smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features N#Cc1cc([N+](=O)[O-])ccc1Oc1ccc2c(-c3ccccc3)cc(=O)oc2c1 7983163 NJYCBMJQWBAOAZ-UHFFFAOYSA-N 384.347 5.032 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C#N)ccc1OC(C)C 65473361 XVJHZPGSGYEKSU-UHFFFAOYSA-N 377.897 5.114 30 20 GKED C[C@@H](NC(=O)NCCC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 106116375 SZNWYSMOEXOIGR-LJQANCHMSA-N 383.495 5.141 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1cc(F)ccc1F)c1ccccc1)c1ccccn1 106983680 HRORRMVBVLYFLU-IIBYNOLFSA-N 380.419 5.070 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1cccc(Cl)c1 108148015 ZEQDTEOGXKGHKB-CYBMUJFWSA-N 376.934 5.323 30 20 GKED Cc1cc(Cl)ncc1NC(=O)c1ccccc1Sc1ccccc1C#N 135936179 LJZMEAMQRLYOCY-UHFFFAOYSA-N 379.872 5.319 30 20 GKED C=C(C)COc1cc(CNCc2ccnc(Oc3ccccc3)c2)ccc1OC 142890484 VHWCOMYSOZXWPD-UHFFFAOYSA-N 390.483 5.127 30 20 GKED Cc1nc(NC(=O)CCCCCO[C@@H]2CCC[C@H](C)C2)sc1SCC#N 159619520 WHEBHAQBCYWMKO-GOEBONIOSA-N 395.594 5.161 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)c1ccccn1 173950936 ZSUILKRFTHYAFJ-ZDUSSCGKSA-N 384.222 5.066 30 20 GKED COc1cccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 175946565 UEXLTYZAXNOPMC-DNVCBOLYSA-N 376.481 5.189 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1nc(-c2ccccc2)cs1 184538717 NJQKVQOECXGXNS-CYBMUJFWSA-N 398.329 5.295 30 20 GKED CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 185351416 YUIOHKRQBCTXTH-NVXWUHKLSA-N 397.500 5.196 30 20 GKED O=C1CC[C@H](C(O)=Nc2ccc3c(c2)OC2(CCCCC2)O3)c2ccccc21 328806289 LCVOWCHOHDRGIR-SFHVURJKSA-N 377.440 5.467 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1CNC)c1ccc(C(F)(F)F)cc1 415913883 SAQDUJRVAMFHMM-GOSISDBHSA-N 391.437 5.254 30 20 GKED Cc1c(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)sc2ccc(C#N)cc12 429863663 XOQIYVNQCCNSBK-INIZCTEOSA-N 388.414 5.505 30 20 GKED C=CCC[C@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)c1ccccc1 435277113 IRXXLXSNZIRANR-FQEVSTJZSA-N 396.437 5.376 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCc1cc(C#N)ccc1F 438189532 TYEOGYRGLTYUPW-UHFFFAOYSA-N 397.519 5.752 30 20 GKED COc1cccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 438660623 JXZWJRGVFJVONX-UHFFFAOYSA-N 377.375 5.142 30 20 GKED Cc1sc([C@H](C)NCCCCC(C)(C)C#N)nc1-c1ccc(Cl)cc1 444684509 KIPWXJAVXCMMFK-AWEZNQCLSA-N 375.969 6.143 30 20 GKED CC1(C)CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C[C@H]1c1ccccc1 458804819 SZSIBEOGDYOBPF-FCHUYYIVSA-N 375.516 5.257 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458853569 WRNIYUSSOZZHMG-FCHUYYIVSA-N 379.504 5.223 30 20 GKED Cc1ccc(CNc2cc(C#N)c([N+](=O)[O-])c(NCc3ccc(C)s3)c2)s1 462791957 UFWHYVVAODFRSL-UHFFFAOYSA-N 398.513 5.431 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(COCC)cc1 464976905 BEHINSCFAOHJLV-UHFFFAOYSA-N 379.378 5.059 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@H]1CCOc2ccc(OC)cc21 466424463 FMVXIBWTBIBNQY-AVRDEDQJSA-N 379.500 5.150 30 20 GKED CO[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 471252711 WWCRWGKSFJUWGF-OAQYLSRUSA-N 399.878 5.037 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(F)(F)F)c1C 473827842 VTBVJJKAOXLZRM-UHFFFAOYSA-N 393.365 5.142 30 20 GKED C=CCCC1(C(=O)Nc2ccc(Cl)c(C(=O)NCc3cccs3)c2)CC1 476291910 WYTKZCWNUWIVJL-UHFFFAOYSA-N 388.920 5.016 30 20 GKED N#CC[C@@H](CC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1)c1ccccc1 476463976 WISWISPESYZKSG-AHWVRZQESA-N 394.518 5.443 30 20 GKED Cc1cc(Br)c(NC(=O)C[C@H](CC#N)c2ccccc2)cc1Cl 476714170 HPDYBOIBUISPEX-AWEZNQCLSA-N 391.696 5.437 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)s1 477662932 GXZUTQXQRCGKTJ-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2sc(C3CC3)nc2-c2ccccc2)cc1 480112390 DRMMOZSZSZCYMH-UHFFFAOYSA-N 387.508 5.741 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nc(-c4cccnc4)cs3)c2)cc1 482237170 GAJSFXVXJXXOLC-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccnc(C#N)c2)cc1 483109350 JXNUGJKMUMMDRO-UHFFFAOYSA-N 393.830 5.050 30 20 GKED COc1ccc([C@H](NCc2cc(C#N)ccc2F)c2ccccc2Cl)cc1 494020074 KXLIVMIATMYHOO-QFIPXVFZSA-N 380.850 5.239 30 20 GKED C=CCN(C(=O)Cc1ccccc1OC(C)C)c1nc(-c2ccccc2)cs1 499311202 WFHXDHCYYTVTBQ-UHFFFAOYSA-N 392.524 5.359 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2Nc2c(F)cccc2F)c(F)c1 499346951 HLVJSENWIWTMNV-UHFFFAOYSA-N 385.320 5.111 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(F)ccc2s1)c1c(Cl)cccc1Cl 499812283 NANZOJCIUYFUJQ-CYBMUJFWSA-N 379.243 5.342 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(COc3cccc(F)c3)c2)c1 505313690 ICUNRKJSBSUWBJ-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#CC1(c2ccccc2)CCC(NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)CC1 507661265 SRVMICXXMCJVSY-KUTWWHHOSA-N 399.582 5.176 30 20 GKED CC[C@H](SCCCC1(C#N)CCOCC1)c1ccc(Br)cc1 508585063 CBZLDAVKMNSCRU-KRWDZBQOSA-N 382.367 5.734 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nnc(-c2ccccc2)o1 510185485 MOILSTXCADUVSM-HNNXBMFYSA-N 384.464 5.524 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1nnc(-c2cc(C)c(CC)s2)o1 512522844 ZWPROPZALJDUQW-UHFFFAOYSA-N 399.564 5.025 30 20 GKED COc1cccc(C2=CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)c1 513418080 IDVRACPAYLSVHQ-UHFFFAOYSA-N 394.474 5.163 30 20 GKED CNc1snc(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 515978136 CZWAQYNLJPEZJD-UHFFFAOYSA-N 398.875 5.063 30 20 GKED CSc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1NC(C)=O 518239561 GVXBRKIWUOUJCF-CYBMUJFWSA-N 399.541 5.013 30 20 GKED N#Cc1cccc(-c2nnc(COc3c(Cl)cc(Cl)c4cccnc34)o2)c1 519034723 AZXPKTWMXLJIDH-UHFFFAOYSA-N 397.221 5.042 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@H]3C(F)(F)F)cc2)cc1 520558885 UUBVAYMQLOSLMC-RBUKOAKNSA-N 388.389 5.658 30 20 GKED Cn1c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c(Cl)c2ccccc21 521768935 KQEFIVBXMMOTBR-ZDUSSCGKSA-N 392.673 5.133 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nc2sccc2c1=O 522863442 KXGMCXQMDITVPO-CYBMUJFWSA-N 395.509 5.152 30 20 GKED C=C(C)[C@@H](CC(=O)N(CC)[C@H](c1ccc(Cl)cc1)c1cccnc1)OCC 533710405 NWCBBKISBLZSKR-IFMALSPDSA-N 386.923 5.044 30 20 GKED Cc1ccc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c(Br)c1 535097692 YLAGAUMAGGNAND-HNNXBMFYSA-N 398.087 5.059 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N[C@@H](C)c3ccc(C#N)cc3)cc2)cc1 535510432 KJDUCJHSXNDNBW-INIZCTEOSA-N 384.435 5.044 30 20 GKED Cc1cc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2ccccc2Cl)ccc1F 541965678 PBTYUSBUWYLORK-OAQYLSRUSA-N 399.897 5.212 30 20 GKED N#CCCC[C@H](Nc1ncnc2cc(F)c(Br)cc12)c1ccccc1 574137522 CTMSOQCFHXPZAO-KRWDZBQOSA-N 399.267 5.378 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC(C)(C)CCC#N 582566119 FSZMHLYNJOIYQI-UHFFFAOYSA-N 380.275 5.017 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3OC(C)C)n2)cc1 592360733 ABMPTQAKJWDXDH-GOSISDBHSA-N 392.480 5.096 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1ccc(Cl)c(Cl)c1)c1ccccc1 595768359 ZENSUBBQCQFLQU-GOSISDBHSA-N 376.287 5.228 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 607803195 USMDMMHDMRRPLF-HNNXBMFYSA-N 377.406 5.032 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N(C)c3ccc(C#N)cc3F)s2)c(C)c1 609216797 PECXPNNZTXFERK-UHFFFAOYSA-N 379.460 5.023 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1 609378222 WHYHCUVMEOJYFK-KRWDZBQOSA-N 388.492 5.983 30 20 GKED CC(C)n1c(S[C@H](C#N)C2CCCCC2)nc2cc(Cl)ccc2c1=O 609648759 XFYDWBYXFLCHBM-QGZVFWFLSA-N 375.925 5.195 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 610755229 VPYGVYRUHIPSCN-NEPJUHHUSA-N 387.270 5.327 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Br)cc2F)c(Cl)c1 611093176 ITHSQBQEMIVASR-UHFFFAOYSA-N 388.023 5.019 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 611207069 QCJPPYQAQUDACN-UHFFFAOYSA-N 381.457 5.062 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC(c3cccnc3)CC2)cc1 611256096 LCCZDJWCYWQGPR-UHFFFAOYSA-N 397.478 5.074 30 20 GKED Cc1c(C#N)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)n(-c2ccccc2)c1C 619516944 CQLRZIIYRXEKAP-UHFFFAOYSA-N 382.467 5.019 30 20 GKED CCN(CC1CC1)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646436681 VJUAERYRJIZQKA-UHFFFAOYSA-N 386.311 5.240 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2)n1 657528486 BYKZBEWNCAFXQU-WIYYLYMNSA-N 383.561 5.361 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2ccc(OC)c(NC(=O)C3CCCCC3)c2)C1 666083655 FOAWMOOJAWHJTL-QGZVFWFLSA-N 399.535 5.034 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)c(Cl)c1 676036805 CHJVRITZRSJVHN-RKDXNWHRSA-N 391.714 5.118 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)c1 726917642 JMOIJBDUSBBTCY-JOCHJYFZSA-N 378.472 5.008 30 20 GKED Cc1cn2c(/C=C/C(=O)c3sc(-c4ccccc4)nc3C)c(C)nc2s1 727780312 KPFZQMDWJJXBMF-MDZDMXLPSA-N 379.510 5.341 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 727957134 MAHVNDJDRCWRFP-XJKSGUPXSA-N 396.462 5.631 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 730182313 ZCFAARYATTUSGD-UHFFFAOYSA-N 384.410 5.138 30 20 GKED CC(C)(C)c1ccc(SCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730422325 WHWSUGXEXNBYBN-MRXNPFEDSA-N 398.528 5.701 30 20 GKED Fc1ccc(-c2nnc(S)n2N=CC(c2ccccc2)c2ccccc2)cc1 730548771 FXRVIONLIMQZCC-UHFFFAOYSA-N 388.471 5.039 30 20 GKED N#CCOc1ccc(CSc2nnc(-c3ccccc3)c3ccccc23)cc1 731156300 NUMVEECJBBOFBA-UHFFFAOYSA-N 383.476 5.491 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731972793 NPXCAGXNGIBDCX-XZOQPEGZSA-N 386.520 5.851 30 20 GKED CCCCCCCCCC(=O)N1CCC(c2nc(-c3ccncc3)cs2)CC1 732121312 MPSYPIQBSMOZIT-UHFFFAOYSA-N 399.604 6.052 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@@H](C#N)C(=O)Nc3ccccn3)sc2c1 732708096 LXBRXBLQRSPARQ-CQSZACIVSA-N 397.887 5.034 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H]1CCc2ccccc2C1 734060420 WMJKHYPGMSLTSQ-RPBOFIJWSA-N 395.506 5.363 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H]3CCOc4ccccc43)n2)cc1 735594368 YDXYQNDEXVPTOD-HKUYNNGSSA-N 388.492 5.251 30 20 GKED CC(C)[C@@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccn1 736512170 KJYKTVRVCWPOEY-JOCHJYFZSA-N 389.430 5.012 30 20 GKED C[C@H]1/C(=C\c2ccc(O[C@H](C)C#N)cc2)C(=O)c2cccc(Br)c21 742435511 UTDXQWTTYQBMQV-ZMRQWQKBSA-N 382.257 5.123 30 20 GKED CCN(CCc1cccs1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746659617 MGXKZLMELBDMRT-QFIPXVFZSA-N 389.524 5.500 30 20 GKED COc1ccc(/C=C(\Cl)c2nc3ccccc3s2)cc1OCCCC#N 747361177 FBCUXVVIIREKPV-QINSGFPZSA-N 384.888 5.724 30 20 GKED CC(C)[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccccn1 748321086 DPUIECQTKYQVFJ-QFIPXVFZSA-N 387.508 5.232 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 756517084 LYSUPHJDZMUENM-IFCKCIONSA-N 378.884 5.743 30 20 GKED CCCCn1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1CC 758036043 XJHQRYHCYKTRGR-NRFANRHFSA-N 386.499 5.153 30 20 GKED C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760366172 UTBLMERAXFDHEC-WZONZLPQSA-N 376.500 5.408 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)[C@H](C)c1ccccc1C(F)(F)F 766484933 BWXZBBHZLWCZJO-PMPSAXMXSA-N 376.422 5.278 30 20 GKED C=CCN(C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C)C(C)C 767944053 SVNCBVVUKCFKTC-UHFFFAOYSA-N 385.895 5.329 30 20 GKED CCCCCCCOc1ccc([C@@H](C)N[C@H]2CCOC3(CCOCC3)C2)cc1 773077565 FCMULJFWWURVQB-IRLDBZIGSA-N 389.580 5.415 30 20 GKED COc1cccc(NC(=S)Nc2ccc(Oc3ccccc3)c(C#N)c2)c1 777476337 JQJOSJQSHBVATE-UHFFFAOYSA-N 375.453 5.168 30 20 GKED C#CCCCCCC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 779845176 MTMWHFLOGSSONQ-UHFFFAOYSA-N 392.377 5.073 30 20 GKED CCCc1c(NC(=S)Nc2ccc(Cl)cc2)cnn1-c1cccc(C#N)c1 783952781 RMHLFFSABIRKBU-UHFFFAOYSA-N 395.919 5.159 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1cnn(C(C)C)c1C 787187069 MMTSIJFUXYLWAV-KHPPLWFESA-N 396.922 5.184 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nnc(-c2ccccc2F)s1 795987353 CFYTVPBAYLQSHF-ZBFHGGJFSA-N 395.459 5.036 30 20 GKED N#Cc1cc(F)ccc1CN[C@H](c1c[nH]c2ccccc12)C(Cl)(Cl)Cl 796470905 NCZDSDFZZLNTMA-QGZVFWFLSA-N 396.680 5.380 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 798813938 BLRHZUYTJNGHOD-SJCJKPOMSA-N 398.384 5.190 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 800385614 CLXQFIGLXHENRO-QWRGUYRKSA-N 382.382 5.090 30 20 GKED Cc1ccc(CC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(Cl)n1 807219641 DIAHYFOHQBFHBQ-MRXNPFEDSA-N 389.886 5.002 30 20 GKED CC(C)N(C)c1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1F 814601721 PMYAQDDYFISAJY-HXUWFJFHSA-N 382.483 5.227 30 20 GKED C=CCC(F)(F)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 815863673 WBNLCBOOELBGOP-UHFFFAOYSA-N 389.789 5.225 30 20 GKED Fc1cc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c(F)cn1 843419861 UXIBQLXWXJRUPF-UHFFFAOYSA-N 388.233 5.261 30 20 GKED N#Cc1ccc(C2(NCc3nc4ccc(Br)cc4s3)CCC2)cc1 848567055 AMVXDXKJVXMODW-UHFFFAOYSA-N 398.329 5.099 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 916128466 FLISZPWGEQRNNK-KAMYIIQDSA-N 385.467 5.149 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(OC(F)F)cc3)cs2)c1 916137711 MPZQMEIJMATAIY-YFHOEESVSA-N 387.407 5.316 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2cc1C(C)C 916848579 DTADNBVYQMEGRT-NRFANRHFSA-N 382.463 5.832 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CC12CC3CC(CC(C3)C1)C2 916901111 YVGVDMKQDGEASN-HJFDCUHHSA-N 392.543 5.065 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3[nH]c(C)c(C)c3c2)cc1 916947007 CSFPDTNDJVVIAJ-QKKBWIMNSA-N 387.483 5.259 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2)CCC1)c1nc(-c2ccc(Cl)cc2)cs1 916975430 CLJPDNKDSUUQHH-GOSISDBHSA-N 392.911 5.762 30 20 GKED COc1cccc2c1OC/C(=C\c1csc(-c3ccc(Cl)cc3)n1)C2=O 920067321 VLBNKOWPWDGLQT-UKTHLTGXSA-N 383.856 5.131 30 20 GKED CC(C)CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(C(F)(F)F)c1 1776033427 FGAWDRUOSZLSKR-UHFFFAOYSA-N 398.812 5.919 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN([C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)C1 1776154014 RCEJVWORRRDVRS-QVKFZJNVSA-N 388.895 5.107 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C/C(=O)c1cccc(OCC(=O)O)c1 1776365048 NGCHZKUCVICTSV-MDZDMXLPSA-N 390.888 5.200 30 20 GKED CCCCCCCOc1ccc(CNC[C@]2(C(=O)O)CC3CCC2CC3)cc1 1776786218 AYKMAVFCFUDDCZ-NFDBJIOVSA-N 387.564 5.407 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)oc2ccccc12 1776956189 JLGDIRCPSZUIIA-SSZFMOIBSA-N 396.442 6.257 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccccc3F)n2CC(C)C)cc1 27122832 PLANMBKVGORGQY-SFHVURJKSA-N 394.519 5.276 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(C(F)(F)F)cc1 30114599 XMCCPSGZLRJEKM-HNNXBMFYSA-N 394.396 5.735 30 20 GKED COc1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1O 33498575 VIBMLTDBHZBHHT-GHRIWEEISA-N 387.460 5.434 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SCc1cscn1)c1nc2ccccc2o1 41541027 GYLQXIWXZGXHFX-HNNXBMFYSA-N 391.477 5.067 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cccc(C)c2)cs1 54897082 VWPJMECFNPSMMV-FLIBITNWSA-N 380.444 5.171 30 20 GKED Cc1ccc(-c2ccsc2C(=O)Nc2cccc(OCCCC#N)c2)cc1 59771239 XLHGBUQEPMMOIF-UHFFFAOYSA-N 376.481 5.658 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2ccc(C#N)c(F)c2)cs1 66748883 FHBXXTTVECKUOM-UHFFFAOYSA-N 395.459 5.034 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66954809 NHNJVKHAMZEVJQ-KGLIPLIRSA-N 389.471 5.584 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccncc1 66955762 FWUQOQYPBLXFMT-YLJYHZDGSA-N 394.544 5.625 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cccc(Oc3ccccc3)c2)cc1 105672665 QGGYNQNXYLQMKP-UHFFFAOYSA-N 387.439 5.039 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(F)c(F)c1 108409214 RULHOOCOQFVVGL-ZDUSSCGKSA-N 392.496 5.231 30 20 GKED CCOc1cccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108533239 JRARTEGVHKIAMS-HOTGVXAUSA-N 383.517 5.220 30 20 GKED CCN(C(=O)c1ccc(-c2ccccc2Cl)o1)[C@@H](C)c1ccc(C#N)cc1 116840845 JDBJYZUAYKEKSJ-HNNXBMFYSA-N 378.859 5.695 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCC2CCOCC2)cc1Cl 173515593 ZYGJJHMBTBVXAY-HXUWFJFHSA-N 382.891 5.141 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(NC(=O)c3cccs3)cc2)n1 177742830 PAQREHOHZBIITG-OAHLLOKOSA-N 395.509 5.070 30 20 GKED CCOc1ccc(NC(=O)Nc2ccccc2O[C@H](C)C#N)c(C(F)(F)F)c1 183825681 QRJJLHXFKVIGSB-GFCCVEGCSA-N 393.365 5.039 30 20 GKED Cc1nc(-c2ccc(CCNCc3cccc(OCCCC#N)c3)s2)cs1 237804722 VTTOUHAFHOAYCX-UHFFFAOYSA-N 397.569 5.195 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C(C)(C)c1csc(-c2cccs2)n1 283472118 JTCIFKLVXLWGIN-CYBMUJFWSA-N 397.525 5.079 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc([N+](=O)[O-])c(C#N)c1 302179935 QDGSCUXYRMQKBC-NSHDSACASA-N 382.420 5.211 30 20 GKED Cc1cc(Br)cc2cc(/C(O)=N/[C@@H]3CCCC34CCOCC4)oc12 328641614 FQYBZDLDTFPYIV-MRXNPFEDSA-N 392.293 5.158 30 20 GKED CSCC[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1nnc2ccccn12 328985179 GKQAHUNCMUELKZ-FJIDUMEYSA-N 386.565 5.087 30 20 GKED O/C(COc1ccc(F)cc1Cl)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329259940 AMAPWOGZOHIQIM-QGZVFWFLSA-N 391.874 5.204 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2c(F)cc(Br)cc2F)s1 411008146 RUZRQJCRMGJJLN-UHFFFAOYSA-N 399.260 5.210 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1-c1ncc2n1CCCC2)c1ccccc1 425676743 SZJWDEPICGQGJR-OAQYLSRUSA-N 399.498 5.053 30 20 GKED N#CCSc1cccc(C(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)c1 429829896 QWQMHKPBDKQBKG-HSZRJFAPSA-N 384.504 5.090 30 20 GKED Cc1cc(Br)cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 430597800 AWVQEWPRLBUGTJ-CYBMUJFWSA-N 377.307 5.002 30 20 GKED CC1(C)C[C@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)c2ccc(F)cc2O1 431289556 GSTHUNIBRZGIOR-UXHICEINSA-N 395.478 5.162 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1cccc(OCc2ccccc2)c1 433957530 JOUUWAIKASAWJR-LJQANCHMSA-N 399.494 5.040 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 438417282 DYOFYMTUKWCRMX-XUTJKUGGSA-N 381.907 5.078 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3[C@H]4CCC[C@H]3CC4)cc2Cl)cc1 438595278 IEOFALUTKLQMPL-IRXDYDNUSA-N 381.863 5.553 30 20 GKED Cc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c(C)c1O 439293882 DICDRFRDIJENAT-UHFFFAOYSA-N 392.842 5.579 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccc(F)cc2F)cc1F 440746903 KPXOQHKRIAAAGN-UHFFFAOYSA-N 383.329 5.412 30 20 GKED C[C@@H](c1cccc(C#N)c1)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 463050139 AWQGOJLIVJSSCL-ZBEGNZNMSA-N 375.325 5.171 30 20 GKED C=C(C)CN1CCC(NC(=O)N(C)[C@@H](C)c2ccc(-c3ccccc3)cc2)CC1 465860632 FTZQLFFXWKTPOR-FQEVSTJZSA-N 391.559 5.097 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n(C)n1 471260727 RMDBLFXBXOHYPQ-UHFFFAOYSA-N 394.862 5.113 30 20 GKED COc1ccc2c(c1)[C@@H](N(CCCC(C)(C)C#N)Cc1ccccc1)CCO2 472235061 UXYCFZLZZYKYPV-QFIPXVFZSA-N 378.516 5.351 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@H]1CCC[C@H](C(F)(F)F)C1 473242634 RTEACPRBSKKKKT-UWVGGRQHSA-N 386.311 5.107 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@@H]1CCC[C@H](C(F)(F)F)C1 473242639 RTEACPRBSKKKKT-ZJUUUORDSA-N 386.311 5.107 30 20 GKED CC(C)c1cccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)n1 474244143 HBBLFYYQCASLHV-UHFFFAOYSA-N 385.467 5.102 30 20 GKED CC[C@H](CC#N)NC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 475010846 ZCLOCJYKHASFJC-CYBMUJFWSA-N 377.366 5.311 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(SC)c(Cl)cc1Cl 476100248 QUDINLJSDZOVSZ-UHFFFAOYSA-N 394.367 6.820 30 20 GKED N#Cc1ccc(NC(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)c(Cl)c1 478071790 OLPFKPQKXCOUQQ-LJQANCHMSA-N 389.833 5.305 30 20 GKED CCc1cccc(C)c1NC(=O)COc1ccc(Oc2ccc(C#N)cc2)cc1 480336082 PKHAYXJKWZUDEO-UHFFFAOYSA-N 386.451 5.239 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(CC1CC1)CC1CC1 480660990 QQMVOMWINSUOBT-UHFFFAOYSA-N 389.499 5.100 30 20 GKED Cc1cc(C)n(Cc2cccc(-c3noc(-c4ccc(C(C)(C)C#N)cc4)n3)c2)n1 481929253 CLWCJECVJYWURP-UHFFFAOYSA-N 397.482 5.066 30 20 GKED CC[C@@H](C)n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C 482556335 JRCDVKRCADZULW-RHSMWYFYSA-N 378.501 5.085 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccccc2)cc1)c1nccc2ccccc12 483201383 PGNNVMZMDZEWCD-QHCPKHFHSA-N 378.431 5.304 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(Cl)c1OCC(F)F)c1ccccc1 497537473 SGTUYQKKEKYKBY-HNNXBMFYSA-N 393.821 5.150 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)CCc2c(C)nn(CCC#N)c2C)c(C)c1 499786593 PLQBSUYQVHSKJM-MRXNPFEDSA-N 398.576 5.184 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccc(Cl)cc1 499835454 DDLXWYBLUYKVPM-IBGZPJMESA-N 382.822 5.053 30 20 GKED CN(Cc1ccccc1C(F)(F)F)Cc1cn(CCC#N)nc1-c1ccccc1 506377794 BDCPXSBGCKKMRQ-UHFFFAOYSA-N 398.432 5.115 30 20 GKED CCOc1ccc([C@H]2CCCN2Cc2ccc(OC)c(OCCCC#N)c2)cc1 506718631 JHOKGFUUDUIOJO-JOCHJYFZSA-N 394.515 5.114 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](C)c1ccc(C#N)cc1 509228576 SUKKCOZKEHLFKL-HNNXBMFYSA-N 389.421 5.258 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)C[C@H](C)C2 509230236 REJNGZKQGGTYNY-ONZPZFSWSA-N 395.506 5.343 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cccc(C#N)c2C)c(C(F)(F)F)c1 509862287 WNNZHKSIIDSARS-LBPRGKRZSA-N 392.446 6.028 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N(C[C@@H](C)C#N)C2CC2)cc1 513661895 WUHFRRYBOSNLME-INIZCTEOSA-N 379.460 5.034 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)n1 514360300 GAXBNAVTPQDOHF-IRXDYDNUSA-N 389.524 5.081 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N(Cc1ccccc1)C(C)(C)C 518263105 RTZLFIVCTPKCPW-SFHVURJKSA-N 395.572 5.320 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)cc1 518493991 YERDKFLAGYCBEF-NRFANRHFSA-N 392.911 5.878 30 20 GKED Cc1nc(COC(C)(C)C)oc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 521254113 JIUZNQSJWUQYCI-UHFFFAOYSA-N 395.484 5.151 30 20 GKED Cc1cccc([C@@H](C)NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1C 522464286 NIBVNFGEAAUIMB-MRXNPFEDSA-N 390.512 5.105 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](COCC(C)C)c1ccco1 523193007 TUSFNWVFFUGSGY-MRXNPFEDSA-N 396.940 5.106 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC2(c3cccc(F)c3)CC2)cc1 525346688 PQAVRTISFQVOFG-UHFFFAOYSA-N 387.414 5.300 30 20 GKED Cc1ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1-c1ncco1 532745094 VWZYDEGHJYMAJQ-UHFFFAOYSA-N 395.462 5.713 30 20 GKED C=C[C@H](CC(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 533915427 RSNDZKCSFFXKLZ-LJQANCHMSA-N 384.479 5.546 30 20 GKED CCN(C(=O)c1ccc(CC#N)cc1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 534685905 NNXRLYJOULZVCV-RUZDIDTESA-N 397.522 5.523 30 20 GKED COc1ccc([C@H](NCCCC2(C#N)CCOCC2)c2ccccc2Cl)cc1 538610099 OQPACSRHNHZQBP-QFIPXVFZSA-N 398.934 5.128 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCc1cc(Cl)sc1Cl 539966846 DVCLZGRMHYUZNS-UHFFFAOYSA-N 382.316 5.048 30 20 GKED N#Cc1ccc(CN(C(=O)c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 543224629 BHDYEQUMKPVYEE-UHFFFAOYSA-N 378.781 5.035 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)c1ccccc1-c1ccccc1C#N 543491122 SQABZXAAGHSNRI-UHFFFAOYSA-N 398.506 6.183 30 20 GKED CC[C@@H](CC#N)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 546585877 VERFSIKEDVPYLN-FCFCDCELSA-N 387.508 5.205 30 20 GKED C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](OC(F)F)C1 549414358 RISHJAZNWXIKDD-UFBFGSQYSA-N 377.275 5.099 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1ncc(C#N)cc1Cl 559187445 LIOGEEQLFSJAHO-UHFFFAOYSA-N 394.862 5.195 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccc(Cl)cc2)CC1 567934670 GZKMVVIQTCJEIT-OAHLLOKOSA-N 399.947 5.445 30 20 GKED N#CCCCn1cc(-c2nc(CSc3ccc(F)cc3)no2)c2ccccc21 573642905 VHVOETLRKCXNHN-UHFFFAOYSA-N 392.459 5.426 30 20 GKED N#C[C@@H](C(=O)c1cnn(C2CCCC2)c1-c1ccccc1)c1nc2ccccc2o1 580062263 YARVHRALRBUFJA-SFHVURJKSA-N 396.450 5.296 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)NCc3cccc4ccccc34)cc2)ccn1 582151554 FXPJUQYBPJXTSL-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C=CCCC(=O)N(Cc1ccc(Br)cc1)c1ccc(F)cc1F 588031236 YLMFEUWNEQVFGE-UHFFFAOYSA-N 380.232 5.227 30 20 GKED N#CC1(CC(=O)Nc2c(Oc3ccc(Cl)cc3)ccc3ncccc23)CC1 590320105 LNALUMLDCQQKBH-UHFFFAOYSA-N 377.831 5.313 30 20 GKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4Cl)o3)CCOCC2)c1 594984696 RDXZQLJVZWPTEL-UHFFFAOYSA-N 392.886 5.267 30 20 GKED N#CC[C@H]1CCCN(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 596534724 QLHQEFJIHMDMBX-PXAZEXFGSA-N 399.844 5.145 30 20 GKED CSCc1c(C(=O)Nc2sc3c(c2C#N)CCCC3)oc2ccccc12 600841210 LAMBZTVJHBCMAL-UHFFFAOYSA-N 382.510 5.360 30 20 GKED Cc1ccccc1NCCC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609072389 KHTNVDHRIGOUTH-UHFFFAOYSA-N 399.494 5.195 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 609191859 YHYOMRJEZRYBHO-UHFFFAOYSA-N 396.343 5.519 30 20 GKED CSCc1cccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c1 609644427 WMAKKIACCZFTKW-UHFFFAOYSA-N 388.492 5.253 30 20 GKED C[C@@]1(c2ccccc2)C[C@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 610190114 DWMMLRWFZDHDMO-VWNXMTODSA-N 384.504 5.169 30 20 GKED C[C@H](NC(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1)c1cccc(C#N)c1 610361619 CWFGXYKGLSWWST-ZYSHUDEJSA-N 387.508 5.095 30 20 GKED C[C@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1cccc(C#N)c1 610407064 PYYDXHVBHJNTBT-HNNXBMFYSA-N 383.442 5.052 30 20 GKED Cc1noc(C(F)F)c1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 610432230 ZSZWGVZWNRVXHZ-SNVBAGLBSA-N 393.459 5.257 30 20 GKED Cc1nc(COc2ccccc2C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cs1 613291086 SZPPFWDUWYTBHU-IBGZPJMESA-N 399.475 5.069 30 20 GKED O=C(NCC(F)(F)C(F)F)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 622553708 WPECPHCSTBFKLV-UHFFFAOYSA-N 397.265 5.142 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)s2)o1 679762790 QDWBVQSJPBSLTB-GFCCVEGCSA-N 382.441 5.555 30 20 GKED Cc1cccc2sc(C(=O)[C@H](C#N)c3cnc4ccccc4n3)c(Cl)c12 682993808 BEUMLPQEKARGOU-GFCCVEGCSA-N 377.856 5.296 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3ccccc3F)n2)cc1 726857855 BAKFLHZUQHWKQQ-CRAIPNDOSA-N 378.472 5.628 30 20 GKED CCN(c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1)C(C)C 727222974 MACDVBHZYRSMJZ-UHFFFAOYSA-N 378.520 5.235 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 727589471 VDJVBRYPQWMVDA-VWLOTQADSA-N 395.506 5.847 30 20 GKED C[C@H](NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 727980482 NEAACXQTFVQHMD-KRWDZBQOSA-N 387.508 5.185 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1csc2ccccc12 730028766 AOTABWXXHHKMAN-KRWDZBQOSA-N 391.540 5.702 30 20 GKED CC(C)(C)OC(=O)NC1CCC(=NNc2ccnc3cc(Cl)ccc23)CC1 731923598 UILJXEMQFBESOJ-UHFFFAOYSA-N 388.899 5.123 30 20 GKED CC(C)c1nc(C#N)c(NN=C2CCCc3nc(-c4ccccc4F)sc32)o1 731926765 QHWVNAGUKYSGGU-UHFFFAOYSA-N 395.463 5.085 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 734060220 SARNUFWJDPHNRS-HXUWFJFHSA-N 389.524 5.503 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3c(F)cccc3F)o2)cc1NC(C)=O 734368638 VYGMKACGEJMSHX-VQHVLOKHSA-N 397.377 5.088 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@@H](C#N)C3CCCCC3)c2c1 734508625 JVOGRUPPYHKNKQ-QHCPKHFHSA-N 385.467 5.235 30 20 GKED O=[S@@](Cc1ccccc1)Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1 734752924 LKAILQYPCIVVMN-LJAQVGFWSA-N 399.515 5.745 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N2CCCCC[C@H]2c2ccco2)cc1OC 736526337 NZXBNPVMJVNNIN-QXFGJRORSA-N 381.472 5.010 30 20 GKED N#CCCCOc1cccc(/C=C2\Cc3ccc(OC(F)(F)F)cc3C2=O)c1 737451255 XRLVNODBRVFONR-MHWRWJLKSA-N 387.357 5.090 30 20 GKED Cc1ccc(-c2n[nH]cc2CNCc2cccc(-c3ccc(C#N)s3)c2)cc1 740014665 USBNEFKQRMGOTO-UHFFFAOYSA-N 384.508 5.275 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc3c(c2)COC3)cc1OCc1ccccc1 742433902 AQVKJIOHYPQTDH-XFFZJAGNSA-N 386.447 5.201 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1 743612910 YZPQCAXICPLJEX-NFBKMPQASA-N 391.515 5.031 30 20 GKED CCC[C@H](CC1CCCCC1)C(=O)OCc1nnc(-c2cccc(C#N)c2)o1 745025808 DGHHPDOXFTWRQC-LJQANCHMSA-N 381.476 5.038 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2cccc3ccccc23)cs1 747060157 KBCKCQAURFZSFQ-UHFFFAOYSA-N 386.480 5.427 30 20 GKED CC[C@@H](Oc1ccccc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748294548 GEWCNGIVYQYQDB-RBBKRZOGSA-N 388.442 5.277 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)O[C@@H](C)c3ccc(C#N)cc3)c12 748685408 PZLJQMODBIJSGO-ZDUSSCGKSA-N 375.428 5.013 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2ccc(Cl)nc2)CC3)cc1 748998753 SGBFEDXMFANQSD-GXDHUFHOSA-N 382.872 5.080 30 20 GKED C#CC[C@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccccc1 757764078 XHERTXFXKNSKGY-QFIPXVFZSA-N 376.500 5.001 30 20 GKED C=CC[C@H](NC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1)c1ccncc1 761704092 ZSBFIKUKYMXFLB-DQEYMECFSA-N 397.522 5.251 30 20 GKED C=CCn1c(SCc2nc(Cl)ccc2Cl)nnc1-c1ccc(F)cc1 762470770 WOCDFYHRUBBXAT-UHFFFAOYSA-N 395.290 5.264 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C(F)(F)F)o1 769863308 SUNPYXOOQINLCE-GOSISDBHSA-N 384.357 5.515 30 20 GKED Cc1nc2c(s1)[C@@H](NCc1cccc(OCc3ccccc3C#N)c1)CCC2 779987783 GOHNWNVYPVCKHO-NRFANRHFSA-N 389.524 5.069 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 780577147 OTNMSTUGKUEHCF-KRWDZBQOSA-N 387.439 5.722 30 20 GKED CC(C)(C)n1cc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)nn1 790210146 JHOZGUGTZMGPBO-GHRIWEEISA-N 388.496 5.066 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)C[C@@H]2CCC(F)(F)C2)c1 798213131 MVOAZFQDBRBAEQ-INIZCTEOSA-N 388.845 5.570 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2ccc(C(F)(F)F)s2)C(=O)c2ccccc21 802707038 CVNHFQQJSYCKGD-KLQCNHIUSA-N 380.387 5.084 30 20 GKED N#Cc1csc(CN[C@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)n1 810152763 AWPROHWDGUEIIP-SFHVURJKSA-N 391.393 5.052 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cc2ccccc2o1 812394027 NBFPOKCUAGXHIV-UHFFFAOYSA-N 385.448 5.062 30 20 GKED CCOc1cc(/C=C\C(=O)c2cnn(-c3ccccc3)c2C)ccc1OC(F)F 818253361 SPIQTQCCMHIZHH-LUAWRHEFSA-N 398.409 5.077 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1 824266086 VFYRRNGLEJJBFN-OAHLLOKOSA-N 398.457 5.052 30 20 GKED C[C@]1(C#N)CC[C@@H](OC(=O)Cc2csc(-c3ccc(Cl)s3)n2)CC1 836158857 ZSEABEHUXNNJPA-LAUQKZGBSA-N 380.922 5.083 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCCC2(F)F)cc1 836270576 UQQBGPAIJGWXIZ-UYAOXDASSA-N 383.442 5.289 30 20 GKED C[C@@H](NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl)c1cccc(C#N)c1 863892617 CIMAFCZVJPRFAA-CYBMUJFWSA-N 399.878 5.050 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccccc1Oc1ccccc1Cl 915996860 FNAOZXXDMFPPGI-UHFFFAOYSA-N 379.872 5.813 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCSc2ccc(F)cc2)cc1 916949035 ZYFBRSCLJILQRX-QRWLVFNGSA-N 398.503 5.169 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2)CC1)c1nc2cc(C(F)(F)F)ccc2s1 917043806 OVWICPARQKRXPL-CQSZACIVSA-N 386.398 5.223 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN2CCC[C@@H]2c2ccsc2)c1=S 917455995 YYEYHIBGEAAMFF-LJQANCHMSA-N 396.585 5.432 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2cccc3c2CCCC3)cc1 917552631 LFEOEHKXYSPJGS-UHFFFAOYSA-N 378.520 5.275 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cc2sccc2s1 918486667 KDTZCXSGMXFZAZ-LLVKDONJSA-N 395.292 5.231 30 20 GKED O=C(O)c1cc(NN=Cc2ccccc2-c2ccccc2Cl)ccc1Cl 1776034644 RAZOBMGQJNJCAS-UHFFFAOYSA-N 385.250 5.805 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)c1 1776341448 NVWHGXIQYSEPCL-VQHVLOKHSA-N 387.273 5.242 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1csc(-c2cccs2)n1 1776355256 YROWQGZKSMPPSP-VOTSOKGWSA-N 399.493 5.253 30 20 GKED CCOc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(C)c1 1776925995 TVPULXDPPOIBQJ-PKNBQFBNSA-N 376.408 5.248 30 20 GKED CCc1ccc(-c2ccc(/C=C3\CCCc4cc(C(=O)O)ccc4C3=O)o2)cc1 1776964091 JJEXQDJLQQWZKD-XDJHFCHBSA-N 386.447 5.810 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccc(C(=O)O)c3Cl)s2)cc1 1777430567 DYVYWHGNXLZNCI-ZHACJKMWSA-N 397.883 5.675 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccccc2)cc1)c1ccc(C(F)(F)F)cn1 41553659 PXVXUOFDTSQXTJ-LJQANCHMSA-N 396.368 5.169 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)Cc1csc2ccccc12 65473904 SEFHSDIROPTKDS-UHFFFAOYSA-N 379.485 5.224 30 20 GKED C[C@H](OCC1CC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 68336631 MQYHCHASXFDBJA-IINYFYTJSA-N 395.311 5.108 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCc2ccccc2C1 102796584 WZCGNBMDAXJARC-UHFFFAOYSA-N 397.478 5.036 30 20 GKED N#C[C@H](C(=O)[C@@H](Oc1cccc(Cl)c1Cl)c1ccccc1)c1ccccn1 106983728 NNVGZNYAFHOBPC-BTYIYWSLSA-N 397.261 5.385 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cn2)c(C(F)(F)F)c1 107468164 BYLGOFLYHNBAGL-NSHDSACASA-N 379.407 5.115 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 112128257 JBXCXHLPBADEGH-HZPDHXFCSA-N 377.579 5.078 30 20 GKED COc1ccc(C[C@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1OC 118443300 MRRLKXSPPYVUGK-JPYJTQIMSA-N 386.495 5.210 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1OC1CCC1 118544600 DIOIGRQHKFELHJ-INIZCTEOSA-N 395.528 5.334 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C(C)=O)cc2)cc1)c1ccc(C#N)cc1 126551185 AJEAMUDTAZAGRU-UHFFFAOYSA-N 384.435 5.220 30 20 GKED N#CCCCOc1cccc(CNc2cccc(OCc3cscn3)c2)c1 127333128 KVJKHWYZHQASBH-UHFFFAOYSA-N 379.485 5.017 30 20 GKED C[C@H](SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1cccs1 133963870 LBSFETLEEDADBG-DZGCQCFKSA-N 384.551 5.542 30 20 GKED COc1cc(Oc2ccccc2)ccc1NCc1nnc(-c2ccc(C#N)cc2)o1 163313374 SKJGQIJTSBGXOT-UHFFFAOYSA-N 398.422 5.021 30 20 GKED CC[C@@H](Cc1cccc(Br)c1)C(=O)[C@H](C#N)c1nc2ccccc2o1 172019812 FUWIVJGPWMJBDL-HOCLYGCPSA-N 397.272 5.035 30 20 GKED CC[C@@H](C)CN(CC)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 175240664 XHGFAIBJQAQQQY-GOSISDBHSA-N 379.504 5.232 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc2ccccc2o1 176733153 VBVOMWKSHRVOTL-NSHDSACASA-N 379.268 5.395 30 20 GKED C=CC[C@H](Cc1ccccc1)NC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 416848835 XAEARYHJGYCGQI-PIIWDFAUSA-N 398.572 5.043 30 20 GKED CCOc1ccc(-c2nc(CN3CCC[C@H]3[C@@H](C#N)c3ccccc3)co2)cc1 437575729 AWMJKCUPLXDWAR-GOTSBHOMSA-N 387.483 5.012 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2ccccc2C#N)n(C2CCCCC2)c1C 439694673 OYKHZSLLQWLREF-UHFFFAOYSA-N 392.528 5.084 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)N[C@H](CCC#N)c2ccccc2)cc1 440251948 FFDROUXILSIVNC-PKTZIBPZSA-N 391.515 5.367 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 441534975 RYCVTQVTXFWWKK-PBHICJAKSA-N 380.410 5.708 30 20 GKED N#C[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccccc1F 442750429 ITEDVFNMOJDLPM-INIZCTEOSA-N 388.229 5.122 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)O1 443876933 HQQZKOGFLKBMPL-IERDGZPVSA-N 382.891 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)Cc1cc(Cl)ccc1F 446777137 PUAVUYMRKDDRSF-UHFFFAOYSA-N 381.900 5.273 30 20 GKED COCCN(C(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccc(C#N)cc1 460351670 UMEDRBKUAZGPQY-UHFFFAOYSA-N 390.870 5.172 30 20 GKED Cc1sc(NC(=O)CNc2cccc(Oc3ccc(C#N)cc3)c2)c(C)c1C 462237055 XQSBXHRTQPWELM-UHFFFAOYSA-N 391.496 5.388 30 20 GKED CSc1cc(C)ccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 465252877 KWYBEOPTCUQWSJ-OAHLLOKOSA-N 385.558 5.433 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1F 474270757 VVKCZIMKZKWDAN-AWEZNQCLSA-N 397.265 5.407 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)o2)cc1 474429475 FZOWTADWMVNQGW-INIZCTEOSA-N 378.453 5.219 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccc(C(C)(C)C#N)cc3)cc2)cs1 474701278 LCXCKZJCDVYGIC-OAHLLOKOSA-N 389.524 5.411 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc3nc(-c4ccccc4)oc3c2)c1 474972025 UJYDNFQRLFTRQN-UHFFFAOYSA-N 397.434 5.430 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@H](C)Cc1ccc(OC)cc1 475570204 SBJIDEZVZHDEIA-LJQANCHMSA-N 394.559 5.890 30 20 GKED Cc1ccc(CCN(Cc2ccco2)C(=O)C[C@H](CC#N)c2ccccc2)cc1 476188615 JFDMKDLWGXTGBP-QHCPKHFHSA-N 386.495 5.247 30 20 GKED C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)C[C@H](CC#N)c1ccccc1 476479196 DYOZOOQKHRSCET-ZBFHGGJFSA-N 375.299 5.128 30 20 GKED C[C@H](SCCCC(C)(C)C#N)c1nc(-c2cccc(C(F)(F)F)c2)no1 480362371 IUVWAKFQSGCIOF-LBPRGKRZSA-N 383.439 5.880 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nc(-c4ccccn4)cs3)c2)cc1 482378814 IDCQIZHCUPYLAU-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 483715154 WGTVKZSOEYBNTH-AWEZNQCLSA-N 385.876 5.373 30 20 GKED N#Cc1cc(Cl)cc(OCc2nnc(-c3ccc(Cl)cc3Cl)o2)c1 487371030 KFUIQPXDESVDBW-UHFFFAOYSA-N 380.618 5.147 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 488384537 AUGFZACJOUWPNQ-AZUAARDMSA-N 379.891 5.568 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccccc1C)C1CC1 497463049 DXOXLMNSNNLDKB-JOCHJYFZSA-N 380.536 5.011 30 20 GKED Cc1ccc(C#N)cc1NCc1cccc(NC(=O)c2ccccc2Cl)c1 500975180 QMVDMTREDDAPRN-UHFFFAOYSA-N 375.859 5.385 30 20 GKED CCOc1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)ccc1C 503419987 QFIHICKXNUCPHL-AWEZNQCLSA-N 398.434 5.286 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](Cn1ccnc1)c1ccc(C)cc1C 505035124 JSKNHZFCYRRBRU-QHCPKHFHSA-N 388.515 5.182 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@H](C)c2nc(C(C)C)no2)cc1 507832219 YUJBZAASPCZJOI-CQSZACIVSA-N 378.432 5.039 30 20 GKED COCCC[C@@H](c1ccc(Cl)cc1)c1noc(-c2cccc(CC#N)c2)n1 508645004 ITGQXUREIRRVSP-IBGZPJMESA-N 381.863 5.015 30 20 GKED CCN(C(=O)CCC(=O)c1ccc2c(c1)CCCC2)[C@@H](C)c1ccc(C#N)cc1 509576743 XZELACYYELAXGA-SFHVURJKSA-N 388.511 5.010 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C1CCC(C)CC1 510855833 BLJZBNGUDKWRSZ-UHFFFAOYSA-N 377.488 5.701 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccc(F)cc1 515304581 MPRYKWVKQBZAHN-MRXNPFEDSA-N 395.503 5.251 30 20 GKED N#C[C@H](C(=O)c1ccc(-n2cccc2)cc1)c1nc2cc(Cl)ccc2s1 515539584 ZSYYYSBRHFKHKR-MRXNPFEDSA-N 377.856 5.230 30 20 GKED C=CCn1c(SCc2cc(OC)ccn2)nnc1-c1ccc(C(C)(C)C)cc1 517355953 VWTPSUSHOVQFEC-UHFFFAOYSA-N 394.544 5.125 30 20 GKED CC(C)c1ccc(-c2noc(CNc3ccccc3S[C@@H](C)CC#N)n2)cc1 517534864 HKNJWEXLKXFSRD-INIZCTEOSA-N 392.528 5.866 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc2cc(Cl)ccc2s1 518220434 IHIKSIWTXRGIBM-KRWDZBQOSA-N 396.899 5.761 30 20 GKED COc1ccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 518683389 UIOUKZMQWLDXAW-INIZCTEOSA-N 397.544 5.046 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1 519157386 KUCWRNQTUMXYFW-UHFFFAOYSA-N 399.560 5.389 30 20 GKED Cc1cccc(COc2ccc(NC(=O)CCc3ccc(C#N)cc3)c(C)c2)c1 520638013 UYSZSPPJOYANDM-UHFFFAOYSA-N 384.479 5.325 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1 521935886 JNCHSZWOLBYPLG-FQEVSTJZSA-N 391.858 5.280 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCc1cc(C)cc2c(C)c(C)[nH]c12 522807582 FIOHZLMKZSFKLO-UHFFFAOYSA-N 388.515 5.087 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c[nH]c2c(C)cccc12 524961981 UEGAOVHWWRWSQQ-UHFFFAOYSA-N 395.462 5.630 30 20 GKED CSCC[C@H](C)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 535597739 IEOLMQSKDLKSJT-AWEZNQCLSA-N 388.920 5.218 30 20 GKED N#Cc1cc(/C=C2\CCn3c2nc2scc(-c4ccccc4)c2c3=O)ccc1F 539958032 AJNRAIRJIDAZPD-MHWRWJLKSA-N 399.450 5.080 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)nn1C1CCCCC1 540638980 BKJQYRYMIRWHBW-HNNXBMFYSA-N 382.533 5.201 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CC1CCC(C(F)(F)F)CC1 543101934 NVKNASQBAZWFBX-JDGDGYACSA-N 378.438 5.044 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 543776937 HMXFEZLPGDTTJE-YCRPNKLZSA-N 390.449 6.022 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)N1CCC[C@H]1c1cccs1 543960164 XPCLUPIOQXEROC-WFASDCNBSA-N 376.934 5.117 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(Cc3ccncc3)no2)c1 545595567 IRLPMODMUWQWKA-UHFFFAOYSA-N 388.814 5.040 30 20 GKED Cn1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1C1CCC1 551598072 LSVUJJWICVNGAB-UHFFFAOYSA-N 389.430 5.348 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(Cl)c(F)cc2Cl)cc1 555845151 RMKDHOZZSWOGMY-UHFFFAOYSA-N 381.234 5.092 30 20 GKED N#CC1CCC(CN[C@@H](c2ccc(F)cc2)c2ccc(Br)o2)CC1 556177890 PWOWJCFKLVRBTE-MHVYXZCWSA-N 391.284 5.190 30 20 GKED O=C([C@@H]1CC[C@@H](C(F)(F)F)C1)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 557033609 KYTMZPCQRJUQAX-DJSGYFEHSA-N 397.334 5.081 30 20 GKED C=CCC(CC=C)c1nc(-c2ncoc2-c2cccc(C(F)(F)F)c2)no1 564283366 NDKCQNZGHFUJMI-UHFFFAOYSA-N 375.350 5.646 30 20 GKED Cc1csc(NC(=O)N2CCC[C@H]2c2ccc(Br)s2)c1C#N 565606073 DXEQKHVTXIATNN-NSHDSACASA-N 396.335 5.121 30 20 GKED N#Cc1c(F)cccc1C(=O)N1CCC(c2c(Cl)cccc2Cl)CC1 567904988 WCLLUDCDLFQBLR-UHFFFAOYSA-N 377.246 5.024 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1ccc2c(c1)CCCC2 569024119 DVSMXOLALXICJZ-UHFFFAOYSA-N 397.478 5.114 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N1CCC(CCC#N)CC1 576156819 KVZSTQUBLIFRJD-UHFFFAOYSA-N 378.314 5.120 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)C1 577347823 APUFVVOVTFNGAI-WBAXXEDZSA-N 379.426 5.024 30 20 GKED N#CCCC1CCN(C(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)CC1 578991078 JPPMPWSGRIXGHI-UHFFFAOYSA-N 399.441 5.188 30 20 GKED CC[C@@H](C)c1ccc(C(=O)Cn2cc(C#N)c(=O)c3cc(C)cc(Cl)c32)cc1 580845827 JDMSPIKJXOOHNV-OAHLLOKOSA-N 392.886 5.231 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H]1CCC(F)(F)C1 601059982 MBLGUIUXWMRABG-UONOGXRCSA-N 384.517 5.045 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1C 601184886 VQLYPSRCHCWGLQ-VWLOTQADSA-N 395.506 5.467 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(-c2ccccc2OC)c1 601192924 MYUUMTRLTUAYLP-UHFFFAOYSA-N 378.497 5.644 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2cccc(COc3ccccc3)c2)cc1 604084834 BNUSMWWSNWEXSK-UHFFFAOYSA-N 399.494 5.388 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCS[C@@H](c2ccccc2)C1 609811031 ILLLLEMZKLTPHJ-OXQOHEQNSA-N 397.569 5.260 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609926785 FIRHAYOVTZHGAR-LIRRHRJNSA-N 385.895 5.039 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)c1cccc(C(F)(F)F)c1 609993924 CLIKAZHRGLSXSD-YVEFUNNKSA-N 380.797 5.233 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NC3(c4cccc(F)c4)CC3)cc2)cc1 610052298 CDPSWPAUFGJWRA-UHFFFAOYSA-N 386.426 5.103 30 20 GKED C=CCN(C(=O)[C@@H]1CCC[C@H](C)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610169108 BCKYVJPFYUTWAH-GOEBONIOSA-N 385.489 5.064 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1oc2ccccc2c1CSC 610492417 DPRBSAOSBGNWBH-UHFFFAOYSA-N 379.485 5.242 30 20 GKED CCOc1ccc([C@H](NCc2cc(C#N)cs2)c2cccc(Cl)c2)cc1 611039265 KDFGJMROUDOQRS-NRFANRHFSA-N 382.916 5.551 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(COc3ccc4ccccc4c3)no2)cc1 615132042 XILQPQVMAFPHBC-QFIPXVFZSA-N 396.450 5.015 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 615971635 PIYNCKPWXKFAIR-ZWKOTPCHSA-N 377.381 5.163 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1c(F)ccc(F)c1Cl 622175492 LGGIESGJXUPZHR-UHFFFAOYSA-N 397.693 5.402 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726459062 VKSQIIABUQULKS-SNVBAGLBSA-N 398.746 5.908 30 20 GKED Cc1cccc2c1CC[C@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 729553420 PNTVMVLYRTXMKW-DNQXCXABSA-N 381.479 5.460 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/Cc1cccc(COC2CCOCC2)c1 731937341 JEWZUUKLSGNRNE-FSJBWODESA-N 394.298 5.014 30 20 GKED C[C@@H](/N=C\c1c(O)ccc2ccccc12)c1ccc(NC(=O)c2ccncc2)cc1 733750319 UBPXDDRXYQKBGO-AFSAKMMISA-N 395.462 5.373 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cccc(Oc3ccccc3)c2)c1 733772119 XVFYNVCPIBOTFY-HXUWFJFHSA-N 386.451 5.090 30 20 GKED O=C1/C(=C\c2cccc(F)c2)CC(O)(C(F)(F)F)C/C1=C\c1cccc(F)c1 735792240 AOILMMNYZGEMBL-BSHIDLADSA-N 394.339 5.088 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 739142984 NBXLYTDLPNLXSA-KBXCAEBGSA-N 382.385 5.624 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2[C@H]3CC[C@H]2c2ccccc23)c1=S 739878363 CTYFLNUWURWPTJ-PMACEKPBSA-N 392.503 5.255 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)c2cnc(-c3ccncc3)s2)c1 741557666 WPCBDUKAOZFFPI-UHFFFAOYSA-N 395.487 5.033 30 20 GKED C[C@H](N[C@@H](C)c1csc2ccccc12)C(=O)N(CCC#N)c1ccc(F)cc1 743475150 NYSQOXZBFJHTBN-HOTGVXAUSA-N 395.503 5.026 30 20 GKED COc1ccccc1C1(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CC1 749344525 WBNUXBGTWTUOFD-KRWDZBQOSA-N 388.492 5.035 30 20 GKED Fc1ccccc1-c1nnc(SCC#Cc2ccc(C(F)(F)F)cc2)o1 754270361 KGFAVJWUNBPIMG-UHFFFAOYSA-N 378.350 5.038 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3cc(Cl)ccc3OCC#N)oc12 754584097 PSSMVENSNFAHBO-CQSZACIVSA-N 384.863 5.238 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3cccc(OC4CCCC4)c3)cc2N1 758025739 NPCLIFGGUHWKMY-CMDGGOBGSA-N 385.510 5.010 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 760111553 MFNITDNSCCOJAK-ZDUSSCGKSA-N 391.393 5.461 30 20 GKED C#CCOc1cccc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)c1 761432110 OQVKSFNLMMFCBC-UHFFFAOYSA-N 384.407 5.012 30 20 GKED C[C@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 762234884 QQSNMQPHQIAZBE-VAKHEIKFSA-N 378.781 5.035 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 763547973 IGKTUJRWVINQDQ-HNAYVOBHSA-N 376.406 5.362 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccc(SC(F)F)cc2)cc1C#N 771838155 MFUTUMUGXGBJEO-UHFFFAOYSA-N 393.484 5.469 30 20 GKED CCCCCC[C@]1(C)NC(=O)N(c2ccc([C@H](C#N)c3ccccc3)cc2)C1=O 771903030 HNBJIXSGLKZROE-QPPBQGQZSA-N 389.499 5.127 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cn(C)c2ccccc12 772161771 MECQMJSYKKYOMX-WZONZLPQSA-N 393.490 5.576 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(N2CCSCC2)c(C)c1 776812573 KRERVXMCDVSZFJ-UHFFFAOYSA-N 384.570 5.079 30 20 GKED Cc1nc(/C=C/c2ccnn2C(C)C)sc1C(=O)/C=C/c1ccnn1C(C)C 794938417 PIWGHBJFNBKNOJ-CDJQDVQCSA-N 395.532 5.073 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1cc(Cl)cc(Cl)c1 795139133 LXEWYFMQSYBNFK-UHFFFAOYSA-N 397.375 5.546 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H](Oc2ccccc2)c2ccccc2)s1 797571370 OCAGPVDZGJBEFY-NQIIRXRSSA-N 390.508 5.437 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801677744 WJWJZATVNPUKPL-AWEZNQCLSA-N 379.275 5.460 30 20 GKED N#Cc1cc(C(=O)Nc2cccc(CC[C@@H](O)c3ccccc3)c2)ccc1Cl 806762194 XRRURJXUNVPVFQ-JOCHJYFZSA-N 390.870 5.130 30 20 GKED CC(/C=C\C(=O)c1cnn(-c2ccccn2)c1C)=C/c1ccccc1OC(F)F 811691530 NVLMPYCXKAGWAG-DTWLVYLASA-N 395.409 5.020 30 20 GKED COc1cccc2c1[C@H](C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 814305926 RHZFHWYMSXEWMR-FGZHOGPDSA-N 382.463 5.019 30 20 GKED C=CCOc1ccccc1CNc1cc(C(=O)N2CCCCC2)ccc1Cl 864003702 WHSBXTIEJKXYHH-UHFFFAOYSA-N 384.907 5.143 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916050532 CFTQJDNCUIVNLE-WZONZLPQSA-N 386.520 5.602 30 20 GKED N#Cc1ccccc1NC(=S)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 917580046 MQJCAWCBYOCGHQ-KRWDZBQOSA-N 376.312 5.399 30 20 GKED COc1ccc(C)c(C=NNc2c(Cl)cc(Cl)cc2Cl)c1C(=O)O 1776014796 ZQFSYIMFIUWRNU-UHFFFAOYSA-N 387.650 5.108 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2cccc(O[C@@H](C)C(=O)O)c2)cc1 1776125782 SIVZBKHVKADJFD-DZXKJOIRSA-N 382.456 5.004 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(-c2ccccc2)c1 1776355410 KDWAZRZRLNZXIK-QBFSEMIESA-N 386.447 5.735 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1\CCc2occ(C(=O)O)c2C1=O 1776365078 VFSSVSWWWOHVGO-DHZHZOJOSA-N 376.861 5.344 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCC)c(OCC)c1 1776784801 XZLHAFDRQARZQW-LJQANCHMSA-N 379.541 5.168 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CCC2)cc1 1791587937 VZXZTJZCVQTVQE-VLCRHTCISA-N 394.559 5.303 30 20 GKED Cc1c(Cl)cccc1/N=C(\O)Cn1c2ccccc2c(=O)c2ccccc21 4135502 ICBUCOHBEHESTE-UHFFFAOYSA-N 376.843 5.405 30 20 GKED C=CCn1c(S[C@@H](C)c2ccccc2Cl)nnc1-c1ccccc1OC 6077422 GXPJFAXSANYKGA-AWEZNQCLSA-N 385.920 5.646 30 20 GKED N#CCc1ccc(NC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)cc1 29646530 GNZDVLCDAOUFPO-UHFFFAOYSA-N 385.448 5.388 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(Cl)ccc3F)c2)c1 32289505 QPQJSVUWSGEGRY-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccccc2COc2ccccc2)cc1 56003155 FUDXORLJUYOCDC-UHFFFAOYSA-N 388.492 5.009 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1cc(F)ccc1F 72040925 BDBZABLETGFNKE-AWEZNQCLSA-N 393.393 5.068 30 20 GKED CO[C@](C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 106985072 LEVXTGXDIQAEFP-UTKZUKDTSA-N 396.899 5.202 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Sc3ccccn3)cc2)c1 109708546 NEIHONZTPCTIOU-UHFFFAOYSA-N 389.480 5.168 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CSc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 118600140 KSUKEJZFCHUOKP-QWHCGFSZSA-N 398.459 5.154 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3ccccc3F)n2)cc1 122012591 VPDCSUSPJLPLHJ-KBXCAEBGSA-N 394.471 5.013 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)cc1 125356746 MMMGDVSGIASLIU-SDNWHVSQSA-N 399.446 5.215 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(-c4ccoc4)c3)n2)cc1 127964634 RKWSNVLFWXVUNG-HXUWFJFHSA-N 395.443 5.432 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nnc(-c2ccccc2Cl)o1 133850106 GSZRBYSCSBCGBK-CYBMUJFWSA-N 384.892 5.396 30 20 GKED Cc1sc([C@@H](C)NCc2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 162777960 POEAUBQLKKCFFY-GFCCVEGCSA-N 385.895 5.634 30 20 GKED COc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1NC(=O)C1CCCCC1 174103976 JIVQIIAHLLMAMX-MRXNPFEDSA-N 377.488 5.259 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 175133019 QRNIXPVETXSYSG-ATEOEAFZSA-N 387.439 5.101 30 20 GKED N#C[C@H](C(=O)c1ccc2ncccc2c1)c1nc(-c2ccc(Cl)cc2)cs1 179621414 LPAJBVMJIQVHON-QGZVFWFLSA-N 389.867 5.502 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nccs1 183543882 WBNSPNAPDRMGLX-OAHLLOKOSA-N 392.484 5.074 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(CCC(F)(F)F)c1 184064105 YIKRVFCGFOGYLT-CYBMUJFWSA-N 377.366 5.116 30 20 GKED N#CCCCOc1cccc(NCc2nc(-c3ccccc3Cl)cs2)c1 187721785 CNOYBLGBVQDECB-UHFFFAOYSA-N 383.904 5.758 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1c(C)nn(CC(C)C)c1C 189898652 RKAXCZGJAGWOFG-UHFFFAOYSA-N 381.564 5.579 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCCCC#N)n2Cc2ccco2)cc1 195562827 BDVJBEVKSNKHLN-UHFFFAOYSA-N 394.544 5.670 30 20 GKED C[C@@H]1CCN(C(=O)c2cccc(CC#N)c2)c2cc(C(F)(F)F)ccc2S1 195695807 YFVVNMUNSCCOCB-CYBMUJFWSA-N 390.430 5.303 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 293409929 QQWCGOVKBOKUNP-UHFFFAOYSA-N 389.455 5.004 30 20 GKED CCCCS[C@H](C)C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 303048735 XQYXPUBEGJKPAF-QGZVFWFLSA-N 384.520 5.148 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl 303854182 SEYFVQADNWNJAS-HZSPNIEDSA-N 388.895 5.616 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](C)c1cc2cccc(F)c2o1 329002939 LQIUYCMFBJMZJD-SMDDNHRTSA-N 388.464 5.297 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CCCCS2)c1)[C@@H]1CCCCS1 329355419 YYCLODQXTBZRRP-IRXDYDNUSA-N 378.563 5.303 30 20 GKED CC[C@H](C)n1ncc(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1C1CC1 329508824 MCKBTANIXUZRSA-YWZLYKJASA-N 395.551 5.425 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)N[C@@H](C)c1ccccc1 409463492 FFWRNCOTVLZUGW-AWEZNQCLSA-N 391.284 5.047 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 427245053 YNYCDKRCQBXJJR-MSOLQXFVSA-N 392.808 5.271 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N(CCC#N)CC2CC2)c(C(F)(F)F)c1 429057466 ABMCRAXOQULXPB-ZDUSSCGKSA-N 399.482 5.754 30 20 GKED CC(C)OCc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)oc2ccccc12 430589979 GNTFMYHKNDOMJC-OAHLLOKOSA-N 396.512 5.602 30 20 GKED C[C@H](NCc1ncc(C(F)(F)F)s1)c1ccc(-c2cccc(C#N)c2)cc1 433339885 BYOKARHIYGOTLE-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(OC(F)(F)F)cc2)c2ccccc21 436441209 FKRKYTUEZZFYPD-UHFFFAOYSA-N 387.361 5.096 30 20 GKED C[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438644292 CCQBLKIZHUUGGA-INIZCTEOSA-N 389.430 5.715 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Br)cc1Cl)c1ccccc1 439128108 CZODNQQZVAPXAQ-HNNXBMFYSA-N 392.684 5.269 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1ccc(C(F)(F)F)c(F)c1 439472820 USMCXSMVQCMZGA-UHFFFAOYSA-N 380.263 5.071 30 20 GKED CN(C(=O)NCC1CCC(C#N)CC1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 442731408 UAYDQSCHYBRNLN-MYKUNDNFSA-N 387.955 5.543 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443953358 SVBZSRIEGLDTPQ-INIZCTEOSA-N 379.891 5.432 30 20 GKED Fc1ccc([C@@H](NCc2ncccc2C(F)(F)F)C(F)(F)F)cc1Cl 444810321 DZSWXZONINBKTG-CYBMUJFWSA-N 386.698 5.286 30 20 GKED Cc1cc(F)ccc1C1CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 458854380 XMCNPVZSCDUCKV-QHCPKHFHSA-N 393.506 5.458 30 20 GKED COc1ccccc1C[C@@H](C)N(C)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 464223694 MYDWLAGKEAKZRU-GOSISDBHSA-N 399.494 5.014 30 20 GKED CCCn1ccc2ccc(NC(=O)c3ccc(COc4ccccc4C#N)o3)cc21 465163143 FUOHKMHEUIZESJ-UHFFFAOYSA-N 399.450 5.347 30 20 GKED CSc1ccc([C@@H](C)NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 467789363 ROYYZTIETGFQQW-MRXNPFEDSA-N 377.513 5.158 30 20 GKED Cc1nc(CN2CCC[C@@H]2[C@H](C#N)c2ccccc2)oc1-c1ccc(Cl)cc1 468281207 WPHXUFWISGDMBB-NHCUHLMSSA-N 391.902 5.575 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nnnn1C1CCCCC1 468989570 MVZSFOFEUYETRT-MRXNPFEDSA-N 388.475 5.015 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCN1c2ccccc2CC[C@H]1C 469317675 OLLLOOKHNUCGET-ZWKOTPCHSA-N 393.556 5.108 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1C1CC1 469734208 CKFYDCXENKUOKL-MRXNPFEDSA-N 389.503 5.242 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cn(CC(C)C)nc1C(F)F 469918455 NUIHRXSZXAOVMQ-UHFFFAOYSA-N 376.451 5.087 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)c3ccc(C#N)nc3)c2)cc1 470662797 MCVIQLMGNMPSDB-SFHVURJKSA-N 399.494 5.241 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)sc1-c1ccc(F)cc1 474435914 TWDAWCJPBAASJC-OAHLLOKOSA-N 384.501 5.933 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1 475548834 OVEJOPIKWJWAEC-JTHBVZDNSA-N 396.506 5.719 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccc([N+](=O)[O-])cc2C1 475577286 DETCZSCUTRXDIM-UHFFFAOYSA-N 379.460 5.037 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(SCC(F)(F)F)c1 476119195 PLRYVNWDUVKPDL-UHFFFAOYSA-N 394.462 5.840 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)C[C@@H](CC#N)c2ccccc2)o1 477916038 PZNFBCSPFLCFMG-QGZVFWFLSA-N 378.859 5.935 30 20 GKED N#Cc1nnc2ccccc2c1Sc1nc2cccc(Br)c2s1 480820794 GBZNCOOAVOEAID-UHFFFAOYSA-N 399.298 5.025 30 20 GKED Cc1nc(-c2ccccc2)sc1CNc1c(C#N)cnc2c(F)cc(F)cc12 488183758 RGBFMWLMCWKUNS-UHFFFAOYSA-N 392.434 5.429 30 20 GKED CN(C(=O)c1cc(C#N)c[nH]1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 488227062 DBUUUXPOETUQFE-UHFFFAOYSA-N 384.266 5.055 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)c1 488479061 FKFCDBONTHANLH-UHFFFAOYSA-N 388.254 5.410 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](CC)c1ccc(Cl)s1 497480128 JHGRTEBLXWNNGH-INIZCTEOSA-N 394.972 5.418 30 20 GKED Cc1ccc(F)c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1F 499633942 VRZOYQGUVBQLOE-UHFFFAOYSA-N 380.419 5.224 30 20 GKED CC(C)[C@@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 504225616 IOJOJSSMQGKYQC-HOYKHHGWSA-N 383.495 5.237 30 20 GKED CCN(C(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 513211275 VSJWTZMUVIEESE-GOSISDBHSA-N 385.467 5.204 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 515800005 KCCDKWSSAXODMV-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 515859152 JDUIHMHPEIGQED-AWEZNQCLSA-N 394.824 5.113 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 517256735 IUQAGULZDLDRFC-MHECFPHRSA-N 396.494 5.228 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 517456254 HNRYGWCYADAIDW-FUHWJXTLSA-N 396.556 5.776 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@@H](C)C(C)C 520055274 BUWCCNRCPUVHPG-JXFKEZNVSA-N 383.923 5.894 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 522070782 JOXDCVQSNJVFOY-NRFANRHFSA-N 387.508 5.084 30 20 GKED CCC1CCC(N(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)C2CC2)CC1 524381571 JGYGBBHLBNLVFN-UHFFFAOYSA-N 392.499 5.304 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(Cl)cc2cccnc12 530980888 DJXDDUOSSLQOOD-ICSRJNTNSA-N 390.874 5.192 30 20 GKED CCC(CC)N(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)C1CC1 531422783 FGHOIQFFRFOSEJ-UHFFFAOYSA-N 391.515 5.631 30 20 GKED CC[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 536074210 YPAMNVQRLLSGOM-OAQYLSRUSA-N 398.915 5.801 30 20 GKED C=C[C@H](CC(=O)N(C[C@H]1CCCO1)c1nc2ccccc2s1)c1ccccc1 536215592 URWRCORVKFKUBN-IEBWSBKVSA-N 392.524 5.168 30 20 GKED Cc1ccc(-c2n[nH]cc2CNCc2ccc(-c3ccccc3C#N)cc2)cc1 536893859 OGHGLTQYZJNRSB-UHFFFAOYSA-N 378.479 5.214 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 537298327 FTVZZMSALKYZTJ-UHFFFAOYSA-N 378.501 5.405 30 20 GKED COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)c2cccc(CC#N)c2)c1 541441612 HWEVAEJMJANYKM-RPBOFIJWSA-N 396.490 5.132 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccc(F)cc3Cl)CC3CC3)cc2)CC1 553063872 UEMZOLDWMGIZES-UHFFFAOYSA-N 382.866 5.087 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1 554204670 HPPSQXXYHFDASD-DBXWQHBBSA-N 393.556 5.943 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1c([N+](=O)[O-])cccc1C(F)(F)F 554873235 IZPFQDAXTYOGKF-UHFFFAOYSA-N 396.218 5.024 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c2)cc1 565069683 JCZWNLTVORMSPP-QFIPXVFZSA-N 382.419 5.049 30 20 GKED N#C[C@]1(C(=O)Nc2ccc(Br)c(Cl)c2Cl)CC12CCCC2 572341224 KHTXULCZIWYCQY-HNNXBMFYSA-N 388.092 5.168 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cnc(-c4cccs4)s3)cc2)ccn1 579242993 GVSKFSFGWBTAMR-UHFFFAOYSA-N 390.493 5.543 30 20 GKED N#CCCCCCC(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1 588266504 FQSAXHCPBPVOGE-UHFFFAOYSA-N 381.423 5.165 30 20 GKED N#CCCCCCC(=O)NCC1(c2ccc(Br)cc2)CCCCC1 588377119 BRDJQXMZOKOSTQ-UHFFFAOYSA-N 391.353 5.241 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1nc2cc(F)ccc2s1 592974225 POCJYEUWFNQDPL-INIZCTEOSA-N 389.455 5.286 30 20 GKED Cc1cc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C#N)c1[N+](=O)[O-] 596073046 DAVACICPJKBOFH-PJXYFTJBSA-N 395.303 5.096 30 20 GKED COc1cc2ccc(C(=O)N[C@H](CCCC#N)c3ccccc3)cc2cc1OC 597691264 KATYJTFIOZNBGD-OAQYLSRUSA-N 388.467 5.022 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCSc3ccc(F)cc3)cn2)c1 603622752 XWVMIZUXXCLDIK-UHFFFAOYSA-N 393.443 5.006 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 609207217 WBVQGTOPCJRJMB-UHFFFAOYSA-N 391.393 5.465 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1cccc(C(F)(F)F)c1 609377502 HOOCTNQNIHNFEH-CYBMUJFWSA-N 378.419 5.138 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cc3ccccc3o2)cc1F 610313502 IKLJONSBKMMIAB-UHFFFAOYSA-N 386.382 5.417 30 20 GKED C[C@H](NC(=O)Nc1ccccc1-c1nc2ccccc2s1)c1cccc(C#N)c1 610317958 LEJRMAVEXMSDQV-HNNXBMFYSA-N 398.491 5.718 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC(Cc3ccccc3)C2)cc1 611520424 AETZTJABNUNESA-UHFFFAOYSA-N 398.531 5.165 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(-n4cccc4)c3)n2)cc1 613318011 DZWWPWGBJRLFPA-HXUWFJFHSA-N 383.476 5.399 30 20 GKED CC1(NC(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)CCC(F)(F)CC1 680214933 HIRVKSJBGIRMTM-UHFFFAOYSA-N 386.311 5.430 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccccc2-c2nncn2C(C)C)CCCC1(C)C 683557767 ZNFCKPFYBHROBH-IBGZPJMESA-N 381.524 5.125 30 20 GKED N#Cc1ccc(CNc2ccccc2NC23CC4CC(CC(C4)C2)C3)c(F)c1 726186020 RYHZMVWVRURBFR-UHFFFAOYSA-N 375.491 5.690 30 20 GKED COc1cc(C(C)=NNc2ccc(Br)cc2F)ccc1SC 728432652 UXLBWZWYKMWHSH-UHFFFAOYSA-N 383.286 5.155 30 20 GKED N#CCOc1cccc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)c1 730151865 RTMFVTZKCPQRCX-FLIBITNWSA-N 379.362 5.240 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C(/C)Cc1ccccc1OC 730162947 OBWFJKNHDJIJDF-SQFISAMPSA-N 375.921 5.114 30 20 GKED O=C(/C=C\c1cccc(F)c1F)c1ccc(OC(F)F)cc1OC(F)F 730732738 PDIWGDDXBMWIOH-DAXSKMNVSA-N 376.252 5.064 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2ccccc2Cl)c1 733804314 BPHCBBJNDZGYRP-DYESRHJHSA-N 397.906 5.068 30 20 GKED N#C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C1CCCCC1 734367317 HWFLUHRFXNOZEC-CQSZACIVSA-N 381.979 5.881 30 20 GKED C[C@H](SCc1cc(Cl)ccc1OCC#N)C(=O)Nc1ccccc1Cl 735320578 YPICESVIFMUUEM-LBPRGKRZSA-N 395.311 5.156 30 20 GKED Cc1csc(SCc2ccc(C(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)n1 743778415 ITQPKIIMRKWLHO-HNNXBMFYSA-N 393.537 5.107 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c1 744038303 PUJFOYQNNZSBKL-MRXNPFEDSA-N 396.441 5.075 30 20 GKED C=CCOc1ccccc1CN(C(=O)C1CCC(=O)CC1)c1ccc(C)c(C)c1 746244313 FUWNDEJOVVNAAK-UHFFFAOYSA-N 391.511 5.161 30 20 GKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl 754573862 TYJQYQULLPNHNV-TZMCWYRMSA-N 383.835 5.048 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccc2ccsc12 767957612 CSUAJQDFJOOXAI-ZDUSSCGKSA-N 389.263 5.169 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3COc4cc(C)c(C)cc43)n2)cc1 770848150 SGIVWYJLBQBZGR-RTBURBONSA-N 388.492 5.088 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=O)Nc1ccccc1O[C@@H](C)C#N 780678622 VUEQAUKKMGUMCK-AWEZNQCLSA-N 389.858 5.214 30 20 GKED CC1(C#N)CCN(C(=O)c2sc3cc(Br)ccc3c2Cl)CC1 780780047 INEFBXSKSMNESR-UHFFFAOYSA-N 397.725 5.083 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)cc1F 781423546 RQYRFCWNYCZNFJ-SSOJOUAXSA-N 386.470 5.463 30 20 GKED COc1ccc(/C=C2\CCc3[nH]c4ccccc4c3C2=O)cc1OCCCC#N 781551106 GGBXLWSOVOAXFU-SAPNQHFASA-N 386.451 5.072 30 20 GKED COc1cccc(NC(=S)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 782206882 YTPCLJXBQSVYJR-MRXNPFEDSA-N 387.508 5.281 30 20 GKED Cc1ccc(Cl)c(NC(=S)N[C@H]2CCc3cc(C#N)ccc32)c1Cl 782449526 BPSLYIWTSLPLDC-HNNXBMFYSA-N 376.312 5.147 30 20 GKED C[C@@H](OC(=O)Cc1cccc(OCC#N)c1)c1ccc(SC(F)(F)F)cc1 784108827 VDVQGBRVWIZPNS-CYBMUJFWSA-N 395.402 5.048 30 20 GKED N#Cc1ccc([C@@H](O)C(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)cc1 792588852 RQPTZDSWGKENHQ-HXUWFJFHSA-N 397.261 5.204 30 20 GKED N#C[C@@H](C(=O)C(C1CCC1)C1CCC1)c1nc(-c2c(F)cccc2F)cs1 796906423 VZNVNGBBQDSITG-AWEZNQCLSA-N 386.467 5.481 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(SC(F)(F)F)cc2)s1 797568248 PGFCYKBKQORACB-LBPRGKRZSA-N 384.448 5.543 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2Cl)nnc1-c1ccccc1C 799888556 NNAOYHFSHDQNMH-UHFFFAOYSA-N 391.327 5.434 30 20 GKED Cc1ccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(Cl)n1 806577806 XERQOBPVVZQVRB-UHFFFAOYSA-N 391.858 5.197 30 20 GKED CC1(CC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)CCCC1 808980064 SGRRQYWFVRGSAC-GOSISDBHSA-N 376.456 5.097 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1SC(F)(F)F)c1ccccc1 814615770 IFWQJYCJVBLONE-OAHLLOKOSA-N 393.434 5.855 30 20 GKED FC(F)(F)c1cc(NN=C2CC[C@@H](c3ccccc3)C2)nc(-c2ccccn2)n1 814848059 NBPALGIDXCZECH-OAHLLOKOSA-N 397.404 5.293 30 20 GKED CC(C)c1ccc(C2(O)CCC(Nc3ccc(F)cc3OCC#N)CC2)cc1 816565388 NKDXUSJQVFAFRU-UHFFFAOYSA-N 382.479 5.094 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCCCc2ccncc2)cc1 863949228 XVCROKDFWOGIHK-UHFFFAOYSA-N 388.492 5.035 30 20 GKED C[C@@H](Nc1ccc([C@H](O)C(F)(F)F)cc1)c1ccc(F)cc1C(F)(F)F 864021360 AWHODTUYUNINLK-PSLIRLAXSA-N 381.291 5.613 30 20 GKED CCc1ccc(C(=O)CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915088740 XPORZEORWAQFQU-XMMPIXPASA-N 396.490 5.506 30 20 GKED N#C[C@@H](C(=O)c1ccnc(Cl)c1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 915103159 PWZAJVZTNQHVKL-KQZSUJQPSA-N 397.931 5.149 30 20 GKED N#C[C@H](C(=O)Cc1ccc(C(F)(F)F)cc1)c1nc2cc(Cl)ccc2s1 917042664 CRMMJBYTCPGDET-CYBMUJFWSA-N 394.805 5.387 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c(OC)c1 1776114306 LLTUJKIVQUCHCY-FLIBITNWSA-N 394.448 5.027 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1[N+](=O)[O-] 1776116166 SPJISPHEXQKNLM-LCYFTJDESA-N 387.391 5.165 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccsc3)cc2)c1)C(=O)O 1776470733 FUJSYFPYVKFUJL-VSGCLNPGSA-N 378.449 5.163 30 20 GKED CCCCOc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1OC 1776801417 SMBRHFRBVIOQIB-AQTBWJFISA-N 394.467 5.175 30 20 GKED Cc1cccc2c1CC/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777457167 AGCONCXAWUARCZ-HMAPJEAMSA-N 382.459 5.502 30 20 GKED C=CCCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(C)C)CC1 1823753536 SOVHNLPTUCLKRL-NRFANRHFSA-N 390.612 5.035 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H](c3ccccc3)c3ccco3)c2)c1 60961225 ZGVHGTQVSCEMSM-SANMLTNESA-N 394.474 5.609 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)c(Cl)c1 63320355 JZAHDEIBDNCFBT-UHFFFAOYSA-N 380.231 5.122 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(OC2CCCC2)c1 63390826 BFOYQKAQSCKOGJ-UHFFFAOYSA-N 395.459 5.136 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1oc2ccccc2c1C 63402909 OZUBTZBLVSXIAX-MRXNPFEDSA-N 393.443 5.108 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 69354326 YOGJHHDHRINEID-LBPRGKRZSA-N 381.259 5.100 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1nc(-c2ccccc2)cs1 107321818 SYCKIOUAWIALHR-KRWDZBQOSA-N 377.513 5.343 30 20 GKED CCC[C@@H](NC(=O)CNc1ccccc1SC[C@H](C)C#N)c1ccccc1 108353913 WAMSPVHHIRJLKG-IEBWSBKVSA-N 381.545 5.008 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 128407139 PTHJVRVJUNUYGB-AEFFLSMTSA-N 384.549 5.322 30 20 GKED CCc1nc2c(s1)[C@H](N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1)CCC2 133532066 ZNTODBQOXIQATB-QGZVFWFLSA-N 382.533 5.048 30 20 GKED CC(=O)N(c1nc(CSc2cccc(C#N)c2)cs1)c1ccccc1F 158807310 XNSHMUZMQDYKCY-UHFFFAOYSA-N 383.473 5.131 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(OCc3ccccn3)c2)cc1 165805950 HXYFBUBMOCIPME-UXHICEINSA-N 386.495 5.084 30 20 GKED COc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 175116904 DDRUZVAZMYFPKR-HNAYVOBHSA-N 376.481 5.189 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 185834954 ZOAQOZIXWLRCKD-MSOLQXFVSA-N 391.487 5.066 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1ccc(Cl)cc1C(F)(F)F 186420932 YRCHYCRDAVGARZ-GOSISDBHSA-N 380.797 5.004 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)cc1 328912086 OSTHHLHOBOKPLY-ICSRJNTNSA-N 378.472 5.099 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 329044978 FLVCBWMLFJTBEI-JFIYKMOQSA-N 388.508 5.126 30 20 GKED Cc1ncc(N=C(O)C2CCC(/N=C(/O)CC3CCCC3)CC2)c(C2CC2)n1 329808270 PDYBPWKQNSHIHD-UHFFFAOYSA-N 384.524 5.346 30 20 GKED O/C(=N/[C@@H]1CC2(CCCC2)Oc2ccccc21)c1cc(O)nc2ccc(F)cc12 330102747 FXAZDOCJIBVVBV-LJQANCHMSA-N 392.430 5.221 30 20 GKED CCc1occc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 430520665 PGZUBGKWCFGKHC-ZDUSSCGKSA-N 391.279 5.762 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 432869569 XXNNWIJODVBQRN-FDDCHVKYSA-N 393.556 5.585 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 433156902 KTGMDADXDFGARL-HKUYNNGSSA-N 392.528 5.638 30 20 GKED Cc1ccc(C(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1Oc1ccncc1 436325548 BNJSJUPSKBBHRE-PKTZIBPZSA-N 397.478 5.094 30 20 GKED Cc1cccc(COc2ccc(NC(=O)c3c(F)cc(C#N)cc3F)c(C)c2)c1 445779298 CGRGJAZCGAPGAP-UHFFFAOYSA-N 392.405 5.285 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 445971799 PGFOEKXVGIIEIF-YGRLFVJLSA-N 397.334 5.066 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(Cc3cccc(C#N)c3)C2)n1 447056995 DENLAKICJMHLDC-LJQANCHMSA-N 389.524 5.070 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1ccc(F)cc1Cl 458875509 PJCFBEIOCMVHAY-OAHLLOKOSA-N 392.906 5.105 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(F)c3Cl)cc2F)c1 463502204 PSMCNWPOWUCITO-UHFFFAOYSA-N 398.796 5.321 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2-c2ccccc2)c(Cl)c1 465389602 STQZKRZGWVCFQW-UHFFFAOYSA-N 378.884 5.609 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@H](CC(C)C)C1 467620394 XWVROJFKXKXNBA-IBGZPJMESA-N 377.488 5.559 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1)c1ccccc1 469405857 LVXCVGLEIUYLNM-QFIPXVFZSA-N 395.453 5.199 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 471166939 ZGNABAAEHQVVNP-UHFFFAOYSA-N 390.483 5.556 30 20 GKED CSc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(Cl)cc1Cl 471221094 RDPFKLRKETWVGU-UHFFFAOYSA-N 379.312 5.769 30 20 GKED CC(=O)CCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 473125231 HKIKYAFTGCGUCJ-UHFFFAOYSA-N 390.361 5.067 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1 473836540 OLVIUUFYFOOKRK-UHFFFAOYSA-N 395.528 5.134 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 474903449 VPUCAEHQBNPYEG-GOSISDBHSA-N 375.516 5.114 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1 477018231 GZKRKTGAMPSPOD-UHFFFAOYSA-N 396.535 5.303 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C2CCC2)cc1Cl 480118667 CCUJLANCDDQNNB-RBBKRZOGSA-N 393.918 5.792 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@H]3C3CCC3)cc2F)c1 481683928 IQBOEIUCHAHLSL-NRFANRHFSA-N 393.462 5.073 30 20 GKED N#C[C@H](C(=O)c1ccccc1C(=O)c1ccc(F)cc1)c1nccc2ccccc12 483238313 WPRNPYUEPJQBGE-QFIPXVFZSA-N 394.405 5.095 30 20 GKED CC(C)C[C@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 487376844 LJPMWWKFYKRBOB-NQIIRXRSSA-N 395.572 5.396 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487393126 TYBIOXKFHHLELM-OXJNMPFZSA-N 399.332 5.179 30 20 GKED CSC[C@H]1CCCN(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1 489998449 PXAYBLONUCZLPF-HKUYNNGSSA-N 393.556 5.071 30 20 GKED CSc1cccc([C@H](NCc2cc(C#N)ccc2F)c2cc(F)ccc2F)c1 494020495 NCEWZBJAMMRLLM-QFIPXVFZSA-N 398.453 5.577 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N(CC#N)c3ccccc3)c2)c(C)c1 497902383 GRPZTLVYBZOZFI-UHFFFAOYSA-N 386.520 5.766 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503467449 WVSLQJMIUIANKD-UHFFFAOYSA-N 385.389 5.207 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 504117343 WMGXZTWBWFWXTJ-LBPRGKRZSA-N 396.903 5.526 30 20 GKED C=CCNC(=O)[C@H](C)S[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 506235894 UUHQDOAIHRPFNO-UWVGGRQHSA-N 385.373 5.209 30 20 GKED C=CCc1cc(CNc2ccc3nc(C(F)F)sc3c2)cc(OC)c1O 513027287 KHCZASHNUNTCHS-UHFFFAOYSA-N 376.428 5.289 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccccc3SC[C@H](C)C#N)CCCC2)c1 517461147 APBAULAWKMZUTI-GOSISDBHSA-N 378.541 5.697 30 20 GKED N#C[C@@H](NC(=O)c1ccc2c(c1)Cc1ccccc1-2)c1cccc(C(F)(F)F)c1 521016108 HYQDXSCCDDYPCB-OAQYLSRUSA-N 392.380 5.271 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 521325923 ZPLVYOJSBZSGJA-KRWDZBQOSA-N 386.451 5.491 30 20 GKED N#C[C@H](NC(=O)c1cccc2ccccc12)c1ccc(OCc2ccccc2)cc1 524109492 DJRSHSQMUKJNAG-VWLOTQADSA-N 392.458 5.413 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2s1 527497259 FEQJHDRZKYHJET-LSDHHAIUSA-N 395.553 6.178 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 532569922 AINZDPXQZIQSRK-OALUTQOASA-N 395.572 5.329 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)cccc1-c1ccccn1 535093322 BDLCPKKDKLLAGL-HXUWFJFHSA-N 395.384 5.071 30 20 GKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 540129022 SQPASRADZDPHPC-PXNSSMCTSA-N 377.488 5.126 30 20 GKED C=CCN(C(=O)c1cccc2ccc(C)nc12)c1nc(-c2ccccc2)cs1 540399240 RMOUQLXNLNVXFV-UHFFFAOYSA-N 385.492 5.500 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)cc1 540878443 JSTNWJZPXOISIY-UHFFFAOYSA-N 381.435 5.404 30 20 GKED COc1ccc(CN[C@@H](c2ccc(OC(F)(F)F)cc2)C(F)(F)F)cc1F 542014070 UYMBEVWAZCNIIO-HNNXBMFYSA-N 397.290 5.126 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(Br)cc1F 567435938 CVBTUGXZMPHQJS-LBPRGKRZSA-N 397.313 5.109 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ocnc2C2CC2)cc1Cl 569013623 KBVXEZGARYXPBV-KRWDZBQOSA-N 377.831 5.113 30 20 GKED COc1cc(Cl)c(NC(=O)c2ccccc2-c2ccccc2C#N)cc1C 578696347 ITKDFUOCZLEHGA-UHFFFAOYSA-N 376.843 5.448 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)c3cccc(C#N)n3)c2)cc1 589450868 RWPBQBWBRVGNMF-SFHVURJKSA-N 399.494 5.241 30 20 GKED C=CCOc1ccc(CNCc2cccc(OCC(F)(F)F)c2)cc1Cl 589641024 CGVQKSOULLLBKB-UHFFFAOYSA-N 385.813 5.136 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)C1 596936331 JKAUQPWUHXULSD-MRXNPFEDSA-N 383.492 5.276 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccccc2Oc2cccc(Br)c2)C1 597912474 DKAZXCXMZZCDFB-OAHLLOKOSA-N 399.288 5.007 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1C 601184885 VQLYPSRCHCWGLQ-RUZDIDTESA-N 395.506 5.467 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@H](C)c2ccc(Cl)cc2Cl)n1 603946923 VICDOYMKVWHGSG-SNVBAGLBSA-N 381.284 5.290 30 20 GKED Cc1csc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 608808503 OLYAYMRVBMSRKP-UHFFFAOYSA-N 395.487 5.910 30 20 GKED CN(C(=O)c1cc2ccccc2n1CC#N)c1ccccc1Oc1ccccc1 609170730 YNJLXLLJASOABT-UHFFFAOYSA-N 381.435 5.234 30 20 GKED N#CCn1c(C(=O)Nc2nc(-c3cccc(Cl)c3)cs2)cc2ccccc21 609200944 FZHWMAHTHMVLMV-UHFFFAOYSA-N 392.871 5.194 30 20 GKED N#C[C@H](NC(=O)c1ccnc(Oc2ccccc2)c1)c1c(Cl)cccc1Cl 609589345 VIOQDFOVKOVPRF-KRWDZBQOSA-N 398.249 5.175 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609647239 BWZPNTUDLPSAQE-CYFREDJKSA-N 396.490 5.155 30 20 GKED C[C@H](N[C@H](C)c1cccc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 610158673 GZVBVJSWARHESQ-CABCVRRESA-N 377.875 5.043 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 611549608 AICWSZKQXNOLSS-KRWDZBQOSA-N 391.452 5.135 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1SCC(F)(F)F 615491922 UFUKLNFTOTUOHF-UHFFFAOYSA-N 398.425 5.700 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 619804421 YLPAYCMTOSGINB-UHFFFAOYSA-N 383.923 5.952 30 20 GKED N#C[C@@H](C(=O)c1cccc2ncccc12)c1nc2cc(C(F)(F)F)ccc2s1 678919975 GKYMADAFHKJYLP-AWEZNQCLSA-N 397.381 5.353 30 20 GKED N#C[C@H](C(=O)c1ccccc1SCc1ccco1)c1cnc2ccccc2n1 682994912 LCKXKDIBHRMWHJ-KRWDZBQOSA-N 385.448 5.005 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)C1CCCCC1 726324723 DSZCILHUMRIUIM-HNAYVOBHSA-N 377.513 5.465 30 20 GKED Cc1ccc(N(Cc2ccco2)C(=O)CSc2ccc(C#N)cc2)cc1C 728464510 HYSYNZYRBVQJGX-UHFFFAOYSA-N 376.481 5.094 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cccc(OC2CCCC2)c1 731287819 KTBALFSIHIEYJP-FQEVSTJZSA-N 386.451 5.003 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 732499435 QFROHFMQOYBFEC-JQVXPOPVSA-N 398.409 5.507 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ncc(-c2cccs2)o1 735319285 YDRFDMUEASVDKA-UHFFFAOYSA-N 376.890 5.392 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744017076 YAOCTZPESLFURE-VSOYFRJCSA-N 380.369 5.533 30 20 GKED CC(=NN=C(C)c1ccc(-c2ccc(Br)cc2)s1)c1cnccn1 745207014 VIUWXKNIJUIISB-UHFFFAOYSA-N 399.317 5.201 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccc(Cl)cc1 745723562 BTIVIBNMNWGADL-UHFFFAOYSA-N 377.900 5.615 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1OC 745990188 MYOPJLNCJMFLHB-BJMVGYQFSA-N 389.451 5.061 30 20 GKED N#C[C@@H](COC(=O)c1cnc(-c2ccccc2Cl)s1)Cc1ccccc1 750781061 MEXWGUAQIYZZMD-HNNXBMFYSA-N 382.872 5.003 30 20 GKED C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 754110273 UGUVTYGPZMESGT-HFSPZYRZSA-N 397.434 5.292 30 20 GKED CC(C)(C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1ccc2ccccc2c1 764306297 HWRUPYHMKHCZLR-UHFFFAOYSA-N 393.830 5.189 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(SC(F)F)cc2)c1 772983526 JIQTTXLAJOOYBC-WMLDXEAASA-N 376.472 5.533 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2csc(-c3cccs3)n2)cc1 774579016 RCWZXYMATCXAHJ-UHFFFAOYSA-N 398.509 5.133 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc3cc[nH]c23)cc1 786079993 ZNUFRXBGBJAXAT-JOCHJYFZSA-N 380.451 5.145 30 20 GKED Cc1ccccc1C1(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)CCC1 788348633 JQIPCOBWLYSWPE-HNNXBMFYSA-N 379.410 5.038 30 20 GKED CC(C)CN(CCC#N)C(=O)c1cc2sc(Nc3ccccc3)nc2s1 789890175 TUUMYGJZZJTQDC-UHFFFAOYSA-N 384.530 5.113 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 800387898 WPTUYSFFRQIMCK-GXTWGEPZSA-N 380.847 5.465 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1 800578972 XBSSGZIVMMTGOB-AWEZNQCLSA-N 396.878 5.391 30 20 GKED N#Cc1ccc(CNc2cc(F)c(N3CCCC3)c(F)c2)c(C(F)(F)F)c1 810134155 XFQBACKETHALFB-UHFFFAOYSA-N 381.348 5.068 30 20 GKED CC(=NNc1ncnc2ccsc12)c1sc(-c2ccc(F)cc2)nc1C 814879747 ZKKGMSAFMMIZDS-UHFFFAOYSA-N 383.477 5.098 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(-c2ccc3ccccc3c2)no1 818425949 PUFQBVASPOTWCG-SFHVURJKSA-N 392.459 5.149 30 20 GKED Cc1cc(-c2cc(C(=O)O[C@H]3CC[C@@](C)(C#N)CC3)c3c(C)noc3n2)c(C)o1 836160567 KHIYDCOJRBSLFG-FVUUGDKNSA-N 393.443 5.037 30 20 GKED N#CC1C/C(=C/c2scnc2C2CC2)C(=O)/C(=C/c2scnc2C2CC2)C1 899379405 HRXWUUNTKIRECU-BSHIDLADSA-N 393.537 5.324 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 915179161 AQCZNLJZSFUWCN-LJQANCHMSA-N 391.814 5.156 30 20 GKED COc1cc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cc(OC)c1OC 916131423 CSOSDJBEJJEOFV-NTMALXAHSA-N 388.419 5.508 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](C#N)C(=O)c1ccc(C2CCCCC2)cc1 916923796 SXGGYGJOWJZUBS-FQEVSTJZSA-N 390.483 5.094 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c2cc1C 917043391 IGOTWHIYEJUZOS-INIZCTEOSA-N 394.883 5.732 30 20 GKED CCN(C(=O)c1cc(C)n(Cc2ccccc2)c1C)[C@H](C)c1ccc(C#N)cc1 919862206 HWOCWXKRGVTWHU-LJQANCHMSA-N 385.511 5.248 30 20 GKED Cc1ccc(NN=Cc2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c(Cl)c1 1776060703 JXBLJUCSEKAHLS-UHFFFAOYSA-N 398.846 5.273 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2)cc1 1776125356 GFXBGURAGALRBN-QWSHFYNQSA-N 380.484 5.876 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)cc1 1776215416 BOUVUCDRCXMJFL-XFVCYKSVSA-N 394.427 5.109 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccccc1C(F)(F)F 1776785357 ZTWJYYNFSICTNH-LJQANCHMSA-N 387.486 6.294 30 20 GKED CCN(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776855385 ARUBZGVACUOTCG-OWBHPGMISA-N 391.492 5.466 30 20 GKED CCn1c2ccccc2c2cc(/C=C3/CCc4occ(C(=O)O)c4C3=O)ccc21 1777002722 AXSXZNBVTPOCEQ-PTNGSMBKSA-N 385.419 5.318 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc(C(=O)O)ccc3F)s2)cc1 1777430657 ZZRZZDDODKNBKR-CSKARUKUSA-N 381.428 5.160 30 20 GKED O=C1/C(=C/c2ccccc2OC2CCCCC2)C[C@H](C(=O)O)c2ccccc21 1777698154 NZNAPNYAXKAFPQ-UEBLJOKOSA-N 376.452 5.236 30 20 GKED C=CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCCCCC(C)(C)C)CC1 1831577241 LQRKXNXTEFDFRX-OAQYLSRUSA-N 390.612 5.179 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 31810596 LPBSERDGHVMUOH-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1 56740057 AOOSRYIYVGXQDW-UHFFFAOYSA-N 397.544 5.031 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)s1)c1nc(-c2c(F)cccc2F)cs1 64714402 OBCKWWDLULQWHC-QMMMGPOBSA-N 380.828 5.293 30 20 GKED CCc1ccc2c(CNc3ccccc3SC[C@H](C)C#N)cc(=O)oc2c1 68782270 AZHMIVOPAJVPQD-OAHLLOKOSA-N 378.497 5.219 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc2c(s1)-c1ccccc1CC2 78669167 QNLSOEYVCQSVRL-UHFFFAOYSA-N 390.533 5.772 30 20 GKED CC(=O)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 110308977 LOSDMRUTOCZVEP-UHFFFAOYSA-N 392.402 5.166 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccoc1C 118610026 VFPSNXFOCVEMOU-OAHLLOKOSA-N 392.484 5.541 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N(CCC#N)Cc3ccco3)c2)C1 123576657 HSLMRKUFUPWYRU-WIYYLYMNSA-N 395.503 5.323 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1 153193209 HVSMRMPMXXYQJK-FQEVSTJZSA-N 391.858 5.302 30 20 GKED C=CCC[C@H](NC(=O)Nc1c(C)cccc1C(=O)N1CCCC1)c1ccccc1 155051887 FEJATTGZTJDCCO-NRFANRHFSA-N 391.515 5.060 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(CC(F)(F)F)cc1 173650356 IWDJPEOEEUPSKS-UHFFFAOYSA-N 375.394 5.106 30 20 GKED N#CCSCCCSc1nnc(-c2ccccc2Cl)n1C1CCCC1 174000249 KVIFNUMMQGVFPW-UHFFFAOYSA-N 392.981 5.453 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1Oc1ccncc1 177765008 UPGIYLPWDWPJNL-QGZVFWFLSA-N 377.469 5.252 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nnc(-c3ccccc3)o2)cc1F 178033985 ALUBGKLNLTXVIJ-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CN(C)c1ccc(NC(=O)c2ccc(C(F)(F)F)c(F)c2)c(C(F)(F)F)c1 190702485 SNOJHOLHNLHDSA-UHFFFAOYSA-N 394.290 5.182 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)ccc1OCC#N 212561424 UGOPBSVSXVQFMG-QPEQYQDCSA-N 375.468 5.541 30 20 GKED COc1cc(C=NOCc2csc(C3CCCC3)n2)cc(Cl)c1OC 255084795 LHWVMDNCHNZLQG-UHFFFAOYSA-N 380.897 5.022 30 20 GKED CCc1noc2ncc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)cc12 302949746 DMLQOJYDOKPKRK-UHFFFAOYSA-N 398.422 5.010 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1 303933010 QCBDWKYNNFUFOT-LBPRGKRZSA-N 379.262 5.421 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1cccc(Br)c1C 328779242 DVUBQNGKCMNCQI-GFCCVEGCSA-N 395.322 5.053 30 20 GKED N=C(O)N1CCC[C@H]1/C(O)=N/[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 329170332 JYXKPGFWEPMEPU-UAGQMJEPSA-N 397.441 5.035 30 20 GKED C[C@H]1CC[C@@H](c2ccccc2)N(C(O)=Nc2nc(C3CCOCC3)cs2)C1 329460471 SCIZEFGJWCNTDF-KXBFYZLASA-N 385.533 5.056 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=O)c1cccc(SCC#N)c1 429940206 IEMJCYKUNGWXPJ-UHFFFAOYSA-N 376.884 5.147 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)c(Cl)c1 430362410 WSBRXQNLIZZNGI-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)c2c(Cl)cc(F)cc2Cl)cc1 432154118 GIHYMIBGFODFAH-UHFFFAOYSA-N 399.252 5.601 30 20 GKED CC[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)C1 438184882 LKKLXLVJAYFINL-QHCPKHFHSA-N 393.487 5.403 30 20 GKED COc1ccccc1[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 438864156 NXDPATYIDRLYJQ-VWNXMTODSA-N 399.494 5.129 30 20 GKED CCCc1c(NC(=O)[C@@H](C)c2cccc(Cl)c2)cnn1-c1cccc(C#N)c1 440076703 KLOVUKQOZKYSSC-HNNXBMFYSA-N 392.890 5.092 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C2CC2)cn1 445795244 OACFTCKBLBJWGT-UHFFFAOYSA-N 391.418 5.236 30 20 GKED C=CC[C@@H]1N(c2nnc(-c3cccnc3)n2Cc2cccs2)CCCC1(C)C 461329154 FPZTYSLPGRHOJM-IBGZPJMESA-N 393.560 5.021 30 20 GKED C=CCn1c(S[C@@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1cccc(C)c1 463044689 SZWIXOCXACEZJS-HNNXBMFYSA-N 380.473 5.201 30 20 GKED CCC[C@@H](CNc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 468893002 IBGZXMQFHPIGSX-NRFANRHFSA-N 375.516 5.265 30 20 GKED C[C@H](CCNC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 470494913 ADFVAJXUMWWERL-CQSZACIVSA-N 375.394 5.087 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@@H]3CCC[C@@H]3c3ccccc3C(F)(F)F)CC2)cc1 474144933 FLGUGMYDBWEUHR-UYAOXDASSA-N 398.428 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(CN(C)CC)c1 475553968 QCGJBOLNAZCXIS-UHFFFAOYSA-N 379.548 5.312 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2nc(C3CC3)oc2c1 477080108 AUOAOAXVWCZRJR-UHFFFAOYSA-N 393.491 5.093 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1)c1ccc(F)c(F)c1 481598087 YJUMZRWSFLOLPZ-YJYMSZOUSA-N 387.405 5.430 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1cnc2ccccc2n1 483201418 MPNLFYGVRLJMHA-INIZCTEOSA-N 399.475 5.247 30 20 GKED CC(C)(C#N)c1ccccc1CSCc1cccc(C(=O)N2CCCCC2)c1 486740118 UEYDFQXZBCKGSQ-UHFFFAOYSA-N 392.568 5.547 30 20 GKED O=C(NCC[C@H](c1ccccc1)C(F)(F)F)c1ccc(F)cc1C(F)(F)F 490928079 QHRLNDTUKDBUOI-CQSZACIVSA-N 393.302 5.311 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccc(Br)cc2)s1)c1ccccc1 495548947 SLGURNJCUHJXJZ-UHFFFAOYSA-N 397.297 5.348 30 20 GKED N#CCCn1cc(CNCCc2c(Cl)cccc2Cl)c(-c2ccccc2)n1 500135607 SYXPDCBZGXWPTI-UHFFFAOYSA-N 399.325 5.103 30 20 GKED C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 502633422 KCHBULXPYPYWPD-FGSXEWAUSA-N 391.515 5.278 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 506002189 MLEWMASSWFGKMV-CQSZACIVSA-N 389.502 5.167 30 20 GKED C[C@H](CC1CCCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 510086107 NYJYBKHZFZNTEC-GOSISDBHSA-N 376.500 5.487 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCOC1CCCCC1 510692501 DTICDRTYAAPGIZ-UHFFFAOYSA-N 393.487 5.130 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1ccccc1Sc1ccccc1C#N 515613071 NCLHBUOTVADOCI-UHFFFAOYSA-N 388.492 5.669 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517338789 IGEUADDKEKVDPP-XZOQPEGZSA-N 384.435 5.101 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1C 520427633 SHARYUBRFFBWCJ-LLVKDONJSA-N 388.464 5.511 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 521016079 FVICEPNWDOECQP-BDJLRTHQSA-N 398.837 5.220 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(Cl)cc1F 521126962 WGVBXKGGJASBNP-UHFFFAOYSA-N 381.794 5.099 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 521954811 AYJPDBNHQRQXRJ-MSOLQXFVSA-N 387.310 5.407 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@H]1CCC[C@H](C)C1 522150962 ILHPDYWSFXIZEI-JXFKEZNVSA-N 378.472 5.193 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C1CC(c2cccc(F)c2)C1 522923633 XNZJAKWXPKWKQA-UHFFFAOYSA-N 376.456 5.558 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 530594052 PSVGHVKODSJOSL-UHFFFAOYSA-N 389.436 5.178 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)c3ccc(C#N)cn3)c2)cc1 531847504 DYSXMFWFKNQELK-SFHVURJKSA-N 399.494 5.241 30 20 GKED C=CCN(C(=O)[C@H]1CCO[C@H]1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 536123583 YBIVKODVHWZESR-AAEUAGOBSA-N 397.327 5.061 30 20 GKED COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)Nc2ccc(C#N)cc2)c1 542192130 JMSSQLHOPRFJIA-BJKOFHAPSA-N 397.478 5.330 30 20 GKED C[C@](NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)(c1ccc(F)cc1)C(F)(F)F 543797215 UONJNEFGZWGTFM-GMXABZIVSA-N 385.323 5.088 30 20 GKED Cc1nc(-c2cccc(-c3noc(CSc4ccc(C#N)cc4)n3)c2)cs1 546401612 HJRZZFHJZNVCED-UHFFFAOYSA-N 390.493 5.333 30 20 GKED N#Cc1cccc(Cc2nc(-c3cccc(Oc4ccc(Cl)cc4)n3)no2)c1 547267223 IZRSZIOQWAMQFB-UHFFFAOYSA-N 388.814 5.040 30 20 GKED N#CCc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 558193927 YVTSRMPUHXNZQW-UHFFFAOYSA-N 398.249 5.499 30 20 GKED N#CC[C@@H](Cc1nc(Cc2csc(-c3ccccc3)n2)no1)c1ccccc1 565740891 UPOOTKOCEKOBQK-SFHVURJKSA-N 386.480 5.024 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccc(C#N)cc1C(F)(F)F 571216320 GWNUGYBVZWLPTC-UHFFFAOYSA-N 389.421 5.482 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)C1 596752949 KJCAMMAFOWHAKC-MRXNPFEDSA-N 383.879 5.077 30 20 GKED N#CC1(c2ccc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)cc2)CC1 598299041 CBFBAGZVJAYBTO-UHFFFAOYSA-N 392.343 5.025 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1[C@@H]2c3ccc(Cl)cc3C[C@H]21 599737671 OTEXAHJNKDRFTP-DJGFWBNSSA-N 397.931 5.052 30 20 GKED C[C@@H](Oc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cn1)c1ccccc1 603737967 YBNXXKMNOJCYPA-QGZVFWFLSA-N 385.467 5.275 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3C3CCCCC3)cn2)cc1 603828899 BQMWSFQHZFMFDL-OAQYLSRUSA-N 390.487 5.322 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3)cn2)c1 604510893 KLXMYTDRBLRWFV-UXHICEINSA-N 389.842 5.141 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)on1 609382834 UHVCVRKUGIAIAD-ZDUSSCGKSA-N 397.887 5.499 30 20 GKED C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)c1ccc(C#N)cc1 609813743 MTYXFKFZQISIAG-HNNXBMFYSA-N 376.529 5.505 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(Cn2cnc3ccccc32)cc1 611391950 BYJCIJMIJNRYAH-DEOSSOPVSA-N 392.506 5.123 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 611395013 DMVYRMLXPUNOSC-VWNXMTODSA-N 387.914 5.558 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3cc4ccccc4n3CC#N)c2C(C)C)cc1 616564253 MZTOGZBDSWINMM-UHFFFAOYSA-N 397.482 5.035 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccnc2Oc2ccccc2)c2ccccc21 618181727 WMLDDUNEQRDTEI-UHFFFAOYSA-N 396.450 5.385 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)c(Cl)c1 619457100 RCLXZMCWAWETCM-UKRRQHHQSA-N 377.246 5.070 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sc3cccc(C)c3c2Cl)cc1 634698209 DSJHGZIBEYSGAE-UHFFFAOYSA-N 399.903 5.423 30 20 GKED CN(Cc1ccco1)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646437064 IGGBMLIIPYGSJF-UHFFFAOYSA-N 398.278 5.233 30 20 GKED CN(C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)[C@H]1CC[C@@H](C(F)(F)F)CC1 685284461 MUNYGJAKRJAPKG-AOOOYVTPSA-N 389.286 5.177 30 20 GKED Cc1ccc2c(CC(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)c[nH]c2c1 726142582 IRVIJZNYQMUWCD-UHFFFAOYSA-N 395.462 5.108 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccc(Cl)cc2)c2cccs2)c1 726465789 LUKTZWWZPVSCHJ-LJQANCHMSA-N 382.941 5.459 30 20 GKED C#CCCOc1ccc(/C=C2/SC(=S)N([C@H](C)c3cccs3)C2=O)cc1 726629740 QKRARIDDGRSAIK-QFGUUYLXSA-N 399.562 5.113 30 20 GKED C[C@@H](CC#N)N(C)Cn1nc(-c2ccccc2Cl)n(C2CCCC2)c1=S 728901897 DGXNLHQJIHSMLW-AWEZNQCLSA-N 389.956 5.041 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2F)CCCC1)c1nc2cc(F)ccc2s1 730418349 UTZVNFDYNZPYRL-CQSZACIVSA-N 382.435 5.263 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 731331367 DPKRIANDIGVCAN-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1-n1cccc1 731332538 NWSXJFQXLPFVTJ-QGZVFWFLSA-N 375.497 5.432 30 20 GKED C[C@H](CNc1snc(Cl)c1C#N)Sc1ccc(Br)cc1 731663667 NMCHJQLMPOPLHZ-MRVPVSSYSA-N 388.743 5.023 30 20 GKED Cc1c([C@H](NC(=O)Nc2cccc(OCC#N)c2)C(C)C)oc2ccccc12 732696451 IIFGXWSKVFXEDT-HXUWFJFHSA-N 377.444 5.162 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@@H](C#N)C(=O)NC3CCCC3)sc2c1 732708143 MAQLWKUXJNPZJS-OAHLLOKOSA-N 388.920 5.059 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cc(C)sc1C 733080425 WUMIUHLALWCUIY-UHFFFAOYSA-N 391.422 5.072 30 20 GKED COCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3OC)cc2)cc1 741467540 NZJYXSLKTBVJOX-CXUHLZMHSA-N 388.463 5.284 30 20 GKED C[C@H]1/C(=C/c2csc(-c3ccccn3)n2)C(=O)c2cccc(Br)c21 742433935 BAHKENCWECWEAF-HOXUKUGESA-N 397.297 5.351 30 20 GKED C=CCn1c(SCc2cccc(Cl)n2)nnc1-c1ccc(Cl)cc1 743248465 UNIPSLIIHCTALA-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 746523556 RYLLMDIBDAADTC-XJKSGUPXSA-N 391.298 5.094 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)ccc1SC 747615023 RGAHZBBJVXQBPE-UITAMQMPSA-N 391.492 5.287 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)c2ccc(Cl)s2)cc1 750683830 IPULSONCIQDUID-CZUORRHYSA-N 388.920 5.195 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cc2ccccc2nc1N1CCCCC1 754712781 SZSDGSWCDXIXSW-UHFFFAOYSA-N 399.416 5.657 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cc(Br)ncc1F 762423194 OZTMZBLJLOGLTN-ARJAWSKDSA-N 395.278 5.064 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(-c2ccccc2)cc1)c1nc(-c2ccccc2)cs1 768127109 PATZKQBDJGJLJQ-NRFANRHFSA-N 395.487 5.723 30 20 GKED Cc1cccc(-c2nnc([C@@H](C)Sc3nc(C(F)(F)F)ccc3C#N)o2)c1 777569459 IZDLWBDHXUBGGE-LLVKDONJSA-N 390.390 5.184 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1SC1CCCC1 780479000 ALUGJNCPLZRRMJ-OAHLLOKOSA-N 381.501 5.656 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl 780668666 DLGCZVQAZUBURU-IAQYHMDHSA-N 390.270 5.093 30 20 GKED CC(C)(CNC(=O)c1ccccc1SCC#N)c1ccc(C(F)(F)F)cc1 787463484 HFHFTHQYASQWTB-UHFFFAOYSA-N 392.446 5.029 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccsc3)cc2F)c1 790315193 UGBGAQAZOVKXGE-UHFFFAOYSA-N 383.473 5.147 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cscc2Br)cc1 795205907 RMKDXLVTGBWWNE-MRXNPFEDSA-N 397.297 5.418 30 20 GKED C=CC[C@H](OC(=O)c1cccc(C[S@@](C)=O)c1)c1ccc(Cl)c(Cl)c1 797566409 JFZKNGFSWDBXDP-AVRWGWEMSA-N 397.323 5.346 30 20 GKED C[C@H](OC(=O)C(C)(C)c1csc(-c2cccs2)n1)c1ccc(C#N)cc1 799960468 WHGNVQRFOPWUIR-ZDUSSCGKSA-N 382.510 5.325 30 20 GKED C[C@H](Oc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1)C(F)(F)F 806608343 DJFHNLLUYUMICO-JTQLQIEISA-N 399.825 5.350 30 20 GKED N#Cc1c(F)cccc1/C=C(\Cl)c1nc(O)c2c3c(sc2n1)CCCC3 811685884 FZHOWVOJPCGWLL-JYRVWZFOSA-N 385.851 5.023 30 20 GKED C#C[C@@H](NC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccc(Cl)cc1 811946675 HOZYNBWHUVRGIP-GOSISDBHSA-N 399.277 5.072 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 814630069 SMRAVJJORVXKIB-HXUWFJFHSA-N 381.545 6.134 30 20 GKED COCc1ccc([C@H]2CCCN2C(=O)Nc2scc(C(C)(C)C)c2C#N)o1 821481424 KWKPFIQPDRDPIM-MRXNPFEDSA-N 387.505 5.026 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1 831617789 JSYFNFWNBFONAL-NHCUHLMSSA-N 390.612 5.014 30 20 GKED N#CCCC[C@@H](NCc1cc(Br)cnc1Cl)c1ccccc1 842710098 JWSKMHBKUUUKQW-MRXNPFEDSA-N 378.701 5.022 30 20 GKED C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942832 NYVRASDTEVUFLS-QIENPNARSA-N 392.402 5.199 30 20 GKED COc1ccc([C@@H]2C[C@H]2C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 850762746 NFXVHEQQVTVOKQ-XUVXKRRUSA-N 388.492 5.107 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)O[C@H](C)CC(C)(C)C#N 851207062 SBXOGTATHXAVFH-LLVKDONJSA-N 380.366 5.154 30 20 GKED C=CCCC[C@@H](NCc1ccccc1Oc1ccc(F)c(Cl)c1)C(=O)O 900068394 GZVYAKDGVPDRTB-GOSISDBHSA-N 377.843 5.171 30 20 GKED CC(C)(c1cc(F)cc(C#N)c1)c1nc(-c2c(Cl)cccc2Cl)no1 904310353 RPFMKUYMCNHNTG-UHFFFAOYSA-N 376.218 5.380 30 20 GKED COc1cc([C@@H](C)/N=C\c2cc(Cl)ccc2O)ccc1OCc1ccncc1 915981405 RTBDOZAXHALXNL-FWWWNHOTSA-N 396.874 5.208 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 916051839 UOMDVCLTNXEKRE-NLWGTHIKSA-N 386.417 5.649 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccnc(Cl)c2)cc1Cl 916056681 GCHLZZBWGVXKTD-KRWDZBQOSA-N 382.250 5.296 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)[C@@H](C#N)c5nc(C)cs5)(C4)C2)C3)cc1 916844227 YRVZHKBEOAEVDV-RBFUXZAUSA-N 390.552 5.474 30 20 GKED N#C[C@H](C(=O)COc1ccc2oc3c(c2c1)CCCC3)c1ccc2ccccc2n1 916849102 SBNMDQUJKPVNLH-FQEVSTJZSA-N 396.446 5.115 30 20 GKED N#C[C@H](C(=O)CCCC1CCCCC1)C(=O)Nc1ccc(Cl)cc1Cl 916927731 CGGZCYBDBRXGCR-OAHLLOKOSA-N 381.303 5.391 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)c2ccccc2OCC#N)c2cccs2)cc1 919990394 UJMMZIVXGWAVCU-JOCHJYFZSA-N 390.508 5.293 30 20 GKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 920140495 DPWVESMUMZLSST-HEDKFQSOSA-N 397.503 5.497 30 20 GKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 920791060 SYKYIZRJWLODIN-BZPMIXESSA-N 380.435 5.708 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 921120754 YQLABTDLBYQRER-HNNXBMFYSA-N 377.469 5.603 30 20 GKED O=C(O)c1cc(NN=Cc2cc(Cl)ccc2OC2CCCC2)ccc1Cl 1776033510 SGOLWLFUIVKJMY-UHFFFAOYSA-N 393.270 5.459 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)c2c(c1)C(C)(C)CC2 1776269184 AMSJWCFQVVJBIP-VQHVLOKHSA-N 394.486 5.941 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1c(Cl)[nH]c2ccccc12 1776354809 ZBDJTWYAXKYNEP-HJWRWDBZSA-N 383.831 5.203 30 20 GKED CC1(C)CCc2cc(/C=C3/CCCc4cc(C(=O)O)ccc4C3=O)ccc2O1 1776558144 OVIVAYZNAJPAKN-AQTBWJFISA-N 376.452 5.091 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776697647 LULIPAPXHHZLGX-IZTKXNPESA-N 384.475 6.461 30 20 GKED CCCCCCCC[C@H](C)C(=O)Nc1cc(C(=O)O)cc(Br)c1C 1776786033 DOASZEPAWKMFLM-ZDUSSCGKSA-N 398.341 5.781 30 20 GKED COc1cc(C#N)ccc1OCCCC(=O)Nc1ccccc1-c1cccs1 49621836 WQOHCJNHUGTYPI-UHFFFAOYSA-N 392.480 5.093 30 20 GKED CCc1ccccc1O[C@H](C(=O)[C@@H](C#N)c1nc(C)cs1)c1ccccc1 107407925 OLMSAZBYDHDEPI-NQIIRXRSSA-N 376.481 5.011 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1ccccc1SC[C@@H](C)C#N 108237338 BZFVRBPXIJFBDG-MAUBAPBLSA-N 380.513 5.074 30 20 GKED CO[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 132311811 XOWYLODXUUYHTH-QFBILLFUSA-N 382.872 5.027 30 20 GKED CCN(C(=O)CNc1ccccc1SC[C@@H](C)C#N)[C@H](C)c1ccc(F)cc1 153930605 YNFWELNSTHUMRX-DLBZAZTESA-N 399.535 5.099 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc1Cl 153936763 IRQHEQXVXSWPPE-UHFFFAOYSA-N 379.872 5.151 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccnc2ccccc12)c1nc2cc(Cl)ccc2s1 158786717 BRXSZEMRLRLEGL-YERXGYGTSA-N 389.867 5.388 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 173993296 PZFNUJCOAWLCKC-OWCLPIDISA-N 380.419 5.068 30 20 GKED COc1ccc([C@@H](Cc2ccccc2C)NCc2cc(C#N)cs2)cc1OC 177692603 HHGHZNFNMIVEMI-OAQYLSRUSA-N 392.524 5.019 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 184329951 WBXJKNKUHBJAHT-FGSXEWAUSA-N 377.488 5.291 30 20 GKED C=CCC[C@H](CCC)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 186468727 YODPCLIDXWTUFC-INIZCTEOSA-N 382.470 5.035 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2cccc(Cl)c2Cl)cc1 207054433 OSFSMKFXIRULEZ-YFHOEESVSA-N 387.266 5.202 30 20 GKED N#Cc1c(NC(=O)c2ccccc2COc2ccccc2)sc2c1CCCC2 247755730 WAQGCRQGPSPBQI-UHFFFAOYSA-N 388.492 5.330 30 20 GKED C[C@H](ON=Cc1ccccc1F)c1nnc(-c2ccc(Cl)cc2Cl)o1 255545369 SVLZWEDYPIXFDB-JTQLQIEISA-N 380.206 5.294 30 20 GKED CC(C)c1nc([C@@H]2CCCCCN2C(O)=Nc2cccc3ccsc23)no1 329525955 HIEJJTPPCDMUDD-INIZCTEOSA-N 384.505 5.571 30 20 GKED CC(C)c1nc([C@H]2CCCCCN2C(O)=Nc2csc3ccccc23)no1 329566479 SVMUGDIRLDJZOD-MRXNPFEDSA-N 384.505 5.571 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)N[C@H](C)c1ccccc1 409463500 FFWRNCOTVLZUGW-CQSZACIVSA-N 391.284 5.047 30 20 GKED CN(C(=O)c1cscc1C#N)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 410671399 IKXCEZHYOALUQT-WBVHZDCISA-N 378.419 5.047 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1c(Cl)cccc1[N+](=O)[O-])c2C#N 410992185 WLKKEKKBFMXEHL-ZJUUUORDSA-N 389.864 5.119 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1 432088657 KIWNDCIGLKQQPD-IXDOHACOSA-N 397.519 5.535 30 20 GKED O=C(NCc1c(F)cc(F)c(F)c1F)Nc1ccccc1CCC(F)(F)F 432218785 NLWYYDZUBUHUQL-UHFFFAOYSA-N 394.290 5.060 30 20 GKED CC(C)(C)Oc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 432238732 ULNYHPRGVBCVHG-SFHVURJKSA-N 376.481 5.477 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1ccc(Br)cc1)C(C)C 432269137 IIOXWHBXYIDWGK-UHFFFAOYSA-N 386.293 5.072 30 20 GKED N#Cc1csc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436401971 SKHVOMZKHOWETJ-CQSZACIVSA-N 378.341 5.422 30 20 GKED CCS[C@H]1CC[C@H](N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C1 437107354 PHUZDFOUGVHTBD-WMZOPIPTSA-N 398.503 5.236 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H](C)CCC[C@@H]1C 437965677 UFNHVBRQHLJKKT-MJGOQNOKSA-N 391.515 5.488 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C1CC1 438667511 UHPXGRXZCDTBPT-CQSZACIVSA-N 379.435 5.284 30 20 GKED CC(C)[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCS1 438672358 QFPBHMRHJVAEAV-HXUWFJFHSA-N 399.491 5.095 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)N[C@@H](CCC#N)c2ccccc2)cc1 440251947 FFDROUXILSIVNC-GOTSBHOMSA-N 391.515 5.367 30 20 GKED CCN(C(=O)Cc1ccc(NCc2ccc(C#N)c(C)c2)cc1)c1ccccc1 443977783 FCHDTVLQDGCDRQ-UHFFFAOYSA-N 383.495 5.074 30 20 GKED Cc1nc(CC(C)C)c(NC(=O)c2cn(CCCC#N)c3ccccc23)s1 444303384 MIKHYZLHJNSRLQ-UHFFFAOYSA-N 380.517 5.161 30 20 GKED C=CCC[C@H](NCc1nncn1-c1ccccc1)c1ccc(C(F)(F)F)cc1 444685424 RMZGCRRHSYLEFK-IBGZPJMESA-N 386.421 5.083 30 20 GKED Fc1ccc([C@H](NCc2ncccc2C(F)(F)F)C(F)(F)F)cc1Cl 444810335 DZSWXZONINBKTG-ZDUSSCGKSA-N 386.698 5.286 30 20 GKED C=CCCCNC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 447991020 NWKJHBVLLMHIAA-UHFFFAOYSA-N 382.851 5.163 30 20 GKED C=CCCCNC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 448389833 PMOGCEGMYCZIKU-UHFFFAOYSA-N 378.303 5.066 30 20 GKED C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCC[C@H]1c1ccccc1Cl 453461071 NQRPGBDTPMYLIX-SNRMKQJTSA-N 386.927 5.089 30 20 GKED C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1C(=O)Nc1ccccc1SC[C@H](C)C#N 454762997 YFJVAYQKUSZNCQ-LXTVHRRPSA-N 399.482 5.522 30 20 GKED O=C([C@H]1CCC[C@@H](C(F)(F)F)C1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 456563247 ADCYPSMAIYTQMK-ZRUFSTJUSA-N 399.297 5.087 30 20 GKED C=CC[C@@H](C)NC(=O)N[C@@H](c1cccc(SC)c1)c1cc(F)ccc1F 466240421 FKNBGIPLFWVQSQ-YJYMSZOUSA-N 376.472 5.040 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 471272601 KRWXLDWBGXNDOH-SFHVURJKSA-N 379.529 5.691 30 20 GKED C=CCn1c(SCC[C@H](C)OCc2ccccc2)nnc1-c1ccoc1C 473413437 ROKUDADTHCWUJA-INIZCTEOSA-N 383.517 5.120 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1Cc1c(F)cccc1Cl)c1ccccc1 474968154 NDIXLUJRGGRJAI-QZTJIDSGSA-N 384.882 5.100 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(-c3ccccc3C(F)(F)F)o2)n1 475033488 ZPGIOEILWGLNEP-GFCCVEGCSA-N 376.359 5.220 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)C[C@@H](CC#N)c1ccccc1 475366023 GFFMWWKZSYRXKW-DENIHFKCSA-N 388.536 5.925 30 20 GKED N#C[C@@H](C(=O)c1coc(C2CCCCC2)n1)c1nc2cc(Cl)ccc2s1 484050636 XSSDFTBIUOINMC-ZDUSSCGKSA-N 385.876 5.475 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2c2ccccc2)c1 497437889 AFKRUKXWQPPIJU-XMMPIXPASA-N 382.463 5.115 30 20 GKED C=CCOc1ccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc1OC 502184678 YKTSYMXBFQUPLC-QNGOZBTKSA-N 388.423 5.152 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 503214709 DOPZAJMDFNOOPN-AZUAARDMSA-N 393.556 5.486 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1ccc(F)cc1Cl 503222800 FZAHSUIEIIEFME-ZDUSSCGKSA-N 391.899 5.238 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 504012999 KWRXJZMVDUSKFE-INIZCTEOSA-N 398.428 5.072 30 20 GKED N#C[C@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1cccc(C(F)(F)F)c1 505917180 NVPDDUOQKGAUPX-AWEZNQCLSA-N 391.151 5.146 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(=O)c1cccc(OC)c1 506045604 HOYAKRKNTCJBLR-UHFFFAOYSA-N 379.500 5.539 30 20 GKED Cc1nc(-c2ccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)cc2)cs1 506050500 BTALVVRNPWLKPK-UHFFFAOYSA-N 379.460 5.046 30 20 GKED CC(C)(C)c1cnc(CN(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)o1 513430347 QBQWQCZKVALJPX-UHFFFAOYSA-N 377.463 5.185 30 20 GKED C=CCn1c(S[C@@H](C(C)=O)c2ccccc2)nnc1-c1ccc(Cl)cc1 514197536 OXOZCDNKYZNREC-SFHVURJKSA-N 383.904 5.207 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@@H](Cn1cnc3ccccc31)c1ccc(F)cc1)CC2 515925371 SXUBJCOTINJHHH-VWNXMTODSA-N 396.469 5.065 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(F)c(F)c2F)cc1 518037030 HDSGUAPETOOVAM-UHFFFAOYSA-N 386.304 5.159 30 20 GKED C[C@H](N[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 531695843 MKLPDQGMPPFPJU-RYUDHWBXSA-N 386.339 6.008 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 536074209 YPAMNVQRLLSGOM-NRFANRHFSA-N 398.915 5.801 30 20 GKED COc1cc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)ccc1SC 537012008 ACQIYBOINDAYIT-QGZVFWFLSA-N 388.536 5.807 30 20 GKED Cc1ccc(C)c(Oc2ccc(CN[C@H](C)c3ccc(C#N)cc3F)cn2)c1 541904815 PVPDPFJHOMYBDY-QGZVFWFLSA-N 375.447 5.352 30 20 GKED Cc1ccccc1NC(=O)CCN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542014778 YSPCKDAUAOJEKH-IBGZPJMESA-N 383.495 5.213 30 20 GKED C[C@H](C#N)CN(C)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 549658629 DKSVRCJRCKEZBZ-RDTXWAMCSA-N 381.442 5.128 30 20 GKED N#Cc1c(NC(=O)CC2(C(F)(F)F)CC2)sc2c1-c1ccccc1CC2 554696450 SGMHQQIWSPLAJX-UHFFFAOYSA-N 376.403 5.056 30 20 GKED C=CCN(C(=O)c1cc(F)cc2cccnc12)c1nc(-c2ccccc2)cs1 560002389 IWOFKNRHLOBRAR-UHFFFAOYSA-N 389.455 5.330 30 20 GKED CC(C)CN(Cc1nnc(-c2cccc(C#N)c2)o1)[C@@H](C)c1ccccc1Cl 560180047 XLRMWENPYJVELK-INIZCTEOSA-N 394.906 5.481 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(F)c1Br 570298867 JFUGUOYEMXKNLW-NSHDSACASA-N 393.281 5.092 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 577644261 FXSLWLMOIOYHFX-HNNXBMFYSA-N 375.403 5.017 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Cc1cccc(OCc2ccccc2Cl)c1 591955595 JNMBQFQDAZITMT-UHFFFAOYSA-N 397.824 5.038 30 20 GKED N#CC[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)C1 596297599 RTRIUOMLQVBMNS-DVECYGJZSA-N 383.495 5.264 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 603559424 OBGWUPBMORDCFM-QZTJIDSGSA-N 390.508 5.177 30 20 GKED CC(=O)c1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1 604842076 OFBZJLQPWXOGCT-UHFFFAOYSA-N 390.826 5.459 30 20 GKED CC(C)CN(C(=O)c1csc(Cc2ccc(F)cc2)n1)c1ccc(C#N)cc1 608871356 XPTATPVCUNBDLY-UHFFFAOYSA-N 393.487 5.047 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)[C@H]1CCc2ccccc21 609297284 BBQDPPMDXXLGAY-QFIPXVFZSA-N 386.426 5.249 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)cc1F 609427856 WLWFBYTUPHJGHU-NSHDSACASA-N 393.281 5.235 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)c1ccccc1F 609434694 JMFKVJBMIQFPOV-OAHLLOKOSA-N 385.508 5.319 30 20 GKED C[C@H](NC(=O)N[C@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 610138588 NWZMVMJFCMTXFL-GAJHUEQPSA-N 387.458 5.042 30 20 GKED Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NCc1ccc(C(C)(C)C#N)cc1 614056373 SEQGQRWVVNPEDG-IBGZPJMESA-N 389.543 5.423 30 20 GKED COc1cc(CN[C@@H](C)c2ccsc2)ccc1OCc1cccc(C#N)c1 619782619 GOTWMTHOFLFCKJ-INIZCTEOSA-N 378.497 5.058 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)nc(Cl)c3)cc2)c1 728005451 LOQVGNUALOGPHF-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 728764480 AVYJPTHPEMDDEO-IRXDYDNUSA-N 382.916 5.956 30 20 GKED C#Cc1ccc(C(=O)N(Cc2cccc(F)c2)[C@H](CC)c2ccc(F)cc2)cn1 728815522 HIABKNADCLVWPW-HSZRJFAPSA-N 390.433 5.135 30 20 GKED CC(C)c1ccc(CSc2nn(CN(C)[C@@H](C)CC#N)c(=S)s2)cc1 728902950 YYYAPIHUFUNPIU-AWEZNQCLSA-N 392.619 5.281 30 20 GKED Cc1cc(C)cc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 730664613 NFCZFASERAFZFZ-NTKDMRAZSA-N 383.495 5.842 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)Cc1ccc(OCC#N)cc1)C1CC1 731978854 AWKJMZMLHXHKBW-GOSISDBHSA-N 384.479 5.037 30 20 GKED COc1ccc(/C=C\C(=O)c2sccc2Br)c(OC(F)F)c1 734094731 GKJLOXRKBSRFLZ-HYXAFXHYSA-N 389.217 5.017 30 20 GKED C=CC[C@@H](NC(=O)NCC(C)(C)c1c(Cl)cccc1Cl)c1ccncc1 734667582 INRAMNYSOLLCKW-QGZVFWFLSA-N 392.330 5.283 30 20 GKED C=CC[C@@H](NC(=O)N(CCCCC)Cc1ccc(Cl)cc1)c1ccncc1 734683874 RFMASBSXHQEPPJ-OAQYLSRUSA-N 385.939 5.754 30 20 GKED CN(C)c1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1 734986582 QNTJKJIBMGLOPP-UHFFFAOYSA-N 391.858 5.322 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3c(Cl)nc4ccccn34)cs2)cc1 737445610 BTWCMOPYADIHBX-YFHOEESVSA-N 395.871 5.016 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@@H]2c2ccc(C)o2)c1 739023267 LJHGFWFFDLFXTR-PZJWPPBQSA-N 395.503 5.096 30 20 GKED CCOc1ccc(C=Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c(O)c1 743043866 BNBXDYFNUABOMX-HNNXBMFYSA-N 384.476 5.127 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC3(CCCC3)C2)cc1F 743238807 WBMQTPZZKOCGJF-UHFFFAOYSA-N 379.435 5.288 30 20 GKED N#Cc1csc(/C=C(/Cl)c2ncc(-c3ccccc3Br)o2)c1 748440878 RUOKXFNZEXHPAB-MKMNVTDBSA-N 391.677 5.774 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2C[C@@H]2c2sccc2C)cc1 748835204 UNFIIRRAJFUVCR-ZQEOTTOMSA-N 380.513 5.021 30 20 GKED Clc1ccc(-c2nc(CON=Cc3ccccc3Br)co2)cc1 749349919 AJRRTKFISQVSNY-UHFFFAOYSA-N 391.652 5.308 30 20 GKED Cc1cc(Cl)cc2c1OCC/C(=C\c1cnc(-c3ccccn3)s1)C2=O 768501010 SPNKSCZVINFXMX-UKTHLTGXSA-N 382.872 5.216 30 20 GKED OC1(c2cccc(F)c2)CCC(=NOCc2ccc(C(F)(F)F)cc2)CC1 783857219 XIDCNAHUUBRAEH-UHFFFAOYSA-N 381.369 5.179 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ncc(Cc2ccccc2Cl)s1 787212697 CPNKNMVEXMOULC-UHFFFAOYSA-N 399.928 5.255 30 20 GKED FC(F)(F)CC(=NNc1nnc(-c2ccccn2)s1)c1ccc(Cl)cc1 788028375 WRGXNZVINNYPOW-UHFFFAOYSA-N 397.813 5.022 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1sc(-c2ccc(C)cc2)nc1C 789086277 QVHGLIRJFNPHOB-UHFFFAOYSA-N 388.496 5.105 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C 789890606 SHFXQSLBVXKWKU-MRXNPFEDSA-N 396.478 5.026 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 845842118 RHLHHWKHZMGPTF-LBKOFNPBSA-N 397.396 5.118 30 20 GKED O=c1c2ccccc2ncn1N=Cc1c2ccccc2c(Cl)c2ccccc12 916369799 PALSZOUGKZNYIM-UHFFFAOYSA-N 383.838 5.239 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1 916410655 AEYBEQZUYLYNFW-UHFFFAOYSA-N 384.464 5.157 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)/C=C\c3ccccc3F)c2)cc1 916449790 MYNXURNRJCGRKV-RAXLEYEMSA-N 386.426 5.123 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)Cc2coc3cc(C)ccc23)cc1 916955704 TUYDZTMMMBPJTM-HRAATJIYSA-N 388.467 5.145 30 20 GKED CC(C)c1cccc(NC(=S)Nc2ccccc2Oc2ncccc2C#N)c1 917575151 VEZLOEXTUSYAAT-UHFFFAOYSA-N 388.496 5.678 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C/c1ccc2ccccc2n1 917712540 HKJMYVCLZUCZEI-OUKQBFOZSA-N 381.460 5.487 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(-c2cccnc2)nc2ccccc12 918383650 ZMICOQCUAZTWBM-UHFFFAOYSA-N 397.453 5.264 30 20 GKED Cc1cccc(OC[C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 919773607 TYDFQSCUJNTUFO-YADARESESA-N 399.494 5.240 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\c1ccccc1C#N 919893236 BYWLZYNWUNWZIY-JYRVWZFOSA-N 379.419 5.183 30 20 GKED CCOc1ccc(C=Nc2cccc(COCc3ccc(OC)cc3)c2)c(O)c1 921138534 QPQFREYMCMZGPG-UHFFFAOYSA-N 391.467 5.267 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1)C(=O)O 1776469865 WSRRDLBCBAJFBH-BJTBTHHMSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc(F)cc2C)o1 1776783053 WLKLWAJWFPILCK-GOSISDBHSA-N 375.484 5.688 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](C(=O)O)C2CCCCCC2)c1 1776788715 QVPRNNVAGAOSFJ-HSZRJFAPSA-N 389.580 5.797 30 20 GKED Cc1ccsc1C(=O)/C=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1777477296 YXLWBZPBEHTJHC-CTDFXDFQSA-N 378.449 5.157 30 20 GKED O=C(/C=C\c1ccc(F)c(C(=O)O)c1)c1ccc(-c2c(F)cccc2F)cc1 1777570072 LUCGEFABFXFCRG-WZUFQYTHSA-N 382.337 5.365 30 20 GKED O=C1/C(=C\c2cccc(SC(F)(F)F)c2)C[C@H](C(=O)O)c2ccccc21 1777698386 KKWDKNOFRWBIBI-LJEUOOAZSA-N 378.371 5.137 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 6793505 DOFPNSMYDGILOO-HXUWFJFHSA-N 376.843 5.256 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)cc2)[n+]2cccc(C)c2)cc1 28777521 OOBWCZPLIGPQDV-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccc(Cl)cc2)nn1-c1ccccc1)c1ccccn1 41493740 HIACDBNVPWPRPR-IBGZPJMESA-N 398.853 5.078 30 20 GKED C=CCn1c(SCc2csc(Nc3ccccc3)n2)nnc1-c1ccco1 46560302 AOOBVPZJMIVILS-UHFFFAOYSA-N 395.513 5.217 30 20 GKED CCOCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 51285579 AIASLGFBFKRNBY-ZDUSSCGKSA-N 383.300 5.110 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2o1 54736779 HVIVLQFCWRJRKV-CMPLNLGQSA-N 391.279 5.492 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2SCc2c(C)noc2C)c1 55723693 FKPISQDKZFIXOK-UHFFFAOYSA-N 394.496 5.401 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3ccc(OC(C)C)cc3)cc2c1C 59270008 HUIVTQSBWGXILY-JXMROGBWSA-N 395.480 5.075 30 20 GKED C=C(C)CNC(=S)N(CC)Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 63674684 SVMCMABCLBMHSI-UHFFFAOYSA-N 382.451 5.238 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3csc(Br)c3)cc2)cc1 66037388 CUEMRXVJNJUOPG-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc4ccccc4[nH]3)s2)c(C)c1 126908106 LJDBSLKCWFQOSF-INIZCTEOSA-N 386.480 5.102 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2c(F)cc(C#N)cc2F)cc1)c1ccccc1 132266124 JJNMLMWDABQSSH-CQSZACIVSA-N 377.394 5.262 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C 173115582 NFLIKRLQZKSBSP-IIBYNOLFSA-N 393.556 5.924 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1 191425835 AIIINWXHOZYRSG-NRFANRHFSA-N 398.934 5.797 30 20 GKED OC1=N[C@H](C/C(O)=N/C2(c3ccc(Br)cc3)CCCC2)CCC1 329325381 IOZLSHANBTWDHV-HNNXBMFYSA-N 379.298 5.074 30 20 GKED O/C(=N/[C@@H]1CCCc2c[nH]nc21)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 330153590 MWBPVJPNOAZCON-HLLBOEOZSA-N 378.501 5.103 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 409471235 QDZWUICLDMJJJX-UXHICEINSA-N 386.417 5.118 30 20 GKED C=C(C)CN(CC)C(=O)c1ccc(COc2ccccc2Br)cc1 410180800 LVQXCFKJSPNULY-UHFFFAOYSA-N 388.305 5.066 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc([C@H](C)C(=O)OC)c1 417045990 RXPZBVXFEIOTDI-INIZCTEOSA-N 380.488 5.459 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ncc(-c2cccs2)o1 425531568 HTGCQTBSKWSEKP-CYBMUJFWSA-N 391.418 5.336 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C1CC1)[C@@H](C)C1CC1 437834028 CGNQBCZQQQSWAU-INIZCTEOSA-N 375.472 5.454 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 438841139 OUTCFYBISRGQOY-MSOLQXFVSA-N 375.394 5.024 30 20 GKED N#C[C@H]1CC[C@@H](NCCc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1 442774458 AJQOPHGNNHLQHD-LAUBAEHRSA-N 390.918 5.017 30 20 GKED CC(C)(C#N)CCCCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444671797 IQBCSZXREARLCM-HNNXBMFYSA-N 380.376 6.009 30 20 GKED N#CCCC[C@@H](NCc1cnc(CCc2ccccc2)s1)c1ccccc1 449342181 ZPXXGOIHNHREAD-JOCHJYFZSA-N 375.541 5.453 30 20 GKED Cc1c(Cl)cccc1-n1c(S[C@H]2CC[C@H](C#N)C2)nnc1-c1ccncc1 450632223 MHPWFWSHMQVCIF-HOCLYGCPSA-N 395.919 5.076 30 20 GKED C=CCC[C@@H](CC)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 461892051 YWKVXNMTHWYUQJ-TZIWHRDSSA-N 391.964 5.167 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)o2)cc1 464407800 HOLHWCQKZDFFBS-INIZCTEOSA-N 398.340 5.053 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)Nc2ncccc2OCCCC#N)cc1 466604156 LFEYAFOYYVHSOK-MRXNPFEDSA-N 398.532 5.147 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3csc4ccccc34)ccc21 468956190 LGUNTMFARPADSE-UHFFFAOYSA-N 375.497 5.096 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCCC3(CCC3)C2)cc1 471260339 ZLUHFAFQMTZHPE-UHFFFAOYSA-N 389.499 5.130 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3ccc4ncccc4c3)cc2)cc1 471564626 ULKNETLHHLUGPD-UHFFFAOYSA-N 393.446 5.023 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)Cc1ccc(OC)c(OC)c1 475556321 PMRPMOKQJFRONQ-KRWDZBQOSA-N 396.531 5.308 30 20 GKED Clc1ccc(OCc2nnc(SCC#Cc3ccccc3)o2)c(Cl)c1 478528156 MEIOXDWUCWCETO-UHFFFAOYSA-N 391.279 5.099 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(C#N)c(F)c1)c1ccccc1Cl 479455154 RJDIRKVTNVEGSK-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CCCN(C(=O)Nc1ccc(OC(C)C)c(C#N)c1)[C@@H]1CCCc2cccnc21 480967938 YOXXEWKZUAFSMN-HXUWFJFHSA-N 392.503 5.062 30 20 GKED C[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 481915148 BRYMAPOZMZMESL-BCHFMIIMSA-N 397.522 5.651 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@@H](c3ccccc3)[C@@H]3CCCO3)c2)cc1 483668880 NZAWEKFOLUECJW-ZEQRLZLVSA-N 398.462 5.001 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1-c1ncco1 483768689 JSODKLAEOAZQRU-UHFFFAOYSA-N 388.471 5.212 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(N2CCSCC2)cc1C 485307505 YMEOXWVZIJDHLV-UHFFFAOYSA-N 387.593 5.148 30 20 GKED N#CCCN(C(=O)c1ccc(SC2CC2)cc1)C12CC3CC(CC(C3)C1)C2 486572716 GPWCSYUOZXLWMY-UHFFFAOYSA-N 380.557 5.266 30 20 GKED C=CCSc1ccccc1C(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1 486708763 PLNFHLSGVJUOGL-UHFFFAOYSA-N 398.915 5.512 30 20 GKED CC(=O)c1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cs1 496027178 FNOSSTTYWWYJAT-CQSZACIVSA-N 386.885 5.218 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC=C(c4ccccc4)C3)cc2)cc1 497646245 IILQSIFIDJXPRV-UHFFFAOYSA-N 381.435 5.282 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 499326231 YRNXYVZXJJDELF-JOCHJYFZSA-N 381.495 5.088 30 20 GKED N#C[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccc1Cl 499951798 OQNAAGWPYNNEAJ-CYBMUJFWSA-N 395.698 5.856 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2ccc3ncsc3c2)sc2ccc(C#N)cc12 501353616 KWXLJVJFOATDKW-LBPRGKRZSA-N 377.494 5.182 30 20 GKED CCC[C@H]1C[C@H](C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 502799647 SPIVZEITCQITAZ-IRLDBZIGSA-N 394.490 5.134 30 20 GKED CC(C)c1ccsc1C(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1 505321439 USDOHPRINROJSW-NRFANRHFSA-N 390.508 5.445 30 20 GKED C=C(C)COc1cc(CN[C@H]2CCCc3cn(C4CCCC4)nc32)ccc1OC 505995215 BWJJPZSBHXFNBI-NRFANRHFSA-N 395.547 5.129 30 20 GKED Cc1c(C(=O)NC23CCC(C(F)(F)F)(CC2)CC3)sc2ccc(C#N)cc12 508546274 RXKPLVZQVDUZQL-UHFFFAOYSA-N 392.446 5.467 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513414717 OYTNFWZMOPKMRX-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CCCCCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 515118277 VWYASZLGURHKNW-UHFFFAOYSA-N 381.495 5.851 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2sccc2Br)n1 517096485 CZMVMEIVSLFYDA-UHFFFAOYSA-N 393.253 5.397 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 518170138 ZXMJNIGSMIZUFC-IAGOWNOFSA-N 397.544 5.608 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1Cl 518239675 KIEGVZYIEZCKLJ-CABCVRRESA-N 388.920 5.449 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2ccccc2)nc1)c1cccc(Cl)c1Cl 518709352 TYLUZBYKJWWMPV-QGZVFWFLSA-N 398.249 5.175 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 520678091 UTTHANZIQNYNSG-AWEZNQCLSA-N 379.378 5.417 30 20 GKED C=C(C)COc1cccc(NC(=O)N(CC)[C@H](C)Cc2ccc(OC)cc2)c1 521808534 JIQYZPRCWHQWOK-GOSISDBHSA-N 382.504 5.135 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 522704571 GYHCJAGXVINPKB-LJQANCHMSA-N 391.515 5.376 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(Cl)c2SCC(F)F)cc1 522953098 OHZYXYUSLDQNRW-UHFFFAOYSA-N 398.887 5.300 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1 523142203 ZLBRMCDREMYOMG-CPJSRVTESA-N 390.527 5.416 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2cscc2s1 528918435 IRWWAGMZGYBZNC-OAHLLOKOSA-N 382.510 5.049 30 20 GKED N#CC1(NC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CCSCC1 534457650 OJKLDPDUEULBKZ-UHFFFAOYSA-N 397.352 5.241 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3cc(C#N)ccc3OC(C)C)ccc2c1 546725022 LMOMYLRBZHAWBJ-INIZCTEOSA-N 388.467 5.249 30 20 GKED Cc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1F 553315280 XOZYMMDGWAETFA-UHFFFAOYSA-N 391.421 5.379 30 20 GKED Cc1cc(C(=O)Nc2[nH]nc(C3CC3)c2C#N)sc1-c1cccc(Cl)c1 554640082 DFIKILVFIOOFFP-UHFFFAOYSA-N 382.876 5.101 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)C(=O)Nc1cccc2ccccc12 557559884 XTPMHRUHWADZSI-SJORKVTESA-N 389.524 5.531 30 20 GKED C=CCC[C@H](N[C@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 572020914 MJUKHYLAWMJZMS-HRCADAONSA-N 381.360 5.412 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(CN2CCCCC2)cc1 576420247 YALSOBLOZFFRTA-GOSISDBHSA-N 393.556 5.177 30 20 GKED N#CC[C@H](Cc1nc(CCc2c(Cl)cccc2Cl)no1)c1ccccc1 577102607 OQYANODKRXNXCA-OAHLLOKOSA-N 386.282 5.402 30 20 GKED N#Cc1cc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)nc2ccccc12 584805478 UGHDMBZNDBWOEK-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc(C4CC4)[nH]c3C3CC3)cc2)ccn1 599949354 PQBKEKQRBGXGEY-UHFFFAOYSA-N 384.439 5.081 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc2ccccc2n1CC#N 609162569 NPFQZGWNCIBRBB-CQSZACIVSA-N 385.389 5.017 30 20 GKED Cc1cc(F)ccc1N(Cc1ccco1)C(=O)c1cc2ccccc2n1CC#N 609215607 GCJJZJHSSVJVOF-UHFFFAOYSA-N 387.414 5.052 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCOc1cccc2ccccc12 609378854 XLJNNBJVRTWGMC-UHFFFAOYSA-N 390.508 5.643 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)CCCCOc1cccc(C#N)c1)C1CC1 609500100 OFHCGGKVJLFPKQ-KRWDZBQOSA-N 396.918 5.513 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2c(C)c(C)ccc2[nH]1 609731129 NXPPPSXDVUHPIE-UHFFFAOYSA-N 396.450 5.404 30 20 GKED N#Cc1ccc(SCC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)cc1 609757531 IFLFAWPFCSFDIH-HXUWFJFHSA-N 384.932 5.448 30 20 GKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 610014577 BHZPBOCKQNQQHH-PGRDOPGGSA-N 375.516 5.801 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@H]1C 610019312 LWKLLRJLCSDVNE-LSDHHAIUSA-N 383.492 5.229 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2ccncc2)n1-c1ccccc1C 614397283 IIMCEJYNJRXXAH-UHFFFAOYSA-N 397.507 5.110 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 615971613 PBOHQNYQRSGERH-DLBZAZTESA-N 377.381 5.163 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1F 675737556 HTGDCNUDSSCCNR-GUBZILKMSA-N 375.303 5.525 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1ccc2ccccc2c1O 725831831 ZHCUAGJIFIXNNC-UHFFFAOYSA-N 396.372 5.344 30 20 GKED C=CCOc1ccc(/C=C\C(=O)O[C@H](C)c2cnc3ccccc3c2)cc1OC 726333469 YFPBFSRDDVONEF-XSLBHYSZSA-N 389.451 5.126 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccc(OC)cc4)sc3C2=O)cc1 727780811 UCQWNLGKQAGDKQ-SSZFMOIBSA-N 377.465 5.040 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cccc(OCC#N)c1 730149366 GXWKBRYQTZIRGG-YHYXMXQVSA-N 394.883 5.570 30 20 GKED C#CCN1CCC(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)CC1 730503124 MONCMKQZTNBSJA-UHFFFAOYSA-N 394.518 5.304 30 20 GKED Cc1cc2occ(CC(=O)OCc3ccc(OCC#N)cc3)c2cc1C(C)C 733396032 YOHUOQGEWFFKFI-UHFFFAOYSA-N 377.440 5.053 30 20 GKED C=CC[C@H](NC(=O)NCC1(c2ccc(F)cc2)CCCCC1)c1ccncc1 734663115 HKOOLZVICXAAMA-NRFANRHFSA-N 381.495 5.039 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1ccccc1F)C1CCCC1)c1ccncc1 734682405 CWAULTYWUOMZQT-JOCHJYFZSA-N 381.495 5.035 30 20 GKED Cc1nc(-c2ccccc2Br)sc1C(=O)/C=C/c1nccs1 735232388 NIIDTGDXPHYLTF-VOTSOKGWSA-N 391.315 5.234 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1Br 741469753 MNXWTWBONKYCTE-ALCCZGGFSA-N 394.268 5.416 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)N[C@@H]3CCc4ccccc4C3)cc2)cc1 742990182 KWUVCEYDFYMQOG-OAQYLSRUSA-N 399.519 5.194 30 20 GKED CN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccccc2)cc1 743011805 WHQUQRYWPTXEFJ-UHFFFAOYSA-N 377.900 5.712 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(Cl)c2)CCCC1)c1ccc2ccccc2n1 744017008 XHZVTLIMDPOLEZ-HXUWFJFHSA-N 388.898 5.868 30 20 GKED COc1ccc(CNC(=O)N(Cc2ccccc2)[C@H](C)c2ccccc2)cc1C#N 746781127 MBGSUCUYAAYTPO-LJQANCHMSA-N 399.494 5.040 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1C(F)(F)F 747197950 PGQAQALLMONOQK-CEFACKQISA-N 378.419 5.565 30 20 GKED C#CC[C@@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccccc1 757778503 NPZWGRKZXLINSH-HXUWFJFHSA-N 386.417 5.144 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 767048598 YPVPYMMAUSJYPC-AVRDEDQJSA-N 389.543 5.084 30 20 GKED Cc1cc(C(=O)Nc2cc(C#N)cn2C(C)(C)C)ccc1NC(=O)OC(C)(C)C 772069855 JSLBYBBIRQUDTB-UHFFFAOYSA-N 396.491 5.023 30 20 GKED Cc1nc(-c2ccc([C@@H](C)N[C@@H](C)c3ccc(OCC#N)cc3)cc2)cs1 776153657 CAGKOTGUQBWTBK-CVEARBPZSA-N 377.513 5.433 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl 780169556 LUPYFFZQYXEHJL-LZGFCCKTSA-N 394.780 5.302 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3)cc2OC)c1 781417059 YBABAGGYNGZSAT-HSZRJFAPSA-N 386.495 5.333 30 20 GKED CC(C)(C#N)CCCOC(=O)C(C)(C)Sc1ccc(Br)cc1 783734474 WXWSYIQTMMQFQV-UHFFFAOYSA-N 384.339 5.193 30 20 GKED O=C1C/C(=C\c2cnc(-c3ccc(Cl)cc3)s2)C(=O)c2ccccc2N1 789149445 YWIXMFUWXGRFCX-UKTHLTGXSA-N 380.856 5.072 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 789621648 SOBUTKBGICMAOG-HXUWFJFHSA-N 387.508 5.312 30 20 GKED Cc1cc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)sc1Br 794732291 HVOKNIZXRWHEJZ-NSCUHMNNSA-N 391.315 5.234 30 20 GKED C[C@@H](N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1ccc(OCC#N)cc1 798940159 BSQXNAVCXJRDSV-KBRIMQKVSA-N 375.299 5.493 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)C(=O)Nc3ccc(Cl)cc3)c2c1 805854149 RCWRELZJIBZPEF-QGZVFWFLSA-N 380.831 5.171 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1c(F)cccc1Cl 809159020 GJIMQTJSWLCCHF-FPLPWBNLSA-N 388.807 5.407 30 20 GKED C=C(C)CNC(=S)/C(=C(/O)c1ccc(-c2ccccc2)cc1)[n+]1ccccc1 839406918 NCUBBOSUEBAPNN-UHFFFAOYSA-O 387.528 5.018 30 20 GKED N#CC[C@H](Cc1nc(-c2cccc(Oc3ccccc3)c2)no1)c1ccccc1 904591839 RTMGVELPWRZSRZ-LJQANCHMSA-N 381.435 5.769 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)c1ccccc1SC(F)(F)F 915869390 FLKNXRHUUSLLHY-UHFFFAOYSA-N 397.315 5.386 30 20 GKED Cc1ncsc1C(=O)/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1 918713272 QJSPLOCHILYBCV-SREVYHEPSA-N 380.416 5.490 30 20 GKED CC(C)(C)c1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 920221767 OSXMZQWASOBRMH-GOSISDBHSA-N 375.497 5.348 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c(OC)c1 1776114161 HUKAABOGMKVCTK-JXMROGBWSA-N 394.448 5.027 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776794109 SXYFJCNFRFLDTI-LCYFTJDESA-N 396.483 5.637 30 20 GKED COc1ccc(C(=O)O)cc1/C=C\C(=O)c1sc2c(C)cc(C)cc2c1C 1777354853 YIXFUHMNLJCWTB-ALCCZGGFSA-N 380.465 5.429 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 1777640987 MSXLNBRXOKDSAY-YVMONPNESA-N 399.657 5.396 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(C)(C)CC)CC1 1831388283 KWOOIEUWXJFXCM-FQEVSTJZSA-N 390.612 5.035 30 20 GKED Cc1cc(C)cc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)c1 6367159 CJYSYPGWYWSKRO-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cn1c(SCc2ccc(C#N)cc2F)nnc1-c1ccc(C(C)(C)C)cc1 10408174 XJEOTRHRCNDERT-UHFFFAOYSA-N 380.492 5.083 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2ccc(C)c(C)c2)c1 22695541 OHVVHPHJWJOTPU-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1nc(SCC(=O)N[C@H](C)c2ccc3ccccc3c2)c(C#N)c(C)c1C 23078022 SPVOQNWTWZSKCJ-QGZVFWFLSA-N 389.524 5.001 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1ccc(C#N)cc1 26123168 RXZFOPJZGWGQQP-KRWDZBQOSA-N 393.446 5.371 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(F)cc1Br 45990581 BPAXVHKLMJFDAD-UHFFFAOYSA-N 395.231 5.379 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c2cnn(C(C)C)c2n1 47375135 YNSCLKZKIHPDAS-SFHVURJKSA-N 397.482 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1cccc(F)c1 108413171 JZZLJJVYZNWZQD-HUUCEWRRSA-N 388.533 5.653 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3oc(C4CC4)nc3c2)c1 113539391 VZFZRBWQLHPQHE-UHFFFAOYSA-N 376.416 5.032 30 20 GKED C=C[C@H](CC(=O)Nc1ccccc1NC(=O)c1cccs1)c1ccccc1 126475597 LIMUKPLTKZKVFW-MRXNPFEDSA-N 376.481 5.299 30 20 GKED COc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 153999497 OMUQEDLZFQQCKS-IRXDYDNUSA-N 395.528 5.111 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCCc2ccccc21)c1nc2ccccc2n1C(F)F 171777096 WSWOOONGCOSDMM-RDJZCZTQSA-N 379.410 5.118 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(OCC(F)(F)F)cc1 172906140 BQANSYNPJSXWJN-AWEZNQCLSA-N 380.435 5.492 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C 173115575 NFLIKRLQZKSBSP-IERDGZPVSA-N 393.556 5.924 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)ccc1OCC(C)C 181599293 YJKHLQMGLSJSBR-MSOLQXFVSA-N 382.504 5.044 30 20 GKED CCCn1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc2ccccc21 191476663 LKURMIPEVUNMLX-HNNXBMFYSA-N 392.409 5.286 30 20 GKED COc1ccccc1-c1csc(C2CCN(Cc3ccc(C#N)s3)CC2)n1 191836479 KXDJIJIJYAVYRI-UHFFFAOYSA-N 395.553 5.131 30 20 GKED CC[C@H]1c2ccsc2CCN1CC(=O)Nc1ccccc1S[C@H](C)CC#N 247218813 SJDJUGBYFUORLI-QAPCUYQASA-N 399.585 5.090 30 20 GKED Cc1ccccc1COc1cccc(CC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 303254123 GLJUIADGPGZFPO-UHFFFAOYSA-N 398.506 5.556 30 20 GKED CSc1cccc(N=C(O)N[C@H]2CCCc3cn(C4CCCC4)nc32)c1C 329342933 PUNXFRYYKHBHAR-SFHVURJKSA-N 384.549 5.241 30 20 GKED CC(C)c1scnc1N=C(O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 329590265 YJBMAUBHXIADDS-ZDUSSCGKSA-N 390.578 5.027 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@@H](C)[C@@H](C)CC2 410987567 RFFFHMBEACMPOL-RYUDHWBXSA-N 395.484 5.043 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21 416823066 XVZGDEBQOSPKLR-HNAYVOBHSA-N 390.512 5.152 30 20 GKED C[C@@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccc(C#N)cc1 425999634 DPVIANDJWDPRFT-GOSISDBHSA-N 396.494 5.055 30 20 GKED N#Cc1ccc(NC(=O)Nc2cccc(COCc3ccco3)c2)c(Cl)c1 426124631 TVSAOXLGQUVYOL-UHFFFAOYSA-N 381.819 5.165 30 20 GKED CCCc1ccc([C@H](NC(=O)c2ncc(C#N)cc2Cl)c2cccs2)cc1 427930276 RJUOCZQKBMTSPA-IBGZPJMESA-N 395.915 5.140 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)c1 429856586 YMTNSFXTQYIONT-UHFFFAOYSA-N 394.883 6.000 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 433974575 PBXJAJDWUKLKLX-UHFFFAOYSA-N 392.242 5.380 30 20 GKED COc1cccc(Oc2ccc(NC(=O)C3(c4cccc(C#N)c4)CC3)cc2)c1 435067326 YIBXOKRDKHMNPO-UHFFFAOYSA-N 384.435 5.029 30 20 GKED CC1CCC(N(C[C@@H]2CCCO2)C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1 437908215 MJYWGGOICAFSAK-JITJBCMDSA-N 383.536 5.079 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2ccn(CCC)c2c1 438299882 MNXXXSVTVBLCQN-UHFFFAOYSA-N 392.459 5.180 30 20 GKED Cc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)ccc1C(F)(F)F 438533827 MLRFLHWNAADZDR-UHFFFAOYSA-N 375.394 5.328 30 20 GKED C[C@H](c1c(F)cccc1F)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438637623 UIJSFWLVVGWBTI-SNVBAGLBSA-N 383.320 5.080 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439494850 PSWTWURZDIALCN-NRFANRHFSA-N 379.504 5.477 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 439695382 YNRRBTHXFDQPPO-OAHLLOKOSA-N 394.496 5.109 30 20 GKED CCCCc1ccc([C@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 441232749 LWXFVXPJECBEHL-HSZRJFAPSA-N 388.515 5.438 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 443114328 VQNGDGOLMPGFOU-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C=CCOCCCC(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 443817911 SFMPZAMKPCYEHH-UHFFFAOYSA-N 396.512 5.343 30 20 GKED CC[C@H](N[C@@H](c1ccc(OC)cc1)c1ccccc1OC)c1ccc(C#N)cc1 447573760 JCNCGVQYTVYZGW-ZCYQVOJMSA-N 386.495 5.406 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)c(C)c1F 447600044 ZESAKKSOJDFMSO-UHFFFAOYSA-N 390.296 6.001 30 20 GKED N#Cc1cc(F)ccc1NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 462914902 ROCRZGDLKITEQT-UHFFFAOYSA-N 387.336 5.516 30 20 GKED C=CCOCCCC(=O)N[C@H](c1ccc(Cl)cc1)c1ccccc1Cl 464055255 IEUPVVRJBAPTMU-HXUWFJFHSA-N 378.299 5.182 30 20 GKED C[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467466347 JEWXLNKJCXFOAB-GJZGRUSLSA-N 383.879 5.195 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1cc2cccc(F)c2o1 469837774 DZUYAIXWOUJJJK-HNNXBMFYSA-N 389.430 5.321 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1 471919977 QYQYSBREDZQZHB-SFHVURJKSA-N 375.472 5.191 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2cccc(C#N)c2)n1 472676085 GXCIOTHGJHKPMK-UHFFFAOYSA-N 386.499 5.381 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1 475457772 PBUPSSHLILWSPS-KRWDZBQOSA-N 391.858 5.553 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)N[C@@H](C)CC#N 481210410 DPVPHDFDWAAWHW-HNNXBMFYSA-N 393.466 5.155 30 20 GKED CCOc1cccc(CN[C@H]2CCCCc3cc(C#N)ccc32)c1OC(F)F 481676613 XXAZVHAZRIPPFM-IBGZPJMESA-N 386.442 5.116 30 20 GKED COc1cc(SC)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 487436526 WAMDIJXZQXENJU-UHFFFAOYSA-N 390.464 5.333 30 20 GKED C=C[C@@H]1CCCCN1Cc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 489429587 PUWPJIKZKOZXQR-QGZVFWFLSA-N 375.925 5.022 30 20 GKED CC(C)(C)[C@H](NCCCC1(C#N)CCOCC1)c1cccc(C(F)(F)F)c1 499605390 ZETZUNXXHSAEAY-GOSISDBHSA-N 382.470 5.483 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(F)c(C(F)(F)F)c1 501863898 RFSOBHRIEIIPPG-UHFFFAOYSA-N 379.275 5.136 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 503799483 XKKIGLRPNRZTMH-NRFANRHFSA-N 381.907 5.285 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)cc2)n1 507880922 YQVBGMWAERGLCI-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC(C)c1ccc(NC(=O)N2CCN(c3ccccc3C#N)CC2)c(C(C)C)c1 508358392 DUSOFMNPQDZLBI-UHFFFAOYSA-N 390.531 5.159 30 20 GKED CCN(Cc1ccc(C(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1)C(C)C 509002602 ZUSLRTHRQGDKLO-UHFFFAOYSA-N 391.559 5.087 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)CSc2ccc(C#N)cc2)cc1 515571263 ANXZBWMRTOWSPS-NRFANRHFSA-N 378.541 5.312 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2Cl)cc1 515711291 IPKUPFUTVQXUJW-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1sc(NC(=O)C(C)(C)C)cc1C 515872451 APLGZIVLVZCORB-UHFFFAOYSA-N 388.508 5.009 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccccc2c1Cl)c1ccc(Cl)c(Cl)c1 517605346 TVDRHGMIKMWWKB-AWEZNQCLSA-N 378.646 5.123 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1F 518668866 QSWGRQHTJVLDRD-UHFFFAOYSA-N 382.382 5.411 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)cc1 519026545 LNRGLIIOMZPERB-HZPDHXFCSA-N 388.389 5.658 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccccc3S[C@H](C)CC#N)coc2c1C 521327224 XQUYBNCWESMMHQ-OAHLLOKOSA-N 378.497 5.625 30 20 GKED N#CCCn1cc(CNc2ccc3nc(C4CC4)sc3c2)c(-c2ccccc2)n1 532888034 AYLFLMVPWPKLAI-UHFFFAOYSA-N 399.523 5.563 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(-c3c(F)cccc3F)c2)n1 534584440 JRRZQMMVYJZKDE-HNNXBMFYSA-N 382.435 5.702 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1ccc(OC)c(NC(=O)C2CCCCC2)c1 537253190 DBORXPORAUVREC-MRXNPFEDSA-N 387.524 5.080 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sc(C3CCCCC3)nc2C)cc1 538245528 FCOORXKAIXGOCP-UHFFFAOYSA-N 398.532 5.059 30 20 GKED N#CC1(c2ccc(C(=O)NC(c3ccc(F)cc3)c3ccc(F)cc3)cc2)CC1 540731748 REPBKGLSFMDQNE-UHFFFAOYSA-N 388.417 5.039 30 20 GKED C[C@H]1CCCCN1C(=O)c1ccc(NCc2ccc(CC#N)cc2)cc1Cl 544098689 QCDKORHZPFJJQI-INIZCTEOSA-N 381.907 5.033 30 20 GKED Cc1ccc(-c2c(C#N)c(-c3ccoc3C)nc3sc4c(c23)CCOC4)cc1 544407539 KKKIRSNWSZTBKA-UHFFFAOYSA-N 386.476 5.785 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)Nc2cc(CC#N)ccn2)c1 545342168 OFMLWMGLAJEEAS-UHFFFAOYSA-N 393.899 5.513 30 20 GKED CC[C@H](CC#N)NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 547292706 DCYVGIAJRZZEGN-CQSZACIVSA-N 396.409 5.418 30 20 GKED C=CCC[C@@H](NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)c1ccco1 552046153 ZLCGZWOKRVLCAS-JOCHJYFZSA-N 391.515 5.196 30 20 GKED COCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 556610024 PQFNRZNBWOACLA-HXPMCKFVSA-N 381.278 5.433 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1cccc(Oc3ccc(C#N)cc3)c1)CCO2 563334897 TUMCFKQSXGJYJO-UHFFFAOYSA-N 399.450 5.086 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCc2sc(Cl)cc21 566647691 JAFLGUYMAFTXRW-DGCLKSJQSA-N 391.949 5.605 30 20 GKED CCC[C@H](CC1CCCC1)C(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1 574933746 HTLWLOZJRUZPGA-LJQANCHMSA-N 386.511 5.064 30 20 GKED COc1ccc(C[C@@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccc(OC)cc2)cc1 581303430 ZLQTWSRVNJIIMJ-IZZNHLLZSA-N 398.506 5.136 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC[C@@H](c2ccccn2)C1 590564952 GVSCTJJUVUNONN-LJQANCHMSA-N 399.519 5.124 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(Oc3ccc(C)cc3)CC2)c1 604907001 NVRHUAKFROYZAT-UHFFFAOYSA-N 380.488 5.025 30 20 GKED N#Cc1ccsc1C(=O)N(Cc1ccccc1OC(F)(F)F)C1CCCC1 609175590 NAPFFQSRAOJARO-UHFFFAOYSA-N 394.418 5.103 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1 609398748 NSDCOMCCSSGIAS-YCRPNKLZSA-N 395.528 5.220 30 20 GKED Cc1cccc2sc(C(=O)Nc3ccnn3-c3ccc(C#N)cc3)c(Cl)c12 609580939 DLMDRNBTABTYSI-UHFFFAOYSA-N 392.871 5.173 30 20 GKED N#CCN(C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)C1CCCC1 609976860 YIABUHAAWSIIKE-UHFFFAOYSA-N 384.932 5.541 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc(F)c(F)c1 610226323 ZCOOANBWZOBYKP-AWEZNQCLSA-N 378.378 5.371 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1cccc(C#N)c1 610357574 PCZOICZKGBFIDR-GOSISDBHSA-N 381.479 5.271 30 20 GKED N#Cc1cc(Cl)ccc1SCc1cccc(C(=O)NCc2ccco2)c1 610655133 QMINWNGPASWTKB-UHFFFAOYSA-N 382.872 5.027 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 611210616 SRVAETRFIRARKF-UYAOXDASSA-N 377.875 5.042 30 20 GKED C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 611548666 DQBHLNNWXCIVJT-RHSMWYFYSA-N 388.389 5.154 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(C2CC2)nc2onc(CCC)c12 615971496 LUPFGMWXMIOOJZ-UHFFFAOYSA-N 393.462 5.020 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 618750803 XKBWZIARZHBSJF-QFIPXVFZSA-N 394.434 5.031 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 661115682 DLJPTXPDOVIMKR-CTNGQTDRSA-N 397.588 5.669 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccccc2OC)n1 661116276 ICXZFHNMBOOSMH-MJGOQNOKSA-N 399.560 5.061 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cnn1C(CC)CC 682990984 BDLIGNRNECZWAJ-CQSZACIVSA-N 384.480 5.045 30 20 GKED Cc1ccc(N(Cc2cccs2)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726473480 PTCKJZZRTCNXLW-UHFFFAOYSA-N 397.956 5.985 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN(C)C[C@@H](C)c2ccccc2)c1=S 727428456 OHLPAISIBPZRBK-QGZVFWFLSA-N 396.535 5.099 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(-c2ccccc2Cl)s1 728699526 TUXFPFFCFJBQLK-VMPITWQZSA-N 396.821 5.723 30 20 GKED N#CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3Cl)s2)c1 730149433 IEBJMMOXQCJWBY-HJWRWDBZSA-N 379.868 5.867 30 20 GKED C[C@H](CSc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 732495451 ALIUERODSRCPFF-CRAIPNDOSA-N 378.522 5.415 30 20 GKED CCC[C@H](C#N)NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 733895702 UJBPBKZRRUGOQM-LJQANCHMSA-N 382.463 5.355 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 734654187 QSLJOMVDIDFLNV-GTNSWQLSSA-N 382.266 5.205 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 734679454 MMXIEFSQZZPIIE-KDOFPFPSSA-N 377.410 5.120 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2ncc(C(C)C)n2C(C)C)cc1 739435009 CISUMWHEFKCUML-SFHVURJKSA-N 398.576 5.323 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)Cc2c1ccc(Cl)c2Cl 743055863 LSXMYEQVVVMQHJ-LCYFTJDESA-N 383.234 5.398 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 744031331 KRZVPJZVJCBXGA-KRQVXIAISA-N 396.556 5.669 30 20 GKED O=C(/C=C/c1cccc(NC(=O)C(F)(F)F)c1)c1ccc(-c2ccncc2)cc1 745989950 ICGPLGHGQCQSLZ-RUDMXATFSA-N 396.368 5.146 30 20 GKED Cc1ccccc1C1(CNC(=O)c2ccccc2SCC#N)CCCCC1 750760009 DWNMUNYZMQFXAA-UHFFFAOYSA-N 378.541 5.243 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCc2[nH]c3ccc(F)cc3c21 753143612 WFEIJJXHGGWQKU-UKTHLTGXSA-N 375.428 5.038 30 20 GKED CCn1cc(C(=O)/C=C\c2nc(-c3cc(Cl)ccc3Cl)cs2)cn1 753900575 NYMUPGVOMIGJPF-WAYWQWQTSA-N 378.284 5.229 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1cnn(Cc2ccccc2)c1 760268851 CNPROXCYJLKBGP-HJWRWDBZSA-N 377.494 5.013 30 20 GKED Cc1ccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)cc1Cl 766431096 MKCAWACSYAIZRO-UHFFFAOYSA-N 377.300 5.068 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C 767851899 SHEUDHHBIHRCFT-OAQYLSRUSA-N 395.503 5.157 30 20 GKED C[C@H](NCc1ccc(-c2ccc3c(c2)C[C@@H](C)O3)cc1)c1ccc(OCC#N)cc1 776171433 NIEAWVIJQNTMNZ-MOPGFXCFSA-N 398.506 5.430 30 20 GKED CCOc1cc(/C=C(\C(=O)OCCCC(C)(C)C#N)c2ccccc2)ccc1O 782328587 WOHIOBRUFUHQKO-HKWRFOASSA-N 393.483 5.205 30 20 GKED O=C(/C=C/c1scnc1C1CC1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 782346778 CEYLCWXFHNKXRO-DYLHUKMJSA-N 387.476 5.004 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Cl)nc1C(F)(F)F 786764396 BYIXRFXICRBBLZ-NSHDSACASA-N 385.842 5.618 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1/S/C(=N/C2CCCC2)NC1=O 787476926 WHYJCSGLNAXYEP-MHWRWJLKSA-N 380.966 5.343 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2cccc(F)c2)CC1 789454811 FQKBIIVRGDDORZ-UHFFFAOYSA-N 380.507 6.089 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@H]2SCCS[C@H]12 789460306 SDSUWFNRTVAIHG-ZHALLVOQSA-N 376.591 5.040 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792095718 XLQOEIQLKRIQHI-JOCHJYFZSA-N 386.495 5.424 30 20 GKED O=C(CCCC(F)(F)F)O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809126745 XLJABGKUEQZBNZ-LLVKDONJSA-N 382.222 5.585 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccccc2C)C2CCCC2)ccc1OC 813860258 PSPYUGLMONLEOJ-PXDATVDWSA-N 392.543 5.706 30 20 GKED COc1ccccc1C1(C(=O)[C@@H](C#N)c2nc3ccccc3s2)CCCCC1 815899302 LYHQIVLBDYLHOV-MRXNPFEDSA-N 390.508 5.383 30 20 GKED C[C@@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C[C@@H]2C[C@@H]2C1 815912058 XVBZQYCAWZLADU-TZSRSQOCSA-N 391.323 5.729 30 20 GKED O=C1/C(=C/c2ccc3ncccc3c2)CCOc2ccc(Br)cc21 818470705 SQBNCHLHMBXHQT-RVDMUPIBSA-N 380.241 5.046 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915085667 DNRKARGIGZEDBP-XMMPIXPASA-N 392.458 5.756 30 20 GKED COc1cc(C=NOCc2csc(-c3cccs3)n2)ccc1OC(F)F 916732253 YXXRFZDNFCWLQT-UHFFFAOYSA-N 396.440 5.032 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3ccc(F)cc3)n2)cc1 918489783 NPMRHMYKDMCGTK-DNVCBOLYSA-N 378.472 5.628 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(C)c3cccc(C#N)c3)cs2)cc1 920346042 FLCVKNXWZGQCNP-UHFFFAOYSA-N 375.497 5.011 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C\C(=O)c3ccc(CC(=O)O)cc3)o2)cc1 1776271445 INIAHJWMXDNJCH-OWBHPGMISA-N 388.463 5.767 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C\C(=O)c3csc(C(=O)O)c3)o2)cc1 1776271486 SZJHHSSVCRPWKH-NTMALXAHSA-N 380.465 5.900 30 20 GKED CC(C)[C@@H]1/C(=C/c2cc(Br)cc(C(=O)O)c2)C(=O)c2ccccc21 1776308800 QEAMFRRQNIESDD-XUKORKDYSA-N 385.257 5.167 30 20 GKED CC(C)c1cccc2c1OC/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1776377866 AGDOUSPMMLNPRL-ZSOIEALJSA-N 378.449 5.382 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2Cl)s1 1776782768 HAXWTOMWOHBQOI-MRXNPFEDSA-N 393.980 6.362 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C1/C[C@@H](C(=O)O)c2ccccc2C1=O 1777342065 VPCAFVFIZSAAEU-SCFJIEIRSA-N 398.458 5.509 30 20 GKED Cc1cccc2c1C(=O)/C(=C\c1cccc(OCc3cccc(C(=O)O)c3)c1)C2 1777455715 POLSDJOECVQERG-NHDPSOOVSA-N 384.431 5.095 30 20 GKED N#C[C@@H](C(=O)CSc1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 26111365 SWTAJYQWYNKTFH-AWEZNQCLSA-N 386.448 5.057 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1F 41514776 GKGNVZVLPWFIHW-AWEZNQCLSA-N 386.835 5.101 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCC[C@H]1c1ccsc1 45988243 FMOVQXAHLQZZNL-FQEVSTJZSA-N 378.522 5.578 30 20 GKED COc1ccc(CN[C@@H](C)c2oc3ccccc3c2C)cc1OCCCC#N 64614160 XEOIJXWKSRYVBD-KRWDZBQOSA-N 378.472 5.283 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1C[C@H]1c1ccc(F)cc1 72025316 XISXBAHRGKTFLC-VXKWHMMOSA-N 386.426 5.540 30 20 GKED C=CCn1c(SCc2ccc(Cl)s2)nnc1-c1ccccc1OC 79399572 PENRLFRXPLCLCX-UHFFFAOYSA-N 377.922 5.147 30 20 GKED O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1c(F)cccc1F 106839859 RHBZCPWSVUQTMG-UHFFFAOYSA-N 399.237 5.020 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(-c2cccs2)no1 109226594 RZGWXTLMQDSGSA-AWEZNQCLSA-N 388.452 5.635 30 20 GKED COCc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 123753689 OPXLWMTZKIPVBD-MAUKXSAKSA-N 399.516 5.189 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=O)N[C@@H](CCC#N)c1ccccc1 151323831 KXQJMTCTSNBZBG-KRWDZBQOSA-N 376.287 5.180 30 20 GKED CCN(C(=O)CNc1ccccc1S[C@@H](C)CC#N)[C@H](C)c1ccc(F)cc1 153953434 PYQVRPKDSQHXGW-DLBZAZTESA-N 399.535 5.242 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1C1CC1 157880940 PBBLNQQXAOEXSX-BZNIZROVSA-N 391.302 5.033 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1ccccc1OCC#N 171085672 VIRIKISJKKPPJX-SFHVURJKSA-N 386.451 5.290 30 20 GKED Cc1cc(CNc2ccccc2O[C@@H](C)C#N)cc(C)c1OCc1ccccn1 181122321 DEZFBEBKRHVOFE-IBGZPJMESA-N 387.483 5.180 30 20 GKED C=C(C)[C@@H](NCc1nnc(-c2ccccc2Cl)o1)c1ccc(F)c(F)c1 187770098 BCIXRZAKLPPRJK-GOSISDBHSA-N 375.806 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 191469029 OEGKMMHIBMHEFU-UHFFFAOYSA-N 395.503 5.889 30 20 GKED C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246672490 GIYAXNIXMOPBPS-JXXFODFXSA-N 397.519 5.835 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3scnc3C(F)(F)F)c2C#N)[C@H](C)C1 297938897 UBRSZVRERVKWAQ-HTQZYQBOSA-N 385.436 5.033 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2ccccc2-c2cccs2)no1 329375801 KYSPTNZYLPHITR-KRWDZBQOSA-N 382.489 5.269 30 20 GKED OC(=Nc1cccc(CSC2CCCC2)c1)N1CCC[C@H](c2ncc[nH]2)C1 329443299 BVXGTOMXPIBECJ-KRWDZBQOSA-N 384.549 5.011 30 20 GKED CC(C)c1c(/C(O)=N/[C@H]2CCOC3(CCC3)C2)cnn1-c1ccccc1Cl 330075738 GPAQIEINBXMCQL-HNNXBMFYSA-N 387.911 5.055 30 20 GKED CCn1ccnc1[C@H]1CCCCN1/C(O)=N/[C@@H](C)c1oc2ccccc2c1C 330277630 ONOVAICXQHWTCW-FUHWJXTLSA-N 380.492 5.160 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2C[C@@H]3CCCC[C@H]3C2)cc1F 428880856 MFRLPGXPBYPZSU-IRXDYDNUSA-N 379.435 5.144 30 20 GKED N#CCSc1cccc(C(=O)Nc2c(F)cccc2Oc2ccccc2)c1 430936826 XEZRURUCFUYHDL-UHFFFAOYSA-N 378.428 5.486 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 432082605 UNDSKCYQJZVUDZ-ZHRRBRCNSA-N 397.519 5.415 30 20 GKED N#CCCC[C@H](NCc1csc(Cc2ccc(Cl)cc2)n1)c1ccccc1 433034273 XVZVEWIJJDCEKZ-NRFANRHFSA-N 395.959 5.912 30 20 GKED Cc1cc2sc(NC(=O)Nc3cccc(OCCCC#N)c3)nc2cc1F 434395345 MWFFUKYOMYBIIA-UHFFFAOYSA-N 384.436 5.070 30 20 GKED Cc1cc(O)c(C(C)C)cc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 436542411 BQAOWHWWKZLXHG-KRWDZBQOSA-N 377.271 5.126 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](Cc4ccccc4)C3)cc2)cc1 438222820 BNONVJOAAZYUMN-OAQYLSRUSA-N 397.478 5.447 30 20 GKED N#CCC[C@@H](NC(=O)N1CCc2c(Cl)cc(Cl)cc2C1)c1ccccc1 438848104 AMCDSVXIKKQWQX-LJQANCHMSA-N 388.298 5.106 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N[C@H](CCC#N)c1ccccc1 439494851 PSWTWURZDIALCN-OAQYLSRUSA-N 379.504 5.477 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2ccccc2)c2cccc(F)c2)cc1 446954529 PMHQYNUABYITTK-QFIPXVFZSA-N 387.458 5.538 30 20 GKED CC(=O)c1csc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)c1 460326327 CCOYGVKZTKWHJO-UHFFFAOYSA-N 394.883 5.323 30 20 GKED C=C(C)C[C@H](C)C(=O)N(C)c1ccc(Cl)c(N(C)C(=O)[C@H](C)CC(=C)C)c1 466441173 JDCYUCFIWJBZEM-DLBZAZTESA-N 390.955 5.470 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1SCCC#N 470897101 KFSVLIOQJWYCHA-INIZCTEOSA-N 376.481 5.252 30 20 GKED C=C[C@](C)(CCOC)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 473954146 WPVOYYISRSAUAL-ZUOKHONESA-N 392.952 5.178 30 20 GKED C[C@@H](CCNC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 476207731 OGPPNHQKGRSXEL-QFBILLFUSA-N 388.433 5.403 30 20 GKED Cc1ccccc1[C@@H](C)SCC(=O)Nc1ccccc1S[C@@H](C)CC#N 480380075 AYHRGCHVPWTBTE-DLBZAZTESA-N 384.570 5.822 30 20 GKED O=C(NC[C@@H]1CCCC[C@H]1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 483675277 ZNZYTSSSNZBOFU-GXSJLCMTSA-N 386.311 5.335 30 20 GKED C[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Oc2ccccc2)c(F)c1 484299202 WISBSTYDDBSOIT-INIZCTEOSA-N 383.467 5.308 30 20 GKED Cc1cccc(O)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 490730553 GLDPKGVUTDWCKC-UHFFFAOYSA-N 378.815 5.270 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(Oc3ccccn3)cc2)c1 492439342 KPNYLBHSLGXMFX-UHFFFAOYSA-N 380.245 5.120 30 20 GKED N#Cc1ccc(C2=CCN(Cc3ncc(-c4cccc(Cl)c4)o3)CC2)cc1 502526934 DJVHYXFQJQZQNV-UHFFFAOYSA-N 375.859 5.156 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1sccc1F 504179577 CLPXJTGHQAMDGX-NSHDSACASA-N 385.304 5.330 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Nc3cccc4ccccc34)n2)cc1 505462145 PEJIAAZGSNFUSA-LJQANCHMSA-N 383.476 5.518 30 20 GKED CC(C)c1cccc(O[C@H](C(=O)N2CCC(C)(C#N)CC2)c2ccccc2)c1 509411505 RVEAMCSHNWNTQU-QFIPXVFZSA-N 376.500 5.082 30 20 GKED Cc1cccc(C)c1OCc1nnc(SCCCCC#N)n1-c1ccccc1 514585991 QXHFQQYVHGLIBZ-UHFFFAOYSA-N 392.528 5.249 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517654142 VHAUAQYZTRTTTI-KRWDZBQOSA-N 388.442 5.517 30 20 GKED CCN(Cc1cccc(F)c1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 520322840 IEHJBHPNIADVKJ-UHFFFAOYSA-N 388.442 5.346 30 20 GKED CN(CC#N)C(=O)c1sc2ccccc2c1CSc1ccccc1Cl 522583112 JSAQFNDPWLXKOP-UHFFFAOYSA-N 386.929 5.443 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)CCc1ccccc1 524613844 JSYGXCKCFRLLOP-ZWKOTPCHSA-N 398.597 5.631 30 20 GKED C=C[C@@H](CC(=O)Nc1nc(-c2ccc(NC(C)=O)cc2)cs1)c1ccccc1 533943394 JJWCWPIMAQGNLB-INIZCTEOSA-N 391.496 5.067 30 20 GKED CC[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1c(C)noc1C 535318400 SBHIKUUFRPCXAF-LJQANCHMSA-N 391.496 5.195 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 536939867 JWKIRERNUFFBGJ-MRXNPFEDSA-N 386.455 5.191 30 20 GKED CCN(C(=O)c1cc(-c2ccccc2Cl)on1)c1ccc(C#N)c(Cl)c1 539175476 RVLQCWWZVQOGRR-UHFFFAOYSA-N 386.238 5.187 30 20 GKED Cc1cc(C)cc(OCc2noc(CSc3cccc(Cl)c3C#N)n2)c1 541173205 MWZNYFCIFNJBRO-UHFFFAOYSA-N 385.876 5.083 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccc(Cl)s2)nc2ccccc12)c1ccccn1 543733325 WDCLXACFCFDIGX-HNNXBMFYSA-N 389.867 5.502 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nnc(-c2cccs2)o1 543860746 IUSNPWRLNLQYDW-VIFPVBQESA-N 381.404 5.542 30 20 GKED C=CCn1c(-c2ccc3ccccc3c2)nnc1N1CCC(OC(C)(C)C)CC1 548914327 NHHZEICVZGARLL-UHFFFAOYSA-N 390.531 5.068 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 552964236 ULPLSDDHQDGVEE-UHFFFAOYSA-N 393.506 5.303 30 20 GKED Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 556198724 WLMHVSMIJRXOSK-OXJNMPFZSA-N 376.529 5.599 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1C1CC1 556694736 RAQVQLHTYYIOPJ-GFCCVEGCSA-N 378.501 5.379 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 558850211 ACNNKBKOWHQNSN-OAQYLSRUSA-N 388.446 5.363 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(CCc3ccccc3O2)C1 562021366 IGWCKZQOVVWVQY-RUZDIDTESA-N 390.527 5.540 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C1CC1 562173304 AWLLWOWEWFFNNS-HNNXBMFYSA-N 397.548 5.455 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)NC1(C#N)CCC(C(C)(C)C)CC1 567142197 IHOHFKWKUQGJHG-RAMCEHFNSA-N 377.532 5.028 30 20 GKED CC(C)Oc1ccc(N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 577072944 FJBKOKLIERBCJN-MRXNPFEDSA-N 383.517 5.394 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 585720967 SBWGMCYCXDJLQB-QHCPKHFHSA-N 395.453 5.100 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)CCc1nc2cc(Cl)ccc2s1 593033359 IOXNLSFURHYQAN-UHFFFAOYSA-N 388.895 5.236 30 20 GKED Cc1cc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C#N)c1[N+](=O)[O-] 596073043 DAVACICPJKBOFH-GHMZBOCLSA-N 395.303 5.096 30 20 GKED Cc1csc(CN(C(=O)CCCCCC#N)c2nc3ccccc3s2)n1 602397937 ROOOSNLCTYUVPC-UHFFFAOYSA-N 384.530 5.069 30 20 GKED N#C[C@H](C(=O)c1cc2c(Cl)cccc2s1)c1nc(-c2ccncc2)cs1 604005443 NNZQANDHMCDPGF-CYBMUJFWSA-N 395.896 5.563 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c1 604088318 PHWAXMLRGGXVIL-QFIPXVFZSA-N 398.466 5.423 30 20 GKED C[C@H](C[C@H]1CCCO1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 608841366 NXFYCDJMLNRXKL-ZTNFWEORSA-N 397.906 5.075 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1 608896066 KQROSTGGCUJSOW-GFCCVEGCSA-N 393.270 5.058 30 20 GKED CCCN(C(=O)c1csc(-c2cccs2)n1)c1cc(Cl)ccc1C#N 609285603 BURQRZTUDHQDLX-UHFFFAOYSA-N 387.917 5.453 30 20 GKED N#C[C@H](NC(=O)C1CC(c2cccc(F)c2)C1)c1ccc(Cl)c(Cl)c1 609460545 NWSQKJIVARFKKK-JRSKDTKFSA-N 377.246 5.007 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1F 610019167 GAOVACJGCFXPJD-CXAGYDPISA-N 389.471 5.489 30 20 GKED Cc1nc(NC(=O)C(C)(C)c2ccc3ccccc3c2)sc1SCC#N 610224389 GZQCUMCVAQUJKP-UHFFFAOYSA-N 381.526 5.137 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1ccc(C#N)cc1F 610471761 XZAUQSIBAAKFHQ-UHFFFAOYSA-N 380.806 5.420 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(Nc3ccccc3)c2)c(Cl)c1 611094471 LBAYXZJKTKCGCB-UHFFFAOYSA-N 382.250 5.861 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC[C@](C)(C#N)C3)c(C)c2)n1 612303695 XRSVRNNHZNBYJX-LJQANCHMSA-N 386.546 5.069 30 20 GKED CC(C)c1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cnn1-c1ccccc1 613289541 FIRKLCKQAHTELD-MRXNPFEDSA-N 386.480 5.095 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(C(F)(F)F)ccc1F 622315111 PTBZWLYRVBYHBA-UHFFFAOYSA-N 379.275 5.136 30 20 GKED O=C(c1ccc(C(F)(F)C(F)(F)F)cc1)N1CCC(CC(F)(F)F)CC1 622865947 MGRPBBXSSLRUKB-UHFFFAOYSA-N 389.286 5.145 30 20 GKED C=CCC[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccco1 671743405 BNWHCMPNLGMTFE-QGZVFWFLSA-N 375.394 5.281 30 20 GKED C[C@H](NC(=O)c1ccccc1SCC#N)c1ccccc1Oc1ccccc1 725743414 MAVALXUSGVYQHF-KRWDZBQOSA-N 388.492 5.586 30 20 GKED FC(F)SCc1ccc(C=NNc2ccc(OCC(F)(F)F)cc2)o1 727261449 AXAZKUGUJDCXJI-UHFFFAOYSA-N 380.338 5.123 30 20 GKED COc1c(O)cccc1/C=C/C(=O)c1sc(-c2ccc(Cl)cc2)nc1C 727654179 IMUPPPRMMOWXJM-DHZHZOJOSA-N 385.872 5.382 30 20 GKED C#Cc1cccc(N(C(=O)c2sc(-c3ccc(F)cc3)nc2C)C(C)C)c1 728247446 DWKLPTZELAYEFC-UHFFFAOYSA-N 378.472 5.294 30 20 GKED CC(C)(C)c1ccc([C@H](NCc2ccc(OCC#N)cc2)C(F)(F)F)cc1 731211789 AZSDVNMZLFNLKM-IBGZPJMESA-N 376.422 5.280 30 20 GKED CCOc1cc(/C=C2/CCOc3ccc(Cl)cc3C2=O)cc(Cl)c1O 733749466 XJYDARLJGOOZNL-GHXNOFRVSA-N 379.239 5.147 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccc(F)cc2)C(C)(C)C)c1 733849418 XAEHYNCJMDIDFJ-PZJWPPBQSA-N 397.494 5.093 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)CSCc1cc(Cl)ccc1OCC#N 735318670 MVCYZESSFASZPU-UHFFFAOYSA-N 384.888 5.148 30 20 GKED CC[C@@H](C)Oc1cc(/C=C/C(=O)c2c(Cl)nc3ccccn23)ccc1OC 737445622 CAVFNUDXIHLYPW-QSYFUGGGSA-N 384.863 5.070 30 20 GKED CSc1ccc(Cl)c(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 739589867 FAQJVZMIJFYCQG-UHFFFAOYSA-N 398.940 5.592 30 20 GKED COc1ccc(OCc2nc(/C=C/C(=O)c3cc(C)c(F)c(C)c3)cs2)cc1 741467583 OWGLWMIQVOBHSZ-RUDMXATFSA-N 397.471 5.383 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N[C@H](C)c2cccc3ccccc23)cc1 743462949 NFELFEYACXURQE-WOJBJXKFSA-N 385.511 5.134 30 20 GKED C=CC[C@@H](NC(=O)N(CC)[C@H](Cc1ccc(F)cc1)C(C)C)c1ccncc1 745828069 QMKLDCQNWNLMQK-FGZHOGPDSA-N 383.511 5.137 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cn1 746686488 GSGGSDGCVHFPCK-YCRREMRBSA-N 395.390 5.200 30 20 GKED C=CC[C@@H](NC(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)c1ccncc1 746898526 KMEOEAUXQNOFBG-HXUWFJFHSA-N 387.414 5.076 30 20 GKED C[C@H]1CN(c2ccc(N=Cc3cc(Cl)cc(Cl)c3O)cc2)C[C@@H](C)O1 747361972 GUIAGRVHZVYATE-BETUJISGSA-N 379.287 5.063 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCC#N)c1ccccc1 747988613 UTZGWVSJSKEGAP-LJQANCHMSA-N 389.421 5.282 30 20 GKED Cc1ccccc1[C@@H](OC(=O)[C@H](C)Oc1ccc(C#N)cc1)c1cccs1 748501826 FLEPAGOBRDJOGQ-HRAATJIYSA-N 377.465 5.028 30 20 GKED COc1ccccc1-c1nc(CON=C(c2ccccc2)C(F)(F)F)cs1 751964942 GHFIRVPLGQRTIN-UHFFFAOYSA-N 392.402 5.302 30 20 GKED Cc1cc(CCCC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)c(C)s1 753397020 XHHYGDWVNXUVQC-FQEVSTJZSA-N 390.508 5.188 30 20 GKED C#CCCCC(=O)N(c1nc(-c2ccc(C)cc2)cs1)c1cc(C)ccc1C 757812350 JIZBPPSJLAJCGY-UHFFFAOYSA-N 388.536 6.204 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cnn(Cc2ccccc2)c1 760272826 KCJJHWAUEWBDCE-HJWRWDBZSA-N 377.494 5.013 30 20 GKED COCCC1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCC1 761617347 CPDOVBVETIWWFX-JOCHJYFZSA-N 391.515 5.060 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccc(F)cc3)on2)cc1 761929193 MPEDXKFWVBACSW-OAQYLSRUSA-N 397.409 5.388 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(C)c(C)c1O 774835777 XTGDMAQFQXLRTQ-UHFFFAOYSA-N 390.414 5.373 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)CCc2c(Br)cccc21 782890831 TXXYIHLQLFNHIO-ZRDIBKRKSA-N 397.297 5.180 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 798394237 FTEZCMAWLITXQO-SFHVURJKSA-N 376.456 5.455 30 20 GKED CC(C)CN(C(=O)NCc1ccc(OCC#N)cc1)[C@H](C)c1ccccc1Cl 806715399 GUGQRKTYEHGYJU-QGZVFWFLSA-N 399.922 5.171 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1ccccc1-c1ccccc1)c1ccccc1 814209739 CYBHIWYEHDCYLI-JOCHJYFZSA-N 385.536 6.075 30 20 GKED N#CCCC[C@H](NC(=S)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 814210440 OTQPHGTZYQCHKT-KRWDZBQOSA-N 378.328 5.715 30 20 GKED Cc1csc(SCc2c(C(=O)N(C)CC(C)(C)C#N)oc3ccccc23)n1 817617718 BBGBLGSMDTZLPJ-UHFFFAOYSA-N 399.541 5.112 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2cc(Cl)sc2Cl)ccc1OC 823845140 AXEBNPZSSGHZGL-ZDUSSCGKSA-N 385.316 5.034 30 20 GKED CC(C)(C)OC(=O)CCCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 846819036 VPHUPLSCJKQMFA-OAQYLSRUSA-N 392.499 5.183 30 20 GKED CCCCc1ccc2nc(NC(=O)c3ccccc3SCC#N)sc2c1 871789184 ROSGUQQSSGMZDS-UHFFFAOYSA-N 381.526 5.507 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 916051841 UOMDVCLTNXEKRE-WSTZPKSXSA-N 386.417 5.649 30 20 GKED CC(C)(C)c1ccc(OCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 916627341 NMEXAAAQLWNRBA-SFHVURJKSA-N 392.524 5.629 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2c(F)cccc2s1 916910345 WWLPFLVBPHZZSQ-MRXNPFEDSA-N 394.471 5.126 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917041237 ROSKDZQOKSGGSB-JIIJFUIFSA-N 393.437 5.619 30 20 GKED Clc1cccc(C=NOCc2csc(Cc3ccccc3)n2)c1Cl 918732870 AQLLVJJRUHMZQI-UHFFFAOYSA-N 377.296 5.591 30 20 GKED N#CCOc1cccc(NC(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)c1 920345091 WNEVKOLWZBUONN-UHFFFAOYSA-N 396.805 5.426 30 20 GKED Cc1ccc(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 920872973 RVRWJAKMJUOZQX-XMMPIXPASA-N 383.495 5.323 30 20 GKED COc1cccc(Sc2ccccc2C=NNc2cccc(C(=O)O)c2C)c1 1776088004 JVZSXVRMBLIPIE-UHFFFAOYSA-N 392.480 5.299 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN([C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)C1 1776154018 RCEJVWORRRDVRS-YCRPNKLZSA-N 388.895 5.107 30 20 GKED C=CCOc1ccc(/C=C/c2nc(-c3ccccc3)ncc2C(=O)O)cc1Cl 1776183906 BPWFJBCPHYLLPT-CSKARUKUSA-N 392.842 5.230 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C\C(=O)c2csc(C(=O)O)c2)cc1Cl 1776353717 XTRZSANIDLRUBG-ARJAWSKDSA-N 385.268 5.436 30 20 GKED CC(C)c1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776375387 LGZQSMZWKGLSMY-BENRWUELSA-N 376.477 6.133 30 20 GKED CCc1ccc(-c2ccc(/C=C3/CCc4oc(C(=O)O)c(C)c4C3=O)o2)cc1 1776964182 PNMDZPZTKKURSD-VBKFSLOCSA-N 376.408 5.321 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(C(=O)O)cc1 1777487815 ZQISVDVNJYYSSC-NYYWCZLTSA-N 383.856 5.366 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(Cl)cc1 54466133 XHESATHBZXTVDP-AWEZNQCLSA-N 387.817 5.239 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@H]2c2ccccc2)cc1 62300208 UGPVNFQADKFIQC-VXKWHMMOSA-N 384.504 5.136 30 20 GKED CN(C)c1ccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c(C(F)(F)F)c1 67040489 NTUWYVLNZRVPSI-UHFFFAOYSA-N 394.290 5.182 30 20 GKED C[C@@H](Cc1nc(-c2cn(CCC#N)c3ccccc23)cs1)n1cc(Cl)cn1 110567525 TUCHNEAXNBQJFC-AWEZNQCLSA-N 395.919 5.332 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H](C)c2ccc(Br)cc2)n1 153550019 HGNRCYPXFNWSHE-WFASDCNBSA-N 391.334 5.399 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1nc(C)cs1 160447505 LFQNWVWSKKLGND-ZDUSSCGKSA-N 399.541 5.112 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 171740901 ZAOBOZADNZIBHI-INIZCTEOSA-N 383.517 5.001 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2Oc2ccccc2C#N)n1 182147163 RWRVGKZTHSSHPY-KRWDZBQOSA-N 387.464 5.421 30 20 GKED COc1cc(C)c(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1F 186048918 CJKQASNYEXZWTN-UHFFFAOYSA-N 392.455 5.418 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)co1 187255716 YCYNXNASUDQHSG-ZDUSSCGKSA-N 377.252 5.508 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc3ccccc3s2)ccc1OC 188195771 SPDIHPVNGJCUHT-YJBOKZPZSA-N 380.513 5.442 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1ccc(-c2ccncc2)cc1 191821612 DCZVUPDQPHSZSN-OAHLLOKOSA-N 392.300 5.234 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(Br)cc1 210112059 MJGILOQKHINSDE-RAXLEYEMSA-N 394.268 5.319 30 20 GKED COc1ccccc1[C@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccccn1 301858932 CPFNSMYXYORKOF-FQEVSTJZSA-N 383.373 5.182 30 20 GKED COc1cccc(C2(CNC(=O)Nc3ccc(C(C)(C)C#N)cc3)CCCC2)c1 303425266 ZLZMBJHCNBIPCD-UHFFFAOYSA-N 391.515 5.130 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(N2CCCC2)c1 330007669 FZVFFGBPXKXAIL-VQSBYGRUSA-N 383.536 5.230 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(COc3cccc(F)c3)c2)c1 429864918 GIJDKNCEXQMCBY-UHFFFAOYSA-N 392.455 5.273 30 20 GKED COc1c(Cl)cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 432857313 DLNBNUFOOPFINS-KRWDZBQOSA-N 392.286 5.559 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)c1ccccc1 432950650 TVCGIKABJBDSEQ-SFHVURJKSA-N 375.394 5.348 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)F 433116786 LXSYCJOZRWBWQE-CXAGYDPISA-N 375.444 5.066 30 20 GKED Cc1c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cccc1-c1ncco1 433142033 BYJOSGNOQWRARG-CQSZACIVSA-N 392.484 5.688 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)nn1-c1ccccc1 435752935 NBSMYVRILITYIX-INIZCTEOSA-N 386.480 5.095 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)NCC1CCC(C#N)CC1 440985351 DSLQEXYJRYUXJF-WWDZGPRUSA-N 396.560 5.151 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(Cc3ccc(C#N)s3)C2)n1 447057912 GXVWOAJXSGVDGJ-OAHLLOKOSA-N 395.553 5.131 30 20 GKED C=CCn1c(SCc2noc(C3CCCCC3)n2)nnc1-c1cccc(C)c1 448055492 VQJXKLHEPDGEIY-UHFFFAOYSA-N 395.532 5.163 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3noc(C)n3)n2)o1 450839228 QUDSULRXBYBVSH-VIFPVBQESA-N 394.378 5.085 30 20 GKED C[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Oc1cccc(Cl)c1 460412991 PUNQQRRRNISZTQ-MRXNPFEDSA-N 390.870 5.076 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc3cc(C)c(C)cc3o2)cc1 463166223 YHCWZQKTGCSDQE-UHFFFAOYSA-N 388.467 5.116 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2cc(-c3ccccc3)no2)cc1F 463231813 VVPCENQCHOAWPV-UHFFFAOYSA-N 385.398 5.757 30 20 GKED C=CCC[C@H](N[C@@H](C)c1cnn(C(C)C)c1C)c1ccc(C(F)(F)F)cc1 469182580 QIUPFUXWVFNJRZ-YWZLYKJASA-N 379.470 6.149 30 20 GKED Cc1cc(C(=O)NC2(C#N)CCC(C(C)(C)C)CC2)c(Br)s1 470198077 NWLRNLFGNURVCZ-UHFFFAOYSA-N 383.355 5.048 30 20 GKED COC1CCC(C)(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 471287472 NUKOQIKOZIPZAP-UHFFFAOYSA-N 393.487 5.067 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 475574279 VODNYBTXYIWVGZ-VGOFRKELSA-N 380.507 6.293 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 475775168 AGEPZPZCZYVRDS-UHFFFAOYSA-N 381.435 5.404 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cccc(OCc2cccc(C#N)c2)c1 486434366 PKUFUWQEEXFYIV-UHFFFAOYSA-N 381.479 5.551 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1ccc(OC(F)(F)F)cc1)c1ccccc1 487506910 WPKLDCFDKLGHOR-LJQANCHMSA-N 390.405 5.069 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)NCC(C)(C)CCC#N)cc2)c1 492708729 XGCYCKFPWRHFEC-LJQANCHMSA-N 393.531 5.264 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)c1nc(O)c2c(-c3ccccc3)csc2n1 495268666 ZMGISZTWZSQLSP-LBPRGKRZSA-N 390.493 5.184 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)c2c1 505954355 NSPXRANLMPUBCU-LJQANCHMSA-N 386.282 5.097 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C[C@@H](C)C#N)C2CC2)cc1 513670925 DKRDLMMMFOJHSS-AWEZNQCLSA-N 399.878 5.297 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 517832528 KNFNIVCVIXPSNY-UHFFFAOYSA-N 390.483 5.414 30 20 GKED CC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(OC)cc1 518269610 GJOKWEBHLOIVRF-RUZDIDTESA-N 386.495 5.387 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)ccc1OC 530402185 XSIUSJUIUGQQLN-UHFFFAOYSA-N 388.305 5.562 30 20 GKED N#CCC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1 533496795 MHGSPAOPCIZVNK-IBGZPJMESA-N 377.469 5.458 30 20 GKED C=C(C)[C@@H](CC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1)OCC 535147915 SKUUIDLXYIBAEV-QGZVFWFLSA-N 392.952 5.027 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CN(Cc1ccc(C#N)cc1)C1CC1 543249414 SGFPBCIPALIFKG-UHFFFAOYSA-N 389.543 5.408 30 20 GKED CN(C[C@@H]1CC=CCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 544236572 VLTJNSZHHQPOSZ-HXUWFJFHSA-N 389.499 5.152 30 20 GKED N#Cc1ccc(C(=O)N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1Cl 557078166 DABGPJZMOMKUNZ-INIZCTEOSA-N 392.808 5.250 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21 561129893 COWDTFWMRQFUFU-QKKBWIMNSA-N 391.515 5.858 30 20 GKED N#CC1(CC[S@](=O)Cc2nc(-c3ccccc3Cl)cs2)CCCCC1 565587622 FPHBRMJBLQJUFR-VWLOTQADSA-N 392.977 5.576 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N3CCC(CCC#N)CC3)c2)C1 573561311 CMXBYLMJWUEYII-GCJKJVERSA-N 383.536 5.330 30 20 GKED COc1ccc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1Br 576131628 ZXDSMXWEAUCTIA-BFUOFWGJSA-N 385.305 5.058 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)c1C 586794301 UZFHHSDOLUBHOX-UHFFFAOYSA-N 394.490 5.381 30 20 GKED C=C(C)COc1cccc(NC(=O)c2sc(NC(=O)C(C)(C)C)cc2C)c1 589382731 YRBTZRMTNUFMDQ-UHFFFAOYSA-N 386.517 5.248 30 20 GKED CC(C)c1ccc(NC(=O)N2CCc3c(CC#N)cccc3C2)c(C(C)C)c1 599714131 PDKKTCZVGBULQE-UHFFFAOYSA-N 375.516 5.590 30 20 GKED N#Cc1c(NC(=O)CCc2nc3ccccc3s2)sc2c1CCCCC2 602788817 VKCDQISJNMZTTJ-UHFFFAOYSA-N 381.526 5.070 30 20 GKED CCN(C(=O)c1cnc(-c2ccc(C)cc2C)s1)[C@H](C)c1ccc(C#N)cc1 604508805 UJPUCKLNVPAYLZ-QGZVFWFLSA-N 389.524 5.522 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N[C@H]3CC=CCC3)cc2Cl)c1 609929406 YPHFKJUVWJBROB-KRWDZBQOSA-N 381.863 5.021 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](Cc1ccccc1)C1CC1 609930274 XSVGZNAHQJFQJA-OXJNMPFZSA-N 379.529 5.224 30 20 GKED Cc1cc(C(=O)N[C@H](C)CC#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 610165561 RXQZRLPOEAWKHE-KGLIPLIRSA-N 390.314 5.507 30 20 GKED N#CCCCOc1cccnc1NC(=O)C[C@H](Cc1ccccc1)c1ccccc1 610227932 XLODSDLXSWEKEU-QFIPXVFZSA-N 399.494 5.119 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)c1ccc2ccccc2c1 610227938 ZINMUMYRFCIJJD-KRWDZBQOSA-N 388.536 6.008 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)C1CC1 610663644 ZVPQWEVUNYDDIY-OAHLLOKOSA-N 388.427 5.096 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N1CCC[C@](C)(C#N)C1 612314918 LMSWGHBPYBLGHP-LJQANCHMSA-N 386.293 5.068 30 20 GKED N#CC1(CCCSCc2cc(Cl)ccc2OC(F)F)CCOCC1 619587839 BDGDMBXNKYTPTD-UHFFFAOYSA-N 375.868 5.275 30 20 GKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cc2cc(Br)ccc2o1 619754865 NEMHVQPDMDZMBC-NSHDSACASA-N 389.680 5.571 30 20 GKED O=C(CCCc1ccc(F)cc1)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 653565358 HYTGWIRKKJYQEW-NHAGDIPZSA-N 399.350 5.174 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(F)c(C(F)(F)F)c(F)c2)s1 684673617 AHDCOVPBTSXKAR-SECBINFHSA-N 388.361 5.228 30 20 GKED CC(C)[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1cccc(C(F)(F)F)c1 726694699 HNZXNWPIXJPTOR-SFHVURJKSA-N 391.393 5.127 30 20 GKED Cc1ncsc1/C=C1/CC(c2ccccc2)C/C(=C/c2scnc2C)C1=O 742429355 NBMGIHYSRFZKLV-BJPQZVBLSA-N 392.549 5.830 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)Nc1ccc(F)cc1 745723596 CPEJNEDWMUFVAM-UHFFFAOYSA-N 393.462 5.549 30 20 GKED Cc1cccc(-c2nn(CN(C)C[C@H](C)C#N)c(=S)n2[C@@H]2CCCC[C@@H]2C)c1 746707153 XWKDXLLSGPSYTB-WSTZPKSXSA-N 397.592 5.190 30 20 GKED C[C@@H](OC(=O)/C=C\c1ccccc1C#N)c1ccc(NC(=O)c2ccccc2)cc1 748015416 SRYGWIHERYTQEZ-BBLCHGJFSA-N 396.446 5.128 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2cnn(-c3ccccn3)c2C)cc1 748441250 KKSTYRYXVPDFLG-QINSGFPZSA-N 395.462 5.147 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)Nc3ccc(F)cc3C#N)cccc2c1=O 751294924 TUEYIKTZPOTVJD-UHFFFAOYSA-N 398.393 5.032 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2cncc(SCc3ccccc3)n2)c1 754056675 NMCPAADKQWJMOE-LJQANCHMSA-N 390.512 5.062 30 20 GKED Cc1oc2ccccc2c1CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 767956623 DXBRSADMEJYMPK-LJQANCHMSA-N 397.459 5.155 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 770095349 BVTVYCXPQHZEFJ-GCJKJVERSA-N 378.859 5.168 30 20 GKED O=C(Nc1cccc(/C=C/C(=O)c2sccc2O)c1)c1ccccc1Cl 771744730 NGHNJJUDFDDUIL-CMDGGOBGSA-N 383.856 5.256 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)cc1 772591528 ATRDDSPMEPFUBA-YADHBBJMSA-N 390.870 5.058 30 20 GKED N#C[C@@H](COC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)Cc1cccs1 772735728 KHMNUPDATDIXPX-PFSWGADMSA-N 399.821 5.273 30 20 GKED C[C@@H](Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)c1cccc(C#N)c1 777243554 VBHLGQWBMDVKRU-MRXNPFEDSA-N 377.488 5.025 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)OCC3(C#N)CCOCC3)sc2c1 780543436 LJCPFHBCKQCRPQ-UHFFFAOYSA-N 377.893 5.155 30 20 GKED OC1(c2cccc(F)c2)CCC(=NNc2nc(-c3ccccc3)cs2)CC1 783817560 VCTGLFYQWXDQBB-UHFFFAOYSA-N 381.476 5.179 30 20 GKED N#Cc1cc(/C=C(/Cl)c2nc3cc(Br)ccc3o2)ccc1F 794738426 KHEKFOCYMZTWQI-WUXMJOGZSA-N 377.600 5.338 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](OC(C)C)c3ccccc3)n2)cc1 796766713 ZMVAESXTCICHFP-UGKGYDQZSA-N 390.508 5.461 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)C[C@@H]1CCC(F)(F)C1 798213345 XCLNFCGDRGYGEJ-INIZCTEOSA-N 388.845 5.570 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)o1 806561378 UWKNRNMWJROTEH-KWRJMZDGSA-N 376.383 5.232 30 20 GKED Clc1nc(Oc2ccccc2)sc1C=NNc1nccnc1C1CCC1 807991735 QXVLJLRCCHMCLP-UHFFFAOYSA-N 385.880 5.092 30 20 GKED COc1ccc([C@H](Cc2ccccc2)NCc2ccc(O[C@@H](C)C#N)cc2)cc1 810170899 CIWVFVCVEQOREN-DFBJGRDBSA-N 386.495 5.060 30 20 GKED N#Cc1cc(Oc2ccc(NC(=S)Nc3ccccc3Cl)cc2)ccn1 811709539 ZPVWKXJKKYZQBB-UHFFFAOYSA-N 380.860 5.208 30 20 GKED CCc1nc(C)c(COC(=O)c2ccccc2SCc2ccc(C#N)cc2)o1 814070672 VSWMDIJEYIGVNA-UHFFFAOYSA-N 392.480 5.066 30 20 GKED C#CCCC[C@@H](C)OC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 847866330 MNDNCUNIRVBZKD-CYBMUJFWSA-N 395.286 5.101 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1cncc(Br)c1 853326049 SIJOVSQMUXMYNR-UHFFFAOYSA-N 392.141 5.297 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN(Cc2ccccc2)C2CC2)c1=S 887562192 IAUGDHOFKWXYLH-UHFFFAOYSA-N 394.519 5.028 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)c1ccc(F)cc1F 916127711 VDIVVLMMQKPZKP-CMDGGOBGSA-N 376.765 5.148 30 20 GKED O=C(O)C(=O)/C(=C/c1ccc(-c2cccs2)cc1)c1ccc2ccccc2n1 1776117277 SFMFVNFGSKVMAU-NBVRZTHBSA-N 385.444 5.158 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)CC3CCC(C)(C)CC3)cc2)CCC1 1790570951 TXYZMPNCEOOGJP-UHFFFAOYSA-N 382.548 5.303 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)C(=O)Nc2cccc(Cl)c2)n1 21514654 DUYADWDCWMRAJU-SNVBAGLBSA-N 399.825 5.053 30 20 GKED Cc1ccc(F)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 49939180 WWHBBSUKKLFWCR-UHFFFAOYSA-N 376.456 5.550 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C(C)C)cc1C(C)C 63390934 HYTYAHFTVNQBSU-UHFFFAOYSA-N 375.516 6.025 30 20 GKED CC(C)Oc1cccc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 69285657 KSTLRKGPRXBVJG-INIZCTEOSA-N 384.888 5.156 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(Cl)c2Oc2cccnc2)cc1 102998955 MXKYRKHDLLAYMQ-UHFFFAOYSA-N 395.871 5.130 30 20 GKED Cc1ccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2SCC#N)cc1 107889251 ASQMFQPNSRDCLH-XSFVSMFZSA-N 375.497 5.119 30 20 GKED CC[C@@H](NC(=O)CNc1ccccc1SCCC#N)c1ccc(Cl)cc1 108352866 GWQLVLXVTZFDFA-QGZVFWFLSA-N 387.936 5.025 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N(CCC#N)Cc3ccco3)c2)c1 124910315 RBSQAXCBTQHYNA-UHFFFAOYSA-N 389.455 5.115 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 133191558 NRENPMUBXSZCMH-AWEZNQCLSA-N 375.428 5.088 30 20 GKED C[C@@H](SCCCC(C)(C)C#N)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 161158921 GULQJYOBTQPXFZ-GFCCVEGCSA-N 387.530 5.369 30 20 GKED C=CCCCN(C)Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 165977650 UZXHGKVHADOBIP-UHFFFAOYSA-N 398.359 5.533 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)CCc1ccc(Cl)cc1 172226178 WZOQYSYEBORKFF-HNNXBMFYSA-N 387.936 5.298 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1nc2ccccc2o1 174016092 ZOBFTIQAWKQDRP-HNNXBMFYSA-N 392.336 5.402 30 20 GKED COC(=O)[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1Cl 180615269 SAXPEDFKQNJNKD-GOSISDBHSA-N 393.270 5.002 30 20 GKED CN(C(=O)c1oc2ccccc2c1CSc1ccccc1F)C1(C#N)CCC1 181597670 QCAHPLYJHHFODP-UHFFFAOYSA-N 394.471 5.382 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1 182143146 RVDVYPGLKQGBFQ-CQSZACIVSA-N 394.377 5.300 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cs1 188913332 YMMIOCILLIFOCZ-CXAGYDPISA-N 386.546 5.072 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cnn(-c2ccccc2)c1 191415160 SHQRKSNVABHELI-UHFFFAOYSA-N 388.515 5.388 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccco1)C[C@@H]1CCCO1 191516681 UTURIIQJTRQFSK-FQEVSTJZSA-N 382.504 5.345 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 192217326 HFTOFWMAEWRONE-CZUORRHYSA-N 399.482 5.523 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1cc2sc3ccccc3c2s1 193442662 ACMZIEQIZMKHTP-AWEZNQCLSA-N 376.462 5.077 30 20 GKED CC1C/C(=C\c2csc([N+](=O)[O-])c2)C(=O)/C(=C/c2csc([N+](=O)[O-])c2)C1 207185144 YEKCSYZVSMYJEU-PCSLFHOQSA-N 390.442 5.092 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C\c1nc2ccccc2s1 255443462 PTUCLIRODJNJFL-BMSUMIBZSA-N 379.510 5.342 30 20 GKED O=C(c1cc(F)c(F)c(F)c1F)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 302967378 QBOTZZRQTMXCIV-UHFFFAOYSA-N 391.286 5.067 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1sc2nc(C(F)(F)F)ccc2c1C 303168443 AYVPPOOMRFNJJI-UHFFFAOYSA-N 397.466 5.416 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(C2CC2)nc2ccccc12 303288129 AGGARVBURYTUMN-OAHLLOKOSA-N 387.508 5.616 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@@H]1CCC[C@H](C(F)(F)F)C1 410399333 DKGPMJPVABXMOO-ZJUUUORDSA-N 387.295 5.074 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H](C)CCC#N 411545364 XAXZONAFJOIYQI-RYUDHWBXSA-N 378.339 5.224 30 20 GKED C=CC[C@@H](C(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1)c1ccccc1 427134956 GLEYBSRNAQGIJI-LJQANCHMSA-N 380.875 5.280 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)F 433145342 PVJAGVFWUJAPTE-SUMWQHHRSA-N 375.444 5.209 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(OCc2cscn2)c1)c1ccccc1 435612039 VNLUUZDTJRBERO-OAQYLSRUSA-N 393.512 5.551 30 20 GKED Cc1occc1-c1nnc(SCCCCC(C)(C)C#N)n1Cc1ccccc1 436142730 RRAMNBITWZHABX-UHFFFAOYSA-N 394.544 5.707 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)ccc2C)c1 438673344 TVLWBEWBKBQJGI-QGZVFWFLSA-N 386.455 5.245 30 20 GKED Cc1oc(C#N)cc1C(=O)N(Cc1cccs1)C12CC3CC(CC(C3)C1)C2 439088385 HJGPCUNUGPPPKO-UHFFFAOYSA-N 380.513 5.132 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)[C@@]1(C#N)C[C@@H]1C 450006905 WKATYPYGGWTOMQ-NPMXOYFQSA-N 390.462 5.220 30 20 GKED C=CCCc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 459549151 MRUKVRKBEBQYPL-SFHVURJKSA-N 396.453 5.018 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 465669847 WZJWSHCIAFSNLA-OALUTQOASA-N 383.495 5.689 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c(C)c1 470895984 COQFAZNWBBTVRR-VQIMIIECSA-N 377.513 5.078 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1 475551774 YTMGNPYYDLFTMP-QFIPXVFZSA-N 380.507 6.437 30 20 GKED N#Cc1ccc([C@H](Nc2cccc(Sc3ccc(Cl)cc3)c2)C(N)=O)cc1 476526884 XCPDGTDOBZKQRU-FQEVSTJZSA-N 393.899 5.001 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3)o2)nnc1-c1ccc(C)cc1 481377443 SQNJWZHUNBUOEE-UHFFFAOYSA-N 388.496 5.387 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](C(=O)Nc1ccccc1)c1ccccc1 481649405 DYXDYMZMPHMPSR-DQEYMECFSA-N 395.506 5.295 30 20 GKED CC[C@H](C)n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 482561498 RYTXRDDVGFXGKV-LRDDRELGSA-N 398.919 5.430 30 20 GKED N#C[C@H](C(=O)c1sc(C2CC2)nc1-c1ccccc1)c1nccc2ccccc12 483213071 LGRKNWUHDAZPOO-IBGZPJMESA-N 395.487 5.726 30 20 GKED Cc1cc(F)ccc1C1CCN(C(=O)N[C@H](CCC#N)c2ccccc2)CC1 489786136 NBUIDTCVBAPTJR-JOCHJYFZSA-N 379.479 5.068 30 20 GKED O=C(N[C@@H](c1ccccc1OC(F)F)C(F)(F)F)c1cccc(C(F)F)c1 493371739 WDODJSYBPGHCGD-ZDUSSCGKSA-N 395.274 5.259 30 20 GKED CC(C)c1noc([C@@H](C)Sc2nc3c(c(-c4ccco4)c2C#N)CCC3)n1 498057204 GWDNKJCFGFEHFJ-GFCCVEGCSA-N 380.473 5.062 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 499833487 LZRFGYVSMLLXSI-MLGOLLRUSA-N 379.312 5.103 30 20 GKED CC(C)c1cc(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)nn1C(C)(C)C 502388456 DTGATVSMUZVRJH-UHFFFAOYSA-N 393.516 5.009 30 20 GKED N#CCCN(CC1CC1)C(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 505175548 ZSDVAYBBIBFXDR-UHFFFAOYSA-N 395.572 5.332 30 20 GKED CCN(C(=O)c1sc(Cc2ccccc2)nc1C)[C@H](C)c1ccc(C#N)cc1 509587718 WSDLBKZMBBNGDG-QGZVFWFLSA-N 389.524 5.137 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CC4(CCCCC4)C3)c2)cc1 519732392 HTQFMRXZTMVSJB-UHFFFAOYSA-N 389.499 5.130 30 20 GKED COc1cccc([C@H]2C[C@H]2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 520704515 PYMKJJRHVLEWCD-FGZHOGPDSA-N 384.435 5.101 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 524329361 FVMLAHTYYYJNIY-QZTJIDSGSA-N 387.310 5.406 30 20 GKED CCn1c(S[C@H](C#N)C2CCCCC2)nc2cc3ccccc3cc2c1=O 524535244 VPPITIPGEOMWSY-HXUWFJFHSA-N 377.513 5.134 30 20 GKED COc1cccc([C@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)c1 525174577 LFDHBCIDPOBRJC-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CC(C)(C)c1csc(-c2cccc(Oc3ncc([N+](=O)[O-])cc3C#N)c2)n1 525357368 NTGIWNPWPXPSQJ-UHFFFAOYSA-N 380.429 5.075 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1nccs1 534155215 ZTRDTRIIJLEBFZ-INIZCTEOSA-N 397.887 5.342 30 20 GKED COc1cc(C#N)ccc1CN[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 543516467 VSVIHSXTVCALQT-HNNXBMFYSA-N 377.513 5.158 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1F 550835048 GFIAVJANLDBLSZ-IFXJQAMLSA-N 375.285 5.674 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C#N)cc1Cl 554233414 GXNBNUDHAXEFIO-UHFFFAOYSA-N 389.864 5.264 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3ccc(F)c(C#N)c3)s2)cc1 556385498 JFUZESRCSHRLML-HNNXBMFYSA-N 393.487 5.271 30 20 GKED C=CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 557397439 JJGMHBLPIYWFIE-MSUUIHNZSA-N 399.519 5.325 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1Cl)c1cccc(Cl)c1Cl 561290241 BOLZFHMOTCCYHM-WWGRRREGSA-N 379.674 5.131 30 20 GKED CCSCc1ccccc1C(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F 562626800 GVSKZLOLHOBUSL-UHFFFAOYSA-N 392.446 5.016 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(-c2ccncc2)cc1 564382925 YMNPZAMEGNRIIH-OAHLLOKOSA-N 381.401 5.490 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)c(C(F)(F)F)c1 565916202 LZPRBUJXEOTSQC-UHFFFAOYSA-N 380.797 5.437 30 20 GKED N#CCCCCCC(=O)NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1 588155640 ZZNDHXKEWOWDDA-UHFFFAOYSA-N 390.405 5.588 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(Oc3cc(C)ccc3C)CC2)c1 589741862 XYZBGNMPEPSJIB-UHFFFAOYSA-N 394.515 5.334 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC3(CC2)CC3(F)F)cc1 593829151 RSFRKVJYZFDGPN-UHFFFAOYSA-N 398.478 5.112 30 20 GKED N#Cc1cccc(C2(NCc3ccc(Cl)c4ccccc34)CCOCC2)c1 595768043 FOJIRBKBCZQZMN-UHFFFAOYSA-N 376.887 5.160 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F)c1cccc(C#N)c1 600850278 UYUVRDHDCYIGNZ-CYBMUJFWSA-N 399.372 5.595 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cc(F)c(Cl)cc1Cl 603658283 YLNILDISPQWCDS-LLVKDONJSA-N 394.277 5.816 30 20 GKED CCC[C@H](C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 603995482 GLOMZOAFYVDYEO-QHCPKHFHSA-N 397.478 5.333 30 20 GKED COc1cccc(-c2nc(CSCCOc3cccc(C#N)c3)cs2)c1 604062649 CQGLQDOMTQVXAU-UHFFFAOYSA-N 382.510 5.003 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1coc2cc3c(cc12)CCC3 609375985 RXTAPUNOEPOXER-UHFFFAOYSA-N 376.481 5.108 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 609427706 DNPXXNTZBCPCSC-OAHLLOKOSA-N 376.481 5.495 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 609660142 NCJLXXDLDWSOEQ-HRAATJIYSA-N 389.886 5.523 30 20 GKED COc1ccc(Oc2cc(CNc3ccc(C#N)cc3C(F)(F)F)ccn2)cc1 609961364 HKTAXRBSHWIASM-UHFFFAOYSA-N 399.372 5.385 30 20 GKED C[C@@H]1CC(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C[C@@H](C)C1 610093354 DPNIWORBHMAXIM-ROUUACIJSA-N 391.515 5.278 30 20 GKED N#Cc1cccc(CNC(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)c1 610149203 YKEMAWRPNQDLON-UHFFFAOYSA-N 399.825 5.188 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610322743 OOQKKNVVCAKJLL-KRWDZBQOSA-N 387.508 5.901 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(Br)cc1)c1cccc(C#N)c1 612574916 YDGFYVVFDHALKX-PXAZEXFGSA-N 397.238 5.665 30 20 GKED O=C(Cc1c[nH]c2cc(F)ccc12)NC(CCC(F)(F)F)CCC(F)(F)F 619124650 DUQWFSTYYYPZLH-UHFFFAOYSA-N 398.322 5.019 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 665395560 MSHJGJZAMBWPIE-LPHOPBHVSA-N 381.476 5.097 30 20 GKED C=CCCc1ccccc1NC(=O)c1sc(-c2ccccc2)nc1C(F)F 669675447 CYXMTJCOSZQWDY-UHFFFAOYSA-N 384.451 6.119 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 681622232 RITUVJCEPUKRJS-MRXNPFEDSA-N 378.497 5.126 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@H]2c2ccc(Cl)cc2)cc1Cl 726458477 LLCVFOHQOCQSJQ-KRWDZBQOSA-N 376.312 5.399 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cnc(-c3ccccc3)s2)S1 727264695 YPEOONLTDJUGAC-GZTJUZNOSA-N 391.521 5.319 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2F)c2ccccc2F)c1 729821459 OPKALGQLBCURPW-UHFFFAOYSA-N 378.447 5.350 30 20 GKED CC(C)COc1ccc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 730399287 XODGUTCGSCVMQY-KRWDZBQOSA-N 398.915 5.403 30 20 GKED CC(C)(C)n1cc(C=Nn2cnc3ccccc32)c(-c2ccccc2Cl)n1 731151646 NPIVFXANWLHFKA-UHFFFAOYSA-N 377.879 5.190 30 20 GKED N#C[C@@H](C(=O)CC[C@@H]1CCCCO1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 732496214 QFMGSZDJXNLWIU-UGUVSMLOSA-N 398.572 5.136 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)cc1 733324712 VLSXXSBQTZHAIY-IBGZPJMESA-N 393.527 5.270 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 733921042 LVSYAGQCYVGRTE-KRWDZBQOSA-N 398.434 5.566 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2cccnc2Cl)c1 741970402 ZXIGCLOSJFJCEI-UHFFFAOYSA-N 382.250 5.107 30 20 GKED CN(CCC#N)c1ccc(CN[C@H](c2ccc(F)cc2)c2cccs2)cc1 743763955 YUNXGVCSTWMLHR-JOCHJYFZSA-N 379.504 5.116 30 20 GKED C=CCCC(=O)O[C@H](C)c1sc(-c2ccccc2Br)nc1C 744320052 NICWTCRAIDYOTA-GFCCVEGCSA-N 380.307 5.451 30 20 GKED Cc1ccccc1-c1noc([C@@H](C)ON=Cc2cccc(Cl)c2Cl)n1 744442594 DFROJGSHMRTUGH-GFCCVEGCSA-N 376.243 5.464 30 20 GKED O=C(CSC(F)(F)F)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750202370 GVVOJBJQSGXLSE-VIFPVBQESA-N 386.235 5.105 30 20 GKED N#Cc1cccc(/C=C2/CC3(CCOCC3)C/C(=C\c3cccc(C#N)c3)C2=O)c1 751517873 OYAKDZUPBDIJOV-NQGGHMMCSA-N 394.474 5.057 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1C=NOc1ccccc1C(F)(F)F 754708813 FDUJKVHZTAXCLI-UHFFFAOYSA-N 397.759 5.405 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]nc2-c2ccccc2F)cc1 755167057 QUZFWHYGFVZUMH-HXUWFJFHSA-N 396.425 5.124 30 20 GKED O=C1/C(=C/c2nc(Cl)cs2)CCc2nc(-c3ccccc3F)sc21 759084783 QVADDOVZKNNPKG-VQHVLOKHSA-N 376.865 5.272 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(F)cc2OC(C)(C)C)c1 766492742 WCYNFAKLXBONGW-KRWDZBQOSA-N 399.466 5.006 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cnc1Cl 771100397 YDKRCPWUZPPUCU-XTKXOIQPSA-N 389.854 5.027 30 20 GKED Cc1cc(-c2cc(C(=O)OCC3(C#N)CCCC3)c3c(C)noc3n2)c(C)s1 780530150 WGUMBHLWSLXGRS-UHFFFAOYSA-N 395.484 5.117 30 20 GKED Cc1ccccc1C1=CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 782553618 TXGKJNXRCIMXLY-VWLOTQADSA-N 393.490 5.582 30 20 GKED CC[C@@H](NC(=O)[C@H](C#N)C(=O)c1cc2c(Cl)cccc2s1)c1ccccc1 787044189 FTMJDEAAIWIQBR-NVXWUHKLSA-N 396.899 5.145 30 20 GKED O=C(/C=C/c1cnnn1Cc1ccccc1)c1ccc(Cl)c(Cl)c1Cl 792860401 VUMSUNBRFATYAZ-RMKNXTFCSA-N 392.673 5.183 30 20 GKED Cc1cc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)sc1Br 794733616 QEQAPBKYZJBEKZ-AATRIKPKSA-N 391.315 5.234 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570805 KPYWTOUAHZNYNV-ZEERGYAVSA-N 382.529 5.508 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2coc(C3CCCCC3)n2)cc1 802043393 ZPQJRKMOTPVFMU-LJQANCHMSA-N 393.487 5.026 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(Br)nc3)s2)cc1 811695497 HPKSGTFZBDSZOF-BQYQJAHWSA-N 385.286 5.172 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 812242998 AJWYHCWGAZSGNK-SREVYHEPSA-N 385.470 5.194 30 20 GKED CCOc1cc(/C=C/C(=O)c2cnn(-c3ccccc3)c2C)ccc1OC(F)F 818253366 SPIQTQCCMHIZHH-PKNBQFBNSA-N 398.409 5.077 30 20 GKED N#CC1(c2ccc(CNc3ccc(N4CCc5sccc5C4)cc3)cc2)CC1 850210569 KZGWMEGHTQFPLN-UHFFFAOYSA-N 385.536 5.478 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)C(C)(C)c1ccc(C#N)cc1 862718261 AOVPREGBDUUENY-UHFFFAOYSA-N 393.487 5.130 30 20 GKED C=C(C)C[C@@H](NCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)O 864530349 WNFRTNDTSSHYSW-LJQANCHMSA-N 394.298 5.081 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](c1ccc(F)cc1)c1ccccc1Cl 916029348 BICNUSRNJRJJKY-FQEVSTJZSA-N 395.890 5.427 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccsc1)c1nc2cc(C(F)(F)F)ccc2s1 917043875 PRVQVUMMSYCBQZ-BIVBXWGWSA-N 378.400 5.266 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N3CCCCC3)cc2)cc1 918156724 SMSYBISVWVVCOY-OVCLIPMQSA-N 391.515 5.103 30 20 GKED Cc1ccc(Oc2cc(Cl)ccc2C=NNc2cccc(C(=O)O)c2)c(C)c1 1776037800 CLHTWTHGOUKIQW-UHFFFAOYSA-N 394.858 5.893 30 20 GKED O=C(O)c1cccc(NN=Cc2cc(F)ccc2Oc2cccc(Cl)c2)c1 1776037983 MJYFFZOTVMZLOR-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CCCCCCCOc1ccc(CNCc2cc(C(=O)O)sc2Cl)cc1 1776787100 VAZIOUSOYCWFEO-UHFFFAOYSA-N 395.952 5.739 30 20 GKED COc1ccc2ccnc(C(=O)/C=C/c3ccc(-c4ccc(C(=O)O)cc4)o3)c2c1 1777374415 USFHPDZXJHGOBS-CSKARUKUSA-N 399.402 5.098 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccn(-c4ccccc4)n3)cc2)cc1 1777671094 BZWHREFDDYCTTA-NVNXTCNLSA-N 394.430 5.134 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)cc1Cl 8331425 WNELDNLIRZUWRN-UHFFFAOYSA-N 388.279 5.170 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Sc2nc(C)cc(C(F)(F)F)c2C#N)c(C)c1 18535760 QKFWVRLGHCBIFD-CYBMUJFWSA-N 393.434 5.017 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc23)n1 22360862 GVXASIAGCHOXDQ-IRXDYDNUSA-N 389.524 5.081 30 20 GKED N#C[C@H](C(=O)c1cccc(OCc2cccs2)c1)c1ccc2ccccc2n1 48858000 GBAGDGBEHWGKSG-FQEVSTJZSA-N 384.460 5.365 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCc1ccccc1)c1nc2ccccc2s1 60477225 QXQCXGFRNVQPSX-FQEVSTJZSA-N 382.488 5.572 30 20 GKED COc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 66955053 UTNYZLHPHXZKIM-FUHWJXTLSA-N 395.528 5.111 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)C2CCCCC2)cs1)c1ccc(F)cc1F 70794606 LFJHCZSNARITMG-CSKARUKUSA-N 390.455 5.269 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)Nc1ccc(F)cc1OCC#N 120114887 FECOKTZBXYVQHV-SNVBAGLBSA-N 399.274 5.154 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1cccc(C#N)c1 120597463 NHLHOQBKNUVKGT-UHFFFAOYSA-N 397.356 5.041 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1cccc(CSC2CCCC2)c1 135048871 SFGZXGWZNPWOCQ-UHFFFAOYSA-N 394.544 5.205 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1Cl 136902937 AAZBZLFZNDZELT-LLVKDONJSA-N 377.252 5.102 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](SC)c3ccccc3)n2)cc1 172546329 QHZAJMLBYJGUOA-XLIONFOSSA-N 394.521 5.099 30 20 GKED COc1ccc2sc(C(=O)Nc3ccccc3SCCC#N)c(C)c2c1 172995977 RYKUWVOPECAZCW-UHFFFAOYSA-N 382.510 5.476 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 174346730 KOGRERZKXQOWBN-LJQANCHMSA-N 396.494 5.079 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1OC(F)(F)F 180201645 ANLNURQFFDGIJN-GFCCVEGCSA-N 380.391 5.089 30 20 GKED CCc1c([C@@H](C)NCc2ccc(OC)c(O[C@H](C#N)CC)c2)oc2ccccc12 181956215 SMBMWKHTZBROFI-AEFFLSMTSA-N 392.499 5.536 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1noc(-c2ccc(F)cc2F)n1 187493476 YMKKBUCFLOJNTO-LBPRGKRZSA-N 386.427 5.021 30 20 GKED C=CC[C@@H](C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1)c1ccccc1 188967298 FGNNSBHPPINZRL-MRXNPFEDSA-N 393.468 5.041 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCCCC[C@H]1c1ccco1 246845284 VHPKOAOWZIIFQY-MJGOQNOKSA-N 397.544 5.230 30 20 GKED Cc1nc(CNc2nc(C(F)(F)F)ccc2C#N)oc1-c1ccc(Cl)cc1 301662856 NHFSABKDJUUBLP-UHFFFAOYSA-N 392.768 5.201 30 20 GKED COc1ccc(SCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 302965528 CNFUWSVTPRJCQW-UHFFFAOYSA-N 390.464 5.090 30 20 GKED O=C(N1CCCC1)N1CCC(C(O)=Nc2ccc3c(c2)oc2ccccc23)CC1 328942623 UCZGHKZSNZRVTN-UHFFFAOYSA-N 391.471 5.102 30 20 GKED COc1cc(/C(O)=N/[C@H]2CCCCC23CCCC3)cc(Cl)c1OCC(=N)O 329645785 ZQTKOUAWZNSMRA-INIZCTEOSA-N 394.899 5.070 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1 330080491 JJANLEPNFQZTQY-NHCUHLMSSA-N 391.515 5.074 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1csc(-c2ccc(OCC)cc2)n1 410362551 HAMBGGGVSIBLJU-UHFFFAOYSA-N 392.524 5.509 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)Nc1cccc(C(F)F)c1Cl 416997725 RMRVEYVQTSVWBW-HNNXBMFYSA-N 375.806 5.348 30 20 GKED N#Cc1c(F)cccc1CN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 428349248 QYYNDMCBAMLKPJ-OAHLLOKOSA-N 376.275 5.109 30 20 GKED N#CCCC[C@@H](NC(=O)NC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 431927636 ZFVAPAMHSBQSNW-RTBURBONSA-N 389.421 5.067 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(C(=O)c2ccccc2)c1)c1ccccc1 433148398 APZMXSZMLQKVSV-HSZRJFAPSA-N 397.478 5.474 30 20 GKED CSC1(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCC1 433255146 ZYLWVLWTFQSHPG-UHFFFAOYSA-N 381.501 5.066 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1 435194543 UYISOBDXMCDDAZ-UHFFFAOYSA-N 391.515 5.067 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)CSc1ccc(C#N)cc1 437904785 CSOHKSGYCFXGTM-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C)[C@H](C)CC#N)cc1 444381210 GZOUOAHUGWLEBR-CQSZACIVSA-N 387.867 5.297 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(C1CC1)[C@H](C)c1ccccc1Cl 460560842 DHSKTTVXBVXEOL-DNVCBOLYSA-N 386.927 5.089 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1SC[C@H](C)C#N 470890330 VEABHMXXXHMDGT-SJORKVTESA-N 390.508 5.498 30 20 GKED CCO[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)C(C)C 471274259 VJMQPVNEXGECPB-HNNXBMFYSA-N 388.455 5.101 30 20 GKED CC(=O)c1sc(NC(=O)C[C@@H](CC#N)c2ccccc2)nc1-c1ccccc1 474402936 NWYAUXFJSRSYRW-GOSISDBHSA-N 389.480 5.039 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Oc3ccc(F)cc3F)cc2)n1 474429791 URVSIOWZESPMOR-MRXNPFEDSA-N 398.434 5.827 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3ccccc3C(F)(F)F)o2)n1 475033489 ZPGIOEILWGLNEP-LBPRGKRZSA-N 376.359 5.220 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C(=O)OC(C)(C)C)CC1 475550006 SDNZOAQXZVLZGQ-UHFFFAOYSA-N 386.536 5.124 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483227841 LYRBWKSQCBZGHW-NRFANRHFSA-N 389.414 5.389 30 20 GKED N#Cc1ccc(SCC(=O)N2CCC(c3cccc4ccccc34)CC2)cc1 483551068 CCDRBXQHTKGOST-UHFFFAOYSA-N 386.520 5.210 30 20 GKED Cc1cc(C(=O)N(c2ccsc2)C2CCCCC2)nn1-c1cccc(C#N)c1 487238405 PDNUYJQYAVXMKK-UHFFFAOYSA-N 390.512 5.093 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(-c2ccccc2F)n1)c1ccccc1 487289321 VKSGBVNVKIFFRA-SFHVURJKSA-N 379.460 5.114 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C)c1ccccc1 488711590 HKYXZEADMKOMPQ-GHTZIAJQSA-N 378.516 5.212 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N(CCC#N)Cc1ccco1 490626573 KQVRRTJSHSAATN-LBPRGKRZSA-N 383.300 5.009 30 20 GKED CC1(C#N)CCN(C(=O)c2oc3ccccc3c2CSC2CCCCC2)CC1 507829774 XAKRNOFCFCTRQP-UHFFFAOYSA-N 396.556 5.765 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(CC2CCCCC2)c2ccccn2)c1 507970047 UBCAUKNCRUZPDA-UHFFFAOYSA-N 391.515 5.116 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)c1nc(O)c2c(-c3ccco3)csc2n1 509642616 YKJXXGBTLCVGDR-LLVKDONJSA-N 379.466 5.382 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccnc(Oc2ccccc2)c1 509858971 ZESZEBBINWPMOC-UHFFFAOYSA-N 391.430 5.665 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccn(-c2ccccc2)n1 510230315 SMCJDMANQMWTAY-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#CC1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)CCCCC1 512966033 FTZVBHXQZXHXPO-UHFFFAOYSA-N 381.863 5.005 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Oc2ccccc2)nc1 513556574 KLPHENCCCLDJSB-UHFFFAOYSA-N 385.467 5.044 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(-c2nc(C)cs2)cc1 513972962 MVHIWWDSKYWHCC-UHFFFAOYSA-N 381.476 5.478 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)cnn1C1CCCCC1 514829209 MZBIDVIEJCDXAQ-CYBMUJFWSA-N 382.533 5.007 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1 514836088 MDWFOROTXLQXNX-UHFFFAOYSA-N 399.899 5.693 30 20 GKED C=CCN(C(=O)c1ccc(CSCC)cc1)c1nc(-c2ccccc2)cs1 515609002 QKGOLIFJYWKACH-UHFFFAOYSA-N 394.565 5.896 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1C 518907275 VNILNWQODUBZAX-QHCPKHFHSA-N 376.500 5.088 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 519422698 GGGZUOWXJZLYEF-KGLIPLIRSA-N 390.961 5.711 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523878172 DGWCDJRYNBJUSX-CQSZACIVSA-N 380.831 5.430 30 20 GKED N#C[C@@H](C(=O)c1ncsc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 527101683 IGZDUXRWFDSADI-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 543944252 JYUQWYKELYEFBV-INIZCTEOSA-N 375.497 5.189 30 20 GKED C[C@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1F 552318135 QZFYTDGDDMIIQR-HXPMCKFVSA-N 378.369 5.398 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(Oc2cccnc2)cc1 554727257 ZTHYFAOZDUTBKD-LJQANCHMSA-N 387.483 5.407 30 20 GKED C=CCc1cc(CNC(C)(C)c2cccc(C(F)(F)F)c2)cc(OC)c1O 557791131 RWJYVIRKLPFFNH-UHFFFAOYSA-N 379.422 5.173 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc2cc(Cl)sc2[nH]1 558606493 XZBPQMXZWLRSNI-JTQLQIEISA-N 375.906 5.387 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 572946042 WSYKCUSUUZKKKF-UHFFFAOYSA-N 379.391 5.162 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1OC(F)F 578789048 TURBCNLZAMXLHW-UHFFFAOYSA-N 387.430 5.158 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1Oc1ccncc1 581048651 KSADDPMQJSUTQB-KRWDZBQOSA-N 391.496 5.426 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 598415483 NGRAHGAFQACMNT-FQEVSTJZSA-N 382.510 5.162 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC2(CCSCC2)CC1 602843126 VJTGGWVQOKNORO-INIZCTEOSA-N 389.590 5.222 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 603527343 KGBQWSSIZCYHBP-RTBURBONSA-N 386.417 5.118 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(-c2nc(C)cs2)c1 606761398 ZRFZMEJRSYUQSK-UHFFFAOYSA-N 388.945 5.662 30 20 GKED N#CCn1c(C(=O)N(Cc2ccccc2F)c2ccccc2)cc2ccccc21 609216054 ZOGZADDIFRMEDY-UHFFFAOYSA-N 383.426 5.151 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 609222173 VRJVCBNHLJSFNZ-MRXNPFEDSA-N 389.430 5.237 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccccc1SCCC#N 609375836 AVYVOINBMCVSAU-CYBMUJFWSA-N 393.339 5.816 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(Cl)c1Cl 609414276 DWQSCWYRBRWZRE-CYBMUJFWSA-N 379.243 5.342 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)cc2)c1 609434394 DGLIBTOABJVMCK-FUUYNRHESA-N 387.483 5.393 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccccc1 609435510 SRWJKSHFOUIHPI-UZLBHIALSA-N 379.529 5.696 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](C)c2ccsc2)cc1 609970090 UNDQUQQKEYKQSL-CQSZACIVSA-N 378.453 5.163 30 20 GKED Cn1c([C@@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccccc2)nc2ccccc21 611392627 ZSILOISMWMNZAU-DHLKQENFSA-N 392.506 5.202 30 20 GKED Cc1csc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 624005295 MDRJGAXADIPUTM-SECBINFHSA-N 386.336 5.914 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCC[C@@H]1c1cccs1 642480470 WSVZZDLSLHHHKR-LJQANCHMSA-N 378.522 5.578 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(OCC)cc3)n2)nnc1C1CC1 645075485 CIHRJHWQPYCVTB-UHFFFAOYSA-N 398.557 5.156 30 20 GKED C[C@@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(C(F)F)nc1 658256061 WEKSYYFEPFFBHO-SECBINFHSA-N 378.307 5.723 30 20 GKED CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 675160074 RLEVNXMXJFCZDF-IBGZPJMESA-N 394.478 5.208 30 20 GKED COc1cccc2cc(C(C)=NNc3ccc(OCC(F)(F)F)cc3)oc12 727262849 ZVNBHERGFQSNNN-UHFFFAOYSA-N 378.350 5.219 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)NCc2ccc(OCC#N)cc2)C(C)C)cc1 727938239 HQCPIWDVGFNURB-MBSDFSHPSA-N 393.531 5.299 30 20 GKED Brc1ccc(-c2nc3c(s2)C(=NNc2ccccn2)CCC3)cc1 728427353 CGNJGWFKGURIOB-UHFFFAOYSA-N 399.317 5.120 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C\c1cccc(F)c1 730995744 SDQPOAQZTVZNOF-YVMONPNESA-N 394.393 5.502 30 20 GKED Cc1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)c2ccc(F)cc2)o1 731162317 JOMVWTBRPFZSAA-UHFFFAOYSA-N 399.878 5.656 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 731318811 DIISRYLZDGPQGC-LBPRGKRZSA-N 391.949 5.552 30 20 GKED N#CCn1c(C(=O)O[C@H](c2cncc(F)c2)C2CCCCC2)cc2ccccc21 731776437 ZXDGCWCBLFIHAW-QFIPXVFZSA-N 391.446 5.177 30 20 GKED C=CC[C@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)c1ccncc1 734510087 QEVYOKZGBCZFEI-DEOSSOPVSA-N 398.510 5.024 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(SC(F)F)cc1 734980920 MSMQQIXYYQCXCW-RAXLEYEMSA-N 397.446 5.871 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1C#N 742366989 ABPUXOJZSLFEDZ-MRXNPFEDSA-N 376.431 5.349 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 743709015 PYHWANIVHCEHMW-KUHUBIRLSA-N 387.405 5.185 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccncc1 745826603 BSZDXAVETAYSIM-NRFANRHFSA-N 385.458 5.131 30 20 GKED Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 747904669 NAVTZYBQEUBWPB-ROUUACIJSA-N 378.522 5.077 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1cc(Cl)ccc1OCC#N 754677801 WGZOXSHJIANMCD-CQSZACIVSA-N 397.931 5.525 30 20 GKED C[C@H](CC(=O)OCCC(C#N)(c1ccccc1)c1ccccc1)c1ccncc1 754950069 USWMPPGMHHCIGO-HXUWFJFHSA-N 384.479 5.018 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccc(F)cc3)on2)cc1 761929190 MPEDXKFWVBACSW-NRFANRHFSA-N 397.409 5.388 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)c1 772982724 HLUFURZVZQRXDW-UZLBHIALSA-N 391.540 5.650 30 20 GKED O=C1C/C(=C\c2csc(-c3ccc(Cl)cc3)n2)C(=O)c2ccccc2N1 774146580 WFKJACSXMLVKDC-UKTHLTGXSA-N 380.856 5.072 30 20 GKED COc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc(OC)c1C(C)C 778534029 USPPHZIGWDBWKK-UHFFFAOYSA-N 389.908 5.161 30 20 GKED CCc1noc(C2CCC(=NNc3cc(C)c4cc(Cl)ccc4n3)CC2)n1 778540544 RDBTZUDWZSEFMQ-UHFFFAOYSA-N 383.883 5.268 30 20 GKED CC(C)(C)OC(=O)N[C@@H]1C[C@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 780730512 SXJCKBCSPCVQSX-FDFHNCONSA-N 391.515 5.332 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1c[nH]c2ccccc12 786320614 CBCOLUKENVKTSJ-IUODEOHRSA-N 393.899 5.801 30 20 GKED COc1ccccc1-c1ncc(C=NN(c2ccccc2)c2ccccc2)cn1 792872610 OTNSZTQIYCVVND-UHFFFAOYSA-N 380.451 5.324 30 20 GKED COCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCC1 793124254 KNXPJIAHHMNEEV-ZDUSSCGKSA-N 395.311 5.110 30 20 GKED CON(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 812935651 GDQXLPAEHPDGJD-CQSZACIVSA-N 389.908 5.330 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc2ccccc12)c1cc(C(F)(F)F)ccn1 813212235 ZVJFJCGJZZCVAE-GOSISDBHSA-N 398.384 5.289 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(c3cc(Cl)cc(Cl)c3)C2=O)cc1 814297769 SHRKQZZBLDNVSN-PJQLUOCWSA-N 391.304 5.271 30 20 GKED N#CC1(c2ccc(CNc3ccc(OC(F)F)cc3OC(F)F)cc2)CC1 850208258 IIGRHFZYZBPUMR-UHFFFAOYSA-N 380.341 5.057 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(F)c(Cl)c2)cc1 915085608 NXECZDQGWDGAJJ-LJQANCHMSA-N 394.833 5.152 30 20 GKED Cc1nc(-c2c[nH]c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2)cs1 915086045 FSSRROPVYLMYNC-HXUWFJFHSA-N 398.491 5.354 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3Cc4ccccc4S3)n2)cc1 915099845 CYSHBBDUHHOHHT-VQIMIIECSA-N 376.506 5.012 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@@H](C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc1 916938903 MRSYKBNROOJRGK-SCBHQAGPSA-N 398.865 5.137 30 20 GKED O=C(/C=C\c1cccc(Oc2ccccc2)c1)c1ccc(N2CCOC2=O)cc1 920749176 FMDJSSNUFRDQNV-ZROIWOOFSA-N 385.419 5.332 30 20 GKED C/C(=C/C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccc(F)cc1 921281737 UMUBHVMNZAWQOQ-SQFISAMPSA-N 387.414 5.235 30 20 GKED CC(CCCCCCC(=O)O)=NNc1ccc(Cl)cc1Br 1776093904 QTZFFANLFUPDSW-UHFFFAOYSA-N 375.694 5.316 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1OC(F)F 1776120217 YPKNWZDLHJNZJN-SDNWHVSQSA-N 394.373 5.549 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(N(C)C)cc1C(F)(F)F 1776784219 VPOZZGYGQRJUQO-INIZCTEOSA-N 388.474 5.065 30 20 GKED C[C@H](C#N)Sc1nc2scc(-c3cccs3)c2c(=O)n1-c1ccccc1 5583253 LCVOZNZSTYNWKE-GFCCVEGCSA-N 395.534 5.180 30 20 GKED C=CCn1c(SCC(=O)c2ccc(C)s2)nnc1-c1ccc(Cl)cc1 7393643 VDBMWKGTZQOBQA-UHFFFAOYSA-N 389.933 5.129 30 20 GKED N#Cc1cccc(OCCSc2nnc(-c3ccco3)n2C2CCCCC2)c1 59407491 LIEQFWBPTSWEIW-UHFFFAOYSA-N 394.500 5.086 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 63400569 RDBRWGOFYURWJM-OAQYLSRUSA-N 379.891 5.061 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1 64742471 IYGGKYKEXOSNSL-UHFFFAOYSA-N 390.270 5.070 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1c(C)noc1C 66334942 DDRAASPLOUJBKT-HXUWFJFHSA-N 389.455 5.396 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 71813544 ITVNLQPSSYTSTN-SOFGYWHQSA-N 388.807 5.407 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CC1 108530086 KPAMGZBCXOVXGI-OAHLLOKOSA-N 383.492 5.274 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc3ccc(F)cc3c2C)cc1 111018852 HSUIHXXNMFPKOB-UHFFFAOYSA-N 382.460 5.308 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1csc(-c2ccco2)n1 151063010 RXUGFKUZCKRDST-ZDUSSCGKSA-N 398.513 5.119 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccccc1 151391233 HGDDSJYKAJZGFQ-FQEVSTJZSA-N 395.553 5.566 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 159516802 ZVSNJJPIYHPYPG-GFCCVEGCSA-N 376.913 5.325 30 20 GKED CC(C)(C#N)CCCSCc1nc(-c2cccc(Br)c2)no1 161225849 RVIDFDXQDRXHCX-UHFFFAOYSA-N 380.311 5.062 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 173969508 RQNCBWVXRPSXCL-QRWLVFNGSA-N 375.859 5.133 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1cc(N2CCOC2=O)ccc1C 174533412 YXZCNGJRKHHHIQ-UHFFFAOYSA-N 375.513 5.166 30 20 GKED C=C[C@](C)(CCOC)COC(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C 191162526 TZVJFQJRWRUGRJ-LJQANCHMSA-N 397.393 5.054 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2CCSCC2)cc1Cl 195450887 AVERQENTBJBYBG-GOSISDBHSA-N 385.920 5.013 30 20 GKED CC(C)COc1ccc(C(C)(C)NCc2ccc(N(C)CCC#N)cc2)cc1 236666693 XMEHKQNMUMQJQH-UHFFFAOYSA-N 379.548 5.096 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C1(C)C 276366043 MIYSODJGGOISQH-IUODEOHRSA-N 385.455 5.276 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C[C@H]1C 296540828 FDGZLLZUGHQTFX-MGPQQGTHSA-N 385.455 5.276 30 20 GKED N#Cc1cc(N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)ccc1[N+](=O)[O-] 302188015 JMCMVVWHHLBETM-MRXNPFEDSA-N 394.431 5.219 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410688651 OEBCUMLOBBSIGU-KCJUWKMLSA-N 395.265 5.356 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425658363 JEUGZEGVDRGKKE-KRWDZBQOSA-N 379.504 5.407 30 20 GKED C=CCC[C@H](NC(=O)c1cn(C)nc1C(C)(C)C)c1ccc(C(F)(F)F)cc1 426260853 LOVUCVIDMSCFBM-KRWDZBQOSA-N 393.453 5.174 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)c1 429793546 MQBGKAGDLVLQDC-UHFFFAOYSA-N 380.419 5.500 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430588872 ATMALGDZNXMEAP-AWEZNQCLSA-N 381.526 5.363 30 20 GKED CC(C)(C)[C@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)c2ccccc21 434989677 BVLVSXOQWFABGD-NRFANRHFSA-N 385.515 5.009 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc(Cl)c2)cc1C(F)(F)F 438643642 UYUJYVIQNVTSGM-QGZVFWFLSA-N 393.796 5.599 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)cc1 439314322 MVSXLVROYXUJRJ-SFHVURJKSA-N 375.394 5.290 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 448896410 QLOZRCPBHYWAOF-QGZVFWFLSA-N 390.405 5.363 30 20 GKED C[C@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(Oc2ccccc2)c(F)c1 454285747 HFFRUAQDWSKNOW-BQFCYCMXSA-N 381.451 5.061 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCCC[C@H]1c1ccncc1)c1ccccc1 458807642 XUWNSVCZWJHWJV-YADHBBJMSA-N 376.504 5.143 30 20 GKED CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)Nc2ccccc2SCCC#N)c1 463796036 XUBUQSRJUYCVSC-UHFFFAOYSA-N 399.491 5.068 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)c1c(Cl)cccc1Oc1ccccc1Cl 464708612 JEGPKEVGMZPFHM-INIZCTEOSA-N 377.271 5.454 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3C[C@H]4CCC[C@H]4C3)cc2Cl)c1 465252667 PNDFCBOKGODRNC-HDICACEKSA-N 395.890 5.054 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2)cc1 467096006 WWBSCRIOSSXDDI-OAQYLSRUSA-N 395.487 5.671 30 20 GKED Cc1c([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cnn1C(C)(C)C 469202451 TUBQTPVFNOPAAQ-QZTJIDSGSA-N 386.543 5.897 30 20 GKED CC(C)Oc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469303769 XWJFDRZKPCHDOX-SFHVURJKSA-N 391.515 5.230 30 20 GKED CO[C@@]1(C)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 471204546 YVUGNIGWKOFNAO-KNQAVFIVSA-N 397.906 5.028 30 20 GKED C=CCCC1(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1 475026755 BLBUBJYIYWTTJY-MRXNPFEDSA-N 380.463 5.002 30 20 GKED N#Cc1ccc(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)c(F)c1 475491080 GIGYIUSNZODTKE-UHFFFAOYSA-N 377.366 5.452 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1c[nH]c2cc(F)ccc12 475546021 KNIVIFANPDAOII-UHFFFAOYSA-N 379.479 5.523 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc2c(cc1OC)C[C@H](C)O2 475564350 AKRMHTHNWFHURA-INIZCTEOSA-N 394.515 5.192 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](COc1ccccc1)c1ccccc1)c1ccccc1 475757184 QQYQXYFENDTWAP-UPVQGACJSA-N 384.479 5.010 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(Cc2ccccc2)s1 476165370 SVZRNRNVYRMAHC-UHFFFAOYSA-N 376.525 5.838 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1Cl 503530218 BYYRQIBWWHNOPS-GFCCVEGCSA-N 388.826 5.540 30 20 GKED Cc1ccc(-c2csc(CNc3ccccc3SC[C@@H](C)C#N)n2)cc1 506300344 ZYBASWDOXCLMKX-INIZCTEOSA-N 379.554 5.982 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(SC(C)C)cc1 508582161 YYPBHIDYEQSAII-GOSISDBHSA-N 395.572 5.742 30 20 GKED CC(C)(CNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 510399260 RCBOVHVLILPZRS-UHFFFAOYSA-N 376.481 5.120 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4ncco4)c3)cc2)cc1 513958953 BJJVFLIKJIPRAD-UHFFFAOYSA-N 395.418 5.452 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1cc(Cl)ccc1Cl 519412245 WGRNBRWHTBSSRP-LBPRGKRZSA-N 395.311 5.263 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)[C@@H](C)Oc3ccccc3C#N)c2)C1 521670821 YZHHYSFDSXETFA-JBYIUTFZSA-N 392.499 5.060 30 20 GKED CCN(C(=O)c1ccc(C)c(Oc2ccncc2)c1)[C@@H](C)c1ccc(C#N)cc1 522305140 VPNRWWRXXCMFQZ-SFHVURJKSA-N 385.467 5.277 30 20 GKED C[C@@H](CC#N)NC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525060398 VAFBYVGDPIUHEV-LBPRGKRZSA-N 379.312 5.318 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)C[C@H](CC#N)c3ccccc3)CC2)cc1 526983522 KVJYMRXBHQQSIW-QFIPXVFZSA-N 390.527 5.267 30 20 GKED C[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc(Cl)cn1 527178723 XVXORTKKWBLQON-AWEZNQCLSA-N 393.899 5.249 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(Cl)c2c(c1)OCCCO2 531389529 GWCQOZYQWIJEFJ-AWEZNQCLSA-N 388.920 5.365 30 20 GKED C[C@@H](Nc1ccc(C#N)cc1Br)c1nc2ccccc2n1C(F)F 534880066 LLASJCLSLOYBDA-SNVBAGLBSA-N 391.219 5.239 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccccc1 536163535 PNSDNJPICMBYGK-QFBILLFUSA-N 385.891 5.196 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1sc(C)c(C)c1C#N 537392900 UCYDHVQOYRXRTK-UHFFFAOYSA-N 389.502 5.289 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1cccc(C)c1 537558020 XFAKEBISYCNWDX-OAHLLOKOSA-N 376.485 5.434 30 20 GKED CCN(C(=O)Cc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1)c1ccccc1 540838889 IQXWDGFQNBEQFD-IBGZPJMESA-N 383.495 5.327 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 551330609 JYLXFMYNNLDXMN-UHFFFAOYSA-N 393.446 5.246 30 20 GKED C=CCN(Cc1csc(-c2ccc(OC)c(OC)c2)n1)Cc1ccccc1F 557035131 UZTJHZPKLZJYED-UHFFFAOYSA-N 398.503 5.155 30 20 GKED CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 558511516 PONWXFSFTARNQP-IERDGZPVSA-N 378.476 5.178 30 20 GKED Cc1cc(Cl)c2ncc(C#N)c(N[C@H](c3ccccc3)c3nccn3C)c2c1 558754307 CUZKWUDPGNYDJO-HXUWFJFHSA-N 387.874 5.003 30 20 GKED O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1cccc(C(F)(F)F)c1F 566938944 LXLAMNXCIRBSPR-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C=CCn1c(SCc2cscc2Br)nnc1-c1ccoc1C 570353912 DIXYPWLIFFHDHZ-UHFFFAOYSA-N 396.335 5.149 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC4(CCCC4)CC3)c2)cc1 573167936 FQORQTRKBPCGAF-UHFFFAOYSA-N 375.472 5.539 30 20 GKED CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)N1CCC[C@@H](CC#N)C1 597052593 UEYSMVBOHDWULJ-JTQLQIEISA-N 391.846 5.238 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1csc(C(F)(F)F)c1 599737600 MYVIGDMBBWWZEY-NSHDSACASA-N 399.463 5.483 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F)c1cccc(C#N)c1 600850279 UYUVRDHDCYIGNZ-ZDUSSCGKSA-N 399.372 5.595 30 20 GKED Cc1ccc(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 603817312 WGMRBXZXMANBHD-FQEVSTJZSA-N 393.874 5.261 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1C 604044205 BRKUSMHDHMCCDM-LJQANCHMSA-N 399.494 5.193 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 609403072 QHYCCQLDMZIYMJ-MRXNPFEDSA-N 379.529 5.443 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434453 LKDRFWQFMLCANI-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCc1ccc([C@H](C)CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 609968233 QAJJHTVSDHMGEZ-QGZVFWFLSA-N 399.494 5.749 30 20 GKED CC[C@@](C)(NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1nccs1 610049355 SUAMQVOSNORXQT-OAQYLSRUSA-N 395.459 5.001 30 20 GKED CCN(C(=O)C[C@@H](C)c1ccccc1C(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 610171617 XQAZPRYOSCTAAT-CVEARBPZSA-N 388.433 5.680 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(C#N)cc1F)c1ccccc1Cl 610258769 WJTGKJYBIRKLAU-QFIPXVFZSA-N 380.850 5.239 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c(Cl)cccc3Cl)cn2)cc1 610472499 UOVKNRSJNPGSOO-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610584080 ZMJWLGIBVKUALK-VGSWGCGISA-N 398.466 5.155 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c(Cl)cc1F 610737583 ZPCSQOHVQRAONI-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc([C@@H]3CCCS3)no2)cc1Cl 612949651 ZCHHAWNUWMXIDI-KRWDZBQOSA-N 383.860 5.622 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc(-c2ccccc2)cs1 613392089 IQGKDEITRDOEMJ-FQEVSTJZSA-N 388.492 5.622 30 20 GKED C=CCC1(C(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CCCCC1 648139064 CSIZTSQORMBGGX-STQMWFEESA-N 385.392 5.539 30 20 GKED CC(F)(F)c1cccc(NC(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c1 682055331 JGWSCNNJEWPRIZ-GHMZBOCLSA-N 390.274 5.003 30 20 GKED Fc1cccc2c(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)ncnc12 683382817 BSMZBGJBSIMACH-IUCAKERBSA-N 381.295 5.090 30 20 GKED COC1CCN(c2ccc(Nc3cccc(F)c3C#N)cc2C(F)(F)F)CC1 728052224 IZVHUKZCOZKQLQ-UHFFFAOYSA-N 393.384 5.075 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)N(CCC#N)Cc1ccccn1 728871521 VZGIWGNOVNFSGX-BUHFOSPRSA-N 387.483 5.126 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730421460 KNPMFGPMEGMTQG-DNVCBOLYSA-N 384.501 5.429 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(Cc2cccc(C)c2)CC(C)C)c1 733808243 YTAWRIVTABXFMI-QFIPXVFZSA-N 393.531 5.044 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@@H](C)/N=C\c1cc(Br)ccc1O 735978747 KSEZKHOKACXWLF-PVXMUIKYSA-N 382.685 5.003 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(Br)c2)c(SC)cc1OC 741165089 GNPSKAMOMNXBSI-BQYQJAHWSA-N 393.302 5.084 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cc(Cl)ccc1Br 742432583 CKVYLQFZQDIUIL-YVMONPNESA-N 381.701 5.393 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1ccc2c(c1)COC2 742437778 XMXRQMVDXZDROZ-KTKRTIGZSA-N 392.886 5.128 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 742643032 WYGPATPPPALHGZ-UHFFFAOYSA-N 387.524 5.134 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746126351 XDBQUMSNJUPEER-JOCHJYFZSA-N 393.446 5.558 30 20 GKED Cc1ccc(-c2ncc(C(=O)OC[C@H](C#N)Cc3ccc(F)cc3)s2)c(C)c1 747114706 LQGCHFQYLBGIPN-KRWDZBQOSA-N 394.471 5.105 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)cc1OCCCC#N 747361067 BBDMJNNPJZSERB-CLFYSBASSA-N 389.373 5.293 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)cc1Cl 747705336 CYAGPNMAIMWIAS-UHFFFAOYSA-N 394.931 5.225 30 20 GKED O=C(CSC(F)(F)F)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 750216210 IKELQDRXFLDTHV-VIFPVBQESA-N 386.235 5.105 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)COc2c(Cl)cc(Cl)cc21 753141937 JWTWMSOYURILDJ-YHYXMXQVSA-N 389.263 5.171 30 20 GKED CCn1cc(C(=O)/C=C/c2nc(-c3cc(Cl)ccc3Cl)cs2)cn1 753900572 NYMUPGVOMIGJPF-AATRIKPKSA-N 378.284 5.229 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(Cl)cc1Cl 754393042 RUBORVGRZJFSPH-QMMMGPOBSA-N 388.081 5.663 30 20 GKED Cc1ncsc1/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 776782582 KUWLNTAOKSUQCZ-QZEKMECESA-N 393.899 5.412 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1cc(C(F)(F)F)cnc1Cl 779766073 WVHLQTJFRCAXME-UHFFFAOYSA-N 386.654 5.164 30 20 GKED N#CCC1CCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)CC1 781834789 MEOZWHVVIYFOSJ-AWEZNQCLSA-N 398.359 5.130 30 20 GKED C[C@H](NC(=O)/C=C/SCc1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 782485250 FYYMKAZORMAZJX-HVJHFUJKSA-N 388.492 5.443 30 20 GKED C[C@@H](NC(=O)/C=C\SCc1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 782485253 FYYMKAZORMAZJX-QAAVPBIRSA-N 388.492 5.443 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 782827095 YKZCPRQHKJKHLH-QHCPKHFHSA-N 397.478 5.043 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cc(C(F)(F)F)ccc1Br 810152128 UCAFYKGILQWNSP-NSHDSACASA-N 399.210 5.371 30 20 GKED N#C[C@H](C(=O)[C@@H]1CSC[C@H]1c1ccccc1)c1nc2cc(Cl)ccc2s1 845452890 ZYLSFTRVQKEWMQ-OWCLPIDISA-N 398.940 5.273 30 20 GKED CC(C)(CC(F)(F)F)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 850796635 NOTAIRLDZQPFEA-SECBINFHSA-N 388.361 5.243 30 20 GKED C[C@@H](Nc1ccc([C@@H](O)C(F)(F)F)cc1)c1ccc(F)cc1C(F)(F)F 864021361 AWHODTUYUNINLK-RFAUZJTJSA-N 381.291 5.613 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)/C=C/c3nc4ccccc4s3)c2C#N)C1 877880245 HKIXJBDFSRYRIX-IDVQTMNDSA-N 379.510 5.006 30 20 GKED CC(=O)c1ccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915124255 AOKHPNKMRZFCRB-QFIPXVFZSA-N 385.492 5.354 30 20 GKED C[C@@H](CCc1ccccc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353457 UKRHIFMCKFYOAK-CYFREDJKSA-N 383.495 5.485 30 20 GKED CCCCCCCCCCC(=O)N1CCCN(C(=O)c2cccc(F)c2)CC1 915699548 ZNSXIBRUWQGBRT-UHFFFAOYSA-N 390.543 5.031 30 20 GKED Cc1cc(C=Nn2c(S)nnc2[C@@H]2CCCO2)c2c(C)ccc(C(C)C)cc1-2 916367604 IJRBWBDCXNBPQV-IBGZPJMESA-N 394.544 5.146 30 20 GKED Cc1c(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)oc2ccc(Cl)cc12 916907484 BFMWRZMTOYELTL-CYBMUJFWSA-N 387.222 5.009 30 20 GKED Cc1cc(C)c(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 917043621 LBSKSWRSDDDBCP-HNNXBMFYSA-N 384.888 5.130 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/Sc3ccccc3)n2)cc1 920138850 LAJLQPMFFWXECI-IENJSVCTSA-N 392.505 5.301 30 20 GKED CC(C)Oc1cc(Cl)c(C=NNc2ccc(C(=O)O)c(F)c2)cc1Cl 1776075811 GFYXKUHIEMKTNM-UHFFFAOYSA-N 385.222 5.064 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3ccc4ccccc4c3)cc2)c1 1776130931 AZSWDWQEFHXCRO-GDNBJRDFSA-N 392.454 6.030 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(O)c(C(=O)O)c2)o1)c1ccc2ccccc2c1 1776131222 LMRPFAMHYZOQKY-FLIBITNWSA-N 384.387 5.400 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](Cc2ccc(C)cc2)C(=O)O)cc1 1776786293 MKVDLUBRXIZELV-HSZRJFAPSA-N 397.559 5.377 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)ccc1C(=O)O 1777289143 VHYWZTUCXKMAQP-XVNBXDOJSA-N 385.630 5.250 30 20 GKED COc1ccc(/C=C/C(=O)c2coc3c(C)cccc23)c2cc(C(=O)O)oc12 1777361565 PJBGHXBIUNJUJT-SOFGYWHQSA-N 376.364 5.090 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(Cl)c(Br)c1F 1777436150 NFJZHVUYFXWWAQ-FNORWQNLSA-N 397.627 5.144 30 20 GKED O=C(/C=C/c1cc2cc(Br)ccc2s1)c1csc(C(=O)O)c1 1777569348 GTFKEQJAUIFMIB-NSCUHMNNSA-N 393.283 5.320 30 20 GKED C=CCn1c(SCc2cc3ccccc3nc2Cl)nc2ccccc2c1=O 8542079 GOBSKFVNIMVTPJ-UHFFFAOYSA-N 393.899 5.076 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1cccc(C)c1 15748027 DOGFRABGXKXRLP-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1 25120048 NKUULWBNLKKGFS-UHFFFAOYSA-N 386.417 5.047 30 20 GKED O/C(CSc1ccc(F)cc1)=N\c1nc(-c2cccc3ccccc23)n[nH]1 65515001 FZIGKLUKBIJUOU-UHFFFAOYSA-N 378.432 5.144 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66801155 QNAPQGWLQYUGTO-CQSZACIVSA-N 393.537 5.765 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 66954928 ZHZXXWFCMJSJSV-UYAOXDASSA-N 393.556 5.882 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1csc(-c2cccc(OC)c2)n1 108406851 KHABGNMOOWWAQG-UHFFFAOYSA-N 380.513 5.016 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 124358702 AGIKQQCIKHAOKZ-UHFFFAOYSA-N 396.450 5.182 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)c1nc(-c2ccccc2)cs1 155441816 FLMWDGWOBIIPGM-ZDUSSCGKSA-N 388.279 5.363 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC[C@H]2c2ccncc2)cc1 175190240 ZYSWWLRZRBVECZ-NRFANRHFSA-N 385.492 5.082 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)s1 175656708 MUQMKCDODLEOGJ-GFCCVEGCSA-N 389.546 5.003 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 180392109 ATXPBZVLJISXJY-CYBMUJFWSA-N 378.419 5.313 30 20 GKED COc1ccc(CNc2ccc(Cl)c(OC(F)F)c2)cc1OCCCC#N 181168531 VFUVNUVKOUHIGH-UHFFFAOYSA-N 396.821 5.245 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3ccccc3O[C@H](C)C#N)sc2C)cc1 182131356 YHNWGENCEOPWBB-CQSZACIVSA-N 392.480 5.275 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2cccc(F)c2)C1 191442782 KZSUOFNNMADUCU-NRFANRHFSA-N 382.479 5.283 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)cc1 211738712 TWGDVJFSUICPGE-JYRVWZFOSA-N 379.818 5.628 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@@H](C)CC3)s1 410990034 VNSHMIHYXOHIBR-JBLDHEPKSA-N 389.546 5.030 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)c(C)c2c1 425471118 GOANAJIQDUAEBP-HOTGVXAUSA-N 391.471 5.085 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cnc(-c3ccsc3)s2)cc1 437242066 VECVHPWBPLJYOD-UHFFFAOYSA-N 395.553 5.298 30 20 GKED CCCCOc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c(C)c1 437899459 VFDGUAGWCTUEEB-FYYLOGMGSA-N 391.515 5.478 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CC1 440930458 UNAALUDHOKFMCP-UHFFFAOYSA-N 375.900 5.113 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccncc3Oc3ccccc3)n2)c1 441066719 PHGLDJWDNQOXIB-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1coc(-c2cc(NC(=O)c3cn(CCCC#N)c4ccccc34)ccc2C)n1 444307553 ZAYRABHBLBZSJA-UHFFFAOYSA-N 398.466 5.469 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3c(F)cccc3Oc3ccccc3)on2)c1 447464236 VLBRKPWVDWSSSX-UHFFFAOYSA-N 399.381 5.397 30 20 GKED N#CCCC[C@@H](NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2)c1ccccc1 458827609 DKIJPBBMKABYGG-QHGAOEGBSA-N 393.453 5.376 30 20 GKED C=CC[C@@H](CC)NC(=O)c1cc2ccccc2cc1OCc1c(C)noc1C 467687978 KAGXXYJWSUAFRZ-LJQANCHMSA-N 378.472 5.108 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C(=O)Nc1ccc(COC(C)C)cc1 475188143 YECOQVKGMIOQQN-UHFFFAOYSA-N 394.515 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(OC2CCC(C)CC2)CC1 475562320 FJJKRUKEBKKGAN-UHFFFAOYSA-N 398.591 6.130 30 20 GKED CC(C)CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 482383180 GZGSHJBINYOXRJ-UHFFFAOYSA-N 395.462 5.525 30 20 GKED Cc1cc(F)c2nc(O)cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2c1 489419627 WTKRJMKAYLWKBN-CYBMUJFWSA-N 395.459 5.035 30 20 GKED FC(F)Oc1ccccc1CN[C@@H](c1ccccc1OC(F)F)C(F)(F)F 491272947 VXWKWCSLNGSGPX-AWEZNQCLSA-N 397.290 5.283 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1cccc(C(F)(F)F)c1 492750034 OZUFPHHWELXYIG-NSHDSACASA-N 383.211 5.190 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc(SCCCC)s2)c1C 496353911 BQUDSQJIKRPMJY-UHFFFAOYSA-N 381.592 5.010 30 20 GKED CC(C)[C@@](C)(NCCCC1(C#N)CCOCC1)c1ccc(Br)cc1 499718418 KSPUMMZOUCLERW-LJQANCHMSA-N 393.369 5.010 30 20 GKED Cc1ccc([C@H](NC(=O)c2sc3ccc(C#N)cc3c2C)c2ccccn2)cc1 510073971 PQAJFBPRLOXPMK-QFIPXVFZSA-N 397.503 5.304 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc(Cl)ccc2Cl)cc1 510965440 FYOBBMIXZPJFIW-UHFFFAOYSA-N 387.188 5.070 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 515540145 LENFUXIRGWRWTO-MRXNPFEDSA-N 384.888 5.619 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccc(Cl)c(Cl)c1 518319967 FCCIGSRCULNXFE-VBQJREDUSA-N 379.674 5.131 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 518662990 XDGHLNJPGHMWQT-AWEZNQCLSA-N 396.899 6.104 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518667695 IXAOOEAIHINADE-UWJYYQICSA-N 398.597 5.835 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)NC[C@@H](C)c1ccccc1 520268110 WKZVSQHKXQQLFL-MOPGFXCFSA-N 399.494 5.071 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)cc2)cc1 520558884 UUBVAYMQLOSLMC-MOPGFXCFSA-N 388.389 5.658 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H](c2ccccc2)[C@@H]2CCCO2)c1 521831519 ZNKSMRSWVHLZOC-UIOOFZCWSA-N 398.506 5.147 30 20 GKED C=CCC[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc(C(F)(F)F)cc1 533528741 JXIFLWIRZCFFOI-HXUWFJFHSA-N 389.465 5.498 30 20 GKED O=C(CCCC(F)(F)F)N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F 541112783 ZLHMDCKHJPVGJQ-LLVKDONJSA-N 397.237 5.037 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(C)c(C)c2Cl)cc1 543075683 JWPBSIPMBZJWMZ-UHFFFAOYSA-N 382.891 5.023 30 20 GKED COCC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)c(Cl)c1 551818046 SMNVTVBOPKCMRR-BLVKFPJESA-N 381.278 5.433 30 20 GKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc2cc(Br)ccc2o1 560263328 ZMPPRTWNPGFVPX-ZDUSSCGKSA-N 381.273 5.407 30 20 GKED CN(CCOCc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 571837846 UTFXULWXCNNAEC-UHFFFAOYSA-N 399.450 5.138 30 20 GKED C=CCOc1ccccc1-c1nc(-c2ccc(COCC(F)(F)F)cc2)no1 573760995 UEXXHVUIMUPDHH-UHFFFAOYSA-N 390.361 5.047 30 20 GKED Cc1cc(NC(=O)C(C)(C)c2cc(F)cc(C#N)c2)ccc1Oc1ccncc1 573869932 OTKISVHAXTWVSB-UHFFFAOYSA-N 389.430 5.109 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](F)(c2ccccc2)C1 576532171 HTENKYRIJJXMFQ-HRAATJIYSA-N 383.492 5.183 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SCCOc1cccc(C#N)c1 579051590 WGENCYFXGZJCNN-KRWDZBQOSA-N 382.529 5.129 30 20 GKED Cc1nc(-c2ccc(NC(=O)NC3(c4ccc(C#N)cc4)CCC3)cc2)oc1C 594071044 LDAQFTKPEKGBPJ-UHFFFAOYSA-N 386.455 5.031 30 20 GKED N#CC1(c2ccc(CN[C@H](Cc3ccc(Cl)cc3)c3ccccn3)cc2)CC1 594935887 QVHJXPOWWVNYRA-HSZRJFAPSA-N 387.914 5.364 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccc(Cl)cc1 603961873 LSQARXWYHAUAJS-UHFFFAOYSA-N 391.858 5.315 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1nccc2ccccc12 609072532 PCVUDKJIQZHDMR-UHFFFAOYSA-N 393.446 5.246 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 609079032 XYBJUKDZPVNBCV-UHFFFAOYSA-N 399.494 5.418 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)[nH]1 609377616 ZODCRBNRODQCFQ-KRWDZBQOSA-N 389.524 5.505 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1OC 609378057 PREXPTMAFZJOAA-INIZCTEOSA-N 398.528 5.378 30 20 GKED C[C@H](NCc1ccc(-c2ccc(Br)cc2)o1)c1cccc(C#N)c1 610344937 NRTWAJGYVOLYMA-AWEZNQCLSA-N 381.273 5.432 30 20 GKED C[C@H](NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1cccc(C#N)c1 610364599 SDAULVGHQIBDAO-KSFYIVLOSA-N 390.483 5.408 30 20 GKED C=CCN(Cc1ccccc1)C(=O)NCc1ccc(-c2csc(C)n2)s1 612208896 QJMATUYNJSFCRZ-UHFFFAOYSA-N 383.542 5.078 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)(F)F)cc1)c1nc(-c2ccccc2)cs1 642281543 ILPNSQHMPQWURN-HNNXBMFYSA-N 388.370 5.199 30 20 GKED COc1ccc2ccc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)cc2c1 645959992 VOVFEAACRAIYJL-QGZVFWFLSA-N 376.412 5.087 30 20 GKED Cn1cc2c(n1)CCC[C@H]2Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647323504 RPVFMKLJVBRIAU-CYBMUJFWSA-N 395.322 5.199 30 20 GKED C=CC[C@H]1CCCC[C@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 665395561 MSHJGJZAMBWPIE-QFBILLFUSA-N 381.476 5.097 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1ccc(C#N)c(Cl)c1 726446205 VDVFGTIPCDLOPF-UHFFFAOYSA-N 382.341 5.312 30 20 GKED CC(=NNc1ccc([N+](=O)[O-])cc1Cl)c1sc2nc(C)nc(C)c2c1C 727649440 INMSXBAYSIITBM-UHFFFAOYSA-N 389.868 5.014 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ccc(O[C@@H](C)C#N)cc1 728698108 LRJNPGFPJJIMFT-CLUXPMKYSA-N 392.455 5.445 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3nc(Cl)ccc3Cl)c2)cc1 729375636 OODQJDSKVSNUSI-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)/C=C/c1ccccc1O[C@H](C)CC 729827612 QAZWIUOAMWISDI-CLHDZIPGSA-N 399.494 5.013 30 20 GKED C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730380361 UMPLNCNTVWCYKC-MHECFPHRSA-N 381.479 5.493 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C\c1ccccc1F 730996695 YPIRHMKIACMEGV-TWGQIWQCSA-N 394.393 5.502 30 20 GKED CC(C)COc1ccc(C2(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)CCC2)cc1 731768408 IKNOAQWOXVJPEN-QFIPXVFZSA-N 398.506 5.568 30 20 GKED C=CC[C@@H](NC(=O)[C@H](C)Sc1cc(Cl)ccc1Cl)c1ccncc1 734360008 FFBHPIMYEOVLDZ-BLLLJJGKSA-N 381.328 5.303 30 20 GKED C=CC[C@@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1ccncc1 734360992 QDHDTUUYCXBOEQ-GOSISDBHSA-N 382.916 5.414 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 734654188 QSLJOMVDIDFLNV-PIGZYNQJSA-N 382.266 5.205 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(N4CCCCC4)cc3)c2)s1 740014164 NHHXOPOETIGQEV-UHFFFAOYSA-N 387.552 5.567 30 20 GKED Cc1cc(/C=C2/CCc3cc(C#N)ccc3C2=O)cc(C)c1OCc1ccccn1 742438430 XFLBNWSEWFQXPT-HMAPJEAMSA-N 394.474 5.362 30 20 GKED N#Cc1ccc(NC(=S)N2CC[C@@H](CSc3ccccc3)C2)cc1Cl 743019325 VFYNVOLCJXVSBI-CQSZACIVSA-N 387.961 5.023 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 752235171 IGBVIOFEQQNRHC-KBXCAEBGSA-N 385.920 5.571 30 20 GKED C#CC[C@H](NC(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 757760798 JCGCCHORQUAFDH-QFIPXVFZSA-N 397.478 5.133 30 20 GKED N#C[C@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nc2ccccc2o1 760966866 DGHUMDNMVPNPJE-MRXNPFEDSA-N 377.831 5.093 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3nc(C)sc3c2)cc1 763944015 LUIDKOZFQDRBBU-FZKQIMNGSA-N 391.496 5.079 30 20 GKED COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 766258462 DIGVHXQGDPTECK-LJQANCHMSA-N 390.508 5.281 30 20 GKED C#CCCCCCC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 766564609 PVPRWCJXEJQYOL-UHFFFAOYSA-N 382.891 5.423 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccccc2CN2CCc3ccccc32)cc1 770528389 JFCXZCHEYJGPRP-LJQANCHMSA-N 383.495 5.152 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 772417503 LTLQIIGJAPLKFY-SFTDATJTSA-N 379.529 5.091 30 20 GKED N#CCc1ccccc1CC(=O)O[C@@H]1CCCc2nc(-c3ccccc3)sc21 776954618 SAAXSQWXIVITST-HXUWFJFHSA-N 388.492 5.039 30 20 GKED COc1cc(/C=C2\CCc3ncc(C(F)(F)F)cc3C2=O)ccc1SC 777468220 PRTPGRARMARKQQ-KPKJPENVSA-N 379.403 5.043 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@@H](O)c2ccc(C#N)cc2)cc1 780966268 YLOYADLTFAVBPR-AOMKIAJQSA-N 388.492 5.084 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCO1 781616552 KDHFMLHREBLKKU-LEOXJPRUSA-N 376.500 5.122 30 20 GKED C=CC[C@H](NC(=O)c1cccc2cccc(Br)c12)c1ccncc1 796480946 BIFXPUNQVJCHME-SFHVURJKSA-N 381.273 5.045 30 20 GKED COc1ccc(C(=O)CCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797567095 YNVHBWHPVYCVCK-KRWDZBQOSA-N 398.528 5.069 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1sc(-c2ccccc2)nc1C 814689813 HFONWFXXOCJIIP-UHFFFAOYSA-N 385.876 5.306 30 20 GKED Cc1cccc(NN=Cc2cc(Br)ccc2OCc2ccccn2)c1 818199622 PJUKIMOBMVXVEU-UHFFFAOYSA-N 396.288 5.178 30 20 GKED Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)O[C@H]1CC[C@@](C)(C#N)CC1 836154164 OHKLZQMACOPYBW-GLRZTSSQSA-N 391.393 5.033 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@]3(CCSC3)C2)cc1 836274296 SUASYBSDGDZUJT-GGAORHGYSA-N 391.540 5.093 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](CCCCC#N)NC(=O)OC(C)(C)C 846765426 PPCRZOCRJHJFKZ-SFHVURJKSA-N 387.524 5.034 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=S)Nc3ccccc3C#N)cc2)cs1 915997747 FWGCCAJSPXMFNK-CYBMUJFWSA-N 378.526 5.038 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 916975974 HLKLYZDXWLFGDT-KRWDZBQOSA-N 380.900 5.618 30 20 GKED CC(=NNc1ccc(F)cc1C(F)(F)F)c1sc2ccccc2c1C(=O)O 1776110813 VFCMCGYFQLBFGT-UHFFFAOYSA-N 396.365 5.594 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(C(=O)O)nc2)c2c(c1)C(C)(C)CC2 1776269235 NUVRNBKFZWJGBT-CLFYSBASSA-N 377.484 5.197 30 20 GKED CC(C)c1cccc2c1OCC/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1776378161 VVGJKKHXVYSJJM-GXDHUFHOSA-N 392.476 5.772 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]([C@@]23CC[C@@H](C2)[C@@H]3C(=O)O)C1 1776786819 PULFDPIZXDKJRG-BCYLSMINSA-N 377.569 5.113 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1OC1CCCCC1 1776786945 CHPKXMGNJBVAHY-FQEVSTJZSA-N 375.553 5.692 30 20 GKED O=C(O)c1cc(Br)cc(/C=C2\CCc3c(Cl)cccc3C2=O)c1 1777663534 GNJJZSCXSFNTEC-IZZDOVSWSA-N 391.648 5.013 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(NC(=O)c3cccs3)cc2)cc1 25438667 IHNKCFFBMKCDIF-UHFFFAOYSA-N 389.480 5.054 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(-n2cccc2)cc1 49723806 AEZMCALKQFTIQJ-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2COc2ccccc2)c1 55568212 MSFZJRUVSBGTTO-UHFFFAOYSA-N 386.451 5.200 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCC(=O)c1ccccc1 56469698 MOVOCMSYYPHBHQ-UHFFFAOYSA-N 384.435 5.261 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1ccccc1Cl 60036218 XSXOBRCCGTYRGF-HNNXBMFYSA-N 391.858 5.443 30 20 GKED COc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c(F)c1 60924666 NOHAFIRLCGESGG-LBPRGKRZSA-N 386.492 5.171 30 20 GKED Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c2[nH]ncc12 63713989 VUOOWCIQNUVZOU-UHFFFAOYSA-N 384.464 5.147 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4ccccc4c3)n2)cc1 66545431 WXFAXRYZQNRPBA-FQEVSTJZSA-N 379.444 5.325 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 92358784 KCQRIINSXJUUBX-INIZCTEOSA-N 386.414 5.279 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(OCCCC#N)c2)c1Br 120655266 YHXJFBQSFXIILY-UHFFFAOYSA-N 388.265 5.084 30 20 GKED N#CCCn1cc(CNc2cccc(CCC(F)(F)F)c2)c(-c2ccccc2)n1 151043284 YGPHORLBVJNPEH-UHFFFAOYSA-N 398.432 5.571 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccccc2Cl)CC1 151835505 LHWNMCUVLLHLCK-UHFFFAOYSA-N 382.872 5.164 30 20 GKED C=CCN(C(=O)C[C@H](C)c1c(C)noc1C)c1nc(-c2ccccc2)cs1 156180467 WPBRLVGBHJVEHN-AWEZNQCLSA-N 381.501 5.128 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)Nc1cc(C#N)ccc1C 159032502 WNYZRSNTIWAIHW-UHFFFAOYSA-N 391.496 5.171 30 20 GKED COc1cccc(F)c1[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 173122801 JTUFJLPQXNHWOT-KGLIPLIRSA-N 387.480 5.111 30 20 GKED Cc1cnc(C(C)(C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 177084217 ZRRGLVFLFRQGLI-UHFFFAOYSA-N 392.484 5.172 30 20 GKED Cc1nc(Cc2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 177773174 WBVFVKAMUUUBHD-HNNXBMFYSA-N 399.516 5.251 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1)C1CCCCC1 182633729 RUJHJGWFWIUQHQ-UHFFFAOYSA-N 387.527 5.259 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](Oc2cccc(F)c2)C1 191435492 HAWVAJNMPQFQBS-FQEVSTJZSA-N 382.479 5.363 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c1 194189980 ZEBCHKCOHOILFP-HNNXBMFYSA-N 391.323 5.291 30 20 GKED O=C1CC[C@@H](C(O)=Nc2ccc3c(c2)OC2(CCCCC2)O3)c2ccccc21 328806286 LCVOWCHOHDRGIR-GOSISDBHSA-N 377.440 5.467 30 20 GKED CN1CCC(O)=Nc2cc(/C(O)=N/[C@H]3CCCc4sc(Cl)cc43)ccc21 329233511 LZJPZWJMPKWOOG-ZDUSSCGKSA-N 389.908 5.212 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@@H](C)C3)s1 411007470 GLYTUEDPRVRFOD-IJLUTSLNSA-N 389.546 5.112 30 20 GKED CCCOc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1OCCC 429879059 WPTUURHAJUHVBM-UHFFFAOYSA-N 384.501 5.132 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 431777994 FVBIQRKNDCJKNM-CRAIPNDOSA-N 387.430 5.083 30 20 GKED Cc1cccc([C@@H](C)SCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 437457270 ZZZXTFRWRKEOGG-DLBZAZTESA-N 384.570 5.822 30 20 GKED CC[C@@H](NCc1cccc(C(=O)NCc2ccc(C)cc2)c1)c1ccc(C#N)cc1 447552614 UHXMEPMRKQVDCY-RUZDIDTESA-N 397.522 5.038 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)o1 458798845 ISIIGYGDWGIFMP-YYWHXJBOSA-N 379.504 5.506 30 20 GKED CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458831179 GQMZOFRLFXXMJF-YADHBBJMSA-N 381.495 5.599 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OCc2ccccn2)cc1 460806861 XQUDAONIBCAYFG-UHFFFAOYSA-N 398.915 5.204 30 20 GKED N#C[C@H](C(=O)c1cc(Oc2ccccc2)ccn1)c1nc(-c2ccccc2)cs1 466975560 DLDJGSKEJCPPKZ-LJQANCHMSA-N 397.459 5.487 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](c2c(F)cccc2F)C1 469798422 FCBOUGXBCALXLX-KRWDZBQOSA-N 388.417 5.133 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ncc(-c4cccc(F)c4)o3)c2)c1 475164842 UBFFEPBLVZLXLF-UHFFFAOYSA-N 399.425 5.543 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 475256699 WXMSMAWGHLPEGQ-UHFFFAOYSA-N 375.428 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCOc1cccc(OC)c1 475560901 KMEDZLZBQCDFET-UHFFFAOYSA-N 382.504 5.138 30 20 GKED N#C[C@@H](C(=O)c1coc2cc(F)ccc12)c1nc(-c2ccc(Cl)cc2)cs1 483461753 OGAFIQQFEUHDGC-HNNXBMFYSA-N 396.830 5.839 30 20 GKED CC1(C)CN(C(=O)Nc2cc(C(F)(F)F)ccc2F)CC[C@H]1C(F)(F)F 483713115 NPWHQHLLEIXHPC-GFCCVEGCSA-N 386.311 5.287 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 485351565 BLWKBSLGIZKCBV-UHFFFAOYSA-N 397.563 5.303 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 485439824 UKOXZRXHBNAWTO-UHFFFAOYSA-N 385.552 5.580 30 20 GKED Cc1cc(C)c(-c2nnc(SCc3ccccc3C(C)(C)C#N)o2)c(C)c1 488789481 UPRHPOXMEWAGRM-UHFFFAOYSA-N 377.513 5.755 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 489086050 BCGXWTVLJGIPLD-LBPRGKRZSA-N 397.466 5.897 30 20 GKED N#Cc1cccc(C2(NC(=O)Nc3cc(Cl)ccc3C(F)(F)F)CC2)c1 489709701 BZYIFCJQRYXRIX-UHFFFAOYSA-N 379.769 5.041 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1oc2ccccc2c1CSc1ccccc1F 497164797 RRWVCPNYGATSOT-UHFFFAOYSA-N 396.487 5.486 30 20 GKED C=CCN(C(=O)c1sc2cccc(F)c2c1C)c1nc2c(s1)CCCC2 499152186 QWBYAJRJBXOSKD-UHFFFAOYSA-N 386.517 5.517 30 20 GKED CN(CCCC1(C#N)CCOCC1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 499619840 OCAQBEUCAMJFOF-WOJBJXKFSA-N 394.481 5.374 30 20 GKED Cc1c(C(=O)Nc2ccc(Cl)cc2OC(F)F)sc2ccc(C#N)cc12 499918658 HWIDNRDKPRTMGF-UHFFFAOYSA-N 392.814 5.589 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccccc2Oc2ccccc2Cl)c1 500196718 HCGOFVWXAXAJQK-UHFFFAOYSA-N 377.831 5.326 30 20 GKED CCOc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)ccc1C 503433466 KWQOBEXYIRVAIE-SFHVURJKSA-N 392.480 5.016 30 20 GKED C[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(Oc2ccccc2)c(F)c1 503987051 MPXZMUJZGKLIPD-INIZCTEOSA-N 381.451 5.014 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccnc(-c2ccccc2)c1 504151421 ORXLFXWFGIXIRB-GGAORHGYSA-N 382.467 5.052 30 20 GKED COc1ccc(-c2nc(CSc3nc(-c4ccccc4)ccc3C#N)co2)cc1 510190789 OWZSDAMUFWDMJG-UHFFFAOYSA-N 399.475 5.576 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2cccc(CC#N)c2)cc1F 510245809 XUGRAPVKEIOHNZ-UHFFFAOYSA-N 390.414 5.253 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc4ncsc4c3)cc2)cc1 520308756 HRRPZBORLKPCRX-UHFFFAOYSA-N 385.448 5.407 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1 520939019 JOLFQACIIARENQ-MISYRCLQSA-N 393.556 5.929 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)oc2ccc(Cl)cc12 521886444 XIEYWTGWHFXUEB-OAHLLOKOSA-N 392.764 5.408 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(Cl)c(Cl)c1 522986329 ZLTQDEDKZKUNCB-UHFFFAOYSA-N 375.299 5.235 30 20 GKED C=CC1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 523628596 WXQAZWWHVXGCRF-FQEVSTJZSA-N 379.891 5.425 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C1(c2ccccc2)CC1 524422098 YWRGLCVEBLNPFE-UHFFFAOYSA-N 382.463 5.116 30 20 GKED CC[C@@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1S[C@H](C)CC#N 533256242 JHWGTOIUQZHKMJ-NQIIRXRSSA-N 395.572 5.493 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 533362661 ZCMIIVAOSPRDBC-INIZCTEOSA-N 385.508 5.073 30 20 GKED COc1cc([C@@H](C)NC2CCC(Oc3ccccc3C#N)CC2)ccc1SC 539077318 AHTAZVYODPDPEC-PBPGXSGUSA-N 396.556 5.330 30 20 GKED N#CCCCNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 543157773 YKLNTIZMSIJVJN-UHFFFAOYSA-N 384.888 5.412 30 20 GKED Cc1ccccc1C1=CCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 543883477 NYOOKRBLVCHOQO-INIZCTEOSA-N 377.513 5.178 30 20 GKED COc1cc(C#N)ccc1CN[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 544471655 XXYPXYHQWNFQLG-CYBMUJFWSA-N 397.931 5.503 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCc2c(F)cc(Br)cc21)c1ccccc1 550827140 KTXPTZDZNTUQBF-WOJBJXKFSA-N 387.296 5.600 30 20 GKED CC1CCN(CCC[C@@H](NCc2cccc(C#N)c2)c2ccc(F)cc2)CC1 551271003 IVZINAKVTANAGJ-XMMPIXPASA-N 379.523 5.040 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc3cccc(Br)c23)n1 552076317 HAHPXUGLKJCJKV-AWEZNQCLSA-N 399.313 5.672 30 20 GKED Cc1cccc2c(CCC(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c[nH]c12 562213055 BVBIMQBFKJMIEI-CYBMUJFWSA-N 377.513 5.106 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)N(CCC#N)c2ccc(F)cc2)cc1 566554161 NSEMHKLWMOLKLO-UHFFFAOYSA-N 380.463 5.070 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3sccc3-c3ccccc3)cc2)ccn1 582248521 LKAKVJRTBJYLBO-UHFFFAOYSA-N 397.459 5.726 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2csc(Br)c2)c1 589740245 OGWWFJBHBJIWPP-UHFFFAOYSA-N 395.322 5.129 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N3Cc4cccc(C#N)c4C3)c2)C1 593150320 CDXJKGWOYCIIBE-VGSWGCGISA-N 389.499 5.201 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccc(Oc2ccccc2)c(F)c1 595456084 VPTXPUIXXHYFFM-SJORKVTESA-N 381.451 5.014 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1F)CC1CC1 596735017 KKHKTSFCYHNVPV-MRXNPFEDSA-N 397.519 5.664 30 20 GKED CC[C@H](C)Cc1c(C)sc2nc(S[C@H](C#N)Cc3ccccc3)nc(O)c12 598795117 FZIUARJITAAZNN-BBRMVZONSA-N 397.569 5.521 30 20 GKED C=CCN(C(=O)CCc1cc(Cl)cs1)c1nc(-c2ccccc2)cs1 605614385 DJRWPCKBLQGOBU-UHFFFAOYSA-N 388.945 5.677 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(F)ccc1N1CCCCC1 608916521 JDUFMLJCFSUJFQ-UHFFFAOYSA-N 394.494 5.130 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609428462 PTLXXPMFTSUNFR-KRWDZBQOSA-N 382.529 5.530 30 20 GKED CCN(CCNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1C 609437126 QWHIIQAPIRBSNY-GOSISDBHSA-N 396.560 5.037 30 20 GKED CN(C[C@H]1CCCO[C@H]1c1ccccc1)c1c(C#N)cnc2ccc(Cl)cc12 610274734 APCMFJWAXDWUCR-HXOBKFHXSA-N 391.902 5.364 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 610355981 GJZYHAKBPVPQKA-UONOGXRCSA-N 375.394 5.041 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)C(=O)Nc1ccccc1Br 611103433 UJBAQZHSMBNUPR-JTQLQIEISA-N 395.709 5.093 30 20 GKED C[C@H](NCc1ccccc1CN[C@H](C)c1cccc(C#N)c1)c1cccc(C#N)c1 611387318 KIKJFMFLOYZGTB-BGYRXZFFSA-N 394.522 5.132 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c1C 637024073 PETFTDJJRGYNEP-CQSZACIVSA-N 397.544 5.171 30 20 GKED C=CCN(C(=O)[C@H](C)Oc1ccc(C)cc1)c1nc(-c2ccccc2)cs1 641900253 AYZIDICYELMZTB-KRWDZBQOSA-N 378.497 5.105 30 20 GKED FC(F)Oc1ccc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc1 678310676 KXNNDZMSJDDYEP-BRPSZJMVSA-N 378.263 5.004 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(O)c(F)c1 728425476 HPKZIEMHWNUXHK-UHFFFAOYSA-N 396.422 5.178 30 20 GKED COc1ccc2oc(C(C)=NNc3ncnc4c3oc3ccccc34)c(C)c2c1 729143817 SIFWMQNFLQRGFI-UHFFFAOYSA-N 386.411 5.275 30 20 GKED CCc1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)s1 731150294 ASNFFAOFUUALIQ-UHFFFAOYSA-N 383.329 5.047 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C\c1csc(-c3cccc([N+](=O)[O-])c3)n1)CCO2 733083657 OHLHTBFIBNWYIE-UVTDQMKNSA-N 392.436 5.076 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(Cl)cc3)s2)c1 733800718 GBYUAHQXLPEOFU-IBGZPJMESA-N 396.943 6.039 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)c2cccc3ccccc23)c1 733845549 DLEHTLJDNBURLK-YLJYHZDGSA-N 387.483 5.081 30 20 GKED Cc1ncsc1COC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 735210190 AVIRBKIBTDVZRZ-UHFFFAOYSA-N 384.844 5.126 30 20 GKED COc1c(Cl)cc(Cl)cc1/C=C\C(=O)c1c(Cl)nc2sccn12 741842750 BPFSHDIVQILVDU-IHWYPQMZSA-N 387.675 5.261 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]cc2-c2ccc(F)cc2)cc1 742046804 DJZZMTWPTKTBRA-JOCHJYFZSA-N 395.437 5.729 30 20 GKED Cc1cccc2c(N3CCC([C@H](O)c4ccc(Cl)cc4)CC3)c(C#N)cnc12 742405693 AHHONNJMNBTAKT-HSZRJFAPSA-N 391.902 5.018 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744036921 KARZFBFBDRHGBQ-YJBOKZPZSA-N 378.472 5.394 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1)c1cccc(C(F)(F)F)c1 744159471 CTWWADYSFQALMS-LRFDDAOPSA-N 383.373 5.170 30 20 GKED CC(C)c1ccc(C2(O)CCC(=NNc3ncnc4ccsc34)CC2)cc1 753929475 PVLVIXMQIOJNAX-UHFFFAOYSA-N 380.517 5.044 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1cccc(OCCCC#N)c1 754079834 NEKRBKMOYMVBCK-UHFFFAOYSA-N 395.503 5.637 30 20 GKED CC(C)c1ccc(C[C@@H]2CCN(C(=O)Nc3ccccc3O[C@H](C)C#N)C2)cc1 764694904 SKTRKZRAIRDIAF-QUCCMNQESA-N 391.515 5.197 30 20 GKED C#CCCN(CC(F)(F)F)C(=O)Nc1cc2oc3ccccc3c2cc1OC 767221914 USAPOSGQRIHADQ-UHFFFAOYSA-N 390.361 5.014 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)O[C@H](C)c1nc2ccccc2n1C(F)F 767738072 DMZSSEZKODXYFY-CZUORRHYSA-N 381.423 5.007 30 20 GKED CCOc1c(Cl)cc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1Cl 768086844 RDDPUVDDXHLFKL-NSHDSACASA-N 394.258 5.327 30 20 GKED Cc1cncc(/C=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 772062305 UOAPBNGQLYFMTF-UKSYNSBOSA-N 387.870 5.351 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc2ccccc2c1OC(F)F 772959385 LJGOWKFTTZQJQJ-HNNXBMFYSA-N 382.410 5.194 30 20 GKED C[C@H](N[C@@H](COCc1ccccc1)c1ccccc1)c1ccc(OCC#N)cc1 776163988 TXMUVZUSHFGVHV-CPJSRVTESA-N 386.495 5.198 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1 780677784 IXQPGEQRHZBHSE-HNNXBMFYSA-N 399.441 5.232 30 20 GKED N#CCC1CCN(C(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)CC1 782054388 AWOJOZLUJHMROR-RCCKNPSSSA-N 382.866 5.172 30 20 GKED CCc1cnc(/C=C2\CCc3nc(-c4ccc(OC)cc4)sc3C2=O)s1 783706876 LPDKJFYABPQCBE-JLHYYAGUSA-N 382.510 5.050 30 20 GKED C=CCCCCCSc1nnc([C@H]2CCCN(C(=O)OC(C)(C)C)C2)o1 795259990 VXQLJYWOYYKWRK-HNNXBMFYSA-N 381.542 5.023 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](c3cccnc3)C(C)C)n2)cc1 797943983 ZEHXDFOIAQRKEA-UYAOXDASSA-N 375.497 5.130 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(Cl)c(SC(=O)N(C)C)c1)c1ccccc1 805441994 WDWYVEFPZNGCTH-MRXNPFEDSA-N 388.920 5.412 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)[C@H](C#N)c1nc(-c3ccccc3)cs1)CCC2 847625094 BXJNTCWFILNWHN-ICSRJNTNSA-N 388.492 5.115 30 20 GKED C[C@H](CC(C)(C)C#N)OC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 851214352 PSMCBCBNHNVCGU-GFCCVEGCSA-N 390.892 5.139 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2ccc(F)cc2)cc1 915085377 AZXGRTBZLULBOZ-NRFANRHFSA-N 376.456 5.212 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2ccccc2n1 915087574 VLNXUMNUAPZSPF-QHCPKHFHSA-N 377.447 5.451 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1sc(C(C)(C)C)nc1C 915112283 YVIYNERRWGSXKG-UHFFFAOYSA-N 379.489 5.275 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cc2cnn(C(C)C)c2nc1Cl 915115074 VRIKSCVPXZPUAS-CMDGGOBGSA-N 378.863 5.351 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCOCc2ccccc2)cc1 915352871 KHQUAKJGPRONCL-XMMPIXPASA-N 399.494 5.070 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccccc2C(F)(F)F)S1 915848574 ZSLUDGBCYPHEHI-XNTDXEJSSA-N 376.403 5.214 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)CC(c2ccccc2)c2ccccc2)cc1 916908892 GDYVMRYTRNDIGA-DEOSSOPVSA-N 396.490 5.119 30 20 GKED CCc1nc2ccccc2n1N=Cc1csc(COc2ccc(Cl)cc2)n1 918710827 GHNSYJAFWIQXTN-UHFFFAOYSA-N 396.903 5.170 30 20 GKED C[C@@H](NN=Cc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 920385967 MEPCPKGEWJNUSZ-MRXNPFEDSA-N 377.875 5.277 30 20 GKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920806984 VEQPRKFVNSCGDB-JKSUJKDBSA-N 396.462 5.848 30 20 GKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1ccc(C(=O)O)c(F)c1 1776014595 NREKWFBYHBKZER-UHFFFAOYSA-N 375.614 5.320 30 20 GKED O=C(O)c1cc(NN=C2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)ccc1F 1776062319 ODZIOWOEIWKUSH-HNNXBMFYSA-N 394.368 5.668 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)c(F)c1 1776127974 KVDCBLYQEIXRPT-GHXNOFRVSA-N 390.410 5.025 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(CC2CCC2)cc1 1776354294 BIBROHFFURXPLF-ZRDIBKRKSA-N 378.468 5.411 30 20 GKED CC(/C=C\C(=O)c1ccc(OCCCC(=O)O)cc1)=C/c1cc(F)cc(F)c1 1776398801 IDDGJOGJYKSXCP-IRKYWFSESA-N 386.394 5.051 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(Cc3ccccc3)cc2)c1)C(=O)O 1776471127 BEQVBYMEPSCOKS-KGUUONHRSA-N 386.447 5.025 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c2ccccc12 1777360743 HLTJTXHZRCSNIQ-ZRDIBKRKSA-N 398.414 5.703 30 20 GKED O=C(O)c1ccc(Br)c(/C=C2\CCc3ccc(Cl)cc3C2=O)c1 1777672895 JKVGGPJVFMVKBE-YRNVUSSQSA-N 391.648 5.013 30 20 GKED CCCCn1c(S[C@H](C)C#N)nc2scc(-c3ccc(F)cc3)c2c1=O 9357249 TZEBXDRFNARIMB-GFCCVEGCSA-N 387.505 5.068 30 20 GKED C[C@@H](Sc1ccc(Cl)c(C(F)(F)F)c1)C(=O)Nc1ccccc1C#N 9790852 MYEMQTGXKVIQDB-SNVBAGLBSA-N 384.810 5.350 30 20 GKED C=CCN(C(=O)CSc1cccc(OC)c1)c1nc(-c2ccccc2)cs1 27661663 QFTQPPHSDUYACL-UHFFFAOYSA-N 396.537 5.130 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(Cl)cc2)cc1 55823577 AMECORPXBKVSLQ-UHFFFAOYSA-N 376.843 5.237 30 20 GKED O=C(/C=C/c1ccc(SC(F)(F)F)cc1)c1cccc(N2CCOC2=O)c1 60203547 YOZNSRACAXXDFR-RMKNXTFCSA-N 393.386 5.151 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1ccc(C#N)cc1 64564734 VBLTYQKBZIEYRC-AWEZNQCLSA-N 392.846 5.282 30 20 GKED C[C@H](S[C@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccccc1C#N 65280279 CEYFIVLXNVYUJX-OLZOCXBDSA-N 394.418 5.278 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1 120759351 RGDNLWOMCAQUPU-LJQANCHMSA-N 382.895 5.107 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1coc(-c2ccccc2)n1 120813108 XRUPKVLSJRHTTE-UHFFFAOYSA-N 385.448 5.123 30 20 GKED Cc1noc(-c2ccccc2)c1NC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 123869287 AJNXGFDUBAMJOU-UHFFFAOYSA-N 396.450 5.182 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 132105902 SCDNRPNQUBLAOG-RDTXWAMCSA-N 375.394 5.111 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 134762108 GUDVLLIZEDABHH-UHFFFAOYSA-N 378.844 5.069 30 20 GKED CC[C@@H](C)OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 152409950 DWZCDBWFICKDBX-ZWNOBZJWSA-N 383.300 5.108 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(F)c(Cl)c1 152710284 XFHODMBSGKAGOQ-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)o1 176337904 JIDJYHNLZALUHD-HNNXBMFYSA-N 378.453 5.576 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)c2c1 176463570 VOAZFBZMAXUUEK-GOSISDBHSA-N 381.435 5.360 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C 179315148 CNUQSYPVVWJEQG-CQSZACIVSA-N 386.521 5.070 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 179634636 BROSCYGIGQPPOF-XRHLQHRESA-N 384.545 5.002 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)ccc1OC 237290955 KJWKSMBACUBPSM-IBGZPJMESA-N 388.511 5.563 30 20 GKED N#C[C@H](C(=O)c1cccc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 301764728 RLOLBKGNKGRUFA-LJQANCHMSA-N 388.879 6.107 30 20 GKED O/C(=N/Cc1nc2ccccc2s1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329415799 CXUYSISKTARCGB-INIZCTEOSA-N 394.544 5.260 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)c1c[nH]c2ccccc12 426333386 UJIQYMMMICSFML-HZPDHXFCSA-N 377.513 5.694 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)s1 430624625 JJLCGGYEERSUKR-LBPRGKRZSA-N 385.470 5.054 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC(C3CCCC3)C2)cc1F 432203222 MMYFITCNRYWWQC-UHFFFAOYSA-N 379.435 5.144 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 437832475 GNPUOJYOEPAWJQ-MRXNPFEDSA-N 383.517 5.346 30 20 GKED COc1cccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 442209297 OGRPPPOYNFBSOG-INIZCTEOSA-N 397.544 5.189 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)c1cn(CCCC#N)c2ccccc12 443886371 SQLNTWWXUQRXOX-UHFFFAOYSA-N 381.479 5.370 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Oc3ccncc3)cc2)c2ccccc21 444136679 CLYDIXZKYFBOKR-UHFFFAOYSA-N 396.450 5.385 30 20 GKED CC[C@@H](N[C@H](c1ccc(OC)cc1)c1ccccc1OC)c1ccc(C#N)cc1 447573757 JCNCGVQYTVYZGW-ILBGXUMGSA-N 386.495 5.406 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F 454743954 DVAMWKWWJXKELM-KKUMJFAQSA-N 399.482 5.571 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(C3CC3)nc3ccc(F)cc23)c1 463293203 FMDVWBCNZNAJPU-UHFFFAOYSA-N 389.430 5.186 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 464161811 WHYFCOUXSZAKMU-HSZRJFAPSA-N 376.456 5.070 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464469952 UPZXMMFWKBGUKO-ZDUSSCGKSA-N 379.407 5.013 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C 466121370 HSSYWFKVFSWEAF-URZJWIJPSA-N 395.934 5.529 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 466394934 GEBMJSPUPOYRNJ-HNNXBMFYSA-N 385.335 5.039 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H]1CCOc2ccc(OC)cc21 466424473 FMVXIBWTBIBNQY-XMSQKQJNSA-N 379.500 5.150 30 20 GKED COc1ccccc1-c1nc2sc3c(c2c(-c2cccnc2)c1C#N)CCC3 469145425 ZTQWRSUYVBWMHS-UHFFFAOYSA-N 383.476 5.394 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2OCCc2ccccc2)cc1 474891883 PGRXBNRHOJBKQH-UHFFFAOYSA-N 384.479 5.362 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1 475111569 OTCFJCPUIRMLRP-OXJNMPFZSA-N 389.524 5.383 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@H]1c1ccncc1 476241679 KIQFAJDAGQLPSU-QHCPKHFHSA-N 397.478 5.163 30 20 GKED CCCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1ccccc1C 477127886 NUBWBYKRRWZZPJ-UHFFFAOYSA-N 386.499 5.187 30 20 GKED Cc1ccc(-c2nc(NC(=O)CSc3ccc(C#N)cc3)sc2C)cc1 482334982 RALDLXTWVROVLR-UHFFFAOYSA-N 379.510 5.029 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc4ccccc4c3C)n2)cc1 484555164 HJUPZPNGGHPEKG-SFHVURJKSA-N 383.476 5.465 30 20 GKED N#CCCN(C(=O)c1nc(-c2ccccc2)cs1)C12CC3CC(CC(C3)C1)C2 486560627 VMJYGWKKAFMHQM-UHFFFAOYSA-N 391.540 5.135 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 487328399 VBVXFBYWBLZHCS-QFIPXVFZSA-N 378.516 5.439 30 20 GKED N#CCCC[C@H](NC(=O)CC1(CSc2ccccc2)CC1)c1ccccc1 487510155 ATDYMVLFHAFPLW-NRFANRHFSA-N 378.541 5.500 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc(F)cc1OCC(F)(F)F 494778151 FTDYVCVAFRFHSE-SECBINFHSA-N 390.299 5.009 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N[C@H](c2cccs2)C2CC2)c1 504007425 VOTYQGVJGIGIPQ-QFIPXVFZSA-N 388.492 5.080 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)[C@@H]3CC[C@@H](C(F)(F)F)C3)c2)c1 506443677 HBWOWNCOWMAGFS-IAGOWNOFSA-N 388.389 5.054 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1nc2ccccc2o1 507008533 SKQXBGNIBBVEQI-SFHVURJKSA-N 388.810 5.764 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CC1 507827124 QVZRELJHBIKWCJ-UHFFFAOYSA-N 384.932 5.398 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(-c2ccccc2)no1 510172236 INCOFFKYEYZJSY-HNNXBMFYSA-N 384.464 5.524 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 517783016 QIYIQCJHDLEORN-UHFFFAOYSA-N 377.532 6.248 30 20 GKED N#Cc1ccc(NC(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 517866970 JALMWPFBUDSDMJ-SFHVURJKSA-N 392.459 5.020 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1C(F)(F)F 518756008 VJANWJZQDQGKGV-CYBMUJFWSA-N 393.434 5.421 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 521800154 HISMFFRDGAGPEI-HNNXBMFYSA-N 388.558 5.179 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@@H](C)O1 522088415 XGTPFLFQIPNROZ-RHSMWYFYSA-N 399.878 5.035 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 524200450 PMWJJNTUASMJBX-SFHVURJKSA-N 375.394 5.290 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cncc2ccccc12 524388287 VDEUFKDIYUZXRV-UHFFFAOYSA-N 393.446 5.246 30 20 GKED N#Cc1c(NC(=O)c2cnc3ccc(F)cc3c2)sc2c1-c1ccccc1CC2 534000670 SEPNMQVYXQRMBT-UHFFFAOYSA-N 399.450 5.325 30 20 GKED CCOc1ccc(F)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1F 535485807 DXRLTNYZGWWRET-UHFFFAOYSA-N 394.377 5.280 30 20 GKED N#CC1(c2ccc(C(=O)N[C@@H](c3ccc(Cl)cc3)c3cccs3)cc2)CC1 539636056 HDAIFADACUCFLW-FQEVSTJZSA-N 392.911 5.476 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)n([C@@H](C)C4CC4)n3)n2)cc1 540778150 DILYOOVECYUEIZ-MAUKXSAKSA-N 390.512 5.085 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(-c2nc(C3CC3)no2)cc1C 541490145 FBGOZZYRQACGDN-UHFFFAOYSA-N 394.500 5.204 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)C2CC2)cc1 542379566 ZDEUYDQDUJNFQL-UHFFFAOYSA-N 393.796 5.427 30 20 GKED N#Cc1cc(C(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)ccc1Cl 543457659 QVNJLTBYYYDQCG-UHFFFAOYSA-N 390.792 5.160 30 20 GKED N#CCCC[C@H](N[C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 556205769 MQUSHLLVLYNHCL-HJNYFJLDSA-N 377.488 5.331 30 20 GKED CC(C)c1ccccc1OC[C@@H](O)CNc1ccccc1S[C@@H](C)CC#N 563881593 DJDXVNVFDGBYFI-ROUUACIJSA-N 384.545 5.056 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1)C(F)(F)F 573403628 VOBXKKMMUCAPKG-ZBFHGGJFSA-N 391.393 5.183 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NC[C@@H](OCC2CC2)c2ccc(Cl)cc2)cc1 573512363 NZZNZNYOZWMDJV-OAQYLSRUSA-N 396.918 5.039 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2cncc(C(F)(F)F)c2)n1 577145181 RWPRMRHLGPHZEP-LBPRGKRZSA-N 391.246 5.228 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C[C@@H](C)C1(F)F 599738444 WCNFGDNAKVPDTG-HUUCEWRRSA-N 385.414 5.106 30 20 GKED C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1)c1cccc(C#N)c1 600847937 ZXDIHDIRPPLYJL-CLOONOSVSA-N 395.506 5.709 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cscc1Br)c1ccccc1 603013309 AINJZDMABATRMO-AWEZNQCLSA-N 378.295 5.067 30 20 GKED C[C@H](c1ccccc1)n1c(SCc2ccc(C#N)cc2)nnc1-c1ccccc1 603917492 WFVWCNQQHSOJEY-GOSISDBHSA-N 396.519 5.718 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2Cl)cc1 604026996 SEJYVGAIPMZDHJ-UHFFFAOYSA-N 393.786 5.164 30 20 GKED COc1ccc(CSc2nnc(S[C@H](C#N)Cc3ccccc3)s2)cc1 604041556 HHIXSOLWXXRNTO-KRWDZBQOSA-N 399.566 5.066 30 20 GKED C=CCCCCCN(C)C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 606813774 BXVGMYLHKOKPJF-UHFFFAOYSA-N 396.478 5.576 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1 608915545 SDINUOXWFULQCD-UHFFFAOYSA-N 385.467 5.793 30 20 GKED Cc1ccccc1-c1nc(C(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cs1 608936089 PXCHYNQQKZCZRX-UHFFFAOYSA-N 389.524 5.289 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1cc2ccccc2n1CC#N 609162664 QOAYUWPIRPOCJY-CYBMUJFWSA-N 386.282 5.305 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609682698 QODYHSDAQDPVCQ-WIYYLYMNSA-N 397.478 5.760 30 20 GKED N#C[C@@H](C(=O)c1cc2ccc(F)cc2s1)c1nc2ccccc2n1C(F)F 613401533 CJHGEXKRTNMMDD-LBPRGKRZSA-N 385.370 5.275 30 20 GKED FC(F)(F)c1ccccc1CN1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618448788 BQVGNEDTZYBRKO-GHMZBOCLSA-N 379.266 5.268 30 20 GKED Cc1cc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c(F)cc1F 619124660 FAYHTDHSKXVAPV-UHFFFAOYSA-N 377.275 5.057 30 20 GKED CC(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 620304359 VQIRFHDGGYKNLF-OAHLLOKOSA-N 398.434 5.366 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3nc4ccccc4s3)cs2)c1 726427858 ZSPQYECVNKIPGP-MDZDMXLPSA-N 378.478 5.325 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)c1 726463197 RFAMPJOKQITYIO-UHFFFAOYSA-N 395.503 5.135 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420221 BRCPQMBKYPARQH-MRXNPFEDSA-N 382.460 5.123 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 733620527 ALYQBRNBPOTBCQ-XMMPIXPASA-N 399.494 5.911 30 20 GKED CC(C)C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 741111280 JIIJDLSLENRWKO-IAGOWNOFSA-N 382.916 5.956 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@@H](C)c3ccccc3C(F)(F)F)[nH]c12 744161927 WZDRHSHCYBCBFN-HIFRSBDPSA-N 385.389 5.260 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccccc2)C2CCOCC2)cc1 766023765 XURWENMULGUEGK-MBSDFSHPSA-N 385.935 5.636 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)C1 766619255 SMZVZAZDDRYOSN-HMXCVIKNSA-N 378.516 5.567 30 20 GKED Cc1cc(C(=O)Nc2sc(C)c(C)c2C#N)ccc1NC(=O)OC(C)(C)C 772019836 GRCQTQXWOQXWIU-UHFFFAOYSA-N 385.489 5.144 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCc2c(Cl)cccc21)c1nc(-c2ccccc2)cs1 776081563 PDXKRIDWFCLURL-IRXDYDNUSA-N 378.884 5.370 30 20 GKED C=CCn1c(SCc2nc(Cl)ccc2Cl)nnc1-c1ccccc1 785008873 ORBOFEOMECCPDJ-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CCCCCCC[C@H](C)CNC(=O)Nc1cccc(NC(=O)N(C)C)c1C 791915067 SPQMBKIGKIZLCN-INIZCTEOSA-N 376.545 5.207 30 20 GKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C/C(=O)c1ccc(C(=O)N(C)C)cc1 792924502 DAWIMWIKEDHXCC-HMHGSNSKSA-N 387.401 5.250 30 20 GKED O=C(O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@H]1CCC(F)(F)C1 796745757 RFYUUXMYRBLNCT-KWQFWETISA-N 376.243 5.287 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 797613063 BFXNUPPJIALIDH-IFMALSPDSA-N 375.516 5.632 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccc(F)cc1 812922176 CEAMYXZEWLJBQH-QFIPXVFZSA-N 388.442 5.039 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)c2cccc(Br)c2)n1 813072083 HYJWYKSOKKEIMK-BXUZGUMPSA-N 377.307 5.009 30 20 GKED CCSc1cccc(Br)c1NC(=O)/C=C/c1ccccc1C#N 813285743 RNKVRJVPXJERIX-ZHACJKMWSA-N 387.302 5.085 30 20 GKED Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CN[C@H]1CC[C@@H](CC#N)C1 824683401 HZQFWCJSZDGFEE-ZFWWWQNUSA-N 396.844 5.025 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C4CCC(C)(C#N)CC4)c23)cc1 834931613 NCLMYQFAKIVNAU-UHFFFAOYSA-N 391.500 5.239 30 20 GKED CC[C@@H](CC(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790885 LJOFTNCVRZEXKQ-WPRPVWTQSA-N 376.350 5.173 30 20 GKED O=C(N[C@H](c1ccccc1)C(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 857441579 QWZFFGFXEFKHKB-UONOGXRCSA-N 379.275 5.136 30 20 GKED CC1(C)CCc2cccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)c2O1 863046381 FDCUENROGXNCPI-UHFFFAOYSA-N 375.255 5.221 30 20 GKED COc1ccc(Cl)cc1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915087409 UDQAXJQQCWBQOO-OAQYLSRUSA-N 390.870 5.185 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccccc3OC(F)F)cs2)c1 916140351 NZRCCBFMSFVVOL-MDZDMXLPSA-N 387.407 5.316 30 20 GKED N#CCOc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1 918197889 OKVJWPPFZFBJSB-QHCPKHFHSA-N 376.887 5.316 30 20 GKED C[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccnc(O)c1 926630639 GTRXPQVIYLDCMO-VIFPVBQESA-N 382.279 5.250 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1ccccc1Oc1cccc(Cl)c1 1776037499 LGWIDJBKYORTOH-UHFFFAOYSA-N 380.831 5.667 30 20 GKED C[C@@H]1/C(=C\c2ccc3oc(C(=O)O)cc3c2)C(=O)c2cccc(Br)c21 1776586943 DQMSMMSJNGLNDI-WWNSAXIVSA-N 397.224 5.277 30 20 GKED CSc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1Cl 1777403489 ZXWCXDSYGYNZTG-WAPJZHGLSA-N 398.867 5.916 30 20 GKED CCC[C@H]1CC[C@H](C(=O)Nc2ccc(C3(NC(=O)CCC#N)CCC3)cc2)CC1 1791366722 FLZOOJZEOZIWON-WGSAOQKQSA-N 395.547 5.031 30 20 GKED Cc1cc(C)c(NC(=S)NCCSCc2ccccc2C#N)c(Cl)c1 15152515 PHYXGSIGUCDXKR-UHFFFAOYSA-N 389.977 5.048 30 20 GKED Cc1ccc(-n2c(SC[C@@H](C#N)CCC#N)nnc2-c2ccccc2)cc1C 15232754 WVSTYGWCWFUONN-GOSISDBHSA-N 387.512 5.087 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nc2ccccc21 22351401 INTBUMPGGVVAGB-HNNXBMFYSA-N 399.947 5.612 30 20 GKED C[C@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 48161356 DIXSIXLRCVPOOL-SFHVURJKSA-N 385.467 5.214 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(-c2ccccc2F)n1 63825906 RXZVQSUJACCARB-UHFFFAOYSA-N 392.908 5.493 30 20 GKED COCc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)o1 123753932 OPXLWMTZKIPVBD-CRAIPNDOSA-N 399.516 5.189 30 20 GKED C=C[C@H](CC(=O)N1CC=C(c2c[nH]c3ccc(OC)cc23)CC1)c1ccccc1 153406927 KSIKAAWWMKAKAZ-GOSISDBHSA-N 386.495 5.152 30 20 GKED N#CCCCOc1cccc(CN2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1 154847000 NUPPNZVYPILGBF-UHFFFAOYSA-N 396.918 5.117 30 20 GKED CCOCc1cc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)ccc1OC 164458784 HCGLWWHKJJURLL-NTUHNPAUSA-N 379.500 5.118 30 20 GKED COc1cccc(F)c1[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 173122807 JTUFJLPQXNHWOT-UONOGXRCSA-N 387.480 5.111 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(F)c1Cl 173455062 NFQUXEZCPIGDAI-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C=CCCC[C@H](C)NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 179772337 RRWQIQWQSGEXMU-ZDUSSCGKSA-N 376.909 5.128 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(N4CCc5sccc5C4)cc3)cc2)CC1 180076046 OUNSPLHRCDVQHL-UHFFFAOYSA-N 399.519 5.118 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C1CCCC1)C(F)(F)F 184010043 PVMHSUNQCZPMBH-MLGOLLRUSA-N 385.455 5.181 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc3ccccc3s2)ccc1OC 188195794 SPDIHPVNGJCUHT-MAUKXSAKSA-N 380.513 5.442 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c1 188499440 KEZXSZNRNUVLMA-UHFFFAOYSA-N 388.389 5.058 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(Br)cc1 214012152 QARKGXPSRLCTDV-WAYWQWQTSA-N 376.300 5.530 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](/C(O)=N/[C@H]3CSc4ccccc43)C2)c1 329659820 OFSJVLIBCYDYBW-LPHOPBHVSA-N 395.528 5.056 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)oc12 425401877 QVMQJRXLKBWICQ-CVEARBPZSA-N 391.471 5.167 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 431864740 KXBOYWAXIJRUIP-UHFFFAOYSA-N 397.356 5.325 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)NCC2(CC#N)CC2)c(C(F)(F)F)c1 432015894 VACBVYRDLCHSGI-GFCCVEGCSA-N 385.455 5.411 30 20 GKED COc1ccc(C)cc1NC(=O)[C@@H](Sc1cccc(C#N)c1)c1ccccc1 435025678 DYNPMNQHHMUJHK-QFIPXVFZSA-N 388.492 5.347 30 20 GKED C=CCC[C@@H](NC(=O)c1sc(NC(=O)c2ccco2)cc1C)c1ccccc1 435278473 GGKNLPGREKJMDI-QGZVFWFLSA-N 394.496 5.339 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 436364959 LVRUBUFEIKIMIN-XQFWAAQXSA-N 394.515 5.238 30 20 GKED Cc1nc(C(C)(C)C)sc1[C@H](C)NC1CCC(Oc2ncccc2C#N)CC1 437098827 SFZHGROPUIFHTB-NNGSBXSVSA-N 398.576 5.057 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 441282933 AJVNKMRFVAHWPA-GFCCVEGCSA-N 387.270 5.108 30 20 GKED N#CC1CCC(CNC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)CC1 442719901 HWMOODZPBMVMKL-RJYAGPCLSA-N 393.453 5.272 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC(c2nc3cccc(C)c3o2)CC1 444539218 AHLVQKYFVZJCOZ-UHFFFAOYSA-N 392.524 5.434 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)Cc1ccc(F)c(Cl)c1 446778561 XILVNGDSXSJZDS-UHFFFAOYSA-N 381.900 5.273 30 20 GKED C=CCC[C@H](NC(=O)NCc1cnc(C2CC2)o1)c1ccc(C(F)(F)F)cc1 454707598 LJDXLNBUBBXZCK-KRWDZBQOSA-N 393.409 5.078 30 20 GKED C[C@@H](C(=O)Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1cccc(C#N)c1 461898908 CCKBPAKHSASZLI-GFCCVEGCSA-N 399.422 5.025 30 20 GKED N#CCCCC(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 461926115 BVOJUTTZCWUJPZ-UHFFFAOYSA-N 376.378 5.150 30 20 GKED CN1CCC[C@@H](CNc2ccc(C#N)cc2C(F)(F)F)[C@H]1c1cccs1 462870150 JJUIELNINPZYRT-KSSFIOAISA-N 379.451 5.134 30 20 GKED CCC1(CC)CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CCS1 467343449 YCUFTUMFCDKIKT-OAHLLOKOSA-N 377.579 5.220 30 20 GKED Cc1ccc(C(=O)CCCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 467512914 KGGJBYPGQDICMA-GOSISDBHSA-N 389.282 5.036 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(-c3ccccc3)ccc2Cl)c1 471443177 KMFKSQTYHUEPBZ-UHFFFAOYSA-N 378.884 5.875 30 20 GKED Cc1csc(Nc2ccc(NC(=O)C[C@H](CC#N)c3ccccc3)cc2)n1 475762206 MCSQOSDJGDQLDC-KRWDZBQOSA-N 376.485 5.221 30 20 GKED COc1cc(C#N)ccc1CNc1ccc(-c2csc(C(F)(F)F)n2)cc1 480143869 HKPNDZXOKBJCSR-UHFFFAOYSA-N 389.402 5.321 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Br)c(F)c1 484765706 GMQUWFBVUSSONH-GFCCVEGCSA-N 379.298 5.595 30 20 GKED C=CCCC[C@@H](C)NC(=O)NCc1cc(-c2c(OC)ccc3ccccc23)no1 487986398 UMYIUDPHOQRDAZ-MRXNPFEDSA-N 393.487 5.047 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccccc1 488678658 VYOFHWKYIPQSDN-QFIPXVFZSA-N 376.500 5.001 30 20 GKED C=CCC[C@H](C(=O)NCc1ccc(OCc2ccccn2)cc1)c1ccccc1 488678866 WDVHAFPEJKVFJQ-DEOSSOPVSA-N 386.495 5.027 30 20 GKED CCNc1ccc(Cl)cc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 490688482 AYZWHPVAGUFYHJ-UHFFFAOYSA-N 392.846 5.083 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)NCC(C)(C)CCC#N)s2)cc1 495109608 PYOCBBDCDNLRNA-MRXNPFEDSA-N 384.549 5.117 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1Br 498971725 BHOQWCHTZRXRHM-ZDUSSCGKSA-N 385.286 5.111 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccc(-c4ncco4)cc3)c2)c1 500405653 MOBUBAMGAHALBT-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CC[C@@H]1C[C@@]1(NCc1ccc(OC)c(OCCCC#N)c1)c1cccc(C)c1 500526693 FNTKTLOMTIXARI-YKSBVNFPSA-N 378.516 5.101 30 20 GKED N#CCCN(Cc1ccco1)Cc1cn(Cc2ccccc2)nc1-c1ccccc1 505756181 KDYJYMDEDDLIPX-UHFFFAOYSA-N 396.494 5.107 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1Oc1ccccc1 510343405 SSDIGWIRZVCRDV-SFHVURJKSA-N 385.467 5.253 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N(Cc2ccccc2)C2CC2)cc1 510644973 COGCGXPKRNMWRJ-UHFFFAOYSA-N 383.451 5.547 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 511012879 KEIQMRBJEVHYRW-ZDUSSCGKSA-N 392.286 5.115 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(OCc2cccc(F)c2)c1 511363249 MXMKVALPQAXCDY-UHFFFAOYSA-N 396.487 5.686 30 20 GKED N#C[C@H](NC(=O)c1cccc(F)c1Sc1ccccc1)c1ccccc1F 511610400 JTIPFFYDIRVBJO-IBGZPJMESA-N 380.419 5.111 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 512796183 DXUFOBFXBLQBLV-AWEZNQCLSA-N 390.405 5.497 30 20 GKED N#CCc1ccc(C(=O)Nc2nc(-c3ccccc3)c(-c3ccccc3)o2)cc1 513173679 LGQFYKLUQDTKBN-UHFFFAOYSA-N 379.419 5.327 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(COc3ccccc3C#N)o2)cc1 515551383 LEEFRLSCBCESHB-OAQYLSRUSA-N 386.451 5.016 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 518755832 OPDIBUZPBDTFBC-GHTZIAJQSA-N 393.556 6.230 30 20 GKED COc1ccc(C#N)cc1NC(=O)[C@@H](Sc1ccccc1F)c1ccccc1 521570488 OIEQSXCXKCPVTR-NRFANRHFSA-N 392.455 5.178 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(N[C@H](C)C(=O)Nc3cccc(C#N)c3)c2)C1 521726443 NLXVOILEHJFCKD-PMAPCBKXSA-N 391.515 5.093 30 20 GKED N#Cc1cccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)c1 530675051 ZXJNBRKDERSUFH-XMMPIXPASA-N 381.479 5.148 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 534595979 BPCQDWZPEPYEDQ-GOSISDBHSA-N 396.343 5.104 30 20 GKED CC[C@H](C)n1c(SCCCC2(C#N)CCOCC2)nnc1-c1ccccc1 537504981 DYUVSGLDBFPNLM-KRWDZBQOSA-N 384.549 5.109 30 20 GKED Cc1cccc(Oc2cc(CN[C@H](C)c3ccc(C#N)c(F)c3)ccn2)c1C 539606249 IYUCLJLAPBXORZ-QGZVFWFLSA-N 375.447 5.352 30 20 GKED CC(C)(C)c1cc(NC(=O)CCCc2nc3ccccc3s2)c(C#N)s1 540273020 UGPWBDXSGPCUHF-UHFFFAOYSA-N 383.542 5.488 30 20 GKED Cc1ccccc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541076017 WESBITIUZJSWAA-OALUTQOASA-N 383.495 5.212 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 549212818 AXQNXSCPVHKYIS-HNNXBMFYSA-N 389.948 5.559 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C1CC1 554205386 DUFRWHANFZNIAV-OAHLLOKOSA-N 397.548 5.312 30 20 GKED N#Cc1ccc2ncc(CN[C@H](c3ccccc3)[C@@H]3CCCc4ccccc43)n2c1 560259628 ZIQWRJMBKWIATC-AOYPEHQESA-N 392.506 5.157 30 20 GKED N#Cc1cc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)nc2ccccc12 572560486 WDSGINFTVBTZGO-UHFFFAOYSA-N 384.826 5.074 30 20 GKED N#CCCC[C@@H](Nc1ncnc2cc(F)c(Br)cc12)c1ccccc1 574137524 CTMSOQCFHXPZAO-QGZVFWFLSA-N 399.267 5.378 30 20 GKED N#Cc1ccc(-c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1Cl 578678910 PTSFUGVKICJANE-AWEZNQCLSA-N 381.716 5.339 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)n2)cc1 581386890 SXKSHQYTGPEGHE-JKSUJKDBSA-N 379.872 5.077 30 20 GKED CSc1cccc([C@@H](NC(=O)CCCCCC#N)c2cc(F)ccc2F)c1 588621134 COKRADTWOQTGQM-OAQYLSRUSA-N 388.483 5.366 30 20 GKED N#CCc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)c1 603727090 LQTRLFUHNGWBIX-UHFFFAOYSA-N 387.405 5.014 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 604547426 ZBLXUQVFBVOLPD-RISCZKNCSA-N 385.533 5.118 30 20 GKED CCc1nc(CN(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cs1 609208676 DZTHFVCKWHQEQN-UHFFFAOYSA-N 392.484 5.033 30 20 GKED N#Cc1cccc(NC(=O)[C@@H](Sc2ccc(F)c(F)c2)c2ccccc2)c1 609261236 DWOIYELPPJBAAD-FQEVSTJZSA-N 380.419 5.309 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(C(F)(F)F)cc1 609377629 ZQSIRVQPBSUHHL-ZDUSSCGKSA-N 378.419 5.138 30 20 GKED C[C@H](NC(=O)Nc1cccc(CSc2ccccn2)c1)c1cccc(C#N)c1 610323514 ZDKSZVOIXPYUFY-INIZCTEOSA-N 388.496 5.128 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 613292719 ROHLUNYALSHJLN-OAQYLSRUSA-N 377.447 5.493 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)c2cccc(Oc3nccs3)c2)CC1 613617037 IGWJJQMOCWVCKG-UHFFFAOYSA-N 383.517 5.164 30 20 GKED N#Cc1cc(NC(=O)CCC(F)F)ccc1Oc1ccc(C(F)(F)F)cc1 619437705 NRQDNQWXPFLIIC-UHFFFAOYSA-N 384.304 5.353 30 20 GKED N#C[C@@H](C(=O)c1cc(F)c(Br)c(Cl)c1)c1nc(C2CC2)cs1 647379713 HGYSCAZXZPIHAB-VIFPVBQESA-N 399.672 5.066 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 679239007 SZUOVDGJRDQRDD-HXUWFJFHSA-N 389.414 5.389 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1ccc2ccccc2n1 679536267 HJQHEGXYBIJRPK-CQSZACIVSA-N 391.402 5.127 30 20 GKED COc1ccc(-c2nn(-c3ccccc3)cc2C=NNc2cccc(OC)c2)cc1 725853564 NDZFFSKLERNIGD-UHFFFAOYSA-N 398.466 5.003 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)c1 726484673 CLJXPOVNHXGUCT-UHFFFAOYSA-N 399.494 5.391 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(O[C@H](C)c3ccccc3)nc2)cc1 726940698 PCZALPQEKZQHRF-LJQANCHMSA-N 385.467 5.091 30 20 GKED Cc1c(C(=O)O)oc2c1C(=O)/C(=C/c1ccc(Cl)c(C(F)(F)F)c1)CC2 727267461 UVOKZRONNUICJA-UXBLZVDNSA-N 384.737 5.171 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)c1cccc(C#N)c1 727640606 LVFHJZYRUXHQFQ-ZDUSSCGKSA-N 382.872 5.182 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C(F)(F)c1cccc(Cl)c1 731332394 KMLYOILPPCAMPZ-LBPRGKRZSA-N 380.847 5.465 30 20 GKED O=C1/C(=C/c2csc([N+](=O)[O-])c2)CCc2nc(-c3ccccc3F)sc21 731936592 BKTODOSXRBRWMB-YRNVUSSQSA-N 386.429 5.131 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 732644582 XJKOUOOZSRJNJP-UHFFFAOYSA-N 390.499 5.381 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679442 HZMOOVCDLBATNZ-SJLPKXTDSA-N 388.920 5.378 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OCc2cc(Cl)ccc2OCC#N)cc1 742360984 FIYILIMQFJEFJE-UHFFFAOYSA-N 388.851 5.168 30 20 GKED C[C@H]1/C(=C\c2csc(-c3ccccn3)n2)C(=O)c2cccc(Br)c21 742433940 BAHKENCWECWEAF-LUHPIMIVSA-N 397.297 5.351 30 20 GKED CCCCN(CC(=O)[C@H](C#N)c1nc2ccccc2s1)[C@H](C)c1ccc(C)o1 746164835 CJZYFHIBAUASBI-SJORKVTESA-N 395.528 5.237 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3cccc4ccccc34)C2=O)s1 749017466 UKIMOPWPGBGKIT-YVLHZVERSA-N 378.503 5.179 30 20 GKED C[C@H](OC(=O)c1c(F)cc(C#N)cc1F)c1ncc(-c2ccc(Cl)cc2)o1 751745218 LXIIPEZEOXUHCD-JTQLQIEISA-N 388.757 5.063 30 20 GKED Cc1ccccc1-c1cc(C(=O)O[C@@H](C)C(C)(C)C#N)c2cnn(C(C)C)c2n1 753621701 YPUVFUKIZWSMBC-INIZCTEOSA-N 390.487 5.083 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C/c3ccc(Cl)c(C(F)(F)F)c3)ccc21 754688901 BITDXHVCKIMJCA-FPYGCLRLSA-N 393.792 5.164 30 20 GKED C#CCN(Cc1csc(N(C(C)=O)c2ccccc2CC)n1)C1CCCCC1 756499805 GJVZTYISBXTWIV-UHFFFAOYSA-N 395.572 5.158 30 20 GKED CC(C)Oc1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1C#N 761774839 AIOMPWHWGAYTJU-UHFFFAOYSA-N 383.662 5.558 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCc3sccc3[C@@H]2c2cccs2)cc1 768209476 YIBXCKDPUJUGLD-YCRPNKLZSA-N 380.538 5.248 30 20 GKED O=C(/C=C\c1nccc2ccccc12)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 771097851 KWVNRWXAJDYAMZ-VJIACCKLSA-N 391.442 5.218 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc(O)c3c4c(sc3n2)CCCC4)c(F)c1 772806172 KRELMUSGQGMXDX-JYRVWZFOSA-N 385.851 5.023 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2cccc(Br)c2)c1 772984213 NQMXYHNZCFKIGS-UYAOXDASSA-N 387.321 5.371 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 774450220 SFXDHXIGIAZOTA-DYESRHJHSA-N 389.326 5.915 30 20 GKED Cc1ccc(-c2cc(C(=O)O[C@H](C)C(C)(C)C#N)c3cnn(C(C)C)c3n2)s1 777333203 GWHVNFFPLRIGTN-CQSZACIVSA-N 396.516 5.144 30 20 GKED C[C@H](Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(C#N)c(F)c1 777668354 TUUJKUFWNZYZSC-HNNXBMFYSA-N 377.488 5.495 30 20 GKED Cc1cc(Br)cc([C@@H](C)Nc2cccc(OCCCC#N)c2)c1O 779040626 NQGMMNOFCLIKEG-CQSZACIVSA-N 389.293 5.319 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3sccc3Cl)SC2=S)cc1Cl 779205626 ZTENCFFYHYYFLJ-AWNIVKPZSA-N 397.333 5.332 30 20 GKED CSc1ccc2cc(CNc3ccccc3O[C@@H](C)C#N)c(Cl)nc2c1 779746002 LSQGDQBCGASRJM-ZDUSSCGKSA-N 383.904 5.513 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1sc(-c2ccccc2)nc1C(F)F 780174759 AEBLOFGOQNCMJI-GFCCVEGCSA-N 399.422 5.291 30 20 GKED CC(C)(C)OC(=O)N[C@@H]1C[C@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 780730507 SXJCKBCSPCVQSX-BHIFYINESA-N 391.515 5.332 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C/c1cnc(-c2cccs2)s1 787184927 WOPBDMBRQGQZKC-FNORWQNLSA-N 389.885 5.208 30 20 GKED CC(/C=C/C(=O)c1ccc(C(=O)N(C)C)cc1)=C\c1cccc(C(F)(F)F)c1 792924505 DAWIMWIKEDHXCC-HMYPBVIVSA-N 387.401 5.250 30 20 GKED COc1ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)cc1OCc1cccnc1 795810440 KABICJOCVQDENU-HSZRJFAPSA-N 399.494 5.420 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)OC(=O)C[C@@H](CC#N)c3ccccc3)o2)cc1C 795982914 JBVBJWWDOUEHOE-IEBWSBKVSA-N 389.455 5.045 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797573580 UOKCHAGNBSKPSR-KBXCAEBGSA-N 378.497 5.238 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2Br)cc1)c1ccnc(O)c1 806556579 WKVRJETUILHRNA-JXMROGBWSA-N 380.241 5.113 30 20 GKED COc1ccccc1-c1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)cc1 806561004 QMVXCCOXUBNANR-JIDPPIHHSA-N 384.431 5.200 30 20 GKED CCOc1cc(/C=C\C(=O)c2c(F)cccc2Cl)cc(Br)c1O 809158490 AUCCBLMXURDFMY-SREVYHEPSA-N 399.643 5.242 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842942576 PKLUHAIYYRXCST-NHYWBVRUSA-N 378.419 5.409 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC(NC(=O)c2oc(C)cc2C)CC1 857816689 FPCIHSANOXKNRA-KRWDZBQOSA-N 390.568 5.004 30 20 GKED Cc1ncsc1C(=O)/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1 915054323 YYIDYPPJZUWTHF-MDZDMXLPSA-N 382.872 5.253 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2sccc2-n2cccc2)cc1 915085851 PCFHCRNSJLJVRR-FQEVSTJZSA-N 383.476 5.447 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Cl)s1)C(=O)Nc1cc(Cl)cc(Cl)c1 916946003 HRVHGRBJQNLMPV-MTMQSLQUSA-N 399.686 5.069 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917026586 IJBTWZVTMUYRGB-LPHOPBHVSA-N 390.508 5.579 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C/c2cc(Cl)cc(Cl)c2)cc1 917517780 KRTNKOHBKHHPGF-FARCUNLSSA-N 387.266 5.202 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2ccc(Cl)cc2Cl)SC1=S 917644632 JPALFGZVOFOQOF-CHHVJCJISA-N 391.304 5.271 30 20 GKED N#CCSc1ccccc1C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330422 DADLELZDJMQQBQ-UHFFFAOYSA-N 390.420 5.097 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2COC(C)(C)C)c1 932532996 ODTGNRFGJZXEEU-IBGZPJMESA-N 395.503 5.004 30 20 GKED N#CCCc1ccc(NC(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)cc1 932581524 PCKQCZCSMQKQMG-KRWDZBQOSA-N 390.512 5.164 30 20 GKED Cc1cccc(Cl)c1NN=Cc1cccc(OCc2cccc(C(=O)O)c2)c1 1776060881 ULAWRKJMJHUTAM-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(OC)c(C(=O)O)c2)cc1 1776125893 VYRVEKKPBGQLGU-RIYZIHGNSA-N 396.483 5.639 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)cc1 1776788936 JBNIPVIEMUSTCQ-NZHZHZHDSA-N 396.483 5.394 30 20 GKED Cc1cccc2c1CC/C(=C\c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777457258 NEFYTCVRKMVPDU-XMHGGMMESA-N 398.458 5.485 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc3c(Br)cccc3s2)c1 1777686173 UKUXJFAFGFXNIN-BQYQJAHWSA-N 387.254 5.258 30 20 GKED N#Cc1ccc(Oc2nc(-c3cccnc3)nc3sc4c(c23)CCCC4)cc1 15175249 DZCSAABUNUVPEV-UHFFFAOYSA-N 384.464 5.296 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2ccc(C)c(F)c2)cc1 27293636 ADDUFCPJWBKPNZ-UHFFFAOYSA-O 399.536 5.151 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 103330552 PWQWDQJQTLPSIN-YJBOKZPZSA-N 376.481 5.189 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccncc1 108532102 VAVMKKRMIUMULN-FXAWDEMLSA-N 394.544 5.483 30 20 GKED COc1ccc(Cl)cc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 109028865 QFYHMSNIFYMPMT-CYBMUJFWSA-N 389.908 5.065 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CN(CCC#N)CC(C)(C)C)cs1 109812385 PAFNCLWMRDDAGS-UHFFFAOYSA-N 398.576 5.206 30 20 GKED C=CCc1cc(CN[C@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1O 113339592 ZDPQLXLDTRCTEB-OAHLLOKOSA-N 380.513 5.104 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1ccccc1C#N 120314999 HPQWAKWZPFOHGT-UHFFFAOYSA-N 387.386 5.261 30 20 GKED Cc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1NC(=O)C(C)(C)C 120857420 KEOMOSUBJIPXBZ-LJQANCHMSA-N 392.503 5.146 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)c(F)c1 154705807 LDBYIRIYJWFNSO-UHFFFAOYSA-N 388.295 5.173 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)c2sc3ccccc3c2Cl)cc1C#N 161017654 LEHMBUVHOAEEQQ-UHFFFAOYSA-N 399.859 5.247 30 20 GKED C=CCn1c(-c2cccs2)nn(CN(CC)[C@@H](CC)c2ccncc2)c1=S 161029792 AMNMUCLZYJMZQA-KRWDZBQOSA-N 399.589 5.154 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1)c1ccccc1 188068381 PHUZGOQGPBPTQD-QDPGVEIFSA-N 395.568 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](NC(C)=O)c1ccc(C)cc1 189887565 DADWFVSDLWIMCX-QFIPXVFZSA-N 378.516 5.053 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)c1nccs1 191464778 JMTSOMDZUQWMBG-OAQYLSRUSA-N 391.540 5.906 30 20 GKED CCCNc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 192415769 ANJJRFWDLPWREL-INIZCTEOSA-N 382.533 5.224 30 20 GKED C=CCOc1ccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc1OC 215737826 YKTSYMXBFQUPLC-RCCKNPSSSA-N 388.423 5.152 30 20 GKED N#Cc1cnc2ccc(OC(F)F)cc2c1N[C@@H]1CCO[C@H](c2ccccc2)C1 302155023 DMXYPSIRTZILFU-UZLBHIALSA-N 395.409 5.040 30 20 GKED O/C(CC1CCCC1)=N/C1CCN(/C(O)=N\CC2CC(c3ccccc3)C2)CC1 328749757 QEKBFZQVAPTWRA-UHFFFAOYSA-N 397.563 5.095 30 20 GKED CC(C)(C)C1CCC(C#N)(/N=C(/O)CCc2cc3ccccc3nc2O)CC1 329960441 RCZQYSZPZABSGX-UHFFFAOYSA-N 379.504 5.328 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)c1cccc(NC(=O)C2CCCCC2)c1 410963465 FXLZSUWTQABLQX-UHFFFAOYSA-N 395.890 5.177 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c21 411008558 IKSZBABNLGMIRL-NEPJUHHUSA-N 394.525 5.076 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ncccc2OCCCC#N)c2ccccc21 425940404 WSDYGJWTXZHORK-PXNSSMCTSA-N 377.488 5.020 30 20 GKED C=CC[C@@H](C)NC(=O)C/C(=C/c1cccc(OC)c1)c1nc2ccccc2s1 426875212 MZCYCPAKAASRGH-OKSBFYSISA-N 392.524 5.316 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc2ncsc2c1 431916461 MNGHYFHHBAVEFR-QAPCUYQASA-N 378.501 5.092 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)Nc2cccc(C#N)c2C)cc1 432282261 IXDBAUVTRYUXHZ-GOSISDBHSA-N 399.494 5.767 30 20 GKED C=CCOc1ccccc1CN[C@@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 433406056 LMIYZZBUNUZQBA-RXVVDRJESA-N 399.506 5.189 30 20 GKED C=CCC[C@@H](NC(=O)CCc1ncc(-c2ccccc2F)o1)c1ccccc1 435280042 RJORUTRUKJDSNJ-HXUWFJFHSA-N 378.447 5.237 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(C)c1C(=O)N1CCCC1)c1ccccc1 435664021 QMTFBPQREUFTTL-FQEVSTJZSA-N 391.515 5.060 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 437951666 HRPRCOJOORJTAO-UHFFFAOYSA-N 383.879 5.054 30 20 GKED CC(C)(C)OC1CCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1 444637299 GCCOBQSKMMKNAC-UHFFFAOYSA-N 376.544 5.166 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(CF)CC2)cc1Cl 454489033 QRLWINYBYTZNNK-LJQANCHMSA-N 385.870 5.209 30 20 GKED CSCC1CCC(NC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 454757690 JTMAKHFVMWKVDH-QQFBHYJXSA-N 377.579 5.124 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ccc(Br)s3)c2)c1 462209453 IWDIWBLWHLXRQP-UHFFFAOYSA-N 399.313 5.573 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F 463738061 OEZYZOKXTASYSJ-FMKPAKJESA-N 399.482 5.666 30 20 GKED CSc1c(F)cc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)cc1F 464319274 ZLSRUAWHCKZVJZ-UHFFFAOYSA-N 383.288 5.236 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 467869961 XLPMWLULLDHRLW-TZIWHRDSSA-N 385.511 5.353 30 20 GKED CSc1ccc(Cl)cc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 477709186 DYXLVMFDTCTPAV-UHFFFAOYSA-N 387.936 5.624 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 477727648 SCXHMZVSKKNKIU-BUXKBTBVSA-N 380.385 5.263 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)c1ccc(Sc2ccccc2C#N)cc1 479495181 FOEOGCRXDVTASP-OAQYLSRUSA-N 387.508 5.025 30 20 GKED N#Cc1c(NC(=O)CCSc2ccc(F)c(Cl)c2)sc2c1CCC2 480545552 MOJHMDUSLOTREH-UHFFFAOYSA-N 380.897 5.022 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(-c2nccc(C)n2)c1 480580852 RMEPYJGOYANEMF-UHFFFAOYSA-N 398.919 5.387 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(OC)c(OC)c1C 482202562 WLKBPHXLTIFVSJ-KRWDZBQOSA-N 396.531 5.747 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Cl)cc1Br)c1ccccc1 483871573 MDNQUJWQFFEKBL-CYBMUJFWSA-N 377.669 5.129 30 20 GKED N#CCCC[C@H](NC(=O)Cc1csc2ccc(Cl)cc12)c1ccccc1 487221724 SMVXVPCLWNCGPX-IBGZPJMESA-N 382.916 5.649 30 20 GKED Cc1cccc([C@H](NCc2cc(C#N)ccc2Br)C(F)(F)F)c1 491597368 UNULARBLZDTCFR-INIZCTEOSA-N 383.211 5.022 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3)s2)cc1 493732517 AKRFVRWOOCREQS-MOPGFXCFSA-N 393.899 5.001 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cccc(OCc2cccs2)c1 509614094 ARUZHUZYAIHBKC-UHFFFAOYSA-N 392.480 5.238 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1cccc(C(F)F)c1 511542715 QAMUPGMAQKCRPG-UHFFFAOYSA-N 394.396 5.790 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CCCCOc1cccc(C#N)c1 518373144 OICVJNWZXRBPNC-UHFFFAOYSA-N 391.298 5.073 30 20 GKED C[C@](C#N)(NC(=O)CCOc1ccccc1-c1ccccc1)C1CCCCC1 518426944 VMQKGDKYNOAAIF-XMMPIXPASA-N 376.500 5.101 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCC(=O)c3ccc(F)cc3)c2)cc1 519124676 QZKGLKVMOYBOCH-UHFFFAOYSA-N 388.398 5.091 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)oc12 521797938 VQYXAEQTUREHDX-HNNXBMFYSA-N 378.497 6.005 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 522701634 PXFCPUMNSKBMGZ-SFHVURJKSA-N 377.488 5.703 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cccc(C#N)c3)cc2Cl)cc1 531384242 YHKIBDYKBMVCNF-UHFFFAOYSA-N 387.826 5.057 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 533299079 JNIRDRBACVDQPT-MJGOQNOKSA-N 395.572 5.187 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3scnc3C3CC3)c2C#N)C1 534029292 YYGPRGXHJBYWIE-LBPRGKRZSA-N 385.558 5.357 30 20 GKED C[C@@H](N[C@@H](CO)c1cccc(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 536867383 DECOZUVAALGANX-HWPZZCPQSA-N 395.318 5.248 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1csc(C)c1C 536907999 DAPLNIQOOAELSD-UHFFFAOYSA-N 376.481 5.376 30 20 GKED CC(C)(C)c1ccc(OCc2ccc(C(=O)N3CCC(CC#N)CC3)cc2)cc1 541049490 NWQAHJXEAWHGAR-UHFFFAOYSA-N 390.527 5.329 30 20 GKED CC(C)(CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)C(F)(F)F 548911126 CXHUQMLYKYJRHB-UHFFFAOYSA-N 392.446 5.169 30 20 GKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(SCC(F)(F)F)cc1 551557940 CPUCMTMQVAGWTC-AWEZNQCLSA-N 376.447 5.553 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCOC[C@H]1c1nc2ccccc2s1 554578985 HLBXPEMELBARNG-IBGZPJMESA-N 393.512 5.020 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](CC)c1cccc(OC)c1 554759740 AHGDSUPCUOOKRD-QFIPXVFZSA-N 380.532 6.162 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCc2sc(Cl)cc21 564369657 KYHVGXSNOIIODS-AAEUAGOBSA-N 391.949 5.462 30 20 GKED C=CCOc1ccc(CN[C@@H]2c3ccccc3CC23CCOCC3)cc1Cl 580015853 FTZXVHMWGMSVKI-JOCHJYFZSA-N 383.919 5.089 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)n2)cc1 581386889 SXKSHQYTGPEGHE-HZPDHXFCSA-N 379.872 5.077 30 20 GKED CC(C)n1c(S[C@@H](C)c2ccc(C#N)cc2)nc2cc(Cl)ccc2c1=O 583717031 AMCVUAMBTXPLPE-ZDUSSCGKSA-N 383.904 5.356 30 20 GKED CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)CCCCCC#N 588887008 GZMMXPKTUNRKGD-QFIPXVFZSA-N 384.470 5.919 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1csc(C(F)(F)F)c1 599737599 MYVIGDMBBWWZEY-LLVKDONJSA-N 399.463 5.483 30 20 GKED N#C[C@H](C(=O)c1nccc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 603627417 JIBUNHNNIZDNMA-CQSZACIVSA-N 397.381 5.353 30 20 GKED N#Cc1c(NC(=O)c2ccc(Br)cc2Cl)sc2c1CCCC2 603946138 XPCBEXKEWBENAB-UHFFFAOYSA-N 395.709 5.167 30 20 GKED C=CCCCCCN(C)C(=O)c1oc2ccccc2c1CSc1ncccn1 606817386 ZDYFACZHCCDNAY-UHFFFAOYSA-N 395.528 5.334 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccccc3-c3ccccc3)o2)cc1 609054349 DFXJMYRHAKGPQL-UHFFFAOYSA-N 394.430 5.650 30 20 GKED COc1ccc(Cl)c(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1 609643353 YMASCTNPMRWBGN-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CSCCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 609928135 KBOBOHONBYGPRQ-GOSISDBHSA-N 387.936 5.260 30 20 GKED CC(C)n1nc(-c2ccco2)cc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 619167249 ZMQFRDDDDYGPSK-UHFFFAOYSA-N 389.242 5.155 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H](CC2CCCCC2)c2ccccc2)c1 726231015 RIPWISOSRSHFBL-JOCHJYFZSA-N 377.488 5.422 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cnc(-c3ccc(C)cc3C)s2)cc1 726940649 ZTTOTCGLAQYMNV-UHFFFAOYSA-N 375.497 5.296 30 20 GKED C#Cc1cccc(N(C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)C(C)C)c1 728247576 LGHJBQHIRXHYDQ-UHFFFAOYSA-N 388.515 5.172 30 20 GKED N#CCCCCOC(=O)[C@@H](Oc1cc(Cl)ccc1Cl)c1ccccc1 730369022 HWVWIRUPSCKXJG-SFHVURJKSA-N 378.255 5.351 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)cc1 730948709 KAFZYLYWKCAYJE-NYYWCZLTSA-N 394.448 5.175 30 20 GKED Cc1ccc(CN2C(=O)c3ccccc3N[C@@H]2c2ccc(O[C@H](C)C#N)cc2)cc1 731298545 KDOHDXJJZMPLQF-KOSHJBKYSA-N 397.478 5.053 30 20 GKED Cc1cc(NC(=O)c2sc3cc(C(C)C)ccc3c2Cl)n(CCC#N)n1 732636689 ONLFVRXWQLCJFV-UHFFFAOYSA-N 386.908 5.349 30 20 GKED C=CCN(Cc1ccccc1)C(=S)Nc1ccc(OC(F)F)c(Cl)c1 735624493 HIPAMMYXKAPPRH-UHFFFAOYSA-N 382.863 5.326 30 20 GKED COc1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1C#N 741840397 SBOLRLJAVVDKNY-XMHGGMMESA-N 396.471 5.600 30 20 GKED Cc1cccc2c(CCC(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c[nH]c12 744118200 HNWYGQHQTVTZEJ-INIZCTEOSA-N 377.444 5.034 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)n1 748688053 MWGBWQCNGAAVFT-UHFFFAOYSA-N 393.830 5.137 30 20 GKED COc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760010560 XAVHVPDECUAESH-PKTZIBPZSA-N 397.478 5.160 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)c1c(Cl)cc(F)cc1Cl 763540318 IQSROMRUAYZWDD-UHFFFAOYSA-N 388.609 5.045 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1ccc(Cl)c2ccccc12)c1ccncc1 765887211 ZSNSOTJHZQMFCP-QVKFZJNVSA-N 379.891 5.566 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2nc(O)c3c4c(sc3n2)CCCC4)c(F)c1 772806179 KRELMUSGQGMXDX-MDWZMJQESA-N 385.851 5.023 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780679010 ZXIVVISNTIJSGJ-PGRDOPGGSA-N 391.515 5.860 30 20 GKED CC[C@H](C)CCCCC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 784821076 KWDNJIOFLKPICA-ZFWWWQNUSA-N 385.533 5.058 30 20 GKED C=CC[C@H](NC(=O)[C@H](CC)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 786185350 MYMNTVRBMSWFQK-APWZRJJASA-N 376.422 5.103 30 20 GKED CN(CCC(F)(F)F)[C@@H](C/N=C/c1ccccc1O)c1ccc(Cl)cc1 790572703 BCVNEGIEESUQNW-KZKMUKRCSA-N 384.829 5.090 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792101200 FUDZNPLOCQEBKK-MLGOLLRUSA-N 385.250 5.185 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(C4CC4)cnc3Cl)c2)cc1 793432140 JEEDRDCJUYFLIJ-UHFFFAOYSA-N 389.842 5.529 30 20 GKED CC(C)n1ncc2c(C(=O)OCC(C)(C)CCC#N)cc(-c3ccccc3)nc21 798878139 DYVDNIGKTSOETF-UHFFFAOYSA-N 390.487 5.166 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(C3(c4cc(F)cc(C#N)c4)CC3)n2)nc1 809447228 MQHLWWMJXSITCQ-UHFFFAOYSA-N 394.475 5.113 30 20 GKED CC(=NNc1nnc(-c2ccccc2)s1)c1csc(-c2ccccc2F)n1 814949298 YVCQFUDGZQYEBF-UHFFFAOYSA-N 395.488 5.304 30 20 GKED C[C@@H]1CCC[C@H](c2noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)C1 848605731 ROSSGZUNIHLQGM-OWCLPIDISA-N 376.501 5.013 30 20 GKED Cc1cccc(CCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 917042343 DYKXOOJWFRCGEY-HNNXBMFYSA-N 388.414 5.433 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(SCC(F)(F)F)cc1 1776062417 SPLXPUQIDDUUEZ-UHFFFAOYSA-N 386.370 5.014 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(C(C)(C)C)cc2)c2cc(C(=O)O)oc12 1776119536 DHAJVBZMUBTQLF-XFFZJAGNSA-N 378.424 5.333 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc2c(c1)CCC(C)(C)O2 1776354561 PZYMBWCPKRZSPR-VMPITWQZSA-N 394.467 5.172 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](Cc2ccccc2)C(=O)O)cc1 1776786455 WGUZXOYKKXCOFE-JOCHJYFZSA-N 383.532 5.069 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2cccc(CCC(=O)O)c2)cc1 1776786655 SAIKEKLCDNPVFQ-UHFFFAOYSA-N 381.516 5.859 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2cccc(OCC(=O)O)c2)cc1 1776789301 RKYKUPVWAWZREI-SDNWHVSQSA-N 382.456 5.005 30 20 GKED COc1ccccc1-n1c(-c2ccccc2)cnc1SC[C@@H](C#N)CCC#N 7043404 AFNYVHORXPOWBU-QGZVFWFLSA-N 388.496 5.084 30 20 GKED Cc1nc(Cc2ccc(F)cc2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 30847975 CCLVELBRTAJYRC-UHFFFAOYSA-N 393.487 5.235 30 20 GKED N#C[C@H](C(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccccn1 41493695 YUEGHLQXLBAWGX-SIKLNZKXSA-N 392.911 5.434 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 56744497 HZCQXZNEFXMMCJ-UHFFFAOYSA-N 387.439 5.023 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc1 57683892 HIVOPKDOSZJMJH-UHFFFAOYSA-N 384.810 5.102 30 20 GKED N#Cc1cccc(C(=O)/C=C/c2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 59270288 QILQPZQQXCYQRD-KPKJPENVSA-N 386.838 5.360 30 20 GKED N#CC1CCN(C(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)CC1 61584173 AAECXHORDRLZSV-UHFFFAOYSA-N 394.471 5.240 30 20 GKED Cc1cc(C)n(-c2ccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2)n1 66800697 FXPYIUFDRLIZTQ-QGZVFWFLSA-N 390.512 5.136 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2oc3ccc(Cl)cc3c2C)cc1 111020654 HWZXFNOUUKTBKD-UHFFFAOYSA-N 382.847 5.354 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 112818385 YRRGRLBBDAEIHA-CHWSQXEVSA-N 392.883 5.279 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 153785063 FBZRCQFUMUPUDV-AWEZNQCLSA-N 375.428 5.088 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(C)cc2O)cs1 156708099 IWULPWBRIPMTOR-YRNVUSSQSA-N 392.480 5.046 30 20 GKED CCC(=O)c1ccc(OCCCCC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 171408949 YWHGMFSIDCOZLL-UHFFFAOYSA-N 392.499 5.268 30 20 GKED N#C[C@@H](NC(=O)c1scnc1C1CCCC1)c1cccc(Cl)c1Cl 185280001 KBKYHNSJPLGGJD-CYBMUJFWSA-N 380.300 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(OC(F)F)cc1 191466573 ZUPHXTZEDZAMCG-UHFFFAOYSA-N 388.458 5.804 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c(C)n(C2CCCCC2)c2ccc(OC)cc12 195740065 OKYLQBFMUXOXDW-MRXNPFEDSA-N 381.520 5.085 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cccc(C)c2C)cs1 255334632 CYTZXPBLBXTHNH-XFXZXTDPSA-N 394.471 5.480 30 20 GKED Cc1nc(C)c(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)s1 266343407 MVXYYNVIKXHCHS-GFCCVEGCSA-N 391.587 5.026 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CCC(=O)c2ccc(C)s2)c1 303126258 BBIAPZXZHSPHQT-UHFFFAOYSA-N 393.533 5.296 30 20 GKED CCS(=O)(=O)c1ccc([C@H](C)/N=C(/O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1 329162880 ZWUTXEPUXCAVKL-GDAAHCPNSA-N 377.550 5.104 30 20 GKED C[C@@H]1CCCCN(C(O)=Nc2cccc(C(O)=Nc3ccc(Cl)cn3)c2)C1 330101043 HXNOWQRDLKGXQQ-CQSZACIVSA-N 386.883 5.039 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](c1ccc(Cl)cc1)C1CC1 330261636 UJYSXYBKWVAVNH-WBVHZDCISA-N 390.936 5.455 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)no1 377183444 RJPMBIAXNDFKMY-NRFANRHFSA-N 388.427 5.016 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1C 425659907 LEKATZLRFKVOQW-SFHVURJKSA-N 393.531 5.797 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc4c(F)cccc4c3)n2)cc1 429679206 FETPBBWZYSYINJ-KRWDZBQOSA-N 387.439 5.296 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccccc1)c1cccc(C(F)(F)F)c1F 429821658 OQASFPWKSBDKKK-CYBMUJFWSA-N 379.275 5.268 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CO[C@@H]1CCCc2ccccc21 430547073 DTDGDCCTFAPHJA-OXJNMPFZSA-N 380.513 5.114 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)F 433116787 LXSYCJOZRWBWQE-DYVFJYSZSA-N 375.444 5.066 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1nc(C2CCCCC2)no1)c1ccccc1 435761350 FNWLQHWVMBAXDB-QFBILLFUSA-N 382.508 5.185 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 438033244 XQSYEURZXFPISW-INIZCTEOSA-N 383.517 5.346 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] 439660150 IFQWDALCDHQQCP-KRWDZBQOSA-N 391.452 5.332 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)C1 456055526 WQHPSFRPJCSQNG-GUYCJALGSA-N 390.380 5.324 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2(C3CCC3)CCC2)cc1 459354503 VKGORYZSVSRYMZ-UHFFFAOYSA-N 389.499 5.176 30 20 GKED CC(C)Sc1c(Cl)cccc1NCC(=O)Nc1cc(Cl)ccc1C#N 462241798 BUGKAYVFSPGPER-UHFFFAOYSA-N 394.327 5.416 30 20 GKED Cc1ccc(-c2nc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)cs2)cc1 464938912 VXAPUEFFXQQSGD-TZIWHRDSSA-N 387.508 5.031 30 20 GKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 467606328 GDIJJUKGACWKKB-MAUKXSAKSA-N 379.460 5.011 30 20 GKED C[C@H]1CSc2ccccc2N1CC(=O)Nc1ccccc1S[C@H](C)CC#N 472584884 YCKFPHOIUWVRDA-JKSUJKDBSA-N 397.569 5.020 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1c(F)cccc1Cl 477799362 HVQHPZREMNXGQD-STQMWFEESA-N 391.899 5.614 30 20 GKED CN(C)Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1Cl 478023072 IUKKEGNZQCNOIN-UHFFFAOYSA-N 389.886 5.193 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(CN2CCSCC2)ccc1C 486253657 MGSZOMWBARSBAW-UHFFFAOYSA-N 398.597 5.074 30 20 GKED Cc1cscc1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 488376055 CQZRZODRWQDTEJ-UHFFFAOYSA-N 391.496 5.023 30 20 GKED CC[C@H](c1ccccc1)c1nnc(SCc2ccccc2C(C)(C)C#N)o1 488826694 BUTDCCDLEGIHPY-GOSISDBHSA-N 377.513 5.705 30 20 GKED C=CC[C@H](C(=O)N1CCC(n2c(CC)nc3ccccc32)CC1)c1ccccc1 489631390 SHKXWHOAKVEYDS-NRFANRHFSA-N 387.527 5.122 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cc2ccccc2n1Cc1ccccc1F 505181234 ACVRYJADRSIMEQ-UHFFFAOYSA-N 391.490 5.231 30 20 GKED CCc1ccccc1N(C(C)=O)c1nc(CSc2ccc(C#N)cc2)cs1 509656191 ULSBMJDYSRDYMP-UHFFFAOYSA-N 393.537 5.554 30 20 GKED CCC[C@H](C)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 519129625 GBKCGSMBLHNQLJ-KKSFZXQISA-N 378.476 5.178 30 20 GKED N#C[C@@H](NC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1)C1CC1 520884632 DOPJKWXRMAHVNB-QGZVFWFLSA-N 391.323 5.318 30 20 GKED CCCOc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(C)c1 521089248 FTDLCPKZCKZXRQ-UHFFFAOYSA-N 387.439 5.095 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1 521450317 SYHZEQLYHFSHRQ-UHFFFAOYSA-N 387.386 5.039 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 535535897 VPISNVNQYFKBJF-LADGPHEKSA-N 396.494 5.361 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)Nc2ccc(C#N)cc2Cl)c1 539007748 YPBCSNCRHXJEDZ-UHFFFAOYSA-N 376.843 5.530 30 20 GKED COc1cccc(COc2cccc(NCCCC3(C#N)CCOCC3)c2C)c1 539710802 DYPUYWGIUINWTL-UHFFFAOYSA-N 394.515 5.095 30 20 GKED Cc1sc2nc(CSc3ccc(C#N)c(C(F)(F)F)c3)nc(N)c2c1C 542932625 UAKMWYOTPVQUMZ-UHFFFAOYSA-N 394.447 5.073 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c1 543302998 HFKFDBAZQJDYOK-MJGOQNOKSA-N 379.529 5.268 30 20 GKED COCCOc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 543876723 FKDBINPLACDJPT-LJQANCHMSA-N 386.495 5.101 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543961435 JQSOYNFHVHMQRZ-OALUTQOASA-N 393.494 5.218 30 20 GKED CCc1nc2cc(CN[C@H](CCC#N)c3ccc(OC)cc3)ccc2n1C1CC1 549626133 RQOVLDNWXZDXBB-OAQYLSRUSA-N 388.515 5.077 30 20 GKED CC(=O)c1c(C)cc(C)c(Cn2cc(C#N)c(=O)c3cc(C)cc(Cl)c32)c1C 554871276 QWGHSPIYTKVLBC-UHFFFAOYSA-N 392.886 5.011 30 20 GKED COc1sc(CN[C@@H](CCCC#N)c2ccccc2)cc1Br 556907279 QMXPNYHHJIISFR-INIZCTEOSA-N 379.323 5.044 30 20 GKED Cc1csc(NC(=O)[C@H](C)Sc2ccnc3cc(Cl)ccc23)c1C#N 569167967 BUKAVKWOKXDNBT-NSHDSACASA-N 387.917 5.249 30 20 GKED N#Cc1cc(Oc2ccc(NCc3csc(Br)c3)cc2)ccn1 570438292 ASINQYWDKUVMSK-UHFFFAOYSA-N 386.274 5.182 30 20 GKED C=C[C@@](C)(CCOC)c1nc(-c2ccnc(Oc3ccc(C)c(C)c3)c2)no1 572800423 YWSDIYQDOAAXRJ-QFIPXVFZSA-N 379.460 5.021 30 20 GKED C=CCN(CCC#N)C(=O)c1sc2cccc(F)c2c1COc1ccccc1 574407743 WKVKBPABJCLZEG-UHFFFAOYSA-N 394.471 5.161 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)sc1-c1ccc(F)cc1 588348208 DUNBZFZRIZUDFV-HNNXBMFYSA-N 375.428 5.229 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3cc(OC(F)F)ccc32)c(C(F)(F)F)c1 589310508 GLOABQPNBFMYIT-SFHVURJKSA-N 396.359 5.346 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 592974611 VKKCEJIWHQPLIX-AWEZNQCLSA-N 388.851 5.366 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC23CCCC3)cc1Cl 593143908 PUHNFLRMGYBFPW-LJQANCHMSA-N 379.891 5.546 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)CCCCC#N)cc1 593965576 VCBMFFIGKHNNIM-UHFFFAOYSA-N 377.488 5.259 30 20 GKED N#Cc1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)cc1 603460041 YITJGEKTXZOJPD-SAPNQHFASA-N 391.430 5.439 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(CC(C)C)cc1 603739102 QMAHYNFHNRNJJV-UHFFFAOYSA-N 385.467 5.505 30 20 GKED CCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1OCC 604500861 ROIZLBGXNAVFTG-UHFFFAOYSA-N 395.503 5.046 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CC1 609643154 WLEAHNAQTJKXOL-KRWDZBQOSA-N 386.451 5.096 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)Cc1ccccc1 609772979 RDZNBBZKFJIEGE-KRWDZBQOSA-N 381.545 5.329 30 20 GKED CC(C)(C#N)CNC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 611621050 LGCSUKPQIWREQM-UHFFFAOYSA-N 377.366 5.169 30 20 GKED Fc1cc(-c2noc([C@@H](C[C@@H]3CCCO3)C(F)(F)F)n2)cc(C(F)(F)F)c1 650625781 NVPHCDVWGYPEJH-NWDGAFQWSA-N 398.278 5.110 30 20 GKED N#CCOc1cccc(NC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)c1 730171794 APIONGGKGHGTDO-NRFANRHFSA-N 392.455 5.200 30 20 GKED C#CC[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1ccccn1 733693456 ZCDCEEOIMRQIEF-ARNLJNQMSA-N 397.474 5.072 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1ccc(F)cc1)C1CCCC1)c1ccncc1 734684371 NKKXRCBHGYQWOK-JOCHJYFZSA-N 381.495 5.035 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 739143928 TYGFTYVIONHWMB-WFASDCNBSA-N 388.414 5.685 30 20 GKED C[C@@H](NC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1)c1cccc(C#N)c1 743128844 SSEFRGQKAMSZAC-OAHLLOKOSA-N 382.895 5.085 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3cc(F)ccc3F)n2)cc1 744034371 HGJFRQNTGHJAGP-KBAYOESNSA-N 394.446 5.377 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1ccccc1)Cc1ccc(F)cc1 745709035 JWIXDGFRQOYARY-UHFFFAOYSA-N 375.472 5.097 30 20 GKED O=C(/C=C\c1coc2ccccc12)c1ccc(S(=O)(=O)C2CCCC2)cc1 746521174 WUDWOSOCKFVJSY-KAMYIIQDSA-N 380.465 5.045 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSc2ncc(C(C)(C)C)s2)c1C 759712812 AQQZALHVUNHMMA-UHFFFAOYSA-N 387.574 5.096 30 20 GKED C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 760180467 FCBKWBGXPRWUEB-DOMZBBRYSA-N 382.872 5.035 30 20 GKED C[C@@H](OC1CCCCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760366166 UTBLMERAXFDHEC-JPYJTQIMSA-N 376.500 5.408 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(NC(=O)CCC)cc2)cc1 764977754 ZOLNLAHUUCCSAQ-KRWDZBQOSA-N 386.923 5.407 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCCc4sccc43)n2)cc1 771578754 OJDIXLLFJDMDRS-IAGOWNOFSA-N 378.522 5.476 30 20 GKED C=CC[C@@H](NC(=O)c1oc2c(C)cc(Br)cc2c1C)c1ccncc1 777671453 UYNWTOZRDTUJTQ-QGZVFWFLSA-N 399.288 5.254 30 20 GKED O=C(/C=C/c1scnc1C1CC1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 782346781 CEYLCWXFHNKXRO-MNDMWVCDSA-N 387.476 5.004 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](CC)c2cccc3ccccc23)ccc1OC 783252353 PFHIRKFTXWHOOB-NZQKXSOJSA-N 388.511 5.770 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)n1[C@H](C)c1ccccc1 792102726 JCYGEEBEJHNPKZ-KOSHJBKYSA-N 393.490 5.753 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)/C=C\c2ccccc2C#N)c1 798651361 BZMJWNVUKAYDQB-LUAWRHEFSA-N 387.870 5.162 30 20 GKED Cc1ccc(C(=O)OCC(C)(C)CCC#N)cc1NC(=O)Nc1ccccc1 798878357 UWKNTCNMNZILRG-UHFFFAOYSA-N 379.460 5.126 30 20 GKED Cc1cccnc1[C@@H]1CCCC(=NNc2ncnc3sc4c(c23)CCC4)C1 799106158 XHNPHZLREZREDU-CQSZACIVSA-N 377.517 5.009 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(SCc2cccnc2)cc1 799924020 GKOYCULWKAGDNQ-UHFFFAOYSA-N 391.521 5.242 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1Cl)CC1CC1 806402283 ZFPSIARQINDGHA-OAHLLOKOSA-N 383.879 5.075 30 20 GKED N#C[C@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1nc(C2CC2)cs1 842940712 DHIBQOJLUSPRNO-UFUQCMIWSA-N 378.497 5.232 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@H]1CC[C@H](C2CCC2)CC1 850760986 YQKNHTIXOUYFLT-ACRUOGEOSA-N 380.532 5.065 30 20 GKED CCCCOc1ccc(C=NOCc2coc(-c3cccc(F)c3)n2)cc1OC 914571688 CHULEQUJZHJBSL-UHFFFAOYSA-N 398.434 5.219 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(-n3cccc3)cc2)cc1 915086322 SSWMGJALFJTWSA-VWLOTQADSA-N 391.474 5.314 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 915124760 VQDPTQGTYYBOTH-HXUWFJFHSA-N 388.452 5.059 30 20 GKED N#C[C@H](C(=O)c1cc2c(F)cccc2s1)c1nc2cc(Cl)ccc2s1 917046634 LVXMIBCQEUXYDX-LLVKDONJSA-N 386.860 5.794 30 20 GKED CC(C)(C)n1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C1CC1 917119368 AQQCRDVFWHMYBH-OAQYLSRUSA-N 398.510 5.423 30 20 GKED O=C(O)c1cc(F)c(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c(F)c1 1776126602 QOEXUKDNUPWLNY-ZHACJKMWSA-N 380.346 5.351 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)s1 1776339951 SRQSTCWGHJPMMC-XQRVVYSFSA-N 388.485 5.895 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776473412 FNXFQDDZYSUCQV-LAUAKBEESA-N 396.386 5.047 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc(C(C)(C)C)cc2)o1 1776782934 POWSEOOOGORCQK-OAQYLSRUSA-N 399.575 6.538 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(OCc2ccccc2)c1 1776784054 VCLLVQRXEUAUPB-QFIPXVFZSA-N 383.532 5.559 30 20 GKED CCCCCCCCOc1ccc(/C=C2\CCc3occ(C(=O)O)c3C2=O)cc1 1776785467 DCKZWSLNVGQMIE-OBGWFSINSA-N 396.483 5.930 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)oc2ccccc12 1776956188 JLGDIRCPSZUIIA-DTQAZKPQSA-N 396.442 6.257 30 20 GKED Cc1cc(C)c(C#N)c(SCC(=O)Nc2c(C(C)C)cccc2C(C)C)n1 5642323 IXNFFCJULITREF-UHFFFAOYSA-N 381.545 5.548 30 20 GKED C=CCN/C(S)=C(/C(=O)c1cc(C)ccc1C)[n+]1ccc(C(CC)CC)cc1 22687664 YXOVFTQUXSNONC-UHFFFAOYSA-O 395.592 5.209 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1SCc1cccs1 32616105 KDLOUCPJZJEUFI-UHFFFAOYSA-N 378.522 5.184 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(C)c(C)cc2C)nnc1-c1ccoc1C 35767173 URFRQDDERHGVEN-QGZVFWFLSA-N 395.528 5.321 30 20 GKED N#C[C@@H](C(=O)c1cccs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538093 WWLSENHBLGAXCT-NSHDSACASA-N 379.293 5.668 30 20 GKED Cc1oc(C)c(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1C 41548584 BWULSSHXVGTERY-GFCCVEGCSA-N 378.375 5.323 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 47376016 TXIRCXOLXMLIOS-QGZVFWFLSA-N 387.439 5.296 30 20 GKED CSCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 66544815 YKBNWMNARIVLDR-GOSISDBHSA-N 389.505 5.035 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66956266 GLUCLZGVCJTYFF-CABCVRRESA-N 387.936 5.959 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 103330738 NSFUMFZQSFEPKJ-SWLSCSKDSA-N 384.888 5.328 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1ccc(F)cc1Cl 152709966 CWNQODHMPVHEIM-UHFFFAOYSA-N 395.821 5.028 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 160039030 KRTKQHFDPJDBTR-RYRKJORJSA-N 383.517 5.679 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1ccccc1F 161346219 NNCNDUFNKFBBKK-OAQYLSRUSA-N 397.409 5.142 30 20 GKED Cc1nc(C(F)(F)F)c(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)s1 183642606 VVTBBEIJBFTWFJ-LLVKDONJSA-N 386.336 5.393 30 20 GKED CSCCCCCNC(=O)c1ccccc1SCc1ccc(C#N)cc1 186960786 MJMTWJXBCZWCEF-UHFFFAOYSA-N 384.570 5.114 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 190868121 LFWQQVRIWGXQLD-OAHLLOKOSA-N 379.510 5.018 30 20 GKED CCO[C@@H](C)c1nc(CSCc2cc(C#N)ccc2Br)cs1 191607461 ZKOYFVZOJLIUAN-NSHDSACASA-N 397.363 5.308 30 20 GKED CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1SC[C@H](C)C#N 246755454 XSKXWIYMMVFMEQ-HLLBOEOZSA-N 377.579 5.124 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1csc(-c2ccc(Cl)cc2)n1 277991830 UHBQSBOWOGGFKD-XMMPIXPASA-N 380.966 5.432 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 303193109 FYGJOKGDFLQYDF-UHFFFAOYSA-N 389.358 5.078 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2C[C@@H]2c2c(F)cccc2Cl)CC1)C1CC1 330010291 HZCXAGYAELXQGO-TXBNBULBSA-N 378.875 5.217 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(CCCc2ccccc2)cc1 426130282 YRFKZZGRPPEJNO-UHFFFAOYSA-N 387.483 5.403 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc(F)ccc2Cl)cc1 431347890 CZVAJKZLBYIZBW-UHFFFAOYSA-N 394.833 5.376 30 20 GKED N#CCC[C@@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccccc1 440037165 LBMPFDYPACAICW-IAZZRBKQSA-N 390.449 5.297 30 20 GKED COc1ccc(SCCCC(=O)Nc2ccccc2SCCC#N)cc1 444010399 QDMOGILXFXSVJI-UHFFFAOYSA-N 386.542 5.212 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1C 458795930 DJXUCAACQOQELK-PKTZIBPZSA-N 375.516 5.585 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1c(F)cccc1F)C1CC1)c1ccccc1 458812185 CLJZNMHAXYRZGP-NRFANRHFSA-N 383.442 5.074 30 20 GKED COc1cc(CN(C)c2c(C#N)cnc3ccc(Cl)cc23)ccc1SC 462794696 IJKMWMQILKRHRZ-UHFFFAOYSA-N 383.904 5.127 30 20 GKED CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](c1ccc(C)cc1)c1cccnc1 463821285 XXNMXTZAIJMCLO-DVECYGJZSA-N 383.495 5.003 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](c1ccc(OC)cc1C)c1ccccc1Cl 466388328 MQPJONQHBRNPQM-NRFANRHFSA-N 384.907 5.130 30 20 GKED N#CCSc1cccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c1 466883363 FWJJGYYXEBTPBC-UHFFFAOYSA-N 388.895 5.057 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1nc(C(F)(F)F)cs1 467735305 MOIBTKWUOOOEBS-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 469895038 CBOYGMSMVDRMEN-GFCCVEGCSA-N 381.259 5.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccccc1C(F)(F)F 476076848 BSSWAXWBQLDABW-UHFFFAOYSA-N 377.406 5.575 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1sc(C)nc1CC(C)C 476690675 ZQNUAXOLDPRXAH-UHFFFAOYSA-N 389.569 5.038 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(OCc2ccccc2)cc1 476894940 XPZXQPWITFRMOA-QFIPXVFZSA-N 384.479 5.316 30 20 GKED Cc1ccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc1 477825244 NSWWJCVCMTUMTB-UHFFFAOYSA-N 375.403 5.229 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cc(Oc2ccc(F)cc2)ccn1 481898074 AAZPFOKNVTYJOR-DEOSSOPVSA-N 387.458 5.442 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1 485459502 BDVGPLPXTDVEBG-UHFFFAOYSA-N 379.525 5.008 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1ccccc1 488697199 VTNZYULNHHQATO-RXVVDRJESA-N 375.472 5.103 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 490433234 BLXDBIGWKYETTP-QGZVFWFLSA-N 398.413 5.503 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC(c2ccc(Cl)cc2Cl)CC1 491183839 DOMMFZPCSXMKFD-UHFFFAOYSA-N 382.335 5.212 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1Cl 496028918 OTZGSYQKGJFYFP-OAHLLOKOSA-N 382.872 5.271 30 20 GKED CC(C)n1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 497797431 AWPXVVVWNYCQLN-GOSISDBHSA-N 378.863 5.025 30 20 GKED N#Cc1ccc(-n2nccc2NC(=O)c2cc(-c3ccccc3)ccc2Cl)cc1 497929924 MKTZJNIRTZKTSP-UHFFFAOYSA-N 398.853 5.317 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)COc1ccccc1C#N 499755020 WBKJJPTWRLIDGC-UHFFFAOYSA-N 380.513 5.309 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 500239918 YEURIRCGMHPPKR-CQSZACIVSA-N 381.369 5.455 30 20 GKED C[C@@H](NC(=O)N(C)C1CCC(F)(F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 501861638 SGGADTFKDGFREN-MRXNPFEDSA-N 397.469 5.506 30 20 GKED N#Cc1c(NC(=O)c2ccc([C@@H]3CCCOC3)cc2)sc2c1CCCCC2 502566761 CNKZFUCARPCYSX-QGZVFWFLSA-N 380.513 5.035 30 20 GKED CCC[C@H]1C[C@@H](C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 503417891 HFRQCRXIBYSMLV-UGKGYDQZSA-N 396.918 5.340 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(N(C(C)=O)c2ccc(C)cc2)n1 508545031 NVXQFKFUPDRUSK-UHFFFAOYSA-N 391.540 5.324 30 20 GKED CC(C)N(Cc1ccco1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 509246202 KUQFPBHATDHGER-UHFFFAOYSA-N 375.428 5.386 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 509260128 LCEWPIUPJGSSEQ-UHFFFAOYSA-N 395.356 5.452 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 509510099 RRUHSYVDXMZLEH-SFHVURJKSA-N 395.572 5.740 30 20 GKED CCN(C(=O)c1sc(-c2ccc(C)o2)nc1C)[C@H](C)c1ccc(C#N)cc1 509586776 TTYBYGMCEPLDFW-OAHLLOKOSA-N 379.485 5.115 30 20 GKED C=CCC[C@H](NC(=O)N1CCCCC[C@@H]1c1c(C)n[nH]c1C)c1ccccc1 510630653 TXZXGUNTQQFTAM-LEWJYISDSA-N 380.536 5.361 30 20 GKED C[C@@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(C#N)cc1F 512617712 GLORCBYOBPJMJK-MRXNPFEDSA-N 378.422 5.266 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(F)cc([N+](=O)[O-])c1 518280757 MSQXHAGLTNQLIG-UHFFFAOYSA-N 396.218 5.024 30 20 GKED CC[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc(C)cs1 519193069 YIMIFKJMJIXNGC-LJQANCHMSA-N 392.484 5.388 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCC(C)(C)c1ccccc1Cl 520476369 FLXRWJAXAOBXDS-UHFFFAOYSA-N 383.923 5.109 30 20 GKED COc1cc(Cl)ccc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 520682441 NNPYJRCZQCYRFU-UHFFFAOYSA-N 394.883 5.300 30 20 GKED CC(C)(C)c1cccc(OCCCn2cc(C#N)c(=O)c3cc(Cl)ccc32)c1 523108683 AFXRUZUGKFUXCP-UHFFFAOYSA-N 394.902 5.293 30 20 GKED CCN(Cc1ccncc1)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534137638 SIZJEPOMQVGFPA-UHFFFAOYSA-N 391.858 5.061 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1ccc(CC#N)cc1 535367027 WPOIVXFJTYDPSQ-UHFFFAOYSA-N 390.414 5.253 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 535690961 YALLVCPUTNKLMG-UHFFFAOYSA-N 397.931 5.274 30 20 GKED Cc1cc(C)n(-c2ccc(CN[C@@H](C)c3ccc(C#N)cc3)c(C(F)(F)F)c2)n1 538396958 KFTJHLHYCJMGBS-INIZCTEOSA-N 398.432 5.230 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N2CCC(CC#N)CC2)cc1 540994513 WTLSSLBXJDCKIG-UHFFFAOYSA-N 399.878 5.298 30 20 GKED CC[C@@H](CC#N)NC(=O)c1sc2cccc(F)c2c1COc1ccccc1 545157088 YWEKHKOMIRDXDJ-AWEZNQCLSA-N 382.460 5.041 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1sc(C2CCCC2)nc1C 553452209 KQCWLODKYCDHTK-UHFFFAOYSA-N 386.565 5.105 30 20 GKED C[C@H](Nc1cccc(Br)c1C#N)c1nc2ccccc2n1C(F)F 570893751 XAQOCTVIVMAJHC-JTQLQIEISA-N 391.219 5.239 30 20 GKED N#CCCCCCC(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 588677861 DDDIASDWVASJFA-CQSZACIVSA-N 391.231 5.033 30 20 GKED C[C@H](NC(=O)c1sc2ccccc2c1Br)c1cccc(C#N)c1 589437699 AXARVWKAAYTRJZ-NSHDSACASA-N 385.286 5.026 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1ccc2ccccc2n1 589830738 QCGUMLHJPQFFCD-HNNXBMFYSA-N 389.867 5.502 30 20 GKED CC[C@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)[C@H](C#N)c1ccccc1 595292412 XRMQWGFOOBQTGB-HNAYVOBHSA-N 389.421 5.009 30 20 GKED CC(C)(C)[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596243089 GOCMOXLAKJWKLH-PBHICJAKSA-N 381.442 5.128 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)Nc2cccc(OCCCC#N)c2)c1 597077853 ZOMAZEFGNLZWFV-UHFFFAOYSA-N 377.366 5.340 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)N(c2ccc(C#N)cc2)C2CCC2)s1 598886418 SSJONQXGIFVJOL-UHFFFAOYSA-N 393.537 5.180 30 20 GKED Cc1ccc(CCC(=O)N(Cc2ccco2)c2ccccc2C#N)cc1Cl 603533341 SWMIFNISMCSUCE-UHFFFAOYSA-N 378.859 5.279 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)ccc2F)cc1Cl 603673370 MTQPXXMURUZZIF-SFHVURJKSA-N 382.797 5.526 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccccc1 608994734 RVMUBQKSWAIBKR-QGZVFWFLSA-N 386.455 5.013 30 20 GKED N#CCn1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc2ccccc21 609167273 WGHZVCRLCDUSOT-UHFFFAOYSA-N 392.418 5.081 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc(C#N)c1 610323991 MIWPCNCQURSBBY-INIZCTEOSA-N 382.423 5.105 30 20 GKED N#CC1(C(=O)Nc2ccc(COc3ccc(Br)cc3)cc2)CCCC1 610421859 FJJDRAYMKHPVGH-UHFFFAOYSA-N 399.288 5.051 30 20 GKED Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NCc1ccc(C(C)(C)C#N)cc1 614056295 LQONWEGXRVUCHB-SFHVURJKSA-N 389.543 5.280 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1nc(-c2cc3ccccc3o2)cs1 614159905 ZJEZFANHLGNLQD-LJQANCHMSA-N 385.492 5.595 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)cc1 622485432 NNPPMKOZGIYLEU-CYBMUJFWSA-N 397.265 5.676 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cccc(Oc3nccs3)c2)s1 684676036 SOBGLACMZILNDB-AWEZNQCLSA-N 383.498 5.179 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1ccccc1Cl 727628119 HRKJBVGTHUKUIV-QAAVPBIRSA-N 376.843 5.125 30 20 GKED C=C(C)CNC(=S)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 727979943 GLLHEWYBUXBTDW-UHFFFAOYSA-N 380.435 5.147 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3csc(-c4ccsc4)n3)c(C)c2c1 729151311 QYZBHQPWCUFBHD-HYXAFXHYSA-N 381.478 5.831 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1c(F)cccc1F 729877912 DVAURKKKYPPTOQ-VIFPVBQESA-N 394.290 5.502 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417272 LXLFXCQQJQQAOX-DYVFJYSZSA-N 396.487 5.377 30 20 GKED CC(C)COc1ccc(C2(C(=O)[C@H](C#N)c3ccc4ccccc4n3)CCC2)cc1 731768406 IKNOAQWOXVJPEN-JOCHJYFZSA-N 398.506 5.568 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)nc1 731989335 WTOSSKTUZKJFJP-UHFFFAOYSA-N 384.826 5.074 30 20 GKED CC(C)[C@@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 734706444 HTAFQUICAIQDHM-SJORKVTESA-N 387.474 5.850 30 20 GKED CCOc1cc(/C=C2/Cc3cc(Cl)ccc3C2=O)cc(Br)c1O 742437725 QGNDCNJVEYZLTN-XGICHPGQSA-N 393.664 5.029 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](C)c2ccc(C)o2)cc1 742610273 JLSZDFHJJMBTOT-HNNXBMFYSA-N 376.412 5.003 30 20 GKED Cc1ccc(-c2nc(CON=Cc3ccccc3Br)cs2)o1 744180580 UFKZASTZHVEDNP-UHFFFAOYSA-N 377.263 5.025 30 20 GKED COc1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)cc1F 747003870 RGAFJVTTZBGVFI-LGMDPLHJSA-N 389.451 5.868 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)n1[C@H](C)c1ccccc1 747198502 XYFPKISPSGNDOQ-UZLBHIALSA-N 391.540 5.784 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c1 749324182 KSTRCMFCEQHSMP-HNNXBMFYSA-N 391.323 5.025 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(-c4ccccc4F)s3)cc12 750907573 WWMUFZHFXAFKDX-FPLPWBNLSA-N 377.444 5.040 30 20 GKED CC(=O)c1ccc(C#N)cc1N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 754009167 ZEXQUZULEOQZHX-ITGUQSILSA-N 378.316 5.082 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl)C1CC1 754423419 CCLOCTHSEJSSNR-QWHCGFSZSA-N 398.359 5.128 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C/c3ccnc(Cl)c3)cc2)c1 757935826 DUOIFLAOQJRYOO-RUDMXATFSA-N 375.815 5.051 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1ncnc2ccsc12 764842078 XDAFOEHAIVJEAC-UHFFFAOYSA-N 396.907 5.100 30 20 GKED N#C[C@@H](C(=O)CCc1cncc2ccccc12)c1nc2cc(Cl)ccc2s1 765591211 SOORZSPGFRCKPH-KRWDZBQOSA-N 391.883 5.307 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCc3cc(Cl)cc(Cl)c32)c1 772986769 YNZALFYQMXYJQR-APWZRJJASA-N 375.299 5.451 30 20 GKED COc1cccc(C(=O)/C(=C/c2cc(C)c(OC(F)F)c(C)c2)c2ncc[nH]2)c1 776433263 DPYKQAIIVJIDNT-WQRHYEAKSA-N 398.409 5.060 30 20 GKED Cn1cc(CNc2cccc(COc3ccccc3)c2)c(-c2ccc(C#N)cc2)n1 778077227 UUFNXAQRXDHIKH-UHFFFAOYSA-N 394.478 5.150 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC2CC(c3ccc(Br)cc3)C2)c1 786858385 XWWUBROPOJVPTC-LYBXBRPPSA-N 399.332 5.166 30 20 GKED Cc1cc(C)c(N2CC[C@@H](Nc3ccccc3SC[C@@H](C)C#N)C2=O)c(C)c1 788689870 DYELORKDZQEZIQ-OXJNMPFZSA-N 393.556 5.081 30 20 GKED N#CC[C@@H](CC(=O)N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 793830743 NWNIVZCWZYTEJZ-RBUKOAKNSA-N 386.417 5.109 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(F)(F)Cc3ccccc3)n2)cc1 796636115 WESFLQFJPFSLJO-KRWDZBQOSA-N 382.435 5.173 30 20 GKED COc1cc(C2(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)CCC2)ccc1C 797567115 DGAVGSJGYRLVLW-INIZCTEOSA-N 382.529 5.056 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)sc2cccc(F)c12 813210908 BAMZDPOULNKQRZ-LLVKDONJSA-N 378.350 5.253 30 20 GKED Cc1c(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cccc1NC(=O)OC(C)(C)C 861398007 FYXHHOPFXRQSEB-HNNXBMFYSA-N 394.475 5.096 30 20 GKED C=CCOc1cccc(CNc2cc(C(=O)N3CCCCC3)ccc2Cl)c1 864003456 RYIBSIVCJQTLFO-UHFFFAOYSA-N 384.907 5.143 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3c(F)cccc3s2)cc1 915088037 ZLBKDBKABNDYNV-IBGZPJMESA-N 386.451 5.948 30 20 GKED CCOc1cccc(/C=N\[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1O 915271334 UGQMMZPOBDQSCC-WZGIJCTISA-N 388.467 5.223 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCCc2ccccc2)cc1 915351994 FFLVFCOTPLYQCJ-DEOSSOPVSA-N 383.495 5.486 30 20 GKED Cc1ncsc1C(=O)/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1 915988509 YLFZTZSYBBBWTR-YHYXMXQVSA-N 382.872 5.253 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(C=NNc2ccccc2Cl)cs1 917532265 GQVNLWQZPONTRG-UHFFFAOYSA-N 388.855 5.066 30 20 GKED CCO[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805642 OKGKXOKTSFGOMP-VBKZILBWSA-N 398.434 5.042 30 20 GKED Cc1c(NN=C/C=C/c2ccc(OCc3ccccc3)cc2)cccc1C(=O)O 1776088376 IGYCIKLQJMBWCI-MZFZBOHFSA-N 386.451 5.383 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2F)c1)C(=O)O 1776470771 HLQNOYGQBMWHAF-CFYYFVFUSA-N 396.439 5.302 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)[C@H]2CCc3ccccc32)cc1 1776787909 DNFZXLNIKNVWOP-ZEQRLZLVSA-N 395.543 5.309 30 20 GKED C=CCC(CC=C)C(=O)NC1(c2ccc(NC(=O)CC3CCC3)cc2)CCC1 1792266817 ICXOXTCNRGHIRD-UHFFFAOYSA-N 380.532 5.079 30 20 GKED C=CCN(C(=O)c1cc(SC)ccc1Cl)c1nc2c(s1)CCCC2 23656551 WUBGAKKGEMYLOW-UHFFFAOYSA-N 378.950 5.230 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1 33224033 OOEYCYWGRKOLAE-MRXNPFEDSA-N 376.481 5.032 30 20 GKED COc1cc(C#N)ccc1OCCCC(=O)Nc1c(C(C)C)cccc1C(C)C 42194769 ZIRVDBIYGQWIGK-UHFFFAOYSA-N 394.515 5.611 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)(C)C)cc3)n2)cc1 60043684 KWIOTDPTEYCCGS-LJQANCHMSA-N 390.508 5.606 30 20 GKED CCC(C)(C)[C@@H]1CCc2nc3ccccc3c(C(=O)N3CCC(C#N)CC3)c2C1 61585065 GFZSBKUKERITGV-GOSISDBHSA-N 389.543 5.152 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 103329386 NKDSBXOWBXXCOO-SJORKVTESA-N 398.384 5.104 30 20 GKED N#Cc1ccc(F)c(COC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)c1 105387538 ADLBVGYXFODTIO-UHFFFAOYSA-N 387.410 5.071 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Nc1cccc(OCCCC#N)c1 120604600 DJWFANUGMLMMAI-GOSISDBHSA-N 379.504 5.240 30 20 GKED Cc1cccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1Br 120707045 NKGDWEDTEDXQTJ-AEFFLSMTSA-N 398.304 5.061 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1 151040904 LYTJSALHHCHTHR-IBGZPJMESA-N 392.418 5.025 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Nc3cccc4ccccc34)n2)cc1 155642413 PDHSPWWTAKEMIW-LJQANCHMSA-N 399.475 5.218 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](Cc2ccccc2)C1 173123955 UBBHZMDWHSSNPT-MJGOQNOKSA-N 379.529 5.177 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1c(F)cccc1F 182862391 ZEXZUWNYBJYYIT-ZDUSSCGKSA-N 392.496 5.231 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccc2ncccc2c1 193958489 JGCMQUGBVHLAER-UHFFFAOYSA-N 395.487 5.188 30 20 GKED C[C@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 194626670 VVCYWUHEDYREPT-CYBMUJFWSA-N 384.888 5.410 30 20 GKED N#Cc1c(Cl)nsc1NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2 302192933 CFQRIXBXGFVKPT-LBPRGKRZSA-N 386.933 5.009 30 20 GKED COc1ccc(N=C(O)N2CCC[C@@H](C3CC3)C2)cc1N=C(O)C1CCCCC1 329580749 UWAPICSUYGNIJH-GOSISDBHSA-N 399.535 5.531 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1/C(O)=N/[C@@H](c1ccc(F)cc1)C1CCC1 330280561 SOZZMVYRGTYUSE-VQTJNVASSA-N 384.499 5.025 30 20 GKED Cc1c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cccc1OCC(F)(F)F 425650154 LADSVZBAJAYTOR-CQSZACIVSA-N 391.393 5.033 30 20 GKED C=CC[C@@H](C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 427115525 BSKWEIHQOKVCON-HSZRJFAPSA-N 399.494 5.307 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 429689589 GBONBMALDNBEAV-QGZVFWFLSA-N 393.418 5.284 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc(SCC#N)c1 429953539 XFJZOIGBEQUFFC-UHFFFAOYSA-N 392.446 5.372 30 20 GKED CCN(C(=O)Nc1cccc(C#N)c1C)[C@H](C)c1cccc(C(F)(F)F)c1 431712449 SBCYQEATMXRKCO-CQSZACIVSA-N 375.394 5.501 30 20 GKED C[C@@H](CCC(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 437033902 HEEIYXLBABKUJY-JOYOIKCWSA-N 381.282 6.020 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H](Cc3ccc(OC)cc3)C2)c1 438133355 CHMVLSSEYCGMAL-FQEVSTJZSA-N 394.515 5.137 30 20 GKED C=CCN(C(=O)[C@@H]1SCCc2ccccc21)c1nc(-c2ccccc2)cs1 443814859 JXHMTVUQOBYOGX-HXUWFJFHSA-N 392.549 5.360 30 20 GKED CC(C)Cn1cc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)cn1 464374524 LPTHITOZXADACZ-UHFFFAOYSA-N 394.862 5.109 30 20 GKED Cc1ccc2c(CCC(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)c[nH]c2c1 465122232 ORXUESJAFUXCNK-GOSISDBHSA-N 386.282 5.097 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466250142 OHVUYNSGBNNOCB-FQEVSTJZSA-N 390.499 5.384 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)c1cc(-c2cccc(C#N)c2)no1 469117626 JTUFNPUCIUSKSS-UHFFFAOYSA-N 389.455 5.171 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 475413698 XOUZJDWPOXICIB-XUTJKUGGSA-N 381.907 5.079 30 20 GKED N#CC[C@H](CC(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21)c1ccccc1 475447210 USTPLBLVBBQSIU-QPPBQGQZSA-N 396.490 5.381 30 20 GKED Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C[C@H](CC#N)c1ccccc1 475597986 BBAPMBSFKVZJGB-GMAHTHKFSA-N 398.510 5.143 30 20 GKED Cc1cc(C)c(-c2nnc(SCCCOc3cccc(C#N)c3)o2)c(C)c1 477541724 ZNXVYQJJFOGKHS-UHFFFAOYSA-N 379.485 5.095 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc2ccccc12 480321755 VXKIKOSDERCGCJ-IBGZPJMESA-N 385.511 5.640 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1ccccc1C 481390592 ZETAIXGQSWOPSN-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC[C@H](C)CN(CC)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 483447950 UZEKZGRNVPNNNA-SFHVURJKSA-N 379.504 5.232 30 20 GKED C=CCn1c(SCc2ccc(F)c(C#N)c2)nnc1-c1cccc(Cl)c1 489637257 UHGVRBFOQPKGKA-UHFFFAOYSA-N 384.867 5.088 30 20 GKED N#Cc1cc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)ccc1Cl 494665577 NHAPBOJMXLUVGB-UHFFFAOYSA-N 386.238 5.091 30 20 GKED Cc1ccc(NC(=O)[C@@H](Sc2ccc(C#N)cn2)c2ccccc2)cc1Cl 498163799 SAIHRHJWOIXWEU-FQEVSTJZSA-N 393.899 5.387 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)cc1 502276266 NDJICWMXSMSAMV-HNNXBMFYSA-N 399.416 5.137 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCC(F)(F)C1 503663903 SVEBBUOXTJANRH-SFHVURJKSA-N 386.417 5.365 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCSc2ccccc21 504093423 GPAYHUZPLNXXHH-HNNXBMFYSA-N 378.950 5.336 30 20 GKED C=CCCc1ccccc1NC(=O)N(CCc1ccccc1)Cc1cccnc1 505035668 OVRFPJNKKQCGHL-UHFFFAOYSA-N 385.511 5.477 30 20 GKED Cc1ccnc2sc(C(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)c(C)c12 505533942 TXFQCZKRJPZQFW-ZDUSSCGKSA-N 390.295 5.215 30 20 GKED CC(C)C[C@@H](NC(=O)N1CCC(C)(C#N)CC1)c1cccc(C(F)(F)F)c1 508465494 HPEFNXYDKBDEKD-QGZVFWFLSA-N 381.442 5.128 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccccc1Nc1cccc(C(F)(F)F)c1 509722164 PLUFZEQGZADFTE-CQSZACIVSA-N 375.394 5.071 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@@H]3CCC[C@@H]3c3ccccc3C(F)(F)F)CC2)c1 509992881 QRODNVUKXPSKFC-UYAOXDASSA-N 398.428 5.061 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1cccs1 510663069 MHAWRDTWOQRFQT-IBGZPJMESA-N 391.496 5.993 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2F)cc1Cl 515131440 VQMKRYJJNUFTCO-SFHVURJKSA-N 399.252 6.040 30 20 GKED N#C[C@@H](C(=O)c1sccc1C1CC1)c1nc(-c2c(F)cccc2F)cs1 521552216 MRWGEVCBQWSMQZ-LBPRGKRZSA-N 386.448 5.517 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)cc1 521752603 BIAIYOHRKLDDMF-DNQXCXABSA-N 384.479 5.289 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccc(F)cc1F 522181823 AEKKKEGFRIOJTM-UHFFFAOYSA-N 399.210 5.087 30 20 GKED Cc1sc(NC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)c(C#N)c1C 525003910 JMAJYKKPWYBMQV-UHFFFAOYSA-N 394.500 5.128 30 20 GKED N#Cc1ccc(C2(NCc3ccc(-c4ccccc4F)s3)CCOCC2)cc1 527809703 FDTUTZIYTBYFIH-UHFFFAOYSA-N 392.499 5.221 30 20 GKED CCN(C(=O)c1ccc(CC#N)cc1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 535397587 DEHFSNGDLVODBV-QFIPXVFZSA-N 389.886 5.053 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)Nc1ccc(C(C)(C)C#N)cc1 537577030 DNGZOQYRZFFFMP-UHFFFAOYSA-N 391.696 5.464 30 20 GKED C=CCSc1ccccc1NC(=O)CN[C@@H](CC(F)(F)F)c1ccccc1 538176252 IWBGEPCFUWZFKZ-KRWDZBQOSA-N 394.462 5.187 30 20 GKED CCOc1ccc(Oc2ccc(NCCCC3(C#N)CCOCC3)cc2)cc1 539711251 JSLDUDDXPFPWBD-UHFFFAOYSA-N 380.488 5.390 30 20 GKED CC[C@@H](C)[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 540386451 SULHVWNKPBNABT-JLTOFOAXSA-N 380.879 5.139 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CSc1cccc(Cl)c1C#N 541172820 HKOGKQSYDVFJBG-ZDUSSCGKSA-N 384.888 5.270 30 20 GKED FC(F)(F)c1cc([C@H](NCc2ccon2)C(F)(F)F)cc(C(F)(F)F)c1 543980972 VZEVBOYBUQAXFB-NSHDSACASA-N 392.221 5.105 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3ccccc3SCCC#N)ccc2c1 545313512 GTAWOSYKQKCZKB-INIZCTEOSA-N 390.508 5.596 30 20 GKED Cc1ccccc1[C@@H](c1noc(-c2cnc(C(F)(F)F)c(C#N)c2)n1)C(C)C 569795324 KYFZVWBGNYQXFC-INIZCTEOSA-N 386.377 5.118 30 20 GKED C[C@H](N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1cccc(C#N)c1 571558897 GKCZSIMFYRIQQO-RNODOKPDSA-N 394.316 5.530 30 20 GKED Cc1oc(C#N)cc1C(=O)N1CC[C@@H](C)Sc2ccc(C(F)(F)F)cc21 574234561 ZDYGWCIHFGJSJL-SNVBAGLBSA-N 380.391 5.010 30 20 GKED C[C@@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 574308609 ICGWADDIUGILTD-VQIMIIECSA-N 377.488 5.032 30 20 GKED N#CCCN(C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(F)cc1 583803374 NNHOBJNDIRKMSQ-UHFFFAOYSA-N 395.437 5.601 30 20 GKED CSCc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)oc2ccccc12 589795026 SSDDJHXZCUTRGN-ZDUSSCGKSA-N 390.386 5.200 30 20 GKED CS[C@@H](C)CC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 592678815 GBQURZOJBZTETR-QMMMGPOBSA-N 377.325 5.056 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)CSc1ccccc1 593157138 GFNLQNDZWYMZGI-SJORKVTESA-N 399.585 5.725 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)c1ccccc1 594892576 AYAADUWAQLWPSR-LJQANCHMSA-N 375.501 5.202 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 597036968 HAYXQGQBABNDOH-AWEZNQCLSA-N 398.322 5.034 30 20 GKED N#CCCN(C(=O)c1cc(C(F)F)ccc1F)C12CC3CC(CC(C3)C1)C2 598827820 NHPWGXMPEMIQMO-UHFFFAOYSA-N 376.422 5.088 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1ccc(OC(F)F)cc1 603968640 HDUCOHOJFXQSFM-UHFFFAOYSA-N 398.434 5.459 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nnc(-c2ccc(F)cc2)c2ccccc12 604035667 INLTUNYERZVETE-IBGZPJMESA-N 385.467 5.663 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 604099019 DMHDALASJFKGMF-VWLOTQADSA-N 395.506 5.029 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 608917860 XIMQVZNQRNRSHK-NRFANRHFSA-N 381.907 5.283 30 20 GKED CC(C)CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)C1CCCC1 609056580 PLYSNHURHUTADP-UHFFFAOYSA-N 380.488 5.161 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(OCc2ccccc2C#N)cc1 609647418 NAFLIKFXJSJVJU-DVECYGJZSA-N 396.490 5.155 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2cc(C#N)ccc2OC(C)C)C1 610016244 KDDJFLVLTLLHKQ-PKOBYXMFSA-N 377.488 5.064 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361797 BTLYZMNOBHDYND-HKUYNNGSSA-N 381.442 5.128 30 20 GKED CON=Cc1ccc(C(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 726777818 VRFUWWBLLHGWIT-IBGZPJMESA-N 390.405 5.053 30 20 GKED Cc1cc2c(c(C)c1Cl)C(=O)/C(=C\c1csc(-c3ccccn3)n1)CO2 727780642 QZCUEBYAVFKDAW-JYRVWZFOSA-N 382.872 5.134 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417813 SUDNNVKRJMNZRO-SMDDNHRTSA-N 388.851 5.041 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)c1 733799741 DVNHEPCHDQIOCZ-TZIWHRDSSA-N 399.922 5.217 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@H](C)c1ccc(C)o1 733804874 KPBNXWLZPHXXAL-QUCCMNQESA-N 397.519 5.342 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@]3(C#N)CCC[C@@H](C)C3)cs2)cc1 735056983 AOWRTXPAXCGMGC-OPAMFIHVSA-N 381.545 5.065 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1c(Cl)nc2ccccn12 737446378 RPRCAGCXCPJJMX-CMDGGOBGSA-N 383.835 5.146 30 20 GKED CCOc1cccc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 745267858 AKGQDTVQGKBHQY-KOSHJBKYSA-N 399.494 5.623 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 747072798 KEGPEXMAVCTPLV-NRFANRHFSA-N 393.462 5.107 30 20 GKED Cc1ccsc1[C@@H]1C[C@@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 748833482 CRQNPUWNLRQCAH-ARFHVFGLSA-N 398.940 5.813 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)Nc1ccccc1C 749103418 YGKZKEPTJZDPIT-UHFFFAOYSA-N 393.325 5.282 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc3ccc(F)cc3c2)cc1 758409838 MZOFJCQNTASVPE-JOCHJYFZSA-N 381.410 5.282 30 20 GKED CC(C)(C)n1cc(CNc2cccc(OCC#N)c2)c(-c2ccccc2Cl)n1 779586258 RAHHQYLGPLLMSF-UHFFFAOYSA-N 394.906 5.473 30 20 GKED N#C[C@@H](C(=O)C1c2ccccc2Oc2ccccc21)c1ccc2ccccc2n1 781755262 RLAFTVAYXLSGHY-LJQANCHMSA-N 376.415 5.349 30 20 GKED CC(C)(C#N)CCCOC(=O)c1ccsc1NC(=O)c1ccccc1Cl 783531527 VXWYYPZJNNLOFV-UHFFFAOYSA-N 390.892 5.141 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(-c3ccco3)cc2F)c1 786500409 PKOZVTWFHQUGED-KRWDZBQOSA-N 393.418 5.088 30 20 GKED CCSCc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 789896068 HXNCHFNUKCXIKK-HSZRJFAPSA-N 386.520 5.847 30 20 GKED Cc1sc2ncn(N=Cc3ccc(C(F)F)cc3)c(=O)c2c1-c1ccccc1 794474223 IUDGJYYNBUXMJH-UHFFFAOYSA-N 395.434 5.253 30 20 GKED C=CC[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccncc1 799634366 VWDBNJWUGJMWOG-QGZVFWFLSA-N 386.282 5.431 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)CC1 809089223 VDAXHUIFQGFIBH-TXEJJXNPSA-N 395.311 5.604 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813214789 DOESSAPHVVVGSY-CMPLNLGQSA-N 384.810 5.111 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1nc(C2CC2)cs1 842942044 MFULXUGPBQPTLG-IBGZPJMESA-N 380.513 5.151 30 20 GKED C=CCOc1cc(OC)ccc1-c1nc(-c2c(Cl)cccc2Cl)no1 904309807 JBMLKLLRDFGPFR-UHFFFAOYSA-N 377.227 5.284 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915180233 MGUBKPVWDTWRGD-QFIPXVFZSA-N 386.520 6.095 30 20 GKED COc1ccc(CC(C)=NNc2nc(Cl)c(Cl)cc2Cl)cc1OC 916319545 YQRACPPQRXQMRM-UHFFFAOYSA-N 388.682 5.090 30 20 GKED Cc1ccc(OCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c(C)c1 917026612 JOAMKCOKPWMVKN-GOSISDBHSA-N 376.481 5.072 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)c3ccccc3SCC#N)CC2)cc1 918608369 FIYJGNVXIDRGLT-UHFFFAOYSA-N 394.540 5.109 30 20 GKED Cc1c(NN=C2CCCC[C@@H]2c2cc(F)c(F)c(F)c2)cccc1C(=O)O 1776089204 HDUKXXYPKKHTBO-CQSZACIVSA-N 376.378 5.236 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3ccc4c(c3)CCCC4)cc2)c1 1776113295 FIOOBVZPNFMFMA-GDNBJRDFSA-N 396.486 5.756 30 20 GKED CC(C)(C)[C@H]1C/C(=C\c2cccc(C#N)n2)c2nc3ccccc3c(C(=O)O)c2C1 1776121621 PGNQQKFCECWTLV-STTHAQSSSA-N 397.478 5.349 30 20 GKED C=C(C)COc1cc(CNc2cc(C(=O)O)c3ccccc3c2)ccc1OC 1776140726 KVQHEIJBCHMCSV-UHFFFAOYSA-N 377.440 5.114 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(Cl)c1C(F)(F)F 1776784133 YYNUTXUEZBPUAG-CQSZACIVSA-N 379.850 5.652 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(F)c(C(=O)O)c3)s2)cc1 1777430607 QGGLSCNPXMXOIH-UXBLZVDNSA-N 381.428 5.160 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C\c1ccc(OCc3occc3C(=O)O)cc1)C2=O 1777455891 KFEDXECVXYGHMN-SLDJAQPHSA-N 388.419 5.249 30 20 GKED O=C(/C=C\c1cc2c(Br)cccc2s1)c1csc(C(=O)O)c1 1777569476 YTZGUZHTMAEEMA-PLNGDYQASA-N 393.283 5.320 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)c1 1777686114 LLGUNHSXZDHIDK-VQHVLOKHSA-N 386.325 5.560 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2cccc(Cl)c2)[n+]2ccccc2)c1 14872139 PODNSYOUPFHUJM-UHFFFAOYSA-O 395.935 5.241 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2)CCCC1)c1nc2ccccc2n1C(F)F 51655721 LDAYNERAZVKBPI-MRXNPFEDSA-N 397.400 5.259 30 20 GKED COc1cc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)ccc1OC(F)F 60370906 PQPDUTCYLKCNPO-CSKARUKUSA-N 387.407 5.316 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1 90665068 BHYQVSUGWAZLQY-PGRDOPGGSA-N 378.520 5.256 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc3ccccc3n2)cc1Cl 107648410 OEMLWYGXNJCSJI-SFHVURJKSA-N 398.853 5.191 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Oc1cccnc1 108237277 AHBSOHQFBMDILO-INIZCTEOSA-N 389.480 5.378 30 20 GKED Cc1cccc([C@@H]2CCCN2CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108360416 DJSAKHNFLBWTEP-RXVVDRJESA-N 393.556 5.022 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 112738205 DUZZAISTMHAHFF-UTKZUKDTSA-N 381.545 5.799 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2c(C)oc(-n3cccc3)c2C#N)c(C)c1 116272557 IGAQXTFYZNCMLD-HNNXBMFYSA-N 393.512 5.702 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 124426964 HRKJVTKFEWODOV-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 151813484 YKZXRMPRSMUATR-NRFANRHFSA-N 382.460 5.286 30 20 GKED C[C@H](N[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 152806243 VOTHXRLHPQODCG-QWHCGFSZSA-N 386.282 5.932 30 20 GKED CC(C)(CCC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 155263870 IJTIRXWKUPDLLP-FQEVSTJZSA-N 399.519 5.616 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(OC(C)(C)C)cc2)ccc1OC 157252767 CXBFBWFZOMWVNO-FXAWDEMLSA-N 396.531 5.404 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)C(=O)N1CCC[C@H]1c1cccs1 163310502 SZZHQTLPRHSEKB-WFASDCNBSA-N 376.934 5.117 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](CCC#N)c1ccccc1 181571685 DQMVCELKPBMSQL-MGPUTAFESA-N 379.504 5.953 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](CCC#N)c3ccccc3)s2)cc1 181576865 KHOSLBGTCFHYDR-IERDGZPVSA-N 391.540 5.823 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 184076698 CZNOLQJYUYAVKJ-ZWKOTPCHSA-N 392.503 5.309 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 188064383 CWFSLPKSQDGRHB-QGZVFWFLSA-N 386.536 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cc(OC)c(OC)c(OC)c1 189909575 AAIVJUFISQZKMG-UHFFFAOYSA-N 397.515 5.136 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(CN(C)C(=O)OC)cc1 191429272 BRFVQCSWVHFKHV-UHFFFAOYSA-N 395.503 5.381 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)c(C)n1[C@@H](C)c1ccccc1 195659013 KLCFEHBDCKBLBV-OXJNMPFZSA-N 382.467 5.081 30 20 GKED COc1ccccc1C(C)(C)NCc1cccc(OCc2cccc(C#N)c2)c1 237107625 VBECHOYYEPSSNQ-UHFFFAOYSA-N 386.495 5.171 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCCCC2(C#N)CCOCC2)cc1 282014236 ORFPTNQZBDZNRY-LJQANCHMSA-N 378.516 5.113 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)n2C)cc1 303677115 HZFSJBSKRRBHPZ-INIZCTEOSA-N 391.544 5.053 30 20 GKED CC[C@@H]1C[C@@H](C(O)=Nc2cc(Cl)ccc2OC[C@H]2CCCCO2)CC(O)=N1 330271548 WCHVGTSRXCMVPL-FVQBIDKESA-N 394.899 5.021 30 20 GKED Cc1nc2ccccc2n1C1CCN(C(O)=Nc2cccc3c2CCCC3)CC1 330302555 OLEMXOYSGZLAIV-UHFFFAOYSA-N 388.515 5.106 30 20 GKED CC(C)(C#N)Cc1nc(C2(c3ccc(Br)c(Cl)c3)CCC2)no1 426594437 FPACLQPYFMWQBV-UHFFFAOYSA-N 394.700 5.048 30 20 GKED C=CCn1c(S[C@@H]2CC[C@@H](C#N)C2)nc2scc(-c3cccs3)c2c1=O 430090244 PVPPIJYFZBDESN-CHWSQXEVSA-N 399.566 5.157 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cc12 430612887 UPHODUACUDFZTI-GFCCVEGCSA-N 386.546 5.002 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc2c(c1)COC2 431541634 ICNRPQSOUKANQP-UHFFFAOYSA-N 399.450 5.011 30 20 GKED Cc1nsc(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 432007899 OKXHOFVBMDNDPM-KRWDZBQOSA-N 381.888 5.321 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(COC2CCCC2)cc1)c1ccccc1 432952857 AXWPSVKRCDDTAP-HSZRJFAPSA-N 391.515 5.702 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 437039809 NTBPXALJTBBRGM-SJCJKPOMSA-N 386.339 5.921 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(C(C)C)CC1 437836585 CWDBVAVNPIZJQX-UHFFFAOYSA-N 377.488 5.559 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1 438200844 KHSBQWZKXNBMSO-INIZCTEOSA-N 385.467 5.478 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)c(Oc2cc(C)ccn2)c1 438680438 ABVVGLRBBNWIMN-UHFFFAOYSA-N 387.483 5.711 30 20 GKED COc1cc(-c2noc([C@@H](C)c3cccc(C#N)c3)n2)cc(Cl)c1OC(C)C 462828317 ZUXSZYRNGKDRTM-ZDUSSCGKSA-N 397.862 5.209 30 20 GKED CC(C)c1scnc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 463593572 URLICFNRPFZERA-KRWDZBQOSA-N 395.915 5.828 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3cc(F)ccc3C#N)C2)nc2ccccc21 469340642 ZBHKEKSMMDTAHH-SFHVURJKSA-N 376.479 5.008 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(CN2CCCCCC2)cc1)c1ccccc1 475320375 PTHOPPFZIHAFJF-JOCHJYFZSA-N 375.516 5.089 30 20 GKED CN(Cc1cccs1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481690249 VKDFVBWDIPZNDS-UHFFFAOYSA-N 395.459 5.002 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Br)ccc2o1)c1nccc2ccccc12 483216033 SOOIYOMEJSGMHN-MRXNPFEDSA-N 391.224 5.234 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2c(F)cccc2F)c1)c1nccc2ccccc12 483223159 ASXLSADQEVSIAV-IBGZPJMESA-N 384.385 5.670 30 20 GKED N#CC1(F)CCN(C(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)CC1 483819683 RFPLQVZOGWKSBK-UHFFFAOYSA-N 392.261 5.520 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@]1(c1ccccc1)C(F)(F)F)c1ccccc1 484143203 MBQVZACUNCRIND-WIYYLYMNSA-N 386.417 5.154 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@](C)(Cc1ccccc1)[C@H](C)O 484658048 WFSDZHXLBHJLHA-DFBJGRDBSA-N 394.559 5.290 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1csc(-c2ccc(OCC)cc2)n1 493701726 LQUDPICCKSFAQL-UHFFFAOYSA-N 384.526 5.099 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(C(F)F)ccc1Cl 497398764 AGTRRGGRUJPHTM-UHFFFAOYSA-N 375.806 5.369 30 20 GKED CCCN(CCc1cccc(F)c1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 503227577 WNQOOEUWEIKTEB-KRWDZBQOSA-N 399.535 5.564 30 20 GKED N#CCCN(Cc1cccc(NC(=O)c2ccc(Cl)cc2)c1)Cc1ccco1 505779206 YXCPWNUDCVAVFO-UHFFFAOYSA-N 393.874 5.101 30 20 GKED CCN(C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1)c1ccc(C#N)cc1 510397642 QLQHTUZOTZWKFJ-UHFFFAOYSA-N 391.496 5.136 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F 510451958 OBBLNUIWXHDYAB-KRWDZBQOSA-N 398.375 5.482 30 20 GKED Cc1nc(NC(=O)C2(c3cccc(F)c3)CCCCC2)sc1SCC#N 512185380 JIPLPWFILOYZNN-UHFFFAOYSA-N 389.521 5.047 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(OC(F)F)cc2)nnc1-c1ccco1 513329488 NWZOVYQQBANLEF-GFCCVEGCSA-N 377.416 5.179 30 20 GKED CCCc1ccc([C@H](NC(=O)Nc2ccc(CC#N)cc2)c2cccs2)cc1 515219461 SQZCIPGQWODYBV-QFIPXVFZSA-N 389.524 5.678 30 20 GKED N#C[C@H](NC(=O)c1ccnc(Oc2ccccc2)c1)c1cccc(Cl)c1Cl 518207370 GLOYIAUTNNQJBN-KRWDZBQOSA-N 398.249 5.175 30 20 GKED CC(C)CCOCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 519261904 GBNALDMYOQATPQ-FQEVSTJZSA-N 399.922 5.180 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 520476000 WOXPFHSZPJSFHV-FQEVSTJZSA-N 379.504 5.093 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccccc1SC[C@H](C)C#N 520826159 BZRKZCWMINEPMZ-SJLPKXTDSA-N 394.540 5.396 30 20 GKED C[C@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1)C(C)(C)C 523715828 ZYQCZAKYPLNFMI-LLVKDONJSA-N 395.450 5.245 30 20 GKED N#C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C1CCCCC1 524534321 NJIMEVGMLMAIOE-NRFANRHFSA-N 389.524 5.009 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 531444295 KOHHAKVKNLGJBG-NYVOZVTQSA-N 391.515 5.016 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl 540470751 GPSMELWQDGCAAN-WMZOPIPTSA-N 392.808 5.271 30 20 GKED COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 544236246 FZTNSXSNKMEEKG-IIBYNOLFSA-N 377.488 5.111 30 20 GKED C=CCC[C@H](NC(=O)[C@H]1CCCc2cccnc21)c1ccc(C(F)(F)F)cc1 551611221 XBVPIUCUJJOTFQ-OALUTQOASA-N 388.433 5.344 30 20 GKED N#Cc1cccc(-c2nnc(CN3CC4(CCCCC4)[C@H]3c3ccccc3)o2)c1 565702610 DIDJTRRJCIBNIA-JOCHJYFZSA-N 384.483 5.116 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cn1)c1ccccc1 571972198 DXPVNFGTORSUQL-VGOFRKELSA-N 393.446 5.260 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N1CCC[C@H](CC#N)C1 596803932 WMEHMGGHRNQCTJ-QGZVFWFLSA-N 395.528 5.145 30 20 GKED C=CCOc1ccccc1CNC(=O)c1occc1CSc1ccccc1 599813355 WDBYCMIMYQDPKC-UHFFFAOYSA-N 379.481 5.067 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)c1ccccc1 602113967 SRBNHUQLUIYQHU-QGZVFWFLSA-N 384.435 5.198 30 20 GKED COc1ccc2oc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c(C)c2c1 602756709 YUYPMLXGXXMIET-NSHDSACASA-N 380.469 5.060 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccccc3C(F)(F)F)cn2)c1 603621679 OJWGHPAAUJCIPQ-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056588 QBEVMKARYGLJNT-JOCHJYFZSA-N 388.467 5.344 30 20 GKED C[C@H]1Cc2ccccc2N1Cc1occc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 609316888 UOQHTAHHZOFURY-KRWDZBQOSA-N 399.494 5.284 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCSc1ccc(Cl)cc1 609376632 FOXZPARCQCSPEF-CQSZACIVSA-N 390.961 5.713 30 20 GKED COc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1SC[C@H](C)C#N 609398407 YVUZIEZZUVWADU-MRXNPFEDSA-N 397.544 5.046 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 609808796 HPEVMIYXIODJNS-UHFFFAOYSA-N 390.487 5.441 30 20 GKED C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610584079 ZMJWLGIBVKUALK-VGOFRKELSA-N 398.466 5.155 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1sc(-c2ccccc2)nc1C(F)F 611186452 MLOOBQUCMJPCHG-UHFFFAOYSA-N 377.460 5.340 30 20 GKED COc1ccc([C@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccccc2OC)cc1 611394728 ZCFHJVBMHKXWHR-RSXGOPAZSA-N 398.506 5.332 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc(-c2ccccc2)nc1C(F)F 615926909 CECKYINPAFDXCL-UHFFFAOYSA-N 377.460 5.292 30 20 GKED C=CCC[C@H](NC(=O)NCCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 676723662 BKKUZADQQMQYBC-INIZCTEOSA-N 397.466 5.020 30 20 GKED N#Cc1ccc(SCC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1 728521790 HJDAORFBWVWADV-GOSISDBHSA-N 390.430 5.033 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)cn1 728820024 UQQQXVPMUQWAMM-LBPRGKRZSA-N 378.419 5.225 30 20 GKED Fc1ccc(NC(=S)Nc2ccc(C(F)(F)C(F)(F)F)cc2)c(F)c1 729821571 PAKHVZNZWOUYEC-UHFFFAOYSA-N 382.304 5.428 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(F)(F)c1cccc(Cl)c1 730990547 ZIKSVVXAXQFDQI-GFCCVEGCSA-N 380.847 5.322 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccccc3)[nH]2)cc1 732495915 KQAKBCKYNPMWPG-JXFKEZNVSA-N 385.467 5.156 30 20 GKED Cn1cc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc21 733082987 ACWUJBXAYVUFNA-MDZDMXLPSA-N 389.436 5.106 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1nc2ccccc2s1 734223431 OCLJWGVEHBWWJK-LBPRGKRZSA-N 391.949 5.470 30 20 GKED C=CC[C@H](NC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1ccncc1 734680186 NRDCFHPFGLNDRH-DEOSSOPVSA-N 383.495 5.351 30 20 GKED CC(C)(C)C[C@@H](NC(=O)Cc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 741589349 KIAKVGAKHDZZBO-HXUWFJFHSA-N 384.907 5.079 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@@H]2Cc2ccccc2)cc1 743096042 OAIFXDYWYBLJMA-QPTUXGOLSA-N 381.479 5.095 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 749379298 LUUNGAVAEBWLOQ-UHFFFAOYSA-N 399.425 5.190 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C(C)=C/c2ccc(F)cc2)cc1 750685961 AAWQMPDACVTPTJ-ZCVWUUOSSA-N 378.447 5.090 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(Cl)c(C(F)(F)F)c1 754690376 SQCDSCHWEWJZQB-ALCCZGGFSA-N 394.805 5.773 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2SCC#N)c(O[C@H](C)CC(C)C)c1 758652900 JFWPEYYPXTTWSQ-GOSISDBHSA-N 396.556 5.354 30 20 GKED C=C[C@H](CC(=O)O[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 758909957 DRYRWSVWCXDKQK-DLBZAZTESA-N 385.891 5.187 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)Cc2ccccc21 759912956 WKNZSDXRGQSNKV-HSZRJFAPSA-N 395.506 5.667 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2sc(-c3cccnc3)nc2C)c1 772984261 PGERKHFJEPNLKO-KXBFYZLASA-N 392.528 5.045 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1csc(-c2cccc3ccccc23)n1 780170599 YGMHONPMXFHUCV-OAHLLOKOSA-N 399.475 5.506 30 20 GKED C#CCCCCCC(=O)O[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 780254961 KNTHBHKIUKBKBN-GFCCVEGCSA-N 381.259 5.231 30 20 GKED N#CC1(CCCNc2ccccc2NC23CC4CC(CC(C4)C2)C3)CCOCC1 798388182 QDTIYLDTDMXJKM-UHFFFAOYSA-N 393.575 5.580 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 802706944 BOSIQGUEDKKXMH-JIIJFUIFSA-N 395.505 5.188 30 20 GKED CCc1cc2oc(=O)cc(CN[C@@H](CCCC#N)c3ccccc3)c2cc1Cl 814660087 ROEJIZAAIINJPO-NRFANRHFSA-N 394.902 5.534 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCCC2(F)F)cc1 836270574 UQQBGPAIJGWXIZ-QUCCMNQESA-N 383.442 5.289 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(C(=O)C(F)(F)F)c1 841694212 FFZUKINDHQLLEN-ZDUSSCGKSA-N 378.419 5.295 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2ccccc2n1 915087573 VLNXUMNUAPZSPF-HSZRJFAPSA-N 377.447 5.451 30 20 GKED CN(CCCCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916679577 SFHPGUJSXRBWAZ-VWLOTQADSA-N 397.522 5.829 30 20 GKED Cc1ccccc1C[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916681186 QNENTOPGEVBWRV-DVECYGJZSA-N 383.495 5.403 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2c(s1)CCCCC2 916900699 RKJYYKHQFGSMKH-SFHVURJKSA-N 394.540 5.103 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCOc2ccc(C)cc2)cc1 916947385 IUGMTVYRWNUVAY-PGRDOPGGSA-N 392.499 5.015 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3cccs3)[nH]n2)cc1 917119537 KMBCGBBANWOVRV-SFHVURJKSA-N 384.464 5.046 30 20 GKED COc1cc(C=NOCc2ccc(Cl)c3cccnc23)ccc1OC(F)F 917394185 VZHBYXRWPNBJBT-UHFFFAOYSA-N 392.789 5.049 30 20 GKED C[C@H](NC(=O)Nc1ccc(N(C)Cc2ccccc2)cc1)c1ccc(C#N)cc1 918047674 SFEDXYVETSTZRE-SFHVURJKSA-N 384.483 5.077 30 20 GKED CCCCCCCOc1cccc(C=NNc2ccc(C(=O)O)cc2OC)c1 1776050067 VMSGIYNIXOFDNI-UHFFFAOYSA-N 384.476 5.189 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(O[C@H](C)c2ccccc2)cc1 1776085493 QEBBZVFGZGOBHO-GOSISDBHSA-N 388.467 5.290 30 20 GKED C[C@@H]1/C(=C/c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2c(O)ccc(F)c21 1776586629 IZDNZTKKEMEWED-FDIDITGRSA-N 388.394 5.280 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776805912 AHNZIWOFNGPIFS-ATVHPVEESA-N 398.502 6.219 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Br)ccc2o1)c1nc2ccccc2s1 41498203 NWORSTISESGSII-LBPRGKRZSA-N 397.253 5.295 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)ccc1C 41548731 OWZRNAGMSAJHNN-ZDUSSCGKSA-N 390.386 5.122 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)oc2c(Cl)cccc12 41559631 NXFVGPHFABCAHP-LBPRGKRZSA-N 399.784 5.630 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 61632309 ZNKUQEWWZRZLNU-UHFFFAOYSA-N 383.451 5.902 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1nc2c(cc1C#N)CCCC2 96994959 KHFDZFCYANMLDZ-INIZCTEOSA-N 393.556 5.383 30 20 GKED COc1ccc(CCCN(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108533066 OGIBEZDKHNQWSF-QGZVFWFLSA-N 397.544 5.043 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 152800240 JTEXVSCBCVDVFH-OAQYLSRUSA-N 386.455 5.361 30 20 GKED C=CCn1c(SCc2coc(-c3ccccc3)n2)nnc1-c1cccs1 155923634 NOQMFIXWVBIBRT-UHFFFAOYSA-N 380.498 5.140 30 20 GKED CCC(=O)c1ccc(OCCCCC(=O)N(C)c2cc(Cl)ccc2C#N)cc1 156753826 JZMUAMNQHZMGHI-UHFFFAOYSA-N 398.890 5.016 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 163222556 GGHANCCUERBVLM-QGZVFWFLSA-N 397.544 5.532 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 183003055 OTOMHALKTZBPLD-ZDUSSCGKSA-N 375.856 5.052 30 20 GKED N#CCC[C@H](NC(=O)Nc1nc(-c2ccccc2Cl)ns1)c1ccccc1 184374762 ULNYOLYPPPHHKM-INIZCTEOSA-N 397.891 5.025 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc2n1 185257681 QTZQEZFPIXCMEF-OAHLLOKOSA-N 377.856 5.296 30 20 GKED C[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)c2ccccc12 185385040 RWQFCAQOSLJNME-CQSZACIVSA-N 388.858 5.266 30 20 GKED COc1ccc(CSc2nnc(S[C@H](C)c3cccc(C#N)c3)s2)cc1 189800912 SFCOYVRXKOEGMK-CYBMUJFWSA-N 399.566 5.564 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1sc2cc(Cl)ccc2c1Cl 193443641 GELOUPSOEZEBEQ-CYBMUJFWSA-N 389.263 5.169 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccccc1Cl)C(=O)Nc1ccc(Cl)cc1Cl 193465468 LDMDONYDOUPJDS-LJLILKBBSA-N 393.657 5.008 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 194109962 WMWPYVGSHUIPJS-UHFFFAOYSA-N 385.448 5.118 30 20 GKED CCCC(=O)Nc1ccc(-c2csc(NN=C(C)c3ccccc3)n2)cc1 254308967 CVIHOGVRNUWVKI-UHFFFAOYSA-N 378.501 5.385 30 20 GKED CCOc1cc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)ccc1O 303235994 ZTQTYIFHHCSRMK-PTNGSMBKSA-N 395.455 5.266 30 20 GKED OC(=Nc1ccc2nc(C(F)F)[nH]c2c1)C1CCC(/N=C(/O)C2CC2)CC1 330022448 ZOKSKRDDGYXXDA-UHFFFAOYSA-N 376.407 5.014 30 20 GKED OC(=Nc1cc(Cl)ccc1OC1CCCC1)N1CCCC2(CCOCC2)C1 330187777 KPUGSVACXUDJDO-UHFFFAOYSA-N 392.927 5.100 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CC(C)(C)Oc2ccccc21 413418439 XYXQMWZTXJDMBG-DOTOQJQBSA-N 380.513 5.222 30 20 GKED Cc1nc(COc2ccc(CN[C@H]3CCCc4cc(C#N)ccc43)cc2)cs1 418153968 ZFXOJFMVLWCONN-QHCPKHFHSA-N 389.524 5.069 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N(CCC#N)CC3CC3)cc2)cc1 429221551 SAVKSJBKGINXMP-UHFFFAOYSA-N 379.460 5.035 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccc(F)cc2)C1 432073811 DZRMWMNFPVCBOS-DOTOQJQBSA-N 383.492 5.241 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC2(CCCCCC2)C1 438039730 GWFOHUZYZWXEAL-GOSISDBHSA-N 385.577 6.049 30 20 GKED N#CCC[C@H](NC(=O)Nc1cc(F)ccc1SCC(F)F)c1ccccc1 439394512 GMUGRCNKUUJYDK-HNNXBMFYSA-N 393.434 5.349 30 20 GKED N#Cc1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1C(F)(F)F 443884096 MMUNGCCURSEJAC-LJQANCHMSA-N 388.389 5.216 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H]3Cc3ccccc3)cc2)c1 443934985 GCWPJOGCQYLJKA-OAQYLSRUSA-N 383.451 5.199 30 20 GKED CC[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(C#N)cc1 447603911 ZINJZTJGNJXTLH-JOCHJYFZSA-N 376.504 5.529 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccc(F)cc1)CC1CC1)c1ccccc1 458806821 WNDAFKZVJUCGBB-JOCHJYFZSA-N 379.479 5.182 30 20 GKED C[C@@H](c1ccccc1)N(CCC(=O)Nc1sccc1C#N)Cc1ccccc1 463231140 LOWRCMNRFLMXKW-SFHVURJKSA-N 389.524 5.212 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2OCC(F)F)ccc(C(F)(F)F)c1F 467987423 AWACSDVNABUASF-UHFFFAOYSA-N 395.274 5.188 30 20 GKED Cc1ccc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 468642085 OZUJVCCJIGYGSA-OAHLLOKOSA-N 384.570 5.427 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CC1(CSc2ccccc2)CC1 471825147 TUTIWYSKBNIHFP-QGZVFWFLSA-N 396.581 5.982 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H](OC)c1ccc(OC)cc1 475549205 NXHOCOMJNHPATF-UZUQRXQVSA-N 396.531 5.445 30 20 GKED C=CCn1c(SCc2cccc(C(F)F)c2)nnc1-c1ccc(OC)cc1 475964742 FPNBTPJDZNEJRL-UHFFFAOYSA-N 387.455 5.370 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477507528 GBGXZVYYZCSTSM-NRFANRHFSA-N 377.488 5.038 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(C#N)cc1Cl 478168584 PUBDYLAKTSZSGZ-KUHUBIRLSA-N 383.879 5.225 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 481567809 CHELWMKJHPCASL-INIZCTEOSA-N 389.430 5.159 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487622851 ZNCIZQHXZIAKGN-GCJKJVERSA-N 376.500 5.180 30 20 GKED O=[S@](Cc1cccc(C(F)F)c1)Cc1cc(F)c(C(F)(F)F)cc1F 488836714 JFMFSNXBDZZAJT-RUZDIDTESA-N 384.316 5.370 30 20 GKED C=CC[C@@H](C(=O)N1CCC(n2c(CC)nc3ccccc32)CC1)c1ccccc1 489631394 SHKXWHOAKVEYDS-OAQYLSRUSA-N 387.527 5.122 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl 501044536 GQDJIEQSHZDXGJ-MRXNPFEDSA-N 381.328 5.440 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(C(=O)c3ccccc3)c2)c1 503235932 ZUCMYZGELOIYIU-UHFFFAOYSA-N 399.450 5.244 30 20 GKED N#Cc1ccccc1OCc1ccc(-c2nc(-c3ccccc3Cl)no2)o1 504987018 RQTAQSLQQSHEEM-UHFFFAOYSA-N 377.787 5.101 30 20 GKED C[C@H](NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 505285634 QCPDJACWPLYEAN-RBUKOAKNSA-N 383.495 5.139 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1cccc(Cl)c1Cl 505314408 NFPUQFFOVWKUTG-INIZCTEOSA-N 392.673 5.052 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1 507004949 FPZWTCOGNWOHQU-UHFFFAOYSA-N 393.821 5.257 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 510627266 BWRKQDQHWADGHC-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CC(C)Oc1ccc(CNCc2cccc(OCc3ccccc3C#N)c2)cc1 517538714 FCCIKIMFIZMZCX-UHFFFAOYSA-N 386.495 5.214 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1CC1CCCCC1 518255953 KVXZCGALDAWSLZ-HKUYNNGSSA-N 385.577 6.048 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)c1nc(-c2ccccc2)cs1 519321161 AYUMPKHFFRANPK-VQTJNVASSA-N 390.508 5.141 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCCC1 520941124 DSSHDXBUTVHBCI-INIZCTEOSA-N 397.519 5.811 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)ccc1SCC(F)F 523445573 PBCJFLSSDDZVPT-UHFFFAOYSA-N 386.464 5.465 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2CCSCC2)cc1Cl 532134449 SRFMKJJZEJXNMC-IBGZPJMESA-N 384.932 5.467 30 20 GKED COc1ccc(CSCc2csc(-c3ccccc3OC)n2)cc1C#N 533946946 WAKYXLBEBFBUKN-UHFFFAOYSA-N 382.510 5.132 30 20 GKED Cc1ccc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c(Br)c1 535093682 DIJZEJNVAGJHNI-CQSZACIVSA-N 398.087 5.059 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)c2ccc(C#N)c(F)c2)cc1 537406262 FATSDOCNEWLOBJ-VOIUYBSRSA-N 392.449 5.480 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(-c2cncnc2)cc1 538670921 QXUSZEXYANWGHV-UHFFFAOYSA-N 392.418 5.060 30 20 GKED C=CCC[C@H](NCc1ncn(-c2ccccc2)n1)c1ccc(C(F)(F)F)cc1 539332021 YKXYFTHKKVEAOX-IBGZPJMESA-N 386.421 5.083 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N3CCC(CC#N)CC3)c2)c1 543832847 ZSSJDEDUMIWRBG-UHFFFAOYSA-N 378.541 5.362 30 20 GKED N#CC[C@@H](Cc1nc(C2(c3ccccc3F)CCCC2)no1)c1ccccc1 573139761 JPSLUMNXHQRMGO-SFHVURJKSA-N 375.447 5.309 30 20 GKED N#Cc1c(NC(=O)C2(c3cccnc3)CCCC2)sc2c1CCCCCC2 576735224 QBBNZEITHNPIIN-UHFFFAOYSA-N 379.529 5.124 30 20 GKED N#C[C@H](C(=O)c1sccc1-c1ccccc1)c1nc2cc(F)ccc2s1 592974201 OYAQCYKLRFIYOC-OAHLLOKOSA-N 378.453 5.654 30 20 GKED COc1ccccc1NC(=O)c1cc2ccccc2cc1OCC1(CC#N)CC1 596242419 QHWZIULTYLPSMX-UHFFFAOYSA-N 386.451 5.173 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(C)Cc3cccc(C#N)c3)cs2)cc1 603522157 CFMAWABAFUGYAH-UHFFFAOYSA-N 389.524 5.006 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2ccccc2F)c2ccccc2)cc1 603739170 HHFHGKGRERMFKZ-UHFFFAOYSA-N 390.483 5.164 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3ccccc3F)s2)cc1 604068368 KRJLPUUSEZPQTH-UHFFFAOYSA-N 381.476 5.474 30 20 GKED N#C[C@@H](C(=O)c1cccc2cnccc12)c1nc2cc(C(F)(F)F)ccc2s1 608752414 GSSLGDXLHAHOAT-HNNXBMFYSA-N 397.381 5.353 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 608919008 YRIWNHPXPNDYPI-IBGZPJMESA-N 399.947 5.369 30 20 GKED COc1ccccc1CN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208741 CWCKHIDEANBZGQ-UHFFFAOYSA-N 387.439 5.023 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2ccc(F)c(C#N)c2)c(-c2ccccc2Cl)n1 609372258 KLVWFENWHXPGQP-UHFFFAOYSA-N 396.853 5.222 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccc(Cl)cc12 609431871 WOOQGJIYSHIUSS-LBPRGKRZSA-N 384.888 6.041 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H]3CSc4ccccc43)c2)cc1 609811240 VSORMETXHOENEA-HXUWFJFHSA-N 387.464 5.319 30 20 GKED C[C@@H](NC(=O)NCc1cccc(C#N)c1)c1ccccc1-c1ccc(Cl)cc1 610090304 ZMLDPOUOYVGUIE-MRXNPFEDSA-N 389.886 5.439 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccc(Cl)s1 610540066 OBAJTTPJIVQBOR-LBPRGKRZSA-N 383.860 5.203 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cn1)c1ccccc1 647377288 ATSSZLBCIGTJJS-KDOFPFPSSA-N 389.480 5.046 30 20 GKED Fc1cc(F)c2c(c1)[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC2 677129548 MRFXWVIXIYSOEF-GEYZGQBZSA-N 387.314 5.451 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(Br)c1 726729602 JHGCZAZEMFZXAT-CQSZACIVSA-N 399.313 5.213 30 20 GKED O=C1/C(=C/c2cn3cc(Cl)ccc3n2)CCc2nc(-c3ccccc3)sc21 727266911 JRBMPZBXYGNGEP-GXDHUFHOSA-N 391.883 5.324 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=S)Nc1ccccc1C#N 727980217 GLZUKONYMPFRNZ-UHFFFAOYSA-N 391.471 5.394 30 20 GKED C#Cc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)Cc3ccccc3-4)cs2)cn1 728815980 RHVKVBUJCQWMPP-UHFFFAOYSA-N 393.471 5.010 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)cc1OC 731937453 HZTYDYYTTUPTOK-SDNWHVSQSA-N 395.455 5.179 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1c(F)c(F)c(F)c(F)c1F 735318956 SQRLHMIZELTMPU-UHFFFAOYSA-N 393.764 5.371 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F)c1ccncc1 741088675 AHQGTMFYABAETJ-PKTZIBPZSA-N 389.474 5.121 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1ccc2ccccc2n1 741427307 IMGWWPPJHQWWGN-BBWFWOEESA-N 396.368 5.113 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C/c1csc(-c3ccc(Cl)cc3)n1)C2=O 742437224 KFGUNFSANIZKOB-YBEGLDIGSA-N 376.868 5.548 30 20 GKED COc1ccc([C@H](NCc2ccc(N(C)CCC#N)cc2)c2ccc(C)cc2)cc1 742725562 WGBMFCFCECMLGY-AREMUKBSSA-N 399.538 5.233 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC(C(F)(F)F)CC2)s1 743070288 IMTMEMMIAHSQAY-UHFFFAOYSA-N 392.491 5.247 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@H](C)c3cccc(C#N)c3)c(F)c2)c(F)c1 743779524 XOVBPGZNOCXBMC-CQSZACIVSA-N 392.405 5.003 30 20 GKED COc1cc(C(C)=NNc2nccc3sccc23)ccc1SC(F)F 746489652 FZIXQSWJHNHDNF-UHFFFAOYSA-N 379.457 5.456 30 20 GKED CO[C@]1(C)C[C@H](N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1(C)C 752635779 HMESYEVEDMQVIO-ZFGGDYGUSA-N 391.515 5.009 30 20 GKED CN(C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)c1ccccc1C#N 752820063 UVMTUBKFWIUNBB-UHFFFAOYSA-N 381.410 5.189 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(OCC(F)(F)F)cc1 753143307 TVWOFGJUDQEJKJ-CMDGGOBGSA-N 390.386 5.042 30 20 GKED C=C[C@H](CC(=O)O[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 758907472 JRBJPTRWSCETGN-QZTJIDSGSA-N 376.456 5.318 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1ccncc1 768949626 ZNTKFJDGKRPGNO-QHCPKHFHSA-N 389.474 5.250 30 20 GKED Fc1ccc([C@H](CC(F)(F)F)NCc2c(F)c(F)c(F)c(F)c2F)cc1 775190082 DMUFFASPZUDZAI-JTQLQIEISA-N 387.245 5.305 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1ccc(Cl)nc1C(F)(F)F 789964009 PIORSDVXUXFOPV-UHFFFAOYSA-N 386.654 5.164 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cnc3ccccc3c2)cc1 796630239 OTTMIOAKQUREBI-HTAPYJJXSA-N 399.494 5.028 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccccc1)c1nc(-c2c(F)cccc2F)cs1 796903386 JERZYHAERJFWRP-ZNMIVQPWSA-N 380.419 5.068 30 20 GKED COc1ccc(NC(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)c(C(F)(F)F)c1 801660264 AXKQLENPNAEBIU-AWEZNQCLSA-N 395.274 5.382 30 20 GKED Cc1cc(C#N)cc(N[C@H]2CCCc3cc(NC(=O)OC(C)(C)C)ccc32)n1 804626238 PNUREWCBKRSSIM-IBGZPJMESA-N 378.476 5.098 30 20 GKED Cc1ccc(N(C)C(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)c(C)c1 807571659 MCXJTOLOTBOLLV-UHFFFAOYSA-N 395.934 5.098 30 20 GKED N#C[C@H](C(=O)C12CC(C(F)(F)F)(C1)C2)c1nc(-c2ccc(Cl)cc2)cs1 810530938 DATNVAJCENFZRA-AXOLYNHLSA-N 396.821 5.372 30 20 GKED COc1cccc2cc(/C=C3/CC/C(=C\c4cccc([N+](=O)[O-])c4)C3=O)oc12 818240181 IMVWDQWSIRYTAU-HDVIWIBHSA-N 375.380 5.180 30 20 GKED C[C@@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCCO1 838786375 IKPYJVMLYAHSIY-UGSOOPFHSA-N 395.311 5.252 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc(OC)c1OC 844255428 BQJMJUJWSBJLMY-RUDMXATFSA-N 398.455 5.476 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(Cl)nc(C3CC3)c2)cc1 847626955 VIQTVPJESYXKDR-UGSOOPFHSA-N 395.890 5.087 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccncc2)cc1 863197637 VHRIHNDSILKTPW-LPADLIQXSA-N 384.483 5.268 30 20 GKED COc1cccc(C(F)F)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 888862400 DHGUKEPFRIJQNZ-LBPRGKRZSA-N 376.428 5.137 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1 915179442 DVXGMMPLZBINCL-KRWDZBQOSA-N 382.250 5.296 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCSc2ccccc2F)cc1 916948962 KUPGCBXNLINALG-CRAIPNDOSA-N 398.503 5.169 30 20 GKED O=C(O)c1ccc(NN=C(CCCc2ccccc2)c2ccc(F)cc2)cc1 1776013222 OIELPNFLRXBQDF-UHFFFAOYSA-N 376.431 5.363 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)c1)C(=O)O 1776473533 OELGDAJWJDDIEI-IDJPSDCMSA-N 396.508 5.469 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(C)c(Br)s1 1776784032 OPHYHENFYRUCPB-ZDUSSCGKSA-N 376.360 5.112 30 20 GKED CCCCCCOc1cccc(/C=C/C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)c1 1776790351 QLXBVJMEHHJCGA-JKGDOXCYSA-N 396.483 5.394 30 20 GKED CCCCCC[C@](C)(NCc1cccc(OCc2ccccc2C#N)c1)C(=O)O 1776803972 HMDQQHKALNFQMC-DEOSSOPVSA-N 394.515 5.041 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3cc(C(=O)O)c(Cl)s3)c(C)c2c1 1777376038 GSHSIHONIKNYMZ-SNAWJCMRSA-N 376.817 5.059 30 20 GKED O=C(O)Cc1cccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c1 1777650961 JDPVHEOJCJEUNM-XMHGGMMESA-N 399.471 5.347 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CSc4ccc(F)cc4C3=O)s2)c1 1777684343 TYJZTNNTRZMATP-NTEUORMPSA-N 396.464 5.624 30 20 GKED Cc1nc(SCC(=O)N[C@@H](C)c2ccc3ccccc3c2)c(C#N)c(C)c1C 23078023 SPVOQNWTWZSKCJ-KRWDZBQOSA-N 389.524 5.001 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-c2nnco2)c1 24739704 QBYKFRSZPUDGAN-UHFFFAOYSA-N 398.447 5.012 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 33178758 WGPLOTODQKYOKY-OAHLLOKOSA-N 394.396 5.735 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)on1 66953496 WBXSZOFNYBYWND-HXUWFJFHSA-N 388.427 5.016 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccccc1C(F)(F)F 70867106 SBHTVAQANYHICD-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 108530983 DRLQPXASSDPPMJ-KKSFZXQISA-N 393.556 5.924 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccc(F)cc3)o2)cc1 111184786 IHQJAHVPMQUCDP-UHFFFAOYSA-N 378.403 5.045 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(-c2ccccc2F)o1 121018636 HZKOKOFMTAQWBP-MRXNPFEDSA-N 386.382 5.081 30 20 GKED CC(C)n1cc(C#N)c(NC(=O)c2ccc(Oc3cccc(Cl)c3)cc2)n1 161151197 RTPMNPVPIGLQDA-UHFFFAOYSA-N 380.835 5.034 30 20 GKED C[C@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(OCC#N)cc1 171768588 VGYABJVWDQYOCJ-SFHVURJKSA-N 390.458 5.158 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(C)=C/c3ccc(F)cc3)n2)cc1 175132748 ZSXJUONKUNTNNZ-VUVZNRFTSA-N 392.455 5.238 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccc3c(c2)CCO3)no1 189895861 OJAKXKWWTAFZDH-UHFFFAOYSA-N 388.467 5.381 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(C2SCCS2)c1 272530450 MRYFJKGTTLHFFA-CYBMUJFWSA-N 385.514 5.100 30 20 GKED COc1ccccc1-c1noc([C@H](C)/N=C(/O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)n1 328791425 QVPXUCURWUGTTN-LUKYLMHMSA-N 383.492 5.369 30 20 GKED Cc1nc2c(c(C(F)(F)F)n1)C[C@H](/C(O)=N/[C@@H](c1cccs1)C1CC1)CC2 329810425 BKUXECWUJGXGOY-MLGOLLRUSA-N 395.450 5.078 30 20 GKED C[C@H](N[C@@H](C)c1nc(-c2cccnc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 368060529 NKUKOXKXGCXMCC-IRXDYDNUSA-N 395.466 5.082 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1Br 425308426 FNAFYZSLUGYRRD-VIFPVBQESA-N 383.336 5.063 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430586586 TZCFDLRDTHUUHG-OAHLLOKOSA-N 395.553 5.286 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c(Cl)cncc1Cl 431936778 IWFSRVUTMCNQAK-UHFFFAOYSA-N 399.237 5.008 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 432791018 YKKFGFMUNLHXPS-UHFFFAOYSA-N 384.483 5.371 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1c(Cl)cc(F)cc1Cl 432934050 QRMAUWBXOISLAT-SNVBAGLBSA-N 383.275 5.637 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccn(C(CC)CC)n3)o2)cc1 433643547 FJZSHKQQTFNEHT-UHFFFAOYSA-N 384.505 5.151 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1-c1nncn1C(C)C)c1ccccc1 435613827 CBXBRAGYTNPXDJ-FQEVSTJZSA-N 389.503 5.355 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 437906475 HJYILAKNSLUFNQ-OAHLLOKOSA-N 381.907 5.899 30 20 GKED CSc1ccc(Cl)cc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 438079712 KOIJNFSFPHZGBD-WMZOPIPTSA-N 385.920 5.366 30 20 GKED CCCN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@@H](C)c1ccccc1OC 438848089 ALIOGJIRRNMTRO-GHTZIAJQSA-N 379.504 5.223 30 20 GKED N#CCC[C@@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccccc1 439667666 LDXVUIJHAILKQQ-OAQYLSRUSA-N 376.431 5.180 30 20 GKED C[C@H]1CCN(Cc2nnc(-c3cccc(C#N)c3)o2)c2cc(Cl)ccc2S1 440395015 WYPUGPWOWNGRRO-ZDUSSCGKSA-N 396.903 5.153 30 20 GKED C=CCC[C@H](NC(=O)c1cc2c(s1)CCOC2)c1ccc(C(F)(F)F)cc1 441580070 KMSWJUVNJXUVNW-INIZCTEOSA-N 395.446 5.277 30 20 GKED C[C@H]1COCC[C@@H]1c1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 442686191 VBGDUNPCGVTWOQ-UGSOOPFHSA-N 395.846 5.194 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)COCc1ccccc1 443527968 CSEWOZJBZXMINX-KRWDZBQOSA-N 382.529 5.120 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2cc(-c3ccc(F)cc3)c(C)s2)cc1 446005486 YIDVYTQBRNFEIT-UHFFFAOYSA-N 394.471 5.031 30 20 GKED CC[C@@H](NCc1cccc(NC(=O)c2cccc(F)c2)c1)c1ccc(C#N)cc1 447532091 UXUITJGDDWYXER-HSZRJFAPSA-N 387.458 5.191 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2cn3cc(Cl)ccc3n2)cc1F 463224734 GITCRLGKNLLYDY-UHFFFAOYSA-N 392.821 5.403 30 20 GKED N#CCCCC(=O)N(CCc1ccccc1)c1nc(-c2ccccc2)cs1 463289101 DUJCAPMERKRMAX-UHFFFAOYSA-N 375.497 5.080 30 20 GKED CC(C)Oc1ccc(NC(=O)CCCCOc2cccc(C#N)c2)c(Cl)c1 474144652 BRFDNLPYZJZRAX-UHFFFAOYSA-N 386.879 5.187 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1 475377982 COQUJELLSOVIFV-UHFFFAOYSA-N 380.491 5.570 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 475406904 CNRMTHVEDHMDAJ-ZDUSSCGKSA-N 378.419 5.453 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)cc1 475475216 ZKHDYUZOVCHQST-UHFFFAOYSA-N 389.480 5.054 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 476812714 FZCIMHWLZREERN-OAQYLSRUSA-N 375.472 5.151 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2ccc(C3(C#N)CC3)cc2)o1 477893952 OUVJBERJNJPJIB-UHFFFAOYSA-N 376.843 5.716 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(C(F)F)c1Cl 481491555 KSHSIHFGEDEFJH-UHFFFAOYSA-N 391.270 6.213 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1F 483957642 PRBAXKWEJOOSBH-OAQYLSRUSA-N 382.385 5.178 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)Cc1c(F)cccc1C#N)C1CC1 506766436 ITIAQANNCPCRAI-CYBMUJFWSA-N 390.380 5.011 30 20 GKED Cc1cc(C)n(-c2ccc(CCNC3CCC(C#N)(c4ccccc4)CC3)cc2)n1 507653973 PGWMTZMWAURNDA-UHFFFAOYSA-N 398.554 5.025 30 20 GKED N#CCCCCNC(=O)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1 509549579 OWBORZCXYIWYNH-UHFFFAOYSA-N 378.259 5.601 30 20 GKED CC(C)(C)[C@H]1CCc2sc(-c3nnc(SCCCCC#N)o3)cc2C1 509956149 GPCPLDLRUYDKNZ-AWEZNQCLSA-N 375.563 5.735 30 20 GKED FC(F)Oc1ccc(CN[C@H](c2ccc(OC(F)F)cc2)C(F)(F)F)cc1 510462681 YLFBQBUQKUOYSJ-CQSZACIVSA-N 397.290 5.283 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3F)s2)cc1 512674441 XKVUYYSSDKTPBB-LSDHHAIUSA-N 379.504 5.850 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccccc1-c1nc2ccccc2s1)C1CC1 513768718 ANMFHSJDDYFMLA-AWEZNQCLSA-N 376.485 5.119 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1ccc(F)cc1F 517168808 LGZAGISXXAFOPT-CQSZACIVSA-N 393.393 5.068 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)sc1C 518516796 YZTOPTMDYJTWGU-KRWDZBQOSA-N 396.537 5.631 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1F 519505429 VMUSDSADNFLINY-LBPRGKRZSA-N 396.409 5.592 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1 520813428 GGTVTRDGUZXFIH-CQSZACIVSA-N 390.961 5.464 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cs2)o1 521326051 DTBUIHHPDZWWTF-ZDUSSCGKSA-N 383.498 5.358 30 20 GKED C[C@H](NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1ccc(C#N)cc1 521606141 GKHGGQLZEYYOPB-KSFYIVLOSA-N 390.483 5.408 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)CSc1ccc(C#N)cc1 522678449 BDVATVQLCFYGHE-UHFFFAOYSA-N 388.492 5.177 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 524326837 NRYUONAIECJIPY-MSOLQXFVSA-N 387.310 5.407 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(O[C@@H](C)c3ccccc3)nc2)n1 531091621 KDKFCNRRCRBSMP-YJBOKZPZSA-N 391.496 5.292 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](N[C@@H](C)c2ccc(C#N)cc2)CCC3)cc1 531695533 NPDHFGGGRLLFQV-MGPUTAFESA-N 389.524 5.419 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N[C@H](C)c3ccc(C#N)cc3)cc2)cc1 535510435 KJDUCJHSXNDNBW-MRXNPFEDSA-N 384.435 5.044 30 20 GKED CC(C)C[C@H]1C[C@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 540777607 WBNHTWVKAHPEJC-MOPGFXCFSA-N 394.540 5.033 30 20 GKED Cc1ccc(-c2cc(-c3nnc(SCC4(C#N)CC4)o3)c3ccccc3n2)cc1 540858662 PNPGAVOGFAZHRF-UHFFFAOYSA-N 398.491 5.656 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 541254942 DDIKANDXZWJURM-HXUWFJFHSA-N 395.506 5.759 30 20 GKED Cn1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1C1CCC1 549526501 HDSRSVSPNHIEDM-UHFFFAOYSA-N 399.494 5.190 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H]2CCC[C@@H](C2)C1 554419124 ODWFUEFFVIUYCY-OALUTQOASA-N 375.472 5.313 30 20 GKED CCc1cccc(CC)c1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 558369209 LIOMZYZAFXKHDF-UHFFFAOYSA-N 391.515 5.195 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 562413285 IHJCBXLVLDDOLO-UWJYYQICSA-N 391.540 5.697 30 20 GKED N#C[C@]1(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)CC12CCCC2 562688806 JGXLNNONCZCXIE-FQEVSTJZSA-N 379.441 5.076 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)N1CCC(CCC#N)CC1 564932648 NIZFCMRXNYXZBK-UHFFFAOYSA-N 395.478 5.261 30 20 GKED Cc1oc(C#N)cc1-c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 575364488 TZQKPDXVSXGZNL-UHFFFAOYSA-N 387.239 5.214 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(Cl)s1 579655119 CCDORHBQJOVAOL-LBPRGKRZSA-N 383.860 5.203 30 20 GKED C=CCn1c(-c2ccc3ccccc3n2)nnc1N1CCC[C@H]1c1ccsc1 579894435 VHGNCEQGNKHNCT-FQEVSTJZSA-N 387.512 5.082 30 20 GKED N#Cc1ccc(CNc2cccc(OCc3cccnc3)c2)c(C(F)(F)F)c1 582754863 BGYNSHVCETXQNK-UHFFFAOYSA-N 383.373 5.163 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 588349038 QBZJEOQGZKOVRK-HNNXBMFYSA-N 388.826 5.891 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)F)cc1)c1nc2cc(C(F)(F)F)ccc2s1 588349050 RBNZNWXJGPGXAI-GFCCVEGCSA-N 396.340 5.743 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1 596697872 BCCXLJZXIVSYKB-HXUWFJFHSA-N 379.460 5.088 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N(c3ccc(C#N)cc3)C3CCC3)s2)o1 598885905 TYYOXIVYZYURGI-UHFFFAOYSA-N 377.469 5.091 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(Cl)cc1 609370934 KQSGEHHOAWKYBG-CYBMUJFWSA-N 376.934 5.465 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 609378525 RMBCVTZZOGJGKH-CQSZACIVSA-N 392.446 5.843 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2)o1)c1cccc(C(F)(F)F)c1 609460367 CCNQRIMBKVGQKS-IBGZPJMESA-N 398.384 5.279 30 20 GKED Cc1cccc2sc(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)c(Cl)c12 609589528 TYUFQHKIDSARDR-ZDUSSCGKSA-N 375.280 5.511 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1)C1CCCC1 609976754 RSQIWPJOXFPVFT-UHFFFAOYSA-N 379.312 5.630 30 20 GKED C[C@@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1cccc(C#N)c1 610362933 BMTVLAXEWFRTMR-CQSZACIVSA-N 380.900 5.334 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 612377676 RXDHXCJKMOQRSY-AEFFLSMTSA-N 399.844 5.145 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)cc1 619479112 QQRKJVYRNKEWNB-UHFFFAOYSA-N 382.332 5.394 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 677975025 NXHRWTANFPEMJQ-JTQLQIEISA-N 398.768 5.598 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1C[C@@H](C(F)(F)F)CC[C@H]1C 679526704 OIPBJBFMLXPBSE-YPMHNXCESA-N 395.343 5.073 30 20 GKED C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)C1CCCCC1 726320326 WUVBZFFTTPRSMV-DYVFJYSZSA-N 394.487 5.255 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 726475505 BGELOCNYXJLXJE-HNNXBMFYSA-N 377.538 5.147 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCc1ccc(OCC#N)cc1 727844683 GYLIUINHFPJOJD-HXUWFJFHSA-N 399.494 5.062 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1nc(-c2ccccc2)cs1 727973917 DGAMXSGKRRGAQB-OUBUNXTGSA-N 388.448 5.548 30 20 GKED CN(CCC#N)c1ccc(CNCc2ccccc2Oc2cccc(F)c2)cc1 731041686 OWDJNSPYDRTVSU-UHFFFAOYSA-N 389.474 5.258 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc(Cl)nc3)cc2)c1 731320722 XIEZCIRIJLGWAF-UHFFFAOYSA-N 380.860 5.208 30 20 GKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1nc2cc(Cl)ccc2s1 731547383 ZZFAVZJKIRGWDJ-HNNXBMFYSA-N 388.945 5.991 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)s1 733080946 HGFOBLRAWYQHCT-SNAWJCMRSA-N 376.846 5.329 30 20 GKED O=C1/C(=C/c2ccc(OCc3ccncc3)cc2)CCOc2ccc(Cl)cc21 733748871 LRSJWVAOFDDHHE-QGOAFFKASA-N 391.854 5.363 30 20 GKED CCCCOc1ccc(NC(=O)NCc2cccc(O[C@@H](C#N)CC)c2)c(C)c1 733843395 HCSRFCBQXBLNCR-LJQANCHMSA-N 395.503 5.177 30 20 GKED C=CCN(Cc1cccs1)C(=S)Nc1ccc(OC(F)F)c(Cl)c1 735621334 KFJPLOBCXWCJKU-UHFFFAOYSA-N 388.892 5.388 30 20 GKED N#C[C@@H](C(=O)CC/C=C\c1ccccc1)C(=O)Nc1cc(Cl)cc(Cl)c1 739156416 WZOLSPPQVXXOJG-MSEQUDFZSA-N 387.266 5.134 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3[C@H]4CC[C@H]3c3ccccc34)c2)s1 740484919 XTGJVPBJHJUJNG-SFTDATJTSA-N 385.492 5.388 30 20 GKED CC(=NNc1ncnc2sc3c(c12)CCC3)c1cccc(-c2ccncc2)c1 741455807 MHTZLNRGIOFBRQ-UHFFFAOYSA-N 385.496 5.078 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744015075 FTVMAYTXEXIFNC-YOEHRIQHSA-N 382.385 5.624 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(-c2cc3ccccc3o2)o1 749092288 MYXIURGEQYAHAN-UHFFFAOYSA-N 397.843 5.331 30 20 GKED CCCCCCN(C(=O)Cc1ccc(C#N)cc1)c1nc2ccccc2s1 749786414 PDGMHSWKWZDULG-UHFFFAOYSA-N 377.513 5.324 30 20 GKED CCOc1c(OC)cc(/C=C2\CCc3cc(SC)ccc3C2=O)cc1OC 750907856 BOGBKYLEOLHMGI-MHWRWJLKSA-N 384.497 5.037 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)o1 752238952 ZQJGDOKEKSDPPF-BENRWUELSA-N 379.843 5.644 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 754887458 AEGCVIMJDFFBSW-VGOFRKELSA-N 385.467 5.693 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1ccc(C(C)(C)C#N)cc1 774298637 WFUJQDZVUKILGK-UHFFFAOYSA-N 379.504 5.755 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)Cc2ccccc2CC#N)cc1 776958910 SFDKXDOSSIQIGD-LJQANCHMSA-N 398.506 5.190 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC1(c2cccc(Cl)c2)CCCC1 780677323 FTVLPVMJFXTMTB-OAHLLOKOSA-N 383.879 5.222 30 20 GKED Cc1cc(C)c(N2CC[C@H](Nc3ccccc3S[C@@H](C)CC#N)C2=O)c(C)c1 788796539 FVKPCAJHTBPCTE-ICSRJNTNSA-N 393.556 5.224 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C\Sc2cc(F)ccc2F)s1 797964259 FPRJWJQNTODNES-ZHRWSRJISA-N 378.469 5.201 30 20 GKED N#Cc1ccncc1C(=O)Oc1ccc(-c2nc3ccccc3s2)cc1Cl 807986675 QUEIEVUDPVOMSE-UHFFFAOYSA-N 391.839 5.103 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCCC(F)(F)C2)cc1 813761149 KRAYELZXTDXTNT-UTKZUKDTSA-N 397.469 5.679 30 20 GKED Cc1cc(Br)cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c1O 815635893 LPTPMHQHFWQFGI-BEFAXECRSA-N 387.321 5.549 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)CC(C)(C)C#N)c23)cc1 853278686 HCHYDVNGWHAIMU-UHFFFAOYSA-N 379.489 5.095 30 20 GKED N#C[C@@H](C(=O)CCn1c2ccccc2c2ccccc21)c1nc2ccccc2s1 916847671 ODQMCAXTEDRRCU-SFHVURJKSA-N 395.487 5.671 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)n1[C@@H](C)c1ccccc1 916848181 DMYYWLBPDDAVAE-FDDCHVKYSA-N 393.490 5.753 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)c(-c2ccncc2)n1 920067714 BTEUUWWFXGOVPB-CLFYSBASSA-N 399.425 5.310 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)[C@@H]2CCc3ccccc32)c1 1776788207 YSTRARGQMUGCLV-RPWUZVMVSA-N 395.543 5.309 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)cc1 1776801724 PGZUQZYERFABJQ-BUHFOSPRSA-N 389.451 5.316 30 20 GKED CCN(C)c1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(C)c1 1776855538 WCVVGVYJYVHCFT-ZRDIBKRKSA-N 389.451 5.305 30 20 GKED N#Cc1ccccc1CSCCNC(=S)Nc1ccc(Cl)c(Cl)c1 18163377 PMLNLHKWHPCZSR-UHFFFAOYSA-N 396.368 5.085 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)cc1OC 25934691 WRLFYUFISHVELO-UHFFFAOYSA-N 390.439 5.045 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1ccoc1C 31613059 VCKGCLZMJSPOBM-UHFFFAOYSA-N 380.448 5.012 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1nc2ccccc2s1 54537863 BFNWYBLXOCMEFH-CQSZACIVSA-N 394.500 5.180 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1cc(Cl)ccc1Cl 56199852 POJPWBPQCQAAEQ-ZDUSSCGKSA-N 392.286 5.115 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(OC)cc3)o2)nc2ccccc21 65279362 CPADOUBYTNEIER-UHFFFAOYSA-N 377.469 5.178 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954297 ORPFPLOXOWGUAO-INIZCTEOSA-N 383.492 5.440 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2Cl)o1)c1cccc(N2CCOC2=O)c1 72047178 AXYUJLPVUMZXEI-CSKARUKUSA-N 393.826 5.453 30 20 GKED COCc1nc(Oc2ccc(C#N)cc2C)c2c(-c3ccccc3)csc2n1 97543151 QMQNTISLEXEPAA-UHFFFAOYSA-N 387.464 5.477 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(C(F)(F)F)c1 106116705 BSZBAQKZSXXIRY-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccccc2F)cc1Cl 107876491 VULRQAGDDDAXTO-GOSISDBHSA-N 394.833 5.152 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccco1 108528611 ZBMYMVYKLDWMMT-HRAATJIYSA-N 391.496 5.442 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccccc2Cl)cc1 116525364 DLCMUKMRKKCGSS-UHFFFAOYSA-N 378.815 5.265 30 20 GKED CC[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 131984295 QXSXWPFFWBNYTJ-QZTJIDSGSA-N 387.430 5.083 30 20 GKED C=CCN(C(=O)[C@H](C)c1ccsc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 151167577 XEQPYEVSADVLIJ-CYBMUJFWSA-N 399.497 5.103 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(OCc3cccnc3)c(Cl)c2)cc1Cl 154663672 QLVIBKKLADLCLG-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)c2ccccc12 185385023 RWQFCAQOSLJNME-AWEZNQCLSA-N 388.858 5.266 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCC(F)(F)F)nc1 189875673 OFZBNRSUEGSVNS-UHFFFAOYSA-N 378.394 5.127 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CCc4cc(F)ccc43)cc2)cc1 303041584 PZYXVVWEVBHWHY-QFIPXVFZSA-N 387.414 5.299 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN(Cc2ccc3c(c2)CCC3)C1)C1CCCC1 329401485 YDNKTWOKMNOFAD-NRFANRHFSA-N 392.547 5.056 30 20 GKED OC(=Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)[C@H]1CCCSC1 329796792 HBUPMVCBRQEHGS-ZDUSSCGKSA-N 390.940 5.056 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(F)(F)F 361442892 UBYUNGSBSPZTJE-IEBWSBKVSA-N 387.405 5.095 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@@H]1CC[C@H](C#N)C1 424317277 BQWWAGCGPIZOTB-KWCYVHTRSA-N 390.350 5.224 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 429370420 HCGBPUXVNQUTSX-HIFRSBDPSA-N 397.525 5.081 30 20 GKED N#CCSc1cccc(C(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)c1 429947869 RJDSSLMPYNNHOS-UHFFFAOYSA-N 399.928 5.255 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc(CCc3ccccc3)n2)s1 430596612 JRFBESSLIWFESA-OAHLLOKOSA-N 395.553 5.172 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc(-c3ccccc3F)n2)s1 430618273 SHKJIDSMFHLGDK-LBPRGKRZSA-N 385.489 5.193 30 20 GKED N#CCCC[C@H](NC(=O)NCc1ccc(-c2ccco2)cc1F)c1ccccc1 431904912 APONEDKAIYVZOE-NRFANRHFSA-N 391.446 5.320 30 20 GKED CC(C)c1ccc2c(c1)[C@H](NCc1cn(CCC#N)nc1-c1ccncc1)CCC2 433331598 NMFPWZLPNNFDMK-XMMPIXPASA-N 399.542 5.149 30 20 GKED N#Cc1cc(NC(=O)N2CC[C@H](CC(F)(F)F)C2)ccc1Oc1ccccc1 434160479 AEPKIHZJALWHOJ-CQSZACIVSA-N 389.377 5.157 30 20 GKED C[C@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccc(C#N)cc1 435128546 FDDKZBTVRAFBLR-HNNXBMFYSA-N 383.442 5.052 30 20 GKED Cc1cc(Br)ccc1-c1noc(-c2cccc(SCC#N)c2)n1 445462298 KLFJQYXHQMGCBD-UHFFFAOYSA-N 386.274 5.090 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)c(F)c1 445757382 JXXPVPGYPUHMDY-FQEVSTJZSA-N 382.797 5.009 30 20 GKED CC[C@@H](N[C@@H](c1ccc(OC)cc1)c1ccccc1OC)c1ccc(C#N)cc1 447573758 JCNCGVQYTVYZGW-NOZRDPDXSA-N 386.495 5.406 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccc(Cl)cc1)C1CC1)c1ccccc1 458794516 BCKAWGVBAZAIIQ-OAQYLSRUSA-N 381.907 5.449 30 20 GKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 459549150 MRUKVRKBEBQYPL-GOSISDBHSA-N 396.453 5.018 30 20 GKED C=C(C)COc1cc(CNC[C@H]2CCCO[C@@H]2c2ccc(C)cc2)ccc1OC 464049308 KNFAEHGWMKLGES-RCZVLFRGSA-N 395.543 5.216 30 20 GKED Cc1oc2ccccc2c1CCNC(=O)Nc1ccccc1SC[C@H](C)C#N 467335118 JHWCICCJAMKHPR-OAHLLOKOSA-N 393.512 5.357 30 20 GKED C=CCC(CC=C)C(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 467841512 UUXSKQUFVSJBLA-INIZCTEOSA-N 380.351 5.213 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(Br)c(F)cc1F 468220533 YGXPXOPSHUMSMB-UHFFFAOYSA-N 384.245 5.258 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)CCC)ccc1Cl 469905711 IQBZXBHNDASIRA-UHFFFAOYSA-N 399.922 5.689 30 20 GKED Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 475016561 LOYXUYGODPFSII-UHFFFAOYSA-N 397.478 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC(F)(F)F)c1ccccc1 475558368 IXSHTXFNGFBHQA-LJQANCHMSA-N 390.449 6.354 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2cccc(Cl)c2)n1 476141702 JIIZFMBLOWBQOP-UHFFFAOYSA-N 393.918 5.938 30 20 GKED CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 487393160 UAIQCESDYYUQMM-FQEVSTJZSA-N 397.906 5.099 30 20 GKED CCc1oc2ccccc2c1CN(C)CC(=O)c1cn(CCC#N)c2ccccc12 494342558 APUNCFXIINXGSL-UHFFFAOYSA-N 399.494 5.178 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C)o1 499914602 UWHZATUKASHBQZ-RZXSNQJFSA-N 376.500 5.063 30 20 GKED C[C@H](NC(=O)N(C)C1CCC(F)(F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 501861637 SGGADTFKDGFREN-INIZCTEOSA-N 397.469 5.506 30 20 GKED C=CCn1c(SC[C@H]2CCCC(F)(F)C2)nnc1-c1ccccc1OC 509094213 BGCKKTWEYGTRRJ-AWEZNQCLSA-N 379.476 5.057 30 20 GKED CSc1ccc(-c2csc(NC(=O)c3cc(C#N)ccc3Cl)n2)cc1 511845934 YQAIWMGQWGVAOG-UHFFFAOYSA-N 385.901 5.309 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 512797209 MZRPEPXRXNQDMB-UHFFFAOYSA-N 388.945 5.282 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@H](C)c1ccccc1OC(C)C 517629296 JUPHIRYUOWHADI-MRXNPFEDSA-N 381.476 5.015 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N(Cc1ccco1)c1ccccc1C#N 517652198 GCUYDEPNAFRKBI-QGZVFWFLSA-N 376.481 5.113 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1 517905757 GEHKCUSVYBPMCC-UHFFFAOYSA-N 376.843 5.575 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 518659310 AUNISNXYCYSFFE-GOSISDBHSA-N 396.556 5.743 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Oc2cccnc2)cc1 521663019 GVIRMCGPRQBPQS-GHTZIAJQSA-N 385.467 5.139 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2oc3ccccc3c2c1 521711008 SRDLUJWWLDCPQY-UHFFFAOYSA-N 381.435 5.678 30 20 GKED CC(C)c1nnc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 522578175 YPZHAXURVPSYPS-UHFFFAOYSA-N 398.875 5.231 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCCC2)cc1 522597137 RESFLJCKFSYHPD-UHFFFAOYSA-N 391.515 5.712 30 20 GKED N#C[C@H](C(=O)c1cccc(Nc2ccccc2)c1)c1ccc(C(F)(F)F)cn1 525427578 HPTJAPHSNHPHEG-SFHVURJKSA-N 381.357 5.334 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 533916590 PMZSUNSFJQGLHH-OAQYLSRUSA-N 385.854 5.314 30 20 GKED CCN(C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)c1ccc(C#N)cc1 533919459 FFGRLLDJWYLIGN-SFHVURJKSA-N 397.478 5.034 30 20 GKED C=C[C@H](CC(=O)N(CC)[C@@H](c1ccc(C)cc1)c1cccnc1)c1ccccc1 535399049 UVBXYGCRTXFQBI-RLWLMLJZSA-N 384.523 5.688 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccccc1C(F)(F)F 543346360 WSMXDXREKBSLDP-CQSZACIVSA-N 387.405 5.012 30 20 GKED CC(=O)Nc1cccc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 543921919 ZNIVQBUIFIEVFB-QZTJIDSGSA-N 383.495 5.595 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 551204922 HLOOHOLDJKFCMB-AVRDEDQJSA-N 389.568 6.128 30 20 GKED Cc1ccc2c(CCNC(=O)Nc3ccccc3SC[C@@H](C)C#N)c[nH]c2c1 553071062 HIEIRWFGUUNMIC-INIZCTEOSA-N 392.528 5.092 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl)c1ccc(Cl)c(Cl)c1 553962574 XKPGOHBPHAQTPQ-XNJGSVPQSA-N 379.674 5.131 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC1CC1)c1nc(-c2c(F)cccc2F)cs1 554007735 KBVNVUQLEZWEIF-CQSZACIVSA-N 396.418 5.120 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c2[C@H]1C 571170355 PBLRAIWHDAQKLB-STQMWFEESA-N 377.469 5.213 30 20 GKED Cc1cccc([C@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 573489761 OUUMDFYMGYGCMD-AWEZNQCLSA-N 392.446 5.762 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)cn1)c1nc(-c2ccccc2)cs1 574119613 QPGSHXAWCYRMOK-IBGZPJMESA-N 397.459 5.487 30 20 GKED N#CC1CCC(CNC(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)CC1 578671886 WZJOLXAUURTTNF-UHFFFAOYSA-N 394.346 5.212 30 20 GKED O=C(NCC(F)(F)C(F)F)c1sc2cc(C(F)(F)F)ccc2c1Cl 579185844 MNRNSQYNRWPCRM-UHFFFAOYSA-N 393.711 5.204 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cc2ccccc2o1 580368264 FWTBMQFROGDHCQ-HNNXBMFYSA-N 398.422 5.374 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ncc(C#N)cc2C)c(C(F)(F)F)c1 581712207 UYVRVNZWOSDEHY-GFCCVEGCSA-N 393.434 5.423 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2cc(C)c(-c3cccc(Cl)c3)s2)nc(C)n1 588348229 FFUIVLBNRWPKPJ-MRXNPFEDSA-N 381.888 5.274 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(NC(=O)CCCCC#N)cc2Cl)n1 594006909 ZLNNAMDEJKJFEH-UHFFFAOYSA-N 392.912 5.304 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc(C4CC4)nc4ccccc34)c2C#N)C1 603834507 JLXHENILTSMTMM-CYBMUJFWSA-N 387.508 5.422 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609378805 SCKACXQPWFRRMY-KGLIPLIRSA-N 391.323 5.741 30 20 GKED Cc1nc(COc2ccccc2C(=O)[C@H](C#N)c2ccc3ccccc3n2)cs1 613291087 SZPPFWDUWYTBHU-LJQANCHMSA-N 399.475 5.069 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 615081366 BDDGXJAJLZPRML-WOJBJXKFSA-N 389.417 5.032 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H]3CCc4cc(C#N)ccc43)c2)cc1 618753507 UGPQNZYFIIAAMF-QHCPKHFHSA-N 394.434 5.031 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(C#N)c(Cl)c1 619754625 GEJVDMXWGQMVHG-LBPRGKRZSA-N 385.895 5.634 30 20 GKED CCn1nc(C(C)C)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 642281329 ZZNRZPIQNBMCQO-HNNXBMFYSA-N 398.919 5.293 30 20 GKED CC(C)n1nccc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647229806 FWWVRZQCXNCWIA-UHFFFAOYSA-N 383.311 5.366 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c1 678572138 CXSMHRJSKORHQF-JOCHJYFZSA-N 392.458 5.791 30 20 GKED C=CCSc1ccccc1C(=O)N(C)C[C@H]1CCCO[C@H]1c1ccccc1 681623328 KNLXPNMBIZVARJ-KNQAVFIVSA-N 381.541 5.205 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1cc(F)c(C(F)(F)F)c(F)c1 683199713 JNDLJQQDJNNAKB-UHFFFAOYSA-N 381.247 5.146 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cnc(Cl)c(Cl)c3)cc2)c1 728006043 PMCPGPAKPUCOBL-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](Oc2ccc(Cl)cc2C)c2ccccc2)n1 730395797 XZAOFQVXXVIMMO-YLJYHZDGSA-N 396.899 5.410 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc1-c1ccc(F)cc1 730422056 SKPRWPPINKMLQP-OAHLLOKOSA-N 393.418 5.070 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 734060219 SARNUFWJDPHNRS-FQEVSTJZSA-N 389.524 5.503 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1cccc(CSC2CCOCC2)c1 734752268 CJJYDWZSNKLGSL-UHFFFAOYSA-N 396.339 5.862 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1cccc(OC(F)(F)F)c1 743055602 GSGRUEFIQKKVGB-RMKNXTFCSA-N 386.329 5.064 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc4nc(S)oc4c3)c2)cc1 746220309 HYXSTFIQEPGILR-UHFFFAOYSA-N 387.420 5.033 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3ccccc3OC(C)C)n2)cc1 749047333 FSAMUCAXUJWLRN-IBGZPJMESA-N 390.508 5.325 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)COc2c1ccc(Cl)c2Cl 753142462 CGUYRBHVIBGUJA-JXMROGBWSA-N 389.263 5.171 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1cc(Br)ncc1F 762427509 VEJLXIHLFOXOMU-SREVYHEPSA-N 389.249 5.003 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 763975121 FKNGDAPBRRSGHR-NRFANRHFSA-N 395.478 5.611 30 20 GKED Cc1c([C@H](C)NCc2ccc(C#N)cc2)cnn1-c1ccc(Cl)cc1Cl 765014971 ZBSBPUDKEAWKFZ-ZDUSSCGKSA-N 385.298 5.210 30 20 GKED C=CC[C@@H](N[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1)c1ccncc1 766022543 WUGQNKRBPUWXJB-MHECFPHRSA-N 376.475 5.768 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](Cn2cccn2)c2ccccc2)cc1 766135970 GLMJENRSTFVONR-PGRDOPGGSA-N 381.907 5.107 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2ccccc2s1 770095843 FEXXMPJGXZBOGN-HNAYVOBHSA-N 384.888 5.230 30 20 GKED Cn1c([C@@H](C#N)C(=O)C23CC4(C)CC(C)(CC(C)(C4)C2)C3)nc2ccccc21 773943808 OMPIQSYLCRSRLY-OWCYNOOXSA-N 375.516 5.136 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 774575500 LJOKGKZIFZRSCF-CVEARBPZSA-N 383.410 5.003 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2ccccc2)c2ccccc2Br)c1 779120763 OOVAVTZHLANDHQ-NRFANRHFSA-N 395.275 5.339 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCO[C@@H](C(C)C)C3)n2)cc1 781765508 OELSSKPPZZHSFC-HGHGUNKESA-N 382.529 5.136 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 785755732 YOBWNPCREBVNIC-NRFANRHFSA-N 386.517 5.090 30 20 GKED C[C@H](Cc1ccccc1)NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 786059014 XFOWMQMIRYDMIO-JPYJTQIMSA-N 385.536 5.260 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2cnn(Cc3ccccc3Cl)c2)c(Cl)c1 788361172 VXYDUZQZRQRMLA-SOFGYWHQSA-N 382.250 5.006 30 20 GKED O=C(/C=C\c1ccsc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 790219963 PLTVCWALXJPNMF-YFHOEESVSA-N 380.918 5.014 30 20 GKED N#C[C@@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1cnc2ccccc2n1 792105061 TUJOAUKIGSYXJX-FCHUYYIVSA-N 391.474 5.223 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)[C@@H](F)CC1CCCCC1 793021446 OQYOUZHOXXDJRZ-DGAVXFQQSA-N 391.371 5.321 30 20 GKED Cc1c(C(=O)Nc2ccc(SC(F)F)nc2)sc2ccc(C#N)cc12 794399351 QEONGDKUQFTRSD-UHFFFAOYSA-N 375.425 5.043 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)cc2)nc1 796448605 KWALSKDPJLIGFU-UHFFFAOYSA-N 389.430 5.109 30 20 GKED CC(C)=CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1O[C@H](C)C#N 799225915 RGEOLGTZMILKJV-QGZVFWFLSA-N 397.906 5.631 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2Cc3cccc(Cl)c3C2)cc1 806200871 OYHKOLMKZHLIRS-FQEVSTJZSA-N 387.870 5.543 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnnc(-c3ccccc3)c2)cc1 810115155 TZILEQPVBHSMNC-HSZRJFAPSA-N 390.446 5.051 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(C(F)(F)F)cc1 813212099 XFACPKZTPVIXPJ-QMTHXVAHSA-N 386.295 5.099 30 20 GKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1O 815636082 OGCYBEAAVVXSGE-RBUKOAKNSA-N 376.422 5.887 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2Cl)cc1 915999191 VQJWLHPJNYGYCS-UHFFFAOYSA-N 379.872 5.813 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)/C=C/c2cccs2)cc1 918629699 MIKNDBPARBPOQL-ZHACJKMWSA-N 376.456 5.001 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)CC(C)(C)C 920805633 DXJWIFBHRYDWMP-CHWSQXEVSA-N 376.472 5.727 30 20 GKED CC(C)CC(=NNc1ccc(F)c(C(=O)O)c1)c1cccc(Br)c1 1776062941 SMCDRVHKKGGBIU-UHFFFAOYSA-N 393.256 5.149 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1776665794 CYHBJLKVZLKOAE-FSURKZHVSA-N 398.458 5.350 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC)c(OCC(C)C)c1 1776784251 YNUXRHABFSSCIZ-IBGZPJMESA-N 379.541 5.023 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1Cl 1777360727 FBAWETULBYKLJM-WAPJZHGLSA-N 382.799 5.203 30 20 GKED C[C@H](C#N)OC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(Cl)cc1)CC2 4549112 AXUDSZCBQDNAIR-RGHBXIHOSA-N 388.854 5.444 30 20 GKED N#CCc1ccc(NC(=O)/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 15030305 BBCQJHBXEFQBFF-ZZXKWVIFSA-N 398.306 5.442 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2c(-c3c(Cl)cccc3Cl)noc2C)n1 41516007 QRRDVVVEQRALBL-SNVBAGLBSA-N 392.267 5.212 30 20 GKED N#C[C@@H](C(=O)CSc1cc(Cl)ccc1Cl)c1nc2ccccc2o1 41545930 FUVJUSVWIOMYIK-NSHDSACASA-N 377.252 5.103 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)cs2)o1 66800284 CYVVPFIHIPGIMI-AWEZNQCLSA-N 397.525 5.287 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2[nH]c(C(F)F)nc2c1 66802130 ASFRFLFXUPYPSR-NSHDSACASA-N 386.427 5.147 30 20 GKED COc1ccc(CC[C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66953925 AGPRAIBMUBSNRF-IRXDYDNUSA-N 397.544 5.232 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1nc2ccccc2s1 66954589 GVRJBZKOHDBHBO-CQSZACIVSA-N 396.541 5.354 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 66956223 MOUMVRDVEAVWDK-ROUUACIJSA-N 393.556 5.913 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2cccc(Cl)c2)n(Cc2ccco2)c1C 72076999 GPUQJRXMVMLPOO-UHFFFAOYSA-N 399.903 5.002 30 20 GKED N#C[C@@H](NC(=O)[C@@H]1CCCc2ccccc21)c1ccc(OCc2ccccc2)cc1 72096706 XMZRMCFRAZHMHQ-JWQCQUIFSA-N 396.490 5.067 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnn(-c2ccccc2Cl)c1 108239435 DXPCOGLSXSYLSQ-CQSZACIVSA-N 396.903 5.030 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cn3)c(F)c2)CCCC1 113124053 NAYKLRMSBLZOOO-UHFFFAOYSA-N 393.340 5.054 30 20 GKED N#Cc1ccccc1/C=C(/Cl)c1nc2scc(-c3cccs3)c2c(=O)[nH]1 120831431 QVEOUQUIUZVRDB-RIYZIHGNSA-N 395.896 5.322 30 20 GKED N#C[C@H](C(=O)c1ccn(C2CCCC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 121696669 LQKCNYLAYQNTQU-MRXNPFEDSA-N 396.903 5.265 30 20 GKED N#C[C@@H](C(=O)Cc1c[nH]c2ccc(Cl)cc12)c1nc(-c2ccccc2)cs1 124124736 WZCQWBOIEGKNFB-KRWDZBQOSA-N 391.883 5.364 30 20 GKED CC(C)OC1CCC(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 162997695 MOXVKYLRCWXGIJ-UHFFFAOYSA-N 393.487 5.208 30 20 GKED COc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 173123754 NBFUQCRIWYRNQS-IRXDYDNUSA-N 397.544 5.184 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCC[C@H]3c3cccc4ccccc34)o2)cc1 173566483 PSBUYNZWUZBXEB-QFIPXVFZSA-N 380.451 5.099 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N(C)Cc3ccc(C#N)cc3)ccc2C)c1 174036273 UKXLHFVZANSLRT-UHFFFAOYSA-N 386.455 5.026 30 20 GKED COc1ccc(CN[C@@H](C)c2c(F)cccc2Cl)cc1OCCCC#N 177714364 BWXSZRUOOUILDO-AWEZNQCLSA-N 376.859 5.021 30 20 GKED N#C[C@@H](C(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2o1 178257518 YRIJDDZVGIAKEE-GFAPJHNFSA-N 390.748 5.303 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 180202893 DWGUIJJSTLLASA-LLVKDONJSA-N 398.837 6.005 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2C[C@H](C)Sc3sccc32)ccc1OC 180816803 NEZHFOTUGJCLML-YSVLISHTSA-N 388.558 5.153 30 20 GKED N#Cc1cc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1Oc1ccccc1 187153002 FEQRCXOAPDIBIN-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C=CCN(C(=O)[C@@H](C)c1cccc(OC)c1)c1nc(-c2ccccc2)cs1 195602469 ORIJBKPIIYMNDX-INIZCTEOSA-N 378.497 5.141 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(F)c3C)o2)c1 237023081 UGIMZIRLUHDNPY-SFHVURJKSA-N 378.447 5.365 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303289854 MEBGQHIDDJBPID-QZTJIDSGSA-N 396.556 5.776 30 20 GKED Cc1c(C(O)=Nc2cc([C@H]3CCCOC3)nn2C)oc2c1ccc1ccccc12 329867167 VPIQLVWQJUMDMD-INIZCTEOSA-N 389.455 5.158 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1nc(C(C)(C)C)cs1 330027030 MKKCAOOWSIUDAK-GRTSSRMGSA-N 377.554 5.383 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cccc(F)c2Br)c1C#N 410933038 VUGVIRSYICIJQH-UHFFFAOYSA-N 381.270 5.071 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(CN2CCCCC2)c1 412094219 RLDWXOYCXUMBBL-SFHVURJKSA-N 393.556 5.319 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 425380565 DFIZJXSOGBBKOG-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c(Cl)c1 426133624 MBOSCHVIXAUEBN-FQEVSTJZSA-N 378.863 5.452 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1 430100506 NJZMBWZLZYBNAB-VQIMIIECSA-N 394.931 5.431 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430585120 QZBBKQLVWOBCON-AWEZNQCLSA-N 376.909 5.371 30 20 GKED Cc1oc(C#N)cc1C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 436178538 VORYFLAXMNUBQI-JTQLQIEISA-N 385.876 5.036 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)NCC1CCC(C#N)CC1 441626764 QZNBSUYHBDJBNB-UHFFFAOYSA-N 377.488 5.026 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2OC2CCCC2)c2ccccc21 444030828 LZPSVDQAURFSAF-UHFFFAOYSA-N 387.483 5.519 30 20 GKED CC(C)(C#N)CCCCN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 444668179 CBOJCTSFDVKEAZ-NRFANRHFSA-N 378.495 5.226 30 20 GKED C[C@H](c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1)C(F)(F)F 453780839 QBMSXRJVUODFLM-BXUZGUMPSA-N 380.435 5.596 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 454625092 WLICENWLYVIDCC-UHFFFAOYSA-N 389.377 5.157 30 20 GKED Cc1ccc(C(=O)C2CCN(c3c(C#N)cnc4c(C)cc(C)cc34)CC2)cc1 462372012 IXLOIFFVONVFMW-UHFFFAOYSA-N 383.495 5.131 30 20 GKED C/C(=C/c1ccc(Cl)cc1)CNc1ccc2c(c1)CCC(=O)N2CCCC#N 469027570 RATITTGSOGFNNW-VKAVYKQESA-N 393.918 5.438 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)C[C@@H](CC#N)c3ccccc3)cc2)cs1 474701859 OMIIUBFKDDPOKY-IIBYNOLFSA-N 389.524 5.383 30 20 GKED C=CCCCCCN(C)C(=O)c1c(-c2c(Cl)cccc2OC)noc1C 476092131 RHBGZIDAFQIYEV-UHFFFAOYSA-N 376.884 5.130 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(Cc2ccc(F)cc2)s1 476121486 NSRKSBJSUQDTSF-UHFFFAOYSA-N 394.515 5.977 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](c1cccc(Cl)c1)c1ccccn1 481654468 VKFCNDSATOFPJD-ISKFKSNPSA-N 387.914 5.753 30 20 GKED CN1CCC[C@H](CN[C@@H]2CCCCc3cc(C#N)ccc32)[C@@H]1c1cccs1 481667827 KNBAYLRKYHKQBD-KJXAQDMKSA-N 379.573 5.060 30 20 GKED CC[C@H]1CCc2ccccc2N1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 482836359 MVJVXOOPXUXKMS-FQEVSTJZSA-N 383.451 5.117 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)C1 483488057 HCHRDCSMQZVONV-WIYYLYMNSA-N 396.918 5.340 30 20 GKED CC1(C)C[C@@]1(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 484912262 SHZAHTBMHYPJKL-FQEVSTJZSA-N 382.510 5.209 30 20 GKED Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 485246137 OWGSPAYOMBLILL-UHFFFAOYSA-N 394.434 5.301 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 485246540 PWKUBYOWEUWCNE-DYESRHJHSA-N 381.545 5.908 30 20 GKED N#CCCC[C@H](NC(=O)CCc1ccccc1OC(F)(F)F)c1ccccc1 487474390 ODZQZIKCNHRLJV-SFHVURJKSA-N 390.405 5.069 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 505022117 AKWYQCZOUJIHHE-UNMCSNQZSA-N 382.479 5.328 30 20 GKED Cc1ccc2c(CCC(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)c[nH]c2c1 505982030 PIKYLLLXWPABRP-IBGZPJMESA-N 386.282 5.097 30 20 GKED CCCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@H](C)c1ccccc1OC 510615088 LLQGKRJDXHDVDX-MRXNPFEDSA-N 382.508 5.128 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1nc2ccccc2s1 513676713 JLEUYOUYJCBGSG-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 517734682 BDTFSGIOVQPKPU-OXJNMPFZSA-N 392.890 5.009 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 518168805 LHCRXPUAISKYHL-CVEARBPZSA-N 393.512 5.909 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518905239 LRBDPZODYZWAKX-SFHVURJKSA-N 385.467 5.186 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Br 519847590 ZAVIOALGBUJHTL-AUUYWEPGSA-N 375.285 5.674 30 20 GKED COc1cccc([C@@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 520197809 PZEOMLPTCQIZOR-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)CNc2ccccc2S[C@@H](C)CC#N)cc1 520200680 NKOKZDFYHDNPOD-SJORKVTESA-N 381.545 5.645 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cccc(-c4cscn4)c3)c2C#N)C1 524767438 HTCJAZHSFCUOAD-LBPRGKRZSA-N 379.510 5.120 30 20 GKED C=CCC[C@@H](NC(=O)c1cc(C)n(C(F)F)n1)c1ccc(C(F)(F)F)cc1 534204207 ZBFPBFOXBMCYCQ-CQSZACIVSA-N 387.352 5.043 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 540821535 JRAYTXSLCDXTJZ-RTBURBONSA-N 387.405 5.229 30 20 GKED C[C@@H](C1CCCCC1)[C@@H](C)NCC(=O)Nc1ccccc1SC[C@H](C)C#N 541602197 HVADHMHEJVGDNC-KZNAEPCWSA-N 387.593 5.071 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2C2CC2)cc1Cl 542223081 XHLJCCBUVMLGSY-FQEVSTJZSA-N 387.870 5.520 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 543944199 IUYUWQVNJCIFIZ-QZTJIDSGSA-N 399.494 5.394 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccccc2)c2ccc(F)cn2)cc1 544379963 TXECIAPELBCJNR-AREMUKBSSA-N 393.465 5.639 30 20 GKED N#CCCN(C(=O)c1cccc2cccc(Br)c12)c1ccc(F)cc1 552159202 NAKQKKSSJDVKIC-UHFFFAOYSA-N 397.247 5.302 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1nc(C(C)(C)C)cs1 553403770 ARHKICAPOKTGGR-CYBMUJFWSA-N 388.562 5.014 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC(C)(C)CC1 561293891 PMRWFMUZFNUHFA-UHFFFAOYSA-N 377.488 5.100 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCc1c(Cl)cccc1Cl 562293546 NCIBZPBYHQHFQX-UHFFFAOYSA-N 395.334 5.059 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1 567192968 VPURACZTVJDENH-LJQANCHMSA-N 388.870 5.045 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(F)c(Br)c1 590194983 OYCLDDVYSNGHDY-CYBMUJFWSA-N 375.285 5.240 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1 591780633 GTZTWDDTAJHHED-UHFFFAOYSA-N 384.226 5.007 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)C1 597912811 WMPRLFVDTHDFJH-AWEZNQCLSA-N 389.282 5.552 30 20 GKED CCOc1ccc(NC(=O)c2ccc(N[C@H](C)c3cccc(C#N)c3)cc2)cc1 600848701 HTUSTTCJFKNPMT-QGZVFWFLSA-N 385.467 5.382 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)Nc3sc(C)c(C)c3C#N)s2)cc1 603564500 KPRDYTHFMOZAMB-UHFFFAOYSA-N 397.525 5.320 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)ccc2F)sc2c1-c1ccccc1CC2 603991965 JCQNYYLQOBDFHE-UHFFFAOYSA-N 382.847 5.430 30 20 GKED C[C@H]1C[C@@H](C)CN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 609079732 HHFQKULHYWDJTO-IYBDPMFKSA-N 397.906 5.300 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)Cc1ccccc1C 609208194 HSHOWBDWCRZKJJ-UHFFFAOYSA-N 385.467 5.110 30 20 GKED Cc1nc(CSc2ccc(C(=O)N(C)c3ccc(C#N)cc3F)cc2)cs1 609217279 BHQSJVRUQBHLDP-UHFFFAOYSA-N 397.500 5.031 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(C(F)(F)F)c1 609460405 KVLUREWZDMKFBI-AWEZNQCLSA-N 378.350 5.054 30 20 GKED C[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609880306 DSSSFHYWBSTJSU-QLVMHMETSA-N 378.447 5.283 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H]2c2cccc(F)c2)cc1 611042196 JKTHYHIBAKYGTG-NRFANRHFSA-N 387.414 5.469 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 613407327 QVLQKDNYRZRHET-LLVKDONJSA-N 399.884 5.465 30 20 GKED C[C@H](NCc1ccnc(C#N)c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 616863965 DZNFZIFVFISMLB-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCSc2ccc(Br)cc21 618807999 YJDBCNLIZTZMMT-ROUUACIJSA-N 385.330 5.135 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(c2cccc(F)c2)CC1 619125575 SLEFMBJHJYPHRM-UHFFFAOYSA-N 385.323 5.027 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1c(F)ccc2ccncc12 619130087 XLJTYASBOMHZSS-UHFFFAOYSA-N 396.306 5.157 30 20 GKED C[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1cccc(C#N)c1 619670730 ANRUDVANKGYERU-LBPRGKRZSA-N 384.266 5.351 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCc2cc(F)ccc21 622585798 KRRYYTWHYZAPTF-UHFFFAOYSA-N 377.259 5.066 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 648494537 WYMUIHDSJQXOEQ-UHFFFAOYSA-N 397.246 5.024 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@]3(C)CCCc4ccccc43)n2)cc1 726322373 SMHHDGCXKAPILQ-DVECYGJZSA-N 386.520 5.589 30 20 GKED CCCN(CCC)c1ccc(/C=C/C(=O)c2ccc(OC)c(NC(C)=O)c2)cc1 726430476 YWYRQNAKBNQUGM-UKTHLTGXSA-N 394.515 5.176 30 20 GKED O=C(/C(=C/C1=Cc2ccccc2OC1)c1nc2ccccc2s1)c1ccccc1 726742719 WYOJCENXFNAXFY-HKWRFOASSA-N 395.483 6.039 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1ccccc1Br 727262487 RPHAEZNDFPPQKD-UHFFFAOYSA-N 387.199 5.226 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1cccc2cnccc12 728432618 ZJMWMFLGFHQHNF-UHFFFAOYSA-N 393.853 5.027 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 729165983 XNLPCRBBFAEOIU-CQSZACIVSA-N 395.528 5.287 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 731167099 KYUDDUPSXUPKNK-PKTZIBPZSA-N 391.474 5.079 30 20 GKED C[C@H]1C[C@@H]1c1ccc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)o1 732765249 XAVWQXSVSRQBSK-ZANVPECISA-N 393.299 5.139 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)c2cccc3ccccc23)c1 733845547 DLEHTLJDNBURLK-PXNSSMCTSA-N 387.483 5.081 30 20 GKED C=CC[C@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccncc1 734509252 JRKTXZAIXVBEHE-NRFANRHFSA-N 388.471 5.165 30 20 GKED N#C[C@H](C(=O)/C=C\C1CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 735593487 MVKJRYNCENBLLC-IQCBXXCUSA-N 378.419 5.628 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc(C#N)c(Cl)c3)c2)s1 740432315 YPGUQXYKCRJNJF-UHFFFAOYSA-N 392.871 5.134 30 20 GKED CC(C)C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 741111775 YLZOAABOEXNCCS-DLBZAZTESA-N 381.426 5.438 30 20 GKED C/C(=C/C(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccc(C(F)(F)F)c1 742628984 AYLCWBBTIOSAOO-XFFZJAGNSA-N 396.315 5.220 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCCc2ccccc2)c1)c1cccc(C#N)c1 743111758 YVKBIHIYYIIPBL-GOSISDBHSA-N 385.467 5.062 30 20 GKED COc1ccc(Cl)c(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)c1 747706893 SGGLKRXTJONIIG-UHFFFAOYSA-N 399.947 5.362 30 20 GKED CCc1oc2ccccc2c1C=NO[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 747827436 NBEIRLKBJINTOG-ZDUSSCGKSA-N 395.846 5.810 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nccs1 752485700 PRRIBHAOFDXMBH-UZLBHIALSA-N 390.512 5.066 30 20 GKED C=CCc1cc(CN[C@H]2CCOc3c2ccc(Cl)c3Cl)cc(OC)c1O 752987236 SJOXFZWBUNYABR-INIZCTEOSA-N 394.298 5.050 30 20 GKED CC(C)(C)OC(=O)N1CCc2cccc(/C=C\C(=O)c3cc(F)ccc3F)c21 757530155 SGHZUBKSIHFNJC-YFHOEESVSA-N 385.410 5.159 30 20 GKED O=C1/C(=C\c2nc3ccc(F)cc3s2)CCc2ncc(C(F)(F)F)cc21 761486880 QMMMGMOHBLXCHV-UITAMQMPSA-N 378.350 5.062 30 20 GKED COc1cccc(-c2nn(C(C)(C)C)cc2/C=C\C(=O)c2ccc(C#N)s2)c1 762441893 CYXZEQLJKKBCFS-NTMALXAHSA-N 391.496 5.143 30 20 GKED Cc1sc2ncn(N=Cc3cscc3Cl)c(=O)c2c1-c1ccccc1 771870978 IROKEWFVHPRAPG-UHFFFAOYSA-N 385.901 5.031 30 20 GKED Cc1ccsc1CCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 774022986 LKBGCBOBMMHUEU-HXUWFJFHSA-N 375.497 5.076 30 20 GKED CC(C)(C#N)c1ccc(CN2CCC([C@H](O)c3ccc(Cl)cc3)CC2)cc1 775601541 WMQCUQUNCVDFFD-JOCHJYFZSA-N 382.935 5.087 30 20 GKED O=C1/C(=C/c2cnc(-c3cccs3)s2)CCc2ncc(C(F)(F)F)cc21 777469529 DTTFVJDQJDWHQI-UXBLZVDNSA-N 392.427 5.498 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(Oc3ccccc3)o2)S1 779708433 WSGQKGAEEUWXSD-QGOAFFKASA-N 390.464 5.580 30 20 GKED N#C[C@H](C(=O)Cc1cc(Cl)ccc1Br)c1nccc2ccccc12 790798298 DJJWARNSTJJZNN-MRXNPFEDSA-N 399.675 5.070 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 793538459 CZHOGWJFEZVXNQ-UHFFFAOYSA-N 385.492 5.018 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC([C@@H](O)c2ccccc2C)CC1)c1ccccc1 805223270 HMCMOANVCUNEFG-DNQXCXABSA-N 392.543 5.158 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)c1 810990811 UYKBOMNTUOEHNA-UHFFFAOYSA-N 392.842 5.216 30 20 GKED COc1cccc2c1[C@@H](C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 814305928 RHZFHWYMSXEWMR-VXKWHMMOSA-N 382.463 5.019 30 20 GKED CCCc1ccc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 842699087 HSVJUFDPTLOCIZ-HXUWFJFHSA-N 389.524 5.357 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 845840779 FOSAJDNTBXCXDH-CJNGLKHVSA-N 386.278 5.107 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccco1 860477130 AVGSLYIRGRRYMV-ZYHUDNBSSA-N 378.375 5.278 30 20 GKED Fc1cccc(F)c1C(F)(F)c1nc(-c2ccc(C(F)(F)F)s2)no1 904974909 LMCQGLNWVTWUCS-UHFFFAOYSA-N 382.260 5.235 30 20 GKED Fc1ccc(NC(=S)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 914707649 XXPVFNNLHOFEMD-RKDXNWHRSA-N 388.352 5.022 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3ccc(F)cc3)n2)cc1 921133795 YINKRAZLIUOBAS-KXBFYZLASA-N 378.472 5.313 30 20 GKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1sccc1Br 921265337 DNECCJARQQPHGV-ZZXKWVIFSA-N 391.208 5.348 30 20 GKED C=CCOc1c(Cl)cc(/C=C/c2cc(C(=O)O)c3ccccc3n2)cc1OC 1776183187 XUDMGUVVNGVTOG-CMDGGOBGSA-N 395.842 5.330 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2cc(C(=O)O)cs2)cc1)c1ccccc1 1776469461 YLSZMIMXIUWMPD-QYMJWVLRSA-N 378.449 5.482 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cccc(Oc3ccccc3)c2)c1)C(=O)O 1776471055 FBRLQFKDAQNMMW-LKBMAGLMSA-N 388.419 5.227 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)c(Cl)c1 1777353286 OXTXXFDGTIHTBP-MDWZMJQESA-N 392.838 5.610 30 20 GKED C=CCn1c(SCc2c(F)cccc2Cl)nnc1-c1ccccc1OC 4196893 JUSKQXIZVPKROZ-UHFFFAOYSA-N 389.883 5.225 30 20 GKED C[C@@H](SCc1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 22694812 FZBOTEXBYVQGEW-LLVKDONJSA-N 376.934 5.022 30 20 GKED CN(Cc1ccccc1N1CCCC1)C(=O)c1ccccc1-c1ccccc1C#N 28093481 QAEHYEFQKLAKOO-UHFFFAOYSA-N 395.506 5.098 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2oc3c(ccc4ccccc43)c2C)cc1 29200736 XEMRVAPHRCWPDQ-UHFFFAOYSA-N 399.450 5.454 30 20 GKED CC(C)c1ccc(NCC(=O)Nc2ccccc2SCC#N)c(C(C)C)c1 29641897 OLXQFYVDXHAUNT-UHFFFAOYSA-N 381.545 5.600 30 20 GKED N#C[C@@H](C(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccccn1 41493697 YUEGHLQXLBAWGX-DENIHFKCSA-N 392.911 5.434 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)Nc1cccc(C#Cc2cccs2)c1 43996095 QZSJDRWAMUZJAJ-HNNXBMFYSA-N 378.522 5.361 30 20 GKED N#CCSc1ccccc1NC(=O)CSCc1c(Cl)cccc1Cl 60825195 VSAQSWRAIRBPOT-UHFFFAOYSA-N 397.352 5.481 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl 63640958 MAVORZMTZODGHQ-LBPRGKRZSA-N 392.286 5.091 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)c1 66329160 KRAOJJJZJOULTL-UHFFFAOYSA-N 388.389 5.058 30 20 GKED N#Cc1ccc(F)cc1CSc1nnc(-c2ccncc2)n1C1CCCCC1 124468563 YZZOXJTWJBZPPU-UHFFFAOYSA-N 393.491 5.148 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cccc(Cl)c3SC(F)F)o2)cc1 133980178 UCWISTFAQXHSPB-UHFFFAOYSA-N 392.818 5.188 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nccs1 158733016 KJXXFYGKWOKWNR-OAQYLSRUSA-N 392.484 5.254 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c(C)[nH]c2ccccc12 171020468 LDDDPAFXSGADHW-UHFFFAOYSA-N 382.423 5.096 30 20 GKED Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 173553400 HECGRNLHJXCBMA-DYESRHJHSA-N 380.488 5.009 30 20 GKED C[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174492926 BTZVRAXNZFTFAR-HNNXBMFYSA-N 390.418 5.110 30 20 GKED Cc1ncccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 178317696 SUXOMMJTJCFWEZ-AWEZNQCLSA-N 388.279 5.310 30 20 GKED C[C@@H](NCc1ccc(CO)c(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 178561169 KKUUDANJZYVPFH-SNVBAGLBSA-N 395.318 5.206 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cc2)cc1 182876788 IUGUFSFPWYEABX-FQEVSTJZSA-N 396.402 5.313 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](c1ccccc1)c1cccnc1)c1ccc(F)c(F)c1 185475161 PJUDPAXXVNQBMS-FGZHOGPDSA-N 393.437 5.066 30 20 GKED Cc1cc2occ(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c2cc1C 187483543 ZCJVLDIIPCKKKC-CQSZACIVSA-N 379.366 5.285 30 20 GKED Cc1ccccc1-c1noc(C)c1/C(O)=N/C1CCN(C2CCCCC2)CC1 330016458 PORICDCSTZKBEY-UHFFFAOYSA-N 381.520 5.060 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(F)c2Br)c(C#N)s1 410621512 UCMOTLRCQVTLIT-UHFFFAOYSA-N 381.270 5.071 30 20 GKED CC(C)c1ccc([C@H](N)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 415159532 JROAHMVDCCYZIE-VQIMIIECSA-N 396.560 5.026 30 20 GKED COc1ccccc1-c1nnc(S[C@H]2CC[C@@H](C#N)C2)n1-c1ccc(C)cc1 430145831 KAGWQHZHNXJYHJ-AEFFLSMTSA-N 390.512 5.036 30 20 GKED Cc1c(NC(=O)N[C@H](CCCC#N)c2ccccc2)cccc1C(F)(F)F 433284160 DNNJOEOYFBVQAN-GOSISDBHSA-N 375.394 5.571 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1 433743103 VNDYESQHWJRMIY-AWEZNQCLSA-N 390.430 5.124 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 438065428 MXDXYAWZEYJVAW-TZYHBYERSA-N 378.516 5.037 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cc(C#N)oc2C)c(C(F)(F)F)c1 439109142 FCKAHCFSMRUHPT-JTQLQIEISA-N 382.407 5.621 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442259109 LVCCLYWZPNRAIY-UHFFFAOYSA-N 384.266 5.132 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)cc1 444857628 JINXBESGVBFSOO-FQEVSTJZSA-N 381.907 5.900 30 20 GKED C=CCC1(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CCC1 447687581 DDJKAUHNHALPGR-UHFFFAOYSA-N 378.259 5.261 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCC(=O)C2CC2)cc1Cl 448709153 OHXBRHLYYGGCNE-LJQANCHMSA-N 380.875 5.083 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2ccc(CC#N)cc2Cl)C1 452646338 QCTUFYHWXMTRTK-AEFFLSMTSA-N 376.928 5.500 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@H]3CCC[C@@H]32)c1 460395888 WBOBQYAMEOCURR-QRWLVFNGSA-N 380.875 5.409 30 20 GKED C[C@H](C(=O)N(C1CC1)[C@@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 463384674 MCAARVQIONXJQJ-GJZGRUSLSA-N 386.417 5.433 30 20 GKED CCOCc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 464984839 ZEUIUVMZNRMFTC-UHFFFAOYSA-N 388.492 5.498 30 20 GKED C[C@@H](NC(=O)NCc1cc(C#N)ccc1F)c1ccc(Oc2ccccc2)cc1 465821541 UDGNMPKWVAAVKA-MRXNPFEDSA-N 389.430 5.050 30 20 GKED C[C@@H](C(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccc(C(F)(F)F)cc1 466356125 MVVDFRLWKBRMMJ-MRVPVSSYSA-N 395.274 5.327 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 466392579 NQKPIAVGXWDKHZ-IRXDYDNUSA-N 399.560 5.062 30 20 GKED C=C[C@@](C)(CC)C(=O)NCc1ccc(Cl)c(NC(=O)[C@@](C)(C=C)CC)c1 467972428 ZUBPXDUNBSLBQW-SFTDATJTSA-N 376.928 5.099 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 469359985 WZZRKLVVHSAXGW-VWLOTQADSA-N 385.511 5.057 30 20 GKED CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 470023147 WYOMMKUNYZANSO-LAUBAEHRSA-N 379.504 5.105 30 20 GKED FC(F)Oc1ccc([C@H](NCc2cccc(C(F)F)c2)C(F)(F)F)cc1 470777960 AJXANVVMBRBQEM-AWEZNQCLSA-N 381.291 5.619 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471260228 YCFNXJPYTCTQOU-SECBINFHSA-N 377.256 5.163 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)cc1 475894689 ADICJWCNABJNTO-UHFFFAOYSA-N 380.451 5.283 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(CSC3CCOCC3)c2)cc1 476072788 SGIJNNQTULGXSF-UHFFFAOYSA-N 394.540 5.152 30 20 GKED CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(CC#N)cc1 478243858 XFWPIMKFTIOQDC-QFIPXVFZSA-N 387.527 5.115 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(F)cc3)n2)nnc1-c1cccs1 481368011 FAWSISLZUMAPML-UHFFFAOYSA-N 398.488 5.279 30 20 GKED CCc1c(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1C(CC)CC 484165840 VKDPUUCWROESRJ-HNNXBMFYSA-N 399.564 5.702 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 484345625 AQJHHIVITAOBKY-OAHLLOKOSA-N 396.487 5.486 30 20 GKED N#Cc1cccc(C2(NC(=O)Nc3ccccc3COCc3ccccc3)CC2)c1 492147372 BGGLTPCJPHRWSX-UHFFFAOYSA-N 397.478 5.086 30 20 GKED Cc1ccc(Oc2ccccc2)c(NC(=O)N(CCC#N)Cc2ccco2)c1 494104952 GFXHWTGRZUFXHP-UHFFFAOYSA-N 375.428 5.328 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(OC(F)F)c1 500766458 BSQGIQUKOIYHMU-UHFFFAOYSA-N 394.377 5.513 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@@H]1c1ccccc1Cl 501017106 HNUCTMNBCUBCQL-RTBURBONSA-N 376.843 5.142 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCc2cccc(Br)c2C1 505000374 CYIRQZKIYQURCC-UHFFFAOYSA-N 385.305 5.158 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C2CCC(OC(F)F)CC2)cc1 506758057 JJQSBFUVHNQTTP-UHFFFAOYSA-N 386.398 5.087 30 20 GKED COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)c1cccc(CC#N)c1 509130427 WYFQQZGRZCINTL-HXUWFJFHSA-N 398.506 5.035 30 20 GKED C[C@]12CCN(C(=O)Nc3ccc(Sc4ccccc4C#N)cc3)C[C@@H]1C2(F)F 518106592 WZSFHBUWJNURAY-ICSRJNTNSA-N 399.466 5.218 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 518239809 MNQFPDUEHNSEHU-GJZGRUSLSA-N 388.920 5.449 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2sccc2C#N)cc1Cl)c1ccccc1 520568362 MFGOKISXUCWJJA-ZDUSSCGKSA-N 381.888 5.699 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1c(F)cccc1F 521811189 WVUZPRQTJVCSAX-AWEZNQCLSA-N 393.393 5.511 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccccc3Cl)n2)sc2c1CCC2 524290284 DLPCODHVQLXMEZ-UHFFFAOYSA-N 385.901 5.138 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN[C@@H](C)c2cc3ccccc3s2)c1C 526944824 ISDCGIMVQMIIMO-SFHVURJKSA-N 391.540 5.116 30 20 GKED Cc1sc(NC(=O)CN[C@H](C)c2ccc(SC(C)C)cc2)c(C#N)c1C 537100123 FCQZYUCGQZWKRF-CQSZACIVSA-N 387.574 5.026 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(=O)c1c[nH]c2ncccc12 541089176 KXXJIBVUZNVMOM-SJORKVTESA-N 394.478 5.024 30 20 GKED CN(C(=O)Cc1cccc(F)c1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 543106700 DIIXDROQEPJMLF-INIZCTEOSA-N 393.302 5.149 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(Cl)c4ncccc34)n2)cc1 548938648 WNQVGIOKVOOEGM-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 549928426 STYGOZBDXUTIRJ-LJQANCHMSA-N 397.931 5.146 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cc2ccccc2s1 553319871 GQEWMRPOAJSGSY-CQSZACIVSA-N 381.526 5.617 30 20 GKED CC(C)(CCC#N)CNC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 557999597 JGTJNZQSINAERL-UHFFFAOYSA-N 388.842 5.633 30 20 GKED C=CC[C@H](C(=O)N1CCC(c2noc3cc(F)ccc23)CC1)c1ccccc1 576735912 IAGTVURKBRHMNL-IBGZPJMESA-N 378.447 5.033 30 20 GKED O=C(NCCc1ccc(C(F)(F)F)cc1)Nc1ccc(F)cc1C(F)(F)F 590335437 NNCPJIXERUEYQH-UHFFFAOYSA-N 394.290 5.228 30 20 GKED CC[C@H](C)c1nc(C)c(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)n1 593973532 CSWVZYLLACOLMN-GJZGRUSLSA-N 396.560 5.040 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1F 595689906 FOWFMBXVJRTJMD-AOMKIAJQSA-N 399.535 5.003 30 20 GKED CC[C@H](Nc1ccc(Cl)cc1SCCC(=O)OC)c1ccc(C#N)cc1 600853893 JMAQSDQTIQMWEO-KRWDZBQOSA-N 388.920 5.430 30 20 GKED CN(C)Cc1cccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 604455157 DRKHBPIHPVAVAZ-UHFFFAOYSA-N 386.455 5.056 30 20 GKED C=CCn1c(SCCCc2cccc3ccccc23)nnc1-c1ccncc1 605446368 BVRGOYRZORGUCE-UHFFFAOYSA-N 386.524 5.404 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1ccccc1Cl 609061614 FLXKXYPNHFIDND-UHFFFAOYSA-N 390.870 5.280 30 20 GKED CCCCOc1ccc(C(=O)N(C)c2ccc(C#N)cc2F)cc1OCCCC 609217869 VXZVEIYRUOKETP-UHFFFAOYSA-N 398.478 5.332 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609504084 NVYQHABXQSCUOU-INIZCTEOSA-N 389.480 5.112 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 609566713 GERQKXCGJWLHOE-QFIPXVFZSA-N 398.506 5.539 30 20 GKED CCc1ccccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723479 XLTJISSLBTYLDX-UHFFFAOYSA-N 376.843 5.819 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610322736 MRRKMSOCGGLRJB-QGZVFWFLSA-N 396.450 5.413 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@@H]1CCCCO1 611480916 TVVDBLCFDJQEMD-ZRCAFCQKSA-N 397.906 5.075 30 20 GKED CC(C)(C)Sc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726748315 WCRLHAWLTAXLEY-UHFFFAOYSA-N 375.950 5.911 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 727233118 GFDNLYJBRXLCOE-HNAYVOBHSA-N 399.466 5.425 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730476011 YEQRJEPSCKIRPM-NTKDMRAZSA-N 398.506 5.558 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)Nc1ccccc1F 730955362 YZHRMOLAZBRJGO-UHFFFAOYSA-N 399.438 5.659 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccc(F)cc2)C(C)(C)C)c1 733849419 XAEHYNCJMDIDFJ-TZIWHRDSSA-N 397.494 5.093 30 20 GKED C=CC[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc(C)cc1)c1ccncc1 734510158 RTMCJQHITMQJOU-RUZDIDTESA-N 394.522 5.650 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(Cl)c2Cl)cc1OCCCC#N 734979776 DPOVIYHPYRBIFJ-CLFYSBASSA-N 390.266 5.581 30 20 GKED N#C[C@@H](C(=O)CC/C=C\c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 739156150 LHICBJDRBKQLMK-KYLNKMBASA-N 392.911 6.133 30 20 GKED CC(C)(C#N)CCSc1nnc(Nc2ccc(SC(F)F)cc2)s1 741446990 HJOVWRXGVBMXLN-UHFFFAOYSA-N 386.518 5.628 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1ccc(N2CCCCC2)c(F)c1 742430800 FFJCJPNBQJHTLT-ZRDIBKRKSA-N 375.447 5.102 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)O1 744037204 PONCUSJPDRZPQU-MYQFVTIZSA-N 398.572 5.135 30 20 GKED Cc1ccc(NC(=S)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)cc1 745724141 KRNJVSCKLJHZGD-UHFFFAOYSA-N 389.499 5.718 30 20 GKED C=CC[C@@H](NC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1)c1ccncc1 745827410 JXWWWIWOFIJOGA-RPWUZVMVSA-N 383.495 5.208 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 748649445 DDGGPUNLNLWLNV-UHFFFAOYSA-N 390.508 5.128 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2ccccc2Cl)n1)Cc1ccccc1 750784570 QGQTZWUGBJKUQH-OAHLLOKOSA-N 382.872 5.003 30 20 GKED Cc1nc([C@H](C)OC(=O)c2ccc(CC#N)cc2)oc1-c1ccc(Cl)cc1 758689076 UWQSVHWWFSLTRB-AWEZNQCLSA-N 380.831 5.288 30 20 GKED C=CC[C@H](NC(=O)c1ccc(Oc2ccc(C(C)=O)cc2)cc1)c1ccncc1 760465182 ONDHWNZAOQJIQV-QHCPKHFHSA-N 386.451 5.124 30 20 GKED COc1ccc(/C=C2\CCOc3c(C)cc(C)cc3C2=O)cc1OCCCC#N 763116725 MLADTXYFDDUMEF-XMHGGMMESA-N 391.467 5.043 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc3ccccc3s2)c(Br)c1 773956369 SBMAQHCJMYUKBV-AWEZNQCLSA-N 399.313 5.176 30 20 GKED C[C@@H](N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779082370 MPDAJICAAQQDPW-OPAMFIHVSA-N 391.515 5.633 30 20 GKED Cc1nc2c(s1)[C@@H](NCc1cccc(OCc3cccc(C#N)c3)c1)CCC2 779988784 RGWNIQFAMNPMIK-NRFANRHFSA-N 389.524 5.069 30 20 GKED C=CCC[C@@H](NC(=O)Cc1ccc(Cl)cn1)c1ccc(C(F)(F)F)cc1 786434667 BUSQYUOXPUYESZ-QGZVFWFLSA-N 382.813 5.120 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)Cc1nc(-c2ccc(F)cc2)cs1 787013418 LHVKDVXZSFKMTQ-UHFFFAOYSA-N 394.471 5.036 30 20 GKED CC[C@@H](CC#N)OC(=O)c1oc2ccccc2c1CSc1nc(C)cs1 787089586 JFXZERQBCQOGJA-ZDUSSCGKSA-N 386.498 5.339 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccccc3SC(F)(F)F)on2)c1 789921811 LIAOICWRMRSTPQ-UHFFFAOYSA-N 389.358 5.077 30 20 GKED N#Cc1ccc(C[C@@H](C#N)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 791440785 VBFLDBOXTLOKQE-IBGZPJMESA-N 379.423 5.295 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Nc2ccc(O)c(Cl)c2)cc1 792733338 VAXNIXBHRHUOCS-GOSISDBHSA-N 377.831 5.345 30 20 GKED N#C[C@@H](C(=O)COc1ccccc1-c1ccccc1)c1cc(C(F)(F)F)ccn1 813211748 PMMQROSLUHMHHT-GOSISDBHSA-N 396.368 5.023 30 20 GKED CCOc1c(Cl)cc(C=NOCc2cccc(C(F)(F)F)c2)cc1OC 826544808 UTCDNRWOWWNVPU-UHFFFAOYSA-N 387.785 5.317 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842944344 JIKUPTNBXBKYHI-INIZCTEOSA-N 397.500 5.166 30 20 GKED CC(C)(C)c1ccc(C=Nn2c(S)nnc2SCc2ccccc2)cc1 916368579 HYLBUNHKAXTHNP-UHFFFAOYSA-N 382.558 5.039 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccccc2Cl)cc1 916947449 KPPZGBCKJMUBGK-DNVCBOLYSA-N 382.891 5.134 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc2c(c1)Nc1ccccc1S2 1776073499 YGXFHVBMOGBUKJ-UHFFFAOYSA-N 393.443 5.568 30 20 GKED O=C(O)c1ccc(/C=C\C(=O)c2ccccc2OCc2ccccc2)c(Cl)c1 1776126428 LNVLMULLPWBXQD-SEYXRHQNSA-N 392.838 5.513 30 20 GKED C=CCOc1ccc(CNC2(C(=O)O)CCC(C(C)(C)C)CC2)cc1Cl 1776185711 SBCZCRWLAOSLJG-UHFFFAOYSA-N 379.928 5.054 30 20 GKED C[C@@H]1/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2c(O)ccc(F)c21 1776586540 CCCPORPEKDANDG-HGLKBHAMSA-N 394.423 5.341 30 20 GKED COc1cc(C)ccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)s1 1777280830 YANOFUARMXPUGU-DHZHZOJOSA-N 378.449 5.326 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1OCc1ccccc1F 1777436399 RJZTXDNVTKPRDN-OUKQBFOZSA-N 390.410 5.307 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1791246810 DGSZEEUFFUQNDK-QGZVFWFLSA-N 396.556 5.027 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(F)cc1)=C(/S)Nc1ccc(C)cc1 10173113 SIVQDTCQJCYNLT-UHFFFAOYSA-O 393.507 5.035 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2cc(C)sc2C)[n+]2ccccc2)cc1 10173609 GIVHUKMLVNLSAR-UHFFFAOYSA-O 395.573 5.266 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1CN(C)C1CCCCC1 78462303 MZLYEZLUASHSLO-UHFFFAOYSA-N 384.568 5.245 30 20 GKED N#CCCn1cc(C(=O)CSc2cccc(Br)c2)c2ccccc21 97529810 UPLNZBZUEWZBCM-UHFFFAOYSA-N 399.313 5.292 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(C)n1 106606453 OBCYQZKDLMIYRJ-UHFFFAOYSA-N 375.403 5.062 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C/c1ccc(Cl)cc1 108252212 WLQFYWCNWNHGEB-VNDWYCCKSA-N 392.933 5.004 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccccc3SC[C@@H](C)C#N)o2)cc1C 123564877 JQFHJWPCGDBSRQ-YOEHRIQHSA-N 392.528 5.778 30 20 GKED Cc1ccc(-c2nnc(-c3ccc(C(=O)Nc4cc(C#N)ccc4C)cc3)o2)cc1 127695378 PKNKBAUHQJSLPM-UHFFFAOYSA-N 394.434 5.144 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc(F)c1Cl 173039943 CEUISVKGIHBRAW-UHFFFAOYSA-N 394.833 5.491 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3ccc(C#N)cc3)s2)cc1 174094319 ZJQLNKXVFKVFLT-CABCVRRESA-N 377.513 5.411 30 20 GKED COc1cccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 175947691 XZIWWRILLDNNBT-BLLLJJGKSA-N 384.888 5.328 30 20 GKED COc1cc([C@@H](C)NCc2cc(C#N)cs2)ccc1OCc1ccccc1 177687367 YOPODVDZXIORRN-MRXNPFEDSA-N 378.497 5.058 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 179384922 ZFPDPPDIFFPHNL-IEZBTEQYSA-N 385.801 5.365 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccn1C1CCCC1 180386422 OHLMKFRDTALLGO-UHFFFAOYSA-N 386.455 5.223 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)c(OCC)c(OC)c1 189897164 TUQOAONMWHAIDH-UHFFFAOYSA-N 387.907 5.852 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)oc2c(C)cccc12 193617296 SHHQKIYCELBOPK-CQSZACIVSA-N 379.366 5.285 30 20 GKED N#C[C@@H](C(=O)c1cc(Br)cs1)c1nc2cc(Cl)ccc2s1 194590564 IIRAXBVPIUJHHZ-VIFPVBQESA-N 397.706 5.264 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CCCOc3ccccc32)c1 237840337 VPTYMEOPJDGXFK-DEOSSOPVSA-N 384.479 5.141 30 20 GKED COc1ccc([C@H](Nc2ccc(C#N)cn2)c2ccc(C(F)(F)F)cc2)cc1 302011806 CSGHJXUPIVNWSR-HXUWFJFHSA-N 383.373 5.182 30 20 GKED O/C(=N/[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)[C@H]1CCCOCC1 329662276 PHBVEYLKTXJNHH-YVEFUNNKSA-N 391.309 5.081 30 20 GKED CSc1nc(C(C)C)nc(C)c1/C(O)=N/[C@@H]1CCC[C@H](C(F)(F)F)C1 331043555 SDXOUFNSLPAZJG-NWDGAFQWSA-N 375.460 5.056 30 20 GKED CCCCn1c(SCCC2(C#N)CCCCC2)nnc1[C@H](CC)N(C)C 412982989 LWYFVMIPGOSJGD-KRWDZBQOSA-N 377.602 5.047 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 425915155 GYBHNSNCRHBLRG-OCCSQVGLSA-N 383.439 5.230 30 20 GKED CC1(C)[C@H]2CN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)c(Cl)c3)C[C@H]21 437740027 YGGZQCDURVOPQH-GBESFXJTSA-N 379.891 5.115 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)o2)cc1 442608032 IXAHWMIEGYDSJK-MRXNPFEDSA-N 384.357 5.413 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)C1CCC(c2ccccc2)CC1 443831644 CRVJIXBJANNWHM-UHFFFAOYSA-N 384.479 5.658 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)N[C@@H](CCC#N)c1ccccc1 444123943 CWQRXQDKCSSKGF-RBUKOAKNSA-N 389.421 5.333 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C2CC2)o1 458809095 ZVYIQMZPOLTUIM-VOQZNFBZSA-N 391.515 5.512 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc3ccccc3c2Br)s1 463455561 DRAIALSBVOMSDJ-UHFFFAOYSA-N 391.315 5.412 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 476318119 HGGPXWOGIMJVET-FDDCHVKYSA-N 389.886 5.028 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)[C@H](C)c1cccnc1 479624496 UCGJYQMIMQQCPT-QGZVFWFLSA-N 387.508 5.328 30 20 GKED C[C@H]1CCN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@H](c2ccco2)C1 480558491 BHHXHKITILBCAG-AVRDEDQJSA-N 385.467 5.080 30 20 GKED C[C@@H]1CCCC[C@H]1OCCNC(=O)c1ccccc1Sc1ccccc1C#N 481382547 IGMPRXLETVCFIH-YLJYHZDGSA-N 394.540 5.035 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1 485464106 LDMKJQCHUPFKAC-MRXNPFEDSA-N 385.529 5.252 30 20 GKED CN(C)C(=O)c1ccc(Cl)cc1NCc1ccc(-c2ccccc2C#N)cc1 486157085 LYRFHTLFYRCKQB-UHFFFAOYSA-N 389.886 5.193 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1C 486240538 QUNXLFTUNAOYFA-UHFFFAOYSA-N 394.540 5.198 30 20 GKED C=CCOc1ccc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1 498421732 KAECMSGIXKULMU-HXUWFJFHSA-N 381.522 5.162 30 20 GKED N#CC1(CCCNC2(c3ccc(C(F)(F)F)cc3)CCCC2)CCOCC1 499621386 XUNUONLQICMDLW-UHFFFAOYSA-N 380.454 5.165 30 20 GKED Cc1c(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)sc2ccc(C#N)cc12 501396229 IIAIQDDPAZOXPO-MRXNPFEDSA-N 388.414 5.157 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3cccnc3)n2)o1 504537747 COMINBZHYXJMIW-UHFFFAOYSA-N 375.375 5.228 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(F)cc3C(F)(F)F)no2)cc1 508030751 YZIBBAOQPGUCAW-UHFFFAOYSA-N 379.338 5.058 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)[C@@H](C)C(C)C 508273206 AIUFFUKTLONPCY-INIZCTEOSA-N 381.476 5.257 30 20 GKED CCc1cc(C(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)c2c(C(C)C)noc2n1 509084533 QXIRMWDNAQUZSB-OAHLLOKOSA-N 390.487 5.004 30 20 GKED CC(C)c1cccc(O[C@@H](C(=O)N2CCC(C)(C#N)CC2)c2ccccc2)c1 509411501 RVEAMCSHNWNTQU-JOCHJYFZSA-N 376.500 5.082 30 20 GKED N#Cc1cc(Cl)ccc1NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 511426711 QCSLOFSVSFAEAI-UHFFFAOYSA-N 398.897 5.736 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C(C2CCC2)C2CCC2)cc1 515399416 LIPHBSQMFTZHHJ-UHFFFAOYSA-N 388.511 5.487 30 20 GKED Cn1c(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc2ccccc21 516127244 GSMNENWMFIRNQE-UHFFFAOYSA-N 397.453 5.032 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cc(C)ccc4o3)n2)cc1 516270351 UNGXVLFORYXIDG-KRWDZBQOSA-N 388.448 5.363 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1Br 517790802 MCGBIFXRMOMQND-UHFFFAOYSA-N 386.293 5.072 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 519507543 GFAPUNXLBNIUDG-IBGZPJMESA-N 376.422 5.120 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 520148350 HVWMEQUHXILFCO-LJQANCHMSA-N 399.494 5.144 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(N3CCc4ccccc4C3)cc2)cc1 520915742 VNXYHTDSYLPFTI-UHFFFAOYSA-N 395.506 5.303 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)c1 522085767 ZDCNDDINIHUYTI-UHFFFAOYSA-N 393.462 5.283 30 20 GKED COc1ccc(-c2nc(CS[C@@H](C)c3ccc(C#N)cc3)cs2)cc1OC 522839800 KZYDZYYSLZMMHT-AWEZNQCLSA-N 396.537 5.693 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(C#N)cc1 524598158 JYQQJKXWQQHLIZ-HXUWFJFHSA-N 383.495 5.340 30 20 GKED CO[C@H]1CCC[C@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)C1 530282679 SUYHZJGJUFIMKC-AVRDEDQJSA-N 394.490 5.134 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccc2)c(C)nc1O 530563553 QVAULAOLKKAPRG-UHFFFAOYSA-N 386.495 5.867 30 20 GKED Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 539492995 DIBUWDJDEZUAOK-HXOBKFHXSA-N 393.556 5.069 30 20 GKED C[C@@H](NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(C#N)c1 540595941 IZSOGEFIXUZICF-OAHLLOKOSA-N 388.342 5.180 30 20 GKED C=CCC[C@H](NC1CCN(c2nccs2)CC1)c1ccc(C(F)(F)F)cc1 542840703 LKTINXAOVJHPLE-SFHVURJKSA-N 395.494 5.428 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC=C(c2ccccc2F)C1 542954585 JFKADYCAQVHVDW-OAHLLOKOSA-N 381.476 5.009 30 20 GKED N#Cc1c[nH]c(-c2nc(-c3ccc(Oc4cccc(Cl)c4Cl)nc3)no2)c1 545839945 FFNRHHFCIOFYKV-UHFFFAOYSA-N 398.209 5.097 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)CCCCC(=O)c1ccc(C)cc1 546091158 MRQARJWRDDHJIA-UHFFFAOYSA-N 377.488 5.070 30 20 GKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1cnc(C(F)(F)F)c(C#N)c1 551129644 LDGZSGUMCXHOJL-MRXNPFEDSA-N 395.812 5.095 30 20 GKED C=CCC[C@H](NCc1cnc2ccc(C#N)cn12)c1ccc(C(F)(F)F)cc1 556599308 KUDVIKIDTAYIGB-IBGZPJMESA-N 384.405 5.022 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NCC2(C(F)(F)F)CC2)cc1Cl 560760526 HYQGJHZYQFPJFT-UHFFFAOYSA-N 394.780 5.076 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)N[C@](C)(C#N)C3CCCCC3)s2)cc1 561602288 ZRSSQIOEAKYHFN-JOCHJYFZSA-N 397.544 5.110 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H]2CCc3ccc(C#N)cc32)cc1 562095871 LYJXTKDRRPLYIJ-LOSJGSFVSA-N 386.470 5.267 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)[C@H](C)Cc3cncc4ccccc34)c2C#N)C1 565266439 NUHANJJGFQMUEB-HUUCEWRRSA-N 389.524 5.110 30 20 GKED CC(C)CC[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567117619 LRZOVZLICRHUAG-IBGZPJMESA-N 378.476 5.178 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)[C@H](C)c1ccccc1 569534393 KEXZCWLMFLTPCA-IRXDYDNUSA-N 386.455 5.059 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)C(C)(C)c2csc(-c3cccs3)n2)cc1 570482207 GZKYPXDRLXZEDR-INIZCTEOSA-N 395.553 5.093 30 20 GKED Cc1c(C(=O)N(c2cccc(F)c2)C2CCOCC2)sc2ccc(C#N)cc12 574255964 KNJMPSLKNMOMKK-UHFFFAOYSA-N 394.471 5.046 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)C1 577347822 APUFVVOVTFNGAI-JCGIZDLHSA-N 379.426 5.024 30 20 GKED Cc1cc(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(C)c(C)c1O 579534011 HGNCWXKXDVJVGK-UHFFFAOYSA-N 388.427 5.020 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CC(C)(C)[C@H]1c1cccs1 580454028 PLKLDDLJNDNXMO-FOIQADDNSA-N 399.585 5.164 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 592974612 VKKCEJIWHQPLIX-CQSZACIVSA-N 388.851 5.366 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)CC(C)(C)c1ccccc1 608918186 OSSLYFASAPCHOZ-IBGZPJMESA-N 377.532 5.235 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CCC1 609378219 WGLUJDFKSXAIOS-HNNXBMFYSA-N 384.932 5.652 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(OC(C)(C)C)cc1 609401944 LWVNDMWFXVAWPU-MRXNPFEDSA-N 397.544 5.437 30 20 GKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccc(Br)cc1 609825479 AAUYJELKIPVWHV-STQMWFEESA-N 389.318 5.142 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)Nc3ccc(C#N)cc3)cc2c1 610089467 XWOADSOUWLYTLU-UHFFFAOYSA-N 385.423 5.440 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2ccc(Cl)o2)cc1F 610335117 WWVPXLPSZHKWMM-UHFFFAOYSA-N 385.782 5.058 30 20 GKED Cc1cccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1Cl 610399737 RMSOWAFDRLDNEX-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C[C@H](NC(=O)N1CCc2cc(-c3cccc(F)c3)ccc21)c1cccc(C#N)c1 610408293 RRVBITMWTMGLBC-INIZCTEOSA-N 385.442 5.198 30 20 GKED C[C@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cccc(C#N)c1 610830302 KSLVYGYIAZKBJW-LIRRHRJNSA-N 377.488 5.549 30 20 GKED N#Cc1cc(CNc2ccccc2C(=O)Nc2ccc(Cl)c(Cl)c2)ccn1 610956378 LVKYTYWIXCVMMJ-UHFFFAOYSA-N 397.265 5.124 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 611210613 SRVAETRFIRARKF-AZUAARDMSA-N 377.875 5.042 30 20 GKED C=CCCO[C@H](C)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 620574657 GERDMPXWMMOPCN-AUUYWEPGSA-N 378.299 5.180 30 20 GKED C=CCOc1c(Cl)cc(CNc2ccc(C)c(NC(C)=O)c2C)cc1OC 623370431 JQFOCYQSQFGHRU-UHFFFAOYSA-N 388.895 5.101 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(-c2ccccc2)cc1F 672629558 NNOYBHRCSDXLCP-UHFFFAOYSA-N 394.446 5.188 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccccc2SCC#N)cc1)c1ccccc1 728026142 ORAVNOFLUHGJMN-KRWDZBQOSA-N 387.508 5.728 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 729070850 ZLBLOWHDRQMTQY-ACJLOTCBSA-N 389.282 5.225 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(C(F)(F)F)n3)cc2)cc1 731983301 BLLCULVYRSIATM-UHFFFAOYSA-N 397.356 5.211 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)OC(=O)c1cccc(CC#N)c1 734739137 XHOYWWXGSWWPTC-AWEZNQCLSA-N 380.444 5.242 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3ccccc3C)n2)cc1 734965051 GHULWFJAQBYEOF-UZLBHIALSA-N 390.508 5.497 30 20 GKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1ccc(Cl)c([N+](=O)[O-])c1 741840462 VRGOCRHAMYYGRG-VURMDHGXSA-N 385.725 5.085 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)/C=C/c3cnc(C(C)(C)C)s3)c2C#N)C1 744351101 KJDHZEVBGQPVAN-WAFBPQNNSA-N 385.558 5.150 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCc3ccccc3C2)cc1 749423095 PLHUCWCHZYDFFR-DNQXCXABSA-N 381.479 5.021 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)COc2cc(Cl)cc(Cl)c21 758915504 ZDTZKJPPDXOEAB-BJMVGYQFSA-N 389.263 5.171 30 20 GKED CCc1noc(C)c1C(C)=NNc1ncnc2scc(-c3ccc(F)cc3)c12 769797559 VSWIFEAYFYZHJP-UHFFFAOYSA-N 395.463 5.192 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(N(C)C(=O)OCC)cc1)c1ccccc1 772422844 VSHTZDZQEDAXQX-FQEVSTJZSA-N 381.476 5.108 30 20 GKED Cc1ccccc1N(C(=O)Cc1ccccc1CC#N)c1nc2ccccc2s1 776739417 PLIMRYFTBMUHPX-UHFFFAOYSA-N 397.503 5.578 30 20 GKED CCCCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@H](CC)c1ccccc1 780676220 ZZPHXAWCMWTEIY-WIYYLYMNSA-N 379.504 5.763 30 20 GKED C=C[C@](C)(CCOC)COC(=O)c1nc(-c2ccc(Cl)c(Cl)c2)oc1C 784623699 CXTWJBZVHUQTAW-LJQANCHMSA-N 398.286 5.342 30 20 GKED COc1cc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)ccc1SC(F)F 787167598 DLDPRGWFQBOZJX-ALCCZGGFSA-N 398.814 5.258 30 20 GKED O=c1[nH]ccc2cc(NN=C3CCC[C@@H]3c3cccc(C(F)(F)F)c3)ccc12 789062358 OZZMUZSNPRXGFD-QGZVFWFLSA-N 385.389 5.283 30 20 GKED N#C[C@H](C(=O)[C@@H](Oc1ccccc1)c1ccccc1)c1nccc2ccccc12 792102866 IHILSEDDFPYHHK-DHLKQENFSA-N 378.431 5.231 30 20 GKED C#CCN(Cc1ccccc1)C(=O)c1ccc(SCc2csc(C)n2)cc1 804830979 CEJXHXDLDAPGIF-UHFFFAOYSA-N 392.549 5.019 30 20 GKED C[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCCC2=O)cc1 810262666 VJMZKRHBMFBJRJ-HOYKHHGWSA-N 387.527 5.193 30 20 GKED CC(C)(CCC#N)CN[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 824395692 IZGCYDDZVNYWPB-UXHICEINSA-N 385.552 5.047 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccc(C2SCCCS2)cc1 918170714 PCIOKKHBPPUCNY-UHFFFAOYSA-N 387.545 5.523 30 20 GKED CCOc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 920341656 CPHNLLAMSYRHAK-QHCPKHFHSA-N 385.467 5.062 30 20 GKED Cc1ccc2c(c1)C/C(=C\c1cn(-c3ccccc3)nc1-c1cccnc1)C2=O 921264765 YYRMBMWNPOIDPC-XSFVSMFZSA-N 377.447 5.065 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(O)c(C(=O)O)c2)cc1 1776125500 KEUKNNVENABIEH-FUIJVIPGSA-N 396.483 5.582 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1csc(-c2ccsc2)n1 1776355252 YDVRDOQPAOLZEC-SNAWJCMRSA-N 399.493 5.253 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2cccc(SC(F)(F)F)c2)cc1)C(=O)O 1776470391 MIIIFFYUVARKNZ-PMDBQALLSA-N 396.386 5.047 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2c(F)cccc2F)o1 1776782858 NEJAEYMLRSYNHH-OAHLLOKOSA-N 379.447 5.518 30 20 GKED CCCCCCCOc1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)cc1 1776785953 ZOJFUFMATFYOCY-NMJXDZPISA-N 392.495 5.874 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(CCCC(=O)O)cc2)c1 1776787572 AWFGZFKYZIBLRK-UHFFFAOYSA-N 383.532 6.055 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cccc(C(=O)O)c1Cl 1777488295 XRQFEXMOFQAUCI-KHPPLWFESA-N 383.856 5.366 30 20 GKED COc1ccc(C(C)(C)C)cc1NC(=O)c1ccccc1-c1ccccc1C#N 7278130 OJEANEREJOXCGY-UHFFFAOYSA-N 384.479 5.784 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2cccc(Cl)c2Cl)cc1OC 15587526 YGAJOAHWBZJFRV-CSKARUKUSA-N 378.255 5.219 30 20 GKED CCN(CC(=O)Nc1ccccc1-c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 42741728 IIUNFJZPWHYICC-IBGZPJMESA-N 383.495 5.247 30 20 GKED C=CCN(Cc1nnc(-c2ccc(Cl)cc2Cl)o1)Cc1ccccc1F 64247361 YJEFBPLQZYLCDF-UHFFFAOYSA-N 392.261 5.371 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 108199924 ULBZREIQXLSGDB-UHFFFAOYSA-N 397.887 5.182 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 112128854 VNPBRCKKUCQJHB-UHFFFAOYSA-N 397.494 5.339 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 114619057 DBSHFJXELWGSQF-QHAWAJNXSA-N 395.487 5.338 30 20 GKED C=CCOc1ccc(C(=O)N2CCC[C@H]2[C@@H](CC)c2ccccc2)cc1OC 116161095 ZUIBDYYTPOPNKF-SFTDATJTSA-N 379.500 5.058 30 20 GKED CCN(CC)c1nc2sc(C(=O)N(CCC#N)c3ccc(C)cc3)cc2s1 116712496 BSOUOMUYBCRMGA-UHFFFAOYSA-N 398.557 5.073 30 20 GKED CCN/C(S)=C(/C(=O)c1cccc(Cl)c1)[n+]1ccc(C(CC)CC)cc1 121280722 GXRZONWRJIRZSU-UHFFFAOYSA-O 389.972 5.079 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1C[C@H](O)c1cccs1)c1ccccc1 131035956 FRVWIPYUIVUXLA-UFYCRDLUSA-N 384.545 5.053 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3F)o2)nnc1-c1ccoc1C 133506455 MPKFLWQERNYUCU-UHFFFAOYSA-N 396.447 5.119 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(CN(C)Cc2cscn2)c1)c1ccccc1 134286189 RIONKAJWCPLIIL-LJQANCHMSA-N 391.540 5.074 30 20 GKED CC(C)c1ccc(-c2nn(-c3ccccc3)cc2C(=O)N2CCC(C#N)CC2)cc1 147111116 GLZBSYGRUDDBEA-UHFFFAOYSA-N 398.510 5.038 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)cc2F)C(C)C)cc1OCCCC#N 150883137 YQQOKKCSCCZCMI-QFIPXVFZSA-N 388.458 5.143 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2cccc(Cl)c2)c2ccccn2)c1 153318678 FYAUZXJNRMIWAE-QHCPKHFHSA-N 391.902 5.297 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ncc(-c2ccc(Cl)cc2)o1 154611989 PKCITRHHHPKPET-OAHLLOKOSA-N 381.863 5.851 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C(F)(F)F)cn1 156280724 SBKHQSHLAOCTRQ-JTQLQIEISA-N 392.686 5.263 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CC1 175213630 FLISFRMHNLUMHM-KRWDZBQOSA-N 389.499 5.126 30 20 GKED CCSc1ccccc1[C@H](C)NCc1ccc(OC)c(O[C@@H](C#N)CC)c1 180810080 PIOSWOSSPLUOTL-FUHWJXTLSA-N 384.545 5.339 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(Br)cc1 189903654 PSIIJDNWPLHJLO-UHFFFAOYSA-N 388.305 5.319 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(OC(F)F)c2)ccc1OC(F)F 210049063 QWVQUORXUAFHNR-VURMDHGXSA-N 384.325 5.184 30 20 GKED COc1cc(C(=O)/C=C\c2cnn(-c3ccccc3)c2)ccc1SC(F)F 214924559 QQPWDMUNMCTUNX-CLFYSBASSA-N 386.423 5.092 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(Cc3ccccc3)no2)nc2ccccc21 303914828 SJAYFYUOGKKLCG-HNNXBMFYSA-N 376.485 5.049 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](c1ccc(F)cc1F)C(C)C 328954606 YLLPHHXAVIEJDK-DYVFJYSZSA-N 394.487 5.326 30 20 GKED O/C(=N/[C@H]1CCCc2c[nH]nc21)C1(c2cccc(C(F)(F)F)c2)CCCC1 330164438 WAGPWFOZSSFDES-INIZCTEOSA-N 377.410 5.274 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@H](C)/N=C(/O)Nc1c(F)cc(Cl)c(C)c1F 330953765 SAZAPVHABFZKAH-JTQLQIEISA-N 384.858 5.274 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)c3cccc(SCC#N)c3)cn2)cc1 429968333 ZFXZACRHAYXXMB-UHFFFAOYSA-N 375.453 5.050 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@@H](Cc2ccccc2)C1)c1ccccc1 431916739 PHOSHAPIBNHRHW-PMVMPFDFSA-N 375.516 5.132 30 20 GKED Cc1sc(NC(=O)c2ccc(Br)c(Cl)c2F)c(C#N)c1C 435667011 FMRAJIPCOQLDQM-UHFFFAOYSA-N 387.661 5.044 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 436330112 CRRSLUQNNDJRMC-RPVQJOFSSA-N 385.920 5.412 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 438484598 RLBDOURDEFRBBJ-QUCCMNQESA-N 377.488 5.168 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 438603793 SOUXZJWHBMSLBJ-IBGZPJMESA-N 390.405 5.252 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccc(F)cc2)CC2CC2)cc1C(F)(F)F 438640101 ZRELKCCHKCEIRS-UHFFFAOYSA-N 391.368 5.160 30 20 GKED COc1ccc2cc(CN(C)C(=O)N[C@@H](CCC#N)c3ccccc3)ccc2c1 438840148 MXPDIRAEEHAZOE-QHCPKHFHSA-N 387.483 5.035 30 20 GKED CC(C)Oc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(Cl)c1 445036950 XTEYZGSBOXWZSM-UHFFFAOYSA-N 385.895 5.441 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)CSc1ccc(F)cc1 445795784 RDNQWTLVTXLFDY-LSDHHAIUSA-N 388.533 5.444 30 20 GKED CC(C)(C#N)CC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 447332091 UNWFYQSXLUYICA-UHFFFAOYSA-N 381.526 5.392 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@H]1C[C@@H](C)O)c1ccc(C(F)(F)F)cc1 448153985 GVUOXLZBRAHQHH-MNEFBYGVSA-N 398.469 5.048 30 20 GKED N#CCCC[C@@H](NC(=O)C[C@H](c1cccs1)n1cccc1)c1ccccc1 452141525 UPXUJIFJPNUULT-WOJBJXKFSA-N 377.513 5.080 30 20 GKED Cc1cc2c(cc1C)O[C@H](C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)C2 463138962 FWHRMKQXQGRYKP-DEOSSOPVSA-N 398.462 5.218 30 20 GKED N#CC1(NC(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)CCCC1 465120445 KHGHZUQPVVEONJ-UHFFFAOYSA-N 375.255 5.352 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccccc3S[C@H](C)CC#N)c[nH]c2c1 465131084 XBYISWQCIYYVMA-MRXNPFEDSA-N 377.513 5.442 30 20 GKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ncccc2OCCCC#N)cc1 466612961 APCZTVNAUBNRAU-HXUWFJFHSA-N 392.503 5.257 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1noc2c1C[C@@H](C)CC2 468945661 LMKVDKDLYSKZJV-AWEZNQCLSA-N 387.439 5.024 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](COc1ccccc1)c1ccccc1)c1ccccc1 475757183 QQYQXYFENDTWAP-LADGPHEKSA-N 384.479 5.010 30 20 GKED Cc1sc(NC(=O)c2c(F)cc(C#N)cc2F)nc1-c1ccc2c(c1)CCC2 476922200 QMPSYCZZQOKUTC-UHFFFAOYSA-N 395.434 5.009 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc3nc(-c4ccccc4)oc3c2)n1 483713752 SOHJJVZWGABGCP-INIZCTEOSA-N 387.464 5.565 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c1-c1ccccc1 488234430 QYDDAGYTKILHBP-MRXNPFEDSA-N 398.388 5.035 30 20 GKED N#C[C@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccco1)C1CCCCC1 489414464 NWMPOGRAVVZESZ-IBGZPJMESA-N 396.491 5.290 30 20 GKED C/C(=C/c1ccccc1)CN(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 494261098 BZYCPSQXROUXSL-NZCCEVMUSA-N 393.556 5.055 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(C(F)F)ccc1Cl 497214461 KDBVFYANPCNXNE-MAUKXSAKSA-N 389.833 5.581 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(Cl)cc1Cl 500736682 GAJRUWXBQZRCSD-UHFFFAOYSA-N 397.261 6.218 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccn(C)n1 505034155 AXNXJRGCLNTFIZ-OAQYLSRUSA-N 394.906 5.103 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)cc1 506280227 AXHVTZISNICRGA-MRXNPFEDSA-N 394.540 5.543 30 20 GKED N#CC1CCC(CNC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)CC1 508357609 ACZABDRQRJTACF-MYKUNDNFSA-N 398.959 5.620 30 20 GKED C[C@@H]1CCN(C(=O)NCC(C)(C)CCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1 513118407 KKENNLYEZGRXSQ-PBHICJAKSA-N 381.442 5.128 30 20 GKED Cc1cccc(N(CCC#N)S(=O)(=O)c2ccc3oc4ccccc4c3c2)c1 518170568 WPOYHNLHGBDYGO-UHFFFAOYSA-N 390.464 5.003 30 20 GKED C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(C#N)cc1 518277286 DODQCNCXRCNKBZ-OAHLLOKOSA-N 391.402 5.249 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(Cl)cc1 524115141 XJPFLUODVMKHHY-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(C[C@H](C)C#N)C1CC1 533599306 OTRKIAMKOOYVHL-SJLPKXTDSA-N 377.488 5.291 30 20 GKED CN(C(=O)c1ccc(OC2CCC2)cc1Cl)c1cc(Cl)ccc1C#N 534778298 YZKMQQYSTHHTCR-UHFFFAOYSA-N 375.255 5.073 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)Nc3ncccc3OCCCC#N)o2)c1 538524554 ALUZSFRBDXYLLO-UHFFFAOYSA-N 389.455 5.400 30 20 GKED C=CCCOCCN[C@H](C)c1sc(-c2ccccc2Br)nc1C 539052388 XTFGQIGRRQWLJE-CYBMUJFWSA-N 395.366 5.124 30 20 GKED C=CCOc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)cc1OC 540202858 NAEQAJISBGKQSY-UHFFFAOYSA-N 384.479 5.088 30 20 GKED CCN(C(=O)c1sc(Cc2ccccc2)nc1C)c1ccc(C#N)c(Cl)c1 540274537 NSHALJAAYRQBFJ-UHFFFAOYSA-N 395.915 5.234 30 20 GKED C[C@H](NCc1nc(C(F)(F)F)cs1)c1ccc(-c2cccc(C#N)c2)cc1 542018196 ZRAYPTHRSQKGHC-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1F 542960109 NCRWZKVATMAYBU-GOSISDBHSA-N 387.430 5.309 30 20 GKED C[C@H](NC(=O)N1CC=C(C(F)(F)F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543016651 HCVQCSOTCJPFEG-HNNXBMFYSA-N 399.416 5.190 30 20 GKED CC[C@@H](CC#N)NC(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 545861891 VPFYUCMLTDVNBC-KBXCAEBGSA-N 376.884 5.121 30 20 GKED N#CCCC[C@H](N[C@H]1CCc2c(F)cc(Br)cc21)c1ccccc1 550827137 KTXPTZDZNTUQBF-PMACEKPBSA-N 387.296 5.600 30 20 GKED N#Cc1ccc(CNCC[C@H](c2ccccc2)C(F)(F)F)c(C(F)(F)F)c1 559308574 YYLGSYWENONEML-MRXNPFEDSA-N 386.339 5.403 30 20 GKED Cc1c(C(=O)N2CCC(OC3CCC(C)CC3)CC2)sc2ccc(C#N)cc12 559652085 VQPOUCJFCQMAAG-UHFFFAOYSA-N 396.556 5.281 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCc3occc3C2)cc1F 568911805 BTAXIUDQSYOSBC-UHFFFAOYSA-N 391.402 5.063 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Cl)c(C(F)(F)F)c1 570604811 SMAHTAFMGRNUPY-CQSZACIVSA-N 380.797 5.409 30 20 GKED CCCOc1ccccc1Oc1ncccc1CN[C@H]1CCc2ccc(C#N)cc21 574946296 ALSNREJIWZQVEA-QFIPXVFZSA-N 399.494 5.311 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Br)cc1C#N 580945085 VTSKNLHUHWZOCU-ZDUSSCGKSA-N 386.318 5.185 30 20 GKED C[C@@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)c1ccc(C#N)cc1 582539201 YVAWIUSUCLKMKO-OAHLLOKOSA-N 375.497 5.237 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccc(-c2cccc3cccnc23)cc1 586814103 OYGNILHFXIPFFX-DEOSSOPVSA-N 389.458 5.191 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2)cc1 590880721 DGXQHEPUCNDSPS-JOCHJYFZSA-N 389.414 5.389 30 20 GKED COc1ccc(COc2cccc(F)c2)cc1N[C@H](C)c1cccc(C#N)c1 600848117 GSRHHWCPVSUYOD-MRXNPFEDSA-N 376.431 5.458 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)cn2)cc1 603764812 NCANYQQXZJWNER-LSDHHAIUSA-N 389.377 5.053 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c1 604006342 DTWPRXDZYSVXCT-NRFANRHFSA-N 395.289 5.579 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccc(F)cc1 604113362 JAUHROCNLICNBH-HNNXBMFYSA-N 375.403 5.017 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1oc2ccccc2c1CSC 604486887 NPVWZUJAGIEZPJ-UHFFFAOYSA-N 396.468 5.032 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 607433073 ADOQLKLYVSOCFX-INIZCTEOSA-N 378.522 5.845 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609682692 QODYHSDAQDPVCQ-GHTZIAJQSA-N 397.478 5.760 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCCCC[C@H]2c2ccco2)o1 609909211 UJAZUSRXCDDFIN-IBGZPJMESA-N 390.439 5.081 30 20 GKED C[C@H]1C[C@H](C)N(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 610142446 LWXJMWNMBDIVBA-GJZGRUSLSA-N 383.879 5.053 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610290475 MLWXCSYGKMULCN-INIZCTEOSA-N 389.430 5.092 30 20 GKED N#Cc1cc(Cl)ccc1SCc1csc(CC(=O)Nc2ccccc2)n1 610655186 TYKFDYAHTGWYGK-UHFFFAOYSA-N 399.928 5.142 30 20 GKED O=C(C/C=C\c1cccc(F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 619125291 MSZJDTQBNNMGSG-RQOWECAXSA-N 385.323 5.399 30 20 GKED C=C(C)[C@H](N[C@H]1CC[C@@H](C(=O)OCC)c2ccccc21)c1ccc(F)c(F)c1 619822814 PNENDQWRBLTUQY-COPCDDAFSA-N 385.454 5.353 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccccc1Oc1cccnc1 622981611 ZUAXDMHBLDJDQM-UHFFFAOYSA-N 384.888 5.417 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1sc(-c2ccccc2)nc1C(F)F 677745619 VXVQVBGFFFASQI-UHFFFAOYSA-N 390.480 5.638 30 20 GKED N#C[C@H](C(=O)c1coc(-c2ccccc2Cl)n1)c1nc2cc(F)ccc2s1 678969577 IJGNWBASFNOXRK-GFCCVEGCSA-N 397.818 5.234 30 20 GKED N#CCCCOc1cccc(NC(=O)/C=C\c2cccc(OC3CCCC3)c2)c1 727665907 XCMFJZZEFDWAGT-YPKPFQOOSA-N 390.483 5.342 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccc(F)cc3F)cc2)c1 727980036 BUJKUZHAIVSKQK-UHFFFAOYSA-N 395.434 5.224 30 20 GKED Fc1c(F)c(F)c(CNc2ccc(C(F)(F)C(F)(F)F)cc2)c(F)c1F 729849717 NOFNVTUGCNLXNA-UHFFFAOYSA-N 391.208 5.648 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2ccc(C3SCCS3)cc2)cc1 731199419 XYZLHEHGGDHZQD-LJQANCHMSA-N 396.581 5.457 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1ccc(Cl)c(Cl)c1 731645425 LXDSPLWHDZVYHW-CQSZACIVSA-N 392.044 5.434 30 20 GKED C[C@@H](OC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cccnc1 735163696 NXJVSDDTJQWIOT-CQSZACIVSA-N 378.815 5.317 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4ccccc4F)CC3)n2)cc1 737323698 XAMYGDKTFDBSAE-INIZCTEOSA-N 376.456 5.166 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@@H](C)c3cccc(C(F)(F)F)c3)[nH]c12 739190613 IIKBAIYWXQILND-CZUORRHYSA-N 385.389 5.260 30 20 GKED Cc1ccc([C@@H](C)NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740034864 FGFVGBTVVJNFFD-MRXNPFEDSA-N 375.497 5.156 30 20 GKED CCC[C@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccn1 740048213 RESYVBYNTHBNDM-FQEVSTJZSA-N 390.512 5.022 30 20 GKED N#Cc1ccc(CN[C@H](Cc2ccc(Cl)cc2Cl)c2ccc(F)cc2)o1 742369907 IWGPAOSYMYWLCO-HXUWFJFHSA-N 389.257 5.671 30 20 GKED COc1ccc2cc([C@@H](C)OC(=O)c3ccccc3SCC#N)ccc2c1 745955824 QTZFIDVHTWECCY-OAHLLOKOSA-N 377.465 5.382 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)c(OC)c1OC 747188649 UTWSWDADRLBPED-PKNBQFBNSA-N 380.465 5.337 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3occc3[nH]2)cc1Cl 750846305 YLMHUPZDYBYTID-INIZCTEOSA-N 375.815 5.322 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2ccc(-c3ccncc3)cc2F)cc1 751535011 LFSCLBLNJCUDER-TWGQIWQCSA-N 383.426 5.278 30 20 GKED C#CC[C@@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccccc1 757060118 XSAUBJRNTKKSTR-HXUWFJFHSA-N 380.538 5.286 30 20 GKED COc1ccc(C[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 759214084 XZSIMMIGXGKDQR-OXJNMPFZSA-N 390.508 5.182 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2cccc(NC(=O)CCC)c2)cc1 764987256 ANQOENPEDDGEJZ-KRWDZBQOSA-N 386.923 5.407 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(F)c1F 766337125 RDLWCCRMSUTDDS-YWZLYKJASA-N 391.421 5.503 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1O[C@@H](C)C#N 766596827 MMFXHYIDGMAUFZ-UKVQZPPCSA-N 375.255 5.326 30 20 GKED C=C(C)C[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 767959957 NHMPTSWYMFXARW-FZMZJTMJSA-N 379.312 5.895 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCCc3c(C)ccc(C)c32)ccc1OC 769962685 JFVFBOJMEWTVIT-FPOVZHCZSA-N 378.516 5.160 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC2CCC2)c2ccccc2)c1 778669772 KOGBARYNRAUNDU-JTHBVZDNSA-N 391.515 5.098 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@H](CCCc2ccccc2)C1 780673038 NDLRCXKHRBSMPX-CTNGQTDRSA-N 391.515 5.244 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1 780675797 VQXDCAGRXKYVCS-GFCCVEGCSA-N 392.286 5.341 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@H]2CCO[C@@H](C(C)C)C2)c1 781646115 OMJXFPVYEWXONT-SIKLNZKXSA-N 381.541 5.104 30 20 GKED C[C@H](OC(=O)CCc1ccccc1NC(=O)OC(C)(C)C)c1cccc(C#N)c1 790749250 GFWVGTBLLPPRRJ-INIZCTEOSA-N 394.471 5.142 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)cc1 792925442 JZOKVINTGCXWBQ-QBFSEMIESA-N 379.456 5.152 30 20 GKED Cc1nn(-c2ccccn2)c(Cl)c1C=NN[C@H](C)c1ccc(C(C)C)cc1 794896586 LTIFNGXSNBEZIC-OAHLLOKOSA-N 381.911 5.037 30 20 GKED C#Cc1ccccc1CC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1 810437614 AFMVEQXONWFYTI-LJQANCHMSA-N 383.491 5.106 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cnc(Cl)c(C(F)(F)F)c1 841803248 GQTUNGWMNURTQG-UHFFFAOYSA-N 396.800 5.068 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1)c1nc2ccccc2o1 847628995 QDZLVHSPYAJDMG-HNNXBMFYSA-N 384.357 5.145 30 20 GKED CC(C)(C)OC(=O)N1CCc2cccc(/C=C\C(=O)c3cc4cnccc4o3)c21 849252548 WGJOZHQGAFYWKR-FPLPWBNLSA-N 390.439 5.022 30 20 GKED C[C@@H](N[C@@H]1CCCc2c1[nH]c1ccc(Cl)cc21)c1ccc(OCC#N)cc1 858376438 LBYYDDVVEUGXNI-SPLOXXLWSA-N 379.891 5.452 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(C=NOC)cc2)cc1 903626800 SRVPACCKCLLPDL-UHFFFAOYSA-N 390.439 5.110 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1 912899290 KQUWTAMOVSPXOH-SREVYHEPSA-N 399.233 5.041 30 20 GKED CNC(=O)c1ccc(/C=C/C(=O)c2ccc(-c3ccccc3Cl)s2)cc1 915112688 HMSUWESMJAQJRV-DHZHZOJOSA-N 381.884 5.324 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(CC)[C@H](C)c2ccc(F)cc2)cc1OC 916486185 BEQZHNAZEQQOFI-XMCSSRMMSA-N 383.463 5.022 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2ccccc21 1776308640 JCXFNMWTKBYMQN-VLOXRPPESA-N 388.488 6.133 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cnc(-c2ccc(Cl)cc2)s1 1776785689 RWLSGLPIXYZXHL-QGZVFWFLSA-N 394.968 5.757 30 20 GKED CCc1oc2ccccc2c1/C=C/C(=O)c1ccc(OCCCC(=O)O)cc1 1776999365 LSIKAPCFCOYWCM-BUHFOSPRSA-N 378.424 5.135 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3csc(C(F)(F)F)c3)c2c1 1777684050 SFHDJOJLFDAYEO-HNQUOIGGSA-N 382.384 5.576 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3ccsc3)CCC2)cc1 1789453323 VUBQHGOFCFAVNS-HXUWFJFHSA-N 394.540 5.264 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 25074687 VMNQOUKEBBPVFA-CYBMUJFWSA-N 397.849 5.007 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3nc(Cl)ccc3Cl)c2)c1 32289519 JJINFUUVAJFPQM-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC)cc1C(F)(F)F 48549368 WIDFKLDQUHXTHU-UHFFFAOYSA-N 391.393 5.030 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1cccc(Br)c1)c1ccccn1 49458336 GXVSNRPYVZHOTG-KRWDZBQOSA-N 393.240 5.126 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2[nH]c(C(F)F)nc2c1 66802131 ASFRFLFXUPYPSR-LLVKDONJSA-N 386.427 5.147 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/CC/C(=C\c3ccc(O[C@H](C)C#N)cc3)C2=O)cc1 103249802 GDNBJFVFRZPWJC-UZDRMONISA-N 398.462 5.098 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1F 109039538 WGWVVICXZLMEDQ-YPMHNXCESA-N 386.398 5.207 30 20 GKED C[C@@H](NC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccc(C#N)cc1 125819128 SHDPBKMZDQKVJS-MRXNPFEDSA-N 399.454 5.085 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3csc(-c4ccco4)n3)o2)cc1 126328610 ZRPOWRHIJJMPTG-UHFFFAOYSA-N 397.481 5.310 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(OC(F)(F)F)c1 153464665 HCXJQBRHMXETKG-GFCCVEGCSA-N 380.391 5.089 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2)cs1 159997686 HPEGWAVLCVPUPK-IBGZPJMESA-N 376.485 5.285 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(Br)s1)[C@@H](C)c1ccc(C#N)cc1 173773146 FBIMQYAFAYWDNN-STQMWFEESA-N 391.334 5.095 30 20 GKED COc1ccc(/C=C(\Cl)c2nc3cc(F)ccc3o2)cc1OCCCC#N 176908177 SEBUFBFFWVARLQ-GDNBJRDFSA-N 386.810 5.395 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)ccc1Br 189881199 PHPJUDVKOZSEQC-UHFFFAOYSA-N 376.269 5.692 30 20 GKED CCC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 236917199 NFEUIBNCJGGZNB-MGPUTAFESA-N 376.422 5.627 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(Cl)c1 303417461 XAMWWVSUXAMJLD-RHSMWYFYSA-N 387.936 5.865 30 20 GKED Cc1cnc(N2CCC(/N=C(/O)CC3CCCC3)CC2)nc1-c1ccccc1F 328679485 BQHTUQGIMRYZLN-UHFFFAOYSA-N 396.510 5.097 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CCC[C@@H]1Cc1ccccc1 328833624 LGOMAWVXJFZZHP-GUDVDZBRSA-N 384.545 5.062 30 20 GKED CC1(C)C(O)=Nc2ccc(C(O)=Nc3ccc4c(c3)OC3(CCCC3)O4)cc21 330205322 DIUZKBHWRTWEEZ-UHFFFAOYSA-N 378.428 5.244 30 20 GKED N#CCSc1cccc(C(=O)N2CCC(F)(c3ccc(Cl)cc3)CC2)c1 410197919 YOZOTRRMMKPSEV-UHFFFAOYSA-N 388.895 5.057 30 20 GKED C=CCC[C@H](NC(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1)c1ccccc1 413392738 DHFMOUYEAGXIDO-XZOQPEGZSA-N 390.527 5.257 30 20 GKED N#C[C@@H]1CCC[C@@]2(C1)Nc1ccccc1C(=O)N2c1cccc(C(F)(F)F)c1 414170042 BMQQWUUDWUJGKH-JLTOFOAXSA-N 385.389 5.188 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CCC[C@@H](CC(F)(F)F)C1 421975895 WZDBPDQKROFNAX-HNNXBMFYSA-N 388.389 5.155 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccc(C#N)cc3Cl)c2C(C)C)cc1 430361204 QJETUWIRXXUAGW-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H](c1ccccc1)C1CC1 433157296 LWVAVISAPHRFDU-VQIMIIECSA-N 379.529 5.396 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C(F)(F)F)ccn1 434228693 QORZTAZKKWGCMK-UHFFFAOYSA-N 375.803 5.035 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)CC[C@H]1c1ccccc1 438067848 QOQVVRYQANQRIT-CJFMBICVSA-N 395.506 5.139 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccccc1 438850843 NIUFRWZBYBSUIN-PKTZIBPZSA-N 387.458 5.259 30 20 GKED CO[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)[C@H](C)C1 440911567 ATMJVVWVEQFDRA-KDOFPFPSSA-N 399.878 5.035 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441500768 NQUZCNZFMPHTRC-KSSFIOAISA-N 377.410 5.168 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)C1 452560626 GLSLSXRREIBCJQ-RIFZZMRRSA-N 384.932 5.372 30 20 GKED Cc1cc(Br)c(C(=O)Nc2ccccc2S[C@H](C)CC#N)s1 457563500 DDBHVCUVKAJPHM-SNVBAGLBSA-N 395.347 5.466 30 20 GKED C=CCC[C@H](CCC)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 461883561 JZMTZNFHSUKTFV-RBBKRZOGSA-N 389.536 5.043 30 20 GKED Cc1nc(-c2cccc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)cs1 463509138 ZYMJERBSOJIPTR-UHFFFAOYSA-N 375.497 5.041 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3cccc(Cl)c3Cl)ccc21 468877762 FLJGYSTZXDJPOJ-UHFFFAOYSA-N 388.298 5.188 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccccc1OC(F)F 475546440 ISWGPWFDDOIMIK-HNNXBMFYSA-N 388.458 6.023 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccccn1)c1ccc(F)c(F)c1 477726287 SSGAJHUDQWKHTB-YADHBBJMSA-N 393.437 5.066 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COCC2CC2)c1 477727362 WAQNHLIKBRGHDJ-UHFFFAOYSA-N 391.515 5.175 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1ccccc1C#N 479696725 WZZVPCGTRALYCV-UHFFFAOYSA-N 397.356 5.041 30 20 GKED CCS[C@H]1CCCCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 480363844 GXMLKIVHZYRRTD-QFIPXVFZSA-N 394.540 5.293 30 20 GKED C[C@@H]1CCN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@@H](c2ccco2)C1 480558501 BHHXHKITILBCAG-XMSQKQJNSA-N 385.467 5.080 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)NCCCCCSC)cc1 480637072 PVDVEEDCTXGFGN-UHFFFAOYSA-N 399.516 5.014 30 20 GKED N#C[C@H](C(=O)c1ccccc1OCc1ccc(F)cc1)c1nccc2ccccc12 483239068 RMNUJWHSJAHFTF-QFIPXVFZSA-N 396.421 5.443 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC[C@H]1C(F)(F)F 483796924 WQFWFCKVYBEGLU-CYBMUJFWSA-N 393.331 5.019 30 20 GKED C=CC[C@H](C(=O)Nc1nc(-c2c[nH]c3ncccc23)c(C)s1)c1ccccc1 489667602 ODIRYJWJGDECOL-INIZCTEOSA-N 388.496 5.293 30 20 GKED COc1cc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc(OC)c1C(C)C 490766943 GNWPHUWEZWWBDE-UHFFFAOYSA-N 381.476 5.272 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccn(C)c3C3CCC3)n2)cc1 496028005 JXRZQJYKEMCJTI-SFHVURJKSA-N 375.497 5.215 30 20 GKED COc1ccc(C#N)cc1NC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 502519725 SKHIWLFMDNKPDJ-INIZCTEOSA-N 386.455 5.384 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 502672706 VUAOBJKYKYUYCI-MRXNPFEDSA-N 399.454 5.085 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc(-c3cc4ccccc4o3)cs2)c1 512104977 KHPOGZCGXASISF-UHFFFAOYSA-N 379.828 5.334 30 20 GKED Cc1cc(N(C)C)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 518538095 VOKCJCDDGFTWJI-UHFFFAOYSA-N 389.430 5.116 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4cnc[nH]4)cc3)cc2)cc1 520333764 ALOCPIZBSBVAQS-UHFFFAOYSA-N 394.434 5.187 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1c1ccccc1 520939016 JOLFQACIIARENQ-HOJAQTOUSA-N 393.556 5.929 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)c2cc1C 521329316 AXEJHXYMTWDFHT-INIZCTEOSA-N 378.497 5.625 30 20 GKED CSCc1cccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c1 521346856 MDLXPSBTOFBVQG-UHFFFAOYSA-N 388.492 5.253 30 20 GKED C=C[C@H](CC(=O)N(CCc1ccccn1)Cc1ccc(F)cc1)c1ccccc1 535345700 RGNMNNSDTZFJPB-OAQYLSRUSA-N 388.486 5.152 30 20 GKED N#CCC[C@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccccc1 539050597 NJFROMGDNJGGBQ-VQTJNVASSA-N 391.515 5.961 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2csc(-c3ccccc3)n2)cc1 540809468 GFOHZBYARJUJEU-UHFFFAOYSA-N 381.504 5.639 30 20 GKED COC(=O)c1ccc(F)c(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 542017522 DZHSPHWFBDRJBY-MRXNPFEDSA-N 388.442 5.002 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ccc(C(C)(C)C#N)cc1 543584400 NEWLWGZRNUVWFA-UHFFFAOYSA-N 379.504 5.837 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@H]1CCOC(C)(C)C1 554919427 JIHMDGLFKHCSFT-IBGZPJMESA-N 393.487 5.162 30 20 GKED C=CCn1c(S[C@H](CC)C(=O)c2ccccc2)nnc1-c1ccc(F)cc1 558409691 ZCSMCCSIDXNRIU-GOSISDBHSA-N 381.476 5.024 30 20 GKED CC(C)(C)c1nc(CC(=O)N(Cc2ccccc2)c2ccccc2C#N)cs1 558998348 UGIOWJCBZMWTCZ-UHFFFAOYSA-N 389.524 5.088 30 20 GKED N#CCc1cccc(Br)c1OCc1csc(C2CCCC2)n1 559645790 WIBGIARDDWQEQD-UHFFFAOYSA-N 377.307 5.208 30 20 GKED CCCN(C(=O)Nc1ccc(CC#N)cc1Cl)[C@H]1CCCc2cccnc21 562914179 ZSLKKRWNXAWRQC-IBGZPJMESA-N 382.895 5.123 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ncc(Cc2ccccc2)s1 564742355 QZBZUIDJBNWBCT-UHFFFAOYSA-N 390.512 5.048 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)CC1 566917440 NOVQABIDKVXGLZ-UHFFFAOYSA-N 392.377 5.001 30 20 GKED C=CCOc1ccc(CNc2ccc(C(=O)Nc3nccs3)cc2)cc1Cl 572203397 XNWKHBJNMQWUIA-UHFFFAOYSA-N 399.903 5.226 30 20 GKED N#Cc1csc(CNC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)n1 573170214 MRCOIAOORBEPBL-QGZVFWFLSA-N 392.915 5.071 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)cc1 581265611 ZTRNVRBSYXYCMM-IBGZPJMESA-N 387.405 5.531 30 20 GKED N#CCCCCCC(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1 588158750 GXDFDNLCSIQWIU-UHFFFAOYSA-N 382.304 5.059 30 20 GKED CCN(C(=O)Nc1cccc(CC#N)c1)[C@H](C)Cc1ccc(C(F)(F)F)cc1 596925314 FOYDZHFOVXBAFO-OAHLLOKOSA-N 389.421 5.256 30 20 GKED Fc1ccc2c(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)ccnc2c1 603493139 KIKPQUSPLOFDSK-NXEZZACHSA-N 380.307 5.695 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1ccc(C(C)C)cc1 603756492 WEZMEPOSENNSDV-UHFFFAOYSA-N 399.494 5.749 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)o1 603765405 UESSDMRGQBRSJX-YWZLYKJASA-N 387.439 5.033 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](CCc2ccccc2)c2ccccc2)cc1 603918222 FRCFJSFJMFXWTE-HSZRJFAPSA-N 386.520 5.141 30 20 GKED COCc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cc1 604027193 MYIXJFQXPOLSEO-UHFFFAOYSA-N 392.842 5.403 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)Nc2ccc(C#N)c(Cl)c2)CC1 604082599 DBIKYOLDKHHYOP-UHFFFAOYSA-N 392.890 5.413 30 20 GKED N#CCn1c(C(=O)N(Cc2ccc(F)cc2F)C2CCCC2)cc2ccccc21 609215502 AYNRLYFOCUNEEH-UHFFFAOYSA-N 393.437 5.028 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](COc2ccccc2)c2ccccc2)cc1 609355886 KOWAAJWXWSKGLM-HSZRJFAPSA-N 399.494 5.430 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1sc2cc(F)ccc2c1Cl 609523728 LAVAWKANPLAPCY-FQEVSTJZSA-N 386.879 5.339 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)C1CCCCC1 609554443 LTRMKJFJNDJGRU-UHFFFAOYSA-N 393.487 5.546 30 20 GKED COc1cc(CSCCOC(C)(C)C)ccc1OCc1cccc(C#N)c1 609741108 GGTNTPFRDZOCJA-UHFFFAOYSA-N 385.529 5.194 30 20 GKED CC(C)(C#N)CCSc1nc2ccccc2c(=O)n1CCCc1ccccc1 610166868 VKTRXOGFWLNXOS-UHFFFAOYSA-N 391.540 5.061 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1ccc(C(F)(F)F)cc1 612145473 FMZBSDPIYRFRLS-MJGOQNOKSA-N 379.426 5.048 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(C(F)F)ccc1F 622175502 LOUPZWSOQSJFJC-UHFFFAOYSA-N 395.265 5.547 30 20 GKED FC(F)c1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cn1 631037716 MXSYEXDKLKHQMK-UWVGGRQHSA-N 376.291 5.018 30 20 GKED C=CCN(C(=O)[C@@H](C)OCC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 642360974 DEZDKWRTNXXOBU-LLVKDONJSA-N 385.316 5.061 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)C[C@@H]1CCCO[C@@H]1c1ccccc1 674249807 KCUSKEHUHHSISJ-RBBKRZOGSA-N 387.445 5.157 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 684629881 JJPCFQFMMQHBNI-KRWDZBQOSA-N 387.826 5.342 30 20 GKED O=C1/C(=C\c2csc([N+](=O)[O-])c2)CCc2nc(-c3ccc(F)cc3)sc21 727685530 QJWRCSQPLOAPKT-GHXNOFRVSA-N 386.429 5.131 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 728287522 FGOVCWRUTAQKTE-WQAKAFBOSA-N 393.293 5.829 30 20 GKED C#Cc1cccc(N(C)C(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)c1 731328261 BZMHIAHGLQSZLK-UHFFFAOYSA-N 378.431 5.267 30 20 GKED Cn1c(CC(=NOCc2cc(F)ccc2F)c2ccccc2)nc2ccccc21 731664539 QEWYNPXJZOKXNM-UHFFFAOYSA-N 391.421 5.015 30 20 GKED C=CCOc1ccccc1CNC(=S)Nc1c(Cl)ccc(C)c1Cl 731946850 WCAXNAZVWYFUTJ-UHFFFAOYSA-N 381.328 5.353 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1Br 733266207 GAQCSTDERIIFFI-HXUWFJFHSA-N 391.268 5.111 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CSc3ccccc32)cc1 735568002 ZZGAJUSFOBEALC-LEWJYISDSA-N 385.492 5.311 30 20 GKED Cc1ccccc1-c1noc([C@H](C)ON=Cc2ccccc2C(F)(F)F)n1 744443907 OUUJYWJSCAKDIF-ZDUSSCGKSA-N 375.350 5.176 30 20 GKED N#CCc1cccc(C(=O)O[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 746438333 WDTGLYOACOVQSC-OAHLLOKOSA-N 387.279 5.232 30 20 GKED N#Cc1csc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)c1 748440920 SRPJSTHLFSKZOD-MKMNVTDBSA-N 375.222 5.307 30 20 GKED CCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 749048304 MAYCDUVIBHUUNB-RISCZKNCSA-N 381.328 6.119 30 20 GKED N#CCSc1ccccc1C(=O)NC[C@@H](Cc1ccccc1)c1ccccc1 749451265 YEPNQRINYTUBCE-OAQYLSRUSA-N 386.520 5.059 30 20 GKED C#CC[C@@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccccc1 756995467 IDLXSEBWPJVWOF-HXUWFJFHSA-N 382.916 5.230 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccccc3SCc3ccccc3)o2)cc1 760448212 NMIASIZUYQUSDW-UHFFFAOYSA-N 398.491 5.513 30 20 GKED C=CCn1c(SCc2ccc(OC(C)=O)cc2)nnc1-c1cccc(Cl)c1 768402152 HNGQVZDVFYJSID-UHFFFAOYSA-N 399.903 5.002 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@@H]1/C=C\c1cccs1)c1ccncc1 783230393 MCUJIFYEUSSSBJ-PCXBEVNGSA-N 381.545 5.428 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792092489 BZFYEKZCOHXIFJ-IFXJQAMLSA-N 382.385 5.309 30 20 GKED CCN(C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 801657693 OSQXVPDTXVDLCL-SCLBCKFNSA-N 378.369 5.197 30 20 GKED C[C@@H](OC(=O)c1cc(C#N)ccc1Cl)c1ncc(-c2ccc(Cl)cc2)o1 803834566 JSDPXXWMEZNQEQ-LLVKDONJSA-N 387.222 5.438 30 20 GKED N#CCCCCCC(=O)O[C@@H](CC(F)(F)F)c1ccc(Br)cc1 805879906 ULVVZRYXEZBWPF-AWEZNQCLSA-N 392.215 5.460 30 20 GKED C[C@H](c1ccccc1)N(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 806200730 LWFJUCSCGKPYDH-KBMIEXCESA-N 395.506 6.100 30 20 GKED COc1ccc(OCc2nc(/C=C3/C(=O)c4ccccc4[C@@H]3C)cs2)cc1 809159318 NJGVUJDYFVTPGY-HXJASHHUSA-N 377.465 5.114 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC/C(C)=C/c2ccccc2OC(F)F)c1 810145193 VMQIRUYNLDWQPA-SKTWIKFTSA-N 386.442 5.162 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813218588 XVLBDCMKCPCSRO-YJBOKZPZSA-N 396.796 5.034 30 20 GKED CSCc1cnc(CNc2ccc(OCc3cccc(C#N)c3)cc2)s1 816565603 VFSTUKZOFVMYMO-UHFFFAOYSA-N 381.526 5.069 30 20 GKED CC(C)c1ccccc1N=C1SCCCN1C(=O)C1C[C@@H]2CCC[C@H](C1)C2=O 864014285 KJJFTCKQDVDCKI-JWTNVVGKSA-N 398.572 5.158 30 20 GKED C=CC(C)(C)CCCNCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 872103366 YWBRFTKQHSKBIX-UHFFFAOYSA-N 375.513 5.049 30 20 GKED N#C[C@@H](C(=O)C1CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916996490 NCHAKAGFYVENNC-AWEZNQCLSA-N 379.312 5.873 30 20 GKED Cc1[nH]c2c(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cccc2c1C 917046794 PUTWMWCYTVEMCM-OAHLLOKOSA-N 379.872 5.538 30 20 GKED Brc1ccccc1C=NOCc1csc(Cc2ccccc2)n1 918733868 XAZQZMALRHGWIV-UHFFFAOYSA-N 387.302 5.047 30 20 GKED C#Cc1cccc(NC(=O)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)c1 919903515 POBCYYUFVLRVQF-UHFFFAOYSA-N 381.888 5.075 30 20 GKED CC(CCc1cccc(C(F)(F)F)c1)=NNc1c(F)c(F)nc(F)c1F 920365102 KIRXSXDCIWCBFL-UHFFFAOYSA-N 379.279 5.077 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OCC(C)C)cc2)c2cc(C(=O)O)oc12 1776126447 MDXWBNOXUKAESZ-POHAHGRESA-N 394.423 5.071 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2ccccc21 1776308566 DMRYDURDGRJPCR-BCGDRIGESA-N 382.459 6.071 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1F 1777352365 VBYQSJYRDUHKBM-UUILKARUSA-N 376.383 5.096 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c(C)c1 1777353311 XUNAMNHWKXGYFD-DHZHZOJOSA-N 378.449 5.326 30 20 GKED Cc1c(/C=C2/CSc3c(Cl)cccc3C2=O)nc2ccccc2c1C(=O)O 1777414214 NHCXXOLKTRPBAT-XFXZXTDPSA-N 395.867 5.267 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cs1 23612122 LFOINHAHRXOMJG-ZHACJKMWSA-N 382.510 5.141 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1sc(-c2ccco2)nc1-c1ccccc1 32618315 OABFLKULAMBTAY-UHFFFAOYSA-N 399.475 5.214 30 20 GKED C[C@H](SCc1ccc(C#N)cc1)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 58453103 KKUHMMUYZBRTOK-LBPRGKRZSA-N 393.493 5.111 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OCc1ccc(Cl)cc1Cl)c1ccccn1 60477063 SQKPQBISPGXUCZ-QGZVFWFLSA-N 397.261 5.457 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CNc2ccccc2Cl)cc1 63657324 VIPAUNBYFDBRKU-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 108528356 CJYCBVAMIWLUJD-UYAOXDASSA-N 393.556 5.740 30 20 GKED CC(C)CCO[C@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 109195691 JIIHDFLQEUCLAE-OXQOHEQNSA-N 384.907 5.385 30 20 GKED Cc1noc(C)c1[C@@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116646256 IEBBDZKMHIWDKM-GFCCVEGCSA-N 395.846 5.100 30 20 GKED N#Cc1c(NC(=O)c2cc(F)ccc2Br)sc2c1CCCCC2 120058755 STDLBJSUJDLSMQ-UHFFFAOYSA-N 393.281 5.043 30 20 GKED N#C[C@H](C(=O)Cc1ccc(F)c(F)c1)c1nc(-c2ccc(Cl)cc2)cs1 120111907 WZSZYRWACGKENZ-CQSZACIVSA-N 388.826 5.161 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 147188149 AIAVYJFHZZKUMY-CQSZACIVSA-N 381.526 5.363 30 20 GKED CC[C@](C)(NCc1cccc(OCc2cccc(C#N)c2)c1)c1nccs1 152634803 DYSVWHAMOLXYRF-QFIPXVFZSA-N 377.513 5.009 30 20 GKED O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1C(F)(F)F 182738825 UAGGXHZAILJCQP-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1CCC(F)(F)F 184073611 OYDMAHGPPSLIDB-ZDUSSCGKSA-N 377.366 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@@H](c2ccsc2)C1 191420985 CCPWBLIASSCGCK-OXJNMPFZSA-N 384.545 5.594 30 20 GKED C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 247052250 WSYPBXNGPJJRMF-JZXOWHBKSA-N 397.519 5.630 30 20 GKED CCS[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)C(C)C 303144523 LKQODSMWKXJFET-HXUWFJFHSA-N 384.501 5.075 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 409667997 WAYPSNLTQLIQJS-KBPBESRZSA-N 392.446 5.842 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@@H]3C)n1 410974752 JFDFKDJTAJMBKU-QWRGUYRKSA-N 388.924 5.125 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cccc(SCC#N)c1 429952682 KNBWFKRWGZFRHU-QGZVFWFLSA-N 392.549 5.767 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccc(F)cc2)C1 432095267 PUTCNCDUSXIJFA-NVXWUHKLSA-N 383.492 5.099 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 432103754 UYGKMHQEOZRBGV-QGPMSJSTSA-N 399.947 5.659 30 20 GKED N#CCCC[C@@H](NCc1ccc(OCc2ccccc2F)nc1)c1ccccc1 433018162 FMZPVXNPWXWHBT-HSZRJFAPSA-N 389.474 5.324 30 20 GKED Cc1ccc(N(C(=O)c2cc(C#N)cn2C)c2nc3ccccc3s2)c(C)c1 433415101 ZQLLISXLKHTETB-UHFFFAOYSA-N 386.480 5.102 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(N2CCCCCC2)c1)c1ccccc1 439393084 BUQHOJDTQYRVGB-JOCHJYFZSA-N 376.504 5.234 30 20 GKED N#Cc1ccc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)c(Cl)c1 439454520 RXJTYHJSDRCSPB-CYBMUJFWSA-N 385.842 5.067 30 20 GKED C=CCN(C(=O)c1cnn(CCC(C)C)c1C)c1nc(-c2ccccc2)cs1 441293811 MVBNWPXGFLQPOO-UHFFFAOYSA-N 394.544 5.194 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)s1 442207608 JUKNNOAJABUQHY-CQSZACIVSA-N 395.406 5.196 30 20 GKED C=C[C@@](C)(CC)C(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 442902605 WRRSEMACHUEJHV-RDPSFJRHSA-N 376.500 5.027 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)N[C@@H](CCC#N)c1ccccc1 444123942 CWQRXQDKCSSKGF-OALUTQOASA-N 389.421 5.333 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CCCC1(C)C 444858387 YHFVVEILLSGYJL-NRFANRHFSA-N 391.515 5.538 30 20 GKED COc1c(F)ccc(F)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 445922120 RUOVOIBAMDVRIV-UHFFFAOYSA-N 394.377 5.198 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCC[C@@H]1Cc1ccccc1)c1ccccc1 458804482 SRLGGQKUNGZKPY-DHIUTWEWSA-N 375.516 5.228 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)N[C@H]1CC[C@@H](CC#N)C1)C1CC1 459012078 OENUBPWESIRVIW-ZQIUZPCESA-N 379.426 5.023 30 20 GKED CC(C)c1cc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)on1 460176634 UTUUAWDTSRVMRH-UHFFFAOYSA-N 379.847 5.170 30 20 GKED COc1cccc([C@H](NC(=O)Nc2ccc(C#N)cc2)c2ccccc2Cl)c1 466053785 VHCBBJODXGYTCO-NRFANRHFSA-N 391.858 5.131 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H]1CCc2c(O)cccc21 466103573 WAFHUPLLKRTZHQ-QFIPXVFZSA-N 399.450 5.174 30 20 GKED C=CCN(C(=O)c1cncc(-c2ccc(C)cc2)c1)c1nc2c(s1)CCCC2 466414850 KZWSRIGRERNQIY-UHFFFAOYSA-N 389.524 5.225 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)cc1 469464275 GUCTXNFXGMKOBC-UHFFFAOYSA-N 395.453 5.477 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2cccc(F)c2o1 474717968 VVUNCKVDKVOTBP-UONOGXRCSA-N 397.475 5.849 30 20 GKED N#CC1(c2ccc(C(=O)NCc3nc(-c4cc5ccccc5o4)cs3)cc2)CC1 475706090 NMNWDQSYRZYQTQ-UHFFFAOYSA-N 399.475 5.041 30 20 GKED Cc1nc2ccccc2n1C1CCN(c2cc(C#N)ccc2C(F)(F)F)CC1 480849062 YTZSSHIEWYNHIF-UHFFFAOYSA-N 384.405 5.077 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 483971078 CQYYPUNFIQHFPK-FQEVSTJZSA-N 387.483 5.251 30 20 GKED Cc1cc(CN(C(=O)[C@@H](C)c2cccc(C#N)c2)C2CCCC2)c2ccccc2n1 486234245 WZBUJUMVLHFXNF-IBGZPJMESA-N 397.522 5.490 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)c(F)c2)nnc1-c1ccc(OC)cc1 497669019 ZVYGRYCDNLNMPM-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED CCN(CCCC1(C#N)CCOCC1)[C@H](c1ccccc1)c1ccc(F)cc1 499535151 ZXYZJQCEKYEVBE-HSZRJFAPSA-N 380.507 5.338 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)c3cc(C#N)ccn3)c2)cc1 500975788 LLOXMMREYKJFIM-SFHVURJKSA-N 399.494 5.241 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(CCN(CC)CC2CC2)CC1 505022176 BCOROOMQGMBCBY-UHFFFAOYSA-N 383.580 5.171 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(C(F)F)c1 505995551 IHGBCHDOFSLOHH-UHFFFAOYSA-N 380.419 5.899 30 20 GKED FC(F)(F)Cn1cc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 507849061 CUWRRJAWYNSFSP-UHFFFAOYSA-N 391.237 5.095 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1nc(-c2ccccc2)cs1 513454301 GMTNXLWWRXTUDA-AWEZNQCLSA-N 379.510 5.314 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(CCN2CCCCC2)cc1 515801674 SXXNYERICMDFAJ-UHFFFAOYSA-N 395.522 5.074 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 520603448 IWJNBBBQUIXUST-INIZCTEOSA-N 382.423 5.105 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1 520938092 PQORCLKRKOTENY-IIBYNOLFSA-N 379.529 5.662 30 20 GKED CC(C)Sc1ccc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 521770950 ZPFVNMBXELRPLX-INIZCTEOSA-N 379.312 5.489 30 20 GKED C=C[C@H](CC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 535374044 LJQXBKGMPQNCRZ-VQTJNVASSA-N 398.506 5.476 30 20 GKED C=CCC[C@@H](NCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccccc1 538258277 XRMLSUNFZGQVEM-GOSISDBHSA-N 388.298 5.841 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cnoc2-c2ccc(F)cc2Cl)c1 538315925 PTOHGMFWFFUJQW-UHFFFAOYSA-N 399.809 5.069 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2)c1 538659457 ITJKCVXCEIBGBZ-UHFFFAOYSA-N 382.769 5.050 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NC1CCC(C#N)(c2ccccc2)CC1 538824238 QGHJAWAIWHAUED-UHFFFAOYSA-N 375.516 5.406 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(C(F)F)c1Cl 541790287 FHQCOFCYNIDCPW-UHFFFAOYSA-N 375.806 5.369 30 20 GKED C[C@H](NCc1nc(-c2ccsc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543873266 SFKVGERJQAHOHS-HNNXBMFYSA-N 386.480 5.188 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2cc(F)ccc2OCC(F)(F)F)s1 545340112 TYGDJUDCSYXWFC-UHFFFAOYSA-N 388.308 5.163 30 20 GKED C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](OC(F)F)C1 549414357 RISHJAZNWXIKDD-PELKAZGASA-N 377.275 5.099 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c(C)c1 549921933 RMKZTPWSFJJKIO-GFCCVEGCSA-N 393.434 5.423 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)c1 554858313 OLYHHDBUIUPFKN-BCDXTJNWSA-N 397.425 5.102 30 20 GKED Cc1ccc([C@H](C)N(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 557418918 IBBACHSILRGFIY-MJGOQNOKSA-N 395.572 5.187 30 20 GKED N#CCCC[C@@H](NCc1cccc(OCc2ccccc2F)c1)c1ccccc1 577898260 CMPOIASXUPAMGV-RUZDIDTESA-N 388.486 5.929 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 581276048 YQSWHUPYWDBZRV-IBGZPJMESA-N 392.883 5.037 30 20 GKED COCc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)cc1 603819844 HDJYUVFEPMGQON-MRXNPFEDSA-N 382.529 5.169 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3cccc4ccccc34)c2)c1 603995668 TZPICWIUVCJMAJ-UHFFFAOYSA-N 391.430 5.216 30 20 GKED C=CCOc1ccc(CN[C@@H](COC)c2cccc(C(F)(F)F)c2)cc1Cl 605322490 WGJRSVFDSBXTSR-SFHVURJKSA-N 399.840 5.401 30 20 GKED C[C@@](C#N)(NC(=O)c1sc2cccc(Cl)c2c1Cl)C1CCCCC1 609638186 NNIABEXOYHXMHL-SFHVURJKSA-N 381.328 5.800 30 20 GKED Cc1nc(NC(=O)c2ccc(OC3CCCCC3)cc2)sc1SCC#N 609784331 OLARSQZTSOISFJ-UHFFFAOYSA-N 387.530 5.031 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@H](C)c3cccc(C#N)c3)sc2C)cc1 610361164 SJPDBGDSVPWMAA-CQSZACIVSA-N 376.481 5.095 30 20 GKED CCn1nc(C(C)C)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 642281330 ZZNRZPIQNBMCQO-OAHLLOKOSA-N 398.919 5.293 30 20 GKED N#C[C@@H](C(=O)c1cnccc1Oc1ccccc1)c1nc2cc(F)ccc2s1 669694180 ICPWUGJTSAJPRY-HNNXBMFYSA-N 389.411 5.113 30 20 GKED C=C(CNC(=O)c1ccccc1SCc1csc(C)n1)c1ccccc1 685215709 AUJURQAMNIFPKE-UHFFFAOYSA-N 380.538 5.187 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)NCc2ccc(OCC#N)cc2)cc1 727934997 MPCVUTRJWAEIEN-UHFFFAOYSA-N 387.439 5.011 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CCc2c[nH]c3ccccc23)c1 728181632 TXWOPEYKLVAFLG-UHFFFAOYSA-N 384.504 5.377 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)n1C 730996687 YNSWAGGRNXARFY-OAHLLOKOSA-N 393.487 5.335 30 20 GKED N#C[C@H](C(=O)CCCCCc1cccs1)C(=O)Nc1cccc2ccccc12 731545811 FGSGPIFEPOOCAE-HXUWFJFHSA-N 390.508 5.352 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc([C@@H]2C[C@H]2C)o1 732764706 VGLGAFQEMBYMHE-CXAGYDPISA-N 389.480 5.032 30 20 GKED C=CC[C@H](NC(=O)N1CCC(CCc2ccc(C)cc2)CC1)c1ccncc1 734679264 LGCKSNYGWFCMNH-QHCPKHFHSA-N 377.532 5.062 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(C)cc1 739159214 IMLGURDACWUPGG-GHTZIAJQSA-N 399.519 5.750 30 20 GKED CS[C@@H]1CC[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 743103448 BOGLERDFAPNVDF-SUMDDJOVSA-N 399.947 5.401 30 20 GKED Cc1ccc(CC[C@H](C)NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 743623785 COGKMVBTISYMGY-HNNXBMFYSA-N 393.512 5.009 30 20 GKED CCOc1cccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)c1 747705818 KAKJZLWEVNLQQA-UHFFFAOYSA-N 379.529 5.099 30 20 GKED CC(C)c1ccc(C=NO[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)cc1 749528226 UQYXMBQPWYYFNL-AWEZNQCLSA-N 378.394 5.207 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(OC)c(F)c2)ccc1OCC(F)(F)F 750900725 AIKAVNYPAJQTKG-DAXSKMNVSA-N 398.352 5.070 30 20 GKED C[C@@H](OC(=O)c1sccc1C#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 753353339 MFEXDXOZUCTAPH-SECBINFHSA-N 393.251 5.500 30 20 GKED CCCOc1cccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 762995089 MQUJBTHXNNSKEX-FQEVSTJZSA-N 390.508 5.326 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)C1 766616404 HUHUMUJHFGRWTQ-FGTMMUONSA-N 384.545 5.628 30 20 GKED CC(C)C[C@@H](NCc1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 772960017 POLQFILUOLAONB-HXUWFJFHSA-N 376.422 5.485 30 20 GKED Cc1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 775226585 GNWBOGLOFYKKBB-AWEZNQCLSA-N 391.279 5.437 30 20 GKED CC(C)(C)C[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccc(F)cc1 777116760 IDZGYZGOZGSRCA-QFIPXVFZSA-N 395.522 5.248 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 779397225 SEORGKJLBMSRSJ-ZHRRBRCNSA-N 385.471 5.154 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)no1 779923011 VTNLWLHKOQYKMO-FQEVSTJZSA-N 388.427 5.016 30 20 GKED C=C[C@](C)(CCOC)COC(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 784635402 WQNQAEOBQIOTSC-HYFFOGBASA-N 385.529 5.118 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(C(F)F)c3)n2)cc1 790766721 DQMZUZVKWNHPNB-KRWDZBQOSA-N 382.435 5.475 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 792230235 VMLWTQYVMZHMPH-IIBYNOLFSA-N 387.487 5.462 30 20 GKED N#C[C@H](C(=O)CCc1cnc2ccccc2c1)c1nc(-c2ccccc2)cs1 796648350 AOKKDGGTRRRBQW-LJQANCHMSA-N 383.476 5.167 30 20 GKED C=CC[C@@H](OC(=O)CCc1nnc(C(C)C)o1)c1ccc(Cl)c(Cl)c1 797552546 DIRPCUXNNCTZHS-OAHLLOKOSA-N 383.275 5.293 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Nc2ccc(F)cc2)c2ccncc12 797870027 FJQOVQBMGNEWQX-UHFFFAOYSA-N 386.386 5.143 30 20 GKED Clc1cc(Br)cc(Cl)c1NN=C1CCC12CCOCC2 799882286 LHDWEKSPFJCVTM-UHFFFAOYSA-N 378.097 5.114 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(F)c(Br)c2)cc(Cl)c1OC 810248346 XCIAOQGWCHYHOM-ZZXKWVIFSA-N 399.643 5.155 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1Cl)c1nc(-c2ccccc2)cs1 810534466 SABNDGSUPWXESR-KRWDZBQOSA-N 380.900 5.663 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccc(OCc3ccccc3)cc2)SC1=S 814290856 PYZDFMQBPKSDDI-UNOMPAQXSA-N 381.522 5.043 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3ccc(Cl)nc3Cl)c2C#N)[C@H](C)C1 839388256 JURJPHDNPRVLBJ-RKDXNWHRSA-N 380.300 5.260 30 20 GKED CCCCCCN(C(=O)[C@@H](C)CC#N)c1nnc(-c2ccc(Cl)cc2)s1 857593720 YQVVRTYTMSXSJU-AWEZNQCLSA-N 390.940 5.322 30 20 GKED N#C[C@@H](C(=O)CCc1ccco1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 915102710 DQWGZVFARGACDH-CONPEVPGSA-N 380.513 5.013 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915352323 GWTKNCTWXHQSRH-RPBOFIJWSA-N 395.506 6.020 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)c1 915711215 BMXAAIJDXCGKTE-DEOSSOPVSA-N 399.494 5.475 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C2CC2)o1 916679608 UENMAYAHTVMIQJ-QHCPKHFHSA-N 385.467 5.440 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)n1-c1ccc(F)cc1 916848601 FMZYDOMKQNDXGX-NRFANRHFSA-N 383.426 5.272 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)Nc1ccc(F)cc1 920078325 MQEAGUFXMHYZFB-UHFFFAOYSA-N 377.444 5.607 30 20 GKED Cc1cccc(C2(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)CC2)c1 920111089 QLSPALBHLHSXAG-GOSISDBHSA-N 392.911 5.680 30 20 GKED O=C(O)c1cc(NN=Cc2ccccc2Cc2ccc(Cl)cc2)ccc1F 1776064656 XZWVFFFNDDROEB-UHFFFAOYSA-N 382.822 5.214 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc2ccccc2c1 1776131431 QVAGZOUNEWMTNP-DHZHZOJOSA-N 384.387 5.400 30 20 GKED C=CCCC[C@H](NCc1cc(C(C)(C)OCc2ccccc2)ccc1F)C(=O)O 1776170845 CMLWFBNDEAUIRG-QFIPXVFZSA-N 399.506 5.177 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Oc2cccc(OC)c2)cc1 1776784708 LKAHTLOTMZRNIL-FQEVSTJZSA-N 399.531 5.781 30 20 GKED CCCCCCCCCCCN(C)c1c(C(=O)O)cnc2c(C)cc(C)cc12 1776787856 YOXUTLFCZGPRFP-UHFFFAOYSA-N 384.564 6.517 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)C2CCCCCC2)cc1 1776787982 GORRVBSOCJLUTB-QHCPKHFHSA-N 389.580 5.939 30 20 GKED COc1c(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cccc1C(C)(C)C 1777254552 OXJHPDFWGBVQFJ-BENRWUELSA-N 396.483 5.374 30 20 GKED Cc1nn(C2CCCCC2)cc1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1777555725 PBMOJNDPSZEQTN-LUAWRHEFSA-N 396.487 5.078 30 20 GKED CC(=O)Nc1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1 6514641 BDDIMBGFRKSCGX-HMMYKYKNSA-N 398.487 5.678 30 20 GKED CCCCn1c(SCc2cc(C#N)ccc2F)nnc1-c1ccc(OC)cc1 11488934 UOPDKOIBFROTPZ-UHFFFAOYSA-N 396.491 5.057 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2cc(C)c(C)c(C)c2C)=C(/S)NC)cc1 27302005 MIYCNBNDFFIAKA-UHFFFAOYSA-O 397.608 5.270 30 20 GKED COc1cccc(S[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 27662419 UUMGBLOPMBOZHU-ZDUSSCGKSA-N 386.542 5.017 30 20 GKED COc1ccc(/C=C/c2nc(-c3ccc(F)cc3)cs2)cc1OCCCC#N 64367295 HJADLKDVFKGNAV-VZUCSPMQSA-N 394.471 5.811 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(=O)oc2cc3c(cc12)CCC3 109323620 JGPIBNGZHFDBNK-HNNXBMFYSA-N 390.508 5.288 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(Oc2ccncc2)c1 112637587 ABIYJYLVNKNGOI-INIZCTEOSA-N 389.480 5.378 30 20 GKED Cc1csc(-c2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2)n1 120519291 JPNZXJKQFMXKSE-IBGZPJMESA-N 376.485 5.285 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 121118163 FIXYYPVCAKWAEW-CQSZACIVSA-N 382.769 5.031 30 20 GKED COc1ccccc1-c1nc(CNc2ccccc2SC[C@@H](C)C#N)cs1 170983105 JGAMZDPULZPVBI-HNNXBMFYSA-N 395.553 5.683 30 20 GKED Cc1c([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 181571708 ARNIBTVAEHUOTD-ZHRRBRCNSA-N 378.907 5.530 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 185834974 ZOAQOZIXWLRCKD-ROUUACIJSA-N 391.487 5.066 30 20 GKED COc1cccc(C(=O)/C(=C/c2csc(-c3ccsc3)n2)c2ncc[nH]2)c1 187580233 LCTOCKWNBLIYDE-YVLHZVERSA-N 393.493 5.027 30 20 GKED CCOC1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 194344665 APQRYEGSQFHYKP-FQEVSTJZSA-N 397.906 5.028 30 20 GKED CN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(F)cc1)CCC2 206122616 DYXYOWNIGKUAOM-FBMGVBCBSA-N 399.469 5.236 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 245936644 LDXLOIRWOQWJNP-XXBNENTESA-N 390.531 5.540 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc([N+](=O)[O-])c(C#N)c1 302179934 QDGSCUXYRMQKBC-LLVKDONJSA-N 382.420 5.211 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nc(O)c2ccccc2n1 376865770 AOSMRWBFFYCLHW-SJORKVTESA-N 394.478 5.286 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C(C)(C)C#N)cc1 425082803 GSHDHHUWWSGUCV-HNNXBMFYSA-N 399.416 5.061 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 425769754 PBDWJUUOESFUEY-ZUOKHONESA-N 385.870 5.204 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C#N)cc2Cl)cnn1-c1ccc(Cl)cc1 430363714 HWEOVUSRIWDFEK-UHFFFAOYSA-N 399.281 5.426 30 20 GKED CCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@@H](C)c1cc2ccccc2o1 435127504 WZWFPHXDVQWIHJ-SFHVURJKSA-N 399.498 5.188 30 20 GKED CCSc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 437392802 QCBMCQOLCMYUNY-ZDUSSCGKSA-N 384.810 5.356 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(OC2CCCC2)cc1 437861016 SUGPRFIZUQQAMX-GOTSBHOMSA-N 389.499 5.312 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(CSC(C)C)c1C 438472384 OXXOZNAONJZKLI-UHFFFAOYSA-N 393.556 5.728 30 20 GKED N#CCCC[C@@H](NC(=O)NC1(c2ccc(F)cc2F)CCC1)c1ccccc1 458797088 FZTXBGYUEQRNMS-HXUWFJFHSA-N 383.442 5.078 30 20 GKED Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458857426 ZMZHTCKCRHZCJC-VXKWHMMOSA-N 379.479 5.416 30 20 GKED N#Cc1cc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)ccc1F 467773739 VWZYIOFRLVXHKC-UHFFFAOYSA-N 397.812 5.354 30 20 GKED Cc1c(Br)cccc1NC(=O)c1cn(CCCC#N)c2ccccc12 468928005 KJZORZXRYXOKAR-UHFFFAOYSA-N 396.288 5.268 30 20 GKED CC(C)Sc1c(Cl)cccc1NCc1nnc(-c2cccc(C#N)c2)o1 471680180 PBDKLILCZCBBKF-UHFFFAOYSA-N 384.892 5.374 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2cccc(C#N)c2)C1 471870903 MAPVKQJEFUNAJW-JOCHJYFZSA-N 391.515 5.240 30 20 GKED CCOc1ccc([C@H](NC(=O)C[C@H](CC#N)c2ccccc2)c2ccccc2)cc1 474786210 QIFHBZVAASAVIU-JYFHCDHNSA-N 398.506 5.378 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 475572300 INIKVLPQAOQESW-PKTZIBPZSA-N 387.527 5.842 30 20 GKED CC(C)CN(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 476828249 WOWFRBSJBHBTGQ-FCHUYYIVSA-N 375.516 5.031 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NCc1ccc(Cl)cc1C#N 478357770 BWTTUIALMLMKPP-UHFFFAOYSA-N 375.859 5.385 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 480932813 WFBNLBUARXIGJI-ZDUSSCGKSA-N 392.956 5.667 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(Br)c1 485993001 ITFAHPMUJIEMCU-GFCCVEGCSA-N 390.306 5.487 30 20 GKED N#C[C@@H](C(=O)c1cnc2c(F)ccc(F)c2c1)c1nc2cc(Cl)ccc2s1 496408252 UEWVUVNSTUAGBO-LBPRGKRZSA-N 399.809 5.266 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1C[C@@H]1c1cccc(F)c1 499271465 HWHVHCUMWLGPGO-WOJBJXKFSA-N 388.467 5.134 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2cc(Cl)ccc2SC)cc1 502636648 SEKOQBGHWQPPQF-UHFFFAOYSA-N 390.896 5.013 30 20 GKED COc1ccc2sc(C(=O)N3CC=C(c4ccc(C#N)cc4)CC3)c(C)c2c1 503964509 ZIESFFLLMSVZTL-UHFFFAOYSA-N 388.492 5.020 30 20 GKED N#Cc1ccc(CC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)cc1 504052714 AOSCHZBRZICEBA-QFIPXVFZSA-N 395.289 5.313 30 20 GKED C[C@@H]1CCN(C(=O)Cc2ccc(C#N)cc2)c2cc(C(F)(F)F)ccc2S1 504056259 SNOQFDQMSWOWIO-CYBMUJFWSA-N 390.430 5.037 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1 505062986 WVASBKZBAMIMIR-FQEVSTJZSA-N 380.488 5.191 30 20 GKED COc1cccc(C2(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)CC2)c1 511715909 PLRGPAUPAWDBIO-UHFFFAOYSA-N 384.435 5.029 30 20 GKED COc1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc2ccccc12 512943360 ODUFTFZAPSZHOD-GOSISDBHSA-N 399.475 5.165 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(F)c(Cl)cc1Cl 519423924 KJFQWNHJDNVVTK-SNVBAGLBSA-N 383.275 5.637 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1cc(Cl)ccc1Oc1ccc(OC)cc1 520636657 PLMIQNMDZMOGBG-AWEZNQCLSA-N 375.852 5.061 30 20 GKED Cc1cc(CN(C(=O)c2ccc(C#N)s2)C2CCCC2)c2ccccc2n1 531390578 XUCUTGSOCQHLHD-UHFFFAOYSA-N 375.497 5.061 30 20 GKED CC1CC(C#N)(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)C1 532072467 WLRUISBKNUZTIL-AWVSAENJSA-N 391.902 5.009 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccc(C#N)cc1 532206765 YWAFTFVGIXEJIC-GJZGRUSLSA-N 377.469 5.607 30 20 GKED CC(C)(C)c1cc(NC(=O)CCc2ncc(-c3ccccc3F)o2)c(C#N)s1 534519782 CHHPKHVQYXFPRP-UHFFFAOYSA-N 397.475 5.283 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(-c3ccccc3C)o2)n1 535259032 AAERTGGYNLGVMP-UHFFFAOYSA-N 389.402 5.536 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(-c3ccccn3)nc3ccccc23)n1 536225667 MDKXQXVLUUITBH-QGZVFWFLSA-N 398.491 5.367 30 20 GKED C=CCC[C@H](CC)Nc1ccc(NC(=O)[C@H](C)n2nc(C)cc2C)c(Cl)c1 538634555 IONDCMKAUJLDTR-IRXDYDNUSA-N 388.943 5.510 30 20 GKED COc1cc(CN2CCC(CC#N)CC2)ccc1OCc1ccc(Cl)cc1 541922031 KODUTXUCLJMGCS-UHFFFAOYSA-N 384.907 5.053 30 20 GKED C[C@@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(CC#N)CC1 541953659 PVCZLKNIOAXJFU-KRWDZBQOSA-N 392.934 5.425 30 20 GKED COc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1OC(C)C 545512167 RIHLRIOTGLRIIJ-UHFFFAOYSA-N 395.503 5.044 30 20 GKED C=C(C)Cn1c([C@H](C)CC)nnc1N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 549665554 PQIQZEFTTPTTKX-CVEARBPZSA-N 397.498 5.032 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1nc(C(C)(C)C)cs1 553403771 ARHKICAPOKTGGR-ZDUSSCGKSA-N 388.562 5.014 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)C(C)(C)c2csc(-c3cccs3)n2)cc1 570482208 GZKYPXDRLXZEDR-MRXNPFEDSA-N 395.553 5.093 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC3(CCC3)[C@H]2C2CC2)cc1F 576077494 RJMAYEMLTHFPRB-OAQYLSRUSA-N 391.446 5.286 30 20 GKED N#Cc1ccc(CNc2cccc3c2CN(c2ccccn2)C3)c(C(F)(F)F)c1 589508660 XXTDQDOLWRTOBS-UHFFFAOYSA-N 394.400 5.104 30 20 GKED N#CCCCCSc1nc2cc(Cl)ccc2c(=O)n1C1CCCCC1 592749392 OLMDGYJSXBLSFM-UHFFFAOYSA-N 375.925 5.341 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCc2sccc2[C@H]1c1cccs1 593953676 IBFZJTZLTJBTIC-VFNWGFHPSA-N 392.549 5.034 30 20 GKED N#CCCCCCC(=O)N1CCC[C@@H]1c1ccc(Br)cc1Cl 600510903 XMGLNAUCVDOKHL-MRXNPFEDSA-N 383.717 5.240 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(Cl)ccc1Cl 602311633 MRVKICIIBXFKIY-UHFFFAOYSA-N 399.302 6.269 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccnc3ccccc23)cc1Cl 603766783 YPUIWPGZOWJZKI-NRFANRHFSA-N 397.865 5.796 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 609171786 BZRAGNFKAXPLIP-DVECYGJZSA-N 384.479 5.140 30 20 GKED CCc1ccc([C@H](C)NC(=O)[C@H](C)Nc2ccccc2SC[C@@H](C)C#N)cc1 609387221 TXFVDRNZGFPOMN-BZSNNMDCSA-N 395.572 5.179 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(F)c(Cl)c1 609398581 CDNBFOUPWMVPJC-LBPRGKRZSA-N 377.872 5.053 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)c12 609427342 FBFNSNGFUJEWCT-UHFFFAOYSA-N 381.435 5.322 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)NC[C@@H](C)c1ccccc1 609466148 MGTAJYKWBRNPMU-MOPGFXCFSA-N 399.494 5.071 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccccc12 609682262 FRPDINPTAIHVRP-AWEZNQCLSA-N 379.485 5.315 30 20 GKED COc1ccccc1N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723643 PQDOIQWSJATTAT-UHFFFAOYSA-N 392.842 5.289 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610324915 YQIOXHVXZYJOEO-GOSISDBHSA-N 385.467 5.328 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 610358007 XGSQFIGIYRXXNC-KBPBESRZSA-N 375.394 5.041 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2c(cnn2C(F)F)c1 610962244 PWUSJCILSCXLND-UHFFFAOYSA-N 388.377 5.222 30 20 GKED N#Cc1ccc(CSCc2cc(-c3ccco3)on2)c(Br)c1 611496502 RZTOAIVKCNNOSC-UHFFFAOYSA-N 375.247 5.002 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 613370923 ZHZRGUYZUOEOFB-UHFFFAOYSA-N 395.418 5.141 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1OC(C)C 656394023 WOSDRGLWYDYPQO-OAHLLOKOSA-N 396.512 5.323 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C1(C(F)(F)F)CC1 671290322 KFIXWDADCLBFDO-UHFFFAOYSA-N 393.249 5.025 30 20 GKED CC(C)Cn1ncc(NC(=O)c2cc(F)c(C(F)(F)F)c(F)c2)c1C(F)F 683250879 QRDVADAZGOUFBI-UHFFFAOYSA-N 397.294 5.026 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2F)cc1NC(C)=O 726427386 KWLQWUCUNQZMTK-VQHVLOKHSA-N 395.455 5.417 30 20 GKED C#CCOc1ccc([C@H](C)OC(=O)Cc2sc(C)nc2-c2cccs2)cc1 730425219 IDDFNORROPZDMH-AWEZNQCLSA-N 397.521 5.039 30 20 GKED O=C(/C=C\c1ncc(-c2cccc(Br)c2)[nH]1)c1ccccc1Cl 731937747 LNXVPTRQGIYAAK-HJWRWDBZSA-N 387.664 5.389 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCC3(CCCCC3)C2)cc1 732417890 LNEZJVZPQDSGHG-HSZRJFAPSA-N 387.527 5.920 30 20 GKED C#CC[C@@H](OC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccccn1 733692467 GVTUZWFXVAVLIP-JOCHJYFZSA-N 391.854 5.089 30 20 GKED C[C@H](CC#N)OC(=O)c1ccccc1SCc1ccc(Br)cc1 733709152 FAXLWASKVAHZOM-CYBMUJFWSA-N 390.302 5.200 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2c[nH]cc2-c2ccc(Cl)s2)c1 733787952 ZMWRHHDFQDWXIW-AWEZNQCLSA-N 399.903 5.008 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccsc1 739155629 JPSGJFFNYGNVHA-JOYOIKCWSA-N 380.416 5.357 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)OC(=O)CCc1ccc(C#N)cc1 739589354 LOJYHCJSQJLZSR-QGZVFWFLSA-N 390.508 5.151 30 20 GKED Cc1cccn2c(/C=C\C(=O)c3ccc(SCC(F)(F)F)cc3)cnc12 741841295 FHLOPOHNKIGCLM-TWGQIWQCSA-N 376.403 5.193 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3ccc(Oc4cnccn4)cc3)oc12 743056476 HQJIJJZTNKWARU-FLIBITNWSA-N 386.407 5.310 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CC(C)(C)c2ccccc2)cc1 743447790 SWMLBEIVJNYPDT-UTKZUKDTSA-N 376.500 5.215 30 20 GKED N#Cc1cccc(-c2nnc(COC(=O)c3ccc(C4CCCCC4)cc3)o2)c1 744577876 XWFSKIRVCFCCNB-UHFFFAOYSA-N 387.439 5.013 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)CCOc3ccccc3)n2)cc1 745948372 YXSSKPRYCUQFQV-FXAWDEMLSA-N 390.508 5.400 30 20 GKED COc1ccc(CNC(=O)N(C2CC2)[C@@H](C)c2ccc3ccccc3c2)cc1C#N 747430179 IZIRUASVAGFJFG-KRWDZBQOSA-N 399.494 5.155 30 20 GKED CC(C)[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccccn1 748321085 DPUIECQTKYQVFJ-JOCHJYFZSA-N 387.508 5.232 30 20 GKED Cc1cc(CSc2ccccc2C(=O)O[C@@H](C)c2ccc(C#N)cc2)on1 748680272 BNVLZAMEXASTDK-HNNXBMFYSA-N 378.453 5.065 30 20 GKED C[C@@H](CCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 750330238 GFOCETKQJCSJAM-HOCLYGCPSA-N 396.462 5.848 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2c(C)cc(C)cc2Cl)cc1C#N 752153796 IMUUSTVJPDNHGS-UHFFFAOYSA-N 386.839 5.041 30 20 GKED C[C@H](Cc1ccc(O)cc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 765907456 JDXRKUJAHSGSJE-KOSHJBKYSA-N 399.494 5.143 30 20 GKED N#C[C@@H](C(=O)[C@@H](c1ccccc1)C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 765916488 SEBIAHNYCZLSSG-ICSRJNTNSA-N 392.911 5.834 30 20 GKED CCc1oc2ccccc2c1C=NOCc1nnc(-c2ccccc2Cl)o1 768522365 PZCHNVHTCHOKFB-UHFFFAOYSA-N 381.819 5.249 30 20 GKED CCCCCC[C@@]1(C)NC(=O)N(c2ccc([C@@H](C#N)c3ccccc3)cc2)C1=O 771903034 HNBJIXSGLKZROE-XUZZJYLKSA-N 389.499 5.127 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(F)cc2)C2CCCC2)ccc1OC 774450638 VDUKYOPXJSJEGT-ZJSXRUAMSA-N 396.506 5.536 30 20 GKED N#Cc1cc(N[C@H](c2ccccc2F)C2CCCC2)ccc1N1CCC(O)CC1 777116880 IKQJLRZUFSAUSJ-DEOSSOPVSA-N 393.506 5.002 30 20 GKED N#C[C@H](C(=O)c1ccc(N2CCCCC2)cc1)c1nc2cc(Cl)ccc2s1 777304694 XBNNVSGXIRUQHJ-QGZVFWFLSA-N 395.915 5.430 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(NCC2CCCC2)cc1 780673087 NMJVDZFEENZECE-INIZCTEOSA-N 378.476 5.224 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)Nc1ccsc1 790312342 CDMLQYOCSUFHRI-UHFFFAOYSA-N 385.327 5.035 30 20 GKED Cc1ccnc2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc12 795204289 IOLBLDHLRHTQRA-QHCPKHFHSA-N 377.447 5.451 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21 796793416 NWRCLDHTBDASQD-MIGQKNRLSA-N 393.314 5.247 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)N[C@@H](CCCC#N)c1ccccc1 838613157 UMAXSRNWAQZHRM-NRFANRHFSA-N 379.504 5.139 30 20 GKED COCC(C)(C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 842289927 UANCMRYKXBFCBR-CYBMUJFWSA-N 397.327 5.356 30 20 GKED N#Cc1ccsc1NC(=O)CCN1c2ccccc2Sc2ccccc21 908181287 QIHWCHRVEXSRKS-UHFFFAOYSA-N 377.494 5.251 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 916411237 VIXJCPFROSEIQC-UHFFFAOYSA-N 384.464 5.157 30 20 GKED Cc1ccc(OCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)c1 916977686 WQVFWAYKRWGIIX-KRWDZBQOSA-N 396.899 5.336 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)cc1Cl)c1nc2cc(Cl)ccc2s1 917043674 MGKWVLORTHEWNE-GFCCVEGCSA-N 395.698 5.675 30 20 GKED CCCCCCC[C@H](C)CNC(=O)c1cc2c(C(F)(F)F)cc(O)nc2o1 918678246 VYMHQDAYIFADAE-LBPRGKRZSA-N 386.414 5.279 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OCC3CC3)cc2)cc1 919815102 RIHGLCOJNCBBHP-XMMPIXPASA-N 382.463 5.383 30 20 GKED CC1(C)[C@H]2CC[C@@]1(C)[C@H](NN=Cc1ccc(-c3cccc(C(=O)O)c3)s1)C2 1776057438 YACOCROSACLSCA-NBCNXNJRSA-N 382.529 5.252 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](c2ccccc2)[C@@H](C)C(=O)O)cc1 1776786496 MTCAASVLKSIUJW-AUSIDOKSSA-N 383.532 5.587 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1OCc1ccccc1 1776786957 DMCYJNYNWVMGHT-JOCHJYFZSA-N 383.532 5.559 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C\c1ccc(-c2ccccc2C(=O)O)cc1 1777038308 AYMTYQMJUZNOTG-ZROIWOOFSA-N 389.426 5.153 30 20 GKED Cc1cccc2c1CC/C(=C/c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777457403 RZUBGIYAQPNOPQ-AUCVXZHOSA-N 398.458 5.412 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)c1 1777461674 AQFPDIIRVAYJSQ-JKGDOXCYSA-N 386.447 5.410 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1 7033620 ONLWQCSXGPAJNR-HNNXBMFYSA-N 393.903 5.123 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1nc2ccccc2o1 41545177 NYOOVHORCKKGRN-LLVKDONJSA-N 387.247 5.839 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 43788432 GSFODQVJPQAFMF-MGPUTAFESA-N 390.874 5.273 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccccc3OC(F)F)c2)c1 47699415 CSHPOHPVIVLATJ-UHFFFAOYSA-N 394.421 5.028 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@@H]2CCc3ccccc32)cc1 48161665 FUGICYZAWRENMU-XMMPIXPASA-N 397.478 5.141 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3cc4ccccc4[nH]3)cc2)cc1 58646517 XLPRITWASYDSBV-UHFFFAOYSA-N 382.423 5.154 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1 61967222 WMSKNSVIAANYTA-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCn1c(SC(c2ccccc2)c2ccccc2)nnc1-c1ccncc1 79433558 BOAOEJQWBBNKKD-UHFFFAOYSA-N 384.508 5.408 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC[C@H]2C2CCC2)cc1 102953527 KVVXDNKCODGWGF-QHCPKHFHSA-N 389.499 5.128 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\Cc3ccc(C)cc3C2=O)cs1 108145216 RCFLWLQGGUFFAR-LDADJPATSA-N 388.492 5.267 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(F)cc1F 108146717 QYPQQKIXKXSUFB-GFCCVEGCSA-N 378.469 5.090 30 20 GKED COc1cccc(-c2nc(CNc3ccccc3SC[C@@H](C)C#N)cs2)c1 108354090 MOGAFQDDKWRGJM-HNNXBMFYSA-N 395.553 5.683 30 20 GKED CN(CCC#N)c1ccc(CN[C@H](Cc2ccccc2)c2cccs2)cc1 116923301 KLAUPCVJPLFCRC-JOCHJYFZSA-N 375.541 5.172 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccc(F)cc3OCC#N)c2cc1C(C)C 120276989 VWGYKOBDLCRXRE-UHFFFAOYSA-N 380.419 5.087 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CCC(F)(F)F 126309869 SZNNGDKMJSSLQF-UHFFFAOYSA-N 389.421 5.497 30 20 GKED C#CCCOc1ccc(CNc2cccc(C[S@](=O)C3CCCCC3)c2)cc1 133317650 MSEJIOCNRJMMNB-MUUNZHRXSA-N 395.568 5.282 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 174341001 REXFXKYJCGNUEH-LJQANCHMSA-N 398.510 5.301 30 20 GKED Cc1ccc(C(=O)Nc2cccc(C#N)c2C)cc1NC(=O)Nc1ccccc1 178380078 NSCRSDMCWAHRLM-UHFFFAOYSA-N 384.439 5.071 30 20 GKED CC(C)Sc1ccccc1NCc1cn(CCC#N)nc1-c1ccccc1 180885110 DVTZSZXTPJMPFF-UHFFFAOYSA-N 376.529 5.576 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 183086770 ZKONCUSSLJYRGR-UHFFFAOYSA-N 395.462 5.055 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](c1ccccc1)c1nccs1)c1ccc(F)c(F)c1 185460399 WYSYQKNMZCUBJZ-MOPGFXCFSA-N 399.466 5.127 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(Cl)cc1F 188917887 LPKFWEWNRVDVEB-LBPRGKRZSA-N 377.872 5.195 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCN(C(=O)c2ccccc2)CC1 189878455 QVZATWDXJDHZDL-UHFFFAOYSA-N 390.527 5.029 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](c2ccc(F)cc2)C[C@H]1C 247052297 WSYPBXNGPJJRMF-NUJGCVRESA-N 397.519 5.630 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 303137041 CELMZIITTZYTQU-UHFFFAOYSA-N 381.435 5.404 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@]3(CC=CCC3)C2)c1 303539976 HQWLTBOHYUMKCM-RUZDIDTESA-N 386.495 5.100 30 20 GKED CC(C)n1nccc1[C@@H]1OCCC[C@H]1/C(O)=N/[C@@H](C)c1ccc(Cl)s1 328931256 HUIHNTLFXXNUNI-OGHNNQOOSA-N 381.929 5.364 30 20 GKED OC(=Nc1cccc(COC2CCCCC2)c1)N1CC2(CCC2)[C@@H]1[C@H]1CCCO1 329720780 AOECQIDQRJYPSF-YADHBBJMSA-N 398.547 5.115 30 20 GKED OC1=Nc2cc(C(O)=Nc3ccccc3N3C[C@H]4CC[C@H]3C4)ccc2SCC1 329889076 ZRIQXVUHVWULFK-HOCLYGCPSA-N 393.512 5.395 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cc(Cl)ccc1F 434160296 QPIWBGYKSLWVPX-ZDUSSCGKSA-N 391.899 5.395 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccc(C(F)(F)F)cn1 435468494 DBQQJIGODCXXLE-MRXNPFEDSA-N 399.347 5.155 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 438670168 VPVKHFTWYYBUOO-RBSFLKMASA-N 399.482 5.429 30 20 GKED N#CCC[C@H](NC(=O)NCCOc1ccccc1-c1ccccc1)c1ccccc1 438846391 BBCFXPQWVABKIU-QHCPKHFHSA-N 399.494 5.077 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CCCC1(C)C 444837571 MJNBBGCMUBKOTO-LJQANCHMSA-N 381.476 5.131 30 20 GKED CCc1noc(C)c1-c1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1 445804658 BVRSSGPGWGMJKY-UHFFFAOYSA-N 388.452 5.285 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 448151343 MNZCANDLEIJHLG-UHFFFAOYSA-N 385.920 5.309 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)C)nc3C)n2)cc1 453632523 VYQUIEMKTAPEFU-GOSISDBHSA-N 391.496 5.136 30 20 GKED C[C@]1(c2ccccc2)CCCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458804381 SLVMUASBJOFTJR-UPVQGACJSA-N 375.516 5.185 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1OC(F)F 460228448 FXUMKHDNHFAUOI-UHFFFAOYSA-N 393.821 5.256 30 20 GKED C[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)c1cccc(OCc2ccccc2)c1 462332553 NFQDRTJHKTZCTM-OALUTQOASA-N 384.479 5.118 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N(Cc1ccc(C#N)cc1)CC(C)C 463578416 VAGGHMVTYKQLPD-UHFFFAOYSA-N 381.545 5.279 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N(C)Cc2ccc(C#N)cc2)cc1 466089631 WIDVHYXVEQTXMX-GOSISDBHSA-N 399.494 5.136 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1 466127716 ZNELWSMYQJAWNW-UHFFFAOYSA-N 392.524 5.322 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)NCc2cc(C#N)ccc2F)cc1 466202207 QQIYSJPOKMMUJS-OAQYLSRUSA-N 379.479 5.042 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@]1(C)Cc1ccccc1 467341420 OAWJCHBFJOSVDZ-MBSDFSHPSA-N 393.556 5.710 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(c3ccc(OC)cc3)CC2)c1 467709933 BOLMBGAKLQSGJF-UHFFFAOYSA-N 380.488 5.062 30 20 GKED C[C@@H](S[C@H](c1ccccc1)c1ccc(Cl)cc1)C(=O)NC1(C#N)CCC1 468474963 LCKPJQIJBSMFCH-DNVCBOLYSA-N 384.932 5.114 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 470499592 WZBODHQNHDIWQM-QGZVFWFLSA-N 377.513 5.269 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1Cc1c(F)cccc1Cl)c1ccccc1 474968155 NDIXLUJRGGRJAI-ROUUACIJSA-N 384.882 5.100 30 20 GKED N#CC[C@@H](CC(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21)c1ccccc1 475447211 USTPLBLVBBQSIU-URXFXBBRSA-N 396.490 5.381 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 475554628 YLFJFSLNNDJDTD-OAQYLSRUSA-N 380.507 5.917 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)cn1CC 476141092 ITABSZXAAMSAFW-UHFFFAOYSA-N 375.310 5.375 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 476527159 XUMYORDXSYNERG-UHFFFAOYSA-N 383.879 5.132 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2c(F)cc(F)cc2F)nc2ccccc21 476635818 MBRBGSWYRIWEBS-LLVKDONJSA-N 376.403 5.003 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)NCC(C)(C)CCC#N)cc1 477108807 OGYCLQGMKSYHJM-QGZVFWFLSA-N 381.545 5.991 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)[C@H](C#N)c1nccc2ccccc12 483211014 FTRAWHNUGFZCMP-MRXNPFEDSA-N 391.496 5.079 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)C1 483625873 OXKCMJXIIQQAQA-PGRDOPGGSA-N 396.918 5.340 30 20 GKED CC(C)c1ccc(/C=C/CC(=O)N2CCC(Oc3ccc(C#N)cc3)CC2)cc1 487418525 IPLNATSAOMABKV-ONEGZZNKSA-N 388.511 5.155 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1ccc(Br)s1 488758948 CCCGVCZABDZMHG-UHFFFAOYSA-N 379.226 5.088 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnn(-c2ccccc2)c1C(C)C 490345352 CDDOYPIHHCSOAP-UHFFFAOYSA-N 377.513 5.526 30 20 GKED N#Cc1cc(NC(=O)c2cnc(-c3ccccn3)s2)ccc1Oc1ccccc1 490495338 HMTZWZFVEDJBSL-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 495102013 PFCYQTBJGVCALZ-HNNXBMFYSA-N 390.405 5.396 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3nc(C4CC4)sc3c2)c1 502502646 QUPZEMROWSUGGM-UHFFFAOYSA-N 392.484 5.500 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(-c2ccccc2)nn1C(C)C 506876511 WCDNYBGBRKSORW-UHFFFAOYSA-N 399.498 5.223 30 20 GKED N#CCCn1cc(CN2CCC[C@H]2/C=C\c2ccccc2)c(-c2ccccc2)n1 507872467 CKBPUCPUHOWZNC-XYSUMVETSA-N 382.511 5.142 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@@H]1c1ccc(Cl)cc1 511544720 DLFDOYIPTMEJOL-HNAYVOBHSA-N 399.947 5.120 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(COc2ccccc2)n1 512531823 JPPKDWPAEMMEQN-UHFFFAOYSA-N 396.560 5.078 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NC[C@H]3CCOc4ccccc43)c2)cc1 517503725 BNPWVHOSHUANBP-GOSISDBHSA-N 399.450 5.038 30 20 GKED Cc1cccc(C)c1OC[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 521261112 MHXKMJVWMLMXLN-MAUKXSAKSA-N 397.544 5.144 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cs1 522073079 RWFJFZCPKBVQBQ-AWEZNQCLSA-N 392.484 5.252 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccc(Cl)cc2)c2ccccc2Cl)nc1 522122554 RUJLDLNVGLWEOL-UHFFFAOYSA-N 382.250 5.107 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCOc3c(-c4ccccc4)cccc32)cc1 523372263 QAAIHHCYJLUTNE-QFIPXVFZSA-N 383.451 5.065 30 20 GKED CCCn1c(S[C@@H](C#N)C2CCCCC2)nc2cc(Cl)ccc2c1=O 524534294 LKVPARTVMBHVHL-KRWDZBQOSA-N 375.925 5.024 30 20 GKED Cc1[nH]nc2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc12 535821006 DHXPGHWRGUQPBG-UHFFFAOYSA-N 384.464 5.147 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 536772681 PRMVTDZFTFVZHR-UHFFFAOYSA-N 397.429 5.062 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)s1 540609117 AFAQJGKPRQHSNJ-IBGZPJMESA-N 383.314 5.261 30 20 GKED Cc1cc(Br)c2ccccc2c1NCCCC1(C#N)CCOCC1 540809290 AMVYFCXTGBZRKN-UHFFFAOYSA-N 387.321 5.423 30 20 GKED CCc1sc(-c2nnc(CSc3cccc(Cl)c3C#N)o2)cc1C 543031310 BJXWVOKXRMBQDY-UHFFFAOYSA-N 375.906 5.486 30 20 GKED N#Cc1ccc(Cc2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)cc1 545704453 ZERNTNITGBFQIY-UHFFFAOYSA-N 388.814 5.040 30 20 GKED C=C[C@H](Cc1nc(-c2cc(Cl)ccc2O[C@@H]2CCOC2)no1)c1ccccc1 547267023 VPFXLQALKWZFHJ-CRAIPNDOSA-N 396.874 5.070 30 20 GKED N#CCCC[C@@H](N[C@H]1CCc2c(F)cc(Br)cc21)c1ccccc1 550827138 KTXPTZDZNTUQBF-UXHICEINSA-N 387.296 5.600 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NCCCC(F)(F)F)cc1Cl 551322229 KYXJWBQZCYUPTR-UHFFFAOYSA-N 382.769 5.076 30 20 GKED C[C@H]1CC(CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@H](C)O1 558812657 LZUIEBAAPIAAOW-IRXDYDNUSA-N 394.540 5.033 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)CC3(C#N)CCOCC3)cc2)c(C)c1 596648909 BABIYBZPKNFHOJ-UHFFFAOYSA-N 380.513 5.104 30 20 GKED C[C@@]1(C#N)CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)C1 596704633 CFKPLDBAZLBKJX-IBGZPJMESA-N 389.377 5.265 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1cccc(C#N)c1 600848874 LTOSJAWVYFPNTF-CYBMUJFWSA-N 399.372 5.595 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccc(F)cc1 604112888 NZPHUSCUHNYRHW-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CCc1c(C)sc(NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)c1C#N 609032391 FYNMKPCIWRTJJL-UHFFFAOYSA-N 395.528 5.262 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 609071759 ZFEOXQKAEFFOSY-QFIPXVFZSA-N 386.451 5.016 30 20 GKED CCC[C@H](NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 609387655 AYLOPPACDRZNLO-GGPKGHCWSA-N 395.572 5.396 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc3c(Cl)cccc3s2)cc1 609413506 JIBOGANOGKAHTH-UHFFFAOYSA-N 384.888 5.514 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)NC[C@H](C)c1ccccc1 609466150 MGTAJYKWBRNPMU-RBUKOAKNSA-N 399.494 5.071 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(Cc3cccs3)C3CC3)cc2)cc1 609500051 MSWXPZIMTBDQJL-UHFFFAOYSA-N 388.492 5.411 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccccc12 609682263 FRPDINPTAIHVRP-CQSZACIVSA-N 379.485 5.315 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCCCC[C@@H]3c3ccco3)o2)cc1 609909191 STPBXGZDAJUTME-HXUWFJFHSA-N 390.439 5.081 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccco1 609929604 GEJXTXIUJVYGCS-SJLPKXTDSA-N 383.517 5.681 30 20 GKED Cc1cnc(-c2cccc(NC(=O)c3cccc(Nc4ccc(C#N)cc4)c3)c2)o1 609989507 GUGCLBGCGYYKDN-UHFFFAOYSA-N 394.434 5.518 30 20 GKED N#C[C@@H](C(=O)c1c(-n2cccc2)sc2c1CCCC2)c1nc2ccccc2o1 614439907 WUZQJKHIRYTHEK-HNNXBMFYSA-N 387.464 5.049 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc([N+](=O)[O-])c1 617726697 BYKCLFOIABZDLT-HNNXBMFYSA-N 387.395 5.001 30 20 GKED Cn1ncc(C2CC2)c1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 657497998 JLVRXXUTQLVSER-UHFFFAOYSA-N 395.322 5.199 30 20 GKED C=CCCC(=O)OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 726650462 GMPQIDJZAHSFTJ-UHFFFAOYSA-N 392.908 5.107 30 20 GKED N#Cc1cccc(COc2ccc(NC[C@H]3CC3(Cl)Cl)cc2Cl)c1 728053173 QXNIKGLHIGKWGL-CQSZACIVSA-N 381.690 5.396 30 20 GKED O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)CCc2nc(-c3ccccc3F)sc21 731936509 AFCCJTNMHGGUSS-QBFSEMIESA-N 380.400 5.070 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 734965984 RXLBXHNEGLOREB-GDBMZVCRSA-N 396.462 5.767 30 20 GKED COc1c(Cl)cccc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740442860 DWIMWKSURWHVBT-UHFFFAOYSA-N 397.887 5.270 30 20 GKED Cc1ccc([C@H]2CCCCN2CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 741792643 CXADOYFKRWCGFD-AZUAARDMSA-N 389.524 5.008 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)[C@H]3CCSc4ccccc43)c2)s1 741948621 NYRQFSZFEWRAQK-IBGZPJMESA-N 390.533 5.183 30 20 GKED FC(F)(F)c1ccc2sc(NN=Cc3c(Cl)nc4ccccn34)nc2c1 743445289 NHFNALKLYZFFNC-UHFFFAOYSA-N 395.797 5.062 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 743457239 AINBUQUXICDTPO-NRJHKNTJSA-N 387.439 5.101 30 20 GKED CC/C(=C\C(=O)Nc1nc(C)c(SCC#N)s1)c1cccc(Cl)c1 744489552 MIKZLYKJARXCTA-ZRDIBKRKSA-N 377.922 5.153 30 20 GKED C=C(C)COc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)ccc1OC 745990521 RYAUBNOJWYWJMN-ONNFQVAWSA-N 385.463 5.608 30 20 GKED CO[C@@H](C)c1nc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cs1 749135093 KOFODSCYOSREJD-AWEZNQCLSA-N 397.475 5.052 30 20 GKED CC(C)OC1CCC(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 752183249 DNUWUDZIIQDWGT-VNXZQDSDSA-N 391.515 5.200 30 20 GKED N#Cc1cc(Br)ccc1Oc1nc(C(F)(F)F)nc2ccccc12 759247241 AOYKDBCCRVMHEX-UHFFFAOYSA-N 394.150 5.075 30 20 GKED Cc1nc([C@H](C)OC(=O)/C=C\c2ccccc2C#N)oc1-c1ccc(Cl)cc1 763907814 GTTJRLZXSXMXJA-LMRWQKIVSA-N 392.842 5.493 30 20 GKED COc1ccc(/C=C/C(=O)c2c[nH]c3ccccc23)c(OCc2cccnc2)c1 766491957 RWQHDSZXQUSGKG-PKNBQFBNSA-N 384.435 5.047 30 20 GKED O=C1Nc2ccccc2C12CCC(=NNc1c(Cl)cc(F)cc1Cl)CC2 767910181 FGXMVKKKKGGVQV-UHFFFAOYSA-N 392.261 5.365 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775304006 ADOICFSHNWJZBY-FGZHOGPDSA-N 399.498 5.051 30 20 GKED C=CCCC[C@H](C)NC(=O)c1ccsc1NC(=O)c1ccccc1Cl 776016424 RCUUFBAYBNXBNF-ZDUSSCGKSA-N 376.909 5.128 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3cccc(F)c3F)cc2)oc1C(=O)O 776268485 QTHZFIZXEKBMBX-JXMROGBWSA-N 398.361 5.040 30 20 GKED C[C@@H](Nc1cccc(OCc2ccc(F)cc2)c1)c1ccc(OCC#N)cc1 776821063 YWKMIZYOQYBWAK-QGZVFWFLSA-N 376.431 5.480 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)OCC1(C#N)CCCCC1 780490163 OTGQBRUATIYNFZ-UHFFFAOYSA-N 384.501 5.215 30 20 GKED CCOc1cc(/C=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1O 780886668 CNLMJSOZGZXARU-BQEXRTDESA-N 398.462 5.098 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c(C)n1-c1cccc(Cl)c1 781034867 RLUQTQLKYBPUEM-HNNXBMFYSA-N 393.874 5.291 30 20 GKED N#Cc1cnc2c(c1)CC/C(=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C2=O 788357301 QGYSTBNHRUOXCH-DXNYSGJVSA-N 396.290 5.203 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(C(C)(C)C#N)cc1 793770359 ADHBYUIJPDOQGQ-IBGZPJMESA-N 398.506 5.597 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)cc1 798505573 RRGAKENJJZCQNR-KBRIMQKVSA-N 375.299 5.320 30 20 GKED CC(C)(C#N)CCCSC1=NC(=O)/C(=C/c2csc3ccccc23)S1 814774218 ZVLLCDMDNAVLHK-YBEGLDIGSA-N 386.567 5.935 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)N2[C@H]3CC[C@H]2c2ccccc23)s1 819305100 MHVQOXJVDPFDDY-HOTGVXAUSA-N 390.961 5.257 30 20 GKED N#CCCC[C@@H](N)c1nc(C2(c3cccc(C(F)(F)F)c3)CCCCC2)no1 823110294 PKQDFCCWXAYSCN-MRXNPFEDSA-N 392.425 5.032 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 842941512 QOBBWUVDUGZOIS-NHYWBVRUSA-N 389.318 5.153 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842944347 JIKUPTNBXBKYHI-MRXNPFEDSA-N 397.500 5.166 30 20 GKED CCOc1cc(/C=C/C(=O)c2sccc2Br)cc(Cl)c1O 915112572 FBAVATLSLBJLQS-ONEGZZNKSA-N 387.682 5.164 30 20 GKED CC(C)CC[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)cc1 916680353 HZXVEYHNNMTCAG-HXUWFJFHSA-N 385.895 5.541 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCSc2ccccc2)cc1 916953729 DMBBNDNTPMCZTD-OXJNMPFZSA-N 380.513 5.030 30 20 GKED C=CCOc1cccc(NC(=O)c2cc3ccccc3cc2NC(=O)C2CC2)c1 919837575 FTVHSHQNGGWONK-UHFFFAOYSA-N 386.451 5.005 30 20 GKED CCCCC1CCC(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC1 920141303 NJOQEHOZIBYFMV-GQOXECLESA-N 391.540 5.855 30 20 GKED COc1ccc(-c2cc(N=Cc3cccc(O)c3O)ccc2OC(F)F)cc1 920943710 FBILHRSRZJRUSC-UHFFFAOYSA-N 385.366 5.125 30 20 GKED CCC(CSc1ccc(Cl)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033497 QYSVJPHPBYWTHJ-UHFFFAOYSA-N 383.300 5.662 30 20 GKED O=C(O)c1ccc(C=NNc2ccc(Cl)c(C(F)(F)F)c2)c(Cl)c1 1776090801 AYDKYJRWWSRWLE-UHFFFAOYSA-N 377.149 5.156 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc(Br)cc3)o2)cc1 1776114101 FZEYUHAZGYCKMG-LUAWRHEFSA-N 397.224 5.303 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3ccc(F)c(F)c3)cc2)c1 1776125473 JQFSICZTERQYSC-WDZFZDKYSA-N 378.374 5.155 30 20 GKED Cc1cc(C)c(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1C 1776132847 HQESEIGYQKYFOI-VQHVLOKHSA-N 376.477 5.935 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1)C(=O)O 1776469767 HJSRAKAWMYOSHJ-ZUYFITGHSA-N 399.657 5.395 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@@H](C(=O)O)CC2(C)C)cc1 1776787502 HOQQZEPOAUGBEY-KRWDZBQOSA-N 377.550 5.074 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)c(C)c(C)c1C)=C(/S)NC(C)(C)C 55014160 POGSFVZBFGXFNB-UHFFFAOYSA-O 397.608 5.097 30 20 GKED CCc1noc(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 56036948 PKYWPYYMEPXFPF-UHFFFAOYSA-N 381.819 5.115 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 60460089 OTGJHDJNPYWIMJ-GFCCVEGCSA-N 396.921 5.005 30 20 GKED CN(C(=O)c1ccc(-c2ccc(Br)cc2)s1)c1cccc(C#N)c1 63326696 AOZCQTOCPUNPIA-UHFFFAOYSA-N 397.297 5.326 30 20 GKED CCN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)[C@H](C)C(C)C 65412346 MFLMYSYYBCMTHY-GOSISDBHSA-N 379.504 5.230 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3SC[C@@H](C)C#N)c2cc1C 68782280 STBZRFVUTPOMHB-AWEZNQCLSA-N 378.497 5.274 30 20 GKED Cc1nc(NC(=O)c2cc3ccccc3c3cccnc23)sc1SCC#N 107916258 BVPLVMBRYDZYKY-UHFFFAOYSA-N 390.493 5.021 30 20 GKED N#CCCSc1ccccc1NC(=O)CSc1cccc(C(F)(F)F)c1 108200535 ANGQMPWCKYHEFU-UHFFFAOYSA-N 396.459 5.442 30 20 GKED CC[C@@H]1c2ccsc2CCN1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 108359076 SJDJUGBYFUORLI-MAUKXSAKSA-N 399.585 5.090 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 113570663 MHNGKMVCWQMAJM-MRXNPFEDSA-N 383.517 5.650 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 114619055 DBSHFJXELWGSQF-PCCBWWKXSA-N 395.487 5.338 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ncc(-c2ccccc2)o1 126195084 QCVQNSPPHPFGAV-QGZVFWFLSA-N 393.446 5.371 30 20 GKED C[C@H](Oc1ccccc1NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1 133887706 RUYPUYOMXMZKHD-KRWDZBQOSA-N 396.450 5.360 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccc(F)cc1OCC#N 135327902 WSMMLOZMDIXBKA-INIZCTEOSA-N 381.451 5.123 30 20 GKED N#CC1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 171650491 ABRMJJIVSRRTHN-IBGZPJMESA-N 388.298 5.028 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(SC(=O)N(C)C)c1 176880622 NKBTWEJJQQNYDS-HNNXBMFYSA-N 385.558 5.324 30 20 GKED C[C@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(OCC#N)cc1 181622476 JXTVXUBCBXOCBJ-MBSDFSHPSA-N 390.458 5.199 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CN2CCCCCC2)C1 191419003 CJGYFPVWBRTRGD-NRFANRHFSA-N 397.607 5.658 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccc(C#N)c2)cc1 237714326 VPINKFQXEYSMRS-UHFFFAOYSA-N 378.479 5.009 30 20 GKED Cn1c(C(C)(C)C)nc2cc(N=C(O)[C@@H]3CCC(=O)c4ccccc43)ccc21 328823679 RGFXMFQXRUCHKA-QGZVFWFLSA-N 375.472 5.219 30 20 GKED Cc1cc(C(C)(C)/C(O)=N/[C@H]2CCC(O)=NC23CCC3)ccc1Br 329685964 FQHTXBUIRZZVIX-HNNXBMFYSA-N 393.325 5.033 30 20 GKED CC1(C)C[C@@H](/N=C(/O)c2ccc3c(c2)C(C)(C)C(O)=N3)c2ccc(F)cc2O1 330210808 CORCHXFWYSPNEI-QGZVFWFLSA-N 382.435 5.312 30 20 GKED Cc1sc(Br)c(C(=O)Nc2scc(C(C)(C)C)c2C#N)c1C 410932211 SXCLKSCVJXMIQX-UHFFFAOYSA-N 397.363 5.610 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 431775928 LAGIMYYKTPDUAY-DNVCBOLYSA-N 387.430 5.083 30 20 GKED Cc1c(C(=O)N(Cc2ccco2)Cc2ccco2)sc2ccc(C#N)cc12 431843866 KIPHELXHRFKMPX-UHFFFAOYSA-N 376.437 5.110 30 20 GKED CC[C@@H](CNC(=O)N[C@H](CCCC#N)c1ccccc1)Oc1ccccc1Cl 431982386 RZOUVNBQPHCBNT-AZUAARDMSA-N 399.922 5.232 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438839517 FWSIGKJKVLOGFL-BEFAXECRSA-N 389.421 5.453 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 439567458 HHGCGPVGSGBQJC-HNNXBMFYSA-N 389.411 5.440 30 20 GKED CCCc1c(NC(=O)c2ccc(SCC)cc2)cnn1-c1cccc(C#N)c1 440092129 NKIYXKWXEHTRMY-UHFFFAOYSA-N 390.512 5.061 30 20 GKED CCN(C(=O)NCC1CCC(C#N)CC1)[C@H](C)c1cccc(C(F)(F)F)c1 440990452 UZOLOCOITACYAB-QQFBHYJXSA-N 381.442 5.128 30 20 GKED C/C=C\COc1cccc(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 448944769 TWOBWHXCTWSWQE-LIMHQNJXSA-N 380.513 5.217 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1ccc(C)c(C)c1 453467582 RGCJQNQLUOHRKE-SFTDATJTSA-N 380.536 5.054 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCOc4ccc(Cl)cc43)c2)cc1 460619769 NLXNKEDUFYUTKF-UHFFFAOYSA-N 390.826 5.043 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CC[C@H]3CCC[C@@H]3C2)cc1 461413167 AHZIDISWLAWUMX-NJDAHSKKSA-N 390.552 5.549 30 20 GKED N#Cc1cccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1 464067278 BVRQPROPGHATGZ-UHFFFAOYSA-N 379.822 5.215 30 20 GKED C[C@@H](CNC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 468299723 HKVRHMAIPHLLLG-JTQLQIEISA-N 393.302 5.397 30 20 GKED N#Cc1ccc(C[C@H](C#N)C(=O)Nc2cccc(CSC3CCCC3)c2)cc1 470987040 WPGOBDUIWPRTPE-HXUWFJFHSA-N 389.524 5.055 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1c2ccccc2SC[C@H]1C 472584883 YCKFPHOIUWVRDA-HZPDHXFCSA-N 397.569 5.020 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2ccccc2)n1 476078970 IPVCBLVGWNJLEG-UHFFFAOYSA-N 376.525 5.843 30 20 GKED C=C(C)[C@@H](NC(=O)NCc1cccc(-c2cccnc2)c1)c1ccc(F)c(F)c1 477174327 AKLKHSWGFXVFBN-JOCHJYFZSA-N 393.437 5.143 30 20 GKED C[C@@H](NCc1ccc(C#N)o1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 480460762 MCJHYQGYFBVEEO-GFCCVEGCSA-N 376.403 5.749 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1ccc(F)cc1OC1CCOCC1 483119116 OVTYSRRBSHSVGG-UHFFFAOYSA-N 384.451 5.146 30 20 GKED Cc1nc(-c2cccc(C(=O)N[C@H](CCCC#N)c3ccccc3)c2)cs1 487185339 LHBIXHMLLYKTRP-HXUWFJFHSA-N 375.497 5.284 30 20 GKED N#Cc1ccc(CN[C@@H](CC2CC2)c2cc(F)cc(Br)c2)s1 495163909 LHPKQISSNWKCAI-KRWDZBQOSA-N 379.298 5.152 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(F)ccc2s1)c1c(Cl)cccc1Cl 499812284 NANZOJCIUYFUJQ-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 503723879 AHDZSEWDPNSUII-RUZDIDTESA-N 397.522 5.578 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 511336822 ZZEPRXDTIHWNNZ-QFIPXVFZSA-N 379.479 5.160 30 20 GKED Cc1sc([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 512630236 LWBRXWYHFDSYPL-OLZOCXBDSA-N 399.922 6.195 30 20 GKED O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513552478 XJAGCDFXXBPKMG-CYBMUJFWSA-N 383.307 5.039 30 20 GKED N#CCCC1CCN(C(=O)c2cccc(OCc3cccc(Cl)c3)c2)CC1 516295774 ZVDJVJDPGOURHP-UHFFFAOYSA-N 382.891 5.075 30 20 GKED C=CCN(C(=O)C[C@H](CC)C(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517922171 XJUQWYKUGHCSQQ-HNNXBMFYSA-N 387.505 5.310 30 20 GKED Cc1[nH]c2ccc(CNCc3cccc(OCc4ccccc4C#N)c3)cc2c1C 518276859 XTZKCKSXZSLIPR-UHFFFAOYSA-N 395.506 5.525 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(Oc3cccnc3)cc2)c1 518612670 IAOGXEYYRZGCSU-UHFFFAOYSA-N 380.245 5.120 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 518683216 MQXDKYUUWKXZLH-PXNSSMCTSA-N 381.545 5.847 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2cccc(F)c2)no1 520924315 UEQOMZCQSKXCFF-ZDUSSCGKSA-N 381.432 5.127 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 521840660 FSMANEPPLLFBEL-CQSZACIVSA-N 395.846 5.822 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)cc1 524253870 IMMQLFFYQZWUIB-HXUWFJFHSA-N 398.940 5.271 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)s1 524389882 DYSQEPXKDHGOFD-UHFFFAOYSA-N 391.496 5.025 30 20 GKED Cc1cc([C@@H](NC(=O)Cc2ccc(C#N)cc2)c2ccccc2Cl)ccc1F 525080781 RBEDUVRLGKCSIG-HSZRJFAPSA-N 392.861 5.108 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 525570556 JWQLWQQNXDMKAH-SJKOYZFVSA-N 380.797 5.233 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccccc1C(F)(F)F 525591930 FYNHSIISUIXQCG-OAHLLOKOSA-N 390.405 5.004 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c2c1 530589341 AJBSCDAESLAQSC-CQSZACIVSA-N 377.513 5.106 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)c1ccc(CC#N)cc1 536184191 WOCWSIYEZKBQJX-UHFFFAOYSA-N 398.441 5.006 30 20 GKED N#CCC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)CC1 542905252 HRLUMACAPAVSEC-UHFFFAOYSA-N 389.282 5.552 30 20 GKED COc1c(F)ccc(F)c1C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542968453 ZHQXBVRIFKHYIH-AWEZNQCLSA-N 392.405 5.003 30 20 GKED C[C@@H](N[C@H](C)c1nc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543861458 RFWMTUIAYNMCPE-QZTJIDSGSA-N 394.478 5.687 30 20 GKED C[C@@H](NCc1ncc(-c2cccs2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543873667 AOICMBUYVOTXOV-MRXNPFEDSA-N 385.492 5.793 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCCC[C@@H]2CCCCO2)c1 546162663 MHOMHVWDZGFKSY-IBGZPJMESA-N 398.890 5.083 30 20 GKED C[C@@H](Nc1cccc(Oc2ccccc2)c1)C(=O)N(CCC#N)c1ccccc1 552445429 QOWKETRFYLMGNI-LJQANCHMSA-N 385.467 5.226 30 20 GKED COC1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 552970237 QCFZXGQZGJGSDU-UHFFFAOYSA-N 399.878 5.037 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)N(CCC#N)c3ccc(F)cc3)cs2)cc1 554283776 WOEOZWVNRSTXMQ-UHFFFAOYSA-N 393.487 5.633 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(Oc2cccnc2)cc1 555099749 WFKFNSDJJSEVOT-OAHLLOKOSA-N 397.400 5.615 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1CC(C)(c2ccccc2)C1 557581866 JSFMIQIHBIGRQX-GENZYMQKSA-N 379.529 5.180 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc(Cl)c1Br 560228020 CHZRNFSTLYDVKI-NSHDSACASA-N 389.636 5.042 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 562165514 RPIKQWPKSZKLBW-UHFFFAOYSA-N 396.491 5.554 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(=Cc3cccc(F)c3)CC2)c1 589741670 OSEBIDYWNKINAH-UHFFFAOYSA-N 380.463 5.492 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1 591773949 HYUBTTWGOBRVRC-RHSMWYFYSA-N 394.462 5.115 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1[C@H]1CCCOC1 599410087 XICOMFSRYFCRJT-AEFFLSMTSA-N 397.544 5.103 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 603968965 PVBRWTSRJPNBBL-HIFRSBDPSA-N 378.419 5.594 30 20 GKED N#C[C@@H](C(=O)c1cc2c(Cl)cccc2s1)c1nc(-c2ccncc2)cs1 604005444 NNZQANDHMCDPGF-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)Cc2coc3ccc4ccccc4c23)c1 609067999 CLBHWJVCZZROID-UHFFFAOYSA-N 392.361 5.240 30 20 GKED CCc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 609104814 OZLHQMFLTSMVJG-UHFFFAOYSA-N 380.444 5.153 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609177097 JLDJBIZXDVIHAO-UHFFFAOYSA-N 381.435 5.322 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(Cl)cc1Cl 609431365 MAYJJQBRWKEART-CYBMUJFWSA-N 393.339 5.959 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1ccc(C#N)cc1F 609566474 JPYXUTMJEWLVAS-UHFFFAOYSA-N 382.341 5.044 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@H]1CCC[C@@H](C)C1 609575680 MSSLKQPKWXHXLX-VGSWGCGISA-N 394.490 5.134 30 20 GKED Cc1ccc(-n2ncc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2C(C)C)cc1 613292506 MROKCJBMEOJWFW-FQEVSTJZSA-N 394.478 5.342 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)n(C(C)C)c3C)n2)cc1 613315649 XHNFQQGTSHHSAJ-IBGZPJMESA-N 377.513 5.608 30 20 GKED C=CC[C@H]1CCCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 617787510 QAEMDGKWNNDMHE-AWEZNQCLSA-N 393.314 5.396 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1coc2ccc(F)cc12 619128069 DFGMPEJBJRUIHW-UHFFFAOYSA-N 385.279 5.355 30 20 GKED C=C(C)Cn1c([C@H]2CC[C@@H](C)O2)nnc1N1CCC[C@@H]1c1ccc(Cl)cc1 624984086 YOOXYSYZPQBAOJ-ATZDWAIDSA-N 386.927 5.089 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)nc1 653734803 KBMYOMGURZBPPQ-LBPRGKRZSA-N 398.253 5.071 30 20 GKED C=CCC[C@@H](NC(=O)N(C)CC1=CCSC1)c1ccc(C(F)(F)F)cc1 660937942 DVFOHVGRWJHXND-QGZVFWFLSA-N 384.467 5.027 30 20 GKED C=C(C)COc1cc(CNc2cccc(-c3nc(C)c(C)o3)c2)ccc1OC 676319262 HKBKDJVZOUYYIG-UHFFFAOYSA-N 378.472 5.534 30 20 GKED COc1ccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1F 726461485 UEHARIWVXMJHFK-IBGZPJMESA-N 391.471 5.299 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(OCc3csc(C)n3)c2)C(C)C)c1 728247512 GIGPQNSOESHCCV-UHFFFAOYSA-N 390.508 5.067 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C\c2ccc(N3CCOCC3)c(F)c2)cc1 728441995 SHQFRPQVMCXJBG-WMZJFQQLSA-N 385.504 5.059 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccccc2SC[C@@H](C)C#N)c(Cl)c1 730954892 NQEYPGVMCUJOEQ-ZDUSSCGKSA-N 389.977 6.018 30 20 GKED C#CCOc1cccc(NC(=O)N(CC)[C@@H](C)c2cccc(C(F)(F)F)c2)c1 731110895 ITQGURBAHQXNKV-HNNXBMFYSA-N 390.405 5.332 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 732495994 LFYHHCGSVXCGKD-YVJSUPCUSA-N 396.874 5.882 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1cccc(F)c1 732496543 YNSUYDPNZSSKEO-DQXUBXGMSA-N 376.456 5.537 30 20 GKED COc1cc(/C=C2/CCOc3ccc(Cl)cc3C2=O)cc(Cl)c1OC 733749019 QEGIMVRZCXLLLH-GHXNOFRVSA-N 379.239 5.059 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 733851947 NQZDXMSNPHPVNY-JTHBVZDNSA-N 391.515 5.194 30 20 GKED N#C[C@@H](C(=O)c1cc2c(F)cccc2s1)c1nc(-c2ccncc2)cs1 734082925 JCVHIEQTSSEZNN-ZDUSSCGKSA-N 379.441 5.049 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 734706409 GWPLGKPXNUPIFR-NSHDSACASA-N 394.443 5.531 30 20 GKED C[C@H](OC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccc(C#N)cc1 735675362 GGJYHNCEGLPFBV-INIZCTEOSA-N 379.419 5.086 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3ccccc3F)n2)cc1 739157835 XIDKGJZJUQWWEE-CRAIPNDOSA-N 378.472 5.313 30 20 GKED Cc1cc(C)c(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c(C)c1 740428405 SYTDVYIRFQAGKN-UHFFFAOYSA-N 375.497 5.534 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1sc2cccc(Cl)c2c1Cl 741635806 TVCRCDJFJGSGOL-UHFFFAOYSA-N 394.254 5.612 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccccc2OCc2ccccn2)cc1F 741847919 SPUJNTWJTMCHMY-PKNBQFBNSA-N 379.456 5.418 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@@H]2Cc2ccccc2)cc1 743096043 OAIFXDYWYBLJMA-QTJGBDASSA-N 381.479 5.095 30 20 GKED Cc1sc([C@@H](C)NCc2ccc(OCC#N)cc2)nc1-c1ccc(Cl)cc1 754942828 NSTLTHRASDOXQH-CQSZACIVSA-N 397.931 5.525 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccc[nH]1 760743886 VVBDCHHLZHCTJP-KDOFPFPSSA-N 378.863 5.206 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cccc(O)c1F 762321106 QMBYFZAJTSYJRV-PLNGDYQASA-N 393.258 5.221 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](Cc2nccn2C)c2ccccc2)cc1 766298554 CCVRSBGVFGNPIF-XMSQKQJNSA-N 395.934 5.186 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCC(=O)c2cccc(F)c2)cc1 767250798 PFJKSRUIXVRNPG-QFIPXVFZSA-N 386.426 5.083 30 20 GKED N#CCCCn1cc(C(=O)OCc2cc(-c3cccs3)on2)c2ccccc21 769545847 CHNHVJGJIGZODV-UHFFFAOYSA-N 391.452 5.019 30 20 GKED N#Cc1cc(N[C@@H](c2ccccc2F)C2CCCC2)ccc1N1CCC(O)CC1 777116883 IKQJLRZUFSAUSJ-XMMPIXPASA-N 393.506 5.002 30 20 GKED CCC[C@H]1C[C@H](C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)CCO1 780167565 WCIVYNYHGLRPDZ-OFNKIYASSA-N 391.511 5.025 30 20 GKED N#Cc1cc(NC(=O)c2cc(Cl)ncc2Cl)ccc1Oc1ccccc1 781042053 WFJRMDNPAXAPHD-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC(C)n1ncc2cc(/C=C3/CCc4[nH]c5ccccc5c4C3=O)c(Cl)nc21 781551127 GZMBTQXGDPWAKK-LCYFTJDESA-N 390.874 5.359 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)CCCc2ccsc2)cc1 783430821 VBLWXTRPFMEIOO-UHFFFAOYSA-N 392.499 5.311 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1 791127481 GZVQQHKVCNSQKR-UHFFFAOYSA-N 392.462 5.166 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1 793892364 SNFLWAINXWMIGT-SFTDATJTSA-N 396.535 5.102 30 20 GKED CN(C(=O)Cc1ccc(OCC#N)cc1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 798542706 DXENAOYOOMIZAY-HSZRJFAPSA-N 396.918 5.175 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1)C[C@@H](O)c1ccco1 800579226 ZDKXWXVUQXALGM-JOCHJYFZSA-N 390.483 5.166 30 20 GKED C#CC[C@@H](Cc1ccccc1)NC(=O)Nc1cccc(COC(C)(C)C)c1C 806328675 JITKTVRTICTKID-NRFANRHFSA-N 378.516 5.066 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OC[C@H]1CC[C@@H](C#N)CC1 809085771 MARRDMHVXMRUSM-OKILXGFUSA-N 392.377 5.156 30 20 GKED C[C@H](N[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 810264242 ZHZQGOSTNQWQHS-AVRDEDQJSA-N 393.531 5.255 30 20 GKED COc1ccc2cc(/C=C/C(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2c1 817314136 OXXQFWOKUFOXNU-MXWQMBOOSA-N 384.479 5.413 30 20 GKED N#CCCCOc1cccc(N[C@@H](c2nc(Br)cs2)C2CC2)c1 817581702 WDCGGTOVGYYCKM-MRXNPFEDSA-N 392.322 5.151 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 821447844 MAPUFGPFGTUVFS-UHFFFAOYSA-N 392.908 5.127 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 845840777 FOSAJDNTBXCXDH-BBRMVZONSA-N 386.278 5.107 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 860844272 HRPJMBJGQODIOE-HUUCEWRRSA-N 389.318 5.153 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1 915085705 DVIUMQDKGBTEIJ-HXUWFJFHSA-N 380.369 5.613 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2Cl)cc1 915352490 LLUSRUQCLVLBMU-FQEVSTJZSA-N 375.859 5.317 30 20 GKED COc1cc(/C=C/C(=O)c2scnc2C)ccc1OCc1ccc(F)cc1 915987909 MTAAFBAPGVUYDI-WEVVVXLNSA-N 383.444 5.074 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Cl)nc(Cl)c3)cc2)cc1 921010415 IVZGVFICZTVFIQ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)cc1 1776119745 KOYIBHCDQSEPTH-RUDMXATFSA-N 387.273 5.341 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)cc1 1776125687 QDIFTSUFAVLZTR-GXDHUFHOSA-N 384.447 5.769 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cnc(CCc2ccccc2)s1 1776785654 OSBAYRGNYFVCOS-IBGZPJMESA-N 388.577 5.222 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(F)ccc2Oc2cncc(Cl)c2)c1 1777685013 UFAWKNUYYWIERH-GQCTYLIASA-N 397.789 5.261 30 20 GKED N#Cc1c(NC(=O)c2ccc(SC(F)F)cc2)sc2c1CCCCC2 10390910 DFTSJQZHHLURJE-UHFFFAOYSA-N 378.469 5.456 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)n1 41516615 VSDPYEASFZKLRS-GOSISDBHSA-N 385.448 5.264 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1C 64714528 SHARYUBRFFBWCJ-NSHDSACASA-N 388.464 5.511 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(F)c1 66955205 CXRYVJJTGAVIMJ-DNVCBOLYSA-N 383.492 5.589 30 20 GKED COc1c(C)cc(CN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 66956040 FPBUFDFLOVAMAG-KRWDZBQOSA-N 397.544 5.370 30 20 GKED N#Cc1ccc(/C=C\C(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 96316138 JMDDMLQOCOIUBN-VPLQDYMCSA-N 384.401 5.344 30 20 GKED Cc1ccc(-c2noc([C@@H](C)Nc3ccccc3SC[C@H](C)C#N)n2)cc1F 108408017 QCHUPLVMYAIHNW-UKRRQHHQSA-N 396.491 5.609 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@H](Nc2ccccc2)C1 111015546 MTIRCXHJRMIPHO-FQEVSTJZSA-N 399.519 5.036 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)CC1 111736504 ZENANZMNAICOTN-UHFFFAOYSA-N 397.906 5.047 30 20 GKED C=C(C)Cn1c(SCc2cc(C)nc3ccccc23)nnc1-c1ccncc1 123319890 QFKVLEHONSKZGS-UHFFFAOYSA-N 387.512 5.065 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCSc2ccccc21 171741480 IFXAAXDALSLZIY-GDBMZVCRSA-N 383.542 5.297 30 20 GKED C[C@H](c1ccc(F)c(F)c1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 178699817 COCTXIDLZOLHIK-OAHLLOKOSA-N 397.446 5.179 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(OCc2ccccn2)c1 179695397 UUFKVARIOKMLNA-LJQANCHMSA-N 385.511 5.313 30 20 GKED C=CCN(C(=O)c1ncccc1C(F)(F)F)c1nc(-c2ccccc2)cs1 179905744 VNTRYDQLAOEBER-UHFFFAOYSA-N 389.402 5.057 30 20 GKED Cn1cc(CNc2ccc(COC3CCCC3)cc2)c(-c2ccc(C#N)cc2)n1 180235962 FGJCVOPOOHSNHQ-UHFFFAOYSA-N 386.499 5.030 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](O)c1cc2ccccc2s1 191447488 UCOGRDXCAHDFRY-IBGZPJMESA-N 394.540 5.608 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1sc2cc(Cl)ccc2c1Cl 193443628 GELOUPSOEZEBEQ-ZDUSSCGKSA-N 389.263 5.169 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1cccc(Cl)c1 303166889 IPVYCTOGVWAFLC-UHFFFAOYSA-N 390.870 5.280 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1CC1CCCCC1 303370428 JWCPZGYFUNFPLW-PKOBYXMFSA-N 385.577 5.905 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCC(=O)C(C)(C)C)n2)o1 303674542 XSCQXTNHQORXKK-UHFFFAOYSA-N 382.407 5.248 30 20 GKED COc1c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc(Cl)cc1C(=O)N(C)C 329151215 SGMZHYYZFWYBEM-NUEKZKHPSA-N 392.927 5.245 30 20 GKED COc1cccc(C2(/N=C(/O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)c1 329282196 KTNTXCPUKIWXPV-SFHVURJKSA-N 393.531 5.148 30 20 GKED C[C@H]1C[C@@H](C(O)=Nc2sc3c(c2C(=O)c2ccccc2)CCC3)CCC1=O 329403847 WVDFGCREOXOJEG-ZFWWWQNUSA-N 381.497 5.061 30 20 GKED CC(C)c1ccccc1N=C(O)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 329427316 HHUHKVVIDFAQHT-GOSISDBHSA-N 395.551 5.401 30 20 GKED CN(C(=O)c1cscc1C#N)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 410671393 IKXCEZHYOALUQT-NVXWUHKLSA-N 378.419 5.047 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 431806536 BRYKIVGMOVMMEI-KXBFYZLASA-N 387.430 5.083 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 438494688 UCMJINVKYFYOTL-FXAWDEMLSA-N 397.906 5.431 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](c1ccccc1)c1cccc(F)c1)c1ccccc1 438850841 NIUFRWZBYBSUIN-DHIUTWEWSA-N 387.458 5.259 30 20 GKED C[C@H]1CCN(C(=O)NCC2CCC(C#N)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 440999726 CNWDPWMYYKAUKW-QAVIERHMSA-N 393.453 5.128 30 20 GKED CCc1nc2ccccc2c(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C 443884611 NSXOTBPZMGRPJZ-UHFFFAOYSA-N 383.373 5.248 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443911457 YDQBLOGQXLUYSE-HNNXBMFYSA-N 381.426 5.056 30 20 GKED CC[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1cc(F)ccc1F 444240300 CYGIOXHNUUAIAG-HXUWFJFHSA-N 381.426 5.104 30 20 GKED COc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1OC(C)C 455141159 OQYBBJMCYPFWSL-IBGZPJMESA-N 381.476 5.039 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 455272546 LBIMGFRRSIGKOT-PZSREKOKSA-N 399.844 5.191 30 20 GKED CC[C@@H](CC(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 457469952 YCJDVJGEGKJACR-SUMWQHHRSA-N 376.834 5.615 30 20 GKED CN(C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)c1ccc(C#N)cc1 461542519 UYOBALXMLJEBLN-UHFFFAOYSA-N 397.453 5.441 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1c[nH]c2c(C)cccc12 466009455 NWGWHESECDUHJS-UHFFFAOYSA-N 387.936 5.132 30 20 GKED C[C@@H](NC(=O)Nc1cc(C#N)cn1C(C)(C)C)c1ccc(-c2ccncc2)cc1 467770072 JTTBKFALMOXTJE-MRXNPFEDSA-N 387.487 5.059 30 20 GKED CC(C)n1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cn1 468652343 HVXCRMYIRBLFAN-UHFFFAOYSA-N 380.835 5.034 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H](Cc3ccccc3)C2)c2ccccc21 469368789 DIWGMGAXMHADIA-OAQYLSRUSA-N 385.511 5.040 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1nc(-c2ccc(F)cc2)cs1 470640989 GFQGQWFPNFMUJB-UHFFFAOYSA-N 380.488 5.097 30 20 GKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 473645305 SBNVTQAMWIXXNW-IBGZPJMESA-N 395.286 5.348 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1F 474270758 VVKCZIMKZKWDAN-CQSZACIVSA-N 397.265 5.407 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)s1 476366799 CTHAVAGODLYMDC-UHFFFAOYSA-N 387.508 5.103 30 20 GKED C[C@H](Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)c1ccc(C#N)cc1 477542869 LDKCXZJLYNQYEX-SFHVURJKSA-N 379.467 5.038 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(-n2cncn2)cc1Cl)c1ccc(F)c(F)c1 480696335 VBXMVINAAHMTHJ-XCLFUZPHSA-N 388.849 5.167 30 20 GKED C=C(C)[C@@H](NCc1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)c(F)c1 481608022 VHCZWEYSOIKRGF-GOSISDBHSA-N 375.806 5.075 30 20 GKED C=C(C)COc1cc(/C=C(\CC(=O)O)c2nc3ccccc3s2)ccc1OC 489061292 ACTPRFDGUQMKLZ-MHWRWJLKSA-N 395.480 5.275 30 20 GKED Cc1ccccc1NCCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 490630011 MSCWBKWSZODYFR-UHFFFAOYSA-N 399.494 5.081 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](c1c[nH]c2ccccc12)C(F)(F)F 490757202 HOFDCIDZJAKBHN-IBGZPJMESA-N 387.405 5.169 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2ccccc2OC)cc1 490808674 CUNFVMKPRLRWAR-UHFFFAOYSA-N 392.455 5.343 30 20 GKED C=CCOc1ccc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1 498421731 KAECMSGIXKULMU-FQEVSTJZSA-N 381.522 5.162 30 20 GKED C[C@H](N[C@@H](C)c1cnn(C2CCCC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 502412771 GZRQDIGLORCAQK-OALUTQOASA-N 384.527 5.949 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)C1 503956115 ROQVEBQGAQKPNL-HYBUGGRVSA-N 394.559 5.330 30 20 GKED C[C@H](C#N)CN(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 507510114 VPUBMONWVXHCFG-LLVKDONJSA-N 396.343 5.013 30 20 GKED CCCCc1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508065924 YTZWBDJRCRWSJW-OAQYLSRUSA-N 395.572 5.515 30 20 GKED CCN(C(=O)c1cnc(-c2ccccc2F)s1)[C@@H](C)c1ccc(C#N)cc1 516757886 QOWVXSFIAOUHFH-AWEZNQCLSA-N 379.460 5.044 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cncnc3-c3ccccc3)n2)cc1 517788989 QUBPDISMWWBESU-SFHVURJKSA-N 396.475 5.066 30 20 GKED C[C@H](Cc1ccccc1F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518903611 KUGPMYNUYHRAQV-QGZVFWFLSA-N 388.442 5.045 30 20 GKED CCCn1c(CNCc2ccc(-c3ccccc3C#N)cc2)nc2ccccc21 538003209 XLLONJXDQYHGFC-UHFFFAOYSA-N 380.495 5.275 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NCCCC1(C#N)CCOCC1 539710024 DKNBGSZXFLLIDC-UHFFFAOYSA-N 398.478 5.448 30 20 GKED C=CCC[C@@H](NCc1csc(-c2ccc(OC)cc2OC)n1)c1ccccc1 540392942 CXYNPFBZOPIBOH-OAQYLSRUSA-N 394.540 5.624 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(F)c(F)c3)no2)cc1C(F)(F)F 541077004 JHBJHFOFFHITEH-UHFFFAOYSA-N 397.328 5.198 30 20 GKED C=C(C)[C@H](CC(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)OCC 541253757 XRPLSVQGBAZHOQ-HOCLYGCPSA-N 397.359 5.139 30 20 GKED N#Cc1ccc(CSCc2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)cc1 544686352 PNGVXHOSRQJQNZ-UHFFFAOYSA-N 394.887 5.100 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](c1cncc(Br)c1)C1CC1 551811529 DXKXZHONELRUDS-LEWJYISDSA-N 396.332 5.224 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 554789991 JQSQYHYQOFKJIT-NRFANRHFSA-N 397.503 5.267 30 20 GKED CC[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 563486965 MBFIGOMIWFAQAY-GFCCVEGCSA-N 393.356 5.293 30 20 GKED CC(C)OCCOCc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 581160916 XAQYFZJQJYDQAP-UHFFFAOYSA-N 392.421 5.131 30 20 GKED CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)CCCCCC#N)c1 588837424 GAVCRIIQSIGVFA-IBGZPJMESA-N 391.515 5.209 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1cc(C(F)(F)F)ccc1Cl 599422298 LORKEXCBLWNGAT-GOSISDBHSA-N 380.797 5.004 30 20 GKED CC[C@@H](Nc1ccc(Cl)cc1SCCC(=O)OC)c1ccc(C#N)cc1 600853898 JMAQSDQTIQMWEO-QGZVFWFLSA-N 388.920 5.430 30 20 GKED Cc1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 603758863 LONDVULRALXIEE-KRWDZBQOSA-N 381.888 5.321 30 20 GKED CC(C)(C)[C@@H](NC(=O)NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608918792 TUCNFZBJDARZIV-SFHVURJKSA-N 389.421 5.164 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1ccc2c(c1)CCC2 609061774 HVCQISOAEFYCHY-UHFFFAOYSA-N 396.490 5.116 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cnc(-c4ccco4)s3)c2)cc1 609176447 KZDLRKAIKYYVLA-UHFFFAOYSA-N 387.420 5.319 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)oc2c(F)cccc12 609416363 JRGUOANTGKLVFF-CQSZACIVSA-N 377.202 5.182 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccc(Br)cc1)c1ccc(C#N)cc1 609825478 AAUYJELKIPVWHV-QWHCGFSZSA-N 389.318 5.142 30 20 GKED N#Cc1ccc(SCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)c(F)c1 610165781 QFWWOWNCNZPLEH-UHFFFAOYSA-N 389.666 5.388 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc2cc(Cl)ccc2s1 613407041 DSLLTZLBAFKOMI-KRWDZBQOSA-N 396.899 5.761 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)c1ccc(CCC(F)(F)F)cc1 622308659 NYEXCGCMXKBAKQ-UHFFFAOYSA-N 393.302 5.269 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 665395559 MSHJGJZAMBWPIE-APWZRJJASA-N 381.476 5.097 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2c(cnn2C(F)F)c1 681412723 RMIXUWJFZVCJDP-UHFFFAOYSA-N 396.850 5.366 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Oc1c(Cl)cc(C#N)cc1OC 729945944 WATTYGCCTHGJDH-KRWDZBQOSA-N 387.863 5.107 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc1Cl 730417364 MZGODMPFQYXMQV-SMDDNHRTSA-N 388.851 5.041 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 731319066 OEYUORSOTBNTIL-UHFFFAOYSA-N 377.444 5.607 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=S)Nc1ccc(C#N)c(Cl)c1 731955294 QGYIHQUUBBRIOE-NSHDSACASA-N 397.853 5.148 30 20 GKED CC(=O)Nc1ccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 733620923 FNBYWXOZOLFQOJ-QFIPXVFZSA-N 398.466 5.253 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)cs1)C1CC1 734303408 NVEDTOWAJOSKER-KAMYIIQDSA-N 394.540 5.602 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)n1 735765951 XHRONNMOMCLBQE-STHPQGGCSA-N 384.932 5.330 30 20 GKED Cc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc(C)c1OC(F)F 741844356 OKGIPAKMUFFRAC-ARJAWSKDSA-N 382.819 5.164 30 20 GKED COc1ccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)cc1C#N 742370190 VNSIMDKDDCLIEJ-AREMUKBSSA-N 378.475 5.599 30 20 GKED C=CCn1c(-c2ccncc2)nn(CN(CCCC)C2CCCCC2)c1=S 746044075 GXPLROZYUPCYHF-UHFFFAOYSA-N 385.581 5.054 30 20 GKED CCN(C[C@H](C)C#N)Cn1nc(Nc2c(C)cc(C)cc2Cl)sc1=S 747327038 PTIMEQAKADHGRM-GFCCVEGCSA-N 395.985 5.127 30 20 GKED COc1ccc(C=NN(c2ccccc2)c2ccccc2)cc1OCCCC#N 747357071 JMQNAXPVQCLUEW-UHFFFAOYSA-N 385.467 5.550 30 20 GKED N#Cc1ccc(O)c(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c1 748002704 LYVPSRINSJTIQK-UHFFFAOYSA-N 396.777 5.403 30 20 GKED CC[C@@H](Oc1cccc(C)c1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 750688495 DNYZDDCEGZDATQ-DOTOQJQBSA-N 384.888 5.292 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 752201429 IJDXBSQJSOOURH-GJZGRUSLSA-N 380.435 5.655 30 20 GKED Cn1c(C=NOc2ccccc2C(F)(F)F)nc2cc(C(F)(F)F)ccc21 754712449 OHKKAQOWYPROJM-UHFFFAOYSA-N 387.283 5.024 30 20 GKED N#CC1CCC(COC(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)CC1 755965888 LIWRJLOSBSAPLM-UHFFFAOYSA-N 394.418 5.316 30 20 GKED C=C[C@H](CC(=O)O[C@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 758906940 FSGWPUDAWNUENV-YLJYHZDGSA-N 379.500 5.042 30 20 GKED C=CCC(CC=C)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 759008145 RBMQAHYSWOAGCU-UHFFFAOYSA-N 398.528 5.256 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCCC[C@@H]1c1nc2ccccc2o1 761991302 ZUZKVKLHIKHKGD-GOSISDBHSA-N 381.863 5.111 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cc(Br)ncc1F 762427006 RZKWQDIBQVYOCV-UPHRSURJSA-N 395.278 5.064 30 20 GKED N#C[C@H](C(=O)Nc1ccc(-c2ccccc2)cc1)c1nc(-c2ccccc2)cs1 768127113 PATZKQBDJGJLJQ-OAQYLSRUSA-N 395.487 5.723 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1C#N 773081634 FFEOCWZTKGJMLZ-CQSZACIVSA-N 393.468 5.054 30 20 GKED CCOc1cc(CNc2cccc(OCC#N)c2)ccc1OCc1ccccc1 779589069 WQTBMHFBYDVLSV-UHFFFAOYSA-N 388.467 5.179 30 20 GKED CO[C@@H]1Cc2ccc(NC(=O)c3ccc(Oc4ccc(C#N)cc4C)cc3)cc2C1 784240534 XSRVIVQSOUOISB-HSZRJFAPSA-N 398.462 5.025 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1Br)c1nccc2ccccc12 792093660 YQZVHTLHGWJTTP-SFHVURJKSA-N 393.284 5.196 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(Br)c1)c1nccc2ccccc12 792097904 YXCPEJSTMPMMGT-IBGZPJMESA-N 393.284 5.196 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)Nc1cc(C#N)cn1C(C)(C)C 796594843 YIDVKSVAVYVGER-UHFFFAOYSA-N 396.491 5.023 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 801650331 BCDICYSHXKGUHQ-AWEZNQCLSA-N 399.874 5.158 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801673656 VMYAVWDTHHBOET-SJKOYZFVSA-N 396.409 5.749 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 801911870 VECQAKVWSQKVIM-GFCCVEGCSA-N 398.875 5.398 30 20 GKED C#CCC(C)(C)c1nc(-c2ccc(-c3csc(-c4ccncc4)n3)cc2)no1 809494718 ASUKBUAWEYAVSL-UHFFFAOYSA-N 386.480 5.223 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc3ccccc3n2)cc1 813409737 LNWIJCYGXFCQBS-DEOSSOPVSA-N 391.474 5.462 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@@H]1c1ccncc1 814576628 FTWPETWQDJMOOA-DHIUTWEWSA-N 396.494 5.352 30 20 GKED Cc1nn(Cc2ccccc2)c(Cl)c1CN[C@H](CCCC#N)c1ccccc1 814659416 MUXMKIPMOZVTLN-JOCHJYFZSA-N 392.934 5.418 30 20 GKED Cc1c(NC(=O)c2cc(C)n(-c3ccc(C#N)cc3)c2C)cccc1-c1ncco1 816797860 VRWVMBGOCXDXSA-UHFFFAOYSA-N 396.450 5.182 30 20 GKED COc1cc(NN=Cc2cn(C3CCCC3)nc2-c2ccccn2)ccc1Cl 841636840 OYSHMBDXSBWCOR-UHFFFAOYSA-N 395.894 5.168 30 20 GKED N#CCCCn1cc(-c2nc(Cc3ccc(Cl)cc3)no2)c2ccccc21 904547227 ODYXGAMWKOOYJB-UHFFFAOYSA-N 376.847 5.239 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2cccc(OC)c2OC(C)C)cc1Cl 916154329 BHMBEAUKDNVTHH-KTKRTIGZSA-N 390.863 5.049 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916707935 BZAPENXBYVACND-RPBOFIJWSA-N 395.506 6.020 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@@H]2c2ccccn2)s1 919898086 WBRMNWVDAOCETM-QGZVFWFLSA-N 387.553 5.205 30 20 GKED CCCCC(=NNc1cccc(C(=O)O)c1C)c1ccc(Cl)cc1Cl 1776086977 AXJJWEMOMYIMSI-UHFFFAOYSA-N 379.287 6.006 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1cc(Cl)cc(Cl)c1 1776180271 OWIBERXXBWJGIF-HNNXBMFYSA-N 390.719 5.522 30 20 GKED CC1(C)Sc2ccccc2C(=O)/C1=C\c1ccc(-c2ccc(C(=O)O)cc2)o1 1776572974 DALSPBFUGKZLQC-QGOAFFKASA-N 390.460 5.795 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)cc(C)c(Br)c1C 1776783380 WXTICRJJINXNLH-QGZVFWFLSA-N 398.385 5.668 30 20 GKED C=CCn1c(SCC(=O)C23CC4CC(CC(C4)C2)C3)nnc1-c1ccccc1 4285403 DGYOTDIVGJJXBT-UHFFFAOYSA-N 393.556 5.009 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cccc(C(F)(F)F)c1 14091435 GQJYOHWQUGTPLX-UHFFFAOYSA-N 389.446 5.366 30 20 GKED CCCCN/C(S)=C(/C(=O)c1ccc(C(C)(C)C)cc1)[n+]1ccc(CC)cc1 27327738 XZNHIIFIMNRSAA-UHFFFAOYSA-O 397.608 5.163 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C 44634851 OADPCNAPEWNTRE-UHFFFAOYSA-N 386.451 5.064 30 20 GKED Cc1nc(-c2ccccc2)ccc1/C(O)=N/c1nc(-c2ccccc2Cl)n[nH]1 97576546 LJDHJEGHOIODQE-UHFFFAOYSA-N 389.846 5.132 30 20 GKED Cc1cc(-c2noc([C@H](C)Nc3ccccc3SC[C@@H](C)C#N)n2)ccc1F 108408192 VOHNVJJGRWPRLN-ZFWWWQNUSA-N 396.491 5.609 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ncc(-c2ccc(Cl)cc2)o1 109002280 DVACXQCSDCTJJO-CQSZACIVSA-N 383.904 6.001 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2cccnc2)cc1 151279309 KBGSTXXREYRURN-MBSDFSHPSA-N 384.483 5.154 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(OC3CCC3)cc2Cl)c1 155874998 QJBYIWLYHZUMNQ-UHFFFAOYSA-N 384.863 5.206 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(C(F)(F)F)cc1 171301319 UPNGNMKWBOJAPX-CQSZACIVSA-N 387.405 5.012 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1sc(Cl)nc1C 177815423 NXLVMLFLZPXDSF-UHFFFAOYSA-N 397.887 5.116 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccccc2O[C@@H](C)C#N)CC[C@H]1c1ccccc1 184327242 IOORZJUFMPCRCD-NLWGTHIKSA-N 377.488 5.025 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)ccc1Cl 189874515 UGUNYYYMMIFCAW-UHFFFAOYSA-N 392.724 6.207 30 20 GKED N#CCCCCSc1nc2sc3c(c2c(=O)n1C1CCCC1)CCCC3 195536289 VHAOSCMSIMTIMZ-UHFFFAOYSA-N 387.574 5.238 30 20 GKED CC(C)(CCC#N)CNC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 236818495 CZUMXUWIKYBVLS-LJQANCHMSA-N 379.935 5.873 30 20 GKED C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 296857932 ZDIJRSIKNZFLPM-HZSPNIEDSA-N 385.455 5.133 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1sccc1C#N 303330372 UBRMNDQUSSWYHM-SNVBAGLBSA-N 387.917 5.196 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(C)cs1 303357416 PCZASDLFWGTJQY-IBGZPJMESA-N 392.484 5.388 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 303493711 WOSQAXLYKMMMGC-FQEVSTJZSA-N 395.528 5.490 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@]4(CC=CCC4)C3)c2)c1 303638634 GYSCOWLAWSPCNY-VWLOTQADSA-N 386.495 5.100 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C(/O)N3CCCC34CCC4)s2)cc1 328606376 KISFWTPCDZUWCI-HNNXBMFYSA-N 385.533 5.121 30 20 GKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)N3CCCC[C@@H]3[C@H]3CN=C(O)C3)c3cccc1c32 329246993 VYLUWZOXNATGOK-YAJHFMINSA-N 395.547 5.031 30 20 GKED O/C(=N/[C@@H]1CCOc2ccccc21)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 329458697 RFUDXZZVXSCJMY-JFIYKMOQSA-N 390.508 5.826 30 20 GKED CC(=O)c1cccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 419513586 ZIFMOCCJGGSXMM-HNNXBMFYSA-N 398.553 5.155 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 425642802 ZYFUQMNMIWMLHC-HMPGYPRDSA-N 390.449 5.227 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 431719004 MURJINJUZOBVTD-NRFANRHFSA-N 387.487 5.046 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3cc(C#N)oc3C)s2)cc1 435459181 SHXHMENULNNHDM-AWEZNQCLSA-N 379.485 5.033 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H](C)C1 437829244 QVKURIRYLQCWTC-YLJYHZDGSA-N 377.488 5.003 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1c(F)cc(Br)cc1F 438632297 LAPJAAFNQRYLKU-UHFFFAOYSA-N 387.268 5.328 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC2CCC(C#N)CC2)C1 441006567 UYSYLZHARGGGMV-QAVIERHMSA-N 393.453 5.128 30 20 GKED C=CCN(Cc1ncc(-c2ccc(Br)cc2)o1)Cc1cccs1 441244554 KGULZMUVZGWQCG-UHFFFAOYSA-N 389.318 5.354 30 20 GKED CCC(CC)CN(CCC#N)Cc1nc(O)c2cc(-c3ccccc3)sc2n1 444222663 HCSKEXDPOGJITN-UHFFFAOYSA-N 394.544 5.216 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1OC(F)F 468885029 GAMBDINNZVRRRE-OAHLLOKOSA-N 399.441 5.044 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Br)cc1Cl 475116415 FLBOZTDBGRJHSN-AWEZNQCLSA-N 391.696 5.153 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)s1 478629878 HQJFYLWZLQZAMU-OAHLLOKOSA-N 381.526 5.497 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc2ccc(Cl)cc2n1C)c1ccc(F)c(F)c1 480692013 FDACYZIDYAAQJQ-BLVKFPJESA-N 375.850 5.473 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@H]1CCC(F)(F)C1 481069772 KTLNJNZVOPRLQT-JQWIXIFHSA-N 389.286 5.251 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)sc2C)cc1 483218677 HVUZRYVQPPUVEJ-NRFANRHFSA-N 398.487 5.770 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N(CC)CC)c(Cl)c1)c1ccccc1 488613625 NYAUXAPPFJSINF-GOSISDBHSA-N 384.907 5.120 30 20 GKED CCNc1ccc(Cl)cc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 490738141 ZDFZYZSAYQAPRY-UHFFFAOYSA-N 395.846 5.068 30 20 GKED Cc1cc(C(=O)Nc2cccc(Nc3ccccc3)c2)nn1-c1cccc(C#N)c1 509157425 VPLPVOKMSUHNHW-UHFFFAOYSA-N 393.450 5.048 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3cc(C#N)ccc3Cl)s2)cc1 510178551 ZNIGBDUWBKQGHO-ZDUSSCGKSA-N 395.915 5.443 30 20 GKED N#Cc1c(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)sc2c1CCC2 510217814 OGBYYKJXJWGJID-UHFFFAOYSA-N 395.871 5.201 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC(=Cc2cc(Cl)ccc2Cl)CC1 513130885 ZNPIUYBWCSOBFV-UHFFFAOYSA-N 394.346 5.512 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccccc3Br)cc2)ccn1 516939682 IZTDTHPSWQRHCK-UHFFFAOYSA-N 380.245 5.120 30 20 GKED CC(C)CCc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518378346 RAACVWFQXWWRIA-UHFFFAOYSA-N 385.467 5.586 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](Cc2ccccc2)C1 518684890 QGJMHRFLJFFADY-AZUAARDMSA-N 393.556 5.425 30 20 GKED C[C@H](CN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 519199271 VQJZMFFKWMSREA-GOSISDBHSA-N 385.467 5.618 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 521992382 CESURQIPCYVIHI-MLGOLLRUSA-N 379.312 5.103 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)Cc3cc(Cl)ccc3Cl)n2)cc1 522712020 XYBJFRTVWIRYIU-UHFFFAOYSA-N 388.279 5.170 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)Nc1cccc(C#N)n1 523514383 DPXZACDRHOCLOV-LLVKDONJSA-N 399.317 5.321 30 20 GKED C=CC[C@@H](C)NC(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 523968245 HHAUXXSNMIPARH-CYBMUJFWSA-N 382.533 5.052 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(C(F)F)c1Cl 542724728 QLSUETMTBHMEGU-UHFFFAOYSA-N 380.822 5.506 30 20 GKED C[C@H](NC(=O)N(Cc1ccccn1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543015919 AKOSJMRJSCHERH-SFHVURJKSA-N 396.494 5.055 30 20 GKED CC(=O)Nc1ccc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 543034855 VVCZAEUYBPBKFF-ROUUACIJSA-N 383.495 5.595 30 20 GKED COc1ccc(CSc2nnc(SCc3ccc(CC#N)cc3)s2)cc1 543144620 ZRELURYZVUZJHT-UHFFFAOYSA-N 399.566 5.197 30 20 GKED N#CCC1CCN(C(=O)c2ccc(-c3cccc(OC(F)(F)F)c3)s2)CC1 543836834 VRAOCVVWDUMXRD-UHFFFAOYSA-N 394.418 5.080 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccccc2)n1 551140591 UUCJDOCIMMAVOP-QRVBRYPASA-N 379.504 5.069 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)c2cnc(C(F)(F)F)c(C#N)c2)c1 556248645 JWBIOBGEGKUTFE-GOSISDBHSA-N 387.405 5.038 30 20 GKED CC(C)c1nc([C@@H]2CCCCCN2Cc2ccc(C#N)cc2C(F)(F)F)no1 558575354 SOLPPBJRSUDDQP-KRWDZBQOSA-N 392.425 5.201 30 20 GKED Cc1cnc([C@@H](C)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)o1 560769109 VSZQNBLUIZCRNH-CYBMUJFWSA-N 387.361 5.839 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)sc2c1-c1ccccc1CC2 564313942 OFFJVMOQXFONNI-CHWSQXEVSA-N 390.430 5.302 30 20 GKED Cc1ccccc1-n1nc(C(C)(C)C)cc1NC(=O)N1CCC(CCC#N)CC1 570960281 ODKFJSYKLWYALL-UHFFFAOYSA-N 393.535 5.026 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 576892017 AKLBWDFHDKKFJI-DNVCBOLYSA-N 397.316 6.281 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2cc(C#N)c3ccccc3n2)s1 577982925 KJKFLDRZNOXSRC-UHFFFAOYSA-N 384.464 5.099 30 20 GKED CC(C)(C#N)Cc1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 580497306 WNNFMHNNWDOLQU-UHFFFAOYSA-N 388.349 5.035 30 20 GKED N#CCCCCCC(=O)N[C@H](CC1CC1)c1cc(F)cc(Br)c1 588164843 SGRNGYQYKBUMNT-QGZVFWFLSA-N 381.289 5.020 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CC=CC2)[C@@H]1c1ccccc1)c1ccccc1 592024897 GLEXHRPVGIZMPJ-PKTZIBPZSA-N 385.511 5.524 30 20 GKED CCOc1ccc(Oc2cc(CNCc3ccc(C4(C#N)CC4)cc3)ccn2)cc1 594926552 SZBWLTBDGUXYPH-UHFFFAOYSA-N 399.494 5.118 30 20 GKED C[C@@H](c1ccc(CNC2(c3cccc(C#N)c3)CCOCC2)cc1)C(F)(F)F 595769326 PETNMAFHTDJJSX-INIZCTEOSA-N 388.433 5.020 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)C1 596650531 KVQQXWJVTCZTLS-KRWDZBQOSA-N 390.512 5.045 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccncc1 596733816 KQIIYFGLFKCPBV-OXQOHEQNSA-N 392.528 5.092 30 20 GKED N#CC[C@@H]1CCCN(C(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 597918492 PRBTVSVPMULIFQ-HTAPYJJXSA-N 398.959 5.315 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C2CCOCC2)cc1 601134229 CEONDGNQWHXEAT-MRXNPFEDSA-N 380.513 5.227 30 20 GKED COc1ccc([C@@H]2CCCN2c2c(C#N)cnc3c(F)ccc(Cl)c23)cc1 603838123 YLABISSHOHCYQH-SFHVURJKSA-N 381.838 5.249 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 608860924 PNQRAAXPKDOPFZ-UHFFFAOYSA-N 389.886 5.220 30 20 GKED CCc1ccc([C@H](C)C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 609020081 IUSABIWJISSVEB-KRWDZBQOSA-N 397.478 5.115 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609177496 ZAJSJJBDAFBBME-UHFFFAOYSA-N 377.469 5.491 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)c1ccc(F)cc1 609385223 DJRANVGVHUTICA-IAGOWNOFSA-N 399.535 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc(OC(F)(F)F)cc1 609387259 VLBZDLQXCUXBGT-KBPBESRZSA-N 380.435 6.010 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609500515 PXFATKUEYFNMGV-FQEVSTJZSA-N 389.480 5.255 30 20 GKED N#Cc1cc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ccc1C(F)(F)F 613272382 QATUCMBUYRVSLA-UWVGGRQHSA-N 390.249 5.144 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc(-c2ccccc2)cs1 613392506 QQATXIRVGJQSSY-QGZVFWFLSA-N 388.423 5.699 30 20 GKED FC(F)(F)C1CCC(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 681080647 FYJBFZBWWGZPKT-KIDURHIOSA-N 385.314 5.418 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1N1CCCC1 682777258 JEQSQSIRAXCEGR-UHFFFAOYSA-N 377.532 5.460 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)c2ccc(CC)cc2)cc1 727953928 RECKCTHAEPGVKW-VGOFRKELSA-N 376.500 5.043 30 20 GKED Cc1cccc(Oc2ccccc2CNC(=O)Nc2cccc(OCC#N)c2)c1 730129580 WAOBBLRRWCPLKL-UHFFFAOYSA-N 387.439 5.011 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c[nH]c4ccc(F)cc34)n2)cc1 734706643 POIPBIXKKLEQIV-SFHVURJKSA-N 389.455 5.158 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1cccc(Cl)c1Cl 734980097 HLFUIZKFNLZDQM-RMKNXTFCSA-N 384.262 5.864 30 20 GKED CCCCCCCCC/C=C\C(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 737805603 GKUWIWWGUHZXIX-QXMHVHEDSA-N 390.612 5.180 30 20 GKED COc1ccc(-c2cc(NCc3ccc(C#N)cc3)ccc2OC(F)F)cc1 741181936 OGQGZXHNSINGRY-UHFFFAOYSA-N 380.394 5.447 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 743446919 GHXIONWKQHVSQR-HGZMWJMZSA-N 396.874 5.882 30 20 GKED C=CCn1c(C2CC2)nn(CN(CCC)Cc2c(F)cccc2Cl)c1=S 746037629 HGGVVNAXCLTJJY-UHFFFAOYSA-N 394.947 5.140 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](Sc2ccccc2)c2ccccc2)n1 747197294 DFGXTAVWTIFNHL-GHTZIAJQSA-N 392.549 5.976 30 20 GKED N#Cc1ccc(C(=O)O[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)s1 750216382 KDDTTYIHAAQWLL-LBPRGKRZSA-N 379.281 5.099 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2csc(Cl)c2Cl)S1 761392541 NJSYQLLFOCABKG-WDZFZDKYSA-N 383.325 5.563 30 20 GKED CCc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 763005538 VBDAAEXCTRIZAE-OAHLLOKOSA-N 382.435 5.070 30 20 GKED C[C@H](NC(=O)c1ccccc1SCC#N)[C@H](C)c1ccccc1C(F)(F)F 766531494 QKOVUZWSFMRVIH-KBPBESRZSA-N 392.446 5.243 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4occc4C)c23)cc1 767764275 GZFOZODDYLCLHS-UHFFFAOYSA-N 378.457 5.104 30 20 GKED CN(CCC#N)c1ccc(CNc2cccc(CC[C@H](O)c3ccccc3)c2)cc1 770558704 IUTRCXHWSHTZEP-SANMLTNESA-N 399.538 5.315 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCCc3ccc(Cl)cc32)ccc1OC 772984985 HMKPMJVKROEIRD-QUCCMNQESA-N 384.907 5.197 30 20 GKED CCN(C(=O)Cc1ccccc1CC#N)[C@@H](c1ccccc1)c1ccc(F)cc1 776903362 XJAKVEQDIQQFDG-VWLOTQADSA-N 386.470 5.072 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc(Br)ccc1F)c1ccc(F)c(F)c1 788754555 PXSLBSUUOAZDFC-QFYYESIMSA-N 385.227 5.229 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792095719 XLQOEIQLKRIQHI-QFIPXVFZSA-N 386.495 5.424 30 20 GKED COCCC(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 810533070 ULKUXRGDJIGWGB-CYBMUJFWSA-N 397.327 5.356 30 20 GKED Cc1cccc(COc2ccc(C(=O)/C=C\c3cn(C)nc3C(F)F)cc2)c1 812241902 OIBANJRWXSDLNT-FLIBITNWSA-N 382.410 5.141 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1cc(C(F)(F)F)ccn1 813211644 NTTDOGNJXRXWJA-ILXRZTDVSA-N 399.199 5.387 30 20 GKED Cc1csc(SCc2c(C(=O)N[C@H](C#N)C(C)(C)C)oc3ccccc23)n1 813283949 KDCVDSFYSXWXTK-MRXNPFEDSA-N 399.541 5.158 30 20 GKED CC(=NNc1cc(C#N)cc(Cl)n1)c1sc(-c2ccccc2F)nc1C 814890979 JLPXOAUHSQWFJU-UHFFFAOYSA-N 385.855 5.014 30 20 GKED C[C@@]1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1(Cl)Cl 836269585 DCXNGPQFGIBIDS-HKUYNNGSSA-N 388.298 5.047 30 20 GKED CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](N[C@@H](CCCC#N)c3ccccc3)CC[C@H]2C1 842874615 DUMZWZXOIUGMBQ-LRSLUSHPSA-N 397.563 5.047 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(-c3cccs3)cc2)ccc1OC 850136218 WHRHPWHMXUAWSR-HXUWFJFHSA-N 392.524 5.394 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CNCc2ccc(C(C)(C)C#N)cc2)c1 850343050 OXKNDLIHILGODB-UHFFFAOYSA-N 379.504 5.125 30 20 GKED C#CC[C@H](NC(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 861396387 XHVIIHRTSCXOKV-FQEVSTJZSA-N 393.487 5.228 30 20 GKED Cc1cc(C)n(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)n1 914756276 XPZZNAGKSICSEM-UHFFFAOYSA-N 392.462 5.280 30 20 GKED COc1cccc(C=NNc2nc(Cl)c(Cl)cc2Cl)c1OC(F)F 916317600 DJURHXCKOMOEKV-UHFFFAOYSA-N 396.608 5.098 30 20 GKED C=CCN(C(=O)[C@H](C)Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 920998710 IFHCHKGOKSFIKV-MRXNPFEDSA-N 380.488 5.347 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3cccc(C(F)(F)F)c3)s2)c1 1776015009 ZAPFRJJZWDLYOQ-UHFFFAOYSA-N 390.386 5.578 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2cccc3cc(Cl)ccc23)c1)C(=O)O 1776471325 OHDKMBACXDXSSX-ZHZWZMEUSA-N 380.827 5.241 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccc(C(F)(F)F)cc1 1776785295 RMRVQMPWIDJNIT-IBGZPJMESA-N 387.486 6.294 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)o1 1777424543 ITRICXZNTLXIMA-XMELGKRDSA-N 394.398 5.142 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777455808 BSKMAUDBFDUWMD-DMGPTTAYSA-N 382.459 5.673 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ccc(/C=C\C(=O)O)cc1 1777487695 FQVNPLYEYDYUSN-FVPAAFGUSA-N 393.439 5.252 30 20 GKED CC(C)OCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 41533304 IMXSHMUJYSRJRU-IBGZPJMESA-N 376.481 5.225 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nnc1-c1ccoc1C 46415380 YSDYYKBDIIFHPF-UHFFFAOYSA-N 396.903 5.526 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 47376015 TXIRCXOLXMLIOS-KRWDZBQOSA-N 387.439 5.296 30 20 GKED CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 55902556 KNGRYHBDJUAJLX-UHFFFAOYSA-N 389.842 5.089 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1COc1ccccc1 62405559 RRZMUIQUJRPPMF-UHFFFAOYSA-N 386.495 5.528 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)oc2c1C(=O)CCC2 68824032 CUQQIPNYFDFBNT-UHFFFAOYSA-N 386.407 5.023 30 20 GKED COc1ccc(F)cc1[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 109028908 PSLQZYGDEYNVOE-KBPBESRZSA-N 387.480 5.111 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 109362577 GMRZSUVNRZKKRY-UHFFFAOYSA-N 380.263 5.071 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2ccccc2CCC(F)(F)F)cc1 119919009 DCDVCBKGTBBXRH-UHFFFAOYSA-N 375.394 5.627 30 20 GKED C[C@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccc(C#N)c1 184605159 RAZWJPOREFKIPL-LIRRHRJNSA-N 377.488 5.549 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2C)cc1 189875866 BCBRONCPGVDKBV-IIBYNOLFSA-N 376.500 5.385 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1c(CSC)nc2ccccc21 189881370 RGPIVVWYJUMTBI-UHFFFAOYSA-N 393.556 5.390 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2F)C2CCCC2)cc1OCCCC#N 237351968 CMHNZRQGUSVPPN-XMMPIXPASA-N 396.506 5.538 30 20 GKED CN(Cc1cccc(F)c1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 301218069 KPOZUQCPHXACSV-UHFFFAOYSA-N 379.275 5.136 30 20 GKED CC[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1nc(C(F)(F)F)cs1 301432515 PIRDFSVBOOFNIZ-MRVPVSSYSA-N 380.317 5.011 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329522334 RCPQAAOHMAXLDJ-DJJJIMSYSA-N 389.446 5.078 30 20 GKED O=C(Nc1ccc(C2CCC2)cc1)N1CCC(/N=C(/O)CC2CCCC2)CC1 330238660 ZYIMWIMNBWNCQH-UHFFFAOYSA-N 383.536 5.487 30 20 GKED N#CC1(CCCSCc2cccc(Br)c2Cl)CCOCC1 419611882 LQYBZSUQZHGQEZ-UHFFFAOYSA-N 388.758 5.436 30 20 GKED Cc1sc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Br 424667344 UUJOSCHTHSRMLI-SNVBAGLBSA-N 395.347 5.466 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 425664500 RZJJWXRHPPZFJK-ZDUSSCGKSA-N 387.430 5.239 30 20 GKED N#CCCC[C@@H](NCc1csc(Cc2ccc(Cl)cc2)n1)c1ccccc1 433034277 XVZVEWIJJDCEKZ-OAQYLSRUSA-N 395.959 5.912 30 20 GKED C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1Cc1nnc(-c2cccc(C#N)c2)o1 434899695 AJKXRBXSYSXHEQ-GFCCVEGCSA-N 399.281 5.034 30 20 GKED COc1c(Cl)cc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1Cl 439373049 SXIQZQMIDPSBOA-MRXNPFEDSA-N 378.259 5.169 30 20 GKED N#CCC[C@@H](NC(=O)CCc1cccc(OC2CCCC2)c1)c1ccccc1 439656646 UBGQFBPGXQXPSN-HSZRJFAPSA-N 376.500 5.102 30 20 GKED N#CCCC[C@H](NCc1cnc(CCc2ccccc2)s1)c1ccccc1 449342182 ZPXXGOIHNHREAD-QFIPXVFZSA-N 375.541 5.453 30 20 GKED Fc1ccc(CN2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)cc1C(F)(F)F 459645434 GPUIMVFJYFLEGL-HNNXBMFYSA-N 399.350 5.026 30 20 GKED C[C@H](C(=O)Nc1ccccc1CN(C)C1CCCCC1)c1cccc(C#N)c1 463254560 FTLBDTQBBJTAPE-SFHVURJKSA-N 375.516 5.065 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1csc(-c2ccccc2F)n1 464822003 JWLVHJLWCIUFJE-TZIWHRDSSA-N 377.488 5.221 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1 465669839 QMZQGDJCATYUSH-MSOLQXFVSA-N 399.494 5.355 30 20 GKED CCCc1c(NC(=O)c2ccc(C)c(Cl)c2F)cnn1-c1cccc(C#N)c1 468955226 LWJHYNPGIIJDMO-UHFFFAOYSA-N 396.853 5.050 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)n(C)c2ccccc12 471279444 ZTSCHRDCYBTMTN-OAHLLOKOSA-N 392.528 5.203 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1 479606314 ZANRIJUHGAUPRL-OAQYLSRUSA-N 387.508 5.328 30 20 GKED COc1ccc2cc([C@@H](C)C(=O)Nc3sc4c(c3C#N)CCC4)ccc2c1 482214413 PWBXFXLSIKZOIH-CYBMUJFWSA-N 376.481 5.012 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Br)cc1Cl)c1ccccc1 483078432 PFAUEZCKRRYLHF-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED N#CCC[C@@H](NC(=O)NC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1 483236936 ABQDBWYWOVZNQY-OBXNSHGQSA-N 385.870 5.011 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C)c(OCC2CCOCC2)c1 485473805 IMOPJLWZWKDSNG-UHFFFAOYSA-N 397.540 5.331 30 20 GKED Cc1c(C2CCCCC2)noc1NC(=O)c1ccccc1-c1ccccc1C#N 485532627 VTNRKUNTVBUILR-UHFFFAOYSA-N 385.467 5.822 30 20 GKED Cc1csc(-c2ccc(NC(=O)[C@@H](Oc3ccccc3C#N)C(C)C)cc2)n1 506065314 XGQHGLQOWXNNJW-FQEVSTJZSA-N 391.496 5.032 30 20 GKED C=CCn1c(SCc2csc(C(C)(C)C)n2)nnc1-c1cccc(C)c1 508869733 YVZCKDMMHVNTEK-UHFFFAOYSA-N 384.574 5.486 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccccc1Oc1cccnc1 512542734 UGNUFIMMCQRFNJ-UHFFFAOYSA-N 376.504 5.230 30 20 GKED C=C(C)COc1cc(CNCc2ccc(OC3CCCCC3)nc2)ccc1OC 518772956 ULSCNHZQCSUTLR-UHFFFAOYSA-N 396.531 5.046 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 518867528 KYSRPBWOTJDOQK-ROUUACIJSA-N 385.467 5.137 30 20 GKED C=CCC[C@H](C(=O)Nc1cncc(Cl)c1Br)c1ccccc1 519717866 APPKISUJVORBEG-ZDUSSCGKSA-N 379.685 5.186 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2ccccc2)n1)c1ccc(Cl)c(Cl)c1 521352639 CZRBLRUQEWWKAV-HNNXBMFYSA-N 388.279 5.112 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 531383147 NAHINAUXZQSQKQ-UHFFFAOYSA-N 399.498 5.065 30 20 GKED CC(C)N(CCC#N)Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 535795914 OEEZBVKMBFEZJP-UHFFFAOYSA-N 390.314 5.370 30 20 GKED C[C@@H](NC(=O)CCC(=O)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 543918960 RWKIHPMRPRUVKQ-MRXNPFEDSA-N 388.492 5.127 30 20 GKED CC(=O)Nc1cccc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 543921918 ZNIVQBUIFIEVFB-MSOLQXFVSA-N 383.495 5.595 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)Nc1ccc(CC#N)cc1 544927665 LHPLJIUCHIGKNH-LBPRGKRZSA-N 395.812 5.254 30 20 GKED CC[C@@H](CC#N)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 552433929 IPLPRJZTVWVPRW-NSHDSACASA-N 396.343 5.203 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cccc(-c2ccccn2)c1C 553449372 MZDDNGMSIFZBAJ-UHFFFAOYSA-N 388.515 5.053 30 20 GKED C[C@@H](Oc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cn1)c1ccccc1 554519219 LVCGYEWJCRIYEU-XXBNENTESA-N 399.494 5.387 30 20 GKED CCc1nc2cc(CNCc3ccc(C#N)cc3C(F)(F)F)ccc2n1C1CC1 570369033 JLABGOGSEUKBGG-UHFFFAOYSA-N 398.432 5.114 30 20 GKED N#Cc1ccc(-c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1Cl 578678911 PTSFUGVKICJANE-CQSZACIVSA-N 381.716 5.339 30 20 GKED CC1(C)C[C@@H](NC(=O)c2c(Cl)cc(C#N)cc2Cl)c2cc(F)ccc2O1 593813177 CFFZQULDOGLOSO-OAHLLOKOSA-N 393.245 5.036 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)CCCCC#N 593982387 JOPYWNQOKBVSNF-UHFFFAOYSA-N 392.478 5.754 30 20 GKED N#CC1(CC(=O)Nc2cc(Cl)ccc2Sc2ccccc2)CCOCC1 598799378 DEIUWOVCLHWPMS-UHFFFAOYSA-N 386.904 5.140 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(C4CC4)[nH]c3C3CC3)cn2)c1 599055974 FUSRSGSCMFYGGF-UHFFFAOYSA-N 384.439 5.081 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccn1)C1CCC1 599736155 BKASSJYHNUVNRK-FOIQADDNSA-N 380.517 5.139 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccsc3)cn2)cc1 603689987 WCICOQKMGMKMOV-LJQANCHMSA-N 390.468 5.176 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2NCc2ccccc2C#N)cc1 604007291 DZKJVLMNIPVJTH-UHFFFAOYSA-N 383.495 5.720 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3occc3-c3ccccc3)cn2)cc1 604241584 AOOXCVSEQKIKRG-UHFFFAOYSA-N 381.391 5.258 30 20 GKED N#CCCCOc1cccc(CNCC2(c3cccc(C(F)(F)F)c3)CC2)c1 608983116 IODLFVMJHDRELE-UHFFFAOYSA-N 388.433 5.209 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C2CC2)o1 609434051 ZSFKQQWDUQOPOU-UHFFFAOYSA-N 387.439 5.449 30 20 GKED Cc1sc2nc(S[C@@H](C#N)C3CCCCC3)n(C(C)C)c(=O)c2c1C 609648565 IVYGCFIBVPITOW-HNNXBMFYSA-N 375.563 5.220 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1F 611586387 QHLVHXLHEJZRAB-FTYKPCCVSA-N 382.323 5.257 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1CC[C@@H](C(F)(F)F)C1 619125467 BAQZGABNYJPYDE-RKDXNWHRSA-N 387.286 5.135 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OC(C)C)cc3)n2)cc1 619756425 AVTARRBAQGUTAJ-IBGZPJMESA-N 392.480 5.096 30 20 GKED Cc1ncc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)s1 647323493 QWVWTGAONZOKDI-MRVPVSSYSA-N 386.336 5.914 30 20 GKED Fc1ccc(/C=C\CNC2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 671706738 OVKJSHMDNQRMJI-BLVLIDIHSA-N 387.314 5.477 30 20 GKED FC(F)(F)c1cc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccn1 672161956 IFEDUYWWIDWVNN-MBTKJCJQSA-N 380.254 5.422 30 20 GKED Cc1ccc(Cl)c(NC(=S)N(Cc2ccc(C#N)cc2)C(C)C)c1Cl 728445330 OVQXEKQJFFHWLI-UHFFFAOYSA-N 392.355 5.781 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](OC1CCCC1)c1ccccc1 730988726 BSNCDXFSGCMOFZ-VGSWGCGISA-N 394.540 5.577 30 20 GKED COc1ccccc1-c1cccc(NC(=O)c2c(C)oc(-n3cccc3)c2C#N)c1 732121401 AAKCKBVJKYSQFC-UHFFFAOYSA-N 397.434 5.178 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)cc1 734771723 GBNBNYQDQWAUOA-XUVXKRRUSA-N 388.417 5.362 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](Cc1ccccc1)c1ccccc1 735306090 IANPJWGNPLGPMK-JOCHJYFZSA-N 376.887 5.316 30 20 GKED CC(C)c1ccc(Nc2nn(CN(CCC#N)C(C)C)c(=S)s2)cc1 739841917 RORRMNDAJXBMFC-UHFFFAOYSA-N 375.567 5.123 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1ccc(SCC(F)F)cc1 741844834 VXVVYHCQZFDKEM-ZHACJKMWSA-N 384.451 5.185 30 20 GKED CCC(=NNc1c(Cl)cc(Br)cc1Cl)C1CCOCC1 745200981 KLSFJIBCPJMNBM-UHFFFAOYSA-N 380.113 5.360 30 20 GKED COc1cccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1OC(F)F 745989837 CFHLEZVKKZJVQC-MDZDMXLPSA-N 381.378 5.255 30 20 GKED N#CCOc1ccc(Cl)cc1COc1cccc(NC(=O)c2ccccc2)c1 746051854 SQSQKNOTMFPWJB-UHFFFAOYSA-N 392.842 5.074 30 20 GKED O=C(/C=C/c1ccc(-c2cccc(F)c2)s1)c1cccc(N2CCOC2=O)c1 750913155 KSIWCLPDWZOAJL-VQHVLOKHSA-N 393.439 5.407 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@H]2c2ccc(Cl)cc2)cc1C(F)(F)F 752257117 PMFUBQNLWVSKRD-INIZCTEOSA-N 379.769 5.209 30 20 GKED O=C(/C=C\c1cc(F)cc(C(F)(F)F)c1)c1cc(Br)ncc1F 762428522 ZJBUJTBXCADOOC-UPHRSURJSA-N 392.121 5.037 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(F)c1F 766337123 RDLWCCRMSUTDDS-QRWLVFNGSA-N 391.421 5.503 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(COc3cccc(F)c3)c2)cc1 770527413 IQACGDQKELTQQJ-QGZVFWFLSA-N 376.431 5.308 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C[C@H](O)c3ccc(Cl)cc3)cc2)cc1 772626976 WQBRUVDJYYJAHT-NRFANRHFSA-N 392.842 5.066 30 20 GKED N#C[C@@H](COC(=O)c1occc1CSc1ccccc1)Cc1cccs1 772733889 NEZPJSDSTDIJHW-HNNXBMFYSA-N 383.494 5.173 30 20 GKED N#CCOc1ccc(CN[C@@H](Cc2ccccc2Cl)c2ccccc2)cc1 772957394 FHMTYIMLKMTEKR-QHCPKHFHSA-N 376.887 5.316 30 20 GKED Cc1sc(CN[C@@H](C)c2ccc(OCC#N)cc2)nc1-c1ccc(Cl)cc1 776158204 VLUKRURNEMGATA-AWEZNQCLSA-N 397.931 5.525 30 20 GKED C[C@H](OC(=O)CC(C)(C)C#N)c1cnc(-c2ccc(Br)cc2)s1 784364414 BSSRNHKCRRCVRB-NSHDSACASA-N 393.306 5.117 30 20 GKED CC(=O)c1ccc2nc(NC(=O)c3ccccc3-c3ccccc3C#N)sc2c1 788495965 HOZZWQAYOCGKKF-UHFFFAOYSA-N 397.459 5.290 30 20 GKED CCOc1cc(O)ccc1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 791143281 JNMUICKZAKAZRL-UHFFFAOYSA-N 388.423 5.016 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 793043148 KYJWIYJYWJJPND-QHCPKHFHSA-N 379.463 5.396 30 20 GKED O=C(/C=C\c1ccc(C(F)F)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 794942397 MMPDGGSQIBJXIM-AUWJEWJLSA-N 390.451 5.237 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3cc(C)c(C)o3)c2)cc1 799896144 GSWUBWDXGTVMEB-GHXNOFRVSA-N 375.424 5.053 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)cc1Cl 800133822 SSRYOAVYHFHBPM-UHFFFAOYSA-N 389.160 5.058 30 20 GKED N#Cc1ccc(CN2CCCCC[C@H]2C[C@H](O)c2ccco2)c(C(F)(F)F)c1 811467159 GWMHNISNIROSIV-HKUYNNGSSA-N 392.421 5.038 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1csc(-c2ccccc2F)n1 812245377 SRGIJBRYRDJWHO-HJWRWDBZSA-N 393.468 5.364 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C(F)=C/C3CCCCC3)n2)cc1 815921500 ITSRVKDAYKUVFK-LVSMMTLPSA-N 384.476 5.429 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)oc2ccc(F)cc12 915088049 ZPVMIXJCFUKHHV-OAQYLSRUSA-N 384.410 5.788 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCOc2ccccc2Cl)cc1 915180609 QCQUQAYPMIRGTF-FQEVSTJZSA-N 390.870 5.403 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 916681789 YVEIGDQITOTJCS-NPFVIJTESA-N 385.467 5.380 30 20 GKED N#C[C@@H](C(=O)CCC1CCCCC1)C(=O)Nc1ccc(SC(F)F)cc1 916883466 KVZNKSYNOWFDKX-INIZCTEOSA-N 380.460 5.009 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(SC)ccc2C)cc1 916955473 RBGLIIBEWYBAEI-VBKZILBWSA-N 380.513 5.192 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 918034484 QSAIKRMWZJSZNS-CPJSRVTESA-N 397.522 6.184 30 20 GKED CCN(C(=S)Nc1cc(Cl)cc(Cl)c1)[C@H](C)c1ccc(C#N)cc1 920993529 TZXZTVXOASOCCE-GFCCVEGCSA-N 378.328 5.645 30 20 GKED CC(=NN=C1c2ccccc2-c2ccccc21)c1cc(C(=O)O)ccc1OC(C)C 1776027609 TYIWSTXMCUJLAO-UHFFFAOYSA-N 398.462 5.414 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1ccc(Oc2ccc(Cl)cc2)cc1 1776037406 GLYSRKCBQGIJKY-UHFFFAOYSA-N 380.831 5.667 30 20 GKED O=C(O)c1ccc(NN=CC(Cc2ccccc2)Cc2ccccc2)cc1F 1776075184 SJIAAVPYGTZPHF-UHFFFAOYSA-N 376.431 5.023 30 20 GKED O=C(O)c1cc(Br)cc(/C=C\C(=O)c2ccc3ccccc3c2)c1 1776131167 JYIXTURFPANOEJ-YVMONPNESA-N 381.225 5.197 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776470815 JEGHYIGTGVGWFX-FPAJZGIOSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCC)cc1OCCC 1776784668 FNHHOKYIWYVAOT-FQEVSTJZSA-N 393.568 5.558 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)o1 1776931579 ZUJLJPRIGQESOV-NTMALXAHSA-N 396.826 5.593 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc(C(=O)O)c(C)cc3C)s2)cc1 1777430654 YVWLMZPMBQXNSB-MDZDMXLPSA-N 391.492 5.638 30 20 GKED N#CCc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 51157171 CMOOGWRBIDBGGG-QGZVFWFLSA-N 377.856 5.020 30 20 GKED CC[C@H](C)n1c(SCCCC#N)nc2sc3c(c2c1=O)CCCCC3 57500850 KQEFSFTYWXSBCO-ZDUSSCGKSA-N 375.563 5.094 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccc(Cl)cc2F)c1 59995437 JTDGFQBMEWGVNO-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCc4sccc4C3)cc2)cc1 69203003 VBYDCRAMZUWJTL-UHFFFAOYSA-N 375.453 5.002 30 20 GKED Cc1ccc(NC(=O)[C@H](Sc2cc(C#N)ccn2)c2ccccc2)cc1Cl 71918278 JSNKWWXUGJFIEZ-HXUWFJFHSA-N 393.899 5.387 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3ncccc23)cc1 97699598 JEGTZJWUXLNHFD-UHFFFAOYSA-N 393.446 5.132 30 20 GKED Cc1ccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c(Cl)c1 108824990 VJDRPYQDYQHQLW-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccnc(Cl)c1F 119122293 DSICLNTYASEONF-UHFFFAOYSA-N 381.794 5.099 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(SC)cc3)n2)cc1 121865612 DRVNTYCJOMYEKZ-QGZVFWFLSA-N 380.494 5.031 30 20 GKED CC[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 131983882 QXSXWPFFWBNYTJ-MSOLQXFVSA-N 387.430 5.083 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC3(CCC3)C2)cc1Cl 152396267 WCZOSSQHCHKKCM-IBGZPJMESA-N 379.891 5.403 30 20 GKED N#CCOc1ccc(CNC(=O)Nc2cccc(CSC3CCCC3)c2)cc1 172583180 JMJUBRZEVRQCGN-UHFFFAOYSA-N 395.528 5.086 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CSCc2coc(-c3ccccc3)n2)n1 177768053 BWDZWHINRQKZBS-MRXNPFEDSA-N 397.525 5.031 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1ccc(Br)cc1C(F)(F)F 179720661 OZJDUGQLMAEONN-UHFFFAOYSA-N 391.231 5.060 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2nc3ccccc3s2)o1 183104926 HOQYMDYHFKWQBJ-CYBMUJFWSA-N 389.436 5.099 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)Cc1ccccc1 184308623 WINXUPRWOLGOTM-IBGZPJMESA-N 385.467 5.212 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(=O)N([C@H](C)c2ccccc2)C1 189886280 YSECCLAIKNHFMI-NQIIRXRSSA-N 390.527 5.087 30 20 GKED COc1cccc(Cl)c1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 192217301 UQZUBBUCSRZGDB-CYBMUJFWSA-N 389.908 5.065 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 195629367 ZOVHVEOGEMQBCM-SJORKVTESA-N 388.389 5.106 30 20 GKED COc1ccc([C@H](NCc2cccc(C#N)c2)c2ccccc2Cl)c(OC)c1 237362756 JTFHOQZRJFTGSI-HSZRJFAPSA-N 392.886 5.108 30 20 GKED O/C(Cn1c(C2CCCCC2)nc2ccccc21)=N/[C@H]1CCOC2(CCC2)C1 328926306 WIOLLSLWIGBOKH-SFHVURJKSA-N 381.520 5.142 30 20 GKED C[C@H]1C[C@@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329266337 CSFMNGVQBNAXFQ-VJVADCGASA-N 381.520 5.410 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1N=C(O)[C@@H](C)N1CCC2(CCCCC2)C1 329624425 SJOZIMYFSQTFPB-LJQANCHMSA-N 380.536 5.122 30 20 GKED CC(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1 329991708 KAZQGINLCKEHLX-KVZIAJEVSA-N 376.928 5.919 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 409916827 ZEOHWLOFIUGCBJ-MOPGFXCFSA-N 387.310 5.406 30 20 GKED CC[C@@H](CC(F)F)C(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410691468 VQCUXRNGKVSPLI-TVQRCGJNSA-N 391.302 5.449 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@@H](C)[C@H](C)CC2 410987563 RFFFHMBEACMPOL-NEPJUHHUSA-N 395.484 5.043 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])s1 411008113 RNOXSOLYUHNXIC-UHFFFAOYSA-N 397.378 5.097 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1cccc(OC(F)F)c1 424654909 AOIXPZRSIKZSAF-AWEZNQCLSA-N 390.455 5.111 30 20 GKED CC(C)c1c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cnn1-c1ccccc1 425674309 BCBQILRBAQGLNL-QGZVFWFLSA-N 387.487 5.092 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc(-c4ccc(Cl)cc4)c[nH]3)CC2)cc1 426931499 JLIDPBVHRTWWPW-UHFFFAOYSA-N 387.870 5.136 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)c1cccc(SCC#N)c1 430607360 BZGBSLOKTAELDC-UHFFFAOYSA-N 376.934 5.708 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3ccnc(Oc4ccccc4Cl)c3)CC2)c1 435361811 GTRUGBFQWFPUGE-UHFFFAOYSA-N 389.842 5.069 30 20 GKED N#Cc1ccnc(NC(=O)c2oc3ccccc3c2CSCc2ccccc2)c1 435997838 USQOMJJKRAUZSO-UHFFFAOYSA-N 399.475 5.385 30 20 GKED CC(C)[C@H](Sc1ccccc1C#N)C(=O)Nc1cc(Cl)ccc1Cl 439709221 UXASIIYXBBJFPB-KRWDZBQOSA-N 379.312 5.620 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(Br)s1 443000872 ONYHAEFZRLPZSY-CYBMUJFWSA-N 379.323 5.044 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(Cc3ccc(C#N)cc3)C2)n1 447069647 SUAPWTIKCYPIQH-IBGZPJMESA-N 389.524 5.070 30 20 GKED Cc1ccccc1[C@H]1CN(C(=O)c2ccccc2-c2ccccc2C#N)[C@H](C)CO1 460379083 FQXRSLNIXAFMAQ-KBMIEXCESA-N 396.490 5.136 30 20 GKED C[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Oc1ccccc1Cl 460438050 NXVJWRCPXMEJHG-INIZCTEOSA-N 390.870 5.076 30 20 GKED CCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccccc1S[C@H](C)CC#N 462059350 NMNBPLPCBSBDBB-CYBMUJFWSA-N 398.919 5.197 30 20 GKED C=CCOc1ccc(CNCc2ccc(-c3cccc(OC)c3)cc2)cc1OC 462736310 RZVWHJAYAQHLIY-UHFFFAOYSA-N 389.495 5.225 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](CC)C(C)(C)c1ccccc1 465968734 XIAFOTMAPMPWQS-JOCHJYFZSA-N 375.516 5.012 30 20 GKED CC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)C(C)(C)c1ccccc1 465973581 QYCYUNJZTJPYMM-JOCHJYFZSA-N 377.532 5.235 30 20 GKED N#C[C@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1nccc2ccccc12 483232893 HYVVYWUUWMEEKA-QHCPKHFHSA-N 378.431 5.304 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@]2(c2ccccc2)C(F)(F)F)cc1 484142126 KZKPBFFQUDUQIF-NRFANRHFSA-N 386.417 5.182 30 20 GKED CC[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2[nH]1 484281081 OIFCOHYBOUSTLJ-FQEVSTJZSA-N 396.450 5.108 30 20 GKED CCSc1cccc(F)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 484922007 QKASQDPTKPJWKQ-UHFFFAOYSA-N 393.443 5.249 30 20 GKED N#CCCN(C(=O)c1ccc(-c2cccs2)o1)C12CC3CC(CC(C3)C1)C2 486548323 LFAFHCWKSCLTSE-UHFFFAOYSA-N 380.513 5.333 30 20 GKED C=CCC[C@@H](C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 489749941 IJDSZVQDQMNVMI-CABCVRRESA-N 382.451 5.479 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccccc1)C1CCC1 494680532 NNWJDCRODPYJJS-QFIPXVFZSA-N 380.536 5.093 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCO[C@H](C(CC)CC)C1 498384461 JVLJQDIZACKCEA-RDJZCZTQSA-N 384.973 5.083 30 20 GKED N#C[C@H](NC(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccccc1F 505955437 WSVBKAOPPKXMFI-LEWJYISDSA-N 376.456 5.040 30 20 GKED C[C@H]1CCC[C@H](CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 510610400 XNQCJJTYFAUKBE-ICSRJNTNSA-N 391.515 5.279 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Cn1ccc2ccccc21 511878287 XPNIQPHSDJMCMU-IRXDYDNUSA-N 377.513 5.168 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)NCC(C)(C)CCC#N 513148087 JSRNWLVOPZTOMQ-MRXNPFEDSA-N 384.549 5.151 30 20 GKED CC(C)(CCC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccccc1 513853351 WXYCZALWXIEWKT-UHFFFAOYSA-N 388.433 5.207 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 514708844 KXBKFUQSURSWPH-CQSZACIVSA-N 387.508 5.367 30 20 GKED CC(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)cc1 518906094 VXQCPWVYVGRTAX-INIZCTEOSA-N 380.513 5.226 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)Nc3ccc(F)c(C#N)c3)s2)cc1 520785593 CDBPWYZDSVTEIS-CQSZACIVSA-N 394.475 5.320 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 522702150 FCOBKCVWIGNBDM-IBGZPJMESA-N 391.515 5.376 30 20 GKED COc1ccc(Sc2ccc(NC(=O)c3ccc(C#N)cn3)cc2Cl)cc1 523311134 ORUZYZVUIRHYDM-UHFFFAOYSA-N 395.871 5.019 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2cc(C)oc2C)nc2onc(C)c12 523512030 DPRLFSHTASBUSP-UHFFFAOYSA-N 381.476 5.226 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc([C@@H]2CCCOC2)c1 534300928 JWTNSRWATBHDED-VQIMIIECSA-N 380.513 5.085 30 20 GKED CCCN(C(=O)c1ccc(CC#N)cc1)[C@H](C)c1ccccc1Br 536243078 IITHTTGVEMWALT-OAHLLOKOSA-N 385.305 5.129 30 20 GKED C=CCC[C@H](NCc1nc(COc2cc(C)cc(C)c2)no1)c1ccccc1 539361197 MSUFRROCUOCMFH-NRFANRHFSA-N 377.488 5.063 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cccc(C(F)F)c2Cl)c(OC)c1 541647842 YRTIPGODAGDRFL-UHFFFAOYSA-N 381.806 5.032 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 541992178 QWLOBKPFIMOEPT-KRWDZBQOSA-N 380.451 5.174 30 20 GKED Cc1ccccc1-c1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)no1 542012772 LDAKIDOHEFRETQ-GOSISDBHSA-N 394.478 5.435 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(CCC(F)(F)F)no2)cc1Cl 544986933 HMTFDDZSZCRBQN-UHFFFAOYSA-N 393.752 5.549 30 20 GKED CCCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)CC1CCCCC1 557554278 RZVRKQIJEGYVIB-SFHVURJKSA-N 387.593 5.312 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCCOCCc1ccccc1 559737102 ROWLLKHLVRXPML-UHFFFAOYSA-N 398.506 5.131 30 20 GKED CC(C)OCc1ccc(C(=O)N(Cc2ccccc2)c2ccccc2C#N)cc1 560324593 BBICFPGSFWBUFS-UHFFFAOYSA-N 384.479 5.330 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCc3cccnc32)cc1Cl 589830567 XCLCVZPQNBXKBM-WOJBJXKFSA-N 387.870 5.059 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1Cl 590880748 QXPCKNVZZGGGNC-LBPRGKRZSA-N 394.805 5.767 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)N3Cc4cccc(C#N)c4C3)c2)C1 593150318 CDXJKGWOYCIIBE-JTSKRJEESA-N 389.499 5.201 30 20 GKED C[C@H](Oc1ccc([C@@H](C)NC(=O)N(C)CC(C)(C)C#N)cc1)c1ccccc1 596749440 JRKVQEWNUUOOCW-MSOLQXFVSA-N 379.504 5.079 30 20 GKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)CCOCC1 597589731 WVLKANHULLCGDY-UHFFFAOYSA-N 389.282 5.309 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccccc2Nc2cccc(C(F)(F)F)c2)C1 597916484 NCYQRJSDFOPDGU-HNNXBMFYSA-N 387.405 5.215 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)[C@@H](C)c1ccc(F)cc1 603964616 YISADKZJGZEKGP-INIZCTEOSA-N 392.430 5.093 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2sc3c(c2C#N)CCCC3)cs1 608932013 PSMDZSMXLJZNQR-UHFFFAOYSA-N 379.510 5.183 30 20 GKED Cc1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cnn1-c1ccccc1 609176493 JUWVOFMRPOQOJI-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C[C@@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1cccc(C#N)c1 610344920 MPYPGSIVZOMWRL-QGZVFWFLSA-N 386.455 5.085 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3F)cn2)c1 618798575 RYZZPBXDQZRCTA-UHFFFAOYSA-N 398.397 5.132 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1 618841688 AETZMZRYWWUGJR-XMMPIXPASA-N 399.469 5.097 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618848358 UQWPBOBQEKNFDU-VFCRVFHLSA-N 381.907 5.033 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1c(C)cc(C)nc1OC 621459019 XYJWPIPVJQDRMS-UHFFFAOYSA-N 381.520 5.223 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCC(=O)c1ccc(C(C)C)cc1 642287995 ITQHAPAHNYLVNQ-UHFFFAOYSA-N 391.540 5.153 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1c(C)cccc1C 669321957 ZNLXBILETRAGJP-UXHICEINSA-N 380.536 5.054 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)N[C@@H](C)c1ccsc1 670175068 FRFOPVIMKUOCEU-LBPRGKRZSA-N 397.313 5.109 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1ccccc1OC(F)F 725831369 SQHVTTBJZNJKSS-UHFFFAOYSA-N 396.319 5.086 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)CCc1ccc(Cl)c(Cl)c1 726755953 PHRHDCHEWZEMGR-UHFFFAOYSA-N 398.293 5.061 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCCc2c[nH]c3ccccc23)c1 728183310 RHAZEEMNBYPSES-UHFFFAOYSA-N 382.463 5.298 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)c1 730180515 FZHLFJXPHLYWCC-UHFFFAOYSA-N 383.419 5.274 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 731199026 SGXUELVYOVBOQH-MRXNPFEDSA-N 379.485 5.004 30 20 GKED O=C1NC(=Nc2cccc(C(F)(F)F)c2)S/C1=C\c1ccnc2ccccc12 731835487 GADVPBXFNPXEAD-YVLHZVERSA-N 399.397 5.145 30 20 GKED CC[C@@H](C#N)Oc1cc(C/N=C/c2cc(Cl)cc(Cl)c2O)ccc1OC 733205010 HCWOCKOUHPSLBV-QCXKMSLLSA-N 393.270 5.008 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccccc2N(C)c2ccccc2)c1 733771121 KAZYGSWJRSEBBA-NRFANRHFSA-N 399.494 5.065 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccccc3OCc3ccccn3)c2c1 734307447 OYBMBRUCASZSEH-FMIVXFBMSA-N 384.435 5.047 30 20 GKED O=C(/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1c(Cl)nc2sccn12 741849506 WHSLJJNEEFVOEK-GQCTYLIASA-N 399.815 5.114 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H](c2cccc(Cl)c2)C(C)C)c1 749389577 DZZNQWWGFHWFFZ-TZIWHRDSSA-N 384.907 5.077 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cccc(-c2ccoc2)c1 760970588 UUGXFZFIUROVEM-GOSISDBHSA-N 399.233 5.215 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 765041117 WYOCSQTWXUTOSD-HZPDHXFCSA-N 384.907 5.114 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)C1 766616496 HUHUMUJHFGRWTQ-KZNAEPCWSA-N 384.545 5.628 30 20 GKED Nc1c(Cl)cc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)cc1Cl 773159694 IZUYYUWJBSXIAT-UTCJRWHESA-N 386.238 5.054 30 20 GKED O=C(/C=C/c1cccc(Br)n1)c1ccc(SCC(F)F)cc1 777918490 MIEQOTVATGTVQD-RMKNXTFCSA-N 384.245 5.097 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)O[C@@H](C#N)C1CCCCC1 782422495 FWKHSKWIPMCXHL-INIZCTEOSA-N 392.377 5.298 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)c(-c2ccccc2)n1 788349224 KADKKRMPRVRMRJ-FMIVXFBMSA-N 395.384 5.379 30 20 GKED C#CCC1(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)CCCCC1 788433477 XSZTVQKGRFSZOE-LJQANCHMSA-N 388.511 5.090 30 20 GKED CCCNc1ccc(C#N)cc1NCC(=O)Nc1ccccc1Cc1ccccc1 795266719 RGJRKDSPAAOQID-UHFFFAOYSA-N 398.510 5.022 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cn1nc(SCC)sc1=S 798178445 CMPDSTQROVJVKF-UHFFFAOYSA-N 378.013 5.147 30 20 GKED CC(C)(CCC#N)COC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 798876106 OFBDARJONQOMRG-UHFFFAOYSA-N 380.872 5.174 30 20 GKED C[C@@]12CC[C@H]3[C@H](CC=C4C[C@H](OC(=O)CCCC#N)CC[C@@]43C)[C@@H]1CCC2=O 813072149 FVKHJRGCYYRFPX-WGTGAISYSA-N 383.532 5.124 30 20 GKED N#C[C@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1nc(C2CC2)cs1 842938896 MHOCBMXEATZUPJ-CYBMUJFWSA-N 382.432 5.008 30 20 GKED COc1ccc(N=Cc2cc(Cl)cc([N+](=O)[O-])c2O)cc1OC1CCCC1 914557108 ASDKAMOQVKAUMB-UHFFFAOYSA-N 390.823 5.034 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(OCC(F)(F)F)cc1 920480263 CKMUEAFVEVGHQX-UTCJRWHESA-N 395.427 5.709 30 20 GKED O=C(O)c1ccc(NN=Cc2ccccc2OCCC2CCCCC2)cc1F 1776077022 QXPAFNSAZAYMHU-UHFFFAOYSA-N 384.451 5.319 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776697208 AHKYRSHICXPASI-RZXPCSSPSA-N 390.435 5.760 30 20 GKED O=C(O)COc1ccc(/C=C2\CCCc3ccc(Cl)cc3C2=O)cc1Cl 1777645841 STRPWSSZPBOESM-RIYZIHGNSA-N 391.250 5.059 30 20 GKED C[C@H](C#N)Sc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccccc1 4800640 DBBWOFAOBZNQDP-GFCCVEGCSA-N 389.311 5.304 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nc3ccccc3c(=O)n2C2CCCC2)cc1 7427828 HACDNUDTYXKOIH-LJQANCHMSA-N 389.524 5.047 30 20 GKED CC(C)c1ccc([C@@H](NCC(=O)Nc2ccc(C#N)cc2)c2cccs2)cc1 7876728 RMTGOZDGMZWTHX-HSZRJFAPSA-N 389.524 5.061 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nnc1-c1ccco1 42154704 NFEDYSKISJDLFT-UHFFFAOYSA-N 382.876 5.218 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2F)s1)c1cccc(N2CCOC2=O)c1 60203539 YQRDRKHJMOVIIW-CSKARUKUSA-N 393.439 5.407 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 61550085 SHXPKXVEGOTJNW-UHFFFAOYSA-N 383.448 5.295 30 20 GKED C[C@@H](NC(=O)NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccc(C#N)cc1 61587413 FZUINZCRCFABHJ-MRXNPFEDSA-N 389.430 5.050 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1cccc(OCc2ccccc2C#N)c1 65635917 NOCMKPDXQBMZRJ-KRWDZBQOSA-N 388.442 5.110 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(C2CC2)n(C(C)(C)C)n1 66801369 MCXCHKIMNUCPJY-CQSZACIVSA-N 382.533 5.162 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)n1 112148634 UWLPUPWKWIJTRA-QHAWAJNXSA-N 388.492 5.011 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(Cc2cccc(Cl)c2)C(C)C)c1 114037953 GKOPOMCFRAVBOI-FQEVSTJZSA-N 399.922 5.141 30 20 GKED C[C@H](N[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)c1ccc(C#N)cc1 150872838 RPHSMYRYTWANLB-RYUDHWBXSA-N 387.270 5.327 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1cccc(N2CCOC2=O)c1C 174559705 PBLRITCHISTRRX-UHFFFAOYSA-N 375.513 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)c1cc2ccccc2o1 182627500 ZRVCBTRYQHLNCM-HOTGVXAUSA-N 393.512 5.116 30 20 GKED Fc1ccc2oc(CN[C@@H](c3ccccc3C(F)(F)F)C(F)(F)F)nc2c1 183334441 WVGONKFROQMPRU-HNNXBMFYSA-N 392.274 5.379 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCNc1ccc([N+](=O)[O-])cc1 188061595 ZUESBMWYZZUMOI-UHFFFAOYSA-N 381.476 5.278 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccsc2)cs1)c1ccc(F)cc1F 194614852 YVZGSONQAPISJW-HWKANZROSA-N 390.436 5.064 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C1(C)C 276366047 MIYSODJGGOISQH-WFASDCNBSA-N 385.455 5.276 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(c2c[nH]c3ncccc23)CC1 301992184 QIUPTKFLJAHJQT-UHFFFAOYSA-N 387.874 5.020 30 20 GKED Cc1ccc(-c2noc([C@@H](C)Sc3nc4c(cc3C#N)CCCC4)n2)cc1F 302931792 FTXIDTQLEMRCRI-CYBMUJFWSA-N 394.475 5.183 30 20 GKED C[C@H](NCc1ccc(OC(F)(F)F)c(Br)c1)c1ccc(C#N)cc1 392289499 PZVZWSZIQJIGPV-NSHDSACASA-N 399.210 5.070 30 20 GKED C=CCC[C@H](NC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 429085542 ZTAPMGNLHPQMCO-RJGXRXQPSA-N 378.516 5.161 30 20 GKED CCCOc1cc(C)ccc1CNC(=O)N[C@H](CCCC#N)c1ccccc1 431286922 HZLSLMLNMDPQQN-OAQYLSRUSA-N 379.504 5.018 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(-c2nccs2)cc1)c1ccccc1 432629605 IPIPGWUNFHBSAB-IBGZPJMESA-N 376.485 5.367 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2OC(F)F)C(F)(F)F)c(Cl)c1 439432962 XKYOWACYWPVXMR-OAHLLOKOSA-N 390.739 5.206 30 20 GKED N#CCC[C@H](NC(=O)N1CCSC[C@H]1c1ccc(Cl)cc1)c1ccccc1 440245546 QTYHZMQAXZIXEF-PMACEKPBSA-N 399.947 5.185 30 20 GKED Cc1nc(-c2ccc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)cc2)cs1 442669438 CRSZURDOBMJAON-IFMALSPDSA-N 387.508 5.031 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@@H]3Cc3ccccc3)c2)cc1 443937199 MKZJISNXVHIOKG-OAQYLSRUSA-N 383.451 5.199 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(COCCOCC)c2C)CCCC1(C)C 444921083 MIWLEZXUWYFUEN-NRFANRHFSA-N 388.552 5.147 30 20 GKED CC[C@@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1 447585465 JCJLWJARDIUUHH-GGAORHGYSA-N 375.903 5.631 30 20 GKED CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458831177 GQMZOFRLFXXMJF-FGZHOGPDSA-N 381.495 5.599 30 20 GKED C[C@@H](C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1cccc(C#N)c1 462245298 JBLJQCXKRVBNKQ-OAHLLOKOSA-N 384.932 5.098 30 20 GKED C=CCOCCCC(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 463538656 BVDDKSCWFFPHEL-UHFFFAOYSA-N 382.938 5.177 30 20 GKED CC[C@@H]1CCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 465158627 SBVKSBVLZMGRJJ-NQIIRXRSSA-N 377.488 5.032 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C(C)(C)c1ccccc1 469155227 UVCJEHVXIHWZGW-GOSISDBHSA-N 375.516 5.048 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1 475548831 OVEJOPIKWJWAEC-GMAHTHKFSA-N 396.506 5.719 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2NC(=O)C[C@@H]2C=CCC2)cc1 475750267 AHFAKLDPLUBVQH-QGZVFWFLSA-N 387.483 5.035 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC[C@H](c3cccc(F)c3)C2)c2ccccc21 478261233 ORPPMNJXUTZYRJ-ICSRJNTNSA-N 389.474 5.150 30 20 GKED C[C@H](NCc1cc(C#N)n(C)c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 480461944 OZWFNJJSFGEFBE-ZDUSSCGKSA-N 389.446 5.495 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 481567812 CHELWMKJHPCASL-MRXNPFEDSA-N 389.430 5.159 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)NCc3ccc(C#N)cc3)o2)cc1 482488722 MXVIJTIWSSLSJK-UHFFFAOYSA-N 393.446 5.119 30 20 GKED C=CCN1CCC(N[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 482628524 KJBIRRWKVIFSQE-GFCCVEGCSA-N 380.376 5.025 30 20 GKED N#CCCC[C@@H](NC(=O)c1cnc(Cc2ccccc2F)s1)c1ccccc1 487485334 LZZWTORBVMEMRF-LJQANCHMSA-N 393.487 5.038 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N[C@H](CCCC#N)c1ccccc1 487596509 RXMGQRQJIMLCEG-LJQANCHMSA-N 393.487 5.423 30 20 GKED CCn1cc(CC(=O)Nc2sc3c(c2C#N)CCCCC3)c2ccccc21 498289655 VQSJEUDKVFHFLP-UHFFFAOYSA-N 377.513 5.044 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 499468251 CEYLDRFKRRHLGS-GFCCVEGCSA-N 394.418 5.095 30 20 GKED C[C@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(C(F)(F)F)cc1 500458043 BTZQXVFSCLCQDQ-NSHDSACASA-N 398.837 5.663 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCc4cccc(F)c4C3)cc2)c1 503500394 XXPFQNOMCHRWNF-UHFFFAOYSA-N 387.414 5.080 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@@H](C)c3ccc(C#N)cc3F)c2)cc1 512659451 HBKRNTJPTXGEHA-KRWDZBQOSA-N 387.458 5.109 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCc1ccc(F)cc1 514536958 JVFYWFNYIUWRQU-UHFFFAOYSA-N 390.433 5.311 30 20 GKED N#Cc1c(NC(=O)c2ccc(Oc3ccccc3)nc2)sc2c1CCCCC2 514568121 JZFKIDXKAAYZDX-UHFFFAOYSA-N 389.480 5.328 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H]1CCc2ccccc21 517533578 WSNPFMPFOFJNOJ-UWJYYQICSA-N 393.556 6.012 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 518256207 PYHCDGLEUQHGRV-IRXDYDNUSA-N 397.544 5.751 30 20 GKED Cc1csc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 518955830 OKQYIPZXTWAXJF-UHFFFAOYSA-N 384.848 5.413 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nccs2)cc1 519909428 XCMYFDLEYJFXRW-UHFFFAOYSA-N 390.512 5.372 30 20 GKED COc1ccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520198072 ZWIPJRAULZJWAO-MRXNPFEDSA-N 397.544 5.189 30 20 GKED Cc1sc(NC(=O)c2cccnc2SCC2CCCCC2)c(C#N)c1C 522306903 RIDZRCWDOWTWLC-UHFFFAOYSA-N 385.558 5.556 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CC[C@H](Cc4ccccc4)C3)c2)cc1 524653746 HDVXZRHKDDKALY-OAQYLSRUSA-N 381.479 5.007 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2cnc(-c3ccsc3)s2)CC1 531001668 XQCFQEIBVUAVJT-UHFFFAOYSA-N 395.553 5.223 30 20 GKED C=CC[C@H](C)[C@@H](C)Nc1ccc(NC(=O)[C@@H](C)n2nc(C)cc2C)c(Cl)c1 538634108 HEHYNDRCGHQSKY-IAOVAPTHSA-N 388.943 5.366 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(SCc4ccccc4)cn3)cc2)CC1 539706508 CYJFBDPTZRGZMH-UHFFFAOYSA-N 385.492 5.181 30 20 GKED CCC[C@@H](C#N)NC(=O)c1sc2cccc(F)c2c1COc1ccccc1 539927236 JSZYKBARIATNEQ-AWEZNQCLSA-N 382.460 5.041 30 20 GKED Cc1nc(C2CC2)oc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 546777293 OVPKJEQBNIKGPN-UHFFFAOYSA-N 395.406 5.137 30 20 GKED N#Cc1ccc(C[C@@H](C#N)C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)cc1 556483221 UIZKMEAVRKJHJL-FQEVSTJZSA-N 385.854 5.200 30 20 GKED CCc1ccc(-c2nc(CC(=O)N(CCC#N)c3ccc(F)cc3)cs2)cc1 558148964 POWBWMVRUNPDEP-UHFFFAOYSA-N 393.487 5.001 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(CN(CC)CC)cc1 558711678 VGWRFDCYRHASGH-UHFFFAOYSA-N 376.953 5.072 30 20 GKED Cc1ccc(OC2CCN(C(=O)c3sc4ccc(C#N)cc4c3C)CC2)cc1 559882450 XDUKFHGKSIECJP-UHFFFAOYSA-N 390.508 5.073 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1cccc2c1CN(c1nccs1)C2 563340816 YNPJSTISWSFEBQ-NRFANRHFSA-N 386.524 5.415 30 20 GKED CCO[C@@H](c1noc([C@H](C)C(F)(F)F)n1)c1ccc(F)cc1C(F)(F)F 573733753 KERXOFAABUPSCC-WRWORJQWSA-N 386.267 5.019 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(F)(F)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 574093127 DKXHBENVIKKXEJ-CJNGLKHVSA-N 390.396 5.399 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)CCCCC2=O 584143293 TWZKCJWZAWTAAH-HNNXBMFYSA-N 378.497 5.242 30 20 GKED C[C@H](N[C@H](C)c1ccc2nc(O)oc2c1)c1ccc(-c2cccc(C#N)c2)cc1 586792962 DFARYWAXBQPHFA-JKSUJKDBSA-N 383.451 5.484 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(C(F)(F)F)s3)n2)cc1 588816075 KBALBLSKUYPESG-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CC[C@@H](OCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 593158036 SDEMQLQFRQOUOQ-FXAWDEMLSA-N 397.544 5.370 30 20 GKED N#CC1(c2ccc(CN[C@H]3CSCc4ccc(Br)cc43)cc2)CC1 594973311 PZLGLTJNJLLKHR-IBGZPJMESA-N 399.357 5.082 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 596691878 PYSDBCMFBHPMKH-JXFKEZNVSA-N 392.890 5.153 30 20 GKED CN(C)c1cc(C(=O)Nc2ccccc2SCCC#N)cc(C(F)(F)F)c1 597177442 MIYXZGIZUBGHHC-UHFFFAOYSA-N 393.434 5.029 30 20 GKED N#Cc1ccc(Sc2nnc(-c3ccc(Cl)cc3)n2-c2ccccc2)nc1 602373818 MWCLTYJLSRJDNA-UHFFFAOYSA-N 389.871 5.006 30 20 GKED Cc1cc(C(=O)[C@@H](C)Sc2ccc(C#N)cc2F)c(C)n1Cc1ccco1 607760986 SZNMQLDNOBDLDZ-OAHLLOKOSA-N 382.460 5.121 30 20 GKED N#Cc1c(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)sc2c1CCCC2 608931626 GLELWPQJDCZDRI-UHFFFAOYSA-N 390.430 5.188 30 20 GKED CCc1sc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1C 609378367 FGOZOLHQUNJBAK-UHFFFAOYSA-N 398.475 5.896 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccccc2)CCC1 609436528 ONWMRCFCLQZUIH-QGZVFWFLSA-N 379.529 5.324 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)oc2c(F)cccc12 609594497 WBFIAAKOIBPTLG-CQSZACIVSA-N 377.202 5.182 30 20 GKED CC[C@@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(F)cc1F 610007478 BPCXJFDJEWZGTB-QGZVFWFLSA-N 380.847 5.313 30 20 GKED C[C@@H](NC(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1cccc(C#N)c1 610318620 ZZNNOYJWQPTFNK-LLVKDONJSA-N 397.784 5.035 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc(C#N)c1 610325267 UIBFZKGQXAIPBN-MRXNPFEDSA-N 382.423 5.105 30 20 GKED C[C@H](N[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)c1cccc(C#N)c1 610755230 VPYGVYRUHIPSCN-NWDGAFQWSA-N 387.270 5.327 30 20 GKED C[C@H](NCc1cccc(CN[C@@H](C)c2cccc(C#N)c2)c1)c1cccc(C#N)c1 611389052 WTOSHJKZKZELCE-PMACEKPBSA-N 394.522 5.132 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c(C)o1 613346750 PTMHWMGPGYFRLB-AWEZNQCLSA-N 391.279 5.817 30 20 GKED C=CCCOCC(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 620326420 UIFVLKSCHZYAJO-UHFFFAOYSA-N 380.513 5.677 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 661115528 SWLVLRXEJYIFOM-SIKLNZKXSA-N 397.588 5.669 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 671910449 ZAMCRPYOCXCWIR-IBGZPJMESA-N 381.438 5.058 30 20 GKED CC(C)[C@H](NC(=S)Nc1ccccc1C#N)c1cccc(C(F)(F)F)c1 726494683 UUXRUXJQAQUWAO-KRWDZBQOSA-N 377.435 5.261 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3csc(C(C)(C)C)n3)n2)cc1 726858707 SRPVDJFZUPHDJA-INIZCTEOSA-N 395.553 5.292 30 20 GKED O=C(/C=C/c1csc(-c2ccc3c(c2)OCO3)n1)c1nc2ccccc2s1 728439358 HZXWCTPSKPUVBV-VOTSOKGWSA-N 392.461 5.045 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(F)c(Br)c2)c(Cl)c1OC 730434674 RTVLUJPZCBVGOS-DAXSKMNVSA-N 399.643 5.155 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3cccc(F)c3)CCCCC2)c1 733775011 NJYXCKXZOKSVNA-NRFANRHFSA-N 394.490 5.025 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2c3ccccc3cc3ccccc23)c1 733800377 OLYGWZIVSBZCAE-JOCHJYFZSA-N 380.491 5.964 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3c(c2)oc2ccccc23)c1 733842924 FRQJURKTRKVWJN-SFHVURJKSA-N 399.450 5.589 30 20 GKED C#CCOc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 741523460 YMPLHHRCVPYUTH-UHFFFAOYSA-N 384.460 5.228 30 20 GKED N#Cc1c(NC(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)sc2c1CCC2 741883308 OEAFYZJMVQDQQX-UHFFFAOYSA-N 398.409 5.445 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 744015130 GXGPCQUEPKOWKW-BJRSVTDJSA-N 380.369 5.533 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@H](C#N)c3nc(C(C)C)cs3)ccc2c1 747193046 CUDSGVJLHAZRFJ-SQUITACLSA-N 376.481 5.318 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3csc(C)n3)n2)cc1 750686583 GPJNQPSFRQIVEW-QGZVFWFLSA-N 381.526 5.083 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2cccc(C(F)F)c2Cl)cc1OC 754484955 ZJKAFNIWTPUOQT-NTMALXAHSA-N 393.817 5.503 30 20 GKED N#C[C@@H](C(=O)[C@H](c1ccccc1)C1CC1)c1nc(-c2c(F)cccc2F)cs1 765932474 ZDEYACHMNBQNPH-HNAYVOBHSA-N 394.446 5.458 30 20 GKED C=CCOc1cccc(CNc2ccc(OC)c(NC(=O)C3CCCCC3)c2)c1 770582023 OGOUFCORPVEFRU-UHFFFAOYSA-N 394.515 5.391 30 20 GKED C#CC[C@@H](N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccccc1 773113278 CVKNTAKEGPARTP-RTWAWAEBSA-N 388.536 5.550 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3cc(Cl)ccc3OCC#N)cc2)cs1 775138879 RPISSARKCNCPAO-AWEZNQCLSA-N 397.931 5.525 30 20 GKED CC(C)(C#N)CCCN[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1 775527111 OFDKNMVGGTYMRZ-NRFANRHFSA-N 395.547 5.325 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2sc(-c3ccc(F)c(F)c3)nc2C)cc1 778251119 OIFOTKPBXSWYKU-UHFFFAOYSA-N 397.450 5.266 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1cc(Cl)ccc1Cl 782246149 UZKKZIQRCBQPKT-UHFFFAOYSA-N 395.340 5.048 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2F)cc1 786956779 DUCGLWBWSWIQDT-OAQYLSRUSA-N 395.437 5.729 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(O[C@@H](C)c3ccccc3)cc2)c1 788350027 CIQWEXIFZJEAAN-MBSDFSHPSA-N 398.462 5.096 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cnn(Cc3ccccc3Cl)c2)c(Cl)c1 788361173 VXYDUZQZRQRMLA-VURMDHGXSA-N 382.250 5.006 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2ccc(Br)cn2)cc1 794835455 KCQXIXRYMVKYKD-KBPBESRZSA-N 395.728 5.387 30 20 GKED C[C@H]1CCCN(c2ccc(CNCc3ccc(O[C@@H](C)C#N)cc3)cc2Cl)C1 800277771 ZGUSXNFTCVBNGL-ROUUACIJSA-N 397.950 5.157 30 20 GKED CCOc1c(Cl)cc(C=NOCc2ccccc2C(F)(F)F)cc1OC 836737376 OUOVGWXTZWWASQ-UHFFFAOYSA-N 387.785 5.317 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OC(=O)[C@]2(C#N)CC23CCCC3)c(Cl)c1 839338144 LCAZLRUQLUYCQA-HXUWFJFHSA-N 390.867 5.066 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@]4(C3)CC4(F)F)c2)cc1 844530418 DYWBJRKXWSSBOJ-FQEVSTJZSA-N 383.398 5.004 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)[C@@H](F)c1ccc(C(F)(F)F)cc1 857458190 RIWPSFFEUYAJMH-AWEZNQCLSA-N 379.275 5.460 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 915085503 CCLSUJBXLDNYMT-HXUWFJFHSA-N 391.268 5.357 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccc(F)cc3s2)cc1 915179475 FVRUMYCIIFJMKC-HXUWFJFHSA-N 386.451 5.948 30 20 GKED Cc1csc([C@H](C#N)C(=O)COc2ccc(Cl)cc2C2CCCCC2)n1 916843979 PKYOXWYERPTKPC-QGZVFWFLSA-N 388.920 5.408 30 20 GKED Cc1cc(C)n([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 916975253 AZXAWMASYJTVBI-WMLDXEAASA-N 398.919 5.104 30 20 GKED Cc1c(N=Cc2c(O)ccc3ccccc23)cccc1NC(=O)c1ccccc1 917557314 FRSKOJLJDUIWRF-UHFFFAOYSA-N 380.447 5.857 30 20 GKED Cc1ccc(OCc2nc(C=NNc3nccc4sccc34)cs2)cc1 920375472 UFJKLZLJQOXMRV-UHFFFAOYSA-N 380.498 5.086 30 20 GKED Oc1ccc2ccccc2c1C=Nc1cccc(-c2nnc3n2CCCCC3)c1 920941993 DQEPNJGGOCZQHD-UHFFFAOYSA-N 382.467 5.281 30 20 GKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1sccc1Br 921265332 DNECCJARQQPHGV-UTCJRWHESA-N 391.208 5.348 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc(Cl)ccc1OC(F)F 1776033438 HIAOWEKHLODNIW-UHFFFAOYSA-N 389.185 5.129 30 20 GKED CC(=NNc1ccccc1Oc1ccccc1)c1cccc(O[C@H](C)C(=O)O)c1 1776090985 MGBAHPIROBHFFU-QGZVFWFLSA-N 390.439 5.167 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)cc(C(F)(F)F)c1 1776783114 XIQADCVTOOCXHM-MRXNPFEDSA-N 379.850 5.652 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 1777489734 JTBAUHCWMHEGFQ-PKNBQFBNSA-N 395.480 5.603 30 20 GKED O=C(O)c1cc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)cs1 1777663714 YBUJOIKCENZFIN-GDNBJRDFSA-N 391.473 5.480 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)Cc3ccc(C(C)C)cc3)CCC2)cc1 1791589539 JISLSXGTBRADSF-UHFFFAOYSA-N 390.527 5.063 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)cc1 16405975 OLHLOMIDYUVCTP-JLHYYAGUSA-N 386.838 5.360 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@@H]2CCCC[C@@H]2C)c1 27490073 RFWRHXWPOWVUAV-GHTZIAJQSA-O 395.592 5.006 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2nccs2)c1 56777120 RVFNSRDIGIGVOG-UHFFFAOYSA-N 376.485 5.126 30 20 GKED N#Cc1ccc(OCc2nnc(-c3ccc(Cl)cc3Cl)o2)c(Cl)c1 63534723 GQEOSXBHXZMWRX-UHFFFAOYSA-N 380.618 5.147 30 20 GKED CCCCOc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 64765456 MNQWDZDFVFABJW-UHFFFAOYSA-N 390.439 5.161 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccc(Oc4ccccc4C#N)cc3)o2)cc1 72030866 DWVLQQRZWJZTMI-QGZVFWFLSA-N 396.450 5.882 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccccc2Br)c1 72093557 WGEYUCFDEHNRAC-UHFFFAOYSA-N 389.293 5.068 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc3ccccc3n2)cc1Cl 107648406 OEMLWYGXNJCSJI-GOSISDBHSA-N 398.853 5.191 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1Cl 114620374 RSVQZFXSTGLKHW-DDKJEQMHSA-N 379.872 5.138 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1OC 125560244 MHBOFWNNYNHRCL-CMDGGOBGSA-N 389.451 5.061 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cccc(COC4CCCCC4)c3)o2)cc1 133601020 WHAZUWSCSVYLQR-UHFFFAOYSA-N 388.471 5.070 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3ccc(C#N)cc3)s2)cc1 174094291 ZJQLNKXVFKVFLT-GJZGRUSLSA-N 377.513 5.411 30 20 GKED COc1ccc(-c2ccc(CNCc3ccc(O[C@@H](C)C#N)cc3)s2)cc1 177584105 TWFLBERAVHPALJ-INIZCTEOSA-N 378.497 5.004 30 20 GKED N#Cc1ccc(CN2CCC(NC(c3cccs3)c3cccs3)CC2)cc1 181980656 JWIGMYUOVSVSLS-UHFFFAOYSA-N 393.581 5.025 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cccnc1SCC1CCCCC1 182143081 RWFCOFZPMMVROY-INIZCTEOSA-N 395.528 5.297 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3C[C@@H]4CCC(=O)c5cccc3c54)c2)cc1 183807635 ZUIYOCFRUKEXQV-SFHVURJKSA-N 394.430 5.071 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccc(F)c(F)c1 187783862 KLNPQIUBIZEIQI-YWZLYKJASA-N 383.442 5.600 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)nc2onc(C(C)C)c12 189870512 LNOGAJFXMDUNSO-UHFFFAOYSA-N 377.488 5.759 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(C#N)ccc1OCCOC 191465465 BDVFXFZDEBWOKU-UHFFFAOYSA-N 393.487 5.079 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C[C@H]1C 247062980 BPWVMINZBLPICY-LMMKCTJWSA-N 379.529 5.491 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Nc1ccc(-c2csc(C)n2)cc1 303576074 ZHJTYCSJHSKRNT-OAHLLOKOSA-N 397.569 5.195 30 20 GKED CC(C)C[C@@H]1C[C@H](/N=C(/O)[C@@H]2CC=CC[C@H]2c2nc3ccccc3s2)CCO1 329497254 UZWNPWUQFIXFGE-NCXUSEDFSA-N 398.572 5.896 30 20 GKED CO[C@](C)(/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1F 330277155 NWEHEMDLHKINIT-KNQAVFIVSA-N 385.483 5.033 30 20 GKED CC(C)(C)OC1CC(CCNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1 432280073 MSZAPGKTJJKYMR-UHFFFAOYSA-N 391.515 5.015 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1cc(C#N)cs1 437566562 IHGQGURRVRRDCD-SNVBAGLBSA-N 387.917 5.196 30 20 GKED CCCc1c(NC(=O)Nc2cc(Cl)ccc2F)cnn1-c1cccc(C#N)c1 439222628 KYDJUWCDGGPDPN-UHFFFAOYSA-N 397.841 5.133 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cccc(C[S@@](=O)c2ccccc2)c1 442118876 CHJWNPIUUBZREP-MUUNZHRXSA-N 388.536 5.408 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)c1ccccn1 442658859 UYYXMXUUJKKDQL-OAHLLOKOSA-N 383.234 5.671 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444017462 FBRPRFAMCGWARD-CQSZACIVSA-N 382.348 5.307 30 20 GKED C[C@H](C(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F)c1cccc(C#N)c1 462571824 AIPRIBMTVYNMHY-XOBRGWDASA-N 382.385 5.235 30 20 GKED COc1ccccc1[C@@H](C)S[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1 463201078 ICPVSRZFBVMHTK-RTBURBONSA-N 396.556 5.442 30 20 GKED N#C[C@H](C(=O)c1ccccc1Cc1ccccc1)c1cc(C(F)(F)F)ccn1 464430575 ZUPPJXZRGFDNOV-IBGZPJMESA-N 380.369 5.181 30 20 GKED COc1ccc(C#N)cc1N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 466142987 IKGBVFGETKLGSJ-SNVBAGLBSA-N 389.242 5.097 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(F)c(OC(F)F)cc1F 470145623 XDWJMINKXCXQFB-UHFFFAOYSA-N 382.357 5.176 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 472233852 ODGMZKZICXQNIJ-CYBMUJFWSA-N 383.439 5.011 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1 476172683 WZZDIGWIVOXDEX-PMACEKPBSA-N 398.344 6.043 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1C 482782011 OGPJVAJJMRWBMD-AWEZNQCLSA-N 392.434 5.218 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CC1 485428856 BAAVSPKQPPCQTG-CQSZACIVSA-N 385.920 5.545 30 20 GKED N#Cc1ccc(OCC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 485778819 ACVXHAVDSONHGR-UHFFFAOYSA-N 380.806 5.035 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cc(F)cc4cccnc34)o2)cc1 489791923 VPXVLVMGAZMHMD-UHFFFAOYSA-N 393.443 5.281 30 20 GKED Cc1ccc2nc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)ccc2c1 497366564 TVLNMDLVQYQQJA-GOSISDBHSA-N 394.459 5.028 30 20 GKED Cc1c(C#N)cccc1NCc1cccc(NC(=O)c2ccccc2Cl)c1 500705636 ZNMSITBMXJNFRC-UHFFFAOYSA-N 375.859 5.385 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(-c4ncco4)cc3)c2)cc1 501655647 NRVSEIFFRPBFOR-UHFFFAOYSA-N 380.407 5.209 30 20 GKED N#C[C@H](NC(=O)c1cccc(-c2cscn2)c1)c1cccc(Cl)c1Cl 505302364 UKTOXRYAHHXYEI-HNNXBMFYSA-N 388.279 5.112 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3coc(C4CCCC4)n3)c2)c1 509624362 IEPKZGNVDSHGNM-UHFFFAOYSA-N 387.439 5.035 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)Nc3ccccc3Cl)c2)cc1 517924131 SQMAUJSFYGMRCZ-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCCC[C@H]1c1ccccc1 518634204 ZBBYUCCYFICCQW-RXVVDRJESA-N 393.556 5.247 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 520556879 MBXFWMBZBLEDJM-UHFFFAOYSA-N 394.883 5.978 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cs1 522088740 DZDXRWOEXRXKLX-AWEZNQCLSA-N 392.484 5.252 30 20 GKED C[C@H]1CC(F)(F)CCN1C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 530013407 FHSDPDUYEVKWPI-ZDUSSCGKSA-N 390.817 5.264 30 20 GKED C=CCN(C(=O)c1cnn(CC(C)C)c1CC)c1nc(-c2ccccc2)cs1 534463497 PXZMBSDFNFDTES-UHFFFAOYSA-N 394.544 5.058 30 20 GKED CC(C)c1cc(Br)ccc1NCc1nnc(-c2cccc(C#N)c2)o1 536301988 JGKOZPGMSJKYPQ-UHFFFAOYSA-N 397.276 5.106 30 20 GKED COc1cccc([C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)c1 537295818 RASBATJCHSUEFG-HJPURHCSSA-N 376.887 5.660 30 20 GKED CC(C)(C)C[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(F)cc1 538151303 RMDCEWQYUGKYHV-IBGZPJMESA-N 378.451 5.014 30 20 GKED N#CC1CCN(C(=O)N[C@@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)CC1 538972503 FYHNUWNDQGGPBY-IEBWSBKVSA-N 393.453 5.067 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 539417764 VTZVZJXVKZKNJX-UHFFFAOYSA-N 383.454 5.174 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C#N)c1ccc(-c2ccncc2)cc1 554229655 CNIJAMZMFORDCJ-OAHLLOKOSA-N 392.300 5.234 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3csc(-c4ccncc4)n3)c2)cc1 559024558 MLABMRXUNQQFAU-UHFFFAOYSA-N 397.463 5.073 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)NCC(C)(C)CCC#N 562101261 BQJMKXZOFMYFFC-UHFFFAOYSA-N 393.491 5.091 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 562137522 SAKYVXHXDPSEHT-QGZVFWFLSA-N 387.405 5.297 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(C)s1 574727670 FGVFZXPTQCFTEH-AWEZNQCLSA-N 392.484 5.307 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)COc1cccc2ccccc12 576936992 UFMPIJARSYABQX-HKUYNNGSSA-N 392.524 5.086 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)Nc1cc(C#N)c2ccccc2n1 578097430 VSGIOLDDQRYZPC-UHFFFAOYSA-N 376.485 5.171 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC[C@@H](C3CC3)C2)cc1 589525512 GSEJCZNJDGSZPX-HXUWFJFHSA-N 376.525 5.113 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)CC1(C#N)CC1 590272174 CAGHQGZWYXKARH-UHFFFAOYSA-N 390.462 5.364 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC[C@H](O)CC2(C#N)CCOCC2)cc1 600742114 JUAYABCETNWZKY-WIYYLYMNSA-N 396.556 5.023 30 20 GKED N#Cc1ccc(C(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)nc1 609342661 ZPKJDPBXTSDFSK-UHFFFAOYSA-N 390.855 5.195 30 20 GKED CC[C@@H](SCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 609389467 RXDPJBFCJSAWDO-QFBILLFUSA-N 384.570 5.904 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCCCCOC1CCCCC1 609510797 OERRDQZHMWUJET-UHFFFAOYSA-N 390.527 5.475 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cccc(Cl)c3Cl)c2)cc1 609642870 BOCZRLGBOWSWAE-UHFFFAOYSA-N 397.261 5.696 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)CC1 609773849 ZXUJFWPJXIHBML-KRWDZBQOSA-N 393.487 5.403 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccncc1 610723104 PYOPLIDSHITLHM-CYBMUJFWSA-N 393.434 5.238 30 20 GKED Cc1cc(F)ccc1C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 622485295 JVIRRXWHGQPIGC-AWEZNQCLSA-N 379.275 5.186 30 20 GKED FC(F)(F)c1cc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccn1 672161955 IFEDUYWWIDWVNN-HTQZYQBOSA-N 380.254 5.422 30 20 GKED CCc1c(C)sc(NC(=O)c2sc3cc(F)ccc3c2Cl)c1C#N 727790902 YRHZPNOTTSJOND-UHFFFAOYSA-N 378.881 5.750 30 20 GKED O=C(O)c1ccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)s1 730588981 DUYVOHSAJDVYDT-ALCCZGGFSA-N 381.434 5.212 30 20 GKED CCc1ccc(C(C)=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)s1 733080631 TZXXUQXYVONJJL-UHFFFAOYSA-N 391.422 5.017 30 20 GKED C=CC[C@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccncc1 734234813 UPSSHOSICCKNNM-QHCPKHFHSA-N 381.479 5.132 30 20 GKED C/C(=C/C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 741908560 FVSSXOLYCJSFGR-SQFISAMPSA-N 388.389 5.430 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N[C@H](C)c2csc3ccccc23)cc1 743474403 HWCJVZVUKOCNCH-QZTJIDSGSA-N 391.540 5.196 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1 747111408 JIKJVTYPXQGMDG-SUMWQHHRSA-N 397.544 5.224 30 20 GKED FC(F)Oc1ccccc1C=NOCc1coc(-c2ccc(Cl)cc2)n1 749116960 PUDCAZMXWZHLKR-UHFFFAOYSA-N 378.762 5.147 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)c2cc3cccc(Cl)c3o2)c1C 753241305 WJFKKJXEPGABDU-UHFFFAOYSA-N 390.830 5.013 30 20 GKED COc1cc(F)cc(NN=Cc2c(C(C)C)nn(-c3ccccc3)c2Cl)c1 759209608 GQKWCOCYQABHFB-UHFFFAOYSA-N 386.858 5.243 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1cc(Br)ncc1F 762410093 IWMKZCJCTVAQAH-UHFFFAOYSA-N 393.647 5.021 30 20 GKED N#CCCn1cc(C=NNc2c(Cl)cccc2Cl)c(-c2ccccc2)n1 763188610 UPSKSHLFSRLSOO-UHFFFAOYSA-N 384.270 5.217 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C[C@H](O)c3ccc(C#N)cc3)s2)cc1 763412472 XXLYCOVZEQXNDB-UWJYYQICSA-N 391.540 5.025 30 20 GKED Cc1c(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1CC(C)C 766335331 BMRHJFJOSGGEAR-OAQYLSRUSA-N 387.487 5.147 30 20 GKED CC(C)CN(C(=S)Nc1cccc(OC(F)(F)F)c1)c1ccc(C#N)cc1 783729976 HJZYMVWBXJFRCX-UHFFFAOYSA-N 393.434 5.316 30 20 GKED Cc1ccc(Br)nc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 786617043 FDLBULUPSZBGKO-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C[C@H](C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1)[C@@H]1OCCc2sccc21 796749635 WAUZQRROXRTHKF-NYHFZMIOSA-N 389.476 5.142 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 798864417 JJTKCJFHYJPIGP-SMDDNHRTSA-N 380.435 5.439 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccc(Oc2ccnc(C#N)c2)cc1 811707626 FREFOWWHPUPGNS-UHFFFAOYSA-N 394.887 5.516 30 20 GKED CCCC(=NNc1cnnc(O)c1Cl)c1ccc(Oc2ccccc2)cc1 814782493 KCEYUVLAZIQBLX-UHFFFAOYSA-N 382.851 5.244 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)cc(F)c1O 815635961 MRUFQQHGQXSKFQ-UGSOOPFHSA-N 391.284 5.380 30 20 GKED N#CCCC[C@@H](NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1ccccc1 817318935 IZSOQQUMOFGDMW-MSOLQXFVSA-N 378.369 5.267 30 20 GKED CC(C)(C)c1csc(NC(=O)N2CCCCC[C@@H]2c2ccncc2)c1C#N 821482896 YYCJYQKLEKLTRL-GOSISDBHSA-N 382.533 5.461 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c2C#N)[C@H](C)C1 839389766 SRXXGOSWMKKGFP-NXEZZACHSA-N 389.864 5.119 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)c1cc2c(s1)CCCC2)c1ccc(Cl)s1 845838390 SKEKCEVUBHGDTC-CMPLNLGQSA-N 377.918 5.037 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)N(c2ccc(C#N)cc2)C2CCC2)cc1 857677385 QEQDCGGLCNMRFV-UHFFFAOYSA-N 391.471 5.105 30 20 GKED Clc1ccc(CNN=Cc2ccccc2OCc2ccccn2)c(Cl)c1 914696722 JYXPZKDQDVKXIR-UHFFFAOYSA-N 386.282 5.091 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 916942951 RAQFKJVXNXYELU-QGZVFWFLSA-N 389.282 5.252 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(C)s2)cc(Br)c1OC 917042355 AGXIPTJGSAONPP-SREVYHEPSA-N 381.291 5.122 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCCC(=O)c2ccccc2)cc1 917119622 PGZYNYPAXHACSW-XMMPIXPASA-N 396.490 5.724 30 20 GKED O=C(Nc1cccnc1)/C(=C\c1ccc(C(F)(F)F)cc1)C(=O)c1ccccc1 920955565 VTPMQFCOGXHYQR-UYRXBGFRSA-N 396.368 5.005 30 20 GKED O=C(O)c1ccccc1NN=Cc1cc(F)ccc1Oc1cc(F)cc(F)c1 1776031375 CQXBIYHCHWBUJW-UHFFFAOYSA-N 386.329 5.040 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2Cc2ccc(Cl)cc2)ccc1Cl 1776033780 GQGVQBFYPFNXPX-CYBMUJFWSA-N 377.271 5.502 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2ccccc21 1776308634 JCXFNMWTKBYMQN-IMEWXKHHSA-N 388.488 6.133 30 20 GKED C[C@H]1/C(=C/c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2c(O)ccc(F)c21 1776586628 IZDNZTKKEMEWED-CYUIRQCWSA-N 388.394 5.280 30 20 GKED O=C(O)/C=C/c1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 1777623985 IUMGKPQNTYCXIE-NXZHAISVSA-N 381.642 5.641 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)c4cccc(Cl)c4)CCC3)cc2)C1 1785808094 NPHOEQMVIVDXRT-UHFFFAOYSA-N 394.902 5.054 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)c1ccccc1-c1ccccc1C#N 8176490 ORLOXLFQNRAPCI-GOSISDBHSA-N 398.462 5.026 30 20 GKED C=CCn1c(SCc2cn3cc(Cl)ccc3n2)nnc1-c1cccc(C)c1 10241255 KZISKPAMGVVOFU-UHFFFAOYSA-N 395.919 5.033 30 20 GKED O=C(CON=C1c2ccccc2-c2ccccc21)Nc1ccccc1C(F)(F)F 14354314 MEFBOZNAQIPAJR-UHFFFAOYSA-N 396.368 5.094 30 20 GKED C=CCn1c(SCC(=O)c2sc3ccccc3c2C)nnc1-c1ccco1 28503502 OLOXSGGGRWYMKL-UHFFFAOYSA-N 395.509 5.222 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 32164001 YLEOYKUDALVMCL-UHFFFAOYSA-N 376.500 5.288 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 55823894 CGYIVAAMQQTYFP-UHFFFAOYSA-N 398.462 5.149 30 20 GKED CCn1c([C@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)nc2ccccc21 65824854 UYCFMLUAPPHKAV-KRWDZBQOSA-N 394.478 5.086 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)cc2)CC1 66037325 MWRUPCSPGGMCHP-UHFFFAOYSA-N 396.450 5.189 30 20 GKED CSc1ccc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1 66545479 GPTCBKGJUIBUGI-GOSISDBHSA-N 389.505 5.202 30 20 GKED O=C(Nc1cc(F)c(F)cc1F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 92034034 XNKKEVNCJYXQMK-AWEZNQCLSA-N 380.263 5.058 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)Nc1ccc(F)cc1OCC#N 135265899 KBIWCDNMIZZOQX-UHFFFAOYSA-N 389.430 5.059 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)C(=O)c1cccc(F)c1 174730100 JZWXNXQOLLNMGV-LSDHHAIUSA-N 384.476 5.068 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1cccc(Cl)c1 175119658 NPQCUVVHEBJOJS-SAAWKEMMSA-N 385.801 5.365 30 20 GKED C=CCn1c(-c2sc(NC(=O)C(C)(C)CCCCC)nc2C)n[nH]c1=S 175393659 MAGOACDUQYIINQ-UHFFFAOYSA-N 393.582 5.104 30 20 GKED COc1cccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 175946600 UEXLTYZAXNOPMC-BEFAXECRSA-N 376.481 5.189 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CNC1(c2ccccc2)CCCC1 183538827 MWZBLZZACUNNEH-GOSISDBHSA-N 393.556 5.078 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(Sc2ncccn2)cc1C)c1ccccc1 187393058 SJWSIJCKKDNTGB-IBGZPJMESA-N 375.497 5.235 30 20 GKED COc1cccc(F)c1[C@H](C)NCc1cccc(OCc2ccccc2C#N)c1 237291495 UOGMZPLRHOTHFU-KRWDZBQOSA-N 390.458 5.136 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1 237606154 GJGVQCQZMDLDRO-QZTJIDSGSA-N 390.458 5.760 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 303487711 KFYVOKHPYWKNQO-IRLDBZIGSA-N 396.918 5.672 30 20 GKED C[C@@]12CC3CC(/C(O)=N/[C@H]4CCN(C(O)=Nc5ccccc5)C4)(C1)C[C@](C)(C3)C2 328668861 DVWSLWLCUQMAJC-COOFZQEKSA-N 395.547 5.260 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c2[C@@H](C)C1 411024524 ZMPVTLLHMQOVLG-QWRGUYRKSA-N 375.444 5.065 30 20 GKED C=C(C)COc1cc(CNC23CCC(C(F)(F)F)(CC2)CC3)ccc1OC 425970742 IUMVPOZOVXYWDU-UHFFFAOYSA-N 383.454 5.395 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H]1CCCC(F)(F)C1 426092232 PZOBFKLGNMXSJK-INIZCTEOSA-N 385.414 5.358 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2F)cc1 431525990 RHXXTDXPYYSOCP-FQEVSTJZSA-N 383.442 5.525 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)N[C@H](CCCC#N)c3ccccc3)ccc2o1 433150298 LKRCGYBIYRMFOV-GOSISDBHSA-N 390.487 5.682 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccn2)cc1 438190563 ODJPCVAEGZLJLC-FCHUYYIVSA-N 398.466 5.178 30 20 GKED CCc1ccccc1CSCC(=O)Nc1ccccc1S[C@H](C)CC#N 438302275 HUGMQGBJKNCIMS-MRXNPFEDSA-N 384.570 5.515 30 20 GKED N#Cc1ccc(CNc2ccccc2COCc2ccccc2)c(OC(F)F)c1 439548894 IUYLICXACBZWTK-UHFFFAOYSA-N 394.421 5.489 30 20 GKED Cc1cc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)ccc1C#N 443981770 BAPPQVVLGYXPHH-UHFFFAOYSA-N 393.849 5.524 30 20 GKED FC(F)(F)CCCCN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444738754 DGNYBVQAVVLGQS-LBPRGKRZSA-N 381.282 6.021 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 446362573 JHSRPIINWBURPV-LDYMZIIASA-N 394.718 5.113 30 20 GKED CCSCc1ccccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 448342917 SSCBQOKURRLDOK-MRXNPFEDSA-N 379.312 5.241 30 20 GKED N#CCCC[C@H](NC(=O)N1CCn2cccc2[C@@H]1c1ccccc1)c1ccccc1 458806340 VZKVNIBVMMHNNR-UPVQGACJSA-N 398.510 5.038 30 20 GKED CN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 459020525 VZIYULCZWYNPEH-UDTPNQRGSA-N 393.453 5.065 30 20 GKED C=C(C)Cn1c(-c2ccoc2)nnc1N1CCC[C@@H]1c1nc2ccccc2s1 460396108 XBORDLINWJHOTD-QGZVFWFLSA-N 391.500 5.065 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cncc(C(F)(F)F)c3)o2)cc1 460878831 HBVZYNLVTZUHBJ-UHFFFAOYSA-N 393.390 5.008 30 20 GKED C=CCn1c(S[C@@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1ccc(F)cc1 463047885 IYLMLSYVJITOFX-ZDUSSCGKSA-N 384.436 5.032 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1CCC(c2ccccc2)CC1 463526994 IMILBGQZVOUXEM-UHFFFAOYSA-N 378.472 5.083 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1 470849054 PLVPEAHEMNMLJH-HXUWFJFHSA-N 397.503 5.339 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 471990928 ZFDAKYLIGYZGPE-FQEVSTJZSA-N 385.511 5.598 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)C[C@H](CC#N)c1ccccc1 475184489 RREPTXCKEGVPNR-HNNXBMFYSA-N 376.378 5.130 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccc(C)cc1)N(C)C 475560046 RGDYNYXUWIZHBB-JOCHJYFZSA-N 379.548 5.271 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1oc2ccccc2c1OC 475576445 WYHYIUWXQPWIKK-UHFFFAOYSA-N 378.472 5.615 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccccc2C)c2c1CCC2 476089603 KANYNDZAOGHKSH-UHFFFAOYSA-N 399.538 5.774 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(Cc2cccc(F)c2)CCC1 480538795 JAZTUKUBMQCRBW-INIZCTEOSA-N 397.519 5.364 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 481791326 CRZPFIXJIPTJIK-KRWDZBQOSA-N 382.529 5.353 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(-c4cnco4)c3)c2)cc1 483323846 JXVDDWJHVGTMPA-UHFFFAOYSA-N 381.391 5.258 30 20 GKED COc1ccc(CNc2cc(C)cc(Br)c2)cc1OCCCC#N 485733135 ZWBRDKOZLZAQIA-UHFFFAOYSA-N 389.293 5.061 30 20 GKED C=CCC[C@H](C(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1)c1ccccc1 489404296 OSOBGIOKBQCOPB-FQEVSTJZSA-N 397.465 5.136 30 20 GKED COc1ccc(-c2ccc(C(=O)N(CCC#N)CCC(C)C)c(F)c2)c(F)c1 500722688 SHQIGAZCCLCUPQ-UHFFFAOYSA-N 386.442 5.042 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4ccccc4s3)c2)cc1 501417368 CSSCNZFVHWHOST-UHFFFAOYSA-N 398.487 5.799 30 20 GKED N#CCCCOc1cccc(NC(=O)Cc2csc3ccc(Cl)cc23)c1 501853116 YGKAHIFZFCIPAU-UHFFFAOYSA-N 384.888 5.418 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)o1 505354176 UYRMVEFPFSLQQP-IWGBCORSSA-N 398.462 5.048 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N1CCC(C)(C#N)CC1 506743807 PFOMTBPBSLVVEP-UHFFFAOYSA-N 395.528 5.145 30 20 GKED CC1(C#N)CCN(Cc2ccc(-c3ccccc3Br)s2)CC1 507688737 CUCDKAGXONNXPK-UHFFFAOYSA-N 375.335 5.303 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1)c1ccccc1 510005015 ACYJKYSIUVXZQU-OAHLLOKOSA-N 375.859 5.637 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1cncc(Br)c1 510225749 ZEFUQUWXTITYCD-UHFFFAOYSA-N 382.286 5.070 30 20 GKED N#Cc1cnc(N[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)c(Cl)c1 514083256 KWPFLTZWRFNUCL-NRFANRHFSA-N 375.859 5.133 30 20 GKED C=CCN(C(=O)CC1CCCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514616799 HAOQUJIRKFGJIN-UHFFFAOYSA-N 385.489 5.208 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)cc2nc1C 517511419 KNRUKQUQGNIVKN-UHFFFAOYSA-N 394.434 5.163 30 20 GKED CC(C)c1ccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520813790 SUMQCORTTAJBOV-KRWDZBQOSA-N 398.597 6.076 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc([C@@H]4CCOC4)cc3)c2)cc1 521932812 KFJXYNIJVHFNTM-HXUWFJFHSA-N 383.451 5.058 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1SCCC#N)c1cccc(C(F)(F)F)c1 523086962 CZTCQVMOEXVGRO-AWEZNQCLSA-N 392.446 5.843 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)N[C@@H](c1ccccc1)C(F)(F)F 523766530 MWXCFZCZIYIPDW-ZDUSSCGKSA-N 380.263 5.270 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3cc(CC#N)ccn3)o2)cc1 532184778 AWRNHLCTBPDCEN-UHFFFAOYSA-N 394.434 5.030 30 20 GKED C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCCCC(C)(C)C#N 532412868 BETUWHOZPDPZMO-IYBDPMFKSA-N 375.944 5.485 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F)C1CC1 533596395 LEYLGCOFEFUHTF-JTQLQIEISA-N 391.846 5.150 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cncc3ccccc23)cc1 534756580 VPMCLIWLOSHJGD-UHFFFAOYSA-N 395.487 5.651 30 20 GKED COc1c(Cl)cccc1NC(=O)c1ccccc1Oc1ccccc1C#N 539754718 AQMDZZFDPLSJOS-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cnc2ccsc2c1 541175793 DWEGHWODKIMVFA-SJORKVTESA-N 383.520 6.247 30 20 GKED Cc1cc(C)c(NC(=O)CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)c1 542016533 AEHYBPBDKUEIIR-HXUWFJFHSA-N 397.522 5.440 30 20 GKED Cc1nc(-c2cccc(-c3noc(-c4ccc(C5(C#N)CC5)cc4)n3)c2)cs1 546398368 DASXLGRVDIPVSR-UHFFFAOYSA-N 384.464 5.391 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(Cl)c(F)cc1Cl 556432984 DVSCBTZDIJJUAP-RDTXWAMCSA-N 377.246 5.044 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C(C)C)oc3C)n2)cc1 560554089 RQNMRLPWLTXTRO-KRWDZBQOSA-N 380.469 5.334 30 20 GKED COc1cc(CN[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)ccc1C#N 581578390 ZVACSJJGAPJNTR-HNNXBMFYSA-N 377.513 5.158 30 20 GKED C=C(C)CN1CCC(NC(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)CC1 592302263 YMFGKZGDTWVDIP-LJQANCHMSA-N 397.588 5.061 30 20 GKED N#Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)cc1F 602755673 FHIXSGVRTYQQHY-HXUWFJFHSA-N 395.796 5.261 30 20 GKED N#CC1(C(=O)Nc2nc(C3CC3)c(Cc3ccccc3Cl)s2)CCCC1 608849472 AJXKPBZGAJNMMN-UHFFFAOYSA-N 385.920 5.287 30 20 GKED CCC[C@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccn1 609299497 ZWHBIDFTPIFQKZ-NRFANRHFSA-N 389.430 5.156 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 609556453 KUEFGKHLRCEIHT-UHFFFAOYSA-N 395.551 5.250 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C(C)(C)c1ccccc1 610177291 AYDBKZBLKVFAAS-JOCHJYFZSA-N 399.494 5.232 30 20 GKED C[C@@H](NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 610356650 XFOAGGZVAGNXGU-HXOBKFHXSA-N 387.458 5.042 30 20 GKED CC(C)(C#N)CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 611695666 ZWDVIPSBWYWEKA-NTCAYCPXSA-N 387.508 5.063 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1cc(F)c(C(F)(F)F)c(F)c1 622333118 LKAZWSBXRWUFKJ-UHFFFAOYSA-N 398.253 5.210 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cnc(-c3ccccc3Cl)s2)cc1 726940156 LELLDDVABLQULS-UHFFFAOYSA-N 381.888 5.332 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 730916775 AEHBBGBIOGSXHL-GOSISDBHSA-N 392.524 5.485 30 20 GKED C/C(=C\C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 731970840 HBCYIPJJAOEVMO-KOOLHJLFSA-N 397.334 5.255 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 732499437 QFROHFMQOYBFEC-PINLSGDHSA-N 398.409 5.507 30 20 GKED C[C@@H](Cc1ccccc1F)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 739157439 WLDLKHLVNBKZCL-GUYCJALGSA-N 398.890 5.658 30 20 GKED C=CCOc1ccc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc1Cl 741843426 GDTPZJLKLWVDDD-HWKANZROSA-N 379.268 5.164 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)NCCc2ccccc2)cc1F 743034651 ASEILJLITXZOIO-UHFFFAOYSA-N 391.471 5.019 30 20 GKED N#C[C@@H](C(=O)[C@@H]1Cc2ccccc21)c1nc(-c2ccc(Cl)cc2Cl)cs1 744035133 KMLVVPNRIRLCAU-CVEARBPZSA-N 399.302 5.633 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N(Cc2ccco2)c2ccccc2C#N)s1 744358236 HYQQBKBEAITETA-KHPPLWFESA-N 391.496 5.152 30 20 GKED Cc1ccc(/C=C/C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(Br)c1 747198506 XZCPCZXGVGEFPR-PSKZRQQASA-N 389.318 5.227 30 20 GKED COc1cc(C(=O)/C=C/c2cc(Cl)c3c(c2)OCCCO3)ccc1SC 747614286 ALYIUMHGBPBNLY-GQCTYLIASA-N 390.888 5.128 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3cc[nH]n3)s2)cc1 761533158 JFDHKTRLPINTJP-GOSISDBHSA-N 384.464 5.046 30 20 GKED C[C@H](NCc1nc(Cl)ccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 766894128 PCQSOIGARLFNQC-AWEZNQCLSA-N 382.294 5.778 30 20 GKED CCN(c1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1)C(C)C 767807164 VXXNHBYEKSZABO-UHFFFAOYSA-N 388.515 5.114 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 772982533 HLUFURZVZQRXDW-JXFKEZNVSA-N 391.540 5.650 30 20 GKED COc1ccc(COCc2cccc(N[C@H](C)c3ccc(C#N)c(F)c3)c2)cc1 777217413 YRLVUDGSWLCHCU-QGZVFWFLSA-N 390.458 5.596 30 20 GKED C[C@@H](Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(C#N)c(F)c1 777668356 TUUJKUFWNZYZSC-OAHLLOKOSA-N 377.488 5.495 30 20 GKED CC(C)n1cc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cn1 779595658 KTNJDPGGLHFOBH-UHFFFAOYSA-N 380.879 5.180 30 20 GKED Cc1nnc([C@H](C)OC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 783704481 VGMHSXCRXULSGU-NSHDSACASA-N 399.859 5.082 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792092848 SDDAXOQQHRCOLY-JOCHJYFZSA-N 384.479 5.417 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ccc(OC(F)(F)F)cc2)s1 797572421 ZJWCEKMLDQSEMS-CQSZACIVSA-N 396.434 5.148 30 20 GKED C[C@@H](Oc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1)C(F)(F)F 806608344 DJFHNLLUYUMICO-SNVBAGLBSA-N 399.825 5.350 30 20 GKED N#C[C@@H](C(=O)C12CC(C(F)(F)F)(C1)C2)c1nc(-c2ccc(Cl)cc2)cs1 810530945 DATNVAJCENFZRA-CDEQTRAXSA-N 396.821 5.372 30 20 GKED CCCCCCCCCCC(=O)N[C@H]1C[C@H](C)S(=O)(=O)c2sccc21 812382483 NPNVHQVWYXSESP-RDJZCZTQSA-N 385.595 5.002 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1nc(C2CC2)cs1 842942506 KIRRPEAOOQBFSI-XQQFMLRXSA-N 377.296 5.307 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)sc2[nH]1)C(=O)c1cc2c(s1)CCCC2 845835091 YGCAPKLNNCMOOL-NSHDSACASA-N 388.901 5.028 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CC3(C2)CC3(F)F)c1 847138282 BXOIFKMMRYDDKZ-UHFFFAOYSA-N 380.479 5.437 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2ccc(C(F)(F)F)nc2Cl)cc1 862380356 UXIOLKOPYJLQKC-ZDUSSCGKSA-N 382.813 5.007 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1sc2nc(C)nc(C)c2c1C 863967675 RQFPSWSOXFSUNU-UHFFFAOYSA-N 393.541 5.576 30 20 GKED Cc1ccc(OCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 915085333 KXTFMRPFMKPTOL-QHCPKHFHSA-N 384.479 5.367 30 20 GKED CN(CCCOc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915350499 WVYJINLRPKLOTF-DEOSSOPVSA-N 399.494 5.275 30 20 GKED Cc1csc([C@@H](C#N)C(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)n1 916843734 IANRPAJHLSHKRO-LYASGUKUSA-N 384.913 5.723 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(Cl)nc3)cc2Cl)cc1 917876572 MDWUIADOJRJJSE-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc1C 920105738 LLLWGUUUKSLSPH-IBGZPJMESA-N 390.508 5.167 30 20 GKED N#CCSc1ccccc1C(=O)Oc1ccc2ccc(C(F)(F)F)nc2c1 920799686 SVVLIHKCKADDDM-UHFFFAOYSA-N 388.370 5.088 30 20 GKED Cc1cc(CN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)c(C)s1 1653643633 VYOLZHNNSAJYCM-UHFFFAOYSA-N 388.496 5.025 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(-c2ccccc2F)s1 1776033381 VUFRLMVCAQOEHM-UHFFFAOYSA-N 388.851 5.742 30 20 GKED CC(C)c1c(Cl)ncnc1NN=Cc1ccc(-c2ccc(C(=O)O)cc2)cc1 1776056874 VRANCVQARSHLMH-UHFFFAOYSA-N 394.862 5.065 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=NNc2cccc(Cl)c2Cl)C1 1776081117 YRYICMYIZULQGC-UHFFFAOYSA-N 383.662 5.231 30 20 GKED C=CC1(CC(=O)N[C@@H](CC(=O)O)c2ccc(-c3ccccc3)cc2)CCCCC1 1776149702 POSXPAGDRAVZED-QFIPXVFZSA-N 391.511 5.512 30 20 GKED CC(C)[C@H]1/C(=C/c2cc(C(=O)O)ccc2Br)C(=O)c2ccccc21 1776308917 YPMQZTYOFHLYPG-CFINBHSISA-N 385.257 5.167 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1C 1776819030 DZWYMSBVIJROPC-WMZJFQQLSA-N 390.435 5.638 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)c1 1777461673 AQFPDIIRVAYJSQ-HWOXTHGCSA-N 386.447 5.410 30 20 GKED N#CCSc1nnc(-c2ccccc2Cl)n1-c1cccc(C(F)(F)F)c1 4246846 LNHRYAWFYLSTBJ-UHFFFAOYSA-N 394.809 5.222 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cnn1-c1ccc(F)cc1 25842102 YKFMHPSTYIIDPQ-UHFFFAOYSA-N 390.462 5.188 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 43788435 GSFODQVJPQAFMF-FOIQADDNSA-N 390.874 5.273 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(OC(F)F)c3)n2)cc1 46442775 GHKJQHQVUKRHJZ-INIZCTEOSA-N 384.407 5.210 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(F)F)cc1OC(F)F 57615577 OFPSOBHWZFFBSY-UHFFFAOYSA-N 398.356 5.110 30 20 GKED N#Cc1c(NC(=O)Cc2csc(-c3ccccc3Cl)n2)sc2c1CCC2 61046912 PIVDFRJHQFLAMK-UHFFFAOYSA-N 399.928 5.067 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)ccc1OCCC 63392314 ZAXKNZRTNBEJGF-UHFFFAOYSA-N 383.879 5.221 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cccc(C)c2C)cs1 114992116 NURZVEWWMVPENX-JLHYYAGUSA-N 390.508 5.649 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@@H](C)c1cccnc1 115764026 BVTSZMRLPQHDQH-KRWDZBQOSA-N 386.455 5.361 30 20 GKED O=C(c1ccc(-c2ccc(F)cc2)o1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117204003 OPIADSLQNWENOJ-UHFFFAOYSA-N 395.274 5.043 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc(-c2ccncc2)cs1 128875123 BFXDHTXCLUAMPA-IBGZPJMESA-N 389.480 5.017 30 20 GKED N#CCC[C@H](NC(=O)CCC(=O)c1csc2ccccc12)c1ccccc1 153432246 HCIOSBILIVRGCZ-IBGZPJMESA-N 376.481 5.025 30 20 GKED CCSCC[C@H](C)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 173261775 HJSJZMWHWWFPKJ-INIZCTEOSA-N 384.570 5.112 30 20 GKED C=CCOCCCC(=O)N(c1cccc(Cl)c1)c1nc2ccccc2s1 175046775 WMYHVNSCFKLDKD-UHFFFAOYSA-N 386.904 5.597 30 20 GKED CCc1ccc(C(=O)/C=C/c2csc(N(C(C)=O)c3ccc(C)cc3)n2)o1 176680154 CJLUWXAFMIQQHW-YRNVUSSQSA-N 380.469 5.188 30 20 GKED COc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1NC(C)=O 180220999 UEKALTFUUGGKKX-QGZVFWFLSA-N 399.494 5.043 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 184019509 VRUISEQHCLXUTI-HUUCEWRRSA-N 380.473 5.016 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 187310227 MWVXSAPNWPSTIK-JOCHJYFZSA-N 384.479 5.546 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccco1 191447673 LJRHTHXPNQTOGX-QUCCMNQESA-N 382.504 5.252 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccccc3SC)n2)cc1 193664094 VHIFCIMMSGVROT-INIZCTEOSA-N 380.494 5.031 30 20 GKED Fc1ccccc1-c1n[nH]c(=S)n1N=Cc1ccc(-c2ccccc2Cl)o1 254707339 WJRREYRQVPJVGN-UHFFFAOYSA-N 398.850 5.542 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1[nH]c2ccccc2c1Cl 329336615 LWGUHLFFSBAMRR-QGZVFWFLSA-N 382.895 5.515 30 20 GKED O/C(=N/[C@@H]1COc2ccc(Cl)cc21)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329476468 PKISVXCWNCELNI-HNAYVOBHSA-N 399.922 5.237 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 410973706 WPVNJZXEWVDDRP-HUUCEWRRSA-N 394.780 5.047 30 20 GKED COc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1Cc1ccccc1 429839655 KXQVNRDTZDPDGF-UHFFFAOYSA-N 388.492 5.154 30 20 GKED COc1cc(OC)c(NC(=O)c2sc3ccc(C#N)cc3c2C)cc1Cl 429908710 MQOJHTBFBIDJNK-UHFFFAOYSA-N 386.860 5.004 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2)cs1 430628684 NTHGHPUFLSMGMX-OAHLLOKOSA-N 381.526 5.363 30 20 GKED CCC[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431290649 NHASPJPCTBTSJO-RTWAWAEBSA-N 385.458 5.540 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)C1 433130357 HNOCERISGJOJQK-IEBWSBKVSA-N 379.529 5.350 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 439440029 PHEWANYUZWUWPN-HNNXBMFYSA-N 396.878 5.552 30 20 GKED CN(c1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1)C1CCCC1 439470429 DFHGDFJEAKHDKT-HXUWFJFHSA-N 376.504 5.232 30 20 GKED C=CCn1c(SCc2ccc(C(F)F)cc2)nnc1-c1ccc(OC)cc1 460676087 ZPDCUEOLYLMTCB-UHFFFAOYSA-N 387.455 5.370 30 20 GKED C=C(C)Cn1c(-c2ncccc2C)nnc1N1CCC[C@@H]1c1ccccc1Cl 460776866 DNJPSZHUQDDJGT-LJQANCHMSA-N 393.922 5.220 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(Br)ccc1Cl 462237272 ZNLOVTNPSKRWFP-LBPRGKRZSA-N 395.753 6.109 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F)C(F)(F)F 464068779 FKUFPZFNDCKOGJ-LURJTMIESA-N 381.288 5.200 30 20 GKED CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 469701176 DNHDZNYFEMFXIS-QUCCMNQESA-N 395.572 5.813 30 20 GKED Cc1ccccc1-c1nc(CNc2cccc(OCc3cccc(C#N)c3)c2)no1 471605741 NLTXICOIEHTDMA-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(Cc2ccccc2)n1 476086441 PZPAVPMGGNGKHY-UHFFFAOYSA-N 376.525 5.838 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)NCC#Cc2cccc(C(F)(F)F)c2)c1 481311218 DMBGECBWGDNRFP-QGZVFWFLSA-N 388.433 5.076 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 481791251 CEGPCWMBBPIOMV-SFHVURJKSA-N 382.529 5.495 30 20 GKED CC1(C)CN(C(=O)c2ccccc2-c2ccccc2C#N)CC[C@@H]1C(F)(F)F 482051220 FDVRDAMRRVASQO-IBGZPJMESA-N 386.417 5.276 30 20 GKED N#CCCC[C@H](NC(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccccc1 487547409 ZYBGXXSLZOHDEJ-IBGZPJMESA-N 393.487 5.038 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccccc1 488668549 CNMZLUBKNAWKAY-QFIPXVFZSA-N 376.500 5.001 30 20 GKED C[C@@](NC(=O)c1ccc(F)cc1C(F)(F)F)(c1ccccc1)C(F)(F)F 504547610 NWJXJGCHIPIMGZ-OAHLLOKOSA-N 379.275 5.052 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCC2(C3CC3)CCC2)cc1 505865881 ICABAIGHKOMOQJ-UHFFFAOYSA-N 376.525 5.161 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 506409132 XCTIFFXUCHPESS-OAQYLSRUSA-N 394.519 5.152 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508047258 ABNATZOBZDRCAW-UTKZUKDTSA-N 395.572 5.686 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1cc(C#N)ccc1Cl 510825978 KPZUCJHCFCLIKT-MRXNPFEDSA-N 390.870 5.912 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)cc1Cl 512977817 SLEREJLDZGLVFT-UHFFFAOYSA-N 394.308 5.231 30 20 GKED CC(C)N(Cc1cccc(F)c1)C(=O)Nc1ccccc1SC[C@H](C)C#N 517473771 SZFFHYYZEWJNMQ-MRXNPFEDSA-N 385.508 5.520 30 20 GKED N#CCN(C(=O)Cc1cccc(OCc2ccc(Cl)cc2)c1)c1ccccc1 517978776 ZRETYXJAXLARDW-UHFFFAOYSA-N 390.870 5.018 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(Cl)cc1Cl 518660439 XLYDARMMAWWPKD-ZDUSSCGKSA-N 393.339 5.816 30 20 GKED CC(C)c1ccc(OCCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521260448 DFCUPWJCQPUAHB-KRWDZBQOSA-N 397.544 5.262 30 20 GKED C=CC1CCN(C(=O)c2cc(-c3ccc(C)cc3)nc3c2cnn3C(C)C)CC1 521957598 MQTIZLKVQMLPTM-UHFFFAOYSA-N 388.515 5.026 30 20 GKED N#CC1(C(=O)Nc2ccc(OCC(F)(F)F)c(C(F)(F)F)c2)CCCCC1 522897600 SMIAILHVOKODHN-UHFFFAOYSA-N 394.315 5.059 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)n1cccc1 522899240 WVYUNAXGLCYELO-ZDUSSCGKSA-N 381.423 5.102 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccc3c[nH]nc23)c1 523898501 JQUYYPNWMUESAC-UHFFFAOYSA-N 388.814 5.133 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Nc1ccccc1SC[C@H](C)C#N 524565784 IVGOPPCOPOKKJY-KDOFPFPSSA-N 397.544 5.675 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CC=C(C(F)(F)F)CC2)cc1 533831434 GKMYPYRTRUCAAD-UHFFFAOYSA-N 388.414 5.044 30 20 GKED CC[C@H](C)[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 538188264 PYWDKRXEGBPKME-VBKZILBWSA-N 380.879 5.139 30 20 GKED Cc1sc([C@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 540708188 NHMIJDVIRRSTJN-STQMWFEESA-N 399.922 6.195 30 20 GKED N#CC1(C(=O)Nc2ccc3oc(SCc4ccccc4)nc3c2)CCCC1 552523069 UZYALDHLUVJTCR-UHFFFAOYSA-N 377.469 5.143 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1Cl)c1ccc(Cl)c(Cl)c1 553962572 XKPGOHBPHAQTPQ-DCGLDWPTSA-N 379.674 5.131 30 20 GKED CC(C)(CCC#N)CNC(=O)c1oc2ccccc2c1CSc1cccs1 554096882 QZLAYNDHIXQKOQ-UHFFFAOYSA-N 398.553 5.846 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccccc2OCc2ccccc2)no1)c1ccccc1 570550838 KBRSSRRLDDOQQE-NRFANRHFSA-N 395.462 5.556 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)NCC(C)(C)CCC#N)cc1F 579575980 FHIXYTQGTLUSDZ-UHFFFAOYSA-N 399.466 5.387 30 20 GKED CC(C)(C(=O)Nc1cc(Cl)ccc1Br)c1cc(F)cc(C#N)c1 584195777 QRVJXFFIDURJKC-UHFFFAOYSA-N 395.659 5.030 30 20 GKED C=C(CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccccc1 588775959 MODTXSGPTHQBKO-UHFFFAOYSA-N 384.504 5.294 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(C#N)n2)c(C(F)(F)F)c1 589762221 IRFYHQUMDHSOQM-LLVKDONJSA-N 379.407 5.115 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 590023889 YPORXXQYKVIDRQ-HNNXBMFYSA-N 380.419 5.086 30 20 GKED CCn1c(COc2ccc(C)cc2)nnc1S[C@H](C#N)c1ccc(Cl)cc1 594893034 NBXBFNGOTKLMQK-GOSISDBHSA-N 398.919 5.196 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 598838165 KKNQFAAZJQLJOW-KRWDZBQOSA-N 396.359 5.506 30 20 GKED Cc1ccc(CN2C(=O)c3ccccc3N[C@@H]2c2ccc(C3(C#N)CC3)cc2)cc1 602761551 SZYKYVSMCIHCHA-DEOSSOPVSA-N 393.490 5.317 30 20 GKED Fc1ccc2c(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)ccnc2c1 603493140 KIKPQUSPLOFDSK-UWVGGRQHSA-N 380.307 5.695 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)Nc2cccc(OCCCC#N)c2)s1 603969701 UFNGQDKMUIGTJK-UHFFFAOYSA-N 397.525 5.044 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc3c(c2)nc(C)n3-c2ccccc2)s1 604027605 LVRGVVNWPFZPMQ-UHFFFAOYSA-N 386.480 5.082 30 20 GKED N#CCc1ccc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)cc1 609425341 PJWTZIIACMPGEG-UHFFFAOYSA-N 379.419 5.327 30 20 GKED CC[C@@H](NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccncc1 610176939 OLZISEMOVVMQEM-HXUWFJFHSA-N 391.858 5.280 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC(c3cccnc3)CC2)cc1 611256025 FMEUHPDXVHJLLI-UHFFFAOYSA-N 399.519 5.124 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(-c3c(Cl)cccc3Cl)no2)cc1 614970132 XGYMYRQNAGXYRN-MRXNPFEDSA-N 385.254 5.257 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(-c3cccc(-c4cscn4)c3)no2)cc1 615133188 OSBPODNWGVEQNK-FQEVSTJZSA-N 399.479 5.073 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)CCc1ncc(-c2ccccc2Cl)o1 615971601 OZFYGCFCWFLVAJ-UHFFFAOYSA-N 398.865 5.282 30 20 GKED N#Cc1ccc(NC(=S)N[C@@H](c2ccc(Cl)cc2)C2CC2)cc1Cl 726445331 UVCXFQFHWYJFHT-QGZVFWFLSA-N 376.312 5.303 30 20 GKED N#CCOc1ccc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)cc1 727677928 YUXKMSHRWDXNPU-UHFFFAOYSA-N 391.279 5.040 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)/C=C/c2ccc3ccccc3n2)c1 728184974 BYFQZKAAYRGCTQ-CCEZHUSRSA-N 378.431 5.056 30 20 GKED CCN(C(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C)[C@H](C)c1ccc(C#N)cc1 728269469 NRCOGTAVZWVQCW-GOSISDBHSA-N 396.494 5.061 30 20 GKED N#Cc1c(NC(=O)c2ccc(-c3ccc(F)cc3)cc2F)sc2c1CCC2 729944743 ZCZNMFAIBOYNQH-UHFFFAOYSA-N 380.419 5.306 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1C[C@H]1c1cccc2ccccc12 730742070 SREOLIAOEXUXND-ROUUACIJSA-N 377.827 5.083 30 20 GKED C#CC[C@H](OC(=O)c1sc(-c2ccc(C)cc2C)nc1C)c1ccccn1 733692239 BURSNKMVICDFKU-IBGZPJMESA-N 376.481 5.052 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)NC(C1CC1)C1CC1 734755974 IZBGDGQSHQGNDL-UHFFFAOYSA-N 377.513 5.134 30 20 GKED Cc1nc(COC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cs1 734997518 UTBULYMAIXPOFK-UHFFFAOYSA-N 384.844 5.126 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@H](C)/N=C\c1cc(Br)ccc1O 735978746 KSEZKHOKACXWLF-OMZGXYFASA-N 382.685 5.003 30 20 GKED C=CCCCCCN(C)Cn1nc(-c2cc(C)ccc2C)c2ccccc2c1=O 739885642 POQVZOBUSXMBJD-UHFFFAOYSA-N 389.543 5.316 30 20 GKED Cn1cc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2ccccc21 743830679 UKWJVTUOPRHSQR-QHCPKHFHSA-N 379.463 5.015 30 20 GKED N#C[C@@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 744017086 YCXZKESTKASWMK-DNQXCXABSA-N 390.486 5.828 30 20 GKED N#C[C@H](C(=O)c1sccc1-c1ccc(F)cc1)c1nc2ccccc2s1 744936899 YLLYEEYVYGXGSX-OAHLLOKOSA-N 378.453 5.654 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1Cl)C1CCCC1)c1ccncc1 745826952 ZENBUROWWAYARY-NRFANRHFSA-N 383.923 5.507 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCc2nc3cc(Cl)ccc3s2)n1 747198524 YKAJRCWERZORMS-GFCCVEGCSA-N 389.933 5.339 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3cccs3)s2)ccc1OC(F)F 751513671 SFGYDLVIIAVEIU-WAYWQWQTSA-N 393.436 5.378 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2ncnc3oc(-c4ccccc4)cc23)c1 752634885 KTRTXIIOFIMJDS-SFHVURJKSA-N 384.439 5.183 30 20 GKED COc1ccc(/C=C2\CCc3c(Cl)cccc3C2=O)cc1OCCCC#N 758041522 ZOGDXVQGKSANNX-DTQAZKPQSA-N 381.859 5.244 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)cc1 767869215 JOFGFJVDPTZCCC-LJQANCHMSA-N 398.359 5.752 30 20 GKED C[C@H](Nc1ccc(CC[C@@H](O)c2ccccc2)cc1)c1ccc(OCC#N)cc1 777676017 SEAVOBVWXCEXLN-UQBPGWFLSA-N 386.495 5.428 30 20 GKED Cc1ccc(/C=C/C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 779472156 SKDWPFFTMNEBLY-ZRFOIIEFSA-N 387.870 5.351 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 781770250 KZTSFTSXIKJPMV-IACUBPJLSA-N 396.434 5.087 30 20 GKED O=[N+]([O-])c1c(F)cccc1NN=Cc1sc(Oc2ccccc2)nc1Cl 790309183 XYYUSVFLLNJKKD-UHFFFAOYSA-N 392.799 5.082 30 20 GKED CSc1cc(O)ccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 792732968 ONTFVXITRDJIDW-LJQANCHMSA-N 389.480 5.414 30 20 GKED CCCN(C(=O)c1ccc(C)c(C#N)c1)[C@@H](c1ccc(F)cc1)c1cccnc1 799339221 KBBBFXHRGRVXMP-QHCPKHFHSA-N 387.458 5.043 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@](F)(c3ccccc3)C2)cc1 801611036 AFXMMKCSUDQMPM-UKILVPOCSA-N 399.469 5.445 30 20 GKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C1/S/C(=N/C2CCCC2)NC1=O 806570381 YAXRFHQFVSQHCC-VOANPMSRSA-N 380.435 5.154 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1sc(-c2ccccc2)nc1C 814801128 BDDDEWCQIWPGPQ-UHFFFAOYSA-N 376.407 5.368 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1sc(-c2ccc(F)cc2)nc1C 814853243 HZYUQOFWSKSZMF-UHFFFAOYSA-N 394.397 5.508 30 20 GKED COc1ccccc1C1(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)CCCCC1 815900050 MRSNMFYTYUVCBL-IBGZPJMESA-N 384.479 5.322 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 835110045 MIEIWIZHVBJYKR-ZJUUUORDSA-N 388.361 5.243 30 20 GKED O=C(Nc1cccc(C=NOCc2ccccc2)c1)c1ccc(Cl)cc1Cl 839419788 MABMNEFSKLQVTN-UHFFFAOYSA-N 399.277 5.796 30 20 GKED Cc1cc(NC(=O)c2ccc(C3(C#N)CC3)cc2)ccc1NC(=O)OC(C)(C)C 856372572 MOOQPCCBHQVJEO-UHFFFAOYSA-N 391.471 5.150 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)[C@@H](C)Cc1ccc(C#N)cc1 862718461 DKGINPBMHJYPJV-HNNXBMFYSA-N 393.487 5.031 30 20 GKED C=C(C)C[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 904034121 ZCVBBUBQFPURLM-QGZVFWFLSA-N 377.843 5.089 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc(-c3ccc(OCc4ccccc4)cc3)no2)c1 904424262 WUEGNASKTDFKIS-XZOQPEGZSA-N 393.446 5.458 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)s1 915353600 PFHXRJRGOOUGIO-ZHRRBRCNSA-N 389.524 5.903 30 20 GKED CCCCOc1ccc(-c2nnc(CON=Cc3ccc(Cl)cc3)o2)cc1 917395552 QCCHJVNOIBJBPK-UHFFFAOYSA-N 385.851 5.120 30 20 GKED Cc1cc(N=Cc2cc(Cl)cc([N+](=O)[O-])c2O)ccc1Oc1cccnc1 920176997 BZEKTVXUWIZECJ-UHFFFAOYSA-N 383.791 5.200 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776114745 ZOHCPDGIXRXCHG-JCMHNJIXSA-N 398.458 5.966 30 20 GKED O=C(/C=C\c1ccc(-n2cnc(C(=O)O)c2)cc1)c1ccc(-c2ccccc2)cc1 1776131408 QCICKHHKMAZCBZ-NVNXTCNLSA-N 394.430 5.134 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(CC2CCC2)c1 1776355380 FRIPSUHITRHTTP-PKNBQFBNSA-N 378.468 5.411 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C\C(=O)c1cc(C(=O)O)ccc1O 1776365018 JCARQGSAZPGLCJ-CLFYSBASSA-N 376.861 5.140 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)oc2ccccc12 1776956366 VIXRQCNJWQYKIF-QBFSEMIESA-N 386.403 5.850 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C1\C[C@@H](C(=O)O)c2ccccc2C1=O 1777260630 NGTGDLHFRIRAKM-OOIVEFLKSA-N 384.431 5.200 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CSc2cccc(C(F)(F)F)c2)cc1 11435894 ARAINSVYKAJYIM-UHFFFAOYSA-N 378.419 5.053 30 20 GKED Cc1ccccc1CCNC(=O)c1ccccc1SCc1ccc(C#N)cc1 18832557 DMVSSROBOMSQFO-UHFFFAOYSA-N 386.520 5.132 30 20 GKED N#C[C@H](C(=O)c1ccccc1C(=O)c1ccccc1)c1nc2ccccc2s1 39776280 IXJFKICHKHAGJF-GOSISDBHSA-N 382.444 5.017 30 20 GKED COc1ccc(CNCCc2c(Cl)cccc2Cl)cc1OCCCC#N 64614260 YUKXDDRBDYYHIP-UHFFFAOYSA-N 393.314 5.017 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc3cc(OC)ccc3c2)cc1OC 72067724 IDZZQKSRTGCMRN-IZZDOVSWSA-N 392.451 5.160 30 20 GKED N#C[C@@H](C(=O)[C@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1)c1ccccn1 107408751 FGKNHEGWIMZJNK-IIBYNOLFSA-N 397.261 5.385 30 20 GKED COc1ccc(CC[C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108528686 NFEOJDQOSSICMK-SJORKVTESA-N 397.544 5.090 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(OC(F)F)c1 113570571 FPBOWXKWUMBOAW-LBPRGKRZSA-N 377.416 5.326 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Sc2nnc(C)s2)cc1C)c1ccccc1 125121925 NJIIARXNRVEOFG-INIZCTEOSA-N 395.553 5.605 30 20 GKED CC[C@H](C)N/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1cccc(C)c1 154484994 DIUOQUHSAFLDDV-HNNXBMFYSA-O 397.589 5.133 30 20 GKED CC(C)CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H]1CCCc2cccnc21 154944490 XYWCSJHFRVLHHH-OAQYLSRUSA-N 390.531 5.450 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1cccs1 155830602 VSLLDAWFEDXDFM-UHFFFAOYSA-N 386.527 5.201 30 20 GKED N#Cc1c(NC(=O)c2ncoc2-c2ccccc2Cl)sc2c1CCCC2 172678654 SHOLREXQLJJKSO-UHFFFAOYSA-N 383.860 5.059 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2ncccc2Cl)cc1Cl 179976632 FKUPLUJGRNEQOW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(O[C@H](C)c2ccccc2)cc1 191224696 GUIUEZAQCWBRSN-ZWKOTPCHSA-N 386.451 5.370 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2ccc3cc(C#N)ccc3n2)cn1 301988786 WNOCRGUHVCZGIR-UHFFFAOYSA-N 396.450 5.305 30 20 GKED COc1ccccc1[C@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccccn1 302195376 OHDMSMYKTBBVLL-FQEVSTJZSA-N 383.373 5.182 30 20 GKED COc1ccccc1[C@H]1CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 303170509 ISMRVDXVVYEOSM-HSZRJFAPSA-N 398.462 5.336 30 20 GKED OC1=Nc2cc(F)ccc2[C@@H](/C(O)=N/C2[C@H]3CC[C@H]2Cc2ccccc2C3)C1 329444157 KODHNSFOCGRKAT-BXWFABGCSA-N 378.447 5.051 30 20 GKED OC(=Nc1ccc2c(c1)oc1ccccc12)N1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 329781013 NAKVWROLESLYIA-FPOVZHCZSA-N 376.456 5.165 30 20 GKED Cc1ccc(-c2nc(C)sc2C/C(O)=N/[C@H]2CCOC3(CCCC3)C2)cc1 330216987 NOBZPJOHSYECLV-SFHVURJKSA-N 384.545 5.418 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1 410158028 OCEYSTNTNDJUCL-OAHLLOKOSA-N 389.421 5.260 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC[C@@H]2CCCCC)cc1 426105544 JLBOJUOJMAWPFU-NRFANRHFSA-N 383.536 5.077 30 20 GKED CCCOc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1Cl 432908416 WFOGHERBRKBZMR-LJQANCHMSA-N 385.895 5.685 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1c(CC)cc(C)cc1CC 435176874 JMBPPKVIMAXYFE-UHFFFAOYSA-N 381.476 5.248 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1cccc(OC(F)F)c1 435913203 HNCRRCFFXVSZDJ-HNNXBMFYSA-N 397.425 5.037 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437459789 KGGAXFYNKRXADH-IBGZPJMESA-N 382.435 5.166 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 437657377 QQXSIEOZBHRYSM-DHIUTWEWSA-N 389.543 6.237 30 20 GKED CCc1c(NC(=O)N[C@H](CCCC#N)c2ccccc2)cnn1C(CC)CC 455279546 MAPCPYNLWJIDQT-LJQANCHMSA-N 381.524 5.363 30 20 GKED CCN(C(=O)NCc1ccc(C#N)c(F)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 455537244 IZQVKISPBAWMRU-ZDUSSCGKSA-N 393.384 5.009 30 20 GKED C[C@@H]1CCN(C(=O)Nc2cccc(CC#N)c2)[C@H]1c1ccc(C(F)(F)F)cc1 455907118 OVGXLAASRDTOSJ-AUUYWEPGSA-N 387.405 5.386 30 20 GKED CC[C@@H](CC(F)F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457750610 MGBJVEODXFVHAB-CABZTGNLSA-N 391.302 5.497 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2NCc2ccc(Cl)cc2)cc1 462837069 BJIPNTPMAMOROT-UHFFFAOYSA-N 389.886 5.395 30 20 GKED C[C@H](NC(=O)NCc1cc(C#N)ccc1F)c1ccccc1Oc1ccccc1 465797204 KFDGDDTVVNCARQ-INIZCTEOSA-N 389.430 5.050 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2cc(C#N)ccc2OC(C)C)s1 481520594 MDWWWLKUDTZUCW-UHFFFAOYSA-N 391.496 5.338 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2c(C(=O)c3ccco3)oc3ccccc23)cc1 483106482 ULPKSPJRHFHGNE-UHFFFAOYSA-N 398.418 5.310 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)CCCCOc1cccc(C#N)c1 485660794 FCFGDPOBHJUTTC-XMMPIXPASA-N 378.516 5.272 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)s1 487260280 HWNDXHUJMXYOPZ-UHFFFAOYSA-N 379.441 5.288 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(N2CCCC2=O)ccc1Cl)c1ccccc1 488626726 ISGHZXTVIGHWFJ-GOSISDBHSA-N 382.891 5.155 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(Cl)ccc2OC2CCCC2)c1 494248650 SXWLJAHWHUCZMM-UHFFFAOYSA-N 386.904 5.529 30 20 GKED COc1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1Cc1ccccc1 505364301 OFMBGUDRRUVMAW-KRWDZBQOSA-N 385.467 5.040 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1/C=C/c1ccccc1 506641499 FKUFEBMLCUYDHZ-JQBOOCOKSA-N 391.540 5.791 30 20 GKED C[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc(Cl)cn1 507157319 XVXORTKKWBLQON-CQSZACIVSA-N 393.899 5.249 30 20 GKED Cc1ccc(Cc2cnc(NC(=O)c3cc(C#N)ccc3Cl)s2)cc1C 507660555 NTZYEQZRDBHFDW-UHFFFAOYSA-N 381.888 5.128 30 20 GKED CC(=O)N(c1nc(CSc2ccc(C#N)cc2)cs1)c1ccccc1F 509639506 MEBHQCFUCWRWTL-UHFFFAOYSA-N 383.473 5.131 30 20 GKED N#CC1(CCCN(Cc2ccccc2C(F)(F)F)CC2CC2)CCOCC1 511146003 XOJLHZWAJYPWJW-UHFFFAOYSA-N 380.454 5.018 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)c(F)c1 511708192 QMUPNQTYCBRRTA-SFHVURJKSA-N 390.311 5.023 30 20 GKED COc1ccc(COCc2cccc(N[C@H](C)c3ccc(C#N)cc3F)c2)cc1 512283548 QMKZNVMTDKLEDF-QGZVFWFLSA-N 390.458 5.596 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)s1 512545813 XHCIIQSSVFMRKH-QWHCGFSZSA-N 393.965 5.926 30 20 GKED C=CCN(C(=O)C(C)(C)Oc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 514650145 VQNPCLKNNYQKOL-UHFFFAOYSA-N 396.487 5.326 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Sc1nc2cc(Cl)ccc2o1 515178896 YTMLTXOMKIUQRM-LBPRGKRZSA-N 392.933 5.238 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)n1cccc1 520498243 YBBSMUFRHDPWJB-UZLBHIALSA-N 377.875 5.387 30 20 GKED CCc1cccc(CC)c1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 524492930 UBMZAXHTHVFLDT-UHFFFAOYSA-N 384.479 5.514 30 20 GKED CCn1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1C 524706645 BTYGLWQRRZVMTR-IBGZPJMESA-N 392.890 5.081 30 20 GKED N#Cc1ccc(CN[C@H](c2cccc(F)c2)c2cccc(Br)c2)cc1 531836005 CFNLKKJAADAYTN-NRFANRHFSA-N 395.275 5.339 30 20 GKED C[C@H](C1CC1)N(C(=O)c1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 540735283 CORXWFSYTRJGRL-OAHLLOKOSA-N 398.428 5.706 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccn1Cc1cccs1 551820118 JQVXYCOKODGYCU-UHFFFAOYSA-N 376.934 5.141 30 20 GKED C[C@@H]1c2nnc(C3CCCC3)n2CCN1Cc1ccc(-c2ccccc2C#N)cc1 553954354 PLLRVCPTYMTKAQ-GOSISDBHSA-N 397.526 5.051 30 20 GKED Cc1cn(C2CCCCC2)[nH]c1=NC(=O)Nc1ccccc1SC[C@@H](C)C#N 555814541 JNAPCNSPMBESBL-HNNXBMFYSA-N 397.548 5.014 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)c1nc(C2(c3cccc(C(F)(F)F)c3)CC2)no1 580635234 ZEFHGGDZSOCJMD-ZDUSSCGKSA-N 399.372 5.180 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(C(F)F)cc1 588025571 IZBGWETWRYNMDJ-QWRGUYRKSA-N 389.286 5.264 30 20 GKED COc1ccc(/C=C(/C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1F 588438341 JHALGWNYFVKOSW-QTNMRXCUSA-N 384.476 5.128 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 588952542 RPRZRUZQYQBEFD-UZUQRXQVSA-N 385.511 5.092 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCc3cccnc32)cc1Cl 589830566 XCLCVZPQNBXKBM-VQTJNVASSA-N 387.870 5.059 30 20 GKED CC(F)(F)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 589981283 CJSSKOCYDOZRBB-UHFFFAOYSA-N 379.366 5.110 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)CC3(C#N)CC3)c2)cc1 590301159 YIELVEKXUIMGKG-SFHVURJKSA-N 376.500 5.354 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F 590327638 FQSSDXVBBCRWBL-UHFFFAOYSA-N 394.290 5.527 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2cccc(C#Cc3ccccc3)c2)s1 592897414 IOPUWIZDEMAVMF-QGZVFWFLSA-N 389.524 5.385 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 596693688 BBRAQUAGLGAMGJ-FQEVSTJZSA-N 389.499 5.152 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4ccccc4F)o3)cn2)c1 603624299 ZOBCSYBXYLDJTG-UHFFFAOYSA-N 399.381 5.397 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cccc(Oc3ccccc3)c2)c1 609067559 BXCZTUKIPNNOTL-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3ccnn3-c3ccc(C#N)cc3)sc2c1 609580971 HIEUYZULDVLOLK-UHFFFAOYSA-N 392.871 5.173 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)CC1 609772748 IJDUAMOOSVLQBL-LJQANCHMSA-N 391.515 5.490 30 20 GKED COc1ccc2sc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c(C)c2c1 610227935 XYAOOISMWDQRLA-ZDUSSCGKSA-N 396.537 5.722 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CC[C@@H]2c2cccc(F)c2)cc1 610305178 KKVXZIKUQSBOQX-OAQYLSRUSA-N 390.389 5.216 30 20 GKED N#C[C@H](NC(=O)c1ccccc1SCc1ccco1)c1ccc(Cl)cc1 611251918 NDQXCWMOQWGNCI-SFHVURJKSA-N 382.872 5.220 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)s1 647379152 FVIRJUWPTDKCBR-HNNXBMFYSA-N 379.510 5.251 30 20 GKED C[C@@H](NCc1ccc(CN)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 650752997 DOERZQBFIFMCPO-SNVBAGLBSA-N 394.334 5.173 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)c1Br 682993783 ANZQANMJXDWWLS-KRWDZBQOSA-N 379.257 5.104 30 20 GKED CCOc1cc(/C=C/C(=O)c2sc(-c3ccc(OC)cc3)nc2C)ccc1O 727973953 CGWFHUGSDBRSLT-WUXMJOGZSA-N 395.480 5.128 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCc3ccc(F)cc32)cc1 730131380 LNAWBXXTEKHHMJ-GOTSBHOMSA-N 385.442 5.290 30 20 GKED C/C=C\c1ccc(OC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(OC)c1 732494283 DBNRCEUGOHNPLR-ARJAWSKDSA-N 386.407 5.006 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1)c1ccncc1 734681088 XZNOWYOYQPQKDZ-LJQANCHMSA-N 390.314 5.380 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3ccccc3C)n2)cc1 734965049 GHULWFJAQBYEOF-OXQOHEQNSA-N 390.508 5.497 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1ncc(C(F)(F)F)cc1Cl 735232243 KEANROAOBNTLJU-UHFFFAOYSA-N 393.217 5.602 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)cc1 736955095 FAGMBFZCNSFSGL-GOTSBHOMSA-N 399.494 6.084 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@@H](c3ccccc3C)C[C@H]2C)c1=S 738054312 NMCXKOPVXSCVAS-MSOLQXFVSA-N 394.544 5.004 30 20 GKED c1ccc(C2CCC(=NNc3nc(-c4ccccn4)nc4c3CCC4)CC2)cc1 741813534 SGCOISDMUQHFPN-UHFFFAOYSA-N 383.499 5.153 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(Cl)ccc2OC2CCCC2)c1 742709756 PKAFESKCCWNHJC-HXUWFJFHSA-N 398.934 5.632 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)CC/C1=C\c1cccc([N+](=O)[O-])c1 743056067 BTAJWIPILGWFFX-KLCVKJMQSA-N 399.406 5.007 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](CC2CC2)c2ccccc2)cc1 743097992 ZCXVPWVYUPIDHC-JWQCQUIFSA-N 395.506 6.005 30 20 GKED N#CCC1(COC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)CC1 744276552 AAKOWSVHKVOMGI-UHFFFAOYSA-N 377.227 5.031 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1ccc(OC(F)F)cc1 745694959 MZQFGVQMPZVDAN-UHFFFAOYSA-N 389.471 5.015 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1 747111406 JIKJVTYPXQGMDG-DYVFJYSZSA-N 397.544 5.224 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C/c2cccc(OC3CCCC3)c2)n1 747197351 YDFIKQMCVMFYBX-GNISGLHKSA-N 380.513 5.478 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)N(C)c2ccc(C#N)cc2)cc1 749151474 VFEVASCQUYYOQT-UHFFFAOYSA-N 383.455 5.316 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H]2Cc2ccccc2)cc1 752186736 SXVJHFWXJKJTRH-DNQXCXABSA-N 381.479 5.191 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1OC(F)F 753389078 AJWFPVXWIDBCSY-BHEFUSTPSA-N 378.378 5.116 30 20 GKED CC(=NNc1ccc(C(F)(F)F)nn1)c1ccc(Cl)c(C(F)(F)F)c1 754709030 LJCKXVWBQGWNEV-UHFFFAOYSA-N 382.695 5.004 30 20 GKED CC(C)C[C@@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccn1 761381458 FHPXNGRFCMQXEB-OAQYLSRUSA-N 387.439 5.085 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@@H]1CCC(F)(F)C1 763842844 SXHRRUVDWFRBTA-YYRQZUAOSA-N 387.270 5.041 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccccc2)c2ccncc2)cc1 765337754 UAFZTKKUUNLVRE-MBSDFSHPSA-N 378.903 5.653 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)Cc2c(C)oc3ccccc23)cc1 767958464 FWJJDEFUFGXZJN-QVKFZJNVSA-N 388.467 5.145 30 20 GKED C=CCn1c(C)nn(CN2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)c1=S 768905293 WAPWTCSLIXQVPL-QGZVFWFLSA-N 396.482 5.112 30 20 GKED C[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1cccc(-c2ccccc2)c1 777117620 NPXBJYYPRYPMPT-LJQANCHMSA-N 397.522 5.359 30 20 GKED C#CCOc1cccc(Cl)c1CNc1cccc(C[S@](=O)C(C)(C)C)c1 778173487 JDNKWGZOUGNMOO-SANMLTNESA-N 389.948 5.011 30 20 GKED C[C@H]1C[C@@H]1[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)cc1 780667867 NTYZARWEGNFYBC-AMVBQIFNSA-N 383.879 5.150 30 20 GKED CC(C)Cc1nc(C#N)c(NN=C2CC(c3ccc(C(F)(F)F)cc3)C2)o1 781587551 GENSBPSXUXTXBF-UHFFFAOYSA-N 376.382 5.109 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccsc3)cc2Cl)c1 790314407 MHTDKKNHLLQSPO-UHFFFAOYSA-N 399.928 5.661 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(Br)cc1C(F)(F)F 793068337 WBUCLLACWRJYMJ-LLVKDONJSA-N 399.210 5.371 30 20 GKED COc1cccc(C2(C(=O)[C@@H](C#N)c3nc(-c4ccc(C)cc4)cs3)CC2)c1 796799324 STKMCOSTXYXBIT-LJQANCHMSA-N 388.492 5.035 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1cc(N2CCOCC2)ccc1C 797685968 CATVMWYZFVZJDM-UHFFFAOYSA-N 375.557 5.046 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)s1 802250309 QNXLCEUWCGTYII-GXTWGEPZSA-N 384.398 5.346 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccccc1SCC(F)(F)F 806181699 HGUYFRBAVDIPQT-UHFFFAOYSA-N 378.419 5.008 30 20 GKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)n1-c1ccc(C#N)cc1 817319847 SYPFCGPFNNFLIF-DEOSSOPVSA-N 396.494 5.131 30 20 GKED COc1cc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)ccc1SC(F)F 841762958 SOZNCTCPNUYFQE-UGSOOPFHSA-N 388.483 5.610 30 20 GKED N#C[C@@H](C(=O)CSCc1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842942430 OTEVGQRHHPCSHQ-ZDUSSCGKSA-N 397.352 5.437 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2cccnc2)cc1 915351964 FAOAQWZMCCAXPM-GOTSBHOMSA-N 382.467 5.106 30 20 GKED COc1ccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 915656180 HGDHGPCRIVYWCU-NRFANRHFSA-N 390.870 5.185 30 20 GKED CC(C)(C)c1ccc(C=NOCc2cccc(C(=O)NCc3ccco3)c2)cc1 917623364 ZCWXHWMNGWKXKG-UHFFFAOYSA-N 390.483 5.058 30 20 GKED CCCCS[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 918492985 YKEMFMFHJQHABZ-JQWIXIFHSA-N 386.464 5.413 30 20 GKED C=CCOc1cccc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c1 920013531 YGERQCGFJMAMSW-UHFFFAOYSA-N 392.069 5.512 30 20 GKED O=C(O)c1cccc2c(C=NNc3c(Cl)cc(Cl)cc3Cl)c[nH]c12 1776014765 XOYTXRWZDXOMJJ-UHFFFAOYSA-N 382.634 5.272 30 20 GKED CC(C)(C)CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Cl)cc1 1776033408 CMVJGBXPZFKWSQ-UHFFFAOYSA-N 379.287 5.944 30 20 GKED CC(=NNc1nc2ccccc2cc1C)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776052750 OAAXHUJVVZXHCM-UHFFFAOYSA-N 385.423 5.338 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc2c(c1)Nc1ccccc1S2 1776086390 RLYZPBOGJMOGEV-UHFFFAOYSA-N 389.480 5.738 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776327495 YYSWJVYHIFJMIT-UXBLZVDNSA-N 377.440 5.187 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2nc3cc(C(=O)O)ccc3o2)cc1 1776785478 DKEUPHQRXQPCDE-GDNBJRDFSA-N 393.483 6.436 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)o1 1777316279 OPTDLPRZHHVDTC-YFHOEESVSA-N 382.799 5.203 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)CC3CCC(C)(C)CC3)CCC2)cc1 1791593402 QBMLZKFFNQQUPW-UHFFFAOYSA-N 382.548 5.303 30 20 GKED O=C(Nc1ccc(F)cc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 15010366 YALOQMNXXRYKOW-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1cccc(C)c1 21991282 OLMNGPXUJBBTGU-UHFFFAOYSA-N 378.526 5.342 30 20 GKED C=CCn1c(SCC(=O)c2ccc(C(C)(C)C)cc2)nnc1-c1ccoc1C 36807387 NJMCWILUCMVAEC-UHFFFAOYSA-N 395.528 5.305 30 20 GKED CN(Cc1ccncc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 56750735 WRASIBOUHJXMCI-UHFFFAOYSA-N 392.846 5.063 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)NC3(C#N)CCCCC3)cc12 60855473 KRHJJWXHMGMLGX-UHFFFAOYSA-N 398.919 5.005 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1sccc1SC(F)F 66801319 WACJGRLJBSPVBW-SNVBAGLBSA-N 384.498 5.709 30 20 GKED CC[C@@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1c(C)noc1C 104417987 KMKGYAPTZZIVSI-HXUWFJFHSA-N 375.428 5.088 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 118444520 BLWHPDIGNFQMDR-JKSUJKDBSA-N 395.553 5.243 30 20 GKED N#C[C@@H](C(=O)c1sccc1Br)c1nc2cc(Cl)ccc2s1 120034634 XFJHUGVAJNBGHC-QMMMGPOBSA-N 397.706 5.264 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1C)[C@H](c1ccc(Cl)cc1)c1ccccn1 122734064 CGSRZRVMEQUQIT-JOCHJYFZSA-N 389.886 5.167 30 20 GKED C=CC[C@H](C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1)c1ccccc1 188774146 ZCUCRDSCYWKJQQ-LPHOPBHVSA-N 385.891 5.054 30 20 GKED CCOc1ccc(O)c(C=Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)c1 255513649 JFDOBPZLZARRSN-UHFFFAOYSA-N 384.819 5.040 30 20 GKED N#CCCCCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 264027706 CCXIUXWODUVJNE-UHFFFAOYSA-N 376.287 5.029 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 303232815 YJFXMFDCPWPGIV-IBGZPJMESA-N 399.494 5.637 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@]4(CC=CCC4)C3)c2)c1 303638633 GYSCOWLAWSPCNY-RUZDIDTESA-N 386.495 5.100 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCC[C@@H]1[C@@H]1CCCC[C@H]1O 328851188 WQDCWBVSCXFUJF-BHDDXSALSA-N 398.547 5.011 30 20 GKED OC(=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)[C@H]1C[C@@]12CCOC2 329633859 WUUFKMHJSCYHAK-JLCFBVMHSA-N 393.512 5.185 30 20 GKED OC(CN1CCCCCC1)=Nc1cccc(N=C(O)[C@H]2CCC(F)(F)C2)c1 330043410 HFJBAWQJYXPDJS-HNNXBMFYSA-N 379.451 5.174 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(OCCCC#N)c1 409838130 UUSPUYRVEUTRLT-CQSZACIVSA-N 391.298 5.493 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)c1cc(C(F)(F)F)ccc1F 410413386 JKMKEEHJSSTGIH-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CC(C)(C)Oc2ccccc21 412092095 QJFQFBDXTBGZGG-WBVHZDCISA-N 380.513 5.364 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425660400 XGFFOJLKVRBNMX-JKSUJKDBSA-N 378.501 5.035 30 20 GKED N#Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c(Cl)c1 430362037 RZRNGSYHOPYSTC-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#CCCC[C@@H](NS(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1 431637182 RREORMWSRUZSIE-HSZRJFAPSA-N 390.508 5.067 30 20 GKED CC1CCN(c2cccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2)CC1 432953784 CRPHGJVDTOKENV-HSZRJFAPSA-N 390.531 5.480 30 20 GKED CCCN(CC(C)(C)O)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 435111975 UOCUVNOPUQNLIT-LJQANCHMSA-N 399.922 5.010 30 20 GKED COc1ccc(CC(C)(C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 446161713 NHTHHHYZAUVRCG-MRXNPFEDSA-N 397.544 5.090 30 20 GKED C[C@H](c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1)C(F)(F)F 453780846 QBMSXRJVUODFLM-RISCZKNCSA-N 380.435 5.596 30 20 GKED COc1cc(NC(=O)Nc2ccc(CC#N)cc2Cl)cc(OC)c1C(C)C 455707457 RLTFZMQKHNQBFC-UHFFFAOYSA-N 387.867 5.191 30 20 GKED C[C@H](CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)c1ccccc1F 456579176 QCJJKSBWGOXUFO-IFUGULHKSA-N 385.323 5.051 30 20 GKED C[C@H]1C[C@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCO1 456897196 KASWJTRXWMIFPN-UONOGXRCSA-N 386.904 5.116 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccccc1 458794235 AOZHHIMSTAZFCZ-NRFANRHFSA-N 393.512 5.488 30 20 GKED CC1(C)CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C[C@@H]1c1ccccc1 458804825 SZSIBEOGDYOBPF-YADHBBJMSA-N 375.516 5.257 30 20 GKED COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458835767 KHWOYHJYFJRIGS-SFTDATJTSA-N 399.922 5.104 30 20 GKED C=C(C)COc1cccc(NC(=O)[C@@H](C)c2ccc(Br)s2)c1 463556626 JYMOPOKDKXYHQX-LBPRGKRZSA-N 380.307 5.208 30 20 GKED Cc1ccccc1-c1noc([C@H](C)Sc2nc3c(cc2C#N)CCCC3)n1 466633256 MJLDDPRMCDGQGZ-AWEZNQCLSA-N 376.485 5.044 30 20 GKED Cc1ccccc1-c1nc(CNc2cccc(Oc3ccc(C#N)cc3)c2)no1 471670399 ZHZASLCLXKESLF-UHFFFAOYSA-N 382.423 5.321 30 20 GKED COc1cc(C)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1F 475849715 CEFXTJYPQPFMHL-UHFFFAOYSA-N 376.387 5.059 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](C)C(F)(F)F 477973719 YUPURGKQZGBVPH-SSDOTTSWSA-N 381.238 5.137 30 20 GKED CC(C)C[C@H](NC(=O)CNc1ccccc1SCCC#N)c1ccccc1 487361148 GQJGAEARYKCXOC-FQEVSTJZSA-N 381.545 5.008 30 20 GKED CC(C)Sc1cc(Br)ccc1CNCc1cccc(C#N)c1 503572800 HRSBOKFYAYOOMJ-UHFFFAOYSA-N 375.335 5.111 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc(-c3ccco3)s2)cc1 504334146 IOVVPSGXZINJQA-UHFFFAOYSA-N 387.420 5.319 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 505337943 MQCXDOLCWZUNFE-OAHLLOKOSA-N 379.312 5.489 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1 506581565 YZCSOZWAMMAKRY-ZDUSSCGKSA-N 396.903 5.526 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(-c2ccncc2)cc1 507612726 HUMMUVSAEQVBFR-LSCLNCKRSA-N 381.523 5.803 30 20 GKED C=C(C)COc1cc(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)ccc1OC 507822882 JUMWGHRMZFZUDC-SFHVURJKSA-N 397.412 5.573 30 20 GKED CC1(C#N)CCN(C(=O)c2ccccc2Oc2cccc(Br)c2)CC1 507839505 WFRODGICNAWRRB-UHFFFAOYSA-N 399.288 5.007 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@H](c2ccccc2)C(C)C)cc1 510508996 SNTZWIFGZGHLSD-QFIPXVFZSA-N 391.515 5.020 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1nc(C(C)C)oc1C 510812281 IYHJTYKUBRPWQS-UHFFFAOYSA-N 389.455 5.118 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1OCC 513687325 QKZHZGBAMHTSNL-MRXNPFEDSA-N 394.496 5.364 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)cc2c1 515577907 ZKTDLCKYBACDJV-UHFFFAOYSA-N 395.462 5.374 30 20 GKED C[C@@H]1c2c(sc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c2C#N)CC[C@H]1C 517316976 SQRFCGJXWGYKTF-WWGRRREGSA-N 378.497 5.004 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccccc2F)s1 517874864 MUSATKJRVDVKLN-UHFFFAOYSA-N 393.487 5.119 30 20 GKED COC(=O)c1sc2ccccc2c1CNc1ccccc1SCCC#N 518659625 ZEDAUAJEBXBKFH-UHFFFAOYSA-N 382.510 5.306 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)Nc1ccccc1S[C@H](C)CC#N 518739007 JTHLHSSZVUHSEN-KGLIPLIRSA-N 390.961 5.854 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 519125260 BIPVJWZCEFDVFV-UHFFFAOYSA-N 390.464 5.322 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Sc2cc(F)ccc2F)c2ccccc2)cc1 519325802 GGGMZEWYRXPBLM-NRFANRHFSA-N 394.446 5.503 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520601526 WRLGIFSKUNPSCX-OAHLLOKOSA-N 377.469 5.165 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520941721 YEGARGSPWSWMBY-UHFFFAOYSA-N 393.393 5.293 30 20 GKED CCCCN(C)c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 521326956 KNANCBOURKVZAQ-KRWDZBQOSA-N 381.545 5.569 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCCC2)c1)c1nc2ccccc2s1 523458712 VXJUNEKVEBFCPC-GOSISDBHSA-N 376.481 5.498 30 20 GKED N#Cc1ccsc1C(=O)Nc1nc(C2CC2)c(Cc2ccccc2Cl)s1 524160298 QVOCFBQTMOFAEW-UHFFFAOYSA-N 399.928 5.450 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1)C1(C#N)CCC1 525289837 QGNVUROYNIKHTC-UHFFFAOYSA-N 375.255 5.304 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(N3CCc4ccccc4C3)cc2)c(Cl)c1 532698965 SUPSAIAUXKOUNF-UHFFFAOYSA-N 387.870 5.027 30 20 GKED Cc1cc(C#N)ccc1C(=O)N(c1ccccc1)c1ncccc1Br 539172534 KHUJKXDPZRPZRN-UHFFFAOYSA-N 392.256 5.003 30 20 GKED COc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)c(Br)c1 539628099 ZCYHBUYGAYTOFI-AWEZNQCLSA-N 389.293 5.313 30 20 GKED N#Cc1c(Cl)cccc1SCc1nc(O)c2c(-c3ccco3)csc2n1 541172866 IKCKPOCWTTWMQV-UHFFFAOYSA-N 399.884 5.474 30 20 GKED N#Cc1ccccc1-c1ccc(CSCc2cc3ccccc3nc2O)cc1 562065106 XWMINXYSGSLYDL-UHFFFAOYSA-N 382.488 5.912 30 20 GKED COCCc1ccc(Oc2ccc(NC(=O)NCC(C)(C)CCC#N)cc2)cc1 572433167 KYKFXZMFEXLCHK-UHFFFAOYSA-N 395.503 5.119 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c2[C@H](C)C1 576005632 QXYTYLRASDDSFV-CHWSQXEVSA-N 377.469 5.213 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)CCCCCC#N 588158761 IPXCVNHCCLNGIN-UHFFFAOYSA-N 378.451 5.100 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccc3oc(CO)cc3c2)cc1 590607989 JMFRDIIUBMJUHZ-UHFFFAOYSA-N 399.406 5.233 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)oc2ccc(Cl)cc12 592975817 TVZFOZZAHCAOBW-ZDUSSCGKSA-N 384.819 5.634 30 20 GKED CCOc1ccc(NC(=O)c2ccc(N[C@@H](C)c3cccc(C#N)c3)cc2)cc1 600848700 HTUSTTCJFKNPMT-KRWDZBQOSA-N 385.467 5.382 30 20 GKED N#Cc1ccc(SCC(=O)Nc2nc(-c3cccc(Cl)c3)cs2)cc1 603918265 NJHIMMYPYQQSRU-UHFFFAOYSA-N 385.901 5.066 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1OCC1CC1 606985921 NAFMSRRYMIDRHQ-UHFFFAOYSA-N 390.936 5.088 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 608820318 BSTUPNIXXWCMGI-INIZCTEOSA-N 376.378 5.166 30 20 GKED COc1cc([C@H](C)Nc2ncc(C#N)cc2Cl)ccc1OCc1ccccc1 608886006 KDUCNXWWDMVQOX-HNNXBMFYSA-N 393.874 5.367 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 609080339 HLGOWDOSGJTOAS-MOPGFXCFSA-N 399.494 5.889 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(F)c(Cl)c1 609398580 CDNBFOUPWMVPJC-GFCCVEGCSA-N 377.872 5.053 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 609401918 JYMLTCTUGHOKRM-WMZOPIPTSA-N 397.544 5.610 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)[C@@H]1CCCN1c1ccc(C#N)cc1 610234284 JRQXESBYYCYBSV-QFIPXVFZSA-N 393.556 5.116 30 20 GKED CSc1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)ccn1 611231229 MZEDUZYOSSYXNT-UHFFFAOYSA-N 377.494 5.079 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)c(C(F)(F)F)c1 612303391 GDTZAASBMMTUHI-ACJLOTCBSA-N 399.482 5.754 30 20 GKED C=CC[C@@H]1CCN(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)C1 626291105 UQTDKRWGBUFLLH-QGZVFWFLSA-N 378.476 5.069 30 20 GKED C#Cc1cccc(NC(=S)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1 726439119 KLXFGGXGUMKEMN-QFIPXVFZSA-N 395.531 5.268 30 20 GKED CCOc1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)C(C)C)cc1 726484424 MAUWDRXTTZNYKZ-UHFFFAOYSA-N 387.936 5.218 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2NC(=O)c2cccs2)c1 727401956 VGFAOXIPYWMXSK-UHFFFAOYSA-N 392.480 5.208 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2cnc(-c3ccccn3)s2)cc1 727891802 YBJXUFDAKKDLJH-UHFFFAOYSA-N 397.459 5.101 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1ccc2ccccc2n1 727952844 TUOJHGKHHHNACY-QKWZMAAQSA-N 382.463 5.446 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 728287512 FGOVCWRUTAQKTE-ICCXJUOJSA-N 393.293 5.829 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)cc1 728696421 QZNYQBPSAVNZPY-QHVUTBCBSA-N 383.447 5.453 30 20 GKED CCCCCCCCCn1cc(C#N)c(=O)c2cc(Br)ccc21 728705342 UMHHBIXOCFWXIM-UHFFFAOYSA-N 375.310 5.386 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1-n1cccc1 730996322 XVBWRBZEMIOMIO-INIZCTEOSA-N 375.497 5.290 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1N=Cc1cc(Br)ccc1O 732528956 HSVQEPITXKGSCP-UHFFFAOYSA-N 389.293 5.198 30 20 GKED CSc1ccc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 733083466 JTEULORSUHDCDM-JXMROGBWSA-N 382.466 5.336 30 20 GKED CC(C)(C)c1cnc(COC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)o1 733490918 OWDVKNVFQIRBGO-UHFFFAOYSA-N 394.402 5.132 30 20 GKED Cc1nc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cs1 733679448 IIYQELOOIHRVTM-HNNXBMFYSA-N 387.917 5.038 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=S)Nc2c(C)cc(C)cc2Cl)c1 733755611 WMVNIUGJDOZLFI-MRXNPFEDSA-N 387.936 5.124 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 733801768 WZRJLSCYTUJSNQ-VQIMIIECSA-N 397.544 5.040 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(Oc3ccncc3)c(Cl)c2)c1 733932032 KRBDFUONTNVQLS-UHFFFAOYSA-N 376.843 5.175 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3c(F)cccc3F)n2)cc1 734964856 DOZMYGPCWRTTDB-ARFHVFGLSA-N 394.446 5.377 30 20 GKED O=[S@@](Cc1cccc(N=Cc2cc(Cl)ccc2O)c1)C1CCCCC1 734979652 SNFOIVVPQUUCMD-VWLOTQADSA-N 375.921 5.378 30 20 GKED C#CCOc1ccc(F)cc1NC(=S)Nc1c(Cl)ccc(C)c1Cl 741508532 LPWCIJWQDFMGLR-UHFFFAOYSA-N 383.275 5.262 30 20 GKED O=C(/C=C/c1cnc2ccc(Cl)cn12)c1ccc(SCC(F)F)cc1 741842070 JQOOEBNJDONYDJ-QPJJXVBHSA-N 378.831 5.241 30 20 GKED CC(C)[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(C(F)(F)F)cc1 748562321 FJSWETIAVGGZQQ-GOSISDBHSA-N 391.393 5.127 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cnc(Cl)c4ccccc34)n2)c1 766841798 HOSKLTPOBFHKQQ-UHFFFAOYSA-N 390.855 5.136 30 20 GKED O=C1/C(=C\c2ccc(F)nc2)CC(c2ccccc2)C/C1=C/c1ccc(F)nc1 777463352 BIWMSXSZRKMBLY-JTMCVSSMSA-N 388.417 5.369 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccc([N+](=O)[O-])cc1Cl 782189622 UOPRJCFCWDUWPN-XQRVVYSFSA-N 376.846 5.329 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)nc1 783299433 CCOLTSWLHLSPPF-HXUWFJFHSA-N 399.828 5.087 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cc4c(C)nn(C)c4s3)s2)cc1 806577205 RNGMSEULPZENNL-CMDGGOBGSA-N 379.510 5.271 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCSc2cccc(Cl)c2)s1 809006714 INCGPTCCKYZWEQ-CQSZACIVSA-N 378.950 5.453 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1ccc(C#N)cn1)CC(C)(C)O2 811862006 AOJIFXXHXQCKOL-KRWDZBQOSA-N 394.475 5.015 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1cc(C(F)(F)F)ccn1 813215795 BTUQQJYLIPHOQE-QRVBRYPASA-N 380.369 5.234 30 20 GKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1O 815636081 OGCYBEAAVVXSGE-OALUTQOASA-N 376.422 5.887 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@]4(C3)CC4(F)F)cc2)cc1 844522308 MKURTUNAQFWKHZ-HXUWFJFHSA-N 383.398 5.004 30 20 GKED CC(C)(c1ccc(C(=O)[C@@H](C#N)C(=O)C2(c3ccccc3)CC2)cc1)C(F)(F)F 845845132 MNXKNRBBZKKHLK-GOSISDBHSA-N 399.412 5.150 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(Cl)nc(C3CC3)c2)cc1 847626954 VIQTVPJESYXKDR-SCLBCKFNSA-N 395.890 5.087 30 20 GKED N#CCCCC[C@@H](N)c1nc(-c2ccc(Nc3ccc(Cl)cc3)cc2)no1 848624336 AISPKDIBKKXQRF-GOSISDBHSA-N 381.867 5.217 30 20 GKED Cc1cc(NC(=O)c2cc(C#N)ccc2Cl)ccc1NC(=O)OC(C)(C)C 856372580 NHXNRIOSVHWUJX-UHFFFAOYSA-N 385.851 5.119 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ocnc1C(F)F 860577931 PKSVZMBMSUPXTH-JTQLQIEISA-N 389.198 5.091 30 20 GKED N#Cc1c(F)cccc1CNc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 864020884 BXDGXVRDCMOJNX-UHFFFAOYSA-N 393.167 5.557 30 20 GKED O=C(/C=C\c1ccc2ncccc2c1)c1ccc(OC(F)F)cc1OC(F)F 916140188 FIILNBCPEZAKEZ-YWEYNIOJSA-N 391.320 5.334 30 20 GKED CCOc1ccccc1CCC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916974224 HEDIOUCHUJTSKS-LJQANCHMSA-N 390.508 5.326 30 20 GKED Cc1cccc(C)c1OCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 916977664 VYCPUPLCJKQTDU-KRWDZBQOSA-N 396.899 5.336 30 20 GKED C[C@H](Cc1ccco1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 918052729 LWBAGBRXEXWXPY-CQSZACIVSA-N 395.846 5.350 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(OCc3ccccc3Cl)cc2)cc1 918067165 GCRPTCLSIXXHRM-UHFFFAOYSA-N 391.858 5.112 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc2c(c1)Cc1ccccc1-2 920103883 GFMRXTDAMOOFET-JOCHJYFZSA-N 390.442 5.253 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)o2)cc1 1776125261 BMZMGYPRPWXBJC-MUSGIIIZSA-N 384.472 5.778 30 20 GKED CC(C)(C#N)c1ccc(/C=C/c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)cc1 1776230893 OVYPKASLPVNNOV-LFYBBSHMSA-N 392.455 5.619 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)C2(C)CCCCC2)cc1 1776788216 RKMIXHOIKFBTPG-NRFANRHFSA-N 375.553 5.549 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4cccc(CC(=O)O)c4)cc3)coc12 1777449035 GWFXGNRBYGVWBN-RAXLEYEMSA-N 396.442 5.931 30 20 GKED O=c1c2ccccc2n(C/C(O)=N/c2ccccc2C(F)(F)F)c2ccccc12 34859955 SSGHGFUKWCQONA-UHFFFAOYSA-N 396.368 5.462 30 20 GKED N#C[C@H](C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nc2ccccc2o1 54734009 AROQFGRIRMPBOD-QGZVFWFLSA-N 399.362 5.018 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@@H]2CCCc3ccccc32)cc1 55823849 GQGZIFDHKSPGED-XMMPIXPASA-N 396.490 5.390 30 20 GKED COc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 60477477 BPCVMQWQVKJODL-MRXNPFEDSA-N 382.872 5.271 30 20 GKED Cc1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 63641516 SCRWPZNXCWYSGQ-GOSISDBHSA-N 385.467 5.407 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1 66953939 BABHABUMMQQMCU-GJZGRUSLSA-N 387.936 5.959 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 66954886 FHOJITLFTRQVGG-GHTZIAJQSA-N 393.556 6.067 30 20 GKED N#Cc1cccc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)c1 70785343 GTNNNSHVKNOHTK-UHFFFAOYSA-N 396.277 5.103 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)c1ccc(COc2ccccc2C#N)o1 108333257 FBKSUZDSTHSBFN-OAQYLSRUSA-N 386.451 5.016 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc(Cl)ccc1Br 112879061 PNEXQKXTHQIYGX-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2nccs2)cc1 123360461 JCECQKKFYFRCNT-UZLBHIALSA-N 384.932 5.715 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1Cl 123933690 AJVCURRSCFEDOD-INIZCTEOSA-N 382.876 5.190 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2cnc(C3CCCC3)s2)SC1=S 128448291 RVVVXTYABCCCTF-SXGWCWSVSA-N 397.550 5.078 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccccc1 156959608 PIOVURFMEDDWHW-JOCHJYFZSA-N 392.462 5.072 30 20 GKED C[C@H](CCC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 160175795 XPJQNWTXOZCRCG-CZUORRHYSA-N 389.282 5.225 30 20 GKED N#C[C@@H](C(=O)c1cccc(COc2cccc(F)c2)c1)c1nc2ccccc2o1 172086863 YCJCWUPZYGNYJS-IBGZPJMESA-N 386.382 5.036 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@H](C#N)c3nc(C(C)C)cs3)cs2)cc1 177744183 JWNAJLZYCAMDGJ-INIZCTEOSA-N 381.526 5.117 30 20 GKED COCCC1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCCCC1 187129551 IJJHDFWQFWGZRP-KRWDZBQOSA-N 389.565 5.189 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3o2)oc2ccc(Br)cc12 193282162 OYDGAYNIJTWTEU-ZDUSSCGKSA-N 395.212 5.135 30 20 GKED O=C(CNc1cccc(C#Cc2ccccc2)c1)Nc1ccccc1C(F)(F)F 195673355 NGYOOFWXQLVQBY-UHFFFAOYSA-N 394.396 5.156 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)n1 246675952 UWLPUPWKWIJTRA-PWRODBHTSA-N 388.492 5.011 30 20 GKED N#Cc1ccc(C(F)(F)F)c(NCc2ccc(OCc3ccccn3)cc2)c1 302257858 ZYULGRVRECPRBC-UHFFFAOYSA-N 383.373 5.163 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(-n2ccnc2)c1 303655419 GBQKPPZLJUUDFG-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccccc3OCC3CC3)c2)cc1 303836542 MISPVVXSVYGBAH-UHFFFAOYSA-N 398.462 5.178 30 20 GKED Cc1ccccc1N=C(O)[C@@H](C)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 329227548 ADAUSTWNXCSBNW-MJGOQNOKSA-N 395.551 5.017 30 20 GKED COc1ccc2c(c1N=C(O)[C@@H]1CCn3c(cnc3C3CCCCC3)C1)CCC2 330084952 CLMHSUCIWZWGAZ-GOSISDBHSA-N 393.531 5.279 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@H](C#N)CCc1ccccc1 433301806 GNWXQKMNXLIVMW-JXFKEZNVSA-N 389.524 5.068 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(Br)c(Cl)c1 436093979 WQYDMZFHSKTMEH-HXUWFJFHSA-N 376.747 5.071 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437459790 KGGAXFYNKRXADH-LJQANCHMSA-N 382.435 5.166 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC4(CCCCC4)C3)cc2)c1 438065321 IIRWVKVKWNNRQC-UHFFFAOYSA-N 375.472 5.539 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 438652960 PXZRAAFOBIYEIA-UHFFFAOYSA-N 378.501 5.129 30 20 GKED N#CCC[C@H](NC(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccccc1 439674111 OYWOJXOSUBPPNN-NRFANRHFSA-N 375.859 5.177 30 20 GKED COc1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc(OC)c1C(C)C 455112882 SCPVJWUNLSJMAV-IBGZPJMESA-N 395.503 5.384 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)CC1 460769542 OTDBNBXMRBZPAU-PWGQDJSOSA-N 380.319 5.074 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)[C@H](C)c2cccc(C#N)c2)cc1 463817040 VOLORQGXDHDLIU-CLOONOSVSA-N 397.522 5.257 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(-c2ccc(C)cc2)nc2onc(C)c12 464461286 NVQLLANAABRQMD-UHFFFAOYSA-N 390.487 5.051 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1ncccc1OCCCC#N 466613641 HSGRRJVIYMAVDE-UHFFFAOYSA-N 396.491 5.032 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)C[C@@H](CC#N)c3ccccc3)oc12 474293801 RXSXJRXZOKHNFC-FUHWJXTLSA-N 376.456 5.096 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1 474944841 JSLKAXAFRMLUFL-UHFFFAOYSA-N 389.286 5.213 30 20 GKED C=C(C)[C@H](NCc1cc(Br)c(OC)s1)c1ccc(F)c(F)c1 479410489 PKUKDKILLYJMFQ-HNNXBMFYSA-N 388.277 5.204 30 20 GKED CN(C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1cc(Cl)ccc1C#N 479577674 WUKBCSOCWLACNB-NFAYLAGKSA-N 396.840 5.323 30 20 GKED C=CCn1c(SCc2nc(-c3ccccc3)oc2C)nnc1-c1cccs1 481369058 HBGPYLORZFPWKT-UHFFFAOYSA-N 394.525 5.448 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(COc2ccccc2OC)o1 482832047 ZZECUZAVDJHYDS-UHFFFAOYSA-N 383.488 5.076 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1cccc(C(F)(F)F)c1 492750033 OZUFPHHWELXYIG-LLVKDONJSA-N 383.211 5.190 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1c(F)cccc1Cl 498624336 RHWOUYJMLBEYFG-OAHLLOKOSA-N 392.906 5.105 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(c4cc(F)cc(C#N)c4)CC3)cc2)cc1 508172694 DYUTZCZYOCFPNV-UHFFFAOYSA-N 397.409 5.032 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 510858636 XGJNLPZLNAKWTQ-UHFFFAOYSA-N 385.467 5.631 30 20 GKED N#Cc1cc([N+](=O)[O-])ccc1N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 511401005 XUWABXOKDVNXMK-QGZVFWFLSA-N 394.431 5.219 30 20 GKED CC(C)c1nc2ccccc2n1Cc1noc(-c2ccc(C(C)(C)C#N)cc2)n1 515092360 LFSQTKBYKTZBFC-UHFFFAOYSA-N 385.471 5.059 30 20 GKED N#CCc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 515703837 BZXQODWWCRKQGK-PKTZIBPZSA-N 382.463 5.074 30 20 GKED N#CCCSc1ccccc1NC(=O)CSc1ccc2ccccc2c1 518648473 IUYOXQOHRMJLIP-UHFFFAOYSA-N 378.522 5.576 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(COc3ccccc3C#N)o2)CC1 523828500 SAACEBXGTZOPBL-GOSISDBHSA-N 380.488 5.019 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H]1CCCC[C@@H]1C 524442603 SYTSHAGQBOAJNR-SBUREZEXSA-N 391.515 5.488 30 20 GKED N#CCc1cccc(C(=O)N(c2cc3c(cc2Cl)OCO3)C2CCCCC2)c1 535517145 WLRRSMHVRXQNHL-UHFFFAOYSA-N 396.874 5.114 30 20 GKED COc1cc(Cl)c(C)cc1NCc1cn(CCC#N)nc1-c1ccccc1 535854779 MIXMQSLIMPSGRD-UHFFFAOYSA-N 380.879 5.046 30 20 GKED CCCCc1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 541036701 WAJYDQQYOPQNNW-QFIPXVFZSA-N 395.572 5.515 30 20 GKED N#Cc1ccc(CN(C(=O)c2cc(-c3ccccn3)ccc2Cl)C2CC2)cc1 542296792 YVAJEYNOENNHHD-UHFFFAOYSA-N 387.870 5.078 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N1CCC(CC#N)CC1 543827900 LDFAKXNEFAMDQM-UHFFFAOYSA-N 386.293 5.068 30 20 GKED CCOc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543875357 XISZCJYVRNLASY-GOSISDBHSA-N 386.495 5.483 30 20 GKED FC(F)(F)c1cc([C@@H](NCc2ccon2)C(F)(F)F)cc(C(F)(F)F)c1 543980971 VZEVBOYBUQAXFB-LLVKDONJSA-N 392.221 5.105 30 20 GKED C[C@H](CCNC(=O)c1cc(C#N)ccc1Cl)c1cccc(C(F)(F)F)c1 552299932 RFMDFKSPILAIBA-GFCCVEGCSA-N 380.797 5.154 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)[C@H](C)Cc3cncc4ccccc34)c2C#N)C1 565266441 NUHANJJGFQMUEB-LSDHHAIUSA-N 389.524 5.110 30 20 GKED C[C@H]1CCc2onc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)c2C1 577582994 PUZFDCCTMLEWBC-XHDPSFHLSA-N 397.887 5.066 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccc(C#N)cc3)c3cnn(C(C)C)c3n2)cc1 590612769 DDWBIBZTMBFQAU-UHFFFAOYSA-N 395.466 5.112 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21 599737670 OTEXAHJNKDRFTP-BMZRXHPRSA-N 397.931 5.052 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)oc2ccc(F)cc12 603624159 SVFMRWGMINQQFW-UHFFFAOYSA-N 387.370 5.192 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)nc1)c1nc(-c2ccccc2)cs1 603627829 YGCDOLMSPMWXNJ-IBGZPJMESA-N 397.459 5.487 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](C)c1ccccc1F 608846978 ANBRNBKCQAGUAY-OAHLLOKOSA-N 389.430 5.325 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3c3cccs3)cc2)cc1 609497435 UPJHLNPDGJHDJX-NRFANRHFSA-N 388.492 5.584 30 20 GKED N#C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C1CCCCC1 609648417 FLYAGXOHYZTJHF-IBGZPJMESA-N 394.569 5.619 30 20 GKED COc1ccc(C)cc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609722558 NDWBDCRUNUTLRW-UHFFFAOYSA-N 392.842 5.573 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3cccc(CC#N)c3)s2)cc1 610050822 LDMCUFHPDVPQLQ-QGZVFWFLSA-N 389.524 5.326 30 20 GKED Cc1cccc2c(N3CCC(c4nc5ccccc5s4)CC3)c(C#N)cnc12 610211293 KPBXFOPUWRECDP-UHFFFAOYSA-N 384.508 5.409 30 20 GKED C=CCn1c(S[C@H](C)C(=O)CC)nc2sc(-c3ccccc3)c(C)c2c1=O 613979521 VBMPOHBMTNJBMC-CQSZACIVSA-N 398.553 5.079 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(Cc2ccccc2F)CC1 619127200 UQJPSVYKALKHIB-UHFFFAOYSA-N 399.350 5.318 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc3ccc(F)cc3s2)cc1 619209910 YJOPJEXWCWKZQS-UHFFFAOYSA-N 394.471 5.107 30 20 GKED N#C[C@H](C(=O)c1cc(OCc2ccccc2)cs1)c1nc(C2CC2)cs1 626467237 KINKMLJNRWQDJE-MRXNPFEDSA-N 380.494 5.151 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccccc2-c2nncn2C(C)C)CCCC1(C)C 683557774 ZNFCKPFYBHROBH-LJQANCHMSA-N 381.524 5.125 30 20 GKED O=C(/C(=C\C1=Cc2ccccc2OC1)c1nc2ccccc2s1)c1ccccc1 726742720 WYOJCENXFNAXFY-HMMYKYKNSA-N 395.483 6.039 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(O)c(F)c2)cc1OCc1ccccc1 728438216 CEFJQDXRHJSAGZ-YFHOEESVSA-N 378.399 5.015 30 20 GKED C#Cc1cccc(N(C)C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)c1 728481650 HYTQHVDRHIORQY-UHFFFAOYSA-N 387.291 5.375 30 20 GKED O=C(/C(=C/c1cccnc1Cl)c1ccccc1)c1nc2ccccc2s1 728700289 NLWBQBYCRIEMPL-DTQAZKPQSA-N 376.868 5.768 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3\Cc4c(C)cccc4C3=O)c2)cc1 729149697 GGNWQHIFWSDPME-CPNJWEJPSA-N 383.447 5.078 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1cc(Cl)cc(Cl)c1 730955090 UAVBEOTZOBJIEO-LLVKDONJSA-N 396.368 6.054 30 20 GKED N#C[C@@H](C(=O)/C=C/C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 735593377 KOTHSCSGAQMYDU-APHAIJBRSA-N 388.467 5.263 30 20 GKED C[C@H]1C[C@H]1c1ccc(CNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 740037554 YPYCSUGQEREETM-IFXJQAMLSA-N 391.496 5.003 30 20 GKED CCC[C@]1(C)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 743093515 VOXNSRLWUIWJFR-ISKFKSNPSA-N 375.516 5.776 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1nc2ccc(SC(F)F)cc2s1 749060689 PJXNLWRHQOMIEY-UHFFFAOYSA-N 375.425 5.043 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2cccc(Cl)c2Cl)cc1C#N 752154746 KYBMYTHJKPHUJB-UHFFFAOYSA-N 393.230 5.077 30 20 GKED Cc1csc([C@@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 755755740 IZGLKPUVYLJERR-MGPUTAFESA-N 390.512 5.032 30 20 GKED N#Cc1ccccc1NC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 762258627 HFQRZKHOEVXCFC-AATRIKPKSA-N 384.279 5.248 30 20 GKED O=C(/C=C\c1cccc(Cl)c1Cl)c1cc(Br)ncc1F 762425314 VTXMTEHFCYKXOE-PLNGDYQASA-N 375.024 5.186 30 20 GKED CCc1noc(C)c1C(C)=NNc1nc(C)nc2sc(-c3ccccc3)cc12 769797009 CRYGHFKWOFLXTE-UHFFFAOYSA-N 391.500 5.362 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](C#N)CCc1ccccc1 774091635 VBXNVRSMRLYXFJ-OFNKIYASSA-N 398.506 5.255 30 20 GKED C[C@@H](N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 777655664 HPPRIFLSXCDFBZ-ZHRRBRCNSA-N 391.515 5.633 30 20 GKED N#Cc1cc([N+](=O)[O-])ccc1N1CCC(c2nc3cc(Cl)ccc3s2)CC1 796560466 XWTKDRQUUXVTIB-UHFFFAOYSA-N 398.875 5.114 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(Cl)c2ncccc12 802043173 SFNSEKZZMYULQQ-SFHVURJKSA-N 399.837 5.003 30 20 GKED C[C@H](O)c1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)ccc1F 804799900 KKYLJKBQTIGCPA-AWEZNQCLSA-N 392.455 5.154 30 20 GKED CC(C)(CCC#N)CNC(=O)c1sc2cc(Br)ccc2c1Cl 805280447 IHQCJILIQXZYKQ-UHFFFAOYSA-N 399.741 5.377 30 20 GKED N#CCCCCCC(=O)O[C@H](c1cccnc1)c1cccc(C(F)(F)F)c1 805902035 GQSCCOQZFQKORU-IBGZPJMESA-N 376.378 5.207 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(OC(F)F)c(Br)c2)co1 806558156 UOOJKTQCWPPVII-HYXAFXHYSA-N 386.192 5.058 30 20 GKED COc1ccc2cc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)ccc2c1 806613092 MDOLBVZLNXUGNM-UHFFFAOYSA-N 383.451 5.041 30 20 GKED CC(C)(C)Sc1ccc(-c2noc([C@@H](C#N)Cc3ccc(C#N)cc3)n2)cc1 809441149 XWFKINZXOQZAIY-GOSISDBHSA-N 388.496 5.349 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(C2=CCCC2)cc1 810530103 VTBJZZIIXLCEIX-JOCHJYFZSA-N 386.495 5.340 30 20 GKED CSc1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3oc2=O)cc1 817343172 LAAAZJHUHIOJLD-CYVLTUHYSA-N 399.471 5.333 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H]1CCCC[C@@H]1c1ccccc1 841681590 IMTWPYBTEATCKJ-YFVAEKQCSA-N 377.488 5.168 30 20 GKED N#CCCCn1cc(-c2nc(Cc3ccccc3Cl)no2)c2ccccc21 904372374 KELXKJOVQPXQEJ-UHFFFAOYSA-N 376.847 5.239 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Cl)cc1)c1nc(-c2ccc(Cl)cc2)cs1 916628737 ZOGXEKWIFKXCFN-ZZBREXMISA-N 399.302 6.007 30 20 GKED CCc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 917042282 AMHFEPDFDURABS-LLVKDONJSA-N 380.416 5.429 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(-c2ccc(Cl)cc2)s1 1776083904 GJPUIYUCVIWTEM-UHFFFAOYSA-N 384.888 5.532 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C1/CCc2oc(C(=O)O)c(C)c2C1=O 1776199937 AYDLFYSTQNRSDQ-RGPVUHAUSA-N 388.366 5.046 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc2cc(Cl)ccc12 1776355550 ZZYGCZUYDPASDP-UXBLZVDNSA-N 394.854 5.875 30 20 GKED CC(C)c1ccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)cc1 1776370447 GRNGFHUBRSNPJD-LFYBBSHMSA-N 390.435 5.576 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(OCC(=O)O)c(Cl)c1)CC2 1776374857 ZMJXQONJHZYKFL-MFOYZWKCSA-N 384.859 5.139 30 20 GKED N#Cc1cccc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)c1 24966409 VMYLLIVZVVYJOU-UHFFFAOYSA-N 375.931 5.481 30 20 GKED C[C@@H](NC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)c1ccc(C#N)cc1 26129459 CXMUQHOTQDPSDB-OAHLLOKOSA-N 399.475 5.433 30 20 GKED CN(Cc1ccccn1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 66402019 QFQFXSBGZXPMQF-FQEVSTJZSA-N 390.874 5.054 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1nc(C(C)(C)C)cs1 66955958 XARISSVVCOPDOS-ZDUSSCGKSA-N 388.562 5.157 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(OC(F)(F)F)cc2)c1 113952507 SVYDTIFCYNKEHT-PBHICJAKSA-N 378.394 5.117 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccccc3C(F)(F)F)c2)cc1 114996073 DLJIRUOFBJPKIY-UHFFFAOYSA-N 396.368 5.408 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(Cl)ccc1F 115061678 WLCOGEYZOCGHAD-UHFFFAOYSA-N 382.847 5.754 30 20 GKED Cc1cccc2c(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c12 122333994 IUQVOZPRIWAHOA-OAHLLOKOSA-N 379.872 5.158 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3sccc3C)n2)cc1 129592356 CAZGJTUSYNCHQN-QGZVFWFLSA-N 396.537 5.388 30 20 GKED C[C@H](SCCCC(C)(C)C#N)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 161158803 GULQJYOBTQPXFZ-LBPRGKRZSA-N 387.530 5.369 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1cccc(NC(=O)CCC)c1C 178333399 UIOWJKXYPOYGCZ-UHFFFAOYSA-N 397.544 5.062 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ncc(Cl)cc1Cl 179793113 YPZNEJJRIJIZCK-UHFFFAOYSA-N 391.327 5.049 30 20 GKED Cc1nc(-c2ccc(NC(=O)Nc3ccccc3O[C@H](C)C#N)cc2)cs1 183607859 WEMFLJLHGBQBSY-CYBMUJFWSA-N 378.457 5.053 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 184012382 IPOGSPNCNBZEIZ-MRXNPFEDSA-N 398.422 5.285 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3cnccn3)n2)o1 186140607 STXPBFIBGLNVGF-LLVKDONJSA-N 390.390 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)[C@@H]2C[C@@H]2C)cc1 189875886 BCBRONCPGVDKBV-HRAATJIYSA-N 376.500 5.385 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N(CCOC)Cc1ccc(C#N)cc1 189971918 OBXORRXICPBKNN-UHFFFAOYSA-N 393.531 5.315 30 20 GKED CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(F)ccc1F 303094134 FCISWLIOTLOVQQ-UHFFFAOYSA-N 383.238 5.279 30 20 GKED CC1(C)CCC[C@@H]1/N=C(/O)C1CCN(c2noc3ccc(Cl)cc23)CC1 328873026 FBZDDGZAPPAAGU-KRWDZBQOSA-N 375.900 5.233 30 20 GKED COc1ccc(C(=O)N2CCCC2)cc1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 328983966 FWCZCAAEYYZYGU-QXAKKESOSA-N 384.520 5.126 30 20 GKED OC1=Nc2cc(/C(O)=N/C3[C@H]4CC[C@H]3Cc3ccccc3C4)ccc2SCC1 329436528 JIPXMOIGZPWRBT-IRXDYDNUSA-N 392.524 5.269 30 20 GKED CC(C)c1noc2ncc(/C(O)=N/[C@@H]3CCCc4cn(C5CCCC5)nc43)cc12 329523288 ROVNROFBWRMVJO-GOSISDBHSA-N 393.491 5.040 30 20 GKED OC(=Nc1ccccc1N=C(O)N1CCCC1)[C@H]1CCSc2ccccc21 329545359 GOXCVNDTEDJYNF-INIZCTEOSA-N 381.501 5.196 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])c(C#N)s1 410619058 OKJMULQKAWCDPO-UHFFFAOYSA-N 397.378 5.097 30 20 GKED C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1C(=O)Nc1ccc(CC#N)cc1 435666839 CODILDDWWQQQBO-UQBPGWFLSA-N 395.506 5.363 30 20 GKED C[C@H](C1CC1)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638926 ZVHKCTGMXVIHTH-CQSZACIVSA-N 387.405 5.410 30 20 GKED Cc1ccccc1[C@H]1C[C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 439505485 YBIQCRYYCRIHDB-SZMVWBNQSA-N 379.529 5.315 30 20 GKED N#CCC[C@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccccc1 439667663 LDXVUIJHAILKQQ-NRFANRHFSA-N 376.431 5.180 30 20 GKED C=CCC[C@H](NC(=O)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 441546623 YIPLHCPGDXREKM-IBGZPJMESA-N 390.405 5.101 30 20 GKED Cn1c([C@H](C#N)C(=O)c2ccccc2Sc2ccccc2)nc2ccccc21 442608758 WNKDLAHCCOZIDA-GOSISDBHSA-N 383.476 5.215 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(N[C@H]3CC[C@@H](C#N)C3)cc2Cl)n1 442862486 OKUZXZHBTIEVQU-NEPJUHHUSA-N 376.913 5.385 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@](C)(C(=O)OC(C)(C)C)C1 455255728 ZJEJAZYLKWOSNS-HSZRJFAPSA-N 386.536 5.124 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(F)c2Cl)cc1Cl 463391025 JVRJVWSIUANGCC-QGZVFWFLSA-N 399.252 6.040 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)oc2c(Cl)cccc12 464464640 FFFYDMRQOFANNX-GFCCVEGCSA-N 378.737 5.299 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 466339912 MOLWARCKVMOIQH-HNNXBMFYSA-N 375.434 6.300 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccccc3Cc3ccccc3)on2)c1 468258539 FAUMJABFXDOLBA-UHFFFAOYSA-N 379.419 5.056 30 20 GKED N#CCCCN1C(=O)CCc2cc(NC3CCC(c4ccccc4)CC3)ccc21 469119444 VIUVMRZTZFRHJW-UHFFFAOYSA-N 387.527 5.408 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 475555659 XZZBHSJTPDQJCW-OAQYLSRUSA-N 380.507 5.917 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 478661637 LDLQFPKZAHAHGU-UHFFFAOYSA-N 385.389 5.207 30 20 GKED COc1cc2c(cc1OC)[C@@H](NCc1ccc(-c3ccccc3C#N)cc1)CC2 479425550 WUHKMQCJDVBBDN-QHCPKHFHSA-N 384.479 5.020 30 20 GKED CC(C)N(C)c1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 480300634 KGXBBGOYLJYYSC-LJQANCHMSA-N 384.527 5.316 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cccs1)c1ccc(F)cc1F)c1ccccc1 483356773 KDBKWDDVPQLTOH-QGZVFWFLSA-N 396.462 5.647 30 20 GKED N#CCCCCNC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 483973356 DQODVILOIZYTQU-UHFFFAOYSA-N 394.862 5.496 30 20 GKED Cc1c(C(=O)Nc2nc3c(F)c(F)ccc3s2)sc2ccc(C#N)cc12 495279302 DOJSOHWRGIYUAS-UHFFFAOYSA-N 385.420 5.222 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@@H]1C[C@H]1c1ccccc1 510014436 YHCKDPRHVSVXCN-FPOVZHCZSA-N 384.504 5.243 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1ccc(C#N)cc1 510533054 KMDQJDWGNVBPJE-ZDUSSCGKSA-N 386.282 5.713 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)cc1 513191098 DLJQRBJGUGQUNX-GOSISDBHSA-N 384.479 5.503 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccccc1OC(C)C 515605788 RHTAIWXYWXSALM-UHFFFAOYSA-N 379.529 5.134 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H]2c2cccc3ccccc23)c1 521370855 PEZQECDWKRHZNG-RUZDIDTESA-N 398.506 5.624 30 20 GKED CCN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccc(F)c(F)c1 524489617 JBDPPIPYYQWSAV-UHFFFAOYSA-N 392.405 5.082 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1c(Cl)cccc1Cl 524673745 HICQQORAWFMWMP-UHFFFAOYSA-N 381.284 5.017 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)C1 530282685 SUYHZJGJUFIMKC-PGRDOPGGSA-N 394.490 5.134 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 541158416 APHUJJZNKIXVCT-ROUUACIJSA-N 384.483 5.084 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccn(Cc4ccccc4)c3)n2)cc1 542881719 VIRNGTBIBMFVGD-NRFANRHFSA-N 397.503 5.458 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccccc2)n1 551140589 UUCJDOCIMMAVOP-OTWHNJEPSA-N 379.504 5.069 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)sc12 554772987 SQTICVRKKXZZNT-QGZVFWFLSA-N 399.500 5.695 30 20 GKED COc1ccc(CCCC(=O)N(Cc2ccccc2)c2ccccc2C#N)cc1 558463058 AJKIFMXUJKGCHU-UHFFFAOYSA-N 384.479 5.123 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N1CCC(CCC#N)CC1 563186556 OIGCTKAVSVSUHT-UHFFFAOYSA-N 383.561 5.188 30 20 GKED N#CCCC1CCN(C(=O)Nc2cc(Cl)ccc2OC2CCCC2)CC1 582120551 BAJWYAPSJOWUSA-UHFFFAOYSA-N 375.900 5.209 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 588316026 ZTSIGGIAFIHTRO-GOSISDBHSA-N 376.504 5.130 30 20 GKED CCCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H](C)c1ccc(C)o1 590942336 KUHPPBSPLHPNNA-TZIWHRDSSA-N 381.520 5.896 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC3(CC2)CC3(F)F)cc1 593149155 HZEFBLFSUVVQPK-UHFFFAOYSA-N 383.398 5.004 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1 596697871 BCCXLJZXIVSYKB-FQEVSTJZSA-N 379.460 5.088 30 20 GKED N#Cc1c(NC(=O)CCOc2cccc(Cl)c2Cl)sc2c1CCCC2 603749948 MHCGQQXFRIIRSN-UHFFFAOYSA-N 395.311 5.213 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N[C@H](C)c1ccc(C#N)cc1 603872433 SPPTVUYODUBZDB-VXGBXAGGSA-N 379.312 5.223 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2Oc2cccc(F)c2)cc2ccccc21 609166032 APJTVAJNPZEXKU-UHFFFAOYSA-N 385.398 5.349 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2ccccc2F)c2ccccc2F)cc1 609228556 KEQKGAFRQCXTIX-UHFFFAOYSA-N 376.406 5.002 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cc2ccsc2[nH]1 609526056 LMGZUWPTEZIVKT-UHFFFAOYSA-N 389.455 5.396 30 20 GKED N#C[C@H](NC(=O)c1cc2occc2s1)c1ccc(OCc2ccccc2)cc1 609875171 ZGWPTFSRVGCVDE-SFHVURJKSA-N 388.448 5.068 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@@H](C)c3cccc(C#N)c3)cs2)cc1 610363313 VQRXRJXJNYGZJQ-INIZCTEOSA-N 389.524 5.225 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)cs2)cc1 678172207 BGHHISRNFUDEQC-GOSISDBHSA-N 383.476 5.081 30 20 GKED C[C@H](Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1nc(C(F)(F)F)cs1 681139845 OQZIJACMJMDBHN-ZETCQYMHSA-N 390.299 5.989 30 20 GKED Clc1c2ccccc2c(C=Nn2cnnc2-c2ccccc2)c2ccccc12 725856880 OSKZIGHXECMYIY-UHFFFAOYSA-N 382.854 5.787 30 20 GKED N#Cc1ccc(NC(=S)NCc2ccccc2OC2CCCC2)cc1Cl 726469327 IAJUKQYSVLDBQT-UHFFFAOYSA-N 385.920 5.020 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccc(C(F)(F)F)c2)C(C)C)c1 726484026 AKVDLKFEBQCFKR-UHFFFAOYSA-N 376.447 5.294 30 20 GKED O=C(/C=C/c1ccccc1-n1cncn1)c1ccc(SC2CCCC2)cc1 726744234 XZLSBVXUADKEIU-SDNWHVSQSA-N 375.497 5.198 30 20 GKED CCc1c(C)sc(NC(=O)c2cccnc2Sc2ccccc2)c1C#N 727790874 XHMINIHANQPZQO-UHFFFAOYSA-N 379.510 5.289 30 20 GKED O=C(/C(=C/c1cnn2ccccc12)c1nc2ccccc2s1)c1ccccc1 729641664 RZFBFBRFIJEHIA-JXAWBTAJSA-N 381.460 5.368 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc(-c2cccnc2)nc2ccccc12 730421283 YXPYELABJIEPQG-UHFFFAOYSA-N 393.490 5.168 30 20 GKED C#CCOc1ccc(NC(=O)N(Cc2cccs2)Cc2cccs2)cc1 733633849 KDNSIUKDTJRVSK-UHFFFAOYSA-N 382.510 5.056 30 20 GKED COc1ccc(/C=C2/CCOc3c(Cl)cccc3C2=O)cc1OCCCC#N 733749203 SEWBSCCQRYHBRU-SSZFMOIBSA-N 397.858 5.080 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1cccc(-c2ccncc2)c1 741473850 SLXZRHVOSFWZEB-RMKNXTFCSA-N 392.458 5.619 30 20 GKED Cn1c(C(=O)N(Cc2ccco2)c2ccccc2C#N)ccc1-c1ccccc1 741897887 CWVQIGKPBVXCSD-UHFFFAOYSA-N 381.435 5.004 30 20 GKED C/C(=C/C(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 742559809 XHIWNZMIQVTMPP-QINSGFPZSA-N 388.389 5.430 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2cccc(OCC)c2)c1 742994761 JDMAGUGUWZVTOS-UHFFFAOYSA-N 386.520 5.470 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CCSc4ccccc43)n2)cc1 744036116 YADLWKRVUGDUDM-MSOLQXFVSA-N 390.533 5.574 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 746659630 MOYMFHILKFSSTR-SBUREZEXSA-N 385.467 5.233 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COc2ccc3oc4c(c3c2)CCCC4)n1 747194280 VZUUOYXQSFRKNE-QGZVFWFLSA-N 394.496 5.147 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)c(C)cc2Cl)c1 752308316 HKSVBXRXYRTGIH-AWEZNQCLSA-N 392.286 5.305 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3cnc(-c4ccccn4)s3)oc12 753143646 XNYBDRNNCZDIJJ-KTKRTIGZSA-N 376.437 5.246 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(Br)c(Cl)c2)c1 755196624 XLTSAZFAADXTNB-HNNXBMFYSA-N 393.712 5.073 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3nc(Cl)cs3)s2)cc1 759086041 YUOLLDUHMQJGGT-FPLPWBNLSA-N 376.890 5.133 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)Nc1ccc(OC2CCCCC2)cc1 761667565 AQFUTJLQOORFTB-UHFFFAOYSA-N 383.423 5.084 30 20 GKED C[C@@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1ccc2ccccc2c1 764306404 WLWVQRJGXQLEHF-GFCCVEGCSA-N 379.803 5.015 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(N2CCCCC2)c(F)c1 776841825 QTQHOYZUFXRQAX-GOSISDBHSA-N 381.495 5.672 30 20 GKED N#Cc1cc(NCc2ccc(C(=O)N3CCCC3)cc2)ccc1Oc1ccccc1 777617034 OLGWGXDATBBGLQ-UHFFFAOYSA-N 397.478 5.199 30 20 GKED N#Cc1cc(NC(=O)c2ccc(Cl)nc2Cl)ccc1Oc1ccccc1 777966631 FWHFJIOULCPHRI-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1cccc(COc2ccc(NCc3occc3Br)cc2)c1 779594976 BJQONUDPVKWSKS-UHFFFAOYSA-N 383.245 5.105 30 20 GKED CCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780149756 RCXMRWHGYIFTJG-LJQANCHMSA-N 399.494 5.256 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F 780682850 YSDZNDRNBAQXMJ-AUUYWEPGSA-N 385.414 5.015 30 20 GKED COc1ccccc1NC(=S)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782204275 KWQZAJOQHQLIGU-INIZCTEOSA-N 387.508 5.281 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)COc2c1ccc(Cl)c2Cl 788356318 SLXPPOCWDXJKSP-ZZXKWVIFSA-N 380.174 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCN(c2ccc(C)cc2)CC1 789450197 KONYHXDRRAWKLP-UHFFFAOYSA-N 391.559 5.591 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)[C@H](C#N)c3nccc4ccccc34)o2)cc1 792102582 IQLZARGIHFQSNM-FQEVSTJZSA-N 381.435 5.007 30 20 GKED C#C[C@@H](NC(=O)c1oc2ccc(CCC(C)=O)cc2c1C)c1ccc(Cl)cc1 812352356 LINGLLPHHDOJKB-HXUWFJFHSA-N 393.870 5.021 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1cc(C(F)(F)F)ccn1 813212181 ZCNBFTBGWUAGAK-CQSZACIVSA-N 394.343 5.067 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)c(F)cc1Cl)c1ccc(Cl)c(Cl)c1 815544070 IJCVCAKHFQANAB-AWEZNQCLSA-N 392.044 5.434 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835073096 KDWCEFOQMUSRHD-WPRPVWTQSA-N 394.340 5.470 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1 845841650 OWKGUQUNPVYRDE-SFHVURJKSA-N 392.524 5.123 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@]34CCCC[C@H]3C4(F)F)n2)cc1 850762262 HLTHCZJOQXTXLA-XFQXTVEOSA-N 386.467 5.510 30 20 GKED COc1ccc2c(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)coc2c1 915087078 PJCPWSNLKLMAES-QHCPKHFHSA-N 396.446 5.278 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=S)Nc3ccccc3C#N)cc2)cs1 915997748 FWGCCAJSPXMFNK-ZDUSSCGKSA-N 378.526 5.038 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2c(Cl)nc3sccn23)cc1 917560257 KJBOVTGRBBRYDV-SREVYHEPSA-N 379.268 5.077 30 20 GKED CCOC(=O)Cc1ccc(C(=O)/C=C/c2csc(-c3ccc(C)cc3)n2)cc1 918713175 PXLJDFKPTZXGPI-OUKQBFOZSA-N 391.492 5.120 30 20 GKED Cc1cc(O)c(CN(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1C(C)C 921188970 WCEZPDOPTFVNLY-UHFFFAOYSA-N 376.422 5.260 30 20 GKED C=CCC(C)(C)CCNc1c(C(=O)O)cnc2c(OC)cc(Cl)c(OC)c12 1776150705 BGJDBOFEIODRRO-UHFFFAOYSA-N 392.883 5.008 30 20 GKED CC(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776370524 WHLXUMICFGGGNI-OVCLIPMQSA-N 384.475 6.000 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c2cc(C(=O)O)oc12 1777360806 QXDHPLLYZZNGQU-SOFGYWHQSA-N 399.402 5.098 30 20 GKED O=C(/C=C\c1ccc(Cl)nc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570021 CEZOAASUIPAYHO-ALCCZGGFSA-N 388.206 5.243 30 20 GKED C=CCn1c(SCc2coc(-c3ccccc3)n2)nnc1-c1cccc(C)c1 24293538 LGBWCWPOAHADHG-UHFFFAOYSA-N 388.496 5.387 30 20 GKED COc1cccc(-c2nnc(SCc3cccc(C#N)c3)n2-c2ccccc2)c1 24967715 COLPYNBXJXVXBO-UHFFFAOYSA-N 398.491 5.107 30 20 GKED N#C[C@@H](C(=O)Cc1c(Cl)cccc1Cl)c1nc2ccccc2n1C(F)F 41558709 WDRURVVWUBQCCP-NSHDSACASA-N 394.208 5.157 30 20 GKED C=C(C)CN(CC)C(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 47249953 RKLXBCGLJUMELW-UHFFFAOYSA-N 394.899 5.140 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 60043773 RSUPCBDSSKLQFJ-HNNXBMFYSA-N 377.494 5.104 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OCCC)c(Cl)c1 63392654 PEXMEPTYUMVPFZ-UHFFFAOYSA-N 383.879 5.221 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC=C(c3ccccc3Cl)CC2)cc1 91950926 SWQQUTPZKZDPKA-UHFFFAOYSA-N 379.891 5.462 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2cc3cc(Br)ccc3o2)cc1 97992875 KPUREGAKUFNHBR-YWEYNIOJSA-N 384.229 5.050 30 20 GKED CCCCc1ccc([C@H](NC(=O)N2CCC(C#N)CC2)c2cccs2)cc1 105092418 XUGQMLZMIHHBGB-NRFANRHFSA-N 381.545 5.125 30 20 GKED CCCCCCCC(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1 105409686 GMYSIHFLFVPOID-UHFFFAOYSA-N 385.470 5.230 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)N(CCC#N)Cc1ccco1 125471245 FPEMRUKGLJHIKL-UHFFFAOYSA-N 377.897 5.381 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccc(-c2ccoc2)c1 127867692 DVQMJFSYNWDEKR-MRXNPFEDSA-N 399.233 5.215 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1ccccc1CCC(F)(F)F 133628612 GHUWVVJZXUYGDB-UHFFFAOYSA-N 379.378 5.007 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 174162017 ODRLOGDLFYNDHA-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(NC(=O)Nc3ccccc3)s2)c1 195645669 DXBOSEJGBDKILM-UHFFFAOYSA-N 393.468 5.209 30 20 GKED COc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCC2)cc1OCCCC#N 237351027 CGGFUXBUXUFLDW-HSZRJFAPSA-N 398.934 5.662 30 20 GKED COC(=O)c1sc(Oc2ccc(Oc3ccc(C#N)cc3)cc2)nc1Cl 301967689 WMIOONHRHQCPCM-UHFFFAOYSA-N 386.816 5.039 30 20 GKED N#Cc1ccc(C(=O)N(c2cccc(N3CCCC3)c2)C2CCCCCC2)cc1 303668625 CSIJQWCXFOSZOI-UHFFFAOYSA-N 387.527 5.528 30 20 GKED CCCc1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)s1 304096571 XTGKSUIPHKAIBD-UHFFFAOYSA-N 393.468 5.020 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1c1cccnc1 363378056 OSMYJSBQWDCINU-QHCPKHFHSA-N 398.466 5.423 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)c1 409836572 OMBBBTPQAOFSEW-MSOLQXFVSA-N 389.282 5.418 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1nc(-c2ccccc2)cs1 426124127 RASIWDIDFVOBIS-LBPRGKRZSA-N 382.876 5.218 30 20 GKED CCN(CCC#N)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 428892253 LJFOKCRAFMEAFG-UHFFFAOYSA-N 399.360 5.127 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 435171449 QFIKVEULTNBQGO-FGZHOGPDSA-N 375.516 5.424 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cccc(-c3ccncc3)c2)cc1 437239212 JGQUCWCXTQUZEU-UHFFFAOYSA-N 383.495 5.175 30 20 GKED CCOCc1ccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 437837007 IRAOGKXQBWTSEO-UHFFFAOYSA-N 387.439 5.531 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H]2CCSc3ccc(F)cc32)cc1C(F)(F)F 438641385 MBTKOKVZOMUVDF-OAHLLOKOSA-N 395.381 5.075 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccccc1 438838176 RYDGWGQABXSWHL-GOTSBHOMSA-N 387.458 5.259 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(Oc3ccccc3C#N)c(F)c2)n1 439676200 UQAUOMQHTXMRNZ-AWEZNQCLSA-N 380.423 5.388 30 20 GKED CCC(CC)(NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 439877688 JPCYXFOBNKILPN-UHFFFAOYSA-N 380.879 5.067 30 20 GKED Cc1ccc(/C=C/CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 440582842 INGXTUZDAPGJPD-SNAWJCMRSA-N 396.490 5.682 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnn(CCC(C)C)c3C)n2)cc1 442049483 MGNGEOFDQSGMPI-GOSISDBHSA-N 392.528 5.160 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccc(O)cc3Cl)no2)c2ccccc21 445450289 RVFLHYMYEGCRGN-RMKNXTFCSA-N 390.830 5.134 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(F)cc(C(F)(F)F)c1 445517273 AFBYARYVMMNORO-UHFFFAOYSA-N 399.237 5.177 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H](c2ccccc2)CC1)c1ccccc1 458799708 JUASYSJXEWQNGT-GGAORHGYSA-N 375.516 5.401 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(Cl)cc2OC(F)F)c1 460241971 YYGSPKBCPZACAM-UHFFFAOYSA-N 395.793 5.268 30 20 GKED N#Cc1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)s1 474261001 WLROOPVLJPVRCH-LBPRGKRZSA-N 392.324 5.062 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1ccccc1 474416412 RZTDNXRMHGECME-GOSISDBHSA-N 380.451 5.256 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1 474902792 WTFBNVOEDXGOID-UHFFFAOYSA-N 395.462 5.191 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1 475550029 MTZQXLCIEMTHBW-DENIHFKCSA-N 391.559 5.496 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1Cc1ccccc1OC 475572621 PUDGEXXNFYUAQX-NRFANRHFSA-N 392.543 5.786 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1)c1ccc(C#N)cc1 477818198 QZPCRKDYYWEBTK-OAHLLOKOSA-N 399.416 5.137 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3OC(F)F)c2)cc1 482304046 QQSSFGJJHPCYAO-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)C[C@@H](CC#N)c1ccccc1 483438145 BGBNOXKFVMNSJB-GOSISDBHSA-N 388.471 5.195 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1 486435919 PKJAPBZYEJRKBK-CYBMUJFWSA-N 399.903 5.159 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2cccc(Cl)c2)no1)c1ccccc1 487470549 HXOVFVDNIDZSTQ-SFHVURJKSA-N 379.847 5.160 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)c1ccccc1 488650790 CDIJKGQPBQDHFJ-XMMPIXPASA-N 398.506 5.191 30 20 GKED C=CCn1c(SCCCC(=O)c2ccc(F)cc2)nnc1-c1cccs1 489440130 OYSNJDIAPKSYTD-UHFFFAOYSA-N 387.505 5.087 30 20 GKED CC(=O)c1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cs1 496027155 FNOSSTTYWWYJAT-AWEZNQCLSA-N 386.885 5.218 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(-c2ccc(Cl)cc2)s1 499628669 YOYWCNJIJGHLBC-MRXNPFEDSA-N 388.964 5.820 30 20 GKED CC(C)c1cccc(O[C@H](C(=O)Nc2ccc(CC#N)cc2)c2ccccc2)c1 499752451 ZGTCMWQOYPEZBN-DEOSSOPVSA-N 384.479 5.635 30 20 GKED CC(C)(Cc1cccc(Cl)c1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 504013652 REELJBJYPQCFKI-UHFFFAOYSA-N 378.903 5.096 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2cccc(OCc3ccccc3C#N)c2)C1 504930730 QBYKNYMBBQBLEP-JOCHJYFZSA-N 396.490 5.075 30 20 GKED Cc1nc(NC(=O)c2ccccc2N(C)c2ccccc2)sc1SCC#N 507375051 LENODOWIMBJHDF-UHFFFAOYSA-N 394.525 5.087 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc3c(c2)COC3)c1 508385895 KUBMYYWLPRKGHL-UHFFFAOYSA-N 390.826 5.286 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1C1CCCCC1 511029738 QDRPPEHCXPZDND-OAHLLOKOSA-N 382.533 5.201 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cc2ccccc2o1 516641048 DWQJNJMSXOOZCQ-UHFFFAOYSA-N 397.434 5.727 30 20 GKED Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 517734681 BDTFSGIOVQPKPU-JXFKEZNVSA-N 392.890 5.009 30 20 GKED CC(C)CN(C(=O)CCc1nc2cc(Cl)ccc2s1)c1ccc(C#N)cc1 521928438 KKSYMRFSYJPHME-UHFFFAOYSA-N 397.931 5.443 30 20 GKED C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 523032811 VPZRCUTXLQRGIY-NQIIRXRSSA-N 399.469 5.030 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)NCc3ccc4ccccc4c3)s2)cc1 525224413 BWJSUELICSZIMG-UHFFFAOYSA-N 398.491 5.080 30 20 GKED CO[C@H]1CCC[C@@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)C1 530282684 SUYHZJGJUFIMKC-GCJKJVERSA-N 394.490 5.134 30 20 GKED N#CCC[C@@H](NCc1cc(Br)cc(C(F)(F)F)c1)c1ccccc1 533920688 DEPQEXAXTPGDTQ-QGZVFWFLSA-N 397.238 5.603 30 20 GKED C=CCCC(=O)CSc1nnc(SCc2ccc(C(C)C)cc2)s1 534242992 PNCXIMGBBMIKOE-UHFFFAOYSA-N 378.588 5.581 30 20 GKED CCC[C@@H](C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 538827588 JOPUHWVUKGRQHM-AWEZNQCLSA-N 382.847 5.087 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2ccc(CC#N)cc2)c1)c1ccccc1 544095152 MNLQJCKNEFXZIY-UHFFFAOYSA-N 389.886 5.295 30 20 GKED C=CCC(C)(C)c1noc(-c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 551144504 TUXGKMTUURCQQQ-AWEZNQCLSA-N 393.447 5.067 30 20 GKED N#Cc1cccc(C2(C(=O)N(Cc3ccccc3C(F)(F)F)CC3CC3)CC2)c1 552713025 FJEQUCNUSVSWEU-UHFFFAOYSA-N 398.428 5.047 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Oc3cccnc3)cc2)c2ccccc21 568574231 CRPGWBALCGKXAW-UHFFFAOYSA-N 396.450 5.385 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)c(F)c1 588933991 DPDBYINBIXHELL-LJQANCHMSA-N 398.279 5.108 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2ccccc2SCc2ccco2)cc1 589077513 ADSOZQLBJFUSLN-FQEVSTJZSA-N 376.481 5.129 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)c1 589739221 LDXHLTYJVQAGIK-OAQYLSRUSA-N 390.487 5.195 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)Cc2sc(C)nc2-c2cccs2)cc1 594029499 XXPINZGNDYXDKV-QGZVFWFLSA-N 395.553 5.008 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(Oc3cccc(Br)c3)cc2)C1 597913984 SLBYXTCERCFIMF-OAHLLOKOSA-N 399.288 5.007 30 20 GKED C=CCN1CCC(NC(=O)N[C@H](C)c2ccccc2-c2ccc(Cl)cc2)CC1 606925870 YBPNJHPMAIEJNJ-QGZVFWFLSA-N 397.950 5.018 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)s2)c(C)c1 609358750 SHKMVUQOCLOYCT-UHFFFAOYSA-N 378.501 5.107 30 20 GKED CC(C)COc1cccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 609398467 UUMUHZOLVPNAFV-QGZVFWFLSA-N 397.544 5.295 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1 609398745 NSDCOMCCSSGIAS-BTYIYWSLSA-N 395.528 5.220 30 20 GKED N#CCN(C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)C1CCCC1 609978144 IGRXOQBRTQLJKY-UHFFFAOYSA-N 389.474 5.201 30 20 GKED CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 610010283 HQUHRRVYNFVMFJ-KXBFYZLASA-N 382.533 5.038 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cn1)c1ccccc1 613292319 HJLHEFZPNULTEC-DYESRHJHSA-N 393.446 5.260 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 615081363 BDDGXJAJLZPRML-UXHICEINSA-N 389.417 5.032 30 20 GKED C=CCN(Cc1cccs1)C(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1 619387458 UWXKGUCFRXCCFK-UHFFFAOYSA-N 398.478 5.514 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cccc(COCc2ccco2)c1 619508218 SLDCHWVLDWAZKK-RUZDIDTESA-N 386.495 5.425 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)cc1Cl 622485710 WDLWGTUMUFSSIO-CYBMUJFWSA-N 399.693 5.531 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1 682776980 CIHKNYFRBZIESU-JOCHJYFZSA-N 391.559 5.277 30 20 GKED N#Cc1ccc(NC(=S)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1Cl 726489285 IYPVHEQBQBHFKI-BBRMVZONSA-N 395.837 5.073 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)c1 726490484 ZDLUCRASJDQWDQ-UHFFFAOYSA-N 399.475 5.149 30 20 GKED O=C(Cc1ccc(N=Cc2cc3ccccc3nc2O)cc1)Nc1ccccc1F 727973145 SIZPHZBLYKZUKQ-UHFFFAOYSA-N 399.425 5.011 30 20 GKED CC(=NNc1ccc(OC(F)F)cc1)c1csc(-c2csc(C)n2)c1 729144857 BCLXTSZZIGBGAJ-UHFFFAOYSA-N 379.457 5.618 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](c3cccc(F)c3)C2)cc1 729553759 UHSIXGDDQWRWJJ-QPPBQGQZSA-N 399.469 5.503 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(Cl)cc1)c1nc2cc(F)ccc2s1 730416296 AOUPDKQQGDJPQO-OAHLLOKOSA-N 388.851 5.124 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)cc1 734304480 LACNOTZUOJZGQO-QXMHVHEDSA-N 379.481 5.040 30 20 GKED N#Cc1ccc2ncc(/C=C\C(=O)c3ccc(-c4ccccc4Cl)s3)n2c1 736433705 JKODCSBLCINTGP-SREVYHEPSA-N 389.867 5.484 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 744016770 SSGFRZUKKLLPAN-BLLLJJGKSA-N 398.384 5.190 30 20 GKED CC(C)(C)c1nc(C#N)c(NN=C2CCCOc3c2ccc(Cl)c3Cl)o1 746498556 VHXJZPSXTQBIMM-UHFFFAOYSA-N 393.274 5.139 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H]1CCCCO1 758536809 XZFXGYYJAZIIRE-VXKWHMMOSA-N 391.515 5.059 30 20 GKED N#C[C@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1ccc2ccccc2n1 759530747 IVUNCURKBQTXMV-AWEZNQCLSA-N 381.262 5.450 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N2CCO[C@@H](c3cccc(C#N)c3)C2)cc1 761844366 GHOPWRZJGLPCCX-HXUWFJFHSA-N 395.528 5.054 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2ccc(Br)cc2)cc1 768936555 MSPWBXJJDPRZKB-MGPUTAFESA-N 385.305 5.077 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(C3SCCCS3)cc2)cc1C#N 772148117 LPBVRNMQALTMJH-UHFFFAOYSA-N 398.553 5.466 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2ccc3ccc(Cl)cc3n2)cc1 774574609 FLGVDGUWTHBCLR-UHFFFAOYSA-N 394.858 5.150 30 20 GKED COCCOc1c(Cl)cc(N[C@H](C)c2ccc(C#N)c(F)c2)cc1Cl 777706344 FTYRITIGWLQMEK-LLVKDONJSA-N 383.250 5.202 30 20 GKED C#CCCCCCC(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 780255674 VNADHYYMMGOMHX-UHFFFAOYSA-N 398.528 5.071 30 20 GKED Cn1ncc(Br)c1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 782299817 ANPZWSPLSHGCRY-PLNGDYQASA-N 394.483 5.039 30 20 GKED CC(C)N(C(=S)Nc1cccc(OC(F)(F)F)c1)c1cccc(C#N)c1 783729536 FKGHEACRZURDQA-UHFFFAOYSA-N 379.407 5.069 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](CCOC)c2ccc(Cl)c(Cl)c2)c1 789356857 MJDJPGRKIZGHPG-SFHVURJKSA-N 393.339 5.039 30 20 GKED N#CCOc1ccc(Cl)cc1CSCCCc1nc(-c2ccccc2)no1 790561333 MNXSOKIPQYUJNT-UHFFFAOYSA-N 399.903 5.158 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(-c3ccc(OC)c(Cl)c3)cn2)c1 794999750 PIAZTOLAYQNSAO-UHFFFAOYSA-N 393.899 5.201 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 796745214 LJTFWCBXNFGJCV-OAHLLOKOSA-N 397.208 5.066 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)c1sc2cc(C(C)C)ccc2c1Cl 798038308 WGFDXTTXXHDDGY-KSSFIOAISA-N 377.937 5.389 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801666254 SRUIHVCDJWHJKT-QGZVFWFLSA-N 380.341 5.014 30 20 GKED CCCn1c(Sc2nc(Cl)c(C#N)s2)nnc1-c1ccc(Cl)cc1 804337457 CCWZMSBXMQWQFM-UHFFFAOYSA-N 396.328 5.141 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1C 806347068 DRMQWXIQOQFGAO-FQEVSTJZSA-N 375.516 5.041 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(SCc2cccnc2)cc1 812414397 ZCALVOPOHMPUDR-UHFFFAOYSA-N 389.307 6.137 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cccc(Cl)c1[N+](=O)[O-])c2C#N 839389778 SRXXGOSWMKKGFP-ZJUUUORDSA-N 389.864 5.119 30 20 GKED Cc1cc(Br)ccc1CNc1ccccc1S[C@H](C)CC#N 864005560 BJHUJDJHRWWPFF-CQSZACIVSA-N 375.335 5.764 30 20 GKED Cc1cncc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 878676180 OSXAVFNSFAVJBM-LPHOPBHVSA-N 380.517 5.153 30 20 GKED C[C@H](/N=C\c1cc2ccccc2nc1O)c1cccc(NC(=O)c2ccccc2)c1 915270834 CGRNDOINIZWXTE-PBRFOAMMSA-N 395.462 5.373 30 20 GKED O=C(/C=C\c1ccc2ncccc2c1)c1cc2cc(Br)ccc2o1 916130236 LNMQOQXCOFQLMT-DAXSKMNVSA-N 378.225 5.640 30 20 GKED Cc1cccc(OCCCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 920114016 XHHQMXTVXWANTD-FQEVSTJZSA-N 390.508 5.544 30 20 GKED CC(=Nn1c2ccccc2c2ccccc21)c1cccc(OCCCC(=O)O)c1 1776112757 JVYWJHUKUHOUJG-UHFFFAOYSA-N 386.451 5.310 30 20 GKED O=C(/C=C\c1ccc2oc(C(=O)O)cc2c1)c1ccc(Oc2ccccc2)cc1 1776126737 VWHPRSJJGHVUMQ-SDQBBNPISA-N 384.387 5.819 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1cccc(OCc2cccc(C(=O)O)c2)c1 1776665993 RBAQNAOYZKMNCS-HIQXPHMNSA-N 398.458 5.422 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2nc(C(=O)O)ccc2C#N)cc1 1776785596 QGZHIQDXYYTEIB-UVTDQMKNSA-N 378.472 5.561 30 20 GKED CCCCCCCSc1ccc(C(=O)NCc2ccc(C(=O)O)c(C)c2)cc1 1776787477 AIHBSJIXPFHYTJ-UHFFFAOYSA-N 399.556 5.686 30 20 GKED N#Cc1ccc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)c(F)c1 11372476 MSIJKATYGJYVQZ-UHFFFAOYSA-N 393.921 5.620 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 43714140 KZYGZESVIGMELO-JOCHJYFZSA-N 389.886 5.143 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C)C(=O)N(C(C)C)C(C)C 63641497 IEMYEJOHGOQVJP-GOSISDBHSA-N 379.504 5.105 30 20 GKED C[C@@H](SCC(=O)Nc1ccc(CC#N)cc1)c1ccc(OC(F)(F)F)cc1 65280228 OKKNQAKAQXTOFD-CYBMUJFWSA-N 394.418 5.084 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)Cc1coc2ccc3ccccc3c12 65839328 FUGMGHWPOUCVJY-UHFFFAOYSA-N 384.435 5.426 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccccc1OCC(F)F 137445995 XIXXACWVPAZDAZ-ZDUSSCGKSA-N 391.443 5.226 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(-c2cccnc2)cc1 151279521 KBGSTXXREYRURN-WZONZLPQSA-N 384.483 5.154 30 20 GKED C=CCCCN(C)Cc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 165977114 YEPDHGQAKRNYMM-UHFFFAOYSA-N 397.466 5.245 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)s1 170974502 LFNGWUJDCGMJAK-CQSZACIVSA-N 393.537 5.623 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 171797175 SSNFBFQJJQPBIZ-WMLDXEAASA-N 385.439 5.179 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cccc(OCc2cccc(C#N)c2)c1 181118401 ABZVMACXCGCREG-SFHVURJKSA-N 383.451 5.040 30 20 GKED COc1cc([C@H](C)N[C@@H](CCC#N)c2ccccc2)ccc1SC(F)F 181575819 UVVNRLQTARFDEG-YOEHRIQHSA-N 376.472 5.706 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(Oc3ccc(F)cc3)cc2)cc1 237495214 QPTALNQHYMYVRN-KRWDZBQOSA-N 376.431 5.199 30 20 GKED Cc1ccccc1[C@@H]1CCCN1CC(=O)Nc1ccccc1S[C@H](C)CC#N 247040412 FNCPHDFAGPBEEK-NQIIRXRSSA-N 393.556 5.165 30 20 GKED C=CCn1c(SCc2csc(C)n2)nnc1-c1ccc(C(C)(C)C)cc1 255933375 KVCRTCZJNYTCOW-UHFFFAOYSA-N 384.574 5.486 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2cc3ccccc3c(Cl)n2)ccc1OC 301288260 SHFDHIDHLHPBFB-INIZCTEOSA-N 381.863 5.190 30 20 GKED OC(=Nc1cccc(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1)C1CC1 329515458 ONASUOJMDCURQQ-HXUWFJFHSA-N 392.503 5.378 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2cccs2)Cc2cccs2)c(Cl)c1 426157264 RQHUJMZNKGOXIE-UHFFFAOYSA-N 387.917 5.569 30 20 GKED Cc1c(-c2nc(-c3cccc(Cn4ccnc4)c3)no2)sc2ccc(C#N)cc12 426455858 UXYVXVUCKCAHAI-UHFFFAOYSA-N 397.463 5.043 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437488921 XSVFHFGWOGDIAC-UHFFFAOYSA-N 385.398 5.532 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC(C)(C)C)cc1 438385527 MGXZBRFQPKYMGW-UHFFFAOYSA-N 379.504 5.426 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 438845387 BBRKSVFYSDNYQR-QZTJIDSGSA-N 385.920 5.221 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)N[C@H](CCC#N)c2ccccc2)c(C(C)C)c1 439445227 WIGSHBPJJVMQGD-OAQYLSRUSA-N 391.515 5.033 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2ccc(OC)cc2)c2ccco2)ccc1OC 449780772 VOYWMZXAGHQWJK-DEOSSOPVSA-N 393.483 5.131 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CCCC#N)c1ccccc1 458798159 HIBVEYIYBFAIDD-QGZVFWFLSA-N 375.925 5.368 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2ncc(C#N)cc2Cl)nc1-c1ccccc1 462102803 DHHWILGDLICWRT-GOSISDBHSA-N 392.890 5.727 30 20 GKED C[C@H](C(=O)N(Cc1cccs1)c1ccc(F)cc1F)c1cccc(C#N)c1 463465156 UOOBHUJEPRQPKA-AWEZNQCLSA-N 382.435 5.235 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1nc(C(F)(F)F)cs1 467735304 MOIBTKWUOOOEBS-CYBMUJFWSA-N 387.430 5.551 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 469830268 KUUPRSQGYVKNPV-UHFFFAOYSA-N 392.912 5.160 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)c1ccccn1 475577449 DVKFONDRTCRNKV-DEOSSOPVSA-N 385.511 5.845 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(-c2ccc(OC)cc2)s1 476088776 GWEWIXXJDXEXSB-UHFFFAOYSA-N 392.524 5.923 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1 476141292 HUADKPMPQFMNCM-VQTJNVASSA-N 398.344 6.043 30 20 GKED N#CC[C@H](CC(=O)N1CCCCC[C@H]1/C=C\c1cccs1)c1ccccc1 476671589 OOYDOAXDERKTKR-QFRKBEELSA-N 378.541 5.620 30 20 GKED COc1cc2c(cc1OC)[C@H](N[C@H](C)c1ccc(-c3cccc(C#N)c3)cc1)CC2 479460856 MEJPZXQWHCPWCR-MZNJEOGPSA-N 398.506 5.581 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(COCC(F)(F)F)cc1 481920738 UXYAEGHFGWQOSQ-OAQYLSRUSA-N 388.433 5.194 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nc(C)cs2)c(OC2CCCC2)c1 482565431 KHQZBGNZLNCYCW-GOSISDBHSA-N 384.501 5.052 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483217369 XHJCLFFNQHFLCK-HNNXBMFYSA-N 375.478 5.218 30 20 GKED N#C[C@H](C(=O)c1sc(C2CC2)nc1-c1ccccc1)c1nc2ccccc2o1 484120431 WFGCWIMGNXNETF-OAHLLOKOSA-N 385.448 5.319 30 20 GKED Cc1ccccc1[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)C1CC1 489105819 OYGUBXWDLSQHSD-SANMLTNESA-N 382.507 5.687 30 20 GKED C=CCC[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 500103758 UTGUBLGYNPHBDY-KRWDZBQOSA-N 381.442 5.342 30 20 GKED C[C@H](NC(=O)Nc1ccccc1OCCc1ccccc1)c1ccc(C#N)cc1 505309397 BWSXCAYWILEOFB-SFHVURJKSA-N 385.467 5.062 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 506771782 JWSKZYSRCQIUMA-UHFFFAOYSA-N 393.446 5.424 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SC[C@H](OC)c1ccc(Cl)cc1 509101813 AOHLSRCIJHBFPH-IBGZPJMESA-N 399.947 5.188 30 20 GKED CCc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 511727759 RODKRSKCIPDBLD-UHFFFAOYSA-N 398.509 5.084 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)C1(C#N)CCCC1 513081529 RISLGDHSLXUAID-UHFFFAOYSA-N 390.405 5.398 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CNC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 517652787 AOJOBESPHCUIFW-ZHRRBRCNSA-N 386.451 5.191 30 20 GKED Cc1nc2ccccc2n1Cc1cc(NC(=O)C2(C#N)CCCC2)ccc1Cl 517666144 VFAXMXNSRCNIRX-UHFFFAOYSA-N 392.890 5.069 30 20 GKED C=CCN(C(=O)[C@H]1C[C@H]1c1cccc(OC)c1)c1nc(-c2ccccc2)cs1 519321159 AYUMPKHFFRANPK-PMACEKPBSA-N 390.508 5.141 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 520855392 LJRGZTDVXQVHON-INIZCTEOSA-N 385.508 5.520 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)cc1 521106177 AVJZCVJYQNJXQA-DEOSSOPVSA-N 382.463 5.522 30 20 GKED Cc1ccc(SCCC(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)cc1C 521352914 WNOYEUJVPXDOJX-SFHVURJKSA-N 392.446 5.186 30 20 GKED Cc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 524565688 DBTQSEDFNUICOT-INIZCTEOSA-N 381.545 5.346 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccccc1SCc1ccccc1OC)OCC 534452631 WAKTUSKEDJOVIK-HXUWFJFHSA-N 385.529 5.297 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 537254033 PJZKPUCBAQCPPV-GOSISDBHSA-N 377.488 5.198 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 538072726 NCGVDESRYKWGEU-UHFFFAOYSA-N 391.496 5.249 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 538107829 KLPHPUAAJJPALT-QGZVFWFLSA-N 387.458 5.267 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c1 541447238 SFWISKCWCGJYOI-RBUKOAKNSA-N 393.556 5.577 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 542003866 PYPZZAQZZKXBNX-GFCCVEGCSA-N 378.419 5.259 30 20 GKED CN(C[C@@H]1CC=CCC1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 542348699 BQACNUIJDOBXOL-HXUWFJFHSA-N 389.499 5.152 30 20 GKED COC(=O)c1cccc(CN[C@H](C)c2ccc(Cl)c3ccccc23)c1C#N 547316141 NWNRLPCKWFWNRC-CQSZACIVSA-N 378.859 5.002 30 20 GKED Cc1c(C(=O)N[C@H](C)c2nc(C(C)(C)C)cs2)sc2ccc(C#N)cc12 550380403 JPWLLHFIQIUULL-GFCCVEGCSA-N 383.542 5.326 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 551212028 PTAISIFBRFETEF-VGSWGCGISA-N 394.465 6.527 30 20 GKED C=CCn1c(S[C@H](CCOC)c2ccccc2)nnc1-c1ccccc1F 551389044 YFYBBKOARLLWIK-LJQANCHMSA-N 383.492 5.140 30 20 GKED C=CCC1(c2nc(CC(=O)Nc3ccccc3Oc3ccccc3)no2)CCC1 558367428 FOAFIHFALDOADR-UHFFFAOYSA-N 389.455 5.041 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cccc(-c4cccc(Cl)c4)c3)o2)c1 559944903 XMOWLQIITIHVBS-UHFFFAOYSA-N 386.842 5.541 30 20 GKED N#CC1(CNC(=O)c2cc(Cl)ccc2Sc2ccc(Cl)cc2)CC1 562437072 QBQZIXYEIMTQPF-UHFFFAOYSA-N 377.296 5.178 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1ccc(C#N)cc1C(F)(F)F 584204679 WDCCCCHDZLMCLV-QGZVFWFLSA-N 386.339 5.669 30 20 GKED N#CCCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 593980743 QZEILRDRTKDXEJ-UHFFFAOYSA-N 384.345 5.382 30 20 GKED COCc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1C(F)(F)F 597043070 KJGRMPKEYZWEAU-SFHVURJKSA-N 391.393 5.018 30 20 GKED C=CCn1c(S[C@@H](CC)C(=O)c2ccccc2)nnc1-c1ccccc1F 606150137 DDMOQTHVOVOVFH-SFHVURJKSA-N 381.476 5.024 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)c1cc2ccccc2n1CC#N)C1CC1 609166070 CKAFGNUPAULSBA-OAHLLOKOSA-N 377.875 5.184 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCCCOC3CCCCC3)cc2)cc1 609514048 UZHGLQSQEVWWRM-UHFFFAOYSA-N 392.499 5.014 30 20 GKED CC(C)(C)c1ccccc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 609552425 ZLKBXVZLRTYUCH-UHFFFAOYSA-N 391.515 5.367 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CSc4ccccc43)cc2)cc1 609807704 KTUZLLBSNBGUMF-FQEVSTJZSA-N 387.464 5.319 30 20 GKED C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1ccccc1-c1ccccc1C#N 609909298 AVYUWSJSYQNRII-XLIONFOSSA-N 384.454 5.383 30 20 GKED CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609926783 FIRHAYOVTZHGAR-IFXJQAMLSA-N 385.895 5.039 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 610019398 NWQPRGYUYURUTE-HOJAQTOUSA-N 393.556 5.471 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC(Cc3ccccc3)C2)cc1 610630747 MXAXAAZWADFLSY-UHFFFAOYSA-N 383.451 5.057 30 20 GKED COc1ccc([C@H](NC(=O)N[C@H](CCC#N)c2ccccc2)c2ccccc2)cc1 610973732 DCFILXZODKDNOP-DNQXCXABSA-N 399.494 5.129 30 20 GKED COc1cccc(C(N[C@H]2CCCc3cc(C#N)ccc32)c2cccc(OC)c2)c1 611393673 KANGHRVTFZUVFZ-VWLOTQADSA-N 398.506 5.332 30 20 GKED CN(C(=O)c1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1)c1ccccc1 614056114 JGEDCACMAWMAMO-UHFFFAOYSA-N 383.495 5.376 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1CC[C@@H](C(F)(F)F)C1 619125465 BAQZGABNYJPYDE-DTWKUNHWSA-N 387.286 5.135 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Br)cc2F)C2CC2)cc1Cl 619755516 JYVGYVWFCVKTRS-GOSISDBHSA-N 393.687 5.354 30 20 GKED Cc1cc(F)ccc1C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 622485296 JVIRRXWHGQPIGC-CQSZACIVSA-N 379.275 5.186 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)C3C[C@@H]4CCC[C@H](C3)C4=O)c2C#N)C1 637012843 DCRVVJGKCOUVDR-QXULXFAOSA-N 398.572 5.105 30 20 GKED C=C(C)Cn1c(C2CCCC2)nnc1N1CCC[C@@H](c2nc3ccccc3o2)C1 670194709 DWODTASIWRNPJR-GOSISDBHSA-N 391.519 5.037 30 20 GKED Fc1cc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 678296303 ALNMHFGWAXADJV-PHIMTYICSA-N 383.229 5.017 30 20 GKED Fc1ccc2c(c1)OCCC[C@@H]2NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 679768805 TZQRBNGSETVKBW-HFAKWTLXSA-N 399.350 5.539 30 20 GKED N#Cc1ccc(COC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)cc1 725994875 PLTUZYBKECDAHG-UHFFFAOYSA-N 388.370 5.058 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCCc2ccc(Br)s2)cc1 726940800 SPZJZPGJZKBQRI-UHFFFAOYSA-N 391.334 5.089 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)NCCSc1ccccc1 730955240 VWBDKUVCEGWLRO-HNNXBMFYSA-N 387.599 5.017 30 20 GKED Clc1ccc(-c2nc3c(s2)C(=NNc2nccnc2Cl)CCC3)cc1 733079075 SNZZNWBSADNTMY-UHFFFAOYSA-N 390.299 5.059 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3ccc(Cl)cc3)CCCC2)c1 733787758 WMWIQJBGORFEQU-FQEVSTJZSA-N 396.918 5.149 30 20 GKED C=CC[C@H](NCc1ccc(-c2ccc(Br)cc2)s1)c1ccncc1 734510580 XPXDUMCUDQEIGI-IBGZPJMESA-N 399.357 5.980 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1)c1ccncc1 734683212 JQXDASMXUAFNCM-NQIIRXRSSA-N 391.540 5.733 30 20 GKED N#Cc1ccc2ncc(/C=C/C(=O)c3ccc(Cl)c(Cl)c3Cl)n2c1 736433342 SIFQCOMPNGGDFH-GORDUTHDSA-N 376.630 5.062 30 20 GKED O=C(/C=C/c1ccc(Cl)s1)c1ccc(S(=O)(=O)C2CCCC2)cc1 741447569 OLDBWJSMMPWEPN-YRNVUSSQSA-N 380.918 5.014 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)[nH]1)c1c[nH]c2cc(Br)ccc12 742434681 MRPURAJVKTVOHT-VQHVLOKHSA-N 392.256 5.217 30 20 GKED CCOCc1cc(/C=C/C(=O)c2cc3cccc(OCC)c3o2)ccc1OC 747612654 HPSQGMHIZKCTRL-PKNBQFBNSA-N 380.440 5.273 30 20 GKED CCN(CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc2ccccc2c1 747816940 DGEZMIPVLKNLQM-IBGZPJMESA-N 385.492 5.152 30 20 GKED Cc1cccc(-c2nnc([C@H](C)ON=C(c3ccccc3)C(F)(F)F)o2)c1 751953644 ZYPHLVNECMAXJR-ZDUSSCGKSA-N 375.350 5.089 30 20 GKED N#CCOc1cccc(CC(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)c1 760262013 IPJZEJZVIQZTOL-VWLOTQADSA-N 398.506 5.012 30 20 GKED CCCOc1cccc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 762995077 MNNCBNHDYJELNW-INIZCTEOSA-N 384.888 5.157 30 20 GKED N#CCCN(C(=O)/C=C\c1nc2ccccc2s1)C12CC3CC(CC(C3)C1)C2 763178236 XUFGGHSSHGPIOK-SREVYHEPSA-N 391.540 5.021 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1SCC#N 764859709 TYSMINQTLMGLDQ-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C=CCc1cc(CN[C@H](C)c2sccc2Br)cc(OC)c1OC 772944894 DCUHKSWGARMKCA-GFCCVEGCSA-N 396.350 5.107 30 20 GKED N#Cc1ccc([C@@H](O)CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 776033429 HESIJKLBLGZILF-OALUTQOASA-N 394.824 5.005 30 20 GKED C#CCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 780313905 UCKNRCWWYRKKSJ-HNNXBMFYSA-N 391.323 5.877 30 20 GKED COCCOc1c(Cl)cc(N[C@@H](C)c2ccc(C#N)cc2F)cc1Cl 781420944 GOYMNSFXWMBJBV-NSHDSACASA-N 383.250 5.202 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)s2)o1 781756181 WSWIGUMHHZMBSC-OAHLLOKOSA-N 388.448 5.312 30 20 GKED C[C@@H](OC(=O)c1cccc(F)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 784648264 YOHZJXAWCNCNGL-MRVPVSSYSA-N 381.247 5.176 30 20 GKED CCc1cc(C#N)c(NC(=O)CCc2ccccc2NC(=O)OC(C)(C)C)s1 790862353 PJAFADSEDMEVPF-UHFFFAOYSA-N 399.516 5.100 30 20 GKED COc1ccc(-c2nc(/C=C3/CCc4cc(OC)ccc4C3=O)cs2)cc1 797091122 BEUSJMZMFMBHOD-WJDWOHSUSA-N 377.465 5.040 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 813091374 ZKRPCZMHYJXIPZ-DENIHFKCSA-N 378.859 5.168 30 20 GKED Cc1c(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)sc2ccc(C#N)cc12 814344211 AUABPTDLHMKCTE-UHFFFAOYSA-N 376.268 5.223 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)n1 835200546 MMHSVCLGGRITOY-ZNMIVQPWSA-N 389.318 5.009 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCSC3(CCC3)CC2)cc1 841599005 USBFXMURBYFVGN-NRFANRHFSA-N 391.540 5.236 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(-c2ccccc2Cl)no1 848603225 NWGSWOFOJMVOMB-OAHLLOKOSA-N 390.871 5.040 30 20 GKED C[C@@]1(c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)CCCO1 854041848 HLPNVOWIJBLBIX-ZDUSSCGKSA-N 398.278 5.052 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 854461181 UQECPAZNWBQTFB-IEBWSBKVSA-N 375.557 5.777 30 20 GKED C=C[C@@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 909531370 XRRRCCOUAMSONM-AWEZNQCLSA-N 392.908 5.127 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2)cc1 915085317 KUJDFRTTZAIHKD-SFHVURJKSA-N 381.357 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1 915085342 ARVNDCMPGGHQCW-NRFANRHFSA-N 397.865 5.796 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@H](C#N)c2nc3ccccc3s2)c1 916847993 ZXZCWRISSYLPGK-RDJZCZTQSA-N 378.497 5.372 30 20 GKED N#C[C@@H](C(=O)CCC1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 916904761 INUDSONJAINGNW-FQEVSTJZSA-N 390.483 5.487 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917045987 FDVAAWYWRUFXMH-CXAGYDPISA-N 398.915 5.717 30 20 GKED CN(C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccc2ccccc2c1 920927021 FNHHAAVWJFWUAW-UHFFFAOYSA-N 398.491 5.427 30 20 GKED CCc1ccccc1Oc1ccc(Cl)cc1C=NNc1ccccc1C(=O)O 1776031258 VSZJDOWVTNKREV-UHFFFAOYSA-N 394.858 5.839 30 20 GKED N#Cc1ccc(NN=Cc2ccc(-c3cccc(C(=O)O)c3)s2)cc1Cl 1776054557 XMVFOAVDWLCSBI-UHFFFAOYSA-N 381.844 5.084 30 20 GKED O=C(O)Cc1ccc(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 1776084813 QLYAFHXWBUIGTB-KRWDZBQOSA-N 376.378 5.068 30 20 GKED O=C(O)[C@H](Oc1cccc(C=NNc2ccc(Cl)cc2F)c1)c1ccccc1 1776106595 MLLRWGUTCGGXLA-HXUWFJFHSA-N 398.821 5.130 30 20 GKED CC(C)(C#N)c1ccc(/C=C(/CC(=O)O)c2nc3cc(Cl)ccc3s2)cc1 1776230941 QHHCIRGHLHDVKW-ZROIWOOFSA-N 396.899 5.766 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)cc1 1777673492 ZWWVSHXYUVYOTI-PTNGSMBKSA-N 395.867 5.374 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccccc2)nnc1-c1ccc(Cl)cc1 11450206 GANULUZVYQHGGC-CQSZACIVSA-N 383.904 5.148 30 20 GKED Cc1cc(S[C@@H](C)C(=O)N(CCC#N)c2ccc(F)cc2)nc2ccccc12 23410267 GUHRYVLRXKSRJR-INIZCTEOSA-N 393.487 5.110 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc4c3CCCC4)n2)cc1 54251830 PNEXNPOQKSYQAI-MRXNPFEDSA-N 378.522 5.549 30 20 GKED N#CCCCOc1cccc(NC(=O)c2sc3cc(F)ccc3c2Cl)c1 55569133 FEYDWTXOSJPEHX-UHFFFAOYSA-N 388.851 5.629 30 20 GKED CC(C)OCc1ccccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 66954310 IYIQNNRECIJUEO-QGZVFWFLSA-N 397.544 5.328 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nnc(-c2ccccc2)o1 72030865 KPHPTWHQTIUOBC-MRXNPFEDSA-N 382.423 5.574 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1ccc(SC(F)F)cc1 105723254 JKAYFZMPTRLQPM-UHFFFAOYSA-N 380.419 5.048 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1ccc(F)cc1F 108533503 NDWOEKURAIIPGB-CHWSQXEVSA-N 375.444 5.099 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C34CC5CC(CC(C5)C3)C4)n2)cc1 108977982 XFXZQUILZCAOGT-HAVBXNNZSA-N 392.524 5.211 30 20 GKED Cc1nc2ccc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)cc2o1 119290008 NFWACHULMNWRRQ-UHFFFAOYSA-N 399.475 5.553 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc(-c2ccncc2)cs1 128874899 BFXDHTXCLUAMPA-LJQANCHMSA-N 389.480 5.017 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 152577177 PUFWRNHFIOWTKQ-UHFFFAOYSA-N 395.503 5.562 30 20 GKED CC[C@@](C)(NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nccs1 159078442 WQKUJJIGZHJQOR-OAQYLSRUSA-N 392.484 5.254 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(CCC(F)(F)F)cc1 159194640 RKUUFWKGIIGXTI-WOJBJXKFSA-N 386.417 5.093 30 20 GKED N#C[C@H](C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)c1nc2ccccc2o1 178763590 FAAFAIFBHWOISK-QGZVFWFLSA-N 397.365 5.265 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H](C)c1ccccc1 183333432 XSGBIKMZGLFCPE-SJORKVTESA-N 384.570 5.556 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)c1ccccc1 188044627 UZYGBDLQVXTPDV-IDISGSTGSA-N 383.557 5.422 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCCc2nc(C)sc21 191490567 XFLCERJMEWQZJF-IBGZPJMESA-N 383.561 5.845 30 20 GKED COc1cc(CNc2ccc(CC#N)cc2)ccc1OCc1ccc(F)cc1 237261897 DVCQHHDHSPSHNE-UHFFFAOYSA-N 376.431 5.091 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 302934529 HDTHBVLMBUFZEJ-IBGZPJMESA-N 376.378 5.166 30 20 GKED C=CCN(CCc1ccccc1)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 303084732 XDDVVVKVBVJIHN-UHFFFAOYSA-N 394.902 5.185 30 20 GKED N#C[C@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccccc1Cl 329385536 SARGBLNYZSBGED-JXFKEZNVSA-N 396.922 5.368 30 20 GKED O/C(CC1CCCC1)=N/C1CCC(c2nc([C@H]3CCCCS3)no2)CC1 329503488 APSVMNODWAVAAQ-OFLPRAFFSA-N 377.554 5.591 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc23)c1 409779502 KXVORQCHGYABTA-MSOLQXFVSA-N 378.378 5.055 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(OCc2csc(C)n2)c1 410355224 QHDRHONHPXLJOS-UHFFFAOYSA-N 378.497 5.401 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cnc(-c4ccccn4)s3)c2C#N)[C@H](C)C1 410977950 LBQUUKZQOPDHGV-NWDGAFQWSA-N 394.525 5.076 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(OCC(F)(F)F)cc1 426134204 SBGUAQGESCLQCX-NSHDSACASA-N 397.784 5.035 30 20 GKED N#C[C@H](C(=O)c1c[nH]c(C(F)(F)F)c1)c1nc(-c2ccc(Cl)cc2)cs1 429685177 VTBPQNHISHBSPG-GFCCVEGCSA-N 395.793 5.300 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)s1 430595384 XPDSUEWUEREBPD-HNNXBMFYSA-N 395.553 5.671 30 20 GKED N#CCC1(CNC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 431157189 RTDWAFBXCHCPAJ-UHFFFAOYSA-N 375.255 5.209 30 20 GKED CSC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 432768045 JPDPYSTZUOPAAC-GOSISDBHSA-N 395.528 5.266 30 20 GKED CCSc1ccc(Cl)cc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 437392801 QCBMCQOLCMYUNY-CYBMUJFWSA-N 384.810 5.356 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(OC2CCCC2)c(F)c1)c1ccccc1 439382830 DUPIAVOYHMYRBI-FQEVSTJZSA-N 381.451 5.314 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1cccc(NC(=O)c2ccccc2)c1 439429647 IROUALCSBBFTTD-MRXNPFEDSA-N 389.886 5.315 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(Cl)cc1Cl 440577404 BJOWWUJYWYFEMO-NSHDSACASA-N 380.300 6.032 30 20 GKED Cc1nc(-c2ccc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)cc2)cs1 440759807 YCGHCTZNTWDJHO-UHFFFAOYSA-N 375.497 5.293 30 20 GKED CCCOc1ccc(-c2csc(NC(=O)c3c(F)cc(C#N)cc3F)n2)cc1 445676906 UFSLIAQJHOECMQ-UHFFFAOYSA-N 399.422 5.001 30 20 GKED COc1ccc(CC(C)(C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 446145425 PUUFIGLCDKQGCD-INIZCTEOSA-N 397.544 5.232 30 20 GKED COc1cc(CNc2ccc3c(c2)CCC(=O)N3CCCC#N)cc2ccccc12 449272677 OAXKTXBVSQKNJO-UHFFFAOYSA-N 399.494 5.043 30 20 GKED C=CCC1(c2nc(CC(=O)Nc3ccccc3C(F)(F)F)no2)CCCCC1 453159708 FNHJEVREVJOPDV-UHFFFAOYSA-N 393.409 5.048 30 20 GKED C[C@@H](NCCC(=O)Nc1sccc1C#N)c1ccc(Cl)c2ccccc12 462473573 KVLZUFZLGUSQRL-CYBMUJFWSA-N 383.904 5.106 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc3cc[nH]c23)cc1 463283697 OJIDALSYONHPQM-UHFFFAOYSA-N 383.426 5.021 30 20 GKED N#CCCCn1cc(C(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)c2ccccc21 469553562 FCBRZBMJYLGZOC-CRAIPNDOSA-N 391.437 5.044 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C)c(C(=O)N2CCCCC2)c1 470471201 VBLRSLVTHKUJPH-UHFFFAOYSA-N 394.540 5.152 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)cc1)c1ccccc1 472501680 ODRGAKLCEUKLOG-UWJYYQICSA-N 395.462 5.203 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 476120202 KJMBZCJFRIGETE-WMZHIEFXSA-N 398.506 5.627 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1cccc2c1CN(c1ccccn1)C2 482003790 VOIWBXMMDIBIGJ-HSZRJFAPSA-N 380.495 5.353 30 20 GKED C=CCC[C@H](C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccccc1 488820731 UUUBHJSWVCWSQU-WQYPUDFKSA-N 388.555 5.048 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(Cl)cc1Cl 498450802 QNMHFTQKEQUDNB-UHFFFAOYSA-N 375.299 5.236 30 20 GKED CCOc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1C 503501019 CIMVNEWYORUCRM-SFHVURJKSA-N 376.481 5.316 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3cccc4ccccc34)n2)cc1 505462144 PEJIAAZGSNFUSA-IBGZPJMESA-N 383.476 5.518 30 20 GKED N#Cc1cnc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c(Cl)c1 505601480 GIYSIKWSEQNAQX-UHFFFAOYSA-N 399.885 5.131 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@H]2c2ccsc2)c1 513463593 OHGPEGDLIRXJPQ-NRFANRHFSA-N 388.492 5.176 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2cccc(-c3ncco3)c2)c1 514067150 HZMIVCBSQLMVRO-UHFFFAOYSA-N 381.435 5.404 30 20 GKED N#Cc1c(NC(=O)c2ccc(-c3cnco3)cc2)sc2c1CCCCCC2 515676274 ATRBNSXJRFTHBU-UHFFFAOYSA-N 377.469 5.186 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1C(C)C 517455431 IDKNCYUZXZVDSM-FUHWJXTLSA-N 396.556 5.776 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c2ccc(C)cc2)cc1 518005553 WCMIGBSHVUYICA-UUOWRZLLSA-N 399.494 5.025 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)oc2c(Cl)cccc12 518738825 AOXOOSYLGZJFJN-GFCCVEGCSA-N 384.888 6.041 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 519913436 YNXGSRKZHZZCCQ-GFCCVEGCSA-N 392.286 5.489 30 20 GKED C[C@H](Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)C(=O)Nc1ccccc1C#N 521107971 PSPPLHDIXQDCNT-KGVIQGDOSA-N 391.515 5.093 30 20 GKED CCc1c(C)sc(NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)c1C#N 524330653 XUMOYPHAODGSNF-UHFFFAOYSA-N 394.496 5.319 30 20 GKED N#Cc1ccsc1C(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 524627685 BPNRBRGODJULMQ-JISUQADQSA-N 393.537 5.034 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1COC(C)(C)C 539138104 ZPCDXTIAEVCASK-INIZCTEOSA-N 382.529 5.506 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@H]1CCCCS1 544222787 VORVGCLEQKCHHF-LJQANCHMSA-N 381.501 5.066 30 20 GKED N#CCCCn1cc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c2ccccc21 553296843 SQRRIKJRQQYOFQ-QFZWGZQFSA-N 397.522 5.353 30 20 GKED C=CCC[C@@H](NCC(=O)Nc1c(F)cccc1F)c1ccc(C(F)(F)F)cc1 557571297 BMCOPYYQDSSDFH-QGZVFWFLSA-N 398.375 5.219 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC(CC(F)F)C2)cc1Cl 564887066 RWELLIMKSPHNHI-QGZVFWFLSA-N 389.833 5.114 30 20 GKED Cc1cc(C(=O)N2CCC(C)CC2)ccc1NCc1ccc(F)c(C#N)c1Cl 570745957 PLKHCTIVRWTJKI-UHFFFAOYSA-N 399.897 5.143 30 20 GKED N#CCCCn1cc(-c2nc(COc3ccc(Cl)cc3)no2)c2ccccc21 580480713 FCCMSALBQOGHGE-UHFFFAOYSA-N 392.846 5.227 30 20 GKED Cc1sc(NC(=O)c2ccccc2SCc2cccs2)c(C#N)c1C 590613337 MZZDKJDZYCYZDT-UHFFFAOYSA-N 384.551 5.843 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2ccc(Br)cc2)cc1 603737838 PNGVJTHILZPEHR-UHFFFAOYSA-N 385.305 5.167 30 20 GKED N#Cc1c(NC(=O)COc2ccc(Cl)cc2)sc2c1-c1ccccc1CC2 603991509 AJZWMYFJYWDXBM-UHFFFAOYSA-N 394.883 5.056 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N(C3CC3)[C@H]3CCc4ccccc43)o2)cc1 609058362 NFOMTNJSYKKZQB-QHCPKHFHSA-N 398.462 5.022 30 20 GKED C[C@H]1CCC[C@](C#N)(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)C1 609735239 DTOWJJPYLHLJPB-RBZFPXEDSA-N 381.526 5.227 30 20 GKED Cc1nc(-c2cccc(-c3noc(-c4cc5ccccc5n4CC#N)n3)c2)cs1 612938487 YAEVOWRGNJIIPA-UHFFFAOYSA-N 397.463 5.314 30 20 GKED Cc1cccc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c(Cl)c12 613289538 CFQQNQHDFJRPJT-LLVKDONJSA-N 382.897 5.963 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 619726855 UYRARAIHJMUVNJ-YUSALJHKSA-N 391.302 5.412 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)cs2)cc1 647376903 BEZGJSMGOADAAE-HNNXBMFYSA-N 395.509 5.033 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCO[C@@H](c2ccccc2)C1 682777830 SMWPXFIOODEAQQ-JOCHJYFZSA-N 378.516 5.534 30 20 GKED C=CCn1c(C2CC2)nn(CN2Cc3ccccc3-c3ccccc3C2)c1=S 726186618 WFRLTJVBHGGPPU-UHFFFAOYSA-N 388.540 5.118 30 20 GKED C#Cc1ccc(C(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)cn1 728797347 FUCTVGKVYWLKHF-UHFFFAOYSA-N 381.460 5.106 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nc(C)cs1 729553298 NYATZLAFNDTJQP-VQTJNVASSA-N 390.512 5.380 30 20 GKED C=C(C)COc1cc(/C=C/C(=O)c2c[nH]c3ccc(OC)cc23)ccc1OC 734307615 PSKQHAPOVWQBTF-WEVVVXLNSA-N 377.440 5.036 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCc3cccc(OC4CCCC4)c3)[nH]c12 735790882 ROBNQWAZGVHFHE-FQEVSTJZSA-N 387.483 5.002 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1c(Cl)nc2ccccn12 737424303 FLRJTLOAXCRFON-UHFFFAOYSA-N 389.073 5.179 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3c(Cl)nc4ccccn34)cs2)c1 737448476 HXMDBNIGMUPPJW-HJWRWDBZSA-N 395.871 5.016 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)Cc3ccc(OCC#N)cc3)s2)cc1 739923788 LEKADKIFPAZNBJ-SFHVURJKSA-N 391.540 5.522 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccccc3Cl)nc2)cc1 746592805 GOKHIVXZZWBWBJ-UHFFFAOYSA-N 391.858 5.396 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1cccc(Cl)c1 750682395 YJENLSJQPNYZPC-ADYSOMBNSA-N 376.843 5.125 30 20 GKED CCc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)s1 750842188 BSBLCVFDOCVIGR-UHFFFAOYSA-N 378.453 5.235 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(-c4ccc(F)cc4)s3)cc12 750906518 RYZFWUBSIVZVQT-FPYGCLRLSA-N 377.444 5.040 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cccc(C(F)F)c1Cl 754483872 YGEVZNVTIJCGBA-UHFFFAOYSA-N 375.762 5.094 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 760182486 WVZLIPSGNMPAEC-HXUWFJFHSA-N 384.479 5.409 30 20 GKED C=CCn1c(SCc2nc(Cl)ccc2Cl)nnc1-c1cccs1 762479129 KKBIZTPTLJPOFH-UHFFFAOYSA-N 383.329 5.187 30 20 GKED COc1ccc(CN[C@H](C)c2ccc3ccccc3c2OC(F)F)cc1C#N 773072558 ANAZTXLEZUDPGO-CQSZACIVSA-N 382.410 5.172 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@H](C#N)CCc1ccccc1 774091638 VBXNVRSMRLYXFJ-REWPJTCUSA-N 398.506 5.255 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3ccc4[nH]ccc4c3)c2)s1 775754627 ZBPZPKYZIOIMAW-UHFFFAOYSA-N 385.492 5.017 30 20 GKED CC(=O)N1C/C(=C/c2sc3ccccc3c2Cl)C(=O)c2ccccc2C1 778520330 UNUMGMAWGDOKQY-GDNBJRDFSA-N 381.884 5.183 30 20 GKED C=CC[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1 778739639 WFECQRZUQHSLMX-HSZRJFAPSA-N 383.447 5.015 30 20 GKED C#CCCCCCC(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 780258484 LWCLKRDIVJBQFA-UHFFFAOYSA-N 398.528 5.071 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 780672705 IELJWZLTYIULNV-VBKZILBWSA-N 383.879 5.294 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1ccc(Cl)nc1C(F)(F)F 787254678 IEUXJDZGBJHSSV-HZPDHXFCSA-N 379.813 5.026 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792095255 KDAVPYJAZMYBTE-KSSFIOAISA-N 382.385 5.624 30 20 GKED N#CC[C@@H](CC(=O)O[C@@H](C(=O)c1ccccc1)c1ccccc1)c1ccccc1 795988242 FXWYIJHRMADPGU-WIOPSUGQSA-N 383.447 5.241 30 20 GKED N#C[C@H](C(=O)/C=C\Sc1cc(F)ccc1F)c1nc2cc(F)ccc2s1 797947206 ACGHTWSHGVTYFR-FOQNGQEVSA-N 390.411 5.196 30 20 GKED N#CC1(c2ccccn2)CCN(C(=S)Nc2ccccc2-c2ccccc2)CC1 799899621 CFOVIAAFYXWGGP-UHFFFAOYSA-N 398.535 5.003 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1cccc(CSc2ccccn2)c1 806248788 NTDJNIWCKHZDFM-UHFFFAOYSA-N 387.508 5.041 30 20 GKED C#C[C@@H](NC(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccc(Cl)cc1F 806373991 OJPMQSSLKDWBRV-SJKOYZFVSA-N 388.874 5.020 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211230 GIOGMWSKSUOCGY-WMZOPIPTSA-N 390.405 5.258 30 20 GKED Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1sc2ccc(C#N)cc2c1C 815645697 NFUJQNUUWJCJMH-UHFFFAOYSA-N 385.832 5.204 30 20 GKED CCOP(=O)(CCC=NNc1cc(C)c2ccc(C)c(C)c2n1)OCC 834934936 KXQSJHFLEHWOEO-UHFFFAOYSA-N 377.425 5.214 30 20 GKED C=CCc1ccc(OCc2nc(-c3ccc(C(F)(F)F)s3)no2)c(OC)c1 904975888 IBLXORQKODJDJQ-UHFFFAOYSA-N 396.390 5.133 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(F)cc2Cl)cc1 915088040 ZLPXJYYKTLLOFL-KRWDZBQOSA-N 382.797 5.526 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1 915802355 SXPGXKBPOIGMEG-UHFFFAOYSA-N 386.432 5.469 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 916847429 IAQOVBOANGIZLR-GOSISDBHSA-N 390.508 5.334 30 20 GKED Cc1cc(C)cc(C2(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)c1 917119615 PAVUDMQHKXEJTD-DEOSSOPVSA-N 380.491 5.629 30 20 GKED Cc1c(NN=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)cccc1C(=O)O 1776087449 CRLGQHXLJGGOLS-UHFFFAOYSA-N 388.345 5.418 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)C(=O)c2ccccc21 1776308877 ULLVQDNTGXSEOK-PSXBWXLBSA-N 388.419 5.370 30 20 GKED CC(/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C)=C\c1cc(F)cc(F)c1 1776398733 FUZOINADDWBLAL-SITOFEAGSA-N 386.394 5.293 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)c1)C(=O)O 1776470904 LPFGBHWPCMMZGU-MARXPDLDSA-N 396.826 5.348 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)cc1 1777472302 MQZGUGIQXOBCEC-QPEQYQDCSA-N 390.410 5.307 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C(C)C)cc2)=C(\S)Nc2ccccc2)cc1 27183903 ISNNRKCXFQEOEF-UHFFFAOYSA-O 389.544 5.457 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3oc4c(c3C)C(=O)CCC4)n2)cc1 51154748 UUTVYOJBKHBTHK-HNNXBMFYSA-N 390.464 5.029 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(Cl)cc2F)cc1 60347598 DECVPOKBKZNXGC-UHFFFAOYSA-N 396.805 5.404 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(C(F)(F)F)c1 66955500 DEYDSLAUXAFFTC-CYBMUJFWSA-N 393.434 5.421 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 68225927 LNILSQZOSZADSZ-DLEKYWELSA-N 387.508 5.015 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)n1 102115485 FPYAUBPUBAFCNR-GFCCVEGCSA-N 393.415 5.084 30 20 GKED CCCCCCCCC(=O)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 110349984 XHMROPCUXHGPIG-SFHVURJKSA-N 387.499 5.332 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 112149389 UEGXVSFCFOAUHS-UKRRQHHQSA-N 382.435 5.143 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)c1cccc(O)c1 112421103 AVNABNBKRZTWCD-MRXNPFEDSA-N 387.439 5.247 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)C1(c2cccc(C(F)(F)F)c2)CC1 112521021 LUOMZEYAFARNAN-UHFFFAOYSA-N 391.286 5.534 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc(-c2ccncc2)cs1 114620894 HQSKNULGUHAYAU-IBGZPJMESA-N 389.480 5.017 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(c2c[nH]c3ccccc23)CC1)c1ccccc1 151373927 QIBYOGBZIBRLQN-JOCHJYFZSA-N 386.499 5.102 30 20 GKED CCc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)oc1CC 152709849 FAAPKIDUNBGEOW-UHFFFAOYSA-N 375.428 5.024 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)C(C)(C)C#N 173784337 NOCMBUSZSKWJJJ-UHFFFAOYSA-N 378.451 5.220 30 20 GKED N#C[C@H](C(=O)c1ccc2ccc(Cl)cc2n1)c1nc2ccccc2n1C(F)F 176462486 ONQJKSLQCNIDSF-CYBMUJFWSA-N 396.784 5.123 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)c1nc2ccccc2o1 182308041 TYIVJJJWHJXKJC-HNNXBMFYSA-N 376.485 5.049 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cccc(Br)c1Cl 183328347 GTEGRZXVYUJKBM-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1nc(C2CC2)no1)C(C)C 191514703 OERDXEHQOQRNQI-GOSISDBHSA-N 382.508 5.318 30 20 GKED C=CCn1c(SCc2csc(CCCC)n2)nnc1-c1ccccc1F 195558314 GSOODCANEBDJNG-UHFFFAOYSA-N 388.537 5.362 30 20 GKED Cc1cc(F)cc2c(N[C@@H](c3cccc(F)c3)c3ccccn3)c(C#N)cnc12 301899089 STWJSWGQLNTWLV-QHCPKHFHSA-N 386.405 5.290 30 20 GKED CC(=O)N1CC[C@H](/N=C(/O)c2oc3c(C)ccc(C)c3c2C)c2ccccc21 328850190 ZAMMZMXCEIGYHF-SFHVURJKSA-N 376.456 5.161 30 20 GKED N=C(O)C1CCC(/N=C(/O)Cn2c(C3CCCCC3)nc3ccccc32)CC1 328866460 GQLJGJPHEAMJHD-UHFFFAOYSA-N 382.508 5.135 30 20 GKED Cc1nc(N=C(O)[C@H]2CCC(=O)[C@@H](C)C2)sc1Cc1ccccc1Cl 328893222 ACWFMCWJCQHEDK-FZMZJTMJSA-N 376.909 5.289 30 20 GKED CC[C@H]1OCCC[C@H]1C(O)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 330245274 KPFVWONLTQDCDC-VQIMIIECSA-N 376.472 5.787 30 20 GKED Cc1ccc(Br)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 429862625 RRXGHQSGHRHFEM-UHFFFAOYSA-N 385.286 5.405 30 20 GKED Cc1c(Br)cccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430578297 ARILRGLRTCHKJX-LBPRGKRZSA-N 377.307 5.002 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc(Cc3cccc(F)c3)n2)s1 430599934 QYHWFMWKAHEOPH-CQSZACIVSA-N 399.516 5.117 30 20 GKED CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 432857755 FUFBLDNDNOGGFT-HRAATJIYSA-N 399.535 5.938 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)Cc2ccccc2O1 433131786 LFGVZMMBXMQMGX-KRWDZBQOSA-N 399.450 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1cccc2ccccc12 435856373 NIZVYIJAFAZLGM-DLBZAZTESA-N 390.508 5.640 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccn2)cc1 438190569 ODJPCVAEGZLJLC-YADHBBJMSA-N 398.466 5.178 30 20 GKED Cc1cscc1NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 439399857 YIAXYWNOXKHOTJ-UHFFFAOYSA-N 381.432 5.290 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccncc1)c1ccc(F)c(Br)c1 442403900 BEEYLZDCTAJWAU-AWEZNQCLSA-N 391.284 5.119 30 20 GKED C=C[C@@H]1OCC[C@H]1C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 448803772 FKKRFUSNKJLYGD-QAPCUYQASA-N 377.362 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 455246875 OFFJAUBLRRTETE-RTWAWAEBSA-N 382.548 5.352 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458800390 LCMXTKGCVHJVOU-IBGZPJMESA-N 390.314 5.570 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)N[C@H](C#N)c3ccc(C(C)(C)C)cc3)cc12 463760249 NPKGPERADNJFEP-QGZVFWFLSA-N 394.544 5.050 30 20 GKED C[C@H]1CCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c2c(O)cccc21 468800928 BXYPAPZJFWZUBO-KRWDZBQOSA-N 398.462 5.405 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2CC(F)(F)F)c2ccccc21 469456621 ITTHATDOJAEXNE-UHFFFAOYSA-N 385.389 5.302 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccccc1 470438151 KTYHTVKTSCTMFN-NRFANRHFSA-N 378.516 5.164 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCO[C@H]1c1ccccc1 475571191 UXECLPUUDHOWKL-OFNKIYASSA-N 378.516 5.438 30 20 GKED C=CCOc1ccccc1CN[C@H](c1ccccc1)c1nc(-c2ccccc2)no1 475773253 PZWBFUSOKRSXPI-HSZRJFAPSA-N 397.478 5.181 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477509900 LIUCOTBYPITOCQ-UHFFFAOYSA-N 387.886 5.724 30 20 GKED C=CCN(Cc1cccs1)C(=O)NC1CC(F)(c2cccc(Cl)c2)C1 483504054 NGPILMQJPSZBJX-UHFFFAOYSA-N 378.900 5.127 30 20 GKED Cc1c(Br)cccc1-c1noc(-c2cccc(SCC#N)c2)n1 485873495 VDJUKQMRIILKQY-UHFFFAOYSA-N 386.274 5.090 30 20 GKED C=CCN(C(=O)C[C@H]1CCOC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 489274379 FISOJUMVFCIKRA-GFCCVEGCSA-N 397.327 5.063 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cccc2[nH]ccc12 494745463 LMAQEOLUCRVXCE-OAHLLOKOSA-N 378.501 5.084 30 20 GKED C=CCn1c(SCc2ccc(Cl)cc2Br)nnc1C1CC1 504548306 PZPFBFQOLISFAP-UHFFFAOYSA-N 384.730 5.050 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(C#N)ccc1Cl 505108387 LBFXTWOVDHSIQW-UHFFFAOYSA-N 382.769 5.272 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3c(s2)CCC3)cc1 505620782 PBGKQBDPQTYVDY-UHFFFAOYSA-N 390.464 5.162 30 20 GKED CN(Cc1cn(CCC#N)nc1-c1ccccc1)Cc1csc2ccccc12 506480274 ISOUQQAKXIVCQA-UHFFFAOYSA-N 386.524 5.310 30 20 GKED C=CCN(C(=O)c1cc2cc(Cl)ccc2o1)c1nc(-c2ccccc2)cs1 506867739 WPUNMZJNOWYRLO-UHFFFAOYSA-N 394.883 6.043 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CCC(C)(C#N)CC1 506919408 SZEBUUOJAXNBPX-UHFFFAOYSA-N 397.450 5.093 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Sc3nc(-c4ccccc4)ccc3C#N)o2)cc1 510174039 XAAQQIJAQBCMHV-MRXNPFEDSA-N 398.491 5.832 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1 510659768 SEZNYZMTZWMBPA-UHFFFAOYSA-N 396.450 5.196 30 20 GKED N#Cc1cccc(C2(c3nc([C@@H](F)c4ccc(C(F)(F)F)cc4)no3)CC2)c1 512027367 UJXMLMSANQDIMR-INIZCTEOSA-N 387.336 5.099 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)n1 514360294 GAXBNAVTPQDOHF-DLBZAZTESA-N 389.524 5.081 30 20 GKED COCc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 515714971 GHNITMHMWVSQEJ-UHFFFAOYSA-N 392.842 5.403 30 20 GKED Cc1ccc([C@H](NCc2ccc(C#N)cc2F)c2ccc(F)cc2Cl)cc1 517456265 HZVMZGZIOVLIOI-QFIPXVFZSA-N 382.841 5.678 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cs1 519515840 YEKNKSXLJIXWPC-OAHLLOKOSA-N 393.537 5.765 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)o1 520829845 UUCQCVRHDYEFBP-QGZVFWFLSA-N 390.508 5.770 30 20 GKED N#CCCC[C@@H](NC1CC(c2cccc(Br)c2)C1)c1ccccc1 520851040 RKSQJKIRDGWVTE-DQVLVPHSSA-N 383.333 5.720 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)cc1 525349782 ZZAJJHHKULDJJO-UHFFFAOYSA-N 399.881 5.249 30 20 GKED N#CCc1ccc(NC(=O)N2CCc3c(cccc3C(F)(F)F)C2)c(Cl)c1 529110565 YWHHQBMAYFTJFX-UHFFFAOYSA-N 393.796 5.015 30 20 GKED N#Cc1ccccc1/C=C(\CC(=O)O)c1nc2cc(C(F)(F)F)ccc2s1 535890637 DKXNFJPPONDDMB-NTUHNPAUSA-N 388.370 5.202 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1coc(-c2ccccc2Cl)n1 537362274 HUDBLPHHPYRRGH-UHFFFAOYSA-N 393.874 5.165 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCCC(F)(F)F)cc2Cl)c1 539943705 URUPJWOELNWMIG-UHFFFAOYSA-N 396.796 5.462 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccccc1C(C)(C)C#N 544477593 BLLIXWDGDJQOJM-OAHLLOKOSA-N 393.531 5.910 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(C(F)F)c1Cl 544632729 YXUVDFQTZCENOZ-UHFFFAOYSA-N 395.793 5.406 30 20 GKED C[C@@H]1C[C@H](c2noc(-c3ccc(Sc4ccccc4C#N)cc3)n2)CCO1 547219941 LMGXTMIBHSICAP-GDBMZVCRSA-N 377.469 5.042 30 20 GKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1ccc(OCc2cccnc2)cc1 547833594 DUQLFQJGEPTYMU-MRXNPFEDSA-N 377.875 5.036 30 20 GKED C[C@@H]1C[C@@H](N[C@H](CCCC#N)c2ccccc2)c2cccc(Br)c21 550827079 JRIBLIHRQYETMM-CDHQVMDDSA-N 383.333 6.022 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1cnc(-c2ccco2)s1 551908039 TXYGEFBAVMLJFR-UHFFFAOYSA-N 385.448 5.122 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl 554242346 BBKKLPCQQYNMOD-CQSZACIVSA-N 397.371 5.687 30 20 GKED CC(C)C[C@@H](Cc1cccc(Br)c1)C(=O)NCC(C)(C)CCC#N 554662711 VWNDJUCXBAXJEA-KRWDZBQOSA-N 393.369 5.100 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)sc2ccc(C#N)cc12 556010402 XUELTXLNKUGTNO-INIZCTEOSA-N 399.397 5.095 30 20 GKED C=C[C@@](C)(CCOC)c1nc(-c2ccnc(Oc3ccccc3Cl)c2)no1 564248888 KMJRPPJSDMOPKG-FQEVSTJZSA-N 385.851 5.058 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 570545833 XVUHEDMIPRMHGV-HKUYNNGSSA-N 386.417 5.460 30 20 GKED C=CCN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)Cc1cccs1 588166984 QEVHHAKXDFPNGU-UHFFFAOYSA-N 380.300 5.293 30 20 GKED CC(C)(Oc1ccc(F)cc1)C(=O)Nc1sc(-c2ccccc2)cc1C#N 603969135 FRAKYCQLTSFQCP-UHFFFAOYSA-N 380.444 5.222 30 20 GKED C[C@@H](Oc1ccccc1)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378317 CBPZOCASEZBNTN-CYBMUJFWSA-N 394.418 5.117 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CSc3ccc(F)cc3)cc2)c1 609427160 GNSCOQHEMZUFFA-UHFFFAOYSA-N 378.428 5.220 30 20 GKED C[C@@H]1CCC[C@](C#N)(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)C1 609735241 DTOWJJPYLHLJPB-XCLFUZPHSA-N 381.526 5.227 30 20 GKED CC(=O)Nc1c(C)ccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1C 609987676 PKSXBNLBOXFSKY-UHFFFAOYSA-N 398.466 5.129 30 20 GKED C[C@@H](NC(=O)N[C@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 610138592 NWZMVMJFCMTXFL-UZUQRXQVSA-N 387.458 5.042 30 20 GKED C[C@H](NC(=O)NCCSCc1cccc2ccccc12)c1cccc(C#N)c1 610348987 MONPUULPQZESGV-KRWDZBQOSA-N 389.524 5.005 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 611299897 GEZVTBBDCLWESX-OAHLLOKOSA-N 391.858 5.198 30 20 GKED C[C@H](c1ccc(F)c(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618447755 BEOBIYLNSMYXGM-IEBDPFPHSA-N 377.731 5.603 30 20 GKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1OC(F)F 618804458 ADDMXCUYKYYGRS-SZNDQCEHSA-N 378.422 5.651 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(COCCOC)cc1 626534268 CUPYHDVJYATEQI-UHFFFAOYSA-N 382.504 5.346 30 20 GKED Cc1ccc(OC(F)F)c(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 678207845 FUJIVWZQIIGKIC-RYUDHWBXSA-N 391.302 5.159 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(SC(C)(C)C)cc1C 726081121 KKTFUWZILYYYMX-UHFFFAOYSA-N 393.556 5.977 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 728519049 YCGFMGNQENNHQG-UHFFFAOYSA-N 381.435 5.219 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(Cl)c(Cl)c3)cc2)c1 731331532 IKHHHYLOSYDYMF-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1ccc(CSCC(=O)O[C@@H](c2cncc(F)c2)C2CCCCC2)cc1 731774180 HKFOVCBBDIBFAA-JOCHJYFZSA-N 398.503 5.190 30 20 GKED O=C(/C=C/c1ncc(-c2cccc(Br)c2)[nH]1)c1ccccc1Cl 731937746 LNXVPTRQGIYAAK-CMDGGOBGSA-N 387.664 5.389 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C(C)(C)CCCc2ccccc2)c1 733770745 JJSCGHUSOCHOAB-OAQYLSRUSA-N 378.516 5.033 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C(C)C)c1ccncc1 734683659 ODQLDDOUAXKKFP-IBGZPJMESA-N 392.330 5.626 30 20 GKED N#C[C@@H](C(=O)/C=C\C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 735593384 KOTHSCSGAQMYDU-IBIZNAIESA-N 388.467 5.263 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 738896338 OCBOJWCOCNWBOJ-NLFFAJNJSA-N 397.522 5.745 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)/C=C/c2cnc(C(C)(C)C)s2)cc1 742657602 PQPQRUYHXCEABP-IENJSVCTSA-N 381.545 5.132 30 20 GKED Cc1ccc([C@H]2CCC[C@H]2N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 743004234 HQVGNGBLVPCVJB-UYAOXDASSA-N 383.948 5.485 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@]12CCc1ccccc12)c1nc2cc(Cl)ccc2s1 744036410 YGDSKAUXHRNMNF-ZJTDPSCFSA-N 378.884 5.030 30 20 GKED CC(C)Oc1ccccc1C=NO[C@H](C)c1nc(-c2ccc(Cl)cc2)no1 744444115 QYYCAYUMCVHTFL-CQSZACIVSA-N 385.851 5.289 30 20 GKED C=CC[C@H](N[C@H]1CCSc2ccc(Br)cc21)c1ccncc1 766018189 GFJNLWUPAANGIH-IRXDYDNUSA-N 375.335 5.288 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(NC(=O)OC(C)(C)C)c(C)c1 772470935 HWUPFUBRDOMPRT-UHFFFAOYSA-N 387.524 5.134 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1cnn(C(C)C)c1C 787187070 MMTSIJFUXYLWAV-ZHACJKMWSA-N 396.922 5.184 30 20 GKED CCC(CSc1ccc(Cl)cc1)=NNc1nnc(-c2ccccn2)s1 788031057 BXXGTQBPDBDISI-UHFFFAOYSA-N 389.937 5.224 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1csc2cc(C)ccc12 796631660 IAJKJTAZZCGRTD-SFHVURJKSA-N 390.508 5.296 30 20 GKED CC(C)(C)OCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 796798829 RFVOMJIGNNMSBO-OAHLLOKOSA-N 376.909 5.235 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C[C@H](c2ccccc2)C(F)(F)F)s1 797573149 OITKIPJPLOYKFR-ZIAGYGMSSA-N 380.435 5.353 30 20 GKED CC(/C=C/C(=O)c1cnn(-c2ccccn2)c1C)=C\c1ccccc1OC(F)F 811691534 NVLMPYCXKAGWAG-KZTCSYITSA-N 395.409 5.020 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1sc(-c2ccccc2F)nc1C 814821033 TZUNRNJIYYEYGG-UHFFFAOYSA-N 397.479 5.152 30 20 GKED CC(C)COc1ccc(C2(c3noc([C@@H](N)CCCCC#N)n3)CCCC2)cc1 848632639 VOYGUKDRUXBFKC-FQEVSTJZSA-N 396.535 5.048 30 20 GKED Fc1ccc(C=Nn2c(S)nnc2-c2cccs2)cc1-c1cccs1 917536317 NSTUGQUYNUVAFM-UHFFFAOYSA-N 386.502 5.045 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Nc2ccccn2)CC1 931062030 MZPUUZSQQIBRDW-UHFFFAOYSA-N 378.520 5.042 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1ccc(Oc2ccc(Cl)cc2)cc1 1776012596 XAZKOUHUWSUTJZ-UHFFFAOYSA-N 380.831 5.667 30 20 GKED CCCCOc1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)cc1OCC 1776033231 QOQJQPQCAQAXCT-UHFFFAOYSA-N 390.867 5.062 30 20 GKED Cc1cc(C=NNc2ccc(C(=O)O)c(F)c2)c(C)n1-c1ccc(Cl)cc1 1776073417 ULQRHVKQEAXOTI-UHFFFAOYSA-N 385.826 5.031 30 20 GKED CCCC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Oc2ccccc2)cc1 1776075718 ZDRWIFDXOOPFBD-UHFFFAOYSA-N 392.430 5.933 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776113852 WNJKDCADXDFIIP-PXLXIMEGSA-N 398.458 5.966 30 20 GKED C=CC[C@]1(C(=O)O)CCN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 1776161812 FPXDWFBZPCDUJF-QFIPXVFZSA-N 385.891 5.294 30 20 GKED C=CCOc1c(Cl)cc(/C=C\c2cc(C(=O)O)c3ccccc3n2)cc1OC 1776183188 XUDMGUVVNGVTOG-HJWRWDBZSA-N 395.842 5.330 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)c2cc(C)cc(C)c2)c1 1776787942 IWNLJZLMYCRPMX-HSZRJFAPSA-N 383.532 5.568 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cnc(-c3ccccc3F)s1)C2=O 1777682948 IEYLTUIDODCLNR-SDNWHVSQSA-N 393.439 5.250 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cc[nH]c3C)CCC2)cc1 1789625860 BUDNGOORPMRYSI-UHFFFAOYSA-N 393.531 5.063 30 20 GKED CC(C)c1ccc([C@H](NC(=O)CCc2ccc(C#N)cc2)c2cccs2)cc1 10762563 MFWXOTLKILIOKZ-DEOSSOPVSA-N 388.536 5.582 30 20 GKED C=CCN(C(=O)COC(C)C)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 64779144 FFRYSQAIBDZQHN-UHFFFAOYSA-N 392.524 5.421 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1)C(C)C 66801903 KGZYLLCUBLFDMP-GOSISDBHSA-N 395.572 5.563 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 66956026 SPDHXFLIAFMQIJ-GXTWGEPZSA-N 388.562 5.379 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 111766972 SGXFJXZPAAQWQV-NVXWUHKLSA-N 399.947 5.756 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128810178 YAOANUHTWMRVAV-IBGZPJMESA-N 391.496 5.120 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCOC2(CCCCCC2)C1 151062738 MTPOUPBJARMOGI-QGZVFWFLSA-N 387.549 5.038 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1Cl 180194528 NAJXGYBCZNGKAS-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 181586544 UQVNNGFQANJAOE-MOPGFXCFSA-N 399.966 5.089 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(CNc2ccc(Cl)c(C#N)c2)cs1 191836906 YLQRUVWHCBTBSK-UHFFFAOYSA-N 396.903 5.273 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc([N+](=O)[O-])c1 195693010 VUNJISTXECQBKN-UHFFFAOYSA-N 387.395 5.128 30 20 GKED N#C[C@H](C(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1)c1nc2ccccc2o1 249705263 MNIDWFCQCZBPOV-ARFHVFGLSA-N 399.475 5.364 30 20 GKED N#CCCn1ncc(C(=O)N2CCCC3(CCCCCC3)C2)c1-c1ccccc1 428618143 DWDVSRNHCGODRY-UHFFFAOYSA-N 390.531 5.040 30 20 GKED CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1cnn(CCC#N)c1-c1ccccc1)CC2 428940125 BRZLAZZXDWIHHJ-QHCPKHFHSA-N 398.510 5.004 30 20 GKED C[C@@H]1[C@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@H]1c1ccccc1 430418782 YGLDFUCPJVWIFG-MUEKUWCCSA-N 396.490 5.320 30 20 GKED Cc1nc(-c2ccccc2NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cs1 433780295 SJMQQQGGGHPMER-UHFFFAOYSA-N 388.496 5.187 30 20 GKED C[C@@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccc(C#N)cc1 435128547 FDDKZBTVRAFBLR-OAHLLOKOSA-N 383.442 5.052 30 20 GKED CC(C)Cc1ccc([C@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 437645581 KHYNXVYFEMIPQA-HSZRJFAPSA-N 388.515 5.294 30 20 GKED Cc1nc(-c2ccc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2)cs1 440485869 LSLSPDUHRBFLKP-UHFFFAOYSA-N 375.497 5.041 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OC4CCC4)cc3)n2)cc1 442881569 ZPHWIKKZFHWHIL-HXUWFJFHSA-N 399.475 5.103 30 20 GKED C=CCn1c(COc2ccc(C)cc2)nnc1S[C@@H](C)c1cccc(C#N)c1 442917039 FTOOFMAXKAZAON-KRWDZBQOSA-N 390.512 5.077 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)c(F)c1 445915189 AZBLRWKZYPWKJP-UHFFFAOYSA-N 376.790 5.064 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2cc(Cl)ccc2s1 447164994 DAPYYOJFDPVLEC-GFCCVEGCSA-N 398.768 5.598 30 20 GKED CCCn1ncc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C1CC1 454754326 NQSHRQGDDPSFGV-AWEZNQCLSA-N 383.521 5.066 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458799690 JSFXBILHVZDDIY-YHYVQYDKSA-N 379.479 5.353 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCC3CCOCC3)cc2Cl)cc1 463170089 FIFSAHZESOBOCA-UHFFFAOYSA-N 384.863 5.149 30 20 GKED N#C[C@@H](C(=O)c1cccc2cnccc12)c1nc(-c2ccc(Cl)cc2)cs1 466984464 ZZPRALNORPTLOT-SFHVURJKSA-N 389.867 5.502 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cncc(-c4ccc(Cl)cc4)c3)[nH]c12 467058974 KKSCKRFCHAIZEE-GOSISDBHSA-N 386.842 5.077 30 20 GKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 467606330 GDIJJUKGACWKKB-YJBOKZPZSA-N 379.460 5.011 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(Br)s1 471271836 GEOWSUGXSCRTRL-JTQLQIEISA-N 395.347 5.323 30 20 GKED C=CCCC1(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)CC1 474916010 SQWVOASNTQOQNQ-QGZVFWFLSA-N 377.488 5.254 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 475554375 ISPXRRXLKLZVSA-HXUWFJFHSA-N 382.479 5.713 30 20 GKED COc1ccc(CN[C@H]2CC=C(c3ccc(F)cc3)CC2)cc1OCCCC#N 478235615 SUYMRFJSBGYIAN-QFIPXVFZSA-N 394.490 5.243 30 20 GKED C[C@H]1CCCC[C@@H]1OCCNC(=O)c1ccccc1Sc1ccccc1C#N 481382544 IGMPRXLETVCFIH-PXNSSMCTSA-N 394.540 5.035 30 20 GKED Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)N[C@@H]1CCCCc2cc(C#N)ccc21 482010347 XEFHBLYRFNGDBN-ORAYPTAESA-N 390.453 5.052 30 20 GKED CCCN(CCCC(=O)Nc1c(C)cc(C)cc1C)Cc1ccc(C#N)cc1 485017907 ZJCHMDJGNVWBGP-UHFFFAOYSA-N 377.532 5.114 30 20 GKED C[C@@H](c1cccc(NCc2ccc(-c3ccccc3C#N)cc2)c1)N1CCOCC1 487351052 DVIWBOVGJJKMKG-FQEVSTJZSA-N 397.522 5.231 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc2ccc(=O)n(C)c2c1 489093846 WRAZRZXCSWYWNH-UHFFFAOYSA-N 375.472 5.034 30 20 GKED C=CC[C@H](C(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 495059647 NWTAARVIJPSCHJ-IBGZPJMESA-N 394.902 5.547 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2CCc2ccccc2)cc1 497653876 YLUFPGCQNQGPHY-JOCHJYFZSA-N 375.516 5.507 30 20 GKED Cc1cc(C(=O)Nc2ccccc2Oc2ccccc2)nn1-c1cccc(C#N)c1 502521655 RYNHAHXPALJVIY-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)C1CCC1 511310908 YGWXOIYYMVJRHX-QHCPKHFHSA-N 375.516 5.267 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1Cl 515109838 LUCJQJHRKQKBJI-UHFFFAOYSA-N 378.863 5.104 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Sc1nc2cc(Cl)ccc2o1 515178895 YTMLTXOMKIUQRM-GFCCVEGCSA-N 392.933 5.238 30 20 GKED CCOc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 517461987 XKNKHCUBFVEDFC-UHFFFAOYSA-N 394.418 5.362 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3Cc3ccccc3)c2)cc1 517905599 LIQKYNBMRTUWMA-QFIPXVFZSA-N 397.478 5.590 30 20 GKED CC[C@H](C)c1ccc(NC(=O)CNc2ccccc2SC[C@@H](C)C#N)cc1 519425156 VZMVLLPFFRQHTF-IRXDYDNUSA-N 381.545 5.502 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1cccc(C)c1C 523732044 NSPGYFPOWSQWDR-UHFFFAOYSA-N 384.479 5.421 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@H]2c2ccc[nH]2)c1 523948878 BAOWUXIMFATTFA-FQEVSTJZSA-N 391.858 5.309 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)cc1-c1ccc(F)cc1 532290377 PZVIKGBGGDMHRN-KRWDZBQOSA-N 389.455 5.537 30 20 GKED C=C[C@H](CC(=O)Nc1nc(-c2ccc(NC(C)=O)cc2)cs1)c1ccccc1 533943395 JJWCWPIMAQGNLB-MRXNPFEDSA-N 391.496 5.067 30 20 GKED CCN(C(=O)c1ccc(C)c(Oc2ccncc2)c1)c1ccc(C#N)c(Cl)c1 536972534 AOJBGRIFSRHAHZ-UHFFFAOYSA-N 391.858 5.374 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3ccccc3C(C)(C)C#N)cc2)cs1 537079370 OJUOOANOQWJWAV-MRXNPFEDSA-N 375.541 5.771 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4nc5c(F)cccc5[nH]4)cc3)cc2)CC1 539623426 ZMTNJKYKKZBKIU-UHFFFAOYSA-N 396.425 5.176 30 20 GKED N#CCCn1cc(CNc2cccc(C(F)F)c2Cl)c(-c2ccccc2)n1 544596794 YWYMUCOGYYLVTO-UHFFFAOYSA-N 386.833 5.667 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccccc3C(F)(F)F)CC3CC3)cc2)CC1 552717476 NHHFFGWGAVBHGH-UHFFFAOYSA-N 398.428 5.313 30 20 GKED Cc1c(C(=O)Nc2c(F)cccc2N2CCCC2)sc2ccc(C#N)cc12 559474706 ANRBLYBISBLXJN-UHFFFAOYSA-N 379.460 5.073 30 20 GKED COc1ccc(NC(=O)c2cc(C#N)ccc2Cl)c(OCc2ccccc2)c1 560659842 VYTYTVRCILGDQI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(CCC#N)CC1 574274643 MPGBWHTZOKODGN-UHFFFAOYSA-N 388.471 5.207 30 20 GKED C=CCn1c(SCc2cc(Cl)cc(Cl)c2)nnc1-c1ccccn1 584022475 QXILIPBPWDFRRX-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C/C(=C/c1ccc(C)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 588401968 JXMQNBNLUPJLFV-TUOAVLBBSA-N 383.476 5.270 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1 589739575 VQTNTZADRUJKKQ-LJQANCHMSA-N 389.499 5.534 30 20 GKED C=CCCC(C)(C)NC(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 596749623 OOEBXRBAWBTYGN-HHHXNRCGSA-N 384.545 5.002 30 20 GKED CCCOc1c(Br)cc(/C=C/c2ccc(C#N)cn2)cc1OCC 603894189 UCEFPSFZFWUPRN-FNORWQNLSA-N 387.277 5.074 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)NCc3cccs3)cc2Cl)c1 609079514 BJASKZVFHZXVFN-UHFFFAOYSA-N 397.887 5.174 30 20 GKED Cc1cccc(C)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723407 PLPFDUQOTRVMJU-UHFFFAOYSA-N 376.843 5.873 30 20 GKED CCC(CC)c1cc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)on1 610172331 RRTNFRNOTHYAKD-UHFFFAOYSA-N 391.496 5.529 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)sc2C)cc1 613290718 KLUGPJUOIPVIHD-FQEVSTJZSA-N 398.487 5.770 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(Br)cc3ccccc23)cc1 730214893 RTJZALYNPVEUEB-UHFFFAOYSA-N 393.284 5.471 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730417011 KQRQLQCQIKMPIN-DGCLKSJQSA-N 388.851 5.041 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)n1 730684983 DUMXGGRTQONMAK-RBBKRZOGSA-N 390.508 5.572 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cccnc2Cl)c1 735032103 RQLFSETYMFCOIJ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)c1ccccc1SCC#N 735272780 HDMIOUWSPWSTEG-UHFFFAOYSA-N 388.492 5.442 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)cc1 736955090 FAGMBFZCNSFSGL-DHIUTWEWSA-N 399.494 6.084 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)CC/C1=C\c1cccc([N+](=O)[O-])c1 743056070 BTAJWIPILGWFFX-MGYAYREDSA-N 399.406 5.007 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744036965 LIUPTNKXNIVRAD-HNAYVOBHSA-N 378.472 5.394 30 20 GKED N#Cc1ccccc1CN(C(=S)Nc1ccc(F)c(Cl)c1)C1CCCC1 747706537 OHENLBHVVRVOLD-UHFFFAOYSA-N 387.911 5.492 30 20 GKED Cc1ccc(SC2(CNC(=O)c3ccccc3SCC#N)CCCC2)cc1 750857269 FEGHVQVINIVUQH-UHFFFAOYSA-N 396.581 5.446 30 20 GKED COc1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)cc1OC 750917801 XLNSQNBXIWNIBH-NTEUORMPSA-N 376.424 5.231 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 751221445 OWPKHGONPKSLSH-JNKARSBBSA-N 393.405 5.011 30 20 GKED N#Cc1cc(F)c(C(=O)O[C@@H]2CCCc3nc(-c4ccccc4)sc32)c(F)c1 755343640 CZXKWYQSXQVHRA-QGZVFWFLSA-N 396.418 5.194 30 20 GKED CC(C)C[C@@H](C)OCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 756231467 MOKBOFZMPWZXCX-RHSMWYFYSA-N 390.936 5.481 30 20 GKED C=C[C@H](CC(=O)Oc1ccc(C2SCCS2)cc1OC)c1ccccc1 759188536 FRMGJCYWPSZPDQ-OAHLLOKOSA-N 386.538 5.439 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccc(OCC4CCCCC4)cc3)o2)c1 760453915 BIAMTASWAZZBCJ-UHFFFAOYSA-N 388.471 5.179 30 20 GKED N#CCCCn1cc(C(=O)OCc2cc(Cl)nc(Cl)c2)c2ccccc21 769547512 UZVMMVOGRCTAEN-UHFFFAOYSA-N 388.254 5.004 30 20 GKED CCCN(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 770111479 RRIPWYSIEMMKJD-LJQANCHMSA-N 375.497 5.146 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(Cl)cc2)C(C)C)ccc1OC 774449645 PPBVBFCGZSGRNK-SIKLNZKXSA-N 386.923 5.516 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1O[C@H](C)C#N 780669237 ACDLILSRRMGZGQ-CQSZACIVSA-N 391.393 5.050 30 20 GKED C=CCc1cc(CN[C@@H]2CCCSc3ccc(OC)cc32)cc(OC)c1OC 783243355 AAKURNUCGKYNBZ-HXUWFJFHSA-N 399.556 5.158 30 20 GKED CC(C)Cc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)c1 796892405 YHEYWFHVERUNHL-UZLBHIALSA-N 389.524 5.384 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1)C[C@H](O)c1ccco1 800579233 ZDKXWXVUQXALGM-QFIPXVFZSA-N 390.483 5.166 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2cc([N+](=O)[O-])ccc2F)cc1 814191773 SXPSQUDULWUGNH-MDWZMJQESA-N 377.371 5.306 30 20 GKED C=CC[C@@H](NC(=O)c1cc(Br)c2ccccc2c1)c1ccncc1 815623152 OYYGVWNWVKFUSK-LJQANCHMSA-N 381.273 5.045 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(-c2ccc(F)cc2Cl)n1 816802589 RGSPKLVGPSRUJS-UHFFFAOYSA-N 397.862 5.409 30 20 GKED Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCCN1C(=O)CC1(C#N)CCCCC1 830132504 TXZAIPOUPDSDDK-KRWDZBQOSA-N 390.959 5.029 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 836497743 VHOKYQNWVUDABH-CWTRNNRKSA-N 387.842 5.043 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(Br)nc1C 841197746 MHFSCGKMBHRMKV-UHFFFAOYSA-N 379.323 5.318 30 20 GKED O=[N+]([O-])c1ccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)c(F)c1 853397012 SPXHYNJATMNGMM-UHFFFAOYSA-N 375.244 5.187 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(F)c1Br 864006446 VOFFFYXLOSFFBX-GFCCVEGCSA-N 379.298 5.595 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cccc(C(F)(F)F)c2)S1 915848294 HMVZJPXLYSWQEQ-GDNBJRDFSA-N 376.403 5.214 30 20 GKED O=C(Nc1cccc(C=NNc2ccccn2)c1)c1ccc(Cl)cc1Cl 916276180 OFOXJRKKYVBYJR-UHFFFAOYSA-N 385.254 5.087 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4ccccc4)CCC3)n2)cc1 920142842 MQKPRWLJCFQWEV-LJQANCHMSA-N 388.492 5.117 30 20 GKED O=C(O)[C@@H](Oc1cccc(C=NNc2cccc(F)c2Cl)c1)c1ccccc1 1776093468 SRBMZBQXPVKFRJ-FQEVSTJZSA-N 398.821 5.130 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(O)c(C(=O)O)c2)cc1 1776125830 TXSZDHOHQLISES-NTUHNPAUSA-N 382.456 5.336 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(Oc3ccccc3)c2)cc1CC(=O)O 1776131776 HZDGNWYECZBKAC-BENRWUELSA-N 388.419 5.011 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Br)c(C)s1 1776784234 YNZGCJVZPNLKHS-CYBMUJFWSA-N 376.360 5.112 30 20 GKED N#Cc1c(NC(=O)CCSc2ccc3ccccc3n2)sc2c1CCCC2 14071626 TYHABBNQEZITNF-UHFFFAOYSA-N 393.537 5.168 30 20 GKED COCc1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)oc2ccccc12 41536970 YUAXMHFHSNDHSR-MRXNPFEDSA-N 388.448 5.193 30 20 GKED C[C@@H](c1ccccc1)n1c(SC[C@H](C#N)CCC#N)nnc1-c1ccccc1 51423555 CQYZCBQTRKFTHG-ROUUACIJSA-N 387.512 5.090 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 60016459 MBWQUUZEGCHJKJ-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)N(C)[C@H]1CCCc2ccccc21 66861088 KCSLGXSEUVWYCL-UTKZUKDTSA-N 393.556 5.029 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccc2ccccc2c1 78714234 GQSCEOUQFLRUNU-INIZCTEOSA-N 376.481 5.252 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 108528755 OBIBZNOZUUAUFQ-OXQOHEQNSA-N 379.529 5.616 30 20 GKED N#Cc1cc(F)ccc1CSc1nnc(-c2ccc(F)cc2)c2ccccc12 112530248 MLLSOFUSJOKXPR-UHFFFAOYSA-N 389.430 5.739 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc(-c2ccncc2)cs1 114619269 NXPQBAIRTSVSCC-MRXNPFEDSA-N 389.411 5.094 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)c2)c1 132099680 BMNFCJWTNCHUHI-HXUWFJFHSA-N 396.475 5.066 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCCCCC(F)(F)F 156124961 WBOVDAIPPGVKMI-CYBMUJFWSA-N 390.496 5.485 30 20 GKED C=CCN(C(=O)C[C@@H](C)c1c(C)noc1C)c1nc(-c2ccccc2)cs1 156180592 WPBRLVGBHJVEHN-CQSZACIVSA-N 381.501 5.128 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H]1C[C@H]1c1sccc1C 161422706 MMNLMNWVAVKMRL-MSOLQXFVSA-N 389.480 5.166 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1F 170673846 VWCPWBUAFZSVAC-KDOFPFPSSA-N 389.455 5.191 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1cccc(O)c1 171307782 WZEKGDYFVAZQKE-MRXNPFEDSA-N 388.492 5.047 30 20 GKED Cc1cccc2c(CCC(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c[nH]c12 173993636 LLOZIYAEMVMTNK-LJQANCHMSA-N 385.492 5.409 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CC(F)(F)F 174000495 JSYXGIQQWQXHJY-UHFFFAOYSA-N 375.394 5.106 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)n1 177760717 WCEURWXZDPLRAP-CQSZACIVSA-N 378.419 5.193 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 184040476 XFUJASGNBBGBJD-HNNXBMFYSA-N 383.517 5.572 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCSCC[C@H]1C 192137896 UVFOAOLMJXQXQE-MRXNPFEDSA-N 381.501 5.018 30 20 GKED COc1ccc([C@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C2CC2)cc1 237364260 MAIPRBLYKSTOAS-AREMUKBSSA-N 398.506 5.387 30 20 GKED N#Cc1cccc(Cl)c1NCc1cn(-c2ccccc2)nc1-c1ccncc1 301396840 GOYZRFNKQHAVKA-UHFFFAOYSA-N 385.858 5.071 30 20 GKED N#Cc1nc(Sc2nnc(-c3ccco3)n2C2CCCCC2)ccc1Cl 301507084 HECOEBRTGFWATF-UHFFFAOYSA-N 385.880 5.115 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SC)c(OC)c2)cc(Cl)c1OC 303069933 WXLRJCPSNRRREP-SOFGYWHQSA-N 392.904 5.374 30 20 GKED COc1c(Br)cc(Cl)cc1N[C@H](C)c1ccc(OCC#N)cc1 319737224 RVEKOZXNEPPNEF-LLVKDONJSA-N 395.684 5.187 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)NCC1CCC(C#N)CC1 332258044 AMEGGTPIOHLPKE-UHFFFAOYSA-N 392.286 5.017 30 20 GKED COc1cc(CN(C)C(=O)c2sc3ccc(C#N)cc3c2C)ccc1SC 428201874 SJEZVBTXUBOILV-UHFFFAOYSA-N 396.537 5.084 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4cc[nH]n4)s3)cc2)c1 431839270 ZCROUWHECFIPPT-UHFFFAOYSA-N 386.436 5.054 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc2cccc(F)c2o1 431920896 HTOUWJJFTQQKSD-KXBFYZLASA-N 379.435 5.367 30 20 GKED C=CCC[C@H](NC(=O)CCc1ncc(-c2ccccc2F)o1)c1ccccc1 435280040 RJORUTRUKJDSNJ-FQEVSTJZSA-N 378.447 5.237 30 20 GKED N#CCC[C@H](NC(=O)c1cc(Cl)cc(Br)c1F)c1ccccc1 435914324 FZZPWAHLRDXELC-HNNXBMFYSA-N 395.659 5.016 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 437906816 SCSOCASGKIXODJ-OAQYLSRUSA-N 381.495 5.358 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccc(F)cc2F)C2CC2)cc1C(F)(F)F 438638333 DESFKJJNBFLIAJ-UHFFFAOYSA-N 395.331 5.052 30 20 GKED Cc1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)c(F)c1 439659591 GHMWHQQHODNBIA-MRXNPFEDSA-N 389.430 5.237 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)CS[C@@H](C)c2cccc(C#N)c2)cc1 446708677 SEBRGRRVLPRZCB-JTSKRJEESA-N 394.540 5.115 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458798140 HGBHTJISJJBBMP-PKOBYXMFSA-N 398.576 5.713 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccco1)c1ccccc1 458804326 SGSKZOCPMKVDCA-HSZRJFAPSA-N 387.483 5.427 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1cc(C#N)ccc1F 466194405 LOIHZJUUEHYQKS-MRXNPFEDSA-N 393.487 5.232 30 20 GKED C=C(C)C[C@H](C)C(=O)N(C)c1cc(N(C)C(=O)[C@H](C)CC(=C)C)ccc1Cl 466441176 JDCYUCFIWJBZEM-SJORKVTESA-N 390.955 5.470 30 20 GKED N#CCCCOc1cccnc1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 466625148 DDBGCDDZCCKYQO-UHFFFAOYSA-N 394.456 5.013 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(OCC2CC2)c(F)c1 469515963 VXSNJVVGYSGPOE-HNNXBMFYSA-N 395.478 5.298 30 20 GKED C=C(C)CN(CC)C(=O)CN1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 471181224 KOVDTZBWEUGZOU-HXUWFJFHSA-N 395.547 5.027 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c(Cl)c1 473493949 WTHGILOUBKUXHD-HNNXBMFYSA-N 396.796 5.423 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1c(Cl)cccc1Cl 476081729 VCLNNSUEBZCFNS-UHFFFAOYSA-N 378.299 5.863 30 20 GKED COc1cc(OC)cc(Oc2ccc(CN[C@@H](C)c3ccc(C#N)cc3)cc2)c1 477318902 GUUYWKUZAHDYNU-KRWDZBQOSA-N 388.467 5.219 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)Cc1ccc(OC(F)F)cc1)c1ccc(F)c(F)c1 477746394 NUOGADVRPWJZLY-GOSISDBHSA-N 396.384 5.025 30 20 GKED C=C(C)[C@@H](NCc1ccc(OC(F)F)c(OCC)c1)c1ccc(F)c(F)c1 479405482 DNLQFRLIVBPNGD-LJQANCHMSA-N 383.385 5.372 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1cccc(Br)c1 479770923 UCWVDSJRMDFTRY-KGLIPLIRSA-N 375.335 5.874 30 20 GKED C[C@@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)c(F)c1 480750416 RPRKWNFSKIPMAZ-WYRIXSBYSA-N 391.259 5.401 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(OC2CCC2)c(F)c1 483518604 MRMUXOLOOKKVDH-PZJWPPBQSA-N 393.462 5.061 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc2cc(Cl)ccc2s1 484571343 MEUONHOMNQTYBT-CQSZACIVSA-N 394.839 5.825 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C#N)c(C)c3)s2)cc1 488284358 YKVFJZXXHUZVQS-HNNXBMFYSA-N 377.513 5.158 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c1 502422237 ZPOMUJWWTQFMET-UHFFFAOYSA-N 381.476 5.270 30 20 GKED N#Cc1ccc(C2=CCN(Cc3nc4cc(C(F)(F)F)ccc4o3)CC2)cc1 502530378 QOEHJHOOYCDSDT-UHFFFAOYSA-N 383.373 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCCC(F)(F)C2)cc1Cl 503993592 PTOQYNPUJKODSM-YJBOKZPZSA-N 388.845 5.759 30 20 GKED COCCSc1ccc([C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1 507638931 UXSVBHUWMUTQRF-BJRAERQBSA-N 394.584 5.480 30 20 GKED Cc1c(C#N)cccc1C(=O)N(c1ccccc1)c1ncccc1Br 509285165 YCUHSWMDGRJFKM-UHFFFAOYSA-N 392.256 5.003 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(-c3nc4cc(F)ccc4[nH]3)cc2)c1 510323170 WUVDBVNLRMTMLX-UHFFFAOYSA-N 390.805 5.146 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2)c1 513655667 SWUKKIYGNRBLQJ-HXUWFJFHSA-N 398.487 5.674 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1Cl 517473263 MAHGJFPCRYPTQS-LSDHHAIUSA-N 387.936 5.817 30 20 GKED COc1cccc(C2(C(=O)N(Cc3ccc(C#N)cc3)CC(C)C)CCCC2)c1 517475411 CGCBAGQUXCEJMQ-UHFFFAOYSA-N 390.527 5.063 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 518684396 DNYHMHWAXGDIRB-APWZRJJASA-N 397.519 5.316 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520534418 DCIJEYQVVYNFGV-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(C(C)(C)C)cc1 521326488 UJFLIVJJNCCYQG-MRXNPFEDSA-N 382.529 5.396 30 20 GKED Cc1ccccc1-c1nnc(S[C@@H](C#N)C2CCCCC2)n1Cc1ccco1 522332028 SHMSZHSDJAODFW-FQEVSTJZSA-N 392.528 5.459 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 524572724 PIURYWMLANAZLL-WBMJQRKESA-N 379.312 5.164 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2)cc1 524912615 HREQXVUGWVNVIL-IBGZPJMESA-N 394.459 5.402 30 20 GKED CCN(CC(F)(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 536382999 NMOYHRAFNGRPIO-UHFFFAOYSA-N 382.769 5.028 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(F)cc1)c1ccc(-c2cccc(C#N)c2)cc1 541157946 ZBNYBQPJMDBMRD-QGZVFWFLSA-N 387.458 5.267 30 20 GKED CC(C)(C)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 541421131 LIQRTVPKVMPNKM-HXUWFJFHSA-N 391.515 5.232 30 20 GKED N#Cc1ccc(Cc2cnc(NCc3cnc(-c4ccccc4)s3)s2)cc1 542749308 CJNSHJSSIWFOMT-UHFFFAOYSA-N 388.521 5.341 30 20 GKED N#CCC1CCN(C(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)CC1 542905152 CKQXDEREFXWLKT-UHFFFAOYSA-N 387.508 5.243 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC=C(c4ccccc4F)C3)cc2)cc1 542923562 MGQACINMRQZIAI-UHFFFAOYSA-N 399.425 5.421 30 20 GKED C[C@H](NCc1coc(-c2cccc(F)c2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542945023 JNCDOUXOJCKWCA-KRWDZBQOSA-N 397.453 5.870 30 20 GKED Cc1nc(C2CC2)oc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 544684637 MCLPTXCJRGWMNP-CYBMUJFWSA-N 383.517 5.197 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccccc1Cl 551341079 HKBHIIDLBBYXMP-UHFFFAOYSA-N 380.831 5.050 30 20 GKED CCOc1ccc([C@@H](N[C@H]2CCc3ccc(C#N)cc32)C(C)C)cc1OCC 554997200 JJDPDLBBAVDULB-URXFXBBRSA-N 378.516 5.330 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 556198860 YCTYTORKHHHQRW-IERDGZPVSA-N 393.531 6.343 30 20 GKED C[C@H](CCNC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1 573372002 SYRHVTGALOLOGE-QGZVFWFLSA-N 386.455 5.061 30 20 GKED C=CCOc1ccc(CN(C(=O)C2CCC(OC(F)F)CC2)C(C)(C)C)cc1 578396116 BOCHICGVVYYJTD-UHFFFAOYSA-N 395.490 5.177 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(-c2nc(C)cs2)c1 588260388 FULJABAGAJKXLA-UHFFFAOYSA-N 381.476 5.478 30 20 GKED N#CCCCCCC(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 588875363 GKOCEUPGLOHWOJ-UHFFFAOYSA-N 378.259 5.593 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(CCc3ccc(O)cc3)CC2)cc1 603656252 BDAIPGTXGUUSOL-UHFFFAOYSA-N 391.515 5.070 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccccc1F 608847111 DXKWRTRPSUDPSD-OAHLLOKOSA-N 375.403 5.017 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1c[nH]c2ccccc12 609062470 OAFBZGBLIPHFEC-UHFFFAOYSA-N 395.462 5.108 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3C3CCCC3)c2)cc1 609209593 XSIXFFGGEUNFNB-JOCHJYFZSA-N 375.472 5.537 30 20 GKED Cc1ccc(C(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1Oc1ccncc1 609642047 WSRMJTSPCVBIJW-UHFFFAOYSA-N 385.467 5.105 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2cccs2)CCCCC1 609971393 ZHJYEBWVRKOARQ-MRXNPFEDSA-N 384.570 5.840 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 610140762 NNCYQXCIHPJWKF-GOSISDBHSA-N 375.516 5.883 30 20 GKED COc1cc(CN[C@@H](C)c2cccc(C#N)c2)ccc1OCc1ccc(F)cc1 610345101 RKPLEZCIQMNOSV-KRWDZBQOSA-N 390.458 5.136 30 20 GKED Cc1nc(CSc2ccccc2C(=O)N[C@@H](C)c2cccc(C#N)c2)cs1 610364804 UUTHFRKQCVXSOG-AWEZNQCLSA-N 393.537 5.107 30 20 GKED C[C@H](N[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 610706279 IBOAJXBABBHKIW-RYUDHWBXSA-N 387.270 5.327 30 20 GKED CN(C(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccc(C#N)cc1 610982896 KPPNUHPMFYLBKQ-UHFFFAOYSA-N 376.843 5.067 30 20 GKED COc1ccc([C@@H](NCc2ccc(C(C)(C)C#N)cc2)c2ccc(F)cc2)cc1 614056097 HKOOZXBSPOWPSG-DEOSSOPVSA-N 388.486 5.515 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 618891712 CSXFYXJAESBEGX-AABGKKOBSA-N 399.519 5.021 30 20 GKED O=C(NCC#Cc1ccccc1)c1sc2cc(C(F)(F)F)ccc2c1Cl 642165913 WPESLJYHRLFFIR-UHFFFAOYSA-N 393.817 5.355 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 673718783 DTGDRIBUKXALBL-UHFFFAOYSA-N 394.340 5.019 30 20 GKED N#C[C@H](C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1ccc2ccccc2n1 679237440 IRWKQBXAOWJCPM-FQEVSTJZSA-N 388.430 5.064 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2)c2ccccc2)cc1Cl 726440589 WZACQIBALPTBGI-UHFFFAOYSA-N 377.900 5.615 30 20 GKED CCOc1ccc(OCC)c(NC(=S)N(CC)[C@@H](C)c2ccc(C#N)cc2)c1 726903879 PQPNITYVNJLAOY-INIZCTEOSA-N 397.544 5.136 30 20 GKED CCn1c(/C(Cl)=C\c2cccc(OCCCC#N)c2)nc2cc(F)ccc21 727267368 IDXACHDKSVEIPQ-QGOAFFKASA-N 383.854 5.615 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1ccc2ccccc2n1 727952046 ACSSZSDVNNQRJT-JOCHJYFZSA-N 384.479 5.365 30 20 GKED Cc1ccccc1-c1cccc(C=Nn2cnc3sc4c(c3c2=O)CCCC4)c1 729633253 MFSLBPCIGSLVGI-UHFFFAOYSA-N 399.519 5.194 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730422027 SBGKVCMAUHZOMI-CXAGYDPISA-N 382.460 5.203 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@@H](C#N)C(=O)Nc3ccccc3)sc2c1 732708010 JKUFIVCXTQWTIK-MRXNPFEDSA-N 396.899 5.639 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](CC)c2ccccc2)c1 733806200 IDNKBGKLWRPUEL-RBBKRZOGSA-N 379.504 5.050 30 20 GKED CSCc1ccc(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 739600373 WOUBVOAQKRRRFB-UHFFFAOYSA-N 378.522 5.080 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCC[C@H]3c3ccsc3)c2)s1 740063578 BIWZZOKHOLPXME-IBGZPJMESA-N 393.537 5.395 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744017178 ZOGYTCAQMMARCI-OCCSQVGLSA-N 388.414 5.685 30 20 GKED COc1ccc(/C=C2\CCc3cc(SC)ccc3C2=O)cc1OC(F)F 748146296 IONRZAOZWFSMRA-NTEUORMPSA-N 376.424 5.231 30 20 GKED CCOc1cccc(C=Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)c1O 750949536 GKNAGHPSLOWZES-UHFFFAOYSA-N 388.423 5.214 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(SC(F)F)c1 752665425 BQHKRSOMILWTHG-ZWKOTPCHSA-N 387.455 5.305 30 20 GKED CC(=O)c1ccc(C#N)cc1NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 754009168 ZEXQUZULEOQZHX-RYUDHWBXSA-N 378.316 5.082 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 758398889 XDZBCJXSCXWBKU-GOSISDBHSA-N 391.512 5.252 30 20 GKED Cc1ccsc1/C=C1\CC(O)(C(F)(F)F)C/C(=C\c2sccc2C)C1=O 764431286 AXSXKDKLUIJSRP-FNCQTZNRSA-N 398.471 5.550 30 20 GKED CC(=O)[C@H](OC(=O)c1ccccc1Sc1ccccc1C#N)c1ccccc1 767373016 GWCOXPGHPMXPAR-QFIPXVFZSA-N 387.460 5.197 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCc2sccc21)c1nc(-c2ccc(Cl)cc2)cs1 771577223 CSUHXSYQTAOBQQ-CVEARBPZSA-N 398.940 5.821 30 20 GKED O[C@H](CN[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1 775191983 NPQROLLAIBWIBX-JKSUJKDBSA-N 395.318 5.161 30 20 GKED C#CC[C@H](NCc1cc(-c2c(OC)ccc3ccccc23)no1)c1ccccc1 778237004 PCVNWXCAWHWVDJ-QFIPXVFZSA-N 382.463 5.358 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3ccccc3F)s2)C(=O)c2ccccc2C1 778520496 ZLZUQKOTQZQFBE-SFQUDFHCSA-N 391.467 5.183 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)sc1-c1cccc(Cl)c1 780166962 YHVNCSHGUDNDHI-AWEZNQCLSA-N 396.899 5.920 30 20 GKED CCC[C@@H]1C[C@H](C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)CCO1 780167560 WCIVYNYHGLRPDZ-NFBKMPQASA-N 391.511 5.025 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C)c1ccncc1 781941944 WABASOZIZVRLEW-OALUTQOASA-N 375.875 5.188 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccc([N+](=O)[O-])cc1Cl 782188642 LKGPDOPWHFHIQC-FPYGCLRLSA-N 394.814 5.118 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCS1 788572879 UPVZKGWRALIVDE-FQEVSTJZSA-N 379.529 5.091 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C\c1ccc(OCCN(C)C)cc1 789887475 DMQHHKDGLZKPDC-SSZFMOIBSA-N 392.543 5.131 30 20 GKED Cc1sc(CC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)nc1C(C)C 789956394 FLPSUHDXNMDEHP-UHFFFAOYSA-N 395.553 5.034 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1Br)c1nccc2ccccc12 792093656 YQZVHTLHGWJTTP-GOSISDBHSA-N 393.284 5.196 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)c1 793539914 KPBJHYUEXPAHPC-LPHOPBHVSA-N 386.923 5.659 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC(F)(F)C1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 796648501 CDSYDKULEYIHSB-GSTHLXFWSA-N 390.499 5.223 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1cnccc1C#N)CC(C)(C)O2 811862751 JSEVXMNYOJHKJC-QGZVFWFLSA-N 394.475 5.015 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2ccccc2)C(F)F)cc1 814576488 DOJALMIFCJQLEQ-SFTDATJTSA-N 391.421 5.470 30 20 GKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(C(F)(F)F)nc1Cl 820593498 AGLPIMMYTBOIBS-ZETCQYMHSA-N 394.706 5.212 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(-c2ccccc2Cl)no1 848603224 NWGSWOFOJMVOMB-HNNXBMFYSA-N 390.871 5.040 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)C1 855258900 DOHFYNYNJWNJGO-INIZCTEOSA-N 389.886 5.321 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)c(C)s1 916155813 DCLBXQQFQUTOCB-ZHACJKMWSA-N 395.911 6.167 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)cc1 916409160 WOJKUFPEQCPZDW-UHFFFAOYSA-N 377.831 5.326 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2oc3c(C)cccc3c2C)cc1 920110345 DEIFJWOYQGTVKJ-VLIAUNLRSA-N 388.467 5.524 30 20 GKED O=C(O)c1ccc2[nH]cc(/C=C\C(=O)c3ccc(OCc4ccccc4)cc3)c2c1 1776127332 PWWWJZDUZAMEPM-LCYFTJDESA-N 397.430 5.341 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3F)s2)cc1CC(=O)O 1776131857 QCRHINZHSRELEW-CLFYSBASSA-N 396.439 5.086 30 20 GKED C[C@@H]1C/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2sccc21 1776589564 MOLYTQRFESYMPX-PKVLTRFUSA-N 380.490 5.948 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)c(OCCC)c1 1776819104 KCPYNHGTQFVZPS-LUAWRHEFSA-N 382.456 5.167 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777455809 BSKMAUDBFDUWMD-NQRZERFFSA-N 382.459 5.673 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Sc2nc3c(c(C)c2C#N)CCC3)c(Cl)c1 26523735 NHVHUBTYIVHJHL-CQSZACIVSA-N 399.947 5.140 30 20 GKED CC(C)c1ccc(CSc2nnc(SC[C@@H](C#N)CCC#N)s2)cc1 61732943 KRMKRUZNMHRXSY-OAHLLOKOSA-N 388.587 5.489 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 112818383 YRRGRLBBDAEIHA-QWHCGFSZSA-N 392.883 5.279 30 20 GKED C=CCN(Cc1ccccc1)C(=O)CCSc1ncnc2sc(C)c(C)c12 115711603 ZHLMRVNNFCJFTA-UHFFFAOYSA-N 397.569 5.005 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2ccc(C#N)cc2F)cs1 127583252 PXEYHGZFRXLIPH-UHFFFAOYSA-N 395.459 5.034 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(NC(=O)C3CCCCC3)c2)cc1 152394230 IQKHIUOEXWAJSD-QGZVFWFLSA-N 377.488 5.108 30 20 GKED COc1ccc2c(c1)c(C(=O)[C@@H](C#N)c1nc(C)cs1)c(C)n2C1CCCC1 155904583 ZEBWCYXQJNKLGJ-GOSISDBHSA-N 393.512 5.328 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174492568 ZAZQFZNOPZMENU-CQSZACIVSA-N 379.391 5.308 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3ccccc3O[C@H](C)C#N)o2)c(C)c1 182102476 ODCIEUURCGCXON-QGZVFWFLSA-N 390.439 5.019 30 20 GKED Cc1csc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1Br 191412981 CPBGITHHHBLWKT-SNVBAGLBSA-N 395.347 5.323 30 20 GKED CC(C)(CCC#N)COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 195047964 GQLVKUVSBSCJTN-UHFFFAOYSA-N 396.434 5.245 30 20 GKED COc1ccc(F)cc1[C@H](C)NCc1cccc(OCc2cccc(C#N)c2)c1 237184556 IWOOOGQFTDZOTP-KRWDZBQOSA-N 390.458 5.136 30 20 GKED Cc1ccc(-c2nnc(Sc3cccc(F)c3C#N)n2Cc2ccco2)cc1 301702485 GVVCMYWKTNMVEI-UHFFFAOYSA-N 390.443 5.057 30 20 GKED COc1ccccc1[C@@H](Nc1c(C#N)cnc2c(C)cc(F)cc12)c1ccccn1 301840052 AEXRUOKKBOHKSC-XMMPIXPASA-N 398.441 5.159 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)cc3F)cc2)c1 303225956 WGAIBUSKIARPAK-UHFFFAOYSA-N 380.806 5.182 30 20 GKED OC(=Nc1ccccc1)C1CCN(/C(O)=N/[C@H]2CCCc3ccc(F)cc32)CC1 330024155 JNIJFKPDVMISPV-NRFANRHFSA-N 395.478 5.117 30 20 GKED C=CC[C@H](CC)NC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 410114883 DFKARQSOVCLYFO-ZDUSSCGKSA-N 394.899 5.186 30 20 GKED CO[C@H]1CCc2c(sc(NC(=O)c3sc4ccc(C)cc4c3C)c2C#N)C1 410965021 HOQJEIAZYKLYDX-ZDUSSCGKSA-N 396.537 5.207 30 20 GKED CSc1c(F)cccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 435780392 VXBYCSDETOPJQI-OAHLLOKOSA-N 382.485 5.470 30 20 GKED CC(C)[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccnc1 436215990 FETZUTIBANJGAP-JOCHJYFZSA-N 389.430 5.263 30 20 GKED C[C@H](CCC(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 437033898 HEEIYXLBABKUJY-BXKDBHETSA-N 381.282 6.020 30 20 GKED N#Cc1ccc(CN[C@H](c2cccc(Cl)c2)c2ccccn2)c(OC(F)F)c1 441052999 SBAYDRQMZMENDW-HXUWFJFHSA-N 399.828 5.087 30 20 GKED CSc1ccccc1[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 441624430 WPRLLGSJNUUDTM-CABCVRRESA-N 385.558 5.685 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@@H]1c1ccccc1I 444646860 JSEFTMMOGAUIHX-QGZVFWFLSA-N 396.316 5.148 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](CO)c1ccc(Cl)cc1 455248636 PFXMKCITLKQQAM-HXUWFJFHSA-N 386.923 5.389 30 20 GKED CC[C@@H](CC(F)F)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457708079 MWMRBCUKIRICOX-UFBFGSQYSA-N 377.275 5.106 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H](C)c1cccc(C)c1 463033957 DDKMKPFTPOHPCR-INIZCTEOSA-N 383.492 5.344 30 20 GKED CCS(=O)(=O)c1ccc(N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 466448634 LGMOUNXFZLGNLR-QGZVFWFLSA-N 390.508 5.192 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Sc3nc4c(c(C)c3C#N)CCC4)o2)cc1C 468647679 KTLBDNQOCHIZKM-HNNXBMFYSA-N 390.512 5.271 30 20 GKED CO[C@@H]1CCOc2c(NC(=O)c3cccc(Nc4ccc(C#N)cc4)c3)cccc21 468682610 XDJRVFPQKUGPFH-JOCHJYFZSA-N 399.450 5.024 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cnn1C1CCCC1 474970388 NVKHKIWZIGUCMJ-CQSZACIVSA-N 398.919 5.314 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 475581726 QNMKOXPERPGKSB-LJQANCHMSA-N 382.935 6.213 30 20 GKED C=C(C)[C@@H](NC(=O)Cc1csc(-c2ccccc2)n1)c1ccc(F)c(F)c1 475674681 KMNKOALFDRTROI-HXUWFJFHSA-N 384.451 5.064 30 20 GKED C[C@@H](Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)c1ccc(C#N)cc1 477542858 LDKCXZJLYNQYEX-GOSISDBHSA-N 379.467 5.038 30 20 GKED C[C@@H]1CCC[C@@H](N(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 481621607 HRRRCBGRXOBGBM-OXQOHEQNSA-N 395.478 5.319 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCCSC2)cc1Cl 483473077 TVFFZPVYFCQABO-AEFFLSMTSA-N 385.920 5.013 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(COc2ccccc2)cc1)c1ccccc1 487186392 OPIYBNCOADRWNM-DEOSSOPVSA-N 384.479 5.431 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)sc2cc(F)ccc12 497582038 IHIJVZRPIOWFPJ-GFCCVEGCSA-N 384.501 5.995 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@@H]3CCCC(F)(F)C3)cc2F)c1 500815843 NSAJNQCVLHIVDF-MRXNPFEDSA-N 388.389 5.040 30 20 GKED Cc1cc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)ccc1C(F)(F)F 503469055 XXQPCCYQIMQJLI-UHFFFAOYSA-N 385.389 5.207 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 504034298 HQRQFYGUMWLLPV-IIBYNOLFSA-N 389.886 5.878 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1ccccc1SC 510247921 CXJTWVZGXKQVQM-UHFFFAOYSA-N 383.542 5.057 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 518684398 DNYHMHWAXGDIRB-QFBILLFUSA-N 397.519 5.316 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1ccc(C#N)cc1 518736910 QXMLGXLYXGKMTP-VBKZILBWSA-N 395.915 5.423 30 20 GKED C[C@H](C#N)CNC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 520358502 KUDFBZLLONHVAL-PXAZEXFGSA-N 379.312 5.103 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1csc(C(C)C)n1 522540383 NPZWEZONDLPZDD-UHFFFAOYSA-N 377.469 5.491 30 20 GKED CC(C)[C@@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1C(F)(F)F 525629682 MRPXORVGZQHJJM-QGZVFWFLSA-N 396.409 5.472 30 20 GKED N#Cc1ccc(C2(NCc3ccc(-c4cccc(F)c4)s3)CCOCC2)cc1 527812190 PZIVYMJSTYDDFM-UHFFFAOYSA-N 392.499 5.221 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccc(C#N)cc2Cl)c(Cl)c1 533177353 IPZSIZFIGDSVCS-LBPRGKRZSA-N 379.312 5.601 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cc(-c2ccccn2)ccc1Cl 534354530 JMUSDQYPEMCTCG-UHFFFAOYSA-N 387.870 5.102 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2scnc2C2CC2)c1 535670359 PLVPFDHUBQYFJQ-UHFFFAOYSA-N 395.871 5.590 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 537517668 RBCSZQCYMJVRMQ-SIKLNZKXSA-N 393.487 5.066 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cccc(-c3ccncc3)c2)cc1 538002752 RLBCKUMJRNOZKM-UHFFFAOYSA-N 375.475 5.577 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1)C(=O)Nc1ccccc1C#N 539853429 DPPIGJYETODMIZ-IRXDYDNUSA-N 387.458 5.042 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 540632182 FWVNIIOFEHHQMT-CVEARBPZSA-N 378.419 5.047 30 20 GKED COc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(C#N)c(F)c2)cc1 540707663 BMYJJCDUJBDXIU-MRXNPFEDSA-N 376.431 5.349 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 544270322 GDXZQZCFYKQRKI-UHFFFAOYSA-N 390.512 5.433 30 20 GKED CCc1cccc2c(C3CCN(C(=O)c4ccc(C#N)c(Cl)c4)CC3)c[nH]c12 548303221 MLAPVJYOTLULAE-UHFFFAOYSA-N 391.902 5.275 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 550480196 LOMXJGSPSBTYPS-UHFFFAOYSA-N 381.526 5.602 30 20 GKED CSc1cc(C(=O)NC2(c3cccc(C#N)c3)CC2)c(Cl)cc1Cl 552470985 GXLBZWYVHJLMBX-UHFFFAOYSA-N 377.296 5.006 30 20 GKED CCC[C@]1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOC1 554133695 CRVWMDYNSSQTLI-KNQAVFIVSA-N 397.906 5.076 30 20 GKED COc1cc(C#N)ccc1OCCSCc1c(Cl)ccc2cccnc12 558533576 NYTDYCMYPXAVFI-UHFFFAOYSA-N 384.888 5.081 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 573641169 FEIKVFDDMMYVML-JXFKEZNVSA-N 397.544 5.704 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 573641272 FEIKVFDDMMYVML-UZLBHIALSA-N 397.544 5.704 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 583464058 CQZKQRZMQQZLAA-UHFFFAOYSA-N 397.356 5.211 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2cccc(-c3ccc(Br)cc3)c2)C1 588302877 BECIPISNAWVGRP-HXUWFJFHSA-N 398.304 5.274 30 20 GKED CCCN(C(=O)c1cccc([C@H]2CCCOC2)c1)c1cc(Cl)ccc1C#N 598810063 KWTRJBKULPCMAC-IBGZPJMESA-N 382.891 5.162 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1cccc(Oc2ccccc2)c1 603472030 WUAIYIPBASIHSD-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C[C@@H](N[C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1)c1cccc(C#N)c1 608381781 MYJPYWSAJSSSKH-OSPHWJPCSA-N 379.463 5.314 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 609693743 FRDMJVYSHRIKGY-FQEVSTJZSA-N 398.506 5.772 30 20 GKED CC(C)CN(C(=O)c1cccc(Oc2nccs2)c1)c1ccc(C#N)cc1 609906997 HAJHBYNRSUDWJM-UHFFFAOYSA-N 377.469 5.110 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cccc(Cl)c1 610223721 GGHZJIFYFANJHK-CQSZACIVSA-N 377.831 5.141 30 20 GKED N#Cc1cc(Cl)c(C(=O)NC2CCC(c3ccc(F)cc3)CC2)c(Cl)c1 611685154 DQJYXQSJSREHHS-UHFFFAOYSA-N 391.273 5.460 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2)n1)c1nc2cc(Cl)ccc2s1 613403549 QJGWRLMYOKGXDX-CYBMUJFWSA-N 395.896 5.563 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cn2)cc1 618393492 IQBNXSQKDSWSIK-UHFFFAOYSA-N 399.450 5.127 30 20 GKED C=C(C)Cn1c(SCCO[C@@H](CC)c2ccccc2)nnc1-c1ccncc1 651191646 IRFQWIJFAQNLRW-FQEVSTJZSA-N 394.544 5.176 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C[C@H]1CCCO1)C(F)(F)F 654046941 HCFZMBFQNBIMKA-NVXWUHKLSA-N 384.442 5.160 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 676591506 MEVUQOMOFNFBBN-JTQLQIEISA-N 398.768 5.598 30 20 GKED Cc1cc(C(=O)NCc2ccc(OCC#N)cc2)sc1-c1cccc(Cl)c1 727674768 DKXLCOXZCFUNLI-UHFFFAOYSA-N 396.899 5.209 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c2ccc(CC)cc2)cc1 727953927 RECKCTHAEPGVKW-JTSKRJEESA-N 376.500 5.043 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=S)Nc1ccccc1C#N 727981619 PQKVRTUGSRIUKN-QGZVFWFLSA-N 387.508 5.816 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3cncc(F)c3)cc2Cl)cc1 729330008 JKSOQCGXAKLGBK-BAQGIRSFSA-N 393.805 5.190 30 20 GKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1c[nH]c2cc(Br)ccc12 729937145 MGDYIGWLOSHJIQ-KTAJNNJTSA-N 376.637 5.186 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420378 CUBXKWIYVJNHRR-JQWIXIFHSA-N 390.892 5.446 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc3c(c2)CCC(C)(C)O3)S1 731562863 IOEDVPXABZAVEK-UYRXBGFRSA-N 392.524 5.299 30 20 GKED Cc1ccc2c(C)cc(NN=C3CCC(NC(=O)OC(C)(C)C)CC3)nc2c1C 731925273 VZBJUKPJRTXZFK-UHFFFAOYSA-N 396.535 5.395 30 20 GKED C#Cc1cccc(NC(=O)N(C)[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 740435499 ZAKCUCYMEXCZFH-KRWDZBQOSA-N 389.524 5.633 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@]12CCCc1ccccc12)c1nc2cc(Cl)ccc2s1 744035123 HUTFTRAWHYZDSV-ULYRPOKDSA-N 392.911 5.420 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1cccc(C(F)(F)F)c1 745696598 ZYWYRMLLGWIJHG-UHFFFAOYSA-N 391.462 5.432 30 20 GKED O=C(/C=C/c1ccc(N2CCOCC2)cc1)c1ccc(-c2ccccc2)s1 747188041 GNVXYGOVPICYBP-DHZHZOJOSA-N 375.493 5.148 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@H](CCC#N)c1ccccc1 748594732 XFEZMZUMSXRRJO-HXUWFJFHSA-N 381.545 6.052 30 20 GKED CC(=NNc1ccc(Br)cn1)[C@H](C)c1nc2ccccc2s1 748787741 GRPUKXUWCMINEE-JTQLQIEISA-N 375.295 5.045 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 750691481 RINGRHDBJDGAQT-RDGATRHJSA-N 395.506 5.672 30 20 GKED C#CCCCCCC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1 752913195 ATPKZEKOBXWJDN-NOZRDPDXSA-N 375.512 5.336 30 20 GKED CCOc1cccc(-c2cccc(NC(=O)c3ccccc3SCC#N)n2)c1 754753285 NFWWDISIIPOMAU-UHFFFAOYSA-N 389.480 5.015 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccc[nH]1 760756206 MUGWGXFMWNAPQH-ZDUSSCGKSA-N 380.835 5.215 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccnc(Cl)c1F 766761614 OAJRLWPJWUHEOG-UHFFFAOYSA-N 386.654 5.164 30 20 GKED C=CCOc1ccc(CNc2ccc(OC)c(NC(=O)C3CCCCC3)c2)cc1 770581551 NAMUTGSQRWDRBQ-UHFFFAOYSA-N 394.515 5.391 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 772981743 ADYUIVPOEPIAPD-GHTZIAJQSA-N 399.332 5.297 30 20 GKED Cc1cc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cnc1Cl 779595057 CXEKLHHGPKUEKI-UHFFFAOYSA-N 381.838 5.245 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(Cl)ncc2Cl)cc1 780454760 NEOMXSUBYBTSKD-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C\c1cnc(-c3ccccn3)s1)C2 782369740 OKBGVAIROWYMCS-LCYFTJDESA-N 397.297 5.098 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1ccc(Cl)nc1C(F)(F)F 787254676 IEUXJDZGBJHSSV-HOTGVXAUSA-N 379.813 5.026 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)C1 788097398 VPJYQHJYCHLKHF-BXKDBHETSA-N 384.502 5.381 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792095930 YJWBXPNFAHEYSJ-PKOBYXMFSA-N 382.385 5.624 30 20 GKED N#CC[C@@H](CC(=O)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 796672744 AXSIKRGNTZFSLB-FUHWJXTLSA-N 395.808 5.444 30 20 GKED N#CC1(CCCN2CCCc3cc(OCc4ccccc4)ccc32)CCOCC1 799123145 PKMIHYIDDMEJJN-UHFFFAOYSA-N 390.527 5.119 30 20 GKED C[C@@H](Nc1nc(Cl)c(C#N)s1)c1cccc(NC(=O)c2ccccc2)c1 804349570 MPSOLBGXXSXTTB-GFCCVEGCSA-N 382.876 5.094 30 20 GKED N#CC1(CSc2nnc(Cc3cccs3)n2-c2ccccc2)CCCC1 806585856 NBMSMCPGFVKUEQ-UHFFFAOYSA-N 380.542 5.096 30 20 GKED O=C(O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)[C@H]1CCC(F)(F)C1 809126165 HKJZPZQXLQCENI-ONGXEEELSA-N 376.243 5.287 30 20 GKED Cc1cc(NCc2ccc(N(C)CCC#N)cc2)ccc1NC(=O)OC(C)(C)C 850416718 PERRRIGEKHKCMH-UHFFFAOYSA-N 394.519 5.304 30 20 GKED C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)c1nc(-c2ccc(CC)cc2)no1 904574947 YRFYBFYEVXTDAF-HNNXBMFYSA-N 377.872 5.007 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1ccc(Cl)cc1 916907217 XCYYCSWWTNCVCA-GOSISDBHSA-N 390.826 5.093 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 916942548 LSVRKWGTGNRJBW-WUTVXBCWSA-N 393.657 5.008 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/Sc3ccccc3)n2)cc1 916971579 BUWHUDKRYWSNIF-IENJSVCTSA-N 376.506 5.601 30 20 GKED C[C@@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917044107 PUKKVMVKBXNYBY-YGRLFVJLSA-N 391.279 5.247 30 20 GKED N#C[C@@H](C(=O)COc1cccc2ccccc12)c1nc2cc(Cl)ccc2s1 917046204 HRCBQALBQOHFKV-INIZCTEOSA-N 392.867 5.358 30 20 GKED C=CCN(Cc1c(O)ccc2ccc(O)c(CN(CC=C)C(C)C)c12)C(C)C 917481412 JEYDZQQGCIDGGM-UHFFFAOYSA-N 382.548 5.044 30 20 GKED Cc1ccc(C(=O)/C=C/c2csc(COc3ccc(Cl)cc3)n2)s1 918712782 NBFGYZLLTSFRER-VMPITWQZSA-N 375.902 5.642 30 20 GKED Cc1cc(NN=Cc2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)ccc1Cl 1776105337 ZGUHJVHZNKEWBF-OAQYLSRUSA-N 394.858 5.299 30 20 GKED O=C(O)C(=O)/C(=C\c1ccc(Cc2ccccc2)cc1)c1ccc2ccccc2n1 1776116764 GGYYAZCUGXUYDR-XLNRJJMWSA-N 393.442 5.020 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(OCCCCCC)c1 1776783829 OCXUIIVOJCDTJR-OAQYLSRUSA-N 377.569 5.939 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cccc(Cl)c1Cl 1776785350 YFVKJGUJVFNMET-IBGZPJMESA-N 388.379 6.582 30 20 GKED CCCCCCCOc1cccc(/C=C\c2cc(C(=O)O)c3ccccc3n2)c1 1776789093 POSZDHQWYQECJF-PFONDFGASA-N 389.495 6.453 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)s1 1776966065 SVWPQBJBAPUBNU-UFSNDUKISA-N 392.476 5.411 30 20 GKED CCn1c2ccccc2c2cc(/C=C3\C[C@H](C(=O)O)c4ccccc4C3=O)ccc21 1777002917 PGHNLHHGVMWKTC-OEHGHSTBSA-N 395.458 5.653 30 20 GKED C[C@@H]1/C(=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1777407755 BOGPYIZYUXDSCL-FFJULPRVSA-N 384.431 5.275 30 20 GKED Cc1cccc2c1C/C(=C/c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777456096 KCJULKBSEALILU-UNOMPAQXSA-N 384.431 5.095 30 20 GKED O=C(/C=C\c1cc2cc(Cl)cnc2o1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569481 ZBHWWCGBZQQGLJ-WAYWQWQTSA-N 393.782 5.336 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 1777686082 GYPTVSZZAPCUNB-YVMONPNESA-N 397.770 5.103 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc(Cl)c1OCC(C)C 41547222 MTUOWCONPAPPAW-AWEZNQCLSA-N 398.846 5.015 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2cccs2)cs1 54895351 NTOOKOCLEPTAER-RMKNXTFCSA-N 388.901 5.439 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(C)ccc2C)cs1 54897319 ZXKMPHIUKZWEJQ-XFXZXTDPSA-N 390.508 5.649 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N(C)[C@H](C)c2ccc(C)cc2)cc1 56757737 VDEHNLLGHOKVBL-LJQANCHMSA-N 391.515 5.034 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OCC)cc1C(F)(F)F 64564302 RNMZWTDZKGBFMM-UHFFFAOYSA-N 378.394 5.324 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(-c2cccs2)no1 72030810 GJGYANMTVVPKIQ-AWEZNQCLSA-N 388.452 5.635 30 20 GKED C#Cc1cccc(N(C)Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)c1 103146172 BFUSBTWBDKIPKN-UHFFFAOYSA-N 389.524 5.062 30 20 GKED Cc1cccc(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1C 113549142 NBQMGZXAQPLPNN-UHFFFAOYSA-N 385.467 5.593 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\Cc3cc(F)ccc3C2=O)cs1 114992235 OWSOHRUDYIEFMX-LFIBNONCSA-N 392.455 5.098 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1COc1ccccc1)c1ccccc1 119486455 PLWZAXICWAQOPB-JOCHJYFZSA-N 385.467 5.432 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)CCc1ccc(C#N)cc1 153074474 LOGZXRWSVFHVFG-QGZVFWFLSA-N 389.524 5.142 30 20 GKED CC(C)(CCC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1 155265481 QCUGMEIWTXPAKY-SFHVURJKSA-N 375.497 5.139 30 20 GKED N#CCC[C@H](Nc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccccc1 164343201 DGJGCSOOBRDWKX-INIZCTEOSA-N 383.377 5.014 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3ccccc3OCC#N)c(C)c2)n1 171161332 OUVDSHHICMQPPD-UHFFFAOYSA-N 395.509 5.066 30 20 GKED N#CCOc1ccc(CNCc2cccc(OCc3ccccc3Cl)c2)cc1 171769603 ABNAMSUBXQVJMY-UHFFFAOYSA-N 392.886 5.111 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(C(F)(F)F)CC3)cc2)c1 173121341 ZKIYVKMZMRMOEE-UHFFFAOYSA-N 389.377 5.157 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)cc1 174649432 DHCODQFQPHYRSV-IRXDYDNUSA-N 395.503 5.175 30 20 GKED COc1cc([C@@H](C)NCc2ccc(F)c(C#N)c2)ccc1OCc1ccccc1 179709052 CENGYZKTOOLHNG-QGZVFWFLSA-N 390.458 5.136 30 20 GKED C[C@H](N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1cccc(C#N)c1 181687781 BXUAAILAUXERDV-GAJHUEQPSA-N 384.458 5.139 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)cc1C(F)(F)F 185738884 OOLUXNQGRWSJEX-NSHDSACASA-N 398.837 6.005 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2)=C(\S)NC(C)(C)CC)cc1 186969074 RECOHHGFTKZQAG-UHFFFAOYSA-O 397.608 5.595 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCOc1ccc(C(C)=O)cc1 189891947 ULAAFBCUPXCJTF-UHFFFAOYSA-N 379.500 5.539 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CC#N)c3ccccc3)c3ccccc3n2)c(C)c1 216754123 YUXFFOJGLOXBEA-UHFFFAOYSA-N 391.474 5.689 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 246088802 JFHOSTQKINNUEH-BZUAXINKSA-N 377.579 5.076 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C(C)(C)C 303397462 PYFZNEPSGDVWIE-JTSKRJEESA-N 395.572 5.254 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(C(F)(F)F)cc1 303508869 BHBURRBOKDMAQO-UHFFFAOYSA-N 381.247 5.038 30 20 GKED CC(C)c1nc([C@@H]2CCCCCN2C(O)=Nc2ncc(C(C)(C)C)s2)no1 329585837 YEOVEKGEKQAIKF-ZDUSSCGKSA-N 391.541 5.110 30 20 GKED Cc1csc(C2(/N=C(/O)C3CCC(/N=C(/O)C4CC4)CC3)CCCC2)n1 330008356 FIZZJFMMMFAVHM-UHFFFAOYSA-N 375.538 5.103 30 20 GKED COc1cc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)ccc1OC1CCCC1 410277189 XIJDZNJVGHGDMY-UHFFFAOYSA-N 392.499 5.191 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1 410346155 UOHGPPPQHCQTEJ-UHFFFAOYSA-N 381.863 5.080 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccccc1OCc1cccc(Cl)c1 428905863 JSOSZQZARWGTPH-UHFFFAOYSA-N 383.879 5.077 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 435615511 PLYQHAMEHIMQRU-PKOBYXMFSA-N 379.529 5.910 30 20 GKED COc1ccc(-c2csc3ncnc(NCC4CCC(C#N)CC4)c23)cc1 440664449 PPODEJGYJFFWBH-UHFFFAOYSA-N 378.501 5.109 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c1C 444460197 ZUQKJJKTJGIXDG-MRXNPFEDSA-N 384.357 5.467 30 20 GKED N#CCSc1ccccc1NC(=O)CN1CCCC[C@H]1c1cccc(Cl)c1 444793076 OSEVLQPTAAVDAO-IBGZPJMESA-N 399.947 5.121 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)c(F)c1 445757383 JXXPVPGYPUHMDY-HXUWFJFHSA-N 382.797 5.009 30 20 GKED CC[C@@H](NCC1(c2cc(Cl)ccc2OC)CCOCC1)c1ccc(C#N)cc1 447536915 RDOZVLLYULSQBN-OAQYLSRUSA-N 398.934 5.009 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2N2C[C@H]3CC[C@H]2C3)c1 448043462 NTAAQADLJXFLFY-HKUYNNGSSA-N 390.487 5.002 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)c1cccc(C#N)c1Br 451297016 QZJZMKKXZNZNSJ-UHFFFAOYSA-N 385.305 5.649 30 20 GKED COc1ccc([C@@H](NCc2ccccc2C#N)c2ccccc2Cl)c(C)c1 462175639 LEHRIYQOXVGXOO-HSZRJFAPSA-N 376.887 5.408 30 20 GKED COc1ccc([C@@H](NC(=O)c2sccc2C#N)c2ccccc2Cl)c(C)c1 464636271 KRIPJDWTQXJILF-LJQANCHMSA-N 396.899 5.110 30 20 GKED C=CCC(CC=C)C(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 467528501 VMNAXMXFFOKSLH-HSZRJFAPSA-N 390.552 6.003 30 20 GKED CSc1cc(C(=O)N[C@@](C)(C#N)CCc2ccccc2)c(Cl)cc1Cl 471270114 IGQUCRPCYZGADH-LJQANCHMSA-N 393.339 5.360 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(C(F)(F)F)o1 471793134 ZNVTYCSSZKGLEY-UHFFFAOYSA-N 386.329 5.523 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 473054390 CWMMHAXPGBVDGI-HKUYNNGSSA-N 387.405 5.318 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(-c3ccco3)nc3ccccc23)n1 474428626 RVYMZGDAAWFIDG-MRXNPFEDSA-N 387.464 5.565 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1OCC 474435658 CFWRBAZSHJXTDB-MRXNPFEDSA-N 386.517 5.334 30 20 GKED Cn1c(-c2ccc(NC(=O)C[C@H](CC#N)c3ccccc3)cc2)nc2ccccc21 475581390 JCMDKYVZRJZQNT-FQEVSTJZSA-N 394.478 5.266 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(COC(C)(C)C)c1C 475972795 NFYRZDRYHJWIBR-UHFFFAOYSA-N 391.515 5.402 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1c(C)nc2cc(F)c(F)cc21 477003466 UAOOCPWQOGEYII-UHFFFAOYSA-N 383.442 5.114 30 20 GKED CO[C@@]1(C)CCCN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CC1 477863219 NIWZVAUMZQEDMW-QFIPXVFZSA-N 398.890 5.035 30 20 GKED Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482024389 HZWDASDWSOHSGB-UHFFFAOYSA-N 387.395 5.128 30 20 GKED COC(=O)c1cc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2o1 482847776 LUCMQTSNNUDNMA-UHFFFAOYSA-N 396.402 5.010 30 20 GKED CCC[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccn1 483707947 XTWHGCBUEBHUPE-HSZRJFAPSA-N 399.494 5.249 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1 485370046 AUYBMSGVGLTQBT-IBGZPJMESA-N 397.563 5.301 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 485374342 OBXJHSMKFCJWFZ-UHFFFAOYSA-N 391.515 5.539 30 20 GKED C=CCN(C(=O)c1ccc(C)c(OCC)c1)c1nc(-c2ccccc2)cs1 499168966 LSSRTERDQGNPRR-UHFFFAOYSA-N 378.497 5.350 30 20 GKED N#CCCN(CCC#N)Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 499213984 VTRAZXBECLVEJY-UHFFFAOYSA-N 388.298 5.202 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)Sc1ccccc1 500745523 RDHKBECWAYZYSA-KRWDZBQOSA-N 388.492 5.778 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(C)cc2)n1)Cc1cccs1 506009526 KUCWNJYUWUKHDW-UHFFFAOYSA-N 397.569 5.386 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc[nH]c2C(C)C)cc1 509038939 NGFKJTNHUZZNNX-UHFFFAOYSA-N 375.428 5.063 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1ccncc1F)c1ccc(C(F)(F)F)cc1 511531195 YAHLVNRVHOBNHS-FZKQIMNGSA-N 395.400 5.307 30 20 GKED C[C@H]1CCCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 512549386 QCJCGRPBAMJYLD-INIZCTEOSA-N 381.451 5.073 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(C#N)cc2F)c2ccccc2OC)cc1 512637697 YLHJESKFACSQLZ-GYCJOSAFSA-N 390.458 5.155 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 523100922 LVSBTGQQZANSNL-AWEZNQCLSA-N 390.405 5.182 30 20 GKED COc1ccc([C@@H](NCCCC(C)(C)C#N)c2ccccc2Cl)c(OC)c1 531648067 MIUUGHIIBKTCJX-NRFANRHFSA-N 386.923 5.366 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N(C[C@@H](C)C#N)C1CC1 533589875 JIAZVWPYMDWHJR-HNNXBMFYSA-N 397.450 5.091 30 20 GKED C=CCC[C@H](NC(=O)Nc1c(C)nn(CC)c1C)c1ccc(C(F)(F)F)cc1 536782324 DTYBIJDQMKKZFJ-KRWDZBQOSA-N 394.441 5.368 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](Cc2ccccn2)c2cccnc2)cc1 539216675 IJEPQBDHWRENCJ-AREMUKBSSA-N 390.490 5.089 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccc(F)cc2)c2cnccn2)cc1 542493881 FWJFJWCCNSZPTP-RUZDIDTESA-N 394.453 5.034 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 548793447 BRTJGOBCHYICBD-UHFFFAOYSA-N 377.488 5.007 30 20 GKED CC(=O)c1cc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)cs1 550572326 SQJWNSQPFWCIGR-UHFFFAOYSA-N 392.455 5.117 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C[C@H](c1ccccc1)C(F)(F)F 553451963 BUHKHMICIKJZRM-LJQANCHMSA-N 393.453 5.105 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC(C3CCC3)C2)cc1Cl 554398477 SFSBGQKMBFDWBY-FQEVSTJZSA-N 379.891 5.259 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC(CCC#N)CC3)c(C)c2)c1 570088701 KOAWSPHOWIIMTK-UHFFFAOYSA-N 391.515 5.430 30 20 GKED N#C[C@H](NC(=O)c1cccc(Nc2ccccc2)c1)c1cccc(C(F)(F)F)c1 572160852 LEAKMSXWCKTEMT-FQEVSTJZSA-N 395.384 5.444 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2Oc2ccncc2)s1 576448331 RJXNUQVZSXSYAW-MRXNPFEDSA-N 377.469 5.118 30 20 GKED CC(C)c1scnc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 582571662 BZMSCDPSZAGWRK-UHFFFAOYSA-N 377.469 5.377 30 20 GKED COc1ccc([C@H](NC(=O)CCCCCC#N)c2ccccc2Cl)c(C)c1 588625317 XGXOAWOXHHIWLO-QFIPXVFZSA-N 384.907 5.337 30 20 GKED Cc1sc(C2(NC(=O)CCCCCC#N)CCC2)nc1-c1ccccc1F 590532262 WTTLYHBFORNHKR-UHFFFAOYSA-N 385.508 5.227 30 20 GKED CCc1ccc([C@@H](C)C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 609020085 IUSABIWJISSVEB-QGZVFWFLSA-N 397.478 5.115 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC#N)[C@H](C)c1cccc(C(F)(F)F)c1 609168413 MLEPNDYXFVHXPK-OAHLLOKOSA-N 399.416 5.407 30 20 GKED CC(C)c1ccc(CN(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 609384918 UFAWXWREMIYISO-GOSISDBHSA-N 395.572 5.275 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2cccs2)n1 609428293 KYKGNEYJOMTEJU-GFCCVEGCSA-N 385.539 5.518 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 609501921 JDUFWIRZSRNNKF-LSDHHAIUSA-N 389.282 5.394 30 20 GKED Cc1cccc2sc(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)c(Cl)c12 609589527 TYUFQHKIDSARDR-CYBMUJFWSA-N 375.280 5.511 30 20 GKED C[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609880304 DSSSFHYWBSTJSU-LDBYXDLTSA-N 378.447 5.283 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N[C@H](C)c1ccc(C#N)cc1 609919557 FTTAXKAEGHLRBP-UTKZUKDTSA-N 389.524 5.272 30 20 GKED C[C@H](N[C@@H](C)c1cccc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 610158674 GZVBVJSWARHESQ-GJZGRUSLSA-N 377.875 5.043 30 20 GKED COc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(C)c1 610227716 ATOHONGQTYVITE-UHFFFAOYSA-N 394.418 5.281 30 20 GKED CC(C)(C#N)c1ccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc1 614056126 JWFOCHSHNVKJFJ-UHFFFAOYSA-N 376.450 5.645 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 618742647 NVQZVQCVIVXHMB-HXUWFJFHSA-N 393.830 5.157 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 643123894 XIKCPZGSFXCGKN-KRWDZBQOSA-N 378.497 5.112 30 20 GKED O=C(Nc1cccc(F)c1Cl)NC(CCC(F)(F)F)CCC(F)(F)F 667092887 AGLRVVICHRFDAP-UHFFFAOYSA-N 394.718 5.654 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(Cl)c1 674915295 XGZKJGHTHRMWQV-GDGBQDQQSA-N 391.714 5.118 30 20 GKED C=CCC[C@H](NC(=O)N[C@H]1CCC(F)(F)C1)c1ccc(C(F)(F)F)cc1 676725869 QYGANGCTQWHZEX-GJZGRUSLSA-N 376.369 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCc2cc(OC)ccc2C1 682777108 CXPKRBTXVYWEAJ-HXUWFJFHSA-N 378.516 5.226 30 20 GKED Cc1ccc(N(CCC#N)C(=O)/C=C/c2ccc3ccc(Cl)cc3n2)cc1 726941738 KBFDPSJCXXUIPF-FMIVXFBMSA-N 375.859 5.157 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)sc2cccc(F)c12 730416954 JKXGZGXYJWWVNP-LLVKDONJSA-N 384.432 5.588 30 20 GKED O=C(/C=C/c1sc2ccccc2c1Cl)c1ccc(C(F)(F)F)nc1O 731564804 UCTADURKDAHOAA-VOTSOKGWSA-N 383.778 5.570 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(-c3ccccc3)cc2)c1 733841712 JRCRTLWCQGTALT-QFIPXVFZSA-N 385.467 5.356 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)/C=C\c3cccc(OC4CCCC4)c3)[nH]c12 735788018 BDFLFQIEWVJESE-GHYICZDASA-N 385.467 5.082 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)/C=C\c3cnc(C(C)(C)C)s3)c2C#N)C1 744351103 KJDHZEVBGQPVAN-XYLWRLHESA-N 385.558 5.150 30 20 GKED COc1cc(/C=C\C(=O)c2scnc2C)ccc1OCc1ccc(Cl)cc1 745626409 OLNHEYYKICBIKO-UITAMQMPSA-N 399.899 5.589 30 20 GKED Cc1ccc2c(CCC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c2c1 745947720 KKWRPTJPAUUMKB-MRXNPFEDSA-N 393.899 5.549 30 20 GKED C[C@@]1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCc2ccccc21 751084493 OQPMWAZOUGEOOS-JYFHCDHNSA-N 380.491 5.575 30 20 GKED CC(=C/c1ccc(Cl)cc1)/C=C(\C(=O)C(=O)O)c1ccc2ccccc2n1 753713695 KVUOUTQEMZXBEQ-REFMDLPBSA-N 377.827 5.029 30 20 GKED C[C@@H](Cc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 756515803 FPUYYMDCVOUXGN-WFASDCNBSA-N 387.817 5.140 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 759216706 FKDCOFMWIIPPPH-GPZRYRNASA-N 378.884 5.743 30 20 GKED CCCn1nc(C)c(/C=C\C(=O)c2ccc(SC(F)F)c(OC)c2)c1C 759653680 UVDWQEIZGXBDOY-FPLPWBNLSA-N 380.460 5.129 30 20 GKED N#C[C@@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nc2ccccc2o1 760966843 DGHUMDNMVPNPJE-INIZCTEOSA-N 377.831 5.093 30 20 GKED Cc1cc(NC2CCC(C#N)(c3ccccc3)CC2)ccc1OC1CCOCC1 770429737 QJBVWAFZEBRBCP-UHFFFAOYSA-N 390.527 5.369 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)c(Br)c2)c1 772984274 PKEYKSGPOBIMQW-BBRMVZONSA-N 391.284 5.120 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2sccc2Br)c1 772985736 XSVRIBFGURBZOH-JSGCOSHPSA-N 379.323 5.042 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SC[C@@H](O)c1ccc(Cl)cc1Cl 777658612 AEYIYWIJVXJNDL-GFCCVEGCSA-N 393.217 5.105 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2ccccc2)c2ccc(OC)cc2)c1 779103969 GMFRXHZDOTVWSY-RCZVLFRGSA-N 386.495 5.255 30 20 GKED Fc1ccc(CON=Cc2csc(-c3ccsc3)n2)c(Br)c1 780287300 MBQJFLVWXPIQLO-UHFFFAOYSA-N 397.294 5.324 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(C(F)F)c3)n2)cc1 790769739 XSCSPLMKHAGUMC-KRWDZBQOSA-N 398.434 5.175 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1 793628713 NKRVRMNPUVUBPF-DEOSSOPVSA-N 398.506 5.406 30 20 GKED N#CC1(CCCOC(=O)c2csc(-c3ccc(Cl)cc3)c2)CCOCC1 795872135 UVNJSGFYALCTCR-UHFFFAOYSA-N 389.904 5.326 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)ccc2C(C)(C)C)c1 801832234 IFVJIWRURLJDMI-KRWDZBQOSA-N 399.922 5.640 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2cc(Cl)cc(Cl)c2O)c1 806147611 YYTYCQINCARGMJ-KXBFYZLASA-N 393.314 5.621 30 20 GKED O=C1/C(=C/c2cnc(-c3ccc(Cl)cc3)s2)C[C@H](C(=O)O)c2ccccc21 806560607 MUCDNZQLSPPEDU-FUNAXGEOSA-N 395.867 5.302 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1Cl)c1nc(-c2ccncc2)cs1 810549117 ICXMVNLQPKDWOU-INIZCTEOSA-N 381.888 5.058 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2CCC3(CC2)CC3(F)F)cc1 854302268 BGFBUGWDOPAHJD-SNCIUUNGSA-N 395.453 5.432 30 20 GKED C[C@H](N[C@@H]1CCCc2c1[nH]c1ccc(Cl)cc21)c1ccc(OCC#N)cc1 858376433 LBYYDDVVEUGXNI-LHSJRXKWSA-N 379.891 5.452 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc(C(F)(F)F)s2)no1 904968874 ILRLMQYYYNVFEU-LLVKDONJSA-N 396.287 5.895 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1nc(-c2ccc(Cl)cc2Cl)cs1 915103256 RAXJDNNIHFKXFS-LWWSYDQCSA-N 391.323 5.729 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2cccs2)C2CC2)cc1 915354091 VAZQSKWTVFEJAD-IFMALSPDSA-N 387.508 5.676 30 20 GKED Cc1ccc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)c(Cl)n1 916046740 BAJHVBNYGXLZCV-UHFFFAOYSA-N 393.849 5.210 30 20 GKED Cc1cc(NN=Cc2csc3ccc(C(=O)O)cc23)ccc1Br 1776038997 BHZOCJJZTKGFOF-UHFFFAOYSA-N 389.274 5.116 30 20 GKED O=C(O)c1cc2c(C=NNc3c(Cl)cccc3Cl)c(F)ccc2s1 1776048845 FNTMIPQOMDZKIS-UHFFFAOYSA-N 383.231 5.491 30 20 GKED CC(C)c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1[N+](=O)[O-] 1776372400 ARYCOKSBSUTVRA-YBEGLDIGSA-N 379.412 5.019 30 20 GKED CCCCCCCOc1ccc(/C=C/C(=O)c2ccc(CC(=O)O)cc2)cc1 1776785889 INIZUFHPVGWWDM-LFIBNONCSA-N 380.484 5.559 30 20 GKED COc1ccc(C(=O)O)cc1/C=C\C(=O)c1sc(-c2ccc(C)cc2)nc1C 1777354598 BLKPUSCIXFXHSK-NTMALXAHSA-N 393.464 5.030 30 20 GKED Cc1cccc2c1C/C(=C\c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777456151 SHTRXSURXXBGQU-RGVLZGJSSA-N 384.431 5.095 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Sc2nc(C)cc(C(F)(F)F)c2C#N)c(C)c1 18535764 QKFWVRLGHCBIFD-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED C[C@@](Cc1nc2ccccc2s1)(C(=O)Nc1cccc(C#N)c1)c1ccccc1 19199724 RKTKDFKTCPUBAX-DEOSSOPVSA-N 397.503 5.307 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C2(c3ccc(Br)cc3)CCC2)cc1 25841286 FCPSRJGLLVCAJW-UHFFFAOYSA-N 397.316 5.311 30 20 GKED C=CCOc1ccccc1C(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 53988266 KUZMZHWMWOSZJN-UHFFFAOYSA-N 396.874 5.066 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)CCc1ccc(-c2ccccc2)o1 62888767 JCHMLEUQAHRIPM-UHFFFAOYSA-N 390.439 5.002 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H]1C1CCC1 102954482 HECAPLXOLOXYLV-QHCPKHFHSA-N 389.499 5.242 30 20 GKED N#C[C@H](C(=O)[C@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1)c1ccccn1 107408747 FGKNHEGWIMZJNK-HRAATJIYSA-N 397.261 5.385 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 112129341 AGAQZTAHKHIZKA-UHFFFAOYSA-N 385.533 5.261 30 20 GKED C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccccc1S[C@H](C)CC#N 112818389 YRRGRLBBDAEIHA-OLZOCXBDSA-N 392.883 5.279 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 123290902 SDZBIHOZMAHOLX-QGZVFWFLSA-N 376.525 5.362 30 20 GKED C=CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccoc1C 126999755 KXPHKFVDYAERLU-UHFFFAOYSA-N 378.501 5.126 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Br)cc2F)c1 127926475 RTVATCDXZHEHMN-CJNGLKHVSA-N 391.284 5.120 30 20 GKED Cc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1-c1ncco1 152132377 UGCPFXAPTYJRLD-UHFFFAOYSA-N 383.455 5.039 30 20 GKED CCN(CC(=O)Nc1ccccc1SCC#N)[C@H](C)c1cc2ccccc2o1 173246072 UEWNSTNMKBQFDN-MRXNPFEDSA-N 393.512 5.070 30 20 GKED N#CCCCOc1cccc(CN[C@@H]2CCCc3cc(OC(F)F)ccc32)c1 237905561 NEKAWWKZTGBCDA-OAQYLSRUSA-N 386.442 5.138 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c21 410994423 BABHRARUWUBALE-SFYZADRCSA-N 385.436 5.033 30 20 GKED COc1cc(Cl)c(Cl)cc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 429346992 DKMAKTROSDNAOE-SNVBAGLBSA-N 377.252 5.102 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cc2cccc(F)c2o1 431920892 HTOUWJJFTQQKSD-DNVCBOLYSA-N 379.435 5.367 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(C3CC3)nc3ccc(Cl)cc23)n1 435592893 JVUZFBDSOQMXBK-INIZCTEOSA-N 395.915 5.836 30 20 GKED CN(CCc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 437826937 DTEZJMYJTOGZRQ-UHFFFAOYSA-N 377.469 5.118 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 438860261 RYHOGMBLGLVZBD-SUMWQHHRSA-N 376.287 5.399 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)cc2Cl)ccc1OC1CCCC1 439447584 RSYUYYWVASPRDH-OAHLLOKOSA-N 384.907 5.392 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cn(CCCC#N)c2ccccc12 443914763 IOYLWRBHGYQDOF-UHFFFAOYSA-N 397.931 5.488 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 446374598 MDOZRKXCHPLMIH-UHFFFAOYSA-N 399.450 5.051 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1c1ccccc1Cl)c1ccccc1 458798383 HZUYFYAAJQQDQR-LEWJYISDSA-N 381.907 5.622 30 20 GKED C[C@H](C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 461964388 JZVRGIFMKKNLRV-VBKZILBWSA-N 380.900 5.282 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)c1ccc(C#N)cc1 464231466 QUIGAPMSSKHLHX-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1ccc(Br)s1 468173039 GCXVZGPOMUZFSX-LLVKDONJSA-N 382.348 5.280 30 20 GKED Cc1cc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc(C)c1F 469155271 XRKYAVVMECHXKM-KRWDZBQOSA-N 379.479 5.199 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1F 469329591 WPGQTTRMLAWOJI-CQSZACIVSA-N 385.870 5.235 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474690329 CXQDBLMWABKIJO-RHSMWYFYSA-N 375.299 5.600 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(N2CCCC2)c1 475554742 JNBODOMZWFGMPE-IBGZPJMESA-N 391.559 6.021 30 20 GKED C[C@H](CCNC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 476207732 OGPPNHQKGRSXEL-VQIMIIECSA-N 388.433 5.403 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCNc1cc(Cl)ccc1OC 476792377 VIVKYRSRCCCRBZ-UHFFFAOYSA-N 386.923 5.641 30 20 GKED CCSc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 480938505 HEEKVHQTGFXSDC-SFHVURJKSA-N 389.505 5.284 30 20 GKED CC(C)(C)[C@H]1C[C@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 482928205 CXJFACSHVSLYBK-WIYYLYMNSA-N 393.487 5.066 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cnn(-c2ccccc2C)c1CC 485343510 GYABWYOALPPAGR-UHFFFAOYSA-N 380.517 5.025 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 486755619 QRNCFGCAUPXFIW-KRWDZBQOSA-N 377.856 5.181 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Cl)cc1Br)c1ccccc1 487600853 HAPIWDLXBUTSKW-KRWDZBQOSA-N 391.696 5.267 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1Br 498063144 RKCWIHOHBICNED-SECBINFHSA-N 383.336 5.143 30 20 GKED CCCC[C@H](CC)COCc1cccc(NC(=O)N2CCC(C)(C#N)CC2)c1 506952239 OALVMOGWBVNJEL-IBGZPJMESA-N 385.552 5.577 30 20 GKED CCN(C(=O)c1csc(-c2ccc(C)cc2)n1)[C@H](C)c1ccc(C#N)cc1 509556250 BPAVXOIPURAJEP-MRXNPFEDSA-N 375.497 5.214 30 20 GKED CCN(C(=O)CC(c1ccccc1)c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 509603213 KSYHFYFDHNEVMW-FQEVSTJZSA-N 382.507 5.690 30 20 GKED C=C(C)Cn1c(S[C@@H]2CCCc3ccc(F)cc32)nnc1-c1ccncc1 512728464 GPKUVNHRFBTOMK-LJQANCHMSA-N 380.492 5.225 30 20 GKED CCc1cc(C#N)c(NC(=O)c2csc(-c3ccc(Cl)s3)n2)s1 512936197 SGDHIBXBMALJBD-UHFFFAOYSA-N 379.919 5.273 30 20 GKED O=C(c1ccc(F)cc1C(F)(F)F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513552479 XJAGCDFXXBPKMG-ZDUSSCGKSA-N 383.307 5.039 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1[nH]c2ccc(F)cc2c1Cl 518743044 JWMPQVHUVUJEJP-LLVKDONJSA-N 387.867 5.607 30 20 GKED CC[C@H](C)[C@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 521111810 MYBNUAKQRFJXGJ-XKYBLWFHSA-N 390.527 5.194 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cc(Cl)ccc2F)cc1 521666622 KEFCRQZYWACBJP-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CCCCOc1ccc([C@H](C)Nc2nc(C(F)(F)F)ccc2C#N)cc1OC 523755027 PHYVRXJBDRGASE-ZDUSSCGKSA-N 393.409 5.333 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C2CCOCC2)c1 529268132 MTMDSKYPXOVXCE-UHFFFAOYSA-N 391.515 5.142 30 20 GKED Cc1sc(NC(=O)c2ccc(C3(C#N)CC3)cc2)nc1-c1ccc(F)cc1 539593701 RGIRGESFFYWSFS-UHFFFAOYSA-N 377.444 5.065 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(F)F)c1Cl 541792153 XQWBOSZWUSILQY-UHFFFAOYSA-N 377.822 5.593 30 20 GKED Cc1ccccc1-c1cnc(CSc2nc(C(F)(F)F)ccc2C#N)o1 548283447 NZHMKMRYWCRZTJ-UHFFFAOYSA-N 375.375 5.228 30 20 GKED N#CCCC[C@@H](NCc1ccc(Cl)cc1Br)c1ccccc1 552083609 PAXXPALPVKKDPJ-GOSISDBHSA-N 377.713 5.627 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCc2ccccc21 553665136 LPZISJAUHDLIIP-SJLPKXTDSA-N 379.529 5.322 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC1(C(F)(F)F)CC1 554161109 XUDPPVMAELQGAY-UHFFFAOYSA-N 389.377 5.123 30 20 GKED C=CCn1c(S[C@@H](C)c2nccn2-c2ccccc2)nnc1-c1ccoc1C 561442307 MWUNHEPYPZIINQ-INIZCTEOSA-N 391.500 5.072 30 20 GKED N#C[C@@H](NC(=O)c1cccc(Nc2ccccc2)c1)c1cccc(C(F)(F)F)c1 572160853 LEAKMSXWCKTEMT-HXUWFJFHSA-N 395.384 5.444 30 20 GKED C[C@@H](N[C@H](C)c1ccc2nc(O)oc2c1)c1ccc(-c2cccc(C#N)c2)cc1 586792961 DFARYWAXBQPHFA-HZPDHXFCSA-N 383.451 5.484 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)c1 589739964 FSMDUWGMQPSOPH-UHFFFAOYSA-N 394.393 5.204 30 20 GKED CC[C@@H](NC(=O)Nc1cccc(C#Cc2cccs2)c1)c1nc(C)cs1 591486854 SBBKUPBCALTLMH-GOSISDBHSA-N 381.526 5.186 30 20 GKED C=CCCOCC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 599833448 NVNBLYDDTHEFCM-UHFFFAOYSA-N 384.526 5.045 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1Cl 603673418 UNBIJNSLCCCJCV-IBGZPJMESA-N 382.797 5.526 30 20 GKED CCc1onc(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603759089 UBWNISSPOFQXQT-KRWDZBQOSA-N 379.847 5.107 30 20 GKED C=C(C)CN(CC)C(=O)CSCc1csc(Cc2ccc(Cl)cc2)n1 604062543 OEJWZHPFPMFJGE-UHFFFAOYSA-N 394.993 5.045 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc2cccc(F)c2o1 607789457 OYSSBYNSYZAYCX-NXEZZACHSA-N 397.290 5.211 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)C3(C#N)CCCCC3)cc2)c1 609033514 ZJGJEHFQEBHGNR-LJQANCHMSA-N 376.500 5.225 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)s3)cc2F)c1 609105522 AJNZBORMKIUYDH-UHFFFAOYSA-N 386.835 5.244 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)NCc1ccc(C#N)cc1F 609254639 WHJTXYUYRGEBOL-UHFFFAOYSA-N 393.462 5.128 30 20 GKED COc1ccccc1[C@@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1OC(C)C 609281602 HGHLCLJRJOYGOJ-FQEVSTJZSA-N 393.487 5.113 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 609376532 BSKIWHJUCHKCBX-HBGVWJBISA-N 386.520 5.834 30 20 GKED COc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1F 609723570 GNMWDBXCJIXUOQ-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CCCN(Cc1ccccc1F)Cc1cn(CCC#N)nc1-c1ccccc1 611255964 PBCAZOCFLRKLHU-UHFFFAOYSA-N 376.479 5.015 30 20 GKED Cc1c(NC2CCC(C#N)(c3ccccc3)CC2)cccc1C(=O)N1CCCC1 611287959 IBGXNMHNRQGBEA-UHFFFAOYSA-N 387.527 5.047 30 20 GKED Fc1cccc2[nH]cc([C@@H](NCc3nc(C(F)(F)F)cs3)C(F)(F)F)c12 646063172 NXDHCVXWQPUYNX-CYBMUJFWSA-N 397.319 5.176 30 20 GKED CC(C)C[C@H](N)c1noc(-c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 663250136 CCZGWWVAZSMIHK-NSHDSACASA-N 399.310 5.072 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(OCc3ccccc3)cc2)cc1Cl 726434642 PVWUDINMSASCFX-UHFFFAOYSA-N 393.899 5.600 30 20 GKED C[C@@H](C#N)Oc1ccc(CNC2(c3ccc(Br)cc3)CCCC2)cc1 728714979 FWWXNOQKOHEJEL-INIZCTEOSA-N 399.332 5.299 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc1-c1ccc(F)cc1 730422055 SKPRWPPINKMLQP-HNNXBMFYSA-N 393.418 5.070 30 20 GKED Cc1cc(CN(C(=O)/C=C/c2ccccc2C#N)C2CCCC2)c2ccccc2n1 732096655 VTMOSTGXHDJVPH-CCEZHUSRSA-N 395.506 5.400 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1nc(-c2ccccc2)cs1 732571534 RGTURIJOFUDBSJ-KTKRTIGZSA-N 375.478 5.225 30 20 GKED C=CC[C@@H](NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccncc1 734684613 WEHBYXJOMPGNOB-RTBURBONSA-N 389.421 5.264 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)OC(=O)CCc1ccc(C#N)cc1 734738423 GZWCDQRIRYELQR-OAHLLOKOSA-N 394.471 5.366 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@@]3(C#N)CCC[C@@H](C)C3)cs2)cc1 735056986 AOWRTXPAXCGMGC-ZHRRBRCNSA-N 381.545 5.065 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(Cl)cc1NC(=O)c1ccoc1C 739809175 FWWHNQAVFHETKF-UHFFFAOYSA-N 388.895 5.312 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1 741912769 IQMRYCUWJPMZJE-UHFFFAOYSA-N 396.368 5.294 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(COc2ccccc2)c1 745267941 DNXRRJPLELIDIH-UHFFFAOYSA-N 397.478 5.357 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3nc(S)oc3c2)cc1 746125399 HRZSXHBXKCWYNS-GOSISDBHSA-N 385.448 5.024 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3c(C)nn(C(C)C)c3C)cs2)c1 746346276 OMZFSYRLKPZWIJ-KTKRTIGZSA-N 381.501 5.109 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)NCc2ccc(OC)c(C#N)c2)c(C)c1 747275557 OYSAREJAZDLLSO-OAHLLOKOSA-N 383.517 5.088 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(-c2cccc(C(F)(F)F)c2)cn1 747705690 FSAFFJZQBLBIMQ-UHFFFAOYSA-N 398.413 5.448 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748618619 KIPZTUMTRVNZLJ-QHCPKHFHSA-N 384.479 5.310 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(OC)cc1 752495982 PINGQDXZQLXSIW-CXAGYDPISA-N 382.460 5.204 30 20 GKED CC(C)N(C)c1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1F 754405517 IVKRVTJFNQMOMQ-UHFFFAOYSA-N 380.250 5.101 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 755459321 ITBFUPNCGBABRD-UWJYYQICSA-N 379.479 5.035 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 755874231 ZXPHJMBTPHNBFT-UHFFFAOYSA-N 387.439 5.135 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12 756514537 DCQJQVLUIXYDEX-ZDRDQBANSA-N 388.854 5.244 30 20 GKED C#CCCCC(=O)Nc1cc(NC(=O)c2cccc(C(F)(F)F)c2)ccc1C 757875778 AGANTQAHFSKSQN-UHFFFAOYSA-N 388.389 5.008 30 20 GKED N#C[C@@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1nc2ccccc2s1 759529915 DYUHIHCVDXTZFB-NSHDSACASA-N 387.291 5.511 30 20 GKED CCc1ccc(CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 762995233 NUHMUASKGBKWHN-HNNXBMFYSA-N 388.414 5.296 30 20 GKED C#CCOc1ccc([C@H](C)N[C@H](c2cccc(Cl)c2)c2ccccn2)cc1 766598334 GMOAKFFVWDUGEL-GAJHUEQPSA-N 376.887 5.187 30 20 GKED Cc1cc(Br)c(F)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 769758187 PUSQTVRHDWEPLN-UHFFFAOYSA-N 398.688 5.231 30 20 GKED C=CC[C@@H](C(=O)O[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 778416182 DXCHTCYFQYSEPB-WIYYLYMNSA-N 379.500 5.349 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 780676822 FVNIVMLWNQNUJH-LAUBAEHRSA-N 391.515 5.644 30 20 GKED CCCOc1c(Cl)cc(/C=C2/CCc3cc(C#N)cnc3C2=O)cc1OCC 788354639 CNSQUXPIXGDBKB-IUXPMGMMSA-N 396.874 5.007 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1c(Cl)cccc1Cl 797572765 IBTSYDCKTFZBRB-MNOVXSKESA-N 381.328 5.727 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 798864405 JJTKCJFHYJPIGP-BXUZGUMPSA-N 380.435 5.439 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1ccc(NC(=O)OC(C)(C)C)cc1 800158136 VRRGFHGRAJCUJD-UHFFFAOYSA-N 380.488 5.333 30 20 GKED N#Cc1ccc(CNC(=S)Nc2ccc(SC(F)F)cc2)cc1Cl 800826384 YSSBPWFUKKLZBH-UHFFFAOYSA-N 383.876 5.013 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(Cl)cc1F 813212714 GEUQIBVEJJTAEJ-GFCCVEGCSA-N 384.760 5.047 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1NCc1cccc(OCCCC#N)c1 816601445 CBAUGDPAURWHCM-UHFFFAOYSA-N 381.476 5.328 30 20 GKED C[C@@H](Sc1nc2ccccc2s1)C(=O)N[C@@H](CCCC#N)c1ccccc1 817325022 VBFGSBKIMKBFLM-WBVHZDCISA-N 395.553 5.328 30 20 GKED CC(C)(CCC#N)CN[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 824395693 IZGCYDDZVNYWPB-VQTJNVASSA-N 385.552 5.047 30 20 GKED Cc1ccccc1CO[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 860478586 CMPSVGPACYOULO-CZUORRHYSA-N 384.888 5.040 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 918486848 GOWHZENYHDLPGP-HXUWFJFHSA-N 394.540 5.026 30 20 GKED CCCc1ccc([C@@H](NC(=O)c2ccccc2OCC#N)c2cccs2)cc1 919987408 DFHRFQOBPUJEMW-JOCHJYFZSA-N 390.508 5.122 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(N=Cc2cc([N+](=O)[O-])ccc2O)cc1Cl 920942101 KWWGJRUUNYOAKI-LJQANCHMSA-N 391.814 5.360 30 20 GKED CC[C@H](C)CN(C)c1ccc(F)cc1C=NNc1ccc(Cl)c(C(=O)O)c1 1776033479 OETNVBLDBHWRIL-ZDUSSCGKSA-N 391.874 5.106 30 20 GKED CC(=NO[C@H](C)c1ccccc1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776082971 DWTMTBZZCWSFRO-QGZVFWFLSA-N 375.424 5.679 30 20 GKED CC(C)=CCOc1ccc(CCC(C)=NNc2cccc(C(=O)O)c2C)cc1 1776086540 AAGBMQLTPVNIIX-UHFFFAOYSA-N 380.488 5.459 30 20 GKED CCCc1ccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)cc1 1776112624 DHIAUDVFXOBNFL-JYRVWZFOSA-N 390.435 5.405 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1scc(Cl)c1Cl 1776355093 LHDIPJAATYTGOY-GQCTYLIASA-N 385.268 5.436 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)cc1)C(=O)O 1776469809 NVGQIVPLCHOTHQ-JQVXPOPVSA-N 386.403 5.334 30 20 GKED CCCCCCCOc1ccc(/C=C\c2nc3cc(C(=O)O)ccc3o2)cc1 1776787872 CGIYHVZTOQVYSQ-ZROIWOOFSA-N 379.456 6.046 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1OC 1776801038 BIFMTCJNUWKFGP-VQHVLOKHSA-N 388.847 5.122 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)C3(C)CCC3)CCC2)cc1 1789448858 JIPYRLVTFGWOSX-FQEVSTJZSA-N 380.532 5.079 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2cc(C)c3ccccc3n2)cc1 23410279 RIAVQQKEAWCDNJ-SFHVURJKSA-N 389.524 5.279 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1F 46861747 VNTTVMHGVDXDHY-SFHVURJKSA-N 394.833 5.395 30 20 GKED C[C@@H](SCc1cccc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCC2 58485767 JAQSKAZIMIZVEU-CQSZACIVSA-N 392.549 5.522 30 20 GKED COc1ccc(CNCCc2cc(Cl)cc(Cl)c2)cc1OCCCC#N 64614410 HMQGGFMMKYIAOL-UHFFFAOYSA-N 393.314 5.017 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)s1)c1nc(-c2c(F)cccc2F)cs1 68348877 OBCKWWDLULQWHC-MRVPVSSYSA-N 380.828 5.293 30 20 GKED N#CCc1ccc(NC(=O)c2cc3ccccc3n2Cc2ccccc2F)cc1 71923980 ZRDITNHXPOKDTQ-UHFFFAOYSA-N 383.426 5.147 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 97546129 PAQLPTNLCDSDKU-GQCTYLIASA-N 376.846 5.329 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1csc(C2CC2)n1 108242376 LENSEUPSEHTLCZ-UHFFFAOYSA-N 397.447 5.297 30 20 GKED N#C[C@@H](NC(=O)c1c(F)cccc1Cl)c1ccc(OCc2ccccc2)cc1 157674001 LBAFIGYNTFYBNJ-HXUWFJFHSA-N 394.833 5.053 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(Cl)ccc2-c2nc(C3CC3)no2)cc1 173850475 UTWDKBUVHRFDPY-UHFFFAOYSA-N 395.846 5.085 30 20 GKED CC(C)CO[C@@H](C)c1noc(CNc2cccc(Oc3ccc(C#N)cc3)c2)n1 174309352 BCNOBSHGAGNMKZ-INIZCTEOSA-N 392.459 5.079 30 20 GKED Cc1ccc(C)c(OCc2nnc(SCc3ccc(Cl)cc3C#N)o2)c1 186409244 GKEXPBDSGKHXDO-UHFFFAOYSA-N 385.876 5.083 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)ccc1OCC#N 209308794 VBTUGXMTUXPEKG-QPEQYQDCSA-N 399.446 5.073 30 20 GKED C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 246683531 HLMUPWFHNKYUEK-YRNRMSPPSA-N 397.519 5.692 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(-c2ccccc2F)s1 263634923 QYOLXHKHTVUBHA-YVMONPNESA-N 380.366 5.209 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)NC3(C#N)CCCCC3)cc12 302369958 MUXNHZHDDKJRPF-UHFFFAOYSA-N 398.919 5.005 30 20 GKED Cc1cc(Cl)cc2nc(SCC(=O)Nc3cc(Cl)ccc3C#N)oc12 303654987 FYERJZAEOWSPLH-UHFFFAOYSA-N 392.267 5.046 30 20 GKED O/C(=N/[C@@H]1CC[C@@H]2CCC[C@H]2C1)C1CCN(c2ccc3cccc(O)c3n2)CC1 329528946 UWCSNRVDPSMWED-FFZOFVMBSA-N 393.531 5.082 30 20 GKED C[C@H](N[C@H](C)c1nc(O)c2ccccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 376865767 AOSMRWBFFYCLHW-DLBZAZTESA-N 394.478 5.286 30 20 GKED Cc1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)ccc1Br 432484813 XGUNSISSONIEKM-SFHVURJKSA-N 386.293 5.314 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cncs2)cc1Cl 432713718 LEMGWTKUZZTSAY-GOSISDBHSA-N 381.888 5.023 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(COc2ccc(C#N)c(C)c2)cs1 434652258 ZTCZVEWYTJRATC-UHFFFAOYSA-N 397.887 5.240 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1sc(-c2ccccc2)cc1C#N 439105323 CNPRKHKWSRYMDR-UHFFFAOYSA-N 397.843 5.409 30 20 GKED Cc1c(CNC(=O)N(C)Cc2cccc(C#N)c2)sc2ccc(Cl)cc12 441015261 QNBPNNXHMLAGSZ-UHFFFAOYSA-N 383.904 5.076 30 20 GKED CCCOc1ccc(Oc2ncccc2CNCc2ccc(C#N)c(C)c2)cc1 443967034 CEZHCYKEYRAGQC-UHFFFAOYSA-N 387.483 5.133 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)c1C 446010576 JZQCXYWNRYTBMB-SFHVURJKSA-N 398.384 5.577 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(c3ccc(C#N)cc3)C2)n1 447690064 AVNPBWGTUMQLCN-KRWDZBQOSA-N 375.497 5.074 30 20 GKED C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1C(=O)N[C@H](CCCC#N)c1ccccc1 458838199 LWKQMNAKAFSSJJ-CIRFHOKZSA-N 381.442 5.182 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)CCCc1cccnc1 459408605 WZWVSCOZCFDSTA-SJORKVTESA-N 382.533 5.009 30 20 GKED Cc1sc2nc(CN3CCCC3)nc(Sc3ccc(C#N)cc3F)c2c1C 463079347 ZHGDUZVJAXHGFH-UHFFFAOYSA-N 398.532 5.066 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)cs2)cc1 464412240 TYJYYUZUMUBLHJ-AWEZNQCLSA-N 387.386 5.022 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 474948551 BOEOFTBEMCKNOM-OXQOHEQNSA-N 387.310 5.744 30 20 GKED N#CC[C@H](CC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)c1ccccc1 475115204 VNTPKQXRUHYMOX-HXUWFJFHSA-N 390.433 5.258 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 479140037 SIICINROWMOXHG-KRWDZBQOSA-N 398.555 5.119 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nnn(-c2ccc(C)cc2)c1C)c1ccc(F)c(F)c1 480658259 BDWHZOXDQBHLOU-QVKFZJNVSA-N 382.458 5.130 30 20 GKED N#C[C@@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1nccc2ccccc12 483985034 USIOKWKFYVBEGR-HXUWFJFHSA-N 389.414 5.533 30 20 GKED C[C@@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487457484 ZSWQFTACRDYBFM-BEFAXECRSA-N 385.305 5.104 30 20 GKED C[C@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487457486 ZSWQFTACRDYBFM-HNAYVOBHSA-N 385.305 5.104 30 20 GKED CCc1sc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1Br 487629345 RLEUQJWTBRZYNS-OAHLLOKOSA-N 391.334 5.238 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@H](CC)C(=O)c3ccccc3)o2)cc1 489759514 PAQIQYNQIZOZEG-GOSISDBHSA-N 380.469 5.055 30 20 GKED N#CC1(CCCOc2ccc(C(=O)c3ccc(Cl)cc3)cc2)CCOCC1 499913172 MTMJKLHVXOBDJW-UHFFFAOYSA-N 383.875 5.050 30 20 GKED N#Cc1ccc(CC(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)cc1 504368937 VYJGXYGVDIPEQT-UHFFFAOYSA-N 388.279 5.170 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccc(Cl)c4ncccc34)n2)c1 509188866 VBADCDKASCBTOW-UHFFFAOYSA-N 390.855 5.136 30 20 GKED Cc1nn(-c2ccccc2)cc1NC(=O)c1ccccc1Oc1ccccc1C#N 511511133 CRMWXISYSKAIIE-UHFFFAOYSA-N 394.434 5.097 30 20 GKED COc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c2cccnc12 511583787 FXNARBJUWRTHHJ-UHFFFAOYSA-N 379.419 5.034 30 20 GKED CC1(CNC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CCCC1 520907235 HSELWYYZWOXJAE-UHFFFAOYSA-N 377.488 5.033 30 20 GKED CCc1cccc2c1OCC[C@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 520940960 AVWZSRHCWXOVPR-CRAIPNDOSA-N 395.528 5.289 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cnc(-c4ccsc4)s3)c2C#N)C1 522127873 AJYKBMCBJFEOPS-SNVBAGLBSA-N 385.539 5.182 30 20 GKED CN(Cc1ccccc1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522574614 CIIVUTCHDZPGKN-UHFFFAOYSA-N 376.843 5.276 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCC(=O)c1ccccc1 524250050 YWWHNRIDABMHKO-UHFFFAOYSA-N 398.462 5.047 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C 525000512 QZDFFXVTBVNBHL-QGZVFWFLSA-N 375.497 5.122 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN1CCCCC[C@H]1c1ccco1 533435269 XGYDPDKXDLFWTM-HKUYNNGSSA-N 397.544 5.087 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccco1)c1ccccc1 536167395 LRIJCILVRQAWJS-HNNXBMFYSA-N 394.858 5.484 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 536935092 MQUQEOUKIGLIIZ-MAUKXSAKSA-N 397.400 5.196 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnn(Cc3ccccc3Cl)c2)c(C#N)s1 538073895 POQSOGGEQYUSBC-UHFFFAOYSA-N 398.919 5.068 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc2ccccc2n1 541175237 CNMQGTPGDCDPID-MOPGFXCFSA-N 377.491 6.185 30 20 GKED CC[C@@H](NCc1cccc(Cn2cnc3ccccc32)c1)c1ccc(C#N)cc1 575310639 DILGOCRYDUEYIB-HSZRJFAPSA-N 380.495 5.197 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCCC34CCCCC4)cc2)ccn1 575911634 OQBVQUMIQONCHU-UHFFFAOYSA-N 376.460 5.076 30 20 GKED N#C[C@@H](NC(=O)c1ccc(C(F)(F)F)s1)c1cccc(Cl)c1Cl 586776751 MTPMHFWBWXYHGQ-SECBINFHSA-N 379.190 5.068 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3sc4c(c3C#N)CCC4)sc2C)cc1 602754329 BABYKYMXBSXHOX-UHFFFAOYSA-N 394.521 5.406 30 20 GKED Cc1ccc(Cl)c(OCC(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 603969408 RGYNFZUITIRUPF-UHFFFAOYSA-N 382.872 5.266 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 608996038 QKIHFMTTZNLLRN-SFHVURJKSA-N 385.467 5.618 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H]1CCC[C@H](C)C1 609078587 BBVADCGPLAGNMZ-UWJYYQICSA-N 391.515 5.488 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccccc3Cl)cc2F)c1 609107058 UEHMQHUYEAQEOI-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#CCn1c(C(=O)NCCC(c2ccccc2)c2ccccc2)cc2ccccc21 609159632 JTHVHBIRHXMGKF-UHFFFAOYSA-N 393.490 5.117 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N(c3ccccc3)C3CCCC3)o2)cc1 609409230 XFHPXHQRAJORAQ-UHFFFAOYSA-N 386.451 5.320 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](C)c2cccc(C)c2)cc1 610043117 FMNAWIVSZVQQRO-QGZVFWFLSA-N 386.451 5.410 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cccc(C#N)c1 610324053 JXMMTJKYNUYKKX-NSHDSACASA-N 383.320 5.095 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610349136 ZSFICBJEQYBUCI-GOEBONIOSA-N 390.512 5.112 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)c1cc2ccccc2n1CC#N 610962818 BPSLUFOSOYCJEH-UHFFFAOYSA-N 397.434 5.218 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1F 611586389 QHLVHXLHEJZRAB-MVWJERBFSA-N 382.323 5.257 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N1CCC[C@](C)(C#N)C1 612315945 WAMFTGPNVOXNJB-JOCHJYFZSA-N 395.528 5.145 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc2ccccc21 617898144 MPIABFFRFCDLLI-ZDUSSCGKSA-N 399.397 5.297 30 20 GKED CSc1ccc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 642281261 UDAXHWWKYAKKEP-SFHVURJKSA-N 378.522 5.639 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1OC(C)C 656393397 LPHSUCSYYPQDJB-OAHLLOKOSA-N 396.512 5.180 30 20 GKED CC[C@H](c1ccccc1)c1nnc(SCCCOc2ccc(C#N)cc2)o1 727690611 LARCEBXDNURYDJ-LJQANCHMSA-N 379.485 5.044 30 20 GKED O=C1/C(=C/c2csc(-c3ccc4c(c3)OCO4)n2)CSc2c(F)cccc21 728440751 TWBQPKGBOCVUGF-WUXMJOGZSA-N 397.452 5.050 30 20 GKED CCN(C[C@H](C)C#N)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 729260887 PDHDQUOLHCANLY-QGZVFWFLSA-N 396.490 5.555 30 20 GKED N#C[C@@H](C(=O)CSc1ccccc1Cl)c1nc2cc(F)ccc2s1 730417015 JVAGZBYBTGLBDY-NSHDSACASA-N 376.865 5.057 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3C#N)c2)cc1OC 731320144 VSWCTBHKYKUWMC-ZRDIBKRKSA-N 399.446 5.051 30 20 GKED N#CCSc1ccccc1C(=O)NCC1(Sc2ccccc2)CCCC1 731653964 DKLOGFRMOFFHSS-UHFFFAOYSA-N 382.554 5.137 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1csc2ccccc12 731989965 CZRCPFCSELJAFY-INIZCTEOSA-N 378.497 5.199 30 20 GKED C=CC[C@H](NC(=O)NCCC(c1ccccc1)c1ccccc1)c1ccncc1 734515288 KPSZXGUPMBRNMM-DEOSSOPVSA-N 385.511 5.220 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3csc(-c4ccsc4)n3)c2)s1 740013345 FALGCOIJCYEOIL-UHFFFAOYSA-N 393.562 5.762 30 20 GKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1sccc1Br 741844695 RUXOUVIZWIMICA-WAYWQWQTSA-N 391.208 5.348 30 20 GKED CCCCCC[C@@H](C)C(=O)Nc1nnc(SCc2ccc(C#N)cc2)s1 741885653 SHCLVOTUSBSUQP-CQSZACIVSA-N 388.562 5.247 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2SCCc3sccc32)cc1 742537765 PGKZEFYNVUZLFR-TZIWHRDSSA-N 390.533 5.373 30 20 GKED COc1ccc(Cl)c(NC(=S)N(Cc2ccc(C#N)cc2)CC(C)C)c1 742990589 ISOORPJZYRNVEK-UHFFFAOYSA-N 387.936 5.075 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)N[C@@H]3CCc4ccccc4C3)cc2)c1 742996704 CDHHBXOICVIEDD-OAQYLSRUSA-N 399.519 5.194 30 20 GKED CS[C@@H]1CC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 743103447 BOGLERDFAPNVDF-KVSKMBFKSA-N 399.947 5.401 30 20 GKED CC(C)c1nc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cs1 754860450 RUBQQMFYZQYZOA-UHFFFAOYSA-N 381.476 5.468 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1nc(C(F)(F)F)cs1 767362832 SLTHTYPRIAGKOD-UHFFFAOYSA-N 389.617 5.353 30 20 GKED CC(C)(C#N)c1ccc(CNc2cc(C(=O)N3CCCCC3)ccc2Cl)cc1 774288527 OPLSEWFBIXJNSW-UHFFFAOYSA-N 395.934 5.379 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2sc(-c3ccccc3C)nc2C)cc1 775825594 VUJSGWZGCIONML-UHFFFAOYSA-N 375.497 5.296 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(CF)cc1 776905380 AJOGBKADKSPCFI-HNNXBMFYSA-N 388.533 5.280 30 20 GKED N#CCOc1cccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 779589062 WJQMCNHNSCJZCZ-UHFFFAOYSA-N 383.791 5.023 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(-c2ccccc2)o1 784831596 MUFWZYHBNLGZRP-LJQANCHMSA-N 386.451 5.033 30 20 GKED Cc1cc(/C=C/C(=O)c2cnn(C(C)C)c2C)cc(C)c1OCc1ccccn1 787187373 QXXMSEDPKYFTGV-MDZDMXLPSA-N 389.499 5.259 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(C#N)cc3Cl)cs2)cc1 788360064 GPYAZIXWLIWYGA-UITAMQMPSA-N 380.856 5.240 30 20 GKED CCCCCCCCS(=O)(=O)[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1 790143609 OPQNBLPCJYWMGZ-HNNXBMFYSA-N 382.501 5.020 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)OCc2cccc(C(F)F)c2)c1C(F)F 791761931 JGHIPERDWLFYBY-UHFFFAOYSA-N 398.278 5.154 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797571935 SAKMFWFISBIHOV-DGCLKSJQSA-N 380.435 5.439 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(C(F)(F)F)CCCCC3)n2)cc1 850763353 ZQUCUDPZEACKJX-HNNXBMFYSA-N 392.446 5.808 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1scnc1C 915111264 FLFOMBGGVTUSDB-UHFFFAOYSA-N 379.514 5.268 30 20 GKED COc1ccc2oc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)c(C)c2c1 915175247 RMXSIDOAGODANP-UHFFFAOYSA-N 399.406 5.061 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3c(F)cccc3s2)cc1 916914702 RIKDFRDLNKHJEZ-KRWDZBQOSA-N 394.471 5.344 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OCc3nccn3C)cc2)c2ccccc12 917517466 FZZSMVSMYGPFSO-LCYFTJDESA-N 398.462 5.057 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccnc3SC(F)F)cc2)cc1 921034759 CBEQJIDWXLNDOZ-UHFFFAOYSA-N 397.406 5.313 30 20 GKED O=C(O)c1ccc(Br)c(C=NN(c2ccccc2)c2ccccc2)c1 1776032748 PATLOOGMKIRBRJ-UHFFFAOYSA-N 395.256 5.320 30 20 GKED O=C(O)[C@@H](Oc1cccc(C=NNc2ccc(Cl)cc2F)c1)c1ccccc1 1776106594 MLLRWGUTCGGXLA-FQEVSTJZSA-N 398.821 5.130 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1 1776125574 MATPLMUZYDAOMD-JVVYVMHDSA-N 394.511 6.185 30 20 GKED Cc1ccc(-c2cccc(/C=C\C(=O)c3cccc(O[C@@H](C)C(=O)O)c3)c2)cc1 1777429697 INVIEPOUGJEQNK-RMHQSFGDSA-N 386.447 5.410 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)COc3c(Cl)cccc3Cl)c2C#N)C1 23055568 XLTRTGBCILHDAG-JTQLQIEISA-N 395.311 5.069 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1 65680106 ISINUIITIDFZRZ-UHFFFAOYSA-N 382.341 5.622 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nnc1-c1ccncc1 97292693 GMQBTEZQTYGNHF-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CC(C)c1noc([C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)n1 102778531 MFHHCYYFSCVHHQ-CQSZACIVSA-N 396.878 5.470 30 20 GKED COc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 108530498 KHADOTQMULCLEB-QFBILLFUSA-N 395.528 5.316 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 108530995 DRLQPXASSDPPMJ-IIBYNOLFSA-N 393.556 5.924 30 20 GKED CC(C)[C@H](Oc1ccccc1C#N)C(=O)Nc1cccc(C2SCCS2)c1 108658298 VMQYVYODSOTSFF-IBGZPJMESA-N 398.553 5.079 30 20 GKED COc1ccccc1Oc1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cc1 111390236 AECZRIURTFQBLK-GOSISDBHSA-N 388.467 5.068 30 20 GKED CC(C)CC(=O)Nc1cccc(CNc2ccc(C#N)cc2C(F)(F)F)c1 112665913 SDBOKIIZWYIOHY-UHFFFAOYSA-N 375.394 5.174 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 118444512 BLWHPDIGNFQMDR-HOTGVXAUSA-N 395.553 5.243 30 20 GKED C[C@@H](N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 123873989 UDIBIVWIGINPEC-VXGBXAGGSA-N 387.270 5.327 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2cccc(F)c2)c2nccn2C)cc1 128558920 JNQRSSQPGWLEQQ-HRAATJIYSA-N 399.897 5.131 30 20 GKED N#CCC[C@@H](NC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1)c1ccccc1 160560404 BQGZDFCUPQWCAE-OFNKIYASSA-N 386.499 5.450 30 20 GKED C[C@H](Nc1ccc(NC(=O)C2(c3ccc(C#N)cc3)CC2)cc1)c1ccccc1 189397685 JUISHPAKPHMUAN-SFHVURJKSA-N 381.479 5.402 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC(=O)c1ccccc1F 266358831 PJXFUOHYULWQKM-CABCVRRESA-N 384.476 5.068 30 20 GKED COCc1nc(Oc2cccc(F)c2C#N)c2c(-c3ccccc3)csc2n1 301825441 ISKZQQFALDAIQF-UHFFFAOYSA-N 391.427 5.308 30 20 GKED Cc1ccnc2sc(C(=O)N3CCC[C@H](C(O)=Nc4ccccc4)C3)c(C)c12 329348660 CVFSTKHWEKWMJD-INIZCTEOSA-N 393.512 5.054 30 20 GKED C/N=C(/O)C1CCC(/N=C(/O)Nc2cccc(CSC3CCCC3)c2)CC1 329400370 BBVLPXWLHKZGBV-UHFFFAOYSA-N 389.565 5.333 30 20 GKED O/C(=N/CCc1cc2ccccc2[nH]1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329483453 RWWGEDOLKGWSDP-IBGZPJMESA-N 390.531 5.174 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@H](c2ccc(Cl)cc2)C2CCC2)CC1)C1CC1 330022981 HZDUCWGSPCIQLL-UUKMXZOPSA-N 388.939 6.063 30 20 GKED Cc1ccc(-c2nc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)sc2C)cc1 330028991 PJKLGYUAKZIMQD-UHFFFAOYSA-N 397.544 5.940 30 20 GKED Cc1noc(C)c1C(C)(C)/N=C(/O)c1cc(Cl)cc(Br)c1F 330670194 LNKCXJUPMKOQKB-UHFFFAOYSA-N 389.652 5.086 30 20 GKED CC(C)c1csc([C@@H]2CCCN(C(=O)c3ccc(C(C)(C)C#N)cc3)C2)n1 332307442 LOBDCEXWFDVVSA-QGZVFWFLSA-N 381.545 5.087 30 20 GKED CSc1cccc(F)c1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 409455859 IVRSNTDTMCBDEQ-UHFFFAOYSA-N 392.455 5.251 30 20 GKED CC1CCN(CCC[C@H](NCc2ccc(C#N)s2)c2ccc(F)cc2)CC1 421871223 FWRAGYNIDSVVFM-QFIPXVFZSA-N 385.552 5.102 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc3c(ccc4ccccc43)s2)c1 429921232 HKFYNOQKLFZXOM-UHFFFAOYSA-N 375.478 5.317 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)s2)o1 430624189 IORJTCYWRZXBMC-GFCCVEGCSA-N 385.514 5.264 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 432859485 OLANATPNRTYXRT-WZONZLPQSA-N 393.556 5.442 30 20 GKED CCN(C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)c1ccc(C#N)cc1 432939399 QYCROQGQPKEBHV-UHFFFAOYSA-N 379.463 5.228 30 20 GKED CC1(C)CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCS1 433226659 HPIWJECALQCKDG-UHFFFAOYSA-N 381.501 5.100 30 20 GKED C=CCC[C@H](NC(=O)NCCc1coc(-c2ccc(F)cc2)n1)c1ccccc1 435759843 JFUDKUBVFWBSJO-NRFANRHFSA-N 393.462 5.030 30 20 GKED Cc1ccccc1-n1c(S[C@H](C)c2cccc(C#N)c2)nnc1-c1cccnc1 442911658 GWQHXOYYMIIBPD-QGZVFWFLSA-N 397.507 5.363 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CCCC4)c2)cs1 443813422 JBLJCUUXVYSCMT-UHFFFAOYSA-N 379.510 5.183 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)N(Cc1ccco1)c1ccccc1C#N 443832542 DWRNHXPQPSVZNN-JUXOCIIHSA-N 380.488 5.058 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 445971796 PGFOEKXVGIIEIF-HZMBPMFUSA-N 397.334 5.066 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cnc(Cc2ccccc2)s1 446067054 DEQYATIXTHUNCY-UHFFFAOYSA-N 399.475 5.046 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc(-c2ccccc2)cs1 447173342 DUJVOAKSEHVHRP-OAHLLOKOSA-N 390.361 5.458 30 20 GKED C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 452649486 KCOZFDYDFXOGEY-YOEHRIQHSA-N 388.389 5.154 30 20 GKED FC(F)Oc1ccccc1[C@H](NCc1ccc(C(F)F)cc1)C(F)(F)F 461372706 FQCCGEGKTAKGHD-AWEZNQCLSA-N 381.291 5.619 30 20 GKED C[C@H]1C[C@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCN1Cc1ccccc1 463255330 KXTOCTMPUWVLHQ-SIKLNZKXSA-N 398.510 5.211 30 20 GKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467690466 FWEZNMBEZFEMTO-BEFAXECRSA-N 397.906 5.443 30 20 GKED Cc1ccc([C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CCC2)o1 469281788 GNMRCPNOFFLXOL-HSZRJFAPSA-N 377.488 5.124 30 20 GKED N#Cc1ccc(C[C@H](C#N)C(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 471439798 CAUBEVWCBZIQKN-HXUWFJFHSA-N 385.854 5.200 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccccc1 474413983 UTBHBDAXWLFYNP-IBGZPJMESA-N 381.435 5.521 30 20 GKED CO[C@H](C)c1nc(CSc2nc3c(c(-c4ccco4)c2C#N)CCC3)cs1 476479217 DRUBZJJRKMIEGP-GFCCVEGCSA-N 397.525 5.158 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(Cl)cc1Cl 480237679 QUOZQLHCBOLTAF-UHFFFAOYSA-N 390.314 5.233 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1cnc2ccccc2n1 483232458 JVUKHTBSIQVSQX-LBPRGKRZSA-N 398.274 5.641 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2cccs2)c2ccc(F)cc2)cc1 483434229 DASCHVCVFNAISG-UHFFFAOYSA-N 382.485 5.084 30 20 GKED O=C(N[C@H](c1ccccc1OC(F)F)C(F)(F)F)c1ccc(C(F)F)cc1 493413031 WDQSZRHEGBNHNR-CYBMUJFWSA-N 395.274 5.259 30 20 GKED C=CCN(C(=O)c1ccsc1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 502944382 HMGNJYOQTPVLKA-UHFFFAOYSA-N 395.336 6.011 30 20 GKED C[C@@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)cc1 504014131 USEOPIDSZKJVPO-INIZCTEOSA-N 398.428 5.387 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(C#N)cc1 505320241 WBAWSVKEIPSBKR-GHMZBOCLSA-N 380.250 5.126 30 20 GKED CCc1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)o1 506477048 KRACGISGSOSNAP-KRWDZBQOSA-N 379.847 5.107 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 506880818 FQYHCDNPDQNDJQ-UHFFFAOYSA-N 394.862 5.162 30 20 GKED CN(Cc1cccc(C#N)c1)Cc1csc(-c2cccc(Br)c2)n1 507190792 FQQIYBBFZGEPOS-UHFFFAOYSA-N 398.329 5.076 30 20 GKED N#CC1(c2ccccc2)CCC(NCCc2csc(-c3ccccc3)n2)CC1 507569909 SPWXSSHXZYEDKO-UHFFFAOYSA-N 387.552 5.346 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3CCC(OC(F)F)CC3)cc2)cc1 508178835 VKOHFSSQOXJMRY-UHFFFAOYSA-N 386.398 5.087 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2ccc3c(c2)COC3)cc1Cl 508451395 KHWBDNFEKBMWCO-UHFFFAOYSA-N 390.826 5.286 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1ccccc1F 510857083 NMUIVGCLIFVXSH-UHFFFAOYSA-N 389.430 5.462 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(-c2ccc(F)cc2)o1 514958158 TUISIFLOIXBTFA-UHFFFAOYSA-N 381.451 5.082 30 20 GKED Cc1nc(NC(=O)c2cccc(CC#N)c2)sc1Cc1cccc(Cl)c1 515633620 ULCHVJQIMHYMAW-UHFFFAOYSA-N 381.888 5.014 30 20 GKED CCc1cc(C#N)c(NC(=O)[C@@H](C)Sc2ccc(Br)cc2)s1 515710877 BPSCXUVVWKDHOE-SNVBAGLBSA-N 395.347 5.064 30 20 GKED CCn1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc2ccccc21 518175206 UUIBDCAZJVPDPZ-AWEZNQCLSA-N 379.872 5.414 30 20 GKED C[C@H](SCCC(=O)Nc1ccccc1C#N)c1ccc(OC(F)(F)F)cc1 518914556 NCJZLNCDMNHSSY-ZDUSSCGKSA-N 394.418 5.280 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@@H](C)C(C)C 520055275 BUWCCNRCPUVHPG-OXJNMPFZSA-N 383.923 5.894 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccccc1C(F)(F)F 521235600 QSOYIHKDNPVKKH-UHFFFAOYSA-N 386.398 5.487 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1ccc(F)c(F)c1 521316378 JYFJZWTUTNTFJF-CQSZACIVSA-N 393.393 5.068 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2nc(C3CC3)sc2c1 521427519 LHXBUASDBGLMAU-UHFFFAOYSA-N 390.512 5.488 30 20 GKED C=CCn1c(SCc2cc(Cl)ccc2Cl)nnc1-c1ccoc1C 525110720 GQKLPOQLJTUJML-UHFFFAOYSA-N 380.300 5.632 30 20 GKED C[C@@H](N[C@H](C)c1cc2ccccc2s1)C(=O)N(CCC#N)c1ccc(F)cc1 527485532 LGTGQAJFWRMEGT-HZPDHXFCSA-N 395.503 5.026 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc1 533899514 AMIWTSJORPFYSV-UHFFFAOYSA-N 398.249 5.499 30 20 GKED C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(OCc2ccccn2)c1 540704832 AXEZBJOYDIXCQN-IAGOWNOFSA-N 375.447 5.083 30 20 GKED C[C@@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542015866 UUUOFQOSCIMJKI-QGZVFWFLSA-N 397.453 5.870 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 551355833 HAKNBTXCVYSAQD-UHFFFAOYSA-N 395.915 5.195 30 20 GKED N#CC1(CNC(=O)Nc2ccc(-c3nc4cccc(Cl)c4s3)cc2)CC1 559406889 DTQBXTQKLJYPSL-UHFFFAOYSA-N 382.876 5.042 30 20 GKED Cc1c(C(=O)N[C@H](C)Cc2nc3ccccc3s2)sc2ccc(C#N)cc12 560261977 ANZSYORKYVYXIL-GFCCVEGCSA-N 391.521 5.052 30 20 GKED C=CCC1(c2nc([C@H](OCC)c3ccc(F)cc3C(F)(F)F)no2)CCC1 584258408 QOMVJZSKLMNNAK-OAHLLOKOSA-N 384.373 5.351 30 20 GKED CC(C)O[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 584778758 XULAGXGMQOOMOG-UYAOXDASSA-N 397.906 5.027 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3c[nH]c4cc(Cl)ccc34)cc2)ccn1 589543411 FFJSMTJIEOXAHY-UHFFFAOYSA-N 388.814 5.133 30 20 GKED Cc1c(C(=O)N2CCS[C@H](c3ccccc3)C2)sc2ccc(C#N)cc12 590037035 VFWRVVRLIZFWND-IBGZPJMESA-N 378.522 5.012 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1C(F)(F)F 591780378 DMCQFVPYZJQXOW-UHFFFAOYSA-N 383.238 5.612 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC[C@H]1CCc2ccccc2N1 593758371 SXGGFRXGLCIWRL-FUHWJXTLSA-N 394.544 5.019 30 20 GKED Cc1ccccc1Oc1cc(F)cc(F)c1NC(=O)N1CCC(C)(C#N)CC1 598657301 HVTXXRCAYANBDL-UHFFFAOYSA-N 385.414 5.223 30 20 GKED C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1cccc(OCCCC#N)c1 608895861 BUHNCPBKVRFETL-CYBMUJFWSA-N 393.270 5.082 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1c(F)cccc1F 609438581 LGRWFEIQTZYHFE-OLZOCXBDSA-N 375.444 5.242 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1ccc2ccccc2n1 613290591 HSFVCFDEQFMEEG-MRXNPFEDSA-N 387.826 5.342 30 20 GKED O=C(/C=C/c1ccccc1-n1cncn1)c1ccc(-c2ccc(F)cc2)s1 726743474 JBFNCNLSIITHPV-JXMROGBWSA-N 375.428 5.031 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 728182295 HXWMRLWNMXJZKY-SJORKVTESA-N 375.390 5.163 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1csc(-c2cccs2)n1 728440787 VBYOCJSQTAZSQD-FBXUGWQNSA-N 394.477 5.610 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 730193530 KXZNWYFPNUTKOP-FMIVXFBMSA-N 399.450 5.626 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCc3ccc(C#N)cc3)c(C)c2)n1 731283133 ZNFTXEHNWSCFDA-UHFFFAOYSA-N 394.525 5.105 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)N[C@H]2CCOc3ccccc32)cc1 741483754 NBBBVLPQFACPKV-YADHBBJMSA-N 399.519 5.152 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1C#N 742369169 NGURWBHMPZYCTL-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CSCc2ccc(Cl)cc2Cl)n1 747194406 ZLXPBAHWPVCXCI-ZDUSSCGKSA-N 399.368 5.683 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1coc2ccccc12 747706279 SXSZRRDQVXEPDT-HJWRWDBZSA-N 376.393 5.361 30 20 GKED Cc1nc(Cl)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 751612023 ITJXVGSBJZJIKI-GOSISDBHSA-N 396.277 5.605 30 20 GKED Cc1nc(COC(=O)c2ccc(Cl)c(C#N)c2)oc1-c1ccc(Cl)cc1 754906217 PXMYLCFGJXNZMW-UHFFFAOYSA-N 387.222 5.186 30 20 GKED CCCn1c(Sc2snc(Cl)c2C#N)nnc1-c1ccc(Cl)cc1 771002161 VBGIZSVKAHKFNA-UHFFFAOYSA-N 396.328 5.141 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(-c2ccncc2)cc1 775526203 IVPSYKCRAMMIIN-MRXNPFEDSA-N 377.875 5.155 30 20 GKED C=CC[C@H](NC(=O)c1oc2c(C)cc(Br)cc2c1C)c1ccncc1 777671451 UYNWTOZRDTUJTQ-KRWDZBQOSA-N 399.288 5.254 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cc(Cl)ccc1Cl 779265111 MCXRXJBWVDBYLV-QMMMGPOBSA-N 388.081 5.663 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(Sc3ccccc3Cl)cc2)nc1 782037448 YZTOLMRMFLPRSL-UHFFFAOYSA-N 394.887 5.080 30 20 GKED CC(=O)Nc1ccc(C(=O)/C=C/c2cnc(-c3ccc(Cl)cc3)s2)cc1 789147833 LAFFOUFOSONLFQ-ZHACJKMWSA-N 382.872 5.318 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)cc1 793791349 WLKVMHMHOJJZSJ-UHFFFAOYSA-N 383.442 5.009 30 20 GKED CC(C)(CCC#N)COC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 810825950 SITVBMFMNQKIPW-UHFFFAOYSA-N 392.471 5.239 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2csc(-c3ccccc3F)n2)cc1 812245119 PXIQPEIRCPUVJF-BMGYJQCNSA-N 378.428 5.136 30 20 GKED Cc1cc(NC(=O)CCCCCC#N)c(C(=O)N[C@H](C)c2ccccc2)cc1F 813285199 MBYLGURHUKQEGN-QGZVFWFLSA-N 395.478 5.038 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 817618092 TYOQGZNQDLNSNZ-UHFFFAOYSA-N 395.553 5.210 30 20 GKED CC(F)(F)C(C)(C)CNC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 868780004 YHDJBCRYEFSJNB-UHFFFAOYSA-N 386.327 5.021 30 20 GKED N#CC1(CCCC[S@](=O)Cc2coc(-c3cccc(Cl)c3)n2)CCC1 899387726 SFSXLXAMPXDORH-VWLOTQADSA-N 376.909 5.108 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCOc2ccc(Cl)cc2)cc1 915598613 XAFSDHOWYZNWBS-JOCHJYFZSA-N 390.870 5.403 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(F)c1)c1nc(-c2ccc(Cl)cc2)cs1 916628466 SWZAVEUAAYELTC-INDRUJQFSA-N 382.847 5.492 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCSc2ccccc2)cc1 916953728 DMBBNDNTPMCZTD-JXFKEZNVSA-N 380.513 5.030 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cn(CC)c3ccccc23)cc1 916955828 VDGPKKZQOZTYHH-UZLBHIALSA-N 387.483 5.136 30 20 GKED Clc1cnc(NN=Cc2c(-c3ccccc3)nc3sccn23)c(Cl)c1 917027528 CXBYDJTXOZUMLI-UHFFFAOYSA-N 388.283 5.211 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CCSc3ccccc3)n2)cc1 920141801 RMJQJAVYYIOLGK-GOSISDBHSA-N 389.505 5.040 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)C(F)(F)c3ccc(F)cc3)c2)c1 920844135 UXCOVGGXHRKLEI-UHFFFAOYSA-N 396.368 5.007 30 20 GKED O=C(O)C(=O)/C(=C\c1cccc(Oc2ccccc2)c1)c1ccc2ccccc2n1 1776116507 VZNRVVYTBLNOOV-PGMHBOJBSA-N 395.414 5.221 30 20 GKED O=C(O)c1cc2cc(/C=C/C(=O)c3ccccc3OCc3ccccc3)ccc2o1 1776126131 CUCHKKASYRZWEQ-ZRDIBKRKSA-N 398.414 5.606 30 20 GKED C=CCOc1ccc(CNc2cc(C(=O)O)ccc2OC(C)C)cc1Cl 1776184564 JXJCQUSKGIZGNO-UHFFFAOYSA-N 375.852 5.002 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2cccc(C(=O)O)c2OC)cc1 1776786599 AUASJKWVECMGDT-UHFFFAOYSA-N 383.488 5.549 30 20 GKED N#Cc1ccc(OCCSc2nnc(-c3ccco3)n2C2CCCCC2)cc1 11152262 QTWCSGOSZMFLBO-UHFFFAOYSA-N 394.500 5.086 30 20 GKED N#Cc1ccc(CSc2nnc(Cc3ccccc3)n2-c2ccccc2)cc1 12105290 XWEODZSKIQGASZ-UHFFFAOYSA-N 382.492 5.022 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2sccc2-c2ccccc2)c1 71068579 KQXAMUFMRQDJKM-GOSISDBHSA-N 376.481 5.026 30 20 GKED Cc1nc(NC(=O)C(C)(c2ccccc2)c2ccccc2)sc1SCC#N 105369016 RUNGRXVYRSXJJS-UHFFFAOYSA-N 393.537 5.012 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@H](C)C(C)(C)C#N 131690913 DYILTVLVJYUUGS-GFCCVEGCSA-N 390.892 5.057 30 20 GKED Cc1ccc(Oc2ccccc2)c(NCc2nnc(-c3ccc(C#N)cc3)o2)c1 134103463 USAAXKRDRFQKLM-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(NC(=O)C2CC2)ccc1C)c1ccccc1 155192904 SPKUWKHFQNCAFC-HXUWFJFHSA-N 377.488 5.173 30 20 GKED C[C@H](CCC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 160176045 XPJQNWTXOZCRCG-CJNGLKHVSA-N 389.282 5.225 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1CC(F)(F)F 161173206 MXGLWMLZNKAJDF-UHFFFAOYSA-N 388.842 5.726 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(-c2ccccn2)s1 171414192 DMGALWAJUFORFW-UHFFFAOYSA-N 388.477 5.058 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 173122391 UTUIILGRALMZGK-MJGOQNOKSA-N 381.545 5.566 30 20 GKED C[C@H](c1ccccc1Cl)N(CC(=O)Nc1ccccc1SCC#N)C1CC1 173224851 IXPRBMIPXUTCDI-OAHLLOKOSA-N 399.947 5.120 30 20 GKED N#Cc1ccc(/C=C2\CCn3c2nc2scc(-c4ccccc4)c2c3=O)s1 176404115 BNIWGEKURDECCJ-GXDHUFHOSA-N 387.489 5.002 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)c1c(F)cc(C#N)cc1F 180384886 IVEOQBJRNZRKEF-UHFFFAOYSA-N 377.394 5.009 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1csc(-c2ccc(Cl)cc2)n1 277991828 UHBQSBOWOGGFKD-DEOSSOPVSA-N 380.966 5.432 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cc(F)ccc2Oc2ccccc2)cc1 303216183 SVWBTDORFSQBNC-UHFFFAOYSA-N 392.455 5.362 30 20 GKED COc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/Cc5scnc5C)(C4)C2)C3)cc1 329082098 DKYSBVUTWAGWCS-TWVWUCKLSA-N 396.556 5.455 30 20 GKED O=C1CCC(C(O)=Nc2ccc(Cl)c(/C(O)=N/C3CCCCC3)c2)CC1 329852597 UUQCFYDYBHNDSO-UHFFFAOYSA-N 376.884 5.325 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 409755941 SMRJQRGYUOUOSC-RBUKOAKNSA-N 385.294 5.183 30 20 GKED Fc1ccc(NCc2ccc(C(F)(F)F)cn2)c(OCCC(F)(F)F)c1 409864226 LGQKLVASQSXWDU-UHFFFAOYSA-N 382.279 5.183 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cc(C#N)ccc1OC(F)F 409921217 ILYOWTDLTFWCLG-JTQLQIEISA-N 399.224 5.284 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NC[C@H]3CCCC(F)(F)C3)cc2)cc1 410259904 JWCVSWVUOKARBO-KRWDZBQOSA-N 384.426 5.100 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1cccc(OC(F)F)c1 424662927 MOSNAMBTSXASRD-AWEZNQCLSA-N 390.455 5.254 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccccc1 432624494 VKIXZROOYSEKEN-LJQANCHMSA-N 391.471 5.285 30 20 GKED CC(C)n1cc2cc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2n1 432956994 CHGGAHOTZPXOFD-FQEVSTJZSA-N 375.476 5.174 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 435615509 PLYQHAMEHIMQRU-MJGOQNOKSA-N 379.529 5.910 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C2(c3cccc(C#N)c3)CC2)cc1)c1ccccc1 435676918 ZWLIHBACZCCNAT-GOSISDBHSA-N 381.479 5.402 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccc(C#N)cc1OC(F)F 439546542 IJAWUSQTPRZLOK-UHFFFAOYSA-N 387.430 5.065 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(CCC(F)(F)F)cc2)c1 439657040 YAUKISPQSAPKGE-UHFFFAOYSA-N 390.405 5.241 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3ccccc3SC[C@H](C)C#N)cc2)cs1 440486140 NPBKCPQYUCMLHM-CQSZACIVSA-N 393.537 5.623 30 20 GKED N#CC[C@H](Cc1nc(-c2ccccc2-n2ccc(C3CC3)n2)no1)c1ccccc1 453203391 BPFOBXYJQLLQMV-LJQANCHMSA-N 395.466 5.040 30 20 GKED CC[C@H](CC(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 457469948 YCJDVJGEGKJACR-DYVFJYSZSA-N 376.834 5.615 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 460296964 KJQUKWQASUXOIF-DEOSSOPVSA-N 398.506 5.231 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 466673694 VFZMMACPUHRYGV-AWEZNQCLSA-N 389.487 5.391 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(F)cc([N+](=O)[O-])c1 470708033 RJYFGHRQONGROF-UHFFFAOYSA-N 393.399 5.009 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)cc1C(F)(F)F 472352319 ULESQLDYRBCHAK-UHFFFAOYSA-N 392.686 5.502 30 20 GKED Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3sccc3C#N)nc12 497992058 XLGUFIMRCCGXDO-UHFFFAOYSA-N 389.505 5.385 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 508143867 PHCNEDCJJYHJTJ-UHFFFAOYSA-N 389.282 5.060 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1ccc(SCC)cc1 509532792 MUFSNYJJPANMTN-KRWDZBQOSA-N 384.545 5.266 30 20 GKED CCN(C(=O)CC(c1ccccc1)c1ccccc1)[C@H](C)c1ccc(C#N)cc1 509603214 KSYHFYFDHNEVMW-HXUWFJFHSA-N 382.507 5.690 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2cccc(C(F)(F)F)c2)c1 510077886 FPWXHOJSJXQLFY-UHFFFAOYSA-N 396.412 5.446 30 20 GKED CC[C@H]1C[C@@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 514121127 RZDPXGOXGABJET-UNMCSNQZSA-N 394.490 5.134 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 517428973 VXNVSTBTOQWVDP-YJYMSZOUSA-N 398.293 5.101 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(Cl)c1 518041277 SJAGBAJWPZVNQL-UHFFFAOYSA-N 380.806 5.704 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 518137721 PZCIUFADGVXSON-LSDHHAIUSA-N 388.920 5.306 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1c(F)cccc1Cl 518681730 HQCBDRRIGURZLV-LBPRGKRZSA-N 377.872 5.053 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SCC#N)c1ccc(Cl)cc1 521025439 XJKUAMFWVOKROM-ZDUSSCGKSA-N 376.934 5.389 30 20 GKED CC(C)N(CC(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534886718 OYGCHMXXKOHCEA-UHFFFAOYSA-N 378.806 5.120 30 20 GKED N#Cc1c(NC(=O)c2ccccc2CCC(F)(F)F)sc2c1CCCCC2 535412916 HUNXIHCREYRZAM-UHFFFAOYSA-N 392.446 5.636 30 20 GKED C=C[C@@H](CC(=O)N(C[C@H]1CCCO1)c1nc2ccccc2s1)c1ccccc1 536215595 URWRCORVKFKUBN-PKOBYXMFSA-N 392.524 5.168 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)CC1 541020220 ZOLLLGASCCQUDY-QGZVFWFLSA-N 399.844 5.145 30 20 GKED CSC[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 541915351 IZBDCQXPCAKPQN-IBGZPJMESA-N 394.462 5.904 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4ccc5ncccc5c4)no3)cc2)nc1 547050695 NTKDZQZJUSIYPD-UHFFFAOYSA-N 391.390 5.011 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc(-c2csc(C)n2)cc1 547943747 VVJGEGHDQHVSTM-UHFFFAOYSA-N 380.538 5.327 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1c(CC)cccc1CC 553892435 PTJBVZSKIZEFRK-HNNXBMFYSA-N 390.980 5.542 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 558239486 RLYRXFRXEFCFKM-OALUTQOASA-N 387.405 5.229 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3Cc4cccc(Cl)c4C3)cc2)c1 558341272 VLLMRWNSMHLILX-UHFFFAOYSA-N 389.842 5.552 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccn(C4CCCCC4)n3)n2)cc1 569660684 CKROAOVWDIPOKP-GOSISDBHSA-N 390.512 5.310 30 20 GKED CC(C)N1CC[C@H](NCCCCC(C)(C)C#N)[C@@H]1c1ccc(Cl)c(F)c1 578859358 VPHWOOYMQDILQS-PMACEKPBSA-N 379.951 5.313 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C(C)C)cc1 583398242 IHHKAQHKXIRAEG-IIBYNOLFSA-N 397.544 5.608 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cc(F)c(F)cc1Cl 591780438 FPAJOISOWDNBSE-UHFFFAOYSA-N 385.666 5.525 30 20 GKED N#CC1(CCCSCc2ccc(Br)c(F)c2F)CCOCC1 600651144 WQWSSSQMEGUGII-UHFFFAOYSA-N 390.293 5.061 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(F)c(F)c2F)cc1 603470278 GGFCSHGUENDBQV-UHFFFAOYSA-N 398.409 5.520 30 20 GKED CO[C@H](C)c1cccc(N[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 608889109 IIBLLPDJAJEOKJ-LSDHHAIUSA-N 397.544 5.035 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1cc2ccccc2n1CC#N 609162935 YLFNDXWXGFSTNK-CYBMUJFWSA-N 386.282 5.305 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(Oc2ccccc2)c1 609377063 PBOXSIIINAVMEM-KRWDZBQOSA-N 388.492 5.983 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N(CC3CC3)C3CCCCC3)cn2)cc1 609554269 YTDPCOVLAYTUGY-UHFFFAOYSA-N 390.487 5.322 30 20 GKED N#C[C@H](Sc1nc(O)c2c(-c3ccc(F)cc3)csc2n1)C1CCCCC1 609649070 VQVXITIHBIVZMD-INIZCTEOSA-N 399.516 5.768 30 20 GKED N#Cc1c(NC(=O)c2cc3occc3s2)sc2c1-c1ccccc1CC2 609856239 SLIDNCGQBQXLGH-UHFFFAOYSA-N 376.462 5.445 30 20 GKED C[C@@H](c1ccccc1)n1c(SCCC(C)(C)C#N)nc2ccccc2c1=O 610285625 SBNLJERQZWOSQQ-INIZCTEOSA-N 377.513 5.038 30 20 GKED N#C[C@H](C(=O)c1occc1CSc1ccccc1)c1ccc2ccccc2n1 613292442 KDZIPDMVYMGXSF-IBGZPJMESA-N 384.460 5.610 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1cccc(C#N)c1 618471939 RMOIDPIHOBELLM-MGPLVRAMSA-N 399.775 5.015 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 618765091 DQWHTMGTVGBZGK-OAQYLSRUSA-N 377.488 5.072 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(Cl)c(F)c1 619127259 WSVMUAQKOKRCKW-UHFFFAOYSA-N 379.703 5.263 30 20 GKED C=CC[C@@H]1CCN(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)C1 626504646 STMICWZDOQXTJL-MRXNPFEDSA-N 397.906 5.331 30 20 GKED N#C[C@H](C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1nc(C2CC2)cs1 647377062 MTTVVARGSVLFQD-GOSISDBHSA-N 393.512 5.029 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 672758748 AYKLBEYDTIQRAS-UHFFFAOYSA-N 390.911 5.333 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](Cn1cccn1)c1ccccc1 682777376 QMUXMKALOKSNQD-JOCHJYFZSA-N 388.515 5.298 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)cc1NC(C)=O 726428008 CQFKVFRHMIGWHA-NTMALXAHSA-N 395.842 5.463 30 20 GKED COc1cc(/C=C\C(=O)c2sc(-c3ccc(C)cc3)nc2C)cc(OC)c1O 727654603 OCRKSRKAMRKVPW-YFHOEESVSA-N 395.480 5.046 30 20 GKED O=C(/C(=C\c1cccnc1Cl)c1ccccc1)c1nc2ccccc2s1 728700290 NLWBQBYCRIEMPL-SSZFMOIBSA-N 376.868 5.768 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)N[C@@H]1C[C@H]2CC[C@H]1C2 730954685 HOZXEOGJWQPYLC-SGMGOOAPSA-N 399.507 5.186 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)/C=C\c1ccccc1Cl 731340868 UVORAAHNMMWSCG-YBEMTRGBSA-N 392.933 5.147 30 20 GKED COc1ccc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)cc1OC(F)F 732570743 HPICKKKSEGNVEO-CLFYSBASSA-N 387.407 5.316 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)/C=C\c2ccccc2C#N)cc1 732963613 PDLIZPAOWAMUMW-HXHYHFERSA-N 395.506 5.167 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1ccncc1 734667513 GUFHYYQKLOLDGG-SFTDATJTSA-N 383.923 5.583 30 20 GKED C[C@@H](C(=O)OCc1cc(Cl)ccc1OCC#N)c1ccccc1C(F)(F)F 745309396 ONRMDAQUMGZXLB-GFCCVEGCSA-N 397.780 5.108 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@H](C#N)c3nc(C(C)C)cs3)ccc2c1 747193047 CUDSGVJLHAZRFJ-STISFXCESA-N 376.481 5.318 30 20 GKED Cc1cc(/C=C\C(=O)c2coc(C(C)C)n2)cc(C)c1OCc1ccccn1 752891313 SZVHNQNYZBSGAY-HJWRWDBZSA-N 376.456 5.285 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@@H](O)c2cc(Cl)cc(Cl)c2)CC1 768404649 WTQQYAZURJVARU-NYLDSWQDSA-N 389.326 5.021 30 20 GKED COCc1ccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 770264057 DDGPTDGGCVHTFP-UHFFFAOYSA-N 387.439 5.449 30 20 GKED COc1ccc(N[C@H]2CCCc3cc(C#N)ccc32)cc1OCc1ccncc1 776834541 JINHAJDFEHZTBR-QFIPXVFZSA-N 385.467 5.030 30 20 GKED O=C(/C=C/c1cnn(Cc2ccc(C(F)(F)F)cc2)c1)c1cccc(F)c1F 777466405 CELZWAPSIGZWMF-RMKNXTFCSA-N 392.327 5.125 30 20 GKED COc1ccc(C(=O)/C=C\c2cnc(-c3ccco3)s2)cc1Br 788097046 FTNWZELDZJVILX-WAYWQWQTSA-N 390.258 5.070 30 20 GKED Cc1ccc(/C=C/C(=O)[C@H](C#N)c2nccc3ccccc23)c(Br)c1 792104203 NZXUYUPJNMXSTI-BLGFXRMMSA-N 391.268 5.195 30 20 GKED CCOc1cc(O)ccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 792229215 PGJUHHFPJUCLLY-FQEVSTJZSA-N 387.439 5.090 30 20 GKED Cc1nn(Cc2ccccc2)c(Cl)c1CN[C@@H](CCCC#N)c1ccccc1 814659417 MUXMKIPMOZVTLN-QFIPXVFZSA-N 392.934 5.418 30 20 GKED N#C[C@H](NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccc(F)cc1 841740759 KVJLHUXXIRIOAC-RDELFYGPSA-N 380.419 5.088 30 20 GKED N#C[C@H](C(=O)COC(c1ccccc1)c1ccccc1)c1nc(C2CC2)cs1 842937935 HJZBYHCPSWOKAV-LJQANCHMSA-N 388.492 5.003 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ncccc1C(F)(F)F 853290086 UFGKXTHOMQXWSZ-UHFFFAOYSA-N 381.242 5.553 30 20 GKED C=CCN(C(=O)c1ccc(CSc2nc3ccccc3s2)cc1)C(C)C 915148077 UTMZQVWPVXAFON-UHFFFAOYSA-N 382.554 5.625 30 20 GKED Cc1cc(C)cc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 916906730 UYVXOSOLMBMYLP-FQEVSTJZSA-N 384.435 5.057 30 20 GKED Cc1cc(C=Nn2c(S)nnc2-c2ccccc2)c(C)n1C1CCCCC1 917026957 XJSLXSMDDUJAJI-UHFFFAOYSA-N 379.533 5.040 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1cc(-c2ccccc2)cs1 917540812 VJCKUTUEVUUIMA-UHFFFAOYSA-N 376.510 5.153 30 20 GKED N#Cc1ccc(CN(Cc2sccc2Cl)c2ccc3nc(O)[nH]c3c2)cc1 1167789284 LMDCZTWKYLOYFD-UHFFFAOYSA-N 394.887 5.062 30 20 GKED CCCCCCCOc1cccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)c1 1776788968 HOBNZMMUOLKDCI-QYAIIROKSA-N 392.495 5.874 30 20 GKED Cc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)cc1 6338259 FGJMOMHBUTUBLM-SDNWHVSQSA-N 375.855 5.797 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2c(CC)cccc2CC)nc2ccccc21 29575411 NLYMLZSIBSYTCN-MRXNPFEDSA-N 393.556 5.466 30 20 GKED Cc1nc(Cc2ccccc2)sc1/C(O)=N/c1nc(C(F)(F)F)cs1 31509451 ZSXLLTBXLGHECR-UHFFFAOYSA-N 383.420 5.154 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\CCc3ccccc3C2=O)cs1 54895516 BEXWTOUANUHWMT-FOWTUZBSSA-N 392.455 5.179 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc(OC)c1OC 66800323 XSBBFWFKUXMNKW-OAHLLOKOSA-N 396.512 5.079 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(C#N)CCCCC2)cc1Cl 72030215 KCXVXBUCJXTLSY-IBGZPJMESA-N 377.875 5.408 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSC(F)(F)F)cc1Cl 107876067 AANNXZJUVLHPHN-AWEZNQCLSA-N 384.810 5.187 30 20 GKED CCN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@@H](C)c1cccnc1 115769708 HYBJXHWFOZYYKP-KRWDZBQOSA-N 386.455 5.361 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC[C@H]4CCC[C@@H]43)c2)cc1 120114492 MJZMCAYSHSLMNT-OFNKIYASSA-N 389.499 5.128 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 120862939 PJWJBOGZCVQZGC-LJQANCHMSA-N 392.503 5.146 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2)o1 120922214 RYRLNCSWWSOGRH-FQEVSTJZSA-N 388.471 5.632 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 131197151 FALUPMWRVSRKJA-YKSBVNFPSA-N 398.462 5.001 30 20 GKED COCc1nc2cc(NC(=O)Nc3ccccc3S[C@H](C)CC#N)ccc2o1 177090093 VAZPMZFCUPCFLP-CYBMUJFWSA-N 396.472 5.012 30 20 GKED CC(C)Cc1ccc([C@@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C2CC2)cc1 179793309 RGLNSYJSPPGYCQ-HSZRJFAPSA-N 386.499 5.048 30 20 GKED CSc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1 181422474 FVMAEZCAWBNSRN-AWEZNQCLSA-N 385.901 5.070 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 181586560 UQVNNGFQANJAOE-RBUKOAKNSA-N 399.966 5.089 30 20 GKED Cc1cc(F)ccc1CSCC(=O)Nc1ccccc1SC[C@H](C)C#N 182077842 CVBUTHXRGQTPMT-CQSZACIVSA-N 388.533 5.258 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 191518482 VFBAINMAJAJYHK-UNMCSNQZSA-N 378.516 5.580 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)nc3)cc2Cl)c1 216753097 KIGHSSPJOPLWEL-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](COc2ccccc2)C1 272598533 XESWSBNVYLTKMN-ROUUACIJSA-N 395.528 5.014 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)cc1 303888547 PGWDTTIFTOOZJP-SJORKVTESA-N 388.389 5.129 30 20 GKED CS(=O)(=O)c1ccc(N=C(O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1C(F)F 329280491 MXZZOCZLYYNIKX-HZSPNIEDSA-N 385.476 5.222 30 20 GKED Cc1cc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)ccc1OCC(F)(F)F 425647693 FDSJMGDGCHDIPR-AWEZNQCLSA-N 391.393 5.033 30 20 GKED N#CC(CCSc1nnc(-c2ccccc2)o1)(c1ccccc1)c1ccccc1 434642124 DGNLVIBWSXTDJG-UHFFFAOYSA-N 397.503 5.729 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 438053139 AKFYYUOAVWUFMT-MRXNPFEDSA-N 383.517 5.346 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1[N+](=O)[O-] 439658825 BYQKBZATSWWKHU-CQSZACIVSA-N 377.375 5.571 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 439677478 ZDAOSAAOKMEMBT-MRXNPFEDSA-N 389.430 5.237 30 20 GKED N#Cc1ccc(NC(=O)c2csc(-c3ccc(F)cc3)n2)cc1C(F)(F)F 443878663 MUEVHYVVTDYIBP-UHFFFAOYSA-N 391.349 5.092 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 446514505 LTQSSSCCXKFJOS-UHFFFAOYSA-N 399.450 5.051 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c(Cl)c1 452644304 LJZDFAVWSMLAPW-LSDHHAIUSA-N 378.781 5.167 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F)c1ccccc1 455271412 UPXVEAUVYMHSMV-KSZLIROESA-N 381.442 5.232 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ncc(C#N)cc1Cl 462640594 OXNFEVQRVCHIDP-MRXNPFEDSA-N 375.859 5.010 30 20 GKED C=CCOCCCC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccccc1Cl 464055246 IEUPVVRJBAPTMU-FQEVSTJZSA-N 378.299 5.182 30 20 GKED N#Cc1cc(NCc2ncc(-c3cccc(Br)c3)o2)ccc1Cl 467263032 MWOAQFVAAHTFKQ-UHFFFAOYSA-N 388.652 5.241 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@@H]2Cc2ccccc2)cc1 472168815 GCCLEFUWZCIXSA-JOCHJYFZSA-N 398.531 5.308 30 20 GKED CC(C)(C#N)CCCSc1nnc(Cc2cccs2)n1-c1ccccc1 476480079 DBHAHPHVVGMZKB-UHFFFAOYSA-N 382.558 5.342 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1c(F)cccc1Cl 478385195 UDXPRTBFLHPWDE-ZSZQSSIHSA-N 385.870 5.021 30 20 GKED C=CCn1c(SCc2ccc(F)cc2C#N)nnc1-c1ccc(Cl)cc1 483068620 KFNSMHIPRFTTLH-UHFFFAOYSA-N 384.867 5.088 30 20 GKED C[C@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(Br)c1 487157413 PEODNLSXCLQSBN-HNAYVOBHSA-N 385.305 5.104 30 20 GKED N#Cc1cccc(CNc2nc(-c3cccnc3)nc3sc4c(c23)CCCC4)c1 488185203 ULDATYVUJXWEPA-UHFFFAOYSA-N 397.507 5.116 30 20 GKED Cc1cc(CN[C@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)ccc1C#N 488288499 DKRNBGWGGSDISA-CQSZACIVSA-N 381.932 5.803 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc(-c2ccccc2)no1 489778744 XTRVCEFDGAKHHQ-MRXNPFEDSA-N 382.423 5.574 30 20 GKED N#Cc1ccc(CN(C(=O)c2csc(-c3ccc(Cl)cc3)n2)C2CC2)cc1 499314714 AMIQWUQLQWOMMD-UHFFFAOYSA-N 393.899 5.140 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(-c3cccc(Cl)c3)o2)nc2ccccc21 501340555 KCMWOBPHKWTFIC-CYBMUJFWSA-N 396.903 5.779 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(F)cccc2Cl)cc1 505673031 LPQLAJOVXAIVKW-UHFFFAOYSA-N 396.805 5.404 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1cccc(C(F)(F)F)c1 505927671 BFIPSAWQEFHYDY-MRXNPFEDSA-N 388.320 5.099 30 20 GKED C[C@H](C#N)CSc1ccccc1NCCOc1ccccc1Br 507599876 XXKBFHUEIBSALH-CQSZACIVSA-N 391.334 5.192 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)c2ncccc12 509472387 RFKFPAPYBMFPHQ-CYBMUJFWSA-N 381.888 5.535 30 20 GKED N#Cc1c(NC(=O)c2coc(C3CCCC3)n2)sc2c1-c1ccccc1CC2 509556805 YTKFFALDUHYIGW-UHFFFAOYSA-N 389.480 5.283 30 20 GKED N#C[C@H](C(=O)c1csc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 518870183 XGNUFUMIHQIECQ-GFCCVEGCSA-N 396.443 5.793 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)nc1 519407088 UJMYDDPESAFGDN-UHFFFAOYSA-N 375.453 5.132 30 20 GKED C=C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 519419850 QAMFIEVSQKLHGG-UHFFFAOYSA-N 388.876 5.192 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3cccc4cccnc34)cc2)cc1 521090455 GXEJOFBPVCHREZ-UHFFFAOYSA-N 394.434 5.220 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(F)(F)C[C@H]1C 528945443 SFVOSIBLFYYTRN-OAHLLOKOSA-N 385.414 5.311 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 540146778 LPUFVBOPEZQLSR-QRWLVFNGSA-N 395.959 6.468 30 20 GKED COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)c2cccc(CC#N)c2)c1 541441607 HWEVAEJMJANYKM-JWQCQUIFSA-N 396.490 5.132 30 20 GKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 551803230 NMYMHKKHNIDYTQ-OAHLLOKOSA-N 389.480 5.535 30 20 GKED CC(C)(CCC#N)CNC(=O)c1oc2ccccc2c1COc1ccccc1 554097819 DAYAKZOKQISALA-UHFFFAOYSA-N 376.456 5.072 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cccc(F)c2)c(C(F)(F)F)c1 555093595 WWVQHSMBLAXKKY-NRFANRHFSA-N 384.376 5.595 30 20 GKED Cc1c(C(=O)N[C@@](C)(C#N)C2CCCCC2)sc2nc(C(F)(F)F)ccc12 555905303 YVMWLNZAUFXHIB-SFHVURJKSA-N 395.450 5.216 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1nc2ccccc2o1 556886538 LTUUWVGBPTXBSX-FQEVSTJZSA-N 389.414 5.533 30 20 GKED C[C@@H](NC(=O)c1cc(C#N)ccc1Cl)[C@H](C)c1ccccc1C(F)(F)F 571509230 HFOJNVLXTVXCGX-NWDGAFQWSA-N 380.797 5.152 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 582882360 DUWHNERSJWYMSO-NQIIRXRSSA-N 379.504 5.269 30 20 GKED N#Cc1cc(NC(=O)c2sc(C3CC3)nc2-c2ccccc2)nc2ccccc12 584315902 PSVDTCHOZDBBIX-UHFFFAOYSA-N 396.475 5.360 30 20 GKED C[C@H]1CCCCN1C(=O)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 593943978 HDEWZNVBKUZTGK-SFHVURJKSA-N 375.516 5.114 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)NC(C)(C)c2cccc(C#N)c2)c1 596812901 JPHOXLMVUVDNEA-UHFFFAOYSA-N 398.894 5.007 30 20 GKED N#Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)cc1 603940406 BJDNQVZSIQKSAE-HXUWFJFHSA-N 377.806 5.122 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176553 NCEVPUHOGIKMAS-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)c1 609507417 IOYNPKOJVJFYJQ-RUZDIDTESA-N 376.459 5.425 30 20 GKED CC[C@H]1c2ccccc2CCN1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 609625729 UKNXWQQZTJYTNG-UWJYYQICSA-N 393.556 5.029 30 20 GKED Cc1csc([C@H](C)NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 609724416 ZDTWMBGIQAOLIG-ZDUSSCGKSA-N 397.887 5.260 30 20 GKED C[C@@H](SCCC(=O)Nc1ccc(Br)cc1)c1ccc(C#N)cc1 609825664 LHDYBNMYUVXTKL-CYBMUJFWSA-N 389.318 5.144 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)c(Cl)c1 611433591 YONSXLXNYBTZQB-OAHLLOKOSA-N 395.673 5.162 30 20 GKED CCOc1cc(CN[C@@H]2CCc3cc(C#N)ccc32)ccc1OCc1ccccc1 618741606 HKFCUZFAPPWBNY-XMMPIXPASA-N 398.506 5.313 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H]3CCc4cc(C#N)ccc43)cc2)c1 618753934 DRVJSDCUNBWYQP-QHCPKHFHSA-N 394.434 5.031 30 20 GKED O=C([C@H]1CC[C@H]1c1ccc(F)cc1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 627664993 BLYXRIOSLMFRNQ-ZQDZILKHSA-N 397.334 5.051 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@]3(C)CCCc4ccccc43)n2)cc1 726322377 SMHHDGCXKAPILQ-YADARESESA-N 386.520 5.589 30 20 GKED COc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc1NC(C)=O 726427859 ZTAJGPOTMCVKPN-KTKRTIGZSA-N 377.465 5.278 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=S)Nc1c(Cl)ccc(C)c1Cl 728443944 LRNNFJOOLYLJTK-UHFFFAOYSA-N 395.355 5.695 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1ccc(Cl)c(Cl)c1 730953223 ULNNWUMNVAKIGK-UHFFFAOYSA-N 382.341 5.808 30 20 GKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 734082454 BURHIVJSBUDDKF-LPHOPBHVSA-N 382.529 5.601 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccc(OCc4ccncc4)cc3)c2c1 734306654 HUQYLZUEVUYUTQ-WTKPLQERSA-N 384.435 5.047 30 20 GKED CC(C)(NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccs1 740484135 HYGVUEZTFKLHKV-UHFFFAOYSA-N 381.526 5.083 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(SCC(F)F)cc1 741841372 GDLXOCAWZGHIIW-UTCJRWHESA-N 393.505 6.125 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccccc2-c2nc(C)no2)s1 741896950 GTNNNPHCEQSEFZ-UHFFFAOYSA-N 399.520 5.052 30 20 GKED CON=Cc1ccc(C(=O)Nc2cccc(CO[C@H]3CCC[C@@H](C)C3)c2)cc1 745136067 RECBTGMAPGSMGE-VGSWGCGISA-N 380.488 5.015 30 20 GKED CC(=NN=C(C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1)c1cnccn1 745202293 VOGWQDKOJKUBOB-UHFFFAOYSA-N 388.418 5.457 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(OC)cc2F)ccc1OCC(F)(F)F 750893066 NZVBLJPRAFGCBR-XBXARRHUSA-N 398.352 5.070 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(F)cc2F)ccc1OCC(F)(F)F 750903786 RPRFIKWIULOXBC-XVNBXDOJSA-N 386.316 5.201 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1cc(-c2ccc(Cl)s2)nc2ccccc12 751335484 DUDJNUILWCHPNK-CYBMUJFWSA-N 383.904 5.238 30 20 GKED COc1cccc(/C(C)=C/C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 751829826 HIHORDRVFSIPCK-OQRGYWNNSA-N 382.872 5.238 30 20 GKED Cn1nc(C(F)(F)F)c(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1Cl 758933008 YGNKVVLGKRAYIG-WAYWQWQTSA-N 391.780 5.050 30 20 GKED CCN(c1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1)C(C)C 770125248 SZTZGFUGIKSKST-KRWDZBQOSA-N 381.476 5.160 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc(CSC(F)F)o2)cc1 773428497 PSUFHGPSSSOIMW-UHFFFAOYSA-N 384.451 5.564 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(N2CCOCC2)cc1Cl 776841812 PXQVRNTZPZGHSL-KRWDZBQOSA-N 399.922 5.032 30 20 GKED CC(C)c1ccc2c(c1)[C@@H](Nc1ccc(N3CCC(O)CC3)c(C#N)c1)CCC2 777114280 IJOSJCURSPUKHC-DEOSSOPVSA-N 389.543 5.132 30 20 GKED COc1cc(C(=O)/C=C\c2cc(-n3ccnc3)cs2)ccc1SC(F)F 783708471 RGKZVGDKWKOIHV-ARJAWSKDSA-N 392.452 5.153 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc3ccccc3n2CC(F)(F)F)cc1 787256781 RGUTZASHLBPAPR-UHFFFAOYSA-N 385.389 5.073 30 20 GKED Cc1c(C(=O)OC[C@H]2CC[C@@H](C#N)CC2)sc2nc(C(F)(F)F)ccc12 809091262 DBFLYTILXUWRMA-TXEJJXNPSA-N 382.407 5.110 30 20 GKED O=C(/C=C/c1cccc(NC(=O)C(F)(F)F)c1)c1cccc(C(F)(F)F)c1 810197144 LMRIEXYZWKWJEF-BQYQJAHWSA-N 387.279 5.102 30 20 GKED C#C[C@@H](N[C@@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccc(Cl)cc1 811516581 QCMAQASBAXXJMQ-SUMWQHHRSA-N 394.824 5.040 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813214795 DONKNTNBTDUZQN-MFKMUULPSA-N 386.295 5.099 30 20 GKED CC[C@@H](Cc1ccccc1C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 819947840 RFXOEGWHWXZWCC-DOTOQJQBSA-N 381.426 5.185 30 20 GKED Cc1ccc(CO[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 860479066 IPCHZCUQSAKTMA-BBRMVZONSA-N 384.888 5.040 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc(F)ccc3s2)cc1 915086516 KIVNHSJTYWRPBC-FQEVSTJZSA-N 386.451 5.948 30 20 GKED O=C(/C=C/c1ccc(Br)s1)c1sccc1Br 915113932 YLFYOANIICQQBC-HNQUOIGGSA-N 378.110 5.231 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2nc(SC)sc2c1 915310923 FBOUAFRZULEROW-UHFFFAOYSA-N 375.544 5.300 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 916948464 GUZAAIKYDJDIKD-KMANFZQXSA-N 394.437 5.216 30 20 GKED Cc1cc(C=Nn2c(S)nnc2-c2cccs2)c(C)n1C1CCCCC1 917028706 VFCYRGGMBHIIHK-UHFFFAOYSA-N 385.562 5.101 30 20 GKED Cc1ccc(C(=O)/C=C/c2c(C)nn(-c3ccc(Br)cc3)c2C)o1 917144061 XSRFSAZXGVQCEH-MDZDMXLPSA-N 385.261 5.049 30 20 GKED CC(C)Sc1cc(Br)ccc1C=NNc1ccc(C(=O)O)cc1 1776013364 UHJILAIGHWZHJP-UHFFFAOYSA-N 393.306 5.094 30 20 GKED O=C(O)c1cccc(NN=Cc2cccc(OCc3ccccc3Cl)c2)c1 1776036776 MQRMMVGICFJVIK-UHFFFAOYSA-N 380.831 5.063 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(OCc3ccc(Cl)cc3)c2)ccc1F 1776064335 IZLZLUCMMNMMPP-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc2ccccc2c1OC(F)F 1776087847 ABSBDWAVTFJOQJ-UHFFFAOYSA-N 384.382 5.284 30 20 GKED Cc1ccc(C(=O)/C=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c(C)c1 1776133409 WGZVMSZBSURWBT-ZOBSEURRSA-N 386.447 5.404 30 20 GKED C=CCOc1ccc(/C=C/c2nc3c(s2)CCC[C@@H]3C(=O)O)cc1Cl 1776184142 KSBKTSZKHDICHO-XOVSCCBYSA-N 375.877 5.036 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NC/C(C)=C\c1ccccc1OC(F)F 1776782364 LJDSEHMHJUIVSA-ZUTYSQTGSA-N 383.479 5.485 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cscc3C)CCC2)cc1 1791248202 VERBNKNAOCJJDO-OAHLLOKOSA-N 382.529 5.016 30 20 GKED N#Cc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 41538029 GXPXYUNQIJGPGL-OAHLLOKOSA-N 398.274 5.479 30 20 GKED Cc1ccccc1N(C(=O)CCc1ccc(C#N)cc1)c1nc2ccccc2s1 53677731 QQTIVIZCEWDKJW-UHFFFAOYSA-N 397.503 5.774 30 20 GKED CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 54195146 UORHKFVRWZODPR-QGZVFWFLSA-N 397.478 5.006 30 20 GKED CCN(Cc1ccncc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 56800243 QJVDVRLJSLKOOS-UHFFFAOYSA-N 386.455 5.108 30 20 GKED N#Cc1c(NC(=O)c2ccc(Oc3cccnc3)cc2)sc2c1CCCCC2 63262999 DRAFWBVMCSHVDE-UHFFFAOYSA-N 389.480 5.328 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Br)cc1 66801818 IYVJTOHYDMJDSX-ZDUSSCGKSA-N 389.318 5.025 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2cccc(Cl)c2)cc1 67817177 QWBPAJYTIMXTDU-UHFFFAOYSA-N 390.870 5.166 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccccc2C)cs1)c1ccc(F)cc1F 70794617 QISXPCSHOLEZRB-CSKARUKUSA-N 398.434 5.310 30 20 GKED Cc1ccc(-c2csc3nc(SCCC(C)(C)C#N)n(C)c(=O)c23)cc1C 97599279 JLFNNRWALFXIRX-UHFFFAOYSA-N 397.569 5.311 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)cc1 108314160 KRPGEMDEOOAKMF-GHXNOFRVSA-N 376.843 5.171 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)CCC1 128231870 YATSKEBNEADPIY-UHFFFAOYSA-N 380.444 5.040 30 20 GKED C=C(C)COc1cc(CNc2ccc(NC(=O)c3ccco3)cc2)ccc1OC 155869898 UYLBWQBMUOEFTM-UHFFFAOYSA-N 392.455 5.108 30 20 GKED COc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 175120163 PQFQOGMQZCJZEO-WBMJQRKESA-N 384.888 5.328 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)CNc1ccccc1S[C@H](C)CC#N 178391501 CDAQMCJPASRQFE-QAPCUYQASA-N 399.585 5.090 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)c1 180526779 RAZDQIKCGSVRBO-UHFFFAOYSA-N 379.419 5.158 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(-c3ccccc3)o2)ccc1OC 180810006 KCCIOAGQJXUAOJ-FXAWDEMLSA-N 390.483 5.487 30 20 GKED N#C[C@H](C(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2o1 255050139 YRIJDDZVGIAKEE-OZYJXZHSSA-N 390.748 5.303 30 20 GKED CCCc1ccc(C(=O)/C(=C(\S)NC2CCCCC2)[n+]2ccc(C)cc2)cc1 280500176 CPHIFLCXMQOJHO-UHFFFAOYSA-O 395.592 5.096 30 20 GKED CCOc1cc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)ccc1O 303203300 OVFIVAYNQMTCMO-PKNBQFBNSA-N 383.444 5.258 30 20 GKED C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 303228726 XTVFVNDRKWDKHW-KRWDZBQOSA-N 399.494 5.284 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)on1 303418495 XNFSUOQXASOHNC-ZDUSSCGKSA-N 397.887 5.499 30 20 GKED Cc1sc(C/N=C(/O)[C@@H]2CCC(=O)[C@H](C)C2)nc1-c1ccc(Cl)cc1 328923888 NHZAVBIWUVVZOK-BXUZGUMPSA-N 376.909 5.234 30 20 GKED Cc1cc(N=C(O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c2ncccc2c1 329383007 OSSCZCSHSOXOTL-GOSISDBHSA-N 393.491 5.212 30 20 GKED C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1ccccc1Cl 329776500 JZALTMAHZRUFLD-MGPUTAFESA-N 384.907 5.000 30 20 GKED OC(=Nc1ccc(OC2CCCC2)c(Cl)c1)N1CCCC2(CCOCC2)C1 330188212 LACDOJRBULGPOL-UHFFFAOYSA-N 392.927 5.100 30 20 GKED Cc1cccc(-c2cncc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c2)c1 426613522 TYBNQNPTLNCXAW-QGZVFWFLSA-N 387.508 5.561 30 20 GKED Cc1cc(N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)ccc1-c1ccncc1 427834514 SNNSVLRPTJKGCS-OAHLLOKOSA-N 390.874 5.021 30 20 GKED CC(C)(C(=O)Nc1ccc(CC#N)cc1)c1csc(-c2c(F)cccc2F)n1 429919270 DZRSELMYWHSIDV-UHFFFAOYSA-N 397.450 5.071 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc2nc(C3CC3)oc2c1 431154666 ZYIGJRYVZJYQDH-AZUAARDMSA-N 386.455 5.009 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431931051 MBDWECSXBNUELD-GCJKJVERSA-N 395.572 5.982 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccc(F)cc2)C1 432095268 PUTCNCDUSXIJFA-RDJZCZTQSA-N 383.492 5.099 30 20 GKED CC1(C)CN(C(=O)Nc2ccccc2C#Cc2ccccc2)[C@H]1c1ccncc1 433003768 AXZVEIDFOZFBDP-QHCPKHFHSA-N 381.479 5.096 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc(Cl)ccc1F 434149462 ZPJUQKDFYXTXAX-ZDUSSCGKSA-N 391.899 5.537 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 436345278 YLMIHADMPSWCOH-QANKJYHBSA-N 385.920 5.412 30 20 GKED C[C@H](NCC1CCC(C#N)CC1)c1ccc(Br)cc1C(F)(F)F 442858261 RMSUIALEKDEALF-HIFPTAJRSA-N 389.259 5.448 30 20 GKED Cc1csc([C@@H](NCCC(C#N)(c2ccccc2)c2ccccc2)C2CC2)n1 444688415 JOTSOSRNTMIEQM-QFIPXVFZSA-N 387.552 5.392 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 465593550 GJZCLGYDLKCKTA-TZYHBYERSA-N 391.515 5.016 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H](c3ccccc3)C3CCCC3)ccc21 469347437 IFSBLHKUNOMIBP-RUZDIDTESA-N 387.527 5.613 30 20 GKED COc1ccc(-c2nnc(CNc3cccc(Oc4ccc(C#N)cc4)c3)o2)cc1 471667686 LEINIHWHUXVCFE-UHFFFAOYSA-N 398.422 5.021 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(Cc2cccc(C)c2)CC1 475554280 HVWBSWTYQCKAQZ-UHFFFAOYSA-N 391.559 5.197 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 475972037 YHYOKFSLCIBBKD-UHFFFAOYSA-N 395.384 5.306 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)s2)cc1 493732519 AKRFVRWOOCREQS-RBUKOAKNSA-N 393.899 5.001 30 20 GKED COc1ccc2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1 496356906 MLDDWRYBBORJTB-QGZVFWFLSA-N 391.377 5.083 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1c(Cl)cccc1Cl 499811090 KAFCCUWNBZSGGC-HNNXBMFYSA-N 389.213 5.387 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 503113212 ANSFCPQPRUIZMQ-UHFFFAOYSA-N 395.356 5.238 30 20 GKED COc1cccc(C2(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)CC2)c1 506745952 AKHYDLSFWIZPIU-UHFFFAOYSA-N 384.435 5.029 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 511992883 DQVPRQAFQPYROV-MEDUHNTESA-N 391.324 5.159 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)c1 514561815 JUYXOOXFDTUAMI-HSZRJFAPSA-N 386.520 5.212 30 20 GKED N#C[C@@H](NC(=O)Cc1csc2ccccc12)c1cccc(Cl)c1Cl 517494430 ZWYPSJPWTAOJGE-OAHLLOKOSA-N 375.280 5.132 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c1C#N 518361533 LKQFFIPABWEBEK-GJZGRUSLSA-N 378.419 5.252 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)cc1 520855232 FMHWJTXNHJMGDT-PBHICJAKSA-N 387.936 5.865 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 521260290 AZWFGEQSSUKVNC-AEFFLSMTSA-N 381.545 5.780 30 20 GKED CC(C)CCOc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 521796893 IJZLUELSPIINRC-QGZVFWFLSA-N 382.529 5.758 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@@H]1CCC[C@@H](C)C1 522150964 ILHPDYWSFXIZEI-OXQOHEQNSA-N 378.472 5.193 30 20 GKED N#CC1(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)CCCCC1 522889352 GJNXQNXXEDALMP-UHFFFAOYSA-N 386.826 5.530 30 20 GKED CCCC(=O)Nc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1C 535852381 WCFBFXIAGJGCGY-UHFFFAOYSA-N 375.516 5.550 30 20 GKED Cn1c(CNCc2ccc(-c3ccccc3C#N)cc2)nc2cc(Cl)ccc21 538003102 VADOEOAEASZPFU-UHFFFAOYSA-N 386.886 5.055 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(COCc3ccco3)c2)CC1 538822978 ABHCSMZWUINHLP-UHFFFAOYSA-N 386.495 5.812 30 20 GKED C[C@@H](NCc1noc(C2CCCCC2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541085189 MYURKUXPQOSOGL-QGZVFWFLSA-N 386.499 5.507 30 20 GKED Cc1c(Cl)cnc(N[C@H](C)c2ccc(OCc3cccnc3)cc2)c1C#N 543205701 GCLQYEOMYAIXBX-OAHLLOKOSA-N 378.863 5.062 30 20 GKED CN(c1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)C1CCCC1 544266106 VTNGWAGZJVZQBB-UHFFFAOYSA-N 388.515 5.134 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)nc4ccccc34)n2)cc1 546155794 XIRHESMMJSESNL-IBGZPJMESA-N 383.476 5.465 30 20 GKED C=CCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccc(Cl)s1 551414978 FDEAXDGVLYEVRM-UHFFFAOYSA-N 389.864 5.153 30 20 GKED N#Cc1cccc(C2(NCc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)CC2)c1 556406761 DIXNKJDXFITQRQ-UHFFFAOYSA-N 393.830 5.159 30 20 GKED C=CCn1c(SCC2(C#N)CC2)nc2sc(-c3ccccc3)c(C)c2c1=O 562141138 MORCLJGILWEBKB-UHFFFAOYSA-N 393.537 5.015 30 20 GKED N#CCCC[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccccc1 563693297 NDPWWVWOBQHOFA-SANMLTNESA-N 395.506 5.662 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567203587 WEJNWXXYSAOFLV-MJGOQNOKSA-N 398.466 5.155 30 20 GKED COc1cc(CNCC(C)(C)CCC#N)ccc1OCc1ccc(Cl)cc1 574551725 PULADEAVAXAYMG-UHFFFAOYSA-N 386.923 5.347 30 20 GKED N#CCCCCCC(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 588146889 FTCUSUQGZGHXSO-IBGZPJMESA-N 393.918 5.543 30 20 GKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 596735560 ZZZAGSBGPDOWFB-OXQOHEQNSA-N 393.556 5.924 30 20 GKED COCc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1C(F)(F)F 597043069 KJGRMPKEYZWEAU-GOSISDBHSA-N 391.393 5.018 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC2(CC1)CC2 599743844 VGBSBVVIFBVJFT-UHFFFAOYSA-N 389.499 5.244 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)Cc2ccc(C#N)nc2)c(C(F)(F)F)c1 602249058 JBZVCBDHZAFYKR-LBPRGKRZSA-N 393.434 5.044 30 20 GKED CCc1nc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)sc1C 603907059 RKXGVHMYDOJSHK-UHFFFAOYSA-N 393.537 5.430 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609064669 CLJYRJRNNUIJKG-UHFFFAOYSA-N 395.462 5.108 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609398768 PJKZBGVCZYKSPC-PXNSSMCTSA-N 381.545 5.943 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 609773517 IOVXIIPPLAWQFN-HKUYNNGSSA-N 381.501 5.146 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(c2cccc(Cl)c2)CC1 610095220 JXTKNZQBFRSLOR-HNNXBMFYSA-N 399.947 5.445 30 20 GKED CC1CCN(c2cccc(NC(=O)Nc3cccc(OCCCC#N)c3)c2)CC1 610096602 HVTNTNGAOWUVIV-UHFFFAOYSA-N 392.503 5.249 30 20 GKED CC(C)CCn1c(SCCC(C)(C)C#N)nc2cc(Cl)ccc2c1=O 610165543 IGIADTYLJKNKGZ-UHFFFAOYSA-N 377.941 5.128 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(C#N)c1 610829959 UFKYXSXWQNOEKS-GJZGRUSLSA-N 377.469 5.607 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@H]3c3cccc(F)c3)c2)cc1 611049278 FPWZLZMBCLWLTQ-QFIPXVFZSA-N 387.414 5.469 30 20 GKED N#CCn1c(-c2nc(-c3ccc(Oc4cccnc4)cc3)no2)cc2ccccc21 612917918 PYGAASQFEYCWTL-UHFFFAOYSA-N 393.406 5.069 30 20 GKED CCN(C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1ccc(C#N)c(Cl)c1 617517077 RQZAZFWAEHRMQK-UHFFFAOYSA-N 388.723 5.175 30 20 GKED FC(F)(F)c1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 618452122 QQGIDMHXVWFLTO-VXGBXAGGSA-N 379.266 5.268 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 618759110 UAJFPXNKAHTZLR-HXOBKFHXSA-N 388.515 5.055 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccccc2CCc2ccccc2)cc1 626581595 XFKSLHBPNUHVLE-UHFFFAOYSA-N 399.494 5.032 30 20 GKED N#C[C@@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1nc2ccccc2o1 642281489 KOXNGNZUHFTPQU-VIFPVBQESA-N 387.247 5.839 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(Oc2ccccc2)cc1 725853383 PUBALQXUDNVQHR-HXUWFJFHSA-N 385.511 5.680 30 20 GKED CC(C)CN(C(=S)NCc1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 726485155 VKDGMFTZKSKOHS-UHFFFAOYSA-N 391.462 5.114 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(F)c3)cc2C)c1 727980985 YDDIMGOEEQJGLQ-UHFFFAOYSA-N 390.483 5.503 30 20 GKED CSc1ccc(C(=O)/C=C\c2csc(-c3ccc4c(c3)OCO4)n2)cc1 728438937 CQDSWLGLHGCGHM-YVMONPNESA-N 381.478 5.157 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1C 730416076 AAUISCBMCGRKDT-MRXNPFEDSA-N 384.501 5.411 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C/c3ccccc3C#N)s2)cc1 730761101 GUPLJSJGWRMURE-DBTPVHCXSA-N 387.508 5.189 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CCc2nc(-c3ccccc3F)sc21 731938007 NWVZSHVJGQPKHP-JLHYYAGUSA-N 380.400 5.070 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 741641526 YCUWHBDUNUSEQF-UHFFFAOYSA-N 379.818 5.410 30 20 GKED N#CCOc1cccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)c1 741841370 GCNKVLUEMDRDHS-RUDMXATFSA-N 377.387 5.139 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SCC(F)F)cc2)ccc1SC 741842399 LDNOKDCSAGKEJQ-YCRREMRBSA-N 380.481 5.670 30 20 GKED Cc1cc(C(=O)Nc2ccccc2CC(F)(F)F)c(C)n1-c1ccc(C#N)cc1 742114870 IBXZCLAHLMEUHU-UHFFFAOYSA-N 397.400 5.323 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(N2CCCCC2)cc1 743057130 QETCVLHOWWKJRH-MLPAPPSSSA-N 385.467 5.155 30 20 GKED CC(=NO[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1)c1cc2ccccc2o1 744444177 SCMBIADYLITZPK-CQSZACIVSA-N 379.391 5.432 30 20 GKED Cc1cc(C(=O)NC2(c3cccc(C#N)c3)CC2)c(C)n1[C@@H](C)c1ccccc1 749016111 SEBSCKGRHIHTKZ-SFHVURJKSA-N 383.495 5.005 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1F 752475949 HJNMFKKTQOQRTH-CXAGYDPISA-N 382.435 5.458 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1F 752475956 HJNMFKKTQOQRTH-SUMWQHHRSA-N 382.435 5.458 30 20 GKED C=CC[C@H](NC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@@H]1C)c1ccncc1 756041611 YIVUSGAIGANYHK-DJJJIMSYSA-N 390.314 5.335 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 758447268 RZSDQTNMECQZTR-OAHLLOKOSA-N 398.963 5.708 30 20 GKED O=C(/C=C\c1ccc(SC(F)F)cc1)c1cc(Br)ncc1F 762424202 QAARDIKHYCIUQO-UTCJRWHESA-N 388.208 5.194 30 20 GKED COc1ccc2[nH]c3c(c2c1)C(=O)/C(=C\c1cccc(OCCCC#N)c1)CC3 765612792 FPKHKRHBVZINNY-LGMDPLHJSA-N 386.451 5.072 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc2[nH]ccc2c1)c1nc2cc(Cl)ccc2s1 765917159 ZARJKBQGRQPSSW-FIMWJMCYSA-N 377.856 5.321 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CN(Cc2ccccc2)c2ccccc2)n1 772678685 ROSOVJYFVXRKKT-HXUWFJFHSA-N 389.524 5.150 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3cccc(O[C@H](C#N)CC)c3)oc12 776163380 AGFHCWQFDBABSY-APWZRJJASA-N 378.472 5.363 30 20 GKED Cc1ccc(-c2cc(C(=O)N3CCC(CC#N)CC3)c3ccccc3n2)c(C)c1 782056932 WGWJJMZQAMFPGQ-UHFFFAOYSA-N 383.495 5.285 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@H](F)C(F)(F)F)c(C(F)(F)F)c1 788126217 GRDNAFLBYNXGNZ-HQJQHLMTSA-N 377.325 5.435 30 20 GKED N#CCCn1cc(C=NNc2cc(Cl)cc(Cl)c2)c(-c2ccccc2)n1 790210946 JEOOEYVUVHWRJV-UHFFFAOYSA-N 384.270 5.217 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)cn1 792867670 WTINCRRLFBVYTB-NTEUORMPSA-N 399.494 5.039 30 20 GKED FC(F)(F)c1cccc(-c2ccc(NN=C3CCC4(CCCO4)CC3)nn2)c1 794980911 HUIVLWPDEGXLID-UHFFFAOYSA-N 390.409 5.054 30 20 GKED C#CC[C@H](Cc1ccccc1)NC(=O)N(Cc1cccs1)Cc1cccs1 805785860 KALCNPYKPKYVLV-LJQANCHMSA-N 394.565 5.156 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813217028 ATEWDRPRPZAHGS-GUYCJALGSA-N 390.405 5.042 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3ccccc3Cl)c2)cc1 916135246 NZLBHZWJYBPXBA-NTEUORMPSA-N 391.854 5.497 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 916392077 CQFZCWSLNZPGMB-XMMPIXPASA-N 399.494 5.453 30 20 GKED N#C[C@@H](C(=O)Cc1cc2ccccc2o1)c1nc(-c2ccc(Cl)cc2)cs1 920110986 PSZAQXZZBJEISG-KRWDZBQOSA-N 392.867 5.629 30 20 GKED N#Cc1ccc(OC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)cc1 921145959 XQVGVZVONWTNJE-UHFFFAOYSA-N 375.236 5.208 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(OC(C)C)c(Cl)c1 1776033896 VLOSAMUHDAFVFV-UHFFFAOYSA-N 381.259 5.315 30 20 GKED CC(C)COc1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776335083 GWOFRXLVUIZYGV-IZZDOVSWSA-N 390.435 5.576 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)c(OCC)c(OC)c1 1776782795 BMABMQMFDWDXIV-INIZCTEOSA-N 385.932 5.041 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3cc(C)c(C)cc3o2)c2cc(C(=O)O)oc12 1777360713 CDMYNXRDWFFCFX-XQRVVYSFSA-N 390.391 5.399 30 20 GKED C=CCn1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 7442055 UKNXDNBIUQULQW-LJQANCHMSA-N 394.931 5.320 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nc2ccccc2n1C(F)F 41558846 ZUPNCXXZQWJBLM-GOSISDBHSA-N 387.389 5.588 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CSCCOc1cccc(C#N)c1 56263016 IQWZNMKVXKVTAC-UHFFFAOYSA-N 396.556 5.556 30 20 GKED CC(C)[C@@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 66861007 ZCVIOEKTMUDETR-VGOFRKELSA-N 381.545 5.006 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 91707848 HGBJWPKRADAIEB-QZTJIDSGSA-N 393.384 5.163 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1sccc1Br 108240728 RECUTFGTLPCOIR-SNVBAGLBSA-N 381.320 5.015 30 20 GKED C=CCN(C(=O)C[C@@H](C)OC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 109882845 STWNMJDIHKMVEG-LLVKDONJSA-N 385.316 5.061 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)oc2ccc(Cl)cc12 114619199 SOQKZVMLPLSJOU-HNNXBMFYSA-N 393.855 5.403 30 20 GKED CC[C@@H](N/C(S)=C(/C(=O)c1ccccc1)[n+]1ccc(C)cc1)c1cccs1 115511080 RQYOPYYHAALFTH-GOSISDBHSA-O 395.573 5.024 30 20 GKED CCc1ncsc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 131908425 LMECNPIXQJVGDJ-UHFFFAOYSA-N 379.510 5.122 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1nc(C)cs1 152932450 GVNZHRDFHTUBQG-UHFFFAOYSA-N 397.887 5.436 30 20 GKED Cc1cc(C(=O)N[C@@H](CCC#N)c2ccccc2)ccc1NC(=O)OC(C)(C)C 153231332 IICPMMHLTPFBJU-FQEVSTJZSA-N 393.487 5.117 30 20 GKED Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 170991746 LYQDXENKLXYXMH-UKRRQHHQSA-N 387.936 5.339 30 20 GKED CCCOc1ccc(CCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 173999816 MFXHRKDIRKGODR-QGZVFWFLSA-N 397.425 5.029 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)Cc1ccccc1-c1ccccc1 184333594 DACHWLWMCZHWLR-GOSISDBHSA-N 385.467 5.308 30 20 GKED C=CCn1c(SCc2ccc(C(F)F)cc2)nnc1-c1ccccc1OC 185735922 RIVWPFZUPPARCK-UHFFFAOYSA-N 387.455 5.370 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1cc(OC)ccc1OC 189908427 NSGBCIVCPCBLIG-FPOVZHCZSA-N 379.500 5.298 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 237505410 SPJGJBQSQJYBRW-BXKMTCNYSA-N 392.449 5.329 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1ccc(F)c(F)c1 303286628 NJVCXDOIOPGCDM-CQSZACIVSA-N 393.393 5.068 30 20 GKED Cc1cccc(COc2ccc(NC(=O)NCc3cccc(C#N)c3)c(C)c2)c1 303310049 RVXJLMYBDVBAND-UHFFFAOYSA-N 385.467 5.076 30 20 GKED CC(O)=Nc1ccc(NC(O)=Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1 329375871 LBOVRLLXRVZHHC-UHFFFAOYSA-N 381.432 5.384 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 409667999 WAYPSNLTQLIQJS-UONOGXRCSA-N 392.446 5.842 30 20 GKED C[C@@H]1CCc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c2[C@@H]1C 410976019 ALMJHGMAPVYRNA-OKZRHMCRSA-N 382.476 5.042 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c2[C@H](C)C1 411008564 IKSZBABNLGMIRL-VXGBXAGGSA-N 394.525 5.076 30 20 GKED CC1(C)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)[C@H]1c1cccnc1 430105700 VHKBWEIMBCZZRA-DEOSSOPVSA-N 383.495 5.115 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc(Cc3ccc(F)cc3)n2)s1 430618032 QRGCVJCNUBZHSE-AWEZNQCLSA-N 399.516 5.117 30 20 GKED CCc1cccc2c(C3CCN(C(=O)C4(c5cccc(C#N)c5)CC4)CC3)c[nH]c12 435673885 PHWZXJOJVFPMFW-UHFFFAOYSA-N 397.522 5.040 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccc(C(F)(F)F)s2)cc1 437272938 YNZWZGZZACAUFS-UHFFFAOYSA-N 380.435 5.193 30 20 GKED N#Cc1csc(C(=O)N(Cc2ccc(F)cc2)c2nc3ccccc3s2)c1 437554687 GWJSLXPKWPTDSB-UHFFFAOYSA-N 393.468 5.216 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)SCc1ccc(C#N)cc1OC(F)F 439523081 DALAPJCBFNWOMG-CQSZACIVSA-N 390.455 5.037 30 20 GKED COc1ccc(-c2nc(CS[C@H](C)c3cccc(C#N)c3)cs2)c(OC)c1 443158732 WYOMPXZTLNREJA-CQSZACIVSA-N 396.537 5.693 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(C(=O)N[C@@H](C)CC)cc2C)CCCC1(C)C 445241417 WTRCWGUNMDQQHN-FXAWDEMLSA-N 385.552 5.122 30 20 GKED C[C@@H](C(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12)c1cccc(C#N)c1 461775584 LGIRTHWCNLPXRB-SEIJQPCPSA-N 392.502 5.075 30 20 GKED Cc1c(CSC(C)C)cccc1NCC(=O)Nc1cc(Cl)ccc1C#N 462169792 HZEGKOMFMIBSDH-UHFFFAOYSA-N 387.936 5.212 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3ccoc3C(F)(F)F)c2C#N)C1 463146241 NLPNXEAFZKCAAB-SNVBAGLBSA-N 396.434 5.635 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(Oc2ccccn2)c1 464891509 JLDZMHZXVQRYBK-UHFFFAOYSA-N 391.430 5.665 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccncc2Cl)c1 467093622 GTIMIUYPFLTDNU-UHFFFAOYSA-N 382.250 5.107 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(-c3ccccc3C(F)(F)F)o1)CC2 474258126 YUMZGDHPPOYYDR-UHFFFAOYSA-N 382.341 5.040 30 20 GKED Cc1nc(COc2ccccc2C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cs1 474429660 GYJASDJXTGGCLM-INIZCTEOSA-N 397.525 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(Br)s1 475554307 XQUAHEKLSFGVKB-UHFFFAOYSA-N 393.350 5.684 30 20 GKED COc1ccc(-c2csc(CNC(=O)C[C@@H](CC#N)c3ccccc3)c2)cc1 476246992 PQRXMOMHFRUODK-LJQANCHMSA-N 390.508 5.127 30 20 GKED C=CCC1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CCC1 480411006 LFCDXFVPRJMLFD-UHFFFAOYSA-N 381.438 5.069 30 20 GKED COc1cccc(Oc2ccc(CN[C@H]3CCCCc4cc(C#N)ccc43)cn2)c1 481920667 KGPQKVICHYJNPB-DEOSSOPVSA-N 399.494 5.311 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cnc(-c3ccsc3)s2)cc1 485959222 DITRJXBQLXPJSK-MRXNPFEDSA-N 381.526 5.164 30 20 GKED N#Cc1ccc(F)c(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)c1 487339366 ONYKLUGDGFKBQD-XMMPIXPASA-N 399.469 5.287 30 20 GKED FC(F)Oc1ccc(CN[C@@H](c2ccccc2OC(F)F)C(F)(F)F)cc1 491378890 FXIICEMPVCWWQW-AWEZNQCLSA-N 397.290 5.283 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 496633766 ULFJQXMBZDJHRG-UHFFFAOYSA-N 378.453 5.020 30 20 GKED CCCN(CC1CC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510007374 XOFFBLODBITPOZ-FQEVSTJZSA-N 381.907 5.649 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)sc2cc(F)ccc12 513198395 CWPDOBJHDFOVGL-GFCCVEGCSA-N 384.501 5.853 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)CCC(C)(C)c2ccccc2)c1C 513947402 XDJRWKKBHJCNHJ-UHFFFAOYSA-N 386.499 5.057 30 20 GKED CCc1sc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1C 515282515 GWLGTUABKATRNR-UHFFFAOYSA-N 377.469 5.239 30 20 GKED C[C@H](CSc1ccccc1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 518907028 IMMKCFYKQGFQEM-CQSZACIVSA-N 379.510 5.049 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)CNc2ccccc2S[C@H](C)CC#N)cc1 520200678 NKOKZDFYHDNPOD-IAGOWNOFSA-N 381.545 5.645 30 20 GKED CC(C)COc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 520323471 DGBMHFGSWGMJGJ-UHFFFAOYSA-N 387.439 5.033 30 20 GKED CCc1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 520466209 UNPHIFNEYALLIS-MRXNPFEDSA-N 381.888 5.267 30 20 GKED CC(C)(C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1Cl 521218901 CDEYKDGUBZPLMA-UHFFFAOYSA-N 381.888 5.251 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccs1 523101736 YQTQEEYXUSVNEQ-CYBMUJFWSA-N 382.872 5.808 30 20 GKED Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 531499347 AJYIRSNNAHZJSO-UHFFFAOYSA-N 387.395 5.128 30 20 GKED CC[C@H](C)n1c(SCc2ccc(OC)c(C#N)c2)nnc1-c1ccccc1 533331788 GMRFMMGKIFVAKR-HNNXBMFYSA-N 378.501 5.089 30 20 GKED N#Cc1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1F 538322969 IBLBQOSIJBXRTE-HNNXBMFYSA-N 376.275 5.109 30 20 GKED N#CCCCNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 543154331 GDCIIXWZDRRBIV-UHFFFAOYSA-N 384.888 5.412 30 20 GKED COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 544236247 FZTNSXSNKMEEKG-KKSFZXQISA-N 377.488 5.111 30 20 GKED N#CCCN(C(=O)c1csc(-c2ccc(Cl)s2)n1)c1ccc(F)cc1 554167499 GZEMDKUNVULZJC-UHFFFAOYSA-N 391.880 5.225 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1N[C@H](C)c1ccccc1 554679627 UHKNGIXQVOIJCJ-QZTJIDSGSA-N 385.467 5.137 30 20 GKED C[C@H](NC(=O)C1CCC(OC(F)F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 560623650 XVNZBUONBJZDQO-ULUNDTCASA-N 398.453 5.200 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2ccccc2SCc2cccs2)cc1 565799702 RLGVXYKTCHCGIS-HXUWFJFHSA-N 392.549 5.597 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C(C)C)cc1 583398241 IHHKAQHKXIRAEG-IERDGZPVSA-N 397.544 5.608 30 20 GKED C=CCN(C(=O)CCOCC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 590451477 VMXLCUDYJQJZFI-UHFFFAOYSA-N 392.524 5.423 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CCC[C@@H](CC#N)C1 596707515 MYYNIKIHDDPZHQ-INIZCTEOSA-N 397.450 5.093 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccc(Cl)c(C#N)c3)c2C(C)C)cc1 603567497 JTJATIDHEVAXCU-UHFFFAOYSA-N 378.863 5.082 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)c2C)cc1 603968550 APXYKYURJKAVFH-UHFFFAOYSA-N 398.491 5.342 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCCC1CCCC1 609079377 ZWOKLGGRGVALPK-UHFFFAOYSA-N 377.488 5.148 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 609652444 ZDZNNMQFBKCAKC-QZTJIDSGSA-N 386.451 5.104 30 20 GKED N#Cc1nnc2ccccc2c1NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 610128253 LIGXPNMXJIDFCM-FQEVSTJZSA-N 389.462 5.227 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3C=CC[C@H]2CC3)cc1Cl 611048113 JVTVDGFIHIOGHC-BJLQDIEVSA-N 377.875 5.320 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)c1cc2ccccc2n1CC#N 612503496 OHSMJJSBLGFSJR-UHFFFAOYSA-N 375.472 5.122 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1N1CCCCCC1 615491961 BYPDURPJVHQDRY-UHFFFAOYSA-N 381.495 5.426 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(F)cc1C(F)(F)F 622292690 GYRGGFWXWHLBLK-UHFFFAOYSA-N 379.275 5.136 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)CCCC1 661848435 DZHUCEHNZANGPS-UHFFFAOYSA-N 397.588 5.731 30 20 GKED COc1ccccc1/C(C)=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727304361 ALLUTJLKBHRCRS-BZNBOCDVSA-N 382.463 5.393 30 20 GKED C#CCOc1ccc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 731112343 IFOFOZWZMCCQSU-ZDUSSCGKSA-N 377.271 5.230 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 732735066 SBPKTRHIRBUATP-VQHVLOKHSA-N 395.871 5.421 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)CC(c2ccccc2)c2ccccc2)c1 733773293 YHDFHCSKBSDOAJ-HSZRJFAPSA-N 398.506 5.206 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCOC2CCCCCC2)cc1 735742647 IIDJRDWVQMTLNV-HSZRJFAPSA-N 391.515 5.203 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2OCc2cccc(Cl)c2)cc1 737011651 YBLPQSSWMRSSQE-UHFFFAOYSA-N 391.858 5.112 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 741523357 YNHWHPWWBOCTKP-LLVKDONJSA-N 397.780 5.338 30 20 GKED Cc1cccc(O[C@@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 743093049 KVYRDPXMFXRTQM-CYFREDJKSA-N 399.494 5.240 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C(=C\c2ccc(F)cc2)c2cccs2)n1 747196795 BKBQATAEQHZLKU-RNIVLKNTSA-N 396.512 5.884 30 20 GKED FC(F)Oc1ccccc1C=NOCc1csc(CCc2ccccc2)n1 753169215 CAIOQQOHKCFCEC-UHFFFAOYSA-N 388.439 5.080 30 20 GKED CCCCN(Cc1ccccc1Cl)C(=O)Nc1ccc(F)cc1OCC#N 761668171 IMXMWYJABQTWDE-UHFFFAOYSA-N 389.858 5.216 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C1CC1 766401552 ZSHYKWNQHWRQQU-HSZRJFAPSA-N 382.463 5.480 30 20 GKED C[C@H](OC(=O)CSCc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1 767983164 KOUBFDVOUPEGIV-HNNXBMFYSA-N 394.521 5.219 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)cc2Br)c1 772985237 UQBQQNZGGHYFAX-CZUORRHYSA-N 391.284 5.120 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nc(COc2ccccc2)cs1 776743609 OAPYEZGDWCHZIZ-UHFFFAOYSA-N 382.510 5.253 30 20 GKED COc1cccc(O)c1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 779596561 XPWLWFUCYDVQOL-UHFFFAOYSA-N 394.858 5.117 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 780486682 ZJFPCDQIOGRYKH-DYESRHJHSA-N 396.450 5.277 30 20 GKED O=C(/C=C\c1cccc2cnccc12)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 782889172 DRUXOGALGAOCND-XOYLTFLUSA-N 391.442 5.218 30 20 GKED N#C[C@@H](C(=O)c1cc2cccc(Cl)c2o1)c1nc(-c2ccccc2)cs1 783070114 SNWNEKKYKCNZFF-AWEZNQCLSA-N 378.840 5.700 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Cl)nc1C(F)(F)F 786764314 AXVZYIBZJNQNPG-NSHDSACASA-N 385.842 5.760 30 20 GKED Cc1ncsc1/C=C/C(=O)c1ccc(Br)cc1C(F)(F)F 790234024 YEZRUVZRCUBKLQ-SNAWJCMRSA-N 376.197 5.129 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccc(C)cc3Cl)n2)cc1 790769440 SVFIXMNXKZIGOE-QGZVFWFLSA-N 396.899 5.200 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)[C@H](C#N)Cc1ccc(C#N)cc1 791562670 VBBPTADMYBGEAT-NRFANRHFSA-N 399.881 5.508 30 20 GKED N#Cc1ccc(COC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)c(F)c1 795143706 WQIHWPBQZGVGRF-ZDLGFXPLSA-N 381.403 5.182 30 20 GKED CC(C)C[C@H](NC(=O)OC(C)(C)C)c1noc(-c2ccc(C(C)(C)C#N)cc2)n1 795713852 DRLZRGNYPQHFIB-KRWDZBQOSA-N 398.507 5.150 30 20 GKED CC(C)c1ocnc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 843642470 WSOZOZRKMZESFI-UHFFFAOYSA-N 398.278 5.340 30 20 GKED Cc1ccc([C@@H]2C[C@H]2C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 850790413 LOIJQDMWJKQNLD-HBMCJLEFSA-N 397.503 5.279 30 20 GKED CCC(=O)Nc1ccc(Cl)c(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)c1 858710844 VJHJBZNSLRCXBJ-UHFFFAOYSA-N 395.890 5.011 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cccc(F)c1Br 864005595 CKISYHZOTHMSDJ-GFCCVEGCSA-N 379.298 5.452 30 20 GKED C=C(C)COc1cc(CNc2cccc3oc(C(F)(F)F)nc23)ccc1OC 864009433 UEZLHZRJGYMWAG-UHFFFAOYSA-N 392.377 5.422 30 20 GKED FC(F)Oc1ccccc1C=NOCc1cc(-c2ccc(Cl)cc2)no1 913029611 DBCIPRRJOMYBJA-UHFFFAOYSA-N 378.762 5.147 30 20 GKED N#Cc1ccccc1NC(=S)NC[C@@H]1CC2c3ccccc3C1c1ccccc12 915996999 FXPAXBSATQWGTJ-QBHLMBNYSA-N 395.531 5.142 30 20 GKED C[C@@]12CC3CC(C(=O)[C@@H](C#N)c4nc5ccccc5n4C(F)F)(C1)C[C@](C)(C3)C2 917041473 SSTCBEWBSULUSM-BIJPVBECSA-N 397.469 5.604 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)s1 1776339942 RXNRKZAAJNIDEJ-JXMROGBWSA-N 396.533 6.269 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(-c2ccccc2)nn(C)c1Cl 1776783305 OFVBOHASUUMCQA-KRWDZBQOSA-N 391.943 5.034 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776950885 FHVUMBBTFWZXQP-BENRWUELSA-N 394.517 6.121 30 20 GKED Cc1ccsc1C(=O)/C=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1777477295 YXLWBZPBEHTJHC-CFGKVWFZSA-N 378.449 5.157 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 1777684964 PSHAJPPPJNCFOH-PLNGDYQASA-N 388.263 5.319 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)c(C)c1)=C(/S)NC1CCCCC1 27462195 XOMZZQOMFZRDPU-UHFFFAOYSA-O 395.592 5.014 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C)C(=O)N(C)c1ccccc1 63641526 QVKGGHYBNVMKSD-SFHVURJKSA-N 385.467 5.122 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCOc2ccccc21 102852670 PDHYWQGQVOXPME-OAQYLSRUSA-N 384.435 5.164 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1cn(C)c2ccccc12 151005727 XECMDNQZCBGNKK-MRXNPFEDSA-N 377.513 5.144 30 20 GKED CC[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1c(C)noc1C 160591809 DDCSBCRKKFXUTK-SFHVURJKSA-N 391.496 5.195 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 180055335 TVVXONQCKGUBOD-IERDGZPVSA-N 388.471 5.218 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c(F)c2)cc1 182073509 UXNHVNJGPQGXQX-HNNXBMFYSA-N 390.414 5.044 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 183076075 JPTYHUOVVLQUGI-UHFFFAOYSA-N 395.462 5.055 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCN(C(=O)c2ccccc2)C1 189883201 RRPBPXNXQKBWKW-OAQYLSRUSA-N 390.527 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(SC)c(OC)c1 191427246 SUJUFDJJIKJZJH-UHFFFAOYSA-N 398.572 5.933 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1 303577764 CYPUUZZFXWMBGG-UHFFFAOYSA-N 395.462 5.191 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc(F)c(F)c(F)c2)cc1 303893543 PTHRDPZKBURNKR-UHFFFAOYSA-N 398.409 5.520 30 20 GKED Cc1csc([C@H](C)C/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)n1 329806817 BGZGILHQKOYMFN-RHSMWYFYSA-N 386.565 5.018 30 20 GKED C[C@@H](CC(F)F)C(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 415425870 DBPBAVPZALNIES-QPUJVOFHSA-N 377.275 5.059 30 20 GKED Cc1ccoc1CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 432682943 VZJLYZCGCMQEAZ-IBGZPJMESA-N 393.874 5.561 30 20 GKED C=CCOc1ccccc1CN[C@@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1 433406054 LMIYZZBUNUZQBA-GHTZIAJQSA-N 399.506 5.189 30 20 GKED CCCN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@H](C)c1ccccc1OC 438848098 ALIOGJIRRNMTRO-WIYYLYMNSA-N 379.504 5.223 30 20 GKED COc1cc(CNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)ccc1C#N 440639942 RDCFTPZNCPCHBG-UHFFFAOYSA-N 380.797 5.018 30 20 GKED N#CCCCn1cc(C(=O)Nc2cnccc2Oc2ccccc2)c2ccccc21 444138266 GXYVWUFJYGXBFP-UHFFFAOYSA-N 396.450 5.385 30 20 GKED CC(C)c1ccc(-c2noc(/C=C\c3cn(CCC#N)c4ccccc34)n2)cn1 445519843 QQJYPNYGABZGDU-LUAWRHEFSA-N 383.455 5.294 30 20 GKED COc1ccc(N(CC2CC2)C(=O)c2cn(CCCC#N)c3ccccc23)cc1 456186901 YVJRFZSWVUXYIG-UHFFFAOYSA-N 387.483 5.010 30 20 GKED C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798741 IKSOBGNVCYRSEI-UTKZUKDTSA-N 383.923 5.348 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1 465970151 SPRROWHVVKWJCK-FQEVSTJZSA-N 383.923 5.531 30 20 GKED C=CC[C@H](CC)NC(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 466366882 MPUCHSUDDGVUJM-SFHVURJKSA-N 391.437 5.167 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)CC(F)(F)F 467155598 QVCOWUALZKJOQK-ZDUSSCGKSA-N 377.366 5.121 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c(Cl)c1 474401088 AWXBWVZZJBIROJ-UHFFFAOYSA-N 390.870 5.918 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-n2ncc3ccccc32)cc1)c1ccccc1 476594817 BHKDFQMFMJJOKN-LJQANCHMSA-N 380.451 5.052 30 20 GKED CC[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(CC#N)c1 478255181 SLMFDGWLZDMOOO-QFIPXVFZSA-N 387.527 5.115 30 20 GKED C[C@@H](N[C@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccc(C#N)cc1 479251162 JHAWRQKYKNQGTG-VXGBXAGGSA-N 397.238 5.751 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)nn1-c1ccccc1 483215779 RXXOGROKLIRJDY-HXUWFJFHSA-N 380.451 5.034 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 485246543 PWKUBYOWEUWCNE-UWJYYQICSA-N 381.545 5.908 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccsc3)s2)sc2c1CCCCC2 486994573 GLFTZAXFWFAWMO-UHFFFAOYSA-N 385.539 5.326 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc(C)c1F 490717942 GZISSMUYNACKND-ZDUSSCGKSA-N 386.398 5.334 30 20 GKED COCc1ccsc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 498243446 FJOUBFDKHPXUEC-CYBMUJFWSA-N 388.558 5.231 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 499864885 UKAXTZGMRCDTKV-PXAZEXFGSA-N 380.797 5.233 30 20 GKED Cc1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)s1 507578713 QTHIRCQDLGLDBP-QGZVFWFLSA-N 381.888 5.321 30 20 GKED N#CCCCCNC(=O)Nc1cc(Cl)ccc1Sc1ccc(F)cc1 510050352 QHRFSAVSPSYVLL-UHFFFAOYSA-N 377.872 5.446 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1C1CCCCC1 511029737 QDRPPEHCXPZDND-HNNXBMFYSA-N 382.533 5.201 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)n(Cc2ccccn2)c1C 512679443 ZFTPFQFICWMJLC-UHFFFAOYSA-N 399.947 5.092 30 20 GKED N#CC1CCN(Cc2cn(Cc3ccccc3)nc2-c2cc3ccccc3o2)CC1 512694346 UXRUCWGQZHFPQU-UHFFFAOYSA-N 396.494 5.080 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc(-c2ncco2)c1 513960185 BPDRJEJQVIJGEN-UHFFFAOYSA-N 388.345 5.178 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2)cc1 520610514 BWEJRNXGMSXHFL-UHFFFAOYSA-N 399.362 5.257 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2c(F)cccc2F)c1 521104511 XEEQSBIVYJBJDE-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C=CCc1ccc(OCc2nnc(-c3c(Cl)cccc3Cl)o2)c(OC)c1 522620043 OJDYHYVSBQKDPF-UHFFFAOYSA-N 391.254 5.360 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 523610784 OCEHGIFYYZEMSY-UHFFFAOYSA-N 397.478 5.560 30 20 GKED CC[C@@H](C)N(CC(=O)Nc1ccccc1SC[C@H](C)C#N)Cc1ccccc1 532909357 LLPWEOZOVCUXKZ-RTBURBONSA-N 395.572 5.178 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)nn1C1CCCCC1 540642069 VOCANPKCYDYBEL-MRXNPFEDSA-N 382.533 5.343 30 20 GKED Cc1cc2ncc([C@@H](C)N[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)c(C)n2n1 542106335 KQPQTSUBZIZFOO-ZWKOTPCHSA-N 395.510 5.297 30 20 GKED CC(=O)Nc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542923153 APAYQQIVDYWAAJ-INIZCTEOSA-N 398.466 5.066 30 20 GKED C[C@@H](N[C@H](C)c1cn(-c2ccccc2)nn1)c1ccc(-c2cccc(C#N)c2)cc1 542934936 XSTKXAPIKUYUDX-RTBURBONSA-N 393.494 5.218 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 543513303 SUGMFLJOUGRXDS-UUOWRZLLSA-N 397.478 5.163 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)N1CCC[C@@H]1c1cccs1 543960163 XPCLUPIOQXEROC-SWLSCSKDSA-N 376.934 5.117 30 20 GKED N#C[C@@H](C(=O)c1cncc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 543986626 AGFKXEQYVPWART-AWEZNQCLSA-N 391.402 5.127 30 20 GKED N#C[C@@H]1N(C(=O)c2cc3sc4ccccc4c3s2)CCC[C@@]12CCCCO2 548399955 FJWCLNSQTBREMP-RXVVDRJESA-N 396.537 5.183 30 20 GKED CO[C@@H]1CCCC[C@H]1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 549779115 TWUVQCFLZBYPHL-SFHLNBCPSA-N 382.891 5.139 30 20 GKED N#CCCC1CCN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)CC1 563190058 MBFRABGEOGKYNT-UHFFFAOYSA-N 385.467 5.165 30 20 GKED CC(C)(C)OC(=O)NCc1cccc(-c2nc(-c3ccc(C#N)cc3)cs2)c1 587921695 SHNHVQMGBNAUPK-UHFFFAOYSA-N 391.496 5.373 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)CC1(C#N)CC1 590277797 VMVYRPFBFGASSG-UHFFFAOYSA-N 390.462 5.364 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NC(CCC(F)(F)F)CCC(F)(F)F 596495824 WVKOIFLLZXWKCU-UHFFFAOYSA-N 393.253 5.438 30 20 GKED N#CC1(CC(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CCOCC1 597332326 DHWZKCPFCWRVHD-UHFFFAOYSA-N 386.904 5.140 30 20 GKED CCc1c(C)sc(NC(=O)c2cc(Br)ccc2Cl)c1C#N 609033013 OCEXTHCYOGQWQL-UHFFFAOYSA-N 383.698 5.159 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056838 ZGMYNAHCLZDQRI-UHFFFAOYSA-N 396.446 5.156 30 20 GKED CCc1ccc([C@H](C)NC(=O)[C@@H](C)Nc2ccccc2SC[C@H](C)C#N)cc1 609387224 TXFVDRNZGFPOMN-FGTMMUONSA-N 395.572 5.179 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccc(F)cc12 609438988 RHKNWXCESSODJH-CYBMUJFWSA-N 397.475 5.596 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl 610106867 ISERJRZPLYWFOT-ZWKOTPCHSA-N 384.882 5.139 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N[C@@H](C)c1cccc(C#N)c1 610361024 NQVHOBGTMSHWPV-LBPRGKRZSA-N 381.888 5.135 30 20 GKED N#C[C@H](C(=O)c1ccccc1OCc1ccc(F)cc1)c1ccc2ccccc2n1 613291241 WZSADLSNBVZMAM-NRFANRHFSA-N 396.421 5.443 30 20 GKED C=CCOc1cccc(CN[C@@H](c2ccc(F)cc2)c2ccc(OC)cc2)c1 620759730 XEHIKIMQEGEAOV-DEOSSOPVSA-N 377.459 5.278 30 20 GKED C=CCC[C@H](NC(=O)N1CC[C@@]2(C1)CC2(F)F)c1ccc(C(F)(F)F)cc1 650982165 LXZOTTQLQOZIKJ-RDJZCZTQSA-N 388.380 5.153 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)C1 661379023 QUGUODQLQJUZDZ-LJQANCHMSA-N 383.561 5.233 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 676723680 DCXKBYZMYNHTDF-KSSFIOAISA-N 377.410 5.168 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccc(Cl)cc2)C2CC2)cc1Cl 726469636 LTISXXFHBMMBDO-UHFFFAOYSA-N 376.312 5.226 30 20 GKED CCc1oc2ccccc2c1C=NOCC(=O)Nc1c(C)cccc1C(C)C 727491093 ZYCDQVDDNPQAGJ-UHFFFAOYSA-N 378.472 5.416 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1csc(-c2csc(C)n2)c1 729144982 DSCNFFPGIGWQDG-UHFFFAOYSA-N 385.518 5.074 30 20 GKED C=CC[C@H](NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccncc1 734460931 SVNNYYJUKSEPBM-FQEVSTJZSA-N 380.394 5.199 30 20 GKED C[C@H](Cc1nnc(SCc2cc(Cl)ccc2OCC#N)o1)c1ccccc1 735231110 VPGPKSFCMIJSQB-CQSZACIVSA-N 399.903 5.264 30 20 GKED CC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1c(Cl)nc2sccn12 741836424 AKKXDOHSSXUICI-UHFFFAOYSA-N 390.299 5.395 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c2cccc(Cl)c2)cc1 744034008 XYBNNOFRNJYQQT-AVYPCKFXSA-N 382.891 5.305 30 20 GKED Cc1ccc2c(CCC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c2c1 745947719 KKWRPTJPAUUMKB-INIZCTEOSA-N 393.899 5.549 30 20 GKED O=C(/C=C/c1coc2ccccc12)c1ccc(S(=O)(=O)C2CCCC2)cc1 746521175 WUDWOSOCKFVJSY-SDNWHVSQSA-N 380.465 5.045 30 20 GKED Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 747904668 NAVTZYBQEUBWPB-QZTJIDSGSA-N 378.522 5.077 30 20 GKED N#CCCN(Cn1c(=S)sc2ccc(C(F)(F)F)cc21)CC(F)(F)F 749955528 NILZDUQXZUZWAY-UHFFFAOYSA-N 399.385 5.187 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)N[C@@H]2CCCC[C@H]2C)cc1 751013600 IZRYRTSMOGJCQL-DNVCBOLYSA-N 395.528 5.224 30 20 GKED CCCCCCCNCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 755740118 VQIQNBIHICSRMR-UHFFFAOYSA-N 379.957 5.541 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 756515250 LEIPNDSDVGTIBW-NHIYQJMISA-N 393.314 5.247 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccccc1CCC(F)(F)F 759851353 ZXQHROBCWKWISS-UHFFFAOYSA-N 376.378 5.093 30 20 GKED C[C@H](OC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1cccc(C#N)c1 764613471 NMJMKELRXLXSPF-INIZCTEOSA-N 379.419 5.086 30 20 GKED CCOc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] 765615322 FIEDSHRMGQGFNM-LUAWRHEFSA-N 380.425 5.013 30 20 GKED CN1C(=O)CCc2cc(/C=C\C(=O)c3ccc(Cl)c(Cl)c3Cl)ccc21 774118671 ACMKCAKLRBXOPM-BAQGIRSFSA-N 394.685 5.452 30 20 GKED CN1C(=O)CCc2cc(/C=C/C(=O)c3ccc(Cl)c(Cl)c3Cl)ccc21 774118672 ACMKCAKLRBXOPM-FPYGCLRLSA-N 394.685 5.452 30 20 GKED CCc1ccc([C@@H](NCc2ccc(OC)c(O[C@H](C#N)CC)c2)C(C)C)cc1 774450245 SSBKOVNUNHQOGY-URXFXBBRSA-N 380.532 5.425 30 20 GKED C#CCOc1ccccc1NC(=O)c1ccc(CSc2nc(C)cs2)cc1 775946525 VNASSARUGUCJTA-UHFFFAOYSA-N 394.521 5.008 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1cnc(-c2ccco2)s1 789126955 GNHQOOTZARULJI-FBXUGWQNSA-N 378.409 5.141 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1c(C)cc(C)cc1Cl 795141237 XXUWGYDHNOFBCB-UHFFFAOYSA-N 390.984 5.509 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)n2)cc1 798288066 QDIBGXCJYBBEPO-OTWHNJEPSA-N 376.456 5.238 30 20 GKED N#Cc1cc(Oc2ccc(NC(=S)Nc3ccc4c(c3)CCC4)cc2)ccn1 811708238 ULDMQMIPPYXVKR-UHFFFAOYSA-N 386.480 5.043 30 20 GKED CC1CCN(CCC[C@H](NCc2ccc(C#N)cc2)c2ccc(F)cc2)CC1 812718382 QQCVOARJQWILQI-DEOSSOPVSA-N 379.523 5.040 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](Cc2ccccc2)c2nccn2C)cc1 846207216 LUZHLIMTILFABY-GCJKJVERSA-N 395.934 5.186 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)C1CC2(CCCCC2)C1 850758421 FFZNFZMDQOLMRK-CQSZACIVSA-N 379.287 5.001 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC[C@H]2CC2(Cl)Cl)cc1 856822706 NTUIJENZIKOWOT-FUHWJXTLSA-N 388.298 5.047 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)NCc1csc(C(F)(F)F)n1 895402241 BNMDSWSBLSKUPD-UHFFFAOYSA-N 388.299 5.305 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3nc4ccccc4o3)n2)cc1 915102141 SIMVRODTZAGODA-MRXNPFEDSA-N 387.464 5.069 30 20 GKED C[C@@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915359110 MUUYEQGFDQBHGV-YSZBQJHXSA-N 391.515 5.059 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)s2)cc1 1776051857 KOSQLBPPFAJZQG-UHFFFAOYSA-N 391.370 5.545 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2F)cc1 1776125371 GWPOSYVVWSBTHX-MLRPBERTSA-N 398.474 6.015 30 20 GKED CC(C)COc1cccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)c1 1776335232 YAVJGEXVAGXXRY-CSKARUKUSA-N 382.456 5.103 30 20 GKED C[C@H]1C/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2sccc21 1776589568 MOLYTQRFESYMPX-YGRGUWMTSA-N 380.490 5.948 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)c1cccc(OCC(=O)O)c1 1776807949 FONGZZNSQKDKLO-SEYXRHQNSA-N 378.424 5.135 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776817278 KJTWSJHOTLIZTC-ACCUITESSA-N 392.476 5.798 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(-c2ccc(Cl)cc2)s1 1777268173 NMKNDDSYTTZBII-TWGQIWQCSA-N 398.867 5.671 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1cc2ccccc2o1 45899591 CCGPWICFNQAMNH-MRXNPFEDSA-N 398.487 5.947 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(F)cccc1Cl 57374560 SJNCJXQRNQXMLA-UHFFFAOYSA-N 380.806 5.704 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 58034919 NXXPTRJPKNZDJX-UHFFFAOYSA-N 379.293 5.907 30 20 GKED N#Cc1ccccc1CNc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 63462380 JICIKDNXLQHZSI-UHFFFAOYSA-N 385.345 5.034 30 20 GKED Cc1nc(CSc2ccc(C(=O)OCc3ccc(C#N)cc3F)cc2)cs1 140167672 UVJXQOLSJCVAKH-UHFFFAOYSA-N 398.484 5.112 30 20 GKED CCN(C(=O)CCc1ncc(-c2ccc(C)cc2)o1)c1ccc(C#N)c(Cl)c1 156582082 DCYKZUFCKBHLOM-UHFFFAOYSA-N 393.874 5.161 30 20 GKED N#CCSc1cccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 176022641 DODQZSZRWHSUPW-CQSZACIVSA-N 383.885 5.055 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C[C@H](O)c1ccc(C)cc1 191492088 AZGMFMVSMVPEKJ-QFIPXVFZSA-N 380.532 5.434 30 20 GKED Cc1cccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)c1 209181682 OZJBPXBIKQJPPU-SEYXRHQNSA-N 375.855 5.797 30 20 GKED Cc1ccc(-c2nnc(-c3ccc(C(=O)Nc4ccc(CC#N)cc4)cc3)o2)cc1 248052254 AVGNWWVOBSMWJO-UHFFFAOYSA-N 394.434 5.030 30 20 GKED N#Cc1ccc([N+](=O)[O-])c(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)c1 302216251 PBQPRQCRTNSILV-UHFFFAOYSA-N 384.347 5.032 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)cc1 303277044 HOAXVKPGKSBMBQ-UHFFFAOYSA-N 399.281 5.233 30 20 GKED Cc1ccc(C)c(CSCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 303476699 NYYUXMANJSQJSD-LJQANCHMSA-N 392.549 5.537 30 20 GKED Cn1cc(C(O)=Nc2ccc3c(c2)OC2(CCCC2)O3)c(C2CCCCC2)n1 328714867 DETDPYGILVKMLE-UHFFFAOYSA-N 381.476 5.146 30 20 GKED C=CCCc1ccccc1NC(=O)C1CCN(c2nc3ccccc3s2)CC1 410349034 CTEGUQWTPVIELE-UHFFFAOYSA-N 391.540 5.270 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1c[nH]c2ccccc12 426333388 UJIQYMMMICSFML-JKSUJKDBSA-N 377.513 5.694 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)[C@H](C#N)CCc1ccccc1 433354224 MTLRFIMXDSJSKV-QFIPXVFZSA-N 384.479 5.285 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)cc1 433869752 TUUQAUONJBWIAY-XFKLWTPLSA-N 390.449 5.575 30 20 GKED COc1ccc2cc([C@@H](C)SCC(=O)Nc3cccc(C#N)c3)ccc2c1 438798976 ZOMJNETZXJOANW-OAHLLOKOSA-N 376.481 5.153 30 20 GKED CCCc1c(NC(=O)c2ccc3[nH]c(C)c(C)c3c2)cnn1-c1cccc(C#N)c1 440069388 JOCSTXTXRKLORV-UHFFFAOYSA-N 397.482 5.047 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Nc1cccc(CCC(F)(F)F)c1 441731099 SPIXFLLRJLTLFO-OAHLLOKOSA-N 396.478 5.258 30 20 GKED Cc1cc(CSc2nnc(-c3ccccc3)n2Cc2ccco2)ccc1C#N 447314636 VLWFMYYCOJGSTF-UHFFFAOYSA-N 386.480 5.059 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cccc(Cl)c2C1 459404753 RYORZUUSTUSGIG-AWEZNQCLSA-N 385.920 5.324 30 20 GKED CSc1ccc(-c2csc(NC(=O)[C@@H](C)c3cccc(C#N)c3)n2)cc1 461787910 IHRDYDBNGQQHET-ZDUSSCGKSA-N 379.510 5.146 30 20 GKED N#CCCCOc1cccc(CN[C@H]2C[C@H](c3ccc(Br)cc3)C2)c1 462868192 AJIYFJIIHZNSLJ-KESTWPANSA-N 399.332 5.167 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cccc(-c2csc(C)n2)c1 463413251 CIIAIYXBTFVGFU-UHFFFAOYSA-N 375.497 5.043 30 20 GKED Cc1ccc(-c2cncc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c2)cc1 466350535 TXMVKYYTPKWYIR-QGZVFWFLSA-N 387.508 5.561 30 20 GKED N#Cc1cccc(CCN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)c1 467447182 HDSSXCOACCJGFH-VWLOTQADSA-N 381.454 5.167 30 20 GKED Cc1nc(CN(Cc2ccc(C#N)cc2)C(C)C)oc1-c1ccc(Cl)cc1 468266198 KUUWNCCTYIXCKV-UHFFFAOYSA-N 379.891 5.586 30 20 GKED C=CCN(C(=O)c1ccc(C(=O)CC)cc1)c1nc(-c2ccccc2)cs1 471108413 YQHSVBGVYWNIGW-UHFFFAOYSA-N 376.481 5.236 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)c2ccccc21 473663382 SCGWWMNKCVWUAX-QUCCMNQESA-N 389.474 5.150 30 20 GKED CC(C)c1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)n1 474690591 DLHAUUCTKYSAEZ-UHFFFAOYSA-N 393.434 5.482 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC(c1cccs1)c1cccs1 475569039 OTKSAGAEPIUHIU-UHFFFAOYSA-N 396.581 6.573 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 476086727 XOVHOKDGPDGEET-UHFFFAOYSA-N 380.469 5.914 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(-c2ccc(Cl)cc2)no1 487376239 ITSAVOPTFXSWFG-CQSZACIVSA-N 383.904 6.001 30 20 GKED Cc1cccc2[nH]cc(CCNC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)c12 487388464 MXGWORYUNPEKAY-UHFFFAOYSA-N 395.462 5.113 30 20 GKED N#C[C@H](C(=O)c1cccn1C1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 496571417 KLYNKOWUGSFAPZ-QGZVFWFLSA-N 395.915 5.870 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 498143129 BIHHEQLMYOPGMM-QMMMGPOBSA-N 386.691 5.033 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cc(F)ccc1F 502678532 JMNGJSBYKHFVCF-UHFFFAOYSA-N 399.210 5.087 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H]1c2ccccc2CC[C@@H]1n1ccnc1 505036362 WBHZZMTUJXSDJC-GOTSBHOMSA-N 386.499 5.052 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2Sc2ccccc2)cc1 509681903 WDYHNCRIGYWQCB-UHFFFAOYSA-N 376.506 5.440 30 20 GKED N#CCCCn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)c2ccccc21 513354462 SZMLSKRIEGOQPT-KOUNCHBCSA-N 397.522 5.496 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1 513973551 YSMDXOMAVJZVIJ-UHFFFAOYSA-N 379.287 5.265 30 20 GKED C[C@H](C#N)CN(C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1)C1CC1 514248101 LXMCUDVQDYGHGP-GFCCVEGCSA-N 394.418 5.078 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 517461510 KAVFHBCWXZZHSG-KRWDZBQOSA-N 382.529 5.388 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 520431335 GTLZDKZBIZRNDF-CYBMUJFWSA-N 393.418 5.368 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2sccc2C#N)cc1Cl)c1ccccc1 520568361 MFGOKISXUCWJJA-CYBMUJFWSA-N 381.888 5.699 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cs2)o1 521326049 DTBUIHHPDZWWTF-CYBMUJFWSA-N 383.498 5.358 30 20 GKED C=CCN(C(=O)[C@@H](CC)OC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 521545792 BHRZHCJNVWHKIB-OAHLLOKOSA-N 385.316 5.061 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)CC1 522088716 CWFJXYMZBFVRKZ-ZDUSSCGKSA-N 386.483 6.026 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 524326839 NRYUONAIECJIPY-ROUUACIJSA-N 387.310 5.407 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H]1C(C)C 524438210 VGABBOQBXSVVJF-JOCHJYFZSA-N 377.488 5.098 30 20 GKED C=CCC[C@H](NCc1csc(-c2ccc(OC)c(OC)c2)n1)c1ccccc1 537155889 JHVQQNCCYUXPJH-FQEVSTJZSA-N 394.540 5.624 30 20 GKED C[C@H](N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccc(C#N)c(F)c1 540704834 AXEZBJOYDIXCQN-SJORKVTESA-N 375.447 5.083 30 20 GKED C=C(C)CN1CCC(NC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 542593412 RRBIWBZCMUDNCF-UHFFFAOYSA-N 392.996 5.145 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 543944257 JYUQWYKELYEFBV-MRXNPFEDSA-N 375.497 5.189 30 20 GKED C=CCC[C@@H](NCc1nnc(C2CC2)n1C1CC1)c1ccc(C(F)(F)F)cc1 543980940 UKCMPKMJCXQLDX-GOSISDBHSA-N 390.453 5.306 30 20 GKED N#C[C@@H](C(=O)c1cc(F)ccc1Sc1ccc(Cl)cc1)c1ccccn1 544817981 OWMKSJSBNLFVIN-QGZVFWFLSA-N 382.847 5.515 30 20 GKED CC1=C(c2ccco2)CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 548955327 BYPRCWBRFDXSDL-INIZCTEOSA-N 381.501 5.385 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCc2ccccc21 553665137 LPZISJAUHDLIIP-WMZOPIPTSA-N 379.529 5.322 30 20 GKED N#CCCN(C(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccc(F)cc1 553822496 UPFBCQZRKVIEBH-UHFFFAOYSA-N 376.218 5.174 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OC2CCCC2)cc1 562086846 JACQOBXQBFTGMP-UHFFFAOYSA-N 396.535 5.396 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)Nc1cc(C#N)ccn1 563558150 RVQCJOASPCDDLJ-LLVKDONJSA-N 399.317 5.321 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCSc1cccc(Cl)c1 564108003 IRAHDEUAXRQHDZ-AWEZNQCLSA-N 390.961 5.855 30 20 GKED C=C(C)Cn1c(SCc2ccc(C(C)C)nc2CC)nnc1-c1ccncc1 565138366 ZWAQOWANXRULAZ-UHFFFAOYSA-N 393.560 5.289 30 20 GKED Cc1ccccc1[C@H](c1noc(-c2cnc(C(F)(F)F)c(C#N)c2)n1)C(C)C 569795325 KYFZVWBGNYQXFC-MRXNPFEDSA-N 386.377 5.118 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)NCc3ccc(C(F)F)cc3)cc2)ccn1 572327326 COHBVRJINFNEBB-UHFFFAOYSA-N 394.381 5.005 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1Cl 574835530 YFIOGUOWLIAPKR-CVDCTZTESA-N 389.886 5.408 30 20 GKED Cc1ccccc1-c1cc(NC(=O)CCCCCC#N)n(Cc2ccccc2)n1 588305747 UFAFKHSITMCLGA-UHFFFAOYSA-N 386.499 5.319 30 20 GKED N#CC1(CC(=O)Nc2sc3c(c2-c2nc4ccccc4s2)CCC3)CC1 590240595 ILRRHRDPGALDOR-UHFFFAOYSA-N 379.510 5.146 30 20 GKED N#Cc1cc(NC(=O)CC2(C#N)CC2)ccc1Oc1ccc(C(F)(F)F)cc1 590282085 UTUFTDWKPZVHAC-UHFFFAOYSA-N 385.345 5.002 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccccc1-c1ccc(Cl)cc1 595527589 VNEVJCKGODRZDF-IRXDYDNUSA-N 381.907 5.403 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)CC3(C#N)CCOCC3)cc2)cc1C 596716920 JQHLYIUJPQKAQT-UHFFFAOYSA-N 380.513 5.104 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)nc1)c1nc(-c2ccccc2)cs1 603627830 YGCDOLMSPMWXNJ-LJQANCHMSA-N 397.459 5.487 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(COc3ccc(C#N)cc3)o2)c(C)c1 609056333 HGUAWJUUCLCWGJ-GOSISDBHSA-N 388.467 5.180 30 20 GKED CCn1c(C)cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1C 609072513 OUSFSJCQXIRTAE-UHFFFAOYSA-N 387.483 5.136 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C2CC2)cc1Cl 609137795 ASMAVHRSOJMLDL-TZIWHRDSSA-N 379.891 5.402 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(OCC(F)(F)F)cc1 609377273 SVIZSOQGDQDEPX-ZDUSSCGKSA-N 394.418 5.132 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N(c2ccccc2)C2CCCC2)o1 609409179 PZXQSQOPSIHKRF-UHFFFAOYSA-N 386.451 5.320 30 20 GKED Cc1nc(-c2cccc(NC(=O)CCCCOc3cccc(C#N)c3)c2)cs1 609497355 JAIRWLLPXKDQOI-UHFFFAOYSA-N 391.496 5.178 30 20 GKED Cc1csc([C@@H](C)NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 609724415 ZDTWMBGIQAOLIG-CYBMUJFWSA-N 397.887 5.260 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)c1cccc(F)c1 609855885 LFSZGTXOEQLTNA-UHFFFAOYSA-N 388.442 5.714 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1)c1cccc(C#N)c1 610356274 NELRVXJNYOGUKF-ROUUACIJSA-N 389.524 5.654 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H]3c3cccc(F)c3)cc2)c1 611049356 SAUAAMZHNAEHRC-QFIPXVFZSA-N 387.414 5.469 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 618758575 VNTTYADJGKTQKB-DEOSSOPVSA-N 397.478 5.255 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](COC)c1cccc(OC)c1 666866020 GFRBHVBBVKYHHA-OAQYLSRUSA-N 382.504 5.056 30 20 GKED C=CCn1c(SCc2ccc3ccccc3c2)nnc1-c1ccccc1OC 673459289 JWHTUIJVSVZQNI-UHFFFAOYSA-N 387.508 5.585 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(CO[C@H]3CCC[C@H](C)C3)c2)c1 726484884 KBGKELKHEAYECP-JTSKRJEESA-N 378.541 5.572 30 20 GKED COc1cc(/C=C/C(=O)c2cn(C)c3ccccc23)ccc1OCC(F)(F)F 726740771 PKKQETSLGUCPBR-VQHVLOKHSA-N 389.373 5.024 30 20 GKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(N2CCCC2=O)cc1 727264178 NHKSGWXIUHNIPM-WMZJFQQLSA-N 393.792 5.382 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1c(Cl)cccc1Cl 730416657 HAVTXXDQANRHOI-KOLCDFICSA-N 393.270 5.722 30 20 GKED C[C@@H](NN=Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl)c1ccccc1 731150686 DFFUYNNCKIBRAF-MRXNPFEDSA-N 380.923 5.643 30 20 GKED Cc1cc(CN(C(=O)/C=C\c2ccccc2C#N)C2CCCC2)c2ccccc2n1 732096656 VTMOSTGXHDJVPH-PFONDFGASA-N 395.506 5.400 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 740037557 YPYCSUGQEREETM-LIRRHRJNSA-N 391.496 5.003 30 20 GKED CSCc1ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740446685 BFCNLZOXNULZSV-UHFFFAOYSA-N 393.537 5.471 30 20 GKED CCOc1ccc(C=Nc2ccc(OCc3ccccn3)c(Cl)c2)c(O)c1 743538166 HJKSBIQEQBUCQY-UHFFFAOYSA-N 382.847 5.169 30 20 GKED COc1cc(/C=C2\CCSc3ccc(Cl)cc3C2=O)cc(OC)c1OC 748440488 DCGMOCISWHQXQH-MDWZMJQESA-N 390.888 5.128 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cccc(F)c2F)cc1 749793029 GBVDIIOZGTWPPD-FQEVSTJZSA-N 376.406 5.192 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C=C(/C)c1cccc(Cl)c1 750684313 PVPXRMUPIGVHBC-NLBZTSMMSA-N 394.902 5.216 30 20 GKED CC(C)(C)O[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 753968676 OIFPXRKRPIQIEF-BJKOFHAPSA-N 398.506 5.837 30 20 GKED CC[C@@H](SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 757749428 IZTPOHAYKPBCGL-WIYYLYMNSA-N 392.549 5.871 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)Cc1ccc(OCC#N)cc1 759404110 PYTMAGDBJHBZJN-KRWDZBQOSA-N 377.513 5.214 30 20 GKED C=CC[C@H](N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccncc1 766018757 ITIUCAKKYSXGQU-VQTJNVASSA-N 391.540 5.498 30 20 GKED N#C[C@H](C(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)c1nc2cc(Cl)ccc2s1 766263279 QVVPJZYVHREKDD-PMZIWESGSA-N 388.895 5.434 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ccc(Br)c(Cl)c1F 769514876 GZDGMCQBJQNXBW-UHFFFAOYSA-N 376.653 5.118 30 20 GKED CCCOc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1Cl 770489641 UGXQCPAUUTYNFS-UHFFFAOYSA-N 394.906 5.518 30 20 GKED CC(C)CN(Cc1cc(Cl)ccc1OCC#N)[C@H]1CCCc2cccnc21 775768196 ZLWCLFPVLIUJSA-FQEVSTJZSA-N 383.923 5.173 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C)c1ccccc1 777731451 IKLCLTARVSLNLB-GOSISDBHSA-N 392.499 5.283 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCC(C)(C)Cc1cccc(Cl)c1 780673108 NWYGYOSHAHCGBJ-HNNXBMFYSA-N 385.895 5.021 30 20 GKED C=CCCN(OCc1ccccc1)c1nc(-c2cccnc2)nc2ccccc12 782448380 FTFVCRUPVYCWPL-UHFFFAOYSA-N 382.467 5.206 30 20 GKED N#Cc1c(Cl)nsc1Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 788569420 OCHGGYGVIXQENU-UHFFFAOYSA-N 398.662 5.301 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCc3cc(Br)ccc32)c1 794811906 UQUHBJWVLUGCCR-NQIIRXRSSA-N 399.332 5.297 30 20 GKED CC(C)(C#N)c1ccc(C(=O)OCc2nc3cc(C(F)(F)F)ccc3o2)cc1 796041498 VHBUITDOVOLETB-UHFFFAOYSA-N 388.345 5.005 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c(C)n1Cc1ccccc1 797571110 NWHMZRKMVGAAAB-LJQANCHMSA-N 391.540 5.397 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)C[C@H]2CCC(F)(F)C2)cc1 797835076 IBYUEKBNHDRYDD-GOSISDBHSA-N 386.417 5.052 30 20 GKED Cc1cc(Br)cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c1O 815635896 LPTPMHQHFWQFGI-KXBFYZLASA-N 387.321 5.549 30 20 GKED C[C@H](Sc1nc2ccccc2s1)C(=O)N[C@@H](CCCC#N)c1ccccc1 817325021 VBFGSBKIMKBFLM-RDJZCZTQSA-N 395.553 5.328 30 20 GKED COc1ccc(-c2cc(NCc3ccc(C#N)cc3F)ccc2OC(F)F)cc1 825123249 IZWCUBJWJUZUHI-UHFFFAOYSA-N 398.384 5.586 30 20 GKED Cc1nc(SC2CCCC2)sc1CC(=O)[C@@H](C#N)c1nc2ccccc2o1 842293878 MKIDBEJUISNZLQ-CQSZACIVSA-N 397.525 5.046 30 20 GKED COCc1c(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)sc2cccc(F)c12 842940088 XAEZHMTYLHLWGE-NSHDSACASA-N 386.473 5.011 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)c1C1CC1 860484611 OYFCETUCBPQTCT-MRXNPFEDSA-N 376.504 5.054 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(Cl)cc1 917669092 NPBALIBKEWZIEL-QFIPXVFZSA-N 388.898 5.912 30 20 GKED Cc1ccc(C(Cc2ccccc2)=NNc2ccc(Cl)c(C(=O)O)c2)cc1C 1776033537 XBTOBHPDEHMFMI-UHFFFAOYSA-N 392.886 5.714 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2cccc(F)c2)cc1 1776788300 ZCSXVCGGOFLZFA-QFIPXVFZSA-N 387.495 5.481 30 20 GKED COc1c(C)cc(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)cc1Cl 1777252734 JRXYFVIOTWGHTI-HJWRWDBZSA-N 395.842 5.108 30 20 GKED COc1cccc(Oc2ccc(/C=C/C(=O)c3ccc(C(=O)O)s3)cc2)c1 1777382071 NQQIBHXDHBFJGF-JXMROGBWSA-N 380.421 5.143 30 20 GKED Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2-c2ccccc2C#N)c(C)c1 8176459 NHZUSCRDXROXRP-SFHVURJKSA-N 398.462 5.026 30 20 GKED C[C@@H](Sc1ccc2ccccc2c1)C(=O)Nc1sc2c(c1C#N)CCC2 22249604 QIJKMHGNFFMBOG-CYBMUJFWSA-N 378.522 5.381 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccccc1Cl 24591629 DFXFFKSLDVATON-UHFFFAOYSA-N 378.884 5.293 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Br)ccc1C 47571094 LBVWOSQQPGUNFF-UHFFFAOYSA-N 386.293 5.073 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)cc2c1 57088884 PDHVPUBKAOBVAV-UHFFFAOYSA-N 382.423 5.096 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1 62407377 FQHFWMGFTUMITL-JOIKAWEESA-N 387.483 5.393 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cc2c(s1)-c1ccccc1OC2 62905066 YSHNGXVIYGZFMR-UHFFFAOYSA-N 386.476 5.008 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccccc2Cl)s1 64907551 IAFFWNZNYQTVSV-UHFFFAOYSA-N 395.915 5.386 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc(F)c2F)cc1 67331973 GHVISPRDYONGDF-UHFFFAOYSA-N 380.419 5.381 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ncc(-c2cccs2)o1 67429351 DCPOFBRFIPYMER-UHFFFAOYSA-N 394.525 5.064 30 20 GKED CSc1ccsc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 107411110 QINPJVIVGPLSDK-SECBINFHSA-N 392.477 5.362 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)c1ccccc1F 108147819 IGRJKQKQJRKGDX-GJZGRUSLSA-N 388.533 5.510 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)cc1OC 110088465 NDNVABDKJLPPAJ-BJMVGYQFSA-N 380.362 5.017 30 20 GKED C=CCn1c(C2CC2)nn(CNC2(c3ccc(Cl)cc3)CCCC2)c1=S 110628598 SUHRPDFFYSDTIK-UHFFFAOYSA-N 388.968 5.147 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 111766969 SGXFJXZPAAQWQV-DOTOQJQBSA-N 399.947 5.756 30 20 GKED C[C@H](SCc1ccccc1C#N)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 120502027 WEUXFGBDNNQWKH-LBPRGKRZSA-N 393.493 5.111 30 20 GKED N#CCC[C@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccccc1 130472624 YONAHMVACHUVGX-FQEVSTJZSA-N 397.931 5.510 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C(C)=C/c1ccc(Cl)cc1 136601851 BKQUKNLCMLAFNX-GUCAUAJOSA-N 394.902 5.216 30 20 GKED C=CCCC(=O)N[C@H](C)c1sc(-c2ccccc2Br)nc1C 160412524 IOOADCZBHKKYBQ-LLVKDONJSA-N 379.323 5.024 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(Oc3ccccn3)c2)c1 174509901 RHAGYHCCFRLHFF-UHFFFAOYSA-N 388.427 5.200 30 20 GKED CSc1c(F)cc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1F 184177243 GZMAMCDCBMGREC-UHFFFAOYSA-N 384.455 5.076 30 20 GKED C=CC[C@@H](C(=O)N[C@@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 186746323 WPVGCMYJPIQMCH-PGRDOPGGSA-N 393.531 5.097 30 20 GKED Cc1cc(Br)c2oc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cc2c1 187578171 DELYFJDWTAKTDC-LBPRGKRZSA-N 395.212 5.135 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)nn(CC(F)(F)F)c1C 189907741 GKHMXOKEYBSNMS-UHFFFAOYSA-N 393.453 5.095 30 20 GKED COc1cc(C(=O)/C=C/c2cccc(OC(F)F)c2)ccc1SC(F)F 195741305 NUQQKSOIPVMJOE-FNORWQNLSA-N 386.366 5.507 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cccc(OCc3ccccc3)c2)c1 237023427 PVSPCVUYZQKQIM-QHCPKHFHSA-N 386.495 5.236 30 20 GKED N#Cc1ccc([N+](=O)[O-])c(Oc2ccc3c(-c4ccccc4)cc(=O)oc3c2)c1 302230995 YNOMQVVNWFRMNT-UHFFFAOYSA-N 384.347 5.032 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCc1c(C)nn(CC(C)C)c1C 302792812 MUYUHMURTXKEHD-UHFFFAOYSA-N 393.984 5.018 30 20 GKED Cc1sc(NC(=O)c2ccc(CSc3ccccc3)cc2)c(C#N)c1C 410001638 YKCUGAASJWOGEE-UHFFFAOYSA-N 378.522 5.781 30 20 GKED C=CCC1(C(=O)N2CCC(F)(c3ccccc3OC(F)(F)F)CC2)CCC1 410172774 FOZJVVWUZUGAGG-UHFFFAOYSA-N 385.401 5.119 30 20 GKED CCCCn1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 435008071 KWFJKVHEHZNCST-UHFFFAOYSA-N 388.471 5.216 30 20 GKED Cc1nn(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1-c1ccccc1 435550016 DBCAMFTWGNEPAU-UHFFFAOYSA-N 398.491 5.097 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CC[C@@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 437793909 BZSMZMZYYBNFDH-BFUOFWGJSA-N 387.405 5.501 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 438226032 OPXNBNNFXKKJOZ-MRXNPFEDSA-N 383.517 5.346 30 20 GKED N#Cc1cc(N(C#N)CC(=O)c2c(-c3ccccc3)[nH]c3ccccc23)ccc1F 439707412 KFGMWSJJCMNPGS-UHFFFAOYSA-N 394.409 5.016 30 20 GKED C=CCC[C@H](NC(=O)N(C)CCC1CCOCC1)c1ccc(C(F)(F)F)cc1 441535118 NASITCROKXNQKR-IBGZPJMESA-N 398.469 5.171 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 442598479 APLOCILIEBDVES-CYBMUJFWSA-N 379.407 5.013 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(-c3nc(C4CC4)no3)cc2C)CCCC1(C)C 445104949 DUSLFNUESUTXCE-LJQANCHMSA-N 394.519 5.521 30 20 GKED N#Cc1cc(NC(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)ccc1F 448352732 VHHVGVHJEMYVGN-UHFFFAOYSA-N 389.883 5.139 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N[C@H]3CC[C@@H](CC#N)C3)cc2)cc1 454715265 VOCVHFYMKWDTJQ-RDJZCZTQSA-N 381.501 5.050 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1)c1ccccc1 458797427 GHPVZNHWQXRPNS-SFTDATJTSA-N 381.907 5.622 30 20 GKED Cc1nc(C)c(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)s1 460170086 YGOPTBDYDTVJLJ-UHFFFAOYSA-N 381.888 5.132 30 20 GKED C=C(C)Cn1c(N2CCC[C@@H]2c2nc3ccccc3s2)nnc1C(C)(C)C 460566857 UQGCNZJEDXXYKT-MRXNPFEDSA-N 381.549 5.103 30 20 GKED Cc1ccc(-c2cnc(CSc3nc(C)cc(C(F)(F)F)c3C#N)o2)cc1 463250341 LCKOMMAZWVYBKA-UHFFFAOYSA-N 389.402 5.536 30 20 GKED CC(C)c1scnc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 463593573 URLICFNRPFZERA-QGZVFWFLSA-N 395.915 5.828 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 465738968 DOPBGNWOHXWMHV-IBGZPJMESA-N 399.878 5.001 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 465738969 DOPBGNWOHXWMHV-LJQANCHMSA-N 399.878 5.001 30 20 GKED CC(C)c1ccc(CN(C(=O)Nc2ncccc2OCCCC#N)C2CC2)cc1 466623886 YGCYXPJECBSGMQ-UHFFFAOYSA-N 392.503 5.084 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)c1 468369482 XJFZNIJVQWGNKP-OAQYLSRUSA-N 378.834 5.065 30 20 GKED N#CCCCn1cc(C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccc21 469534251 YBMQGPCJJWRYEG-HZPDHXFCSA-N 391.437 5.044 30 20 GKED C[C@H]1CCCCN1Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 474898358 GYHQJFPTBQWPJU-SIKLNZKXSA-N 375.516 5.087 30 20 GKED Cc1c(F)ccc(Cl)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 475589291 NVVATDMDRZZBII-UHFFFAOYSA-N 394.833 5.491 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 475967617 VGNAIDLZWJSDCX-UHFFFAOYSA-N 394.519 5.555 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccccc1 476533857 BZYROIYLRRFPJH-DYESRHJHSA-N 386.417 5.360 30 20 GKED C=CCCCC(=O)Nc1c(C)cccc1-c1nc2cc(F)ccc2n1C(C)C 481854655 KCJYATDLBZXZKA-UHFFFAOYSA-N 379.479 6.027 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccnc(Oc2ccccc2F)c1 481996664 DVUNJHNJMDLGJY-JOCHJYFZSA-N 387.458 5.442 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cccs1)c1ccc(F)cc1F)c1ccccc1 483356772 KDBKWDDVPQLTOH-KRWDZBQOSA-N 396.462 5.647 30 20 GKED Cc1nc2cc(C(=O)[C@H](C#N)c3nc(-c4c(F)cccc4F)cs3)ccc2o1 483529827 ZZXQLRPQZWSMPI-LBPRGKRZSA-N 395.390 5.028 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1nc2ccccc2[nH]1 495221522 OZJKTRDOCBUXKB-CQSZACIVSA-N 395.340 5.332 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@@H]1c1cccc2ccccc12 503081184 ATWMJUPTSGXUCT-YADHBBJMSA-N 393.408 5.130 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@](C)(c2ccccc2)C1 503225381 KIAMCESMGHBPSO-JPYJTQIMSA-N 393.556 5.666 30 20 GKED Cc1nc(NC(=O)c2cc3c(s2)CCCCCC3)sc1SCC#N 504837045 MPDXOWZKHZPGSD-UHFFFAOYSA-N 377.560 5.040 30 20 GKED N#C[C@H](NC(=O)c1cccc(F)c1Cl)c1ccc(OCc2ccccc2)cc1 505338676 QFJHXZUBBFWFMD-FQEVSTJZSA-N 394.833 5.053 30 20 GKED N#CCN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)c1ccccc1 510620834 ARVXKSWVUIBCQL-UHFFFAOYSA-N 398.249 5.351 30 20 GKED C=CCCOCCCCC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 510853076 RYDRGRIRDORCFV-UHFFFAOYSA-N 382.331 5.372 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CNC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 517652786 AOJOBESPHCUIFW-OPAMFIHVSA-N 386.451 5.191 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 518162810 KEMJNYMUVXPDPA-NRFANRHFSA-N 388.471 5.197 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Br)c1 521191345 HZTSCXYJBXPYOR-UHFFFAOYSA-N 386.293 5.011 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1ccc2ccccc2c1 521725529 FALWURYNEGEUDE-MRXNPFEDSA-N 376.481 5.109 30 20 GKED C[C@H](SCc1csc(COc2ccc(F)cc2)n1)c1ccc(C#N)cc1 522841267 QAYLOYFRMUXHGP-AWEZNQCLSA-N 384.501 5.727 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1ccccc1F 524420024 MBZZKPFYRZUXOQ-UHFFFAOYSA-N 375.403 5.229 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c2)cs1 525284157 VISWVGAMRFFPKB-GFCCVEGCSA-N 393.537 5.429 30 20 GKED CSc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1F 527292728 PRTFZXKWMNWZMA-OAHLLOKOSA-N 397.519 5.304 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 531320339 FEGBVJFCTRVLGP-CQSZACIVSA-N 394.475 5.320 30 20 GKED COc1ccc(CNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)cc1C#N 532612318 QJRLQVJKNMTSGV-UHFFFAOYSA-N 399.372 5.385 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N(C[C@@H](C)C#N)C3CC3)c(C)c2)c1 533140351 VEFAYCBZUHFVRN-KRWDZBQOSA-N 377.488 5.038 30 20 GKED C=C[C@H](CC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 535409482 AQMRTOQTWOQIMK-HXUWFJFHSA-N 399.494 5.307 30 20 GKED C[C@@H](NCC#Cc1ccccc1Cl)c1ccc(OCc2cccnc2)cc1 538126506 XCMFKDLYKRFRCN-GOSISDBHSA-N 376.887 5.016 30 20 GKED CC(C)c1oc([C@H]2CCCN2Cc2ccc(C#N)s2)nc1-c1ccccc1 539819642 OOZBUZRSOYOXCA-LJQANCHMSA-N 377.513 5.735 30 20 GKED CC(C)(CNC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C(F)(F)F 548956242 YKKGEQXMYIZIKY-UHFFFAOYSA-N 377.366 5.061 30 20 GKED CCCc1nc(C)c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2OC3)s1 565996447 CXHPJLUTPVVVMA-UHFFFAOYSA-N 395.509 5.149 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCCc3sc(-c4ccc(F)cc4)nc31)CC2 568453020 YIBZCNOCIRZEEY-PMACEKPBSA-N 389.499 5.475 30 20 GKED COc1ccc([C@H](CCC#N)Nc2cnn(-c3ccc(Cl)cc3)c2C)cc1 569736176 RFTLQVUTOBLROU-FQEVSTJZSA-N 380.879 5.300 30 20 GKED C[C@](C#N)(NC(=O)c1sc2cc(Cl)ccc2c1Cl)C1CCCCC1 577976500 POSFDBGZDKLTDE-GOSISDBHSA-N 381.328 5.800 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1cccc(O)c1)CC1CC1 580977482 CGZOUBCORZHPGG-MRXNPFEDSA-N 395.528 5.231 30 20 GKED C=CCN(C(=O)c1ccc2nccc(C)c2c1)c1nc(-c2ccccc2)cs1 583833653 XLHGYTREQONPRI-UHFFFAOYSA-N 385.492 5.500 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1cccc(C(F)(F)F)c1 588204459 BRAPOCVRLWQRHN-NSHDSACASA-N 383.211 5.190 30 20 GKED C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 588447168 GXRQEFRKGXBPLB-QIENPNARSA-N 397.843 5.138 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)C1CCC(F)(F)CC1 594069616 FSGKRTWWSNQSHO-UONOGXRCSA-N 381.492 5.274 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCCC(F)(F)CC2)cc1Cl 600253493 CXRAXQLCKYTLLW-UHFFFAOYSA-N 390.817 5.265 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)c1cc2ccccc2n1CC#N)C1CC1 609165003 MCVONNWESOMLNL-HNNXBMFYSA-N 377.875 5.184 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N(Cc3cccs3)C3CC3)c2)cc1 609208732 HZRDMDCLKXXLBG-UHFFFAOYSA-N 389.480 5.609 30 20 GKED CCCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 610357021 FPYUDUSPTPCZRH-IAGOWNOFSA-N 375.472 5.548 30 20 GKED CN(C(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)o1)c1ccc(C#N)cc1F 610388015 AEPBNFGEIGAHEO-UHFFFAOYSA-N 376.431 5.531 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611851663 DDHLMACOXZKJPB-ROUUACIJSA-N 384.483 5.050 30 20 GKED N#C[C@@H](C(=O)c1cc2ccsc2[nH]1)c1nc(-c2ccc(Cl)cc2)cs1 613319882 OQAVDBNUZSRPDN-ZDUSSCGKSA-N 383.885 5.496 30 20 GKED Cc1[nH]c2ccc(-c3noc([C@H]4CCCN4c4ccc(C#N)cc4)n3)cc2c1C 615132112 ZLQAIRAPTUGCLD-OAQYLSRUSA-N 383.455 5.048 30 20 GKED O=C(c1cc2ccc(F)cc2s1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618300930 HRHZMQGGVCATTN-AOOOYVTPSA-N 399.331 5.243 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2cc3ccccc3n2CC#N)o1 619451567 SOWNSIVHAMCFAK-UHFFFAOYSA-N 389.842 5.639 30 20 GKED O=[N+]([O-])c1cc(C=Nn2cnc3ccccc32)ccc1Oc1ccccc1Cl 725848845 LNEJDRURCQPOQK-UHFFFAOYSA-N 392.802 5.272 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)NCc1ccc(OCC#N)cc1 727659951 MBNHORWDDYNYFY-UHFFFAOYSA-N 381.545 5.322 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCC(=O)c2ccc(C)c(C)c2)c1 728182414 ONSJTAWEZPROCE-UHFFFAOYSA-N 385.463 5.074 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 728483020 GOJYZWXQVLLKJB-UHFFFAOYSA-N 388.448 5.004 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2SC(F)(F)F)cc2ccccc21 729354646 QPIPRBUDRBDDPP-UHFFFAOYSA-N 375.375 5.029 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420380 CUBXKWIYVJNHRR-ZYHUDNBSSA-N 390.892 5.446 30 20 GKED CCCCSCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 730996216 WLCSSBHLNBPURP-UHFFFAOYSA-N 376.469 5.183 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2c(OC(F)F)ccc3ccccc23)c1 733800083 GVOVEPRUCPPJQI-GOSISDBHSA-N 396.437 5.412 30 20 GKED C=CC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1ccncc1 734457542 LHRJYTSWGGNDOH-SDHSZQHLSA-N 398.506 5.198 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3ccc(Cl)s3)c2)s1 739594719 OWUGHKREWKIUFH-UHFFFAOYSA-N 386.929 5.251 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC)c(OC)c2)c(SC)cc1OC 741165074 GHLMRTGPMHFCNB-VURMDHGXSA-N 390.526 5.052 30 20 GKED N#C[C@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2o1 744038862 AZTRGQOGOIIHPH-LEWJYISDSA-N 380.447 5.421 30 20 GKED CC(C)Oc1ccccc1C=NO[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1 744444114 QYYCAYUMCVHTFL-AWEZNQCLSA-N 385.851 5.289 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1ccccc1)C(=O)c1ccccc1 747150604 RESNNPONDCTDFJ-PTGBLXJZSA-N 383.491 5.716 30 20 GKED CC1(C)CCC(CC(=O)[C@H](C#N)c2nc(O)c3c4c(sc3n2)CCCC4)CC1 752474196 RLNUKNQPOOZTSO-HNNXBMFYSA-N 397.544 5.058 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(N2CCCCC2)c(F)c1 753140296 AMDRRAPNPDMQRI-CSKARUKUSA-N 393.487 5.231 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C(C)=C\c1cccc(Cl)c1 759204986 HJAOYEXUSHJJQH-LFDGNKEFSA-N 394.902 5.216 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1cnc(C)s1 761254894 OMGDYVVZHMKZRV-UHFFFAOYSA-N 379.514 5.268 30 20 GKED C=C(C)C[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 767706850 UYWOSBRQPANXRW-ZJUUUORDSA-N 378.683 5.119 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCCc3c(C)ccc(C)c32)ccc1OC 769962688 JFVFBOJMEWTVIT-PZJWPPBQSA-N 378.516 5.160 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(O)c(-c2nc3ccccc3s2)c1 770080433 RHOMPXOAPMSYDN-UHFFFAOYSA-N 385.448 5.101 30 20 GKED CC(C)(C)OC(=O)N1CCc2cc(NCc3ccc(C(C)(C)C#N)cc3)ccc21 774293481 RORABFWQOJAHFZ-UHFFFAOYSA-N 391.515 5.397 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(F)cc2)cc1 780168662 BDJHCEMQMNFUKD-HNNXBMFYSA-N 376.387 5.161 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)nc1 782048466 JFBAVVUQAYVOGP-UHFFFAOYSA-N 394.887 5.080 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566455 KGDJRSMVVWRSHB-QWHCGFSZSA-N 376.909 5.046 30 20 GKED Cc1nc(CCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)oc1-c1ccccc1 797570411 GUAMDVRTWVAGPZ-INIZCTEOSA-N 393.512 5.213 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570729 JJYMATBONPLEEF-AWEZNQCLSA-N 399.516 5.278 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)NCc1cccc(O[C@H](C#N)CC)c1 797683393 KOGOEFWTMMZGQE-FQEVSTJZSA-N 379.504 5.123 30 20 GKED C[C@H](Oc1ccccc1NC(=O)C(F)(F)c1c(F)cccc1F)C(F)(F)F 809316685 PAXDHIQHZQOFIW-VIFPVBQESA-N 395.274 5.025 30 20 GKED Clc1nc(Sc2ccccc2)sc1C=Nn1cnnc1-c1ccccc1 814779496 NVJJYYTZQHTSIK-UHFFFAOYSA-N 397.916 5.088 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842942573 PKLUHAIYYRXCST-IAQYHMDHSA-N 378.419 5.409 30 20 GKED CN(CCCN1c2ccccc2Sc2ccccc21)C[C@@H](C#N)CCC#N 860042747 QWXFHOPMCFQQOY-GOSISDBHSA-N 376.529 5.055 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 860424715 KMPNBHRMMTYYCJ-SLFFLAALSA-N 381.426 5.136 30 20 GKED CSc1ccc(/C=C/C(=O)[C@H](C#N)C(=O)c2cc3c(s2)CCCC3)s1 860853151 DWTRIXQOURHWOX-OWNNVSBGSA-N 387.551 5.015 30 20 GKED C=CC[C@@H](C=C)OC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 860926249 WBXMTYHDVMLKMB-CYBMUJFWSA-N 381.259 5.040 30 20 GKED Cc1sc([C@@H](C)N[C@H](C)c2cc(C#N)ccn2)nc1-c1ccc(Cl)cc1 902837199 VHJBUMXAZKYANS-CHWSQXEVSA-N 382.920 5.450 30 20 GKED C[C@H](CCc1ccccc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353465 UKRHIFMCKFYOAK-DVECYGJZSA-N 383.495 5.485 30 20 GKED Cc1[nH]c2ccccc2c1C=Nn1c(C)nc2scc(-c3ccccc3)c2c1=O 916309373 GWDLRPUAWZWKCV-UHFFFAOYSA-N 398.491 5.105 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cn3c(C)cc4ccccc43)n2)cc1 916975007 URVBPFMIEPWUQC-IBGZPJMESA-N 385.492 5.258 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CC1)c1nc2cc(Cl)ccc2s1 917047112 RDVFADYMKCUPJY-CQSZACIVSA-N 387.291 5.511 30 20 GKED CCCc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[nH]c(C)c1C(C)=O 917119860 YOBKYAGETZXAGH-JOCHJYFZSA-N 399.494 5.386 30 20 GKED Cc1cc(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3o2)c(C)n1C1CCCCC1 917509908 GXLMJUDPEGYMER-CBUFDYBVSA-N 387.483 5.641 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCC[C@H]1c1cccc(C(F)(F)F)c1 1776050303 CIAIWUUGWVAWKW-HNNXBMFYSA-N 392.377 5.148 30 20 GKED Cc1cccc(Cl)c1NN=Cc1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1776060941 XFARPNAASXHBAB-OAQYLSRUSA-N 394.858 5.299 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)cc1 1776125669 PRBCGLJMODBZCG-MJZABRMRSA-N 392.495 6.030 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)c(OCC)c(OC)c1 1776782797 BMABMQMFDWDXIV-MRXNPFEDSA-N 385.932 5.041 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)C2(C)CCCCC2)c1 1776789210 VGCOYXNTQICGDQ-OAQYLSRUSA-N 375.553 5.549 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)c1 1777033376 HVAZCSJGZCTSPZ-OVCLIPMQSA-N 385.463 5.010 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4cccc(C(=O)O)c4)s3)coc12 1777449103 VGTAFAZZDOXDBU-NTMALXAHSA-N 388.444 6.064 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)C34CC(F)(C3)C4)cc2)CCC1 1786420630 LUYFQIYMVRTGPF-UHFFFAOYSA-N 398.522 5.005 30 20 GKED C=CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1-c1ccoc1C 6911864 SZRRGPKXIVNBPY-UHFFFAOYSA-N 380.300 5.632 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nc3cc(Cl)ccc3c(=O)n2C(C)C)cc1 7437071 AHONUQMHYBHKBK-KRWDZBQOSA-N 397.931 5.166 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Sc1nc2c(c(C)c1C#N)CCC2 24851596 WBDGCDRSZNFIEI-ZBFHGGJFSA-N 393.556 5.383 30 20 GKED N#C[C@@H](C(=O)c1ccccc1COc1ccccc1)c1ccc2ccccc2n1 48854110 LYDUNRHQHCAEBM-JOCHJYFZSA-N 378.431 5.304 30 20 GKED CCC[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 60577502 TVXVJHLWNPCREH-LJQANCHMSA-N 390.314 5.548 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 66801600 IDOJMMCQKBNZTM-HOCLYGCPSA-N 392.446 5.756 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nc(-c4ccco4)cs3)c2)cc1 97547260 LAENMJGGNAGMMW-UHFFFAOYSA-N 387.420 5.319 30 20 GKED CC[C@H](C#N)Sc1nnc(-c2cccnc2)n1-c1ccc(Cl)c(Cl)c1 127090520 YZTYTNZAKVKGNW-CYBMUJFWSA-N 390.299 5.030 30 20 GKED CC(C)(C)c1nc2ccc(NCc3nnc(-c4ccc(C#N)cc4)o3)cc2s1 134016369 UABDGNDAJOYRIC-UHFFFAOYSA-N 389.484 5.128 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(-c2cccs2)cc1 161659591 LNKZNXFKLOBVHL-KRWDZBQOSA-N 388.540 5.001 30 20 GKED C=C(C)CN(CC)Cc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 164716606 NPUSPQSEKIHCRS-UHFFFAOYSA-N 397.466 5.245 30 20 GKED Cc1nc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)c2)oc1C 171258760 AIRFCBXRVWBSHQ-UHFFFAOYSA-N 386.455 5.027 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1c(Cl)nc2sccn12 177616152 LERKPIGSOSYSJE-ONEGZZNKSA-N 377.903 5.130 30 20 GKED Cc1nc(C(F)(F)F)c(CN[C@H](c2cccc(F)c2F)C(F)(F)F)s1 183668927 ZZNDBUDPRVGXEO-LLVKDONJSA-N 390.299 5.142 30 20 GKED C=CCC1(C(=O)Nc2cc(NC(=O)C3(CC=C)CCC3)c(F)cc2F)CCC1 189341595 XFGRKSKXOQQFDA-UHFFFAOYSA-N 388.458 5.335 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(OCCCC#N)c1 191439020 OSUHDCPORSQZIQ-UHFFFAOYSA-N 377.488 5.865 30 20 GKED C[C@@H]1[C@@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)CCC[C@H]1C 255953080 WQQVRIFZUMFFID-WWMYMODYSA-N 378.541 5.405 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c2[C@H]1C 297760869 IXPMYKWEDWGYOU-YUMQZZPRSA-N 385.436 5.033 30 20 GKED OC1=NC2(CCC2)[C@@H](/N=C(/O)C2(c3cccc(C(F)(F)F)c3)CCCC2)CC1 328735578 JCFSDQKYWAPUBZ-INIZCTEOSA-N 394.437 5.515 30 20 GKED O/C(=N\C1CCC(/C(O)=N\Cc2nc3c(s2)CCCC3)CC1)C1CCCC1 329915495 DDARXJLNEJPVLD-UHFFFAOYSA-N 389.565 5.184 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@H]3C)n1 410974737 JFDFKDJTAJMBKU-GHMZBOCLSA-N 388.924 5.125 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 432843339 ZVCNRCVIUCWUQZ-UHFFFAOYSA-N 397.409 5.580 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(Cc2ccccc2)CC1 435609798 CBZHKHVOJDXIOB-QGZVFWFLSA-N 379.529 5.225 30 20 GKED CCC1(CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CCC1 438629435 FMAFMUGFQHHGJF-UHFFFAOYSA-N 377.488 5.033 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(OC(F)F)cc2)C(F)(F)F)c(Cl)c1 439437324 HXDPUQPWHKTQIX-HNNXBMFYSA-N 390.739 5.206 30 20 GKED Cc1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccccc2C#N)c(F)c1 439659589 GHMWHQQHODNBIA-INIZCTEOSA-N 389.430 5.237 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1nc(C)cs1)c1ccc(C(F)(F)F)cc1 440836709 WSYCTVWFXDJGHC-CJNGLKHVSA-N 397.466 5.538 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCC1CCC(C#N)CC1 441035485 VNYABAYTVFCKFC-QNGMFEMESA-N 375.516 5.289 30 20 GKED COc1cc2ccccc2cc1CNc1ccc2c(c1)CCC(=O)N2CCCC#N 449273912 YLSDLOPSSXKMPU-UHFFFAOYSA-N 399.494 5.043 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458797493 GJIXPGCGJYYOPG-XZOQPEGZSA-N 375.516 5.147 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H](c2ccccc2)CC1)c1ccccc1 458799710 JUASYSJXEWQNGT-JTHBVZDNSA-N 375.516 5.401 30 20 GKED N#CCCC[C@H](NC(=O)N1CC=C(c2ccc(F)cc2)CC1)c1ccccc1 458806377 WAXHBBFNMZWCJL-QFIPXVFZSA-N 377.463 5.060 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1)c1ccc(F)c(F)c1 460881598 JIUSQSOWCRHPGL-VBQJREDUSA-N 390.396 5.345 30 20 GKED CC(C)c1ccc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)nc1 463471671 RYDBZZXGCRSLHA-UHFFFAOYSA-N 387.458 5.058 30 20 GKED CCCOc1ccc(Cl)cc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464416440 BVKYZIKFSRHMIE-CQSZACIVSA-N 382.769 5.033 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)c1cn(CCCC#N)c2ccccc12 469415784 IISPXGFQMVQJOZ-OAQYLSRUSA-N 385.511 5.101 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)CSc1ccc(C#N)cc1 471469441 CRBZPVHKIMHRKX-UHFFFAOYSA-N 388.492 5.177 30 20 GKED Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1NC(=O)C(C)(C)C 475936580 ZRNXHUBHOCEZLW-SFHVURJKSA-N 377.488 5.006 30 20 GKED CCOc1ccc(-c2nc(CC)c(C(=O)[C@@H](C#N)c3nc(C)cs3)s2)cc1 483431823 MYCDSJBDAULCLN-OAHLLOKOSA-N 397.525 5.026 30 20 GKED C=CCC[C@@H](NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 499412726 PYUGXXTVBANVCP-MRXNPFEDSA-N 392.833 5.040 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(C)[C@H](c2ccccc2Cl)C(C)C)cc1 502619769 VZPYCXYWSRKQFH-FQEVSTJZSA-N 399.922 5.117 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1cccc2[nH]ccc12 502622715 OCRYWTZWNHBECT-UHFFFAOYSA-N 382.423 5.784 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(-c4ccccc4)cc3)CC2)cc1 503641635 HQLFZGALOPCXAC-UHFFFAOYSA-N 379.463 5.546 30 20 GKED C[C@@H](NC(=O)Nc1c(F)cccc1Oc1ccccc1)c1ccc(C#N)cc1 504154547 JWWZQRLJUKXBJN-OAHLLOKOSA-N 375.403 5.372 30 20 GKED N#CCSc1cccc(C(=O)N2CCCc3cc(Cl)cc(Cl)c32)c1 508189874 HBTJKJAYGWGHDE-UHFFFAOYSA-N 377.296 5.202 30 20 GKED C=C(C)CCc1noc(-c2ccc(Oc3cccc(Cl)c3Cl)nn2)n1 508594256 JFSROPQQRDZRMZ-UHFFFAOYSA-N 377.231 5.134 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3F)s2)cc1 512648453 NEKRZJKFWWNQAY-UONOGXRCSA-N 395.503 5.550 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C)oc2c1ccc1ccccc12 513672760 UXKXVLDVFMOMLU-SFHVURJKSA-N 379.419 5.271 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 518259327 ITFSGLYRMRBBQO-QFBILLFUSA-N 397.519 5.459 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](Cc2ccccc2)C1 518684892 QGJMHRFLJFFADY-QUCCMNQESA-N 393.556 5.425 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1csc2ccccc12 518754148 FELNZJXRJDKXCA-AWEZNQCLSA-N 381.526 5.617 30 20 GKED C=CCOc1ccc(CNc2ccccc2CN(C)C(=O)c2cccs2)cc1 532742621 BZCPELFGZQRYCN-UHFFFAOYSA-N 392.524 5.197 30 20 GKED C[C@H](N[C@@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1)c1ccc(C#N)cc1 532906920 HIAIHSRABJZDSC-XGHQBKJUSA-N 382.479 5.057 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccccc3CCC(F)(F)F)c2C#N)C1 533970618 PGHZZKHXCJGQHQ-GFCCVEGCSA-N 392.446 5.492 30 20 GKED N#Cc1ccc2ncc(CNc3cccc(CSCc4ccccc4)c3)n2c1 536097523 BTTPFIUSBQYVMK-UHFFFAOYSA-N 384.508 5.251 30 20 GKED Cc1cc(C[C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)n(-c2ccccc2)n1 536840752 SOBWLJTWBYOPLO-GZSFQLOGSA-N 398.554 5.106 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)c1cc(C#N)ccc1Cl 552402122 POMNFHBQEICTER-UHFFFAOYSA-N 377.669 5.350 30 20 GKED N#CCc1ccc(C[S@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 559231947 SHCYHQPPMRFOLY-NVQXNPDNSA-N 379.912 5.444 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(Cl)cc2cccnc12)c1ccccc1 562410258 DRVMXIUKFOHOEH-GOSISDBHSA-N 378.863 5.445 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccn(C4CCCCC4)n3)n2)cc1 569660685 CKROAOVWDIPOKP-SFHVURJKSA-N 390.512 5.310 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)ccc1OC1CCCC1 570619057 JZEXPMOTCYBKEF-HXUWFJFHSA-N 386.451 5.055 30 20 GKED COc1cccc([C@@H](C)c2noc(-c3cn(CCCC#N)c4ccccc34)n2)c1 589111968 FMPZGEFOLKGWKH-MRXNPFEDSA-N 386.455 5.155 30 20 GKED CC[C@H](NC(=O)Nc1cccc(C#Cc2cccs2)c1)c1nc(C)cs1 591486855 SBBKUPBCALTLMH-SFHVURJKSA-N 381.526 5.186 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccccc1SC[C@@H](C)C#N)CCC2 593975094 LYWVJIFQJZTTBT-YJBOKZPZSA-N 380.513 5.006 30 20 GKED CN(C)Cc1ccc(-c2ccccc2CNCc2ccc(C3(C#N)CC3)cc2)cc1 594915431 ULHNLIFBTATIQX-UHFFFAOYSA-N 395.550 5.260 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(F)cc1 603533278 ZJIAVIVIPOAJQD-UHFFFAOYSA-N 390.433 5.311 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCCCC[C@H]2CC(C)C)cc1 607201932 GQJFRJGUQCOJTO-QFIPXVFZSA-N 397.563 5.323 30 20 GKED Cc1sc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)c(C#N)c1C 611184213 OMSYCHWQFGFAMF-UHFFFAOYSA-N 389.452 5.550 30 20 GKED Cc1cc(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)cc(C(F)(F)F)c1 617536064 JIGCOFWUXSTHDR-UHFFFAOYSA-N 398.388 5.043 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cccc(OCc2ccccn2)c1 619508195 LREOGYAACOYUMM-VWLOTQADSA-N 383.495 5.090 30 20 GKED C=CC[C@@H]1CCN(Cc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)C1 625702929 JWQLPNMCIQUQON-LJQANCHMSA-N 383.561 5.151 30 20 GKED O=C([C@@H]1CC[C@H]1c1ccc(F)cc1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 627664992 BLYXRIOSLMFRNQ-LJISPDSOSA-N 397.334 5.051 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2c(Cl)ccc3cccnc23)cc1 683723153 AOQOGGZVSGOWTQ-UHFFFAOYSA-N 391.902 5.315 30 20 GKED CC(C)c1occc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 684631292 NUIXDHVYEXDSAJ-LBPRGKRZSA-N 378.375 5.522 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 726319042 XBVAEKPCYLQLRM-GFCCVEGCSA-N 375.280 5.412 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nc4ccccc4o3)cc2Cl)c1 728052843 ONWHWBVWRNHMGP-UHFFFAOYSA-N 389.842 5.544 30 20 GKED CCc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)s1 728193615 UZUYXKVUPGHOJE-UHFFFAOYSA-N 380.444 5.153 30 20 GKED Cc1ccccc1CCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 729088341 BQPNZCOCKIHZQB-HNNXBMFYSA-N 382.435 5.206 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 731167097 KYUDDUPSXUPKNK-GOTSBHOMSA-N 391.474 5.079 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2scnc2Cl)c1 741969454 CDQMAQRKZIIABJ-UHFFFAOYSA-N 388.279 5.169 30 20 GKED C[C@H](NCc1cc(C#N)ccc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 743485157 WXZGBWHEMUURFI-JTQLQIEISA-N 390.302 5.586 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCc1ccc(OCC#N)cc1 743582831 JISHMKDKJPKLOG-LJQANCHMSA-N 399.494 5.159 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 755218817 AWCSDQKNRJZZMP-KXBFYZLASA-N 389.421 5.585 30 20 GKED COc1ccc(C(F)(F)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 755511927 ZCSCVPOZTZHWOL-OAQYLSRUSA-N 392.405 5.081 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1 764755023 LQNFDPAHDXJVFJ-DLBZAZTESA-N 398.934 5.578 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(CC)cc2)n1 767700723 HURRCOXNPGZSQB-OAHLLOKOSA-N 386.517 5.036 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(F)cc2C(F)(F)F)S1 771843366 ZAVCMHRIFHHKEX-OVCLIPMQSA-N 394.393 5.353 30 20 GKED N#C[C@H](C(=O)C1(F)CCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 773983619 ZSQDUOWHUOSNPZ-GFCCVEGCSA-N 383.275 5.575 30 20 GKED C=C(C)[C@H](NC(=S)Nc1cc(OC)ccc1Cl)c1ccc(F)c(F)c1 774206675 OJWGKWAGFZTGCV-KRWDZBQOSA-N 382.863 5.231 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3ccccc3)c(C#N)c2)cc1F 777476091 GMAWBAXTGHCKKB-UHFFFAOYSA-N 393.443 5.307 30 20 GKED CC(C)(C)n1cc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)nn1 790219151 HFPWCTFSMNPBBT-JLHYYAGUSA-N 398.919 5.023 30 20 GKED Cc1ncsc1/C=C\C(=O)c1ccc(Br)cc1C(F)(F)F 790234017 YEZRUVZRCUBKLQ-PLNGDYQASA-N 376.197 5.129 30 20 GKED O=C(/C=C/c1cnnn1Cc1ccccc1)c1cc2c(ccc3ccccc32)o1 792870741 SWAKJAFODCYYSO-VAWYXSNFSA-N 379.419 5.122 30 20 GKED Cc1nc(-c2ccccc2)sc1COC(=O)C[C@H](CC#N)c1ccccc1 795993077 SKNHCWCSHCKJGK-IBGZPJMESA-N 376.481 5.249 30 20 GKED CC(=O)N1C/C(=C/C(C)=C/c2ccccc2C(F)(F)F)C(=O)c2ccccc2C1 799892602 RHQNVSKAZYHQFC-DDQZDWCKSA-N 399.412 5.280 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 801911871 VECQAKVWSQKVIM-LBPRGKRZSA-N 398.875 5.398 30 20 GKED N#C[C@@H](C(=O)Cc1coc2ccc3ccccc3c12)c1cc(C(F)(F)F)ccn1 813218854 UCJQIWZQQYHNAA-QGZVFWFLSA-N 394.352 5.419 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1cccc(C(F)F)c1 902686705 KQFRJILCUFBBRZ-CYBMUJFWSA-N 376.428 5.036 30 20 GKED C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915085915 PYNIPJCOMOVJMT-OXJNMPFZSA-N 390.870 5.401 30 20 GKED N#CCn1c(CSc2ccc(C3CCCCC3)cc2)nc2ccccc2c1=O 915796531 HMZGEKCXURUJON-UHFFFAOYSA-N 389.524 5.260 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H](C)Oc1cc(C)ccc1C(C)C 916373496 GITXIBFQBVYLMP-AWEZNQCLSA-N 387.863 5.025 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc(Cl)cc3)n2)cc1 916627347 NRPAPNJLZLHBCS-QKIXSCASSA-N 378.884 5.662 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 916906130 RHNPBFBSFMLWNS-GHTZIAJQSA-N 398.462 5.320 30 20 GKED C[C@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917044100 PUKKVMVKBXNYBY-HZMBPMFUSA-N 391.279 5.247 30 20 GKED N#C[C@@H](C(=O)COc1ccc2ccccc2c1)c1nc2cc(Cl)ccc2s1 917047324 WVYTUIVLXGIGNW-KRWDZBQOSA-N 392.867 5.358 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(F)cc1C=NNc1ccc(C(=O)O)nc1 1776071866 WZCHJBHSJFZIJR-UHFFFAOYSA-N 399.809 5.119 30 20 GKED CCC(=NNc1ccc(F)c(Cl)c1)c1ccc(OCCCCC(=O)O)cc1 1776097792 CKLXXFGVTNLQDJ-UHFFFAOYSA-N 392.858 5.339 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1cc(Cl)cc(Cl)c1 1776179971 SZMLCPGPPRNOIT-KRWDZBQOSA-N 384.690 5.461 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Br)c(C)s1 1776784236 YNZGCJVZPNLKHS-ZDUSSCGKSA-N 376.360 5.112 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1nc(-c2cccc(OC)c2)cs1 1776784461 QAYGBXKNFWYQDH-KRWDZBQOSA-N 390.549 5.112 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1c(C)cc(C)cc1Cl 7325952 PIGDHJXVWBWZAF-UHFFFAOYSA-N 385.385 6.057 30 20 GKED CCN(Cc1ccc(OCc2cccs2)c(OC)c1)Cc1ccccc1C#N 16351544 GOTPYBGHUAMSIJ-UHFFFAOYSA-N 392.524 5.229 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1ccc(C(F)(F)F)cn1 41554760 OJXHBHSXDYHKLY-CYBMUJFWSA-N 390.748 5.504 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SCC(F)(F)F)c1ccc(C#N)cc1 43960369 VKSPVCOYYZNQTR-LBPRGKRZSA-N 379.407 5.095 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)(C)C)cc3)n2)cc1 60043687 KWIOTDPTEYCCGS-IBGZPJMESA-N 390.508 5.606 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 64935463 AFRJOGLNSOYFMS-UHFFFAOYSA-N 377.469 5.239 30 20 GKED C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 65745794 MVDHVNDQOUHBGT-CQSZACIVSA-N 394.377 5.035 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(F)(F)F)cc1 65852534 ICXJOWYIXZGOII-ROUUACIJSA-N 388.389 5.658 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCCCOc2ccc(C#N)cc2)cc1Cl 71983574 CBWZTBJBOOSVMA-UHFFFAOYSA-N 399.922 5.011 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(Br)c1 118980120 VARWDMYZHSGXFZ-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 152710030 XLKWNBITAKARPO-QHCPKHFHSA-N 389.474 5.016 30 20 GKED C[C@@H](CCC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 160576294 XEHSGHVBVUGMCT-OXJNMPFZSA-N 385.492 5.442 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)cs1 173915954 XIFHLBOELDNSNV-GOSISDBHSA-N 399.475 5.114 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(Cl)s1 175120220 BOQUHPZHOHYDDC-WCBMZHEXSA-N 381.309 5.645 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 175641011 HRZHQUJFIXODNV-GFCCVEGCSA-N 383.498 5.011 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(OC(C)C)cc2)ccc1OC 180811858 OPDZETWYPKYWGE-FXAWDEMLSA-N 382.504 5.014 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 185322246 AOCXERYBCGPDTR-VQIMIIECSA-N 379.529 5.307 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OC[C@@H]2CCCO2)c1 189908972 BQVLILVJEDMXIH-NRFANRHFSA-N 379.500 5.349 30 20 GKED N#Cc1ccc(CN(C(=O)c2ccc(C3SCCCS3)cc2)C2CC2)cc1 193052716 FCUBQUTUBRKPCW-UHFFFAOYSA-N 394.565 5.232 30 20 GKED OC(=Nc1cc(Cl)ccc1OC1CCCC1)c1coc(C2CCOCC2)n1 328786461 JDEGDJYUTYANRA-UHFFFAOYSA-N 390.867 5.180 30 20 GKED Cc1csc(Sc2c(Cl)cccc2N=C(O)[C@@H]2C[C@H]3CC[C@H]2O3)n1 329312640 CEHPEUOCXWPWLS-JTNHKYCSSA-N 380.922 5.412 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1sccc1OC(F)F 329489079 HIFXBRCOPKWNAQ-ZDUSSCGKSA-N 381.448 5.043 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CC(O)=N1 329875989 HHVDWNWJDWNYMK-ZLDLUXBVSA-N 387.480 5.038 30 20 GKED C[C@H](/N=C(/O)N[C@H]1CCCc2ccc(F)cc21)c1ccc2c(c1)CCC(O)=N2 329952380 IRUORCBTLFWPLF-RBZFPXEDSA-N 381.451 5.002 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2CCC(O)=Nc2ccc(C(=N)O)c(Cl)c2)C1 330322732 HCGACCKIPONTDZ-VBKZILBWSA-N 377.916 5.102 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1cnc(C(F)(F)F)s1 425365799 MVILMSVKUWDOEX-SNVBAGLBSA-N 393.356 5.095 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 431775929 LAGIMYYKTPDUAY-HNAYVOBHSA-N 387.430 5.083 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 432869571 XXNNWIJODVBQRN-MBSDFSHPSA-N 393.556 5.585 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)c1ccccc1 432965484 GRBSNZCQYJUAJI-SFHVURJKSA-N 375.394 5.348 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(OC2CCCC2)cc1 437861014 SUGPRFIZUQQAMX-DHIUTWEWSA-N 389.499 5.312 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438839519 FWSIGKJKVLOGFL-HNAYVOBHSA-N 389.421 5.453 30 20 GKED C=CCC[C@@H](NC(=O)c1cc2c(s1)CCOC2)c1ccc(C(F)(F)F)cc1 441580071 KMSWJUVNJXUVNW-MRXNPFEDSA-N 395.446 5.277 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3c(F)cc(C#N)cc3F)c2C#N)C1 445676702 RQBUVQGPYKAONT-GFCCVEGCSA-N 399.466 5.173 30 20 GKED CC[C@@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 447544662 VJLLJPYYUUNAOL-HSZRJFAPSA-N 375.516 5.318 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)o1 458794222 AOOKVLJYOQEVIZ-LEWJYISDSA-N 379.504 5.650 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3SCCc4ccccc43)cc2)cc1 463655669 NBBZUSSCLOUTAM-QFIPXVFZSA-N 386.476 5.320 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 463746674 OEGGJPKDPCWLEZ-AWEZNQCLSA-N 394.327 5.411 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 464712375 QBOYRXFBOVTNDB-KRWDZBQOSA-N 395.553 5.136 30 20 GKED COCC[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 467329497 BYTIMVKPJLGGKL-SFHVURJKSA-N 393.487 5.021 30 20 GKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 467708939 NHFZWPUSSJDBKI-OXQOHEQNSA-N 377.488 5.098 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc(-c2ccc(Cl)s2)nc1C 471163208 YLGWFULGIBXRIA-UHFFFAOYSA-N 381.954 5.378 30 20 GKED C=CCCCCCN(C)C(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1 473670344 KMKBDPDTDUWOBG-UHFFFAOYSA-N 375.900 5.191 30 20 GKED Cc1ccc([C@@H](NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)C2CC2)cc1 479078333 IHSIPPYFEOKFFG-HSZRJFAPSA-N 375.516 5.186 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1 479757722 JNAWTVPMCXJSRQ-IBGZPJMESA-N 398.551 5.100 30 20 GKED N#Cc1csc(/C=C(/CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c1 480333561 WKPASYFQMQSAQO-WMZJFQQLSA-N 394.399 5.264 30 20 GKED CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 480474738 DFNLMBCABQEPDB-KUHUBIRLSA-N 385.895 5.039 30 20 GKED C[C@H]1N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOC1(C)C 483057972 YXCPLGZFPYBURJ-DNVCBOLYSA-N 397.906 5.027 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(Br)c1)c1nccc2ccccc12 483234874 SEDRVHIXXPATOW-CQSZACIVSA-N 385.648 5.141 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc3nc(-c4ccccc4)oc3c2)n1 483713765 SOHJJVZWGABGCP-MRXNPFEDSA-N 387.464 5.565 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCCCC(=O)C1 486265362 DOHNAQMWBDWOJS-FQEVSTJZSA-N 392.474 5.079 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccccc1 487544226 QTGNGNFRXRLMFP-LJQANCHMSA-N 388.492 5.472 30 20 GKED C=CCC[C@@H](C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 489749943 IJDSZVQDQMNVMI-HUUCEWRRSA-N 382.451 5.479 30 20 GKED N#CC1(CCCN[C@H](Cc2ccc(Cl)cc2)C2CCCCC2)CCOCC1 499609912 IGSAYBLRYOSUIF-JOCHJYFZSA-N 388.983 5.522 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccc(-c4ncco4)cc3)c2)cc1 500394657 JFGFGTNUSZNFFR-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1nc(C(=O)N(Cc2ccc(-c3ccc(F)cc3)s2)C(C)C)ccc1C#N 500961098 SREILTRBYKZQFR-UHFFFAOYSA-N 393.487 5.180 30 20 GKED CC1(C#N)CCN(C(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)CC1 507826464 PMCNQFBVSFDCAU-UHFFFAOYSA-N 387.508 5.243 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@H]3CCC[C@H]3c3ccccc3C(F)(F)F)CC2)c1 509992879 QRODNVUKXPSKFC-ICSRJNTNSA-N 398.428 5.061 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cccc(-c4ncco4)c3)c2)cc1 513964615 LHGPDKYVQKDNDS-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3sc4c(c3C#N)CCCCCC4)cc2)CC1 515449192 PWVSIQDTBUZSML-UHFFFAOYSA-N 392.528 5.117 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)n(C(C)(C)C)n1 517346777 ZXJSRQSXKUFERC-UHFFFAOYSA-N 392.434 5.002 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cc2c1 518318853 TYKQGXYPYLMWSE-UHFFFAOYSA-N 395.462 5.374 30 20 GKED Cc1cccc(N(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1 522640790 YSENEBQUZDCDDH-UHFFFAOYSA-N 376.843 5.589 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)c2ccc(C#N)cn2)c2cccs2)cc1 522677809 WUXMAJJALPUIQG-QVKFZJNVSA-N 375.497 5.048 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 524572668 LRDDPMRSCDFKOK-GFCCVEGCSA-N 392.267 5.013 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 535436883 MVBIQVPUSVRWJM-SJLPKXTDSA-N 378.447 5.033 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(OCC(F)(F)F)cc2)c(C#N)s1 538074088 VOUKLKWAIHJOFH-UHFFFAOYSA-N 382.407 5.111 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)C(=O)Nc1ncc(Cl)cc1Cl 538947483 DJPZPFOHFRGGSM-MRVPVSSYSA-N 386.691 5.033 30 20 GKED Cc1ccccc1NC(=O)C[C@H](C)NCc1ccc(-c2ccccc2C#N)cc1 540314587 QLFOFYMDWVXBHL-IBGZPJMESA-N 383.495 5.041 30 20 GKED C=CCC[C@H](NCc1ccc(OC)c(OC)c1Br)c1ccccc1 540456855 PDLLKFBQNMDWFX-KRWDZBQOSA-N 390.321 5.263 30 20 GKED N#Cc1ccc(C(=O)N2CCC(c3ccccc3C(F)(F)F)CC2)cc1Cl 548286842 SVUDFHQNWBONRD-UHFFFAOYSA-N 392.808 5.250 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 551204926 HLOOHOLDJKFCMB-GCJKJVERSA-N 389.568 6.128 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN1CC(C)(C)[C@@H]1c1cccs1 558175803 JUXFMBRNAZHDQG-YWZLYKJASA-N 399.585 5.021 30 20 GKED CC(C)c1nc([C@H]2CCCCCN2Cc2ccc(C#N)cc2C(F)(F)F)no1 558575355 SOLPPBJRSUDDQP-QGZVFWFLSA-N 392.425 5.201 30 20 GKED CC(C)(C)[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 559503043 FVXXCVRZMJXZRL-GOSISDBHSA-N 389.421 5.680 30 20 GKED N#Cc1ccc2ncc(CN[C@@H](c3ccccc3)[C@H]3CCCc4ccccc43)n2c1 560259627 ZIQWRJMBKWIATC-AHWVRZQESA-N 392.506 5.157 30 20 GKED C[C@@H](NC(=O)C1CCC(OC(F)F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 560623648 XVNZBUONBJZDQO-BSFYPJFYSA-N 398.453 5.200 30 20 GKED COc1ccc([C@H](CCC#N)NC[C@@H](Cc2ccccc2)C(F)(F)F)cc1 563654500 DXDVSIGAVVTCPD-QUCCMNQESA-N 376.422 5.051 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCCc1c[nH]c2ccccc12 569021481 CYPUWKFPBNIHIK-UHFFFAOYSA-N 393.490 5.596 30 20 GKED C[C@@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccc(C#N)c1 569462241 KNSCLTGZYOGUSV-QVKFZJNVSA-N 388.433 5.396 30 20 GKED CC(C)c1noc2ncc(C(=O)N(Cc3ccccc3)c3ccccc3C#N)cc12 574229419 SLKDPMCYOMBENW-UHFFFAOYSA-N 396.450 5.065 30 20 GKED N#CCCC[C@H](NCc1ccc(Oc2ccccc2F)c(F)c1)c1ccccc1 590068625 HBEKWCUVPIJDAU-QFIPXVFZSA-N 392.449 6.282 30 20 GKED C[C@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 594942421 IFXNBJUKVIXXBU-AFMDSPMNSA-N 398.506 5.244 30 20 GKED CC(C)(NC(=O)Nc1ccccc1CCC(F)(F)F)c1cccc(C#N)c1 596789711 FQGDXRHCFSELMF-UHFFFAOYSA-N 375.394 5.110 30 20 GKED Cc1c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)oc2c(F)cccc12 602229935 KXAWLBUKLXUXFX-UHFFFAOYSA-N 391.427 5.052 30 20 GKED N#Cc1c(F)ccc([C@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)c1Cl 602761548 SYYGRVIFTMMXJL-NRFANRHFSA-N 391.833 5.117 30 20 GKED C=CC[C@@H](C)NC(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 604902550 JTZVUNCNDQROCF-GFCCVEGCSA-N 383.542 5.154 30 20 GKED CCOc1ccc(-c2nc(C(=O)Nc3sc(C)c(CC)c3C#N)cs2)cc1 609032562 OWFCBQAJRMGUQN-UHFFFAOYSA-N 397.525 5.265 30 20 GKED N#Cc1ccc(NCc2ccc(Oc3cccnc3)c(F)c2)c(C(F)(F)F)c1 609213606 BDFYCUYUSHHWQT-UHFFFAOYSA-N 387.336 5.516 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2ccccc2F)c2ccc(F)cc2)cc1 609230494 JBJYBEKRNDPQCG-UHFFFAOYSA-N 376.406 5.002 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)N[C@H](C#N)c3cccc(C(F)(F)F)c3)oc12 609460632 HDXIZRSDNQHDOV-MRXNPFEDSA-N 386.373 5.372 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccc(F)c(F)c3)no2)c2ccccc21 609476039 YWLDMYVDVGDANU-VQHVLOKHSA-N 376.366 5.054 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N(CC3CC3)C3CCCCC3)cn2)c1 609554163 UBHSSMINZMYLHA-UHFFFAOYSA-N 390.487 5.322 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccsc1 609968254 RMWVYVYPSXMWIF-AUUYWEPGSA-N 380.900 5.799 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1O[C@H](C)c1ccccc1)c1cccc(C#N)c1 610325063 MADWSNWXDJSYPI-QZTJIDSGSA-N 385.467 5.581 30 20 GKED C[C@H](NC(=O)Nc1ccnc(Oc2ccccc2Cl)c1)c1cccc(C#N)c1 610328735 PVMJGRIZYCRULB-AWEZNQCLSA-N 392.846 5.282 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)cc1O 613031974 VFSWLUXZCCEUBK-UHFFFAOYSA-N 392.842 5.579 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1Cl 619754573 DNZMAFFPDSAGDK-GOSISDBHSA-N 397.906 5.641 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)NCc1ccc(C#N)c(Cl)c1 619789297 LHYPZLDEJQKSLU-UHFFFAOYSA-N 385.895 5.157 30 20 GKED O=C(Nc1cc(F)ccc1Cl)NC(CCC(F)(F)F)CCC(F)(F)F 665965095 DQTSREBCDBBVGQ-UHFFFAOYSA-N 394.718 5.654 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cnc3c(c2)c(C)nn3C)cc1 727781831 YBSVZQZPGJVNFT-MDWZMJQESA-N 397.478 5.060 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3c(Cl)nc(Cl)n3C)s2)cc1 728440797 VGZHRHXNWLTKTL-CMDGGOBGSA-N 392.311 5.363 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1ccc(F)cc1Cl 730551819 CSXIIDMGWYZGNY-UHFFFAOYSA-N 382.748 5.277 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3c[nH]c4ccc(OC)cc34)cs2)cc1 734306584 HARVTQTWMHWYAK-YHYXMXQVSA-N 390.464 5.205 30 20 GKED CCOc1cccc(C=Nc2cccc(C[S@@](=O)C3CCCCC3)c2)c1O 734979209 MCGDITUQVUJNCM-HHHXNRCGSA-N 385.529 5.123 30 20 GKED CSCC[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 736958964 BMKNKHYPJVCDMT-RDTXWAMCSA-N 387.936 5.259 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1[N+](=O)[O-] 741842718 MQJKVTGAZZHAGW-KRXBUXKQSA-N 397.374 5.154 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 743199017 QHUOKYOCCKFFEA-ZDUSSCGKSA-N 394.368 5.081 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 744034755 LEIMNVJDFWVQNI-SJKOYZFVSA-N 384.863 5.583 30 20 GKED Cc1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 744037620 ASNZTVHMQVBTPW-CMPLNLGQSA-N 378.375 5.197 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C/SCc3ccco3)cc2)c1 754230972 UMLRFRMXVZYDQE-ZRDIBKRKSA-N 376.437 5.329 30 20 GKED CCOc1cc(C=NOc2ccccc2C(F)(F)F)ccc1OC(F)F 754712416 NWUJRWIIFORVMC-UHFFFAOYSA-N 375.293 5.118 30 20 GKED C[C@H](Cc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 756518062 SRNHITHJPKQJKR-RDTXWAMCSA-N 380.900 5.519 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3cccc(Cl)c3Cl)o2)cc1C 758410939 OVCHCLGUYJYNKF-ZDUSSCGKSA-N 390.270 5.772 30 20 GKED N#C[C@@H](C(=O)[C@H]1CC12CCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 759833644 JUBBSAKKEOGRCG-QWHCGFSZSA-N 377.296 5.483 30 20 GKED Cn1cc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)c(-c2ccncc2)n1 760264860 NJOPYPHOJROKQI-FLIBITNWSA-N 390.295 5.063 30 20 GKED N#C[C@@H](C(=O)CC1CCSCC1)c1nc2cc(C(F)(F)F)ccc2s1 762067438 GOTZNXSGBUOVTM-LBPRGKRZSA-N 384.448 5.025 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)NCc3ccc(C(F)F)cc3)c2)s1 765270491 LCUABUVUDBVYDC-UHFFFAOYSA-N 397.450 5.224 30 20 GKED N#C[C@H](C(=O)[C@H](c1ccccc1)C1CC1)c1nc(-c2c(F)cccc2F)cs1 765932473 ZDEYACHMNBQNPH-DNVCBOLYSA-N 394.446 5.458 30 20 GKED CCn1c(CNc2ccc(OCc3cccc(C#N)c3)cc2)nc2ccccc21 779594310 FJKMAGACWBGOCS-UHFFFAOYSA-N 382.467 5.119 30 20 GKED C[C@H](NC(=S)Nc1ccccc1F)c1ccc(-c2cccc(C#N)c2)cc1 782205003 NSSXQSRRAPVLGS-HNNXBMFYSA-N 375.472 5.412 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cccc(CC(C)C)c2)ccc1OC 796827394 UACURMQZHCTLTJ-GCJKJVERSA-N 380.532 5.425 30 20 GKED O=C1/C(=C\c2cc(C(F)(F)F)ccc2Cl)C[C@H](C(=O)O)c2ccccc21 806561976 FIZTUCZTXMXKNC-QARUFBMTSA-N 380.749 5.197 30 20 GKED CC(F)(F)C(C)(C)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835072288 CTDYYBILIMZKKY-VIFPVBQESA-N 376.350 5.173 30 20 GKED C=CCC[C@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 901689884 JHJYXOIRJZSRAC-IBGZPJMESA-N 377.843 5.089 30 20 GKED C[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CC2)cc1 914557508 HQBGMELNGHNDNZ-ZOCVZFIWSA-N 377.271 5.228 30 20 GKED COc1ccccc1-c1cc(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)no1 914872689 LMKYZTXSXVIEFX-UHFFFAOYSA-N 396.402 5.108 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2Br)cc1 915086031 GVVDTPNLGLHXNV-IBGZPJMESA-N 391.268 5.357 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915088159 HIMUIBQHTVBFTJ-QFIPXVFZSA-N 393.446 5.558 30 20 GKED CCOc1ccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915124279 CBHVAEIVCHOCDN-QFIPXVFZSA-N 387.508 5.550 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2ccccc2)C2CC2)cc1 915352748 KAEXNOGPZKUZCU-DNQXCXABSA-N 381.479 5.615 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Cl 917026199 AKVSTVYSWSYKKB-WMLDXEAASA-N 396.899 5.416 30 20 GKED CCO[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 920324808 VDSRAGDTJNYRGB-GHTZIAJQSA-N 376.481 5.073 30 20 GKED O=C(O)c1ccc2scc(C=NNc3ccc(F)cc3C(F)(F)F)c2c1 1776110750 QZFUPZDJSBAZBS-UHFFFAOYSA-N 382.338 5.203 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(F)ccc1N(C)C[C@@H](C)CC 1776782907 LUHIJZOSUBCWJD-GHTZIAJQSA-N 394.575 5.601 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(Cl)c1C(F)(F)F 1776784131 YYNUTXUEZBPUAG-AWEZNQCLSA-N 379.850 5.652 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CCCCCCC)CC(=O)O)cc1 1776786594 ZDXUDSWGRNWGTA-JOCHJYFZSA-N 391.596 6.329 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2ccc([C@H](C)C(=O)O)cc2)cc1 1776787519 LGZBFECUWMVAKD-KRWDZBQOSA-N 399.556 6.190 30 20 GKED Cc1c(/C=C2/Cc3c(ccc(Cl)c3Cl)C2=O)nc2ccccc2c1C(=O)O 1777414197 LGYILKQDZFICKO-LUAWRHEFSA-N 398.245 5.371 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccccc2)c2ccc(OC)cc2)cc1OC 22790468 OMLAVSVTJMJPGM-RUZDIDTESA-N 389.495 5.148 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 29779975 PSDRVJITUIZLFG-OAHLLOKOSA-N 399.475 5.241 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(-c4ccccc4)on3)c2)c1 32289735 MKTJJEMVFBDJSX-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)oc2c(F)cccc12 41558306 ZHIXNYKNTABUDZ-GFCCVEGCSA-N 383.329 5.115 30 20 GKED CCOc1cccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 54812290 PCXDHGJFLUOBGV-AWEZNQCLSA-N 390.386 5.204 30 20 GKED C=CCOc1cccc(NC(=O)c2cnn(-c3ccc(C)cc3)c2C(C)C)c1 65749634 YGAOVINAIAHTFG-UHFFFAOYSA-N 375.472 5.121 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)s1 66956028 SPDHXFLIAFMQIJ-TZMCWYRMSA-N 388.562 5.379 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)n1 67785652 KVOYYJAAWLFOTF-LLVKDONJSA-N 394.308 5.372 30 20 GKED CCOc1ncccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 107647272 APPQRFDXKPMRJR-IBGZPJMESA-N 391.858 5.041 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1sccc1SC(F)F 108239394 CKZSIOCKQJXXDG-SNVBAGLBSA-N 384.498 5.567 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 108408461 ZGPQWKGDYOFPBG-FUHWJXTLSA-N 395.572 5.809 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 112128259 JBXCXHLPBADEGH-CVEARBPZSA-N 377.579 5.078 30 20 GKED C=CCc1ccc(OCC(=O)Nc2ccccc2SC(F)(F)F)c(OC)c1 117139923 YZTUNNLDJCRLPJ-UHFFFAOYSA-N 397.418 5.053 30 20 GKED N#CCC[C@@H](NC(=O)CCC(=O)c1csc2ccccc12)c1ccccc1 153432177 HCIOSBILIVRGCZ-LJQANCHMSA-N 376.481 5.025 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(-c2nnc(CC)o2)cc1)c1ccccc1 155945548 YRLWPCOFSOMBNI-IBGZPJMESA-N 376.460 5.128 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(CSc2cccc(C#N)c2)cs1 158667281 DWRQVOIJWCHUKX-UHFFFAOYSA-N 399.928 5.645 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 176890940 GNQFSSRYSLDNEC-CQSZACIVSA-N 398.359 5.130 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1cccc(C(F)(F)F)c1F 177054240 XDYFXMBGNQIVAQ-UHFFFAOYSA-N 380.263 5.071 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Oc2cccc(Cl)c2Cl)n1 177773141 MWCNMRAKSZVNTK-QWRGUYRKSA-N 383.300 5.217 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(F)cc2Cl)ccc1OC 180814609 FFQUZNJXEDIQMM-CJNGLKHVSA-N 376.859 5.019 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 182341903 PBJBLKBTBGERLU-RHSMWYFYSA-N 399.491 5.255 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 184633771 AOQHEOAFKHQREP-HXOBKFHXSA-N 398.466 5.361 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)cc1C(F)(F)F 185738906 OOLUXNQGRWSJEX-LLVKDONJSA-N 398.837 6.005 30 20 GKED C=C[C@H](CC(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1)c1ccccc1 187003929 QFKIDZMOHDDTKW-MRXNPFEDSA-N 391.496 5.067 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1F 192170668 JKVORRCZLLAXJM-HNNXBMFYSA-N 376.275 5.109 30 20 GKED COc1ccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2ccc(F)cc2)cc1 237362189 DZULLNZCZCZIHK-BXKMTCNYSA-N 390.458 5.004 30 20 GKED COc1ccc(-c2nn(-c3ccccc3)cc2CNc2ccc(CC#N)cc2)cc1 237407663 DSIDVZPXSNBXOO-UHFFFAOYSA-N 394.478 5.226 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](c2ccc(F)cc2)C[C@H]1C 247084385 ZPLMVHKFKAHUAZ-NUJGCVRESA-N 397.519 5.487 30 20 GKED Cc1cccc(-c2nc3cc(F)ccc3n2C(C)C)c1NC(=O)CCCC#N 291520582 PHWYSEBGVVHLCS-UHFFFAOYSA-N 378.451 5.364 30 20 GKED CC(=O)c1ccc(C#N)c(NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)c1 302102961 LYKUSKLXUBNBNA-UHFFFAOYSA-N 398.466 5.325 30 20 GKED CC1(C)C(O)=Nc2cc(/C(O)=N/[C@@H]3CCO[C@@H]3c3ccc(Cl)cc3)ccc21 328939137 DOWXAXLOXVQKRY-SJLPKXTDSA-N 384.863 5.054 30 20 GKED OC1=N[C@@H](C/C(O)=N/C2(c3ccc(Br)cc3)CCCC2)CCC1 329325382 IOZLSHANBTWDHV-OAHLLOKOSA-N 379.298 5.074 30 20 GKED OC(=Nc1cccc(CSC2CCCC2)c1)N1CCC[C@@H](c2ncc[nH]2)C1 329443309 BVXGTOMXPIBECJ-QGZVFWFLSA-N 384.549 5.011 30 20 GKED OC1=Nc2cc(N=C(O)N3C[C@H](c4ccccc4)[C@@H]4CCCC[C@H]43)ccc2CC1 330147931 UJMFDJZSAYXHPO-TUNNFDKTSA-N 389.499 5.425 30 20 GKED CC(C)c1ccc(NC(=O)N2CCC(C#N)(c3ccccn3)CC2)c(C(C)C)c1 376740386 UJXAFGOMIPHHTB-UHFFFAOYSA-N 390.531 5.418 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 429050678 UPNPKAMFUKBAEQ-UHFFFAOYSA-N 394.862 5.162 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)Nc3cccc(C#N)c3C)cc2)cs1 431701854 IQSVKSVQCVFBFH-CQSZACIVSA-N 376.485 5.181 30 20 GKED Cc1c(C#N)cccc1NC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 431834023 QEDWHNPLNPCRIQ-UHFFFAOYSA-N 389.402 5.067 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H](CC)CC#N 432318149 PTGWCVLAVKQWLL-NSHDSACASA-N 380.275 5.023 30 20 GKED N#CCCn1cc(CNc2cccc(Oc3ccccc3)c2)c(-c2ccncc2)n1 433332509 WMQNFTKULSMQRX-UHFFFAOYSA-N 395.466 5.263 30 20 GKED CCCCn1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1C 435359445 SXDFCGIPPXGSAQ-UHFFFAOYSA-N 392.434 5.047 30 20 GKED CCC(CC)(C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 440635323 CZJZPQUGWSFJTJ-UHFFFAOYSA-N 390.527 5.122 30 20 GKED C[C@@H]1COCC[C@H]1c1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 442686189 VBGDUNPCGVTWOQ-FZKQIMNGSA-N 395.846 5.194 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)CS[C@@H](C)c1cccc(C#N)c1 443135282 CGYUECDVUUUBDA-OXJNMPFZSA-N 382.529 5.019 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@@H](C)Cc1ccsc1 444280343 JARNVWCLAKGDQV-KRWDZBQOSA-N 379.529 5.100 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 455512335 JSJTZQQWMJFCJF-ZIAGYGMSSA-N 392.446 5.856 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)c1 455923834 VACMPGWZJBSNAW-LJQANCHMSA-N 387.405 5.531 30 20 GKED Cc1cc(-c2csc(NC(=O)CCCC#N)n2)c(C)n1CCc1ccccc1 461795606 LYGLYVACQWJLDF-UHFFFAOYSA-N 392.528 5.104 30 20 GKED C=C(C)C[C@H](C)C(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)cs1 466545127 MKHUTHPCLALXHK-QWHCGFSZSA-N 393.350 5.352 30 20 GKED C[C@@H](N(Cc1ccccc1)C(=O)Nc1ncccc1OCCCC#N)C(C)(C)C 466623490 RFEAFFWPTLRDCR-GOSISDBHSA-N 394.519 5.233 30 20 GKED Cc1ccc(-c2nc(NC(=O)C3(c4cccc(C#N)c4)CC3)sc2C)s1 467252228 XKQZAZGTPKVVPK-UHFFFAOYSA-N 379.510 5.030 30 20 GKED C=CCC[C@@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccc(C(F)(F)F)cc1 469182363 QIUPFUXWVFNJRZ-FOIQADDNSA-N 379.470 6.149 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccc(C)cc1)c1ccccn1 470133947 OJARNILDKDLUQI-VWLOTQADSA-N 399.538 6.153 30 20 GKED C=CCCC1(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CC1 477136452 KCSIMXCQONMCRO-UHFFFAOYSA-N 378.259 5.261 30 20 GKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1c2ccccc2-c2ccccc21 477765394 IMKIDQIOCYYYTB-UHFFFAOYSA-N 381.479 5.721 30 20 GKED COc1ccc(-c2ccncc2)cc1CN1CCC[C@@H]1[C@H](C#N)c1ccccc1 481997971 JXFRMVUTBQMHKM-DNQXCXABSA-N 383.495 5.029 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(OC(C)C)c1 483203308 VJDUSHKKXSHJPP-NRFANRHFSA-N 388.467 5.301 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1ccc(C#N)s1 487235165 UKQPLOAZBATVHG-SNVBAGLBSA-N 387.917 5.196 30 20 GKED CC(C)[C@H]1CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c2ccccc21 487259269 SSRXYMWOEWACSU-OAQYLSRUSA-N 383.451 5.146 30 20 GKED Cc1ccoc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 494595209 LRYAIELGQWTNEE-GOSISDBHSA-N 379.847 5.219 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccccc1Cl 499951502 DTBCAUYHDOHMQS-ZENOOKHLSA-N 379.674 5.131 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)cc1Br 509852750 RHXQDTGWAOIFPX-ZDUSSCGKSA-N 377.307 5.136 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2cccs2)cc1Cl 510024318 UQMXQXVKUFSNBR-IBGZPJMESA-N 395.915 5.421 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1cnn(-c2ccccc2)c1 511129026 CZOQKTJJMUHOTN-UHFFFAOYSA-N 398.491 5.044 30 20 GKED N#CC1CCC(CNC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 512480186 MBQJRLXIYHHGAW-UHFFFAOYSA-N 376.378 5.025 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2CCc3ccccc3C2)cc1 514641277 TYVMLPMAUMBRLT-QFIPXVFZSA-N 398.531 5.138 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)o1 518221893 SHNJJJDPQLDITA-UHFFFAOYSA-N 379.391 5.055 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 518256993 VURBVCXKZDZGLC-PKOBYXMFSA-N 381.545 5.642 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 520704516 PYMKJJRHVLEWCD-VXKWHMMOSA-N 384.435 5.101 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1ccc(C(C)(C)C)cc1 521731243 OQYKGBHBLKKTHK-DLBZAZTESA-N 395.572 5.675 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F 522537815 LACUHIMWDAJHGI-HUUCEWRRSA-N 380.419 5.307 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](C)c1ccc(C#N)cc1 523205070 KUZLKVBCCQKUBS-CQSZACIVSA-N 390.314 5.546 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc(-c3ccccn3)s2)cc1 524245278 STBJUDZGTXZAFZ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccccc2o1)c1ccc(OCc2ccccc2)cc1 524337498 NHLIZJXAPCPFIM-OAQYLSRUSA-N 382.419 5.006 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCc2ccccc21 524441350 CQAJTAGEANWIFE-UHFFFAOYSA-N 383.451 5.040 30 20 GKED N#Cc1ccsc1C(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 524627686 BPNRBRGODJULMQ-KQZSUJQPSA-N 393.537 5.034 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12 531309745 UMVQAOVISAEHNW-UHFFFAOYSA-N 386.411 5.039 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3Oc3cc(F)cc(F)c3)cc2)CC1 538568299 MKRIFYPIDOWDBG-UHFFFAOYSA-N 390.389 5.565 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H](c3ccccc3)[C@H]3CCOC3)c2)c1 540068877 VHKXMKGGELNXSH-AZGAKELHSA-N 398.506 5.005 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnc(Cc3ccc(F)cc3)s2)c(C#N)s1 540274208 ICAMUYQZHMTKKA-UHFFFAOYSA-N 399.516 5.356 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CC1 541971680 LBQDGCUBQKGVLZ-UHFFFAOYSA-N 385.920 5.649 30 20 GKED CCSCc1ccc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 564522441 XQWDOEGPNBZLNQ-UHFFFAOYSA-N 389.480 5.251 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@H](C)C3)c1C1CC1 569553164 BCVMPNGZJQYZCQ-STQMWFEESA-N 382.533 5.042 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 573573850 QPEXDEUKRVSEIA-QGPMSJSTSA-N 383.492 5.145 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1 577909296 JHUTXGVTAUMQHP-IBGZPJMESA-N 388.483 5.244 30 20 GKED C=CCc1cc(CNc2ccccc2O[C@H](C)C(F)(F)F)cc(OC)c1O 579996547 BKKKEPJEWCHUSQ-CYBMUJFWSA-N 381.394 5.071 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 586783730 MNMUFJCMWBGJAY-UWVGGRQHSA-N 390.274 5.219 30 20 GKED N#CCCC[C@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 590068608 GGAFFSHAVQJRHB-SANMLTNESA-N 393.534 6.214 30 20 GKED N#C[C@@H](C(=O)c1coc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 603627475 VSZIOCFIDKFMMI-LBPRGKRZSA-N 386.354 5.551 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3C3CCCCC3)cn2)c1 603829177 MBAJGZVHJYDJBH-NRFANRHFSA-N 390.487 5.322 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)sc2c1CCC2 609033384 KSZAPXVZHPCZAS-NEPJUHHUSA-N 377.296 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-n2cccc2)c(F)c1 609382660 LJEIKEIAVSQBAB-HNNXBMFYSA-N 379.460 5.120 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2-c2cccs2)c1 609497980 BVWXZYZWLKNQCW-UHFFFAOYSA-N 376.481 5.475 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609985532 DRVDBIXVFORKGI-UHFFFAOYSA-N 396.494 5.463 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@H]1F 611503327 WMKGXHZVTIEXSH-LXGCGDOSSA-N 385.870 5.207 30 20 GKED C[C@@H](NCc1ccnc(C#N)c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 616863964 DZNFZIFVFISMLB-CYBMUJFWSA-N 387.430 5.551 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618848331 UFWNEUDBUMDNKK-BUXKBTBVSA-N 388.298 5.255 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)c(C(F)(F)F)c1 622477829 MSEBVNDXMFOFIX-CQSZACIVSA-N 397.265 5.407 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccc(F)c(F)c3)cc2)cc1 732757083 QQHAGXLXYXSYPG-UHFFFAOYSA-N 392.405 5.626 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(Cl)cc1 733080153 QPHJJUHBAJPYFU-UHFFFAOYSA-N 391.784 5.047 30 20 GKED C=CC[C@H](NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1ccncc1 734235627 KZTAKGJICOESDM-PFWMLDTASA-N 380.797 5.201 30 20 GKED O=C(/C=C\c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)c1cnccn1 734751248 KLGPGNVRZUQBOT-YWEYNIOJSA-N 385.250 5.259 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(C(C)(C)C)s2)ccc1SC(F)F 736434850 XDQFYRVQROHDNB-SREVYHEPSA-N 383.485 5.660 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1ccc(F)cc1F 740764198 NVNYQVGVSPHVCR-MDZDMXLPSA-N 386.829 5.376 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1 741470780 VPWNCQYNNCLPMT-HJWRWDBZSA-N 381.435 5.043 30 20 GKED CCCCOc1ccc(C=NOCc2cc(C)nc3ccccc23)cc1OC 742351867 GTQFHCMCKBHYLH-UHFFFAOYSA-N 378.472 5.281 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2ccccc2S[C@H](C)CC#N)c1 742997348 HHUXLIKUGFAYSF-GFCCVEGCSA-N 391.949 5.552 30 20 GKED C[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743094613 AMMBGYVTYNPBFI-MHECFPHRSA-N 381.479 5.321 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc(Cl)c1O 745990850 ZGPHXRJVMZOZSS-BAQGIRSFSA-N 379.843 5.402 30 20 GKED CCCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)[C@H](C)c1ccccc1 746146376 ASRGODFNMNJGJK-WIYYLYMNSA-N 398.510 5.087 30 20 GKED CC(C)(C)OC(=O)NC1CCC(=NOCc2ccc(C(F)(F)F)cc2)CC1 746578018 YGGPOWOOJQVIPZ-UHFFFAOYSA-N 386.414 5.045 30 20 GKED CCOCc1cc(/C=C/C(=O)c2ccc(F)c(Br)c2)ccc1OC 747612550 FTWOQMQRZDXFQO-XBXARRHUSA-N 393.252 5.029 30 20 GKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 755219978 NEAQYJYZXXOAKA-AOVJHHBVSA-N 395.506 5.909 30 20 GKED N#Cc1cc(NC(=O)C2CCC(c3ccccc3)CC2)c(Cl)c([N+](=O)[O-])c1 764304565 ZVIOCXDEIQREGZ-UHFFFAOYSA-N 383.835 5.032 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 766619276 VABLKOQVCBRFPB-BXUZGUMPSA-N 385.286 5.039 30 20 GKED CCN(c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1)C(C)C 770112316 VWLWHGRJOIEHAE-QGZVFWFLSA-N 396.441 5.156 30 20 GKED C=C(C)[C@@H](NC(=O)c1ccc(C(F)(F)F)nc1Cl)c1ccc(F)c(F)c1 774546466 UZPPFCXOIIWCBO-CQSZACIVSA-N 390.739 5.079 30 20 GKED O[C@@H](CN[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1 775191980 NPQROLLAIBWIBX-CVEARBPZSA-N 395.318 5.161 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(C)o2)C2CCCC2)ccc1OC 775631706 KUWDISUXXZWWFC-WMZHIEFXSA-N 382.504 5.299 30 20 GKED CC(C)(C#N)CCOC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 776398091 FYDORRYAUXLUKQ-UHFFFAOYSA-N 379.243 5.277 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)cn1 792858749 LCQXSIUGTWDKDU-TWGQIWQCSA-N 385.250 5.355 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 800387900 WPTUYSFFRQIMCK-OCCSQVGLSA-N 380.847 5.465 30 20 GKED Cc1nn(C)c(Cl)c1/C=C\C(=O)c1ccc2ccccc2c1OC(F)F 812488679 FEMSKVUEGLCZBE-KTKRTIGZSA-N 376.790 5.033 30 20 GKED C[C@@H](CCCCNC(=O)OC(C)(C)C)NC1CCC(C#N)(c2ccccc2)CC1 813874203 GCDRADNNWSULQX-RNQSCQIESA-N 399.579 5.064 30 20 GKED N#CC[C@@H](CC(=O)OCC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 816477401 YEAAKBXNTFITRL-RBUKOAKNSA-N 375.390 5.353 30 20 GKED O=[N+]([O-])c1cccc([C@H](NCc2ccc(C(F)(F)F)cc2)C(F)(F)F)c1F 839649923 ITNOHQTVCRZPIJ-AWEZNQCLSA-N 396.262 5.146 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842940499 BGWMYZVAIXDREE-MGPQQGTHSA-N 377.296 5.307 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 917119858 YNYJQPSFNOTFRO-QFIPXVFZSA-N 392.462 5.293 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)ccc1Cl 1776033715 WLCFPRIIVXAMPT-GFCCVEGCSA-N 397.689 6.081 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1 1776149325 GXIIIYSFJVXWBM-INIZCTEOSA-N 377.843 5.089 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776308752 LJTFZUMYJXWCMN-KMBIYUNPSA-N 396.486 6.000 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C[C@H](C)c2ccccc2)C(=O)O)cc1 1776786330 AHZBCMWBONMZBB-GBXCKJPGSA-N 397.559 5.772 30 20 GKED CCCCCCCOc1ccc(CNc2cc(C(=O)O)c3ccccc3c2)cc1 1776789099 QSMSUVICPMTZDN-UHFFFAOYSA-N 391.511 6.499 30 20 GKED CN(Cc1cccs1)c1ccc(/C=C\C(=O)c2csc(C(=O)O)c2)cc1 1777077176 AJRRXDYCAQJNFU-TWGQIWQCSA-N 383.494 5.040 30 20 GKED COc1cc2ccc(C(=O)/C=C\c3cc(C(=O)O)c(C)cc3C)cc2cc1OC 1777339043 UUADORDMRYYLDE-FPLPWBNLSA-N 390.435 5.068 30 20 GKED COc1ccc2c(c1F)C/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1777373696 RZSSSUPIPRXBQW-UVTDQMKNSA-N 394.423 5.083 30 20 GKED Cc1cc2c(s1)C/C(=C/c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777428025 DNGPOLAOOQJUJX-NVMNQCDNSA-N 390.460 5.156 30 20 GKED Cc1ccc(-c2ncc(/C=C3/CCCc4cc(C(=O)O)ccc4C3=O)s2)cc1 1777431427 HZAWCFFWWBYDSU-ATVHPVEESA-N 389.476 5.419 30 20 GKED C[C@@H](OC(=O)c1ccccc1-c1ccccc1C#N)c1nnc(-c2ccccc2)o1 5354062 MMBFLOONWWIUHT-MRXNPFEDSA-N 395.418 5.193 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1ccc(F)cc1F 7712597 NCMGGUYBTOOFLY-MDZDMXLPSA-N 386.829 5.376 30 20 GKED N#CCc1ccc(NC(=O)CNc2ccccc2Oc2ccccc2Cl)cc1 28662172 KAYOPPXRZCEVSN-UHFFFAOYSA-N 391.858 5.249 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c2ccccc2n1 49723886 JRINXUNBTONKKT-UHFFFAOYSA-N 394.434 5.163 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCc1ncc(-c2ccccc2)o1 54671814 QXYPGGVTWOFVIT-UHFFFAOYSA-N 386.904 5.204 30 20 GKED Cc1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c(C)s1 55823759 CUBSOBBQQJOYGN-UHFFFAOYSA-N 376.481 5.262 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(N(C(C)=O)c2ccc(F)cc2)n1 58907323 OOIABPVEIUJVHO-UHFFFAOYSA-N 395.503 5.155 30 20 GKED COc1cc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cc(OC)c1 60241333 HLTUEWHHPNXPSM-MHWRWJLKSA-N 377.465 5.040 30 20 GKED Cc1ccc(-c2noc([C@H](C)Nc3cc(C#N)ccc3OC(C)C)n2)cc1F 63640716 YNQLJSJVXZGBHC-AWEZNQCLSA-N 380.423 5.016 30 20 GKED O=S(=O)(/C=C/c1ccccc1)/N=C(\O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 70030744 RHDKMCFYBDIIEI-MATWNZDUSA-N 396.295 5.054 30 20 GKED Cc1cc(-c2noc([C@H](C)Nc3cccc(OCCCC#N)c3)n2)ccc1F 120596094 WOKOLIIEFGPLPA-HNNXBMFYSA-N 380.423 5.040 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1scnc1C1CC1 123533403 DQPVQTGPGHLVOE-UHFFFAOYSA-N 389.480 5.032 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 123693334 ZLOLXGJJPUXVOX-CABCVRRESA-N 399.564 5.081 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N(CCC#N)Cc1ccco1 152864251 VEESUGICSICBIG-UHFFFAOYSA-N 390.281 5.113 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OC(F)(F)F)c1 153625252 FNSSVFONMNJMPY-GFCCVEGCSA-N 380.391 5.232 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Cl)c(F)c3)n2)cc1 162081906 AADZYERUYHWWOX-CQSZACIVSA-N 386.835 5.101 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(Br)c1 179063151 ULYTWNRPTKTMJX-ZDUSSCGKSA-N 389.318 5.262 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1 188085993 VICAPBYLFJRKSF-CQSZACIVSA-N 379.344 5.080 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccnc3C(F)(F)F)cc2)cc1 188364016 LOSPFKZQSXZIEB-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccc1Br 189909814 QDUBYUHOXGZBMU-UHFFFAOYSA-N 392.724 6.207 30 20 GKED N#CCCCOc1cccc(NCc2ccc(Br)c(Cl)c2)c1 318694393 OSSGCUWBYARDJR-UHFFFAOYSA-N 379.685 5.397 30 20 GKED O=C1CC[C@H](C(O)=Nc2ccc3nc(N4CCCC4)sc3c2)c2ccccc21 328826368 SDYLSMYUYNLXLP-KRWDZBQOSA-N 391.496 5.245 30 20 GKED CCCn1ccc2cc(NC(=O)c3cnn(CCC#N)c3-c3ccccc3)ccc21 428913722 WCSMISSGPFHYGU-UHFFFAOYSA-N 397.482 5.081 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nc3ccccc3c(=O)n2CCC2=CCCCC2)C1 430103851 HHNYTLMWKPQSPG-QZTJIDSGSA-N 379.529 5.071 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 432008179 UCJHEKFWZBOENE-GOSISDBHSA-N 393.874 5.668 30 20 GKED Cc1cncc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 432008713 WSCWSJPHHSZPAQ-NRFANRHFSA-N 389.886 5.270 30 20 GKED CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 436348618 AHPAURMOHFQIDQ-ZAAXVRCTSA-N 395.528 5.015 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)o2)cc1 436364613 OKKRQSUTMFTWGJ-YADHBBJMSA-N 398.462 5.061 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCS1 437784947 ZNVLTLLBCXCYHE-IEBWSBKVSA-N 399.947 5.355 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)Nc1cccc(CC(F)(F)F)c1 438073177 KJUNRVKMNURPMA-UHFFFAOYSA-N 395.384 5.230 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)N[C@@H](CCC#N)c1ccccc1 438860369 QHBCKZRSZZXMSD-CVDCTZTESA-N 375.516 5.604 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC[C@@H](C)c1ccccc1 441338621 TUKCUFAKPDFXLS-QGZVFWFLSA-N 385.467 5.576 30 20 GKED C=CCOCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 443811664 RRXCDXOSWJPPMK-UHFFFAOYSA-N 395.528 5.092 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](C)(c2ccccc2)C1 447057097 BVCPHRXDVGXNKE-VGOFRKELSA-N 379.529 5.276 30 20 GKED C[C@@H](c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1)C(F)(F)F 453780847 QBMSXRJVUODFLM-SMDDNHRTSA-N 380.435 5.596 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2cc(F)ccc2F)c2ccccc2Cl)c1 460555866 UDJGURQGOSNVMI-NRFANRHFSA-N 396.824 5.204 30 20 GKED COc1cccc(F)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 462114507 WMLBALDXNYHJEG-QGZVFWFLSA-N 394.833 5.395 30 20 GKED C[C@H](C(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 464272916 PQJPXBHJQRBQBX-YVEFUNNKSA-N 380.797 5.077 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)NCc1cc(C#N)ccc1F 466202121 ZKMQRMPNZAPVAG-UHFFFAOYSA-N 391.471 5.479 30 20 GKED CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 469701177 DNHDZNYFEMFXIS-UYAOXDASSA-N 395.572 5.813 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccc(OC)cc1)C1CC1 475545554 FCGQTHOJNZEFAP-QFIPXVFZSA-N 378.516 5.820 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(-c2nccc(C)n2)cc1 480595239 YUWGZLACIQYKRF-UHFFFAOYSA-N 398.919 5.387 30 20 GKED C=CCN(C(=O)c1ccc(Oc2ccccc2)o1)c1nc2c(s1)CCCC2 482555162 HCNPICNPQKRPSC-UHFFFAOYSA-N 380.469 5.240 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 484895406 SKLWZZFFDJTFOT-DEOSSOPVSA-N 398.462 5.336 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(Br)ccc1Cl)c1ccccc1 487373308 PEHTYLNHSPJYNS-QGZVFWFLSA-N 391.696 5.267 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc(Cl)ccc3Cl)s2)cc1 487447987 SQBDQLAHNQBCQD-UHFFFAOYSA-N 388.279 5.165 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(Br)cc1 489140587 QQMVBPINKLELLZ-ZIAGYGMSSA-N 375.335 5.874 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)c12 504899163 BNKYDZDPVMYNMC-UHFFFAOYSA-N 395.462 5.108 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)CC1 506606359 ARBIUIOECIXTIO-UHFFFAOYSA-N 394.475 5.260 30 20 GKED CCOC(=O)c1ccc(C#N)c(SCc2nc3ccccc3c3ccccc23)n1 514351712 WKGCQRJKSNNYGM-UHFFFAOYSA-N 399.475 5.124 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cc2c(s1)CCCC2 520940575 XZPLPZIDMOQHNY-CQSZACIVSA-N 385.558 5.343 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccccc1SCCC#N 521717532 ZQTAEVSIYBAZGJ-INIZCTEOSA-N 382.529 5.396 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3c3ccsc3)cc2)cc1 521962546 IBJSWWRFZIFWJR-JOCHJYFZSA-N 388.492 5.584 30 20 GKED CC(C)c1ccc(CN(C)C(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1 524381432 CHPWSOXDAQRUEK-UHFFFAOYSA-N 388.467 5.126 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1c(F)cccc1F 524565325 PODCDNBAQNYBQA-STQMWFEESA-N 375.444 5.099 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1CNc1ccc(C#N)cc1C(F)(F)F 524601691 ZZVVNHULYQWVIG-UHFFFAOYSA-N 384.405 5.051 30 20 GKED CC[C@H]1CCCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 524828676 NZGYKDZHEGDLKD-NRFANRHFSA-N 391.515 5.632 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 525006069 DABZERVNYXJBSP-DLBZAZTESA-N 396.462 5.411 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc3sc(N4CCCC4)nc3s2)cc1 527230517 OCKYGOATSGFMKR-UHFFFAOYSA-N 396.541 5.011 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCO[C@H]2c2ccc(Cl)cc2)CC1 537096707 IPORTWDPMMIDGT-JSPDHQCPSA-N 380.919 5.164 30 20 GKED CC(C)C[C@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 537517669 RBCSZQCYMJVRMQ-UGKGYDQZSA-N 393.487 5.066 30 20 GKED C[S@@](=O)c1ccc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 538821204 YIYDWQCOLTTWFE-AREMUKBSSA-N 399.331 5.213 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3ncc(C)o3)n2)o1 539997399 RPMJWEOREMDBLB-LLVKDONJSA-N 393.390 5.690 30 20 GKED Cc1cccc(NC(=O)CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C 542946769 YEPDYFGZYYZMCY-IBGZPJMESA-N 383.495 5.131 30 20 GKED CC(C)(c1ccc(Cl)cc1)c1noc(-c2cnc(C(F)(F)F)c(C#N)c2)n1 556339811 IGGMXOYGIBMUGP-UHFFFAOYSA-N 392.768 5.001 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ncc(-c4cccnc4)s3)c2)cc1 557384756 HIMGLEFSILQFLV-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2cc(F)c(C(F)(F)F)cc2F)cc1 558278648 TVABBXWLDXGXKA-UHFFFAOYSA-N 397.347 5.106 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC=C(c4ccccc4)C3)cc2)ccn1 564760703 JRCODLGHPAZZPD-UHFFFAOYSA-N 396.450 5.067 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@H](C)CC3)c1C1CC1 575637010 YKSDAAGFNJVBDH-CHWSQXEVSA-N 382.533 5.042 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)[C@]3(C#N)CC34CCCC4)s2)cc1 581766357 NUMDJZFQHUXSRW-OPAMFIHVSA-N 379.529 5.078 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C(C)C)cc1 583398243 IHHKAQHKXIRAEG-KKSFZXQISA-N 397.544 5.608 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)c1 586789371 XIQBWDMOOWFIFT-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccsc1CN(C(=O)CCCCCC#N)c1ccc(F)c(Cl)c1 588827666 KJUNTHDKTGLJNF-UHFFFAOYSA-N 378.900 5.856 30 20 GKED Cc1ccc(CN(CC2CC2)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cn1 592229391 SDKZXLPALVKEGV-INIZCTEOSA-N 394.544 5.086 30 20 GKED N#C[C@@H](C(=O)c1ncoc1-c1ccccc1Cl)c1nc2cc(F)ccc2s1 608553105 SFFHQEGQPMQVNX-LBPRGKRZSA-N 397.818 5.234 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1ccc(C(F)F)cc1 608804224 UBXDWELEVNKRJD-UHFFFAOYSA-N 394.396 5.790 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1F 608915192 IFZJYWPNWBESBV-UHFFFAOYSA-N 387.458 5.807 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1 609428568 PXMXHZVLEUEOOT-KRWDZBQOSA-N 388.492 6.125 30 20 GKED CCc1cccc2c(CC(=O)Nc3sc4c(c3C#N)CCCCC4)c[nH]c12 609452502 DFYJYPMEIFNUFG-UHFFFAOYSA-N 377.513 5.114 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)c2ccc(C#N)nc2)c2cccs2)cc1 609641393 XDCMQCIVHAWQFX-BTYIYWSLSA-N 375.497 5.048 30 20 GKED N#Cc1ccc(NC(=O)c2sc3cc(F)ccc3c2Cl)cc1C(F)(F)F 610388531 HHXXQMIHDCGVEG-UHFFFAOYSA-N 398.768 5.837 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1ccc(Br)cc1 615621723 GOUZQFOZSYLZNY-CQSZACIVSA-N 391.284 5.047 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@]1(c1c[nH]c2ccccc12)C(F)(F)F 622981040 QYTUALSURDKVNI-FQEVSTJZSA-N 376.422 5.316 30 20 GKED C=CCn1c(SCC(=O)c2sccc2Br)nc2ccccc21 643091061 VXUMCXWWOUDJSE-UHFFFAOYSA-N 393.331 5.021 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 662087900 OUOZHRRTTULVEM-BGYRXZFFSA-N 381.545 5.128 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)C1(C(F)(F)F)CCCC1 666820793 CJCJOXTYKXZRRR-IUCAKERBSA-N 399.297 5.135 30 20 GKED CC(C)Cc1ccc([C@H](NC(=O)Nc2cccc(OCC#N)c2)C2CC2)cc1 726074720 YABSURYGEJCEKI-QFIPXVFZSA-N 377.488 5.060 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CCCC1)c1nc2cc(F)ccc2s1 730417081 KKFAEHSEIJZKMI-INIZCTEOSA-N 382.435 5.263 30 20 GKED CC(C)COc1ccc(C2(C(=O)[C@@H](C#N)c3nc4ccccc4o3)CCC2)cc1 731767827 MJYZMCXHCHSMGA-LJQANCHMSA-N 388.467 5.161 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1cccc(OCc2ccccc2)c1 734094350 CJRBMLUTOPUHED-CCEZHUSRSA-N 394.474 5.407 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cc(Cl)cs3)n2)cc1 737323531 TWQONVKZQYFQQV-INIZCTEOSA-N 386.929 5.643 30 20 GKED CC[C@H](C)Oc1cc(/C=C/C(=O)c2c(Cl)nc3ccccn23)ccc1OC 737445618 CAVFNUDXIHLYPW-PLWJUESGSA-N 384.863 5.070 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC[C@H](c2nc3ccccc3s2)C1 738297713 AAQHNKWGZGUONA-HNNXBMFYSA-N 397.931 5.232 30 20 GKED Cc1cc(C)cc(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 741058625 GTJCEFQWSNPXMT-XMMPIXPASA-N 383.495 5.323 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 742537422 JRTRVKMOAOXTJP-DNVCBOLYSA-N 391.496 5.148 30 20 GKED Cc1ccc([C@@H](C)C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)o1 742658715 CCCZTZJMFRWQSJ-QGZVFWFLSA-N 376.431 5.244 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=S)Nc3ccccc3C#N)c2)C1 745036299 YPTWPFGQFRQYNL-JXFKEZNVSA-N 379.529 5.462 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N(C)C(C)C)c(F)c1 746665477 ZZDRCBYKZKJCMZ-UHFFFAOYSA-N 396.510 5.232 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)NC12CC3CC(CC(C3)C1)C2 750980063 GPODEYIDJLRCQG-UHFFFAOYSA-N 381.010 5.233 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2ccccc2)cc1 751015835 YDYGIKDPDUAERA-UHFFFAOYSA-N 375.453 5.168 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(C#N)s2)cc1OCc1ccccc1 762442946 NAOXUUOSFPSURB-JXMROGBWSA-N 375.449 5.103 30 20 GKED CC(=NNc1ncnc2ccsc12)c1sc(-c2ccc(C)cc2)nc1C 764842126 WSCPQXSXEHGOSL-UHFFFAOYSA-N 379.514 5.268 30 20 GKED COc1cc(/C=C(\C(=O)OCCCCC(C)(C)C#N)c2ccccc2)ccc1O 768597450 KKOYUMGGUWNDIN-HKWRFOASSA-N 393.483 5.205 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(SCC(F)(F)F)cc2)cc1C#N 773072621 ASCNHNVAZDLIQN-CYBMUJFWSA-N 380.435 5.072 30 20 GKED CCC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776154900 CPHJFSXQWXBDQA-QRWLVFNGSA-N 376.422 5.800 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCc2c(Br)cccc21 782890848 UJOUUADSSBOQSR-RAXLEYEMSA-N 397.297 5.180 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1ccc(N)cc1Cl 782907755 VIOMFWINIGENMO-UHFFFAOYSA-N 384.814 5.387 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(C4CC4)cnc3Cl)cc2)cc1 793215978 ZOTQDFUITKTKDU-UHFFFAOYSA-N 389.842 5.529 30 20 GKED Cc1nc(COC(=O)C[C@@H](CC#N)c2ccccc2)oc1-c1ccc(Cl)cc1 795988673 BRTNGDKIYRCSOI-GOSISDBHSA-N 394.858 5.434 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C(C3CCC3)C3CCC3)n2)cc1 796886522 BDISGJUERWFMKF-GOSISDBHSA-N 380.513 5.211 30 20 GKED CC(C)(COCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 800387060 PWHMFMKAKGPXFI-MRXNPFEDSA-N 398.915 5.369 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801894818 BKVUKUFXAUUIKU-KRWDZBQOSA-N 379.353 5.261 30 20 GKED C[C@@H]1C[C@@H](CN[C@@H](CCCC#N)c2ccccc2)CCN1C(=O)OC(C)(C)C 824434980 VLOGRZKVNWLPNP-DYXWJJEUSA-N 385.552 5.047 30 20 GKED CC(C)=CCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842682361 WVFISDBJAWCWHY-GDBMZVCRSA-N 397.544 5.225 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1)C(=O)O 900069341 YFUOYNJNZKZHCP-SFHVURJKSA-N 377.843 5.171 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3cnco3)cc2)cc1 917515090 FOUYUHXNXMLDQW-QFIPXVFZSA-N 379.419 5.249 30 20 GKED C[C@@H](Cc1ccco1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 918052728 LWBAGBRXEXWXPY-AWEZNQCLSA-N 395.846 5.350 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cccc(Oc2ccccc2)c1 920106106 RJWVBWRBIJDBMV-OAQYLSRUSA-N 394.430 5.474 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1)c1nc(-c2c(F)cccc2F)cs1 920807102 XXEWSMUNTMJIMD-HNNXBMFYSA-N 382.435 5.287 30 20 GKED O=C(O)c1ccc(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1F 1776074815 WFLOXCYUXVZWNF-CQSZACIVSA-N 380.341 5.278 30 20 GKED COc1ccc2c(c1Cl)C(=O)/C(=C/c1csc3ccc(C(=O)O)cc13)CC2 1777373590 JAPZXHGHQNMVME-XYOKQWHBSA-N 398.867 5.474 30 20 GKED O=C(O)c1ccc2scc(/C=C3\Cc4ccc(Br)cc4C3=O)c2c1 1777685543 LDIUVSLCBVJSBQ-WUXMJOGZSA-N 399.265 5.184 30 20 GKED Cc1cccc(-n2c3ccccc3c3cc(B4OC(C)(C)C(C)(C)O4)ccc32)c1 1857795717 GXLCXERAVQIIMQ-UHFFFAOYSA-N 383.300 5.391 30 20 GKED N#CCCn1cc(-c2csc(NCc3ccc(F)cc3)n2)c2ccccc21 7321767 WPMXBADWDKJFKB-UHFFFAOYSA-N 376.460 5.430 30 20 GKED N#C[C@H](C(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccc2ccccc2n1 47375517 NTRDYMKKVIGXCJ-SFHVURJKSA-N 397.459 5.039 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1C 66161068 CMAQMOICGNNKLW-UHFFFAOYSA-N 392.503 5.048 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CNc1cccc(C(F)(F)F)c1 66931911 WQWUPYYFJIPNHC-ZDUSSCGKSA-N 393.434 5.150 30 20 GKED N#Cc1ccc(CSCC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1 108286995 JDQFFHFDBABQIR-QFIPXVFZSA-N 389.524 5.027 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)s1 108529242 CERRWPSHFISOSY-GXTWGEPZSA-N 388.562 5.237 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)N[C@@H](CCC#N)c3ccccc3)c(C)c2c1 132807395 GPVNHXRYIPEHIX-JXFKEZNVSA-N 391.471 5.155 30 20 GKED CC(C)[C@@H]1CCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 155756743 BTKIMDQHTUEXJR-QHCPKHFHSA-N 391.515 5.374 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)ccc1NC(=O)CC(C)C 172996052 AVVXNDPVNOKMTQ-UHFFFAOYSA-N 395.528 5.238 30 20 GKED CCO[C@H](C)c1nc(CSCc2cc(C#N)ccc2Br)cs1 191607475 ZKOYFVZOJLIUAN-LLVKDONJSA-N 397.363 5.308 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 193568596 IGOVLSRKSFHPEG-UHFFFAOYSA-N 375.394 5.170 30 20 GKED N#C[C@H](C(=O)c1cc(Br)cs1)c1nc2cc(Cl)ccc2s1 194590579 IIRAXBVPIUJHHZ-SECBINFHSA-N 397.706 5.264 30 20 GKED COc1ccc(-c2ccc(CNCc3cccc(OCCCC#N)c3)s2)cc1 237434703 KQUCILSZWKNSBM-UHFFFAOYSA-N 392.524 5.396 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303317226 HCPXRPWTZBCXOX-UHFFFAOYSA-N 386.451 5.319 30 20 GKED N#CCC[C@H](NC(=O)NCc1ccc(COc2ccccc2)cc1)c1ccccc1 429071594 PZNKABORBKOONP-DEOSSOPVSA-N 399.494 5.110 30 20 GKED N#CCSc1cccc(C(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)c1 429823072 TUUVWRPRFQTDLK-UHFFFAOYSA-N 394.446 5.100 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)C1 430096143 DKAKOIOQJLOTKV-DYVFJYSZSA-N 384.892 5.024 30 20 GKED C[C@@H](NC(=O)NC[C@H]1CCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 430897206 KHNLKOFLVCWQFX-WBVHZDCISA-N 383.442 5.021 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)c1ccccc1SCc1ccc(C#N)cc1 432626868 NCGKKHMCDCSJMU-KRWDZBQOSA-N 376.525 5.255 30 20 GKED COc1ccc(OC(C)C)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 433172277 DMEINLJZGJJVNX-LJQANCHMSA-N 381.476 5.039 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 437273001 ZLTGGWSWDOTMAY-YJBOKZPZSA-N 392.808 5.271 30 20 GKED CC1(C)[C@H]2CN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)c(Cl)c3)C[C@H]21 437900543 ZSJSYBLCKAOSRF-CALCHBBNSA-N 381.863 5.124 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 438494690 UCMJINVKYFYOTL-PXNSSMCTSA-N 397.906 5.431 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C 438667237 KBXAJKJCJXGAFU-WSOZGMELSA-N 395.528 5.013 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2c(F)cc(F)cc2F)cc1 443922097 VTOQDYUHPHORGV-UHFFFAOYSA-N 386.304 5.159 30 20 GKED O=C(N(CCC(F)(F)F)CC1CC1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 444227964 SFRSKISLOPUIJC-UHFFFAOYSA-N 397.334 5.067 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2cccc(-c3ccc4ccccc4c3)n2)c(F)c1 446167140 ZJGCWURELKCMAO-UHFFFAOYSA-N 385.373 5.304 30 20 GKED C=CCn1c([C@H]2CCCCO2)nnc1N1CCCC[C@@H]1c1ccc(Cl)cc1 453433359 CYEHJAVIVATUAE-RTBURBONSA-N 386.927 5.091 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CCS1 455939768 HGFSDXSBTDXWLP-HNNXBMFYSA-N 383.542 5.069 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CCC(C(F)F)CC2)cc1 455945303 NXNNXGOLWWMICE-UHFFFAOYSA-N 387.455 5.218 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C2CC2)o1 458809100 ZVYIQMZPOLTUIM-WTNAPCKOSA-N 391.515 5.512 30 20 GKED C=C(C)Cn1c(-c2ncccc2C)nnc1N1CCC[C@@H]1c1cccc(Cl)c1 460584737 OLEYHJJWUZFKSG-LJQANCHMSA-N 393.922 5.220 30 20 GKED CCCN(C(=O)c1cccc(C#N)c1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 461532251 GFBSGAUCSZYJQH-QHCPKHFHSA-N 387.458 5.043 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 464935879 AOSCOUGLWXBCEU-IRXDYDNUSA-N 393.537 5.092 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)CC)ccc1Cl 471189931 AUIYFHQCUXLTAI-UHFFFAOYSA-N 385.895 5.299 30 20 GKED CCCc1ccc(-c2ccc(NC(=O)N(CCC#N)Cc3ccccn3)cc2)cc1 473810355 OPOPFDQGRRPRQR-UHFFFAOYSA-N 398.510 5.649 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 473850113 MTCSCNDSKYZLKT-ICSRJNTNSA-N 379.529 5.491 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3[nH]ccc3s2)cc1 475014779 FUUVVTLYUFEKQM-UHFFFAOYSA-N 387.464 5.127 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476343944 ZQHATLSVBKZSSL-TZIWHRDSSA-N 375.516 5.400 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)s1 477838625 SBZDYITXDQFTJX-OAHLLOKOSA-N 389.505 5.527 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(Cc3cncs3)no2)cc1Cl 482778101 JLXOYDQVJAVFNV-UHFFFAOYSA-N 394.843 5.101 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccc2ncsc2c1 486875041 SLNLFNMJIRCCMA-GFCCVEGCSA-N 391.949 5.470 30 20 GKED C=CC[C@H](C(=O)N(C)Cc1ccc(OC(F)F)c(OCC)c1)c1ccccc1 488621111 CIVAVMRNVIKDCB-SFHVURJKSA-N 389.442 5.005 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1sccc1Br 488772305 YWWVLVKAFAEWCA-UHFFFAOYSA-N 379.226 5.088 30 20 GKED N#Cc1ccc(CN(C(=O)CCc2ccc(-c3ccccc3F)o2)C2CC2)cc1 499321012 WRMCSOQRYAXLCH-UHFFFAOYSA-N 388.442 5.081 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1cccc(F)c1F 500245640 WWNDGXQMCQQUJA-MRXNPFEDSA-N 378.422 5.266 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC=C(c3ccccc3)C2)cc1 501537205 BVAZKIGWFUOVQN-UHFFFAOYSA-N 396.515 5.390 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1Cl 503552379 WNGNZMMEBKBWFK-HNNXBMFYSA-N 387.291 5.915 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N2CCC(C)(C#N)CC2)cc1 506301853 PYWMAMHWLTVKFG-UHFFFAOYSA-N 399.878 5.298 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc(C#N)ccc1Cl 506353846 AHOQCOUIKSSEJD-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1Oc1ccncc1)c1ccc(Cl)c(Cl)c1 509272886 XQNBRVQVZDWEIK-GOSISDBHSA-N 398.249 5.175 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)ccc1OC1CCCC1 512662175 VYZYRKWIPINQFY-HZPDHXFCSA-N 382.479 5.439 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 517578575 PSQIGPOPXWMYCP-SFHVURJKSA-N 391.540 5.577 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(-c2ccccc2)[nH]1 518395139 DJFZERXMMDPTMP-UHFFFAOYSA-N 394.434 5.301 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C(C)C)cc1 521260903 KAQNUJLLZOPWCU-IERDGZPVSA-N 397.544 5.466 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1ccccc1SCCC#N 521716885 RKFFIQXCCGDXTB-UHFFFAOYSA-N 397.500 5.516 30 20 GKED N#CCCN(CC1CC1)C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 531519795 XDLXEVKFZFMVBU-UHFFFAOYSA-N 386.826 5.339 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1nccs1 534155216 ZTRDTRIIJLEBFZ-MRXNPFEDSA-N 397.887 5.342 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CSCC(F)(F)F)c1 534171113 MRHOAZVVFJPLJO-UHFFFAOYSA-N 398.837 5.040 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4nc(C)ccc4c3)n2)cc1 534691862 OZLWZQOHFHCQDW-IBGZPJMESA-N 383.476 5.465 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccc2ncccc12 535535366 MLMODRSMUUVVFQ-UHFFFAOYSA-N 393.446 5.370 30 20 GKED CCOCc1ccc(-c2noc(/C=C\c3cn(CCC#N)c4ccccc34)n2)cc1 545634797 ANBUEVFFHCGOID-SEYXRHQNSA-N 398.466 5.312 30 20 GKED CC(C)[C@](C)(Cc1ccc(Cl)cc1)NCc1nnc(-c2cccc(C#N)c2)o1 550367908 HTCQEXCHFUPRJO-QFIPXVFZSA-N 394.906 5.009 30 20 GKED N#Cc1cccc(C2(NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2)c1 551230146 MIOLODTXOASOJG-UHFFFAOYSA-N 384.323 5.375 30 20 GKED COCC[C@H](NC(=O)c1cc(C#N)ccc1Cl)c1ccc(Cl)c(Cl)c1 552397991 DASCMNDOMTWICK-KRWDZBQOSA-N 397.689 5.026 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccccc1-c1nc2ccccc2s1 554105161 MFUQRWJYTINMFD-UHFFFAOYSA-N 378.501 5.415 30 20 GKED CC(C)(C)[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 559503044 FVXXCVRZMJXZRL-SFHVURJKSA-N 389.421 5.680 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCCCN1Cc1ccc(C#N)cc1C(F)(F)F 573497107 WXGIGMOSTQPAJV-GOSISDBHSA-N 376.426 5.034 30 20 GKED CC(C)CN(C(=O)Nc1ccc(CC#N)cc1Cl)[C@@H]1CCCc2cccnc21 574494996 YYGQBHFXUYEGRX-HXUWFJFHSA-N 396.922 5.369 30 20 GKED N#Cc1cc(Br)ccc1CNc1cccc(Oc2ccccn2)c1 579037258 WBXNLWMPCRXLSK-UHFFFAOYSA-N 380.245 5.120 30 20 GKED C[C@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)o1 589541927 VNHYZTNRGZCUNQ-YCRPNKLZSA-N 387.439 5.033 30 20 GKED N#CCCC1CCN(Cc2csc(-c3cccc(Br)c3)n2)CC1 592135826 YRTGWRVIHFSXHG-UHFFFAOYSA-N 390.350 5.088 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 592974700 XJXYKGNRMGTTEM-LJQANCHMSA-N 397.434 5.464 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1F)CC1CC1 596734322 OZASLLBVXQFMGS-MRXNPFEDSA-N 397.519 5.522 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)C1 598417049 XSROJCWFRNLQIN-QFIPXVFZSA-N 394.471 5.240 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccn1)C1CCC1 599736157 BKASSJYHNUVNRK-QRWLVFNGSA-N 380.517 5.139 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(F)cc1Cl 603470501 KKUQYECXZYVZBN-UHFFFAOYSA-N 382.847 5.754 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc3ccc(F)cc3s2)cc1 604249186 NDFAQTOGYQLNEA-UHFFFAOYSA-N 392.377 5.117 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4occc4s3)n2)cc1 606144819 DHVSBXOUNPQFSO-CYBMUJFWSA-N 380.450 5.116 30 20 GKED CCc1c(C)sc(NC(=O)c2cccc(OCc3csc(C)n3)c2)c1C#N 609033217 VOOWVYDWWISBII-UHFFFAOYSA-N 397.525 5.087 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3cc4ccccc4o3)c2)cc1 609209648 GSARIEUDAFGSND-UHFFFAOYSA-N 383.407 5.418 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC2CCCC2)cc1 609427492 DSGMXPAFRVPCKY-MRXNPFEDSA-N 380.513 5.655 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cccc2ccccc12 609435178 WLIQJZLZTAZZJY-QGZVFWFLSA-N 389.524 5.898 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)Cc1ccc(Cl)cc1 609928098 LSPRBMFVNLLQDQ-OAHLLOKOSA-N 385.895 5.094 30 20 GKED N#Cc1ccc(NCc2ccnc(OCc3ccccc3)c2)c(C(F)(F)F)c1 609964624 NLGABRCZHMKGBF-UHFFFAOYSA-N 383.373 5.163 30 20 GKED COc1ccc(CNCC2(c3cccs3)CCCCC2)cc1OCCCC#N 610089963 HPIKMSLQRDSIJS-UHFFFAOYSA-N 398.572 5.431 30 20 GKED Fc1cc(F)c2c(c1)[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CC2 677129555 MRFXWVIXIYSOEF-KOSWAMCASA-N 387.314 5.451 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3nccc4ccccc34)sc2c1 682995295 SIYWLUQQNFQEBK-INIZCTEOSA-N 376.868 5.901 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 727595656 WIHOXUJZHUDNHK-UHFFFAOYSA-N 393.556 5.954 30 20 GKED COC(=O)c1ccc(/C=C\C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)o1 727654484 NARHZJHWABUEHE-CLFYSBASSA-N 387.844 5.048 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2nc3ccc(Cl)cc3o2)cc1 728701829 WMUOHARAUUABGF-CQSZACIVSA-N 399.903 5.217 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(Cl)c1Cl 731195863 PBHSFHJFMOCBDA-VIFPVBQESA-N 380.083 5.356 30 20 GKED Cc1cc(F)ccc1C(=O)/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1 731320893 BQSSCIKMURSFQD-FMIVXFBMSA-N 393.845 5.936 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2sccc2-c2ccc(C)cc2)c1 733773259 WZHPNRSSZXCQAK-LJQANCHMSA-N 390.508 5.335 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1ccc(Cl)c(Cl)c1Cl 734096469 NDVJHJNFDBPFCY-CMDGGOBGSA-N 391.685 5.788 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccncc1 734661017 DFXXTYWUBIGYCX-QUCCMNQESA-N 397.931 5.503 30 20 GKED CC(C)[C@@H]1CN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)CCS1 742909252 ZXHYIMNJQUTTQD-NRFANRHFSA-N 396.581 5.064 30 20 GKED C=CCn1c(C2CC2)nn(CN(Cc2ccc3ccccc3c2)C2CC2)c1=S 746708235 SOCBSFREEMVVCT-UHFFFAOYSA-N 390.556 5.253 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)s1 747198167 UJLZKOITRLFZCP-GFCCVEGCSA-N 387.555 5.179 30 20 GKED C[C@H](OC(=O)CCc1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 751655694 GSCKHWFFFAZHNM-AWEZNQCLSA-N 380.831 5.104 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3csc(C=O)c3)cc2Cl)cc1 754994651 VCGKIWCTWWAJOZ-UHFFFAOYSA-N 382.828 5.130 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc3c2N(C(=O)OC(C)(C)C)CC3)c(F)c1 757528119 APKJRBUVZGZJFB-DHZHZOJOSA-N 397.446 5.028 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3sccc3c2)cc1 761035918 IACAFDVGJJRNJP-KUHUBIRLSA-N 376.481 5.376 30 20 GKED Cc1nn2c(C=NNc3c(Cl)cc(F)cc3Cl)c(C(C)C)nc2s1 767911803 ZOUOAMTUWKNZLO-UHFFFAOYSA-N 386.283 5.115 30 20 GKED CCC(CC)n1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 776301220 REFGJUXZJITTCD-JOCHJYFZSA-N 386.499 5.460 30 20 GKED CCNc1ccc(C#N)cc1NCc1ncc(-c2ccccc2Br)o1 776848711 FJBLEOFYXSFKDP-UHFFFAOYSA-N 397.276 5.020 30 20 GKED O=C1/C(=C/c2nc(-c3ccccc3)cs2)CCc2ncc(C(F)(F)F)cc21 777467284 JEPYTGFRLAENQT-MDWZMJQESA-N 386.398 5.436 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccccc1O[C@@H](C)C#N 780667048 FQKBRNZKFABGSQ-ICSRJNTNSA-N 379.504 5.161 30 20 GKED C[C@H]1COc2ccccc2CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782553286 OCLFPAVPLQQKIX-MBSDFSHPSA-N 397.478 5.157 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2cccc(OC(F)(F)F)c2)cc1C#N 783750188 ZYKIJNRDSLYOGI-UHFFFAOYSA-N 395.406 5.053 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ncc(C(F)(F)F)s3)cc2)c1 789748587 XSFKUBAVEMGYQX-UHFFFAOYSA-N 389.402 5.225 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc(C(=O)c2ccc(F)cc2)cc1)c1ccccc1 792866245 GYTUJYGTLRHTRN-FQEVSTJZSA-N 387.410 5.050 30 20 GKED FC(F)(F)c1ccc(-n2cc(C=NOc3ccccc3C(F)(F)F)cn2)cc1 794924585 XSSRDRLLHLOOBO-UHFFFAOYSA-N 399.294 5.323 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)ccc2c1 797569807 XOFNXWCPOPWJKJ-LIRRHRJNSA-N 392.524 5.582 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)c2ccccc2Br)n1 798838916 UHMLHKBPBHUOEW-LBPRGKRZSA-N 391.334 5.183 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)[C@H]2CC=CC[C@H]2c2nc3ccccc3s2)CC1 809089443 CWLJSSRCKHJKEK-XDNAFOTISA-N 380.513 5.219 30 20 GKED N#CC[C@H](CC(=O)OCC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 816477402 YEAAKBXNTFITRL-RTBURBONSA-N 375.390 5.353 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cc(Cl)ncc3Cl)c(C#N)c2[C@@H]1C 839391267 WMACHHJUDYLJQP-DTWKUNHWSA-N 380.300 5.260 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](OC2CCC2)CC1 878675246 DTJUXIYDYDFMTC-WMZOPIPTSA-N 387.549 5.036 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 916057723 VQZJSJXHIUDZNN-KCQSEKJDSA-N 397.865 5.519 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccc(Cl)cc2)cc1 916948220 FDUOHLHYWFQYRT-QRWLVFNGSA-N 382.891 5.134 30 20 GKED Cc1ccc(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)c1 916977687 WQVFWAYKRWGIIX-QGZVFWFLSA-N 396.899 5.336 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917043757 OLHDIEGFGUWOHP-IUODEOHRSA-N 388.414 5.685 30 20 GKED COc1ccc(/C=C/C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 919893748 OJELXDBXDWFKOH-VGOFMYFVSA-N 384.435 5.320 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 920055904 WCSPKNFZHJGZNA-UZUQRXQVSA-N 387.458 5.406 30 20 GKED CCCCCCCOc1ccc(C(C)=NNc2ccc(CC(=O)O)cc2)cc1 1776083851 CJTLWMIXQUXTFR-UHFFFAOYSA-N 382.504 5.499 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2cncc(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269196 DKJVKYMAWCCPOB-SREVYHEPSA-N 377.484 5.197 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(-c2ccccc2)cs1 1776354812 ZBFISMCSIHYLGL-MDZDMXLPSA-N 392.476 5.797 30 20 GKED CCCCCCCC/C=C/CCCCCCCC(=O)NCC1(CC(=O)O)CC1 1776785321 URVJPWMUIZHDKK-MDZDMXLPSA-N 393.612 6.395 30 20 GKED COc1cc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)ccc1Cl 1777263129 TWDXRCBSPCWRRO-UTCJRWHESA-N 390.819 5.297 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc4cc(F)ccc4[nH]3)c2)c1 32290856 WRNDBLATGYYTKS-UHFFFAOYSA-N 385.398 5.010 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccccc2n1)c1nc2cc(C(F)(F)F)ccc2s1 41549154 ATOUWEJBOUHHTN-ZDUSSCGKSA-N 397.381 5.353 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(-c2nccs2)c1 64833715 UMOWNAPMZHTMDF-UHFFFAOYSA-N 381.460 5.601 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(C)(c2ccccc2)CC1 119916093 UWPRYQRESCEASB-SFHVURJKSA-N 393.556 5.524 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2nc(C3CC3)cs2)cc1 124104398 SNAXTRBKMKDNRR-UHFFFAOYSA-N 391.521 5.437 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 125787154 VAUQYWZPZKZPJH-UHFFFAOYSA-N 396.834 5.068 30 20 GKED Cc1ccc(Br)c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 129639391 KXUVAHIHOORQPN-QFBILLFUSA-N 398.304 5.061 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCCSC(C)(C)C 130394735 PJNBCRKKZVRUSV-UHFFFAOYSA-N 383.517 5.304 30 20 GKED N#CCCn1cc(CNc2ccc(N3CCCCC3)cc2)c(-c2ccccc2)n1 155647098 PSKBUWQNRNSQLR-UHFFFAOYSA-N 385.515 5.066 30 20 GKED C[C@@H](CSCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 178844066 HRABVNGPKSLNSE-GOEBONIOSA-N 399.466 5.177 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c(C)n1-c1ccccn1 193721782 QJJCCYPSZQWUBF-IBGZPJMESA-N 398.491 5.103 30 20 GKED C[C@H]1[C@H](C)CCC[C@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 255953079 WQQVRIFZUMFFID-LLGFUMIMSA-N 378.541 5.405 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccc(F)cc2)n1 303340910 YODHLBARPCIQJI-CYBMUJFWSA-N 397.500 5.453 30 20 GKED Cc1nc2ccc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)cc2o1 329452577 NJWBPWHJEHTZFQ-INIZCTEOSA-N 378.476 5.231 30 20 GKED Cc1cccc(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c1Br 330094004 SFSWOVMCJJNEKW-UHFFFAOYSA-N 393.325 5.139 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CC(F)F)c1ccccc1 421055700 HDJBKSOXCVDXKG-RHSMWYFYSA-N 389.471 5.599 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(CN)nc1C)c1ccc(C(F)(F)F)cc1 423001080 HNZQTHWBOKFTGJ-YWZLYKJASA-N 377.454 5.226 30 20 GKED C=CCC[C@H](C(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644191 GPZSTPXNCIAAEC-QUCCMNQESA-N 392.474 5.423 30 20 GKED CC(C)Cn1ncc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c1-c1ccccc1 429119480 ZESINUJVXIRPDD-KRWDZBQOSA-N 392.528 5.276 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)[C@H](C#N)CCc1ccccc1 433301809 GNWXQKMNXLIVMW-UZLBHIALSA-N 389.524 5.068 30 20 GKED C=CCn1c(SCc2nc(-c3ccccc3)cs2)nnc1-c1ccco1 435693995 KERWKNDKGVGVNL-UHFFFAOYSA-N 380.498 5.140 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1nc(C2CCCCC2)no1)c1ccccc1 435761348 FNWLQHWVMBAXDB-APWZRJJASA-N 382.508 5.185 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 436285011 CLMGXFVKPNUHSG-OWQGQXMQSA-N 376.953 5.404 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)c(Cl)cc1F 439973373 SJMPNJKACUHXQO-UHFFFAOYSA-N 378.234 5.224 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccc(C#N)cc1 445232676 BRGVOSAYCCQYGC-QFYYESIMSA-N 399.775 5.015 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 448729333 NTONKTOIUMXNIR-QGZVFWFLSA-N 390.405 5.249 30 20 GKED CCCCOc1ccc(NC(=O)c2cccc(C#N)c2Br)c(C)c1 448766534 BTQYQLNHTHIFDW-UHFFFAOYSA-N 387.277 5.060 30 20 GKED C[C@H](C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1cccs1 460344244 YIKFGUUCOBTFCA-HNNXBMFYSA-N 380.900 5.610 30 20 GKED C[C@H](C(=O)Nc1ccccc1Oc1ccccc1Cl)c1cccc(C#N)c1 463287934 OAPATPDCGRLFMD-HNNXBMFYSA-N 376.843 5.746 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)cc1Cl 469125192 SAWCCCRURDQGJS-AWEZNQCLSA-N 385.870 5.235 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)Nc2cc(C#N)ccc2C)cc1 473358119 XOANEJMLOFAUSB-GOSISDBHSA-N 399.494 5.767 30 20 GKED Cc1csc(Sc2ccc(NC(=O)C[C@@H](CC#N)c3ccccc3)cc2)n1 474965785 KHCUUHFSUCKMIZ-QGZVFWFLSA-N 393.537 5.629 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cc(Br)cs1 476122311 JYFRXQOKBUJCFX-UHFFFAOYSA-N 392.362 5.934 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2ccc(C)o2)nc1C 476122793 LPTINRSNDHJVDA-UHFFFAOYSA-N 380.513 6.124 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)cc1 480270283 XRDYBHFLRSCTHS-BJKOFHAPSA-N 382.463 5.074 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-c2ccc(Cl)s2)cn1)c1ccccc1 481145127 PYXBVOYMZODLMM-OAHLLOKOSA-N 381.888 5.490 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1OCc1ccccc1)c1ccccn1 483448407 MMDOMBPACKHWTD-KRWDZBQOSA-N 397.261 5.457 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(CS(=O)(=O)C(C)(C)C)cc1)c1ccccc1 488697694 DPUHBUUJPNWWKW-OAQYLSRUSA-N 399.556 5.088 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(F)c(F)c(F)c1F 499353870 ADIMFCGUBKXPIS-QMMMGPOBSA-N 379.275 5.095 30 20 GKED C=CCC[C@H](NC(=O)C(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 499412725 PYUGXXTVBANVCP-INIZCTEOSA-N 392.833 5.040 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1c(Cl)cccc1Cl 499845117 MCFBALSGBKXMHX-XEZPLFJOSA-N 379.674 5.131 30 20 GKED Cc1cc(NC(=O)Nc2cccc(OCCCC#N)c2)ccc1Br 502646146 FFMNNRAWIVAKIW-UHFFFAOYSA-N 388.265 5.084 30 20 GKED C=CCOc1ccc(CN[C@H]2CCCc3cn(C4CCCC4)nc32)cc1Cl 505986038 FSPRQTNUBKMUQM-FQEVSTJZSA-N 385.939 5.384 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4sccc4s3)n2)cc1 516270366 VCQJKCLLUQSNIF-CYBMUJFWSA-N 391.502 5.448 30 20 GKED CCCCN(CC)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 517441063 NVTAXIDXGFJDCT-UHFFFAOYSA-N 381.545 5.571 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cc1 518904258 FKFGDIVKEFZWAK-UHFFFAOYSA-N 390.826 5.459 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCOc2ccccc2-c2ccccc2)cc1 520604344 FBSBENSZXSXKHQ-UHFFFAOYSA-N 399.494 5.355 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 522314272 WDKDAEGDMNAEDQ-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CCc1c(C)sc(NC(=O)c2sc(-c3ccc(C)cc3C)nc2C)c1C#N 524105513 HZQYXARRQBIMCS-UHFFFAOYSA-N 395.553 5.792 30 20 GKED N#CC[C@H](CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 526011208 YUWUEJSMWIOJPD-GGAORHGYSA-N 398.510 5.218 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N[C@@H](CCC#N)c3ccccc3)cc2)cc1 534824166 YVMKQTDMMDQBLD-DEOSSOPVSA-N 398.462 5.456 30 20 GKED Cc1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)nn1[C@H](C)C1CC1 540720785 BPNCLBBMXIJFNZ-MRXNPFEDSA-N 386.455 5.079 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)s1 544858773 FUFYXIXESTVWTK-NSHDSACASA-N 388.464 5.763 30 20 GKED Cc1nc(C2CC2)oc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 545449117 MPKJUGHWPBGLBJ-AWEZNQCLSA-N 383.860 5.127 30 20 GKED C=C(C)[C@H](Cc1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1)OCC 546549986 NDTYBUKCXXJPLL-ZDUSSCGKSA-N 377.218 5.040 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1)C(F)(F)F 573403626 VOBXKKMMUCAPKG-HOCLYGCPSA-N 391.393 5.183 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@@H]1Cc1ccccc1 577013199 IWBVYIHEEARBMT-AZUAARDMSA-N 393.556 5.710 30 20 GKED CC1(C)CN(C(=O)c2cn(CCCC#N)c3ccccc23)[C@@H]1c1cccs1 584832228 SHSZRKDDKCRLTH-HXUWFJFHSA-N 377.513 5.230 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(SCc4ccccc4)cc3)[nH]c12 605363300 SXHCHBOFTWIPAI-HXUWFJFHSA-N 397.503 5.654 30 20 GKED Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 606576421 IDOWBMDCVHNNOY-IRLDBZIGSA-N 395.506 5.200 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)c1 609094817 JCTUDJLPLVVYAX-UHFFFAOYSA-N 384.464 5.032 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)sc1SCC#N 609502412 ZTWVSHXMVGIIEF-MNOVXSKESA-N 398.340 5.116 30 20 GKED C[C@@H](CN(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccccc1 609643728 GUAXRXMXUVVCJR-IBGZPJMESA-N 384.479 5.013 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccc(C#N)cc1 609825160 JBYCSGZPVSZGDY-ZDUSSCGKSA-N 375.419 5.756 30 20 GKED Cc1cccc2c(CC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)c[nH]c12 610153277 DQKXUWBONAUSLK-UHFFFAOYSA-N 381.435 5.322 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1CCSc2ccccc21 610224750 NEYNMQXZMSGPES-KRWDZBQOSA-N 376.506 5.505 30 20 GKED C[C@H](N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 610706278 IBOAJXBABBHKIW-NWDGAFQWSA-N 387.270 5.327 30 20 GKED C[C@H](N[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 611077966 VIPANKYHOQZSML-STQMWFEESA-N 386.282 5.932 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc(-c2ccccc2)nc1C(F)F 611183940 MANYNHRMQMJOEN-UHFFFAOYSA-N 399.422 5.270 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)NCc1ccc(C#N)c(Cl)c1 619755400 IANUEEXROJGCCN-LBPRGKRZSA-N 385.895 5.634 30 20 GKED C=CCCC1(CNC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)CCCC1 665589865 IWUIBORNYBLWHQ-GOSISDBHSA-N 386.540 5.100 30 20 GKED C=CCN(C(=O)c1coc(C)n1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 673447734 OHAMKLDEGFAUDO-UHFFFAOYSA-N 394.283 5.246 30 20 GKED COc1cc(C(C)=NNc2ccc(C#N)c(C(F)(F)F)c2)ccc1SC 726426369 VGCTXYPMNBYTQI-UHFFFAOYSA-N 379.407 5.144 30 20 GKED N#CCCCOc1cccc(/C=C2\COc3c(ccc(Cl)c3Cl)C2=O)c1 726743443 HQMPSXVFRKPNQD-GXDHUFHOSA-N 388.250 5.335 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)NCc2ccc(OCC#N)cc2)C(C)C)cc1 727938238 HQCPIWDVGFNURB-JPYJTQIMSA-N 393.531 5.299 30 20 GKED CC(C)(CNC(=O)c1ccccc1SCC#N)c1c(Cl)cccc1Cl 729420008 UZKYXPBPDJJBRT-UHFFFAOYSA-N 393.339 5.317 30 20 GKED CC(=NNc1ccc(C)nn1)c1ccc(-c2ccc(Br)cc2)s1 729935630 HYGQUAJFDFIFRR-UHFFFAOYSA-N 387.306 5.112 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(-c2nc3c(F)cccc3[nH]2)cc1 730736118 AYQPYFZUZQSTKA-UHFFFAOYSA-N 387.443 5.050 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc3c(c2)COC3)cc(C)c1OCc1ccccn1 742435250 RVRAJVPHQXHUOL-TWGQIWQCSA-N 385.463 5.204 30 20 GKED COc1cc(C(=O)/C=C/C=C\c2ccccc2[N+](=O)[O-])ccc1SC(F)F 750908742 GQOILCLRQSIRQZ-NINQLNBYSA-N 391.395 5.370 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1 756234531 VRPHPHGRPPHNIL-CXAGYDPISA-N 398.890 5.132 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)Cc2nnc(-c3cc(C)oc3C)o2)c1 760857990 UKPYRCAAUDAWJE-UHFFFAOYSA-N 383.451 5.135 30 20 GKED CCn1c(NC(=S)Nc2cc(Cl)cc(Cl)c2)nc2cc(C#N)ccc21 763294862 UIECWXJLHHKZBU-UHFFFAOYSA-N 390.299 5.044 30 20 GKED CCOCCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCCC1 763475772 INOUHAXSGWLMPA-GOSISDBHSA-N 382.529 5.282 30 20 GKED Cc1cncc(C(=O)/C=C/c2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 767368231 UGTMBCDAYQVGKF-BJMVGYQFSA-N 376.843 5.192 30 20 GKED CN1C(=O)CCc2cc(/C=C\C(=O)c3ccc(Cl)c(C(F)(F)F)c3)ccc21 774134133 IKOVFAIMWOXTOH-BAQGIRSFSA-N 393.792 5.164 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 776828752 MPVSWQRZVOYHMR-UHFFFAOYSA-N 384.501 5.564 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCCS1)c1nc(-c2ccc(Cl)cc2Cl)cs1 783354710 GHBVDNZMGWOTKC-SWLSCSKDSA-N 397.352 5.579 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccccc2Cl)CC1)c1nc2cc(F)ccc2s1 784506421 NPDRUUQTKDTSLH-AWEZNQCLSA-N 384.863 5.288 30 20 GKED CCSCc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 789896073 HXNCHFNUKCXIKK-QHCPKHFHSA-N 386.520 5.847 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C\c3ccc(-c4cccc(F)c4F)o3)ccc21 790225166 KCBRMUWQFPTOJT-YFHOEESVSA-N 393.389 5.030 30 20 GKED N#C[C@@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1cnc2ccccc2n1 792109815 VBLGPAMKDWLUJP-XCMFGDQWSA-N 399.450 5.247 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cc(C)c(OC)c(Cl)c2)cn1 792905268 KOQWNAINTCGGBG-HJWRWDBZSA-N 394.858 5.019 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ccc(Br)cc2)s1 797568464 RYXIFWRKNXVYMI-AWEZNQCLSA-N 391.334 5.012 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797568907 XTAULKQKAWMIAW-QGZVFWFLSA-N 384.545 5.483 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570811 JZUPICDNSBYTNO-TZIYXEQSSA-N 392.446 5.739 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C[C@@H]2CCC(F)(F)C2)cc1 797835798 MZEZAANKLOHDMX-KRWDZBQOSA-N 384.426 5.096 30 20 GKED N#C[C@H](C(=O)CC1CC(c2ccccc2)C1)c1nc2cc(Cl)ccc2s1 798816309 KGFWRSKFTAAXEG-PUJMQQBBSA-N 380.900 5.710 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801686922 CNORBEYACOINTH-HNNXBMFYSA-N 395.274 5.138 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(-c4c(F)cccc4F)cc3)cc12 811697340 JSHCEZNLYQLDCO-WDZFZDKYSA-N 389.405 5.118 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc(C(C)(C)NC(=O)OC(C)(C)C)no1 904763566 BWXYOZWZNKIHOH-QGZVFWFLSA-N 385.508 5.318 30 20 GKED N#CCCCCOC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 914621230 CIEHBLPHOLGFDV-UHFFFAOYSA-N 387.464 5.362 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccc(Cl)cc2)cc1 916947636 PBAAJTIAFKZAGJ-FQJYRUACSA-N 380.875 5.214 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026852 PVXJVSQRWLKLLV-GDBMZVCRSA-N 396.899 5.416 30 20 GKED Cc1cc(Oc2ccc(C=NNc3ccc(C(=O)O)cc3)c(Cl)c2)ccc1F 1776012246 LBXODYPJCFOSST-UHFFFAOYSA-N 398.821 5.724 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776033211 NWEJPHXTRAPMDQ-UHFFFAOYSA-N 388.345 5.500 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2ccc(O[C@@H](C)C(=O)O)cc2)cc1 1776125994 ZBVJTQJDGSIWHJ-KCPLEYNQSA-N 382.456 5.004 30 20 GKED O=C(/C=C/c1ccc2oc(C(=O)O)cc2c1)c1ccc(Oc2ccccc2)cc1 1776126738 VWHPRSJJGHVUMQ-WUXMJOGZSA-N 384.387 5.819 30 20 GKED C=CCOc1c(Cl)cc(CN[C@@H](CCCCCCC)CC(=O)O)cc1OC 1776183342 ZVKPREPRNZAHKS-KRWDZBQOSA-N 397.943 5.207 30 20 GKED C[C@H]1/C(=C/c2ccc3oc(C(=O)O)cc3c2)C(=O)c2cccc(Br)c21 1776586942 DQMSMMSJNGLNDI-WULZRQGASA-N 397.224 5.277 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc([C@H](C)C(=O)O)cc2)cc1 1776786657 SERNMAVIAITFBF-SFHVURJKSA-N 381.516 6.030 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2cccc(O[C@H](C)C(=O)O)c2)o1 1777424544 ITRICXZNTLXIMA-YYRKOSNBSA-N 394.398 5.142 30 20 GKED O=C(O)/C=C\c1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 1777623989 IUMGKPQNTYCXIE-POQLCMLLSA-N 381.642 5.641 30 20 GKED COc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1Cl 15656675 SOGLFYIBLSYKKI-UHFFFAOYSA-N 394.883 5.624 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cccc(C)c2)cs1 54897085 VWPJMECFNPSMMV-DHZHZOJOSA-N 380.444 5.171 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccc(C)cc2C)cs1 54897287 JKUMSHYQXIHEJF-YRNVUSSQSA-N 394.471 5.480 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)c(Cl)cc1Cl 66800976 SABDBFRHRMATLZ-JTQLQIEISA-N 383.275 5.779 30 20 GKED Cc1csc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 69656945 BZCKEWIJBCRNTH-HNNXBMFYSA-N 392.484 5.307 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccnc3ccccc23)cc1 97699595 AZGFITAVNWREEW-UHFFFAOYSA-N 393.446 5.132 30 20 GKED O=C(c1ccc(-c2ccccc2F)o1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117206295 DOKWAGYORIHZDF-UHFFFAOYSA-N 395.274 5.043 30 20 GKED CC(C)c1noc(-c2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2)n1 120530734 WJHQPYNCJLBSCK-LJQANCHMSA-N 389.459 5.027 30 20 GKED N#Cc1c(NC(=O)c2ncccc2C(F)(F)F)sc2c1-c1ccccc1CC2 179986393 GHHLIJCKHOEKHN-UHFFFAOYSA-N 399.397 5.051 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1ccc(C(F)(F)F)cn1 189868670 DTLGYGLIHRKJQL-UHFFFAOYSA-N 394.462 5.683 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NCc1cccc(C#N)c1 216759518 GAWQMQPBXQHVSJ-SFHVURJKSA-N 385.467 5.328 30 20 GKED C[C@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)Cc1ccccc1O 282061290 SETAZODDOAAQNP-HXUWFJFHSA-N 378.516 5.056 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303310721 FOSDVYFDFWXQAL-AWEZNQCLSA-N 394.377 5.035 30 20 GKED O/C(=N/Cc1cccc(C/N=C(/O)[C@@H]2CC23CCCC3)c1)[C@@H]1CC12CCCC2 329032800 QFHWCFTVOONEEQ-PMACEKPBSA-N 380.532 5.760 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c2[C@@H]1C 410976498 ATRCNRSSGLGUOY-WDEREUQCSA-N 375.444 5.065 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H](CC(F)(F)F)C3)c2)cc1 421934290 BZELXAQDNZEEKI-INIZCTEOSA-N 388.389 5.155 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4cc[nH]n4)s3)cc2)cc1 431490975 PPXARGKMDOCJLL-UHFFFAOYSA-N 386.436 5.054 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C 432979620 NVPOEBAQLRGWEN-UHFFFAOYSA-N 385.467 5.655 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCC1CC(OC(C)(C)C)C1 433504972 BYXWDKSWQTXMIU-KLAILNCOSA-N 389.565 5.044 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 438050191 CXPDEYSOAUVWTP-CUWPLCDZSA-N 384.545 5.002 30 20 GKED C[C@H](c1cc(F)ccc1F)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438641285 KXCBZUMKIHCXBH-SNVBAGLBSA-N 383.320 5.080 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3cc(Cl)cc(Cl)c3C2)cc1 438697607 QDVFYNYXAMMLIZ-UHFFFAOYSA-N 388.298 5.385 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1cscn1)c1ccc(C(F)(F)F)cc1 441529489 LGUFYBORVRYUDI-INIZCTEOSA-N 383.439 5.011 30 20 GKED C=CCN(C(=O)c1cnc([C@@H](C)OCC)s1)c1nc(-c2ccccc2)cs1 443816120 MMPHQJRBAHKTPO-CQSZACIVSA-N 399.541 5.197 30 20 GKED COc1ccc(CC(C)(C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 446161712 NHTHHHYZAUVRCG-INIZCTEOSA-N 397.544 5.090 30 20 GKED N#CCCC[C@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)c1ccccc1 458477193 OVOKQNRJTSNQNW-FQEVSTJZSA-N 394.906 5.098 30 20 GKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H]1CCCC[C@H]1C(F)(F)F 458839388 MRKJBAFTXSGKHI-KURKYZTESA-N 381.442 5.184 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccc(Cl)cc1 461109150 CTLFTVYTVOMQEV-ULQDDVLXSA-N 379.674 5.131 30 20 GKED Cc1cc(Cl)c2ccccc2c1NCC(=O)Nc1ccccc1SCC#N 462551041 YEWKVMKBQYCONI-UHFFFAOYSA-N 395.915 5.468 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3SCCc4ccccc43)c2)cc1 463878439 NIOJKFNMUAYRRQ-QFIPXVFZSA-N 386.476 5.320 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(F)cc(F)c1Br 468274751 PVRIMWHTRDEJNT-UHFFFAOYSA-N 384.245 5.258 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2cc(C(F)(F)F)ccc2C)c1C#N 470220254 XMICDWIHHFRUEI-UHFFFAOYSA-N 391.418 5.132 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1 471171471 YDMAHCVQHOWJGC-UHFFFAOYSA-N 385.533 5.142 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C)cc1-c1nc(C2CC2)no1 472891134 ZSUNKBDRQZXVBS-UHFFFAOYSA-N 394.500 5.204 30 20 GKED Cc1ccc(-n2cccn2)cc1NC(=O)c1ccccc1Oc1ccccc1C#N 476097262 BCKRMEBGOBRUKQ-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)s1 478082483 WORJNWFXRRFJFS-UHFFFAOYSA-N 375.497 5.480 30 20 GKED C[C@@H](NCc1cc(C#N)n(C)c1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 480461942 OZWFNJJSFGEFBE-CYBMUJFWSA-N 389.446 5.495 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cccc(NC(=O)C2CCCC2)c1 481926269 XKZWHLPDGWRTIS-XMMPIXPASA-N 387.527 5.244 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccc2ncsc2c1 486875142 SLNLFNMJIRCCMA-LBPRGKRZSA-N 391.949 5.470 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1nc(C)c(-c2ccc(Cl)cc2)o1 489525440 NEPVSNZPIUSQHM-UHFFFAOYSA-N 389.238 5.416 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)Nc3ccc(Cl)c(C#N)c3)s2)cc1 494737631 HCYXZSMANHQYAV-UHFFFAOYSA-N 397.887 5.295 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 502413900 KPYSHIOVNQSVFG-UHFFFAOYSA-N 394.525 5.357 30 20 GKED C=CCOc1cccc(CN(CC)CC(=O)Nc2c(Cl)cccc2Cl)c1 506294124 IJFSEBJOILKHKO-UHFFFAOYSA-N 393.314 5.019 30 20 GKED Cc1c(C#N)cccc1C(=O)N(C)CCCCCc1cc(-c2ccccc2)no1 509934872 OIPYRJYFYSZMAC-UHFFFAOYSA-N 387.483 5.007 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc(-c4ccco4)s3)n2)cc1 510588033 ATXGWSLSBPDADX-CQSZACIVSA-N 391.477 5.325 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 513109087 WEPOIMHUUAQRNR-UHFFFAOYSA-N 399.432 5.006 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)oc1ccccc12)c1ccc(C(F)(F)F)cn1 513732200 CLTAMCRPILWSOM-INIZCTEOSA-N 380.325 5.490 30 20 GKED COc1ccc2cc(CN(C)C(=O)Nc3ccc(C(C)(C)C#N)cc3)ccc2c1 514514567 CUZUPTUWIFWCJW-UHFFFAOYSA-N 387.483 5.313 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1 517684649 QPXVXIQAERAJMP-HXUWFJFHSA-N 395.459 5.069 30 20 GKED CCO[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 517905700 CBOBYQPTPONNNM-QHCPKHFHSA-N 386.451 5.375 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)Nc1ccc(COC2CCCC2)cc1 525346561 ASQRXTDTPMOIBO-UHFFFAOYSA-N 379.460 5.060 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3cccc(C(F)(F)F)c3C2)cc1 528898687 DWFJXNOXMIMZDK-UHFFFAOYSA-N 387.405 5.097 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 533372368 IOMFEHJLLOWBBN-QFIPXVFZSA-N 396.487 5.532 30 20 GKED CCN(C(=O)c1c[nH]c2cccc(Br)c12)[C@H](C)c1ccc(C#N)cc1 536074148 OBMNOAVVHPFPBG-CYBMUJFWSA-N 396.288 5.025 30 20 GKED CC(C)CN(C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccc(C#N)cc1 536094282 DLXDMVILCDKXNB-UHFFFAOYSA-N 397.478 5.113 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)ccc1OCc1ccccc1 538151203 PRMOAMYMNABCHY-RBUKOAKNSA-N 386.495 5.558 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 539718491 SVPCYXDRGNHZMK-DENIHFKCSA-N 393.487 5.066 30 20 GKED C=C(C)[C@@H](NC(=O)c1cc(-c2ccccc2)c(C)nc1O)c1ccc(F)c(F)c1 547861950 XLYBVEZGJHQJTA-OAQYLSRUSA-N 394.421 5.088 30 20 GKED CC(C)(c1noc(C[C@@H](CC#N)c2ccccc2)n1)c1ccc(Cl)cc1F 564275097 CMXNXKSEGQDSET-OAHLLOKOSA-N 383.854 5.428 30 20 GKED COc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(Br)c1 565882732 FZZUWZGMKJHWCD-FOIQADDNSA-N 387.321 5.543 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccccc1Oc1ccccc1)c1ccc(C#N)cc1 570415177 VGFBOTPJLBIMHZ-ZWKOTPCHSA-N 385.467 5.028 30 20 GKED N#CC1(CNC(=O)[C@H](Sc2cc(Cl)ccc2Cl)c2ccccc2)CC1 574141157 BMVAXVVHCAMOND-QGZVFWFLSA-N 391.323 5.247 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCn2c(cc3ccccc32)C1 579779497 RDTJOZBCQGIVJI-INIZCTEOSA-N 390.512 5.083 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(F)c2ccccc12 589941548 MBLXMLBYUWOTJU-NSHDSACASA-N 387.241 5.648 30 20 GKED Cc1nc(CC(C)C)sc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 590207658 BBYWJALAJXIBIQ-LBPRGKRZSA-N 389.933 5.403 30 20 GKED C[C@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC2(CCCCC2)O1 594073039 ZMAWEPIZOQVPOA-DLBZAZTESA-N 387.549 5.036 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 597079099 SBIBPVBLJHWZHQ-QGZVFWFLSA-N 375.394 5.571 30 20 GKED COc1ccc2oc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c(C)c2c1 602756708 YUYPMLXGXXMIET-LLVKDONJSA-N 380.469 5.060 30 20 GKED Cc1ccc(S[C@@H](C(=O)Nc2ccc(CC#N)cc2)c2ccccc2)c(C)c1 609261152 UEEQRJVBZRDLSO-HSZRJFAPSA-N 386.520 5.842 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)o1 609416390 NMUKFOJGCSBKRR-WPGHFRTFSA-N 377.271 5.023 30 20 GKED Cc1cccc(C)c1OCCCNC(=O)Nc1ccccc1S[C@H](C)CC#N 609437003 JIXWIUBGUGPWCT-GOSISDBHSA-N 397.544 5.288 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610356217 MBNJAXYRCZRORC-ORAYPTAESA-N 388.298 5.473 30 20 GKED C[C@H](NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 610400921 SNFKLAOOHDNHSK-RBUKOAKNSA-N 383.495 5.139 30 20 GKED Cc1n[nH]c(C)c1[C@@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 612280458 MHMKCJVOXYTREW-BFUOFWGJSA-N 392.890 5.078 30 20 GKED CCc1nc2ccccc2n1C1CCN(Cc2ccc(C(C)(C)C#N)cc2)CC1 614176738 AGHSGRGNARSVEL-UHFFFAOYSA-N 386.543 5.237 30 20 GKED C[C@@H](C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1c(F)cccc1F 619126757 MOYUGZOZMCUKLZ-SECBINFHSA-N 391.302 5.238 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619768114 IVDOWXOGHQXAPI-UONOGXRCSA-N 390.314 5.199 30 20 GKED N#C[C@@H](C(=O)c1nccs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 683689888 RMJOMBRLHIVFJX-JTQLQIEISA-N 380.281 5.063 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1sc(C)nc1C 726736761 RZMTVNYYRRPZLD-UHFFFAOYSA-N 379.514 5.268 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(C(F)(F)F)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727266585 ARIBOZKTFRPULU-VMPITWQZSA-N 394.305 5.035 30 20 GKED CC(=NNCc1cccc2cccnc12)c1csc(-c2csc(C)n2)c1 729141977 JLCCYPTXXYPXLW-UHFFFAOYSA-N 378.526 5.242 30 20 GKED COc1ccc(/C=C/C(=O)c2sccc2Br)c(Cl)c1OC 730435155 XXUBEEYZACHFKR-HWKANZROSA-N 387.682 5.077 30 20 GKED Cc1cnc(-c2cccc(NC(=O)c3cc(C)n(-c4ccc(C#N)cc4)c3C)c2)o1 731351082 LAOCFYLZTCHBMT-UHFFFAOYSA-N 396.450 5.182 30 20 GKED O=C(/C=C\c1ncc(-c2cccc(Br)c2)[nH]1)c1cc2ccccc2o1 731938995 UCPGYRSTXVAOBI-HJWRWDBZSA-N 393.240 5.482 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 735366171 MJKLVTJZVPMLCS-NJDAHSKKSA-N 379.529 5.138 30 20 GKED COc1cc(/C=C/C(=O)c2cc3cccc(OC)c3o2)c(SC)cc1OC 741165059 FKLFFKTXSKOBTM-CMDGGOBGSA-N 384.453 5.077 30 20 GKED Cc1nc(S[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)sc1C 741855632 FBPMRVJRTKKPAG-LBPRGKRZSA-N 391.587 5.081 30 20 GKED COC(=O)c1ccc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)o1 749450937 CXIMSGUUXNVLQG-SSZFMOIBSA-N 389.432 5.099 30 20 GKED O=C(C#Cc1ccccc1)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 752308110 OMTAELPDCDOFTG-UHFFFAOYSA-N 399.837 5.066 30 20 GKED CCN(CCC#N)C(=O)c1ccccc1Nc1ccc(SC(F)F)cc1 764517189 JBWYGRVYOKLWQD-UHFFFAOYSA-N 375.444 5.121 30 20 GKED CC(=O)[C@@H](OC(=O)c1ccccc1Sc1ccccc1C#N)c1ccccc1 767373014 GWCOXPGHPMXPAR-JOCHJYFZSA-N 387.460 5.197 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(N3CCCCC3)c2)c2ccccc21 767684374 OFYXFXNMBVYPIL-UHFFFAOYSA-N 386.499 5.188 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc(Cl)nc3)n2)cc1 772642461 XLFGERLQVYHIAU-YCOJEUHLSA-N 379.872 5.057 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](CC2CCC2)c2ccccc2)ccc1OC 776165401 QDEYFABXURPDCD-FGZHOGPDSA-N 378.516 5.397 30 20 GKED N#CCOc1cc(F)ccc1NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 779609160 JPQGACXMTZOHGF-UHFFFAOYSA-N 392.274 5.378 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1 780376234 DSXPEIOQXOIFBF-FQEVSTJZSA-N 398.434 5.080 30 20 GKED N#C[C@H](C(=O)CCCc1ccsc1)c1nc(-c2c(F)cccc2F)cs1 783363979 JYRKYAGDHXFPCQ-CYBMUJFWSA-N 388.464 5.349 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(Cl)cc1F 789369593 VVOTVCVPCAJCJF-LBPRGKRZSA-N 390.842 5.382 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792092884 FFPOZMFJJDAGJJ-FIIODCPWSA-N 380.369 5.533 30 20 GKED C[C@H](C#N)OCCSc1nnc(-c2ccc(C(C)(C)C)cc2)n1C1CCCC1 801652966 XMHAWUIHIXTFKC-MRXNPFEDSA-N 398.576 5.378 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](OC1CCCC1)c1ccccc1 804559190 SJTKNXVOXHMMDA-HSZRJFAPSA-N 395.547 5.069 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813217027 ATEWDRPRPZAHGS-DYVFJYSZSA-N 390.405 5.042 30 20 GKED C=CCC1(C(=O)N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)CCCCC1 825786646 VZEJCEUOQPRVFL-HXUWFJFHSA-N 375.940 5.139 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3)no2)cc1 915179785 IZTZHPPKSFRSIM-OAQYLSRUSA-N 379.419 5.249 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SCc1ccccc1 915329789 JKPIHDPDIYVJDF-UHFFFAOYSA-N 387.508 5.514 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)s1 915353598 PFHXRJRGOOUGIO-KSFYIVLOSA-N 389.524 5.903 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccccc3Cl)n2)cc1 916627250 IBJVHRYNGJTCGG-MQNTZWLQSA-N 378.884 5.662 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C2CCCCC2)cc1 916681653 VTFCIMZVZZEQLU-BJKOFHAPSA-N 387.527 5.919 30 20 GKED N#C[C@H](C(=O)C1CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916996492 NCHAKAGFYVENNC-CQSZACIVSA-N 379.312 5.873 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2oc3c(C)cccc3c2C)cc1 920110344 DEIFJWOYQGTVKJ-VBKZILBWSA-N 388.467 5.524 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2cccc(Cl)c2F)cs1 921137514 AFTIYHBRPYAMMA-UHFFFAOYSA-N 388.855 5.066 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NNc1c(Cl)cccc1Cl 1776049054 YRVMFVMBBZNHRW-ZDUSSCGKSA-N 395.286 5.266 30 20 GKED CCCCCCCOc1ccc(CN[C@H]2CCCc3cc(C(=O)O)ccc32)cc1 1776786281 LGOBOGWRULEXPH-DEOSSOPVSA-N 395.543 5.901 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776819142 NIFSRJODVIHBNL-XGICHPGQSA-N 376.408 5.330 30 20 GKED Cc1cccc2c1CC/C(=C\c1ccc(OCc3occc3C(=O)O)cc1)C2=O 1777457397 RCLYEDFDHNNMCR-GHRIWEEISA-N 388.419 5.078 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nc3cc(Cl)ccc3c(=O)n2C(C)C)cc1 7437080 AHONUQMHYBHKBK-QGZVFWFLSA-N 397.931 5.166 30 20 GKED Cc1cc2cc(C/N=C(/S)Nc3ccc(OC(F)(F)F)cc3)ccc2[nH]1 8685203 NSKFMJGVNSICFM-UHFFFAOYSA-N 379.407 5.273 30 20 GKED aggregator C=CCn1c(Cc2ccccc2)nnc1SCc1cc(-c2ccccc2)on1 41722443 ZLEKVKKJYTVQFF-UHFFFAOYSA-N 388.496 5.002 30 20 GKED CN(Cc1cccs1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 47565859 DCNQNBYZUAMCTA-IBGZPJMESA-N 395.915 5.721 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 58452350 KBDUIJFRNSYUGO-KRWDZBQOSA-N 398.466 5.002 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCC(=O)c1cc(C)sc1C 60457928 MGKSVBXOEVPNBL-UHFFFAOYSA-N 381.950 5.258 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccncc1 66955764 FWUQOQYPBLXFMT-XLIONFOSSA-N 394.544 5.625 30 20 GKED CCc1cccc2c(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)c[nH]c12 109212057 SZWUSNCMHZFOKV-HNNXBMFYSA-N 377.513 5.306 30 20 GKED Cc1ccccc1Cc1nnc(CNc2cccc(Oc3ccc(C#N)cc3)c2)o1 133805601 JBXRAHCYRLNARX-UHFFFAOYSA-N 396.450 5.245 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cccc(C)c4o3)n2)cc1 147305924 MEUDHVZXUPEZTE-QGZVFWFLSA-N 388.448 5.363 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1OCC1CC1 159294341 XGQNTLDCONKSEL-MRXNPFEDSA-N 395.528 5.191 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 159299455 BFHWCOVPQWLEOU-APWZRJJASA-N 382.533 5.481 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](C)c1cccc(O)c1 173116236 LXFUGQDAQLMLMG-HOTGVXAUSA-N 383.517 5.259 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(-c2ccncc2)cc1 174346773 BOGTZCGZHIQUQQ-SFHVURJKSA-N 396.494 5.055 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174492555 ZAZQFZNOPZMENU-AWEZNQCLSA-N 379.391 5.308 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccnc1 177847556 UIKHRMSXHDZPQD-SJLPKXTDSA-N 382.533 5.037 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)c1cn(C)c2ccccc12 185352028 FEORJPALZHJRCP-HOTGVXAUSA-N 377.513 5.172 30 20 GKED COc1ccc(CN[C@H](C)c2cccc(C(F)(F)F)c2)cc1OCCCC#N 237172845 VBJKXTAYWOZGOW-OAHLLOKOSA-N 392.421 5.247 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2cccc(-c3cccnc3)c2)SC1=S 255383807 JQKVHELYZZTGHU-UDWIEESQSA-N 399.500 5.026 30 20 GKED COc1ccccc1[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccn1 301868754 IXXVVCGGKWRXOC-FQEVSTJZSA-N 383.373 5.182 30 20 GKED Cc1cc(C(F)(F)F)ccc1C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330096089 WTBULUYYQYNDHS-UHFFFAOYSA-N 382.426 5.396 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 409472683 ZAYJOTAKSQMYSW-QZTJIDSGSA-N 387.310 5.406 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@H](C)C3)c(C(F)(F)F)o1 411012525 NDNWUGXGLCJJNU-IUCAKERBSA-N 382.407 5.478 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1c1cccnc1 432800035 JSVRMISXHQPZFO-JOCHJYFZSA-N 398.466 5.361 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 433967832 FVWKUUDCOXFPGL-UHFFFAOYSA-N 388.370 5.280 30 20 GKED N#CC[C@@H](CC(=O)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 437413350 QUNJJLTZXONXQQ-BJLQDIEVSA-N 386.417 5.155 30 20 GKED CCOc1ccc(Cl)c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 455773673 MWLPWUALXLOPAQ-XLIONFOSSA-N 383.879 5.042 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccc(C(F)F)cc2)c1 462668919 DXTNZFDPUFDDPN-UHFFFAOYSA-N 378.422 5.365 30 20 GKED N#Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(Cl)c(Cl)c2)o1 463018227 ZIGDNCZNCZZOHI-SFHVURJKSA-N 384.222 5.229 30 20 GKED Cc1c(Br)cccc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 463771345 WSHXITBSDFCZIG-AWEZNQCLSA-N 398.087 5.059 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 464160537 QBUMTWLMRUQRKT-NRFANRHFSA-N 398.553 5.845 30 20 GKED CC[C@@]1(C)Oc2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2O1 469821891 PPDOVRAMEZZKJD-QHCPKHFHSA-N 389.455 5.095 30 20 GKED CCn1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c2ccccc21 472042775 FUYMIPRVKZTBAU-SFHVURJKSA-N 380.495 5.446 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NCc2ccc(COCc3ccccc3)cc2)cc1 474891730 FPVQFHBUBFHYJY-UHFFFAOYSA-N 398.506 5.135 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1)C1CC1 474975214 XURWWWKWUIKIJV-LBPRGKRZSA-N 389.286 5.211 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 480354658 HKRXMYHDXGBCKE-MLGOLLRUSA-N 395.812 5.315 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(OCCC(C)C)c1 483234556 KGHMPTWJTHNNTQ-NRFANRHFSA-N 388.467 5.158 30 20 GKED Cc1nc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)ccc2o1 483459796 IVXMCQJJKGFGJO-OAHLLOKOSA-N 393.855 5.403 30 20 GKED Cc1cc(C)c(Br)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 487571772 YIIMVFRFFZKWSU-SFHVURJKSA-N 385.305 5.231 30 20 GKED CC(C)c1ccc(CCC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 487838952 QODSCSWQNNQAMQ-UHFFFAOYSA-N 388.433 5.205 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)COC(c1ccccc1)c1ccccc1 499100060 PDZLUVKYCXEELY-UHFFFAOYSA-N 398.506 5.103 30 20 GKED N#C[C@H](NC(=O)CCCOc1cccc(Cl)c1Cl)c1ccc(Cl)cc1 499811562 KTLQEUUPMLLFSC-HNNXBMFYSA-N 397.689 5.187 30 20 GKED C=CCOc1cccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)c1 503269263 ZWDFBAAAWJBRDC-HSZRJFAPSA-N 378.903 5.373 30 20 GKED N#Cc1c(NC(=O)CCc2cccc(F)c2F)sc2c1-c1ccccc1CC2 505077935 FLBXXAGAPKKTBK-UHFFFAOYSA-N 394.446 5.235 30 20 GKED COc1ccc(CN2CCC[C@H]2/C=C/c2ccccc2)cc1OCCCC#N 507875240 MWRCMOPDBCEPQH-SDNYCIMKSA-N 376.500 5.056 30 20 GKED C=CCn1c(SCc2ccc(SC(C)C)cc2)nnc1-c1ccncc1 510278293 FCUUFJSTTGCDIN-UHFFFAOYSA-N 382.558 5.319 30 20 GKED O=C(N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)c1ccc(C(F)F)cc1 511740475 JPOLHNOIVCXFOV-ZDUSSCGKSA-N 395.274 5.259 30 20 GKED C[C@@H](Oc1ccccc1C#N)c1nc(-c2ccccc2OCc2ccccc2)no1 517630544 IDRPKSLVCMTGBY-QGZVFWFLSA-N 397.434 5.327 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(Sc2ccccc2)CCCC1 518362294 NVPQDQLVJUZCBZ-QGZVFWFLSA-N 396.581 5.982 30 20 GKED C[C@@H](CC(C)(C)c1ccccc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 518755418 HTTGMUFLMAQLGL-ROUUACIJSA-N 395.572 5.959 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)cc1 519485120 FZJOHUFVZRMEPU-RBUKOAKNSA-N 388.433 5.401 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(Cl)c1 521093869 JXAHGSKILFFEJD-UHFFFAOYSA-N 376.843 5.759 30 20 GKED C[C@H](Nc1ccc(NC(=O)Cc2ccc(C#N)cc2)cc1Cl)c1ccccc1 522219417 YDTSHLDUSNHGJC-INIZCTEOSA-N 389.886 5.566 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccc(F)c2F)c1 522640016 PBLWOINRIQAJHW-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CCSCc1ccc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 524626695 XMJFSXZFNPTVOP-QGZVFWFLSA-N 379.312 5.241 30 20 GKED N#Cc1ccc(SCc2nc(-c3cccc(C(F)(F)F)c3)no2)c(F)c1 525503814 BGSGMNYBHMOZIQ-UHFFFAOYSA-N 379.338 5.058 30 20 GKED Cc1ccc([C@H](C)N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 532931180 VGCYBKIMQBELLI-OALUTQOASA-N 395.572 5.329 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1C1CC1 534249210 GERWKXSEMKFNRX-QGZVFWFLSA-N 393.535 5.293 30 20 GKED Cc1ccc(C#N)cc1NC(=O)NCCc1csc(-c2ccc(Cl)cc2)n1 535464964 WJYXVOHPSJBBTM-UHFFFAOYSA-N 396.903 5.008 30 20 GKED Cc1cc(C)n(-c2ccc(CN[C@@H](C)c3cccc(C#N)c3)c(C(F)(F)F)c2)n1 539498953 YOEGWIUFZHBANY-INIZCTEOSA-N 398.432 5.230 30 20 GKED CC(C)[C@H]1C[C@H](CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 542881759 LBVXEAFOMXNTLL-VGOFRKELSA-N 378.472 5.130 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(CC(F)(F)F)no2)c1 545567899 NROWZDNTMAVGOT-UHFFFAOYSA-N 379.725 5.159 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 554757478 OATCQHCNGHLETM-GOSISDBHSA-N 391.393 5.201 30 20 GKED C=CCOc1ccc(CNC(=O)N(Cc2cccs2)Cc2cccs2)cc1 558107200 SNHKXDPAWQQUAM-UHFFFAOYSA-N 398.553 5.286 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@@H](CCCC#N)c1ccccc1 559856980 APIYGOZBORYKFD-UGKGYDQZSA-N 377.532 5.552 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1 560008479 OLUXIRPZHGVSLB-HNNXBMFYSA-N 394.302 5.207 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cnc(-c3ccncc3)s2)cc1 560928977 WZFNTHYBKGOHKW-UHFFFAOYSA-N 382.492 5.034 30 20 GKED CC(C)c1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cs1 588349150 ZJHIZPKMJUQMMP-ZDUSSCGKSA-N 387.917 5.533 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC[C@@H]1CCc2ccccc2N1 593758373 SXGGFRXGLCIWRL-WMZOPIPTSA-N 394.544 5.019 30 20 GKED N#CC1(CC(=O)Nc2c(Cl)cc(C(F)(F)F)cc2Cl)CCCCC1 598842569 FGMHWEWWBAUUDK-UHFFFAOYSA-N 379.209 5.815 30 20 GKED Cc1nc(CCC(=O)N(c2ccc(C#N)cc2)C2CCC2)oc1-c1ccccc1 598887555 WZPZVJJEWOGOEO-UHFFFAOYSA-N 385.467 5.040 30 20 GKED CCc1cc(C#N)c(NC(=O)Cc2csc(-c3ccccc3Cl)n2)s1 604029861 ILJSIUXGMPAAHX-UHFFFAOYSA-N 387.917 5.140 30 20 GKED N#CCCCOc1cccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)O)c1 608845958 LODGCEDAMMEKSR-VKAVYKQESA-N 384.435 5.102 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 609377104 OJOQKSQSYNOSJR-ZBFHGGJFSA-N 392.446 5.613 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)C(=O)Nc1ccccc1 609387145 POOZEZDFPJPJPB-CYBMUJFWSA-N 393.434 5.150 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCCC1 609399150 BEXZHRIEUYYASX-JTSKRJEESA-N 393.556 5.991 30 20 GKED CCOc1ccc([C@@H](C)NCc2cccc(OCc3ccccc3C#N)c2)cc1 609432757 PNNVJWXDVDHSID-LJQANCHMSA-N 386.495 5.387 30 20 GKED CCN(CC(F)(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723077 KQBPKNPBPRHQKA-UHFFFAOYSA-N 382.769 5.028 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)NC(c1cccs1)c1cccs1 610016047 BNBZPMYJJGMZAU-UHFFFAOYSA-N 397.525 5.380 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1csc(-c2ccc(OC)cc2)n1 615347125 ZIBJKRYDBXDPSC-UHFFFAOYSA-N 380.513 5.016 30 20 GKED C=CCC1(C(=O)N[C@H](C)c2ccc(O[C@H](C)c3ccccc3)cc2)CCOCC1 617940300 GXIJFTZKXVBHIL-WOJBJXKFSA-N 393.527 5.377 30 20 GKED CC[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1 618562078 VCRBVAWHWBDWPM-FXUDXRNXSA-N 378.360 5.508 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C#N)c(Cl)c3)s2)cc1 619755381 GVVZFZBQZATQRC-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc4ccccc4[nH]3)c3ccccc3n2)o1 642280813 ABDBSNNKSKIGAM-KRWDZBQOSA-N 392.418 5.170 30 20 GKED CC(C)(CC(=O)N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F)C(F)(F)F 648582466 ZHCZUTMCROHQIF-CYBMUJFWSA-N 384.295 5.005 30 20 GKED Fc1cccc(-c2cnc(CN3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)o2)c1 673856486 MGOCTXJTFUDUIA-TXEJJXNPSA-N 396.306 5.043 30 20 GKED CC(C)CC[C@H](NC(=O)NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 727844777 MCUKOVUBULDCSP-NRFANRHFSA-N 399.922 5.219 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2nc3ccc(Cl)cc3o2)cc1 728701828 WMUOHARAUUABGF-AWEZNQCLSA-N 399.903 5.217 30 20 GKED Cc1cccc2c1C/C(=C\c1cccc(NC(=O)c3ccccc3Cl)c1)C2=O 729150841 NHFQQRDZPKWGJK-SFQUDFHCSA-N 387.866 5.723 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)Cc3coc(-c4cccs4)n3)cc2)cc1 729944249 CGELHYXENXGCKO-UHFFFAOYSA-N 386.432 5.090 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 731287424 BGKSGRIGSVTQGS-BHDDXSALSA-N 392.458 5.325 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccccc3OCc3cccnc3)c2c1 734306223 CCMIWTIFKSVQGR-DHZHZOJOSA-N 384.435 5.047 30 20 GKED Cc1ncsc1/C=C1/CC(c2ccccc2)C/C(=C\c2scnc2C)C1=O 742429356 NBMGIHYSRFZKLV-OMYAATJGSA-N 392.549 5.830 30 20 GKED CCCCCCOCc1cccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)c1 743128244 VUHJGYUEROYJCW-GOSISDBHSA-N 379.504 5.538 30 20 GKED N#Cc1ccc(C(=O)OCc2ccc(Oc3cccc(Cl)c3Cl)cc2)nc1 744985804 YMWXSROZYVXSRW-UHFFFAOYSA-N 399.233 5.409 30 20 GKED Cc1ccc(CCCCC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 746416582 NYUOHTRSZMYPDJ-QFIPXVFZSA-N 384.479 5.209 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 749342204 GFWWBMNTVVDEEO-SFGZWBMOSA-N 397.334 5.255 30 20 GKED C#CC[C@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccccc1 756995465 IDLXSEBWPJVWOF-FQEVSTJZSA-N 382.916 5.230 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3ccc(SC(F)F)cc3)cc2N1 758024414 DPHZRUOFKLIETD-ZZXKWVIFSA-N 383.466 5.003 30 20 GKED C=CC[C@@H](N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccncc1 766018730 GQQMSYXXQOCATF-CRAIPNDOSA-N 379.485 5.686 30 20 GKED CN(C)C(=O)Sc1cccc(CSCc2ccccc2C(C)(C)C#N)c1 767827699 HLKVCKPATLSVHA-UHFFFAOYSA-N 384.570 5.695 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(F)cc2)C2CCCC2)ccc1OC 774450628 VDUKYOPXJSJEGT-QPPBQGQZSA-N 396.506 5.536 30 20 GKED C=CCCC[C@H](C)NC(=O)c1c(C)nn(Cc2ccccc2Cl)c1Cl 775923176 KCNSKQJSARCRSQ-ZDUSSCGKSA-N 380.319 5.021 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F 780682856 YSDZNDRNBAQXMJ-KUHUBIRLSA-N 385.414 5.015 30 20 GKED Cc1cc(C)c(N2CC[C@@H](Nc3ccccc3S[C@H](C)CC#N)C2=O)c(C)c1 788796541 FVKPCAJHTBPCTE-UYAOXDASSA-N 393.556 5.224 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1coc(C(C)C)n1 794980478 BWRSBFVAOSUFGY-UHFFFAOYSA-N 389.381 5.110 30 20 GKED N#Cc1ccc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)cc1F 796471370 PLSYHBYIVFADJL-QGZVFWFLSA-N 396.680 5.380 30 20 GKED O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)[C@@H](F)c1ccc(C(F)(F)F)cc1 801679631 NIDQEDOEQAMPKE-SWHYSGLUSA-N 385.323 5.201 30 20 GKED Cc1nc(COC(=O)c2cc(C#N)ccc2Cl)oc1-c1ccc(Cl)cc1 803831385 PVQIGDCJTWVAFK-UHFFFAOYSA-N 387.222 5.186 30 20 GKED N#CCCCCCC(=O)OCc1csc(-c2ccc(C(F)(F)F)cc2)n1 805694911 ABMXZIWITWZFIC-UHFFFAOYSA-N 382.407 5.346 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1nc2ccccc2n1C(F)F 812377188 COWDCYHQLSRCOI-UHFFFAOYSA-N 385.805 5.469 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)c(F)cc1Cl)c1cccc(Cl)c1Cl 815536710 CSSBGINQZXKBNX-ZDUSSCGKSA-N 392.044 5.434 30 20 GKED COCc1ccccc1/C=C(C)/C=C/C(=O)c1ccc(N2CCCOC2=O)cc1 834444981 ZLYLMPGWNDBLSP-WXLRXACCSA-N 391.467 5.022 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2csc(-c3ccccc3)n2)c1 840730156 TZRBANOAFLKCEY-QFBILLFUSA-N 377.513 5.342 30 20 GKED CC(C)c1csc(SCC(=O)Nc2ccccc2S[C@@H](C)CC#N)n1 845329833 DZHQWCZEDJJYQU-ZDUSSCGKSA-N 391.587 5.392 30 20 GKED Fc1ccccc1NC(=S)NC(CCC(F)(F)F)CCC(F)(F)F 849302630 DJZAOPOZPJFPEX-UHFFFAOYSA-N 376.341 5.166 30 20 GKED CCc1cc(O)nc(-c2cccc(N=Cc3cc(Cl)cc(Cl)c3O)c2)n1 915982797 COPVKKPMOCRIKH-UHFFFAOYSA-N 388.254 5.175 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2[nH]1 916844444 JXCGUTMEGAZDHN-CCCPALQASA-N 387.439 5.320 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)(F)F)cc2)cc1 916948369 URFULDSNQBXPQI-FZKQIMNGSA-N 388.389 5.180 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)c1 918714574 ZOWAXPGWVOMUCA-TWGQIWQCSA-N 380.856 5.143 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccccc3Cl)o2)ccc1Cl 1776033347 MOHDUHFXKOIORI-UHFFFAOYSA-N 375.211 5.398 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Oc2ccc(F)cc2)cc1 1776076229 CWCUYSOVWRISNW-UHFFFAOYSA-N 382.366 5.291 30 20 GKED COc1ccc2c(c1)CC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776127384 RJQVDVLTLQZWDY-KGENOOAVSA-N 384.431 5.273 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1cccc(Cl)c1Cl 1776180254 KLCJLZRZGKTPIQ-HNNXBMFYSA-N 390.719 5.522 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)c2cc(C)cc(C)c2)c1 1776787943 IWNLJZLMYCRPMX-QHCPKHFHSA-N 383.532 5.568 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC(C)C)cc2)c2cc(C(=O)O)oc12 1777361017 KPKKLBCKQBPJNA-UXBLZVDNSA-N 396.464 5.536 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2c(Cl)cccc2Cl)cc1 1777639357 HNLXFLQTWZCZEB-KHPPLWFESA-N 379.239 5.133 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1ccccc1 4285523 GUZISVDJKLYPBF-UHFFFAOYSA-N 380.498 5.140 30 20 GKED Cc1noc2nc(C3CC3)cc(C(=O)Oc3ccc(-c4ccc(C#N)cc4)cc3)c12 14203248 NWQAZKZQMKPKPH-UHFFFAOYSA-N 395.418 5.167 30 20 GKED CCOc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1OCC 24819231 XSQBMLILXZUSSZ-UHFFFAOYSA-N 386.451 5.275 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1nc2c(c(C)c1C#N)CCC2 24851594 WBDGCDRSZNFIEI-GOEBONIOSA-N 393.556 5.383 30 20 GKED C=CCn1c(SCc2csc(Br)c2)nnc1-c1ccoc1C 47972619 HRIMMKYQJIRTII-UHFFFAOYSA-N 396.335 5.149 30 20 GKED C=CCN(C(=O)c1ccnc(SCC)c1)c1nc(-c2ccccc2)cs1 52954795 KLNRBSIFYNROKQ-UHFFFAOYSA-N 381.526 5.150 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OCc2ccccc2)cc1 63388388 NXJOXRJHGGADKM-UHFFFAOYSA-N 397.478 5.357 30 20 GKED CCO[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 67581826 ANVRODYTCKFBBY-QUCCMNQESA-N 397.906 5.028 30 20 GKED CC(C)COC(=O)Nc1cccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1 119877438 LLRKRLFRTWIMIP-FQEVSTJZSA-N 394.475 5.058 30 20 GKED N#C[C@H](C(=O)c1cccc(COc2cccc(F)c2)c1)c1nc2ccccc2o1 172086866 YCJCWUPZYGNYJS-LJQANCHMSA-N 386.382 5.036 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F 175780218 GELKQQNZUXVSDR-NSHDSACASA-N 382.382 5.491 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(CCC(F)(F)F)cc1 176303159 GQAXDQMIADNEGL-UHFFFAOYSA-N 389.421 5.497 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 179389873 RYNCWVDDJCUGHZ-ISBHARSQSA-N 379.872 5.138 30 20 GKED Cc1cnc([C@H](C)CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 185012031 NVPXAODJKMIHOO-CQSZACIVSA-N 392.484 5.041 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1ccccc1 187445033 VVDOFHSPSPFONU-LJQANCHMSA-N 396.918 5.265 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(NC(=O)CCC)cc1 191514250 JXPIKPYHNDKMNO-UHFFFAOYSA-N 393.531 5.599 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N(CCC(F)(F)F)CC(F)(F)F 279099770 JEGATUIUPPINRO-UHFFFAOYSA-N 382.226 5.054 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1nc(C(F)(F)F)ccc1C#N 301306243 UVGXJQCBJRRNII-NSHDSACASA-N 388.418 5.577 30 20 GKED Cc1ccc(SCCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 303363800 IAAIBNDWJCYLCO-MRXNPFEDSA-N 385.558 5.161 30 20 GKED CC(C)C[C@H](/N=C(/O)N1CCn2c(C3CCCC3)nnc2[C@@H]1C)c1ccccc1 329490912 VFTWUVYSIGLWTQ-PXNSSMCTSA-N 395.551 5.014 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)[C@H](C)c1ccc(C#N)cc1 409803985 ZWYVAYVMLIQEOW-UPRAQXHNSA-N 387.310 5.578 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCc1ccc(C#N)s1)C1CC1 422213431 GAKUHNROIRRCBY-GFCCVEGCSA-N 393.434 5.074 30 20 GKED C=CCn1c(SCc2nc(C)c(C)s2)nnc1-c1ccc(Cl)cc1 426502599 CVTWYHWDIPVWGQ-UHFFFAOYSA-N 376.938 5.150 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 433424953 UPQQIYOHWRJURX-XBLGPDGASA-N 395.440 5.489 30 20 GKED C=CCOc1ccccc1CNC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 434078518 GRPFTLMETKHPFJ-XBLGPDGASA-N 393.449 5.017 30 20 GKED CCCOc1cccc(CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 434212381 ULAKAICMHLJYFM-QGZVFWFLSA-N 397.544 5.234 30 20 GKED C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438069574 CIIQRAYEWBYLPJ-HOYKHHGWSA-N 399.469 5.236 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H](C)C2(C)CC2)cc1 438596561 AZOARNGRPDZQNE-HNNXBMFYSA-N 379.460 5.011 30 20 GKED C[C@H](NCCC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 438833156 WLJUKTVOMVPFJW-SFHVURJKSA-N 385.467 5.030 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCC[C@H]3c3cccc4ccccc34)o2)c1 441216322 CUILIDVCNVVQMQ-QFIPXVFZSA-N 380.451 5.099 30 20 GKED CC(C)(C#N)CCCCN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 444619317 JSTYESUMIHPYCS-UHFFFAOYSA-N 390.531 5.409 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)c1 447623317 CAWHIRNFHVDRBI-UHFFFAOYSA-N 381.262 5.979 30 20 GKED COCC[C@@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 467370213 NXHKUQZHMAVZDC-IBGZPJMESA-N 393.487 5.021 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)cc1 469037899 SRIMYSXLRTVRQO-UHFFFAOYSA-N 378.378 5.200 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c(Cl)ccc(F)c1C 474780210 NGRYZTQWTYWVPH-UHFFFAOYSA-N 395.821 5.407 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](c2ccc(F)cc2)C[C@@H]1C 475545806 BZWKHTBJDCBPJM-FXAWDEMLSA-N 380.507 6.088 30 20 GKED C=C(C)[C@H](NCc1ccc(OCc2cccnc2)cc1)c1ccc(F)c(F)c1 479418666 XZYZJBHQORZIGS-QHCPKHFHSA-N 380.438 5.346 30 20 GKED CC(C)(C#N)CNC(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 482387844 DMLLNZCIJPJGKD-UHFFFAOYSA-N 377.366 5.169 30 20 GKED N#CCCCOc1cccc(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)c1 482995354 ZTYBLPWEFRDEDN-GOSISDBHSA-N 376.378 5.044 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC(C)(C)c1ccccc1 485492814 PZVWSNPPKBZIBR-MRXNPFEDSA-N 384.570 5.545 30 20 GKED Cc1ccc2ncc(C#N)c(OCC(=O)Nc3ccccc3-c3ccccc3)c2c1 488287682 QQLLTDYYHRLCTP-UHFFFAOYSA-N 393.446 5.099 30 20 GKED CC(C)(C)n1ncc(C(=O)Nc2ccc(C#N)c(Cl)c2)c1-c1ccccc1 489519711 XPCMCRZHXUYALY-UHFFFAOYSA-N 378.863 5.082 30 20 GKED N#CC1(CCCN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)CCOCC1 499603036 QIEXQFHFEWWIOJ-QFIPXVFZSA-N 382.935 5.314 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ncc(C#N)cc3Cl)s2)cc1 505769809 XIAXQEZDKHZKSK-LLVKDONJSA-N 384.892 5.220 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)nn1-c1ccccc1 507918796 HLVKJMVAUSIKRX-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C)C[C@H](C)C#N)cc1 509229311 YFHSTIZNLLBMSV-CQSZACIVSA-N 387.867 5.154 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Sc1nc(-c2ccccc2)ccc1C#N 510173737 VRUWPJAXSFOBHC-MRXNPFEDSA-N 387.508 5.302 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccccc1Br 511778153 YPVBKBNKAHLLOK-UHFFFAOYSA-N 397.297 5.230 30 20 GKED C=C(C)CN(CC(=O)Nc1c(C(C)C)cccc1C(C)C)Cc1ccc(CO)o1 512193229 GRKUNNKSIYUUDW-UHFFFAOYSA-N 398.547 5.036 30 20 GKED CC[C@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 513657132 BWSQMHPPGSSBAI-MOPGFXCFSA-N 378.472 5.193 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1 516327831 YHDVMHUGSHETKF-INIZCTEOSA-N 392.421 5.087 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(-c2ccccc2)cc1 518140264 JDNUXOPEUPBJMY-GOSISDBHSA-N 386.520 5.787 30 20 GKED C[C@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(C#N)cc1 518277270 CCXTVIMHLKXGRB-INIZCTEOSA-N 389.886 5.315 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)on1 518742936 DJLZDZUMNAPNFG-ZDUSSCGKSA-N 397.887 5.642 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(-c4ccccn4)s3)cc2)c1 519511151 IWEQWXUUWSVHFV-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 521140998 FPJAGXNBBPWOOH-PXAZEXFGSA-N 379.312 5.103 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCCc1cccc(F)c1 521867377 PBRRFGVOCDVEGI-UHFFFAOYSA-N 390.483 5.211 30 20 GKED Cc1cc2cc(NC(=O)c3cccc(COc4cccc(C#N)c4)c3)ccc2[nH]1 522320092 CKTLLVNKGDFNPI-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1cc(F)ccc1F 523956088 XPJBVFUIWZOQMY-UHFFFAOYSA-N 398.796 5.559 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(O[C@@H](C)c3ccccc3)nc2)n1 531091619 KDKFCNRRCRBSMP-MAUKXSAKSA-N 391.496 5.292 30 20 GKED CC(C)c1nc2cc(NC(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)ccc2o1 531221185 LTUUKXPFOPJZSF-ICSRJNTNSA-N 388.471 5.255 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)cc1 533598383 ZRVDUTZGEVCHIE-IRXDYDNUSA-N 379.529 5.696 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccccc1CCC(F)(F)F 535472019 DHVPMROTLPVSPM-CQSZACIVSA-N 392.446 5.828 30 20 GKED COc1ccc(CNc2cc(-c3ccccc3)cnc2C)cc1OCCCC#N 540620256 IIDPNVROZDDUDQ-UHFFFAOYSA-N 387.483 5.360 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542968363 XDKNWYRVEMQTEJ-HZPDHXFCSA-N 387.483 5.201 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)s1 544858771 FUFYXIXESTVWTK-LLVKDONJSA-N 388.464 5.763 30 20 GKED N#CCCN(C(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccc(F)cc1 554166419 ZUNHPQCDZBCDBO-UHFFFAOYSA-N 391.427 5.256 30 20 GKED N#CCCN(C(=O)c1csc(-c2cccc(Cl)c2)n1)c1ccc(F)cc1 558050666 OFFXNCREDZVTNA-UHFFFAOYSA-N 385.851 5.163 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@H]1c1cccs1 558450752 VULFLBXZTPXOEW-WBVHZDCISA-N 398.507 5.146 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nc(CN2CCCCCC2)cs1 558938107 ZOIYKRIXAGZYHZ-UHFFFAOYSA-N 387.574 5.050 30 20 GKED Cc1sc([C@@H](C)NC(=O)[C@@]2(C#N)CC23CCCC3)nc1-c1ccc(Cl)cc1 562684099 HJKKWOJFWIKGTH-ASSNKEHSSA-N 399.947 5.423 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc2n[nH]cc2c1 576013989 MAMURMAIKBEKDY-OAHLLOKOSA-N 397.438 5.110 30 20 GKED Cc1nc2ccccc2n1C1CCN(Cc2ccc(C#N)cc2C(F)(F)F)CC1 577993099 NJFLDFMAEICCKF-UHFFFAOYSA-N 398.432 5.072 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CC1 579117902 XXRITYCGRSYLPY-UHFFFAOYSA-N 387.405 5.319 30 20 GKED CC(C)c1nc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cs1 588348962 KJWPFASXVMCDOC-SNVBAGLBSA-N 395.431 5.385 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)C1CCC(F)(F)CC1 594070574 KFTKIHYTFMATIM-KBPBESRZSA-N 381.492 5.416 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(OCc3ccccc3)cc2)c1 603969685 SANCMMYFOMNTRM-UHFFFAOYSA-N 386.451 5.200 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc(CN4CCCC4)c3)c2)cc1 609176238 CSJBAMHASJYFPL-UHFFFAOYSA-N 397.478 5.199 30 20 GKED N#Cc1cccc(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)c1 610168641 UQSFEMVXCNZKRJ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC(C)n1c(SCCC(C)(C)C#N)nnc1-c1ccc(Cl)cc1Cl 610285489 GVMUITCFSDUDRL-UHFFFAOYSA-N 383.348 5.865 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccc(OCC)cc1 612276171 BMJHFRQYCLBTLD-CQSZACIVSA-N 378.925 5.259 30 20 GKED C[C@H]1CCc2c(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)csc2C1 613392143 JQOQRXXAXQLNCM-XJKSGUPXSA-N 378.522 5.486 30 20 GKED C[C@H](NCc1ccncc1OCC(F)(F)F)c1ccc(F)cc1C(F)(F)F 623977956 FUDDGACCXAITEJ-JTQLQIEISA-N 396.306 5.031 30 20 GKED CC(C)[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cn1 679386999 UTXJKYHOAOUQPD-MDHDOXDCSA-N 386.355 5.417 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1OC1CCCC1 680169734 PSGQKNILCFKVSR-IBGZPJMESA-N 386.451 5.055 30 20 GKED N#Cc1ccc(NC(=S)N2CCC(c3cc4ccccc4[nH]3)CC2)cc1Cl 726481971 BGSWFQQXROSGDH-UHFFFAOYSA-N 394.931 5.269 30 20 GKED COc1c(O)cccc1/C=C\C(=O)c1ccc(OCc2ccc(F)cc2)cc1 727685475 OOINBPYMVMBWAF-ZROIWOOFSA-N 378.399 5.015 30 20 GKED Clc1ccc(-c2nc3c(s2)C(=NNc2cncc(Cl)n2)CCC3)cc1 728425740 MIYRXJIKAJBQJG-UHFFFAOYSA-N 390.299 5.059 30 20 GKED CN(C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)c1ccc(C#N)cc1F 729653721 JPOYDPCNTWZTIK-UHFFFAOYSA-N 399.400 5.328 30 20 GKED CCc1ccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)s1 730949056 QKDCKQSGDKBBIX-WEVVVXLNSA-N 382.437 5.077 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1cc(Cl)cc(Cl)c1 731318104 BMNYKNSCWRUPDB-LLVKDONJSA-N 396.368 6.197 30 20 GKED C/C(=C\C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1)c1ccccc1Cl 731645920 UPGUYNYDODDPAV-KQPPXVQYSA-N 378.781 5.143 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cccc(CSCc2ccccc2)c1 734784046 SVIIOFLAEPKYJM-UHFFFAOYSA-N 388.492 5.275 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(N3CCOCC3)cc2)cc1 741469427 SBWUSGNYXMGLTI-NVNXTCNLSA-N 399.490 5.095 30 20 GKED COCc1cccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c1 742429398 PSBJKZXLDJHDPC-HKWRFOASSA-N 385.488 5.866 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2C[C@H](C)[C@@H]2c2ccccc2)c1=S 743395849 UQRZAXZHQDQNIL-OXJNMPFZSA-N 394.519 5.057 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1c(C)nn(-c2ccccc2)c1C 746487960 AQDLOOJPNBGNCD-UHFFFAOYSA-N 387.512 5.449 30 20 GKED CC(C)CCc1nc(CON=Cc2cccc(OCc3ccncc3)c2)cs1 747829612 WEEAISZZGJVXGF-UHFFFAOYSA-N 395.528 5.256 30 20 GKED CC(=NNc1nncc2ccccc12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750917417 HOVDUKVYDXJYDZ-UHFFFAOYSA-N 398.310 5.504 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)OCc2ncc(C3CC3)o2)c1 760518811 JJQAPRLTWPQFTI-UHFFFAOYSA-N 394.814 5.226 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccc3[nH]ccc3c2)cc1 765622484 CNXSNSXALZALGR-ZHBYIJCFSA-N 377.447 5.475 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc3c(s2)CCCC3)ccc1OC 772984292 CSNVTCIPALOEIV-CRAIPNDOSA-N 384.545 5.167 30 20 GKED C[C@@H]1C[C@@H]1[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)cc1 776026568 OWVFVPGECAAUTN-MJWYBRSISA-N 375.299 5.383 30 20 GKED C=CC[C@@H](C(=O)O[C@@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 778417482 HPAKIPZPMWULNQ-LAUBAEHRSA-N 379.500 5.042 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782708003 BINPISPFLSPPOL-OALUTQOASA-N 389.421 5.441 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Br)cs2)c1 786851367 CNNALTFXXWFDJH-WFASDCNBSA-N 379.323 5.042 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1cn(CCC#N)nc1-c1ccncc1)CC2 788353856 JQSUVTFDSTYQCK-KGENOOAVSA-N 396.494 5.195 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)Nc1ccc(C#N)c(Cl)c1 790626942 KVPBYNUXJRKXBQ-UHFFFAOYSA-N 399.878 5.130 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2[nH]1 793118559 SUVBBEPUIZMHAK-ZBFHGGJFSA-N 385.389 5.027 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(N3CCCCC3)c3ncccc23)c1 795002954 VTPCAOXTWHHZBJ-UHFFFAOYSA-N 386.524 5.015 30 20 GKED Cc1c(C(=O)COC(=O)C[C@@H](CC#N)c2ccccc2)sc2ccccc12 795985618 LRELYXQUPDVIAE-QGZVFWFLSA-N 377.465 5.023 30 20 GKED C=CCC[C@H](C(=O)N1CCC([C@@H](O)c2ccccc2C)CC1)c1ccccc1 804515454 JWZRNTOJVDAWDK-BJKOFHAPSA-N 377.528 5.017 30 20 GKED C#Cc1ccccc1CC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 810426462 SJIFOVNIDQVESF-JOCHJYFZSA-N 398.506 5.353 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccccc1 814524227 PSPKQKJJDPXRFU-IBGZPJMESA-N 397.569 5.722 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)Nc2scnc2C(C)C)s1 819558241 QVQDGZURDKNAHO-UHFFFAOYSA-N 387.983 5.057 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2cccnc2)C2CCCCC2)ccc1OC 846151097 VKFOQKISBFJKGT-QPPBQGQZSA-N 393.531 5.182 30 20 GKED CN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](CCc1ccccc1)C(F)F 863246969 CHWYSMHTCRMEQP-KRWDZBQOSA-N 393.890 5.107 30 20 GKED Cc1cc(-c2nc(-c3c(Cl)cccc3Cl)no2)nn1-c1cccc(C#N)c1 904310234 OZUDZQWFVVNPAH-UHFFFAOYSA-N 396.237 5.076 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2nc1C 915086828 NPQOCWZTFHBXRM-JOCHJYFZSA-N 392.462 5.154 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)o2)cc1 915087087 PKERCUKGZRRMLM-QFIPXVFZSA-N 396.421 5.993 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1sccc1Br 915113967 YWTMWARCPJBHPB-WAYWQWQTSA-N 394.290 5.669 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2cccs2)cc1 915352176 ILLOVKKNNMLUSH-SFTDATJTSA-N 387.508 5.773 30 20 GKED Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1N=Cc1cc2ccccc2nc1O 921138691 YRJIRBGFZVRANS-QGZVFWFLSA-N 387.483 5.014 30 20 GKED O=C(O)c1ccc(NN=C2CCCCC[C@@H]2c2ccccc2C(F)(F)F)cc1 1776013462 XTAZDPFIRPQXMA-QGZVFWFLSA-N 390.405 5.919 30 20 GKED CC(=NNc1cc(Cl)nc(Cl)c1)c1sc2ccccc2c1C(=O)O 1776081819 JKLPJLKMJBWRPE-UHFFFAOYSA-N 380.256 5.137 30 20 GKED CC(C)CC(=NNc1ccc(CC(=O)O)cc1)c1cccc(C(F)(F)F)c1 1776084409 NMNQOGYHKNOECE-UHFFFAOYSA-N 378.394 5.195 30 20 GKED C=CC[C@]1(C(=O)O)CCCN([C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)C1 1776154005 RCEJVWORRRDVRS-BTYIYWSLSA-N 388.895 5.107 30 20 GKED C[C@@H]1/C(=C\c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2c(O)ccc(F)c21 1776586631 IZDNZTKKEMEWED-RNEAKCBISA-N 388.394 5.280 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc3[nH]c(C(=O)O)cc3c2)cc1 1776786614 GGCAYEJZSVKIRH-UHFFFAOYSA-N 392.499 6.021 30 20 GKED COc1c(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)cccc1C(C)(C)C 1777254515 JMUDNHFNVNNZDP-QINSGFPZSA-N 396.483 5.132 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(-c2ccccc2C(=O)O)cc1 1777545296 APCJSIURFROPJX-SDNWHVSQSA-N 388.467 5.342 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)[C@@H](CC=C)C(=C)C)cc2)CCC1 1789458311 WAJCQEVMUXSCTQ-QFIPXVFZSA-N 392.543 5.083 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(-c3ccccc3)o2)nnc1-c1ccccc1 7833170 PUZUBYYKMPSYMS-HNNXBMFYSA-N 389.484 5.034 30 20 GKED C=CCn1c(SCC(=O)Nc2ccccc2C(C)C)nnc1-c1cccs1 10303401 DDSIONKTNBOTLM-UHFFFAOYSA-N 398.557 5.047 30 20 GKED N#CC1(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)CCCCC1 57398163 WQNWTQFCQNJDSL-UHFFFAOYSA-N 381.863 5.005 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 60036242 HLQSTQKURWXWQK-SFHVURJKSA-N 399.494 5.913 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cccc(OCc2ccccc2C#N)c1 65622307 OYACJDSOTRNHSA-UHFFFAOYSA-N 388.492 5.027 30 20 GKED CCC[C@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 66861213 RBDBOPDCRPJOKH-HKUYNNGSSA-N 381.545 5.150 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCO[C@@H](C)c1ccccc1 66955135 YKWXCHUMHQFKIT-ROUUACIJSA-N 397.544 5.370 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 69354327 YOGJHHDHRINEID-GFCCVEGCSA-N 381.259 5.100 30 20 GKED COc1ccc(Cl)cc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 109028863 QFYHMSNIFYMPMT-ZDUSSCGKSA-N 389.908 5.065 30 20 GKED Cc1cscc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 123497130 INXKYVBLYVRRFO-UHFFFAOYSA-N 379.460 5.302 30 20 GKED CC[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1c(C)noc1C 124561135 SEBSWLLZIWHIBA-FQEVSTJZSA-N 390.443 5.228 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(NC(=O)C3CCCCC3)c2)cc1 152394149 IQKHIUOEXWAJSD-KRWDZBQOSA-N 377.488 5.108 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1 160480130 KSGSTFJHNDUXOP-AWEZNQCLSA-N 394.359 5.220 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@H](C)c1ccc(OCC#N)cc1 181777651 SWYKMULFBGKBNO-XMSQKQJNSA-N 376.525 5.594 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)n1 194079735 YNMCTUZLQCPXRS-MRXNPFEDSA-N 395.465 5.001 30 20 GKED C[C@H]1CCCCN1Cc1ccccc1CNCc1cccc(OCCCC#N)c1 237522064 BFNUMPYTUICRIO-NRFANRHFSA-N 391.559 5.033 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1snc(Cl)c1C#N 301204622 QZVJULHCTZFFNX-VIFPVBQESA-N 378.885 5.412 30 20 GKED C[C@@H](/C(O)=N/[C@H]1CCCC[C@H]1C)N1CCC([C@@H]2C(O)=Nc3ccccc32)CC1 328679442 BPMCQJWVCMTFGJ-DFPKUZHUSA-N 383.536 5.008 30 20 GKED Cc1nc(CN2CCC(C/N=C(/O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CC2)oc1C 329184026 PBODYESHQWRYEP-PCCBWWKXSA-N 387.568 5.066 30 20 GKED C/C(O)=N/C1(c2noc([C@@H]3C[C@@H]3c3ccc4ccccc4c3)n2)CCCCC1 329441257 KETHOELVYBYJDN-WOJBJXKFSA-N 375.472 5.630 30 20 GKED Cc1sc(N=C(O)CN2CCCC[C@H]2c2nc3ccccc3o2)c(C)c1C 329992840 KTNNPQFDRVNIMM-KRWDZBQOSA-N 383.517 5.630 30 20 GKED N#Cc1nc(Oc2ccc(C(=O)Nc3ccccc3)cc2)ccc1C(F)(F)F 409723813 VLKCJHUUKBHHPO-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#CC1(CCCN(Cc2cccc3ccccc23)C2CCCC2)CCOCC1 410345721 DJDLZFSUKMZFPR-UHFFFAOYSA-N 376.544 5.685 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425663028 PGOXKIUOFHJMOW-OALUTQOASA-N 390.531 5.470 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)Cc1ccc(C#N)cc1 432092175 HHSVRKHNEKTVLC-UHFFFAOYSA-N 388.492 5.040 30 20 GKED CC(C)(C)OC1CC(CCNC(=O)c2ccccc2Oc2ccccc2C#N)C1 432267921 MVBMDENDXCOBML-UHFFFAOYSA-N 392.499 5.064 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 437863732 HRQVJECCOUFEJN-UHFFFAOYSA-N 387.439 5.023 30 20 GKED C[C@H](C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccc(Br)s1 443811959 HJSUSOZCXSMLKE-VIFPVBQESA-N 395.347 5.065 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(-c3ccc(Cl)s3)cn2)c1 448514258 WGFKAQFVNXBEDF-UHFFFAOYSA-N 385.901 5.331 30 20 GKED N#CCSCCCN(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 451010384 PDLAZEMRFWKEMF-UHFFFAOYSA-N 380.344 5.037 30 20 GKED COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)Nc1ccc(CC#N)cc1Cl 455725903 DNIDKIBAHDAPAG-MGPUTAFESA-N 397.906 5.420 30 20 GKED CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 458670859 XOVSHALTQPQDFS-DQLDELGASA-N 399.922 5.150 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2c(F)cccc2F)CC1)c1ccccc1 458829979 FUGYWSRICPLJKS-OAQYLSRUSA-N 397.469 5.289 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)c(Cl)c1 464135192 XCMQCMPKHDCDMY-UHFFFAOYSA-N 391.736 5.138 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1 473887045 OFVYYTMCZJLUEW-HNNXBMFYSA-N 382.435 5.039 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cc(F)ccc1F 474260506 SHIRWGPZSNCWLD-AWEZNQCLSA-N 397.265 5.407 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)C[C@@H](CC#N)c2ccccc2)c1C 475032829 YFBPXFPWMMGWRY-HXUWFJFHSA-N 385.467 5.517 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N(CCC#N)CC1CC1 477985786 CKRZEASZDNTQBI-UHFFFAOYSA-N 386.293 5.068 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@]1(C)CCCO)c1ccc(C(F)(F)F)cc1 483190947 DBKDBSAJLHNJMD-ICSRJNTNSA-N 398.469 5.049 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc4nc(-c5ccccc5)oc4c3)[nH]c12 483631910 CAVFTJQPWBISNL-KRWDZBQOSA-N 392.418 5.170 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)cc2F)nnc1-c1ccc(F)cc1 497685815 GWKYVMAFNYLHNU-LBPRGKRZSA-N 375.419 5.402 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccnn3-c3ccc(C#N)cc3)c(F)c2)cc1 497962129 YVNOLJXQOUAZHA-UHFFFAOYSA-N 396.425 5.111 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)c2cccc(C#N)c2)n1 499254249 ULBCYLJSKSIMGM-UHFFFAOYSA-N 385.901 5.380 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc(C#N)cc3[N+](=O)[O-])s2)cc1 505769345 QVNVPSFTIALLLQ-GFCCVEGCSA-N 394.456 5.080 30 20 GKED CCCN(C(=O)NCC(C)(C)CCC#N)[C@@H](C)c1ccccc1Br 513151583 WORHSFSLHJGKSW-HNNXBMFYSA-N 394.357 5.262 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1nc2ccccc2s1 513670820 BYNGDSKNXBNOFJ-CYBMUJFWSA-N 393.855 5.403 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 516380483 ONXAUKSILOLDEU-ORAYPTAESA-N 388.298 5.473 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1ccc(C#N)cc1 518026973 BNYOVXWWLHECMV-CYBMUJFWSA-N 398.434 5.379 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 518668828 OQDUUXKSQODWLS-AWEZNQCLSA-N 377.469 5.154 30 20 GKED CC(C)N(Cc1ccco1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 519199100 NLBVBZFYDYPITO-UHFFFAOYSA-N 375.428 5.386 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](Nc2cccc(F)c2C#N)CCC3)cc1 520271533 VQFLUGWJSJPSKN-GOSISDBHSA-N 379.460 5.319 30 20 GKED CCOc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1Cl 521953707 OWQYPNMMVOCIJU-UHFFFAOYSA-N 393.830 5.050 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCCC4(CCCCC4)C3)s2)cc1 523626134 OTJJUINMDXJBTH-UHFFFAOYSA-N 394.544 5.184 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3c3cccs3)c2)cc1 524664577 SKKRSTSDBWBKBR-FQEVSTJZSA-N 389.480 5.781 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)c1C#N 524962708 NQYZNHLWPCPKCY-UONOGXRCSA-N 394.418 5.131 30 20 GKED N#CC1(c2ccccn2)CCN(C(=O)Nc2cccc(C3CCCCC3)c2)CC1 529155792 JWLKDHRHPSFBMW-UHFFFAOYSA-N 388.515 5.219 30 20 GKED COc1ccc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)cc1-c1ccccn1 534360619 OMLNNVMMWXUEAF-JOCHJYFZSA-N 399.494 5.049 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 544834786 NTJXAJZJCKEUIM-INIZCTEOSA-N 376.378 5.006 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccc4[nH]ccc4c3)no2)c2ccccc21 545033787 OZPDIKYUKQHPAH-VQHVLOKHSA-N 379.423 5.257 30 20 GKED CN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccc(OCc2ccccc2)cc1 548706684 SSHDUZGAGYVAHF-UHFFFAOYSA-N 376.843 5.067 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(O)c(Cl)c1 553421573 ZXIISFTVDVRHAO-UHFFFAOYSA-N 378.815 5.270 30 20 GKED C=CCN(C(=O)c1ncoc1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 553729767 ZMYRDTHWBPEMTR-UHFFFAOYSA-N 394.283 5.246 30 20 GKED Cc1cccc(COc2cccc(C(=O)N(CCC#N)c3ccc(F)cc3)c2)c1 553943906 KDQZROQDPQZKDP-UHFFFAOYSA-N 388.442 5.274 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C#N)c1ccccc1C(F)(F)F 558097024 RMBIXRNVVMKSSD-LLVKDONJSA-N 383.211 5.190 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(-c3cccc4cccnc34)cc2)c(Cl)c1 563769751 HJSYMOSBQIEWLZ-UHFFFAOYSA-N 383.838 5.679 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccnc2)cc1 564175606 QQYJQQFWLGDXLL-XZOQPEGZSA-N 398.466 5.178 30 20 GKED C[C@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1 564307699 QVRHEPJEXJPBSK-CQSZACIVSA-N 378.369 5.285 30 20 GKED Cc1oc(-c2cccs2)nc1COc1c(Br)cccc1CC#N 571212010 QVDMUGDBINKFHX-UHFFFAOYSA-N 389.274 5.119 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1Cl 571964600 CYGXYDXUGROFHY-OAHLLOKOSA-N 395.915 5.646 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CC1 572685968 RBQRDMAOCXBBFH-OAHLLOKOSA-N 388.427 5.096 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 591724108 WGVUOEYISABKRR-HNNXBMFYSA-N 382.504 5.673 30 20 GKED N#CC1(CNC(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)CCCC1 593202274 PPQSAKWKRYIINH-UHFFFAOYSA-N 394.422 5.034 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)C1 596697027 JSXOMLWMXQZGCK-MRXNPFEDSA-N 383.879 5.077 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)Nc3ccc(C(C)(C)C#N)cc3)oc12 603658149 PPENFHNUZDCFPY-OAHLLOKOSA-N 391.471 5.515 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc3cccc(Cl)c3c2Cl)s1 604028897 ZBNVHAHUCZRLBG-UHFFFAOYSA-N 381.309 5.956 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1cc2ccccc2n1CC#N 609162939 YLFNDXWXGFSTNK-ZDUSSCGKSA-N 386.282 5.305 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccccc3C(F)(F)F)c2)cc1 609176277 CWPLULVOSOMHDT-UHFFFAOYSA-N 382.341 5.622 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccc(F)cc1 609600652 QYQIBBCLWHJZKU-OAHLLOKOSA-N 393.468 5.159 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccc(F)cc3Cl)c2)cc1 609643003 UKATVDKIEUFVGO-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609682635 UQPSQOHQZVOUKM-FXAWDEMLSA-N 398.466 5.155 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)Nc1ccc(OCc2ccccc2)cc1 610206600 QQPQEFWFTKPVMT-KRWDZBQOSA-N 388.492 5.257 30 20 GKED CCCOc1c(Cl)cc(CN[C@@H]2CCc3cc(C#N)ccc32)cc1OCC 618741853 MWCGAISIRMXSHC-HXUWFJFHSA-N 384.907 5.176 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 619479088 KQGPDJLYMUTVDO-CQSZACIVSA-N 382.332 5.367 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Cl)c1SC(F)F 726079249 RVBAQCHNYGJZRU-UHFFFAOYSA-N 388.892 5.936 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C\c1cnc(-c3ccccc3)s1)CC2 727266651 BXNWAKDQKBEHKK-PTNGSMBKSA-N 393.464 5.101 30 20 GKED O=C(/C=C/c1c[nH]nc1-c1ccc2c(c1)OCO2)c1cc(Cl)sc1Cl 728156632 GLPBASABKVEBRD-HNQUOIGGSA-N 393.251 5.070 30 20 GKED Cc1cc(C(=O)Nc2cccc(COCC3CC3)c2)c(C)n1-c1ccc(C#N)cc1 728269527 PHGZUWIJCBLWFX-UHFFFAOYSA-N 399.494 5.145 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416473 DDRATZUVGXPPTQ-CZUORRHYSA-N 382.460 5.204 30 20 GKED CC(C)n1cc(/C=C/C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 732714489 UMVPJBXVMBSQTH-ONEGZZNKSA-N 376.300 5.398 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2ccc(OC)cc2F)cc1F)c1ccncc1 734459837 LIFALBFTXPBZNL-JOCHJYFZSA-N 394.421 5.083 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)c(C)c1 735791487 ZROGDJFIDGRELT-SFHVURJKSA-N 387.483 5.026 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 739155780 VRQLMUDAMGOPQQ-HTAPYJJXSA-N 390.527 5.215 30 20 GKED COc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)c(SC)cc1OC 741165894 SHRKRZXNOYDNOG-SNAWJCMRSA-N 389.325 5.690 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)cc1OC 742377618 ORQKUKBYECUUAP-HSZRJFAPSA-N 392.886 5.108 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cccc(N[C@@H](C)C(C)C)c2C)c1 743409800 CQAHQPQRNQVFQH-ICSRJNTNSA-N 393.531 5.062 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744015074 FTVMAYTXEXIFNC-WMLDXEAASA-N 382.385 5.624 30 20 GKED Cc1ccc([N+](=O)[O-])cc1NN=Cc1c(C(C)C)nn(-c2ccccc2)c1Cl 747061257 FRYVOZCOBVDIRT-UHFFFAOYSA-N 397.866 5.312 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)ccc2c1 747193044 CUDSGVJLHAZRFJ-FVXMCEBTSA-N 376.481 5.318 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1OCCCC#N 747361799 XQTJYFKDNNJQRA-YWEYNIOJSA-N 390.266 5.581 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(SC(F)F)c1 752665419 BQHKRSOMILWTHG-MSOLQXFVSA-N 387.455 5.305 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3ccc(Cl)nc3)cc2)cc1 758737338 QXCZGLOMPBPQIW-UUILKARUSA-N 375.815 5.051 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2nc(-c3ccccc3)co2)cc1 767108561 IVBKETQFJYFWTI-KRWDZBQOSA-N 391.496 5.078 30 20 GKED CCCCCCCOc1ccc([C@H](C)N[C@@H]2CCO[C@]3(CCOC3)C2)cc1 773154123 XENNMDWAOSIANI-XKCSPQBFSA-N 375.553 5.025 30 20 GKED C=C(C)[C@H](NCc1ccc(NC(=O)OC(C)(C)C)nc1)c1ccc(F)c(F)c1 775319386 TVPOKIVSLCMCCY-IBGZPJMESA-N 389.446 5.114 30 20 GKED C=CCC[C@@H](C(=O)OCc1nnc(-c2ccccc2Cl)o1)c1ccccc1 777645725 ZHFOGXAMBHAHTF-MRXNPFEDSA-N 382.847 5.183 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 780675406 WPOVFSCFOLUHGD-KBPBESRZSA-N 391.393 5.221 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(Br)cc1C(F)(F)F 793068345 WBUCLLACWRJYMJ-NSHDSACASA-N 399.210 5.371 30 20 GKED C=CC[C@H](OC(=O)c1cccc(C[S@](C)=O)c1)c1ccc(Cl)c(Cl)c1 797566410 JFZKNGFSWDBXDP-BVZFJXPGSA-N 397.323 5.346 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(CNc3nc(Cl)c(C#N)s3)c2)c1 804361221 JNLOZJCBGLYCCG-UHFFFAOYSA-N 397.891 5.233 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Nc1ccc(CC[C@@H](O)c2ccccc2)cc1 806244385 YZLRZZKMKCEPFH-HSZRJFAPSA-N 385.467 5.177 30 20 GKED CC(=NNc1nccnc1C1CCC1)c1sc(-c2ccc(C)cc2)nc1C 807991935 WFQQNHLZBQVYBZ-UHFFFAOYSA-N 377.517 5.321 30 20 GKED CC1(CC(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)CCCC1 808980065 SGRRQYWFVRGSAC-SFHVURJKSA-N 376.456 5.097 30 20 GKED C#C[C@H](NC(=O)N(C)[C@H](C)c1nc2ccccc2s1)c1ccc(Cl)cc1 811959345 NOKKDYOZTFVPNI-CJNGLKHVSA-N 383.904 5.027 30 20 GKED N#CCCC[C@H](NCc1ccc(OCc2ccccc2)cc1O)c1ccccc1 816627070 DOKZHOGYTQLTOQ-DEOSSOPVSA-N 386.495 5.496 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(SC(F)(F)F)cc1)c1ccccc1 817320085 XBTITRFPOMUFHD-QGZVFWFLSA-N 378.419 5.463 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1 819440584 TURFCBKXQURJTK-GUYCJALGSA-N 396.434 5.125 30 20 GKED CCC1(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)CCC(F)(F)CC1 850768995 CVYZBVGQGZRFET-LBPRGKRZSA-N 381.373 5.213 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1 915180979 UVMRLDCTCLGLAQ-LJQANCHMSA-N 380.369 5.613 30 20 GKED C[C@H](/N=C/c1cc2ccccc2nc1O)c1cccc(NC(=O)c2ccccc2)c1 915270831 CGRNDOINIZWXTE-GNYKCMPYSA-N 395.462 5.373 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)(F)F)cc2)cc1 916912756 JVMYTDJQQPDBFH-GOSISDBHSA-N 388.389 5.009 30 20 GKED CC(C)c1cccc(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046419 JUGXUTPZYMKLHK-MRXNPFEDSA-N 384.888 5.328 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(C)Cc2csc3ccccc23)c1=S 917454154 DCYQNPYITOQKNY-UHFFFAOYSA-N 396.541 5.164 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1sc2ccccc2c1Cl 917713576 LBMOQGNIWLFEMM-UHFFFAOYSA-N 394.908 6.407 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1sccc1Br 920066158 SMPUKPJWDSWXSF-OWOJBTEDSA-N 382.329 5.592 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(N=Cc2cc([N+](=O)[O-])ccc2O)cc1Cl 920942100 KWWGJRUUNYOAKI-IBGZPJMESA-N 391.814 5.360 30 20 GKED CC(=NNc1ccc(OC(F)(F)F)cc1)c1cnn(-c2ccc(F)cc2)c1C 920987641 OKVCMWAOWYHGBR-UHFFFAOYSA-N 392.356 5.055 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(OCc3cccc(F)c3)cc2)ccc1Cl 1776033315 FAKPFUMRCKWYHT-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CCCCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Cl)cc1Cl 1776033667 OWIJDRDSAKCELP-UHFFFAOYSA-N 399.705 6.351 30 20 GKED CC(=NNc1cccc(Cl)c1Cl)c1oc2cc(C)ccc2c1CC(=O)O 1776080971 OSLQRXBCJBPJLG-UHFFFAOYSA-N 391.254 5.511 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(O)c2)cc1 1776125768 RXZGVRDQSSAFJY-XMCSSRMMSA-N 396.483 5.582 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2ccccc21 1776526514 NAUWIOGMJMEQNS-CYVLTUHYSA-N 382.459 5.999 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3ccc(F)cc3F)c2)cc1 16388272 BVRLWZGKHHFUIK-LFYBBSHMSA-N 393.389 5.122 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2cccs2)Cc2cccs2)cc1 42399946 HYBNSYHCRYSDIY-UHFFFAOYSA-N 398.578 5.143 30 20 GKED C[C@H](CCc1ccco1)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 47741975 KRLFFNAEXXVDCF-QGZVFWFLSA-N 390.508 5.195 30 20 GKED CSc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 52409667 PNGQZXNSERAXKY-UHFFFAOYSA-N 390.533 5.825 30 20 GKED CCOc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1OCC 66800703 CIZKXJQZUBKNGX-OAHLLOKOSA-N 384.501 5.131 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 66955898 KONCEHJOXUBEIO-KXBFYZLASA-N 399.947 6.103 30 20 GKED C=CCn1c(S[C@H](C)C(=O)CC)nc2scc(-c3ccc(C)cc3)c2c1=O 71958169 ABLOWMAHKORDNA-CQSZACIVSA-N 398.553 5.079 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCc4sccc4C3)c2)cc1 105039435 IJDUPJQISGZYHC-UHFFFAOYSA-N 375.453 5.002 30 20 GKED C=CCn1c(SCc2cc(C)nc3ccccc23)nnc1-c1ccoc1C 114096363 SHABUGGOAFYULH-UHFFFAOYSA-N 376.485 5.181 30 20 GKED CN(CC(=O)c1cn(CCC#N)c2ccccc12)Cc1ccc2ccccc2c1 115290370 NVQZDPWALXHGNE-UHFFFAOYSA-N 381.479 5.023 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 121479351 FDAAANSTOAQLIV-UHFFFAOYSA-N 387.439 5.535 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(F)cc1C(F)(F)F 122531959 MDOYIHBRUOQONG-UHFFFAOYSA-N 399.237 5.177 30 20 GKED N#Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1Cl 123870175 LWDIWRBEKUHRDE-OAHLLOKOSA-N 398.274 5.479 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 128381537 VGOHQMPQMBZSHW-CQSZACIVSA-N 392.446 5.686 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC(c2cccs2)c2cccs2)cc1 152045025 QULPDMGOVSSKMR-UHFFFAOYSA-N 381.526 5.522 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)[C@H]1c1ccc(C(F)(F)F)cc1 156547532 XYZOCPKIRRQZEX-IFXJQAMLSA-N 387.405 5.386 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Oc1ccc(Oc2ccc(C#N)cc2)cc1 157150178 XXAGSIOAKLBHHS-AWEZNQCLSA-N 376.412 5.055 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 158995458 AXXVZLQPWKGJPJ-UHFFFAOYSA-N 397.494 5.217 30 20 GKED N#CC1(CCCN[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CCOCC1 281208894 CZJUZZIAIHFIMA-IEBWSBKVSA-N 380.454 5.032 30 20 GKED C[C@H](S[C@H]1CCO[C@@H]1C)C(O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328870931 YDTPTXSRLPYIMQ-GLJUWKHASA-N 377.506 5.005 30 20 GKED CC(C)n1nccc1[C@@H]1OCCC[C@H]1/C(O)=N/C1CCC(C(F)(F)F)CC1 329004511 WZCFYUPBFFZNIP-OCUYMYNFSA-N 387.446 5.009 30 20 GKED OC(=Nc1ncc(C2CCCCC2)s1)N1CCC(c2nccs2)CC1 329456255 NGHHYNMUKHMVCF-UHFFFAOYSA-N 376.551 5.072 30 20 GKED Cc1cccc(-c2cncc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2)c1 426379488 JJWJUJPDKIBVMP-QGZVFWFLSA-N 387.508 5.704 30 20 GKED N#Cc1ccc(-c2nc(-c3ccc(-c4csc(-c5ccncc5)n4)cc3)no2)o1 426584355 PVWMUTRURUJSRD-UHFFFAOYSA-N 397.419 5.054 30 20 GKED CSc1ccc(Cl)cc1NC(=O)c1cnn(CCC#N)c1-c1ccccc1 428911878 KSTAYHNNLPSVGQ-UHFFFAOYSA-N 396.903 5.091 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@H]1c1cccnc1 433133313 NVZXMFGJDJZJHV-QFIPXVFZSA-N 398.466 5.361 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 437275222 KKWILZAVLVJQAG-UHFFFAOYSA-N 382.769 5.270 30 20 GKED N#CCC[C@@H](NC(=O)NCCOc1ccccc1-c1ccccc1)c1ccccc1 438846390 BBCFXPQWVABKIU-HSZRJFAPSA-N 399.494 5.077 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccccc1 439302444 BPVUPLHISAQCSE-HSZRJFAPSA-N 385.467 5.432 30 20 GKED COc1cc(CN[C@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)ccc1C#N 440618296 VZVNEDVBTQYPDO-CYBMUJFWSA-N 397.931 5.503 30 20 GKED C=CCCCN(C)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444015993 BWWKWFUIZTYZES-CQSZACIVSA-N 382.348 5.307 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@H](C)c1ccc(C#N)cc1 444033329 NXVYGTOHLQUUHJ-GOSISDBHSA-N 384.483 5.040 30 20 GKED C=C(C)Cn1c(-c2ccc(C)c(F)c2)nnc1N1CCC[C@@H]1c1csc(C)n1 460807479 DLBAQEHGBIGGOF-LJQANCHMSA-N 397.523 5.075 30 20 GKED FC(F)Oc1ccc([C@H](NCc2ccc(C(F)F)cc2)C(F)(F)F)cc1 461367908 DRBUZQBYADRFSS-AWEZNQCLSA-N 381.291 5.619 30 20 GKED Cc1c(Br)cccc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 463742631 CJNAVUPDIIVXHY-OAHLLOKOSA-N 398.087 5.059 30 20 GKED CSc1cccc([C@@H](NC(=O)c2cccc(C#N)c2)c2ccc(F)c(F)c2)c1 464123703 VRESMMHRZCYYBF-OAQYLSRUSA-N 394.446 5.078 30 20 GKED CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 464885076 KLZNXZDUTAZYNF-PGRDOPGGSA-N 394.515 5.263 30 20 GKED C[C@H]1CCC[C@@H](N(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 481621603 HRRRCBGRXOBGBM-OXJNMPFZSA-N 395.478 5.319 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2ccco2)c2ccc(F)cc2F)cc1 483362260 YBJHWIBRWGKUGA-UHFFFAOYSA-N 380.394 5.206 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc2c(cc1Cl)OCCCO2 485739514 BEWJFNDLJYGWPA-UHFFFAOYSA-N 375.877 5.032 30 20 GKED N#C[C@@H](NC(=O)CSc1cc(Cl)ccc1Cl)c1ccccc1Cl 499947951 UQDREHVSSIGVGD-CQSZACIVSA-N 385.703 5.120 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)c1 501141960 WZBBNMPNAHQNDD-UHFFFAOYSA-N 377.444 5.041 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccsc2)cc1Cl 503990915 CVJGLGNKQVGOOI-GOSISDBHSA-N 382.872 5.074 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCC[C@@H]3/C=C/c3ccccc3)o2)cc1 505359952 OTULENATGXMDLC-OGECGYFKSA-N 398.462 5.048 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCC(c1ccccc1)c1ccccc1 505644218 KHRVXMQJRXAHHY-UHFFFAOYSA-N 397.522 5.312 30 20 GKED N#Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)ccc1F 506458522 CONHOSZOFCBHLR-LJQANCHMSA-N 389.817 5.259 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@H](C)c2nc(C(C)(C)C)no2)cc1 507826782 BUHIECJYBIKVOV-CQSZACIVSA-N 392.459 5.213 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(-c3cccc(OC(F)(F)F)c3)s2)CC1 507840088 FVSACIXCOTUXGR-UHFFFAOYSA-N 394.418 5.080 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1COCc1ccccc1 515267606 QOCGFTSHMFQJRW-UHFFFAOYSA-N 386.495 5.624 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3cccc(F)c3F)CC2)c(Cl)c1 516403190 MZGTXDSNSGQACY-UHFFFAOYSA-N 389.833 5.096 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)oc2c(Cl)cccc12 516767722 QXTYMZUQTNGJNH-CQSZACIVSA-N 393.855 5.403 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1ccc(C#N)cc1 517887792 WPOVLVLTESZRLA-SFHVURJKSA-N 387.458 5.170 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cccc4cccnc34)cc2)cc1 519978018 SQJFYAXUORXEII-UHFFFAOYSA-N 379.419 5.080 30 20 GKED C=CCOc1ccc(CNCCc2coc(-c3ccc(F)cc3)n2)cc1Cl 520215237 RATQSMMDZJKTKB-UHFFFAOYSA-N 386.854 5.031 30 20 GKED CC[C@@H](C)[C@@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 521111807 MYBNUAKQRFJXGJ-BEBLGJCVSA-N 390.527 5.194 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccccc3SC[C@@H](C)C#N)coc2c1C 521726990 QYLJJGOUHORMFO-AWEZNQCLSA-N 378.497 5.483 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccsc3)cc2)c1 521810659 YFJJILLWDNPDRD-OAQYLSRUSA-N 389.480 5.781 30 20 GKED C[C@@H](NCc1ccc(-c2ccc(Br)cc2)o1)c1ccc(C#N)cc1 521830696 LZJAVKFGXNCATE-CQSZACIVSA-N 381.273 5.432 30 20 GKED CCCOc1cc(C)ccc1NC(=O)c1occc1COc1cccc(C#N)c1 523277408 DWDHSMHJRBYONF-UHFFFAOYSA-N 390.439 5.080 30 20 GKED C=CCC[C@H](NCc1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 533069419 TVPYBTIHEHWCSB-FQEVSTJZSA-N 376.422 5.461 30 20 GKED C=CCC[C@@H](NCc1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 533069420 TVPYBTIHEHWCSB-HXUWFJFHSA-N 376.422 5.461 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@H]2CCCC[C@H]2C(F)(F)F)cc1 539100185 RRHOWFVLHZCJTN-VQTJNVASSA-N 386.417 5.210 30 20 GKED N#CC1(CCCSc2nnc(-c3ccccc3)c3ccccc23)CCOCC1 540768894 XXNZSDWWNPGDNL-UHFFFAOYSA-N 389.524 5.489 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 546190483 VXWLWZIWMUCLNV-LIRRHRJNSA-N 389.421 5.316 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 549185732 CMRCHOSZOVCNQV-CYBMUJFWSA-N 398.322 5.431 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1ccccc1 553677922 XBTJCNAXXAXSLT-NRFANRHFSA-N 399.897 5.446 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 562074414 NIXGYRLZGMNMGZ-UHFFFAOYSA-N 378.501 5.415 30 20 GKED COc1ccc([C@H](CCC#N)NC[C@@H]2CCN(c3cc(Cl)ccc3C)C2)cc1 562593676 VCECIPDUHCBUKE-AVRDEDQJSA-N 397.950 5.118 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1F 566554484 BLPJDTZXYFPVCO-OAHLLOKOSA-N 375.403 5.017 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)C2CCC(=O)CC2)cc1 569313241 QDUMZPRLHYGDTI-UHFFFAOYSA-N 384.888 5.061 30 20 GKED Cc1csc(NC(=O)c2oc3c(C)cc(Br)cc3c2C)c1C#N 575159722 FXUXBUIHVYOXCL-UHFFFAOYSA-N 389.274 5.306 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(O[C@@H]2CC2(F)F)cc1 599410106 XMJOQUIFRYLIBB-SCLBCKFNSA-N 388.439 5.120 30 20 GKED C=CCN(C(=O)c1ccc(C)cc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603458907 NIRJSXVJHCOQPC-UHFFFAOYSA-N 393.468 5.168 30 20 GKED N#Cc1ccc(CNC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)cc1 603510405 QQRIHRKLXGFOSO-UHFFFAOYSA-N 395.698 5.663 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccc3)cn2)cc1 603690085 HSAINWRKBWCRAA-OAQYLSRUSA-N 384.439 5.115 30 20 GKED CCN(Cc1ccccc1C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692562 KZFGZUSUVMUFKW-UHFFFAOYSA-N 386.455 5.108 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cnc(-c4ccccc4)s3)c2C#N)C1 603727561 XLUVTQGISXIAKA-GFCCVEGCSA-N 379.510 5.120 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(COc3cccc(F)c3)c2)cc1 603918521 XZBLJOGRFTWVNJ-UHFFFAOYSA-N 392.455 5.007 30 20 GKED C=CCCCCCN(C)C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 606967656 MTDYIINIRAGFLF-LJQANCHMSA-N 393.531 5.388 30 20 GKED N#Cc1cccc(OC2CCN(Cc3csc(C4CCCCC4)n3)CC2)c1 609194938 RVWXPGXPWHWGBD-UHFFFAOYSA-N 381.545 5.106 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc2c(c1)CCC2 609370633 JIXLPNVNSIIIEW-OAHLLOKOSA-N 382.554 5.300 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1C(C)C 609427552 JGJTUSHFWIHGNT-QZTJIDSGSA-N 396.556 5.919 30 20 GKED COc1ccc(C(C)(C)C)cc1NC(=O)CCCCOc1cccc(C#N)c1 609496385 QPZCETYKRXPITD-UHFFFAOYSA-N 380.488 5.052 30 20 GKED Cc1ccc(-c2ncc(C(=O)N(CCC#N)c3ccc(F)cc3)s2)c(C)c1 609522234 PKGGBXKGLAZGFX-UHFFFAOYSA-N 379.460 5.127 30 20 GKED CCCCSCCC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 610047505 BALMCVHVMDEVIP-UHFFFAOYSA-N 382.529 5.308 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CC1CC1)c1ccccc1 610324156 AWXMBVCKIUUDFZ-OXQOHEQNSA-N 379.529 5.744 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)N[C@](C)(C#N)C(C)(C)C 613365862 ZEDQHYLWCSYNDX-GOSISDBHSA-N 395.450 5.196 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 677975035 NXHRWTANFPEMJQ-SNVBAGLBSA-N 398.768 5.598 30 20 GKED O=C(Nc1cccc(C=NNC2CCCC2)c1)c1ccc(Cl)cc1Cl 727652795 ZLCBSYLKMQXHRC-UHFFFAOYSA-N 376.287 5.112 30 20 GKED COc1ccc(N=Cc2ccccc2O)cc1OCc1ccc2ccccc2n1 727972908 KWSJXUZLMBPXTP-UHFFFAOYSA-N 384.435 5.279 30 20 GKED Cc1ccc2c(c1C)OC[C@@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728392372 ZTTKMEWEBBLKIH-GOTSBHOMSA-N 397.478 5.214 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc1C(C)C 730417185 LPUFFEZJUOGFQZ-KDOFPFPSSA-N 396.487 5.511 30 20 GKED Cc1cc(C)cc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)c1 730949451 WODQGVYWTJTVFC-YVMONPNESA-N 376.408 5.070 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccccc2SC[C@H](C)C#N)c(Cl)c1 730954891 NQEYPGVMCUJOEQ-CYBMUJFWSA-N 389.977 6.018 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 732596142 LGQHKGSDYDIYNL-NQIIRXRSSA-N 398.462 5.005 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3cccc(F)c3)CCCCC2)c1 733775012 NJYXCKXZOKSVNA-OAQYLSRUSA-N 394.490 5.025 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(-c3ccccc3)cc2C)c1 733843433 OZCNDOGZLNWPLX-JOCHJYFZSA-N 399.494 5.665 30 20 GKED CC[C@H](NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 734374045 OZAYXNUGTYETHB-PMACEKPBSA-N 391.565 5.841 30 20 GKED N#CCOc1ccc(Cl)cc1CNC1(c2ccc(Cl)c(Cl)c2)CC1 735309351 DQJXZUPRISHSGG-UHFFFAOYSA-N 381.690 5.328 30 20 GKED CC(C)(C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 739157294 SWHXCNUWOMFZHF-CYBMUJFWSA-N 381.328 6.119 30 20 GKED COc1ccc(-c2nc(/C=C3/CCc4ccc(OC)cc4C3=O)cs2)cc1 741847686 KFIBTYJPTZVWIQ-WJDWOHSUSA-N 377.465 5.040 30 20 GKED COc1ccc(CN[C@H](c2ccc(C)cc2)c2ccccc2Cl)cc1C#N 742372940 YITDJPYAMGANJU-HSZRJFAPSA-N 376.887 5.408 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)Cc1ccc(OCC#N)cc1 742840613 MOYVRZCYUKPOGZ-IBGZPJMESA-N 384.479 5.018 30 20 GKED CC/C(=C/C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1cccc(Cl)c1 744512387 DJKWWYIQWUXWSR-MBGNVJMVSA-N 382.891 5.131 30 20 GKED C=CC[C@H](NC(=O)N(CC)[C@H](Cc1ccc(F)cc1)C(C)C)c1ccncc1 745828068 QMKLDCQNWNLMQK-FCHUYYIVSA-N 383.511 5.137 30 20 GKED COc1ccc(CCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 747123988 OCGSXTHLVBFDLW-DEOSSOPVSA-N 384.479 5.312 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747197571 IGJKLFGOUZGBKE-GOSISDBHSA-N 382.529 5.304 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2F)s1)c1ccc(N2CCOC2=O)cc1 748583751 FHXDPLHZYJLAES-LUAWRHEFSA-N 393.439 5.407 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1 751319119 CQSSJHDDLQNCSY-UHFFFAOYSA-N 375.453 5.087 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)cc1 765015127 PRBKBENQKQPDJM-GOSISDBHSA-N 379.916 5.502 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(OC)c(OCC)c2)cc1 765997632 LKXOLSAROUUQHW-MRXNPFEDSA-N 375.896 5.076 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NCc2ccc(O[C@@H](C)C#N)cc2)c1 770586785 VVLNEGKMIXATOR-AWEZNQCLSA-N 380.435 5.552 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2cc3ccccc3o2)C(C)C)ccc1OC 776309685 LOYMBDXGXDXHSE-NTKDMRAZSA-N 392.499 5.609 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccc(-c4ccccc4)cc3F)on2)c1 789893629 MIUUPAKARAIWGX-UHFFFAOYSA-N 383.382 5.272 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(OC)c3ccccc23)cn1 792870287 QNFNSQRWINDEIT-QBFSEMIESA-N 396.446 5.210 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2cnc(-c3ccc(Cl)cc3)s2)cc1 792926167 PLTLQRYEBBQBJT-QXMHVHEDSA-N 396.899 5.061 30 20 GKED COc1ccc2cc(NCc3cn(CCC#N)nc3-c3ccccc3)ccc2c1 796458442 NQTVDCKRCSKOQY-UHFFFAOYSA-N 382.467 5.238 30 20 GKED CN(Cc1ccccc1)C1CCC(=NNc2ncnc3c2oc2ccccc23)CC1 797787442 PMYZJXMIMKAXEC-UHFFFAOYSA-N 399.498 5.219 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@@H]1CCC(F)(F)C1 797869837 BGRDUTMJWWFDAR-INIZCTEOSA-N 386.417 5.365 30 20 GKED CC(C)(CC(=O)c1ccccc1)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 799600871 NBQPDMOWGBGYHH-MRXNPFEDSA-N 376.481 5.162 30 20 GKED N#Cc1ccccc1/C=C\C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 799839981 IWEPVULCYFPADN-HVMBHNBBSA-N 391.474 5.001 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2nc3ccc(Br)cc3o2)c(F)c1 812247889 AAXGIWYFYWMTJN-WUXMJOGZSA-N 377.600 5.338 30 20 GKED Clc1cccc(Oc2ccccc2)c1C=NNc1nc(-c2cccnc2)no1 814950133 RHJDKFZORMYCAE-UHFFFAOYSA-N 391.818 5.023 30 20 GKED Oc1nncc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)c1Cl 914867418 WAMIDRGSPOLJTB-UHFFFAOYSA-N 399.690 5.317 30 20 GKED N#C[C@@H](C(=O)[C@@H]1Cc2ccccc2S1)c1nc(-c2ccc(Cl)cc2)cs1 915102342 XKCSZAVXODVXJR-YJBOKZPZSA-N 396.924 5.357 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(F)c1)c1nc(-c2ccc(Cl)cc2)cs1 916628465 SWZAVEUAAYELTC-ASRSSLEJSA-N 382.847 5.492 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C/C(=O)c2cc(Cl)sc2Cl)c1 918711991 FOYATLYNUJCVIV-AATRIKPKSA-N 379.268 5.350 30 20 GKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 920140494 DPWVESMUMZLSST-GEPASTNRSA-N 397.503 5.497 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCSc3ccccc3)n2)cc1 920141802 RMJQJAVYYIOLGK-SFHVURJKSA-N 389.505 5.040 30 20 GKED O=C(O)c1ccccc1-c1ccc(/C=C\C(=O)c2cccc3ccccc23)cc1 1776114366 NLPPDRIXQCRPHR-VKAVYKQESA-N 378.427 6.101 30 20 GKED O=C(O)c1cc(F)c(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)c(F)c1 1776127323 PLOVMOMFZCTFSE-ZHACJKMWSA-N 394.373 5.138 30 20 GKED C=CCOc1ccc(/C=C/c2nc(C(=O)O)c(-c3ccccc3)s2)cc1Cl 1776183972 WOCBOCWQINZZES-PKNBQFBNSA-N 397.883 5.897 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc(Cl)cc2)cc1 1776783019 VVTVEDSCQZHMIH-JOCHJYFZSA-N 387.951 6.300 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1cc(OC)cc(OC)c1 1776785256 LDVJKOKEMPBLRM-OAQYLSRUSA-N 379.541 5.292 30 20 GKED CCCCCCCOc1ccc(/C=C(/CC(=O)O)c2nc3ccccc3o2)cc1 1776785864 DIFSPSJBRZQADF-MNDPQUGUSA-N 393.483 6.192 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cccc(CC)c2)[n+]2ccccc2)cc1 14872218 CJYOQNFLHLTYSJ-UHFFFAOYSA-O 389.544 5.150 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)cc1 44634849 SAJPETNVSOZCBE-UHFFFAOYSA-N 386.451 5.064 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(Cc2ccccc2)CC1 66955793 HLQDCTLPEUKVOC-SFHVURJKSA-N 393.556 5.567 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)cs2)cc1 91865706 WAKMEXRBKWAMMD-HNNXBMFYSA-N 381.526 5.112 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Nc1ccc(OCc2cccc(C#N)c2)cc1 97543260 SGQPCCAVSDJDDH-LJQANCHMSA-N 399.494 5.193 30 20 GKED CCC[C@H](NC(=O)CNc1ccccc1SC[C@H](C)C#N)c1ccccc1 108353911 WAMSPVHHIRJLKG-MJGOQNOKSA-N 381.545 5.008 30 20 GKED COc1ccccc1CC(C)(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 112582351 JMEHFLNFBCRYGQ-MRXNPFEDSA-N 382.529 5.154 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3c(F)cccc3F)n2)cc1 154389084 DLXREJCBGYJOCO-IUODEOHRSA-N 398.434 5.077 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(C(C)C)no2)nnc1-c1cccc(Cl)c1 154895377 FMOGGCLPUVYIPB-LBPRGKRZSA-N 389.912 5.144 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cccc(F)c1F 161549532 OWFRMJYXDQDKJG-QWHCGFSZSA-N 375.444 5.099 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1Cl 172088142 RSVQZFXSTGLKHW-QSOAKEGCSA-N 379.872 5.138 30 20 GKED C[C@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccc(C#N)cc1 175807334 OEMZLQQXSWSRLN-AWEZNQCLSA-N 380.831 5.104 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 179440732 OLOZVZGVPIAPDR-HOCLYGCPSA-N 394.462 5.228 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccsc2)cs1)c1ccc(F)cc1F 255312987 YVZGSONQAPISJW-HYXAFXHYSA-N 390.436 5.064 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)CCCC1(C#N)CCOCC1 282001839 NPTBKWGQXOUHLV-SFHVURJKSA-N 383.561 5.212 30 20 GKED COc1ccc(F)cc1[C@H](C)/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329430862 IHVKIFJXSNNWDG-RDJZCZTQSA-N 399.510 5.359 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1nnc(-c2cc3ccccc3o2)o1 410352857 JJQOBQHRWQVMPC-UHFFFAOYSA-N 387.439 5.173 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Oc3cccnc3)cc2)s1 430587092 YDWRQTGOXOIRDF-QGZVFWFLSA-N 377.469 5.118 30 20 GKED CCC(CC)n1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)n1 431169615 MQIKFAAABKMCIW-QGZVFWFLSA-N 378.501 5.166 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nnc(C(F)(F)F)s2)cc1 436056253 SLIYEKGXSSMANU-UHFFFAOYSA-N 377.416 5.388 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2nc(-c3ccccc3)cs2)cc1 437254236 HAGLLOXCODHXBE-UHFFFAOYSA-N 389.524 5.236 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc2oc(C3CC3)nc2c1 437927370 PJCQSSYTLWEMFP-AZUAARDMSA-N 386.455 5.009 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)N[C@H](c1ccc(F)cc1)C(F)(F)F 438624111 NWFADBUWQUCFOX-CQSZACIVSA-N 394.290 5.356 30 20 GKED C=C(C)Cn1c(COc2cccc(C)c2)nnc1N1CCC[C@@H]1c1ccsc1 460372260 DSFOFIIWOSOEAQ-HXUWFJFHSA-N 394.544 5.145 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4cc(C(F)(F)F)ccn4)cc3c2C1 464458018 DIIYOTAKVNWODH-SJCJKPOMSA-N 397.400 5.197 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 469473973 GTUKMGJRPDTBKC-IBGZPJMESA-N 387.405 5.531 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)CCCCOc1cccc(C#N)c1 469991978 NISMCPHYPMEQRQ-UHFFFAOYSA-N 376.378 5.073 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)CCCCOc1cccc(C#N)c1 472675420 DVCCIPQNACRHOG-UHFFFAOYSA-N 378.516 5.822 30 20 GKED C=C(C)[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(F)c(F)c1 475702803 NNYAYUUCZLGLMK-VCBZYWHSSA-N 393.380 5.103 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@@H](C)c2ncc(C(C)(C)C)o2)cc1 476534589 MEGWRBPQYYQDBR-HNNXBMFYSA-N 391.471 5.818 30 20 GKED CC1(c2ccc(Cl)cc2)CCN(C(=O)C[C@@H](CC#N)c2ccccc2)CC1 477154019 WEMHWMHJPFVDRS-LJQANCHMSA-N 380.919 5.308 30 20 GKED Cc1csc(C(=O)N[C@@H](C#N)c2ccc(OCc3ccccc3)cc2)c1Cl 480045689 PCHJEECWMRZBTH-SFHVURJKSA-N 396.899 5.284 30 20 GKED CC(C)(C#N)c1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 483488409 CPHQVWAKFCZZOW-HNNXBMFYSA-N 379.872 5.241 30 20 GKED Cc1cc(CCC(=O)N[C@@H](CCCC#N)c2ccccc2)ccc1Br 487175493 JEBNEWJVFNTGMI-FQEVSTJZSA-N 399.332 5.242 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Oc3ccncc3)c(C)c2)cc1OC 487697267 IZODWWKFOQQYLB-UHFFFAOYSA-N 390.439 5.008 30 20 GKED O=C(N[C@@H](c1ccccc1OC(F)F)C(F)(F)F)c1ccc(C(F)F)cc1 493413034 WDQSZRHEGBNHNR-ZDUSSCGKSA-N 395.274 5.259 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1)c1ccccc1 494534967 ZXPRXSNYSPZJDL-PXNSSMCTSA-N 399.918 5.444 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3ccc(C#N)cc3Cl)o2)c(C)c1 494638068 OTNLIVVVCQJFGF-UHFFFAOYSA-N 380.831 5.253 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1F 499638303 XIOSBQLTACZWKK-QGZVFWFLSA-N 396.824 5.834 30 20 GKED CC(C)c1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(C(C)C)c1 502361351 OPOKKQRSGVAISA-UHFFFAOYSA-N 379.504 6.260 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3[nH]c(-c4ccc(F)cc4)nc3c2)c1 506494552 HAKDPRMWOBJZEA-UHFFFAOYSA-N 390.805 5.146 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(-c2ccccc2)nn1C(C)C 506898911 RCBALJUJYSUXBD-UHFFFAOYSA-N 380.517 5.413 30 20 GKED CSCc1cnc(CN(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)s1 507628891 HAXXAPNSYRVHSD-UHFFFAOYSA-N 397.544 5.219 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@@H]1CCc2ccccc21 510645570 MWYOSCZCECFODZ-JOCHJYFZSA-N 383.451 5.502 30 20 GKED N#Cc1ccc(NCc2cccc(NC(=O)c3ccc(F)cc3)c2)cc1Cl 517655208 AMOCNJRTAPDYFZ-UHFFFAOYSA-N 379.822 5.215 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 518256154 NWSLNXCMGZDBTP-JLTOFOAXSA-N 399.947 6.007 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCc2c(Cl)cccc21 518753707 YYJBPDDLQWUTBN-CXAGYDPISA-N 385.920 5.543 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 519507544 GFAPUNXLBNIUDG-LJQANCHMSA-N 376.422 5.120 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 520711492 IELZOESAQBVLME-LBPRGKRZSA-N 392.267 5.013 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)sc2cccc(F)c12 521326794 HBGATKQADKRMPT-LBPRGKRZSA-N 384.501 5.995 30 20 GKED COc1cc(CNc2ccccc2S[C@H](C)CC#N)ccc1OC(F)F 521813285 DNOSIJCTHNOMSU-CYBMUJFWSA-N 378.444 5.303 30 20 GKED CN(CC1CCC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 522090465 HJOUCUFLHSHNFF-UHFFFAOYSA-N 383.879 5.054 30 20 GKED CCc1c(C)sc(NC(=O)c2cc3c(s2)-c2ccccc2OC3)c1C#N 524330654 YALBFZFEXOYGIT-UHFFFAOYSA-N 380.494 5.364 30 20 GKED Cc1ccc(CN(C)C(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 524413856 ZJNCXWNOVFXONU-UHFFFAOYSA-N 392.549 5.493 30 20 GKED C[C@@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccc(C#N)cc1 524515370 SWBWTMJWSDFRMF-VLIAUNLRSA-N 393.537 5.100 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 530603536 SZHXIAXHRKJJNF-LJQANCHMSA-N 387.405 5.645 30 20 GKED C=CCn1c(SCc2csc(C3CC3)n2)nnc1-c1cccc(Cl)c1 533888887 SGGXVYFLYBRDML-UHFFFAOYSA-N 388.949 5.411 30 20 GKED N#Cc1ccc(CN2CCC(Nc3cccc(N4CCCCCC4)c3)CC2)cc1 540974545 KYMACHXVEDMOSY-UHFFFAOYSA-N 388.559 5.015 30 20 GKED Cc1ccc(C)c(NC(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)c1 552695793 IRKXPXHGNPARBY-UHFFFAOYSA-N 381.907 5.074 30 20 GKED CC[C@H](C)n1nc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1C 554244922 LUGLQEFUMOFIOW-ZDUSSCGKSA-N 390.512 5.114 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1C 565076666 JQFXDXXVXGSCQS-SFHVURJKSA-N 393.556 5.894 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@@H](C)CC3)c1C1CC1 575637013 YKSDAAGFNJVBDH-STQMWFEESA-N 382.533 5.042 30 20 GKED N#Cc1ccc(CNC(c2cccs2)c2cccs2)c(C(F)(F)F)c1 578407550 LLDJCJHNCARMLE-UHFFFAOYSA-N 378.444 5.579 30 20 GKED CSc1ccc(Cl)cc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 584738671 UELCQPYZBQSUHS-UHFFFAOYSA-N 395.871 5.373 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3csc(-c4ccccc4)n3)CC2)cc1 588337122 HKLYFZIMJQIEBN-UHFFFAOYSA-N 386.480 5.003 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)[C@H]1c1ccccc1 589363273 IMNNSBDODWNBGD-QFIPXVFZSA-N 398.466 5.361 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1 589404676 DWYIASUYABSHCU-JKSUJKDBSA-N 399.947 5.199 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@H]1c1ccccc1 604460584 CIWHXRYSMDZLQK-QHCPKHFHSA-N 397.478 5.966 30 20 GKED CC(C)(CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 604470123 ORZUFLMRVKQHTB-UHFFFAOYSA-N 398.506 5.638 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)c2ncccc12 604488266 UYUKXDBSZIJKIB-UHFFFAOYSA-N 396.834 5.017 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 604561904 XVKGDVIVLVXFJM-LJQANCHMSA-N 398.466 5.075 30 20 GKED C=CCCCCCN(C)C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 606815799 CLKXZABLSKPBSB-UHFFFAOYSA-N 396.478 5.576 30 20 GKED N#Cc1cccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)c1 609018935 UCJGWERKWWNTHB-UHFFFAOYSA-N 398.397 5.030 30 20 GKED CCC(CC)CN(CCC#N)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 609186885 BXCBDLOGQYUCLB-UHFFFAOYSA-N 389.952 5.184 30 20 GKED N#CCn1c(C(=O)Nc2ccc(NCCc3ccccc3)cc2)cc2ccccc21 609477119 SCYMFPQXOTYSRN-UHFFFAOYSA-N 394.478 5.072 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2csc(-c3ccccc3)n2)CC1 609544900 XCVSDIXLHXUXKW-UHFFFAOYSA-N 389.524 5.162 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cccc(-c4cnco4)c3)c2)c1 609642223 GADHHPGRAXJSIV-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#CCn1c(C(=O)Nc2nc(/C=C/c3ccccc3)cs2)cc2ccccc21 609757353 XHVVHOUGLRMLQG-ZHACJKMWSA-N 384.464 5.044 30 20 GKED C[C@H](NC(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1cccc(C#N)c1 610318621 ZZNNOYJWQPTFNK-NSHDSACASA-N 397.784 5.035 30 20 GKED COc1cc(OC)cc(Oc2ccc(CN[C@H](C)c3cccc(C#N)c3)cc2)c1 610344743 GVZQBZNQTRGTGM-QGZVFWFLSA-N 388.467 5.219 30 20 GKED O=C(Nc1ccc(F)c(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618539026 GDIQNABKDANXPO-YUMQZZPRSA-N 392.702 5.074 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(C(F)F)c1F 628112887 CKGMINVCNKZPBS-UHFFFAOYSA-N 395.265 5.547 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 651380647 AIGSEAJXELUTGN-ZDUSSCGKSA-N 383.473 5.082 30 20 GKED N#C[C@H](C(=O)c1cccc(N2CCCC2)c1)c1nc2cc(Cl)ccc2s1 659053933 UTGASFBGMGXPNB-MRXNPFEDSA-N 381.888 5.040 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cccc(Cl)c1F 675627444 IFROETWBDRVYNZ-YUMQZZPRSA-N 391.714 5.118 30 20 GKED N#Cc1ccc(NC(=S)Nc2cc(C(F)(F)F)ccc2Cl)cc1Cl 726435030 ZKARPRNQGDQKKV-UHFFFAOYSA-N 390.217 5.693 30 20 GKED O=C1/C(=C/c2csc([N+](=O)[O-])c2)CCc2nc(-c3ccc(F)cc3)sc21 727685531 QJWRCSQPLOAPKT-KPKJPENVSA-N 386.429 5.131 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1C 728062003 GFFPDVWFWXPQMM-IBGZPJMESA-N 399.494 5.193 30 20 GKED Cc1nn(C)c(C)c1C(=O)/C=C\c1cn(C(C)(C)C)nc1-c1ccccc1Cl 731159995 ZWTKLNMJIKBXDD-QXMHVHEDSA-N 396.922 5.205 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(COc3ccccc3C#N)c2)cc1 734124504 GKEJJLUDNDEGRG-UHFFFAOYSA-N 395.462 5.006 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC(c2cc3ccccc3[nH]2)CC1 735309275 AXKXKZKRTBUYRI-UHFFFAOYSA-N 379.891 5.103 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 739153973 ANMIWQAWMFZKFW-KOLCDFICSA-N 380.416 5.357 30 20 GKED Cc1ccc([C@H](C)C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)o1 742660319 ZGKTYYAARVWFRS-KRWDZBQOSA-N 376.431 5.244 30 20 GKED N#C[C@H](C(=O)[C@@H]1Cc2ccccc21)c1nc(-c2ccc(Cl)cc2Cl)cs1 744035137 KMLVVPNRIRLCAU-HZPDHXFCSA-N 399.302 5.633 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1)c1cccc(C(F)(F)F)c1 744159473 CTWWADYSFQALMS-RCBBPTIPSA-N 383.373 5.170 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(-c2cccnc2)nc2ccccc12 752396843 FYIVAWBSEQNGNF-UHFFFAOYSA-N 385.492 5.187 30 20 GKED Cn1cc(CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc21 756239584 BRXZIFBZPXYNOI-MRXNPFEDSA-N 393.899 5.250 30 20 GKED CC(=NOCc1ccccc1C(C)(C)C#N)c1nc2ccccc2n1C(F)F 767822491 BOBOFUSABKVMSL-UHFFFAOYSA-N 382.414 5.173 30 20 GKED CCN(c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1)C(C)C 770099976 MFGFLMCVPGLRLR-QFIPXVFZSA-N 399.494 5.036 30 20 GKED O=C(/C=C/c1c(C2CC2)nc2sccn12)c1cc(Br)ccc1F 774555661 UGNAMDNAZMZYGD-AATRIKPKSA-N 391.265 5.071 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780679018 STHMJJKLKLRDSI-UTKZUKDTSA-N 377.488 5.470 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](O)c1ccc2ccccc2c1 789455074 HVMIMZDFCDUZTM-QHCPKHFHSA-N 388.511 5.547 30 20 GKED CC(C)n1cc(/C=C\C(=O)c2ccc(Br)cc2C(F)(F)F)cn1 790233168 QDNIXULSRVBYBU-UTCJRWHESA-N 387.199 5.141 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(OC(C)C)c(Cl)c2)c1 793539917 KPBJHYUEXPAHPC-VQIMIIECSA-N 386.923 5.659 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)o2)cc1 797568356 QNTWCQTUEROHAU-MRXNPFEDSA-N 393.512 5.213 30 20 GKED CN(C(=S)Nc1ccccc1C#N)[C@H](c1ccc(Cl)cc1)C1CCCC1 798374216 HLVULIAJZKCQRX-FQEVSTJZSA-N 383.948 5.772 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2Cl)nnc1-c1cccs1 799889076 SSZZAHUGBZETKF-UHFFFAOYSA-N 383.329 5.187 30 20 GKED Cc1ccc(-c2ccc(C(=O)OCCCC3(C#N)CCOCC3)c(F)c2)cc1 800163801 UARKFDYOXWPYGG-UHFFFAOYSA-N 381.447 5.059 30 20 GKED COc1ccc(C[C@@H](Nc2nc(Cl)c(C#N)s2)c2ccc(OC)cc2)cc1 804330622 ZRXCSWODDCVIRI-QGZVFWFLSA-N 399.903 5.081 30 20 GKED O=C(/C=C/c1cncc(F)c1)O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809127766 LAHNFCSFLQKNDT-IQHSHDKKSA-N 393.258 5.100 30 20 GKED N#Cc1cscc1C(=O)OCc1csc(-c2ccc(C(F)(F)F)cc2)n1 814610717 BJYOCHFLPQLPLD-UHFFFAOYSA-N 394.399 5.119 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@]3(C)CC3(Cl)Cl)n2)cc1 835068675 SNMKJMAJGJVXJS-DYVFJYSZSA-N 379.312 5.269 30 20 GKED C[C@]1(C#N)CC[C@@H](OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)CC1 836158588 FPPUIUYUJBNIJG-UJKQEGAGSA-N 394.418 5.458 30 20 GKED O=C(O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)c1ccc(C(F)F)nc1 847054101 UKBXNQNUKLLUNP-LBPRGKRZSA-N 399.237 5.498 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)OC(=O)[C@H](C)CC#N 850865005 HLDNMPISPUIKMC-ZYHUDNBSSA-N 393.306 5.035 30 20 GKED COc1ccc2cc(/C=C\C(=O)N(Cc3ccc(C#N)cc3)C(C)C)ccc2c1 914501437 IDPKGMOYLNXQIM-LCYFTJDESA-N 384.479 5.170 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccccc2Cl)cc1 915086767 MNOSEBQDRQREEE-LJQANCHMSA-N 376.843 5.013 30 20 GKED C[C@@H](/N=C\c1cc2ccccc2nc1O)c1cccc(NC(=O)c2ccccc2)c1 915270832 CGRNDOINIZWXTE-LYVYQLNUSA-N 395.462 5.373 30 20 GKED C=CCOc1cccc(/C=C(/Cl)c2nc(O)c3c4c(sc3n2)CCCC4)c1 916140627 ADCXXCMXBHPUAT-FOWTUZBSSA-N 398.915 5.577 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/Sc3ccccc3)n2)cc1 916971573 BUWHUDKRYWSNIF-DXRVJIQQSA-N 376.506 5.601 30 20 GKED COc1cccc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)c1OC(F)F 920068364 MZGGOKHGWVRKDO-YVMONPNESA-N 377.774 5.327 30 20 GKED CC(C)(C)c1nnc(S)n1N=Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 920362623 GTTNGRHPKYWHPE-UHFFFAOYSA-N 394.422 5.025 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804818 ZWLZJRZILUBFBM-GJZGRUSLSA-N 382.435 5.458 30 20 GKED O=C(O)c1cc(NN=C(CC(F)(F)F)c2ccc(Cl)cc2)ccc1Cl 1776033735 ZTYFETVPJRUSGU-UHFFFAOYSA-N 391.176 5.460 30 20 GKED C[C@@H](ON=Cc1cccc(OCc2ccccc2C(=O)O)c1)c1ccccc1 1776082935 CHGMYPSAARJTDG-QGZVFWFLSA-N 375.424 5.076 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776113282 DWJLNCJWRHRHKM-VGOFMYFVSA-N 388.488 5.599 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(C)c(C(=O)O)c2)cc1 1776126029 ZZBCIZZANUACTC-GDNBJRDFSA-N 380.484 5.939 30 20 GKED C=CCCC[C@@H](NCc1ccc(-c2ccc(Cl)c(Cl)c2)s1)C(=O)O 1776170909 PMHGUWXAUOYWDF-MRXNPFEDSA-N 384.328 5.621 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C/C(=O)c3cncc(C(=O)O)c3)o2)cc1 1776271509 VOSHXCQKHSYSAM-CSKARUKUSA-N 375.424 5.233 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2ccccc2CC)cc1 1776788212 QVGFMWFHYSCAIU-DEOSSOPVSA-N 397.559 5.904 30 20 GKED CCCCCCCOc1cccc(/C=C/c2ncc(C(=O)O)c(C(C)C)n2)c1 1776789242 YARYENKSRSDJIC-OUKQBFOZSA-N 382.504 5.818 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(OC)c3oc(C(=O)O)cc23)oc2ccccc12 1776956352 TYLRIJNHPUPBLI-NTMALXAHSA-N 390.391 5.344 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4ccc(O)cc4C3=O)s2)c1 1777684324 PTWBGUNFUTVQCP-RVDMUPIBSA-N 376.433 5.031 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N[C@H](C)c1ccc(C#N)cc1 26131951 RBIMBNXKGSRVNY-MRXNPFEDSA-N 391.540 5.394 30 20 GKED N#C[C@H](C(=O)CSc1ccccc1Cl)c1nc2ccccc2n1C(F)F 41559569 RZKODOWTSUPLCZ-LLVKDONJSA-N 391.830 5.053 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(Cl)s1)c1nc2ccccc2n1C(F)F 51655976 DXMPZGQQPVASPY-OKPNEXGHSA-N 377.803 5.036 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1c(-c2c(F)cccc2Cl)noc1C 65775593 FRFPSUBBTNLXPB-UHFFFAOYSA-N 398.865 5.313 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1ccc(OCc2ccccc2C#N)cc1)C1CC1 65829278 HJCFHLBMTCUZHQ-KRWDZBQOSA-N 386.451 5.096 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1nc(C2CC2)no1 102778544 PGQLNVGBIBLKBF-ZDUSSCGKSA-N 394.862 5.224 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F 102798173 QOTAJOFXSLJWMR-UHFFFAOYSA-N 379.357 5.159 30 20 GKED Cc1cc(C)n(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 107803198 ZBHBMDSUQGEIOX-UHFFFAOYSA-N 392.462 5.280 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccsc3)nc2C)cc1 108808462 BMLIOUYYIBVVLC-UHFFFAOYSA-N 391.496 5.078 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc(-c2ccsc2)s1 112246780 ACGGEOPWWGOURJ-GFCCVEGCSA-N 385.539 5.518 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122025820 POGHHTMLXADCOJ-HNAYVOBHSA-N 375.497 5.138 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccc(Cl)cc1 122339291 CNRVFEJRTLGBBV-IBGZPJMESA-N 382.250 5.050 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 128897203 BPVJXUOUEMWQKR-TZMCWYRMSA-N 399.928 5.216 30 20 GKED CC[C@](C)(NCc1cccc(OCc2ccccc2C#N)c1)c1nccs1 152664964 OAIALYOPYLOILN-QFIPXVFZSA-N 377.513 5.009 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(F)c(NC(=O)c2ccoc2C)c1)c1ccccc1 153665359 AHUGSLDPBVAGBA-INIZCTEOSA-N 392.430 5.278 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)ccc1Cl)c1nc(-c2ccccc2)cs1 155435986 JVARYHWUXLAZMF-ZDUSSCGKSA-N 388.279 5.363 30 20 GKED C[C@H]1CSCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 192203246 QKKDKMXFCMZZJO-DNVCBOLYSA-N 399.947 5.212 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 217227251 ILHBCGCNAWGYDD-ROUUACIJSA-N 381.545 5.913 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1 255902385 UFOUWUWGHAHSAU-KHPPLWFESA-N 393.899 5.546 30 20 GKED CCc1nc2cc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)ccc2o1 329422534 FTQBZIKCTURGJS-INIZCTEOSA-N 392.503 5.485 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ncc(-c2ccccc2F)o1 371569822 IUIYYJBLFUWVFV-UHFFFAOYSA-N 395.459 5.058 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)C1 412198914 GHRANBPRTQYWLC-VJICWTENSA-N 398.428 5.290 30 20 GKED CCN(Cc1cccc(Br)c1)C(=O)Nc1ccc(C#N)cc1Cl 426128703 OKMDIAVUGGKITI-UHFFFAOYSA-N 392.684 5.028 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1 428869284 CKKPDGQLVSJZIY-UHFFFAOYSA-N 395.459 5.044 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cn1 429382718 JFRSKLUGIPGYBF-HNNXBMFYSA-N 387.443 5.162 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1cccc(SCC#N)c1 429962168 MIDLAPSIBUEVNB-LBPRGKRZSA-N 379.312 5.442 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)s1 430593289 IPQNFXKZTBNLKL-AWEZNQCLSA-N 394.462 5.771 30 20 GKED COc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)s2)cc1 430622509 FMRXPZZDCSXBAW-CQSZACIVSA-N 397.525 5.063 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 432678858 NCURVIKJIHEKEK-SFHVURJKSA-N 380.879 5.009 30 20 GKED Cc1cc(Br)ccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432743548 ZZJABGKGVUWAAK-SFHVURJKSA-N 386.293 5.314 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 433152773 SPZTVXVJXIRNMM-UHFFFAOYSA-N 380.448 5.036 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1C1CC1 435560898 XWFWUHUQTCUPHD-UHFFFAOYSA-N 399.450 5.192 30 20 GKED C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438629486 FWSNGOAOTKKVIK-XIKOKIGWSA-N 391.368 5.331 30 20 GKED CCCc1c(NC(=O)Nc2cccc(Cl)c2F)cnn1-c1cccc(C#N)c1 439241631 XSDWPVBWKQKDLS-UHFFFAOYSA-N 397.841 5.133 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(OC2CCCC2)c(F)c1)c1ccccc1 439382831 DUPIAVOYHMYRBI-HXUWFJFHSA-N 381.451 5.314 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 439508654 CLADYSVCQSHNOX-NLWGTHIKSA-N 393.556 5.881 30 20 GKED COC(=O)[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1Cl 439567711 WWZCFVJLUYQBEN-SFHVURJKSA-N 393.270 5.002 30 20 GKED O=C(Nc1ccc(F)c(C2CC2)c1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 439779638 GAZGZROHBWKWRT-UHFFFAOYSA-N 384.295 5.052 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)N[C@H](CCC#N)c1ccccc1 444123944 CWQRXQDKCSSKGF-RTBURBONSA-N 389.421 5.333 30 20 GKED N#CCCCn1cc(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)c2ccccc21 444284396 UFUDDYGQILHVPD-IBGZPJMESA-N 399.416 5.021 30 20 GKED CC(C)C(C)(C)CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 446225875 KPEWKLFEYSQUHX-UHFFFAOYSA-N 379.504 5.135 30 20 GKED CC[C@H](N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1 447546245 UIFGLAKCCBZBBN-XUZZJYLKSA-N 380.495 5.275 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H]1OCCc2sccc21 455254909 XOURFKKLVZAATI-BTYIYWSLSA-N 384.545 5.424 30 20 GKED N#CCc1cccc(NC(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1 455912419 XMMBLICCVJCDID-UHFFFAOYSA-N 387.405 5.183 30 20 GKED CCO[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1=CCCC1 465175389 MCTSQBJBLBRPHH-JOCHJYFZSA-N 376.456 5.195 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](CC)c2nc(C(F)(F)F)cs2)c1 467708452 FZUJYOVVZOTXOE-CQSZACIVSA-N 399.438 5.390 30 20 GKED CC(C)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(F)cc1F 468527403 JCJSTZPWYQIPIF-OAQYLSRUSA-N 385.458 5.154 30 20 GKED Cc1cc(C)c([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1C 469274967 WCUGTRPNOPDLTJ-LJQANCHMSA-N 375.516 5.368 30 20 GKED C[C@H](CC#N)NC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 480602585 QJJNORCWVAWZPX-GFCCVEGCSA-N 398.825 5.243 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N(C)Cc2ccc(C#N)cc2)c1 485417551 WICRSRYKWKPTED-UHFFFAOYSA-N 385.467 5.110 30 20 GKED CCC(C)(C)[C@H]1CCc2nc3ccccc3c(C(=O)N3CCC(C#N)CC3)c2C1 490028204 GFZSBKUKERITGV-SFHVURJKSA-N 389.543 5.152 30 20 GKED N#Cc1cccc(CN[C@H](c2ccccc2)c2cc(Br)ccc2F)c1 490135867 IUUMAAAGKBFYIL-OAQYLSRUSA-N 395.275 5.339 30 20 GKED CCNc1ccc(Cl)cc1NC(=O)c1ccc(COc2ccccc2C#N)o1 490637247 GACSZLLXNISQPB-UHFFFAOYSA-N 395.846 5.068 30 20 GKED CCSc1ccc([C@@H](C)NCc2cc(C#N)ccc2Br)cc1 492586861 ZMNKSCXRNQOBDZ-CYBMUJFWSA-N 375.335 5.284 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)C1CCCCC1 514896649 MXTYOHSMDVHYKN-QGZVFWFLSA-N 378.541 5.549 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 517380324 UQGQNWZLGWEYLN-UHFFFAOYSA-N 389.377 5.109 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520721480 SXRMIEJWNJVJGS-UHFFFAOYSA-N 396.368 5.040 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CS[C@H]2CCCc3ccccc32)c1C 523950613 YOVQEQWZHCOQAG-QFIPXVFZSA-N 378.541 5.361 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2ccc(CC#N)cc2)nc1-c1ccccc1 534681891 VFSRBLKGEMIIIL-OAQYLSRUSA-N 399.494 5.508 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1Cl 543653020 QRGFTZIZAIYSKQ-WBVHZDCISA-N 389.833 5.581 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 549007824 XOUJLEKAULECCN-SFHVURJKSA-N 377.528 6.119 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)c1nc(O)c2c(C)c(C)sc2n1 551688603 DQBWFVZPFLBQSK-NSHDSACASA-N 393.965 5.478 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 588247174 JNXWIWMFYHASIH-UHFFFAOYSA-N 398.894 5.044 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1 588885178 DHSRRKOBLVSTDD-UHFFFAOYSA-N 389.867 5.163 30 20 GKED CN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@H]1CC[C@@H](C(F)(F)F)CC1 589529597 RYRDOQCFBVVOCN-IYBDPMFKSA-N 391.437 5.138 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)CC1(C#N)CC1 590278198 VHLKIDBAGAMJNC-UHFFFAOYSA-N 390.462 5.364 30 20 GKED N#CCCCCCC(=O)N1CCCCC[C@H]1C1CCN(Cc2ccccc2)CC1 590892008 PRFMIAWFVOHTQO-DEOSSOPVSA-N 395.591 5.144 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2sc3cc(C)ccc3c2Cl)cc1 591011939 QBQZUSKJTCLQBZ-UHFFFAOYSA-N 384.888 5.031 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)C1 596649607 CZPSCSXXCYJEOM-OAHLLOKOSA-N 376.485 5.121 30 20 GKED C[C@@H](Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1)c1cccc(C#N)c1 600848534 ULHZNAIYPYKWNR-HZPDHXFCSA-N 381.907 5.399 30 20 GKED N#Cc1c(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)sc2c1CCCCCC2 603996120 AADMBMRIHCLEEH-STQMWFEESA-N 384.467 5.586 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(Cl)s3)o2)c1C 607438992 GEOACRQQTLPOPH-UHFFFAOYSA-N 393.921 5.031 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(Cl)cc1F 609061835 YUCFSHJUOVFGNB-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N[C@H](c2ccccc2)C2CCC2)o1 609177288 MDAXCSBWKQJZPB-HSZRJFAPSA-N 386.451 5.001 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2Cl)c1 609504053 QMYXMUXUGAQQDB-RYUDHWBXSA-N 397.208 5.209 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccnc2ccccc12 609907327 JKXZRLHODVBTHD-INIZCTEOSA-N 375.497 5.058 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CCCCCc1ccc(O)cc1 609922097 SCAQPINDCAMUPH-UHFFFAOYSA-N 378.516 5.052 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc4cccc(F)c4o3)c2)c1 610224485 SJNYTSYMRZILAR-UHFFFAOYSA-N 386.382 5.275 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nnc(-c2ccncc2)n1C1CCCCC1 610863405 KJINXVGWOQYSCK-HXUWFJFHSA-N 389.528 5.072 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1 611278994 XLLNJPBLRKQXGC-BFUOFWGJSA-N 387.405 5.089 30 20 GKED CN(C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(C#N)cc1F 726368922 RMGCKYZGPMDXMV-UHFFFAOYSA-N 381.410 5.189 30 20 GKED N#CCn1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc2ccccc21 729317576 ZQMRPAYMXWQJKJ-JOCHJYFZSA-N 390.446 5.073 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C\c1ccc(Cl)cc1 730997841 WLQFYWCNWNHGEB-BMSUMIBZSA-N 392.933 5.004 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)CSc2ccc(C(C)(C)C)cc2)c1 733774402 NTCXXPXWDYYALE-IBGZPJMESA-N 396.556 5.074 30 20 GKED O=C(/C=C\c1ccc(-c2c(F)cccc2F)o1)c1cccc(N2CCOC2=O)c1 734368246 RCMFDGHFVZZRQH-CLFYSBASSA-N 395.361 5.078 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)C[C@@H](CC)c1ccc(C)cc1 739153299 AIVHQCJSZFZEQL-IRLDBZIGSA-N 390.527 5.351 30 20 GKED N#Cc1ccc(NC(=O)c2sc3ccccc3c2Cl)cc1C(F)(F)F 744371707 ZOZCCKIHJKZIQN-UHFFFAOYSA-N 380.778 5.697 30 20 GKED CCC[C@@H](CC1CCCCC1)C(=O)OCc1nnc(-c2cccc(C#N)c2)o1 745025807 DGHHPDOXFTWRQC-IBGZPJMESA-N 381.476 5.038 30 20 GKED O=C1/C(=C/c2cn(-c3ccccc3)nc2-c2ccncc2)CCc2ccccc21 747003716 MRZVSTWHLRDCEO-CAPFRKAQSA-N 377.447 5.147 30 20 GKED C#Cc1cccc(NC(=S)N(C)[C@@H](c2ccncc2)c2ccc(Cl)cc2)c1 749013246 NQCFQFGZXHXQRI-OAQYLSRUSA-N 391.927 5.135 30 20 GKED Clc1ccc(-c2nc(CON=Cc3ccc(Br)cc3)co2)cc1 749528682 ZOFFHMYIIMJSPD-UHFFFAOYSA-N 391.652 5.308 30 20 GKED COc1cc(/C=C/C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1O 750917004 QSTNFSRCJYEVJP-DUXPYHPUSA-N 390.279 5.335 30 20 GKED CCCCOC(=O)c1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 754385453 WDLMRWAHMYJRCD-UHFFFAOYSA-N 391.254 5.074 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3cc(Cl)ccc3OCC#N)oc12 754584092 PSSMVENSNFAHBO-AWEZNQCLSA-N 384.863 5.238 30 20 GKED CCN(CC)c1ccc2cc(C(=O)/C=C/c3cnc(C(C)C)s3)c(=O)oc2c1 758431307 WYIFOYSJVIEKCV-MDZDMXLPSA-N 396.512 5.115 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 767703343 UEBPVSUATAQURY-ZDUSSCGKSA-N 392.908 5.127 30 20 GKED N#C[C@H](COC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)Cc1cccs1 772736168 XASGHQVFJUAKBE-CQSZACIVSA-N 398.871 5.128 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(Br)c1 773962606 XYOSMURDNJJAPW-KRWDZBQOSA-N 393.284 5.115 30 20 GKED N#C[C@H](C(=O)C1CCC(=O)CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 773982618 JEPJLULMFRPIKB-CQSZACIVSA-N 393.295 5.052 30 20 GKED COc1ccc(CC(=NOC2CCOCC2)c2cc(Cl)ccc2Cl)cc1 774443962 IOJCREUADWLAGV-UHFFFAOYSA-N 394.298 5.144 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccccc2F)C2CCCC2)ccc1OC 774449690 QLHMNIQBEZMBGF-CYFREDJKSA-N 396.506 5.536 30 20 GKED Cc1cccc(-c2nnc([C@@H](C)Sc3nc4c(cc3C#N)CCCC4)o2)c1 775057045 YDAGCPGVEJNIQA-CQSZACIVSA-N 376.485 5.044 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccnc1-c1ccc(Cl)s1 782912418 ZFTAGRXQIDREIC-GFCCVEGCSA-N 398.875 5.398 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 785767280 FONKCYUAKUXQRT-OAQYLSRUSA-N 386.517 5.036 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1ccc(Cl)nc1C(F)(F)F 787254673 IEUXJDZGBJHSSV-CVEARBPZSA-N 379.813 5.026 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)c(F)c2)cc1 790544750 YYXQRGONXFAZGO-LJQANCHMSA-N 378.834 5.316 30 20 GKED COc1ccc2cc(C(=O)/C=C/c3cnc(-c4ccccc4OC)nc3)ccc2c1 792858793 MCAAODYUNBKVTN-KPKJPENVSA-N 396.446 5.210 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)NCCCCC(F)(F)F)cc2)cc1 794975685 UZSOJQIMTOPWRB-UHFFFAOYSA-N 393.434 5.370 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccccc1SC(C)(C)C 798181827 ZVHRENWFLJGMOH-QGZVFWFLSA-N 394.588 5.163 30 20 GKED Cc1cc2occ(CC(=O)OCCCC3(C#N)CCOCC3)c2cc1C(C)C 800099370 ITKWBZGFVABZLH-UHFFFAOYSA-N 383.488 5.051 30 20 GKED CN1CCC[C@@H](COC(=O)CCCCCC#N)[C@H]1c1ccc(C(F)(F)F)cc1 805885998 XLQVBVACDRBCCB-FXAWDEMLSA-N 396.453 5.106 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2cc(Cl)cc(Cl)c2O)c1 806147609 YYTYCQINCARGMJ-DNVCBOLYSA-N 393.314 5.621 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21)c1nc2cc(Cl)ccc2s1 860479481 QJBMVJFWKIWKLK-IHETXDGRSA-N 399.302 5.365 30 20 GKED Cc1ccc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc1[N+](=O)[O-] 864004018 BLYUAZWVAHRVPT-UHFFFAOYSA-N 391.402 5.105 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1sccc1Br 915049774 XOFTZWPSQRIOPU-UHFFFAOYSA-N 378.320 5.470 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1csc(-c2ccccn2)n1 915954790 LXEBSWXYZZLMIU-UHFFFAOYSA-N 384.508 5.241 30 20 GKED Cc1ccccc1OCCCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917046950 NTINGRDZDIABHF-OAHLLOKOSA-N 384.888 5.294 30 20 GKED CCCOc1ccc(C=NOCc2ccc(Cl)c3cccnc23)cc1OC 917395141 ABEPMDNGJRACNW-UHFFFAOYSA-N 384.863 5.236 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NN[C@@H](C)c1ccccc1 920385680 FYKMOIISCPGNKL-AWEZNQCLSA-N 387.314 5.231 30 20 GKED CCOc1ccc(/C=C/C(=O)c2sccc2Br)cc1OCC 920991438 HZGRBQSZDHJLRF-FNORWQNLSA-N 381.291 5.204 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccsc1C(F)F 930110597 QUTDEGFPYXIXCY-BQBZGAKWSA-N 395.315 5.325 30 20 GKED C[C@@H](C=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(Br)c1 1776033406 CDTQUCHWXUEFMR-JTQLQIEISA-N 381.657 5.002 30 20 GKED CCC(=NNc1ccc(C(=O)O)c(F)c1)[C@H](C)c1cccc(Br)c1 1776077156 XJOAPBFJNCOLBK-LLVKDONJSA-N 393.256 5.268 30 20 GKED Cc1c(NN=C2CC[C@H](C)c3ccc(Br)cc32)cccc1C(=O)O 1776089151 DOWAWXKCIGNGBL-NSHDSACASA-N 387.277 5.169 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccccc3OC(F)F)cc2)cc1 1776120263 ZRBMQQKCYPRTSY-VGOFMYFVSA-N 394.373 5.549 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C\C(=O)c3ccc(F)cc3F)c2)c1 1776125471 JPPZXUPQPFVPTO-YFHOEESVSA-N 394.373 5.138 30 20 GKED C=CCC1(C(=O)O)CCN([C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 1776157949 CVUURBDLZQPMCC-FQEVSTJZSA-N 387.882 5.311 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)nn(-c2ccccc2)c1Cl 1776783348 SGBLDHYNRKVYNT-QGZVFWFLSA-N 391.943 5.128 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)[C@H](C)c2ccccc2)c1 1776789050 MPYGWLPAMVTVLU-XXBNENTESA-N 383.532 5.382 30 20 GKED CN(CCc1ccccc1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 47570438 NIOKZKSIPBYQGC-UHFFFAOYSA-N 399.494 5.038 30 20 GKED CC[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1nc(C)cs1 105503592 RYMMGJKIDOGZQY-NRFANRHFSA-N 377.513 5.143 30 20 GKED Cc1csc(C(C)(C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 116499036 SUMMMAWJPVTSOH-UHFFFAOYSA-N 392.484 5.172 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@H]1CCC[C@@H](C(F)(F)F)C1 128964991 VSWAGLDUYHMXSU-VHSXEESVSA-N 387.295 5.074 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1nc(Cc2ccc(F)cc2)no1 133216388 APDQZYNYJQHWJP-LSDHHAIUSA-N 396.491 5.224 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)c1ccc(COc2ccccc2C#N)o1 153540181 KMGMBANKLZLARQ-UHFFFAOYSA-N 390.439 5.120 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(-c2ccncc2)cc1 174346789 BOGTZCGZHIQUQQ-GOSISDBHSA-N 396.494 5.055 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2ccc(Br)s2)n1 177746952 FRZSNCOULPZSTI-LBPRGKRZSA-N 397.363 5.290 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2ccc(Cl)s2)cc1 193435483 IHMAAKLALYIZQB-UHFFFAOYSA-N 396.899 5.228 30 20 GKED COc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 193614739 RNMKYLRWUPFTKV-FZKQIMNGSA-N 396.899 5.452 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(Cl)c1Cl 194075552 VGMFCGZEGDKUHX-GFCCVEGCSA-N 379.312 5.569 30 20 GKED CC(C)(C)c1csc(CNCc2cccc(OCc3ccccc3C#N)c2)n1 236717797 XZHHMFBGGOFLDG-UHFFFAOYSA-N 391.540 5.181 30 20 GKED CC[C@@](C)(NCc1cccc(OCc2ccccc2C#N)c1)c1nc(C)cs1 237064955 YNJDSDDMMKMZAW-HSZRJFAPSA-N 391.540 5.317 30 20 GKED CCN(Cc1ccccc1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 301244918 YRZHODXXWGCMBY-UHFFFAOYSA-N 386.520 5.513 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CC1 303538855 HKVQXNFVNRPSTM-KRWDZBQOSA-N 386.451 5.096 30 20 GKED C[C@H]1CC[C@H](c2ccccc2)N(C(O)=Nc2nc(C3CCOCC3)cs2)C1 329460470 SCIZEFGJWCNTDF-HNAYVOBHSA-N 385.533 5.056 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H]1CCSc2c(F)cccc21 330303653 JZNARBOSTDPXES-DOMZBBRYSA-N 392.521 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@](CO)(c2ccccc2)C1 374673077 HFEIYKPBXKLYJB-RUZDIDTESA-N 392.543 5.097 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 429052534 BDDDWEHFVYNHRC-UHFFFAOYSA-N 377.366 5.265 30 20 GKED C[C@@H](NC(=O)CCSc1ccnc2cc(Cl)ccc12)c1ccc(C#N)cc1 433862898 OQNQXVCBKPLLOX-CQSZACIVSA-N 395.915 5.119 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 437985621 KHGONOQPHQVAQC-LJQANCHMSA-N 384.863 5.274 30 20 GKED C[C@H](Sc1ccccc1C#N)c1nc(O)c2c(-c3ccccc3)csc2n1 439700337 XKQUQMJFCROLPM-ZDUSSCGKSA-N 389.505 5.789 30 20 GKED CCCc1c(NC(=O)c2[nH]c3ccc(C)cc3c2C)cnn1-c1cccc(C#N)c1 440091038 JDOQNTYBTIWNIC-UHFFFAOYSA-N 397.482 5.047 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccncc1Oc1ccccc1 440475352 DVTIOJYOMBPFEL-MRXNPFEDSA-N 389.480 5.378 30 20 GKED C=CCC[C@H](NC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)c1ccc(C(F)(F)F)cc1 441839193 ARTMPBPJZPJVMG-RZRMAFQFSA-N 393.449 5.224 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@H](C)c3cccc(C#N)c3)o2)cc1 442905340 SFTNTEFXOWXBQX-OAHLLOKOSA-N 378.501 5.308 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]3CCC[C@H]32)cc1F 444392775 CJUCPRAJSKJATA-DNVCBOLYSA-N 379.435 5.286 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 447376406 UIINGQIZRGGYRC-UHFFFAOYSA-N 377.488 5.115 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c(Cl)c1 455727244 FXNNTRSUJNZVJC-LJQANCHMSA-N 388.298 5.819 30 20 GKED Cc1ccc([C@H]2CSCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458798149 HHBGPQDOMFEEMC-FGZHOGPDSA-N 393.556 5.230 30 20 GKED C=CCC[C@H](NCc1nnc(-c2cc3c(s2)CCCC3)o1)c1ccccc1 461377124 ROTNVDWDEGTOIT-SFHVURJKSA-N 379.529 5.474 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(F)c(Br)c1 462232613 NKLWWKULJQNBGY-LBPRGKRZSA-N 379.298 5.595 30 20 GKED Cc1ncccc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464285501 VPJZFKQQDKTNIS-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc2nc(-c3ccccc3)oc2c1 475772250 JXJYMWLLUYMPNO-UHFFFAOYSA-N 399.475 5.753 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1ccc(F)c(F)c1 477740739 CNTMYFUYKBCJLI-QIJUGHKUSA-N 395.453 5.063 30 20 GKED CCC[C@@H](C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1)c1ccccc1 481805731 KAXVQDZCMQDIMW-QGZVFWFLSA-N 376.378 5.022 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(Cl)ccc2Br)cc1 483858316 KIFOJCPWCRKNTJ-UHFFFAOYSA-N 377.669 5.156 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1)c1c[nH]c2ccccc12 486432304 JUCJIQGCOLIJSP-BFUOFWGJSA-N 385.389 5.061 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1)c1ccccc1 487247871 BDHUVFJRHAKKNZ-AABGKKOBSA-N 397.316 5.104 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccncc2)c(C)c1 489335652 IFRQDWKDTHOABT-UHFFFAOYSA-N 376.481 5.713 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1cccc(OCc2ccccc2)c1 499739131 NTENIGHGHAVFPQ-FQEVSTJZSA-N 378.516 5.017 30 20 GKED Cc1c(NC(=O)c2ccccc2Sc2ccccc2C#N)cnn1CC(C)C 500177759 FJQAPKOTSASWSL-UHFFFAOYSA-N 390.512 5.123 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)Oc1ccccc1F 500740789 DFSLCXKSSKWGOW-INIZCTEOSA-N 390.414 5.204 30 20 GKED Cc1cc(NC(=O)C(C)(C)c2cc(F)cc(C#N)c2)ccc1Oc1cccnc1 506787158 ADLNDSCUPSOBEY-UHFFFAOYSA-N 389.430 5.109 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccc(Cl)cc2F)c1 513385539 XRCUPQOEUWLZCO-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(F)F)c2ncccc12 516069964 ARVJXBHPEFIXLJ-UHFFFAOYSA-N 383.398 5.056 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1ccc(Oc3ccccc3F)c(F)c1)CC2 516819140 IPOKRHUZHRGRKC-NRFANRHFSA-N 376.406 5.406 30 20 GKED COc1ccc(-c2csc3ncnc(N[C@H](C)c4ccc(C#N)cc4)c23)cc1 516827601 DSLATNCGXPXKNV-CQSZACIVSA-N 386.480 5.412 30 20 GKED N#Cc1ccc(N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1[N+](=O)[O-] 516860261 WPBKONLZCQNARR-MRXNPFEDSA-N 394.431 5.219 30 20 GKED CC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1C 518372311 OEZLGSBCZDQDRH-UHFFFAOYSA-N 399.450 5.064 30 20 GKED CCc1cc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1Cl 518661871 KHRJYRPTEHRKLA-AWEZNQCLSA-N 388.920 5.314 30 20 GKED C=C1CCN(C(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)CC1 519419732 JKSKHMDEFMRYLY-UHFFFAOYSA-N 381.472 5.656 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 520940203 IMOGJTVOHBUSSE-QGZVFWFLSA-N 399.535 6.054 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 521016232 SVQGGYCHSKLZCT-CYBMUJFWSA-N 382.316 5.051 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(Cl)cc1)C1CC1 521259540 OUBYSORQLLQIHH-OAHLLOKOSA-N 399.947 5.788 30 20 GKED CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521712708 OUHWTCCZNOHKAX-HOTGVXAUSA-N 388.558 5.253 30 20 GKED COc1ccc(-c2nc(CS[C@H](C)c3ccc(C#N)cc3)cs2)c(OC)c1 522840428 KJNAZCQIUNLVJX-CQSZACIVSA-N 396.537 5.693 30 20 GKED CC[C@H](NCc1ccc(OC)c(OCCCC#N)c1)c1ccc(Cl)s1 523691566 PZGYUZPPPYPEGK-HNNXBMFYSA-N 378.925 5.334 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 525284242 ZBOWKELNSSXAKL-AWEZNQCLSA-N 379.460 5.028 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCCOc3c(Cl)cccc32)cc1 537237131 PSEGJNDQZJMKMK-GOSISDBHSA-N 383.879 5.177 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1cccc(C#N)c1C 539908705 MSKYQTBFYBXRFK-UHFFFAOYSA-N 375.497 5.210 30 20 GKED CCN(C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)[C@H](C)c1cccnc1 541159330 VTAJUZFUJWLZCY-RTBURBONSA-N 398.510 5.474 30 20 GKED C=CCC[C@H](NC(=O)c1oc(C2CC2)nc1C)c1ccc(C(F)(F)F)cc1 546048159 GOVZWGXWGNDBTO-INIZCTEOSA-N 378.394 5.317 30 20 GKED CN(C(=O)c1cnc(C(F)(F)F)c(C#N)c1)c1ccc(Oc2ccccc2)cc1 550263306 XMPANGPJPYLHTI-UHFFFAOYSA-N 397.356 5.041 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 552776859 QTWFUMNKKBAVQQ-UHFFFAOYSA-N 386.455 5.079 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 558748165 UYLNDEDLDFSXBI-CYBMUJFWSA-N 398.322 5.431 30 20 GKED N#C[C@@]1(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)CC12CCCC2 562688811 JGXLNNONCZCXIE-HXUWFJFHSA-N 379.441 5.076 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F 566887927 VPNNRSNJAQNJSQ-CTNGQTDRSA-N 388.417 5.173 30 20 GKED COc1cc(CSCCC(C)(C)C#N)ccc1OCc1cccc(C#N)c1 570718620 IALVNRIGPXVHFW-UHFFFAOYSA-N 380.513 5.319 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@H]1c1cccc(F)c1F 577550769 OYCRIUIFTMSCMA-PMACEKPBSA-N 388.417 5.173 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2cc(Br)cs2)c1 589739601 XMQPATFRFVUKOD-UHFFFAOYSA-N 395.322 5.129 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCc2sccc2[C@H]1c1cccs1 593953658 IBFZJTZLTJBTIC-BTYIYWSLSA-N 392.549 5.034 30 20 GKED CC(NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)(C1CC1)C1CC1 596695122 PJYDABJYJCEOFG-UHFFFAOYSA-N 389.499 5.032 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCSc1ccc(F)cc1 603969314 KUQNILVELPYMIY-UHFFFAOYSA-N 382.485 5.547 30 20 GKED Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)c3ccc(C#N)nc3)nc2c1 609640513 XSHUBRPXQJPDCU-UHFFFAOYSA-N 398.491 5.027 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3nc(-c4ccccn4)cs3)c2)cc1 609989648 RYCGHOLRFQHFIZ-UHFFFAOYSA-N 397.463 5.073 30 20 GKED CC[C@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(F)cc1F 610007477 BPCXJFDJEWZGTB-KRWDZBQOSA-N 380.847 5.313 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 610434090 UEMVKTIYAFIEAC-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C[C@H](CC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1 615939966 NUMGNISNYLFPKR-WXHSDQCUSA-N 399.350 5.345 30 20 GKED Fc1cccc(OC(F)(F)F)c1CNc1cccc(NCC(F)(F)F)c1 630068552 ULDVVDMULNPDQC-UHFFFAOYSA-N 382.279 5.311 30 20 GKED CC(C)(CC(F)F)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494402 NUQZIXMDZYIUGR-UHFFFAOYSA-N 395.265 5.596 30 20 GKED N#C[C@H](C(=O)c1cc2cc(C(F)(F)F)ccc2s1)c1nc(C2CC2)cs1 659116217 RIJVBVGTJGUPQY-GFCCVEGCSA-N 392.427 5.744 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1F 678944654 FHXGXUAVTJHJFJ-IVZWLZJFSA-N 375.303 5.525 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(SC3CCCCC3)cc2C)c1 726487824 JWYOPYKSVBAYPF-UHFFFAOYSA-N 380.582 6.210 30 20 GKED N#CCCCOc1cccc(C=NN=C(C(=O)c2ccccc2)c2ccccc2)c1 726738502 XFYRHIAPJWJINV-UHFFFAOYSA-N 395.462 5.075 30 20 GKED Cc1c(NCc2c(F)c(F)c(F)c(F)c2F)cccc1OCC(F)(F)F 727827428 FHUKSSCRMNMKCC-UHFFFAOYSA-N 385.254 5.244 30 20 GKED O=C(/C=C\c1c[nH]nc1-c1ccc2c(c1)OCO2)c1cc(Cl)sc1Cl 728156635 GLPBASABKVEBRD-IWQZZHSRSA-N 393.251 5.070 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)/N=C/c1cc([N+](=O)[O-])ccc1O 729149699 NXMMTSNVBJUJRV-JYQBEENSSA-N 385.420 5.052 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)/N=C/c1ccc(O)c(O)c1O 730148017 XXAUXQHPNCPXHD-PRMNVEQPSA-N 388.876 5.069 30 20 GKED COc1ccc(/C=C2/CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)c(Cl)c1OC 730433919 KFNZMYGAXCIFDD-HDVIWIBHSA-N 399.830 5.095 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)CSc3ccccc3)n2)cc1 732496481 WPYPRYCWHRGGNO-APWZRJJASA-N 392.549 5.723 30 20 GKED CC1CCN(c2ccc(NC(=O)Nc3cccc(OCCCC#N)c3)cc2)CC1 733617748 OBSKNTXUEBHWBD-UHFFFAOYSA-N 392.503 5.249 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2CC2CCCCC2)c1 733805326 QUANZHOKVMCGPC-RTWAWAEBSA-N 383.536 5.012 30 20 GKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 734082446 BURHIVJSBUDDKF-APWZRJJASA-N 382.529 5.601 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)[C@@H](C)Cc3ccc(Cl)cc3Cl)[nH]c12 735788552 DZUNKDZLRAANRU-WFASDCNBSA-N 386.282 5.233 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 739143933 TYTYRWMVEMBISE-RDTXWAMCSA-N 382.385 5.309 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1csc(-c2csc(C)n2)c1 739421272 GWVXIZJRCNGEDK-UHFFFAOYSA-N 382.436 5.430 30 20 GKED CCOc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc(Cl)c1OC 741842799 BZDLXGQLLKATRL-SNAWJCMRSA-N 397.283 5.006 30 20 GKED CC(=NN=Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)c1cnccn1 745202955 BOEXTYBIBAZWPK-UHFFFAOYSA-N 399.281 5.206 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C\c3ccc(-c4c(F)cccc4F)o3)ccc21 754690061 NUARSTQGLKYEKK-YFHOEESVSA-N 393.389 5.030 30 20 GKED C=CC[C@H](NC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1)c1ccncc1 754921938 UBCDROQSVNBVFZ-UUOWRZLLSA-N 385.511 5.787 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(F)c(F)c1)c1nc2cc(Cl)ccc2s1 756245765 YGXZBLXOARBGSW-ZDUSSCGKSA-N 390.842 5.427 30 20 GKED C#Cc1cccc(N(Cc2nnc(-c3cc(C)oc3C)o2)Cc2cccs2)c1 760858058 WKWVKPSXNDFOOK-UHFFFAOYSA-N 389.480 5.196 30 20 GKED Cc1ccccc1-c1cc(C(=O)O[C@@H](C#N)C(C)(C)C)c2cnn(C(C)C)c2n1 765630068 ODLUEWBIDCHGFN-FQEVSTJZSA-N 390.487 5.083 30 20 GKED C=CC[C@@H](N[C@H](CC)c1ccc(I)cc1)c1ccncc1 766018094 FZTWGPUIOZFNJT-QZTJIDSGSA-N 392.284 5.044 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 774446622 CRMYSBXYZBFSOO-TZIWHRDSSA-N 388.433 5.627 30 20 GKED C=CC[C@@H](C(=O)O[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 778426590 GSEKCMXQEMJLRV-FUHWJXTLSA-N 385.891 5.187 30 20 GKED CCCOc1ccc(NC(=O)Nc2ccccc2O[C@H](C)C#N)cc1OCCC 780456038 XEOSPSMDQOGQEC-MRXNPFEDSA-N 397.475 5.199 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(OC2CCCCC2)cc1 780580356 ZEZNMCXDADYBOM-INIZCTEOSA-N 379.460 5.333 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@H](Cc1ccc(F)cc1)C(C)C 780670315 KTIIFKTYBPJFHI-LAUBAEHRSA-N 397.494 5.238 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 782556961 WEJHBJVCHSRJKO-KRWDZBQOSA-N 396.450 5.010 30 20 GKED COc1cc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)ccc1SC(F)F 787167601 DLDPRGWFQBOZJX-FNORWQNLSA-N 398.814 5.258 30 20 GKED N#C[C@H](C(=O)COc1ccccc1Cc1ccccc1)c1nccc2ccccc12 792101800 HAFGJQNULIQJEL-HSZRJFAPSA-N 392.458 5.081 30 20 GKED N#C[C@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1cnc2ccccc2n1 792109813 VBLGPAMKDWLUJP-WQJNHMDYSA-N 399.450 5.247 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567320 GNUZJEONCOJKFT-QAPCUYQASA-N 382.529 5.136 30 20 GKED N#C[C@H](C(=O)CCCC1CCOCC1)c1nc(-c2ccc(Cl)cc2)cs1 798816231 IRZJHGAPJPEXQV-QGZVFWFLSA-N 388.920 5.237 30 20 GKED C=CCCc1ccccc1NC(=O)[C@H](CNC(=O)OC(C)(C)C)c1ccccc1 800156653 UFXKMXCFOBMCEK-HXUWFJFHSA-N 394.515 5.052 30 20 GKED Cc1cc(/C=C2\Cc3nc(Cl)ccc3C2=O)cc(C)c1OCc1ccccn1 806577932 JHYDTERWFQVRNW-GZTJUZNOSA-N 390.870 5.148 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)cn1 809439104 LDHXFIDHNGFCEQ-MRXNPFEDSA-N 378.501 5.262 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Br)c(Cl)c1)c1nccc2ccccc12 810717338 UZCPBZNVRQGIDY-HNNXBMFYSA-N 399.675 5.070 30 20 GKED CC(C)(C)OC(=O)NCc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 848549750 STTWVDNZYWZWBL-UHFFFAOYSA-N 379.504 5.125 30 20 GKED CCN(Cn1nc(-c2ccccc2Cl)n(C2CCCC2)c1=S)[C@H](C)C#N 853577016 AOVAQBDGIAXEDB-CQSZACIVSA-N 389.956 5.041 30 20 GKED Fc1ccc([C@@H](CC(F)(F)F)NCc2cnc(CC(F)(F)F)s2)cc1 893229884 MIRJNMWXOZXWBL-GFCCVEGCSA-N 386.336 5.170 30 20 GKED O=C1/C(=C/c2csc(COc3ccc(Cl)cc3)n2)Cc2c(F)cccc21 921264302 QJVUQELIWWMHCT-XYOKQWHBSA-N 385.847 5.337 30 20 GKED N#CCCc1ccc(NC(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1 932584539 XQHSCJWDDUJNLO-UHFFFAOYSA-N 390.512 5.164 30 20 GKED CC(=NNc1ccc(C)c(Cl)c1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776034837 BYVGNSNIKJCJSR-UHFFFAOYSA-N 394.858 5.975 30 20 GKED CC(CCCCCCC(=O)O)=NNc1cccc(Cl)c1Br 1776110829 VSUUWEJFKQQTHX-UHFFFAOYSA-N 375.694 5.316 30 20 GKED O=C(O)c1cc2c(/C=C\C(=O)c3cccc4ccccc34)c(F)ccc2s1 1776114754 ZUKKMCAMIIEKRP-NTMALXAHSA-N 376.408 5.788 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2c(Cl)ccc(Cl)c2Cl)c1)C(=O)O 1776470862 ZBIRSCIFCUXKRX-DAGBOUIGSA-N 399.657 5.395 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2ccc(Cl)cc2)cc1 15340685 MQRJFAMUVKCXIZ-UHFFFAOYSA-N 392.911 5.434 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)on1 69202976 VWFBZIKBFBQREG-FQEVSTJZSA-N 388.427 5.016 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(C(F)(F)F)cc1 108353760 WMBMPNJRFGJLMK-CYBMUJFWSA-N 393.434 5.008 30 20 GKED CCc1nc([C@@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)cs1 111407065 JEXDHYZXCZCNJN-MRXNPFEDSA-N 377.513 5.007 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2sccc2C)cs1 113771931 BIBPPRXMIDDTTI-RMKNXTFCSA-N 382.510 5.402 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nc(-c2ccncc2)cs1 114619706 GSGUVVVBMPYARL-HXUWFJFHSA-N 381.460 5.362 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)[nH]c(C)c1C(C)=O 120060756 WZBXNPNWSLAYSY-CQSZACIVSA-N 399.903 5.231 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(C(C)(C)C)s1 121541655 NARUDLKQENFSMU-MRXNPFEDSA-N 382.529 5.132 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1-c1ccc(F)cc1 176733800 HGTDRMRXSKZXJF-MRXNPFEDSA-N 376.412 5.494 30 20 GKED C=CCC[C@@H](NCc1csc(-c2ccc(O)c(OC)c2)n1)c1ccccc1 180047000 OZWJUKYBPNDDJI-LJQANCHMSA-N 380.513 5.321 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 181570530 UPSWLNLGVDXRGM-HARLFGEKSA-N 396.506 5.469 30 20 GKED Cc1cc(NC(=O)Nc2ccccc2O[C@H](C)C#N)ccc1Oc1cccnc1 183819114 DCLDJSQNQBMFLW-MRXNPFEDSA-N 388.427 5.117 30 20 GKED CCCN(CCc1cccs1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 187129414 BTWWHQNJTKBARS-INIZCTEOSA-N 387.574 5.629 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]nc(C(C)C)c1Br 188058303 WOTSKGJYNLZFEG-UHFFFAOYSA-N 390.325 5.400 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ccc(C)cc2)CC1 191439685 CXGYVUARFDPOAZ-UHFFFAOYSA-N 392.543 5.922 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccccc2SC(F)F)cc1OC 209452359 HCTOVTLIJOAUNN-LUAWRHEFSA-N 391.439 5.227 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2nc3ccccc3[nH]2)C(C)C)ccc1OC 237338389 BHMYZQADFUQIHL-JOCHJYFZSA-N 379.504 5.013 30 20 GKED CCN(CC)c1nc2sc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)cc2s1 302975924 IUNKFWXQLQSPQV-UHFFFAOYSA-N 398.557 5.257 30 20 GKED CC(C)CC[C@@H](NC(=O)Cc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 303485356 PDTAOSWKVSZYIR-OAQYLSRUSA-N 384.907 5.079 30 20 GKED CC(C)[C@@H](/N=C(/O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)c1ccccc1Cl 328697781 LLHRGDJCXJAQOC-CBGDNZLLSA-N 398.938 5.005 30 20 GKED OC(=Nc1ccc(OC2CCCC2)c(Cl)c1)c1coc(C2CCOCC2)n1 328817857 PZXDPUVGSSGYCK-UHFFFAOYSA-N 390.867 5.180 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@@H]4CCC[C@H](C)C4)no3)C2)c1 329710296 MCDPTUNAJMGDHG-JQHSSLGASA-N 382.508 5.097 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cc(Cl)ccc1Cl 329963248 PTHZNCKCPFMQOE-ZOODHJKOSA-N 383.319 5.936 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1CC(C)(C)Oc2ccccc21 413418442 XYXQMWZTXJDMBG-WBVHZDCISA-N 380.513 5.222 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 428887507 XHCLMVISWLNTOT-UHFFFAOYSA-N 376.460 5.144 30 20 GKED CCN(CCC#N)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 429642927 CCERXMOYMZBSBK-UHFFFAOYSA-N 377.366 5.265 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1nc(C(C)(C)C)cs1 431939789 TYNSZFNQAICTNX-DOTOQJQBSA-N 384.549 5.236 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 432339063 ZDENLDRIUURIMO-UHFFFAOYSA-N 379.419 5.441 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cncc(F)c1 437042512 IJLOSFWVXXAZDN-BMIGLBTASA-N 380.307 5.584 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc(C(F)(F)F)cs1 443525779 FIHXCXWUWACUPT-UHFFFAOYSA-N 377.416 5.388 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3c[nH]c4ccccc34)no2)c2ccccc21 445451523 GUXVSLZDVFHCLG-ZHACJKMWSA-N 379.423 5.257 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 448519464 JUGNPHPITBXEOR-UHFFFAOYSA-N 384.794 5.084 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(OC)c1 448940913 BMNFAUZSNHKLLY-OAHLLOKOSA-N 384.501 5.131 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)c1ccccc1C(C)(C)C 460828555 JRLWPRIEKVPPLW-OAHLLOKOSA-N 388.558 5.179 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)c(C)c1 462173706 DHMQUHSQSKCWLB-QHCPKHFHSA-N 376.887 5.408 30 20 GKED CN1CCC[C@H](CNc2ccc(C#N)c(C(F)(F)F)c2)[C@@H]1c1cccs1 462884670 RBBQVSCNJBTWCA-RDTXWAMCSA-N 379.451 5.134 30 20 GKED C[C@@H](C(=O)N(c1ccc(F)c(Cl)c1)c1nccs1)c1cccc(C#N)c1 464398984 PULOSGXBFZCOQL-GFCCVEGCSA-N 385.851 5.276 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1 466894873 WEXVIOOICFDBHK-UHFFFAOYSA-N 384.882 5.242 30 20 GKED CCCC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 469165861 YLBYHJMOSXXEFU-QFIPXVFZSA-N 375.516 5.613 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469226240 FBRFEXTWUMZKBE-LSDHHAIUSA-N 393.874 5.131 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)c2cn(CCCC#N)c3ccccc23)c1 469691606 FPSYDTGIGAYVPN-UHFFFAOYSA-N 389.499 5.004 30 20 GKED CSc1ccccc1CN(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 471271731 DAIYNMFFLYRKFO-OAHLLOKOSA-N 385.558 5.467 30 20 GKED CC(C)(C)OC(=O)C[C@](C)(C#N)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471442509 HKDJCHGCTRQGBH-JOCHJYFZSA-N 398.890 5.207 30 20 GKED N#CC[C@H](CC(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21)c1ccccc1 475447213 USTPLBLVBBQSIU-ZJSXRUAMSA-N 396.490 5.381 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H](C)C(F)(F)F 477973721 YUPURGKQZGBVPH-ZETCQYMHSA-N 381.238 5.137 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc(Oc2ccc(F)cc2)nc1 485731199 HBNOJGZKZXKNKO-UHFFFAOYSA-N 394.471 5.221 30 20 GKED N#CCCC[C@H](NC(=O)CCC(=O)c1ccc2ccccc2c1)c1ccccc1 487268446 MLBMXYGANZFJMT-QHCPKHFHSA-N 384.479 5.354 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2cccc(Cl)c2)no1)c1ccccc1 487470545 HXOVFVDNIDZSTQ-GOSISDBHSA-N 379.847 5.160 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cccc(OCc2cccc(OC)c2)c1C 488942218 AZUYZWGOKALVFM-IBGZPJMESA-N 380.488 5.155 30 20 GKED O=C(CCc1cccc(C(F)(F)F)c1)Nc1cc(F)c(OC(F)F)cc1F 490289335 WHFDHCCIKJRRNC-UHFFFAOYSA-N 395.274 5.156 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)Cc1cc(C#N)ccc1Br 492484905 NEJVOIAGBSIHJM-GFCCVEGCSA-N 386.318 5.123 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@@H](C)c1ccc(C#N)cc1 495168045 POIZGYRZBISHJP-KBPBESRZSA-N 395.915 5.118 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)o2)n1 495206712 PTRQOUJLFOBPID-CYBMUJFWSA-N 376.359 5.220 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3coc4ccccc34)c2)cc1 499412552 PYDDOGZRLWAEAC-UHFFFAOYSA-N 382.419 5.330 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1F 499734878 VMIHDZBDLDVGHN-UHFFFAOYSA-N 396.368 5.115 30 20 GKED Cc1cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc2n[nH]cc12 501720555 JUGMZPYIUIXXJI-UHFFFAOYSA-N 398.491 5.288 30 20 GKED Cc1ccccc1[C@]1(F)CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 505311755 SRGMXTCPDDYMQK-ZHRRBRCNSA-N 397.519 5.349 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccccc1OCc1ccc(Cl)cc1Cl 509725078 RKFLPTTZWPGFFE-CQSZACIVSA-N 391.298 5.194 30 20 GKED C[C@H](N[C@H](C)c1ccncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 510971581 YLJQNHYSTLGLMV-VHSXEESVSA-N 380.307 5.670 30 20 GKED CC[C@H](C)[C@H](C)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CC1 513278784 HYIIQTRQFZSIMU-ROUUACIJSA-N 376.500 5.176 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)n1 513681895 LJSVBEAHRYMQLQ-CYBMUJFWSA-N 393.320 5.977 30 20 GKED CC[C@H](C)[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 515195492 YOEHKHXQGSUIGR-GAJHUEQPSA-N 399.494 5.822 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2c(ccc3ccccc32)[nH]1 518743127 NMVFYNRUOVNVMM-HNNXBMFYSA-N 385.492 5.968 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)Nc1ccccc1S[C@@H](C)CC#N 519515804 XISLNRQVVDEKRS-KRWDZBQOSA-N 382.529 5.530 30 20 GKED C=CCCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 523227013 RAZJGFMWLFMQID-YJBOKZPZSA-N 378.903 5.823 30 20 GKED CCOc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 524388738 WCQADAYOCRDKTQ-UHFFFAOYSA-N 386.451 5.097 30 20 GKED N#CC1CCN(C(=O)Nc2ccc(C34CC5CC(CC(C5)C3)C4)cc2Cl)CC1 524661322 WSXDQOKZBRFARJ-UHFFFAOYSA-N 397.950 5.575 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 531145816 LDAZHCVFHZMZOI-OAQYLSRUSA-N 385.854 5.048 30 20 GKED C=CCC[C@@H](NCc1cc(-c2cccnc2)n[nH]1)c1ccc(C(F)(F)F)cc1 533069613 MHLBZLZWPKUQIO-LJQANCHMSA-N 386.421 5.288 30 20 GKED C=C(C)[C@H](CC(=O)N(CC)[C@@H](c1ccc(Cl)cc1)c1ccccn1)OCC 533712159 FVUQNXKYCIQMNX-UNMCSNQZSA-N 386.923 5.044 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NC2CCC(F)(F)CC2)c1 534919225 WGKFSEGYRIPCAD-UHFFFAOYSA-N 390.817 5.312 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1 537853593 QVDQXDYQUALTHX-UHFFFAOYSA-N 382.407 5.078 30 20 GKED Cn1c(CNCc2ccc(-c3ccccc3C#N)cc2)nc2ccc(Cl)cc21 538609911 GSFPQSHXEIEPNF-UHFFFAOYSA-N 386.886 5.055 30 20 GKED N#CC1(CCCNc2cc(C(=O)Nc3ccccc3)ccc2Cl)CCOCC1 538610770 VKUWRZAFCJYIOU-UHFFFAOYSA-N 397.906 5.105 30 20 GKED C[C@@H](NCc1ccc(Oc2ccccc2C(F)(F)F)nc1)c1cccc(C#N)c1 539496345 LLJHPDNJNVDUDZ-OAHLLOKOSA-N 397.400 5.615 30 20 GKED C[C@@H]1C[C@@H](c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCO1 547218445 MXJNXYSIOMNDMF-KGLIPLIRSA-N 395.846 5.336 30 20 GKED CC(C)(C)c1n[nH]cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 549376441 LTRSYXLMOXYYEE-KRWDZBQOSA-N 392.890 5.268 30 20 GKED C=C(C)[C@@H](CC(=O)N(c1nc2ccccc2s1)c1ccccc1C)OCC 549930293 GGKSFDSJAWSYQB-LJQANCHMSA-N 380.513 5.641 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C(c1ccccc1)c1ccccc1 557606076 CVMXDLSMAHRWDS-UHFFFAOYSA-N 387.527 5.201 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2-c2nc(C3CC3)no2)c1 576427301 QLRIGIUTNSCJRX-UHFFFAOYSA-N 399.237 5.045 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 588349039 QBZJEOQGZKOVRK-OAHLLOKOSA-N 388.826 5.891 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccccc2[C@H](C)C1 593157970 PWBLBJIBFUYYJI-SJORKVTESA-N 379.529 5.275 30 20 GKED CCO[C@H](C)c1nc(CSCc2ccc(C#N)cc2C(F)(F)F)cs1 596342125 IJWSSZZRALWXME-LLVKDONJSA-N 386.464 5.564 30 20 GKED CC(C)(NC(=O)Nc1cccc(CCC(F)(F)F)c1)c1cccc(C#N)c1 596788181 KKOCLAYHBIZNTH-UHFFFAOYSA-N 375.394 5.110 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCCC(F)(F)CC2)c1 600255427 XHVKBHBATRSOTP-UHFFFAOYSA-N 390.817 5.265 30 20 GKED N#CCCCCCC(=O)N1CCC[C@H]1c1ccc(Br)cc1Cl 600510899 XMGLNAUCVDOKHL-INIZCTEOSA-N 383.717 5.240 30 20 GKED COc1ccc(CNc2ccc(Cl)cc2SC)cc1OCCCC#N 600860582 IYXQTSIYABRBSJ-UHFFFAOYSA-N 376.909 5.365 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(Cl)cc1Cl 603527256 GRDCJTSFNPXQQV-UHFFFAOYSA-N 375.299 5.235 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H](C)Oc1ccccc1 603532276 ADXBXDBYSFUTOI-SFHVURJKSA-N 388.442 5.007 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc2ccccc2c1 603601395 YIXHOGNFZJEJKQ-UHFFFAOYSA-N 379.419 5.460 30 20 GKED Cc1cc([C@@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)c(C)s1 603682131 VSBDFYTYPBHPFV-QGZVFWFLSA-N 376.525 5.666 30 20 GKED N#C[C@@H](C(=O)c1cccc(COc2cccc(F)c2)c1)c1ccc2ccccc2n1 604005437 LWOFYSZWBZUWJF-JOCHJYFZSA-N 396.421 5.443 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1oc2ccccc2c1CSC 604010954 NHPVTWJBYKFRBF-UHFFFAOYSA-N 381.497 5.133 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2ccc(NC[C@@H]3CCCO3)c(F)c2)c1 606943748 JSKWIUFIBGPZEG-IBGZPJMESA-N 399.466 5.016 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 609206864 JGXQUOGTPHVHOU-UHFFFAOYSA-N 377.366 5.157 30 20 GKED Cc1cc(C(=O)N(C)c2ccc(C#N)cc2F)sc1-c1cccc(Cl)c1 609216358 IENUBBUBCWKHPB-UHFFFAOYSA-N 384.863 5.664 30 20 GKED Cc1cc(Br)ccc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 609287051 BPUKVXXYWKLRGX-AWEZNQCLSA-N 398.087 5.059 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccc(F)cc1F 609387074 JNYRHNPCHRVELM-LLVKDONJSA-N 386.389 6.162 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)N[C@@H](C#N)c3cccc(C(F)(F)F)c3)oc12 609460631 HDXIZRSDNQHDOV-INIZCTEOSA-N 386.373 5.372 30 20 GKED CC(C)c1ccc(-c2csc(NC(=O)c3ccc(C#N)nc3)n2)c(C(C)C)c1 609640494 VMXRNTQDOGSHPX-UHFFFAOYSA-N 390.512 5.576 30 20 GKED CCN(CC[S@](=O)c1cc(Cl)ccc1Cl)[C@@H](C)c1ccc(C#N)cc1 609798396 ZNOPBUSZSUKIPN-SXBQZSJRSA-N 395.355 5.056 30 20 GKED CCCn1c(S[C@@H](C)c2ccc(C#N)cc2)nc2sc3c(c2c1=O)CCC3 609813663 YJECDTXLDGMNKJ-ZDUSSCGKSA-N 395.553 5.082 30 20 GKED C[C@H](Sc1ccccc1C#N)c1nc(-c2cccc(C(F)(F)F)c2)no1 610206581 LWGOGQGDJSIAOZ-NSHDSACASA-N 375.375 5.480 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(C4CCCC4)CC3)cn2)cc1 610320255 UKSBXPXCRHRBQF-UHFFFAOYSA-N 390.487 5.180 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)c(F)c1 612409657 MCAFCAIBNKWSTL-DEOSSOPVSA-N 385.417 5.264 30 20 GKED Fc1cccc2c(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)ncnc12 683382822 BSMZBGJBSIMACH-RKDXNWHRSA-N 381.295 5.090 30 20 GKED COc1cc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)cc(OC)c1OC 727780321 LBYQXORIPKEJMJ-KHPPLWFESA-N 395.480 5.040 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccccc2CSc2nc(C)cs2)c1 728482771 FMMTVRMZHDDVAQ-UHFFFAOYSA-N 378.522 5.002 30 20 GKED O=C(/C=C/c1c(Cl)ccc(Cl)c1Cl)c1cccc(N2CCOC2=O)c1 745626918 VNWWRADBOVXFFD-QPJJXVBHSA-N 396.657 5.500 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccc(OC)cc2)cc1 750688493 UQXRIFMVGKHQGY-JKSBSHDWSA-N 392.499 5.050 30 20 GKED C[C@H](Cc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 756515793 FPUYYMDCVOUXGN-IUODEOHRSA-N 387.817 5.140 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@H]4CCCC[C@H]4C3)n2)cc1 756530154 SSUAWSPVNBDBMZ-GSEOLPGOSA-N 389.524 5.465 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c(Cl)c1 757623090 WLAROVZKDCJZIH-LRDDRELGSA-N 386.282 5.106 30 20 GKED N#C[C@H](COC(=O)c1sc(-c2ccccc2)nc1C(F)F)Cc1ccccc1 762071718 ZUTFWRJPZZCGOV-OAHLLOKOSA-N 398.434 5.287 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCCSC(C)(C)C 783553683 YFVDBOUPSNNEIC-CQSZACIVSA-N 382.620 5.284 30 20 GKED CC(C)(C)OCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 796798827 RFVOMJIGNNMSBO-HNNXBMFYSA-N 376.909 5.235 30 20 GKED Cc1ccc(COc2cccc(NC(=O)NCC3CCC(C#N)CC3)c2)cc1 799401095 MHMUUBVOMTWODX-UHFFFAOYSA-N 377.488 5.026 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 800154809 YLTSLYUOELYOFZ-UHFFFAOYSA-N 380.488 5.713 30 20 GKED N#Cc1ccc(C(=O)O[C@@H](c2ccc(C(F)(F)F)cc2)C(F)(F)F)s1 809126355 LTBIEGBMQYYYRF-LBPRGKRZSA-N 379.281 5.099 30 20 GKED CC(=NOCc1coc(-c2ccccc2)n1)c1nc2ccccc2n1C(F)F 836976250 ASWLAIMZGYLVMQ-UHFFFAOYSA-N 382.370 5.027 30 20 GKED C=CCOc1c(Cl)cc(CN[C@@H](C)c2nc3ccccc3s2)cc1OC 858137842 HLIXUAUEKXBJAV-ZDUSSCGKSA-N 388.920 5.374 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)c1C 858764033 ZGYMZOYOTNEDFV-UHFFFAOYSA-N 389.499 5.056 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NCc2nccn2C)cc1 907676579 KSERFCUYXWDNDS-UHFFFAOYSA-N 388.515 5.136 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1ccncc1 916136086 HDDITIIXWPZRFD-DAXSKMNVSA-N 397.261 5.537 30 20 GKED Cc1ccc(/C=C/C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(Br)c1 916849136 POSFGAHEUJEBQG-QXLXQBSBSA-N 391.268 5.195 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1ccc2c(c1)Nc1ccccc1S2 1776029995 ZTPHPQXPBXQQBE-UHFFFAOYSA-N 375.453 5.429 30 20 GKED O=C(O)c1cccc(NN=C(CCCc2ccccc2)c2ccc(F)cc2)c1 1776037646 SNUGNXHFPOWJJD-UHFFFAOYSA-N 376.431 5.363 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)cc1 1776339945 SDIRNKMJQSEFKE-NTMALXAHSA-N 387.273 5.242 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H]3CC=C(C)CC3)cc2)CCC1 1789115123 UDVYKQVYDQRWRY-OALUTQOASA-N 380.532 5.079 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)Cc3ccc4ccccc4c3)CCC2)cc1 1791587350 BUHJKYAWJZSARA-UHFFFAOYSA-N 398.506 5.093 30 20 GKED Cc1csc([C@H](C#N)C(=O)COc2ccc(-c3ccccc3)cc2Cl)n1 23104891 BPPVHLJCIYTHGR-MRXNPFEDSA-N 382.872 5.027 30 20 GKED N#C[C@H](C(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1)c1nc2ccccc2o1 54734090 MNIDWFCQCZBPOV-HRCADAONSA-N 399.475 5.364 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/CCc3ccccc3C2=O)cs1 54895512 BEXWTOUANUHWMT-VBKFSLOCSA-N 392.455 5.179 30 20 GKED CCOc1ccc([C@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)cc1 60972674 YTKVYHMNTSJPMC-IBGZPJMESA-N 386.495 5.387 30 20 GKED C[C@H](NC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1ccc(C#N)cc1 63789469 IWVBOMIILPEAID-SFHVURJKSA-N 381.479 5.271 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 112738249 NKYJBBZMYMBTRQ-UWJYYQICSA-N 381.545 5.942 30 20 GKED N#CCCCOc1cccc(CN[C@H](Cc2ccccc2)c2cccs2)c1 116923065 WVFLQGBPWFYMEU-JOCHJYFZSA-N 376.525 5.504 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(OC(F)(F)F)c1 121937109 JPHUIIBZGXVOEL-CYBMUJFWSA-N 394.418 5.161 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)N(CCC#N)Cc1ccco1 124476528 DLQUWFZDNPMSLL-UHFFFAOYSA-N 377.897 5.381 30 20 GKED CC(C)CNC(=O)c1ccc(NCc2ccccc2C(C)(C)C#N)cc1Cl 131585046 QZEIWNURRCSFOM-UHFFFAOYSA-N 383.923 5.139 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC[C@@H]2c2ccncc2)cc1 175190222 ZYSWWLRZRBVECZ-OAQYLSRUSA-N 385.492 5.082 30 20 GKED CCOc1ccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2ccccc2)cc1 236852103 TXOQUXNJXHOJNP-UQBPGWFLSA-N 386.495 5.255 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CSc2ccccc21 303741003 ZDJXJPFUPITQAF-HXUWFJFHSA-N 386.476 5.487 30 20 GKED CC1(C)CCc2ccccc2[C@@H](/N=C(/O)c2ccc3c(c2)N=C(O)CN=C3O)C1 329172827 LCZJPJYUANRILO-IBGZPJMESA-N 391.471 5.001 30 20 GKED Cc1cc2c(cc1C)[C@H](/C(O)=N/[C@H]1CCCc3cn(C4CCCC4)nc31)CO2 330000516 WNZDFZVAQUOJPL-UXHICEINSA-N 379.504 5.125 30 20 GKED Cc1nc2c(s1)[C@H](N(C)C(O)=Nc1cc(-c3cccnc3)ccc1C)CCC2 330338466 VKYUCLOCGQVSSC-HXUWFJFHSA-N 392.528 5.377 30 20 GKED N#CCSc1cccc(C(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 431168677 ITZSFUZYIZGSEY-SFHVURJKSA-N 391.323 5.586 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 431806535 BRYKIVGMOVMMEI-HNAYVOBHSA-N 387.430 5.083 30 20 GKED CC(C)(C)OC1CC(CCNCc2cccc(OCc3cccc(C#N)c3)c2)C1 432252547 ZDTSZARYUGJPHI-UHFFFAOYSA-N 392.543 5.211 30 20 GKED COc1cc2nc(C)sc2cc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432837104 QOTCKWYZHCPCEW-INIZCTEOSA-N 394.500 5.170 30 20 GKED CSC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 432996069 SFKNHLUGBVORBH-HNNXBMFYSA-N 399.491 5.097 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccccc1 435670174 ROIUHPSVSAXBQV-QFIPXVFZSA-N 391.515 5.142 30 20 GKED C=CCN(C(=O)c1ccc2ccc(Cl)cc2n1)c1nc2c(s1)CCCC2 437318773 AVCZHABFJKJMTG-UHFFFAOYSA-N 383.904 5.056 30 20 GKED Cc1cc(C#N)ccc1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 438835523 LADHZTOXZPGJOO-OAQYLSRUSA-N 399.494 5.622 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1C 439491309 CNWGVKMQRSILCQ-QFIPXVFZSA-N 393.531 5.867 30 20 GKED N#CCC[C@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1 440081402 SQFWMBCDEHCRPI-SFHVURJKSA-N 387.405 5.039 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)CC1 441308329 GRLVTKPDAQQFBQ-UHFFFAOYSA-N 390.512 5.415 30 20 GKED CCC[C@@H](Cc1ccccc1)N(CCC)Cc1nnc(-c2cccc(C#N)c2)o1 441502681 QVCSNQSUNMUSGE-QFIPXVFZSA-N 388.515 5.232 30 20 GKED Cc1cc(Br)ccc1NC(=O)CS[C@H](C)c1cccc(C#N)c1 443152622 BSDOYMOPAAISIF-CYBMUJFWSA-N 389.318 5.062 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1Oc1ccncc1 443891432 GSDIOQAHLBTWOZ-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC4(CCC4)[C@H]3c3ccco3)cc2)cc1 454598197 FVGDSLYDYUNVGW-JOCHJYFZSA-N 399.450 5.703 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc([C@@H]2CCOC2)cc1 455669884 VURBLLLVRCUZFZ-OAHLLOKOSA-N 376.909 5.126 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469329228 PECIZBIWGOWBPU-ZDUSSCGKSA-N 399.372 5.065 30 20 GKED COc1ccccc1[C@H](CNC1CCC(C#N)(c2ccccc2)CC1)OC(C)C 471597376 DTTKMZQCYIVGBH-QNVARPAVSA-N 392.543 5.155 30 20 GKED CCCOc1ccc(C(C)(C)NC(=O)N[C@H](CCC#N)c2ccccc2)cc1 474534083 LERRJZCLZHYQCB-OAQYLSRUSA-N 379.504 5.055 30 20 GKED N#CC[C@@H](CC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1ccccc1 474584188 JAKNVPUWAOKEOD-DHLKQENFSA-N 380.491 5.248 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCCc2c(O)cccc21 476069932 DCNNLUGPJMQTRZ-QFIPXVFZSA-N 398.462 5.423 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)c1 477661994 KEGNZDASWNQREM-UHFFFAOYSA-N 387.386 5.147 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2nc(C(F)F)[nH]c2c1 480898590 NBYXCFBECWKQKL-UHFFFAOYSA-N 396.850 5.436 30 20 GKED CCOc1nc(C)ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 482562821 VBICKXHRGUSNKA-INIZCTEOSA-N 397.887 5.056 30 20 GKED N#C[C@H](C(=O)c1cc2[nH]ccc2s1)c1nc(-c2c(F)cccc2F)cs1 483527358 UDVUIMLYRWJONV-SECBINFHSA-N 385.420 5.121 30 20 GKED CCN(CCCC(=O)Nc1c(C)cc(C)cc1C)[C@H](C)c1ccc(C#N)cc1 485075076 RUXFZMHNPSPUEH-HXUWFJFHSA-N 377.532 5.285 30 20 GKED N#CCCC[C@@H](NC(=O)c1c[nH]c2cccc(Br)c12)c1ccccc1 487390223 PHBNDSXGCKQJHC-QGZVFWFLSA-N 396.288 5.095 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1coc(-c2c(F)cccc2F)n1 488732676 KVBLZYNTSDNGBC-UHFFFAOYSA-N 397.328 5.198 30 20 GKED COc1ccc2c(c1)c(C(=O)N(C)CC(C)(C)C#N)c(C)n2C1CCCCC1 497377070 RFOVSBZVDFRBQO-UHFFFAOYSA-N 381.520 5.085 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)cc1 503956665 VKLXUDLZQBHJGU-UHFFFAOYSA-N 389.458 5.026 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)cc1Br 509852733 RHXQDTGWAOIFPX-CYBMUJFWSA-N 377.307 5.136 30 20 GKED CCC(CC)N(C(=O)c1cccc(SCC#N)c1)[C@@H]1CCCc2cccnc21 511303370 GUQMOVRIXYTNSK-OAQYLSRUSA-N 393.556 5.406 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 513652604 AZVZDROZPWUSHK-SFHVURJKSA-N 383.476 5.554 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1F 513960452 IJHOIMHUMMUYFV-UHFFFAOYSA-N 391.421 5.379 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(CCC#N)CC(C)(C)C 514217815 HXYWIELRNBDTKT-UHFFFAOYSA-N 394.302 5.359 30 20 GKED Cc1ccccc1C1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 517533647 YJPROODEVRBBMW-KRWDZBQOSA-N 379.529 5.243 30 20 GKED C=C(C)COc1cccc(NC(=O)CCc2nc(C)c(-c3ccccc3)o2)c1 518037197 XQWQQOVOIVPZDH-UHFFFAOYSA-N 376.456 5.176 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 522066796 AGYINYAQHATQCZ-CQSZACIVSA-N 393.314 5.461 30 20 GKED C[C@@H](C[C@H]1CCCO1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 524200520 RNEWUKXNIJPEMP-KBXCAEBGSA-N 399.878 5.083 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H]1CCCC[C@@H]1C(C)(C)C 533512423 LDVYQGADUVWWDN-FGTMMUONSA-N 387.593 5.214 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H](c3cccnc3)C3CC3)c2)cc1 535487026 XHLDXYBOYZRQBH-JOCHJYFZSA-N 384.439 5.018 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 536841750 YXLPGDBOYBQPJF-YCRPNKLZSA-N 390.449 6.022 30 20 GKED CC(=O)N(Cc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1)C1CC1 537729598 BBHGZBLVIRSCOK-UHFFFAOYSA-N 387.527 5.014 30 20 GKED CSc1cccc(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c1C 540411804 PGLGRGOSLBSXEX-UHFFFAOYSA-N 395.528 5.100 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1cccc(Cl)c1 540856266 URZLTKCTPZGPGM-CYBMUJFWSA-N 396.903 5.779 30 20 GKED C[C@H](NCc1csc(N(C)C2CC2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541086062 XQSKMPOIPSDPCE-INIZCTEOSA-N 388.540 5.131 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CC1CCC(C(F)(F)F)CC1 549197097 NMJCWDAKTBBZDN-UHFFFAOYSA-N 382.813 5.204 30 20 GKED Cc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1NC(=O)C(C)(C)C 579650861 SLIWIKXVPAJZCX-UHFFFAOYSA-N 389.421 5.482 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Nc3nc(C)cs3)cc2)cc1OC 599246728 GZGWBBAZGBMTEG-UHFFFAOYSA-N 395.484 5.021 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)oc12 604358645 UPXPEFLICYTDAC-UHFFFAOYSA-N 398.418 5.666 30 20 GKED C=CCCCCCN(C)C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 606924767 PUTIHFJRKZSLRG-INIZCTEOSA-N 389.540 5.706 30 20 GKED Cc1ccccc1-c1cc(NC(=O)c2sccc2C#N)n(Cc2ccccc2)n1 608943980 YIEQFQZGRGDQDY-UHFFFAOYSA-N 398.491 5.092 30 20 GKED CCOc1ccc(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609208908 PLLFCMGCIKVUCG-UHFFFAOYSA-N 387.439 5.071 30 20 GKED Cc1ccc(-c2ccsc2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609377637 IYBAGNKHZFANRD-MRXNPFEDSA-N 392.549 6.228 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H](C)c1ccsc1 609967900 OOYAFWYLQMJFOR-MRXNPFEDSA-N 378.472 5.404 30 20 GKED CS[C@@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1 610041302 CKOOYASKNUJYCS-HXUWFJFHSA-N 390.533 5.428 30 20 GKED N#Cc1ccc(CC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccccc2Cl)cc1 610117565 IQNQMSVIBBJKJN-QFIPXVFZSA-N 395.289 5.313 30 20 GKED C[C@@H](NC(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1)c1cccc(C#N)c1 610324179 GFKUZTGXLKJNAU-CQSZACIVSA-N 376.460 5.171 30 20 GKED CC(C)c1c(C(=O)N[C@@H](C)c2cccc(C#N)c2)cnn1-c1cccc(Cl)c1 610360208 TUWLPYCLJDWOOX-HNNXBMFYSA-N 392.890 5.012 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)c1 610793159 COXVRHPBJYDGRS-QGZVFWFLSA-N 387.487 5.105 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1ccc(C(F)(F)F)cn1 613289642 XHPMMVUSAFZBGJ-QGZVFWFLSA-N 397.400 5.341 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-n4cc(C)cn4)cc3)n2)cc1 613319158 SDCNFEUEACQHHP-HXUWFJFHSA-N 398.491 5.103 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc2cc(Cl)ccc2s1 613407451 TWSMWOBUPGBHPU-LBPRGKRZSA-N 387.247 5.839 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)NCc1ccc(C#N)c(Cl)c1 619770685 PPNPFCFRNKDWPB-INIZCTEOSA-N 381.907 5.285 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ncsc1C(F)(F)F 669968353 YGARBZFKBXEKCS-UHFFFAOYSA-N 390.255 5.068 30 20 GKED FC(F)(F)c1cccc(CON=Cc2cccc(OCc3ccncc3)c2)c1 727433792 CHNRREQBMOPZGG-UHFFFAOYSA-N 386.373 5.230 30 20 GKED C=CCN(Cc1nnc(-c2ccc(Br)s2)o1)CC1CCCCC1 732696125 YEORZIMMMCUNCI-UHFFFAOYSA-N 396.354 5.129 30 20 GKED CC(C)n1cc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 732878987 VNYGMSJTMFMIAJ-JTSKRJEESA-N 387.487 5.002 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1ccncc1 734455232 CCABHVGRWOIQGG-OAQYLSRUSA-N 380.394 5.199 30 20 GKED C=CC[C@@H](NC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1)c1ccncc1 735386753 QACKBSCOJLDCAP-RTWAWAEBSA-N 383.923 5.679 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)/C=C\c2ccccc2C#N)cc1 741645893 MLQYQFJCQMJUCD-JJCXBQPYSA-N 396.490 5.467 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)cc1C#N 742370463 VTIPHYAIBHQHLV-IBGZPJMESA-N 386.495 5.305 30 20 GKED Cc1ccc(-c2ccc(/C=C\C(=O)c3cccc(N4CCOC4=O)c3)s2)cc1 745625426 AHASPHSXCUHLBK-LUAWRHEFSA-N 389.476 5.576 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cc(Cl)ccc3Cl)cn2)cc1 748176239 SRKPNWKZTBAGMV-UHFFFAOYSA-N 398.249 5.234 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)c2sc3ccc(F)cc3c2C)cc1C#N 752195323 FTPGLGXMWYKIMB-UHFFFAOYSA-N 397.431 5.041 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 754690371 SOUINRCRXXLYHL-OXFRDRNISA-N 379.765 5.546 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(C3SCCS3)cc2)cc1C#N 772148380 RCFHTXPQNGMRHN-UHFFFAOYSA-N 384.526 5.076 30 20 GKED N#Cc1cc(NC(=S)Nc2ccc(F)cc2F)ccc1Oc1ccccc1 777476934 PXGBTPNZDDLDOL-UHFFFAOYSA-N 381.407 5.438 30 20 GKED COc1cccc2[nH]cc(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c12 778597118 NFBFPDOKHFOVIA-NRFANRHFSA-N 395.462 5.013 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C 780678043 KFLWKDJTGKTTIQ-DJJJIMSYSA-N 387.430 5.165 30 20 GKED Cc1nc(Cl)ccc1CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782484151 DDGQRKKQIMLQCE-HNNXBMFYSA-N 389.886 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2 789887885 GJXTYHMTBJNLKX-YADARESESA-N 398.547 5.124 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F 796650562 MPXBKVGUNSPJTR-SECBINFHSA-N 394.340 5.470 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1ccc(CNC(=O)OC(C)C)cc1 800576137 BJZDDXGONAUJCZ-UHFFFAOYSA-N 381.476 5.084 30 20 GKED C=CCOc1ccc(CNc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)cc1Cl 815166151 ZJFQGOJKFQIAMQ-VFNWGFHPSA-N 384.907 5.278 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](OC2CCC2)CC1 878675244 DTJUXIYDYDFMTC-FUHWJXTLSA-N 387.549 5.036 30 20 GKED C[C@@H](N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cc(C#N)ccn1 902965481 SZALSGKWEJOSSU-FOIQADDNSA-N 392.503 5.028 30 20 GKED Cc1ncsc1C(=O)/C=C/c1csc(-c2cccc(Br)c2)n1 915987479 FFHUXVOUGXQYPH-AATRIKPKSA-N 391.315 5.234 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2c(s1)CCCCC2 916900698 RKJYYKHQFGSMKH-GOSISDBHSA-N 394.540 5.103 30 20 GKED CC(C)=C[C@@H]1[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1(C)C 920140356 BYTQZVRCRJFPSX-ZHALLVOQSA-N 375.497 5.096 30 20 GKED CC(=NNc1ccc(Br)c(C)c1)c1[nH]c(-c2ccccc2)nc1C 920479468 OGONBAYIKZVZKK-UHFFFAOYSA-N 383.293 5.292 30 20 GKED O=C(O)C1(c2ccccc2)CC(=NNc2c(Cl)cc(Cl)cc2Cl)C1 1776014712 SKZQMLRUTINDDL-UHFFFAOYSA-N 383.662 5.231 30 20 GKED Cc1c(NN=Cc2ccc(Oc3cc(F)cc(F)c3)cc2)cccc1C(=O)O 1776086902 VLOARGFTAYGAHB-UHFFFAOYSA-N 382.366 5.210 30 20 GKED Cc1c(NN=Cc2cc(C)n(-c3ccc(C(C)C)cc3)c2C)cccc1C(=O)O 1776087150 LBSOBWAASFKQTA-UHFFFAOYSA-N 389.499 5.670 30 20 GKED O=C(O)c1ccc(Br)c(/C=C\C(=O)c2cccc3ccccc23)c1 1776114077 FHDFTHRFZICSBC-LUAWRHEFSA-N 381.225 5.197 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1F 1777353299 UPFVJEDHBDFWNE-WQLSENKSSA-N 376.383 5.096 30 20 GKED COc1ccc(OC)c(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1777368082 HCSRNGWHAHQBEB-VQHVLOKHSA-N 394.448 5.027 30 20 GKED CCCn1c(SCc2cc(C#N)ccc2F)nnc1-c1ccc(Cl)cc1 11421911 CLOGROLHLDSUJK-UHFFFAOYSA-N 386.883 5.312 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2ccc(C)cc2)[n+]2cccc(C)c2)c1 52537245 ZFWMXYBYGUGTOI-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(C)c1[N+](=O)[O-] 57375763 SJIQSJPMKRYBHU-UHFFFAOYSA-N 387.395 5.128 30 20 GKED C=CCC(CC=C)C(=O)N(Cc1ccccc1)[C@H](C)c1cccc(NC(C)=O)c1 122117328 RDQKINBCURUHJX-LJQANCHMSA-N 390.527 5.503 30 20 GKED COc1ccc(CNc2cc(-c3nc(C)co3)ccc2C)cc1OCCCC#N 152563376 JNVOQEOWAAAZPT-UHFFFAOYSA-N 391.471 5.262 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(F)c(SC)c3)n2)cc1 155681380 XXEITDXMWKLHRS-HNNXBMFYSA-N 398.484 5.170 30 20 GKED CN(C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1cc(Cl)ccc1C#N 156816891 QYOPQUMRPIITRG-UHFFFAOYSA-N 379.822 5.053 30 20 GKED N#Cc1ccccc1CSc1nnc(-c2ccncc2)n1C1CCCCC1 159367106 BIRPDHXLWRTLIX-UHFFFAOYSA-N 375.501 5.009 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 160112111 YNQMLDVIXGBHOH-SFHVURJKSA-N 386.480 5.051 30 20 GKED CC(C)(C)OCc1cccc(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 171150143 QWTWOFMWJSSOKY-UHFFFAOYSA-N 379.504 5.125 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(Cl)cn1 183035073 PCROPVZBSKXJQK-UHFFFAOYSA-N 392.846 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CN2CCCCCC2)C1 191418989 CJGYFPVWBRTRGD-OAQYLSRUSA-N 397.607 5.658 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3o2)oc2ccc(Br)cc12 193282148 OYDGAYNIJTWTEU-CYBMUJFWSA-N 395.212 5.135 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC(c4ccccc4)CC3)c2)cc1 303583099 FIXRKCGIWCZVES-UHFFFAOYSA-N 396.490 5.157 30 20 GKED Cc1nc([C@H]2CCCN2C(O)=Nc2cnn(CCC(C)C)c2C(C)C)cs1 330189216 VBPGINQJJHSOFB-GOSISDBHSA-N 389.569 5.200 30 20 GKED C=CCOc1c(Br)cc(CN[C@@H](C)c2ccccc2)cc1OCC 409612767 NKUGUBLLOUSTNJ-HNNXBMFYSA-N 390.321 5.263 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 409643970 FZSKITOKYLMIQM-UHFFFAOYSA-N 392.455 5.251 30 20 GKED CC(C)(C)c1ccc(-c2ccc(NC(=O)[C@@H](N)CCCC#N)c(Cl)c2)cc1 424090232 BKQNXZSKOOVLEV-IBGZPJMESA-N 383.923 5.264 30 20 GKED CCC(CC)n1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 431171861 HDYZGLNYWQYZNA-MRXNPFEDSA-N 398.919 5.511 30 20 GKED N#CCCC[C@@H](NC(=O)NCCc1cccc(Cl)c1Cl)c1ccccc1 431862062 XAIWIZDNMDQALS-GOSISDBHSA-N 390.314 5.270 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2)n1 433255830 JAQQNWPICJUDHT-FQEVSTJZSA-N 388.471 5.515 30 20 GKED C=CCC[C@@H](NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 435280512 NUSGOMIZGQNTMT-LJQANCHMSA-N 395.890 5.146 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C1CCN(CCCCC(C)(C)C#N)CC1 444665936 QIRBOFUMQRGPQG-UHFFFAOYSA-N 395.513 5.322 30 20 GKED C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1C(=O)Nc1ccc(F)cc1C(F)(F)F 454700189 NORYUGOCWKZXOK-IVZWLZJFSA-N 386.311 5.428 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1C 458793865 ABUGJRGWCFVPSB-XZOQPEGZSA-N 375.516 5.585 30 20 GKED N#CCCN(C(=O)c1ccc(F)c(C(F)(F)F)c1)C12CC3CC(CC(C3)C1)C2 460460788 OFSMSDOZWMBNAO-UHFFFAOYSA-N 394.412 5.169 30 20 GKED Cc1ccc(C(=O)C2CCN(c3c(C#N)cnc4ccc(Cl)cc34)CC2)cc1 462373783 RGZOCUARVXYBOK-UHFFFAOYSA-N 389.886 5.168 30 20 GKED N#C[C@H]1CCC[C@H](NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 463296720 FYZGZMNYNDFWCG-HOCLYGCPSA-N 375.394 5.065 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 463740390 CPGSTWBHDYUFJJ-UHFFFAOYSA-N 376.387 5.141 30 20 GKED C[C@@H](C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1cccc(C#N)c1 463943773 IDUGRLPKADJRRO-CQSZACIVSA-N 378.834 5.760 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N[C@@](C)(C#N)C(C)(C)C 464158314 NAKSGKPGURZJES-VWLOTQADSA-N 385.511 5.197 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CCCc2cccc(C(F)(F)F)c2)c1 471815158 HLEPJTULUAOTMT-UHFFFAOYSA-N 398.331 5.140 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2cccnc2)c(C)c1 490589417 MBDPINOBCSMYOS-UHFFFAOYSA-N 377.444 5.038 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 501154312 NNSVVVZREKLHFO-UHFFFAOYSA-N 398.285 5.005 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cncc3ccccc23)cc1 505673696 OIEDIYWXMXNCQD-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccccc1Nc1cccc(C(F)(F)F)c1 509722163 PLUFZEQGZADFTE-AWEZNQCLSA-N 375.394 5.071 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccccc1OCc1ccc(Cl)cc1Cl 509725077 RKFLPTTZWPGFFE-AWEZNQCLSA-N 391.298 5.194 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1ccc(Br)cn1 510962547 PJUGMGMNWMGZMA-UHFFFAOYSA-N 382.286 5.070 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1ccccc1C(F)(F)F 514474409 DRZDJQLSYLAHNH-UHFFFAOYSA-N 384.810 5.102 30 20 GKED COc1nc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc2ccccc12 520099676 IONVLXVWIWJKKB-UHFFFAOYSA-N 385.448 5.096 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3sc4c(c3C#N)CCC4)cc2)cc1 520326853 PUULSUVZGKLVSP-UHFFFAOYSA-N 399.475 5.219 30 20 GKED CC(C)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CCCCC1 522311215 XIARADGRRQNDEQ-UHFFFAOYSA-N 376.500 5.321 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(OC2CCCCC2)cc1 522929594 HZNOSZIBQVDZNG-UHFFFAOYSA-N 384.545 5.357 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 522999917 YVRFGOKJZYCNTM-VWLOTQADSA-N 391.474 5.300 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)CC/C=C\c3ccccc3)c2)c1 523102160 UTXAFVNUAHVQSE-WMZJFQQLSA-N 395.462 5.243 30 20 GKED N#C[C@@H](C(=O)c1ccnn1C1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 532243944 YMFBFABHBOAITR-INIZCTEOSA-N 396.903 5.265 30 20 GKED C=CCC[C@H](NC(=O)c1sc(COC)nc1C)c1ccc(C(F)(F)F)cc1 535435874 MEAOHJIVVYFWPZ-HNNXBMFYSA-N 398.450 5.054 30 20 GKED C[C@H](NCc1cc(F)cc2c1OCOC2)c1ccc(-c2cccc(C#N)c2)cc1 541085496 FWANZIMEZVXMOH-INIZCTEOSA-N 388.442 5.082 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 544266617 DUFATHVYPZUBNS-UHFFFAOYSA-N 382.464 5.178 30 20 GKED C[C@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1F 552318133 QZFYTDGDDMIIQR-BUXKBTBVSA-N 378.369 5.398 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(-c2ccc(Br)s2)s1 554098325 XRTLZLATYNPGSV-UHFFFAOYSA-N 397.363 5.299 30 20 GKED N#Cc1ccc(C[C@@H](C#N)c2nc(-c3ccccc3OCC3CCCC3)no2)cc1 554816807 VFRXTTNSNAJUGM-FQEVSTJZSA-N 398.466 5.027 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2c3ccccc3CC23CCOCC3)CC1 558508109 AVNBQMSTCCWPPT-UMGQLZEVSA-N 386.539 5.074 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)c1 560553668 YAXVAPUZAYGHQC-UHFFFAOYSA-N 386.760 5.548 30 20 GKED N#CCCCOc1cccc(-c2nc3ccccc3n2CCc2ccccn2)c1 568786633 KFOYKWSKIFSTBY-UHFFFAOYSA-N 382.467 5.024 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(Oc3cccnc3)cc2)c1 580358830 NDTWZWKMUIFABE-UHFFFAOYSA-N 388.427 5.200 30 20 GKED COc1cc2ccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)cc2cc1OC 597691263 KATYJTFIOZNBGD-NRFANRHFSA-N 388.467 5.022 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccccc2CCC(C)C)cc1 603574534 CFIHUPGNORETDX-UHFFFAOYSA-N 380.492 5.227 30 20 GKED CCCn1c(S[C@@H](C#N)Cc2ccccc2)nnc1-c1ccc(Cl)cc1 604008585 RURTZCQPIGQPDC-GOSISDBHSA-N 382.920 5.235 30 20 GKED C=CCN(C(=O)C[C@H](C)CC(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 609009592 FVBRSXCEMMONQK-OAHLLOKOSA-N 387.505 5.310 30 20 GKED CCCN(C(=O)c1sc(C(C)(C)C)nc1C)c1cc(Cl)ccc1C#N 609285986 IVPNLVRYTLURGH-UHFFFAOYSA-N 375.925 5.331 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)c1ccc(F)cc1 609385335 RWBFNVRWGREODB-IAGOWNOFSA-N 399.535 5.242 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NC3(c4ccccc4F)CC3)c2)cc1 609930767 XIWFRVSASPZXHV-UHFFFAOYSA-N 387.414 5.300 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCC34CCCCC4)cn2)c1 611160305 UWCFOIWKJAOVTN-UHFFFAOYSA-N 376.460 5.076 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)N2CC[C@@H]2c2cccc(F)c2)cc1 611362924 XHKBHHBJNRLARK-HSZRJFAPSA-N 385.442 5.021 30 20 GKED CCCCN(C(=O)Nc1ncccc1OCCCC#N)[C@@H](C)c1ccc(C)o1 615554685 UGGOLLDRZHEAGY-KRWDZBQOSA-N 384.480 5.061 30 20 GKED CC(C)c1ccsc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 619753859 HQFXYMWVEXIUJN-HNNXBMFYSA-N 386.929 6.138 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3cccs3)c2)[C@H]1c1ccncc1 644980418 MQHWBCTWNOAMNR-NRFANRHFSA-N 387.508 5.158 30 20 GKED CC[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1nccn1C 647323378 DYPPVIMZBZLMTM-LBPRGKRZSA-N 383.311 5.273 30 20 GKED COc1ccc([C@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 675737160 AYLGCRRICLKLFO-NNYUYHANSA-N 387.339 5.394 30 20 GKED C#CCN(C(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12)C1CCCCC1 727710521 ONLSWWKACSABHM-UHFFFAOYSA-N 391.471 5.014 30 20 GKED CCCCCCCCC/C=C/C(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 727756166 RKACQHLDCZSEMY-KVDXNUTJSA-N 390.612 5.180 30 20 GKED N#CCOc1ccc(CNC(=O)Nc2ccc(CCCc3ccccc3)cc2)cc1 727936271 JBZZYBGWCIEFRY-UHFFFAOYSA-N 399.494 5.086 30 20 GKED CCN(C(=O)/C=C/c1ccccc1C#N)[C@H](c1cccnc1)c1ccc(F)c(C)c1 729254532 FDEBGAAVFWNFFE-BVYAJCBJSA-N 399.469 5.052 30 20 GKED CC(=NNc1ccc(C)nn1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 729935765 OVYYKOZJEKWMQK-UHFFFAOYSA-N 376.407 5.368 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc2c(c1)OCCCO2 731318197 CUVASSHPPMQEQN-AWEZNQCLSA-N 399.541 5.051 30 20 GKED CC(C)n1cc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 732878989 VNYGMSJTMFMIAJ-VGSWGCGISA-N 387.487 5.002 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Cc2coc3ccc4ccccc4c23)c1 733773892 HNSPQTRETWVANE-FQEVSTJZSA-N 398.462 5.126 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)Cc2csc(-c3ccoc3)n2)c1 737541571 LFHCAAGAFWKWEM-UHFFFAOYSA-N 398.487 5.160 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3cc(Cl)cs3)c2)s1 739596091 QOTURQWWFDNYQO-UHFFFAOYSA-N 386.929 5.251 30 20 GKED CON=Cc1ccc(C(=O)Nc2cccc(CO[C@@H]3CCC[C@H](C)C3)c2)cc1 745136061 RECBTGMAPGSMGE-HTAPYJJXSA-N 380.488 5.015 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 747108794 SKBYPQYSVZQORJ-LRDDRELGSA-N 389.282 5.007 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(=O)oc2ccccc12 750599600 CJZFQAQQSYCZAK-OAQYLSRUSA-N 394.430 5.009 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2ccc(Cl)s2)n1)Cc1ccccc1 750782569 BQGYIENFYPQXGI-CYBMUJFWSA-N 388.901 5.064 30 20 GKED C=CCn1c(SCc2nc(Cl)ccc2Cl)nnc1-c1ccccc1C 762480772 QFEUJSDCMURQBD-UHFFFAOYSA-N 391.327 5.434 30 20 GKED C=CC[C@@H](N[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 766018244 GTSQQEYDIRADFS-YVEFUNNKSA-N 388.355 6.087 30 20 GKED O=C1/C(=C/c2ccc(-c3cccc(Br)c3)o2)CCc2nc(O)ccc21 769614777 MQJQKQRIDNYJKH-ACCUITESSA-N 396.240 5.022 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C1(c2ccc(Cl)cc2)CCCCC1 780153483 JKWUARYSPWMZOW-INIZCTEOSA-N 382.891 5.471 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1ccnc(Cl)c1 782194036 KSQHXACEGSJSIS-ZZXKWVIFSA-N 391.279 5.320 30 20 GKED CCc1ccccc1CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 785887736 ZLCPIBLOIGRRBN-OAHLLOKOSA-N 382.435 5.070 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)[C@@H](C)Oc1ccc(Cl)cc1Cl 789075821 CGCGLUXGGUDDKJ-GFCCVEGCSA-N 390.270 5.090 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nccc3ccccc23)c(Cl)c1 792108789 ZCUNNPKAPMLWHC-SFHVURJKSA-N 378.859 5.232 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1 793384776 WRQHBELTPYASSO-KRWDZBQOSA-N 379.460 5.060 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)OC(=O)C[C@H](CC#N)c3ccccc3)o2)cc1C 795982917 JBVBJWWDOUEHOE-MJGOQNOKSA-N 389.455 5.045 30 20 GKED Cn1cc(/C=C\C(=O)c2cnn(C3CCCC3)c2)c(-c2cc3ccccc3o2)n1 799897040 KCGRIDLRSSOYSU-KHPPLWFESA-N 386.455 5.041 30 20 GKED N#CC1(CCCOC(=O)c2cc(C3CC3)nc3ccc(Cl)cc23)CCOCC1 800178849 GCYRJRHTRHSCJY-UHFFFAOYSA-N 398.890 5.023 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(OC(F)F)c(Br)c2)co1 806558155 UOOJKTQCWPPVII-HWKANZROSA-N 386.192 5.058 30 20 GKED N#CCC1(OC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)CCC1 810854138 MCDCEHQSTNOIDA-UHFFFAOYSA-N 377.227 5.174 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(C)ccc2C(F)(F)F)c1 825446726 NFTSXVWTSXZTPP-OAHLLOKOSA-N 391.393 5.017 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2C[C@@H]3[C@H](C2)C3(F)F)c1 844519609 HGFIUJPMEABDOZ-KDURUIRLSA-N 380.479 5.293 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 862718174 HSYLYBNEBAGPLT-SFHVURJKSA-N 391.512 5.252 30 20 GKED C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[S@](=O)CCCCC1(C#N)CCC1 899394048 CDDOSYGUHIEFOJ-RMKBEBRYSA-N 391.924 5.064 30 20 GKED N#CC[C@H](CC(=O)Nc1c(-c2cccc(F)c2)n[nH]c1C1CC1)c1ccccc1 909718395 NUEPGRIDJZPXLY-QGZVFWFLSA-N 388.446 5.119 30 20 GKED CC(C)CN(C(=O)c1ccc(C2SCCCS2)cc1)c1ccc(C#N)cc1 914510784 XNDTWYPDHHTBTN-UHFFFAOYSA-N 396.581 5.730 30 20 GKED CC(C)Oc1cccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 916679463 OZQZTHSRZMDBRP-DEOSSOPVSA-N 399.494 5.451 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026853 PVXJVSQRWLKLLV-GOEBONIOSA-N 396.899 5.416 30 20 GKED C=CCn1c(C)nn(CN(Cc2ccc(Cl)c(Cl)c2)C(C)C)c1=S 917482060 DXTYVYXGILAWCQ-UHFFFAOYSA-N 385.364 5.083 30 20 GKED Sc1nnc(-c2ccccc2Cl)n1N=Cc1ccccc1OC1CCCC1 920364259 AOGXXXAQWJGQCM-UHFFFAOYSA-N 398.919 5.091 30 20 GKED CC(=NNc1cccc(Cl)c1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776080880 INDMGZIDALFJBT-UHFFFAOYSA-N 389.238 5.788 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2sc(Br)cc2C(=O)O)cc1 1776105742 CRDDZDSMMLJRMV-NSHDSACASA-N 395.322 5.017 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)sc(C)c1Br 1776783309 OLALUUOCXJEOQI-AWEZNQCLSA-N 390.387 5.421 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCC)cc1OCCC 1776784669 FNHHOKYIWYVAOT-HXUWFJFHSA-N 393.568 5.558 30 20 GKED CCCCCCCOc1cccc(CNc2ccc([C@@H]3C[C@H]3C(=O)O)cc2)c1 1776787617 SVIIJDSXSFKMJT-XZOQPEGZSA-N 381.516 5.836 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(-c2c(F)cccc2F)cc1 1777268214 RPWILFWKUCJCMS-QXMHVHEDSA-N 394.373 5.235 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)s1 1777462957 SZDMKTBITAQWGH-MDZDMXLPSA-N 383.856 5.366 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(Cl)c(C(F)(F)F)c1 1777640947 GTGAHDMEBXAMQH-VURMDHGXSA-N 398.764 5.108 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc3nc(C(F)F)sc13)C2=O 1777682956 ISZNAJPJQWGDBZ-BENRWUELSA-N 399.418 5.535 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)c1ccc(C#N)cc1 26129746 UETZBKRQXYBVCV-OAHLLOKOSA-N 386.417 5.266 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Cl)cc3[N+](=O)[O-])n2)cc1 46442658 GFWGCLYOAUOPJU-OAHLLOKOSA-N 397.843 5.170 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3csc(-c4ccccc4)n3)n2)cc1 61047540 CSFOVMOEGWYJMQ-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(F)cc1 66956319 WKFOTVLQAHHDSL-KXBFYZLASA-N 383.492 5.589 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)NCc1ccc(F)cc1C(F)(F)F 97547241 XVSWCDRURYABGL-HNNXBMFYSA-N 393.302 5.197 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccccc3SC[C@@H](C)C#N)o2)cc1 108408476 XDKRVESTFSUKDY-JKSUJKDBSA-N 378.501 5.470 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2ccccc2Cl)cc1 111183639 DITQRZMCKWDDPG-HNNXBMFYSA-N 388.920 5.166 30 20 GKED Cc1ncc(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 112484202 SITRRMNLEPANSL-LFAOLKIESA-N 385.901 5.118 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 112738252 NKYJBBZMYMBTRQ-DYESRHJHSA-N 381.545 5.942 30 20 GKED C=CCn1c(SCc2csc(-c3ccccn3)n2)nnc1-c1cccs1 123201185 XKCINKCQZAXXCK-UHFFFAOYSA-N 397.554 5.003 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)Nc1ccc(F)cc1OCC#N)C1CC1 135270887 AMKLZUOCBSSEAE-CYBMUJFWSA-N 387.842 5.139 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171243307 UHQPFYBOPPOOCL-UHFFFAOYSA-N 375.516 6.002 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)sc1-c1ccc(F)cc1 182122941 TVRDBXMHOSRQPD-CQSZACIVSA-N 380.444 5.406 30 20 GKED N#CCCCOc1cccc(CNc2nnc(SCc3ccccc3)s2)c1 192960662 RSPQZBZOTFMBEF-UHFFFAOYSA-N 396.541 5.125 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2cccc(OC(F)F)c2)ccc1OC 237173538 LBEPJHRCSRSIKL-OAHLLOKOSA-N 377.431 5.102 30 20 GKED C[C@@H]1CC(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 245739606 GAFMCFXHAFINGN-STXHMFSFSA-N 382.891 5.138 30 20 GKED OC1=N[C@@H](/C(O)=N/C2(c3cccc(Br)c3)CCCCC2)CCC1 328877709 ISKUUQKHVHLNJF-OAHLLOKOSA-N 379.298 5.074 30 20 GKED Cc1nc2ccccc2n1CC/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329533330 XWVOGRKKWVCTGN-HXUWFJFHSA-N 391.519 5.081 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)oc12 425401890 QVMQJRXLKBWICQ-JKSUJKDBSA-N 391.471 5.167 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1 425652971 KBWUGGZBQQCNJJ-CQSZACIVSA-N 398.894 5.175 30 20 GKED Cc1ccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)c(OC(C)(C)C)c1 431291536 FKYOYXLGUNLWNM-OAQYLSRUSA-N 393.531 5.407 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 436303535 CVXMZPIYAHIBPV-FOVJLYNBSA-N 376.475 5.034 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(CSC(C)C)c1C 438448535 WMCGKWCVOLGUEW-UHFFFAOYSA-N 398.572 5.865 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccccc1 438842411 POTNFIWVVQCVCD-JOCHJYFZSA-N 377.463 5.060 30 20 GKED CSc1cc(C(=O)N[C@@H](CCC#N)c2ccccc2)c(Cl)cc1Cl 439668411 AUYIBQBCCMPZNX-INIZCTEOSA-N 379.312 5.490 30 20 GKED CCCCN(Cc1nnc(-c2ccc(C#N)cc2)o1)Cc1ccccc1Cl 441516031 XLFODHUJLNEKPU-UHFFFAOYSA-N 380.879 5.064 30 20 GKED N#Cc1c(F)ccc(CNc2ccc(C(=O)NC3CCCCC3)cc2)c1Cl 446881212 OCKUQBBGOMWAHM-UHFFFAOYSA-N 385.870 5.025 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)NCC1(C#N)CCC1 450736822 GXHGMRAFTDCWLL-LBPRGKRZSA-N 390.350 5.226 30 20 GKED COc1ccccc1[C@H](C)SCC(=O)c1cn(CCC#N)c2ccccc12 463213819 QLHKNEXREHEEGK-INIZCTEOSA-N 378.497 5.241 30 20 GKED N#CCCCOc1cccnc1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 466615600 AHUFWZWWEBWUOU-UHFFFAOYSA-N 394.456 5.013 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1ccco1)c1ccccc1OC 472049385 QUVBREGHDZVFMC-HSZRJFAPSA-N 390.483 5.166 30 20 GKED N#CC[C@H](CC(=O)Nc1ncccc1OCC1CCCCC1)c1ccccc1 475453879 STNVMIWVEALXGH-HXUWFJFHSA-N 377.488 5.067 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CCC)c1nnc2ccccn12 475556959 VJIHAZSQNOGMQC-IBGZPJMESA-N 391.519 5.244 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)cc1 476225353 NTEZUCCIGLNULG-UHFFFAOYSA-N 394.396 5.824 30 20 GKED C[C@H](NCc1ccc(C#N)o1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 480460763 MCJHYQGYFBVEEO-LBPRGKRZSA-N 376.403 5.749 30 20 GKED C[C@@H](CC1CC1)NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 497772070 WZWQYXDIFUFCBH-AWEZNQCLSA-N 383.879 5.101 30 20 GKED C=CCN(C(=O)c1ccc(F)c(SC)c1)c1nc(-c2ccccc2)cs1 499126326 FSYUPAMAVCVWNP-UHFFFAOYSA-N 384.501 5.504 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1sc2c(c1C#N)CCCC2 500223247 CFQXLRDNWCTHFH-UHFFFAOYSA-N 385.539 5.244 30 20 GKED O=C(CCCC(F)(F)F)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 505401801 FNLTXUYPGFVOHL-NSHDSACASA-N 381.238 5.158 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)Cc2csc(-c3cccs3)n2)cc1 505809138 MCVARJRBCHBZGH-QGZVFWFLSA-N 395.553 5.093 30 20 GKED N#Cc1c(NC(=O)Cc2c[nH]c3cc(F)ccc23)sc2c1CCCCCC2 508960220 PMPHEWLUCYVHDE-UHFFFAOYSA-N 381.476 5.080 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)s1 512561796 YJBNNGQXPBTOMY-STQMWFEESA-N 393.965 6.069 30 20 GKED N#Cc1c(NC(=O)c2ccc(C(F)(F)F)cn2)sc2c1-c1ccccc1CC2 515628576 TUJGAYUHUBWYML-UHFFFAOYSA-N 399.397 5.051 30 20 GKED C=CCOc1c(Br)cc(CNCc2ccccc2C)cc1OCC 518272742 IPPFSTPTNQXYJO-UHFFFAOYSA-N 390.321 5.011 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCCc3c[nH]c4ccccc34)cc2)cc1 519988429 RSTOCYUOPKEKKV-UHFFFAOYSA-N 396.450 5.196 30 20 GKED CC(C)N(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CCCCC1 520327800 WSZIMUAXBVZWBP-UHFFFAOYSA-N 376.500 5.728 30 20 GKED CSc1cccc(N(C)C(=O)c2cccc(OCc3ccccc3C#N)c2)c1 523553892 SKOFJANAFQDWHH-UHFFFAOYSA-N 388.492 5.136 30 20 GKED CO[C@@H](C)CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(C)C 525417036 SVKYWPUCWKDVLE-OXJNMPFZSA-N 399.922 5.273 30 20 GKED CC(C)C[C@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 537041316 BTGBBVOZGGFSAC-RXVVDRJESA-N 395.572 5.254 30 20 GKED CC(C)c1cccc(O[C@H](C(=O)N2CCC(CC#N)CC2)c2ccccc2)c1 541055587 UOYJYQKTMOYPSQ-QHCPKHFHSA-N 376.500 5.082 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Sc2cccc(Cl)c2C#N)c(Cl)c1 543960740 VDDULDPBCURBBO-GFCCVEGCSA-N 379.312 5.601 30 20 GKED Cc1ccccc1C1CCN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC1 544458673 RTGFOLSBYYYTLQ-UHFFFAOYSA-N 397.478 5.074 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(CC(F)(F)F)no2)cc1Cl 545560947 BRJBRWPQZPQNEP-UHFFFAOYSA-N 379.725 5.159 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)cc1 554390143 FKAJDNVXVJIVHA-GOTSBHOMSA-N 387.527 5.505 30 20 GKED C=CCC[C@H](NCc1ncc(CSC)s1)c1ccc(C(F)(F)F)cc1 555563931 SAOWWPYHMLRZIY-INIZCTEOSA-N 386.508 5.822 30 20 GKED C=CCC(C)(C)C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 560121303 LODHBKULOBTCMG-UHFFFAOYSA-N 385.895 5.203 30 20 GKED CCN(CC(=O)Nc1c(Cl)cccc1Cl)[C@@H](C#N)c1ccc(Cl)cc1 585717743 XAEZBSROWWNXED-INIZCTEOSA-N 396.705 5.172 30 20 GKED N#CCCC[C@@H](NCc1cc(Br)c(Cl)s1)c1ccccc1 590069296 PQRGJPMPFZCJTQ-OAHLLOKOSA-N 383.742 5.689 30 20 GKED CC(C)C[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596241669 VWWZKWRMHFYXBJ-CRAIPNDOSA-N 381.442 5.128 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 609555572 UBAUZBUQFPUWRY-BHIYHBOVSA-N 379.529 5.396 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1ccncc1 610722649 QJNAVRVWDPBENK-KRWDZBQOSA-N 387.458 5.128 30 20 GKED C[C@H](N[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)c1cccc(C#N)c1 610755231 VPYGVYRUHIPSCN-RYUDHWBXSA-N 387.270 5.327 30 20 GKED COc1cccc([C@@H](C)c2noc(/C=C\c3cn(CCC#N)c4ccccc34)n2)c1 612917853 QYZXUEDGLGQFOG-WFTPILKQSA-N 398.466 5.269 30 20 GKED C=CCN(C(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C)c1ccccc1 614559951 MELLWZHWTNGINS-UHFFFAOYSA-N 394.471 5.281 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1cccc(C(F)F)c1 622571907 PBLNRPWTTUQFAB-UHFFFAOYSA-N 381.247 5.497 30 20 GKED Cc1cc(F)cc(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 676327096 GUXOBHQFQWMKBN-IWIIMEHWSA-N 386.311 5.165 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)F)c1cc(F)c(C(F)(F)F)c(F)c1 683215095 RQLAUAAOVBXJOO-UHFFFAOYSA-N 399.237 5.019 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(SC(F)(F)F)cc2)cc1NC(C)=O 726430016 WYRYJVUOGBMGDY-WEVVVXLNSA-N 395.402 5.162 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1Cl 727627502 NQXWSXVPSYUFEM-ZDRDQBANSA-N 388.854 5.244 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)NC1CCCCC1 727978963 QPALBFHDYXKDKT-UHFFFAOYSA-N 379.529 5.065 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)c2)cc1 729160446 QKYKOGIBNOIUFZ-UHFFFAOYSA-N 390.424 5.068 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)c1 729556745 JSMVNQYIOUROCW-FQEVSTJZSA-N 383.879 5.295 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3sc(C)c(C)c3C#N)c2c1 730447001 HZCHTLWAQPQPKT-UHFFFAOYSA-N 398.491 5.408 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 730749363 KVZNLZJYSYIJAE-PKTZIBPZSA-N 391.474 5.079 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 732878897 SBJBNNKAHWFBJP-JWQCQUIFSA-N 395.506 5.923 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@H]2c2ccc(F)c(F)c2)cc1Cl 732928343 HACJKEKURIYZJG-KRWDZBQOSA-N 377.847 5.024 30 20 GKED FC(F)(F)Oc1ccc(NN=C(CC2CCCCC2)c2ncccn2)cc1 733907423 PQCKIWJAIMUYIG-UHFFFAOYSA-N 378.398 5.162 30 20 GKED Cc1oc(-c2ccsc2)nc1CSCc1cc(Cl)ccc1OCC#N 735318029 IEKQUTRCKVBEIO-UHFFFAOYSA-N 390.917 5.701 30 20 GKED O=C(c1cccc(Oc2nccs2)c1)N1CCCSC1=Nc1ccccc1 736458572 GQADLVKFKCDACC-UHFFFAOYSA-N 395.509 5.202 30 20 GKED COCCOc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741842731 MRXOGOODSONPGG-WCIBSUBMSA-N 396.430 5.262 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744462908 SACGSXZWAVDEFA-NTKDMRAZSA-N 384.479 5.386 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)COc2c(Cl)cc(Cl)cc21 753141931 JWTWMSOYURILDJ-BJMVGYQFSA-N 389.263 5.171 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 754690370 SOUINRCRXXLYHL-KFRNIWOLSA-N 379.765 5.546 30 20 GKED C=CCC(CC=C)C(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 761200543 VSWOHPHKLIAFEE-NSHDSACASA-N 381.259 5.416 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)OCc2ccc(C(F)F)cc2)c1C(F)F 764552627 ACUIHNVDBVWQFE-UHFFFAOYSA-N 398.278 5.154 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2n1C 766836949 GJQKHGYKPQIKJA-GAJOTYCWSA-N 384.266 5.160 30 20 GKED Cc1cc(Cl)cc2c1OCC/C(=C/c1cnc(-c3ccccn3)s1)C2=O 768501007 SPNKSCZVINFXMX-LCYFTJDESA-N 382.872 5.216 30 20 GKED C[C@@H](N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(OCC#N)cc1 772961097 XPEVWWONIQDESN-PXAZEXFGSA-N 377.271 5.070 30 20 GKED C[C@H](N[C@H](C)c1ccccc1-c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 776162175 CLLYVSSQFWYFAY-ZWKOTPCHSA-N 390.914 6.321 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2)c1 780151172 NNFNCUDQRDGJKW-OAHLLOKOSA-N 392.842 5.675 30 20 GKED CC(=O)c1cc(F)cc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1O 782523164 IENLPLDUUOTAEI-HNNXBMFYSA-N 388.442 5.123 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 782773179 LYGZWBVHHILHDT-SFHVURJKSA-N 395.528 5.480 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2ccc(Br)cc21 788353231 FPFRMOQOVHMLLN-UITAMQMPSA-N 388.208 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CCC)[C@@H](O)c1ccccc1 791875001 KYAIHDGQSCCRKL-GMAHTHKFSA-N 380.532 5.562 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)[C@@H](C)c1nc2ccccc2s1 796750989 KJNJWSMNAPXTAB-RYRKJORJSA-N 378.497 5.419 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568089 FFXFJQMWAYRLOU-DOMZBBRYSA-N 394.462 5.514 30 20 GKED Cc1sc(CNc2nc(Cl)c(C#N)s2)nc1-c1ccc(Cl)cc1 804372226 JWJFSWPWULENKA-UHFFFAOYSA-N 381.313 5.366 30 20 GKED O=C1/C(=C\c2ccc(-c3c(F)cccc3F)o2)C[C@@H](C(=O)O)c2ccccc21 806559564 CJRGEELSUHLWHK-UILAEWCASA-N 380.346 5.063 30 20 GKED COc1ccc([C@H](Cc2ccccc2)N[C@H](C)c2ccc(OCC#N)cc2)cc1 810255058 VHKKELSHPXZAFV-CLOONOSVSA-N 386.495 5.232 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)c2cccc(Br)c2)n1 813072090 HYJWYKSOKKEIMK-SMDDNHRTSA-N 377.307 5.009 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)c(Cl)c1)c1cc(C(F)(F)F)ccn1 813216173 NZSPVHIHDJOKER-GFCCVEGCSA-N 387.188 5.216 30 20 GKED O=C(/C=C\c1cc(Br)c(Cl)s1)c1cc([N+](=O)[O-])ccc1F 814190824 JGYKVYWKRHWSQZ-RQOWECAXSA-N 390.617 5.107 30 20 GKED C=CCN(CCC#N)C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 816802905 CZNQHIMWBCGOGZ-UHFFFAOYSA-N 375.859 5.097 30 20 GKED CCCCCCCC(=O)N1CCC(c2nccc(-c3ccccc3OC)n2)CC1 856523560 QKGGBXAXPZMBED-UHFFFAOYSA-N 395.547 5.219 30 20 GKED N#CC(CCOC(=O)c1c(F)cccc1Cl)(c1ccccc1)c1ccccc1 912956427 DHBDWNRWQDJABE-UHFFFAOYSA-N 393.845 5.536 30 20 GKED Cc1cc2ccccc2n1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086233 IICFBPWIJYNMGX-QHCPKHFHSA-N 379.463 5.244 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915181054 WLGZWKKMCSKJIS-QHCPKHFHSA-N 386.520 5.771 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976399 NKWXXLZCWDHXFC-SFHVURJKSA-N 380.900 5.581 30 20 GKED N#C[C@@H](C(=O)CN1CCCCC[C@@H]1c1ccccc1)c1nc2ccccc2s1 917155555 YZDPFOFLVLZJCA-AZUAARDMSA-N 389.524 5.090 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)c(C)n1-c1cccc(Cl)c1 920115971 SWCPQBHZMVTTAN-SFHVURJKSA-N 389.842 5.379 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccccc3Cl)n2)cc1 920138861 LGZOBGZKUQJKQM-VGMNTSGFSA-N 394.883 5.362 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1c(F)cccc1O[C@@H](C)c1ccccc1 1776030141 GTHFARIMGHFOFB-INIZCTEOSA-N 392.430 5.500 30 20 GKED CC(C)CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Cl)cc1 1776033326 HJGUNSDZMDXEAB-UHFFFAOYSA-N 379.287 5.944 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NNc1cc(Cl)cc(Cl)c1 1776058590 UHICKWJKOKTOLV-UHFFFAOYSA-N 395.286 5.268 30 20 GKED CC(=NNc1cccc(Cl)c1Cl)c1sc2ccccc2c1C(=O)O 1776081115 YEWONGKMCWITTE-UHFFFAOYSA-N 379.268 5.742 30 20 GKED C=C(Cl)C[C@@H](NCc1ccc(Cl)cc1Oc1ccc(C)cc1C)C(=O)O 1776143166 SINDGRJJECHBAV-QGZVFWFLSA-N 394.298 5.435 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 1776354834 AALAVXSSTMYTIH-KTKRTIGZSA-N 393.464 5.192 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)ccc1Br 1776782871 IMKWIBUXNSCSAG-HNNXBMFYSA-N 390.749 5.396 30 20 GKED CCCCCCCOc1cccc(/C=C(\CC(=O)O)c2nc3ccccc3o2)c1 1776789103 RBGVHIGAECECDO-XDJHFCHBSA-N 393.483 6.192 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)c(Cl)c1 1777403172 GTDUMXZFULZQKF-POHAHGRESA-N 398.867 5.916 30 20 GKED O=C(O)c1ccc2scc(/C=C3\CSc4cc(F)c(F)cc4C3=O)c2c1 1777685675 TUWBIRXGBOPWFB-QDEBKDIKSA-N 388.416 5.250 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)C1 1785807051 FSNQYEGDVZDLFU-UHFFFAOYSA-N 380.532 5.057 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OCCCC)cc1C 63393221 KLDNGIXXQYNVIS-UHFFFAOYSA-N 397.475 5.302 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCC(=O)c1ccc2ccccc2c1 63667683 ICOFPKLPRBZCGN-UHFFFAOYSA-N 384.479 5.112 30 20 GKED CC(C)(C)[C@@H]1CCc2sc(C(=O)Nc3ncccc3OCCCC#N)cc2C1 72086244 SEUDSRBPCJTGPZ-MRXNPFEDSA-N 397.544 5.229 30 20 GKED O=C(c1cc(F)c(Cl)cc1Cl)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117203378 HKOBOJDEALKTIU-UHFFFAOYSA-N 398.105 5.089 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCOC2(CCCCC2)C1 124698556 DYHCSNXZRNBPDS-DLBZAZTESA-N 387.549 5.084 30 20 GKED N#CCC[C@@H](NC(=O)NC(c1cccs1)c1cccs1)c1ccccc1 133073586 RQKTUUMSDRMCCS-MRXNPFEDSA-N 381.526 5.243 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 153465288 RSWZNECOTRQIIE-ZDUSSCGKSA-N 389.318 5.262 30 20 GKED C=CCc1cc(C(=O)N(C)c2c(Cl)cccc2Cl)cc(OC)c1OC 155922007 GCTQDFSEBUXHIH-UHFFFAOYSA-N 380.271 5.016 30 20 GKED CCC(CC)n1ncc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 156402607 NTYYYOPTUCEJRC-CQSZACIVSA-N 386.908 5.306 30 20 GKED CCC(CC)n1ncc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 156402728 NTYYYOPTUCEJRC-AWEZNQCLSA-N 386.908 5.306 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(CCC(F)(F)F)cc2)c1 159415604 OVIVNROTLTWOOG-UHFFFAOYSA-N 376.378 5.116 30 20 GKED Cc1c([C@@H](C)Nc2cccc(OCCCC#N)c2)nnn1-c1cccc(Cl)c1 179821663 WMOXQBFJKWYZHR-OAHLLOKOSA-N 395.894 5.085 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2ccc(Cl)cc2)n1)Cc1cccs1 180112972 WPALUXULIYBOJG-GFCCVEGCSA-N 388.901 5.064 30 20 GKED COc1cc(C(=O)/C=C\c2cc3cccc(OC)c3o2)ccc1SC(F)F 214929047 VGZUTEDFMXGDDE-FPLPWBNLSA-N 390.407 5.661 30 20 GKED CCOc1ccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)c2ccccc2)cc1 236852134 TXOQUXNJXHOJNP-KBMIEXCESA-N 386.495 5.255 30 20 GKED N#C[C@@H](C(=O)/C=C\c1nc2ccccc2s1)c1nc(-c2ccccc2)cs1 255012320 ZZEAEDOSCRVOLI-WOLCWHLNSA-N 387.489 5.309 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C\c2ccc3ccc(Cl)cc3n2)n1 255326885 TULKQNGXICOQSU-PTZVLDCSSA-N 381.888 5.358 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)CCCC1(C#N)CCOCC1 281997134 NHOFGKQLLVPFAA-UHFFFAOYSA-N 395.547 5.087 30 20 GKED CC[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc(C(F)(F)F)cs1 301415314 DWMNBQVQZAVXNZ-LLVKDONJSA-N 379.329 5.616 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)CCCCOc2cccc(C#N)c2)c1C 303846808 DYHLZPAGRUDWKJ-HSZRJFAPSA-N 376.500 5.088 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)nc1 409665168 NYYLEPSSDIWRHY-UHFFFAOYSA-N 379.872 5.151 30 20 GKED Cc1c(C)n(Cc2ccco2)c2ncnc(N[C@@H](CCCC#N)c3ccccc3)c12 431137149 CRBUIPOXMMTRKZ-NRFANRHFSA-N 399.498 5.537 30 20 GKED CC1(C)CN(C(=O)Nc2ccccc2C#Cc2ccccc2)[C@H]1c1cccnc1 433004226 DIXVCJXSTPZLMA-QHCPKHFHSA-N 381.479 5.096 30 20 GKED CCCN(CC(C)(C)O)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 435111974 UOCUVNOPUQNLIT-IBGZPJMESA-N 399.922 5.010 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 437273000 ZLTGGWSWDOTMAY-QAPCUYQASA-N 392.808 5.271 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCS[C@@H]4CCCC[C@H]43)cc2)cc1 438045130 RAGSPPHCMWDEAH-FGZHOGPDSA-N 392.524 5.045 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc(-c2ccccc2)cs1 439662204 PXQSRMAUDFXJAZ-ZDUSSCGKSA-N 390.361 5.458 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 441002223 JNLQZKDAXFYCLU-BPZDKFOGSA-N 381.907 5.059 30 20 GKED COC(=O)c1ccc(C(C)C)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 455248140 GXDRYKXLEORHED-HXUWFJFHSA-N 393.487 5.153 30 20 GKED CC(C)c1nc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cs1 469267595 UIQPYZMELLZBCJ-HNNXBMFYSA-N 382.533 5.023 30 20 GKED O=C(Cc1ccccc1F)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474260290 RSLZVGPGGZZIGU-HNNXBMFYSA-N 393.302 5.197 30 20 GKED N#CC[C@H](CC(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 476055386 VUUNMGIIIXTSQP-UYAOXDASSA-N 384.932 5.044 30 20 GKED N#CCCCOc1ccccc1C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 478727512 XWJXBGZTVZADDK-UHFFFAOYSA-N 382.769 5.294 30 20 GKED C=C(C)[C@H](NCC(=O)Nc1ccccc1-c1ccccc1)c1ccc(F)c(F)c1 481604239 XUAZDLCRDAVEOJ-DEOSSOPVSA-N 392.449 5.477 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@H](C)C#N 482537722 SYWJHWJDIWKETJ-PBHICJAKSA-N 388.920 5.388 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2cc(Br)ccc2o1)c1ccccc1 487407130 RGXKTORMHZXJCW-QGZVFWFLSA-N 397.272 5.360 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)N[C@H](CCCC#N)c1ccccc1 487467679 BNFGTRHQKJCXPP-HXUWFJFHSA-N 389.524 5.207 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(Br)cc1)[C@H](C)c1ccc(C#N)cc1 499284835 DTSMYAHIYZOJMO-HUUCEWRRSA-N 385.305 5.034 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)c1 502375010 OCXSORDCEQXVDY-NRFANRHFSA-N 378.834 5.065 30 20 GKED COc1cc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)ccc1OC(C)C 502618056 MNBKXAMSMXZVNG-MRXNPFEDSA-N 395.503 5.166 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(C)(C#N)CC2)c(C(F)(F)F)c1 506953991 RBMQSLVQMKGYIQ-CYBMUJFWSA-N 399.482 5.754 30 20 GKED C=CCN(Cc1cc(-c2cccs2)on1)Cc1cc(-c2cccs2)on1 507329899 YWTNGASGGWUDMB-UHFFFAOYSA-N 383.498 5.308 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(COCCc3ccccc3)c2)c1 508417724 NUPAHVCJMLEFAQ-UHFFFAOYSA-N 390.870 5.223 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccccc3Oc3ccncc3)n2)c1 509187203 OTKPQYXJZYXYAW-UHFFFAOYSA-N 398.447 5.121 30 20 GKED COc1ccccc1SC[C@H](C)CNC(=O)Nc1ccc(C(C)(C)C#N)cc1 509548218 FWXAQHPSPXVJLF-MRXNPFEDSA-N 397.544 5.046 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510646511 HAJYWVADKSWWEX-UHFFFAOYSA-N 391.858 5.668 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1nc(C(C)C)oc1C 511990610 PLMNGEHVXCKHFF-UHFFFAOYSA-N 391.446 5.273 30 20 GKED Cc1sc(NC(=O)CCCc2ccc(Br)s2)c(C#N)c1C 514518343 QQFGRWLRFHDMDY-UHFFFAOYSA-N 383.336 5.022 30 20 GKED COCc1c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)oc2ccccc12 515448928 DFGIQPLCSQKCBL-UHFFFAOYSA-N 394.496 5.424 30 20 GKED CC(C)c1cc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)nn1C(C)(C)C 520889546 MABVXGLCVUBYBB-IBGZPJMESA-N 380.536 5.054 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCCC2(CCCCC2)C1 533440880 NWNHBNIUILSLPG-GOSISDBHSA-N 385.577 5.066 30 20 GKED Cc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cccc1-c1ccccn1 535878137 YABOMKVUQAMSHK-UHFFFAOYSA-N 395.487 5.910 30 20 GKED C=CCC[C@H](NCc1c(C)nc2sc(C)nn12)c1ccc(C(F)(F)F)cc1 537320435 JYJRLWDACMCYGT-INIZCTEOSA-N 394.466 5.224 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)C1CC1 539030431 XKSAJWFYKKREGY-UHFFFAOYSA-N 377.366 5.075 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1c(F)cccc1F 539525682 XACJVJASBQDRBN-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED CCC(CC)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C 539582363 GTLRSEPKJWWCLS-SFHVURJKSA-N 392.528 5.475 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c1 539666402 HWHPEXFCYFQGEP-UHFFFAOYSA-N 384.483 5.158 30 20 GKED Cc1cc([C@H](NC(=O)N2CCC(CC#N)CC2)c2ccccc2Cl)ccc1F 541965677 PBTYUSBUWYLORK-NRFANRHFSA-N 399.897 5.212 30 20 GKED N#CCCN(C(=O)CCCSc1ccc(Cl)cc1)c1ccc(F)cc1 556707278 MDHLWOUTRUGRAX-UHFFFAOYSA-N 376.884 5.298 30 20 GKED Cc1c(C(=O)N2CCC(OC3CCCCC3)CC2)sc2ccc(C#N)cc12 559339933 NVRYFBPVKDZCNO-UHFFFAOYSA-N 382.529 5.035 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)Cc1coc(-c2cccs2)n1 579990128 NOKARPKAFXWKKB-UHFFFAOYSA-N 399.475 5.051 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)CC3(C#N)CC3)nc2c1C 590975514 NCNGULPSUJPMMT-UHFFFAOYSA-N 375.497 5.140 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC[C@H](CC#N)C3)o2)cc1 597916338 MBUOJGJQLYGNEB-GOSISDBHSA-N 385.467 5.083 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)N1CCc2c(CC#N)cccc2C1 599710622 HOIMKALJUCOWIV-UHFFFAOYSA-N 381.907 5.121 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c2C(C)C)cc1 603569240 CNXAJSNRFCOQQL-UHFFFAOYSA-N 386.499 5.358 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CCc3ccccc3F)c2)cc1 603814314 QOOMDFNBCXWONH-UHFFFAOYSA-N 388.442 5.042 30 20 GKED C=CCN1CCC(NC(=O)N[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)CC1 606925868 YBPNJHPMAIEJNJ-KRWDZBQOSA-N 397.950 5.018 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(F)c(F)c1 609298125 HHDOJDAQQHWCGG-UHFFFAOYSA-N 382.341 5.044 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cc2ccccc2o1 609378497 PWIDAQVGLZTXNL-UHFFFAOYSA-N 390.386 5.710 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 609773535 JPVOVJRNSPEKKI-XLIONFOSSA-N 395.528 5.455 30 20 GKED CCCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 613319697 JTWDCZPJXJOAIB-GOSISDBHSA-N 396.899 5.742 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cccc(F)c1Cl 622485049 CIZSESQRKVVPTR-CYBMUJFWSA-N 399.693 5.531 30 20 GKED C=CCCc1ccccc1NC(=O)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 669727601 GMQIQPWLYAYNOJ-STQMWFEESA-N 380.332 5.010 30 20 GKED Cc1cc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c2cc(F)ccc2n1 675789523 DSIDAQSXVILMLA-QWRGUYRKSA-N 380.307 5.249 30 20 GKED Cc1cc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c(OC(F)F)cc1C 678297121 KEIXVNRCRGATHQ-TXEJJXNPSA-N 391.302 5.077 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 678761095 XADJUUGANXHEMD-CQSZACIVSA-N 399.516 5.738 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1cnc(-c2ccccc2)s1 727264396 QKKQJOPNUVWSJC-LVAJTGTJSA-N 388.448 5.548 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2cccc(SC(F)F)c2)c1C#N 727412546 NPPLGXKNQURSOU-UHFFFAOYSA-N 391.468 5.120 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@H]1CCCN1c1ccc(C#N)cc1 728168713 ZGYUXCDMRFKNOV-OAQYLSRUSA-N 393.556 5.365 30 20 GKED Cc1ncc(-c2ccc(NC(=O)c3cc(C)n(-c4ccc(C#N)cc4)c3C)cc2)o1 728265947 PFAUBNQUUIARJQ-UHFFFAOYSA-N 396.450 5.182 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)cc2F)c1 730173382 WVZOMRJREBBSJD-UHFFFAOYSA-N 380.806 5.301 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2cc(-c3ccccc3)cs2)ccc1OC 733330283 RGQMCVFMEPRVFB-FQEVSTJZSA-N 392.524 5.394 30 20 GKED C=CC[C@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccncc1 734679509 HWTUYHGQTLCKCI-PXNSSMCTSA-N 395.553 5.179 30 20 GKED N#CCN(C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)C1CCCC1 737640527 CJYJDEOHLXHRSE-UHFFFAOYSA-N 389.886 5.464 30 20 GKED COc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1 743034595 AGGBHMLKVKUCTC-UHFFFAOYSA-N 393.443 5.307 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(N2CCCCCC2)cc1 743056615 IGQCLYNJMYFGJP-AUWJEWJLSA-N 399.494 5.545 30 20 GKED CC(C)(C)c1ccc(C2(CNC(=O)c3ccccc3SCC#N)CCC2)cc1 748784506 ZJZYJJLRRXZTKM-UHFFFAOYSA-N 392.568 5.451 30 20 GKED COc1cccc(/C(C)=C\C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 751233221 PPGMBJREEFUWBW-SSZFMOIBSA-N 399.450 5.105 30 20 GKED C#CCCCCCC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1 752913198 ATPKZEKOBXWJDN-UKILVPOCSA-N 375.512 5.336 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3cnc(-c4ccccn4)s3)c(C)c2c1 753142959 BWEXEPZCAOVOOX-BQYQJAHWSA-N 376.437 5.164 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC/C(C)=C\c2ccc(Cl)cc2)ccc1OC 753852690 FFLWFATTXBNWDY-VZEGMYIASA-N 384.907 5.223 30 20 GKED CCCCCOc1cc(C)ccc1CNC(=O)c1ccccc1SCC#N 756971403 YSFRVLLTNSQXSO-UHFFFAOYSA-N 382.529 5.110 30 20 GKED O=C(/C=C/c1ccc(F)c(C(F)(F)F)c1)c1cc(Br)ncc1F 762428208 WZMUEJFFGQHBPY-DUXPYHPUSA-N 392.121 5.037 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 767703339 UEBPVSUATAQURY-CYBMUJFWSA-N 392.908 5.127 30 20 GKED CCNc1ccc(C#N)cc1NCc1coc(-c2ccc(C(F)(F)F)cc2)n1 776849291 JJEJDWBIJHMLPQ-UHFFFAOYSA-N 386.377 5.276 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl 780682405 VSOINMCQJQPTRT-GHMZBOCLSA-N 396.249 5.306 30 20 GKED CSCCCCCCNC(=S)N(Cc1ccccc1)c1ccccc1C#N 782202598 SQVWOEMBKYITHW-UHFFFAOYSA-N 397.613 5.363 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792095251 KDAVPYJAZMYBTE-KDOFPFPSSA-N 382.385 5.624 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)Nc1sc(C)c(C)c1C#N 796519882 GEHVFNHOUOIJBZ-UHFFFAOYSA-N 385.489 5.144 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 802036551 ZVGDERJJURVVTD-YOEHRIQHSA-N 376.481 5.115 30 20 GKED COCCOCc1ccc(/C=C/C(=O)c2ccc(SC)cc2Cl)cc1 809157938 PFDWOGRJTRNNIH-JXMROGBWSA-N 376.905 5.121 30 20 GKED C#C[C@H](NCc1cc(-c2ccncc2)ccc1OC)c1ccc(Cl)cc1F 809698527 CHQJPWXTUZGQMS-NRFANRHFSA-N 380.850 5.014 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1sc(-c2ccccc2F)nc1C 814820601 JPTORZSQNSWNMY-UHFFFAOYSA-N 383.452 5.077 30 20 GKED CN(Cc1cccs1)c1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1 824434846 SCMZUDKZTMAEBB-XMMPIXPASA-N 389.568 5.909 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)n1[C@H](C)c1ccccc1 916848182 DMYYWLBPDDAVAE-JPYJTQIMSA-N 393.490 5.753 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)c(C)n1C1CCCCC1 916912972 UHEDTCPVTAUJOM-SFHVURJKSA-N 397.906 5.225 30 20 GKED CC(F)(F)CCC(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917032673 OHRYFKIKKYQNTQ-NSOUWEPUSA-N 378.488 5.223 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2COC(C)(C)C)c1 932533001 ODTGNRFGJZXEEU-LJQANCHMSA-N 395.503 5.004 30 20 GKED O=C(O)c1cc(F)c(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)c(F)c1 1776127322 PLOVMOMFZCTFSE-KHPPLWFESA-N 394.373 5.138 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(Br)c1Cl 1776784766 SWEOULGYKIJWPB-AWEZNQCLSA-N 390.749 5.396 30 20 GKED N#Cc1ccc(/C=C/c2nc3ccccc3c(-c3ccccc3)c2CC(=O)O)cc1 1777566541 ZCGZAGMAJOYWAQ-CCEZHUSRSA-N 390.442 5.571 30 20 GKED O=C(O)/C=C\c1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 1777624241 YOKBLTWHIQCDJE-OZDSWYPASA-N 380.749 5.353 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3ccc(C(C)(C)C#N)cc3)cs2)cc1 29151156 IIWZXFVQBRYBJO-UHFFFAOYSA-N 375.497 5.101 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 41558492 QTVKCYCYNKNOIH-INIZCTEOSA-N 383.398 5.100 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc2[nH]c(C)c(C)c2c1 65696119 OYLSWIGAFLIYDT-UHFFFAOYSA-N 387.936 5.397 30 20 GKED Cc1ccc(Br)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 66159958 SNWZMGIOAYBKOF-UHFFFAOYSA-N 386.293 5.072 30 20 GKED Cc1ccc2c(CNc3ccccc3S[C@@H](C)CC#N)cc(=O)oc2c1C 66861057 AJDPBZOPRNJXJX-HNNXBMFYSA-N 378.497 5.416 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccnc(Cl)c1 108241868 FDKJXSILWJYNHM-UHFFFAOYSA-N 385.798 5.012 30 20 GKED CCC[C@@H](NC(=O)CNc1ccccc1SC[C@@H](C)C#N)c1ccccc1 108353907 WAMSPVHHIRJLKG-PKOBYXMFSA-N 381.545 5.008 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1)c1ccccc1 120452838 PVBSPKIIHXYRNN-CQSZACIVSA-N 388.349 5.013 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cccc(Cl)c3Cl)s2)cc1 121431985 YJSLVVYJERQYQU-UHFFFAOYSA-N 388.279 5.165 30 20 GKED CC(C)(C#N)CCCNc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 133704126 HZPAPYWSOHPHFC-UHFFFAOYSA-N 379.382 5.293 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1[C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1 154395163 IHFRPFYMUQHHNU-ZDUSSCGKSA-N 389.846 5.043 30 20 GKED C[C@H](C#N)CNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 171843509 FENNZBWBGDBXEC-CYBMUJFWSA-N 384.888 5.268 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 178012737 RLJGGMSRTBLRLO-UHFFFAOYSA-N 395.242 5.502 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](O)c1cc2ccccc2s1 191447502 UCOGRDXCAHDFRY-LJQANCHMSA-N 394.540 5.608 30 20 GKED Cc1cccc(-n2c(SCCCCC#N)nc3cc(Cl)ccc3c2=O)c1 195579558 FMMGICAHVSSLBW-UHFFFAOYSA-N 383.904 5.134 30 20 GKED COc1cc(/C=C\C(=O)c2cc(Br)cs2)ccc1OC(F)F 210595442 IWQATGUXJDGEMN-RQOWECAXSA-N 389.217 5.017 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1nc(-c2ccccc2Cl)cs1 277827125 JQQOATJFXOQTCR-DEOSSOPVSA-N 380.966 5.432 30 20 GKED N#Cc1nc(N2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)ccc1Cl 301661178 MQJUTIXZAOAYRP-UHFFFAOYSA-N 396.705 5.099 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc2cc(Br)ccc2o1 302964925 GTKGNMQZVMKNAQ-UHFFFAOYSA-N 384.273 5.066 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 303713225 QGZVQFSXKDIZIY-CWTRNNRKSA-N 379.262 5.139 30 20 GKED CC1(C)C(O)=Nc2cc(/C(O)=N/CCc3nc(C4CCCCC4)cs3)ccc21 328899268 YUILNMFASGIUSZ-UHFFFAOYSA-N 397.544 5.617 30 20 GKED CC1(C)CCCC[C@@H]1/C(O)=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1 329866161 AWKKLSCIIUZZSE-SJORKVTESA-N 389.540 5.644 30 20 GKED CC(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(F)cc1F 330013811 MLJRLMKMOOYERR-KJXMEXGPSA-N 378.463 5.544 30 20 GKED C=CCN(C(=O)c1cncc(-c2cccc(C)c2)c1)c1nc2c(s1)CCCC2 426881042 BZQRIOIOFCCIHJ-UHFFFAOYSA-N 389.524 5.225 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCS[C@@H]4CCCC[C@@H]43)cc2)cc1 438045129 RAGSPPHCMWDEAH-FCHUYYIVSA-N 392.524 5.045 30 20 GKED C[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 438078204 WVGYFCJOSXASMN-QGZVFWFLSA-N 383.451 5.329 30 20 GKED Cc1ccc(NCc2ccc(C#N)cc2OC(F)F)cc1NC(=O)C(C)(C)C 439548302 INHYKGJKVNVISJ-UHFFFAOYSA-N 387.430 5.065 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1CC1 444396707 OMBPJSNUAOVKMG-MRXNPFEDSA-N 387.439 5.701 30 20 GKED CC(C)(C#N)CCCCN[C@@H](CC(F)(F)F)c1ccc(Br)cc1 444688721 KOEYGCJZXIGPJL-HNNXBMFYSA-N 391.275 5.752 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 457785408 KYQDBKPAXZFBBL-LLVKDONJSA-N 385.323 5.081 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 458797421 GHPVZNHWQXRPNS-NHCUHLMSSA-N 381.907 5.622 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)NCC(C)(C)CC#N)s2)cc1 459256401 IGADSXMQLFDNSO-MRXNPFEDSA-N 384.549 5.069 30 20 GKED COc1ccc(N(C)C(=O)c2ccc(Sc3ccccc3C#N)cc2)cc1F 466918960 WAYVQELZJQBSAQ-UHFFFAOYSA-N 392.455 5.134 30 20 GKED C[C@@H](CCC#N)Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 470447310 XWJWCVHTUQTVEK-HNNXBMFYSA-N 382.920 5.431 30 20 GKED COCCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCC1 471230155 LXXFCIVHRRMLIN-IBGZPJMESA-N 382.891 5.141 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)C[C@H](CC#N)c2ccccc2)s1 475253757 FECRRUAROUBVGG-IBGZPJMESA-N 378.497 5.266 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](COc1ccccc1)c1ccccc1)c1ccccc1 475757185 QQYQXYFENDTWAP-VWNXMTODSA-N 384.479 5.010 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1c(F)cccc1F 481153040 IFZOHQBLKXUWOY-UHFFFAOYSA-N 380.419 5.264 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc[nH]c2C2CCC2)cc1Cl 485710816 NPMSYESVHVUKQZ-HXUWFJFHSA-N 389.886 5.843 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 488361088 BYSHRXBPHCMNDT-LJQANCHMSA-N 383.879 5.165 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(F)c(C(F)(F)F)c1 498737628 RMTTVIVLCZFSNP-AWEZNQCLSA-N 379.275 5.268 30 20 GKED CN(C(=O)c1ccc(C#N)[nH]1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 501108487 DWEAEWYQYMRNQN-UHFFFAOYSA-N 384.266 5.055 30 20 GKED CC[C@@H](C)Oc1cccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 503616974 WVJWWDRPIXKMCJ-QGZVFWFLSA-N 375.472 5.057 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 505326776 XDIHPIWPXSFXHM-QRWLVFNGSA-N 385.508 5.739 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 511541316 KYDCTQNUUSKKTO-GOSISDBHSA-N 398.375 5.356 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(Cl)cc1Cl 513554205 OGRXBQNABFXCMV-UHFFFAOYSA-N 381.307 5.381 30 20 GKED COc1ccc2oc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c(C)c2c1 515539112 KPGHWIIDORSASY-AWEZNQCLSA-N 396.855 5.503 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(F)cc1Br 518262788 DOJJGQNZMLAMLW-GFCCVEGCSA-N 379.298 5.595 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccc3)cc2)cc1 519052280 ONWXMFFPQWKIPK-HSZRJFAPSA-N 383.451 5.720 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 519427375 CHDCWBOMCZVDOD-AWEZNQCLSA-N 393.537 5.623 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)[nH]n1 520927894 BDVRPFWDWAPGOD-ZDUSSCGKSA-N 396.903 5.377 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)n[nH]2)cc1 521329364 BYVLXXJSFBOANF-OAHLLOKOSA-N 376.485 5.032 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2cccc(COc3cccc(C#N)c3)c2)C1 522312520 DAABGBYICKVDBG-QHCPKHFHSA-N 396.490 5.075 30 20 GKED C[C@H](NC(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1)c1ccc(C#N)cc1 522786107 VLISWXRXKFXLLZ-AWEZNQCLSA-N 376.460 5.171 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)sc1SCC#N 525656751 YREAVMJMTUCNBF-QWHCGFSZSA-N 398.340 5.116 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccc(C#N)cc1 532206767 YWAFTFVGIXEJIC-LSDHHAIUSA-N 377.469 5.607 30 20 GKED C=CC1CCN(C(=O)Nc2cccc(OCc3cccc(OC)c3)c2C)CC1 533775218 NIDQFLKNVCJFLC-UHFFFAOYSA-N 380.488 5.013 30 20 GKED N#Cc1ccc(C2=CCN(Cc3ncc(-c4ccc(Cl)cc4)o3)CC2)cc1 534310427 VVYVEMUEBIYQMW-UHFFFAOYSA-N 375.859 5.156 30 20 GKED COc1cc(CN[C@H](c2ccccc2)C2CC2)ccc1OCc1cccc(C#N)c1 537291130 UUKOUDJDHRBGOE-AREMUKBSSA-N 398.506 5.387 30 20 GKED C[C@H](C(=O)Nc1cc(C(C)(C)C)sc1C#N)c1ccc(Br)s1 538071681 CNDCUYOJHNQYBC-VIFPVBQESA-N 397.363 5.483 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 539621411 PCZNGPLZNSLSEV-OAHLLOKOSA-N 386.417 5.484 30 20 GKED Cc1nc(-c2cccc(-c3noc([C@@H](C)Oc4ccccc4C#N)n3)c2)cs1 546401733 PNWMIJFMCWBGPR-CYBMUJFWSA-N 388.452 5.180 30 20 GKED N#CCCC[C@H](N[C@@H]1CCc2c(F)ccc(Br)c21)c1ccccc1 551206098 PNMVVSDJRLXRLH-RBUKOAKNSA-N 387.296 5.600 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1c1ccccc1 558340804 PAXVNMAMXVVTPV-NZSAHSFTSA-N 379.529 5.539 30 20 GKED C[C@@H](N[C@@H](CO)c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 560912959 DXWVZSHCHUNZLK-HWPZZCPQSA-N 395.318 5.248 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)CC1 570330359 ZDIZPWFPODBGSN-LJQANCHMSA-N 389.421 5.169 30 20 GKED N#Cc1ccc(CNCc2ccc(F)cc2C(F)(F)F)c(C(F)(F)F)c1 571604863 PAUHCVGWZJGEIY-UHFFFAOYSA-N 376.275 5.025 30 20 GKED C=CCn1c(-c2ccccc2)nnc1N1CCC[C@H]1c1nc2ccccc2s1 572446403 SJHXRHIEPLJTEV-SFHVURJKSA-N 387.512 5.082 30 20 GKED CC(C)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(Cl)cc1 577128713 GEVORJHXPJEYQJ-OAQYLSRUSA-N 381.907 5.283 30 20 GKED Cc1sc(NC(=O)[C@H](C)Oc2ccc(C#N)cc2)nc1-c1cccc(Cl)c1 580350210 JHLKPYRVKTYKHE-LBPRGKRZSA-N 397.887 5.050 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Br)cc1F 581750025 PTUISENMBDGYNW-CYBMUJFWSA-N 375.285 5.240 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(Br)cc3)cc2)ccn1 582151856 STELCRDXMVRQBH-UHFFFAOYSA-N 380.245 5.120 30 20 GKED CC(=O)c1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cs1 583886406 LWKKCBBFKLRTGZ-UHFFFAOYSA-N 398.431 5.228 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F 588411209 CUXUIZXQLWFQQC-JXCQQFQQSA-N 394.780 5.215 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)CC1 592024478 JXNRYYGOAIIWKD-GOSISDBHSA-N 380.319 5.170 30 20 GKED CC(C)CCO[C@H]1CC[C@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 599171445 HOVUMWLKJHPNBM-FKBYEOEOSA-N 385.552 5.095 30 20 GKED Cc1nc(C)c(C#N)c(SCc2cnc(-c3ccc(C(C)C)cc3)s2)n1 600818755 BVXPRPZILZPXNU-UHFFFAOYSA-N 380.542 5.504 30 20 GKED CC(C)[C@H](Sc1cc(C#N)ccn1)C(=O)Nc1cc(Cl)ccc1Cl 603724914 OOSCLAKMXLWNDO-INIZCTEOSA-N 380.300 5.015 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 609125675 ZEQNTFXICRCRLN-UHFFFAOYSA-N 399.475 5.627 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609403129 VJWUQNBSPASTAY-KRWDZBQOSA-N 399.535 5.912 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCc1ccc(C#N)cc1F 610402582 SWVQUEWUFQNYPB-QGZVFWFLSA-N 387.458 5.267 30 20 GKED Cc1cc(-n2cccn2)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 616166998 MGIPLWQYGGGOHM-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CCCOc1c(Cl)cc(CN[C@H]2CCc3cc(C#N)ccc32)cc1OCC 618741842 MWCGAISIRMXSHC-FQEVSTJZSA-N 384.907 5.176 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCc2ccc(-c3ccco3)cc2F)c(Cl)c1 619242773 BUMQNQHSSBIOJG-UHFFFAOYSA-N 389.213 5.194 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCC[C@@H]1C1CC1 646436629 LDOZVNJWUXAMCP-CYBMUJFWSA-N 398.322 5.382 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1nc(C2CC2)cs1 647377487 OHTDXILVYUVVSR-SECBINFHSA-N 391.930 5.349 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494387 MSSIZAUZVLOKKK-ZETCQYMHSA-N 399.228 5.503 30 20 GKED CC(C)(CC(F)(F)F)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 666674676 CIUXDUFBNZDWHT-UHFFFAOYSA-N 389.311 5.021 30 20 GKED C#CC[C@@H](OC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1ccccn1 727775382 GDKHSSNOGLCVOE-XMMPIXPASA-N 383.447 5.019 30 20 GKED C=CCc1cc(OC)cc(CN2CCC[C@@H]2c2nc3ccccc3s2)c1O 732456199 SZAUZBCMXHFSLG-LJQANCHMSA-N 380.513 5.076 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(Cl)cc3)s2)c1 733800719 GBYUAHQXLPEOFU-LJQANCHMSA-N 396.943 6.039 30 20 GKED Cc1cc(C(=O)Nc2ccccc2OC(C)(C)C)c(C)n1-c1ccc(C#N)cc1 734474412 URUMFTNRWYKYIP-UHFFFAOYSA-N 387.483 5.395 30 20 GKED CCOCc1cccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740448627 TZHNVKNUZUJCLK-UHFFFAOYSA-N 391.496 5.145 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1cnn(-c2ccc(C#N)cc2)c1C 741812217 NRJRIFJIPPDUNU-UHFFFAOYSA-N 398.495 5.012 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744015072 FTVMAYTXEXIFNC-PBHICJAKSA-N 382.385 5.624 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-c4ccccc4)n3C)n2)cc1 744035710 VBRLIQYUPTWHJK-IBGZPJMESA-N 397.503 5.614 30 20 GKED FC(F)(F)c1ccc(NN=C(Cc2ccccn2)c2ccc(Cl)cc2)nc1 745192974 YAFKAZUKWLYLAA-UHFFFAOYSA-N 390.796 5.208 30 20 GKED CC(=NNc1ccc(Br)cn1)[C@@H](C)c1nc2ccccc2s1 748787743 GRPUKXUWCMINEE-SNVBAGLBSA-N 375.295 5.045 30 20 GKED Cc1sc2ncn(N=C[C@H]3CCCc4ccccc43)c(=O)c2c1-c1ccccc1 752158611 WEGJVBNLMGIBJD-LJQANCHMSA-N 399.519 5.387 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(Cl)c(C(F)(F)F)c1 754689403 GLEXEEHJMPPOPS-DUXPYHPUSA-N 394.805 5.773 30 20 GKED Cc1nc(CSc2ccccc2C(=O)OCC2CCC(C#N)CC2)cs1 755975267 OSYWVOLJBPTHQF-UHFFFAOYSA-N 386.542 5.231 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 757739760 BULZYWNDTXXXAU-FQEVSTJZSA-N 396.491 5.240 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(-c3ccoc3)c2)cc1 760969053 MCNFJONGRSIARQ-OPAMFIHVSA-N 386.451 5.421 30 20 GKED CCc1cc(Br)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 763141246 VSFODICXSCAXJK-UHFFFAOYSA-N 394.725 5.345 30 20 GKED COc1cc(C=NOCc2nc(-c3ccccc3)cs2)ccc1OC(C)C 766683269 CQZWBQNXAKNJBK-UHFFFAOYSA-N 382.485 5.157 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCc2cn3ccccc3c2C#N)cc1 773370618 JRCTXFUHDHYUTB-MRXNPFEDSA-N 390.487 5.009 30 20 GKED COc1cc(C(=O)/C=C\c2nc3c(s2)CCCC3)ccc1SC(F)F 776263166 BMKJUKVXIMYEEH-CLFYSBASSA-N 381.469 5.241 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SC[C@H](O)c1ccc(Cl)cc1Cl 777658625 AEYIYWIJVXJNDL-LBPRGKRZSA-N 393.217 5.105 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 780486690 ZJFPCDQIOGRYKH-UWJYYQICSA-N 396.450 5.277 30 20 GKED Oc1nc(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)nc2ccccc12 789023721 NMNFRPZCYUYQBJ-AWEZNQCLSA-N 386.377 5.090 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(C)[C@H](C1)C2(Cl)Cl 794331552 VDQZYWYGXHBMCA-QFBILLFUSA-N 381.347 5.586 30 20 GKED N#CC1(CCCOC(=O)c2ccc(Oc3ccccc3Cl)cc2)CCOCC1 800177062 YEYXEJLYKRDGSE-UHFFFAOYSA-N 399.874 5.390 30 20 GKED CCOC(=O)c1csc([C@@H](C#N)C(=O)CC2CCC(C(C)(C)CC)CC2)n1 802056411 NEHWDOMPEZSBBT-GPANFISMSA-N 390.549 5.129 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(F)c(N2CCCC2)c(F)c1)c1ccccc1 814616239 OIDWLYOADABIIN-HXUWFJFHSA-N 398.457 5.122 30 20 GKED COc1cc(/C=C2\CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1OC 818242010 HAYKVTYSKIQRQV-IZKYPSLPSA-N 399.830 5.095 30 20 GKED Cc1cc(NC(=O)c2ccccc2SCC#N)ccc1NC(=O)OC(C)(C)C 856370719 NCZLQRMXUXICSB-UHFFFAOYSA-N 397.500 5.210 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 916681787 YVEIGDQITOTJCS-HVETUWLQSA-N 385.467 5.380 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1 1776126030 ZZBCIZZANUACTC-XNTDXEJSSA-N 380.484 5.939 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776473701 ZRPNXLVESNLSFH-HBWSCVEGSA-N 396.439 5.302 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776805961 KCUIYSZDVWVTCU-GIJQJNRQSA-N 384.475 6.291 30 20 GKED C[C@@H](CC(=O)Nc1nnc(SCc2ccc(C#N)cc2)s1)CC(C)(C)C 6705263 YPMSVRJJRFIRJA-ZDUSSCGKSA-N 388.562 5.103 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C(C)(C)C)cc1)=C(/S)NC(C)(C)C 55014826 SEZFBRRNWMVRLG-UHFFFAOYSA-O 397.608 5.161 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)cc1OCCCC#N 64367489 ZVYUYMWYOQQGJB-ONNFQVAWSA-N 389.373 5.293 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc2ccccc21 64715410 ONOXICIGMALYHM-ZDUSSCGKSA-N 393.418 5.070 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1Cl 66392865 WXAPIXIUBRFSIJ-NRUUGDAUSA-N 379.209 5.043 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66953959 GDLCJBDTDHPTQG-JKSUJKDBSA-N 383.517 5.314 30 20 GKED C=CCOc1ccc(C(=O)N2CCC[C@H]2[C@H](CC)c2ccccc2)cc1OC 116161098 ZUIBDYYTPOPNKF-RTWAWAEBSA-N 379.500 5.058 30 20 GKED C=CCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1OC 119995411 MCEINMDBNMAOHD-AWEZNQCLSA-N 398.871 5.013 30 20 GKED Cc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1OCC(F)F 128692826 QNWAAMGRKIIBAB-UHFFFAOYSA-N 396.441 5.028 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1cccc(OC(C)(C)C)n1 132028541 PTGHKSSDESIHCY-MRXNPFEDSA-N 397.544 5.224 30 20 GKED N#Cc1ccc(-c2nnc(COc3cc(Cl)c(Cl)cc3Cl)o2)cc1 133347138 QXVHWAVKNMGYIQ-UHFFFAOYSA-N 380.618 5.147 30 20 GKED N#CC1CCN(C(=O)N[C@H](CCCCc2ccccc2)c2ccccc2)CC1 153729546 OZYVENVQOFFZDB-HSZRJFAPSA-N 375.516 5.086 30 20 GKED Cc1c(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cccc1C(=O)Nc1ccccc1 154964966 NKBDHPAIJMQCKZ-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(CCC(F)(F)F)cc1 159194513 RKUUFWKGIIGXTI-PMACEKPBSA-N 386.417 5.093 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c1C1CC1 159658414 YMTUGAJCFBPOIU-YWZLYKJASA-N 378.520 5.024 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(F)c1 171742344 UBEJYKMIJDHIPQ-DNVCBOLYSA-N 383.492 5.446 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C1CCCC1)C(F)(F)F 184010026 PVMHSUNQCZPMBH-LRDDRELGSA-N 385.455 5.181 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 184333791 WYJADPIOOYWXEZ-KRWDZBQOSA-N 383.451 5.192 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@H](C)c1cc2ccccc2o1 184359219 APFPNZCFVHYOOO-HZPDHXFCSA-N 377.444 5.339 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 184633755 AOQHEOAFKHQREP-GAJHUEQPSA-N 398.466 5.361 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ncc(Br)cc1F)c1ccc(F)c(F)c1 187567666 QIWDINDTRVBIKC-MGPLVRAMSA-N 385.227 5.229 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCn1c(=O)oc2cc(Cl)ccc21 189887117 GXGOSUZCWNEVDP-UHFFFAOYSA-N 398.890 5.129 30 20 GKED N#Cc1ccc(C[S@@](=O)Cc2ccc(Oc3ccccc3)c(F)c2)cc1F 190832139 BLLKTOZJKLZIBF-HHHXNRCGSA-N 383.419 5.078 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cnc3ccccc3n2)oc2c1ccc1ccccc12 191002194 PJPWSFCSWIDSMH-GOSISDBHSA-N 377.403 5.328 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1cc2sc3ccccc3c2s1 193442674 ACMZIEQIZMKHTP-CQSZACIVSA-N 376.462 5.077 30 20 GKED C=CCn1c(SCCCCC#N)nc2scc(-c3ccccc3)c2c1=O 195564527 QDAREKFKHOSDGX-UHFFFAOYSA-N 381.526 5.097 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@@H](c3c(Cl)cccc3Cl)C3CC3)o2)cc1 289749350 KYPSBTROTGCARS-LJQANCHMSA-N 399.281 5.156 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(c2ccc(Br)cc2)C2CC2)cc1 411046967 LQUXBRIFZBCWHF-UHFFFAOYSA-N 383.289 5.059 30 20 GKED O=[S@@](Cc1cc(F)c(C(F)(F)F)cc1F)C1CCC(C(F)(F)F)CC1 414270994 QMJZKLUBPFFPOX-VPWWVJTISA-N 394.327 5.353 30 20 GKED C[C@@H](SCc1ncc(C#N)cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 419416547 WICXRQOYNINGHX-SECBINFHSA-N 391.340 5.380 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425631295 OUGJDNSSMPGHDP-CQSZACIVSA-N 386.293 5.163 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 433235934 XLFMIZFMJSTOQU-UHFFFAOYSA-N 377.284 5.156 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)cc1Br)c1ccccc1 439484392 OLVRBQPKTSFXEA-HNNXBMFYSA-N 392.684 5.269 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC(C)(C)CC(=O)c1ccccc1 442769964 NGXSQHNRHNRWSB-UHFFFAOYSA-N 377.528 6.166 30 20 GKED CC(C)(C#N)CCCCN1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 444648458 NMOSCASWIGSIDA-UHFFFAOYSA-N 383.363 5.694 30 20 GKED CC[C@H](NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1ccc(C#N)cc1 447595937 BABUIBHGKBBUEB-SFTDATJTSA-N 387.552 5.528 30 20 GKED CC(C)(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COCc2ccco2)c1 454834155 NUXWAJVRBZBPLC-UHFFFAOYSA-N 388.467 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 455238025 BAWHSQWSAWNXGQ-JOCHJYFZSA-N 375.516 6.095 30 20 GKED CCSc1cc(Cl)ccc1C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 461113345 YXEKFOYEKKWNEW-HNNXBMFYSA-N 398.837 5.465 30 20 GKED C[C@@H](C(=O)Nc1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 463461291 MRNBCYLPQKKESJ-SNVBAGLBSA-N 397.194 5.082 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ncccc1OCCCC#N 466610614 MTBSQLBREQFPGQ-SFHVURJKSA-N 392.503 5.159 30 20 GKED N#Cc1csc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)c1 470135225 WBZUXMHISPXZFN-UHFFFAOYSA-N 390.251 5.366 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N(C)c3cc(Cl)ccc3C#N)ccc2c1 472304089 UOGCTWKDNDCASO-AWEZNQCLSA-N 378.859 5.140 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1C 473053716 WBTADVNOYVHSDK-UHFFFAOYSA-N 375.394 5.330 30 20 GKED Cc1ccc([C@H](NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)C2CC2)cc1 479078335 IHSIPPYFEOKFFG-QHCPKHFHSA-N 375.516 5.186 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)N(CC2CC2)C2CCCCC2)CC1 479211076 DSHWLCKLFIGKOU-UHFFFAOYSA-N 395.547 5.003 30 20 GKED Cc1ccc(C)n1C1CCN(C(=O)c2ccccc2Oc2ccccc2C#N)CC1 480521462 SWRFEOBXYPVIBZ-UHFFFAOYSA-N 399.494 5.246 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3C(F)(F)F)c2)cc1 482316192 IRWVQVMURVCKEX-UHFFFAOYSA-N 382.341 5.622 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1C 482787668 MCSJRLPAWPMJNN-INIZCTEOSA-N 388.471 5.273 30 20 GKED CN(C(=O)[C@H]1CCC(F)(F)C1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 484087486 YYNSXPDAYDTCSN-CMPLNLGQSA-N 389.286 5.203 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)ccc1OC(F)F)c1nc2ccccc2s1 484550821 YOQUPNSSCLGUJT-LLVKDONJSA-N 378.787 5.041 30 20 GKED C=CCC[C@@H](C(=O)N(C)Cc1ccc(OC)c(OC(F)F)c1)c1ccccc1 488621094 CBTMIZRPYFYZBO-GOSISDBHSA-N 389.442 5.005 30 20 GKED C=CC[C@@H](C(=O)N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 488677227 RIQLPXJNBAGAHD-NTKDMRAZSA-N 386.495 5.198 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 488717140 KLHGDMOQEFKFGW-HSZRJFAPSA-N 398.506 5.936 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H](C)c1cccc2ccccc12 492662806 YEFHSNAOKPGXGL-ZWKOTPCHSA-N 378.541 5.155 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H]1CCCC(F)(F)C1 503341457 CTNXXTAKUHDJKN-LLVKDONJSA-N 392.393 5.475 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(Oc4ccccn4)cc3)CC2)cc1 503492354 WFRIBJJIIMBGJV-UHFFFAOYSA-N 396.450 5.067 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1cc2ccccc2s1 504463178 VQZUHWNAUFOJSP-MRXNPFEDSA-N 375.497 5.232 30 20 GKED Cc1ccc(-c2nc(NC(=O)CSc3ccc(C#N)cc3)sc2C)s1 504846800 RUIWDAFXIWUAAV-UHFFFAOYSA-N 385.539 5.091 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3c(F)cc(C#N)cc3F)s2)cc1 505768600 KINNOANNAFXNTC-LLVKDONJSA-N 385.439 5.450 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)F)cc1 505834603 UQZCMJILGSCSKT-FHWLQOOXSA-N 398.453 5.070 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 510678461 FQPUIRRBJVDGCS-QHCPKHFHSA-N 397.478 6.028 30 20 GKED N#Cc1ccc(NCc2cccc(COCc3ccco3)c2)c(C(F)(F)F)c1 517928399 FXOUMMYXIGOUPY-UHFFFAOYSA-N 386.373 5.499 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccccc1Oc1ccccc1 519842516 XDVQATDOXQKYQX-UHFFFAOYSA-N 392.455 5.174 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)CC1 523587718 CINDVVCWIBBFCZ-UHFFFAOYSA-N 377.513 5.317 30 20 GKED CC(C)c1ccccc1OCCNC(=O)Nc1ccccc1S[C@H](C)CC#N 523594597 VYLOFAYURSILBG-QGZVFWFLSA-N 397.544 5.405 30 20 GKED CCOc1ccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1Cl 524383397 ANGNWFGRRGVDOX-UHFFFAOYSA-N 396.830 5.035 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 524526689 SLRAJIXZVCSPIV-HNNXBMFYSA-N 391.858 5.531 30 20 GKED CCCc1c(NC(=O)c2cc3sccc3s2)cnn1-c1cccc(C#N)c1 527385617 FHURXNVPHREZHF-UHFFFAOYSA-N 392.509 5.225 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cccc1-c1ccccn1 535094264 IEAGATVWRYORIJ-LJQANCHMSA-N 396.277 5.359 30 20 GKED Fc1ccc2oc(CN[C@@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)nc2c1 538319910 ILTGEXADHYVIHO-HNNXBMFYSA-N 392.274 5.379 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCOc2c(Cl)cccc21 538371292 DKLFYIRLLCJBSS-FQEVSTJZSA-N 397.906 5.046 30 20 GKED CC(C)C(=O)N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 542172085 RXWIMDUTZQAVCD-JTQLQIEISA-N 381.238 5.100 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 558338279 GGUWZFAYMJIXGE-QFBILLFUSA-N 397.544 5.704 30 20 GKED N#CCCC1CCN(C(=O)c2ccccc2NCc2ccccc2Cl)CC1 566276037 SKTXFAUNWFHPEH-UHFFFAOYSA-N 381.907 5.108 30 20 GKED Cn1c(-c2cccc(C#N)c2)nnc1N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 569393339 BDQKNJJLXCFOIK-SFHVURJKSA-N 398.297 5.002 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)Nc1ccc(C(C)(C)C#N)cc1 575321665 FMRRSUTYUZZAKH-UHFFFAOYSA-N 384.483 5.426 30 20 GKED Cc1csc(NC(=O)c2oc3ccccc3c2COc2ccccc2)c1C#N 584493626 BZYXTXYNCGKADL-UHFFFAOYSA-N 388.448 5.506 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 590122688 PYFJMTUZXPNXKG-NRFANRHFSA-N 379.504 5.558 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Cc1cccc(OCc2ccc(Cl)cc2)c1 591955600 JYAZWXWJELQRMN-UHFFFAOYSA-N 397.824 5.038 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cc3ccsc3[nH]2)cc1 604248843 HCIBJWVBMGMREV-UHFFFAOYSA-N 389.455 5.083 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCCC2)cc1)c1ccc(C(F)(F)F)cn1 605257487 GBDQPPKUWNMDIX-SFHVURJKSA-N 388.389 5.302 30 20 GKED CCS[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)C 608939146 ZMDVAALSEAGUBM-OAQYLSRUSA-N 382.529 5.048 30 20 GKED CSCc1ccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)cc1 608953549 YMARIOICPPLOOO-UHFFFAOYSA-N 388.492 5.253 30 20 GKED CC(F)(F)CCC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609062674 XEDIBOAFBUURQV-UHFFFAOYSA-N 378.806 5.165 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccc(Cl)cc1 609377279 TVUPPPXCMKXJSJ-OAHLLOKOSA-N 388.920 5.389 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609682689 WDEMLKGEGCTBBJ-YLJYHZDGSA-N 398.466 5.155 30 20 GKED N#Cc1c(NC(=O)Cc2ccccc2OC(F)F)sc2c1CCCCCC2 609815113 NQHMDYFNRAITGX-UHFFFAOYSA-N 390.455 5.061 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCc2ccnc3ccccc23)cc1 609906677 JAOAJLXBXWVNOL-UHFFFAOYSA-N 393.446 5.470 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(Cl)c1SCC(F)F 609932823 NAEUMIYMRFJAJQ-UHFFFAOYSA-N 395.862 5.233 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1coc(-c2ccccc2)n1 609968737 CAWNUNZDVWJFHB-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1c[nH]c2ccc(Cl)cc12 610040630 BYITVNLIJVWRIW-UHFFFAOYSA-N 391.883 5.603 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1C[C@@H]1Cc1ccccc1 610187213 ZMZPUYQZIGRRTH-PZJWPPBQSA-N 384.504 5.070 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610352639 VGWXZTKQBITUKV-QZTJIDSGSA-N 399.494 5.355 30 20 GKED C[C@@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1cccc(C#N)c1 610829696 FJFLSOAGIMJURP-KUHUBIRLSA-N 377.488 5.549 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3[C@H]4C=CC[C@H]3CC4)cc2Cl)cc1 611042041 HTZXCFAMPMTMCB-IRXDYDNUSA-N 379.847 5.329 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(-c2cccnc2)cc1 611094909 FWWGFCZSTXSDKS-CYBMUJFWSA-N 396.277 5.418 30 20 GKED COc1cccc(C(N[C@@H]2CCCc3cc(C#N)ccc32)c2cccc(OC)c2)c1 611393669 KANGHRVTFZUVFZ-RUZDIDTESA-N 398.506 5.332 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1sc2c(c1C#N)CCCCC2 619673870 SHBOZJXQDSEQFH-UHFFFAOYSA-N 379.460 5.137 30 20 GKED C=CCN(C(=O)[C@H](C)Cc1cccc(F)c1)c1nc(-c2ccccc2)cs1 620454016 FFNGLBQKCCXTPD-MRXNPFEDSA-N 380.488 5.347 30 20 GKED N#C[C@@H](C(=O)C1(C(F)(F)F)CC1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 726322442 UUNDZSALKVBVRA-RZYZSWTKSA-N 394.462 5.130 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)cc1 728037492 IZAHCYOFRQGSDX-GOSISDBHSA-N 388.467 5.368 30 20 GKED O=C(O)C(=O)/C(=C\c1sc2ccccc2c1Cl)c1ccc2ccccc2n1 728156597 KEUXAHIHIXBQNY-KAMYIIQDSA-N 393.851 5.297 30 20 GKED N#Cc1ccc(COC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)cc1 731377056 MHJNRAFWKZPKPM-UHFFFAOYSA-N 380.403 5.237 30 20 GKED O=C(/C=C\c1ncc(-c2ccc(Br)cc2)[nH]1)c1cc2ccccc2o1 732714401 ZIQURDQKXZHYSE-KTKRTIGZSA-N 393.240 5.482 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1nc2ccccc2s1 739141802 CTOCCRVJZQFAKB-DOMZBBRYSA-N 388.414 5.370 30 20 GKED COCc1ccc(/C=C2/CCc3nc(-c4ccc(OC)cc4)sc3C2=O)cc1 741843291 ZJHXSHFKADWFRI-AQTBWJFISA-N 391.492 5.178 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCCCC(F)(F)F 743779453 WQDSWXNDCBBFDG-IHWYPQMZSA-N 393.249 5.196 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1ccccc1-c1ccccc1 751002256 GMHXWQZMIYQVPM-UHFFFAOYSA-N 376.500 5.878 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(F)cc1F 752482378 UNXYWHYVBVYQDD-IINYFYTJSA-N 390.842 5.598 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2cccnc2)c2ccc(F)c(C)c2)c1 753678028 FCJQEHKQUOPRGV-QPPBQGQZSA-N 389.474 5.089 30 20 GKED CCC(=O)c1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)ccc1F 757934105 UNPSLGMNQUHLEB-UHFFFAOYSA-N 378.428 5.271 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(SCC(F)(F)F)cc2)cc1C#N 773072627 ASCNHNVAZDLIQN-ZDUSSCGKSA-N 380.435 5.072 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(OCc2ccc(F)cc2)cc1 773367447 KFHMFMHSGTUBMF-QGZVFWFLSA-N 376.431 5.308 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1ccsc1NC(=O)c1ccccc1Cl 776016423 RCUUFBAYBNXBNF-CYBMUJFWSA-N 376.909 5.128 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3cc(Cl)cs3)SC2=S)cc1Cl 779203498 IRNHFURUBVQNNG-WLRTZDKTSA-N 397.333 5.332 30 20 GKED O=C1/C(=C/c2scnc2C2CC2)CCc2nc(-c3ccccc3F)sc21 782327588 SJOYYOFBGFPXOE-FMIVXFBMSA-N 382.485 5.496 30 20 GKED COc1ccc2cc(C(=O)/C=C\c3cnc(-c4ccccc4OC)nc3)ccc2c1 792858792 MCAAODYUNBKVTN-GHXNOFRVSA-N 396.446 5.210 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(-c3cccc4cccnc34)cc2)c1 795298140 CUGGEPMLWDCLII-UHFFFAOYSA-N 379.419 5.056 30 20 GKED C#CCCCCNC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 797153907 HWNXNRXCYIXVEW-UHFFFAOYSA-N 395.355 5.314 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCOCC(F)(F)F)n2)o1 808023020 VYGUTBXXDOLRHR-UHFFFAOYSA-N 396.312 5.169 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)sc12 808979098 FBYCAUTTXDQDCY-SFHVURJKSA-N 384.460 5.324 30 20 GKED C=CCOc1ccc(CC(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2C)cc1 827311301 YEGKVKZQFPAJKO-UHFFFAOYSA-N 396.487 5.088 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc3cccc(OC)c3o2)ccc1OC(F)F 916130218 LCUUXODOPUQGQO-CLFYSBASSA-N 388.366 5.338 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3cccc4ccccc34)n2)cc1 916650311 CINNTSAOWVITFG-HXUWFJFHSA-N 398.487 5.527 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 917045880 BWXBAEPZTWTBNK-MRXNPFEDSA-N 396.899 5.406 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCCC(=O)c2ccccc2)cc1 917119621 PGZYNYPAXHACSW-DEOSSOPVSA-N 396.490 5.724 30 20 GKED C[C@@H](NCc1sc(Sc2ccccc2)nc1Cl)c1ccc(C#N)cc1 917427828 MZAOOPPJQUUNFS-CYBMUJFWSA-N 385.945 5.670 30 20 GKED C[C@H](C1CC1)N(C(=O)c1ccccc1OCC#N)c1cccc(C(F)(F)F)c1 920004990 BAZKOKMTCAHKBE-CQSZACIVSA-N 388.389 5.053 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)OCc1ccc(C(C)C)cc1C(C)C 920529497 UHBCDUXPCIUBST-UHFFFAOYSA-N 395.547 5.336 30 20 GKED O=C(O)c1cc(NN=C2CCCOc3c2ccc(Cl)c3Cl)ccc1Cl 1776033359 PLRDAWGJGQDGCE-UHFFFAOYSA-N 399.661 5.334 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1sc(-c2ccc(Cl)cc2)nc1C 1776084389 MFOARKUWNMYJGC-UHFFFAOYSA-N 399.903 5.235 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C2/CCc3occ(C(=O)O)c3C2=O)cc1Cl 1776353568 BYLVWTUITCHZOE-YHYXMXQVSA-N 395.238 5.284 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/Cc4c(F)cc(F)cc4C3=O)s2)c1 1777684279 CNUCDXMIXIIABE-QPEQYQDCSA-N 382.387 5.214 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(F)ccc2Oc2cc(F)cc(F)c2)c1 1777685008 UASKHJLVUYIQGI-XQRVVYSFSA-N 398.336 5.491 30 20 GKED C=CCC(CC=C)C(=O)NC1(c2ccc(NC(=O)c3ccc(C)o3)cc2)CCC1 1786488500 QAONHRZQKJZGQN-UHFFFAOYSA-N 392.499 5.104 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1coc(-c2ccccc2)n1 48053534 YYMQWDUYZADVDY-UHFFFAOYSA-N 388.496 5.002 30 20 GKED C=CCn1c(C)cc(C(=O)/C(C#N)=C\c2ccc(OC)c(OCC(=C)C)c2)c1C 60790310 DHVJQWDDLGXZHD-NDENLUEZSA-N 390.483 5.044 30 20 GKED Cc1ccccc1-c1nnc(SCc2ccc(C#N)cc2)n1Cc1ccco1 98072456 FOQQFKGSDDNVBE-UHFFFAOYSA-N 386.480 5.059 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(F)cc2)o1)[C@@H](C)c1ccc(C#N)cc1 105907773 YTVMZUNEAPJKGE-INIZCTEOSA-N 392.430 5.093 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccc(F)cc1F 108238421 AVVOTNIIZXGQBJ-CQSZACIVSA-N 390.455 5.014 30 20 GKED COc1ccc(F)cc1[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 109028913 PSLQZYGDEYNVOE-UONOGXRCSA-N 387.480 5.111 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 112246662 YRHSKKRICYCUST-GQCTYLIASA-N 397.447 5.128 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1c(C)noc1C 123605517 JXFPVMNTLLGEMZ-LJQANCHMSA-N 390.443 5.228 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)c1nc(-c2ccccc2)cs1 155441906 FLMWDGWOBIIPGM-CYBMUJFWSA-N 388.279 5.363 30 20 GKED C=CCC[C@H](NCc1nnc(-c2ccccc2Br)o1)c1ccccc1 180049652 WIVMUDCOXQQSCP-SFHVURJKSA-N 398.304 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(OC(F)F)cccc2[nH]1 188072677 WZLXFIIUGVNJDB-UHFFFAOYSA-N 384.426 5.874 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-n2ccnc2S)cc1 188072955 QPZUNHWQSGZKFO-UHFFFAOYSA-N 377.513 5.265 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2c(F)cccc2F)n1 189883701 DPWLELZWTUMEAZ-UHFFFAOYSA-N 381.426 5.255 30 20 GKED CCOc1c(Cl)cccc1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 191527873 ZBPLHVAAVZFZCX-AWEZNQCLSA-N 388.920 5.314 30 20 GKED N#CCCCOc1cccc(NCc2cc(Cl)ccc2Br)c1 316260369 DSIRDNITIQHYOB-UHFFFAOYSA-N 379.685 5.397 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329481007 DFQDCEWLSQMLFU-HXUWFJFHSA-N 392.503 5.061 30 20 GKED CC(C)(C)C(O)=Nc1nc(C/C(O)=N/[C@@H]2CCCCC23CCCC3)cs1 329573214 AHGQNPCBAOLEPM-OAHLLOKOSA-N 377.554 5.779 30 20 GKED CC(O)=Nc1ccc(C)c2c1CCCN2C(=O)c1ccc2c(c1)CCCCC2=O 329850598 ZVHXTTXMXSZIHG-UHFFFAOYSA-N 390.483 5.105 30 20 GKED N#Cc1ccc(NC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)c(Cl)c1 426131321 ZWXADRLWGUWBMU-FQEVSTJZSA-N 387.870 5.391 30 20 GKED CC(C)C[C@H](C)N(C(=O)c1ncc(C#N)cc1Cl)c1ccc2[nH]ccc2c1 431589032 IWNSASRJAVSRRE-AWEZNQCLSA-N 380.879 5.169 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCSc2c(F)cccc21)c1ccccc1 431845856 PXMDUCWCDMQIEU-MOPGFXCFSA-N 383.492 5.097 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(C#Cc2ccccn2)c1)c1ccccc1 433142475 DKIQSAYUOPXISL-DEOSSOPVSA-N 394.478 5.038 30 20 GKED N#CCC[C@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccccc1 439656065 QARJPOUYJMRIOF-QHCPKHFHSA-N 384.479 5.284 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 446640972 AJGVBERFLGDWQA-CHWSQXEVSA-N 388.327 5.095 30 20 GKED Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1sc2c(c1C#N)CCCCCC2 447391804 LEFCBCLRUGJXOF-AWEZNQCLSA-N 385.558 5.102 30 20 GKED C[C@@H](c1ccc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cc1)C(F)(F)F 453564368 GWIXDSDHVGJAFG-IINYFYTJSA-N 386.295 5.256 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 463663324 KSLXZJPZDWLIFL-CQSZACIVSA-N 393.468 5.157 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)ccn1 464669574 JSCPAWXTIQGBBH-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2ncc(-c3cccs3)o2)cc1F 467271228 KPIAEYRBUIFWIR-UHFFFAOYSA-N 391.427 5.818 30 20 GKED CCc1cccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 468647179 CQEDBHCDJWAURY-MRXNPFEDSA-N 384.570 5.515 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1)Cc1cccc(F)c1 469003164 QQBBVNXNZZVQTM-KZULUSFZSA-N 379.262 5.082 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 469665167 MEJXBFCRJMYVLL-IEBWSBKVSA-N 383.879 5.042 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1cccc(SCC#N)c1 470296895 GPTGDDIFFSFVHQ-QGZVFWFLSA-N 378.419 5.034 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(-c2nc3ccccc3s2)s1 471164278 FTROIDLKZNXXMK-UHFFFAOYSA-N 383.542 5.569 30 20 GKED CN(C(=O)c1cc(C#N)cn1C)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 471600539 CNSWQOQMUVYDQF-UHFFFAOYSA-N 398.293 5.065 30 20 GKED Cc1cccc(C)c1Oc1ccccc1NCc1nnc(-c2cccc(C#N)c2)o1 471616706 CDRFFWCBEXDXGD-UHFFFAOYSA-N 396.450 5.630 30 20 GKED Cc1onc(CC(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)c1C#N 473572570 YLRJUARLFPPEDV-UHFFFAOYSA-N 386.238 5.010 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2c2ccc(Br)cc2)cc1 475021683 FNWNJJZWILGXRA-IBGZPJMESA-N 397.316 5.228 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2cc(F)ccc2F)CC1 475560585 VFHSSNYJJDAVRP-UHFFFAOYSA-N 399.485 5.171 30 20 GKED CC[C@H](c1ccccc1)c1nnc(SCCCOc2cccc(C#N)c2)o1 477533321 WIBNVUDGBCDHMH-LJQANCHMSA-N 379.485 5.044 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)[C@H](C)C(F)(F)F 477971194 UFDJANIOLVJVRY-GFCCVEGCSA-N 396.796 5.417 30 20 GKED COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(C#N)cc1Cl 478168582 PUBDYLAKTSZSGZ-AUUYWEPGSA-N 383.879 5.225 30 20 GKED C=CCC1(C(=O)Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)CCC1 478337956 MXMZOAXNEIDSTA-UHFFFAOYSA-N 393.874 5.760 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@H](Nc3ccccc3)C2)cc1 479669974 GANZTDPPEASFMZ-NRFANRHFSA-N 399.519 5.036 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccc(Oc3ccccc3)nc2)no1)c1ccccc1 481921572 WTFZPFXJPAYNHF-SFHVURJKSA-N 382.423 5.164 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1nccc2ccccc12 483203771 WDODWHHEZPFKLJ-HNNXBMFYSA-N 391.402 5.127 30 20 GKED C=CCc1cc(C(=O)Nc2onc(C3CCCCC3)c2C)cc(OC)c1OC 485522102 SJBDPFDUNVGREO-UHFFFAOYSA-N 384.476 5.029 30 20 GKED N#CCCC[C@H](NC(=O)c1cccc(Br)c1Cl)c1ccccc1 487236856 DAAHIYPDJBMNBU-INIZCTEOSA-N 391.696 5.267 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C)c1ccccc1 488704332 ZIUSRXGCJGVTMU-OAQYLSRUSA-N 378.516 5.069 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1cc(-c2ccc(OC)cc2)c(C)s1 490257454 KRBMZSPWOHDPGE-UHFFFAOYSA-N 381.497 5.196 30 20 GKED N#CCCCOc1cccc(N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 494957013 VBWLBJSPRWSJPO-QHCPKHFHSA-N 387.439 5.479 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N(Cc3ccc(C#N)cc3)C3CC3)ccc2c1 499327334 KDELCGXHTWNVFM-KRWDZBQOSA-N 384.479 5.015 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)CCCCCC2 503296038 OIJNTGIAPHIDLF-UHFFFAOYSA-N 395.484 5.016 30 20 GKED Cc1ccc(F)c(NC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 505750529 LWJMGLOAUPEBAR-CQSZACIVSA-N 385.851 5.157 30 20 GKED Cc1nc(C(F)(F)F)ccc1-c1nc(-c2ccc(F)cc2C(F)(F)F)no1 508051352 FYAPIAFTZLFRGL-UHFFFAOYSA-N 391.246 5.284 30 20 GKED CCN(C(=O)c1sc(-c2ccc(F)cc2)nc1C)[C@@H](C)c1ccc(C#N)cc1 509605285 YGTCMSBOMWHPAN-HNNXBMFYSA-N 393.487 5.353 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(CCC(C)C)C1CC1 510857334 NAMNNSAMCPEBLU-UHFFFAOYSA-N 377.488 5.701 30 20 GKED N#C[C@@H](C(=O)c1ccc(OCC2CC2)cc1)c1nc2cc(Cl)ccc2s1 516713870 LKXUTLYWZWRFBK-INIZCTEOSA-N 382.872 5.229 30 20 GKED C[C@H](NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1)c1cccc2ccccc12 517104991 ZNEFEIQGTPHWBT-SFHVURJKSA-N 399.494 5.025 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 521800852 SCXACABWVHURAD-CQSZACIVSA-N 397.500 5.539 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCCCC[C@@H]3c3ccncc3)c2)cc1 523122783 WBNXBYJYOSWBKS-XMMPIXPASA-N 396.494 5.454 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(F)cc2)c2cccs2)c(OC(F)F)c1 531233833 TYWWELPEJXYLSI-IBGZPJMESA-N 388.414 5.239 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(C)(C)C)cc2)nnc1-c1cnccn1 531761388 IKJYDRBWYBNSNJ-HNNXBMFYSA-N 379.533 5.072 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN1CCCCC[C@@H]1c1ccco1 533435274 XGYDPDKXDLFWTM-PKOBYXMFSA-N 397.544 5.087 30 20 GKED C=CCC[C@@H](NCc1cncc(Br)c1)c1ccc(C(F)(F)F)cc1 543184778 PDBABNBFAOFUTN-QGZVFWFLSA-N 399.254 5.660 30 20 GKED CC(C)N(Cc1ccc(NCc2cc(C#N)cs2)cc1)C[C@H]1CCCCO1 546256599 PUZLBDHTDJDWDI-OAQYLSRUSA-N 383.561 5.011 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ncsc3C(F)(F)F)n2)cc1 549086399 QRVQOBOEFYIXJW-LLVKDONJSA-N 393.415 5.084 30 20 GKED C=CCN(C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 580274550 VTDGBCAOHAWRTH-HNNXBMFYSA-N 393.468 5.041 30 20 GKED Cc1csc(NC(=O)c2cc(NC(=O)CC(C)(C)C)ccc2Cl)c1C#N 581691239 QTNASXRQXAXQSM-UHFFFAOYSA-N 389.908 5.209 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)c1nc2c(Cl)cccc2s1 581729329 RMOSACPNNGNFJJ-UHFFFAOYSA-N 399.903 5.033 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)Nc3ccccc3)cc2)c(C(F)(F)F)c1 582154633 IDZRKBLUYUCAOC-UHFFFAOYSA-N 395.384 5.441 30 20 GKED CCOCCOc1c(Cl)cccc1NCc1ccc(C#N)cc1C(F)(F)F 582212857 DASNBSDNGBMFPP-UHFFFAOYSA-N 398.812 5.258 30 20 GKED Cc1sc(C2(N[C@@H](C)c3ccc(C#N)cc3)CCC2)nc1-c1ccccc1F 583091710 IPEOXRQJKMOVBP-HNNXBMFYSA-N 391.515 5.859 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H]1OCc2cc(Cl)ccc21 593975628 POJFVGIPZMUALF-UGSOOPFHSA-N 386.904 5.192 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(F)c(Br)c2)cc1OC 594782057 LKHWJJZWXIEVFM-CYBMUJFWSA-N 394.284 5.012 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603763535 DRMCBLLEEUNDSV-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CN(C(=O)c1ccc(NCc2ccccc2C#N)cc1Cl)C1CCCCC1 604009450 LQUHSHBDWHYCCG-UHFFFAOYSA-N 381.907 5.228 30 20 GKED N#CCCCOc1cccnc1NC(=O)c1sc2cc(F)ccc2c1Cl 608883412 WFEBIISYQXUOJL-UHFFFAOYSA-N 389.839 5.024 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N[C@H](c3cccs3)C3CC3)c2)c1 609641264 GDQLIUCEQKTDMO-QFIPXVFZSA-N 388.492 5.080 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2cccnc2)n1-c1ccccc1C 614397237 FDPLCJCJTGQFQK-UHFFFAOYSA-N 397.507 5.110 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1ccc(Br)cc1 615621722 GOUZQFOZSYLZNY-AWEZNQCLSA-N 391.284 5.047 30 20 GKED C[C@H](N[C@H](C)c1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 616354013 MZVLRIZWMIYJRZ-NWDGAFQWSA-N 397.238 5.751 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c(C)c2c1 642053540 NMANIQDRJOYJSS-UHFFFAOYSA-N 388.467 5.316 30 20 GKED CSc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 642282189 SIRNHRPAICZTCA-CYBMUJFWSA-N 392.427 5.527 30 20 GKED CCN(CCC(F)(F)F)C(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 683635196 MWUAUUXBZFSCSZ-NSHDSACASA-N 394.718 5.066 30 20 GKED COc1ccccc1/C=C/C=C\C(=O)c1ccc(SC(F)F)c(OC)c1 726740606 LRZCVSAZKGBFQK-FSIVZHEYSA-N 376.424 5.471 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730417303 OUXQGCNAUOHKOI-WMLDXEAASA-N 396.487 5.511 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)cc2)CCCC1)c1nc2cc(F)ccc2s1 730418715 YKXITVIYURKYQH-INIZCTEOSA-N 398.890 5.777 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420169 AOHDXOFPPQWRBL-YGRLFVJLSA-N 390.892 5.446 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(/CC(=O)O)c2nc3cc(Cl)ccc3s2)cc1 730436960 OATXIUVAAFSKOD-QENILXLESA-N 398.871 5.256 30 20 GKED COc1ccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(OC)c1 733621255 IFGOPCCKHFJGPZ-HXUWFJFHSA-N 387.439 5.003 30 20 GKED C=CC[C@@H](NC(=O)c1sc(-c2cccc(Cl)c2)nc1C)c1ccncc1 734235554 IKPLBLCRBXRNAE-QGZVFWFLSA-N 383.904 5.214 30 20 GKED Cc1cc(C(=O)N[C@](C)(C#N)C2CCCCC2)c(C)n1[C@H](C)c1ccccc1 734238775 PSKINIMKWLZXBW-HOYKHHGWSA-N 377.532 5.307 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1cnc2c(C)cccn12 741468064 RVLFHKIGONKGOR-KTKRTIGZSA-N 377.444 5.110 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3cccc(-c4ccncc4)c3)cs2)cc1 741473504 RHSJMCOIGGCPRQ-JXMROGBWSA-N 398.487 5.777 30 20 GKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1csc(-c2ccc3c(c2)OCO3)n1 742436133 GLYIXLGAMQHZGI-IXIHQHOXSA-N 399.518 5.361 30 20 GKED O=C(/C=C\c1ccc(N2CCOCC2)cc1)c1ccc(-c2ccccc2)s1 747188042 GNVXYGOVPICYBP-FLIBITNWSA-N 375.493 5.148 30 20 GKED N#C[C@H](C(=O)[C@H]1CC12CCCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 747477569 BVDYMLPYDXIRDH-ZIAGYGMSSA-N 391.323 5.873 30 20 GKED C[C@@H](OC(=O)COc1ccc(C2SCCCS2)cc1)c1ccc(C#N)cc1 748680447 QFFILMNUJIGDGB-OAHLLOKOSA-N 399.537 5.110 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1cc(Cl)ccc1OC(F)F 753144696 QUETUNGUHCLIRM-IHWYPQMZSA-N 392.814 5.356 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)c1 764151133 VQCCSCQXAJBMFN-QGZVFWFLSA-N 383.448 5.065 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)N(CC#N)C2CCCC2)cc1 772141858 IULASYXSVNBLNE-UHFFFAOYSA-N 375.476 5.076 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCOCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 786310870 FCTPEBURCNIKBY-SMDDNHRTSA-N 395.311 5.110 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNCc2cccc(Cl)c2Cl)c1Cl 790180165 AYHLKXAKUJVLKX-UHFFFAOYSA-N 393.705 5.171 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 793164953 QYYPPBYLXCHNCU-GDBMZVCRSA-N 394.462 5.730 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)c1 796350338 AYXDTBINESBNBO-CVEARBPZSA-N 377.431 5.241 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C[C@@H]3CCC(F)(F)C3)c2)cc1 797832489 BHLDWEAZUGZBOD-KRWDZBQOSA-N 384.426 5.096 30 20 GKED C=C(C)[C@H]1OCC[C@@H]1CNC(=O)c1sc2cc(C(C)C)ccc2c1Cl 798038311 WGFDXTTXXHDDGY-RDTXWAMCSA-N 377.937 5.389 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCc1ccc(C#N)cc1 800376261 ALKMLIJFCQXGFG-UHFFFAOYSA-N 392.458 5.368 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 800387886 WEUJRLANIIKGRU-ONGXEEELSA-N 388.361 5.317 30 20 GKED Cc1cc(C(C)(C)C(=O)[C@H](C#N)c2nc3ccccc3o2)ccc1Br 810534849 BZHDMWZBZDWOCR-AWEZNQCLSA-N 397.272 5.053 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@H]([C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 814673913 LYSYJYSSLFMYDU-PMACEKPBSA-N 391.600 5.066 30 20 GKED CC(=NNc1cnc2ccccc2n1)c1sc(-c2ccc(F)cc2)nc1C 814829861 MRBADTBPZQGTBT-UHFFFAOYSA-N 377.448 5.037 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)c1ccc(C2SCCCS2)cc1 841370229 LWQDOYARJJMXRL-FQEVSTJZSA-N 394.565 5.234 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)c1ccccc1SCC#N 843779557 CDBUYQFSGURAHX-UHFFFAOYSA-N 396.581 6.288 30 20 GKED N#Cc1ccccc1/C=C/C(=O)OCc1csc(Cc2ccc(Cl)cc2)n1 915232971 KVMMWIRHMIDFHD-JXMROGBWSA-N 394.883 5.016 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCOC2CCCCC2)cc1 915352878 ORQUIBUKPFWBJY-HSZRJFAPSA-N 391.515 5.203 30 20 GKED FC(F)(F)c1cccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)c1 916546067 DDXPABYCUSMKSM-UHFFFAOYSA-N 396.825 5.125 30 20 GKED C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 916906132 RHNPBFBSFMLWNS-NQIIRXRSSA-N 398.462 5.320 30 20 GKED O=C(c1cc2c(F)cccc2s1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 918670573 JUNTYUWJUVTEMP-RKDXNWHRSA-N 399.331 5.243 30 20 GKED C=CCC1(C(=O)O)CCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)CC1 1776157950 CVUURBDLZQPMCC-HXUWFJFHSA-N 387.882 5.311 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(C(F)F)c1F 1776355357 BUICCTORVPYIDU-SOFGYWHQSA-N 378.346 5.145 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](Cc2ccccc2)C(=O)O)c1 1776788658 HTTYEGGNWAXGGY-QFIPXVFZSA-N 383.532 5.069 30 20 GKED CCCCCCCOc1cccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)c1 1776788971 HOBNZMMUOLKDCI-VPULJAIHSA-N 392.495 5.874 30 20 GKED O=C(/C=C/c1ccc(C(=O)O)s1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1777569811 NGEVALOYHRDETA-HNQUOIGGSA-N 394.292 5.380 30 20 GKED Cc1sc2ncnc(N/N=C3/C(O)=Nc4c(Cl)cc(Cl)cc43)c2c1C 20791488 AXSUROZXFQWWAQ-UHFFFAOYSA-N 392.271 5.033 30 20 GKED O/C(=N\c1nnc(SCc2ccccc2)s1)c1sccc1-n1cccc1 29644709 SEJHQFNLUIZPFL-UHFFFAOYSA-N 398.538 5.319 30 20 GKED N#C[C@@H](C(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)c1ccccn1 41481760 KFWPOOWSGMBIJN-GOSISDBHSA-N 383.382 5.033 30 20 GKED Cc1noc(C)c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41537942 XVLUQYXBDCQTIM-LBPRGKRZSA-N 392.267 5.212 30 20 GKED N#C[C@@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc2ccccc2n1C(F)F 41559000 CDGMZVXPOQAALD-INIZCTEOSA-N 392.409 5.112 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)cc1C 58783154 UOYDJTVUKVZWFA-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)[C@H](C)C(C)C 65414411 BVSNGXZDEKPGCI-GOSISDBHSA-N 379.504 5.230 30 20 GKED O/C(Cc1ccc(OC(F)F)cc1)=N\c1nc(-c2cccc3ccccc23)n[nH]1 65514854 IAVARTGJMVLFIZ-UHFFFAOYSA-N 394.381 5.057 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCc1c[nH]c2ccccc12 66954359 RHPPVCMUPFIZEI-INIZCTEOSA-N 392.528 5.316 30 20 GKED C[C@H](OCC1CC1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 68336632 MQYHCHASXFDBJA-HZMBPMFUSA-N 395.311 5.108 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)n1 68721815 SYFUGJMFFCYBNY-SNVBAGLBSA-N 394.308 5.372 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(Cc2ccccc2)CC1 108532732 UVVJHXOOKIZCJJ-GOSISDBHSA-N 393.556 5.425 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1F 109039534 WGWVVICXZLMEDQ-DGCLKSJQSA-N 386.398 5.207 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cc(Cl)cs3)n2)cc1 131115464 DMXVIOLNNAGTMQ-INIZCTEOSA-N 397.912 5.206 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CN(CCC#N)CCC(C)C)cs1 173547529 CPEHOUXRJCYXDC-UHFFFAOYSA-N 398.576 5.206 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3cccs3)Cc3cccs3)cc2)CC1 182509032 GEAPHAFZRGJBHO-UHFFFAOYSA-N 378.522 5.207 30 20 GKED C[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1cn(C)c2ccccc12 185352008 FEORJPALZHJRCP-CVEARBPZSA-N 377.513 5.172 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1sc(CC)nc1C 191516780 GCXQMPJMZGQJLF-MRXNPFEDSA-N 385.577 6.091 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)s1)c1nc(-c2ccc(Cl)cc2)cs1 301768199 ZKUGCTRHCAQGKZ-LLVKDONJSA-N 379.293 5.668 30 20 GKED N#Cc1ccsc1C(=O)Nc1nc2ccc(Oc3ccccc3)cc2s1 303048658 RFKKGPAZVKIGAU-UHFFFAOYSA-N 377.450 5.274 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1CC1CCCCC1 303370427 JWCPZGYFUNFPLW-MJGOQNOKSA-N 385.577 5.905 30 20 GKED O=C1CCCc2ccc(N=C(O)c3cc4sc(N5CCCC5)nc4s3)cc21 330002600 BDGMNTXJLVAAND-UHFFFAOYSA-N 397.525 5.113 30 20 GKED CC(C)[C@@H]1CCc2c(sc(NC(=O)c3ccoc3C(F)(F)F)c2C#N)C1 411006966 LKGVDERSFDTPOI-SNVBAGLBSA-N 382.407 5.245 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc([N+](=O)[O-])c(OC(C)C)c1 413748512 NLOGRUWUNKUIOU-UHFFFAOYSA-N 382.460 5.486 30 20 GKED C=C(C)C(C)(C)C(=O)N(CC)CCCC1CCN(C(=O)C(C)(C)C(=C)C)CC1 424747495 MYKJZUHTGYYMMR-UHFFFAOYSA-N 390.612 5.058 30 20 GKED CCO[C@H](C)c1nc(CN(Cc2cccc(C(F)(F)F)c2)[C@@H](C)C#N)cs1 425541842 XKADDFUQJXOHNC-UONOGXRCSA-N 397.466 5.174 30 20 GKED Cc1c([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 431857353 LGPIASYNIULPAB-PXNSSMCTSA-N 375.472 5.537 30 20 GKED CCN(C(=O)c1cc(C#N)oc1C)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 435455817 YPRIYVJDRMRKBE-HSZRJFAPSA-N 387.483 5.230 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccccn2)c1 438655434 KDOICJYPOAIQAD-VXKWHMMOSA-N 398.466 5.178 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3ccc(F)cc3)C3CCCCC3)o2)cc1 441174948 KFWJQBPERUEAEJ-UHFFFAOYSA-N 390.462 5.082 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441533316 MONFGHOHAFLAOC-BEFAXECRSA-N 391.437 5.510 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H]3Cc3ccccc3)cc2)cc1 443859538 NUWIOYRYSBZMOM-OAQYLSRUSA-N 383.451 5.199 30 20 GKED N#CCCCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 464185271 MCEWUNFCDFVXIR-UHFFFAOYSA-N 377.494 5.301 30 20 GKED CCO[C@@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1=CCCC1 465121431 NHTAYVGFRLOIHE-QFIPXVFZSA-N 376.456 5.195 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccccc3SC[C@@H](C)C#N)c[nH]c2c1 465129045 RPKDBNTXDMMAPA-INIZCTEOSA-N 377.513 5.299 30 20 GKED Cc1occc1-c1nnc(SCc2ccc(F)c(C#N)c2)n1-c1ccccc1 468651252 KQMZCUCAZRNTOU-UHFFFAOYSA-N 390.443 5.139 30 20 GKED COc1cccc([C@H](C)CCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 469247149 PWZQSNOYDAXEMI-ZWKOTPCHSA-N 396.556 5.859 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 474739014 UUZZPQOWGQPKPU-CYBMUJFWSA-N 396.368 5.049 30 20 GKED N#CC[C@H](CC(=O)N1CCc2ccccc2[C@@H]1c1ccccc1)c1ccccc1 475763019 PQMUBRBFKWUMPH-BVAGGSTKSA-N 380.491 5.248 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)CSCc3ccc(C#N)cc3)c2)o1 477548398 JHRBMKOMSYLUEC-UHFFFAOYSA-N 376.481 5.307 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1 486256141 XIOVESMMWLJYAW-UHFFFAOYSA-N 394.540 5.280 30 20 GKED N#CCCN(C(=O)c1cncc(-c2ccccc2)c1)C12CC3CC(CC(C3)C1)C2 486567727 RXXOJDGFVUDXHV-UHFFFAOYSA-N 385.511 5.073 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 503138512 KGTIYSSVTMHTPU-APWZRJJASA-N 380.513 5.085 30 20 GKED Cc1ccc2c(CCC(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)c[nH]c2c1 505327525 VXTKGKKCPHPWSP-SFHVURJKSA-N 386.282 5.097 30 20 GKED Cc1ccc(-c2nc(CCNC3CCC(C#N)(c4ccccc4)CC3)co2)cc1 507596801 PTAKBXUHMNFKRZ-UHFFFAOYSA-N 385.511 5.186 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cscc1Br 511702070 TVVHDPUSKRUWNT-JTQLQIEISA-N 381.320 5.157 30 20 GKED CCc1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cnn1C(C)(C)C 517841073 FTVPUZOILDOWRK-UHFFFAOYSA-N 388.471 5.117 30 20 GKED C=CCN1CCC(NC(=O)N(CCC)[C@H](C)c2ccc(Cl)c(Cl)c2)CC1 518531282 SBDSRDNFFFIJKD-OAHLLOKOSA-N 398.378 5.126 30 20 GKED C[C@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520596443 KWYAGQSXUTWXGD-MRXNPFEDSA-N 375.428 5.086 30 20 GKED Cc1ccc(-c2csc(C(=O)N3CCC(C)(C#N)CC3)c2-n2cccc2)cc1 521701979 QHKFECMUNQVROL-UHFFFAOYSA-N 389.524 5.280 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1OC1CCCC1 521859836 VFZWTYYTYLRWFO-UHFFFAOYSA-N 391.515 5.570 30 20 GKED CC(C)n1cc([C@@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cn1 522133462 LNKYHAFYYREUNA-MRXNPFEDSA-N 389.459 5.011 30 20 GKED C=CCCCN(C)C(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 522951272 XEMGZELJDWZHFH-UHFFFAOYSA-N 376.283 5.263 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3c[nH]nc23)cc1Cl 524706786 KDBPAJVDVJRPDJ-IBGZPJMESA-N 386.842 5.124 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1 525285861 HQTWSIPVIMAFRB-LBPRGKRZSA-N 395.311 5.263 30 20 GKED Cc1cccc(N(CC(=O)Nc2ccccc2S[C@H](C)CC#N)C(C)C)c1 532683353 UFQDNZRAIHERNT-GOSISDBHSA-N 381.545 5.243 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(NC(=O)c2cccs2)c(C)c1 535372873 RYYQITKLZKRFCU-UHFFFAOYSA-N 390.508 5.137 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 535436882 MVBIQVPUSVRWJM-FUHWJXTLSA-N 378.447 5.033 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C4(C#N)CC4)cc3)n2)cc1 537477264 FVFBLGYLTULGAD-LJQANCHMSA-N 383.476 5.164 30 20 GKED C=C(C)[C@@H](NC(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(F)c(F)c1 554961260 GGTTZDGKRCLNKY-YCRPNKLZSA-N 385.454 5.341 30 20 GKED CC(C)CCc1ccccc1NC(=O)C1CCN(c2ccc(C#N)cc2F)CC1 560467747 PZWBLSWFRPKMSX-UHFFFAOYSA-N 393.506 5.141 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(CCC(F)(F)F)cc1 561238366 PVPYIMYRLCNLNQ-UHFFFAOYSA-N 393.453 5.177 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OCCC)cc1C 563894922 QAHQPQXVGDCCSQ-UHFFFAOYSA-N 384.524 5.171 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)cc1 563999442 HZIHKNKEABZVJT-UHFFFAOYSA-N 388.298 5.471 30 20 GKED C=C[C@@H]1OCC[C@H]1C(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 569793932 NNHVTHGKMKSIFX-DOMZBBRYSA-N 396.537 5.043 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)CC1 570330358 ZDIZPWFPODBGSN-IBGZPJMESA-N 389.421 5.169 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1 580766842 KLBUEBOWWFKAHU-KRWDZBQOSA-N 386.455 5.013 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cc(Cl)cc4cccnc34)cc2)ccn1 582753719 DUOQZUQOYFXSND-UHFFFAOYSA-N 386.842 5.559 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cccc4ncccc34)no2)c2ccccc21 585731237 HEJVAGQXXZMJFK-VAWYXSNFSA-N 391.434 5.324 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H]2CC[C@@H](C1)S2 599729277 WGPXMHCTZNKMCQ-UXHICEINSA-N 393.512 5.161 30 20 GKED CC[C@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 600002775 WVNUNJQQOVZLRP-HOTGVXAUSA-N 395.528 5.029 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2ccco2)c2cccc(Cl)c2)cc1 603739406 ZCAJQAUAUHXEEE-UHFFFAOYSA-N 396.899 5.271 30 20 GKED N#Cc1c(NC(=O)CCSc2ccccc2)sc2c1-c1ccccc1CC2 603992285 PFGTVEAGIZCOJC-UHFFFAOYSA-N 390.533 5.506 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccccc1F 608847110 DXKWRTRPSUDPSD-HNNXBMFYSA-N 375.403 5.017 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 609428266 HZGPDQDLLDNRNV-KRWDZBQOSA-N 384.570 5.819 30 20 GKED COc1ccc([C@H](Nc2nc(C(F)(F)F)ccc2C#N)c2ccccc2)cc1 609669453 MVSOFTOITNLKRM-LJQANCHMSA-N 383.373 5.182 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(OCCCC#N)c1 609968657 XNFQMLKNRKLPOG-OAHLLOKOSA-N 390.405 5.205 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1C(F)(F)F 610228155 ORMQUGDARBIDJT-KGLIPLIRSA-N 392.446 5.842 30 20 GKED N#C[C@H](C(=O)c1cc2ccsc2[nH]1)c1nc(-c2ccc(Cl)cc2)cs1 613319881 OQAVDBNUZSRPDN-CYBMUJFWSA-N 383.885 5.496 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 618754196 LBKUUHSKFNLEDT-MRXNPFEDSA-N 395.331 5.021 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cc(F)ccc1Cl 622485348 LLLJMXXZXOGOIO-ZDUSSCGKSA-N 399.693 5.531 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC2(CCCC2)C1 646439206 WLBARFOMTOYXNQ-UHFFFAOYSA-N 398.322 5.384 30 20 GKED COc1ccc(C(=O)/C=C\c2c(Cl)ccc(Cl)c2Cl)cc1NC(C)=O 726430563 ZICYYKJNCBLXAT-DAXSKMNVSA-N 398.673 5.510 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1c(Cl)nc2ccccn12 727780873 VPJVQUWIYWOOIE-KHPPLWFESA-N 379.872 5.316 30 20 GKED O=C1/C(=C\c2csc(-c3ccc4c(c3)OCO4)n2)Cc2c(Cl)cccc21 728439713 DXFGVQATVGHSBB-SDQBBNPISA-N 381.840 5.015 30 20 GKED N#C[C@H](C(=O)CCSc1ccc(Cl)cc1)c1nc2cc(F)ccc2s1 730416128 ASTXFWAEMGQPPE-CQSZACIVSA-N 390.892 5.447 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCOc3ccccc32)cc1 731280662 SNKNAIIETQRLNA-NFBKMPQASA-N 397.478 5.030 30 20 GKED C=CC[C@H](NCc1ccc(OCc2cccs2)c(OC)c1)c1ccncc1 734510497 WIFNCVGRCUFIMA-FQEVSTJZSA-N 380.513 5.138 30 20 GKED C=CC[C@H](NC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)c1ccncc1 734664836 SRHHUIHUCGELAQ-NRFANRHFSA-N 393.437 5.066 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2cccc(F)c2)cc1 734964673 YVGIPSTXPMRBOK-IIBYNOLFSA-N 380.463 5.009 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 739181518 SJACYQNDZBDGFW-ZDUSSCGKSA-N 395.390 5.028 30 20 GKED Cc1nc(CCC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)cs1 741920928 OLADHECFFOLGSH-UHFFFAOYSA-N 395.915 5.143 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743092810 DQCKZNQZFDCIES-LAUBAEHRSA-N 381.545 5.337 30 20 GKED C=CC[C@H](NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1ccncc1 754037240 YPEYAQFEMUZKGZ-SFHVURJKSA-N 391.298 5.175 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1c(-c2ccccc2)nc2sccn12 754711939 DJLCZNNAPDRJNE-UHFFFAOYSA-N 387.386 5.495 30 20 GKED N#C[C@H](C(=O)Cc1ccc(F)c(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 756245913 ZJTKUOZVOZCBDL-LLVKDONJSA-N 396.340 5.012 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1)c1ccccc1 759051889 SFKMQVPZKUHSLO-SFHVURJKSA-N 380.488 5.010 30 20 GKED COc1cc(/C=C/C(=O)c2c[nH]c3ncccc23)ccc1OCc1ccccc1 761817918 PIAFJOMCYJMWHS-PKNBQFBNSA-N 384.435 5.047 30 20 GKED CC(C)(C)c1ccc(CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 762996960 SZNAYOQSFARMJQ-MRXNPFEDSA-N 381.426 5.148 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccccc2)c2ccccn2)cc1 764568440 JKZXCEGIFXZFLJ-FDDCHVKYSA-N 378.903 5.653 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1cncc2ccccc12 764980446 DSRRYPIDXBMSQS-UHFFFAOYSA-N 391.474 5.272 30 20 GKED Cc1cc(CNc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)ccc1C#N 767685861 LAZXFMZZHRSPAB-UHFFFAOYSA-N 377.488 5.167 30 20 GKED CN(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1F 770105558 FDAJPBLITREVNA-HNNXBMFYSA-N 399.878 5.159 30 20 GKED O=C(/C=C/c1cc(Cl)cs1)c1ccc(S(=O)(=O)C2CCCC2)cc1 782341835 LTPXKMTZUVRYTN-JXMROGBWSA-N 380.918 5.014 30 20 GKED Cc1noc(-c2ccc(N[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)nc2)n1 782378437 OQBSCCLDSHWEKV-HNNXBMFYSA-N 381.439 5.152 30 20 GKED CC(C)(C#N)CCCOC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 783357836 IXMZLPMKEQAPGR-UHFFFAOYSA-N 382.407 5.316 30 20 GKED Cc1cc(Br)ccc1CN[C@H](c1cccc(C#N)c1)C(F)(F)F 783671850 LUQVFYMLEZVHRJ-MRXNPFEDSA-N 383.211 5.022 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCOCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 786310867 FCTPEBURCNIKBY-BXUZGUMPSA-N 395.311 5.110 30 20 GKED COc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cc1OCc1ccncc1 795810102 GRXXDXIDCSPVTH-QHCPKHFHSA-N 399.494 5.420 30 20 GKED N#Cc1cccc(COc2ccc(N[C@H]3CCCC34CCOCC4)cc2F)c1 800519068 JUVIUFOFNAKRID-QFIPXVFZSA-N 380.463 5.038 30 20 GKED N#Cc1ccc(/C=C\C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 811685047 IDPBIUVZQJFWKN-XQRVVYSFSA-N 380.709 5.035 30 20 GKED COc1cc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)ccc1SC(F)F 841762952 SOZNCTCPNUYFQE-FZKQIMNGSA-N 388.483 5.610 30 20 GKED O=C(CON=Cc1ccc(Cl)cc1)Nc1cc(C(F)(F)F)ccc1Cl 854278629 ZXRMJYSALZBOLA-UHFFFAOYSA-N 391.176 5.001 30 20 GKED N#CCCCOc1cccc(NCc2cc(Cl)cc(Br)c2)c1 864006778 YRWSHAYQODHJJA-UHFFFAOYSA-N 379.685 5.397 30 20 GKED C=C[C@H](Cc1nc(-c2cccc(OCc3cccnc3)c2)no1)c1ccccc1 904507142 YONNPPSCKBJENL-LJQANCHMSA-N 383.451 5.223 30 20 GKED CC(=NNc1nnc(-c2ccccc2)n1C)c1ccc(Cl)c(Cl)c1Cl 915968789 YCGLJDUHBWOEGX-UHFFFAOYSA-N 394.693 5.278 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(OCc3cccc(C#N)c3)c2)c(F)c1 915984275 VGXCPZCDNVJBLG-DHZHZOJOSA-N 387.410 5.181 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccccc3Cl)n2)cc1 916627251 IBJVHRYNGJTCGG-QXPKXGMISA-N 378.884 5.662 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)cc1)c1nc2cc(Cl)ccc2s1 917046684 MEEYPISFVWVEEI-CQSZACIVSA-N 375.280 5.412 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2c(s1)CCCCCC2 920102135 QBMPOENIOOZUBT-QGZVFWFLSA-N 390.508 5.402 30 20 GKED CCCCCCCCCCC(=O)N1CCC(C(=O)N2CCc3ccccc32)CC1 920813050 XBRDONRQKYRNDM-UHFFFAOYSA-N 398.591 5.345 30 20 GKED O=C(O)c1cccc(NN=Cc2cccc(OCc3ccc(Cl)cc3)c2)c1 1776038494 MNBMAKYPMIXKGL-UHFFFAOYSA-N 380.831 5.063 30 20 GKED C=CC[C@]1(C(=O)O)CCCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 1776154588 MFQGWAFRPVBRSL-IRLDBZIGSA-N 387.882 5.311 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)c1 1776341403 DFLJAIAHHXRYKO-NTCAYCPXSA-N 384.475 6.146 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc(SC)c(C(=O)O)c2)cc1 1776786619 LJOQTIPXRCDGNP-UHFFFAOYSA-N 399.556 6.262 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4c(F)cccc4C3=O)s2)c1 1777684356 VAAFIJAXFSRUCP-OWBHPGMISA-N 378.424 5.465 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCCOc2ccc(Cl)cc2Cl)cc1 29150719 GHBXANLAFCINPM-UHFFFAOYSA-N 391.298 5.592 30 20 GKED Cc1ccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c(Cl)c1 31812465 AYJUVIZNPVAZAU-UHFFFAOYSA-N 376.843 5.351 30 20 GKED COc1ccccc1/C=C(/C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1ccccc1 54735256 GLJQPEMKZKMGGS-ZWUNQBBJSA-N 394.430 5.253 30 20 GKED C=CCOc1cccc(N[C@@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)c1 62238461 JKCNBOKRTPIXLX-HSZRJFAPSA-N 388.467 5.052 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCCOc2ccc(F)cc21 65418951 VCNAAFVYNJYLCR-QFIPXVFZSA-N 386.426 5.008 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1csc(CCC(C)C)n1 109168126 IVDUEHCWGIFDHS-UHFFFAOYSA-N 398.601 5.392 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Oc1ccc(F)cc1Cl 112818387 YRRGRLBBDAEIHA-STQMWFEESA-N 392.883 5.279 30 20 GKED C[C@@H](C(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(C(=O)c2ccccc2)c1 120269717 QDIRIZIJTKZFRT-DVECYGJZSA-N 396.490 5.182 30 20 GKED Cc1nnc(-c2cccc(NCc3cccc(OCc4cccc(C#N)c4)c3)c2)o1 151013745 IPQDIMZYVIJJOW-UHFFFAOYSA-N 396.450 5.108 30 20 GKED CO[C@@H](C)c1nc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)cs1 177516990 CMKBIXDTMHKRKF-ZDUSSCGKSA-N 383.448 5.266 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cnn1C(C)C 179909892 MDPGXUMXJBKKNM-LJQANCHMSA-N 392.890 5.334 30 20 GKED CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)CCO1 245526404 APGZYCGXGWBSHG-AYBZRNKSSA-N 389.565 5.044 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(Cl)cc2)cc1 255942281 HGEHYHHDKPTGAM-UHFFFAOYSA-N 378.884 5.756 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@@H]3CCSc4ccccc43)c2)cc1 303205705 PQKWLGAVBCVUGY-OAQYLSRUSA-N 386.476 5.317 30 20 GKED N/C(=N/Cc1coc(-c2ccccc2)n1)Nc1cccc(Oc2ccccc2)c1 304760346 SGDLRNPEAQZBSI-UHFFFAOYSA-N 384.439 5.061 30 20 GKED Cc1nc(C2CC2)oc1C(O)=Nc1cc(C(F)(F)F)ccc1N1CCCCC1 329802436 ZCIAAHMNZJPLLB-UHFFFAOYSA-N 393.409 5.506 30 20 GKED Cc1ccnc2[nH]c([C@@H](C#N)C(=O)c3ccc(-c4ccc(Cl)cc4)s3)nc12 429564666 POVDKGFFNKIXTF-AWEZNQCLSA-N 392.871 5.138 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(C(F)(F)F)ccc1F)c1ccccc1 432873135 QDXWHWNZBKTPJY-INIZCTEOSA-N 379.357 5.401 30 20 GKED N#CCCC[C@@H](NCC(=O)N[C@@H](c1ccccc1)C1CCCC1)c1ccccc1 433020660 OIZJXWGJFPEXLJ-NOZRDPDXSA-N 389.543 5.059 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(NC(=O)CC)ccc1Cl)c1ccccc1 435654793 LGIYZZQZTNATJQ-GOSISDBHSA-N 385.895 5.518 30 20 GKED C=CCCCN(C)C(=O)Nc1ccnc(Oc2ccccc2Br)c1 438381210 UJEVAIORXCXUEF-UHFFFAOYSA-N 390.281 5.066 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)N(C)Cc3ccc(C#N)cc3)cn2)c1C 438391575 LAJBXFBQFKJDQM-UHFFFAOYSA-N 386.455 5.026 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 443871194 WXYITPAZFBJTHM-UHFFFAOYSA-N 390.414 5.449 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1 450883750 QNBDBTLVGKLDET-CXAGYDPISA-N 384.892 5.024 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1C 458795932 DJXUCAACQOQELK-XZOQPEGZSA-N 375.516 5.585 30 20 GKED C[C@H](C(=O)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 462543564 AKYDUZXGMCADSG-QMIHWGKISA-N 386.417 5.133 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 463656933 SVEOPGXFMQHOTO-UHFFFAOYSA-N 376.387 5.141 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 463768734 MAVDNQGNUDLIBB-AWEZNQCLSA-N 394.327 5.411 30 20 GKED Cc1cc(Br)cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 464414488 KXLCNSUHMZEJGQ-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464477111 RIZVEQOIEJVGFY-CYBMUJFWSA-N 377.753 5.034 30 20 GKED CC[C@](C)(NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1nccs1 464968426 ZYYMDBUYQLXTHR-QFIPXVFZSA-N 391.496 5.171 30 20 GKED Cc1ccccc1-c1noc([C@@H](C)Sc2nc3c(cc2C#N)CCCC3)n1 466633257 MJLDDPRMCDGQGZ-CQSZACIVSA-N 376.485 5.044 30 20 GKED C=CCC(CC=C)C(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 467738038 QTTIZWLIUFHWFM-JOCHJYFZSA-N 388.511 5.193 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc2c(s1)CCCC2 468754180 AEUTXVQZMLKLRQ-INIZCTEOSA-N 393.556 5.383 30 20 GKED CC(C)Cn1ncc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1C(C)C 469728360 JYQBWZBDTYJZJU-UHFFFAOYSA-N 391.519 5.173 30 20 GKED C=CCN(C(=O)[C@H](C)SC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 476130100 CHXFIZFSNZMPPM-JTQLQIEISA-N 387.357 5.387 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)c1 483198152 MRIVDDMBVGQOIT-HXUWFJFHSA-N 393.446 5.186 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F 485747236 WKYUISSGNKVYBA-CYBMUJFWSA-N 387.455 5.201 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@@H]1CCCC[C@@H]1C 497798211 GTDSWSIXJBILHU-GAJHUEQPSA-N 394.490 5.134 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCCCCO[C@H]1CCC[C@@H](C)C1 499297368 YGACTBNNUKUJHM-OFNKIYASSA-N 384.564 5.451 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(F)ccc(C)c1F 499725873 NQJBIWCHZIEVJA-UHFFFAOYSA-N 392.405 5.285 30 20 GKED Cc1ccc(-c2nc(C(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)cs2)o1 499845950 YPRDPBBDTKURSW-GFCCVEGCSA-N 392.267 5.013 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 501461144 HVGQMEOVSBTGQN-INIZCTEOSA-N 390.439 5.160 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)c1 502375016 OCXSORDCEQXVDY-OAQYLSRUSA-N 378.834 5.065 30 20 GKED C[C@@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(-c2cccc(C#N)c2)cc1 509008238 XSGLGVWAIICMNQ-CQSZACIVSA-N 393.393 5.262 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)Nc3ccc(-c4ccccc4)cc3)CC2)cc1 509067700 WOECVHBPCATEOS-UHFFFAOYSA-N 397.478 5.301 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1noc(-c2ccsc2)n1 510205385 HAQFEBOBSWRIRZ-UHFFFAOYSA-N 376.466 5.024 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 513553356 GYYWTJUNWWROBD-UHFFFAOYSA-N 381.307 5.381 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 513877349 YDQHQYTVBUVAMG-UHFFFAOYSA-N 391.496 5.855 30 20 GKED C=CCN(C(=O)CCC1CCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514301734 HHKOZQGTLQXOFC-UHFFFAOYSA-N 385.489 5.208 30 20 GKED C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NCc1ccc(C#N)cc1F 515659236 CIOOEYWERRZCJC-GJZGRUSLSA-N 399.897 5.366 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccccc1Br 518146914 OAMIDOJHVUDNBZ-KBPBESRZSA-N 375.335 5.874 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(Cl)c(Cl)c1 518660960 MRKGGUSRMJQPSD-GFCCVEGCSA-N 394.327 5.296 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnn(-c3ccccc3)c2C(C)C)n1 530614126 IJZXQBRCFZSURJ-MRXNPFEDSA-N 378.501 5.066 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cccc1-c1ccccn1 535871488 JMZXIAVHTQQKPY-LJQANCHMSA-N 396.475 5.066 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3cccnc3)c3ccc(Cl)cc3)cc2)CC1 537433166 PWEJVXXXGQYKEM-UHFFFAOYSA-N 387.870 5.137 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(C(F)F)c2Cl)c1 541646452 MVBUZMVTNKZJCR-UHFFFAOYSA-N 378.806 5.337 30 20 GKED COc1ccc(CN(C)C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542084966 MVBKUVQWPPYWSV-SFHVURJKSA-N 399.494 5.136 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)oc2c1C(=O)CCC2 543857013 SRDSARQARBNUBW-INIZCTEOSA-N 398.462 5.137 30 20 GKED C[C@@H](NCCc1nc2ccccc2n1C)c1ccc(-c2cccc(C#N)c2)cc1 543872524 ANHGYUGWBCUWSF-GOSISDBHSA-N 380.495 5.005 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)sc2ccc(C#N)cc12 550453329 NBKNDAIHCHOTMZ-UHFFFAOYSA-N 377.494 5.339 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N(C)[C@H](C)c1cccs1 554925023 PGORGZAHIARMQU-CABCVRRESA-N 386.496 5.002 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1F 566554483 BLPJDTZXYFPVCO-HNNXBMFYSA-N 375.403 5.017 30 20 GKED C=CCn1c([C@H]2CCO[C@@H]2C(C)(C)C)nnc1N1CCCC[C@@H]1c1ccccc1 567314078 XKFXNXFUXGMAEE-HBMCJLEFSA-N 394.563 5.114 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N(C)CCOCc1ccc(C#N)cc1 571598577 RNCOZHXGQRWUSB-UHFFFAOYSA-N 399.494 5.214 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 590942452 JOSCRVANYBEFKG-IBGZPJMESA-N 389.421 5.282 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F 592156185 JOCSPOWHLXEPRJ-LJQANCHMSA-N 389.396 5.501 30 20 GKED Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)CCCCC#N)nc2c1 593947225 QNHLWWCPIXAIRK-UHFFFAOYSA-N 377.513 5.530 30 20 GKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 596733760 VGSWQBCLZCYMTA-AZUAARDMSA-N 393.556 6.067 30 20 GKED Cc1ccc([C@@H](C)N(C(=O)CC2(C#N)CCOCC2)c2cc(C)ccc2F)cc1 598827921 KTGUULZCZYPDFM-LJQANCHMSA-N 394.490 5.247 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(C(F)(F)F)CCCC1 599737741 PAPFJUXZSUUINP-CYBMUJFWSA-N 385.455 5.325 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(COC2CCCC2)cc1 606968753 OIAUYCNIQIHPQP-UHFFFAOYSA-N 394.515 5.375 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c(F)c1 609252932 JOXGCXZWPHYEJW-IBGZPJMESA-N 399.878 5.001 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccccc1 609398416 ZXZJEYAKJUPEAA-MJGOQNOKSA-N 379.529 5.177 30 20 GKED CSCc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccccc12 609428281 JETWRETZBBIXOZ-AWEZNQCLSA-N 396.537 5.942 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609428559 UTMFDIFNRGMATR-CABCVRRESA-N 388.920 5.449 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCc2ccc(Cl)o2)c1 609731250 UONVIYIGOGWGGQ-UHFFFAOYSA-N 387.222 5.180 30 20 GKED CC[C@@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1nccs1 609982375 SEKDEIDDVYOHGB-QGZVFWFLSA-N 397.887 5.342 30 20 GKED N#Cc1ccccc1CNc1ccc(Oc2nncc3ccccc23)c(Cl)c1 611028581 AMFUSISLWWPPKV-UHFFFAOYSA-N 386.842 5.559 30 20 GKED N#Cc1ccc(CSCc2nc(C(F)(F)F)cs2)c(Br)c1 611496806 GVNLSMMCKGGMDE-UHFFFAOYSA-N 393.253 5.229 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N[C@@H](C)c1cccc(C#N)c1 611752592 HACAMOIFYWPVGO-LBPRGKRZSA-N 399.372 5.032 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 614179532 RCYQLOOKWKGULM-IBGZPJMESA-N 384.523 6.014 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 620567652 DBECQIUPLKICFL-CQSZACIVSA-N 395.528 5.090 30 20 GKED C=C(C)COc1cc(CNc2cccc(NCC(F)(F)F)c2)ccc1OC 630068892 BSCUTJNRQSXSCQ-UHFFFAOYSA-N 380.410 5.236 30 20 GKED Fc1ccccc1-c1csc(N2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)n1 645037814 YANBQJVFRGCMGO-AOOOYVTPSA-N 384.320 5.126 30 20 GKED N#C[C@H](C(=O)c1ccc(C2CC2)cn1)c1nc2cc(C(F)(F)F)ccc2s1 674893624 ABMKWDWDFRKBCT-CYBMUJFWSA-N 387.386 5.078 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 684227562 BDRFZNOQGMQMDH-KCJUWKMLSA-N 390.274 5.145 30 20 GKED COc1cccc(NN=Cc2c(C)nn(Cc3ccccc3Cl)c2Cl)c1 725853499 SBQWFJRDUYRGDR-UHFFFAOYSA-N 389.286 5.001 30 20 GKED C=CCn1c(-c2ccco2)nn(CNC2(c3ccc(F)cc3)CCCC2)c1=S 727166713 ZJFBSSLZLXZSCW-UHFFFAOYSA-N 398.507 5.016 30 20 GKED C#Cc1ccc(C(=O)N(Cc2cccc(F)c2)[C@H](CC)c2ccc(F)cc2)nc1 728815761 QDXVKSGQNYPYOW-HSZRJFAPSA-N 390.433 5.135 30 20 GKED Cc1ccccc1OCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 729552491 HBXGGUUHDPTLAB-HSZRJFAPSA-N 399.494 5.241 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)c1 729644219 STARFPIPMBWJBV-OUKQBFOZSA-N 383.447 5.515 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1csc2ccccc12 730067963 JDPYEINWIDLPKA-HNNXBMFYSA-N 395.484 5.268 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(CCc1ccccc1)C1CC1 731400013 KELPMQYPVAYRAX-QGZVFWFLSA-N 379.529 5.320 30 20 GKED C[C@H](CC1CCCC1)C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 734079502 RBTLZJOQRBYFQT-YLJYHZDGSA-N 390.483 5.343 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](Cc2ccccc2)C2CC2)cc1 736955108 FCWTWEKQQUWKHH-RPBOFIJWSA-N 395.506 5.485 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1 741638236 IHIBEAAJXNXRKB-UHFFFAOYSA-N 395.455 5.136 30 20 GKED COc1ccc(CN[C@@H](c2ccc(C(C)C)cc2)c2cccs2)cc1C#N 742366545 JJBRVLYYZIPIJU-QHCPKHFHSA-N 376.525 5.631 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Oc3ccc(F)c(F)c3)n2)cc1 744936593 TZKLOUONMSDOOO-CZUORRHYSA-N 398.434 5.041 30 20 GKED Cc1ccccc1[C@@H](OC(=O)[C@H](C)Oc1ccccc1C#N)c1cccs1 748501221 AMTGOZXIBVGFDF-HRAATJIYSA-N 377.465 5.028 30 20 GKED CN(C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)c1ccc(C#N)cc1 749150338 KHZDYZSLDKPSBB-UHFFFAOYSA-N 381.410 5.189 30 20 GKED C[C@@H](C=Nn1cnnc1SCc1ccc(Cl)cc1)CCc1ccccc1 749158979 VRZXSFCBDKFUCM-MRXNPFEDSA-N 384.936 5.327 30 20 GKED C[C@@H](OC(=O)C1CC(F)(F)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 753811718 VABBMAJXIBKTHX-SSDOTTSWSA-N 376.243 5.374 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(O)c(Cl)c2)cc1 770834762 PBGFKFXVPBPWRY-QGZVFWFLSA-N 380.806 5.092 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 775871469 TVHVFUINMLZJCA-SNVBAGLBSA-N 383.757 5.294 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 776818572 BLFYWGYNMBJLFU-QFIPXVFZSA-N 399.881 5.243 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)c1 780526677 IHVPULPYBWDMEK-KRWDZBQOSA-N 382.813 5.330 30 20 GKED C[C@H](NC(=O)C12CC(C(F)(F)F)(C1)C2)c1ccc(-c2cccc(C#N)c2)cc1 787254962 ORUQEFDSNZVQKL-YJPTXTSQSA-N 384.401 5.135 30 20 GKED N#C[C@@H](C(=O)C1c2ccccc2Oc2ccccc21)c1nccc2ccccc12 792100402 DTSMTYAHNDDOEJ-HXUWFJFHSA-N 376.415 5.349 30 20 GKED FC(F)(F)CCCCNC(=S)Nc1ccc(C(F)(F)C(F)(F)F)cc1 794977672 GAWZFIGULCBUEZ-UHFFFAOYSA-N 394.331 5.360 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCOc2ccc3ccccc3c2)s1 797572789 ILDJBJKEVYACDU-GOSISDBHSA-N 378.497 5.239 30 20 GKED COc1cccc2cc(/C=C3\CC/C(=C\c4cccc([N+](=O)[O-])c4)C3=O)oc12 818240182 IMVWDQWSIRYTAU-NCZFFCEISA-N 375.380 5.180 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ncc(Cc2cccc(Cl)c2)s1 827419907 IKNFELZYPCOTNB-UHFFFAOYSA-N 399.928 5.255 30 20 GKED Cc1nc(CSc2ccccc2C(=O)OCc2cc(C#N)ccc2F)cs1 841994683 NYXFVZKWNIWGTI-UHFFFAOYSA-N 398.484 5.112 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@]4(C3)CC4(F)F)c2)cc1 844530419 DYWBJRKXWSSBOJ-HXUWFJFHSA-N 383.398 5.004 30 20 GKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1cccc([N+](=O)[O-])c1 916136630 YNZXOBYXRIPQSR-NTMALXAHSA-N 376.393 5.361 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2ccc(C)cc2)cs1 916250177 PLAUTFKRDMXWBN-UHFFFAOYSA-N 384.892 5.236 30 20 GKED CCCCC[C@@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 916720849 RBUFRWREXUQOCJ-GOSISDBHSA-N 379.504 5.422 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1cc2c(s1)CCCCCC2 916882938 MLRAJALORWPOKI-INIZCTEOSA-N 386.904 5.022 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3[nH]c(C)c(C)c3c2)cc1 916947008 CSFPDTNDJVVIAJ-SPLOXXLWSA-N 387.483 5.259 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c2cc1C 917043396 IGOTWHIYEJUZOS-MRXNPFEDSA-N 394.883 5.732 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc3ccccc3c2)c(-c2ccc([N+](=O)[O-])cc2)n1 920063066 XKBCTNHJPLWFPT-RAXLEYEMSA-N 383.407 5.045 30 20 GKED COc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 920109990 ITWWVENSRAUPKO-BEFAXECRSA-N 376.481 5.107 30 20 GKED C/C=C\COc1ccc(CCC(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033298 AONYKCYDKNMPFS-GXITWSLSSA-N 386.879 5.414 30 20 GKED O=C(O)c1cc(NN=Cc2ccccc2OCc2ccccc2)ccc1Cl 1776033309 DJIJWQQNZQCRAJ-UHFFFAOYSA-N 380.831 5.063 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc4c(c3)CCCC4)s2)cc1 1776113719 SFHAAQIQVKTMCR-QBFSEMIESA-N 388.488 5.888 30 20 GKED CCCCCCCCCC[C@H](C)Nc1nc(C)nc2sc(C(=O)O)c(C)c12 1776785326 VPLPEICLHYMWJI-AWEZNQCLSA-N 391.581 6.338 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCCC[C@@H]1c1ccc(C(=O)O)n1C 1776786880 YOBKTGMKCLVPIP-PKOBYXMFSA-N 376.541 5.164 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1C 1777275186 GZVSSBQXMLHNIL-GQCTYLIASA-N 384.428 5.260 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)CC3CCC3)cc2)CCC1 1792269971 GVQSNKBAOAAJRC-OAQYLSRUSA-N 380.532 5.079 30 20 GKED O=C(O)c1sccc1/N=C/c1c(-c2ccccc2)nc2ccc(Cl)cn12 1857777255 LAEPKONHQLSXDL-UFFVCSGVSA-N 381.844 5.165 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1-c1nc2ccccc2s1 29780725 DGDYQAVOYZFKSG-OAHLLOKOSA-N 399.475 5.241 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)no2)nnc1-c1ccc(F)cc1 29846052 MFRJUXLFRYQRSJ-UHFFFAOYSA-N 392.459 5.218 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](C)c1ccc(F)cc1 57473239 HNEMNMLOTIMSLU-OAHLLOKOSA-N 389.430 5.325 30 20 GKED N#C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccco1)C1CCCCC1 123832504 OZJAPMULQZDCAX-QGZVFWFLSA-N 384.530 5.212 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1)c1ccccc1 135042875 HULVQHZQOCQHQQ-MMTVBGGISA-N 395.568 5.566 30 20 GKED N#Cc1ccc(-c2nnc(CNC3(c4ccc(Cl)cc4)CCCCC3)o2)cc1 173281893 LILLNFKMTUDJIL-UHFFFAOYSA-N 392.890 5.211 30 20 GKED COc1cccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 175947711 XZIWWRILLDNNBT-MLGOLLRUSA-N 384.888 5.328 30 20 GKED Cc1cccc(C2=CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)CC2)c1 179382980 BMORYWVAOZIEJU-SFHVURJKSA-N 391.540 5.711 30 20 GKED C[C@H](N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 181687668 VXPZUANWJNTTTP-SBUREZEXSA-N 384.458 5.139 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)c(C)n1[C@@H](C)c1ccccc1 193536941 XXPLFEXOEOQODK-OXJNMPFZSA-N 383.451 5.346 30 20 GKED CC(C)[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc(C(F)(F)F)c1 236736520 CCEVGVVKJHWERY-OAQYLSRUSA-N 389.465 5.542 30 20 GKED Cc1nc(-c2cc3c(s2)CCN(c2ccc4cc(C#N)ccc4n2)C3)cs1 301957374 MVMJBGRMHDDKQY-UHFFFAOYSA-N 388.521 5.163 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(F)c1 303359355 POPCHDFXBQGNIA-INIZCTEOSA-N 389.430 5.237 30 20 GKED Cc1nc(CN2CCC(C/N=C(/O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CC2)oc1C 329184027 PBODYESHQWRYEP-PWRODBHTSA-N 387.568 5.066 30 20 GKED CC(C)c1c(N=C(O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cnn1-c1ccccc1 330171393 FJUYISVEUBRTIO-ZVBHREPYSA-N 378.520 5.052 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)(F)F)cc3)n2)cc1 429680017 GPPQOOZHWBPCGA-QGZVFWFLSA-N 382.435 5.720 30 20 GKED N#CCSc1cccc(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)c1 429962506 BYACSMHAPBKWJL-UHFFFAOYSA-N 399.928 5.255 30 20 GKED COc1ccc(-c2nnc(S[C@@H]3CC[C@@H](C#N)C3)n2-c2ccc(C)cc2)cc1 430091678 YNZSFBMAIROAHN-OXQOHEQNSA-N 390.512 5.036 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)s1 430613608 XAYVYCFPRVBNIE-CYBMUJFWSA-N 385.489 5.136 30 20 GKED C[C@H](CCC(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 437033904 HEEIYXLBABKUJY-SKDRFNHKSA-N 381.282 6.020 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(-c2nccs2)c1 437881200 ASHAQOQWGVOMLJ-PMACEKPBSA-N 388.496 5.114 30 20 GKED O=[S@@](Cc1cccc(NCC#Cc2ccccc2Cl)c1)c1ccccc1 442113111 WKLKFHAPVUILCP-SANMLTNESA-N 379.912 5.111 30 20 GKED COc1cccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 442209300 OGRPPPOYNFBSOG-MRXNPFEDSA-N 397.544 5.189 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc2cc(C(F)(F)F)ccc21 442615712 LHHOCKILWQGKLU-ZDUSSCGKSA-N 399.397 5.297 30 20 GKED C[C@H](Sc1nnc(-c2cccc(Br)c2)o1)c1cccc(C#N)c1 442914238 LLETZDBIGIQQRL-NSHDSACASA-N 386.274 5.224 30 20 GKED C=C(C)Cn1c(-c2ccccc2OC)nnc1N1CCC[C@H]1c1cccc(F)c1 460944290 QJYGBKUIQWEDFC-FQEVSTJZSA-N 392.478 5.010 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(-c2cscn2)c1 463751990 AALFQMVKGGHLFZ-CQSZACIVSA-N 379.510 5.457 30 20 GKED CSc1ccc(F)cc1CNCc1cccc(OCc2ccccc2C#N)c1 465001638 PKCDCYWOEWGPNZ-UHFFFAOYSA-N 392.499 5.288 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4cnccc34)c2)cc1 465023972 CMJLYDLCJWWRHU-UHFFFAOYSA-N 393.446 5.132 30 20 GKED COc1cccc([C@H](C)CCCC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1 469030856 PVXDRAQCJAGDFX-GOSISDBHSA-N 376.500 5.032 30 20 GKED CCc1ccc([C@H](CC)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469265664 UBCXRQWNWRBYFL-QFIPXVFZSA-N 375.516 5.395 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cccc(CCCc4ccccc4)c3)o2)cc1 471644291 UYRSNHCWNJADMH-UHFFFAOYSA-N 394.478 5.396 30 20 GKED O=C(Nc1ccccc1C#Cc1ccccc1)N1CCC(OC2CCCC2)CC1 472888691 PMDABWVYFGKNOS-UHFFFAOYSA-N 388.511 5.042 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)Sc2ncc(C(C)(C)C)o2)c1 474391476 AUVFLIPRQDZQQJ-MRXNPFEDSA-N 385.533 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(Cc2ccccc2F)s1 476171082 YTEQRILVWZMWQD-UHFFFAOYSA-N 394.515 5.977 30 20 GKED CSCCCCCNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 480821161 HBWGRBHECUQQBB-UHFFFAOYSA-N 383.517 5.314 30 20 GKED O=C(NCc1ccc(C(F)F)cc1)N[C@@H](c1c(F)cccc1F)C(F)(F)F 482442728 XLZLVHZBCRUGQN-AWEZNQCLSA-N 394.290 5.005 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN(C)Cc1cccc(C#N)c1 484981830 WJKTYLCBHSVGAF-UHFFFAOYSA-N 397.950 5.187 30 20 GKED Clc1ccc(C#CCSc2nnc(COc3ccc(Cl)cc3)o2)cc1 485252862 LFUXCUCMKUXYLC-UHFFFAOYSA-N 391.279 5.099 30 20 GKED Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 485753369 JYNKJAQUCZYPKD-IBGZPJMESA-N 389.480 5.174 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccccc1 487452767 AOVXCGLSHSUXJZ-FQEVSTJZSA-N 389.326 5.867 30 20 GKED COCCSc1ccc([C@@H](C)Nc2c(C#N)cnc3c(F)cc(F)cc23)cc1 488177412 HSGGABNAVCZWRF-CYBMUJFWSA-N 399.466 5.296 30 20 GKED N#Cc1ccccc1-c1ccc(CS(=O)(=O)Cc2ccc(F)cc2Cl)cc1 494735887 PWUUUSFFVGNRTF-UHFFFAOYSA-N 399.874 5.133 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CC4(CCC4)[C@H]3c3ccccc3)o2)cc1 495353870 MCLWQWJNDZXGPW-HSZRJFAPSA-N 398.462 5.098 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccccc2OC(F)F)cc1 507888395 BPVPEAJBUIBGDT-UHFFFAOYSA-N 380.350 5.204 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CSCc3cccnc3)c2C#N)C1 512181457 MZYIXSNXSMTMFM-OAHLLOKOSA-N 399.585 5.038 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 512529762 VRXFMHBFECEYFP-UHFFFAOYSA-N 377.366 5.099 30 20 GKED C[C@@H](CC(=O)Nc1sc2c(c1C#N)CCC2)c1ccc(C(F)(F)F)cc1 512961998 NJGSRFOIYSWQSP-NSHDSACASA-N 378.419 5.260 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC(C)(C)CCC#N)C1 513130443 UPKLYAXQMXAQEA-YOEHRIQHSA-N 381.442 5.128 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1ccc(Br)cc1)C(C)C 513859735 PFRSGFQOILGCKU-UHFFFAOYSA-N 386.293 5.072 30 20 GKED CC(C)(CNC(=O)Nc1ccc(CC#N)cc1)c1c(Cl)cccc1Cl 517115636 UTAXBMMXFRAKAL-UHFFFAOYSA-N 376.287 5.159 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCSc3ccccc32)cc1 520726333 LGROOWSQQKCMJT-UHFFFAOYSA-N 390.439 5.242 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cc3c(OC(F)F)cccc3[nH]2)cc1 520889333 FBSMWRDHLDRKHW-GOSISDBHSA-N 397.425 5.061 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 520940519 VTMCSLHZFOHOIQ-OAHLLOKOSA-N 387.936 5.788 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 521317208 YRIFDLQRSZWOKH-UHFFFAOYSA-N 377.469 5.491 30 20 GKED CC[C@@H](CC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccc(C)cc1 523112600 QSJKJCMAYSJNBS-IBGZPJMESA-N 399.494 5.885 30 20 GKED N#CCN(Cc1nc2cc(Cl)ccc2n1Cc1ccccc1)C1CCCC1 523443481 SYHVUXKJKOBSFJ-UHFFFAOYSA-N 378.907 5.006 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1c(Cl)cccc1Cl 524854211 NWNRROAHFSVTBY-YHAQOWFVSA-N 397.664 5.270 30 20 GKED CC(C)Cn1c(SCC2(C#N)CC2)nnc1-c1ccc(Cl)cc1Cl 537554970 ASSSHSYJCOCDRA-UHFFFAOYSA-N 381.332 5.304 30 20 GKED CN(C(=O)CCC(F)(F)F)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 544035832 ZEQIXPXIYURCDH-LLVKDONJSA-N 381.238 5.110 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(Br)c1 559865348 SLYPKEYKPNTVRD-AUUYWEPGSA-N 375.285 5.674 30 20 GKED CCN(C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C#N)c(Cl)c1 560985674 DQHKDEBXOGGMNO-UHFFFAOYSA-N 387.188 5.551 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F)C(F)(F)F 567949464 FPTJSFUGYJKEEH-VIFPVBQESA-N 395.274 5.426 30 20 GKED CN(C(=O)c1cc(-c2cccc(C#N)c2)no1)c1ccc(-c2ccccc2)cc1 573314461 JDSXZRONFCDDOA-UHFFFAOYSA-N 379.419 5.157 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCCCCC(=O)C1 575807016 YNJCGLZBJTURQG-GOSISDBHSA-N 376.456 5.137 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1cccc(C#N)c1 588151025 SGSVPGAJEXYDLY-AWEZNQCLSA-N 385.870 5.034 30 20 GKED CC[C@@H](C#N)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 593481394 GRDUVTGHESXUCE-HNNXBMFYSA-N 378.451 5.220 30 20 GKED CC(C)c1ccc([C@H](NC(=O)N2CCC[C@H](CC#N)C2)c2cccs2)cc1 596106325 OHWKZTNKOHLKSZ-UTKZUKDTSA-N 381.545 5.296 30 20 GKED C=CC1CCN(C(=O)CCc2c(-c3ccc(OC)cc3)[nH]c3ccccc23)CC1 599686247 QOHGNZWEODBXAJ-UHFFFAOYSA-N 388.511 5.201 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 603527342 KGBQWSSIZCYHBP-RBUKOAKNSA-N 386.417 5.118 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603624276 YJDJAJMXCRYRGA-UHFFFAOYSA-N 389.480 5.498 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCSc3ccc(F)cc3)cn2)cc1 603765396 XJXUQKNGXHNNJA-UHFFFAOYSA-N 393.443 5.006 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 609439066 VWIJDPLLBQHGGT-ROUUACIJSA-N 381.545 5.450 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3c[nH]c4ccc(F)cc34)cc2)c1 609644246 BIQXBQAEOYDWTD-UHFFFAOYSA-N 385.398 5.152 30 20 GKED N#C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C1CCCCC1 609648418 FLYAGXOHYZTJHF-LJQANCHMSA-N 394.569 5.619 30 20 GKED CC(C)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1Cl 609687085 LRNBXGGYGQRCDA-OAQYLSRUSA-N 383.923 5.529 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)c(F)c1 610219100 WFIYUVOPHJIJQX-UHFFFAOYSA-N 388.773 5.100 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(Cl)c2ncccc12 610628360 DUGUTJJBTIYLDU-PXNSSMCTSA-N 390.874 5.192 30 20 GKED C[C@H](N[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 611077965 VIPANKYHOQZSML-QWHCGFSZSA-N 386.282 5.932 30 20 GKED Cc1ccccc1-n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1C 613392518 XGWXJWMFNLSEAQ-GOSISDBHSA-N 398.491 5.103 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Br)s2)C2CC2)cc1Cl 619755782 SJTCSLNQHKKVRV-MRXNPFEDSA-N 381.726 5.277 30 20 GKED C=C(CNC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1)c1ccccc1 672481211 MJPHSSMJWQZAFL-UHFFFAOYSA-N 396.899 5.097 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccco2)s1)c1nc2ccccc2n1C(F)F 675908559 SLJXVPYHZDIMNV-LLVKDONJSA-N 383.379 5.243 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1cccc(C#N)c1 727639017 CNECFOWKIVWFOJ-ZDUSSCGKSA-N 382.872 5.182 30 20 GKED Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 727978256 FQVHNBWEACPQCL-UHFFFAOYSA-N 387.508 5.563 30 20 GKED Cc1cc(C(=O)Nc2ccc3cnn(C(C)C)c3c2)c(C)n1-c1ccc(C#N)cc1 728272625 DHWGNBDRQPOEDR-UHFFFAOYSA-N 397.482 5.149 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1sc(-c2ccccc2)cc1C#N 730176203 XXPVWRPBSRWZSZ-SSZFMOIBSA-N 388.492 5.423 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](Oc2ccc(Cl)cc2C)c2ccccc2)n1 730395794 XZAOFQVXXVIMMO-XLIONFOSSA-N 396.899 5.410 30 20 GKED COCCOc1ccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1 730464917 OLYMZXOTFWJNGF-LFYBBSHMSA-N 397.471 5.179 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc([C@H]2C[C@@H]2C)o1 732764711 VGLGAFQEMBYMHE-GUYCJALGSA-N 389.480 5.032 30 20 GKED Fc1cc(F)c(NN=Cc2cc(Cl)ccc2OCc2cccnc2)cc1F 734302373 BRHZBXUBTLPDBO-UHFFFAOYSA-N 391.780 5.177 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3cccc(F)c3)n2)cc1 734965743 OLKWBNZQFITAIJ-HNAYVOBHSA-N 378.472 5.628 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3cccc(F)c3)n2)cc1 734965744 OLKWBNZQFITAIJ-KXBFYZLASA-N 378.472 5.628 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@H](C)c3ccc(C#N)cc3)c2c1 735675774 OSWAKYUHRZKGAV-QGZVFWFLSA-N 393.446 5.395 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C[C@@H](C)c2ccc(C(C)C)cc2)c1 737565243 FNTUQKKOBOKPJG-XMSQKQJNSA-N 378.516 5.301 30 20 GKED CCOc1cccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740440377 MKWCJBFQDFDJDI-UHFFFAOYSA-N 377.469 5.007 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1OC(F)F 741474193 VRKLJLIROXLDGM-FNORWQNLSA-N 381.378 5.255 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)cc1C#N 741841059 JLCOACBHLJUHKV-VQHVLOKHSA-N 378.428 5.034 30 20 GKED C=CCOc1cccc(CNc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c1 742388648 QIJYLKCCZNHRDM-KRWDZBQOSA-N 382.504 5.449 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1cc(C#N)ccc1F 745892744 FTIOKGBMUYLXOO-UHFFFAOYSA-N 394.277 5.124 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C2(c3c(Cl)cccc3Cl)CC2)n1 759563065 UCGPKDJHLWDEJR-NSHDSACASA-N 379.312 5.481 30 20 GKED N#CCOc1cccc(CC(=O)N(Cc2cccc3ccccc23)C2CCCC2)c1 760442083 HFPLQTAJJFYWIJ-UHFFFAOYSA-N 398.506 5.256 30 20 GKED CC(C)c1ccc(-c2nc(CNc3ccc(F)cc3OCC#N)cs2)cc1 760458656 BDCHRBLHKZRVOI-UHFFFAOYSA-N 381.476 5.587 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)OCc3ccc(C(F)F)cc3)cc2)nc1 764546992 WZEHJOGPPYFRNI-UHFFFAOYSA-N 380.350 5.040 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccccc2F)c2nccn2C)cc1 764814667 OBYGNZJQCWPWDE-KKSFZXQISA-N 399.897 5.131 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCC(C)(C)CC#N 764838278 BGURDEZZEHVIIA-UHFFFAOYSA-N 390.892 5.059 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc4[nH]ccc4c3)n2)cc1 765938769 ZAESEDXJWLVENC-KYLNKMBASA-N 394.459 5.053 30 20 GKED CC(=NOCc1nc(-c2ccccc2)cs1)c1ccc(NC(=O)C2CC2)cc1 766688186 BVCUERPSQVHBKY-UHFFFAOYSA-N 391.496 5.099 30 20 GKED C=CCc1cc(CN[C@H]2C[C@H](C)Sc3sccc32)cc(OC)c1OC 772948611 XGIHPJYFKJUSFX-GUYCJALGSA-N 375.559 5.209 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)CCc2ccc(Cl)s2)ccc1OC 772980527 RBWBTROMPPOXKN-GOEBONIOSA-N 392.952 5.202 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2oc3ccc(OC)cc3c2C)c1 772982276 BKOVKGSLAAAZAY-WMZOPIPTSA-N 378.472 5.282 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3scnc3C3CC3)s2)cc1 782324090 AZVZNZNQUPMYGZ-MDZDMXLPSA-N 382.510 5.357 30 20 GKED CC(C)(C#N)CC(=O)Oc1cccc(OCc2cccc(C(F)(F)F)c2)c1 783771805 UBRLUVZMNWZUMM-UHFFFAOYSA-N 377.362 5.130 30 20 GKED CC(/C=C/C(=O)c1ccc(C(=O)N(C)C)cc1)=C\c1ccccc1C(F)(F)F 792926366 QDGXUMVJLBRVCC-MGMVUIRKSA-N 387.401 5.250 30 20 GKED Cc1csc(Nc2cccc(NC(=O)C[C@H](CC#N)c3ccccc3)c2)n1 793168912 KUYVWNZDAHKYMH-KRWDZBQOSA-N 376.485 5.221 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(OCc3ccccc3F)cc2)c1 796992199 SMFHCFCRCRIRRS-KAMYIIQDSA-N 389.426 5.259 30 20 GKED CCOC(=O)/C(=C/c1ccc(C#N)s1)c1nc(-c2ccc(C)cc2)cs1 797405549 ACDPHPMEILRDQE-LICLKQGHSA-N 380.494 5.155 30 20 GKED CN(C(=O)Nc1cccc(OCC#N)c1)[C@H](c1ccc(Cl)cc1)C1CCCC1 799208230 SYHOTFXYQFMKCG-NRFANRHFSA-N 397.906 5.638 30 20 GKED N#Cc1ccccc1C(=O)/C=C/c1csc(COc2ccc(Cl)cc2)n1 799500464 WSTNGDXZPXMMOB-JXMROGBWSA-N 380.856 5.143 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 805947555 PFFKQPOXOSWFOQ-INIZCTEOSA-N 394.496 5.117 30 20 GKED CSCC(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 810533096 VCCVOCVYAZHUJX-LBPRGKRZSA-N 399.368 5.682 30 20 GKED N#Cc1c(F)cccc1/C=C(\C(=O)c1ccccc1)c1nc2ccccc2s1 811684721 BSQATCBYOOPZKP-GHRIWEEISA-N 384.435 5.731 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)Nc2nc(Cl)c(C#N)s2)c1 841223666 BHPAPBBZVSEUDS-UHFFFAOYSA-N 377.922 5.264 30 20 GKED CCCCn1ncc(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)c1C(C)C 861296725 DKBZMRIPMMSLQG-UHFFFAOYSA-N 378.520 5.129 30 20 GKED Cc1cc(N2CCC[C@H]2c2ccccc2C(F)(F)F)cc(C#N)c1[N+](=O)[O-] 864007155 RLBXRTMNWMQORY-KRWDZBQOSA-N 375.350 5.135 30 20 GKED N#CCCCn1cc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c2ccccc21 904314114 CGJAAWHKMGXUPR-UHFFFAOYSA-N 396.372 5.681 30 20 GKED C=CCOc1cc(OC)ccc1-c1nc(-c2ccsc2C(F)(F)F)no1 904920126 DIKRGUHZGMCUNE-UHFFFAOYSA-N 382.363 5.057 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 916135349 SZBWRJIIXQUBEY-QDEBKDIKSA-N 388.354 5.294 30 20 GKED CCCCn1nc(C)c(/C=C\C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1Cl 916137005 FMVBYDHMCQAJJJ-VURMDHGXSA-N 382.247 5.103 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCOc3ccccc3C)n2)cc1 916974172 FUQLGFGIHPAIEP-IBGZPJMESA-N 390.508 5.462 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OCC3CC3)cc2)cc1 919815101 RIHGLCOJNCBBHP-DEOSSOPVSA-N 382.463 5.383 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3ccc(F)cc3)n2)cc1 921133794 YINKRAZLIUOBAS-HNAYVOBHSA-N 378.472 5.313 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(Cc3ccccc3)cc2)c1)C(=O)O 1776471128 BEQVBYMEPSCOKS-LGHUBQEGSA-N 386.447 5.025 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(NC(=O)CCCC)cc1 1776783986 QLFNRBUWNYESGY-FQEVSTJZSA-N 376.541 5.109 30 20 GKED CCc1cccc2c1OC/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776977754 COAGOEVYUXVZND-XMHGGMMESA-N 384.431 5.273 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(-c2ccccc2Cl)s1 1777268253 XOJPEZAIEZXBJU-HJWRWDBZSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3[nH]c4ccc(Cl)cc4c3C2=O)c(Cl)c1 1777673289 KMDCNTMFUIHFSN-YRNVUSSQSA-N 386.234 5.385 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@H]3CC[C@H](C(C)C)CC3)cc2)CCC1 1791376298 VJHXOGQTULDRCN-WGSAOQKQSA-N 382.548 5.159 30 20 GKED C#CCCCC(=O)Nc1ccc(C2(NC(=O)/C=C/C3CCCCC3)CCC2)cc1 1791584063 LOEHIMCHIDOGRP-SFQUDFHCSA-N 392.543 5.061 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc2ccccc2n1C(F)F 41558283 ZIKOTLODDGWNOY-ZDUSSCGKSA-N 395.340 5.321 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1nc2ccccc2s1 66802001 UJXDDXNWYLNFNG-CQSZACIVSA-N 381.526 5.262 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122020191 SGWNBOVYHLRILS-OXJNMPFZSA-N 389.524 5.699 30 20 GKED CCC(CC)n1nccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 132672457 YYXXTXYHBUDQLM-MRXNPFEDSA-N 398.919 5.511 30 20 GKED N#CCCCOc1cccc(N[C@H]2CCCc3ncc(C(F)(F)F)cc32)c1 133750764 ZIWLSBCXVYYNCB-IBGZPJMESA-N 375.394 5.272 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(OCC#N)cc1 180538033 ZWIKXGUXUPZVNY-HUUCEWRRSA-N 395.503 5.572 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C(C)(C)Cc1ccc(C(F)(F)F)cc1 188060694 JKVVXRZSJMNFFJ-AWEZNQCLSA-N 390.405 5.204 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2nnc(S)o2)cc1 188064286 YWLPWYIDCHXJEM-UHFFFAOYSA-N 379.485 5.130 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)C(C2CC2)C2CC2)cc1 194749836 WYMROXDQZKRAOY-UHFFFAOYSA-N 391.471 5.011 30 20 GKED Cc1cccc(COc2ccc(CNCc3ccc(O[C@H](C)C#N)cc3)cc2)c1 237599482 RHFUDKOIOSXNLD-HXUWFJFHSA-N 386.495 5.155 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3ccccc3OC(F)F)o2)cc1C 254926936 CIJBQGARLUWWCU-AWEZNQCLSA-N 387.386 5.067 30 20 GKED CC(C)OCc1cc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1O 290070850 BOEQORPFQXPASO-HNNXBMFYSA-N 399.516 5.213 30 20 GKED Cc1cc(C)cc(N=C(O)[C@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c1 328717963 UVJUCZNJHZZCJB-HTAPYJJXSA-N 391.515 5.377 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@H](c2cccc(F)c2)C2CCCC2)CC1)C1CC1 330006108 DUHLSRFRGCSLQD-JITJBCMDSA-N 386.511 5.939 30 20 GKED CC(C)(C)Cc1nc2cc(N=C(O)N3CCC(c4ccncc4)CC3)ccc2o1 330223517 AGCOPAITYYEBOS-UHFFFAOYSA-N 392.503 5.237 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 426118850 ZHABXCDOHJHUGE-UHFFFAOYSA-N 395.846 5.673 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H]4CCC[C@H]43)cc2Cl)cc1 429356261 UWHITGWMDZRVFY-HNAYVOBHSA-N 381.863 5.410 30 20 GKED C[C@H](N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1(C)CC1 438636473 YWLHQDXKQSRJGH-KXBFYZLASA-N 381.907 5.648 30 20 GKED N#CCC[C@@H](NC(=O)NCc1cccc(COc2ccccc2)c1)c1ccccc1 438840727 JBVKKHZCSAAVGB-XMMPIXPASA-N 399.494 5.110 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)NCC2CCC(C#N)CC2)c1 441627225 SXTNWHCZRZSBSX-UHFFFAOYSA-N 377.488 5.026 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)[nH]1 444440972 TVYQUWFKPXNWHG-UHFFFAOYSA-N 394.843 5.194 30 20 GKED CCn1c(NC(=O)c2c(-c3ccccc3)oc(C)c2C)nc2cc(C#N)ccc21 446008703 CLFDEPQQHVLHDL-UHFFFAOYSA-N 384.439 5.057 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 457554034 OGXCRBANDJGIHE-RBUKOAKNSA-N 399.947 5.611 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3cc(Cl)ccc3OCC3CCC3)CC2)c1 468194710 JQZPKBDLHBJLHS-UHFFFAOYSA-N 380.875 5.061 30 20 GKED C[C@H](C(=O)N[C@@](C)(C#N)CCc1ccccc1)c1ccc(Cl)c(Cl)c1 471969536 JIMLIKFSLOVXQM-VBKZILBWSA-N 375.299 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccc(F)cc1)N(C)C 475555342 WGRAWZOOVGXFLE-NRFANRHFSA-N 383.511 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCN(c2ccccc2)C1 475568121 MLQKNCWIIGURBY-HXUWFJFHSA-N 377.532 5.329 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(F)cc1OCCC 476570107 QZZAYGMFKCDNCL-UHFFFAOYSA-N 388.487 5.002 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477515100 ZOHOGWDPQJMZRC-CYBMUJFWSA-N 390.314 6.019 30 20 GKED Cc1ccccc1-n1ncc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C(C)C 478894122 DJVYUQVCKQATJK-UHFFFAOYSA-N 386.499 5.358 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)CSc1ccc(C#N)cc1 482272439 RPFFDNHJKGTMOQ-UHFFFAOYSA-N 394.418 5.097 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nccc4ccccc34)s2)c(C)c1 483207496 XKSLWYPUWNNNQI-FQEVSTJZSA-N 397.503 5.774 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3ccc(C#N)s3)s2)cc1 487567611 BSRPCBWAXXTEHC-AWEZNQCLSA-N 381.526 5.193 30 20 GKED C=CCN(C(=O)C/C=C\c1ccc(C(C)C)cc1)c1nc(C(=O)OCC)cs1 488284067 VUJPDONUSRHXEU-FPLPWBNLSA-N 398.528 5.066 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccccc1Cl 499958246 NXPXSNHUSVHRAM-HXUWFJFHSA-N 381.262 5.655 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(-c3ncco3)cc2)cc1 500403610 ASFWGOSHWQRXDN-UHFFFAOYSA-N 399.381 5.397 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)on1 504257363 FBRKBIYSEFJCNQ-UHFFFAOYSA-N 395.846 5.154 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cccc(C(F)F)c2)c1 506033637 UCMNBRXKJMGJAP-UHFFFAOYSA-N 378.378 5.327 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 511536938 FPTSGMVJUZYTIF-KRWDZBQOSA-N 398.466 5.002 30 20 GKED N#Cc1ccccc1CNc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 513055883 CMTIDVWZERPPOF-UHFFFAOYSA-N 395.384 5.441 30 20 GKED C[C@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(F)c(Cl)c1 517177924 IIFPJNRIYBGCBI-JTQLQIEISA-N 383.275 5.437 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCc4cc(F)c(F)cc43)cc2)cc1 517654144 VJGNNLBVLKFJRS-UHFFFAOYSA-N 390.389 5.026 30 20 GKED CC[C@H](SCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 518133508 MSWPFKZJOUDRBJ-LPHOPBHVSA-N 384.570 5.761 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CCc2ccc(Cl)c(Cl)c2)cc1 518177633 PYJWVTIWEKUBER-UHFFFAOYSA-N 391.298 5.272 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2N2CCCCCC2)c1 520321974 SVHXDZUJVMHFNN-UHFFFAOYSA-N 391.515 5.126 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521034013 SBHLOWUGGODXIO-IRXDYDNUSA-N 397.544 5.608 30 20 GKED CCn1c(C)cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1C 521474937 IMDXPGLKDKTQJQ-OAQYLSRUSA-N 391.902 5.686 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2Cl)sc2c1CCC2 521955731 VXJQJNZPOFOYQQ-RYUDHWBXSA-N 377.296 5.157 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cc(F)c(F)c(F)c2)cc1 524958103 AIVOSNRXYGGMFE-UHFFFAOYSA-N 386.304 5.159 30 20 GKED N#Cc1ccc(C2(NCc3sc4ccccc4c3Cl)CCOCC2)cc1 527808488 APBMASYVMAXEKH-UHFFFAOYSA-N 382.916 5.222 30 20 GKED C=CCCOCCNC(=O)c1oc2ccccc2c1CSc1cccs1 536060634 HODWHGDNZHNCLQ-UHFFFAOYSA-N 387.526 5.109 30 20 GKED CSc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1C 540443434 ATZWQOZVXQZVBS-UHFFFAOYSA-N 378.453 5.013 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2cccc(Cl)c2)o1 541172391 VRLUTIBHFGGRJZ-JTQLQIEISA-N 376.268 5.768 30 20 GKED CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nccs1 542964246 KVCFUKYJOCZWFE-MGPUTAFESA-N 390.512 5.193 30 20 GKED COCCOc1cccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 543875204 NTQKKNKFVHZMST-LJQANCHMSA-N 386.495 5.101 30 20 GKED C=CCCOCCCCc1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 545844389 JGBFFPCCOYKPOB-UHFFFAOYSA-N 391.245 5.432 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](c1cncc(Br)c1)C1CC1 551811532 DXKXZHONELRUDS-SFTDATJTSA-N 396.332 5.224 30 20 GKED N#C[C@H](NC(=O)CCCCCc1cccs1)c1cccc(Cl)c1Cl 557790395 OZZYLWWOHSLWJL-INIZCTEOSA-N 381.328 5.539 30 20 GKED CC(C)Oc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 559147053 LHJOVSDUKGVGDW-OAHLLOKOSA-N 397.887 5.136 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)CCCCC2=O)c1nc(-c2ccccc2)cs1 562170583 RSACWDUELCMQIN-LJQANCHMSA-N 386.476 5.209 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)C(C)(C)C)cc1 572075291 NKZBGJXLMNWUGK-DLBZAZTESA-N 383.454 5.357 30 20 GKED CCN(C(=O)c1cccc2cccc(Br)c12)c1ccc(C#N)cc1 577538073 QVYXETRCXABNDN-UHFFFAOYSA-N 379.257 5.141 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccsc1Cl 596390623 IEWKDIZIDKLOMC-GFCCVEGCSA-N 396.990 5.668 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H]1CCC[C@@H](C)C1 609078586 BBVADCGPLAGNMZ-UTKZUKDTSA-N 391.515 5.488 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3ncccc3OCCCC#N)sc2c1 609171404 VRYCVKPGPNHOKC-UHFFFAOYSA-N 385.876 5.193 30 20 GKED CCCN(C(=O)CSc1ccc(F)c(F)c1)c1cc(Cl)ccc1C#N 609286267 QTJDTYUSKQFWMD-UHFFFAOYSA-N 380.847 5.025 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C1CCCCC1 609552957 HWFFSOUKUOMDIM-UHFFFAOYSA-N 377.488 5.846 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)C1CC1 609930273 XSVGZNAHQJFQJA-JXFKEZNVSA-N 379.529 5.224 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@H]1C 610019258 JYFUSXZQEIOBMA-HUUCEWRRSA-N 383.492 5.229 30 20 GKED C[C@H](NC(=O)Nc1ncc(Cc2ccccc2Cl)s1)c1cccc(C#N)c1 610317921 FAZIJQLMPGAXIW-ZDUSSCGKSA-N 396.903 5.142 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(OC(F)F)cc1OC(F)F 610830093 CYHFHUFHXCOANX-NEPJUHHUSA-N 382.357 5.173 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C(F)(F)F)CC[C@H]1C 611557373 OPBLLKJCGWZPFM-MGPQQGTHSA-N 385.455 5.133 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1cc2cccc(OCC)c2o1 612199103 PKBIUYKJRXGFCA-HNNXBMFYSA-N 384.501 5.352 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N1CCC[C@@](C)(C#N)C1 612305286 XPOLVJOXRMUEAD-QFIPXVFZSA-N 397.906 5.385 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc2ccccc2n1 671746201 VINUSVNFKJUVLT-QHCPKHFHSA-N 399.453 5.940 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 726858451 LFVXTXOEVANCIX-DYVFJYSZSA-N 398.890 5.973 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCCCCCC3)cc2F)c1 728392709 NURVORBOEUHQSW-UHFFFAOYSA-N 381.451 5.074 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)C[C@H](CC)c1ccccc1 729069990 OROOYDUQTCUXEZ-FPOVZHCZSA-N 376.500 5.043 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(-c3nc4cc(F)ccc4[nH]3)cc2)c1 729942078 IGLZZUGORQOODV-UHFFFAOYSA-N 386.455 5.159 30 20 GKED O=C(/C=C/c1ccc(-c2cccc(F)c2)s1)c1ccc(C(F)(F)F)nc1O 731564453 FTQKNSIZPFXVRF-QPJJXVBHSA-N 393.361 5.570 30 20 GKED Cc1ccc2c(CSc3nc(-c4ccccc4)ccc3C#N)cc(=O)oc2c1 733902416 DYUHDJYMUSMSPS-UHFFFAOYSA-N 384.460 5.327 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)SCc2cc(Cl)ccc2OCC#N)cc1C 735320156 LWWZNGPQDNROOO-OAHLLOKOSA-N 388.920 5.120 30 20 GKED Cc1ccc2[nH]cc(C=Nn3c(C)nc4scc(-c5ccccc5)c4c3=O)c2c1 735610340 NQKYXIBLYJNFOU-UHFFFAOYSA-N 398.491 5.105 30 20 GKED CCN(CC)c1ccc(/C=C2/SC(=Nc3c(C)cccc3C)NC2=O)cc1F 739426474 MNMZQCSEILOCAM-CPNJWEJPSA-N 397.519 5.180 30 20 GKED COc1ccc(CNc2ccccc2SCCC#N)cc1SC(F)(F)F 742259849 RTXDBRZQXWLTFF-UHFFFAOYSA-N 398.475 5.925 30 20 GKED Cc1cccc(O[C@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 743093051 KVYRDPXMFXRTQM-NTKDMRAZSA-N 399.494 5.240 30 20 GKED Cc1cccc(F)c1CNC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 743120677 GTLUKTRPCXJJSA-UHFFFAOYSA-N 375.403 5.120 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)c1 744028634 MQXQYONWGBUSKM-QFIPXVFZSA-N 398.462 5.146 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)C1CCC(c2ccccc2)CC1 744359403 HIJJEKMMZHSVPH-UHFFFAOYSA-N 383.495 5.096 30 20 GKED CC(C)c1nc(C#N)c(NN=Cc2c(-c3ccccc3)n(C)c3ccccc23)o1 745612174 SVGQSYMBNJCPIY-UHFFFAOYSA-N 383.455 5.274 30 20 GKED O=C(/C=C\c1cc(Cl)c2c(c1)OCCCO2)c1ccc(-c2ccncc2)cc1 745990112 KGOQCMPSUVCHEZ-UQCOIBPSSA-N 391.854 5.459 30 20 GKED Fc1cccc(-c2ccc(C=Nn3c(S)nnc3-c3cccs3)s2)c1 750922890 UPNXWHHLOBWBJC-UHFFFAOYSA-N 386.502 5.045 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)o1 752238967 ZQJGDOKEKSDPPF-ZRDIBKRKSA-N 379.843 5.644 30 20 GKED O=C(/C=C\c1ccc(OC(F)F)c(F)c1)c1sccc1Br 754684245 FRXZDBPMLCLGCI-IWQZZHSRSA-N 377.181 5.147 30 20 GKED C=CC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21)c1ccncc1 777242899 JVPYGVJAUKMORX-BXXSPATCSA-N 375.516 5.067 30 20 GKED C=CCC[C@H](C(=O)OCC(=O)Nc1c(Cl)cccc1Cl)c1ccccc1 778553545 WZLYCVUEJALLNA-HNNXBMFYSA-N 392.282 5.225 30 20 GKED C=C[C@H](CC(=O)O[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784402886 OUTKNYKYVIUYQR-HUUCEWRRSA-N 382.847 5.354 30 20 GKED O=C(C[C@@H]1CCC(F)(F)C1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 797975326 GTQVMDFTVRUHOF-TVQRCGJNSA-N 389.286 5.251 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@H](c2ccccn2)C1 799208529 QVKYSRAHBNKWBQ-LJQANCHMSA-N 398.466 5.075 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(CNC(=O)OC(C)(C)C)c1 800157365 NVAKRLKBRLRCHO-UHFFFAOYSA-N 380.488 5.082 30 20 GKED CC(=NNc1ncnc(Cl)c1C(C)C)c1csc(-c2ccccc2F)n1 812230354 SRRNDNMTQOMCIQ-UHFFFAOYSA-N 389.887 5.352 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)ccc2c1 813215204 UDQHYTTVZKNOSJ-DJJJIMSYSA-N 398.384 5.242 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1ccncc1 815623415 XAIGRQONDVIQNJ-KRWDZBQOSA-N 386.373 5.408 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cc(C4CC4)cnc3Cl)c2C#N)[C@H](C)C1 839387690 GRQBNNOSPPWTEH-WDEREUQCSA-N 385.920 5.484 30 20 GKED C[C@H](c1cccs1)N1C(=O)/C(=C\c2ccc(C(C)(C)C#N)cc2)SC1=S 846756873 NQOZDZBXFFNCTO-VVBXCHJUSA-N 398.578 5.512 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1 915085142 HDWZCHRUHPIXAZ-FQEVSTJZSA-N 385.854 5.729 30 20 GKED CCN(CC)c1ccc(C=Nc2cccc(COCc3ccco3)c2)c(O)c1 915981379 RAKZYMTUMSFSEP-UHFFFAOYSA-N 378.472 5.299 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2coc3cc(C)ccc23)cc1 916955707 TUYDZTMMMBPJTM-KKSFZXQISA-N 388.467 5.145 30 20 GKED CC(=O)c1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916975891 GGOYRYNGHQQKKT-GOSISDBHSA-N 394.883 5.085 30 20 GKED Cc1ccc(/C=C\S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 917737720 HEHUWJHXRMGTCG-DHOHLHFPSA-N 388.492 5.063 30 20 GKED Cc1ccc(S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1Cl 917738144 RXSNJTIFGMJDGH-FQEVSTJZSA-N 396.899 5.105 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 920792512 SBKKZIRZRFXEMK-IINYFYTJSA-N 379.312 5.729 30 20 GKED CC(C)c1sc(NC(=O)CSc2ccc(C#N)cc2)nc1-c1ccccc1 1643650715 ZIAHXISVVWIJJK-UHFFFAOYSA-N 393.537 5.536 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)ccc1Cl 1776033606 GRBGCHKXCRXQFZ-AWEZNQCLSA-N 396.796 5.793 30 20 GKED Cc1c(NN=Cc2cc(C)n(-c3ccc4c(c3)CCC4)c2C)cccc1C(=O)O 1776086193 GXFOUFVCDKACPM-UHFFFAOYSA-N 387.483 5.035 30 20 GKED CC(C)(C#N)c1ccc(/C=C\c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)cc1 1776230898 OVYPKASLPVNNOV-XGICHPGQSA-N 392.455 5.619 30 20 GKED CCCCCCC[C@H](CC(=O)O)NC/C(C)=C/c1ccccc1C(F)(F)F 1776782386 POFOYJHSCHTCMV-IYICPGQYSA-N 385.470 5.902 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccccc1Br 1776785347 XZJZDSLHKIFHMH-LJQANCHMSA-N 398.385 6.037 30 20 GKED COc1c(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)ccc2[nH]ccc12 1777254456 CSCBWVOYKIBIHK-CLFYSBASSA-N 387.391 5.031 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2oc3ccccc3c2COc2ccccc2)n1 41521263 JEUYZUFIKZAAPC-QGZVFWFLSA-N 388.448 5.267 30 20 GKED C=CCN(C(=O)c1sc(COc2ccc(Cl)cc2)nc1C)c1ccccc1 58642344 KEIJOXMBCZEKFZ-UHFFFAOYSA-N 398.915 5.517 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(C)(C)c2ccc(Cl)cc2)cc1 65869886 RLEDFLYIMRDRAC-UHFFFAOYSA-N 396.918 5.071 30 20 GKED Cc1ncsc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 105004431 WGQVDMCCXZGLPK-QGZVFWFLSA-N 396.903 5.082 30 20 GKED CC(=O)c1csc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 108241749 SBQGGRMWYHYIJU-UHFFFAOYSA-N 398.431 5.228 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cccnc1Cl 108241803 DUJSOIMCBZSIOH-UHFFFAOYSA-N 385.798 5.012 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C/c2nc(-c3ccccc3)cs2)S1 112515374 FQRCNBYLLDZYDN-BOPFTXTBSA-N 391.521 5.319 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 121070967 SIYYMIWEVOICFM-DEOSSOPVSA-N 399.494 5.570 30 20 GKED C=CCn1c(S[C@H](C)c2cc(Cl)ccc2Cl)nnc1-c1cnccn1 155881412 RACRZLMRTPLVDS-LLVKDONJSA-N 392.315 5.081 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)OC3CCCCCC3)n2)cc1 163110952 IJXSVSXZAAORQA-HNAYVOBHSA-N 398.528 5.123 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)c1 175499016 LVKZKNBTPKPIRK-UHFFFAOYSA-N 384.464 5.098 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2NC(=O)c2cccs2)n1 177767858 MTXVSWWSFXZLSE-AWEZNQCLSA-N 395.509 5.070 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(C)[C@@H](c1ccncc1)c1ccc(Cl)cc1 178534405 HXEDBVRTPJZRGP-OAQYLSRUSA-N 390.874 5.168 30 20 GKED CCO[C@H](C)c1nc(CSCc2ccc(C#N)cc2Br)cs1 183272644 KKRASBXKZPSOSU-LLVKDONJSA-N 397.363 5.308 30 20 GKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/C[C@@H]2CCC3(CCCCC3)O2)CC1 329876044 HJMHVZFDLCUWJS-ABHNRTSZSA-N 378.557 5.386 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccncc1 361168877 PAYQCZVQMHOPMD-HNNXBMFYSA-N 389.484 5.034 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2)c1 426179769 UZXIQFFXKOGQPA-NRFANRHFSA-N 395.487 5.671 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 426381611 NYXYCLOHXGEXLP-HUUCEWRRSA-N 388.533 5.587 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1SCCc2ccccc21 428886758 KZFBUVAUVPFCFL-FOIQADDNSA-N 397.569 5.233 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F 428889745 SERAEAUDNARRJV-UHFFFAOYSA-N 391.821 5.075 30 20 GKED CCCOc1cc(O)ccc1NC(=O)Nc1ccccc1SC[C@H](C)C#N 429738447 ORGXSMFWNWTVPS-CQSZACIVSA-N 385.489 5.077 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sc(C(F)(F)F)nc1C 463125106 CSLFMNWXQMBPMB-UHFFFAOYSA-N 380.844 5.014 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccccc1 463687456 ZBPGKZVIKWISHU-JOCHJYFZSA-N 399.498 5.053 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CNc2ccccc2SC(C)C)c1C 471680696 VRGFZSLPKSWGRW-UHFFFAOYSA-N 381.545 5.163 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 475113555 DOTOUBUZWSLSKG-LJQANCHMSA-N 381.435 5.377 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Br)cc1Cl 475121265 QMVIUXYNQHRSIF-UHFFFAOYSA-N 391.696 5.180 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3cnc4ccccc4c3)c2)cc1 475495367 DQDUSJXSMZZZIT-UHFFFAOYSA-N 379.419 5.080 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)N(C)Cc1ccccc1 475547259 GQZXDAOYGQVGNG-LJQANCHMSA-N 379.548 5.181 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCOc2ccc(F)cc21 475573947 UZDFZTFDCRJBJQ-FQEVSTJZSA-N 382.479 5.713 30 20 GKED C=CCC[C@H](C(=O)N1CCC(n2c(C)nc3ccccc32)CC1)c1ccccc1 477418689 NKLZLMJSDVRCTP-QFIPXVFZSA-N 387.527 5.258 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1Cl 477799360 HVQHPZREMNXGQD-QWHCGFSZSA-N 391.899 5.614 30 20 GKED C=C(C)[C@H](NCc1nc(C)c(-c2ccc(Cl)cc2)o1)c1ccc(F)c(F)c1 481630477 WTPFRNFWQPPEND-FQEVSTJZSA-N 388.845 5.989 30 20 GKED Cc1ccc(S[C@H](C)C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1 487420162 VYIQTXVQHWNUIK-OAHLLOKOSA-N 393.537 5.033 30 20 GKED N#C[C@@H]1CN(c2ncnc3scc(-c4ccccc4)c23)C[C@H]1c1ccccc1 488767472 OINXSKVULFFFET-MOPGFXCFSA-N 382.492 5.102 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cnn(C(C)C)c2-c2ccccc2)cc1C#N 489718429 QJFDLRYAYYVOIW-UHFFFAOYSA-N 388.471 5.042 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cccc(OC(F)F)c3)o2)cc1 489760174 PSFLPRFNKOEJCG-UHFFFAOYSA-N 390.411 5.195 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 498447939 GWASNALWQVDMJG-WOJBJXKFSA-N 386.417 5.119 30 20 GKED COc1ccc(CN[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)cc1OCCCC#N 500429919 UNEQTQPIMYUTHX-KSFYIVLOSA-N 384.907 5.056 30 20 GKED C=CCCc1ccccc1NC(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1 505035211 LECWWVRRGIOQBI-NQIIRXRSSA-N 383.561 5.071 30 20 GKED Fc1cccc(F)c1[C@H](NCc1ccccc1OCC(F)(F)F)C(F)(F)F 506307674 NZYZMFWYGAEFMH-HNNXBMFYSA-N 399.281 5.299 30 20 GKED C=C[C@@H](CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 507278119 DNLQDEGMFRWGBK-WMZHIEFXSA-N 385.511 5.490 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1OC1CCCC1 510479317 ZSOIOYMIVODJOJ-UHFFFAOYSA-N 377.488 5.324 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)c1 512727359 GEYGUHZVQGFVIW-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C[C@@H](Oc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 515241058 RZSNSRBNIBCDOV-IIBYNOLFSA-N 390.870 5.401 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 517532866 PWDSCHKLPMLSLI-QGZVFWFLSA-N 379.529 5.586 30 20 GKED C[C@H]1C[C@H]1c1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)o1 518308535 CXPJYQWNEPYNHO-HNAYVOBHSA-N 388.492 5.356 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@@H](C)c1ccccc1OC 519913877 TWJNIJOPWCLWKL-KRWDZBQOSA-N 395.503 5.359 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@H](C)c1ccccc1OC 519913878 TWJNIJOPWCLWKL-QGZVFWFLSA-N 395.503 5.359 30 20 GKED N#C[C@@H](NC(=O)CCCCCc1cccs1)c1cccc(C(F)(F)F)c1 520271489 SHBJMQPKAMXRRQ-QGZVFWFLSA-N 380.435 5.251 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 521730579 PMXMCWSVYSRJNX-MRXNPFEDSA-N 387.508 5.561 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H]1CC(C)C 524438277 YKRCGCFIFKBXML-NRFANRHFSA-N 391.515 5.488 30 20 GKED CN(CC(=O)Nc1ccccc1SCC#N)c1ccc(-c2ccccc2)cc1 532574276 FWNHBZQFTIAYGN-UHFFFAOYSA-N 387.508 5.044 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(C(F)(F)F)cc1 541018707 OVXYMJQFSMFVMD-SFHVURJKSA-N 379.426 5.048 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc(O)cc2)cc1Cl 546162252 CFLLGUCTIQECBJ-NRFANRHFSA-N 390.870 5.272 30 20 GKED COc1cc(CNc2cc(CC#N)ccn2)ccc1OCc1ccc(Cl)cc1 546634883 FTTRWZGGWQQZBK-UHFFFAOYSA-N 393.874 5.001 30 20 GKED CC[C@@H](CC#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 547277926 HZNJEEUWCZYAKW-IBGZPJMESA-N 389.524 5.137 30 20 GKED N#Cc1cc(NC(=O)c2cnc(-c3cccnc3)s2)ccc1Oc1ccccc1 547969723 UHSQRICRONGHSD-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc2cc(Cl)sc2[nH]1 558606496 XZBPQMXZWLRSNI-SNVBAGLBSA-N 375.906 5.387 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 559867092 ZEIRRTQHCKJSRF-OXQOHEQNSA-N 376.422 5.713 30 20 GKED N#CC1CCC(CN[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)CC1 569286063 INVLHHVWOLJSFP-MHVYXZCWSA-N 386.337 5.227 30 20 GKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc2c1 575100088 REFOBWJRYRACJF-KRWDZBQOSA-N 399.500 5.695 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC(C2CCCC2)C1 575858857 PZIYJVARLCYYJT-UHFFFAOYSA-N 389.499 5.100 30 20 GKED Cc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1C#N 599405583 ZYXZISHCISALSY-OAQYLSRUSA-N 388.433 5.143 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cn2)cc1 603765302 UZGNCOPRJRPJHP-UHFFFAOYSA-N 398.249 5.234 30 20 GKED CCOc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cc1Cl 603964176 FOBAXTFXUXDWQL-UHFFFAOYSA-N 396.830 5.035 30 20 GKED Cc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)ccc1Br 608915205 NODZILDNUVJGRP-UHFFFAOYSA-N 386.293 5.072 30 20 GKED N#CCCCOc1cccc(NC(=O)CCc2cccc(OC3CCCC3)c2)c1 609016163 DBGMBRWYBJFGFJ-UHFFFAOYSA-N 392.499 5.262 30 20 GKED CCN(CC#N)C(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 609298947 VFTMDSWYYTXJEK-QGZVFWFLSA-N 379.312 5.199 30 20 GKED N#CCCN(C(=O)c1cnc(-c2ccccc2Cl)s1)c1ccc(F)cc1 609521950 KVSNKCRSHQDCLA-UHFFFAOYSA-N 385.851 5.163 30 20 GKED Cc1nc(-c2ccc(NCc3cn(CCC#N)nc3-c3ccccc3)cc2)oc1C 610910439 DGNIYBVRWAGBJM-UHFFFAOYSA-N 397.482 5.348 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCC(c2ccccc2)c2ccccc2)c(Cl)c1 611093388 IEFDHGPPCNODML-UHFFFAOYSA-N 395.289 5.427 30 20 GKED C=CCn1c(S[C@@H](C)c2c(F)cccc2F)nnc1-c1ccc(OC)cc1 613932649 IDGUZRMKNFJNSX-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)c1 618761523 GHVJEXFWWSUNBI-JOCHJYFZSA-N 399.498 5.031 30 20 GKED N#Cc1ccc(CNC(=O)c2occc2CSc2ccccc2)cc1Cl 619765557 COSGTDOSXBHKSP-UHFFFAOYSA-N 382.872 5.027 30 20 GKED CC(C)(C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1F 624619305 OXIRIFLSJMQWPE-GHMZBOCLSA-N 399.350 5.129 30 20 GKED N#CCCn1cc(C(=O)CSc2ccc(Cl)cc2C#N)c2ccccc21 674694106 VQGRCCDQBQBZPH-UHFFFAOYSA-N 379.872 5.055 30 20 GKED Fc1cccc2c(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)ncnc12 683382819 BSMZBGJBSIMACH-MYJAWHEDSA-N 381.295 5.090 30 20 GKED CCOc1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 683765607 RWNSMJVXPSTLOJ-ITGUQSILSA-N 387.339 5.224 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1OC 727267151 DKCRGIBDJHIUAN-WMZJFQQLSA-N 383.444 5.171 30 20 GKED N#CCOc1ccccc1C(=O)N[C@@H](c1ccccc1)c1cccc2ccccc12 732016590 VOBOFDWRUYIDHB-VWLOTQADSA-N 392.458 5.262 30 20 GKED C#CC[C@@H](OC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1)c1ccccn1 733692422 FEGOZSMPLAGFID-HXUWFJFHSA-N 377.465 5.049 30 20 GKED Cc1cc(C(=O)N[C@](C)(C#N)C2CCCCC2)c(C)n1[C@@H](C)c1ccccc1 734238777 PSKINIMKWLZXBW-MHECFPHRSA-N 377.532 5.307 30 20 GKED CCCCCCCC(=O)Nc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1 737651656 XBYSHOQNCALSPA-UHFFFAOYSA-N 389.517 5.181 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156240 LRODLDQOSZKATB-YJBOKZPZSA-N 395.453 5.925 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)cc1C#N 741943497 PORHMGGZOHUJSH-UHFFFAOYSA-N 392.393 5.037 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 743004232 HQVGNGBLVPCVJB-ICSRJNTNSA-N 383.948 5.485 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)Cc2c1ccc(Cl)c2Cl 743055864 LSXMYEQVVVMQHJ-UKTHLTGXSA-N 383.234 5.398 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccc(OC)cc2)cc1 750688491 UQXRIFMVGKHQGY-HOIFWPIMSA-N 392.499 5.050 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)N(CCC#N)Cc1cccnc1 751110660 FPAMCMAXPQVCHA-SEYXRHQNSA-N 387.483 5.126 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1OC(F)F 753389067 AJWFPVXWIDBCSY-ABDJAZHISA-N 378.378 5.116 30 20 GKED C#CCCCC(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 757910849 WLQYBIWADGECRY-UHFFFAOYSA-N 394.858 5.316 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F 767942255 PWCRZCUCWLDCIW-KRWDZBQOSA-N 395.475 5.082 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 774089047 HXLYCYGOJRPVPI-CXAGYDPISA-N 390.439 5.232 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@@H](c2ccco2)C1 775487085 HSTJMLFBKCHOKU-YFXJRYMSSA-N 399.494 5.940 30 20 GKED CC(C)[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1cc2ccccc2o1 777117208 KRTGURRGHPQDPF-XMMPIXPASA-N 389.499 5.075 30 20 GKED CC(Cl)(Cl)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 777304322 QLLWHJMTJZPOJQ-VIFPVBQESA-N 394.110 5.487 30 20 GKED Cc1cc2c(Br)ccc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c2o1 785596410 BWZUMCFDWKHNPC-LBPRGKRZSA-N 399.244 5.047 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](CC#N)c3ccccc3)n2)cc1 796633101 GWQUFJFZUWRRJI-UXHICEINSA-N 385.492 5.382 30 20 GKED COc1ccc2sc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c(C)c2c1 797571452 RRHAQXXQFBFPKJ-AWEZNQCLSA-N 384.526 5.462 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccc(Cl)cc1 810193293 FZIIQWTWYQAYFJ-MRXNPFEDSA-N 380.797 5.331 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCCc1ccccc1Cl 810521797 RSQLSROPSGZDSD-KRWDZBQOSA-N 378.859 5.044 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1nccc2ccccc12 811636001 UKJAOHUKEOUEPH-UHFFFAOYSA-N 381.361 5.033 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)c1cc(C(F)(F)F)ccn1 813216062 FKKYFRIVPLXEFJ-CQSZACIVSA-N 398.306 5.027 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813218193 SWFHZVNUTVKPDZ-PBHICJAKSA-N 390.405 5.176 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)CC(F)(F)F)c23)cc1 814760934 CMARENRYHUVTTA-UHFFFAOYSA-N 380.395 5.107 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC12CCSCC2)c1nc2cc(C(F)(F)F)ccc2s1 835075278 WVMVONSUVJXRLX-NEPJUHHUSA-N 396.459 5.025 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)[C@@H](C)[C@H](C)CC2 839390998 PGBWEQLNXYAXSK-MNOVXSKESA-N 390.940 5.068 30 20 GKED Cc1sc2ncnc(NN=C3CCC(C#N)(c4ccccc4)CC3)c2c1C 916588203 AAXDTBXIOLMLQP-UHFFFAOYSA-N 375.501 5.112 30 20 GKED C=CCOc1ccc(/C=C\c2nc(-c3ccccc3)ncc2C(=O)O)cc1Cl 1776183907 BPWFJBCPHYLLPT-NTMALXAHSA-N 392.842 5.230 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2cc(C(=O)O)cs2)cc1)c1ccccc1 1776469463 YLSZMIMXIUWMPD-SSCKCOOKSA-N 378.449 5.482 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3ccc(CC(=O)O)cc3)ccc21 1777002843 LDETWCZZMKALNZ-UVTDQMKNSA-N 383.447 5.338 30 20 GKED N#Cc1ccccc1/C=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 51155581 QXUXJYHOOVMYEI-RUJXFNLJSA-N 389.867 5.225 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2cc3ccccc3[nH]2)cc1 58901305 AIJWSOMJLMADAX-UHFFFAOYSA-N 397.503 5.262 30 20 GKED COc1ccc(CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 66800960 XAFJRMINTWJSOK-AWEZNQCLSA-N 388.920 5.314 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1 66801398 VFKGPSNNKXNPCL-AWEZNQCLSA-N 396.903 5.172 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66954304 HALWDPXUVHEDOG-CVEARBPZSA-N 383.517 5.362 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)n1 112148632 UWLPUPWKWIJTRA-NJDAHSKKSA-N 388.492 5.011 30 20 GKED CCc1cccc2c(C3CCN(C(=O)Nc4ccc(CC#N)cc4)CC3)c[nH]c12 124486724 HGEWENVKBQKHIR-UHFFFAOYSA-N 386.499 5.208 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCc4ccsc4C3)c2)cc1 132047531 KVWSHABXQAOQJX-UHFFFAOYSA-N 375.453 5.002 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N(CCC#N)CCC(C)C 183408808 LXVBNVQBWLOXFB-UHFFFAOYSA-N 393.409 5.071 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 187330377 AMPSNMHFHJTGKH-IBGZPJMESA-N 376.481 5.299 30 20 GKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 193455144 IMXWNHJFWJQTFO-HXUWFJFHSA-N 388.492 5.301 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C\c2ccsc2)C(=O)c2ccccc2)c(Cl)c1 213691303 MUFODQZUUCXMER-PDGQHHTCSA-N 395.911 5.923 30 20 GKED COC1(C)CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 271773728 GLKGLWZBOKNYRZ-IBGZPJMESA-N 397.906 5.028 30 20 GKED O/C(=N/Cc1nc2cc(Cl)ccc2s1)[C@@H]1C[C@]12CCOc1ccccc12 328785540 ITHQPPKTBVHARR-XOBRGWDASA-N 384.888 5.147 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@@H]4CCCC[C@H]4C)no3)C2)c1 329547107 AYMWZCFADOAUIM-ZIFCJYIRSA-N 382.508 5.097 30 20 GKED CC(C)(C)OC(=O)C1CCC(/N=C(/O)c2cc(Cl)sc2Cl)CC1 330627451 XGMZIVSNAHFWGZ-UHFFFAOYSA-N 378.321 5.260 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccc(F)cc2F)C2CCCC2)c1 429921009 GXBSQCIZZBUKRB-UHFFFAOYSA-N 386.467 5.165 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 432859484 OLANATPNRTYXRT-MBSDFSHPSA-N 393.556 5.442 30 20 GKED CN(Cc1cc(F)cc(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 434149354 ZBQCEGVQQQSKME-UHFFFAOYSA-N 393.393 5.293 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 436133601 XNUJJAXWQYIXBK-UHFFFAOYSA-N 386.329 5.523 30 20 GKED N#CC[C@@H](CC(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 437486086 ODDDURMWFFXBOL-BJLQDIEVSA-N 386.417 5.155 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H]1CCOC2(CCC2)C1)c1ccc(C(F)(F)F)cc1 441537592 XNYQMHNLKSHDBP-QZTJIDSGSA-N 396.453 5.114 30 20 GKED CC1(C)CCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)CCS1 447640930 WRBQDKSRHBZGPS-UHFFFAOYSA-N 396.581 5.208 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNC1CCC(C)(C#N)CC1 449087153 FFVPNIOTORTDIY-UHFFFAOYSA-N 379.504 5.225 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccnc(C(F)(F)F)c1 455249425 QHCLAFRTUAYHMD-UHFFFAOYSA-N 377.410 5.274 30 20 GKED C[C@@H](CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)c1ccccc1F 456579180 QCJJKSBWGOXUFO-ITDIGPHOSA-N 385.323 5.051 30 20 GKED CCC(CC)c1cc(CNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)on1 461119322 WFPVYCMRILGCQM-UHFFFAOYSA-N 388.471 5.123 30 20 GKED C[C@H](C(=O)N[C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462440891 MQYWRHCICYWRJH-VHKYSDTDSA-N 386.417 5.133 30 20 GKED N#C[C@@H](C(=O)c1ccccc1COc1ccccc1)c1cc(C(F)(F)F)ccn1 464477601 SFZHCXMCKQRMFO-LJQANCHMSA-N 396.368 5.169 30 20 GKED CCC(=O)c1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 471190350 FVDUMBNAVPONMT-UHFFFAOYSA-N 398.462 5.177 30 20 GKED Cn1ncc(C(=O)Nc2ccc(-c3ccc(C(C)(C)C)cc3)cc2Cl)c1C#N 474772258 FBJSLUHYBKIUHA-UHFFFAOYSA-N 392.890 5.162 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CN1CCOc2ccc(Cl)cc21 476118910 ONOCFUODMGFFJZ-UHFFFAOYSA-N 384.907 5.029 30 20 GKED COc1ccc(-c2ccncc2)cc1CN1CCC[C@@H]1[C@@H](C#N)c1ccccc1 481997970 JXFRMVUTBQMHKM-BJKOFHAPSA-N 383.495 5.029 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(CO)cc2)cc1 486938151 HOTCJELQZPNPQJ-UHFFFAOYSA-N 391.492 5.502 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1)c1ccccc1 488684589 JVBWQKPEQVSWNW-GOSISDBHSA-N 384.907 5.024 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1F 498993354 ZTVAZUYUIQVVFF-UHFFFAOYSA-N 379.275 5.530 30 20 GKED CC(C)(C(=O)Nc1ccc(CNc2ccccc2)cc1)c1cc(F)cc(C#N)c1 499507787 DQVNHCCVWIZHHM-UHFFFAOYSA-N 387.458 5.226 30 20 GKED CC[C@@H](C)Oc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cc1 500583608 NYOKVOLLQZCUMG-MRXNPFEDSA-N 390.439 5.160 30 20 GKED COc1cc(C#N)ccc1CN[C@@H](c1ccccc1Cl)c1ccccc1OC 500852278 MCUHDCTWTUBMDM-QHCPKHFHSA-N 392.886 5.108 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2cnn(CC(C)C)c2C)cc1 501343754 MRULVHGXTMFRPA-UHFFFAOYSA-N 388.471 5.072 30 20 GKED Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccccc1Sc1ccccc1C#N 501981954 APTVNYSTCPKIQK-OAQYLSRUSA-N 384.504 5.435 30 20 GKED CC(C)c1sc(NC(=O)c2ncc(C#N)cc2Cl)nc1-c1ccccc1 504379253 YPXCDXLLJFDHAZ-UHFFFAOYSA-N 382.876 5.106 30 20 GKED C[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509906424 YRLCDLVODRQJFZ-JPYJTQIMSA-N 391.515 5.374 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccccc1F 510829547 YWGQNQVMADFSSN-JOCHJYFZSA-N 381.410 5.036 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1C1CCCC1 510858585 WVIPWOJXQBMOCN-QHCPKHFHSA-N 389.499 5.846 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H]1CCc2ccccc21 510887486 OKECYFVXVVSSIV-DEOSSOPVSA-N 397.478 5.810 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 511400962 XEYWVGWXOBQBRX-UHFFFAOYSA-N 383.797 5.110 30 20 GKED N#C[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(F)cc1 511721877 ITQYJYZHTFBILM-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3coc4ccccc34)c2)cc1 512534531 ROCLKOOMXZTRIU-UHFFFAOYSA-N 383.407 5.418 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@H]3c3ccsc3)s2)cc1 514511854 XIDSVWVIXWNCAG-SFHVURJKSA-N 394.525 5.036 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccccc1OC(C)C 519897073 PURSWBSBGJPULR-LJQANCHMSA-N 393.531 5.274 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 521152184 YCYQPRXEVGIGIO-QWHCGFSZSA-N 376.287 5.329 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Br)s1 521726932 OYHJOJPUWOXTDI-SNVBAGLBSA-N 381.320 5.015 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCSC[C@H]1c1ccccc1 522458697 URFQOTJDNGBQOY-LPHOPBHVSA-N 397.569 5.260 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)S1 525739464 YSWZIDRCKBWWDS-ZRGWGRIASA-N 399.947 5.353 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(Cl)c2c(c1)OCCCO2 531391282 IQRRKNGPHOMJEG-AWEZNQCLSA-N 388.920 5.508 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cccc1-c1ccccn1 535117952 XXYFMLFWHAQEFT-UHFFFAOYSA-N 396.475 5.305 30 20 GKED COc1ccccc1COc1cccc(NC(=O)c2ccc(C#N)cc2C)c1C 536240166 SUKVDZGRJMRJBE-UHFFFAOYSA-N 386.451 5.015 30 20 GKED CC(C)N(Cc1cccc(Br)c1)C(=O)c1ccc(C2(C#N)CC2)cc1 537396259 CAVLEYXQCFDNLI-UHFFFAOYSA-N 397.316 5.055 30 20 GKED C[C@H](NCC#Cc1cccc(Cl)c1)c1ccc(OCc2cccnc2)cc1 538124345 ILRFGTMMMAQDDU-SFHVURJKSA-N 376.887 5.016 30 20 GKED Cc1ccc(C)c(Oc2ccc(CN[C@@H](C)c3ccc(C#N)c(F)c3)cn2)c1 538506893 KBOPEXWUFJBUPC-KRWDZBQOSA-N 375.447 5.352 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1ccc(C2(C#N)CC2)cc1 538522911 UQLATTHJTPBBJR-UHFFFAOYSA-N 398.510 5.286 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 538855602 ZNHVTTCWRHESGH-FQEVSTJZSA-N 389.886 5.307 30 20 GKED C[C@H](N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543961436 JQSOYNFHVHMQRZ-RBUKOAKNSA-N 393.494 5.218 30 20 GKED C[C@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)cc1F 545942695 JMQKWPAGDNCDHV-INIZCTEOSA-N 378.422 5.266 30 20 GKED COc1cc(C#N)ccc1NC(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 546002831 QTBXRIPKZUTRCF-INIZCTEOSA-N 386.455 5.384 30 20 GKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 550826446 FYILBAVAHRNWIV-VQTJNVASSA-N 376.422 6.061 30 20 GKED CC(C)Oc1c(Cl)cccc1NCc1cn(CCC#N)nc1-c1ccccc1 552213360 PAJZCIAOOGESGG-UHFFFAOYSA-N 394.906 5.516 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CC1 572685967 RBQRDMAOCXBBFH-HNNXBMFYSA-N 388.427 5.096 30 20 GKED Cc1ncc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C2CC2)n1 576456310 IYXLQKNJARZLDP-HNNXBMFYSA-N 397.482 5.084 30 20 GKED N#CCCC1CCN(C(=O)c2cccc(OCc3ccc(Cl)cc3)c2)CC1 582907093 UCNIWELDJIAUDP-UHFFFAOYSA-N 382.891 5.075 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 593998163 SJWOMRXFJZRZAB-MRXNPFEDSA-N 398.959 5.174 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1 596733086 BOVMVIUOHOQBEO-OXQOHEQNSA-N 395.528 5.681 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccc3)cn2)c1 603691222 JAGKMNXUXPEJQY-OAQYLSRUSA-N 384.439 5.115 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(NC(=O)CC(C)C)ccc1Cl 607448712 CEHLJONBWJYBAG-UHFFFAOYSA-N 390.936 5.215 30 20 GKED C[C@@H](CN(C)C(=O)c1cccc(OCc2ccccc2C#N)c1)c1ccccc1 608947946 JPUBQXBXONKAPO-IBGZPJMESA-N 384.479 5.013 30 20 GKED CSc1ccsc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 609323876 BFTGKKGSWMIUEJ-LLVKDONJSA-N 390.599 5.806 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)n1CC(F)(F)F 609382738 RGGHCQCHPJCXRI-LBPRGKRZSA-N 395.450 5.171 30 20 GKED Cc1sc2nc([C@H](C)Sc3ccc(Cl)cc3C#N)nc(O)c2c1C 610655187 UBVMEBCVLDVUSG-JTQLQIEISA-N 375.906 5.392 30 20 GKED CSCc1c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)oc2ccccc12 611247081 ODXKESPCXNREPP-UHFFFAOYSA-N 388.492 5.097 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CC[C@](F)(C#N)C2)c(C(F)(F)F)c1 615528827 KBKKHQBAXMURRW-BZNIZROVSA-N 389.418 5.065 30 20 GKED O=C(CC1CCC(F)(F)CC1)NC(CCC(F)(F)F)CCC(F)(F)F 628113037 KBUWTHKWPPAFKV-UHFFFAOYSA-N 383.323 5.372 30 20 GKED C=CCn1c(SCc2csc(Nc3ccc(C)cc3)n2)nnc1C1CC1 645075425 JAXDFMVWYRYJHK-UHFFFAOYSA-N 383.546 5.142 30 20 GKED C[C@@H]1CCCc2ncc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)n21 651265201 JDLGKNYOBIWGMP-IUODEOHRSA-N 396.903 5.047 30 20 GKED Cc1cn2c(/C=C\C(=O)c3sc(-c4ccccc4)nc3C)c(C)nc2s1 727780311 KPFZQMDWJJXBMF-KTKRTIGZSA-N 379.510 5.341 30 20 GKED CCC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccn1 729553394 OYFSBYGZMTXOND-GMAHTHKFSA-N 384.483 5.400 30 20 GKED C=CCc1cc(CNCc2ccc(-c3ccccc3F)o2)cc(OC)c1OC 729683522 WJZUKTVSYMKIPW-UHFFFAOYSA-N 381.447 5.121 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1sc(-c2ccccc2)cc1C#N 730176201 XXPVWRPBSRWZSZ-DTQAZKPQSA-N 388.492 5.423 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccc(O)cc2)n1 731373144 HHPFCDFHWBZUMP-ZDUSSCGKSA-N 395.509 5.162 30 20 GKED CN(CCc1ccccc1F)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 731756447 SDHJRVVTVAMOBT-UHFFFAOYSA-N 389.430 5.196 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cc(C)c(C)cc1C 733081274 SUBWANAFENJHNU-UHFFFAOYSA-N 399.420 5.319 30 20 GKED c1ccc(-c2csc(NN=C(CC3CCCCC3)c3ncccn3)n2)cc1 733906741 FVEWJZGJJZCWSD-UHFFFAOYSA-N 377.517 5.387 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 744073810 GDASXGZJPYJZOA-FZMZJTMJSA-N 386.398 5.207 30 20 GKED Cc1ncsc1C(=O)/C=C\c1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 745625432 AIURLWOKUABLML-LUAWRHEFSA-N 379.441 5.024 30 20 GKED C=CC[C@H](NC(=O)N(CCc1ccc(C)cc1)Cc1ccco1)c1ccncc1 745828307 RNVNIBDFPYVNNU-QHCPKHFHSA-N 389.499 5.055 30 20 GKED CC[C@@H](/N=C/c1cc(Br)ccc1O)c1nc(C(F)(F)F)cs1 745975913 CPFDDCYIPUTTOE-GFKCFBEASA-N 393.228 5.200 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1OC(F)F 745990510 RGNPGXSACJIZNF-WAPJZHGLSA-N 381.378 5.255 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1cc(Cl)ccc1OC(F)F 748440654 DZLAUIHUDGSVPW-WAYWQWQTSA-N 392.814 5.356 30 20 GKED O=C(/C=C\c1ccc(-c2cccs2)cc1F)c1ccc(N2CCOC2=O)cc1 748584974 XXGNENZLYXLGTI-YFHOEESVSA-N 393.439 5.407 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1sc2ccccc2c1Cl 749360673 AMQUJUREIXYXHO-UHFFFAOYSA-N 391.883 5.304 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@@H](C)c2c(C)noc2C)c1 754024529 NKMSVOBPPIXXNO-OAHLLOKOSA-N 378.497 5.061 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2OCC#N)c(C)n1-c1ccc(Cl)cc1 760971348 QIWVTEJUBVHWJO-UHFFFAOYSA-N 397.837 5.041 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc3ccsc23)cc1 767960428 RCVCCJCGPYIUND-IFXJQAMLSA-N 376.481 5.376 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1nc2cc(F)ccc2s1 771282930 OAILHZCSXGCHNU-OAHLLOKOSA-N 384.863 5.288 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@@H](O)c1ccc(-c2ccccc2)cc1 777194317 YNCWAWMIGGHMCF-JOCHJYFZSA-N 389.520 5.095 30 20 GKED N#C[C@@H](C(=O)CCCCC(=O)c1ccc(F)cc1)c1nc2cc(F)ccc2s1 778637090 WCBFUQFODKKBJD-INIZCTEOSA-N 398.434 5.194 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 786446709 DNKUGRAPFRAUSZ-SFHVURJKSA-N 396.412 5.699 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc2nc(-c3ccccc3)oc2c1 793787314 COOXWSOCFYINHM-OAHLLOKOSA-N 383.407 5.038 30 20 GKED C=CC[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccncc1 799634365 VWDBNJWUGJMWOG-KRWDZBQOSA-N 386.282 5.431 30 20 GKED C#CCCCCCc1nc([C@@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 809532715 KDIJPAIRMWZYHJ-KRWDZBQOSA-N 384.373 5.090 30 20 GKED COc1ccc([C@@H](Cc2ccccc2)N[C@H](C)c2ccc(OCC#N)cc2)cc1 810255061 VHKKELSHPXZAFV-KBMIEXCESA-N 386.495 5.232 30 20 GKED CCC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccn1 810531075 FPOTWWDEKNPVRH-IRXDYDNUSA-N 395.915 5.619 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2csc(-c3ccccc3F)n2)c1 812724885 OVEGAOLKTZGCKI-RDJZCZTQSA-N 395.503 5.481 30 20 GKED CC(C)c1ccc(N2C(=O)/C(=C/c3ccc(OCC#N)cc3)SC2=S)cc1 814278244 HRCOMYAPMXEBIK-UYRXBGFRSA-N 394.521 5.118 30 20 GKED CC(C)c1cccc(CC(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)c1 838786306 HNJBTRQUJQFZPY-MRXNPFEDSA-N 389.282 5.007 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 916942547 LSVRKWGTGNRJBW-UYZDIKGJSA-N 393.657 5.008 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccccc1F)c1nc(-c2ccc(Cl)cc2)cs1 916977035 HHDRKDQTKIONAX-OJXHRBAXSA-N 382.847 5.492 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)cc1 921280369 GJASDCMKCVDGQH-GOSISDBHSA-N 398.359 5.752 30 20 GKED O=C(Nc1ccc(C(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 933112417 TXJWKSHDDZCREF-AOOOYVTPSA-N 390.274 5.219 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269252 SMWFWDOYMSORPI-VQHVLOKHSA-N 394.486 5.941 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccncc2)cc1 1776354331 AVWHQCRVAWJXTK-WEVVVXLNSA-N 387.435 5.130 30 20 GKED CCCCCCCSc1ccc(C(=O)OCc2cc(C(=O)O)co2)cc1 1776787570 ZOXRCDJTDDNAIN-UHFFFAOYSA-N 376.474 5.397 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1nc2ccccc2c(C(=O)O)c1C 1776931504 RNKRDJKSDSKPHB-KTKRTIGZSA-N 395.842 5.190 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)CCC=C(C)C)cc2)CCC1 1790453421 ILUJSQDVMHBSIA-UHFFFAOYSA-N 380.532 5.061 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)n1 5642609 ZEZZGXAKDVSZQY-KRWDZBQOSA-N 387.508 5.356 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2cccc(-c3ccccc3)c2)cs1 63874641 ZCWSCHROFNGYKI-OUKQBFOZSA-N 376.481 5.079 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)CCc1ccc(OC)cc1 65485229 QSCKTHXYVGQYLJ-OAHLLOKOSA-N 392.952 5.129 30 20 GKED N#Cc1ccccc1NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 119720052 YEEZEILCDQYOQI-UHFFFAOYSA-N 386.238 5.091 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2ccsc2C1 131355373 LWNCFKDFMPWCLS-UHFFFAOYSA-N 389.480 5.311 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 179384929 ZFPDPPDIFFPHNL-WONIAPNHSA-N 385.801 5.365 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1nc2ccccc2o1 179457990 BDADBNOKXNRZMO-OAHLLOKOSA-N 378.334 5.072 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H](C)c1ccc(OCC#N)cc1 180538256 LDNMNPYNSYMLFR-HZPDHXFCSA-N 377.513 5.433 30 20 GKED CCC[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 181767564 RABGICYFTNAGHZ-IEBWSBKVSA-N 381.545 5.150 30 20 GKED COc1ccccc1-c1cccc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)c1 184021255 VQNJQMHLRHNNKD-INIZCTEOSA-N 387.439 5.297 30 20 GKED CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 185349629 TUPGFFSNHZVYFE-NVXWUHKLSA-N 397.500 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCN(c2ccc(C)cn2)CC1 189893650 AZLAIELDLWJDFW-UHFFFAOYSA-N 377.532 5.097 30 20 GKED CC(C)c1noc2ncc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc12 193775329 HEKHWVXQZVXETO-CYBMUJFWSA-N 396.859 5.099 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cccc(CC#N)c2)c(C(F)(F)F)c1 195301787 ZQSNCVGFWSGPPE-ZDUSSCGKSA-N 392.446 5.914 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(Br)cc1 209742068 QCQUVWUTERRQDQ-FPLPWBNLSA-N 376.300 5.530 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 303487163 PJQNCGKULHNSLC-VOBQZIQPSA-N 386.417 5.290 30 20 GKED O/C(=N\C1CCC(/C(O)=N\Cc2ccc(C3CCC3)cc2)CC1)C1CCCC1 330228659 PTRJLLSCXAPQQQ-UHFFFAOYSA-N 382.548 6.116 30 20 GKED C=CCn1c(SCc2ncccc2C(F)(F)F)nnc1-c1ccccc1C 428072120 SYHDIIWSXIOTQZ-UHFFFAOYSA-N 390.434 5.146 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(-c3ccccc3Cl)on2)s1 430624183 IMTHCMPYAUHSEV-GFCCVEGCSA-N 385.876 5.239 30 20 GKED Cc1c(C(=O)Nc2cccc(-c3nccs3)c2)sc2ccc(C#N)cc12 431330807 XUBGOGHGQVVOLR-UHFFFAOYSA-N 375.478 5.457 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)Nc1cccc(OCCCC#N)c1 432799775 ZNBPLGMPOKXOST-UHFFFAOYSA-N 386.455 5.384 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(F)ccc1Br)c1ccccc1 433259495 QOFPSHUCOMRGPH-INIZCTEOSA-N 390.256 5.145 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)CC2)c1 435356009 DXCAXIWHNQZMSL-UHFFFAOYSA-N 397.409 5.032 30 20 GKED CCSCC[C@@H](C)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438672843 ROIMGANWQJTRCW-CQSZACIVSA-N 387.480 5.143 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@H]1Cc1ccccc1Cl)c1ccccc1 438850970 WORPATCOAHDCMG-FPOVZHCZSA-N 381.907 5.102 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442015358 WOIPKZQGONAMSH-UHFFFAOYSA-N 377.193 5.179 30 20 GKED N#CCCCn1cc(C(=O)Nc2nc(-c3ccccc3)cs2)c2ccccc21 443914898 HXVXWUFGVKLVEQ-UHFFFAOYSA-N 386.480 5.321 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)c[nH]1 444430031 DYEKTRKBQHNJFT-UHFFFAOYSA-N 394.843 5.194 30 20 GKED N#CCCC[C@H](NC(=O)C[C@@H](c1cccs1)n1cccc1)c1ccccc1 452141416 UPXUJIFJPNUULT-PMACEKPBSA-N 377.513 5.080 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1F 455046809 PEKFJOZYGNKXAP-MRXNPFEDSA-N 377.822 5.483 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)C(C)C)cc1 457536495 ZMWVJLKWJOYTFD-VXKWHMMOSA-N 379.504 5.127 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccco1)Cc1ccco1)c1ccccc1 458805875 VOQYNGVTCKJENF-NRFANRHFSA-N 377.444 5.020 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N1CCC[C@H]1c1ccc(C(C)C)cc1 460957696 ITAIKVGQWPWPNU-SFTDATJTSA-N 380.536 5.171 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCc3cncc4ccccc34)c2)cc1 462501670 LBCWLHYMYCRLNG-UHFFFAOYSA-N 393.446 5.470 30 20 GKED C[C@H](N[C@H]1CCC[C@@H](C#N)C1)c1nc(-c2ccc(Br)cc2)cs1 463241098 CBEZVUZTGDRONG-ZENOOKHLSA-N 390.350 5.306 30 20 GKED CCN(C(=O)c1cc(-c2ccc(C)cc2)nc2onc(C)c12)c1ccc(C#N)cc1 463958254 JTWLGQFIIYVMHR-UHFFFAOYSA-N 396.450 5.045 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c(F)c1 464092918 MQMBRDSUOCFGMP-UHFFFAOYSA-N 397.812 5.354 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)C[C@@H](c1ccccc1)C(F)(F)F 464957472 ZBYWILRFKZQHGZ-HSALFYBXSA-N 386.417 5.021 30 20 GKED Cc1ccc(C(=O)CCCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 467512915 KGGJBYPGQDICMA-SFHVURJKSA-N 389.282 5.036 30 20 GKED CC(C)C[C@H]1CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 467613369 LQOBWEDQZGCBPO-HXUWFJFHSA-N 391.515 5.232 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl)Cc1cccc(F)c1 468973872 LHWQYKPAWCNWKE-PXAZEXFGSA-N 379.262 5.082 30 20 GKED CSc1cccc(C)c1NC(=O)c1cccc(OCc2ccccc2C#N)c1 472240823 LSLPDFIVYPMBRB-UHFFFAOYSA-N 388.492 5.420 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 475495272 CYVJYCTXWZUYBV-UHFFFAOYSA-N 375.428 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1 475551768 YTMGNPYYDLFTMP-JOCHJYFZSA-N 380.507 6.437 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 476662595 FKYQMQBKJIQBKQ-UQBPGWFLSA-N 393.490 5.490 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2scnc2C2CC2)cc1 477057945 ODADDOIOGFHPDJ-UHFFFAOYSA-N 391.521 5.437 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC(F)(F)F)c1)c1nc(-c2ccccc2)cs1 477876701 LIEYUURLZVUKKS-HNNXBMFYSA-N 388.370 5.199 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H]1CCC(F)(F)C1 483475528 OHIREGVXQOCVOP-SNVBAGLBSA-N 378.366 5.085 30 20 GKED CC(C)(C#N)c1ccccc1COc1cccc(NC(=O)c2cccs2)c1 486901727 VVDJUUNVZQLUAU-UHFFFAOYSA-N 376.481 5.381 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc(Cl)s2)cc1 488009397 BCAINKNMSJSETD-UHFFFAOYSA-N 384.863 5.255 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 488340003 ZMAOQPYFKXFVAE-IBGZPJMESA-N 397.906 5.189 30 20 GKED C=CCC[C@H](C(=O)N(C)Cc1ccc(OC)c(OC(F)F)c1)c1ccccc1 488621095 CBTMIZRPYFYZBO-SFHVURJKSA-N 389.442 5.005 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 496670898 OQNLJLMDHWTAJO-UHFFFAOYSA-N 386.451 5.009 30 20 GKED Cn1c(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c(Cl)c2ccccc21 499837196 IDQOYABTIQLNTH-CYBMUJFWSA-N 392.673 5.133 30 20 GKED N#Cc1cccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)c1F 505846785 UHMGQNGMEUDHAY-OAHLLOKOSA-N 376.275 5.109 30 20 GKED C=C(C)[C@@H](NC(=O)Cc1c(C(C)=O)oc2cc(C)ccc12)c1ccc(F)c(F)c1 505899794 ATZHEWVULRIGJC-JOCHJYFZSA-N 397.421 5.198 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 509502790 JSMFBDLGENKDEO-QGZVFWFLSA-N 381.545 5.351 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1nc2ccccc2[nH]1 513742377 WEFYQQDZMVDSJR-HXUWFJFHSA-N 388.430 5.268 30 20 GKED COc1ccccc1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 514544265 FTWKQFFZTFQQKH-HXUWFJFHSA-N 390.870 5.185 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3nc4ccccc4cc3Cl)c2C#N)C1 515725777 BZXUOQRGQRWCBD-NSHDSACASA-N 381.888 5.198 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Sc2ccc(F)cc2F)c2ccccc2)cc1 517977892 LVBASJPUECJNOZ-OAQYLSRUSA-N 394.446 5.503 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCCCOC3CCCCC3)cc2)cc1 519987237 JZOXURRZPSJONM-UHFFFAOYSA-N 393.487 5.211 30 20 GKED COc1cccc(CN(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 520940449 RWUSWRVUQFGZCL-UHFFFAOYSA-N 387.439 5.023 30 20 GKED CC(C)CCOc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 521796892 IJZLUELSPIINRC-KRWDZBQOSA-N 382.529 5.758 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)sc1SCC#N 524105118 QZEFEPOQZZHMAK-QWRGUYRKSA-N 398.340 5.116 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)cc2c1 524250656 RBPUYHDSBUESDD-UHFFFAOYSA-N 395.462 5.488 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(N2CCC(C)CC2)c1 524826861 FAZIUHGMLFNIKT-UHFFFAOYSA-N 393.531 5.152 30 20 GKED C=CCn1c(SCCCSC)nc2scc(-c3cccs3)c2c1=O 525085617 KHJZVCXFKJBUHE-UHFFFAOYSA-N 394.612 5.218 30 20 GKED Cc1cccc(N(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)C(C)C)c1 533043625 YAHOHORVBGYPRU-SFHVURJKSA-N 381.545 5.100 30 20 GKED Cc1nc(C)c(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541095652 XTKQWBSJLACDEP-ZDUSSCGKSA-N 376.485 5.181 30 20 GKED CC(C)(C#N)NC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 542830548 FYXRNRPIKBINDA-UHFFFAOYSA-N 379.312 5.318 30 20 GKED C[C@@H](NC(=O)N[C@H](c1cccnc1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543004369 PPVMZRBSJYDHBM-OSPHWJPCSA-N 396.494 5.132 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3scnc3C3CCCC3)n2)cc1 546155827 ZGBDZLXDONBFCG-INIZCTEOSA-N 393.537 5.723 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C(F)F)cc1Cl 554133682 CIQLKJCCFCZBPP-SJLPKXTDSA-N 389.833 5.257 30 20 GKED CCOC(=O)c1oc2c(c1C)[C@@H](N[C@H](CCCC#N)c1ccccc1)CCC2 556202361 MOWMTTHNRNECHS-MOPGFXCFSA-N 380.488 5.167 30 20 GKED N#CCCC1CCN(c2nnc(-c3cc(Cl)ccc3Cl)n2C2CC2)CC1 568084379 LEOBKQHLNZAUDV-UHFFFAOYSA-N 390.318 5.107 30 20 GKED N#Cc1ccc(CNc2ccc3oc(C(F)(F)F)nc3c2)c(C(F)(F)F)c1 568378685 SUNVCRLIOUCDTE-UHFFFAOYSA-N 385.267 5.349 30 20 GKED CC(C)OCCCN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 573649955 NAVOSOOFOBTYPU-HXUWFJFHSA-N 399.922 5.274 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2nc3ccccc3cc2Br)cc1 573705734 AOVAHSRHQNVYMF-UHFFFAOYSA-N 394.272 5.051 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)s1 576023570 VZLDXLILOOKUAA-QGZVFWFLSA-N 386.318 5.031 30 20 GKED C=CCN(CCC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccc(OC)cc1 576893166 XXPCLYUPHZCIII-UHFFFAOYSA-N 393.314 5.019 30 20 GKED C=CCn1c(S[C@H](CCOC)c2ccccc2)nnc1-c1ccc(F)cc1 578148758 YIYNQKCROIHBRI-LJQANCHMSA-N 383.492 5.140 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccccc1)c1ccccc1C#N)c1ccccc1 578191643 YFLOYJKDQAROPC-JOCHJYFZSA-N 379.463 5.179 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)c1 589381899 APUYZTMTGKODBH-UHFFFAOYSA-N 375.424 5.356 30 20 GKED N#Cc1ccc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)s1 592372059 AMIVXINVQRGHHQ-UHFFFAOYSA-N 382.304 5.521 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)s2)C1 597911848 CVDLBIIJKYRTRH-ZDUSSCGKSA-N 394.418 5.080 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 600895976 DWXNDRIXEBSBIO-HNNXBMFYSA-N 392.421 5.173 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 603996162 CUCFOQPNWOLEOR-UHFFFAOYSA-N 393.306 5.195 30 20 GKED N#CCn1c(C(=O)N2CCC[C@H]2c2cccc3ccccc23)cc2ccccc21 609167237 YJSSUYWBCQLMJE-QHCPKHFHSA-N 379.463 5.295 30 20 GKED CCCN(C(=O)c1nc(-c2ccco2)sc1C)c1cc(Cl)ccc1C#N 609286241 PEQAEOJBKDXHEV-UHFFFAOYSA-N 385.876 5.293 30 20 GKED Cc1ccc2c(C3=CCN(c4nc(C(F)(F)F)ccc4C#N)CC3)c[nH]c2c1 609669707 IUXHXSKCKJCVIX-UHFFFAOYSA-N 382.389 5.056 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)c1ccccc1C(F)(F)F 610227846 NJOLCQNAVPLKAY-KBPBESRZSA-N 392.446 5.699 30 20 GKED C[C@H](NC(=O)Nc1cccc(CSC2CCCC2)c1)c1cccc(C#N)c1 610326571 BINHPXQFWFKVJZ-INIZCTEOSA-N 379.529 5.617 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@H](C)c1ccncc1 610722615 HYJOIVCMUZPCOK-KRWDZBQOSA-N 387.458 5.128 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1C1CC1 611197842 GVXAOGWQLHCTRL-JTQLQIEISA-N 377.275 5.162 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)c(F)c1 611465410 KVKBOKVSDLYJNZ-ZWKOPEQDSA-N 382.323 5.257 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cc(Cl)ccc4o3)n2)cc1 613318051 KFEYFZHMQFXLLY-MRXNPFEDSA-N 392.867 6.008 30 20 GKED CC(C)(C#N)c1ccc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)cc1 614176388 ZHKKJJUHIDDFLD-HNNXBMFYSA-N 393.478 5.343 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)NCc2ccc(C#N)c(Cl)c2)c1C 619789328 PUTKWLOZJIMNFB-UHFFFAOYSA-N 399.922 5.547 30 20 GKED C=CCOc1c(Cl)cc(CNc2ccc(NC(=O)C(C)C)cc2)cc1OC 623365171 HYVBNCINDKWONV-UHFFFAOYSA-N 388.895 5.120 30 20 GKED Cc1nc(NC(CCC(F)(F)F)CCC(F)(F)F)cc(C(F)(F)F)n1 664469855 OQMXAWUZRAMATR-UHFFFAOYSA-N 383.258 5.269 30 20 GKED C=C(CNC(=O)c1ccccc1SCc1c(C)noc1C)c1ccccc1 673343422 RENXDLOZLNHUGD-UHFFFAOYSA-N 378.497 5.027 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc(OC)c1C(C)C 679730637 VOHJOQVLCRECIA-AWEZNQCLSA-N 398.459 5.066 30 20 GKED COc1c(O)cccc1/C=C\C(=O)c1sc(-c2ccc(Cl)cc2)nc1C 727654181 IMUPPPRMMOWXJM-FLIBITNWSA-N 385.872 5.382 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1nc2ccccc2s1 730071680 QHCYDNIPUDKCNH-WMZOPIPTSA-N 378.497 5.454 30 20 GKED N#C[C@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1c(Cl)cccc1Cl 730092826 QWCCXXAYFMZQAL-ZDUSSCGKSA-N 392.044 5.434 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)cc1Cl)c1nc2cc(F)ccc2s1 730422874 XVZWOZXFXDWADR-GFCCVEGCSA-N 379.243 5.161 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(Cl)c1 730962410 RFDMFQXSEJPGAZ-HXUWFJFHSA-N 376.843 5.256 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=S)Nc2cc(Cl)cc(Cl)c2)c1 733754208 HNVHMBVBSYJOSS-MRXNPFEDSA-N 394.327 5.161 30 20 GKED C=CCn1c(-c2ccncc2)nn(CN2CCCC3(CCCCCC3)C2)c1=S 743385807 OOVVWRWGIILYCW-UHFFFAOYSA-N 397.592 5.056 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)s1 744016733 SLJSXRJKNCHNST-WCQYABFASA-N 385.286 5.039 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1cccc(Cl)c1 744031400 VWAGCKDGOIVQCH-YGRLFVJLSA-N 395.673 5.098 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Sc2cc(Cl)ccc2Cl)n1 747199432 TVKFYLVLECZQKU-JQWIXIFHSA-N 399.368 5.930 30 20 GKED COc1cccc(/C=C2/CCc3cc(SC)ccc3C2=O)c1OC(F)F 748148229 RMPDMOBMDRPULT-RAXLEYEMSA-N 376.424 5.231 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2c(C)nn(CC)c2C)cc1OCC 750907906 BSHSDQYLXRYXLG-MDZDMXLPSA-N 390.911 5.257 30 20 GKED N#C[C@@H](NC(=O)c1sccc1SC(F)F)c1c(Cl)cccc1Cl 768139795 ILOYJACZGNCZII-SECBINFHSA-N 393.267 5.364 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@H](O)c2ccc(Cl)cc2Cl)CC1 768403056 NAICVQVZOBYIMK-SGDIKTSBSA-N 389.326 5.021 30 20 GKED C=C(C)[C@@H](NCC(=O)Nc1ccccc1SC(F)F)c1ccc(F)c(F)c1 775722884 DNWHAWQCYPYNOD-GOSISDBHSA-N 398.425 5.125 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccnc(Cl)c1 782194035 KSQHXACEGSJSIS-UTCJRWHESA-N 391.279 5.320 30 20 GKED C[C@H](ON=C(c1ccccc1)C(F)(F)F)c1nnc(-c2cccc(Cl)c2)o1 784670535 FVPZTRUIADDSPF-NSHDSACASA-N 395.768 5.434 30 20 GKED O=C1/C(=C/c2cnc(-c3ccco3)s2)CCc2ncc(C(F)(F)F)cc21 789146711 BKQGXMIJSGENRI-UXBLZVDNSA-N 376.359 5.029 30 20 GKED N#C[C@@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1nccc2ccccc12 792097600 XWTAWUPSBHYICW-OKPNHQCWSA-N 398.462 5.852 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571037 LIQKDHVQQWAPEM-IUODEOHRSA-N 394.462 5.514 30 20 GKED CC(=NNc1ccc(C#N)cc1C(F)(F)F)c1c(C)nn(-c2ccccc2)c1C 799492870 WEELGEXAHKONKC-UHFFFAOYSA-N 397.404 5.216 30 20 GKED Cc1ccc(-c2csc(COC(=O)C[C@H](CC#N)c3ccccc3)n2)cc1 803512122 IQNVUSAGVFLUGX-IBGZPJMESA-N 376.481 5.249 30 20 GKED O=C(Nc1cccnc1)/C(=C/c1csc2ccccc12)C(=O)c1ccccc1 810237179 RAFIBPKZFREMJD-DEDYPNTBSA-N 384.460 5.201 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(Cc3cccs3)CCCCC2)c1 810403018 LVSLWQRZWMTLNZ-IBGZPJMESA-N 396.556 5.238 30 20 GKED COC(C)(C)c1nc(C)c(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)s1 810528162 PZHJFJKODVWIGX-UHFFFAOYSA-N 392.480 5.091 30 20 GKED CCc1ccc2c(CNc3ccc(Oc4ccnc(C#N)c4)cc3)cc(=O)oc2c1 811777790 HJEWPFBYZHALQB-UHFFFAOYSA-N 397.434 5.026 30 20 GKED CC(=NNc1ccccn1)c1sc(-c2ccc(Br)cc2)nc1C 814732064 WAXDMNQAKZNVJS-UHFFFAOYSA-N 387.306 5.112 30 20 GKED CC(C)(C#N)[C@@H]1CCCC1=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 814926881 OEUOIFOLFDGQJO-OAHLLOKOSA-N 387.409 5.280 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@]23CCCC[C@H]2C3(F)F)cc1 821861130 PGYCAZYYNINAOR-SJBKTWHCSA-N 380.438 5.496 30 20 GKED FC(F)(F)c1cc(NN=Cc2cnc([C@H]3CCCO3)s2)ccc1Cl 844606707 FXSBVEYMQUJAGJ-CYBMUJFWSA-N 375.803 5.113 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1ccc(Cl)c(C#N)c1 862718726 NFQVVDKMCHKKLD-UHFFFAOYSA-N 385.851 5.119 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCCc2ccccc2)cc1 915352005 FFLVFCOTPLYQCJ-XMMPIXPASA-N 383.495 5.486 30 20 GKED C=CCc1cc(CN2CCC[C@H]2c2nc3ccccc3s2)c(O)c(OC)c1 915814363 XRBXNKVWDAQACD-SFHVURJKSA-N 380.513 5.076 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1 916943515 YZICTHIIPXNFIJ-LLYBFZRZSA-N 393.657 5.008 30 20 GKED Cc1ccc(-c2nnc(S)n2N=Cc2cc(-c3ccccc3)cs2)cc1 917534760 OGPIZTYAZUCVFH-UHFFFAOYSA-N 376.510 5.153 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C\c1ccc(Br)o1 917713150 HBNTYCBZCVZQJI-CLFYSBASSA-N 399.269 5.294 30 20 GKED O=C(O)c1ccc(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1F 1776074814 WFLOXCYUXVZWNF-AWEZNQCLSA-N 380.341 5.278 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3cc(Cl)nc(Cl)c3)s2)cc1 1776081850 KKYSGGUGROHFBO-UHFFFAOYSA-N 392.267 5.261 30 20 GKED C[C@H]1/C(=C\c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2c(O)ccc(F)c21 1776586630 IZDNZTKKEMEWED-HTMJNSLASA-N 388.394 5.280 30 20 GKED C[C@H]1C/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2sccc21 1776589448 BDIRQDZAHNXWDX-YGRGUWMTSA-N 380.490 5.948 30 20 GKED CCc1c(C(=O)/C=C\c2cccc(O[C@@H](C)C(=O)O)c2)oc2ccc(C)cc12 1776956207 KNNGUXVYVLEVQX-KVPUOBJLSA-N 378.424 5.052 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C/C(=O)c1ccc(C(=O)O)s1 1777341951 IAPURDGXZSBDHF-VQHVLOKHSA-N 378.449 5.326 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3C3CC3)cc2)CCC1 1786054789 KDMHDPJCQYMOOI-NHCUHLMSSA-N 394.559 5.159 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)cc2)=C(/S)Nc2ccccc2F)cc1 22696074 WYKHEVYENZANLZ-UHFFFAOYSA-O 393.507 5.035 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1cccc(C)c1 25352739 BFFQRJIFFMHDJG-UHFFFAOYSA-N 394.525 5.448 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Cl)c(Cl)c3)n2)cc1 60477258 IDCNJQQXZVCNLO-AWEZNQCLSA-N 387.291 5.915 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 62407271 BUIQGHZGHWQLJS-UHFFFAOYSA-N 375.472 5.221 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)CC(C)(C)c1ccccc1 63404041 IIIXLJWQFGDAKH-LJQANCHMSA-N 375.516 5.012 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 65438385 PIRICCSCAGBEGU-UHFFFAOYSA-N 382.357 5.073 30 20 GKED Cc1ccc([C@@H](C)N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 108359464 QWFFCCLFEUZUSY-ZWKOTPCHSA-N 381.545 5.021 30 20 GKED CCCCn1c(SCc2ccc(F)cc2C#N)nnc1-c1ccc(OC)cc1 112529936 HQJFMFRGWWJNLY-UHFFFAOYSA-N 396.491 5.057 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC[C@H]4CCC[C@H]43)c2)cc1 120114788 MJZMCAYSHSLMNT-NFBKMPQASA-N 389.499 5.128 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1ccccc1 134932728 ZXKKZBRMTKAYJV-MMTVBGGISA-N 389.520 5.293 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1OCC(F)F 137456244 NHMZCBSDIPLSRW-CYBMUJFWSA-N 391.443 5.369 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c1C1CC1 159658675 YMTUGAJCFBPOIU-MGPUTAFESA-N 378.520 5.024 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](Cc2ccccc2)c2cccs2)c1 175980079 VVOQHZUEBVKLJW-IBGZPJMESA-N 378.522 5.078 30 20 GKED CO[C@H](C)c1nc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)cs1 177517009 CMKBIXDTMHKRKF-CYBMUJFWSA-N 383.448 5.266 30 20 GKED N#C[C@H](C(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2[nH]1 178988474 COVKIBRDMKHODW-CKXDQPNJSA-N 389.764 5.038 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(OCc3cccnc3)c2)c(C#N)s1 179547433 URGNNYKWSFRYKR-UHFFFAOYSA-N 391.496 5.144 30 20 GKED C=C(C)[C@H](NCc1cccc(SC(=O)N(C)C)c1)c1ccc(F)c(F)c1 187772532 MEKKZHMFJXJHEM-IBGZPJMESA-N 376.472 5.146 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)[C@H]2C[C@H]2C)cc1 189875826 BCBRONCPGVDKBV-IERDGZPVSA-N 376.500 5.385 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CNCc1ccc(C#N)cc1F 237711678 MSBBYKVDSYTULY-UHFFFAOYSA-N 396.469 5.148 30 20 GKED CC(=O)Nc1ccc(C(C)=NOCc2nc(C)c(-c3ccc(Cl)cc3)o2)cc1 254993133 ZMEVQKGUTXJQJH-UHFFFAOYSA-N 397.862 5.203 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ccncc2C)CC1 278273455 ATBQQHCZHUMPIF-UHFFFAOYSA-N 393.531 5.317 30 20 GKED N#Cc1ccc(SCC(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1 303211527 RMDJBVSBHNMMHO-UHFFFAOYSA-N 385.901 5.066 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl 303854184 SEYFVQADNWNJAS-MCIONIFRSA-N 388.895 5.616 30 20 GKED OC(=Nc1cccc2ccsc12)N1CCC[C@@H](c2ncc(C(F)(F)F)[nH]2)C1 328618825 VKXAYCGUKVGXHZ-GFCCVEGCSA-N 394.422 5.068 30 20 GKED Cc1sc2nc(CC/C(O)=N/[C@@]3(C)CCCc4ccccc43)nc(O)c2c1C 328646301 GUPGFTZKMGGARV-QFIPXVFZSA-N 395.528 5.155 30 20 GKED Cc1ccccc1[C@H]1C[C@H](/N=C(/O)N2CCC(C(O)=Nc3ccccc3)CC2)C1 329792602 AJCXKOBNAZTUBL-XUTJKUGGSA-N 391.515 5.155 30 20 GKED O/C(=N/[C@H]1CCc2c[nH]nc2C1)C1(c2cccc(C(F)(F)F)c2)CCCCC1 329869970 ZPLJMGXSCIZTKS-KRWDZBQOSA-N 391.437 5.144 30 20 GKED CC1(C)CCC(/N=C(/O)c2ccc(Br)cc2Cl)(C(=N)O)CC1 330490884 GCQOMWIUFFRDOL-UHFFFAOYSA-N 387.705 5.281 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1ccccc1Sc1ccccc1C#N 427760772 PJSAJMRIAQAWSQ-CQSZACIVSA-N 392.446 5.560 30 20 GKED CC(C)(C)OCc1cccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 431902317 OGECOYASNAVPCU-QFIPXVFZSA-N 393.531 5.236 30 20 GKED CCOc1ccc(N(CC)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 436502071 GBVBBMQFPNVDFB-INIZCTEOSA-N 383.517 5.395 30 20 GKED N#Cc1csc(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)c1 437570609 QUIWJWPGHMPZQI-UHFFFAOYSA-N 379.388 5.014 30 20 GKED N#Cc1csc(C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)c1 437703341 PDYJNIQLCLHXCS-UHFFFAOYSA-N 382.485 5.198 30 20 GKED Cc1cccc(C(NC(=O)N(C)Cc2ccc(C#N)cc2)c2cccc(C)c2)c1 439645632 UZJCFFQOTBLOFM-UHFFFAOYSA-N 383.495 5.106 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)[C@H]1CCOC(C)(C)C1 464684703 HLWRYICBGPIQBQ-IBGZPJMESA-N 394.540 5.129 30 20 GKED Cc1nc(C)c(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 466115041 XXDQPRPNTDPHQT-UHFFFAOYSA-N 392.484 5.054 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)CC2 468970024 NVMMURAGGLTQLH-QFIPXVFZSA-N 398.462 5.336 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1cnc2ccccc2c1 470893286 XIXPLRQXDUDBCJ-MRXNPFEDSA-N 375.497 5.200 30 20 GKED C[C@@H](Nc1ccc(NC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)cc1)c1ccccc1 471947496 SAIYKSRLLQACAG-XMSQKQJNSA-N 394.478 5.052 30 20 GKED N#Cc1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)s1 474261000 WLROOPVLJPVRCH-GFCCVEGCSA-N 392.324 5.062 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 480287772 MABMAIJVHKRPJG-IBGZPJMESA-N 383.879 5.368 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)c2)c1 483237050 ALSUBLZEPHOUDB-NRFANRHFSA-N 393.446 5.007 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@H](c1cccs1)C(CC)CC 483258609 NHTOJRLTCQUGIT-FQEVSTJZSA-N 390.549 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CC1 485390313 YLIBEQBOZZIXFV-AWEZNQCLSA-N 385.920 5.403 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1 485464103 LDMKJQCHUPFKAC-INIZCTEOSA-N 385.529 5.252 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 485473628 ZYRIGWBQKBFWTG-HKUYNNGSSA-N 391.895 5.017 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1csc(-c2cccc(F)c2)n1)c1ccccc1 487519580 ZVOFXLMWQDMZJS-HXUWFJFHSA-N 393.487 5.043 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccccc1OCc1ccc(Cl)cc1 494154156 AWSBLCNQCKAWSP-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC(C)CN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1ccc(C#N)cc1 499318268 HFCLMPHEKBQUDU-UHFFFAOYSA-N 379.460 5.067 30 20 GKED C[C@H]1CCN(CCCC2(C#N)CCOCC2)[C@@H]1c1ccc(C(F)(F)F)cc1 499569626 CCDLDUJGEMJMCH-LPHOPBHVSA-N 380.454 5.189 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)c1 500203041 GBFRWCUSWDXFOH-UHFFFAOYSA-N 398.381 5.025 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 500727078 VWXPSTKXAKISIR-UHFFFAOYSA-N 397.466 5.036 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@](C)(C#N)CC(=O)OC(C)(C)C)c(C)c1 503055183 OKHMPSGVKFSGQA-BTYIYWSLSA-N 390.549 5.086 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1cccc2[nH]ccc12 506203489 AFERVTTWMLFLCW-UHFFFAOYSA-N 397.503 5.163 30 20 GKED COc1cc([C@@H](C)NC(=O)c2cc(C#N)ccc2Cl)ccc1OC1CCCC1 506357067 QHGNHKIAJOHMOO-CQSZACIVSA-N 398.890 5.033 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Cc2ccccc2Cl)cc1 512540148 KLEUDPXXPNWUFZ-UHFFFAOYSA-N 392.842 5.194 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 512843121 FHPKTGALSXUILE-UHFFFAOYSA-N 384.435 5.476 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 516380481 ONXAUKSILOLDEU-BFUOFWGJSA-N 388.298 5.473 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(-c3cc[nH]n3)c2)cc1 517353019 JLZRUIRTISOCJD-UHFFFAOYSA-N 398.397 5.132 30 20 GKED Cc1cc(C)cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 518669002 YFPJMIPYCSYXKN-UHFFFAOYSA-N 378.419 5.580 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(-c4cccs4)on3)c2)cc1 519122414 FBMLJVRRBUOMRJ-UHFFFAOYSA-N 387.420 5.319 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCCC1 520941126 DSSHDXBUTVHBCI-MRXNPFEDSA-N 397.519 5.811 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccccc2Cl)c1 522575018 NBQDODBQHHUYKH-UHFFFAOYSA-N 383.234 5.910 30 20 GKED CC(C)c1nc2cc(NC(=O)Nc3cccc(OCCCC#N)c3)ccc2o1 522782441 ZBRRKJMQKDHBFD-UHFFFAOYSA-N 378.432 5.278 30 20 GKED C[C@H](CC(=O)Nc1ccccc1SCCC#N)c1cccc(C(F)(F)F)c1 523086963 CZTCQVMOEXVGRO-CQSZACIVSA-N 392.446 5.843 30 20 GKED C[C@@H]1CCC[C@](C#N)(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 523970623 SMBISSGMKLNPGI-QRQCRPRQSA-N 393.874 5.206 30 20 GKED N#CC1(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)CCCCC1 524429428 AHYUAEDFDRTJOE-UHFFFAOYSA-N 376.485 5.127 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@@H](c3cccc(Cl)c3)C3CCCC3)o2)c1 537125859 JQVGGALBINHOIU-OAQYLSRUSA-N 392.890 5.283 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(OCC(F)(F)F)cc1 538527283 BFDGUKMCQWMXJU-OAHLLOKOSA-N 378.394 5.483 30 20 GKED C[C@@H](NCc1csc(C(C)(C)C)n1)c1ccc(-c2cccc(C#N)c2)cc1 543873069 MXIQHKKSCCDTHV-MRXNPFEDSA-N 375.541 5.830 30 20 GKED C=C[C@@H](Cc1nc(Cc2ccc(OCc3cccnc3)cc2)no1)c1ccccc1 544965541 KVCPXAXPIOQSPE-NRFANRHFSA-N 397.478 5.147 30 20 GKED N#CC1(c2ccc(-c3nc([C@H](F)c4ccc(C(F)(F)F)cc4)no3)cc2)CC1 548891161 CRNHXHIYVCKJKY-MRXNPFEDSA-N 387.336 5.369 30 20 GKED C=CCn1c(SCc2ccc(C(F)(F)F)cn2)nnc1-c1ccc(C)cc1 551084723 AVJUAOPFFFAPIX-UHFFFAOYSA-N 390.434 5.146 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccc(F)cc1 557553140 AJKZFIQOBOJJHA-KRWDZBQOSA-N 399.535 5.069 30 20 GKED C=CCn1c([C@@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@@H]1c1ccsc1 580008372 HUKFDFJOOLCOIE-DNVCBOLYSA-N 398.507 5.146 30 20 GKED C=CCN(C(=O)c1cc(C#N)ccc1Cl)c1nc(-c2ccccc2)cs1 580595412 FWYUZFPCFBRBLY-UHFFFAOYSA-N 379.872 5.168 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 582882361 DUWHNERSJWYMSO-RXVVDRJESA-N 379.504 5.269 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 590829317 CJSYHXPTMFPALH-ROUUACIJSA-N 375.394 5.024 30 20 GKED C=CCN(C(=O)CCc1c(C)nn(Cc2ccc(C)cc2)c1C)c1ccccc1 592585009 JMKQDIAHTGCFJU-UHFFFAOYSA-N 387.527 5.008 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](c1ccccc1)c1ccccc1OC 595002219 GRXMNTJHJCRDAK-DEOSSOPVSA-N 386.495 5.182 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCOc2ccccc2[C@H]1C 596736090 SDMDZJWYFCVVCE-JKSUJKDBSA-N 381.501 5.068 30 20 GKED CCC(C#N)(CC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 599769642 XJFBEMMBBCCAGT-UHFFFAOYSA-N 383.879 5.169 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2ncccc12 603461739 PEXSPLNWGTZVLK-UHFFFAOYSA-N 381.460 5.510 30 20 GKED N#Cc1ccsc1NC(=O)c1cc2ccccc2n1Cc1ccccc1F 603750207 KOYYPSOPAXPQTJ-UHFFFAOYSA-N 375.428 5.014 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(F)ccc1SCC(F)F 606585718 XGZMCCJUIGEQDP-UHFFFAOYSA-N 380.435 5.403 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 609123820 KVBIOOYBYKSMMH-UHFFFAOYSA-N 395.459 5.002 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208910 PVKHGCIYMYOINK-UHFFFAOYSA-N 389.430 5.196 30 20 GKED N#Cc1ccc(CNC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c(F)c1 609254381 MASWJRWSJBOAGM-SFHVURJKSA-N 392.261 5.051 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1csc(-c2cccs2)n1 609375720 SDOWYWSVEZZWGY-UHFFFAOYSA-N 385.539 5.059 30 20 GKED Cc1ccc(Cl)cc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 609552211 CTPOUCPXJSFTSX-UHFFFAOYSA-N 383.879 5.032 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)s1 610172687 VXJFWBPPTLKYPN-UHFFFAOYSA-N 394.500 5.073 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(NC(=O)C2CCCCC2)c1 611391735 HSXMRTBUIYLHMD-XMMPIXPASA-N 387.527 5.244 30 20 GKED O=[N+]([O-])c1cccc(F)c1CN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 611434621 DDSUPNGEMCUKLW-CQSZACIVSA-N 396.262 5.146 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OCC(F)(F)F)cc1 616082571 BFMONOAROZCYGV-UHFFFAOYSA-N 389.826 5.171 30 20 GKED Cc1cc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c(C(F)(F)F)o1 619126737 MGMWVSOUWUCHJN-UHFFFAOYSA-N 399.253 5.390 30 20 GKED COc1cccc(C[C@H](NCc2ccc(C#N)c(Cl)c2)c2ccccc2)c1 619755850 WCUCXMMBCZMBPU-QHCPKHFHSA-N 376.887 5.294 30 20 GKED CN(C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)[C@H]1CCCC[C@H]1C(F)(F)F 643808857 JRIWSIFRWYXPRK-SKDRFNHKSA-N 389.286 5.177 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3c[nH]nc3C(C)(C)C)s2)cc1 727974389 JPKFCPAQFGPDRH-DHZHZOJOSA-N 381.501 5.044 30 20 GKED C[C@H]1CCCC[C@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1 727979996 AOJWWUHTPKZUGN-HRAATJIYSA-N 379.529 5.002 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(-c2ccc(F)cc2)s1 728440080 IKVVVHBQKGGSKJ-SREVYHEPSA-N 381.259 5.491 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)C 729888869 JWZGSCGKJONODJ-PKOBYXMFSA-N 378.472 5.199 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCc3ccc(F)cc32)cc1 730131383 LNAWBXXTEKHHMJ-XZOQPEGZSA-N 385.442 5.290 30 20 GKED COc1ccc(/C=C/C(=O)c2c(C)nn(-c3ccccc3)c2C)c(Cl)c1OC 730433397 FWXJNVZDQDZWPS-ZRDIBKRKSA-N 396.874 5.056 30 20 GKED CCc1cc(NN=C(C)c2cc(Cl)sc2Cl)nc(-c2ccccn2)n1 730463314 BDGGEUUTFBTHED-UHFFFAOYSA-N 392.315 5.305 30 20 GKED Cc1cc(C)cc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 730664615 NFCZFASERAFZFZ-YADARESESA-N 383.495 5.842 30 20 GKED CC1(C)/C(=C\c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2ccccc21 730949708 ZVCXKLABYNQCJU-MOSHPQCFSA-N 388.419 5.114 30 20 GKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1ccc(N2CCC(O)CC2)cc1 734235532 QDNFRWLPOKXJJV-KHPPLWFESA-N 389.520 5.272 30 20 GKED N#Cc1ccc([C@@H](Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)C(N)=O)cc1 734507002 JGOFUPABPPIQMN-HXUWFJFHSA-N 396.277 5.171 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccncc1 734661015 DFXXTYWUBIGYCX-AZUAARDMSA-N 397.931 5.503 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)cc1 739156592 ZJMMKMCLCPXHJO-QAPCUYQASA-N 382.891 5.305 30 20 GKED CCOc1ccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 739437145 JTRMCICDOWSPNI-UHFFFAOYSA-N 393.537 5.172 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744017068 YAOCTZPESLFURE-ABDJAZHISA-N 380.369 5.533 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@H](Cc3ccccc3)c3ccccc3)[nH]c12 744161627 VYJXHOXNAGLQFP-FCHUYYIVSA-N 393.490 5.464 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccccc1OCc1cscn1 749451003 GPHWUFYFKQOZKG-UHFFFAOYSA-N 379.268 5.485 30 20 GKED C#CCCCCNC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 752310809 YNSOWAMSBMBTAV-UHFFFAOYSA-N 394.862 5.001 30 20 GKED CC1(C)CCCC[C@@H]1CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 752483316 MLDPEZUQNMKBAQ-MSOLQXFVSA-N 377.513 5.465 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1 758471338 AYBGYFMKSFJANM-UHFFFAOYSA-N 396.453 5.028 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cnc(Cl)c2ccccc12 766394333 XXVMLTSREJYRMX-UHFFFAOYSA-N 387.826 5.200 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2cc(C(F)F)ccc2Cl)cc1OC 768901451 XZLUAWLYCWWLLU-UITAMQMPSA-N 393.817 5.503 30 20 GKED C=CC[C@H](C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1 778696261 ITQIMSSRDGOTTK-NSHDSACASA-N 390.270 5.061 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Br)cc2)c2ccccc2F)cc1 779017643 JMXJWAUTQVOWST-NRFANRHFSA-N 395.275 5.339 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 779397222 SEORGKJLBMSRSJ-AOMKIAJQSA-N 385.471 5.154 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC(C)(c1ccccc1)c1ccccc1 780668378 VHMKVYDRLZIGSG-SFHVURJKSA-N 385.467 5.063 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2ccccc2)cs1 786319718 UCWSNWGLGQRLEM-MCIONIFRSA-N 384.913 5.505 30 20 GKED Cc1ccc(-c2ccncc2)cc1NC(=O)C#Cc1ccc(C(F)(F)F)cc1 790565553 DGABIICHSCARCI-UHFFFAOYSA-N 380.369 5.066 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(OCC(C)C)cc2)cn1 792867008 SMQRQSRKTKOHCG-JYRVWZFOSA-N 388.467 5.083 30 20 GKED COc1cccc(C2(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)c1 795204274 IJORWIGHXKFQRV-QHCPKHFHSA-N 382.463 5.021 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 796648720 DYHHTDMSVQEKGO-KKSFZXQISA-N 398.487 5.607 30 20 GKED COc1cc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 797614908 GLNKLDCAQFBERG-QGZVFWFLSA-N 396.899 5.200 30 20 GKED Cc1nc(Cl)ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 802043661 LOXVRMXFROZTPR-AWEZNQCLSA-N 388.279 5.310 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2cccc(-c3ccccn3)c2)C(=O)c2ccccc21 802709510 QRDQELLJGZQBTA-JXTFVVQCSA-N 383.447 5.065 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)Cc2c(Cl)cccc2Br)n1 850874284 XUOIMBNBZQPJGW-NSHDSACASA-N 397.725 5.101 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1 860626973 CVOCDAVAZLLOQU-BTHPGYMESA-N 391.540 5.348 30 20 GKED N#Cc1c(F)cccc1CNc1ccccc1SC[C@H]1CC1(Cl)Cl 864005649 FUAXKFOXLNCGNT-CYBMUJFWSA-N 381.303 5.595 30 20 GKED C=CCCC[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C(=O)O 900068519 JYNBIASIGPAWHM-AWEZNQCLSA-N 385.316 5.016 30 20 GKED COc1cc2c(cc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1)oc1ccccc12 915306697 RJTYOXJJLPIPCA-AWEZNQCLSA-N 385.423 5.349 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2cccs2)C2CC2)cc1 915354092 VAZQSKWTVFEJAD-IRLDBZIGSA-N 387.508 5.676 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccco1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917029848 CEGMTTLGFUIERJ-OQJYLFSOSA-N 378.497 5.094 30 20 GKED C=CCn1c(-c2ccccc2OC)nn(CN(C2CCCCC2)C2CC2)c1=S 917428639 FVWIRTUYAURPTO-UHFFFAOYSA-N 398.576 5.030 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1csc(-c2ccsc2)n1 920065691 GQGVECDXBYSURF-CKXDQZPMSA-N 394.477 5.610 30 20 GKED CC(C)(C)C(=O)Oc1ccc2c(c1F)CCCC=C2B1OC(C)(C)C(C)(C)O1 1690107120 QIXFYXHEAIEYJN-UHFFFAOYSA-N 388.288 5.128 30 20 GKED O=C(/C=C/c1c(F)ccc2sc(C(=O)O)cc12)c1ccc2c(c1)CCCC2 1776113477 KZIILVNGKOQNDT-VQHVLOKHSA-N 380.440 5.514 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cn(CC(=O)O)nc2-c2ccccc2)cc1 1776697680 MJXRLDOWGYFMBR-TUQDCPSNSA-N 388.467 5.044 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(Oc2ccc(F)cc2)c1 1776783814 NKEUYKFRJBRHLK-FQEVSTJZSA-N 387.495 5.911 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)c2ccccc2Cl)c1 1776787455 SECPWHFSOSYSCM-NRFANRHFSA-N 389.923 5.605 30 20 GKED CCCCOc1ccccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776803790 RDAOWIBFYKAFLJ-OUKQBFOZSA-N 390.435 5.720 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(O)c(C(=O)O)c1 1777487716 JHOQJMIZIKEESD-YCRREMRBSA-N 399.855 5.072 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4nc(Cl)ccc4C3=O)s2)c1 1777684351 USADUHHOOVFMPM-QBFSEMIESA-N 395.867 5.374 30 20 GKED CCc1ccc(OCc2nnc(S[C@H](C)C#N)n2[C@H](C)c2ccccc2)cc1 7196531 YITISRVZZDUSAF-IAGOWNOFSA-N 392.528 5.033 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1cc2ccccc2c2cccnc12 62897695 ZLGMXZHTVAEFOG-UHFFFAOYSA-N 397.434 5.125 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66800437 IDRMURPTLIMHIV-QGZVFWFLSA-N 381.545 5.175 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)c(F)c1 66800808 PAGBMSQOAJSKRB-NSHDSACASA-N 393.281 5.235 30 20 GKED C[C@H](OCCCNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 66955136 YKWXCHUMHQFKIT-MSOLQXFVSA-N 397.544 5.370 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccccc2)cs1 107375225 UBZUCNODAKITKF-HNNXBMFYSA-N 390.512 5.494 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 111766096 FXYVAHOBCWIPBZ-WBVHZDCISA-N 399.947 5.613 30 20 GKED Cc1nc(Cl)ccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 128390602 CGNIGFFWXWGYCK-UHFFFAOYSA-N 399.825 5.320 30 20 GKED N#C[C@H](C(=O)c1cncc(F)c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 151678895 XUSNHIWJOSKVTD-CYBMUJFWSA-N 392.242 5.141 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)o1 153969023 CTUGONUCFUEMCG-QFBILLFUSA-N 397.544 5.989 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)c1ccccc1 155762582 RYQAKSZDBPEHEC-LYZGTLIUSA-N 398.572 5.563 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)c2ccc(Br)cc2)n1 156452451 MPFQPGKDXLNVEM-SMDDNHRTSA-N 377.307 5.009 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2OCC#N)c(C)n1[C@@H](C)c1ccccc1 159433937 SNZLYXXAXBDULZ-INIZCTEOSA-N 391.446 5.008 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC(C(F)(F)F)CC2)cc1 175573094 WTORQGDMQGWXBY-UHFFFAOYSA-N 389.377 5.157 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccnc3C(F)(F)F)cc2)c1 188380283 YMEQNUSIAIOUPC-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccnc2ccccc12)c1nc2cc(Cl)ccc2s1 254993160 BRXSZEMRLRLEGL-WRLNGNIRSA-N 389.867 5.388 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 303362284 QGMVRSPVUDKMAI-IAGOWNOFSA-N 396.556 5.784 30 20 GKED O=C1CC[C@H](/C(O)=N/CCc2nc(C3CCCCC3)cs2)c2ccccc21 328794607 BMYQDSJAKXHVHQ-SFHVURJKSA-N 382.529 5.450 30 20 GKED CC(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 329159798 DYXCPDJRVYSRKF-YZGWKJHDSA-N 377.550 5.204 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] 410757394 ZMBFBGMYAKXFSF-UHFFFAOYSA-N 392.377 5.718 30 20 GKED N#Cc1c(F)cccc1CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 428504493 UXSFHGDMIPSFRR-INIZCTEOSA-N 390.302 5.499 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)c1cccc(SCC#N)c1 430621012 IYUKAGAXXFPZBW-HXUWFJFHSA-N 392.549 5.386 30 20 GKED C=CCC[C@H](NC(=O)c1sc(NC(=O)c2ccco2)cc1C)c1ccccc1 435278472 GGKNLPGREKJMDI-KRWDZBQOSA-N 394.496 5.339 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@@H](C)c1ccc(Cl)cc1 437854571 ZKSBWFNYXYRPAQ-AWEZNQCLSA-N 383.879 5.368 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 438465544 KSXDQDJOTRKNQF-NVXWUHKLSA-N 386.417 5.324 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1cccc(OC(F)F)c1 438641927 ONLXSBOEOQXFNV-SNVBAGLBSA-N 399.319 5.061 30 20 GKED N#CCC[C@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccccc1 445781928 DCMZPKIOFVPCOB-IBGZPJMESA-N 386.417 5.189 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)c3c(F)cc(C#N)cc3F)c2)C1 445960741 QHPOLMXAJWYFEH-KDOFPFPSSA-N 384.426 5.184 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)on2)c1 448098935 OJHVFHNDAPRPQS-UHFFFAOYSA-N 391.736 5.138 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c(Cl)c1 455694656 AGAPPQIYQUZJIR-OAQYLSRUSA-N 392.890 5.646 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 458540366 WIOYHDNMTZPMNG-NXHRZFHOSA-N 381.442 5.089 30 20 GKED C=C(C)Cn1c(Cc2c[nH]c3ccccc23)nnc1N1CCC[C@@H]1c1ccccc1 460543469 MTOLYDKRNWVPMJ-HSZRJFAPSA-N 397.526 5.268 30 20 GKED C[C@@H](C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1)c1cccc(C#N)c1 462452398 QFMRKDLBHTUIDM-BEFAXECRSA-N 386.417 5.087 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OCC2CCOCC2)cc1 467917106 APXKFKAQTNQUBE-UHFFFAOYSA-N 394.515 5.102 30 20 GKED C[C@@H]1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)[C@H](c2ccco2)C1 469477896 LMJHPUQIVWCECU-UTKZUKDTSA-N 375.472 5.151 30 20 GKED C[C@@H](CCNC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 470468824 UKVQUYNEUPPPJP-LSDHHAIUSA-N 389.421 5.131 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc2c(cc1Cl)OCCCO2 471169213 KUMCKCSYFNJLSP-UHFFFAOYSA-N 386.879 5.112 30 20 GKED COc1ccc([C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)c2ccc(C)cc2)cc1 475172401 HWBNRKVJOSSTEC-ZEQKJWHPSA-N 398.506 5.297 30 20 GKED C=C(C)[C@@H](NCc1ccc(OCc2ccccn2)cc1)c1ccc(F)c(F)c1 479414183 UVJGSQQIULPNSR-HSZRJFAPSA-N 380.438 5.346 30 20 GKED N#Cc1cc(NC(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)ccc1F 481623228 JFESFZIZCLBJRQ-GOSISDBHSA-N 391.368 5.475 30 20 GKED N#Cc1ccccc1COc1cccc(CNC2(c3ccc(Cl)cc3)CC2)c1 482042916 PLXRPWVUUCDENT-UHFFFAOYSA-N 388.898 5.570 30 20 GKED CN(Cc1ccccc1C(C)(C)C#N)[C@H](c1ccc(Cl)cc1)c1cnccn1 486784529 ZAUHYVDVGORYSO-JOCHJYFZSA-N 390.918 5.153 30 20 GKED Cc1c(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cnn1CC(C)C 499868336 HPYKFNGLXNEUNX-UHFFFAOYSA-N 389.459 5.156 30 20 GKED C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CC=C(c2ccc(C#N)cc2)CC1 502508275 QRIYYAIOJIQXJG-OAHLLOKOSA-N 390.874 5.112 30 20 GKED CCN(C(=O)c1csc(-c2ccc(F)c(F)c2)n1)[C@@H](C)c1ccc(C#N)cc1 502724471 GANAQQUQCSBCMT-ZDUSSCGKSA-N 397.450 5.183 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCSc3ccc(Cl)cc3)CC2)cc1 504013626 QWLSYVDPKRFVMM-UHFFFAOYSA-N 382.916 5.010 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(OC)c(OC(F)F)c1 505036224 UMFIQYKKXNJSDQ-UHFFFAOYSA-N 390.430 5.079 30 20 GKED Fc1ccc2nc(CN[C@@H](c3ccccc3C(F)(F)F)C(F)(F)F)oc2c1 505833098 OXHSKZKHMJPUIR-HNNXBMFYSA-N 392.274 5.379 30 20 GKED CC(C)CCSCC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509966226 FQPUGNYYINASSV-UHFFFAOYSA-N 382.529 5.049 30 20 GKED Cc1sc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)c(C#N)c1C 510197428 JQMUPZHYJMNADZ-UHFFFAOYSA-N 383.860 5.330 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(-c4ncco4)c3)c2)cc1 513967031 CPOCRVQULXLVJS-UHFFFAOYSA-N 381.391 5.258 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CSc3ccccc3Cl)n2)cc1 515321795 FEDONNVGAJXLQN-UHFFFAOYSA-N 385.901 5.066 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCc1ccc(Cl)cc1 518683155 KKSOCQOHRJYBMS-HNNXBMFYSA-N 387.936 5.346 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccc(F)cc2)CCC1 520855443 NGDFEETXGBMBTH-MRXNPFEDSA-N 397.519 5.321 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccccc2)CCCC1 520938386 WYOGOWJZLLCAGG-GOSISDBHSA-N 393.556 5.714 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1 523123400 DKPQADDUFAIWEF-INIZCTEOSA-N 388.433 5.193 30 20 GKED N#CCCCOc1cccc(CN[C@@H]2CCOc3c(-c4ccccc4)cccc32)c1 524171031 NHNAPWXFSQYPEZ-RUZDIDTESA-N 398.506 5.650 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CC1CCSCC1 531882343 NQQZNQQQYULDEZ-UHFFFAOYSA-N 384.932 5.278 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 535436885 MVBIQVPUSVRWJM-WMZOPIPTSA-N 378.447 5.033 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H](c3cccnc3)C3CC3)c2)cc1 535487027 XHLDXYBOYZRQBH-QFIPXVFZSA-N 384.439 5.018 30 20 GKED C=CCC[C@@H](NCc1nc(-c2ccsc2)no1)c1ccc(C(F)(F)F)cc1 537129365 RCHVEGHUVIRHHR-MRXNPFEDSA-N 393.434 5.614 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2cccc(Cl)c2)o1 541172392 VRLUTIBHFGGRJZ-SNVBAGLBSA-N 376.268 5.768 30 20 GKED N#CCC1CCN(C(=O)c2cc(F)ccc2Sc2ccc(Cl)cc2)CC1 545452381 WMWPFBQTVUSOSY-UHFFFAOYSA-N 388.895 5.396 30 20 GKED C=CCC[C@H](Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1)c1ccco1 552284376 XZJMFVZMLOVEPN-QFIPXVFZSA-N 395.524 5.514 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1oc(C(C)C)nc1C 556028639 PPDVNCDKESWDGN-UHFFFAOYSA-N 391.446 5.273 30 20 GKED C=C(C)Cn1c([C@H](CC)c2ccccc2)nnc1N1CCC(OC(C)(C)C)CC1 559011142 QOSSHPRSEJFXKQ-OAQYLSRUSA-N 396.579 5.180 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl)c1cccc(Cl)c1Cl 561290240 BOLZFHMOTCCYHM-IOASZLSFSA-N 379.674 5.131 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1cccs1 562174232 IWRGNPKWWFYJMW-KBXCAEBGSA-N 385.558 5.757 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)CCCCCC#N 588153485 YIBVPHPQSPQGKR-UHFFFAOYSA-N 392.421 5.788 30 20 GKED Cc1sc([C@@H](C)NC(=O)CCCCCC#N)nc1-c1ccc(Cl)cc1 588161487 OEGKAVQQYHOJOW-CYBMUJFWSA-N 375.925 5.423 30 20 GKED Cc1cccc2sc(C(=O)Nc3sc4c(c3C#N)CCCC4)c(Cl)c12 602092117 DXXCQYLYULHTTJ-UHFFFAOYSA-N 386.929 5.927 30 20 GKED C[C@H](CN(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1)c1ccccc1 608947951 JYKBNDOCBMPBRR-LJQANCHMSA-N 384.479 5.013 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(-c2nc3c(Cl)cccc3[nH]2)cc1 608948062 RYQNLKWYTLBAMV-UHFFFAOYSA-N 378.844 5.069 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)CSc2nc(C)c(C)c(C)c2C#N)cc1 610179514 MHCJWGRHZXOCEY-NRFANRHFSA-N 393.556 5.033 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)c(Cl)c1 614058859 KRRQBRUJZUZQSV-UHFFFAOYSA-N 393.579 5.790 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1 614179539 RCYQLOOKWKGULM-LJQANCHMSA-N 384.523 6.014 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(C(F)(F)F)cc1Cl 618754330 RVYQFRMSZIYUKT-OAHLLOKOSA-N 379.769 5.039 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1csc(-c2ccc(OCC)cc2)n1 641986681 FRVHMUPAQCZMNC-UHFFFAOYSA-N 398.553 5.028 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1Cl 727627480 GQORCZOJEJTHRE-IFCKCIONSA-N 378.884 5.743 30 20 GKED C#CC[C@H](OC(=O)c1ccc(CSc2nc(C)cs2)cc1)c1ccccn1 727775344 FKKWXKQARHTALK-IBGZPJMESA-N 394.521 5.060 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(CCc2ccccc2)C2CC2)cc1 728738853 UKXXLWXVIOLXNI-RUZDIDTESA-N 395.506 5.581 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(C)cc3)s2)c1 733801076 RLZJWBKJHDNZOX-HXUWFJFHSA-N 376.525 5.694 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(OC3CCCC3)c2)c1 733842815 ABYZUSNHFGPBLG-LJQANCHMSA-N 393.487 5.011 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc(C)cc1 739153918 GNUUTAAQGYWINT-RHSMWYFYSA-N 386.854 5.019 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1cc(C)n([C@@H](C)c2ccccc2)c1C 741729497 QPJJNKHCCRWFKI-KRWDZBQOSA-N 390.458 5.118 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N[C@@H](C)c2csc3ccccc23)cc1 743474405 HWCJVZVUKOCNCH-ZWKOTPCHSA-N 391.540 5.196 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@]12CCCc1ccccc12)c1nc(-c2ccccc2)cs1 744037513 XJXYHWJTTPWPPL-DRMXPCRNSA-N 384.504 5.281 30 20 GKED Cc1ccc(-c2noc([C@@H](C)ON=Cc3cccc(Cl)c3Cl)n2)cc1F 744442260 AYAFISWVZORZHP-LLVKDONJSA-N 394.233 5.603 30 20 GKED CCn1cc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc21 748482742 NWZPTKNHBRVBML-INIZCTEOSA-N 393.899 5.343 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(F)c(F)c2)ccc1OCC(F)(F)F 750902752 MVDPGKSCXPEDEQ-XVNBXDOJSA-N 386.316 5.201 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1F 752475953 HJNMFKKTQOQRTH-DYVFJYSZSA-N 382.435 5.458 30 20 GKED CC(C)(C)O[C@@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1 754535521 ZXGVEYLTBFTVKW-HNAYVOBHSA-N 382.460 5.168 30 20 GKED COc1cc(C=NOc2ccccc2C(F)(F)F)ccc1OCC(F)(F)F 754710880 YDFOPXVFXMHPQT-UHFFFAOYSA-N 393.283 5.068 30 20 GKED N#Cc1cc(NC(=O)c2cccc(Oc3ccccc3)c2)c(Cl)c([N+](=O)[O-])c1 755368383 RXUCICWXKHXJEZ-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12 759213684 GPWODGPCCWIFJZ-AFRXXKALSA-N 388.854 5.244 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 764755684 HTFVXJQEWFMPAX-RTBURBONSA-N 378.472 5.628 30 20 GKED C#CC[C@@H](NCc1csc(-c2ccc(OCC)c(OC)c2)n1)c1ccccc1 775400030 WKWFHHWOEQYACV-HXUWFJFHSA-N 392.524 5.072 30 20 GKED CC(C)(C)OC(=O)C[C@](C)(C#N)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 779713191 QQGXOXNFPKJGFR-JOCHJYFZSA-N 392.459 5.302 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccc(OCCCC)c(Cl)c1)c1ccncc1 786237119 PZCPTQJRZPQITA-LJQANCHMSA-N 387.911 5.031 30 20 GKED N#C[C@@H](C(=O)C1CC(c2ccc(F)cc2)C1)c1nc2cc(Cl)ccc2s1 796757117 SZHOHJBWKKVEBN-ZUEPYMLJSA-N 384.863 5.459 30 20 GKED N#C[C@H](C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1nc2ccccc2s1 802036107 PZPVESBLEMLDIZ-DOMZBBRYSA-N 378.350 5.202 30 20 GKED N#CCCCCCC(=O)N[C@H](c1c[nH]c2ccccc12)C(Cl)(Cl)Cl 807695991 YCYYKHLMRDHKED-MRXNPFEDSA-N 386.710 5.169 30 20 GKED N#C[C@H](C(=O)CCCSc1ccc(Cl)cc1)c1cc(C(F)(F)F)ccn1 813218130 SLCKSEKOAWHUGL-HNNXBMFYSA-N 398.837 5.503 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1sc(-c2ccc(F)cc2)nc1C 814742907 LPZDZEKTDRAISP-UHFFFAOYSA-N 398.360 5.045 30 20 GKED N#CCSc1ccccc1C(=O)N[C@@H]1CCC[C@@H](c2cccc(Cl)c2)C1 837190617 UUIZFSBKWMKDOH-SJLPKXTDSA-N 384.932 5.412 30 20 GKED CN(CCC#N)c1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2)cc1 916839755 ZVOICSKFUUEEIZ-SANMLTNESA-N 383.539 5.500 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4cccc(F)c4)CCC3)n2)cc1 916974593 NHULTNNEXVOCMB-LJQANCHMSA-N 390.483 5.556 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccc(Cl)cc3)n2)cc1 916975062 VITHGSDRWAGPKV-LJQANCHMSA-N 394.927 5.971 30 20 GKED Cc1cccc2nc(C3CCN(C(=O)Nc4ccc(CCC#N)cc4)CC3)oc12 932573350 YLZJGPUAVFCDTH-UHFFFAOYSA-N 388.471 5.004 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1ccc(Oc2ccc(F)cc2)cc1Cl 1776037052 OLHINEOLNQLSIQ-UHFFFAOYSA-N 398.821 5.806 30 20 GKED C[C@@H](ON=Cc1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccccc1 1776083235 STOSXKQSZQCVEZ-VGSWGCGISA-N 375.424 5.003 30 20 GKED O=C(O)c1cc2c(C=Nn3c4ccccc4c4ccccc43)c(F)ccc2s1 1776113121 XZNAPPGLSONVPO-UHFFFAOYSA-N 388.423 5.729 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(Cl)c1Cl 1776355387 HHUGOFSFCCBFED-SOFGYWHQSA-N 379.239 5.375 30 20 GKED CCCCCCCC/C=C/CCCCCCCC(=O)N1CCCC[C@@H]1C(=O)O 1776785236 JARCNTJKQPPSSM-DGSRBQDKSA-N 393.612 6.490 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](CC(=O)O)Cc2ccccc2)cc1 1776786224 CIIMOPJBLXMLMU-HSZRJFAPSA-N 397.559 5.459 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1C 1777275215 NWXQWZBIYFHURW-NTMALXAHSA-N 376.408 5.166 30 20 GKED C=CCn1c(SCc2cccc3cccnc23)nc2sc(C)c(C)c2c1=O 11316687 RWJXAXNCBVELDI-UHFFFAOYSA-N 393.537 5.101 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N[C@H](C)c1ccc(C#N)cc1 26123274 KITNWTRBKMCJAW-GFCCVEGCSA-N 381.888 5.135 30 20 GKED N#C[C@H](C(=O)c1ccccc1SCc1cccs1)c1nc2ccccc2o1 41544270 BZYKMBJPRPJDMJ-MRXNPFEDSA-N 390.489 5.672 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sccc2-c2ccc(C)cc2)cc1 42643529 ASIONYYGQZNTIB-UHFFFAOYSA-N 391.496 5.283 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)cc1 57820959 JAAPVNPEOCUEJP-UHFFFAOYSA-N 380.369 5.691 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 66347869 GTWGYLMWOVMNOO-HXUWFJFHSA-N 395.915 5.204 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)cc(Br)c1 66800162 HLTLADMMXRNMCX-NSHDSACASA-N 393.281 5.235 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccccc2Cl)cc1 70717898 RYWNVERHHHQHJR-UHFFFAOYSA-N 378.884 5.756 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 120773153 XKQUPNURGQXRQY-AEFFLSMTSA-N 378.501 5.105 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1C)[C@H](c1ccc(Cl)cc1)c1cccnc1 122652393 RQKLTWUZNJWPOC-JOCHJYFZSA-N 389.886 5.167 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1cccs1 134006083 WQXKINODQLBYJJ-ZIAGYGMSSA-N 376.572 5.575 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1nccs1 152871746 YKVAAIPLIMRJHO-SFHVURJKSA-N 392.484 5.388 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 160977387 CTOOLLYWHGTHLT-JOCHJYFZSA-N 398.466 5.105 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](Cc2ccccc2)C1 173116737 WJYFTQWTKZTRKG-IEBWSBKVSA-N 379.529 5.035 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C/c1cnc(C(C)(C)C)s1 173265548 YNQQIIAHMILXSO-HBWSCVEGSA-N 385.558 5.487 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 173731859 VOBXCRLAZDHLFD-GFCCVEGCSA-N 389.468 5.072 30 20 GKED COc1ccc(CN[C@H](C)c2c(F)cccc2Cl)cc1OCCCC#N 177714378 BWXSZRUOOUILDO-CQSZACIVSA-N 376.859 5.021 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(F)c(F)c2)C(C)C)ccc1OC 182136515 VBHZFKBWNUXLNZ-JTSKRJEESA-N 388.458 5.141 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(Br)s2)s1)c1ccccn1 183178767 IHKZWXPAYISGLU-JTQLQIEISA-N 389.299 5.124 30 20 GKED CCC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 237033786 NFEUIBNCJGGZNB-QRWLVFNGSA-N 376.422 5.627 30 20 GKED N#CC1(CCCSCc2coc(-c3cccc(Cl)c3)n2)CCOCC1 282061787 ZYVRZGFTPMGIOO-UHFFFAOYSA-N 376.909 5.329 30 20 GKED C[C@H]1CCCCN1CC(O)=Nc1ccc(F)c(N=C(O)CC2CCCC2)c1 328882208 LPTFUJSWTUQMDR-HNNXBMFYSA-N 375.488 5.456 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 426904836 KVURYYWPQDXBIO-GFCCVEGCSA-N 375.460 5.001 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)Nc2cccc(C#N)c2C)cc1 431737693 HADWBLWVZMJLED-UHFFFAOYSA-N 385.467 5.110 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(OCC(F)(F)F)c1 431929690 ZJSMQGPQFPYVQQ-CYBMUJFWSA-N 394.418 5.132 30 20 GKED COc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@@H](CCC#N)c1ccccc1 438859588 PTBHCTAYNPEDKE-LEWJYISDSA-N 379.504 5.127 30 20 GKED Cc1ccc(/C=C\CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 440530882 ARBMUFSWLIBOIT-HYXAFXHYSA-N 383.451 5.404 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)CCCC1(C)C 444896427 DLLZGKYOYMIXJM-NRFANRHFSA-N 385.552 5.042 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@@H](C)c1cccc(C#N)c1 462035462 WESSCYCFPWXKBA-KRWDZBQOSA-N 388.442 5.327 30 20 GKED CC(C)[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)cc1 469357953 RECUMARWOODWRP-HSZRJFAPSA-N 395.934 5.732 30 20 GKED CN(C(=O)CC(C)(C)C#N)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 469548528 AISPNJRSZGWOOP-UHFFFAOYSA-N 375.299 5.481 30 20 GKED C[C@H](C#N)CN(C)C(=O)N[C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 479343554 DSQUKZVYXOJDMF-CHWSQXEVSA-N 395.450 5.296 30 20 GKED C[C@@H](NCc1ccc(Br)o1)c1ccc(-c2cccc(C#N)c2)cc1 480301445 OVJWMZCDPIEFAE-CQSZACIVSA-N 381.273 5.432 30 20 GKED CC(C)(CC(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C(F)(F)F 480748764 INGSTKNDKTVOBM-NSHDSACASA-N 395.265 5.404 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Br)cc2Cl)cc1 483081724 YIWKJGXVFDEYKX-UHFFFAOYSA-N 377.669 5.156 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cc(C(F)(F)F)ccc1Br 483382490 QXQCUKXTBJGKTI-LLVKDONJSA-N 377.204 5.040 30 20 GKED CC(C)(C#N)c1ccccc1CSCc1nc(Cc2cccc(F)c2)no1 485583136 VERJKZINLKYIOD-UHFFFAOYSA-N 381.476 5.034 30 20 GKED CSc1ccc([C@H](C)NCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 500245487 MEBWAIJCKQWLTG-CVEARBPZSA-N 399.585 5.092 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1csc(-c2ccccc2Cl)n1 500470983 OONFOWRKAQQSDD-UHFFFAOYSA-N 388.945 5.282 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)cc1 501000952 PNCCDZPBFONCDX-QGZVFWFLSA-N 376.481 5.174 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCC3CCC(F)(F)CC3)cc2)cc1 501177831 XRXOFLPXLURCQD-UHFFFAOYSA-N 384.426 5.100 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC)c1ccccc1OC(F)F 502643850 HKQVWYLWHPHZAE-INIZCTEOSA-N 380.460 5.198 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 517652421 SCIYWQBPWKWUEH-LJQANCHMSA-N 393.537 5.115 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2 518668687 LWVOGJARGQHZOS-FPXTWHHMSA-N 382.573 5.873 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 519066386 XCYSGOCHHJBVGN-GOSISDBHSA-N 379.504 5.027 30 20 GKED N#C[C@H](NC(=O)CSc1ccccc1Cl)c1c(Cl)cccc1Cl 519305506 WFVMUNTXYHDGKV-ZDUSSCGKSA-N 385.703 5.120 30 20 GKED Cc1ccc2nc(C)c(C(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)cc2c1 520271309 BXRDXVDKCHHSPS-LJQANCHMSA-N 384.266 5.153 30 20 GKED C=CCOc1cccc(NC(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)c1 521208249 IMWPHTGZLLCJDY-AWEZNQCLSA-N 378.394 5.495 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 521419074 KRQBBGHZGIRFTE-UHFFFAOYSA-N 383.451 5.900 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3ccc(Oc4ccccc4)cc3)CC2)c1 524554698 WLUJTSWTHWEIDC-UHFFFAOYSA-N 398.462 5.034 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 524784388 FUJMFFIASIDLJV-OAHLLOKOSA-N 392.421 5.173 30 20 GKED CO[C@H]1CCC[C@@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)C1 527244463 LUQMHACKSXWAJO-IRLDBZIGSA-N 394.490 5.134 30 20 GKED CC[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)N(CC)CC 531050485 LQGVCPDBGHVWCG-FPOVZHCZSA-N 383.923 5.054 30 20 GKED C=CCN(C(=O)c1cc(-c2cccc(Cl)c2)on1)c1nc2c(s1)CCCC2 531497423 GRZQUNDJBNEQDP-UHFFFAOYSA-N 399.903 5.163 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSCC(F)(F)F)cc1Cl 534170484 HOPCNXCIFHVSJT-HNNXBMFYSA-N 398.837 5.229 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)c1cccc(C(=O)c2ccccc2)c1 534869617 SEOVKEDUFDMPDO-GOSISDBHSA-N 389.520 5.297 30 20 GKED C[C@H](NCc1ccc(C#N)cc1OC(F)F)c1ccc(-c2cccnc2)cc1 538227590 BZJSVIKQXYQLAI-HNNXBMFYSA-N 379.410 5.072 30 20 GKED N#CCCCNC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 541297361 JIFOZKDHOQEBKE-KRWDZBQOSA-N 379.312 5.247 30 20 GKED N#CCc1ccc(CN[C@@H](c2ccc(OC(F)(F)F)cc2)C(F)(F)F)cc1 542255648 KTHIWZKTTCTUPU-INIZCTEOSA-N 388.311 5.044 30 20 GKED C[C@H](NC(=O)c1cccc([C@@H]2CCOC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 542929077 QGZIVQHHZSMUIS-AVRWGWEMSA-N 396.490 5.220 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)CC1 543828854 HQNAHFKEZBTTFX-UHFFFAOYSA-N 383.879 5.077 30 20 GKED C[C@H](Nc1ccccc1NC(=O)CSc1ccc(C#N)cc1)c1ccccc1 559250123 LAFKUZTUVGXAEQ-KRWDZBQOSA-N 387.508 5.462 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccc(-c4cnc(C5CC5)o4)cc3)CC2)cc1 560548668 KNPXPUTVWKVUKG-UHFFFAOYSA-N 384.483 5.172 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 562153424 FYTBNHJOBHGFHO-UHFFFAOYSA-N 398.894 5.044 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1 562870418 XODIBGCDLOHEST-ZWOKBUDYSA-N 379.529 5.744 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)Cc1csc(-c2ccoc2)n1 566881984 DOJAICJYZNDGMO-UHFFFAOYSA-N 399.475 5.051 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(F)c(C(F)(F)F)cc1F 568324403 FVLKAAXKKDJABD-LLVKDONJSA-N 386.389 5.990 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccc(C#N)cc1F)c1ccc(Cl)cc1Cl 572535887 XHMODPFURUKPCT-WDEREUQCSA-N 397.302 5.362 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1OC1CCCC1 578294582 BKGAZIUTAHRYJO-FQEVSTJZSA-N 386.451 5.055 30 20 GKED N#CC1(c2ccccn2)CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 580760666 VMVWULHLZGOOFA-HSZRJFAPSA-N 387.914 5.382 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)Cc1ccccc1C(F)(F)F 582356005 POIVBUITHMQIQT-GOEBONIOSA-N 394.462 5.115 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(F)c(Br)c1 590192607 AEVPOBIRSBZLNX-CQSZACIVSA-N 391.284 5.122 30 20 GKED N#CCCC[C@@H](NC(=O)c1sc2cc(F)ccc2c1Cl)c1ccccc1 590477924 MBQYHTLNDCCYOT-MRXNPFEDSA-N 386.879 5.859 30 20 GKED N#CC[C@H]1CCCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)C1 597916221 VMKLPDOGWMSTRF-QGZVFWFLSA-N 389.474 5.059 30 20 GKED Cc1ccc(C[S@@](=O)CC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1C#N 600928610 RXRSIJXNCYAMQU-MUUNZHRXSA-N 396.556 5.001 30 20 GKED C=CCn1c(SCCOC2CCCCCC2)nnc1-c1ccccc1F 607059229 PZPCQUQIEDPSDX-UHFFFAOYSA-N 375.513 5.102 30 20 GKED C[C@H](NC(=O)Nc1ccccc1N(C)Cc1ccccc1)c1ccc(C#N)cc1 609046412 DHGMHHQAJOZBJF-SFHVURJKSA-N 384.483 5.077 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)Cc1ccsc1 609078691 ILJWCOXHRIOTIG-UHFFFAOYSA-N 391.496 5.171 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)Oc1ccccc1 609636202 CHBSOTDCTDJOOH-INIZCTEOSA-N 383.517 5.060 30 20 GKED N#Cc1c(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)sc2c1CCC2 610575470 KUVHFEUFWKKAPJ-ORMMXULVSA-N 394.462 5.196 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cc2ccccc2s1 615494772 JEZZVMQKLRTOTI-SNVBAGLBSA-N 375.280 5.571 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 615971634 PIYNCKPWXKFAIR-ROUUACIJSA-N 377.381 5.163 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(-c2ccccc2F)on1 642240055 OGHNGSIBJPAXQA-UHFFFAOYSA-N 376.840 5.024 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)Nc2ccccc2C(F)F)c1C(F)F 644992285 CDODYGAMCAPXFU-UHFFFAOYSA-N 383.267 5.049 30 20 GKED CC(F)(F)CCNC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646440895 NSVKCJFJGYUYJQ-UHFFFAOYSA-N 396.253 5.143 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)cs2)cc1 678172231 BGHHISRNFUDEQC-SFHVURJKSA-N 383.476 5.081 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(Oc3ccccc3)c2)cc1NC(C)=O 726430142 XKWFOLMOMHVDTO-QBFSEMIESA-N 387.435 5.342 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(O[C@H](C)C#N)cc3)s2)cc1 728697715 HWRAQKHZITTYIE-WDBUWWRISA-N 388.492 5.614 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1csc(-c2csc(C)n2)c1 729141231 YJDHWUZYLLYLBS-UHFFFAOYSA-N 382.436 5.430 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(CCc1ccccc1)C1CC1 731114025 CDXPRDAYMFELGA-KRWDZBQOSA-N 379.529 5.177 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)oc2ccccc12 733083446 JKMJHDKXSRIHAX-KTKRTIGZSA-N 390.420 5.669 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2-c2ccccc2)c1 733841704 JDUGVJHGEMWNIJ-FQEVSTJZSA-N 385.467 5.356 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCc3ccc(Cl)c(Cl)c3)[nH]c12 735789770 QEIZUMGASGPYDA-CQSZACIVSA-N 386.282 5.377 30 20 GKED C#CCN(C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1)C1CCCCC1 741184108 STTMOHXNSYHGRA-UHFFFAOYSA-N 389.499 5.047 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C2CCCCCCC2)cc1 741543156 BDZZDVOGLQLLQY-UHFFFAOYSA-N 376.500 5.631 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)[nH]2)cc1 742435278 VFBGRWDWJLRZMA-FOCLMDBBSA-N 380.447 5.648 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(C3CCCC3)CC2)cc1 743093584 VYWQPELMNMTMRF-DEOSSOPVSA-N 387.527 5.776 30 20 GKED N#Cc1ccc(CN(C(=S)Nc2cc(Cl)cc(Cl)c2)C2CC2)cc1 745653883 VXIORSIFJKJQJN-UHFFFAOYSA-N 376.312 5.226 30 20 GKED Cc1cc(OCCCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)ccc1Cl 747198657 JJIZLNNYYRRVAH-OAHLLOKOSA-N 376.909 5.264 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ncc(-c3ccccc3)s2)ccc1OC 750027403 JFEZXWSHGRWNQB-KRWDZBQOSA-N 379.485 5.112 30 20 GKED CCC(=O)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1F 756927524 RZUYNYQCFMXZJH-OAQYLSRUSA-N 386.426 5.326 30 20 GKED C[C@H]1C(=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C[C@@H]1c1ccccc1 767782239 NDLCUVCSYQHDGU-HIFRSBDPSA-N 397.404 5.149 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCCc2nc(-c3ccncc3)cs2)cc1 773003911 IBIRUZIWTMGBAR-MRXNPFEDSA-N 399.947 5.230 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(Sc3ccc(F)cc3)cc2)cc1 773428488 ZHZPCPDQXPCECD-QGZVFWFLSA-N 392.499 5.558 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 774025090 ZEQZOKAUVYLJMU-UZUQRXQVSA-N 384.483 5.182 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(CF)cc1 776909773 YJMMOGQJACYQLE-OAHLLOKOSA-N 388.533 5.422 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cc(Br)cc(C(F)(F)F)c1 779993183 NCZVDRIVFYGCJN-LLVKDONJSA-N 399.210 5.371 30 20 GKED CCSc1ccc(Cl)cc1NC(=O)Nc1ccccc1O[C@H](C)C#N 780558390 BFJGOAOPNPGQAG-GFCCVEGCSA-N 375.881 5.387 30 20 GKED CCCCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@@H](CC)c1ccccc1 780676217 ZZPHXAWCMWTEIY-NQIIRXRSSA-N 379.504 5.763 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1Cl)C1CCCC1 780680677 GXJWXZPEIMEPMS-INIZCTEOSA-N 397.906 5.608 30 20 GKED CC(C)(C#N)CC(=O)O[C@@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]4CCC(=O)[C@]4(C)CC[C@@H]32)C1 786434269 JQZFABQMSSHDNY-FEOUROHLSA-N 397.559 5.370 30 20 GKED Oc1ccc(Cl)c(F)c1CNC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 790949611 NWMYKIRUOCUOPN-YUMQZZPRSA-N 393.730 5.184 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792092886 FFPOZMFJJDAGJJ-RNUYOQPASA-N 380.369 5.533 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792093541 XPBVBELNFQPGFR-QIXNEVBVSA-N 380.369 5.533 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cnc4ccccc4c3)n2)cc1 796634997 OJUSMAWSEGWNLO-FQEVSTJZSA-N 397.503 5.476 30 20 GKED CCOC(=O)c1csc([C@H](C#N)C(=O)C2(C3CCCCC3)CCCCC2)n1 796658022 IJUQCGMZXARLLO-MRXNPFEDSA-N 388.533 5.027 30 20 GKED O=C(C[C@H]1CCC(F)(F)C1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 797975319 GTQVMDFTVRUHOF-NOZJJQNGSA-N 389.286 5.251 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 802036548 ZVGDERJJURVVTD-PBHICJAKSA-N 376.481 5.115 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cc(Cl)cc(Cl)c3O)cc2)ccn1 810166237 FNFQZOHWYJBMOR-UHFFFAOYSA-N 386.238 5.370 30 20 GKED N#C[C@H](C(=O)Cc1ccc(-c2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 813212454 CMRBIROCIZYVBV-IBGZPJMESA-N 380.369 5.186 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)c2sccc2Br)s1 845846693 YJPOMOUFPMBANO-SECBINFHSA-N 396.331 5.075 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC(C)(C)CC(F)F)n2)cc1 892607105 PWLLGBMOKPUOIY-AWEZNQCLSA-N 378.444 5.066 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCSc2ccccc2F)cc1 916948965 KUPGCBXNLINALG-YJBOKZPZSA-N 398.503 5.169 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccsc1C(F)F 930110598 QUTDEGFPYXIXCY-JIGDXULJSA-N 395.315 5.325 30 20 GKED CCCCCCCOc1ccc(C=NNc2ccc(C(=O)O)cc2)cc1OCC 1776011985 KRBMCAGFOWCVIQ-UHFFFAOYSA-N 398.503 5.579 30 20 GKED O=C(O)c1ccc(NN=Cc2cc(F)ccc2Oc2cc(F)cc(F)c2)cc1 1776012328 OYZUFNQIAYOGNH-UHFFFAOYSA-N 386.329 5.040 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NNC1CCCCC1 1776080242 TZKVDEXXZOBICF-UHFFFAOYSA-N 394.515 5.195 30 20 GKED CC(=NNc1c(Cl)cccc1Br)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776083466 IKOBBSJFZUVVFL-MNOVXSKESA-N 387.705 5.027 30 20 GKED Cc1ccc(Cl)cc1NN=Cc1cccc(OCc2ccccc2C(=O)O)c1 1776106615 NDVJIDKCDNBDKF-UHFFFAOYSA-N 394.858 5.372 30 20 GKED COc1ccc(/C=C2/CCc3c(Cl)cccc3C2=O)c2cc(C(=O)O)oc12 1777360219 FULXPCRUALDTMU-XFXZXTDPSA-N 382.799 5.006 30 20 GKED Cc1c(/C=C2/Cc3cccc4cccc(c34)C2=O)nc2ccccc2c1C(=O)O 1777414138 AUYJVLZPKDVDEJ-LGMDPLHJSA-N 379.415 5.217 30 20 GKED O=C(/C=C\c1ccc(-c2cc(Cl)ccc2Cl)o1)c1csc(C(=O)O)c1 1777569474 YOGLWFLPOUNEPE-DJWKRKHSSA-N 393.247 5.909 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccc4ccccc4c3)n2)cc1 66545385 HSNUAVDKKUOCMK-OAQYLSRUSA-N 393.471 5.254 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)c1 66545496 DYJWGBPMABABHM-HXUWFJFHSA-N 385.492 5.108 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1c(F)cccc1Cl 66953966 RQSGWUGRIHMJLZ-CYBMUJFWSA-N 391.899 5.537 30 20 GKED CCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)[C@@H](C)C(C)C 67677394 BVSNGXZDEKPGCI-SFHVURJKSA-N 379.504 5.230 30 20 GKED C[C@@H](c1ccncc1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116635109 SANJVRAJENRUEH-HNNXBMFYSA-N 391.858 5.232 30 20 GKED CCN(Cc1ccccn1)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 119079545 JFHPIPZIKDNWCG-UHFFFAOYSA-N 391.858 5.061 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CSCCCOc1cccc(C#N)c1 126476122 FRILMZJXZLBDAX-UHFFFAOYSA-N 382.529 5.131 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 131855540 USZXFSXCEZSWRZ-CABCVRRESA-N 386.542 5.209 30 20 GKED Cc1ccc(C[C@H](NC(=O)N[C@H](CCC#N)c2ccccc2)c2ccccn2)cc1 151435730 NJIBGCRBPTXQCU-VWNXMTODSA-N 398.510 5.018 30 20 GKED C[C@@H](NCc1ccccc1COCc1ccccc1)c1ccc(OCC#N)cc1 181496101 BEBIQQCRGLIYBR-HXUWFJFHSA-N 386.495 5.157 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@H](CC3CCCCC3)c3ccccc3)o2)cc1 181826013 SBKVGBVVGPOXCW-JOCHJYFZSA-N 386.499 5.410 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 183805962 QZMWUOWWQXSIOT-QGZVFWFLSA-N 380.513 5.239 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2cccc(Br)c2C1 191435611 ZDYIWOILNYRSBT-UHFFFAOYSA-N 399.332 5.849 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)c1cccc(N2CCOC2=O)c1 207668112 VQODGCWHICGKKE-NTMALXAHSA-N 393.439 5.407 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2c(s1)CCCC2 426699761 MBSJSVVNCBSTKO-VXGBXAGGSA-N 378.950 5.060 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cs1 426973403 SIHXOQAZRAEDCQ-UHFFFAOYSA-N 395.459 5.216 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(-c3ccccc3Cl)o2)s1 430592445 HJFFCTJYZCLZOZ-ZDUSSCGKSA-N 384.888 5.844 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(C)cc(C)cc1Br 431953290 INXYQJMKMSHPBK-UHFFFAOYSA-N 398.304 5.158 30 20 GKED CC1(C)CCCN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)[C@@H]1C#N 434033965 ZIECJHRBPFCLSF-OAHLLOKOSA-N 394.327 5.271 30 20 GKED C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1Cc1nnc(-c2ccc(C#N)cc2)o1 434908202 YGWSOVPSUAFCCZ-GFCCVEGCSA-N 399.281 5.034 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)c2c1 435468063 AQKCVPPMOTWPHF-KRWDZBQOSA-N 395.384 5.325 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)nn1-c1ccccc1 435752936 NBSMYVRILITYIX-MRXNPFEDSA-N 386.480 5.095 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 436285015 CLMGXFVKPNUHSG-XCRHUMRWSA-N 376.953 5.404 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(NC(C)=O)cc2C(F)(F)F)CCCC1(C)C 444832947 FFTUMXXTOJDCNO-QGZVFWFLSA-N 397.441 5.262 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1cccc(F)c1)C1CCCC1)c1ccccc1 458805184 UFOXLXBXKFGYFH-HSZRJFAPSA-N 393.506 5.715 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 463879457 PSWIVBHFNCWFPM-UHFFFAOYSA-N 376.387 5.141 30 20 GKED CN(Cc1ccc(F)cc1Cl)C(=O)c1cn(CCCC#N)c2ccccc12 469375791 ULKUGAAFBQKASO-UHFFFAOYSA-N 383.854 5.010 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1 470435594 FDKFDRIDDDOGSM-UHFFFAOYSA-N 382.529 5.006 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccncc2)cc1 470501659 ZTUXCIONSSMLLG-CQSZACIVSA-N 376.847 5.156 30 20 GKED C[C@@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccc(C#N)cc1F 480661591 KOQACMBIHRYQEW-CYBMUJFWSA-N 377.444 5.418 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Cl)c2Br)cc1 484074423 RNPALAKAHRHWDO-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CC[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2[nH]1 484281084 OIFCOHYBOUSTLJ-HXUWFJFHSA-N 396.450 5.108 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](C)c1cccc(C(F)(F)F)c1 492805355 FUMFYAZIQUVCFZ-GJZGRUSLSA-N 396.478 5.021 30 20 GKED C=CCc1cc(CNC(=O)N(CC)[C@@H](CC)c2ccccc2)cc(OC)c1OC 497836759 PZISXRJXSRGRCO-NRFANRHFSA-N 396.531 5.115 30 20 GKED CCCN(C(=O)[C@H](C)Oc1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 501624063 CQEIHEKVNFDERL-IRXDYDNUSA-N 376.456 5.072 30 20 GKED CC(C)CN(C(=O)c1csc(Cc2cccc(F)c2)n1)c1ccc(C#N)cc1 502746997 BUYQZTFDFCGDBV-UHFFFAOYSA-N 393.487 5.047 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nc2ccccc2s1 505311574 LUDONDVTNUEOTJ-AWEZNQCLSA-N 397.481 5.197 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2sccc2Cl)cc1Cl 506479301 FHFOSGLMXIXBPB-HNNXBMFYSA-N 387.291 5.963 30 20 GKED COCCSc1ccc([C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1 507638938 UXSVBHUWMUTQRF-HRRASNIPSA-N 394.584 5.480 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(-c4ccc(Cl)s4)cn3)CC2)c1 509483018 FMCSVYFXBQTEMK-UHFFFAOYSA-N 397.862 5.145 30 20 GKED Cc1ccc(O[C@@H](C)C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 511065995 URTWXSORXBZIRU-HNNXBMFYSA-N 388.492 5.100 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 513118373 KCLKQKUMFOFWMT-KRWDZBQOSA-N 381.442 5.272 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518755319 FJQPSXGZBZBGER-UHFFFAOYSA-N 389.480 5.632 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 523142563 OWLPQCNWOCMOOE-MRXNPFEDSA-N 390.508 5.276 30 20 GKED C=CCCSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 523497088 HBSHDMIFCFMWLT-UHFFFAOYSA-N 380.300 5.561 30 20 GKED Cc1ccc(COc2c(C)cc(CN(C)C[C@H](C#N)CCC#N)cc2C)cc1 523791408 ZSLCUNLAEXDLTN-QFIPXVFZSA-N 375.516 5.066 30 20 GKED N#CCCCCNC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 525052802 ZLRWSJVWRNXREV-UHFFFAOYSA-N 393.339 5.709 30 20 GKED N#Cc1ccc(NCc2ncc(-c3ccc(Cl)cc3)o2)cc1C(F)(F)F 525175635 MLFZKSNVVCNCCS-UHFFFAOYSA-N 377.753 5.498 30 20 GKED CCN(C(=O)Cc1cccc(C#N)c1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 530914651 IVGFAROUNYZYMK-SANMLTNESA-N 397.522 5.257 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC1CCC(F)(F)CC1 534896597 HSHBBCGYSXOEST-UHFFFAOYSA-N 385.414 5.358 30 20 GKED C=C[C@H](CC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 535374045 LJQXBKGMPQNCRZ-WOJBJXKFSA-N 398.506 5.476 30 20 GKED CC[C@H](C)n1nc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1C 539757518 ZGBVOQUIHCTJRE-INIZCTEOSA-N 388.471 5.387 30 20 GKED C[C@H](Sc1nc(C(F)(F)F)ccc1C#N)c1nc2ccccc2n1C(F)F 551100834 IHXWKQIQFMCZHF-VIFPVBQESA-N 398.360 5.570 30 20 GKED Cc1ccoc1CN(C)C(=O)c1ccccc1SCc1ccc(C#N)cc1 553918982 JDQZZGHKFOQKAE-UHFFFAOYSA-N 376.481 5.024 30 20 GKED CCCCc1ccc(C(=O)Cn2cc(C#N)c(=O)c3cc(C)cc(Cl)c32)cc1 563250881 SEIJGFAKEAQZOX-UHFFFAOYSA-N 392.886 5.061 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(F)c2)CCCCC1 563267850 IEMFPMREDVFGHF-KRWDZBQOSA-N 396.531 5.918 30 20 GKED CC(C)c1ccc2occ(C(=O)N3CCC(Oc4cccc(C#N)c4)CC3)c2c1 572708501 PBOPFWUKCBVOMC-UHFFFAOYSA-N 388.467 5.111 30 20 GKED C[C@@H](NCc1cccc(COCc2ccco2)c1)c1ccc(C#N)cc1Cl 581644919 VLEAXZKECWXGKC-MRXNPFEDSA-N 380.875 5.372 30 20 GKED COc1cc(CNC(=O)N(C)[C@@H](C)c2ccc(-c3ccccc3)cc2)ccc1C#N 583987440 XTVPXCSWPQSGBI-SFHVURJKSA-N 399.494 5.136 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(COc3ccccc3OC)o2)c1 589382563 GKYJWOJBFAODBN-UHFFFAOYSA-N 393.439 5.074 30 20 GKED N#CCCCCCC(=O)Nc1cc(C(F)(F)F)ccc1NCc1ccccc1 589840684 RKHCYMZXQKFNTM-UHFFFAOYSA-N 389.421 5.730 30 20 GKED N#CC1(c2ccc(-c3cc(F)ccc3OCC(F)(F)F)cc2)CCOCC1 596638713 BHRFCDYMRAPVGC-UHFFFAOYSA-N 379.353 5.006 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cccc(CC#N)c2)cc1Cl)c1ccccc1 604512966 IXJSSOOEBMMDAO-MRXNPFEDSA-N 389.886 5.831 30 20 GKED CSCc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 608953618 KTZPHMOVAKXYPA-UHFFFAOYSA-N 390.533 5.825 30 20 GKED C[C@H](NC(=O)c1cc2ccccc2n1CC#N)c1cc(F)c(Cl)cc1Cl 609160004 GKPCOHWDSQSJPD-NSHDSACASA-N 390.245 5.102 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 609208958 RJEZSDLDPWMTCV-UHFFFAOYSA-N 377.469 5.384 30 20 GKED N#Cc1c(NC(=O)c2ncoc2-c2ccccc2)sc2c1CCCCCC2 609558599 PJYYAEBCJPISQE-UHFFFAOYSA-N 377.469 5.186 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)Cc1ccccc1 609772983 RDZNBBZKFJIEGE-QGZVFWFLSA-N 381.545 5.329 30 20 GKED Cc1nc(NC(=O)c2cccc(N[C@@H](C)C(C)C)c2C)sc1SCC#N 610210721 OWTZQZLUNXLYPW-ZDUSSCGKSA-N 388.562 5.084 30 20 GKED C[C@H](NC(=O)Nc1ccccc1N1CCc2ccccc21)c1cccc(C#N)c1 610318841 DXQGVLYPSCUSII-KRWDZBQOSA-N 382.467 5.135 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610355863 DOIISZYNDBDJKN-STQMWFEESA-N 376.287 5.329 30 20 GKED C[C@@H](NC(=O)N[C@H](CCc1ccccc1)c1ccccc1)c1cccc(C#N)c1 610357244 JIWJDMRUXBPGAA-NTKDMRAZSA-N 383.495 5.293 30 20 GKED C[C@H](NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1cccc(C#N)c1 610947436 GKDRNECKVMIULP-HNNXBMFYSA-N 399.947 5.239 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3c(F)cccc3Cl)c2)c1 612391483 DCVCKGWMRMDBJQ-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccccc1OC(C)C 612651301 DPHTYJPAYDOATG-HNNXBMFYSA-N 392.952 5.648 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1cc2cccc(OCC)c2o1 615629590 XTCOEYCXJKSLLT-INIZCTEOSA-N 396.462 5.429 30 20 GKED Fc1ccc(-c2cc(CN3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)on2)cc1 618450407 KTXMQVIGSSJKCD-TXEJJXNPSA-N 396.306 5.043 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1 642496058 JYCJDXQQFFKPRT-UHFFFAOYSA-N 396.487 5.686 30 20 GKED O=C(Nc1cc(F)cc(Cl)c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 675696339 ZSCIPRQKHAJJNC-HTQZYQBOSA-N 392.702 5.074 30 20 GKED C=CCn1c(C2CC2)nn(CN(C)Cc2ccccc2-c2ccccc2)c1=S 725783074 RQRUZQQJYVEPTL-UHFFFAOYSA-N 390.556 5.234 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C\c1cccc(F)c1 727997350 YTEHTPFUPRDLIY-FLIBITNWSA-N 386.426 5.237 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C(F)(F)c3ccc(F)cc3)cc2)c1 728006560 NNCHEWLHBWFFFX-UHFFFAOYSA-N 396.368 5.007 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2C)n1 728062536 MECQYNZECUOCGO-QGZVFWFLSA-N 390.487 5.344 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)c2cnc(-c3ccccn3)s2)c1 728248288 PXUMXJZUXKKDEW-UHFFFAOYSA-N 395.487 5.033 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccccc2SCc2ccccc2)CC1 730063837 GNMDZOJMZUTMHY-UHFFFAOYSA-N 395.572 5.141 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416771 IJDHSXZJERCYES-SJLPKXTDSA-N 396.487 5.593 30 20 GKED N#CCOc1ccc(CC(=O)O[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 732499416 PWCCHYBWXIRGDG-HSZRJFAPSA-N 391.854 5.118 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 734662382 YTJQKEDQFPNFSD-QFBILLFUSA-N 392.528 5.191 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=S)Nc1ccccc1C#N 736446986 MTYFQVJIYVOVGZ-LJQANCHMSA-N 377.538 5.199 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741842350 KCKRKFQIFFRGRX-NYYWCZLTSA-N 379.403 5.196 30 20 GKED COc1ccc(CNc2cccc(OCCCC#N)c2)cc1SC(F)(F)F 742259372 WKVLASFIWPPONV-UHFFFAOYSA-N 396.434 5.602 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(C3CCCC3)CC2)cc1 743093585 VYWQPELMNMTMRF-XMMPIXPASA-N 387.527 5.776 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 743194799 PIXNJGLKGFPXAC-ZDUSSCGKSA-N 394.368 5.081 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3cccc(Cl)c3)n2)cc1 744035394 RIGGTFKBTZLWFI-KDOFPFPSSA-N 380.900 5.752 30 20 GKED O=C(/C=C\c1nc2ccc(Br)cc2s1)c1ccnc(Cl)c1 773142532 AQGCOQKXLYVCTG-ARJAWSKDSA-N 379.666 5.003 30 20 GKED CCOCc1cc(CNCc2ccc(-c3ccccc3C#N)cc2)ccc1OC 773427450 MITQOAADJKTKOO-UHFFFAOYSA-N 386.495 5.060 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Br)c2ccccc12 773756200 IIIZGVCHZIUXPW-UHFFFAOYSA-N 397.297 5.470 30 20 GKED C=CC[C@H](C(=O)O[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 778426589 GSEKCMXQEMJLRV-AEFFLSMTSA-N 385.891 5.187 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)Nc1ccccc1SC(F)F 782917105 DQPDXFIQVYFNQA-UHFFFAOYSA-N 384.860 5.257 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=S)Nc2ccsc2)cc1 790309628 ZNPYCTXIESKWDQ-UHFFFAOYSA-N 381.501 5.158 30 20 GKED N#CC[C@H](CC(=O)N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 793830734 NWNIVZCWZYTEJZ-MOPGFXCFSA-N 386.417 5.109 30 20 GKED CN(C)Cc1cnc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)s1 794699457 MJPOXCZFXDGHQY-LUAWRHEFSA-N 382.460 5.032 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCc3cc(Br)ccc32)c1 794811910 UQUHBJWVLUGCCR-WIYYLYMNSA-N 399.332 5.297 30 20 GKED Cc1ccc(C(=O)N2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)cc1C#N 799636298 KSEOMLSTXLIDID-NRFANRHFSA-N 399.494 5.622 30 20 GKED C[C@H](C#N)Oc1ccc(CN(C)[C@H](C)Cc2ccccc2C(F)(F)F)cc1 809725076 IVLPJGKUEAWCMQ-HZPDHXFCSA-N 376.422 5.059 30 20 GKED N#CC[C@H](CC(=O)OCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccccc1 811083702 AVPNYIBMTGOBHZ-CYBMUJFWSA-N 393.226 5.032 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813213896 QTNOKHZKTARPHP-MAUKXSAKSA-N 396.796 5.034 30 20 GKED Cc1cc(/C=C\C(=O)c2cc([N+](=O)[O-])ccc2F)ccc1Oc1cccnc1 814190065 AZKQHTMWGXLGLQ-YWEYNIOJSA-N 378.359 5.126 30 20 GKED C[C@H](c1cccs1)N1C(=O)/C(=C/c2ccc(C(C)(C)C#N)cc2)SC1=S 846756870 NQOZDZBXFFNCTO-GPLLRDDGSA-N 398.578 5.512 30 20 GKED CC(C)(CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)CC(F)(F)F 883985759 BEGBBNPIFKLPPP-WCBMZHEXSA-N 387.286 5.087 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCSc2ccccc2)cc1 915353591 VQOWHNLQDYONMB-JOCHJYFZSA-N 387.508 5.256 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1cccc(OC(F)F)c1 915985843 YJAMMDMLCVNHLM-KHPPLWFESA-N 381.378 5.158 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4ccccc4F)c23)cc1 916357136 AWVBZBMYQNBGKE-UHFFFAOYSA-N 392.459 5.342 30 20 GKED N#CC1(c2ccccc2)CCC(=NNc2ncc(C(F)(F)F)cc2Cl)CC1 916588494 SPSVTXYTJQWPQS-UHFFFAOYSA-N 392.812 5.557 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(Cc2cccc(F)c2)C2CC2)cc1 916680000 CMIULYHBSKCLJY-DEOSSOPVSA-N 399.469 5.678 30 20 GKED N#Cc1ccc(NC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1 917998120 BKDYUVBTFKIVFE-CYBMUJFWSA-N 392.311 5.488 30 20 GKED C(=NN=C1c2ccccc2-c2ccccc21)c1csc(COc2ccccc2)n1 918710743 BCSHDLLMSFQZLL-UHFFFAOYSA-N 395.487 5.574 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2ccc(F)cc2s1 920102071 ORJJRRRORAIUGI-OAHLLOKOSA-N 376.412 5.036 30 20 GKED CCC[C@H](NCc1ccc(OC)c(O[C@H](C#N)CC)c1)c1ncccc1Cl 925397489 PJDUZRRXWDUYIO-WMZOPIPTSA-N 387.911 5.056 30 20 GKED CC1(C)C(=NNc2ccc(C(=O)O)cc2)C[C@H]1c1ccc(Br)cc1 1776014145 JEAKEGWDJTVUKV-INIZCTEOSA-N 387.277 5.129 30 20 GKED C[C@@H]1C(=NNc2c(Cl)cccc2Br)CC[C@@H](C(=O)O)C1(C)C 1776083404 DCIREVMGTVXZJE-ZJUUUORDSA-N 387.705 5.027 30 20 GKED O=C(/C=C/c1c(F)ccc(C(=O)O)c1F)c1ccc(OCc2ccccc2)cc1 1776126974 CRSYZFVRGPCUSV-ACCUITESSA-N 394.373 5.138 30 20 GKED O=C(O)/C=C\c1ccc(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)cc1 1776127043 GJDGWJHNSFZNPP-APGQMXJTSA-N 384.431 5.260 30 20 GKED C=CC[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)c1ccc(-c2ccccc2)cc1 1776152038 WSWIZPAGNNWTRD-VXKWHMMOSA-N 379.500 5.224 30 20 GKED CC(C)(C)Oc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776264902 WDAOHOQZMUMMDD-POHAHGRESA-N 380.465 5.673 30 20 GKED CC(C)c1cccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)c1 1776375327 FXSNMQHNJFMUAW-KAMYIIQDSA-N 384.475 6.000 30 20 GKED C[C@@H]1C/C(=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776589756 WFLHKILMDDXWBP-JFHVZYDGSA-N 398.458 5.665 30 20 GKED CCc1cccc2c1OC/C(=C\c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1776977631 QDHGSENSRJPVIR-SFQUDFHCSA-N 390.460 5.334 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1c(F)ccc2sc(C(=O)O)cc12 1777559838 JRXIUCVEWAGPKC-VURMDHGXSA-N 380.396 5.689 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccnn3CC3CCC3)s2)cc1 1777671226 VNKJEGVMOMWQBX-CSKARUKUSA-N 392.480 5.006 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)CCC3CCCC3)CCC2)cc1 1791728049 XHQMJRSVBDEZLH-UHFFFAOYSA-N 394.559 5.285 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C(C)(C)CC)CC1 1831388285 KWOOIEUWXJFXCM-HXUWFJFHSA-N 390.612 5.035 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2ccccc2F)[n+]2cccc(C)c2)c1 11170737 UGLHRNYHLGKJKN-UHFFFAOYSA-O 393.507 5.089 30 20 GKED CCN(Cc1ccc(C#N)cc1)Cc1ccc(OCc2cccs2)c(OC)c1 15369599 SXGMZAWMQMDRKA-UHFFFAOYSA-N 392.524 5.229 30 20 GKED N#C[C@H](C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)c1ccccn1 46440088 IOCYMOKCKQHHMR-IBGZPJMESA-N 398.853 5.078 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)Cc1csc(COc2ccccc2)n1 63750352 MDOOHLOEFZZFHK-UHFFFAOYSA-N 377.513 5.004 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl 66861032 FGCWFZAIJUNGNN-GFCCVEGCSA-N 394.327 5.438 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3sccc3SC)n2)cc1 107410953 NJTDLGNQYKMRGR-CYBMUJFWSA-N 386.523 5.092 30 20 GKED N#Cc1ccc(NCc2ccc(COCC(F)(F)F)cc2)cc1C(F)(F)F 111218699 WLEKAECIGQNSOC-UHFFFAOYSA-N 388.311 5.268 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 112128362 XKOMAJRKLPVYCV-HOTGVXAUSA-N 377.579 5.220 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)SCCCOc2cccc(C#N)c2)c(C)c1 126498273 PDKMAAAXWNSGKM-GOSISDBHSA-N 382.529 5.013 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc(Oc2cnccn2)c1 134586349 XNMIBZBUTVUVNS-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 153967343 LWVBRUCREOMMNW-QZTJIDSGSA-N 381.545 5.342 30 20 GKED Cc1oc(-c2ccsc2)nc1CC(=O)Nc1sc2c(c1C#N)CCCCC2 170700296 RVRRLCCRNXBTIX-UHFFFAOYSA-N 397.525 5.095 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2cccs2)n1Cc1ccccc1 177142504 GKDBXELGJBZUJA-UHFFFAOYSA-N 382.558 5.477 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(COc3ccccc3)cc2)n1 177756773 UOSBBQJBMSSIMD-IBGZPJMESA-N 376.481 5.336 30 20 GKED Cc1cc(F)ccc1CSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 182080890 VGZXZXPHOOTFDK-HNNXBMFYSA-N 388.533 5.400 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 183819575 KUZLJQCVEBNKMV-QGZVFWFLSA-N 380.513 5.381 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 186388637 SKHQJEQTFPUHEL-IBGZPJMESA-N 376.481 5.299 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2cc(Cl)ccc2OC2CCCC2)c(F)c1 189336504 CRECVMUKPPWOED-UHFFFAOYSA-N 376.790 5.064 30 20 GKED Cc1occc1-c1nnc(S[C@H](C)c2ccc(C#N)cc2)n1-c1ccccc1 303728245 UJRCAYMNWIMFCF-MRXNPFEDSA-N 386.480 5.561 30 20 GKED Cc1cnc(N2CCC(/N=C(/O)C3CCCCC3)CC2)nc1-c1ccccc1F 328722730 XRCVQSNDDSDXHC-UHFFFAOYSA-N 396.510 5.097 30 20 GKED Cc1nc(-c2cccc(N=C(O)[C@H]3CCCC[C@H]3C(=O)N3CCCC3)c2)cs1 329227293 BAFFYTZSAHPGSQ-RBUKOAKNSA-N 397.544 5.135 30 20 GKED CC(C)C[C@@H]1C[C@H](/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CCO1 329503722 ZDTCQQYUNHZTIX-SFHLNBCPSA-N 387.568 5.043 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccnc3)cc2)cc1 371461754 CALGYWLYFKJZTQ-JOCHJYFZSA-N 384.439 5.115 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1sccc1Cl 419604623 ZWSZTVOYXYXJKT-LBPRGKRZSA-N 396.990 5.668 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 425677746 FQSADZQUCSORHU-CQSZACIVSA-N 389.421 5.623 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(C#N)cc2Cl)[C@@H](C)C2CC2)cc1 426156767 MROIDEDIIPDJCP-AWEZNQCLSA-N 383.879 5.053 30 20 GKED C=CCn1c(SCc2cc(C(C)(C)C)on2)nnc1-c1ccc(Cl)cc1 430133881 OFOXBBAILTZYKA-UHFFFAOYSA-N 388.924 5.362 30 20 GKED Cc1ccc(C(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1Oc1ccncc1 436325546 BNJSJUPSKBBHRE-DHIUTWEWSA-N 397.478 5.094 30 20 GKED CC1CCC(N(C[C@H]2CCCO2)C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1 437908213 MJYWGGOICAFSAK-FBPXKMNZSA-N 383.536 5.079 30 20 GKED C=CCC(CC=C)c1nc(CC(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)no1 445745801 YYBKJTFYLMXQGW-LBPRGKRZSA-N 394.302 5.032 30 20 GKED Cc1cc(C#N)cc(C)c1OCc1ncc(-c2ccccc2Br)o1 462640481 QIJQYCNDSCCGAG-UHFFFAOYSA-N 383.245 5.172 30 20 GKED C[C@@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCCC(C)(C)C#N)nnc1-c1ccco1 463035117 HAOZXWXIKFRKQA-QAETUUGQSA-N 384.549 5.567 30 20 GKED C[C@H](C(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 464272912 PQJPXBHJQRBQBX-SJCJKPOMSA-N 380.797 5.077 30 20 GKED O=C(N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccoc1C(F)(F)F 464526207 IJHZITXBVAWMGV-JTQLQIEISA-N 389.654 5.124 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc(C(F)(F)F)c1F 468028834 JEVJAYOLVGLIME-NSHDSACASA-N 396.409 5.657 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 474618603 CYFLNIFPUVTSCK-UHFFFAOYSA-N 387.405 5.297 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccc(F)cc1)[C@H]1CCCO1 475548827 OVEJOPIKWJWAEC-FYYLOGMGSA-N 396.506 5.719 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1cccs1)N1CCCC1 475556789 STFUKEPENXQWMB-FQEVSTJZSA-N 397.588 5.559 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2c[nH]c3ccccc23)CC1 475569762 HPFRXRFCFMNNHH-UHFFFAOYSA-N 399.538 6.341 30 20 GKED CCN(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H](c1ccc(C)cc1)c1cccnc1 475909378 ZERZDQGOZBEBEL-OZXSUGGESA-N 397.522 5.416 30 20 GKED Cn1c(SCCCC(C)(C)C#N)nc2sc(-c3ccccc3)cc2c1=O 476475261 DXJUBHKGUJOZQC-UHFFFAOYSA-N 383.542 5.084 30 20 GKED C=CCC1(C(=O)N[C@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)CCC1 480085963 VHGLOZNYYWIVQR-SFHVURJKSA-N 382.529 5.059 30 20 GKED C=C(C)[C@H](NCc1nnc(-c2cc(C)c(CC)s2)o1)c1ccc(F)c(F)c1 481598370 NHPQZEQZVZDHCK-IBGZPJMESA-N 389.471 5.354 30 20 GKED CCc1c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cnn1C(CC)CC 485155236 CRPHRUXOAKXYLZ-UHFFFAOYSA-N 395.551 5.368 30 20 GKED N#Cc1ccccc1OCC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485790850 SQVVIBOGQSATHJ-UHFFFAOYSA-N 380.806 5.035 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc(Cl)cc(C(F)(F)F)c3)CC2)cc1 489646253 BGAQUNRTYVKCCB-UHFFFAOYSA-N 390.792 5.160 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1ccc(C)cc1 489662760 RRVSVIHJNXSGLV-UHFFFAOYSA-N 394.525 5.448 30 20 GKED C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccc(F)c2ccccc12 489936787 RTVAVXWWFLTYSK-GOSISDBHSA-N 387.502 5.166 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc2nc(C(F)F)sc2c1 490560401 CPCHRQMOOUAHQZ-UHFFFAOYSA-N 391.418 5.593 30 20 GKED N#Cc1ccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c(Cl)c1 494632234 NLPYMKSXIPRVKX-UHFFFAOYSA-N 386.238 5.091 30 20 GKED Cc1ccc(C(C)C)c(Oc2ccc(CNCCCCC#N)cc2[N+](=O)[O-])c1 504170488 UTTDYDSMLBAKPC-UHFFFAOYSA-N 381.476 5.602 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(c2ccc(Br)cc2)CC1 504744807 FZXWINBOQCINOT-UHFFFAOYSA-N 398.304 5.041 30 20 GKED CCN(Cc1nc2cc(Br)ccc2o1)[C@H](C)c1ccc(C#N)cc1 509264818 RZCFZUSXRFEBKT-CYBMUJFWSA-N 384.277 5.045 30 20 GKED N#Cc1cnc(N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c(Cl)c1 513624070 IQKXGHCHLSAYEF-HNNXBMFYSA-N 384.867 5.359 30 20 GKED N#CCc1ccc(NC(=O)CCCC(=O)c2ccc(Cl)c(Cl)c2)cc1 513805240 NKHLCUJEBYEKAS-UHFFFAOYSA-N 375.255 5.051 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(F)cc2)c(C(F)(F)F)c1 514697977 WRVYRYVVEWYDET-OAQYLSRUSA-N 384.376 5.595 30 20 GKED CCCCCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 515540062 GSOIPUKJBAQEGZ-KRWDZBQOSA-N 397.425 5.490 30 20 GKED Cc1cc(CN(C(=O)c2sccc2C#N)C2CCCC2)c2ccccc2n1 517679769 GBXFXQOBKKLESR-UHFFFAOYSA-N 375.497 5.061 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(Cl)c(Cl)c1 518660961 MRKGGUSRMJQPSD-LBPRGKRZSA-N 394.327 5.296 30 20 GKED Cc1cc([C@@H](C)NCc2cccc(OCc3ccccc3C#N)c2)c(C)s1 520951839 OWJAWGLNFMKIQF-QGZVFWFLSA-N 376.525 5.666 30 20 GKED C[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccccc1C(F)(F)F 527349502 HLNNCIWZUHCRSL-ODIFPOPNSA-N 389.421 5.013 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2ccc(CC#N)cc2)nc1-c1ccc(Cl)cc1 534725428 IEGWHRYLMGPEJO-CYBMUJFWSA-N 395.915 5.329 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)Nc1sc(C)c(C)c1C#N 538689850 LLNNKGHSOYBXJL-UHFFFAOYSA-N 389.452 5.199 30 20 GKED C[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(NC(=O)c2ccccc2)c1 540705267 MLLVQQSLBQXURL-IAGOWNOFSA-N 387.458 5.361 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cnc3c(c2)CCCC3)cc1 541142181 DPEOEOKIEJSPCG-UHFFFAOYSA-N 399.519 5.377 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3nccnc23)cc1Cl 543467324 BFCTXLWIOXZJSS-LJQANCHMSA-N 398.853 5.191 30 20 GKED Cc1sc(C2(NCc3ccc(F)c(C#N)c3)CCC2)nc1-c1ccccc1F 550527696 QYISUGUMGNGWSH-UHFFFAOYSA-N 395.478 5.437 30 20 GKED Cc1c([C@@H](C)NC2(c3cccc(C#N)c3)CC2)cnn1-c1cccc(Cl)c1 556611846 YMJJPJBXNPQBOP-OAHLLOKOSA-N 376.891 5.046 30 20 GKED C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 558001857 JEBGMDGTJHFKHS-SJLPKXTDSA-N 388.433 5.182 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC(CCC#N)CC3)cc2)cc1 564326804 RCHCZCBMQALNKS-UHFFFAOYSA-N 395.528 5.394 30 20 GKED N#CCCCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 588817230 HNPUXQWFVBNSTF-UHFFFAOYSA-N 392.528 5.583 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)CSc1ccccc1 593159018 HHFHVFJGAQPNRC-IRXDYDNUSA-N 399.585 5.583 30 20 GKED C[C@H](N[C@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)c(F)c1 595077268 QFCZPSZMKSNGKA-VOJFVSQTSA-N 391.309 5.099 30 20 GKED Cc1ccc(CS[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)cc1C#N 600649865 ZGTKFXXZRVPCMF-CYBMUJFWSA-N 378.419 5.146 30 20 GKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)[C@@H]1CCCc2ccccc21 603693040 UCQAMKRAXVLTBY-JOCHJYFZSA-N 398.466 5.287 30 20 GKED N#Cc1c(NC(=O)CCCOc2cccc3ccccc23)sc2c1CCC2 603727284 LHEVEOSXTBQCFB-UHFFFAOYSA-N 376.481 5.059 30 20 GKED CCCCS[C@@H](C)C(=O)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 604115962 NEJLUWVKFIKROM-KRWDZBQOSA-N 384.520 5.461 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cccc(COc4cccc(F)c4)c3)[nH]c12 605362645 OBRKXNVZCFAYIK-FQEVSTJZSA-N 399.425 5.080 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CC)c1ccc(F)cc1F 606711797 TYESYXFUWARPMR-MRXNPFEDSA-N 384.879 5.529 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 609080708 MHUYDZYBLUSIQL-IBGZPJMESA-N 399.494 5.671 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCc2ccccn2)cc1Cl 609152288 UJLGGTUORKVDPI-NRFANRHFSA-N 389.886 5.352 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(-c2nc3ccccc3s2)o1 609186973 KLVJFERCOGXXRY-UHFFFAOYSA-N 381.501 5.348 30 20 GKED CCC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccn1 609207714 HBBJWONBSBHMST-QFIPXVFZSA-N 386.455 5.408 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccccc1 609399175 DLEGFGHHOPKALO-OXQOHEQNSA-N 379.529 5.553 30 20 GKED CCc1ccc(OCc2nnc(SCCC(C)(C)C#N)n2CC(C)C)cc1 610165774 OOKQMZQHJHJIJY-UHFFFAOYSA-N 386.565 5.107 30 20 GKED Cc1cc(C(=O)Nc2ccc(NC3CCCCC3)cc2)nn1-c1cccc(C#N)c1 611539252 PCASQBYHVRPNCY-UHFFFAOYSA-N 399.498 5.049 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1csc(COc2ccc(Cl)cc2)n1 618742705 PUQWCEJETGXOKF-HXUWFJFHSA-N 395.915 5.024 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1CCc2cc(F)ccc21 619129135 OLFLMLFTAPUKQF-AWEZNQCLSA-N 385.323 5.025 30 20 GKED COc1cc([C@H](C)NC(CCC(F)(F)F)CCC(F)(F)F)ccc1F 658253471 ITDURKHSXPXQPF-JTQLQIEISA-N 375.328 5.539 30 20 GKED C=CCC[C@@H](NC(=O)NCc1ccc(Cl)cn1)c1ccc(C(F)(F)F)cc1 678845636 GDWZMXRCMXOBQF-QGZVFWFLSA-N 397.828 5.261 30 20 GKED Sc1nnc(-c2ccco2)n1N=Cc1ccc(-c2ccc(Cl)cc2)s1 725793907 WKAUFEIDQZZMMI-UHFFFAOYSA-N 386.889 5.091 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 726858448 LFVXTXOEVANCIX-CXAGYDPISA-N 398.890 5.973 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc2ccccc2c1OC(F)F 728438305 TXLZAIFCFPMBRE-CMDGGOBGSA-N 397.208 5.378 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(OCC(F)(F)F)cc1 728440785 VBTYUVSIOLHBMQ-VMPITWQZSA-N 395.427 5.709 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728464974 DUEKBXQCVDCRQZ-WZONZLPQSA-N 384.479 5.483 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1 728698419 JXUDEQSFUFXCLQ-VEMDQMBVSA-N 387.410 5.805 30 20 GKED C[C@@H](CC#N)Sc1ccccc1N=Cc1cc(Br)ccc1O 731317858 FJNJRZRRLUFBSI-LBPRGKRZSA-N 375.291 5.300 30 20 GKED CCN(CC)C(=O)[C@@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 734850235 YFACEXSKQDNVNE-RPBOFIJWSA-N 397.522 5.364 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 735172422 ZENSZPBLHUOIMD-CPJSRVTESA-N 397.522 6.175 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)N1CCCSC1=Nc1ccccc1 737469455 MBXKXMRZLXZECR-UHFFFAOYSA-N 395.459 5.056 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1ccc(Cl)c(Cl)c1Cl 745613773 OUKIIVDVXVWYBS-UHFFFAOYSA-N 385.682 5.541 30 20 GKED C=C(C)COc1cc(/C=C2/SC(=S)N(c3ccccc3)C2=O)ccc1OC 747033469 GRMAMUHPDFCQDQ-XDHOZWIPSA-N 397.521 5.056 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1ccccc1Cl)c1ccc(F)cc1 752775843 SGGKNZBGHSIZGP-UHFFFAOYSA-N 395.890 5.754 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2cccnc2)C2CC2)cc1 759685627 YFRZWDMMJAMQMW-XZOQPEGZSA-N 382.467 5.010 30 20 GKED CCOc1ccc(C=NO[C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)cc1 763172010 CPIIXGLGWRAZHF-HNNXBMFYSA-N 384.863 5.814 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](F)c2ccccc2)cc1 768990578 YQASEKCGMKMUBW-NRFANRHFSA-N 376.387 5.008 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2cc(N3CCOC3=O)ccc2C)cc1 777708979 XQCFKWATCINVAB-MRXNPFEDSA-N 386.879 5.256 30 20 GKED Cc1cc(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)ccc1Cl 779759240 FTBPWCCQCALVTH-UHFFFAOYSA-N 393.899 5.277 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1c(C)noc1C1CC1 783896791 ULHDVMZNWSDGKP-UHFFFAOYSA-N 389.430 5.027 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)(F)Cl)cc1)c1nc2cc(F)ccc2s1 786403395 XMJQDZHGJMQUSL-GFCCVEGCSA-N 396.777 5.093 30 20 GKED CC(C)(C)c1cnc(COC(=O)c2cn(CCCC#N)c3ccccc23)s1 790887843 GTTALIBLIFBBJA-UHFFFAOYSA-N 381.501 5.056 30 20 GKED C[C@H](Sc1nc2ccccc2s1)C(=O)N[C@H](CCCC#N)c1ccccc1 817325019 VBFGSBKIMKBFLM-DOTOQJQBSA-N 395.553 5.328 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C=NOc2ccccc2C(F)(F)F)cc1 834967347 ZNMZQWOOPVPMJZ-UHFFFAOYSA-N 380.366 5.465 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cccc(F)c3C#N)cc2Cl)c1 864010654 IJQYEZKUPIEGCV-UHFFFAOYSA-N 391.833 5.414 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccc(Cl)s2)cc1 916948859 KEKVSSARUVTZMX-QWYCDTIGSA-N 386.904 5.276 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140846 CJWDWQSSNVJZPI-RBUKOAKNSA-N 376.481 5.189 30 20 GKED C=C(C)CNC(=S)/C(=C(/O)c1cccs1)[n+]1ccc(C(CC)CC)cc1 1115823974 ILICGHBTUFVWTC-UHFFFAOYSA-O 387.594 5.316 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2F)cc1CC(=O)O 1776131818 MGUHNYCTXXYVOP-SOFGYWHQSA-N 396.439 5.086 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cs1 1776280420 HNIRRPSXCYHDHJ-VQHVLOKHSA-N 397.521 5.763 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(F)cc(Cl)c1Cl 1776354421 GQYNEJQZOCMPSU-HWKANZROSA-N 397.229 5.514 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(O)c2)cc1)c1ccccc1 1776469392 GJFSKJFZFRJHKX-FCONWMNKSA-N 388.419 5.127 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Sc2ccccc2)cc1 1776784727 NNHGJDNDCGWUDB-HXUWFJFHSA-N 385.573 6.131 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2cccc(F)c2)c1 1776788115 SEGBYIMQCQMRPD-JOCHJYFZSA-N 387.495 5.481 30 20 GKED Cc1ccc(-c2nc(C)c(/C(O)=N/c3nnc(Cc4ccccc4)s3)s2)o1 31273907 DAKJUPNJYXRGNE-UHFFFAOYSA-N 396.497 5.099 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccccc2F)cc1 53747932 NFZBIADHSMMRSP-UHFFFAOYSA-N 377.394 5.071 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](C)c3ccc(C#N)cc3)s2)c(C)c1 63575961 MMVRPGNKROHWAL-HNNXBMFYSA-N 375.497 5.098 30 20 GKED COc1cc(Cl)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 65651450 VKAUXAYERNKYLA-MRXNPFEDSA-N 382.872 5.271 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc2ccccc21 68349696 ONOXICIGMALYHM-CYBMUJFWSA-N 393.418 5.070 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccco1)C1CCCC1 69344370 KORBXVJFGPKKQU-INIZCTEOSA-N 383.517 5.651 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1 107320413 GZMOAEYIXIDZLD-SIBVEZHUSA-N 398.506 5.182 30 20 GKED CCOc1c(Cl)cc(C(=O)Nc2ccccc2SCCC#N)cc1OC 108199503 JDDIKKYOUWSTDY-UHFFFAOYSA-N 390.892 5.005 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccn(-c2cccc(Cl)c2)n1 108241143 RPLQDNIGLRPLGE-AWEZNQCLSA-N 396.903 5.030 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1c(Cl)c2ccccc2n1C 108325291 YKCAUOBQAIOFPT-ZDUSSCGKSA-N 383.904 5.336 30 20 GKED N#C[C@@H](NC(=O)CCCCC(=O)c1ccccc1)c1cccc(Cl)c1Cl 112908196 XXAVWNINSJZEEG-QGZVFWFLSA-N 389.282 5.118 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)s1 114245684 RKHYNAOWPZNGRA-UHFFFAOYSA-N 383.860 5.275 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Nc1cccc(OCCCC#N)c1 120607843 ZJGWSSLLUVAOTA-ZWKOTPCHSA-N 379.504 5.322 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1 120773633 XKQUPNURGQXRQY-FUHWJXTLSA-N 378.501 5.105 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccncc3)cc2)cc1 124198397 ZQBZCBDIESPBTG-QFIPXVFZSA-N 384.439 5.115 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)Nc1ccc(F)cc1OCC#N 135307177 ZHFFERXUZALYEO-UONOGXRCSA-N 389.858 5.037 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nccs1 153991725 SSLMIFBAKSZWFQ-GOSISDBHSA-N 378.457 5.080 30 20 GKED COc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1OC1CCCC1 160396824 ZIOHPBKTJDWNOV-FQEVSTJZSA-N 393.487 5.183 30 20 GKED Cc1nc(CCC(=O)Nc2sc3c(c2C#N)CCCC3)oc1-c1ccccc1 171754941 HGPZCXDPXMUKDC-UHFFFAOYSA-N 391.496 5.033 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(Cc1nnc(-c2ccc(C#N)cc2)o1)C1CC1 173667545 HYZANEQIEKNIDV-KRWDZBQOSA-N 394.478 5.487 30 20 GKED Cc1cc(NC(=O)c2cccc(SCC#N)c2)ccc1Oc1ccncc1 193190810 PHKAHJMFITYMPL-UHFFFAOYSA-N 375.453 5.050 30 20 GKED C[C@H]1C/C(=C\c2ccccc2)c2nc3ccccc3c(C(=O)N(C)CCC#N)c2C1 212459616 PACOASVYJBTAEX-ONZPZFSWSA-N 395.506 5.343 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@H](C)Nc1cccc(OCCCC#N)c1 236795366 NCDLPARFPXKQKQ-SFHVURJKSA-N 379.504 5.322 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccc(SC(C)C)cc2)cs1)C1CC1 255597637 SDHKTGOYDCKLDG-WDZFZDKYSA-N 386.542 5.055 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)C1(C#N)CCCCC1 303300270 MQMPQLVQQHZFPK-CQSZACIVSA-N 387.936 5.423 30 20 GKED CC(O)=Nc1cccc(N=C(O)Nc2ccc3c(c2)OC2(CCCCC2)O3)c1 329396060 VXJXIWHTLWHEAJ-UHFFFAOYSA-N 381.432 5.384 30 20 GKED CC(C)(C)Cc1nc2cc(N=C(O)N3CCC[C@@H]3c3ccncc3)ccc2o1 329593547 ZUFRCIVZDDQTEI-GOSISDBHSA-N 378.476 5.194 30 20 GKED N#CC1(CCCN[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 375621708 WIZVJRXQBVEAMV-MOPGFXCFSA-N 380.454 5.032 30 20 GKED C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)Nc1ccc(CC#N)cc1Cl 421111659 KXAPVIYTQFNWBA-NRFANRHFSA-N 385.870 5.174 30 20 GKED CCC(CC)n1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 431778829 NRYQPJQLIFELCY-UHFFFAOYSA-N 388.471 5.469 30 20 GKED COC(=O)c1cccc(-c2nc(CS[C@H](C)c3ccc(C#N)cc3)cs2)c1 437280315 ZJPHHOXHJBHEPT-CQSZACIVSA-N 394.521 5.463 30 20 GKED CC1(C)[C@H]2CN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)c(Cl)c3)C[C@H]21 437740030 YGGZQCDURVOPQH-QRVBRYPASA-N 379.891 5.115 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(OC(F)F)cc2)C(F)(F)F)c(Cl)c1 439437325 HXDPUQPWHKTQIX-OAHLLOKOSA-N 390.739 5.206 30 20 GKED C=CCC[C@H](NC(=O)Cc1c(CC)noc1CC)c1ccc(C(F)(F)F)cc1 441579191 ZUTACODWGYKQRT-SFHVURJKSA-N 394.437 5.184 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443881870 IALQYTBJKQNZJZ-UHFFFAOYSA-N 387.386 5.261 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)CC2)cc1 444121359 ZEKLHKURJZBSHC-UHFFFAOYSA-N 397.409 5.032 30 20 GKED C[C@H](SCC(=O)N(CC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 463198813 FNOFEEPHELLQHL-ZDUSSCGKSA-N 379.312 5.344 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 463743914 IUGYKWOZFTUQJO-XIKOKIGWSA-N 379.262 5.082 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 464942223 IIGQNVMWSLEQPG-NCYKPQTJSA-N 398.428 5.107 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 465593545 GJZCLGYDLKCKTA-CDNPAEQRSA-N 391.515 5.016 30 20 GKED C[C@@H]1C[C@@H]1[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 466133151 UKVMYOLXYONADD-UAOJZALGSA-N 381.907 5.660 30 20 GKED Cc1cccc([C@@H]2CCCCN2C(=O)Nc2ncccc2OCCCC#N)c1C 466613466 FLTBURITVMHXTD-FQEVSTJZSA-N 392.503 5.140 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](c2ccc(F)cc2)C[C@@H]1C 475545813 BZWKHTBJDCBPJM-PXNSSMCTSA-N 380.507 6.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(Br)cs1 475567838 YVWJUADOYUMVGT-UHFFFAOYSA-N 393.350 5.684 30 20 GKED Cn1c(SCCCC(C)(C)C#N)nc2scc(-c3cccs3)c2c1=O 475964506 JSIFQBUKJOGTEZ-UHFFFAOYSA-N 389.571 5.146 30 20 GKED CC(C)(CC(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C1CCCCC1 476950395 IDAHEPZSSRISAJ-UHFFFAOYSA-N 395.547 5.205 30 20 GKED CCc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cnn1-c1ccc(Cl)cc1 477026749 SAPIVRLAGGUHFW-KRWDZBQOSA-N 392.890 5.114 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc3c2CCO3)cc1 477760725 QDUMCDBHGSWDJO-UHFFFAOYSA-N 386.476 5.038 30 20 GKED Cn1nc(C2CCCCC2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 478668930 FOKSXECVIUADHW-UHFFFAOYSA-N 384.483 5.259 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(-n2cncn2)cc1Cl)c1ccc(F)c(F)c1 480696333 VBXMVINAAHMTHJ-RNODOKPDSA-N 388.849 5.167 30 20 GKED CCc1c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cnn1C(CC)CC 485174188 BUMTXNBXEDPQNK-UGKGYDQZSA-N 393.535 5.110 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 494861650 RHUPDOCYZRRICU-CYBMUJFWSA-N 394.368 5.341 30 20 GKED N#C[C@H](NC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)c1ccccc1Cl 499935084 UETDVHSEEVQPTQ-HNNXBMFYSA-N 378.646 5.123 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)Sc1ccccc1 500745527 RDHKBECWAYZYSA-QGZVFWFLSA-N 388.492 5.778 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc(C(F)F)c2)cc1 511769080 GMZYKGLRBPEPKE-UHFFFAOYSA-N 394.396 5.478 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CC1 518906641 MDDXLZOAIBVKBI-QGZVFWFLSA-N 386.451 5.504 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1cccc(C#N)c1 521787411 IJKYVPIDUBDPBT-QGZVFWFLSA-N 375.497 5.093 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 524526690 SLRAJIXZVCSPIV-OAHLLOKOSA-N 391.858 5.531 30 20 GKED COC(=O)c1oc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1C 541085906 RSYDRFRIWFBCPG-IAGOWNOFSA-N 388.467 5.325 30 20 GKED N#CCC[C@@H](NC(=O)N1CC=C(c2cccc3ccccc23)C1)c1ccccc1 542738311 FOECDMKUCWBBPE-XMMPIXPASA-N 381.479 5.293 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1F 543320599 MUPQMUFEXVUPLX-XLIONFOSSA-N 399.441 5.056 30 20 GKED Cc1ccc(C2CCN(C(=O)c3cccc(Oc4ccc(C#N)cc4)c3)CC2)cn1 544015982 QHBPGVXBBDZBKM-UHFFFAOYSA-N 397.478 5.074 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(-c2nc(C)no2)ccc1C)c1ccc(F)c(F)c1 548162544 AHJVHPWHENVKLE-IBGZPJMESA-N 398.413 5.071 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 554858539 UURHOTJPLVVKAZ-FQEVSTJZSA-N 393.874 5.561 30 20 GKED CC[C@@H](C)Oc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 560135487 UICNPLUHLZLVFX-MRXNPFEDSA-N 390.439 5.160 30 20 GKED Cc1c(NC(=O)c2ccccc2-c2ccccc2C#N)cccc1-c1ncco1 560989236 FWKVUNQLYYEHBP-UHFFFAOYSA-N 379.419 5.441 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2(C(F)(F)F)CC2)cc1Cl 574430569 NKYOBBUANAKDCB-INIZCTEOSA-N 392.808 5.667 30 20 GKED C=CCN(C(=O)[C@@H]1CCC(=O)c2ccccc21)c1nc(-c2ccccc2)cs1 581681280 HZECNYLKNQTDRJ-LJQANCHMSA-N 388.492 5.089 30 20 GKED N#Cc1ccc(CNCc2nc(-c3ccccc3F)cs2)c(C(F)(F)F)c1 581708649 HCZRMJRALPBTOF-UHFFFAOYSA-N 391.393 5.129 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)CCCCC#N)c2)cc1 593991500 FIUUAKCBJIPXAH-LJQANCHMSA-N 378.516 5.744 30 20 GKED N#CCCC[C@@H](NCc1oc2ccccc2c1Br)c1ccccc1 594518529 JDARNPWXWFKUDT-QGZVFWFLSA-N 383.289 5.720 30 20 GKED C[C@H](CC#N)C(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 596714634 ROGNTXKMVWHUTF-RKVPGOIHSA-N 391.902 5.406 30 20 GKED N#CCCC[C@H](NC(=O)NCc1csc(C(F)(F)F)c1)c1ccccc1 599225743 NNRLHDCSFYKPNV-HNNXBMFYSA-N 381.423 5.001 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1[C@H]2c3ccc(Cl)cc3C[C@H]21 599410152 YWKDOIMAIGWXNO-WWIODWGFSA-N 382.916 5.259 30 20 GKED CCOc1cc(CN[C@H](C)c2ccc(C#N)cc2)ccc1OCc1ccccc1 603633237 AKUAQMPKGVZUKD-LJQANCHMSA-N 386.495 5.387 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)s2)c(C)c1 605362862 WMICGJBULJICDO-MRXNPFEDSA-N 386.480 5.102 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C1(c2ccccc2C)CC1 609060544 HWEZKTZGFIQGPE-UHFFFAOYSA-N 396.490 5.424 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1)c1ccccc1 609168739 DFBMHIBUEYWYAA-SFHVURJKSA-N 394.478 5.590 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1coc2cc3c(cc12)CCC3 609377262 SSWWJVOUNRMWAQ-HNNXBMFYSA-N 390.508 5.354 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C[C@H]1CCc2ccccc21 609651372 DWJTVYKIWXZKAH-JOCHJYFZSA-N 396.490 5.504 30 20 GKED N#Cc1cccc(C(=O)N(c2cccc(N3CCCC3)c2)C2CCCCCC2)c1 609905591 FOKWLJMRCPTLKD-UHFFFAOYSA-N 387.527 5.528 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)c3)cc2)nc1 610052299 UZMHGCLRQXNGHI-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc3ccsc3[nH]2)cc1F 610313322 HOLFUWSYUYHCJB-UHFFFAOYSA-N 377.400 5.285 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 610361741 JPAJKSFUTRCCRN-OAHLLOKOSA-N 394.396 5.735 30 20 GKED CC(C)(C)c1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 726501464 AXNWMFLVKLFQPL-SFHVURJKSA-N 375.497 5.348 30 20 GKED Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1 728175171 KUSCGPCFINMBPJ-UHFFFAOYSA-N 391.471 5.394 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)c1 728481235 RDTQVJIXPJZMCZ-UHFFFAOYSA-N 385.492 5.043 30 20 GKED C=CC[C@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccncc1 734361704 WRUVTKQVJWPBOF-QFIPXVFZSA-N 379.463 5.344 30 20 GKED CCc1cccc(C)c1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740428421 UQLFVTBGQCSDIT-UHFFFAOYSA-N 375.497 5.479 30 20 GKED Cc1cc(C)cc(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 741058624 GTJCEFQWSNPXMT-DEOSSOPVSA-N 383.495 5.323 30 20 GKED CC[C@H](C)Oc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)ccc1OC 741844033 MQTVJINDSGMRTG-HWPRWLFBSA-N 390.892 5.131 30 20 GKED Cc1cccc2c(N3CCC([C@@H](O)c4ccc(Cl)cc4)CC3)c(C#N)cnc12 742405694 AHHONNJMNBTAKT-QHCPKHFHSA-N 391.902 5.018 30 20 GKED C[C@@H]1/C(=C\c2csc(-c3ccccn3)n2)C(=O)c2cccc(Br)c21 742433943 BAHKENCWECWEAF-ZECSTPGPSA-N 397.297 5.351 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)N(C)c1ccc(-c2ccccc2)cc1 742789104 WDCMGTDXENCOEM-UHFFFAOYSA-N 381.435 5.194 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 743457237 AINBUQUXICDTPO-CPPNXCSESA-N 387.439 5.101 30 20 GKED Cc1ccc(CC[C@@H](C)NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 743623790 COGKMVBTISYMGY-OAHLLOKOSA-N 393.512 5.009 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1cccc(Cl)c1 744031397 VWAGCKDGOIVQCH-HZMBPMFUSA-N 395.673 5.098 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744035985 VCEVWKJAPUZHSX-CRNXPOROSA-N 390.936 5.500 30 20 GKED CC[C@@H](Oc1ccccc1F)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749027225 YXFWWMLHWQKCOB-QFBILLFUSA-N 394.471 5.292 30 20 GKED Cn1nnc2cc(/C=C(/C(=O)c3ccccc3)c3nc4ccccc4s3)ccc21 751032162 FHGAVKWSLALPKX-LGMDPLHJSA-N 396.475 5.002 30 20 GKED O=C(/C=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cc(O)cc(O)c1 753716241 CJAKZSSKRULSAD-AATRIKPKSA-N 391.370 5.136 30 20 GKED C#CC[C@@H](NC(=O)Nc1cccc(CSc2ccccn2)c1)c1ccccc1 757877835 ARSHLMRCSVIWGK-OAQYLSRUSA-N 387.508 5.260 30 20 GKED C=CC[C@@H](N[C@H]1CCc2c(Cl)cc(Br)cc21)c1ccncc1 760329593 KXZAUNAMKXKJHT-MSOLQXFVSA-N 377.713 5.392 30 20 GKED C[C@H](OC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1cccc(C#N)c1 764603895 FBFODVYHMIWVJJ-ZCOSWFLJSA-N 377.406 5.311 30 20 GKED C[C@@H](NC1CCN(c2ccc(C(C)(C)C)cc2)CC1)c1ccc(OCC#N)cc1 772958467 GYTHJPJZJOJHGC-LJQANCHMSA-N 391.559 5.206 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCSc3ccc(Cl)cc32)c1 772983831 MHLYTMISQURENS-PXNSSMCTSA-N 386.948 5.738 30 20 GKED Cc1ccc(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 773982306 DTNBOZUQUGNYHG-MDGVGCGJSA-N 379.872 5.057 30 20 GKED CCCCc1ccc([C@@H](C)Nc2ccc(N3CCC(O)CC3)c(C#N)c2)cc1 777117974 PVCDVIJDUGXIQJ-GOSISDBHSA-N 377.532 5.035 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1ccc(Cl)nc1C(F)(F)F 786732655 UKDFHIJTJFJKDS-UHFFFAOYSA-N 397.731 5.332 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc2c(c1)Nc1ccccc1S2 789059343 AFVAWLJCVFPEQM-UHFFFAOYSA-N 398.491 5.572 30 20 GKED O=C(c1ccc(SC(F)(F)F)cc1)N(CCC(F)(F)F)CC(F)(F)F 791117731 RAYIGZYMRDYXIP-UHFFFAOYSA-N 399.278 5.255 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3cc4cccc(OC)c4o3)cs2)cc1 797152720 UJYLBASCXNGWAI-FLIBITNWSA-N 391.448 5.470 30 20 GKED N#CC1(CCCSc2nc3cccc(Br)c3s2)CCOCC1 798371667 FYBKEMNQKCUEOI-UHFFFAOYSA-N 397.363 5.251 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813217222 DHWFMOQRGDFEMF-DYVFJYSZSA-N 390.405 5.042 30 20 GKED C#Cc1cccc(NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)c1 819395397 OBLUVBYDPNGCCJ-UHFFFAOYSA-N 383.476 5.089 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CCO[C@@H](c3cccs3)C2)cc1 834902631 FIIMKJHBVJEJJX-KVSKMBFKSA-N 377.937 5.450 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1cc(Cl)c2c(c1)OCCCO2 836491791 AHEPLOVPNTVKDD-UHFFFAOYSA-N 385.769 5.071 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(-c2noc(CC3(C#N)CCCCC3)n2)c1 849341220 HGOLBBXTLYVTBC-UHFFFAOYSA-N 382.464 5.100 30 20 GKED N#CC1(CCCC[S@](=O)Cc2cccc(C(=O)Nc3ccccc3)c2)CCC1 899392067 NLECRADOEYJQBV-NDEPHWFRSA-N 394.540 5.052 30 20 GKED C=C[C@H](Cc1nc(-c2ccc(OCc3cccnc3)cc2)no1)c1ccccc1 904465974 LGUMHEZBRBPNNG-LJQANCHMSA-N 383.451 5.223 30 20 GKED N#C[C@@H](C(=O)COc1cccc2ccccc12)c1nc(-c2ccccc2)cs1 915102209 OLVHRLDQMCRTMP-IBGZPJMESA-N 384.460 5.219 30 20 GKED C[C@@H](/N=C/c1cc2ccccc2nc1O)c1ccc(OCc2cccnc2)cc1 915271254 QKIGPLYHEPDPEQ-CIRUFVMISA-N 383.451 5.095 30 20 GKED CCCCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)cc1 916627476 XFKMGJDJPQQPSZ-LJQANCHMSA-N 375.472 5.022 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(Cc2ccccc2)[C@H](C)CC)c1=S 917454096 AKTGHTLQZOAHNG-QGZVFWFLSA-N 382.533 5.118 30 20 GKED N#C[C@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1nc2ccccc2o1 917509801 AEJIANBCPQLXKN-NWNNTGRJSA-N 388.423 5.445 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)ccc1Cl 1776033607 GRBGCHKXCRXQFZ-CQSZACIVSA-N 396.796 5.793 30 20 GKED CC(=NNc1c(Cl)cccc1Cl)c1cc(C(=O)O)ccc1OC(C)C 1776048816 BWNUEPTUQYPTDW-UHFFFAOYSA-N 381.259 5.315 30 20 GKED Cc1c(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)cccc1C(=O)O 1776087778 WCNUIGKLPQJCHL-MRXNPFEDSA-N 376.378 5.448 30 20 GKED CC(=Nn1c2ccccc2c2ccccc21)c1sc2ccccc2c1C(=O)O 1776112966 RJMSDQRZGKCQLM-UHFFFAOYSA-N 384.460 5.980 30 20 GKED CCOc1c(Cl)cccc1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776910389 VVCBUVQNSNGFEF-CSKARUKUSA-N 388.847 5.120 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1sc2c(Cl)cccc2c1C 1777269402 GMLLWJPRFNMHQW-HJWRWDBZSA-N 386.856 5.466 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 14576724 DDTRNQRUFGDNSS-OAHLLOKOSA-N 399.475 5.241 30 20 GKED C=CCc1ccc(OCC(=O)Nc2c(CC)ccc(Cl)c2CC)c(OC)c1 14663903 IPGZEDKHNALXNY-UHFFFAOYSA-N 387.907 5.219 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCCC2=CCCCC2)cc1 25183504 IBGNHUUNGKWCJL-UHFFFAOYSA-N 376.525 5.471 30 20 GKED CCCCN/C(S)=C(/C(=O)c1cc(C)c(C)c(C)c1C)[n+]1ccccc1CC 27323378 QNWHCZCTTUPCIG-UHFFFAOYSA-O 397.608 5.099 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N(C)[C@@H](C)CC#N)cc3C2)cc1 91034797 NAJIEOCQIAOHJO-KRWDZBQOSA-N 376.504 5.096 30 20 GKED CCn1cc(CC(=O)Nc2ccccc2SC[C@H](C)C#N)c2ccccc21 108237435 BFSGCGLCABVDSR-MRXNPFEDSA-N 377.513 5.094 30 20 GKED COc1c(C)cc(CN(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 108532408 ICKZVBOLCHFQJT-HNNXBMFYSA-N 397.544 5.228 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 123266909 QCMRMBXHUOOJGE-VGOFRKELSA-N 380.451 5.048 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 125406161 RGSITWPTKYOWOU-QHCPKHFHSA-N 398.466 5.423 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)o1 133833938 KZHGARLKZBBLGY-ZDUSSCGKSA-N 384.892 5.254 30 20 GKED COc1ccc(CN(C)[C@H](C)c2nc3ccccc3s2)cc1OCCCC#N 179734462 JERRASAJBDEGPG-MRXNPFEDSA-N 395.528 5.180 30 20 GKED CCCN(CCc1cccs1)C(=O)Nc1ccccc1SC[C@H](C)C#N 187112169 COUDTCWMZHNAFG-MRXNPFEDSA-N 387.574 5.486 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(Cc2ccccc2)n1 189869921 OZFMVLGRSMYHQP-UHFFFAOYSA-N 390.552 5.767 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3cccc(OCCCC#N)c3)oc12 236988138 PATGPSIGFGCVKW-QGZVFWFLSA-N 378.472 5.365 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1 237509974 KAWGCIJULZDDQS-BVZFJXPGSA-N 382.463 5.603 30 20 GKED OC(=Nc1nc(-c2cc(Cl)sc2Cl)cs1)[C@@H]1C[C@@]12CCOC2 329543750 FPBKNLCNSDKEMB-RMLUDKJBSA-N 375.302 5.193 30 20 GKED COc1ccc2c(c1)CN(CCCC1(C#N)CCOCC1)[C@H](C1CCCCC1)C2 410404639 AXWKVMCKWYDRLO-DEOSSOPVSA-N 396.575 5.103 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cnn1C1CCCC1 430594934 WPSDZYRIVQEMHG-HNNXBMFYSA-N 384.549 5.195 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](CC(F)(F)F)C3)cc2)c1 434148224 NZLLMFYJDSEQNB-OAHLLOKOSA-N 389.377 5.157 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2cccnc2)n1Cc1ccccc1 436135919 GJJWTNDYUMWBCS-UHFFFAOYSA-N 391.544 5.201 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1)c1ccccc1 440234617 AUMZOSPUWQETFH-XMMPIXPASA-N 383.495 5.443 30 20 GKED CC1(C#N)CCC(N[C@H](Cc2ccccn2)c2ccc(Br)cc2)CC1 449278428 JGEXXALYPHVVBE-VEDCXYSMSA-N 398.348 5.190 30 20 GKED Cc1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1 455068857 VLDKYBKAVBBELL-MJUUVYJYSA-N 391.519 5.109 30 20 GKED N#CCc1ccc(NC(=O)N2CC[C@@](F)(c3cccc(Cl)c3)C2)c(Cl)c1 455737695 ULAXMWGCUQOCFC-IBGZPJMESA-N 392.261 5.162 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cncc(-c4ccccc4)c3)n2)cc1 467067810 GWWRQRSBZLHTBB-OAQYLSRUSA-N 395.487 5.671 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 468841668 FIPSQTDTINAEHU-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CC[C@@H](C)Sc1ccc(NCc2nnc(-c3cccc(C#N)c3)o2)c(C)c1 471636182 UJODLYTXNSJASH-OAHLLOKOSA-N 378.501 5.419 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1Br 473679481 VGEMIBVIFADEQH-LBPRGKRZSA-N 389.318 5.262 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 475548007 LCMSTYJCEHEFPL-LJQANCHMSA-N 380.507 5.774 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCOc2ccc(OC)cc21 475548943 KXYUBIJGAJDCLR-FQEVSTJZSA-N 380.488 5.192 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nc(-c2ccccc2Cl)cs1 478341594 RRUTXOMEMAGPRS-CQSZACIVSA-N 399.972 6.327 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCc2ccc(Cl)cc2C#N)cc1Cl 478353504 ZAXSFKPSWJCJAO-UHFFFAOYSA-N 390.314 5.396 30 20 GKED N#Cc1cccc(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)c1F 480161524 RVKZGALOHIUTEB-UHFFFAOYSA-N 377.366 5.452 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1 480517629 XFPHXYDIMSEEQX-XZOQPEGZSA-N 390.527 5.157 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(C(F)F)CC1 482916578 AIJSPDUICAJRGG-UHFFFAOYSA-N 385.414 5.168 30 20 GKED C[C@@H](NC(=O)Nc1ccnn1C(C)(C)C)c1ccc(-c2cccc(C#N)c2)cc1 484766293 IDFMSBHVCWDQHF-MRXNPFEDSA-N 387.487 5.059 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccc(C#N)cc1 495168047 POIZGYRZBISHJP-UONOGXRCSA-N 395.915 5.118 30 20 GKED C=C(C)CN(C)C(=O)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 498660953 IJDSLTIDBJWEAN-IBGZPJMESA-N 392.421 5.021 30 20 GKED CCCCCn1cc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1 503499570 URENJVYNMJCOFP-INIZCTEOSA-N 399.564 5.098 30 20 GKED C[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 508275991 RSGYCPBBYPDPDL-AWEZNQCLSA-N 387.936 5.465 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)s1 510284695 XFPYBDCDZAXWAX-UHFFFAOYSA-N 393.424 5.189 30 20 GKED CCc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1 513961224 YPLZTIKFZAKVAV-UHFFFAOYSA-N 387.458 5.494 30 20 GKED CC[C@@H](C)[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 515195495 YOEHKHXQGSUIGR-UZUQRXQVSA-N 399.494 5.822 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N(C)Cc1ccc(C#N)cc1 515553229 YVHZTDDIGSWEEA-GFCCVEGCSA-N 379.312 5.004 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 517351654 VPKWUKGXSCVGAS-IFXJQAMLSA-N 390.911 5.321 30 20 GKED C=CCN(C(=O)[C@H](C)OCC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 518173060 RTXVVMWLNWDJGU-KRWDZBQOSA-N 392.524 5.421 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 518739253 UVBSIOUWYKSDGD-AWEZNQCLSA-N 393.537 5.765 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)Nc3cccc(C#N)c3)s2)cc1 520771188 ACBOARBINJXYJR-OAHLLOKOSA-N 376.485 5.181 30 20 GKED COc1cc(C#N)ccc1OCCSCc1cc(Cl)cc2cccnc12 524885331 SLUCYZNRMRFGHO-UHFFFAOYSA-N 384.888 5.081 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)NC[C@@H](C)C#N 532057067 REVCGXOSSHVAFI-AWEZNQCLSA-N 393.466 5.013 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@H]1NCc1ccc(C#N)cc1F 532567027 FJBQGUCSDPYJPG-ZMZPIMSZSA-N 391.309 5.033 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(CC1CCCCC1)C1CC1 532921864 RITBCCWHFGTPJI-KRWDZBQOSA-N 385.577 5.064 30 20 GKED Cc1cccc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1Br 536054619 ZWRMBAHCFFSLRZ-ZDUSSCGKSA-N 398.087 5.059 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 536383351 SLWUQBVLKCHHIW-UHFFFAOYSA-N 394.780 5.194 30 20 GKED N#Cc1ccc(CNCc2ccc(Oc3ccccc3C(F)(F)F)nc2)s1 537297826 ASDMXNXHEFPQEJ-UHFFFAOYSA-N 389.402 5.116 30 20 GKED COc1cc([C@H](C)NCc2ccc(F)cc2C#N)ccc1OCc1ccccc1 538153788 ZEBZKVADUOGHKP-KRWDZBQOSA-N 390.458 5.136 30 20 GKED CCCCOc1ccc([C@H](C)NCc2ccccc2C(C)(C)C#N)cc1OC 539272209 MGDPCKFTRZETAW-SFHVURJKSA-N 380.532 5.526 30 20 GKED Cc1cc(C(=O)N(Cc2ccco2)c2ccccc2C#N)nn1C1CCCCC1 539549669 QKINBMJDCDTDMJ-UHFFFAOYSA-N 388.471 5.008 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)c1 540081655 SPUFMPWAIHBVNF-FQEVSTJZSA-N 395.462 5.129 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-n2cncn2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543961437 JQSOYNFHVHMQRZ-RTBURBONSA-N 393.494 5.218 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)NCC(C)(C)CCC#N 554418088 ULYGMEOHHSLZHY-UHFFFAOYSA-N 399.466 5.387 30 20 GKED CC(C)c1scnc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 555065252 HNWSIGYTICGENE-ZDUSSCGKSA-N 387.917 5.533 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C1CC1)C1(C#N)CCC1 560102320 UAYDIKZYFOBOBT-UHFFFAOYSA-N 395.506 5.190 30 20 GKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1 570415176 VGFBOTPJLBIMHZ-ROUUACIJSA-N 385.467 5.028 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)c1 574189938 YUVYLJHEIXGTLH-UHFFFAOYSA-N 390.855 5.136 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1ncc(C#N)cc1C 578649387 PMKMGPUUDVCORE-UHFFFAOYSA-N 391.858 5.055 30 20 GKED Cc1c(C(=O)N2CCC(CCC#N)CC2)sc2ccc(Br)cc12 582493102 SJNUEWMWEOVQPE-UHFFFAOYSA-N 391.334 5.128 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CNC1(c2ccc(C#N)cc2)CCC1 594032398 GRLZGYMEDUJFJU-UHFFFAOYSA-N 389.543 5.413 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1F 596606939 ZXIMUVHSTRQNPM-LEWJYISDSA-N 395.478 5.116 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)C1 596704309 KJPQKIWAHHDESH-HNNXBMFYSA-N 385.920 5.649 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CC[C@](C)(C#N)C3)c(F)c2)cc1 596916149 HVWKNZFGJTWZKZ-JOCHJYFZSA-N 381.451 5.047 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)Nc1cccc(C#Cc2cccs2)c1 597261336 ANLSOSRGQANBQA-MRXNPFEDSA-N 376.481 5.078 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)CC1 601178405 MPJAGWDJOGZEPE-UHFFFAOYSA-N 381.476 5.532 30 20 GKED C[C@H](SCc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603756318 NDEGGQLITYITMP-INIZCTEOSA-N 389.480 5.006 30 20 GKED Cc1nc(NC(=O)c2cccc(CC#N)c2)sc1Cc1ccccc1Cl 603975384 XBVJMDRBFAJEBB-UHFFFAOYSA-N 381.888 5.014 30 20 GKED CC(C)c1noc([C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 604046666 IPHHYNQPCZKPDL-CYBMUJFWSA-N 382.851 5.683 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(OC(F)(F)F)cc1 609387263 VLBZDLQXCUXBGT-UONOGXRCSA-N 380.435 6.010 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 609986934 MVYJNNFMGWPUBP-UHFFFAOYSA-N 380.451 5.355 30 20 GKED C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 610187186 YQWVONHWNCKGOO-IEGUWTFLSA-N 397.478 5.152 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1)C1CC1 611095319 PTOMBSWQRBBRKK-OAHLLOKOSA-N 383.879 5.075 30 20 GKED Cc1ccc(CN(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)C2CC2)o1 611362945 FVBHMQIBXRTNKM-UHFFFAOYSA-N 385.467 5.001 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(C#N)c(F)c1 611465409 KVKBOKVSDLYJNZ-XDTLVQLUSA-N 382.323 5.257 30 20 GKED FC(F)(F)c1cccnc1NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 642226894 XCKPVEKSJGUBQY-YUMQZZPRSA-N 380.254 5.422 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 676723678 DCXKBYZMYNHTDF-KBXCAEBGSA-N 377.410 5.168 30 20 GKED Fc1cncc([C@H](NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C2CC2)c1 684954726 XFELVBRIABOVIH-LALPHHSUSA-N 384.339 5.171 30 20 GKED Cc1cccc(COc2cccc(NC(=O)c3ccccc3SCC#N)c2)c1 732166308 WPRWHPNMBALTSR-UHFFFAOYSA-N 388.492 5.442 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccncc1 734237726 UCGVVJMVVPWVEP-HNNXBMFYSA-N 391.521 5.467 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740059483 JOCMCWJCYYSUTM-OAHLLOKOSA-N 393.487 5.328 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C(\C)c2ccc(F)cc2)cc1 743447222 LGFNJPWDDIWHAF-ZCVWUUOSSA-N 378.447 5.090 30 20 GKED O=C(Cc1cccc(F)c1)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746437125 KEEMXOMQFOATJU-HNNXBMFYSA-N 380.259 5.234 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3c(Cl)cccc3Cl)c2)s1 747403578 ZPSRNLKBGGYDDA-UHFFFAOYSA-N 387.291 5.524 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3cnc(-c4ccncc4)s3)c(C)c2c1 753142844 ASGHOZBXFAFHNV-PLNGDYQASA-N 376.437 5.164 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1nc2ccccc2s1 760963685 LLSUKGBYDPQSGO-CQSZACIVSA-N 382.435 5.263 30 20 GKED Cc1nc([C@H](C)OC(=O)Cc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 763957332 YQZDDLVQNKAKRW-AWEZNQCLSA-N 380.831 5.022 30 20 GKED Cc1ccc(CN(Cc2ccc(N(C)CCC#N)cc2)Cc2ccco2)s1 769138917 DISITZRRAXIGQK-UHFFFAOYSA-N 379.529 5.202 30 20 GKED C=CC[C@H](C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 778678260 JZAFTAHWURBSQI-KRWDZBQOSA-N 384.451 5.471 30 20 GKED COc1ccc2cccc(CC(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2c1 780359710 YEAGVGIXMJGOED-SFHVURJKSA-N 390.439 5.016 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1ccc(Br)cc1 783736271 WWTIEMLDZVBHST-UHFFFAOYSA-N 392.347 5.264 30 20 GKED C[C@H](NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1ccc(OCC#N)cc1 785568982 ASUMFPNDFIFMBG-AWEZNQCLSA-N 392.396 5.129 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)Nc1ccsc1 790313430 NTHFETUBZMOHMP-UHFFFAOYSA-N 381.501 5.471 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3snc(C)c3C#N)c3ccccc3n2)cc1 798240514 IMKIMVXMQNEJBQ-UHFFFAOYSA-N 384.464 5.099 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1)c1ccncc1 798414357 LLLGZZIOEHWGGL-LJQANCHMSA-N 387.886 5.023 30 20 GKED Cn1cc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)c(C(F)F)n1 812241671 LAEXIKDREILJFA-RVDMUPIBSA-N 395.434 5.391 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)c(Cl)c1)c1cc(C(F)(F)F)ccn1 813216174 NZSPVHIHDJOKER-LBPRGKRZSA-N 387.188 5.216 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2)CCCCC1)c1cc(C(F)(F)F)ccn1 813218353 OSDIHMINDHPTRP-QGZVFWFLSA-N 390.380 5.318 30 20 GKED CC(=NNc1nc(C(F)(F)F)cs1)c1sc(Cc2ccccc2)nc1C 814868108 VCYYJNKNMQMYJC-UHFFFAOYSA-N 396.463 5.354 30 20 GKED CC(C)c1ccc(C2(O)CCC(N[C@@H](CCCC#N)c3ccccc3)CC2)cc1 815635538 FCKHGMVZGFUYEI-JNLGVIEDSA-N 390.571 5.965 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)N[C@H](CCCC#N)c1ccccc1 838613158 UMAXSRNWAQZHRM-OAQYLSRUSA-N 379.504 5.139 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H]2CCCc3c2[nH]c2ccc(Cl)cc32)cc1 858297767 HJJYYQNXHAFXBW-QKKBWIMNSA-N 379.891 5.279 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2ccc(-c3ccccc3)o2)SC1=S 917645007 QLDQLFFHNAMHQB-XDHOZWIPSA-N 388.473 5.224 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1oc2c(C)ccc(C)c2c1C 920104454 TWZSEAFTGOESLS-KRWDZBQOSA-N 384.435 5.353 30 20 GKED CC(C)(C)OCc1ccccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 932538885 KTPFJHLRQFIOLO-UHFFFAOYSA-N 389.499 5.195 30 20 GKED O=C(O)c1ccc(NN=Cc2sc(Sc3ccccc3)nc2Cl)cc1 1776013247 PWTQZRLOOLAELI-UHFFFAOYSA-N 389.889 5.092 30 20 GKED O=C(O)c1cc2cc(C=NNc3c(Cl)cc(Cl)cc3Cl)ccc2o1 1776014324 CKMVSDSEWSNSLA-UHFFFAOYSA-N 383.618 5.537 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NN[C@H](C)C(C)(C)C 1776065099 VBIPXFMDNBOHLV-GOSISDBHSA-N 396.531 5.297 30 20 GKED Cc1ccc(Cl)cc1NN=Cc1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1776106572 LOKMDYYRDJUMIK-OAQYLSRUSA-N 394.858 5.299 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(F)c1OC(F)(F)F 1776784096 XBHPWXWLWQVJCC-AWEZNQCLSA-N 379.394 5.018 30 20 GKED CCc1ccc(-c2ccc(/C=C3\CCc4oc(C(=O)O)c(C)c4C3=O)o2)cc1 1776964180 PNMDZPZTKKURSD-FOWTUZBSSA-N 376.408 5.321 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3ccc(Br)cc3C2=O)c(Cl)c1 1777673226 IJSQLNYFJJXVNF-GHXNOFRVSA-N 391.648 5.013 30 20 GKED C[C@@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(C#N)CC1 57876035 FTMWQCIXFNQOSK-INIZCTEOSA-N 378.907 5.035 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 63961994 IPAASXBSGOTAKS-UHFFFAOYSA-N 394.805 6.006 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66956270 MYVYKDZXIFLRKT-FXAWDEMLSA-N 379.529 5.758 30 20 GKED COc1ccc(F)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 92872613 ZSZSXTXPJRVDJF-UHFFFAOYSA-N 378.428 5.109 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H](CCC#N)c2ccccc2)c1 119772690 BNVACYVHEZDWJD-GOSISDBHSA-N 398.894 5.245 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)CCCCOc1cccc(C#N)c1 152953084 DRBIXTRKGOOLBH-KRWDZBQOSA-N 399.560 5.215 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(NC(=O)C2CC2)ccc1C)c1ccccc1 155192786 SPKUWKHFQNCAFC-FQEVSTJZSA-N 377.488 5.173 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Cc2ccc(C(F)(F)F)cc2)n1 177761416 VCFUOVUJQMSGMH-IUODEOHRSA-N 380.435 5.340 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 185482446 LTEZTIGEQHESBA-PXAZEXFGSA-N 379.476 5.058 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Br)c1F 192294229 JUXZIHIDWKHXAJ-NSHDSACASA-N 393.281 5.235 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)c1 206974365 ZQILISBNWGUEGC-QXMHVHEDSA-N 386.838 5.360 30 20 GKED CC(C)C(=O)Nc1cccc(NCc2cccc(OCc3ccccc3C#N)c2)c1 236578962 XTZLSSKHRBBQST-UHFFFAOYSA-N 399.494 5.344 30 20 GKED CCC(CC)c1cc(CNCc2cccc(OCc3ccccc3C#N)c2)on1 236730550 AFAYJLUPDMGYOS-UHFFFAOYSA-N 389.499 5.319 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(NCc2ccc(N(C)CCC#N)cc2)cc1 237352163 WGNCNNOXWFBQKY-HXUWFJFHSA-N 376.548 5.023 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Sc1ccccc1Cl 303281857 KIFLDYLQCXRBAF-KBPBESRZSA-N 390.961 5.711 30 20 GKED N#CCCCOc1cccc(NCc2ccc(Cl)c(Br)c2)c1 317577568 FSHFVFGCZGSTAE-UHFFFAOYSA-N 379.685 5.397 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)c(Cl)c1 426130345 VWVAKVAQKLBUGM-INIZCTEOSA-N 382.876 5.190 30 20 GKED Cc1nc([C@H]2CCCN2Cc2cccc(OCc3cccc(C#N)c3)c2)cs1 428404881 WQROQMCAXUVQHT-HSZRJFAPSA-N 389.524 5.239 30 20 GKED Cc1cccn2cc(-c3ccc(NC(=O)c4cccc(SCC#N)c4)cc3)nc12 431171517 SMMHPBFJPITXEA-UHFFFAOYSA-N 398.491 5.178 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 431806533 BRYKIVGMOVMMEI-BEFAXECRSA-N 387.430 5.083 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 432103755 UYGKMHQEOZRBGV-ZVZYQTTQSA-N 399.947 5.659 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)C2(c3cccc(C#N)c3)CC2)cc1 435078972 VOLDLTMHYWECTH-SFHVURJKSA-N 396.490 5.143 30 20 GKED CCN(C(=O)CCCSc1ccc(OC)cc1)[C@H](C)c1ccc(C#N)cc1 436141114 MRJGJLYQPOWQHR-QGZVFWFLSA-N 382.529 5.049 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1C 438074297 OFBPYZSLJJDOME-RUZDIDTESA-N 395.506 5.467 30 20 GKED Cc1cnn(-c2ccccc2)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 439824175 ODMDZZWHKPVYOI-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C=CCN(Cc1cccs1)C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 448137918 QJDCILDRONSHAN-UHFFFAOYSA-N 383.410 5.152 30 20 GKED CCC(CC)Oc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 453619654 CQJVSVZOOATMIU-LJQANCHMSA-N 391.496 5.263 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1ccc(F)c(C#N)c1 469693242 YGRDSAOYGVJVGC-AWEZNQCLSA-N 394.475 5.354 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NCc1csc(-c2ccccc2)n1 471885397 DCJMVEWWDOSSHB-UHFFFAOYSA-N 377.513 5.098 30 20 GKED C[C@H](Oc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1 476062747 OTAQFIJJZYZTML-SIKLNZKXSA-N 384.479 5.853 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)F 476171692 ZYIMDGQGVXHWON-OALUTQOASA-N 385.454 5.882 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 477745475 VNACRVFXXOOYQK-HXPMCKFVSA-N 380.385 5.263 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1nccc2ccccc12 483236578 OYJKAACLYIWLOC-HXUWFJFHSA-N 397.865 5.804 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)[C@@H]1CCC(F)(F)C1 483652157 SICRLUAMSDZAIY-MRVPVSSYSA-N 389.336 5.437 30 20 GKED C=CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)CC1CCCCC1 484543337 PPDCCJUNTXPMAS-GOSISDBHSA-N 385.577 5.088 30 20 GKED CSc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)cc1Cl 487178436 VEZKFYAQJKZGQS-QGZVFWFLSA-N 393.339 5.880 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 488839723 OFKMURGXEQGMSW-INIZCTEOSA-N 376.378 5.073 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 492170105 UJWOTTWEBNNBHO-ZPHPHTNESA-N 381.479 5.097 30 20 GKED CCCCOc1ccc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cc1OC 499316245 KBNSTAAUENKCMC-UHFFFAOYSA-N 380.488 5.049 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(C(F)(F)F)cc2Cl)c1 503226642 SBMFEGODOHRDHN-UHFFFAOYSA-N 397.784 5.685 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc(-c4ccccn4)ccc3Cl)CC2)cc1 503911759 RMYSUSVIYGCQNP-UHFFFAOYSA-N 399.881 5.203 30 20 GKED COc1cccc(C2(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)CC2)c1 511176336 XSZZQOQKWWTMPH-UHFFFAOYSA-N 384.435 5.029 30 20 GKED N#Cc1ccccc1OCCSCc1cccc(C(=O)Nc2ccccc2)c1 517298105 JGFGHRSZMHWKOH-UHFFFAOYSA-N 388.492 5.123 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(OC)c1)c1nc(-c2ccccc2)cs1 519321162 AYUMPKHFFRANPK-WOJBJXKFSA-N 390.508 5.141 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]nc3-c3ccc(F)cc3)cc2)cc1 519991406 IIIRXEJOVJGAOS-UHFFFAOYSA-N 398.397 5.132 30 20 GKED N#CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)CC1 520311930 VYYLUEVQQHQXAI-SAPNQHFASA-N 399.519 5.159 30 20 GKED CSc1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 521668262 PZFQBRNLQJDTDY-UHFFFAOYSA-N 378.428 5.464 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2c(F)cccc2F)n1 523828125 VXRXYRBDUKDZCA-UHFFFAOYSA-N 397.450 5.012 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2cccc(COc3ccc(C#N)cc3)c2)C1 524500318 FQIQQBTUYGCQDF-QHCPKHFHSA-N 396.490 5.075 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 524550508 UFGZVIHMNRQYNW-UHFFFAOYSA-N 387.439 5.175 30 20 GKED CSc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)ccn1 524706908 PRONZHJPBHSECA-SFHVURJKSA-N 393.899 5.365 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1cccc(F)c1 525650504 AFCNJKBWFGOBFA-GFCCVEGCSA-N 396.409 5.592 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)cc1C#N 525663045 ZMRPADYJXATJJJ-UHFFFAOYSA-N 386.461 5.020 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccn(-c2ccc(Cl)cc2)n1 536055829 SHRDIPWUCFILBB-AWEZNQCLSA-N 396.903 5.172 30 20 GKED COc1cc(C#N)ccc1CN[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 543516470 VSVIHSXTVCALQT-OAHLLOKOSA-N 377.513 5.158 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1cccc(F)c1Sc1ccccc1 546005689 VKAYZRLFEXFHLP-UHFFFAOYSA-N 378.428 5.109 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(CNC(=O)C(C)(C)C)ccc1Cl 551689416 KSINDBPLBYOSHT-UHFFFAOYSA-N 398.934 5.373 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@@H](CCCC#N)c1ccccc1 552311784 ACATXAOWQSQUAB-QFIPXVFZSA-N 378.907 5.359 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCSc2ccc(Br)cc21 552956736 NYEPXXUXUGDYMT-MOPGFXCFSA-N 399.357 5.525 30 20 GKED COCc1cccc2sc(NC(=O)c3sc4ccc(C#N)cc4c3C)nc12 568973898 ZJHGBBXOTVGQMX-UHFFFAOYSA-N 393.493 5.090 30 20 GKED C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@H](CCCC#N)c1ccccc1 577881471 AMZLOHKHQDVUFO-PGRDOPGGSA-N 397.950 5.102 30 20 GKED C=CCOc1ccccc1-c1nc(Cc2csc(-c3ccccc3)n2)no1 579403872 RDGFVKMPPMNEAQ-UHFFFAOYSA-N 375.453 5.016 30 20 GKED N#C[C@H](C(=O)c1csc(C2CCCCC2)n1)c1cc(C(F)(F)F)ccn1 579937060 BEGSBAMZIYNSKY-ZDUSSCGKSA-N 379.407 5.095 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc(Cl)c1Br 582196165 MMJZFQPHAZECSF-LLVKDONJSA-N 397.725 5.481 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccc(Br)s2)c1 589740152 LKRMTFSRZYMEHI-UHFFFAOYSA-N 395.322 5.129 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 592912470 LNTCBBCXLQBRSW-UHFFFAOYSA-N 393.340 5.206 30 20 GKED Cc1cc(C)c2cc(C(=O)N(Cc3ccc(C#N)cc3)CC(C)C)sc2n1 603530528 SUYCNTFHKOSOFK-UHFFFAOYSA-N 377.513 5.083 30 20 GKED CCCCS[C@@H](C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609060899 PIDBDQQLODLOBG-KRWDZBQOSA-N 382.529 5.306 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1[N+](=O)[O-] 609322054 VQCVFEOSEXXWBD-CYBMUJFWSA-N 397.431 5.131 30 20 GKED Cc1nc(C(C)(C)NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)sc1C 609991790 SAJBZIAZHAGLDD-UHFFFAOYSA-N 390.512 5.040 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2cccc(C#N)c2)C(C)C)cc1 610189119 MJEMDDOFBYYSOG-UHFFFAOYSA-N 384.479 5.285 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610352644 VGWXZTKQBITUKV-ZWKOTPCHSA-N 399.494 5.355 30 20 GKED C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610583965 ORLLOWGMPJNTTG-JTSKRJEESA-N 398.466 5.155 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NCc1nnc(-c2cccc(C#N)c2)o1 610754800 ZWWNACDFSSZAKJ-UHFFFAOYSA-N 382.423 5.321 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN[C@@H](C)c1cccc(C#N)c1 611388172 KJBSNQBRWCLQTF-INIZCTEOSA-N 397.950 5.406 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 611390945 WXEOCEFLZRBZRE-HWMZRRJGSA-N 390.371 5.435 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC[C@H]2CCC[C@H]21 646439169 NSOOETGEYDHYRI-ZWNOBZJWSA-N 398.322 5.382 30 20 GKED C[C@H]1C[C@@H](Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c2nccn21 647323530 WDXPQXPVKKGTOG-JOYOIKCWSA-N 381.295 5.290 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCCn3ccnc32)cc1)C(F)(F)F 655779643 PSMCDEYZQLRUMB-GFCCVEGCSA-N 381.295 5.120 30 20 GKED CC(=O)c1ccc(C#N)c(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 680372116 VADUROIMWUIUQH-STQMWFEESA-N 378.316 5.082 30 20 GKED Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 726501504 CAFPKPDPXGJGBR-QHCPKHFHSA-N 392.462 5.089 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)s3)SC2=S)cc1Cl 726626288 CTQMILWUSFMSEW-WUXMJOGZSA-N 397.333 5.332 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccc(OC)cc4)sc3C2=O)cc1 727780810 UCQWNLGKQAGDKQ-DTQAZKPQSA-N 377.465 5.040 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12)C(C)C 727938739 LMGXEWGOTHQSOF-UHFFFAOYSA-N 379.435 5.595 30 20 GKED N#C[C@H](C(=O)C(c1ccccc1)c1ccccc1)c1nc2cc(F)ccc2s1 730416087 AGCCWRRLMAJEOL-GOSISDBHSA-N 386.451 5.444 30 20 GKED Cc1cccc(OCCCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730418503 WFCZJLCQIRKMJG-KRWDZBQOSA-N 382.460 5.169 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(C2CCCCC2)CC1 731114132 GOWJIIBOSCCVSZ-KRWDZBQOSA-N 385.577 5.763 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1nc(-c2ccccc2)cs1 731287671 IAQPFSPNHSHJBZ-FDFHNCONSA-N 394.499 5.943 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccccc1S[C@@H](C)CC#N 731322436 ZTAMONFMJQJMNJ-LBPRGKRZSA-N 375.950 5.852 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCc4ccccc4C3)n2)cc1 732596588 YFYMJRRHELLLQT-LAUBAEHRSA-N 397.503 5.053 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)c1 733789910 YSJVWSLTHNXGRW-IBGZPJMESA-N 389.499 5.076 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1ccc(OCc2ccccc2)cc1 734096179 KRLGYJHRVUOOHT-NXVVXOECSA-N 394.474 5.407 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1nc2ccccc2s1 734210402 KKRHQKPUKNWIAO-KBPBESRZSA-N 396.541 5.573 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 740445583 ZSVAUUYCCGQQJL-UHFFFAOYSA-N 383.561 5.521 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741471578 BKUVKANHYOCDPW-VAWYXSNFSA-N 379.463 5.447 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccccc2Cl)cc1F 743037640 SOTKBUOOHBZEDG-UHFFFAOYSA-N 397.862 5.952 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 747105625 UFQOZZYNCBLBEV-NHYWBVRUSA-N 399.277 5.478 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(Cl)c(Cl)c1 747117435 QHUOBTXKSLZJHX-JOYOIKCWSA-N 393.270 5.722 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3ccccc3C(F)(F)F)o2)cc1 748095469 MNTXSHLNYGSKRO-ZDUSSCGKSA-N 375.350 5.176 30 20 GKED C[C@@H](OC(=O)CCC(=O)c1cc(Cl)sc1Cl)c1ccc(C#N)cc1 756300115 LZSQDORIUMFBBP-SNVBAGLBSA-N 382.268 5.194 30 20 GKED C#CCCCC(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 758133516 DENGSICCYKWAPH-UHFFFAOYSA-N 389.377 5.091 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(C(F)(F)F)s2)S1 761390763 FOPYOSROEQOVNP-XYOKQWHBSA-N 382.432 5.275 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCc2cccs2)cc1 769952243 DRLBFTOOURKSGG-OAQYLSRUSA-N 375.497 5.158 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccccc1-c1ccc(Cl)cc1 775454042 JGYKTKPULWBTGK-QGZVFWFLSA-N 376.887 5.760 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3SCc3ccccc3)cc2)CC1 776749332 AATYIJZVBZWLIQ-UHFFFAOYSA-N 384.504 5.786 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797571032 LIAYCRDVTXPFNE-CABCVRRESA-N 394.462 5.829 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 813091381 ZKRPCZMHYJXIPZ-UGKGYDQZSA-N 378.859 5.168 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cc(C3CC3)cnc1Cl)c2C#N 839387685 GRQBNNOSPPWTEH-MNOVXSKESA-N 385.920 5.484 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CCc2ccccc21 915351641 AMNNOUBUPXTULQ-DNQXCXABSA-N 381.479 5.493 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1cccc(Cl)c1 916268246 SNPVAPJBGAWLRX-UHFFFAOYSA-N 377.250 5.132 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2ccc3ccccc3c2)cc1 916546039 CDYPYLHPDHIIFP-UHFFFAOYSA-N 378.888 5.259 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccccc2SCC#N)CC1 918666979 URVYLSWCZHASDU-UHFFFAOYSA-N 389.524 5.112 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CSc1ccc2ccccc2c1 920106623 UXTKKFMDWBXHKR-FQEVSTJZSA-N 398.487 5.313 30 20 GKED C[C@@H]1CCCC[C@H]1CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 920791065 SYKYIZRJWLODIN-MBNYWOFBSA-N 380.435 5.708 30 20 GKED Cc1ccc(Oc2cc(Cl)ccc2C=NNc2ccc(C(=O)O)cc2)c(C)c1 1776012063 ALRTZPUVGSPGOR-UHFFFAOYSA-N 394.858 5.893 30 20 GKED O=C(/C=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1cc(F)ccc1F 1776113736 SONCFFDQEGVNAJ-FQTAANOTSA-N 394.373 5.066 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 1776473544 PIMPVYZRCXZYKM-AYLMVEPYSA-N 398.764 5.107 30 20 GKED CCCCCCCCc1ccc(C(=O)NCCc2ccccc2C(=O)O)cc1 1776785815 CZEWXELAFNPNSB-UHFFFAOYSA-N 381.516 5.260 30 20 GKED Cc1nc2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc2o1 26390393 LWLCCJQRUVTAAS-UHFFFAOYSA-N 385.448 5.411 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 54839331 NARZTLPUJJMECV-HOCLYGCPSA-N 390.512 5.112 30 20 GKED N#C[C@H](C(=O)CSc1cccc(Cl)c1)c1nc(-c2ccccc2)cs1 72076857 PFDLGEIALHOYPY-MRXNPFEDSA-N 384.913 5.432 30 20 GKED CC(=O)c1csc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 106619668 XSRYHUUBQANSAD-GOSISDBHSA-N 394.883 5.512 30 20 GKED N#C[C@@H](C(=O)CCSc1ccccn1)c1nc(-c2ccc(Cl)cc2)cs1 120112951 YCZFFXWVDMJSPX-HNNXBMFYSA-N 399.928 5.217 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)n1 120997173 MYTWMVZVRZMEEF-UHFFFAOYSA-N 388.924 5.098 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)n1 125031057 CTNQSMXJXDYCAT-KXBFYZLASA-N 380.517 5.011 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Br)c(Cl)c2)n1 126041860 VHYMSCGXYRUFCH-SNVBAGLBSA-N 383.698 5.172 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)c1 175535862 FWBAEYRMUKFPJU-UHFFFAOYSA-N 384.464 5.098 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H](C)c1ccc(OCC#N)cc1 180538102 LDNMNPYNSYMLFR-HOTGVXAUSA-N 377.513 5.433 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccn3C3CCCC3)n2)cc1 181489001 AFOMFLJXUDINPE-GOSISDBHSA-N 391.496 5.225 30 20 GKED C=CC[C@H](C(=O)N[C@@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 186746290 WPVGCMYJPIQMCH-AVRDEDQJSA-N 393.531 5.097 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2csc(Cl)c2)cc1 187844990 SROIYDILUOESRG-UHFFFAOYSA-N 382.872 5.299 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccc2c(c1)OCCO2 189871785 NZFMFKSLNPQDBA-UXHICEINSA-N 377.484 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1cccc(N(C)C)c1 191515802 IERNNNUJHBNGMB-HSZRJFAPSA-N 391.559 5.974 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCS1 192225258 CUMVAQSDISIZEK-BEFAXECRSA-N 399.947 5.355 30 20 GKED N#C[C@H](C(=O)c1coc(C2CCC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 192521822 KIVOEFDXUVWNMJ-CQSZACIVSA-N 383.860 5.209 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)o2)cc(OC)c1OC 212893485 ABZGGCNIBYIRKA-NTMALXAHSA-N 382.387 5.008 30 20 GKED C=CCOc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1Cl 237660352 QCLFITLEZGJWEC-UHFFFAOYSA-N 392.326 5.354 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1cccc(C#N)c1 248054786 UEGAIUHKTCCZOH-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C[C@@H](ON=Cc1ccccc1F)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 255337792 COTHTGAPBVFTLL-SNVBAGLBSA-N 380.206 5.294 30 20 GKED N#Cc1c(Cl)nsc1N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21 302207688 XKKWZIAZDSRSJP-LBPRGKRZSA-N 390.896 5.420 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 303627608 OCLUAOLVSVFFKC-UHFFFAOYSA-N 390.870 5.063 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 303719654 VXEBSWXZFDAACM-XLIONFOSSA-N 381.501 5.146 30 20 GKED C[C@H](/N=C(/O)C1CCCC1)C(O)=Nc1cc(Cl)ccc1N1CCSCC1 328802671 MLKZJLRFJIYDCF-ZDUSSCGKSA-N 395.956 5.016 30 20 GKED CC1(C)CC[C@H](/N=C(/O)C2CCN(c3noc4ccc(Cl)cc34)CC2)C1 329053114 XAMYTYIPEGJMIG-HNNXBMFYSA-N 375.900 5.233 30 20 GKED Cc1sc(N=C(O)CN2CCCC[C@H]2c2nnc(C3CCC3)o2)c(C)c1C 329344030 CJPGICJBAHEVFP-INIZCTEOSA-N 388.537 5.139 30 20 GKED O/C(=N/CCOC1CCCCCC1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329449250 MOKATRUNOBAVPG-IBGZPJMESA-N 387.568 5.189 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1cccc(OC2CCCC2)c1 330308814 MLLKKXVPOIXMPR-HNNXBMFYSA-N 386.517 5.303 30 20 GKED Cc1ccc(-c2cccnc2)cc1N/C(O)=N/C1CCN(C2CCCCC2)CC1 330319695 DJXJBQZWQNOJKP-UHFFFAOYSA-N 392.547 5.180 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)CCc1ccc2[nH]ccc2c1 425080310 AZQBZWWPPNBNJC-HNNXBMFYSA-N 399.416 5.060 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cc(Cl)ccc1F 434160295 QPIWBGYKSLWVPX-CYBMUJFWSA-N 391.899 5.395 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)Nc2ccc(C#N)cc2)cc1 437675642 PTAIXSDWIGICMF-KRWDZBQOSA-N 385.467 5.459 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1cccc(OCCCC#N)c1 437812149 ULMZWWVEIFMGRN-UHFFFAOYSA-N 397.544 5.963 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)N[C@H](CCC#N)c4ccccc4)CC3)c[nH]c2c1 438841584 ZPWOTCTYHTXESB-HSZRJFAPSA-N 398.510 5.320 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(CCC(F)(F)F)c2)c1 440706097 RTEQFRLQOOGDMJ-UHFFFAOYSA-N 390.405 5.241 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)N[C@H](CCC#N)c1ccccc1 444123941 CWQRXQDKCSSKGF-MOPGFXCFSA-N 389.421 5.333 30 20 GKED CC(C)c1cc(C(=O)Nc2cc(C#N)ccc2OC(F)F)c2ccccc2n1 448208581 JCBAHANXRGRAGX-UHFFFAOYSA-N 381.382 5.084 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 454997152 JVWMKMPFTAIASO-WMZOPIPTSA-N 395.528 5.191 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(CC#N)cc2Cl)cc1 455742603 CAYIDASKUHKPKQ-FQEVSTJZSA-N 383.879 5.174 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457713909 RYCJGHNUJYGWBW-OIBJUYFYSA-N 381.238 5.014 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 464951202 RLXWCOVLIAPFAY-WOJBJXKFSA-N 387.508 5.031 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccccc2CCC(F)(F)F)c1 465264579 WSEJUMJQGLRZKP-UHFFFAOYSA-N 399.319 5.299 30 20 GKED C=CC[C@@H](C)NC(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466250376 OWTVYTRSVSJVFS-YJYMSZOUSA-N 376.472 5.040 30 20 GKED O=C(c1ccc(-c2ccc(F)cc2)s1)N(CCC(F)(F)F)CC(F)(F)F 468530242 JAQTYBFUIKYKRC-UHFFFAOYSA-N 399.331 5.511 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cc(-c4ccccc4)ns3)cc2)nc1 475483985 FQFJYAVDQDOZJS-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cnn1-c1ccccc1Cl 478905113 XUZXBLBTZFUTAD-UHFFFAOYSA-N 392.890 5.142 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cccc(NC(=O)C2CCCC2)c1 481926268 XKZWHLPDGWRTIS-DEOSSOPVSA-N 387.527 5.244 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)cc1F 483197819 MANFJSGNFGCPSR-LJQANCHMSA-N 399.400 5.374 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(OC2CCC2)cc1Cl)c1ccccc1 487362616 WEFCWBIBJBVIGK-OAQYLSRUSA-N 382.891 5.436 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccccc2-c2nc3ccccc3s2)c1 500221925 REBVZERABYUYBP-UHFFFAOYSA-N 384.464 5.157 30 20 GKED CCN(C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)[C@@H](C)c1ccc(C#N)cc1 502725085 HYEXSAVVPYZFEW-ZDUSSCGKSA-N 397.450 5.183 30 20 GKED Cc1ccsc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 504813164 SPTZBMOYVSMTFZ-GOSISDBHSA-N 395.915 5.687 30 20 GKED C=CCNC(=O)[C@@H](C)S[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 506235895 UUHQDOAIHRPFNO-VHSXEESVSA-N 385.373 5.209 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 507570966 UWZMHTNLORPAPN-OAHLLOKOSA-N 396.388 5.069 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cccc(CN(C)Cc3ccccc3)c2)s1 508752560 CXGURWZKQXEMJO-UHFFFAOYSA-N 389.524 5.066 30 20 GKED CN(Cc1cccc(C#N)c1)Cc1cn(-c2ccccc2)nc1-c1cccs1 508933041 IYUVBYKAOIIFGU-UHFFFAOYSA-N 384.508 5.104 30 20 GKED CCN(C[C@H](C)C#N)C(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 509969992 PRNACFWUUCPDAP-QGZVFWFLSA-N 383.561 5.188 30 20 GKED C=CCOc1cccc(NC(=O)N2CCCCC[C@@H]2c2ccc(OC)cc2)c1 510986631 XDAHHJQLNQQMTJ-JOCHJYFZSA-N 380.488 5.409 30 20 GKED FC(F)(F)c1nnc(N2CCC(F)(c3ccccc3C(F)(F)F)CC2)s1 513077429 QXKQFSBNGFILPF-UHFFFAOYSA-N 399.335 5.041 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccccc1 515932436 MWTULTXPHXERKO-FXAWDEMLSA-N 379.529 5.697 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@H]1c1ccccc1 515932438 MWTULTXPHXERKO-PXNSSMCTSA-N 379.529 5.697 30 20 GKED CCN(C(=O)Nc1ncc(-c2ccccc2)s1)[C@H](C)c1ccc(C#N)cc1 518958036 JYBFLRYHGQLAPN-OAHLLOKOSA-N 376.485 5.297 30 20 GKED N#C[C@H](NC(=O)c1cc(C2CC2)nc2ccccc12)c1cccc(Cl)c1Cl 520888544 PATPMMFZUQDEAG-IBGZPJMESA-N 396.277 5.414 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1 520939021 JOLFQACIIARENQ-YZGWKJHDSA-N 393.556 5.929 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cc2ccccc2s1 526957527 JGNNYNRJZURNHV-CABCVRRESA-N 395.553 6.036 30 20 GKED COCc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541997309 ZARWEGXIDCPJLH-KRWDZBQOSA-N 385.467 5.254 30 20 GKED CCS[C@H](C)c1noc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542017050 IKQRIRPAGGXMOC-HZPDHXFCSA-N 392.528 5.273 30 20 GKED COc1cccc([C@@H](NCc2cccc(C#N)c2F)c2ccccc2Cl)c1 542222096 BOUJVRRZKRVOAQ-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)CCCC1(C)C 558840362 IWDHLWFNNYLHGU-LJQANCHMSA-N 396.535 5.382 30 20 GKED N#CCCC[C@H](NCc1ccc(Cl)c(Br)c1)c1ccccc1 560563540 ADFBOKNIWDRYCN-SFHVURJKSA-N 377.713 5.627 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)sc12 564124025 CEHQEKCLDCTWJJ-HNNXBMFYSA-N 375.478 5.218 30 20 GKED CC[C@@](C)(C#N)c1nc(-c2ccc(-c3csc(-c4ccncc4)n3)cc2)no1 571206728 WEPSNTWRSVZKQK-NRFANRHFSA-N 387.468 5.113 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)oc2ccc(F)cc12 572449350 NCWLGIXHCNALEG-UHFFFAOYSA-N 387.370 5.192 30 20 GKED CCO[C@H](c1noc([C@H](C)C(F)(F)F)n1)c1ccc(F)cc1C(F)(F)F 573733750 KERXOFAABUPSCC-CPCISQLKSA-N 386.267 5.019 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)NCC3(C#N)CC3)c2)cc1 581287480 QTVNURVKLGGILR-SFHVURJKSA-N 391.515 5.147 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589541992 JJWCOGUZXNPCNE-UHFFFAOYSA-N 387.464 5.276 30 20 GKED N#Cc1cc(C(=O)N2CCC[C@H]2c2cccc3ccccc23)cnc1C(F)(F)F 590177159 SAXBJOQELIPSET-IBGZPJMESA-N 395.384 5.103 30 20 GKED Cc1nc(C(C)C)oc1CNC(=O)c1ccccc1Sc1ccccc1C#N 590562723 ZGSDMLZKXSGTNQ-UHFFFAOYSA-N 391.496 5.059 30 20 GKED CCc1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[nH]c(C)c1C(C)=O 591206242 AZCBCTKJOBASAY-UHFFFAOYSA-N 387.439 5.004 30 20 GKED C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CCC(CCC#N)CC1 592135542 ZNRFUCJRVICUQU-GFCCVEGCSA-N 379.291 5.120 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3sc4ccccc4c3s2)c1 603972449 OYPYODNBHNFORY-UHFFFAOYSA-N 392.505 6.051 30 20 GKED C=CC[C@H](C)NC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 604907415 KHAIJLWTZYEBIE-NSHDSACASA-N 383.345 5.118 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC1CCC1)c1nc2cc(Cl)ccc2s1 605362875 XIZCSOHFZDZRDV-HNNXBMFYSA-N 382.872 5.371 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)C[C@@H]2CCc3ccccc32)cc1 609651596 ILMHYGNGVCLDND-QHCPKHFHSA-N 398.481 5.346 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@H]1C 610019095 BJQNCBISMJFUTO-HUUCEWRRSA-N 383.492 5.371 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 612300496 JIIAKVZFXYCSOJ-DENIHFKCSA-N 392.890 5.153 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(C(=O)N3CCCCC3)c(Cl)c2)cc1 614056305 MCVHHXJQBPBJHD-UHFFFAOYSA-N 395.934 5.379 30 20 GKED Cc1c([C@@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cnn1-c1cccc(Cl)c1 618803279 HRZNRWFIRPSTFS-JLCFBVMHSA-N 376.891 5.044 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1C[C@H]1c1ccc(F)cc1 619126575 ZEHHFAKUVKPCTO-UONOGXRCSA-N 385.323 5.099 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(C[S@](=O)c3ccccc3)c2)cc1 619669074 DPFWOJQZBYPMFM-NDEPHWFRSA-N 388.536 5.408 30 20 GKED COc1cc(Cl)c(Cl)cc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 674299639 RUBQFQLKBXNMRE-JTQLQIEISA-N 395.242 5.241 30 20 GKED C=C[C@H](CC(=O)N(C)CCCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 677533547 RUWZGAGJHVNDFI-GOSISDBHSA-N 392.474 5.232 30 20 GKED C#CCN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)[C@H]1CCc2ccccc21 726596173 CEUSCCYDOMLSMJ-SFHVURJKSA-N 398.293 5.166 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2sccc2Br)c1 726744255 YQKQHWDWDJPJQG-SREVYHEPSA-N 376.275 5.089 30 20 GKED C=CCn1c(-c2ccc(C(C)(C)C)cc2)nn(CN(CC)C[C@H](C)C#N)c1=S 726964011 QYWZYCKYJKQTRS-QGZVFWFLSA-N 397.592 5.004 30 20 GKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(N2CCOC2=O)cc1 727266832 HKSBKNKCSBESTO-KRXBUXKQSA-N 395.764 5.212 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 727589077 HURFPOMSHHUUAS-DVECYGJZSA-N 383.495 5.609 30 20 GKED Cn1c2ccccc2c2cc(C(=O)Nc3cc(C#N)ccc3OC(F)F)sc21 728014104 LYQXXFOXQORIJW-UHFFFAOYSA-N 397.406 5.118 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1C 728062004 GFFPDVWFWXPQMM-LJQANCHMSA-N 399.494 5.193 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ccc(O[C@H](C)C#N)cc1 728698110 LRJNPGFPJJIMFT-IMBBRHANSA-N 392.455 5.445 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)Cc1ccc(OCC#N)cc1)C1CC1 731978858 AWKJMZMLHXHKBW-SFHVURJKSA-N 384.479 5.037 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)CSc3ccccc3)n2)cc1 732496483 WPYPRYCWHRGGNO-QFBILLFUSA-N 392.549 5.723 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 732499436 QFROHFMQOYBFEC-LDCOFTPGSA-N 398.409 5.507 30 20 GKED C#CCOc1ccc(CN[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 733328415 QQZWDGAWMJVVAW-OAHLLOKOSA-N 380.488 5.120 30 20 GKED C=CC[C@H](NC(=O)N[C@H](CCC)c1cccc(C(F)(F)F)c1)c1ccncc1 734667301 XKBRUOIAKDMAGO-RBUKOAKNSA-N 391.437 5.558 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1cccc(-c2ccncc2)c1 741463842 KDLHEKUSZBWETA-UHFFFAOYSA-N 380.373 5.475 30 20 GKED Cc1cc(/C=C\C(=O)N(CCC#N)Cc2ccco2)c(C)n1C1CCCCC1 749378658 FNHQKZFZBLQEBY-QXMHVHEDSA-N 379.504 5.159 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(COC(C)(C)C)cc2)c1 752717477 VTEUDKBGGIMIKU-FQEVSTJZSA-N 395.503 5.004 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCC[C@H]3c3ccccc3)cn2)cc1 762812082 ORGRAPCHPBGAHU-QFIPXVFZSA-N 398.466 5.505 30 20 GKED CC(=O)N(c1nc(/C=C2\CCc3c(sc4ccccc34)C2=O)cs1)C1CC1 763102618 YVAIYRVLJOMLLO-JLHYYAGUSA-N 394.521 5.086 30 20 GKED CCOc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1[N+](=O)[O-] 765616210 MIVDIFLUAZQMTQ-PLNGDYQASA-N 386.454 5.075 30 20 GKED C=C(C)C[C@H](C)C(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 767697867 WRJYGFYWRRRXNO-JKSUJKDBSA-N 381.497 5.350 30 20 GKED COc1ccccc1CN(Cc1ccc(O[C@@H](C)C#N)cc1)Cc1cccs1 768178248 BQHCWPRLKIGNIL-SFHVURJKSA-N 392.524 5.250 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(SC)c(F)c2)cc(OC)c1OC 772946266 LWLIYLQIRFQWDG-AWEZNQCLSA-N 375.509 5.144 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(N4CCCCC4)c(Cl)c3)cc2)CC1 776836123 HGLCQMZOJBLVGV-UHFFFAOYSA-N 379.891 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCc1ccccc1)CCN(C)C 789457785 KPMAGKGPQJGRFL-UHFFFAOYSA-N 393.575 5.177 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(CC[C@@H](O)c3ccccc3)c2)cc1 793626847 AOECWJKKZLMSQN-XMMPIXPASA-N 398.506 5.406 30 20 GKED CC(C)C[C@@H](NCc1ccc(OCC#N)cc1)c1cccc(Br)c1 794811861 TWBGFIGKZOIZFU-HXUWFJFHSA-N 387.321 5.228 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCCC)Cc1ccccc1O 801754302 CYPBRQYOTBPVKD-UHFFFAOYSA-N 380.532 6.078 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1 810990733 SAKUUPCAYIBJBY-UHFFFAOYSA-N 392.842 5.216 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2CCSc3ccccc32)cc1 842289592 RKUCZMVFLXYYRG-RYGJVYDSSA-N 392.524 5.127 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)c(F)c1)c1ccc(-c2cccs2)cc1 844256405 UDRJSLPQOCNWDP-WMZJFQQLSA-N 375.428 5.031 30 20 GKED N#C[C@H](C(=O)COc1ccc(-c2ccccc2)cc1)c1nc2ccccc2s1 916627185 DBZJEKOPALIJJW-LJQANCHMSA-N 384.460 5.219 30 20 GKED CC(C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917043643 LQHUOFUYLJLVHB-OAHLLOKOSA-N 384.888 5.328 30 20 GKED CC(=NOCC(=O)Nc1ccccc1C)c1ccc(-c2ccc(F)cc2)s1 917402937 LONBLYYXRMOMDL-UHFFFAOYSA-N 382.460 5.242 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)c3ccc(Cl)cc3)n2)cc1 917428201 PRIHWMGSDOKERF-SFHVURJKSA-N 394.927 5.926 30 20 GKED Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919904644 QTMFNXJADCDSIM-BJKOFHAPSA-N 381.479 5.460 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776388571 HKWUWZUTUOEROD-SXGWCWSVSA-N 386.447 5.735 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(C)C)CC1 1831381400 YPQZTBVMPCPGTA-OAQYLSRUSA-N 390.612 5.035 30 20 GKED C=CCn1c(SCCCC#N)nc2sc(C)c(-c3ccc(F)cc3)c2c1=O 21744501 BHJSTSSCLNAKNB-UHFFFAOYSA-N 399.516 5.154 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)oc2c(Cl)cccc12 41559629 NXFVGPHFABCAHP-GFCCVEGCSA-N 399.784 5.630 30 20 GKED C[C@H](c1cccnc1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 128749851 AIVPABIGVQVTNB-OAHLLOKOSA-N 391.858 5.232 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)c1cccc(C#N)c1 152389474 ZWJIQSJMNGWHAC-UHFFFAOYSA-N 398.249 5.329 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc(Cl)ccc2Cl)ccc1OC 154691383 FBEPZOQVEZKYNY-CZUORRHYSA-N 393.314 5.534 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC[C@@H]2c2ccncc2)cc1 155356530 WENPITHGASCLJQ-JOCHJYFZSA-N 383.451 5.031 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)OC3CCCCCC3)n2)cc1 163111211 IJXSVSXZAAORQA-BEFAXECRSA-N 398.528 5.123 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(Cl)s1 175109541 IDVJEYOPXUYEAE-DOMZBBRYSA-N 382.872 5.006 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2[nH]ccc12 176210811 KCDQGQDZUQSUDB-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(SC(C)C)cc2)ccc1OC 180811166 STFQPXVNLWBAKX-PXNSSMCTSA-N 398.572 5.727 30 20 GKED C[C@@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccc(C#N)c1 184605142 RAZWJPOREFKIPL-AUUYWEPGSA-N 377.488 5.549 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(OCC(F)(F)F)c1 189871738 XCHFFADVRZXTMG-UHFFFAOYSA-N 378.394 5.127 30 20 GKED CC(C)(C)[C@@H]1CC(/C=N/c2ccccc2)=C(Cl)/C(=C/Nc2ccccc2)C1 204606640 SGNGRHNZHKGIJF-QAGJUCOBSA-N 378.947 7.334 30 20 GKED N#Cc1cc(Br)ccc1N[C@@H](c1cccc(F)c1)c1ccccn1 302062711 CZBUYKIMIJNDIQ-IBGZPJMESA-N 382.236 5.056 30 20 GKED Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C 303310695 FNWIMUAYCITQDZ-HNNXBMFYSA-N 388.558 5.115 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 303581246 OYSCRKTYUWFBIX-INIZCTEOSA-N 376.481 5.032 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(OCC(F)(F)F)c(Cl)c3)cc2)CC1 410396370 GTZOQTPICKNTHR-UHFFFAOYSA-N 394.780 5.089 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cnc(-c4ccccn4)s3)c2C#N)[C@H](C)C1 410977954 LBQUUKZQOPDHGV-VXGBXAGGSA-N 394.525 5.076 30 20 GKED N#CC1(CC[S@](=O)Cc2csc(-c3ccccc3F)n2)CCCCC1 417142419 RLMNVCIYFBFAAB-VWLOTQADSA-N 376.522 5.062 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425670848 GPKOKKGDEQVOIA-LJQANCHMSA-N 390.531 5.472 30 20 GKED Cc1c(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cccc1-c1ncco1 432963232 ZKJAQQQXQAZPDX-UHFFFAOYSA-N 386.333 5.185 30 20 GKED Cc1ccc(C(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1Oc1ccncc1 436325549 BNJSJUPSKBBHRE-XZOQPEGZSA-N 397.478 5.094 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccc(F)cc12 436349950 FESMQTHOLDPWST-XUZZJYLKSA-N 399.469 5.163 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(F)cc1C(F)(F)F 437989126 CIAGCUBGMZNWBN-MAUKXSAKSA-N 391.368 5.148 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(OCC2CC2)c(F)c1 438842332 OVVBWAKHWDYMQN-HRAATJIYSA-N 395.478 5.020 30 20 GKED CCCN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@H](C)c1ccccc1OC 438848093 ALIOGJIRRNMTRO-NQIIRXRSSA-N 379.504 5.223 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1cccc(CCC(F)(F)F)c1 441140906 KUYVKAGABUCLKN-UHFFFAOYSA-N 378.394 5.068 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N(Cc1ccco1)c1ccccc1C#N 443835503 KJVTVJZJHCTGBL-UHFFFAOYSA-N 391.496 5.421 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@H]1C[C@H](C)O)c1ccc(C(F)(F)F)cc1 448153986 GVUOXLZBRAHQHH-SNRMKQJTSA-N 398.469 5.048 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4cc(C(F)(F)F)ccn4)cc3c2C1 464458019 DIIYOTAKVNWODH-SJKOYZFVSA-N 397.400 5.197 30 20 GKED C=CCC(CC=C)C(=O)N(Cc1ccc(OC)cc1)c1ccc2nc(C)[nH]c2c1 468728078 XLTPPMSLWSKQKX-UHFFFAOYSA-N 389.499 5.182 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1C[C@H]1c1cccc(F)c1 469114789 HWHVHCUMWLGPGO-VQTJNVASSA-N 388.467 5.134 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 469417281 BATDNCQCPYDGAY-KRWDZBQOSA-N 393.918 5.302 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3sc4c(c3C#N)CCCCC4)c2c1 470834796 WUBCVFDELRPVOW-UHFFFAOYSA-N 377.513 5.250 30 20 GKED C[C@@H](C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(F)(F)F 474259964 QEMCYUAHWAXBLB-OIBJUYFYSA-N 381.238 5.014 30 20 GKED N#CC[C@H](CC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1ccccc1 474584198 JAKNVPUWAOKEOD-RCZVLFRGSA-N 380.491 5.248 30 20 GKED C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)C[C@@H](CC#N)c1ccccc1 476479190 DYOZOOQKHRSCET-GDBMZVCRSA-N 375.299 5.128 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OCC(F)F)cc1 480360048 SMPVQEWOZJNKOG-UHFFFAOYSA-N 378.378 5.121 30 20 GKED C=CCn1c(S[C@@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1ccccc1C 481374024 NSUPNBJBRSJJOC-HNNXBMFYSA-N 380.473 5.201 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 486241306 KDBUUHMGGQHAON-UHFFFAOYSA-N 392.480 5.371 30 20 GKED Cc1ccc(-c2nc(CC(=O)N[C@H](CCCC#N)c3ccccc3)cs2)cc1 487277243 ZOABAUYIXZAZSN-OAQYLSRUSA-N 389.524 5.212 30 20 GKED Cc1c(C(=O)Nc2cccc(C(F)F)c2Cl)sc2ccc(C#N)cc12 499426527 YGLWCOMAZDZZGO-UHFFFAOYSA-N 376.815 5.925 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1cccc(F)c1F 500234303 VLTMBQNNQWSIGA-MRXNPFEDSA-N 378.422 5.266 30 20 GKED C[C@H]1C[C@@H](NC2CCC(C#N)(c3ccccc3)CC2)CCN1Cc1ccccc1 507651510 UCBRWMJEZMWOSB-UPXZRFMXSA-N 387.571 5.033 30 20 GKED CCN(C(=O)CCOc1cccc(Cl)c1Cl)[C@H](C)c1ccc(C#N)cc1 509576988 ZJYUZGDJCHAEEM-CQSZACIVSA-N 391.298 5.244 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(-c2ccccc2)no1 510172237 INCOFFKYEYZJSY-OAHLLOKOSA-N 384.464 5.524 30 20 GKED CCC[C@H](C)[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 519129622 GBKCGSMBLHNQLJ-HRAATJIYSA-N 378.476 5.178 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)C(C)(C)c1ccccc1 520197923 UEWFSIPEVUYLRM-IAGOWNOFSA-N 381.545 5.569 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 521356742 OMZYNAGEARZAFO-UHFFFAOYSA-N 390.464 5.322 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 521469974 VWBFOPXYUOIHGW-LJQANCHMSA-N 399.947 5.370 30 20 GKED C=CCOc1cccc(NC(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)c1 522615992 RKXXJZZCXBIGCI-IBGZPJMESA-N 388.920 5.227 30 20 GKED CC(C)(C)c1csc(-c2cccc(Oc3c(C#N)nnc4ccccc34)c2)n1 524839962 ICRXBKPYRFDMOP-UHFFFAOYSA-N 386.480 5.715 30 20 GKED CCN(C(=O)c1sc(-c2ccc(F)cc2)nc1C)c1ccc(C#N)c(Cl)c1 535875518 KNXJPQJYDNSJIV-UHFFFAOYSA-N 399.878 5.449 30 20 GKED CCN(CCC1CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1)CC(C)C 539182565 AZZHHCFNKOVHCF-UHFFFAOYSA-N 398.595 5.100 30 20 GKED CCOc1cc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)ccc1OC 541090408 PHFOJRWXUHHWLX-GOSISDBHSA-N 386.495 5.483 30 20 GKED N#CCC1CCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)CC1 541973094 KICKFRFRXNOUIZ-UHFFFAOYSA-N 379.529 5.278 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 542674599 HTPYJZCOIWPLMU-UNMCSNQZSA-N 398.478 5.165 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944539 PBPRAKOKVYFASF-IBGZPJMESA-N 398.510 5.301 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cnc4ccccc4c3)no2)c2ccccc21 545705630 OQCBEXAHENCNHS-KHPPLWFESA-N 391.434 5.324 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1ccc(Cl)c2cccnc12 554876632 MFSGEFNMHXGAGD-UHFFFAOYSA-N 394.261 5.085 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc2ccccc2n1C(F)F 558866865 SGKUYUNRLBMERZ-CYBMUJFWSA-N 396.784 5.123 30 20 GKED N#CC1(c2ccc(C(=O)N(CC3CC3)c3cccc(C(F)(F)F)c3)cc2)CC1 574127166 FWVWSEGNMJJMHJ-UHFFFAOYSA-N 384.401 5.317 30 20 GKED N#CC[C@H](CC(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 577875495 GPCSEILLMOYFSZ-QGZVFWFLSA-N 395.915 5.167 30 20 GKED N#CCCC1CCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)CC1 578503702 HLAGWMOIYJDEKX-UHFFFAOYSA-N 397.906 5.467 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)[C@H](N)CCCCC#N)cc2)c1 594431207 JREDLOQSBHNURO-JOCHJYFZSA-N 393.531 5.047 30 20 GKED Cc1cc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc(C#N)c1[N+](=O)[O-] 596073047 DAVACICPJKBOFH-QWRGUYRKSA-N 395.303 5.096 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC[C@H](CC#N)C3)c(C)c2)n1 596715021 CQRSJNQTUYWEON-OAHLLOKOSA-N 386.546 5.069 30 20 GKED C[C@H]1c2ccccc2OCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 596736087 SDMDZJWYFCVVCE-CVEARBPZSA-N 381.501 5.068 30 20 GKED C=CC1CCN(C(=O)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)CC1 599710239 DDHFLUUBCZSNLS-UHFFFAOYSA-N 380.435 5.176 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1oc2ccccc2c1CSC 603519444 AOMINQTVXZIKBM-UHFFFAOYSA-N 378.497 5.220 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)[C@@H](C)Oc1ccccc1C#N 603559426 OBGWUPBMORDCFM-ZWKOTPCHSA-N 390.508 5.177 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)Sc2c(F)cc(F)cc2F)c1 603939170 YOGIVDOMHAHZLK-CQSZACIVSA-N 392.446 5.148 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(COc2ccccc2C#N)o1 603950785 DGMSMJAXLWWDIE-SFHVURJKSA-N 388.467 5.171 30 20 GKED CCc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)sc1C 609061939 LHUMXLBPJCKDBB-UHFFFAOYSA-N 390.508 5.630 30 20 GKED Cc1ccc(OCc2nc(CSCc3cc(C#N)ccc3F)cs2)cc1 609236831 CSEOEUPXJMGOSL-UHFFFAOYSA-N 384.501 5.475 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc2ccccc2c1 609369368 BHNDRHZAOHVPCZ-INIZCTEOSA-N 392.549 5.965 30 20 GKED Cc1ccc(CN(C(=O)c2cc3ccccc3n2CC#N)c2ccc(F)cc2)o1 609410387 HESCGCHNDVXUIG-UHFFFAOYSA-N 387.414 5.052 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 609636266 KOZDJWYBELQRMH-ICSRJNTNSA-N 393.556 5.628 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610356215 MBNJAXYRCZRORC-BFUOFWGJSA-N 388.298 5.473 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(NC(=O)c2cccc(F)c2)c1 611391125 UIQDTQMGHOGMPN-XMMPIXPASA-N 399.469 5.117 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1cccc(C#N)c1 618471938 RMOIDPIHOBELLM-HWPZZCPQSA-N 399.775 5.015 30 20 GKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc2cc(Br)ccc2o1 618803207 HMLXJGOTTOMDME-SGTLLEGYSA-N 381.273 5.405 30 20 GKED C=CCn1c(S[C@@H](C)c2ccncc2)nnc1-c1ccc(C(C)(C)C)cc1 619950467 JGELKBJEZZTILL-INIZCTEOSA-N 378.545 5.677 30 20 GKED COc1cc(F)ccc1NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 665493189 RRPKLBSWCZQXAW-UHFFFAOYSA-N 390.299 5.009 30 20 GKED CN(Cc1ccc(N2CCCCC2)cc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726448520 GGRYTWZZKRUVMT-UHFFFAOYSA-N 398.963 5.031 30 20 GKED CC(=NNc1ccc(Br)cc1F)c1nc2ccccc2n1C(F)F 728433179 WFJSJCQRMBCRIL-UHFFFAOYSA-N 397.198 5.169 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(C(F)(F)F)nc2O)c(C)n1C1CCCCC1 731564683 OXEOZDZHNBSJNL-NTMALXAHSA-N 392.421 5.626 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(-c2ccc(Cl)cc2)o1 735230798 JBNWZPZLSFFHFO-UHFFFAOYSA-N 392.267 5.238 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)Cc1cc(Cl)ccc1OCC#N 735309796 LPENJHKWBSZORD-CYBMUJFWSA-N 382.813 5.454 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2cnc(-c3ccncc3)s2)cc1 741745275 NJSGZPJMIUSVMK-UHFFFAOYSA-N 397.459 5.101 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cc3ccccc3[nH]2)cc1 746763459 OZUMJESFYFLFCU-JOCHJYFZSA-N 380.451 5.145 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(F)cc1F 752482362 UNXYWHYVBVYQDD-HZMBPMFUSA-N 390.842 5.598 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)CCc2[nH]c3ccc(F)cc3c21 753142384 OIPMRUDNKJPSEE-XFXZXTDPSA-N 375.428 5.038 30 20 GKED COc1cc(F)c(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)cc1OC 760269283 FRCLUNRAAIQYIE-HJWRWDBZSA-N 383.444 5.171 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 765910147 KBEONDBHZHJQRG-KDOFPFPSSA-N 393.284 5.052 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C2/CCc3nc(O)ccc3C2=O)cc1 769613783 DJAWVMVFZQIDKU-SILNSSARSA-N 384.479 5.026 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C=C3CCSCC3)cc2Cl)cc1 772158807 XMLJSOPUCXXFIF-UHFFFAOYSA-N 384.888 5.396 30 20 GKED C=CCC[C@H](NC(=O)Nc1cnn(C(F)F)c1)c1ccc(C(F)(F)F)cc1 772468193 RYRIKUDWJRTFJN-AWEZNQCLSA-N 388.340 5.126 30 20 GKED Cc1scc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1C 773772576 WSXKJVHGSDFAEL-QGZVFWFLSA-N 390.464 5.118 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(NC(=O)OCC(C)C)c1 776797888 OFKWDQYQPDWDSB-UHFFFAOYSA-N 384.501 5.422 30 20 GKED Cc1ccncc1/C=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784832794 AMEPXRDWEMLTIP-IMXKFXGHSA-N 379.872 5.057 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cc(OCC)ccc1OCC 794995245 OBQDUZRSQBSIEX-UHFFFAOYSA-N 384.545 5.259 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)c1 795880066 JXFRPZYAFQWITO-UHFFFAOYSA-N 393.899 5.088 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Oc2cccc(NC(=O)c3cccs3)c2)cc1 796678236 PRNIKMXSLNHNFL-UHFFFAOYSA-N 390.464 5.021 30 20 GKED C[C@@H](OC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 801706481 HQYVNTPSJRDAFF-OTYXRUKQSA-N 395.274 5.434 30 20 GKED O=C1/C(=C\c2cc(Cl)cc(C(F)(F)F)c2)C[C@H](C(=O)O)c2ccccc21 806560423 LPGFCWWTDLOYLL-XKGFZTIGSA-N 380.749 5.197 30 20 GKED N#Cc1cc(Cl)cc(OCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 806584411 FZMXLMLRTZSKEB-UHFFFAOYSA-N 390.053 5.189 30 20 GKED CC(=NNc1nccnc1C1CCC1)c1ccc(SCC(F)(F)F)cc1 807992197 COOBQXGBEKISNS-UHFFFAOYSA-N 380.439 5.235 30 20 GKED C[C@@]12CC3CC(C(=O)[C@H](C#N)c4cc(C(F)(F)F)ccn4)(C1)C[C@](C)(C3)C2 813217458 GSFFOAARJCAHSM-DVJXLTIASA-N 376.422 5.273 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1csc(-c2ccc(Cl)cc2)c1 814124031 KZYVUALUIHHKIL-ZDUSSCGKSA-N 382.872 5.612 30 20 GKED C=C(C)COc1cc(CNc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)ccc1OC 815166138 ZHSOLEUCHQQCFZ-JTSKRJEESA-N 394.515 5.024 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@]4(C3)CC4(F)F)cc2)c1 844533851 DUQIGRZUWBHBAO-FQEVSTJZSA-N 383.398 5.004 30 20 GKED N#C[C@@H](C(=O)CC1(C#N)CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 850769342 NWWJJKWHUTZPCM-ZDUSSCGKSA-N 391.418 5.356 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2ccc(F)cc2)cc1 915085379 AZXGRTBZLULBOZ-OAQYLSRUSA-N 376.456 5.212 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc(Cl)ccc3o2)cc1 915087923 YHVUDQKJWUMARM-FQEVSTJZSA-N 386.838 5.994 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3cccc(F)c3)no2)cc1 915180928 SOVZZSVLHVROJK-NRFANRHFSA-N 397.409 5.388 30 20 GKED Cc1ccccc1OCCN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351612 FRDXEYMWOQGDTN-QHCPKHFHSA-N 399.494 5.193 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3ccc(F)cc3)CC2)cc1 916623256 NHDJZSQDUJCWQV-HSZRJFAPSA-N 399.469 5.334 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cccc(Cl)c3)n2)cc1 916974000 CFMPZZFSSYBIGN-GOSISDBHSA-N 380.900 5.581 30 20 GKED O=C(O)c1ccc2scc(C=NNc3ccccc3Cc3ccccc3)c2c1 1776090982 MDZFMRRMKHMFNY-UHFFFAOYSA-N 386.476 5.636 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cs1 1776280384 CNKLGPHPXXLBIA-GQCTYLIASA-N 389.473 5.389 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C/C(=O)c2ccc(CC(=O)O)cc2)cc1Cl 1776353747 ZDAHKZWISKLNHH-BQYQJAHWSA-N 393.266 5.304 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776471522 YNLOXJMAAQVKJT-KSVUCXBSSA-N 378.468 5.482 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C)c2ncc(C(=O)O)s2)c1 1776787898 CJYVDCCCIQPEIV-HNNXBMFYSA-N 376.522 5.041 30 20 GKED CCCCOc1ccccc1/C=C\C(=O)c1ccc(OCCCC(=O)O)cc1 1776803759 OBGBEVWGDODDBZ-QINSGFPZSA-N 382.456 5.005 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777372600 MSSJWZGIFPMPFJ-SGMWPGOQSA-N 398.458 5.519 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(C2CCC2)cc1 1777569317 AKKKJQHNMJATKZ-XFXZXTDPSA-N 388.419 5.514 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1nc2ccccc2s1 36092592 GHUKSULAWWKVOU-CYBMUJFWSA-N 378.840 5.700 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)CCC2)c1 49723950 PMPRHWCCFIVFMH-UHFFFAOYSA-N 397.478 5.423 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccnc2ccccc12 68054216 SXMMBIQQOIFAFL-OAHLLOKOSA-N 393.537 5.360 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc(-c2ccccc2)s1 108237468 PGGAPPPOKGSXLR-AWEZNQCLSA-N 379.510 5.314 30 20 GKED C[C@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(C(=O)c2ccccc2)c1 120269878 QDIRIZIJTKZFRT-YADARESESA-N 396.490 5.182 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCSC(C)(C)C)n2)cc1 155262745 FADMTGAXWXAVIP-INIZCTEOSA-N 388.558 5.307 30 20 GKED Cc1nscc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 184552998 MEKVDYNHEKHZCA-LLVKDONJSA-N 394.308 5.372 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccc(NC(C)=O)c1 185110184 IHAKNQZCYFTHCS-MOPGFXCFSA-N 378.516 5.337 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)c1ccccc1 188820948 AGPPSGXOXJBEPP-SJORKVTESA-N 385.891 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2cccc(Cl)c2)C1 191465268 COKOBYQRNHVOHP-OAQYLSRUSA-N 398.934 5.797 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C(C)(C)C)cc2)=C(/S)N[C@H](C)CC)cc1 194973102 QDBSMYXRPWNOHV-QGZVFWFLSA-O 397.608 5.161 30 20 GKED COc1ccc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)cc1OCCCC#N 237269979 VBJKXTAYWOZGOW-HNNXBMFYSA-N 392.421 5.247 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)Nc1ccc(-c2ncco2)cc1 329507670 LWWQNJYFMXODOB-IBGZPJMESA-N 391.475 5.057 30 20 GKED CC(=O)c1ccc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 419510056 STHQCZYFTSRGLU-OAHLLOKOSA-N 398.553 5.013 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1c1cccnc1 432754510 KYYZZEXGYAYKKW-JOCHJYFZSA-N 398.466 5.361 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)N(C)Cc3cccc(C#N)c3)cn2)c1C 438383825 FSDUPIWJKGEELS-UHFFFAOYSA-N 386.455 5.026 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)C(=O)Nc1cccc(F)c1 439669648 HCGZDIRSOJESQE-AWEZNQCLSA-N 393.393 5.068 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCC[C@@H]3c3cccc4ccccc34)o2)c1 441216321 CUILIDVCNVVQMQ-JOCHJYFZSA-N 380.451 5.099 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 442683614 WDIBCPZIDISRGV-ZFWWWQNUSA-N 397.525 5.163 30 20 GKED C[C@@H](c1cccc(C#N)c1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 442693005 OFZUAWFIMVWWDS-KXBFYZLASA-N 392.890 5.202 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCC1CCC(C#N)CC1)C1CC1 442742108 WWQXYBYKEUMFSM-FHERZECASA-N 393.453 5.270 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2CC2)cn1)c1nc(-c2ccc(Cl)cc2)cs1 447239495 SICTYGWTAZCZOK-INIZCTEOSA-N 379.872 5.226 30 20 GKED CC#CCCCC(=O)N(CC)[C@H]1CCSc2ccc(Br)cc21 464442965 UQCQCYJTICNXDM-INIZCTEOSA-N 380.351 5.028 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@]1(C)Cc1ccccc1 467341418 OAWJCHBFJOSVDZ-JPYJTQIMSA-N 393.556 5.710 30 20 GKED C=CCCCNC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 468391748 GKGMFOGCLRFAEQ-AUPQCFOMSA-N 397.403 5.191 30 20 GKED N#CCSCC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1Cl 470567932 COIXSGSFPYRRFA-UHFFFAOYSA-N 385.703 5.509 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(Cc1ccccc1)C(C)(C)C 474287803 YKSQVLXLCLRJRA-GOSISDBHSA-N 395.572 5.320 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1 476062746 OTAQFIJJZYZTML-KNQAVFIVSA-N 384.479 5.853 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 476376907 JNZLCFQFSLITGE-HSZRJFAPSA-N 395.506 5.327 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 480944877 IFFBESCCJJUQGT-RXVVDRJESA-N 394.540 5.033 30 20 GKED CN(C(=O)c1cccc(CC#N)c1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482763819 AAUPKSXOGWPCQU-JOCHJYFZSA-N 392.861 5.407 30 20 GKED CCN(C(=O)Cc1ccc(C#N)cc1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496557906 ZCSWNMFKDDVADP-SANMLTNESA-N 397.522 5.257 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3oc(-c4ccccc4)nc3C)n2)cc1 496574949 RXTQWGQWPRSAGE-SFHVURJKSA-N 399.475 5.572 30 20 GKED N#Cc1ccccc1CSCCNC(=O)Nc1cc(C(F)F)ccc1Cl 497185083 YRZURHYSJXYKAY-UHFFFAOYSA-N 395.862 5.204 30 20 GKED C=CCc1cc(CNCc2ccc(OC3CCCCC3)cc2)cc(OC)c1O 500108013 INDRUZUDQKJUOF-UHFFFAOYSA-N 381.516 5.131 30 20 GKED CC[C@H](CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC)cc1 502052455 YCHWFXDRENQYKH-IAGOWNOFSA-N 382.529 5.469 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1ccc(F)cc1Cl 503222799 FZAHSUIEIIEFME-CYBMUJFWSA-N 391.899 5.238 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 504950508 STOUCMXFQNWCQD-VIFPVBQESA-N 390.299 5.009 30 20 GKED Cc1ccc(Oc2ccc(Cl)cc2NC(=O)CN2CCC(C)(C#N)CC2)cc1 506031159 KNFIRMSBBREWKP-UHFFFAOYSA-N 397.906 5.005 30 20 GKED Cc1nc(C(F)(F)F)ccc1NC(=O)c1ccc(C(F)(F)F)c(F)c1C 512437733 XSFGOGVDKMJKAO-UHFFFAOYSA-N 380.263 5.127 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 512796184 DXUFOBFXBLQBLV-CQSZACIVSA-N 390.405 5.497 30 20 GKED CSC[C@@](C)(C#N)NC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 517199793 BVUVZSXLDUZOMU-LJQANCHMSA-N 390.961 5.007 30 20 GKED N#CCc1ccc(NC(=O)NCc2ccccc2Oc2cccc(F)c2)cc1 518162372 RMAZKXFYYGPRHN-UHFFFAOYSA-N 375.403 5.006 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518907134 NEHXLDSBUSSKAS-UHFFFAOYSA-N 385.467 5.044 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 523742761 PWFPYGXLVRGXAT-INIZCTEOSA-N 376.481 5.032 30 20 GKED Cc1nc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)oc1C 524408377 ZNQVQWREIFSHFA-UHFFFAOYSA-N 396.834 5.040 30 20 GKED C=C[C@@H](CC(=O)NCCc1nc(-c2ccccc2)c(C)s1)c1ccccc1 534671282 OMPWWNSZRBIWDV-SFHVURJKSA-N 376.525 5.137 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(OCC(F)(F)F)c2)c(C#N)s1 538071392 SHTDFAWJKTXOCD-UHFFFAOYSA-N 382.407 5.111 30 20 GKED N#CCCCOc1cccc(N[C@H]2CCc3ccc(OC(F)(F)F)cc32)c1 540725629 BUJHWBADVBUOID-IBGZPJMESA-N 376.378 5.367 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)n([C@@H](C)C4CC4)n3)n2)cc1 540778154 DILYOOVECYUEIZ-YJBOKZPZSA-N 390.512 5.085 30 20 GKED COc1ccc(-c2cncc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2)cc1 563830501 WFVMVZVDALVDCI-SFHVURJKSA-N 391.496 5.001 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F 566887933 VPNNRSNJAQNJSQ-PZJWPPBQSA-N 388.417 5.173 30 20 GKED Cc1cc(C#N)cnc1C(=O)N1CCCCC[C@H]1c1ccc(C(F)(F)F)cc1 570832854 PVXMHGWQSSZGNQ-SFHVURJKSA-N 387.405 5.038 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 576892019 AKLBWDFHDKKFJI-KXBFYZLASA-N 397.316 6.281 30 20 GKED C=C[C@](C)(CCOC)c1nc(-c2ccc(Oc3ccccc3F)c(F)c2)no1 580739073 JMQGGUUYVCZFSC-OAQYLSRUSA-N 386.398 5.287 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3coc(C4CCCC4)n3)n2)cc1 581204208 PQTHPHGWYNWEKA-INIZCTEOSA-N 377.469 5.254 30 20 GKED N#Cc1cc(Br)ccc1CN[C@H](CC(F)(F)F)c1ccccc1 581744508 YALDFNPUDIWWEI-MRXNPFEDSA-N 383.211 5.104 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@]12CCCC[C@@H]1C2(F)F 596790875 SJNJVRHSMPCPPM-RXVVDRJESA-N 397.425 5.208 30 20 GKED C[C@H](CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)c1ccccc1 602148296 QLLHQIAKBTXTAS-QGZVFWFLSA-N 384.435 5.198 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 604127029 YSVCXLIAVMHBIY-OAQYLSRUSA-N 381.495 5.406 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](Cc2ccc(C)cc2)c2ccccn2)c1 604666091 SCCSJAIBGYNMJY-QHCPKHFHSA-N 387.483 5.060 30 20 GKED CCCN(CC)Cc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 609382217 AYIYYFWNYCYYIH-UHFFFAOYSA-N 381.545 5.177 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 609427588 MOXMMSJXEVRABX-CQSZACIVSA-N 396.899 6.247 30 20 GKED C[C@H](NC(=O)N[C@H](CCc1ccccc1)c1ccccc1)c1cccc(C#N)c1 610357245 JIWJDMRUXBPGAA-YADARESESA-N 383.495 5.293 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 610629333 ZLDJMWGYCWTFCD-UHFFFAOYSA-N 381.476 5.328 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)cc2ccccc21 611988476 OWGKAVJCKHSXDW-CVTTXWKISA-N 389.524 5.325 30 20 GKED Cn1c([C@@H](NCc2ccc(C(C)(C)C#N)cc2)c2ccccc2)nc2ccccc21 614212617 SJEGDLQYXNECQI-DEOSSOPVSA-N 394.522 5.254 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 619450781 HYSOYHRPULDSEE-UHFFFAOYSA-N 382.250 5.488 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)cc1F 731322121 UKRRWQWTNBFEAQ-LBPRGKRZSA-N 375.494 5.037 30 20 GKED COc1ccccc1CC(C)(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 732934558 GLIVJDISNLWLJJ-HSZRJFAPSA-N 398.506 5.558 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccccc2OC(C)(C)C)cc1OC 734413238 YTTWZDLWCRWNFU-WYMLVPIESA-N 381.472 5.089 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](CCC)c1cccc(C(F)(F)F)c1)c1ccncc1 734667300 XKBRUOIAKDMAGO-OALUTQOASA-N 391.437 5.558 30 20 GKED Cc1ccc([C@@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)o1 742650141 WGBWQFVOGNVOQL-GFCCVEGCSA-N 382.407 5.355 30 20 GKED CC(C)(CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 743448817 BQVPWBFIEABXGI-KRWDZBQOSA-N 389.282 5.009 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c2cccc(Cl)c2)cc1 744029809 WNSJKYACXWNVMI-YWZLYKJASA-N 382.891 5.134 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1-c1ccccc1 744035501 MXDWFTJUDYDYCX-OAHLLOKOSA-N 391.883 5.445 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc3cc(O)ccc3c2)cc1OCCCC#N 749003977 RPPWKVAJSSPWQA-WMZJFQQLSA-N 387.435 5.133 30 20 GKED CC[C@H](C)n1c(-c2ccccc2)nn(CN(C)Cc2cccc(C#N)c2)c1=S 749888464 PFUBFOSLRYMNKP-KRWDZBQOSA-N 391.544 5.013 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 750692922 IWUWWWJNBSTLKX-LMRWQKIVSA-N 398.409 5.507 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(SCC(F)F)cc1 753144971 SGDJXNCOXJAHEC-WAYWQWQTSA-N 388.464 5.458 30 20 GKED O=C1/C(=C/c2nc(Cl)cs2)CCc2nc(-c3ccc(F)cc3)sc21 759085217 SYSGXBQOUHPSDU-JXMROGBWSA-N 376.865 5.272 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 763944890 OSMRRHZYSZYGIA-RDTXWAMCSA-N 391.452 5.007 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2NCc2ccccc2Cl)n1 776075120 SGGRSUVMXQWPQX-INIZCTEOSA-N 381.888 5.207 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCC1(c2cccs2)CCCCC1 780668038 QFLOOMITJQOGBA-INIZCTEOSA-N 383.517 5.063 30 20 GKED O=C1c2ccccc2CN1N=Cc1nc(-c2cc(Cl)ccc2Cl)cs1 781599643 YLBYIQPOVQIBMJ-UHFFFAOYSA-N 388.279 5.107 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C)c1ccncc1 781941945 WABASOZIZVRLEW-RBUKOAKNSA-N 375.875 5.188 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1ccc(Cl)cc1Cl 782245020 GLKMMZITHQESCK-UHFFFAOYSA-N 395.340 5.048 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1 791556710 LRGMHABVHYIAIP-GOSISDBHSA-N 377.513 5.078 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CSc3ccc(Cl)cc3C2=O)cn1 792870246 PKBIBFZYSAHCSC-RIYZIHGNSA-N 394.883 5.178 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C\Sc1cc(F)ccc1F 797865842 FWRSHBXAZVMWQI-YXVBKTCISA-N 390.480 5.461 30 20 GKED COc1cccc(CC2(C(=O)[C@@H](C#N)c3nc4ccccc4o3)CCCCC2)c1 805860190 AULGSIXUMYAMTO-LJQANCHMSA-N 388.467 5.206 30 20 GKED COc1ccc(-c2nc(C)c(C(C)=NNc3cccc4cnccc34)s2)cc1 814836365 OEIRTDQOPCGGDR-UHFFFAOYSA-N 388.496 5.511 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c2C#N)[C@@H](C)C1 839389790 SRZHCCAUOMXAKE-YUMQZZPRSA-N 398.290 5.399 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCCC(=O)OC(C)(C)C)n2)cc1 847626206 GTZLAWMCOCGQME-KRWDZBQOSA-N 398.528 5.197 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1ccccc1SCC#N 862722025 OWEDAIBWTQUKSR-UHFFFAOYSA-N 397.500 5.210 30 20 GKED CC(C)(c1ccc(NCc2cc(C#N)ccc2Br)cc1)C(F)(F)F 864026784 DABQHLWOJCEFKF-UHFFFAOYSA-N 397.238 5.773 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1sccc1C(F)F 873985472 NHDIZUYYFFYACP-BQBZGAKWSA-N 395.315 5.325 30 20 GKED C=C(C)C[C@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 901682024 QQNCAXVSYMCDNX-IBGZPJMESA-N 377.843 5.089 30 20 GKED CCN(C(=O)/C=C/c1ccc2cc(OC)ccc2c1)[C@@H](C)c1ccc(C#N)cc1 914509474 MRIHJNQXXDNLDT-QKAYDNCFSA-N 384.479 5.343 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)[C@H](C#N)C(=O)Nc1ccccc1 916900855 XXQKUNQSXBTVIL-KYFVDPIZSA-N 386.451 5.136 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3sc(-c4ccccc4)cc3C#N)c2c1 917716673 PCGGAIPCECRACI-UHFFFAOYSA-N 388.448 5.602 30 20 GKED CCCCCCCCCCC(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 918345753 CKUJAQSGUNEHQR-UHFFFAOYSA-N 378.601 5.014 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1sc2ccccc2c1Cl 920105575 HRTSQSUKPCFBIS-AWEZNQCLSA-N 392.867 5.550 30 20 GKED CC(C)(C)Oc1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776265002 PFOAHYYXNOZNPS-KPKJPENVSA-N 390.435 5.718 30 20 GKED CC(=C/c1cc(F)cc(F)c1)/C=C/C(=O)c1ccc(OCCCC(=O)O)cc1 1776398804 IDDGJOGJYKSXCP-VDGJTISKSA-N 386.394 5.051 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCC)c(OCC)c1 1776784800 XZLHAFDRQARZQW-IBGZPJMESA-N 379.541 5.168 30 20 GKED CCCCCCCC/C=C/CCCCCCCC(=O)N1CCCC[C@H]1C(=O)O 1776785225 JARCNTJKQPPSSM-CZQLGGELSA-N 393.612 6.490 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2nc(C(=O)O)ccc2C#N)cc1 1776785595 QGZHIQDXYYTEIB-GXDHUFHOSA-N 378.472 5.561 30 20 GKED COc1cc(C)ccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)s1 1777280831 YANOFUARMXPUGU-FLIBITNWSA-N 378.449 5.326 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4cc(Cl)ncc4C3=O)s2)c1 1777684312 LXXZWMPXNRHBHJ-ZROIWOOFSA-N 395.867 5.374 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)C(=O)Nc2cccc(Cl)c2)n1 21514656 DUYADWDCWMRAJU-JTQLQIEISA-N 399.825 5.053 30 20 GKED C[C@@H](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 31436192 UOXPKQPGUZAHLH-SNVBAGLBSA-N 386.295 5.087 30 20 GKED CC(=O)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 41514645 MACUUNRVYDURTK-CYBMUJFWSA-N 386.885 5.218 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nc2ccccc2o1 41543116 GDDFZWYCLFOUDR-ZDUSSCGKSA-N 379.828 5.095 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)s1 49723725 IFXCBKJDRHMPMS-UHFFFAOYSA-N 392.484 5.024 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(C2CC2)n(C(C)(C)C)n1 66801368 MCXCHKIMNUCPJY-AWEZNQCLSA-N 382.533 5.162 30 20 GKED C=CCN(C(=O)c1ccc(C)c(NC(=O)c2ccccc2F)c1)c1ccccc1 121205625 HYKNPIRFJLPHLI-UHFFFAOYSA-N 388.442 5.219 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc(-c3cccs3)nc3ccccc23)n1 122343137 SUXPWNTYULHTCN-OAHLLOKOSA-N 375.478 5.218 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)n1 125031693 CTNQSMXJXDYCAT-DNVCBOLYSA-N 380.517 5.011 30 20 GKED N#CCC[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 130598734 VHDLYDDCDPCAHH-VWLOTQADSA-N 381.479 5.272 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1csc(-c2ccoc2)n1 152323337 KVNACCHPZVENEJ-UHFFFAOYSA-N 391.477 5.184 30 20 GKED COc1cc(Cl)c(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1OC 153801570 MHUOWZRPNAZRAQ-GFCCVEGCSA-N 390.892 5.004 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3cccc4ccccc34)n2)cc1 155730033 PAVLGLNQHSRXGI-IBGZPJMESA-N 394.459 5.081 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(-c2ccncc2)cc1 174344493 INYSUCBKQGAVOA-KRWDZBQOSA-N 384.483 5.432 30 20 GKED CCc1cnc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 175654824 SKLOTGHUTNKNNI-UHFFFAOYSA-N 392.484 5.033 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 186646448 LWFNSNNJIVMVRK-AOMKIAJQSA-N 399.897 5.131 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)cc1-c1ccc(F)cc1 190931401 ALOZEJJMNXSQHY-KRWDZBQOSA-N 387.439 5.296 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2ccccc2OC)n1 270203497 MBBHSOBVDSZBPL-UHFFFAOYSA-N 387.549 5.015 30 20 GKED COc1ccccc1[C@H](Nc1ccc(C#N)cc1C(F)(F)F)c1ccccn1 301891209 UNYVVYYVWSAJDG-FQEVSTJZSA-N 383.373 5.182 30 20 GKED C/C(O)=N/[C@@H](C(O)=Nc1ccc(N2CCCCC2)c2ncccc12)C1CCCC1 329910682 NJTSOUFCOFBVAI-OAQYLSRUSA-N 394.519 5.348 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H]1CCCC(F)(F)C1 409961944 GGKGRQQSBDZSQI-BXKDBHETSA-N 389.286 5.251 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1c(F)ccc(Br)c1F 410324498 SHFSNSQQXSZEIK-NSHDSACASA-N 397.288 5.591 30 20 GKED C[C@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)CC(F)(F)F 413988971 ODSPHMYFFRAWFC-ZDUSSCGKSA-N 378.419 5.028 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)N(Cc1ccco1)Cc1cccs1 419616232 SDHKQPZJDZINFO-NRFANRHFSA-N 391.496 5.002 30 20 GKED Cc1cccc([C@H]2CCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C 437911335 BAZMBYDNSDDJIW-JOCHJYFZSA-N 375.516 5.864 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442259521 MGFOKXXDXJEFLQ-UHFFFAOYSA-N 384.266 5.132 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)cc1C(F)(F)F 443884092 MMUNGCCURSEJAC-IBGZPJMESA-N 388.389 5.216 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1C 446896964 TYFHXWYNFOWMHK-KRWDZBQOSA-N 382.451 5.448 30 20 GKED CC1(C#N)CCC(N[C@@H](Cc2ccccn2)c2ccc(Br)cc2)CC1 449278427 JGEXXALYPHVVBE-CKHPTIKVSA-N 398.348 5.190 30 20 GKED CCC1(c2ccccc2)CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 459393236 FGOHWXCMSMHISE-QGZVFWFLSA-N 379.529 5.134 30 20 GKED C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1Cl)c1cccc(C#N)c1 463287935 OAPATPDCGRLFMD-OAHLLOKOSA-N 376.843 5.746 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)CC(=O)c1cn(CCC#N)c2ccccc12 472423244 BWXORSGJTJUMHP-KRWDZBQOSA-N 385.467 5.177 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1OCC 474435655 CFWRBAZSHJXTDB-INIZCTEOSA-N 386.517 5.334 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 475576056 RQTBWKWAOZKQAP-UHFFFAOYSA-N 389.543 6.100 30 20 GKED N#Cc1ccc(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)cc1F 480150329 QWNPMQIIUFOZGJ-UHFFFAOYSA-N 377.366 5.452 30 20 GKED CC1(C)C[C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccc(F)cc2O1 483033578 ZVECUUFVQGFSAK-SFHVURJKSA-N 381.451 5.051 30 20 GKED CCCCCn1cc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)c2ccccc21 483233629 UQBYCLLXXQALPZ-SFHVURJKSA-N 382.467 5.265 30 20 GKED Cc1nc2cc(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)ccc2o1 483529825 ZZXQLRPQZWSMPI-GFCCVEGCSA-N 395.390 5.028 30 20 GKED CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CCCC#N)c2ccccc2)c1 487393163 UAIQCESDYYUQMM-HXUWFJFHSA-N 397.906 5.099 30 20 GKED CC(C)Oc1cc(F)ccc1NC(=O)Nc1ccccc1SC[C@H](C)C#N 491973885 ABLROVNTYYWTMS-CQSZACIVSA-N 387.480 5.509 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccccc1C)C(C)C 496248378 VVINFLXCXSIZEU-QFIPXVFZSA-N 382.552 5.257 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1sc2c(c1C#N)CCCCC2 500252332 IVLIOEYCHKCDEQ-UHFFFAOYSA-N 399.566 5.634 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(COC3CCCCC3)c2)cc1OC 502353733 RIVAHRHFUBVIRH-UHFFFAOYSA-N 395.499 5.362 30 20 GKED CCOc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1C 503501018 CIMVNEWYORUCRM-GOSISDBHSA-N 376.481 5.316 30 20 GKED C[C@H](C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(C)(F)F 504181852 MTLZVDPBWVJEFI-LDYMZIIASA-N 377.275 5.106 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)CC1 507827768 RLYAMIIKVFUYKX-UHFFFAOYSA-N 389.282 5.552 30 20 GKED CCN(Cc1nc2cc(C(F)(F)F)ccc2n1C)[C@H](C)c1ccc(C#N)cc1 508605748 SJJJTJWZOVLAIS-CQSZACIVSA-N 386.421 5.047 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510661108 IIXZIFGOHPWGRI-UHFFFAOYSA-N 389.480 5.632 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510704470 VBGQYKGERDPGAT-MRXNPFEDSA-N 389.430 5.715 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)c1 513030025 BJMCTMZHYCGWRN-NUNAXRQHSA-N 388.511 5.045 30 20 GKED CCCOc1nc(C(=O)Nc2ccccc2SCCC#N)cc2ccccc12 513233430 MEEBTDPDPPYNOX-UHFFFAOYSA-N 391.496 5.282 30 20 GKED CC(C)C[C@@H](NC(=O)c1ccc(COc2ccccc2C#N)o1)c1cccs1 515873305 UWBSJWCKSZUIAD-GOSISDBHSA-N 394.496 5.309 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CCCCOc1cccc(C#N)c1 517652817 DGPLGWLZZNIOJB-UHFFFAOYSA-N 391.298 5.073 30 20 GKED CC(=O)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 518668425 BWLIPMYJBKHFDF-UHFFFAOYSA-N 398.431 5.228 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccnc4ccccc34)cc2F)c1 524460135 CJKRFCQWBUUQSM-UHFFFAOYSA-N 397.409 5.077 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1cccc(COc2cccc(C#N)c2)c1 524522104 WKYNALPKOXOBIW-UHFFFAOYSA-N 396.899 5.124 30 20 GKED C=CCOc1ccccc1CNCc1cc2ccccc2nc1N1CCCCC1 524640161 HRQAONHKVPMNLC-UHFFFAOYSA-N 387.527 5.080 30 20 GKED CCc1ocnc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 525327286 GHOFQRLZEURRKM-NSHDSACASA-N 392.267 5.157 30 20 GKED Cc1ccc([C@@H](NC(=O)CSc2ccc(C#N)cc2F)c2cccs2)cc1 525503553 BLSRLZKFPREZNA-OAQYLSRUSA-N 396.512 5.065 30 20 GKED CC(C)(C)[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(F)(F)F 525802104 LTOYOYXKARYSCD-IBGZPJMESA-N 390.405 5.252 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)nn1C1CCCCC1 537381930 AMBSYVQRLSMNSS-GOSISDBHSA-N 390.512 5.310 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)Nc2ccccc2N2CCCC2)cc1 538081405 BTQJAGOBSGOLON-UHFFFAOYSA-N 396.494 5.147 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 539594099 GFSADWBZHSZDND-UHFFFAOYSA-N 398.462 5.685 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3c[nH]c4cc(F)ccc34)c2)c1 540887563 OYXNKILQJRBOPT-UHFFFAOYSA-N 385.398 5.010 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc(Sc3ccccc3C#N)cc2)C1 542585013 QGCRBFPNLILLQC-VGOFRKELSA-N 399.519 5.328 30 20 GKED CCSc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccn1 542650374 VPXUTISVIGLIPA-MRXNPFEDSA-N 379.510 5.116 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1)c1ccccc1 545964593 IOVPEFOHKGNOAL-FQEVSTJZSA-N 399.897 5.355 30 20 GKED CCN(C(=O)c1ccc(C#N)c(Cl)c1)[C@H](c1ccc(C)cc1)c1cccnc1 548283956 JBFYPCGLYBYZQJ-JOCHJYFZSA-N 389.886 5.167 30 20 GKED CSc1cccc(F)c1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 554212514 XWPMGLLZTKZHIL-CYBMUJFWSA-N 389.521 5.264 30 20 GKED N#Cc1ccncc1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 561640398 JARCAIQJLRRNRW-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1cc(Br)ccc1CNc1ccc(CCC(F)(F)F)cc1 571480759 ZDILIPFJNZHYEI-UHFFFAOYSA-N 383.211 5.428 30 20 GKED CN(C(=O)Cc1cccc(C#N)c1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 583060158 JXYKBDOONWMTBP-QHCPKHFHSA-N 392.861 5.141 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cc(Cl)ccc2C(F)(F)F)cc1Cl 588326913 PKSJFRNSRKHZFT-UHFFFAOYSA-N 388.176 5.206 30 20 GKED C=C(C)COc1cc(CNCc2cc(C)cc3c(C)c(C)[nH]c23)ccc1OC 591711657 FDXYYMVELAGIHQ-UHFFFAOYSA-N 378.516 5.346 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2)cc1C 597348643 ADBKCLCWFFTLOE-UHFFFAOYSA-N 378.497 6.069 30 20 GKED COc1cc2nc(C)sc2cc1NC(=O)c1ccccc1-c1ccccc1C#N 608849173 AYYLWWALVGBQJS-UHFFFAOYSA-N 399.475 5.404 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccoc3)n2)sc2c1CCCCCC2 609371197 NTDFVHYKKMBXNH-UHFFFAOYSA-N 383.498 5.248 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1cccc(Cl)c1 609371465 LFRKKOVWNBMAQK-AWEZNQCLSA-N 390.961 5.464 30 20 GKED CCCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@H](C)c1ccccc1 609499708 XVKHPRXSHUBYOE-LJQANCHMSA-N 399.494 5.749 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609518988 XOIZZFQVUNFKHU-UHFFFAOYSA-N 389.499 5.337 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 619530153 AGUJOPAZHSPSST-LBPRGKRZSA-N 394.302 5.440 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n([C@H]2CCCOC2)c1C 626633945 QUADZCYGCIXJGK-FQEVSTJZSA-N 380.532 5.561 30 20 GKED Cc1scc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1C 678642566 YUSROSZJNGLJCU-NSHDSACASA-N 380.416 5.484 30 20 GKED FC(F)(F)c1cscc1CN1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 685834856 PVFZOHGAODYVNU-RKDXNWHRSA-N 385.295 5.330 30 20 GKED COc1cc(C#N)ccc1OCCCC(=O)Nc1ccc(SC(C)(C)C)cc1 726760051 IARODJPDUFDRTQ-UHFFFAOYSA-N 398.528 5.255 30 20 GKED COC(=O)c1ccc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)o1 728438716 LWMSOKYFWJEZNI-BENRWUELSA-N 399.855 5.056 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1cccc(OCc2ccccc2)c1 728439938 HRHDUTGXWIHHBG-KHPPLWFESA-N 387.266 5.202 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3cccc(OC)c3OC(F)F)c(C)c2c1 729151518 SSJGFXHVTSUBBK-VQHVLOKHSA-N 388.366 5.256 30 20 GKED N#CCn1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc2ccccc21 729317577 ZQMRPAYMXWQJKJ-QFIPXVFZSA-N 390.446 5.073 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1cccc(Br)c1 730953460 ZPUHFILKNMPIEC-UHFFFAOYSA-N 392.347 5.264 30 20 GKED N#CCC1(COC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 744278028 HMUVZQZEZDHXPD-UHFFFAOYSA-N 376.239 5.636 30 20 GKED C[C@@H](OC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 744336867 ZIUBLOYTCDTFNV-TYWZFMJISA-N 380.206 5.231 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)c1 745893120 NRJLUTYERNUDPC-FQEVSTJZSA-N 385.870 5.178 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=S)Nc1ccccc1C#N 746544185 SFGBORRUVZEYFU-UHFFFAOYSA-N 375.453 5.168 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 747194276 VWDZEZWZOZNGFY-XCHKQJEOSA-N 378.419 5.565 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cc(F)cc2Cl)cc1 761535529 UQPNRQXLCQYTCR-QGZVFWFLSA-N 399.252 6.040 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccccc1SCc1ccccc1 768960478 ARRXOVNBRQDKQJ-UHFFFAOYSA-N 391.496 5.520 30 20 GKED CN(Cc1cccc(N(C)C)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 770233141 XANQNIUJCDVGJA-XMMPIXPASA-N 398.510 5.072 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3ccc(F)cc3C)o2)C(=O)c2ccccc2C1 778520389 VRUDAEGXWZVTPO-PDGQHHTCSA-N 389.426 5.023 30 20 GKED C[C@H](C#N)Oc1ccc(CNC2(c3ccc(C(F)(F)F)cc3)CCCC2)cc1 779984397 GDHCGIRMQIDPII-MRXNPFEDSA-N 388.433 5.555 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1C 782680044 DLPDEDSOOHOOCN-UHFFFAOYSA-N 379.504 5.137 30 20 GKED C=CC[C@H](C(=O)O[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784832618 UXWCDRSYJOCRMC-ZBFHGGJFSA-N 382.460 5.308 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 796750128 ZGDHLMNQWGUDNI-MRXNPFEDSA-N 399.516 5.412 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2cc(F)ccc21 797707301 LBIMDIQJLMKVPK-NRFANRHFSA-N 383.426 5.225 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H]2c3ccccc3CC23CCOCC3)cc1 810255639 QMNXMEYSAAQLMO-FDDCHVKYSA-N 397.946 5.563 30 20 GKED N#CCCCn1cc(C(=O)OC[C@H]2CC[C@@H](c3ccccc3)O2)c2ccccc21 814056951 NLURKSSIXRERJH-XXBNENTESA-N 388.467 5.022 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1cnn(-c2ccccc2)c1C 818209744 YTYZYKYXDPIJSS-UHFFFAOYSA-N 393.800 5.084 30 20 GKED C=CCCC[C@@H](NCc1ccc(-c2ccccc2Br)s1)C(=O)O 900069296 XOIJHVPVAIQSNH-MRXNPFEDSA-N 394.334 5.077 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(C2CC2)[C@H](C)c2ccccc2)cc1OC 914481662 RAKKMAOOSSXHQF-HAZIXKIPSA-N 377.484 5.025 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Cl)s1)C(=O)Nc1cc(Cl)cc(Cl)c1 916946001 HRVHGRBJQNLMPV-GIDQFRGBSA-N 399.686 5.069 30 20 GKED CC(C)(C)c1cc(C=NNc2ccc(F)c(C(=O)O)c2)cc(C(C)(C)C)c1O 1776061591 DOQGIMRHOOHQND-UHFFFAOYSA-N 386.467 5.271 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2csc(-c3ccc(C(C)C)cc3)n2)C1 1776155961 XXUGVVSAYBYNTM-QFIPXVFZSA-N 384.545 5.176 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776326979 METAPPMFVGPOGO-WEVVVXLNSA-N 394.492 5.921 30 20 GKED CC[C@@H](C)n1ncc2c(C(=O)O)cc(/C=C\c3ccc(C(C)(C)C#N)cc3)nc21 1776702137 YNITZXQJGNTUOT-MEODZPNASA-N 388.471 5.072 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Br)cc1Cl 1776782961 SRHBFQRDWGIVQA-HNNXBMFYSA-N 390.749 5.396 30 20 GKED CCCCCCOc1cccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)c1 1776790295 LDJWNZAFJGGIOU-OVWUPXBPSA-N 378.468 5.484 30 20 GKED CCn1c2ccccc2c2cc(/C=C3/CCc4ncc(C(=O)O)cc4C3=O)ccc21 1777002760 CLCJAMKWMFSUSC-WJDWOHSUSA-N 396.446 5.120 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc2ccccc12 1777263374 KPJAFLRKLJUMAI-BENRWUELSA-N 398.414 5.703 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cc(C(=O)O)c(Cl)s1 1777488175 PGKBQWIDBMLPIV-FPLPWBNLSA-N 389.885 5.428 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc(Oc3ccccn3)c1)C2=O 1777682915 FKESUDGBRIDYHM-QGOAFFKASA-N 385.419 5.175 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2sc3cc(Cl)ccc3c2Cl)nc(C)n1 41574026 ISAKWFNIYSKSIY-LBPRGKRZSA-N 376.268 5.105 30 20 GKED C=CCN(Cc1cccs1)C(=O)COC(c1ccccc1)c1ccccc1 60678198 ODMDQJGJUWZGKU-UHFFFAOYSA-N 377.509 5.069 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(O)cc1 97992939 IVSYWRJGVPHONJ-JYRVWZFOSA-N 377.827 5.194 30 20 GKED CCCCCCCCC(=O)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 107576462 QDFQHPLZZVYKEF-GOSISDBHSA-N 387.499 5.332 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(OCCCC#N)c2)cc1 117670102 PADFPPCJGIUXMS-UHFFFAOYSA-N 398.462 5.161 30 20 GKED Cc1c(C#N)c(NC(=O)CS[C@H](C)c2cccs2)n(Cc2ccco2)c1C 133845264 ZKROVUKNDYTATO-OAHLLOKOSA-N 399.541 5.112 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 153997504 NOYYAMCSWHGFTC-HKUYNNGSSA-N 397.544 6.132 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(CCC(F)(F)F)cc1 184063067 OGOMZYVHADVHBG-ZDUSSCGKSA-N 377.366 5.116 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(OCc2nccn2C)cc1)c1ccc(F)c(F)c1 186447500 MFXFCWGPNWXCAW-HJPURHCSSA-N 397.469 5.245 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C(=O)NCCCC)CC[C@H]1C 191488300 YEHOYYJWFCFHAB-UYAOXDASSA-N 399.579 5.087 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H](c2ccccc2)c2ccco2)c1 237839809 LRKBBZBVQLTWDU-SANMLTNESA-N 394.474 5.609 30 20 GKED CC(C)[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Nc1ccccc1 248250263 IQQNZAKDAZALOR-XMMPIXPASA-N 383.495 5.092 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCOCC2)cc1 276431297 ISNUOSXVPPRRDK-UHFFFAOYSA-N 379.500 5.349 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2cc(C)nc3c(F)c(F)ccc23)ccc1OC 302697971 FBDQLLMPDDNPAF-HNNXBMFYSA-N 397.425 5.123 30 20 GKED Cc1cc(C)n(-c2cccc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)c2)n1 329984938 CRBOMKQFZLWIAB-UHFFFAOYSA-N 380.492 5.002 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)cc1 410142149 XCIZWCCLVVZKHL-CYBMUJFWSA-N 375.394 5.389 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(CCCC1(C#N)CCOCC1)C1CC1 410348044 GYLXWWVOMIXLNC-INIZCTEOSA-N 380.454 5.331 30 20 GKED CC1(C)[C@H](c2ccccc2)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 422209314 UJRKFHCTCGYPKT-VXKWHMMOSA-N 375.516 5.399 30 20 GKED N#Cc1cnc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c(Cl)c1 431579121 NQPQEUXHCFLADU-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC[C@H](CC#N)NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 432319457 GHPUWTDITAJFIR-LLVKDONJSA-N 380.275 5.194 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 432870682 DCTNHVLYVYNOSK-UHFFFAOYSA-N 390.418 5.100 30 20 GKED CCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H](Cc1ccc(F)cc1)C(C)C 437919425 VPGJVTFCBICXAZ-QFIPXVFZSA-N 395.522 5.748 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1nc(-c2cc(Cl)ccc2Cl)cs1 439147566 STMXEFJQLXPGLX-UHFFFAOYSA-N 378.240 5.142 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccc(Br)c3ccccc23)CC1 441805943 XIELGCHIZJDIPX-UHFFFAOYSA-N 386.293 5.054 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccco2)cc1 454573505 VUIBUAKFEWUWCK-JOCHJYFZSA-N 399.450 5.703 30 20 GKED C=C(C)Cn1c(-c2sccc2C)nnc1N1CCC(CC(F)(F)F)CC1 460946106 BAALBMPLZDKNIV-UHFFFAOYSA-N 384.471 5.060 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 464272710 PHGJSPOGRNHOOS-NSHDSACASA-N 382.769 5.075 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc4cnccc34)cc2F)c1 465131114 XCSIXUCRDUFHBB-UHFFFAOYSA-N 397.409 5.077 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1c(F)cccc1OC 466124094 PQBYJGFZYFCASR-GFCCVEGCSA-N 382.888 5.008 30 20 GKED CN(Cc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1)C1CCCCC1 474579766 SQQPRHJVWFCGDR-OAQYLSRUSA-N 389.543 5.477 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)C[C@@H](CC#N)c4ccccc4)CC3)c[nH]c2c1 474904009 CTFHGZGYNQJDHC-OAQYLSRUSA-N 383.495 5.180 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn2c(-c3ccccc3)ccnc12 476795403 IOLQENRHWOFLEB-UHFFFAOYSA-N 396.494 5.501 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(F)cc(Cl)c(C)c1F 479000734 XDLGCXIUOGCULD-UHFFFAOYSA-N 396.869 5.314 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2scc(C)c2Cl)cc1 480042191 IDXYCJUXRFQGLT-UHFFFAOYSA-N 398.871 5.635 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)cc1 482101248 GAGRRQJPWUWWKZ-XMMPIXPASA-N 398.487 5.302 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 486414842 GDQWVCJICSREJQ-UHFFFAOYSA-N 394.540 5.736 30 20 GKED CSc1cc(O)ccc1NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 486939229 NPMGTSFPDNHADK-UHFFFAOYSA-N 391.452 5.422 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)Nc1cc(F)c(OC(F)F)cc1F 491419080 VZOXBKLOPAPSOO-UHFFFAOYSA-N 396.262 5.315 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 495350164 ZGBOJUBIUCNIRP-UHFFFAOYSA-N 386.467 5.186 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)c1ccccc1Cl 499935086 UETDVHSEEVQPTQ-OAHLLOKOSA-N 378.646 5.123 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1Cl 499943250 HYSUBOFIUITPED-DCGLDWPTSA-N 379.674 5.131 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 504034556 HQRQFYGUMWLLPV-HRAATJIYSA-N 389.886 5.878 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)N[C@@H](C)c3ccc(C#N)cc3)cc2)cs1 504173607 WFMYKRFVJVWRLU-LSDHHAIUSA-N 390.512 5.112 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2cc(C#N)ccc2Cl)CC1 507731660 JIXPDTHBIAACTE-UHFFFAOYSA-N 377.875 5.021 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C 509997101 IXZSBMNGCNFYOB-UHFFFAOYSA-N 391.393 5.028 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c(Cl)c1 510069950 GSTCOSNMHVNWPN-OAHLLOKOSA-N 385.748 5.166 30 20 GKED Cc1c(C#N)cccc1C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 513226423 PJMWDQGILXENGU-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(-c3cnco3)cc2)cc1 518546139 XIYNCRFCLPFHRF-UHFFFAOYSA-N 399.381 5.397 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(-c2csc(C)n2)cc1 522174055 WVDJFVHZPPTWDR-UHFFFAOYSA-N 383.542 5.078 30 20 GKED N#CC1(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)CCCCC1 525575044 HWHVHNNYWDNOCQ-UHFFFAOYSA-N 390.270 5.137 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)CCc2ccnc3ccccc23)cc1 536888254 YLGASEZQVBLMIY-UHFFFAOYSA-N 391.474 5.022 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc3cnccc3c2)cc1Cl 537538561 OENCKINWUMRTRR-HXUWFJFHSA-N 398.853 5.191 30 20 GKED Cc1cccc([C@H]2CCCN2Cc2cccc(OCc3cccc(C#N)c3)c2)n1 538727470 SWVLDZXUXDBWJU-RUZDIDTESA-N 383.495 5.178 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1cccc(OCCCC#N)c1 539626916 GXCLSABURIOENY-MRXNPFEDSA-N 377.513 5.974 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](C)c1cccc(C#N)c1 540594402 UAQVFPDYPIWYOU-KBPBESRZSA-N 381.932 6.055 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1 554444773 RMGYBQAKBOXSKI-UHFFFAOYSA-N 385.895 5.370 30 20 GKED CC(C)(C)c1ccc(NC(=O)N2CCC(Oc3ccc(C#N)cc3F)CC2)cc1 558228904 PUOXVZUFJFZEHF-UHFFFAOYSA-N 395.478 5.070 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(C)(C)[C@H]1C1CC1 570250779 UEVBUQUCNFXVAB-OAQYLSRUSA-N 375.472 5.311 30 20 GKED C=CCOc1cc(OC)ccc1-c1nc(-c2cccc(-c3cscn3)c2)no1 579288028 FZQBZQKBZOORCM-UHFFFAOYSA-N 391.452 5.101 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1)c1cccc(C#N)c1 589789483 LECRMPQMUALPQJ-VQTJNVASSA-N 383.495 5.592 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CCc2ccccc2F)cc1 604563897 RIDYXNJPRCUFBV-UHFFFAOYSA-N 390.414 5.070 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 608862702 JCKOCDKZZDKVPB-LJQANCHMSA-N 387.405 5.531 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)on2)cc1 609427538 IIAMOUJBDCTGAU-OAHLLOKOSA-N 377.469 5.297 30 20 GKED CN(Cc1nc2ccccc2s1)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609986042 QWVMFFXDXNTNNP-UHFFFAOYSA-N 398.491 5.184 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1C 610142700 KKLKQNIXCZORBG-INIZCTEOSA-N 393.556 5.752 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC(c2ccccn2)CC1 611085739 UOUFKLMREUXHIV-UHFFFAOYSA-N 399.519 5.124 30 20 GKED C[C@@H]1C[C@H](NCc2ccc(C#N)c(Cl)c2)c2cccc(Br)c21 619755344 XNXNNHJFDQUSEZ-DIFFPNOSSA-N 375.697 5.312 30 20 GKED O=C(N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F)[C@@H]1CC[C@@H](C(F)(F)F)C1 648582631 CNQUUXBXDTYUKP-RFXMVYNHSA-N 396.306 5.005 30 20 GKED C=CCSc1ccccc1C(=O)N(C)C[C@H]1CCCO[C@@H]1c1ccccc1 681623327 KNLXPNMBIZVARJ-DENIHFKCSA-N 381.541 5.205 30 20 GKED N#C[C@@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1cnc2ccccc2n1 682995721 ZRTFMUXIUXBEQJ-SNVBAGLBSA-N 398.274 5.641 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728390047 DZXGMALOZKAXAO-QFIPXVFZSA-N 379.504 5.011 30 20 GKED N#CCSc1ccccc1C(=O)NCc1ccccc1Sc1ccccc1 730558826 SGBFRHAJKYKCMC-UHFFFAOYSA-N 390.533 5.383 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 730735281 PGBVSWPYJHHNQD-MRXNPFEDSA-N 391.565 5.456 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccncc1 734664775 RCHIYIBYYMZNPK-UXHICEINSA-N 397.931 5.503 30 20 GKED Cc1cc(NCc2cccc(-c3ccc(C#N)s3)c2)nc(-c2ccccn2)n1 739889612 BHHNFGCTHSAVSL-UHFFFAOYSA-N 383.480 5.059 30 20 GKED Cn1c([C@H](C#N)C(=O)C[C@@H](Cc2ccccc2)c2ccccc2)nc2ccccc21 744010262 FFTRZBPTDCRYOJ-FGZHOGPDSA-N 393.490 5.166 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3sccc3C)n2)cc1 748834071 JRFOLMTVDXEACP-GVDBMIGSSA-N 378.522 5.468 30 20 GKED Cc1c(C2CC2)nc2ccc(Br)cc2c1C(=O)OCCCCC#N 750577780 XWOWWCAMRDJNBO-UHFFFAOYSA-N 387.277 5.034 30 20 GKED COc1cc(/C=C/C(=O)c2nc3ccccc3s2)ccc1OCC(F)(F)F 750902681 MDMYIEZMWCFPIF-SOFGYWHQSA-N 393.386 5.142 30 20 GKED C#CC[C@H](NC(=O)N(CC)Cc1cccc(-c2ccncc2)c1)c1ccccc1 757775410 YOQMJPJHISPPAE-DEOSSOPVSA-N 383.495 5.045 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3ccc(Cl)nc3)cc2)cc1 758737333 QXCZGLOMPBPQIW-QCDXTXTGSA-N 375.815 5.051 30 20 GKED C=CC[C@@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccncc1 766023642 VXZWOUBZUGKBRQ-NTKDMRAZSA-N 398.510 5.276 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc3c(s2)CCCC3)ccc1OC 772984293 CSNVTCIPALOEIV-MAUKXSAKSA-N 384.545 5.167 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 775144523 WCKWFXURXXLRRC-RTWAWAEBSA-N 392.628 5.260 30 20 GKED Cn1nccc1[C@H]1CCCC(=NNc2nc3cc(C(F)(F)F)ccc3s2)C1 790296136 BOHQEJPKNWYOTH-NSHDSACASA-N 393.438 5.174 30 20 GKED CC(C)Cc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)c1 796892396 YHEYWFHVERUNHL-JXFKEZNVSA-N 389.524 5.384 30 20 GKED C=CC[C@@H](OC(=O)[C@H](C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 797552632 GNFZBEAQYCMMMJ-FXAWDEMLSA-N 399.277 5.408 30 20 GKED Cc1cc(Cl)nc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 800519895 XZSBSZMVMZMPPM-FQEVSTJZSA-N 390.874 5.021 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801853533 RXDRZPXOOVIQGB-CQSZACIVSA-N 394.290 5.329 30 20 GKED N#C[C@H](C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 813213805 QBIJMDOFSMJRIE-JSGCOSHPSA-N 390.258 5.006 30 20 GKED C=CCC(C)(C)c1noc([C@H](C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 815706464 KBQPMHKQCPROFI-WBVHZDCISA-N 385.508 5.293 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N4CC[C@](C)(C#N)C4)cc3C2)cc1 822333373 XTUZKPFGEQHVGU-XMMPIXPASA-N 388.515 5.098 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN(Cc2ccccc2)C2CC2)c1=S 887562334 ULDGACIHINYZEJ-UHFFFAOYSA-N 394.519 5.028 30 20 GKED Cc1cc(C#N)cc(C)c1Cc1nc(-c2cccnc2Oc2ccccc2)no1 904457492 HZYRYYQHVZARSO-UHFFFAOYSA-N 382.423 5.003 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2nc3ccccc3s2)cc1 915351872 CUMYFHPRIJBVPY-LJQANCHMSA-N 398.491 5.273 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c(C)c1 916907366 YDMVUTAZOFQPOV-HXUWFJFHSA-N 384.435 5.057 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1 918035979 SDKZOBCWJZNZSP-BJKOFHAPSA-N 399.469 5.850 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc([C@H](C)CC)cc2)cc1 918486993 NTZRSKFSRQLOIV-IERDGZPVSA-N 394.540 5.414 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(C)cc3C)n2)cc1 920143293 OPCVZCXQYLJCEW-HXUWFJFHSA-N 390.508 5.245 30 20 GKED O=C(Nc1ccc(C(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 933112419 TXJWKSHDDZCREF-UWVGGRQHSA-N 390.274 5.219 30 20 GKED CC(CCCCCCC(=O)O)=NNC(=S)Nc1ccc(Cl)cc1Cl 1776015392 BYPZCFPKWJQWSL-UHFFFAOYSA-N 390.336 5.081 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C/C(=O)c3ccccc3Cl)c2)c1 1776114886 FLOHSTPNDIRRMX-VAWYXSNFSA-N 392.838 5.513 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1ccc(SC)cc1)C(=O)O 1776170682 AZUKYDHRJKTBIF-IBGZPJMESA-N 389.492 5.239 30 20 GKED CC(C)(C)c1ccc([C@H](CC(=O)O)NCc2ccc(C(C)(C)C#N)cc2)cc1 1776271944 YHSOTGDXBTYQMB-NRFANRHFSA-N 378.516 5.091 30 20 GKED CCCCCCCCCC[C@@H](C)Nc1nc(C)nc2sc(C(=O)O)c(C)c12 1776785327 VPLPEICLHYMWJI-CQSZACIVSA-N 391.581 6.338 30 20 GKED CCCCCC[C@@](C)(NCc1cccc(OCc2cccc(C#N)c2)c1)C(=O)O 1776804109 PJXRRYWRYNSWFE-XMMPIXPASA-N 394.515 5.041 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(C2CCC2)cc1 1777569316 AKKKJQHNMJATKZ-FMIVXFBMSA-N 388.419 5.514 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)C3CC(=C)C3)cc2)CCC1 1785808583 PKXGEZVNWMRBSY-UHFFFAOYSA-N 380.532 5.079 30 20 GKED Cc1csc([C@@H](C#N)C(=O)CCN2c3ccccc3Sc3ccccc32)n1 41519464 CETNYBJWOKVTSR-HNNXBMFYSA-N 391.521 5.321 30 20 GKED C=C(C)COc1cc(CNCc2c(OC)ccc3ccccc23)ccc1OC 60946774 FJWNGRCHSRSWCX-UHFFFAOYSA-N 377.484 5.102 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1 120825576 ABAAMSZXBKHIJD-QFIPXVFZSA-N 385.467 5.529 30 20 GKED Cc1noc(-c2ccccc2)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 122752647 OSRIWSNYIPCIII-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccc(Cl)cc2C1 123805896 MOVCLFHNIBEKLF-AWEZNQCLSA-N 385.920 5.324 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2sccc2C#N)cc1Cl 128117190 XZRYHBQCKCIQBV-UHFFFAOYSA-N 379.828 5.189 30 20 GKED CCOc1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)c(C(F)(F)F)c1 151719620 DSEZVNMGWOUJCI-UHFFFAOYSA-N 395.274 5.514 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1nc2ccccc2o1 176101347 QJQJROBBDMWXJA-MRXNPFEDSA-N 387.826 5.397 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc3scc(-c4ccccc4)c3c(=O)[nH]2)s1 176402315 YZNCQKUHRHMYSK-NVNXTCNLSA-N 395.896 5.322 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc4ccccc4o3)c2c1 176463584 VOAZFBZMAXUUEK-SFHVURJKSA-N 381.435 5.360 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 187852439 ALVDRKSTMLHPIV-UHFFFAOYSA-N 378.331 5.031 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H]1CCCN(C2CCC2)C1 191435286 JLYZTIDYVIDVLM-ICSRJNTNSA-N 383.580 5.313 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303967500 DIIIIQLQSIFKOA-UHFFFAOYSA-N 378.815 5.265 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)C1 328748985 BKXNIGDDZVDRCM-CTAFRAEOSA-N 397.563 5.628 30 20 GKED CC(C)c1ccc2c(c1)[C@@H](/N=C(/O)C1CCN(C(=O)N3CCCC3)CC1)CCC2 328953499 XZLUZCDSEUUCMA-QFIPXVFZSA-N 397.563 5.072 30 20 GKED CC(C)(C)c1nnc(N=C(O)c2cc(Cl)cc(F)c2Br)s1 330467461 JHBDUNFPZZIDPA-UHFFFAOYSA-N 392.681 5.027 30 20 GKED C[C@@H](CC(F)F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 411974913 AYODGCGFOSWIMY-LBPRGKRZSA-N 378.806 5.020 30 20 GKED CCOc1ccc(OCC)c(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 429953047 YGJOIFGRNJCXDJ-UHFFFAOYSA-N 380.469 5.131 30 20 GKED Cc1ccc(-c2csc3nc(S[C@@H]4CC[C@@H](C#N)C4)n(C)c(=O)c23)cc1C 430094252 JEYFUULLASWAQW-GDBMZVCRSA-N 395.553 5.063 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1-c1cccs1)c1ccccc1 432685744 HQRSIISHZKZCNK-LJQANCHMSA-N 375.497 5.972 30 20 GKED CC(C)[C@@H](Sc1ccccc1C#N)C(=O)Nc1cc(Cl)ccc1Cl 439709228 UXASIIYXBBJFPB-QGZVFWFLSA-N 379.312 5.620 30 20 GKED C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 445637151 RIBTZYAGNJEMLO-SECBINFHSA-N 395.274 5.269 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(OC(F)F)c(F)c1 451331460 NSCMQFYPAGUYBP-UHFFFAOYSA-N 377.406 5.460 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(CCC(F)(F)F)c2)c2ccccc21 469553063 YTOSBXKXZLNONB-UHFFFAOYSA-N 399.416 5.692 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 471909256 YSFBBXIJCUWOFH-INIZCTEOSA-N 382.529 5.353 30 20 GKED O=C(CCCC(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474261269 XYXCUVXYKNPTGI-LLVKDONJSA-N 395.265 5.548 30 20 GKED N#CC[C@H](CC(=O)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1)c1ccccc1 474899532 CQCMQQMHHBPWBC-LJQANCHMSA-N 387.458 5.010 30 20 GKED N#CC[C@@H](CC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1)c1ccccc1 476463980 WISWISPESYZKSG-AZGAKELHSA-N 394.518 5.443 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477523603 BLAHQTZRFFZJMR-HXUWFJFHSA-N 397.522 6.283 30 20 GKED CCN(c1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cn1)C(C)C 478104401 UVSIVBGQCKERJA-OAHLLOKOSA-N 398.919 5.069 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ncc(Cl)s1 478914930 YTZGTXNDYHMFEQ-NSHDSACASA-N 397.978 5.063 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1sc(C)c(C)c1C#N 483073684 MTPXHMGPRBORAV-UHFFFAOYSA-N 385.876 5.360 30 20 GKED C=CCn1cccc1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 488974537 JJMUCRCGTMCVCQ-LJQANCHMSA-N 389.499 5.430 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 490433233 BLXDBIGWKYETTP-KRWDZBQOSA-N 398.413 5.503 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)oc2ccc(F)cc12 499811965 LNOXOLGHEWOYKX-CQSZACIVSA-N 377.202 5.182 30 20 GKED C[C@@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccccc1C(F)(F)F 504012828 KBYMKIBJWKLHJF-INIZCTEOSA-N 398.428 5.387 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CC1 504420710 YNHPCHNEVXZONQ-PKTZIBPZSA-N 387.527 5.183 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2cccnc2C(F)(F)F)n1 512039950 KTXISNLANWJCRU-NSHDSACASA-N 391.246 5.228 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3coc4ccccc34)cc2)c1 512562051 ZXSHHIGVNIDJLH-UHFFFAOYSA-N 383.407 5.418 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2cccc(F)c2)cc1 513846402 NPKTWUGANLYEND-UHFFFAOYSA-N 377.394 5.071 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1c(Cl)cccc1Cl 520159910 MEQBGTURWRUYGB-UHFFFAOYSA-N 390.314 5.233 30 20 GKED N#CC[C@H](CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 526011207 YUWUEJSMWIOJPD-FYYLOGMGSA-N 398.510 5.218 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 530603531 SZHXIAXHRKJJNF-IBGZPJMESA-N 387.405 5.645 30 20 GKED C=C[C@@H](CC(=O)N(CC)[C@@H](c1ccc(C)cc1)c1cccnc1)c1ccccc1 535399047 UVBXYGCRTXFQBI-LVXARBLLSA-N 384.523 5.688 30 20 GKED O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)[C@@H]1CCC[C@H](C(F)(F)F)C1 544061228 FUQFEOKFDHMXPR-VYUIOLGVSA-N 389.286 5.053 30 20 GKED C=CCC[C@H](C(=O)N(C)Cc1ccc(OC(F)F)c(OC)c1)c1ccccc1 547627139 RZVFMCPWFXREHV-SFHVURJKSA-N 389.442 5.005 30 20 GKED CC(C)n1c([C@H]2CCCN2C(=O)c2ccc(C#N)c(Cl)c2)nc2ccccc21 548305884 YVGJMLVJWMWFNB-HXUWFJFHSA-N 392.890 5.120 30 20 GKED COc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2ccc(C)cc2)cc1 556338905 ULPGJDSSXFYVOL-INIZCTEOSA-N 378.501 5.036 30 20 GKED Cc1oc(-c2cccs2)nc1CNc1ccc(Oc2ccnc(C#N)c2)cc1 562232278 KIMBZBRYZIUAQM-UHFFFAOYSA-N 388.452 5.383 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NC2CC(C(F)(F)F)C2)c1 568129483 YBZVAPMLPHIIEH-UHFFFAOYSA-N 394.780 5.075 30 20 GKED Cc1nc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)sc1C(F)(F)F 572664683 OXEWSRLFFREWGK-UHFFFAOYSA-N 396.438 5.032 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1 583268868 DFFBTFFUHQAGHL-LJQANCHMSA-N 393.506 5.238 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(F)ccc2F)nnc1-c1cccc(C)c1 592562389 GWDXCVCLZKIQSK-AWEZNQCLSA-N 399.466 5.081 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1F)CC1CC1 596734321 OZASLLBVXQFMGS-INIZCTEOSA-N 397.519 5.522 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21 599410150 YWKDOIMAIGWXNO-BMZRXHPRSA-N 382.916 5.259 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1csc(-c2cccs2)n1 603968468 WBYYQZKEOAUDNW-UHFFFAOYSA-N 393.518 5.724 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCn3cnc4ccccc43)cc2)cc1 604458710 ZQEYWKDYEOLJPB-UHFFFAOYSA-N 396.450 5.119 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)N[C@H](C)c2ccc(C#N)cc2)cc1 608923836 CKIDBLXNWYXCNP-LJQANCHMSA-N 399.494 5.040 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609378786 SCKACXQPWFRRMY-KBPBESRZSA-N 391.323 5.741 30 20 GKED CC[C@H](C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccccc1 609384855 KCCSECXQICYMHJ-OALUTQOASA-N 395.572 5.320 30 20 GKED CCCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccccc1F 609385322 QVOFSFLDLXVFCS-KRWDZBQOSA-N 399.535 5.071 30 20 GKED Cc1ccc(-c2ncc(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)s2)c(C)c1 609589581 JKHHXWSFUFUCFA-KRWDZBQOSA-N 381.888 5.075 30 20 GKED CC(C)(C#N)c1ccc(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)cc1 614182253 JSWZBDPQBPKDJR-FQEVSTJZSA-N 388.433 5.080 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(C(C)(C)C#N)cc1 614185048 IOLASEMJMHCJCD-MRXNPFEDSA-N 375.541 5.771 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1cc(Br)cc(C(F)(F)F)c1 618742308 MFPIGBPGPDWMJY-QGZVFWFLSA-N 395.222 5.117 30 20 GKED COc1ccc(CN(CCc2ccccn2)Cc2ccc(C(C)(C)C#N)cc2)cc1 619515556 VFLLIAJSADZPTP-UHFFFAOYSA-N 399.538 5.136 30 20 GKED C[C@H](CC(F)(F)F)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494386 MSSIZAUZVLOKKK-SSDOTTSWSA-N 399.228 5.503 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 678451753 PFWGIRRCUVYADS-BEFAXECRSA-N 391.437 5.477 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@H]1C[C@@H](C)CC(C)(C)C1 727627745 QHHBNAKJWWWBJT-MBOZVWFJSA-N 382.548 5.311 30 20 GKED COc1ccccc1/C(C)=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 727628672 VXAGNNUXGCRIMA-KVVHSQDJSA-N 388.492 5.407 30 20 GKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 727955675 MVHJTZOZIAJCCB-VQIMIIECSA-N 379.529 5.855 30 20 GKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1ccc(Br)s1 727972968 NKEQHYMJPZOJSI-RMKNXTFCSA-N 376.300 5.530 30 20 GKED Cc1cc(C(=O)N[C@@H](c2ccccc2)c2ccco2)c(C)n1-c1ccc(C#N)cc1 728311125 ZPBRFMMJNMFVKW-DEOSSOPVSA-N 395.462 5.078 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 728536569 NKMNMQYCIZFHJN-UHFFFAOYSA-N 382.488 5.108 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@@H]2c2ccc(F)c(F)c2)cc1Cl 732928344 HACJKEKURIYZJG-QGZVFWFLSA-N 377.847 5.024 30 20 GKED N#C[C@@H](C(=O)C1CCSCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 733053224 YUVQCDCFRSTAAC-ZDUSSCGKSA-N 397.352 5.436 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2-c2ccccc2)c1 733841705 JDUGVJHGEMWNIJ-HXUWFJFHSA-N 385.467 5.356 30 20 GKED Cc1c(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)oc2ccccc12 734645058 ZYWFLBLWDFUMAU-QFIPXVFZSA-N 395.462 5.718 30 20 GKED C#CCN(C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1)C1CCCCC1 744844982 AWCAZPFSVUWBFL-MRXNPFEDSA-N 381.545 5.157 30 20 GKED C=C1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 746226109 QSSOZRBJCBRLJC-UHFFFAOYSA-N 381.475 5.726 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=C(c3ccccc3)C(F)(F)F)o2)cc1C 751956800 WEIDLKWDSKFHQB-CQSZACIVSA-N 389.377 5.398 30 20 GKED C[C@H](NC(=S)Nc1ccccc1C#N)c1ccc(-c2cccc(C#N)c2)cc1 782204238 KNTWZMTYWGZSQW-INIZCTEOSA-N 382.492 5.145 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)n1 786461853 YEOJNTPNOJISKB-OAHLLOKOSA-N 394.462 5.730 30 20 GKED CC(C)(O)c1cccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 788037609 TZRRFVNUOCOWCU-UHFFFAOYSA-N 387.439 5.222 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(C#N)cc2Cl)cc(Cl)c1OC 788361225 XDYVIOLRYYXGHM-FNORWQNLSA-N 376.239 5.168 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N2CCSCC2)c(C)c1 791805946 HMEKVMYBROSPEC-UHFFFAOYSA-N 395.572 5.158 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792096065 ZGBKUVCXPBMUCM-QAAVPBIRSA-N 381.262 5.821 30 20 GKED N#CC[C@@H](CC(=O)Oc1cc(Br)ccc1Cl)c1ccccc1 796786271 HRDJBWKDTXIBPB-ZDUSSCGKSA-N 378.653 5.095 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566991 WZRGSDLSCPNWME-NVXWUHKLSA-N 384.545 5.516 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)C(=O)c1ccc(Cl)cc1 797568017 NIOFGIBREYHAJS-IUODEOHRSA-N 388.920 5.179 30 20 GKED CC(C)[C@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1 813216217 PAXXWIYFZOPKDA-RDJZCZTQSA-N 380.797 5.370 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(C(C)(C)C2=CCCCC2)no1 818423705 GEPDELGBDDNGAZ-MRXNPFEDSA-N 388.512 5.107 30 20 GKED N#Cc1c(NC(=O)c2cc3sccc3nc2Cl)sc2c1CCCCC2 857568260 SHEAIHIULUTZLG-UHFFFAOYSA-N 387.917 5.404 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc(OC)c1O 914703686 WWICLNPMYGCYDT-KPKJPENVSA-N 384.497 5.340 30 20 GKED COc1ccc(-n2c(C)cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2C)cc1 916848104 BAWSNSFTENCYGQ-QFIPXVFZSA-N 395.462 5.141 30 20 GKED CC(=NOCc1csc(C(C)(C)C)n1)c1nc2ccccc2n1C(F)F 918186185 VJWBXWCGLQFMJT-UHFFFAOYSA-N 378.448 5.126 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)cc1 1776125485 JVTXXDBVNCFYCB-JVCXIRSZSA-N 394.511 5.805 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)cc1 1776125487 JVTXXDBVNCFYCB-QMDZLVRISA-N 394.511 5.805 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)c1 1776341516 WQXJKXSTLYFZPS-YFHOEESVSA-N 390.435 5.445 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 1776473545 PIMPVYZRCXZYKM-BWNDKRECSA-N 398.764 5.107 30 20 GKED CCCOc1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776823697 CQAGCFKCZIWVEI-WDZFZDKYSA-N 376.408 5.330 30 20 GKED CCCn1nc(C)c(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1Cl 1776846363 KOVGFXYEJHEZJE-CMDGGOBGSA-N 398.846 5.109 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3csc(-c4ccccc4)n3)c2c1 1777683955 GWPNSJVECJHEMM-VURMDHGXSA-N 391.473 5.619 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\Cc4c(F)ccc(F)c4C3=O)s2)c1 1777684293 GXRPPTWSEAADLY-UKTHLTGXSA-N 382.387 5.214 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(F)ccc2Oc2ccc(Cl)cc2)c1 1777685040 YWRLHYMUPDNJCS-WMZJFQQLSA-N 396.801 5.866 30 20 GKED C=CCn1c(SCc2c(C)cc(C)c(C(C)=O)c2C)nnc1-c1ccoc1C 36661781 SQHZGFARMOYTBQ-UHFFFAOYSA-N 395.528 5.453 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(-c3nc4ccccc4s3)s2)n1 41519754 ZGIBMBJYYHBKGY-LLVKDONJSA-N 381.507 5.280 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 47052231 WTDDSRRFYGNTEU-QWHCGFSZSA-N 376.287 5.329 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 47565579 JXCKPADUVHZGEE-LJQANCHMSA-N 395.915 5.721 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1C2CC3CC(C2)CC1C3 49723911 HARUFXWHJUIVDE-UHFFFAOYSA-N 387.483 5.065 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)N(CCOC)Cc1ccc(C#N)cc1 58415169 FCMOEMOICJYZLR-UHFFFAOYSA-N 399.922 5.017 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 109028927 HLBBBECAZROROV-HNAYVOBHSA-N 399.947 6.103 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(Cl)ccc1C 123181514 BNYOZHJFZCDMKL-UHFFFAOYSA-N 377.831 5.268 30 20 GKED Cc1ccc(OCc2nc(CN[C@H](CCC#N)c3ccccc3)cs2)cc1 130414620 ZVVSDHKKNSHDJV-OAQYLSRUSA-N 377.513 5.165 30 20 GKED Cc1cccc(C)c1/N=C1/NC(=O)/C(=C/c2cccc(-c3ccccn3)c2)S1 158306619 XUSFFSOELOJBEE-ZHZULCJRSA-N 385.492 5.257 30 20 GKED CCc1onc(C)c1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 158377769 OSFKICQGZIMYMY-UHFFFAOYSA-N 376.416 5.162 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Nc2cccc3[nH]ccc23)cc1 172216528 CBHNPYCVYKTMBG-UHFFFAOYSA-N 396.450 5.457 30 20 GKED CC[C@](C)(NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1nc(C)cs1 173116826 NLKNFZQMZBUWLQ-DJJJIMSYSA-N 388.562 5.150 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)Nc1ccc(CC#N)cc1 175049179 VMEHFZBRRNCQQE-CYBMUJFWSA-N 381.888 5.074 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1c(C)nn(-c2ccccc2)c1C)c1ccc(F)c(F)c1 185506775 MNAYYCUFWRYSMK-HXUWFJFHSA-N 396.441 5.206 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1cc(F)cc(F)c1 187542815 UATWHQHMDVMBIZ-ZDUSSCGKSA-N 392.496 5.231 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2SCCCS2)cc1 189892851 LNVXUJNQILCUKB-UHFFFAOYSA-N 397.609 6.660 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@@H](c2ccc(F)cc2)C1 191461572 SOAXCQPZJGCTAJ-HTAPYJJXSA-N 396.506 5.672 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(Cl)c1C 195350448 CPOYIJVMKKZRQG-UHFFFAOYSA-N 377.831 5.268 30 20 GKED N#Cc1cccc(COc2cccc(CNc3cccc(OC(F)F)c3)c2)c1 195658822 FAQNXFFHDYLRGJ-UHFFFAOYSA-N 380.394 5.351 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccccc2C)cs1)c1ccc(F)cc1F 255629808 QISXPCSHOLEZRB-NTMALXAHSA-N 398.434 5.310 30 20 GKED OC(=Nc1ccc2oc(C3CC3)nc2c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 328754915 SNRIHGBYWFKOPM-INIZCTEOSA-N 393.409 5.305 30 20 GKED Cc1ccc(C(=O)Nc2sc(C)c(C)c2C#N)c(Sc2ccccc2)n1 428384071 NQPJMOKKNXRCOD-UHFFFAOYSA-N 379.510 5.344 30 20 GKED Cc1ccnc2[nH]c([C@H](C#N)C(=O)c3ccc(CSc4ccccc4)cc3)nc12 429597785 MGVVXMVLPIMANT-LJQANCHMSA-N 398.491 5.049 30 20 GKED N#CCCC[C@H](NS(=O)(=O)c1ccccc1-c1ccccc1)c1ccccc1 431644715 LFCLAQXZWHBHGR-QFIPXVFZSA-N 390.508 5.067 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)N[C@@H]1CCCC(F)(F)C1 433225411 BKLKTNOJJAWLTG-SECBINFHSA-N 388.283 5.006 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(C#N)c2)CC1)c1cccc(OCc2ccccc2)c1 434024652 IYIYZDMEKRBCKL-LJQANCHMSA-N 396.490 5.046 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CC[C@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 437763017 VZBZHFXERVHDGA-LIRRHRJNSA-N 387.405 5.501 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)N[C@@H](c1ccc(F)cc1)C(F)(F)F 438566365 IOHIQSJNPNLTEC-AWEZNQCLSA-N 394.290 5.356 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)CCCOCc1ccccc1 439519046 TWMOOURJAUJVFT-SFHVURJKSA-N 397.544 5.151 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)Nc3ccccc3)cc2)c(OC(F)F)c1 439545027 CSORSFFWIIZXAE-UHFFFAOYSA-N 393.393 5.024 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)c1ccc(C#N)cc1 439922669 LSGMTKXQVHWDDD-UHFFFAOYSA-N 388.279 5.265 30 20 GKED O=[S@](Cc1cccc(NCC#Cc2cccc(Cl)c2)c1)c1ccccc1 442083597 FLQQFDWRJRRJBX-AREMUKBSSA-N 379.912 5.111 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)o2)cc1 442671156 FYQZQOIMCKOCBP-QGZVFWFLSA-N 384.435 5.875 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc(-c2ccccc2)cs1 447173341 DUJVOAKSEHVHRP-HNNXBMFYSA-N 390.361 5.458 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C 448415723 NJRUURQMTFGHSW-UHFFFAOYSA-N 389.459 5.300 30 20 GKED Cc1ccccc1C1CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 458802957 QEPJAYFMOQUERW-QHCPKHFHSA-N 375.516 5.319 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458853572 WRNIYUSSOZZHMG-YADHBBJMSA-N 379.504 5.223 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(C)[C@H](C)c1ccc(Cl)cc1Cl 460376180 RWPCSPPYJYPVOB-CXAGYDPISA-N 395.334 5.210 30 20 GKED Cc1c(C(=O)Nc2ccccc2CC(F)(F)F)ccc(C(F)(F)F)c1F 468023972 GJNKGAVAMWFFOM-UHFFFAOYSA-N 379.275 5.510 30 20 GKED Cc1c(COC(C)(C)C)cccc1N[C@@H](C)C(=O)N(CCC#N)c1ccccc1 474926190 KSIDSFHTSWCHMC-IBGZPJMESA-N 393.531 5.057 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OC(C)C)c(OC)c1 481514937 CAICQYNUYPIPHO-UHFFFAOYSA-N 394.924 5.417 30 20 GKED O=C(NCc1ccc(C(F)F)cc1)N[C@H](c1c(F)cccc1F)C(F)(F)F 482442730 XLZLVHZBCRUGQN-CQSZACIVSA-N 394.290 5.005 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@]1(C)CCCO)c1ccc(C(F)(F)F)cc1 483190946 DBKDBSAJLHNJMD-AZUAARDMSA-N 398.469 5.049 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)cs2)cc1 483195643 IMFMURQTPAMSAN-KRWDZBQOSA-N 398.491 5.367 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cnn(CCCC)c1C(C)C 485161604 RVWDNRIZVMTHED-UHFFFAOYSA-N 384.524 5.035 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C(F)(F)F)cc1Br 488896955 HEUAVZXQTAVPBR-LLVKDONJSA-N 377.204 5.040 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 494749529 QSADWJUGAJIYBJ-UHFFFAOYSA-N 396.450 5.496 30 20 GKED N#Cc1ccsc1C(=O)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 501773415 SUPIYICCCFRAAQ-UHFFFAOYSA-N 393.468 5.216 30 20 GKED C[C@@H](CC1CCCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 510086108 NYJYBKHZFZNTEC-SFHVURJKSA-N 376.500 5.487 30 20 GKED COc1ccc(CN(C2CC2)[C@@H]2CCc3ccccc32)cc1OCCCC#N 510660832 HXVSYHQQSHXJRA-JOCHJYFZSA-N 376.500 5.030 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(C1CC1)[C@@H](C)c1ccccc1 512270109 NOLZUQNKWDZMME-ROUUACIJSA-N 393.556 5.245 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4sccc4s3)n2)cc1 516714089 OYKCUMKMWRTGAH-ZDUSSCGKSA-N 396.518 5.585 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 520178752 XTAHNPOKGJWOJY-ZDUSSCGKSA-N 391.393 5.201 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@@H](C)c1ccc(F)cc1 520324860 PWNPNEOANFPRBC-INIZCTEOSA-N 389.430 5.108 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)NC[C@@H](C)c1ccccc1 521012608 OWQZNARDGUSEJI-MOPGFXCFSA-N 399.494 5.071 30 20 GKED COc1cc(CSc2ccc(O)cc2)ccc1OCc1cccc(C#N)c1 522624794 RJMVPDWCBMGGSC-UHFFFAOYSA-N 377.465 5.144 30 20 GKED CCOc1ccccc1N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 534392952 DHMNCOKMZQBGCE-UHFFFAOYSA-N 386.451 5.220 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@@H]1CCCO1 534480796 SPWOLUAPSJUAIJ-GIVPXCGWSA-N 397.906 5.075 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(C(C)C)cc2)cc1 536281754 XZQGTKACIBHNAY-JOCHJYFZSA-N 391.515 5.095 30 20 GKED C=C(C)Cn1c(Sc2cc(C(C)C)nc(C(C)C)n2)nnc1-c1ccncc1 536385616 INUPXLVNUUFJCZ-UHFFFAOYSA-N 394.548 5.104 30 20 GKED COc1cc([C@@H](C)NCc2ccccc2C(C)(C)C#N)ccc1OC1CCCC1 538151097 OEDQHMUEMCXVMC-GOSISDBHSA-N 392.543 5.669 30 20 GKED C[C@@H](NC(=O)C[C@@H]1OCCc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 542927626 KXFIRQVXGHOCMP-CJAUYULYSA-N 396.490 5.107 30 20 GKED Cc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cnn1-c1ccc(F)cc1 550827910 SDBGPBCXPAUIBA-HXOBKFHXSA-N 376.479 5.406 30 20 GKED COCc1ccc([C@@H]2CCCN2c2c(C#N)cnc3c(Cl)cc(C)cc23)o1 558785566 RRNKHYVAAFGJHW-SFHVURJKSA-N 381.863 5.149 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(CCC#N)CC1)c1ccc(C(F)(F)F)cc1 565889619 JZPRKXNNPXXBBI-IBGZPJMESA-N 393.453 5.438 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C#N)c1cccc(C(F)(F)F)c1 588204458 BRAPOCVRLWQRHN-LLVKDONJSA-N 383.211 5.190 30 20 GKED N#CCCCCCC(=O)NC1(c2noc(C3CCCCC3)n2)CCCCCC1 588949660 OMDYFYDSWUIGFO-UHFFFAOYSA-N 386.540 5.257 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 603691159 DAZURAZXPXFPIJ-FDDCHVKYSA-N 390.487 5.178 30 20 GKED Cc1occc1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604316386 DSXBNXZJGXOSOZ-UHFFFAOYSA-N 381.819 5.227 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2(c3ccccc3)CC2)cc1 608840918 GKJAZKKOYPGOKQ-UHFFFAOYSA-N 397.478 5.142 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NC1CCC(c2ccccc2)CC1 608918221 BAEFYDGDBQRNFH-UHFFFAOYSA-N 375.516 5.205 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCc2nc3cc(Cl)ccc3s2)cc1 609326626 ALKOWASBAIKCMX-UHFFFAOYSA-N 383.904 5.322 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCOc1ccc2ccccc2c1 609377471 VXWOWMIJWLSCNQ-QGZVFWFLSA-N 390.508 5.499 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 609816333 HTDGTHDBTVYTRS-AWEZNQCLSA-N 390.314 5.546 30 20 GKED C[C@H](NC(=O)NCC[C@@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 610431967 KJRXEHKAJIJHAH-CABCVRRESA-N 389.421 5.131 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2c(cnn2C(C)C)c1 681408321 MCCDXGVZVCXSFH-UHFFFAOYSA-N 388.924 5.552 30 20 GKED COc1ccccc1/C(C)=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727304362 ALLUTJLKBHRCRS-NGIFANIDSA-N 382.463 5.393 30 20 GKED N#CCOc1cccc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)c1 730151945 VCUDFULNILFYED-SILNSSARSA-N 396.471 5.622 30 20 GKED COc1ccc(CCCCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730422435 XVLLDYGRPKJDEL-SFHVURJKSA-N 396.487 5.423 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(Cl)cc2)o1)c1ccc(C(F)(F)F)nc1O 731564971 WSHNDPOEILUOJN-YVMONPNESA-N 393.748 5.616 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)ccc1N(C)C 731971709 NHGHJNJHBJBJCU-UHFFFAOYSA-N 385.467 5.172 30 20 GKED C#CC[C@@H](OC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccccn1 733692882 ZYWOUMVXEVPVSU-CYBMUJFWSA-N 376.264 5.525 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2oc3c(ccc4ccccc43)c2C)c1 733773197 UZDGGYRIFZMAOH-LJQANCHMSA-N 398.462 5.505 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2CC2CCCCC2)c1 733805319 QUANZHOKVMCGPC-LEWJYISDSA-N 383.536 5.012 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(-c2ccccc2)cc1)c1nc(-c2ccncc2)cs1 734081360 JRLPGDAGCFJXMW-NRFANRHFSA-N 395.487 5.291 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccc(OCC(F)(F)F)cc3)c2c1 734307392 OKAQZGCIKSLTMJ-WTKPLQERSA-N 375.346 5.014 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 734679388 LRYSXRQFGMDZNH-SCLBCKFNSA-N 378.303 5.408 30 20 GKED O=C(/C=C/c1cn(Cc2ccccc2)nc1-c1cccs1)c1cncc(F)c1 737444408 REZGAYOCANHQAN-CMDGGOBGSA-N 389.455 5.090 30 20 GKED C[C@@H]1/C(=C\c2cnc(-c3ccccc3)nc2)C(=O)c2cccc(Br)c21 742435104 QCLDEURUWCXKEE-VGSSETLESA-N 391.268 5.290 30 20 GKED Cc1ccc(N(Cc2nnc(-c3cccc(C#N)c3)o2)Cc2cccs2)cc1 744396535 IMZHOKHJWPIHJK-UHFFFAOYSA-N 386.480 5.185 30 20 GKED CCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)[C@@H](CC)c1ccccc1 746144531 APYTXYJYJABLGA-UNMCSNQZSA-N 398.510 5.087 30 20 GKED CN(Cc1cc2ccccc2o1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746718137 NEYQKALGRCEKJJ-QHCPKHFHSA-N 395.462 5.752 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2ccccc2OCc2ccccn2)cc1 751517983 QMYZMBYEBLCFRL-KAMYIIQDSA-N 395.462 5.051 30 20 GKED CC(=NNc1nc(O)c2ccccc2n1)c1ccc(-c2ccccc2F)s1 757582696 FVBYESXWPYFYMM-UHFFFAOYSA-N 378.432 5.039 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 761673293 FNZLARBXTNDVBH-HXUWFJFHSA-N 395.478 5.395 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@H](C)c2ccc(F)c(F)c2)c1C(F)F 764347833 WACDUJYZJDLGMO-SSDOTTSWSA-N 398.278 5.056 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3c(C)cc(Cl)cc32)c1 772984554 OJGOJHFDOBWSAJ-WIYYLYMNSA-N 384.907 5.333 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c(F)c1 781108917 VFQDCVJNGCHTDU-XVNBXDOJSA-N 396.761 5.415 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CC=C(c2cccc3ccccc23)C1 782612026 HJNRYNPFYCTBFO-QGZVFWFLSA-N 383.451 5.062 30 20 GKED CC[C@@H](NC(=O)[C@H](C#N)C(=O)c1sc2ccccc2c1Cl)c1ccccc1 787034154 ZOFYNBZPHBNDMH-HZPDHXFCSA-N 396.899 5.145 30 20 GKED C#CCC1(C(=O)Nc2cccc(C[S@@](=O)Cc3ccccc3)c2)CCCCC1 788223462 MKBSHXKZBYSFLR-NDEPHWFRSA-N 393.552 5.048 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1ccccc1NC(=O)OC(C)(C)C 791863085 DBPIGCGBISNWDF-UHFFFAOYSA-N 394.515 5.181 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792092885 FFPOZMFJJDAGJJ-KWRJMZDGSA-N 380.369 5.533 30 20 GKED N#C[C@H](C(=O)CN(Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 792103303 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914176886 SHHFXFSFWHNDKC-UHFFFAOYSA-N 397.550 5.400 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N(Cc1ccco1)C12CC3CC(CC(C3)C1)C2 914478385 KVLMNBUZFJYQGE-BQYQJAHWSA-N 386.495 5.162 30 20 GKED Cc1ncsc1C(=O)/C=C\c1cccc(/C=C\C(=O)c2scnc2C)c1 915054124 JLHPEOMQIAFLAN-VRHVFUOLSA-N 380.494 5.009 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccc(F)cc3s2)cc1 915179474 FVRUMYCIIFJMKC-FQEVSTJZSA-N 386.451 5.948 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 915293984 VXIKSAPOUQAUBQ-LJQANCHMSA-N 375.497 5.312 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1 916877013 WOESFNMNUMSWEF-UHFFFAOYSA-N 399.446 5.192 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3ccccc3s2)cc1 916955126 MTRGWQHQBZKYLZ-KSSFIOAISA-N 376.481 5.376 30 20 GKED C[C@H](Oc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047471 YBNSKJVIMCONOX-JQWIXIFHSA-N 391.279 5.247 30 20 GKED COc1cc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)ccc1OC(F)F 920068179 KXPOSFVRWBRXEU-KXFIGUGUSA-N 377.774 5.327 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 920080513 YWXZLNYMZOVOGA-SFHVURJKSA-N 383.929 5.349 30 20 GKED C/C(=C/C(=O)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 921279321 SMQAGGDSZIPGPN-RXCTWCCOSA-N 397.334 5.255 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1cccnc1SC(F)(F)F 921292639 INVQFVRZVSDFGD-UHFFFAOYSA-N 384.276 5.104 30 20 GKED CCCOc1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)c(OCCC)c1 1776033170 HQBWDINHXWXHBS-UHFFFAOYSA-N 390.867 5.062 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)[C@H](C)Oc1ccc(Cl)cc1Cl 1776074404 YKGFOXKTGDVZMR-JTQLQIEISA-N 385.222 5.086 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(F)cc3Cl)cc2)c1 1776106715 RIXIUJMMOBBLKV-UHFFFAOYSA-N 382.822 5.219 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(NC(=O)OC(C)(C)C)c1 1776783786 JLOVANPSCJUVDL-GOSISDBHSA-N 392.540 5.327 30 20 GKED CCCCCCCOc1cccc(CNCc2cc(C(=O)O)sc2Cl)c1 1776787711 YCZCSYYEWJPFCD-UHFFFAOYSA-N 395.952 5.739 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)ccc1SC(F)F 1777263356 ITPBBYFFPWJTSD-TVBMFEEWSA-N 390.407 5.004 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3nc(-c4ccccc4)cs3)c2c1 1777683953 GQUFHXPGGIRHRI-VURMDHGXSA-N 391.473 5.619 30 20 GKED COc1cc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)ccc1OCC#N 7716431 WQXTZVMHOPHVNB-RMKNXTFCSA-N 383.403 5.393 30 20 GKED CC(C)c1ccc(CN(CC(=O)Nc2ccccc2SCC#N)C2CC2)cc1 7797847 QUNKBBOHAOCJEZ-UHFFFAOYSA-N 393.556 5.029 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)cs2)cc1 41502477 QQHCVOAPHHSSCL-CQSZACIVSA-N 375.478 5.218 30 20 GKED N#C[C@H](C(=O)COc1cc(Cl)c(Cl)cc1Cl)c1nc2ccccc2o1 41545142 FFWWJJPJSJTMNZ-SECBINFHSA-N 395.629 5.043 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(Cl)cc2Cl)cc1OCCCC#N 64613493 FAKGEVZSTIVKSH-AWEZNQCLSA-N 393.314 5.535 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C#N)c(Cl)c3)s2)cc1 71879009 MIJUATDQKJOSNS-UHFFFAOYSA-N 397.887 5.295 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 103674273 FFOANPMUTHPJBX-XLIONFOSSA-N 385.492 5.442 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Oc1cccnc1 108237274 AHBSOHQFBMDILO-MRXNPFEDSA-N 389.480 5.378 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 108241993 IBGWRVZNDGDGTF-SNVBAGLBSA-N 397.422 5.058 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)ccc1OC 113308868 OXECDSILXZYQNE-KSSFIOAISA-N 392.421 5.246 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(F)cc1)CC1CC1 115769769 DDPJOAWJSLZIID-INIZCTEOSA-N 397.519 5.664 30 20 GKED N#CC1CCN(C(=O)c2cc(Cl)ccc2Oc2cccc(Cl)c2)CC1 126371342 GQUNEPKEBGIOKU-UHFFFAOYSA-N 375.255 5.161 30 20 GKED CC(=O)N(c1nc(COc2cccc(F)c2C#N)cs1)c1ccc(C)cc1C 132060078 FPRQDPLVPJPCLC-UHFFFAOYSA-N 395.459 5.034 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)o1 133848497 JLQQEAOFNWGFJF-CYBMUJFWSA-N 384.892 5.396 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 137457191 ONSNEKRVFVJPKQ-GHTZIAJQSA-N 393.556 6.067 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1C1CC1 157881100 PBBLNQQXAOEXSX-ZBEGNZNMSA-N 391.302 5.033 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1nc(Cc2ccccc2)no1 173777289 YYDDJPUKFGGKCQ-HZPDHXFCSA-N 378.501 5.085 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(Cl)cc2Cl)ccc1OC 174091851 HOKKKDVXXIXEQM-CJNGLKHVSA-N 393.314 5.534 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccn(-c2c(F)cccc2F)n1 180589888 JFULSFLQWHZAPC-AWEZNQCLSA-N 384.455 5.157 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 181570565 UPSWLNLGVDXRGM-ZEYPLWLESA-N 396.506 5.469 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 184578354 SFNJNEXNNMDBQU-VGOFRKELSA-N 398.466 5.361 30 20 GKED Cc1ccc(C)c(OC2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2)c1 193636586 QSJRCINDJZKEHC-UHFFFAOYSA-N 391.515 5.180 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 237797664 CXXIKJGHLIEYOC-QFIPXVFZSA-N 396.943 5.963 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)CCCC1(C#N)CCOCC1 282001826 NPTBKWGQXOUHLV-GOSISDBHSA-N 383.561 5.212 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)CSc1ccc(C#N)cc1 303239729 ITYGCOMSDSJADG-UHFFFAOYSA-N 376.934 5.443 30 20 GKED CC(C)n1nccc1[C@@H]1OCCC[C@H]1/C(O)=N/[C@@H]1CCC[C@H]1c1ccccc1 329060386 UORBZMPIKAHYSC-GPQLQYNLSA-N 381.520 5.225 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2ncc(C3CCCCC3)s2)no1 329363010 DBAIAXUBOXYFIX-OAHLLOKOSA-N 389.525 5.045 30 20 GKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(F)cc1Cl 330005658 DJIVMQRYLYNGKJ-UHFFFAOYSA-N 394.918 5.639 30 20 GKED OC1=Nc2ccccc2O[C@H]1C/C(O)=N/[C@@H]1CC2(CCCC2)Oc2ccccc21 330165157 WQZBLRMBXSYZCR-XLIONFOSSA-N 392.455 5.219 30 20 GKED C=CCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 424594533 QORGKNVBIRBFJT-FQEVSTJZSA-N 394.902 5.307 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(c2ncccc2Cl)CC1 428660945 FOUDSPLRLLXOIM-UHFFFAOYSA-N 383.282 5.192 30 20 GKED N#CCCn1cc(/C=C\c2ccc3cc([N+](=O)[O-])ccc3n2)c(-c2ccccc2)n1 432707443 DGZHDSUPAQINKI-NTMALXAHSA-N 395.422 5.091 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCN(c2ccccc2)C1 433859687 UPUNIUCDPKBRLH-FQEVSTJZSA-N 391.559 5.577 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(N2CCCCCC2)c1)c1ccccc1 439393085 BUQHOJDTQYRVGB-QFIPXVFZSA-N 376.504 5.234 30 20 GKED C[C@@H]1COCC[C@H]1c1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 442693058 YKOCKMDMRKJNDJ-CZUORRHYSA-N 395.846 5.194 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2cn(CCCC#N)c3ccccc23)s1 444224652 UUYDANRBXUOFCA-FQEVSTJZSA-N 377.513 5.292 30 20 GKED CC[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(C#N)cc1 447603912 ZINJZTJGNJXTLH-QFIPXVFZSA-N 376.504 5.529 30 20 GKED CC1(C#N)CCC(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)CC1 449148303 JTBBOONEBKVLFE-UHFFFAOYSA-N 389.421 5.455 30 20 GKED Cn1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C2CCCCC2)n1 455718849 LTYJKVJDHPAIRH-LJQANCHMSA-N 379.508 5.024 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](C)c1cccc(C#N)c1 463072096 YOKLRQCOBQFXNB-CYBMUJFWSA-N 376.378 5.108 30 20 GKED Cc1occc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464298544 SOQHGYVRLHLLOK-UHFFFAOYSA-N 386.329 5.523 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc(C(F)(F)F)c1F 467999031 VVDJBZQWWGGNMR-LLVKDONJSA-N 396.409 5.800 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1ccc(C)c(NC(=O)c2ccco2)c1 470644594 PFALYVICCRWSMN-UHFFFAOYSA-N 388.467 5.059 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(=O)N(c2ccccc2CC)C1 476121440 NJYOHLLJSHUXDN-HXUWFJFHSA-N 390.527 5.093 30 20 GKED CCS[C@@H]1CCCCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 480361774 DAJNXBAJOGFXAP-OAQYLSRUSA-N 380.513 5.098 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 483088849 OERQPFPOSVJPFQ-RXVVDRJESA-N 393.487 5.066 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1nccc2ccccc12 483212490 RLJPTWKXZQVOLL-INIZCTEOSA-N 389.867 5.502 30 20 GKED N#CCCC[C@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccccc1 487264516 GJCZBRWUAITWJN-INIZCTEOSA-N 386.282 5.640 30 20 GKED N#CCCCn1cc(C(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)c2ccccc21 495443219 BHOAARNOSSVEIN-QHCPKHFHSA-N 383.495 5.312 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cc2ccccc2s1 504694988 LSSXEAZJWNOQSS-INIZCTEOSA-N 387.508 5.333 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 505921718 AOVZWOXEROYXKZ-WDMOLILDSA-N 379.209 5.043 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)c1 506760319 URXRROMXXRLEFW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CC1(c2ccccc2)CCC(NCCCCOCCc2ccccc2)CC1 507653049 JYFYMHHDLORDGQ-UHFFFAOYSA-N 376.544 5.020 30 20 GKED COc1c(Cl)cccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513507835 RHLWQTOJMBRRPV-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CCCNc1ccc(C(F)(F)F)cc1NC(=O)c1cc(C#N)ccc1Cl 515624159 FGWISKHEWDIDRL-UHFFFAOYSA-N 381.785 5.305 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2ccc(C#N)cc2)c(-c2ccccc2Cl)n1 517449526 WZRHLUPCYJDHAH-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C=CC1CCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)CC1 518438683 NQHVIYWIHULYDL-UHFFFAOYSA-N 376.475 5.331 30 20 GKED COc1cc(Cl)ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 520077069 VKAUXAYERNKYLA-INIZCTEOSA-N 382.872 5.271 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 521260021 TWUORLHGFNKVCI-IEBWSBKVSA-N 381.545 5.500 30 20 GKED C=CCOc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 521264114 WVISHWPKZXIBHK-CQSZACIVSA-N 396.418 5.143 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 522781453 BCPBOVASHILWMO-UHFFFAOYSA-N 388.471 5.217 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1ccccc1Cl 524119846 LUBWHSYMWVPMBC-UHFFFAOYSA-N 391.858 5.743 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2)n1 525327587 XCDQJVBZNNYLMA-OAHLLOKOSA-N 375.478 5.218 30 20 GKED C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1cc2ccccc2s1 527197839 RJXPYIAUYNKYNM-QGZVFWFLSA-N 375.541 5.088 30 20 GKED Cn1c(C2CC2)nc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc21 534076409 PVAUQUDBIAYMEG-UHFFFAOYSA-N 392.462 5.242 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)cs1 538499826 OQLVPDKTMJNZHW-HNNXBMFYSA-N 387.508 5.165 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 540227441 CJKUNBOTLCIHLQ-MRXNPFEDSA-N 386.455 5.191 30 20 GKED COC[C@H](C#N)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 542189273 HTTUPRPQNIDOPB-JTHBVZDNSA-N 395.506 5.095 30 20 GKED N#CCCC[C@H](NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccccc1 552084053 LDCHDVSBRUCVFH-NRFANRHFSA-N 398.432 5.416 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)nc1 555058193 CISKOAITEXAORA-CYBMUJFWSA-N 383.423 5.097 30 20 GKED Cc1cc(C#N)cnc1C(=O)N(Cc1ccc(-c2ccccc2F)s1)C(C)C 555457995 YLWGFLVGWKTRKL-UHFFFAOYSA-N 393.487 5.180 30 20 GKED Cc1ccc([C@H]2OCCC[C@@H]2NC(=O)c2sc3ccc(C#N)cc3c2C)cc1 560135012 KCZHQTCGFPJDPP-PZJWPPBQSA-N 390.508 5.040 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 585755053 DSKCBYILJZDIFR-NRFANRHFSA-N 388.433 5.143 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 586783728 MNMUFJCMWBGJAY-AOOOYVTPSA-N 390.274 5.219 30 20 GKED N#CC[C@@H](Cc1nc(CCCOc2cccc3ccccc23)no1)c1ccccc1 589120956 NTSFZERLNFEEJT-NRFANRHFSA-N 397.478 5.474 30 20 GKED N#C[C@H](C(=O)c1ccccc1Cc1ccccc1)c1nc2cc(F)ccc2s1 592974191 OUXNOVWNKQOZJG-LJQANCHMSA-N 386.451 5.516 30 20 GKED N#Cc1c(NC(=O)c2cccc3cccnc23)sc2c1-c1ccccc1CC2 603992394 VLGOCHSKYRIRTE-UHFFFAOYSA-N 381.460 5.186 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)COCc3ccccc3)cc2Cl)cc1 604026651 FHIVYFBKUNRNGK-UHFFFAOYSA-N 392.842 5.159 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 607434112 YJYWZKWXNMXERC-MRXNPFEDSA-N 396.512 5.984 30 20 GKED Cc1cccc(Oc2ccccc2NC(=O)c2cc3ccccc3n2CC#N)c1 609159391 CDRUZBZOLDBZRP-UHFFFAOYSA-N 381.435 5.518 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)NCc3ccc(C#N)cc3F)c2)C1 609252236 HNIIKRULGDQCOB-IIBYNOLFSA-N 395.478 5.114 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196204 RVCLQCKJBTYDOI-CYBMUJFWSA-N 393.339 5.517 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)c2)c1 610324778 NXVUMWKCRBEVOI-SFHVURJKSA-N 385.467 5.328 30 20 GKED O=C(c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1[C@H]2CCC[C@H]1CC2 612076136 TZQWUHOFFBBILG-STQMWFEESA-N 383.307 5.133 30 20 GKED CC(C)(CC(=O)N[C@@H](c1c[nH]c2cccc(F)c12)C(F)(F)F)C(F)(F)F 648582467 ZHCZUTMCROHQIF-ZDUSSCGKSA-N 384.295 5.005 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(C(F)F)nc1)c1ccc(C(F)(F)F)cc1 657929990 HUIZVVCPQINGOQ-SUMWQHHRSA-N 384.392 6.396 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2F)c2ccccc2)cc1Cl 726485222 WHCHWCLSQWXYPP-UHFFFAOYSA-N 395.890 5.754 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(O[C@@H](C)c3ccccc3)nc2)cc1 726940697 PCZALPQEKZQHRF-IBGZPJMESA-N 385.467 5.091 30 20 GKED Cc1cccc2c1CC[C@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 729553419 PNTVMVLYRTXMKW-BJKOFHAPSA-N 381.479 5.460 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 731287425 BGKSGRIGSVTQGS-BHIFYINESA-N 392.458 5.325 30 20 GKED Cc1ccc(CN2C(=O)c3ccccc3N[C@H]2c2ccc(O[C@H](C)C#N)cc2)cc1 731298542 KDOHDXJJZMPLQF-HOYKHHGWSA-N 397.478 5.053 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C/c1csc(-c3cccc([N+](=O)[O-])c3)n1)CCO2 733083655 OHLHTBFIBNWYIE-GXDHUFHOSA-N 392.436 5.076 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 734966271 XCROHYMPEVBBPX-SCLBCKFNSA-N 398.890 5.973 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)ccc1OC(F)F 734979309 BPLCANQWSMETOP-WAPJZHGLSA-N 386.366 5.507 30 20 GKED C[C@H](OC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccc(C#N)cc1 735675183 COKJNICIXFKTOM-INIZCTEOSA-N 379.419 5.086 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 742537425 JRTRVKMOAOXTJP-HNAYVOBHSA-N 391.496 5.148 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCCCc1ccc(C)cc1 746417246 UNGVYXWIIXGZQD-JOCHJYFZSA-N 390.527 5.180 30 20 GKED COc1ccc(/C=C/C(=O)c2c[nH]c3ncccc23)cc1OCc1ccccc1 761811000 BBBROSWSTGXNRM-PKNBQFBNSA-N 384.435 5.047 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCc3cc(F)ccc3C2)cc1 768868599 NABWRRYAUICPDV-HSZRJFAPSA-N 385.442 5.071 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCc2sccc21)c1nc(-c2ccc(Cl)cc2)cs1 771577233 CSUHXSYQTAOBQQ-JKSUJKDBSA-N 398.940 5.821 30 20 GKED N#CCOc1cc(F)ccc1NCc1ccc(OCc2cccc(F)c2)cc1 779609719 UVYBWNCVYPNVRG-UHFFFAOYSA-N 380.394 5.058 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(C#N)cc2F)cc(C)c1OCc1ccccn1 781108358 PNKQKPULRVHXPQ-CLFYSBASSA-N 386.426 5.184 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2csc(COc3ccc(Cl)cc3)n2)c(F)c1 781111690 QAFMFZMEQLCSRL-XBXARRHUSA-N 398.846 5.282 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792093974 BSZMZHNNYFVRMD-IFXJQAMLSA-N 382.385 5.624 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(-c3ccccc3)o2)cn1 792883815 HGHZHMNIDKPNDA-QXMHVHEDSA-N 382.419 5.308 30 20 GKED N#Cc1sc(Oc2ccc3c(-c4ccccc4)cc(=O)oc3c2)nc1Cl 804322793 MRENWVDGBKQWKS-UHFFFAOYSA-N 380.812 5.234 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 806200963 QKJIFYVTXJNSGL-BTZRARBUSA-N 395.506 5.957 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1cc(C(F)(F)F)ccn1 813211645 NTTDOGNJXRXWJA-KFWWJZLASA-N 399.199 5.387 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 814311680 IGFXBTIRLSTMCR-SFTDATJTSA-N 389.499 5.167 30 20 GKED C=CCC[C@@H](NC(=O)c1conc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 830889582 IXTDGGXAQXZPPP-CYBMUJFWSA-N 392.299 5.150 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(NC(=O)OC(C)(C)C)c2C)cc1 862721788 LAZPYPORFPGNJY-UHFFFAOYSA-N 382.460 5.159 30 20 GKED C=C[C@@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 909531085 VFSKIJHJHDZPPG-KRWDZBQOSA-N 386.517 5.090 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C\Sc1ccccc1 915860313 RICKFQOBZSPGOP-QBFSEMIESA-N 387.464 5.299 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)/C=C\c1ccc2ccc(Cl)cc2n1 917828885 WETQZFCMDOPJDA-RAXLEYEMSA-N 392.886 5.125 30 20 GKED CCc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 920804065 JZCXLLOSAYEGAE-INIZCTEOSA-N 396.462 5.460 30 20 GKED CCC1CC(=O)C(=CNc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C(=O)C1 920978590 LPYZTLFOYNUUJI-XCWJXAQQSA-N 392.886 5.249 30 20 GKED Cc1c(NN=C2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cccc1C(=O)O 1776086997 CKRNAFIEJXITJA-QGZVFWFLSA-N 390.405 5.838 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2ccccc2OCCC(=O)O)cc1 1776125989 YYSHUPHMXKBIRH-KAMYIIQDSA-N 382.456 5.005 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)s1 1776339850 HBFZSFDXLOMCLM-HYXAFXHYSA-N 393.302 5.303 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776339957 VSLGOMGNAMMOFW-ACCUITESSA-N 390.504 6.208 30 20 GKED CC(/C=C\C(=O)c1cccc(OCC(=O)O)c1)=C\c1ccccc1C(F)(F)F 1776398870 MKHKZNWIIXAOTR-TVFNDYRWSA-N 390.357 5.011 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2cccc(CC(=O)O)c2)cc1 1777559802 DXADDBKQONCJFE-KAMYIIQDSA-N 396.442 5.931 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(C)o3)CCC2)cc1 1785840930 PJGQYBCYGOIPBG-UHFFFAOYSA-N 394.515 5.328 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(Cl)cc2)nnc1-c1ccccc1 4563091 WWZITDFDTZRXQX-CQSZACIVSA-N 383.904 5.148 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1ccc(F)cc1 7764805 CGCIIDXZUKBGCL-UHFFFAOYSA-N 398.488 5.279 30 20 GKED Cc1cccc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2cccc(C)c2)c1 28779786 ZBCLIJQJAWTNCE-UHFFFAOYSA-O 389.544 5.259 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 31809859 IMKWTDYJSAOFSE-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nnc1-c1ccoc1C 42130257 BMGPQXPYPFZAMH-UHFFFAOYSA-N 396.903 5.526 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 43931975 LIAJPBIAEDNUPE-UHFFFAOYSA-N 382.423 5.030 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccc2F)cc1Cl 46861806 LTLYQPWPPFIUFI-GOSISDBHSA-N 399.252 6.040 30 20 GKED CCc1nc(C)c(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 51899514 RCJNAWJVGGBURQ-SNVBAGLBSA-N 395.431 5.133 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2ccccc2C)[n+]2cccc(C)c2)c(C)c1 55011781 UVSUFKDXCZBZLI-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nnc1-c1ccccc1 59121373 YUFDTLWIPWBSSI-UHFFFAOYSA-N 392.915 5.625 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(N2CCCC2)c(F)c1 108335319 OORXNSKRHFMXAI-UHFFFAOYSA-N 385.442 5.217 30 20 GKED CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)o1 121441239 SSAVYPXJIXCZJU-BXWFABGCSA-N 381.476 5.138 30 20 GKED N#CC1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 171680267 NKCVQGPUDNCVAS-UHFFFAOYSA-N 394.474 5.309 30 20 GKED C[C@H](c1ccccn1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 172233892 MIDWSYLHWIIXPP-OAHLLOKOSA-N 391.858 5.232 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C1CC1)[C@@H](C)C1CC1 176050859 QTAUNPYSMHOLCE-KRWDZBQOSA-N 389.499 5.241 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1SC[C@@H](C)C#N 178388614 HHYHKRVLBRMZBJ-INIZCTEOSA-N 397.569 5.267 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 179363325 NDBWDSJHEDNZMN-PKOBYXMFSA-N 380.557 5.088 30 20 GKED C[C@@H](N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(OCC#N)cc1 181901463 RCXHTBQSBSTMIE-ZHRRBRCNSA-N 377.875 5.078 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2ccc(OC)cc2)n1 189873361 OISMVUKZJKHVBP-UHFFFAOYSA-N 389.499 5.294 30 20 GKED C[C@H]1CCCCN1C(=O)c1ccc(N=C(O)c2cccnc2C2CC2)cc1Cl 329623484 GBCKYLOWRGKUQB-AWEZNQCLSA-N 397.906 5.263 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 431748598 HUZMDJCXQQYUSI-UHFFFAOYSA-N 387.405 5.297 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 433368826 YZDGFYNQZQFTGY-QGZVFWFLSA-N 392.405 5.468 30 20 GKED N#CCC[C@@H](NC(=O)NCc1ccccc1OCc1ccccc1)c1ccccc1 438842960 QYYVWVBFHDVDFF-HSZRJFAPSA-N 399.494 5.110 30 20 GKED N#Cc1cc(N(C#N)Cc2cn(-c3ccccc3)nc2-c2ccccc2)ccc1F 439707029 LQLIYALAAJZQEA-UHFFFAOYSA-N 393.425 5.038 30 20 GKED CN(C(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccc(C#N)cc1 440054824 SUOBHOSPWHLALW-UHFFFAOYSA-N 382.419 5.160 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(CCC(F)(F)F)c1 441138031 LDPYTDVZZYJPKJ-UHFFFAOYSA-N 392.421 5.410 30 20 GKED Cc1csc([C@H](NCCC(C#N)(c2ccccc2)c2ccccc2)C2CC2)n1 444688413 JOTSOSRNTMIEQM-JOCHJYFZSA-N 387.552 5.392 30 20 GKED Cc1ccc(NCc2ccc(C#N)o2)cc1Oc1ncccc1Br 448352195 CHYAMXVBRGQPOB-UHFFFAOYSA-N 384.233 5.022 30 20 GKED C[C@H](c1ccc(C(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1)C(F)(F)F 455825550 PBRFRFFGJYQWDS-YSGRDPCXSA-N 386.417 5.264 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)C1 457092403 CGLMKXBYKZNRAV-UHFFFAOYSA-N 390.430 5.124 30 20 GKED N#CCSc1cccc(C(=O)Nc2ncc(-c3ccc(Cl)cc3)s2)c1 461096762 CFNFTUNFEBLBBZ-UHFFFAOYSA-N 385.901 5.331 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)ccc(C(F)(F)F)c1F 464401282 CCECALYROALRPK-LLVKDONJSA-N 390.258 5.057 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2sc3c(c2C)CCCC3)c1C#N 465113050 STFXMHSECYAXGZ-UHFFFAOYSA-N 383.542 5.054 30 20 GKED CO[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 466172748 DKRALPPYFBVSOX-CEWLAPEOSA-N 397.906 5.075 30 20 GKED C=CC[C@H](C)NC(=O)N[C@@H](c1cccc(SC)c1)c1cc(F)ccc1F 466240419 FKNBGIPLFWVQSQ-DJJJIMSYSA-N 376.472 5.040 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)c1cc(-c2cccc(C#N)c2)no1 469102491 RTKLHPOCNUFRMF-UHFFFAOYSA-N 391.496 5.416 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)cc1 472371822 ADVFHVMAGBFBHE-UHFFFAOYSA-N 390.792 5.160 30 20 GKED C=C(C)Cn1c(SCC[C@@H](C)OCc2ccccc2)nnc1-c1ccncc1 473402384 RNQFHSXGZUGATG-GOSISDBHSA-N 394.544 5.004 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccccn1)c1ccc(F)c(F)c1 477726283 SSGAJHUDQWKHTB-FGZHOGPDSA-N 393.437 5.066 30 20 GKED C=CCN(C(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 483085995 PQWWQZBLQXFQCN-HXUWFJFHSA-N 387.508 5.417 30 20 GKED N#C[C@H](C(=O)c1ccc(F)c2ccccc12)c1nc2ccccc2n1C(F)F 483494806 XKSAGAURPJSPHB-OAHLLOKOSA-N 379.341 5.214 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)c(Cl)cc1F 484571103 MTTNLZNKAJTYSO-UHFFFAOYSA-N 399.297 5.520 30 20 GKED CC(C)(CC(=O)N[C@H](CCCC#N)c1ccccc1)CC(=O)c1ccccc1 487242029 OWNZKHPFHAOVPK-OAQYLSRUSA-N 376.500 5.227 30 20 GKED N#CCC[C@@H](NC(=O)N1CC[C@H](Sc2cccc(Cl)c2)C1)c1ccccc1 489755130 JNEVZVZQCWPJRW-VQTJNVASSA-N 399.947 5.261 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc(-c2ccccc2)no1 489778743 XTRVCEFDGAKHHQ-INIZCTEOSA-N 382.423 5.574 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 490315627 VHEOUHRKIFGFBN-VFNWGFHPSA-N 379.529 5.520 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1 490686147 UXXHMWMOAVTCKK-CQSZACIVSA-N 386.427 5.400 30 20 GKED C[C@H](Cc1ccccc1F)NC(=O)c1ccccc1Sc1ccccc1C#N 500939664 PPFSTGUOWXTNCR-MRXNPFEDSA-N 390.483 5.210 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(Cc1ccco1)Cc1ccc(C)s1 502657320 YPEHONXMELGWNL-UHFFFAOYSA-N 395.484 5.154 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3cccc(F)c3C2)cc1 503631159 UMGARVUDMAYMRS-UHFFFAOYSA-N 387.414 5.080 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1 508045228 NXOBKURPHVAPLD-FQEVSTJZSA-N 394.519 5.273 30 20 GKED C[C@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(C#N)cc1F 512616355 AKLFFZNYCWKWQX-SJORKVTESA-N 387.458 5.361 30 20 GKED CCn1c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc2ccccc21 517306644 SYXCFLKJWBACNS-SFHVURJKSA-N 385.492 5.583 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cccc(Cl)c1 517462008 YEJRWWZXBRFLSF-UHFFFAOYSA-N 384.810 5.617 30 20 GKED C=CCN(C(=O)C[C@@H](CC)C(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517922172 XJUQWYKUGHCSQQ-OAHLLOKOSA-N 387.505 5.310 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)c1ccc(F)cc1 518757087 WHZPZRFPPCCLIX-HNNXBMFYSA-N 385.508 5.319 30 20 GKED CC[C@H](C)C(=O)Nc1cccc(CNc2ccc(C#N)c(C(F)(F)F)c2)c1 518814752 NHIXZTQGCJADLL-ZDUSSCGKSA-N 375.394 5.174 30 20 GKED CCC(C#N)(CC)C(=O)N(C)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 528576809 BXOLMHPISUXBMX-UHFFFAOYSA-N 391.393 5.185 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1Cc1cccc(OC)c1 530553081 HNIDREMEEOCJKP-NRFANRHFSA-N 392.543 5.786 30 20 GKED CC[C@H](C)n1ncc2c(C(=O)Nc3cc(C(C)(C)C)sc3C#N)cc(C)nc21 536971294 DKHLUAXZZJTALZ-ZDUSSCGKSA-N 395.532 5.194 30 20 GKED Cc1sc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 537293604 XXXZJHQEARGSCX-UONOGXRCSA-N 381.932 6.055 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccc(F)cc2)c2cccs2)c1 539711971 BTOBGQNHHOYHLZ-JOCHJYFZSA-N 380.488 5.449 30 20 GKED C[C@H](N[C@H](C)C(=O)c1c[nH]c2ncccc12)c1ccc(-c2cccc(C#N)c2)cc1 541089171 KXXJIBVUZNVMOM-DLBZAZTESA-N 394.478 5.024 30 20 GKED COc1cc(C#N)ccc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 547417421 YFCCDXUUHLHYQC-QGZVFWFLSA-N 390.270 5.243 30 20 GKED CC(C)[C@@H](NCc1cnc2c(C#N)cnn2c1)c1ccc(C2CCCCC2)cc1 550153613 VRNPXEPPALGSOZ-HSZRJFAPSA-N 387.531 5.136 30 20 GKED Cc1ccsc1CN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 552279827 HTNUPZJKDMVWIT-UHFFFAOYSA-N 377.469 5.384 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3ccc(Br)cc3C#N)oc12 558117292 PCOSFIFRAFSKQM-ZDUSSCGKSA-N 399.288 5.316 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C1CC1 559989208 IXBJIKOKOZFKEH-HNNXBMFYSA-N 382.872 5.326 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3ocnc3-c3ccccc3)c2C#N)[C@H](C)C1 562700014 XIMBJNPZGDACEV-CHWSQXEVSA-N 377.469 5.213 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H]1c1ccsc1 564381286 WMNPTFBVJDHVMR-MAUKXSAKSA-N 398.507 5.146 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cccc(F)c2F)cs1 588386844 BIIQPJGZKODWIT-FLIBITNWSA-N 398.434 5.310 30 20 GKED C[C@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)CCCCCC#N 588822652 VWALNHUERHELEY-QGZVFWFLSA-N 388.964 5.835 30 20 GKED COc1cccc(C2(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)CC2)c1 588895400 WUNFPMFPDQJUNN-UHFFFAOYSA-N 398.462 5.338 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccc(C(F)(F)F)cc1 603969015 VCRJXRRJUOJYHT-UHFFFAOYSA-N 386.398 5.487 30 20 GKED CC(C)(C)Oc1ccc(CNC(=O)c2ccccc2-c2ccccc2C#N)cc1 604438458 IHZOQOJLWNCUDP-UHFFFAOYSA-N 384.479 5.333 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209144 ZCFSPHVQEIEKPI-UHFFFAOYSA-N 397.887 5.729 30 20 GKED CC(C)Oc1ncc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1Cl 609377925 KWSFTAWVGXDCCG-CYBMUJFWSA-N 389.908 5.026 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(Br)c1 609377988 SSPBDKKMCXGNSK-SNVBAGLBSA-N 381.320 5.015 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCCCc1ccccc1 609398201 KCRMMNJTVKVXRC-GOSISDBHSA-N 381.545 5.473 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(C)c1 609432330 ZTTYRYUBYLFHLB-SFHVURJKSA-N 385.467 5.407 30 20 GKED CC(C)OC1CCN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CC1 609724143 WUVWGGFWCJNADD-UHFFFAOYSA-N 398.890 5.034 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)CC1 609773188 ZRCADDHWJUMNIG-KRWDZBQOSA-N 395.478 5.320 30 20 GKED CCN(C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 609967918 QIPSHYGBUIZCMX-CVEARBPZSA-N 388.433 5.680 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccsc1 609969345 PHJOMXOWNAVOOR-ZDUSSCGKSA-N 382.872 5.808 30 20 GKED Cc1cccc([C@@H](C)C(=O)N[C@@H](C#N)c2ccc(OCc3ccccc3)cc2)c1 610063324 OTKZQOAZXKTGOG-DVECYGJZSA-N 384.479 5.059 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 610226962 XWIBZOFQNIHWFR-PMACEKPBSA-N 387.310 5.406 30 20 GKED CC(C)(C)[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C(F)(F)F 610247470 RBYURWWYRXFHLI-SFHVURJKSA-N 376.378 5.057 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 611548668 DQBHLNNWXCIVJT-YOEHRIQHSA-N 388.389 5.154 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1ccc(C(F)(F)F)cc1 612145472 FMZBSDPIYRFRLS-IEBWSBKVSA-N 379.426 5.048 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC[C@](C)(C#N)C3)c(C)c2)c1 612306613 YOVDVRALEGTHIZ-HSZRJFAPSA-N 377.488 5.040 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 613407304 PXRISSMKXXWMND-CQSZACIVSA-N 392.871 5.138 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 618758698 FLNWDWJDAWVKQZ-OAQYLSRUSA-N 379.529 5.317 30 20 GKED C[C@@H](CC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 626995764 XQGNAVKYQWQXCE-QMMMGPOBSA-N 395.265 5.271 30 20 GKED Fc1ccc2nc(CNC(CCC(F)(F)F)CCC(F)(F)F)sc2c1 657707155 SKSFIAKEBXIAAC-UHFFFAOYSA-N 388.352 5.579 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C(F)F)nc1 657826532 HWWZTXXAFJQMOF-YJQGPUDQSA-N 390.318 5.579 30 20 GKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(N2CCOC2=O)cc1 727266833 HKSBKNKCSBESTO-WAPJZHGLSA-N 395.764 5.212 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C=C(/C)c1ccccc1Cl 727626937 JFWTWIJROVUQKK-RXHHAWBHSA-N 394.902 5.216 30 20 GKED O=C1/C(=C\c2cccnc2Cl)CCc2nc(-c3ccc(Cl)cc3)sc21 728697425 FSXWEFRRMKCZHS-BENRWUELSA-N 387.291 5.724 30 20 GKED N#CCOc1cccc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)c1 730149267 FDJILOMNBMIROH-FOWTUZBSSA-N 390.439 5.064 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 730917681 OUKVSWSCHFZHBO-NRFANRHFSA-N 386.495 5.424 30 20 GKED COc1ccccc1CC(C)(C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 733052883 SQYXMDZCRADXTK-HNNXBMFYSA-N 398.915 5.403 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC(C)C)c2ccccc2C)c1 733807287 UCMISVRFSRNGLB-REWPJTCUSA-N 393.531 5.263 30 20 GKED C#CCOc1ccccc1CNC(=S)Nc1c(C(C)C)cccc1C(C)C 734098023 UNFODWFGZYTQRC-UHFFFAOYSA-N 380.557 5.432 30 20 GKED Cc1ccc(-c2ccc(/C=C\C(=O)c3ccc(N4CCC(O)CC4)cc3)o2)cc1 734235751 WCKAMMKQFUKJOF-BENRWUELSA-N 387.479 5.112 30 20 GKED Cc1cccnc1[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)C 734643867 JDNLNPGXGHHVEF-XZOQPEGZSA-N 398.510 5.564 30 20 GKED N#C[C@@H](C(=O)/C=C\C1CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 735593496 MVKJRYNCENBLLC-QPBFKRLHSA-N 378.419 5.628 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1ccc2c(c1)COC2 742437779 XMXRQMVDXZDROZ-MDZDMXLPSA-N 392.886 5.128 30 20 GKED C[C@H](NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1cccc(C#N)c1 743774547 BCVXNRHTYBQFHR-ZDUSSCGKSA-N 380.369 5.134 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@]34CCCc3ccccc34)n2)cc1 744031564 MVZCMHCDDVSTBA-DZRGJMJISA-N 398.531 5.589 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3cnc(-c4ccncc4)s3)cc2)cc1 748683065 LYABLUHHMJWDJU-UHFFFAOYSA-N 399.431 5.088 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 749616608 YGVSSWLEVZPHRF-AWFCHZOYSA-N 392.343 5.182 30 20 GKED N#C[C@@H](C(=O)CCn1ccc2cc(Cl)ccc21)c1nc2cc(F)ccc2s1 759329952 SJVWUCOOTKGWGH-HNNXBMFYSA-N 397.862 5.310 30 20 GKED Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccc(F)cc3OCC#N)c2C)c1 760970087 AYYRCPPCERUGGQ-UHFFFAOYSA-N 391.446 5.005 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 763944887 OSMRRHZYSZYGIA-KBXCAEBGSA-N 391.452 5.007 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCCc3c(C)ccc(C)c32)ccc1OC 769962513 JFVFBOJMEWTVIT-CTNGQTDRSA-N 378.516 5.160 30 20 GKED C=CCc1cc(CN[C@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1OC 772946389 MNGGFTVQTQHYBK-MRXNPFEDSA-N 394.540 5.407 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775304007 ADOICFSHNWJZBY-VXKWHMMOSA-N 399.498 5.051 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775658349 NJIDXVVWZXPQPS-JOCHJYFZSA-N 386.499 5.460 30 20 GKED N#CC1(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CCC3)CC1 775827920 YSUQCJYWQNGICU-DTQAZKPQSA-N 384.435 5.165 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2ccc(OCC#N)cc2)ccc1OC1CCCC1 776154802 WDVQLSPMZHZKOK-QZTJIDSGSA-N 394.515 5.331 30 20 GKED Cc1ncsc1/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 776782579 KUWLNTAOKSUQCZ-LPADLIQXSA-N 393.899 5.412 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(C#N)c(Cl)c1 778538219 GXCBWIOHXAHEFZ-UHFFFAOYSA-N 398.890 5.254 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)nc1 780663915 WCGJBEGAKRISNN-UHFFFAOYSA-N 394.887 5.080 30 20 GKED CCOCOc1ccc(CNc2ccc(OCc3cccc(C#N)c3)cc2)cc1 783589693 PMAORAKMVUHXCL-UHFFFAOYSA-N 388.467 5.122 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCCCC(C)(C)C#N 784626730 AUKQNCADOSONOT-UHFFFAOYSA-N 381.259 5.444 30 20 GKED CC[C@@H](CC#N)OC(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12 787087242 ZUPRLPXKPGOCGY-KRWDZBQOSA-N 376.456 5.012 30 20 GKED COC1(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCC1 791773069 GXQKOJFYQQFINT-ZDUSSCGKSA-N 395.311 5.252 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)c1 792094137 NCUXBMOCRNOCCN-OAQYLSRUSA-N 384.479 5.390 30 20 GKED C[C@@H](OC(=O)c1ccnc(F)c1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 795668155 NDJKEMGCADBGHL-SSDOTTSWSA-N 399.237 5.315 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C2CC(c3ccc(F)cc3)C2)cc1 796748215 UXDLVLVDTATXRR-KADUTPHKSA-N 392.474 5.180 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)(F)F)s2)cc1 796791040 BOCSZZSHWCZYRV-BXUZGUMPSA-N 394.418 5.242 30 20 GKED COc1ccccc1CON=C(Cc1ccccn1)c1ccc(Cl)cc1F 799118333 AEOOHWRILASUJK-UHFFFAOYSA-N 384.838 5.046 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@H]2NC(=O)CCCCCC#N 805199887 HNIJMAIFUMSHCW-LJQANCHMSA-N 385.508 5.001 30 20 GKED N#C[C@H](C(=O)Cc1cccc(Cl)c1F)c1nc2cc(Cl)ccc2s1 810536712 ROSULVUKVQLAJI-LLVKDONJSA-N 379.243 5.161 30 20 GKED O=C(/C=C/c1cncc(Br)c1)c1csc(-c2ccccc2F)n1 812244399 JVKLZOFGSAUMMC-AATRIKPKSA-N 389.249 5.003 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cc(C4CC4)cnc3Cl)c(C#N)c2[C@@H]1C 839390969 ONYVQQACWGVKRP-GHMZBOCLSA-N 385.920 5.484 30 20 GKED C=CCOc1ccccc1-c1nc(-c2cccc(NC(=O)OC(C)(C)C)c2)no1 904635868 RRJSGDURKYNUEB-UHFFFAOYSA-N 393.443 5.315 30 20 GKED CCN(C(=O)c1cc2c3ccccc3n(C)c2s1)[C@H](C)c1ccc(C#N)cc1 914509450 LIUPTRBXHCSXKK-OAHLLOKOSA-N 387.508 5.488 30 20 GKED Clc1cncc(NN=Cc2sc(Nc3ccccc3Cl)nc2Cl)n1 914556917 JIOUXMRBSUSTLN-UHFFFAOYSA-N 399.694 5.083 30 20 GKED CCOc1cc(/C=C2/CCC/C(=C\c3ccc(O)c(OCC)c3)C2=O)ccc1O 916137233 QCQZRDXCECWIMK-MGYAYREDSA-N 394.467 5.115 30 20 GKED C=CCSc1ccccc1NC(=O)COC(=O)c1cc2sccc2s1 919630358 YPJSVXQJGDXRLK-UHFFFAOYSA-N 389.523 5.036 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=S)Nc2cccc(C(C)C)c2)cc1 920075575 CSMJYSYRCCMAFB-UHFFFAOYSA-N 393.556 5.433 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Br)cs2)cc1 921280390 HRSZUUBBPRFZAS-KRWDZBQOSA-N 397.297 5.418 30 20 GKED Cc1c(NN=C(CC2CC2)c2cccc(C(F)(F)F)c2)cccc1C(=O)O 1776089309 LRRHLUCOUFHYSG-UHFFFAOYSA-N 376.378 5.328 30 20 GKED Cc1cc(C)c(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1C 1776132892 IQGAYSJNYDELLD-FMIVXFBMSA-N 384.475 5.802 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc1)C(=O)O 1776469845 URDUHZVTYDRCDP-MVMZHWFQSA-N 396.508 5.469 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776698011 ZHSPKYCSXNJIAN-SCFJZMLDSA-N 398.502 6.390 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CCCc2ccccc2)C(=O)O)cc1 1776786481 MMCPVUSALMQTPX-XMMPIXPASA-N 397.559 5.602 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CCCCCCC)CC(=O)O)c1 1776787914 FIKRBLKYSMYIGL-QFIPXVFZSA-N 391.596 6.329 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)c2cc(C)cc(C)c2)cc1 1776787918 DOKQJCYRCZVWOY-QHCPKHFHSA-N 383.532 5.568 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)s1)CC2 1777371083 HBUFEFHDDWFHQE-SFQUDFHCSA-N 390.460 5.334 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccc2oc(C(=O)O)cc2c1 1777488286 UWFRMGUKFLPYNQ-VQHVLOKHSA-N 389.432 5.459 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COc2ccc(Oc3ccccc3)cc2)cc1 25439712 LGGRGZLLHWFTJW-UHFFFAOYSA-N 386.451 5.298 30 20 GKED CCOc1cc(C#N)ccc1OCC(=O)Nc1c(C(C)C)cccc1C(C)C 27446114 JKVOABRPQLLPJO-UHFFFAOYSA-N 380.488 5.221 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@H]2CCCC[C@@H]2C)cc1 27490294 UWPDYYMUDLRZIR-RXVVDRJESA-O 395.592 5.006 30 20 GKED N#C[C@H](C(=O)Cc1c[nH]c2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 41514999 KMKAVHPJYGFJGD-QGZVFWFLSA-N 391.883 5.364 30 20 GKED Cc1nc(NC(=O)c2oc3c(Cl)cccc3c2C)sc1SCC#N 44788961 NQFOBRITZVDWPG-UHFFFAOYSA-N 377.878 5.028 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 56744684 FZCVLBTUPHWPLU-OAHLLOKOSA-N 377.469 5.637 30 20 GKED CN(Cc1ccccn1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 63160730 ABPLBPFBZKXSPJ-UHFFFAOYSA-N 392.846 5.063 30 20 GKED CCc1nc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cs1 67547391 UZKBBJAOWYQAFY-UHFFFAOYSA-N 392.484 5.033 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@@H]2CCCC[C@@H]21 102796661 GPIBVNAFKHPWPF-REWPJTCUSA-N 389.499 5.242 30 20 GKED C[C@H](NCc1ccc(Oc2ccccc2F)c(F)c1)c1ccc(OCC#N)cc1 105487527 RAXZUBQJNYUSIL-INIZCTEOSA-N 394.421 5.510 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1CCC(F)(F)F 126054793 HQZAVQKCLOJZRF-UHFFFAOYSA-N 376.422 5.444 30 20 GKED CC(C)n1cc(C#N)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)n1 161092734 RKYOAICPZOSHEL-UHFFFAOYSA-N 398.825 5.173 30 20 GKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 171402671 PBHLCODUDFSOEQ-IAGOWNOFSA-N 381.426 5.438 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(Cl)s1 175109525 IDVJEYOPXUYEAE-WFASDCNBSA-N 382.872 5.006 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)sc1-c1ccc(F)cc1 182122925 TVRDBXMHOSRQPD-AWEZNQCLSA-N 380.444 5.406 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2nc(C3CC3)no2)cc1 189878877 SRHMBGZWDJGVNS-UHFFFAOYSA-N 387.483 5.718 30 20 GKED OC(=Nc1ccc2c(c1)OC1(CCCC1)O2)N1CCCCC[C@@H]1c1ccncc1 329282363 FJCVURPWTGVRNV-LJQANCHMSA-N 393.487 5.286 30 20 GKED Cc1ccc(N=C(O)C(C)(C)C)cc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330038169 ZTGHIORLDBBZNM-UHFFFAOYSA-N 399.535 6.142 30 20 GKED C[C@H](CC(F)F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 412276448 YUIQMRWWESTLKZ-KCJUWKMLSA-N 377.275 5.106 30 20 GKED C=CCC[C@H](NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)c1ccccc1 435759529 KXKNPDZQRFUVCS-FPOVZHCZSA-N 384.545 5.146 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@H]2CCC(F)(F)C2)cc1 435959184 MYGPSQVNHJCIOT-KRWDZBQOSA-N 386.467 5.016 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 436303537 CVXMZPIYAHIBPV-IGKWTDBASA-N 376.475 5.034 30 20 GKED N#CCC[C@H](NC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccccc1 439670050 GOPBADVTMDEBJI-IBGZPJMESA-N 395.915 5.167 30 20 GKED COc1ccc2occ(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)c2c1 440763729 SJGUZIMFLSROKU-UHFFFAOYSA-N 399.406 5.061 30 20 GKED N#CCC[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccccc1 442632681 ADIRHQNKECMDAQ-GOSISDBHSA-N 398.293 5.763 30 20 GKED Cc1cccc(C)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 443899917 MGEQWLKNUCZNGN-UHFFFAOYSA-N 390.870 5.660 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1ccc(C)c(C)c1 453467579 RGCJQNQLUOHRKE-RTWAWAEBSA-N 380.536 5.054 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1ccc2c(c1)COC2 460170899 MYTMPYFRIMDYCL-UHFFFAOYSA-N 388.854 5.089 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)cc1 460342403 HKMAWANUAPWZAO-UHFFFAOYSA-N 399.881 5.249 30 20 GKED N#Cc1ccc(SCc2csc(CC(=O)Nc3ccccc3)n2)c(Cl)c1 465388996 PNNKHACWVIYJFX-UHFFFAOYSA-N 399.928 5.142 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2cccc3cc[nH]c23)cc1 466406056 JOFSQNZCTKNMIJ-UHFFFAOYSA-N 382.423 5.154 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(NCC(F)(F)F)c1 468146139 SYBZZVBMNCZGQY-UHFFFAOYSA-N 395.384 5.452 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCCC[C@H]3c3ccccc3)ccc21 469001936 NIPLEPKGSVMGGF-GOTSBHOMSA-N 387.527 5.408 30 20 GKED C[C@@H](Oc1ccccc1NCc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1 471661179 ATNADAFQJBNOOZ-QGZVFWFLSA-N 396.450 5.360 30 20 GKED CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H](C)c1ccccc1OC 477525216 DOQRCXVBMBORGY-KRWDZBQOSA-N 379.504 5.501 30 20 GKED N#CCC[C@H](NCc1ccc(Br)c2cccnc12)c1ccccc1 478264155 XKTQQJLEJVYPJA-IBGZPJMESA-N 380.289 5.132 30 20 GKED N#CCCCOc1cccc(NC(=O)N[C@@H](C2CCCCC2)C(F)(F)F)c1 482287162 XGTMXXSVZQHFSH-KRWDZBQOSA-N 383.414 5.002 30 20 GKED C[C@@H](C(=O)Nc1ccccc1NCCCc1ccccc1)c1cccc(C#N)c1 487312001 VHEXFCGAIXMUIG-LJQANCHMSA-N 383.495 5.345 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2cccs2)n1 500312812 RXOPJLPHXZBUOW-UHFFFAOYSA-N 381.526 5.042 30 20 GKED CC1(C#N)CCN(Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 507701294 ZYOHBYXDUWXYFI-UHFFFAOYSA-N 385.851 5.166 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 520170591 DRUNXAIGZPTBBF-UHFFFAOYSA-N 385.895 5.219 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)n1 520446186 URVMBINIYNIIJE-INIZCTEOSA-N 386.835 5.526 30 20 GKED COCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](C)c1ccccc1 521259843 SCZYHMYLEVYHHO-ROUUACIJSA-N 397.544 5.180 30 20 GKED CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)N(CCC#N)CC(C)(C)C)c12 521484348 WRCPVVBQQFYNPO-UHFFFAOYSA-N 396.535 5.091 30 20 GKED C=CCCCN(C)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 522945215 UOATXOWLZYEIHA-UHFFFAOYSA-N 382.554 5.506 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)o1 523456346 ATBKBGHZURTUNV-HSZRJFAPSA-N 399.494 5.532 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc(Cl)c(Cl)c3)o2)cc1 524381707 QEBVVQOWPOVZCW-UHFFFAOYSA-N 387.222 5.289 30 20 GKED CC[C@H]1CCC[C@@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 524724628 GMYXSAFMVKZGKC-FXAWDEMLSA-N 378.541 5.549 30 20 GKED C=CCC[C@@H](NC(=O)Nc1c(C)noc1CC)c1ccc(C(F)(F)F)cc1 536289925 HILSOVFWXBWZRS-OAHLLOKOSA-N 381.398 5.393 30 20 GKED COc1cc(F)c([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1OC 537013753 QEYNPIOEKJYVJR-MRXNPFEDSA-N 390.458 5.232 30 20 GKED C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(C#N)c(F)c1 537401323 XTSOYICBFWUPDD-SFHVURJKSA-N 396.469 5.401 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1F 537454688 ZEIFUISALDAFKF-UHFFFAOYSA-N 397.409 5.297 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)s1 551822223 XLXWSPWSGJDVKR-JOCHJYFZSA-N 387.508 5.209 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1nc(-c2cccc3ccccc23)c(C)s1 551975196 VJQPJIXPNUBWNK-UHFFFAOYSA-N 384.464 5.099 30 20 GKED N#C[C@H](C(=O)c1ccc(CN2CCCC2)cc1)c1nc2cc(Cl)ccc2s1 556182012 OTLMXVFHSKRMGU-QGZVFWFLSA-N 395.915 5.036 30 20 GKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)cc(Br)c1 556197958 ODYXPIKSAYUDPP-UXHICEINSA-N 389.312 6.064 30 20 GKED Cc1oc(C2CC2)nc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 560518233 XTBFTLSHVFZJBD-AWEZNQCLSA-N 383.860 5.127 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2cccc(F)c2)C1 563719539 TUDGQNPTRIHZQI-WBVHZDCISA-N 383.492 5.099 30 20 GKED Cc1sc(NC(=O)CCCCCC#N)nc1-c1ccc(OC(F)F)cc1 588266771 XLYRSLBUFHBNOA-UHFFFAOYSA-N 379.432 5.133 30 20 GKED C[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(O[C@@H](C)c2ccccc2)cc1 595751788 HIPSOVFQMQKANU-OALUTQOASA-N 391.515 5.223 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1 603514135 JUYKZHNRYGUGJF-UHFFFAOYSA-N 390.870 5.063 30 20 GKED N#Cc1c(NC(=O)CCCOc2ccccc2)sc2c1-c1ccccc1CC2 603992537 ZKHYVUXFIPIPBW-UHFFFAOYSA-N 388.492 5.183 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 604508989 FYUKPMWABKHCQP-UHFFFAOYSA-N 392.484 5.060 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)c1C#N 609032606 UABDKKFJAJSDLV-KGLIPLIRSA-N 378.419 5.252 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCc1ccccc1F 609378575 WIHVOPUOURVRFJ-UHFFFAOYSA-N 396.409 5.422 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[C@@H]1CCc2ccccc21 609498288 OEGWEIHOJIVXPY-XMMPIXPASA-N 382.463 5.304 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C[C@@H]1CCc2ccccc21 609651373 DWJTVYKIWXZKAH-QFIPXVFZSA-N 396.490 5.504 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cc(Cl)ccn2)c1 609731305 AUCKGZNZJBMPBP-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(CN(C)C(=O)C2(C#N)CCC2)cc(C)c1OCc1ccccc1Cl 609861144 PQVGDAQCFRMKIR-UHFFFAOYSA-N 396.918 5.188 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1ccsc1 609967719 AQLHKULGBLCSHS-MRXNPFEDSA-N 378.472 5.404 30 20 GKED CC(C)(C)Cc1nc(-c2ccc(C(=O)Nc3ccc(C#N)c(Cl)c3)cc2)no1 610169353 RLPZRLHUSSCMPJ-UHFFFAOYSA-N 394.862 5.103 30 20 GKED N#CCN(C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1)C1CC1 610173740 RSGSJQKSJZFYNN-UHFFFAOYSA-N 391.323 5.414 30 20 GKED C[C@H](C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1ccccc1C(F)(F)F 610598290 CDVHXTLHYMWVQV-QSFXBCCZSA-N 386.417 5.107 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(Oc2ccccc2)cc1 610809771 YFLGCPWDNXTCFZ-LJQANCHMSA-N 398.510 5.065 30 20 GKED CCCCOCCOCc1cccc(N[C@H]2CCCc3cc(C#N)ccc32)c1 611482572 RSNJTNVJRISHOB-DEOSSOPVSA-N 378.516 5.381 30 20 GKED Cc1c(C#N)c(NC(=O)c2scnc2C2CCCC2)n(-c2ccccc2)c1C 612663960 KNJGPARDKXZIAV-UHFFFAOYSA-N 390.512 5.332 30 20 GKED C[C@@H](CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 619126344 OQFWKWYXKHVSPX-NSHDSACASA-N 387.339 5.489 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 622515063 JIMFOGSONRNNBL-JTQLQIEISA-N 393.302 5.582 30 20 GKED CCC1(C)CN(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)C1 646440852 HXGPVYDNVPSEMP-UHFFFAOYSA-N 386.311 5.240 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nc(C2CC2)cs1 647372489 NLRBSKLFQXWMCE-AWEZNQCLSA-N 378.478 5.131 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)C[C@H]1CCCO[C@@H]1c1ccccc1 669727564 OAZDVXPKERZZRV-FYYLOGMGSA-N 378.516 5.437 30 20 GKED N#C[C@H](C(=O)c1cc[nH]c1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 672581933 ZMYPFCNRMWXLTQ-GFCCVEGCSA-N 375.375 5.011 30 20 GKED CCN(CCC(F)(F)F)C(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 683635195 MWUAUUXBZFSCSZ-LLVKDONJSA-N 394.718 5.066 30 20 GKED N#Cc1ccc(NC(=S)Nc2cc(F)ccc2N2CCCCC2)cc1Cl 726907806 INOSJJYKGDFRIU-UHFFFAOYSA-N 388.899 5.150 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1sc(-c2ccc(C)cc2)nc1C 727650957 CTEHDRPTEQOGRQ-UHFFFAOYSA-N 379.489 5.246 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ccc(O[C@@H](C)C#N)cc1 728698112 LRJNPGFPJJIMFT-VDFGQWLZSA-N 392.455 5.445 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)n1 730072295 TVINFWQLTGMOSC-BEFAXECRSA-N 398.940 5.815 30 20 GKED CC1(C)/C(=C/c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2ccccc21 730949707 ZVCXKLABYNQCJU-DEDYPNTBSA-N 388.419 5.114 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C(/C)c3cccc(F)c3)n2)cc1 732497149 LKKQQSIVSVDRBD-LMICACPXSA-N 392.455 5.238 30 20 GKED C=CC[C@H](NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1ccncc1 734235626 KZTAKGJICOESDM-IMXKFXGHSA-N 380.797 5.201 30 20 GKED N#CCSc1ccccc1C(=O)Nc1nc(/C=C\c2ccccc2)cs1 735290476 RGBXSQCLKXVDKA-KHPPLWFESA-N 377.494 5.181 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)C1(c2cccc(Cl)c2)CCC1 735336223 HNCGJNMZDNFVMI-UHFFFAOYSA-N 390.266 5.061 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)/C=C/c2ccccc2C#N)cc1 741645895 MLQYQFJCQMJUCD-PIOKWQJESA-N 396.490 5.467 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)COc2c(Cl)ccc(Cl)c21 743055556 FMCZKNFHUYLAGJ-UKTHLTGXSA-N 399.233 5.234 30 20 GKED N#C[C@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2o1 744038863 AZTRGQOGOIIHPH-NHCUHLMSSA-N 380.447 5.421 30 20 GKED O=C(/C=C/c1ccc(O)c(Br)c1)c1cc(Cl)sc1Cl 744865106 CUUYMOLORYNIGM-HNQUOIGGSA-N 378.074 5.419 30 20 GKED CC(=NN=Cc1c(Cl)cccc1OCc1ccccc1Cl)c1cnccn1 745206754 PPCNIJKQQXOIRX-UHFFFAOYSA-N 399.281 5.206 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)oc2ccc(Cl)cc12 746481431 IVZJXAMAPIIAOZ-UHFFFAOYSA-N 390.182 5.080 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 752235178 IGBVIOFEQQNRHC-RDTXWAMCSA-N 385.920 5.571 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCCc3c(Cl)cccc32)ccc1OC 756705160 KJHBCJWHGLBTPF-OXQOHEQNSA-N 384.907 5.197 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 774162404 IMOUDIVREDXLHM-UHFFFAOYSA-N 383.448 5.272 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(-c3ccccc3F)o2)c2ncc[nH]2)c1 776434604 XVJYPVYMHMYYSI-RGEXLXHISA-N 388.398 5.241 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCCCc1ccc(Cl)cc1Cl 780674861 RKSQTUHHOCYMQC-ZDUSSCGKSA-N 392.286 5.039 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccccc2)c2cc(Cl)ccc2Cl)cc1 783892477 GYCKZBQIVYAPDZ-QFIPXVFZSA-N 397.305 5.775 30 20 GKED C[C@@H](OC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1cccc(C#N)c1 787011165 ASUXWXUBGIMMGH-CQSZACIVSA-N 396.899 5.106 30 20 GKED C#CCN(Cc1ccccc1)C(=O)c1sc(-c2ccccc2)nc1C(F)F 804833710 HTJVQHHIZFMANA-UHFFFAOYSA-N 382.435 5.023 30 20 GKED Cc1cc2oc(=O)cc(CN[C@H](CCCC#N)c3ccccc3)c2cc1C(C)C 814658681 GANOGMBHCLPPIG-HSZRJFAPSA-N 388.511 5.750 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842941541 QRNGEXXHIXTGEG-BMGYJQCNSA-N 376.403 5.319 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1 850166164 URWIPXGUXNWWPH-KRWDZBQOSA-N 391.515 5.440 30 20 GKED N#CC1CCC(CSCc2nnc(-c3ccccc3Br)o2)CC1 902567960 RXZMPBPAYLLUBD-UHFFFAOYSA-N 392.322 5.062 30 20 GKED N#CCOc1cccc(NC(=O)c2ccccc2OCc2ccc(Cl)cc2)c1 915740989 DGPLMILPHGMYDW-UHFFFAOYSA-N 392.842 5.074 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(Br)s2)ccc1OC(F)F 916127053 XQTWLQBPRZVGJB-HYXAFXHYSA-N 389.217 5.017 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3c(Cl)cccc3s2)cc1 916912838 MHGDOAIJEDBWOM-OAHLLOKOSA-N 382.872 5.078 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)cc1 918713087 KHVIPXKKZNYYCF-YFHOEESVSA-N 380.856 5.143 30 20 GKED O=C(/C=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(OCC(F)(F)F)cc1 920480554 HLPQDBGLVDOZEF-WAPJZHGLSA-N 385.725 5.085 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)cc1 1776125612 NKLIODJWOLXPOH-LEHPZIBWSA-N 398.474 6.015 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776473409 FNXFQDDZYSUCQV-BCPZQOPPSA-N 396.386 5.047 30 20 GKED CCCCCCOc1ccc(/C=C2\CCc3occ(C(=O)O)c3C2=O)cc1OC 1776788926 JACXBLKTKJOMLF-FOWTUZBSSA-N 398.455 5.158 30 20 GKED C=CCCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H](C)CC)CC1 1823751362 RZMCDSOKQMPRDN-PZJWPPBQSA-N 390.612 5.035 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1nc2ccccc2s1 14604049 GRSWSJPQKVZBCT-OAHLLOKOSA-N 399.475 5.241 30 20 GKED Cc1cc(C)cc(N/C(S)=C(/C(=O)c2ccccc2C)[n+]2cccc(C)c2)c1 55011914 HWHTYZOXUBRDRI-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)n1 59408085 VARJKUPPIIKBAH-QGZVFWFLSA-N 387.508 5.676 30 20 GKED Cc1nn(CC(C)C)c(C)c1CCC(=O)Nc1ccccc1S[C@H](C)CC#N 66802027 CSHDBJQBSUGHEW-MRXNPFEDSA-N 398.576 5.122 30 20 GKED N#Cc1ccc(-c2ccc(OCc3nnc(-c4cccc(Cl)c4)o3)cc2)cc1 78604006 RAWQHNSJHJPYNV-UHFFFAOYSA-N 387.826 5.508 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1cccc2ccccc12 108351557 XWSIVHJCYIKJCS-INIZCTEOSA-N 376.481 5.252 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 108357254 IKNCNYZDZBAWSE-VGOFRKELSA-N 381.545 5.006 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)C(=O)Nc1cc(Cl)ccc1F 108408082 LPEROWJNIRBREZ-OLZOCXBDSA-N 391.899 5.170 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(F)c(Cl)c2)ccc1OC 113308849 OXEXBCNIUAMRGI-XJKSGUPXSA-N 376.859 5.019 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccccc1NC(=O)c1cccs1 131657885 ZXVLOPPVASDRBP-UHFFFAOYSA-N 375.497 5.414 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)o1 133848290 JLQQEAOFNWGFJF-ZDUSSCGKSA-N 384.892 5.396 30 20 GKED N#CCCCCNC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 170885786 XKJVTCXQDHLQHI-SFHVURJKSA-N 376.287 5.076 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(-c3ccc(F)cc3)o2)ccc1OC 172121544 CMOGZTVXXDMEFG-IBGZPJMESA-N 394.446 5.065 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CC(F)(F)F 173983813 QYUMKHVECZKTAP-UHFFFAOYSA-N 375.394 5.107 30 20 GKED Cc1cc([C@@H](C)NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)s1 182745211 PFIFSROJSKBQAR-DZGCQCFKSA-N 387.574 5.049 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 208007114 PDBMCAJKEYODIT-KSHIFHCESA-N 380.658 5.834 30 20 GKED FC(F)(F)c1ccc(C#CCNCc2cnc(-c3ccsc3)s2)cc1 237870947 OYWPMJFKHMTVHQ-UHFFFAOYSA-N 378.444 5.032 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CC(=O)c1ccccc1F 266358839 PJXFUOHYULWQKM-HUUCEWRRSA-N 384.476 5.068 30 20 GKED COc1ccccc1[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccccn1 302195378 OHDMSMYKTBBVLL-HXUWFJFHSA-N 383.373 5.182 30 20 GKED CC(C)(C)OCc1cccc(CNC(=O)c2ccccc2-c2ccccc2C#N)c1 303102769 IHXPPBFDHXOJPO-UHFFFAOYSA-N 398.506 5.470 30 20 GKED CC(C)(C)OC(=O)C1CCC(/N=C(/O)c2c(Cl)cc(F)cc2Cl)CC1 331190183 KYDBYCHGALYTBZ-UHFFFAOYSA-N 390.282 5.338 30 20 GKED C[C@H](SCc1ncc(C#N)cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 419416553 WICXRQOYNINGHX-VIFPVBQESA-N 391.340 5.380 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(C#N)cc3Cl)cc2)cc1 430371717 YAVGCDZRZGWTDE-UHFFFAOYSA-N 387.826 5.322 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)Nc3ncccc3OCCCC#N)c2)o1 432429172 OPXPCEDEHQMZSG-UHFFFAOYSA-N 390.443 5.285 30 20 GKED C[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(C(F)(F)F)cc1 437074259 GSOZNESKCGWXIS-YCMKEVRSSA-N 389.421 5.013 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 437227104 JVFUBUQBCLBYHZ-LLVKDONJSA-N 398.837 5.863 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)NCC3CCC(C#N)CC3)c2)C1 440920322 HUMARKRWEXVRHK-SQOVAUKPSA-N 383.536 5.233 30 20 GKED C=CCC[C@@H](NC(=O)C[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441592522 ULEXVXISWSITDP-DNVCBOLYSA-N 376.422 5.418 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCC(=O)c2cc(Cl)sc2Cl)cc1 445758444 NMEMGUUSZNWFGZ-UHFFFAOYSA-N 395.311 5.458 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1cccc(C)c1C 453462606 IIFOXIUKAZQUHH-LEWJYISDSA-N 380.536 5.054 30 20 GKED C[C@H]1c2cc(F)cc(F)c2CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458808024 YQGOTSKJVRTENM-YCRPNKLZSA-N 383.442 5.029 30 20 GKED CCC1(c2ccccc2)CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 459394610 HCSYJUJJSCCOAW-KRWDZBQOSA-N 379.529 5.276 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)[C@H](C)c1cccc(C#N)c1 462215643 RJOYIPKKFHEWJL-NVXWUHKLSA-N 389.524 5.313 30 20 GKED COC1(c2noc([C@H](C)c3cccc(C#N)c3)n2)CCC(c2ccccc2)CC1 463051756 CCBMPNNAVVWFIO-RAMCEHFNSA-N 387.483 5.293 30 20 GKED Cc1c(Br)cccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 463743137 AKZQSNULEICHIB-CQSZACIVSA-N 398.087 5.059 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cc2ccccc2o1 466495226 KEZLKKCVTFAGOW-KRWDZBQOSA-N 375.472 5.233 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N2CCSCC2)cc1C 471248402 DNXXMYUWHUMFGO-UHFFFAOYSA-N 395.572 5.158 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)Sc1ccccn1 474929919 PKXZDVQHWOLGNE-MRXNPFEDSA-N 389.480 5.173 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1 475575980 ULOWUEKUKWOPPT-SFHVURJKSA-N 388.515 5.607 30 20 GKED CC(=O)c1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 480797135 RTIWKCZFUHJRHH-OAQYLSRUSA-N 388.854 5.450 30 20 GKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)ccc1NC(=O)CC(C)C 487276401 YHIQUFBKYDTRJN-JOCHJYFZSA-N 391.515 5.145 30 20 GKED CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C#N)cc1Cl 489158290 QRYVMGDPEXFXIG-UHFFFAOYSA-N 389.864 5.120 30 20 GKED C=CCN(Cc1ccccc1)C(=O)CCCc1ccc(Br)s1 497802796 QFUFGWSXRDXFDB-UHFFFAOYSA-N 378.335 5.048 30 20 GKED Cc1cc2cc(N[C@H](C)C(=O)Nc3sc4c(c3C#N)CCCCC4)ccc2[nH]1 500262334 GUOQNVNEHZKFLI-CQSZACIVSA-N 392.528 5.118 30 20 GKED C=CCNC(=O)[C@@H](C)S[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 506235893 UUHQDOAIHRPFNO-NXEZZACHSA-N 385.373 5.209 30 20 GKED CC(C)N(C(=O)c1ccc(COc2ccccc2C#N)o1)c1ccc(Cl)cc1 509174272 YYHNHVZPHYVVSN-UHFFFAOYSA-N 394.858 5.439 30 20 GKED N#C[C@@H](C(=O)c1occc1CSc1ccccc1)c1nc2ccccc2s1 513686738 FJDMVDJPBFRKQS-INIZCTEOSA-N 390.489 5.672 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccc(OC(F)F)cc3)no2)c2ccccc21 514631008 IMBHRZINPOEGES-UHFFFAOYSA-N 394.381 5.263 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(C)c1 517168946 PISBDUCNIKGYTB-GOSISDBHSA-N 385.467 5.407 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCCOCc3ccccc3)cc2)c1 518231752 GENRHNFPGMAWQS-UHFFFAOYSA-N 386.451 5.286 30 20 GKED CCN(Cc1cccs1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518370083 CMCUXWHVPYPFBR-UHFFFAOYSA-N 376.481 5.269 30 20 GKED C=CCn1c(SCc2csc(C3CCCC3)n2)nnc1-c1ccoc1C 519900367 WZEZKMNMODNUMT-UHFFFAOYSA-N 386.546 5.439 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)C(C)(C)c1ccccc1 520197922 UEWFSIPEVUYLRM-DLBZAZTESA-N 381.545 5.569 30 20 GKED Cc1cc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)s1 520818163 WKYGSZMHMJTEHK-CYBMUJFWSA-N 390.599 5.489 30 20 GKED C[C@H]1c2cccn2CCN1C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 522635726 VBTMZXUTZMQEHT-HNNXBMFYSA-N 391.858 5.022 30 20 GKED N#C[C@H](NC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1)C1CC1 525570515 IDDVLHRLBTTWMK-KRWDZBQOSA-N 391.323 5.318 30 20 GKED CSc1ccc(-c2csc(NC(=O)c3ccc(C4(C#N)CC4)cc3)n2)cc1 537391589 XIWAYQGSURXBKH-UHFFFAOYSA-N 391.521 5.339 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2c[nH]c3c(CC)cccc23)CC1 538265446 IXMKMIQPPRIPQL-UHFFFAOYSA-N 382.548 5.199 30 20 GKED C=CCN(C(=O)c1scnc1C1CCCC1)c1nc(-c2ccccc2)cs1 545338123 UPWOFZLAGRMTPU-UHFFFAOYSA-N 395.553 5.757 30 20 GKED COc1cc2c(cc1F)CC[C@@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 549204399 KDDHGCUOMLIAKE-DYVFJYSZSA-N 399.491 5.038 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)N(CCC#N)c2ccc(F)cc2)c(C)c1 553948008 WVVZTUYFYQPFSX-UHFFFAOYSA-N 380.463 5.051 30 20 GKED COCC[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)c(Cl)c1 556516047 YLHIADYGVVVKOB-FQEVSTJZSA-N 391.342 5.662 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 558748166 UYLNDEDLDFSXBI-ZDUSSCGKSA-N 398.322 5.431 30 20 GKED C=CCN(CCC#N)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1CCC 570951431 GMSGTLGVINWPGB-UHFFFAOYSA-N 392.286 5.143 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1c(Cl)ccc2cccnc12 573269076 VCTUZIBQMVRGBB-UHFFFAOYSA-N 394.261 5.085 30 20 GKED CN(C(=O)CCCCCC#N)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 588957889 CIWBQTLGZJQXJK-OAHLLOKOSA-N 380.332 5.241 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2cnn(-c3ccc(F)cc3)c2C)cc1Cl 589648069 UHEXDVLMTNDODT-OAHLLOKOSA-N 399.897 5.389 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1CCc2cc(Br)ccc21)c1ccccc1 592635311 BJSJXNWOFKSSAF-PMACEKPBSA-N 397.316 5.030 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2ccccc2)c1)c1nc2cc(F)ccc2s1 592973626 CLKBOLUBMOQJJJ-SFHVURJKSA-N 388.423 5.718 30 20 GKED COc1cc(CNC(C)(C)c2cccc(C#N)c2)ccc1OCc1cccs1 594968354 RJJLGODUBVRQCB-UHFFFAOYSA-N 392.524 5.232 30 20 GKED COc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C3(C#N)CC3)cc2)c1 602759575 MSHOIEPYRBNSKR-QHCPKHFHSA-N 395.462 5.021 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(-c4ccc(F)cc4)o3)n2)cc1 603833714 ZSIGVABIOXDRHH-UHFFFAOYSA-N 389.411 5.333 30 20 GKED Cc1c(F)cccc1NC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 608776074 XXPIIQQMNNIADS-UWVGGRQHSA-N 386.311 5.165 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccccc2Cl)n1 608935858 HYXGXSOIECSSJN-UHFFFAOYSA-N 395.915 5.388 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609647411 MSGFRTGZMPLKIH-XMSQKQJNSA-N 382.463 5.369 30 20 GKED COc1ccc(C)cc1NC(=O)[C@@H](Sc1ccccc1C#N)c1ccccc1 610206775 NCJKMEASAYESPU-QFIPXVFZSA-N 388.492 5.347 30 20 GKED C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610584078 ZMJWLGIBVKUALK-JTSKRJEESA-N 398.466 5.155 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl)c1ccccn1 612892293 KZVNVKTYICHHQM-VIFPVBQESA-N 381.671 5.747 30 20 GKED Cc1cc(C)c(C#N)c(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)n1 619516459 LMLPAZPKUPQRKY-UHFFFAOYSA-N 382.920 5.217 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 660940988 RLJNSZORWRGFCD-DOMZBBRYSA-N 383.439 5.230 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)c(F)c1 673627897 XAPYWIARLFFSQF-YJQGPUDQSA-N 375.303 5.525 30 20 GKED Cc1ccc(OC(F)F)c(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 678207846 FUJIVWZQIIGKIC-TXEJJXNPSA-N 391.302 5.159 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c12 679536838 TZUZBRONAOYZRH-QGZVFWFLSA-N 396.450 5.262 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](OC)c1ccccc1Cl 682776909 AIWJFAFASWYBOD-HXUWFJFHSA-N 386.923 5.701 30 20 GKED CC[C@@H](C)Oc1ccccc1/C=C\C(=O)Nc1ccccc1SCCC#N 730981959 FTVOCZHFCJGITK-LKBMAGLMSA-N 380.513 5.522 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc(-c2ccncc2)cs1 734084202 YMYHNOYASSEDBH-NRFANRHFSA-N 393.471 5.266 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cnc2ccc(Cl)cn12 737442529 BUABTOXAZFCUSR-CMDGGOBGSA-N 379.872 5.316 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3nccc4ccccc34)s2)cc1 740765499 DHPPYPHKAUYQRP-VAWYXSNFSA-N 386.476 5.571 30 20 GKED COc1cc(/C=C\C(=O)c2sccc2Br)c(SC)cc1OC 741165548 NZDQWYWFCFRQEP-PLNGDYQASA-N 399.331 5.146 30 20 GKED COc1cccc(-c2nc(/C=C3\C(=O)c4ccsc4S[C@H]3C)cs2)c1 742435775 AIRBIJQNZUZARG-RCEBRVLHSA-N 385.535 5.641 30 20 GKED Cc1cccc(C)c1NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1 743037733 UUMHPLJIIWLBDJ-UHFFFAOYSA-N 391.471 5.915 30 20 GKED CCCCCSc1nc2ccc(NC(=O)N(C)C[C@@H](C)C#N)cc2s1 743189201 IPEGATZAFFVMMW-ZDUSSCGKSA-N 376.551 5.202 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 747109214 YGVIATFOJFVGJQ-QMTHXVAHSA-N 395.673 5.098 30 20 GKED COc1ccc(C=NN[C@H](C)c2ccc(C(C)C)cc2)cc1OCCCC#N 747356608 DTOIODUURGYDSO-GOSISDBHSA-N 379.504 5.186 30 20 GKED CSc1ccc2c(c1)CC/C(=C/c1cc3cnn(C(C)C)c3nc1Cl)C2=O 748148659 VVMWYXHIPITJMN-ZSOIEALJSA-N 397.931 5.600 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)ON=Cc1cccc(Cl)c1Cl 749512247 REDZZHHBWFUUDX-ZDUSSCGKSA-N 379.287 5.495 30 20 GKED N#CCOc1cccc(NC(=O)c2cc(Cl)ccc2SC2CCCC2)c1 754137172 ONADHDACRGSIIZ-UHFFFAOYSA-N 386.904 5.529 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2cc(C(C)C)nc(C(C)C)n2)ccc1OC 761226052 ZVSZYDTUMWESRM-KRWDZBQOSA-N 382.508 5.025 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(OCC#N)cc1 776155105 YCKXYDXNCBLHRJ-SPWCGHHHSA-N 394.359 5.149 30 20 GKED C=CC[C@H](C(=O)OCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 778428048 PQYGPBLYNMMNIH-QFIPXVFZSA-N 385.463 5.195 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1 780156075 CQVIYEGKSVCNJP-QLENYVDCSA-N 392.455 5.357 30 20 GKED N#C[C@@H](C(=O)CCCCC(=O)c1ccccc1)c1nc2cc(F)ccc2s1 783376480 BXWZTXUOCIVTAS-INIZCTEOSA-N 380.444 5.055 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)o1 794358159 WESIWSFRFCFMSN-UHFFFAOYSA-N 397.312 5.086 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 796793414 NWRCLDHTBDASQD-HNKHHVNMSA-N 393.314 5.247 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCCC[C@H]3[C@@H]3CCOC3)nc2c1 814860135 LMNTWFPWMPTVET-YPMHNXCESA-N 383.439 5.310 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cc(Br)c2ccccc2c1 816016651 WOABXEAUKCOMLP-CYBMUJFWSA-N 395.256 5.145 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 820125670 MZLWTDIGIXPWSC-KBPBESRZSA-N 398.359 5.130 30 20 GKED CN(CCCN1c2ccccc2Sc2ccccc21)C[C@H](C#N)CCC#N 860042762 QWXFHOPMCFQQOY-SFHVURJKSA-N 376.529 5.055 30 20 GKED Cc1cccc(Cl)c1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 864353021 CDVBNQDTDJXFCM-HIFRSBDPSA-N 387.936 5.339 30 20 GKED N#C[C@@H](CCc1ccccc1)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904446753 BIRRHEDOUZQCLA-GOSISDBHSA-N 382.423 5.164 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(N=Cc2cc(Br)ccc2O)cc1 915113170 PRIODPGNXHTFLH-HXUWFJFHSA-N 391.268 5.561 30 20 GKED CCCOc1ccc(C(C)=NNc2nncc3ccccc23)cc1OCCC 915909771 QTQPZMCQJLRUAO-UHFFFAOYSA-N 378.476 5.044 30 20 GKED CC(C)N(C)c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1F 916433314 NQOUJHKDTQJZCK-UHFFFAOYSA-N 387.458 5.461 30 20 GKED COc1cc2c(cc1NC(=O)CSc1ccc(C#N)cc1)oc1ccccc12 916671294 AOTZSXOPRUJJRY-UHFFFAOYSA-N 388.448 5.197 30 20 GKED COc1ccc(OCc2nc(/C=C3\C(=O)c4ccccc4C3(C)C)cs2)cc1 920070342 OWFRBCIDFBXUDZ-UDWIEESQSA-N 391.492 5.288 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 921005752 KDGFSKWTHAFNMI-DEOSSOPVSA-N 384.479 5.310 30 20 GKED Cc1c(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)cccc1C(=O)O 1776088156 UEQAEKJJFXOMSS-CQSZACIVSA-N 376.378 5.448 30 20 GKED C=C(C)COc1cc(/C=C\c2cc(C(=O)O)c3cc(C)ccc3n2)ccc1OC 1776140052 GHNKZFIZXTYWOM-VURMDHGXSA-N 389.451 5.375 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3c(F)cc(C(=O)O)cc3F)s2)cc1 1777430593 NNXRZDVBXQPFMJ-BQYQJAHWSA-N 399.418 5.299 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ncc(Cl)cc3Cl)c2c1 1777684127 WLHWTUWIEYIAKB-IWQZZHSRSA-N 378.236 5.197 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/Cc4c(Cl)cccc4C3=O)s2)c1 1777684346 UJCHXMRORZBLBP-UVTDQMKNSA-N 380.852 5.589 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCc2ccc(-c3ccccc3F)o2)cc1 25439032 AXOFWTNLXRXZQG-UHFFFAOYSA-N 376.431 5.458 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)cc2C)[n+]2ccc(C)cc2)cc1 27177337 NFPHBBXVWDBYDO-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCN(C(=O)c1cc(C)on1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 61204824 DQTRYTSFLBRHAZ-UHFFFAOYSA-N 394.283 5.246 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 63961939 MTYYNTXQFOLRLH-UHFFFAOYSA-N 375.375 5.056 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2ccc(/C=C/C(=O)c3cccc(C#N)c3)cc2)c1 96297957 UBTXMIPXDVKZMO-HEEUSZRZSA-N 388.426 5.222 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 113570661 MHNGKMVCWQMAJM-INIZCTEOSA-N 383.517 5.650 30 20 GKED Cc1cccnc1[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)C(C)C 115622661 URSAPEXRRFXOCS-XMMPIXPASA-N 385.511 5.328 30 20 GKED N#CCCCOc1cccc(NC(=O)COc2ccc(Cl)c3ccccc23)c1 117534577 TZQHNSNMFPWQJZ-UHFFFAOYSA-N 394.858 5.193 30 20 GKED COc1cccc2cc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)oc12 120033148 AYSDPOPXCIKEDY-LBPRGKRZSA-N 382.828 5.195 30 20 GKED N#C[C@@H](C(=O)Cc1c(F)cccc1F)c1nc(-c2ccc(Cl)cc2)cs1 120113277 GRLAKMNTOWUGAU-AWEZNQCLSA-N 388.826 5.161 30 20 GKED Cc1ccc(Br)c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 129639966 KXUVAHIHOORQPN-APWZRJJASA-N 398.304 5.061 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCC[C@H]1c1cccc2ccccc12 135250870 UUONXUIXNWOMCN-NRFANRHFSA-N 389.430 5.250 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(CSC3CCOCC3)c2)cc1 151022794 PBDUKKNAYFWHNU-KRWDZBQOSA-N 382.529 5.002 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 151402605 UVEILNNPXDTBAJ-JPYJTQIMSA-N 384.483 5.154 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 153035866 HMOWKFQIXDXLDO-JOCHJYFZSA-N 386.455 5.361 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccccc1 155488587 ZECYLMXHEYLXOR-OAQYLSRUSA-N 389.455 5.361 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc2c(C)c(C)[nH]c12 171020464 MDDFEZSKSLIBAA-UHFFFAOYSA-N 396.450 5.404 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)n1 177743409 MLQCPTITOOJTTK-JQWIXIFHSA-N 383.300 5.217 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(NC(=O)C3CCCCC3)c2)n1 177759576 YYHVSTHBBNPRSB-SFHVURJKSA-N 395.528 5.275 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2NC(=O)c2cccs2)n1 177767872 MTXVSWWSFXZLSE-CQSZACIVSA-N 395.509 5.070 30 20 GKED N#C[C@H](C(=O)Cn1c(C2CCCCC2)nc2ccccc21)c1nc2ccccc2o1 179457968 MYUJVCDPBPIDNU-QGZVFWFLSA-N 398.466 5.102 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@@H](C)c1cc2ccccc2o1 184359164 APFPNZCFVHYOOO-HOTGVXAUSA-N 377.444 5.339 30 20 GKED N#C[C@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1cnc2ccccc2n1 190951936 CFMUCWCQOWXHHW-FQEVSTJZSA-N 395.487 5.412 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2occc2CSc2ccccc2)cc1 193309760 UQYMTZMVVWFHIW-UHFFFAOYSA-N 376.481 5.625 30 20 GKED COc1ccc(COc2cccc(F)c2)cc1NCc1ccc(C#N)cc1F 195732257 HYPCLSJWTQCDHH-UHFFFAOYSA-N 380.394 5.036 30 20 GKED O=C(/C=C\c1cn(Cc2ccccc2)nc1-c1cccs1)c1cncs1 222068425 GZDAZANKEBJKKG-HJWRWDBZSA-N 377.494 5.013 30 20 GKED Cc1ccccc1[C@H]1CCCN1CC(=O)Nc1ccccc1S[C@H](C)CC#N 247040437 FNCPHDFAGPBEEK-WIYYLYMNSA-N 393.556 5.165 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c2[C@@H]1C 297760860 IXPMYKWEDWGYOU-JGVFFNPUSA-N 385.436 5.033 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(Br)ccc1F 321920409 TXOKSFHAADOFJY-CYBMUJFWSA-N 377.257 5.444 30 20 GKED OC(=Nc1ccc(F)cc1Cl)N[C@@H]1CCCc2cn(C3CCCC3)nc21 329384833 PRFIEWLOWPGHTJ-QGZVFWFLSA-N 376.863 5.003 30 20 GKED Cc1c(C(=O)Nc2cccc(N=C(O)C3CCCCC3)c2)[nH]c2c1C(=O)CCC2 330230644 QPUJUWXWACHIDT-UHFFFAOYSA-N 393.487 5.263 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 409574121 DQSNJFLTMJAWHW-UHFFFAOYSA-N 378.428 5.464 30 20 GKED C=C(C)C[C@H](C)C(=O)N(c1ccc(Cl)cc1)c1nc(C(=O)OCC)cs1 411058052 BYTGEGQOYVWHIT-ZDUSSCGKSA-N 392.908 5.240 30 20 GKED COCc1cc(Cl)ccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 425734178 KZSFNUSECZAXFM-UHFFFAOYSA-N 385.895 5.048 30 20 GKED CCOc1ccc(Cl)cc1CCNC(=O)N[C@@H](CCCC#N)c1ccccc1 431451897 VAORDJOXVCWQMC-FQEVSTJZSA-N 399.922 5.016 30 20 GKED N#Cc1ccc(CSCc2ncccc2C(F)(F)F)c(Br)c1 432255168 ALPTWKQGTIGJDM-UHFFFAOYSA-N 387.224 5.168 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1)c1ccccc1 435114573 UJVMCMKGUPPKAW-NHCUHLMSSA-N 394.515 5.258 30 20 GKED CCN(Cc1ccc2ccccc2c1)Cc1cn(CCC#N)nc1-c1ccncc1 435123764 IVKREHNWLOFHNG-UHFFFAOYSA-N 395.510 5.034 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 436410726 KXHOZHBTWIMHRZ-QFBILLFUSA-N 388.433 5.633 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1F 438046145 WNHDFBDRZJBZFS-ZIAGYGMSSA-N 389.471 5.142 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(NC(=O)c2ccccc2)c1 439565202 QZLIQASGQYVCLY-LJQANCHMSA-N 399.494 5.795 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)CCCC1(C)C 445236030 GGUQQXRHTGQTQE-FQEVSTJZSA-N 395.503 5.439 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(COCCOC(C)C)c2)CCCC1(C)C 445240098 CNDQVOQIMWXRHE-OAQYLSRUSA-N 388.552 5.227 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2cccc(CSCc3ccccc3)c2)C1 454794691 LDRGZAZUETVLNY-UWJYYQICSA-N 379.529 5.324 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 466602205 QVODDOUGZRXEMX-LAUBAEHRSA-N 376.500 5.027 30 20 GKED Cc1nc(NC(=O)C[C@@H](CC#N)c2ccccc2)sc1Cc1cccc(F)c1 474953957 OLRDOGMZZWWLGZ-GOSISDBHSA-N 393.487 5.208 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)Cc1ccco1 475566552 SXYYMNMEUWODRP-UHFFFAOYSA-N 388.511 6.366 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC[C@H]2c2cccnc2)cc1 479516327 MUANFQYUUHRQNW-NRFANRHFSA-N 385.492 5.082 30 20 GKED C[C@@H](NCc1ccc(C#N)c(F)c1)c1ccc(OCc2ccc(F)cc2)cc1 484082308 GNRUVUKSLNANAG-MRXNPFEDSA-N 378.422 5.266 30 20 GKED CN(C(=O)[C@@H]1CCC(F)(F)C1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 484087488 YYNSXPDAYDTCSN-PWSUYJOCSA-N 389.286 5.203 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2ccc(Cl)cc2)on1)c1ccccc1 487294376 CYFSIXARDHXDJI-SFHVURJKSA-N 379.847 5.160 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 490312175 DVMNAVWLCPRPSP-HTAPYJJXSA-N 395.572 6.108 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c(Cl)c1 494671328 ICYJRKXKMQIJNM-UHFFFAOYSA-N 376.843 5.351 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 495438837 JAZYQFBQPQMMJB-MRXNPFEDSA-N 391.496 5.424 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1sc(-c2ccco2)nc1-c1ccccc1 498493899 YSXMTBLONXVHCC-UHFFFAOYSA-N 399.475 5.214 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1cccc(OCc2ccc(Cl)cc2)c1 504401900 SBQXHFBDVTYZSH-UHFFFAOYSA-N 390.870 5.063 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1cc(F)ccc1OC 504726908 WXSHSODORYDFAW-LBPRGKRZSA-N 382.888 5.008 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)CC1 507581569 TVTSBBGEYCTKPV-SPXLFKILSA-N 378.491 5.040 30 20 GKED CCCN(C(=O)c1cccc(C#N)c1C)[C@@H](c1ccc(F)cc1)c1cccnc1 509429190 HLGCDXCPWZBQJM-QHCPKHFHSA-N 387.458 5.043 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1c(F)cc(F)cc1F 511102683 WYYMJLJVTIQJCJ-UHFFFAOYSA-N 398.409 5.057 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 511364469 PBDONCXIPACRGV-IBGZPJMESA-N 399.494 5.523 30 20 GKED Cc1[nH]c2ccccc2c1C1=CCN(C(=O)Nc2ccc(C#N)c(Cl)c2)CC1 517959353 ZAGCSTZBFMLBCG-UHFFFAOYSA-N 390.874 5.323 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N(Cc2cccs2)C2CC2)cc1 518028255 YZPSKZGWOWDADC-UHFFFAOYSA-N 392.455 5.356 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)CCc1ccccc1 520854490 UCAUNOUISNUCPW-KRWDZBQOSA-N 381.545 5.471 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 521644658 NZZHFHBFNVJNRU-HNNXBMFYSA-N 390.414 5.449 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(OC3CCCCC3)cc2)cc1 522762479 NHLMNPJIEXBPRK-UHFFFAOYSA-N 392.499 5.357 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccnc(Oc2ccccc2)c1 523348487 KYUUCMOOPDYMMQ-UHFFFAOYSA-N 385.467 5.044 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1sccc1C#N 524392155 YVMODIUDOWYJOJ-UHFFFAOYSA-N 382.872 5.413 30 20 GKED N#Cc1ccc(N2CCC(C(=O)c3ccc(Cl)cc3)CC2)cc1C(F)(F)F 524621246 WPYBNKZIPGACAS-UHFFFAOYSA-N 392.808 5.330 30 20 GKED C=CCOc1ccc(C(=O)N(C2CC2)C2CC(c3ccccc3C)C2)cc1OC 525605984 JEAXNAIYXBIBSO-UHFFFAOYSA-N 391.511 5.119 30 20 GKED CN(C(=O)c1ccc(C#N)cn1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 531150600 CRNIWNJPEINDJX-UHFFFAOYSA-N 396.277 5.122 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(-c2cccnc2)s1 534912294 CYRORGHVPOAMRH-UHFFFAOYSA-N 388.477 5.058 30 20 GKED N#CCCn1cc(CNc2cccc(OC3CCCC3)c2)c(-c2ccccc2)n1 538831928 GAAPIYGSMDYLQJ-UHFFFAOYSA-N 386.499 5.397 30 20 GKED C[C@@H](NC(=O)Nc1ccc2c(c1)COC2)c1ccc(-c2cccc(C#N)c2)cc1 543889016 NJLVTATWWLQIGU-MRXNPFEDSA-N 383.451 5.138 30 20 GKED CC[C@H](CC#N)NCc1ccc(OCc2cccc(C(F)(F)F)c2)c(OC)c1 547286438 ZLSAUDRJXACQMK-GOSISDBHSA-N 392.421 5.075 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC(C)(C)C(F)(F)F 549185089 URZOOUILJMUMRZ-UHFFFAOYSA-N 391.393 5.369 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H]1CC[C@H](C#N)C1 549933783 BQWWAGCGPIZOTB-UBHSHLNASA-N 390.350 5.224 30 20 GKED Cc1ccc2nc([C@H]3CCCN3C(=O)Nc3ccc(C(C)(C)C#N)cc3)[nH]c2c1 554536638 HFQMORCABRHKBI-HXUWFJFHSA-N 387.487 5.042 30 20 GKED N#Cc1nc(N2CCC([C@H](F)c3ccccc3F)CC2)ccc1C(F)(F)F 561360500 VCVJWWIVUUPXEX-SFHVURJKSA-N 381.348 5.038 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccs2)o1)c1nc(-c2ccncc2)cs1 566936031 PFWRAEIBNAXKHS-ZDUSSCGKSA-N 377.450 5.017 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)SCCOc1cccc(C#N)c1 575212315 QDGWVZOWGUSYGY-IAGOWNOFSA-N 382.529 5.211 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1F 577184570 DYUCUSLQMYUHIK-JOCHJYFZSA-N 380.419 5.039 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1)C(F)(F)F 579631862 APJQUAZDCCJJID-ZBFHGGJFSA-N 376.378 5.042 30 20 GKED N#CCCCCCC(=O)N(c1cccc(Br)c1)C1CCCCC1 588931428 BFUZVPVTFYEBHZ-UHFFFAOYSA-N 377.326 5.589 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(Cc3ccc(OC)cc3)CC2)c1 589740081 JEEHGYZXALXJQA-UHFFFAOYSA-N 394.515 5.137 30 20 GKED COc1ccc(-n2cnnc2SCc2ccc(-c3ccccc3C#N)cc2)cc1 591590786 YUIKIVNLIJPCMI-UHFFFAOYSA-N 398.491 5.107 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CC3(C#N)CCCCC3)c2)cc1 596827537 ONCYCENYZJESTD-UHFFFAOYSA-N 387.483 5.134 30 20 GKED CC(C)Nc1cc(Br)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 598235717 VCLMVPPGKYMENE-UHFFFAOYSA-N 398.304 5.077 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 609501849 GHTGPMUKUSSRDS-DLBZAZTESA-N 388.389 5.106 30 20 GKED CC(C)c1ccc(CCCNC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 609726434 JRQMEAOLZNIZCS-UHFFFAOYSA-N 399.494 5.232 30 20 GKED CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 610010281 HQUHRRVYNFVMFJ-DNVCBOLYSA-N 382.533 5.038 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)NCc1ccc(C#N)cc1F)C1CC1 610664005 LUYZGCLDTVEIFO-MRXNPFEDSA-N 387.458 5.286 30 20 GKED CC(C)(C#N)CNC(=O)c1c(Cl)cccc1Oc1ccc(F)c(Cl)c1 614863917 DIQIYMJWPBYYMF-UHFFFAOYSA-N 381.234 5.204 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Cl)c3ncccc23)c2ccccc21 618177310 RKFHAPPIHBKLHF-UHFFFAOYSA-N 388.858 5.399 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(N)c1C)c1ccc(C(F)(F)F)cc1 625915958 FPDOACSATZSVKU-GOSISDBHSA-N 377.410 5.425 30 20 GKED O=C(NCc1c(F)c(F)cc(F)c1F)Nc1ccccc1CCC(F)(F)F 674989686 FWPLZKDVPKNUJQ-UHFFFAOYSA-N 394.290 5.060 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1nc2ccccc2s1 684682309 UETXACIUFBRQLO-GOSISDBHSA-N 388.423 5.718 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Oc1c(Cl)cc(C#N)cc1OC 729945945 WATTYGCCTHGJDH-QGZVFWFLSA-N 387.863 5.107 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1cc2c(ccc3ccccc32)o1 734095094 JUNVRLGLORCFDF-QBFSEMIESA-N 378.431 5.727 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 735171980 QPUAXGWLFWMCSC-IBGZPJMESA-N 375.497 5.460 30 20 GKED N#CCOc1ccc(Cl)cc1CSCCC(=O)Nc1ccccc1Cl 735320565 XZFJPFDABPEOCW-UHFFFAOYSA-N 395.311 5.158 30 20 GKED CCO[C@@H](C)c1nc(COC(=O)c2ccccc2-c2ccccc2C#N)cs1 736747945 VDEPHPVCFMBXTL-HNNXBMFYSA-N 392.480 5.136 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738893990 CNANUUUEWNYYMH-XZOQPEGZSA-N 384.483 5.352 30 20 GKED O=C1/C(=C/c2csc(-c3ccc4c(c3)OCO4)n2)Cc2cc(Cl)ccc21 742436646 DLGHPHLOGQNXSA-NTUHNPAUSA-N 381.840 5.015 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc(Oc2ccccc2)c(F)c1 745613271 CKNBGCJKQQNHLZ-UHFFFAOYSA-N 378.407 5.437 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cc1)c1sc(-c2cccnc2)nc1C 746579740 XEHQLDWVPZYTMA-UHFFFAOYSA-N 376.407 5.368 30 20 GKED CSc1nc2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2s1 748499925 CZMHQHBUVVDFOR-OAHLLOKOSA-N 382.514 5.185 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)cc1)c1ccc(Oc2ccccc2)c(F)c1 750913456 MZHALBFLUYPRQD-WQLSENKSSA-N 385.398 5.095 30 20 GKED C[C@H](OC(=O)CSc1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 751708895 UJFIPBDGWPWYIS-ZDUSSCGKSA-N 398.871 5.263 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)CCSc2ccc(Cl)cc21 753145213 XDGQTFBGGNYNQK-XFXZXTDPSA-N 384.913 5.621 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)N[C@H](C)c1cccc(C#N)c1 754479343 NWNPRJPJPBYTHD-OAHLLOKOSA-N 394.475 5.096 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CC)cc1 760889132 VKRKIINPYQOCKS-MRXNPFEDSA-N 384.907 5.290 30 20 GKED Cc1ccsc1/C=C1/CC(O)(C(F)(F)F)C/C(=C\c2sccc2C)C1=O 764431302 AXSXKDKLUIJSRP-MFUUIURDSA-N 398.471 5.550 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(/Cl)c2nc3cc(C(F)(F)F)ccc3o2)cc1 764434753 ZBHDTAHMTBMZPX-OXFWXOROSA-N 392.764 5.874 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](CC(F)(F)F)c1ccc(F)cc1 775201898 HVDFDBIMJKBYSM-MRXNPFEDSA-N 386.776 5.165 30 20 GKED O=c1[nH]ccc2cc(NN=C3CC[C@@H](c4ccc(C(F)(F)F)cc4)C3)ccc12 789077457 SMEIRBNVCLJVCO-CQSZACIVSA-N 385.389 5.283 30 20 GKED CCC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](O)c1ccccc1 791816915 CIXBVNPSXLDDNH-NBHGPNQESA-N 397.544 5.105 30 20 GKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1nc(Br)ccc1F 794969332 ICZSZZMBCLLLTL-VQHVLOKHSA-N 389.249 5.003 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)NCCCCC(F)(F)F)c2)cc1 794978401 USOZGIMAGKZVED-UHFFFAOYSA-N 393.434 5.370 30 20 GKED COCCCC[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 795002638 PCXONIBLYCTSJW-IBGZPJMESA-N 387.936 5.056 30 20 GKED O=C(/C=C\c1ccc2ccc(Br)cc2n1)c1cnn(C2CCCC2)c1 799895878 BVHMQBZPYHOZRX-KTKRTIGZSA-N 396.288 5.205 30 20 GKED Cc1cncc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 878676185 OSXAVFNSFAVJBM-VQIMIIECSA-N 380.517 5.153 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc(C2(NC(=O)OC(C)(C)C)CCC2)no1 904553143 ZZSSMKOZECNCHX-SFHVURJKSA-N 397.519 5.462 30 20 GKED C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915085904 PYNIPJCOMOVJMT-JXFKEZNVSA-N 390.870 5.401 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H]1CCc2ccccc21 915351645 AMNNOUBUPXTULQ-ZEQRLZLVSA-N 381.479 5.493 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352513 LOFCWAFVTPDAPN-OAQYLSRUSA-N 389.886 5.659 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 917420596 ULUIIAHCOCPJSZ-CQSZACIVSA-N 377.494 5.255 30 20 GKED CC(=NOCc1ccc(C(F)(F)F)cc1)c1cc(C(=O)O)ccc1OC(C)C 1776112222 NJVQEBVXQYGLFK-UHFFFAOYSA-N 395.377 5.132 30 20 GKED C=CCc1ccccc1/C=C1\CN(CC)Cc2c1nc1ccccc1c2C(=O)O 1776187695 HWAQADCJNGCRDZ-XMHGGMMESA-N 384.479 5.038 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2ccccc21 1776526450 CJXZTFOOGOSUJO-GHRIWEEISA-N 388.488 6.061 30 20 GKED CCCCCCCOc1cccc(/C=C(/CC(=O)O)c2nc3ccccc3o2)c1 1776789102 RBGVHIGAECECDO-CYVLTUHYSA-N 393.483 6.192 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/COc4ccc(Cl)cc4C3=O)s2)c1 1777684310 LTHHFLOXBGAWFG-ZROIWOOFSA-N 396.851 5.425 30 20 GKED Cc1noc2nc(-c3ccccc3)cc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c12 25439583 WYDFEMAHCCELNS-UHFFFAOYSA-N 396.450 5.252 30 20 GKED N#CCCCCOC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 28074082 BEVBUWWTELWLQL-UHFFFAOYSA-N 382.510 5.439 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc(-c2ccccc2)cs1 51534281 KNFICUCXIKZLSF-INIZCTEOSA-N 387.489 5.424 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccc(C)cc2)cs1 54894961 ZTYVEDMKVQCGKE-FMIVXFBMSA-N 396.899 5.686 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 55770212 YHVOUYTWLAVDNF-UHFFFAOYSA-N 390.439 5.078 30 20 GKED C=CCN(CCC(=O)Nc1ccccc1-c1ccccc1)Cc1cccc(C#N)c1 63300304 QOJIHBYFTABTHQ-UHFFFAOYSA-N 395.506 5.242 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(Cl)cc1Cl 78714762 YYQBEOGAYJLMJQ-LBPRGKRZSA-N 394.327 5.567 30 20 GKED CCc1nc([C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)cs1 78881008 HHCWQCGLMCZXLQ-CQSZACIVSA-N 393.537 5.219 30 20 GKED N#CCC[C@@H](NCc1ccc(OC(F)F)c(Br)c1)c1ccccc1 92568141 ZBNKGVXQTWFXHF-MRXNPFEDSA-N 395.247 5.185 30 20 GKED COc1ccc(CSc2nnc(S[C@@H](C#N)C3CCCCC3)s2)cc1 115185922 PGJXLRRWLKAHKA-INIZCTEOSA-N 391.587 5.404 30 20 GKED Cc1nc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)sc1SCC#N 131005712 CWSQTSNWKWFZSK-UHFFFAOYSA-N 392.720 5.280 30 20 GKED Cc1nc(SCc2nnc(-c3ccc(C#N)cc3)o2)n(C2CCCCC2)c1C 133873706 GVBDTCBIMFTULR-UHFFFAOYSA-N 393.516 5.219 30 20 GKED CC(C)c1ccccc1-n1c(SCCCCC#N)nnc1-c1cccnc1 135960945 ZJLWYWSZLWBGNB-UHFFFAOYSA-N 377.517 5.239 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cnn1C(C)(C)C 173533482 KZZKGRTYLFHECL-UHFFFAOYSA-N 392.434 5.002 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)c1 181766936 APNPPUKKWGHLQW-UHFFFAOYSA-N 382.769 5.294 30 20 GKED Cc1csc([C@@H](C)CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 185219634 ODIHLGCJYUVNCY-AWEZNQCLSA-N 392.484 5.041 30 20 GKED COc1ccc(CN[C@H](C)c2cc(Cl)ccc2Cl)cc1OCCCC#N 189270777 YRNJJSPOVDBBBI-CQSZACIVSA-N 393.314 5.535 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 303713222 QGZVQFSXKDIZIY-BUXKBTBVSA-N 379.262 5.139 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)sc1SCC#N 409817899 IKHVVHGMXMTPMT-NEPJUHHUSA-N 398.340 5.116 30 20 GKED Cc1c(-c2nc(-c3cnc(-c4ccccc4)nc3)no2)sc2ccc(C#N)cc12 426388992 JOULJTPVGRSJIA-UHFFFAOYSA-N 395.447 5.255 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1OC 430579697 CQPUFCSKERJCCJ-HNNXBMFYSA-N 386.517 5.118 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cs1 430601709 JPIWIVDZYRSZGM-AWEZNQCLSA-N 381.526 5.363 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(F)(c2ccccc2)CC1 432859031 LSPNHAATKHBFQI-QGZVFWFLSA-N 397.519 5.431 30 20 GKED Cc1c(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cccc1-c1ncco1 433115797 JHQCPXDALZZLNV-CQSZACIVSA-N 392.484 5.546 30 20 GKED N#CCC[C@H](NC(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 440245548 QTYHZMQAXZIXEF-VQTJNVASSA-N 399.947 5.185 30 20 GKED C=C[C@@](C)(CC)C(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 442902606 WRRSEMACHUEJHV-YKSBVNFPSA-N 376.500 5.027 30 20 GKED C=CCCCNC(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 448522672 VWWKPNZLCBZRNP-UHFFFAOYSA-N 383.542 5.155 30 20 GKED CC(C)n1c(S[C@H]2CC[C@H](C#N)C2)nnc1-c1ccc(Cl)cc1Cl 450592920 HYSQVUPAXMTXSK-AAEUAGOBSA-N 381.332 5.617 30 20 GKED CC[C@H](CC(F)F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457750612 MGBJVEODXFVHAB-SKDRFNHKSA-N 391.302 5.497 30 20 GKED C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458797224 GBOJHROPKNVDFR-UEVCKROQSA-N 375.516 5.084 30 20 GKED CCN(C(=O)c1cc2cc(C(F)(F)F)ccc2n1C)[C@H](C)c1ccc(C#N)cc1 463138608 AKHHBMNMWUBREH-CQSZACIVSA-N 399.416 5.292 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)cc2)cs1 464425853 LEYHPCMCOLUHKM-OAHLLOKOSA-N 387.386 5.022 30 20 GKED O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccoc1C(F)(F)F 464526213 IJHZITXBVAWMGV-SNVBAGLBSA-N 389.654 5.124 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2 469909963 VCTKLWZMTGKXNG-UHFFFAOYSA-N 398.510 5.212 30 20 GKED CCC(O)(CC)CCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 472336221 DUZNPOVENCKDAB-IBGZPJMESA-N 399.922 5.058 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cnn1-c1ccc(Cl)cc1 473505979 CGVKKGHTDMJTFB-HNNXBMFYSA-N 398.919 5.158 30 20 GKED CC[C@H](CC#N)NC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 475012496 IIMXPCDQLXFIGH-MRXNPFEDSA-N 391.393 5.098 30 20 GKED N#CC[C@H](CC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1)c1ccccc1 476331229 AVYGCAUXBIAGOX-LJQANCHMSA-N 398.428 5.409 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2)cc1 483242513 KNFLKDRCLBOJOJ-HSZRJFAPSA-N 389.414 5.389 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3cc[nH]c3n2)cc1Cl 499780799 XZGXWWMTDLMLMA-SFHVURJKSA-N 386.842 5.124 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2cc(Cl)ccc12)c1c(Cl)cccc1Cl 499797615 IKLRVKIKCROGLM-MRXNPFEDSA-N 392.673 5.052 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1cccc(C(F)(F)F)c1 505927670 BFIPSAWQEFHYDY-INIZCTEOSA-N 388.320 5.099 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2nc(C(C)C)oc2C)cc1 509040338 SOFZUZXNHFBWCR-UHFFFAOYSA-N 391.427 5.031 30 20 GKED CCc1cc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)c2c(C(C)C)noc2n1 509090642 RYAYSKFIMZGATL-UHFFFAOYSA-N 390.487 5.083 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2cccc(C#N)c2)cc1F 510279683 CGOSEYMNCOLZKI-UHFFFAOYSA-N 376.387 5.059 30 20 GKED CCCc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)sc1C 514424745 ZENYOXPKRMFNEU-UHFFFAOYSA-N 391.496 5.629 30 20 GKED C=CCn1c(SCCCC(=O)c2ccc(F)cc2)nnc1-c1ccccc1F 515306482 VDAGTFZMCSWAAP-UHFFFAOYSA-N 399.466 5.165 30 20 GKED N#Cc1c(NC(=O)c2sccc2Br)sc2c1CCCCCC2 515449076 IUHFDDRSTXPLTO-UHFFFAOYSA-N 395.347 5.355 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)N(Cc1ccco1)c1ccccc1C#N 515636886 REKQCORRZFYMBT-OAHLLOKOSA-N 396.899 5.519 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N(CC3CC3)C3CCCCC3)s2)cc1 522092808 QFFSXRUVHHSPGC-UHFFFAOYSA-N 394.544 5.182 30 20 GKED C[C@@H](C#N)CN(C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)C1CC1 532820865 RHDGJUUCMKAENP-HNNXBMFYSA-N 384.932 5.397 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cnc(-c3ccsc3)s2)cc1 538002358 KSBZVIFZMPZGOF-UHFFFAOYSA-N 387.533 5.700 30 20 GKED CC1(C#N)CCN(C(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)CC1 543744582 WTMBYAKNCREDNH-UHFFFAOYSA-N 386.826 5.339 30 20 GKED C[C@H](N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543861580 RLDRZWQMAHMZDQ-OALUTQOASA-N 393.490 6.292 30 20 GKED COc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2ccccc2)cc1Cl 550969193 POBHCLKJBRGPBO-CQSZACIVSA-N 398.919 5.381 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 556976150 HASXNTISTHRYRM-UHFFFAOYSA-N 399.469 5.288 30 20 GKED C[C@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccccc1OC(F)F 576554698 UHAXYCPXYZUKEU-QMMMGPOBSA-N 395.274 5.076 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Oc3ccccc3)cn2)s1 584568618 BGRUKTMLTZMCNF-MRXNPFEDSA-N 377.469 5.118 30 20 GKED COc1ccccc1C=NOCc1cc(-c2c(OC)ccc3ccccc23)no1 588394678 CYFPTTHJLGNOGQ-UHFFFAOYSA-N 388.423 5.063 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 588987541 LSGKCBFEVQGAKA-UHFFFAOYSA-N 387.826 5.322 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](C)c2ccccc2OC(F)F)c1 589740529 XLZBIPOFBNETDB-AWEZNQCLSA-N 376.403 5.126 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CC[C@](C)(C#N)C2)c(C(F)(F)F)c1 596712267 XUHQYYNCIWWINN-SJKOYZFVSA-N 385.455 5.363 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3cccnc23)cc1Cl 603758999 QYIQUMMVKRRIFL-NRFANRHFSA-N 397.865 5.796 30 20 GKED CCc1noc(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603765971 GULMATBMJQFANC-QGZVFWFLSA-N 379.847 5.107 30 20 GKED Cc1ccc(-n2c(SCc3ccccc3C#N)nnc2-c2ccccn2)c(C)c1 603917913 MSZCNFMNYOXZFU-UHFFFAOYSA-N 397.507 5.110 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 608785990 HJAKQAKDMZLYQJ-UHFFFAOYSA-N 375.497 5.293 30 20 GKED N#CCn1c(C(=O)N2CCC(c3cccc4ccccc34)CC2)cc2ccccc21 609169551 DHNBLMQAISBYIV-UHFFFAOYSA-N 393.490 5.338 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cc(F)c(F)cc2F)cc1 609299425 UPWVAPFTSDNUPH-UHFFFAOYSA-N 386.304 5.159 30 20 GKED CC[C@@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 609389468 RXDPJBFCJSAWDO-VQIMIIECSA-N 384.570 5.904 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434451 LEZLDBWUBKNAPC-UHFFFAOYSA-N 397.887 5.729 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cccc2ccccc12 609435177 WLIQJZLZTAZZJY-KRWDZBQOSA-N 389.524 5.898 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 609682758 AWGHHAYWXHJDOW-WIYYLYMNSA-N 397.478 5.760 30 20 GKED C[C@@H](NC(=O)CS[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 609825562 FQUWYLBKKMYAON-CHWSQXEVSA-N 393.339 5.537 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1cccc(CSC2CCCC2)c1 610122062 OOMIADYBSYBVCO-INIZCTEOSA-N 380.513 5.140 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)c1cc2ccccc2n1CC#N 610434561 UQHVOEPJJOYKMC-UHFFFAOYSA-N 395.462 5.305 30 20 GKED CN1CC[C@H](CN[C@H]2CCCc3cc(C#N)ccc32)[C@@H]1c1ccc(Cl)c(F)c1 611395221 VGPBRBKAISWPHC-LEOXJPRUSA-N 397.925 5.011 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1ccc2ccccc2n1 613290842 NYUUNKGRLULTAR-INIZCTEOSA-N 389.867 5.502 30 20 GKED C[C@@H](NC(=S)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 729160648 ZNIJAGMFFNIZKI-CQSZACIVSA-N 379.510 5.460 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCc3sccc3C2)cc1 730664386 GYPJZYIETOGDEJ-OAQYLSRUSA-N 387.508 5.384 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C\c1csc(COc3ccc(Cl)cc3)n1)C2 730948529 GRLJGEGQQTWCNW-GDNBJRDFSA-N 381.884 5.506 30 20 GKED CC(C)c1ccc(C2(C(=O)[C@@H](C#N)c3nc4ccccc4n3C)CCCC2)cc1 731136609 VLJDMJLLLMWUOU-HXUWFJFHSA-N 385.511 5.385 30 20 GKED N#C[C@H](NC(=O)c1sc2ccccc2c1Cl)c1ccc(Cl)c(Cl)c1 731644493 RYJJSAZAASKDSJ-ZDUSSCGKSA-N 395.698 5.856 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(-c3ccccc3)cc2)cc1 733616297 QDSVTOLXIBTORI-UHFFFAOYSA-N 386.455 5.305 30 20 GKED CCOc1ccc(C=Nc2cccc(C[S@](=O)C3CCCCC3)c2)c(O)c1 734979909 VIQLUYIMLYAVLN-MHZLTWQESA-N 385.529 5.123 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccc(OC3CCCCC3)cc2)c1 735442738 LKWVGVMMLDKEAA-FQEVSTJZSA-N 392.499 5.009 30 20 GKED Clc1ccc(NN=Cc2sc(N3CCCC3)nc2Cl)cc1Cl 735971331 ZHQAWHPCIJKAQB-UHFFFAOYSA-N 375.712 5.150 30 20 GKED N#Cc1ccc(SCC(=O)N2c3ccccc3Sc3ccccc32)c(F)c1 741447519 MVUZBOIOKHKWPZ-UHFFFAOYSA-N 392.480 5.619 30 20 GKED COCc1ccc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1 741842063 REXBBZISVZODHZ-SFQUDFHCSA-N 379.456 5.308 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1cccc(Cl)c1 744035484 MRBCZVSSHOQGCN-YGRLFVJLSA-N 375.280 5.583 30 20 GKED N#CCC1(COC(=O)c2oc3ccccc3c2CSc2cccs2)CC1 744275433 GNAWVUQLGJAHHJ-UHFFFAOYSA-N 383.494 5.637 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=S)Nc1ccccc1C#N 745685853 ALTVHXATQXOGLE-UHFFFAOYSA-N 377.435 5.184 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)NC1CCCCC1 745724780 WUHQSIITKWLXLX-UHFFFAOYSA-N 381.520 5.220 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1cc(Oc2ccccc2)ccn1 745976752 KNIIXAHQIVCOIV-UHFFFAOYSA-N 394.814 5.017 30 20 GKED O=C(/C=C\c1cc(Cl)c2c(c1)OCCO2)c1ccc(-c2ccncc2)cc1 745990143 LQBIHUMUSLNHCR-BHQIHCQQSA-N 377.827 5.069 30 20 GKED CCN(c1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1)C(C)C 752620583 SHAIDFDOOZAMBS-DHIUTWEWSA-N 390.531 5.225 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@H]2c2ccc(Br)s2)cc1 753589533 IVKIXFPALXUBLZ-BBRMVZONSA-N 391.334 5.139 30 20 GKED CCc1cnccc1C(=O)/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1 766772750 YTDPMRMFFMVHNR-KHPPLWFESA-N 390.870 5.446 30 20 GKED CC(C)N(C)c1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1F 767679530 AUHLUHVBUWLCRK-UHFFFAOYSA-N 392.478 5.181 30 20 GKED COc1ccccc1-c1nc(CNc2ccc(OC(C)C)c(C#N)c2)cs1 771882250 XYFUKOMEVCZRCZ-UHFFFAOYSA-N 379.485 5.090 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Br)c(F)c2)c1 772985278 WADOJDAOIHKTKQ-CJNGLKHVSA-N 391.284 5.120 30 20 GKED C[C@H](OC(=O)c1ccc(F)cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 784670500 FETSPWREFSAFFQ-QMMMGPOBSA-N 381.247 5.176 30 20 GKED C[C@H](OC(=O)c1ccc(C(C)(C)C#N)cc1)c1nc2ccccc2n1C(F)F 796039826 RRXIKEIHPYJZFH-ZDUSSCGKSA-N 383.398 5.151 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1C(F)F)c1nc(-c2ccc(Cl)cc2Cl)cs1 802044200 JJMDCWQIVHPFQY-GARJFASQSA-N 387.238 5.194 30 20 GKED N#C[C@H](C(=O)C1c2ccccc2Oc2ccccc21)c1cc(C(F)(F)F)ccn1 813211130 DWGMEVMIUNLZDP-INIZCTEOSA-N 394.352 5.214 30 20 GKED COc1ccccc1C1(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)CCCCC1 815971143 VBHYHDGJGCFFHD-INIZCTEOSA-N 382.529 5.353 30 20 GKED COc1cccc(C=Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1O 915983149 RHGLEMWQRMXLTF-UHFFFAOYSA-N 389.238 5.646 30 20 GKED Cc1ccc(CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1C 917044607 TVYGIWVPWHZSNE-OAHLLOKOSA-N 388.414 5.351 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(F)cc1C=NNc1cccc(C(=O)O)c1 1776038025 OGULLYIPQXOGIA-UHFFFAOYSA-N 398.821 5.724 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C(=O)O)c1cc(Cl)cc(Cl)c1 1776180272 OWIBERXXBWJGIF-OAHLLOKOSA-N 390.719 5.522 30 20 GKED CCC(=O)Nc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776676239 JXJGMUYMRQAOFB-BNCCVWRVSA-N 399.446 5.296 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCOc4ccc(F)cc4C3=O)s2)c1 1777684305 KUVUXBLOKIWDHA-KAMYIIQDSA-N 394.423 5.301 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4cc(F)cc(F)c4C3=O)s2)c1 1777684361 VQAHZMOLZQQYIJ-UVTDQMKNSA-N 396.414 5.604 30 20 GKED O=C1/C(=C\c2ccccc2OC2CCCCC2)C[C@@H](C(=O)O)c2ccccc21 1777698153 NZNAPNYAXKAFPQ-RUDRXDDOSA-N 376.452 5.236 30 20 GKED C=CCN(C(=O)C1CCOCC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 61204828 VMDVYFJDIUULJI-UHFFFAOYSA-N 397.327 5.063 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2occc2-c2ccccc2)cc1 65870144 DWWBXTPYLUGEEG-UHFFFAOYSA-N 386.451 5.013 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccncc1 120713975 MILIJHZUEWJRQR-IERDGZPVSA-N 389.886 5.523 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1 120773499 XKQUPNURGQXRQY-SJLPKXTDSA-N 378.501 5.105 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 123750917 RLZQOMDQTKXDAW-CABCVRRESA-N 399.564 5.224 30 20 GKED CC(C)(C)c1cnc(SCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)o1 129997350 WRNXAKJQRYXYAK-AWEZNQCLSA-N 397.525 5.064 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1cn(C)c2ccccc12 151005681 XECMDNQZCBGNKK-INIZCTEOSA-N 377.513 5.144 30 20 GKED N#CCC[C@@H](NC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1ccccc1 153397388 JQVLXLVCGIWGQC-DRUFCSCSSA-N 375.859 5.063 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1 157178324 RSFDZHRROFVANW-CQSZACIVSA-N 395.846 5.088 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1C1CC1 161162359 LMXBGOVUQHCAAA-APPDUMDISA-N 391.302 5.033 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2cc[nH]c12 173039936 FALRNVINPPNOHY-UHFFFAOYSA-N 381.435 5.179 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)cc1 174649419 DHCODQFQPHYRSV-IAGOWNOFSA-N 395.503 5.175 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(C3CC3)nc3ccc(F)cc23)n1 176188679 JMZXRWZIWKHVQZ-INIZCTEOSA-N 379.460 5.321 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)s2)ccc1OCc1ccccc1 176951305 DSWYZJGOGSEIMC-MRXNPFEDSA-N 378.497 5.058 30 20 GKED C=CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)c1nc(-c2ccccc2)cs1 182356107 QELVDDQPVKQFRA-UHFFFAOYSA-N 385.492 5.198 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)Oc1ccccc1OC 191461817 ZMHMTTHXZZBHFB-KRWDZBQOSA-N 382.504 5.136 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)ccc1OCC#N 213364756 WXKANBCVXWQPIV-KXFIGUGUSA-N 396.657 5.454 30 20 GKED CCOc1ccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)c2ccccc2)cc1 237113533 TXOQUXNJXHOJNP-CLOONOSVSA-N 386.495 5.255 30 20 GKED Cc1ccc(CN(C)C(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 301219264 ZCEDGRUTHISAAF-UHFFFAOYSA-N 386.520 5.431 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccccc1Oc1ccc(Cl)cc1Cl 303099514 GXKBQSTZOSLNQN-ZDUSSCGKSA-N 377.271 5.407 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 303713219 QGZVQFSXKDIZIY-BLVKFPJESA-N 379.262 5.139 30 20 GKED OC(=Nc1ccc2nc(C3CC3)oc2c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 328712770 BTOFDGSCDOEYGF-MRXNPFEDSA-N 393.409 5.305 30 20 GKED OC(=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)C1CCSCC1 329407901 CJQOQXPPFUPCKX-UHFFFAOYSA-N 397.569 5.901 30 20 GKED CC(C)(C)c1nnc(C/N=C(/O)N2CCC[C@H]2c2cccc3ccccc23)s1 329856714 YKLSNCJJNSVMKD-SFHVURJKSA-N 394.544 5.240 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1nc2c(s1)CCCCCC2 330321665 GDAALURJPLGIKT-ZDUSSCGKSA-N 391.562 5.097 30 20 GKED Cc1ccoc1CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 432682944 VZJLYZCGCMQEAZ-LJQANCHMSA-N 393.874 5.561 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccccc1OC(F)F 435358673 OTGOWRIOTPTBBD-OAHLLOKOSA-N 397.425 5.037 30 20 GKED COc1cccc([C@@H](C)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 437472832 ZSDDLBLGMPMJMH-OAHLLOKOSA-N 390.414 5.240 30 20 GKED CCN(C(=O)c1cc(C#N)cs1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 437569758 OQRIGUWKJHUKHZ-QFIPXVFZSA-N 389.524 5.390 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)c(Cl)cc1F 439977031 HWZWRHQCWBXSKW-UHFFFAOYSA-N 398.221 5.261 30 20 GKED COc1ccc(-c2nc(CS[C@@H](C)c3cccc(C#N)c3)cs2)c(OC)c1 443158731 WYOMPXZTLNREJA-AWEZNQCLSA-N 396.537 5.693 30 20 GKED C=CCOCCCC(=O)Nc1cc(Cl)ccc1Oc1ccc(OC)cc1 443819073 UWYNZOKOIDGZBW-UHFFFAOYSA-N 375.852 5.062 30 20 GKED C[C@@H](NCc1nc(-c2ccccc2F)no1)c1ccc(-c2cccc(C#N)c2)cc1 444619124 VUOYBSYVWPGXGG-MRXNPFEDSA-N 398.441 5.265 30 20 GKED O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccccc1CCC(F)(F)F 448462227 RNNLPCBZEJBRPM-HNNXBMFYSA-N 393.302 5.196 30 20 GKED CC[C@@]1(C)Oc2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2O1 455251522 KKLQUMQOWKSOIU-GCJKJVERSA-N 379.460 5.141 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)c(Cl)c1 455742586 BYBCIYFWYDLDRH-KRWDZBQOSA-N 396.903 5.385 30 20 GKED C=CCN(C(=O)C1(CCF)CC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 463294096 QCKVEHXSUQPBPM-UHFFFAOYSA-N 399.318 5.776 30 20 GKED Cc1c(CSC(C)C)cccc1N[C@H](C)C(=O)N(CCC#N)c1ccccc1 463926138 OJUXQOHPUXTQCA-LJQANCHMSA-N 395.572 5.384 30 20 GKED C[C@H](c1ccccc1)n1c(SCCCSCC#N)nnc1-c1ccccc1 466630441 HRSDEUQSGXEYJI-QGZVFWFLSA-N 394.569 5.293 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C4CCC4)c3)n2)cc1 467199480 BBOQGGFHCAVXNZ-HXUWFJFHSA-N 383.476 5.439 30 20 GKED C[C@@H](NC1CCC(Oc2ccccc2C#N)CC1)c1nc(C(F)(F)F)cs1 467740600 NTJZOZOIXPZYJR-LRVUVFPRSA-N 395.450 5.074 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2N2C[C@H]3CC[C@H]2C3)c2ccccc21 468691524 BAQZJPFHSRILKT-OALUTQOASA-N 398.510 5.186 30 20 GKED CC(C)OCc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 468914210 KJMQZFISTBFTOM-UHFFFAOYSA-N 375.472 5.122 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3c(Cl)oc4ccccc34)ccc21 469223888 QXZBGSSIRDBSAK-UHFFFAOYSA-N 393.874 5.281 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c(C)c1 471282345 LQQUACVQQMRYBP-HKUYNNGSSA-N 393.556 5.577 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 475757829 VMGMIGDYUJAAJZ-QFBILLFUSA-N 375.497 5.075 30 20 GKED C=CCn1c(SCc2cccc(C(F)F)c2)nnc1-c1ccccc1OC 475955297 IFVDXPDVNKOPLP-UHFFFAOYSA-N 387.455 5.370 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@H]2c2cccs2)c1 497621516 VRAQIAYSERMPOP-NRFANRHFSA-N 388.492 5.176 30 20 GKED CSc1ccsc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 499600352 NIRAKEVESZQGJK-GFCCVEGCSA-N 390.942 5.737 30 20 GKED COc1ccc(CN[C@]2(c3ccc(Cl)cc3)C[C@H]2C)cc1OCCCC#N 500429920 UNEQTQPIMYUTHX-OPAMFIHVSA-N 384.907 5.056 30 20 GKED C=CCCc1ccccc1NC(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1 505035213 LECWWVRRGIOQBI-WIYYLYMNSA-N 383.561 5.071 30 20 GKED CSc1cc(C(=O)N[C@H](C#N)c2ccccc2Cl)c(Cl)cc1Cl 505632371 JHCIIBATVXWIFP-CQSZACIVSA-N 385.703 5.363 30 20 GKED N#Cc1ccc(N2CCC(C(=O)Nc3ccccc3-c3ccccc3)CC2)c(F)c1 505916320 AKQJLFHWZBTMIQ-UHFFFAOYSA-N 399.469 5.219 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 509668412 TXVJPQHSOILJKG-GOEBONIOSA-N 388.389 5.658 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)N(CCC)CCC)cc1 510423967 JFQQXWUSNHIGHR-UHFFFAOYSA-N 393.531 5.169 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3ccc(C#N)cc3F)s2)cc1 512674440 XKVUYYSSDKTPBB-HUUCEWRRSA-N 379.504 5.850 30 20 GKED N#Cc1ccc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)cc1 514903536 XTGGRRHXHJNNMV-UHFFFAOYSA-N 380.778 5.697 30 20 GKED CC(C)[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(C(C)(C)C)cc1 515154694 PKKCLJKPUGCCDM-JOCHJYFZSA-N 388.515 5.393 30 20 GKED CCc1cc(C#N)c(NC(=O)CN(Cc2ccco2)c2cccc(Cl)c2)s1 517654860 JJSBFYREFNCVQS-UHFFFAOYSA-N 399.903 5.074 30 20 GKED C[C@H](NC(=O)NCc1ccccc1Oc1cccc(F)c1)c1ccc(C#N)cc1 518658363 QLSSRWZEZQJFQI-INIZCTEOSA-N 389.430 5.050 30 20 GKED N#C[C@@H](NC(=O)CCCc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 518850016 LIRQIUPVYXVJQM-QGZVFWFLSA-N 381.690 5.351 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518903452 BBMWKIVWVYWYQD-UHFFFAOYSA-N 391.858 5.061 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)COc3ccccc3Cl)c2)cc1 519124526 JSWFJQDQODHGCB-UHFFFAOYSA-N 378.815 5.021 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)c1C#N 524962697 NQYZNHLWPCPKCY-KBPBESRZSA-N 394.418 5.131 30 20 GKED Cc1nc(O)c(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)cc1-c1ccccc1 530694084 UTWIEBCTEIWPJN-JOCHJYFZSA-N 399.494 5.055 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4nc(C)ccc4c3)n2)cc1 534691886 OZLWZQOHFHCQDW-LJQANCHMSA-N 383.476 5.465 30 20 GKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 539030881 OTMADRSJCSYFBU-LAUBAEHRSA-N 377.488 5.126 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)Nc1ccc(C#N)c(Cl)c1 540886945 BPYCOCRUORGNRH-UHFFFAOYSA-N 384.060 5.188 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)CSc1cccc(Cl)c1C#N 541172819 HKOGKQSYDVFJBG-CYBMUJFWSA-N 384.888 5.270 30 20 GKED CC(C)CN(Cc1nnc(-c2ccc(C#N)cc2)o1)[C@@H](C)c1ccccc1Cl 551421688 KJELZCDJSKXFGM-INIZCTEOSA-N 394.906 5.481 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2CCC(F)(F)F)cc1Br 558214108 MCOSAZPXXXFYHP-UHFFFAOYSA-N 397.194 5.068 30 20 GKED Cc1ccc(NC(=O)C[C@@H](C)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 559860720 YFFAYHGVHBJSQE-YLJYHZDGSA-N 383.923 5.390 30 20 GKED COc1ccc([C@H](CCC#N)NC[C@H]2CCN(c3cc(Cl)ccc3C)C2)cc1 562593679 VCECIPDUHCBUKE-GCJKJVERSA-N 397.950 5.118 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccccc2F)C1 563499943 ZJQXAIJRECAYPD-BZUAXINKSA-N 383.492 5.145 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3cccc(Nc4ccccc4)c3)on2)c1 568830318 CXBPHGGETKHCGR-UHFFFAOYSA-N 380.407 5.209 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)Cc3csc4ccccc34)cc2)ccn1 574681362 PWWJVRPWBAZZRK-UHFFFAOYSA-N 385.448 5.141 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC(C)(C)[C@@H]1c1cccs1 580454031 PLKLDDLJNDNXMO-YWZLYKJASA-N 399.585 5.164 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1ccc2ccccc2n1 589830739 QCGUMLHJPQFFCD-OAHLLOKOSA-N 389.867 5.502 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C(F)(F)F)o1 594073020 ZAUXEVZZVZSNLF-BDJLRTHQSA-N 397.422 5.265 30 20 GKED COCCC[C@H](c1ccc(Cl)cc1)c1noc(CC2(C#N)CCCCC2)n1 596598065 JQGURNURCWZWLY-GOSISDBHSA-N 387.911 5.298 30 20 GKED N#CC1(c2ccc([C@H]3Nc4ccccc4C(=O)N3CCc3ccccc3)cc2)CC1 602758146 IYMCJFAAIUAWQJ-DEOSSOPVSA-N 393.490 5.051 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3ccc(Cl)cc3Cl)cn2)c1 603622067 IXARJLWVKSDUCK-UHFFFAOYSA-N 398.249 5.234 30 20 GKED C[C@H](CNC(=O)c1cc2ccccc2n1CC#N)c1c(Cl)cccc1Cl 609170554 PWXQVOMCMRENJX-CYBMUJFWSA-N 386.282 5.005 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1nccc2ccccc12 609526068 MXJZSQGFBUROQL-UHFFFAOYSA-N 395.437 5.401 30 20 GKED CSCC[C@@H](C)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609869857 IUOKYRRNSKYBJP-CQSZACIVSA-N 388.920 5.218 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](Cc1ccccc1)C1CC1 609930275 XSVGZNAHQJFQJA-OXQOHEQNSA-N 379.529 5.224 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)s2)cc1 613290561 GGZGYPLAEBEQCY-SFHVURJKSA-N 399.475 5.165 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc2ccccc12 615761920 CDFGPHXGHCTPHZ-DEOSSOPVSA-N 397.522 5.986 30 20 GKED O=C(CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(F)cc1F 641933621 SQYVSUJKVFSCQH-UHFFFAOYSA-N 398.253 5.053 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 642010015 XEDQRUXWSJBUHK-UHFFFAOYSA-N 386.476 5.780 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C\c1ccccc1F 727996787 NCDOITGHDYEHHF-XFXZXTDPSA-N 386.426 5.237 30 20 GKED Cc1nc(CSc2ccc(C(=O)OCc3ccc(F)cc3C#N)cc2)cs1 728619237 DZKQBXSCTKKWPN-UHFFFAOYSA-N 398.484 5.112 30 20 GKED COc1ccc(CN[C@@H](C)c2csc3ccccc23)cc1OCCCC#N 730018801 ARDOKISTSRZRED-INIZCTEOSA-N 380.513 5.443 30 20 GKED Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 730130691 GYHVCRBQQMCETP-RPWUZVMVSA-N 381.479 5.460 30 20 GKED C#CCOc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)c1 731112510 KNMXWIHXIAOBPG-HNNXBMFYSA-N 391.496 5.013 30 20 GKED N#C[C@@H](NC(=O)c1sc2ccccc2c1Cl)c1cccc(C(F)(F)F)c1 731646150 YNGOVCJFLDHNER-CYBMUJFWSA-N 394.805 5.568 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C/c3cccc(OC)c3O)s2)cc1 733750438 ZFZMVJJDZXDHJS-AEOXGOBCSA-N 382.485 5.021 30 20 GKED C=CC[C@H](NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1ccncc1 734460201 NQNIIQWIBZUAHY-QFIPXVFZSA-N 392.886 5.361 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1ccccc1)c1ccncc1 734684368 VFXZSKHXEJRDLT-RDPSFJRHSA-N 385.511 5.672 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1cccc(-c2ccncc2)c1 741462629 SEGJCVOHUOCGFS-UHFFFAOYSA-N 379.423 5.274 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2sc(C)nc2C)cc1OCC 742351494 KAUWLAIXDSJPEY-UHFFFAOYSA-N 382.913 5.152 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccc(F)cc2)cc1F 743034717 BEXZWTBEAHLFPJ-UHFFFAOYSA-N 381.407 5.438 30 20 GKED C=CCn1c(SC[C@@H](O)c2cc(C)cc(C)c2)nnc1-c1ccc(Cl)cc1 743253951 WYFRELKNJYQSTD-LJQANCHMSA-N 399.947 5.227 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Nc2ccc3oc(C(C)C)nc3c2)cc1 743467447 AWCSEOHZAKIOQB-QGZVFWFLSA-N 390.487 5.007 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Br)s1 744016613 PFIKBELCXQNBJX-NXEZZACHSA-N 391.315 5.100 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1C(F)(F)F 744117894 DNQSAVOIIKCBFS-MFKMUULPSA-N 392.377 5.434 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C/c2ccccc2)C(=O)c2ccccc2)c(Cl)c1 747155165 QLYOWAPJPKEBQA-HMMYKYKNSA-N 389.882 5.862 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)O[C@H](C)c2ccc(C#N)cc2)cc1 748679448 GHVHRWMDBKOXID-OAHLLOKOSA-N 376.481 5.146 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3cc4ccccc4o3)cc2c1C 750905599 OICWFVPQBPUVLI-FPLPWBNLSA-N 377.421 5.034 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3c(C)noc3C)n2)cc1 754531324 JRBGOLCZCKTFPP-DYVFJYSZSA-N 379.485 5.093 30 20 GKED C[C@@H](CSc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 756242771 OKOUPKVALIMDID-KSSFIOAISA-N 396.512 5.554 30 20 GKED Fc1ccc(/C=C/C=Nn2cnnc2SCc2ccc(Cl)cc2)c(F)c1 758097435 TYJRYEWHRMNJNS-OAPZASBZSA-N 390.846 5.049 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2ccccn2)cc1 764568441 JKZXCEGIFXZFLJ-JPYJTQIMSA-N 378.903 5.653 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1cc(OCC(F)(F)F)c2ccccc2n1 768830410 BEJSPIPCFYRLHU-UHFFFAOYSA-N 394.393 5.053 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CC3(CCCCC3)Oc3ccccc32)c1 772982222 GAPJTWQBJAFNEH-OFNKIYASSA-N 390.527 5.684 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cc([N+](=O)[O-])ccc2Cl)cc1 773425766 CMHITYAZVBIVHL-UHFFFAOYSA-N 377.831 5.077 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c(F)c1 781108916 VFQDCVJNGCHTDU-CLTKARDFSA-N 396.761 5.415 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C#N)cc2F)ccc1OCc1ccccc1 781109038 WQJUUDXGEVMRHA-DHZHZOJOSA-N 387.410 5.181 30 20 GKED Cc1cnc(Cl)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 787981305 WUBPKKCERQMFFT-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc(C(F)(F)F)cc2)c(-c2ccccc2)n1 788349226 KADKKRMPRVRMRJ-XFXZXTDPSA-N 395.384 5.379 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3CCC(=O)c4ccccc43)n2)cc1 793125714 PPRMOCVZYSRRME-OALUTQOASA-N 386.476 5.055 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H](c2ccccn2)C1 799208525 QVKYSRAHBNKWBQ-IBGZPJMESA-N 398.466 5.075 30 20 GKED COC(=O)c1c(F)cccc1NN=Cc1c(Cl)ccc(Cl)c1Cl 800816730 HOXZJAXILXTOEP-UHFFFAOYSA-N 375.614 5.019 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccccc3)n2)CCCC1 838279566 IUJPCKYQKQVAHD-UHFFFAOYSA-N 384.501 5.007 30 20 GKED CC[C@@H](C)NC(=S)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 843277872 VBMOGEYRVFVLMJ-MRVPVSSYSA-N 376.341 5.061 30 20 GKED N#C[C@]1(c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)CC2CCC1CC2 904505242 NFOLMTZCDRGXDQ-SDDNFHFQSA-N 390.418 5.034 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccc(OC(F)F)cc1 915044557 KUJYLUGAXTUMHH-XCVCLJGOSA-N 381.378 5.158 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915086831 XLGBYHRCVDKPPB-QHCPKHFHSA-N 397.478 5.189 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(Cl)c(Cl)c1Cl 915982447 CKKDFLQHZZNQQT-QPJJXVBHSA-N 395.698 6.061 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1Cl 916915535 FCNIXPQIGOCVPY-IBGZPJMESA-N 390.870 5.082 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCOc3cc(C)cc(C)c3)n2)cc1 916974764 PLXDAYRJIDZZBG-HXUWFJFHSA-N 390.508 5.381 30 20 GKED CCC(=NNc1ccccc1C(=O)O)[C@@H](C)c1cccc(Br)c1 1776032240 VAQOUWIWMYULIP-LBPRGKRZSA-N 375.266 5.129 30 20 GKED O=C(O)c1ccc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)c(Cl)c1 1776127396 RSAUCAKMDQNYHC-JLHYYAGUSA-N 392.838 5.513 30 20 GKED C=CCn1c(SCC(=O)Nc2ccccc2-c2ccccc2)nc2ccccc21 5618835 UTRIJSHJLLOJLQ-UHFFFAOYSA-N 399.519 5.620 30 20 GKED O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 19163493 DLLJCHUPLQFDGU-UHFFFAOYSA-N 396.218 5.024 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)CSc1ccc2ccccc2c1 24464658 HSDQABSAVAQDLB-UHFFFAOYSA-N 383.856 5.071 30 20 GKED Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1ccccc1-c1ccccc1C#N)CC3 25547338 XXZUTUSLRIHEAK-UHFFFAOYSA-N 391.474 5.214 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(O)cc2)cc1Cl 45532726 HATHQJCOGJLWLW-HXUWFJFHSA-N 391.858 5.023 30 20 GKED C[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 48125625 HZRKZDHYLZORRX-KRWDZBQOSA-N 398.466 5.035 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccc(-c3cnco3)cc2)c1 56081965 GNMNIAPJACSCKV-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 62905495 MQVKCBKTEZZCCS-INIZCTEOSA-N 386.417 5.285 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 72025230 WUNCWYUXBBCLAQ-UHFFFAOYSA-N 387.395 5.128 30 20 GKED COc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(F)c1 108241871 QWWYNIYNAGDTDQ-UHFFFAOYSA-N 398.381 5.111 30 20 GKED Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)n1 108270495 OQQLCVORKWBUMY-HXUWFJFHSA-N 375.859 5.260 30 20 GKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128864590 YPMAEAZJHBBJLC-LJQANCHMSA-N 375.497 5.138 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC3(CCC3)C2)cc1Cl 152396159 WCZOSSQHCHKKCM-LJQANCHMSA-N 379.891 5.403 30 20 GKED CCc1ccc(C(=O)/C(=C(\S)N[C@@H](C)CC)[n+]2ccc(C(C)(C)C)cc2)cc1 154523621 GPZRBYHJJNEFGZ-KRWDZBQOSA-O 397.608 5.161 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1C)c1ccccc1 155481806 AYCOYBXWCYMOKA-JOCHJYFZSA-N 391.515 5.060 30 20 GKED Cc1c(NC(=O)c2ccc(C#N)c(Cl)c2)cccc1C(=O)Nc1ccccc1 155654327 DIMBFFOWJGNTCF-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C=CCn1c(S[C@H](C)c2nc(CCCC)no2)nnc1-c1ccccc1C 158123255 VCRLGLWMCVZSFW-OAHLLOKOSA-N 383.521 5.018 30 20 GKED N#CCSc1cccc(C(=O)N2CCSc3ccc(C(F)(F)F)cc32)c1 162592610 KIGMIIFSHYEFJY-UHFFFAOYSA-N 394.443 5.074 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 175374309 HAEZQCFFWDTQAS-KRWDZBQOSA-N 389.499 5.126 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2NC(=O)c2ccsc2)n1 177777180 MIUWYTCVODINJT-HNNXBMFYSA-N 395.509 5.070 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(CCOC)c2ccccc12 188058694 GUNMKSYZZLWHCQ-UHFFFAOYSA-N 376.500 5.392 30 20 GKED COc1ccc(CN[C@H](c2ccccc2Cl)C(C)C)cc1OCCCC#N 237255492 MTVVHYPZOBTEGO-QFIPXVFZSA-N 386.923 5.518 30 20 GKED COc1ccc(CN[C@@H](c2cccc(F)c2)C2CCCC2)cc1OCCCC#N 237351670 ZJLKDHONSKYJEW-XMMPIXPASA-N 396.506 5.538 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N[C@H](c1cccc(F)c1)c1ccccn1 301853816 BJYJPTBCXKRXGE-JOCHJYFZSA-N 388.833 5.495 30 20 GKED C[C@H](/N=C(/O)[C@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccncc1)[C@H](C)C1CCCCC1 328951995 HWMHPTMSIWPVHT-SJQULFJYSA-N 397.563 5.085 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCCC1CCOCC1 409519341 NUFXYVZSRAHMHK-UHFFFAOYSA-N 378.472 5.194 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cnc(-c3ccncc3)s1)c2C#N 410977695 KWBMPDMFRBTMAX-NEPJUHHUSA-N 394.525 5.076 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@H](C)[C@@H](C)CC2 410987566 RFFFHMBEACMPOL-NWDGAFQWSA-N 395.484 5.043 30 20 GKED CC(C)[C@@H]1CCc2c(sc(NC(=O)c3ncccc3C(F)(F)F)c2C#N)C1 411008944 VFLCEWGUQCACSG-LLVKDONJSA-N 393.434 5.047 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CC(C)(C)Oc2ccccc21 412092092 QJFQFBDXTBGZGG-DOTOQJQBSA-N 380.513 5.364 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1-c1ncc2n1CCCC2)c1ccccc1 425676736 SZJWDEPICGQGJR-NRFANRHFSA-N 399.498 5.053 30 20 GKED C=CCN(C(=O)C[C@@H](C)c1c[nH]c2ccccc12)c1nc2c(s1)CCCC2 426704723 LRHPHEITHVMZTI-OAHLLOKOSA-N 379.529 5.216 30 20 GKED CC(C)(c1ccc(NCC(=O)Nc2cc(Cl)ccc2C#N)cc1)C(F)(F)F 432306200 LBVFLZOXWSXPRO-UHFFFAOYSA-N 395.812 5.102 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 432798189 NYTYWOZFGSUEGS-UHFFFAOYSA-N 392.434 5.180 30 20 GKED N#CCCC[C@H](NCC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccccc1 433014921 UPATUPJJVVOXTN-DEOSSOPVSA-N 399.494 5.442 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@@H](C#N)CCc1ccccc1 433301807 GNWXQKMNXLIVMW-OXJNMPFZSA-N 389.524 5.068 30 20 GKED CC[C@H](C)c1ccc([C@@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 437643846 CYBNDVALMMKLSJ-SBUREZEXSA-N 388.515 5.609 30 20 GKED CSCCCN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 439344642 GGTIVCDFUYSWMA-GOSISDBHSA-N 387.936 5.212 30 20 GKED CC(C)(C(=O)Nc1ccc(C#N)c(Cl)c1)c1csc(-c2cccs2)n1 443461117 BWXSDNKBHVIQRX-UHFFFAOYSA-N 387.917 5.313 30 20 GKED C=C(C)CN(C)C(=O)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 445040309 LCINOVMSZBXSFV-UHFFFAOYSA-N 394.928 5.321 30 20 GKED COc1cccc2c(CNc3ccc4c(c3)CCC(=O)N4CCCC#N)cccc12 449270977 DSVAWMDTSDEFAB-UHFFFAOYSA-N 399.494 5.043 30 20 GKED COc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1OC(C)C 455141166 OQYBBJMCYPFWSL-LJQANCHMSA-N 381.476 5.039 30 20 GKED C=C(C)C[C@H](C)C(=O)N(C)c1cccc2c1CCCN2C(=O)[C@H](C)CC(=C)C 466273906 NYEPDDLUMXLJMF-RBUKOAKNSA-N 382.548 5.133 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1ncccc1OCCCC#N 466605087 WYNHTFQUIQPPOF-UHFFFAOYSA-N 398.532 5.358 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCC[C@@H]3Cc3ccccc3)ccc21 469258592 SMPAPPBVLAUVNA-OFNKIYASSA-N 387.527 5.093 30 20 GKED Cc1ccccc1-n1c(SCCCC(C)(C)C#N)nnc1-c1ccncc1 476514268 VQXSGQHWLBTESR-UHFFFAOYSA-N 377.517 5.060 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2n[nH]c(C3CC3)n2)cc1 476785012 ARAPXXMAQHSZMC-UHFFFAOYSA-N 386.499 5.453 30 20 GKED C=C(C)[C@H](NCC(=O)Nc1cccc(Cl)c1Cl)c1ccc(F)c(F)c1 481589651 AKGAUXUXXAFZLZ-SFHVURJKSA-N 385.241 5.117 30 20 GKED C=CCCC1(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)CC1 483366522 JLEHKLKBUHJIBJ-UHFFFAOYSA-N 382.891 5.302 30 20 GKED Cc1ccc(NC(=O)CSc2ccc(C#N)cc2)c(OCc2ccccc2)c1 483467815 IHWFZJIHRROYIU-UHFFFAOYSA-N 388.492 5.177 30 20 GKED C[C@@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)s1 487421920 SQJROISHVKJMGJ-HIFRSBDPSA-N 391.334 5.165 30 20 GKED N#Cc1ccc(C(=O)Nc2c(Oc3ccc(Cl)cc3)ccc3ncccc23)o1 494121943 SLESUFHIGIMLKX-UHFFFAOYSA-N 389.798 5.397 30 20 GKED Cc1nc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(-c2ccccc2)s1 498167196 RTWFDEAACRKCAY-AWEZNQCLSA-N 393.537 5.623 30 20 GKED CCN(CC)CCCC1CCN(C(=O)c2sc3ccc(C#N)cc3c2C)CC1 498980187 RFDNXIXYPRHENQ-UHFFFAOYSA-N 397.588 5.056 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc(F)c(F)c(F)c1F 499201612 KTMKVTQVLLMLKH-UHFFFAOYSA-N 393.302 5.313 30 20 GKED N#Cc1ccc(CC(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)cc1 504052712 AOSCHZBRZICEBA-JOCHJYFZSA-N 395.289 5.313 30 20 GKED N#Cc1cccc(OCCCCc2nc(-c3cccc(C(F)(F)F)c3)no2)c1 505073233 FFEXOPPLMIRNPH-UHFFFAOYSA-N 387.361 5.029 30 20 GKED Cc1cc(F)cc2c1CN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)CC2 505324742 JKRLNNLGIKEVCP-HNNXBMFYSA-N 383.492 5.119 30 20 GKED CC(C)CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 510046730 XIABPMRUJXQORF-FQEVSTJZSA-N 381.907 5.648 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 510814260 JROVBFIWTGGODJ-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C=CCN1C(=O)c2ccccc2N[C@@H]1c1cc(C)c(OCc2ccccn2)c(C)c1 510878650 KDGWZCTVQKIQGU-DEOSSOPVSA-N 399.494 5.030 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCC(C)(C)CCC#N)C1CC1 513122273 DDGIYODXPDURHC-CQSZACIVSA-N 381.442 5.270 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c12 515406956 RJTBEVCLJWSMOI-UHFFFAOYSA-N 388.471 5.277 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(SC)ccc3C)n2)cc1 517800700 BWXHFNXJHVYQMD-SFHVURJKSA-N 394.521 5.339 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)C)cc3)n2)cc1 517800778 HMPVZCLRTIVNEC-LJQANCHMSA-N 376.481 5.432 30 20 GKED Cc1ccc(CN(C(=O)CSCc2ccc(C#N)cc2)c2ccc(F)cc2)o1 518186351 KVRCWNYOMBTZPC-UHFFFAOYSA-N 394.471 5.065 30 20 GKED CSc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1NC(C)=O 518239563 GVXBRKIWUOUJCF-ZDUSSCGKSA-N 399.541 5.013 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 518259521 MLZDRPKVTALIMJ-INIZCTEOSA-N 385.508 5.662 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)c2ccc(C#N)cn2)c2cccs2)cc1 522677808 WUXMAJJALPUIQG-BTYIYWSLSA-N 375.497 5.048 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N(CCC#N)CC3CC3)c2)c1 525053546 WNNUTFLLQAOSDH-UHFFFAOYSA-N 378.541 5.362 30 20 GKED C[C@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 525544895 ZWZHCADLBATXIV-SNVBAGLBSA-N 393.302 5.996 30 20 GKED N#CCC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccccc1 537324691 DOTZYSDJOJJJTE-HXUWFJFHSA-N 395.846 5.643 30 20 GKED N#CCCSc1ccccc1NC(=O)c1coc(-c2ccccc2Cl)n1 538443889 QFXKLJGXJRUNDJ-UHFFFAOYSA-N 383.860 5.253 30 20 GKED CC[C@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)c1ccc(Cl)s1 541626972 PAMAFRFZTUQKGY-INIZCTEOSA-N 389.952 5.006 30 20 GKED N#CCCn1cc(CN[C@H]2C[C@H](c3ccccc3Cl)C2)c(-c2ccccc2)n1 550322474 DXRYVORYOJOUQY-KESTWPANSA-N 390.918 5.153 30 20 GKED C[C@H](C1CC1)N(C(=O)c1ccc(F)c(C#N)c1)c1cccc(C(F)(F)F)c1 551563087 GISPJIZETUQMMK-GFCCVEGCSA-N 376.353 5.161 30 20 GKED C[C@@H](NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1ccc(C#N)cc1 552836711 PYXFTKJDLSNWNF-HXUWFJFHSA-N 392.506 5.321 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC(C)(C)[C@H]2c2cccnc2)cc1 553088754 LDTJZVIKTCHDSV-HSZRJFAPSA-N 397.478 5.277 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 564314191 GJHBFXHNIJZITG-UHFFFAOYSA-N 390.443 5.012 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1cc(Cl)cc(Cl)c1OC(F)F)CC2 573371380 XDYFCISXSXVVEF-INIZCTEOSA-N 383.225 5.244 30 20 GKED CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCC(F)(F)CC1 579994644 DXJHSTNCKDMSHM-UHFFFAOYSA-N 389.286 5.374 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)c1ccc(C(F)F)cc1 588037659 KXIWVUNVPNTABO-UHFFFAOYSA-N 398.222 5.354 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2F)n1)c1nc2cc(F)ccc2s1 592973999 LXKLNADDEABEAK-LBPRGKRZSA-N 397.431 5.188 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)N(Cc1ccc(C#N)cc1)C(C)C 603527070 AGZMBCWUYMPKTG-UHFFFAOYSA-N 375.497 5.041 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccccc2F)cc1Cl 603673227 OLMXOKJUASQJIA-LJQANCHMSA-N 378.834 5.316 30 20 GKED CC(C)C[C@H](C#N)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 608825739 RYCNZSDZGCNMCR-SECBINFHSA-N 375.708 5.530 30 20 GKED N#Cc1cc(NC(=O)c2oc3ccccc3c2COc2ccccc2)ccc1F 609103207 YKXLFOLVYNDBKV-UHFFFAOYSA-N 386.382 5.275 30 20 GKED CCC(CC)CN(CCC#N)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 609189553 ZGQKAWKSUIDHOV-UHFFFAOYSA-N 395.981 5.246 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2Cl)sc1SCC#N 609502416 ZTWVSHXMVGIIEF-WDEREUQCSA-N 398.340 5.116 30 20 GKED Cc1ccc(-c2ncc(C(=O)N[C@H](CCC#N)c3ccccc3)s2)c(C)c1 610976343 NEXOXPPQTCQPPY-LJQANCHMSA-N 375.497 5.202 30 20 GKED CC(C)COc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1Cl 611092719 DQPTYSPQTUQFGG-UHFFFAOYSA-N 397.689 5.806 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](CC1CC1)c1ccccc1 611395597 JJIFEVVANWQQDH-UTKZUKDTSA-N 393.556 5.008 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 618765087 DQWHTMGTVGBZGK-NRFANRHFSA-N 377.488 5.072 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 642112851 UOWRIRLFAORXTD-UHFFFAOYSA-N 375.468 5.091 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc(C(F)(F)F)c1F 682400708 JJBSXUDDDRBVPN-LLVKDONJSA-N 396.340 5.392 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c1 727594699 IRTLUFPNEMCABI-UHFFFAOYSA-N 389.499 5.534 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)c1ccc2ccccc2n1 727629541 SQTZTSCDZKEJAE-QGZVFWFLSA-N 380.369 5.162 30 20 GKED Cc1cc(C)nc(NN=C2CCCc3nc(-c4ccc(Cl)cc4)sc32)n1 728429245 GPVDBFFSLNPAFP-UHFFFAOYSA-N 383.908 5.023 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3/Cc4c(C)cccc4C3=O)c2)cc1 729149701 GGNWQHIFWSDPME-UYRXBGFRSA-N 383.447 5.078 30 20 GKED CCc1oc2ccccc2c1C=NOCc1nnc(-c2cccc(Cl)c2)o1 730098752 PQDBNSIQCZETSE-UHFFFAOYSA-N 381.819 5.249 30 20 GKED Cc1nc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cs1 733095519 DMRCSRFNSFPZMB-IBGZPJMESA-N 395.915 5.332 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=S)Nc2ccc(Cl)cc2Cl)c1 733755110 NVMMIXMUZHODPI-AWEZNQCLSA-N 394.327 5.161 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(CSc2nc(C)cs2)cc1)c1ccncc1 734459805 MUDDZYZSYBYAKX-LJQANCHMSA-N 395.553 5.186 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1C(=O)/C=C\c1nccs1 735232523 OKZSBFQGGXJRDE-SREVYHEPSA-N 391.315 5.234 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2OC2CCC2)cc1 735634136 LMUZCGFMMHKTAU-QHCPKHFHSA-N 382.463 5.526 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc(OC(F)F)cc3)c2)s1 740428438 FFQPNRWMRMBWOC-UHFFFAOYSA-N 399.422 5.210 30 20 GKED CS[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 740535279 LUKZVNQIICNWKJ-XLIONFOSSA-N 378.522 5.399 30 20 GKED N#C[C@H](C(=O)c1cccc2cc[nH]c12)c1nc(-c2c(F)cccc2F)cs1 744073270 CEVJFDKLGDDLON-CYBMUJFWSA-N 379.391 5.060 30 20 GKED N#C[C@@H](C(=O)c1scnc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 744936929 YPTSWICWACFDLN-JTQLQIEISA-N 380.281 5.063 30 20 GKED CCCCCOc1cc(/C=C\C(=O)c2cccc(NC(C)=O)c2)ccc1OC 747062526 ZVJVIFFDFORWPM-BENRWUELSA-N 381.472 5.119 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3ccc4cc(O)ccc4c3)c(Cl)nc21 749005113 XFKVQTDDCMGONL-VURMDHGXSA-N 391.858 5.421 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)c(C)cc2Cl)c1 752308319 HKSVBXRXYRTGIH-CQSZACIVSA-N 392.286 5.305 30 20 GKED CC(C)(C)O[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 754530261 DXBXCMRKBSLKHL-DNVCBOLYSA-N 398.915 5.682 30 20 GKED CC(C)c1ccc(-c2ncc(CNc3ccc(F)cc3OCC#N)s2)cc1 760458735 FOUDWMVWJRLQBL-UHFFFAOYSA-N 381.476 5.587 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccc(F)cc2)c2nccn2C)cc1 764815523 QULJSVVKUSRGFT-IERDGZPVSA-N 399.897 5.131 30 20 GKED C=CC[C@@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccncc1 766018078 FTQFMWFPNDDCGP-RTBURBONSA-N 379.504 5.629 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@H]2c2ccc(Br)cc2)cc1 768936709 MSPWBXJJDPRZKB-YWZLYKJASA-N 385.305 5.077 30 20 GKED C#CCCOc1ccc(CNc2ccc(NC(=O)OC(C)(C)C)c(OC)c2)cc1 770527957 HPCGPXKZHIHXKV-UHFFFAOYSA-N 396.487 5.056 30 20 GKED N#CCOc1cccc(NCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)c1 779588316 KIDHATOOWSFFQN-UHFFFAOYSA-N 398.441 5.193 30 20 GKED CC(C)Cn1ccc2cc(NC(=O)Nc3ccccc3O[C@H](C)C#N)ccc21 780542842 VTFPHEXVRWJLNV-MRXNPFEDSA-N 376.460 5.232 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3)c2)cc1 795315139 SOZMEUCOUSCHQL-BJKOFHAPSA-N 382.463 5.074 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797567290 GACLKHIHWUUYTN-QAPCUYQASA-N 384.545 5.599 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 836497744 VHOKYQNWVUDABH-HXPMCKFVSA-N 387.842 5.043 30 20 GKED Cc1ccc(-c2csc(NC(=O)c3ccccc3SCC#N)n2)cc1C 877668581 KIYXQIITJFMWFW-UHFFFAOYSA-N 379.510 5.295 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCc1cccc(C#N)c1 913350045 GVFJXXDHKGWKMK-UHFFFAOYSA-N 387.222 5.186 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 915103673 BIBJSAUXWCWGJE-CABCVRRESA-N 388.414 5.685 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1cccc(C#N)c1 915956668 YUVPVHNAWCCIMG-UHFFFAOYSA-N 383.480 5.375 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=CC(c1ccccc1)c1ccccc1 916342219 YSCJNTREMIOLLG-UHFFFAOYSA-N 384.508 5.208 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccc(Cl)s2)cc1 916915861 QMVBNQVFSWSZQQ-FPISAVPCSA-N 386.904 5.105 30 20 GKED COc1ccc(/C=C\C(=O)c2ccccc2)cc1OCc1ccc([N+](=O)[O-])cc1 917030590 IBWLOQSOPRMNDJ-LCYFTJDESA-N 389.407 5.079 30 20 GKED Cc1cccc(OCCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917047459 XXLSKTMBWNSJGC-MRXNPFEDSA-N 384.888 5.294 30 20 GKED C[C@H](OC(=O)/C=C\c1ccccc1C#N)c1cccc(NC(=O)c2ccccc2)c1 919046869 QIHKRSKKYODUMH-OUFNUQFJSA-N 396.446 5.128 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C3C4CC5CC(C4)CC3C5)n2)cc1 920144222 YWEKCTHRUDTJJJ-HQFHRNBSSA-N 392.524 5.067 30 20 GKED O=C(O)c1cc(-c2ccc(C=NNc3ccc(Cl)cc3Cl)o2)ccc1O 1776029703 OGAPHCYLUGJWMA-UHFFFAOYSA-N 391.210 5.103 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776064970 OOAADNRXGMBGPZ-UHFFFAOYSA-N 396.506 5.881 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(O)c2)cc1 1776125767 RXZGVRDQSSAFJY-QHIITQONSA-N 396.483 5.582 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)c1 1776341481 SCTPYPIZEFBVEU-SREVYHEPSA-N 387.273 5.242 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2cccc(OC)c2)c1 1776787951 JQMOVMRBAMBWND-QHCPKHFHSA-N 399.531 5.350 30 20 GKED CCCCCOc1cc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)ccc1OC 1776793045 IABCAVAYZFOMQS-XMJIKXADSA-N 394.467 5.102 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3c[nH]c(C)c3)CCC2)cc1 1789626186 KEZSEIDNQNXXER-UHFFFAOYSA-N 393.531 5.063 30 20 GKED Cc1cc2occ(CC(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)c2cc1C 14497232 XFELOTKUMQAQDJ-UHFFFAOYSA-N 387.464 5.226 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 24882670 ZIQAGYXLWJRFDU-WUKNDPDISA-N 386.451 5.555 30 20 GKED O=C(Nc1ccc(OC(F)F)cc1OC(F)F)c1ccc(C(F)(F)F)cc1 49768935 SNUWSCBGRWUVTN-UHFFFAOYSA-N 397.246 5.161 30 20 GKED CCc1nnc(/N=C(\O)Cc2c(C)nc3ccccc3c2-c2ccccc2)s1 49936890 JLLINUSVTKOGBB-UHFFFAOYSA-N 388.496 5.455 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2o1 54736781 HVIVLQFCWRJRKV-ZYHUDNBSSA-N 391.279 5.492 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2ccc(Cl)cc2)cc1 55823630 WDEXJCXBOIIPAA-UHFFFAOYSA-N 390.870 5.166 30 20 GKED Cc1cccc(C)c1NC(=O)CCCSCCCOc1ccc(C#N)cc1 56244009 NLQJPKSAZHXWOL-UHFFFAOYSA-N 382.529 5.096 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F 66801359 GSOKLLFSSUDHSS-CYBMUJFWSA-N 378.419 5.281 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F 108239354 KSHXAYPERPSXQS-ZDUSSCGKSA-N 378.419 5.138 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 108408271 BFFVMNSLTJYCGY-DLBZAZTESA-N 381.545 5.501 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)cc1 116483755 FALNYSAPLOARTI-LJQANCHMSA-N 399.947 5.463 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccc(Cl)cc2)CC1 125854799 IFOWOGAAQINOSU-UHFFFAOYSA-N 382.872 5.164 30 20 GKED Cc1ccc2cc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)ccc2n1 136903348 CCMGOBIYSISWNB-HNNXBMFYSA-N 377.856 5.296 30 20 GKED C[C@@H](N[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)c1ccc(C#N)cc1 150872923 RPHSMYRYTWANLB-VXGBXAGGSA-N 387.270 5.327 30 20 GKED C=CCn1c(C)nnc1S[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 155325477 BNAOTFHNUHJHIF-JTQLQIEISA-N 395.315 5.588 30 20 GKED CC(C)[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 172545526 HEJOYRNWTOMMHB-IAGOWNOFSA-N 381.426 5.123 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C 173122685 JPJGLQBGCOSUBN-UWJYYQICSA-N 393.556 6.067 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC4(CCCC4)C3)c2)cc1 175213790 SZDNGWJZXLAPAI-UHFFFAOYSA-N 389.499 5.130 30 20 GKED COc1cc([C@H](C)NCc2cc(C#N)ccc2F)ccc1OCc1ccccc1 179708240 UYHFYBCLMLXXCI-KRWDZBQOSA-N 390.458 5.136 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(OCC#N)cc2)CCC3)cc1 180556886 QEURSBANRATOBM-FQEVSTJZSA-N 389.524 5.188 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(F)cc1F 211951991 FQCUWEQYXOXQLG-TWGQIWQCSA-N 387.389 5.109 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(-c3nc4ccccc4s3)o2)cc1 237509680 OXGIRBWAOWCTTA-HNNXBMFYSA-N 389.480 5.137 30 20 GKED CCc1c(C(=O)/C=C\c2csc(N(C(C)=O)C3CC3)n2)oc2ccc(C)cc12 255013711 DBRTWMOZWIFLHL-TWGQIWQCSA-N 394.496 5.172 30 20 GKED C=CC[C@H](CC)NCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 281452051 SXENUZKQGVWXIZ-HNNXBMFYSA-N 397.466 5.291 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(OC(F)F)cc3)cc2)cc1 303078118 ZQUNVBBCCUTHMI-UHFFFAOYSA-N 380.350 5.204 30 20 GKED O/C(CC1CCCCC1)=N/C1CCC(/C(O)=N\[C@@H]2CCN3CCCC[C@H]23)CC1 328709490 FYIILIZVHYBNSF-TZWRJOPASA-N 389.584 5.055 30 20 GKED CC(C)c1nc([C@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)no1 374776030 DWDKTDPKGCNQCD-GOSISDBHSA-N 395.507 5.143 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 409866011 IDWBXZHDACRXKH-CABCVRRESA-N 375.255 5.006 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc(C(F)(F)F)c1F 430607679 CSQBCWQPMHCVAD-LLVKDONJSA-N 384.398 5.397 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430626991 LOHOULGDDIZJIN-HNNXBMFYSA-N 379.485 5.203 30 20 GKED C=CCN(C(=O)c1ccc2nc(C)sc2c1)c1nc(-c2ccccc2)cs1 432715186 YAVDNNHYXZLYFK-UHFFFAOYSA-N 391.521 5.561 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 432988013 WZJFZKMSWYZQIA-UHFFFAOYSA-N 393.356 5.100 30 20 GKED O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)C1CCC(C(F)(F)F)CC1 436031012 WHAROXPNKXMCTR-KJHLLKJSSA-N 389.286 5.053 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)CC1 438003653 RZKVRIVPPOSMNO-UHFFFAOYSA-N 391.393 5.323 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(OC(C)(C)C)cc1 438057205 AKXPVNSDALLWLJ-HNNXBMFYSA-N 383.517 5.760 30 20 GKED COCc1nc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(-c2ccccc2)s1 440753693 MXKZSKDOKRXKOL-UHFFFAOYSA-N 391.496 5.010 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)CSCc1ccc(C#N)cc1 460252569 AMVHFDHCBUKEDE-UHFFFAOYSA-N 384.570 5.380 30 20 GKED CCSc1cc(Cl)ccc1C(=O)Nc1sc2c(c1C#N)CCCC2 460768147 HAGWTYVYHRQCJD-UHFFFAOYSA-N 376.934 5.516 30 20 GKED CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 466162942 KCRWWFKGRYGGQB-ZWKOTPCHSA-N 379.504 5.278 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)c1cn(CCCC#N)c2ccccc12 469265505 LCMGRTHQGGGUAJ-UHFFFAOYSA-N 381.479 5.370 30 20 GKED C=CC[C@H]1N(C(=O)c2cccc(OCc3c(C)noc3C)c2)CCCC1(C)C 470281776 AWMWRPAVVZCWAU-OAQYLSRUSA-N 382.504 5.077 30 20 GKED COC1CCC(C)(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 471254366 KCWIMXJITFFKKZ-UHFFFAOYSA-N 393.487 5.067 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1nc2ccccc2[nH]1 475036141 XGAYENPXPDJBDM-CYBMUJFWSA-N 395.340 5.332 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 479215461 YCNRRZFVPIFPSC-GFCCVEGCSA-N 381.888 5.135 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(Br)c(F)c1 484791858 PUDCAIPTBNQMAP-UHFFFAOYSA-N 398.235 5.259 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)c1cccc(C#N)c1 487222992 SJLHFNNXIKJHAW-INIZCTEOSA-N 394.434 5.036 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(F)ccc2F)nnc1-c1ccccc1C 488919801 YVTAYVXRQRRURT-CQSZACIVSA-N 399.466 5.081 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 500611397 OMARINSYLAHKOQ-CYBMUJFWSA-N 376.378 5.108 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)Cc2csc3ccc(Cl)cc23)c1 501617285 GVKZUXLMQDQVDO-UHFFFAOYSA-N 392.814 5.209 30 20 GKED CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 504225618 IOJOJSSMQGKYQC-MHECFPHRSA-N 383.495 5.237 30 20 GKED C[C@H]1C/C(=C\c2ccco2)c2nc3ccccc3c(C(=O)NCCCCC#N)c2C1 505501989 URRLQDTZEQSSED-HVESIFNPSA-N 399.494 5.374 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@H]3CC[C@H](C(F)(F)F)C3)cc2)c1 510843900 YCWIREMOJOVWFT-IRXDYDNUSA-N 388.389 5.054 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1csc(CCCC)n1 512048039 XJNHSYMPXDAEJD-UHFFFAOYSA-N 384.574 5.146 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCC(=O)c3cccs3)cc2)cc1 520560503 WOSUZBFJXRAQCK-UHFFFAOYSA-N 376.437 5.014 30 20 GKED Cc1ccc(CSCCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520939147 LJTDRHFKMDYQDC-QGZVFWFLSA-N 399.585 5.444 30 20 GKED Cc1ccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c(Cl)c1 522306867 PJRLWNCOYPMSLS-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc1 523372262 QAAIHHCYJLUTNE-JOCHJYFZSA-N 383.451 5.065 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1F 523456782 SOARXMSJRWPROI-CXAGYDPISA-N 389.471 5.632 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2cccc(C#Cc3ccccn3)c2)c(C)s1 523591189 ZUJCTVJRZPNTMZ-INIZCTEOSA-N 375.497 5.042 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)sc1SCC#N 525656752 YREAVMJMTUCNBF-STQMWFEESA-N 398.340 5.116 30 20 GKED N#C[C@H](C(=O)c1cccc([C@H]2CCCOC2)c1)c1nc(-c2ccccc2)cs1 536588781 NABAGDRVONBKMT-VQTJNVASSA-N 388.492 5.194 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](N[C@@H](CCC#N)c2ccccc2)CCC3)cc1 536838514 LNAQTFNQKQQBJI-SFTDATJTSA-N 387.552 6.131 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCC2CCOCC2)cc1Cl 539738775 JEEPUTBSQJVMMI-NRFANRHFSA-N 396.918 5.531 30 20 GKED CCCc1occc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 542136590 NYOPZIOQNZXORE-UHFFFAOYSA-N 382.407 5.509 30 20 GKED Cc1ccc(C(C)(C)NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 544799148 JMLGOQQQKOYHQL-GOSISDBHSA-N 398.510 5.224 30 20 GKED N#CCCn1cc(/C=C/c2nc([C@@H]3CCOc4ccccc43)no2)c2ccccc21 545691220 RGDKSQOTPMZEGG-CTDFXDFQSA-N 396.450 5.023 30 20 GKED Cc1nc(-c2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)no2)ccc1C#N 546293836 MSYFSFWEXVGQDO-UHFFFAOYSA-N 398.266 5.016 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)c1 556979216 YQRJFACBWTWXEK-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCc4c(F)cc(F)cc43)cc2)cc1 558074555 XKGSKHYSFLPEIM-UHFFFAOYSA-N 390.389 5.026 30 20 GKED C[C@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 558504874 ZOCSLXSNYWOXBZ-GAJHUEQPSA-N 398.466 5.361 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccncc3Oc3ccccc3)n2)cc1 562454960 GGOUMUGQDIIPSV-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1C 564761726 DAIRFZAQICOEOL-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(-c2cccc(Oc3ccc(Cl)cc3)n2)no1 567459236 NMLFGJKCYIHDOO-CRAIPNDOSA-N 383.835 5.026 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Nc3ccc(-c4ncon4)cc3)cc2)cc1 575091802 YCBVFPOFKBUNRF-UHFFFAOYSA-N 397.394 5.045 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cccc(-c4ccoc4)c3)cc2)ccn1 579536013 SXFMDSMGLQACJA-UHFFFAOYSA-N 381.391 5.258 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cc(O)cc(C(F)(F)F)c3)cc2)ccn1 580134412 AZKMXLZSICRWGG-UHFFFAOYSA-N 385.345 5.082 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Br 583038852 LBJGXSVWABQAQT-HNNXBMFYSA-N 397.297 5.371 30 20 GKED CC(C)c1nc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cs1 588349100 VIOSXZJOCIHTFG-SNVBAGLBSA-N 389.452 5.158 30 20 GKED O=C(Nc1cc(F)c(F)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 591248037 JQPUYCLYPMBOHW-UHFFFAOYSA-N 387.201 5.394 30 20 GKED CC[C@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 594092997 LGJDPFAJDPQKOO-FYPAKXHLSA-N 385.467 5.079 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C)cc1C 606590584 MCJMTECGGIPXEA-UHFFFAOYSA-N 380.467 5.118 30 20 GKED COc1cc([C@@H](C)Nc2ncc(C#N)cc2Cl)ccc1OCc1ccccc1 608886007 KDUCNXWWDMVQOX-OAHLLOKOSA-N 393.874 5.367 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 608923834 CKIDBLXNWYXCNP-IBGZPJMESA-N 399.494 5.040 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209159 SYIBOWWSNJTJRQ-OAHLLOKOSA-N 389.480 5.563 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 609213576 XTDPRVMBUBHUGM-JOCHJYFZSA-N 393.918 5.451 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCc4sccc4C3)cc2)c1 609434244 KALBMDNCHBPBJL-UHFFFAOYSA-N 389.480 5.392 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H](C)c1cccc(F)c1 615346382 DFPJIWLZNMREGK-AWEZNQCLSA-N 387.455 5.175 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc([N+](=O)[O-])c1 617726698 BYKCLFOIABZDLT-OAHLLOKOSA-N 387.395 5.001 30 20 GKED C=CCN(C(=O)C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 643127412 SIWRFEKEGIIYLW-ZDUSSCGKSA-N 397.327 5.205 30 20 GKED FCC1(CF)CC(Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)C1 658049363 ZBBJHHWNBOBALI-UHFFFAOYSA-N 379.266 5.476 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(C(F)(F)F)s1 671649931 LEZSGLDMOPNUTO-UHFFFAOYSA-N 387.276 5.099 30 20 GKED C=C(CNC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccccc1 672481480 SGKYAWOMYRRFSB-UHFFFAOYSA-N 380.538 5.187 30 20 GKED FC(F)Oc1ccc(Cl)cc1CN1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 674463373 PHESEXJGHRCZMZ-UWVGGRQHSA-N 397.693 5.114 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 684695343 CTIWNYSMXIPSFN-UHFFFAOYSA-N 394.262 5.113 30 20 GKED Cc1cc(C(=O)/C=C/c2csc(COc3ccc(Cl)cc3)n2)ccc1O 728230306 CXLNMRGSVQVLSD-WEVVVXLNSA-N 385.872 5.286 30 20 GKED Cc1cc(C(=O)Nc2ccccc2OC(F)(F)F)c(C)n1-c1ccc(C#N)cc1 728264543 AAJKPVPDVMHSGJ-UHFFFAOYSA-N 399.372 5.117 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](OC1CCCC1)c1ccccc1 730988723 BSNCDXFSGCMOFZ-HTAPYJJXSA-N 394.540 5.577 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1csc2ccccc12 731400056 KQYRQHIMPGWCCW-LSDHHAIUSA-N 395.553 6.178 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 734644724 UBPDVEUGCJMWJZ-NIDLKEISSA-N 395.506 5.752 30 20 GKED C=CCOc1cccc(NC(=S)Nc2ccc(OC(F)F)c(Cl)c2)c1 735622724 FAPGPAAJSJTULR-UHFFFAOYSA-N 384.835 5.315 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 737479777 XIHYBQCNPZGZCU-NSHDSACASA-N 397.780 5.338 30 20 GKED COCc1cccc(/C=C\C(=O)c2sc(-c3ccc(OC)cc3)nc2C)c1 742435391 WXCOFOMRBSQLRI-GHXNOFRVSA-N 379.481 5.170 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1F 743038450 ZUIJGUNEMHMWGD-UHFFFAOYSA-N 395.434 5.746 30 20 GKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743097370 VAEOAQCKPQXKIA-CDNPAEQRSA-N 375.516 5.775 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc(Cl)c1O 745990853 ZGPHXRJVMZOZSS-FPYGCLRLSA-N 379.843 5.402 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3cnc(-c4ccncc4)s3)oc12 753142162 OWRAXZUARTUOJM-SREVYHEPSA-N 376.437 5.246 30 20 GKED C=C[C@@H](CC(=O)N(Cc1ccccc1)C[C@@H](O)c1cccs1)c1ccccc1 759334164 TWIRCLMLLCRMOV-RBBKRZOGSA-N 391.536 5.170 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C/c1ccc(Oc2cccc(F)c2)cc1 766491349 NVKVERZHEMVRHH-XDHOZWIPSA-N 382.460 5.121 30 20 GKED C=C(C)C[C@H](C)C(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 767706848 UYWOSBRQPANXRW-UWVGGRQHSA-N 378.683 5.119 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)c1 772982627 DSCVJSKAVWCBPO-AUUYWEPGSA-N 375.299 5.451 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(C)c(C)c1O 774832682 MVCMNSRBNODVFW-UHFFFAOYSA-N 386.451 5.428 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3nccc(C)c3c2)cc1 796791196 DAJOOBPAEOARGN-QVKFZJNVSA-N 385.467 5.018 30 20 GKED C#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 809645380 CVKUSNDDJLVEOC-QGZVFWFLSA-N 382.223 5.214 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1cc2ccccc2o1 812434097 OAEXJZVFTMBTTO-UHFFFAOYSA-N 389.267 5.169 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(F)=C/C3CCCCC3)n2)cc1 815921501 ITSRVKDAYKUVFK-PBXDPIQXSA-N 384.476 5.429 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 820682783 RKMONHYPSGZKHN-BGYRXZFFSA-N 379.529 5.026 30 20 GKED CC(C)(c1cc(F)cc(C#N)c1)c1nc(-c2ccc(C(F)(F)F)s2)no1 904971174 QJGVGJJZALUNAW-UHFFFAOYSA-N 381.354 5.154 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 915085648 DLRIKCITZBYSDN-OAQYLSRUSA-N 394.396 5.542 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2ccc(O)c3ccccc23)cc1 915292515 XFKVEGUGLYZONL-UHFFFAOYSA-N 394.430 5.248 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915354065 UMXCKHZYKNXFNV-HOYKHHGWSA-N 399.494 5.576 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(N3CCCCC3)c(F)c2)cc(Cl)c1O 916128886 HNGPJEQKLKEVOE-VMPITWQZSA-N 389.854 5.080 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Cl)cc1)c1nc(-c2ccc(Cl)cc2)cs1 916628735 ZOGXEKWIFKXCFN-TYIWRNDTSA-N 399.302 6.007 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(C)n(C(C)C)c2C)cc1 916955556 RPIVOOKNQWLKJX-VFNWGFHPSA-N 379.504 5.161 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3cccc(OC(C)C)c3)cc2c1C 921266466 YMNWLLOYUKHSRS-HJWRWDBZSA-N 395.480 5.075 30 20 GKED CC(C)COc1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776335084 GWOFRXLVUIZYGV-WDZFZDKYSA-N 390.435 5.576 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)cc1 1776699916 GRGPWFWDSALRCA-FAFAAHBOSA-N 387.273 5.557 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(F)c(C(F)(F)F)c1Cl 1776784312 UBPKQAOUXFTOPT-ZDUSSCGKSA-N 397.840 5.791 30 20 GKED CCCCCCCOc1cccc(/C=C2/CCc3ncc(C(=O)O)cc3C2=O)c1 1776789252 YOMVPIAQRVKZFU-AQTBWJFISA-N 393.483 5.342 30 20 GKED CCSc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)cc1 1776950956 WVOUTBVHRUQANE-UXBLZVDNSA-N 391.286 5.155 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)s1 1777038306 AUHFOOXDTQDEGR-FLIBITNWSA-N 395.455 5.215 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3c(F)cccc3F)cc2)cc1C(=O)O 1777360818 SPFSOKHEVABSIR-VZUCSPMQSA-N 394.373 5.235 30 20 GKED N#Cc1ccc(CSc2nnc(NC(=O)CCC3CCCCC3)s2)cc1 20989018 WTTAVTNFZXBCJE-UHFFFAOYSA-N 386.546 5.001 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3occc3-c3ccccc3)c2)c1 32290513 BKSNVELFCZGIMN-UHFFFAOYSA-N 394.430 5.650 30 20 GKED CC(C)c1nnc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 52618199 MGHLFQPUMRPSJM-UHFFFAOYSA-N 394.525 5.078 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3cccc(OCCCC#N)c3)ccc2c1 59877024 HYJRMZMJBZQUBA-KRWDZBQOSA-N 388.467 5.273 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3S[C@H](C)CC#N)s2)o1 66802289 BSRNGTROCOKFKA-CYBMUJFWSA-N 397.525 5.667 30 20 GKED CC(C)Oc1cccc(CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 69285594 TZVAPIFHGPCHTC-LJQANCHMSA-N 376.481 5.016 30 20 GKED CCOc1ccc2cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)[nH]c2c1 108324044 MVQCFZHYPBMTOS-AWEZNQCLSA-N 379.485 5.071 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H]3CCc4ccccc43)n2)cc1 115909000 XASNWQNVNIVEAO-PXNSSMCTSA-N 388.492 5.115 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1sccc1Br 120824908 FROAORZIKRNXRA-UHFFFAOYSA-N 389.299 5.363 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2c(Cl)cccc2C1 159295916 YHQGKLLWVQEYSA-AWEZNQCLSA-N 385.920 5.324 30 20 GKED CC(=O)N(c1nc(CN(CCC#N)CC(C)(C)C)cs1)c1ccc(C)cc1C 166001368 NMHGICSMTRJDRS-UHFFFAOYSA-N 398.576 5.206 30 20 GKED COc1cccc(F)c1[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 173122794 JTUFJLPQXNHWOT-KBPBESRZSA-N 387.480 5.111 30 20 GKED COc1cccc(F)c1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 173122815 JTUFJLPQXNHWOT-ZIAGYGMSSA-N 387.480 5.111 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)n1 177749976 UAZYKHOBCAXYHX-IBGZPJMESA-N 387.464 5.421 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2NC(=O)c2ccccc2)n1 177772260 KIRIGBYGTRCZCC-KRWDZBQOSA-N 389.480 5.009 30 20 GKED CN(C)c1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)c(C(F)(F)F)c1 177858915 GSYVRSFTNBSGPN-UHFFFAOYSA-N 394.290 5.182 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(Cl)cc3OCC(F)(F)F)cc2)CC1 180855429 CAFNXGRCOUPJEB-UHFFFAOYSA-N 394.780 5.089 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2ccccc2O[C@@H](C)C#N)on1 182583864 ZSCDGDVMPPPKJE-INIZCTEOSA-N 399.450 5.406 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1c(F)cccc1F 182862412 ZEXZUWNYBJYYIT-CYBMUJFWSA-N 392.496 5.231 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1ccc([S@@](C)=O)cc1 191477829 UPVFHRPSEQKBEG-JYRCXFKTSA-N 398.572 5.501 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)ccc1O 213715370 PLURIMJLIONQEJ-YFHOEESVSA-N 377.421 5.167 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C[C@@H]2CCc3ccccc32)cc1 261477182 LCEGUKSZHKCYSC-NRFANRHFSA-N 396.490 5.390 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1F 303651900 FAVMTCXRKKRWGT-SFHVURJKSA-N 387.389 5.307 30 20 GKED O/C(=N/C1(c2nccs2)CCCC1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329410501 BMKCPIALGQOPIO-QGZVFWFLSA-N 398.576 5.376 30 20 GKED CC(C)/N=C(/O)Cc1ccc(NC(=O)N2CCCC3(CCCCC3)CC2)cc1 329936683 DGSXZDAVVDKJAL-UHFFFAOYSA-N 385.552 5.562 30 20 GKED CC1(C)C[C@H](/N=C(/O)N2CCCC[C@@H]2c2nccs2)c2ccc(F)cc2O1 330129012 JROVJKHVAQDJLM-JKSUJKDBSA-N 389.496 5.026 30 20 GKED CC[C@H](CNC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)CC(F)(F)F 413417604 KWAHARJSKLRYLZ-GXFFZTMASA-N 388.327 5.097 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C[C@@H]1CCCO1)C1CCCC1 428889441 RWZAXFQAPUWWOM-AEFFLSMTSA-N 387.549 5.036 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1)c1ccccc1 431984938 HKXBIQZRKRSMJJ-VJBWXMMDSA-N 375.516 5.132 30 20 GKED C=CCN(C(=O)[C@@H]1CCc2ccc(OC)cc21)c1nc(-c2ccccc2)cs1 432713296 IIYMMFWDPFDGOJ-LJQANCHMSA-N 390.508 5.068 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)N(CCC#N)Cc2ccco2)o1 434202388 DXBWWBQCYLHNOL-UHFFFAOYSA-N 383.835 5.449 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1 435762240 NXNQAHBGDRECOT-QFIPXVFZSA-N 388.515 5.159 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1(Cc2ccccc2Cl)CC1 439111689 AUBLIFHIHAZZLN-OAHLLOKOSA-N 384.932 5.696 30 20 GKED C=CCC[C@@H](NC(=O)Cc1c(C)noc1Cl)c1ccc(C(F)(F)F)cc1 441569281 IHQRDXPHQNMGCS-OAHLLOKOSA-N 386.801 5.021 30 20 GKED N#CC1CCC(CNC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CC1 442719900 HWMOODZPBMVMKL-LADRWXRNSA-N 393.453 5.272 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(N[C@H]3CC[C@H](C#N)C3)cc2Cl)n1 442862490 OKUZXZHBTIEVQU-RYUDHWBXSA-N 376.913 5.385 30 20 GKED N#Cc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1C(F)(F)F 443884116 XAIPEPPRYRUNDF-UHFFFAOYSA-N 391.352 5.531 30 20 GKED CCN(C(=O)[C@H](C)c1cccc(Br)c1)[C@@H](C)c1ccc(C#N)cc1 462143682 ZJZHKSIAOJEIEQ-CABCVRRESA-N 385.305 5.034 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1nc2ccccc2cc1Cl 463950378 MWQJPHFKKTYPIC-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED CCCOc1ccc(-c2nc(C(=O)N(CCC#N)C(C)(C)CC)cs2)cc1 471170503 RFTVWJRJEGIJBD-UHFFFAOYSA-N 385.533 5.143 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471254983 PDZZGYCUFWPDHI-SNVBAGLBSA-N 376.268 5.768 30 20 GKED N#CC[C@@H](CC(=O)NCCCc1ccc(Cl)cc1Cl)c1ccccc1 476224244 KKLNAIFGVZMGOU-KRWDZBQOSA-N 375.299 5.130 30 20 GKED CC[C@@H](CN(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 480537174 FVBFUNZLOSEZOG-MOPGFXCFSA-N 395.572 5.986 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@H]1c1ccccc1 480803091 HLHAYTYANUMCIX-GAJHUEQPSA-N 383.451 5.575 30 20 GKED Cc1ncc(-c2ccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)cc2)o1 482463468 IHIZUYMURZNVKL-UHFFFAOYSA-N 395.418 5.566 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C4CCC4)cc3)n2)cc1 482572105 AFAXYMYIGKKMRD-HXUWFJFHSA-N 388.492 5.576 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1nccc2ccccc12 483187960 AEOADNXDIXNVBV-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED CCSc1cccc(Br)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 484895786 UAJUXBQUJLBVEO-LBPRGKRZSA-N 389.318 5.175 30 20 GKED CC1(C)C[C@]1(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 484907955 JCJRZDPHUUFNJA-JOCHJYFZSA-N 394.471 5.286 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 487603032 LVWWMACSRRGBES-AABGKKOBSA-N 386.417 5.360 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 488707208 CLQKXEAUAXEEDA-FQEVSTJZSA-N 390.508 5.689 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCCc3cccc(O)c32)cc1 490895965 DUBAXXSMVRINEC-UHFFFAOYSA-N 386.476 5.008 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc([C@H]2CCCOC2)cc1 502516844 LKCVGMFJQJMHRE-KRWDZBQOSA-N 375.921 5.124 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1cc2ccccc2s1 504470600 XMVOAUAMWWXUCV-OAHLLOKOSA-N 395.484 5.268 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)oc2ccc(F)cc12 505948715 QBADZVONAVFAML-HNNXBMFYSA-N 377.202 5.182 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3nccc4ccccc34)no2)c2ccccc21 507704485 CMTXZMQHLPLJQL-KHPPLWFESA-N 391.434 5.324 30 20 GKED CCN(C(=O)c1cc(-c2cccc(Cl)c2)on1)[C@@H](C)c1ccc(C#N)cc1 509600742 FEINWBGOBNCTHF-AWEZNQCLSA-N 379.847 5.090 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1ccc(Oc3ccccc3F)c(F)c1)CC2 516819141 IPOKRHUZHRGRKC-OAQYLSRUSA-N 376.406 5.406 30 20 GKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1 523142204 ZLBRMCDREMYOMG-NBGIEHNGSA-N 390.527 5.416 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CSc3ccccc3)cc2F)c1 524461122 KFVDRBBCGGVVPR-UHFFFAOYSA-N 392.455 5.007 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)cc2)c2cc(F)ccc2F)c1 525688655 WLZCDFGIGOQSRP-JOCHJYFZSA-N 380.463 5.438 30 20 GKED C=CCC[C@H](NCc1cc2ccccc2nc1O)c1ccc(C(F)(F)F)cc1 537128418 FRZUTOIGMDLVMO-IBGZPJMESA-N 386.417 5.756 30 20 GKED C=CCC[C@H](NCc1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 540431370 YPOLWMYJTCEFGA-FQEVSTJZSA-N 376.422 5.461 30 20 GKED C=C[C@H](Cc1nc(-c2cccc(NC(=O)c3ccco3)c2)no1)c1ccccc1 545059635 LQDQMOMMWFPUOU-MRXNPFEDSA-N 385.423 5.094 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2Cl)C1 576558459 FQDIHPIMXUPUOW-CVEARBPZSA-N 399.947 5.057 30 20 GKED C[C@](C#N)(NC(=O)c1sc2ccccc2c1Br)C1CCCCC1 579557936 YCSBJDSQCHZZBR-GOSISDBHSA-N 391.334 5.256 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 579853699 CVYMROFBAJBBFP-YNEHKIRRSA-N 376.934 5.538 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(SCc3ccccc3)cn2)c1 586800895 IOGYJHKPTUICOH-UHFFFAOYSA-N 379.872 5.151 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2cncc(C)c2)cs1 588476569 RRESVXUVAAGVNL-YVMONPNESA-N 397.887 5.081 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)CCCCCC#N)C(C)C)cc1 588755296 GEESNAYRYZJFCB-UHFFFAOYSA-N 378.516 5.573 30 20 GKED N#CCCC[C@@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccccc1 590069309 VLEYHFPTIRRYLL-RUZDIDTESA-N 388.486 5.929 30 20 GKED CC[C@H](C#N)N(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 594090553 FPWQOWXTMFWYPO-LLVKDONJSA-N 396.343 5.155 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2Cl)c1)c1ccc(C#N)cc1 603633598 UYCAISQWCMIHMD-QGZVFWFLSA-N 376.887 5.641 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1cc2ccccc2o1 609061222 WHVYVNPEICDZDI-UHFFFAOYSA-N 396.446 5.373 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 609080495 IONRWABGMYXVFU-LJQANCHMSA-N 399.494 5.671 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)on2)cc1 609376629 GXPOVLVPWDEDSR-HNNXBMFYSA-N 377.469 5.154 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3ccsc3)c2)c1 609643447 OJYZEGPBQFRUJN-JOCHJYFZSA-N 388.492 5.176 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 609773526 IVHTWHRIVMSXFH-LJQANCHMSA-N 397.906 5.028 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccccc2Br)c(F)c1 611519489 JZIQSDJTCOHFQI-OAQYLSRUSA-N 395.275 5.339 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1C 727980442 LOWIOBYLPHTFDG-UHFFFAOYSA-N 387.508 5.563 30 20 GKED O=C(c1cc(F)c(F)c(F)c1F)N1CCC[C@@H]1c1ccccc1C(F)(F)F 728035166 JTWBLOOBCIFAOP-CYBMUJFWSA-N 391.286 5.239 30 20 GKED Cc1ccc(S[C@H](C(=O)[C@@H](C#N)c2nc(C)cs2)c2ccccc2)c(C)c1 730071050 KQSGHRLFSHDFOA-NQIIRXRSSA-N 392.549 5.778 30 20 GKED N#CCCCCOC(=O)[C@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1 730646688 YAWBUOJRLJYQIQ-GOSISDBHSA-N 378.255 5.351 30 20 GKED O=C(/C=C\c1ccc(-c2cccc(F)c2)s1)c1ccc(C(F)(F)F)nc1O 731564452 FTQKNSIZPFXVRF-DAXSKMNVSA-N 393.361 5.570 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)cc1 731980528 AJPITPXWKLLYGJ-UHFFFAOYSA-N 392.842 5.216 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cccc(Cl)c1 733079519 FLRDZMFXTNPKNC-UHFFFAOYSA-N 391.784 5.047 30 20 GKED CCOc1ccc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 733083832 RENJDYCSIILIFY-DHZHZOJOSA-N 380.425 5.013 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCCc3c[nH]c4ccccc34)c2)s1 739595351 WSZIXOVFYMUKOE-UHFFFAOYSA-N 399.519 5.407 30 20 GKED O=C(CCC(F)(F)F)O[C@H](c1cc(Br)ccc1F)C(F)(F)F 744113387 AKKFSCDCVQKRTJ-SNVBAGLBSA-N 397.084 5.077 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(SC)c(OC)c3)cs2)c1 747614673 LTQZDXRJMUTLBY-HJWRWDBZSA-N 397.521 5.445 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc(CNc2ccccc2)cc1 748384620 DRPRYGLSFLZQEJ-UHFFFAOYSA-N 396.450 5.115 30 20 GKED COc1cccc(/C(C)=C/C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 751233220 PPGMBJREEFUWBW-DTQAZKPQSA-N 399.450 5.105 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\SCc3ccco3)cc2)c1 754230971 UMLRFRMXVZYDQE-BENRWUELSA-N 376.437 5.329 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCc3c(F)cccc3C2)cc1 757879048 HCIHEUGQAAZNSU-QFIPXVFZSA-N 385.442 5.071 30 20 GKED CCc1ccc(CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 762995242 NUHMUASKGBKWHN-OAHLLOKOSA-N 388.414 5.296 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1sc2cc(Br)ccc2c1Cl 766583459 BOXVZEMHLUYCNE-MRXNPFEDSA-N 399.741 5.375 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2oc3ccc(OC)cc3c2C)c1 772982275 BKOVKGSLAAAZAY-SJLPKXTDSA-N 378.472 5.282 30 20 GKED Cc1cccc(-c2nnc([C@H](C)Sc3nc(C(F)(F)F)ccc3C#N)o2)c1 777569460 IZDLWBDHXUBGGE-NSHDSACASA-N 390.390 5.184 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@@H](C#N)c3nccc4ccccc34)ccc2c1 792092237 PGKIHRBAJQLSQP-HJPURHCSSA-N 380.447 5.377 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1nccc2ccccc12 792095964 YREKVMHZAZSVQC-WHIOSMTNSA-N 382.463 5.446 30 20 GKED C=CC[C@@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccncc1 792989232 YHWQVMZBUCHZNW-MRXNPFEDSA-N 385.227 5.270 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C\Sc1cc(F)ccc1F 797866566 VZVIIIMORKUYCS-FLIBITNWSA-N 376.453 5.215 30 20 GKED Cc1ccc(Cn2nc(C)c(CNCc3ccc(C#N)c(Cl)c3)c2Cl)cc1 800895295 AITYBDDDUQGMTM-UHFFFAOYSA-N 399.325 5.017 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3nc(Cl)c(C#N)s3)s2)cc1 804459484 WZHKAKCDFQGNEE-JTQLQIEISA-N 390.921 5.282 30 20 GKED C#CC[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1COC(C)(C)CC 806418795 NLLHWCFLYIYRJI-OAQYLSRUSA-N 378.516 5.148 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)cc1Cl 810529254 CGGHGDIFYWXNTA-ZDUSSCGKSA-N 389.282 5.252 30 20 GKED COc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Cn1cccn1 815635882 LJCOFXRTXVMFSK-AUSIDOKSSA-N 388.515 5.026 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3ccc(Cl)nc3Cl)c(C#N)c2[C@@H]1C 839389990 BRYQXDJQFPYQQR-RKDXNWHRSA-N 380.300 5.260 30 20 GKED N#CCOc1cccc(NC(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)c1 916409861 QTNKOWIMACYAPK-PKNBQFBNSA-N 378.428 5.108 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nn(-c2ccc(Cl)cc2)c(=S)s1 917839023 TZJCOCWOUQRTNR-OAHLLOKOSA-N 389.958 5.544 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nc(O)c2c3c(sc2n1)CCCC3 1307236651 LKFBRBVUBHAENH-UHFFFAOYSA-N 387.917 5.093 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776144206 BOQJEFXGUVHUJS-YWEYNIOJSA-N 398.867 5.627 30 20 GKED C=CCc1cc(C)c(OCCCN2CCC([C@H]3CCC[C@@H]3C(=O)O)CC2)cc1C 1776188878 LGJZFLRYCLITMC-PKTZIBPZSA-N 399.575 5.014 30 20 GKED CC(C)CCOc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776327007 OXWJRZLRYCHWTR-XMHGGMMESA-N 378.468 5.412 30 20 GKED CSc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1Cl 1777403404 JSCIDGHVWCCZCA-DAXSKMNVSA-N 390.888 5.443 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)o1 1777424548 KVWDTMDHQHLQHC-DTQAZKPQSA-N 390.410 5.695 30 20 GKED Cc1ccc(-c2cccc(/C=C/C(=O)c3cccc(O[C@@H](C)C(=O)O)c3)c2)cc1 1777429694 INVIEPOUGJEQNK-BJRSVTDJSA-N 386.447 5.410 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(C)c(C(=O)O)c3)s2)cc1 1777430651 YPDBXFMIQUILNC-DHZHZOJOSA-N 377.465 5.330 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2nc(C)cc(C(F)(F)F)c2C#N)c1 10399600 LWAIECZBESHIAS-CYBMUJFWSA-N 393.434 5.017 30 20 GKED CCN(C(=O)CCCc1nc2ccccc2s1)[C@H](C)c1ccc(C#N)cc1 45499192 QCMWYYLWVCYZNM-MRXNPFEDSA-N 377.513 5.100 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2ccc(C)c(C)c2)c1 55011504 WBHQBLRLGFASCH-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66800641 FXOHGNAIAKWJCK-LLVKDONJSA-N 379.407 5.055 30 20 GKED COc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 66954266 BZIZSAZDWDVDAA-VQIMIIECSA-N 395.528 5.458 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 112738251 NKYJBBZMYMBTRQ-UTKZUKDTSA-N 381.545 5.942 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1Cl 113144631 WKCCUVAWIWQORV-VSZOKUSCSA-N 393.657 5.008 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 120994456 NEBBQEXULFAACZ-UHFFFAOYSA-N 375.472 5.221 30 20 GKED C[C@@H](Cc1nnc(SCc2ccccc2C(C)(C)C#N)o1)c1ccccc1 133986935 RBNQHVZXOXYANU-INIZCTEOSA-N 377.513 5.509 30 20 GKED COc1cccc(F)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 184516743 KCXPKIIJNZWVQA-UHFFFAOYSA-N 396.805 5.404 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@H](C)CCO 191450408 KZINUNHBMZTSIY-LJQANCHMSA-N 380.532 5.344 30 20 GKED Cc1c(Cl)cccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 193824500 HDTAPCMTBMCXHQ-INIZCTEOSA-N 377.856 5.134 30 20 GKED C=CCn1c(SCc2ccccc2OC(F)F)nnc1-c1ccccc1F 217926280 XVOCTWGGOSNCAS-UHFFFAOYSA-N 391.418 5.164 30 20 GKED N#CCCCOc1cccc(CN[C@@H](Cc2ccccc2)c2ccccc2F)c1 237877936 GWFURGIZIIASBU-VWLOTQADSA-N 388.486 5.582 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c2[C@@H]1C 297916769 RUDIDNVDADZZBC-JGVFFNPUSA-N 385.436 5.033 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303289855 MEBGQHIDDJBPID-ROUUACIJSA-N 396.556 5.776 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](c4ccccc4)C3)cc2)c1 303299685 CNZIEKFFLZGUOS-HXUWFJFHSA-N 383.451 5.372 30 20 GKED Cc1nc(N2CCC(/N=C(/O)C3CCCCC3)CC2)c2c(C)c(C)sc2n1 329293309 RMQROVLNTBLVNS-UHFFFAOYSA-N 386.565 5.122 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccc(F)c(C(F)(F)F)c1 330323522 SXULINVWASTNAF-SNVBAGLBSA-N 388.386 5.140 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CC[C@H](c2ccccc2F)C1 432088656 KIWNDCIGLKQQPD-IKGGRYGDSA-N 397.519 5.535 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@@H](C#N)CCc3ccccc3)cc2)n1 433302279 XIFDNTQCIUJJGS-QGZVFWFLSA-N 393.537 5.314 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(-c3cccc(C(F)(F)F)c3)cn2)c1 440050849 ZFYREWVUIRAXQL-UHFFFAOYSA-N 381.357 5.086 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1cccc(F)c1)C1CCCC1)c1ccccc1 440255032 MEASPXPWLLHZBC-QFIPXVFZSA-N 379.479 5.325 30 20 GKED COCCC[C@@H](NC1CCC(Oc2ccccc2C#N)CC1)c1ccc(F)cc1 442880374 YOZSURYLIXXDER-XPPIMPSXSA-N 396.506 5.145 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1 444395934 ZHWMJOOUQWRADH-MRXNPFEDSA-N 387.439 5.701 30 20 GKED CC(C)c1ccc(-c2noc(/C=C/c3cn(CCC#N)c4ccccc34)n2)cn1 445519844 QQJYPNYGABZGDU-PKNBQFBNSA-N 383.455 5.294 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458801413 MZTOPHIBCHVCJA-QFIPXVFZSA-N 379.504 5.050 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1cncc2ccccc12 462489239 CORRHPUKEWXTNH-INIZCTEOSA-N 375.497 5.058 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C 463524665 FJIBHXNMUWQPOX-UHFFFAOYSA-N 399.416 5.120 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCC(F)(F)F)c1cc(C(F)(F)F)ccn1 464408776 SFLNZVIJIBANBM-AWEZNQCLSA-N 386.295 5.085 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cc(C(CC)CC)no1 466115161 GKMSPSBGZMOIBJ-UHFFFAOYSA-N 381.929 5.191 30 20 GKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2ncccc2OCCCC#N)cc1 466599917 IFGKOIQCZCVKOK-WIYYLYMNSA-N 392.503 5.078 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCC3(C(F)F)CC3)cc2Cl)cc1 471251826 SSSFZBUPIACHCU-UHFFFAOYSA-N 391.805 5.171 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)SCCCOc1cccc(C#N)c1 477348173 FWAVWJMOGZKJNK-QGZVFWFLSA-N 382.529 5.211 30 20 GKED CN(C(=O)c1csc(-c2cccc(Cl)c2)n1)c1cc(Cl)ccc1C#N 479567080 PGFADCUUKURLPM-UHFFFAOYSA-N 388.279 5.265 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)Nc3ccc(F)c(C#N)c3)cc2)cs1 481592781 DKDLATMOHKBWGM-LBPRGKRZSA-N 380.448 5.012 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 481791250 CEGPCWMBBPIOMV-GOSISDBHSA-N 382.529 5.495 30 20 GKED CCc1c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cnn1C(CC)CC 485641242 GKROHSRWBPUBPX-INIZCTEOSA-N 393.318 5.108 30 20 GKED C=CCSc1ccccc1C(=O)NCc1cccnc1Oc1cccc(F)c1 485762834 KPWJWUPWVGGBSB-UHFFFAOYSA-N 394.471 5.221 30 20 GKED Cc1c(C(=O)NCc2cccc(-c3ccccn3)c2)sc2ccc(C#N)cc12 486349072 KXAQHFSXPNQBBS-UHFFFAOYSA-N 383.476 5.073 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1cc2ccccc2o1 486726143 YNLBIQYJXTYHGA-HNNXBMFYSA-N 396.537 5.699 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccccc1Cl 499933549 VTLNVOFAPMPSJJ-IBGZPJMESA-N 382.822 5.053 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)CC1 508514193 VELHPIGFMPDUDD-QHCPKHFHSA-N 383.495 5.264 30 20 GKED C=CCN(C(=O)c1ccc(Cl)c2ncccc12)c1nc2c(s1)CCCC2 509026907 QERBPNCODYAJOV-UHFFFAOYSA-N 383.904 5.056 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)CCCCc1ccc(Cl)c(Cl)c1 509891313 SQDQKUSFTPRNEG-UHFFFAOYSA-N 390.314 5.044 30 20 GKED N#CCCCOc1cccc(NC(=O)Cc2cc3c(ccc4ccccc43)o2)c1 510026131 NBLKGPNRERBHGG-UHFFFAOYSA-N 384.435 5.450 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)c3cnc(C(F)(F)F)c(C#N)c3)c2)o1 510583136 WFXBNFPMVCANOK-UHFFFAOYSA-N 385.345 5.101 30 20 GKED Cc1cc(OC(F)F)c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)s1 512980779 KFGLTBYTDSDBPU-SECBINFHSA-N 398.843 5.411 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)C3CCCCC3)s2)c(C(F)(F)F)c1 514117500 XIUWSLDSBWNNQX-UHFFFAOYSA-N 393.434 5.143 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1-c1nc2ccccc2s1 514509711 FADULCVLNFLVRN-UHFFFAOYSA-N 398.491 5.499 30 20 GKED C[C@H](c1ccccc1)n1c(SCc2ccccc2C#N)nnc1-c1ccccc1 515487229 IQHHBDPJWKQQRX-GOSISDBHSA-N 396.519 5.718 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517131691 HPQYZNOPOHIPNY-DEOSSOPVSA-N 397.478 6.028 30 20 GKED Cc1[nH]c2ccc(CNC(=O)N(Cc3ccc(C#N)cc3)CC(C)C)cc2c1C 521886317 SBJYFAKAMSKTMP-UHFFFAOYSA-N 388.515 5.024 30 20 GKED CC(C)[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 522601678 SFVPRXJTCXZXQV-IBGZPJMESA-N 389.421 5.116 30 20 GKED COc1cc(CSc2ccccc2OC)ccc1OCc1cccc(C#N)c1 523932201 HTWIJAXJYMHDSA-UHFFFAOYSA-N 391.492 5.447 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(C)(C)c1ccccc1 524114514 CSTGMYGLNSAJAW-UHFFFAOYSA-N 384.479 5.362 30 20 GKED C[C@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccc(C#N)cc1 524515371 SWBWTMJWSDFRMF-XOBRGWDASA-N 393.537 5.100 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccccc1OCC1CC1 524896463 YHSWMOMCVZCIHK-HNNXBMFYSA-N 381.501 5.371 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(OC(C)C)CC1)c1ccc(C(F)(F)F)cc1 533546817 WCBCBBIKGFZYFM-IBGZPJMESA-N 398.469 5.312 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2ccoc2)c1)c1nc2cc(Cl)ccc2s1 535553055 FTGHMJFJNFFUFI-MRXNPFEDSA-N 378.840 5.700 30 20 GKED C=CCCOCCCCC(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21 537194188 ZBRIKZSOVXEVST-JOCHJYFZSA-N 379.500 5.056 30 20 GKED N#C[C@H](C(=O)c1ccn(Cc2ccccc2)c1)c1nc(-c2ccccc2)cs1 542881253 OXHNQFHDOFJMHX-HXUWFJFHSA-N 383.476 5.150 30 20 GKED N#Cc1c(NC(=O)Cc2ccccc2C(F)(F)F)sc2c1CCCCC2 552387291 ZHVAHVVQAMNIIU-UHFFFAOYSA-N 378.419 5.089 30 20 GKED CC[C@H](CC#N)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 552433928 IPLPRJZTVWVPRW-LLVKDONJSA-N 396.343 5.203 30 20 GKED N#CCCN(C(=O)CCCOc1cccc2ccccc12)c1ccc(F)cc1 558145576 GJABBMLQQKXXOS-UHFFFAOYSA-N 376.431 5.085 30 20 GKED C[C@H](c1ccccc1)N(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C1CC1 561256263 ZNYVFYUKGAYFEU-QGZVFWFLSA-N 383.451 5.111 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc([N+](=O)[O-])c1 565987405 DXKBJXYIXUUJJM-OAHLLOKOSA-N 387.395 5.001 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)c2cnn(C(C)C)c2n1 567815443 PZFRRRWDUUTAAD-LJQANCHMSA-N 397.482 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1CC(c2ccccc2)C1 572493392 XBJJANNZTFPRQN-LRYGQEGESA-N 379.529 5.396 30 20 GKED Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4ccccc4CC#N)cc3)o2)c1 573522516 OWWKTKUTOCSJTP-UHFFFAOYSA-N 394.434 5.030 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(OCC2CC2)c(F)c1 578687811 SIDZVGWVLWBRAJ-ZDUSSCGKSA-N 392.396 5.356 30 20 GKED COc1ccccc1-c1cccc(NC(=O)c2cc(-c3cccc(C#N)c3)no2)c1 581289933 GRGJRELWFADGGW-UHFFFAOYSA-N 395.418 5.141 30 20 GKED C=CCCC(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 588026981 FXLOKRCOLCTQIJ-UHFFFAOYSA-N 380.341 5.002 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)C(F)(F)[C@H](C)C1 599729399 XNUSUISWFFQOQT-IYBDPMFKSA-N 399.441 5.414 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 601687691 ZXQPZSIRDMTUAM-UHFFFAOYSA-N 381.516 5.471 30 20 GKED C[C@@H](NCc1ccc(OCc2c(F)cccc2Cl)cc1)c1ccc(C#N)cc1 603633316 XOHQMHSYHCRCNS-MRXNPFEDSA-N 394.877 5.781 30 20 GKED C[C@H](CC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cccc(F)c1 604699263 KELIQCMAUDHXCG-WXHSDQCUSA-N 399.350 5.345 30 20 GKED N#C[C@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609460850 YCPCBJABGMMEIU-KRWDZBQOSA-N 380.797 5.063 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@@H]1CCCCO1 611480913 TVVDBLCFDJQEMD-DLVCFXQMSA-N 397.906 5.075 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611851664 DDHLMACOXZKJPB-ZWKOTPCHSA-N 384.483 5.050 30 20 GKED CC(C)(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(F)c1 619124816 FXYLSNLYTVXZQU-UHFFFAOYSA-N 387.339 5.273 30 20 GKED Fc1cc(-c2noc([C@H](C[C@H]3CCCO3)C(F)(F)F)n2)ccc1C(F)(F)F 650533137 MJTHYCYXZZOFNO-KOLCDFICSA-N 398.278 5.110 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc2nc(O)oc2c1)c1ccc(C(F)(F)F)cc1 671753892 GYZWMOWLMKZHIB-SUMWQHHRSA-N 390.405 5.910 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccco2)s1)c1nc2ccccc2n1C(F)F 675908561 SLJXVPYHZDIMNV-NSHDSACASA-N 383.379 5.243 30 20 GKED C=CCC[C@H](C(=O)NCc1cccc(OCc2ccccn2)c1)c1ccccc1 681652110 LPTIOGIDRXZHLS-DEOSSOPVSA-N 386.495 5.027 30 20 GKED CCC(=NNc1ncnc2c1oc1ccccc12)c1ccc(OC(F)F)cc1 725844324 UUABZHBPOSGZTP-UHFFFAOYSA-N 382.370 5.204 30 20 GKED Cc1cccc(Oc2ccccc2NC(=O)NCc2ccc(OCC#N)cc2)c1 727935733 VCODPYDPECEZRX-UHFFFAOYSA-N 387.439 5.011 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(F)c(Cl)c1 730954926 OOOXUUMEGUQWEF-LLVKDONJSA-N 379.913 5.540 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4ccccc4SCCC#N)cc3c2C1 731014859 MXLPVFCZNGTOOB-HNNXBMFYSA-N 389.524 5.551 30 20 GKED CCOC(=O)c1ccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)cc1 731322392 YQFDWKAZGFTIJC-AWEZNQCLSA-N 399.541 5.066 30 20 GKED C=CC[C@H](NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccncc1 734234034 FGCCEUHNXMGNKG-BQYDLMEBSA-N 378.472 5.396 30 20 GKED Cc1ccc(/C=C2\CC(O)(C(F)(F)F)C/C(=C\c3ccc(C)s3)C2=O)s1 735793043 QJLKLFBTGJFMEQ-FNCQTZNRSA-N 398.471 5.550 30 20 GKED N#CCCCOc1cccc(CNCc2cccc(-c3ccc(C#N)s3)c2)c1 740014064 LVSJTWCOVPIYPV-UHFFFAOYSA-N 387.508 5.259 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F)c1ccncc1 741088674 AHQGTMFYABAETJ-GOTSBHOMSA-N 389.474 5.121 30 20 GKED O=C(/C=C/c1cccc(NC(=O)C(F)(F)F)c1)c1cccc(-c2ccncc2)c1 741471601 BQUVRZDRFJUXBO-BQYQJAHWSA-N 396.368 5.146 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 742537244 JHKZGAHAQRWFJQ-MHECFPHRSA-N 386.470 5.689 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1ccc(N2CCO[C@H](C)C2)cc1 743181786 ZCNJWIRWFSRPBR-LJQANCHMSA-N 375.557 5.126 30 20 GKED Cc1ccc(Cl)c(N2C(=O)/C(=C/c3ccc(C#N)o3)SC2=S)c1Cl 743282034 IPMJPKOQMYOBBM-SDQBBNPISA-N 395.292 5.172 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)n2)cc1 744034684 KDLYRVKBYINKOM-GVDBMIGSSA-N 394.446 5.377 30 20 GKED C=CCC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 749841223 VGCMXBZYQSAJMC-IERDGZPVSA-N 388.433 5.793 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 750150061 NMBROPWZNLONQT-UHFFFAOYSA-N 393.512 5.073 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1sccc1Br 751512900 BHTJMIFFNASKJV-ARJAWSKDSA-N 382.329 5.592 30 20 GKED Cc1ccccc1CC1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 752636524 LUBTVSGRAUWHNI-VWLOTQADSA-N 395.506 5.357 30 20 GKED CC(C)(C)O[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 754530264 DXBXCMRKBSLKHL-HNAYVOBHSA-N 398.915 5.682 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2O)c1 756708611 DZYFOEXXGLCSMT-GXTWGEPZSA-N 379.287 5.231 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)cc1 769936546 LWONLVDCNOAPBI-UHFFFAOYSA-N 383.364 5.303 30 20 GKED Cn1c(/C(Cl)=C/c2ccc(C#N)s2)nc2ccc(Br)cc21 776723574 JHVUUFHIMVWIRV-GHXNOFRVSA-N 378.682 5.006 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1Cl 778973132 VNPVHIMGPWPDGV-QFIPXVFZSA-N 390.870 5.130 30 20 GKED CC[C@H]1C[C@@H](C=NNc2ccc(Br)cc2C(F)(F)F)CCO1 779775367 AOXVXRPWZNHSDU-JQWIXIFHSA-N 379.220 5.071 30 20 GKED O=C(/C=C\c1cc(Cl)cc(C(F)(F)F)c1)c1cccc(N2CCOC2=O)c1 780187394 QXUNKQASHKIFAH-PLNGDYQASA-N 395.764 5.212 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@H](Cc1ccccc1)c1ccccc1 780669623 HKGMCKUGGFYMAG-UGKGYDQZSA-N 399.494 5.125 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC(=O)c2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 789349458 YRYKWFNTMVLNGE-IAGOWNOFSA-N 392.867 5.010 30 20 GKED N#CC1(CCCOC(=O)c2cc(-c3ccccc3)ccc2Cl)CCOCC1 800165472 PMRYWZHYJDTKSO-UHFFFAOYSA-N 383.875 5.264 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2nc(-c3ccccc3)cs2)C(=O)c2ccccc21 802706983 CGBBYAOVAMCFIN-NRMGUKERSA-N 389.476 5.127 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1nc(C2CC2)cs1 842940711 DHIBQOJLUSPRNO-SCEWNMGZSA-N 378.497 5.232 30 20 GKED O=C(c1occc1COc1ccccc1)N(O)Cc1cc(Cl)cc(Cl)c1 901380363 WJHGOCWVLAJICM-UHFFFAOYSA-N 392.238 5.197 30 20 GKED C[C@H](CCc1ccc(O)cc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354036 TUIXMEBYAWVINP-KOSHJBKYSA-N 399.494 5.190 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(C2CCCCC2)cc1 916884189 ZVODRXIROUAJHL-FQEVSTJZSA-N 380.875 5.349 30 20 GKED Cc1cc(/C=C/C(=O)[C@@H](C#N)c2nc3ccccc3o2)c(C)n1C1CCCCC1 917509916 GXLMJUDPEGYMER-DRUFCSCSSA-N 387.483 5.641 30 20 GKED N#CC1(C(=O)OCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CCCCC1 920673245 GVAUBKWUXIYECT-UHFFFAOYSA-N 390.443 5.058 30 20 GKED C=C(Cl)COc1ccc(C(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033385 XHGBTSRAILARRX-UHFFFAOYSA-N 379.243 5.006 30 20 GKED CC(=NNc1ccc(C(=O)O)nc1)c1ccc(-c2ccc(Cl)cc2F)s1 1776070289 GPLUJVOKCABXCS-UHFFFAOYSA-N 389.839 5.137 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1sc(-c2ccc(F)cc2)nc1C 1776088108 QAPJVZZSOHLZFL-UHFFFAOYSA-N 383.448 5.100 30 20 GKED C=CCC[C@@H](CC(C)C)C(=O)Nc1cc2c(c(C(=O)O)c1)Oc1ccccc1O2 1776166327 RGCTXJQNVXZSKA-HNNXBMFYSA-N 395.455 5.850 30 20 GKED CCCCCCCOc1cccc(CN[C@H]2CCCC[C@H]2CCC(=O)O)c1 1776787278 KJZGBRPDBHPOJK-UNMCSNQZSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(C[C@H](CC)C(=O)O)cc2)c1 1776787583 FOQJOLJBNCORAJ-QFIPXVFZSA-N 397.559 6.301 30 20 GKED CSc1ccc(C)c(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 32290508 VBOKRYHNGFSNCL-UHFFFAOYSA-N 388.492 5.420 30 20 GKED N#C[C@H](C(=O)c1ccccc1COc1ccccc1)c1ccc(C(F)(F)F)cn1 41553023 IGOGPYKRAMONIH-IBGZPJMESA-N 396.368 5.169 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1c(Cl)c2ccccc2n1C 108325288 YKCAUOBQAIOFPT-CYBMUJFWSA-N 383.904 5.336 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 109553196 YDYKJORGTXTORK-UHFFFAOYSA-N 396.368 5.505 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 111781188 RNGIZZMPOPCFNA-UHFFFAOYSA-N 397.494 5.339 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 115300100 NZEFCLOTEKVFCE-UHFFFAOYSA-N 390.439 5.160 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1 115850156 ZKIZBVIVTVSTGI-QFIPXVFZSA-N 391.540 5.133 30 20 GKED N#CCCCOc1cccc(CNc2ccccc2OCc2cscn2)c1 127395328 AYSZQZLQFQSGQQ-UHFFFAOYSA-N 379.485 5.017 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)c1 174103606 CWHKPIPUQMKOMX-IBGZPJMESA-N 389.480 5.040 30 20 GKED CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 176993212 ZNPFBCDJCKBMAM-YQQAZPJKSA-N 377.579 5.267 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(F)c(F)c1F 177193732 XWZZSQTUJHQQGF-UHFFFAOYSA-N 396.368 5.115 30 20 GKED COc1ccc(CNc2cccc(Oc3ccccn3)c2)cc1OCCCC#N 181435709 SEGBOOUBENVKEC-UHFFFAOYSA-N 389.455 5.177 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](c1ccccc1)c1cccnc1)c1ccc(F)c(F)c1 185475142 PJUDPAXXVNQBMS-FCHUYYIVSA-N 393.437 5.066 30 20 GKED C=C(C)[C@H](NCc1nnc(-c2ccc(Cl)cc2)o1)c1ccc(F)c(F)c1 187781463 BSYQRPUGGDKZAO-SFHVURJKSA-N 375.806 5.075 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3sccc3[nH]2)cc1 188697312 AODOJBNVSCMTTM-UHFFFAOYSA-N 387.464 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(=O)N([C@@H](C)c2ccccc2)C1 189886223 YSECCLAIKNHFMI-GHTZIAJQSA-N 390.527 5.087 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/CC1(c2cccc(Cl)c2)CC1 328813785 BXBGSBKNCIFXHZ-CQSZACIVSA-N 390.936 5.035 30 20 GKED O/C(=N\C1(C/N=C(/O)[C@@H]2CCCC(F)(F)C2)CCC1)[C@@H]1CCCC(F)(F)C1 329092583 AFPFVNBMRKEXLQ-ZIAGYGMSSA-N 392.437 5.473 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCc2sc(Cl)cc21 426058683 FNUGNTULVOQGDH-KRWDZBQOSA-N 387.936 5.271 30 20 GKED Cc1ccc(CCC2CCN(C(=O)c3cccc(SCC#N)c3)CC2)cc1 429970899 WNNFVNZMSBFDSV-UHFFFAOYSA-N 378.541 5.096 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc3nc(C4CC4)oc3c2)o1 430524355 KGCJVBCWOAIDMV-UHFFFAOYSA-N 399.406 5.001 30 20 GKED CC1(C)C[C@@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)c2ccc(F)cc2O1 431289558 GSTHUNIBRZGIOR-WOJBJXKFSA-N 395.478 5.162 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 433522991 YLJYSLKVWUFDCP-MRXNPFEDSA-N 393.462 5.073 30 20 GKED C=CCC[C@H](NC(=O)N[C@H]1CCOC2(CCC2)C1)c1ccc(C(F)(F)F)cc1 441537593 XNYQMHNLKSHDBP-ROUUACIJSA-N 396.453 5.114 30 20 GKED CSc1ccccc1[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 441633214 ITXYQBNZNQMODE-CABCVRRESA-N 385.558 5.543 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cn(CCCC#N)c3ccccc23)n1 447611668 ZYENYIMTVSPLTO-MRXNPFEDSA-N 376.485 5.015 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458805591 UTCAQZIKRYBHJR-PKTZIBPZSA-N 375.516 5.585 30 20 GKED Cc1ccc(Br)cc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 461115805 UVNMBVOOSXACPM-CQSZACIVSA-N 398.087 5.059 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 464942221 IIGQNVMWSLEQPG-BURNTYAHSA-N 398.428 5.107 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1cccc(C(F)F)c1 468266050 IUBWLBBBTVBUCV-UHFFFAOYSA-N 393.393 5.173 30 20 GKED CCc1cccc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 468645582 QDEXBSOACBYPFL-INIZCTEOSA-N 384.570 5.373 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl)Cc1cccc(F)c1 469298822 WACGSQNMWVORAQ-PXAZEXFGSA-N 379.262 5.082 30 20 GKED CC[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccc(F)cc1F 469448317 NKIMQJVDYJOHBD-FQEVSTJZSA-N 381.426 5.104 30 20 GKED C[C@@H](CCNC(=O)c1cc(F)c(F)c(F)c1F)c1cccc(C(F)(F)F)c1 470240660 XYHVVCKORYNMEK-VIFPVBQESA-N 393.302 5.185 30 20 GKED C[C@H](CCNC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 470468823 UKVQUYNEUPPPJP-HUUCEWRRSA-N 389.421 5.131 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1)C1CC1 474975213 XURWWWKWUIKIJV-GFCCVEGCSA-N 389.286 5.211 30 20 GKED COc1ccccc1SCC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 479859652 UPQXEYITCWTSNB-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CCN(C(=O)CSc1ccc(C#N)cc1)C(c1ccccc1)c1ccccc1 482490564 BAKGGBDDYASHNZ-UHFFFAOYSA-N 386.520 5.288 30 20 GKED Cc1cc(C)c(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1Br 486328786 VSFAEOIMYXCNKM-QGZVFWFLSA-N 386.293 5.233 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ncc(COC)s1)c1ccc(C(F)(F)F)cc1 487113826 JLXLKPITFLHKBR-OAHLLOKOSA-N 399.438 5.137 30 20 GKED C[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487546691 WPLDWTXORFEDQY-JXFKEZNVSA-N 399.332 5.494 30 20 GKED CCCCc1ccc(CC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 487879479 WWDVCQUSILCTBG-UHFFFAOYSA-N 388.433 5.034 30 20 GKED CCCn1ccc2cc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)ccc21 503450566 IJYQEWCCOHIXLI-UHFFFAOYSA-N 384.483 5.244 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1nc2ccccc2n1CC 505011503 WLVMGSSSSNNAOS-QFIPXVFZSA-N 388.515 5.544 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)[C@@H](C#N)c3ccccn3)c2cc1C 505298529 AVLSQLCPMYJGLN-NRFANRHFSA-N 377.447 5.404 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)NCC1CCC(C#N)CC1 508362634 OMZQOCANVINGLH-UHFFFAOYSA-N 392.286 5.017 30 20 GKED N#Cc1ccc(/C=C\c2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)nc1 510316674 UQZAKGIKUVRVGT-DAXSKMNVSA-N 394.261 5.683 30 20 GKED N#Cc1ccc(CC(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)cc1 511858411 HCPGQCIKWZGCPS-UHFFFAOYSA-N 386.417 5.091 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@H]1c1ccccc1 515932439 MWTULTXPHXERKO-XLIONFOSSA-N 379.529 5.697 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCC1 517532127 KVXJMPDZFKAWPI-IERDGZPVSA-N 379.529 5.744 30 20 GKED COc1ccc(C2(NC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)CC2)cc1 517595819 ITJVMUZRMXBITO-UHFFFAOYSA-N 399.450 5.170 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCSc1ccc(Cl)cc1 518240082 SNNJTTNUPYVTTM-AWEZNQCLSA-N 390.961 5.855 30 20 GKED CCN(CC#N)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 520112953 JITCZYSHWXAXMH-UHFFFAOYSA-N 379.312 5.271 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)n1 532535529 YXJLZIWWEDGRMQ-XMMPIXPASA-N 397.478 5.226 30 20 GKED COc1ccc(CNc2ccc(SC)c(Cl)c2)cc1OCCCC#N 532727837 HZJVDLOFQMPWSS-UHFFFAOYSA-N 376.909 5.365 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(-c2nc(C)no2)ccc1C)c1ccccc1 532943029 YFKWOJOOVXHZGY-IBGZPJMESA-N 376.460 5.182 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CCOCC1 535126084 UYPJKDMXKAHRRU-AWEZNQCLSA-N 384.863 5.005 30 20 GKED N#Cc1ccccc1OC1CCC(N[C@@H](C[C@H]2CCOC2)c2ccccc2)CC1 537977432 HNFFIMNQMMSSHO-RFRZSCIPSA-N 390.527 5.006 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4nc5cc(F)ccc5[nH]4)cc3)cc2)CC1 539722445 NALYUTUFSYPSBS-UHFFFAOYSA-N 396.425 5.176 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CC1CCC(C(F)(F)F)CC1 541200733 VMNBYWHASFZMPT-UHFFFAOYSA-N 390.405 5.443 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccccc2)c2ccc(F)cn2)cc1 544379964 TXECIAPELBCJNR-SANMLTNESA-N 393.465 5.639 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccccc1C(C)(C)C#N 544477592 BLLIXWDGDJQOJM-HNNXBMFYSA-N 393.531 5.910 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N(C)[C@@H](C)c1cccs1 554925025 PGORGZAHIARMQU-GJZGRUSLSA-N 386.496 5.002 30 20 GKED C=CCC(F)(F)c1nc(-c2ccc(-c3csc(-c4ccncc4)n3)cc2)no1 559993355 QOECVTDDVHTBPH-UHFFFAOYSA-N 396.422 5.590 30 20 GKED Fc1cc(-c2ccncc2)ccc1CN1CCC(C(F)(F)F)(C(F)(F)F)C1 560555166 QFPBDZAWPAUZDF-UHFFFAOYSA-N 392.318 5.204 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2cccc(F)c2)C1 563719538 TUDGQNPTRIHZQI-RDJZCZTQSA-N 383.492 5.099 30 20 GKED N#CC(CCOc1ccc(-c2nnco2)cc1)(c1ccccc1)c1ccccc1 564362076 FFPRCLBAWYTUHL-UHFFFAOYSA-N 381.435 5.015 30 20 GKED N#CC[C@H](Cc1nc(Cc2csc(-c3ccccc3)n2)no1)c1ccccc1 565740885 UPOOTKOCEKOBQK-GOSISDBHSA-N 386.480 5.024 30 20 GKED N#Cc1c(F)cccc1SCC(=O)Nc1c(Cl)cc(Cl)cc1Cl 569668796 BSVDCGONKOACCE-UHFFFAOYSA-N 389.666 5.388 30 20 GKED N#Cc1cccc(C2(NCc3ccc(Br)cc3C(F)(F)F)CC2)c1 570300021 QHZRBHBYTDPNCY-UHFFFAOYSA-N 395.222 5.118 30 20 GKED Cc1csc(NC(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)c1C#N 573839598 DPDYRDYWOKMZLA-UHFFFAOYSA-N 397.503 5.633 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(F)c3ccccc23)cc1OCCCC#N 581906471 AAWWEELPPFQKEV-QGZVFWFLSA-N 392.474 5.521 30 20 GKED C=C(C)COc1cccc(NC(=O)c2occc2CSc2ccccc2)c1 589382669 WUGASPVJDIGKJC-UHFFFAOYSA-N 379.481 5.779 30 20 GKED N#Cc1cccc(C2(NCc3ccc(Cl)c(C(F)(F)F)c3)CCOCC2)c1 594984654 PSXUHHKNALGMLV-UHFFFAOYSA-N 394.824 5.026 30 20 GKED N#CC1(CC(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CCOCC1 597059630 OKQXBEWANTVPQY-UHFFFAOYSA-N 386.904 5.140 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@@H]1c1ccccc1 601184773 OCFDXJVEWXVZAH-HSZRJFAPSA-N 381.479 5.096 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)C1CCCC1 608918162 GQBNJSZQIPNOHS-HSZRJFAPSA-N 375.516 5.410 30 20 GKED Cn1c(S[C@H](C#N)C2CCCCC2)nc2scc(-c3ccccc3)c2c1=O 609648716 SKJFSGGNPNGWNV-QGZVFWFLSA-N 395.553 5.227 30 20 GKED C[C@@H](c1ccccc1)N1CCC(Nc2c(C#N)cnc3c(F)cc(F)cc23)CC1 609704140 BPXKTMZFPHOLRD-HNNXBMFYSA-N 392.453 5.022 30 20 GKED N#Cc1ccc(SCC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)cc1 609757530 IFLFAWPFCSFDIH-FQEVSTJZSA-N 384.932 5.448 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](Cc1ccccc1)C1CC1 609929640 IAARPCDVNKSYOO-OXJNMPFZSA-N 379.529 5.081 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 610019399 NWQPRGYUYURUTE-MISYRCLQSA-N 393.556 5.471 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccco2)s1)c1cccc(C(F)(F)F)c1 610806614 OMVSEDQUENRDAG-CYBMUJFWSA-N 376.359 5.022 30 20 GKED C=CCn1c(S[C@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccccc1OC 619863998 YNGFLTCGXFFYSH-GOSISDBHSA-N 396.903 5.150 30 20 GKED CN(C(=O)CCC(C)(F)F)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 679994332 SPHBUAMOQIIYIT-GFCCVEGCSA-N 377.275 5.203 30 20 GKED C#CC[C@@H](OC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccccn1 727775766 ORYHIKCEIVKDJU-CMQXMCPJSA-N 377.440 5.270 30 20 GKED CCn1nc(C)c(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1C 727974422 KMBRRNUYKKQPNW-KTKRTIGZSA-N 381.457 5.053 30 20 GKED CCCCO[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 729071138 XKQFCUBRJJYACJ-RISCZKNCSA-N 397.327 5.498 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417807 SUDNNVKRJMNZRO-BXUZGUMPSA-N 388.851 5.041 30 20 GKED CCN(CC)c1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 731114248 LMWRBIACKTVWQD-KRWDZBQOSA-N 396.560 5.106 30 20 GKED N#C[C@H](NC(=O)c1cc2c(F)cccc2s1)c1ccc(Cl)c(Cl)c1 731643595 IVAGAQUFXQFVJG-AWEZNQCLSA-N 379.243 5.342 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2csc(-c3ccc(C)cc3)n2)c1 733800879 LQEVEJVEMDHIDC-FQEVSTJZSA-N 377.513 5.089 30 20 GKED O=C1/C(=C\c2cccc(F)c2)CC(O)(C(F)(F)F)C/C1=C/c1cccc(F)c1 735792241 AOILMMNYZGEMBL-DUGOVBPYSA-N 394.339 5.088 30 20 GKED Cc1nc(CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)cs1 741969858 OPDIZWUMJGSFGT-UHFFFAOYSA-N 395.915 5.143 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 744462906 SACGSXZWAVDEFA-CYFREDJKSA-N 384.479 5.386 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1)c1ccccc1 746326760 UMJARNWLHPGLSV-XPWALMASSA-N 396.506 5.131 30 20 GKED Cc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)ccc1Br 746394353 PRHUOBUWODGLHA-HYXAFXHYSA-N 381.682 5.016 30 20 GKED O=C(COc1ccc(F)cc1)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746438563 WWEJZQKOPAWWPW-HNNXBMFYSA-N 396.258 5.070 30 20 GKED CC(C)[C@@H](C#N)OC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 750649438 ZLWBGCCGGQVVIL-QGZVFWFLSA-N 382.510 5.294 30 20 GKED C#CC[C@@H](NC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccccc1 757894146 GHWHHCVWKBQPDM-JOCHJYFZSA-N 389.499 5.092 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)Nc2cccc(OCC#N)c2)cc1 763926456 QHGGUOMIKRIACZ-QFIPXVFZSA-N 377.488 5.471 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2CCC[C@H]2c2ccsc2)c1=S 764889961 RAQFJYUTQQRTAM-IBGZPJMESA-N 396.585 5.432 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cccc2ccsc12 767961700 ZCNYBFUVUQDHPT-OAHLLOKOSA-N 389.263 5.169 30 20 GKED Cc1ccc(C2=CCN(Cc3cn(CCC#N)nc3-c3ccccc3)CC2)cc1 768214779 POBRGVSGBIVJMR-UHFFFAOYSA-N 382.511 5.062 30 20 GKED C[C@@H](CCN[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776163210 QIEZEJAAMARHOH-HOTGVXAUSA-N 376.422 5.452 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2cc(N3CCOC3=O)ccc2C)cc1 777708978 XQCFKWATCINVAB-INIZCTEOSA-N 386.879 5.256 30 20 GKED CCCCCCN(C)CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 778607833 SHWKPZLSKCYOAA-CQSZACIVSA-N 397.466 5.003 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C 780678042 KFLWKDJTGKTTIQ-BFUOFWGJSA-N 387.430 5.165 30 20 GKED C[C@H](NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1F 781421173 FNQDMFJTLDUNNE-CVEARBPZSA-N 397.494 5.134 30 20 GKED CN(C)Cc1cnc(/C=C\C(=O)c2ccc(-c3ccc(Cl)cc3)s2)s1 794698135 MSEXYCVQOMRIRY-YFHOEESVSA-N 388.945 5.483 30 20 GKED Cc1cc(C(=O)/C=C/c2csc(-c3ccccn3)n2)sc1Br 794733825 UCHJOKGSQLOTCE-AATRIKPKSA-N 391.315 5.234 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 806366707 DCUZLQPFGJVVNZ-UHFFFAOYSA-N 393.487 5.009 30 20 GKED CCCCCCN(C(=O)c1ncc(C#N)cc1C)c1nc2ccccc2s1 839213300 BEQKDZYXYKJJQY-UHFFFAOYSA-N 378.501 5.099 30 20 GKED CC(C)(c1ccc(C(=O)[C@H](C#N)C(=O)C2(c3ccccc3)CC2)cc1)C(F)(F)F 845845134 MNXKNRBBZKKHLK-SFHVURJKSA-N 399.412 5.150 30 20 GKED C=CCN(C(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1)C(C)(C)C 857651369 ZMPHKNAKAJTMLE-UHFFFAOYSA-N 375.472 5.139 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 861393976 FRQFLWWDQWMXGJ-UHFFFAOYSA-N 393.487 5.009 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)c2c1 916164328 WZJFVSACEWWGBU-UHFFFAOYSA-N 399.406 5.061 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2csc3ccccc23)cc1 916955924 VTNVLZPDGKAUCA-KBXCAEBGSA-N 376.481 5.376 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(Cl)cc3)n2)cc1 916975303 XICRBHAHNVOCIH-SFHVURJKSA-N 380.900 5.581 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1 919864750 WWLZTVUHBOPWPI-NTMALXAHSA-N 391.858 5.199 30 20 GKED CCCCc1nc(CON=C(C)c2nc3ccccc3n2C(F)F)cs1 920400936 YPOOSYUQKCBRCM-UHFFFAOYSA-N 378.448 5.171 30 20 GKED N#CCCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CC(F)(F)F)C2)c1ccccc1 922602793 NJDUSCMVFKVEBX-GBESFXJTSA-N 393.453 5.327 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(OCc2cccc(C)c2)cc1 1776086926 XDGXPLFQWQZHKY-UHFFFAOYSA-N 388.467 5.417 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776470813 JEGHYIGTGVGWFX-CFRMROPGSA-N 396.439 5.302 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)C3=CCCS3)cc2)CCC1 1786411985 QHBCISLOWFYFHJ-UHFFFAOYSA-N 398.572 5.134 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)C34CC(F)(C3)C4)cc2)CCC1 1786423154 QMTGUMMNHPTWDM-UHFFFAOYSA-N 398.522 5.005 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H]3CC=C(C)CC3)cc2)CCC1 1789115121 UDVYKQVYDQRWRY-MOPGFXCFSA-N 380.532 5.079 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2ccccc2C(C)C)nc2ccccc21 27070149 DPTVZMUIILKPTJ-INIZCTEOSA-N 379.529 5.465 30 20 GKED COc1ccc(/C(O)=N/c2nnc(-c3ccco3)s2)cc1-c1ccccc1 50295284 UVGDXFZBFHXZPA-UHFFFAOYSA-N 377.425 5.110 30 20 GKED C[C@H]1CCN(C(=O)c2cccc(C#N)c2)c2cc(C(F)(F)F)ccc2S1 60774223 KOLPRDSLOWKOHI-LBPRGKRZSA-N 376.403 5.108 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 69572798 LNWAHJXGOCCCAS-HNAYVOBHSA-N 393.874 5.813 30 20 GKED CCOc1ccc(C2=CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2)cc1 91950940 DEHKRIWMADIHGC-UHFFFAOYSA-N 389.499 5.208 30 20 GKED CSc1ccc(NC(=O)[C@@H](C)Nc2ccccc2SC[C@H](C)C#N)cc1 108407609 UZGASDVSYQLYLX-HUUCEWRRSA-N 385.558 5.099 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)(F)F 115769744 UZKJDALQNDJVBM-GUYCJALGSA-N 393.434 5.506 30 20 GKED COc1ccc(C[C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1OC 118443302 MRRLKXSPPYVUGK-FDDCHVKYSA-N 386.495 5.210 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(C(C)(C)C)s1 121541499 NARUDLKQENFSMU-INIZCTEOSA-N 382.529 5.132 30 20 GKED C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N(C)Cc1cccc(C#N)c1 122606724 MSRMWUNOKWRSMY-LBPRGKRZSA-N 387.270 5.108 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)c2)n1 123844856 FMBMMTQRTLTTHK-HNNXBMFYSA-N 387.386 5.022 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 129338355 MOENIGFEMLSPTM-CQSZACIVSA-N 392.446 5.828 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(SC(C)C)cc1 147619469 NFZBWOTXRDMYCN-GOSISDBHSA-N 376.481 5.182 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3sccc3C#N)s2)cc1 154764376 WQPDDKJLUGVKSQ-CQSZACIVSA-N 381.526 5.193 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(Oc2ncccn2)cc1C)c1ccccc1 155422069 DNVVQYXDFYBOEK-NRFANRHFSA-N 388.471 5.406 30 20 GKED Cc1cc(C(=O)Nc2nn(C(C)C)cc2C#N)sc1-c1cccc(Cl)c1 161057352 IDKSRCXMJDENNP-UHFFFAOYSA-N 384.892 5.278 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2csc(-c3ccccn3)n2)cc1 180335663 YNRACULXTHDWBO-UHFFFAOYSA-N 382.492 5.034 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(SC)c(F)c2)ccc1OC 180813734 SIWCALJZPMOFTO-RHSMWYFYSA-N 388.508 5.088 30 20 GKED C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 183871102 RQVJMBISXBMLDD-BUYIWHAFSA-N 381.457 5.031 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1CCC[C@@H](C)C1 303134611 CQYODKSKLFHLCW-OXQOHEQNSA-N 377.488 5.146 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1 303727751 TYMXIJYPUPDBHW-SFHVURJKSA-N 385.467 5.362 30 20 GKED CC(C)c1ccccc1N=C(O)[C@@H](C)N1CCC[C@@H](c2ncc3n2CCCC3)C1 328665574 ZGLGXCYQBBIAFV-RTBURBONSA-N 394.563 5.199 30 20 GKED OC1=NCCC[C@H]1/N=C(/O)CC1(Cc2nc3ccccc3s2)CCCCC1 329343987 CJATWYJLRXTXDX-MRXNPFEDSA-N 385.533 5.255 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)c(Cl)c1 430359020 MCLOHRSTCIQHQZ-UHFFFAOYSA-N 394.308 5.231 30 20 GKED CN(CCC1CC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 437765388 RBUMHYMWLFAIID-UHFFFAOYSA-N 383.879 5.054 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438842673 QGALQABMTYDKRR-AUUYWEPGSA-N 390.314 5.741 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@]12CCCc1ccccc12 439232519 KKNOPCIGWBPLMA-ICPLQIHGSA-N 376.525 5.314 30 20 GKED Cc1ccc(NC(=O)NCC2CCC(C#N)CC2)c(OCc2ccccc2)c1 440933955 RSOLNDYQMZSWRN-UHFFFAOYSA-N 377.488 5.026 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C3(C(F)(F)F)CCC3)c2)cc1 448728212 DMMGJWOIRQMTAX-UHFFFAOYSA-N 388.389 5.003 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)[C@]1(C#N)C[C@H]1C 450004781 SQRAHHWYRNVWOU-CMJOXMDJSA-N 390.462 5.220 30 20 GKED COc1ccc([C@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)C(C)C)cc1 457536493 ZMWVJLKWJOYTFD-FGZHOGPDSA-N 379.504 5.127 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)N[C@@H](C#N)c3ccc(C(C)(C)C)cc3)cc12 463760248 NPKGPERADNJFEP-KRWDZBQOSA-N 394.544 5.050 30 20 GKED CCCN(C(=O)Nc1ncccc1OCCCC#N)[C@H](CC)c1ccccc1 466594077 WVVWFBGEJAICGN-LJQANCHMSA-N 380.492 5.159 30 20 GKED Cc1ccc(C)c2c1CCC[C@@H]2Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469147539 WYPGZDSAAVRDPI-QFIPXVFZSA-N 387.527 5.376 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccccc2)ns1 469290111 UURXUGIMCILHNS-AWEZNQCLSA-N 379.510 5.314 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@H](C#N)Cc1ccc(C#N)cc1 470849053 PLVPEAHEMNMLJH-FQEVSTJZSA-N 397.503 5.339 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NCc1nnc(-c2cccc(C#N)c2)o1 471611451 KGFUZWWPJXRESM-UHFFFAOYSA-N 398.491 5.680 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)[C@H](Oc1ccccc1C#N)C(C)C 474768699 SBNLAIJMPPLFLM-JOCHJYFZSA-N 394.515 5.224 30 20 GKED C[C@@H](NC(=O)c1occc1COc1cccc(C#N)c1)c1c(F)cccc1Cl 477257569 GQQWGNDBPCZMKW-CYBMUJFWSA-N 398.821 5.014 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@H]1c1ccccc1 480553646 LDPJCOUIGHKNNK-UZUQRXQVSA-N 383.451 5.575 30 20 GKED CC[C@@H](C)C(=O)Nc1cccc(CN[C@H]2CCCCc3cc(C#N)ccc32)c1 481663616 BUTILYYPBQVJDT-HXOBKFHXSA-N 375.516 5.100 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F 482230437 XLPLHUPNINKXOI-UZLBHIALSA-N 386.417 5.324 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2ccccc2F)s1 484509118 YZFCQDPFJUEHED-JTQLQIEISA-N 375.881 5.723 30 20 GKED CC(C)(C#N)CC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 489912516 QCHFOALLXCKLBS-UHFFFAOYSA-N 391.521 5.547 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccccc1Cl 500744911 PRVJXRTTWCJTIB-UHFFFAOYSA-N 376.843 5.494 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)N(Cc1ccco1)c1ccccc1C#N 501021366 OSMSYVQJFPLALX-GOSISDBHSA-N 388.467 5.277 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 503153570 SFNZMKFFEVYKBQ-DNQXCXABSA-N 392.458 5.641 30 20 GKED CC1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)CC[C@H](C(C)(C)C)C3)CC1 509366887 YDSZWYWMVCXJDF-KRWDZBQOSA-N 389.543 5.152 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 509667200 SRAMEDJVKSNHQS-VIFPVBQESA-N 385.703 5.638 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)cc1)c1ccccc1 510008626 VRQWGJTZHUBXAQ-QGZVFWFLSA-N 399.469 5.541 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H]1CCCC[C@@H]1C 510856624 HLDFEUGRULYLPE-KSFYIVLOSA-N 377.488 5.701 30 20 GKED Cc1cccc(OCCCCC(=O)N(Cc2ccco2)c2ccccc2C#N)c1 512950670 DYAFOVPPEIDYHF-UHFFFAOYSA-N 388.467 5.242 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc1OCCC(C)C 513681489 DDDPIUWRQIWLCA-MRXNPFEDSA-N 394.496 5.220 30 20 GKED C[C@H](NCC(C)(C)CCC#N)c1ccc(Br)cc1Br 517606012 HPAGOMDGXNADMS-NSHDSACASA-N 388.147 5.192 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517656584 KSRAVGDLFMPJMV-QGZVFWFLSA-N 388.442 5.517 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C(=O)NC1CC1)c1ccccc1 518011050 ZGFQRFDSHHFYID-XMMPIXPASA-N 397.478 5.091 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1 518165718 QALDWTMMEJVRMA-IERDGZPVSA-N 379.529 5.520 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 521800165 HISMFFRDGAGPEI-OAHLLOKOSA-N 388.558 5.179 30 20 GKED CC(C)[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 522601679 SFVPRXJTCXZXQV-LJQANCHMSA-N 389.421 5.116 30 20 GKED CC(C)=CCSc1ccccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 525477993 QWGAWQBOFNXDLA-KRWDZBQOSA-N 396.581 6.249 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)CCCCOc1cccc(C#N)c1 534808607 CAQJOJOBTCLHTH-UHFFFAOYSA-N 385.467 5.117 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)c(C#N)s1 536971195 ZJCFXMHWEQORFM-UHFFFAOYSA-N 395.915 5.885 30 20 GKED N#Cc1ccccc1OC1CCC(N[C@H](c2ccccc2)c2ccccn2)CC1 539813662 ZIQFHZHLECOHAM-XUNZJTMSSA-N 383.495 5.022 30 20 GKED N#CCc1ccc(C[S@](=O)Cc2ccc(Oc3ccccc3)c(F)c2)cc1 542189367 KIRQNQIBOVDMHQ-MHZLTWQESA-N 379.456 5.133 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2cccc(C#N)c2F)c1)c1ccccc1 542233688 USSVWKMCSGLGDA-UHFFFAOYSA-N 393.849 5.239 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 551222831 MUWFVUFNLWTZPW-OXQOHEQNSA-N 392.490 6.427 30 20 GKED COc1ccc(-c2cc(C(=O)NC3(c4cccc(C#N)c4)CC3)sc2C)cc1 560841888 MMBAXQZOSOCEAF-UHFFFAOYSA-N 388.492 5.023 30 20 GKED CN(Cc1ccc(F)cc1C#N)[C@H]1CCSc2ccc(Br)cc21 561431212 MYOSKGINSMLQQO-KRWDZBQOSA-N 391.309 5.129 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 568669601 MSXAPADFGZHEOR-XXBNENTESA-N 392.547 5.646 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N1CCC(CCC#N)CC1 576462044 KZSXKHPVJBYXSA-UHFFFAOYSA-N 381.907 5.863 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(Oc3ccc(C)c(C)c3)CC2)c1 589741720 QTRUJAFFBSLTQR-UHFFFAOYSA-N 394.515 5.334 30 20 GKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 596735545 ZZZAGSBGPDOWFB-JXFKEZNVSA-N 393.556 5.924 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CCC3)C1 598407165 HODBFACFINSBFC-YGMDYZATSA-N 397.478 5.080 30 20 GKED C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2C)c(Cl)c1)c1cccc(C#N)c1 600848533 ULHZNAIYPYKWNR-HOTGVXAUSA-N 381.907 5.399 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CCCc1ccccc1)c1ccccc1 603800130 HXXWLJHMEIBQRF-RUZDIDTESA-N 397.522 5.464 30 20 GKED Cc1cc(C)cc(C2(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)CC2)c1 603962065 XQCONXKBCMWAPP-UHFFFAOYSA-N 383.451 5.033 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCCc3cccs3)cc2F)c1 609103817 CEVUSBXBYPZRBT-UHFFFAOYSA-N 394.471 5.299 30 20 GKED CCc1ccc(-c2csc(NC(=O)c3cc4ccccc4n3CC#N)n2)s1 609200601 PCCOTNMWMUUMRK-UHFFFAOYSA-N 392.509 5.165 30 20 GKED CN(C(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccc(C#N)cc1F 609216706 UOIDWBBOCCWPLA-UHFFFAOYSA-N 394.833 5.206 30 20 GKED CCCN(C(=O)Cc1c(C)nc2ccccc2c1C)c1cc(Cl)ccc1C#N 609286172 LUYJZUAWNRZCRM-UHFFFAOYSA-N 391.902 5.362 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3cccs3)c2)cc1 609641068 LCVVSUCZQJOXOS-OAQYLSRUSA-N 388.492 5.176 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3ccc(C#N)cc3)s2)cc1 610050884 OKXPBMFXVPOWBJ-MRXNPFEDSA-N 375.497 5.132 30 20 GKED Cc1ccccc1CC1CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 610632481 BBOXOPFOGRFQOV-KRWDZBQOSA-N 379.529 5.096 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)C1 612367628 RMQLIVFDEFPPRX-QFIPXVFZSA-N 395.572 5.332 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1OC(F)F 619125092 HUIMVTHGOYWGFA-UHFFFAOYSA-N 393.274 5.071 30 20 GKED CC(C)C[C@H](C#N)NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 619530152 AGUJOPAZHSPSST-GFCCVEGCSA-N 394.302 5.440 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1nc(-c2ccco2)c(C)s1 635844351 PXUJTRDAIMYHIN-UHFFFAOYSA-N 380.513 5.745 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)no2)nnc1-c1ccccc1F 673573625 OGHRGWDCNSYJLM-UHFFFAOYSA-N 392.459 5.218 30 20 GKED N#Cc1ccc(CSCC(=O)O[C@H](c2cccc(Cl)c2)C(F)(F)F)cc1 730419597 BRCMMLSWGZYYEB-QGZVFWFLSA-N 399.821 5.292 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1cc2ccccc2o1 730950620 HQCASTGJPUTFSE-JXMROGBWSA-N 388.375 5.199 30 20 GKED C=C1CCN(C(=O)c2oc3ccccc3c2CSc2nc(C)cs2)CC1 731052467 SLVFXCROKPYYFR-UHFFFAOYSA-N 384.526 5.282 30 20 GKED C=CC1CCN(Cn2nc(-c3cccs3)n(Cc3ccccc3)c2=S)CC1 732181559 YTAHUEYDGLZVEC-UHFFFAOYSA-N 396.585 5.046 30 20 GKED CCCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@H](CC)c1ccccc1 733805059 MZLYNWSLOFDADA-JTHBVZDNSA-N 393.531 5.440 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1 734979350 CFCYDZBPIRNPGJ-IZZDOVSWSA-N 386.423 5.296 30 20 GKED Cc1cc(C)cc(-c2nnc(SCc3cc(Cl)ccc3OCC#N)o2)c1 735230377 KDKGUJHUYSPUCI-UHFFFAOYSA-N 385.876 5.202 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)Oc2cc(Cl)cc(Cl)c21 742437671 VUNIFBAOSNDZOX-AUWJEWJLSA-N 375.236 5.128 30 20 GKED C[C@@H](Oc1ccccc1C#N)c1nc(-c2ccc(SC(C)(C)C)nc2)no1 762348331 HOFOHCSNVPSNQX-CYBMUJFWSA-N 380.473 5.034 30 20 GKED COc1ccc(CNc2ccc(SC(C)(C)C)cc2)cc1OCCCC#N 770557937 KMIIZHXSNZLCHN-UHFFFAOYSA-N 384.545 5.880 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C=C3CCSCC3)cc2Cl)c1 771651330 FTEVBTMHSCUDJI-UHFFFAOYSA-N 398.915 5.183 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3cn(C)c4ccccc34)n2)cc1 773983591 ZALWSPUDPSOPTL-APWZRJJASA-N 399.519 5.590 30 20 GKED C=CCC[C@@H](C(=O)OCC(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 778558535 CIHGOZSNKOBFCC-OAQYLSRUSA-N 379.500 5.350 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1csc(Cc2cccc(F)c2)n1 780189614 FLNNUOXGOLYONN-UHFFFAOYSA-N 394.471 5.031 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(OC)c3ccccc23)c2ncc[nH]2)c1 787170309 VRQWSFIXQZMVSO-QNGOZBTKSA-N 384.435 5.004 30 20 GKED COc1ccccc1-c1ncc(/C=C2\Cc3c(ccc(Cl)c3Cl)C2=O)cn1 792885910 XLTBITQBWCQAOE-MDWZMJQESA-N 397.261 5.281 30 20 GKED CC(C)c1noc2ncc(C(=O)Oc3ccc(-c4ccc(C#N)cc4)cc3)cc12 793853880 IZGUYPIWJBZPMP-UHFFFAOYSA-N 383.407 5.104 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 797569604 SZMPINARKUQIAH-DOMZBBRYSA-N 394.462 5.829 30 20 GKED Cc1cc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc(Cl)n1 797601465 RWABOPMNERKUTF-UHFFFAOYSA-N 381.838 5.245 30 20 GKED c1ccc(-c2cc3c(NN=C4CCCC45CCOCC5)ncnc3s2)cc1 799867095 FKMGOVJNBBLPBC-UHFFFAOYSA-N 378.501 5.107 30 20 GKED COCCCn1nccc1/C=C\C(=O)c1ccc(-c2ccccc2Cl)s1 802703939 GFKSIIAHCUFGDE-FPLPWBNLSA-N 386.904 5.198 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2nc(Cl)c(C#N)s2)nc1-c1ccccc1 804512165 NDXYQWXLDJANGK-CQSZACIVSA-N 398.919 5.788 30 20 GKED C[C@@H](N[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 810264257 ZQYMWIRWNLGFQQ-XMSQKQJNSA-N 393.531 5.255 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1cccc(N2CCOC2=O)c1 811689405 CNGOGXKYTLQZBY-OFPSORBISA-N 399.393 5.087 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)ccc1C(C)C 813216086 NEDHDYITDWPVGJ-RDTXWAMCSA-N 390.405 5.176 30 20 GKED Clc1cc(Cl)c(NN=Cc2conc2Cc2ccccc2)nc1Cl 814741101 MBSKCLFHFNAYLB-UHFFFAOYSA-N 381.650 5.067 30 20 GKED C=CCC[C@@H](NCc1ccnc(Br)c1)c1ccc(C(F)(F)F)cc1 815085022 HZCLLBNRGVSDSV-MRXNPFEDSA-N 399.254 5.660 30 20 GKED Cc1ncsc1C(=O)/C=C\c1cccc(/C=C/C(=O)c2scnc2C)c1 915054123 JLHPEOMQIAFLAN-MKKAVFGOSA-N 380.494 5.009 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 915086639 MAVJEUPRGKJSNV-GOSISDBHSA-N 381.262 5.901 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1cc2c(s1)CCCCCC2 916905574 LTAOFPDHKNSWHO-CQSZACIVSA-N 386.904 5.022 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916916552 VUWQSWBAEUVGSX-FOYQMUPJSA-N 396.490 5.498 30 20 GKED Cc1cccc(C)c1OCCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917026709 MSNVPLWZTPVESK-GOSISDBHSA-N 376.481 5.072 30 20 GKED COc1cc(C=NOCc2csc(-c3cccs3)n2)ccc1OC(C)C 920399185 MMMHTSHIGOIZIJ-UHFFFAOYSA-N 388.514 5.218 30 20 GKED CSc1nc(O)c(C(=O)OC2CCCCCCCCCCC2)cc1C#N 1349842218 UXHYWXOXEIXISN-UHFFFAOYSA-N 376.522 5.211 30 20 GKED CC(CCCCCCC(=O)O)=NNc1ccc(-c2ccc(Cl)s2)nn1 1776083068 KNHSRXADKTUMNL-UHFFFAOYSA-N 380.901 5.072 30 20 GKED O=C(O)c1ccc(-c2ccc(C=Nn3c4ccccc4c4ccccc43)cc2)cc1 1776112761 JXOSDOCRWGVQLY-UHFFFAOYSA-N 390.442 6.042 30 20 GKED O=C(O)C(=O)/C(=C/c1cccc(-c2ccccc2)c1)c1ccc2ccccc2n1 1776116472 SUZKVWWPJGTRJL-LTGZKZEYSA-N 379.415 5.096 30 20 GKED CC(C)(C)[C@@H]1C/C(=C/c2cccc(C#N)c2)c2nc3ccccc3c(C(=O)O)c2C1 1776121595 OLCPXTFFBFLKMI-XLXASQRYSA-N 396.490 5.954 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2csc(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269276 ZEZAGMNBHOSFGR-VOTSOKGWSA-N 382.525 5.864 30 20 GKED CCCCCCCCCC[C@H](C)N=c1nc[nH]c2sc(C(=O)O)c(C)c12 1776785178 HAPQNAYKLYFXOM-AWEZNQCLSA-N 377.554 5.451 30 20 GKED CCCn1nc(C)c(Cl)c1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776848224 NIJSAJYODAMALN-HJWRWDBZSA-N 398.846 5.109 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(C)s2)cs1 54897643 CTDRKOUOPFBHIR-YFHOEESVSA-N 382.510 5.402 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc(Cl)ccc2F)cc1 55823784 SHDJCENGLFEGCA-UHFFFAOYSA-N 394.833 5.376 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccccc2)CC1 66954078 TXMWWVXRXDGFHL-QGZVFWFLSA-N 379.529 5.492 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1 105863876 LPSMEMBGSRBVTE-UHFFFAOYSA-N 385.769 5.098 30 20 GKED CO[C@](C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 106985077 LEVXTGXDIQAEFP-UWJYYQICSA-N 396.899 5.202 30 20 GKED Cc1cccnc1[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 115769759 TZZZKLACWYYJIA-QFBILLFUSA-N 382.533 5.303 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1c[nH]c2c(C)cccc12 125008013 WWIQVJAKJALXER-UHFFFAOYSA-N 396.450 5.025 30 20 GKED C[C@@H](Sc1cc(C#N)ccn1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 127202613 DOFBVMZNZFSTKT-SECBINFHSA-N 377.256 5.163 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)CC(F)F 130081326 DCWXVXBIYPGUHX-HNNXBMFYSA-N 389.471 5.380 30 20 GKED C[C@@H](Sc1ccccn1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 134978823 WGJMNODIGDFRTK-DOMZBBRYSA-N 399.928 5.216 30 20 GKED N#C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(Cl)c1Cl 157976120 UGWPHQUKCPUTMM-CYBMUJFWSA-N 391.151 5.146 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 173553386 HECGRNLHJXCBMA-UTKZUKDTSA-N 380.488 5.009 30 20 GKED C[C@H](c1cccnc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174495392 MQBKCCFMDXAQDW-OAHLLOKOSA-N 390.418 5.110 30 20 GKED CC[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nccs1 175730510 ZEZSIMOPBRSPTQ-QGZVFWFLSA-N 379.510 5.047 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)[C@H]2C[C@@H]2C)cc1 189875846 BCBRONCPGVDKBV-KKSFZXQISA-N 376.500 5.385 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2c(F)cccc2F)cc1C 189885043 IVASGWSFBMHFII-UHFFFAOYSA-N 395.453 5.563 30 20 GKED CSc1cccc(C)c1N/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329928163 MFBBAYWCMAYZHK-KRWDZBQOSA-N 384.549 5.432 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1cccc(CSCc2ccccc2)c1 428891054 WSQGCUDHCVYHLX-UHFFFAOYSA-N 379.529 5.278 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)c1 429876653 LDQXWLAERMKWCX-UHFFFAOYSA-N 395.871 5.395 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@@]12CCCc1ccccc12 439232510 KKNOPCIGWBPLMA-BVZALQNUSA-N 376.525 5.314 30 20 GKED CCCN(Cc1nnc(-c2cccc(C#N)c2)o1)[C@H](C)c1cc2ccccc2o1 441217615 OCAPXVOKPLCSIA-MRXNPFEDSA-N 386.455 5.328 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccc3c(c2)COC3)c1 460336032 SMTNFDYTKHJUNG-UHFFFAOYSA-N 388.854 5.089 30 20 GKED C[C@H](C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12)c1cccc(C#N)c1 461775585 LGIRTHWCNLPXRB-XCHHMKERSA-N 392.502 5.075 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)[C@H](C)c2cccc(C#N)c2)C1 462249986 XEBLJLAPZLLROY-STXHMFSFSA-N 386.417 5.290 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)[C@H](C)c2cccc(C#N)c2)c1 464491311 VHPPSAJFTHMEMJ-QGZVFWFLSA-N 389.886 5.252 30 20 GKED CC(C)[C@H](CC1CCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 470771970 IIZJWHGTMBSEFX-NRFANRHFSA-N 395.547 5.061 30 20 GKED N#CC1(c2ccccc2)CCC(NCC2(CCOCc3ccccc3)CC2)CC1 471608027 BBSAWBGLUZTADZ-UHFFFAOYSA-N 388.555 5.367 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1ccc(C)cc1)c1ccccn1 472468590 GBHFKFGNIGDXRM-DEOSSOPVSA-N 385.511 5.267 30 20 GKED CC(C)(C#N)CCCS(=O)(=O)Cc1ccc(Oc2ccccc2F)c(F)c1 476878757 DQYXCDVZMGXJNS-UHFFFAOYSA-N 393.455 5.002 30 20 GKED N#C[C@@H](C(=O)c1sc(C2CC2)nc1-c1ccccc1)c1cnc2ccccc2n1 483217774 XUYJZFLHJJZNEW-MRXNPFEDSA-N 396.475 5.121 30 20 GKED N#Cc1ccc(NCc2nnc(-c3ccc(Cl)cc3Cl)o2)c(Cl)c1 486575619 OYGIYYDUTJCPPA-UHFFFAOYSA-N 379.634 5.181 30 20 GKED N#CCCC[C@H](NC(=O)CSc1cccc(C(F)(F)F)c1)c1ccccc1 487515135 ODFVBWFTBSKHRG-SFHVURJKSA-N 392.446 5.349 30 20 GKED CC(C)[C@@H](Sc1ccc(C#N)cc1)C(=O)Nc1ccccc1C(F)(F)F 488837036 YMCHGWXGWFBBRX-QGZVFWFLSA-N 378.419 5.332 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(-c3nc4cccc(Cl)c4s3)cc2)c[nH]1 489565292 LMZRWUGQIQLHBT-UHFFFAOYSA-N 378.844 5.069 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCc4cccc(F)c4C3)c2)cc1 503479620 OCVQBQDCXHGDNX-UHFFFAOYSA-N 387.414 5.080 30 20 GKED N#C[C@H](NC(=O)c1cccc(-c2cscn2)c1)c1ccc(Cl)c(Cl)c1 505961358 XIBKUFSXNJPJRX-INIZCTEOSA-N 388.279 5.112 30 20 GKED N#CC1CCC(CNC(=O)c2cc(Cl)ccc2SC2CCCC2)CC1 508364145 WPAFELPZBZDDAH-UHFFFAOYSA-N 376.953 5.434 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)CC1 508494068 CZJIDMXBXAQGFQ-QHCPKHFHSA-N 383.495 5.264 30 20 GKED CCN(C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1)[C@H](C)c1ccc(C#N)cc1 509577978 FRSVWNOLELRMOM-MRXNPFEDSA-N 386.451 5.244 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)oc2c1ccc1ccccc12 513164542 IMRUBJLXAWYFQD-QGZVFWFLSA-N 394.352 5.798 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nc2ccccc2s1 513687285 PKMBVTZGHORXKN-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED CCN(Cc1cccc(OCCCC#N)c1)Cc1cccc(-c2ccncc2)c1 517203121 LPUUJUVMOPWAMM-UHFFFAOYSA-N 385.511 5.453 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccc(OC(F)F)cc2)c1 518272793 QEFJVSPCZXTBMI-UHFFFAOYSA-N 394.421 5.028 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(C#N)c(Cl)c1)c1ccccc1 518274238 ZZAQCGGPFYLOHF-UHFFFAOYSA-N 375.859 5.100 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Sc1ccccc1Cl 518739006 JTHLHSSZVUHSEN-KBPBESRZSA-N 390.961 5.854 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCc1cccc2ccccc12 521261503 RRWUEZDYDRDWFT-KRWDZBQOSA-N 389.524 5.456 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(CSc2ccccn2)c1 523380436 BADUBLVWWAAJAD-UHFFFAOYSA-N 376.481 5.191 30 20 GKED CS[C@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 523502929 VDJDDDYUIYMYQD-QFIPXVFZSA-N 388.492 5.180 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)Nc1ccc(CC#N)cc1 524594015 BCIIRDSVVYMGJJ-IBGZPJMESA-N 385.895 5.324 30 20 GKED N#Cc1ccc(-c2nnc(CSCc3c(Cl)cccc3Cl)o2)cc1 525630183 BOQXVOBZNWCDPK-UHFFFAOYSA-N 376.268 5.348 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1F 534174265 LGIMBAOXPZVFDW-PBHICJAKSA-N 389.833 5.230 30 20 GKED Cc1sc([C@H](C)NC(=O)c2ccc(CC#N)cc2)nc1-c1ccc(Cl)cc1 534725435 IEGWHRYLMGPEJO-ZDUSSCGKSA-N 395.915 5.329 30 20 GKED C=CCC[C@@H](NCc1noc(-c2ccccc2)n1)c1ccc(C(F)(F)F)cc1 537130244 BTMOURGRVRHFDQ-GOSISDBHSA-N 387.405 5.553 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CCCC(F)(F)F)cc1 537741014 XZNKROVPTSNFIB-UHFFFAOYSA-N 378.350 5.030 30 20 GKED Cn1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1-c1ccccc1 538239821 FMHQPMSISSGINM-UHFFFAOYSA-N 394.434 5.003 30 20 GKED C[C@H](N[C@@H]1c2cc(Br)ccc2SC[C@@H]1C)c1ccc(C#N)cc1 538394358 XRVKVUKVRMJRNI-JMERFSKESA-N 387.346 5.454 30 20 GKED C=CCn1c(SCc2ncc(Cl)cc2Cl)nnc1-c1ccccc1C 540731916 MBUFTOHJFISOCD-UHFFFAOYSA-N 391.327 5.434 30 20 GKED N#CCCN(C(=O)CCc1ccc(-c2ccccc2F)o1)c1ccc(F)cc1 553944606 PKEWHTHVASMFQP-UHFFFAOYSA-N 380.394 5.104 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(F)cc1C(F)(F)F 554431552 JVYSTRUWYWJDID-UHFFFAOYSA-N 398.404 5.232 30 20 GKED CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555007829 UAMXYJUNRSLFAR-IERDGZPVSA-N 378.476 5.178 30 20 GKED Cc1ccccc1N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 557554302 SKWHFVSXUCCREU-GOSISDBHSA-N 381.545 5.243 30 20 GKED COc1ccc2oc([C@H](C)NCc3ccc(Br)cc3C#N)c(C)c2c1 561884841 BMHSLECGPHUECN-ZDUSSCGKSA-N 399.288 5.235 30 20 GKED COc1ccc([C@@H](CCC#N)NC[C@@H]2CCN(c3cc(Cl)ccc3C)C2)cc1 562593680 VCECIPDUHCBUKE-PGRDOPGGSA-N 397.950 5.118 30 20 GKED C=CCC(C)(C)CN[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 562837272 DTBRKSXTUKVKSY-HXUWFJFHSA-N 391.964 5.025 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)N3CCC(CCC#N)CC3)s2)cc1 563035328 ADPAHQXZYKLMLY-QGZVFWFLSA-N 396.560 5.213 30 20 GKED CCCN(C(=O)NCc1ccc(CC#N)cc1)[C@@H](C)c1cc2ccccc2o1 567893839 BFCGTOYYOGNEII-KRWDZBQOSA-N 375.472 5.182 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)Nc1cc(C(C)(C)C)sc1C#N 572400389 FSQHSPALZKUPPV-CQSZACIVSA-N 377.513 5.283 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC2(CCC2)[C@@H]1C1CC1 576952154 SHIVAACPXYYNHT-QFIPXVFZSA-N 387.483 5.455 30 20 GKED CC(C)=C[C@H]1[C@H](C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)C1(C)C 603738430 BRTLORHPGQLTCT-AZUAARDMSA-N 375.472 5.231 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(Oc4ccccc4)nc3)n2)cc1 603750043 WJEOZWGETROMMQ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccc(Oc4cccnc4)cc3)c2C#N)C1 604433459 FZPBLHFCAKHBDP-CQSZACIVSA-N 389.480 5.184 30 20 GKED Cc1sc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(C#N)c1C 609297641 XURICWNYMLNPFA-UHFFFAOYSA-N 391.427 5.292 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc2ccccc2c1 609398602 CLEIEEVQMCNUOM-MRXNPFEDSA-N 375.497 5.413 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CC[C@H](c3ccco3)C2)c1 609732266 LHBIXCCXFFOROU-INIZCTEOSA-N 392.842 5.227 30 20 GKED CCSc1ccccc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 610313478 CVJFVHVBAQFJHH-UHFFFAOYSA-N 392.455 5.854 30 20 GKED N#CCC[C@@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccccc1 611186796 KCFYMNIMIUCOQC-MRXNPFEDSA-N 397.450 5.523 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3sccc3C(C)C)n2)cc1 619753920 JNMPEMKEIWBCTH-MRXNPFEDSA-N 382.510 5.494 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)C1 661381962 QZPUPNIRWZPNHZ-INIZCTEOSA-N 389.952 5.269 30 20 GKED O=C(Nc1ccc(F)c(F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 664406801 TZCQCVWCIHXSPE-UHFFFAOYSA-N 378.263 5.140 30 20 GKED Fc1ccc(-c2nc(CN3C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C3)cs2)cc1 674458920 FCLGBLXWVMLUPZ-STQMWFEESA-N 398.347 5.122 30 20 GKED Cc1cccc(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1F 678897264 HXOJDMYOXBTCLU-UWVGGRQHSA-N 386.311 5.165 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(COCCc3ccccc3)c2)c1 726482913 OWMNBBWGMXWFPW-UHFFFAOYSA-N 386.520 5.236 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 727233117 GFDNLYJBRXLCOE-DNVCBOLYSA-N 399.466 5.425 30 20 GKED CCCCCCCCCNC(=O)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 731116167 KKSWBDZTKLEZFM-NRFANRHFSA-N 378.532 5.031 30 20 GKED CC(C)(C)OC(=O)NC1CCC(=NNc2nc(-c3ccccc3)cs2)CC1 731925203 SMEDRPXURFSTOK-UHFFFAOYSA-N 386.521 5.045 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CCC#N)c3ccc(F)cc3)c3ccccc3n2)o1 732093464 FYZVEDPTVONJJF-UHFFFAOYSA-N 399.425 5.503 30 20 GKED CC[C@@H](NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 734374049 OZAYXNUGTYETHB-VQTJNVASSA-N 391.565 5.841 30 20 GKED N#CCOc1cccc(NC(=O)[C@@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)c1 735633545 DFDMKOMCCCKYAW-BSRJHKFKSA-N 394.902 5.230 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@H]2c2ccc(C)o2)c1 739023265 LJHGFWFFDLFXTR-CTNGQTDRSA-N 395.503 5.096 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 743199600 IFZURWCATHFBQY-UHFFFAOYSA-N 386.426 5.052 30 20 GKED Cc1ccc(Cl)c(N2C(=O)/C(=C\c3ccc(C#N)o3)SC2=S)c1Cl 743282035 IPMJPKOQMYOBBM-WUXMJOGZSA-N 395.292 5.172 30 20 GKED CC(C)n1ncc2cc(C=NOCc3ccc(C(F)(F)F)cc3)c(Cl)nc21 746575887 JSCDVWRMJCBCGE-UHFFFAOYSA-N 396.800 5.235 30 20 GKED C=CCOc1ccc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3o2)cc1OC 751518069 RJFIDCASYBDQJM-NTEUORMPSA-N 386.791 5.046 30 20 GKED C#CCCCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 757834015 HPQOIXMUTXNPBD-UHFFFAOYSA-N 378.472 5.286 30 20 GKED O=C1/C(=C/c2cncc(Br)c2)CCc2nc(-c3ccccc3)sc21 767362286 RXJOEZZBAIPLPL-RIYZIHGNSA-N 397.297 5.180 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCc3c2sc2ccccc32)c1 772983403 HMEDITOEXGDGRZ-LAUBAEHRSA-N 376.525 5.749 30 20 GKED COC(=O)c1coc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c1 774120252 LBWZPLSUIPKMGJ-ATVHPVEESA-N 389.432 5.099 30 20 GKED C[C@@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(OCC#N)cc1 776171909 QWFKJZOFILXVKL-UZUQRXQVSA-N 391.902 5.272 30 20 GKED Cc1ccc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(Cl)n1 782485262 GESRXQBNOWRGMO-OAHLLOKOSA-N 375.859 5.073 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc(Cl)cc1Br)c1ccccc1 792869390 HYJLZZBOAIWHTI-ZDUSSCGKSA-N 378.653 5.095 30 20 GKED CC(C)(C#N)COC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 797254412 PRDBJRQNSZDUBZ-UHFFFAOYSA-N 397.327 5.487 30 20 GKED C=CC[C@@H](OC(=O)[C@@H]1CCC(=O)c2cccn21)c1ccc(Cl)c(Cl)c1 797555213 VYPDEPPVWVOFTG-FUHWJXTLSA-N 378.255 5.173 30 20 GKED CCCCCCOc1ccc(CN2CCC(C#N)(c3ccccn3)CC2)cc1 800527825 CQQYWMLMLKEZQI-UHFFFAOYSA-N 377.532 5.098 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ncc(C(C)(C)C)o3)n2)cc1 805855254 JAZGLPNHTORZBS-MRXNPFEDSA-N 393.512 5.213 30 20 GKED C=CCC[C@@H](NCc1ncc(C2OCCO2)s1)c1ccc(C(F)(F)F)cc1 809627834 HUPMRSWKWDRMEV-OAHLLOKOSA-N 398.450 5.004 30 20 GKED COc1cccc2c1[C@H](C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 814305930 RHZFHWYMSXEWMR-YADHBBJMSA-N 382.463 5.019 30 20 GKED N#C[C@H]1CCC[C@@H](OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)C1 839048262 CMYATEBYFSBJTD-SMDDNHRTSA-N 380.391 5.068 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842941548 QRNGEXXHIXTGEG-ZHZWZMEUSA-N 376.403 5.319 30 20 GKED CC(=NO[C@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1)c1cc2ccccc2o1 852017601 DZFUUOXWSAOQFK-UKRRQHHQSA-N 384.863 5.093 30 20 GKED CC(C)Oc1ccccc1C=NOCC(=O)Nc1ccccc1-c1ccccc1 852284894 WHTIFFGJAMNXJD-UHFFFAOYSA-N 388.467 5.130 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@@](C#N)(c2ccccn2)C1 852332822 WAABGEHPCGDZQA-AOMKIAJQSA-N 392.890 5.008 30 20 GKED O=C(O[C@@H](c1ccccn1)C(F)(F)F)c1ccc(C(F)(F)C(F)(F)F)cc1 857599827 GZUFZAGAUYDLNY-LBPRGKRZSA-N 399.237 5.196 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccc(OCc3ccccc3)cc2)no1)c1ccccc1 904423488 LUSDRAHLDYDPJE-QFIPXVFZSA-N 395.462 5.556 30 20 GKED COc1cc(C=NNCc2cccc3cccnc23)c(-c2ccccc2)cc1OC 915963413 VZXDIAPETYIFBD-UHFFFAOYSA-N 397.478 5.043 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=S)Nc1cccc(COc2ccc(CC#N)cc2)c1 916026317 XERBEZQJVLJOOV-VGSWGCGISA-N 393.556 5.197 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3ccccc3s2)cc1 916955127 MTRGWQHQBZKYLZ-RDTXWAMCSA-N 376.481 5.376 30 20 GKED O=C(/C=C/c1cc(-c2ccccc2)cs1)c1ccc(N2CCOCC2)cc1 917516544 XLOQAMMCYPXUEE-ZHACJKMWSA-N 375.493 5.148 30 20 GKED Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919904646 QTMFNXJADCDSIM-RPWUZVMVSA-N 381.479 5.460 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1 920066025 QJWIXKGSMIYNFR-FPLPWBNLSA-N 397.525 5.298 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)COc2c1ccc(Cl)c2Cl 920066494 QWZNOUIBBSJOMS-JXMROGBWSA-N 389.263 5.171 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2c2ccc(Cl)c(Cl)c2)ccc1Cl 1776033716 WLCFPRIIVXAMPT-LBPRGKRZSA-N 397.689 6.081 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2ccc(OCCC(=O)O)cc2)cc1 1776125689 QDVRDXLRAPFTJO-AUWJEWJLSA-N 382.456 5.005 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)cc1OCCC 1776125809 SYFKMMXSARZXND-FNIWZSMSSA-N 394.467 5.258 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)cc1)c1ccccc1 1776469406 JMGTXIVGKWBLNA-QIPHDZALSA-N 386.447 5.350 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(F)ccc1N(C)CCCCC 1776782927 NPZPLRZGJPYSJC-NRFANRHFSA-N 394.575 5.746 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC(F)F)c(Cl)c1 1776783929 LYHMVNPGOHKWLV-CQSZACIVSA-N 377.859 5.235 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1777533311 MZCZIZKXCBHZNG-ZRDIBKRKSA-N 398.418 5.035 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(-c3cccs3)o2)nnc1-c1ccccc1 6845538 GMUWRARYDFXMJM-CYBMUJFWSA-N 395.513 5.096 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 21372669 CIOQSLGOCVUTLO-SFHVURJKSA-N 398.506 5.756 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2c(C)cccc2C)cc1 27081095 YXDOUGRKWWOMSO-UHFFFAOYSA-O 395.573 5.320 30 20 GKED N#C[C@@H](C(=O)c1cccc(OCc2cccs2)c1)c1ccc2ccccc2n1 48857998 GBAGDGBEHWGKSG-HXUWFJFHSA-N 384.460 5.365 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2ccc(Cl)c(C#N)c2)cs1 58550567 KQUPVPORXNFPLB-UHFFFAOYSA-N 399.928 5.521 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)c(C)c2)[n+]2ccccc2)cc1 58783163 JZTHOWNDTBRKEX-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4ccccc4c3)n2)cc1 66545429 WXFAXRYZQNRPBA-HXUWFJFHSA-N 379.444 5.325 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 66956278 UBEANTZHFSPFAP-HZPDHXFCSA-N 393.512 6.052 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)[C@@H](C#N)c3ccccn3)o2)cc1 69952355 NDXMRNTYIXKCGA-FQEVSTJZSA-N 379.419 5.202 30 20 GKED Cc1ncc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 98118711 HEWDAZYXGUWJDX-GOSISDBHSA-N 396.903 5.082 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)sc2cccc(F)c12 114619526 XHWXSZBAZNFTJK-CYBMUJFWSA-N 393.468 5.357 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3nc(C4CC4)cs3)cc2)c1 125407535 HGVITXYUHQEWDQ-UHFFFAOYSA-N 390.468 5.006 30 20 GKED CC[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nccs1 153717312 YNTHYOIZBVBFLC-SFHVURJKSA-N 378.457 5.080 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)CCCCOc2cccc(C#N)c2)o1 154225549 CVMVHJIRFPDVNR-OAQYLSRUSA-N 380.488 5.153 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3cccc(OCCCC#N)c3)c2)cs1 173637018 PTFXFMVNOOVAMA-UHFFFAOYSA-N 377.469 5.053 30 20 GKED CC(C)[C@@H](Sc1ccccc1C#N)C(=O)Nc1ccccc1C(F)(F)F 173708036 HIKIZMBENXEGES-QGZVFWFLSA-N 378.419 5.332 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(SC(=O)N(C)C)c1 176880958 XGKBZGOASNADSG-HNNXBMFYSA-N 385.558 5.467 30 20 GKED COc1cc([C@H](C)Nc2cccc(OCCCC#N)c2)ccc1OC(F)F 179821467 NTYPPTHYUHLUOG-AWEZNQCLSA-N 376.403 5.152 30 20 GKED N#CCOc1ccc(CN[C@H]2CCCc3nc(-c4ccccc4F)sc32)cc1 180551579 YGKHEQBQIVJDBR-IBGZPJMESA-N 393.487 5.019 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 193382133 GZCBDIJIBMFLBI-NSHDSACASA-N 395.793 5.162 30 20 GKED O=C(/C=C\c1ccc(O)c(Cl)c1)c1ccc(OC(F)F)cc1OC(F)F 209348361 JHDQUJVVXXJOAW-KTAJNNJTSA-N 390.716 5.145 30 20 GKED O/C(=N/Cc1ccc(C/N=C(/O)[C@H]2CCCCS2)cc1)[C@@H]1CCCCS1 329344187 UESWUTYHIHGXFM-HDICACEKSA-N 392.590 5.171 30 20 GKED CCC/C(O)=N/C[C@H]1CCCN(C(O)=Nc2ncc(C3CCCCC3)s2)C1 329460104 PCOKQQMYPFPWGP-OAHLLOKOSA-N 392.569 5.205 30 20 GKED OC(=Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)[C@H]1CCCSC1 329574275 AOIAQLCZAOSDFA-AWEZNQCLSA-N 390.940 5.056 30 20 GKED O/C(=N/[C@@H]1CCCc2c[nH]nc21)C1(c2ccc(Br)cc2)CCCC1 330128245 NKISGTLRGJDENR-MRXNPFEDSA-N 388.309 5.018 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCC(C#N)(c2ccccn2)CC1 374372403 DLINNASXOHQHLG-UHFFFAOYSA-N 390.531 5.247 30 20 GKED N#Cc1cc(NCc2cnc(-c3ccncc3)s2)ccc1Oc1ccccc1 428400440 JJNUAMYQSQITOM-UHFFFAOYSA-N 384.464 5.481 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 431704491 XYFPXIIDHAKUNN-UHFFFAOYSA-N 398.441 5.112 30 20 GKED Cc1cc(F)cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 433306154 PZFBIMWSAVXBJQ-UHFFFAOYSA-N 376.456 5.550 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)Nc1cccc(CC(F)(F)F)c1 437832728 HYPODHDWKRFCJX-UHFFFAOYSA-N 377.366 5.094 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 437919991 XHUSJAYXQKPOOQ-SFHVURJKSA-N 397.522 6.398 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(C(F)(F)F)ccc1F 437946461 ILOOXSDVYYCPKQ-YJBOKZPZSA-N 391.368 5.148 30 20 GKED Cc1c(Br)cccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 438139499 YJZOZBJBCDTMED-APWZRJJASA-N 398.304 5.061 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@H]1c1ccccc1I 444646859 JSEFTMMOGAUIHX-KRWDZBQOSA-N 396.316 5.148 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)c2c(F)cc(C#N)cc2F)cc1 446038932 JDEYQWONGYLTIC-CQSZACIVSA-N 392.405 5.003 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)N(CCC#N)Cc2cccnc2)cc1 448136925 KMCLDNHFLSDHGX-UHFFFAOYSA-N 387.508 5.097 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)N[C@H](CCCC#N)c2ccccc2)o1 458798843 ISIIGYGDWGIFMP-WMQCIHAUSA-N 379.504 5.506 30 20 GKED CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 470095486 BEFUWQPNJWKLJF-GOSISDBHSA-N 387.405 5.105 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 471272600 KRWXLDWBGXNDOH-GOSISDBHSA-N 379.529 5.691 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnc3ccccc3c2C(F)(F)F)n1 474433943 OICCXUGYNUYHEN-GFCCVEGCSA-N 389.402 5.324 30 20 GKED COc1ccc(N(Cc2ccco2)C(=O)c2ccc(C(C)(C)C#N)cc2)cc1F 476094806 DGHFKLPBZCVAHN-UHFFFAOYSA-N 392.430 5.075 30 20 GKED C=CCn1c(SCc2ccc(C#N)c(F)c2)nnc1-c1ccc(Cl)cc1 478521942 MMYKZRYPNMMTKA-UHFFFAOYSA-N 384.867 5.088 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCCOc2c(F)cccc21 480078476 WNZCRIZPMWXTHJ-JOCHJYFZSA-N 386.426 5.008 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 482936033 WSBBBODXLRUUHA-RXVVDRJESA-N 393.487 5.066 30 20 GKED N#C[C@H](C(=O)c1ccccc1Sc1ccccc1)c1cnc2ccccc2n1 483218346 ZFYXHVCBWCVKBO-SFHVURJKSA-N 381.460 5.271 30 20 GKED C=CCN(C(=O)c1oc2ccc(F)cc2c1C)c1nc(-c2ccccc2)cs1 484493094 WPDJABCWXFUECV-UHFFFAOYSA-N 392.455 5.837 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C 484605971 NAIIKEAPISBWPN-FZMZJTMJSA-N 395.343 5.073 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](C)c1ccc2ncsc2c1)c1ccc(F)c(F)c1 486255720 KRBVXXHXRQUASU-HXPMCKFVSA-N 387.455 5.252 30 20 GKED N#Cc1ccc(CN(C(=O)Cc2csc3ccc(Cl)cc23)C2CC2)cc1 501738229 VCMDHXPUEXNZBJ-UHFFFAOYSA-N 380.900 5.160 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCc4cccc(F)c4C3)cc2)cc1 503494743 BFRSISGPKVTASS-UHFFFAOYSA-N 387.414 5.080 30 20 GKED N#CC1(CCCSCc2cc(-c3ccc(Cl)cc3)no2)CCOCC1 507709328 PMKOZCVGZJWCHE-UHFFFAOYSA-N 376.909 5.329 30 20 GKED CCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@@H](C)c1cc2ccccc2o1 508096926 MMCOMJYXKQTYJJ-HNNXBMFYSA-N 378.476 5.476 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 510059128 XMHRFJSNBLVRFL-OXJNMPFZSA-N 381.907 5.649 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1C(F)(F)F 510767843 SBMVVVSSOOJMDK-ZDUSSCGKSA-N 375.394 5.389 30 20 GKED C=CCOc1cccc(NC(=O)N2CC=C(c3c[nH]c4cc(C)ccc34)CC2)c1 511018113 RJGNNZRVUIZFCH-UHFFFAOYSA-N 387.483 5.362 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 513652600 AZVZDROZPWUSHK-GOSISDBHSA-N 383.476 5.554 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518140224 UEXWPPRKMSAAHH-DZGCQCFKSA-N 388.920 5.306 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 518174479 BSKMWSYXJHCJRU-OAHLLOKOSA-N 386.929 5.693 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccc(F)cc1 519799873 ILWSMWPUCFYCCS-ZWKOTPCHSA-N 377.246 5.183 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1N1CCCCC1 521817034 NCXCRPOHWRJEHH-UHFFFAOYSA-N 390.531 5.239 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cccc(C(=O)N(C)CC(C)(C)C)c2)c1 525570097 KOQOFUWYDPVVDV-UHFFFAOYSA-N 394.515 5.012 30 20 GKED FC(F)Oc1ccc(-c2nnc(SCC#Cc3ccccc3Cl)o2)cc1 533468700 BDXUEVXYNZHXQA-UHFFFAOYSA-N 392.814 5.135 30 20 GKED Cc1cccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1Cl 534359041 QTQRYRXSSUOBBM-UHFFFAOYSA-N 376.843 5.351 30 20 GKED COCCOc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1 540314671 UBVXBKXVPQLIJO-LJQANCHMSA-N 386.495 5.101 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 541973617 YUKDCBVEGCODIU-HXUWFJFHSA-N 392.890 5.153 30 20 GKED N#Cc1ccc(CN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)C2CC2)cc1 543224558 CAJOYSLWGAZOOJ-ZWKOTPCHSA-N 385.294 5.160 30 20 GKED C[C@@H](N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543861582 RLDRZWQMAHMZDQ-RTBURBONSA-N 393.490 6.292 30 20 GKED N#CC1(c2ccccc2)CCC(NCC[C@@H](c2ccccc2)C(F)(F)F)CC1 550856690 MADMFWXKHWVJLW-ORFBVSJDSA-N 386.461 5.716 30 20 GKED N#CCCC[C@H](NCc1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 552312009 LYEWEWJCIYNIKD-QHCPKHFHSA-N 380.495 5.550 30 20 GKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(Br)cc1C(F)(F)F 558237079 GAYMYCFRYLYTKQ-LLVKDONJSA-N 377.248 5.448 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Br)c1Cl 563466764 GXHHBIIGROZHSO-UHFFFAOYSA-N 385.714 5.384 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c(C)c1 568279404 BFOQBUGFDYTBEG-FQEVSTJZSA-N 383.495 5.323 30 20 GKED CC(C)[C@H](CNC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 572537562 XEHKLQHZLIBSKY-ICSRJNTNSA-N 395.572 5.049 30 20 GKED CC(C)c1ccccc1N(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 577796272 ODDCQARJRNTZBW-KRWDZBQOSA-N 381.545 5.279 30 20 GKED CSc1ccccc1NC(=O)C1(C)CCN(c2ccc(Cl)cc2C#N)CC1 583224889 VCEVWSDYGXZBIJ-UHFFFAOYSA-N 399.947 5.179 30 20 GKED C=CCC1(C(=O)Nc2ccc(NC(=O)C3(CC=C)CCC3)c(C)c2C)CCC1 584727211 YYJLSQPVGGQROV-UHFFFAOYSA-N 380.532 5.673 30 20 GKED N#CCCC[C@@H](NC(=O)c1cnc(-c2ccccc2Cl)s1)c1ccccc1 590476081 SLQRBCGFOALYLH-GOSISDBHSA-N 395.915 5.628 30 20 GKED Cc1noc(C(C)C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603758948 PXSVBXLCYPNDSU-SFHVURJKSA-N 393.874 5.668 30 20 GKED N#Cc1c(NC(=O)c2cncc3ccccc23)sc2c1-c1ccccc1CC2 603992757 YAJAJAFPQZWONI-UHFFFAOYSA-N 381.460 5.186 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(C)nc2cc(Br)ccc12 606816807 LZKNHWDVWLNJGK-UHFFFAOYSA-N 375.310 5.124 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(F)cc3)cc2Cl)c1 609062993 NGMKGZLVPOZXIG-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#CCn1c(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc2ccccc21 609159185 CMZFXOMYGZUSRQ-UHFFFAOYSA-N 377.753 5.089 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609647408 MSGFRTGZMPLKIH-AVRDEDQJSA-N 382.463 5.369 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)c2occc2COc2cccc(C#N)c2)CC1 609696461 FPTMMJNBVHLGKX-IBGZPJMESA-N 380.488 5.019 30 20 GKED C[C@@H](Sc1c(C#N)nnc2ccccc12)c1ccc(OC(F)(F)F)cc1 610129740 KJEFNAZPRPFBTE-LLVKDONJSA-N 375.375 5.253 30 20 GKED CCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@@H](Cc1ccc(F)cc1)C(C)C 610406609 GIQJQWPUCFZZKM-VGSWGCGISA-N 381.495 5.057 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(Cc2ccccc2)C1 610630775 OWDZHLGHGAYLAW-UHFFFAOYSA-N 397.478 5.365 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(c4ccccn4)CC3)cc2)cc1 611094491 LPNAJDDLMVUHJL-UHFFFAOYSA-N 398.466 5.157 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(COCc2ccccc2)c1 611390438 AOVHXEBJNUEBGQ-AREMUKBSSA-N 382.507 5.442 30 20 GKED N#C[C@@H](C(=O)c1cc2ccsc2[nH]1)c1nc2cc(C(F)(F)F)ccc2s1 613405326 YHPJEQWFMDRHAW-JTQLQIEISA-N 391.399 5.348 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](CC(F)(F)F)c1ccc(Br)cc1 614405696 COTMNFNIEVYTJN-QGZVFWFLSA-N 397.238 5.413 30 20 GKED N#C[C@@H](C(=O)c1cc(OCc2ccccc2)cs1)c1nc(C2CC2)cs1 626467236 KINKMLJNRWQDJE-INIZCTEOSA-N 380.494 5.151 30 20 GKED O=C(NC[C@H]1CCCC(F)(F)C1)Nc1ccc(C(F)(F)C(F)(F)F)cc1 669718059 ZNIPYAISMVJTDL-JTQLQIEISA-N 386.311 5.288 30 20 GKED N#C[C@H](C(=O)c1ccnc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 677974242 GGQXWAPLUMHYOZ-CQSZACIVSA-N 397.381 5.353 30 20 GKED Cn1c(/C(Cl)=C\c2cccc(OCCCC#N)c2)nc2cc(Cl)ccc21 728439834 GJRJBZJRACHHIH-SFQUDFHCSA-N 386.282 5.646 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cc3cc(Br)ccc3o2)cc1 728700950 YPQULFAFLMKBOA-UKOWJOKBSA-N 396.240 5.382 30 20 GKED CC(C)(C)/C=C/C(=O)Nc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1 733920502 QLMUFGJVMXFNRS-VOTSOKGWSA-N 393.434 5.165 30 20 GKED Cc1cc(C(=O)N[C@@](C)(C#N)C2CCCCC2)c(C)n1[C@@H](C)c1ccccc1 734238778 PSKINIMKWLZXBW-UUOWRZLLSA-N 377.532 5.307 30 20 GKED CCCCCCCC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 740726855 IXRQVYGPGPMNOF-HXUWFJFHSA-N 382.548 6.489 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1ccc(-c2ccc(F)cc2)o1 741840614 ASIMAIYVZUYQKT-PKNBQFBNSA-N 384.378 5.146 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2ncc(-c3ccccc3Br)o2)cc1 741842373 KHQDFDULMOUBAV-CXUHLZMHSA-N 385.648 5.713 30 20 GKED Clc1cc(Cl)c(NN=Cc2ccc(Oc3cnccn3)cc2)nc1Cl 743427737 XUJVKYZEMONQRT-UHFFFAOYSA-N 394.649 5.070 30 20 GKED C[C@@H](NC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1cccc(C#N)c1 743776558 BPWKINNCEBDDBC-QGZVFWFLSA-N 395.462 5.110 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(Cl)ccc2[N+](=O)[O-])n1 746388502 BADJKHSJKZGACH-UHFFFAOYSA-N 387.770 5.134 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)O[C@H](C)c3ccc(C#N)cc3)c12 748685407 PZLJQMODBIJSGO-CYBMUJFWSA-N 375.428 5.013 30 20 GKED N#CCCn1cc(C=NNc2cc(Cl)ccc2Cl)c(-c2ccccc2)n1 751894810 ARYALZSWSGNGDN-UHFFFAOYSA-N 384.270 5.217 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCC1CCC(C#N)CC1 755974409 MARRDMHVXMRUSM-UHFFFAOYSA-N 392.377 5.156 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc3c2N(C(=O)OC(C)(C)C)CC3)c(F)c1 757528123 APKJRBUVZGZJFB-FLIBITNWSA-N 397.446 5.028 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 763547977 IGKTUJRWVINQDQ-KXBFYZLASA-N 376.406 5.362 30 20 GKED CC(C)c1ccc(N(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 763636705 ZWENWWSVHYBXSI-QGZVFWFLSA-N 381.545 5.137 30 20 GKED Cc1cc(C)cc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 765233930 JPBOZHZLECCAKS-DEOSSOPVSA-N 383.495 5.623 30 20 GKED C=CCCC[C@@H](C)OC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O 765496989 QGJFWSDYBDNEIB-GFCCVEGCSA-N 377.843 5.031 30 20 GKED N#C[C@H](C(=O)CC1(CSc2ccccc2)CC1)c1nc2ccccc2s1 770844207 VGLJXKVVXSYSDV-MRXNPFEDSA-N 378.522 5.435 30 20 GKED N#C[C@@H](COC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)Cc1cccs1 772738106 RQHWDNMSNLAICM-UABBMWSGSA-N 397.462 5.122 30 20 GKED N#C[C@H]1CCC[C@H](NCCCCCCc2nc(-c3ccc(Cl)cc3)no2)C1 774368951 IHAIJBAVQPGCJW-LPHOPBHVSA-N 386.927 5.165 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(OC2CCCCC2)cc1 780580357 ZEZNMCXDADYBOM-MRXNPFEDSA-N 379.460 5.333 30 20 GKED N#Cc1c(F)cccc1-n1ccc(NC(=O)c2sc3ccccc3c2Cl)n1 781208249 HATJGZUOKNUFOS-UHFFFAOYSA-N 396.834 5.003 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)sc21 797570924 LZBCMALIKJJGFX-AWEZNQCLSA-N 393.537 5.637 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnnc(-c3ccccc3)c2)cc1 810115156 TZILEQPVBHSMNC-QHCPKHFHSA-N 390.446 5.051 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC[C@@H]3CC3(Cl)Cl)n2)cc1 850763269 XTBQBOYRKYHOPP-KGLIPLIRSA-N 379.312 5.269 30 20 GKED C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)c1nc(Cc2ccccc2Cl)no1 904376131 XMQXQTFIONXYBP-CQSZACIVSA-N 398.290 5.022 30 20 GKED N#C[C@H](C(=O)CCn1c2ccccc2c2ccccc21)c1ccc2ccccc2n1 916848337 CABPUWCQOCIYRZ-NRFANRHFSA-N 389.458 5.609 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 918034655 SXVXHAQJYUKBJU-RPBOFIJWSA-N 395.506 6.020 30 20 GKED Cc1ccc(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 920872972 RVRWJAKMJUOZQX-DEOSSOPVSA-N 383.495 5.323 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccsc1C(F)F 930110599 QUTDEGFPYXIXCY-RNFRBKRXSA-N 395.315 5.325 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccccc3)c(Cl)c2)ccc1Cl 1776034510 KBGLVLAHRRADSS-UHFFFAOYSA-N 385.250 5.805 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)c1 1776341482 SCTPYPIZEFBVEU-VOTSOKGWSA-N 387.273 5.242 30 20 GKED CCCCCCCOc1cccc(CNC2CC3(C2)CC2(CC(C(=O)O)C2)C3)c1 1776787292 MRBZMOJHVYRHIC-UHFFFAOYSA-N 399.575 5.549 30 20 GKED COc1cc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc2ccccc12 1777288486 JARKAUKUJHOMTK-NTMALXAHSA-N 390.435 5.230 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777545381 YFRHZSGDUUZLGR-VGOFMYFVSA-N 388.467 5.342 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325585 NRMHKZVXHDRVHS-YSTOQKLRSA-N 394.559 5.159 30 20 GKED N#CCCCSc1nc(-c2ccc(Br)cc2)nc2ccccc12 4801588 TUMXXMMXZIWGMO-UHFFFAOYSA-N 384.302 5.455 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)ccc1OCC#N 23611978 BSLWPKMQCYOAOH-ONNFQVAWSA-N 375.449 5.222 30 20 GKED CC(=O)c1c(C)cc(C)c(CNc2ccccc2Oc2ncccc2C#N)c1C 55844427 QLFIBKQOCJGGOM-UHFFFAOYSA-N 385.467 5.486 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)Cc1ccccc1 102796589 JAJISUBYODWZRW-UHFFFAOYSA-N 385.467 5.110 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(Cl)cc1Cl 109002679 NNEOGLLKHJSGLA-LBPRGKRZSA-N 394.327 5.438 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)cc1-c1ccc(F)cc1 119835753 LVAWNPMOOQTJEU-KRWDZBQOSA-N 389.455 5.239 30 20 GKED N#Cc1cccc(CSc2nnc(COc3ccc(Cl)cc3Cl)o2)c1 122233729 SHHGTGHHALTFIK-UHFFFAOYSA-N 392.267 5.119 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(OC(C)(C)C)cc2)ccc1OC 157253073 CXBFBWFZOMWVNO-YLJYHZDGSA-N 396.531 5.404 30 20 GKED N#CC1CCN(C(=O)Nc2ccc(-c3nc4cccc(Cl)c4s3)cc2)CC1 159592907 NJMBMDKLJJAHMG-UHFFFAOYSA-N 396.903 5.384 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cc(C)ccc2F)cs1 160632018 HXIIXJFQEBTTEB-UXBLZVDNSA-N 398.434 5.310 30 20 GKED C=CCCCC(=O)Nc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1 175373770 DRBWDLRLZFRXEA-UHFFFAOYSA-N 390.842 5.035 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2cccc(Cl)c2)n1)Cc1cccs1 180073743 DMDMPYGURAQLKJ-LBPRGKRZSA-N 388.901 5.064 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)Nc3ccccc3O[C@H](C)C#N)c2c1 182036906 GMACNENRXOHNQU-MRXNPFEDSA-N 385.467 5.272 30 20 GKED C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)c1cccc(C#N)c1 189815560 VYKSYGPDTHBOKE-CQSZACIVSA-N 385.496 5.486 30 20 GKED C[C@@H](Nc1cccc(Oc2ncc(Br)cn2)c1)c1cccc(C#N)c1 190718178 VVTBEPATMVQSTO-CYBMUJFWSA-N 395.260 5.076 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(S(=O)(=O)CCCC)cc1 192358769 KFGPLKJFKPIONG-UHFFFAOYSA-N 399.556 5.365 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(C2SCCS2)cc1 264451562 CPVMIZHNHKRHRX-UHFFFAOYSA-N 386.567 5.423 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1cccc(Cl)c1Cl 303389316 OJXWKQLRZRIEFK-HNNXBMFYSA-N 389.213 5.387 30 20 GKED COc1ccc(N=C(O)[C@@H]2CCC(=O)[C@H](C)C2)cc1N=C(O)C1CCCCC1 328947626 KFTBHUDDJCWLAQ-GDBMZVCRSA-N 386.492 5.457 30 20 GKED CC(C)C(O)=Nc1cccc(N=C(O)N2Cc3ccccc3C3(CCC3)C2)c1 329452395 NGBLQOZVLWEQNS-UHFFFAOYSA-N 377.488 5.414 30 20 GKED Cc1cccc2c(CC/C(O)=N/[C@H]3CCCc4cn(C5CCCC5)nc43)c[nH]c12 329477070 BTEZMXNPSJHCER-NRFANRHFSA-N 390.531 5.755 30 20 GKED OC(=Nc1ccccc1-c1cccs1)[C@H]1CCCN(/C(O)=N/C2CCCC2)C1 329885177 UFTZCQYBXKVPRP-INIZCTEOSA-N 397.544 5.572 30 20 GKED Cc1ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cc1N=C(O)C(C)(C)C 330021378 XSBOWQGQEHHEDT-UHFFFAOYSA-N 399.535 6.142 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1/C(O)=N/[C@H]1CCCc2sc(Cl)cc21 330200303 AEBQRZBLMZJQGA-GJZGRUSLSA-N 392.956 5.137 30 20 GKED COc1ccc(-c2nnc(S[C@H]3CC[C@@H](C#N)C3)n2-c2ccc(C)cc2)cc1 430091679 YNZSFBMAIROAHN-UZLBHIALSA-N 390.512 5.036 30 20 GKED N#Cc1ccc(F)c(CNC(=O)Nc2cccc(CSC3CCCC3)c2)c1 438249344 CMUQOJMSHASJTC-UHFFFAOYSA-N 383.492 5.195 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)Nc1cccc(C#N)c1C 438892695 JNIDJSYNQKLXNY-UHFFFAOYSA-N 386.238 5.389 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H]1C[C@H]1c1ccccc1 461256084 GRLTVNOSUXONSL-WDSOQIARSA-N 396.581 5.414 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 465669843 QMZQGDJCATYUSH-ROUUACIJSA-N 399.494 5.355 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)ccc1-c1ccoc1)c1ccc(Cl)c(Cl)c1 471089394 SODNQOAGNHJOEG-GOSISDBHSA-N 389.213 5.387 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC2(CCC2)C1 471288348 RBSJFTYOJZABBJ-UHFFFAOYSA-N 389.499 5.244 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(Cc2ccccc2)CCC1 473820612 VWLCJJZLASCBHG-KRWDZBQOSA-N 379.529 5.225 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(COC(C)C)c1 480805532 QPVFFCRPXQKJTJ-UHFFFAOYSA-N 378.925 5.547 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccnn1C1CCCC1 481146065 RNKGWQAJSKKACF-UHFFFAOYSA-N 386.455 5.223 30 20 GKED CC(C)C[C@H](C)n1nccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 481441946 VFUHFAYXICOGJP-SFHVURJKSA-N 381.524 5.052 30 20 GKED CCN(CCCC(=O)Nc1c(C)cc(C)cc1C)[C@@H](C)c1ccc(C#N)cc1 485075068 RUXFZMHNPSPUEH-FQEVSTJZSA-N 377.532 5.285 30 20 GKED C=C(C)[C@@H](NC(=O)c1scc(C)c1Br)c1ccc(F)c(F)c1 488914330 JBDAIGGDICNOCQ-CQSZACIVSA-N 386.261 5.144 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)N[C@H](C)c1ccc(F)cc1 499489211 ZZWKNXLRKIBCON-VXGBXAGGSA-N 396.409 5.074 30 20 GKED Cc1cc(C)n([C@H](C)CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 500751231 CLMXFKKZKOOXLF-GOSISDBHSA-N 388.471 5.062 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 503201694 PSKAWXVUKDDFFZ-AZUAARDMSA-N 393.556 5.628 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cccc(C(F)F)c2)cc1 506039217 VTDWAXDAAVRYKV-UHFFFAOYSA-N 378.378 5.327 30 20 GKED CCN(C(=O)c1ccc(OCCC(C)C)c(OC)c1)[C@H](C)c1ccc(C#N)cc1 509607504 HRWFSIRCIOMAMT-GOSISDBHSA-N 394.515 5.215 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1C 510368204 XRLHHIAYWNDPQK-UHFFFAOYSA-N 381.888 5.128 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)ccc1OC1CCCC1 512662174 VYZYRKWIPINQFY-HOTGVXAUSA-N 382.479 5.439 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1F 512665508 GIDPCCVZIRMKLU-MWTRTKDXSA-N 384.458 5.024 30 20 GKED CC(=O)c1ccc(CC(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)cc1 515286367 UTBLROWVLLXKMU-QGZVFWFLSA-N 394.540 5.155 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3)no2)sc2c1CCCCCC2 515677809 ZHKOXMZDLCYUOV-UHFFFAOYSA-N 377.469 5.186 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)o2)c(C)c1 517446186 UIYLPYNXINTRRV-UHFFFAOYSA-N 391.471 5.156 30 20 GKED CCCCOc1cccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 518681953 NCHDAAGKTABNBY-QGZVFWFLSA-N 397.544 5.439 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccccc3OC(F)F)cc2)c1 519507329 SSOIAAGJVBADTK-UHFFFAOYSA-N 380.350 5.204 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1cccc2ccccc12 520143992 JNJYGSODVLXTEO-KRWDZBQOSA-N 389.455 5.207 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc2ccccc12 521087278 WWUICODXSMQWHF-UHFFFAOYSA-N 393.446 5.565 30 20 GKED Cc1cccc2c(CCC(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)c[nH]c12 525576336 YCVJOJWMDWWJDA-KRWDZBQOSA-N 386.282 5.097 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN1CCCCC[C@@H]1c1ccco1 533435272 XGYDPDKXDLFWTM-IEBWSBKVSA-N 397.544 5.087 30 20 GKED CCN(C(=O)c1cncc(-c2ccc(C)cc2)c1)c1ccc(C#N)c(Cl)c1 539174791 BTTRIEHWFMJOIK-UHFFFAOYSA-N 375.859 5.249 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(OCc3cccnc3)c(Cl)c2)ccc1Cl 539783733 YNVQODDSKPTGJW-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#Cc1ccc(CN2CCC(Nc3cccc(C(F)F)c3Cl)CC2)cc1 543620387 LEQBITNIWGNWMP-UHFFFAOYSA-N 375.850 5.226 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)CCCC1(C)C 549385722 GIUARAUJJWZGIC-MRXNPFEDSA-N 397.441 5.176 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc2n[nH]cc2c1 553312082 TWZUXLHHNVHCMT-OAHLLOKOSA-N 398.491 5.077 30 20 GKED Cc1nsc(Oc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)c1C#N 554678985 IGTNMXIKNBGOOB-UHFFFAOYSA-N 383.860 5.046 30 20 GKED N#Cc1ccc2ncc(CNc3ccccc3OCc3cccc(Cl)c3)n2c1 557036192 ILDHERHXXUPYAM-UHFFFAOYSA-N 388.858 5.050 30 20 GKED CCN(Cc1nnc(-c2cccc(C#N)c2)o1)C(c1ccccc1)c1ccccc1 559725645 LRLYKWUNBLTFGW-UHFFFAOYSA-N 394.478 5.220 30 20 GKED COc1ccc2cccc(Cc3noc(C[C@H](CC#N)c4ccccc4)n3)c2c1 563478983 HFKCLHHTYIBCDJ-IBGZPJMESA-N 383.451 5.062 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1CCC(CCC#N)CC1 563532692 LVWMFTIVSHQTRS-UHFFFAOYSA-N 389.971 5.199 30 20 GKED Cc1sc([C@@H](C)N[C@@H]2CCc3ccc(C#N)cc32)nc1-c1ccc(Cl)cc1 569861769 ZEYZCLBUWMCGSV-ZUOKHONESA-N 393.943 5.982 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)s1 573991934 KNXOUURJZNCLCQ-AWEZNQCLSA-N 381.526 5.363 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)C[C@H](C)C[C@@H]4C)ccc12 577597995 FMGSJIXEFSZRJB-YPMHNXCESA-N 391.496 5.120 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)NCC(C)(C)CCC#N 582686415 QGBFYFNYNHDRNR-UHFFFAOYSA-N 380.275 5.017 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)c(F)c1 588933988 DPDBYINBIXHELL-IBGZPJMESA-N 398.279 5.108 30 20 GKED Cc1cccc(C)c1-c1cccc(OCc2nnc(-c3cccc(C#N)c3)o2)c1 589272490 HQZGRSFKQBGLPI-UHFFFAOYSA-N 381.435 5.471 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2C)cc1 593291808 JQGPCTCOCGIQHL-OAQYLSRUSA-N 387.487 5.046 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H](CCF)C1 596724800 VNKXWESIULPNCO-GOSISDBHSA-N 395.478 5.049 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1sccc1C(C)C 608876855 XPZAPWYKVCPIQY-UHFFFAOYSA-N 377.469 5.491 30 20 GKED COc1cc(Cn2cc(-c3ccccc3)cn2)ccc1OCc1cccc(C#N)c1 609852036 IFXZWZJMSBJPPY-UHFFFAOYSA-N 395.462 5.058 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc(-c3csnn3)cc2)c1 610910146 LJUMWFXNBKLTEF-UHFFFAOYSA-N 398.491 5.268 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cccc(C(F)(F)F)c1 611093010 ZCFSPYUQLQNLCL-SECBINFHSA-N 387.188 5.375 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N(C[C@H](C)C#N)C2CC2)c(C(F)(F)F)c1 611095052 PDUWLMQKKFWOJJ-OLZOCXBDSA-N 399.482 5.752 30 20 GKED Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NCc1ccc(C(C)(C)C#N)cc1 614056292 LQONWEGXRVUCHB-GOSISDBHSA-N 389.543 5.280 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)C1 665430466 NNUWYSZEVLQWMU-KRWDZBQOSA-N 378.476 5.151 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)nc1 685783919 JWQAXTSCUUFCFY-CYBMUJFWSA-N 389.402 5.324 30 20 GKED Cc1cc(C(=O)N2CCC[C@H]2c2ccsc2)c(C)n1-c1ccc(C#N)cc1 728267584 CUCIYCXGLUSGOX-NRFANRHFSA-N 375.497 5.005 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728464971 DUEKBXQCVDCRQZ-FDDCHVKYSA-N 384.479 5.483 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(-c3ccc(F)cc3)cc2F)c1 729947992 OHMCMUMJYUXXPX-UHFFFAOYSA-N 392.405 5.567 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1=S 742176026 QPVPANPNTCICFH-MAUKXSAKSA-N 398.507 5.040 30 20 GKED C=CC[C@H](NC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1)c1ccncc1 745827406 JXWWWIWOFIJOGA-BJKOFHAPSA-N 383.495 5.208 30 20 GKED Cc1ncsc1C(=O)/C=C\c1cnc(-c2ccc(Br)cc2)s1 751524401 QZFGRFVQFHEXLF-SREVYHEPSA-N 391.315 5.234 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N2CCO[C@H](c3cccc(C#N)c3)C2)cc1 761844364 GHOPWRZJGLPCCX-FQEVSTJZSA-N 395.528 5.054 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 765041115 WYOCSQTWXUTOSD-CVEARBPZSA-N 384.907 5.114 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)c(Cl)c1 766235948 AZVYDQZACNWOIB-AWEZNQCLSA-N 384.888 5.294 30 20 GKED N#CCOc1ccc(CNCc2c(Cl)cccc2Oc2ccccc2)cc1 778084600 KMDLCEQULSUTCF-UHFFFAOYSA-N 378.859 5.324 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cnc(-c2ccccc2Cl)s1 780175955 IOUOGYKMMIZVFB-GFCCVEGCSA-N 383.860 5.007 30 20 GKED CC(C)c1ccc(CN(C(=O)Nc2ccccc2O[C@@H](C)C#N)C2CC2)cc1 780668989 GLRDIHMVENRWSF-KRWDZBQOSA-N 377.488 5.297 30 20 GKED CCOc1cc(/C=C/C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1O 780886674 CNLMJSOZGZXARU-OZOJFGJPSA-N 398.462 5.098 30 20 GKED N#C[C@H](C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1ccc2ccccc2n1 781445284 SMGOBJLVGJBVDV-KRWDZBQOSA-N 398.359 5.301 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 793283366 ZSIMQMQAJONXEN-WBVHZDCISA-N 397.400 5.094 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(Oc2cccnc2)cc1 808436001 HJNUHHDPRURODP-IBGZPJMESA-N 386.499 5.075 30 20 GKED CCc1ccc(N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C(C)C)cc1 813259964 IXADMUZJYSQXPQ-UHFFFAOYSA-N 385.467 5.363 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@@H]([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 814673926 LYSYJYSSLFMYDU-WOJBJXKFSA-N 391.600 5.066 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)[C@H](C)Cc1ccc(C#N)cc1 846935405 YHJPOTOQQRCGFA-MRXNPFEDSA-N 393.487 5.031 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC3CCC(F)(F)CC3)n2)cc1 860502966 QNQBKGBPZLZZRQ-INIZCTEOSA-N 390.455 5.211 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc(-c3cccnc3Oc3ccccc3)no2)c1 904452408 BIIPGXKPLIYKNN-VQTJNVASSA-N 380.407 5.067 30 20 GKED Cc1sc2ncn(N=Cc3ccc4ccccc4c3)c(=O)c2c1-c1ccccc1 916283987 FWIUUVVXPKRRLL-UHFFFAOYSA-N 395.487 5.469 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CSCc2cccc(C)c2)cc1 916955946 VYQUTZZLPMWAAA-UTKZUKDTSA-N 394.540 5.089 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2scnc2Cl)cc1Cl 920080549 GPKVSXPVGBUXIZ-CQSZACIVSA-N 388.279 5.358 30 20 GKED CCCCCCCOc1ccc(C=NNc2cccc(C(=O)O)c2)cc1OCC 1776036754 GXNYVNKZYBFUFC-UHFFFAOYSA-N 398.503 5.579 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2ccccc21 1776308686 KNALKDSRUHQQCO-IMEWXKHHSA-N 388.488 6.133 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cs1 1776380544 UYJNIKHDWATBKZ-FMIVXFBMSA-N 377.465 5.528 30 20 GKED Cc1cccc2c1OC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1777459773 PFCFUMJNBSRIDQ-WJDWOHSUSA-N 376.433 5.080 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4cc(F)ccc4C3=O)s2)c1 1777684331 RUIYOTSOKOTTHG-NTCAYCPXSA-N 378.424 5.465 30 20 GKED Cc1cc(C(=O)/C(=C(/S)Nc2cccc(C)c2C)[n+]2ccccc2)c(C)s1 10168248 CYDXUPJMPBDDCA-UHFFFAOYSA-O 395.573 5.320 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc(Cl)c([N+](=O)[O-])c1 25174758 HZZRWQQJURWTCA-PKNBQFBNSA-N 394.814 5.118 30 20 GKED C=CCn1c(S[C@H](c2ccccc2)c2ccc(Cl)cc2)nnc1C1CC1 36800610 BREMXEHOIQHFRI-LJQANCHMSA-N 381.932 5.877 30 20 GKED CC(C)OCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 41533300 IMXSHMUJYSRJRU-LJQANCHMSA-N 376.481 5.225 30 20 GKED CCCCN/C(S)=C(/C(=O)c1ccc(CC(C)C)cc1)[n+]1ccc(CC)cc1 55012997 UZTDQPXBTPTYIJ-UHFFFAOYSA-O 397.608 5.064 30 20 GKED Cc1cccc(S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 58704938 RFVJYDUNYKVYDV-HXUWFJFHSA-N 396.899 5.105 30 20 GKED C=CCn1c(SCCOc2cccc3ccccc23)nnc1-c1ccoc1C 64926785 ASGPGWXGGQERNV-UHFFFAOYSA-N 391.496 5.357 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66954551 AJRPDUXOWSZVQI-QGZVFWFLSA-N 392.528 5.395 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CC2(Cl)Cl)cc1Cl 97404279 LKEMMRFJQGIPDJ-HUUCEWRRSA-N 379.674 5.128 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(O)cc1 98055176 IYQQAOFXCHNQBX-YFHOEESVSA-N 375.371 5.431 30 20 GKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccco1 98081481 FAMVYHSIDUEDTN-QPJJXVBHSA-N 388.173 5.106 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCSCc3ccccn3)c2)cc1 104417605 IXBNMSXGBKUUKC-UHFFFAOYSA-N 389.480 5.008 30 20 GKED N#CCOc1cccc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)c1 107964717 FESGIVAWIIHNAR-UHFFFAOYSA-N 379.419 5.056 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 108357248 IKNCNYZDZBAWSE-JTSKRJEESA-N 381.545 5.006 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1c[nH]c2cc(F)ccc12 109029669 LKERWKHHMQQIQR-CQSZACIVSA-N 396.491 5.065 30 20 GKED CCN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@@H](C)c1cccnc1 115768587 UUDQZSGDWZTXKQ-KRWDZBQOSA-N 386.455 5.361 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccccc1 151391146 HGDDSJYKAJZGFQ-HXUWFJFHSA-N 395.553 5.566 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Cl)cc1Br 154217554 SXKVOFPDZCUKBF-UHFFFAOYSA-N 395.709 5.361 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 159807954 PCKZPKKKNZYRTE-ZUZCIYMTSA-N 385.876 5.048 30 20 GKED N#Cc1ccc(CCC(=O)N(c2ccc(F)c(Cl)c2)c2nccs2)cc1 163944907 FAABDQDDSSEJQY-UHFFFAOYSA-N 385.851 5.105 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N(C)Cc1ccc(C#N)cc1 175008884 IKYLRHVSXRFWHZ-UHFFFAOYSA-N 385.467 5.110 30 20 GKED C=CCC[C@@H](NCc1csc(N(C(C)=O)c2ccccc2)n1)c1ccccc1 180040997 NFPNZSDEKWPMLF-JOCHJYFZSA-N 391.540 5.625 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 185219447 MTFVZHYOGDEZCL-GAJHUEQPSA-N 398.466 5.361 30 20 GKED N#C[C@@H](C(=O)c1scnc1C1CCCC1)c1nc2ccccc2n1C(F)F 185257392 VUHQZOIEOWERMM-LBPRGKRZSA-N 386.427 5.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1nc(-c2cccs2)no1 189898704 GQKYSFQSZKRIIH-UHFFFAOYSA-N 381.501 5.221 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c(C)n1-c1ccccn1 193721771 QJJCCYPSZQWUBF-LJQANCHMSA-N 398.491 5.103 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 195711429 SQMZZKBAXCDHOZ-UHFFFAOYSA-N 398.428 5.330 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2ccccc2-c2ccccc2)no1 329575891 VQGHRBSBJCFNMZ-FQEVSTJZSA-N 376.460 5.208 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C#N)(c2ccccn2)CC1 374376562 XKBKASIEJKUMHJ-UHFFFAOYSA-N 388.515 5.023 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 409820801 KZNCYSIKTRKZLD-UHFFFAOYSA-N 391.858 5.668 30 20 GKED Cc1nc(-c2cccc(NC(=O)N[C@@H]3CCCc4cc(C#N)ccc43)c2)oc1C 416787146 ZAPAGPPONHVPNX-OAQYLSRUSA-N 386.455 5.029 30 20 GKED N#CCCn1ncc(C(=O)Nc2ccc(Cl)cc2Cl)c1-c1ccccc1 428301837 BVHUKKSCAQEYAJ-UHFFFAOYSA-N 385.254 5.023 30 20 GKED N#CCCn1ncc(C(=O)Nc2cc(Cl)cc(Cl)c2)c1-c1ccccc1 428310386 HBBIFXSQXCYPAW-UHFFFAOYSA-N 385.254 5.023 30 20 GKED C[C@@H](NC(=O)CN[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 433023261 OGHMBBWUPSXMNX-DVECYGJZSA-N 385.511 5.042 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)C1(c2cccc(C#N)c2)CC1 437897785 DOXOUUPYBFLIHI-UHFFFAOYSA-N 384.435 5.029 30 20 GKED N#CCSc1cccc(C(=O)N2CCC[C@@H](CCCc3ccccc3)C2)c1 439163628 GAMGWFCZBCIHCO-HXUWFJFHSA-N 378.541 5.177 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1ccc(C#N)cc1OC(F)F 444795455 YOCYGDFZFFZIQG-INIZCTEOSA-N 384.348 5.251 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(CC#N)cc2Cl)c2cnn(C(C)C)c2n1 452645827 NVUKNTXSTIWJAF-UHFFFAOYSA-N 395.894 5.107 30 20 GKED CC(C)Cn1ncc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C(C)C 455038203 KLEGTGGQKQXMMD-IBGZPJMESA-N 381.524 5.219 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 458797416 GHPVZNHWQXRPNS-LEWJYISDSA-N 381.907 5.622 30 20 GKED C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1C(=O)N[C@@H](CCCC#N)c1ccccc1 458838201 LWKQMNAKAFSSJJ-IDCNUPLLSA-N 381.442 5.182 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 464985957 MQWBHRWFTIHOCO-JOCHJYFZSA-N 385.467 5.277 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1c(CCC)cccc1C(C)C 471888345 ZQUVIQXPADVCQO-UHFFFAOYSA-N 395.503 5.891 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1)c1ccccc1 472507248 VDCXOGKVRBBOFG-UZLBHIALSA-N 381.435 5.193 30 20 GKED CCO[C@H](CCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CCCC1 473637114 AOLFGULJFFHLNA-QFBILLFUSA-N 389.565 5.188 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H](CO)c2c(Cl)cccc2Cl)CC1 475624760 KFNTWAZANXBCIP-BSLVTKGXSA-N 389.326 5.021 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-c4ccccc4)[nH]3)n2)cc1 477844986 NFBIVSUOYHZIRH-SFHVURJKSA-N 399.475 5.304 30 20 GKED N#CCCC[C@H](NC(=O)CCc1cccc(OC2CCCC2)c1)c1ccccc1 487515642 PJWYNZUVWPOEGO-DEOSSOPVSA-N 390.527 5.492 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccccc1 489624353 OCTWGVGMLWJWEF-NRFANRHFSA-N 383.495 5.290 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N(Cc1ccco1)c1ccccc1C#N 501001066 QCFOUGGBWGUVAD-UHFFFAOYSA-N 399.475 5.430 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3/C=C/c3ccccc3)cc2)nc1 505359513 KVNUYRNFDLYHOO-QWDXWUACSA-N 395.462 5.064 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)cc1 507285398 SCMOVPVTSXKJAQ-QFIPXVFZSA-N 398.510 5.245 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)c2cccc(C#N)c2C)cc1 509448449 NHNOVLMWJCZFCU-XMMPIXPASA-N 383.495 5.076 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1ccc(C#N)cc1 509703624 CYPOTPGSZIJZKX-SFHVURJKSA-N 387.458 5.170 30 20 GKED CC(C)N(C(=O)CSc1nc(-c2ccccc2)ccc1C#N)c1ccccc1 510215789 JCQZGMNYXAKYOU-UHFFFAOYSA-N 387.508 5.154 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1cccc(C#N)c1C 510343807 TTWCBPCMHMHYNE-MRXNPFEDSA-N 375.497 5.132 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(Oc2ccccc2)cc1 510457986 MGZVGAWIMJULQW-GOSISDBHSA-N 385.467 5.253 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C 510597137 BQAYKUBWBCZFTN-ZDUSSCGKSA-N 392.425 5.358 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)c1 510748049 FAEGJJYQJYRQHL-OAHLLOKOSA-N 393.512 5.566 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1ccncc1F)c1ccc(C(F)(F)F)cc1 511531197 YAHLVNRVHOBNHS-UGSOOPFHSA-N 395.400 5.307 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3ccc(C#N)cc3F)s2)cc1 512648451 NEKRZJKFWWNQAY-KBPBESRZSA-N 395.503 5.550 30 20 GKED N#Cc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)c1 517538633 AQIPFWYVAUSIPB-UHFFFAOYSA-N 398.897 5.354 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cncnc3-c3ccccc3)n2)cc1 517788988 QUBPDISMWWBESU-GOSISDBHSA-N 396.475 5.066 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 518684397 DNYHMHWAXGDIRB-LPHOPBHVSA-N 397.519 5.316 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Oc2cccnc2)cc1 518693641 OFTARRFPRJWJMA-UHFFFAOYSA-N 385.467 5.044 30 20 GKED N#Cc1ccc(NC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)cc1Cl 519968511 JUNAQWQXCVAVLK-OAQYLSRUSA-N 387.870 5.391 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccccc2)s1)c1ccc(Cl)c(Cl)c1 521017124 CGHIEUWUOFQPHU-OAHLLOKOSA-N 388.279 5.112 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1Cc1ccccc1)c1ccc(C#N)cc1 522840058 ZUIJBORXSUPBIK-SFHVURJKSA-N 386.520 5.582 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1cccc(COc2ccccc2C#N)c1 523536162 HSDDQXURXSADBH-QHCPKHFHSA-N 399.494 5.146 30 20 GKED N#C[C@H](NC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1)C1CC1 525055836 PMMVDTGOOHQNCQ-SFHVURJKSA-N 391.323 5.318 30 20 GKED C[C@H](c1ccc(F)cc1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 530928686 PPYAOMUMOCIBSM-MRXNPFEDSA-N 379.456 5.040 30 20 GKED C[C@@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 531695844 MKLPDQGMPPFPJU-VXGBXAGGSA-N 386.339 6.008 30 20 GKED CN(C(=O)c1ccc(CC#N)cc1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 534039014 GRWQBUBHAFGWMT-JOCHJYFZSA-N 392.861 5.407 30 20 GKED C[C@H](NC1CCC(Oc2ccccc2C#N)CC1)c1cnc2ccsc2c1 537979752 UNZAUJPHQSDQEG-MNNVXMFVSA-N 377.513 5.209 30 20 GKED C[C@H](CCNC(=O)c1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 538556807 PUWMSRZLZSOCIX-OAHLLOKOSA-N 386.417 5.184 30 20 GKED C[C@@H](NC(=O)c1occc1Br)c1ccc(-c2cccc(C#N)c2)cc1 542002925 RJOOBKHYFQYZTB-CYBMUJFWSA-N 395.256 5.072 30 20 GKED Cn1ccc([C@H](Nc2ccc(C(F)(F)F)cc2C#N)c2ccc(Cl)cc2)n1 545163128 CAAPSNWUDXHOFP-GOSISDBHSA-N 390.796 5.165 30 20 GKED N#CCCC[C@H](N[C@H]1CCCc2cc(Br)ccc21)c1ccccc1 556203384 MBDMBDGGQHSVQH-SFTDATJTSA-N 383.333 5.851 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccc(F)cc1 561918783 VTSJHEKMVLKEMJ-CVEARBPZSA-N 377.246 5.183 30 20 GKED N#Cc1c(CSc2nnc(-c3cccc4ccccc34)o2)cn2ccccc12 576629743 SXEWGQNDIIXCAJ-UHFFFAOYSA-N 382.448 5.306 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)[C@H]1C1CC1 579221501 TUNPUZGOEFAWPQ-FPOVZHCZSA-N 393.918 5.648 30 20 GKED N#CCCN(C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccc(F)cc1 582096062 NREYHCAXYDHRNS-UHFFFAOYSA-N 398.359 5.470 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)s1 592974644 WDKHQGPLDPQDDC-CQSZACIVSA-N 393.468 5.357 30 20 GKED CC(C)(C#N)c1ccc(CN[C@H](CC(=O)O)c2cc(Cl)cc(Cl)c2)cc1 593948366 WYKHDCKQPYYKHQ-GOSISDBHSA-N 391.298 5.100 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCc3c[nH]c4ccccc34)cn2)cc1 603765611 XKORKEIBPLPUEP-UHFFFAOYSA-N 396.450 5.188 30 20 GKED COc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604026964 PIJRXTKXNKQGHK-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C=CCn1c(SCc2ccn(C(C)C)n2)nnc1-c1ccc(C(C)(C)C)cc1 604839827 DVBMENWZLAWCJS-UHFFFAOYSA-N 395.576 5.498 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208915 QFQCCXRCOLRBGC-UHFFFAOYSA-N 389.480 5.632 30 20 GKED Cc1ccc(S[C@H](C(=O)Nc2ccc(CC#N)cc2)c2ccccc2)c(C)c1 609261153 UEEQRJVBZRDLSO-QHCPKHFHSA-N 386.520 5.842 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(Cl)c(Cl)c1 609376644 GUQAGSGLIFRNHO-LBPRGKRZSA-N 379.312 5.426 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610323711 ANAJVJUNWYKZPP-OALUTQOASA-N 399.494 5.889 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(Oc3ccncc3)c2)c(Cl)c1 611094279 DUKFYBKQVXNCGS-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc(F)c(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 622485203 HHFGXFWQFVFRFU-AWEZNQCLSA-N 379.275 5.186 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H](CC2CCCCC2)c2ccccc2)c1 726231019 RIPWISOSRSHFBL-QFIPXVFZSA-N 377.488 5.422 30 20 GKED N#Cc1ccc(CN(C(=O)/C=C/c2cccc(OC3CCCC3)c2)C2CC2)cc1 727664607 WSSYLKAYVYMFLG-NTCAYCPXSA-N 386.495 5.084 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 727957131 MAHVNDJDRCWRFP-BBRMVZONSA-N 396.462 5.631 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cc1 728698396 JCGKENNGKYGNJW-SHQCLWGWSA-N 377.440 5.741 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2F)c2ccc(F)cc2)c1 729821950 DIUNMRDUGMCMRJ-UHFFFAOYSA-N 378.447 5.350 30 20 GKED N#C[C@@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1ccc2ccccc2n1 730687472 XDQRWLAEKZVHQF-OAHLLOKOSA-N 391.883 5.307 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CC[C@H](c3ccco3)C2)s1 732413944 HULOYYPAMKQPSO-HNNXBMFYSA-N 376.526 5.056 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cc2ccccc2o1 733080921 GOXDOSBIXMGENQ-HJWRWDBZSA-N 376.393 5.361 30 20 GKED COc1cc(C(C)=NNc2cc(F)c(F)cc2F)ccc1SC(F)F 734302490 GHYJPNPVDZVEEB-UHFFFAOYSA-N 376.350 5.263 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(COc3cccc(C#N)c3)c2)C(C)C)c1 734320916 HJTMJGJVICNXDY-UHFFFAOYSA-N 394.474 5.174 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccncc1 734657737 LERKSAUBLRUPGC-QRWLVFNGSA-N 392.528 5.191 30 20 GKED Cc1ccsc1C(Cc1ccccc1)=NNc1c(F)c(F)nc(F)c1F 735970857 QHVMGMHPVYDKEZ-UHFFFAOYSA-N 379.382 5.067 30 20 GKED N#C[C@H](C(=O)CC/C=C\c1ccccc1)c1nc(-c2c(F)cccc2F)cs1 739159607 HQEKQKMJTQWNQY-VCELZJIISA-N 394.446 5.758 30 20 GKED Cc1ccc(F)c(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c1 739437893 QVJOUSZZXFWAJL-UHFFFAOYSA-N 381.501 5.221 30 20 GKED CCN(c1ccccc1)c1ccc(CNCc2ccc(N(C)CCC#N)cc2)cc1 742378651 IXNGPJCHNYEJKG-UHFFFAOYSA-N 398.554 5.484 30 20 GKED N#C[C@H](C(=O)c1scnc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 744936931 YPTSWICWACFDLN-SNVBAGLBSA-N 380.281 5.063 30 20 GKED Cc1cc(C#N)ccc1COC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 748921855 MNVLQPJVXXNSFM-BANKROOTSA-N 377.406 5.059 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3ccc4cc(O)ccc4c3)c(Cl)nc21 749005108 XFKVQTDDCMGONL-SOFGYWHQSA-N 391.858 5.421 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 751129884 NRKIRIJPTTXCNT-YVMONPNESA-N 375.815 5.051 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2C[C@H](c3ccccc3)C2(C)C)ccc1OC 766329634 MYJMGJIZBKZJGK-VIZSFHNOSA-N 378.516 5.048 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nn(-c2ccccc2)c(=S)s1 768101464 UXQGTAOWGFOTCF-UHFFFAOYSA-N 383.567 5.757 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2ccccc2OC)C2CCCC2)c1 774449248 NATUDGLPPSCDMM-YKSBVNFPSA-N 378.516 5.397 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 780468580 PMIVVIQKAOAJIB-OAHLLOKOSA-N 393.443 5.053 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CCCC1 780676748 QPVWTIRJAMHJOL-MRXNPFEDSA-N 381.451 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(N2CCCC2)nc1Cl 789718263 FSJOLMUQFKGFAQ-UHFFFAOYSA-N 389.952 5.501 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2c(OC(F)F)ccc3ccccc23)cc1 792917412 LWXDURBNNYBVSS-SEYXRHQNSA-N 395.405 5.039 30 20 GKED N#Cc1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c(F)c1 796469853 KEOQBTPMJFMQNM-KRWDZBQOSA-N 396.680 5.380 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(Cl)c(O)cc1F 805256989 MQNOJNFYAFXWHW-UHFFFAOYSA-N 398.846 5.460 30 20 GKED CC(C)(C)c1ncc(/C=C2/CCC/C(=C/c3cnc(C(C)(C)C)nc3)C2=O)cn1 806565892 UTRBMMWSASPCLM-BJPQZVBLSA-N 390.531 5.082 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c(Cl)c1 813217600 NMDRROTYRZRYDU-CQSZACIVSA-N 396.796 5.098 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccc(C(F)F)nc2)cc1OC 853009427 KKHWZQPMYRKRCJ-QPJJXVBHSA-N 381.806 5.366 30 20 GKED COCc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)oc2ccccc12 915087507 UOFGYUPNZSAKKM-NRFANRHFSA-N 396.446 5.487 30 20 GKED CCCCCCCCCCC(=O)N1CCCN(C(=O)c2ccccc2F)CC1 915700340 FHESJBBPSXPELX-UHFFFAOYSA-N 390.543 5.031 30 20 GKED CCCCn1nc(C)c(C=NNc2ncc(C(F)(F)F)cc2Cl)c1Cl 916286412 BVYHCBDUVYCJRT-UHFFFAOYSA-N 394.228 5.158 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@@H](C#N)c3ccc4ccccc4n3)ccc2c1 916849130 PNEYHOSUZDFSID-PTHHNIJRSA-N 378.431 5.286 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccccc2Cl)cc1 916947629 OWDDZDSEPCVDNP-VLYYZTRLSA-N 380.875 5.214 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCn2cnc3ccccc32)cc1 917119563 MPGBCIWQPVJQAD-JOCHJYFZSA-N 394.478 5.111 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1cc(-c2cccs2)nc2ccccc12 917362441 FBNJJJHVDWIWSJ-UHFFFAOYSA-N 387.464 5.112 30 20 GKED Cc1c(NN=C2CC[C@@H](C)c3ccc(Br)cc32)cccc1C(=O)O 1776089150 DOWAWXKCIGNGBL-LLVKDONJSA-N 387.277 5.169 30 20 GKED O=C(O)C(=O)/C(=C/c1cccc(Oc2ccccc2)c1)c1ccc2ccccc2n1 1776116506 VZNRVVYTBLNOOV-LTGZKZEYSA-N 395.414 5.221 30 20 GKED CCCOc1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776823695 CQAGCFKCZIWVEI-IZZDOVSWSA-N 376.408 5.330 30 20 GKED Cc1cccc2c1CC/C(=C/c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777457257 NEFYTCVRKMVPDU-RGEXLXHISA-N 398.458 5.485 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CC4(CC4)c4ccccc4C3=O)cc2)cc1 1777670927 BVMALWRPNCGDCB-RCCKNPSSSA-N 380.443 5.753 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2Br)c1 1777684997 SFNJDESJTNGBNW-DAXSKMNVSA-N 399.162 5.062 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)CC3CCC3)CCC2)cc1 1789454776 AJWZBSMLOPYMFR-OAQYLSRUSA-N 380.532 5.079 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccc(OC[C@H](C#N)CCC#N)cc2)cc1 27213574 SFRLBXVLMSBSAF-KRWDZBQOSA-N 375.472 5.059 30 20 GKED Cc1csc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 45357774 XWXKGSYXWXELGJ-QGZVFWFLSA-N 396.903 5.082 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3oc4c(c3C)C(=O)CCC4)n2)cc1 51154749 UUTVYOJBKHBTHK-OAHLLOKOSA-N 390.464 5.029 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cnn1C(C)(C)C 51154776 KDWIUMIQPLUAHB-MRXNPFEDSA-N 392.528 5.123 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2cccnc2)c(C)c1 62411102 IXGKHEKLXTYCRA-UHFFFAOYSA-N 387.483 5.445 30 20 GKED Cc1csc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)n1 66162005 TWBAIYCUHUXSGS-UHFFFAOYSA-N 390.512 5.433 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)[nH]1 66800106 XMIVXULFOIKMAE-KRWDZBQOSA-N 389.524 5.647 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2o1 66955177 YPLXOAVKBFGELY-HUUCEWRRSA-N 379.485 5.710 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 78419741 GLVUAPDAJALTGA-UHFFFAOYSA-N 396.343 5.519 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C(=O)[C@H](C#N)c1ccccn1)c1ccccc1 106983779 PJHRUDUIINSNQR-XMSQKQJNSA-N 376.843 5.040 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc2ccccc2c1 109002856 SDGWKZJUZTXRGU-MRXNPFEDSA-N 375.497 5.285 30 20 GKED Cc1ccc2oc(SCC(=O)Nc3ccccc3S[C@H](C)CC#N)nc2c1 113777351 NKZVWOKKJLMZFS-CQSZACIVSA-N 397.525 5.261 30 20 GKED N#C[C@@H](C(=O)Cc1ccoc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 123700423 PPCPHIFAXFGGGB-ZDUSSCGKSA-N 377.252 5.129 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccc(F)cc3-c3ccc(F)cc3)o2)cc1 133789589 PTPRIPAPGPUUHR-UHFFFAOYSA-N 388.377 5.166 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 155159482 VGZGMHHYNSOSTQ-ZBEGNZNMSA-N 399.903 5.438 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](c3ccccc3)C3CC3)n2)cc1 162081264 YMAHARLELYOHMU-PZJWPPBQSA-N 388.492 5.189 30 20 GKED Cc1cccc(C)c1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 171358376 OWFTUUASBSUYQJ-UHFFFAOYSA-N 387.458 5.549 30 20 GKED CCc1c([C@H](C)NCc2ccc(OC)c(O[C@H](C#N)CC)c2)oc2ccccc12 181956233 SMBMWKHTZBROFI-WMZOPIPTSA-N 392.499 5.536 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccccc1 188853522 SVUKKZRSEBTPOZ-QFIPXVFZSA-N 391.515 5.393 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 189966614 DJYLZZIRBMNJFW-OAHLLOKOSA-N 383.517 5.862 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)Nc1ccccc1SCCC#N 194317674 JKEKMCMYRWJGMS-MRXNPFEDSA-N 376.481 5.252 30 20 GKED C=CCCCCCN(C)C(=O)/C=C/c1csc(N(C(C)=O)c2ccccc2)n1 265699982 DAUVJZRHLMHHLR-CCEZHUSRSA-N 397.544 5.046 30 20 GKED Cc1ccccc1N=C(O)[C@H](C)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 329227546 ADAUSTWNXCSBNW-HKUYNNGSSA-N 395.551 5.017 30 20 GKED CC(C)[C@@H](/N=C(/O)C1CCS(=O)(=O)CC1)c1ccc(C2CCCCC2)cc1 329253431 WDBXABKGFZXKNG-OAQYLSRUSA-N 391.577 5.213 30 20 GKED Cn1cc(CC/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c2ccccc21 329498976 JXZYXYNCWZENOJ-NRFANRHFSA-N 390.531 5.457 30 20 GKED OC(=Nc1ccccc1-c1cccs1)[C@@H]1CCCN(/C(O)=N/C2CCCC2)C1 329885178 UFTZCQYBXKVPRP-MRXNPFEDSA-N 397.544 5.572 30 20 GKED CC1(C)CCC[C@@H]1N(Cc1ccccc1)Cc1nnc(-c2cccc(C#N)c2)o1 426821277 RLPKYOWQJLMBTO-NRFANRHFSA-N 386.499 5.189 30 20 GKED Cc1ccc(-c2csc3nc(S[C@H]4CC[C@H](C#N)C4)n(C)c(=O)c23)cc1C 430094254 JEYFUULLASWAQW-HOCLYGCPSA-N 395.553 5.063 30 20 GKED Cc1nc(CN[C@H](CCCC#N)c2ccccc2)oc1-c1ccc(Cl)cc1 433007589 AMFNFELOFKOVRO-HXUWFJFHSA-N 379.891 5.828 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(Cl)c2)c2ccccn2)c(OC(F)F)c1 441052998 SBAYDRQMZMENDW-FQEVSTJZSA-N 399.828 5.087 30 20 GKED Cc1cccc(Oc2ccccc2C(=O)[C@@H](C#N)c2cnc3ccccc3n2)c1 442527343 XJJPNLDKTXNTRK-IBGZPJMESA-N 379.419 5.221 30 20 GKED CSc1ccccc1[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 442861755 UVNMOBLWRVYACD-MRXNPFEDSA-N 379.529 5.165 30 20 GKED CC[C@@H](NCc1cc(-c2c(OC)ccc3ccccc23)no1)c1ccc(C#N)cc1 447594074 WUTRUKGURRUWDH-JOCHJYFZSA-N 397.478 5.616 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CCCC[C@H]2CC(F)(F)F)c2ccccc21 452506423 BDZXFQDCMGVBQD-YJBOKZPZSA-N 391.437 5.186 30 20 GKED C[C@H](C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 463242966 PCJBODDMVPMEQH-XDHUDOTRSA-N 380.447 5.314 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C2=CCCC2)cc1 463399941 SYRFMASRYRNESO-UHFFFAOYSA-N 395.462 5.874 30 20 GKED Cc1ccc(-c2ccc(CNc3ccc4c(c3)CCC(=O)N4CCCC#N)o2)cc1 469249215 XEZJSWDULRDRTC-UHFFFAOYSA-N 399.494 5.450 30 20 GKED C=C(C)[C@H](NC(=O)N(C)Cc1ccccc1SC)c1ccc(F)c(F)c1 472195883 ZHRNDPWGAJRXIH-IBGZPJMESA-N 376.472 5.146 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 475181182 GKMHEHQQNGTBKI-NRFANRHFSA-N 395.462 5.685 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 476120171 KJMBZCJFRIGETE-AUSIDOKSSA-N 398.506 5.627 30 20 GKED C=C(C)[C@@H](NCc1ccc(OCc2cccnc2)cc1)c1ccc(F)c(F)c1 479418663 XZYZJBHQORZIGS-HSZRJFAPSA-N 380.438 5.346 30 20 GKED C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1 480208990 XZXCOXOAQNMTSR-RIEVBORMSA-N 396.490 5.118 30 20 GKED N#Cc1cc(NC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)ccc1F 481681075 BVEXXPXHNOZXFR-GOSISDBHSA-N 385.851 5.323 30 20 GKED N#Cc1cc(NC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)ccc1F 481740445 KNRKZEGEKJYOFJ-GOSISDBHSA-N 391.368 5.475 30 20 GKED CCOCCOCc1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1C 481999510 GTJVHNIIGAWQSD-XMMPIXPASA-N 378.516 5.299 30 20 GKED N#C[C@H](C(=O)c1ccc(NC(=O)c2cccs2)cc1)c1nccc2ccccc12 483216061 SVQHCIUQKBFLRC-IBGZPJMESA-N 397.459 5.039 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1nc2cc(C(F)(F)F)ccc2o1 483223773 WQUNNEVZRWPHEM-WMZOPIPTSA-N 385.389 5.118 30 20 GKED Cc1ccc2c(c1)CCN(C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)C2 483855416 IIGQLCPKPBJKGX-UHFFFAOYSA-N 397.478 5.558 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2CCCC(F)(F)C2)cc1 488978575 MYOHHKFFPVKPFT-KRWDZBQOSA-N 386.467 5.158 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(Cl)ccc1Cl 500736679 FZVZUKRQJSOEPC-UHFFFAOYSA-N 397.261 6.218 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 509228571 SRSQKFXIPYTRDN-ZDUSSCGKSA-N 377.366 5.121 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCOC2CCCC2)cc1Cl 510005313 KPKWKLVGSNFXQM-HXUWFJFHSA-N 397.906 5.076 30 20 GKED CC[C@@H](CC1CCCC1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 510042877 OHUOHBPERJDRPJ-SFHVURJKSA-N 377.488 5.599 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc1Cl 512792102 HNVJNNNYVSPZFE-OAQYLSRUSA-N 375.859 5.734 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 513174879 ACUCVXJECPAPTN-GOSISDBHSA-N 395.384 5.358 30 20 GKED N#CCc1ccc(NC(=O)N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)c(Cl)c1 517694758 NKJMXGFYKGYASM-REPLKXPHSA-N 379.891 5.349 30 20 GKED CSc1ccccc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 521259682 UCGZKMOTMATKLO-LBPRGKRZSA-N 386.448 5.300 30 20 GKED CC(C)CCO[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 521734838 UALZPZOHAOTQQW-CYBMUJFWSA-N 388.455 5.101 30 20 GKED C[C@@H](CNC(=O)N[C@H](C)c1ccc(C#N)cc1)c1c(Cl)cccc1Cl 523820654 WLMPBIGHVUZRGB-QWHCGFSZSA-N 376.287 5.029 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2c1 525563608 AGJRKNFVBTWDLL-HNNXBMFYSA-N 391.496 5.198 30 20 GKED CC(C)CN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)Cc1ccccc1 532497992 YQDHDVPWMXMNQF-LJQANCHMSA-N 395.572 5.035 30 20 GKED CC(C)c1ccc(CN(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 532917313 ZDBHLVLUQKTZRH-SFHVURJKSA-N 395.572 5.132 30 20 GKED C[C@@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccc(C#N)cc1 538396363 SQWKFWPMHADVHV-MRXNPFEDSA-N 389.886 5.315 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccoc2C2CC2)cc1Cl 540840774 QGWMRGLOFPZVAY-IBGZPJMESA-N 376.843 5.718 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1nccc2sccc12 543419511 JFBCTWNVKJQFAR-UHFFFAOYSA-N 387.489 5.571 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)Nc1ccccc1F 556304358 FHCMMTUPZLJPKN-UHFFFAOYSA-N 394.290 5.527 30 20 GKED N#CC1(CC[S@@](=O)Cc2nc(-c3c(F)cccc3F)cs2)CCCCC1 561137474 DAZPERKGDMAMKP-AREMUKBSSA-N 394.512 5.201 30 20 GKED N#CCC1CCN(C(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)CC1 562575263 YUTBJGQXHHTRQF-UHFFFAOYSA-N 388.895 5.396 30 20 GKED COc1ccccc1[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 571724753 ARPXBJAUNPVJAL-VWNXMTODSA-N 388.898 5.587 30 20 GKED N#CCCN(C(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(F)cc1 575769204 QCTXQAFJUYKRJR-UHFFFAOYSA-N 390.483 5.678 30 20 GKED CC(C)N1CC[C@@H](NCCCCC(C)(C)C#N)[C@@H]1c1ccc(Cl)c(F)c1 578859359 VPHWOOYMQDILQS-UXHICEINSA-N 379.951 5.313 30 20 GKED C[C@@H](NCc1cc(C(F)(F)F)ccc1Br)c1ccc(C#N)cc1 580679552 DABWCKDFQSMUJO-LLVKDONJSA-N 383.211 5.190 30 20 GKED Cc1cc(=NC(=O)Nc2ccccc2SC[C@@H](C)C#N)[nH]n1C1CCCCC1 589327761 FNTDVDMAUXGKMI-HNNXBMFYSA-N 397.548 5.014 30 20 GKED N#CC1(c2ccc(CNCc3ccccc3COCc3ccccc3)cc2)CC1 594926630 UVDCMCGAFGDOQL-UHFFFAOYSA-N 382.507 5.248 30 20 GKED CCS[C@@H](C)c1noc(CSCc2ccc(C#N)cc2C(F)(F)F)n1 596348013 BMHMPFPCHUUGPT-JTQLQIEISA-N 387.452 5.208 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603622735 XNWDKZYDGSAZSQ-UHFFFAOYSA-N 395.418 5.160 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ncc(Cc3ccccc3)s2)c1 604456160 CYWBSARHNRAGMT-UHFFFAOYSA-N 392.484 5.060 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c(C(F)(F)F)c1 609212787 XHRJKPKXSBGVNO-CYBMUJFWSA-N 391.393 5.247 30 20 GKED CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 609376690 HYAXYRZLLNOAHP-FTEYMNFISA-N 388.577 5.354 30 20 GKED CCc1ccc([C@@H](C)CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 609968232 QAJJHTVSDHMGEZ-KRWDZBQOSA-N 399.494 5.749 30 20 GKED C[C@H](C(=O)N(Cc1ccco1)c1ccccc1C#N)c1ccccc1C(F)(F)F 610223547 VIXOCQLCJNRKLQ-HNNXBMFYSA-N 398.384 5.507 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 618741946 OBNNFRHDPBQNSK-KRWDZBQOSA-N 384.323 5.373 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 620567645 DBECQIUPLKICFL-AWEZNQCLSA-N 395.528 5.090 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1c(F)cccc1Cl 642157239 PNYMAWJOEVGVRV-BRPSZJMVSA-N 391.714 5.118 30 20 GKED Fc1ccc(C(F)(F)F)c(-c2noc([C@@H](C[C@H]3CCCO3)C(F)(F)F)n2)c1 650535535 YALLXGNQVVVZCO-BXKDBHETSA-N 398.278 5.110 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc(OC)cc(OC)c3)s2)cc1 727975739 VPZXZEOUJMVAOO-YHYXMXQVSA-N 395.480 5.040 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ccc(F)cc2C#N)cc1OCC 728568657 IRAMJHQFUFCWJT-UHFFFAOYSA-N 390.842 5.089 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)c(Cl)c1)c1nc2cc(F)ccc2s1 730420143 ADJUTSJOTBYEPS-LBPRGKRZSA-N 393.270 5.551 30 20 GKED CC(C)c1ccc2c(c1)CCCN2C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 731971745 RSHDEZLDYOJCKO-UHFFFAOYSA-N 397.478 5.462 30 20 GKED N#CCOc1ccc(CC(=O)O[C@H](CCc2ccccc2)c2ccccc2)cc1 732499704 TVZGEBCCHIISET-XMMPIXPASA-N 385.463 5.049 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccco1)Cc1ccc(C)s1)c1ccncc1 734679462 HOIBUHXXDAQQTF-FQEVSTJZSA-N 381.501 5.074 30 20 GKED CC(C)(C)/C=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 735206543 LNWWBEPKZPIGBK-FWWRYZNZSA-N 379.312 5.895 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC(c2nc3ccccc3s2)CC1 735306976 VULVUGYLBQWHHD-UHFFFAOYSA-N 397.931 5.232 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735569736 PGDAHAXZTPNQTO-UHFFFAOYSA-N 387.886 5.299 30 20 GKED CCCCCC[C@](C)(CC)C(=O)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1 742605236 PJCRAMNBTNXRLG-DEOSSOPVSA-N 397.563 5.122 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)c1 746128277 BFMASJOJLUWWDU-UHFFFAOYSA-N 396.805 5.426 30 20 GKED C#Cc1cccc(NC(=S)NCC[C@@H](C)c2cccc(C(F)(F)F)c2)c1 746392470 FSOXUXHTRBWKFB-CQSZACIVSA-N 376.447 5.167 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 747109217 YGVIATFOJFVGJQ-YGRLFVJLSA-N 395.673 5.098 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cnc(-c3cccs3)s2)S1 751511826 BKHQNUNJDPPHJF-DHDCSXOGSA-N 397.550 5.380 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)cc1 753678729 PAHLOXOGQKTZBD-VWLOTQADSA-N 397.453 5.155 30 20 GKED C#CC[C@@H](NC(=O)N1CCC(c2c(C)[nH]c3ccccc23)CC1)c1ccccc1 757059867 XURRMGYZFVBUHM-JOCHJYFZSA-N 385.511 5.130 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cncc(-c3ccccc3)c2)cc1 757875084 NGHWSPWHKNBMAS-UZUQRXQVSA-N 397.478 5.223 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1ccc2ccccc2n1 759188570 WBFRQOYABRHJJP-RDELFYGPSA-N 383.838 5.326 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ncc(-c3ccccc3)s2)S1 770565533 HGCWEFFGRCPNRG-WJDWOHSUSA-N 391.521 5.319 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 776158370 WRLQCCRBWOGJKH-KRWDZBQOSA-N 376.887 5.760 30 20 GKED CC(=O)N1C/C(=C/c2cccc(Oc3ccccc3)c2)C(=O)c2ccccc2C1 778519973 MEADKNMRJZXVNZ-STZFKDTASA-N 383.447 5.107 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@@](C)(C#N)CC(=O)OC(C)(C)C 779901513 KIVOQOPTECAQBZ-OAQYLSRUSA-N 390.549 5.086 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)C[C@H](CC#N)c1ccccc1 795980134 BUAIWEYOWZILML-ICSRJNTNSA-N 392.499 5.076 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)cc1 796749658 ZZLQJMJTPCKUIH-IFXJQAMLSA-N 384.426 5.273 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797572669 FOOPUNZCPZZHID-QGZVFWFLSA-N 396.556 5.615 30 20 GKED C[C@@H]1CCCN(c2ccc(CN[C@H](C)c3ccc(OCC#N)cc3)cc2Cl)C1 800494294 VTVHWYORQCVZON-QZTJIDSGSA-N 397.950 5.329 30 20 GKED N#CCSCCCOC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 805394495 PXPGLHZZBGHXRI-UHFFFAOYSA-N 393.839 5.377 30 20 GKED N#CCCCCCC(=O)OCc1cn(-c2ccccc2)nc1-c1cccs1 805862017 PVJIPRFUCZACIO-UHFFFAOYSA-N 379.485 5.118 30 20 GKED C=CC[C@@H](N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccncc1 808697114 WFBZPLAYSPJRQS-QUCCMNQESA-N 396.332 5.610 30 20 GKED C#CCC(C)(C)c1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 809421501 NYKVXLVJQAJZKU-UHFFFAOYSA-N 387.361 5.244 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@]3(C)CC3(Cl)Cl)n2)cc1 835068678 SNMKJMAJGJVXJS-GUYCJALGSA-N 379.312 5.269 30 20 GKED CC(=NO[C@@H](C)C(=O)N[C@@H](C)c1ccc(Cl)cc1)c1cc2ccccc2o1 852017603 DZFUUOXWSAOQFK-ZFWWWQNUSA-N 384.863 5.093 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)CC(F)(F)F 892606580 IFRGJYBVADPFSQ-CQSZACIVSA-N 391.418 5.227 30 20 GKED C[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CC2)cc1 914557507 HQBGMELNGHNDNZ-WMJRALALSA-N 377.271 5.228 30 20 GKED C=CCN(Cc1ccccc1)C(=O)COc1ccc(C2SCCCS2)cc1 914610844 IAZJLMBGBCDBCZ-UHFFFAOYSA-N 399.581 5.149 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@@H]2c2cc(C)on2)s1 915311366 GAYZYTPYXFVBKX-MRXNPFEDSA-N 391.541 5.107 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354002 SPFYSHKRMMUDDP-HXUWFJFHSA-N 390.874 5.054 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(C(C)C)cc1 916309249 DLDSWWFBLCSCCT-UHFFFAOYSA-N 387.508 5.439 30 20 GKED C=CCn1c(-c2ccco2)nn(CN[C@H](c2ccccc2)C(C)(C)C)c1=S 917432118 JWYXFZICKOSZNT-GOSISDBHSA-N 382.533 5.195 30 20 GKED COc1ccc2cc(/C=C/C(=O)Nc3cccc(OCCCC#N)c3)ccc2c1 917728241 QRKAFOLZDLQDIV-XYOKQWHBSA-N 386.451 5.183 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)c1cc2c(C(F)(F)F)cc(O)nc2o1 918678245 VYMHQDAYIFADAE-GFCCVEGCSA-N 386.414 5.279 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2ccccc2Cl)c1 1776014833 GICHBHWYZAPRFJ-UHFFFAOYSA-N 380.831 5.063 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccc(N(c2ccccc2)c2ccccc2)cc1 1776149276 ARBOBSDYJKOLEB-OAQYLSRUSA-N 386.495 5.665 30 20 GKED C[C@H](Oc1ccc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)cc1)C(=O)O 1776469731 ZMAICBKSKGVVSJ-OHMLCJAVSA-N 397.279 5.119 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1C 1776819003 CXZSUUHNTYHOEF-TWGQIWQCSA-N 382.456 5.165 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCOc4cc(F)ccc4C3=O)s2)c1 1777684281 DCGUSRCRFWJJOS-SDNWHVSQSA-N 394.423 5.301 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)cc2)=C(/S)Nc2cccc(C)c2)cc1 22729000 JAICYJFOZYYGFB-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CSc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 26309259 OONXGOUXFYEPAH-UHFFFAOYSA-N 376.506 5.684 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)oc2c(Cl)cccc12 41556385 PTNMGCACJHNLSS-GFCCVEGCSA-N 378.737 5.299 30 20 GKED COc1c(F)cc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1F 55947625 VPHFIWKTYDTBSM-UHFFFAOYSA-N 396.418 5.249 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1cc(C#N)ccc1OC(C)C 56212714 OGMMDRHIGBUPQJ-UHFFFAOYSA-N 395.459 5.169 30 20 GKED C=CCc1cc(CNC(=O)Nc2ccc(Cl)cc2Cl)cc(OC)c1OC 65353743 RZAANWYAOQMEFX-UHFFFAOYSA-N 395.286 5.061 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 65793021 LDTOCEWVUNKUQW-UHFFFAOYSA-N 386.451 5.097 30 20 GKED CCOc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 66510053 GVONPVDTVGSKFM-LJQANCHMSA-N 376.481 5.018 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1Cc2ccccc2S1 72025333 CCNWERUSHWBPRO-QFIPXVFZSA-N 386.476 5.315 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCOc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 102967408 AOLLHLAHGYCEGF-IRXDYDNUSA-N 394.883 5.206 30 20 GKED C=C1CCN(C(=O)c2sc3cccc(F)c3c2COc2ccccc2)CC1 111074451 IXDMCOSHVUBGTM-UHFFFAOYSA-N 381.472 5.412 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 120354285 UVGGYMJDVJAHSI-AWEZNQCLSA-N 391.393 5.050 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 120862791 PJWJBOGZCVQZGC-IBGZPJMESA-N 392.503 5.146 30 20 GKED Cc1cc(N(C)C)ccc1NC(=O)c1ccccc1Sc1ccccc1C#N 129705193 FPDGHKUKUVKHNP-UHFFFAOYSA-N 387.508 5.336 30 20 GKED CC[C@H](C)OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 152410045 DWZCDBWFICKDBX-GXFFZTMASA-N 383.300 5.108 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nccs1 153036052 UCIRQIXPWFKDET-GOSISDBHSA-N 378.457 5.080 30 20 GKED Cc1ccc(-c2ocnc2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 172997449 KQIQUHYIJYXXNG-HNNXBMFYSA-N 377.469 5.154 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(Cl)s1 175120261 BOQUHPZHOHYDDC-SCZZXKLOSA-N 381.309 5.645 30 20 GKED N#CCCN(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Cc1ccco1 176291624 MRLPQQNMRLVHLT-UHFFFAOYSA-N 391.418 5.338 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc(-c2ccncc2)cs1 176555879 OLQDMCYRLYUQHG-MRXNPFEDSA-N 387.420 5.080 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(N2CCOC2=O)cc1 180220787 GXMCTPSQNWTJQX-SFHVURJKSA-N 397.478 5.033 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2cccc(NC(=O)c3ccc(Cl)cc3)c2)cn1 214917878 XYLCFMRFALVOFR-WDZFZDKYSA-N 393.874 5.266 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2cccc(Br)c2)n1 245431059 MMHSVCLGGRITOY-RRFJBIMHSA-N 389.318 5.009 30 20 GKED C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 246605401 XUOKBWVWEIIHFE-AOIWGVFYSA-N 379.529 5.491 30 20 GKED CC1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)CC1 272557602 SNKIRCUYRXRBJW-UHFFFAOYSA-N 396.537 5.552 30 20 GKED N#CCCN(Cc1ccco1)C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 303083538 FORCEJMKMASMBF-PKNBQFBNSA-N 380.444 5.103 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccccc3CCC(F)(F)F)CC2)cc1 367295290 IWXDMBYFFGNYAV-UHFFFAOYSA-N 399.416 5.374 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2c(F)cccc2Oc2ccccc2)cc1 410035834 ANKRXGGROUVGNB-UHFFFAOYSA-N 392.455 5.362 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(Cl)cc(C(F)(F)F)c2)cc1 427072554 MYSYPPODXPTEIJ-UHFFFAOYSA-N 396.796 5.318 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3cccc(F)c3C#N)C2)nc2ccccc21 428375704 POMWBNAQCWPAPV-GOSISDBHSA-N 376.479 5.008 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 429051742 ISFUZPRIPFZEMW-UHFFFAOYSA-N 377.366 5.265 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc(OC)c1C(C)C 430598317 CKTMETNFAHNIIJ-AWEZNQCLSA-N 386.517 5.071 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCCC(F)(F)C1 433121308 RDXGDNVICWMVCN-LSDHHAIUSA-N 381.492 5.275 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Sc1nc(-c2ccccc2)co1 436259461 KRXFROWILOGNBB-OAHLLOKOSA-N 384.526 5.099 30 20 GKED Cc1cccc([C@H](C)SCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 437437227 DIRNKFUWRMSTPM-SJORKVTESA-N 384.570 5.680 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 438066815 RPLILLDHUMVBOU-UYAOXDASSA-N 395.572 5.732 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 448734610 HCPUYVYTNGBBEQ-GOSISDBHSA-N 392.396 5.205 30 20 GKED CC1(C)CN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC[C@@H]1C(F)(F)F 458812239 CPKQPFGHKYHXKV-SJORKVTESA-N 381.442 5.042 30 20 GKED C[C@@H](Nc1ccc(F)cc1C#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1 462793455 ZJVRWVFMMLVHNF-CQSZACIVSA-N 377.394 5.262 30 20 GKED COc1cccc([C@@H](NCc2ccc(F)c(C#N)c2)c2ccccc2Cl)c1 467763613 JMGHXMZOFVOERW-JOCHJYFZSA-N 380.850 5.239 30 20 GKED COc1cccc([C@H](C)CCCC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 468998415 LIVNQHRBANPWNK-VEXUSMLFSA-N 390.527 5.267 30 20 GKED C=CC[C@H]1N(C(=O)CCc2ncc(-c3ccc(F)cc3F)o2)CCCC1(C)C 470298426 MSXZBMBUENSSKS-LJQANCHMSA-N 388.458 5.146 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)CC(=O)c1cn(CCC#N)c2ccccc12 472437184 XWVKMFPEWKCRCG-INIZCTEOSA-N 379.891 5.084 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474690331 CXQDBLMWABKIJO-YOEHRIQHSA-N 375.299 5.600 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)N(CC)CCC)cc1 476084170 LBAZFDFTHCQFJA-UHFFFAOYSA-N 392.543 5.663 30 20 GKED CC[C@H](N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc(C#N)cc1 479528730 JSOXWMOIZVGVOC-ROUUACIJSA-N 382.813 5.005 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C2CCC2)cc1Cl 480118666 CCUJLANCDDQNNB-IRLDBZIGSA-N 393.918 5.792 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1cccc(OC2CCCC2)c1)c1ccccc1 487515643 PJWYNZUVWPOEGO-XMMPIXPASA-N 390.527 5.492 30 20 GKED C[C@H](c1ccc(F)c(F)c1)[S@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488802642 HIIDZSCXMWXKNH-IWHNICOQSA-N 384.316 5.272 30 20 GKED CC(C)[C@H](NCc1cc(C#N)ccc1Br)c1ccc(F)cc1F 492775072 RLXUKPUSFSLZPB-SFHVURJKSA-N 379.248 5.086 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 494646473 GHCGOKLIWZBYGX-JOCHJYFZSA-N 398.526 5.232 30 20 GKED Cc1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c(Cl)c1 494663929 WXAFSUMQTASJBR-UHFFFAOYSA-N 390.870 5.546 30 20 GKED C=CCCO[C@H](C)C(=O)N(CC)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496453864 YMKYHFDBAGNTMP-XXBNENTESA-N 380.532 5.124 30 20 GKED C[C@H]1CCC[C@H](OCCCCCC(=O)N(Cc2ccc(C#N)cc2)C2CC2)C1 499268729 BCTIZHVVLZITSL-CVDCTZTESA-N 382.548 5.205 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccccc2-c2cccs2)cc1 502338630 WMMQRGVVRBEOMP-UHFFFAOYSA-N 392.484 5.367 30 20 GKED O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 503245709 WEVYIHCWHNNLRA-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503894717 TWTANHAJOJKYJE-HNNXBMFYSA-N 382.916 5.008 30 20 GKED CCCCOCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510004638 JZCUOYAGYFFMCR-FQEVSTJZSA-N 399.922 5.324 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(Br)s3)cc2)c1 518728291 GWLVWMCGEUFCLV-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CC(C)CN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1 524441240 ZEXXUAVCHVCXKZ-UHFFFAOYSA-N 397.906 5.443 30 20 GKED C=CCCCCCN(C)C(=O)N[C@@H](c1ccccc1)c1nc2ccccc2n1C 525318623 QPFWIOIUPFUTBZ-QFIPXVFZSA-N 390.531 5.051 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(OCC3CCCCC3)CC2)c1 525748194 YJSWUKOJXDILID-UHFFFAOYSA-N 386.536 5.235 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1nc2ccccc2n1C(C)C)c1ccccc1 536205847 YMSUQRVHGINERZ-AUSIDOKSSA-N 387.527 5.641 30 20 GKED CC(C)Sc1ccc([C@@H](C)NCC(=O)Nc2cc(Cl)ccc2C#N)cc1 537099056 GRSRCZAUTURIHB-CQSZACIVSA-N 387.936 5.001 30 20 GKED C[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Oc2ccccc2)cc1 538159292 TZOHNALSNSUTOE-KRWDZBQOSA-N 396.450 5.251 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 539215132 ASMBLCTUNACBFC-QGZVFWFLSA-N 395.506 5.306 30 20 GKED C[C@H](NCc1ccc(Oc2ccccc2C(F)(F)F)nc1)c1cccc(C#N)c1 539496343 LLJHPDNJNVDUDZ-HNNXBMFYSA-N 397.400 5.615 30 20 GKED N#Cc1cc(/C=C2/CCn3c2nc2scc(-c4ccccc4)c2c3=O)ccc1F 539958033 AJNRAIRJIDAZPD-YBEGLDIGSA-N 399.450 5.080 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2ccc(F)cc2OCC(F)(F)F)s1 545342192 OXASTXJJKNSSGJ-UHFFFAOYSA-N 388.308 5.163 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)c1cc(C#N)ccc1Cl 560578311 GQPIKDCYBLZMSR-UHFFFAOYSA-N 399.675 5.688 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(C2CCCCC2)no1 564623576 RSUIHTAKJYCNGU-JVPSVYLMSA-N 378.520 5.172 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc([C@@H]4CCOC4)cc3)c2)cc1 565558613 DVWLLZQOJHZBOB-HXUWFJFHSA-N 384.435 5.107 30 20 GKED CCC(=O)Nc1cccc(CNc2c(C#N)cnc3c(Cl)cc(C)cc23)c1 572305394 IHHXDBFTQNYVHE-UHFFFAOYSA-N 378.863 5.029 30 20 GKED CC1(C(=O)N2CCC3(CCCCC3)C2)CCN(c2ccc(Cl)cc2C#N)CC1 577402212 NKVCRTXCUGZZNK-UHFFFAOYSA-N 399.966 5.001 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCSC2)cc1Cl 579040067 FAYMUQDREOHANZ-KXBFYZLASA-N 399.947 5.260 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C 583717369 OSJCZPMXHNMQGL-UHFFFAOYSA-N 386.908 5.116 30 20 GKED Cc1nn(-c2ccccc2Cl)c2sc(C(=O)Nc3ccccc3C#N)cc12 598544410 XLUNUXNXBVJWQO-UHFFFAOYSA-N 392.871 5.173 30 20 GKED CCC(O)(CC)CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 599731444 HGNKQLVZYZLGDI-LJQANCHMSA-N 399.922 5.010 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)c1ccccc1 602113966 SRBNHUQLUIYQHU-KRWDZBQOSA-N 384.435 5.198 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603831075 JDEUNVRKZKJOGE-JOCHJYFZSA-N 398.466 5.423 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(C(C)C)nc2c1c(C)nn2C(C)(C)C 606814719 SGGARGBFXOKHOS-UHFFFAOYSA-N 384.568 5.437 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2cc(F)ccc2F)cc1 609189324 XQEFWUXVYVKJME-UHFFFAOYSA-N 394.446 5.059 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1cnc(-c2ccccc2Cl)s1 609359258 GJJYFHKUULTRGY-UHFFFAOYSA-N 384.892 5.144 30 20 GKED Cc1sc(NC(=O)CCCCOc2cccc(C#N)c2)nc1-c1ccccc1 609496458 YKABDDRUBTYYCF-UHFFFAOYSA-N 391.496 5.178 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2coc(-c3ccccc3)n2)c1 610271194 JVTZVCBOAPPCBT-UHFFFAOYSA-N 395.462 5.082 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c(Cl)cc1F 610735187 WUCJVHNQBFTPHK-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#C[C@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1ccc2ccccc2n1 613292717 RFDAAOUGSPPZNO-QFIPXVFZSA-N 394.499 6.017 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 665609972 YSXMJHMRRGOGGM-BGYRXZFFSA-N 390.487 5.354 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)c[nH]c2c1 728006984 WRZGVSWXCJGIEM-UHFFFAOYSA-N 395.462 5.108 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)c3ccc(C)cc3)n2)cc1 728770199 QQGXYGVXWKWTLW-IBGZPJMESA-N 390.508 5.281 30 20 GKED CCc1ccc(/C=C2/SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)s1 731231368 MGUWNIALTZVENB-OVCLIPMQSA-N 390.942 5.241 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 733083455 JNNNJKRRQOXBDE-DHZHZOJOSA-N 394.452 5.402 30 20 GKED N#Cc1ccc(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)cn1 734314311 IPKOBWUKZGHCDH-UHFFFAOYSA-N 391.839 5.103 30 20 GKED CC[C@@H](NC(=S)N(Cc1ccccc1)c1ccccc1C#N)c1cccs1 734377991 OZTAVIVHUHSPNC-LJQANCHMSA-N 391.565 5.652 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)Cc1cc(Cl)ccc1OCC#N 735309738 KVXLBSKTLKGQMJ-CYBMUJFWSA-N 382.813 5.454 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(Cl)c2)CCCC1)c1ccc2ccccc2n1 744017007 XHZVTLIMDPOLEZ-FQEVSTJZSA-N 388.898 5.868 30 20 GKED CC(=NOCc1csc(-c2ccc(C)o2)n1)c1ccc(NC(=O)C2CC2)cc1 744179299 MJIWLXIDMQRRCD-UHFFFAOYSA-N 395.484 5.001 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(C)c(NC(=O)OC(C)(C)C)c2)s1 744363055 OTRUXNJYTFIWSJ-UHFFFAOYSA-N 385.489 5.090 30 20 GKED CCCCc1ccc(NC(=S)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 745693879 CNHGCTMQYMJOLC-UHFFFAOYSA-N 379.573 5.756 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2)C2CCCCC2)cc1OCCCC#N 747461428 DMKBLXOQLXQHEC-VWLOTQADSA-N 392.543 5.789 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1cccc(Cl)c1 750682398 YJENLSJQPNYZPC-LVMGUKCRSA-N 376.843 5.125 30 20 GKED C[C@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 759439657 AJZYJPZEMILDBR-HZMBPMFUSA-N 391.279 5.247 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)c1nc(-c2ccc(SC(C)(C)C)nc2)no1 762351894 RNUZRFCPWHMWEI-ZDUSSCGKSA-N 380.473 5.034 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(SC(F)F)c3)CC2)cc1 767857614 LFLPKLFVWXYWNJ-UHFFFAOYSA-N 385.439 5.194 30 20 GKED C=CC[C@H](NC(=O)NCc1c(OC(C)C)ccc2ccccc12)c1ccncc1 768363624 PIEQRZYWIDEHBP-QFIPXVFZSA-N 389.499 5.139 30 20 GKED C#CCN(C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C)C1CCCC1 776298908 WDPMVIRDJKSOAY-UHFFFAOYSA-N 390.487 5.049 30 20 GKED CC1(C)CC[C@H]2C[C@H](NC(=O)Nc3cccc(OCC#N)c3)c3cccc1c32 776467594 PKFYKXZVAYZXBT-YWZLYKJASA-N 375.472 5.010 30 20 GKED Cc1cc(CNc2ncc(Cc3ccc(C#N)cc3C(F)(F)F)s2)sn1 789749210 FDXDEUVOPLOQKF-UHFFFAOYSA-N 394.447 5.001 30 20 GKED COc1ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)cc1OCc1ccncc1 795810094 GRXXDXIDCSPVTH-HSZRJFAPSA-N 399.494 5.420 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CO[C@@H]2CCCc3ccccc32)cc1 797433479 DZUMESOFQHHUCC-LOSJGSFVSA-N 396.490 5.375 30 20 GKED CC(C)OCc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)ccc1O 811592264 DKOYLRNUILDZJS-UHFFFAOYSA-N 386.451 5.108 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)c2cc1C 811776877 ABEBIXIBZNWZMC-UHFFFAOYSA-N 397.434 5.081 30 20 GKED C[C@@H]1C[C@@H](CN[C@H](CCCC#N)c2ccccc2)CCN1C(=O)OC(C)(C)C 824434984 VLOGRZKVNWLPNP-SVFBPWRDSA-N 385.552 5.047 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2)n1 915644801 SMAFGQXOIJKRMU-DEOSSOPVSA-N 392.462 5.089 30 20 GKED COc1cc([C@@H](C)/N=C/c2cc(Cl)ccc2O)ccc1OCc1ccncc1 915981409 RTBDOZAXHALXNL-VSRRSJTHSA-N 396.874 5.208 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccc2ccccc2n1 916848895 KHBKIRDWBULPHU-MRXNPFEDSA-N 383.278 5.741 30 20 GKED Brc1ccc(C=NOCc2csc(-c3cccs3)n2)cc1 920398770 BTIMCSKILFGCOV-UHFFFAOYSA-N 379.304 5.185 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3)s2)cc1CC(=O)O 1776131784 IRHMDBZWLMOSRL-VURMDHGXSA-N 396.439 5.086 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3)s2)c1)C(=O)O 1776470954 RMGJJWFJTDJPOX-HBIYDYFMSA-N 378.449 5.163 30 20 GKED CCCCCCCOc1ccc(CN[C@H](c2ccccc2)[C@@H](C)C(=O)O)cc1 1776786499 MTCAASVLKSIUJW-XXBNENTESA-N 383.532 5.587 30 20 GKED Cc1nn(C2CCCC2)cc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777554812 UTJLBNAIQHJAGL-ZHACJKMWSA-N 390.439 5.161 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)/C=C/C4CCCCC4)CCC3)cc2)C1 1785808043 JCBCNSOSBIJLGB-MDWZMJQESA-N 392.543 5.223 30 20 GKED C=CCCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC(C)(C)C)CC1 1823750666 RHPNZQYWXBQUSB-HXUWFJFHSA-N 390.612 5.035 30 20 GKED Cc1cccc(-c2nnc(SC[C@H](C#N)CCC#N)n2[C@@H]2CCCC[C@H]2C)c1 66237891 MBDKJXWEFFQGNH-WSTZPKSXSA-N 393.560 5.540 30 20 GKED COc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66954010 YYFPQXKECCABIB-OXQOHEQNSA-N 395.528 5.458 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(O[C@@H](C)C#N)cc3)s2)cc1 107718277 TVTRGPHVWQVFTG-IRXDYDNUSA-N 391.540 5.569 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3sc(CC)cc3C#N)cs2)cc1 108397599 DMKDGKLWTTVLIH-UHFFFAOYSA-N 381.526 5.049 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 109028515 RXVVPECTQOHKQU-OXQOHEQNSA-N 395.528 5.458 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 150968591 CNVXHCOBAOAVDZ-WMZOPIPTSA-N 397.519 5.174 30 20 GKED CC(C)(C)[C@@H](NC(=O)CNc1ccccc1SCCC#N)c1cccs1 153924104 OJMGWEMUDVHVPL-IBGZPJMESA-N 387.574 5.069 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1cc(F)ccc1F 170992195 WIYNLBDIJUOOPB-CYBMUJFWSA-N 392.496 5.088 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccc(C)s3)n2)cc1 176026031 DDHXSGHLQPODFZ-GOSISDBHSA-N 396.537 5.388 30 20 GKED Cc1ccc(NCc2nnc(-c3ccc(C#N)cc3)o2)c(OCc2ccccc2)c1 178022414 IGYJBGVDTZEAFY-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccc(F)c(F)c1 187783805 KLNPQIUBIZEIQI-FOIQADDNSA-N 383.442 5.600 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CNC(=O)OC(C)(C)C)o1 189889903 FEBMOWNWAIDVBD-UHFFFAOYSA-N 398.503 5.409 30 20 GKED C[C@@H]1C(=O)CC[C@@H](C(O)=Nc2nnc([C@H]3CCCc4ccccc43)s2)C1(C)C 330319396 DEUVRIPVHVEKIC-COXVUDFISA-N 397.544 5.236 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccnc3)cc2)cc1 371461755 CALGYWLYFKJZTQ-QFIPXVFZSA-N 384.439 5.115 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 376428286 QNQWEHUNDDYPJM-UHFFFAOYSA-N 384.439 5.161 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)c1cccc(C(F)(F)F)c1F 410390763 JBJWXRPFKVRXNA-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)[C@H]1c1ccc(C(F)(F)F)cc1 412208221 WMGNJJPOQKMQPQ-CCARFGRDSA-N 398.428 5.290 30 20 GKED CC(C)c1ccc(CSc2nnc(S[C@H]3CC[C@@H](C#N)C3)s2)cc1 430141061 PUUBLDCSVPHWGV-ZBFHGGJFSA-N 375.588 5.738 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 433117798 OQQJIZXIBGNDFM-PXNSSMCTSA-N 393.556 5.522 30 20 GKED C=CCC[C@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 441846807 UPBCLZYGKPQUMO-INIZCTEOSA-N 378.350 5.051 30 20 GKED N#Cc1nc(Sc2nnc(-c3cccc4ccccc34)o2)ccc1C(F)(F)F 443511390 QFMPXYCUOOWCKK-UHFFFAOYSA-N 398.369 5.326 30 20 GKED C=CCn1c(SCc2cccc(Cl)c2Cl)nnc1-c1ccncc1 446053254 KXFJULUMGSEGCQ-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(SC)cc1OC 446403925 AZKNHEHIBJSXTR-UHFFFAOYSA-N 382.938 5.352 30 20 GKED C[C@H](c1cccc(C#N)c1)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 463050136 AWQGOJLIVJSSCL-BDJLRTHQSA-N 375.325 5.171 30 20 GKED C[C@H](C(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 463722625 BHCDVMGJMRCFOE-MGPUTAFESA-N 386.417 5.434 30 20 GKED N#C[C@@H](NC(=O)c1cscc1-c1ccccc1)c1cccc(Br)c1 464400513 BXNRKIFUHVDZEA-GOSISDBHSA-N 397.297 5.172 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 465108116 FQVMUZVZAGKKSM-UHFFFAOYSA-N 379.275 5.592 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3sc(CC4CC4)nc3C)n2)cc1 475021637 BOQGDFWIFUSKQL-MRXNPFEDSA-N 393.537 5.326 30 20 GKED C[C@H](CC#N)NC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 480812123 OXXQIHDBTFRFSS-LLVKDONJSA-N 381.329 5.060 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)c1noc(C)n1 483114860 FINSTKUKLLDCKU-IBGZPJMESA-N 396.878 5.061 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F 484045782 UJBPKMWPMJKYAP-RTBURBONSA-N 395.469 5.095 30 20 GKED Cc1cc(Br)cc(NCc2cn(CCC#N)nc2-c2ccccc2)c1 485727302 JQFPHPJXUAAHSR-UHFFFAOYSA-N 395.304 5.147 30 20 GKED Cc1cscc1CNc1cc(C#N)c([N+](=O)[O-])c(NCc2cscc2C)c1 486002212 JJPDNUFRCHVRBN-UHFFFAOYSA-N 398.513 5.431 30 20 GKED N#CCCC[C@H](NC(=O)Cc1nc(-c2ccc(F)cc2)cs1)c1ccccc1 487202587 AZOIGUDNVWFBFH-IBGZPJMESA-N 393.487 5.043 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 488307096 JXVMTGHDAGVNRE-NLWGTHIKSA-N 393.556 5.657 30 20 GKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)Nc1ccc(CC#N)cc1 499238396 ZOIASJUHCVUDBX-ZIAGYGMSSA-N 375.394 5.085 30 20 GKED CC(C)Oc1ccc(CC[C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 510605083 IVPSAIPZIMRGJW-SFHVURJKSA-N 393.531 5.418 30 20 GKED N#Cc1c(Br)cccc1N[C@H](c1cccc(F)c1)c1ccccn1 514638482 GWRXNWIOKLTFHF-LJQANCHMSA-N 382.236 5.056 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518140227 UEXWPPRKMSAAHH-ZFWWWQNUSA-N 388.920 5.306 30 20 GKED N#Cc1cccc(OCCCCC(=O)NCC(c2ccccc2)c2ccccc2)c1 521106907 VHRPOJZCXWXAOG-UHFFFAOYSA-N 398.506 5.056 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)c1ccccc1F 521748309 SABBKLFFDJOUOO-OAHLLOKOSA-N 385.508 5.177 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1cccc(COCc2ccccc2)c1 522416463 HGLVLJSQMZRLHW-UHFFFAOYSA-N 397.400 5.301 30 20 GKED COc1cccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c1 522571907 GQTTYBSNTJIVDT-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C[C@@H](NC(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1)c1ccc(C#N)cc1 522786108 VLISWXRXKFXLLZ-CQSZACIVSA-N 376.460 5.171 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCOc2c(Cl)cccc21 537270927 QVWFJLAFKYAJMP-HXUWFJFHSA-N 397.906 5.047 30 20 GKED C[C@H](NCc1ccc(C#N)cc1OC(F)F)c1ccc(-c2ccncc2)cc1 539342423 NMHRLUPCWUIQRT-HNNXBMFYSA-N 379.410 5.072 30 20 GKED N#Cc1ccsc1NC(=O)CCN[C@H](c1cccc(Cl)c1)C1CCCC1 540423093 IUCGEVLCEDIRRF-IBGZPJMESA-N 387.936 5.123 30 20 GKED C[C@@H]1CCCC[C@@H]1OCc1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 544336506 POQQLMXSNPNTQW-NOUVTRLXSA-N 390.487 5.204 30 20 GKED C[C@@H](Oc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cn1)c1ccccc1 554519216 LVCGYEWJCRIYEU-AUSIDOKSSA-N 399.494 5.387 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc(Cl)c1Br 560221092 GYQBKPOJCBINEC-OAHLLOKOSA-N 399.675 5.449 30 20 GKED COc1ccccc1-c1nnc(SCCC(C)(C)C#N)n1-c1ccc(C)cc1 561441418 LLXPJCBGEANAFS-UHFFFAOYSA-N 392.528 5.283 30 20 GKED N#Cc1ccc(CNc2cccc(-c3noc(C4CC4)n3)c2)c(C(F)(F)F)c1 564410453 OLXQHPOPYUSELN-UHFFFAOYSA-N 384.361 5.117 30 20 GKED CC(C)(CC#N)CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 565238414 PDEYXYDVAXATHY-UHFFFAOYSA-N 380.492 5.164 30 20 GKED Cc1ccc(OCc2nc(CN[C@@H]3CCCc4cc(C#N)ccc43)cs2)cc1 571745801 JANBWJNAPMITNK-JOCHJYFZSA-N 389.524 5.069 30 20 GKED N#C[C@]1(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)CC12CCCC2 577933164 QJTRGDGHGYCTGC-QFIPXVFZSA-N 393.874 5.005 30 20 GKED CN(Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H](CCCC#N)c1ccccc1 590942424 AJCJJEIHHYMWRQ-IBGZPJMESA-N 390.314 5.570 30 20 GKED C=CC1CCN(C(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)CC1 599677251 VUFZNZRITSURAU-UHFFFAOYSA-N 377.271 5.219 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)C1CC1 608995018 WSHAWDWFKQXJOU-UHFFFAOYSA-N 398.466 5.251 30 20 GKED C[C@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(C#N)c1 610343400 FTFWAJHXUZAJST-NWDGAFQWSA-N 386.339 6.008 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCc1ccc(C#N)cc1F 610402581 SWVQUEWUFQNYPB-KRWDZBQOSA-N 387.458 5.267 30 20 GKED Cc1cc2ccc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cn2c1 619877316 LPPYLGWZTCSHKY-UHFFFAOYSA-N 395.462 5.145 30 20 GKED C=CCn1c(S[C@H](C)c2ccncc2)nnc1-c1ccc(C(C)(C)C)cc1 619950468 JGELKBJEZZTILL-MRXNPFEDSA-N 378.545 5.677 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(F)cc3F)n2)CCCC1 639320256 IARAEDHAASPXLP-UHFFFAOYSA-N 391.487 5.084 30 20 GKED Cc1ncc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c(C)n1 647323280 WETMSUJAEGHXFH-SNVBAGLBSA-N 395.322 5.556 30 20 GKED O=C(NC[C@@H]1CCCC(F)(F)C1)NC(CCC(F)(F)F)CCC(F)(F)F 661125462 RSCWXONBRZNKDO-SNVBAGLBSA-N 398.338 5.165 30 20 GKED CC(C)Cn1ncc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c1-c1ccccc1 683221350 MVBLVARPQIHPJN-HXUWFJFHSA-N 394.478 5.244 30 20 GKED FC(F)(F)c1cscc1CNC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 685612721 YLCRPHFLXNCVTO-IUCAKERBSA-N 399.322 5.766 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2ccc(OC)c(NC(C)=O)c2)cc1 726430084 XEQFDHMTERPDBK-UKTHLTGXSA-N 381.472 5.119 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3cc(OC)c(OC)cc3C)cs2)c1 731318810 LBNZFTLFZVWYFL-HJWRWDBZSA-N 395.480 5.040 30 20 GKED C[C@@H](Cc1ccccc1Cl)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 731400912 XSWBSCGALYUAHK-GJZGRUSLSA-N 387.936 5.487 30 20 GKED N#C[C@H](NC(=O)c1ccc(SC(F)F)cc1)c1cccc(C(F)(F)F)c1 731645184 HAYMVQXQQLTDTF-AWEZNQCLSA-N 386.345 5.015 30 20 GKED N#Cc1cccc(OCCCCC(=O)OCc2csc(-c3cccs3)n2)c1 732398811 OBYXWCCUCJVEHC-UHFFFAOYSA-N 398.509 5.036 30 20 GKED C=C(C)CNC(=S)N(C)Cc1cc(C)c(OCc2ccccc2C)c(C)c1 734381955 XUEXKRINHDRERN-UHFFFAOYSA-N 382.573 5.073 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 734662383 YTJQKEDQFPNFSD-VQIMIIECSA-N 392.528 5.191 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1ccncc1 734667511 GUFHYYQKLOLDGG-NHCUHLMSSA-N 383.923 5.583 30 20 GKED FC(F)(F)COc1ccccc1CON=Cc1ccccc1C(F)(F)F 742461812 DZAYNJGZRMWUDD-UHFFFAOYSA-N 377.284 5.197 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)c2cccc(Cl)c2)cc1 744029807 WNSJKYACXWNVMI-MGPUTAFESA-N 382.891 5.134 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)O[C@@H](C)C(C)(C)C#N 753620294 BYHXKHQVXZHDOB-NSHDSACASA-N 382.407 5.232 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3c(C)noc3C)n2)cc1 754531325 JRBGOLCZCKTFPP-GUYCJALGSA-N 379.485 5.093 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 761046864 GPXAZGLUNXBZLG-UYAOXDASSA-N 382.529 5.423 30 20 GKED N#Cc1c(F)ccc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3o2)c1Cl 761477803 AGEFKMIHGXJMMJ-VZUCSPMQSA-N 378.146 5.137 30 20 GKED C=CC[C@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccncc1 766023641 VXZWOUBZUGKBRQ-DVECYGJZSA-N 398.510 5.276 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F)c1ccncc1 766800812 REJCWVCAVWNKAA-VCBZYWHSSA-N 391.437 5.209 30 20 GKED CCOC(=O)c1ccc(-c2ccc(CNc3ccccc3O[C@H](C)C#N)o2)cc1 775974168 XFESFBWUWBFFRW-MRXNPFEDSA-N 390.439 5.026 30 20 GKED CC(C)[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1cc2ccccc2o1 777117201 KRTGURRGHPQDPF-DEOSSOPVSA-N 389.499 5.075 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCCc1ccsc1 783422623 VMYKFWPZEWKVKF-UHFFFAOYSA-N 398.475 5.734 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccccc2Cl)CC1)c1nc2cc(F)ccc2s1 784506422 NPDRUUQTKDTSLH-CQSZACIVSA-N 384.863 5.288 30 20 GKED C[C@@H](NC(=O)C12CC(C(F)(F)F)(C1)C2)c1ccc(-c2cccc(C#N)c2)cc1 787254961 ORUQEFDSNZVQKL-OZJRSANCSA-N 384.401 5.135 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(Cl)c(Cl)c1Cl 789070976 OCCGNHPIJNDWQP-UHFFFAOYSA-N 380.662 5.324 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1nc(Br)ccc1F 794973720 XXYMADOBTZPFLO-VURMDHGXSA-N 389.249 5.003 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 812242999 AJWYHCWGAZSGNK-VOTSOKGWSA-N 385.470 5.194 30 20 GKED COc1ccc(-c2nc(C)c(C(C)=NNc3nccnc3C3CCC3)s2)cc1 814931841 HBNANJCGLHPXOI-UHFFFAOYSA-N 393.516 5.021 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 824179003 NLAGBRYDKMMKBF-HNNXBMFYSA-N 382.895 5.037 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2SC(F)F)cc1 915087175 RCFDKYDRYMQMNC-SFHVURJKSA-N 395.434 5.304 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1scnc1C 915110486 VZJVKYRHJIBOCT-UHFFFAOYSA-N 379.514 5.268 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1 915179443 DVXGMMPLZBINCL-QGZVFWFLSA-N 382.250 5.296 30 20 GKED CCCCCCCC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1 917804666 QVMYATRWRTYZFI-OAQYLSRUSA-N 379.504 5.029 30 20 GKED CC(C)Oc1ccc(N[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 917936494 XPPRBOMJYNXSMM-HNNXBMFYSA-N 397.544 5.115 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cs1 1776380560 XSFSEYODUAMUEW-XGICHPGQSA-N 377.465 5.528 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CCc2ccccc2)C(=O)O)c1 1776787297 NQNYSBULWBTFLR-HSZRJFAPSA-N 383.532 5.211 30 20 GKED CCCCCCCOc1cccc(/C=C\c2nc3c(C(=O)O)cccc3o2)c1 1776789182 TYMVGRJJPQILEJ-YPKPFQOOSA-N 379.456 6.046 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)cc1 1776806033 WQXJVABSYFKUOX-BENRWUELSA-N 387.273 5.386 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2F)cc1 1777472319 UJTWIMXUGLEOJS-KAMYIIQDSA-N 390.410 5.307 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1ccc(F)cc1 6094322 NOUXVABHCRNEDG-UHFFFAOYSA-N 382.489 5.172 30 20 GKED COc1ccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(F)c1 20899851 DCVXUTZFVPSXHP-UHFFFAOYSA-N 381.247 5.124 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2cccc(OC3CCCC3)c2)c1C#N 29360888 CUQIGZHMSJIYHH-UHFFFAOYSA-N 393.512 5.126 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(F)cc3)n2)nnc1-c1ccco1 29991134 QLTXOPKGFOGBBZ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 43714132 DSDQMRTXOATVJV-QFIPXVFZSA-N 389.886 5.143 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Br)cc2Cl)c1 55570607 LIPQSTFENCRGEX-UHFFFAOYSA-N 393.668 5.037 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3[N+](=O)[O-])cc2Cl)cc1 56036866 NKENAWJWLBVTDK-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#CCCCOc1cccc(NC(=O)CCSc2nc3ccccc3s2)c1 58535015 YVYSOYMFPNXFHP-UHFFFAOYSA-N 397.525 5.100 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(OC(F)F)cc2)ccc1SC(F)F 63874783 RBOQZZYGDMLJOG-XBXARRHUSA-N 386.366 5.507 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3nnc(C)o3)n2)o1 113778818 XDZLMWZXLZDRQH-SECBINFHSA-N 394.378 5.085 30 20 GKED N#Cc1ccsc1NC(=O)CCN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 117437490 PCRIVVDNNWQDSH-MRXNPFEDSA-N 394.327 5.092 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2)C2CCCC2)cc1OCCCC#N 147228560 GWXHNEZJIVEJDB-DEOSSOPVSA-N 378.516 5.399 30 20 GKED CC(C)C[C@@H](C)N(C(=O)c1ccccc1OCC#N)c1ccc2[nH]ccc2c1 170707287 MUEVSXQGBXRXTP-QGZVFWFLSA-N 375.472 5.152 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@H](CCc3ccccc3)c3ccccc3)o2)cc1 180377344 GFTVWCZXSSNTCL-HSZRJFAPSA-N 394.478 5.072 30 20 GKED Cc1cccc(-n2c(SCCCCC#N)nnc2-c2c[nH]c3ccccc23)c1 195556454 ZSVFASRAUBIJNV-UHFFFAOYSA-N 387.512 5.510 30 20 GKED Cc1nc(NC(=O)C23CC4C[C@](C)(C2)C[C@@](C)(C4)C3)sc1SCC#N 195627484 NGLIUKNRSURUOI-DFDFAMMDSA-N 375.563 5.002 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccnc(Oc3ccccc3Cl)c2)cc1 303693348 MQVKXRGJJYRQAR-UHFFFAOYSA-N 395.871 5.130 30 20 GKED Cc1ccc(Cc2cnc(N=C(O)[C@H]3CCC(=O)[C@@H](C)C3)s2)cc1Cl 328915477 QUHOOGURUFGKRO-JSGCOSHPSA-N 376.909 5.289 30 20 GKED CCOc1c(Cl)cc(N=C(O)N2CCC(OCC(C)C)CC2)cc1Cl 331009418 UYLVIRPHWWHMKH-UHFFFAOYSA-N 389.323 5.075 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@H]3C)c1C1CC1 410973247 IANQFJYSZINIRI-CHWSQXEVSA-N 382.533 5.213 30 20 GKED N#CCSc1cccc(C(=O)N2CC=C(c3cccc4ccccc34)CC2)c1 430730183 QQGRRZRTSLRLGD-UHFFFAOYSA-N 384.504 5.385 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccnc(Oc2ccccc2)c1)c1ccccc1 432956679 VQLHBJASODOISM-OAQYLSRUSA-N 386.455 5.431 30 20 GKED Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 438071481 JWNSHHIJHWVJIS-SFHVURJKSA-N 395.572 5.688 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(F)(c3ccc(Cl)cc3)CC2)c(Cl)c1 439434235 DJZGTQSZCSYXTE-UHFFFAOYSA-N 392.261 5.358 30 20 GKED CCSCc1ccccc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 448343997 CZEVSAJMZCQSJH-INIZCTEOSA-N 379.312 5.241 30 20 GKED N#CCCn1cc(C(=O)CSC2CCC(C(F)(F)F)CC2)c2ccccc21 451034235 BZHMZBBAPYQRDV-UHFFFAOYSA-N 394.462 5.592 30 20 GKED C[C@H](c1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1)C(F)(F)F 453797173 ZVTRFMZLDNZDTM-QMTHXVAHSA-N 386.295 5.256 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 458806398 WDNAZERVNWHGDE-PZJWPPBQSA-N 381.907 5.274 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)cc1 458849974 TYOODEUBOLPKSP-PMOQBDJRSA-N 375.516 5.318 30 20 GKED CC(C)c1cnc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 461270895 RNEYYGWDYOIZHB-UHFFFAOYSA-N 393.537 5.683 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3ccoc3C(F)(F)F)c2C#N)C1 463146240 NLPNXEAFZKCAAB-JTQLQIEISA-N 396.434 5.635 30 20 GKED Cc1cccc(NC(=O)CNc2ccc(Oc3ccccc3C#N)c(F)c2)c1C 463221158 GILBITYCJLFRGZ-UHFFFAOYSA-N 389.430 5.157 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1)c1ccc(C#N)cc1 463503005 FHKOBYHTFVMANE-VQTJNVASSA-N 383.495 5.592 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 463776307 PNXXDQLBTLXSQB-SJKOYZFVSA-N 379.262 5.082 30 20 GKED Cc1cc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c2cccnc2c1C 464453440 AWWHUTWKGKAYCA-UHFFFAOYSA-N 397.434 5.148 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C(C)(C)c1ccccc1 469155289 UVCJEHVXIHWZGW-SFHVURJKSA-N 375.516 5.048 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccccc1 474895569 MZMCCFZJUDXFSV-AVRDEDQJSA-N 394.927 5.695 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1)c1ccccc1 475472485 PKOYMYZPYQXLGX-SFHVURJKSA-N 383.495 5.913 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCOc2c(Cl)cccc21 475555858 ZDFWPOJGHXJERK-IBGZPJMESA-N 384.907 5.837 30 20 GKED COc1ccc(C)cc1-c1csc(NC(=O)c2ccc(C(C)(C)C#N)cc2)n1 475760987 HRTLAUWDWJVCBI-UHFFFAOYSA-N 391.496 5.181 30 20 GKED CC(C)CO[C@@H](C)c1noc(COc2ccc(Oc3ccc(C#N)cc3)cc2)n1 480324027 CJLLLDOSGRZMPS-INIZCTEOSA-N 393.443 5.046 30 20 GKED CCN(C(=O)c1cccc(C#N)c1)[C@H](c1cccnc1)c1csc2ccccc12 481025032 YZYXOYZUIZHTAI-HSZRJFAPSA-N 397.503 5.420 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483228534 NDRRRJHHZJABCW-GCJKJVERSA-N 379.463 5.330 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1 485460241 CMOVRFQHKDJIJF-SIKLNZKXSA-N 381.541 5.171 30 20 GKED C[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(OCc2ccc(F)cc2)cc1 492448462 SMUHLYVHKBEXQP-QGZVFWFLSA-N 397.494 5.095 30 20 GKED C[C@H](NC(=O)c1cc(O)ccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 498945310 AEPIHIRVBHXXCT-AWEZNQCLSA-N 376.843 5.075 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCCCCO[C@@H]1CCC[C@H](C)C1 499297367 YGACTBNNUKUJHM-NZQKXSOJSA-N 384.564 5.451 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 499864886 UKAXTZGMRCDTKV-SJCJKPOMSA-N 380.797 5.233 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Nc3cccc4[nH]ccc34)c2)cc1 502315740 HUPFJLLQXWRVCC-UHFFFAOYSA-N 396.450 5.457 30 20 GKED N#C[C@@H](NC(=O)c1cccc(F)c1Cl)c1ccc(OCc2ccccc2)cc1 505338681 QFJHXZUBBFWFMD-HXUWFJFHSA-N 394.833 5.053 30 20 GKED CCC(CC)N(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 511281063 KLZLAEDKSUTXDL-FYYLOGMGSA-N 389.543 5.564 30 20 GKED C[C@H](CC#N)NC(=O)c1sc(-c2ccccc2)cc1OCc1ccccc1 512025668 PUXUSGSSYIETCQ-MRXNPFEDSA-N 376.481 5.026 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCC#Cc1cccc(F)c1 512156404 NWDMHDYDIOUCAS-SFHVURJKSA-N 392.499 5.212 30 20 GKED Cc1ccc(-c2nc(C(=O)N(Cc3ccco3)c3ccccc3C#N)cs2)o1 512301273 ITWPSZDTQHNAOI-UHFFFAOYSA-N 389.436 5.023 30 20 GKED CN(C(=O)NCC(C)(C)CCC#N)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 513113848 STKZDMRYKDALNR-ROUUACIJSA-N 395.469 5.313 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OC(F)F)c2ncccc12 518170242 SFMCBVNBFSHOIT-UHFFFAOYSA-N 389.427 5.118 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc2ccccc12 518389749 CENGCQGCCNSFFC-QGZVFWFLSA-N 393.446 5.390 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc2c(ccc3ccccc32)[nH]1 520827446 CWNWHNOGWRQJOC-OAHLLOKOSA-N 385.492 5.825 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cn(C(C)(C)C)nc1-c1ccc(F)cc1F 530593988 XLLOVSONCSBKPV-UHFFFAOYSA-N 394.425 5.016 30 20 GKED N#Cc1csc(C(=O)N2CCC(CCc3cccc(C(F)(F)F)c3)CC2)c1 530978714 VUKZRIZJLQUVJY-UHFFFAOYSA-N 392.446 5.124 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H]1CCCC[C@@H]1C(C)(C)C 533512426 LDVYQGADUVWWDN-SQNIBIBYSA-N 387.593 5.214 30 20 GKED CCSc1ccc([C@H](C)NCC(=O)N(CCC#N)c2cccc(C)c2C)cc1 537098288 AHKHPFOICJZXPU-IBGZPJMESA-N 395.572 5.013 30 20 GKED C=CCCOCCCCC(=O)N1CCc2sccc2[C@H]1c1cccs1 539366168 BROFKNHGDFQVRV-FQEVSTJZSA-N 375.559 5.047 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c(-c2ccccc2)s1 541723532 KBIFBCHBULGEAX-CQSZACIVSA-N 387.386 5.022 30 20 GKED Cc1sc([C@H](C)NCc2cccc(C#N)c2F)nc1-c1ccc(Cl)cc1 542575873 SZUGLRIJCNYECI-LBPRGKRZSA-N 385.895 5.634 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)ccc1Oc1cccc(Cl)c1)c1ccncn1 545447345 MQFQFHYDBGPOBR-MRXNPFEDSA-N 384.222 5.066 30 20 GKED COC(=O)c1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)c1 548423064 SNUMIWLTIMTSMT-MRXNPFEDSA-N 388.442 5.002 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1ncc(-c2ccc(F)cc2)o1 548611827 JAABNOSWDPGNQX-UHFFFAOYSA-N 379.338 5.058 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 554442688 OGCZDNZFLWBHKN-MBOZVWFJSA-N 379.529 5.696 30 20 GKED Cc1sc(C2(N[C@@H](C)c3cccc(C#N)c3)CCC2)nc1-c1ccccc1F 555773370 SRYUPHLTUNMQJH-HNNXBMFYSA-N 391.515 5.859 30 20 GKED N#Cc1cccc(CN(Cc2cccc(C(F)(F)F)c2)Cc2ccccn2)c1 575219068 SJENRNZOKPRWIV-UHFFFAOYSA-N 381.401 5.174 30 20 GKED O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 581036117 UTHSLTBEWBTMBQ-UHFFFAOYSA-N 385.666 5.769 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc(C(C)(C)C)n3)n2)cc1 588348897 GCFJEIYKZQBGGK-AWEZNQCLSA-N 397.525 5.063 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 592974424 WPIPLDUNVLWBEK-NSHDSACASA-N 399.497 5.419 30 20 GKED Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1N[C@H](C)c1cccc(C#N)c1 600847262 BERWZSLQDOXPDZ-ZIFCJYIRSA-N 375.516 5.158 30 20 GKED COC(=O)CCSc1cc(Cl)ccc1N[C@@H](C)c1ccc(C#N)cc1F 600854418 OULJPNCDWLVKFQ-LBPRGKRZSA-N 392.883 5.179 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccccc3Cl)cc2Cl)c1 609063006 OUIQNCPXPSDZFN-UHFFFAOYSA-N 397.261 5.696 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCSc1ccc(Cl)cc1 609376624 FOXZPARCQCSPEF-AWEZNQCLSA-N 390.961 5.713 30 20 GKED CCCN(CC)Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609382480 GUKXWKIVMRUIEY-GOSISDBHSA-N 395.572 5.423 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2c(F)cccc2Cl)c1 609433354 VNFXINFNLAZOHD-UHFFFAOYSA-N 380.850 5.220 30 20 GKED CN(Cc1cccs1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723395 NRRLMDCHNYEJCU-UHFFFAOYSA-N 382.872 5.338 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OC2CCCC2)c(Cl)c1)c1cccc(C#N)c1 610322192 SEKLAVDRJAKMJY-CQSZACIVSA-N 383.879 5.416 30 20 GKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 611391180 YQYOOLDDASGDMP-CJAUYULYSA-N 383.495 5.260 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3c(-c4ccccc4)noc3C)n2)cc1 612894662 FFQLUXRZXKJNLW-SFHVURJKSA-N 399.475 5.572 30 20 GKED N#C[C@@H](C(=O)c1cccc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 620304172 GHDOZFUYFCKPKN-INIZCTEOSA-N 390.414 5.732 30 20 GKED C[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cc2n(n1)CCC2 647323436 IXYUMPMEPRKCDF-SNVBAGLBSA-N 395.322 5.292 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 674461360 XKWGXNBZQCTPEO-ZHAHWJHGSA-N 377.275 5.022 30 20 GKED C=CCNC(=O)c1ccc(NC(=S)Nc2c(Cl)ccc(C)c2Cl)cc1 728445319 WXMPRKYOJWUQSS-UHFFFAOYSA-N 394.327 5.027 30 20 GKED N#CCCSc1ccccc1NC(=S)NCc1cccc(C(F)(F)F)c1 730952792 DJBKVMGHDGSLRX-UHFFFAOYSA-N 395.475 5.198 30 20 GKED N#CCOc1ccc(Cl)cc1COc1ccc(NC(=O)C2CCCCC2)cc1 735303341 QGYLQPXGMYWAEL-UHFFFAOYSA-N 398.890 5.340 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccccc2Cl)cc1 743294567 OTKVNYFWUILWSW-OAQYLSRUSA-N 389.886 5.360 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@H](Cc3ccccc3)c3ccccc3)[nH]c12 744161633 VYJXHOXNAGLQFP-VXKWHMMOSA-N 393.490 5.464 30 20 GKED CCOc1ccc(NCc2cccc(OCc3ccccc3C#N)c2)cc1OC 746052889 BHKXUWZMQKZVMZ-UHFFFAOYSA-N 388.467 5.157 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ncc(C(C)(C)C)o1 747815058 AHSFPAMFVRVMJE-OAHLLOKOSA-N 393.462 5.735 30 20 GKED N#C[C@H](C(=O)CCCc1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 762040500 PYMIXPZCUVACOJ-CQSZACIVSA-N 390.842 5.427 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Br)ncc2F)c2ccccc12 762426467 PNRYBKZJLHMZOR-VURMDHGXSA-N 386.220 5.041 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCO1 763931910 RULUYTOGQWFPNE-FSSWDIPSSA-N 391.515 5.057 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2sccc2SC(F)F)cc1 768161239 UTXBYSNGKDGSNB-CYBMUJFWSA-N 380.485 5.355 30 20 GKED CCc1noc(C)c1C(C)=NNc1ncnc2sc(-c3ccccc3)cc12 769798131 OMYYTMFYDIAVPO-UHFFFAOYSA-N 377.473 5.053 30 20 GKED N#C[C@H](C(=O)c1ccccc1NCc1ccccc1)c1ccc2ccccc2n1 776074685 MODRFOKMWDRAIF-NRFANRHFSA-N 377.447 5.337 30 20 GKED CC(Cl)(Cl)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 777304321 QLLWHJMTJZPOJQ-SECBINFHSA-N 394.110 5.487 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(OCc3ccccc3F)cc2)cc1 779592943 KSFLYBUAYVNPIH-KRWDZBQOSA-N 376.431 5.308 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Oc2c(C#N)nnc3ccccc23)c(Cl)c1 790813452 KKKDDZJPYSAMPB-UHFFFAOYSA-N 396.834 5.294 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1nccc2ccccc12 792095138 JRTAKYUPAVCOAS-RDGATRHJSA-N 394.499 5.945 30 20 GKED COc1ccccc1-c1ncc(/C=C2/Cc3c(ccc(Cl)c3Cl)C2=O)cn1 792885909 XLTBITQBWCQAOE-JYRVWZFOSA-N 397.261 5.281 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2c[nH]c3cc(Cl)ccc23)cn1 792886508 UXJZOWFMXKXWKL-RMKNXTFCSA-N 389.842 5.183 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1coc(C(C)C)n1 799469402 OITVXDZRPAUNNA-UHFFFAOYSA-N 377.473 5.306 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3cnn(C4CCCC4)c3)cs2)cc1 799896420 HKZAKOGIUMUDEY-FLIBITNWSA-N 379.485 5.026 30 20 GKED COCc1nc(Cl)cc(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)n1 814977427 NQNZSRBNVCDQLC-LBPRGKRZSA-N 398.816 5.031 30 20 GKED CSCC1(CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CC1 845452052 RYDNZDPHZZUMCD-LLVKDONJSA-N 384.448 5.025 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC[C@@H]2CC2(Cl)Cl)cc1 856822707 NTUIJENZIKOWOT-SJLPKXTDSA-N 388.298 5.047 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F 860478198 RPRIBKGXVHXKHK-VXNVDRBHSA-N 380.313 5.080 30 20 GKED CCc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 915359024 IHCNJPBHEATRMV-OAQYLSRUSA-N 375.497 5.288 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2csc(-c3ccccc3)n2)cc1Cl 916154464 GGXLPLMDTGUYRY-HJWRWDBZSA-N 385.872 5.377 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(C(F)(F)F)c2)cc1 916913801 SGQALKBIYFBMOP-GOSISDBHSA-N 388.389 5.009 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)SCc3ccccc3)n2)cc1 916974370 JHXOHJUTBXSLRT-LPHOPBHVSA-N 392.549 5.617 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2cccc(OCCC(=O)O)c2)cc1 1776125350 GDKNOBAAPHGGTK-JYRVWZFOSA-N 382.456 5.005 30 20 GKED O=C(O)c1ccc2[nH]cc(/C=C/C(=O)c3ccc(Oc4ccccc4)cc3)c2c1 1776126484 MZJWOGXZSCHNMX-UKTHLTGXSA-N 383.403 5.555 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cs1 1776280460 PTMBPPZFJUHJEF-NTMALXAHSA-N 381.453 5.295 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(SC(F)F)cc1 1776354646 UTBSOPDPQYBKMP-WEVVVXLNSA-N 392.423 5.383 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1nc2ccccc2c(C(=O)O)c1C 1777489964 MHUJUUILCHDHJH-ZHACJKMWSA-N 394.496 5.200 30 20 GKED C[C@@H](NC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccc(C#N)cc1 26122520 GZFZNQOKYMIYCJ-MRXNPFEDSA-N 390.870 5.135 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCOc1ccccc1F 65011264 XHSNTWBJDHPLHO-UHFFFAOYSA-N 380.444 5.224 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(C(F)(F)F)c1 66800360 LWABYCDVGQEQCM-ZDUSSCGKSA-N 378.419 5.281 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(CCC(F)(F)F)c1)c1ccccc1 121305825 RQXBQEIGLYYNNE-SFHVURJKSA-N 375.394 5.348 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(O)c(Cl)c1 129608733 JSITVAGLLPREBL-UHFFFAOYSA-N 380.856 5.321 30 20 GKED CC(C)(C)OC1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 130075009 BZMQTGHWFDGVMO-UHFFFAOYSA-N 393.487 5.162 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)COCc1ccccc1 171838740 QEDBVKSDGAMYSR-QZTJIDSGSA-N 397.544 5.055 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](Cc2ccccc2)C1 173123932 UBBHZMDWHSSNPT-PKOBYXMFSA-N 379.529 5.177 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(-c2cccnc2)cc1 175683991 HSJNQONMGFRPIT-IBGZPJMESA-N 399.494 5.047 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 177605375 NYRSHCAFGPELSY-KRWDZBQOSA-N 397.425 5.084 30 20 GKED CSCc1cccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 188168558 CRKANVHBKOAUDQ-OAHLLOKOSA-N 385.558 5.123 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 189911578 VWHFNYROPUMWOG-IBGZPJMESA-N 375.434 6.213 30 20 GKED CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)CCO1 245565411 ZNWHIQPREYCSLQ-SUMDDJOVSA-N 389.565 5.186 30 20 GKED C[C@@H]1CCN(C(=O)CSc2ccc(C#N)cc2)c2cc(Cl)ccc2S1 303135176 BZPCJWNHQKPHOJ-CYBMUJFWSA-N 388.945 5.221 30 20 GKED CN(CC1CCCC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 303187909 LWPZFWAKUYFBGV-UHFFFAOYSA-N 397.906 5.445 30 20 GKED C[C@@H](c1ccc(OC(F)(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303724230 WWIBBGMXGONLAL-VIFPVBQESA-N 395.265 5.463 30 20 GKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/C2[C@H]3CC[C@H]2Cc2ccccc2C3)CC1 329236851 OPWHXOFOHNNKQX-WDEXLOMXSA-N 396.575 5.698 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2ccccc2-c2ccccc2)no1 329575892 VQGHRBSBJCFNMZ-HXUWFJFHSA-N 376.460 5.208 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CCSc2c(F)cccc21 330303654 JZNARBOSTDPXES-IUODEOHRSA-N 392.521 5.026 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](CC(F)(F)F)C1 421059777 KQDGQEYXMULBIQ-KBPBESRZSA-N 385.455 5.277 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CSc1ccc(F)cc1 426381610 NYXYCLOHXGEXLP-GJZGRUSLSA-N 388.533 5.587 30 20 GKED CC(C)n1cc(Br)cc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430612904 UTXJNNDPJCCNQV-GFCCVEGCSA-N 394.338 5.076 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 432812577 IZRZUKJEUNXCHI-CYBMUJFWSA-N 385.455 5.530 30 20 GKED CCNc1ccc(Cl)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444347765 YUBMQVMKWSDXGL-UHFFFAOYSA-N 380.879 5.283 30 20 GKED Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 444911369 ZGYBNJDQZYLXCO-MSOLQXFVSA-N 381.545 5.484 30 20 GKED CC1(C#N)CCC(NCC2(c3ccc(Cl)cc3Cl)CCOCC2)CC1 449096082 DUFPFUHCRLQTQY-UHFFFAOYSA-N 381.347 5.104 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(c2cccc(Cl)c2)C1 454757651 JQHSJZQIXGLNLL-AWEZNQCLSA-N 385.920 5.366 30 20 GKED N#Cc1cccc(Cl)c1NCc1cccc(NC(=O)c2ccc(F)cc2)c1 462791070 QHRTWKJYCGNFSZ-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1cc(C)c(C#N)c(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)n1 462894245 HFZJOISONHYPJR-UHFFFAOYSA-N 398.388 5.388 30 20 GKED CCc1ccccc1NC(=O)CNc1ccc(Oc2ccccc2C#N)c(F)c1 463231047 VINJLJQCLRHVOZ-UHFFFAOYSA-N 389.430 5.103 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)c1cn(CCCC#N)c2ccccc12 468787056 CEDHTIYNZHGJHP-UHFFFAOYSA-N 377.463 5.137 30 20 GKED CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2cccc(C#N)c2)no1 468958985 KQJSLHTWMUPDTO-IRLDBZIGSA-N 385.467 5.012 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2(C(F)F)CC2)cc1Cl 471203927 NIFLYCWDDRAGSI-MRXNPFEDSA-N 389.833 5.162 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1)c1ccccc1 472505897 SNAKUIYXCNHLED-OXQOHEQNSA-N 382.419 5.458 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)o2)c(C)c1 474429127 CIIQMCILESHAMM-KRWDZBQOSA-N 394.496 5.545 30 20 GKED N#C[C@@H](C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1nc2ccccc2s1 480895272 SWXUXTADXKKUEI-KRWDZBQOSA-N 394.459 5.125 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2)cc1 483199659 OAGRVDJSSADYRG-QHCPKHFHSA-N 388.430 5.340 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(-c4csnn4)cc3)c2)cc1 483420815 YUDVXEVHZBWGPP-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1csc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1Cl 485570899 CKFMZMYECQAPKN-UHFFFAOYSA-N 384.913 5.661 30 20 GKED C[C@@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(Br)c1 487157412 PEODNLSXCLQSBN-DNVCBOLYSA-N 385.305 5.104 30 20 GKED CC(C)(C)c1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1[N+](=O)[O-] 487264509 GHIMEZKGTUZOCM-LJQANCHMSA-N 379.460 5.057 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@@H](CCCC#N)c1ccccc1 487537913 OBGVUPYOSISZDY-OFNKIYASSA-N 376.500 5.057 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Cl)cc(C(F)(F)F)c1 488321526 QBBVICMYSXESRL-UHFFFAOYSA-N 384.810 5.617 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1cc(C#N)ccc1Br 492484911 NEJVOIAGBSIHJM-LBPRGKRZSA-N 386.318 5.123 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1)c1ccccc1 495040708 DBVXUJOVHWFQES-JOCHJYFZSA-N 385.467 5.022 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cccc(C)c1C 502659461 CMXTVMTYNBBQCM-UHFFFAOYSA-N 391.284 5.425 30 20 GKED N#Cc1cccc(F)c1CC(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 509143575 XVFJMOVEEXSCHU-IBGZPJMESA-N 390.380 5.012 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccccc1OC(F)F 511551357 DIQKIPKPAIOGNW-UHFFFAOYSA-N 394.377 5.513 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)Nc1sc2c(c1C#N)CCCC2 512146478 KTAZXLPTMQTWLP-UHFFFAOYSA-N 393.537 5.107 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1csc(-c2ccc(Cl)cc2)n1 512567210 YACLDXXKZYJCMW-UHFFFAOYSA-N 397.887 5.375 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cccc(-c3cnco3)c2)c1 513463117 JAVJPTSTSMUPLZ-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 517256734 IUQAGULZDLDRFC-KOSHJBKYSA-N 396.494 5.228 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(Cl)c(Cl)c1 517532711 KXMXHIFLOKHIIY-LBPRGKRZSA-N 394.327 5.438 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccc(C#N)cc1 518736911 QXMLGXLYXGKMTP-VLIAUNLRSA-N 395.915 5.423 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(Cl)cc3F)cc2)cc1 518907081 KVUAZPWLYZCCEM-UHFFFAOYSA-N 380.806 5.590 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC)c1ccc(Cl)cc1 521080889 XAYXQNOPEGLOTA-IBGZPJMESA-N 387.867 5.097 30 20 GKED Cc1cccc2cc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)oc12 524386966 AYOLKAYFNGFSLK-UHFFFAOYSA-N 382.419 5.444 30 20 GKED N#Cc1c(NC(=O)c2ccc(Oc3ccccc3Cl)nc2)sc2c1CCC2 531071894 JZTJJNJWOAFTOK-UHFFFAOYSA-N 395.871 5.201 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)c1cccc(C#N)c1 533577054 YUOSOBNXQNVALU-UHFFFAOYSA-N 398.249 5.329 30 20 GKED C=CCN(C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)C1CC1 537928944 MJTBBERKJHSMRV-LBPRGKRZSA-N 375.925 5.193 30 20 GKED Cc1oc(-c2ccccc2)nc1COc1c(Br)cccc1CC#N 550446004 QHJJMZQQPVIDIN-UHFFFAOYSA-N 383.245 5.058 30 20 GKED C=CCn1c([C@@H]2OCC[C@@H]2C)nnc1N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 558457100 RENIHKQQMHYYET-OGHNNQOOSA-N 395.334 5.066 30 20 GKED CN(C)Cc1ccccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 568156001 PBOWADWGFKBVAP-UHFFFAOYSA-N 387.508 5.023 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cc2c(ccc3ccccc32)[nH]1 576250356 PVFRBSJPMTZQEL-UHFFFAOYSA-N 386.499 5.317 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H]3CCc4ccc(C#N)cc43)s2)cc1 580680088 FGGDTUUIGZYXLG-SZNDQCEHSA-N 389.524 5.337 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1Cl 585709954 XXAOTZAVGGSBFO-UHFFFAOYSA-N 399.837 5.786 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)C1CC1 588235908 TZXJVHDQDMHFNK-KRWDZBQOSA-N 398.466 5.503 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)ccc1F 590995248 FCIXNOMRTWKZRO-LBPRGKRZSA-N 378.350 5.253 30 20 GKED N#CCCCCC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 593972105 OWKILAZWNYGZQS-UHFFFAOYSA-N 376.287 5.001 30 20 GKED CCN(C(=O)CCCCC#N)[C@@H](c1cccnc1)c1csc2ccccc12 593972354 AIRYDNRVOJGJAY-QFIPXVFZSA-N 377.513 5.318 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Cc1sc(C)nc1-c1cccs1 603524629 PGQPAVPARDOKII-UHFFFAOYSA-N 395.553 5.033 30 20 GKED Cc1cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c(C)s1 603814638 ZBOFCMMHDZBOBD-UHFFFAOYSA-N 376.481 5.262 30 20 GKED COc1ccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 608913313 UKLZQEPVPRSOOZ-HXUWFJFHSA-N 391.858 5.648 30 20 GKED CCCCOc1ccc(OC)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 608914805 AKPIIFBHFOGQOM-UHFFFAOYSA-N 395.503 5.188 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1ncc(-c2ccc(Cl)cc2)o1 608987868 KQOVWEUSZHBMAR-UHFFFAOYSA-N 375.211 5.108 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609991129 CRRLGHQMOPBNBK-UHFFFAOYSA-N 375.403 5.092 30 20 GKED N#CC1(C(=O)NCc2ccccc2COc2ccccc2Cl)CCCCC1 610203395 LTCOHCPYDMUKPF-UHFFFAOYSA-N 382.891 5.009 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)CC[C@H]1C 611557356 LUPLXEPXXUCSHL-MCIONIFRSA-N 385.455 5.276 30 20 GKED COc1ccc(Cl)cc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 613407266 NQKCHIGOQSMEDP-LBPRGKRZSA-N 377.252 5.102 30 20 GKED CCc1c(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cnn1C(CC)CC 616699225 HEKJZMDIDYQUOB-UHFFFAOYSA-N 379.291 5.237 30 20 GKED FC(F)(F)[C@@H]1CC(N[C@@H](c2ccccc2)C(F)(F)F)C[C@@H](C(F)(F)F)C1 643307152 ZZNZIGUIMHWELP-GVXVVHGQSA-N 393.293 5.789 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1OCCC 647375875 IIKULOAVERDZCA-INIZCTEOSA-N 384.501 5.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1 666866602 VWWMYLAIRDJYBL-JOCHJYFZSA-N 378.516 6.281 30 20 GKED CC(=NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1)c1cc(C)sc1C 727058114 HFQOMLRHGVVOMD-UHFFFAOYSA-N 399.541 5.002 30 20 GKED O=C1/C(=C\c2csc(-c3cccs3)n2)CC/C1=C\c1cccc([N+](=O)[O-])c1 728440789 VBYOCJSQTAZSQD-PVMFERMNSA-N 394.477 5.610 30 20 GKED CC(C)(NCc1c(F)c(F)c(F)c(F)c1F)c1cccc(C(F)(F)F)c1 728928371 TXWJOHSYLZMLJO-UHFFFAOYSA-N 383.282 5.426 30 20 GKED CCC(CC)CN(CCC#N)C(=S)NCCc1ccc(Cl)cc1Cl 729642500 OACDVGSJMQVRQU-UHFFFAOYSA-N 386.392 5.062 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2CCC(c3ccccc3C)CC2)c1=S 730254016 JZYDVSRLTYEDCR-UHFFFAOYSA-N 394.544 5.006 30 20 GKED COc1ccc(/C=C\C(=O)c2c(C)nn(-c3ccccc3)c2C)c(Cl)c1OC 730433382 FWXJNVZDQDZWPS-BENRWUELSA-N 396.874 5.056 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 731318809 DIISRYLZDGPQGC-GFCCVEGCSA-N 391.949 5.552 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1 733327777 GXZFZWJDAKPNCD-GOSISDBHSA-N 390.552 5.680 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2c3ccccc3cc3ccccc23)c1 733800380 OLYGWZIVSBZCAE-QFIPXVFZSA-N 380.491 5.964 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CSc3ccc(C(C)(C)C)cc3)[nH]c12 735789116 KAVIUWYUNWWACP-QGZVFWFLSA-N 377.513 5.137 30 20 GKED C=CCCCCCN(C)C(=O)c1cccc2c(=O)c(C)c(-c3ccccc3)oc12 739655362 RYVZBFBXNPXTDR-UHFFFAOYSA-N 389.495 5.587 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1OC 741841268 FFIILNHZQWFTIF-YCRREMRBSA-N 382.403 5.254 30 20 GKED Cc1ccc(C(=O)N(CCC#N)c2ccc(F)cc2)cc1NC(=O)OC(C)(C)C 742651904 ZJEPKNGVHIQSHI-UHFFFAOYSA-N 397.450 5.042 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CC(C)(C)c2ccccc2)cc1 743447788 SWMLBEIVJNYPDT-DYESRHJHSA-N 376.500 5.215 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@H](C#N)C(=O)Nc3ccccc3)o2)cc1 744027918 CSKBBDLNFXKODO-IBGZPJMESA-N 386.451 5.205 30 20 GKED N#C[C@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc2cc(Cl)ccc2s1 744035769 RBFMCHAJXRLBOP-LEOMRAHMSA-N 394.927 6.100 30 20 GKED N#Cc1csc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)c1 748660326 FGDSJKSKCDJURR-AWNIVKPZSA-N 396.440 5.044 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccc(OC)cc2)cc1 750688494 UQXRIFMVGKHQGY-PNLZDCPESA-N 392.499 5.050 30 20 GKED CC(=NOCc1ncc(-c2ccc(C)cc2)o1)c1nc2ccccc2n1C(F)F 754801312 YIEVKWGSOZNALU-UHFFFAOYSA-N 396.397 5.336 30 20 GKED CC(C)(CC#N)COC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 764838447 GUXNCNKHGBHFFE-UHFFFAOYSA-N 393.418 5.003 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3sccc3-c3ccc(F)cc3)CC2)cc1 767981568 JJTRGPZPTGEUQK-UHFFFAOYSA-N 388.467 5.355 30 20 GKED CC[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 775658334 NBWNIXFPTKAUFX-BJKOFHAPSA-N 384.479 5.483 30 20 GKED C[C@@H]1C[C@H]1[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)cc1 776026570 OWVFVPGECAAUTN-YHBQJITHSA-N 375.299 5.383 30 20 GKED Cc1c(C(=O)/C=C\c2nc(-c3cc(Cl)ccc3Cl)cs2)cnn1C 778518587 WZODCUJJGJPFER-WAYWQWQTSA-N 378.284 5.055 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CNc1cccc(OCC#N)c1 779589151 XKZXDNZYCIXDMO-UHFFFAOYSA-N 387.270 5.002 30 20 GKED C#CCCCCCC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 779913661 JHFSYHQIIZFTEI-MRXNPFEDSA-N 380.351 5.028 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC1(c2c(Cl)cccc2Cl)CC1 780669341 CAWAABWVZYGHDC-GFCCVEGCSA-N 390.270 5.095 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2nc(C(F)(F)F)cs2)cc1 787017701 JEDZDDIHKNZDCW-NWDGAFQWSA-N 390.858 5.705 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1nccc2ccccc12 792097603 XXVYJKWMLAISHC-GDCKJWNLSA-N 383.838 5.326 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nnc(-c2cccc(Cl)c2)o1 795980975 AODLMWHDVINKSE-GOEBONIOSA-N 395.846 5.082 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ccc(Br)cc2)s1 797568466 RYXIFWRKNXVYMI-CQSZACIVSA-N 391.334 5.012 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCC(C)(C)CCC#N 798878624 GKIMZJMEKMGDKH-ZDUSSCGKSA-N 376.909 5.242 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2Cc3cccc(Cl)c3C2)cc1 806200872 OYHKOLMKZHLIRS-HXUWFJFHSA-N 387.870 5.543 30 20 GKED Cc1ccc(CC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(Cl)n1 807219640 DIAHYFOHQBFHBQ-INIZCTEOSA-N 389.886 5.002 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 813091376 ZKRPCZMHYJXIPZ-KNQAVFIVSA-N 378.859 5.168 30 20 GKED Cc1cc(Cl)cc(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)c1 814736645 UEMQUKSHLLBNPK-UHFFFAOYSA-N 393.899 5.277 30 20 GKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)n1[C@@H](C)c1ccccc1 817318546 CLFKNPWLSDPEIO-CPJSRVTESA-N 399.538 5.879 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c2C#N)[C@H](C)C1 839389776 SRXXGOSWMKKGFP-VHSXEESVSA-N 389.864 5.119 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)[C@@H](C#N)c1nc(-c3ccccc3)cs1)CCC2 847625093 BXJNTCWFILNWHN-AZUAARDMSA-N 388.492 5.115 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2cc(C(F)(F)F)cc(Cl)n2)ccc1OC 848665208 PIMZZCBECLAJTD-ZDUSSCGKSA-N 399.800 5.055 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2cccc3ccccc23)cc1 915088716 VXOMEUZIJAPMEW-DEOSSOPVSA-N 392.458 5.513 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@@H]2c2cc(C)no2)s1 916669727 MRLAIANVAHYNFF-OAHLLOKOSA-N 391.541 5.107 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026893 RTDUAJOECYAREX-OXQOHEQNSA-N 390.508 5.577 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccco1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917029847 CEGMTTLGFUIERJ-LQEGWIEOSA-N 378.497 5.094 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(C)c2)cc(Br)c1OC(F)F 917144293 DPUFZKYLJKKMBD-SREVYHEPSA-N 397.215 5.264 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(N4CCCC4=O)cc3)cs2)cc1 918712305 JALWRVZXTHKLOM-RAXLEYEMSA-N 388.492 5.141 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)/C=C/c2ccccc2C#N)cc1F 919894808 PUPCVTVCSRROLR-JLHYYAGUSA-N 388.398 5.150 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(O[C@@H](C)c2ccccc2)cc1 1776085494 QEBBZVFGZGOBHO-SFHVURJKSA-N 388.467 5.290 30 20 GKED N#Cc1c(F)ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)O)c1Cl 1776120280 AIVYGTMZRIRCDX-FMIVXFBMSA-N 378.790 5.084 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776470817 JEGHYIGTGVGWFX-MARXPDLDSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC(F)(F)F)c(Cl)c1 1776784280 ZXEOUKYTUYVWJP-CQSZACIVSA-N 395.849 5.532 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](Cc2cccc(C)c2)C(=O)O)cc1 1776786290 MDHMLTWGXZMBNW-QHCPKHFHSA-N 397.559 5.377 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C[C@@H](C)c2ccccc2)C(=O)O)cc1 1776786335 AHZBCMWBONMZBB-YKSBVNFPSA-N 397.559 5.772 30 20 GKED CCCCCCCOc1cccc(/C=C/c2nc3cc(C(=O)O)ccc3o2)c1 1776789260 YTYMTOQEBMYXCL-JLHYYAGUSA-N 379.456 6.046 30 20 GKED Cc1cccc2c1C/C(=C/c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777456055 DOUYVWJZTMFZSV-NAJSETDRSA-N 384.431 5.022 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1c[nH]c2ccc(C(=O)O)cc12 1777488165 GTVIKTNJPJILLY-CSKARUKUSA-N 388.448 5.194 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2cc(F)ccc2F)n(C2CCCC2)c1C 12482115 XNCYOKVSFCLXJH-UHFFFAOYSA-N 389.471 5.101 30 20 GKED N#C[C@H](C(=O)CSc1cc(Cl)ccc1Cl)c1nc2ccccc2o1 41545933 FUVJUSVWIOMYIK-LLVKDONJSA-N 377.252 5.103 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c1 41558733 LEGQPFVVTXUTEU-INIZCTEOSA-N 397.425 5.119 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1cccnc1 102907761 YPRDHDMQAQDENK-ZDUSSCGKSA-N 390.434 5.398 30 20 GKED C[C@@H](N[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 152806334 VOTHXRLHPQODCG-CHWSQXEVSA-N 386.282 5.932 30 20 GKED CCc1noc(C)c1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 157680073 IJBGHCSALQAJFF-UHFFFAOYSA-N 396.834 5.507 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4cc[nH]c34)c2)cc1 173583927 POJIPSWHTADZFA-UHFFFAOYSA-N 381.435 5.065 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 178987550 REMJTSRRRHJUIO-RZXPCSSPSA-N 385.801 5.365 30 20 GKED Cc1cc([C@H](C)NCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)s1 182745276 PFIFSROJSKBQAR-HIFRSBDPSA-N 387.574 5.049 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 187310207 MWVXSAPNWPSTIK-QFIPXVFZSA-N 384.479 5.546 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CCCC1)c1nc2ccccc2n1C(F)F 193769181 IAWQPKHSMNXEJE-INIZCTEOSA-N 397.400 5.259 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1csc(Cc2ccc(Cl)cc2)n1 277971229 SHAGYMNBKFRLJJ-VWLOTQADSA-N 394.993 5.356 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ccnc3cc(Cl)ccc23)ccc1OC 301283410 QPXUNAHLBSRLKP-MRXNPFEDSA-N 381.863 5.190 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2cccc(-c3cccs3)c2)no1 329319850 DTXHAOMADMTAGG-QGZVFWFLSA-N 382.489 5.269 30 20 GKED C[C@H]1CCCC[C@H]1/N=C(/O)C1(C/C(O)=N/[C@H]2CCCC[C@H]2C)CCOCC1 330101699 FQCQQGQMFVQALD-YDZRNGNQSA-N 378.557 5.244 30 20 GKED N#CCCC[C@H](NCCC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 411752288 DAJSRXWWIXDTCN-SFHVURJKSA-N 389.421 5.059 30 20 GKED N#Cc1c(F)cccc1CN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 428348242 JHKAZHZQVPYTRF-OAHLLOKOSA-N 376.275 5.109 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 431777995 FVBIQRKNDCJKNM-MAUKXSAKSA-N 387.430 5.083 30 20 GKED CC(C)(C#N)CCCCSc1nnc(CN2CCCCC2)n1-c1ccccc1 436134672 ODXCFXWYZJNVBX-UHFFFAOYSA-N 397.592 5.065 30 20 GKED CCCCN(Cc1nnc(-c2cccc(C#N)c2)o1)Cc1ccccc1Cl 441505193 GTJLIZUAVMRBGR-UHFFFAOYSA-N 380.879 5.064 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 444456100 MSEPFZVGPZWKCS-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CC(C)CCN(CCC#N)C(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 446354965 KEDATHVRBGUGDL-HNNXBMFYSA-N 393.812 5.054 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 447057095 BVCPHRXDVGXNKE-JTSKRJEESA-N 379.529 5.276 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1cccc(Cl)c1F 463396093 LPWXTPKEUJRPGY-UHFFFAOYSA-N 395.821 5.028 30 20 GKED N#Cc1cc(NC(=O)c2ccccn2)ccc1Oc1ccc(C(F)(F)F)cc1 464291355 AXXVSWQLJZYOPT-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@]1(C)Cc1ccccc1 467340074 BYNOILXCSAKUFJ-FDDCHVKYSA-N 393.556 5.567 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3C[C@H]4CCC(=O)c5cccc3c54)c2)cc1 468634830 IUTAWAQBHYZHCV-GOSISDBHSA-N 393.446 5.022 30 20 GKED CCCOc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469276581 VKQFIYFKIZNQGS-SFHVURJKSA-N 391.515 5.231 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 470621722 CZDAOEBLSDCUCL-WRWORJQWSA-N 393.249 5.137 30 20 GKED COc1c(F)cc(F)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 472514261 GQNBUGUFETXZAT-UHFFFAOYSA-N 394.377 5.084 30 20 GKED COc1ccc(-c2nc(NC(=O)c3ccc(C(C)(C)C#N)cc3)sc2C)cc1 474394818 QWUDMTWAQURUCI-UHFFFAOYSA-N 391.496 5.181 30 20 GKED CC(C)c1occc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 483297740 TXUHGZYQZWEBFB-IBGZPJMESA-N 378.859 5.964 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1 487174365 DIESMUGBSYIMPV-ZCNNSNEGSA-N 387.310 5.648 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3csc4ccccc34)s2)cc1 487389034 SIJMTVYXQCWGBN-UHFFFAOYSA-N 375.478 5.073 30 20 GKED C[C@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)s1 487421913 SQJROISHVKJMGJ-DZGCQCFKSA-N 391.334 5.165 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Sc3nc(C(F)(F)F)ccc3C#N)o2)cc1 488727870 BNCILXNZPVJLPE-LLVKDONJSA-N 390.390 5.184 30 20 GKED C=CCn1c(SCc2nc(C(C)C)no2)nnc1-c1ccc(C(C)(C)C)cc1 496898389 NFLXSZXSNSUYPZ-UHFFFAOYSA-N 397.548 5.227 30 20 GKED Cc1c(C#N)c(SCc2ccc(OCc3cccnc3)cc2)nc2c1CCC2 499343449 VVHCXWYNPNTMJH-UHFFFAOYSA-N 387.508 5.017 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@H]1CCCC(F)(F)C1 499594374 SMFNEDSYXGVTGA-HNNXBMFYSA-N 386.467 5.265 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC=C(c4ccccc4F)C3)c2)cc1 501578203 ASAPCHGIFKYWCV-UHFFFAOYSA-N 384.410 5.029 30 20 GKED COc1ccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(C(F)(F)F)c1 503049572 CTGYAIIEUGVCKS-UHFFFAOYSA-N 381.247 5.124 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c(C)c1 510213995 XMSGAPOFJNFNKS-KRWDZBQOSA-N 387.508 5.356 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2cc(C#N)cc(N(C)C)c2)o1 510763817 NJIZQFAZPHCAJQ-UHFFFAOYSA-N 379.847 5.098 30 20 GKED C[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511373537 PNJHOOVOBKFNAP-WZONZLPQSA-N 391.515 5.374 30 20 GKED N#CC1(CCCSCc2ccc(Br)c(Cl)c2)CCOCC1 512390634 GUFIJCABZWTODJ-UHFFFAOYSA-N 388.758 5.436 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CSCc1ccc(C#N)cc1 515281398 IRVPMQGKIKKVOG-ZDUSSCGKSA-N 393.339 5.318 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1c(Cl)cccc1Cl 524252964 NGORZWGKFKGHKX-INIZCTEOSA-N 392.673 5.052 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524439255 OFXXZYZLQFPEFJ-IBGZPJMESA-N 397.906 5.587 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(OC(C)C)CC1 530945474 MGQRLWDOBWJUKT-UHFFFAOYSA-N 393.487 5.080 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C)ccc1Br 536454574 LIYGVTVXGVATTM-UHFFFAOYSA-N 386.293 5.073 30 20 GKED C=CCCC[C@H](C)NC(=O)c1ccccc1SCC(=O)Nc1ccc(C)cc1 538335645 LHKFZQSSSLYPPI-SFHVURJKSA-N 396.556 5.200 30 20 GKED C[C@@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)c(F)c1 540707516 GRRPQVAZOWLGME-OPAMFIHVSA-N 378.422 5.307 30 20 GKED Cc1ccc(CCN(Cc2ccco2)C(=O)c2ccc(C3(C#N)CC3)cc2)cc1 540756321 SMVSXCULASCBIW-UHFFFAOYSA-N 384.479 5.028 30 20 GKED C=CCC[C@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccccc1 541464143 OCHZGCPWKWGBRH-GGAORHGYSA-N 391.559 5.317 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)ccc1SC 542014406 KWWRUYJABNGLJH-KRWDZBQOSA-N 388.536 5.807 30 20 GKED C[C@H](N[C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccc(-c2cccc(C#N)c2)cc1 542106414 MQCCJJGBYWJQGI-ROUUACIJSA-N 395.506 5.522 30 20 GKED N#Cc1c(F)cccc1N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 561322892 BNHGOCYZXMBQRZ-LJQANCHMSA-N 378.369 5.296 30 20 GKED O=C(CC1(C(F)(F)F)CC1)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 561639623 IZZDVZUGDSZIQG-UHFFFAOYSA-N 397.334 5.225 30 20 GKED N#CCCC[C@H](NCc1cc(Br)cc(F)c1F)c1ccccc1 563214547 BIGUFDIUMYQFCL-KRWDZBQOSA-N 379.248 5.252 30 20 GKED CCN(C(=O)c1sc(-c2ccc(C)o2)nc1C)c1ccc(C#N)c(Cl)c1 566744023 WWPSCPSVAUWVGZ-UHFFFAOYSA-N 385.876 5.212 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)CC2 573048843 WZNIOJCIPKOZKG-ZWKOTPCHSA-N 398.350 5.848 30 20 GKED CC(C)n1c(Cc2cccc3ccccc23)nnc1N1CCC(CCC#N)CC1 573845253 URRYSXATYFIHBN-UHFFFAOYSA-N 387.531 5.123 30 20 GKED N#C[C@H](C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1nccc2ccccc12 582216268 AWCXYAUDEWDXHC-QFIPXVFZSA-N 397.478 5.244 30 20 GKED C=CCN(C(=O)Cc1csc(C(C)(C)C)n1)c1nc(-c2ccccc2)cs1 588353402 VNAWGZBIMUPQKX-UHFFFAOYSA-N 397.569 5.326 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1F 596606941 ZXIMUVHSTRQNPM-RTWAWAEBSA-N 395.478 5.116 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1 606883268 IRGKGWFNQIKANF-UHFFFAOYSA-N 389.499 5.530 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC1(c2ccccc2)CC1 609080419 WZCMHHVXQVLKAD-UHFFFAOYSA-N 397.478 5.257 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCCCc1ccccc1 609398203 KCRMMNJTVKVXRC-SFHVURJKSA-N 381.545 5.473 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)CCCCOc1cccc(C#N)c1 609816976 LRYSCHKZRRWPDX-UHFFFAOYSA-N 386.879 5.187 30 20 GKED CC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccc(F)cc1F 610026889 MQUOCYZNOYNORP-OAQYLSRUSA-N 385.458 5.155 30 20 GKED Cc1onc(-c2ccccc2)c1-c1nnc(CSc2ccc(C#N)cc2F)o1 610218822 YWQVVDJJBANOTK-UHFFFAOYSA-N 392.415 5.003 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](OC)c1cccc(OC)c1 626534388 JMVPVVSWASYDSW-NRFANRHFSA-N 382.504 5.056 30 20 GKED FC(F)(F)C1CCC(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 681080646 FYJBFZBWWGZPKT-CAODYFQJSA-N 385.314 5.418 30 20 GKED C=C(C)C[C@@H](C)c1nc(CC(=O)Nc2ccccc2Oc2ccccc2)no1 685358673 AOLJURXOEMEOPN-MRXNPFEDSA-N 377.444 5.113 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NNc1ccc(OC(F)F)cc1 726427488 ZFUPFNMMDXRVBU-UHFFFAOYSA-N 390.821 5.190 30 20 GKED COc1ccccc1/C=C/C=C/C(=O)c1ccc(SC(F)F)c(OC)c1 726740605 LRZCVSAZKGBFQK-DLYLGUBQSA-N 376.424 5.471 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)[nH]c12 735793799 ZABXMZZTUQFLEU-RRFJBIMHSA-N 384.266 5.158 30 20 GKED O=C(/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1c(Cl)nc2ccccn12 737448418 GPKUUZBCBCONRP-VQHVLOKHSA-N 393.786 5.052 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)c1ccc(F)nc1 740786489 SXZZYGQJTZDLJJ-UHFFFAOYSA-N 398.303 5.146 30 20 GKED N#Cc1ccc(CSc2nnc(NC(=O)C3CCCCCCC3)s2)cc1 741517692 VRRGIPXUDZAWGU-UHFFFAOYSA-N 386.546 5.001 30 20 GKED C[C@H]1/C(=C\c2cnc(-c3ccccc3)nc2)C(=O)c2cccc(Br)c21 742435106 QCLDEURUWCXKEE-VZWMTCDZSA-N 391.268 5.290 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H](C)c1cccc(O)c1 743096398 QLXNGRDCTCODBC-MHECFPHRSA-N 399.494 5.663 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC[C@@H](C)c3ccccc3)n2)cc1 750328131 JDWHYYRTBXUTSP-OXQOHEQNSA-N 390.508 5.579 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(Oc4ccccc4)c(F)c3)cc12 750912151 DAPQGXINHRJFDP-CSKARUKUSA-N 387.414 5.104 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(F)c(Br)c1 753143590 WZCQAPHYFQWEBO-RQOWECAXSA-N 389.249 5.003 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1C=NOc1ccccc1C(F)(F)F 754712296 KJPSXMRJGLCSBC-UHFFFAOYSA-N 377.341 5.060 30 20 GKED C[C@H](ON=Cc1cccc(F)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 757616251 UMZACMUYBPEYOY-JTQLQIEISA-N 380.206 5.294 30 20 GKED N#C[C@H](C(=O)CCCC(F)(F)F)c1nc2cc(C(F)(F)F)ccc2s1 771260332 GDJHAMRINOZQGN-SECBINFHSA-N 380.313 5.224 30 20 GKED C=CCc1cc(CN[C@@H]2C[C@H](C)Sc3sccc32)cc(OC)c1OC 772948653 XGIHPJYFKJUSFX-SUMWQHHRSA-N 375.559 5.209 30 20 GKED Cc1cc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c(C)c(C)c1O 774839778 GTRONXXRBLXIPZ-UHFFFAOYSA-N 386.451 5.020 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccccc1SCc1ccco1 780166290 KFRAKUUVEBEZDX-OAHLLOKOSA-N 378.453 5.115 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ncc(-c2ccc(Cl)cc2)o1 795984231 WJUKSNWIFXMMLD-MAUKXSAKSA-N 394.858 5.687 30 20 GKED CC(C)(CCC#N)COC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 798876878 PZXGFODNHCYRAH-UHFFFAOYSA-N 384.423 5.121 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccncc2C(F)(F)F)cc1 800689484 NHVXJJFBZWIWIU-GOSISDBHSA-N 381.357 5.008 30 20 GKED N#Cc1ccsc1C(=O)O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809327162 UXJORALYNPRWIE-GFCCVEGCSA-N 379.281 5.099 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(C#N)cc2C(F)(F)F)ccc1OC(F)F 811687073 LEYFVNGBDLINMX-XQRVVYSFSA-N 397.299 5.083 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2nc(-c3ccccc3F)cs2)ccc1OC 814849180 KUZLAQODNNPELG-OAHLLOKOSA-N 397.475 5.251 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccccc1 817318804 HMKHGMHGIRNESP-HXUWFJFHSA-N 396.581 5.720 30 20 GKED FC(F)(F)c1ccc(-c2ccc(C=Nn3cnnc3-c3ccccc3)s2)cc1 818268775 RIUVRSMZHQCMRG-UHFFFAOYSA-N 398.413 5.575 30 20 GKED Cc1ccc(Cl)c(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915088694 VEVHFZMHGFPXFJ-FQEVSTJZSA-N 390.870 5.321 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3ccc(OC)c(OC(F)F)c3)oc12 916130425 UTBUJBDWSAVURY-VQHVLOKHSA-N 388.366 5.338 30 20 GKED FC(F)(F)c1cnc(NN=Cc2cc3ccccc3nc2Cl)c(Cl)c1 916286422 CQOJATQRFDALMR-UHFFFAOYSA-N 385.176 5.401 30 20 GKED Cc1ccc(SCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916977259 OFDKZYMGAXLOQU-KRWDZBQOSA-N 398.940 5.741 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Nc2cccc(OC(F)F)c2)cc1 917028136 NRYUMTSDVGHHJC-FQEVSTJZSA-N 393.393 5.587 30 20 GKED O=C(O)c1cc2ccccc2c(C=NN(c2ccccc2)c2ccccc2)c1O 1776032731 OBDOXKSYNFROAD-UHFFFAOYSA-N 382.419 5.416 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C\C(=O)c2ccc(C(=O)O)cc2O)cc1Cl 1776353618 LMDIGQOYKGLQMI-XQRVVYSFSA-N 395.238 5.081 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2ncc(/C=C/C(=O)O)s2)cc1 1776785563 LKTANOOLRHOBQZ-MRKNTEETSA-N 385.529 6.151 30 20 GKED CCCCOc1ccccc1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776803770 PZMPVQRHJBHEJN-BENRWUELSA-N 382.456 5.247 30 20 GKED COc1cc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc(C(F)(F)F)c1 1777286045 WFIBFWSRRNECAK-VGOFMYFVSA-N 390.357 5.015 30 20 GKED O=C(O)Cc1cccc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)c1 1777650920 CUCNPKHVKUFASP-XMHGGMMESA-N 399.471 5.347 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccccc2)nnc1-c1ccc(Cl)cc1 11450203 GANULUZVYQHGGC-AWEZNQCLSA-N 383.904 5.148 30 20 GKED N#Cc1cccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)c1 59270164 ZQILISBNWGUEGC-VAWYXSNFSA-N 386.838 5.360 30 20 GKED Cc1c(C(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)sc2cccc(F)c12 117205458 MRQRQDKHLIQNFO-UHFFFAOYSA-N 399.331 5.306 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCO[C@@H]1C(C)(C)C 118544624 FQURWALBSPQYCU-MDZRGWNJSA-N 389.565 5.044 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2cccc(C)c2C)cc1 127588998 MBYFPLQRWXFMJW-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(Cl)c(C(=O)NCc2cccs2)c1 151804142 BKYBIBUBCDKFMT-UHFFFAOYSA-N 388.920 5.038 30 20 GKED Cc1csc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)n1 173123260 OJXIOVSBAUMLPC-CXAGYDPISA-N 386.546 5.119 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1CC(F)(F)F 173997723 HSQIWUBFAGRLBJ-UHFFFAOYSA-N 378.394 5.020 30 20 GKED N#CCSc1cccc(C(=O)N(CCc2ccc(F)cc2)C2CCCC2)c1 175579222 LNRKMAITRCRVDM-UHFFFAOYSA-N 382.504 5.069 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1OC 206869119 CRIOSCMJBBPVJS-YVMONPNESA-N 381.255 5.305 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](COc2ccccc2F)c2ccccc2)cc1 237607370 YCGDNIFZCCFUIX-WZONZLPQSA-N 390.458 5.026 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)NCCCCC#N)nc1-c1ccccc1 267227721 VWVNVAOZZNSBQM-SFHVURJKSA-N 380.492 5.005 30 20 GKED O/C(CCc1nc2ccccc2o1)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329339917 NYNXDTUFHKNVTI-GOSISDBHSA-N 378.476 5.106 30 20 GKED Cc1ncsc1N=C(O)C12CCC(C(O)=Nc3scnc3C)(CC1)CC2 329570717 MLFCYEAGALGATM-UHFFFAOYSA-N 390.534 5.433 30 20 GKED Cc1ccccc1C1(/C(O)=N/C2CCN(/C(O)=N/C3CCCCC3)CC2)CCC1 329958737 QUHOVCBAAUIWDL-UHFFFAOYSA-N 397.563 5.084 30 20 GKED CC1(C)CC[C@H](C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)c2ccccc21 330015620 OGNYZYDOBGOOMX-CUYAVPTFSA-N 382.548 5.723 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)c1C 412168954 BRSDFMHRTQTTTI-LEWJYISDSA-N 376.500 5.314 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1cnc(C(F)(F)F)s1 425365798 MVILMSVKUWDOEX-JTQLQIEISA-N 393.356 5.095 30 20 GKED C=CCOc1ccccc1CN[C@@H](Cc1cccnc1)c1cccc(Cl)c1 426050098 KSPKVFZMGZZIQR-QFIPXVFZSA-N 378.903 5.373 30 20 GKED N#Cc1c(F)cccc1CNc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 427430493 XVKIFMHBOQNBMO-UHFFFAOYSA-N 387.336 5.516 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 427735416 JESORDOSDYTWFV-SNVBAGLBSA-N 385.323 5.113 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2c(-c3cccc(Cl)c3Cl)noc2C)n1 430519819 LNFJJKVMEGKPFK-NSHDSACASA-N 392.267 5.212 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 432447972 HDYZWPQXMMLXBP-GOSISDBHSA-N 394.490 5.012 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CC2(CCC2)[C@H]1c1ccccc1 433138836 ZJMFENJLIMFYFT-XMMPIXPASA-N 393.490 5.241 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1cc(C(C)(C)C)sc1C#N 438944214 DFOJVPSDEDOWCM-UHFFFAOYSA-N 377.853 5.040 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1nc(C(F)(F)F)c(Cl)c1C 464473095 RUDKZSXHURVXFM-UHFFFAOYSA-N 399.844 5.354 30 20 GKED CN(Cc1ccc(Cl)c(F)c1)C(=O)c1cn(CCCC#N)c2ccccc12 469728838 MJWGXEROVFCPHZ-UHFFFAOYSA-N 383.854 5.010 30 20 GKED N#CCc1cccc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)c1 469891954 HWNWOUMWFLJZLJ-UHFFFAOYSA-N 398.249 5.499 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Oc1cnc2ccccc2c1 470891532 MFEXXOJJOCWCGF-HOTGVXAUSA-N 391.496 5.035 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 471248837 FIKOYUMYWAOCAG-SCLBCKFNSA-N 389.377 5.155 30 20 GKED O=C(Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1cc(F)c(F)c(F)c1F 474730766 PZXNNZWYMVUEQA-UHFFFAOYSA-N 399.265 5.580 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@@H](CO)C(C)C 475570361 CBIHTZVSBRMYJJ-QHCPKHFHSA-N 394.559 5.590 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ccc(OC)cc2)CC1 475582385 SLQHJIGAHKZWKA-UHFFFAOYSA-N 392.543 5.959 30 20 GKED CCc1nc2c(s1)[C@@H](N(C)C(=O)c1sc3ccc(C#N)cc3c1C)CCC2 477651427 ZUMCAWBFTTWBFX-INIZCTEOSA-N 395.553 5.250 30 20 GKED C=C(C)[C@H](NCc1coc(-c2ccc(OCC)cc2)n1)c1ccc(F)c(F)c1 481610260 AJMRCBDDYURLLX-NRFANRHFSA-N 384.426 5.426 30 20 GKED N#CCCn1cc(CN[C@H]2CCC[C@H](c3ccccc3)C2)c(-c2ccccc2)n1 486853995 AOECWNHRRAWZEB-UPVQGACJSA-N 384.527 5.280 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(C(F)F)ccc1Cl 497261331 MCXFSQCYCKUPLZ-UHFFFAOYSA-N 380.822 5.506 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 499304643 CFJZFIXMHLWXKH-UHFFFAOYSA-N 389.524 5.217 30 20 GKED Cc1cc(N[C@@H](c2ccccc2)c2ccccn2)n2c(nc3ccccc32)c1C#N 502084000 DWKGGTVCDCLLKI-DEOSSOPVSA-N 389.462 5.264 30 20 GKED Cc1ccccc1NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 502468428 NDKPGLGXYCDVIC-UHFFFAOYSA-N 391.858 5.743 30 20 GKED N#CCCn1cc(CN2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)c(-c2ccccc2)n1 503092790 YYEOWMLOAYODPT-JWQCQUIFSA-N 394.522 5.284 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2COCc2ccccc2)c1 506372937 YRIQDHIORXSZCN-UHFFFAOYSA-N 376.843 5.181 30 20 GKED CC(C)CC(=O)Nc1cccc(CNC2CCC(C#N)(c3ccccc3)CC2)c1 507661529 VGUCRYSWBJICIR-UHFFFAOYSA-N 389.543 5.165 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccccc2)cc1Cl 510023265 LLGWRSHOCKBWRJ-OAQYLSRUSA-N 389.886 5.360 30 20 GKED N#Cc1cc([N+](=O)[O-])ccc1N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 511401004 XUWABXOKDVNXMK-KRWDZBQOSA-N 394.431 5.219 30 20 GKED CC(C)(CCC#N)CNC(=O)N1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1 513130727 XUGOJURNNGQBDF-OAQYLSRUSA-N 395.934 5.479 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(OC(F)F)cc2)nc2sccc2c1=O 513247145 KJHGQGRZMKAKBH-NSHDSACASA-N 394.468 5.099 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1 513965474 ZIVLKLCNTQEJCX-UHFFFAOYSA-N 392.286 5.318 30 20 GKED Cc1cc(Cl)c(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1F 518824581 FDHZKLXZJXYEHU-CYBMUJFWSA-N 392.883 5.199 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccs1 520197894 SKKKOHYSJSIBSB-RDJZCZTQSA-N 387.574 6.051 30 20 GKED CO[C@@](C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 520715277 PGLSQLFGDFJACN-XMMPIXPASA-N 386.451 5.159 30 20 GKED C=CCOc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)c1 521208052 CBNNLKWJCLITDY-AWEZNQCLSA-N 378.394 5.495 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCc2ccccc2)cc1C 522708390 SLZAECAQIBWHKE-UHFFFAOYSA-N 392.524 5.856 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2cccc(CC#N)c2)nc1-c1ccccc1 525334435 VOZNXJOVYJRNLI-NRFANRHFSA-N 399.494 5.508 30 20 GKED CC[C@H]1CCCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 525345469 PAFYTDPLYRKZHE-FQEVSTJZSA-N 395.478 5.463 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)c1nccn1C 530500169 TXPQLUDZYCOLQU-JOCHJYFZSA-N 388.515 5.183 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1csc(-c2ccccc2OC)n1 531342748 OXVLZJNAABICRC-UHFFFAOYSA-N 380.513 5.016 30 20 GKED C=C[C@H](CC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccccc1 536163532 PNSDNJPICMBYGK-APWZRJJASA-N 385.891 5.196 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(C)cc1-c1nc2ccccc2[nH]1 537298967 WAKVNRMBSRESNQ-UHFFFAOYSA-N 377.488 5.240 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC/C=C/c2ccccc2)cc1 537584674 NKQVTAUHEOGCCA-RMKNXTFCSA-N 384.504 5.294 30 20 GKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 540129021 SQPASRADZDPHPC-FXAWDEMLSA-N 377.488 5.126 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 540472439 DCTKGZDMTQPRMX-UHFFFAOYSA-N 381.785 5.305 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)C(=O)Nc1ccccc1Br 541173994 WIVBRRFNBBQLEP-SNVBAGLBSA-N 395.709 5.093 30 20 GKED N#Cc1cc(C(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)ccc1Cl 542529764 RXDBBQMMSABSMR-UHFFFAOYSA-N 387.870 5.078 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc(Cl)ccc2SC2CCCC2)n1 542650240 QNLHXIKWTPJGQT-HNNXBMFYSA-N 376.934 5.630 30 20 GKED C=CCn1c(SCc2ccc(Cl)cn2)nnc1-c1ccc(Cl)cc1 554425568 IAKZZLIYTVWDRT-UHFFFAOYSA-N 377.300 5.125 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cn(C2CCCC2)nc1-c1ccccn1 557199967 NXIXVZSTHZFTIU-HSZRJFAPSA-N 397.526 5.099 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCC1CCC(C#N)CC1 567012263 OHGYWPWWXPTVIL-VIQWUECVSA-N 381.545 5.351 30 20 GKED Cc1csc(NC(=O)[C@@H](C)Sc2ccnc3cc(Cl)ccc23)c1C#N 569167963 BUKAVKWOKXDNBT-LLVKDONJSA-N 387.917 5.249 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 573361076 VPLKFFFINFZUDQ-UHFFFAOYSA-N 384.407 5.335 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccc(C#N)cc1Cl 573663420 CTNCBFQBSPAUBJ-AWEZNQCLSA-N 379.891 5.074 30 20 GKED CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589363351 DAFHEOVGSTWAJW-SFHVURJKSA-N 378.476 5.178 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591865385 RQDGRHTXRVNHHJ-LBPRGKRZSA-N 397.347 5.437 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C[C@@H](C)C1(F)F 599736046 BUUYQDDDXKESOR-HUUCEWRRSA-N 385.414 5.106 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(-c4ccccc4Cl)o3)[nH]c12 605362350 CHPMUNGRTGMBKY-CQSZACIVSA-N 375.815 5.275 30 20 GKED Cc1ccnc2sc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c(C)c12 609431681 TWZYLQJCDADINH-ZDUSSCGKSA-N 381.526 5.560 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccc(F)cc2)CCC1 609436745 SJJVIKOOEWWGAQ-MRXNPFEDSA-N 397.519 5.463 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)cn1 609643299 RMZXBEGIWLTFTR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1cc(NC(=O)c2occc2COc2cccc(C#N)c2)ccc1OC(C)C 610186182 IAYMHXVCZKYDFB-UHFFFAOYSA-N 390.439 5.078 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)cc2)c1 610321933 UTBWDBWDCLJRRF-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@H](Cc1ccc(F)cc1)C(C)C 610406606 GIQJQWPUCFZZKM-HTAPYJJXSA-N 381.495 5.057 30 20 GKED CCN(C(=O)NCc1ccc(C#N)c(Cl)c1)[C@H](C)c1cc2ccccc2o1 619770220 ZTLLAEZBUOUWCT-CQSZACIVSA-N 381.863 5.251 30 20 GKED CC(C)c1nocc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 630009293 MWMPDBFFQDDGEB-UHFFFAOYSA-N 398.278 5.340 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1C[C@H]2CCC[C@@H]2C1 646439050 QNHSFJFIWWGSRN-GHMZBOCLSA-N 398.322 5.240 30 20 GKED C=C(C)Cn1c(SCCO[C@H](CC)c2ccccc2)nnc1-c1ccncc1 651191647 IRFQWIJFAQNLRW-HXUWFJFHSA-N 394.544 5.176 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Nc1ccc(COC(C)(C)C)cc1 674486712 BPCBCJWSBBAPRU-KRWDZBQOSA-N 386.561 5.078 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(F)c1 675739271 WZXGHEIEIKVILI-GJTWSCIVSA-N 375.303 5.525 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 684227561 BDRFZNOQGMQMDH-GZMMTYOYSA-N 390.274 5.145 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)cc3)o2)cc1NC(C)=O 726429337 STUYYZOHFCFMKA-NTMALXAHSA-N 395.842 5.463 30 20 GKED Cc1ccc(-c2csc3ncnc(NCc4ccc(OCC#N)cc4)c23)cc1 727826468 UQQUZJQJJRPTAE-UHFFFAOYSA-N 386.480 5.181 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 730071679 QHCYDNIPUDKCNH-SJLPKXTDSA-N 378.497 5.454 30 20 GKED N#CCOc1cccc(/C=C/C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 730149319 GENZBLXIHIEAKV-SNAWJCMRSA-N 399.290 5.523 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(Cl)s1 731040298 QLMNTWHPYMCWBW-LBPRGKRZSA-N 396.990 5.668 30 20 GKED C[C@H](CC#N)Sc1ccccc1N=Cc1cc(Br)ccc1O 731317856 FJNJRZRRLUFBSI-GFCCVEGCSA-N 375.291 5.300 30 20 GKED N#CCOc1ccc(CSc2nccn2-c2ccc(C(F)(F)F)cc2)cc1 731938386 OZDQEOXRJIKAKK-UHFFFAOYSA-N 389.402 5.086 30 20 GKED C#CCCOc1ccc(CN[C@H](c2ccccc2)c2ccc(OCC)cc2)cc1 733324872 HZJULGNTJCKODK-AREMUKBSSA-N 385.507 5.367 30 20 GKED Cc1ccc(-c2cc(C(=O)OCc3ccc(OCC#N)cc3)c3ccccc3n2)o1 733382476 ZOGWDWRBYKQLNJ-UHFFFAOYSA-N 398.418 5.063 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 734679457 MMXIEFSQZZPIIE-RDTXWAMCSA-N 377.410 5.120 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3cc(-c4ccccc4)on3)c2)cc1 736013440 SYGXAUPDQRVXET-UHFFFAOYSA-N 395.418 5.187 30 20 GKED Cc1ccc([C@@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 738894481 FXMBRLXLPWOONM-YADARESESA-N 383.495 5.576 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744036920 KARZFBFBDRHGBQ-QAPCUYQASA-N 378.472 5.394 30 20 GKED Cc1ccc(-c2noc([C@@H](C)ON=Cc3ccccc3OC(C)C)n2)cc1F 744442696 DYYAWHJHVAUTSC-OAHLLOKOSA-N 383.423 5.083 30 20 GKED Cc1ccc(C)c(-n2nc(C)c(/C=C\C(=O)c3cnn(C(C)C)c3)c2Cl)c1 746686443 DFSQACIKJSELTQ-HJWRWDBZSA-N 382.895 5.124 30 20 GKED C=CCc1cc(/C=C(\Cl)c2nc3cc(F)c(F)cc3[nH]2)cc(OC)c1O 747063406 JOUVQAHWYVLVBS-SDQBBNPISA-N 376.790 5.021 30 20 GKED C=CCC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 749841224 VGCMXBZYQSAJMC-IIBYNOLFSA-N 388.433 5.793 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1ccc(Cl)c([N+](=O)[O-])c1 751513908 TYSQYNFYIHZHRI-XQRVVYSFSA-N 376.846 5.329 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2cccc(F)c2)CC1 752678004 LMOUCYCYPAMCEM-MRXNPFEDSA-N 397.519 5.489 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2cccc(OC)c2)cc1 753392809 DXRSKJPXYFRVDU-PNLZDCPESA-N 392.499 5.050 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCCCCC(C)(C)C#N 768845485 LNDLELXATGKUMF-UHFFFAOYSA-N 395.286 5.834 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1 774162280 ICSGOPFOGRJMFV-UHFFFAOYSA-N 399.516 5.517 30 20 GKED C[C@H](C#N)Oc1ccc(CNC2(c3c(Cl)cccc3Cl)CCC2)cc1 775041981 WITOLCUVTJTEBN-CQSZACIVSA-N 375.299 5.453 30 20 GKED C=CCN(CCc1ccco1)C(=S)Nc1ccc(Oc2ccccc2)cc1 778533560 OAITUERCTJJETM-UHFFFAOYSA-N 378.497 5.499 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(CCc1ccccc1F)C1CCCC1 780666686 CBQNEYATQGIPMX-KRWDZBQOSA-N 395.478 5.136 30 20 GKED C[C@@H](Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(C#N)cc1F 781422356 OREFTALPHPBJRH-OAHLLOKOSA-N 377.488 5.495 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(Br)cnc1Cl)c1ccccc1 787951053 ZLSPOVBNLJGFLO-CQSZACIVSA-N 379.685 5.186 30 20 GKED Clc1sc(Cl)c2c1CCCC2=NNc1nnc(-c2ccccn2)s1 788024323 NQMKPTGYGRMUQQ-UHFFFAOYSA-N 396.328 5.121 30 20 GKED CN(CCC(F)(F)F)[C@H](C/N=C\c1ccccc1O)c1ccc(Cl)cc1 790572707 BCVNEGIEESUQNW-SAMUYDCASA-N 384.829 5.090 30 20 GKED C=CCC1(C(=O)O[C@@H](C)c2nnc(-c3ccc(Cl)c(Cl)c3)o2)CCC1 791558316 JMAGENOLMIVYBN-NSHDSACASA-N 381.259 5.394 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(O)ccc2C(F)(F)F)cc1 793043639 NEYLTZKRKWSKMX-LJQANCHMSA-N 396.368 5.319 30 20 GKED CC(C)[C@@H](c1ccc(Cl)cc1)c1noc(Cc2ccc(OCC#N)cc2)n1 809500106 CUGSTTQDJAOMSX-FQEVSTJZSA-N 381.863 5.004 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1cccc(OC(F)(F)F)c1 810147461 GCAKDSHODZIECN-NSHDSACASA-N 388.311 5.326 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@@H](c1ccccc1)c1ccc3c(c1)CCCO3)CC2 810225619 ISNZXZBFFZPKBB-RSXGOPAZSA-N 380.491 5.250 30 20 GKED Cc1sc2ncn(N=Cc3cc4ccccc4o3)c(=O)c2c1-c1ccccc1 812402688 HTAWZFOUBFIWBL-UHFFFAOYSA-N 385.448 5.062 30 20 GKED N#CCCC[C@H](NC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1ccccc1 817320144 YMHGNKGCDPCFCI-ARKBFRDHSA-N 389.886 5.453 30 20 GKED O=C(N[C@@H](c1ccccc1)C(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 857441578 QWZFFGFXEFKHKB-KGLIPLIRSA-N 379.275 5.136 30 20 GKED N#C[C@@H](CCc1ccccc1)c1nc(-c2ccc(COc3ccccc3)cc2)no1 904446477 OETYGSNAQOPNSV-JOCHJYFZSA-N 395.462 5.556 30 20 GKED Clc1ccc(CNN=Cc2ccccc2OCc2cccnc2)c(Cl)c1 915962039 MGURAQXGARGLIM-UHFFFAOYSA-N 386.282 5.091 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)n1 916137279 YEHMCSOOXMMMEO-CSKARUKUSA-N 396.277 5.667 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCCc1ccc(Cl)cc1 916911010 YZBMKHQEGDPBLY-HXUWFJFHSA-N 396.918 5.135 30 20 GKED N#C[C@@H](C(=O)c1sc2ccccc2c1Cl)c1nc(-c2ccccc2)cs1 917026054 WABFEUVYBVYQDE-AWEZNQCLSA-N 394.908 6.168 30 20 GKED Cc1ccc(C(=O)Nc2cccc(C/N=C\c3cc4ccccc4nc3O)c2)cc1 917557443 MXDJNWGKLBVJBV-QQXSKIMKSA-N 395.462 5.120 30 20 GKED O=C(/C=C\c1ccccc1OC1CCCC1)c1ccc(N2CCCC2=O)cc1 920065953 ONMMQOZHEVFJLT-SSZFMOIBSA-N 375.468 5.031 30 20 GKED C=C(C)C[C@H](NCc1ccccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776139140 VYMPKLBLOJUWSN-KRWDZBQOSA-N 380.271 5.295 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc3oc(C(=O)O)cc3c1)CCO2 1776374834 WJXLWJDVKPBGEW-SXGWCWSVSA-N 376.408 5.303 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2cccc(C)c2C)c1 1776787410 DYKIZBJAPUTPLZ-XMMPIXPASA-N 397.559 5.958 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776950962 YLWAUZLBMHIUKD-WDZFZDKYSA-N 394.448 5.359 30 20 GKED N#CCCn1cc(C(=O)CSc2nc3ccccc3s2)c2ccccc21 5629133 IXEAYTJCDAWYJA-UHFFFAOYSA-N 377.494 5.140 30 20 GKED C=CCn1c(SCc2cc(-c3ccco3)on2)nnc1-c1ccc(Cl)cc1 8205131 JJVHCQQTGCNEPY-UHFFFAOYSA-N 398.875 5.325 30 20 GKED CCCOc1ccccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 32059376 MIEJEOQTWOUUMK-UHFFFAOYSA-N 386.451 5.178 30 20 GKED Cc1ccc(-c2noc([C@H](C)Nc3ccccc3SC[C@H](C)C#N)n2)cc1F 108408018 QCHUPLVMYAIHNW-HIFRSBDPSA-N 396.491 5.609 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCOc2ccccc21)c1nc2cc(Cl)ccc2s1 118143504 VAYSCTBIIZZKFX-SWLSCSKDSA-N 382.872 5.082 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(NC(=O)CCC)ccc1Cl 120090829 GNGLPQUAPWKXGU-UHFFFAOYSA-N 391.924 5.360 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3nc(C4CC4)cs3)c2)cc1 123181274 RSTJTXRMOBEVKJ-UHFFFAOYSA-N 390.468 5.006 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](c1ccccc1)c1nccs1)c1ccccc1 160510696 ZWWRBEBOFWTSDC-VQTJNVASSA-N 377.513 5.239 30 20 GKED O=C(Nc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 178487070 BGXSBYXIGBGKPW-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(F)c(F)c1 186449226 FSPUGRYYEUYRAW-QKKBWIMNSA-N 385.458 5.217 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 188072516 LBEMYXGDVHTJLM-UHFFFAOYSA-N 386.536 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 189908838 GGVPNWWJTHDIKL-UHFFFAOYSA-N 379.460 5.273 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCN(c2ccccc2)CC1 191517885 VAOHHXTXTDCWBJ-UHFFFAOYSA-N 377.532 5.283 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3)o2)nnc1-c1ccccc1F 192623880 KEVUJHGBHDCXMF-UHFFFAOYSA-N 392.459 5.218 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1 194889072 HKCRYYYWYFUHCD-QFIPXVFZSA-N 394.421 5.070 30 20 GKED CCOc1ccc([C@H](NCc2ccc(N(C)CCC#N)cc2)c2ccccc2)cc1 236851761 VSSFHYCNDDVJKV-AREMUKBSSA-N 399.538 5.314 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 248633611 IYULZJVWTYPSGL-KWCYVHTRSA-N 390.430 5.240 30 20 GKED N#Cc1ccc(NCc2cccc(NC(=O)c3cccc(F)c3)c2)cc1Cl 303519377 UYJZEFVTHGDYQE-UHFFFAOYSA-N 379.822 5.215 30 20 GKED O/C(=N/[C@@H]1CCCC(F)(F)C1)[C@H]1CCC[C@H]1/C(O)=N\[C@@H]1CCCC(F)(F)C1 328979886 XPUNFZDALNZTQK-TUVASFSCSA-N 392.437 5.472 30 20 GKED C[C@H]1CCC[C@@H](/N=C(/O)C2(C/C(O)=N/[C@H]3CCC[C@@H](C)C3)CCOCC2)C1 330139822 WOEGCGVPCDRYFL-YDZRNGNQSA-N 378.557 5.244 30 20 GKED C[C@@H]1CCN(C(=O)c2cccc(SCC#N)c2)c2cc(Cl)ccc2S1 429825214 XJPOBRMBSDPLJE-CYBMUJFWSA-N 388.945 5.487 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c(Cl)c1 430375136 XXKHZTTYZUOLDA-UHFFFAOYSA-N 399.837 5.786 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ncc(-c2ccccc2)o1 431977326 LPDBOLXQFHGUIW-XLIONFOSSA-N 388.471 5.137 30 20 GKED CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 432868731 XDQPDUMXNUYREU-HRAATJIYSA-N 399.535 6.081 30 20 GKED C=CCN(C(=O)c1ccc(OC)c(C2CC2)c1)c1nc(-c2ccccc2)cs1 435652116 AEDUHWKMZUCGHR-UHFFFAOYSA-N 390.508 5.529 30 20 GKED CCSc1ccc(Cl)cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 437561892 XPASZKTUDLEFNB-ZDUSSCGKSA-N 390.961 5.956 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 438076681 UHHCJEKIUGRZSM-GHTZIAJQSA-N 393.556 6.148 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC(C(C)C)CC2)cc1 438187469 JEBDYMUXEMUYNI-UHFFFAOYSA-N 393.487 5.259 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 438863606 ZYLPOIFSFBXDJU-WOJBJXKFSA-N 399.441 5.010 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc(Cc2ccccc2)no1 439604843 UGMMLAJKAQITMF-QGZVFWFLSA-N 396.450 5.497 30 20 GKED CO[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 440919025 DKRALPPYFBVSOX-JBACZVJFSA-N 397.906 5.075 30 20 GKED C[C@H]1COCC[C@@H]1c1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 442691855 YSCRLWSUEWBVLC-BBRMVZONSA-N 395.846 5.194 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H](C)c1cccc(C#N)c1 442895486 FCOKMLGDBINPQL-CQSZACIVSA-N 398.919 5.255 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cc(NC(=O)CC)ccc2Cl)CCCC1(C)C 444845558 HHWWNJZFTPETSW-QGZVFWFLSA-N 377.916 5.287 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2Cc3ccccc3C[C@H]2c2ccccc2)cc1 448383987 CQUYTDRWBQCMPZ-DEOSSOPVSA-N 395.506 5.819 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1cccc(Cl)c1 453470127 ZMXHJFNSLKFZND-MOPGFXCFSA-N 386.927 5.091 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)C1 456041197 BSMASMAJHUYPRO-ROUUACIJSA-N 395.572 5.378 30 20 GKED C=C(C)Cn1c(COCc2ccccc2)nnc1N(Cc1cccs1)C(C)C 460797177 UCRSYMXBZREMAI-UHFFFAOYSA-N 396.560 5.048 30 20 GKED Cc1nc(Sc2nnc(-c3cccc4ccccc34)o2)c(Cl)cc1C#N 461975824 VYVAVLJAZJBTAE-UHFFFAOYSA-N 378.844 5.270 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3ccc(C4CCCC4)cc3)ccc21 462902619 KZGBNVGIFVGHSN-UHFFFAOYSA-N 387.527 5.539 30 20 GKED COc1ccc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)c(C(F)(F)F)c1 463584014 UARQSOJJVARSMR-UHFFFAOYSA-N 399.237 5.263 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 471279053 XDKYCALYMJSRJI-GOSISDBHSA-N 379.529 5.549 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(COC(C)(C)C)c1C 475967605 VCIMFELFRSOLTK-UHFFFAOYSA-N 384.495 5.669 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cccc2c1OC(C)(C)C2 476118964 OTXYVRUQLXLSFG-UHFFFAOYSA-N 379.500 5.270 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(-c2ccccc2)c1C 480995971 YRYMTMUSQYUIBL-UHFFFAOYSA-N 386.908 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCN(c2ccccc2F)CC1 482229617 GJGRZCVEDRIPAR-UHFFFAOYSA-N 395.522 5.422 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](c1ccccc1)C(C)C 482815986 HFSQPNZZTIMOLT-QFIPXVFZSA-N 399.494 5.822 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 487215389 BOPCXJQTLOHEHI-QFIPXVFZSA-N 394.478 5.190 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)CNc1ccccc1SC[C@@H](C)C#N 487400745 QKGAYTVOCNOPPW-IBGZPJMESA-N 395.572 5.098 30 20 GKED C=CCn1c(SCc2c(C)nc3ccccn23)nnc1-c1cccc(Cl)c1 489617938 CZFFCSPDTDEGOA-UHFFFAOYSA-N 395.919 5.033 30 20 GKED Cc1ccnc2sc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c(C)c12 489840195 RCOGNLGZKPBONF-GFCCVEGCSA-N 397.912 5.666 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@H](C)c1ccccc1C(F)(F)F 495550006 YMHYKEXOLHSDTP-HUUCEWRRSA-N 396.478 5.021 30 20 GKED COc1cccc([C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)c1 496802196 HFROUCZSKIULJM-MRXNPFEDSA-N 388.492 5.209 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)N[C@H](C#N)c2ccc(Cl)cc2)C1 501208866 LIBBNWKLZOOTGK-NSISKUIASA-N 376.928 5.177 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 502576034 RMAYPFHEUCMEQN-OPAMFIHVSA-N 399.535 5.145 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3c(c2)Cc2ccccc2-3)c1 502679323 KDOVBLMXNXYXMW-UHFFFAOYSA-N 383.451 5.584 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1ccccc1)c1ccc(C)cc1 503723500 QSTHTGXKCCLLLY-JOCHJYFZSA-N 376.525 5.544 30 20 GKED C[C@@H](Nc1cccc(C(F)F)c1)C(=O)Nc1sc2c(c1C#N)CCCCC2 507845111 PTYRDRIJTBGIQO-GFCCVEGCSA-N 389.471 5.265 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c[nH]cc2-c2ccccc2)cc1 507906813 DEDRUDOKBXPMBK-UHFFFAOYSA-N 379.419 5.598 30 20 GKED COc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc(OC)c1C(C)C 511615402 GVRAMOGHKQFGDE-UHFFFAOYSA-N 386.517 5.310 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1cccc(Oc2ccnc3ccccc23)c1 512957856 WXHHKGPBMXUANS-UHFFFAOYSA-N 397.409 5.219 30 20 GKED CC[C@H](NC(=O)c1cccc(COc2ccccc2C#N)c1)c1cccs1 513239342 XHUMCXUUQYTCPQ-IBGZPJMESA-N 376.481 5.080 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 518740252 RDWHYFIBXJQSEZ-PXNSSMCTSA-N 396.556 6.000 30 20 GKED Cc1nc2ccc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)cc2nc1C 519126679 IWPUAPSIHJZUIB-UHFFFAOYSA-N 394.434 5.163 30 20 GKED N#C[C@H](NC(=O)CSc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 521353001 ZZODLKGVMDTZRL-AWEZNQCLSA-N 385.703 5.120 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(C#N)c(Cl)c2)[C@@H](C)C2CC2)cc1 521804266 UECNMKGXNAKSOS-AWEZNQCLSA-N 383.879 5.053 30 20 GKED N#Cc1c(NC(=O)[C@H]2CSc3ccccc32)sc2c1-c1ccccc1CC2 522816208 WUVPJUGUBGFUSK-KRWDZBQOSA-N 388.517 5.213 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c1 524459904 GTSXTWWZEVZSKH-UHFFFAOYSA-N 393.468 5.618 30 20 GKED C=CCCOCCCCC(=O)N(c1ccccc1)c1nc2ccccc2s1 539517240 RXIALTNFLUQUCT-UHFFFAOYSA-N 380.513 5.724 30 20 GKED Cc1cc(Br)c(NC(=O)c2ccc(C#N)c(Cl)c2)cc1Cl 548636826 MIPSPAWAXUAFRF-UHFFFAOYSA-N 384.060 5.188 30 20 GKED C[C@H](NCc1cnc2ccc(C#N)cn12)c1ccccc1-c1ccc(Cl)cc1 551547667 SQFOHVGLPXMUNJ-INIZCTEOSA-N 386.886 5.377 30 20 GKED CCC[C@@]1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOC1 554133696 CRVWMDYNSSQTLI-SIKLNZKXSA-N 397.906 5.076 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3(c4cccnc4)CCCC3)cc2)c1 572677263 AUOIPSYJSYCVKF-UHFFFAOYSA-N 383.451 5.196 30 20 GKED Cc1sc(C(=O)N(CCC#N)c2ccc(F)cc2)cc1-c1ccc(F)cc1 572945006 RFDSWLAFCQPMII-UHFFFAOYSA-N 382.435 5.562 30 20 GKED Cc1c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)sc2ccc(C#N)cc12 576305203 RLMNDGMEKJZSLG-KRWDZBQOSA-N 387.508 5.101 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnn(C(C)C)c2-c2ccccc2)n1 584089236 AXZXWAGDYYKNTJ-INIZCTEOSA-N 378.501 5.201 30 20 GKED C[C@H](CC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccccc1F 588360847 FIUVAGJDGHGVPU-WOPDTQHZSA-N 399.350 5.345 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N3CCC[C@@H](CC#N)C3)c2)c(C)c1 597918401 NOULZYPFPJGBGO-IBGZPJMESA-N 378.541 5.362 30 20 GKED CCCN(C(=O)Cc1ccc(C(F)(F)F)cc1)c1cc(Cl)ccc1C#N 609286083 KRDZUISVMOILTP-UHFFFAOYSA-N 380.797 5.216 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(Cl)cc1Cl 609377367 CXVFUNKFAAQFFC-LBPRGKRZSA-N 379.312 5.426 30 20 GKED C[C@H](CC#N)NC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196926 PHQQHKOMFXLGGU-GFCCVEGCSA-N 379.312 5.318 30 20 GKED C[C@H](NCc1ccc(C#N)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 610341975 RAVZXNXDEJYGPY-JTQLQIEISA-N 390.302 5.586 30 20 GKED CC(C)[C@@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610349932 LUNNUDMQEMDNDG-AUUYWEPGSA-N 389.421 5.335 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(COC(C)(C)C)cc1 610632259 FDAUUDCIFBLOJN-INIZCTEOSA-N 397.544 5.897 30 20 GKED COc1ccccc1[C@@H]1CCCCN1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 610936429 USUGASWSJFTDRX-FQEVSTJZSA-N 393.487 5.113 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2nc3c(s2)CCCCCC3)c(Cl)c1 611096915 SFCGLBOZZWZRBS-UHFFFAOYSA-N 380.300 5.233 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@H]1CCCCO1 611480914 TVVDBLCFDJQEMD-NYSBEXSLSA-N 397.906 5.075 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2ccc(-c3ccc(Br)s3)s2)C1 612246479 YWSWSZIBRXONLK-MRXNPFEDSA-N 395.347 5.005 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3scnc3C3CCCC3)cn2)c1 612663963 MFCBGEPOKBYVLL-UHFFFAOYSA-N 390.468 5.112 30 20 GKED O=C(c1cc2ccc(F)cc2s1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618300932 HRHZMQGGVCATTN-UWVGGRQHSA-N 399.331 5.243 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 618754195 LBKUUHSKFNLEDT-INIZCTEOSA-N 395.331 5.021 30 20 GKED Cc1c(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)oc2c(F)cccc12 619126367 PPIYFKDNJJCFGX-UHFFFAOYSA-N 399.306 5.664 30 20 GKED Cc1cc(C(F)F)oc1C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 623983602 GIELDMQBDPPOOX-HTQZYQBOSA-N 393.274 5.165 30 20 GKED C[C@@H]1C[C@@H](Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c2nccn21 647323528 WDXPQXPVKKGTOG-BXKDBHETSA-N 381.295 5.290 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C(F)(F)F)nn(CC)c1C(F)F 669675678 DXLABMXDJVAETC-UHFFFAOYSA-N 387.352 5.230 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc(Cl)c1Br 671279025 XYLQKXJXVSVMTM-CQSZACIVSA-N 399.675 5.449 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726484119 DQSPBZDHRNWCMN-UHFFFAOYSA-N 397.853 5.449 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1csc2ccccc12 730067846 HCFOPQNSGMEKHN-MRXNPFEDSA-N 380.513 5.369 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Br)s2)c(Cl)c1OC 730434461 NCPUHCJYVJHXRS-HYXAFXHYSA-N 387.682 5.077 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3Cl)s2)c1 733800024 BKQVALAOEXLJRR-KRWDZBQOSA-N 396.943 6.039 30 20 GKED CC(C)C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 741111777 YLZOAABOEXNCCS-IRXDYDNUSA-N 381.426 5.438 30 20 GKED COCCOc1cccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)c1 741842347 JYHQUDOWJSBXGD-YHYXMXQVSA-N 396.430 5.262 30 20 GKED O=C1/C(=C\c2csc(COc3ccc(Cl)cc3)n2)CCc2c(O)cccc21 742435469 UHRLHWRYFJQNTR-RAXLEYEMSA-N 397.883 5.294 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)C1CCC(c2ccccc2)CC1 744028670 NGFPPSOEBZACRT-POOLCLQXSA-N 396.490 5.461 30 20 GKED Cc1sc2ncn(N=Cc3coc4ccccc34)c(=O)c2c1-c1ccccc1 746556911 HERIVWQVFORXGD-UHFFFAOYSA-N 385.448 5.062 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1C(F)(F)F 747197952 PGQAQALLMONOQK-UNJUUPHPSA-N 378.419 5.565 30 20 GKED CCN(CC)c1ccc(C=Nc2ccccc2OCc2cscn2)c(O)c1 749451749 JLYRTFIPSZLLMV-UHFFFAOYSA-N 381.501 5.025 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccnc1 751543831 RRKIPLWEXDVYFY-RPWUZVMVSA-N 398.510 5.298 30 20 GKED C[C@@H](OC(=O)c1cc(C#N)cs1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753379757 GZNOBJMRNAAIFV-SECBINFHSA-N 393.251 5.500 30 20 GKED C[C@H](OC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)C(C)(C)C#N 753628599 KSSQDFZMWKKVQI-NSHDSACASA-N 379.243 5.276 30 20 GKED COc1ccc2oc([C@H](C)NCc3cc(Cl)ccc3OCC#N)c(C)c2c1 754739950 WYGQNORYHADTKB-AWEZNQCLSA-N 384.863 5.156 30 20 GKED C#CC[C@@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccccc1 756996074 NPCLFIUMPRCFTB-HSZRJFAPSA-N 388.898 5.447 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2cccc(-c3cccnc3)c2)cc1 768491775 FRLYOLISNGIVHG-JYRVWZFOSA-N 385.467 5.175 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@H](F)c1ccccc1 769375910 LSPKGJRYBYWZAN-MRXNPFEDSA-N 382.382 5.360 30 20 GKED Fc1ccccc1NC(=S)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 776203357 NOCXBJWXHCZFNT-CYBMUJFWSA-N 396.331 5.435 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1F)C(C)(C)C 780678045 KFLWKDJTGKTTIQ-YJYMSZOUSA-N 387.430 5.165 30 20 GKED Cc1noc(C2CC2)c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784832876 DTXDDJHDJIUEQR-AWEZNQCLSA-N 383.860 5.127 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(CC[C@@H](O)c2ccccc2)c1)c1ccccc1 793629853 SQLBSZJXGPXXAV-UKILVPOCSA-N 398.506 5.379 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)(F)F)s2)cc1 796791049 BOCSZZSHWCZYRV-SMDDNHRTSA-N 394.418 5.242 30 20 GKED C#Cc1ccccc1CC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 810426465 SJIFOVNIDQVESF-QFIPXVFZSA-N 398.506 5.353 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)[C@@H](O)c2ccccc2)c(C(F)(F)F)c1 814170260 UAELIFIGXYLWLY-YADHBBJMSA-N 396.412 5.142 30 20 GKED CCc1cc2oc(=O)cc(CN[C@H](CCCC#N)c3ccccc3)c2cc1Cl 814660088 ROEJIZAAIINJPO-OAQYLSRUSA-N 394.902 5.534 30 20 GKED CC(=NNc1nc2cc(F)c(F)cc2[nH]1)c1sc(Cc2ccccc2)nc1C 814796319 TVKXOCCQDZEPPW-UHFFFAOYSA-N 397.454 5.033 30 20 GKED CC(=NNc1ccc(Br)cn1)c1sc(-c2ccccc2)nc1C 814832420 OAWZDPWDHSWSLR-UHFFFAOYSA-N 387.306 5.112 30 20 GKED Cc1cncc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 878671435 AENBCKKMXWXYMS-QFBILLFUSA-N 380.517 5.011 30 20 GKED C=C1CCC(C(=O)OCc2csc(N(C(C)=O)c3ccccc3CC)n2)CC1 885653584 QUHFJOVHEAHDIB-UHFFFAOYSA-N 398.528 5.180 30 20 GKED CC(C)(C#N)CC[S@@](=O)Cc1nc(-c2cccc(Cl)c2Cl)cs1 905209565 KZQGXQGTYAJJBV-HSZRJFAPSA-N 387.357 5.305 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)oc12 915085409 LNGXBPOTHPYYJG-FQEVSTJZSA-N 382.419 5.349 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916679328 OMHCKZJHAMJVMZ-DEOSSOPVSA-N 399.494 5.405 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(Cl)c(Cl)c1 916899594 JZLPARORJIRNIE-HNNXBMFYSA-N 389.282 5.079 30 20 GKED COc1cccc(COc2cccc(Cl)c2C=Nn2cnc3ccccc32)c1 917541169 QTCNHWSTHXRSPV-UHFFFAOYSA-N 391.858 5.160 30 20 GKED CC(C)(C)c1ccc(-c2csc(NC(=O)c3ccccc3OCC#N)n2)cc1 919809064 BMDAKTYDDYQISM-UHFFFAOYSA-N 391.496 5.262 30 20 GKED CCCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 920324110 LDEWAPKDBLNHRZ-OAQYLSRUSA-N 398.462 5.393 30 20 GKED O=C(O)c1cc(-c2ccc(C=NNc3cccc(Cl)c3Cl)o2)ccc1O 1776080844 GENBFIUQVKLLEQ-UHFFFAOYSA-N 391.210 5.103 30 20 GKED Cc1cc(Cl)ccc1NN=Cc1cccc(OCc2cccc(C(=O)O)c2)c1 1776104804 YWGDNPXURIAVJN-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(OC)c2)cc1 1776125780 SGHKMUNDCZORGL-OQLLNIDSSA-N 396.483 5.639 30 20 GKED C[C@@H](Oc1cccc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)c1)C(=O)O 1776472013 UCMKNDJREHMADZ-MDXIRLPMSA-N 397.279 5.119 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1 1776785806 BECLJIFCIJHRCA-JOCHJYFZSA-N 381.516 5.015 30 20 GKED CCCCCCCOc1ccc(/C=C/c2ncc([N+](=O)[O-])cc2C(=O)O)cc1 1776788286 XCPXWPXEFAIKGD-FMIVXFBMSA-N 384.432 5.208 30 20 GKED C=CCN(CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)Cc1cccs1 19540376 ISNXPZUNWIIFSO-UHFFFAOYSA-N 388.842 5.047 30 20 GKED CCN(C(=O)CCOc1ccc(Cl)cc1Cl)[C@H](C)c1ccc(C#N)cc1 65839828 DAWAUPWLOOBXTO-CQSZACIVSA-N 391.298 5.244 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66953940 BABHABUMMQQMCU-CABCVRRESA-N 387.936 5.959 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)nc1 108981165 QMQXOAKVCBAUQA-MRXNPFEDSA-N 389.480 5.520 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 112128896 FNNJRTUINPIVQM-UHFFFAOYSA-N 393.531 5.242 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H](C)c1c(C)n[nH]c1C 119121607 GDCLGDMLDALHMP-HNNXBMFYSA-N 388.471 5.131 30 20 GKED COc1ccc(CN[C@@H](CCC#N)c2ccccc2)cc1OCc1ccccc1 130535783 VTUHMIYRDVDBOK-QHCPKHFHSA-N 386.495 5.409 30 20 GKED CCCCn1c(SCc2ccccc2C(C)(C)C#N)nnc1[C@@H](CC)N(C)C 134026432 CQMBLQNAHQLXKM-LJQANCHMSA-N 399.608 5.184 30 20 GKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 135255941 HWHNFAOULOMLEA-HRAATJIYSA-N 381.451 5.042 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 153971469 WHFSCYJISUGKSX-QXAKKESOSA-N 393.556 5.657 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 173788680 NZQCZLAZPYLWQY-AWEZNQCLSA-N 393.874 5.153 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 174730114 ANYWQFBYGYSRDY-AWEZNQCLSA-N 377.469 5.297 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc2ccccc2c1 175956469 ZYBWTYOFQUYXDG-FOIQADDNSA-N 383.476 5.338 30 20 GKED CC(C)[C@@H](NC(=O)CNc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1 178388676 PNLPMOIQFZMVIX-KSFYIVLOSA-N 399.535 5.003 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(NC(=O)c2ccccc2)c1 182566468 IGVOCSXJMBSJRQ-LJQANCHMSA-N 397.522 5.591 30 20 GKED CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 185351364 YUIOHKRQBCTXTH-RDJZCZTQSA-N 397.500 5.196 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CSc2nnc[nH]2)cc1 188071340 HQRRFSULHHAJIY-UHFFFAOYSA-N 392.528 5.201 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Br)c1F 190823684 HXRSQPGPFVLGKJ-UHFFFAOYSA-N 376.269 5.692 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1c[nH]c2ccccc12 191483222 DQDJKWRFMBDKSL-UHFFFAOYSA-N 375.516 6.074 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3ccc(F)c(F)c3)c2)cc1 207993264 JKMMTBKNDYQHFE-XGICHPGQSA-N 393.389 5.122 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccccc2OCc2ccccc2)cc1 208251773 DNMPYDCRKMCXBV-AGWAZZAUSA-N 383.447 5.453 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccccc2OCc2ccccc2)c1 236897702 FJBRMLBRZCOQJX-HSZRJFAPSA-N 386.495 5.236 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C\c1cnc(C(C)(C)C)s1 255202882 CNYLDLOSVOJPGI-CMUBDUJZSA-N 385.558 5.344 30 20 GKED N#Cc1ccc(NCc2ccc(NC(=O)c3ccco3)cc2)c(C(F)(F)F)c1 301320750 GKPBHSACBSOGHX-UHFFFAOYSA-N 385.345 5.034 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1csc(-c2ccccc2Cl)n1 303113626 CJZBWCTXRVPONV-UHFFFAOYSA-N 382.916 5.334 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl 303854186 SEYFVQADNWNJAS-MGPQQGTHSA-N 388.895 5.616 30 20 GKED N#Cc1c(NC(=O)c2cccc(Br)c2F)sc2c1CCCCC2 323135116 HEXPHPYFHWYRMX-UHFFFAOYSA-N 393.281 5.043 30 20 GKED C[C@H](/N=C(/O)N1CCC(OCC2CCCC2)CC1)c1cc2cccc(F)c2o1 329918510 GBIHZLHRBPKNIS-HNNXBMFYSA-N 388.483 5.218 30 20 GKED O=C(Nc1ccc(N=C(O)c2ccnn2C2CCCC2)cc1)N1CCCCCC1 330071088 INZMVUGPXQQGNH-UHFFFAOYSA-N 395.507 5.042 30 20 GKED O/C(=N/Cc1noc2c1CCCC2)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 330221045 QSAWRPRISNQLCN-CABCVRRESA-N 393.512 5.370 30 20 GKED C=CC[C@@H](Cc1ccccc1)NC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 416848836 XAEARYHJGYCGQI-WTYVLRPYSA-N 398.572 5.043 30 20 GKED Cc1ccnc2[nH]c([C@H](C#N)C(=O)c3ccc(-c4ccc(Cl)cc4)s3)nc12 429564670 POVDKGFFNKIXTF-CQSZACIVSA-N 392.871 5.138 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc(Oc3ccccc3C#N)c(F)c1)C2 432245584 IYZGJWJZYLYNPF-UHFFFAOYSA-N 387.414 5.346 30 20 GKED N#CCCC[C@H](NCc1cccc2c(Br)cccc12)c1ccccc1 433020780 UFQHWOKHHXRJRC-QFIPXVFZSA-N 393.328 6.127 30 20 GKED C[C@H]1c2ccccc2O[C@@H]1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438645283 XMSHWPKEQKGQGT-KQDGPHEJSA-N 395.528 5.156 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](CC(F)(F)F)c1ccccc1)c1ccccc1 438841144 OUTCFYBISRGQOY-ZWKOTPCHSA-N 375.394 5.024 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N(CCC#N)CC2CC2)cc1 438863005 XEAXMMJJPNPPSG-KRWDZBQOSA-N 379.529 5.697 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(C(=O)N[C@H](C)CC)cc2C)CCCC1(C)C 445241420 WTRCWGUNMDQQHN-YLJYHZDGSA-N 385.552 5.122 30 20 GKED CC1(C#N)CCN(C(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)CC1 446277646 QIOXLYZGCWOPBA-UHFFFAOYSA-N 388.895 5.396 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)n1 447610432 RHHGBTIVJZNAPJ-AWEZNQCLSA-N 380.435 5.596 30 20 GKED COc1cccc([C@H]2C[C@H](NC(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c1 454743244 DLKZCQZDOLJKKG-SZMVWBNQSA-N 395.528 5.015 30 20 GKED Cc1ccc(-n2c(SCCCSCC#N)nnc2-c2cccc(C)c2)cc1 466616054 KZVJBLKZWXVMSL-UHFFFAOYSA-N 394.569 5.290 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)cc1 474408629 KRULJTLWJCEXEY-UHFFFAOYSA-N 389.480 5.054 30 20 GKED C=CCn1c(SCC(=O)C(C)(C)c2ccccc2)nnc1-c1ccccc1C 475876362 YIQSLYOUNRTKPL-UHFFFAOYSA-N 391.540 5.079 30 20 GKED C[C@@H](NC(=O)NCCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 478629156 GCPYKPIMMJJGCU-CYBMUJFWSA-N 395.450 5.488 30 20 GKED CC(C)(CC(=O)Nc1cccc(COCC(F)(F)C(F)F)c1)C(F)(F)F 479740895 IUPGQIYKMUMBGT-UHFFFAOYSA-N 389.311 5.021 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)c1 482187137 UEVVDUAJQUTDIF-GOSISDBHSA-N 388.467 5.275 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc(-c3c(C)cc(C)cc3C)o2)c1C 483273868 VQSXPUNTXGBBLX-UHFFFAOYSA-N 395.528 5.241 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1 483551799 LFUPSWUCNDPJON-UHFFFAOYSA-N 395.871 5.130 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 483838541 IBMJFIZOPOMDBS-KRWDZBQOSA-N 394.824 5.517 30 20 GKED O=C(NC[C@H](c1ccccc1)C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 486538112 VNVXEHARONEPPQ-CYBMUJFWSA-N 394.290 5.312 30 20 GKED Cc1ccc2ncc(C#N)c(N3CCC(c4nc5cccc(C)c5o4)CC3)c2c1 487728443 WJRFVGCIVYRKKD-UHFFFAOYSA-N 382.467 5.249 30 20 GKED Fc1ccc([C@H](NCc2ccccc2OCC(F)(F)F)C(F)(F)F)cc1 488205840 XYPNPFSJPAVCIS-HNNXBMFYSA-N 381.291 5.160 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@H]1CCCC[C@@H]1C 498070959 FLUXKRRFXNSTEE-AOMKIAJQSA-N 378.472 5.193 30 20 GKED CN(CCC#N)C(=O)c1oc2ccccc2c1CSc1ccccc1Cl 500017708 KMIAEEQKTIRZHO-UHFFFAOYSA-N 384.888 5.364 30 20 GKED N#Cc1ccc(C2=CCN(Cc3ccc(C(=O)Nc4ccccc4)cc3)CC2)cc1 502548747 ONIZUXFFAGCUCI-UHFFFAOYSA-N 393.490 5.100 30 20 GKED CCSc1ccc(Cl)cc1NC(=O)Nc1cccc(OCCCC#N)c1 503243367 CQSYONXGCIYNBI-UHFFFAOYSA-N 389.908 5.779 30 20 GKED CCC[C@@H]1C[C@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 503353386 OGMXMBFMGWSEHV-CRAIPNDOSA-N 382.435 5.023 30 20 GKED C=C[C@H](CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 507278120 DNLQDEGMFRWGBK-XXBNENTESA-N 385.511 5.490 30 20 GKED CCN(C(=O)c1cccc(OCc2cccs2)c1)[C@H](C)c1ccc(C#N)cc1 509569703 GXKLHHQATJAOIW-QGZVFWFLSA-N 390.508 5.422 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCc3cc(Br)ccc32)cc1 510759688 AELRAFQKJZGCCN-SFHVURJKSA-N 398.304 5.059 30 20 GKED C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1C(=O)NCC(C)(C)CCC#N 513139957 ABNRNMPHYMZJBM-CVDCTZTESA-N 389.543 5.105 30 20 GKED Cc1sc(NC(=O)c2ccccc2Sc2ccccc2C#N)c(C#N)c1C 515322654 NZRVJBRHDMUUGV-UHFFFAOYSA-N 389.505 5.512 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3nc4ccccc4cc3Cl)c2C#N)C1 515725772 BZXUOQRGQRWCBD-LLVKDONJSA-N 381.888 5.198 30 20 GKED N#C[C@@H](C(=O)c1cnc2ccccc2c1C(F)(F)F)c1nc2ccccc2s1 517280805 COQFOBPAUNOKMH-LBPRGKRZSA-N 397.381 5.353 30 20 GKED C=CCOc1cccc(CN[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 521828656 OHOMAUCVBOAQPK-OAHLLOKOSA-N 382.504 5.673 30 20 GKED Cc1occc1CN(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522634026 IRMXKKIIMTWPTN-UHFFFAOYSA-N 380.831 5.178 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)[C@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2 524018144 DWNXRUFXJOWDFH-NSXLHWASSA-N 392.930 5.219 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1ccccc1C#N 524468714 DITDUSJHHYTTDM-UHFFFAOYSA-N 395.871 5.086 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2cccc(Cl)c2)CC1 524832355 TXUWPNOKAJEPMT-OAHLLOKOSA-N 399.947 5.588 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Sc3ccccc3C#N)cc2)n1 532243058 OYCWIEVYIXTTPF-QFIPXVFZSA-N 399.519 5.390 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@@H]1COc2ccccc21 533630248 GVDLZZNHZDVKGQ-ZHRRBRCNSA-N 399.450 5.037 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2ccccc2)cnc1C 535537781 ILAYAHWNGLDQGA-UHFFFAOYSA-N 384.483 5.373 30 20 GKED C=CCC[C@H](NCc1cnn(C)c1C(F)(F)F)c1ccc(C(F)(F)F)cc1 539331837 PTWZKSDVIWYAFC-HNNXBMFYSA-N 391.359 5.255 30 20 GKED CC[C@@H](C)Oc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccn1 539679781 MEOVUPAVVCWIEE-CRAIPNDOSA-N 391.496 5.181 30 20 GKED N#CC1(c2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)no2)CCCC1 546289669 YIDAAWCPNUPPKC-UHFFFAOYSA-N 375.272 5.110 30 20 GKED Cc1cc(C#N)ccc1-c1nc(-c2cc(Cl)ccc2OCC(F)(F)F)no1 547172431 RHEVQAHJOLLOMY-UHFFFAOYSA-N 393.752 5.178 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3o2)c1 548158562 YGWRKNCNMSWADW-FQEVSTJZSA-N 391.471 5.542 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 549212786 AOKCBWOWDONSMR-LJQANCHMSA-N 390.527 5.185 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)n1 551142315 AAOHMOULPHRDMF-HNNXBMFYSA-N 394.302 5.207 30 20 GKED N#CC(CCNC1(c2ccccc2)CCOCC1)(c1ccccc1)c1ccccc1 584389856 KYCSWOAGKWVHHS-UHFFFAOYSA-N 396.534 5.182 30 20 GKED Cc1csc(NC(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)c1C#N 589034838 LXHOITYXQGJLTR-UHFFFAOYSA-N 393.415 5.323 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)C1 596780280 DIXKBLSNOCGGJT-HNNXBMFYSA-N 385.920 5.649 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2nc3cc(Cl)ccc3s2)cc1 604443161 PFRWZAKATJGRNN-UHFFFAOYSA-N 384.892 5.073 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(OC(F)(F)F)cc1 609387265 VLBZDLQXCUXBGT-ZIAGYGMSSA-N 380.435 6.010 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCCCC[C@@H]2c2ccco2)o1 609909212 UJAZUSRXCDDFIN-LJQANCHMSA-N 390.439 5.081 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)Nc1ncccc1C#N 610077481 ROFXUIMHVKYQDG-NSHDSACASA-N 399.317 5.321 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccccc2OCC2CC2)c1 610089397 TTZQPJRDISIGBR-UHFFFAOYSA-N 398.506 5.216 30 20 GKED CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(COc2ccc(C#N)cc2)o1 610121240 PDSCGHXYJLZGGD-LJQANCHMSA-N 380.488 5.161 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1cccc(C#N)c1 610362394 QRFLNKKWWYSTLV-AWEZNQCLSA-N 378.378 5.120 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c(Cl)c1 611092846 PYUWCQVHOSMYDZ-UHFFFAOYSA-N 389.238 5.159 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Cc1csc(-c2cccc(C)c2)n1 615969671 JHKZCAHYPJWVHC-UHFFFAOYSA-N 380.488 5.015 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 619804390 UPCYALQVDAPEJZ-GHTZIAJQSA-N 395.934 5.941 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 675015914 FLILRTLPEWRCMA-GFCCVEGCSA-N 398.768 5.598 30 20 GKED N#CCCCCOC(=O)c1oc2ccccc2c1COc1ccccc1Cl 726656793 CPXOIZYNKLWLPX-UHFFFAOYSA-N 383.831 5.516 30 20 GKED C#CC[C@H](OC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccccn1 727775768 ORYHIKCEIVKDJU-PKHIPVCBSA-N 377.440 5.270 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 731287426 BGKSGRIGSVTQGS-FDFHNCONSA-N 392.458 5.325 30 20 GKED CCCOc1nc2ccccc2cc1/C=C\C(=O)[C@H](C#N)c1nc2ccccc2o1 731768038 YIHXXRKQSRGRIW-JYBLJSLWSA-N 397.434 5.054 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)CCC(=O)N3)o1 734304186 FXFOWCMTBZGMFT-JXMROGBWSA-N 375.399 5.175 30 20 GKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1c(Cl)nc2sccn12 741849759 YVCXHDJIIGZYQJ-FNORWQNLSA-N 399.815 5.114 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccccc2)n1C 741925319 NUSHJMAQVQDWGC-MRXNPFEDSA-N 375.497 5.196 30 20 GKED C/C(=C\C(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 742646389 NMWUMEMWPAWKEQ-XLNAKTSKSA-N 378.781 5.143 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744036964 LIUPTNKXNIVRAD-DNVCBOLYSA-N 378.472 5.394 30 20 GKED C=CC[C@H](NC(=O)N(CC)[C@@H](Cc1ccc(F)cc1)C(C)C)c1ccncc1 745828072 QMKLDCQNWNLMQK-VXKWHMMOSA-N 383.511 5.137 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2NC(C)C)c(C)n1-c1ccc(C#N)cc1 746290798 AVKQUWHVKCKSQT-UHFFFAOYSA-N 390.462 5.178 30 20 GKED CSc1cc(-c2csc(NN=C(C)c3ccccc3)n2)ccc1NC(C)=O 749262237 KFMRNCHJJQZRJN-UHFFFAOYSA-N 396.541 5.327 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c2)cc1 749981679 RKGCDQLFTUTEMN-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(OC)c3ccccc23)cc1OC 750900698 ABZQFEWPVVANSC-ZRDIBKRKSA-N 392.451 5.160 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)[C@H](C)c2ccc3ccccc3c2)cc1C#N 752193651 JSJZTQKIHQSDEL-OAHLLOKOSA-N 387.439 5.022 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)co1 752882616 NVMPHLWWMKUNAD-KHPPLWFESA-N 398.466 5.001 30 20 GKED CC(C)(C)O[C@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1 754535509 ZXGVEYLTBFTVKW-BEFAXECRSA-N 382.460 5.168 30 20 GKED C#CC[C@@H](NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 757059426 VQFQZJFAHQTEHT-TZIWHRDSSA-N 378.472 5.040 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1cccc(F)c1)C1CCCC1)c1ccncc1 757213118 ZNUCXOXIUHNLSY-JOCHJYFZSA-N 381.495 5.035 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCc3cccc(F)c3C2)cc1 767849791 ZZNFPIKGBHFEIR-OAQYLSRUSA-N 385.442 5.071 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)cc1 772617039 KNIYQACIAWXVIT-FQEVSTJZSA-N 392.842 5.066 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)c1 772983474 KJZAUONOXHQDPR-JSGCOSHPSA-N 381.278 5.664 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 773197009 XSOCGKMCDQDEMW-YHYXMXQVSA-N 382.916 5.008 30 20 GKED CC[C@H](CN(CC)C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1ccccc1 773295946 YXIPJAWREBXTGD-IFMALSPDSA-N 393.531 5.093 30 20 GKED CCOc1c(Cl)cc(C=NO[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1OC 778591092 SVPBOGRDTNFOLV-CYBMUJFWSA-N 392.839 5.076 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2ccccc2)c2ccc(OC)cc2)c1 779103954 GMFRXHZDOTVWSY-DHLKQENFSA-N 386.495 5.255 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2ccccc2O[C@@H](C)C#N)c1Cl 779727031 JHCABSNYMPYXIK-NSHDSACASA-N 380.300 5.402 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@@H]1/C=C\c1ccccc1 780678897 QOQQWCFFCMPIAO-WEJMZEGWSA-N 389.499 5.467 30 20 GKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Br)cc(Cl)c1O 787034933 UJUZKQSDQGPSCE-QGHHPUGFSA-N 391.696 5.018 30 20 GKED Cc1ccc2cc(C(=O)/C=C/c3cn(CCC#N)nc3-c3ccccc3)oc2c1 788353326 GHQXHRJZFAREGB-ZHACJKMWSA-N 381.435 5.415 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792097947 ZGEBJWHLHRHAEC-FZKQIMNGSA-N 383.278 5.597 30 20 GKED Cc1cc(C(=O)/C=C\c2ncc(C(F)(F)F)s2)sc1Br 794732012 FPYGWZCYJAQGTC-IHWYPQMZSA-N 382.226 5.190 30 20 GKED CC(C)C[C@@H](NC(=O)OC(C)(C)C)c1noc(-c2ccc(C(C)(C)C#N)cc2)n1 795713855 DRLZRGNYPQHFIB-QGZVFWFLSA-N 398.507 5.150 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567318 GNUZJEONCOJKFT-CRAIPNDOSA-N 382.529 5.136 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(F)(F)CC2)cc1Cl 797615827 ONPGNRYHFXMZQK-QGZVFWFLSA-N 389.833 5.258 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1cccc(C#N)c1 800570197 HBSOSBMHDRRQNA-NSHDSACASA-N 397.784 5.035 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2coc(C3CCCCC3)n2)cc1 802043392 ZPQJRKMOTPVFMU-IBGZPJMESA-N 393.487 5.026 30 20 GKED COc1ccc2cc(NC(=O)c3ccc(COc4ccccc4C#N)o3)ccc2c1 803453970 WKZKWXZWPJHSAR-UHFFFAOYSA-N 398.418 5.144 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 814210849 VCQGJAFYKBLYHB-QGZVFWFLSA-N 378.328 5.715 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@H]1c1ccncc1 814576633 FTWPETWQDJMOOA-GOTSBHOMSA-N 396.494 5.352 30 20 GKED CC(=NNCc1cnc2ccccc2c1)c1sc(Cc2ccccc2)nc1C 814876928 LVXOKEIAQVLABI-UHFFFAOYSA-N 386.524 5.104 30 20 GKED COCc1nc(Cl)cc(NN=C(C)c2cc(F)ccc2SC(C)(C)C)n1 814977444 OJMZPWIEVVBWBS-UHFFFAOYSA-N 396.919 5.142 30 20 GKED Cc1cc(Br)cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)c1O 815635894 LPTPMHQHFWQFGI-DNVCBOLYSA-N 387.321 5.549 30 20 GKED N#C[C@@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1nc(C2CC2)cs1 842940615 CUIFPOODWSPLHT-LBPRGKRZSA-N 387.917 5.093 30 20 GKED C=CCC[C@@H](NCc1c(Cl)cccc1OCc1ccccc1Cl)C(=O)O 901689724 FGUWNMXAWKFOCQ-GOSISDBHSA-N 394.298 5.081 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C2CC2)[C@H](C)c2ccccc2)cc1OC 914481669 RAKKMAOOSSXHQF-VHUCWBOISA-N 377.484 5.025 30 20 GKED CCCCCCCCCCC(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 915700258 NGIIGWYGAGFHBA-FQEVSTJZSA-N 378.601 5.014 30 20 GKED N#Cc1ccc(OCCCSc2nnc(-c3ccc4ccccc4c3)o2)cc1 915799234 ZZIIXOAGNITTOE-UHFFFAOYSA-N 387.464 5.323 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(Br)s2)cc(Cl)c1O 916134488 MZTMUQNGOJXSHG-ARJAWSKDSA-N 387.682 5.164 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCOc3cccc(C)c3)n2)cc1 916628094 LNCAWJWNAJHTLT-HXUWFJFHSA-N 390.508 5.462 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026855 PVXJVSQRWLKLLV-ZBFHGGJFSA-N 396.899 5.416 30 20 GKED CC(C)Oc1ccccc1C=NOCc1cccc(C(=O)Nc2ccccc2)c1 917394699 OTILHTWEBFSAPR-UHFFFAOYSA-N 388.467 5.277 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 917428180 ORRDCULJYAHLAE-GPZRYRNASA-N 378.884 5.743 30 20 GKED O=C(O)c1cc2c(C=NNc3ccccc3C(F)(F)F)c(F)ccc2s1 1776033202 LXJDAAIHRUTUPM-UHFFFAOYSA-N 382.338 5.203 30 20 GKED CC(CCc1ccc(C(F)(F)F)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033561 ADNNKGVXFXHTDM-UHFFFAOYSA-N 384.785 5.478 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)c2cc(C(=O)O)oc12 1776131544 UNVQSSGJBGMJBR-ACCUITESSA-N 398.414 5.703 30 20 GKED COc1ccc(C(=O)/C=C\c2cc(C)n(C3CCCCC3)c2C)cc1CC(=O)O 1776131870 QSOGORNSFXAJEF-LUAWRHEFSA-N 395.499 5.142 30 20 GKED CCCCCCCOc1cccc(CN[C@@H]2CCCc3cc(C(=O)O)ccc32)c1 1776787392 ZDQRHQQVQHHLMZ-XMMPIXPASA-N 395.543 5.901 30 20 GKED CCCCOc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1OC 1776801418 SMBRHFRBVIOQIB-QGOAFFKASA-N 394.467 5.175 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1F 1777353300 UPFVJEDHBDFWNE-XYOKQWHBSA-N 376.383 5.096 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)s1 1777462959 TYDWUOZIRVBCRI-VOTSOKGWSA-N 389.885 5.428 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COc2ccccc2Cc2ccccc2)cc1 29151647 XGSPGQCUFQAJND-UHFFFAOYSA-N 384.479 5.096 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(C)o3)n2)nnc1-c1ccoc1C 32324883 WEXRZAXISIXWTP-UHFFFAOYSA-N 398.513 5.350 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 46872344 SABUWJFDGIOYQZ-FQEVSTJZSA-N 390.874 5.021 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccccc2)cc1)c1ccc2ccccc2n1 47375307 IIKMJDBGRHZOQI-QFIPXVFZSA-N 378.431 5.304 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1ccccc1Cl 65473627 YQOLSNFGDNWLLI-IBGZPJMESA-N 383.879 5.368 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nnc(-c2ccccc2)o1 105402683 MSYZSSJXFATQRG-MRXNPFEDSA-N 382.423 5.574 30 20 GKED N#C[C@@H](C(=O)[C@H](Oc1cc(Cl)ccc1Cl)c1ccccc1)c1ccccn1 106983653 ZHFUOWCDRGMTRL-IIBYNOLFSA-N 397.261 5.385 30 20 GKED N#Cc1cc(NC(=O)c2ccc(Cl)c(Cl)c2)ccc1OCC(F)(F)F 107567745 YBQZILWVFWZPCI-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C[C@@H](Oc1ccccc1NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1 133887903 RUYPUYOMXMZKHD-QGZVFWFLSA-N 396.450 5.360 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 150781396 QSNINPCENAEJGX-UHFFFAOYSA-N 391.515 5.044 30 20 GKED COc1ccc(CNc2ccccc2N2CCCCCC2)cc1OCCCC#N 157555062 CEBRKWADKHVJCK-UHFFFAOYSA-N 393.531 5.370 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccncc1 174493157 OADHEWPJMLBADP-LJQANCHMSA-N 390.418 5.157 30 20 GKED COc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 175120136 PQFQOGMQZCJZEO-MLGOLLRUSA-N 384.888 5.328 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)n1 177772992 PVADGIJYZWFSQW-INIZCTEOSA-N 399.516 5.032 30 20 GKED C[C@@H](N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1cccc(C#N)c1 181687795 BXUAAILAUXERDV-UZUQRXQVSA-N 384.458 5.139 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1cccnc1)C(=O)c1ccccc1 195385839 DILZZRGXSNDVFI-JWGURIENSA-N 384.479 5.111 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)cc1OC 206864109 KYBKGZKBMNUDQZ-ALCCZGGFSA-N 386.831 5.398 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)Nc1ccc(OC(F)F)cc1 329393336 UQRZSTGZAWHGFO-KRWDZBQOSA-N 390.434 5.003 30 20 GKED C[C@H]1C[C@H](C(O)=Nc2nc(-c3ccc(Br)s3)cs2)CCC1=O 329399178 VKHHLLDQRDRORI-DTWKUNHWSA-N 399.335 5.227 30 20 GKED Cc1sccc1C/C(O)=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1 329894323 JXMQYHLDLWLZBD-INIZCTEOSA-N 389.521 5.040 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425650342 JTTLFCRQAWDYNU-KRWDZBQOSA-N 381.545 5.733 30 20 GKED CCCOc1cc(O)ccc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 429754631 CQDFGPVESZCFBY-AWEZNQCLSA-N 385.489 5.219 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 431873799 AVQRNUXOJXSVMP-AUUYWEPGSA-N 390.314 5.789 30 20 GKED Cc1ccc(-c2csc(/C=C/c3cn(CCC#N)nc3-c3ccncc3)n2)cc1 432705979 TYXGZBMAKVDPBO-BQYQJAHWSA-N 397.507 5.461 30 20 GKED CCCOc1ccc(Oc2ncccc2CNc2c(C#N)cccc2C#N)cc1 436314035 QWYYHLBTVWQPNR-UHFFFAOYSA-N 384.439 5.018 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(ccc3ccccc32)[nH]1 436336413 VQTFLVNELVHHRB-ZJSXRUAMSA-N 379.463 5.233 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C1 437107346 PHUZDFOUGVHTBD-FUHWJXTLSA-N 398.503 5.236 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)Nc1ccc(CC#N)cc1)C1CC1 437620416 ZXASMRHJZUPMQE-CQSZACIVSA-N 387.405 5.529 30 20 GKED COc1ccc([C@@H](C)CCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 438080858 QNQXGNAOPCRUAI-SJORKVTESA-N 397.544 5.262 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ncoc3-c3ccc(C)cc3)n2)cc1 442684344 SELJNMUFYDNILE-SFHVURJKSA-N 399.475 5.572 30 20 GKED C[C@H]1CCN(C(=O)c2c(F)cc(C#N)cc2F)c2cc(Cl)ccc2S1 446014496 YVFGCMWHPSRMME-JTQLQIEISA-N 378.831 5.021 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c(Cl)c1 452644303 LJZDFAVWSMLAPW-HUUCEWRRSA-N 378.781 5.167 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccco2)cc1C#N 455782290 YGLQBZKGMBYVBA-IBGZPJMESA-N 379.460 5.088 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458809142 ZXVXOZIXGBTOQW-XLIONFOSSA-N 375.472 5.570 30 20 GKED CC(C)Cn1ccc2c(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)cccc21 464417809 IGKDNLMOCCABOJ-KRWDZBQOSA-N 385.389 5.201 30 20 GKED N#Cc1cc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)ccc1F 467768340 VKPWIBGJBUXQOK-XMMPIXPASA-N 399.469 5.287 30 20 GKED CCSc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469333638 CMLKLCAKBZMRFM-QGZVFWFLSA-N 393.556 5.555 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)n(C)c2ccccc12 471279846 YEVNOHCHMCSYFJ-HNNXBMFYSA-N 392.528 5.060 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 474429214 UDZXCBFKNDFVDQ-IBGZPJMESA-N 380.451 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@]2(C1)OCc1ccccc12 475564317 ACNRYJHSEPVQNO-VWLOTQADSA-N 390.527 5.592 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@@H](C)Cc1ccc(OC)cc1 475570199 SBJIDEZVZHDEIA-IBGZPJMESA-N 394.559 5.890 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC=C)Cc1ccc(OC)cc1 475579561 VUJKZXUMWNDBMB-UHFFFAOYSA-N 378.516 5.767 30 20 GKED N#CC[C@H](CC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccccc1 476135453 GNMZUZBXLRRGSO-QGZVFWFLSA-N 386.417 5.288 30 20 GKED Cc1sc([C@H](C)NC(=O)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 479202187 BIJFIVAAOSJVGX-LBPRGKRZSA-N 381.888 5.135 30 20 GKED CC(C)CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C1CC1 481659603 RDLZAWNETPCANP-UHFFFAOYSA-N 395.478 5.319 30 20 GKED N#CC[C@@H](CC(=O)Nc1c(C(=O)c2ccco2)oc2ccccc12)c1ccccc1 483107805 XKYYBDWBYVXBNH-KRWDZBQOSA-N 398.418 5.283 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 499864887 UKAXTZGMRCDTKV-SJKOYZFVSA-N 380.797 5.233 30 20 GKED COc1cccc([C@@H](NCc2ccc(C#N)cc2OC)c2ccccc2Cl)c1 500853941 XZMFCKXFIPXJNU-HSZRJFAPSA-N 392.886 5.108 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 503225380 KIAMCESMGHBPSO-FDDCHVKYSA-N 393.556 5.666 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1nc(-c2ccccc2)cs1 503676492 JREAHUORHGBVDE-GFCCVEGCSA-N 382.876 5.218 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 505036368 WECNXDCHCRVOPU-QFIPXVFZSA-N 391.902 5.765 30 20 GKED CN(C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1ccccc1C#N 508099955 ZMXQKDDAEGKELT-UHFFFAOYSA-N 384.407 5.165 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H]2CC(C)C)cc1 508286327 IEEXGEWRVCLFFT-LJQANCHMSA-N 393.487 5.402 30 20 GKED CC1(C)CC[C@@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 509696130 HNBJWQJSBZIPEC-LJQANCHMSA-N 377.488 5.032 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)Nc1ccc(C#N)cc1 510059927 HGQMAHSCIXFIFO-UHFFFAOYSA-N 388.471 5.090 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nc2ccccc2n1C(F)F 512505877 CZWKYFQZPAZSSU-MRXNPFEDSA-N 387.478 5.348 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N(C[C@H](C)C#N)C3CC3)cc2)cc1 513660411 LOBJGGIWHJZVAL-MRXNPFEDSA-N 379.460 5.034 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3c[nH]c4ccccc34)cc2)c1 519506345 SLXGTJKKXUQNSN-UHFFFAOYSA-N 381.435 5.403 30 20 GKED CC(C)c1nc2cc(NC(=O)N[C@H](CCCC#N)c3ccccc3)ccc2o1 519576935 ZRCKTMLRANREJK-GOSISDBHSA-N 376.460 5.508 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC(CCC#N)CC3)o2)cc1 520232804 OJZQLXLMLBZQLB-UHFFFAOYSA-N 399.494 5.473 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 520855259 GKMZRCPQIFCACH-FOIQADDNSA-N 399.535 5.986 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cccc(C)c1 522181850 HFQKCSCFCLMAPD-UHFFFAOYSA-N 377.257 5.117 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc2c1CN(c1ccccn1)C2 535328360 XLSGNVFDFMCHEL-UHFFFAOYSA-N 390.531 5.202 30 20 GKED C[C@@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(C#N)c(F)c1 538507334 XEVVUJQRZYSNLL-MRXNPFEDSA-N 378.422 5.266 30 20 GKED CCN(C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1)[C@H](C)c1ccc(C#N)cc1 538745122 UCTPIEVTLBLJBE-CYBMUJFWSA-N 385.389 5.282 30 20 GKED CCOc1ccc(Oc2cc(CN[C@H](C)c3ccc(C#N)c(F)c3)ccn2)cc1 540709354 LSIFVERLJRAGNV-MRXNPFEDSA-N 391.446 5.134 30 20 GKED Cc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c(Cl)c1C 541184378 QGZAHHHLUCHXDY-UHFFFAOYSA-N 381.888 5.128 30 20 GKED N#Cc1ccc(OCc2cccc(-c3nc([C@H]4CCCCS4)no3)c2)cc1 545813970 PMKNRNKKOTWCCP-LJQANCHMSA-N 377.469 5.145 30 20 GKED CCC(CC)(CCO)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 558746674 OBEUGOWDNUAUEC-LJQANCHMSA-N 399.922 5.058 30 20 GKED O=C(c1ccoc1C(F)(F)F)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 564531245 NKRYWLQUHWKBTK-OAHLLOKOSA-N 395.274 5.028 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCSC4(CCC4)CC3)cc2)c1 565765047 YYLRCBTWXZNJBK-UHFFFAOYSA-N 393.512 5.244 30 20 GKED N#CCC[C@H](C#N)CNc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 569309768 LUVNLHPXNCBVFL-CQSZACIVSA-N 384.361 5.225 30 20 GKED COc1ccc([C@@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccc(F)cc2)cc1 580943867 YQEJIVSNTCRODU-RPBOFIJWSA-N 386.470 5.463 30 20 GKED N#CCCCCCC(=O)NCC1(c2cccc(Br)c2)CCCCC1 588621216 VZCPBGVDMASVGJ-UHFFFAOYSA-N 391.353 5.241 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)s3)cc2)ccn1 589470206 YASOYXNSIZGQLG-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 590116388 CUJHHMQKMLSJJV-UWJYYQICSA-N 391.540 5.840 30 20 GKED CCOc1ccc(-c2nc(CNC3(c4ccc(C#N)cc4)CCC3)cs2)cc1 594032094 DAJSARRVMTVACM-UHFFFAOYSA-N 389.524 5.249 30 20 GKED N#CC1(Cc2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)CCCCC1 594732904 WPGXTGOOMXZHAN-UHFFFAOYSA-N 397.482 5.151 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccc(Oc2ccccc2)c(F)c1 595456082 VPTXPUIXXHYFFM-IAGOWNOFSA-N 381.451 5.014 30 20 GKED C[C@H](Nc1ccc(NC(=O)CC2(C#N)CCOCC2)cc1Cl)c1ccccc1 597132396 QASZDBDGQZBUBP-INIZCTEOSA-N 397.906 5.162 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C)c(C#N)c3)s2)cc1 599363884 SBTRRAQTORXEFE-OAHLLOKOSA-N 377.513 5.158 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(F)c(C#N)c3)cc2)cs1 609102151 FRYOHMTVYFLELN-UHFFFAOYSA-N 383.473 5.007 30 20 GKED N#CCn1c(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc2ccccc21 609162117 YVKSGGMUYVGHRN-UHFFFAOYSA-N 398.491 5.104 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1c(Cl)cccc1Cl 609287005 WOPXZLCRICTDTL-OAHLLOKOSA-N 389.213 5.387 30 20 GKED COC1CCC(N(C)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CC1 609724573 BBPXCXGREQFIIL-UHFFFAOYSA-N 398.890 5.034 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)c(F)c1 610164702 SBBBEZUPGIJNKV-UHFFFAOYSA-N 389.666 5.388 30 20 GKED C=CCn1c(S[C@H](C#N)Cc2ccccc2)nnc1-c1cccc(Cl)c1 610863186 BRLTWKZFULXDPI-SFHVURJKSA-N 380.904 5.011 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(-c3cccc(-c4cscn4)c3)no2)cc1 615133189 OSBPODNWGVEQNK-HXUWFJFHSA-N 399.479 5.073 30 20 GKED C=CCN(C(=O)c1cc(-c2ccccc2)on1)c1nc(-c2ccccc2)cs1 679995290 OEGXSFFBGHGEGU-UHFFFAOYSA-N 387.464 5.298 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1sccc1Br 727261581 FLNVKZAMGIOEHK-UHFFFAOYSA-N 393.228 5.288 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cccc(COc3ccccc3)c2)C2CC2)cc1 727590189 GMPSRARYRHETJF-UHFFFAOYSA-N 397.478 5.334 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(O[C@@H](C)C#N)cc3)cc2)cs1 728713173 RMOQGILEMXEUMV-HOTGVXAUSA-N 377.513 5.260 30 20 GKED CC(=NNc1cncc(Cl)n1)c1c(F)cccc1O[C@H](C)c1ccccc1 730144966 LULPXBAZKLVCIO-CQSZACIVSA-N 384.842 5.245 30 20 GKED Cc1ccc(NC(=O)/C=C\c2ccccc2C#N)c(-c2nc3ccccc3[nH]2)c1 731979238 MROLECOEJCTVMP-QBFSEMIESA-N 378.435 5.062 30 20 GKED C#CCCOc1ccc(CNCc2ccc(Oc3cc(C)ccc3C)nc2)cc1 733324603 NTCXJBNAAITLBF-UHFFFAOYSA-N 386.495 5.183 30 20 GKED C[C@@H](/N=C/c1c(O)ccc2ccccc12)c1ccc(NC(=O)c2ccncc2)cc1 733750320 UBPXDDRXYQKBGO-AKBIMGJMSA-N 395.462 5.373 30 20 GKED C=CC[C@@H](NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1ccncc1 734460200 NQNIIQWIBZUAHY-JOCHJYFZSA-N 392.886 5.361 30 20 GKED C=CC[C@@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccncc1 734508698 CAFFKMPQWAPFNR-LJQANCHMSA-N 385.920 5.178 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C\C(=O)c2ccc(SC(F)F)cc2)c1 734979802 DRDOEFMPPYKWEL-YFHOEESVSA-N 386.423 5.296 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)n1 735765950 XHRONNMOMCLBQE-ROWPZFDLSA-N 384.932 5.330 30 20 GKED C=C(Cl)CNC(=O)c1oc2ccccc2c1CSc1ccccc1F 736239156 RPLAQSNMMKVUOS-UHFFFAOYSA-N 375.852 5.347 30 20 GKED C[C@H](C#N)CN(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 746155091 CSCGPAGAJMIVDF-MRXNPFEDSA-N 382.463 5.165 30 20 GKED CCOCc1cc(/C=C/C(=O)c2ccc(OCC(F)(F)F)cc2)ccc1OC 747613310 XDMVQTDYGHNCFA-ONNFQVAWSA-N 394.389 5.069 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 749034292 ZONRPMLIKIWMAW-DOMZBBRYSA-N 388.851 5.123 30 20 GKED COc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 750685970 AJKWTHSGUNTWSD-OXQOHEQNSA-N 390.508 5.497 30 20 GKED C#CC[C@H](NCc1ccc(OCc2cccs2)c(OC)c1)c1ccccc1 756995340 GMTIERHILOYLAL-NRFANRHFSA-N 377.509 5.190 30 20 GKED N#C[C@H](C(=O)[C@H]1CCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 762067509 HVANUMSUJKQWOA-JOYOIKCWSA-N 383.325 5.046 30 20 GKED CC(C)(C)c1nn(Cc2ccccc2)cc1/C=C\C(=O)c1ccc(OCC#N)cc1 763289905 MROSVPULYCLUJG-KAMYIIQDSA-N 399.494 5.027 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H]1CCC(F)(F)C1 763842840 SXHRRUVDWFRBTA-BIOMNHJASA-N 387.270 5.041 30 20 GKED C[C@H](N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(OCC#N)cc1 772961100 XPEVWWONIQDESN-YVEFUNNKSA-N 377.271 5.070 30 20 GKED CC(C)c1ccc2c(c1)[C@H](Nc1ccc(N3CCC(O)CC3)c(C#N)c1)CCC2 777114281 IJOSJCURSPUKHC-XMMPIXPASA-N 389.543 5.132 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NOC2CCCCC2)cc1Cl 779402169 KMJNKGOJLDTUMX-IBGZPJMESA-N 383.879 5.381 30 20 GKED C#Cc1cccc(N(C)C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)c1 781630258 IVGNDMWZYJQBBC-UHFFFAOYSA-N 385.250 5.215 30 20 GKED Cc1ccccc1[C@H](C)N(CC(C)C)C(=S)Nc1ccc(C#N)c(Cl)c1 789360606 UXUSVQKLNCGGPR-INIZCTEOSA-N 385.964 5.936 30 20 GKED N#C[C@@H](C(=O)CCSc1nc2ccccc2s1)c1nccc2ccccc12 792100225 KZNQFPVBBSKHMZ-INIZCTEOSA-N 389.505 5.203 30 20 GKED Cn1c(-c2cccc(OC(=O)C[C@H](CC#N)c3ccccc3)c2)nc2ccccc21 796642367 BXRSSWCNTONZMN-IBGZPJMESA-N 395.462 5.233 30 20 GKED Cc1ccc(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)cc1C#N 799333614 VKWMFYYDZSRWCR-UHFFFAOYSA-N 387.439 5.535 30 20 GKED CC(=NNc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 799491593 HBDCOAAWGJDEJE-UHFFFAOYSA-N 393.319 5.158 30 20 GKED N#Cc1cccc(COc2cccc(/C=C3\Cc4nc(Cl)ccc4C3=O)c2)c1 806578511 UDBSRAPSRSPCLH-VCHYOVAHSA-N 386.838 5.008 30 20 GKED N#CCCC[C@@H](NCC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccccc1 814658902 IBAWLBFTXRXWTE-XMMPIXPASA-N 383.495 5.317 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1cc(C(F)(F)F)ccn1 835455649 NBYRTHLTZQJLHO-YUELXQCFSA-N 396.771 5.263 30 20 GKED CC(C)c1csc(SCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)n1 845327728 KIYJZKCAJCCCRX-CQSZACIVSA-N 399.566 5.359 30 20 GKED C=C[C@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 909531374 XRRRCCOUAMSONM-CQSZACIVSA-N 392.908 5.127 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCOc2cccc(Cl)c2)cc1 915180855 SKJYCNHOHHZNEQ-JOCHJYFZSA-N 390.870 5.403 30 20 GKED C=CCc1cc(OC)ccc1OC(=O)CCCc1ncc(-c2ccccc2)o1 915276565 AJWIJAOIUYPWPA-UHFFFAOYSA-N 377.440 5.007 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCOc2cccc(C)c2)cc1 916956010 WSLUROKUMJJCKC-PGRDOPGGSA-N 392.499 5.015 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCOc3cccc(C)c3C)n2)cc1 916974746 PDYABVGWHIGFMJ-LJQANCHMSA-N 390.508 5.381 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 917119369 ASJWXGAXTGZEJK-NRFANRHFSA-N 386.499 5.163 30 20 GKED CCCCCCC[C@H](C)CNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1 918678410 ZNQRCGANPQSTAZ-IBGZPJMESA-N 387.568 5.043 30 20 GKED CC(=NNc1nc2ccccc2s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776015213 QQEZFBHEBWILLQ-UHFFFAOYSA-N 377.425 5.091 30 20 GKED O=C(O)c1ccc(NN=C(CC2CC2)c2cccc(C(F)(F)F)c2)cc1F 1776077122 WBUQUCRLAXKIRK-UHFFFAOYSA-N 380.341 5.159 30 20 GKED CC(C)c1cc(O)cc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776369330 QARNWEOJSFIZDR-FPYGCLRLSA-N 376.408 5.370 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776388625 UUQRSXQYTSSZHW-FLIBITNWSA-N 392.407 5.034 30 20 GKED Cc1c(/C=C2\Cc3c(ccc(Cl)c3Cl)C2=O)nc2ccccc2c1C(=O)O 1777414198 LGYILKQDZFICKO-PKNBQFBNSA-N 398.245 5.371 30 20 GKED Cc1ccc(-c2nnc(SC[C@@H](C#N)CCC#N)n2-c2ccc(C)cc2)cc1 7112248 OUSUJLNCPZYMJY-GOSISDBHSA-N 387.512 5.087 30 20 GKED CC(C)(C)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1C1CC1 51534816 WSHJOFJIGIWHPS-MRXNPFEDSA-N 390.512 5.129 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccccn1 56750870 XYTCDJDFUIPOTC-AWEZNQCLSA-N 392.846 5.282 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccccc1OC(F)F 58859682 MXVYZBVGGOQFAH-OAHLLOKOSA-N 379.794 5.086 30 20 GKED COc1ccc2oc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c(C)c2c1 66800876 IAPNIYZJFSZWBD-ZDUSSCGKSA-N 380.469 5.396 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(O[C@@H](C)C#N)cc3)s2)cc1 107718273 TVTRGPHVWQVFTG-DLBZAZTESA-N 391.540 5.569 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1 108396577 WUQATYBDABJIJX-UHFFFAOYSA-N 392.324 5.472 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Oc1ccc(F)cc1Cl 112817947 OLLACAPMZIGLSM-STQMWFEESA-N 392.883 5.137 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)s1 121568182 ASDLAHZPXXKENS-NSHDSACASA-N 395.311 5.314 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1)c1ccccc1 131035541 FRVWIPYUIVUXLA-AABGKKOBSA-N 384.545 5.053 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 154492396 OCERVLDJIWSIQU-UHFFFAOYSA-N 394.862 5.113 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(C(F)(F)F)cc1 171301313 UPNGNMKWBOJAPX-AWEZNQCLSA-N 387.405 5.012 30 20 GKED N#CC1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 171650496 ABRMJJIVSRRTHN-LJQANCHMSA-N 388.298 5.028 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1S[C@H](C)CC#N 173265416 MPVYMELNTYZGNZ-CYBMUJFWSA-N 385.558 5.756 30 20 GKED N#C[C@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc(-c2ccncc2)cs1 174104881 IJOIIPCJEFOFFX-LYBXBRPPSA-N 387.508 5.355 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 175502602 GVSJBUZPLWTFIN-HXOBKFHXSA-N 388.515 5.609 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)s1 175656727 MUQMKCDODLEOGJ-LBPRGKRZSA-N 389.546 5.003 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1C1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 176097974 DKMNIMNDHLLMNZ-HZSPNIEDSA-N 377.296 5.339 30 20 GKED Cc1nn(C(C)(C)C)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 181495147 SSHNYJUSDWQJFC-OAHLLOKOSA-N 398.919 5.214 30 20 GKED N#Cc1c(NC(=O)c2cccc(Br)c2Cl)sc2c1CCCC2 182365074 XZJRNAQDCNSNAT-UHFFFAOYSA-N 395.709 5.167 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 237606558 SSPZYFSYKFYOOZ-RTBURBONSA-N 399.494 5.081 30 20 GKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 273298228 DYNPEOOLJWHDPA-RTWAWAEBSA-N 395.478 5.011 30 20 GKED COc1cc(C2(/C(O)=N/[C@H]3CCCc4cn(C5CCCC5)nc43)CC2)ccc1C 329472359 AGNMLPHIDWMBAM-FQEVSTJZSA-N 393.531 5.381 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1c1nc2ccccc2s1)c1ccccc1 375682251 FCEMEXYAMKRZGV-MJGOQNOKSA-N 375.497 5.047 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1Cc1cc(F)ccc1F)c1ccccc1 419519877 GVWUOUXNOBAZPJ-IFMALSPDSA-N 397.469 5.116 30 20 GKED C=CCC1(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)CCOCC1 424782383 OYWVLMLMVQHZJJ-UHFFFAOYSA-N 384.907 5.264 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc(C(F)F)c1 425092091 YYQQKEUOERBEEL-LBPRGKRZSA-N 382.332 5.197 30 20 GKED C=C(C)[C@@H](N[C@H]1CCCc2ncc(C(F)(F)F)cc21)c1ccc(F)c(F)c1 427877844 PHVCGHINUXGUFD-RBUKOAKNSA-N 382.376 5.663 30 20 GKED Cc1nsc(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 432007900 OKXHOFVBMDNDPM-QGZVFWFLSA-N 381.888 5.321 30 20 GKED N#CCCC[C@H](NCc1nc(-c2c(F)cccc2F)cs1)c1ccccc1 433030920 XNNVMQTXCNORIB-SFHVURJKSA-N 383.467 5.613 30 20 GKED CC(C)(c1ccc(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)cc1)C(F)(F)F 433861050 XFVSAHXFSZTCAV-INIZCTEOSA-N 380.797 5.175 30 20 GKED COc1ccc([C@H](C)CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 438048643 KCQOWLKKAWPMQA-SJORKVTESA-N 397.544 5.405 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(F)(F)F)c(F)c1 439118803 OSTRGXBOYKFXPZ-LLVKDONJSA-N 382.382 5.491 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)O1 440372841 DSBBNDGVJGXEJB-ZTNFWEORSA-N 382.891 5.282 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c(F)c1 445676262 ODUCSSUOFSFJFA-UHFFFAOYSA-N 391.402 5.365 30 20 GKED CC[C@H](NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccc(C#N)cc1 447533247 XDUIPONTFDOEBW-QHCPKHFHSA-N 380.495 5.197 30 20 GKED Cc1c(Cl)cccc1-n1c(S[C@@H]2CC[C@H](C#N)C2)nnc1-c1ccncc1 450632222 MHPWFWSHMQVCIF-GOEBONIOSA-N 395.919 5.076 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 463776303 PNXXDQLBTLXSQB-PXAZEXFGSA-N 379.262 5.082 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1cc(C(F)(F)F)ccn1 464476384 PIABPGNNAANVQV-AWEZNQCLSA-N 390.361 5.458 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466278815 RCPLUJSFHWBAQI-HXUWFJFHSA-N 388.483 5.160 30 20 GKED C=C(C)CN(Cc1ccccc1)Cc1csc(N(C(C)=O)c2ccccc2)n1 470918656 JTPDBDQYPLRMMB-UHFFFAOYSA-N 391.540 5.406 30 20 GKED C[C@@H](c1ccccc1Br)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474693460 IPHMISVUYJXHDY-DOTOQJQBSA-N 385.305 5.056 30 20 GKED N#CC[C@H](CC(=O)NC1(c2cccc(Br)c2)CCC1)c1ccccc1 475185331 HYJLZVPPXQMHCJ-QGZVFWFLSA-N 397.316 5.032 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(CN(C)C)c(F)c1 475546973 KLYCTBSEYWNYSO-UHFFFAOYSA-N 383.511 5.061 30 20 GKED C=C(C)[C@@H](NCc1csc(-c2cccc(OC)c2)n1)c1ccc(F)c(F)c1 481600617 BIYLBOKZTHSUOL-HXUWFJFHSA-N 386.467 5.504 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F 482230432 XLPLHUPNINKXOI-JXFKEZNVSA-N 386.417 5.324 30 20 GKED CC(C)c1nn(C)cc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 482900988 HNGVFRZFQCOTDR-UHFFFAOYSA-N 394.862 5.113 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1nccc2ccccc12 483191686 FYBGJPRKPWYXQQ-LJQANCHMSA-N 399.837 5.566 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@H](C#N)c1cnc2ccccc2n1 483194899 AKCNJASXWLUSPM-HXUWFJFHSA-N 393.446 5.007 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)c1 484468526 XDNFQOUTPHEJAL-HXUWFJFHSA-N 394.490 5.043 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 486412142 VCVGCJAQDDNGAT-UHFFFAOYSA-N 377.494 5.212 30 20 GKED CC(C)(CC(=O)N[C@@H](CCCC#N)c1ccccc1)CC(=O)c1ccccc1 487242026 OWNZKHPFHAOVPK-NRFANRHFSA-N 376.500 5.227 30 20 GKED Cc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)cc1OC(C)C 488394425 GGJNSXUDXJEJSV-UHFFFAOYSA-N 390.439 5.078 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccccc1CC(=O)OC(C)(C)C)c1ccccc1 489704801 UMIVKGVQLHNMAF-HXUWFJFHSA-N 379.500 5.259 30 20 GKED FC(F)Oc1ccc(CN[C@H](c2ccccc2OC(F)F)C(F)(F)F)cc1 491378891 FXIICEMPVCWWQW-CQSZACIVSA-N 397.290 5.283 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCCCOc1cc(C)ccc1C 498430814 QHKQMMILDOBJOO-UHFFFAOYSA-N 378.516 5.163 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC[C@H]1C(F)F 503070501 HHUZYVWMXAXOKJ-FQEVSTJZSA-N 399.441 5.097 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H]1CCCC(F)(F)C1 503661510 BHDRZJONAQCBFN-SFHVURJKSA-N 386.417 5.365 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCc4cc(Cl)ccc43)ccc21 506218451 IOJVKZDUUXNYRO-HXUWFJFHSA-N 379.891 5.022 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3sc4c(c3C#N)CCCCC4)s2)o1 512138034 KCULDEWREKTYMY-UHFFFAOYSA-N 397.525 5.474 30 20 GKED Cc1sc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)c(C#N)c1C 512977614 OYRXFQONSDDJRN-UHFFFAOYSA-N 393.946 5.256 30 20 GKED N#CC1(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)CCCCC1 518705513 JUSRKFVNZZGKQM-UHFFFAOYSA-N 378.863 5.296 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)cc1 519969100 OQGFHZKNVODCFT-XMMPIXPASA-N 395.506 5.667 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(Cl)c1Cl 521293330 MAZXVOJNPLFNJO-CYBMUJFWSA-N 379.630 5.388 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3cccc(F)c3)s2)cc1 522283023 RFAATZZHVFYNJR-UHFFFAOYSA-N 381.476 5.474 30 20 GKED Cc1ccc(-n2c(S[C@@H](C#N)C3CCCCC3)nnc2-c2ccncc2)cc1 524534657 DGRZZQVFQTZDPT-FQEVSTJZSA-N 389.528 5.202 30 20 GKED N#Cc1ccc(SCc2ncc(-c3ccccc3Br)o2)c(F)c1 524727213 OALVTHUQAXPKTG-UHFFFAOYSA-N 389.249 5.407 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1OCC1CC1 524934338 QLAPNZIZPBHQHR-UHFFFAOYSA-N 395.478 5.176 30 20 GKED CN(C(=O)c1ccc(NCCCC(C)(C)C#N)cc1Cl)C1CCCCC1 531649951 TUYHBWZRTZFIRZ-UHFFFAOYSA-N 375.944 5.487 30 20 GKED CC(C)c1nc2cc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)ccc2o1 534314038 YMNIYPXBKYNYLP-UHFFFAOYSA-N 386.455 5.144 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCCC1CCOCC1 537508431 NLJCWIRPFQSERV-UHFFFAOYSA-N 394.490 5.136 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 538679018 BNKLMUPUMKYXJE-UHFFFAOYSA-N 399.450 5.341 30 20 GKED N#Cc1cccc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1F 539424414 MDKNEHBCLDULMB-SFHVURJKSA-N 382.788 5.610 30 20 GKED Cc1ccnc2[nH]c([C@@H](C#N)C(=O)c3ccc(-c4cccc(C(C)C)c4)o3)nc12 539582416 IBFRLRBEAXOUFA-KRWDZBQOSA-N 384.439 5.140 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 539716157 KJDBCCLSZNPWIO-PZJWPPBQSA-N 393.487 5.066 30 20 GKED C[C@H]1CC(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@H](C)O1 539841949 MGYCYGPLOXMCTR-KBPBESRZSA-N 384.863 5.146 30 20 GKED C[C@@H](NCc1ccc(-n2cccn2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 541063685 UMJKQETYGFWKJD-LJQANCHMSA-N 378.479 5.262 30 20 GKED CCc1cccc(C)c1NC(=O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541087604 XQRZCQQEUOCLCB-LJQANCHMSA-N 397.522 5.385 30 20 GKED C[C@H]1COc2ccccc2CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 541995565 ZMLUHXCOCKNYRX-KRWDZBQOSA-N 399.450 5.166 30 20 GKED N#CCc1ccc(C[S@](=O)Cc2ccc(Oc3ccccc3F)c(F)c2)cc1 542188280 UQGAASFODDMEKN-NDEPHWFRSA-N 397.446 5.272 30 20 GKED COc1cccc(COc2cccc(Cl)c2CNc2cc(CC#N)ccn2)c1 545927580 RFXPAJRVDJZVGJ-UHFFFAOYSA-N 393.874 5.001 30 20 GKED CC[C@@H](CC#N)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 546585878 VERFSIKEDVPYLN-IYOXOMEYSA-N 387.508 5.205 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)C2CC2)cc1 550761193 QKDATDSFLQGSMW-XMMPIXPASA-N 399.469 5.161 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(Cl)c1Cl 554060381 AFUGDPIMTWAEPH-UHFFFAOYSA-N 381.307 5.381 30 20 GKED Cc1ccc(-c2csc(C(=O)N3CCC(CC#N)CC3)c2-n2cccc2)cc1 558558337 UDKHWFHOKLNAEM-UHFFFAOYSA-N 389.524 5.280 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3ccc(F)cc3)s2)CC1 558620760 CVFMQBNULTVKQA-UHFFFAOYSA-N 377.488 5.007 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(Cc3nc(C(C)C)no3)cc2)CCCC1(C)C 558840347 IWDHLWFNNYLHGU-IBGZPJMESA-N 396.535 5.382 30 20 GKED O=C(Nc1ccc(CCC(F)(F)F)cc1)c1c(F)cc(C(F)(F)F)cc1F 573026014 LXBPWIOKPKPZDD-UHFFFAOYSA-N 397.265 5.731 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)c(OC)c2)c2ccccc2Cl)cc1 580863636 ZDUUCSXKLJYRHX-HSZRJFAPSA-N 392.886 5.108 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Br)cc1C#N 580945084 VTSKNLHUHWZOCU-CYBMUJFWSA-N 386.318 5.185 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 583339878 JGNQWIZAWSZCDK-UHFFFAOYSA-N 381.863 5.064 30 20 GKED CC(C)C[C@](C)(NC(=O)CCCCCC#N)c1cccc(Br)c1 588982927 ULXKADFMBCXCMB-IBGZPJMESA-N 379.342 5.301 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)cn2)c1 604510894 KLXMYTDRBLRWFV-VQTJNVASSA-N 389.842 5.141 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3C[C@H]3c3cccc(Cl)c3)cn2)cc1 604510943 SSSKXUVCDNGQQE-PMACEKPBSA-N 389.842 5.141 30 20 GKED Cc1cn2cc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)ccc2n1 608878290 ANMNYXYAOXGTQW-UHFFFAOYSA-N 398.491 5.059 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(Cl)s1 609399456 YYURITJSDHQCDL-LBPRGKRZSA-N 379.938 5.317 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)sc2ccc(F)cc12 609427468 AXPBBFWZHNNIKE-LBPRGKRZSA-N 384.501 5.995 30 20 GKED CC[C@H](CC(=O)N[C@@H](C#N)c1ccc(Br)cc1)c1ccc(C)cc1 609986491 ZHEOWEWVUWGELF-BEFAXECRSA-N 385.305 5.022 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c(Cl)c1C 611954257 HUBCPNXLTSZAEG-UHFFFAOYSA-N 377.831 5.268 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)cc2ccccc21 611988487 OWGKAVJCKHSXDW-TZZQJPOUSA-N 389.524 5.325 30 20 GKED C=C(C)COc1cc(CN[C@@H](CC(F)(F)F)c2ccccc2)ccc1OC 622266638 WIMGKLFQXHZADO-SFHVURJKSA-N 379.422 5.433 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1cc(C(F)(F)F)ccn1 643778775 NEBAXMDKJMLIGC-QGZVFWFLSA-N 397.400 5.341 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)sc2C)cc1 647374971 PGKMNKDXEHDDCP-QGZVFWFLSA-N 394.521 5.556 30 20 GKED C=C(C)[C@H](NC(=O)c1cccc(Oc2nccs2)c1)c1ccc(F)c(F)c1 681245629 NBXGCAOLNLQPCR-SFHVURJKSA-N 386.423 5.261 30 20 GKED COc1ccccc1-c1nc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cs1 684675078 IIVMHWCSPKJHKG-ZDUSSCGKSA-N 397.525 5.063 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1ccc(Br)s1 727263963 LLRBVMZZOAUNKN-SREVYHEPSA-N 376.300 5.530 30 20 GKED Cc1ccc2c(CNc3cccc(Oc4ccc(C#N)cc4)c3)cc(=O)oc2c1C 729675364 GYKSYUVDSHAELF-UHFFFAOYSA-N 396.446 5.686 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730170388 DDBFLUIJUSLIBW-VSRFVYNTSA-N 396.490 5.478 30 20 GKED CC(=NNc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1)c1sccc1C 733746594 VHTGHHRRAJMURC-UHFFFAOYSA-N 384.526 5.034 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(Cl)ccc2OCC#N)n1 735231128 WHNNHUSRJOYUTH-UHFFFAOYSA-N 397.809 5.129 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnn(-c3ccccc3)c2)cc1 741470766 VEZUNUNJWUKFDD-LFIBNONCSA-N 380.447 5.444 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccccc2OCc2cccnc2)cc1F 741846741 IDIKQNMNFNTRRX-CSKARUKUSA-N 379.456 5.418 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnc2ccccc12 748698472 HQGKEERGTITYBR-JOCHJYFZSA-N 377.447 5.451 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCCOc3ccccc32)cc1 750304026 UUHNPCFPEPWYRQ-XZOQPEGZSA-N 397.478 5.377 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)CCc2cc(SC(F)F)ccc21 750915050 BWAIVOZCTWLOQW-YVLHZVERSA-N 394.446 5.671 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCc1cc(C#N)ccc1F)C1CC1 754915992 JNGSEDSGTPUVHC-INIZCTEOSA-N 387.458 5.286 30 20 GKED Cc1cc(CSc2ccccc2C(=O)O[C@@H](C)c2cccc(C#N)c2)on1 764616144 ZNQNWIVVTCOMGR-HNNXBMFYSA-N 378.453 5.065 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2ccc(Cl)nc2C(F)(F)F)cc1 766855097 NAQJQADCBHREDN-CQSZACIVSA-N 395.812 5.046 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(Br)c(F)c1 767734561 HIKROZDEYLFBCR-ALCCZGGFSA-N 389.249 5.003 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)O[C@@H](C)c1nc2ccccc2n1C(F)F 767738074 DMZSSEZKODXYFY-XJKSGUPXSA-N 381.423 5.007 30 20 GKED CC(C)(C)Sc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 770558970 QSCUIOCKGXJBMB-UHFFFAOYSA-N 390.556 5.966 30 20 GKED CCn1c(NC(=S)Nc2ccc(C#N)c(Cl)c2)nc2cc(Cl)ccc21 770597454 DMSDPQZMHPBPCL-UHFFFAOYSA-N 390.299 5.044 30 20 GKED N#Cc1ccccc1/C=C\C(=O)OCc1csc(-c2ccc(Cl)cc2)n1 775072078 DFIPHAPBUBCBRN-YFHOEESVSA-N 380.856 5.092 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)c1 780526686 IHVPULPYBWDMEK-QGZVFWFLSA-N 382.813 5.330 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)OCCCC(C)(C)C#N)cccc2c1=O 781840862 CKRUBFOGMUFMDP-UHFFFAOYSA-N 389.451 5.255 30 20 GKED CC(C)(C#N)CCCOC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 782650299 BFYFUQCHMHLIKE-UHFFFAOYSA-N 395.286 5.454 30 20 GKED C[C@@H](C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1)[C@@H]1OCCc2sccc21 796749650 WAUZQRROXRTHKF-QRQCRPRQSA-N 389.476 5.142 30 20 GKED Cc1nc2c(s1)[C@@H](Nc1c(C#N)cnc3c(Br)cccc13)CCC2 799322897 QZOFWADVROHQMX-HNNXBMFYSA-N 399.317 5.123 30 20 GKED N#Cc1sc(N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)nc1Cl 804432265 XBYJMYCLPCXHBW-GFCCVEGCSA-N 390.896 5.420 30 20 GKED C#CCN(C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1)C1CCCC1 810186835 YRZYDRHERYZDQO-UHFFFAOYSA-N 395.890 5.002 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813218825 ZQOBUFUFJUCDPL-QRVBRYPASA-N 380.369 5.234 30 20 GKED COc1ccc(Cl)cc1C(=O)/C=C/c1ccccc1OCc1ccccn1 819840852 IYHMKVFDPLCTTN-PKNBQFBNSA-N 379.843 5.219 30 20 GKED Cc1ccc([C@@H]2C[C@H]2C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 850769149 IZXXFGMCGGCJOI-BBWFWOEESA-N 379.410 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@](O)(c2ccccc2)C1 861012805 ISDRYNCUHVXEJJ-XMMPIXPASA-N 378.516 5.054 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1ccc(SC(F)F)cc1 914515010 GBBQFLYNFUMPAG-UHFFFAOYSA-N 384.407 5.313 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2cccc3ccccc23)cc1 915088717 VXOMEUZIJAPMEW-XMMPIXPASA-N 392.458 5.513 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccccc2Cl)cc1 915124774 VYNLGLKQDJDDFJ-GOSISDBHSA-N 377.900 5.804 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3ccccc3Cl)c2)cc1 916135247 NZLBHZWJYBPXBA-ZROIWOOFSA-N 391.854 5.497 30 20 GKED N#CCSc1ccccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047299 WMGRBBASFSFSDM-ZDUSSCGKSA-N 383.885 5.055 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 917426453 LRLIOFXCHSPMRA-XXJLXKPQSA-N 396.446 5.230 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NOCc3ccccc3)cc2Cl)cc1 918052741 NNOOXJRYVVUFFL-UHFFFAOYSA-N 393.830 5.257 30 20 GKED CCn1cc(C(=O)/C=C\c2ccc(-c3ccccc3Br)s2)cn1 920991503 LDPWMMZNECVKDE-CLFYSBASSA-N 387.302 5.290 30 20 GKED O=C(O)c1cc(NN=Cc2c3ccccc3c(Cl)c3ccccc23)ccc1F 1776061912 VIGLCZAYKBWHEM-UHFFFAOYSA-N 392.817 5.930 30 20 GKED CC(C)COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776126662 SSADKEGDKWVNGG-ACCUITESSA-N 390.435 5.576 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2ccccc21 1776308694 KNALKDSRUHQQCO-WVWKGNOCSA-N 388.488 6.133 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(F)c(C(=O)O)c3)s2)cc1 1777430606 QGGLSCNPXMXOIH-POHAHGRESA-N 381.428 5.160 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc3ccccc3o2)=C(/S)Nc2ccccc2)cc1 27183814 JAEVXEOKGAOPBS-UHFFFAOYSA-O 387.484 5.080 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccccc1C(F)(F)F 57374563 ZEOAZJRCSLFCCP-UHFFFAOYSA-N 396.368 5.930 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(C)C 63961878 FYOKWHRMONUYPR-UHFFFAOYSA-N 378.863 5.082 30 20 GKED Cc1ccc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 66545252 PRQSGURUUXQPCB-HXUWFJFHSA-N 385.492 5.189 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)CCOc2c1ccc(Cl)c2Cl 98055415 FEAWOCGPGDEUBG-GDNBJRDFSA-N 397.261 5.499 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2Cl)cc1Cl 107647464 RBSVBXIZKUNBQJ-SFHVURJKSA-N 399.252 6.040 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 110244549 SLQDNEQKIXGCJT-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1cccc(OC)c1 124230105 JYMXABZIJPNHEP-CQSZACIVSA-N 398.532 5.279 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 145310079 ORLIONATYXLFCH-OFVILXPXSA-N 396.490 5.123 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 160045376 JFJSIWISKYCJCV-OXJNMPFZSA-N 379.529 5.622 30 20 GKED CC(C)(C)c1nc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cs1 170673293 ZQTHFUACPGBCIW-LBPRGKRZSA-N 389.933 5.123 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H](C)c2ccccc2C(F)(F)F)n1 177765222 DZXSWCGPDQERDR-TZMCWYRMSA-N 380.435 5.655 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2cc(C)on2)c1C 188069482 UWDSDJFWOMMJKF-UHFFFAOYSA-N 377.488 5.495 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(Cl)c([N+](=O)[O-])c2)ccc1SC(F)F 214921631 XYXBZEQSXSAJGC-UTCJRWHESA-N 399.802 5.468 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246106613 OHILSMWCDAJNMN-OWCLPIDISA-N 377.579 5.219 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 303424954 DLJJEYCAEANOKM-VQTJNVASSA-N 389.417 5.032 30 20 GKED O/C(=N/Cc1cc(Cl)sc1Cl)[C@@H]1CCc2[nH]nc(C(F)(F)F)c2C1 329109988 JEYCPKGRMADNQT-ZCFIWIBFSA-N 398.237 5.058 30 20 GKED O/C(=N/CC1CCC(C/N=C(/O)[C@H]2CCCCS2)CC1)[C@@H]1CCCCS1 329341812 SHKVRAYEOPXYDB-OWCVQMPJSA-N 398.638 5.277 30 20 GKED OC(=Nc1nc(-c2cc(Cl)sc2Cl)cs1)[C@H]1C[C@]12CCOC2 329543740 FPBKNLCNSDKEMB-CLAHSXSESA-N 375.302 5.193 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]1c1cccnc1 363378055 OSMYJSBQWDCINU-HSZRJFAPSA-N 398.466 5.423 30 20 GKED CO[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 378623851 MDVKUOQXCPQWEM-ICSRJNTNSA-N 397.906 5.028 30 20 GKED Cc1cccc(CCNC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 409530020 NWCXAMYNUUQLMX-UHFFFAOYSA-N 399.494 5.004 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)c1 409779505 KXVORQCHGYABTA-ZWKOTPCHSA-N 378.378 5.055 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@@H](C)C3)s1 411007469 GLYTUEDPRVRFOD-GRYCIOLGSA-N 389.546 5.112 30 20 GKED C=CCn1c(SCCC2(C#N)CCCCC2)nnc1-c1ccccc1OC 412981262 FECBUOAMLWUGFO-UHFFFAOYSA-N 382.533 5.096 30 20 GKED C=CC[C@H](C(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644375 IAVNKRYFHXISCR-HKUYNNGSSA-N 378.447 5.033 30 20 GKED N#CCCC[C@@H](NC(=O)NCC1(Cc2ccccc2)CCC1)c1ccccc1 431289367 GBPMJVZKLSWDAK-JOCHJYFZSA-N 375.516 5.134 30 20 GKED C=CCC(C)(C)C(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 431746202 UHBOYOPRYNBQSL-HXUWFJFHSA-N 376.500 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccc(F)cc2)C1 432073814 DZRMWMNFPVCBOS-WBVHZDCISA-N 383.492 5.241 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(CC(F)(F)F)cc1 438366818 XUGPUDBFNQZIJW-MOPGFXCFSA-N 387.405 5.095 30 20 GKED N#Cc1c(NC(=O)c2cccc(-c3cscn3)c2)sc2c1CCCCC2 443817209 ODFULLGUZZPFBI-UHFFFAOYSA-N 379.510 5.264 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c(Cl)c1 455713147 BPDCYNKGVRJMRC-LJQANCHMSA-N 393.878 5.041 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)cc1 458849975 TYOODEUBOLPKSP-PTUXOGIPSA-N 375.516 5.318 30 20 GKED COc1cc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)ccc1OC(C)C 467683413 ZIIBZEGMXJYZAL-UHFFFAOYSA-N 395.503 5.044 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1 469074160 SXJNJBMMQPEHLX-UHFFFAOYSA-N 398.457 5.104 30 20 GKED C=CCOc1ccc(CN(Cc2nnc(-c3ccccc3)o2)C(C)(C)C)cc1 474160723 SEJXFMMQAGUBKJ-UHFFFAOYSA-N 377.488 5.102 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 475185052 ORCWEJZHOXWFRQ-AZUAARDMSA-N 378.472 5.193 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)NCC(C)(C)C#N 480370827 ZZRBRWYKORGYQU-UHFFFAOYSA-N 382.464 5.082 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1cccc(C(F)(F)F)c1 481214333 UXMISIJPNKMIPO-LLVKDONJSA-N 383.211 5.190 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cccc(COCC(F)(F)F)c1 481654152 CKGSRUUTVBRAGH-NRFANRHFSA-N 388.433 5.194 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(-c4nccs4)c3)c2)cc1 483046131 WFLLRSNNKSPADS-UHFFFAOYSA-N 397.459 5.726 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@H](C#N)c3nccc4ccccc34)cs2)cc1 483192720 HCMYNTLFBOUUQH-LJQANCHMSA-N 399.475 5.247 30 20 GKED N#Cc1ccc(F)c(CNc2cc(C(=O)Nc3ccccc3)ccc2Cl)c1 487378804 OGGFEBZHKFWHAC-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CC1CCC(CNC(=O)N2CCC(c3ccc(Cl)cc3Cl)CC2)CC1 490323613 BENMUZQPEGGMKI-UHFFFAOYSA-N 394.346 5.212 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCc2cc(F)c(F)cc21 498323883 RIAMNXYDGVSMCP-UHFFFAOYSA-N 392.430 5.191 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1c(Cl)cccc1Cl 501016568 FNDXSRJWCPMRHI-UHFFFAOYSA-N 385.250 5.234 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC[C@H]1C(F)F 502227919 MXLIFGPBRLPZAH-IBGZPJMESA-N 385.414 5.311 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1 505344816 QIGOTIVMFVDZBE-AWEZNQCLSA-N 385.703 5.363 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccc(F)c(Cl)c1 507161943 KYSSHEVMSGCFKX-UHFFFAOYSA-N 396.874 5.432 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)NCCCCC#N)cc1 509228959 VFCKPYZXGXNTOR-UHFFFAOYSA-N 387.867 5.346 30 20 GKED O=C(Nc1ccc(C(F)(F)F)nc1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 510048493 HJVNIVFPDLFRQY-LBPRGKRZSA-N 395.278 5.055 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1nc(-c2ccc(Cl)c(Cl)c2)oc1C 514243052 PYGOLQHEUUJPMR-UHFFFAOYSA-N 386.238 5.389 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC(C)(C)O1 520453691 CBKNOCSRDDZCKI-AWEZNQCLSA-N 399.878 5.035 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(Oc2ccc(C(C)(C)C)cc2)nc1 524963586 GFRPGHSVSUQBQQ-UHFFFAOYSA-N 392.421 5.362 30 20 GKED CC(C)(C)Cc1nc(-c2cccc(C(=O)Nc3ccc(C#N)c(Cl)c3)c2)no1 525003811 UTVXECRBICNYEO-UHFFFAOYSA-N 394.862 5.103 30 20 GKED C=C[C@H](CC(=O)N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccccc1 535366609 ZAUNEEVPVGMPSI-CLOONOSVSA-N 395.506 5.139 30 20 GKED C[C@@H](NCc1cc(Cl)cc(Cl)c1OC(F)F)c1ccc(C#N)c(F)c1 540707625 AUYQYYUZAHKQHQ-SECBINFHSA-N 389.204 5.456 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 541254937 DDIKANDXZWJURM-FQEVSTJZSA-N 395.506 5.759 30 20 GKED N#Cc1ccc(SCc2nc(Cc3nc4cc(Cl)ccc4s3)no2)cc1 545594359 XIVAERBTRWHDAK-UHFFFAOYSA-N 398.900 5.087 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@@H](C)c1ccccc1)c1ccc(C#N)cc1 557490754 RGMYYCVKJZMJHT-ROUUACIJSA-N 385.467 5.581 30 20 GKED N#CC1(CCCSCc2cc(F)c(C(F)(F)F)cc2F)CCOCC1 573757973 VEQNZHIIMMJLAQ-UHFFFAOYSA-N 379.394 5.317 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 584120986 XDPQOERICWUEAK-HNNXBMFYSA-N 394.540 5.470 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)c1 589382078 JAYXRWIWOMXGKL-UHFFFAOYSA-N 398.915 5.600 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1OC 592975746 OQLIXRRMIMNZEU-HNNXBMFYSA-N 398.459 5.113 30 20 GKED CCOc1ccc2nc(N(Cc3ccccc3)C(=O)CCCCC#N)sc2c1 593947534 VTFFIAZPNNARMB-UHFFFAOYSA-N 393.512 5.312 30 20 GKED CCc1c(C)sc(NC(=O)CCc2ncc(-c3ccc(C)cc3)o2)c1C#N 609032524 KWQASOKNPASFGD-UHFFFAOYSA-N 379.485 5.025 30 20 GKED N#Cc1ccc(CNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c(F)c1 609230034 LQHYTZHBRGUZKE-UHFFFAOYSA-N 398.359 5.313 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1 609376541 BYQRIXLKBSVXJT-AWEZNQCLSA-N 396.903 5.030 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 609414964 FFJBIGVEYLKGHY-QHCPKHFHSA-N 385.511 5.073 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 609501513 PFGSRWPNTAVAFE-INIZCTEOSA-N 387.439 5.175 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](CC1CC1)c1ccccc1 611395733 RQUKUQZAUFIZJP-UWJYYQICSA-N 393.556 5.150 30 20 GKED COc1ccc2oc([C@@H](C)NCc3ccc(C#N)cc3Br)c(C)c2c1 612512640 VPDHEIHPYFRKGU-CYBMUJFWSA-N 399.288 5.235 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cn1)c1ccccc1 613289593 SSXSKVBCXJWSHG-CRAIPNDOSA-N 399.475 5.321 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 614729874 NKTDDPJJGCWOSR-UHFFFAOYSA-N 380.494 5.258 30 20 GKED Fc1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1F 657300916 WHOTWXLGJUARBK-MYJAWHEDSA-N 379.266 5.103 30 20 GKED C=CCCC(C)(C)NC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 665822743 PJIQZJUFZUJEBX-UHFFFAOYSA-N 375.856 5.052 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C(F)(F)F)s1 671787802 QYBJDVAQLASABL-JTQLQIEISA-N 385.304 5.330 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)sc2c1 682994202 FPWXISATJCMWJL-ZDUSSCGKSA-N 377.856 5.296 30 20 GKED CCOc1c(OC)cc(/C=C2\Cc3c(ccc(Cl)c3Cl)C2=O)cc1OC 729151034 NZVWNXPINCRPFX-KPKJPENVSA-N 393.266 5.232 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(Cl)cc2)CCCC1)c1nc2cc(F)ccc2s1 730418716 YKXITVIYURKYQH-MRXNPFEDSA-N 398.890 5.777 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)Cc1ccccc1Cl 731115316 DJGYMUWUNYFOEH-LSDHHAIUSA-N 387.936 5.344 30 20 GKED N#Cc1cccc(COC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)c1 731377772 HSLZRXRNKYAAHJ-UHFFFAOYSA-N 380.403 5.237 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 732417824 KPRUEGLPSDTFKK-HNAYVOBHSA-N 390.512 5.244 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)[C@H](C)Oc1ccccc1C#N 733072723 RTFWGQXHEDOLFW-HOTGVXAUSA-N 392.480 5.062 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1cccc(Cl)c1 744035478 MRBCZVSSHOQGCN-HZMBPMFUSA-N 375.280 5.583 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 747105621 UFQOZZYNCBLBEV-ABAIWWIYSA-N 399.277 5.478 30 20 GKED CC(=NNc1cccc(C(F)(F)F)c1)c1sc(-c2cccnc2)nc1C 747602606 OPODWUKFZPEXCL-UHFFFAOYSA-N 376.407 5.368 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2SCC#N)c(O[C@@H](C)CC(C)C)c1 758652906 JFWPEYYPXTTWSQ-SFHVURJKSA-N 396.556 5.354 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cncc3ccccc23)cc1 765591413 SSSIDDMRVNSQKH-UZUQRXQVSA-N 399.494 5.028 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc4ncccc4c3)cc2F)c1 779595954 QRUOZVMWOWBGGN-UHFFFAOYSA-N 383.426 5.437 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(C#N)cc2F)cc1OCc1ccccc1 781109846 AVHLSDKITOKPIS-FLIBITNWSA-N 387.410 5.181 30 20 GKED C=CCn1c(SCc2nc(Cl)ccc2Cl)nnc1-c1ccoc1C 785019759 DDOZETYIMMNWNG-UHFFFAOYSA-N 381.288 5.027 30 20 GKED CC(C)(C)c1cnc(CCC(=O)OCc2ccc(-c3ccccc3C#N)cc2)o1 786205210 KBECXQIRGZZTSF-UHFFFAOYSA-N 388.467 5.187 30 20 GKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1nc(Br)ccc1F 794969701 JOGPNKYWRUJMKR-VQHVLOKHSA-N 389.249 5.003 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 808817470 GYKCUDFMWDZQFY-NHYWBVRUSA-N 381.785 5.068 30 20 GKED CCOc1cc(Br)c(F)cc1N[C@H](C)c1ccc(OCC#N)cc1 810259524 KZNDDWWRSOHIST-GFCCVEGCSA-N 393.256 5.062 30 20 GKED C=CCOc1ccc(CNc2cc([C@H](O)c3ccccn3)ccc2C)cc1Cl 812846706 MXDJKKGJCXKEQQ-QHCPKHFHSA-N 394.902 5.302 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H]1CCCC[C@H]1c1ccccc1 841681588 IMTWPYBTEATCKJ-SLYNCCJLSA-N 377.488 5.168 30 20 GKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842280264 AKBKZPLBHCSCCS-GOEBONIOSA-N 397.544 5.058 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](Cc2ccccc2)c2nccn2C)cc1 846207218 LUZHLIMTILFABY-XMSQKQJNSA-N 395.934 5.186 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cccc(C2CCCC2)c1 850758807 DTLFPUCACNEZJR-QFIPXVFZSA-N 388.511 5.430 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2[nH]1 916844447 JXCGUTMEGAZDHN-QXLXQBSBSA-N 387.439 5.320 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)[C@H](C#N)c1nc2ccccc2s1 916847416 GTPDPBCOGZUKRM-WBVHZDCISA-N 378.497 5.372 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2F)CCCC1)c1nc2cc(Cl)ccc2s1 917047050 PRSGMZFILHCILA-CQSZACIVSA-N 398.890 5.777 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(OCc2ccccc2)c(OC)c1 917524819 DNIKCNDEMDOGRK-UHFFFAOYSA-N 393.508 5.164 30 20 GKED C[C@@H](NC(=O)Nc1ccc(N(C)Cc2ccccc2)cc1)c1ccc(C#N)cc1 918047673 SFEDXYVETSTZRE-GOSISDBHSA-N 384.483 5.077 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc(F)c1)c1nc2cc(Cl)ccc2s1 918492098 LRWAQWLZDJGEPA-HNNXBMFYSA-N 388.851 5.124 30 20 GKED O=C(O)c1cc2c(C=NNc3ccnc4cc(Cl)ccc34)c(F)ccc2s1 1776011760 MKPROYKEXKSPNM-UHFFFAOYSA-N 399.834 5.386 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCC[C@H]1c1ccc(C(F)(F)F)cc1 1776050262 WUUKFNVQKTUXPM-HNNXBMFYSA-N 392.377 5.148 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(Oc2ccc(Cl)cc2)cc1 1776089051 YRBRTGQODRFBKX-UHFFFAOYSA-N 394.858 5.975 30 20 GKED Cc1cc(Cl)ccc1NN=Cc1cccc(OCc2ccccc2C(=O)O)c1 1776104590 OUZWJTFEMCEHNN-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)cc1 1776125670 PRBCGLJMODBZCG-WHYMJUELSA-N 392.495 6.030 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776472198 YPQLWGMVAHAXEQ-XTXQVDMPSA-N 396.439 5.302 30 20 GKED CCCCCCCOc1cccc(CNc2cc(C(=O)O)ccc2OC(C)C)c1 1776787444 OKHRVCKHKIJGPG-UHFFFAOYSA-N 399.531 6.133 30 20 GKED CCCCCCCOc1ccc(/C=C/c2cnc(C(=O)O)cn2)cc1OCC 1776788254 UTKTXKIUCREQRD-PKNBQFBNSA-N 384.476 5.093 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cccc(C(=O)O)c1 1777487711 IEUKIOFKVFXERM-BJMVGYQFSA-N 383.856 5.366 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(/S)Nc2ccc(C)cc2)cc1 22730950 LVSVAYYYVRRHDQ-UHFFFAOYSA-O 395.573 5.266 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)c(F)c2)[n+]2ccc(C)cc2)cc1 27293771 CAHRIGABSAMZCE-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1c(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)oc2ccccc12 55823549 SKFKZVCRPXOIEN-UHFFFAOYSA-N 396.446 5.639 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cccc(OC(C)C)c1 107811583 ZIOLWUOCBUDISP-UHFFFAOYSA-N 379.529 5.134 30 20 GKED Cc1ccc2c(CNc3ccccc3SC[C@@H](C)C#N)cc(=O)oc2c1C 108355151 QOEFUBPVBLVWIC-AWEZNQCLSA-N 378.497 5.274 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3ccsc3C2)cc1F 132615100 HXXDQLQBXYDEEN-UHFFFAOYSA-N 393.443 5.141 30 20 GKED Cc1cc(O)ccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 174134342 FNFTYCDASYOPRI-UHFFFAOYSA-N 378.815 5.270 30 20 GKED C[C@H](NCc1ccccc1COCc1ccccc1)c1ccc(OCC#N)cc1 181496081 BEBIQQCRGLIYBR-FQEVSTJZSA-N 386.495 5.157 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C[C@@H](O)c1ccco1 191447709 LJRHTHXPNQTOGX-AZUAARDMSA-N 382.504 5.252 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(N2CC=CC2)cc1 191476068 UWCWUUMPYBOEKB-UHFFFAOYSA-N 375.516 5.236 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 193382116 GZCBDIJIBMFLBI-LLVKDONJSA-N 395.793 5.162 30 20 GKED Cc1c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1C1CCCC1 193559539 CQNHYMVJRLLARR-AWEZNQCLSA-N 383.521 5.345 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCc4cc(F)ccc43)cc2)cc1 303041581 PZYXVVWEVBHWHY-JOCHJYFZSA-N 387.414 5.299 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(c2cccc(Cl)c2)CC1 303877352 OBXHJFUWDFDOAO-CQSZACIVSA-N 385.920 5.403 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)Nc1ccc(OC(F)F)cc1 329393338 UQRZSTGZAWHGFO-QGZVFWFLSA-N 390.434 5.003 30 20 GKED O/C(CC1CCCC1)=N/C1CCC(/C(O)=N\Cc2ccc3c(c2)COC3)CC1 330360306 WZJHTPUYHGFNPJ-UHFFFAOYSA-N 384.520 5.269 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3o2)cc1 364373859 SSMUODGSIBQOIC-LJQANCHMSA-N 388.471 5.388 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cccc(SCC#N)c1 429952674 KNBWFKRWGZFRHU-KRWDZBQOSA-N 392.549 5.767 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430592973 OADHEEMXELQZQJ-FUHWJXTLSA-N 391.540 5.536 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)o2)cc1 430605449 QZBSVFGZPOELLV-INIZCTEOSA-N 392.480 5.393 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 434982098 NIXNSXQAHYTKEC-WBVHZDCISA-N 398.457 5.499 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 435675276 UXYQPHMIVQBEKL-IBGZPJMESA-N 381.501 5.100 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)CC[C@@H]1c1ccccc1 438067849 QOQVVRYQANQRIT-CPJSRVTESA-N 395.506 5.139 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cccnc1C 439232133 GDEVRHXDUJRGFD-UHFFFAOYSA-N 391.858 5.374 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Nc2cscc2C)cc1 439369850 LGONSELHIDCMGF-UHFFFAOYSA-N 379.441 5.373 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@H]3/C=C/c3ccccc3)o2)cc1 441181922 OVMUFWSGZRLXNS-GLBTYYSXSA-N 384.483 5.066 30 20 GKED Cc1nc(-c2cccc(C(=O)N(Cc3ccco3)c3ccccc3C#N)c2)cs1 443834987 JOSUYHRLYUQHNV-UHFFFAOYSA-N 399.475 5.430 30 20 GKED C=CC1CCN(C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CC1 444031572 MGCOXYYRXVDJLV-HNNXBMFYSA-N 394.359 5.307 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3nc(-c4ccc(Cl)s4)cs3)CC2)cc1 445569077 QCYVFEIRGZMMBN-UHFFFAOYSA-N 385.901 5.067 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1cncn1Cc1ccccc1 445596322 HRBRXFGRHIFENA-UHFFFAOYSA-N 382.492 5.157 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1 455565948 AVTTVPMOSQESAY-KBPBESRZSA-N 392.446 5.999 30 20 GKED Cc1c(NC(=O)c2ccc(COc3ccccc3C#N)o2)sc2c1CCCC2 461668317 RLHMISIZKIGYAH-UHFFFAOYSA-N 392.480 5.231 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1nc2ccccc2cc1Cl 463467595 XENYSWWZGJFRDZ-UHFFFAOYSA-N 389.867 5.741 30 20 GKED N#Cc1cccc(CNC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)c1 470044868 TZSKXTOYEQWYET-IBGZPJMESA-N 387.405 5.014 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1nc2ccccc2s1 472754692 RQGZJZKVFPBFQE-CQSZACIVSA-N 396.541 5.055 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1 476080928 QWANPRQBJPPWDM-INIZCTEOSA-N 392.446 5.676 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(C(F)(F)F)c1 476092432 SBPVMEFZRIOUKF-UHFFFAOYSA-N 375.434 6.129 30 20 GKED Cc1ccc(-n2ncc(NC(=O)C[C@@H](CC#N)c3ccccc3)c2C(C)C)cc1 477011706 JWGNYMJCCRFITB-HXUWFJFHSA-N 386.499 5.330 30 20 GKED Cc1csc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1Cl 478698791 QAMHKLSPFTUBAJ-UHFFFAOYSA-N 396.899 5.607 30 20 GKED CCOc1c(Cl)cc(CN[C@@H]2CCCCc3cc(C#N)ccc32)cc1OC 481929332 TZNPNMXETVQHHC-HXUWFJFHSA-N 384.907 5.176 30 20 GKED Cc1ccccc1[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C(C)C 482997738 FDMWLARIPQYXAO-HSZRJFAPSA-N 385.467 5.181 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccc(C(=O)N2CCc3ccccc32)cc1 486464088 UJZYKDIOBAZHRL-UHFFFAOYSA-N 395.506 5.303 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](C)c2ccc(C#N)cc2)cc1 498118030 SHJLNXPZKPKCMD-FQEVSTJZSA-N 392.506 5.570 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](C)c2ccc(C#N)cc2)cc1 498118031 SHJLNXPZKPKCMD-HXUWFJFHSA-N 392.506 5.570 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)oc2ccc(F)cc12 505336164 ACOCLVXDPFEEKJ-AWEZNQCLSA-N 377.202 5.182 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)Cc1cccc(C(F)(F)F)c1 507767968 SBNBONDCDLKOOJ-UHFFFAOYSA-N 391.393 5.028 30 20 GKED CC1(C#N)CCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)CC1 509401250 FKPIOYYKKIMOET-UHFFFAOYSA-N 378.438 5.060 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2c2cccs2)cc1 510648608 WBMBNGSJJTXQPC-IBGZPJMESA-N 389.480 5.781 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)c1 515615500 XIGRGAVHTOERIK-RTBURBONSA-N 388.389 5.130 30 20 GKED N#C[C@@H](NC(=O)c1ccc(F)c(C(F)(F)F)c1)c1c(Cl)cccc1Cl 517343632 KIVJHPMGQQWVGY-CYBMUJFWSA-N 391.151 5.146 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(OC4CCCC4)c3)cc2)nc1 521092949 KPGSORPMBIZJIL-UHFFFAOYSA-N 399.450 5.319 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523590966 NDLFUENWYIDPOS-GOSISDBHSA-N 395.462 5.453 30 20 GKED C[C@@H](c1ccco1)N(C(=O)NCc1ccc(-c2ccccc2C#N)cc1)C1CC1 537007535 XGDWUMZFIOZBGK-KRWDZBQOSA-N 385.467 5.253 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccc(F)cc3F)C3CCCC3)cc2)CC1 539673840 WUHPTEAIQAADAX-UHFFFAOYSA-N 380.438 5.105 30 20 GKED COc1ccccc1[C@H](CC(C)C)NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 541507329 WGBMDJMTMXSTPJ-QFIPXVFZSA-N 391.515 5.028 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccc(F)cc1 561918786 VTSJHEKMVLKEMJ-JKSUJKDBSA-N 377.246 5.183 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](Oc2ncccc2F)C1 562351936 VNBPRQLQAZAMTI-GOSISDBHSA-N 397.494 5.148 30 20 GKED Cc1cc(Br)c(C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1Cl 568688584 TXZNWYHJRAFGFI-UHFFFAOYSA-N 394.700 5.091 30 20 GKED Cc1ccc(-c2nc(C(=O)N(CCC#N)c3ccc(F)cc3)cs2)c(C)c1 577427615 HUQOOKJUSZXUQA-UHFFFAOYSA-N 379.460 5.127 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)[C@@H]1CCCc2ccccc21 577684491 ICMXPSIOIYGWLF-HSZRJFAPSA-N 398.466 5.287 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2F)cc1Cl 603673214 MCUCVDGKCIUBGZ-GOSISDBHSA-N 382.797 5.526 30 20 GKED CC(C)[C@@H](NC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608837321 BYAQWLOUEOXMRF-IFXJQAMLSA-N 389.421 5.335 30 20 GKED N#Cc1cnc(NCC2(c3ccc(Cl)cc3Cl)CCOCC2)c(Cl)c1 608886065 PZPBPEFNJBPORA-UHFFFAOYSA-N 396.705 5.074 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(F)cc1 609296974 RCVGRLAMUBZHBT-UHFFFAOYSA-N 378.378 5.295 30 20 GKED C[C@@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccc(C#N)cc1 609598415 CBWDMGIZRYDINJ-CQSZACIVSA-N 383.904 5.098 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3nc4ccsc4s3)cc2)cc1 609795053 JLYBCNLKEKIMGJ-UHFFFAOYSA-N 391.477 5.468 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1cccc(COc2cccc(C#N)c2)c1 610053148 RSNGRGBBHIOZIX-XMMPIXPASA-N 399.494 5.146 30 20 GKED CC(C)(c1ccc(NC(=O)NCc2ccc(C#N)c(Cl)c2)cc1)C(F)(F)F 619800906 JKHVUPNFKQEZPF-UHFFFAOYSA-N 395.812 5.373 30 20 GKED C=CCC[C@H](NC(=O)c1c(C)noc1C(F)F)c1ccc(C(F)(F)F)cc1 676731447 ZODMXIRHDREMII-ZDUSSCGKSA-N 388.336 5.377 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@]3(C)CCCc4ccccc43)n2)cc1 726322366 SMHHDGCXKAPILQ-CYFREDJKSA-N 386.520 5.589 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 729571148 PTKPFZFXJHJBLQ-OAHLLOKOSA-N 377.469 5.603 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2c1 731333040 WAJXKRIJULQBRS-AWEZNQCLSA-N 391.496 5.198 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)Cc3coc4ccc5ccccc5c34)[nH]c12 735789603 MZYDQRZXTOOSHQ-GOSISDBHSA-N 379.419 5.190 30 20 GKED Cc1cccc(C(C)(C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 736955305 HLLYSYRCNCBJBE-HSZRJFAPSA-N 383.495 5.707 30 20 GKED COc1ccc(CN[C@H](CC(C)C)c2cccc(C(F)(F)F)c2)cc1C#N 742369609 OFKPOEGHGXFHCB-LJQANCHMSA-N 376.422 5.463 30 20 GKED C=CCC[C@H](NC(=O)NCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1 749776203 DNLUXUZYFVXAPO-INIZCTEOSA-N 397.828 5.261 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2ccccc2Cl)n1)Cc1ccccc1 750784568 QGQTZWUGBJKUQH-HNNXBMFYSA-N 382.872 5.003 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(OC)cc1 752481373 LFHVWHKDKJGSCC-DYVFJYSZSA-N 398.915 5.718 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2cccc(C(F)F)c2Cl)cc1OC 754484947 ZJKAFNIWTPUOQT-CSKARUKUSA-N 393.817 5.503 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 758909973 DRYRWSVWCXDKQK-IRXDYDNUSA-N 385.891 5.187 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=S)Nc1ccc(SC(F)F)cc1 779727948 QQUDYBPZLKJZNW-NSHDSACASA-N 379.457 5.101 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780678684 QMLCOWAGYDBQML-CUWPLCDZSA-N 377.488 5.086 30 20 GKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780679017 STHMJJKLKLRDSI-LAUBAEHRSA-N 377.488 5.470 30 20 GKED CCN(CC)c1ccc2cc(C(=O)/C=C/c3ccc4cnccc4c3)c(=O)oc2c1 782314446 SOSHNQYSBLVNII-UXBLZVDNSA-N 398.462 5.084 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1c[nH]c2ccccc12 786325855 WLOIDQGMAIDMEC-UKRRQHHQSA-N 392.409 5.283 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cn1 792860762 XSURVCXPSGECAH-TWGQIWQCSA-N 385.250 5.355 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)c(C)cc1Cl 796638017 YJJSHTQFCLPZQR-SFHVURJKSA-N 376.843 5.071 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ccccc2Br)s1 797572522 BAZCFMIRAHFHHO-ZDUSSCGKSA-N 391.334 5.012 30 20 GKED C=CC[C@H](OC(=O)c1coc(C2CCOCC2)n1)c1ccc(Cl)c(Cl)c1 800971660 SFQKCHSAWQEHJH-KRWDZBQOSA-N 396.270 5.350 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)c2c1 809092190 ZZHSQTNYEWLGPD-HDICACEKSA-N 385.467 5.092 30 20 GKED C[C@H](Nc1ccc([C@@H](O)C(F)(F)F)cc1)c1ccc(F)cc1C(F)(F)F 864021359 AWHODTUYUNINLK-BJOHPYRUSA-N 381.291 5.613 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 917026870 QUWHPMKFSBFLJO-SFHVURJKSA-N 396.899 5.499 30 20 GKED CCCCCCCCCC(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 918672877 UTXKVJBDESOVTJ-ZIAGYGMSSA-N 375.397 5.716 30 20 GKED CCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776127816 GKPCLEYZSQUYJO-ACCUITESSA-N 378.449 5.408 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccccc2)s1 1776354364 BOMCVRKBSOFUKV-LUAWRHEFSA-N 392.476 5.797 30 20 GKED CCOc1ccc(SCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCC2)cc1 10768152 SDRTYIDRLBKKLZ-UHFFFAOYSA-N 397.544 5.221 30 20 GKED C=CCn1c(SCc2ccc(F)cc2Cl)nnc1-c1ccccc1OC 14082566 GEZINVCWQQKBQB-UHFFFAOYSA-N 389.883 5.225 30 20 GKED Cc1cc(C)cc(N/C(S)=C(/C(=O)c2ccc(Cl)cc2)[n+]2ccccc2)c1 20834583 UDDVZOVOONLUCV-UHFFFAOYSA-O 395.935 5.295 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccccc3C(F)(F)F)c2)c1 31777189 NVFCXSUMEJKHNQ-UHFFFAOYSA-N 396.368 5.408 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1cccc(Cl)c1 49723801 XHFLTUUZNSAJTJ-UHFFFAOYSA-N 391.858 5.279 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccc(C)cc2)cs1 54894970 DXFPZYHLJGEDGR-FMIVXFBMSA-N 380.444 5.171 30 20 GKED C=CCN(C(=O)c1cc(Cl)c(Cl)n1C)c1nc(-c2ccccc2)cs1 71874289 GZEWMMAUEYXJGZ-UHFFFAOYSA-N 392.311 5.288 30 20 GKED N#Cc1c(NC(=O)c2cc(F)c(Cl)nc2Cl)sc2c1CCCCCC2 103383205 YUWLXXBYNSRJSF-UHFFFAOYSA-N 398.290 5.372 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 109159673 RTUKVUQXFQDQEL-MRXNPFEDSA-N 387.439 5.281 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 109162933 OZDMUOJJTUFIQK-INIZCTEOSA-N 387.439 5.281 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(F)c(Cl)c2)=C(\S)Nc2ccccc2)c1 122080877 SPXCQEOVTKHFHB-UHFFFAOYSA-O 399.898 5.126 30 20 GKED Cc1noc(C)c1[C@@H](C)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 127483391 OFQPIKQBUNMTOM-GFCCVEGCSA-N 395.846 5.100 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 132105498 SCDNRPNQUBLAOG-KDOFPFPSSA-N 375.394 5.111 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Sc3nnc(C)s3)cc2C)cc1 156665008 PHGJBYZWJYVZTD-UHFFFAOYSA-N 397.525 5.123 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)C(C1CC1)C1CC1 171216876 PWLOGGYEXMAKRH-UHFFFAOYSA-N 389.499 5.098 30 20 GKED C[C@@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 194659602 RLIHJYVMCPLFEA-ZDUSSCGKSA-N 384.888 5.410 30 20 GKED C[C@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 246605425 XUOKBWVWEIIHFE-ZIFCJYIRSA-N 379.529 5.491 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](c2ccc(F)cc2)C[C@H]1C 247052238 WSYPBXNGPJJRMF-JFIYKMOQSA-N 397.519 5.630 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1/C(O)=N/[C@@H]1CCOC2(CCC2)C1 329716005 VVNJWLSDAGVUAH-CYBMUJFWSA-N 395.286 5.363 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccc(F)cc2)[C@@H](N)C1 415581972 OGTBAACVHQXNQH-YADHBBJMSA-N 395.522 5.026 30 20 GKED N#Cc1cccc(NC(=O)CC2CCC(C(F)(F)F)CC2)c1Br 416082100 SAPDZFCKPLWQFE-UHFFFAOYSA-N 389.215 5.018 30 20 GKED CCOc1ccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c(C(F)(F)F)c1 425648101 UKVPCPFXWFLFMP-CYBMUJFWSA-N 391.393 5.201 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)(F)F)cc3)n2)cc1 429681155 BINYAWKMYRQLMZ-QGZVFWFLSA-N 398.434 5.420 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)s1 430624624 JJLCGGYEERSUKR-GFCCVEGCSA-N 385.470 5.054 30 20 GKED C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1C(=O)Nc1ccc(CC#N)cc1 435666838 CODILDDWWQQQBO-KBMIEXCESA-N 395.506 5.363 30 20 GKED N#Cc1ccc(CSCc2coc(-c3ccc([N+](=O)[O-])cc3)n2)c(Cl)c1 438875235 GDVGQURDKXMAIL-UHFFFAOYSA-N 385.832 5.208 30 20 GKED CCCc1c(NC(=O)Nc2ccc(F)cc2Cl)cnn1-c1cccc(C#N)c1 439223227 HLZVKIVINMRKQP-UHFFFAOYSA-N 397.841 5.133 30 20 GKED Cc1nc(-c2ccc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)cc2)cs1 442669442 CRSZURDOBMJAON-RBBKRZOGSA-N 387.508 5.031 30 20 GKED CCO[C@H](c1ccccc1)c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 445803397 SNZJNLWGUTWXOP-OILJVOJPSA-N 398.466 5.234 30 20 GKED CC(C)c1cccc(C(C)C)c1NS(=O)(=O)c1ccc(CC#N)cc1Cl 450992048 LWXOEEBIKJBWPE-UHFFFAOYSA-N 390.936 5.454 30 20 GKED COC1CCC(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 459235753 GFJAREVETGFIFP-OUNSHVDWSA-N 397.906 5.075 30 20 GKED Cc1nc(Sc2nnc(-c3ccc4ccccc4c3)o2)c(Cl)cc1C#N 461788884 UGPGFEQOFNFRQN-UHFFFAOYSA-N 378.844 5.270 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 463465710 BATOTKKEHCIXLS-UHFFFAOYSA-N 393.415 5.323 30 20 GKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)Nc2ncccc2OCCCC#N)cc1 466599914 IFGKOIQCZCVKOK-GHTZIAJQSA-N 392.503 5.078 30 20 GKED COCCc1ccccc1NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 466932848 DLWKQBCATFYBNO-SFHVURJKSA-N 399.494 5.297 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(CN(C(=O)[C@H](C)CC(=C)C)C2CC2)cc1 467724872 UPMBDVWWELEMPK-RTBURBONSA-N 382.548 5.321 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccc2)ns1)c1ccc(Cl)c(Cl)c1 468973931 OFQZYUGUXKUJOB-INIZCTEOSA-N 388.279 5.112 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-c2cn3ccsc3n2)cc1)c1ccccc1 474411259 HKDJTDBAJHFJSE-GOSISDBHSA-N 386.480 5.089 30 20 GKED N#CC[C@@H](CC(=O)Nc1ncccc1OCC1CCCCC1)c1ccccc1 475453878 STNVMIWVEALXGH-FQEVSTJZSA-N 377.488 5.067 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C2)cc1 477366927 UZWCKMUHZLLQLG-HXUWFJFHSA-N 383.451 5.372 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)CCCCOc1cccc(C#N)c1 477557606 HMQLIDSDYDNUPB-UHFFFAOYSA-N 385.467 5.117 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc2ccccc2n1C(F)F)c1ccc(F)c(F)c1 480702921 XENSMQWIWKCOHZ-KPZWWZAWSA-N 377.385 5.678 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1cccc(OC(F)(F)F)c1 481254784 JSYDBKNPZCNPGT-LLVKDONJSA-N 399.210 5.070 30 20 GKED C=C(C)[C@H](NCc1csc(-c2cccc(OC)c2)n1)c1ccc(F)c(F)c1 481600616 BIYLBOKZTHSUOL-FQEVSTJZSA-N 386.467 5.504 30 20 GKED CC[C@H](C)n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C 482556337 JRCDVKRCADZULW-YOEHRIQHSA-N 378.501 5.085 30 20 GKED Cc1nc2ccccc2n1C1CCN(CC#Cc2ccc(C(F)(F)F)cc2)CC1 482895949 SYRBVCRZZBSYLW-UHFFFAOYSA-N 397.444 5.052 30 20 GKED COc1ccc(C#N)cc1NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 495413566 FAXXDPJARBCPOZ-LJQANCHMSA-N 397.887 5.193 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccnc(-c2ccc(Cl)cc2)n1 497686892 IAKKDKPETWHHQJ-UHFFFAOYSA-N 394.887 5.055 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCSc2ccccc21 504093424 GPAYHUZPLNXXHH-OAHLLOKOSA-N 378.950 5.336 30 20 GKED C=CCCc1ccccc1NC(=O)N(CC(C)C)[C@H]1CCCc2cccnc21 505034503 FFBJWEKRXRKQTM-QFIPXVFZSA-N 377.532 5.768 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nnc1-c1ccncc1 505850511 HIIFMORVFJAGJX-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CN1CCC[C@@H](CNC2CCC(C#N)(c3ccccc3)CC2)[C@@H]1c1cccs1 507651984 VNYOBVSPPMRCCC-LDOASJGRSA-N 393.600 5.125 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 511352720 WVDRBQACCPUTPD-QHCPKHFHSA-N 393.506 5.406 30 20 GKED C[C@@H](c1ccccc1)N(CC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 512291240 GLVWAQPADFUMQR-MSOLQXFVSA-N 393.556 5.102 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@]4(CC=CCC4)C3)c2)cc1 512533508 FNLBUVHHTYRBTH-DEOSSOPVSA-N 387.483 5.705 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 512787736 KSXYLUGBQCCSLH-UHFFFAOYSA-N 395.462 5.212 30 20 GKED CCC(CC)CN(CCC#N)Cc1csc(N(C(C)=O)c2ccc(C)cc2)n1 513732317 DGUMHPUHCWIRIB-UHFFFAOYSA-N 398.576 5.288 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)cc1 518690540 PCIBOMPWWLGCEV-UHFFFAOYSA-N 389.499 5.425 30 20 GKED CN(Cc1cccc(F)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520603641 UAELFXJGTOMPSH-UHFFFAOYSA-N 375.403 5.154 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CCC(CC#N)CC3)c(F)c2)cc1 521974728 AGNNMBONVWUMRA-UHFFFAOYSA-N 395.478 5.437 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)sc1-c1cccc(Cl)c1 524013394 NBAKVOXESQKBQL-OAHLLOKOSA-N 391.883 5.743 30 20 GKED Cc1cccc2c1N(C(=O)c1cccc(COc3ccc(C#N)cc3)c1)CCC2 524490995 MQOCRROHDJTHNM-UHFFFAOYSA-N 382.463 5.039 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccccc2C#N)c1 524512588 ZNTNOJYEFNFKPD-YADARESESA-N 396.490 5.155 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 524822658 RNQCADZQTKQVAC-ZDUSSCGKSA-N 386.542 5.017 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)cc12 525284176 DMGWTRFLYVGJSC-NSHDSACASA-N 398.557 5.068 30 20 GKED C[C@@H](C#N)CN(C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)C1CC1 532820126 XYUIYFUPKAMIKQ-INIZCTEOSA-N 389.474 5.057 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 535348474 BYYRLPWLWSMZMG-IBGZPJMESA-N 384.479 5.546 30 20 GKED COc1cc(F)c([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1OC 537013752 QEYNPIOEKJYVJR-INIZCTEOSA-N 390.458 5.232 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F 537198964 QQBSORDHKYSIKI-IBGZPJMESA-N 383.454 5.522 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H](c3ccccc3)[C@@H]3CCOC3)c2)c1 540068879 VHKXMKGGELNXSH-RSXGOPAZSA-N 398.506 5.005 30 20 GKED N#CC1(c2ccc(C(=O)N3CCCCC[C@@H]3/C=C\c3cccs3)cc2)CC1 543110626 HVFCLDYTILDYHB-ZCPJJFRWSA-N 376.525 5.401 30 20 GKED C[C@H](N[C@@H](C)c1nc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543861459 RFWMTUIAYNMCPE-ROUUACIJSA-N 394.478 5.687 30 20 GKED CC(C)(c1noc(-c2cnc(C(F)(F)F)c(C#N)c2)n1)c1ccccc1Cl 551064525 FTAIAUWFVFUJLR-UHFFFAOYSA-N 392.768 5.001 30 20 GKED N#CCCC[C@@H](N[C@H]1CCc2c(F)ccc(Br)c21)c1ccccc1 551206096 PNMVVSDJRLXRLH-MOPGFXCFSA-N 387.296 5.600 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 553119355 IMPGWFZQXKNCCD-RPWUZVMVSA-N 387.527 5.326 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(F)cc2OC2CCOCC2)CC1 560573593 HLMNFVQBZBBCMF-UHFFFAOYSA-N 394.490 5.200 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC([C@@H](F)c2ccccc2F)CC1 561340476 JUYOEZFARRXSNL-QGZVFWFLSA-N 381.348 5.038 30 20 GKED C=CCC[C@H](Nc1ccc(Oc2ccnc(C(=O)NC)c2)c(F)c1)c1ccco1 577493375 BIAHWSJUDAJUJU-SFHVURJKSA-N 395.434 5.085 30 20 GKED CN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 580128832 YRVWGYIDHWBLSY-KDURUIRLSA-N 390.453 5.017 30 20 GKED N#Cc1ccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1Cl 586794311 WJNIXKDAJHBLTR-SFHVURJKSA-N 380.797 5.351 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\c1scnc1C 588517962 NYLCCGYDNUOOOR-KTKRTIGZSA-N 375.453 5.076 30 20 GKED N#CCCCCCC(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 588887940 IUEOXHFBCZGTLY-HXUWFJFHSA-N 375.299 5.673 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccc(O[C@@H](C)c2ccccc2)cc1 595750568 COLPFQXWNQPDHB-UFYCRDLUSA-N 391.515 5.223 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccs3)cn2)cc1 603690590 LXJKEAFNUQTKTJ-GOSISDBHSA-N 390.468 5.176 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)c1 603972452 QAGVUUFNPAASQB-UHFFFAOYSA-N 380.444 5.489 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)CSCc1ccc(C#N)cc1 609444559 DUIWARROTJXKPV-UHFFFAOYSA-N 388.492 5.531 30 20 GKED Cc1cccc([C@@H](C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1 610048285 STTMCWOTAZALEO-QGZVFWFLSA-N 388.442 5.327 30 20 GKED C[C@@H](Sc1ccccc1C#N)c1nc(-c2cccc(C(F)(F)F)c2)no1 610206580 LWGOGQGDJSIAOZ-LLVKDONJSA-N 375.375 5.480 30 20 GKED N#Cc1ccc(SCc2nnc(-c3ccc(Cl)cc3Cl)o2)c(F)c1 610218782 SSLYFYHJJZGQCQ-UHFFFAOYSA-N 380.231 5.346 30 20 GKED C[C@@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1cccc(C#N)c1 610329381 DYYSSEYOMKQQQK-GOSISDBHSA-N 385.467 5.158 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(SC)ccc1Cl 667464560 VLCMWYFNCHZCBY-UHFFFAOYSA-N 392.956 5.450 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(Br)c1)c1ccc2ccccc2n1 677083696 OQRYBCHVUPRGOW-CYBMUJFWSA-N 385.648 5.141 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCCCCCC3)cc2Cl)c1 728121632 KVAUSZXDXGWGLP-UHFFFAOYSA-N 397.906 5.589 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](c3ccccc3F)C2)cc1 730665186 STUGXORDMSLZEH-NZQKXSOJSA-N 399.469 5.503 30 20 GKED CC(C)c1ccc(C=NOCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 731029399 ASHMCWRSIJVMEC-KRWDZBQOSA-N 395.528 5.193 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)cc1 731030100 CKYVHCZAZQSKSP-OAHLLOKOSA-N 387.936 5.057 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)CCC(=O)N3)o1 734304840 XXNOOIBPVDQVLB-WEVVVXLNSA-N 375.399 5.175 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(COc3ccc(C#N)cc3)c2)C(C)C)c1 734321098 KVNUMUNNDJLILM-UHFFFAOYSA-N 394.474 5.174 30 20 GKED C=CC[C@@H](NC(=O)N(CCC)[C@H](C)c1cc2ccccc2o1)c1ccncc1 734678823 IUNIQGZPTAZYHP-YLJYHZDGSA-N 377.488 5.628 30 20 GKED C=C(Cl)CNC(=O)c1ccccc1SCc1ccc(Br)cc1 736239014 PJXYULABXHSRRC-UHFFFAOYSA-N 396.737 5.224 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)cc1 741470561 RPKAMECBVAOJCN-YZIPPPLESA-N 383.447 5.549 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@]3(C)CCc4ccccc4C3)n2)cc1 744034347 GXUMKGMPPBJQLZ-GBXCKJPGSA-N 386.520 5.490 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1ccc(Cl)cc1Cl 745696115 WMHOLDDQSZGQNW-UHFFFAOYSA-N 392.355 5.720 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2cccc(OC)c2)cc1 753392803 DXRSKJPXYFRVDU-HOIFWPIMSA-N 392.499 5.050 30 20 GKED C[C@@H]1C[C@H](NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2c(O)ccc(F)c21 756380553 VTXUZMQRAUGZOD-PRFIWBCESA-N 399.350 5.579 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)/C=C\c1ccccc1C#N 759291918 WBEPXROTQHFBDE-NJWFCXLTSA-N 387.508 5.223 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3c(F)cccc3F)n2)cc1 764567338 OOOJDDUFWXIPMD-ZFWWWQNUSA-N 382.435 5.377 30 20 GKED CCOCCC1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCC1 765907934 JLGLKUZYLPGUDJ-JOCHJYFZSA-N 391.515 5.060 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)c2ccccc21 767691676 SKLOBQUJMSUGAG-UHFFFAOYSA-N 387.270 5.086 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(F)cc2Cl)cc1 767871060 YGGQPKPGSQJVCH-HXUWFJFHSA-N 378.834 5.316 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 772971343 LYLPWTXILMWNHL-APWZRJJASA-N 392.549 5.556 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCCCc3ccc(Cl)cc32)ccc1OC 772984931 GPOOLGMKTCULIN-TZIWHRDSSA-N 398.934 5.587 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(OCC(F)(F)F)cc1 775220056 AWPSMXPGIMWVAG-ZDUSSCGKSA-N 398.812 5.034 30 20 GKED C=CC[C@@H](NCc1c(C(C)C)nn(Cc2ccccc2)c1Cl)c1ccncc1 776186537 UVNPUEPSBQFIJN-OAQYLSRUSA-N 394.950 5.510 30 20 GKED C#CCCCCCC(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 780370015 KHMFWOSAICDVBZ-GOSISDBHSA-N 377.488 5.092 30 20 GKED Cc1sc2ncn(N=Cc3ccc4occc4c3)c(=O)c2c1-c1ccccc1 794870764 BEOUVPTWRPBNCQ-UHFFFAOYSA-N 385.448 5.062 30 20 GKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccc(N2CCOCC2)cc1Cl 794940650 CARFAKHFIKWARF-FPYGCLRLSA-N 377.818 5.010 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)c(C#N)n2)cc1 799938812 IMGRUHHBNBBXGX-UHFFFAOYSA-N 379.338 5.111 30 20 GKED N#CC1(CCCOC(=O)C2(c3ccc(Cl)cc3)CCCCC2)CCOCC1 800156297 AECXTHDZYKKXAZ-UHFFFAOYSA-N 389.923 5.186 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1 803179637 LRXANSFIGSGLAG-IBGZPJMESA-N 377.406 5.229 30 20 GKED Cc1cc(NCc2ccc(C#N)cc2C(F)(F)F)ccc1N1CCSCC1 810149666 QYKSOZYRPHBARZ-UHFFFAOYSA-N 391.462 5.051 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1 815635704 HVUWEWHTZDZKAA-WIYYLYMNSA-N 385.552 5.047 30 20 GKED CC[C@H](c1ccc(F)cc1F)[S@@](=O)Cc1c(F)c(F)c(F)c(F)c1F 841720102 GFOPQUDGCQHNNJ-NDHGSNPTSA-N 384.316 5.060 30 20 GKED CCc1ccc(N(Cc2ccc(C)s2)C(=S)Nc2ccccc2C#N)cc1 915999227 KKYSBHIHFAXJLU-UHFFFAOYSA-N 391.565 5.894 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NOCc2ccccc2)cc1Cl 916683964 OKFFPSJDAHPSBD-HXUWFJFHSA-N 391.858 5.249 30 20 GKED N#CCCCOc1cccc(NCc2ccc(OCc3ccccc3F)cc2)c1 916843382 DWCLSNNHNUSVCN-UHFFFAOYSA-N 390.458 5.699 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ccc(Cl)c(Cl)c3)s2)c1 1776032665 IFGRGUGBRUPWSG-UHFFFAOYSA-N 391.279 5.866 30 20 GKED CC(=NNc1ccc(Br)cc1Cl)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776080135 KMGZKGYXIXBISV-PWSUYJOCSA-N 387.705 5.027 30 20 GKED C[C@@H]1/C(=C/c2ccc(C(=O)O)cc2Cl)C(=O)c2cccc(Br)c21 1776586510 ALWHINMIVUDBLH-VAENJDROSA-N 391.648 5.184 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3ccc(C)cc3o2)c2cc(C(=O)O)oc12 1777360858 XYKJXBJMZCLISE-ALCCZGGFSA-N 376.364 5.090 30 20 GKED Cc1cc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)sc1Br 1777418490 NPETVMHRHZGZIB-PLNGDYQASA-N 385.666 5.067 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC(C)(C)C)CC1 1826335099 XZWOQQQMEVUNRS-HXUWFJFHSA-N 390.612 5.035 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)ccc1C)=C(/S)Nc1ccccc1 10170645 FVHPMUBPWJXVLO-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@H](C#N)Cc3ccc(C)cc3)o2)cc1 24721792 JQMUGQQCRQEOPY-FQEVSTJZSA-N 392.528 5.118 30 20 GKED Cc1ccc(C)c(N/C(S)=C(\C(=O)c2ccccc2C)[n+]2cccc(C)c2)c1 55011866 APJWYHFKTYDTMN-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=C(C)COc1cc(CNCc2ccccc2OC2CCCC2)ccc1OC 60948455 OUKPXJMMODZQKX-UHFFFAOYSA-N 381.516 5.261 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 63747627 IFILNNFCAHMFSL-ZDUSSCGKSA-N 393.339 5.517 30 20 GKED CC(C)(C)c1nnc(NC(=O)c2ccccc2Sc2ccccc2C#N)s1 108401622 YNODGGFSNSMJDM-UHFFFAOYSA-N 394.525 5.111 30 20 GKED Cc1cncc(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 122013538 IEUNKXHMCANSEK-WJCMJQHKSA-N 379.872 5.057 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 131948542 GFISSKZQWRDMOQ-KBXCAEBGSA-N 375.394 5.111 30 20 GKED Cc1ccc(C[C@@H](NC(=O)N[C@@H](CCC#N)c2ccccc2)c2ccccn2)cc1 151435655 NJIBGCRBPTXQCU-LADGPHEKSA-N 398.510 5.018 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(F)cc1C(F)(F)F 151712330 LBSFUSLSBMHZSB-UHFFFAOYSA-N 395.274 5.514 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3sccc3C#N)s2)cc1 154764476 WQPDDKJLUGVKSQ-AWEZNQCLSA-N 381.526 5.193 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(N(C(C)=O)c2ccccc2)n1 164636362 RVBBBXPTZAWHSO-UHFFFAOYSA-N 377.513 5.016 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c(F)c1 176077586 PDDCFAHIXKMXGP-SFHVURJKSA-N 388.826 5.071 30 20 GKED N#Cc1csc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 176949013 DJVNEICEUNWSSN-QGZVFWFLSA-N 377.856 5.181 30 20 GKED CCSc1ccccc1[C@@H](C)NCc1ccc(OC)c(O[C@H](C#N)CC)c1 180810100 PIOSWOSSPLUOTL-AEFFLSMTSA-N 384.545 5.339 30 20 GKED C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@@H](CCC#N)c1ccccc1 181572962 RICCHVZFAUWVPF-QAPCUYQASA-N 389.421 5.057 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccc(Cl)cc3)c2)cc1 208016602 IIPVHTBWMVBLPO-MLPAPPSSSA-N 386.838 5.360 30 20 GKED C=CCN(C(=O)c1ccc(OC(F)F)cc1)c1nc(-c2ccccc2)cs1 301142036 FDKOUEHADVIIMM-UHFFFAOYSA-N 386.423 5.244 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(O)=Nc1cccc(-c2nccs2)c1 329304821 ONWHTXXDHHWQNE-GOSISDBHSA-N 395.532 5.313 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 409755937 SMRJQRGYUOUOSC-MOPGFXCFSA-N 385.294 5.183 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1 432833249 VSLQHSJVVKGTDC-PGRDOPGGSA-N 395.572 6.442 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1 432833251 VSLQHSJVVKGTDC-XMSQKQJNSA-N 395.572 6.442 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1C 438074298 OFBPYZSLJJDOME-VWLOTQADSA-N 395.506 5.467 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(CC(F)(F)F)cc1 438262823 WXOVCTLZWXCXSZ-UHFFFAOYSA-N 389.421 5.353 30 20 GKED CCCc1c(NC(=O)c2oc3ccccc3c2C)cnn1-c1cccc(C#N)c1 440074672 HDZRNGOTZMRLLZ-UHFFFAOYSA-N 384.439 5.003 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3ccc(Cl)c(Cl)c3)C3CC3)o2)c1 441199604 DDTHFERRAVTZFH-UHFFFAOYSA-N 399.281 5.080 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 451504219 FNUFIXMQPGXUKG-XHDPSFHLSA-N 385.323 5.081 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458804115 SBXVKLGFXLCUSK-DHIUTWEWSA-N 375.516 5.147 30 20 GKED CC(C)Oc1ccc2ccccc2c1CNCc1cccc(OCCCC#N)c1 463716893 NKGCWHHEAAFECL-UHFFFAOYSA-N 388.511 5.599 30 20 GKED Cc1c[nH]cc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464302753 YJLQZSFBSGJHIL-UHFFFAOYSA-N 385.345 5.258 30 20 GKED N#Cc1ccsc1C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 469891400 FWLDJOUWKUADCR-UHFFFAOYSA-N 390.251 5.366 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 471203093 JPAUFISKCUPZKD-UHFFFAOYSA-N 399.494 5.549 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 475406903 CNRMTHVEDHMDAJ-CYBMUJFWSA-N 378.419 5.453 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cncc(Cl)c3Cl)c2)cc1 480841689 OUPFQCJREULRNF-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C=CCN(CCc1ccccc1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 499304243 ACLQCGMSZXLYJT-UHFFFAOYSA-N 394.902 5.185 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1 499838051 NCNFETXCAKDWKC-ZQIUZPCESA-N 379.674 5.131 30 20 GKED Cc1cc(Cl)c2ccccc2c1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 500174318 ZYNNKSBUOFHRSR-UHFFFAOYSA-N 389.764 5.339 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccc(Oc4cccnc4)cc3)n2)c1 502416194 OVCQQIZVEJMWJF-UHFFFAOYSA-N 398.447 5.121 30 20 GKED COc1ccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(OC)c1 502605331 XTYUFFLKPWVPCR-UHFFFAOYSA-N 389.411 5.012 30 20 GKED CCN(C(=O)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccc(C#N)cc1 510397336 UEHGASUUNQCOMT-UHFFFAOYSA-N 381.888 5.310 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccccc1F 510829548 YWGQNQVMADFSSN-QFIPXVFZSA-N 381.410 5.036 30 20 GKED CC(C)c1c(C(=O)Nc2sc3c(c2C#N)CCCC3)cnn1-c1ccccc1 514495202 IUMBOGVJNPLYLS-UHFFFAOYSA-N 390.512 5.060 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 518170139 ZXMJNIGSMIZUFC-IRXDYDNUSA-N 397.544 5.608 30 20 GKED C[C@H]1CCN(C(=O)CCCCOc2cccc(C#N)c2)c2ccccc2S1 521087259 VODNYVYBIOLRBV-KRWDZBQOSA-N 380.513 5.025 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 521141001 FPJAGXNBBPWOOH-YVEFUNNKSA-N 379.312 5.103 30 20 GKED CC(C)COc1ccccc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 521260336 BUMWDUILHBWBOA-QGZVFWFLSA-N 397.544 5.295 30 20 GKED C=CCOc1ccccc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 521264112 WVISHWPKZXIBHK-AWEZNQCLSA-N 396.418 5.143 30 20 GKED CC[C@@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1nc2ccccc2[nH]1 524113546 VXZFCESLLXXXNT-HXUWFJFHSA-N 395.466 5.059 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CC(c2ccccc2)c2ccccc2)c1 524113990 KJCCPWDDIPMPNS-UHFFFAOYSA-N 392.405 5.320 30 20 GKED C[C@H](Nc1ccc(NC(=O)C2(C#N)CCCCC2)cc1Cl)c1ccccc1 524422565 VCSCLBJDNYPSQQ-INIZCTEOSA-N 381.907 5.926 30 20 GKED CCc1nc(CN(C)C(=O)c2ccc(Sc3ccccc3C#N)cc2)cs1 530643131 ORZXOKMVPMELAZ-UHFFFAOYSA-N 393.537 5.001 30 20 GKED C=CCC[C@@H](NCc1cc2ccccc2nc1O)c1ccc(C(F)(F)F)cc1 537128419 FRZUTOIGMDLVMO-LJQANCHMSA-N 386.417 5.756 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)nn1[C@H](C)C1CC1 540730778 RVTVNICQWWRHMY-CQSZACIVSA-N 382.533 5.007 30 20 GKED Cc1ccc(CCCSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 541294702 UQZZMBQIKBFHIN-SFHVURJKSA-N 398.597 5.694 30 20 GKED C[C@H](NC(=O)c1c(Cl)cccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 542927064 DSJWTIQCEBRNAS-AWEZNQCLSA-N 395.289 6.023 30 20 GKED Cc1ccc(CN(C)C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 543016485 LZCTWURQLJKSBR-QGZVFWFLSA-N 389.524 5.498 30 20 GKED CSc1ccc(-c2noc(-c3cnc(C(F)(F)F)c(C#N)c3)n2)c(Cl)c1 556309033 VRJRXRPMSWUAKX-UHFFFAOYSA-N 396.781 5.064 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1coc2ccccc12 560479328 QZNKFSMFOKJSHP-UHFFFAOYSA-N 396.446 5.373 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1c[nH]c2cccc(Cl)c12 571292760 UQVVVJBZLDUCRF-ZDUSSCGKSA-N 383.904 5.254 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cc2)ccn1 571847138 RUDGDVUBZBMMHF-UHFFFAOYSA-N 399.450 5.127 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1 577909297 JHUTXGVTAUMQHP-LJQANCHMSA-N 388.483 5.244 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc(CCC3CCCCC3)o2)c1C 589277292 IORXGQKYAREJNS-UHFFFAOYSA-N 387.549 5.162 30 20 GKED CC[C@@H](C)c1nc(C)c(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)n1 593973534 CSWVZYLLACOLMN-LSDHHAIUSA-N 396.560 5.040 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1F 596606942 ZXIMUVHSTRQNPM-SFTDATJTSA-N 395.478 5.116 30 20 GKED Fc1ccc2ccc(=N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)[nH]c2c1 608079036 AXXPRHMKEDYFQD-PJXYFTJBSA-N 380.307 5.117 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609641076 NRNGCBMCGNGINU-UHFFFAOYSA-N 388.492 5.027 30 20 GKED CC[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1F 610009966 MBLGPVVISXAXHS-DEOSSOPVSA-N 392.449 5.656 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610290622 MIWKIZNGJAUZLP-MRXNPFEDSA-N 389.430 5.092 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(CC(F)(F)F)C(C)C)cc1 610703116 XKPLYRWEIWTFBP-UHFFFAOYSA-N 376.378 5.072 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 678451758 PFWGIRRCUVYADS-HNAYVOBHSA-N 391.437 5.477 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1coc2cc(F)ccc12 684388450 YYCSQOZECYJLKV-IUCAKERBSA-N 397.290 5.211 30 20 GKED O=C(/C=C/c1ncc(-c2cccc(Br)c2)[nH]1)c1c[nH]c2ccccc12 731936649 BWKISVJXSQOCOQ-CMDGGOBGSA-N 392.256 5.217 30 20 GKED C=CC[C@H](NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1ccncc1 734460363 PARWKDXDGFJAGB-QHCPKHFHSA-N 384.479 5.145 30 20 GKED Cc1ncsc1COC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 735212248 ZOYWSWRGACTPSC-UHFFFAOYSA-N 384.844 5.126 30 20 GKED CC[C@H](C)Oc1cc(/C=C\C(=O)c2c(Cl)nc3ccccn23)ccc1OC 737445616 CAVFNUDXIHLYPW-GDAGCXPBSA-N 384.863 5.070 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)[nH]2)CCc2nc(-c3ccccc3)sc21 742432727 GBQZNGCGSARGND-LGMDPLHJSA-N 383.476 5.413 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)ccc1OC(F)F 745989868 DLZSDUHYNHTLQB-YCRREMRBSA-N 395.405 5.645 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3ccc(Cl)s3)n2)cc1 750687030 JOVXKJJXKAHMMB-OCCSQVGLSA-N 386.929 5.813 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 757681047 XDLPPCFMYKGUQQ-XUEUYAKLSA-N 389.898 5.528 30 20 GKED N#Cc1cc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)ccc1F 759041628 IJYMRQPGVYJOBI-UHFFFAOYSA-N 393.921 5.620 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc4[nH]ccc4c3)n2)cc1 765915010 IIWCOZNKPUMVCH-FVXMCEBTSA-N 383.476 5.490 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccccc2)CC1)c1nc(-c2c(F)cccc2F)cs1 771267511 UYIBJHQPJFWSOL-OAHLLOKOSA-N 394.446 5.287 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2cc3ccccc3[nH]2)cc1 771464353 RZKLGPRDXPMSJS-HSZRJFAPSA-N 394.478 5.188 30 20 GKED CCOc1c(Br)cc(/C=C/C(=O)c2cccc(F)c2F)cc1OC 776268042 KJNQVVYCDMFCAQ-BQYQJAHWSA-N 397.215 5.031 30 20 GKED Cc1nnc([C@@H](C)OC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 783703402 JXWMPINBQCWNMM-LLVKDONJSA-N 399.859 5.082 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCc3cc(Br)cc(C)c32)c1 786852694 IGASXSHYEROZSG-ICSRJNTNSA-N 399.332 5.216 30 20 GKED CC(C)c1ccc(C2(C(=O)OCCCC3(C#N)CCOCC3)CCCC2)cc1 800165668 VVKRVDAGRSRDEQ-UHFFFAOYSA-N 383.532 5.266 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)c1 801664039 KWMYNEPPADZQOE-KRWDZBQOSA-N 380.341 5.037 30 20 GKED O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N(CCC(F)(F)F)CC(F)(F)F 801705639 RLFFCMPDQMRGKI-SNVBAGLBSA-N 399.228 5.059 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)c2csc(-c3cccc4ccccc34)n2)CC1 809088834 DMZVUWWAGDYHMR-IYBDPMFKSA-N 376.481 5.450 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)/C=C\c3nc4ccccc4s3)cc2)ccn1 810822773 SXWMGAPTNBGYIB-KTKRTIGZSA-N 398.447 5.007 30 20 GKED Cc1oc(-c2cccs2)nc1CON=Cc1ccc(Br)cc1 818264674 XAAZGZRLCDYYDC-UHFFFAOYSA-N 377.263 5.025 30 20 GKED CCOP(=O)(CCC=NNc1nc2cc(Cl)ccc2cc1C)OCC 834969422 HBBPGAVABRJWGR-UHFFFAOYSA-N 383.816 5.251 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1cccc(Br)n1 853356605 IIFBUGSRYGOUEA-UHFFFAOYSA-N 392.141 5.297 30 20 GKED C=C(C)C[C@H](NCc1c(Cl)cccc1OCc1ccccc1Cl)C(=O)O 864529713 LJQDQCNMXOHKMB-SFHVURJKSA-N 394.298 5.081 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccc2c(c1)CCO2 918711842 CKZLJDHPMOOKDP-DAXSKMNVSA-N 397.883 5.207 30 20 GKED CC(C)CCSCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 920112751 JVWNMOPFJBUSDM-LBPRGKRZSA-N 386.464 5.271 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3csc4ccccc34)n2)cc1 920143439 ZSRGSVNMJAAGHM-SFHVURJKSA-N 399.500 5.315 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)cc1 1776125667 PRBCGLJMODBZCG-HMQSQOOHSA-N 392.495 6.030 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)Cc1csc(-c2cccc(C(=O)O)c2)n1 1776180546 JHGPVSNSLHWEAD-UHFFFAOYSA-N 398.915 5.350 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776339854 HMUJPVRIEXMQDT-WJDWOHSUSA-N 384.475 6.146 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CCC(=O)O)c2ccccc2)c1 1776787965 KIUDPEFWXWMJSE-QHCPKHFHSA-N 383.532 5.732 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776805993 PHHFXNRQZYEEQT-OWBHPGMISA-N 390.504 6.352 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2cccc(C(=O)O)c2)cc1 1776869257 QTXJTHDTZMVAJP-SSZFMOIBSA-N 385.463 5.307 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3cc(C(=O)O)c(Cl)s3)oc12 1776940837 YWGPUGQYILXEIL-SREVYHEPSA-N 376.817 5.141 30 20 GKED COc1cc(C)ccc1Oc1ccccc1/C=C\C(=O)c1cccc(C(=O)O)c1 1777281622 DELHNHMWMQMHNT-QXMHVHEDSA-N 388.419 5.390 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])c(Cl)c1 15117027 MCOHEEWTFUGBCW-UHFFFAOYSA-N 378.771 5.143 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)o1 54849626 SJWJPULSTSYLLG-UHFFFAOYSA-N 387.222 5.289 30 20 GKED Cn1cc(CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c2ccccc21 65852634 HBZZFGIPNOEHLH-UHFFFAOYSA-N 381.435 5.023 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(C2CC2)n(C(C)(C)C)n1 108237906 CBCHEJBBLCTSNC-CQSZACIVSA-N 382.533 5.020 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 128105832 HAEYXTXVOUQWEJ-LLVKDONJSA-N 383.325 5.158 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(F)c1F)c1nc2cc(Cl)ccc2s1 159836118 JWYNZZCSAKVLDY-LBPRGKRZSA-N 376.815 5.037 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)NC[C@@H](C)C#N 176476405 XMVOVFHTJUMHON-AWEZNQCLSA-N 393.466 5.013 30 20 GKED CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCO1 181712312 APGZYCGXGWBSHG-WDYCEAGBSA-N 389.565 5.044 30 20 GKED Cc1csc(-c2ccc(NC(=O)Nc3ccccc3O[C@H](C)C#N)cc2)n1 183943783 FJWOVEQFEBITMA-CQSZACIVSA-N 378.457 5.053 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1cn(C)c2ccccc12 185352046 FEORJPALZHJRCP-HZPDHXFCSA-N 377.513 5.172 30 20 GKED Cc1ccc(-c2noc([C@@H](C)SCCCC3(C#N)CCOCC3)n2)cc1F 281738806 DXTDLXZMMAKZGZ-OAHLLOKOSA-N 389.496 5.079 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1 303828170 GDZAJAZYYDAKDB-HSZRJFAPSA-N 376.500 5.170 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(NC(=O)c2cccs2)cc1 410347091 YQODFUIRVPLTEB-UHFFFAOYSA-N 376.481 5.371 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1ccc(C)cc1 429196559 GOIZMCJYRKUXFY-OAQYLSRUSA-N 394.478 5.172 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2cccs2)c2ccc(F)cc2)c1 429824348 KRUGLFDAAYWYLM-UHFFFAOYSA-N 382.485 5.350 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 429852613 PFALNCVRHNGSKM-UHFFFAOYSA-N 385.448 5.503 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1nc(-c2ccccc2Cl)cs1 433339953 CNCVODJMNKZKKU-HNNXBMFYSA-N 381.888 5.175 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1 434157067 JPIVQJFBCHVPJE-AWEZNQCLSA-N 389.377 5.157 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c[nH]nc2-c2ccsc2)cc1 436138351 BFQHYAKERXPUSO-UHFFFAOYSA-N 386.436 5.054 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(C)n1C1CC1 437474394 NRQKMEJTQUAMOJ-UHFFFAOYSA-N 389.430 5.495 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1 437967823 ASHCNMSDDZRMQL-GOSISDBHSA-N 385.414 5.227 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)N(C)CCC#N 443913043 JLYOHKZVGFLBGQ-UHFFFAOYSA-N 393.466 5.109 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)[C@@]1(C#N)C[C@@H]1C 450004785 SQRAHHWYRNVWOU-NPMXOYFQSA-N 390.462 5.220 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3CCSc4ccccc43)c2)cc1 460167417 WUMCRXOQMISAPY-NRFANRHFSA-N 386.476 5.569 30 20 GKED C=CCOCCCC(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 463296442 UONDKJAABWSMST-HXUWFJFHSA-N 378.299 5.182 30 20 GKED N#C[C@H](C(=O)c1csc(Cl)c1)c1nc(-c2ccc(Cl)cc2)cs1 467271370 MYEXZXGANMGILV-GFCCVEGCSA-N 379.293 5.668 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC[C@H](C(F)(F)F)[C@@H]2C)cc1 470629555 VMASNTBQJSAJNX-KSSFIOAISA-N 388.389 5.072 30 20 GKED C[C@H](Sc1cccc(C#N)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471243402 MQAFQHJOFXTYRO-JTQLQIEISA-N 376.268 5.768 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 471283737 UOSYUOCSUXPSIV-HHXXYDBFSA-N 397.519 5.535 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1 471977840 JLQBHSGLSPIMRP-ZEQRLZLVSA-N 392.543 5.251 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccccc1)C(C)(C)C 480569738 PXIXXLKMXFHBBN-OAQYLSRUSA-N 382.552 5.339 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1ccnc2ccccc12 483369940 DRVOJTAGDYZKEG-UHFFFAOYSA-N 395.437 5.401 30 20 GKED N#Cc1cc(NC(=O)CCc2nc3ccccc3o2)ccc1Oc1ccccc1 490553742 CHXDDYHYOZRMOW-UHFFFAOYSA-N 383.407 5.063 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H]2CCCc2ccccc2)cc1 494267786 JPCKQZZXIDEZBR-JOCHJYFZSA-N 375.516 5.507 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)CCCCC(=O)c2ccccc2)cc1 498478248 VFXMGSSSQJFYHY-NRFANRHFSA-N 376.500 5.108 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 503753259 BRDSGJMOXDMOCF-HSZRJFAPSA-N 383.495 5.707 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(C#N)cc1 504887004 GTBQRANNSOCIFG-QGZVFWFLSA-N 377.447 5.264 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)C1CCC1 511310906 YGWXOIYYMVJRHX-HSZRJFAPSA-N 375.516 5.267 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3(c4cc(F)cc(C#N)c4)CC3)cc2)c1 511730004 ONWNCLYXIBKJEM-UHFFFAOYSA-N 397.409 5.032 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(COc3ccc(C#N)cc3)o2)s1 513325016 DXGUGVUBIHRRGD-LJQANCHMSA-N 392.480 5.078 30 20 GKED Cn1cc(CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c2ccccc21 517511297 VICLLVXZBHIXJU-UHFFFAOYSA-N 381.435 5.023 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCCOc1cccc2ccccc12 518489869 FASHPYRXXAMQKK-UHFFFAOYSA-N 396.899 5.116 30 20 GKED COC(=O)c1sc2ccccc2c1CNc1ccccc1SC[C@@H](C)C#N 518661886 LDAOOTDCKIAWJD-AWEZNQCLSA-N 396.537 5.552 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CCC(=O)c1ccc2ccccc2c1 521142422 PDACOUUKRFPWAY-UHFFFAOYSA-N 398.506 5.359 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)cc1-c1ccc(F)cc1 532290378 PZVIKGBGGDMHRN-QGZVFWFLSA-N 389.455 5.537 30 20 GKED C=CCN(C(=O)[C@@H]1CCO[C@@H]1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 536123584 YBIVKODVHWZESR-DGCLKSJQSA-N 397.327 5.061 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(OCC(F)(F)F)cc1 538527282 BFDGUKMCQWMXJU-HNNXBMFYSA-N 378.394 5.483 30 20 GKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 539030880 OTMADRSJCSYFBU-DYESRHJHSA-N 377.488 5.126 30 20 GKED CCOc1cccc([C@@H]2C[C@@H]2NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 539453495 AHPAURMOHFQIDQ-BPAFIMBUSA-N 395.528 5.015 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1)C(=O)Nc1ccccc1C#N 539853428 DPPIGJYETODMIZ-IAGOWNOFSA-N 387.458 5.042 30 20 GKED COc1ccc([C@H](NCc2ccc(CC#N)cc2)c2ccccc2Cl)cc1 541295195 VIOPORSSOXNIIF-QHCPKHFHSA-N 376.887 5.294 30 20 GKED C[C@H](NC(=O)N[C@H](c1cccnc1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543004371 PPVMZRBSJYDHBM-XDHUDOTRSA-N 396.494 5.132 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1ccc(-c2cccc3cccnc23)cc1 556970654 YQTOIZQMMPYLIG-UHFFFAOYSA-N 382.463 5.366 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H]1CCc2ccc(C#N)cc21 558504732 XKYHZVLBCFFUJR-XCLFUZPHSA-N 377.488 5.467 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)N[C@@H]2CC[C@H](C#N)C2)nc1-c1ccccc1 566616867 GVJAMCAUYQJFBW-QXAKKESOSA-N 392.503 5.004 30 20 GKED COc1ccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1Br 576131630 ZXDSMXWEAUCTIA-ORAYPTAESA-N 385.305 5.058 30 20 GKED CC[C@H](C)c1nnc(N2CC=C(c3ccc(C#N)cc3)CC2)n1Cc1ccccc1 578928690 ISEZQWNDRKSSSW-IBGZPJMESA-N 397.526 5.005 30 20 GKED Cc1ccc(OC(F)F)c(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c1 579778895 VDJSXXSCADEMJR-UHFFFAOYSA-N 381.382 5.268 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccoc2C(F)(F)F)cc1F 583664822 RFARSWUXHFEMPG-UHFFFAOYSA-N 390.292 5.354 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1cnc2ccccc2n1 588587635 VHLOUWWJGMBNPU-FWLQQBITSA-N 382.250 5.216 30 20 GKED N#CCCCCCC(=O)N(Cc1ccccc1OC(F)(F)F)C1CCCC1 588753673 DEOFZTZVYIPPFI-UHFFFAOYSA-N 382.426 5.330 30 20 GKED C=C(C)COc1cccc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)c1 589382615 VFAUIARJEUOQRX-UHFFFAOYSA-N 396.874 5.521 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)N[C@H](C)c1cccc(C#N)c1 589789481 LECRMPQMUALPQJ-UXHICEINSA-N 383.495 5.592 30 20 GKED N#Cc1ccc2c(c1)CN(C(=O)Nc1cc(Cl)ccc1OC1CCCC1)C2 594096020 NJXAGRMYBDZDBN-UHFFFAOYSA-N 381.863 5.081 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 603968964 PVBRWTSRJPNBBL-DZGCQCFKSA-N 378.419 5.594 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CCc1ccccc1)c1ccccc1 604128983 FQLZJLKTFUBQGZ-DEOSSOPVSA-N 383.495 5.074 30 20 GKED CC(C)CCc1ccccc1NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1 609207698 FPVBDSVSCSBALY-UHFFFAOYSA-N 391.515 5.222 30 20 GKED N#C[C@@H](NC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1)C1CC1 609416179 HZDIBWSXAREEKI-QGZVFWFLSA-N 391.323 5.318 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 610179572 RMADEOBNVJSKFF-QHCPKHFHSA-N 397.478 5.421 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)cs1 610347393 IUFWUHQROSJNGB-CABCVRRESA-N 390.512 5.112 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610456172 HYWBQKWEJFUZNU-GOSISDBHSA-N 385.467 5.328 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(Br)cc1)c1ccc(C#N)cc1 612574841 KEQBMYMLTWDSBQ-SJKOYZFVSA-N 397.238 5.665 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(C#Cc2ccccc2)cc1 642550769 TWZHBGYUTAFMDJ-UHFFFAOYSA-N 396.490 5.242 30 20 GKED C=CCn1c(Sc2ncnc3scc(-c4ccccc4)c23)nnc1C1CC1 669624398 BMMNZNJUGWDCLW-UHFFFAOYSA-N 391.525 5.164 30 20 GKED C=CCC[C@@H](NC(=O)[C@@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676730112 ALEXZCYNADTKIJ-YVEFUNNKSA-N 380.410 5.237 30 20 GKED Cc1ncccc1/C=C\C(=O)c1sc(-c2ccc(Br)cc2)nc1C 728787590 PFYRQOZCHIVBQG-YFHOEESVSA-N 399.313 5.481 30 20 GKED N#CCOc1cccc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)c1 730149268 FDJILOMNBMIROH-VBKFSLOCSA-N 390.439 5.064 30 20 GKED Cc1c(O)ccc2c(CNc3ccc(Oc4cccc(C#N)c4)cc3)cc(=O)oc12 731358016 ZPXDCVXICNKYLB-UHFFFAOYSA-N 398.418 5.083 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(Cl)s1 733080672 WBBUKIHLVZBBSL-UHFFFAOYSA-N 397.813 5.108 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H](C)c2c(Cl)cccc2Cl)c1 733775159 RFPBVAMSNSHBDU-DZGCQCFKSA-N 391.298 5.094 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cc(F)ccc2F)c2ccccc2)c1 734984342 XYHNJUKKGQGYAX-UHFFFAOYSA-N 378.447 5.350 30 20 GKED Cc1ccc(/C=C2/CC(O)(C(F)(F)F)C/C(=C\c3ccc(C)cc3)C2=O)cc1 735792527 GGIYWZRDYQYZLW-UHWBUFEVSA-N 386.413 5.427 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3cccc(N4CCCC4)c3)c2)cc1 737804299 JLBJNWPGTBRJFZ-UHFFFAOYSA-N 382.467 5.154 30 20 GKED COc1ccc(C(=O)/C=C/c2c(C)nn(Cc3ccc(Cl)cc3)c2C)c(F)c1 740764547 YDUKUQPYHRMBSS-ZHACJKMWSA-N 398.865 5.245 30 20 GKED Cc1cccc(COc2ccc(CNC(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)c1 745462671 LWTZECAWPOIPFK-IBGZPJMESA-N 399.494 5.006 30 20 GKED N#Cc1cc(NC(=O)C2=CCCCO2)ccc1Oc1ccc(C(F)(F)F)cc1 746313267 HQVUBFWAGPUIHC-UHFFFAOYSA-N 388.345 5.002 30 20 GKED COc1cc(/C=C\C(=O)c2cc3ccccc3o2)ccc1OCC(F)(F)F 750896062 MPDPUUWDWDHUHA-VURMDHGXSA-N 376.330 5.279 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 752201428 IJDXBSQJSOOURH-CABCVRRESA-N 380.435 5.655 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(-c2ccc(F)cc2)cc1 769966732 VDIVLHPVMOXGPJ-INIZCTEOSA-N 389.430 5.278 30 20 GKED CC(C)Oc1cc(Br)cc(NCc2ccc(O[C@H](C)C#N)cc2)c1 770599292 STUUAQKCJVLVSP-CQSZACIVSA-N 389.293 5.139 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Br)s2)c1 772985931 UZTFGDSSBDROHZ-OCCSQVGLSA-N 379.323 5.042 30 20 GKED C#CC[C@H](N[C@@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1)c1ccccc1 773103555 AQPIPTIMZDKIOF-HARLFGEKSA-N 381.491 5.189 30 20 GKED C[C@H](Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1cccc(C#N)c1 777686172 MZJVXOVNWHFJHE-INIZCTEOSA-N 377.488 5.025 30 20 GKED COc1ccc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1NC(=O)C1CCCCC1 777697769 OYBLJFQUGQMZFX-HNNXBMFYSA-N 395.478 5.398 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12 780151851 BWZQLSVXESZVKX-KRWDZBQOSA-N 393.446 5.445 30 20 GKED CC(C)COc1ccc(C(C)(C)NC(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780671252 VUTJZIOEDVSOPK-QGZVFWFLSA-N 395.503 5.069 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(Br)cc1 792092883 FFJWRJUWZJSLDX-SFHVURJKSA-N 393.284 5.151 30 20 GKED C[C@@H](OC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 801706483 HQYVNTPSJRDAFF-YMTOWFKASA-N 395.274 5.434 30 20 GKED N#Cc1ccc(F)c(CN[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)c1 808705989 BTLGRLWJAFSRPI-LJQANCHMSA-N 398.279 5.108 30 20 GKED CCCCCCC[C@H](C)CNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 812009877 DNKZLWOQMCSUHY-HKUYNNGSSA-N 390.572 5.570 30 20 GKED CC(C)(C)C(=O)CCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 835111284 QQUWODYEJYPYLN-LBPRGKRZSA-N 390.455 5.050 30 20 GKED CC(C)c1csc(SCC(=O)Nc2ccccc2S[C@H](C)CC#N)n1 845329831 DZHQWCZEDJJYQU-CYBMUJFWSA-N 391.587 5.392 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 857431066 GHOPRTCIDRAXGW-HNNXBMFYSA-N 393.302 5.393 30 20 GKED N#C[C@H](C(=O)CC1CCC(F)(F)CC1)c1nc(-c2c(F)cccc2F)cs1 860506400 FLOMNVXMRIAHSM-GFCCVEGCSA-N 396.409 5.480 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2c(-c3cccc(F)c3)n[nH]c2C2CC2)cc1 909717267 GGTPTAPWWLPGBU-UHFFFAOYSA-N 388.446 5.147 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2)CC1 915863187 UVMWZOGUMDRFMF-XMMPIXPASA-N 394.478 5.180 30 20 GKED CCCCc1ccc(CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917041034 OCEWUZMDAQHURU-KRWDZBQOSA-N 381.426 5.193 30 20 GKED CCC(=NNc1ccc(C(=O)O)cc1)[C@H](C)c1cccc(Br)c1 1776014237 NOGWLKIBYUOYIR-GFCCVEGCSA-N 375.266 5.129 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(C)=NNc2cccc(C(=O)O)c2C)cc1 1776086533 ZMSBLFZYYCGIGB-LJQANCHMSA-N 396.531 6.125 30 20 GKED CCOc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776127783 FIILJHLMQSVLOW-ZRDIBKRKSA-N 378.449 5.408 30 20 GKED CCN(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776855393 BETIRJRQRYWTQF-ACCUITESSA-N 391.492 5.466 30 20 GKED CCOc1c(Cl)cccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776910331 DYUVCIXOZIBEHB-KHPPLWFESA-N 396.826 5.593 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2cccc(C(=O)O)c2)s1 1777559783 AJJZDDHFEOAZTO-LUAWRHEFSA-N 388.444 6.064 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccc(C)o3)cc2)CCC1 1786488476 LANHUHFZMFMCSN-UHFFFAOYSA-N 394.515 5.328 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(Cl)cc2)=C(/S)Nc2ccccc2)cc1 10170264 WZIFOTZLFSBQQF-UHFFFAOYSA-O 395.935 5.241 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1cc(-c2ccccc2)nc2onc(C)c12 24499855 MKXFOYTVGUVTDH-UHFFFAOYSA-N 383.451 5.027 30 20 GKED COc1ccc([C@@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C2CC2)cc1 60961895 MAIPRBLYKSTOAS-SANMLTNESA-N 398.506 5.387 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 66955102 BFWSZKJXICCWCZ-APWZRJJASA-N 397.519 5.459 30 20 GKED Cc1cc(N(CCC#N)C(=O)CSc2ccnc3ccccc23)ccc1Cl 110654632 KMMNAJWBBRZEMT-UHFFFAOYSA-N 395.915 5.236 30 20 GKED C[C@@H](CC#N)N(C)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 110976267 ONQBIGIUUZPLJB-ZDUSSCGKSA-N 393.339 5.660 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 120116564 ZBAIKJLDMYINQK-JSGCOSHPSA-N 395.311 5.252 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1C(=O)N(CCC)C(C)C 153276858 DTIAFAIAAUPWFQ-UHFFFAOYSA-N 399.560 5.229 30 20 GKED N#CCCn1cc(CNc2ccc(SC(F)F)cc2)c(-c2ccccc2)n1 157662170 GNRCHXJPPCLIPN-UHFFFAOYSA-N 384.455 5.391 30 20 GKED Cc1cccc2c(CCNC(=O)Nc3ccccc3SC[C@@H](C)C#N)c[nH]c12 173115143 ALZNVDUSOSKCPB-HNNXBMFYSA-N 392.528 5.092 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1cccc(CC(F)(F)F)c1 173115331 ISJWEWLQAHDBOZ-CYBMUJFWSA-N 393.434 5.687 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1nc(Cc2ccccc2)no1 173777280 YYDDJPUKFGGKCQ-HOTGVXAUSA-N 378.501 5.085 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ncc(C)s1)C1CC1 175887858 AKQKGBAZIGHASL-HNNXBMFYSA-N 381.954 5.015 30 20 GKED CCOc1ccc(-c2nc(CNc3ccccc3O[C@@H](C)C#N)cs2)cc1 182590075 WAIJCLILZZGFPJ-HNNXBMFYSA-N 379.485 5.112 30 20 GKED Cc1cc2occ(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c2cc1C 187483558 ZCJVLDIIPCKKKC-AWEZNQCLSA-N 379.366 5.285 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]c2ccccc2c1Br 188058821 BYNMPOWCMUFZRH-UHFFFAOYSA-N 397.316 6.035 30 20 GKED CC(F)(F)c1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 189397758 FVKZUDMQLJVSGN-UHFFFAOYSA-N 382.366 5.094 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 281544406 XFGOWURSVSYFPJ-AEFFLSMTSA-N 397.548 5.056 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc([N+](=O)[O-])c(C#N)c3)s2)cc1 302199472 QVVVVVYVGVORMF-GFCCVEGCSA-N 394.456 5.080 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 303424955 DLJJEYCAEANOKM-WOJBJXKFSA-N 389.417 5.032 30 20 GKED OC(=Nc1ccccc1)N1CCC[C@H](/C(O)=N/[C@@H]2CCC[C@@H]2c2ccccc2)C1 329510810 XLQZCNRRTWYANF-KSEOMHKRSA-N 391.515 5.237 30 20 GKED Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1N=C(O)c1cccnc1C1CC1 329608049 BMBVQZGLDZMGAX-HOTGVXAUSA-N 391.515 5.022 30 20 GKED CC(C)c1ccc2c(c1)[C@H](/N=C(/O)C1CCC(/N=C(/O)C3CC3)CC1)CCC2 330008609 GTALEFHGQDDZJJ-ZOGYUUGASA-N 382.548 6.069 30 20 GKED Cc1c(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)sc2ccc(C#N)cc12 427996172 YKWYYBIMCJDCAT-UHFFFAOYSA-N 399.519 5.583 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1)c1ccccc1 435096917 YSVPUZMCURBCTP-HSZRJFAPSA-N 390.527 5.307 30 20 GKED C=CCn1c(SCc2ccc(C#N)cc2Cl)nnc1-c1ccc(F)cc1 438889649 HXPIWSLHEDIHOB-UHFFFAOYSA-N 384.867 5.088 30 20 GKED CSc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 439494084 DLJPZMCOUXMNSN-HUUCEWRRSA-N 385.558 5.543 30 20 GKED C[C@@H](NC(=O)C(C)(C)Cc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1 455549012 CNHBQNOZGHCUSH-MRXNPFEDSA-N 389.524 5.128 30 20 GKED CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 464885075 KLZNXZDUTAZYNF-GCJKJVERSA-N 394.515 5.263 30 20 GKED C=C(C)Cn1c(SCc2ccc(C(F)(F)F)cc2)nnc1-c1ccncc1 481341534 QPLBATYLSFFEGN-UHFFFAOYSA-N 390.434 5.227 30 20 GKED N#Cc1ccc(-c2csc(-c3ccc(NC(=O)c4cccs4)cc3)n2)cc1 483312130 QIOXICMJUAQKCB-UHFFFAOYSA-N 387.489 5.663 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1sc(-c2ccccc2)nc1-c1ccccc1 484387856 TXIJBFINMMLIJU-MRXNPFEDSA-N 375.497 5.099 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc2nc(C(F)F)sc2c1 492854123 SVWDMFUYKTZYQW-UHFFFAOYSA-N 389.427 5.120 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCO[C@H](C(CC)CC)C1 498384462 JVLJQDIZACKCEA-WBVHZDCISA-N 384.973 5.083 30 20 GKED C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1CCCC1(C#N)CCOCC1 499560375 FUXGYHOKSRYRDN-OFVILXPXSA-N 388.555 5.166 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccccc1Cl 499946802 IJVYDVKEFUCNNS-CQSZACIVSA-N 378.646 5.123 30 20 GKED CC[C@H]1C[C@@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCO1 502924264 HGZTUFBGWGEZAQ-RDJZCZTQSA-N 384.863 5.148 30 20 GKED CCCn1ccc2cc(NC(=O)Nc3ccccc3S[C@H](C)CC#N)ccc21 503226689 SRVKDWXMRJGUOH-MRXNPFEDSA-N 392.528 6.090 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 505562079 OTGSHMRJKAKLJE-UHFFFAOYSA-N 399.237 5.177 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 505942867 KLCLYQPOHCVQAO-INIZCTEOSA-N 378.419 5.201 30 20 GKED Cc1ccc(CN(C(=O)NCC(C)(C)CCC#N)[C@@H]2CCc3ccccc32)cc1 513136264 VFNXBXWUJGSWNG-HSZRJFAPSA-N 389.543 5.524 30 20 GKED C[C@@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccncc1F 513393623 HFVCBGBORQQGRD-CYBMUJFWSA-N 395.821 5.029 30 20 GKED N#C[C@H](C(=O)c1cccc(C(F)(F)F)c1)c1nc2cc(Cl)ccc2s1 515547327 UYTFDKJQACCHLS-GFCCVEGCSA-N 380.778 5.459 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 517384913 DWZDFHYGZFHKLD-CYBMUJFWSA-N 398.322 5.431 30 20 GKED CCOc1ccc(-c2nc(CC)c(C(=O)Nc3ccccc3CC#N)s2)cc1 517911269 UPWSGWRPFKFZDC-UHFFFAOYSA-N 391.496 5.090 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3)n2)cc1 519939147 LDELMCNGDGPNEJ-SJORKVTESA-N 379.872 5.077 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 520195802 MKEQHZTZXNUAIQ-YWZLYKJASA-N 399.535 6.129 30 20 GKED C=C(C)CN(CC)C(=O)[C@@](C)(Cc1nc2ccccc2s1)c1ccccc1 523722056 RTAPFOGABYFCFQ-QHCPKHFHSA-N 378.541 5.221 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2cccc(C(F)(F)F)c2)c1 523954697 YLWCAMIANFNKES-UHFFFAOYSA-N 386.329 5.001 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)CC1 524154132 OBAYZNMLRLVFSY-UHFFFAOYSA-N 384.907 5.657 30 20 GKED CN(C(=O)c1sccc1C#N)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 538438204 SEADSDYVVXPLQQ-CVEARBPZSA-N 378.419 5.047 30 20 GKED N#CC1(c2ccccc2)CCC(NCC#Cc2ccc(C(F)(F)F)cc2)CC1 540802996 HGEXSNZIVCRKQV-UHFFFAOYSA-N 382.429 5.051 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(SCc3ccccc3Cl)cn2)c1 546923332 UHLOGDZHVGBMDX-UHFFFAOYSA-N 393.899 5.346 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCc2c(F)ccc(Br)c21)c1ccccc1 551206099 PNMVVSDJRLXRLH-RTBURBONSA-N 387.296 5.600 30 20 GKED C=CCn1c(S[C@@H](CCOC)c2ccccc2)nnc1-c1ccccc1F 551389041 YFYBBKOARLLWIK-IBGZPJMESA-N 383.492 5.140 30 20 GKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc2ccccc2c1OC(F)F 551813946 VIFPISNZQYUAKO-OAHLLOKOSA-N 378.422 5.653 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)c1cc(C#N)ccc1Cl 552364545 PNEOLTCVGCFIFK-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C[C@H](Oc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cn1)c1ccccc1 554519217 LVCGYEWJCRIYEU-CVDCTZTESA-N 399.494 5.387 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cncc(C(F)(F)F)c1 554702465 BGUOHDGLQYYMLR-UHFFFAOYSA-N 397.356 5.325 30 20 GKED COc1ccc([C@@H](Cc2ccccc2)NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 555171973 UHHUEWXOKFPJBQ-ILBGXUMGSA-N 398.506 5.183 30 20 GKED N#CCCC[C@@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccccc1 556906886 FEMUGOSARUTNJX-HXUWFJFHSA-N 397.316 5.250 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](NC2(c4cccc(C#N)c4)CC2)CCC3)cc1 560263377 SJQULSZVUYGHPY-OAQYLSRUSA-N 385.536 5.647 30 20 GKED C=CCC[C@H](NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccco1 560529280 LWXHKMPGDHYJFL-VWLOTQADSA-N 397.522 5.989 30 20 GKED O=C(N1CCC(CC(F)(F)F)CC1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 560824978 PZLKPBKKBLHUNJ-UHFFFAOYSA-N 397.334 5.067 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@H](COCc1ccccc1)c1ccccc1 573590686 ALDXGVCKGWCOMZ-LJQANCHMSA-N 397.400 5.342 30 20 GKED O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 574948303 RBILZPYQRGJRIN-NSHDSACASA-N 397.265 5.060 30 20 GKED Cc1ccc(-c2cnc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)o2)cc1 589566129 CZXRFJYNJWVSIC-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)cc1Cl 589648068 UHEXDVLMTNDODT-HNNXBMFYSA-N 399.897 5.389 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccncc1 596736983 XTRPOCIMHDZEHP-OXQOHEQNSA-N 392.528 5.235 30 20 GKED CCN(C(=O)c1cc(NC(=O)CC2(C#N)CCCCC2)ccc1Cl)C(C)C 597580031 BLOFWEACSQGNTN-UHFFFAOYSA-N 389.927 5.013 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCOc2ccc(Cl)cc2Cl)cc1 604096935 FUFJXKPNXTVRFS-UHFFFAOYSA-N 377.271 5.202 30 20 GKED CC[C@H](c1ccc(F)cc1F)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 606431683 LLBLSKOGOBIUCN-PKFCDNJMSA-N 375.303 5.479 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](C)c1ccccc1F 608846968 ANBRNBKCQAGUAY-HNNXBMFYSA-N 389.430 5.325 30 20 GKED CCCN(C(=O)c1cc2ccccc2n1CC#N)[C@@H](C)c1cc2ccccc2o1 609166467 CWVXZXCSOMIMHB-KRWDZBQOSA-N 385.467 5.524 30 20 GKED COc1ccc2cc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)[nH]c2c1 609177074 IHBLHJSGMKIHDO-UHFFFAOYSA-N 383.407 5.093 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc3[nH]ccc3c2)cc1 609344510 GTIAMADGAVCBGE-UHFFFAOYSA-N 383.426 5.021 30 20 GKED CC(C)COc1cccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609436623 QBUSUJCCDAUOCJ-QGZVFWFLSA-N 397.544 5.437 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1c(C#N)c(C)c(C)n1-c1ccccc1 611466794 PFRJIFVJNOEQMU-UHFFFAOYSA-N 396.450 5.182 30 20 GKED N#C[C@@H](C(=O)c1cc2c(Cl)cccc2s1)c1nc(-c2ccccc2)cs1 613392522 YDOVFCIHLHSCBH-AWEZNQCLSA-N 394.908 6.168 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2cc3sc4ccccc4c3s2)cc1 615000205 CSTILPXFBPWXJW-UHFFFAOYSA-N 392.505 5.284 30 20 GKED CCn1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 616768885 SRXARYKRAMFSDX-UHFFFAOYSA-N 388.471 5.144 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCOc2c(OC)cccc21 682776947 BFMQXNPKVURCMF-IBGZPJMESA-N 380.488 5.192 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@](OC)(C(F)(F)F)C1 682777810 SIMDQRKWFPCSRX-IBGZPJMESA-N 384.442 5.114 30 20 GKED C[C@H](NC(=O)Nc1cccc(Cl)c1SC(F)F)c1ccc(C#N)cc1 726078369 GKETZKZOHCLMTJ-JTQLQIEISA-N 381.835 5.409 30 20 GKED C=CCCC(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 726652025 YRBFMSNTAQWWOZ-UHFFFAOYSA-N 399.299 5.144 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccccc2CCc2ccccc2)c1 733775429 URWCXLYZGAMUTR-QHCPKHFHSA-N 398.506 5.083 30 20 GKED C=CCCCN(C)Cn1nc(-c2cccs2)n(Cc2ccccc2)c1=S 736589596 JLRSUZSVBMGEAH-UHFFFAOYSA-N 384.574 5.046 30 20 GKED CCc1ccc(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 736955814 PQTUDWIJSBANQE-DEOSSOPVSA-N 383.495 5.269 30 20 GKED CCCCn1nc(C)c(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1Cl 745990247 PGPXMOSEWKSTRZ-MDZDMXLPSA-N 379.891 5.603 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 747667935 RHRNWFHICOLWLN-QWHCGFSZSA-N 392.355 5.686 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(F)c(F)c2)ccc1OCC(F)(F)F 750902736 MVDPGKSCXPEDEQ-CLTKARDFSA-N 386.316 5.201 30 20 GKED O=C(/C=C/c1ccc(SC(F)F)cc1)c1cc(Br)ncc1F 762424300 QAARDIKHYCIUQO-ZZXKWVIFSA-N 388.208 5.194 30 20 GKED COc1cccc(Cl)c1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 764997126 BVMRYQYEUPZQHT-FQEVSTJZSA-N 390.870 5.185 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cnc1Cl 771100391 YDKRCPWUZPPUCU-QQOXCAACSA-N 389.854 5.027 30 20 GKED N#CCCCOc1cccc(CNc2ccc(OC(F)F)c3cccnc23)c1 775323521 JTGHEFQJDQGQBZ-UHFFFAOYSA-N 383.398 5.131 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(OC)cc1 776076926 KXBWEHHEIBBTJX-WOJBJXKFSA-N 390.508 5.497 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 776979502 UBOFMRYQPBRCGH-UHFFFAOYSA-N 380.369 5.018 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)Nc1ccccc1O[C@H](C)C#N 780678942 ZIDUSOIJNQDLMU-CHWSQXEVSA-N 392.286 5.037 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1c(O)c(Cl)cc(Cl)c1Cl 780979620 BVFDRCNDSJSNHM-NSHDSACASA-N 381.687 5.262 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 783074530 ILCPINPINSIRSR-GXTWGEPZSA-N 390.455 5.050 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801913291 BXIVRLNFUVFGHI-QRVBRYPASA-N 390.380 5.014 30 20 GKED O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1cc(F)c(C(F)(F)F)cc1F 804506355 UAYZAVJIWXDVEW-UHFFFAOYSA-N 391.246 5.050 30 20 GKED C[C@@]1(CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@@]1(F)Cl 844816302 LCAQSQJHPLTXAW-UXHICEINSA-N 388.895 5.144 30 20 GKED CC(=O)Nc1ccc(C(=O)N2CCCSC2=Nc2ccccc2C(C)C)cc1 864015963 OTERWBJHEJSXMY-UHFFFAOYSA-N 395.528 5.035 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCC1C[C@H]2[C@H](C1)C2(F)F 902590948 UEHHYFBYSHNGMC-SNPRPXQTSA-N 396.528 5.044 30 20 GKED N#Cc1ccc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1Cl 904507595 BNXBRRAPWNJLOZ-UHFFFAOYSA-N 392.777 5.255 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccccc2)cc1 915352342 GYVSXDJHWOUJQZ-ZEQRLZLVSA-N 381.479 5.711 30 20 GKED O=[N+]([O-])c1cc(Cl)cc(C=Nc2cccc(COCc3ccco3)c2)c1O 915981836 XKTXTEWLPUHYLO-UHFFFAOYSA-N 386.791 5.014 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)CCc2[nH]c3ccc(F)cc3c21 915987074 QRENZHGTDSHZTI-XFXZXTDPSA-N 375.428 5.038 30 20 GKED O=C(/C=C\c1ccc(OCc2ccccc2)c(Br)c1)c1ccncc1 916136510 QNOOZVBWKGRNBQ-VURMDHGXSA-N 394.268 5.319 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1ccc(OCc2ccccc2)cc1 916325484 PNVJSWOSHBLFSR-UHFFFAOYSA-N 389.352 5.053 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4ccccc4)CCCC3)n2)cc1 916971648 CTSINZTXNVBOFY-FQEVSTJZSA-N 386.520 5.807 30 20 GKED N#Cc1ccccc1NC(=S)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 917580047 MQJCAWCBYOCGHQ-QGZVFWFLSA-N 376.312 5.399 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cn2ccc3ccc(Cl)cc32)cc1 919714249 XOMGBFHEBCMTTJ-QFIPXVFZSA-N 399.881 5.589 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(OCc3ccccc3F)c2)ccc1Cl 1776033340 KGJDIUPTUGMTIE-UHFFFAOYSA-N 398.821 5.202 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1 1776144295 PUJXZTQFCLIFOS-RMKNXTFCSA-N 377.223 5.066 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](Cc2ccccc2C)C(=O)O)cc1 1776786215 AYAFGPHOTXKPGN-HSZRJFAPSA-N 397.559 5.377 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)[C@H](C)c2ccccc2)cc1 1776788276 WHAVEKJLAAJFAP-AUSIDOKSSA-N 383.532 5.382 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(C(=O)O)c(F)c3)s2)cc1 1777430609 QIMYEYGVPPXARJ-UXBLZVDNSA-N 381.428 5.160 30 20 GKED Cc1cccc2c1CC/C(=C/c1ccc(OCc3occc3C(=O)O)cc1)C2=O 1777457398 RCLYEDFDHNNMCR-LGMDPLHJSA-N 388.419 5.078 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C/c2ccsc2)C(=O)c2ccccc2)c(Cl)c1 7913427 MUFODQZUUCXMER-LDADJPATSA-N 395.911 5.923 30 20 GKED N#C[C@H](C(=O)Cc1csc(-c2ccccc2Cl)n1)c1nc2ccccc2o1 41543992 GLYYBCYHGVUAFM-CQSZACIVSA-N 393.855 5.024 30 20 GKED C=CCn1c(SCc2csc(CC)n2)nnc1-c1ccc(Cl)cc1 42216212 ZGQGSBQZMREBRP-UHFFFAOYSA-N 376.938 5.096 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 60678075 GVSKOLZKXWQAEY-UHFFFAOYSA-N 382.554 5.246 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2ccccc2Cl)o1 62904168 ZHLKQPZLDAOQHU-UHFFFAOYSA-N 376.843 5.300 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccccc1 66953990 PNDIEFCFLJPKSD-IEBWSBKVSA-N 379.529 5.320 30 20 GKED C#CCOc1cccc(NC(=O)c2ccc(SCc3csc(C)n3)cc2)c1 78667657 KCSXUGKUVZAYGQ-UHFFFAOYSA-N 394.521 5.008 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 108325056 XSVTXUJVPNRSHN-MRXNPFEDSA-N 392.524 5.029 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108533379 GXBZDBIGRLLQKK-CVEARBPZSA-N 383.517 5.172 30 20 GKED CCC(CC)n1c(COc2ccccc2Cl)nnc1S[C@@H](C#N)CC 126970196 WRWGJAJNWHFGGO-CQSZACIVSA-N 378.929 5.266 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)oc12 128915371 RYZUWHXRADSRAI-INIZCTEOSA-N 387.464 5.367 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F 175780234 GELKQQNZUXVSDR-LLVKDONJSA-N 382.382 5.491 30 20 GKED N#Cc1ccc(NC(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)nc1 185323090 IVCWHQKOZLRCKX-UHFFFAOYSA-N 383.835 5.149 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc(OC)c1O 213500328 MCCBLDGBFYLDIA-UTCJRWHESA-N 387.646 5.266 30 20 GKED Cc1nc(C2(/N=C(/O)c3ccc(OC4CCC4)cc3Cl)CCCCC2)no1 328802270 JPPZIZJCBGUNDN-UHFFFAOYSA-N 389.883 5.127 30 20 GKED CC(C)c1ccc2c(c1)[C@H](/N=C(/O)[C@@H]1CCCO[C@H]1c1ccnn1C)CCC2 329191023 RGKFOWPZHQRGFO-SYYKKAFVSA-N 381.520 5.045 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCC[C@@H]1c1ccccc1 329835027 UTEHNDGOUVUCOI-JOCHJYFZSA-N 386.499 5.269 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](/N=C(/O)[C@]2(C)C[C@H]4CC[C@H]2O4)CCC3)cc1 330115392 UDCZPTGJDCCMFN-UVLLPENVSA-N 398.528 5.110 30 20 GKED C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1C(=O)c1cn(CCCC#N)c2ccccc12 426954934 GWCATWSDJREEKT-DXIQSLLYSA-N 385.511 5.352 30 20 GKED N#CCCC[C@@H](NCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 433007931 BOXOHWDUTKZWLM-HSZRJFAPSA-N 383.495 5.317 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1-c1csc(C)n1 433804281 HHQZYAOKTSHBQZ-UHFFFAOYSA-N 393.512 5.347 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 435097556 SNIFSJKKZZVWRZ-CABCVRRESA-N 397.466 5.620 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(F)c(O)c(Cl)c1 436936134 YORZNEMSTNBZJU-UHFFFAOYSA-N 396.805 5.409 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(OC(C)(C)C)cc1 438068655 AGEAMJKEADLWQY-OAHLLOKOSA-N 383.517 5.902 30 20 GKED CCN(C(=O)c1ccc(-c2csc(C)n2)cc1)[C@@H](C)c1ccc(C#N)cc1 440766024 XKUNOTVIOYFAOM-HNNXBMFYSA-N 375.497 5.214 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(-c3nc(C4CC4)no3)cc2C)CCCC1(C)C 445104942 DUSLFNUESUTXCE-IBGZPJMESA-N 394.519 5.521 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2SCCC#N)c2ccccc2n1 448348710 NQSZLCAGMIMSDR-UHFFFAOYSA-N 375.497 5.616 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(CC#N)cc2Cl)cc1 455755922 RWRZEUNMGUMYHD-OAQYLSRUSA-N 397.906 5.564 30 20 GKED Cc1nc(N2CCC[C@@H]2c2nc3ccccc3n2C(C)C)c(Cl)cc1C#N 461952694 AZCQNLFNSQEBKI-LJQANCHMSA-N 379.895 5.187 30 20 GKED C[C@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCCC(C)(C)C#N)nnc1-c1ccco1 463035118 HAOZXWXIKFRKQA-QZWWFDLISA-N 384.549 5.567 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 463459909 DCRIAOPNOUAUQJ-UHFFFAOYSA-N 399.463 5.315 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(C#N)cc1 463503004 FHKOBYHTFVMANE-UXHICEINSA-N 383.495 5.592 30 20 GKED COc1ccc(N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1Cl 466909155 IUTKNHSLUIUHMQ-UHFFFAOYSA-N 392.842 5.289 30 20 GKED COc1ccc([C@H](NC(=O)C[C@H](CC#N)c2ccccc2)c2ccc(C)cc2)cc1 475172397 HWBNRKVJOSSTEC-JYFHCDHNSA-N 398.506 5.297 30 20 GKED CCN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](C)c1cccc(C(F)(F)F)c1 475365873 FPPSSZXKCFHKBK-QFBILLFUSA-N 388.433 5.702 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)cc1 476667266 KCPSSXRYAUVUHI-CLEWGBKMSA-N 378.541 5.647 30 20 GKED CC(C)C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1cccs1 481513032 CWQZDHNQJMULOF-FQEVSTJZSA-N 383.561 5.575 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cccc(NC(=O)c2ccccc2)c1 481679515 UBIMURSHPUFPDU-VWLOTQADSA-N 395.506 5.368 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(F)c3ccccc23)cc1 483299715 STGVFZWUSXCXGQ-UHFFFAOYSA-N 386.348 5.055 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)[C@H]1CCC(F)(F)C1 483622960 WAINFHTZBTVUCV-QMMMGPOBSA-N 391.258 5.020 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N(CC=C)CC=C)cc1 485241638 AGZCZIOOVNQFLV-UHFFFAOYSA-N 395.547 5.101 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1ncc(-c2ccccc2)o1)c1ccccc1 487511464 FBMXWTVTUJDKPC-OAQYLSRUSA-N 387.483 5.216 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2c(Br)cccc2[nH]1)c1ccccc1 487599037 BKLGIXUMJKGVLD-KRWDZBQOSA-N 396.288 5.095 30 20 GKED CN(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510024210 SUSLINQXYWATJR-OAQYLSRUSA-N 389.886 5.659 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)c1 511764072 BMGZUMVOXODGKC-UHFFFAOYSA-N 391.789 5.411 30 20 GKED COc1ccc(C[C@@H](Nc2ncc(C#N)cc2Cl)c2ccccc2)cc1OC 513630273 MTVRDUFTVQVNPD-LJQANCHMSA-N 393.874 5.020 30 20 GKED Cc1cnc(-c2cccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)c2)o1 517507992 AJICZNWACDQZDY-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C 520197867 ROWUQQMDBARSCB-OXQOHEQNSA-N 381.545 5.990 30 20 GKED C[C@@H](NC(=O)NCC1(Sc2ccccc2)CCCC1)c1ccc(C#N)cc1 521347963 BSNFSKDECQFYAK-QGZVFWFLSA-N 379.529 5.024 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1ccccc1 534615581 GULZWXFJBILADV-ZDUSSCGKSA-N 387.361 5.054 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccnc1-c1ccccc1 535110646 ITZRUZPKOQWEKO-UNMCSNQZSA-N 382.467 5.052 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1cccc(C)c1 537558019 XFAKEBISYCNWDX-HNNXBMFYSA-N 376.485 5.434 30 20 GKED COc1ccc(CNc2ccc(Br)c(C)c2)cc1OCCCC#N 538323417 MCQRPQVAXNIPTK-UHFFFAOYSA-N 389.293 5.061 30 20 GKED CCOc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2cccs2)cc1 559996827 MCXZPDPPSKIGSQ-CQSZACIVSA-N 384.530 5.179 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCc2occc2C1 564162187 ZVQYRRYZNGXJPL-UHFFFAOYSA-N 387.439 5.232 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CSCc1nccn1CC(F)(F)F 588915090 LAWLYMIBTHKRAA-UHFFFAOYSA-N 390.299 5.176 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H](C2CC2)C1 588997683 QGJGIMGCLFQGIS-OAQYLSRUSA-N 389.499 5.100 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)sc2c1CCCC2 589191027 AZANWHFDMRSNIO-KBPBESRZSA-N 390.430 5.260 30 20 GKED N#Cc1ccc(CNC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)cc1 603568775 UCRJRGOBOGXSLN-UHFFFAOYSA-N 394.805 5.375 30 20 GKED CCOc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)cc1Cl 608805029 KUYDRRMSLZPNRH-UHFFFAOYSA-N 396.830 5.035 30 20 GKED N#Cc1cccc(CNCc2cn(-c3ccccc3)nc2-c2cccc(Cl)c2)c1 608982203 AEHXDYOLAKBUBO-UHFFFAOYSA-N 398.897 5.354 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccccc1 608994757 SWINNXPKTQHILB-QGZVFWFLSA-N 386.455 5.013 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609060838 FQKVHQKTFHANPE-UHFFFAOYSA-N 398.462 5.263 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CCc1cccs1 609151856 VDXFIJIGBHAAHX-UHFFFAOYSA-N 380.900 5.439 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3C3CCCC3)c2)cc1 609209597 XSIXFFGGEUNFNB-QFIPXVFZSA-N 375.472 5.537 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H]1CCCc2ccccc21 609371787 XPYPOLLQBKQQCM-UZLBHIALSA-N 396.581 5.688 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1 609398065 AWCIFTZKUXSQAX-VFNWGFHPSA-N 397.519 5.740 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CC[C@@H](c3ccco3)C2)c1 609732267 LHBIXCCXFFOROU-MRXNPFEDSA-N 392.842 5.227 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@@H](Cc4ccccc4)C3)cc2)cc1 610178660 RZPLVAXCCVAWIT-QFIPXVFZSA-N 396.490 5.250 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 610973315 UAZIPGUHMKILSC-MRXNPFEDSA-N 397.347 5.507 30 20 GKED Cc1ccc(C(=O)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 611872172 VQKJDIMMODRTKE-HXUWFJFHSA-N 388.854 5.125 30 20 GKED N#C[C@H](C(=O)c1cccc2c1CCC2)c1nc2cc(C(F)(F)F)ccc2s1 619753789 IQNJVDITBAFNNA-OAHLLOKOSA-N 386.398 5.294 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)CCc1ccc(OC)cc1 620823261 QSCKTHXYVGQYLJ-HNNXBMFYSA-N 392.952 5.129 30 20 GKED Cc1ccc(Oc2ccc(NCC#Cc3ccc(C(F)(F)F)cc3)cc2)nn1 674716409 ZUBIGCWHNDVVBL-UHFFFAOYSA-N 383.373 5.060 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc(OCC#N)c1 729037273 RXWJSJAGOFSPRH-UHFFFAOYSA-N 392.286 5.338 30 20 GKED CCCCO[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 729071136 XKQFCUBRJJYACJ-FZMZJTMJSA-N 397.327 5.498 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2SC(F)(F)F)c1 733624708 PEDOQVZXANRGTG-UHFFFAOYSA-N 395.406 5.625 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccc(-c3ccc(F)cc3)s2)c1 733773880 HCBXBQJCGBBEDW-GOSISDBHSA-N 394.471 5.165 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc(OC)ccc3OC)s2)cc1 733867688 RYMIBJVZPULHDM-XFFZJAGNSA-N 395.480 5.040 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/C[C@H](O)c1cc(Cl)cc(Cl)c1 735618862 GOLNYHRJYHVIKG-FJMXFZMZSA-N 379.070 5.158 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)Nc1cccc(OCC#N)c1 736960945 UWPZDWPRHNFLEX-FQEVSTJZSA-N 391.496 5.064 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(OC(F)(F)F)cc3)c2)s1 740011758 SIZRMKTUJUXDSN-UHFFFAOYSA-N 388.414 5.475 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)s1 749017622 YJKDZOYXUWAZIN-QPEQYQDCSA-N 396.440 5.044 30 20 GKED Cc1cnc(C(C)(C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 750989626 JKWIMOCQUHULTR-IBGZPJMESA-N 390.512 5.164 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 757681045 XDLPPCFMYKGUQQ-SAWYMBPVSA-N 389.898 5.528 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2cccnc2)C2CC2)cc1 759685614 YFRZWDMMJAMQMW-DHIUTWEWSA-N 382.467 5.010 30 20 GKED CCCCCN(Cc1ccc(Cl)cc1)C(=O)Cc1cccc(OCC#N)c1 760361774 HDQAVZJVIIGJCM-UHFFFAOYSA-N 384.907 5.004 30 20 GKED CC(=O)CCCCCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 773983795 OJGCICPNZLNALS-AWEZNQCLSA-N 396.434 5.421 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccc(F)c(F)c1 775558220 MGLKKKFFAMNFBV-MWTRTKDXSA-N 397.469 5.186 30 20 GKED C[C@H](N[C@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccc(OCC#N)cc1 776164709 UMWQRNWGTJVEIH-HJPURHCSSA-N 394.877 5.822 30 20 GKED C=CC[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 778619307 LNEDUNPNFCVGIN-JKSUJKDBSA-N 394.446 5.624 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 782946205 LAUMGDKPTIXPCD-HSZRJFAPSA-N 397.478 5.043 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 785677349 KPHGNDOKYTYNIY-ZEQRLZLVSA-N 392.462 5.023 30 20 GKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc(Br)cc(Cl)c1O 787034925 UJUZKQSDQGPSCE-BTDLBPIBSA-N 391.696 5.018 30 20 GKED CN(C)Cc1cnc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)s1 794691723 RQJIAAIDXYVQSA-AATRIKPKSA-N 375.708 5.061 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(F)c(Br)c(Cl)c2)c1 795162359 NAZNHOGJAVUSOV-UHFFFAOYSA-N 383.673 5.032 30 20 GKED CCOc1ccc(C=NOCc2nc(-c3ccc(C)cc3)cs2)cc1OC 795196830 HUYTUBBTTJWJNX-UHFFFAOYSA-N 382.485 5.077 30 20 GKED N#Cc1ccc(CN2CCCCC[C@H]2C[C@@H](O)c2ccco2)c(C(F)(F)F)c1 811467162 GWMHNISNIROSIV-PKOBYXMFSA-N 392.421 5.038 30 20 GKED CC(/C=C\C(=O)c1cnn(-c2ccccn2)c1C)=C\c1ccccc1OC(F)F 811691535 NVLMPYCXKAGWAG-PCQKKHPJSA-N 395.409 5.020 30 20 GKED Cc1cc(/C=C/C(=O)c2cc([N+](=O)[O-])ccc2F)ccc1Oc1cccnc1 814190064 AZKQHTMWGXLGLQ-XBXARRHUSA-N 378.359 5.126 30 20 GKED COc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Cn1cccn1 815635884 LJCOFXRTXVMFSK-WMZHIEFXSA-N 388.515 5.026 30 20 GKED CCN(CC)c1ccc(CN(C)C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 838603915 MWBWFEHHSKWTLT-HSZRJFAPSA-N 392.547 5.109 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(C(F)(F)F)CCCCC3)n2)cc1 850763354 ZQUCUDPZEACKJX-OAHLLOKOSA-N 392.446 5.808 30 20 GKED C=CCC1(NC(=O)Nc2ccccc2SCc2ccccc2)CCOCC1 854251320 ZOCNZDNUNRHVHU-UHFFFAOYSA-N 382.529 5.226 30 20 GKED CCC(F)(F)C(C)(C)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 860424291 DJNNQMCSUHEOGT-LJQANCHMSA-N 385.458 5.535 30 20 GKED N#C[C@H](C(=O)C1(c2cc(F)cc(F)c2)CCCC1)c1cc(C(F)(F)F)ccn1 860780044 QZGXTUNMLIDHGD-INIZCTEOSA-N 394.343 5.067 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc(CC(=O)Nc2ccc(C)cc2)no1 904246251 OBNOFVSVBWTUTG-HXUWFJFHSA-N 375.472 5.047 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccccc2Cl)cc1 916912962 KTAOUZXBWHRNAZ-VUVZNRFTSA-N 380.875 5.043 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)cc1 916915500 KPGBMUVFVWOXDB-GOSISDBHSA-N 394.858 5.390 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 917363859 FGGGMCDKIAIOSH-UHFFFAOYSA-N 386.948 5.644 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1 919979132 JNZDTAOMZQAKCY-UHFFFAOYSA-N 378.815 5.287 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cc(F)c(Cl)cc1Cl 920957077 BYUKRORJZFYAJV-ZDUSSCGKSA-N 380.294 5.333 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(Cl)cc3Cl)s2)cc1 1776029699 NYSRDJBZNPSYBF-UHFFFAOYSA-N 391.279 5.866 30 20 GKED CC1(C)[C@H]2CC[C@@]1(C)[C@H](NN=Cc1ccc(-c3cccc(CC(=O)O)c3)cc1)C2 1776057219 OWRRMRVOOBEEGL-FBLLAGFSSA-N 390.527 5.119 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776113849 WNJKDCADXDFIIP-JCMHNJIXSA-N 398.458 5.966 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cn(-c2ccccc2Cl)nc1C 1776786896 ANONLRBHDRATNL-GOSISDBHSA-N 391.943 5.128 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3Cl)s2)cc1C(=O)O 1777360830 UXWKODJFFVZBEK-SOFGYWHQSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc2scc(/C=C3/CSc4ccc(Cl)cc4C3=O)c2c1 1777685451 AGNINBUQSRXXNH-XGICHPGQSA-N 386.881 5.625 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)CC(F)(F)F)cc2)CCC1 1787877599 QCZDXXYAKWMGRM-UHFFFAOYSA-N 396.453 5.065 30 20 GKED O=C(Nc1cccc(/C=C2/Cc3c(O)cccc3C2=O)c1)c1ccccc1Cl 11336029 YSGCETOUDHXGJL-PTNGSMBKSA-N 389.838 5.120 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2cccc(C#N)c2)cc1 24645561 BJLZIBSZSPYFJT-UHFFFAOYSA-N 397.478 5.360 30 20 GKED CCCCN/C(S)=C(/C(=O)c1ccccc1)[n+]1ccc(C(CC)CC)cc1 27326027 YRZRNVAFDUTNBZ-UHFFFAOYSA-O 383.581 5.206 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1c(F)cccc1Cl 33197173 PNYMAWJOEVGVRV-HTQZYQBOSA-N 391.714 5.118 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccccc2)cc1)c1nc2ccccc2s1 46442489 LRYVKXHNOSUPOZ-LJQANCHMSA-N 384.460 5.365 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC(C)(C)O1 65457542 LXONZSDAABSIKD-DNVCBOLYSA-N 397.906 5.027 30 20 GKED N#C[C@H](C(=O)c1oc2ccccc2c1CSc1cccs1)c1ccccn1 65650473 OVMCYVAHDRVQGR-HNNXBMFYSA-N 390.489 5.672 30 20 GKED COc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 66954268 BZIZSAZDWDVDAA-APWZRJJASA-N 395.528 5.458 30 20 GKED Cc1[nH]c2ccc(CNC(=O)Nc3ccccc3S[C@H](C)CC#N)cc2c1C 66955590 AICVLRAIKCWUNB-CQSZACIVSA-N 392.528 5.501 30 20 GKED CCCO[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 108508173 CGWNUHGVWMSIAR-FQEVSTJZSA-N 393.487 5.164 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(NC(C)=O)cc1C(F)(F)F 112210869 JKWKBPKQNVYFRE-UHFFFAOYSA-N 397.441 5.264 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 112817943 OLLACAPMZIGLSM-QWHCGFSZSA-N 392.883 5.137 30 20 GKED C=CCN(C(=O)c1cc(Cl)ncc1Cl)c1nc(-c2ccccc2)cs1 121776726 QVCZRSXUTUZFPT-UHFFFAOYSA-N 390.295 5.345 30 20 GKED COc1cc(F)ccc1NC(=O)c1ccccc1Sc1ccccc1C#N 127518418 NXVRKAVOAAOLLJ-UHFFFAOYSA-N 378.428 5.109 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)c1ccccc1 155762453 RYQAKSZDBPEHEC-KMRXNPHXSA-N 398.572 5.563 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(COC2CCCC2)cc1 160532784 SJXRKOKBUJYXPT-UHFFFAOYSA-N 389.499 5.238 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Cc2ccc(Br)cc2)n1 162460859 SILSDLHQEXXOOJ-DOMZBBRYSA-N 391.334 5.084 30 20 GKED Cc1cc(Cl)ccc1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 170991745 LYQDXENKLXYXMH-ZFWWWQNUSA-N 387.936 5.339 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3ccccc3SCCC#N)cc12 173133838 YGNNPCXWJQDAPJ-UHFFFAOYSA-N 384.530 5.016 30 20 GKED CC[C@H](C(=O)Nc1nc(C)c(SCC#N)s1)c1cccc(C(F)(F)F)c1 176954697 YVBAJNABKIKCLV-ZDUSSCGKSA-N 399.463 5.218 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1)c1ccccc1 180216662 SACKDVLMBCERCU-SFHVURJKSA-N 381.479 5.667 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSC(=S)N1CCC(C)CC1 189886927 UHARVCLPPKWQIB-UHFFFAOYSA-N 390.618 5.227 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)c(C)c(C)c1C)=C(/S)N[C@@H](C)CC 194971990 GCJUDQDRLYBCLO-INIZCTEOSA-O 397.608 5.097 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C(C)C)nc2onc(C)c12 217962612 OASQLCRAYGEMRP-UHFFFAOYSA-N 389.908 5.198 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C[C@H]1C 247169273 JJZDLCHWPJQVEU-ZHALLVOQSA-N 379.529 5.348 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(COCC4CC4)c3)c2)cc1 303154249 FYXLVNDKXWDFOK-UHFFFAOYSA-N 398.462 5.529 30 20 GKED OC(=Nc1cccc(N=C(O)C2CCCCC2)c1)c1coc(C2CCOCC2)n1 328811912 OSYRZLZZPOPUNT-UHFFFAOYSA-N 397.475 5.373 30 20 GKED Cc1cc(N=C(O)[C@@H]2CCCO[C@H]2c2ccnn2C(C)C)c2ncccc2c1 329119727 JWINNNZEYGGQQM-DYESRHJHSA-N 378.476 5.077 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)cc2)c1 409498054 GLACCLWXSAFLCB-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2ccc(Cl)cc2CC#N)cc1OC 410972664 USIIQBZFAPVWCL-UHFFFAOYSA-N 393.270 5.109 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@@H](C)C3)n1 411011730 MFTMWWCNVQTQGK-MNOVXSKESA-N 388.924 5.125 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@@H]1CCCc2cc(C#N)ccc21 419647668 QZXFPPKLTPKEPJ-HNAYVOBHSA-N 396.560 5.227 30 20 GKED CC(C)Cn1ncc(C(=O)[C@H](C#N)c2nccc3ccccc23)c1-c1ccccc1 429197725 BNNNKZNCXJUYAE-OAQYLSRUSA-N 394.478 5.244 30 20 GKED N#CCSc1cccc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1 429861053 AIMJGNALQSDXJO-UHFFFAOYSA-N 381.526 5.147 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1ccc(C#N)cc1Cl 430368324 FUJMFNKNIABVKX-UHFFFAOYSA-N 388.279 5.549 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@@H]1CCC(F)(F)C1 431109556 DUCVNXBBOJPTFD-MRXNPFEDSA-N 385.414 5.216 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@H]1CCCc2nc(CC)sc21)c1ccccc1 435758453 DRJFWJYZAZUDDV-MJGOQNOKSA-N 383.561 5.432 30 20 GKED CC[C@]1(C)CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 437944960 BEEXTWVDHLWGCG-HSZRJFAPSA-N 395.478 5.320 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](Cc1ccccc1)c1cccs1)c1ccccc1 438856257 KQVDALGHFIAVJL-RTWAWAEBSA-N 389.524 5.376 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc(-c2ccccc2)cs1 439662194 PXQSRMAUDFXJAZ-CYBMUJFWSA-N 390.361 5.458 30 20 GKED C=CCN(C(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1)c1ccccc1 443805104 CZWRCIQDCSEVCB-UHFFFAOYSA-N 399.425 5.376 30 20 GKED N#Cc1ccc(NC(=O)c2csc(-c3cccs3)n2)cc1C(F)(F)F 443880304 DUIQYBBPHYPUDR-UHFFFAOYSA-N 379.388 5.014 30 20 GKED N#CCCCCN[C@H](c1ccc(Br)cc1C(F)(F)F)C1CC1 447533410 RILHMQNLIFOUFD-HNNXBMFYSA-N 375.232 5.202 30 20 GKED CCSCc1ccccc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 448347364 XYRPOTJKAPIVTA-KRWDZBQOSA-N 379.312 5.241 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)C(F)(F)F 464058274 QXMWVQCSOPALNY-LURJTMIESA-N 399.278 5.497 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C 466121540 IAUPWAGZUKWMRR-WQTXXOFMSA-N 393.918 5.307 30 20 GKED N#CCCCCN[C@H](Cc1ccccc1Br)c1ccc(F)cc1 467741594 KRIIZGBOKDPOQO-LJQANCHMSA-N 375.285 5.155 30 20 GKED CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2cccc(C#N)c2)no1 468959421 KQJSLHTWMUPDTO-UNMCSNQZSA-N 385.467 5.012 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N(CCC#N)C(C)(C)CC)cc1OC 471162420 TZZUCRNFKCEVME-UHFFFAOYSA-N 380.916 5.072 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccccc1-n1cccn1 475553236 OAWJMEXNQYNDDA-GOSISDBHSA-N 388.515 5.607 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ncoc1-c1ccccc1 475574131 NTTQYOHRLNUSCS-UHFFFAOYSA-N 375.472 5.515 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(O)cc3)cs2)sc2ccc(C#N)cc12 477266773 SLCUTWUTFBHFMX-UHFFFAOYSA-N 391.477 5.163 30 20 GKED CC1(c2cccc(Cl)c2)CCN(C(=O)C[C@@H](CC#N)c2ccccc2)CC1 478436920 OPSPFGNLENWZRX-LJQANCHMSA-N 380.919 5.308 30 20 GKED C[C@H](NC(=O)N(C)C[C@@H](C)C#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 479343557 DSQUKZVYXOJDMF-STQMWFEESA-N 395.450 5.296 30 20 GKED Cc1csc(C(=O)N[C@H](C#N)c2ccc(OCc3ccccc3)cc2)c1Cl 480045534 PCHJEECWMRZBTH-GOSISDBHSA-N 396.899 5.284 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(-c2nccs2)c1 480332068 TVCAXKVRZYYXMD-UHFFFAOYSA-N 389.933 5.745 30 20 GKED CC1(C)CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 480439227 SMWQCHSHFGTYPS-UHFFFAOYSA-N 383.879 5.197 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Sc2nncs2)cc1 485754775 MWMWGOCMYNHYGQ-UHFFFAOYSA-N 385.539 5.220 30 20 GKED C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N[C@@H](CCCC#N)c1ccccc1 487214971 AKIRTKWGYPWJGC-QAPCUYQASA-N 390.405 5.024 30 20 GKED C=CCn1c(S[C@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1C 488894726 UJPGEAXLMOYHGX-OAHLLOKOSA-N 380.473 5.201 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1OC)[C@@H](C)c1cccc(C(F)(F)F)c1 495421054 NLUVOKVFROYQJR-ZDUSSCGKSA-N 391.393 5.201 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 499833485 LZRFGYVSMLLXSI-BLLLJJGKSA-N 379.312 5.103 30 20 GKED N#C[C@H](NC(=O)CSc1cc(Cl)ccc1Cl)c1ccccc1Cl 499947950 UQDREHVSSIGVGD-AWEZNQCLSA-N 385.703 5.120 30 20 GKED CC(C)CCN(CCC#N)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 500716058 LMXKPVZSLZRCCX-UHFFFAOYSA-N 397.466 5.036 30 20 GKED N#C[C@@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccc(Cl)cc1 505816343 WKBGKZYBPSKBBF-QGZVFWFLSA-N 383.904 5.044 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 506002188 MLEWMASSWFGKMV-AWEZNQCLSA-N 389.502 5.167 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)s1 512561795 YJBNNGQXPBTOMY-QWHCGFSZSA-N 393.965 6.069 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)cc1Cl 514508432 KNLDYNFDJLOLGO-SFHVURJKSA-N 385.851 5.323 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3cccc(CC#N)c3)c2C#N)C1 514560585 UDLAEMXINNCWKB-INIZCTEOSA-N 377.513 5.089 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cccc(Cl)c2Cl)cc1 518819734 UJBOQVUTIIAOOY-UHFFFAOYSA-N 397.261 5.696 30 20 GKED C[C@H](CN(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccc1 518910816 XPICFDFGORJXOO-LJQANCHMSA-N 384.479 5.421 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2cccs2)nc2ccccc12)c1nc2ccccc2o1 519248818 IXHOTHVICUHOOW-INIZCTEOSA-N 395.443 5.595 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Cc1ccccc1 520171139 OCCCFVZYKAUTCW-UHFFFAOYSA-N 397.522 5.839 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2ccc(F)cc21 520197076 SHLIQNFCFBBTAU-PBHICJAKSA-N 399.491 5.255 30 20 GKED C=CCCCCCN(C)C(=O)NCc1cccc(NC(=O)c2ccc(C)cc2)c1 523567729 GNXDFEPLHBLBMZ-UHFFFAOYSA-N 393.531 5.135 30 20 GKED Cc1ccccc1COc1c(C)cc(CN(C)C(=O)NCCCCC#N)cc1C 523776587 HJLRJMPCQIWXQU-UHFFFAOYSA-N 393.531 5.026 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1 524113685 CPLWOYNGKNIVGA-NWDGAFQWSA-N 397.208 5.209 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(-c2ccncc2)cs1 537968795 XLZHVNMBRLCZEM-JVPSVYLMSA-N 388.540 5.260 30 20 GKED CCN(C(=O)c1cc(-c2cccc(Cl)c2)no1)c1ccc(C#N)c(Cl)c1 538071608 DLFSQBNTKJHUAK-UHFFFAOYSA-N 386.238 5.187 30 20 GKED CC(C)N(Cc1ccc(Br)cc1)C(=O)c1ccc(C2(C#N)CC2)cc1 538499884 SFAPNKWSDNOLSM-UHFFFAOYSA-N 397.316 5.055 30 20 GKED CC[C@H](C)n1nc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1C 539761199 MEFMXRCGJPSCEL-AWEZNQCLSA-N 392.434 5.218 30 20 GKED C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@@H](CCCC#N)c1ccccc1 551204186 AUJQHGYQYPIXGP-AVRDEDQJSA-N 397.950 5.102 30 20 GKED N#Cc1ccc2ncc(CN[C@@H](c3ccc4c(c3)CCCC4)c3cccs3)n2c1 556595140 BKCXLSSEICPZTG-DEOSSOPVSA-N 398.535 5.025 30 20 GKED N#CCC[C@@H](C#N)COc1ccc(Sc2ccnc3cc(Cl)ccc23)cc1 562769270 JQTPHYIXWHJUJE-HNNXBMFYSA-N 393.899 5.862 30 20 GKED N#CCCC[C@H](N[C@@H]1CCc2sc(Br)cc21)c1ccccc1 566576517 YPXXRMHQHOIWDP-JKSUJKDBSA-N 375.335 5.523 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c2ccccc12 570738252 YXCCPUYLRBJESJ-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SCCOc1cccc(C#N)c1 575212314 QDGWVZOWGUSYGY-DLBZAZTESA-N 382.529 5.211 30 20 GKED COc1cc(CN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)ccc1C#N 582389768 BPBYYHFIZPMYGP-VWLOTQADSA-N 397.453 5.133 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)[C@@H](C)CC#N 597297617 HYOSTZPYOGFAEJ-HNNXBMFYSA-N 378.451 5.220 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 599737682 OYXABSPKQREWED-ILXRZTDVSA-N 391.487 5.265 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(F)c(C(=O)OC(C)(C)C)c1Cl 599921054 UPGGYAXRJLYRQW-GFCCVEGCSA-N 382.863 5.007 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)N(C)Cc1cccc(C#N)c1 603646641 HLHLLYFXPWOGIJ-UHFFFAOYSA-N 391.393 5.030 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 604084746 HIFGUFXTZGQXPQ-UHFFFAOYSA-N 399.494 5.304 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccccc1SCc1ccco1 604393042 MBLUXCLHFQSLJA-UHFFFAOYSA-N 378.453 5.095 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N[C@@H](c3cccs3)C3CC3)c2)cc1 609641224 CMHWIFXMBNWMDP-JOCHJYFZSA-N 388.492 5.080 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2ccc(C#N)nc2)C(C)C)s1 609643645 UPHFNGXKWSLKQQ-UHFFFAOYSA-N 375.497 5.041 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1 609967795 HGUALUCPRMOWDU-INIZCTEOSA-N 388.433 5.194 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1 620315110 YFYRRMGKONPPAO-OYRHEFFESA-N 385.467 5.035 30 20 GKED N#C[C@@H](C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1nc(C2CC2)cs1 647377063 MTTVVARGSVLFQD-SFHVURJKSA-N 393.512 5.029 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 661115520 SWLVLRXEJYIFOM-DENIHFKCSA-N 397.588 5.669 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@H](CC(F)(F)F)C1 666866697 YQUAZTZMTWEYEG-GOEBONIOSA-N 384.442 5.112 30 20 GKED CSc1nc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2s1 726438037 PEYVMXHZQAGBFV-UHFFFAOYSA-N 390.946 5.352 30 20 GKED COc1cccc(C=Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1O 727973226 VJZBFLCSWWLGTH-UHFFFAOYSA-N 392.842 5.255 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 730918287 ZTNPGKRIFLASQR-FDFHNCONSA-N 392.458 5.325 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\C[C@H](O)c1ccc(Cl)cc1Cl 731938048 QWZYUMKMSILLSI-DUCFUJNISA-N 379.070 5.158 30 20 GKED Cc1cc(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)c(C)n1[C@@H](C)c1ccccc1 733258567 FGJWKDQTTREIPB-AOMKIAJQSA-N 391.902 5.362 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 733620520 ALYQBRNBPOTBCQ-DEOSSOPVSA-N 399.494 5.911 30 20 GKED C#CC[C@H](OC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccccn1 733691192 BGIAURCRAPRMEO-QHCPKHFHSA-N 397.430 5.328 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccccc2N(C)c2ccccc2)c1 733771132 KAZYGSWJRSEBBA-OAQYLSRUSA-N 399.494 5.065 30 20 GKED Cc1cccc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 734644576 RXTPSRRURBNXDG-DVECYGJZSA-N 383.495 5.842 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccccc1Oc1ccccc1C)c1ccncc1 734668285 AKYBLEDIKBGQHX-OAQYLSRUSA-N 387.483 5.299 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)SCc2cc(Cl)ccc2OCC#N)c1 735317465 AOBFVGRELRZONZ-OAHLLOKOSA-N 388.920 5.120 30 20 GKED C=CC[C@H](NC(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccncc1 735798275 CLQIPKLGIQSKPC-IBGZPJMESA-N 385.492 5.406 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(SC)c(F)c3)cs2)c1 741847506 ONPXEUSGECWDQR-BQYQJAHWSA-N 385.485 5.576 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(Br)cc(C(F)(F)F)c2)c1 743009545 WQNCTKBRPMZFSF-UHFFFAOYSA-N 399.235 5.258 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)N1c2ccccc2Sc2ccccc21 743454830 QFLCFCKYIQMVPR-OAHLLOKOSA-N 388.517 5.868 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1)c1ccncc1 745829194 YSXUKXIOCNKTMQ-QFIPXVFZSA-N 381.495 5.382 30 20 GKED COc1cc(/C=C\C(=O)c2ccsc2)c([N+](=O)[O-])cc1OCc1ccccc1 749105047 QCFVRDBMTICDBS-FPLPWBNLSA-N 395.436 5.140 30 20 GKED C#CC[C@@H](OC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccccn1 750695769 BRAWZAFSNMOLSE-AUUYWEPGSA-N 396.899 5.072 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(CCC(F)(F)F)cc2)cc1Cl 753161899 RZJCCTNDYBVWIU-UHFFFAOYSA-N 383.826 5.515 30 20 GKED N#CC1CCC(COC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)CC1 755978021 XPLJNAOUFNLMFT-UHFFFAOYSA-N 396.434 5.121 30 20 GKED COc1ccc(C[C@@H](C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 758409789 MQAUVSKUKJAGBV-KOSHJBKYSA-N 384.479 5.168 30 20 GKED Cc1ccc(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)cc1Cl 766431534 GTOQWZNDZXPTPI-UHFFFAOYSA-N 393.899 5.277 30 20 GKED Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 770176493 COJMCMLYKLSGJO-NLFFAJNJSA-N 397.522 5.745 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCc3cc(Cl)cc(Cl)c32)c1 772986774 YNZALFYQMXYJQR-VQIMIIECSA-N 375.299 5.451 30 20 GKED Cc1sc(CN[C@H](C)c2ccc(OCC#N)cc2)nc1-c1ccc(Cl)cc1 776158206 VLUKRURNEMGATA-CQSZACIVSA-N 397.931 5.525 30 20 GKED CC(C)(C#N)CCOC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 776371612 IDDXLQRORICZQR-UHFFFAOYSA-N 381.259 5.064 30 20 GKED C[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1cccc(-c2ccccc2)c1 777117619 NPXBJYYPRYPMPT-IBGZPJMESA-N 397.522 5.359 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@H]1CCc2cc(C#N)ccc21 782450514 GALGGTHQLLPWOF-NRFANRHFSA-N 377.557 5.779 30 20 GKED N#C[C@H](C(=O)CCCSc1ccc(Cl)cc1)c1nccc2ccccc12 792102323 HZIGAFMIICVWKC-LJQANCHMSA-N 380.900 5.637 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(SC)cc2Cl)cn1 792884870 GBWIBVVDPQINGC-YFHOEESVSA-N 396.899 5.424 30 20 GKED COc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1OC1CCCC1 792976668 SAGRMWUFFLBSAH-GOSISDBHSA-N 378.472 5.043 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc2ccc(C(F)(F)F)nc2c1)c1ccccc1 796663555 JUGAZZXMJMSQDK-MRXNPFEDSA-N 384.357 5.247 30 20 GKED CCc1ccc2occ(C(=O)[C@@H](C#N)C(=O)Nc3c(CC)cccc3CC)c2c1 796788190 IIFUNQKKHQFAOC-LJQANCHMSA-N 388.467 5.081 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCCCc2nc3ccccc3s2)s1 797569777 WNTZQVDHDIIVBW-CQSZACIVSA-N 397.569 5.640 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571889 WVUZZSFZXHGPTB-AWEZNQCLSA-N 398.919 5.078 30 20 GKED CC(C)(CCC#N)COC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 798877220 PYSNRNLTAIKLER-UHFFFAOYSA-N 382.407 5.316 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc[nH]1)c1nc(-c2ccc(Cl)cc2Cl)cs1 802044034 BLEFKKWFYNZSAX-KXQLTZBTSA-N 388.279 5.335 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(Cl)c(O)cc3F)cc2)cc1 805258495 IDNTZBZAPMZTOG-UHFFFAOYSA-N 396.805 5.295 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1 808239397 JMMMDLZTDWTTDS-GOSISDBHSA-N 381.357 5.008 30 20 GKED CC(=NNc1ccccn1)c1sc(-c2ccccc2Br)nc1C 814731556 CYAPVWQZAFFINQ-UHFFFAOYSA-N 387.306 5.112 30 20 GKED C=CCC(F)(F)C(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 815571957 QSVUJHFYMHWHMF-LJQANCHMSA-N 386.467 5.446 30 20 GKED C=CC[C@H](C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817870533 RUXGYJGUEFBCMB-DOMZBBRYSA-N 382.813 5.291 30 20 GKED C#CCO[C@@H](C)C(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 839214283 RVGIVMGJXOBNHE-INIZCTEOSA-N 378.497 5.123 30 20 GKED C=C[C@@H](Cc1nc(-c2cccc(OCc3cccnc3)c2)no1)c1ccccc1 904507141 YONNPPSCKBJENL-IBGZPJMESA-N 383.451 5.223 30 20 GKED Cc1sc2ncn(N=Cc3c(-c4ccccc4)[nH]c4ccccc34)c(=O)c2c1C 916311017 WCWJTURKDHEQPP-UHFFFAOYSA-N 398.491 5.105 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(Cc2cccc(F)c2)C2CC2)cc1 916680013 CMIULYHBSKCLJY-XMMPIXPASA-N 399.469 5.678 30 20 GKED Cc1cc(/C=C/C(=O)[C@H](C#N)c2nc3ccccc3o2)c(C)n1C1CCCCC1 917509921 GXLMJUDPEGYMER-SJFMBGHLSA-N 387.483 5.641 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccccc1OCC#N 919998281 DZVDKYIPUUTODS-QGZVFWFLSA-N 376.481 5.054 30 20 GKED CC(C)c1ccc(SCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 920267422 IQOMWWNRLVZQMY-GOSISDBHSA-N 393.537 5.297 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=NNc2ccc(Cl)cc2Cl)C1 1776029767 SYXLJQOQQHABKV-UHFFFAOYSA-N 383.662 5.231 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1cc(F)ccc1Oc1cccc(F)c1 1776037733 YHAZETXNSVYZKA-UHFFFAOYSA-N 382.366 5.291 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NNc1ccc(F)cc1C(F)(F)F 1776110746 QQOAWUGLMLDPNW-UHFFFAOYSA-N 380.341 5.085 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2)cc1 1776125355 GFXBGURAGALRBN-KAPURRDVSA-N 380.484 5.876 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1C(F)(F)F 1776355408 KDSZKQBVRRQBAM-VQHVLOKHSA-N 378.346 5.087 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776470883 JMDWITROQAPGNY-FPAJZGIOSA-N 396.439 5.302 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2cccc(SC)c2)nc2ccccc21 22351080 AOSPUKRDRZLWDU-AWEZNQCLSA-N 383.542 5.064 30 20 GKED C=CCn1c(SCc2c(C)cc(C)c(C(C)=O)c2C)nc2ccccc2c1=O 24965903 SGYWFCBHVAQLNJ-UHFFFAOYSA-N 392.524 5.003 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(-c2nc3ccccc3[nH]2)cc1 25675219 FFLPQIMOUPAYNX-UHFFFAOYSA-N 384.464 5.098 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)nc2)cc1Cl 46861736 ZVBHQFAKUKHUCI-KRWDZBQOSA-N 382.250 5.296 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1cccc(Br)c1)c1ccccn1 49458338 GXVSNRPYVZHOTG-QGZVFWFLSA-N 393.240 5.126 30 20 GKED C=CCn1c(SCc2nc(C)c(C)o2)nnc1-c1ccc(C(C)(C)C)cc1 60534065 FZTYJVWBDWVTNA-UHFFFAOYSA-N 382.533 5.326 30 20 GKED N#CCCn1cc(C(=O)CN(Cc2ccccc2)Cc2ccco2)c2ccccc21 96966355 JBSKQQLYXOQDFM-UHFFFAOYSA-N 397.478 5.033 30 20 GKED CSc1ccc([N+](=O)[O-])c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 120812364 BOKPDEIPOUHYOM-UHFFFAOYSA-N 395.465 5.169 30 20 GKED COCc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)o1 123696561 FWFPOWMAHQIHIU-YJBOKZPZSA-N 399.516 5.047 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2cccc(F)c2)c2nccn2C)cc1 128559122 JNQRSSQPGWLEQQ-IIBYNOLFSA-N 399.897 5.131 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2ncc[nH]2)cc1 161822002 BCFMGUKLZHQZTO-UHFFFAOYSA-N 396.475 5.352 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 163108630 MXTNKDFDFUEQNZ-UYAOXDASSA-N 398.528 5.123 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 171742206 HDNOHEXWJZHZNU-LPHOPBHVSA-N 397.519 5.316 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)c1 175501706 ZANQKWXSJIPXNG-UHFFFAOYSA-N 384.464 5.098 30 20 GKED N#CCOc1ccc(CN[C@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 176978908 XCIJXOVBUAJXPP-QFIPXVFZSA-N 380.850 5.261 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(COCc2ccccc2)cc1 177066901 GQJKAEXJKIANLE-UHFFFAOYSA-N 379.504 5.197 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2cccc(F)c2F)C(F)(F)F)cc1 183379786 XQZIBTWSBZXLCV-MRXNPFEDSA-N 397.347 5.191 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1nc(C2CCCCC2)no1 191462346 LSZJQUCNUYQXHE-INIZCTEOSA-N 396.535 5.852 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@]1(O)CCC[C@H](C(F)(F)F)C1 191511863 XLOIHPNIOZLZKK-OXJNMPFZSA-N 398.469 5.144 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1ccc(-c2cccnc2)cc1 191821819 PCFINIUSBXETEW-OAHLLOKOSA-N 392.300 5.234 30 20 GKED CCC(=O)Nc1ccc(C)c(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 236824824 IBONJLNCDWLZRS-UHFFFAOYSA-N 399.494 5.406 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2\CCCC(C)(C)C2=O)cs1 255659936 LETPHIYUOQKLPU-SDNWHVSQSA-N 388.920 5.644 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 303618802 MSOXTTVZQXOZHA-INIZCTEOSA-N 376.481 5.032 30 20 GKED C=CCn1c(SCc2cc(Cl)ccc2Cl)nnc1-c1cccnc1 303874088 IEWKBXPXYJPUKN-UHFFFAOYSA-N 377.300 5.125 30 20 GKED OC(=Nc1ccc(Cl)c(/C(O)=N/C2CCCCC2)c1)C12CCCN1CCC2 328785079 OFEDCHPHEBDUFA-UHFFFAOYSA-N 389.927 5.194 30 20 GKED C=CCCc1ccccc1NC(=O)c1cnc(-c2ccc(OC)c(OC)c2)s1 410348656 ZMYCKNXTPSAKAX-UHFFFAOYSA-N 394.496 5.198 30 20 GKED Cc1cc(Br)ccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430645718 VHXHOSBOXKZKBI-ZDUSSCGKSA-N 377.307 5.002 30 20 GKED N#CCCC[C@H](NCc1nc2cc(Br)ccc2o1)c1ccccc1 433027747 MNGOBURIXMSARY-INIZCTEOSA-N 384.277 5.115 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc(OC)c2)nnc1-c1ccc(OC)cc1 435197930 LRFCNFOJIBMSED-HNNXBMFYSA-N 381.501 5.002 30 20 GKED CC[C@H](C(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 437662813 UPBOLVRPWDPSLM-IBGZPJMESA-N 390.405 5.520 30 20 GKED CN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438649034 LORBFDNVHCMAOR-UHFFFAOYSA-N 389.430 5.196 30 20 GKED N#CCC[C@H](NC(=O)N1CCc2cc(-c3ccccc3)oc2C1)c1ccccc1 438846279 JCKIJKHBMUANCI-NRFANRHFSA-N 385.467 5.059 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)c2)cs1 442616154 CIKBEUVTAZVGOO-HNNXBMFYSA-N 387.386 5.022 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1csc(CCc2ccccc2)n1 444397515 BCWMTJXNJQXWGH-QGZVFWFLSA-N 393.581 5.792 30 20 GKED CCCN(CCCCC(C)(C)C#N)CC(=O)Nc1cc(Cl)ccc1Cl 444582312 JNUPBEVXQYIART-UHFFFAOYSA-N 384.351 5.364 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@H](CC)c2ccc(C#N)cc2)cn1 447533523 XXVNJIXFQSHQGF-OAQYLSRUSA-N 387.483 5.385 30 20 GKED C[C@@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(F)c(F)c1 460164764 SOEXZDBFVJZBGY-CQSZACIVSA-N 378.378 5.371 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 465528129 SJYKUPZYRYEXEA-CDNPAEQRSA-N 391.515 5.016 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1cccs1 465728822 XFPJSUYPTFQBQA-SLFFLAALSA-N 381.545 5.317 30 20 GKED COc1ccc2c(c1)[C@H](NCc1ccc(-c3ccccc3C#N)cc1)CCS2 467407116 LZWIVXKESBJXRF-HSZRJFAPSA-N 386.520 5.561 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCCC4(CCC4)C3)c2)cc1 471200915 ASTLQODSCCBFLC-UHFFFAOYSA-N 389.499 5.130 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 471274074 UCDSJZUPIKSTNI-SCLBCKFNSA-N 389.377 5.155 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CN1CCCC1)c1ccccc1 475578181 MUZZFIKCXPEYRW-QHCPKHFHSA-N 391.559 5.497 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](CC(F)(F)F)c1ccc(F)cc1 481655414 KUCBUZAZFRHFPO-VQTJNVASSA-N 376.397 5.748 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1 482423738 PIEXMOKFBGQPJE-UHFFFAOYSA-N 394.377 5.280 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Br)c1)c1nccc2ccccc12 483206219 CDNIBAGLLMNMNA-INIZCTEOSA-N 385.648 5.141 30 20 GKED N#C[C@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1nc2ccccc2s1 483437271 FVHNQGQCPKWLJC-MRXNPFEDSA-N 395.443 5.595 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(C#N)s3)cc2Cl)cc1 486675098 QXMQEAGPQQIUGB-UHFFFAOYSA-N 379.828 5.189 30 20 GKED N#C[C@H](C(=O)c1csc(CCc2ccccc2)n1)c1nc2ccccc2s1 499581624 HYISUXGTVDQLPW-OAHLLOKOSA-N 389.505 5.028 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC3(CCCCC3)C2)cc1 503149687 DOINXHOUPILVON-UHFFFAOYSA-N 376.525 5.257 30 20 GKED N#CCc1ccc(NC(=O)NC2(c3ccc(Br)cc3)CCCC2)cc1 503516140 JYIKMPLSCPPXCE-UHFFFAOYSA-N 398.304 5.106 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)c1ccccc1C#N 508090736 YZKNSSBMYLBAQE-UHFFFAOYSA-N 388.279 5.265 30 20 GKED CCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](C)c1ccc(C#N)cc1 508622852 YXEDCWNEKOTGTH-HNNXBMFYSA-N 392.484 5.173 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)c2cccc(CC#N)c2)n1 509220153 YEOFQUKMWQUDJW-UHFFFAOYSA-N 399.928 5.575 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C)cc1OCC(F)(F)F 511003391 OWAZHUNUCHMCED-UHFFFAOYSA-N 384.423 5.218 30 20 GKED C[C@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1F 512655666 WEOAWSRANTVTEI-OYHNWAKOSA-N 379.866 5.380 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1cc(C#N)ccc1Cl)c1ccccc1 512935870 MYEFOKMOIANDPL-OAHLLOKOSA-N 376.843 5.604 30 20 GKED COc1cccc([C@H]2C[C@H]2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517338786 IGEUADDKEKVDPP-DHIUTWEWSA-N 384.435 5.101 30 20 GKED CCCN(CC)c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518740329 VSNCUOVDSQIYLU-QGZVFWFLSA-N 381.545 5.569 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1)c1ccc(C#N)cc1 521278576 RRYCWIHFJDFFEI-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(-c2ccccn2)cc1 521320299 NXKKPHILBVWLHB-GGAORHGYSA-N 382.467 5.052 30 20 GKED C=CCN(C(=O)[C@H]1CSc2ccccc21)c1nc(-c2ccccc2)cs1 524025455 KCHWHWAQAWAGPC-KRWDZBQOSA-N 378.522 5.219 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(N3CCCCCC3)c2)c1 525452536 ISRPFGQNSCGJBK-UHFFFAOYSA-N 392.503 5.394 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2ccc(F)cc2)n1 532580491 LOMVUXFYSDWRKB-UHFFFAOYSA-N 375.513 5.145 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc4ccc(F)cc4c3)n2)cc1 533954986 YUYOEYYJVCDNLH-GOSISDBHSA-N 387.439 5.296 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1OC(F)F)c1ccc(-c2cccnc2)cc1 538227591 BZJSVIKQXYQLAI-OAHLLOKOSA-N 379.410 5.072 30 20 GKED Cc1nn(-c2ccccc2)cc1CNCc1ccc(-c2ccccc2C#N)cc1 540202921 QEHFYAVDNPXMFN-UHFFFAOYSA-N 378.479 5.009 30 20 GKED N#Cc1cccc(CNC2(c3noc(C4CCCCC4)n3)CCCCCC2)c1 541696484 CIDWFBIRDMXCGJ-UHFFFAOYSA-N 378.520 5.328 30 20 GKED N#CC1(c2ccc(C(=O)N3CCCCC[C@H]3/C=C\c3cccs3)cc2)CC1 543110622 HVFCLDYTILDYHB-DUQGCJEPSA-N 376.525 5.401 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(SCc3ccccc3Cl)cn2)s1 544883661 RGRUDVOFCMRKSX-UHFFFAOYSA-N 385.901 5.213 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCC(CC(F)(F)F)CC3)c2)cc1 557181293 PDSMIVVEPRQKSU-UHFFFAOYSA-N 387.405 5.106 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C1CC1 559989209 IXBJIKOKOZFKEH-OAHLLOKOSA-N 382.872 5.326 30 20 GKED C=CCn1c(-c2c[nH]c3ccccc23)nnc1N1CCC[C@H]1c1cccs1 562032451 FZNJGQDASGSEDB-SFHVURJKSA-N 375.501 5.015 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CNCc1cscc1C(F)(F)F 569746180 ATUSOCVVDKRUKX-UHFFFAOYSA-N 375.284 5.354 30 20 GKED C[C@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 574308605 ICGWADDIUGILTD-LPHOPBHVSA-N 377.488 5.032 30 20 GKED N#CCCCCCC(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 588943428 OPNCDGGRYZTTMU-UHFFFAOYSA-N 389.421 5.103 30 20 GKED CC(C)Oc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 592360803 KBLTZLGWZGOHKV-CQSZACIVSA-N 398.434 5.366 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N5CCC(CCC#N)CC5)(C4)C2)C3)cc1 592819797 REELTUDEZOGBAP-URFUVCHWSA-N 390.571 5.375 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc2c(c1)CCCO2 596735238 XEYFICBBECUOOK-CVEARBPZSA-N 395.528 5.146 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1[C@@H]1CCCOC1 599410089 XICOMFSRYFCRJT-FUHWJXTLSA-N 397.544 5.103 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 603527340 KGBQWSSIZCYHBP-MOPGFXCFSA-N 386.417 5.118 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)c1 603621704 VWKNYLGFPRHSHN-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604461376 MNHSCJPNIFZBPZ-MRXNPFEDSA-N 389.430 5.715 30 20 GKED CCCc1ncc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 608552894 MPCGGJZBHIDFCF-SNVBAGLBSA-N 395.431 5.214 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3cc(C#N)ccc3OC(F)F)s2)c(C)c1 609066387 FJPRDNFEAZMDFO-UHFFFAOYSA-N 399.422 5.152 30 20 GKED CC(C)c1ccc(CN(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609403004 IZGBGBNMFDXRAB-QGZVFWFLSA-N 381.545 5.726 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccccc3OCc3ccccc3)no2)cc1 609475530 FNNCBVPQMQSVCI-UHFFFAOYSA-N 399.475 5.480 30 20 GKED CCN(Cc1ccoc1)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609724015 CLMJTMHTQMUGMF-UHFFFAOYSA-N 380.831 5.259 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cc(C)ccc4nc3C)n2)cc1 613314331 KSZNLHAPTAPFGD-HXUWFJFHSA-N 397.503 5.774 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618844923 AKJMUYGZPFCVPU-BLVKFPJESA-N 388.298 5.255 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Br)s2)C2CC2)cc1Cl 619755781 SJTCSLNQHKKVRV-INIZCTEOSA-N 381.726 5.277 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2cccc(OCCCC#N)c2)c1Cl 728444399 PQTBOOZUZIFPNB-UHFFFAOYSA-N 394.327 5.793 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)OCc3ccc(OCC#N)cc3)cs2)cc1 733410797 XVVKHKPBLAJFCW-UHFFFAOYSA-N 392.480 5.193 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)Cc3coc4ccc5ccccc5c34)[nH]c12 735789606 MZYDQRZXTOOSHQ-SFHVURJKSA-N 379.419 5.190 30 20 GKED C=CCCOC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 740205392 VLKMDHHXLNFHIO-SSZFMOIBSA-N 394.452 5.255 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@]12CCCc1ccccc12)c1nc(-c2ccccc2)cs1 744037515 XJXYHWJTTPWPPL-LJFZDNNRSA-N 384.504 5.281 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@@H](Cc3ccccc3)c3ccccc3)[nH]c12 744161635 VYJXHOXNAGLQFP-YADHBBJMSA-N 393.490 5.464 30 20 GKED COc1ccc(CCC(C)=NOCc2ncc(-c3ccc(Cl)cc3)o2)cc1 744179204 CETVNYHLICBZFL-UHFFFAOYSA-N 384.863 5.529 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)OCc2ccc(-c3ccccc3C#N)cc2)n1 744674669 HOFFQFPEFQLTMY-UHFFFAOYSA-N 391.858 5.149 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)NCc1ccccc1 745724790 XAKUBAWRCVHGKG-UHFFFAOYSA-N 389.499 5.087 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cc(-c2cccs2)nc2ccccc12 747398679 BEFWOMHUHOVJAL-UHFFFAOYSA-N 385.448 5.096 30 20 GKED CCc1ccc([C@H](NCc2ccc(OC)c(O[C@H](C#N)CC)c2)C(C)C)cc1 774450247 SSBKOVNUNHQOGY-XUZZJYLKSA-N 380.532 5.425 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21 776959341 XNMGOQBQHHIUSE-KHHDVDEJSA-N 389.499 5.168 30 20 GKED Cc1ccc(C[C@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 779197759 ICTKKXURGVGIDX-HOCLYGCPSA-N 396.462 5.452 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCCOc1ccc(C(C)(C)C)cc1 780151263 KLNWIFMORHWCOG-KRWDZBQOSA-N 380.488 5.073 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccc(F)cc2)CC1)c1nc2cc(Cl)ccc2s1 783071090 ZECUKDXMRABLFE-HNNXBMFYSA-N 384.863 5.288 30 20 GKED Cc1c(C#N)c(NC(=O)CSCCSC(C)(C)C)n(C2CCCC2)c1C 783537848 GDWAOWKVCVUDDB-UHFFFAOYSA-N 393.622 5.295 30 20 GKED CC(=O)Nc1ccc(C(=O)/C=C/c2cc(Br)c(Cl)s2)cc1 790223290 JKJONYKAWDSFQY-VOTSOKGWSA-N 384.682 5.019 30 20 GKED COc1cc(C2(C(=O)[C@H](C#N)c3nccc4ccccc34)CCCC2)ccc1C 792103954 VCXHJXBYQZARKO-OAQYLSRUSA-N 384.479 5.240 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccccc1O[C@@H](C)C#N 796924929 VOWYSCRVDPHDEU-ZDUSSCGKSA-N 395.846 5.101 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 812009879 DNKZLWOQMCSUHY-MJGOQNOKSA-N 390.572 5.570 30 20 GKED CCOc1cc(/C=C2\CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1O 818242821 LZNXAXUCZKLRIN-IZKYPSLPSA-N 399.830 5.182 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(-c2ccc3ccccc3c2)no1 818425948 PUFQBVASPOTWCG-GOSISDBHSA-N 392.459 5.149 30 20 GKED C[C@H](NN=Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl)c1ccncc1 819815689 UFQYGIAUDAUDCM-HNNXBMFYSA-N 381.911 5.038 30 20 GKED O=C1CCCN1c1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1Cl 839386350 POOCTSHTKYBCJO-UHFFFAOYSA-N 383.662 5.230 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842942203 WRQGQKMCLGLDEK-BXUZGUMPSA-N 378.419 5.409 30 20 GKED COc1cccc(C(F)F)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 888862399 DHGUKEPFRIJQNZ-GFCCVEGCSA-N 376.428 5.137 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccc(OC(F)F)cc1 915044372 KUJYLUGAXTUMHH-KMKOMSMNSA-N 381.378 5.158 30 20 GKED CC(C)SCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 915101686 GKUXRGAHGBVDIU-GFCCVEGCSA-N 385.341 5.435 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 915124758 VQDPTQGTYYBOTH-FQEVSTJZSA-N 388.452 5.059 30 20 GKED N#C[C@@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1ccc2ccccc2n1 916849610 WAIKPZVUPWSWLY-GRTQGXPSSA-N 398.462 5.852 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3ccc(F)cc3s2)cc1 916955272 NVQQUTYBFVFJQB-UGSOOPFHSA-N 394.471 5.515 30 20 GKED N#Cc1ccccc1/C=C\C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 917043677 NLYNFXRFCMTUDU-PKYBCLHXSA-N 397.381 5.076 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2sccc2s1 918488009 ZFZYMZDVQQMKBK-AWEZNQCLSA-N 376.462 5.077 30 20 GKED C[C@@H](Cc1ccccc1F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919773621 VDALMDLUGJRQLF-HTAPYJJXSA-N 387.458 5.234 30 20 GKED Cc1c(NN=Cc2c(Cl)cccc2Oc2ccccc2)cccc1C(=O)O 1776087331 VQHPSSJRMPGBFS-UHFFFAOYSA-N 380.831 5.585 30 20 GKED C=C(C)COc1cc(CN[C@H](CC(=O)O)c2ccc(C(C)C)cc2)ccc1OC 1776140281 JTACJLKGKXQQTR-OAQYLSRUSA-N 397.515 5.079 30 20 GKED CC(C)c1cccc2c1OCC/C(=C/c1c[nH]c3ccc(C(=O)O)cc13)C2=O 1776378150 UNGSGLWZBGYPJB-UVTDQMKNSA-N 375.424 5.038 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 1776783081 WOMDRAKGVHEPMY-MRXNPFEDSA-N 388.464 5.148 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)c2cc(F)ccc2F)c1 1776788192 WVWIWGRXGAUTEH-NRFANRHFSA-N 391.458 5.230 30 20 GKED CCOc1ccc(Cl)cc1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776931347 DFGXVSUVBMQIBL-VMPITWQZSA-N 388.847 5.120 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)cs1)C(=O)N(CCC#N)c1ccccc1 5971888 JKUSJVLOOOAPKW-INIZCTEOSA-N 393.537 5.238 30 20 GKED C[C@@H](NC(=O)N1CCC(c2cccc3ccccc23)CC1)c1ccc(C#N)cc1 58573523 AYMYAUABUDGLSX-GOSISDBHSA-N 383.495 5.362 30 20 GKED Cc1c(Br)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 66162077 AGOHPKHFICSMHX-UHFFFAOYSA-N 386.293 5.072 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCCc2ccccc21)c1ccc(OCc2ccccc2)cc1 72096709 XMZRMCFRAZHMHQ-DQEYMECFSA-N 396.490 5.067 30 20 GKED COc1ccc(CN(Cc2ccccc2O)C2CCCC2)cc1OCCCC#N 93319334 WKFFNSNBOZKXBZ-UHFFFAOYSA-N 394.515 5.028 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccoc1C 97545430 WXTKFFZUPPTGAA-ZDUSSCGKSA-N 393.434 5.905 30 20 GKED COc1cccc(-c2nc(CNc3ccccc3SC[C@H](C)C#N)cs2)c1 108354087 MOGAFQDDKWRGJM-OAHLLOKOSA-N 395.553 5.683 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(F)c(F)c1 108409222 TYIMSGLWIQCEPC-ZDUSSCGKSA-N 392.496 5.088 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 122295779 TVEVRWRJVHUBBQ-QGZVFWFLSA-N 394.883 5.303 30 20 GKED CC(C)c1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 122544717 RDAFTAVJCCBWSB-ZDUSSCGKSA-N 387.917 5.533 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H](C)c1ccncc1 129055441 ADWBZASJODZYGX-KRWDZBQOSA-N 386.455 5.279 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 145310300 ORLIONATYXLFCH-PXDATVDWSA-N 396.490 5.123 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)c(F)c1 151163540 GKUSMKJNWPUZAI-UHFFFAOYSA-N 393.324 5.036 30 20 GKED CCN(C(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccc(C#N)cc1 151890230 ALCRXWWRGFAYLG-UHFFFAOYSA-N 393.537 5.282 30 20 GKED CC(C)Cc1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 156245800 VNUWPJUYYBTALO-OXJNMPFZSA-N 389.524 5.384 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(CCC(F)(F)F)cc1 160714790 RLSXYIVRCHXZPW-UHFFFAOYSA-N 376.378 5.093 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCSC2(CCCCC2)C1 177090017 DAFXQFSMFYUVBP-MRXNPFEDSA-N 389.590 5.364 30 20 GKED C=CCn1c(SCc2csc(-c3cccs3)n2)nnc1-c1ccccc1 301604998 JVYWLEVONBFPNB-UHFFFAOYSA-N 396.566 5.608 30 20 GKED CC[C@@H]1Oc2cc([C@H](C)/N=C(/O)N3CCCC34CCCCC4)ccc2N=C1O 328813025 FWCHJMRCZWPXDP-YJBOKZPZSA-N 385.508 5.219 30 20 GKED O/C(=N/CCc1cc2ccccc2[nH]1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329483454 RWWGEDOLKGWSDP-LJQANCHMSA-N 390.531 5.174 30 20 GKED CC[C@@H]1C[C@H](/C(O)=N/C[C@@H]2CC3c4ccccc4C2c2ccccc23)CC(O)=N1 329559076 FLEMUEZBBLKPFC-XDNCQWLYSA-N 388.511 5.385 30 20 GKED N#Cc1ccc(NC(=O)N2CCc3c(Cl)cc(Cl)cc3C2)c(Cl)c1 426142669 VZQQRANFMXJKKR-UHFFFAOYSA-N 380.662 5.109 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2occc2CSc2ccccc2)s1 430619936 BONUCWMOQQKADO-MRXNPFEDSA-N 396.537 5.816 30 20 GKED N#CCC1(CNC(=O)c2oc3ccccc3c2CSCc2ccccc2)CC1 431151072 MYGKRMBGRROVKO-UHFFFAOYSA-N 390.508 5.290 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCC[C@H](c2ccccc2)C(F)(F)F)cc1 432699341 NAWQFWKACGMDKY-GOSISDBHSA-N 389.421 5.345 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(Cl)c1-n1cccn1)c1ccccc1 432916694 IYVBKNJBYXGACL-GOSISDBHSA-N 393.878 5.082 30 20 GKED CC(C)Oc1cc(O)ccc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 433521090 RVZOUIWGUYPEFN-AWEZNQCLSA-N 385.489 5.218 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(Cc2ccccc2Cl)C1 438641301 LEGIUHQEELTGSV-HNNXBMFYSA-N 399.947 5.441 30 20 GKED CC[C@@H](NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccc(C#N)cc1 447533246 XDUIPONTFDOEBW-HSZRJFAPSA-N 380.495 5.197 30 20 GKED C[C@H](Sc1ccc(Cl)c(Cl)c1)C(=O)N(CCC#N)c1ccc(F)cc1 463201070 ICHLMXHKACQYBD-LBPRGKRZSA-N 397.302 5.560 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC[C@@H]2c2cccnc2)cc1 464858583 VBRRYKMRQDFRJQ-JOCHJYFZSA-N 383.451 5.031 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1 469031020 PVXDRAQCJAGDFX-SFHVURJKSA-N 376.500 5.032 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)[C@H](C#N)Cc1ccc(C#N)cc1 470896734 IDUXFKOEMDJEAI-INIZCTEOSA-N 383.904 5.033 30 20 GKED O=C(CCCC(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474261271 XYXCUVXYKNPTGI-NSHDSACASA-N 395.265 5.548 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 474911865 KEPKGTNAGDGZIJ-KRWDZBQOSA-N 375.403 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 475547109 IMDPPDNTTVSRES-LJQANCHMSA-N 399.538 6.483 30 20 GKED CC(C)(C#N)c1ccccc1CNC(C)(C)c1ccc(OC(F)(F)F)cc1 475726652 WFBCUIJIOWRTJT-UHFFFAOYSA-N 376.422 5.411 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 476221938 OLCMTKZPOIULKT-SFHVURJKSA-N 399.425 5.516 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)CC(=O)c1ccc(Cl)cc1 476797823 UNFAFAMJKOAPEM-MRXNPFEDSA-N 383.919 6.040 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(-c3cccc(Cl)c3)cs2)c1 476940959 OBGKRPXYDZMXIE-UHFFFAOYSA-N 385.901 5.331 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1c(F)cccc1Cl 477778336 ZTICDRBAWFONDO-OLZOCXBDSA-N 391.899 5.756 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 477778947 YYAHZEOXHMTHDI-UHFFFAOYSA-N 380.332 5.126 30 20 GKED N#Cc1ccc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)cc1F 479490739 NTYJDUWFYUMCNK-UHFFFAOYSA-N 397.812 5.354 30 20 GKED C=CCn1c(SCC(=O)Nc2cccc(C(C)C)c2)nnc1-c1cccs1 481379185 VPKCNHZQXHIADZ-UHFFFAOYSA-N 398.557 5.047 30 20 GKED N#CC[C@@H](CC(=O)Nc1c(-c2ccccc2)nc2ccccn12)c1ccccc1 483108523 ZEYOVOYZEGQSFX-FQEVSTJZSA-N 380.451 5.027 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1)c1ccccc1 483216017 JWHHPBRVBHUIRA-UUOWRZLLSA-N 392.458 5.865 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@H](C#N)c1nccc2ccccc12 483987828 PRYPTPYDEPDAOR-GOSISDBHSA-N 387.826 5.342 30 20 GKED N#Cc1cccc(OCc2cccc(-c3nc([C@@H]4CCC(F)(F)C4)no3)c2)c1 484555251 VNPHCINWFAXHQD-QGZVFWFLSA-N 381.382 5.090 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c1 485302437 MQNMJYJUPTVFIM-GOSISDBHSA-N 385.467 5.328 30 20 GKED CCN(CCC#N)C(=O)c1oc2ccccc2c1CSCc1ccccc1 490117069 IRPIXXRGGPPZSJ-UHFFFAOYSA-N 378.497 5.242 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccc(CCC(F)(F)F)cc1 501777074 RJDPZGMBZMBDGU-UHFFFAOYSA-N 377.406 5.019 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)c1 504060948 XWWLJZVALIWAEA-INIZCTEOSA-N 393.512 5.648 30 20 GKED N#C[C@@H](NC(=O)CCCc1c[nH]c2ccccc12)c1ccc(Cl)c(Cl)c1 505916307 AGEGMOBHFQJHAY-LJQANCHMSA-N 386.282 5.178 30 20 GKED COc1ccc(CN2CCC[C@@H]2/C=C/c2ccccc2)cc1OCCCC#N 507875242 MWRCMOPDBCEPQH-UFSNDUKISA-N 376.500 5.056 30 20 GKED CCCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1 509953342 HSQQGVMCJRUCSR-UHFFFAOYSA-N 383.879 5.197 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nc(C)cs2)cc1 513972599 GKSWWSXCRKMVTN-UHFFFAOYSA-N 390.512 5.434 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCCCCc1cccs1 517558462 CLIWTYHVPOCWIL-UHFFFAOYSA-N 378.497 5.549 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H](c2ccccc2)[C@H]2CCCO2)c1 521831517 ZNKSMRSWVHLZOC-FTJBHMTQSA-N 398.506 5.147 30 20 GKED CN(C(=O)Nc1cccc(C#Cc2ccccn2)c1)[C@H]1CCCc2ccccc21 522071408 NQUUDNJNZRNCDR-DEOSSOPVSA-N 381.479 5.023 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccc(F)cc3C(F)(F)F)c2C#N)C1 532874220 ZRSCNZXAPJJPMT-SECBINFHSA-N 382.382 5.155 30 20 GKED Cc1cccc(Cl)c1NC(=O)COc1ccc(Oc2ccc(C#N)cc2)cc1 533787357 DWXWBIKAZYDDSW-UHFFFAOYSA-N 392.842 5.330 30 20 GKED Cc1cc(-c2csc(NC(=O)c3ccc(C4(C#N)CC4)cc3)n2)ccc1F 539659499 DJEWUUGBEXGGTI-UHFFFAOYSA-N 377.444 5.065 30 20 GKED CCN(C(=O)c1csc(-c2ccc(C)cc2C)n1)c1ccc(C#N)c(Cl)c1 540274460 RAZXOCZYEJZGKL-UHFFFAOYSA-N 395.915 5.619 30 20 GKED C=CCCOCCCCC(=O)N1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 540490876 YEJQREJZOGXLEK-VQIMIIECSA-N 383.454 5.378 30 20 GKED CC[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 541944745 GUAKEWYRRASXNJ-CRAIPNDOSA-N 382.435 5.023 30 20 GKED CC(C)[C@H]1C[C@@H](CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 542881757 LBVXEAFOMXNTLL-HTAPYJJXSA-N 378.472 5.130 30 20 GKED C=C[C@@H](Cc1nc([C@@H](OC)c2ccc(Br)cc2)no1)c1ccccc1 545103766 CRXOAESDYIJFSY-LIRRHRJNSA-N 399.288 5.080 30 20 GKED N#CC1(c2ccccn2)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1 548859419 ZMCNUCLDTZFBRA-UHFFFAOYSA-N 388.342 5.268 30 20 GKED CCC[C@@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccn1 549757100 UJUSNMNQLXEHMP-JOCHJYFZSA-N 399.494 5.249 30 20 GKED Cc1csc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)c2)n1 551114794 IKKYWMBRYXFWTJ-UHFFFAOYSA-N 388.496 5.187 30 20 GKED C=CCC(C)(C)c1noc(CSc2nnc(-c3ccccc3)n2[C@H](C)CC)n1 551136365 LBXXKXKCJHFRSE-OAHLLOKOSA-N 397.548 5.445 30 20 GKED CCCN(C(=O)c1ncc(C#N)cc1C)[C@@H](C)c1ccc(Cl)c(Cl)c1 556278121 JFVUHQFRPRUDFG-ZDUSSCGKSA-N 376.287 5.182 30 20 GKED CC(C)CNC(=O)c1ccc(NCc2cccc(OCCCC#N)c2)cc1Cl 556332621 DANOWWGLNOSKDZ-UHFFFAOYSA-N 399.922 5.020 30 20 GKED N#Cc1ccc(C[C@H](C#N)C(=O)Nc2cccc(-c3cccc(Cl)c3)c2)cc1 556483225 UIZKMEAVRKJHJL-HXUWFJFHSA-N 385.854 5.200 30 20 GKED Cc1c(C(=O)N2CC[C@@H](CSc3ccccc3)C2)sc2ccc(C#N)cc12 560054337 OBTXRAYSINDERB-QGZVFWFLSA-N 392.549 5.336 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)CC1 564655624 RRESOSAKKZLENZ-UHFFFAOYSA-N 384.867 5.075 30 20 GKED C[C@H]1C[C@H](CCNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C[C@@H](C)O1 564741054 NQUSIOPWAXYIFY-IZZQQSIFSA-N 393.487 5.066 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1cc2c(s1)-c1ccccc1C(C)(C)C2 576548584 WKXGTWPNGGUWNL-OAQYLSRUSA-N 384.570 5.014 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)cc1 577511674 VQZQJBWCEZGPPC-GJZGRUSLSA-N 394.540 5.325 30 20 GKED O=C(Nc1cccc(CCC(F)(F)F)c1)c1c(F)cc(C(F)(F)F)cc1F 580804881 JINKKAQXKVXNMR-UHFFFAOYSA-N 397.265 5.731 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1cccnc1C(F)(F)F 599440404 SETGDBXKOVIMQI-GFCCVEGCSA-N 387.327 5.033 30 20 GKED C=CCN(C(=O)c1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603458848 IIGZIRMPDQZTOS-UHFFFAOYSA-N 399.859 5.205 30 20 GKED CC(C)c1nc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2o1 603576689 RSBHIDBPSCMIAQ-UHFFFAOYSA-N 381.435 5.742 30 20 GKED C[C@H](Oc1ccccc1Cl)C(=O)Nc1sc(-c2ccccc2)cc1C#N 603968929 NDUXKLZAUNVZOV-ZDUSSCGKSA-N 382.872 5.346 30 20 GKED N#Cc1c(NC(=O)CCc2c[nH]c3ccccc23)sc2c1-c1ccccc1CC2 603991866 VFPIUYQPZZUVMV-UHFFFAOYSA-N 397.503 5.438 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 606949455 YMVQYUOZMWRDNC-UHFFFAOYSA-N 399.922 5.802 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2Cl)c1)c1cccc(C#N)c1 610345118 SENWDIYZWTYCPO-KRWDZBQOSA-N 376.887 5.641 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1ccc(Oc2ccccc2Cl)cc1 610466298 WBEQMIARHPHXSQ-UHFFFAOYSA-N 391.858 5.083 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC(c3ccccn3)CC2)cc1 611094413 JCIYQWJEVZAQKX-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)c1cc2ccccc2n1CC#N 611169604 GKPXXTKDWAIAFP-UHFFFAOYSA-N 396.288 5.303 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)cc2C)ccc1OCc1ccccc1 614407287 MODKJRLGKPVPHX-LJQANCHMSA-N 386.495 5.305 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(C(F)F)cc1 619125908 YIUZJZOCAUZNTO-UHFFFAOYSA-N 377.275 5.408 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1CC(c2ccc(F)cc2)C1 619129406 QBHKXZLEEVALGR-UHFFFAOYSA-N 399.350 5.489 30 20 GKED C[C@H](CNC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)CC(F)(F)F 668586338 UFBJSPJGJMSSMQ-QMMMGPOBSA-N 378.263 5.051 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)ccc1OC(F)F)c1nc2cc(F)ccc2s1 674045288 FETPYNNXMONWGU-LLVKDONJSA-N 396.777 5.180 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 729070527 XCHXYEHTVZUIQD-BBRMVZONSA-N 389.282 5.225 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1 729448137 FDGHAQAOHVFBMX-UHFFFAOYSA-N 389.499 5.149 30 20 GKED N#C[C@@H](C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1nc2cc(F)ccc2s1 730416858 JAMDIXQWVIBAIE-UONOGXRCSA-N 392.377 5.348 30 20 GKED N#CCOc1ccc(CC(=O)Nc2nc(-c3cccc4ccccc34)cs2)cc1 731958665 BAODRTWQCXAGFV-UHFFFAOYSA-N 399.475 5.047 30 20 GKED C[C@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 737855814 XCPXVTGCIONQRQ-HNNXBMFYSA-N 398.491 5.403 30 20 GKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1csc(-c2ccc3c(c2)OCO3)n1 742436188 GLYIXLGAMQHZGI-UQDQQJHMSA-N 399.518 5.361 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)s1 742646340 LZAQOZJPLDQWGZ-DANTVBBOSA-N 394.327 5.142 30 20 GKED CN(CCC#N)c1ccc(CNCc2ccc(N(C)C3CCCCC3)cc2)cc1 742734097 JVJTZUIFIYPMTR-UHFFFAOYSA-N 390.575 5.095 30 20 GKED CC[C@H](/N=C/c1cc(Br)ccc1O)c1nc(C(F)(F)F)cs1 745975918 CPFDDCYIPUTTOE-PODRTGRWSA-N 393.228 5.200 30 20 GKED C[C@@H](CNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2o1 746562726 FAEQQMPHRUZXRZ-INIZCTEOSA-N 397.434 5.025 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CCCCCCC1 748988924 NQRBKLXVJVSJLJ-QHCPKHFHSA-N 375.516 5.919 30 20 GKED C#CC[C@@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccccc1 757773848 QYZHSZSZBNJTOA-HXUWFJFHSA-N 386.417 5.144 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 759218010 OZUJLYQTOZBBFR-PMXLPMHFSA-N 378.884 5.743 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 762040477 PYMIXPZCUVACOJ-AWEZNQCLSA-N 390.842 5.427 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 762067510 HVANUMSUJKQWOA-SKDRFNHKSA-N 383.325 5.046 30 20 GKED COc1ccccc1CN(Cc1ccc(O[C@H](C)C#N)cc1)Cc1cccs1 768178245 BQHCWPRLKIGNIL-GOSISDBHSA-N 392.524 5.250 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(OCC(F)(F)F)cc2)c1 772982693 FITXWYLQKDYAKK-YJBOKZPZSA-N 392.421 5.159 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)c1 774243454 KYCGMDWRCNHSMG-ILBGXUMGSA-N 388.486 5.580 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)Cc2ccccc2CC#N)cc1 776958909 SFDKXDOSSIQIGD-IBGZPJMESA-N 398.506 5.190 30 20 GKED Cn1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)c(-c2ccc(C#N)cc2)n1 777914935 GDTRRYICCIJXLN-SREVYHEPSA-N 388.279 5.223 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)NCc2ccc(C#N)cn2)cc1 782049843 KXZCERQRDCILCU-MRXNPFEDSA-N 388.496 5.128 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1O[C@H](C)C#N 790927207 RUHLJLWFSKKBCY-GDBMZVCRSA-N 390.405 5.204 30 20 GKED N#C[C@H](C(=O)COc1ccc(Cl)c2ccccc12)c1nccc2ccccc12 792104450 OUIFEPAFKAAYHZ-LJQANCHMSA-N 386.838 5.297 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 796650727 NTIRKHPZVBZQIZ-IACUBPJLSA-N 396.434 5.087 30 20 GKED C#C[C@H](NC(=O)c1ccccc1SCc1cccs1)c1ccc(F)cc1 812751399 UFBVKAOVVLAIOM-IBGZPJMESA-N 381.497 5.284 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 813214197 UKODHAGUGMCBGR-LBPRGKRZSA-N 390.308 5.202 30 20 GKED Cc1sc(C(=O)Nc2nc(Cl)c(C#N)s2)cc1-c1ccc(F)cc1 813370836 ZTKRHCBMAIFIRM-UHFFFAOYSA-N 377.853 5.097 30 20 GKED N#C[C@H](C(=O)[C@H]1CC12CCSCC2)c1nc2cc(C(F)(F)F)ccc2s1 835075281 WVMVONSUVJXRLX-VXGBXAGGSA-N 396.459 5.025 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@]3(CCSC3)C2)cc1 836274298 SUASYBSDGDZUJT-JTHBVZDNSA-N 391.540 5.093 30 20 GKED N#C[C@@H](C(=O)CC1(C#N)CCCCC1)c1nc(-c2c(F)cccc2F)cs1 850795325 CHAFPBMJROMBIR-ZDUSSCGKSA-N 385.439 5.129 30 20 GKED COCc1csc(/C=C2\CC(C#N)C/C(=C\c3cc(COC)cs3)C2=O)c1 899381046 LTDWVWRQHIKTCT-ZEELXFFVSA-N 399.537 5.072 30 20 GKED COc1cccc(-c2nc(/C=C3/CCc4cc(OC)ccc4C3=O)cs2)c1 916153631 YYVHWYXNRYWLOH-GDNBJRDFSA-N 377.465 5.040 30 20 GKED C/C(=C\C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1)C1CC1 916845465 XVSZWOWODMTFGF-OUKQBFOZSA-N 390.533 5.963 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2csc3ccccc23)cc1 916955925 VTNVLZPDGKAUCA-KDOFPFPSSA-N 376.481 5.376 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Br)o1)c1nc(-c2ccccc2)cs1 917024924 CNEKZNIGJBVJNG-IQCBXXCUSA-N 399.269 5.055 30 20 GKED CC(C)N(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)Cc1cccc(Cl)c1 917125249 XHELQPNSCOXIEN-QGZVFWFLSA-N 397.931 5.037 30 20 GKED CC(C)CN(CCC#N)C(=O)CCN1c2ccccc2Sc2ccccc21 917363946 IYLVFDJTIWOMIL-UHFFFAOYSA-N 379.529 5.078 30 20 GKED COc1cccc(C2CC(=O)C(=CN[C@@H](C)c3cccc4ccccc34)C(=O)C2)c1 920979381 KBPVYJNZWQFHFS-DIMJTDRSSA-N 399.490 5.099 30 20 GKED Cc1ccc2c(c1)C/C(=C/c1cn(-c3ccccc3)nc1-c1cccnc1)C2=O 921264767 YYRMBMWNPOIDPC-ZHZULCJRSA-N 377.447 5.065 30 20 GKED CC(C)(C)[C@H]1C/C(=C/c2ccccc2C#N)c2nc3ccccc3c(C(=O)O)c2C1 1776121939 YGZYGISWVPBJAR-OVCORXIESA-N 396.490 5.954 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)c2ccccc12 1776132643 AHSZWIWMQCRBGX-RAXLEYEMSA-N 398.414 5.703 30 20 GKED C[C@H]1C/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776589683 RQRVVHOQQCMHFK-CPEHUTGBSA-N 382.459 5.754 30 20 GKED C=CCn1c(SCc2cc3ccccc3nc2Cl)nnc1-c1ccncc1 8572228 BIOQVWOPZMFAOK-UHFFFAOYSA-N 393.903 5.020 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)Cc3ccc(Cl)cc3Cl)n2)cc1 14497575 XCVBWFVIEDHOCY-UHFFFAOYSA-N 388.279 5.170 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCc1cccc(Oc2ccccc2)c1 63402524 WTAVWWWBLUYEME-UHFFFAOYSA-N 397.478 5.248 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1cc(Cl)ccc1Cl 108352708 OXNJNBFRTHSOSK-UHFFFAOYSA-N 380.300 5.050 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(F)c(Cl)c2)ccc1OC 113308850 OXEXBCNIUAMRGI-CJNGLKHVSA-N 376.859 5.019 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(F)c(F)c1)c1nc(-c2ccccc2)cs1 120130318 TUSAGQJNOXZKPY-MRXNPFEDSA-N 382.435 5.287 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Cl)cn1 120503902 PWIOZEOPAGVJQW-UHFFFAOYSA-N 385.798 5.012 30 20 GKED COc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 153999706 OMUQEDLZFQQCKS-DLBZAZTESA-N 395.528 5.111 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1S[C@@H](C)CC#N)Sc1ccccc1 173122357 JUMYOBIQFGBJHT-HOTGVXAUSA-N 385.558 5.383 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(CSc2ccccc2C#N)cs1 173714306 HFTYQNURKJRMGJ-UHFFFAOYSA-N 383.473 5.131 30 20 GKED C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc(C#N)cc1 173980849 OVQWJLLLTNWDBI-IAGOWNOFSA-N 387.458 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](NC(C)=O)c1ccc(Cl)cc1 189910115 TVEBTDBUHSFHMP-OAQYLSRUSA-N 398.934 5.398 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)C1=Cc2ccccc2OCC1 191570748 MMLNUDDRIRUTEU-UHFFFAOYSA-N 383.513 5.104 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 194178198 KEJLWNJXMDTKDQ-HNNXBMFYSA-N 385.439 5.175 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 255850356 ZFPDPPDIFFPHNL-GAJOTYCWSA-N 385.801 5.365 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)c2ccc(C/N=C(/O)C3CCCC3)cc2)cs1 330005105 BPGTWAGQLUJJPY-HXUWFJFHSA-N 397.544 5.076 30 20 GKED CSc1cccc(F)c1C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 409912581 QKOMLWSRADBBKC-OAHLLOKOSA-N 390.483 5.577 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@@H](C)[C@@H](C)CC2 410976505 ATRUJAOMVBQJPE-YUMQZZPRSA-N 399.463 5.342 30 20 GKED N#C[C@H](C(=O)c1cnc2c(F)cccc2c1)c1nc2cc(Cl)ccc2s1 429684899 NRHXBXVPQBFJAN-CYBMUJFWSA-N 381.819 5.127 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc(OC(C)C)c(C#N)c2)s1 435353948 OCHYEKPEJBMVKU-UHFFFAOYSA-N 377.469 5.030 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(-c2nccs2)c1 437881204 ASHAQOQWGVOMLJ-WOJBJXKFSA-N 388.496 5.114 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)N[C@H](CCC#N)c2ccccc2)c1 440251054 AMGJHOSFLPWPQU-HSZRJFAPSA-N 387.483 5.345 30 20 GKED C[C@@]1(Cc2ccccc2)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458796631 FBBQTLSEKBPNSF-UPVQGACJSA-N 375.516 5.228 30 20 GKED Cc1csc(-c2cccc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)c2)n1 464960948 LRADYWPKOMSHDG-RTWAWAEBSA-N 387.508 5.031 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)c1nnc(-c2ccc(Cl)cc2Cl)o1 466732176 YNOPQIGROIGCPI-SECBINFHSA-N 377.256 5.163 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@](C)(OC)CC1)c1ccc(C(F)(F)F)cc1 474547589 MVCUQCUMJFJBCT-AZUAARDMSA-N 398.469 5.313 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2c[nH]c3ccccc23)C(F)(F)F)c(Cl)c1 478051010 UGFBMQHXOYVUGP-MRXNPFEDSA-N 392.768 5.118 30 20 GKED Cc1csc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1Cl 479663822 SPUIGRXRCLJCTG-UHFFFAOYSA-N 396.899 5.607 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C 480541384 POEQMCYFOTZKAL-MGPQQGTHSA-N 385.455 5.133 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)C[C@H](CC#N)c1ccccc1 483324168 OVEWSZMSRDNCIO-AWEZNQCLSA-N 391.696 5.437 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(-c2ccsc2)s1 487028785 GUEJUHXKFAWCGO-UHFFFAOYSA-N 393.518 5.724 30 20 GKED Cc1ccc(NCc2ccc(-c3ccccc3C#N)cc2)cc1C(=O)NC(C)C 487402643 GEJQEXQNGZYQDB-UHFFFAOYSA-N 383.495 5.284 30 20 GKED N#Cc1c(F)cccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 488682801 HDRWLLFSXDSXKA-GOSISDBHSA-N 389.817 5.259 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(CC(F)(F)F)CC1 497329179 KOKUFQRKXZQFHU-CYBMUJFWSA-N 385.455 5.277 30 20 GKED CCN(C(=O)c1csc(-c2ccc(F)c(F)c2)n1)[C@H](C)c1ccc(C#N)cc1 502724469 GANAQQUQCSBCMT-CYBMUJFWSA-N 397.450 5.183 30 20 GKED Cc1ccc(-c2nc(C(=O)N3CC=C(c4ccc(C#N)cc4)CC3)cs2)c(C)c1 503856682 LNTHLRMGHZBYGU-UHFFFAOYSA-N 399.519 5.228 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)CSCc2ccc(C#N)cc2)cc1 504695039 MCRYUUXIFOYUPI-MRXNPFEDSA-N 384.570 5.169 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(F)cc1OCCC(F)(F)F 505791614 YOQRDPXJIANOLA-JTQLQIEISA-N 390.299 5.009 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccccc2)c2nc(-c3ccccc3)no2)cc1 506619525 QJTQIUNDNANBLQ-HSZRJFAPSA-N 397.478 5.181 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1cccc(C(F)(F)F)c1 514643533 TYQVXQMFRVVQHG-UHFFFAOYSA-N 384.810 5.102 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1 520813427 GGTVTRDGUZXFIH-AWEZNQCLSA-N 390.961 5.464 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(F)cc1F 521840983 OZDHSURZXVFJEO-UHFFFAOYSA-N 393.393 5.259 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C1CCCCC1 523623104 QUJSZNBRPDKDBS-UHFFFAOYSA-N 395.478 5.463 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F 525559395 OYUQVXAYPPIVEE-HZPDHXFCSA-N 380.419 5.307 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)c(F)c1 526051266 IFSIDNNMXGPEOD-AWEZNQCLSA-N 385.870 5.235 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)cc1OC(F)F 536838934 MXLPDIVTEBZFMJ-ZUZCIYMTSA-N 395.318 5.911 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(C#N)cc3OC(F)F)cc2)cs1 539281300 SWDJGJVSBFCCIV-CYBMUJFWSA-N 399.466 5.442 30 20 GKED CCC[C@H](C#N)NC(=O)c1sc2cccc(F)c2c1COc1ccccc1 539927237 JSZYKBARIATNEQ-CQSZACIVSA-N 382.460 5.041 30 20 GKED CSc1cccc([C@H](NCc2cccc(C#N)c2F)c2cc(F)ccc2F)c1 541293774 ZRPZGQZXVNRXOU-QFIPXVFZSA-N 398.453 5.577 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)[C@@H](C)Sc2cccc(Cl)c2C#N)cc1 543031198 JYOZNAMWJAYZGL-CYBMUJFWSA-N 386.904 5.170 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 568669600 MSXAPADFGZHEOR-WMZHIEFXSA-N 392.547 5.646 30 20 GKED Cc1ccc(Cl)cc1NC(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1 569325626 VPRFZLKEJXPYQZ-UHFFFAOYSA-N 391.858 5.363 30 20 GKED CC1(C)C[C@H](NC(=O)c2c(Cl)cc(C#N)cc2Cl)c2cc(F)ccc2O1 593813172 CFFZQULDOGLOSO-HNNXBMFYSA-N 393.245 5.036 30 20 GKED N#Cc1c(NC(=O)c2cccc(OC(F)F)c2)sc2c1CCCCCC2 603996531 VRSDFWWVFDEJDP-UHFFFAOYSA-N 376.428 5.132 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1ccc(C(C)(C)C)cc1 604044355 MEUHHIDRKFJQQQ-QGZVFWFLSA-N 379.504 5.106 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 604127028 YSVCXLIAVMHBIY-NRFANRHFSA-N 381.495 5.406 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c1 609033309 RTIOZFZHMKFYBR-UHFFFAOYSA-N 397.409 5.485 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)c1 609407718 ITZXOXSHLSMYHC-QZTJIDSGSA-N 378.378 5.055 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1sc2cc(F)ccc2c1Cl 609523729 LAVAWKANPLAPCY-HXUWFJFHSA-N 386.879 5.339 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Nc2ccccc2)c1 609820874 ONSKUMPUWYCNAJ-QGZVFWFLSA-N 387.508 6.077 30 20 GKED CCc1ccc([C@@H](C)CC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 609968391 CWINZJTXQGOUIK-INIZCTEOSA-N 388.433 5.205 30 20 GKED CCc1ccc([C@H](C)CC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 609968394 CWINZJTXQGOUIK-MRXNPFEDSA-N 388.433 5.205 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 610331182 XVQDYQDEQRBULU-UHFFFAOYSA-N 391.393 5.030 30 20 GKED N#C[C@H](C(=O)c1cc2ccc(F)cc2s1)c1nc2ccccc2n1C(F)F 613401531 CJHGEXKRTNMMDD-GFCCVEGCSA-N 385.370 5.275 30 20 GKED N#C[C@H](C(=O)c1ccc2ccccc2c1)c1nc2cc(C(F)(F)F)ccc2s1 613404998 SDQUZTPMQGAZMA-MRXNPFEDSA-N 396.393 5.958 30 20 GKED N#C[C@H](C(=O)c1cccc(Br)c1)c1nc2cc(Cl)ccc2s1 613407045 FISGAGXTFCATQQ-GFCCVEGCSA-N 391.677 5.202 30 20 GKED Fc1ccc2ncnc(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)c2c1 614305691 NFTHZGYMSOHZGL-IUCAKERBSA-N 381.295 5.090 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H]1CCc2cc(C#N)ccc21 618807237 TVKATFQOMOJDDG-XCLFUZPHSA-N 377.488 5.467 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1cc(C(F)(F)F)ccn1 643778774 NEBAXMDKJMLIGC-KRWDZBQOSA-N 397.400 5.341 30 20 GKED Cc1cccc2sc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)c(Cl)c12 643779408 TVDLTQPCXHNXEX-NSHDSACASA-N 394.805 5.767 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)Nc1nnc(C(F)(F)F)s1 664469621 NBMLMIHHMVAJAR-UHFFFAOYSA-N 375.260 5.022 30 20 GKED N#C[C@H](C(=O)c1ccnc(OC2CCCCC2)c1)c1nc2cc(F)ccc2s1 678572220 IYGXDHIBIHEQNW-MRXNPFEDSA-N 395.459 5.032 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCCCCCCN1CCCC1 725905803 GDMUGNAPYPZYFB-UHFFFAOYSA-N 389.543 5.001 30 20 GKED C=CCc1ccc(OC(=O)c2csc(-c3c(F)cccc3F)n2)c(OC)c1 726137550 ICVCJPQIIGZWNT-UHFFFAOYSA-N 387.407 5.045 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc2ccccc2c1 727994329 OGCGTPNQYKOSSD-UHFFFAOYSA-N 396.446 5.550 30 20 GKED C#CCN(C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C)C1CCCCC1 729616629 SMEOWJDAYUUHHG-MRXNPFEDSA-N 399.535 5.296 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2)cc1)c1ccc(N2CCC(O)CC2)cc1 730085914 WGEJDFJYZKZGSA-NVNXTCNLSA-N 383.491 5.211 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)-c1ccccc1C2 731333343 YMNJPWFTKASQFZ-INIZCTEOSA-N 384.504 5.904 30 20 GKED CCCCCCCCCCC(=O)N1CCC([C@H]2CCCCCN2C(C)=O)CC1 731469150 SMZHLGWPTQXQHY-HSZRJFAPSA-N 392.628 5.547 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1 733083187 DROKFUUVEWCRGT-MDZDMXLPSA-N 389.436 5.404 30 20 GKED C=CC[C@H](NC(=O)CSCc1ccc(Cl)cc1Cl)c1ccncc1 734458980 GRLSLAXKVOPITJ-KRWDZBQOSA-N 381.328 5.055 30 20 GKED C=CC[C@@H](NC(=O)N(CCC)Cc1c(F)cccc1Cl)c1ccncc1 734681329 ZHOAHMUMDQYPKR-LJQANCHMSA-N 375.875 5.113 30 20 GKED O=C(/C=C\c1cnc2ccc(Cl)cn12)c1ccc(SCC(F)F)cc1 741842068 JQOOEBNJDONYDJ-DAXSKMNVSA-N 378.831 5.241 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C\C(=O)c1ccc2c(c1)COC2 742436043 FIGLQCGAOHJISI-FPLPWBNLSA-N 399.277 5.414 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1)C(C)C 756485807 CJSUWGRDFNKKCW-UHFFFAOYSA-N 397.466 5.243 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cc(Cl)c(F)c(Cl)c2)c(Cl)c1 757641387 BHKVSYSPIFTQCR-UHFFFAOYSA-N 378.017 5.563 30 20 GKED C=C[C@@H](CC(=O)Oc1ccc(C2SCCS2)cc1OC)c1ccccc1 759188535 FRMGJCYWPSZPDQ-HNNXBMFYSA-N 386.538 5.439 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cccc(-c2ccoc2)c1 760970593 UUGXFZFIUROVEM-SFHVURJKSA-N 399.233 5.215 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccc(Cl)cc3)c2)s1 762446323 HRLPHMJQLHCRMN-WMZJFQQLSA-N 392.867 5.422 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(Cl)cc1 763922020 IBABHGNZSDLLIX-MRXNPFEDSA-N 396.922 5.059 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)CCc2ncc(C(F)(F)F)cc21 777467721 MVGNNKPHDPZCDZ-JYRVWZFOSA-N 386.398 5.436 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1 780678956 ZKXTVDMDVKJVQT-GCJKJVERSA-N 385.467 5.083 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCC1(Sc2ccccc2)CCCC1 780682840 YOCVSATYYDKFAT-QGZVFWFLSA-N 395.528 5.204 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 783074532 ILCPINPINSIRSR-OCCSQVGLSA-N 390.455 5.050 30 20 GKED C=CCC[C@@H](NC(=O)c1c(C)noc1C1CC1)c1ccc(C(F)(F)F)cc1 784083100 LJPUATFKWVVGLX-MRXNPFEDSA-N 378.394 5.317 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@]12CCN(C(=O)OC(C)(C)C)C2 789887884 GJXTYHMTBJNLKX-NTKDMRAZSA-N 398.547 5.124 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(Br)c(Cl)s2)c1 790965603 TVCFXPWRTCYHOI-GFCCVEGCSA-N 399.741 5.135 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@@H](CC#N)c1ccccc1 793770911 DPXOBLVEPPMHIY-NZQKXSOJSA-N 398.506 5.570 30 20 GKED Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(C(C)(C)C#N)cc3)o2)cc1C 796039859 SJIMEGKHBSCEMD-INIZCTEOSA-N 389.455 5.073 30 20 GKED C[C@H](OC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1 803061614 OZFGRYBRDPYBBH-LKFCYVNXSA-N 395.274 5.434 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C/c3ccc(OC(F)F)c(Cl)c3)cc12 806576571 HNLWVMXCWQWGBF-HWKANZROSA-N 382.819 5.094 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813218194 SWFHZVNUTVKPDZ-RHSMWYFYSA-N 390.405 5.176 30 20 GKED N#CCCCn1cc(C(=O)OC[C@@H]2CC[C@@H](c3ccccc3)O2)c2ccccc21 814056947 NLURKSSIXRERJH-CVDCTZTESA-N 388.467 5.022 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@H]2NC(=O)CC1(C#N)CCCCC1 855813290 YLOIIIDEJUYYIE-LJQANCHMSA-N 397.519 5.001 30 20 GKED C[C@@H](N[C@H]1CCCc2c1[nH]c1ccc(Cl)cc21)c1ccc(OCC#N)cc1 858376440 LBYYDDVVEUGXNI-SZNDQCEHSA-N 379.891 5.452 30 20 GKED Clc1ccc(CNN=Cc2ccccc2OCc2ccncc2)c(Cl)c1 914696941 WAXOWHSRUHLXMP-UHFFFAOYSA-N 386.282 5.091 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4cccc(Cl)c4)CC3)n2)cc1 915100379 PJMRCHUTCRNRII-SFHVURJKSA-N 392.911 5.680 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)[C@H](C#N)c3cc(C)nc(C)n3)c2c1 915103462 WQKORZWNIQKYJH-OAQYLSRUSA-N 392.462 5.107 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nc2ccccc2[nH]1 915351387 AGVSTZHTCLYENJ-UZLBHIALSA-N 395.466 5.101 30 20 GKED CC(C)c1ccc(C(=O)/C=C/c2cc3ccccc3nc2N2CCOCC2)cc1 916132618 LEMVSTBZSYKHET-VAWYXSNFSA-N 386.495 5.091 30 20 GKED CCCCCCNC(=O)[C@H](C#N)C(=O)c1sc2cccc(Cl)c2c1Cl 916874376 CHSQFLIRHQLDKX-LLVKDONJSA-N 397.327 5.227 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(C=NNc2ccccc2Cl)cs1 917532892 VMZXRICIVFZASI-UHFFFAOYSA-N 384.892 5.236 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(F)c(-c2cccs2)c1 917540909 XRWOFEMOJNDXSY-UHFFFAOYSA-N 394.500 5.292 30 20 GKED N#C[C@H](C(=O)Cc1cc2ccccc2o1)c1nc(-c2c(F)cccc2F)cs1 920806356 VQPNYPLCKJNXEW-CQSZACIVSA-N 394.402 5.253 30 20 GKED Cc1nn(Cc2ccccc2)c(Cl)c1C=NNc1cccc(Cl)c1F 921138014 ZKFJWMYRQXDEDO-UHFFFAOYSA-N 377.250 5.132 30 20 GKED O=C(O)c1cc(NN=CCCOc2ccc(Cl)c(Cl)c2)ccc1Cl 1776033579 CTKYYZHTPVPGIZ-UHFFFAOYSA-N 387.650 5.212 30 20 GKED Cc1c(NN=Cc2ccc(SCc3ccccc3)cc2)cccc1C(=O)O 1776087490 GCLBTNMMZYOWEW-UHFFFAOYSA-N 376.481 5.432 30 20 GKED CCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776112673 GCRGXXVNAGGGOW-WYMLVPIESA-N 376.477 5.962 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Br)c(Cl)c1 1776782736 DFGXTAXNGOFURM-AWEZNQCLSA-N 390.749 5.396 30 20 GKED CCCCCCCOc1ccc(CNCC[C@H](Cc2ccccc2)C(=O)O)cc1 1776786329 QQQFIRDWBNWGHD-HSZRJFAPSA-N 397.559 5.459 30 20 GKED CCc1c(C(=O)/C=C\c2cccc(O[C@H](C)C(=O)O)c2)oc2ccc(C)cc12 1776956206 KNNGUXVYVLEVQX-FJVVXJACSA-N 378.424 5.052 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc(F)c(C(=O)O)c(F)c3)s2)cc1 1777430635 WIVDEISEHRBCKZ-VMPITWQZSA-N 399.418 5.299 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)[C@]3(C)CC=CCC3)CCC2)cc1 1791730005 BWWJLXZFWMLVLF-XMMPIXPASA-N 392.543 5.061 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)C(=O)Nc2ccccc2Cl)n1 18535721 OSLSMEAQXYGWKM-SNVBAGLBSA-N 399.825 5.053 30 20 GKED C=CCn1c(S[C@H](C)c2nc(-c3ccccc3)no2)nnc1-c1ccccc1 53048001 JXGVFUADHPBCSP-OAHLLOKOSA-N 389.484 5.034 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1ccoc1C 67428511 QOVVGZVFXLYZFF-UHFFFAOYSA-N 384.486 5.041 30 20 GKED Cc1ccc2c(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c2c1 102122353 MGDUWIZYJNGAEI-HNNXBMFYSA-N 379.872 5.158 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)n1 106982217 QTFXAZLFJQKWNS-IEBWSBKVSA-N 382.485 5.301 30 20 GKED N#CCCSc1ccccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 108200235 WTNUKWYETJIGPB-OAHLLOKOSA-N 378.419 5.367 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 111766962 SGXFJXZPAAQWQV-RDJZCZTQSA-N 399.947 5.756 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1 133670629 BYUNXXYLSMEXFF-CQSZACIVSA-N 395.812 5.046 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3nccnc3c2)cc1 147268784 WTDIZKXXKXZUHT-UHFFFAOYSA-N 396.475 5.046 30 20 GKED CC(C)N(CCc1nccs1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 150992941 PXZVMRLJDZTLEH-HNNXBMFYSA-N 388.562 5.022 30 20 GKED N#CCCn1cc(CNc2cccc(N3CCCCCC3)c2)c(-c2ccccc2)n1 151497220 QTUMFQCRQBOXIZ-UHFFFAOYSA-N 399.542 5.456 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N(c3ccccn3)C3CCCC3)c2)c1 154552424 DOHQIGCXTNPHCQ-UHFFFAOYSA-N 397.478 5.122 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCSc2nc3ccccc3s2)n1 177776912 MWOIZHVHGFGODP-GFCCVEGCSA-N 387.555 5.235 30 20 GKED CC(C)n1cc(C#N)c(NC(=O)c2cccc(Oc3ccc(Cl)cc3)c2)n1 183138945 CWAUOVXPLWQPOU-UHFFFAOYSA-N 380.835 5.034 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 195712962 YNWLMJQKDZIPJZ-QFIPXVFZSA-N 396.487 5.532 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Cl)s1)C(=O)Nc1ccc(Cl)cc1Cl 254929729 QSYPLQKCZHATSQ-SRMRHOMVSA-N 399.686 5.069 30 20 GKED Cc1nc(/C=C/c2ccc(C#N)s2)sc1C(=O)/C=C\c1ccc(C#N)s1 255440782 NVURPHCBZXPSPS-MKKAVFGOSA-N 393.518 5.384 30 20 GKED Cc1csc([C@@H]2CCCN(C(O)=Nc3cccc(-c4nccs4)c3)C2)n1 328600275 CWXHHWKMQBRWNN-OAHLLOKOSA-N 384.530 5.000 30 20 GKED Cc1c(COc2ccccc2)cccc1N=C(O)N1CCCC2(CCOCC2)C1 329951789 CSQUOAQQDRQAEJ-UHFFFAOYSA-N 394.515 5.012 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(F)c2)cc1)c1ccc(C#N)cc1 409571819 SMBSVJGZHWPTBG-HNNXBMFYSA-N 375.403 5.372 30 20 GKED C=CC[C@H](CC)NC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 410136468 SEJUUMWMULMOBK-ZDUSSCGKSA-N 376.909 5.047 30 20 GKED C=C(C)CNC(=O)c1ccccc1SCc1ccc(Br)cc1 428108074 PMJUEYZTUJIOLR-UHFFFAOYSA-N 376.319 5.047 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 429066437 UCYIJKGAJVCZSB-ZWKOTPCHSA-N 388.298 5.325 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 431777996 FVBIQRKNDCJKNM-QAPCUYQASA-N 387.430 5.083 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(-c2cccnc2)ccc1C 432824926 UJYKUAHZVLJKFT-UHFFFAOYSA-N 382.467 5.149 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432981953 FMUDRZNUTLOKSM-JOCHJYFZSA-N 393.531 5.867 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N[C@H](c1cc(F)ccc1F)C(F)F 433221801 RPYULJOIVVMALP-CYBMUJFWSA-N 398.253 5.251 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2cccs2)n1Cc1ccccc1 436135469 WQGSUBXHPHQKGZ-UHFFFAOYSA-N 396.585 5.867 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)NCc3cc(C#N)ccc3F)c2)C1 438093089 CAZCBKHKNQICDX-IERDGZPVSA-N 395.478 5.114 30 20 GKED C[C@@H]1CCc2c(sc3nc([C@@H](C)Sc4ccccc4C#N)nc(O)c23)C1 439698512 XOCSRHSUTAUIKG-VXGBXAGGSA-N 381.526 5.247 30 20 GKED CCCc1c(NC(=O)c2cc(Cl)ccc2Cl)cnn1-c1cccc(C#N)c1 440090007 GDWMRCUOQWDGKU-UHFFFAOYSA-N 399.281 5.256 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 442675482 YVZVMPRQYLVVPN-MRXNPFEDSA-N 393.537 5.723 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1ccc(Br)s1 444102646 CQWCFQBHWNQHDB-LBPRGKRZSA-N 397.313 5.109 30 20 GKED C/C(=C\c1nc(COCC(F)(F)C(F)F)no1)c1cccc(C(F)(F)F)c1 445757787 HYBKXICPGRJBNJ-WEVVVXLNSA-N 398.278 5.066 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)cc1OC(F)F)c1ccccc1 460245886 YAZRAJNQTUONGU-AWEZNQCLSA-N 379.794 5.108 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)[C@H](C)c3cccc(C#N)c3)s2)cc1 462052404 RDYQQZLCGGAWMD-HZPDHXFCSA-N 389.524 5.280 30 20 GKED C[C@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1F 468033101 GNTSGFSIILKOAU-DJJJIMSYSA-N 395.478 5.688 30 20 GKED C[C@H](C#N)C(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 468182401 HTVSGAFGBYKPFJ-CPUCHLNUSA-N 377.875 5.016 30 20 GKED C[C@H]1CCc2c(sc3nc([C@H](C)Sc4cccc(C#N)c4)nc(O)c23)C1 468628031 PDCSEDDUDPCASZ-RYUDHWBXSA-N 381.526 5.247 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@@H](C)c1ccc(F)cc1 469436984 SQGYVURTIXVCMR-KRWDZBQOSA-N 377.463 5.307 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c(C)c1 471282347 LQQUACVQQMRYBP-IEBWSBKVSA-N 393.556 5.577 30 20 GKED N#Cc1cc(NCc2nnc(-c3ccc(Cl)cc3Cl)o2)ccc1Cl 471623864 DMSGTZFWRVFCAU-UHFFFAOYSA-N 379.634 5.181 30 20 GKED N#Cc1cccc(OCCCSc2nnc(-c3ccc4ccccc4c3)o2)c1 477519020 GYDIRYCDZMUOIX-UHFFFAOYSA-N 387.464 5.323 30 20 GKED CC[C@@H](CN(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 480537178 FVBFUNZLOSEZOG-OALUTQOASA-N 395.572 5.986 30 20 GKED CC[C@H](C)n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C 482556336 JRCDVKRCADZULW-WMLDXEAASA-N 378.501 5.085 30 20 GKED COc1ccc([C@@H](NCc2ccccc2C#N)c2ccc(C(F)(F)F)cc2)cc1 486027075 GSXSHEAPLMJWCL-QFIPXVFZSA-N 396.412 5.465 30 20 GKED Cc1ccc(-n2c(SCCCSCC#N)nnc2-c2cccs2)cc1 489671148 CSDWYDCZLMONSF-UHFFFAOYSA-N 386.571 5.043 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1nc(-c2ccccc2)c(Br)s1 492398550 YPFWLNXRQBBLEY-UHFFFAOYSA-N 398.285 5.005 30 20 GKED CCc1sc(-c2nnc(CSc3nc4c(c(C)c3C#N)CCC4)o2)cc1C 494997949 TUZIJNJKPBSCLV-UHFFFAOYSA-N 396.541 5.025 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(C)(C)C)cc2)nnc1-c1ccncc1 499349194 JCACKAUWIILYFI-MRXNPFEDSA-N 378.545 5.677 30 20 GKED C[C@H](NC(=O)Nc1ccccc1-c1nc2ccccc2s1)c1ccc(C#N)cc1 505332688 GCDZGQZAJNPJDN-HNNXBMFYSA-N 398.491 5.718 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 506012706 QHPPRLOBWMQLJB-UHFFFAOYSA-N 392.686 5.502 30 20 GKED CCN(C(=O)c1csc(-c2ccc(C)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 509556245 BPAVXOIPURAJEP-INIZCTEOSA-N 375.497 5.214 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1cccc(F)c1 510905834 SNKNSOQARRKOGJ-UHFFFAOYSA-N 389.430 5.462 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)Nc1ccc(CC#N)cc1 512115382 LDODCYUWZOCYFW-LBPRGKRZSA-N 395.812 5.254 30 20 GKED CC(C)[C@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 513664330 TWRZHXQZKOLWAS-VGOFRKELSA-N 378.472 5.130 30 20 GKED C[C@H](SCc1cccc(Cl)c1)C(=O)Nc1sc2c(c1C#N)CCC2 516344043 QKDPGZRHVGKDAJ-NSHDSACASA-N 376.934 5.022 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517125132 HBIBDNQPUDJUSY-OAHLLOKOSA-N 377.469 5.637 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518909057 JIZBUUFAAWPFSA-UHFFFAOYSA-N 396.490 5.416 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cc2c(s1)CCCC2 520940574 XZPLPZIDMOQHNY-AWEZNQCLSA-N 385.558 5.343 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2nc(-c3ccc(F)cc3)cs2)c1 521955099 RRDYPZKHMMCCSY-UHFFFAOYSA-N 395.459 5.009 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CC1 522090557 LWPLSYYUTXJKFR-UHFFFAOYSA-N 395.890 5.221 30 20 GKED Cc1[nH]nc(NC(=O)c2ccc(C#Cc3ccccc3)cc2)c1-c1ccccc1 522813608 SBPDQFMNJIABQS-UHFFFAOYSA-N 377.447 5.037 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](CC(C)C)c1ccccc1 525337881 JVFRZQGLUSRLIG-QFIPXVFZSA-N 399.494 5.822 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1cc2ccccc2s1 526957528 JGNNYNRJZURNHV-GJZGRUSLSA-N 395.553 6.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCc2noc(C)n2)cc1 530507742 YPMYJEJZCJCGTE-UHFFFAOYSA-N 391.471 5.061 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)c1 530861171 NGYDFOCMCKTHAV-UHFFFAOYSA-N 383.234 5.910 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cccc(C(F)(F)F)c3F)n2)cc1 531187592 INELLTXNFBMKGL-UHFFFAOYSA-N 391.349 5.092 30 20 GKED C[C@H](NC(=O)N[C@H]1CCCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 542076825 QLWAERAWLKJVNL-YWZLYKJASA-N 383.442 5.163 30 20 GKED C[C@@H](NCc1cn2cc(Cl)ccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 543874284 NIMCNBDZXDTIBW-MRXNPFEDSA-N 386.886 5.377 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)c1ccncn1 545446454 JZGXEFCCHNVSGS-AWEZNQCLSA-N 384.222 5.066 30 20 GKED CC(C)(CCC#N)CN[C@@H](c1ccc(F)cc1)c1ccc(Br)o1 550818649 FHANYYTYVXTJIT-KRWDZBQOSA-N 379.273 5.190 30 20 GKED C=CCOc1ccc(CNC(C)(C)c2cccc(C(F)(F)F)c2)cc1OC 556093224 GNJNXHAUGXSOOA-UHFFFAOYSA-N 379.422 5.304 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(Br)c1 559865354 SLYPKEYKPNTVRD-IFXJQAMLSA-N 375.285 5.674 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1-c1ccccn1 571381650 XMJWGGYVGOQDGM-MRXNPFEDSA-N 391.496 5.001 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(-c4ccc(F)cc4Cl)n3)cc2)CC1 574283243 OJKPSVDQJJRLAM-UHFFFAOYSA-N 391.833 5.349 30 20 GKED CSc1cccc([C@@H](NC(=O)CCCCCC#N)c2ccc(F)c(F)c2)c1 588621176 LYUADLYODDYTMT-OAQYLSRUSA-N 388.483 5.366 30 20 GKED Cc1c(C(=O)N(C)CCOCc2ccc(C#N)cc2)oc2c1ccc1ccccc12 588935449 LARICIHCKDENCH-UHFFFAOYSA-N 398.462 5.055 30 20 GKED Cc1[nH]c2ccccc2c1Cc1noc(-c2cn(CCCC#N)c3ccccc23)n1 589120919 QNEAIRQJDXAIMI-UHFFFAOYSA-N 395.466 5.376 30 20 GKED C=C(C)COc1cccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c1 589382709 YPBFHWTUXWVXAR-UHFFFAOYSA-N 396.874 5.521 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2oc3ccccc3c2COc2ccccc2Cl)C1 598414953 GPDDKKILFJVVPT-QFIPXVFZSA-N 394.858 5.041 30 20 GKED N#CC1(C[C@@H](O)CNc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)CC1 600739255 QQWHXGFBNXTQPA-CQSZACIVSA-N 399.903 5.209 30 20 GKED N#Cc1cc(F)cc(NCc2cccc(NC(=O)c3ccccc3Cl)c2)c1 600861284 NBBZMWWVSZWDJP-UHFFFAOYSA-N 379.822 5.215 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1CCC(F)(F)C1 601059749 KCESEXIKQOGSNX-ZIAGYGMSSA-N 384.517 5.188 30 20 GKED N#Cc1c(NC(=O)CCCc2c[nH]c3ccccc23)sc2c1CCCCC2 602781709 FVYMUADYEHPBAZ-UHFFFAOYSA-N 377.513 5.331 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3c(F)cccc3Cl)c2)c1 604497326 LSQVMCVJNYROGW-UHFFFAOYSA-N 380.850 5.220 30 20 GKED CC[C@@H](C)Oc1ccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1 609058587 DVDRUEVJRCVQOG-MRXNPFEDSA-N 390.439 5.160 30 20 GKED N#CCCn1cc(-c2csc(-c3ccc4c(c3)OCCO4)n2)c2ccccc21 609543840 WRYHSUMLSBRLKI-UHFFFAOYSA-N 387.464 5.117 30 20 GKED CC[C@@H]1c2ccccc2CCN1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 609625727 UKNXWQQZTJYTNG-LAUBAEHRSA-N 393.556 5.029 30 20 GKED N#CCN(C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)C1CCCC1 609976884 CCTUSMXPINZWIH-UHFFFAOYSA-N 389.474 5.201 30 20 GKED N#Cc1cnccc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 610179741 GPCOPBGXDXSEJF-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1ccc(C#N)cc1 610341246 DWQPXTYELRLKNU-LJQANCHMSA-N 395.506 5.253 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)c(Cl)c1 611432681 MMRSKFMRTGESFL-OAHLLOKOSA-N 395.673 5.162 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CNc2ccc(CC#N)cc2)cs1 611537897 RJJJNIRUJZMIBF-UHFFFAOYSA-N 390.512 5.123 30 20 GKED Cn1c(CC#N)nnc1SC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 619460725 KHQXPWRSFUYYMP-UHFFFAOYSA-N 389.311 5.070 30 20 GKED CCC1(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCC(F)(F)CC1 667004157 KTDHPMFLBCHQGH-PHIMTYICSA-N 395.334 5.181 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 726478026 DSEKNBFBCXHILW-UHFFFAOYSA-N 383.476 5.449 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2\CCOc3c(ccc(Cl)c3Cl)C2=O)cc1 728697868 YIUFTCQNNDBBNU-HLVNSREUSA-N 388.250 5.333 30 20 GKED C(=NNc1cccc2ccccc12)c1cn(-c2ccccc2)nc1-c1cccnc1 747060532 VUHGZXQZJCHQMT-UHFFFAOYSA-N 389.462 5.534 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(CSc2ccccn2)c1 751399216 QEKHEZGTBKBUOB-UHFFFAOYSA-N 391.521 5.242 30 20 GKED CC1(C)CCCC[C@H]1CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 752483523 MLDPEZUQNMKBAQ-ZWKOTPCHSA-N 377.513 5.465 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)COc2c(Cl)cc(Cl)cc21 753143522 UZBXHBBVTNQQAP-WZUFQYTHSA-N 389.263 5.171 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 756517087 LYSUPHJDZMUENM-VWILAXROSA-N 378.884 5.743 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 764205371 SQSAEGDQBRFHJG-UHFFFAOYSA-N 383.816 5.101 30 20 GKED C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 765907457 JDXRKUJAHSGSJE-MHECFPHRSA-N 399.494 5.143 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccccc2)C2CCOCC2)cc1 766023762 XURWENMULGUEGK-JPYJTQIMSA-N 385.935 5.636 30 20 GKED CC(C)(C#N)CCCCOC(=O)CCC(=O)c1cc(Cl)sc1Cl 768747460 VCCIWJMKCQHJPK-UHFFFAOYSA-N 376.305 5.281 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C/c1ccc(SCc2ccccc2)cc1 771850403 KMONDNPZPSWVEH-XSFVSMFZSA-N 394.565 5.481 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccccc2-c2cnn(C)c2)cc1 773113288 CZRDAQQVDBRFHO-KRWDZBQOSA-N 381.907 5.069 30 20 GKED C[C@@H](NCC/C=C/c1ccc(Br)cc1)c1ccc(OCC#N)cc1 775336631 OHAYSHWUUMIRBB-WPTTZPOMSA-N 385.305 5.106 30 20 GKED CC[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 775658337 NBWNIXFPTKAUFX-ZEQRLZLVSA-N 384.479 5.483 30 20 GKED Cc1ccc(C(=O)O[C@@H](C#N)C2CCCCC2)cc1NC(=O)c1ccccc1F 776374506 MYOJBKADICVZES-NRFANRHFSA-N 394.446 5.016 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C/c1ncc(-c2ccccc2)s1 787178144 KPIBWGYCIICTGX-MDZDMXLPSA-N 383.856 5.146 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nnc(-c2ccccc2F)s1 795987343 CFYTVPBAYLQSHF-GOEBONIOSA-N 395.459 5.036 30 20 GKED N#C[C@H](C(=O)[C@@H]1Cc2ccc(F)cc21)c1nc(-c2ccc(Cl)cc2)cs1 796632206 CNCFKQVMFRQSTF-IAGOWNOFSA-N 382.847 5.119 30 20 GKED N#C[C@@H](C(=O)CCc1cnc2ccccc2c1)c1nc(-c2ccccc2)cs1 796648346 AOKKDGGTRRRBQW-IBGZPJMESA-N 383.476 5.167 30 20 GKED Cc1nn(-c2ccccn2)c(C)c1/C=C/C(=O)c1ccc(SCC(F)F)cc1 802705557 KMTBYTCHWFXDNA-ZHACJKMWSA-N 399.466 5.137 30 20 GKED N#C[C@H](C(=O)c1sc2ccccc2c1Cl)c1cc(C(F)(F)F)ccn1 813216333 PQCYCBRPLJBBAV-NSHDSACASA-N 380.778 5.459 30 20 GKED Cc1csc(SCc2ccccc2C(=O)Nc2ccc(C#N)c(F)c2)n1 813258753 IZOASSKGPRAOAP-UHFFFAOYSA-N 383.473 5.007 30 20 GKED CC(=NNc1ncnc(Cl)c1C(C)C)c1sc(Cc2ccccc2)nc1C 814922112 UQWKETHRWUJXIR-UHFFFAOYSA-N 399.951 5.445 30 20 GKED N#Cc1cc(C(=O)Nc2ccc3c(c2)oc2ccccc23)cnc1C(F)(F)F 815011974 CQIIHRQCHJTRKB-UHFFFAOYSA-N 381.313 5.124 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2NCc2ccccc2)o1 815783990 ILEOKQTYGCCOKC-UHFFFAOYSA-N 385.345 5.034 30 20 GKED C[C@@H]1C[C@H](CN[C@@H](CCCC#N)c2ccccc2)CCN1C(=O)OC(C)(C)C 824434981 VLOGRZKVNWLPNP-SBHAEUEKSA-N 385.552 5.047 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1nc(C2CC2)cs1 842941023 MFUBSHCEMSWRKC-SOUVJXGZSA-N 377.296 5.307 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)sc2n1 915179415 DRSHMRZOFXTEPX-NRFANRHFSA-N 397.503 5.821 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2nccc3sccc23)cc1 915980135 NSPMGPIXYFJORB-UHFFFAOYSA-N 381.505 5.006 30 20 GKED CCCOc1c(Br)cc(/C=C\C(=O)c2ccccc2F)cc1OC 916136545 PLAIMVJURIYNHJ-HJWRWDBZSA-N 393.252 5.282 30 20 GKED Cc1cc(C)cc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 916906732 UYVXOSOLMBMYLP-HXUWFJFHSA-N 384.435 5.057 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1Cl 917045338 YABZAZJYOYHPDD-CQSZACIVSA-N 389.307 5.721 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cc(Cl)cc(Cl)c2)S1 917516287 RIFXPLKTYJFZFZ-OVCLIPMQSA-N 377.296 5.502 30 20 GKED Cc1cc(C(=O)NC2CCCCC2)ccc1N=Cc1cc2ccccc2nc1O 917556988 SSLAYUJVHXWDRJ-UHFFFAOYSA-N 387.483 5.062 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](Cc2ccc(C)cc2)C(=O)O)c1 1776788639 DUQJWYVMWDHLGN-HSZRJFAPSA-N 397.559 5.377 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)C3CCCC3)CCC2)cc1 1789451938 WZXIKDCGSYODNF-OAQYLSRUSA-N 380.532 5.079 30 20 GKED C=CCn1c(S[C@H](C)C(=O)N2CCC[C@H]2c2cccs2)nc2ccccc21 22351784 WNPBIKGPMLYVLI-QAPCUYQASA-N 397.569 5.128 30 20 GKED Cc1ccc(C)c(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2ccccc2)c1 22729831 FTSGEOAOAXUFOM-UHFFFAOYSA-O 395.573 5.320 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(NC(=O)c3cccs3)c2)cc1 25438702 SENMUWUPIQEJQP-UHFFFAOYSA-N 389.480 5.054 30 20 GKED Cc1nc2cc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)ccc2[nH]1 42060076 UPOARSZIAAUBHX-UHFFFAOYSA-N 398.491 5.288 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 46065302 RRZMWMJLGVDYCG-SFHVURJKSA-N 379.504 5.028 30 20 GKED C=C(C)COc1cc(/C=C2\SC(=S)N(c3ccccc3)C2=O)ccc1OC 60790195 GRMAMUHPDFCQDQ-UNOMPAQXSA-N 397.521 5.056 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)cs2)c(C)c1 64100333 QHHBHYDJCVVUPI-OAHLLOKOSA-N 389.505 5.527 30 20 GKED Cc1ccccc1-n1ncc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C 66802272 CSTKMPQVUAJFEL-INIZCTEOSA-N 390.512 5.136 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc2ccccc2c1 108355314 UKBVFMONLWDDQT-INIZCTEOSA-N 375.497 5.142 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1 120690133 DXLYZBWJXOIDPG-LJQANCHMSA-N 394.475 5.200 30 20 GKED N#CCCCOc1cccc(NC(=O)CCC(=O)c2csc3ccccc23)c1 123518261 XDCGPHJGGQKFRB-UHFFFAOYSA-N 392.480 5.185 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(COCc3ccccc3)cc2)cc1 151073115 HRKWSVBKCCYUMD-UHFFFAOYSA-N 385.511 5.365 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3ccccc3SCCC#N)c2)n1 151818118 ISUUNJFQWPNYET-UHFFFAOYSA-N 379.510 5.377 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1nc(C)cs1 152895972 UEWAXUUIZGKIQT-UHFFFAOYSA-N 397.887 5.436 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)on2)cc1Cl 171438454 XIUAXHMBNIODFJ-KRWDZBQOSA-N 377.831 5.113 30 20 GKED CCCN(Cc1ccccc1O)C(=O)Nc1ccccc1SC[C@@H](C)C#N 173114489 OURVXNCNVGAYEA-INIZCTEOSA-N 383.517 5.088 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 180388031 GMTDQOONMYBQNR-UHFFFAOYSA-N 381.479 5.415 30 20 GKED Cc1cnccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 188604250 FVKKAJJUNZRJFA-HXUWFJFHSA-N 390.874 5.021 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1Cl 191379354 FJNBXAXLHRGZGB-MRXNPFEDSA-N 381.888 5.472 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3F)s2)c1 236899263 NLVYNHPXUDIUIG-QGZVFWFLSA-N 380.488 5.525 30 20 GKED CCOC(=O)c1oc2ccccc2c1CNc1ccccc1S[C@@H](C)CC#N 303326465 IURHMAGAQWLORV-HNNXBMFYSA-N 394.496 5.616 30 20 GKED C=CCC[C@H](NC(=O)c1c(C2CC2)noc1C)c1ccc(C(F)(F)F)cc1 410612401 YGAOLQUGTIFWLW-INIZCTEOSA-N 378.394 5.317 30 20 GKED N#CC1(CCSc2nnc(-c3ccco3)n2Cc2ccco2)CCCCC1 413000451 OWIJTEZPIXIXLC-UHFFFAOYSA-N 382.489 5.136 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 432447973 HDYZWPQXMMLXBP-SFHVURJKSA-N 394.490 5.012 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccc(OC(F)F)cc1 434230778 JECFRMHEUFCIDY-HNNXBMFYSA-N 397.425 5.037 30 20 GKED CN(CCc1cccs1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 438023730 OLWYXVTYNYRLDT-UHFFFAOYSA-N 377.469 5.118 30 20 GKED Cc1sc(Br)c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c1C 442543501 UEWYFGLLAWRCOE-SNVBAGLBSA-N 383.336 5.197 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)[C@]1(C#N)C[C@H]1C 450005121 UVDKTQZBCBOVQW-CMJOXMDJSA-N 390.462 5.220 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1cccc(F)c1 460148273 FSZDUWXVSGOXLE-HNNXBMFYSA-N 392.405 5.158 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)oc2c1ccc1ccccc12 464429990 XISZWIMJJMKNIP-KRWDZBQOSA-N 394.352 5.798 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)Cc1cccc(C(F)(F)F)c1 473763814 UWJRPLJTNVKWDD-UHFFFAOYSA-N 397.462 5.499 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccccc1 474435691 SLRICTDTQUOXFI-RLWLMLJZSA-N 394.474 5.726 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3OCC(F)F)c2)cc1 475517453 AIFLGGHZYAHJLB-UHFFFAOYSA-N 393.393 5.198 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 475959790 VOUGPCZUKAZBSH-UHFFFAOYSA-N 393.418 5.237 30 20 GKED COc1ccc(CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)cc1OCCCC#N 478235613 SUYMRFJSBGYIAN-JOCHJYFZSA-N 394.490 5.243 30 20 GKED C[C@@H](CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C(F)(F)F 480278580 NVEOPXLPBAHDDN-NSHDSACASA-N 397.784 5.324 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2)cc1 483242515 KNFLKDRCLBOJOJ-QHCPKHFHSA-N 389.414 5.389 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)cc1 501446785 URKMUWWWHGXWNA-UHFFFAOYSA-N 376.843 5.237 30 20 GKED Cc1c(C(=O)Nc2ccccc2N2C[C@H]3CC[C@H]2C3)sc2ccc(C#N)cc12 509625001 WWMJUAHUHDJEJG-IRXDYDNUSA-N 387.508 5.322 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 510903937 VHSYTUNUVBSRKY-UHFFFAOYSA-N 399.494 5.756 30 20 GKED C[C@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1F 510971583 YLJQNHYSTLGLMV-ZJUUUORDSA-N 380.307 5.670 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3ccc(F)cc3C#N)C2)nc2ccccc21 512257138 AKWKTQFFQWQPAK-GOSISDBHSA-N 376.479 5.008 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)oc12 517801146 XQHIYTRIRZUGQP-AWEZNQCLSA-N 393.393 5.593 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)s1 518539806 SCHSGVHEXQEWNK-UHFFFAOYSA-N 391.427 5.238 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 519156535 RBZMTMBHBKEMDE-SFHVURJKSA-N 379.504 5.014 30 20 GKED C[C@@H](NC(=O)N[C@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 520416283 TVQGKZNKIBRNDD-NTKDMRAZSA-N 383.495 5.293 30 20 GKED N#CCC[C@H](C#N)CNc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 520633783 LHWXPRUTVAVXHL-GFCCVEGCSA-N 378.234 5.780 30 20 GKED COc1c(Cl)cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1Cl 521231923 OARRCSPANDTPGA-UHFFFAOYSA-N 392.286 5.316 30 20 GKED C[C@H](Nc1cccc(CSC2CCCC2)c1)C(=O)Nc1cccc(C#N)c1 525405309 CVYUSIPEFVXLHS-INIZCTEOSA-N 379.529 5.173 30 20 GKED CC[C@](C)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(F)(F)F 530615823 KPJYGWQRXOXRFK-IBGZPJMESA-N 376.378 5.006 30 20 GKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 539030883 OTMADRSJCSYFBU-UWJYYQICSA-N 377.488 5.126 30 20 GKED CC[C@H](C)[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 540386454 SULHVWNKPBNABT-XOBRGWDASA-N 380.879 5.139 30 20 GKED N#CCc1ccc(C[S@@](=O)Cc2ccc(Oc3ccccc3F)c(F)c2)cc1 542188279 UQGAASFODDMEKN-MUUNZHRXSA-N 397.446 5.272 30 20 GKED COc1ccc(C(=O)CC(C)(C)CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 545378190 NIYRQBSSKPAWOE-UHFFFAOYSA-N 392.499 5.124 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 557096391 BPFFUXARCRDYJD-UHFFFAOYSA-N 375.516 5.429 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)sc2ccc(C#N)cc12 559948892 CKQZLHAWYSCKCB-AWEZNQCLSA-N 387.464 5.227 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCc2sc(Cl)cc21 564369689 KYHVGXSNOIIODS-YPMHNXCESA-N 391.949 5.462 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 570324149 WDHFWDQUFSSRQI-QHCPKHFHSA-N 398.466 5.423 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCSC2)cc1Cl 579040065 FAYMUQDREOHANZ-HNAYVOBHSA-N 399.947 5.260 30 20 GKED Cc1c(CN(C)C(=O)N[C@H](CCCC#N)c2ccccc2)oc2c(C)cccc12 593406439 IPQMCMOPBNCPTR-OAQYLSRUSA-N 389.499 5.626 30 20 GKED N#CC1(CC(=O)Nc2ccc(OCc3cccnc3)c(Cl)c2)CCCCC1 596786664 LOAJZWSLJCZOHZ-UHFFFAOYSA-N 383.879 5.117 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)COc1ccccc1-c1ccccc1 603527383 KTOULGWPGLYCHC-UHFFFAOYSA-N 384.479 5.041 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(C(F)(F)F)CC3)cc2Cl)cc1 608786374 WCEZRWNULZVNGF-UHFFFAOYSA-N 380.753 5.285 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)ccc3F)cc2F)c1 609103824 CKLHBNJVMLDBLL-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1ccc(-c2nc(CSCC(=O)Nc3cc(Cl)ccc3C#N)co2)cc1 609236867 IAGICCGSPWAKLS-UHFFFAOYSA-N 397.887 5.047 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc(C#N)cc1 609254152 JDQQDSDOTSSJJC-LLVKDONJSA-N 383.320 5.095 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609503654 HHSLHOSYLLUYPO-KRWDZBQOSA-N 386.451 5.505 30 20 GKED CN(Cc1ccccc1N[C@H]1CCC[C@@H](C#N)C1)C(=O)c1cc2ccccc2o1 613255274 WBVMYSLPHOFPKJ-XLIONFOSSA-N 387.483 5.199 30 20 GKED COc1ccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1Br 614180086 VYOMHSNHOLLOBU-CQSZACIVSA-N 387.321 5.110 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 618805788 LAGNDRANDZZQKT-UXHICEINSA-N 389.499 5.475 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3CCc4ccccc4C3)n2)cc1 732596103 KJZNUHVHWBLRNE-UWJYYQICSA-N 386.520 5.490 30 20 GKED C=CC[C@@H](NC(=O)N(C)Cc1c(CCCC)oc2ccccc12)c1ccncc1 734682780 GAEPNYLORHNXGV-OAQYLSRUSA-N 391.515 5.629 30 20 GKED C[C@@H](c1ccccc1)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740064706 QYJZPORPTJZXFB-INIZCTEOSA-N 375.497 5.189 30 20 GKED O=C(/C=C\c1ccc(OC(F)F)c(Cl)c1)c1c(Cl)nc2sccn12 741843351 FHCPQRYDSBMLDE-IWQZZHSRSA-N 389.210 5.200 30 20 GKED COc1cc(C(=O)/C=C/c2cc(Br)c(OC)s2)ccc1SC 746520194 LSYFDOVVWRDCNY-AATRIKPKSA-N 399.331 5.146 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\c3ccnc(Cl)c3)cc2)c1 757935829 DUOIFLAOQJRYOO-WTKPLQERSA-N 375.815 5.051 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(C)ccc2F)cs1 763292075 HGADJAXTKPFTOQ-XFFZJAGNSA-N 394.471 5.480 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(OC)c(C3CC3)c2)cc1 774049577 BFHBNGQJKPNXML-YCRPNKLZSA-N 390.483 5.047 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3cc(Cl)ccc3OCC#N)cc2)cs1 775138882 RPISSARKCNCPAO-CQSZACIVSA-N 397.931 5.525 30 20 GKED C#CC[C@H](NCc1csc(-c2ccc(OCC)c(OC)c2)n1)c1ccccc1 775400026 WKWFHHWOEQYACV-FQEVSTJZSA-N 392.524 5.072 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3cccc(F)c3C)o2)C(=O)c2ccccc2C1 778519536 HPESZWJMAMSQJF-LDADJPATSA-N 389.426 5.023 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1 780669620 HKGMCKUGGFYMAG-DENIHFKCSA-N 399.494 5.125 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@H](C#N)c3nccc4ccccc34)cs2)c1 792094170 DHERXJIKNBLCHO-FQEVSTJZSA-N 383.476 5.086 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc(C#N)cc1F 794981432 MURIFUJYWFVLDK-UHFFFAOYSA-N 399.351 5.009 30 20 GKED Cc1ccc(CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(Cl)n1 806968683 MZFDDNJEHQZPOP-UHFFFAOYSA-N 395.821 5.028 30 20 GKED COc1ccc(/C=C\C(=O)c2csc(C(C)C)n2)c(OCc2cccnc2)c1 812244023 YEGFHWSEGCGRBV-CLFYSBASSA-N 394.496 5.145 30 20 GKED CO[C@](C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 813060556 DGARTPBCSAASIP-ACJLOTCBSA-N 395.311 5.108 30 20 GKED Cc1ccc2snc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2c1 815010402 LFBJWSGMRWVZCM-FQEVSTJZSA-N 383.476 5.513 30 20 GKED O[C@H](CC(F)(F)F)c1ccc(-c2cc(F)ccc2OCC(F)(F)F)cc1 854195689 JADRHYXGJZOGOL-CQSZACIVSA-N 382.275 5.420 30 20 GKED Cc1cncc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 878671436 AENBCKKMXWXYMS-VQIMIIECSA-N 380.517 5.011 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)NCc2ccc(SC)c(C#N)c2)cc1 886688586 VSEMVMVQJSMCSC-INIZCTEOSA-N 396.560 5.005 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2nc(-c3c(F)cccc3F)cs2)CCC1 899406120 JFUVBQCWOWOFNN-AREMUKBSSA-N 394.512 5.201 30 20 GKED O=C(Nc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1)c1ccncc1 914701867 QFGRLSFMMSSLAK-UHFFFAOYSA-N 386.238 5.097 30 20 GKED Cc1ccc(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 916628336 RZFXURWUXNFQEA-GOSISDBHSA-N 396.899 5.336 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccccc3Cl)n2)cc1 916650548 XKXJKFMWXUSTLY-QGZVFWFLSA-N 380.900 5.581 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cccc(Cl)c2)cc1 916948525 HOTHFNFOMQYDKS-MGPUTAFESA-N 382.891 5.134 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026892 RTDUAJOECYAREX-OXJNMPFZSA-N 390.508 5.577 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)/C=C/c1nc2ccccc2s1 918585018 RLERQTUYYDRSOJ-CCEZHUSRSA-N 395.487 5.415 30 20 GKED CC(=NNc1ncc(Cl)cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776022138 SLPILRYNNWPCIE-UHFFFAOYSA-N 390.226 5.183 30 20 GKED CC(C)[C@H](Cc1ccccc1)NN=Cc1ccc(-c2cccc(C(=O)O)c2)s1 1776055884 AHJRWOXAAAJOLY-NRFANRHFSA-N 392.524 5.304 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2ccc(C(=O)O)nc2)cc1 1776068798 ACLVINDDNKXZLS-KRWDZBQOSA-N 383.492 5.211 30 20 GKED C[C@@H]1C(=NNc2c(Cl)cccc2Br)CC[C@H](C(=O)O)C1(C)C 1776083401 DCIREVMGTVXZJE-NXEZZACHSA-N 387.705 5.027 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776326978 METAPPMFVGPOGO-UITAMQMPSA-N 394.492 5.921 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)c1 1776341404 DFLJAIAHHXRYKO-QINSGFPZSA-N 384.475 6.146 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1C(F)(F)F 1776355407 KDSZKQBVRRQBAM-CLFYSBASSA-N 378.346 5.087 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2cc(Cl)cc(C(F)(F)F)c2)c1)C(=O)O 1776470953 RFEQEZYSLDHELA-QRGHLMKCSA-N 398.764 5.107 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1sc2c(Cl)cccc2c1C 1777269401 GMLLWJPRFNMHQW-CMDGGOBGSA-N 386.856 5.466 30 20 GKED C[C@@H](NC(=O)C1(c2ccc(Br)cc2)CCCC1)c1ccc(C#N)cc1 33180090 DORCYAWOOOGCIJ-OAHLLOKOSA-N 397.316 5.010 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cnn1C(C)(C)C 51156689 DZWVKDNUYMVTOC-OAHLLOKOSA-N 398.919 5.214 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)cc1 56720232 XFVGYNJDJARTGC-QHCPKHFHSA-N 399.494 5.125 30 20 GKED CCc1nc2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc2o1 58564843 IXJBEJPDBMKXBY-UHFFFAOYSA-N 399.475 5.665 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(/C=C\C(=O)c3ccc(C#N)cc3)c2)cc1 96766303 ZETCIVGEOMYJRF-SFGFDRCGSA-N 388.426 5.222 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(OCc2cscn2)c1 107377676 YFVFEDOPLNPLRH-UHFFFAOYSA-N 385.514 5.004 30 20 GKED N#C[C@H](C(=O)c1nccc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 113656876 VHJQFHOJDKZZDD-CQSZACIVSA-N 391.402 5.127 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 121624347 QVIXPBMTJITTMR-QFIPXVFZSA-N 391.902 5.222 30 20 GKED Cc1ccsc1[C@@H]1C[C@@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 129595006 SQQWGSOLUNTMQL-GVDBMIGSSA-N 389.505 5.032 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)c1cccc(Cl)c1Cl 157954972 ZTLQNKZJJMDIMP-CDMKHQONSA-N 379.209 5.043 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(CSc2cccc(C#N)c2)cs1 158734507 XQGZFBYEBZIPER-UHFFFAOYSA-N 383.473 5.131 30 20 GKED CC(=O)N(c1nc(CN(CCC#N)CCC(C)C)cs1)c1ccc(C)cc1C 166249094 XXKNPUGZQBXJMJ-UHFFFAOYSA-N 398.576 5.206 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1ccccc1SCCC#N 172996024 UVRIBLUGMJRLHT-UHFFFAOYSA-N 375.291 5.016 30 20 GKED N#Cc1ccc(-c2nnc(COc3c(Cl)cc(Cl)cc3Cl)o2)cc1 174063288 VKHXQYNYIRIQSD-UHFFFAOYSA-N 380.618 5.147 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)Nc1ccccc1O[C@H](C)C#N 182032650 OIYBMXZSXXLBII-OAHLLOKOSA-N 392.480 5.357 30 20 GKED Cc1ccc(SC2(C(=O)Nc3ccccc3O[C@H](C)C#N)CCCC2)cc1 182038903 GYOGGTLXFNMRFD-QGZVFWFLSA-N 380.513 5.330 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2csc(-c3ccc(F)c(F)c3)n2)n1 183380440 VBKNHCSNVJJWHK-NSHDSACASA-N 389.452 5.158 30 20 GKED N#CCCN(C(=O)c1cnc(-c2ccsc2)s1)C12CC3CC(CC(C3)C1)C2 185094489 TVZJAWROGVADQT-UHFFFAOYSA-N 397.569 5.196 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCC(C)(C)CCC#N 195038737 HKJIAUDUVKNWRI-UHFFFAOYSA-N 380.366 5.156 30 20 GKED N#C[C@H](C(=O)CC/C=C\c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl 255071653 YRZAGJDUZRIYAE-LWAXHKBTSA-N 387.266 5.134 30 20 GKED CC(C)(C)Sc1ccc(NCc2cn(CCC#N)nc2-c2ccncc2)cc1 278710802 RTLZTEWTWRPVLS-UHFFFAOYSA-N 391.544 5.361 30 20 GKED CC(C)COc1ccc(C2(/C(O)=N/[C@H]3CCC(O)=NC34CCC4)CCC2)cc1 328732281 HBFNENQVFCAGED-IBGZPJMESA-N 384.520 5.141 30 20 GKED O/C(Cc1c[nH]c2ccc(Cl)cc12)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329486593 GHUSJBAIGGZOAS-HXUWFJFHSA-N 396.922 5.710 30 20 GKED C[C@H]1C[C@H](/N=C(/O)C[C@H]2C[C@@H](C)CC(C)(C)C2)c2ccsc2S1(=O)=O 329624897 HTSKGWASXHTMSM-CTASWTNQSA-N 383.579 5.164 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1cccc(C(F)F)c1 425085065 LCNBJZOEDLDDMG-CYBMUJFWSA-N 396.359 5.126 30 20 GKED Cn1cc(CNc2ccc(C(C)(C)C(F)(F)F)cc2)c(-c2ccc(C#N)cc2)n1 428540735 BACBBUCOJKHGMI-UHFFFAOYSA-N 398.432 5.411 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc4nc(C5CC5)oc4c3)cc2)nc1 430491304 ZBRJVIXTNVRHIY-UHFFFAOYSA-N 396.406 5.016 30 20 GKED N#CCCC[C@@H](NCC(=O)Nc1cccc(Oc2ccccc2)c1)c1ccccc1 433013382 XJKXGWVDAHIKJE-XMMPIXPASA-N 399.494 5.442 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(C(C)C)n(-c3ccccc3)n2)n1 435805824 CQVSTSSVVGHADL-INIZCTEOSA-N 378.501 5.066 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccccc2)n1Cc1ccco1 436118012 KWOUQTGGHQXPAF-UHFFFAOYSA-N 380.517 5.399 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444017783 GHPNLZZPXBQXTQ-AWEZNQCLSA-N 380.332 5.083 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc3c2CN(c2nccs2)C3)CCCC1(C)C 444927699 ZLWFBFFACVJPND-LJQANCHMSA-N 396.560 5.262 30 20 GKED CCc1c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cnn1C(CC)CC 455279542 MAPCPYNLWJIDQT-IBGZPJMESA-N 381.524 5.363 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=O)N[C@@H](CCCC#N)c1ccccc1 458807931 YFWXPAOFZVEVAG-IBGZPJMESA-N 390.314 5.570 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Oc2ccccc2)ccn1 465125036 BQWWADPKEFOYET-MRXNPFEDSA-N 389.480 5.378 30 20 GKED Cc1cc(C(=O)N(C)CCC#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 465395084 ODBOAOPCPKONLY-CQSZACIVSA-N 390.314 5.461 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNC(=O)Nc1ccc(C(C)(C)C#N)cc1 466395070 GPDDDFLJXKYICF-UHFFFAOYSA-N 375.394 5.137 30 20 GKED C=CCC(CC=C)C(=O)N(CC=C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 468545253 XWCDZBLUKYVVOK-UHFFFAOYSA-N 383.473 5.006 30 20 GKED CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2cccc(C#N)c2)no1 468959144 KQJSLHTWMUPDTO-RBBKRZOGSA-N 385.467 5.012 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 474978986 NXDXJNCYFHBWQI-FQEVSTJZSA-N 399.332 5.013 30 20 GKED N#CC[C@H](CC(=O)N1CCSC[C@H]1c1ccc(Cl)cc1)c1ccccc1 476055385 VUUNMGIIIXTSQP-QUCCMNQESA-N 384.932 5.044 30 20 GKED N#Cc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)c(Br)c1 481137018 HEODKWXXRXDMFA-UHFFFAOYSA-N 395.222 5.118 30 20 GKED C=C(C)[C@@H](NCC(=O)Nc1cccc(Cl)c1Cl)c1ccc(F)c(F)c1 481589650 AKGAUXUXXAFZLZ-GOSISDBHSA-N 385.241 5.117 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)CSc1ccc(C#N)cc1 482414998 OGWROHIPJQZQJU-UHFFFAOYSA-N 392.446 5.106 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1cccc(F)c1 483236631 PFYKEOLPTZAXBH-FQEVSTJZSA-N 398.441 5.002 30 20 GKED CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccnc(C#N)c1 483308859 JWAHYQCEYRDXQY-JOCHJYFZSA-N 391.421 5.025 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC[C@@H]1C(F)(F)F 483796930 WQFWFCKVYBEGLU-ZDUSSCGKSA-N 393.331 5.019 30 20 GKED Cc1c([C@@H](NC(=O)N(C)Cc2ccc(C#N)cc2)C(C)C)oc2ccccc12 483830056 NOSQJPCIGGNXQE-NRFANRHFSA-N 375.472 5.152 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 487600851 HAJXBNYADAIFMA-UWVAXJGDSA-N 387.310 5.648 30 20 GKED C=CC[C@@H](C(=O)N(C)Cc1ccc(OC(F)F)c(OCC)c1)c1ccccc1 488621110 CIVAVMRNVIKDCB-GOSISDBHSA-N 389.442 5.005 30 20 GKED CSC[C@@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 494198969 RKOQFIAIQJQNMU-PKOBYXMFSA-N 399.947 5.355 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 498446720 ODOZHZNUYJYLNW-MOPGFXCFSA-N 386.417 5.119 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 504769819 IZRVNZZLOFGXDK-UHFFFAOYSA-N 380.831 5.344 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCc3sccc3[C@H]2c2cccs2)c1 506046294 UGOGRVUFAZYGDG-SFHVURJKSA-N 384.913 5.123 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCOc1cccc2ccccc12 512671120 VDNOMEBMCPHYLS-UHFFFAOYSA-N 392.458 5.187 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)cc2)o1 512748516 ITCVNILWPJIITC-UHFFFAOYSA-N 391.446 5.392 30 20 GKED Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)Nc1cccc(OCCCC#N)c1 513207362 XYTFOGVPKSBMPG-MRXNPFEDSA-N 385.895 5.160 30 20 GKED C=CCN(C(=O)C[C@@H]1CCO[C@@H](C(C)C)C1)c1nc(-c2ccccc2)cs1 514152027 QTPNUONIUJLQLH-YLJYHZDGSA-N 384.545 5.170 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1SCCC#N)c1ccc(C(F)(F)F)cc1 518120213 VHFVXFHQWKCGNJ-AWEZNQCLSA-N 392.446 5.843 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)cc1 519485119 FZJOHUFVZRMEPU-OALUTQOASA-N 388.433 5.401 30 20 GKED CSCc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 520315699 IYJBNZCFFHEUBP-UHFFFAOYSA-N 388.492 5.660 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(ccc3ccccc32)[nH]1)c1cccc(C(F)(F)F)c1 521016248 UXOKMJJVRYDYBX-HXUWFJFHSA-N 393.368 5.335 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 521257974 ODZJBKXANIFWSI-SJLPKXTDSA-N 379.529 5.268 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521954892 GCMSEPROJRZQII-OAHLLOKOSA-N 391.858 5.232 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 523111299 KPIHZQIRASATFF-INIZCTEOSA-N 388.433 5.194 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H]1CCCC[C@H]1C 524442604 SYTSHAGQBOAJNR-UZUQRXQVSA-N 391.515 5.488 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccccc1F 532490255 SZGNSHOJGPIAJZ-KRWDZBQOSA-N 399.535 5.069 30 20 GKED Cc1cnc(-c2cccc(NCc3cccc(OCc4cccc(C#N)c4)c3)c2)o1 532892442 SUNNYBZHUQCEEK-UHFFFAOYSA-N 395.462 5.713 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@@H]1COc2ccccc21 533630716 WPCHFDVWMGPRJM-AOMKIAJQSA-N 399.450 5.037 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C)c1ccccc1 533923357 DWFHMZQFZFQNJT-IBGZPJMESA-N 399.494 5.937 30 20 GKED CC(C)C[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 540343860 NPMBTIGDCNOXRT-RXVVDRJESA-N 395.572 5.396 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)c1ccccc1 541241398 GNXAYRHWNBJDIX-GOSISDBHSA-N 395.462 5.721 30 20 GKED CC(C)(C)[C@@H](NC(=O)N1CCC(CC#N)CC1)c1cccc(C(F)(F)F)c1 543823453 QUWSBKSQSKGQFZ-KRWDZBQOSA-N 381.442 5.128 30 20 GKED N#CC(CCN1CCC=C(c2cccnc2)C1)(c1ccccc1)c1ccccc1 564294668 GRSJMOKZGFLTIA-UHFFFAOYSA-N 379.507 5.071 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccc([C@@H]2CCOC2)cc1 564778045 YWXRNDUMJSTILC-DOTOQJQBSA-N 381.501 5.086 30 20 GKED N#Cc1ccc(CNc2ccccc2OCc2cscn2)c(C(F)(F)F)c1 578943073 AXPUMXWVNNGHEQ-UHFFFAOYSA-N 389.402 5.225 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(Oc3cccnc3)cc2)cc(OC)c1O 583028133 HIXSVQLIWRWNHT-KRWDZBQOSA-N 390.483 5.167 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)C1 596699117 ALFCVXXHHUGVJN-OAHLLOKOSA-N 385.920 5.649 30 20 GKED CCOc1ccc(-c2nc(COc3ccc(C#N)cc3OCC)cs2)cc1 597269334 RIDDUKTZSKLYKV-UHFFFAOYSA-N 380.469 5.058 30 20 GKED N#C[C@H](C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1nc2cc(Cl)ccc2s1 603846710 NCOKTQISBVRXPD-GFCCVEGCSA-N 397.799 5.094 30 20 GKED CCCn1ccc2cc(NC(=O)c3ccc(COc4ccc(C#N)cc4)o3)ccc21 609059792 PINSRLDSMSLZBJ-UHFFFAOYSA-N 399.450 5.347 30 20 GKED CSCc1c(C(=O)Nc2ccccc2SCCC#N)oc2ccccc12 609375842 BLMMWGUGEBHNHC-UHFFFAOYSA-N 382.510 5.554 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)CCCCOc2cccc(C#N)c2)C2CC2)o1 609500305 ASIXYCAOPMGPPI-VGOFRKELSA-N 392.499 5.015 30 20 GKED N#CCCCOc1cccc(NCc2cn(Cc3ccccc3)c3ccccc23)c1 609634143 LJYAVPXRNOOTNK-UHFFFAOYSA-N 395.506 5.984 30 20 GKED C[C@H](NC(=O)Nc1cccc(CSC2CCCC2)c1)c1ccc(C#N)cc1 610143839 TZGJUPJDMBMHID-INIZCTEOSA-N 379.529 5.617 30 20 GKED C[C@H](CC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccccc1C(F)(F)F 610174092 HRZQRKQOKSKMFS-LLVKDONJSA-N 398.331 5.311 30 20 GKED CCSc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320231 VBMZGLDMBREQNR-INIZCTEOSA-N 398.940 6.066 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)s1 613346753 PTYWLUHAWGNAEQ-GFCCVEGCSA-N 393.320 5.977 30 20 GKED Cc1c(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)oc2ccc(F)cc12 619125043 GFQLEQKHFMCKMK-UHFFFAOYSA-N 399.306 5.664 30 20 GKED N#Cc1cc(OCC(=O)Nc2ccccc2-c2ccccc2)ccc1C(F)(F)F 619266377 OTWAVAONOJDNKJ-UHFFFAOYSA-N 396.368 5.262 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)NCc1ccc(C#N)c(Cl)c1 619789815 SAXNUAROFVADPG-INIZCTEOSA-N 396.922 5.221 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1 620593389 LYMIPYWLQXGBNO-UHFFFAOYSA-N 383.797 5.110 30 20 GKED O=C(Nc1cc(C(F)F)ccc1Cl)c1c(F)cc(C(F)(F)F)cc1F 637592701 ILXXKRMJGFXLGD-UHFFFAOYSA-N 385.666 5.827 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)nc([C@H](C)CC)nc1C 653760225 MBGSMNCDQYPJDZ-MRXNPFEDSA-N 379.548 5.640 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Cl)c1SC(F)F)c1ccc(C#N)cc1 726078370 GKETZKZOHCLMTJ-SNVBAGLBSA-N 381.835 5.409 30 20 GKED C=C(C)COc1cccc(NC(=S)Nc2cc(OCC)ccc2OCC)c1 727282835 FEHBZGSJDNHZRZ-UHFFFAOYSA-N 386.517 5.248 30 20 GKED COc1ccccc1/C(C)=C/C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 727627245 DHLNBJOUTWJKQQ-RZXPCSSPSA-N 382.872 5.238 30 20 GKED CC(=NNc1cncc(Cl)n1)c1c(F)cccc1O[C@@H](C)c1ccccc1 730144964 LULPXBAZKLVCIO-AWEZNQCLSA-N 384.842 5.245 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 730685499 HGNZFYWNFGMLRM-GUYCJALGSA-N 383.278 5.597 30 20 GKED CC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1c(Cl)nc2ccccn12 737427651 PBRVUFCPHPUKLP-UHFFFAOYSA-N 384.270 5.334 30 20 GKED O=C(/C=C/c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cncc(F)c1 737445108 WBEDONSSRXOTBT-XVNBXDOJSA-N 398.777 5.471 30 20 GKED O=C(/C=C\c1cnc2ccc(Br)cn12)c1cccc(Cl)c1Cl 740765694 NQCRBWBBBJDMHS-WAYWQWQTSA-N 396.071 5.300 30 20 GKED C#Cc1cccc(N(C(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)C(C)C)c1 741186201 RFKOYUUQHQTELV-RTBURBONSA-N 387.401 5.112 30 20 GKED Cc1cccn2c(/C=C\C(=O)c3cc4cc(Br)ccc4o3)cnc12 741471140 IVKCQUGWLPYHMR-WAYWQWQTSA-N 381.229 5.048 30 20 GKED C/C(=C/C(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccccc1C(F)(F)F 741919221 LVJZOFQASRFPPQ-FLIBITNWSA-N 396.315 5.220 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(C#N)c1 743095486 KOVUMUUBHVSHBP-HXOBKFHXSA-N 380.451 5.096 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)cc1C(F)(F)F 743216535 SPRLXXFEGYHHCZ-KRWDZBQOSA-N 395.331 5.224 30 20 GKED C#Cc1cccc(NC(=O)N2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)c1 748940602 HDTSMSKIJJQCQP-OAQYLSRUSA-N 399.494 5.815 30 20 GKED CCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 749048307 MAYCDUVIBHUUNB-SMDDNHRTSA-N 381.328 6.119 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1cc(Cl)ccc1OCC#N 754360205 AGDFEOPVAKRVCT-FQEVSTJZSA-N 396.943 5.686 30 20 GKED C[C@@H](CSc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 756277015 VLCUKYDWZBYNNI-NHYWBVRUSA-N 388.464 5.179 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 758220315 FXOLBZWTDCBHLR-BDTNDASRSA-N 393.556 5.480 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=S)Nc1ccccc1C#N 759127935 KIYGPADCELVYHV-HNNXBMFYSA-N 392.553 5.380 30 20 GKED C[C@@]1(c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)CCCO1 763317797 DHZGEODTOJQKRZ-FQEVSTJZSA-N 381.819 5.080 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc(Cl)c2ccccc12 766633246 DGZBLOJFXLWETH-CYBMUJFWSA-N 381.888 5.535 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ncoc2-c2ccc(F)cc2)cc1 769863766 WPTVUBQUBLXSIK-NRFANRHFSA-N 397.409 5.388 30 20 GKED Cc1nc2ccccc2n1CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772160683 DJQQNBGRIRBCPB-JOCHJYFZSA-N 394.478 5.029 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCCn1ccc2cc(Cl)ccc21 780155681 AEEJYPGDVILZFY-HNNXBMFYSA-N 381.863 5.004 30 20 GKED CSc1cc(Br)ccc1/C=C/C(=O)c1ccc(C#N)cc1F 781107582 IEVJUYKIZVDWLR-QPJJXVBHSA-N 376.250 5.078 30 20 GKED N#CCOc1cccc(NC(=O)c2cccc(F)c2Sc2ccccc2)c1 781137668 WOQRAFMWFJMILK-UHFFFAOYSA-N 378.428 5.132 30 20 GKED CC(=O)c1ccc(NC(=S)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782203136 CKFPBKWDGJMZHF-INIZCTEOSA-N 399.519 5.475 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccc(CC)cc3)n2)CCC1 791564200 BZIMQFYGLNLNSH-UHFFFAOYSA-N 398.528 5.180 30 20 GKED N#C[C@H](C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1nccc2ccccc12 792096402 OORROFSUJVLEPQ-SFHVURJKSA-N 398.359 5.301 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@@H](CC#N)c1ccccc1 793770895 DPXOBLVEPPMHIY-NFBKMPQASA-N 398.506 5.570 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1ccccc1C(F)(F)F)CC1CC1 795095154 FEBAQFGXWAOCNI-UHFFFAOYSA-N 389.446 5.186 30 20 GKED C#C[C@@H](NC(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C)c1ccc(Cl)cc1 810185119 LTJOCGNNLDPLKS-GOSISDBHSA-N 397.906 5.129 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(-c3ccccc3)cc2F)cnc1C(F)(F)F 814978329 AKWHFGNHEOXWLT-UHFFFAOYSA-N 385.320 5.030 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1c(F)ccc(SCC2CC2)c1F 839321792 PHBHMPNSFLLBJN-LBPRGKRZSA-N 388.439 5.010 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c(C#N)c2[C@H]1C 839391392 YOJWHIUSOIVLPR-YUMQZZPRSA-N 398.290 5.399 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(C#N)cc2)CCCC1 859286247 LMPXPPQIQIQEOZ-KRWDZBQOSA-N 389.524 5.261 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(F)ccc2F)cc1OCc1ccccc1 916134149 FAKANTBMMUSKEY-YRNVUSSQSA-N 380.390 5.449 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1OC(F)(F)F)c1ccc2ccccc2n1 916849606 YHPAMQAFDAQTHS-DMIOIOJGSA-N 382.341 5.023 30 20 GKED O=C(Nc1ccccc1)c1cccc(CON=Cc2ccccc2C(F)(F)F)c1 917394619 JNGXBBJOVAIKAN-UHFFFAOYSA-N 398.384 5.508 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)[C@@H](C#N)c1nc2ccccc2o1 917509828 BAQZVCMHWTVVLB-SWNWVQGVSA-N 384.435 5.806 30 20 GKED CN(C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)c1cccc(C#N)c1 920346067 IJUTYVRGOTYGIV-UHFFFAOYSA-N 397.865 5.703 30 20 GKED C=CCCC[C@H](NCc1ccccc1Oc1cc(Cl)cc(Cl)c1)C(=O)O 1776207272 KJHQIUKIMTURSI-SFHVURJKSA-N 394.298 5.685 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)o2)cc1)c1ccccc1 1776469409 KOZKYMKAGWRLBI-MWJAZUTPSA-N 388.419 5.414 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cc1)C(=O)O 1776469864 WPTQURNFDHBJSW-OEWWAVFSSA-N 378.449 5.163 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccccc1Br 1776785346 XZJZDSLHKIFHMH-IBGZPJMESA-N 398.385 6.037 30 20 GKED CCOc1ccc(NC(=O)[C@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)cc1 15336582 DGQFZBFUKJXLOW-KRWDZBQOSA-N 386.451 5.030 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2cccc(C)c2)cc1 55011634 ABIZODIWBMQYPR-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(C(C)C)cc3)n2)nnc1C1CC1 60384006 ROZFYDVCAOWRMU-UHFFFAOYSA-N 396.585 5.881 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1ccc(SCc2csc(C)n2)cc1 106422503 ACTAATNZTKCMMJ-UHFFFAOYSA-N 387.574 5.336 30 20 GKED N#Cc1ccccc1/C=C(/Cl)c1nc2scc(-c3ccccc3)c2c(=O)[nH]1 120755080 LZCAPHXIPLOZMQ-LICLKQGHSA-N 389.867 5.260 30 20 GKED C=C[C@H](CC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)c1ccccc1 158401761 YOGNYEZZIUSOJJ-QGZVFWFLSA-N 381.903 5.121 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)Nc1ccccc1O[C@@H](C)C#N 182032631 OIYBMXZSXXLBII-HNNXBMFYSA-N 392.480 5.357 30 20 GKED C[C@H](CSCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 183337465 ZLEJGFRFWOLDQK-IAGOWNOFSA-N 384.570 5.414 30 20 GKED CC1(C#N)CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CC1 272534717 NQGAPGPERSYSLO-UHFFFAOYSA-N 389.474 5.059 30 20 GKED Cc1cccc2c1OCC[C@H]2/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 330012197 KEVKDGAAIPYDSM-WIYYLYMNSA-N 393.531 5.282 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(CCCC1(C#N)CCOCC1)C1CC1 410348045 GYLXWWVOMIXLNC-MRXNPFEDSA-N 380.454 5.331 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](CC(F)(F)F)C2)cc1 434157068 JPIVQJFBCHVPJE-CQSZACIVSA-N 389.377 5.157 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)[C@@H]1CC[C@@H](SCC)C1 437104252 OATPLAQSWNTAJZ-HUUCEWRRSA-N 387.467 5.016 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1 438368471 BLBUUUZXPXLGEH-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)O1 439212230 FWVIIRCDAZGNOK-BEFAXECRSA-N 398.890 5.077 30 20 GKED C=CCN(C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C1CC1 444036373 SWZBELQDLABRBA-AWEZNQCLSA-N 380.332 5.059 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1cccc(C)c1 447632821 PNTUMWMSHYJJFJ-OAQYLSRUSA-N 394.478 5.172 30 20 GKED C[C@]1(F)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 454486909 OUAHQHYHTOMGJB-NQIIRXRSSA-N 385.870 5.351 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CCc2ccsc2)c1 460336176 ALYQCBYBUVETAG-UHFFFAOYSA-N 380.900 5.439 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 464949995 FZVUXWWGNNVRFV-BURNTYAHSA-N 398.428 5.107 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc4ccsc34)n2)cc1 467837862 CMKYYQHNOWDTIM-KRWDZBQOSA-N 390.489 5.523 30 20 GKED COc1cccc([C@H](C)CCCC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 468998162 LIVNQHRBANPWNK-CTUHWIOQSA-N 390.527 5.267 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 470644431 NXCQSSRPHPPVQG-UHFFFAOYSA-N 398.506 5.182 30 20 GKED CCS(=O)(=O)CCCCCSCc1ccc(-c2ccccc2C#N)cc1 473786245 OOZRYAIEHMKRIF-UHFFFAOYSA-N 387.570 5.063 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnc3ccccc3c2C(F)(F)F)n1 474433944 OICCXUGYNUYHEN-LBPRGKRZSA-N 389.402 5.324 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccccc1 474596181 RCLVQZLMYGIGRH-CQSZACIVSA-N 396.796 5.307 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 475547435 LGDTYNSIWRINQI-OAQYLSRUSA-N 382.935 6.561 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1oc2ccccc2c1C 479362411 OZUBTZBLVSXIAX-INIZCTEOSA-N 393.443 5.108 30 20 GKED CC(C)(C#N)CCCSCc1coc(-c2ccc(Br)cc2)n1 480361572 HDLVBHPADPBAAJ-UHFFFAOYSA-N 379.323 5.667 30 20 GKED C[C@@H](CC#N)NC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 480812125 OXXQIHDBTFRFSS-NSHDSACASA-N 381.329 5.060 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cncc(Cl)c2Cl)cc1 480818691 UZAPBYWDUOHVNJ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C[C@@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1cc2ccccc2o1 482125867 WBBUDVPQONWHIO-CQSZACIVSA-N 387.464 5.094 30 20 GKED CC1(C)C[C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccc(F)cc2O1 483033577 ZVECUUFVQGFSAK-GOSISDBHSA-N 381.451 5.051 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)cc1 483314930 GJVJBZKPQIYFJQ-UHFFFAOYSA-N 389.886 5.383 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1nc2ccccc2n1C(C)C 486807215 FPJKUOJFCRSDCP-MRXNPFEDSA-N 379.529 5.386 30 20 GKED CN(Cc1cn(C)nc1-c1ccc(C#N)cc1)C1c2ccccc2-c2ccccc21 490377221 WNTPBYUXABEMHL-UHFFFAOYSA-N 390.490 5.161 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC(C)(C#N)CC3)o2)cc1 509405739 KHSLSVUZJHFLMD-UHFFFAOYSA-N 385.467 5.083 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)C(=O)N(Cc1ccccc1)Cc1ccccc1 509653195 NQKAEQJLUSIWEM-LJQANCHMSA-N 386.520 5.268 30 20 GKED C=CCn1c(SCc2ccc(SC(C)C)cc2)nnc1-c1cccnc1 510277104 LEFOCPULALHSGB-UHFFFAOYSA-N 382.558 5.319 30 20 GKED CCN(C(=O)Cc1c(F)cccc1C#N)[C@@H](c1ccccc1)c1ccc(F)cc1 510662572 CWGXYGOPRVLYAO-DEOSSOPVSA-N 390.433 5.017 30 20 GKED C=CCn1c(SCc2cccc(C#N)c2F)nnc1-c1ccc(Cl)cc1 513247924 ZFZYFNWGHANQHK-UHFFFAOYSA-N 384.867 5.088 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(Cl)cc2[nH]1)c1ccc(Cl)c(Cl)c1 517605339 SURKUUWTGVYRCJ-MRXNPFEDSA-N 378.646 5.123 30 20 GKED CCCc1ccc(C(=O)CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 519423976 MFLOUPRCDCZIQV-KRWDZBQOSA-N 394.540 5.492 30 20 GKED Cc1ccc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)cc1OCC(F)F 520557538 UZSGAXYWXUBGJC-UHFFFAOYSA-N 395.274 5.188 30 20 GKED CSc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)nc1 522636987 BMTXMPIJOSXPJO-UHFFFAOYSA-N 395.871 5.373 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H]1c1c(F)cccc1Cl 525394490 STGZBKRLXWEZIS-XLIONFOSSA-N 399.897 5.074 30 20 GKED C=CCn1c(SCC(=O)c2cc(C)c(F)c(C)c2)nnc1-c1ccc(F)cc1 525518834 WKSBMRXURDLSIY-UHFFFAOYSA-N 399.466 5.001 30 20 GKED COc1ccc(C[C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccc(OC)cc2)cc1 538397700 SWQDKMGSOIWQMX-IQGLISFBSA-N 386.495 5.210 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)CC2)cc1 540418821 ZQPDBFPUVFVJBU-UHFFFAOYSA-N 390.792 5.160 30 20 GKED CCC(CC)n1c(COc2ccccc2Cl)nnc1SCC1(C#N)CC1 540857288 CHEIEPKJAIJUPJ-UHFFFAOYSA-N 390.940 5.267 30 20 GKED Cc1csc([C@H](C)NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542021051 YABAOWDWUGLJDS-HOTGVXAUSA-N 390.512 5.112 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)c(C(F)(F)F)c1 544444853 ZQWSOJLADFXXIE-UHFFFAOYSA-N 382.769 5.270 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N(CC(C)C)c2ccc(C#N)cc2)cc1 544738490 ZCBBJFZGXWTBJU-UHFFFAOYSA-N 376.500 5.299 30 20 GKED Cc1ccc(COc2ccc(CN3CCC(C#N)(c4ccccn4)CC3)cc2)cc1 548857835 HIRDCBJPLVIEDH-UHFFFAOYSA-N 397.522 5.026 30 20 GKED C[C@@](C#N)(NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)C1CCCCC1 555904257 LUJRZBUUTFSIDB-NRFANRHFSA-N 383.879 5.120 30 20 GKED CSC[C@@H]1CCCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 561901104 QRGVLXFIADISPM-LJQANCHMSA-N 396.581 5.066 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCCC1(C)C 562098269 WOLYNQWZCUQKHM-NRFANRHFSA-N 390.487 5.344 30 20 GKED C[C@@H](NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccc(C#N)cc1Cl 563681030 DLIIGDLHQDNXAF-GFCCVEGCSA-N 388.323 5.839 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccoc1C(F)(F)F 573533143 BGSMJBXBDRQLJT-UHFFFAOYSA-N 391.189 5.588 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SCCCOc1cccc(C#N)c1 576380680 LJDZALIHPLWGAI-SFHVURJKSA-N 396.556 5.519 30 20 GKED C[C@@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccccc1OC(F)F 576554697 UHAXYCPXYZUKEU-MRVPVSSYSA-N 395.274 5.076 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@]4(CCSC4)C3)cc2)cc1 577352429 REFIJAGSRJOQOP-QFIPXVFZSA-N 393.512 5.102 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 589791059 GUNCHNTUZAELJU-KBMIEXCESA-N 395.506 5.519 30 20 GKED COc1ccc([C@H](NCc2ccc(C3(C#N)CC3)cc2)c2ccccc2OC)cc1 594935897 LGPLEZPVJDVPOQ-VWLOTQADSA-N 398.506 5.138 30 20 GKED COc1ccc(COc2cccc(F)c2)cc1N[C@@H](C)c1cccc(C#N)c1 600848105 GSRHHWCPVSUYOD-INIZCTEOSA-N 376.431 5.458 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1ccccc1SCc1ccco1 604485876 NPOFGFIOOSAXMO-UHFFFAOYSA-N 388.492 5.272 30 20 GKED CC(C)Oc1ncc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 609427725 GSMYPJMLJQBAEV-CYBMUJFWSA-N 389.908 5.169 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc3c[nH]nc3c2)c1 609729498 GIYYDKSYEDIPCJ-UHFFFAOYSA-N 388.814 5.133 30 20 GKED COc1ccc(-c2csc3ncnc(N[C@H](C)c4cccc(C#N)c4)c23)cc1 610340440 WOVVUPMVMYKFGL-CQSZACIVSA-N 386.480 5.412 30 20 GKED Cn1ccnc1-c1cccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 610910217 LIUAXNBDHNDGFZ-UHFFFAOYSA-N 394.478 5.150 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 618801352 AGXLFPMNMDAWIT-AUUYWEPGSA-N 389.480 5.533 30 20 GKED O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC(c2cccc(C(F)(F)F)c2)C1 622661762 QYTQIHZZYSWVFK-UHFFFAOYSA-N 391.286 5.103 30 20 GKED C=CC[C@@H]1CCN(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)C1 626323313 ZTXJNTHMECPPGK-MRXNPFEDSA-N 397.906 5.047 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)o1 626369632 JYPGKIIRENLZAH-LLVKDONJSA-N 387.226 5.269 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC[C@H]2CCC[C@@H]21 646439168 NSOOETGEYDHYRI-MFKMUULPSA-N 398.322 5.382 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)C1CCCCC1 726322287 UGAIZYXKUXJYCO-SWLSCSKDSA-N 381.303 5.247 30 20 GKED Cc1nc(C)c2c(C)c(C=NNc3ccc(OCC(F)(F)F)cc3)sc2n1 727262653 UARMGAUFTDUHKL-UHFFFAOYSA-N 394.422 5.004 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(OCc2cccc(F)c2)c(F)c1 728449539 KYVZLIPRMPGBCB-UHFFFAOYSA-N 395.434 5.224 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2ccccc2SCCC#N)c1Cl 730952968 HDYFSBPGNGETRX-UHFFFAOYSA-N 396.368 6.117 30 20 GKED C=C1CCN(C(=O)c2cc(-c3nc4ccccc4s3)nc3ccccc23)CC1 731052046 CIJSCNCNYPWHMV-UHFFFAOYSA-N 385.492 5.304 30 20 GKED C[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 734080688 ZTYLVGLPHUHYKZ-BXUZGUMPSA-N 380.435 5.708 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3C)o2)cc1NC(C)=O 734304814 XFSSFZSLVFVRCM-TWGQIWQCSA-N 393.414 5.257 30 20 GKED CC(C)c1cccc(NC(=O)CSCc2cc(Cl)ccc2OCC#N)c1 735320563 XWNRUTGKXBERRJ-UHFFFAOYSA-N 388.920 5.238 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1 736001887 MHULNXCTALUALJ-QHCPKHFHSA-N 393.446 5.178 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(Br)cc3)c2)s1 740012113 WSJKMRGKZMNZPP-UHFFFAOYSA-N 383.314 5.339 30 20 GKED CCOc1c(Cl)cc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc1OC 741845437 WCFPUTWZOJLBHI-SNAWJCMRSA-N 397.283 5.006 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(OCC(F)F)cc3)c2)s1 742371998 LWRBQQHCFGDLTB-UHFFFAOYSA-N 384.451 5.220 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1/C=C/C(=O)c1ccc2c(c1)COC2 742434122 CSNODSQLCDFROD-CMDGGOBGSA-N 399.277 5.414 30 20 GKED Cc1cc(C(=O)N[C@@H](CCC#N)c2ccccc2)cc(C)c1OCc1cccnc1 749046483 WTJWGZOBMLLHKO-QHCPKHFHSA-N 399.494 5.052 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 749341951 GFWWBMNTVVDEEO-PIFJCSEESA-N 397.334 5.255 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)Nc3ccc(F)cc3C#N)cs2)cc1 751295079 WXGLDOUEPZWXHT-UHFFFAOYSA-N 379.460 5.125 30 20 GKED CC(=NNc1nc(O)c2ccccc2n1)c1ccc(-c2ccc(F)cc2)s1 757584487 XZNPBZPRXZDRBS-UHFFFAOYSA-N 378.432 5.039 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2ccccc2[C@H](O)C(F)(F)F)cc1 758110467 WTFAPRUAKYZZMD-NRFANRHFSA-N 382.385 5.433 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 758220323 FXOLBZWTDCBHLR-YPAWHYETSA-N 393.556 5.480 30 20 GKED N#Cc1c(F)ccc(/C=C\C(=O)c2cc(Br)ccc2F)c1Cl 761478389 FMNUZGOOAWHFGI-KXFIGUGUSA-N 382.591 5.148 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCO[C@H](c2cccc(C#N)c2)C1 761756423 HTWXCMULEJGSQP-BTYIYWSLSA-N 393.874 5.001 30 20 GKED C[C@@H](C=Nn1cnnc1SCc1ccc(Cl)cc1)c1cccc(Cl)c1 763359658 QYAPEHREDGDGPB-ZDUSSCGKSA-N 391.327 5.515 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)[C@H](C)c1ccccc1C(F)(F)F)c1ccncc1 766800810 REJCWVCAVWNKAA-KHYOSLBOSA-N 391.437 5.209 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(OCC(F)(F)F)cc2)c1 772982690 FITXWYLQKDYAKK-CRAIPNDOSA-N 392.421 5.159 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccnn1C1CCCCC1 775585688 HFSYTRGCJCEOEP-UHFFFAOYSA-N 378.929 5.323 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 776877928 KUCFAUIFBCASBK-UHFFFAOYSA-N 398.528 5.872 30 20 GKED N#CC1(c2ccc(COC(=O)c3ccc(C4SCCS4)cc3)cc2)CC1 777145870 JZTKCWLOOQHPLP-UHFFFAOYSA-N 381.522 5.077 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@H](O)c1ccc(-c2ccccc2)cc1 777194318 YNCWAWMIGGHMCF-QFIPXVFZSA-N 389.520 5.095 30 20 GKED O=C1/C(=C/c2scnc2C2CC2)CSc2ccc(Br)cc21 782326626 CKDMYOIYCHWCNN-BJMVGYQFSA-N 378.316 5.155 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(OCC(C)C)cc2)cn1 792867009 SMQRQSRKTKOHCG-MDWZMJQESA-N 388.467 5.083 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(C(=O)N(C)C)cc2)c(C)n1C1CCCCC1 792924659 OEEXBGXMHIHKHV-CCEZHUSRSA-N 378.516 5.208 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc(Cl)cn1 794979715 PYIOBBNJLIJSGS-UHFFFAOYSA-N 391.784 5.047 30 20 GKED N#C[C@@H](C(=O)CCSCc1ccccc1)c1nc2cc(Cl)ccc2s1 796653012 XBJOVOWAZXBLOX-HNNXBMFYSA-N 386.929 5.449 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)ccc2c1 797571329 QLZYMVQWZRWPKY-SMTIMMHKSA-N 390.508 5.492 30 20 GKED C=CC[C@H](NC(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1)c1ccncc1 798414356 LLLGZZIOEHWGGL-IBGZPJMESA-N 387.886 5.023 30 20 GKED COc1ccc2cc(NC(=O)c3cn(CCCC#N)c4ccccc34)ccc2c1 804308441 BWMVZJXLLFBNDZ-UHFFFAOYSA-N 383.451 5.359 30 20 GKED O=C1/C(=C/c2ccc(-c3c(F)cccc3F)o2)C[C@H](C(=O)O)c2ccccc21 806559563 CJRGEELSUHLWHK-TYZQSYOASA-N 380.346 5.063 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc([N+](=O)[O-])c1Cl 809915421 QLSCNAKASIERNZ-UHFFFAOYSA-N 386.260 5.183 30 20 GKED CC(C)c1ccc(C(=O)Nc2sccc2C(=O)NCC(C)(C)CCC#N)cc1 813703699 IRYUUMJTZRWHKA-UHFFFAOYSA-N 397.544 5.184 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NOCc2ccccc2)cs1 839421777 MARINBAJOJKRDI-UHFFFAOYSA-N 385.876 5.032 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1SCCC(F)(F)Cl 863239840 MMFWBIFGOWRUSP-UHFFFAOYSA-N 394.274 5.010 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)nc1)c1ccc(N2CCCCC2)c(F)c1 917142390 BUERFTKZUJHUHI-XFXZXTDPSA-N 387.458 5.169 30 20 GKED N#C[C@H](C(=O)CN1Cc2ccccc2-c2ccccc21)c1nc2ccccc2s1 917144251 DDXIKKGGRJNROI-LJQANCHMSA-N 395.487 5.160 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1cccc(-c2nnc3n2CCC3)c1 918541444 HFYGQLUTYIJYHF-UHFFFAOYSA-N 383.540 5.106 30 20 GKED C[C@@H]1CCc2c(sc3nc([C@@H](C)Sc4ccc(C#N)cc4)nc(O)c23)C1 1652612673 KOBNFIRJCANJEB-VXGBXAGGSA-N 381.526 5.247 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(C3CCCCC3)cc2)cc1CC(=O)O 1776132936 JVRYIXFAWCTAPT-LCYFTJDESA-N 378.468 5.266 30 20 GKED C=C(C)C[C@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(Cl)c1)C(=O)O 1776137589 VNBSOPDVAFUVCC-KRWDZBQOSA-N 398.261 5.434 30 20 GKED C=CCOc1ccc(CN[C@@H](CC(=O)O)c2ccc(C(C)C)cc2)cc1Cl 1776183692 RWSYYUPUOJKLAD-FQEVSTJZSA-N 387.907 5.334 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2cncc(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269197 DKJVKYMAWCCPOB-VOTSOKGWSA-N 377.484 5.197 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1)C(=O)O 1776469866 WSRRDLBCBAJFBH-CNRJSHIUSA-N 396.439 5.302 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)cc1 1776700061 SKYWCADNUIVXFG-PRWOLLLXSA-N 387.273 5.557 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)ccc1OC1CCCC1 1776782878 JVYKYSQDEXBPRL-IBGZPJMESA-N 395.971 5.955 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cc(C(=O)O)cs1 1777487706 HLMOHZJFOHCDKL-SREVYHEPSA-N 389.885 5.428 30 20 GKED N#Cc1ccc(OCC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 6221192 VEADTCZMYODCGS-UHFFFAOYSA-N 378.815 5.021 30 20 GKED N#Cc1ccccc1Oc1nc(-c2cccnc2)nc2sc3c(c12)CCCC3 15209838 ZYWPHDNZFFARDA-UHFFFAOYSA-N 384.464 5.296 30 20 GKED Cc1sc(NC(=O)c2cccc(CC#N)c2)nc1-c1ccc(OC(F)F)cc1 49604227 ARXFRNBRLRZMHG-UHFFFAOYSA-N 399.422 5.038 30 20 GKED CCC[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 60577504 NLTJEYCSNMSXAE-IBGZPJMESA-N 390.314 5.548 30 20 GKED COc1ccc(CNCC(C)(C)c2cccc(Cl)c2)cc1OCCCC#N 64614595 KZYIYIHWZWKHKC-UHFFFAOYSA-N 386.923 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 66680345 GRKDFWXOVFAPPX-ROUUACIJSA-N 393.556 5.771 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccnc(Oc2ccccc2)c1 66800930 KZGWBMIWXXAEQW-INIZCTEOSA-N 389.480 5.520 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCCN(C)c1ccccc1 66955985 HQBFPIABNLPPJE-GOSISDBHSA-N 396.560 5.119 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 103006269 SIFHLAORTZLJQO-UHFFFAOYSA-N 394.377 5.513 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Br)c(F)c1 108237940 HTLJOFRROOUHPS-NSHDSACASA-N 393.281 5.092 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccc(F)cc2OCC#N)c1 135294378 GMZINQUPQCOYCV-HXUWFJFHSA-N 381.451 5.186 30 20 GKED N#Cc1c(F)cccc1Sc1nnc(-c2ccncc2)n1C1CCCCC1 152336297 QDFJXCDTJQEWJC-UHFFFAOYSA-N 379.464 5.007 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 183466594 OTHCDLAXLBMRHC-GFCCVEGCSA-N 389.402 5.077 30 20 GKED CC(=O)N1CCc2c(sc3nc(C(C)C)c(C#N)c(-c4ccc(C)cc4)c23)C1 185003394 PHVZHFCYHKOICS-UHFFFAOYSA-N 389.524 5.171 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCNC(=O)c1ccc(Cl)cc1 189886540 GLRBUDOJLZVWBA-UHFFFAOYSA-N 398.934 5.341 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c(Cl)c1 191558856 LHAHJPMMMWMOKF-UHFFFAOYSA-N 390.870 5.546 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CSCc2coc(-c3ccccc3)n2)cc1 193400668 MFCTZHQHTHFZJU-UHFFFAOYSA-N 391.496 5.015 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3F)o2)cc1 247705444 CZJVOQOAFDLEIM-UHFFFAOYSA-N 397.409 5.466 30 20 GKED CCc1ccc(C(=O)/C=C\c2csc(N(C(C)=O)c3ccc(C)cc3)n2)s1 255495290 FUQUJWWAMGVIIC-XFFZJAGNSA-N 396.537 5.656 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1nc(-c2ccccc2Cl)cs1 277827129 JQQOATJFXOQTCR-XMMPIXPASA-N 380.966 5.432 30 20 GKED CC(C)[C@@H](/N=C(/O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)c1ccc(Cl)cc1 328686538 GJDNAMAAICOQTQ-SFHLNBCPSA-N 398.938 5.005 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](C#N)c1ccc(C(C)(C)C)cc1 328850177 YZSJEFHOUWKOGL-SJLPKXTDSA-N 397.544 5.213 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2sccc2SC)cc1 409913438 WPHCILJOKHDJIV-UHFFFAOYSA-N 396.493 5.395 30 20 GKED N#CCCC[C@H](NCc1cc(Br)cc2cccnc12)c1ccccc1 433010857 DCLCQFWWHIPFJZ-FQEVSTJZSA-N 394.316 5.522 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccccc1 435597653 KTWHSXCPEYYWMC-HXUWFJFHSA-N 375.472 5.787 30 20 GKED C[C@@H](SCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 437277590 QURMNNGQYQBJRT-LLVKDONJSA-N 390.295 5.909 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)CNc1ccc([C@@H](C)Sc2ccccc2)cc1 439550466 NHIHJCCLKAJOCL-VGOFRKELSA-N 381.545 5.006 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 460013151 NPODTXWFLCSTSY-UHFFFAOYSA-N 377.469 5.058 30 20 GKED CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H](c1ccc(C)cc1)c1cccnc1 463821286 XXNMXTZAIJMCLO-NTKDMRAZSA-N 383.495 5.003 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 464162168 YJVUFDJKLXTWHI-NRFANRHFSA-N 381.863 5.062 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1 466274274 VFOQVGXKQGUSGW-SFHVURJKSA-N 398.316 5.015 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 471164523 GRBIUJVKISZUCZ-UHFFFAOYSA-N 396.343 5.661 30 20 GKED CC(C)c1cccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)n1 474884944 CEKOATSLRWCXCN-LBPRGKRZSA-N 383.423 5.097 30 20 GKED CC(C)c1nccn1Cc1cccc(NC(=O)C[C@H](CC#N)c2ccccc2)c1 474897308 CLNJONQULRUWKM-NRFANRHFSA-N 386.499 5.081 30 20 GKED C=CCn1c(SCc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1cccs1 481330453 DTWQRXYGMFOWFX-UHFFFAOYSA-N 392.893 5.047 30 20 GKED N#Cc1cc(NC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)ccc1F 481681078 BVEXXPXHNOZXFR-SFHVURJKSA-N 385.851 5.323 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C)c1ccccc1 488711592 HKYXZEADMKOMPQ-RXVVDRJESA-N 378.516 5.212 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2C)nc2c1cnn2C(C)C 488847613 BITXIXFCEAWWGW-SFHVURJKSA-N 388.515 5.168 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)NCC(C)(C)CCC#N)cc1 498031097 XSFZKRUYFQDFPK-KRWDZBQOSA-N 379.504 5.052 30 20 GKED N#CC1(CCCN2CCC(F)(c3ccccc3C(F)(F)F)CC2)CCOCC1 499936637 OTYLFSUVUXSVFV-UHFFFAOYSA-N 398.444 5.067 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)N3CC=C(c4ccc(C#N)cc4)CC3)o2)cc1C 502529155 NCCTUXKASUMRIB-GOSISDBHSA-N 384.483 5.075 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)[C@H]2CCCC(F)(F)C2)cc1 503170931 XNJOWJASQZPBOV-IBGZPJMESA-N 386.417 5.052 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SC[C@H]3CCCCO3)n2)o1 504549201 UDIWGLULPXJNNF-GFCCVEGCSA-N 382.407 5.202 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1cccc(COCc2ccco2)c1 505000352 CRYZOWOQMZBOPA-UHFFFAOYSA-N 376.456 5.759 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 505364513 RCOINOIGQCSSSK-KSFYIVLOSA-N 389.886 5.361 30 20 GKED C[C@@H](Nc1ccc(C#N)cc1F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 506834418 WDIYNCQJAWEHFR-CQSZACIVSA-N 377.394 5.262 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1 509610527 XLFSHVPQVJKAGT-UHFFFAOYSA-N 388.254 5.386 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCc1ccccc1C(F)(F)F 513119787 DEZIESJYGGETRN-UHFFFAOYSA-N 394.396 5.217 30 20 GKED N#C[C@H](C(=O)c1cc(Br)cc2ccccc12)c1nc2ccccc2o1 519347448 BSKUOSYFOQGZOW-MRXNPFEDSA-N 391.224 5.234 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccccc2)s1)c1cccc(Cl)c1Cl 520888849 WROGNHXONPPJRO-CQSZACIVSA-N 388.279 5.112 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCSc1ccccc1 521746489 KVFBRZPIOJPPGW-INIZCTEOSA-N 385.558 5.242 30 20 GKED Cc1ccc(SCCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 521768836 JKQBMKYNCIMFIM-MRXNPFEDSA-N 379.312 5.165 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2sc3c(c2C#N)CCCCCC3)cs1 524009782 GVILSHSDZAQBAQ-UHFFFAOYSA-N 387.574 5.214 30 20 GKED C[C@H](CC#N)N(C)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525054678 DOIDVJWRGSBGEJ-CYBMUJFWSA-N 393.339 5.660 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)c(F)c1 538509219 HJCMBOBLWVMUKL-QMHKHESXSA-N 384.458 5.024 30 20 GKED N#CCC[C@H](NC(=O)N1CC=C(c2cccc3ccccc23)C1)c1ccccc1 542738310 FOECDMKUCWBBPE-DEOSSOPVSA-N 381.479 5.293 30 20 GKED CC(=O)c1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 543056843 AAYJOYCTBCODJZ-KRWDZBQOSA-N 380.856 5.156 30 20 GKED C[C@H]1C[C@H](CCNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C[C@@H](C)O1 548974216 LNURUHCGCYZPBS-IZZQQSIFSA-N 393.487 5.066 30 20 GKED Cc1ccc(C)c(-n2ncc([C@H](C)N[C@@H](CCCC#N)c3ccccc3)c2C)c1 550835689 LYKBARIJKCBTGB-RDPSFJRHSA-N 386.543 5.883 30 20 GKED N#CCCC[C@@H](N[C@H]1CCCc2nc(-c3ccccc3)sc21)c1ccccc1 551207643 BHIGIQXUEUISCG-RTWAWAEBSA-N 387.552 6.212 30 20 GKED Cc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 553404296 WGFPIGVBFKXBHM-MRXNPFEDSA-N 381.545 5.390 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)cc2)c1 565333950 FWSMNFKWHLCKAZ-GOTSBHOMSA-N 381.435 5.774 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@H](Cc2ccccc2)C(F)(F)F)CC1 565923879 QYAOBAOKIORRJQ-HWELCPFYSA-N 386.461 5.401 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CCC(c3ccc(F)c(F)c3)CC2)c(Cl)c1 586827784 HXORZKSFAJJSOU-UHFFFAOYSA-N 395.236 5.163 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c2ccccc12 603624179 UWXXGRIBZZUJHC-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n[nH]1 609164569 QPRUMEGNHHSRGJ-QGZVFWFLSA-N 378.863 5.094 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCC(C)(C)c1ccccc1 609398176 JIVQDWWXIGDIGZ-QGZVFWFLSA-N 381.545 5.428 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)Cc1ccccc1 609772466 CPDUOCKZSVJWKU-QGZVFWFLSA-N 381.545 5.471 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1 609982358 QPWFAHMHQVVJBF-FQEVSTJZSA-N 398.506 5.149 30 20 GKED N#Cc1cc([N+](=O)[O-])cnc1S[C@@H](c1ccccc1)c1ccc(Cl)cc1 610304723 ZAIRQKPKIIIWDV-SFHVURJKSA-N 381.844 5.397 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610349137 ZSFICBJEQYBUCI-HOCLYGCPSA-N 390.512 5.112 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC1CC1)c1ccccc1 610405132 WXZQBWVLGXXXTF-QHCPKHFHSA-N 375.516 5.267 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1ccc2ccccc2n1 613290287 BHFZTOQSPUXTPA-INIZCTEOSA-N 389.867 5.502 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3coc(C4CCCCC4)n3)cn2)cc1 614395608 NBCQJVVDMATGTD-UHFFFAOYSA-N 388.427 5.034 30 20 GKED C=CCCO[C@H](C)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 620574659 GERDMPXWMMOPCN-KUHUBIRLSA-N 378.299 5.180 30 20 GKED C#CCOc1ccc(NC(=O)c2ccc(CSc3nc(C)cs3)cc2)cc1 731013402 POQZIEUTXCKSBX-UHFFFAOYSA-N 394.521 5.008 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(SC(F)F)c3)cc2)nc1 731986168 IIUPJXWSGKNPBF-UHFFFAOYSA-N 397.406 5.313 30 20 GKED N#Cc1cccc(OCCCCC(=O)OCc2c(Cl)ccc3cccnc23)c1 732396859 JXTZPSGVYYTEJH-UHFFFAOYSA-N 394.858 5.052 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1C)c1ccncc1 734679857 KKHOXZPUJHUTSQ-XMMPIXPASA-N 385.511 5.419 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)Cc3ccc(OCC#N)cc3)s2)cc1 739923776 LEKADKIFPAZNBJ-GOSISDBHSA-N 391.540 5.522 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2(c3cccc(F)c3)CC2)cc1 740435974 YQFPPQXNLMBSHK-JOCHJYFZSA-N 385.442 5.292 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093055 KZRVWSBIFCDSOI-DQEYMECFSA-N 397.522 5.827 30 20 GKED CCCOc1ccc(C=NOCc2csc(-c3ccc(C)o3)n2)cc1OC 744180757 ZGUNZKXOAMKJPA-UHFFFAOYSA-N 386.473 5.060 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)Nc1ccccc1F 745724408 QIFLKBPLNFUKLX-UHFFFAOYSA-N 393.462 5.549 30 20 GKED C=CC[C@@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccncc1 745827260 IMNVGEXHLLQWHL-GOSISDBHSA-N 389.421 5.096 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(F)c(CSC)c2)cc1 747109316 OZGCUCJMGGWGIG-IFXJQAMLSA-N 398.503 5.163 30 20 GKED Cc1cccc(N=C2NN=C(c3cc(C)n(CC(F)(F)F)c3C)CS2)c1C 749955545 RFDZDGOKOFCEDL-UHFFFAOYSA-N 394.466 5.012 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C=C(/C)c1cccc(Cl)c1 750684312 PVPXRMUPIGVHBC-LFDGNKEFSA-N 394.902 5.216 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(C=O)c2)cc1Cl 754989831 SSKYYFVVTAAYON-SFHVURJKSA-N 380.856 5.122 30 20 GKED C=CCc1cc(C(=O)Nc2ccc(N3CCCCCC3)cc2)cc(OC)c1OC 761739805 SRNUSDDIXDVUMK-UHFFFAOYSA-N 394.515 5.065 30 20 GKED C[C@H](N[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772959306 KUNCZVAZAJKALV-JYJNAYRXSA-N 376.422 5.451 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 780359417 VSWHQECIWMYZDM-QGZVFWFLSA-N 396.487 5.513 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Cl)c(Br)c1 780587612 XNQDVWOKDNCMPN-SNVBAGLBSA-N 394.656 5.037 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCCc1cccc(-c2ccccc2)c1 780677355 FZRMMTADIKYWDN-SFHVURJKSA-N 385.467 5.009 30 20 GKED Cc1nc(F)ccc1/C=C\C(=O)c1sc(/C=C/c2ccc(F)nc2C)nc1C 782331283 VRKUHHJONVTWGX-USRDNGHPSA-N 397.450 5.203 30 20 GKED C#CCC1(C(=O)Nc2ccc(NC(=O)N3CCCCCC3)cc2)CCCCC1 788502346 SZOHWFUTQHTPPC-UHFFFAOYSA-N 381.520 5.007 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(-c3ccco3)s2)ccc1SC(F)F 789126505 FZCSDXAQUYAAOS-AATRIKPKSA-N 393.436 5.623 30 20 GKED N#CC[C@@H](CC(=O)OCc1csc(Nc2ccccc2)n1)c1ccccc1 795981053 LGXQMQXCENYSFJ-KRWDZBQOSA-N 377.469 5.017 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 796745495 KYNHNDCDUYKYEB-HXUWFJFHSA-N 382.419 5.344 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2ccccc2F)cs1 812460333 OTIDGKUPWPZJQL-UHFFFAOYSA-N 388.855 5.066 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1 825979818 GXALJIBDKYWURQ-UHFFFAOYSA-N 399.491 5.198 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@H]2C 839388598 KKZKEBIMSCPVLJ-GHMZBOCLSA-N 390.940 5.068 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(N)ccc1C)c1ccc(C(F)(F)F)cc1 841317218 UXIUAXUCQIUZPM-KRWDZBQOSA-N 377.410 5.425 30 20 GKED C[C@@H](OC(=O)CCCCC#N)c1cnc(-c2ccc(Br)cc2)s1 846931412 XIEUDVOQMNWCMD-GFCCVEGCSA-N 393.306 5.261 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)C1 855258700 BWTGLRXYWGNTDG-AWEZNQCLSA-N 395.915 5.383 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)C1 855258901 DOHFYNYNJWNJGO-MRXNPFEDSA-N 389.886 5.321 30 20 GKED COc1cc(N=Cc2cc3ccccc3nc2O)ccc1NC(=O)OC(C)(C)C 915982723 AAWJXLVOGFYRBS-UHFFFAOYSA-N 393.443 5.047 30 20 GKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1cccc([N+](=O)[O-])c1 916136623 YNZXOBYXRIPQSR-CSKARUKUSA-N 376.393 5.361 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCSc3ccccc3F)n2)cc1 916975352 YFVHFCDOIWCWIR-MRXNPFEDSA-N 396.512 5.616 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)Nc3ccc(F)cc3)cc2Cl)cc1 917600148 KDRZKBODCCTCIH-UHFFFAOYSA-N 397.862 5.952 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccccc3Cl)n2)cc1 920138342 FDXMYRZDLCXFIF-KRWDZBQOSA-N 396.899 5.281 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccccc3Cl)n2)cc1 920138343 FDXMYRZDLCXFIF-QGZVFWFLSA-N 396.899 5.281 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NNc1ccc(Cl)cc1Cl 1776029664 LGJBPJBHQISNHQ-CYBMUJFWSA-N 395.286 5.266 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)cc1CC(=O)O 1776131884 SXTCTNDRNXCUGT-CLFYSBASSA-N 396.439 5.086 30 20 GKED C[C@H]1/C(=C\c2cccc(C(=O)O)c2Cl)C(=O)c2cccc(Br)c21 1776587100 QEGYLAQDSMBOAX-ITTMYVLYSA-N 391.648 5.184 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(SC(F)(F)F)cc1 1776784735 OQLBCFPHRPLRQS-OAHLLOKOSA-N 377.472 5.592 30 20 GKED CCCCn1c(S[C@@H](C)C#N)nc2scc(-c3ccc(F)cc3)c2c1=O 9357244 TZEBXDRFNARIMB-LBPRGKRZSA-N 387.505 5.068 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)cc1 22731025 HSABITGDJILOMI-UHFFFAOYSA-O 395.573 5.266 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-n2ccnc2)cc1 29910466 ACONELDKSYOPJW-UHFFFAOYSA-N 396.475 5.147 30 20 GKED N#C[C@H](C(=O)c1sccc1-c1ccccc1)c1nc2ccccc2n1C(F)F 41559637 YZSITRVJYLPDHL-OAHLLOKOSA-N 393.418 5.650 30 20 GKED CCN(C(=O)c1cc(-c2ccccc2Cl)on1)[C@H](C)c1ccc(C#N)cc1 47446855 CDVOXBGTSMQOTC-CQSZACIVSA-N 379.847 5.090 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc2ccccc2n1C(F)F 51656214 KXSAEEZPEICJGW-CYBMUJFWSA-N 394.406 5.045 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1ccc2ccccc2n1 51897445 AENRAORWTVMIJU-HNNXBMFYSA-N 389.867 5.502 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)NC(C)(C)C)[n+]2ccc(C(C)(C)C)cc2)c1 55014059 IJRUCJYNMAQINX-UHFFFAOYSA-O 397.608 5.215 30 20 GKED Cc1nc(NC(=O)C[C@@H](C)c2ccc(C(F)(F)F)cc2)sc1SCC#N 57388896 UZRQBFBTTOAFPY-SNVBAGLBSA-N 399.463 5.218 30 20 GKED C=CCn1c(S[C@@H](C)CCc2ccccc2)nnc1-c1ccccc1OC 59739863 MAWWIEJCTPYJAR-KRWDZBQOSA-N 379.529 5.253 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1ccc(Cl)cc1Cl)c1ccccn1 65489549 BVIHRLAPSXENPN-OAHLLOKOSA-N 383.234 5.671 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2cc(OC)ccc2OC)c1 72093578 WYEOPGPLVWJQBG-OAQYLSRUSA-N 396.487 5.028 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2cc[nH]c2c1 102728955 DZUGTNIDIRJPOT-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CCSc2ccc(C)c(C)c2)cc1 111020363 ASVJFRGNKPRQEW-UHFFFAOYSA-N 382.529 5.131 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3cccc(C)c3)n2)cc1 124340962 XFKGLLLDSQETEO-HNAYVOBHSA-N 376.481 5.107 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 128177401 MOUBQNLHWNOUMU-UHFFFAOYSA-N 378.419 5.440 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccco1 150974401 KFXPRHSWNBEZIR-AEFFLSMTSA-N 383.517 5.823 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 154259100 GXDSSSXWOFDCCV-UHFFFAOYSA-N 389.455 5.060 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2sc(C(C)C)nc2C)ccc1OC 180813886 TVYIRQWFHTZEQA-RHSMWYFYSA-N 387.549 5.115 30 20 GKED C=CCn1c(SCc2ccc3ccccc3n2)nnc1-c1ccccc1F 216103424 HXRSRQHXBSTTIM-UHFFFAOYSA-N 376.460 5.111 30 20 GKED CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccccc2O[C@H](C)C#N)o1 248574988 SSAVYPXJIXCZJU-MDZRGWNJSA-N 381.476 5.138 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(F)cc2)CCCC1 303319610 TUXPZQOIXILXSD-MRXNPFEDSA-N 382.504 5.528 30 20 GKED Cc1nc2cc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)ccc2o1 329506868 ZSFWMMZRHMUQIT-INIZCTEOSA-N 378.476 5.231 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2ccc3c(c2)oc2ccccc23)no1 329515848 DHEWKTMNNZVWOI-SFHVURJKSA-N 390.443 5.440 30 20 GKED Cc1cc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cnc1N1CCCC[C@@H]1C 330019069 UNHJTJONYICSCX-IVMQYODDSA-N 398.551 5.282 30 20 GKED 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CN(CCC#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)c(Cl)c1 475107812 LTHUCZLLFIDKPV-UHFFFAOYSA-N 383.662 5.425 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc2c1OCCCO2 475562595 OFADCINNSQXBJB-UHFFFAOYSA-N 380.488 5.022 30 20 GKED C=CC[C@H](C)NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 477451307 IZWSTPDPMOEHIX-YQSVLCHSSA-N 397.403 5.190 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1scc(C)c1Cl 480044835 RCNKPSNDKYLSEL-UHFFFAOYSA-N 396.899 5.721 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)c(Br)c1 481192902 BIFMNTYSWVNQSE-SFHVURJKSA-N 375.697 5.215 30 20 GKED CCCN(Cc1ccc(OC)c(OCCCC#N)c1)[C@H]1CCCc2cccnc21 482277085 UDGWHBZKGJZSPJ-NRFANRHFSA-N 393.531 5.062 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)c(F)c(C)c3)n2)cc1 490717313 FBWLFZDSQSDYQN-KRWDZBQOSA-N 380.444 5.065 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)cc1OCC(F)F)c1ccccc1 497528818 FAOYDRXRKMYGTH-OAHLLOKOSA-N 393.821 5.150 30 20 GKED Cc1nc(O)c(C#N)c(C)c1CCC(=O)N(c1ccccc1)[C@@H](C)c1ccccc1 498068255 XCJOKVKXTJKJTK-IBGZPJMESA-N 399.494 5.003 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2ccccc2)o1)c1cccc(C(F)(F)F)c1 505938720 PHNXCOLRHWYWTO-MRXNPFEDSA-N 386.329 5.085 30 20 GKED CCOc1ccc(CN(C(=O)Nc2cc(C#N)ccc2OC(C)C)C(C)C)cc1 509237365 RQLRZVLFRYWBCO-UHFFFAOYSA-N 395.503 5.187 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C1Cc2ccccc2C1 510874250 YECLBOFNZBHTLR-UHFFFAOYSA-N 397.478 5.290 30 20 GKED N#Cc1cc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)ccc1Cl 510939025 MTSKLIQRSMFWLE-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1ccc(Oc2ccccc2)cc1 515664007 VXQGPOGKRFRHPH-UHFFFAOYSA-N 377.831 5.055 30 20 GKED CC(C)Cc1ccc(S(=O)(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518241346 FYIAUADIQOIDNC-INIZCTEOSA-N 388.558 5.080 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2cc(C#N)cs2)nc1-c1ccccc1 531457967 MAZHSJKQPCDJJT-KRWDZBQOSA-N 391.496 5.375 30 20 GKED CCN(C(=O)c1ccc(OC2CCCC2)c(OC)c1)c1ccc(C#N)c(Cl)c1 536971959 OOMYLSXEZTVXOU-UHFFFAOYSA-N 398.890 5.208 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(-c2cn3ccc(C)cc3n2)cc1 537314061 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375.280 5.331 30 20 GKED N#CC1(CCCOC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)CCOCC1 800172375 IUECYOSVLGXMOD-HSZRJFAPSA-N 391.511 5.047 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)NCc3ccc(C#N)c(Cl)c3)cc2)nc1 801628942 ADKNDGYVTDLWBD-UHFFFAOYSA-N 392.846 5.029 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)c1 803369380 QRGGMFRKQKVHFF-UHFFFAOYSA-N 389.160 5.058 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810530998 DWITXKMYDYLRQV-ZWNOBZJWSA-N 397.352 5.436 30 20 GKED CC(/C=C\C(=O)c1ccc(N2CCOC2=O)cc1)=C/c1ccccc1OC(F)F 811689937 POJYPIRGNCQTPS-VPCSQCHNSA-N 399.393 5.087 30 20 GKED CCCCOc1ccc(C=NOCc2nc(-c3ccccc3)oc2C)cc1OC 818252829 MFTMGEFPGDWWKQ-UHFFFAOYSA-N 394.471 5.388 30 20 GKED C[C@H](OC(=O)CCCCC#N)c1nc2cc(Cl)ccc2n1Cc1ccccc1 848862603 POLBIFMABHWXHU-INIZCTEOSA-N 395.890 5.426 30 20 GKED C[C@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)c(F)c1 850538400 DUICCEXXQATLDO-QKKBWIMNSA-N 395.478 5.382 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC1CCC(F)(F)CC1 901736670 JCMZQSAAYUBAHO-CYBMUJFWSA-N 384.517 5.188 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccc3ccccc3c2)cc1 915085339 ALAZJFKGUBWWRH-VWLOTQADSA-N 392.458 5.513 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 915087560 VXCPDQAMJUDFQT-ZQMYSKGWSA-N 384.479 5.630 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(N3CCCCC3)c(F)c2)cc(Cl)c1O 916128887 HNGPJEQKLKEVOE-YVMONPNESA-N 389.854 5.080 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(Cl)nc3Cl)c2)c1 920753718 PGXMDDWTFQISBV-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776076757 FTIPKKPWRULZKI-UHFFFAOYSA-N 396.506 5.881 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1 1776144196 AYJXTQKEVKGVDJ-YFHOEESVSA-N 377.223 5.066 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3)s2)c1)C(=O)O 1776470957 RMGJJWFJTDJPOX-WQTVUKCASA-N 378.449 5.163 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CCc2ccccc2)CC(=O)O)cc1 1776786582 WDMYUJQDBVQLQK-QHCPKHFHSA-N 397.559 5.602 30 20 GKED CCc1ccc(C(=O)O)cc1NCc1cccc(OCc2ccccc2C#N)c1 1776966678 IEMJICMXQHHXPP-UHFFFAOYSA-N 386.451 5.010 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3nccc4ccccc34)cc2)c1 1777650921 CYBPCCLMEWMESZ-JLHYYAGUSA-N 393.442 5.425 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4cc(O)ccc4C3=O)s2)c1 1777684286 FBIVQTOGWBXESN-NTCAYCPXSA-N 376.433 5.031 30 20 GKED C=CCCC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCCCC(C)(C)C 1847267737 NOJIONXYKINNQR-PMACEKPBSA-N 390.612 5.177 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1cc(C)sc1C)[n+]1ccccc1 10174396 WERZZAPDUMARBR-UHFFFAOYSA-O 395.573 5.266 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(F)cc3)n2)nnc1-c1ccccc1 24446649 ZPMROZIPFZXECD-UHFFFAOYSA-N 392.459 5.218 30 20 GKED C[C@@H](SC1=Nc2ccccc2CS1)C(=O)N(CCC#N)c1ccc(F)cc1 42512949 ATKPNBHVKWVXJW-CQSZACIVSA-N 399.516 5.129 30 20 GKED C[C@H](NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccc(C#N)cc1 43931662 UCMLUSSLJGANFK-HNNXBMFYSA-N 382.423 5.249 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 56410865 DTCBILAZGYPQMX-HNNXBMFYSA-N 395.553 5.210 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1c(C)nc2ccccc2c1C 60459873 CRUOLNDXBCJNRK-UHFFFAOYSA-N 384.932 5.324 30 20 GKED N#C[C@@H](C(=O)[C@@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1)c1ccccn1 107408749 FGKNHEGWIMZJNK-IERDGZPVSA-N 397.261 5.385 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 120518941 AYZOXVACSFRCIY-ZDUSSCGKSA-N 377.366 5.264 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(CN(C)Cc2cscn2)c1)c1ccccc1 134286212 RIONKAJWCPLIIL-IBGZPJMESA-N 391.540 5.074 30 20 GKED Cc1oc2cc(OC[C@@H](C#N)CCC#N)ccc2c(=O)c1-c1ccccc1Cl 152947516 YHYUYXAVFPZSLB-OAHLLOKOSA-N 392.842 5.244 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1sc(-c2cccnc2)nc1C)c1ccc(F)c(F)c1 186452125 XYTAPNFYOGXTFO-DJJJIMSYSA-N 385.483 5.760 30 20 GKED COc1cc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc(Cl)c1O 207731832 MWKWNIHZMQCZMT-ZROIWOOFSA-N 397.883 5.390 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)c1 303539978 HQWLTBOHYUMKCM-VWLOTQADSA-N 386.495 5.100 30 20 GKED CC1(CC(O)=Nc2cccc(N3C(=O)[C@](C)(C4CC4)N=C3O)c2)CCCCC1 328886780 OZWDFXUZRVHRLM-QFIPXVFZSA-N 383.492 5.064 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)c2ccccc2Sc2ccccc2C#N)C1 437113870 CEOXDZQMONPTMN-QZTJIDSGSA-N 396.581 5.456 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccccn2)c1 438655431 KDOICJYPOAIQAD-FCHUYYIVSA-N 398.466 5.178 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1c(F)cc(C#N)cc1F 446083107 ZZRBLGQCMWLXCK-AWEZNQCLSA-N 382.435 5.302 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F 454750838 CAOXVNLXMPIQRF-KKUMJFAQSA-N 399.482 5.714 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 455251451 MCYIRXBHUBFBQO-QFIPXVFZSA-N 377.532 6.319 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 457700470 PNAIPQMUNMINEX-GMSGAONNSA-N 381.238 5.014 30 20 GKED COc1ccc([C@H](N[C@H]2CCC[C@H](C#N)C2)c2ccccc2)cc1Br 463294474 DKXZEFJQDQRZFM-UQASEVPWSA-N 399.332 5.219 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])cc1F 464646166 WGYZXJFAEKXBMP-UHFFFAOYSA-N 393.399 5.009 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 467910956 NOWFELGDFYQQDF-MUUNZHRXSA-N 398.572 5.344 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 471285014 CEIRHXWUUXDFQK-FZKQIMNGSA-N 389.377 5.155 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1SC(C)C 473841015 FVNAKBJHPSHTCS-UHFFFAOYSA-N 385.489 5.315 30 20 GKED Cc1ccc(CCN(CC(F)(F)F)C(=O)C[C@H](CC#N)c2ccccc2)cc1 476118751 NSPPXLPGKKZUEP-FQEVSTJZSA-N 388.433 5.016 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1c(F)ccc(OCC)c1F)c1ccc(F)c(F)c1 480932152 UPQNFWSTFDMACA-QGZVFWFLSA-N 382.357 5.081 30 20 GKED C=CCn1c(SCc2ccn(C3CCCC3)n2)nnc1-c1ccccc1C 481401916 MAGVXADMWCTYIK-UHFFFAOYSA-N 379.533 5.043 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(Cl)ccc(F)c1C 483375328 NXEPXVAPSKWTFE-UHFFFAOYSA-N 394.833 6.012 30 20 GKED O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccc(F)cc1C(F)(F)F 487315919 HDACUHMKFCYBPU-DOMZBBRYSA-N 391.286 5.149 30 20 GKED Cc1cc(CN[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)ccc1C#N 488130315 VRSWWMJUFRTCPC-KRWDZBQOSA-N 387.458 5.109 30 20 GKED Cc1nc2ccccc2n1CCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 488176803 GKBSDAZLZMAJGN-UHFFFAOYSA-N 396.450 5.038 30 20 GKED C=CCC(C)(C)CNC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 489800387 MBLRLHWGFBJTHJ-UHFFFAOYSA-N 396.318 5.085 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(C)cc1)CC2 492076250 VGDVCZIGLKHEHD-MNDPQUGUSA-N 381.479 5.016 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1 494020676 ODCSVAYHISQDSP-PMACEKPBSA-N 376.843 5.142 30 20 GKED Cc1sc(Nc2ccc(C#N)cc2)nc1-c1ccc(NC(=O)C(C)C)cc1 500398718 NNIZIVXLQCBIKX-UHFFFAOYSA-N 376.485 5.328 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)on1 504756406 NHZIZACCOHMUTE-KRWDZBQOSA-N 379.847 5.359 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(CCN2CCCC[C@@H]2C)CC1 505036737 ZAZYKZICADBYLR-FQEVSTJZSA-N 383.580 5.314 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(CCC#N)CCC(C)C 514225989 FYESSQVFMJJYBS-UHFFFAOYSA-N 394.302 5.359 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](CC)c1ccccc1 517473252 LXBDQMLIQMCQAH-GHTZIAJQSA-N 395.572 6.334 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)Nc2cccc3ccccc23)CC1 518447315 DCJJPPHPQHVUOS-UHFFFAOYSA-N 385.467 5.223 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 522702647 WNUXGDXKKCZQPN-FXAWDEMLSA-N 381.501 5.146 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1 523100923 LVSBTGQQZANSNL-CQSZACIVSA-N 390.405 5.182 30 20 GKED C[C@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccc(C#N)cc1 524515369 SWBWTMJWSDFRMF-VBKZILBWSA-N 393.537 5.100 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(O[C@H](C)c3ccccc3)nc2)n1 531091620 KDKFCNRRCRBSMP-QAPCUYQASA-N 391.496 5.292 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](N[C@H](C)c2ccc(C#N)cc2)CCC3)cc1 531695532 NPDHFGGGRLLFQV-FOIQADDNSA-N 389.524 5.419 30 20 GKED Cc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1Br 532726444 USJJIFODFSGGHH-UHFFFAOYSA-N 395.304 5.147 30 20 GKED COc1ccc(CNc2ccccc2OC2CCCC2)cc1OCCCC#N 533211309 DJXXYKVUARENOJ-UHFFFAOYSA-N 380.488 5.311 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccc(OC)cc2)n1C1CCCCC1 534975476 JAVKXZSPIJUZDK-UHFFFAOYSA-N 385.533 5.086 30 20 GKED N#Cc1cccc(C2(C(=O)N3CCC(c4ccc(C(F)(F)F)cc4)CC3)CC2)c1 536919934 IVDKZRVMMCWHAS-UHFFFAOYSA-N 398.428 5.015 30 20 GKED CC(C)N(Cc1cccs1)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 538110117 CIVMSSPZIQAGPY-UHFFFAOYSA-N 389.524 5.407 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(-c2nc3cc(F)c(F)cc3[nH]2)cc1 540489652 ZBHSNWJTBPUGAR-UHFFFAOYSA-N 399.441 5.210 30 20 GKED N#CC1(CCCN[C@H](c2ccccc2)c2cccc3ccccc23)CCOCC1 540808480 FUIBAOGDOWJYIX-RUZDIDTESA-N 384.523 5.619 30 20 GKED N#CCc1ccc(CNc2ccccc2Oc2ncc(Cl)cc2Cl)cc1 541304447 WSPAPLWNEPEVAO-UHFFFAOYSA-N 384.266 5.859 30 20 GKED C=C[C@@H](Cc1nc(-c2cc(Cl)ccc2O[C@@H]2CCOC2)no1)c1ccccc1 547267024 VPFXLQALKWZFHJ-MAUKXSAKSA-N 396.874 5.070 30 20 GKED C[C@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccc(C#N)cc1 551563493 HNHJZOOPSDGZHS-YCRPNKLZSA-N 388.433 5.396 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1 554246384 WEJFTAKJMWJAHQ-HXUWFJFHSA-N 383.495 5.323 30 20 GKED N#Cc1ccc2ncc(CN[C@H](c3ccccc3)c3cccc4ccccc34)n2c1 560259328 XGCSHIOLMZRFCW-AREMUKBSSA-N 388.474 5.238 30 20 GKED N#Cc1ccc(-c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)s1 568117324 KXGSBTUWHOCDAF-UHFFFAOYSA-N 388.330 5.011 30 20 GKED Cc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)c(OC[C@H]2CCCO2)c1 571847044 MEBFGKXZRKOCPH-QGZVFWFLSA-N 390.405 5.055 30 20 GKED N#CCCCCCC(=O)N[C@@H](CC1CC1)c1cc(F)cc(Br)c1 588164842 SGRNGYQYKBUMNT-KRWDZBQOSA-N 381.289 5.020 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2Cl)C1 589404672 DWYIASUYABSHCU-CVEARBPZSA-N 399.947 5.199 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(C)(CC(F)F)C1 592222953 NUQSMKDAERFHOE-UHFFFAOYSA-N 385.414 5.168 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609031692 LHPPPTGGCYAIFI-ZIAGYGMSSA-N 375.255 5.006 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 609427705 DNPXXNTZBCPCSC-HNNXBMFYSA-N 376.481 5.495 30 20 GKED C[C@H]1c2ccc(F)cc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 610019093 BJQNCBISMJFUTO-CABCVRRESA-N 383.492 5.371 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 610055175 IOLGBYKMQYBMSA-QHCPKHFHSA-N 385.467 5.359 30 20 GKED C[C@@H](NC(=O)N1CCC(c2cccc3ccccc23)CC1)c1cccc(C#N)c1 610355216 KWOUMYKHNKGAGY-GOSISDBHSA-N 383.495 5.362 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(NC(=O)c2ccc(F)cc2)c1 611391169 YJWFFTDKOSVZJT-XMMPIXPASA-N 399.469 5.117 30 20 GKED CC1(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)CCC(F)(F)CC1 612065015 ZKUFQACCEZREHG-UHFFFAOYSA-N 384.426 5.243 30 20 GKED CN(Cc1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1)Cc1cscn1 614056032 AYGNBRFDEQCMEQ-UHFFFAOYSA-N 390.556 5.188 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccsc1 619825351 NTLYRHCIXCZMTI-INIZCTEOSA-N 393.487 5.232 30 20 GKED C[C@@H](NCc1ccncc1OCC(F)(F)F)c1ccc(F)cc1C(F)(F)F 623977957 FUDDGACCXAITEJ-SNVBAGLBSA-N 396.306 5.031 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(SC(F)F)c1 727345098 CFFKUCZYVXJANZ-UHFFFAOYSA-N 380.419 5.792 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 727953989 KASFSFOUJFEEHB-ZDUSSCGKSA-N 394.805 5.387 30 20 GKED COc1cc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)ccc1O 728438801 OYCGFFVDWRHMOQ-GXDHUFHOSA-N 397.883 5.390 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 731410349 ICYAWXNVTGMREP-MLGOLLRUSA-N 384.863 5.583 30 20 GKED C=CCOc1ccccc1CNCc1cc(C)c(OCc2ccccn2)c(C)c1 732230472 SFOUTIZECVDJHA-UHFFFAOYSA-N 388.511 5.132 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 732495989 LFYHHCGSVXCGKD-FHLIRTJZSA-N 396.874 5.882 30 20 GKED C[C@@H](CC1CCCC1)C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 734079500 RBTLZJOQRBYFQT-PXNSSMCTSA-N 390.483 5.343 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1cccc(OC2CCCC2)c1 741840676 BRHOQRWJRQRDLS-SEYXRHQNSA-N 384.447 5.068 30 20 GKED Cc1ccc(C)c(-n2ncc(C(=O)/C=C\c3cnc(-c4ccccc4)nc3)c2C)c1 741841139 DBMHQABLFUPSIO-QXMHVHEDSA-N 394.478 5.151 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1cnc(-c2ccc(C)cc2)s1 741842339 RWTSIBXQAQEMMX-ZHACJKMWSA-N 397.471 5.179 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)c3ccccc3SCC#N)ccc2C)c1 742131986 APSIHCAGDIGQFC-UHFFFAOYSA-N 389.480 5.359 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3ccccc3SCC#N)c2)C1 745136057 QWSIAOMLTHRJIY-YLJYHZDGSA-N 394.540 5.650 30 20 GKED Cc1cc(C(=O)Nc2cc(F)ccc2NC(C)C)c(C)n1-c1ccc(C#N)cc1 746334213 QJJYFYKSXKECNM-UHFFFAOYSA-N 390.462 5.178 30 20 GKED N#Cc1cc(F)ccc1NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 751554877 SZRICJMPWXXWJK-KRWDZBQOSA-N 377.341 5.085 30 20 GKED Cc1cc(F)ccc1[C@@H](O)COc1ccccc1Oc1ccc(C#N)cc1F 755358996 IILHDGXTIJHCQI-IBGZPJMESA-N 381.378 5.050 30 20 GKED C[C@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1cccc(F)c1 764749674 JGYKYFLTRAYSBE-MRVPVSSYSA-N 396.249 5.034 30 20 GKED N#CCc1ccccc1CC(=O)O[C@H]1CCCc2nc(-c3ccccc3)sc21 776954607 SAAXSQWXIVITST-FQEVSTJZSA-N 388.492 5.039 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccnc(Cl)c1 779459811 HLMUALJBEPTABU-CMDGGOBGSA-N 397.261 5.537 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 780677641 GSBNBEJCWSJVAF-OXQOHEQNSA-N 397.906 5.780 30 20 GKED CC(C)(C#N)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 786318225 WTEVSZGUCMDEBM-LBPRGKRZSA-N 378.284 5.233 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1c[nH]c2ccccc12 786354849 KDYVANFATMDHDJ-PBHICJAKSA-N 386.480 5.056 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(-c3ccc(F)cc3)o2)c2ncc[nH]2)c1 787169470 OEYZOGALKAWDIB-ZHZULCJRSA-N 388.398 5.241 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1nccc2ccccc12 792095139 JRTAKYUPAVCOAS-WIOPSUGQSA-N 394.499 5.945 30 20 GKED C=CC[C@@H](NC(=O)c1cccc2cccc(Br)c12)c1ccncc1 796480944 BIFXPUNQVJCHME-GOSISDBHSA-N 381.273 5.045 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1sc2ccc(C#N)cc2c1C 796712155 AEROODIGHHQEKU-KRWDZBQOSA-N 397.459 5.077 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)n1 796742900 DEZLZMOCSBQOND-ZNMIVQPWSA-N 394.418 5.145 30 20 GKED COc1ccc(C[C@@H](Nc2nc(Cl)c(C#N)s2)c2ccccc2)cc1OC 804424984 KXHBNNLPTWYORL-OAHLLOKOSA-N 399.903 5.081 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 805857417 UMQAHKRONSBJAS-HRAATJIYSA-N 397.503 5.413 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1OC 915990343 NKFHYRUYEYUNCA-MDZDMXLPSA-N 394.496 5.289 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3ccc(OC(F)F)c(OC)c3)oc12 916130261 MAOXRDWVNALGHQ-VQHVLOKHSA-N 388.366 5.338 30 20 GKED Cc1[nH]c2ccccc2c1C=Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O 916283755 RELXLVTTXGUYCQ-UHFFFAOYSA-N 398.491 5.105 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1cccc(Cl)c1 916906202 RJLKOYRIALXNMI-SFHVURJKSA-N 390.826 5.093 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917045822 AKBJHROQXRIAKI-NSHDSACASA-N 399.884 5.465 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccc(F)c(F)c1 918713766 VIXLUMKULGIQQH-YWEYNIOJSA-N 391.826 5.550 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1OC1CCCC1 1776354889 HAIGBAPSEZSQGW-QBFSEMIESA-N 394.467 5.390 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccccc2OC2CCCCC2)c1)C(=O)O 1776471053 DPSCHADFMPRIDK-ZWKQNVPVSA-N 394.467 5.146 30 20 GKED CCCCCCCOc1cccc(CNC2(C(=O)O)CCC(C)(C)CC2)c1 1776787376 XFRLKKPLYGUTNB-UHFFFAOYSA-N 375.553 5.549 30 20 GKED CCCCCCCCCCCN(C)c1ncnc2sc(C(=O)O)c(C)c12 1776787723 CQKFAPKPZMKZCK-UHFFFAOYSA-N 377.554 5.665 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1777372464 CFTUAEZQTLFYMP-GCMSVZMUSA-N 398.458 5.519 30 20 GKED O=C(O)c1ccc2scc(/C=C3\CSc4ccc(Cl)cc4C3=O)c2c1 1777685450 AGNINBUQSRXXNH-LFYBBSHMSA-N 386.881 5.625 30 20 GKED O=C1/C(=C\c2cccc(OCc3ccccc3)c2)C[C@H](C(=O)O)c2ccccc21 1777698377 KCEWMACXPYSJOI-FMTUWFKASA-N 384.431 5.104 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)c3cccc4ccccc34)cc2)CCC1 1788896712 JZFVCGJBCMZHED-UHFFFAOYSA-N 384.479 5.164 30 20 GKED O=C(/C=C/c1cccc(NC(=O)C(F)(F)F)c1)c1cc(Cl)sc1Cl 11332036 YEBMDVBMIZJGMP-SNAWJCMRSA-N 394.201 5.452 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccc(C#N)cc1 47052155 KOKMOEQJKGUPOD-AWEZNQCLSA-N 387.405 5.012 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 51533192 YZVRWFAHDHBAIY-QGZVFWFLSA-N 394.883 5.303 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCOCc3ccccc3)cc2)cc1 64943818 RYHYFUFJGYDUTA-UHFFFAOYSA-N 386.451 5.286 30 20 GKED CCCO[C@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 108515280 WOABOWYBPZHNAW-FQEVSTJZSA-N 393.487 5.164 30 20 GKED COc1ccc(F)cc1[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 109028910 PSLQZYGDEYNVOE-KGLIPLIRSA-N 387.480 5.111 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1cccc(OCCCC#N)c1 113570168 VSBPFGFHHIAVJF-MRXNPFEDSA-N 394.500 5.265 30 20 GKED CC(C)COC(=O)Nc1cccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c1 119877573 LLRKRLFRTWIMIP-HXUWFJFHSA-N 394.475 5.058 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 120249970 KVIZMDCAJJUSDH-CYBMUJFWSA-N 377.366 5.264 30 20 GKED CC[C@H](C)OCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 152410207 DWZCDBWFICKDBX-GWCFXTLKSA-N 383.300 5.108 30 20 GKED C=CCn1c(SCc2cccc(NC(C)=O)c2)nnc1-c1cccc(Cl)c1 154878560 BGQSXUPVGKKLEY-UHFFFAOYSA-N 398.919 5.035 30 20 GKED CCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 248375463 AXHBJCQEYHKVQZ-KRWDZBQOSA-N 382.872 5.352 30 20 GKED N#Cc1ccc(NC(=O)c2cc(C3CC3)nc3ccc(Cl)cc23)c(Cl)c1 430356895 RMEXNNSSEIAMGH-UHFFFAOYSA-N 382.250 5.543 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2SCc2cccs2)c(Cl)c1 430363571 WEVUSIDLXSBNOY-UHFFFAOYSA-N 384.913 5.818 30 20 GKED C=C(C)Cn1c(S[C@@H](C)CCSc2ccccc2)nnc1-c1ccncc1 431247536 FPLVXCSCLBHYFW-KRWDZBQOSA-N 396.585 5.579 30 20 GKED COc1ccc(CN[C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1OCCCC#N 435783237 UNXWHOIHGNAPLM-KESTWPANSA-N 384.907 5.067 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 436365849 NCNKDKPVMFWDQB-RBBKRZOGSA-N 387.508 5.031 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccnc(Oc2ccccc2)c1 438481141 CLUUWSDPEOHTKK-VXKWHMMOSA-N 398.466 5.178 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ncccc1Oc1ccccc1 440484323 KUOYVFHGZBEDOV-MRXNPFEDSA-N 389.480 5.378 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(O)c(Cl)c2)cc1F 440655206 BQOIWWVHDLXCPN-UHFFFAOYSA-N 382.778 5.101 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCC2)cc1)c1nc2cc(Cl)ccc2s1 442693557 POSSQYJPQWINSX-INIZCTEOSA-N 382.872 5.371 30 20 GKED CCOc1ccc(Oc2cc(CN[C@H](CC)c3ccc(C#N)cc3)ccn2)cc1 447546933 ZVUGUDCITQZTML-HSZRJFAPSA-N 387.483 5.385 30 20 GKED COc1ccc(C[C@@H](NC2CCC(C)(C#N)CC2)c2ccccc2)cc1OC 449117374 OHWAUTYSZVHKCV-ZPGVXSSASA-N 378.516 5.050 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)C1 456056075 XSQSHBPKPWLAJO-YJBOKZPZSA-N 378.438 5.106 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458805590 UTCAQZIKRYBHJR-GOTSBHOMSA-N 375.516 5.585 30 20 GKED CC(C)(C#N)CCCN1CCN(CCCC(C)(C)C#N)[C@@H](c2ccccc2)C1 459503735 FPCDQLMMOAJDMU-JOCHJYFZSA-N 380.580 5.005 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 460767013 ICMKOLOLIGLPRR-RTWAWAEBSA-N 394.563 5.345 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)[C@H](C)c3cccc(C#N)c3)s2)cc1 462052402 RDYQQZLCGGAWMD-CVEARBPZSA-N 389.524 5.280 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)ccc(C(F)(F)F)c1F 464401285 CCECALYROALRPK-NSHDSACASA-N 390.258 5.057 30 20 GKED Cc1cccnc1[C@@H]1CCC[C@H](NC2CCC(Oc3ccccc3C#N)CC2)C1 467342761 LBYQVEUUIGPBDJ-DNJQPREOSA-N 389.543 5.268 30 20 GKED COc1c(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccccc12 474706616 HPKZOYIDLGJVJF-AWEZNQCLSA-N 395.484 5.015 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccnc(OC2CCC2)c1 475567201 CLFQCMNSHLUDAJ-UHFFFAOYSA-N 379.504 5.187 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1nccn1-c1ccccc1 482154941 ACJSDXALXHVOKR-SFHVURJKSA-N 388.515 5.607 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1cccc(C(F)(F)F)c1)c1ccccc1 487241310 MRDIPDXPYOLGBW-FQEVSTJZSA-N 388.433 5.579 30 20 GKED COc1ccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(OC)c1 502652544 PWDICDROEMDWOK-UHFFFAOYSA-N 389.411 5.012 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1nc2ccccc2o1 505459148 XKHPWDYAUATRLP-LJQANCHMSA-N 389.414 5.533 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N2CCC(C)(C#N)CC2)cc1F 506952046 NWTQHEWGLSKLKH-UHFFFAOYSA-N 397.450 5.093 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Sc1nc2ccc(Cl)cc2o1 514525057 QIXJATDMLQTHLX-GFCCVEGCSA-N 392.933 5.238 30 20 GKED N#C[C@@H](NC(=O)c1ccnc(Oc2ccccc2)c1)c1cccc(Cl)c1Cl 518207372 GLOYIAUTNNQJBN-QGZVFWFLSA-N 398.249 5.175 30 20 GKED CC[C@H](NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)(C)C 518485491 BLMCKSAQZAXOEO-NRFANRHFSA-N 379.504 5.278 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccc(Cl)cc1 519413227 IXDMNAKCINVAJO-ZDUSSCGKSA-N 376.934 5.323 30 20 GKED N#C[C@@H](NC(=O)Cc1csc2ccccc12)c1ccc(Cl)c(Cl)c1 521886140 MHOVDHCCGFZKGZ-MRXNPFEDSA-N 375.280 5.132 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1F 523456784 SOARXMSJRWPROI-GUYCJALGSA-N 389.471 5.632 30 20 GKED C[C@H](CNC(=O)CSCc1ccc(C#N)cc1)c1c(Cl)cccc1Cl 523575624 WJQABIRVBKEHCY-CYBMUJFWSA-N 393.339 5.018 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@]1(C#N)CCC[C@@H](C)C1 524197681 VDQHTTHAEQVSPL-BMLIUANNSA-N 379.938 5.036 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(Cl)c(C#N)c1)C1CCCCC1 537167466 LUIPDRVYBCQUIN-UHFFFAOYSA-N 381.907 5.228 30 20 GKED O=[N+]([O-])c1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(F)c1 538321513 MLTOUPBJBYYFEA-AWEZNQCLSA-N 396.262 5.146 30 20 GKED N#Cc1ccc(CN2CCC(N[C@H](c3ccccc3)c3ccc(F)cc3)CC2)cc1 538392911 HFTCMTVQPDYNIV-AREMUKBSSA-N 399.513 5.041 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc2c1CN(c1nccs1)C2 547946839 BHUUNAKZZRFLLQ-UHFFFAOYSA-N 393.537 5.194 30 20 GKED N#CC[C@H](CC(=O)NC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1ccccc1 552244045 NLBMOBRPECJHOX-IFMALSPDSA-N 396.918 5.011 30 20 GKED Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NCc1ccc(F)c(C#N)c1Cl 556337353 YISKAJWBNOOSDW-OAHLLOKOSA-N 399.897 5.286 30 20 GKED C[C@@H]1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)c2ccccc2S1 571862467 ZWWSZUOTHZSNSK-QGZVFWFLSA-N 389.524 5.476 30 20 GKED C=CCN(C(=O)CCOC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 589035594 OVBRUFULDFWNDK-UHFFFAOYSA-N 378.497 5.033 30 20 GKED CN(Cc1ccco1)Cc1ccccc1CNCc1ccc(C(C)(C)C#N)cc1 594515304 UEPYNLHVSZKGSK-UHFFFAOYSA-N 387.527 5.003 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(-c3ccc(OC)cc3)c(C)s2)s1 604027745 VACFLFGSIMWRBA-UHFFFAOYSA-N 382.510 5.480 30 20 GKED CCn1c(S[C@@H](C#N)Cc2ccccc2)nnc1-c1ccc(C(C)(C)C)cc1 604044804 CFJUOXVCGJDBKE-HXUWFJFHSA-N 390.556 5.489 30 20 GKED C[C@H](C(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 607793545 UQEUFFDXTYNZSI-JTQLQIEISA-N 393.302 5.283 30 20 GKED COc1ccc(C2(C(=O)Nc3ccccc3SC[C@H](C)C#N)CCC2)cc1 609376471 ASCNKXQEMPARQR-MRXNPFEDSA-N 380.513 5.007 30 20 GKED COCc1cccc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)c1 609484019 AURSSGYNKMORQU-UHFFFAOYSA-N 390.870 5.205 30 20 GKED CC[C@@H]1c2ccccc2CCN1CC(=O)Nc1ccccc1S[C@H](C)CC#N 609625726 UKNXWQQZTJYTNG-DYESRHJHSA-N 393.556 5.029 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)N(C)Cc1ccc(C#N)cc1 610027126 TVCCRRZWZQGGEB-FQEVSTJZSA-N 399.922 5.149 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl 610106904 KUEJXBVXOGQVTI-SJORKVTESA-N 394.833 5.281 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)c1cccc(Cl)c1 610223995 ZLEBEODWDDITPI-OAHLLOKOSA-N 391.858 5.450 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@@H](C)c1ccncc1 610722616 HYJOIVCMUZPCOK-QGZVFWFLSA-N 387.458 5.128 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)c1cnccc1C 611301525 BIPSRDXJESMGMS-KRWDZBQOSA-N 386.455 5.245 30 20 GKED O=C(Nc1ccc(OCC(F)F)c(C(F)(F)F)c1)c1coc(C(F)F)c1 626674129 DVWKZEWLJFYKJE-UHFFFAOYSA-N 385.235 5.132 30 20 GKED Cn1ccnc1[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C1CC1 647323370 CMTFNIQWYNJRBR-CYBMUJFWSA-N 395.322 5.273 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(C(F)(F)F)s1 671724836 ZQXIERDZUNYPID-UHFFFAOYSA-N 387.276 5.099 30 20 GKED Cc1nc2c(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cccc2o1 672582353 KHGGACAWDNFTJF-GFCCVEGCSA-N 395.390 5.028 30 20 GKED CCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](C)c1ccccc1OC 726484214 HPXBFNOUWBFYOJ-AWEZNQCLSA-N 387.936 5.390 30 20 GKED C/C(=C\C(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 729369546 HNVIZPGPPCODKT-KRNATXNASA-N 382.463 5.050 30 20 GKED O=C1/C(=C\c2csc([N+](=O)[O-])c2)CCc2nc(-c3ccccc3F)sc21 731936590 BKTODOSXRBRWMB-XFFZJAGNSA-N 386.429 5.131 30 20 GKED C=CC[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1C)c1ccncc1 734509205 IWCQDOAELQBYCA-VWLOTQADSA-N 394.522 5.650 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 734966021 STNKLRBEWSHIOC-CJNGLKHVSA-N 389.282 5.143 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc(C)cc1 739153921 GNUUTAAQGYWINT-WMLDXEAASA-N 386.854 5.019 30 20 GKED Cc1c(C(=O)/C=C/c2ccccc2OCC(F)(F)F)cnn1-c1ccccc1 741849697 ZOGDOEMYQQHAOI-VAWYXSNFSA-N 386.373 5.018 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cnc(-c2ccccn2)s1 753145370 ZDDZLCQMSVEKHF-ZHACJKMWSA-N 389.505 5.533 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H](C)c1ccc2ccccc2c1 753215609 ZPESURLYNKJVGD-GOSISDBHSA-N 379.463 5.079 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 755391932 SWUCXKMCEIKXFE-LBPRGKRZSA-N 392.981 5.490 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2ccccc2NC(=O)OC(C)(C)C)c1 755848729 SQLAPHFLHYACQQ-UHFFFAOYSA-N 396.487 5.170 30 20 GKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C/c1cnc(-c3ccncc3)s1)CCO2 767738011 RSUXCHYSMMZDKS-GXDHUFHOSA-N 382.872 5.216 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2sc(-c3cccnc3)nc2C)c1 772984260 PGERKHFJEPNLKO-HNAYVOBHSA-N 392.528 5.045 30 20 GKED N#C[C@H](Cc1ccc(F)cc1F)OC(=O)c1occc1CSc1ccccc1 774343853 MFTZTDDCAHXFHL-KRWDZBQOSA-N 399.418 5.142 30 20 GKED C#CC[C@@H](N[C@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccccc1 775413998 CHZGKEGMTPUXNE-HYBUGGRVSA-N 376.544 5.096 30 20 GKED C=CC[C@@H](C(=O)OCc1csc(-c2ccccc2OC)n1)c1ccccc1 778416720 BOXVUJCPPWJWSK-GOSISDBHSA-N 379.481 5.222 30 20 GKED N#C[C@H](C(=O)C1(c2cccs2)CCCCC1)c1nc2cc(F)ccc2s1 779207224 YYXZIMZNDSMBAB-CQSZACIVSA-N 384.501 5.575 30 20 GKED N#CC1(COC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CCOCC1 780547687 MUPOWWKQTRJPRF-UHFFFAOYSA-N 396.295 5.199 30 20 GKED Cc1cc(NC(=O)Nc2ccccc2SCc2ccccc2)nn1CCC#N 782686323 CEKHUOYLQWGJMN-UHFFFAOYSA-N 391.500 5.042 30 20 GKED C=C[C@H](CC(=O)O[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784401696 CXRWHNSXURDHRH-HUUCEWRRSA-N 382.460 5.308 30 20 GKED C[C@@H](OC(=O)c1ncsc1C(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 801687073 NGGWGRGAWZOTNW-ZCFIWIBFSA-N 387.276 5.238 30 20 GKED CC[C@H](C)n1c(Sc2nc(Cl)c(C#N)s2)nnc1-c1ccccc1 804399945 AXFJEGBDQDCOTF-JTQLQIEISA-N 375.910 5.049 30 20 GKED C=CC[C@@H](N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccncc1 808697115 WFBZPLAYSPJRQS-UYAOXDASSA-N 396.332 5.610 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813213614 OMDZQGPGQSSNPZ-QAPCUYQASA-N 378.419 5.094 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)nc(C(F)(F)F)c1 834314318 KIPKPXRMKKJTAZ-UHFFFAOYSA-N 382.813 5.858 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2cccc(F)c2)CC1)c1ccccc1 838603549 JHGYVCLEDLRRCG-QFIPXVFZSA-N 379.479 5.150 30 20 GKED N#CCCCC[C@H](N)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 848397761 KZTGASQPKOPEAW-SFHVURJKSA-N 376.287 5.010 30 20 GKED O=C(c1ncoc1-c1ccccc1Cl)N(O)Cc1cccc2ccccc12 901370759 FIIQGBZXBSHHNH-UHFFFAOYSA-N 378.815 5.180 30 20 GKED Cc1ccc(-c2nnc3n2CCCCC3)cc1N=Cc1cc(Cl)ccc1O 912782355 MATCFMNMUNGTMW-UHFFFAOYSA-N 380.879 5.090 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(Oc2ccccc2)cc1 916880578 CHKPPKLNURLZQT-FQEVSTJZSA-N 390.826 5.093 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 916911951 WDHFLNCNUXWUBF-GOSISDBHSA-N 392.455 5.078 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(C(F)(F)F)c2)cc1 916946957 BQCKAOSPUUQAPM-UGSOOPFHSA-N 388.389 5.180 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)[C@@H](C#N)c1nc2ccccc2o1 917509827 BAQZVCMHWTVVLB-KAUXGEHWSA-N 384.435 5.806 30 20 GKED CC(CCc1cccc(F)c1)=NNc1nc(C(F)(F)F)nc2ccccc12 920368023 FFQNFFDLASZOGE-UHFFFAOYSA-N 376.357 5.208 30 20 GKED CC(C)(C)N(N=Cc1cnn(C(C)(C)C)c1)C(=S)Nc1cccc(Cl)c1 920385148 MHNMBGVGNIKZPC-UHFFFAOYSA-N 391.972 5.123 30 20 GKED CCCCCCCOc1ccc(C=NNc2ccccc2C(=O)O)cc1OCC 1776030004 BJCQZIBRWWQWEI-UHFFFAOYSA-N 398.503 5.579 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1sc2c(Cl)cccc2c1C 1776064415 NGKNCDKRXKXSCG-UHFFFAOYSA-N 376.840 5.537 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NN[C@@H](C)c1ccc(C(C)C)cc1 1776106320 ZWFCGKVBOOIBNO-RBUKOAKNSA-N 396.531 5.321 30 20 GKED C=CC1(CC(=O)Nc2cc3c(c(C(=O)O)c2)Oc2ccccc2O3)CCCCC1 1776149644 LRPOCZJDSNFCRH-UHFFFAOYSA-N 393.439 5.748 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](Cc2ccc(C)c(C)c2)C(=O)O)cc1 1776786472 MGVVYFMQYTVHKK-DEOSSOPVSA-N 397.559 5.438 30 20 GKED C=CC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)CCCCC)CC1 1831376306 LTUFVWTYTURMFF-VWPQPMDRSA-N 390.612 5.035 30 20 GKED CCn1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 7427491 OHWJETQOLCEXAE-SFHVURJKSA-N 382.920 5.154 30 20 GKED Cc1ccc(C(C)(C)C)cc1SCC(=O)Nc1ccccc1SCC#N 7492523 QBYMLNLKJIORCP-UHFFFAOYSA-N 384.570 5.639 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(Oc2cnccn2)c1 46292888 DEKXAOLBXBACSC-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#CC1(NC(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)CCCC1 58035937 JQUWCDNAIJRLMK-HXUWFJFHSA-N 384.932 5.115 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)NCc1ccc(F)cc1C(F)(F)F 97547240 XVSWCDRURYABGL-OAHLLOKOSA-N 393.302 5.197 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2ccccc2)c1)c1nc(-c2ccncc2)cs1 114620750 WCTSEUQIJSOOGX-FQEVSTJZSA-N 397.459 5.487 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1Br)c1ccc(C#N)cc1 118445154 UYRDYGHARTVJCJ-QWHCGFSZSA-N 389.318 5.142 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)c1 163672788 JJHSSJNPJRSEAS-UHFFFAOYSA-N 399.519 5.169 30 20 GKED CCN(C(=O)NCCCCC#N)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 177501300 HFQPVNPOICWWHP-GOSISDBHSA-N 379.504 5.149 30 20 GKED CC(C)[C@H](NC(=O)CNc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1 178388661 PNLPMOIQFZMVIX-AOMKIAJQSA-N 399.535 5.003 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 182144048 JGHBRWDSCQJTRP-ZIAGYGMSSA-N 376.378 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN(C)C(=O)C(C)C)cc1 189906871 SCKLXXGOSRHESJ-UHFFFAOYSA-N 392.543 5.405 30 20 GKED C[C@@H]1OCCC[C@@H]1/C(O)=N/C1(c2noc(C3CCCC3)n2)CCCCCC1 330060092 MCVORSQPUBEZHM-RDJZCZTQSA-N 375.513 5.048 30 20 GKED O=[N+]([O-])c1cc(C(F)(F)F)ccc1/C(O)=N/[C@@H]1CCC[C@@H](C(F)(F)F)C1 330929566 YUAHHMMWRKIGSC-PSASIEDQSA-N 384.276 5.039 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)C(F)(F)F 425674109 OUUMEBMKAKDAOX-KGLIPLIRSA-N 391.393 5.113 30 20 GKED N#C[C@@H](C(=O)c1ccc(F)cc1OC(F)F)c1nc2cc(Cl)ccc2s1 429735962 NKNHBSPHXJDMMO-NSHDSACASA-N 396.777 5.180 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H]2CC[C@H](C)C2)cc1 429771888 ZBFIKZOGKYMDIL-YJBOKZPZSA-N 379.460 5.011 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ncc(-c2ccccc2)s1)c1ccccc1 431711110 LZIIIEOGPBIWFK-SFHVURJKSA-N 376.485 5.367 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(-c2nccs2)cc1)c1ccccc1 432629606 IPIPGWUNFHBSAB-LJQANCHMSA-N 376.485 5.367 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1cccc(OCc2ccccc2)c1 433929927 IPPHHQKWFJIXHN-IBGZPJMESA-N 399.494 5.040 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 434982097 NIXNSXQAHYTKEC-RDJZCZTQSA-N 398.457 5.499 30 20 GKED CCCCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@@H](C)c1ccccc1 435127745 ACJXAVQSPYPYDC-FQEVSTJZSA-N 387.531 5.222 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CSCc1ccccc1 439965935 IKPKFOKUKZDDEN-SJORKVTESA-N 384.570 5.589 30 20 GKED CCCc1c(NC(=O)c2ccc(Cl)cc2Cl)cnn1-c1cccc(C#N)c1 440090379 UKIMEQZKOGZCTC-UHFFFAOYSA-N 399.281 5.256 30 20 GKED C[C@H](NC(=O)N[C@@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 445250624 OLOSCONAURPTEP-IRXDYDNUSA-N 385.467 5.052 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 448742536 WOGWJIMVKJIDPE-NSHDSACASA-N 389.311 5.021 30 20 GKED CCOC1(C)CCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CC1 455947748 SNUICESITOFJDQ-UHFFFAOYSA-N 395.528 5.132 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nc(-c3cccs3)no2)cc1F 463223760 UKTOWJLNDBAJBI-UHFFFAOYSA-N 392.415 5.213 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C 463333934 GWOZLIHHUAAZNO-UHFFFAOYSA-N 378.419 5.087 30 20 GKED C=CCOCCCC(=O)Nc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 463416041 RQQSDXLKQVATOH-UHFFFAOYSA-N 394.515 5.158 30 20 GKED CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](c1ccc(C)cc1)c1cccnc1 463821287 XXNMXTZAIJMCLO-YADARESESA-N 383.495 5.003 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1CC2)c1cc(C(F)(F)F)ccn1 464407178 PBRDRHRTXMRWHO-INIZCTEOSA-N 398.409 5.418 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCCC2)c1)c1cc(C(F)(F)F)ccn1 464416840 FHNWEVGJFBPTSH-SFHVURJKSA-N 388.389 5.302 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cccc(N[C@H](C)C(C)C)c2C)cc1 474712800 VOMNQZOBKCFWKH-QGZVFWFLSA-N 394.519 5.011 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 475928139 SSTOGIIJYSVITI-LJQANCHMSA-N 398.510 5.301 30 20 GKED CCOc1cc(CN[C@H]2CCCCc3cc(C#N)ccc32)ccc1OC(F)F 481917093 PAZQFVPYIVHTJC-IBGZPJMESA-N 386.442 5.116 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)CSc2ccc(C#N)cc2)cc1 482012742 FFHFGTWEAMXIDB-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc(OC(C)C)c(C#N)c2)c1C(C)C 484527127 ADPDQHKVDPRFGE-UHFFFAOYSA-N 383.496 5.109 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(-c2ccco2)cc1F 490502242 XLFIOAPKCYCBMJ-NQIIRXRSSA-N 389.430 5.389 30 20 GKED COc1ccc([C@@H](NCCCSCC#N)c2ccc(C(F)(F)F)cc2)cc1 492426261 UZNXBWBTTZHDAC-IBGZPJMESA-N 394.462 5.040 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(CC(F)(F)F)CC1 497327420 MOARVDKKCUWDKB-CYBMUJFWSA-N 385.455 5.135 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)c(F)c2)nnc1-c1ccc(OC)cc1 497669018 ZVYGRYCDNLNMPM-CYBMUJFWSA-N 387.455 5.271 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(CSc2nccn2C)c1 504288210 CXWVXRQNSAMJHS-UHFFFAOYSA-N 377.513 5.083 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C1CCC1)C1CCC1 505324489 BUIZRPHLMZGKDV-UHFFFAOYSA-N 375.472 5.209 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 507774355 XGMXVLOSFFSKAM-NRFANRHFSA-N 393.487 5.113 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(ccn2CCC)c1 509867632 RBBIFRUHJTXVEN-UHFFFAOYSA-N 392.459 5.180 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc(F)c(Cl)cc3Cl)c2C#N)C1 514517260 PYHXWILPIKNJCJ-MRVPVSSYSA-N 383.275 5.443 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H]3CCCOc4ccccc43)c2)cc1 517903853 ZPLZKRIFIOYVDF-QFIPXVFZSA-N 399.450 5.386 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 520198874 JFHRVTPQTJNOSH-RHSMWYFYSA-N 387.936 6.007 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1cccc(Cl)c1 520813930 WUKWHQKQMGQCMU-AWEZNQCLSA-N 390.961 5.606 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)Nc1ccccc1S[C@H](C)CC#N 520941360 LIGSZTLHGXRUHA-AEFFLSMTSA-N 397.544 5.752 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(C(C)(C)C)cc1 521326487 UJFLIVJJNCCYQG-INIZCTEOSA-N 382.529 5.396 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 521992383 CESURQIPCYVIHI-WBMJQRKESA-N 379.312 5.103 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c1 524018652 LFKARQZICLYQMR-KRWDZBQOSA-N 386.451 5.097 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 524326840 NRYUONAIECJIPY-ZWKOTPCHSA-N 387.310 5.407 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2c1CCC2 524389681 WOACCSRZRKPRHW-UHFFFAOYSA-N 382.463 5.187 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F)OCC 533764177 SFNYKJLPKQGXQO-GUYCJALGSA-N 389.483 5.906 30 20 GKED CC(C)(NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1nccs1 535599604 QIFOYVQEPWEARX-UHFFFAOYSA-N 397.887 5.126 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 537062360 RGXHOLBRQRLITD-CQSZACIVSA-N 397.481 5.195 30 20 GKED N#CCC1CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)CC1 541980223 WZERUIGQXDMTJB-UHFFFAOYSA-N 396.537 5.552 30 20 GKED CCN(C(=O)c1ccc(OC)c(OC2CCCC2)c1)[C@@H](C)c1ccc(C#N)cc1 544084508 QEABMTZNTLVTFT-KRWDZBQOSA-N 392.499 5.112 30 20 GKED N#Cc1csc(C(=O)N2c3ccc(Br)cc3[C@@H]3CCCC[C@@H]32)c1 552767052 MYABCOZZKCBNCA-ZFWWWQNUSA-N 387.302 5.069 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1cc([N+](=O)[O-])ccc1C(F)(F)F 555836101 FJCRRYDUABIHGO-UHFFFAOYSA-N 396.218 5.024 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1ccc(Cl)cc1Cl)c1ccncn1 562138533 CYPYRZSJHOPMKQ-AWEZNQCLSA-N 384.222 5.066 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CC12CCSCC2 568837830 QCPWAGASGOROSR-IBGZPJMESA-N 378.497 5.131 30 20 GKED CC[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1OC(F)F 575034162 YHVRFQCCMRQONU-MRXNPFEDSA-N 384.348 5.419 30 20 GKED N#Cc1csc(CNc2cccnc2Oc2ccc(Cl)cc2Cl)n1 579941443 YWTSOJNOTPYFPX-UHFFFAOYSA-N 377.256 5.121 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cccc4ncccc34)no2)c2ccccc21 585731236 HEJVAGQXXZMJFK-QXMHVHEDSA-N 391.434 5.324 30 20 GKED CC1(CC(F)F)CN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)C1 592265108 XOTJBCKKDPTENL-UHFFFAOYSA-N 387.455 5.218 30 20 GKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 596659197 UVQQVACXVUVQQV-HNNXBMFYSA-N 389.421 5.256 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(C3CCOCC3)c2)c(Cl)c1 600428846 XOASXPKELYAETO-UHFFFAOYSA-N 375.255 5.011 30 20 GKED Cc1nc(NC(=O)c2ccc(Oc3ccc(F)cc3)cc2)sc1SCC#N 603775509 LJABNVZVSUAZND-UHFFFAOYSA-N 399.472 5.251 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Sc1ncc(C(C)C)n1C(C)C 606758259 QADXIDPIRLWEOV-MRXNPFEDSA-N 391.606 5.344 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 608917861 XIMQVZNQRNRSHK-OAQYLSRUSA-N 381.907 5.283 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)Nc1ccccc1SC[C@H](C)C#N 609401917 JYMLTCTUGHOKRM-SJLPKXTDSA-N 397.544 5.610 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 609856225 QKRJZQMOMIRQHC-UHFFFAOYSA-N 383.816 5.101 30 20 GKED CCN(C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 609967723 ASFGIZFGLAACFI-CVEARBPZSA-N 388.433 5.365 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3OCC3CC3)c2)cc1 610128596 BHSLFBIILFCARU-UHFFFAOYSA-N 383.451 5.343 30 20 GKED C[C@@H](NC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1cccc(C#N)c1 610318296 IJJFPTVGJYUWCF-MRXNPFEDSA-N 399.454 5.085 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 615081361 BDDGXJAJLZPRML-PMACEKPBSA-N 389.417 5.032 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1COc1ccccc1 615570488 ZQCGUCSCCUPJED-UHFFFAOYSA-N 390.458 5.625 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC(=O)OC)c1cccs1 616123378 DLPXAQROUCFZIT-KRWDZBQOSA-N 386.517 5.026 30 20 GKED CN(C(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccc(C#N)cc1F 726368770 QLJDDIYQZGOCJQ-UHFFFAOYSA-N 387.439 5.251 30 20 GKED Cc1ccc2c(c1C)OC[C@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728392369 ZTTKMEWEBBLKIH-DHIUTWEWSA-N 397.478 5.214 30 20 GKED Cc1nc(CCC(=O)[C@H](C#N)c2nc3ccccc3s2)oc1-c1ccccc1 730395937 ZYCQIQVCVSASON-INIZCTEOSA-N 387.464 5.069 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 731643624 JFIPNFTWPAPMQT-ZDUSSCGKSA-N 392.267 5.013 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNc1cccc(Br)c1 732923926 MNBMPNYLYTZYPT-UHFFFAOYSA-N 375.600 5.150 30 20 GKED C=CC[C@H](NC(=O)c1csc(-c2ccc(OCCC)cc2)n1)c1ccncc1 734458873 CJGXRRQCSYDJLD-IBGZPJMESA-N 393.512 5.041 30 20 GKED CC(C)[C@H](CC1CCCCC1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 734706443 HTAFQUICAIQDHM-IRXDYDNUSA-N 387.474 5.850 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cc(C)n([C@H](C)c4ccccc4)c3C)[nH]c12 735791935 DJECBZHTHHJYIX-UTKZUKDTSA-N 396.494 5.389 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2c(Cl)nc3ccccn23)cc1OCC 737445820 GOMFXFUPPFGFPA-NTMALXAHSA-N 384.863 5.071 30 20 GKED N#CCN(C(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCC1 737642623 ZAOCLHUQAVJNQI-WAYWQWQTSA-N 390.327 5.032 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)c2ccc(-c3ccccc3)cc2)c1C 739668617 GOEMFRACJOXXMV-UHFFFAOYSA-N 392.462 5.280 30 20 GKED CCCOc1c(/C=C\C(=O)c2c(Cl)nc3sccn23)cccc1OCC 741848230 OAGAPIINNGGLAE-HJWRWDBZSA-N 390.892 5.133 30 20 GKED N#Cc1ccc(F)c(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 742381656 BDIQDAOMJXTFKG-UHFFFAOYSA-N 391.393 5.129 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SC(F)F)c(OC)c2)ccc1O 746346567 RRRGHGHDFBUSEZ-DAXSKMNVSA-N 380.412 5.010 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])cc2)c1 749985289 FGFJUTOZTZPAHA-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)cc1 750818708 AWDAQUZMYCTGQU-SFHVURJKSA-N 398.359 5.752 30 20 GKED N#Cc1cccc(/C=C2\CC3(CCOCC3)C/C(=C\c3cccc(C#N)c3)C2=O)c1 751517876 OYAKDZUPBDIJOV-RNIAWFEPSA-N 394.474 5.057 30 20 GKED CC1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCC(F)(F)CC1 752484661 IOBAWDINOZOTTL-LJQANCHMSA-N 383.442 5.432 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(SCc3ccccc3)cn2)c1 753898735 QKSDEGATDJBFMW-UHFFFAOYSA-N 375.522 5.164 30 20 GKED Cc1sc2ncn(N=Cc3cccc(Cl)c3F)c(=O)c2c1-c1ccccc1 759648531 MZWAORJRJRQUPA-UHFFFAOYSA-N 397.862 5.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccc(Cl)nc1C 763986519 WIVOAODDUCLPEM-UHFFFAOYSA-N 391.858 5.197 30 20 GKED CCC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776154898 CPHJFSXQWXBDQA-MGPUTAFESA-N 376.422 5.800 30 20 GKED CCN(C(=O)Cc1ccccc1CC#N)[C@H](c1ccccc1)c1ccc(F)cc1 776903361 XJAKVEQDIQQFDG-RUZDIDTESA-N 386.470 5.072 30 20 GKED N#Cc1ccc(C(=O)Nc2cccc(CC[C@H](O)c3ccccc3)c2)cc1Cl 778972137 QHVAALZWMVUCRY-QFIPXVFZSA-N 390.870 5.130 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 783521898 JVKZLNFYGHAAKN-HRAATJIYSA-N 399.332 5.297 30 20 GKED N#C[C@H](C(=O)[C@H](Oc1ccccc1)c1ccccc1)c1nccc2ccccc12 792102872 IHILSEDDFPYHHK-WIOPSUGQSA-N 378.431 5.231 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccccc2C(F)(F)F)cn1 792857769 DXRWKTCKZGVXLA-ZHACJKMWSA-N 384.357 5.067 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CC(C)(C)C1CCCCC1 796633284 NPDHRCNCTQMEOT-HXUWFJFHSA-N 382.548 5.455 30 20 GKED N#C[C@@H](C(=O)CCC(F)F)c1nc(-c2ccc(Cl)cc2Cl)cs1 796642352 BQXREQCOEMAIOP-JTQLQIEISA-N 375.227 5.338 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)s1)c1nc(-c2c(F)cccc2F)cs1 802058683 LOIFOXFMLYFQFQ-JTQLQIEISA-N 394.855 5.222 30 20 GKED CSc1ccc(C(=O)/C=C\c2c(C)nn(-c3ccccn3)c2C)c(Cl)c1 802706800 ZAMBAMGRHJGCOM-KTKRTIGZSA-N 383.904 5.156 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)N[C@H](C)c1ccc(Oc2cccnc2)cc1 807898558 HHWFOESDYRXIOU-DYESRHJHSA-N 383.492 5.022 30 20 GKED C#CCN(C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)C1CCCC1 810168664 DAJKRWUHDGKOJC-UHFFFAOYSA-N 395.890 5.002 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1ccc(C2CCC2)cc1 814902253 QKIPAOYXHPRRHJ-UHFFFAOYSA-N 380.542 5.009 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2CCO[C@@H](c3cccs3)C2)cc1 834908475 FIIMKJHBVJEJJX-SZVBFZGTSA-N 377.937 5.450 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccco1 860477129 AVGSLYIRGRRYMV-PWSUYJOCSA-N 378.375 5.278 30 20 GKED C=CCCC[C@H](NC(=O)Nc1ccc(C)c(NC(C)=O)c1C)c1ccccc1 878381977 XLRZIEXCWIZEAZ-NRFANRHFSA-N 379.504 5.481 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)Oc3ccc(F)cc3)n2)cc1 915101904 OCRZUBOUAJMGHF-GOSISDBHSA-N 394.471 5.292 30 20 GKED COc1cccc(/C=C/C(=O)c2sccc2Br)c1OC(F)F 915113017 LLVPXYNZXXPFQV-AATRIKPKSA-N 389.217 5.017 30 20 GKED CCCCCCC[C@H](C)CNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 918019267 BTIFMNAFCXVEKB-IBGZPJMESA-N 387.568 5.043 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c(-c2ccncc2)n1 920064582 GWQHWHIFAJSISU-XFXZXTDPSA-N 381.435 5.171 30 20 GKED N#C[C@@H](C(=O)CCn1c2ccccc2c2ccccc21)c1nc2ccccc2o1 920112801 JNOIWBLGLAKRFO-SFHVURJKSA-N 379.419 5.202 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1ccc(-c2ccc(Cl)cc2F)s1 1776030577 RGRCUQCUTWCQOG-UHFFFAOYSA-N 388.851 5.742 30 20 GKED O=C(O)c1ccc2scc(C=NNCc3cccc(Cl)c3Cl)c2c1 1776057960 SXMINUHJAQEJST-UHFFFAOYSA-N 379.268 5.030 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)c(OC)c(OCC)c1 1776782876 JVUBVPIRBCPIDT-MRXNPFEDSA-N 385.932 5.041 30 20 GKED CCCCCCCOc1cccc(/C=C/C(=O)c2ccc(CC(=O)O)cc2)c1 1776789191 UJVUTWDHRIDBCR-NTCAYCPXSA-N 380.484 5.559 30 20 GKED CCc1c(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)oc2ccccc12 1776956104 CUIBCNSHOZYXFP-SEYXRHQNSA-N 385.419 5.446 30 20 GKED Cc1cc(COc2ccc(/C=C3\CCc4ccsc4C3=O)cc2)oc1C(=O)O 1777423228 LFDYATFXCUAFJA-LFIBNONCSA-N 394.448 5.139 30 20 GKED O=C(C/N=C/c1cc(Cl)cc(Cl)c1O)Nc1cc(Cl)ccc1Cl 5290615 YAMXTYZWEBJBIT-CGOBSMCZSA-N 392.069 5.063 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cccc(C)c2C)[n+]2ccccc2)cc1 20834554 AWNUCSPWTGCGQA-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#C[C@H](C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)c1ccccn1 46440050 NPMKZEGZPQEXMW-IBGZPJMESA-N 378.884 5.517 30 20 GKED C=C(C)COc1cc(/C=C(/Cl)c2nc(O)c3ccccc3n2)ccc1OC 57788921 HCWXBJFTCRVOSJ-MHWRWJLKSA-N 382.847 5.036 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)cc2)nnc1-c1ccccc1OC 60426839 IZSDRGWMAQTVTC-CQSZACIVSA-N 385.920 5.646 30 20 GKED C=C(C)CN(CC)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 60624946 LFEAOMRGTCNIDA-UHFFFAOYSA-N 382.554 5.627 30 20 GKED CCN(Cc1cccs1)C(=O)c1ccccc1Sc1ccccc1C#N 60675613 YSSPHRKJXPUOOU-UHFFFAOYSA-N 378.522 5.433 30 20 GKED CCS[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)C(C)C 97542482 CZLNOOMHIIOZRF-NRFANRHFSA-N 382.529 5.162 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4[nH]ccc4c3)c2)cc1 107559877 ZBOWWRMOPULUBF-UHFFFAOYSA-N 381.435 5.065 30 20 GKED CCCCCc1ccc(NC(=O)C(=O)Nc2ccccc2SCCC#N)cc1 119066581 FBFWQDZHMIDCQP-UHFFFAOYSA-N 395.528 5.002 30 20 GKED N#Cc1ccsc1NC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 125076823 FWLFTADCEZBMSB-UHFFFAOYSA-N 380.281 5.302 30 20 GKED CCO[C@@H](C)c1nc(CSc2nc(C)cc(C(F)(F)F)c2C#N)cs1 133362944 HZMUTMSMEFPULI-JTQLQIEISA-N 387.452 5.127 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)o1 133833710 KZHGARLKZBBLGY-CYBMUJFWSA-N 384.892 5.254 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc1 135483790 HFJACJHPVBEBGT-INIZCTEOSA-N 395.478 5.247 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(CC(F)(F)F)c2)c1 175262507 QYOXFKYQKAGJDE-UHFFFAOYSA-N 377.366 5.118 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 176211378 YTIFPQKRCJQERG-CQSZACIVSA-N 393.468 5.075 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1[N+](=O)[O-] 176992904 IMRBJBMXXQKFAK-GJZGRUSLSA-N 398.488 5.180 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(O[C@H](C)c2ccccc2)cc1 191224713 GUIUEZAQCWBRSN-QZTJIDSGSA-N 386.451 5.370 30 20 GKED C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1cccc(Cl)c1 329802874 ZHTAFXSJLVRABM-FOIQADDNSA-N 384.907 5.000 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)CC(O)=N1 329875988 HHVDWNWJDWNYMK-OSAQELSMSA-N 387.480 5.038 30 20 GKED O/C(=N/[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F)c1csc(O)n1 329977998 GTEUQKAMCOLNMD-GXTWGEPZSA-N 384.423 5.289 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 433930110 JHXOEVSNPCXIDO-KRWDZBQOSA-N 386.451 5.084 30 20 GKED CC[C@H](C)n1c(SCc2cc(C#N)ccc2OC)nnc1-c1ccccc1 435141439 OQEYEGNSAIPSCU-HNNXBMFYSA-N 378.501 5.089 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccncc2)n1-c1ccccc1 436112793 FRMPZLXHSWIEIY-UHFFFAOYSA-N 377.517 5.141 30 20 GKED Cc1sc(Br)c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1C 442546889 OSMQZLNKTUUQNL-JTQLQIEISA-N 397.363 5.372 30 20 GKED COCC[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(C(F)(F)F)c1 451696076 RPIFUDULCLIXRB-FQEVSTJZSA-N 390.449 5.374 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c[nH]cc2-c2ccc(F)cc2)cc1 460971959 WHMACCXZOIYOJV-UHFFFAOYSA-N 397.409 5.737 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1coc(-c2ccc(Cl)cc2)n1 464835238 UOQMIWWLKZXUNA-RTWAWAEBSA-N 377.875 5.267 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N(C)Cc2cccc(C#N)c2)cc1 466085462 MSINEJGEUKWJIX-GOSISDBHSA-N 399.494 5.136 30 20 GKED N#CCc1ccc(NC(=O)NCC2(c3cccc(C(F)(F)F)c3)CCC2)cc1 466100036 FMYIEPHUVXZORY-UHFFFAOYSA-N 387.405 5.015 30 20 GKED C[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c2c(O)cccc21 468801110 BXYPAPZJFWZUBO-QGZVFWFLSA-N 398.462 5.405 30 20 GKED N#CCCCN1C(=O)CCc2cc(NC3CC(c4ccc(Cl)cc4)C3)ccc21 469165271 DZVYFRYJLCDZCF-UHFFFAOYSA-N 393.918 5.281 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)NC3(C#N)CCC(C(C)(C)C)CC3)o2)cc1 470203180 OORRRDFTOYDKRD-UHFFFAOYSA-N 393.531 5.198 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN(CC)C(C)C)cc1 476118461 MHTGNJXEKPRHCU-UHFFFAOYSA-N 378.560 6.021 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(-c2ncco2)ccc1C 479012357 AZCVXHWHFYUMHF-UHFFFAOYSA-N 393.491 5.038 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 479373378 JHELJTIRABLYQH-IBGZPJMESA-N 398.551 5.100 30 20 GKED C=C(C)[C@H](NCc1nc2cc(C(F)(F)F)ccc2n1C)c1ccc(F)c(F)c1 479410722 SAYGLMPMYFRIEO-IBGZPJMESA-N 395.375 5.277 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NC(=O)c1cccs1)c1nccc2ccccc12 483193257 FEFQAANQFDTZAO-GOSISDBHSA-N 397.459 5.039 30 20 GKED Cc1ccc(-c2nnc(CNc3ccc(Oc4ccccc4)c(C#N)c3)o2)cc1 488138061 LKUGMCOEXVKKMS-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=C[C@H]1CCCCN1Cc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 489429583 PUWPJIKZKOZXQR-KRWDZBQOSA-N 375.925 5.022 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(Cl)ccc3OC3CCCC3)cc2)CC1 494212102 KHKQELZDAXEHDI-UHFFFAOYSA-N 380.875 5.469 30 20 GKED C[C@H](NC(=O)N1CCC(F)(C#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 500898307 YGRYWMPSDIWVHV-ZDUSSCGKSA-N 391.899 5.167 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 502557351 CIVRBCLYFXCAPX-ZHRRBRCNSA-N 399.535 5.003 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)c2c1 505331961 UAVZIRVGHKTEGL-GOSISDBHSA-N 386.282 5.097 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1ccccc1Oc1ccccc1Cl 505886232 AUNXVRAIUMTVAF-UHFFFAOYSA-N 380.806 5.324 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)o1 510399967 XJLVWKWIUBJMBW-UHFFFAOYSA-N 389.455 5.207 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(-c3ccc(Cl)cc3)nc2C)s1 511064478 QICZEKQTXFXAEB-UHFFFAOYSA-N 387.917 5.520 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1nc(-c2ccccc2)cs1 513656759 XFVBPWAWXWHZLO-KRWDZBQOSA-N 388.540 5.001 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(-c3ncco3)c2)cc1 513967691 OKFFUWPILOCBFA-UHFFFAOYSA-N 399.381 5.397 30 20 GKED CCCn1c(SCCC(=O)Nc2ccccc2C#N)nc2cc(Cl)ccc21 514892177 NVMITRIXHGRTPU-UHFFFAOYSA-N 398.919 5.092 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@H](C)c2ccc(C#N)cc2)c2ccc(C)cc2)cc1 518005550 WCMIGBSHVUYICA-KOSHJBKYSA-N 399.494 5.025 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 518719444 XZGXCYNALMOGGX-FUHWJXTLSA-N 381.545 5.308 30 20 GKED CCN(CCc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 519914233 OFULJQHFTYHRKM-UHFFFAOYSA-N 391.496 5.509 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1csc(C(C)C)n1 522474050 CBTOYRDHQBFJJX-UHFFFAOYSA-N 393.487 5.433 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(F)c2F)cc1Cl 523272011 AELHLGDINRAYJU-QGZVFWFLSA-N 382.797 5.526 30 20 GKED CC(C)(C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1cccc(Cl)c1 524067423 RJYUGVQGLVHMBQ-UHFFFAOYSA-N 381.888 5.251 30 20 GKED CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCCCOc1cccc(C#N)c1 524767898 DNQJEPSPJGJBCJ-ZEQRLZLVSA-N 390.527 5.292 30 20 GKED C[C@@H](C#N)CNC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 531800192 MMLPNZMTMFODNL-LBPRGKRZSA-N 398.825 5.101 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc(-c4csnn4)cc3)c2)c1 532888244 JNFLNOAHNSECIW-UHFFFAOYSA-N 398.491 5.268 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@H](C#N)c1ccc(OC(F)(F)F)cc1 535069306 QGWZZCIUIJSVBT-MRXNPFEDSA-N 394.418 5.080 30 20 GKED CC[C@@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1c(C)noc1C 541071975 DZGMLRMVJZVXHE-IVZQSRNASA-N 387.483 5.201 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1cccn1C)c1ccc(-c2cccc(C#N)c2)cc1 542085323 NPIJFVZTNAPFPH-MHECFPHRSA-N 398.510 5.171 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4c(c3)CCC=C4)n2)cc1 556553503 GTALAMGOZKSMOY-FQEVSTJZSA-N 381.460 5.131 30 20 GKED CC1(C)CN(C(=O)c2c(F)cc(C(F)(F)F)cc2F)CC[C@@H]1C(F)(F)F 558567247 VMHITFORNZCDMN-NSHDSACASA-N 389.286 5.034 30 20 GKED C[C@@H](NC(=O)CCCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 588165216 HAORIGVHUIVMQL-CQSZACIVSA-N 394.462 6.085 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Br)cc1C#N 589055920 IJMXQZKAMDSASK-ZDUSSCGKSA-N 386.318 5.327 30 20 GKED CN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604088227 NAPAFPNOFFOHMH-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCc1cc(C#N)c(NC(=O)Cc2cccc(OCc3ccccc3C)c2)s1 609262052 HNARNOSZCBDHND-UHFFFAOYSA-N 390.508 5.251 30 20 GKED Cc1cccc([C@H](C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1 610048283 STTMCWOTAZALEO-KRWDZBQOSA-N 388.442 5.327 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)CC[C@H]1C 611557372 OPBLLKJCGWZPFM-MCIONIFRSA-N 385.455 5.133 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)C1 612306374 BPSFKSNOWXQWRA-OAQYLSRUSA-N 394.475 5.260 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1O 613031415 ARIVNQUHOUKVKB-UHFFFAOYSA-N 392.842 5.579 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)NCc1ccc(C#N)c(Cl)c1 619755399 IANUEEXROJGCCN-GFCCVEGCSA-N 385.895 5.634 30 20 GKED O=C([C@H]1CC[C@@H]1c1ccc(F)cc1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 627664991 BLYXRIOSLMFRNQ-CBBWQLFWSA-N 397.334 5.051 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)s1 642077210 IQXZTBNUMXGQDG-UHFFFAOYSA-N 392.455 5.117 30 20 GKED C=CCn1c(S[C@H](C(=O)c2ccccc2)C(C)C)nnc1-c1ccccc1 643090091 WOWWIMXRLWAOFR-FQEVSTJZSA-N 377.513 5.131 30 20 GKED O=C(c1ccc(C(F)F)cc1F)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 653865562 GGORHUNUEWSHTQ-GXSJLCMTSA-N 393.249 5.109 30 20 GKED Cc1cc(C(=O)N2CCCCC[C@@H]2c2ccncc2)c(C)n1-c1ccc(C#N)cc1 728267435 KOSQNBDJXPNRQF-XMMPIXPASA-N 398.510 5.118 30 20 GKED C=CCc1cc(/C=C(\Cl)c2nc3c(F)cccc3n2CC)cc(OC)c1O 728438651 JVGDVQMOMPAKQK-PTNGSMBKSA-N 386.854 5.375 30 20 GKED COc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 728766685 GCDXPSCLDMWVBT-VQIMIIECSA-N 390.508 5.497 30 20 GKED C#CC[C@@H](OC(=O)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccccn1 733692884 QGSZLURNHRSNAD-QGZVFWFLSA-N 382.872 5.088 30 20 GKED C=CC[C@@H](NC(=O)N1CCCCC[C@@H]1c1ccc(OC)cc1)c1ccncc1 734681871 ZYVXYIJLHWAMKY-FGZHOGPDSA-N 379.504 5.034 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 739144439 XSVCZYPBMLYDCR-KDOFPFPSSA-N 382.385 5.309 30 20 GKED CCCCCC[C@@](C)(CC)C(=O)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1 742605237 PJCRAMNBTNXRLG-XMMPIXPASA-N 397.563 5.122 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)COc2c1ccc(Cl)c2Cl 743058394 YHWPEIAJJIDGNC-UKTHLTGXSA-N 399.233 5.234 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCOCc2ccccc2)cc1 747637673 QNSDNMUTLNGJOJ-DEOSSOPVSA-N 384.479 5.278 30 20 GKED CCN(c1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1)C(C)C 752620585 SHAIDFDOOZAMBS-PKTZIBPZSA-N 390.531 5.225 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(F)c(C(F)(F)F)c2)S1 755403864 GSWAODDBRUOORF-DHDCSXOGSA-N 394.393 5.353 30 20 GKED C#CC[C@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccccc1 757777714 VAXOYGLOFGMEQW-QHCPKHFHSA-N 384.479 5.290 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCc3c(F)cccc3C2)cc1 757879044 HCIHEUGQAAZNSU-JOCHJYFZSA-N 385.442 5.071 30 20 GKED Oc1nncc(NN=C2CCCCC[C@@H]2c2ccccc2C(F)(F)F)c1Cl 770595350 DGDWQZOENOBQRX-GFCCVEGCSA-N 398.816 5.370 30 20 GKED CCOc1cc(/C=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1O 780886675 CNLMJSOZGZXARU-YTIHOSAGSA-N 398.462 5.098 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1ccc(-c2ccc(C)o2)s1 781636600 TWLBSYVBJKJTPK-UHFFFAOYSA-N 387.464 5.066 30 20 GKED CC1=C[C@@H](C)C[C@H](C=Nn2c(S)nnc2Cc2cccc3ccccc23)C1 789641436 YDYUSGADFJEGTI-WBVHZDCISA-N 376.529 5.137 30 20 GKED Cc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(Cl)c1 790767023 DUQBOVZBOQOVGT-QGZVFWFLSA-N 391.883 5.063 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792105384 MGUGBHJVCNFWRT-FVNWOWOISA-N 382.341 5.023 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cnc3ccccc3c2)cc1 796630241 OTTMIOAKQUREBI-JTSKRJEESA-N 399.494 5.028 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(Br)cc2)s1)c1ccnc(O)c1 798230776 PPUBOQTUTMWTJP-ALCCZGGFSA-N 386.270 5.174 30 20 GKED O=C(NC[C@@H](c1ccccc1)C(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801692603 SBJYHDSWZCMCCJ-LSDHHAIUSA-N 393.302 5.178 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cc(F)c(Br)c(Cl)c1 804809743 LIQCZBPPIJLHBN-UHFFFAOYSA-N 399.672 5.110 30 20 GKED COc1cccc(CC2(C(=O)[C@H](C#N)c3cnc4ccccc4n3)CCCCC2)c1 805929334 AQBIHFRPXXQFJE-HXUWFJFHSA-N 399.494 5.008 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)[C@@H]2CC=CC[C@@H]2c2nc3ccccc3s2)CC1 809089445 CWLJSSRCKHJKEK-XWTMOSNGSA-N 380.513 5.219 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])c(C#N)s1 813094677 XRFSKEHXFDSCMS-UHFFFAOYSA-N 398.271 5.385 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c(C#N)c2[C@@H]1C 839391390 YOJWHIUSOIVLPR-JGVFFNPUSA-N 398.290 5.399 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc12 915086120 GIQUNDIWMXZSQH-OAQYLSRUSA-N 396.450 5.254 30 20 GKED CCCN(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352431 KTUSIVZRSDTONJ-DEOSSOPVSA-N 383.495 5.786 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1 916000867 WXDQMEIOBUUKNL-KKSFZXQISA-N 379.529 5.002 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3nc4ccccc4s3)cn2)cc1 916074796 ZEELTIYCFOQPSA-BENRWUELSA-N 398.447 5.007 30 20 GKED Cc1ccc(Oc2ccc(OCC(=O)[C@H](C#N)c3nc4ccccc4o3)cc2)cc1 917510184 VJGGTVQMKMLVGQ-FQEVSTJZSA-N 398.418 5.184 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2c(s1)CCCCC2 920102160 QTZRUZKCQCBWCC-MRXNPFEDSA-N 376.481 5.012 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1ccc(Cl)c(Cl)c1 1776180259 MAIWUVPYAFUCFW-HNNXBMFYSA-N 390.719 5.522 30 20 GKED CC(=C\c1ccccc1OC(F)F)/C=C1\CCCc2cc(C(=O)O)ccc2C1=O 1776200010 JGYSCXWUTFGUDZ-DMAJYYCCSA-N 398.405 5.535 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H](C)CC)CC1 1824345266 LYSFBLUAUSMWQF-PZJWPPBQSA-N 390.612 5.035 30 20 GKED CC(C)(C)NC(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 31079133 KPPBNVDHMRZAJG-UHFFFAOYSA-N 397.478 5.006 30 20 GKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 51656490 GYUXNWVIAMFABZ-HNNXBMFYSA-N 385.439 5.422 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3ccccc3o2)cc1 55823548 YPCVGYALVSPPFY-UHFFFAOYSA-N 382.419 5.330 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)cc2nc1C 65680220 BLBDQRLDMWQFRI-UHFFFAOYSA-N 394.434 5.163 30 20 GKED Cc1[nH]c2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc2c1C 66544837 XKKDTAOXLRSKLV-LJQANCHMSA-N 396.475 5.270 30 20 GKED CCc1ccc2c(CNc3ccc(Oc4ccc(C#N)cc4)cc3)cc(=O)oc2c1 72040960 GHSSFJHPAIVFLX-UHFFFAOYSA-N 396.446 5.631 30 20 GKED CC(C)(C)[C@H]1CCc2sc(C(=O)Nc3ncccc3OCCCC#N)cc2C1 72086245 SEUDSRBPCJTGPZ-INIZCTEOSA-N 397.544 5.229 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)[C@@H](C)c2cc3ccccc3o2)c1 113980283 QNGGXTKHMTYTKD-QFBILLFUSA-N 391.471 5.016 30 20 GKED Cc1nc(CNc2ccccc2S[C@H](C)CC#N)oc1-c1ccc(Cl)cc1 129978840 VYTVEXXGMBPHOY-CQSZACIVSA-N 397.931 6.310 30 20 GKED N#CCCCCSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 160325514 XZKKPXHSPUYBRJ-UHFFFAOYSA-N 382.920 5.433 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 173969523 RQNCBWVXRPSXCL-MGPUTAFESA-N 375.859 5.133 30 20 GKED Cc1cccc(COc2cccc(C(=O)Nc3ccccc3O[C@H](C)C#N)c2)c1 182152860 GHMABAKYFAXNTN-GOSISDBHSA-N 386.451 5.117 30 20 GKED CCOc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(Cl)c1O 186795493 KFTVGXUMQBEDPC-LBPRGKRZSA-N 390.892 5.091 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Cn2nc(C)cc2C)c1 189894073 SNCYIHVXMGDJNP-UHFFFAOYSA-N 387.527 5.652 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/CC1(c2ccccc2Cl)CC1 328936236 JLTZLLHILUOPTR-CQSZACIVSA-N 390.936 5.035 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 410355514 UKAJGDVICZSSEE-UHFFFAOYSA-N 387.361 5.126 30 20 GKED C=CCn1c(S[C@H]2CC[C@H](C#N)C2)nc2scc(-c3cccs3)c2c1=O 430090247 PVPPIJYFZBDESN-STQMWFEESA-N 399.566 5.157 30 20 GKED Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1cccc(C#N)c1C 432840401 QCYLGZAQDFKQLG-UHFFFAOYSA-N 397.887 5.116 30 20 GKED Cc1cccc(N(Cc2ccccc2)Cc2nnc(-c3ccc(C#N)cc3)o2)c1 434480301 AAFPFODOMLEHFI-UHFFFAOYSA-N 380.451 5.124 30 20 GKED CCc1ccc(CCSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 437437118 VAGXNPCHLJGRLY-KRWDZBQOSA-N 398.597 5.415 30 20 GKED Cc1cc(NC(=O)c2occc2COc2cccc(C#N)c2)c2cccnc2c1C 443917183 OKKLDKMRBLKJAS-UHFFFAOYSA-N 397.434 5.148 30 20 GKED C[C@@H]1CCC[C@](C#N)(NC(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)C1 444021874 JEPOVDPAFUKTBJ-YJYMSZOUSA-N 392.377 5.047 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](C)(c2ccccc2)C1 446852184 MVXKTMMWKOVZTD-VGOFRKELSA-N 379.529 5.134 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(Cc3ccc(C#N)s3)C2)n1 447057902 GXVWOAJXSGVDGJ-HNNXBMFYSA-N 395.553 5.131 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(CC#N)cc1Cl 452648849 VZRHSNWBBZTCNF-GFCCVEGCSA-N 380.797 5.242 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)c1ccccc1C(C)(C)C 460822888 IPLJHMGBJGSOBU-HNNXBMFYSA-N 388.558 5.037 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)CCCC#N 462145601 HHGFHTQXTCVTLD-UHFFFAOYSA-N 378.451 5.364 30 20 GKED C[C@@H](C(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F)c1cccc(C#N)c1 462571822 AIPRIBMTVYNMHY-VLIAUNLRSA-N 382.385 5.235 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1cccc(C(=O)Nc2ccccc2)c1 464824849 WJLPHBLXGGSQEU-LOSJGSFVSA-N 395.506 5.211 30 20 GKED CCO[C@@H](CCNC(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CCCC1 473631782 ZLOIPLYVZSPSOD-LPHOPBHVSA-N 389.565 5.045 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(F)ccc1SCC(F)F)c1ccccc1 476073242 PNJWMQMBKKFECE-AWEZNQCLSA-N 378.419 5.209 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)[C@H](C)C(F)(F)F 477954709 IWZOGFOOTWAYAI-GFCCVEGCSA-N 396.796 5.417 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(F)ccc(OCC)c1F 480919155 FKHCJXPYZFJBHD-UHFFFAOYSA-N 386.851 5.299 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(CC(F)(F)F)c1 481226827 BGUSLKZQQQVIFX-UHFFFAOYSA-N 388.842 5.726 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1ccc(F)c(C#N)c1 481656728 KPAQMWNZUFKHHS-ZDUSSCGKSA-N 380.448 5.012 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1nc2ccccc2[nH]1 483284494 PVLGQNGVDQENNU-MRXNPFEDSA-N 389.361 5.123 30 20 GKED Cc1cc(Cl)cnc1NC(=O)c1ccccc1Sc1ccccc1C#N 485095788 WPEKNUCUNNSMHR-UHFFFAOYSA-N 379.872 5.319 30 20 GKED N#CCCn1cc(CN[C@@H]2CCC[C@@H](c3ccccc3)C2)c(-c2ccccc2)n1 486853991 AOECWNHRRAWZEB-ISKFKSNPSA-N 384.527 5.280 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487393124 TYBIOXKFHHLELM-JXFKEZNVSA-N 399.332 5.179 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1c(C)cccc1Cl 489288018 HNYTXBIENGRDBF-UHFFFAOYSA-N 391.858 5.197 30 20 GKED CC(C)[C@@H](NCc1cc(C#N)ccc1Br)c1ccc(F)cc1F 492775065 RLXUKPUSFSLZPB-GOSISDBHSA-N 379.248 5.086 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 494750127 XROZAUPASKZLKL-CQSZACIVSA-N 391.393 5.593 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(-c2cccc(Cl)c2)no1 499406870 MECXHZNKSHSTQQ-UHFFFAOYSA-N 393.874 5.165 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1coc(-c2cccc(Cl)c2)n1 502119982 IJBUGZVPFTXCAM-UHFFFAOYSA-N 375.211 5.108 30 20 GKED Cc1c(NC(=O)c2cc(C#N)ccc2Cl)cccc1C(=O)Nc1ccccc1 509504977 CYGVHNWTSMXMSD-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1ccccc1OCc1cccc(Cl)c1 512755241 WKMDKJHXUOLPKY-UHFFFAOYSA-N 394.833 5.111 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1SCC 519610275 HIHCZUJBWGIKGY-UHFFFAOYSA-N 389.452 5.066 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1ccc(C#N)cc1 523004766 WAZFNCKCNIWKLH-QGZVFWFLSA-N 375.497 5.093 30 20 GKED COc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 524191671 HAPGCLIGGSRSAX-UHFFFAOYSA-N 378.815 5.265 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)Cc1cccc(C#N)c1 530913202 VGTOUVDAUASTSG-CYBMUJFWSA-N 395.915 5.064 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)c1ccc(CC#N)cc1 534000177 XGRZEDDFLOZHIM-UHFFFAOYSA-N 379.257 5.229 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccc(C(C)C)nc1C 549042208 MXAVRYJYOFDGPH-UHFFFAOYSA-N 378.545 5.174 30 20 GKED CC(C)(C)O[C@H](C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 559066678 MUMFAKMUZMXTFZ-IBGZPJMESA-N 391.496 5.177 30 20 GKED Cc1ccsc1CN(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 560975357 JULLJFOMSBUFOM-UHFFFAOYSA-N 380.444 5.132 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1ccccc1F 561138590 SARRGERJPZZBJT-HUUCEWRRSA-N 388.533 5.653 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(Cl)c1 562189853 MMYKVAYYCVXRQK-AWEZNQCLSA-N 377.831 5.141 30 20 GKED N#CCCCOc1cccc(CNc2ccnc(Oc3ccc(F)cc3F)c2)c1 580607819 KKQRGCCPMJKTIM-UHFFFAOYSA-N 395.409 5.447 30 20 GKED Cc1ncsc1/C=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 588522636 GAZVGTUMALSMRR-LMVHVUTASA-N 385.901 5.118 30 20 GKED N#CC1(c2ccc(CN3CCC[C@H](c4nc(C(F)(F)F)cs4)C3)cc2)CC1 597018502 FPGSWAICRQSOBS-HNNXBMFYSA-N 391.462 5.097 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 597180744 UIHYNEIKABYCCA-IEZWGBDMSA-N 380.513 5.079 30 20 GKED N#Cc1ccccc1NC(=O)c1oc2ccccc2c1CSC1CCCCC1 598544000 NQXSKCWGPANHDN-UHFFFAOYSA-N 390.508 6.123 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 603754862 FIRFYEAUYWSFLS-GOEBONIOSA-N 376.378 5.053 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(C2CC2)nc2ccccc12 608878753 IAVJITMYDHJJQD-UHFFFAOYSA-N 383.495 5.282 30 20 GKED COc1ccc(C)cc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297418 FZQYIKSMJLRCOF-UHFFFAOYSA-N 376.387 5.059 30 20 GKED N#CCn1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc2ccccc21 609426786 BNAPUPFDEWMSIV-UHFFFAOYSA-N 392.418 5.081 30 20 GKED N#Cc1ccc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1C(F)(F)F 609448878 NUQCKMGEVJXXSV-NXEZZACHSA-N 390.249 5.144 30 20 GKED C[C@H](C(=O)Nc1cc(C#N)ccc1OC(F)F)c1c(Cl)cccc1Cl 609579800 OPGLXSCKFUZHAK-VIFPVBQESA-N 385.197 5.209 30 20 GKED Cc1nn(-c2ccccc2)c(CSc2ncc(C(C)C)n2C(C)C)c1C#N 610034601 NTGRVQUIGQRURB-UHFFFAOYSA-N 379.533 5.246 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](CC1CC1)c1ccccc1 610325858 XBRJPKYEAHSAEN-OXJNMPFZSA-N 379.529 5.601 30 20 GKED C[C@@H](NC(=O)NCc1ccc(Oc2ccc(F)cc2)cc1)c1cccc(C#N)c1 610400450 PVSHSVDIUOUTID-MRXNPFEDSA-N 389.430 5.050 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)cc1 613346476 KNVWDRXOQCCPSX-OAHLLOKOSA-N 387.291 5.915 30 20 GKED C=CCN(C(=O)C[C@H]1CCCO1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 643127411 SIWRFEKEGIIYLW-CYBMUJFWSA-N 397.327 5.205 30 20 GKED N#C[C@@H](C(=O)c1c(-n2cccc2)sc2c1CCC2)c1ccc2ccccc2n1 677557941 ZSFYZCMZAPFGGF-QGZVFWFLSA-N 383.476 5.066 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)Nc1ccccc1C#N 727979251 VUURBNSWDMSBII-UHFFFAOYSA-N 398.491 5.126 30 20 GKED CC(C)CN(CCC#N)Cn1cc(-c2ccccc2)n(CC(F)(F)F)c1=S 729464542 YKCYGNGSKCEGTR-UHFFFAOYSA-N 396.482 5.078 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1scnc1Cl 730995417 QYPIBRPIJOCRAS-UHFFFAOYSA-N 391.827 5.073 30 20 GKED COCCOc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3OC)cc2)c1 741468277 DTJAHUVTLPZDNV-XNTDXEJSSA-N 388.463 5.284 30 20 GKED Cn1cc(-c2cccc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)c2)cn1 741559672 XXEUKWHYEVBBNI-UHFFFAOYSA-N 394.434 5.003 30 20 GKED COc1ccc(CN[C@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1C#N 742366759 POKOQWUZAGBVPN-XMMPIXPASA-N 388.536 5.386 30 20 GKED C[C@@H](OC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1ccc(C#N)cc1 748680803 UFQVJYAHYUZZSU-CQSZACIVSA-N 396.899 5.106 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)C3(c4ccccc4)CCOCC3)cc2)cc1 748683210 MBWJCMGFPFMOHP-UHFFFAOYSA-N 399.446 5.004 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1)OCC 756475569 CRYOXZTVCUSBCS-RHSMWYFYSA-N 377.868 5.279 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccn(-c3ccccc3Cl)n2)c(C#N)s1 774162863 IDROZECPSAZQJV-UHFFFAOYSA-N 384.892 5.009 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccccc1-c1ccc(Cl)cc1 775454037 JGYKTKPULWBTGK-KRWDZBQOSA-N 376.887 5.760 30 20 GKED CC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cc(F)cc(Br)c1 776163260 GUNOPHDSKXHFPZ-ORAYPTAESA-N 391.284 5.292 30 20 GKED C=CC[C@H](NC(=O)NCc1ccc(OCCCC)c(Cl)c1)c1ccncc1 786237118 PZCPTQJRZPQITA-IBGZPJMESA-N 387.911 5.031 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1nccc2ccccc12 792096388 OJOBASRXJXBDRO-LJQANCHMSA-N 382.385 5.453 30 20 GKED CC(C)(C)c1ncc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cn1 806566475 HPZWQWYQUUQZGK-WJDWOHSUSA-N 375.497 5.110 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211978 USMKIZWUSOZEPT-VQIMIIECSA-N 392.446 5.235 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1sc(Cc2ccccc2)nc1C 814853260 IKVIMKJEYXWYGK-UHFFFAOYSA-N 390.434 5.292 30 20 GKED C=CCOc1ccc(CNc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)cc1Cl 815166149 ZJFQGOJKFQIAMQ-BTYIYWSLSA-N 384.907 5.278 30 20 GKED Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@@H](C)Nc1ccc(CCC#N)cc1 903297347 FKMAXXIEAHMTDZ-MRXNPFEDSA-N 394.519 5.044 30 20 GKED N#Cc1ccc(OCCCSc2nc(C(F)(F)F)nc3ccccc23)cc1 915793282 PWYJUXJZRGQKSB-UHFFFAOYSA-N 389.402 5.081 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1sc2ccccc2c1Cl 916881092 NNXRKXBZZAVKGG-ZDUSSCGKSA-N 389.263 5.169 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c(C)s1 916904786 IRLCAMUMQFNMJC-SFHVURJKSA-N 390.464 5.118 30 20 GKED N#C[C@H](C(=O)/C=C/Sc1ccccc1)c1nc(-c2c(F)cccc2F)cs1 920803816 DOSSGFHQXRWEAB-ATWMFIQVSA-N 398.459 5.571 30 20 GKED N#CCCc1ccc(NC(=O)COc2ccc(C3SCCCS3)cc2)cc1 928403154 JYPYLYBRLAKUDT-UHFFFAOYSA-N 398.553 5.029 30 20 GKED C#CCC1(NCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)CCCCC1 933268386 XNODSKFEVGLTHT-UHFFFAOYSA-N 395.572 5.260 30 20 GKED CC(C)c1cccc2c1OC/C(=C\c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1776377870 RCJCCPKLBGVISK-XYOKQWHBSA-N 396.439 5.521 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2nc3cc(C(=O)O)ccc3o2)cc1 1776785481 DKEUPHQRXQPCDE-XNTDXEJSSA-N 393.483 6.436 30 20 GKED CCCCCCCOc1cccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)c1 1776789122 TUBKJIYLWJJUQN-JXAWBTAJSA-N 396.483 5.848 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776806021 SXTPZSBSMMUDCP-QGOAFFKASA-N 384.475 6.291 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1csc2ccc(C(=O)O)cc12 1776931550 VDGOGMMJRJCXIO-ZZXKWVIFSA-N 386.856 5.548 30 20 GKED CCc1cccc2c(/C=C/C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)c[nH]c12 1776977373 NEQFBEYLKMOVJM-ZHACJKMWSA-N 385.419 5.585 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3ccc(C(=O)O)s3)ccc21 1777002762 CVXIXYPSHAFCJW-CSKARUKUSA-N 375.449 5.470 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)[C@H]3CC=CCC3)cc2)CCC1 1790467335 KEKUDPDWDQZFMO-UGKGYDQZSA-N 392.543 5.245 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)cs1)C(=O)N(CCC#N)c1ccccc1 5971889 JKUSJVLOOOAPKW-MRXNPFEDSA-N 393.537 5.238 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)c1ccccc1-c1ccccc1C#N 8176491 ORLOXLFQNRAPCI-SFHVURJKSA-N 398.462 5.026 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(C(C)C)no2)nnc1-c1ccc(Cl)cc1 27780255 HWXKKLKDKRDKGZ-LBPRGKRZSA-N 389.912 5.144 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(NC(=O)c2cccs2)c1 43981000 OJCMDQBLRNVXFO-UHFFFAOYSA-N 397.525 5.282 30 20 GKED Cc1ccccc1CCNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161567 DZHDEAPGUAXVIK-UHFFFAOYSA-N 399.494 5.004 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 61787811 FXOVSWQAIJEXJG-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955245 RPXFNNWTGFSKEQ-MRXNPFEDSA-N 383.517 5.143 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)[C@H](C#N)c3nc(C)cs3)oc2c1 68335899 NTROBOTXGODUOX-KRWDZBQOSA-N 388.448 5.363 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 69771126 QQOWCODOEPINSQ-UHFFFAOYSA-N 380.494 5.446 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)[C@@H]1CCC[C@H](C(F)(F)F)C1 70868410 YMRASIKQBXOWGY-ZJUUUORDSA-N 387.295 5.074 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 103439591 MQXTZYOHZBDXAJ-UHFFFAOYSA-N 381.888 5.020 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)N2CCC(C#N)CC2)c2cccs2)cc1 105092989 HFRIRBPAJNHRPS-KKSFZXQISA-N 381.545 5.296 30 20 GKED Cc1cscc1NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 118950678 LSTZZRPFEZKYJJ-UHFFFAOYSA-N 377.469 5.346 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1ccccc1SC[C@H](C)C#N 120185976 QGBPXPALSYIBJJ-CYBMUJFWSA-N 395.459 5.293 30 20 GKED C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(C)(C)C#N 131554825 DGNYHZODHJTPGS-NSHDSACASA-N 381.259 5.062 30 20 GKED COc1ccc(CNc2ccc(CC(F)(F)F)cc2)cc1OCCCC#N 174448967 ANYMGGYLAIVWTH-UHFFFAOYSA-N 378.394 5.095 30 20 GKED N#Cc1csc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c1 176968024 QLJBPDFFEXCLOY-LLVKDONJSA-N 383.325 5.158 30 20 GKED Cc1c([C@@H](C)Nc2cccc(OCCCC#N)c2)nnn1-c1ccc(Cl)cc1 179819308 IHLJRQHOUAUNKY-OAHLLOKOSA-N 395.894 5.085 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1cccc(Oc2ccc(Cl)cc2)c1 182934237 LCPIWVVESYNWSI-UHFFFAOYSA-N 391.858 5.083 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl)c1ccccc1 186942323 LSEGYEGTIGSGQN-SFHVURJKSA-N 384.907 5.167 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1)c1ccccc1 188068433 PHUZGOQGPBPTQD-LXFBAYGMSA-N 395.568 5.566 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cc2ccccc2o1 191947867 RTGALYAFSBACHO-CABCVRRESA-N 379.485 5.567 30 20 GKED CC(C)(CCC#N)COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 195089443 LHFKVLLZHNOPQC-UHFFFAOYSA-N 395.286 5.454 30 20 GKED O=[N+]([O-])c1ccccc1-c1ccc(/C=C2/S/C(=N/C3CCCC3)N=C2O)s1 206109821 YBYUAWIBOVSJPF-GZTJUZNOSA-N 399.497 5.666 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 237607439 SPJGJBQSQJYBRW-MZNJEOGPSA-N 392.449 5.329 30 20 GKED Cc1ccsc1[C@@H]1C[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 246923967 SQQWGSOLUNTMQL-ZACQAIPSSA-N 389.505 5.032 30 20 GKED OC(=Nc1ccccc1NC12CC3CC(CC(C3)C1)C2)c1ncoc1C1CC1 328814597 GDOWWJHUSMSGOJ-UHFFFAOYSA-N 377.488 5.569 30 20 GKED Cc1nc(C2CC2)oc1/C(O)=N/C1(c2ccc(Br)cc2)CCC1 329438893 AQZHKDVQHYHOAC-UHFFFAOYSA-N 375.266 5.007 30 20 GKED OC(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)=Nc1ccccc1N1CCCCCC1 329449894 MQGLIPBXMZUWSR-UOYQGRGCSA-N 382.548 5.376 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1c(Cl)cccc1OCc1ccccc1Cl 417604572 CCGXAJXVGUDZGD-HNNXBMFYSA-N 394.298 5.081 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2OCCc2ccccc2)c1 429960480 BOOJMCBOTSMJAD-UHFFFAOYSA-N 388.492 5.176 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 435457902 GXHRQLPYNVKPFT-UHFFFAOYSA-N 390.333 5.088 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccc(C#N)cc1 438633256 MYHDGFPZABQRGC-AWEZNQCLSA-N 392.846 5.282 30 20 GKED CC(C)c1ccccc1NC(=O)CSCc1ccc(C#N)cc1OC(F)F 439539628 GVPLJWXEWXPHLU-UHFFFAOYSA-N 390.455 5.155 30 20 GKED Cc1ccc(CN(CCc2ccccc2)C(=O)NCC2CCC(C#N)CC2)s1 442729470 NLQFKFSQRLSLJH-UHFFFAOYSA-N 395.572 5.141 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnccc1Oc1ccccc1 443531728 MDOQOJUBUOAGIV-MRXNPFEDSA-N 389.480 5.378 30 20 GKED Cc1cccc([C@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)C(F)(F)F)c1 455175336 FPERHFIUMHDMHQ-OALUTQOASA-N 389.421 5.333 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1)c1ccccc1 458810653 BCIPYRXFWWPUKB-XZOQPEGZSA-N 387.527 5.748 30 20 GKED Cc1ccc(-c2nc(CNc3ccccc3Oc3ncccc3C#N)cs2)o1 462204707 AVRIHXXYNQCSFE-UHFFFAOYSA-N 388.452 5.383 30 20 GKED Cc1c(C(=O)Nc2cccc(OCCCC#N)c2)ccc(C(F)(F)F)c1F 467739081 BYZHEFBWBYJZBN-UHFFFAOYSA-N 380.341 5.088 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)c1ccc(C2(C#N)CC2)cc1 468284109 CBJGYWARXQFBGS-UHFFFAOYSA-N 386.417 5.012 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)cc1 468974914 MHENRTRDXSQEMH-HXUWFJFHSA-N 381.907 5.486 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(OCC)c(OC)c1 475553189 FGMSMFHZIXNHPY-QGZVFWFLSA-N 396.531 5.829 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H]1[C@@H]2c3ccccc3C[C@H]21 478564713 ANWUITFLZUGPGL-GMKZXUHWSA-N 395.462 5.119 30 20 GKED CCOCCOCc1cccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1C 481999508 GTJVHNIIGAWQSD-DEOSSOPVSA-N 378.516 5.299 30 20 GKED C=CCC[C@@H](NC(=O)C[C@@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 496015631 WIYZXUHIGMYPFU-FZKQIMNGSA-N 393.453 5.363 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCCC[C@@H]2c2noc(C(C)C)n2)c1 501146793 YYUQULQBIXISME-LJQANCHMSA-N 398.507 5.297 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)[C@H](C#N)c3ccccn3)c2cc1C 505298530 AVLSQLCPMYJGLN-OAQYLSRUSA-N 377.447 5.404 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3c(F)cc(C#N)cc3F)s2)cc1 505768601 KINNOANNAFXNTC-NSHDSACASA-N 385.439 5.450 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)Nc2cc(C#N)cn2C(C)(C)C)s1 510607752 XHBBGJHDSDCTLZ-UHFFFAOYSA-N 396.516 5.312 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H]2Cc2c(F)cccc2Cl)cc1 510608120 ZPPVORNYMCMAST-QGZVFWFLSA-N 399.897 5.519 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)Nc1cccc(C#N)c1 511907038 AEJWYGMSAKBIAI-LLVKDONJSA-N 381.785 5.060 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nnc(-c2ccccc2F)s1 512552162 JWYSGRPJSBBHHF-INIZCTEOSA-N 399.539 5.261 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)oc2c(C)cccc12 516270334 SMQYTGLQERJONZ-CQSZACIVSA-N 380.856 5.803 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3cc4ccccc4[nH]3)c2)cc1 517345504 YZPLQEAULFNMCN-UHFFFAOYSA-N 382.423 5.154 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc(Cl)c1 517656100 PEEITTKWHYLORR-HXUWFJFHSA-N 391.858 5.280 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cccc2ccccc12 518168497 JFMJUAXMMPXFMN-IAGOWNOFSA-N 389.524 5.974 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 518259524 MLZDRPKVTALIMJ-MRXNPFEDSA-N 385.508 5.662 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)cc1 518493992 YERDKFLAGYCBEF-OAQYLSRUSA-N 392.911 5.878 30 20 GKED CC[C@H](C)c1ccc(NC(=O)CNc2ccccc2S[C@@H](C)CC#N)cc1 520200679 NKOKZDFYHDNPOD-IRXDYDNUSA-N 381.545 5.645 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cccnc1SCC1CCCCC1 522312970 BGVMMXFTMYNGEG-UHFFFAOYSA-N 395.528 5.277 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(F)ccc1OC(C)C 524305277 DHBLBRQUVLFJEQ-UHFFFAOYSA-N 383.467 5.175 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4cc(F)ccc4[nH]3)cc2)c1 524411110 LKZHFIJGUTZPKQ-UHFFFAOYSA-N 385.398 5.010 30 20 GKED N#C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C1CCCCC1 524535789 SSRSUIGGWQNGKE-IBGZPJMESA-N 377.517 5.326 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccccc1Br 537547228 IDTVVYQYSOGEEI-UHFFFAOYSA-N 393.240 5.365 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCCC(F)(F)F 539939811 FVFYTCNTKPVSDL-UHFFFAOYSA-N 378.369 5.272 30 20 GKED C[C@@H](NCc1csc(-c2ccccn2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541066231 BYZMKZKPZZYIMM-QGZVFWFLSA-N 396.519 5.595 30 20 GKED C[C@@H](NCc1ncc(-c2ccccc2F)o1)c1ccc(-c2cccc(C#N)c2)cc1 542942914 XKMAUJGWYOKBDB-QGZVFWFLSA-N 397.453 5.870 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)c1ccccc1Sc1ccccc1C#N 546875998 VVOFZEYQDXTHRT-AWEZNQCLSA-N 378.419 5.170 30 20 GKED C[C@H]1C[C@H](c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)CCO1 547216259 UCCHITJPAXELHQ-UONOGXRCSA-N 395.846 5.336 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)c(C(F)(F)F)c1 548608123 SOIVWEGCWXKQDK-UHFFFAOYSA-N 382.769 5.270 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2cccnc2C(F)(F)F)cc1 564241742 SJIQMZUKJFBOHR-UHFFFAOYSA-N 397.356 5.325 30 20 GKED CC(C)(CCC#N)CNCc1cn(Cc2ccccc2)nc1-c1cccs1 568927775 HDTKLXNTQMWUSJ-UHFFFAOYSA-N 378.545 5.079 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cncnc3-c3ccccc3)c2C#N)[C@H](C)C1 584515779 FAQHCLZORFOLLZ-ZIAGYGMSSA-N 388.496 5.015 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)N(c1ccccc1)c1nc2ccccc2s1 603558237 MPBRAPRFKRMMNY-INIZCTEOSA-N 399.475 5.300 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)c1 604185448 IGHMMKMOGFJXHK-UHFFFAOYSA-N 376.843 5.237 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2nccs2)c1)c1nc2cc(F)ccc2s1 606147109 TZQDJYCRCNBINW-AWEZNQCLSA-N 395.440 5.174 30 20 GKED Cc1ccccc1S(=O)(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 608954526 WUGMCIGVOHNMDW-LJQANCHMSA-N 396.899 5.105 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3sc(C)c(CC)c3C#N)cs2)cc1 609033029 OQMOVZWATQZMCC-UHFFFAOYSA-N 395.553 5.358 30 20 GKED C[C@H](CCc1ccco1)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208742 IMOPBWKJAJOCDM-MRXNPFEDSA-N 375.428 5.086 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 609376510 BRPMICLCVFXUTC-CQSZACIVSA-N 377.469 5.154 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(F)cc2s1)c1ccc(Cl)c(Cl)c1 609463751 YMVFNPNBZQQLGW-AWEZNQCLSA-N 379.243 5.342 30 20 GKED COc1cccc(OC)c1Oc1ccc(CNc2ccc(C#N)c(Cl)c2)cn1 609502375 VXPBYSCHSPPKCT-UHFFFAOYSA-N 395.846 5.028 30 20 GKED C[C@@H](N[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 611077963 VIPANKYHOQZSML-CHWSQXEVSA-N 386.282 5.932 30 20 GKED Cc1nc(C)c(C(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)s1 613393467 IHKSMLBKKQHREC-IIFATDLDSA-N 397.569 5.174 30 20 GKED C=CCN(C(=O)CCC(F)F)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 684625831 JVSQQFNBTZHUMF-UHFFFAOYSA-N 391.270 5.681 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccc(Cl)nc2)cc1 727080726 YHIPDJWNOUAQIG-UHFFFAOYSA-N 380.860 5.208 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc4ncccc4c3)s2)cc1 727976028 ZZQPBOLKLQOXCL-SDQBBNPISA-N 386.476 5.571 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1csc2ccccc12 730031345 XTPUEXVTSIVOFN-INIZCTEOSA-N 377.513 5.456 30 20 GKED Cn1c(CC(=NOCc2cccc(F)c2F)c2ccccc2)nc2ccccc21 731664748 VOJRKLMYFTVUGQ-UHFFFAOYSA-N 391.421 5.015 30 20 GKED CCOCc1cc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)ccc1OC 732571200 NEZGRKJWCJYNBZ-LUAWRHEFSA-N 379.481 5.251 30 20 GKED Cc1cccnc1[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)C 734643864 JDNLNPGXGHHVEF-DHIUTWEWSA-N 398.510 5.564 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1ccc2ccccc2n1 741427310 IMGWWPPJHQWWGN-ZACQAIPSSA-N 396.368 5.113 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2c(C#N)c3n(c2C)CCC3)cc1 741467713 QDBLCKTWAJRPJY-KAMYIIQDSA-N 382.463 5.186 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccc(C#N)cc1 741901953 XBUBUDSQFRHCKG-CYBMUJFWSA-N 380.369 5.134 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(Br)cc2Cl)c1 742371111 HTLUADCJQZQJPR-MRXNPFEDSA-N 393.712 5.073 30 20 GKED N#Cc1ccc(NC(=O)c2cc3ccccc3c(Cl)n2)cc1C(F)(F)F 744370923 JVEYGPGBQZTDRC-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CNc2ccccc2Cl)cc1 745853729 VRMHMXGWQQTXGA-IBGZPJMESA-N 375.859 5.046 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](Sc2ccccc2)c2ccccc2)n1 747197306 DFGXTAVWTIFNHL-RXVVDRJESA-N 392.549 5.976 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccccc2)C2CCOCC2)cc1 766023759 XURWENMULGUEGK-FDDCHVKYSA-N 385.935 5.636 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)C1 766619256 SMZVZAZDDRYOSN-NRSPTQNISA-N 378.516 5.567 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 767701467 YHRHNZHWTAROMN-OAHLLOKOSA-N 386.517 5.036 30 20 GKED C=CCNc1ncc(C(=O)N(C)[C@@H](C)c2sc(-c3ccccc3)nc2C)s1 771031240 HREDQTIJIKVHOA-AWEZNQCLSA-N 398.557 5.006 30 20 GKED CC(C)CN(Cc1cc(Cl)ccc1OCC#N)[C@@H]1CCCc2cccnc21 775768201 ZLWCLFPVLIUJSA-HXUWFJFHSA-N 383.923 5.173 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2nnc(Cc3ccc(Cl)cc3)s2)c1 777758070 QASYEXFLRWBFSX-QGZVFWFLSA-N 398.919 5.075 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccnc4ccccc34)cc2F)c1 779595821 ONQGHMLTYFKJRI-UHFFFAOYSA-N 383.426 5.437 30 20 GKED CC(C)c1ccc(C2(O)CCC(Nc3ccccc3O[C@@H](C)C#N)CC2)cc1 781916691 WVSGWDCWRHWQOM-SJDLUZLQSA-N 378.516 5.343 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1)c1ccccc1 793484841 XTYKLRJUCKNRDL-FQEVSTJZSA-N 390.483 5.198 30 20 GKED CC(C)(Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797569040 MSNNZGWVTHIBBK-CQSZACIVSA-N 376.909 5.128 30 20 GKED O=C1/C(=C/c2cc(Br)c(Cl)s2)C[C@@H](C(=O)O)c2ccccc21 806560856 PCYDQDBXOVRTLU-FZKGZDJFSA-N 397.677 5.002 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813214790 DOESSAPHVVVGSY-JQWIXIFHSA-N 384.810 5.111 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1cc([N+](=O)[O-])ccc1F 814192127 YHDNMTMWOWBQPL-QJUYYABZSA-N 377.318 5.178 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(Cl)cncc2Cl)s1 814347756 XKQPPQQSHMFKTR-UHFFFAOYSA-N 387.336 5.395 30 20 GKED Fc1cccc(-c2nc(-c3ccsc3C(F)(F)F)no2)c1OC(F)(F)F 904917824 KJSJSNCMHIZRNL-UHFFFAOYSA-N 398.259 5.522 30 20 GKED C[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)NC2CC2)cc1 915978981 KYUDFDRJOZNQES-WMJRALALSA-N 392.286 5.163 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)ccc1O 916157647 LPUCJONLYSCKHZ-XBXARRHUSA-N 399.786 5.119 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@@H]1CCCC[C@H]1C 920078340 PTHFVYXKSFNIRD-FOIQADDNSA-N 379.529 5.524 30 20 GKED O=C(O)c1ccc(NN=C/C=C/c2ccc(OCc3ccccc3)cc2)cc1F 1776075357 BOTXWMHLISKUEG-OPLMDEQRSA-N 390.414 5.214 30 20 GKED CC(C)COc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776332966 PSIWBCYTFRGZOP-XFFZJAGNSA-N 382.456 5.103 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cnc(-c2cccs2)s1 1776354930 LOESVWCSXKAGLY-SREVYHEPSA-N 399.493 5.253 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1cc(Br)cc(C(=O)O)c1)CC2 1776374638 NGVKREUMKKSATP-FRKPEAEDSA-N 399.284 5.483 30 20 GKED N#C[C@@H](C(=O)Cc1ccsc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538249 LFBPYEUBMFMTOH-ZDUSSCGKSA-N 393.320 5.597 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 62394177 QSXVAFWXDOUHNM-UHFFFAOYSA-N 399.494 5.202 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(-n2cccc2)cc1 66801983 XKDCAILQCXKENM-QGZVFWFLSA-N 375.497 5.053 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2F)C1 66953794 RMEBYVJOXOJXBL-HZPDHXFCSA-N 383.492 5.241 30 20 GKED N#CC1(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)CCCCC1 72030041 QLEYSCWDHALBTE-UHFFFAOYSA-N 384.426 5.291 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)(F)F 115769751 UZKJDALQNDJVBM-CXAGYDPISA-N 393.434 5.506 30 20 GKED C=CCn1c(SCc2nc(-c3c(F)cccc3F)cs2)nnc1C1CC1 130886872 UWTYPXRNTZPHLL-UHFFFAOYSA-N 390.484 5.036 30 20 GKED CN(C(=O)c1cccc(NCc2ccccc2C(C)(C)C#N)c1)c1ccccc1 131580857 GORKKCNRHNUJKC-UHFFFAOYSA-N 383.495 5.376 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)s2)c(C)c1 146862778 IPVDMQUCFPSMRE-OAHLLOKOSA-N 389.505 5.527 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 156468191 SGNBTMXHBQRXQN-LBPRGKRZSA-N 391.496 5.123 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)c1 158235256 AIRPEDKIGDKOJJ-UHFFFAOYSA-N 375.859 5.270 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 173115256 SVKUCBYWKCMYMK-HKUYNNGSSA-N 381.545 5.423 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 173137383 YXPLOEPTHDAYPU-LBPRGKRZSA-N 389.318 5.262 30 20 GKED C=CCOCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 173989805 IPXVFMBFXJAMEJ-AWEZNQCLSA-N 395.311 5.276 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 181575717 MEJIOAJQAGRVGP-FDDCHVKYSA-N 396.556 5.099 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(=O)N([C@@H](C)c2ccccc2)C1 189886241 YSECCLAIKNHFMI-RXVVDRJESA-N 390.527 5.087 30 20 GKED CC(C)Sc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1 195659855 UCAHEZPJMMWCOQ-UHFFFAOYSA-N 393.537 5.358 30 20 GKED C[C@H]1CCCC[C@@H]1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 195667237 CBLQSILQLUOULW-FXAWDEMLSA-N 378.541 5.407 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2c(F)cc(C#N)cc2F)cn1 301096983 JGFFKBUFWAITQJ-UHFFFAOYSA-N 381.382 5.035 30 20 GKED CC[C@@H]1OCCC[C@@H]1/C(O)=N/Cc1nc2c(s1)C[C@H](c1ccccc1)CC2 329917468 QVHUAMIKUHLXMA-AOIWGVFYSA-N 384.545 5.077 30 20 GKED CCCN(CCCC1(C#N)CCOCC1)[C@@H](C)c1ccccc1Br 410325529 KIBACIDZSYOHES-KRWDZBQOSA-N 393.369 5.323 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)C(C)(C)c1csc(-c2cccs2)n1 425631112 BAVHOEBYSDWWHP-AWEZNQCLSA-N 395.553 5.240 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CCCOc2c(Cl)cccc21)c1ccccc1 431468172 CXRYZKZHRYRMBU-WOJBJXKFSA-N 397.906 5.288 30 20 GKED CCSc1ccc([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431931220 NTAYORIVYPTHAT-UWJYYQICSA-N 381.545 5.594 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)N[C@H]1CCCC(F)(F)C1 433225412 BKLKTNOJJAWLTG-VIFPVBQESA-N 388.283 5.006 30 20 GKED CC(C)Oc1ccc(NC(=O)N(Cc2ccccc2)Cc2ccco2)cc1C#N 435563656 FOAYOCHJEPHDAP-UHFFFAOYSA-N 389.455 5.173 30 20 GKED N#CCCC[C@@H](NC(=O)C[C@@H](c1cccs1)n1cccc1)c1ccccc1 452141417 UPXUJIFJPNUULT-UXHICEINSA-N 377.513 5.080 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N(C)CC(C)(C)C#N)c(F)c2)cc1 455516788 QFFUKAJKWUDLQL-UHFFFAOYSA-N 383.467 5.293 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccc(C(F)F)cc1 463032362 GHBCXNODPOCWTE-UHFFFAOYSA-N 394.446 5.577 30 20 GKED N#C[C@H](NC(=O)c1cscc1-c1ccccc1)c1cccc(C(F)(F)F)c1 464397170 LGIISZCTLPXCTB-SFHVURJKSA-N 386.398 5.429 30 20 GKED CCO[C@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1=CCCC1 465121429 NHTAYVGFRLOIHE-JOCHJYFZSA-N 376.456 5.195 30 20 GKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 467708940 NHFZWPUSSJDBKI-UZLBHIALSA-N 377.488 5.098 30 20 GKED N#CC[C@@H](CC(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1ccccc1 467840947 SRYWJPQSOZLSKX-BZSNNMDCSA-N 387.310 5.443 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2)ns1 469256057 OZVRDMJRDMDWFR-CQSZACIVSA-N 379.510 5.457 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3nn(-c4ccccc4)cc3C)n2)cc1 473486575 HLHVQVPFUDKSBQ-LJQANCHMSA-N 398.491 5.103 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H](COc3ccccc3Cl)C2)cc1 476509696 QVAYJKKMDQBCMV-QGZVFWFLSA-N 396.918 5.072 30 20 GKED CCN(c1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cn1)C(C)C 478104400 UVSIVBGQCKERJA-HNNXBMFYSA-N 398.919 5.069 30 20 GKED C=CCn1c(SCc2csc(C(C)C)n2)nnc1-c1cccc(OC)c1 481392709 NHGJWNNZPFRRSP-UHFFFAOYSA-N 386.546 5.012 30 20 GKED C[C@@H]1SCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)[C@H]1C 483049682 JDCCFNOBWXZBFN-DOXZYTNZSA-N 399.947 5.353 30 20 GKED C=CCN(C(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccccc1 484266798 UBGURYCWLMTFAJ-UHFFFAOYSA-N 380.538 5.577 30 20 GKED CC[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 484362503 RWODOFYWRMKFBB-ZDUSSCGKSA-N 384.888 5.410 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(Br)cc1 484795509 WWXVDUSETKSHIQ-UHFFFAOYSA-N 380.245 5.120 30 20 GKED Cc1cc(Br)cc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 486356046 UADVTADSZGJLIM-RBUKOAKNSA-N 398.304 5.061 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N[C@H](CCCC#N)c1ccccc1 487271451 RRSOFYAPFAKMKA-WMLDXEAASA-N 391.298 5.312 30 20 GKED Cc1ccccc1-c1nc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cs1 487415522 ATHWOOYIMVMIRP-IBGZPJMESA-N 375.497 5.284 30 20 GKED C=CC[C@H](C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 488649430 WTLBJGYMJOVEJW-QFIPXVFZSA-N 384.479 5.546 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(CSc2ccccn2)c1 492122387 MFAXGXOHRIVLTC-UHFFFAOYSA-N 393.512 5.230 30 20 GKED Cc1sc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2C(C)C)c(C#N)c1C 498280719 FZEJFDLSAOTVSQ-UHFFFAOYSA-N 398.919 5.451 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccccc1Cl 499956876 KFKRTVORBSRZSU-CPUCHLNUSA-N 379.674 5.131 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 504071439 NEXIXIKCYSIOBI-IBGZPJMESA-N 388.492 5.433 30 20 GKED Cc1cc(CCCC(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)c(C)s1 505928539 PUIFXOHUBRBRAL-KRWDZBQOSA-N 380.435 5.088 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(Br)cc1F 513051249 KXMMGVWWSANBRW-AWEZNQCLSA-N 391.284 5.122 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(-c2ccccc2)cc1 513531089 SAPQWSOWSBIRRK-UHFFFAOYSA-N 376.456 5.049 30 20 GKED CCCOc1cc(C)ccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518904216 BTKIWNQQEIJHRR-UHFFFAOYSA-N 387.439 5.095 30 20 GKED CC(C)c1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(C(C)C)c1 520322777 DAYXCJATWGTYNI-UHFFFAOYSA-N 399.494 6.245 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520601525 WRLGIFSKUNPSCX-HNNXBMFYSA-N 377.469 5.165 30 20 GKED COCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)c1ccccc1 521259842 SCZYHMYLEVYHHO-QZTJIDSGSA-N 397.544 5.180 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1csc2ccccc12 521787549 JZAJSELTGOGHPA-UHFFFAOYSA-N 377.513 5.141 30 20 GKED CC(C)n1cc([C@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cn1 522133461 LNKYHAFYYREUNA-INIZCTEOSA-N 389.459 5.011 30 20 GKED Cc1ccc(S[C@@H](C(=O)Nc2cc(CC#N)ccn2)c2ccccc2)c(C)c1 531924320 OBMNBEYDYCGUBB-JOCHJYFZSA-N 387.508 5.237 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)C2CCC(F)(F)CC2)c1 536246048 ZGJWLXBCMNTUPI-UHFFFAOYSA-N 388.845 5.570 30 20 GKED N#C[C@@H](C(=O)c1cccc([C@@H]2CCCOC2)c1)c1nc2cc(Cl)ccc2s1 536587749 ZSWJQQFVNKGRPN-WBVHZDCISA-N 396.899 5.334 30 20 GKED C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1cccc(C#N)c1 537295114 LJUNEXJVWYATMB-LJQANCHMSA-N 378.479 5.262 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 538434614 QELOIBGDQPMLNV-HZPDHXFCSA-N 378.419 5.047 30 20 GKED CC[C@H](CSC)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158476 DLVDVSUJWZFOHO-HRAATJIYSA-N 381.545 5.069 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@@H](NCc1ccc(C#N)cc1F)c1ccc(Cl)cc1)C2 548992820 DJSBCGSAFRDUFG-FUDKSRODSA-N 397.925 5.054 30 20 GKED CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@H](C)c1ccc(C#N)cc1 558060453 OEUZHJUHLPENQM-CQSZACIVSA-N 390.314 5.277 30 20 GKED N#Cc1cc(Br)ccc1CSCc1nc(C(F)(F)F)cs1 568319402 DANLKPOHBRRYMK-UHFFFAOYSA-N 393.253 5.229 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 577895388 HHZNCMPOYFHWKB-RNODOKPDSA-N 398.293 5.101 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1 579618530 ZQOPMTFIGOAEJV-AWEZNQCLSA-N 382.529 5.498 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCCC3(CC2)CC3)cc1 599724146 FDXIBCDEZONTGL-UHFFFAOYSA-N 389.499 5.130 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3Cl)cn2)c1 603623659 LEXJSTXHBZELMB-OALUTQOASA-N 389.842 5.141 30 20 GKED CSc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 609378573 PIIKKCXYDHAOOV-UHFFFAOYSA-N 396.459 5.685 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)on1 609427859 XTJLIRWZRJJCBC-CYBMUJFWSA-N 397.887 5.642 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(Sc2ccccc2)c1 610876403 TVUDOQAUZVWQCT-UHFFFAOYSA-N 377.469 5.379 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-n4ccc(C)n4)cc3)n2)cc1 613319030 MSNHWZKWVLDUGG-HXUWFJFHSA-N 398.491 5.103 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2s1)c1nc(-c2ccc(Cl)cc2)cs1 613319180 URVGYONPPIMFNF-HNNXBMFYSA-N 394.908 6.168 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2sc3cccc(C)c3c2Cl)cc1 614999862 PBAQJNNJSOEVBM-UHFFFAOYSA-N 384.888 5.031 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ncc(-c3ccccc3F)s2)c(Cl)c1 619820353 PGXBNJXPNZJIQY-UHFFFAOYSA-N 392.242 5.380 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)NCc2ccc(C#N)c(Cl)c2)c1 619827321 AGOPNEIEDKVKOT-UHFFFAOYSA-N 393.874 5.025 30 20 GKED C=CCC[C@H](C(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccccc1 681653694 WFIXPPSNRALULG-JYJNAYRXSA-N 393.371 5.326 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cccc(OCCCC#N)c1 727781238 HVTWZOWGXUFVFS-OUKQBFOZSA-N 388.492 5.697 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)/C=C\c2ccc3ccc(Cl)cc3n2)c1 728012173 BCWDHIPONRHTFT-VURMDHGXSA-N 399.784 5.013 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc3cc(OC)ccc3c2)c2ncc[nH]2)c1 729240464 NOOHSSFZKHWHPZ-LPYMAVHISA-N 384.435 5.004 30 20 GKED CCN(C(=O)/C=C\c1ccccc1C#N)[C@H](c1cccnc1)c1ccc(F)c(C)c1 729254534 FDEBGAAVFWNFFE-RCZVZRIZSA-N 399.469 5.052 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3csc(-c4ccc(F)cc4)n3)c2c1 734307828 SZFDJIIILWTYGY-RMKNXTFCSA-N 378.428 5.335 30 20 GKED CON=Cc1ccc(C(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)cc1 734454131 UFVXMAVVNFKRDR-UHFFFAOYSA-N 397.434 5.260 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)OC(=O)CCc1ccc(C#N)cc1 734738422 GZWCDQRIRYELQR-HNNXBMFYSA-N 394.471 5.366 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3c[nH]cc3-c3ccccc3)c2)s1 739750499 WFKLGXRUUFGPDT-UHFFFAOYSA-N 383.476 5.212 30 20 GKED COc1ccc(Cl)c(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740443447 ODFAQDRLLRZWLW-UHFFFAOYSA-N 397.887 5.270 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1sc(-c2ccc(C)cc2C)nc1C 741641213 GNDUEOGLVQJQPI-UHFFFAOYSA-N 394.471 5.139 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)cc1OCCCC#N 747361452 NLDHVDXQEFQOHY-DAXSKMNVSA-N 395.842 5.673 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccc(C#N)cc1 748679291 DDQWDZZPRPDTRT-ZDUSSCGKSA-N 382.872 5.182 30 20 GKED N#CCC[C@@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 749035036 NLJIXVALJLIUFV-MTMYEVCSSA-N 392.808 5.447 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1 756514787 HKOYWLRVWILGRJ-PLACYPQZSA-N 380.532 5.065 30 20 GKED C[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)c1ccc(-c2cccc(C#N)c2)cc1 757660047 ZECRCTGWJQDXGM-JKSUJKDBSA-N 387.439 5.251 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C[C@H](Cc1ccccc1)c1ccccc1 760800267 FTGAOWIKZMYDNN-FQEVSTJZSA-N 388.442 5.083 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3cscc3Cl)SC2=S)cc1Cl 771849915 ITIGAELSQPRQJE-DXNYSGJVSA-N 397.333 5.332 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 774450228 SFXDHXIGIAZOTA-UTKZUKDTSA-N 389.326 5.915 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 785769294 POQOTBXSVNVMBL-NRFANRHFSA-N 386.517 5.090 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C#Cc1ccc(C(F)(F)F)cc1 790617748 UMIRNBXQKSREDH-CQSZACIVSA-N 388.414 5.090 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1c(Cl)cccc1Cl 797572766 IBTSYDCKTFZBRB-QWRGUYRKSA-N 381.328 5.727 30 20 GKED C=CCCc1ccccc1NCc1nnc(-c2ccc(Br)s2)o1 799971872 ACINETGIESVJJE-UHFFFAOYSA-N 390.306 5.291 30 20 GKED CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)CCCCCC#N 807934927 OUFZJOVDSYVTEZ-UHFFFAOYSA-N 388.464 5.143 30 20 GKED Cc1cc([C@H](NCc2ccc(OCC#N)cc2)c2cccc(Cl)c2)c(C)s1 810224265 GRANNMFSSZOVPA-JOCHJYFZSA-N 396.943 5.800 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(C2=CCCC2)cc1 810530363 BNOLYHRSYYITRY-JOCHJYFZSA-N 380.447 5.368 30 20 GKED CC(/C=C\C(=O)c1ccc(N2CCOC2=O)cc1)=C\c1ccccc1OC(F)F 811689936 POJYPIRGNCQTPS-DBLDUACQSA-N 399.393 5.087 30 20 GKED N#Cc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c(C(F)(F)F)c1 811691640 PEWNSFTXRLWCNC-SREVYHEPSA-N 378.353 5.535 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2csc(-c3ccccc3F)n2)cc1 812245121 PXIQPEIRCPUVJF-MSKHEQNASA-N 378.428 5.136 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCCC(F)(F)C2)cc1 813761147 KRAYELZXTDXTNT-DYESRHJHSA-N 397.469 5.679 30 20 GKED CCOc1cc(/C=C/C(=O)c2cnn(-c3ccccc3)c2C)cc(Cl)c1OC 818253341 SLCPUOXYAVYFBO-ZHACJKMWSA-N 396.874 5.138 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433788 SEEBIWXMNOBBON-KDOFPFPSSA-N 375.394 5.052 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@H]1Cc1ccccc1)c1nc2ccccc2n1C(F)F 850768895 AVKANZCGDDRSFC-OKZBNKHCSA-N 393.437 5.267 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C3[C@H]4CCCCCC[C@H]34)n2)cc1 850791571 VVAGVFMWCDHASE-OKZBNKHCSA-N 375.497 5.074 30 20 GKED O=C(Cc1coc2cc(F)ccc12)NC(CCC(F)(F)F)CCC(F)(F)F 855929667 DLEVHYTUUZRMDC-UHFFFAOYSA-N 399.306 5.284 30 20 GKED CC(C)(CC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CC(F)F 878202414 ODRWLQIZGSWPPB-IUCAKERBSA-N 383.323 5.084 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1)C(=O)O 900069340 YFUOYNJNZKZHCP-GOSISDBHSA-N 377.843 5.171 30 20 GKED CC(C)Sc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 917119638 QUTJRUHKVCEOAT-HSZRJFAPSA-N 386.520 6.095 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1csc(Cc2ccccc2)n1 918733325 OSWBACJOEXOJKU-UHFFFAOYSA-N 376.403 5.303 30 20 GKED COc1cc(/C=C2/COc3c(ccc(Cl)c3Cl)C2=O)cc(Cl)c1O 920066673 UWEHTJLBIGBLBJ-WTKPLQERSA-N 385.630 5.020 30 20 GKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 920791066 SYKYIZRJWLODIN-YRGRVCCFSA-N 380.435 5.708 30 20 GKED C[C@H]1C(=NNc2c(Cl)cc(Cl)cc2Cl)CC[C@@H](C(=O)O)C1(C)C 1776014724 TWYNTSUGBCLQKQ-WPRPVWTQSA-N 377.699 5.572 30 20 GKED Cc1cc(C=NNc2ccc(C(=O)O)c(F)c2)c(C)n1-c1ccc(C(C)C)cc1 1776074414 ZGMCPNZVPICRST-UHFFFAOYSA-N 393.462 5.501 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776144205 BOQJEFXGUVHUJS-XBXARRHUSA-N 398.867 5.627 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1c(Cl)cccc1Cl 1776354800 YLSVJOCJKMWVBF-FPLPWBNLSA-N 379.239 5.375 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cscc1C(F)(F)F 1776355225 WNQVFPMBQYMBMW-HWKANZROSA-N 384.375 5.148 30 20 GKED CCCCCCCC[C@@H](C)C(=O)NCc1cc2sc(C(=O)O)cc2s1 1776786012 AMLFLGWWNOQFKS-CYBMUJFWSA-N 381.563 5.664 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(C)C)CC1 1829071309 SRECXDDPACCTHU-NRFANRHFSA-N 390.612 5.035 30 20 GKED CCOc1cc(/C=C/C(=O)c2cc3ccccc3o2)cc(Br)c1O 6537221 MFOCFOIXASXWGU-BQYQJAHWSA-N 387.229 5.196 30 20 GKED C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(C(C)(C)C#N)cc1 25438131 DAWPWFYXILKDGP-GFCCVEGCSA-N 377.271 5.201 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc1 45029246 PQJKIQWUPUWEIM-UHFFFAOYSA-N 396.903 5.233 30 20 GKED N#C[C@H](C(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccn1 49457111 CTCYCVHNFKVQRA-WSNITJDQSA-N 384.279 5.009 30 20 GKED N#Cc1c(NC(=O)CCSc2c(F)cc(F)cc2F)sc2c1CCCC2 60430307 BEDSOJVKGRJKEA-UHFFFAOYSA-N 396.459 5.037 30 20 GKED CC(C)Oc1cccc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 69285653 KSTLRKGPRXBVJG-MRXNPFEDSA-N 384.888 5.156 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccco1)C1CCCC1 69344376 KORBXVJFGPKKQU-MRXNPFEDSA-N 383.517 5.651 30 20 GKED CCCCCCCCOc1cc2nonc2cc1OCCCCCCCC 97972198 BVHGFOJOMOBBKV-UHFFFAOYSA-N 376.541 6.701 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(Cl)ccc2Br)c1 121051350 SNSGMBSUJYLQFI-UHFFFAOYSA-N 393.668 5.037 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)c2)cc1 124779918 QBYRJUCWMZXQIO-HXUWFJFHSA-N 396.475 5.066 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1)c1ccccc1 127567958 LJNHQWVGOBJNDT-AWEZNQCLSA-N 393.874 5.566 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)OC3CCCCCC3)n2)cc1 163111137 IJXSVSXZAAORQA-KXBFYZLASA-N 398.528 5.123 30 20 GKED COc1ccc(-c2cnc(CNc3ccccc3SC[C@H](C)C#N)o2)cc1 174310307 FSRJAORRIOZPDY-OAHLLOKOSA-N 379.485 5.214 30 20 GKED C[C@@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cccc(C#N)c1 174431398 LOOKXKSEGROOFE-CYBMUJFWSA-N 387.430 5.551 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(CCc1cccc(F)c1)C1CCCC1 180013671 DVKXMQQTSLWOIA-QGZVFWFLSA-N 395.478 5.136 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12 182132345 QJNNZNKLJZWGII-OAHLLOKOSA-N 383.407 5.038 30 20 GKED N#Cc1ccc(CN2CCC(Nc3ccc(CCC(F)(F)F)cc3)CC2)cc1 182336956 QWSSALBSMCUAOZ-UHFFFAOYSA-N 387.449 5.130 30 20 GKED CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 185349610 TUPGFFSNHZVYFE-WBVHZDCISA-N 397.500 5.054 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC(c2ccncc2)CC1 192273465 HIOMLMSMQJRYCO-UHFFFAOYSA-N 399.519 5.124 30 20 GKED C=CCn1c(SCc2cc(-c3ccc(Cl)cc3)no2)nnc1-c1ccco1 247967492 BZGWCSMSSOKBKO-UHFFFAOYSA-N 398.875 5.325 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)[C@@H](c2ccco2)C1 248556074 KRTKQHFDPJDBTR-JFIYKMOQSA-N 383.517 5.679 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 304120796 ZZUASGWFIKBOEL-UXHICEINSA-N 385.294 5.183 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccc(OC2CCC2)c(F)c1 328867006 CBHDAFPAVXMFNW-CYBMUJFWSA-N 390.480 5.052 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 409472682 ZAYJOTAKSQMYSW-MSOLQXFVSA-N 387.310 5.406 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(C(F)(F)F)cc1 409667998 WAYPSNLTQLIQJS-KGLIPLIRSA-N 392.446 5.842 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N(C)CC(C)(C)C#N 433260177 KNQCYJINJXVERX-UHFFFAOYSA-N 383.517 5.001 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1cc(C#N)oc1C 435683869 SMKRZYOMAUWUNJ-JTQLQIEISA-N 385.876 5.036 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 436125056 BYHRFXYAYWKZRX-UHFFFAOYSA-N 392.455 5.772 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc3ccn(CCC)c3c2)cc1 438299174 FRGWTEQRCZTSSQ-UHFFFAOYSA-N 391.475 5.003 30 20 GKED Cc1csc([C@H](NCc2cc(F)c(C(F)(F)F)cc2F)C(F)(F)F)n1 451139009 CLTDNGUALNWFIQ-NSHDSACASA-N 390.299 5.142 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccc3nccnc3c2)c1 460344007 VBVNAKSJHSJVSR-UHFFFAOYSA-N 398.853 5.002 30 20 GKED CC[C@@](C)(NCCC(C#N)(c1ccccc1)c1ccccc1)c1nccs1 472579486 OTVZOZMLPAIKJH-JOCHJYFZSA-N 375.541 5.258 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1Cl 477778338 ZTICDRBAWFONDO-QWHCGFSZSA-N 391.899 5.756 30 20 GKED C=C(C)[C@H](NCc1nn(-c2ccccc2)c2c1CCC2)c1ccc(F)c(F)c1 481597784 UAHIKPLJIPPZFO-QHCPKHFHSA-N 379.454 5.046 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1)c1ccc(F)c(F)c1 481598085 YJUMZRWSFLOLPZ-DJJJIMSYSA-N 387.405 5.430 30 20 GKED CN(C(=O)c1sccc1C#N)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482785349 ZPRHNHSAZDFZIQ-GOSISDBHSA-N 384.863 5.274 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(OC2CCC2)c(F)c1 483518602 MRMUXOLOOKKVDH-CTNGQTDRSA-N 393.462 5.061 30 20 GKED N#CC[C@H](CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1)c1ccccc1 483966780 YOOJBJFWHPXHCR-OAHLLOKOSA-N 399.878 5.688 30 20 GKED N#CCCC[C@@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1ccccc1 487357532 RRCQEZPGRMHMCA-XMMPIXPASA-N 394.478 5.467 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccccc3-c3c(F)cccc3F)o2)cc1 488179393 CGGWDRFLJBPSPC-UHFFFAOYSA-N 388.377 5.166 30 20 GKED CCC(C)(C)OCc1cccc(N[C@@H](C)C(=O)Nc2ccccc2C#N)c1C 494917936 AHYZUQJVWNWGPO-KRWDZBQOSA-N 379.504 5.011 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)CC(C)(C)C#N 498920343 ZBFQUCKYJPLSNY-UHFFFAOYSA-N 392.478 5.610 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)CSc1ccc(C#N)cc1 499137543 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Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 509670996 NCXYOXUTEQJGFM-UHFFFAOYSA-N 395.418 5.566 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cnn1C1CCCCC1 512719926 HATWNYHJTNULHE-SFHVURJKSA-N 390.512 5.310 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 513195858 IQCIKQLPHKBVTL-LJQANCHMSA-N 399.494 5.118 30 20 GKED N#C[C@]1(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)CC12CCCC2 516907423 VOFXIZMJVUCPQI-NRFANRHFSA-N 399.947 5.130 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4cnco4)cc3)cc2)c1 518234889 DXMHCJCWSSHZSV-UHFFFAOYSA-N 381.391 5.258 30 20 GKED COc1ccccc1C(C)(C)NCc1cccc(OCc2ccccc2C#N)c1 518277454 NQCJIKSPIUXVIY-UHFFFAOYSA-N 386.495 5.171 30 20 GKED C[C@@](C#N)(NC(=O)CCOc1ccccc1-c1ccccc1)C1CCCCC1 518426943 VMQKGDKYNOAAIF-DEOSSOPVSA-N 376.500 5.101 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1F 520923424 MPETWNXFPFRUED-FOIQADDNSA-N 392.861 5.877 30 20 GKED C=C1CCN(C(=O)c2ccc(Oc3ccc(Br)cc3)c(F)c2)CC1 521725781 KCBMBHMJDFGQAX-UHFFFAOYSA-N 390.252 5.173 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCOc2c(CC)cccc21 523916813 HNCVMJCXJWVXDE-QGZVFWFLSA-N 390.936 5.185 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc2ccccc2c1 525234291 DBRAAZWKPSGKOK-INIZCTEOSA-N 375.497 5.556 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3CCC[C@H]2CC3)cc1Cl 530979540 AGIPCVXANTXPLS-CMKODMSKSA-N 379.891 5.544 30 20 GKED COc1ccc(CN2CCS[C@@H](C)[C@@H]2c2ccccc2)cc1OCCCC#N 536662061 NFBYYTIGRGWUHK-FDDCHVKYSA-N 396.556 5.056 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H](c2cccc(F)c2)c2ccccn2)CC1 536830374 DIJLBPASFJRKLH-JYNIAERNSA-N 385.486 5.304 30 20 GKED N#CCCCOc1cccc(N[C@H]2CCc3c(F)cc(Br)cc32)c1 538526411 GTZAJGUIEYUVHT-IBGZPJMESA-N 389.268 5.370 30 20 GKED CC(C)N(C(=O)c1ccn(-c2cccc(C#N)c2)n1)c1ccc(Cl)c(Cl)c1 542152498 BSUDSFTWRYUOBT-UHFFFAOYSA-N 399.281 5.106 30 20 GKED COc1ccc([C@H](NCc2cccc(C#N)c2F)c2ccccc2Cl)cc1 544084794 JVBNMDBBZUVWKI-QFIPXVFZSA-N 380.850 5.239 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccccc1 554444207 ATEKZBMXJRPNNY-DLBZAZTESA-N 379.529 5.838 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccs2)o1)c1nc(-c2ccncc2)cs1 566936030 PFWRAEIBNAXKHS-CYBMUJFWSA-N 377.450 5.017 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 567466468 KETUVXJLLWPVTE-OAQYLSRUSA-N 381.907 5.155 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(-c4nc5ccccc5s4)o3)[nH]c12 571599482 JOWWNPHVPNIBRS-CYBMUJFWSA-N 398.447 5.231 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)sc12 576785894 BYZVFZDUNMALKL-CYBMUJFWSA-N 381.407 5.445 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OCc1ccccc1 581146573 WAPKLWQTZIDXOD-OFVILXPXSA-N 384.523 6.351 30 20 GKED CC(C)N(C(=O)C1CCN(c2ccc(C#N)cc2F)CC1)c1ccc(Cl)cc1 588906967 JUWJRHFLLOSCLJ-UHFFFAOYSA-N 399.897 5.009 30 20 GKED C[C@H](NC(=O)CC1(C#N)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 590341685 NWRDCQAMMHPYCW-LBPRGKRZSA-N 378.419 5.305 30 20 GKED COc1ccc(CNCCc2ccc(Cl)cc2Cl)cc1OCCCC#N 604512432 NGUPJUBNXBNIRG-UHFFFAOYSA-N 393.314 5.017 30 20 GKED COc1cc(F)ccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609723131 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731041725 RZSPLCZOLAOULU-UHFFFAOYSA-N 394.559 5.176 30 20 GKED FC(F)(F)c1cc(NN=C2CCC[C@@H]2c2ccccc2)nc(-c2ccccn2)n1 733079980 OJNTWTPPHOZGBB-OAHLLOKOSA-N 397.404 5.293 30 20 GKED C=CC[C@H](NC(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1)c1ccncc1 734460639 ROZKVRIQJOEIQS-NRFANRHFSA-N 391.540 5.305 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)CCc3cccc(F)c3)n2)cc1 744035002 MAUNLGHDNQPLFJ-OXJNMPFZSA-N 392.499 5.703 30 20 GKED CCC[C@H](CC1CCCCC1)C(=O)OCc1nnc(-c2ccc(C#N)cc2)o1 745027240 NRPAWNOFJFDZJV-LJQANCHMSA-N 381.476 5.038 30 20 GKED CCOc1ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1OC 746053192 IQTZEYKHRVUPHW-UHFFFAOYSA-N 388.467 5.157 30 20 GKED C=CCc1ccc(OC(=O)c2ccccc2SCc2cc(C)no2)c(OC)c1 746135054 OURLRQZLIWBITR-UHFFFAOYSA-N 395.480 5.232 30 20 GKED CC(C)c1ccc(C2(O)CCC(=NNc3ncnc4sccc34)CC2)cc1 753924331 VOOGPDQSSNPIKF-UHFFFAOYSA-N 380.517 5.044 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Cl)c(Cl)c2O)c1 756708619 DZYFOEXXGLCSMT-OCCSQVGLSA-N 379.287 5.231 30 20 GKED CC(C)(c1ccc(NC(=O)c2ccccc2SCC#N)cc1)C(F)(F)F 760665880 IZMFHHASRYWDFE-UHFFFAOYSA-N 378.419 5.394 30 20 GKED C=C[C@@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1 764751017 XDSUSIADMJAEHF-JTQLQIEISA-N 390.270 5.061 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1csc(C(C)C)n1 768772846 KCTZCARMNQFRLT-UHFFFAOYSA-N 379.411 5.065 30 20 GKED Cc1ccc(C)c(Oc2ccc(CN[C@@H](C)c3ccc(OCC#N)cc3)cn2)c1 776153574 FJBLYWYLZXKMHX-IBGZPJMESA-N 387.483 5.244 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CCCC1 780672734 IXDWULGRADWLKQ-HNNXBMFYSA-N 383.879 5.222 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 780672941 AAKMTKMOSKGFNQ-STQMWFEESA-N 392.286 5.509 30 20 GKED CC(=O)CCCCCCC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782829690 ZZTSKIYQVQTPKG-LJQANCHMSA-N 376.500 5.332 30 20 GKED N#CC[C@H](CC(=O)O[C@H](c1cccc(Cl)c1)C(F)(F)F)c1ccccc1 796694475 VITJBSWIOJRIJY-RDTXWAMCSA-N 381.781 5.574 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CSc2cccc(C(F)(F)F)c2)s1 797566997 CHRVINHKEIKVAK-CYBMUJFWSA-N 398.475 5.428 30 20 GKED N#CCC[C@@H](Nc1cc(Br)cnc1Br)c1ccccc1 804566000 WYHMYZDPMPEOAI-CYBMUJFWSA-N 395.098 5.064 30 20 GKED C#C[C@@H](NC(=O)Nc1cc(Cc2ccccn2)ccc1C)c1ccc(Cl)cc1 810235316 PICNKSJDLPDQQT-OAQYLSRUSA-N 389.886 5.130 30 20 GKED CC(=NOCc1cncc(C(F)(F)F)c1)c1csc(-c2ccccc2)n1 812306923 IXCJSZKHMKPUGB-UHFFFAOYSA-N 377.391 5.165 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2cc([N+](=O)[O-])ccc2F)cc1 814191763 SXPSQUDULWUGNH-JYRVWZFOSA-N 377.371 5.306 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(F)c3ccccc23)ccc1OC 815592462 JDBLQGBDDSZYQV-WMZOPIPTSA-N 392.474 5.519 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1nc(C2CC2)cs1 842942843 QVJPWSSUILACTE-ZDUSSCGKSA-N 379.312 5.526 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C(F)(F)Cc1ccccc1 855930182 DLGZAOKXVYYPRZ-UHFFFAOYSA-N 391.302 5.034 30 20 GKED Cc1nc(C)c2c(C)c(C=NNc3nc(-c4ccccc4)cs3)sc2n1 874092333 OYDUSWPWZBHVLI-UHFFFAOYSA-N 379.514 5.186 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2cccc(C(=O)Nc3ccccc3)c2)CCC1 899392066 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C=CCCC1(C(=O)O)CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1 1776171631 OHNQXNMMSUWZEW-UHFFFAOYSA-N 399.918 5.765 30 20 GKED C=CCOc1ccc(CNc2ccc(S[C@H](C)C(=O)O)cc2)cc1Cl 1776184587 PSBAADXOIFUQFE-CYBMUJFWSA-N 377.893 5.082 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776950905 LRDBSFFCBORZKE-CXUHLZMHSA-N 388.488 6.060 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cnc(-c3ccccc3)s1)C2=O 1777683143 WFTJHHRSLNUHDJ-VBKFSLOCSA-N 375.449 5.111 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCCC#N)n2Cc2ccco2)cc1 5858358 GWGAVIFMKIUMAN-UHFFFAOYSA-N 380.517 5.280 30 20 GKED C[C@@H]1CCc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cc2C1 41559387 DPDDJLGDRDIXDP-DGCLKSJQSA-N 385.439 5.108 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccc(C)o2)cs1 54897873 VEVQXHGSEVGQBV-RMKNXTFCSA-N 386.860 5.279 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nc(-c2ccc(Cl)cc2)no1 66861111 LOSZFCJAWIWSEP-ZDUSSCGKSA-N 384.892 5.396 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1)C1CC1 108237292 XJROOURGTCICCC-QGZVFWFLSA-N 393.556 5.175 30 20 GKED C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)c1ccc(C#N)cc1 118174012 VNTKDQKAOFRPJE-CQSZACIVSA-N 385.496 5.486 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccccc1OC1CCC1 118208641 DBCWSLYEYFLTMQ-UHFFFAOYSA-N 399.450 5.238 30 20 GKED CCOc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(C(F)(F)F)c1 119961393 KECBCXDVSHEVTM-KRWDZBQOSA-N 391.393 5.271 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128825812 YGNQTFSTNQNTKI-MBNRZODZSA-N 387.508 5.392 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@H]3CCO[C@@H](c4ccccc4)C3)c2)cc1 133215609 CMDQMORWQYDTIS-XUZZJYLKSA-N 398.462 5.001 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 145310509 ORLIONATYXLFCH-BWKNWUBXSA-N 396.490 5.123 30 20 GKED C=CCn1c(C)nnc1S[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 155325584 BNAOTFHNUHJHIF-SNVBAGLBSA-N 395.315 5.588 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 175687784 FWUNPTKJUPBEMW-UHFFFAOYSA-N 385.448 5.219 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)C1c2ccccc2-c2ccccc21 180014440 OTBCMAYILMITDH-MRXNPFEDSA-N 383.451 5.211 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1c(C)nc(SC)nc1C 189887013 USEOPIXIIVSONO-UHFFFAOYSA-N 383.561 5.239 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1nc2ccccc2s1 191426345 MDSMSGNOGAFROV-MRXNPFEDSA-N 393.556 6.373 30 20 GKED Cc1ncc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 193730137 QLYJUBWIEGJMOE-UHFFFAOYSA-N 392.484 5.088 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)cc1 303031854 UIGFRGJCYWCJSP-UHFFFAOYSA-N 399.281 5.233 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c1 303475822 NVECDUKFMJIDLT-MOPGFXCFSA-N 388.389 5.130 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@@H]2CCCc3sc(Cl)cc32)C2CC2)cc1 426082257 XAXFIMFATCRSJQ-QGZVFWFLSA-N 385.920 5.025 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC3(CCC3)[C@H]2C2CC2)cc1 427590610 CBLAGBCAXXOUCW-JOCHJYFZSA-N 388.536 5.255 30 20 GKED CC[C@H](C)Oc1cc(C)ccc1CNC(=O)N[C@@H](CCCC#N)c1ccccc1 431279738 HDUMXHFIIVTHRL-UGKGYDQZSA-N 393.531 5.407 30 20 GKED COc1cccc([C@H](NCc2cc(C#N)ccc2OC)c2ccccc2Cl)c1 434886978 LIRAXDYINJZVPI-QHCPKHFHSA-N 392.886 5.108 30 20 GKED CC[C@@H](C#N)Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1Cc1ccco1 436041776 DXIGUPPMGFHJOB-SFHVURJKSA-N 380.517 5.278 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)c(OC(F)F)c1 437155174 LPYLGLMWHRZQKF-NRFANRHFSA-N 382.385 5.178 30 20 GKED CCO[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 437469131 GLLBHEQHBFVCOJ-QFIPXVFZSA-N 390.414 5.206 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(OCC2CC2)c(F)c1 438842335 OVVBWAKHWDYMQN-KKSFZXQISA-N 395.478 5.020 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 438845969 GPURGGUVPHQUGU-SCLBCKFNSA-N 376.287 5.399 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)NCC3CCC(C#N)CC3)s2)cc1 441027556 UXUIEGYNCMJOCD-WWDZGPRUSA-N 396.560 5.117 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457740158 GQSNNOLWIRLTHG-LDYMZIIASA-N 395.265 5.404 30 20 GKED CSc1cccc([C@H](NCc2ccc(F)c(C#N)c2)c2ccc(F)c(F)c2)c1 467770077 JUJAENXECBUJNL-QFIPXVFZSA-N 398.453 5.577 30 20 GKED C=CCCN(C)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 468198103 CDRCFWVMCJRLGT-AUPQCFOMSA-N 397.403 5.143 30 20 GKED CCCCn1ncc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1C(C)C 469871007 QYKAQRRJDZOEIH-UHFFFAOYSA-N 391.519 5.317 30 20 GKED CCC(=O)c1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 471208835 WBBWXXWUZZUTCA-UHFFFAOYSA-N 398.462 5.177 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1)c1ccccc1 472507247 VDCXOGKVRBBOFG-OXQOHEQNSA-N 381.435 5.193 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cc(F)c(Cl)cc1Cl 474188329 GYCBDWPLSKAZEK-JSGCOSHPSA-N 379.262 5.397 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1nc2c(s1)CCCC2 475578489 PLDZGPGNCXFILC-UHFFFAOYSA-N 397.588 5.628 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(F)ccc1SCC(F)F)c1ccccc1 476073243 PNJWMQMBKKFECE-CQSZACIVSA-N 378.419 5.209 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F 477590755 SVHGRZQBFUQKGQ-DOMZBBRYSA-N 387.471 5.427 30 20 GKED CCO[C@H](C)c1nc(COc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 480337485 SEOOJIBPTQHEKW-OAHLLOKOSA-N 380.469 5.484 30 20 GKED CC[C@@H](NCc1ccc(C#N)cc1Br)c1ccccc1OC(F)F 481204711 ZDOVLUVFMAJFNA-MRXNPFEDSA-N 395.247 5.163 30 20 GKED COc1cc(C#N)ccc1CNC1(c2cc(C(F)(F)F)ccc2Cl)CC1 484994336 FWZMBLURDPEAMU-UHFFFAOYSA-N 380.797 5.018 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 485471355 YURFNNSCNDNVKO-LBPRGKRZSA-N 386.464 5.321 30 20 GKED C=CCSc1ccccc1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 486414692 XEZXDHOMJZFVEA-CTNGQTDRSA-N 394.584 5.090 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccccc1 487208925 KDNPWQBEIKSOLE-KRWDZBQOSA-N 396.288 5.095 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1csc(-c2cccs2)n1 488771429 VEAJXHHWYLZQIJ-UHFFFAOYSA-N 383.445 5.449 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1nccc2ccccc12 490974824 PFBPQWAKQVPYSK-QGZVFWFLSA-N 393.368 5.242 30 20 GKED CCN(C(=O)c1cccc(CC#N)c1)[C@H](c1ccc(Cl)cc1)c1cccnc1 496519533 SFMNZTXJJBZMCR-JOCHJYFZSA-N 389.886 5.053 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)cc1OCC(F)F)c1ccccc1 497528817 FAOYDRXRKMYGTH-HNNXBMFYSA-N 393.821 5.150 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCc1ccc(-c2ccccc2)o1 501021452 PCXZXRKVUXNEQJ-UHFFFAOYSA-N 396.446 5.577 30 20 GKED Cc1ccccc1CCC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 504340449 BMTWQUXFZKPYOQ-UHFFFAOYSA-N 386.470 5.167 30 20 GKED Cc1ccc(Br)c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1 505332377 WHRYYXIXZTXULL-AWEZNQCLSA-N 398.087 5.059 30 20 GKED Cc1ccc(S[C@@H](C(=O)N2CCC(C)(C#N)CC2)c2ccccc2)c(C)c1 507827852 GTTNJSYPWCLFCL-OAQYLSRUSA-N 378.541 5.289 30 20 GKED CCN(C(=O)c1sc(-c2ccc(Cl)s2)nc1C)c1ccc(C#N)cc1 510378347 PMNPSXHWAPHLHZ-UHFFFAOYSA-N 387.917 5.372 30 20 GKED CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 510856416 FFIKLNWASXCTFU-UHFFFAOYSA-N 391.496 5.775 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)c2)cc1 512533509 FNLBUVHHTYRBTH-XMMPIXPASA-N 387.483 5.705 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c(C)n1C1CCCCC1 513219110 NTMSPOZHICOMOH-GOSISDBHSA-N 389.421 5.514 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CSc1ccccc1 514536536 MKZBVDSIIJRSBU-UHFFFAOYSA-N 390.483 5.331 30 20 GKED CN(Cc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)C1CCCCC1 515798687 CHPXHGCEZYYLHE-XZOQPEGZSA-N 387.527 5.065 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(Cl)c3Cl)cc2)cc1 520326078 KHIVHFJYMQMTOD-UHFFFAOYSA-N 397.261 6.104 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1F 520923427 MPETWNXFPFRUED-MGPUTAFESA-N 392.861 5.877 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc(-c4ccccc4)nc3)n2)cc1 522231422 SCASJUHPVKCHGW-LJQANCHMSA-N 396.475 5.066 30 20 GKED C=CCN(C(=O)c1sc(CC(C)C)nc1C)c1nc(-c2ccccc2)cs1 524100552 SCCBHPLDRVYYTL-UHFFFAOYSA-N 397.569 5.606 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 530789964 MUFTWXHTDKLFFM-ZDUSSCGKSA-N 377.941 5.441 30 20 GKED Cc1cccc(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c1Br 535299186 PTMVTZYFGIGZEB-CYBMUJFWSA-N 398.087 5.059 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C1CC1 535712533 QMIRFGXXOGVWMV-INIZCTEOSA-N 384.483 5.522 30 20 GKED C=CCC[C@H](N[C@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 536839470 MSOHUUIIJFYVAC-APWZRJJASA-N 390.449 5.720 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H](c2ccccc2)[C@@H]2CCOC2)c1 537865411 ZUSMKDILVLJDID-AOYPEHQESA-N 398.506 5.005 30 20 GKED C=C(C)[C@H](CC(=O)N(CCC)[C@H](c1cccnc1)c1ccc(F)c(C)c1)OCC 538554695 CPPYXQBWWFAQPJ-UPVQGACJSA-N 398.522 5.228 30 20 GKED CSc1ccc(C)c(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 540549041 KZSANUVASSRVEU-UHFFFAOYSA-N 378.453 5.013 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(-c2ccc(Br)s2)s1 542984474 MVVYTMDTKOEYMG-UHFFFAOYSA-N 383.336 5.003 30 20 GKED CN(C(=O)c1ccc(NCc2ccc(CC#N)cc2)cc1Cl)C1CCCCC1 543166562 UEKBOWMWOBIXQA-UHFFFAOYSA-N 395.934 5.423 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC(C)(C)C1 543294848 WAGUNFZNICRYEA-SFHVURJKSA-N 391.515 5.232 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OCc2nccn2C)cc1 551211182 NMRJTGMIXUIBSC-AUSIDOKSSA-N 388.515 5.085 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 551212027 PTAISIFBRFETEF-VGOFRKELSA-N 394.465 6.527 30 20 GKED C=CCn1c(SCCCOc2cccc(Cl)c2)nnc1-c1ccoc1C 553312700 VADNETMSTNNXPZ-UHFFFAOYSA-N 389.908 5.247 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC=C(c4ccco4)C3)c2)cc1 554447429 UOIACGFDEIEPBG-UHFFFAOYSA-N 385.423 5.265 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC2(CCC2)C[C@H]1C 555804722 HUPMSXNCAYOHDC-GOSISDBHSA-N 389.499 5.242 30 20 GKED N#Cc1cccc(C2(N[C@@H]3CCc4c(Br)cc(Cl)cc43)CC2)c1 556608979 LFKZPKJWQZGSNH-GOSISDBHSA-N 387.708 5.240 30 20 GKED COCC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 556610022 PQFNRZNBWOACLA-CWTRNNRKSA-N 381.278 5.433 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCCOCc1ccccc1 558513815 GFNLEKNPOKXGMM-UHFFFAOYSA-N 384.479 5.088 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cccc(Cl)c3Cl)cc2)ccn1 566649145 GFLIAHYHOIAFPU-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)C1 575967380 ONOLCMCVQJQLBN-JCGIZDLHSA-N 379.426 5.024 30 20 GKED CCC(CC)N(CC)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 578363284 NPLVMABBHBNUOJ-UHFFFAOYSA-N 379.504 5.374 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)CCCCCC#N 588164493 WXOWXUSFOPFAJB-UHFFFAOYSA-N 383.879 5.313 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)sc1-c1ccc(F)cc1 588348504 OZDBOYUDHWRRRF-MRXNPFEDSA-N 389.455 5.239 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c1 589741009 PQRFKUAOHIWXMJ-UHFFFAOYSA-N 389.499 5.534 30 20 GKED CCCC[C@H](CC)COCc1cccc(NC(=O)N2CCC[C@H](CC#N)C2)c1 596705125 VIUDNNNYKLPUJK-VQTJNVASSA-N 385.552 5.577 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N(Cc1ccc(F)cc1)CC1CC1 604623198 MRBDZLVOGLZDQU-UHFFFAOYSA-N 399.469 5.065 30 20 GKED C[C@@H](SCc1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(C#N)cc1 609825341 RWXUFEWJEWHACM-GFCCVEGCSA-N 389.402 5.621 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc3ccsc3c2)cc1F 610313319 DJUVERUYALZYOC-UHFFFAOYSA-N 389.411 5.352 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)c1ccc(Oc2ccccc2Cl)cc1 610504073 YKECAVZVZJLBAV-UHFFFAOYSA-N 382.769 5.050 30 20 GKED CC(C)(C#N)CCN1CCC([C@H]2CCCCCN2C(=O)Nc2ccccc2)CC1 611462578 QGJFBXAONAIFTM-JOCHJYFZSA-N 396.579 5.115 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1C 611568003 JRMWPKNBUBODEY-UHFFFAOYSA-N 377.831 5.268 30 20 GKED Cn1c(SCCCCC#N)nc2scc(-c3ccccc3Cl)c2c1=O 612645370 HGTWADDXNPNBRG-UHFFFAOYSA-N 389.933 5.101 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1 650024985 ZDWNTWZBHLEPSR-VABKMULXSA-N 392.499 5.168 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@H]1CC[C@@H](C(F)(F)F)C1 671817374 HEQRHMPWBYSQBD-WCBMZHEXSA-N 375.259 5.258 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](C)c1ccccc1C(F)(F)F 672239379 PUVJELHGFXJVFG-MRXNPFEDSA-N 393.453 5.191 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2CCc3ccccc3C2)cc1 732536215 FGIQQIGXADFKLV-DFBJGRDBSA-N 380.491 5.476 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(N2CCSCC2)c(C)c1 732698689 FCJMWDQFTHIMTE-UHFFFAOYSA-N 387.593 5.148 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)n1 735765949 XHRONNMOMCLBQE-RBPRZQKGSA-N 384.932 5.330 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)Cc2cc(-c3ccccc3)on2)c1 736012449 IJZOBXWAGKHXJU-UHFFFAOYSA-N 398.487 5.160 30 20 GKED CN(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)[C@H]1CCc2ccccc21 740483436 AOZPWVPNKLYTCA-NRFANRHFSA-N 387.508 5.116 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)N[C@H]2CCc3ccccc3C2)cc1 742984827 NMSCHWSJYWDAAV-BJKOFHAPSA-N 397.547 5.186 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1C 743034716 BEMDTRGNIBTDRS-UHFFFAOYSA-N 391.471 5.915 30 20 GKED CC[C@@H](C)c1ccc(-c2cc(C(=O)N3CCC(C#N)CC3)c3ccccc3n2)cc1 747198095 LKGZOZFXAPIZKH-GOSISDBHSA-N 397.522 5.791 30 20 GKED N#Cc1ccsc1C(=O)OCc1csc(-c2ccc(C(F)(F)F)cc2)n1 748098196 VAKCDKWCZPDMCA-UHFFFAOYSA-N 394.399 5.119 30 20 GKED C#CC[C@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 756995832 KLRYAZYRHTWAAC-IBGZPJMESA-N 386.442 5.683 30 20 GKED CC[C@@H](SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 757749418 IZTPOHAYKPBCGL-GHTZIAJQSA-N 392.549 5.871 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)s1 763476522 KKNSOXOVJABQFE-INIZCTEOSA-N 376.481 5.160 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 765911243 RKEKIUALESOMHY-DOMZBBRYSA-N 399.313 5.114 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1sc2cc(Br)ccc2c1Cl 766583452 BOXVZEMHLUYCNE-INIZCTEOSA-N 399.741 5.375 30 20 GKED CC(C)(C#N)CCCCOC(=O)Cc1csc(-c2ccccc2Cl)n1 768524433 VELQQOYJFHDYFD-UHFFFAOYSA-N 376.909 5.269 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)Cc1ccc(O[C@@H](C)C#N)cc1 769469952 IIQYFFAMUCKPIC-FUHWJXTLSA-N 391.540 5.602 30 20 GKED N#C[C@H](COC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)Cc1cccs1 772735727 KHMNUPDATDIXPX-GFQQVXNGSA-N 399.821 5.273 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1cn2ccccc2c1C#N 773372127 OQQKQODDCKREGS-UHFFFAOYSA-N 376.460 5.079 30 20 GKED N#CC1(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)CC1 775832129 WYUPJDNPIXVRCV-QINSGFPZSA-N 386.476 5.244 30 20 GKED Cc1nc(CSc2ccc(C(=O)OCc3ccc(CC#N)cc3)cc2)cs1 776110273 MYVYDPPPOTZGMJ-UHFFFAOYSA-N 394.521 5.167 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2cccc(CN3CCCC3=O)c2)cc1 776834051 RMRMYJMZEFLGRQ-QGZVFWFLSA-N 384.907 5.113 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccc(SCc2cccnc2)cc1 780978585 IGFBAXUDYBKDPP-FQEVSTJZSA-N 385.533 5.284 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@H]1/C=C/c1cccs1)c1ccncc1 783230394 MCUJIFYEUSSSBJ-PSVQYUNKSA-N 381.545 5.428 30 20 GKED N#CCCn1cc(/C=C2/CCc3[nH]c4ccccc4c3C2=O)c(-c2ccccc2)n1 788353214 DWOKXRJAQNFSSC-SDXDJHTJSA-N 392.462 5.158 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2CC[C@H](C(F)(F)F)C2)c1 796350348 AYXDTBINESBNBO-HOTGVXAUSA-N 377.431 5.241 30 20 GKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)Cc2cccc(OCC#N)c2)c1 797364505 FUDIAIUWFVWSPD-UHFFFAOYSA-N 390.870 5.399 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccn(-c2cccc(C#N)c2)n1 798419754 FJFSLRLQHNZUSC-UHFFFAOYSA-N 390.512 5.195 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(C(F)(F)F)cc1 798827438 HGEYCERSCMNBHN-IINYFYTJSA-N 392.377 5.434 30 20 GKED CC(C)(C(=O)OCc1coc(-c2cccc(Cl)c2)n1)c1cc(F)cc(C#N)c1 803925847 CLAKHMXQQBMNSL-UHFFFAOYSA-N 398.821 5.027 30 20 GKED C[C@@H](c1ccccn1)N(C(=O)CC1(C#N)CCCCC1)c1ccc(N(C)C)cc1 857602397 FRYHYVXMJXIKSQ-IBGZPJMESA-N 390.531 5.106 30 20 GKED CCC(C#N)(CC)C(=O)O[C@@H](C)C(=O)N1c2ccccc2Sc2ccccc21 860193839 DWIUBKRWHAFGTM-HNNXBMFYSA-N 394.496 5.078 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\c3nc4ccccc4s3)cn2)c1 915175128 MPEBJASKCVVRRE-LUAWRHEFSA-N 398.447 5.007 30 20 GKED COc1cccc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)c1OC(F)F 916154746 SHOCAPIYPKVWQH-RAXLEYEMSA-N 387.426 5.183 30 20 GKED O=C(O)Cc1ccc(NN=C2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1 1776084889 VWPNTCWDVKERLA-HNNXBMFYSA-N 377.271 5.356 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1sc(CC)cc1Br 1776786680 AJBPJZFPBCWLQN-ZDUSSCGKSA-N 390.387 5.366 30 20 GKED CCN(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776855394 BETIRJRQRYWTQF-QBFSEMIESA-N 391.492 5.466 30 20 GKED COc1ccc2ccnc(C(=O)/C=C/c3csc4ccc(C(=O)O)cc34)c2c1 1777374378 PTTFHQNHWGQBHZ-ZZXKWVIFSA-N 389.432 5.052 30 20 GKED Cc1cc(COc2ccc(/C=C3/C(=O)c4ccccc4[C@@H]3C)cc2)oc1C(=O)O 1777423190 AKTSUMSZWDWPMX-NGZBARDMSA-N 388.419 5.249 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(C)c(C)cc2C)nnc1-c1ccoc1C 35767175 URFRQDDERHGVEN-KRWDZBQOSA-N 395.528 5.321 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1nc(-c2ccccc2)oc1C 55416675 YHRHGJLRPFPTHZ-UHFFFAOYSA-N 386.904 5.122 30 20 GKED N#CCCCOc1cccc(NC(=O)CC(c2ccccc2)c2ccccc2)c1 59771152 LGGVBVKRDCXIQL-UHFFFAOYSA-N 384.479 5.530 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c3c(cccc13)CC2 63390199 MJYSXJYIORNIRU-UHFFFAOYSA-N 387.439 5.067 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 65870130 GVRJVBBHJYTIMW-UHFFFAOYSA-N 376.500 5.051 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccccc1F 66917455 HSLARZGSUMQBMX-AWEZNQCLSA-N 382.460 5.096 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@@H](C#N)c3nc4ccccc4s3)cs2)c1 97261627 SHKRXLGWYYSRAR-MRXNPFEDSA-N 389.505 5.147 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc(Cl)c1Cl 120003306 BJUXQUNBROEKLM-MRVPVSSYSA-N 384.675 5.085 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 120790966 DYSKOZVWFZILJS-UHFFFAOYSA-N 380.806 5.301 30 20 GKED CCc1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)co1 123699905 QEEGLJIKXCRWBV-LLVKDONJSA-N 392.267 5.157 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C1CC1 124947574 GCAQVPCOPLVAIA-LSDHHAIUSA-N 382.533 5.236 30 20 GKED N#C[C@@H](C(=O)c1scnc1C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 127894589 QQNOQHNFMQRJSM-ZDUSSCGKSA-N 385.901 5.287 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3sccc3C)n2)cc1 129592767 CHZNARZHIVFHFV-GVDBMIGSSA-N 394.521 5.169 30 20 GKED Cc1c(CSC(C)C)cccc1NCc1nnc(-c2ccc(C#N)cc2)o1 134000257 KWMSSUCSBKGGLJ-UHFFFAOYSA-N 378.501 5.170 30 20 GKED COc1ccc(C[C@H](C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 136902853 XFWLUOTWUBRCSZ-LRDDRELGSA-N 384.888 5.013 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)ccc1Cl 151847221 PKLHYFCWTBQERL-INIZCTEOSA-N 377.856 5.134 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 153967112 LWVBRUCREOMMNW-ZWKOTPCHSA-N 381.545 5.342 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 173002055 BAJXKMYTZNYJNP-CYBMUJFWSA-N 389.318 5.404 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 174000874 NQUARCKKDQYMKP-CJNGLKHVSA-N 385.389 5.016 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 174002912 SSRLIKLRXAAQAC-IACUBPJLSA-N 388.826 5.208 30 20 GKED CC[C@H](C)N(CCCC(C)(C)C#N)CC(=O)Nc1ccccc1C(F)(F)F 175075694 IZFDLSUMKXMLAX-HNNXBMFYSA-N 383.458 5.074 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1)c1ccccn1 179791178 IZJJADHVRDEEGZ-CQSZACIVSA-N 388.370 5.199 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1ccccc1O[C@@H](C)C#N 180027804 WJHBXSQEBHEKMV-DZGCQCFKSA-N 386.521 5.091 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)nn1-c1cccc(Cl)c1 180490274 FTCVVDMEXYWQLO-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cc2sc3ccccc3c2s1 182046236 UOGZOOPCAYIRAN-GFCCVEGCSA-N 378.478 5.659 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 184019238 UZQLWBHDZLQGFR-INIZCTEOSA-N 398.422 5.285 30 20 GKED COc1ccsc1C(=O)/C=C/c1csc(N(C(C)=O)c2ccc(C)cc2)n1 184770267 TTZUKAQLPPLIHW-RMKNXTFCSA-N 398.509 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(OC)c(OCC)c1 191428422 QUFRRAJPTPAMPS-UHFFFAOYSA-N 382.504 5.268 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1ccccc1S[C@@H](C)CC#N 255902274 LRVYUZIOTYYHGS-BHWVZIDZSA-N 380.513 5.217 30 20 GKED CCOc1ccc(-c2nc(C[S@](=O)CCCCC(C)(C)C#N)cs2)cc1 277818296 JBSYOZFMOQDCPZ-AREMUKBSSA-N 390.574 5.178 30 20 GKED Cc1cc(C)c2ncc(C#N)c(N3CCC(C(F)(F)F)(C(F)(F)F)C3)c2c1 301389625 FXNYQGQFGQXQAC-UHFFFAOYSA-N 387.327 5.044 30 20 GKED Cc1ccccc1CSCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 303449783 JGVVQPCHDMSUJY-GOSISDBHSA-N 378.522 5.228 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](C)c1nc(C(C)(C)C)cs1 328799526 HHWFKIQAZQDURS-CHWSQXEVSA-N 393.578 5.165 30 20 GKED N#C[C@H]1CCC[C@]2(C1)Nc1ccccc1C(=O)N2c1cccc(C(F)(F)F)c1 414170047 BMQQWUUDWUJGKH-XOBRGWDASA-N 385.389 5.188 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H](C)c1ccc(C2CC2)cc1 419341195 NYJDSJARVIKOMD-IAGOWNOFSA-N 393.556 5.105 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425631291 OUGJDNSSMPGHDP-AWEZNQCLSA-N 386.293 5.163 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(OCc2ccccc2)cn1 429032651 XTSSSFFACHFTHI-UHFFFAOYSA-N 387.483 5.160 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nc3ccccc3c(=O)n2CCC2=CCCCC2)C1 430103850 HHNYTLMWKPQSPG-MSOLQXFVSA-N 379.529 5.071 30 20 GKED Cc1cc2sc(NC(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)nc2cc1F 434530034 LNBGORUMZFKBFF-CRAIPNDOSA-N 394.475 5.048 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(C2CC2)[C@H](C)c2ccccc2Cl)cc1 437873799 RATHZUHIZIAAFX-OAHLLOKOSA-N 397.906 5.013 30 20 GKED O=C(c1ccc(C(F)(F)F)c(F)c1)N(Cc1cccs1)CC(F)(F)F 439160544 VCXPAQCOYCLCEK-UHFFFAOYSA-N 385.304 5.111 30 20 GKED N#Cc1ccccc1SCc1ccnc(-c2ccc(Br)cc2)n1 440845054 KPTMYYANRVGFHP-UHFFFAOYSA-N 382.286 5.070 30 20 GKED Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1sc2c(c1C#N)CCCCCC2 447391808 LEFCBCLRUGJXOF-CQSZACIVSA-N 385.558 5.102 30 20 GKED O=[N+]([O-])c1cnc(C(F)(F)C(F)(F)F)cc1NCc1ccc(C(F)F)cc1 447686985 SMSZGTBVHNLHOO-UHFFFAOYSA-N 397.250 5.194 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c1 458801989 OLELBLWYZHKFIF-FYYLOGMGSA-N 375.516 5.238 30 20 GKED CC(C)N(Cc1cccc(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458805094 TXQCIVKXPOTYRQ-NRFANRHFSA-N 383.923 5.695 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c(C)c1 458855411 YAVYDELWABIFEC-FYYLOGMGSA-N 375.516 5.238 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)Nc3cc(C#N)ccc3OC(C)C)c2)n1 470794019 IBYOMVVBHDHBNB-UHFFFAOYSA-N 390.443 5.261 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3oc(C)nc23)cc1 470894419 HTUFIHRNJJWSMK-UHFFFAOYSA-N 399.406 5.061 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Br)cc1C(F)(F)F 471166740 ZITZLBTWSCTYKX-UHFFFAOYSA-N 391.231 5.012 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2ccc3cc[nH]c3c2)cc1 473573575 WFPGOHFTJMUTTA-UHFFFAOYSA-N 381.435 5.417 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc(OC)c(OC)c1 476778309 WRRXSLQZPPTFIN-UHFFFAOYSA-N 395.499 5.157 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2ccc(CCC(F)(F)F)cc2)cc1 477141327 UNWJVQBBOMBVPB-UHFFFAOYSA-N 378.394 5.068 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480659727 DMJMZSZKCATIHX-RNODOKPDSA-N 376.403 5.240 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1Oc1ccncc1 483201235 POPDUGAKXMMASJ-OAQYLSRUSA-N 379.419 5.221 30 20 GKED C=CCn1c(S[C@@H](C)c2cc([N+](=O)[O-])ccc2C)nnc1-c1ccoc1C 484588064 FOUGZRWWQZWEBW-AWEZNQCLSA-N 384.461 5.102 30 20 GKED N#CCCN(C(=O)c1cc(-c2ccccc2)ns1)C12CC3CC(CC(C3)C1)C2 486588140 QMYFEXXBZUWMDG-UHFFFAOYSA-N 391.540 5.135 30 20 GKED N#CCCC[C@@H](NC(=O)CCCOc1cccc2ccccc12)c1ccccc1 487403346 IXTSRNCETIQZDQ-HSZRJFAPSA-N 386.495 5.550 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)NCCCC1(C#N)CCOCC1 499604633 FOQORIHCHLPGQL-IBGZPJMESA-N 378.944 5.126 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc(C4CC4)nc4ccc(F)cc34)CC2)cc1 504013397 PLZQQOUCGRPBCY-UHFFFAOYSA-N 397.453 5.052 30 20 GKED C[C@H](CC#N)N(C)C(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 505163539 DZYYQIAHSXGBDM-QGZVFWFLSA-N 393.918 5.036 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2)CC1 511135289 NMWXATCUXQSFDK-UHFFFAOYSA-N 386.480 5.125 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCCCC[C@@H]1c1ccc(C(F)(F)F)cc1 513140061 BEFNKXCOVPTKDA-GOSISDBHSA-N 395.469 5.662 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 514708843 KXBKFUQSURSWPH-AWEZNQCLSA-N 387.508 5.367 30 20 GKED N#Cc1ccc(SCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1 515572174 MPAQOIWJAIQVHI-GOSISDBHSA-N 391.323 5.321 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc(Cl)c(Cl)c1 518319966 FCCIGSRCULNXFE-KEYYUXOJSA-N 379.674 5.131 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccc3)cc2)cc1 519052281 ONWXMFFPQWKIPK-QHCPKHFHSA-N 383.451 5.720 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 521954813 AYJPDBNHQRQXRJ-ROUUACIJSA-N 387.310 5.407 30 20 GKED Cc1c(NCc2cccc(OCCCC#N)c2)cccc1OCC(F)(F)F 533208703 YVULJCXUGIGGCZ-UHFFFAOYSA-N 378.394 5.231 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2cccc3c2CN(c2ccccn2)C3)cc1 534594762 JNLRKIVYQHKCLD-UHFFFAOYSA-N 397.482 5.047 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)c(OC(F)F)c1 537078225 WYFCVYWTADDNHW-HNNXBMFYSA-N 388.311 5.082 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 540311381 WCXFXRMABQGQMU-KRWDZBQOSA-N 387.458 5.267 30 20 GKED C=CCCC[C@@H](C)NC(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 540540453 VTSISRXBYNRLMR-UTKZUKDTSA-N 398.934 5.062 30 20 GKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)N2CCC(CC#N)CC2)c1 541972989 CQWLHRXKEXDSKE-UHFFFAOYSA-N 383.879 5.598 30 20 GKED N#CCC1CCN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CC1 542853560 FZNNCZPVJSBZNX-DNQXCXABSA-N 387.527 5.183 30 20 GKED CCC(C)(C)OCc1ccccc1NCC(=O)Nc1ccccc1SCC#N 543659188 YHAFSINWKSQJIV-UHFFFAOYSA-N 397.544 5.058 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)[C@@H](C#N)c2ccncn2)c1 545446862 XTYVYFIDVGWLAM-KRWDZBQOSA-N 379.872 5.080 30 20 GKED Cn1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1C1CCC1 559081092 AJHXKAQSCNRBKX-UHFFFAOYSA-N 399.494 5.190 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCCc2nc(-c3ccccc3)sc21 561130821 IDXQFMJRRLJLIV-NHCUHLMSSA-N 385.536 5.726 30 20 GKED CC1(C#N)CCN(c2nnc(-c3sc4ccccc4c3Cl)n2C2CC2)CC1 565126621 TZOGIHPGQFMCKZ-UHFFFAOYSA-N 397.935 5.278 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(-n2cncn2)cc1Cl 570230275 OCPSFFNTLCDFDK-IERDGZPVSA-N 379.895 5.006 30 20 GKED Cc1c(C(=O)N2CCC[C@H]2CC(=O)c2cccs2)sc2ccc(C#N)cc12 572065296 KKUVQVRNHVESJI-HNNXBMFYSA-N 394.521 5.021 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)c2ccccc21 578160419 KFVUZTYRGBNVPY-QAQDUYKDSA-N 391.902 5.274 30 20 GKED N#Cc1cnc2c(Br)cccc2c1N1CCC(CC(F)(F)F)CC1 588051318 WRDGZMNPFXWHEV-UHFFFAOYSA-N 398.226 5.038 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Cc1cccc(OCc2cccc(Cl)c2)c1 592609640 DMWZWFIMRCGBKJ-UHFFFAOYSA-N 397.824 5.038 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCc2c(CC#N)cccc2C1 599699578 LEPNJQMSKKATGL-UHFFFAOYSA-N 375.516 5.590 30 20 GKED N#CCCCOc1cccc(NC(=O)CCCc2ccc(Cl)c(Cl)c2)c1 603972311 LBJYZGJNODOHCP-UHFFFAOYSA-N 391.298 5.637 30 20 GKED C[C@@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 606190467 OERVTLLSZIRIHZ-JTQLQIEISA-N 393.302 5.996 30 20 GKED Cc1ccc(CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C2CC2)o1 609208912 KPGMSWMPIGOXTJ-UHFFFAOYSA-N 387.439 5.449 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H](C)c1ccsc1 609967899 OOYAFWYLQMJFOR-INIZCTEOSA-N 378.472 5.404 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccs1 609968364 YUICQYYZQFRFMD-KSSFIOAISA-N 380.900 5.799 30 20 GKED C[C@@H](NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1cccc(C#N)c1 610364600 SDAULVGHQIBDAO-OPAMFIHVSA-N 390.483 5.408 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ncc(-c2ccc(Cl)cc2Cl)o1 611077964 VIPANKYHOQZSML-OLZOCXBDSA-N 386.282 5.932 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 611300673 VHWCBYPBYNJMGC-KRWDZBQOSA-N 387.508 5.045 30 20 GKED CCCCOCCOCc1cccc(N[C@@H]2CCCc3cc(C#N)ccc32)c1 611482573 RSNJTNVJRISHOB-XMMPIXPASA-N 378.516 5.381 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 613560848 NYBXNNATJZQPLK-ZETCQYMHSA-N 399.228 5.047 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21 622150968 VABZULGYHXSGMK-HXUWFJFHSA-N 386.442 5.063 30 20 GKED COc1ccnc(CN[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1F 656691154 WLUFIBKHSULSPM-SECBINFHSA-N 396.306 5.118 30 20 GKED N#Cc1ccc(CN[C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)cc1Cl 669829207 IZCDRQDUZQYAAB-QHCPKHFHSA-N 399.881 5.407 30 20 GKED Cc1cc(F)ccc1/C=C1/SC(=S)N(c2ccc(C#N)c(Cl)c2)C1=O 726628151 YWABWACKDHZDHY-FRKPEAEDSA-N 388.876 5.065 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)/C=C/c1ccccc1C#N 729419445 LATMSNIATIXROK-TZIYXEQSSA-N 391.471 5.020 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1/C=C/C(=O)c1c(Cl)nc2ccccn12 737445907 IAXGUAHEXLKZRZ-ZHACJKMWSA-N 397.265 5.031 30 20 GKED CSCCCCC(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 740535264 LTUZSYOPULBDEW-JRQWYPPZSA-N 388.602 5.320 30 20 GKED COc1ccc(/C=C/C(=O)c2cnn(-c3ccc(C#N)cc3)c2C)c2ccccc12 741845412 VOQXGFBNAUALPX-UKTHLTGXSA-N 393.446 5.110 30 20 GKED Cc1c(N=Cc2cc3ccccc3nc2O)cccc1C(=O)Nc1ccccc1 748147480 GKOKFHWVNFLNGS-UHFFFAOYSA-N 381.435 5.252 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@@H](C)c1ccc2ccccc2c1 753389785 JAMZVTISCWDNOH-BTYIYWSLSA-N 380.447 5.325 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc2ccccc2c1 753392422 BAKQIIHTOVZGAU-UGSOOPFHSA-N 394.833 5.083 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(-c3ccc4c(c3)C[C@H](C)O4)cc2)cc1 756991786 WLJXBYDYUTYTHR-OALUTQOASA-N 398.506 5.258 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(F)cc2OC(C)(C)C)c1 766492751 WCYNFAKLXBONGW-QGZVFWFLSA-N 399.466 5.006 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc3ccsc23)cc1 767960430 RCVCCJCGPYIUND-KUHUBIRLSA-N 376.481 5.376 30 20 GKED CCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCCc2cccnc21 774233333 OKVZXZXCHSJHOY-GOSISDBHSA-N 384.936 5.093 30 20 GKED C[C@H]1Cc2cc(-c3ccc(CN[C@H](C)c4ccc(OCC#N)cc4)cc3)ccc2O1 776171458 NIEAWVIJQNTMNZ-RBUKOAKNSA-N 398.506 5.430 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(NC(C)=O)c(Cl)c2)cc1 776805116 PGJQRBGOOQVHNM-ZDUSSCGKSA-N 379.287 5.603 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)[C@@H](C)c1ccccc1 780675295 PLCDLHMHPIXXNI-PMACEKPBSA-N 399.494 5.773 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(CC[C@H](O)c2ccccc2)cc1)c1ccccc1 793629815 SEFQBSLHLBQUCR-NOZRDPDXSA-N 398.506 5.379 30 20 GKED N#Cc1cc(NC(=O)c2cc(C3CC3)cnc2Cl)ccc1Oc1ccccc1 793877330 VSNJHWIWOAMVQH-UHFFFAOYSA-N 389.842 5.529 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C(Cc2ccccc2)Cc2ccccc2)n1 798839200 WROYWBBAALUQLP-OAQYLSRUSA-N 388.536 5.544 30 20 GKED O=C1/C(=C/c2ccc(SC(F)(F)F)cc2)C[C@@H](C(=O)O)c2ccccc21 806561213 SHCDJOBSUPACSJ-ONOODXEBSA-N 378.371 5.137 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 808385284 OGKWQCUYNIDTHT-JTQLQIEISA-N 380.300 5.201 30 20 GKED C[C@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790599 IOJBNLUSQWVSFB-VXNVDRBHSA-N 380.313 5.080 30 20 GKED Cc1ccc([C@@H](C)c2noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)cc1 848607166 SLTAVWQNXOCKQF-AEFFLSMTSA-N 398.507 5.180 30 20 GKED CCOc1ccc([C@H](NC(=S)Nc2ccccc2C#N)C(C)C)cc1OCC 915998974 NBHGHRXXVGMNSJ-OAQYLSRUSA-N 397.544 5.039 30 20 GKED O=C(/C=C\c1cc2ccccc2nc1N1CCOCC1)c1ccc2ccccc2c1 916136221 CDLYHRVOVPURFT-QXMHVHEDSA-N 394.474 5.121 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1OCc1ccccc1 1776033238 RNMJAQQQQFTFBM-UHFFFAOYSA-N 394.858 5.453 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(Oc2ccccc2)c(F)c1 1776084015 NNCNLYIPWDSGGF-UHFFFAOYSA-N 378.403 5.081 30 20 GKED C=CCOc1c(Cl)cc(/C=C\c2ccc3cc(C(=O)O)ccc3n2)cc1OC 1776183175 VZPUECRUZLKWEE-DAXSKMNVSA-N 395.842 5.330 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](CC(=O)O)c2ccccc2)cc1 1776786222 CDYBSUCBWZTJMT-JOCHJYFZSA-N 383.532 5.384 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1 24697626 CIOJRTOHVQUSDD-UHFFFAOYSA-N 383.476 5.406 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(O[C@H](C)C#N)cc3)s2)cc1 107718288 TVTRGPHVWQVFTG-SJORKVTESA-N 391.540 5.569 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)/C=C/c1ccccc1C#N 107800666 GUGFOBOTRNGNKF-WYMLVPIESA-N 396.450 5.163 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ncc(-c2ccc(Cl)cc2)o1 108355403 WPJJUYANSCITND-AWEZNQCLSA-N 383.904 5.859 30 20 GKED COc1ccccc1CN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CC1 108533293 YKVCJCGVXYZXLF-INIZCTEOSA-N 395.528 5.143 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Oc2cccnc2)cc1 109074491 KWPLOBRRWHRIRN-UHFFFAOYSA-N 384.888 5.417 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-n3c(C)ccc3C)cc2)cc1 111183284 XZGBGCIZNMHBKE-UHFFFAOYSA-N 387.483 5.053 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ncccc1C)C(C)C 115841050 UQCHNHSHIUGDHK-KRWDZBQOSA-N 377.941 5.200 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1nc2cc(Cl)ccc2s1 116593397 VGYAUVNNHQCQSC-GRYCIOLGSA-N 388.826 5.208 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cc2ccccc2o1 175846660 GJSLLCRHWIVLFE-OAHLLOKOSA-N 379.485 5.348 30 20 GKED Cc1coc(-c2cc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)ccc2C)n1 178388212 JWNISQAOWSHJDS-UHFFFAOYSA-N 386.455 5.027 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](C)Cc1ccsc1 188911913 BYDPRIMNVVZLRW-HOTGVXAUSA-N 387.574 5.485 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(N(C)C3CCCCC3)cc2)cc1 237494173 HNOPTWOCIBSGGR-IBGZPJMESA-N 377.532 5.036 30 20 GKED CC(=NNc1oc(C)nc1C#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 254593492 NUGIFXGHBRVJSF-UHFFFAOYSA-N 390.390 5.438 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@H]3CCSc4ccccc43)c2)cc1 303205703 PQKWLGAVBCVUGY-NRFANRHFSA-N 386.476 5.317 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 303251849 BCPLDQZWHLXHID-CQSZACIVSA-N 375.925 5.217 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 303752453 CEYNMJAQVWQERR-UHFFFAOYSA-N 388.389 5.324 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCN1C(O)=Nc1ccc2oc(CC(C)(C)C)nc2c1 329332588 WRKPWKSZKPUHAC-KRWDZBQOSA-N 395.507 5.139 30 20 GKED Cc1cc([C@@H]2CCCN2C(O)=Nc2cccc(CSC3CCCC3)c2)on1 329556545 HKGHFBUCGVNDNU-IBGZPJMESA-N 385.533 5.541 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)Nc1cc(C(F)F)ccc1Cl 416911142 BGDQTWHNUCWSBM-MRXNPFEDSA-N 375.806 5.348 30 20 GKED C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)Nc1ccc(CC#N)cc1Cl 421111662 KXAPVIYTQFNWBA-OAQYLSRUSA-N 385.870 5.174 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425755677 KDRYZTRYTROCGW-DNVCBOLYSA-N 389.421 5.263 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nnc(Cc3ccccc3)n2-c2ccc(Cl)cc2)C1 430097195 GTFAHGJFACAWSW-APWZRJJASA-N 394.931 5.296 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430608392 FFLJGIWLGNQRBV-AWEZNQCLSA-N 399.903 5.548 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)c1nc2cccc(Cl)c2s1 436398981 BWDGOLGXQQDCOV-UHFFFAOYSA-N 399.903 5.033 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 445787343 NZSUQJNNFMNURN-UHFFFAOYSA-N 384.435 5.029 30 20 GKED Cc1cccc(F)c1NC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 461923544 WWITZIRUGCYVMD-CQSZACIVSA-N 394.290 5.578 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)[C@@H](C)c2cccc(C#N)c2)ccc1Br 462345410 XQQQYKVSWFSDFP-YWZLYKJASA-N 397.316 5.096 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC(c2ccccc2F)C1 463009670 JNMNFNSWQJDRCW-UHFFFAOYSA-N 391.286 5.103 30 20 GKED C=CCOCCCC(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 463842944 VNENZWRYLXTVNU-QHCPKHFHSA-N 394.540 5.217 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1Cl)C1CCCC1)c1ccc(C#N)cc1 465651211 CYMDSGBBXDGZAZ-INIZCTEOSA-N 381.907 5.427 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 469497528 JZUWLNZHFBPUDN-OAQYLSRUSA-N 387.527 5.347 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(OCCF)c1 470118994 DVMXOFTTZSLTBM-UHFFFAOYSA-N 392.455 5.310 30 20 GKED COc1ccc2c(c1)CN(C(=O)Nc1cccc(C#N)c1C)[C@@H](c1ccccc1)C2 470425768 UGRBJVUBGXZGTI-XMMPIXPASA-N 397.478 5.207 30 20 GKED C=CCc1cc(C(=O)Nc2cccnc2-c2csc(C)c2)cc(OC)c1OC 474327023 LUVXLPPBEAFQDD-UHFFFAOYSA-N 394.496 5.117 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2ccc(C)cc2)c2ccccn2)ccc1OC 475360175 GPLSXEQPJSBFOB-VWLOTQADSA-N 388.511 5.233 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)c(Cl)c1)c1nccc2ccccc12 483227330 LDXJTKJOOFCDIP-CQSZACIVSA-N 385.648 5.141 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cc(C(F)(F)F)ccc1F 484319174 NZQFKEQTFPAOHQ-GFCCVEGCSA-N 379.275 5.519 30 20 GKED Cc1nc(CCC(=O)N[C@H](CCCC#N)c2ccccc2)oc1-c1ccccc1 487156177 MNFYDLSQAJGHDZ-OAQYLSRUSA-N 387.483 5.134 30 20 GKED CC[C@@H](C)n1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccccc1 504319773 AWQPCOGYKQNOAJ-XLIONFOSSA-N 376.529 5.452 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CCC2 505092292 HRKVSHWCMHTMCB-ZZEZOPTASA-N 395.506 5.535 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1-c1nc2ccccc2s1)c1ccc(C#N)cc1 505332689 GCDZGQZAJNPJDN-OAHLLOKOSA-N 398.491 5.718 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CC[C@@H](C(F)(F)F)C1 506788616 HHOKDGNRIISVAR-JKSUJKDBSA-N 388.389 5.576 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccccc2)CCCC1 506866948 YKKYUJATHYWHCC-QGZVFWFLSA-N 379.529 5.672 30 20 GKED CN(Cc1ccc(C#N)cc1)Cc1cnc(-c2ccc(Br)cc2)s1 507250508 AYBJVKFEWATDRH-UHFFFAOYSA-N 398.329 5.076 30 20 GKED C[C@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510509019 SQXVHKIFNVEZCV-MRXNPFEDSA-N 375.428 5.086 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1sccc1C(C)C 512842556 AGNSPZUKIKPHRF-UHFFFAOYSA-N 376.481 6.096 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)c1ccc(COc2ccccc2C#N)o1 515581961 HSNUNSJOCRDPJF-UHFFFAOYSA-N 396.446 5.156 30 20 GKED N#CCCCOc1cccc(NC(=O)CSc2cc(Cl)ccc2Cl)c1 516006882 BWPZYZULHVYVTO-UHFFFAOYSA-N 395.311 5.407 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 521887132 BVKWJZVBFBTYIL-FQEVSTJZSA-N 396.277 5.359 30 20 GKED Cc1ccc(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c(Cl)c1 522074920 GJMZXERWOUTEBJ-UHFFFAOYSA-N 383.879 5.032 30 20 GKED N#CCN(C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1)C1CC1 524643672 JVKLOJCEVMIEAH-UHFFFAOYSA-N 391.323 5.414 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1cc(Cl)ccc1C#N 532444324 ZYBFSHXHNOQFPY-UHFFFAOYSA-N 398.249 5.329 30 20 GKED C[C@@H](NCc1nc(-c2cccs2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541084071 CTNBIVRBZUUXNU-OAHLLOKOSA-N 386.480 5.188 30 20 GKED CCC(=O)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 542130861 WAAADDDFYQGVHM-KRWDZBQOSA-N 394.883 5.546 30 20 GKED Cc1nc(CCCC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 543915300 FKZMNTLUMJMMAC-INIZCTEOSA-N 389.524 5.190 30 20 GKED COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)c2ccc(CC#N)cc2)c1 544253204 FEYBNKNKKVNKOF-LOSJGSFVSA-N 396.490 5.132 30 20 GKED N#Cc1ccc(-c2nc(-c3ccc(Oc4cccc(Cl)c4Cl)nc3)no2)[nH]1 545833716 CYXGJNWYTFQRFC-UHFFFAOYSA-N 398.209 5.097 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1F 551205303 JDGSSGABTDDAQE-AUUYWEPGSA-N 375.285 5.674 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc2c(c1)CCCC2=O 559186857 QNIWEXALZUJDPY-UHFFFAOYSA-N 396.446 5.430 30 20 GKED COc1ccc([C@@H](CCC#N)Nc2cnn(Cc3ccc(Cl)cc3)c2)cc1 564314754 FIRXWDLCQYUNCZ-OAQYLSRUSA-N 380.879 5.050 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)ccn1 564438718 KZVUFPSCNYCDJS-HSZRJFAPSA-N 388.471 5.100 30 20 GKED C[C@@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(OC(F)F)cc1 565564860 BJMQQZXEIYNPHH-MRVPVSSYSA-N 395.274 5.076 30 20 GKED O=C(c1cc(Cl)c(F)cc1Cl)N1CCC(C(F)(F)F)(C(F)(F)F)C1 573735246 GQVXGLPJVOWDJH-UHFFFAOYSA-N 398.105 5.089 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(-c2ccccc2)cc1C 574473831 KOJDOZXDWGFWAO-UHFFFAOYSA-N 390.483 5.358 30 20 GKED N#CCCC[C@H](Nc1ncnc2ccc(Br)cc12)c1ccccc1 581228513 ULKBBZLOQFIWHT-KRWDZBQOSA-N 381.277 5.239 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(C#N)cc2)CCC1 594068833 AMLPFKOPADMCGA-INIZCTEOSA-N 390.512 5.153 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(F)c(Br)c1 594838129 NGCOLFXAXQXQAS-GFCCVEGCSA-N 397.313 5.109 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184915 XPKYMJDMJUAPGI-UHFFFAOYSA-N 387.458 5.065 30 20 GKED CCN(CCc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609433996 VEACYXFWCBHJCK-UHFFFAOYSA-N 391.496 5.509 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCSc1ccccc1 609438059 ANFZFRUQCZTNOR-INIZCTEOSA-N 385.558 5.385 30 20 GKED CSCc1ccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1 609643735 IBPBNGHCXRUNCC-UHFFFAOYSA-N 388.492 5.253 30 20 GKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccc(Br)cc1 609825477 AAUYJELKIPVWHV-OLZOCXBDSA-N 389.318 5.142 30 20 GKED C[C@H](CCNC(=O)c1cc2ccccc2n1CC#N)c1cccc(C(F)(F)F)c1 610430614 PBGAJAFZKZQKGJ-OAHLLOKOSA-N 399.416 5.107 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622847632 APSRBOFZRGEEHW-SKDRFNHKSA-N 389.286 5.144 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cc(Cl)ccc1OC 642252164 JXACEQSDVUUEAI-UHFFFAOYSA-N 385.920 5.009 30 20 GKED C=CCn1c(S[C@@H](C(=O)c2ccccc2)C(C)C)nnc1-c1ccccc1 643090092 WOWWIMXRLWAOFR-HXUWFJFHSA-N 377.513 5.131 30 20 GKED C=CCN(C(=O)CCC(F)F)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 684625386 RFUMBPWVBCINBN-UHFFFAOYSA-N 398.478 6.041 30 20 GKED O=C(Nc1nc2cc(F)c(F)cc2s1)c1c(F)cc(C(F)(F)F)cc1F 685670802 KXSIITUXWNNHGA-UHFFFAOYSA-N 394.271 5.124 30 20 GKED COc1ccc(CCC(C)=NNc2nc(C(F)(F)F)nc3ccccc23)cc1 725830713 CLSCRKPTKYMXIC-UHFFFAOYSA-N 388.393 5.078 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=NNc2ncnc4sccc24)CCC3)cc1 727648329 CIODNIIMTHIJLH-UHFFFAOYSA-N 391.525 5.276 30 20 GKED CCSc1ccc([C@H](C)NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1 728790440 AXYWZRFLHZEBGV-LBPRGKRZSA-N 375.950 5.371 30 20 GKED Cc1cc(COc2ccc(/C=C3\CCc4ccccc4C3=O)cc2)oc1C(=O)O 729936350 ACCDQCAAQMTHRP-QGOAFFKASA-N 388.419 5.078 30 20 GKED N#C[C@H](NC(=O)c1ccc(SC(F)F)cc1)c1ccc(Cl)c(Cl)c1 731644977 DAFUIIGBZAPJOU-AWEZNQCLSA-N 387.238 5.303 30 20 GKED N#Cc1ccc(C(=O)O[C@@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 731994984 YPJBWONTGOVUKZ-HNNXBMFYSA-N 398.178 5.171 30 20 GKED C=CC[C@H](NC(=O)N(CCC)[C@H](C)c1cc2ccccc2o1)c1ccncc1 734678822 IUNIQGZPTAZYHP-XLIONFOSSA-N 377.488 5.628 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)/C=C\c2cnc(C(C)(C)C)s2)cc1 742657604 PQPQRUYHXCEABP-JYBLJSLWSA-N 381.545 5.132 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1sc2cccc(Cl)c2c1Cl 760801107 NEDYGYDWEKALSY-UHFFFAOYSA-N 395.242 5.502 30 20 GKED Fc1ccc(C2OCCO2)c(Cl)c1C=NNc1c(Cl)cccc1Cl 761810131 MFOGDDIPUGBLNQ-UHFFFAOYSA-N 389.641 5.277 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Br)ccc2F)c(Cl)c1OC 763122972 WQSRQHMCEOUXIP-CLTKARDFSA-N 399.643 5.155 30 20 GKED C=CC[C@H](N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccncc1 766018745 ITIUCAKKYSXGQU-PMACEKPBSA-N 391.540 5.498 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1Br)c1ccc2ccccc2n1 766236057 CGDSQGIJKSRPOD-KRWDZBQOSA-N 393.284 5.196 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2cccc(C(F)(F)F)c2)cc1C#N 771836214 AZWOFEQYMAROQH-UHFFFAOYSA-N 379.407 5.173 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)CCCc2ccc3ccccc3c2)c1 775743979 IEDYNYSLVVJKID-HSZRJFAPSA-N 386.495 5.160 30 20 GKED CCC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776154902 CPHJFSXQWXBDQA-YWZLYKJASA-N 376.422 5.800 30 20 GKED CC(C)n1ccc(C[C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)n1 783586445 BPJSPAMQRZQZQV-QGZVFWFLSA-N 392.478 5.097 30 20 GKED N#C[C@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1cnc2ccccc2n1 792109811 VBLGPAMKDWLUJP-FSEPTYSPSA-N 399.450 5.247 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cn1 792857266 BOUKSAXYHMNCGY-TWGQIWQCSA-N 385.250 5.355 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc(Cl)cc1Br)c1ccccc1 792869388 HYJLZZBOAIWHTI-CYBMUJFWSA-N 378.653 5.095 30 20 GKED Cn1c(-c2cccc(OC(=O)C[C@@H](CC#N)c3ccccc3)c2)nc2ccccc21 796642372 BXRSSWCNTONZMN-LJQANCHMSA-N 395.462 5.233 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@H](c1ccccc1)c1ccc3c(c1)CCCO3)CC2 810225617 ISNZXZBFFZPKBB-AOYPEHQESA-N 380.491 5.250 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211977 USMKIZWUSOZEPT-QFBILLFUSA-N 392.446 5.235 30 20 GKED C[C@]1(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C[C@@]1(F)Cl 844501327 BIGIBPLJWPTYIR-GIVPXCGWSA-N 385.870 5.168 30 20 GKED N#Cc1ccccc1NC(=S)NC[C@H]1CC2c3ccccc3C1c1ccccc12 915996996 FXPAXBSATQWGTJ-CVOKNGKCSA-N 395.531 5.142 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(Cl)c2)cc(Br)c1O 916137578 OWAOJDNZNBZTMM-VOTSOKGWSA-N 381.653 5.103 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2ccc(Cl)c(Cl)c2)cc1 916546351 MSHJOQVZUBYZDZ-UHFFFAOYSA-N 397.718 5.413 30 20 GKED Cc1csc([C@@H](C#N)C(=O)COc2ccc(Cl)cc2C2CCCCC2)n1 916843978 PKYOXWYERPTKPC-KRWDZBQOSA-N 388.920 5.408 30 20 GKED Cc1cc(C)cc([C@@H](OC(=O)CSCc2ccc(C#N)cc2)C(F)(F)F)c1 918563960 RFSWYAPCZRSJFV-LJQANCHMSA-N 393.430 5.255 30 20 GKED CC(=O)Nc1ccc(/C=C2/CCOc3c(ccc(Cl)c3Cl)C2=O)cc1 921138364 HCKHGNULVCHGIE-RAXLEYEMSA-N 376.239 5.001 30 20 GKED Cc1c(NN=C2CCCc3nc(-c4ccc(F)cc4)sc32)cccc1C(=O)O 1776086588 COJVQFYOMXFFSX-UHFFFAOYSA-N 395.459 5.108 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1csc3ccc(C(=O)O)cc13)CCO2 1776374801 SSBTYRBHARMLHM-DHDCSXOGSA-N 392.476 5.772 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776697592 IVPODHGSPYSQEU-WAFWZSCLSA-N 384.475 6.461 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)cc(Cl)c1OC 1776782846 FZAHGOQVJMQQHS-OAHLLOKOSA-N 376.324 5.295 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2cccs2)cc1 1776787966 FSQOIIFDOSHHHS-LJQANCHMSA-N 375.534 5.403 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776950902 KFIILGKQRZSZJB-UKTHLTGXSA-N 378.449 5.653 30 20 GKED Cc1cccc2c1CC/C(=C/c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777457424 WIVZESLFVFWEDX-MOSHPQCFSA-N 398.458 5.485 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1C 26127821 BMGFFWBSTBHGJE-KRWDZBQOSA-N 387.508 5.212 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1CN(C)C1CCCCC1)c1ccc(C#N)cc1 43390762 GXBKAOOOFKCIEQ-GOSISDBHSA-N 390.531 5.205 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 56300369 YPLBFHLMSBQOAY-UHFFFAOYSA-N 389.282 5.060 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 57129500 BNLKYFJPCDZPTD-IBGZPJMESA-N 392.421 5.087 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2nccs2)cc1Cl 57344704 QSIVVMCJNFTDQG-QGZVFWFLSA-N 381.888 5.023 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 60127423 XGDVIXBHOWYBER-GOSISDBHSA-N 399.494 5.913 30 20 GKED CC(C)Oc1ccc(C#N)cc1NCC(=O)Nc1ccccc1-c1ccccc1 63469678 OKBHYWNLFHBLKH-UHFFFAOYSA-N 385.467 5.063 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 66788864 OLVKTCHZZAIXQS-UHFFFAOYSA-N 399.406 5.088 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cs1 67600703 WXKXYMHIKHLNJQ-CQSZACIVSA-N 375.478 5.218 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 78668922 MYHITVHQZPYZRC-HZPDHXFCSA-N 390.430 5.453 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc(-c3ccccc3)nc2C)cc1 103960470 BFLOYWSGMCHZJJ-UHFFFAOYSA-N 391.496 5.078 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1)C(C)C 108237305 DGTDOXNNRRARNC-GOSISDBHSA-N 395.572 5.421 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc(-c2ccncc2)cs1 114620816 OUGUCTKMSCBJDF-HNNXBMFYSA-N 389.411 5.094 30 20 GKED Cc1c(NC(=O)N[C@@H](CCC#N)c2ccccc2)cccc1OCC(F)(F)F 120599439 LSRURXCDKLZQIF-KRWDZBQOSA-N 391.393 5.103 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1OCC(F)F 137456176 NHMZCBSDIPLSRW-ZDUSSCGKSA-N 391.443 5.369 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 176890930 GNQFSSRYSLDNEC-AWEZNQCLSA-N 398.359 5.130 30 20 GKED N#CCCSc1ccccc1NCc1cnoc1-c1ccc(Cl)s1 178821841 WBSAQMFNZTYLGP-UHFFFAOYSA-N 375.906 5.674 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)c1c(Cl)cccc1Cl 180902166 NBSMONUQLOFJFJ-UHFFFAOYSA-N 377.271 5.077 30 20 GKED CCC[C@H]1C[C@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 183387160 AYCRYXQEJUQBSE-QUCCMNQESA-N 378.472 5.193 30 20 GKED C[C@H](Oc1ccc(C(=O)Nc2ccc(F)cc2OCC#N)cc1)c1ccccc1 191194546 HJJBADQIDZMDAN-INIZCTEOSA-N 390.414 5.120 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCC(c2ccccc2NC(=O)[C@H](C)CC(=C)C)CC1 192990056 VBFBYIGVGRUMHQ-UXHICEINSA-N 396.575 5.536 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccccc3Cl)n2)cc1 255030288 GEOPAHBNSROLIV-DOOKAGJSSA-N 389.867 5.225 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2ccccc2s1 303174358 JSFJRAYIMWHGQP-UHFFFAOYSA-N 398.487 5.913 30 20 GKED CC(C)c1cccc(N/C(N)=N/Cc2ccc(Oc3cccnc3)c(F)c2)c1 303872303 GFRQSWNFIJLESB-UHFFFAOYSA-N 378.451 5.063 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O 328851163 WQDCWBVSCXFUJF-BDTNDASRSA-N 398.547 5.011 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425658593 VCTVHKCIJCGAJO-MRXNPFEDSA-N 392.503 5.076 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1O[C@H](C)C(F)(F)F 425674110 OUUMEBMKAKDAOX-UONOGXRCSA-N 391.393 5.113 30 20 GKED C[C@H](NC(=O)c1cccc(SCC#N)c1)c1cc(F)c(Cl)cc1Cl 429969111 ULUMYLXACLMDQB-JTQLQIEISA-N 383.275 5.239 30 20 GKED N#CCSc1cccc(C(=O)N2Cc3ccccc3C[C@@H]2c2ccccc2)c1 430626126 RFGYDSXTWJFVQG-HSZRJFAPSA-N 384.504 5.242 30 20 GKED CC(C)[C@H]1N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1(C)C 432901389 PUIDHUORZZHSRU-JOCHJYFZSA-N 391.515 5.230 30 20 GKED Cc1cc(C)c(CN[C@@H](CCCC#N)c2ccccc2)c(OCc2ccccc2)n1 433026707 HGNWZNNELXMMJO-VWLOTQADSA-N 399.538 5.802 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C2CC2)cc1F 433129234 YUGHYLBDSZBEEX-CQSZACIVSA-N 383.492 5.277 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2cccc(C#N)c2)CC1 435058411 UBKFXMDGDCWTOJ-UHFFFAOYSA-N 393.446 5.201 30 20 GKED Cc1ccc(-n2c(SCCCCC(C)(C)C#N)nnc2-c2ccccn2)cc1 436212722 VOGMPHKORKYYAZ-UHFFFAOYSA-N 391.544 5.450 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C(C1CC1)C1CC1 438669231 RHEGPIHVRVHUGK-UHFFFAOYSA-N 379.435 5.142 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(O)c(-c3nc4ccccc4s3)c2)cc1 440953940 QFLGMHATDSGBES-UHFFFAOYSA-N 399.475 5.112 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC[C@H](C)c1ccccc1 441338620 TUKCUFAKPDFXLS-KRWDZBQOSA-N 385.467 5.576 30 20 GKED Cc1sc(Br)c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c1C 442543496 UEWYFGLLAWRCOE-JTQLQIEISA-N 383.336 5.197 30 20 GKED CCc1ccc([C@H]2CCCCCN2CC(=O)Nc2ccccc2SCC#N)o1 444226342 SUFGHQDKKCEYML-LJQANCHMSA-N 397.544 5.013 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)C1 452563021 ROBHVSBMRPEJSE-KBPBESRZSA-N 389.282 5.598 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1ccc(C)c(C)c1 453467575 RGCJQNQLUOHRKE-NHCUHLMSSA-N 380.536 5.054 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(C(=O)C2CCC2)cc1)c1ccccc1 455272817 NNGOFZZZQNDNDM-OAQYLSRUSA-N 375.472 5.226 30 20 GKED C[C@H](C(=O)Nc1ncc(Cc2ccccc2Cl)s1)c1cccc(C#N)c1 461803414 PUTAANWHMGKRPZ-ZDUSSCGKSA-N 381.888 5.001 30 20 GKED Cc1cc(Br)c(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1Cl 464353861 RJNHCDLCUCOZTC-NSHDSACASA-N 377.669 5.025 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cc2)c1 469735240 GTJQTKHPTJJSAV-UHFFFAOYSA-N 375.428 5.328 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1[N+](=O)[O-] 473582150 KERFREHKGKVUEB-AWEZNQCLSA-N 383.473 5.222 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F 482396286 LPMGYEYQEOVDOM-HNNXBMFYSA-N 390.377 5.028 30 20 GKED C=C[C@H]1CCCCN1C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 488851967 JHGWZTCVVXCVRS-AWEZNQCLSA-N 379.287 5.148 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C#N)cc2Cl)cc1NC(=O)c1ccccc1 494577723 FIWLQOOMSAXMBP-UHFFFAOYSA-N 389.842 5.025 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)sc2cc(F)ccc12 497582039 IHIJVZRPIOWFPJ-LBPRGKRZSA-N 384.501 5.995 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1sc(-c2ccccc2)nc1C 498449059 KPPJTTSFNRAPMB-UHFFFAOYSA-N 375.497 5.043 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 503142594 WXNNQNXPTSMDJV-LPHOPBHVSA-N 380.513 5.227 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)Nc1cc(C#N)cn1C(C)(C)C 513518376 DTXWZWTZWJVJMJ-LPHOPBHVSA-N 394.519 5.128 30 20 GKED N#C[C@H](C(=O)c1cc2sc3ccccc3c2s1)c1nc2ccccc2s1 513687474 TXPBNTPCAJRSSY-GFCCVEGCSA-N 390.514 6.216 30 20 GKED CC(C)(C)O[C@@H](C(=O)Nc1nc(-c2cccc(C#N)c2)cs1)c1ccccc1 514037983 MZPOUFMWAXFYAX-LJQANCHMSA-N 391.496 5.177 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@H](c3ccccc3)C3CCCC3)cc2)nc1 518884734 LJSKZMFKDGRTFW-XMMPIXPASA-N 397.478 5.407 30 20 GKED CCc1ccc(-c2nc(CC(=O)N(CCC#N)CC(CC)CC)cs2)cc1 521139388 WTQWRLJSQLYNDS-UHFFFAOYSA-N 383.561 5.093 30 20 GKED COc1ccccc1[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccccc1 522408824 UXXFFMBZPRRKBD-IBGZPJMESA-N 383.373 5.182 30 20 GKED COc1ccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 524137387 SEYORCMUDOVHDR-UHFFFAOYSA-N 387.439 5.098 30 20 GKED CC[C@@](C)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(F)(F)F 530615824 KPJYGWQRXOXRFK-LJQANCHMSA-N 376.378 5.006 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 536889716 KZRXPPZHADBARP-HXUWFJFHSA-N 395.506 5.093 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccccc2CCC(F)(F)F)c(C#N)s1 538072744 OKEBOEYJUDUGSN-UHFFFAOYSA-N 380.435 5.664 30 20 GKED N#CC1(c2ccc(C(=O)N3CC=C(c4cccc5ccccc45)CC3)cc2)CC1 538583446 HPZSSFKKYLGEED-UHFFFAOYSA-N 378.475 5.324 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC1CCN(c2ccc(C#N)cc2)CC1 552055671 YREAIXHFEOLIHS-OAQYLSRUSA-N 387.449 5.119 30 20 GKED C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555005097 GYYLRUCVJMKZKP-SBUREZEXSA-N 398.466 5.155 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 559794884 GCBXJDADKASCOU-UHFFFAOYSA-N 375.497 5.388 30 20 GKED Cc1csc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c1C#N 564190756 PBSVZMQXTLOGNF-UHFFFAOYSA-N 393.855 5.498 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)CC1 577376963 RUNWEGSUGDDNSY-UHFFFAOYSA-N 388.467 5.168 30 20 GKED C[C@H](c1ccccc1)N(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)C1CC1 588235909 TZXJVHDQDMHFNK-QGZVFWFLSA-N 398.466 5.503 30 20 GKED N#CCCC[C@H](NCc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1 590068601 DSKKDUHSBJVYOW-SFHVURJKSA-N 380.385 5.292 30 20 GKED N#CC1(c2cccc(-c3cc(F)ccc3OCc3ccncc3)c2)CCOCC1 592987036 NYIBMRQHBFILNZ-UHFFFAOYSA-N 388.442 5.038 30 20 GKED CSc1ccsc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 593595446 YXCHPMRDQRJTLG-SECBINFHSA-N 398.456 5.589 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2ccccc2)cc1F 604488251 QZHVGFYDQXGBBJ-UHFFFAOYSA-N 385.442 5.584 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1C(F)(F)F 608915488 PWZVHWOCCPIXPB-UHFFFAOYSA-N 375.394 5.328 30 20 GKED CSc1ccc(Cl)cc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 609058709 MJXUIBGYQNRUGM-UHFFFAOYSA-N 398.871 5.358 30 20 GKED COc1cccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1 609063036 SNOQXJCTPULEHI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 609552428 ZWJNKAHGBPXJDQ-VWLOTQADSA-N 391.474 5.817 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609647240 BWZPNTUDLPSAQE-DVECYGJZSA-N 396.490 5.155 30 20 GKED N#Cc1ccc(-c2nnc(CSc3ccc(C4CCCCC4)cc3)o2)cc1 610217863 LDSXWCKHGXXNBE-UHFFFAOYSA-N 375.497 5.948 30 20 GKED C[C@H](C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1ccccc1C(F)(F)F 610598289 CDVHXTLHYMWVQV-QKYXUNIQSA-N 386.417 5.107 30 20 GKED COc1cc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)ccc1OCC(C)C 611392611 YTGYKHBIVUQIOB-VGOFRKELSA-N 378.516 5.330 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC[C@](C)(C#N)C3)cc2)cc1 612306138 HTPOPOCOROZUMO-OAQYLSRUSA-N 381.501 5.004 30 20 GKED O=C(Nc1ccccc1SCC(F)(F)F)c1cccc(C(F)(F)F)c1F 648081842 SOAWMLWIKHIDAQ-UHFFFAOYSA-N 397.315 5.751 30 20 GKED C=C(CNC(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 672652721 UTEWMLIPTMLNLU-UHFFFAOYSA-N 385.467 5.082 30 20 GKED C=CCOc1ccc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1Cl 678296535 FTNQQDMWVFJLBO-TXEJJXNPSA-N 387.751 5.077 30 20 GKED CC(=O)c1ccc(C#N)c(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 680372117 VADUROIMWUIUQH-WDNDVIMCSA-N 378.316 5.082 30 20 GKED Cc1ccccc1Oc1ccccc1CNCc1ccc(N(C)CCC#N)cc1 730107890 VSFPDLNKUFGSDC-UHFFFAOYSA-N 385.511 5.427 30 20 GKED C#Cc1cccc(NC(=O)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 730897976 SVYQAKVAXYATLP-INIZCTEOSA-N 375.497 5.291 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(O[C@H](C)C#N)cc2)c1 731298252 DVCKRGGEEJLQKZ-HXOBKFHXSA-N 383.451 5.057 30 20 GKED C=CCOc1ccccc1CNC(=S)Nc1c(C(C)C)cccc1C(C)C 731945967 MTJVDNACILAWTG-UHFFFAOYSA-N 382.573 5.985 30 20 GKED CCCCCCCCCNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 735379355 SFPBMGNZGGLBNH-UHFFFAOYSA-N 376.385 5.263 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc([N+](=O)[O-])cc1 740531244 NNMPLZRWXUNKKJ-CQSZACIVSA-N 399.859 5.012 30 20 GKED C[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743094611 AMMBGYVTYNPBFI-HOYKHHGWSA-N 381.479 5.321 30 20 GKED CC(=NN=C(CCSc1ccc(F)cc1)c1ccc(F)cc1)c1cnccn1 745201969 PBNIRLCZNQFVFQ-UHFFFAOYSA-N 396.466 5.151 30 20 GKED CCCOc1c(Cl)cc(C=NOc2ccccc2C(F)(F)F)cc1OC 754712237 HPAJRMOOWLQORX-UHFFFAOYSA-N 387.785 5.569 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 756515249 LEIPNDSDVGTIBW-KQTLUZQSSA-N 393.314 5.247 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C\c3ccnc(Cl)c3)c2)cc1 757938578 UVFREPFYLUOGGO-TWGQIWQCSA-N 375.815 5.051 30 20 GKED N#Cc1ccc(F)cc1CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 759219105 SQWQYEMMDLQEIF-UHFFFAOYSA-N 393.921 5.620 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)Cc1ccc(O[C@H](C)C#N)cc1 769469953 IIQYFFAMUCKPIC-SJLPKXTDSA-N 391.540 5.602 30 20 GKED Cc1cc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c(C)c(C)c1O 774845256 BWAOLUKDSFJISP-UHFFFAOYSA-N 386.451 5.020 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C 780667869 NTYZARWEGNFYBC-PNQCTFMGSA-N 383.879 5.150 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(SC(F)F)cc2)S1 781546064 ANRHGGAUQIYUJA-XNTDXEJSSA-N 390.480 5.510 30 20 GKED C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1c[nH]c2ccccc12 786305547 GUSCVVTXDWVYLU-UZLBHIALSA-N 395.462 5.162 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OC(=O)C[C@@H](CC#N)c2ccccc2)cc1 793562580 REIKMPFFKMYRFF-QGZVFWFLSA-N 380.444 5.027 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801682145 MSYYBKCEKWYYJO-HNNXBMFYSA-N 393.302 5.850 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 805163742 GSVDDGCIXBVAAI-SFHVURJKSA-N 396.277 5.605 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc2c(c1)CCC(=O)N2 811688955 VVPFRLOOVCAWDA-QKXPFDBWSA-N 383.394 5.015 30 20 GKED C#Cc1ccccc1CC(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 812911804 GOFLYDKVBSWMLM-UHFFFAOYSA-N 397.261 5.343 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCc2cc(SC(F)F)ccc21)c1ccccc1 815635361 BBYPLHXJVWFBTC-LEWJYISDSA-N 386.511 6.403 30 20 GKED Cc1c(C#N)nn(-c2ccccc2)c1NC(=O)c1oc2ccc(Cl)cc2c1C 821635571 ICYMVTYBYWMBEC-UHFFFAOYSA-N 390.830 5.013 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)c3cccnc23)cc1 915086295 SGCWIMXSQAQFQN-NRFANRHFSA-N 397.865 5.796 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1ccc(OC(F)F)cc1 916286910 ZGCAYKAKLSLQDV-UHFFFAOYSA-N 379.716 5.191 30 20 GKED Cc1ccc2c(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)coc2c1 917046695 MGKZHYMXHRKIGC-OAHLLOKOSA-N 380.856 5.423 30 20 GKED N#C[C@H](C(=O)Cc1ccc(-n2cccc2)cc1)c1nc2cc(Cl)ccc2s1 917047537 ZKIOHLNWWQXJHL-QGZVFWFLSA-N 391.883 5.159 30 20 GKED N#Cc1cccc(COC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)c1 921226841 YRKZROYDLHWGDC-UHFFFAOYSA-N 389.263 5.346 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)cc1)c1ccccc1 1776469439 RJVMBOFEZFBFMK-SBNBMVPLSA-N 390.410 5.560 30 20 GKED C[C@H]1C/C(=C\c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2sccc21 1776589744 SRSCTQQZPKJRHU-JMRXEAOASA-N 394.448 5.392 30 20 GKED CCCCCCCC/C=C\CCCCCCCc1nc([C@@H](N)CC(=O)O)no1 1776785221 INJAHHHAAUADNC-VJIACCKLSA-N 393.572 5.734 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)cc1 1776806028 VLLXQWGPPRIYMO-JXMROGBWSA-N 387.273 5.386 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)[C@@H](CC=C)C(=C)C)CCC2)cc1 1791729119 WKYJXKBUTDUZTD-QFIPXVFZSA-N 392.543 5.083 30 20 GKED CCc1nc(C)c(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 51899516 RCJNAWJVGGBURQ-JTQLQIEISA-N 395.431 5.133 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSC2=Nc3ccccc3CS2)c1C 53615938 INUBPPPMRIYLBA-UHFFFAOYSA-N 395.553 5.218 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1cccc2ccccc12 63400467 JNJYGSODVLXTEO-QGZVFWFLSA-N 389.455 5.207 30 20 GKED CC(C)Oc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66955755 KNWJPRRPPKXSIV-INIZCTEOSA-N 383.517 5.190 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2sccc2-c2ccccc2)c1 71068577 KQXAMUFMRQDJKM-SFHVURJKSA-N 376.481 5.026 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCc1nc2ccccc2s1 108241506 HPASVOQUKLSSTL-OAHLLOKOSA-N 395.553 5.509 30 20 GKED CCOc1ccccc1C(F)(F)C(=O)Nc1ccccc1SC[C@H](C)C#N 131826956 WESRDDSTKQJJTP-CQSZACIVSA-N 390.455 5.068 30 20 GKED COc1ccc([C@H](Cc2ccccc2C)NCc2ccc(C#N)s2)cc1OC 176958173 HGECZSQRHXOPLB-NRFANRHFSA-N 392.524 5.019 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3nc4ccccc4s3)o2)cc1 178331084 KPAILHYRWLSLSY-UHFFFAOYSA-N 381.482 5.203 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)nc4ccccc34)n2)cc1 185264121 XNTOJIVGLSZRAJ-IBGZPJMESA-N 399.475 5.165 30 20 GKED C=CCn1c(SCc2cccc3cccnc23)nnc1-c1ccccc1F 217501722 RVHUTOXMOVFGDW-UHFFFAOYSA-N 376.460 5.111 30 20 GKED O=[S@](Cc1ccccc1)Cc1cccc(N=Cc2cc(Cl)ccc2O)c1 255006361 ZFXGOYVUYOXKID-AREMUKBSSA-N 383.900 5.245 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1NCc1ccc(OCc2ccccn2)cc1 301618244 LBISFHKAMNRVLG-UHFFFAOYSA-N 383.373 5.163 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)no1 303270316 HDDCUJMXQCAJCP-ZDUSSCGKSA-N 397.887 5.499 30 20 GKED CC(C)(C)/C(O)=N/[C@@H]1CCCN(C(O)=Nc2ncc(C3CCCCC3)s2)C1 329325389 IPGDDADKEUHVBR-OAHLLOKOSA-N 392.569 5.203 30 20 GKED OC1=NCc2ccc(N=C(O)C34C[C@@H]5C[C@H](C3)CC(C(F)(F)F)(C5)C4)cc21 330224408 NQUKAXRONPTHHH-ORMMXULVSA-N 378.394 5.242 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CC(F)F)c1ccccc1 421055703 HDJBKSOXCVDXKG-YOEHRIQHSA-N 389.471 5.599 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](CC(F)(F)F)C1 421064771 OAHYWMKECPSSLB-KGLIPLIRSA-N 385.455 5.135 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1 425652966 KBWUGGZBQQCNJJ-AWEZNQCLSA-N 398.894 5.175 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425669086 NTLXSYGMBFCYSQ-QGZVFWFLSA-N 379.504 5.488 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(C)c1 437468996 FCHQDTIOCYGNEU-UHFFFAOYSA-N 376.387 5.059 30 20 GKED CCCc1c(NC(=O)c2cc(C)c(C)cc2Cl)cnn1-c1cccc(C#N)c1 440086206 DTMFWBUDAHVAIK-UHFFFAOYSA-N 392.890 5.219 30 20 GKED N#CC1CCC(CN[C@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 442868047 PQUJGZZJCOBPBT-PVWAMWICSA-N 396.918 5.120 30 20 GKED Cc1noc(-c2ccccc2)c1NC(=O)c1cn(CCCC#N)c2ccccc12 444365715 CHHFAPZTCRQBMV-UHFFFAOYSA-N 384.439 5.161 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN2CCCC(C)(C)[C@@H]2C#N)on1 444722341 HNMAKBANCVFUPA-NRFANRHFSA-N 375.472 5.018 30 20 GKED CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)N[C@H]2CC[C@@H](CC#N)C2)nc1 453295986 SSLYMKNSVSAILH-AJSBUHFISA-N 381.951 5.123 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458798203 HPOVWIMASSJQKC-LSWJPFSZSA-N 375.516 5.318 30 20 GKED CC1(C)CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC[C@@H]1C(F)(F)F 458812237 CPKQPFGHKYHXKV-IRXDYDNUSA-N 381.442 5.042 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)c1cccc(C#N)c1 461926659 QEQFZHUKNQOUTE-QGZVFWFLSA-N 381.435 5.273 30 20 GKED C[C@H](C(=O)N[C@H](C)c1ccccc1OCc1ccccc1)c1cccc(C#N)c1 461934313 QIMQDQWBKKROBN-RBUKOAKNSA-N 384.479 5.118 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)[C@@H](C)c2cccc(C#N)c2)ccc1Br 462345408 XQQQYKVSWFSDFP-MGPUTAFESA-N 397.316 5.096 30 20 GKED CCC1(CC)CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CCS1 467343448 YCUFTUMFCDKIKT-HNNXBMFYSA-N 377.579 5.220 30 20 GKED Cc1ccc(CCC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)o1 471295525 GPGZXHCVTUDAQB-UHFFFAOYSA-N 376.431 5.073 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(Cl)cc2Br)c1C#N 471707249 UKOOQQDOPVOZDS-UHFFFAOYSA-N 383.698 5.159 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)C[C@H](CC#N)c1ccccc1 475366048 GFFMWWKZSYRXKW-KNQAVFIVSA-N 388.536 5.925 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN(CC)C2CC2)cc1 476124861 YRDMEQUENSNLSA-UHFFFAOYSA-N 376.544 5.775 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NCc2nnc(-c3ccc(C#N)cc3)o2)o1 480271116 YKFYMHAJCYBDOR-UHFFFAOYSA-N 390.830 5.442 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(-c2nccc(C)n2)cc1)c1ccc(F)c(F)c1 480582827 PKOXRDJVCXCGAP-HXUWFJFHSA-N 394.425 5.169 30 20 GKED CCCC(=O)Nc1cccc(NCc2ccc(-c3ccccc3C#N)cc2)c1C 486131905 XQAGDTMFDSFVMY-UHFFFAOYSA-N 383.495 5.884 30 20 GKED C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487498932 GSBRGRQVALHLRB-BEFAXECRSA-N 390.405 5.024 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cccc2[nH]ccc12 494745462 LMAQEOLUCRVXCE-HNNXBMFYSA-N 378.501 5.084 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)NCC(C)(C)CCC#N)cc1 498031098 XSFZKRUYFQDFPK-QGZVFWFLSA-N 379.504 5.052 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 502097584 WAGPSAGSGSIZLC-UHFFFAOYSA-N 393.874 5.782 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](OCc2ccccc2F)C1 505058699 ZBYJRWPVJPDFOF-FQEVSTJZSA-N 382.479 5.157 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1 505950363 JNHVCLGAFHUXHZ-NRFANRHFSA-N 380.488 5.374 30 20 GKED Cc1nccn1-c1ccc([C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1 507619743 XATTXFCFAMLCPZ-KPSOWUDTSA-N 384.527 5.236 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@@H](c2ccccc2)C(C)C)cc1 510508993 SNTZWIFGZGHLSD-JOCHJYFZSA-N 391.515 5.020 30 20 GKED C[C@@H]1CCC[C@@H](N(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 511391533 POYORTDTHNAAFG-WIYYLYMNSA-N 391.515 5.374 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1cccc(COc2ccccc2C#N)c1 513446027 AGRJDQOZKJHNBV-UHFFFAOYSA-N 396.899 5.124 30 20 GKED Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)[C@H](C#N)c2nc(C)cs2)c1 513676806 LAZBVUPPLHQFOT-IBGZPJMESA-N 398.491 5.103 30 20 GKED Cc1sc(NC(=O)CSCc2ccc(C#N)cc2)nc1-c1ccc(F)cc1 514048212 VHUCOVITLZKGHZ-UHFFFAOYSA-N 397.500 5.001 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 516380484 ONXAUKSILOLDEU-YJYMSZOUSA-N 388.298 5.473 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 519049687 BTRNLKJUQLTLEQ-FOCLMDBBSA-N 387.508 5.207 30 20 GKED C[C@@H](C#N)CNC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 520358503 KUDFBZLLONHVAL-SJCJKPOMSA-N 379.312 5.103 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3cc4ccccc4o3)cc2)cc1 520600677 JRUWSNCGRDDOSM-UHFFFAOYSA-N 383.407 5.418 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cc2ccccc2n1Cc1ccccc1F 521185310 NTQVFXVTYAEGKK-UHFFFAOYSA-N 390.380 5.019 30 20 GKED CCC[C@H](NC(=O)NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 521813729 UETPHDQEXLIBSC-SFHVURJKSA-N 376.287 5.206 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@H]3C[C@@H]3c3c(F)cccc3Cl)n2)cc1 524824332 JPRZVZCQQXYAPN-KBPBESRZSA-N 397.862 5.216 30 20 GKED C[C@H](N[C@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1)c1ccc(C#N)cc1 532906918 HIAIHSRABJZDSC-FVJLSDCUSA-N 382.479 5.057 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1F 534174266 LGIMBAOXPZVFDW-RHSMWYFYSA-N 389.833 5.230 30 20 GKED N#CCCCOc1cccc(CNc2ccc(F)cc2OCC(F)(F)F)c1 534829182 MDCKVAHISNCGSN-UHFFFAOYSA-N 382.357 5.061 30 20 GKED N#CC1CCN(C(=O)N[C@@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)CC1 538972507 FYHNUWNDQGGPBY-PKOBYXMFSA-N 393.453 5.067 30 20 GKED N#CCC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)CC1 541985362 YGGOWPSSLHCJKN-FBMGVBCBSA-N 397.478 5.080 30 20 GKED C=C[C@H](Cc1nc(-c2cc(Cl)ccc2O[C@H]2CCOC2)no1)c1ccccc1 547267025 VPFXLQALKWZFHJ-QAPCUYQASA-N 396.874 5.070 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Cl)cc2-c2nc3ccccc3[nH]2)ccc1F 564434694 ARCNKAYUWXQPGQ-UHFFFAOYSA-N 390.805 5.146 30 20 GKED COc1ccc([C@@H](CCC#N)Nc2cnn(-c3ccc(Cl)cc3)c2C)cc1 569736177 RFTLQVUTOBLROU-HXUWFJFHSA-N 380.879 5.300 30 20 GKED N#CCCCCCC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 588950375 FBBDMCKTIPCRQX-UHFFFAOYSA-N 393.874 6.093 30 20 GKED CCCOc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1OC 599930375 NLKWVKSPHSAFBM-IBGZPJMESA-N 381.476 5.041 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(C3CC3)s2)cc1Cl 609164518 PQEPGWWBNOGMME-QGZVFWFLSA-N 393.899 5.582 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1ccc(C#N)cc1F 609254178 DDSKIXLIKAPUTQ-INIZCTEOSA-N 393.487 5.232 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](C)c1ccc(F)cc1 609385222 DJRANVGVHUTICA-DLBZAZTESA-N 399.535 5.099 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CN(C(=O)CCCCOc2cccc(C#N)c2)C2CC2)o1 609500304 ASIXYCAOPMGPPI-JTSKRJEESA-N 392.499 5.015 30 20 GKED CC[C@@H](C)Oc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 609501515 PFGSRWPNTAVAFE-MRXNPFEDSA-N 387.439 5.175 30 20 GKED CCN(Cc1ccc2ccccc2c1)C(=O)CCCCOc1cccc(C#N)c1 609501701 YRPVAWJSFFWROK-UHFFFAOYSA-N 386.495 5.309 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1-c1ccc(Cl)cc1 610092128 DHGIGRJFPHDEMG-MRXNPFEDSA-N 389.886 5.956 30 20 GKED C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 610190111 DWMMLRWFZDHDMO-ISKFKSNPSA-N 384.504 5.169 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1ccncc1 610723579 SXXBEVQKEDNRSE-KRWDZBQOSA-N 389.886 5.334 30 20 GKED Cc1cc(C(=O)NC2CCCC2)ccc1NCc1ccc(C(C)(C)C#N)cc1 614056048 BEBMRXGMXNYHOY-UHFFFAOYSA-N 375.516 5.081 30 20 GKED C=CCN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1)C(C)(C)C 622944141 GKTWOLBGDNSARX-UHFFFAOYSA-N 380.275 5.002 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 674894684 MEAUQCMCTVWBDI-GFCCVEGCSA-N 382.313 5.083 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1ccc(SC)cc1 675771068 HYWAUSCEXYECLB-UHFFFAOYSA-N 383.542 5.057 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(C#Cc3cccs3)c2)n1 675835619 ZLOKBZXDDCQYRS-QFIPXVFZSA-N 387.508 5.220 30 20 GKED C=C[C@H](CC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 677515336 TUMGWLDVBXUNHH-BPLDGKMQSA-N 393.371 5.372 30 20 GKED CCCCCCCCC(=O)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1 726529015 OCYGVNPQBBJQEB-UHFFFAOYSA-N 393.959 5.157 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(SC(C)(C)C)cc1 726848500 VPEOLWOFXMYKFD-UHFFFAOYSA-N 399.516 5.706 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccccc2OCc2ccccc2)cc1 728711433 DOPAKSFWYFHTKN-WOJBJXKFSA-N 386.495 5.407 30 20 GKED CC(C)(C)n1cc(C=C2C(=O)c3ccccc3C2=O)c(-c2ccccc2Cl)n1 731155608 MESPIMCGBSSOMN-UHFFFAOYSA-N 390.870 5.421 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccccc1Oc1ccc(C)cc1)c1ccncc1 734670122 ZLLYNTQKQUYGTH-JOCHJYFZSA-N 387.483 5.299 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCOc3cccc4ccccc34)[nH]c12 735792849 OIYSTGXWCWBBPK-LJQANCHMSA-N 383.451 5.060 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc(Cl)c4c(c3)OCCO4)c2)s1 740010398 CFMOYFHDGDLICE-UHFFFAOYSA-N 396.899 5.001 30 20 GKED O=C(/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1ccc2c(c1)COC2 742436758 NHAFJSDIPLHZCZ-VURMDHGXSA-N 377.421 5.250 30 20 GKED C[C@]1(c2ccccc2)C[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743093865 YTYSHLQBMCGERW-VDKIKQQVSA-N 381.479 5.194 30 20 GKED C[C@@H](NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1cccc(C#N)c1 743778876 QBVZUYUMHFSPNC-CYBMUJFWSA-N 399.878 5.050 30 20 GKED O=C(OCCC#Cc1ccccc1)c1ccccc1SCc1cscn1 744190187 YKHYEXDTQTVLSH-UHFFFAOYSA-N 379.506 5.034 30 20 GKED COc1cc(C(=O)/C=C/c2c(Cl)nc3ccccn23)ccc1SC(F)F 746347382 ZVNAWWRVFUXEIH-VOTSOKGWSA-N 394.830 5.207 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cccc(F)c2F)cc1 749793030 GBVDIIOZGTWPPD-HXUWFJFHSA-N 376.406 5.192 30 20 GKED N#Cc1cc2ccccc2nc1N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 750014644 BVSXMBFLOAVQRK-WDNDVIMCSA-N 387.327 5.428 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(Br)c(F)cc2Cl)c1 751451286 SXCAQDMXECNNJL-UHFFFAOYSA-N 383.673 5.032 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(Cl)nc4ccccc34)n2)c1 752376431 PQVKXRZTPJFCJF-UHFFFAOYSA-N 390.855 5.136 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCC(=O)c2cc(Cl)sc2Cl)cc1 755246394 HCTOYSAFSUKTPN-UHFFFAOYSA-N 395.311 5.273 30 20 GKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1ncc(Br)s1 756843446 FPCWOYXRYAXZNC-ONEGZZNKSA-N 389.249 5.003 30 20 GKED N#CCCn1ncc(C(=O)Nc2ccc(SC(F)F)cc2)c1-c1ccccc1 757745129 WJYFQJIVGUIVHI-UHFFFAOYSA-N 398.438 5.031 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 767697322 BSLURMXUSPPDBM-ZDUSSCGKSA-N 392.908 5.127 30 20 GKED Cc1ccc2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)ccc2n1 773020697 LPPWZWTYFOONIO-HSZRJFAPSA-N 377.447 5.451 30 20 GKED C#CCCOc1ccc(CNCc2nc(-c3cc4ccccc4o3)cs2)cc1 775321156 POMKDLCWSSGSDJ-UHFFFAOYSA-N 388.492 5.248 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(COC2CCCCC2)c1 780529937 HDTHLHFDCIPQCT-KRWDZBQOSA-N 393.487 5.471 30 20 GKED CC[C@@H]1C[C@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCO1 781763532 JNDNBGVFCBAMNW-KBRIMQKVSA-N 388.920 5.235 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@H]1/C=C\c1cccs1 783066075 XKRXVFQVZZXQMI-JJEJIETFSA-N 399.491 5.279 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2F)cc1 786956773 DUCGLWBWSWIQDT-NRFANRHFSA-N 395.437 5.729 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797572176 ZVNSGUAFHDSOOJ-HNNXBMFYSA-N 399.516 5.278 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(N(C)C(=O)OC(C)(C)C)s1 809965049 CEPKRUXNUUMKJM-UHFFFAOYSA-N 392.546 5.009 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1 814475540 QMDVXMNIARFGMP-QGZVFWFLSA-N 375.444 5.558 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)c(F)cc1Cl)c1cccc(Cl)c1Cl 815536709 CSSBGINQZXKBNX-CYBMUJFWSA-N 392.044 5.434 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCN(C(=O)Oc2ccccc2)CC1)c1ccccc1 815636019 NRIFZVZKNVNSNR-GGAORHGYSA-N 391.515 5.065 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CC12CCSCC2)c1nc2cc(C(F)(F)F)ccc2s1 835075280 WVMVONSUVJXRLX-RYUDHWBXSA-N 396.459 5.025 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1cn(C(F)F)c2ccccc12)c1ccccc1 858894563 KANKWILJAFWFKF-LJQANCHMSA-N 396.441 5.271 30 20 GKED N#Cc1c(F)cccc1CNc1ccccc1SC[C@@H]1CC1(Cl)Cl 864005650 FUAXKFOXLNCGNT-ZDUSSCGKSA-N 381.303 5.595 30 20 GKED CCN(Cc1cccc(NCc2cccc(F)c2C#N)c1)C(=O)OC(C)(C)C 864035922 RATSGGFCIFNVNQ-UHFFFAOYSA-N 383.467 5.066 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2csc(-c3ccccc3F)n2)CCC1 899391327 IWCFEJZJGPWZHN-RUZDIDTESA-N 376.522 5.062 30 20 GKED C=CCC[C@@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 901689671 HFYSWTLLAGLZAL-GOSISDBHSA-N 377.843 5.089 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2ccc(F)c(F)c2)cc1 915086576 LKMQEDHASNZKIV-LJQANCHMSA-N 394.446 5.351 30 20 GKED N#CC1CCC(CSc2nnc(SCC3CCC(C#N)CC3)s2)CC1 915604255 WXYIIWDHXXJBCS-UHFFFAOYSA-N 392.619 5.382 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1 916943516 YZICTHIIPXNFIJ-NFAHFFEMSA-N 393.657 5.008 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 917026869 QUWHPMKFSBFLJO-GOSISDBHSA-N 396.899 5.499 30 20 GKED FC(F)(F)c1nc(NN=Cc2ccccc2C(F)(F)F)c2ccccc2n1 917212044 DFKVDUBOXSFZLL-UHFFFAOYSA-N 384.283 5.113 30 20 GKED Cc1cc(Oc2cc(Cl)ccc2C=NNc2ccc(C(=O)O)nc2)ccc1F 1776071718 PHPHCKKHAIRLDM-UHFFFAOYSA-N 399.809 5.119 30 20 GKED COc1ccc(NN=Cc2csc3ccc(C(=O)O)cc23)c(C(F)(F)F)c1 1776077817 DLVPAQNPFPMLFS-UHFFFAOYSA-N 394.374 5.073 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1cc(Cl)cc(Cl)c1 1776179972 SZMLCPGPPRNOIT-QGZVFWFLSA-N 384.690 5.461 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCc3c(C(=O)O)cccc32)cc1 1776787515 KFBBEVRQSKIELV-UHFFFAOYSA-N 397.540 5.650 30 20 GKED Cc1c(/C=C2/Cc3cc(Cl)cc(Cl)c3C2=O)nc2ccccc2c1C(=O)O 1777414295 YFEIVZDIKPNWGF-WQLSENKSSA-N 398.245 5.371 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3ccsc3)CCC2)cc1 1789453322 VUBQHGOFCFAVNS-FQEVSTJZSA-N 394.540 5.264 30 20 GKED CC(C)c1nnc(/N=C(\O)c2sc(-c3ccco3)nc2-c2ccccc2)s1 29653818 RENRPWRPESHQAW-UHFFFAOYSA-N 396.497 5.681 30 20 GKED Cc1c(C#N)c(S[C@H](C(=O)Nc2ccccc2Cl)C(C)C)nc2c1CCC2 32328296 AWMUDIHTXLMNSN-IBGZPJMESA-N 399.947 5.159 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(OCCC)c(OC)c1 46675148 JXZATDVRMMDZGW-MRXNPFEDSA-N 388.533 5.004 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 52050420 MKYRBGIVZFYFTJ-UHFFFAOYSA-N 396.859 5.169 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cc2c1 65577661 CLNWTXRGQUBCDU-UHFFFAOYSA-N 396.446 5.639 30 20 GKED N#CCCCOc1cccc(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)c1 92851017 ONCNAGLCQVZKRU-IBGZPJMESA-N 380.385 5.292 30 20 GKED CC[C@H](NC(=O)CNc1ccccc1SCCC#N)c1ccc(Cl)cc1 108352864 GWQLVLXVTZFDFA-KRWDZBQOSA-N 387.936 5.025 30 20 GKED N#CCC[C@H](NC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccccc1 156959751 PIOVURFMEDDWHW-QFIPXVFZSA-N 392.462 5.072 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 173915971 PRLWMXIVVXZXGF-MRXNPFEDSA-N 391.496 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](c2ccc(F)cc2)O[C@H](C)C1 191461559 SOAXCQPZJGCTAJ-VGOFRKELSA-N 396.506 5.672 30 20 GKED CC(=O)CC(C)(C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 191742617 SINRFIOACZMFOR-LJQANCHMSA-N 382.891 5.329 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)cc1 192036984 DZMAMKRPSBFZGB-UHFFFAOYSA-N 389.421 5.474 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 302952965 DTHNFKAWNWAFCT-QMMMGPOBSA-N 375.708 5.483 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nccn2Cc2ccccn2)cc1 303577831 ZPCUVUXABULPIO-UHFFFAOYSA-N 382.492 5.157 30 20 GKED C[C@H]1CCCC[C@H]1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 409796083 RQVWAFLECXJALJ-ICSRJNTNSA-N 391.515 5.279 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c(Cl)c1 427465983 QXNXLLNMEVOFNV-UHFFFAOYSA-N 390.870 5.660 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3ccc(C#N)cc3Cl)cs2)cc1 430364647 JOYPEFPNMVQJQL-UHFFFAOYSA-N 381.888 5.079 30 20 GKED N#CCCC[C@@H](NCC(=O)N(Cc1ccccc1)c1ccccc1)c1ccccc1 433028119 YDIDGPOAHZPGSI-RUZDIDTESA-N 397.522 5.245 30 20 GKED O=C(N[C@@H](c1c(F)cccc1F)C(F)(F)F)C1CCC(C(F)(F)F)CC1 436031013 WHAROXPNKXMCTR-RPTIHFLNSA-N 389.286 5.053 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccc1C 436457721 YFCYLODRZRPYJU-UHFFFAOYSA-N 384.435 5.422 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(Cl)ccc2F)cc1F 437503191 RGEYABRAWSEKIM-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccccc1 439296719 OPRJIFANFXSOLZ-LJQANCHMSA-N 391.471 5.285 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 439587856 DJHSVKKRHPFVNL-KRWDZBQOSA-N 381.435 6.179 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccc(CNc4ccccc4)cc3)on2)c1 448315851 KEPPNXGYFXNSGZ-UHFFFAOYSA-N 394.434 5.078 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)C1 456058982 PMCVYDUERCKCNQ-ZFWWWQNUSA-N 388.895 5.442 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(F)(c2ccccc2)CC1)c1ccccc1 458838936 MCIMQIZEQQALHP-OAQYLSRUSA-N 379.479 5.092 30 20 GKED N#Cc1cccc(C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)c1 460497953 DZSYDAVNEVAOLF-UHFFFAOYSA-N 376.456 5.136 30 20 GKED C=CCn1c(SCc2cc(Cl)ccc2Br)nnc1C1CC1 460861037 NPHNLZMVSOMQIM-UHFFFAOYSA-N 384.730 5.050 30 20 GKED N#Cc1cc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)ccc1F 467766418 BELWZMSMWNWLHH-NRFANRHFSA-N 395.275 5.339 30 20 GKED Cc1oc2ccccc2c1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 467839968 RFXFIYBQHAIYEQ-CYBMUJFWSA-N 394.402 5.633 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3ccc(Cl)cc3Cl)ccc21 468800710 CPZVMLWDKVTHFR-UHFFFAOYSA-N 388.298 5.188 30 20 GKED O=C(c1cc(F)c(F)c(F)c1F)N1CCSc2ccc(C(F)(F)F)cc21 469135735 YONMUCHQZRMWPP-UHFFFAOYSA-N 395.299 5.014 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(OCC)cc1 475565685 FTYZRVHDHQATHH-QHCPKHFHSA-N 392.543 6.306 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccc(F)cc1 476040125 IIWHSDJYIFAVOD-INIZCTEOSA-N 388.320 5.099 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@H](C#N)c3cnc4ccccc4n3)c2)c1 483237052 ALSUBLZEPHOUDB-OAQYLSRUSA-N 393.446 5.007 30 20 GKED C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487427123 HQVLVRCKCZRHMO-UZLBHIALSA-N 382.891 5.100 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 487545550 TYJUXKGAGIWYIB-AUUYWEPGSA-N 391.298 5.312 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Sc2nc(C(F)(F)F)ccc2C#N)c(C)c1 488802447 RETDNXVUWMVFGB-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED CSc1cccc([C@@H](NCc2cc(C#N)ccc2F)c2ccc(F)c(F)c2)c1 494021765 ZROMLLWWTGZUQP-JOCHJYFZSA-N 398.453 5.577 30 20 GKED Cc1ccc2snc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 496406779 JDUUUJJBFMIBDY-LBPRGKRZSA-N 383.885 5.358 30 20 GKED CCN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@H](C)c1cccc(OC)c1 508614928 MGLFXSKSBRWWRJ-LJQANCHMSA-N 388.515 5.055 30 20 GKED CCc1cccc(CC)c1NC(=O)c1cccc(OCc2ccccc2C#N)c1 512370652 VIOMPHZPZWHDSF-UHFFFAOYSA-N 384.479 5.514 30 20 GKED Cc1ccc(NC(=O)Nc2cccc3c2CCN(c2ccc(C#N)cc2)C3)cc1 518296160 ITNQQJQJWZKTSV-UHFFFAOYSA-N 382.467 5.073 30 20 GKED N#CCCSc1ccccc1NC(=O)CCOc1ccc(Cl)c(Cl)c1 521716986 SSEKKAPVPSBIBV-UHFFFAOYSA-N 395.311 5.407 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2ccsc2)nc1C 523582386 FFWKWILNCGXHRY-UHFFFAOYSA-N 375.497 5.043 30 20 GKED CC(C)c1ccc(-c2ncc(Cn3cc(C#N)c(=O)c4ccccc43)s2)cc1 525629665 LVPLUBUXLHGXTD-UHFFFAOYSA-N 385.492 5.168 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(-c4ccc5c(c4)CCO5)c3)cc2)CC1 537439978 JCNIQYOVVVLSBO-UHFFFAOYSA-N 380.447 5.096 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc3cnccc3c2)cc1Cl 537538560 OENCKINWUMRTRR-FQEVSTJZSA-N 398.853 5.191 30 20 GKED C[C@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccc(C#N)cc1 538396362 SQWKFWPMHADVHV-INIZCTEOSA-N 389.886 5.315 30 20 GKED Cc1cc2ncc([C@@H](C)N[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)c(C)n2n1 542106333 KQPQTSUBZIZFOO-QZTJIDSGSA-N 395.510 5.297 30 20 GKED Cc1oc(-c2ccccc2)nc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542948055 OIQRPMBISXTHLB-SFHVURJKSA-N 393.490 6.040 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1cc(Cl)ccc1SC1CCCC1 545298042 RDLYAKWKUVJKID-UHFFFAOYSA-N 386.904 5.507 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@@H]1CC[C@@H](C#N)C1 549933761 AIBQKLVFYCAZBZ-NORZTCDRSA-N 390.350 5.224 30 20 GKED CC(C)(C)[C@H](CC1CCCCC1)NC(=O)N1CCC(C#N)(c2ccccn2)CC1 554602201 WKOCTYKDZGEFOW-NRFANRHFSA-N 396.579 5.033 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C1CC1)C(F)(F)F 568796260 SBMFEOYBRCUAQO-SFHVURJKSA-N 389.377 5.121 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1nc2cc(F)ccc2s1 592973615 IGAURJRNUVRSNO-CQSZACIVSA-N 396.443 5.793 30 20 GKED Cc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1C(=O)N1CCCCC1 594504677 RZOSCGFTRNTMOB-UHFFFAOYSA-N 375.516 5.034 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H](CCF)C1 596703087 CZKKJGVCEKMCOZ-GOSISDBHSA-N 381.451 5.263 30 20 GKED CCCN(CC1CCCCC1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609071633 MZHQAVJBIWOLKU-UHFFFAOYSA-N 380.488 5.163 30 20 GKED CCc1ccc([C@H](C)CC(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)cc1 610053802 XBKXLCKUOXFRND-MRXNPFEDSA-N 386.499 5.056 30 20 GKED CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 610792618 DEMPGIBYOQVYKE-HTAPYJJXSA-N 393.556 5.726 30 20 GKED Cc1cc(F)c(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c(F)c1 619128040 BZMADKGSVFHMNQ-UHFFFAOYSA-N 377.275 5.057 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c(Cl)c1 619557198 VALPBZOLJWQABT-MQMHXKEQSA-N 379.674 5.194 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2ccc(OC)c(F)c2)C1 626534672 YIMSPGYXFPBAIR-LJQANCHMSA-N 396.506 5.708 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c(C)[nH]1 642281677 OTSOQLNUDSCCLP-AWEZNQCLSA-N 390.295 5.552 30 20 GKED FC(F)(F)c1cc(-c2noc(C3(C(F)(F)F)CC3)n2)cc(C(F)(F)F)c1 680681727 DCVUZELWVRFESB-UHFFFAOYSA-N 390.205 5.368 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2)sc1-c1cccc(Cl)c1 726732812 KYIVHGYADYVURM-QGZVFWFLSA-N 394.883 5.338 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1C 728062872 XRRIQBFWCDVSKV-LJQANCHMSA-N 399.494 5.193 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@@H](C)c3ccc(C(F)(F)F)cc3)[nH]c12 735792118 HUNFPWOKTFDLSM-CJNGLKHVSA-N 385.389 5.260 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3c(Cl)nc4ccccn34)cs2)cc1 737445607 BTWCMOPYADIHBX-JXMROGBWSA-N 395.871 5.016 30 20 GKED C#Cc1cccc(N(C(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)C(C)C)c1 741186198 RFKOYUUQHQTELV-MOPGFXCFSA-N 387.401 5.112 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741844194 SQDYXRHBLNHATP-YIEQYZEGSA-N 391.414 5.528 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC)c(F)c2)c(SC)cc1OC 741846240 AGJLZWFXECUYGX-ALCCZGGFSA-N 378.490 5.183 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)s1 742656221 DDHOEVIYKZEPLM-KEDPEKRHSA-N 394.327 5.142 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)N[C@@H]2CCc3ccccc3C2)cc1 742984828 NMSCHWSJYWDAAV-DNQXCXABSA-N 397.547 5.186 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)cc1C(F)(F)F 743216536 SPRLXXFEGYHHCZ-QGZVFWFLSA-N 395.331 5.224 30 20 GKED CC(=NNc1ncnc2sc3c(c12)CCC3)c1ccc(-c2ccncc2)cc1 745193743 FSTPCJLWZJOKPG-UHFFFAOYSA-N 385.496 5.078 30 20 GKED CC(C)c1cc(C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)c2ccccc2n1 764315633 PUVHROYDIDLECY-UHFFFAOYSA-N 394.818 5.044 30 20 GKED CC(=NOCc1ncc(Cl)cc1Cl)c1nc2ccccc2n1C(F)F 776829278 HLTVAFGNOCZCJA-UHFFFAOYSA-N 385.201 5.074 30 20 GKED CCNc1ccc(C#N)cc1NCc1ncc(-c2cccc(Br)c2)o1 776848838 HSBVHEVCSQTMMP-UHFFFAOYSA-N 397.276 5.020 30 20 GKED N#C[C@H](C(=O)c1cc2cccc(Cl)c2o1)c1nc2ccccc2n1C(F)F 783070721 WDJSJMDJRRMADO-LLVKDONJSA-N 385.757 5.321 30 20 GKED N#C[C@@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 792089867 AVZHFPGTQNDPKC-NOZRDPDXSA-N 390.486 5.828 30 20 GKED N#C[C@H](C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1nccc2ccccc12 792095156 KAVIUJCOXUSSPJ-CIOCTPQZSA-N 398.428 5.560 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)cn1 792884837 SIJZQYNFFTUQIT-QXMHVHEDSA-N 399.475 5.172 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@H](CC#N)c2ccccc2)c1 793479973 VYDUYQLEVNMALB-NRFANRHFSA-N 384.504 5.350 30 20 GKED Fc1ccc([C@H](CC(F)(F)F)NC(=S)NCCCCC(F)(F)F)cc1 794981655 DKZFHCPOTWEZIP-LBPRGKRZSA-N 390.368 5.016 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CSCc2ccc(Cl)cc2)s1 797569128 NKKYWFYFHVVFEC-CQSZACIVSA-N 378.950 5.204 30 20 GKED C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797573729 VKQBGDMFMYHHOJ-IUODEOHRSA-N 388.920 5.179 30 20 GKED C[C@@H](C#N)OCCOC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 801863138 WFINQSXETLPOLO-INIZCTEOSA-N 399.446 5.019 30 20 GKED Fc1ccc(CCN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(Cl)c1 811472916 MCVLGMLMOVNPQN-PJXYFTJBSA-N 391.758 5.521 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cn(C)nc2C(F)F)CC3)cc1 812241843 NOIWLOXXNMAWAD-LCYFTJDESA-N 385.439 5.002 30 20 GKED CC(C)(C)c1csc(NC(=O)N2CCCCC[C@H]2c2ccncc2)c1C#N 821482911 YYCJYQKLEKLTRL-SFHVURJKSA-N 382.533 5.461 30 20 GKED C=C1CCC(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)CC1 885653560 QCQYYSSCDOTXIV-UHFFFAOYSA-N 398.528 5.234 30 20 GKED N#CCOc1cccc(NC(=O)c2ccccc2OCc2ccccc2Cl)c1 915742539 POOSTXXTRAYTGA-UHFFFAOYSA-N 392.842 5.074 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1OC 915990342 NKFHYRUYEYUNCA-KTKRTIGZSA-N 394.496 5.289 30 20 GKED O=C(/C=C\c1cc(Br)ccc1OC(F)F)c1cc(F)ccc1F 916134983 VNEJZEHQTPVACF-KTAJNNJTSA-N 389.142 5.225 30 20 GKED C=CCn1c(Cc2ccccc2)nn(CN2CCC[C@@H]2c2ccsc2)c1=S 917454326 BTKMZWLDSNOYCC-LJQANCHMSA-N 396.585 5.047 30 20 GKED Brc1ccc(C=NOCc2csc(Cc3ccccc3)n2)cc1 918733412 RIHMTKABPGMEMN-UHFFFAOYSA-N 387.302 5.047 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCSC(F)(F)F 919907764 MDDMSCPAECPRBX-UHFFFAOYSA-N 395.406 5.034 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccccc3Cl)n2)cc1 920141665 LHZHWKISNQXPSS-QGZVFWFLSA-N 391.883 5.144 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccccc1OCc1ccc(Cl)cc1 1776031929 FCDJWACPOPINCD-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CCC(=NNc1ccc(C(C)C)cc1)c1ccc(OCCCCC(=O)O)cc1 1776060482 XCAPKGIYAQRKRH-UHFFFAOYSA-N 382.504 5.670 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776471094 JJLJVNKWSWVBLH-BCPZQOPPSA-N 396.386 5.047 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(C[C@@H](C)C(=O)O)cc2)cc1 1776788974 HPNGNDITXLHZHF-LJQANCHMSA-N 383.532 5.911 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(/C=C/C(=O)O)cc3)s2)cc1 1777430644 XWMJGULJEKXEQP-ZKLMZBBOSA-N 389.476 5.421 30 20 GKED O=C(/C=C\c1ccc(Cl)c(F)c1F)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570050 GPJAHBIYDGBASM-VURMDHGXSA-N 388.753 5.473 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccc(C(C)(C)C)cc3)o2)cc1 7164284 BBOSXFBSXPTWLL-IBGZPJMESA-N 377.513 5.570 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(C#N)cc1 26127923 YVYAXNAFVRWVJS-MRXNPFEDSA-N 383.476 5.072 30 20 GKED COc1cccc(SCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCCC2)c1 27662529 HBSUOMAEMUBQBX-UHFFFAOYSA-N 397.544 5.221 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CSc2cc(Cl)ccc2Cl)cc1 29150575 ITGKGVGUSAKBLQ-UHFFFAOYSA-N 379.312 5.525 30 20 GKED N#C[C@H](C(=O)c1ccccc1NC(=O)c1cccs1)c1ccc2ccccc2n1 48856205 WCCFIHZLTDHKIY-KRWDZBQOSA-N 397.459 5.039 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Br)ccc2o1)c1ccc2ccccc2n1 48856915 WTHHEXKTPXTSMB-HNNXBMFYSA-N 391.224 5.234 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccccn1 56750871 XYTCDJDFUIPOTC-CQSZACIVSA-N 392.846 5.282 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)N[C@H](C)c1ccc(Cl)cc1 66861310 UEORUROEWRKRHQ-HUUCEWRRSA-N 387.936 5.024 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccco1 108528607 ZBMYMVYKLDWMMT-IIBYNOLFSA-N 391.496 5.442 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 120274979 PDMVTJFTXWGCBF-JOCHJYFZSA-N 398.466 5.105 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccncc1 136725883 JESFFGDDZZKQED-GUYCJALGSA-N 381.888 5.229 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)o1 159983692 XXSLGYPDTHPWGU-BXWFABGCSA-N 397.544 5.845 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccccc1 160484177 ZZGGZVFTFRKSAQ-CQSZACIVSA-N 383.439 5.011 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(Br)s1 173133907 QPORSNYTTWKOAO-LLVKDONJSA-N 395.347 5.259 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1c(F)cccc1F 182857750 BBUITMCBXVCCGH-CYBMUJFWSA-N 392.496 5.088 30 20 GKED C=CC[C@H](C(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1ccccc1 187445015 VVDOFHSPSPFONU-IBGZPJMESA-N 396.918 5.265 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)c(C)n1[C@H](C)c1ccccc1 193536956 XXPLFEXOEOQODK-OXQOHEQNSA-N 383.451 5.346 30 20 GKED CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 195737649 WGHCVKZYENJTBU-FGZHOGPDSA-N 375.516 5.678 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F 246683498 HLMUPWFHNKYUEK-JXXFODFXSA-N 397.519 5.692 30 20 GKED O/C(=N/[C@H]1CCCO[C@@H]1c1ccncc1)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 328636278 ADQWYZQKJHZOKN-IIHSZXCVSA-N 391.298 5.369 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(O)=Nc2nc(C3CCOCC3)cs2)c1 329427902 JJPLQVRVNKJTBF-IBGZPJMESA-N 385.533 5.037 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21 416812154 LNPNNXRRCAOBOX-HNAYVOBHSA-N 390.512 5.009 30 20 GKED Cc1nc(CC(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c(C)s1 428341014 MFNRWXMFPLFXLZ-ZDUSSCGKSA-N 387.574 5.025 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c1C 428759269 KTQYWEXGXHZXBT-KRWDZBQOSA-N 379.504 5.455 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H]2CCCC[C@H]2C1 429030959 SQPPWISQDZHBDK-OALUTQOASA-N 375.472 5.313 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 437838292 JIDYUQCQZBAIIM-QGZVFWFLSA-N 397.544 5.654 30 20 GKED C[C@@H](NC(=O)Nc1ccnc(Oc2ccccc2Cl)c1)c1ccc(C#N)cc1 438375871 KJCMUYWHOCOZLN-CQSZACIVSA-N 392.846 5.282 30 20 GKED N#Cc1ccc(CSCc2csc(-c3ccccn3)n2)c(OC(F)F)c1 439542129 ORNHCTRRQGNOES-UHFFFAOYSA-N 389.452 5.112 30 20 GKED Cc1cc(C)cc(-c2nnc(SCc3ccc(C#N)cc3OC(F)F)o2)c1 439545915 VYIYCKSZQHZBNL-UHFFFAOYSA-N 387.411 5.119 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1cccc(C#Cc2ccccn2)c1 443588191 AQFQKQPZRBOWCY-UHFFFAOYSA-N 394.478 5.017 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)Nc1ccc(CC#N)cc1Cl 455725908 DNIDKIBAHDAPAG-YWZLYKJASA-N 397.906 5.420 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CC[C@H]3CCC[C@H]3C2)cc1 461413170 AHZIDISWLAWUMX-QHAWAJNXSA-N 390.552 5.549 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)s1 464472898 GAZRLBAHLFPKNQ-AWEZNQCLSA-N 387.386 5.022 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccccc1C1CC1 466460744 FFVQOHXZRPGASE-INIZCTEOSA-N 396.581 5.830 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC[C@H]1c1ccccc1 472683872 NZFMXUIELSANAN-PGRDOPGGSA-N 375.516 5.535 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)C[C@H](CC#N)c3ccccc3)ccc2C)c1 476104825 NWMUUIUUEFVYMM-FQEVSTJZSA-N 385.467 5.517 30 20 GKED C=CCOCCCS[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 479611867 HOTOGDKRRJMRBT-LLVKDONJSA-N 381.847 5.012 30 20 GKED O=C(NCc1ccc(C(F)F)cc1)N[C@H](c1cccc(F)c1F)C(F)(F)F 482415597 AYFYCNWGVKORSK-CQSZACIVSA-N 394.290 5.005 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)Nc1sc2c(c1C#N)CCCC2 483073637 MFRPLGJLAPTEMZ-UHFFFAOYSA-N 377.469 5.023 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1-c1ccc(F)cc1 483213999 NFBRNERAAKCWML-FQEVSTJZSA-N 386.451 5.901 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 483836070 DEJSOCSGYMAKQH-QFBILLFUSA-N 394.824 5.489 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Sc1nc(C(F)(F)F)ccc1C#N 488798947 QNKWAHGQPLPLSR-SNVBAGLBSA-N 399.825 5.053 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)[S@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488802640 HIIDZSCXMWXKNH-HUVZLPTESA-N 384.316 5.272 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H](C)c1cccc(C(F)(F)F)c1 492805360 FUMFYAZIQUVCFZ-LSDHHAIUSA-N 396.478 5.021 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1ccc(SC)cc1 503907440 ACCFSMQCVYJFNX-KRWDZBQOSA-N 386.565 5.035 30 20 GKED C=CCN(C(=O)c1ccccc1OCC1CC1)c1nc(-c2ccccc2)cs1 508901148 UIWUZHWFTIFXMG-UHFFFAOYSA-N 390.508 5.432 30 20 GKED Cc1cc2cc(CNCc3cccc(OCc4ccccc4C#N)c3)ccc2[nH]1 513055645 DCLJZXSEQPANSK-UHFFFAOYSA-N 381.479 5.217 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4nc5ccccc5s4)cc3c2C1 513682825 YWKBIBCYBYGUSR-DYVFJYSZSA-N 385.492 5.392 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 515100710 DNRDRZMHJIBGRR-HXUWFJFHSA-N 390.512 5.124 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCCCOc1cccc(C#N)c1 518904299 HBMJLRCJIJBBIN-UHFFFAOYSA-N 388.920 5.037 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2[nH]c3ccc(F)cc3c2Cl)cc1 521770029 YEOJPHSLLAWTIL-KRWDZBQOSA-N 383.854 5.253 30 20 GKED C=CCOc1c(Br)cc(CNc2ccccc2OCC)cc1OC 522282973 KCWOZFHGPUOXJV-UHFFFAOYSA-N 392.293 5.033 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1cccs1 523108375 OPMHESYVMNHEJA-AWEZNQCLSA-N 380.444 5.080 30 20 GKED Cc1ccc(S(=O)(=O)c2ccc(CSc3ccc(C#N)cc3F)cc2)cc1 525115676 XWHKKOHMFFQUIU-UHFFFAOYSA-N 397.496 5.131 30 20 GKED COc1ccc([C@H](NCc2cc(C#N)cs2)c2ccccc2Cl)c(OC)c1 530640307 LWBDQGDUIMANEY-OAQYLSRUSA-N 398.915 5.170 30 20 GKED C=C(C)[C@H](CC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1)OCC 535147903 SKUUIDLXYIBAEV-KRWDZBQOSA-N 392.952 5.027 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(OC(C)C)c(C#N)c2)c1C1CC1 536475912 IQBZUWDNGQVPDZ-CQSZACIVSA-N 381.480 5.034 30 20 GKED C[C@H](N[C@H]1c2cc(Br)ccc2SC[C@@H]1C)c1ccc(C#N)cc1 538394361 XRVKVUKVRMJRNI-WTOJCKNJSA-N 387.346 5.454 30 20 GKED C[C@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccc([N+](=O)[O-])cc1F 541612053 OYMBGEDWJYOYHM-LBPRGKRZSA-N 395.415 5.076 30 20 GKED COc1ccc(C#N)cc1CN[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 541661308 WCRSHHDVPCIKSN-OAHLLOKOSA-N 377.513 5.158 30 20 GKED Cc1ccc(C)c(Oc2ccc(CN[C@@H](C)c3ccc(C#N)cc3F)cn2)c1 541904814 PVPDPFJHOMYBDY-KRWDZBQOSA-N 375.447 5.352 30 20 GKED Cc1ccc(CN(C)C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 543016484 LZCTWURQLJKSBR-KRWDZBQOSA-N 389.524 5.498 30 20 GKED C=CCC[C@H](NCc1nnc(C2CC2)n1C1CC1)c1ccc(C(F)(F)F)cc1 543980941 UKCMPKMJCXQLDX-SFHVURJKSA-N 390.453 5.306 30 20 GKED CC(C)n1c([C@@H]2CCCN2C(=O)c2ccc(C#N)c(Cl)c2)nc2ccccc21 548305883 YVGJMLVJWMWFNB-FQEVSTJZSA-N 392.890 5.120 30 20 GKED COc1cc(C(=O)Nc2ccccc2CC#N)cc(Cl)c1OCCC(C)C 550078958 CVUXFMSASYDTTC-UHFFFAOYSA-N 386.879 5.092 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)ccc1F 551285464 CAGUJIQFPWAAQQ-UHFFFAOYSA-N 391.349 5.092 30 20 GKED CCC(CC)N(C(=O)c1ccc(C#N)c(Cl)c1)[C@H]1CCCc2cccnc21 554731546 NCEGOKCNJBUGRW-FQEVSTJZSA-N 381.907 5.315 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 561129896 COWDTFWMRQFUFU-SPLOXXLWSA-N 391.515 5.858 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2cccc(Cl)c12)c1cccc(Cl)c1Cl 563289910 YVPLCVCZJGPXBP-HNNXBMFYSA-N 392.673 5.052 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1cccs1 570539881 WJZWYQMAEXJAFG-RDTXWAMCSA-N 385.558 5.615 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@H]2CC[C@H](C(F)(F)F)C2)n1 575954909 KTDYCZPVUNDDKJ-ZMLRMANQSA-N 382.279 5.593 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc2n[nH]cc2c1 576013988 MAMURMAIKBEKDY-HNNXBMFYSA-N 397.438 5.110 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc(-c4ccccc4Cl)on3)c2C#N)C1 603587662 OWZGINGCJKMPAU-NSHDSACASA-N 397.887 5.305 30 20 GKED CCCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603690445 PCXDCNQNLAXNCS-UHFFFAOYSA-N 386.455 5.190 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cccc(Oc3nccs3)c2)cc1 609911823 ZEHUGBBSDDTHTN-IBGZPJMESA-N 391.496 5.228 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@@H]1C 610019256 JYFUSXZQEIOBMA-GJZGRUSLSA-N 383.492 5.229 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCc2ccccc2OC2CCCC2)c(Cl)c1 611093520 RWGVDLATZYMXMC-UHFFFAOYSA-N 389.282 5.116 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 611390946 WXEOCEFLZRBZRE-WBTNSWJXSA-N 390.371 5.435 30 20 GKED O=C(Nc1cccc(Cl)c1F)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618538933 QWRBYKIBUBYJCZ-YUMQZZPRSA-N 392.702 5.074 30 20 GKED CN(C(=O)c1cc(C(F)(F)F)ccc1F)c1cccc(OC(F)(F)F)c1 622353545 SGCUHCGGKIDSGO-UHFFFAOYSA-N 381.247 5.020 30 20 GKED C=CCn1c(Sc2ncnc3sc(C)c(C)c23)nnc1-c1ccccc1F 669624594 QGCBLSURYFQESE-UHFFFAOYSA-N 397.504 5.043 30 20 GKED FC(F)(F)c1csc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)n1 676307711 ZIVMLCKBXQDQLR-WDSKDSINSA-N 386.283 5.483 30 20 GKED Cc1ccc2c(CC(=O)Nc3sc4c(c3C#N)-c3ccccc3CC4)c[nH]c2c1 726142834 DIIILLSPORVSEK-UHFFFAOYSA-N 397.503 5.356 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2cc(C)c(-c3ccc(F)cc3)s2)c1 726733230 SPBZSCFLECONTB-SFHVURJKSA-N 392.455 5.132 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CCC#N)CC(C)(C)C)c3ccccc3n2)o1 729445261 GBSXEKZXUCKMPW-UHFFFAOYSA-N 375.472 5.205 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1csc2ccccc12 730067939 IFJKUIVENDSRTM-MRXNPFEDSA-N 377.513 5.454 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(C(C)C)cc1 733079790 KWJFLSFUJZXROW-UHFFFAOYSA-N 399.420 5.517 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)cc1OC 734304679 RZVOFMXMWWTAJN-MDZDMXLPSA-N 379.481 5.340 30 20 GKED C=CC[C@H](NC(=O)NCC(C)(C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734663535 PCSOAVJIZJUIGF-SFHVURJKSA-N 392.330 5.283 30 20 GKED Cc1ccc(OC(F)F)c([C@H](C)OC(=O)c2ccccc2SCC#N)c1 734737191 IZAQGOMSRWAUJJ-ZDUSSCGKSA-N 377.412 5.130 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1cc(OC)c(OCC)c(OC)c1 735978550 ICBLEIQHUXUGOI-VQHVLOKHSA-N 390.863 5.051 30 20 GKED C#Cc1ccc(C(=O)N(c2cccc(N3CCCC3)c2)C2CCCCCC2)cn1 741936074 FILPWTHLTBIFKU-UHFFFAOYSA-N 387.527 5.033 30 20 GKED CCCCCCC[C@H](C)CNC(=O)Nc1cccc(N2CCOC2=O)c1C 743243187 BYALURSHKYYHOE-INIZCTEOSA-N 375.513 5.070 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 747108137 MFJBKPCJXNYSIY-CMPLNLGQSA-N 395.673 5.098 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)n1 747197946 PDWNMBDJZPKVFT-RBSFLKMASA-N 379.312 5.553 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 756232766 XOWXHWIMRZQAJH-BLLLJJGKSA-N 389.282 5.468 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cncc3ccccc23)cc1 765591412 SSSIDDMRVNSQKH-SBUREZEXSA-N 399.494 5.028 30 20 GKED COc1ccc(NCc2cccc(OCCCC#N)c2)cc1OC1CCCC1 770526451 CLSVFXZQPPOVRS-UHFFFAOYSA-N 380.488 5.311 30 20 GKED COc1ccc(CNc2cc(Cl)c(OC)c(Cl)c2)cc1OCCCC#N 770551955 AKKLINIIDHIFPB-UHFFFAOYSA-N 395.286 5.305 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1 770559796 PHUKBLLBXKNVRQ-UQBPGWFLSA-N 386.495 5.256 30 20 GKED CCc1cnccc1C(=O)/C=C/c1csc(COc2ccc(Cl)cc2)n1 776190752 YNNWXQFZVYVWEQ-VMPITWQZSA-N 384.888 5.229 30 20 GKED C=CC[C@H](C(=O)O[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 778427477 FSLIVWBLQZTMLB-PXNSSMCTSA-N 376.456 5.318 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 780677639 GSBNBEJCWSJVAF-JXFKEZNVSA-N 397.906 5.780 30 20 GKED Fc1ccc(-c2csc3ncnc(NN=Cc4scnc4C4CC4)c23)cc1 782171281 VHFLVABWCZSQKG-UHFFFAOYSA-N 395.488 5.277 30 20 GKED O=C1/C(=C/c2scnc2C2CC2)CCc2nc(-c3ccc(F)cc3)sc21 782324927 IQKTUAHSQQSZRZ-UKTHLTGXSA-N 382.485 5.496 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCC(=O)c3ccccc32)cc1 785852379 VFDMPGITIBLWLA-DHIUTWEWSA-N 380.447 5.041 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2cc(F)ccc2s1 786401379 IPCWETSBTVPXBZ-MXWKQRLJSA-N 376.865 5.130 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(O)c3ccccc3c2)cc1 792057365 MGVXQDDBJNJDJN-HSZRJFAPSA-N 378.431 5.453 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 796469112 FLJUMWNHVQKBME-JLTOFOAXSA-N 390.405 5.117 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccncc1 796480874 AKHBSJITAFMYSX-QHCPKHFHSA-N 379.463 5.344 30 20 GKED C#CCCN(CC(F)(F)F)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 799721478 JAJGLVXIPMXEMM-UHFFFAOYSA-N 389.204 5.016 30 20 GKED CC1=C(c2ccco2)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 801612275 MQVWESDZKYEMMY-QFIPXVFZSA-N 397.478 5.646 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)ncc1F 815636235 RFQXPIKMVDKCRJ-GUYCJALGSA-N 376.273 5.069 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 837099538 GPUJHSFPAXJRPQ-AEFFLSMTSA-N 384.932 5.412 30 20 GKED CC(C)CN(C(=S)Nc1ccccc1C#N)c1ccc(C(F)(F)F)cc1 840812159 MGLTWCCYYSYSOD-UHFFFAOYSA-N 377.435 5.436 30 20 GKED CCc1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)s1 916449977 VCGUAFQLQPVCGO-UHFFFAOYSA-N 376.481 5.208 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(C(F)(F)F)c2)cc1 916946950 BQCKAOSPUUQAPM-FZKQIMNGSA-N 388.389 5.180 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3c(F)cccc3s2)cc1 916955690 SXCPJIGGLDXAQA-GUYCJALGSA-N 394.471 5.515 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCOc3c(C)cccc3C)n2)cc1 916974837 SAIQVBIAURFORW-LJQANCHMSA-N 390.508 5.381 30 20 GKED CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)Nc1ccc(C#N)cc1C1CC1 933843061 VXFRFKSLNFQATJ-OFNKIYASSA-N 389.499 5.067 30 20 GKED COc1cc(C)ccc1Oc1ccccc1C=NNc1ccc(F)c(C(=O)O)c1 1776063727 FQEUSDHDQWRQEO-UHFFFAOYSA-N 394.402 5.079 30 20 GKED O=C(O)c1cc(Br)cc(/C=C/C(=O)c2cccc3ccccc23)c1 1776114703 YBBIVUFXSWVJIW-CMDGGOBGSA-N 381.225 5.197 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1ccc(F)c(Cl)c1)C(=O)O 1776170963 UNIKNLILQAUKRH-GOSISDBHSA-N 395.833 5.310 30 20 GKED C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)s1)c1nc2ccccc2n1CC#N 1776197265 RQPILXSFPLXOFP-PFONDFGASA-N 399.475 5.547 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(N(C)C)cc1C(F)(F)F 1776784225 VPOZZGYGQRJUQO-MRXNPFEDSA-N 388.474 5.065 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2sc3c(c2C(=O)O)CCC3)cc1 1776786643 PWZHXLNHZBAHMZ-UHFFFAOYSA-N 399.556 6.090 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2cccc(O[C@H](C)C(=O)O)c2)o1 1777424541 ITRICXZNTLXIMA-JOZWUWCOSA-N 394.398 5.142 30 20 GKED Cc1ccc(-c2ncc(/C=C3\CCc4oc(C(=O)O)c(C)c4C3=O)s2)cc1C 1777431432 JMRBQVGVQCTVJF-NTEUORMPSA-N 393.464 5.239 30 20 GKED CCn1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 7427492 OHWJETQOLCEXAE-GOSISDBHSA-N 382.920 5.154 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccccc2-c2ccccc2C#N)c1 8176450 VDZIKUNQTPBRDM-GOSISDBHSA-N 398.462 5.026 30 20 GKED CCn1c(S[C@@H](C)C#N)nnc1-c1cc(-c2ccccc2)nc2ccccc12 9840753 RZPADKUUQHYWSK-HNNXBMFYSA-N 385.496 5.184 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(-c3cccs3)on2)n1 10399527 LTVGXLQQMCRTMC-UHFFFAOYSA-N 381.404 5.289 30 20 GKED Cc1ccccc1CSCC(=O)Nc1c(C#N)c(C)c(C)n1C1CCCC1 12253499 QGJLBCPSORGVKV-UHFFFAOYSA-N 381.545 5.272 30 20 GKED CCn1c(S[C@H](C#N)Cc2ccc(C)cc2)nc2cc3ccccc3cc2c1=O 24892348 DKDCGFIAOYNJOB-FQEVSTJZSA-N 399.519 5.105 30 20 GKED C=CCOc1ccc(/C(O)=N/c2nnc(SCc3cccs3)s2)cc1 50004805 DEUZWOJLHGPSGJ-UHFFFAOYSA-N 389.527 5.093 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1 55568224 FFMKSUMGNLSTNK-UHFFFAOYSA-N 384.526 5.100 30 20 GKED C=CCCC(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 60364794 NMTZPFWPUNOKGI-UHFFFAOYSA-N 382.529 5.254 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F 108239349 KSHXAYPERPSXQS-CYBMUJFWSA-N 378.419 5.138 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccco1 108528599 ZBMYMVYKLDWMMT-IERDGZPVSA-N 391.496 5.442 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(C[S@@](=O)C3CCCCC3)c2)cc1 133307446 FFDZHSRDCYDLOJ-JMQGSBJISA-N 396.556 5.171 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1Cl 171367188 YPKGHBBICPCPSF-IEZBTEQYSA-N 385.801 5.365 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3cccc(C#N)c3)s2)cc1 178178884 NTTADFPSFQUSQU-GJZGRUSLSA-N 377.513 5.411 30 20 GKED CC[C@@H](CSC)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 181199993 PAJJIUXKKRHNNJ-IBGZPJMESA-N 397.544 5.051 30 20 GKED COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(OCC#N)cc3)s2)cc1 181850274 BJNXBELGUFSNHH-INIZCTEOSA-N 378.497 5.177 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)c1 183344020 CKNVQSMNVAWPTM-HNNXBMFYSA-N 376.275 5.109 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@](O)(c1ccc(C)o1)C(F)(F)F 188062676 IWFWBAVVEDKIDV-HXUWFJFHSA-N 395.421 5.219 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 191743746 PFMLWEWBYMZIRW-INIZCTEOSA-N 384.545 5.127 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(C)=C\c3ccc(F)cc3)n2)cc1 255632137 ZSXJUONKUNTNNZ-RNUYOQPASA-N 392.455 5.238 30 20 GKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 273298231 DYNPEOOLJWHDPA-SFTDATJTSA-N 395.478 5.011 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1sc2cccc(F)c2c1COc1ccccc1 303117963 LRGGXJQJJYRDLR-OAHLLOKOSA-N 396.487 5.241 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 303238223 ZTJBMBZJFJOORZ-KRWDZBQOSA-N 398.890 5.757 30 20 GKED O/C(=N/[C@@H]1CCCC(F)(F)C1)C1CCN(c2noc3ccc(Cl)cc23)CC1 328925610 OHLHFXSTCZUGTC-CQSZACIVSA-N 397.853 5.232 30 20 GKED COc1ccc(C2(/N=C(/O)C3CCC(/N=C(/O)C4CC4)CC3)CCCC2)cc1 330030487 RRYZTKOQDIZIDB-UHFFFAOYSA-N 384.520 5.346 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)c1 409836699 OMBBBTPQAOFSEW-QZTJIDSGSA-N 389.282 5.418 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1)c1ccccc1 410189995 ASKJGDDKWNNRRD-SFHVURJKSA-N 384.882 5.215 30 20 GKED N#CC1(CCCN2CCC(Cc3cc(Cl)ccc3Cl)CC2)CCOCC1 410384973 ACEHHOIJUIKCTI-UHFFFAOYSA-N 395.374 5.348 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)c1 412339705 VEARTTKYMVPPLR-SESVDKBCSA-N 398.428 5.087 30 20 GKED Cc1ccc(C[C@@H](NC(=O)Nc2ccc(C#N)cc2Cl)c2ccccn2)cc1 426158521 CBTXAYCQBTVPDE-OAQYLSRUSA-N 390.874 5.021 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)C[C@@H](C)c2c[nH]c3ccccc23)cc1 426464108 ZZZUKUUEGYRTJD-QGZVFWFLSA-N 375.472 5.007 30 20 GKED CC(C)(NC(=O)c1cccc(SCC#N)c1)c1ccc(Cl)c(Cl)c1 429793990 HIOCKEPWKWNFEJ-UHFFFAOYSA-N 379.312 5.274 30 20 GKED CCC(CC)n1nccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 431169053 KVIDMSYLIRHUDF-KRWDZBQOSA-N 378.501 5.166 30 20 GKED CCCOc1cccc(CCNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 434222644 LGFHNFWVACGMRW-QGZVFWFLSA-N 397.544 5.091 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 434982096 NIXNSXQAHYTKEC-NVXWUHKLSA-N 398.457 5.499 30 20 GKED Cc1oc(C#N)cc1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 435459893 PGHLBTUGKXSKPD-LJQANCHMSA-N 389.455 5.215 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CN[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 436285014 CLMGXFVKPNUHSG-SKDZVZGDSA-N 376.953 5.404 30 20 GKED CCCCc1ccc([C@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 441183218 WISXBEBFKZSGTP-HSZRJFAPSA-N 388.515 5.438 30 20 GKED N#CCC[C@@H](NC(=O)N1C[C@@H](c2ccccc2)c2ccccc21)c1ccccc1 445216129 NQXFOYYYGHHLRT-XZOQPEGZSA-N 381.479 5.393 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c(Cl)c1 455727243 FXNNTRSUJNZVJC-IBGZPJMESA-N 388.298 5.819 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccc(F)cc2C#N)cc1 462636877 AQUPJJAVHIHNQI-UHFFFAOYSA-N 394.833 5.206 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)F)CC1 470188395 PFIGOOGBOBYFQO-OSYGOLDCSA-N 390.474 5.006 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(N4CCCCC4)c4ncccc34)cc2)CC1 471431106 LXRWNIHXZDFADD-UHFFFAOYSA-N 396.494 5.033 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 475564664 NLLKBHVEXJLZIX-INIZCTEOSA-N 380.536 6.227 30 20 GKED CCCC(C#N)(CCC)NC(=O)Cc1csc(-c2ccc(Cl)s2)n1 475736731 IOYWSCYYWOOGGP-UHFFFAOYSA-N 381.954 5.046 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCCC(=O)c1ccc(C)cc1 476785776 KRISADGIBDXVJS-UHFFFAOYSA-N 377.528 6.229 30 20 GKED Cc1[nH]c2ccc(OCC(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2c1C 478823479 LYLIPEZEABMAMX-AWEZNQCLSA-N 393.512 5.197 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cccc(-c2nccc(C)n2)c1)c1ccc(F)c(F)c1 480594512 WLMCSMHIHCHBTJ-HXUWFJFHSA-N 394.425 5.169 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)[C@@H](C)C(C)C 481748752 ZIQLQPSZJZFDKE-INIZCTEOSA-N 383.467 5.175 30 20 GKED C=CCSc1ccccc1C(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1 486482957 BSHOSLCNJAUHRK-UHFFFAOYSA-N 391.540 5.060 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1ccc(F)cc1C(F)(F)F 487768871 SHZKSCPFTUEWOQ-SNVBAGLBSA-N 393.302 5.224 30 20 GKED C=CC[C@@H](C(=O)N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 488677228 RIQLPXJNBAGAHD-YADARESESA-N 386.495 5.198 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@H]2CCCC(F)(F)C2)cc1 503138226 GFNJRCTXYSXHLY-KRWDZBQOSA-N 384.426 5.096 30 20 GKED Cc1cc(Br)ccc1SCC(=O)Nc1sc(C)c(C)c1C#N 505044156 MBGGXKSBGMKYJR-UHFFFAOYSA-N 395.347 5.038 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCCCC#N)c2)c(C)cc1Br 506966890 YURLPEXJSLWTER-UHFFFAOYSA-N 387.277 5.001 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1c[nH]c2cc(F)ccc12 508943370 XMSKANOADKHGOE-UHFFFAOYSA-N 375.428 5.088 30 20 GKED CCCCS[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 518668808 NHCQSZCMZOPDON-GFCCVEGCSA-N 390.496 5.571 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(F)c2)CCCC1 519433067 OYSPCOOMPNMFIM-INIZCTEOSA-N 382.504 5.528 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524417281 UGNZABUVCSXDHF-JOCHJYFZSA-N 386.451 5.016 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(Cl)c1Oc1cccnc1)c1ccccc1 536243770 KINPLPNKMGZGQY-MRXNPFEDSA-N 378.859 5.826 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(Cl)c(C#N)c1 542539008 FUYUSFDPFSIVBD-UHFFFAOYSA-N 389.842 5.025 30 20 GKED Cc1cc([C@H](C)NCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCC2)c(C)s1 543440370 ZMHRQBZHEOGTRP-HNNXBMFYSA-N 398.576 5.059 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3nccnc23)cc1Cl 543467322 BFCTXLWIOXZJSS-IBGZPJMESA-N 398.853 5.191 30 20 GKED N#Cc1c(Cl)cccc1SCc1nnc(-c2c(Cl)cccc2Cl)o1 543958790 DGBMFJNOYXGUDI-UHFFFAOYSA-N 396.686 5.861 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)cc1 544483442 NQAVBFGSQGWLEP-UZUQRXQVSA-N 397.478 5.277 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1ncc(-c2ccc(Cl)cc2)o1 548283911 YNWVOGDFAXVYRA-UHFFFAOYSA-N 395.793 5.573 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CCC(F)(F)F 551384125 JNBDBTJOFZAXFP-UHFFFAOYSA-N 381.238 5.025 30 20 GKED N#CCCC[C@H](NCc1csc(COc2ccccc2)n1)c1ccccc1 552312134 SIEBAEJWHKYQMU-NRFANRHFSA-N 377.513 5.247 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CCc2ccc(Cl)c(Cl)c2)c1 556477336 LFEPMWYKVAULBZ-UHFFFAOYSA-N 385.197 5.038 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccccc1-c1ccccc1C#N 561231556 GIUXHOCQWMPGFO-UHFFFAOYSA-N 398.510 5.221 30 20 GKED Cc1cccc2c(CCC(=O)N(Cc3ccccc3)c3ccccc3C#N)c[nH]c12 562214181 NWZAYIMNTYFSAG-UHFFFAOYSA-N 393.490 5.514 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)NCC2(C#N)CCC2)nc1-c1ccccc1 569094514 NPYAEAOJDZPJTF-SFHVURJKSA-N 392.503 5.005 30 20 GKED C=CCN(C(=O)c1ccccc1OC1CC1)c1nc(-c2ccccc2)cs1 570914622 CEUWCNUKUDRACV-UHFFFAOYSA-N 376.481 5.184 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ncc(C(F)(F)F)s1 572731703 UFYDVYQHZPFROH-UHFFFAOYSA-N 381.832 5.097 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)NCC(C)(C)CCC#N)oc2c1 588783022 WRLYZNPMRHPQLL-UHFFFAOYSA-N 376.456 5.168 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(OCC(F)(F)F)c1C 590144547 IOYRPJHGQXGEKC-UHFFFAOYSA-N 378.394 5.156 30 20 GKED C[C@H](NC(=O)N1CCC2(CC1)CC2(F)F)c1ccc(-c2cccc(C#N)c2)cc1 593391959 RFZDAVKKFUPQFI-INIZCTEOSA-N 395.453 5.117 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccccc1F)CC1CC1)c1ccccc1 596605430 CUCQZZDQVDLCAU-QFIPXVFZSA-N 379.479 5.182 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 596691879 PYSDBCMFBHPMKH-OXJNMPFZSA-N 392.890 5.153 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3)cn2)cc1 604510944 SSSKXUVCDNGQQE-UXHICEINSA-N 389.842 5.141 30 20 GKED CCc1c(C)sc(NC(=O)COc2ccccc2-c2ccccc2)c1C#N 609032841 INACPVWIDHPKJE-UHFFFAOYSA-N 376.481 5.175 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)oc2ccc(Cl)cc12 609068432 RXFATIZXBGZPHE-UHFFFAOYSA-N 376.746 5.120 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)c2ccc(C#N)nc2)c2cccs2)cc1 609641396 XDCMQCIVHAWQFX-YCRPNKLZSA-N 375.497 5.048 30 20 GKED CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610321351 RHZPEPCIOCKHKZ-UZLBHIALSA-N 378.476 5.178 30 20 GKED CSCc1c(C(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)oc2ccccc12 610599154 NWYGTKUDFLZVRO-ICSRJNTNSA-N 390.508 5.208 30 20 GKED N#CCn1c(C(=O)Nc2cccnc2-c2ccc(Cl)s2)cc2ccccc21 615061403 VKDQQZMYWNIDPW-UHFFFAOYSA-N 392.871 5.194 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)sc2cccc(F)c12 674447907 ZNDOOUBKQICLHD-RKDXNWHRSA-N 399.331 5.162 30 20 GKED C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)C1CCCCC1 726322285 UGAIZYXKUXJYCO-DOMZBBRYSA-N 381.303 5.247 30 20 GKED O=C(/C=C\c1ccccc1-n1cncn1)c1ccc(-c2ccc(F)cc2)s1 726743475 JBFNCNLSIITHPV-YFHOEESVSA-N 375.428 5.031 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C2CCCCC2)n1 726754082 ZYZYSAOEKIKRSK-JOCHJYFZSA-N 398.510 5.376 30 20 GKED Cc1ccc(C)c(Oc2ccc(CNCc3ccc(O[C@H](C)C#N)cc3)cn2)c1 728711631 LQMAKWOEBYIRCB-LJQANCHMSA-N 387.483 5.071 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C/c1nc2ccccc2s1 730988889 DOYCXCNOSATQTF-PLSXKVAHSA-N 379.510 5.200 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)c(Cl)c1 731321780 SCJRTLWOUGSEQF-AWEZNQCLSA-N 389.977 6.160 30 20 GKED C#CC[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1ccccn1 733693461 ZCDCEEOIMRQIEF-LSQMVHIFSA-N 397.474 5.072 30 20 GKED C[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 734079499 RBTLZJOQRBYFQT-FXAWDEMLSA-N 390.483 5.343 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCn3c4ccccc4c4ccccc43)[nH]c12 735789342 LEOYNEVLRIJKJA-IBGZPJMESA-N 392.462 5.246 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cc(F)c(F)cc3F)c2)s1 740450461 SOYOMYFUBJCTGF-UHFFFAOYSA-N 387.386 5.026 30 20 GKED CCOc1ccc(C=NOCc2ccc(OC)c(SC(F)(F)F)c2)cc1 742352816 XEVGOYPPOGXKNI-UHFFFAOYSA-N 385.407 5.257 30 20 GKED COc1cc(C(=O)/C=C\c2c(Cl)nc3ccccn23)ccc1SC(F)F 746347381 ZVNAWWRVFUXEIH-SREVYHEPSA-N 394.830 5.207 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C(=C\c2ccc(F)cc2)c2cccs2)n1 747196792 BKBQATAEQHZLKU-LPPOOGIUSA-N 396.512 5.884 30 20 GKED CCO[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1(C)C 748942995 RFPDWEFMKMEMJZ-BHDDXSALSA-N 391.515 5.009 30 20 GKED N#Cc1ccc(/C=C/C(=O)c2ccc(Br)cc2Br)s1 748994111 GDSNFXQBAMOZMI-GQCTYLIASA-N 397.091 5.041 30 20 GKED CCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 749048282 MAYCDUVIBHUUNB-BXUZGUMPSA-N 381.328 6.119 30 20 GKED C=C[C@H](CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 759677247 DGFBIZLUQZIKKF-QGZVFWFLSA-N 380.488 5.640 30 20 GKED N#CCOc1cccc(CC(=O)Nc2cccc(CSC3CCCCC3)c2)c1 760385598 ILXBLYOVMZKVDV-UHFFFAOYSA-N 394.540 5.336 30 20 GKED Cc1cc(/C=C\C(=O)c2c[nH]c3ncccc23)cc(C)c1OCc1ccccn1 761808795 FBKXPMCSOSYAFB-HJWRWDBZSA-N 383.451 5.050 30 20 GKED C[C@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1cnc2ccccc2c1 774067121 YTTXXLCAPLIAMV-KRWDZBQOSA-N 383.451 5.411 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2cc(C)c(C)cc2o1 783076380 JIVMSIADIJEUNX-IBGZPJMESA-N 388.467 5.136 30 20 GKED CC[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1cccc2ccccc12 783274067 CDBMUDLLMUTBLF-DEOSSOPVSA-N 385.511 5.236 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cccc4cnccc34)cc2F)c1 783589695 PNOAPUQXWRZWDL-UHFFFAOYSA-N 383.426 5.437 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](O)c1cc(F)cc(Cl)c1 785992162 IJFKUXHPQTWOAW-IBGZPJMESA-N 390.886 5.186 30 20 GKED C#CCC1(C(=O)N2CCC(c3nc(-c4ccccc4)cs3)CC2)CCCCC1 788511890 XMTHHRDTVLAFCD-UHFFFAOYSA-N 392.568 5.490 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(C(F)F)cc1 794471975 SAWISBMLCIARSC-UHFFFAOYSA-N 395.434 5.253 30 20 GKED COc1ccc(-c2ccc(NC(=S)Nc3ccccc3C#N)nc2)cc1Cl 794998194 KWERXDYPVDGRHE-UHFFFAOYSA-N 394.887 5.091 30 20 GKED Cc1ccc(NC(=O)c2cccc(OC(=O)C[C@H](CC#N)c3ccccc3)c2)cc1 796630018 CRMDGEWJLUAIND-FQEVSTJZSA-N 398.462 5.240 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570804 KPYWTOUAHZNYNV-VTCQZUJXSA-N 382.529 5.508 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2coc(C3CCCCC3)n2)cc1 802041961 JTJOYCBGYOCYRZ-KXBFYZLASA-N 393.487 5.197 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@@H](c1ccccc1)C1CCCCC1 806447524 ZRYQZCFEOWEZRW-QHCPKHFHSA-N 396.531 5.181 30 20 GKED C#CCCc1noc(C(C)(C)c2csc(-c3c(Cl)cccc3Cl)n2)n1 809397142 XYMOSPIBTAJXRR-UHFFFAOYSA-N 392.311 5.392 30 20 GKED C#C[C@@H](NC(=O)Nc1cccc(COCc2ccco2)c1)c1ccc(Cl)cc1 810163972 PFGBLOKRTAZZQR-OAQYLSRUSA-N 394.858 5.146 30 20 GKED Cc1cc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc(NC(=O)OC(C)(C)C)c1 834897201 YQDOMGFAWQJXCE-KRWDZBQOSA-N 395.503 5.095 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1ccc(N2CCCOC2=O)cc1 836599509 LVFBMSKEUVBZHN-QGZVFWFLSA-N 393.487 5.035 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(-c3ccc(F)cn3)no2)c1 904937347 XKHGCXRLNIPTJH-UHFFFAOYSA-N 392.777 5.255 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086571 LITIYEKKUDLPRH-HSZRJFAPSA-N 395.437 5.590 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1nc(C)sc1C 916312479 ZHJIBNAJXCDEOP-UHFFFAOYSA-N 379.514 5.268 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCOc3ccccc3C)n2)cc1 916974173 FUQLGFGIHPAIEP-LJQANCHMSA-N 390.508 5.462 30 20 GKED CCCCCCCCCN(C)C(=O)C(=O)Nc1ccc(Cl)c2ncccc12 918476110 BNGRZLQNAMOEQD-UHFFFAOYSA-N 389.927 5.036 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3scnc3Cl)c2C#N)C1 920081065 XRRAFDHMHKNVRQ-SECBINFHSA-N 379.938 5.133 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccc4ccccc4c3)n2)cc1 920141678 GXTCESAFAJHJJF-OAQYLSRUSA-N 398.487 5.391 30 20 GKED CC(CCCCCCC(=O)O)=NNC(=S)Nc1ccc(Cl)c(Cl)c1 1776016396 FCUAFJGHETUSEM-UHFFFAOYSA-N 390.336 5.081 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776144348 XZSUXPYSYZIIFR-WAPJZHGLSA-N 382.799 5.158 30 20 GKED C=CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCCCCC(C)(C)C)CC1 1831860922 IMYANNLXPVCPOE-NRFANRHFSA-N 390.612 5.179 30 20 GKED CCN/C(S)=C(/C(=O)c1cc2ccccc2o1)[n+]1ccc(C(CC)CC)cc1 27057327 LAOUPVJGMCFZCV-UHFFFAOYSA-O 395.548 5.172 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 41534252 GZZBQAMPEIJHOP-IBGZPJMESA-N 388.492 5.266 30 20 GKED Cc1oc(C)c(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1C 41548586 BWULSSHXVGTERY-LBPRGKRZSA-N 378.375 5.323 30 20 GKED N#C[C@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1nc2ccccc2[nH]1 48813741 VRZIIWFAGSWALE-LJQANCHMSA-N 383.476 5.345 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2cccc(C)c2C)c1 55011732 PBRSAIYMZLYXTR-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)CCc1ccc(Cl)cc1 172226334 ZBZLGZHADRGJOA-HNNXBMFYSA-N 387.936 5.441 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](SC)c3ccccc3)n2)cc1 172546318 QHZAJMLBYJGUOA-FXAWDEMLSA-N 394.521 5.099 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 174001681 LGYAUKTWGSSFCR-HIFRSBDPSA-N 385.389 5.016 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1cc(C(F)(F)F)ccc1F 176845449 JDDSHZFVBNTECP-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 177089972 RDIJVNPTVOXWKC-AWEZNQCLSA-N 398.488 5.046 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc(N)c2c(C)c(C)sc2n1)c1ccc(F)c(F)c1 187795524 DEMJWYRDWJDZJW-DIFFPNOSSA-N 388.487 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CN(CC1CC1)C(=O)OC(C)(C)C 188073502 PHABDNHPUDFBRK-UHFFFAOYSA-N 386.536 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1 191516732 BIJAHIZIJKYDPU-KRWDZBQOSA-N 389.499 6.076 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Cl)cc2Br)cc1 318059723 AEIUCXDHFKBMPY-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CC1 433858210 IEPCWBSTVHDCRJ-UHFFFAOYSA-N 388.298 5.818 30 20 GKED C=CCC[C@@H](NC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1 435112430 XFRDCSIFPIVBHQ-JOCHJYFZSA-N 386.499 5.069 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccncc2)n1C1CCCCC1 436197212 JXMSGFZLBWVXHP-UHFFFAOYSA-N 383.565 5.657 30 20 GKED N#C[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccccc1F 442750432 ITEDVFNMOJDLPM-MRXNPFEDSA-N 388.229 5.122 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 445007958 PBKLRMBSHXJGJF-KRWDZBQOSA-N 394.478 5.898 30 20 GKED Cc1c(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)cccc1-c1ccccn1 460468854 JFDBVDSSEPIQBC-UHFFFAOYSA-N 399.538 5.382 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCc1ccc(Cl)c(Cl)c1 464943309 LQPYVNVQGKPVKM-YLJYHZDGSA-N 387.310 5.224 30 20 GKED C=CCCCC(=O)N[C@@H](C)c1sc(-c2ccccc2Br)nc1C 466914487 ULDSCZXWGGNSEF-LBPRGKRZSA-N 393.350 5.415 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 474191955 JNCIPFQLIRTTOB-IBGZPJMESA-N 389.524 5.090 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1COCc1ccccc1)c1ccccc1 474902890 PWYXIQFVFHVXOB-QFIPXVFZSA-N 384.479 5.429 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC(=O)Nc1ccccc1CC 475546337 DOAKDKLYNQIICY-UHFFFAOYSA-N 393.531 5.203 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@@H]1c1ccc(OC)cc1)c1ccc(F)c(F)c1 477730495 XAIYJCQIFPIVKN-RTWAWAEBSA-N 386.442 5.137 30 20 GKED CCC[C@H](C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1)c1ccccc1 481805729 KAXVQDZCMQDIMW-KRWDZBQOSA-N 376.378 5.022 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Sc1nc(C(F)(F)F)ccc1C#N 488804193 UONMZPQYKFKEEN-LBPRGKRZSA-N 393.434 5.215 30 20 GKED Cc1ccnc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c(C)c12 489852272 JHQISXCITBGNIL-GFCCVEGCSA-N 396.422 5.148 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 494800822 PGKDDWLKXQOIQI-ZWNOBZJWSA-N 388.327 5.240 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4cc(C)ccc4n3)n2)cc1 497364408 OJIMZNCGTVNOBV-SFHVURJKSA-N 399.475 5.165 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1c(C)cc(C)cc1C 499063943 FTRFYRQQFGUZKO-MRXNPFEDSA-N 376.953 5.342 30 20 GKED N#C[C@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccc(Cl)cc1 499810349 AIGQXGXFLUHTLT-NRFANRHFSA-N 390.870 5.157 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1OC(C)(C)C 500037594 JVQRSIXQRSAOGI-UHFFFAOYSA-N 383.467 5.317 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](Cc2ccccc2)c2ccccc2)cc1 503789699 HLSSBNXECAEVNP-QHCPKHFHSA-N 383.495 5.593 30 20 GKED C[C@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(C#N)cc1 504887003 GTBQRANNSOCIFG-KRWDZBQOSA-N 377.447 5.264 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 505122511 HYLCTOGBXGSAGF-UHFFFAOYSA-N 385.467 5.286 30 20 GKED Cc1ccc(-c2csc(CNc3ccccc3Oc3ncccc3C#N)n2)cc1 506306654 ATQHUCINYCSDOD-UHFFFAOYSA-N 398.491 5.790 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)Cc1c(F)cccc1C#N 510829258 URYADWVCYBLMNJ-QGZVFWFLSA-N 388.442 5.327 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)c1 517858605 AQMAAYIFUBKXBQ-UHFFFAOYSA-N 398.462 5.034 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccccc1SC[C@H](C)C#N 518659606 XKGWFEFZMATCBM-SJORKVTESA-N 396.556 5.642 30 20 GKED Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 520323713 SOKUZBHHINXHOA-UHFFFAOYSA-N 387.395 5.014 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3coc(-c4ccccc4)n3)c2)cc1 520533169 CVTAUZHSVWLJLD-UHFFFAOYSA-N 395.418 5.187 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3cc4ccccc4o3)cc2)cc1 521951300 YNEDIGNBOYISLJ-UHFFFAOYSA-N 382.419 5.221 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2Cl)sc2c1CCC2 521955730 VXJQJNZPOFOYQQ-NWDGAFQWSA-N 377.296 5.157 30 20 GKED C=CCn1c(S[C@H](CC)c2ccc(F)cc2F)nnc1-c1ccoc1C 523111101 ZULKNZCYZXDIHT-QGZVFWFLSA-N 375.444 5.554 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2nc(C(C)(C)C)ncc2C1 529080354 KNMCQANCERAQHT-UHFFFAOYSA-N 392.547 5.216 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1ncc(-c2cccc(F)c2)[nH]1 530405655 FKEMCEMERGCLRL-NRFANRHFSA-N 399.510 5.032 30 20 GKED C=CCC[C@H](NCc1cnn(-c2ccc(Br)cc2)c1)c1ccco1 552277509 WNEZQPWZYREHBC-SFHVURJKSA-N 386.293 5.025 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OCC)c(Cl)c1 554396951 RAYIAIGJCRTBTE-UHFFFAOYSA-N 390.915 5.126 30 20 GKED N#CCc1ccccc1NC(=O)Cc1cccc(OCc2cccc(Cl)c2)c1 564160679 KWUXGJBJCZIIMD-UHFFFAOYSA-N 390.870 5.166 30 20 GKED COc1ccccc1C1(c2noc(-c3cn(CCCC#N)c4ccccc34)n2)CC1 571067401 QSJTXHSVFZXAGV-UHFFFAOYSA-N 398.466 5.084 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(C#N)c(Br)c1 572641728 TXMJRSUWHRKVOG-UHFFFAOYSA-N 375.291 5.074 30 20 GKED C=CCC[C@H](Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)c1ccco1 574421643 NKTFSUYWAXMPRB-INIZCTEOSA-N 378.394 5.241 30 20 GKED N#CCCC[C@@H](NCc1cc(Br)ccc1Cl)c1ccccc1 575450042 MCUNMWQTXDVCKY-GOSISDBHSA-N 377.713 5.627 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2cccnc2C(F)(F)F)cc1 583778141 DVNAVZPZWRGDGA-UHFFFAOYSA-N 399.397 5.376 30 20 GKED CC(C)c1nc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cs1 588349099 VIOSXZJOCIHTFG-JTQLQIEISA-N 389.452 5.158 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)CSc1ccccc1 593157136 GFNLQNDZWYMZGI-IAGOWNOFSA-N 399.585 5.725 30 20 GKED CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)CCCCC#N)ccc1Cl 593965799 ITBUEFFCUZVBPP-UHFFFAOYSA-N 397.906 5.025 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccccc2Oc2cccc(Br)c2)C1 597912462 DKAZXCXMZZCDFB-HNNXBMFYSA-N 399.288 5.007 30 20 GKED N#CCCC[C@H](NCc1ccc(Br)c(F)c1F)c1ccccc1 598980728 PRLDCVBPHARJNX-INIZCTEOSA-N 379.248 5.252 30 20 GKED Cc1ccnc2sc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c(C)c12 603564567 OUQJBNQNYMSLEA-JTQLQIEISA-N 381.526 5.223 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3ccccc3Cl)cc2F)c1 609105518 AFXLXYBCUCCQHO-UHFFFAOYSA-N 394.833 5.111 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CCCc2ccccc21 609399236 JDHUIJMCCMLQPW-UZLBHIALSA-N 379.529 5.480 30 20 GKED C[C@@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1cccc(C#N)c1 610360674 CIBSQIHKQKRQJG-SNVBAGLBSA-N 375.280 5.571 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ncsc3-c3ccccc3)cn2)c1 614971230 GMOCCLAWEHXXPM-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC(C)c1ccc([C@H](NC(=O)CNc2ccc(C#N)cc2)c2cccs2)cc1 619724261 JSDLTLKKTPQHGF-QHCPKHFHSA-N 389.524 5.061 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1F 678944756 FHXGXUAVTJHJFJ-ZNSHCXBVSA-N 375.303 5.525 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 684227564 BDRFZNOQGMQMDH-KWQFWETISA-N 390.274 5.145 30 20 GKED COc1cccc(NN=Cc2sc(Nc3ccccc3OC)nc2Cl)c1 725854721 CJLLQTBEXIJYPQ-UHFFFAOYSA-N 388.880 5.003 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCc1ccc(Cl)c(Cl)c1 726317704 CJMPZDMIDYYPSN-HNNXBMFYSA-N 399.277 5.308 30 20 GKED N#CCCCOc1cccc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)c1 726743496 JWQYFENIYNVPOB-UYRXBGFRSA-N 399.277 6.414 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)Cn1ccc(-c2ccc(C#N)cc2)n1 728152444 LPZYSDYTILHXFL-UHFFFAOYSA-N 386.499 5.307 30 20 GKED N#Cc1ccsc1NC(=O)c1sc2cc(Br)ccc2c1Cl 729823239 JTPJWFABDXSXAX-UHFFFAOYSA-N 397.706 5.503 30 20 GKED N#C[C@H](C(=O)CCCOc1ccccc1Cl)c1nc2cc(F)ccc2s1 730417493 NVXMSHZBPKQYOV-CYBMUJFWSA-N 388.851 5.124 30 20 GKED N#C[C@H](NC(=O)c1ccc2c(c1)-c1ccccc1C2)c1cccc(C(F)(F)F)c1 731646184 ZESRACXLNPITCH-NRFANRHFSA-N 392.380 5.271 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739598230 FOPFPMZERQMAFD-INIZCTEOSA-N 390.508 5.105 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1ccccc1OCc1ccccc1)c1cccc(C#N)c1 745727408 GYDCMHCQFZYFOR-RTBURBONSA-N 399.494 5.259 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 746659629 MOYMFHILKFSSTR-HXOBKFHXSA-N 385.467 5.233 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(OC)cc1 752476390 POZSNPMXRLVEJL-UZLBHIALSA-N 390.508 5.579 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cc(O)cc(O)c1 753716244 CJAKZSSKRULSAD-WAYWQWQTSA-N 391.370 5.136 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C 753898325 MOPYLQLXZWJHPU-UHFFFAOYSA-N 387.524 5.194 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(Cl)c(Cl)c2O)cc(OC)c1OC 756686347 IUHFNOALGITFTJ-GFCCVEGCSA-N 396.314 5.296 30 20 GKED CCc1ccc(C=Nn2c(C)nc3scc(-c4ccc(Cl)cc4)c3c2=O)o1 760227645 ZMQWGENRPKDILS-UHFFFAOYSA-N 397.887 5.124 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 774304550 OBEGHVGSHZBCCS-KRWDZBQOSA-N 393.531 5.686 30 20 GKED N#C[C@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)C1CCCCC1 776395202 CTTNTCGHIOKIMD-AWEZNQCLSA-N 376.428 5.377 30 20 GKED CC(C)(C#N)CCOC(=O)c1ccc(SCCC(C)(C)C#N)cc1Cl 776398444 YFHSLQCQYOZPPJ-UHFFFAOYSA-N 378.925 5.469 30 20 GKED C[C@@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(C#N)c(F)c1 777657214 CIZFRHWQHWXANY-CQSZACIVSA-N 381.838 5.498 30 20 GKED C=CCCN(OCc1ccccc1)c1nc(-c2ccncc2)nc2ccccc12 782441912 ALECGFYFCFEJID-UHFFFAOYSA-N 382.467 5.206 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](O)c1cc(F)cc(Cl)c1 785992167 IJFKUXHPQTWOAW-LJQANCHMSA-N 390.886 5.186 30 20 GKED Cc1cc2cc(C(=O)/C=C/c3cn(CCC#N)nc3-c3ccncc3)oc2cc1C 788355719 PHGNRGTZFDXHQT-SNAWJCMRSA-N 396.450 5.118 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(OC(C)C)c(OC)c1 789451038 SJBSOWOCOULAKT-UHFFFAOYSA-N 396.531 5.656 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1nc(C)sc1C 794980495 CASBVYZUVZFSOL-UHFFFAOYSA-N 391.422 5.072 30 20 GKED CC1(C)CC[C@H](NCc2ccc(OCC#N)cc2)c2cc(Br)ccc21 795799342 BKQHYZLTJFNZNQ-FQEVSTJZSA-N 399.332 5.254 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc1Cl 797567979 NBPJRIASCAFUPI-GXTWGEPZSA-N 376.909 5.046 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2cccc(C3SCCS3)c2)cc1 806175105 UWPFJTSSPFVVLJ-UHFFFAOYSA-N 386.542 5.052 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 808348211 YHULYPDCILLLBU-UHFFFAOYSA-N 382.504 5.567 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2c[nH]c3ccc(Br)cc23)cc1 811699315 ZPMNVXPGHOMVJE-QGQQYVBWSA-N 395.256 5.117 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)c2ccc(C3SCCS3)cc2)cc1 813377303 JIWBUPQQYZUVGO-LJQANCHMSA-N 382.554 5.064 30 20 GKED N#CCCC[C@H](NC(=S)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 814210847 VCQGJAFYKBLYHB-KRWDZBQOSA-N 378.328 5.715 30 20 GKED O=C(c1cc2ccccc2cc1F)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 883978730 UBJKECVLIBTXTL-CHWSQXEVSA-N 393.302 5.182 30 20 GKED CC(C)c1noc([C@@H](C)OC(=O)c2ccccc2Sc2ccccc2C#N)n1 914886084 LSAZULAEOWAPOE-CQSZACIVSA-N 393.468 5.134 30 20 GKED COc1ccc(Cl)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915088443 RYBZJLWVUWBUQH-HXUWFJFHSA-N 376.843 5.256 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc3cccnc23)cc1 915200089 UQRHGWMWPLLYDA-HSZRJFAPSA-N 377.447 5.071 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915350425 VMLIXUOOWPRHNS-DEOSSOPVSA-N 381.479 5.562 30 20 GKED N#Cc1cccc(COc2cccc(N=Cc3cc4ccccc4nc3O)c2)c1 915980394 QHUBCRCGBSYRST-UHFFFAOYSA-N 379.419 5.142 30 20 GKED C=CCOc1ccccc1/C=C1/SC(=S)N([C@H](C)c2ccccc2)C1=O 917643617 HMNGBOOONJBIEP-WBFOAEISSA-N 381.522 5.214 30 20 GKED CCOC(=O)Nc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 917714114 VWVNTPDICPYNFJ-UHFFFAOYSA-N 391.452 5.107 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CSc1ccc2ccccc2c1 920106624 UXTKKFMDWBXHKR-HXUWFJFHSA-N 398.487 5.313 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cc(F)ccc3F)n2)cc1 920109147 DOZYRNCRQYDMDG-KRWDZBQOSA-N 382.435 5.206 30 20 GKED CC(=O)Nc1ccc(/C=C2\CCOc3c(ccc(Cl)c3Cl)C2=O)cc1 921138363 HCKHGNULVCHGIE-JLHYYAGUSA-N 376.239 5.001 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccccc1Oc1cccc(Cl)c1 1776085673 DQRXHUABBNMBLG-UHFFFAOYSA-N 394.858 5.596 30 20 GKED Cc1cc(C)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1C 1776132712 CKZNIFHSFFYISL-CSKARUKUSA-N 376.477 5.935 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1\CCc2ncc(C(=O)O)cc2C1=O 1776365030 KMPRNGJFBHWMHH-XYOKQWHBSA-N 387.888 5.146 30 20 GKED CCCCCCCOc1ccc(/C=C/c2nc3c(C(=O)O)cccc3o2)cc1 1776788044 OUYVLWPBXNPEIB-NTCAYCPXSA-N 379.456 6.046 30 20 GKED COc1cc(C)ccc1Oc1ccccc1/C=C\C(=O)c1ccc(C(=O)O)s1 1777281641 LUMOXQPRUPIXRF-HJWRWDBZSA-N 394.448 5.452 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3C3CC3)cc2)CCC1 1786054791 KDMHDPJCQYMOOI-RTWAWAEBSA-N 394.559 5.159 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(C)o3)CCC2)cc1 1789449045 KCRIWAZKMIZGKF-FQEVSTJZSA-N 392.499 5.104 30 20 GKED CSc1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 24033977 LFCPXRVTPZOEEJ-INIZCTEOSA-N 388.492 5.353 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2CN(C)C2CCCCC2)cc1 29880254 KGKSVAMDOXOJIM-UHFFFAOYSA-N 378.516 5.268 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(Cl)cc1F 46667839 SUGGXJPQJRURGP-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c1 56772170 YIUTZYACXQXCFN-GOSISDBHSA-N 379.485 5.230 30 20 GKED C=CCN(C(=O)c1ccoc1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 57791805 UTHPUUIZFUJSEI-UHFFFAOYSA-N 386.476 5.903 30 20 GKED N#Cc1ccc(NCc2cn(-c3ccccc3)nc2-c2ccncc2)cc1Cl 78879306 AXRXFXVSMRAEBJ-UHFFFAOYSA-N 385.858 5.071 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Sc1nc2c(cc1C#N)CCCC2 96995100 KLFQLGUNGDOQRV-OAHLLOKOSA-N 379.529 5.075 30 20 GKED CCN(CCC(=O)Nc1c(Cl)cccc1Cl)[C@@H](C)c1ccc(C#N)cc1 103468808 CQTBKBNADVAHQK-AWEZNQCLSA-N 390.314 5.277 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 105402609 PERDJXBKHKAYOX-GOSISDBHSA-N 385.467 5.407 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108533387 GXBZDBIGRLLQKK-HZPDHXFCSA-N 383.517 5.172 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cccc1-c1ccccn1 118979871 VRRDNCCJQSIROM-INIZCTEOSA-N 387.508 5.704 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc(Cl)n1 123872113 CNZKJEAJCULGLA-CQSZACIVSA-N 388.279 5.310 30 20 GKED N#CCCCOc1cccc(NCc2nc(-c3c(F)cccc3F)cs2)c1 127412578 LIJVJPKYVHVLLC-UHFFFAOYSA-N 385.439 5.383 30 20 GKED N#CCOc1ccccc1C(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)o1 129445426 RVZBASZJPDZXIK-UHFFFAOYSA-N 395.418 5.163 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)cc1C(F)(F)F 129561600 YPKLGLRARGKWOZ-CQSZACIVSA-N 397.265 5.407 30 20 GKED C[C@@H](Nc1ncccc1C#N)c1nc(-c2ccc(Br)cc2)cs1 155355074 WZVARXJPIKDXCY-LLVKDONJSA-N 385.290 5.012 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2CCSCC2)cc1Cl 195450893 AVERQENTBJBYBG-SFHVURJKSA-N 385.920 5.013 30 20 GKED CCc1cccc(CC)c1-n1c(SCCCCC#N)nnc1-c1cccnc1 195548976 SHKMEEVIVOOANW-UHFFFAOYSA-N 391.544 5.240 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2C)C(C)(C)C)cc1OCCCC#N 237145895 NECQVAMDJGQSGF-QHCPKHFHSA-N 380.532 5.563 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(OC(F)F)cc1 302968389 HOQUYOHSUTWUEN-UHFFFAOYSA-N 394.377 5.513 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 303170248 IORKVPSGHKBSHH-QGZVFWFLSA-N 386.451 5.491 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cccc(OCc2csc(C)n2)c1 303483969 UKGQVOUDAIJSRP-UHFFFAOYSA-N 384.545 5.239 30 20 GKED Cc1nc(-c2ccc([C@@H](C)/N=C(/O)C3C[C@@H]4CCC[C@H](C3)C4=O)cc2)cs1 329104573 CRIYFWAHGNCSKT-UQIORVJUSA-N 382.529 5.531 30 20 GKED O/C(CC1(Cc2nc3ccccc3s2)CCCCC1)=N/[C@@H]1CCCOCC1 329456151 MVGQQDJUDPBYOX-QGZVFWFLSA-N 386.561 5.705 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O 331983508 VVUUKGGNOPRDIX-XYEHWOGUSA-N 384.564 5.332 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ncccc2F)CC1 365670959 JHEPSVGAENURGT-UHFFFAOYSA-N 397.494 5.148 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1oc(C(C)C)nc1C 428213227 ZNUHCMVDJBWZFP-UHFFFAOYSA-N 375.428 5.331 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cc(Cl)ccc1Cl 430263390 VJNHGPWGCDHBIV-CYBMUJFWSA-N 388.298 5.300 30 20 GKED CC(C)N(Cc1ccc(-c2ccccc2F)s1)C(=O)NCC1(CC#N)CC1 431192784 NMEGSSORHXXRKP-UHFFFAOYSA-N 385.508 5.168 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H](c1ccccc1)C1CC1 433135120 MTOUKDZCDMPNAB-VQIMIIECSA-N 379.529 5.254 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 437915209 FCSLMOXOPBXOKR-UHFFFAOYSA-N 398.510 5.604 30 20 GKED C[C@H]1CCN(C(=O)NCC2CCC(C#N)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 440999761 CNWDPWMYYKAUKW-YHRBYZFPSA-N 393.453 5.128 30 20 GKED N#C[C@H](C(=O)c1ccccc1Sc1ccccc1)c1nc2ccccc2s1 442619924 RELJKHVPRXDIOT-QGZVFWFLSA-N 386.501 5.938 30 20 GKED C=CCOCCCC(=O)N(Cc1ccccc1)c1nc2c(C)c(C)ccc2s1 443800221 JPEGSEWCMMQNKY-UHFFFAOYSA-N 394.540 5.429 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458826658 CWTFJPPSFKYZBT-LEWJYISDSA-N 379.504 5.223 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1)c1ccccc1 458842358 PHBVKXWDBUTOKN-ROUUACIJSA-N 393.453 5.186 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cc(C)c(C#N)cn2)c(C(F)(F)F)c1 460070641 CYSKSRIQEFEIRD-LBPRGKRZSA-N 393.434 5.423 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1 462163414 VXVLTOSXZYKRLE-HNNXBMFYSA-N 389.421 5.258 30 20 GKED Cc1ccc2sc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)cc2c1 463396340 CJSDYCIDNSDABP-UHFFFAOYSA-N 399.475 5.829 30 20 GKED C=CCn1c(SC[C@H]2CCC3(CCCCC3)O2)nnc1-c1ccccc1OC 466423054 PUSDBPDWAGREEX-QGZVFWFLSA-N 399.560 5.114 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC[C@H](CC(C)C)C2)cc1 467608719 QACIJOXGEWVBDT-GOSISDBHSA-N 393.487 5.259 30 20 GKED CCc1cccc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 468645583 QDEXBSOACBYPFL-MRXNPFEDSA-N 384.570 5.373 30 20 GKED Cc1sccc1CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 468798999 CJNRJGKTJGAENR-UHFFFAOYSA-N 384.448 5.262 30 20 GKED CSC1(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CCC1 469099276 USCFHXXUQGWLRZ-UHFFFAOYSA-N 386.904 5.015 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1 474419686 CDPDXCOLJLVCQB-UHFFFAOYSA-N 398.466 5.384 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1)c1ccccc1 475469432 IWIXUYGAAXKTOZ-KNQAVFIVSA-N 383.495 5.886 30 20 GKED C[C@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccc(C#N)c(F)c1 480659506 MSFMWGPESRGFPP-ZDUSSCGKSA-N 377.444 5.418 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc2ccccc2n1C(F)F)c1ccc(F)c(F)c1 480702924 XENSMQWIWKCOHZ-XIKOKIGWSA-N 377.385 5.678 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)ccc1OCCC(C)C 483193207 HFGXPIGPLMHOLV-FQEVSTJZSA-N 388.467 5.158 30 20 GKED C=CCCC1(C(=O)Nc2cc(C(=O)N(C)c3ccccc3)ccc2Cl)CC1 483613057 DXVBUOCMHNSWKO-UHFFFAOYSA-N 382.891 5.302 30 20 GKED C[C@H]1COC(C)(C)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 486231614 NOTKDZSGWMBVSK-KXBFYZLASA-N 397.906 5.027 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N[C@H](CCCC#N)c1ccccc1 487302459 WBNQOMLEQDFDRU-MRXNPFEDSA-N 381.526 5.345 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3sc(C(C)(C)C)nc3C)n2)cc1 488332044 SRAOPJCQPNVNMC-OAHLLOKOSA-N 395.553 5.671 30 20 GKED COc1ccc2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2c1 496199247 YJNXGWOMMXMTKV-HXUWFJFHSA-N 384.460 5.462 30 20 GKED C=CCOc1ccc(C(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc1OC 498972025 HWWIIXAYCXEYJC-CQSZACIVSA-N 393.405 5.112 30 20 GKED N#CC1(CCCN2CCCN(Cc3ccccc3)c3ccccc32)CCOCC1 499543051 GKBMDPBNWOMNDF-UHFFFAOYSA-N 389.543 5.004 30 20 GKED CC[C@H](C)n1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccccc1 504319772 AWQPCOGYKQNOAJ-PXNSSMCTSA-N 376.529 5.452 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 506662457 MYEQSSWYGBRNCC-UHFFFAOYSA-N 389.455 5.004 30 20 GKED C=CCOc1ccc(CNc2ccc(NC(=O)CC(F)(F)F)cc2)cc1Cl 509977785 QJRJYPZWBOAGAV-UHFFFAOYSA-N 398.812 5.408 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510463975 JKYVHXPLBNAOFK-OAQYLSRUSA-N 385.854 5.428 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](CCC)c2ccccc2)cc1 511745097 YISRQHVHEAVEOK-QFIPXVFZSA-N 376.500 5.023 30 20 GKED CCc1cc(C#N)c(NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)s1 515711559 XRDNLRQJQFAIDQ-UHFFFAOYSA-N 380.469 5.011 30 20 GKED CC(C)c1ccc(CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518256467 XEFOMTRSAHZGMU-KRWDZBQOSA-N 381.545 5.568 30 20 GKED C[C@H](Nc1ccc(C#N)c(Cl)c1)c1cccc(NC(=O)c2ccccc2)c1 518903828 XYMQYGAOARHOOC-HNNXBMFYSA-N 375.859 5.637 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NC3(c4ccccc4F)CC3)cc2)cc1 523016499 QRUVZJLJQZYKJT-UHFFFAOYSA-N 387.414 5.300 30 20 GKED CC(C)C(=O)Nc1ccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 523122725 RSECSDMFDWZNBJ-UHFFFAOYSA-N 398.466 5.149 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 524503544 XFTFVNFJRZNYMM-UHFFFAOYSA-N 396.490 5.008 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccc2ccccc2n1 525661254 VBSQQPLBIPELCA-UHFFFAOYSA-N 379.419 5.175 30 20 GKED N#C[C@H](C(=O)C1(c2cc(F)cc(F)c2)CCCC1)c1nccc2ccccc12 529000192 QZNIUWSTPBQPNH-FQEVSTJZSA-N 376.406 5.201 30 20 GKED C[C@@H](Cc1nc2ccccc2s1)NC(=O)c1ccccc1-c1ccccc1C#N 532059669 QDYHEZGUGBKQPL-INIZCTEOSA-N 397.503 5.196 30 20 GKED N#Cc1ccc(CNCc2ccccc2-c2ccc(CN3CCCC3)cc2)c(F)c1 532588301 QPFDMQVCBKTVED-UHFFFAOYSA-N 399.513 5.250 30 20 GKED Cc1ccc([C@H]2CCCN2CC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 532896224 ISFITGUXKBQMLM-GHTZIAJQSA-N 393.556 5.022 30 20 GKED CC(C)Cn1cc(NC(=O)c2ccccc2-c2ccccc2C#N)c(C(F)F)n1 534941426 JPOUUKIPASOIIK-UHFFFAOYSA-N 394.425 5.268 30 20 GKED N#CCCCCNC(=O)N[C@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 537873831 BNLYARLEGKOHCJ-WMZOPIPTSA-N 381.442 5.115 30 20 GKED CCC[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 538827240 PPUZCARZPZSKGG-KRWDZBQOSA-N 378.497 5.288 30 20 GKED CC[C@H](CC(F)(F)F)N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F 544832011 HNWHKJYUQMJPQL-DTWKUNHWSA-N 377.300 5.271 30 20 GKED Cc1cccn2c(NC(=O)c3cc(C#N)ccc3Cl)c(-c3ccccc3)nc12 558013260 LUQRZPSBTNWZKI-UHFFFAOYSA-N 386.842 5.087 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 570545837 XVUHEDMIPRMHGV-MJGOQNOKSA-N 386.417 5.460 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)Cc3ccc4ccccc4c3)cc2)ccn1 583055766 REHXUYIGKKPUMR-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1noc2nc(C(C)C)cc(C(=O)Nc3sc4c(c3C#N)CCCCC4)c12 590781660 OKKCZVOSKJYOKZ-UHFFFAOYSA-N 394.500 5.109 30 20 GKED Cc1sc(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)nc1-c1ccco1 602094839 GBISAOZWEGCBIB-ZDUSSCGKSA-N 397.525 5.145 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2ccccc2)nc2c1cnn2C(C)C 606814274 IUEUCZBYJKZGNC-UHFFFAOYSA-N 390.531 5.498 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)N(Cc1ccccc1)C(C)(C)C 609384658 FIDPXZNJSNJRBL-GOSISDBHSA-N 395.572 5.178 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 609427942 MFAPTCGLPOLTQO-UHFFFAOYSA-N 393.446 5.152 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@H](CC3CC3)c3ccccc3)cc2)nc1 610236438 WAOKQSRNCBPTFA-JOCHJYFZSA-N 383.451 5.017 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610318114 LONOSYVMGJNUTR-INIZCTEOSA-N 387.439 5.242 30 20 GKED N#C[C@@H](C(=O)c1ncccc1Oc1ccccc1)c1nc2cc(F)ccc2s1 669601547 SWQLRLKBUWYAHC-HNNXBMFYSA-N 389.411 5.113 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccc(F)cc2C)cs1 731320904 BVKKZCXYJDWYMI-POHAHGRESA-N 398.434 5.310 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1 742664496 FBEDSJVJYJEDNC-UHFFFAOYSA-N 398.425 5.006 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)Cc1ccc(OCC#N)cc1 742840614 MOYVRZCYUKPOGZ-LJQANCHMSA-N 384.479 5.018 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 743037719 ULJGUYBXMXKVHM-UHFFFAOYSA-N 393.443 5.307 30 20 GKED CSc1ccc2c(c1)CC/C(=C/c1cccc(NC(=O)C(F)(F)F)c1)C2=O 748148750 XEJXETAKZHXHCQ-ZROIWOOFSA-N 391.414 5.122 30 20 GKED C[C@@H](OC(=O)Cc1cccc(OCC#N)c1)c1ccc(Cl)c(C(F)(F)F)c1 760627439 PSSXPIUNFVBWAO-GFCCVEGCSA-N 397.780 5.108 30 20 GKED N#Cc1ccc([C@H](O)CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 776033431 HESIJKLBLGZILF-RTBURBONSA-N 394.824 5.005 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)[C@H](O)c2ccc(C#N)cc2)cc1 780966270 YLOYADLTFAVBPR-OPAMFIHVSA-N 388.492 5.084 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782707997 BINPISPFLSPPOL-MOPGFXCFSA-N 389.421 5.441 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1 793388743 IHIRVGQRNQBGKL-LJQANCHMSA-N 386.417 5.484 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 795011738 GREKOBNLULDZBR-UHFFFAOYSA-N 378.888 5.391 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC/C(C)=C\c2ccccc2OC(F)F)c1 810145190 VMQIRUYNLDWQPA-JVCXIRSZSA-N 386.442 5.162 30 20 GKED N#Cc1ccc(/C=C2/CCc3ncc(C(F)(F)F)cc3C2=O)c(C(F)(F)F)c1 811693466 JEUQMYCYPVSKBR-SDQBBNPISA-N 396.290 5.203 30 20 GKED N#CCCC[C@@H](N[C@H]1CCCc2cc(SC(F)F)ccc21)c1ccccc1 815635363 BBYPLHXJVWFBTC-RTWAWAEBSA-N 386.511 6.403 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2nsc3ccc(C)cc23)cc1 815909969 MFTOTXBSBCANOM-KSSFIOAISA-N 391.496 5.079 30 20 GKED CC(C)(C)OC(=O)N1CC[C@H](NCC2CCC(C#N)CC2)C[C@@H]1c1ccccc1 824333744 ZUXCVSGDIDIHJI-IJZHQTRZSA-N 397.563 5.047 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@]2(C1)CC2(F)F)c1ccc(-c2cccc(C#N)c2)cc1 845103350 SFFAHMYUHJMETD-ZHRRBRCNSA-N 395.453 5.117 30 20 GKED CC(=NN(Cc1ccccc1)Cc1ccccc1)c1ccc(-n2cccn2)cc1 874090391 OXVTVLOSBVWQGI-UHFFFAOYSA-N 380.495 5.299 30 20 GKED COc1cccc(/C=C\C(=O)c2sccc2Br)c1OC(F)F 915113018 LLVPXYNZXXPFQV-WAYWQWQTSA-N 389.217 5.017 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccc(Cl)s2)cc1 915180559 OVCYWHFHZKEJNJ-QXFGJRORSA-N 378.884 5.709 30 20 GKED Cc1ccccc1OCCN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351610 FRDXEYMWOQGDTN-HSZRJFAPSA-N 399.494 5.193 30 20 GKED CCCCSCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 916996082 FWCJAWVXFGPHAX-ZDUSSCGKSA-N 399.368 5.826 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccncc2)nc2ccccc12 918169818 JPXRRNBKGYUONE-UHFFFAOYSA-N 397.453 5.264 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)oc12 920111197 YQBXVVDEKQZFRO-LJQANCHMSA-N 396.446 5.472 30 20 GKED C[C@H](Sc1cccnc1C#N)c1nc(O)c2c(-c3ccccc3)csc2n1 1651983872 JENPQPOHKCGOMT-LBPRGKRZSA-N 390.493 5.184 30 20 GKED Cc1ccsc1C(Cc1ccccc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033429 FUOVELQCUBAWPO-UHFFFAOYSA-N 384.888 5.467 30 20 GKED CC(=NNc1cccc(Cl)c1Cl)c1cc(C(=O)O)ccc1OC(C)C 1776081002 QUSPGHPYVSMDES-UHFFFAOYSA-N 381.259 5.315 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc([N+](=O)[O-])c(Cl)c3)cc2)cc1 1776108204 IISUAWMVLQKNFZ-UHFFFAOYSA-N 395.802 5.059 30 20 GKED Cc1ccccc1COc1c(C)cc(/C=C\c2nc(C(=O)O)ccc2C#N)cc1C 1777471937 QASLMNBOSYNXMG-NTMALXAHSA-N 398.462 5.326 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(C(C)(C)C#N)cc1 25839554 FHIYBJNGUFSADS-UHFFFAOYSA-N 379.847 5.357 30 20 GKED Cc1sc(NC(=O)c2c(-n3cccc3)sc3c2CCSC3)c(C#N)c1C 105144676 TYGDATAWVSTSSG-UHFFFAOYSA-N 399.566 5.130 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc1OC 107321544 XKCRVHMIRPPCBD-INIZCTEOSA-N 380.513 5.234 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3cccc(C)c3)n2)cc1 124341252 XFKGLLLDSQETEO-KXBFYZLASA-N 376.481 5.107 30 20 GKED N#C[C@H](NC(=O)c1ccccc1SCc1cccs1)c1ccc(Cl)cc1 159387122 WBAKHHVUHQFZFL-SFHVURJKSA-N 398.940 5.688 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccnc1-c1ccc(Cl)s1 189510774 ZNLKWSXQRCDPQY-UHFFFAOYSA-N 386.864 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@H]1c1ccncc1 191503459 OWVDAJLDHQZJDN-QFIPXVFZSA-N 377.532 6.083 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1nc(C2CC2)n(-c2ccccc2Cl)n1 303431758 DWSOEIDDPWWRSK-UHFFFAOYSA-N 398.938 5.007 30 20 GKED Cc1nc(-c2cccc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)c2)oc1C 330034284 WGXVBDXYGSULPK-UHFFFAOYSA-N 381.476 5.472 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1 330080493 JJANLEPNFQZTQY-RTWAWAEBSA-N 391.515 5.074 30 20 GKED COc1ccc(N=C(O)N2CC[C@@H]3CCC[C@@H]32)cc1N=C(O)C1CCCCC1 330245869 KVIBXWFJEKNKSF-KXBFYZLASA-N 385.508 5.283 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 410973705 WPVNJZXEWVDDRP-GJZGRUSLSA-N 394.780 5.047 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c2[C@H]1C 410976496 ATRCNRSSGLGUOY-QWRGUYRKSA-N 375.444 5.065 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cnc(Cc3ccc(F)cc3)s2)s1 430612423 RGBWJXLZCZRSLB-AWEZNQCLSA-N 399.516 5.117 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(F)(c2ccccc2)CC1 432859030 LSPNHAATKHBFQI-KRWDZBQOSA-N 397.519 5.431 30 20 GKED Cc1ccc(-c2noc(CCCN[C@H](CCCC#N)c3ccccc3)n2)cc1F 433014681 SWNCKLAWUZJXHE-OAQYLSRUSA-N 392.478 5.142 30 20 GKED COCCN(C(=O)c1cc(C)c(-c2ccc(F)cc2)s1)c1ccc(C#N)cc1 460344454 BMUCYCOMNHXBNJ-UHFFFAOYSA-N 394.471 5.028 30 20 GKED CCSCC[C@@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 467049346 VHTKHKXPWQVDGP-MRXNPFEDSA-N 383.517 5.312 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 467758162 NGWYJIAYQUXCNC-HNNXBMFYSA-N 385.895 5.203 30 20 GKED N#CCC[C@@H](NC(=O)N1CC=C(c2cccc(Cl)c2)CC1)c1ccccc1 474532731 FEYSCZQPVXECLA-OAQYLSRUSA-N 379.891 5.184 30 20 GKED C[C@H]1CCCCN1Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 474903450 VPUCAEHQBNPYEG-SFHVURJKSA-N 375.516 5.114 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(-c2ccoc2)nn1-c1ccccc1)c1ccccc1 475531257 MIIZFZOXQHTJBV-LJQANCHMSA-N 396.450 5.158 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1c(F)cccc1Cl 477271850 MSCFKQRYWCTYMX-ZDUSSCGKSA-N 395.821 5.029 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)c1ccccc1 488650789 CDIJKGQPBQDHFJ-DEOSSOPVSA-N 398.506 5.191 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(F)c(F)c(F)c1F 499353869 ADIMFCGUBKXPIS-MRVPVSSYSA-N 379.275 5.095 30 20 GKED N#CC1(CCCN[C@H](c2cccc3ccccc23)C(F)(F)F)CCOCC1 499617101 CYCJHZNFCIBPBP-LJQANCHMSA-N 376.422 5.133 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 501814204 RQRUQHLGCAJYDH-GFCCVEGCSA-N 381.259 5.100 30 20 GKED COc1cc(C2(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)CC2)ccc1C 501891807 PUPIHUSEOSKSED-UHFFFAOYSA-N 398.462 5.338 30 20 GKED CCC[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 504258103 NJTVSBBERJUEHV-JPYJTQIMSA-N 383.495 5.381 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cccc(OC)c1)C[C@H]1CCCO1 505030025 RQQCYTATKFOXJY-JOCHJYFZSA-N 394.515 5.027 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2sccc2s1 516487839 WPHLXOYSCYIQAZ-UHFFFAOYSA-N 391.477 5.583 30 20 GKED CN(CCC#N)C(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 517338428 FKDOGDUDQJCRHO-QGZVFWFLSA-N 379.312 5.199 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 517913275 DJWCYCQGUZCYEN-JOCHJYFZSA-N 382.479 5.073 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(F)cc1Br 518262793 DOJJGQNZMLAMLW-LBPRGKRZSA-N 379.298 5.595 30 20 GKED N#CCCCOc1cccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)c1 518775979 OPUQPTAWDSXBET-UHFFFAOYSA-N 392.449 5.527 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)Cc1ccc(C(F)(F)F)cc1 518971704 PFMLUYNZEUQVDS-CQSZACIVSA-N 382.451 5.096 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 520825067 UKGBDARQDHBNNI-LBPRGKRZSA-N 399.566 5.684 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)Cc1ccccc1-2 521729742 GSYDNAYCAYEWEV-MRXNPFEDSA-N 384.504 5.762 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cc(Cl)ccc1Cl 521797144 BKWDRJLHTMGGKL-LLVKDONJSA-N 380.300 6.032 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1cccc(-c2ccccc2OC)c1 522074543 OKSVGRQMEWEGDX-UHFFFAOYSA-N 388.467 5.249 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(N2CCC(C)CC2)c1 525345613 VERUCISNKOCOKF-UHFFFAOYSA-N 390.531 5.239 30 20 GKED Cc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1Cl 533665659 ZPXCRQMDEMWNFD-UHFFFAOYSA-N 398.837 5.925 30 20 GKED CCOCCOCc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 535837336 QRHRAGNAIMSCOP-UHFFFAOYSA-N 378.516 5.056 30 20 GKED C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccc(C#N)cc1 537295338 UWENHFJGHCHIJI-CYBMUJFWSA-N 381.819 5.231 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)c1ccccc1Sc1ccccc1C#N 537996451 YFQGBPVPIKURSI-MRXNPFEDSA-N 387.508 5.158 30 20 GKED CC(C)CC(=O)Nc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 539923252 WVGIDUIERUCWLG-UHFFFAOYSA-N 375.516 5.487 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)CC3CCC(C(F)(F)F)CC3)n2)c1 542149707 NIIDWCUXDGJXDL-UHFFFAOYSA-N 393.434 5.379 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(CCCc4ccsc4)no3)cc2)nc1 545094085 QTQTYKXMLBUZII-UHFFFAOYSA-N 388.452 5.032 30 20 GKED Cc1cc(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)nn1C1CCCCC1 548273751 IUCZRQFGQLUXSE-UHFFFAOYSA-N 394.563 5.021 30 20 GKED C=C(C)[C@H](NCc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccc(F)c(F)c1 555427859 PMPAODWBVQIGIE-KRWDZBQOSA-N 386.320 5.299 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 571434818 MECBOAWLUXAULN-QFIPXVFZSA-N 389.499 5.177 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Oc2cccnc2)cc1 573841590 HHHRLCIBBNEBIB-UHFFFAOYSA-N 391.430 5.665 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1SCC(F)(F)F 591860613 AQQDPDYIJUAMNB-ZDUSSCGKSA-N 393.434 5.438 30 20 GKED C[C@@H](C1CC1)N(C(=O)CCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 603964414 KTCJNHUHDXABRB-HNNXBMFYSA-N 386.417 5.341 30 20 GKED COc1ccc2c(CC(=O)Nc3sc(-c4ccccc4)cc3C#N)coc2c1 603969376 NZZMMJWWNGGYQH-UHFFFAOYSA-N 388.448 5.223 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CC)c1ccc(F)cc1F 606711789 TYESYXFUWARPMR-INIZCTEOSA-N 384.879 5.529 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)c1cccc(Cl)c1 610019203 IGZABIGUXYMTGR-AWEZNQCLSA-N 387.936 5.649 30 20 GKED C[C@@H](NC(=O)N[C@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 610356652 XFOAGGZVAGNXGU-UZUQRXQVSA-N 387.458 5.042 30 20 GKED CCN(CCC(F)(F)F)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611854607 SDQUFDPOQULCHT-OAHLLOKOSA-N 389.421 5.270 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2ccc(-c3ccc(Br)s3)s2)C1 612246478 YWSWSZIBRXONLK-INIZCTEOSA-N 395.347 5.005 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)C2)cc1 612298983 MEMOIAQVRBFZHB-HXUWFJFHSA-N 398.466 5.075 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2COC(C)(C)CC)cc1OC 680404903 OPSMJXOECOXPQQ-UHFFFAOYSA-N 383.488 5.218 30 20 GKED C=CCN(C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2)C(C)C 726080274 ZFIYGDGLDDLWKQ-UHFFFAOYSA-N 384.501 5.037 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 726444445 OVOJRVRXNIDNES-OAQYLSRUSA-N 376.912 5.397 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3sc4ccccc4c3Cl)CC2)c1 729415716 AHAAJGHAXTYNIV-UHFFFAOYSA-N 396.899 5.110 30 20 GKED C[C@@H](NC(=O)NCCSCc1ccccc1C#N)c1csc2ccccc12 730021084 HABSGDPZAYHHCC-OAHLLOKOSA-N 395.553 5.067 30 20 GKED C[C@@H]1CCC[C@@H](OCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 733053251 ZQRUQGOVKILUMF-MRVWCRGKSA-N 396.434 5.087 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccc(F)cc2)C(C)(C)C)c1 733849416 XAEHYNCJMDIDFJ-CTNGQTDRSA-N 397.494 5.093 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)cc1 736223822 GUTWDARAMGQMNI-UHFFFAOYSA-N 394.858 5.152 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1sc2c(c1C#N)CCCCC2)c1cccs1 737401887 HIFDJCUUXTUZPC-QWHCGFSZSA-N 390.599 5.772 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN2[C@H]3CC[C@H]2c2ccccc23)c1=S 739877372 WLCMFWABLVZHRA-SFTDATJTSA-N 388.540 5.425 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 740531249 OFFJUPRGCJLGFF-IUODEOHRSA-N 388.414 5.604 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)cc1 741537820 HTNFNCWIMHXBJV-PCCBWWKXSA-N 388.417 5.362 30 20 GKED N#Cc1cccc(COc2cccc(/C=C/C(=O)c3ccc4c(c3)COC4)c2)c1 742435892 BFYHSNFFXTZROC-JXMROGBWSA-N 381.431 5.064 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 742568799 DVGDQWQGIAELEN-UHFFFAOYSA-N 398.478 5.310 30 20 GKED C[C@@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccs1 743037060 QOTPSIQUUQTVPA-CYBMUJFWSA-N 397.500 5.599 30 20 GKED C[C@@H](Nc1ccc(OC2CCCCC2)cc1)C(=O)N(CCC#N)c1ccccc1 743477983 WOIBSPYMMKUAPJ-LJQANCHMSA-N 391.515 5.145 30 20 GKED COc1cc(/C=C\C(=O)c2cnn(C(C)C)c2)ccc1OCc1ccc(F)cc1 746687229 TWPKDLGFRNGNKO-POHAHGRESA-N 394.446 5.087 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1ccc(Oc2ccccc2Cl)cc1 747108740 QXUPXQCLDLVTSE-SFHVURJKSA-N 390.826 5.093 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 747805952 JCNGLTFTERXBHQ-CQSZACIVSA-N 391.323 5.405 30 20 GKED CCO[C@@H]1C[C@H](N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1(C)C 748943003 RFPDWEFMKMEMJZ-FDFHNCONSA-N 391.515 5.009 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCc3ccccc3C2)cc1 749423097 PLHUCWCHZYDFFR-RPWUZVMVSA-N 381.479 5.021 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1SC(F)F 752620089 DLOBBJSAXQMJHU-RDJZCZTQSA-N 387.455 5.305 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 757854245 GKQCLQRZMODMTI-FGZHOGPDSA-N 377.488 5.252 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2cnc(Cl)s2)cc1OCC 760348584 LVRPCYHPZIGKIH-UHFFFAOYSA-N 389.304 5.188 30 20 GKED CSc1ccc2cc(CON=C(C)Cn3nc(C)cc3C)c(Cl)nc2c1 760435272 XJXXCBBGWVJVNL-UHFFFAOYSA-N 388.924 5.016 30 20 GKED Cc1nc(CSc2ccc(C(=O)OCCCCC(C)(C)C#N)cc2)cs1 768544432 RSVWUZVVNQEBSE-UHFFFAOYSA-N 388.558 5.621 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2ccc(C#N)c(C#N)c2)cc1 772141178 HEMQTMIKIZSRSM-UHFFFAOYSA-N 394.438 5.164 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCC[C@H]1CCCc1ccccc1 774057155 HVSUFULVTFTJHE-FQEVSTJZSA-N 395.478 5.137 30 20 GKED CCn1nc(C)c(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1C 779595855 PCUPGQKUIOOZRS-UHFFFAOYSA-N 394.906 5.236 30 20 GKED N#CCOc1cc(F)ccc1NCc1cccc(OCc2ccccc2F)c1 779609254 MSPCXZDUCJCBPY-UHFFFAOYSA-N 380.394 5.058 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)c2ccccc21 786314393 UNHIGJDQYJCPOT-SNRMKQJTSA-N 394.902 5.305 30 20 GKED N#Cc1cccc(COc2ccc(NC3CCC4(CCCO4)CC3)cc2F)c1 788264222 GKGWPSREQIEPGV-UHFFFAOYSA-N 380.463 5.180 30 20 GKED Cc1nc(Cl)ccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 790245919 ASUIRLWPAJQWKH-UHFFFAOYSA-N 377.831 5.154 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792092491 BZFYEKZCOHXIFJ-LIRRHRJNSA-N 382.385 5.309 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1Br 798859382 CWJIXISFYPOYBI-INIZCTEOSA-N 393.284 5.151 30 20 GKED C#CC[C@@H](NC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 800593519 LJOCHXUCONNVOH-MRXNPFEDSA-N 394.368 5.043 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)c2c1 805856512 XCZPHMNYDCRBTO-FQEVSTJZSA-N 396.446 5.671 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1Br 815900036 MHCWCJADVIORPS-LBPRGKRZSA-N 385.286 5.111 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NCc1ccc(C#N)s1 816663958 PRCTZFFWRFIYPC-UHFFFAOYSA-N 397.422 5.598 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 821445198 ZCFVRYRMOUXIHR-UHFFFAOYSA-N 386.517 5.090 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1CCC[C@H](c2ccc(Cl)cc2)C1 837099544 GPUJHSFPAXJRPQ-WMZOPIPTSA-N 384.932 5.412 30 20 GKED N#CCCCC[C@@H](N)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 848397760 KZTGASQPKOPEAW-GOSISDBHSA-N 376.287 5.010 30 20 GKED O=C(/C=C\c1ccc(N2CCOCC2)cc1)c1cc2c(ccc3ccccc32)o1 916131722 LWBCYNUTKWZHNH-XFFZJAGNSA-N 383.447 5.319 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917026587 IJBTWZVTMUYRGB-QFBILLFUSA-N 390.508 5.579 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 919936237 HUCALDABPKHAGJ-CLNPQZTCSA-N 378.884 5.192 30 20 GKED C#CCC1(NCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)CCCCC1 933267381 HALYGBPJZAMCOD-UHFFFAOYSA-N 395.572 5.260 30 20 GKED C/C=C/COc1ccc(CCC(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033299 AONYKCYDKNMPFS-SCGVHHCSSA-N 386.879 5.414 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(SC(F)(F)F)c1 1776034104 OAZYOUSUDJCKIN-UHFFFAOYSA-N 388.798 5.486 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)cc1CC(=O)O 1776131885 SXTCTNDRNXCUGT-VQHVLOKHSA-N 396.439 5.086 30 20 GKED CCCCOc1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)cc1OCC 1776801318 KANHZRDVEITFFH-NXNYUAIASA-N 394.467 5.102 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1Cl 15711312 WFKZOYWROYLVJA-OAHLLOKOSA-N 392.842 5.410 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(Br)c1 37499213 RILWBWGFLJCXEX-UHFFFAOYSA-N 376.728 5.054 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2OCc2ccccc2Cl)n1 41519960 QTPSXSHNMRKCLH-MRXNPFEDSA-N 382.872 5.174 30 20 GKED COc1ccc(C(=O)/C=C/c2csc(N(C(C)=O)c3ccc(C)cc3)n2)cc1 54895652 SOXKIHHWBHPWSP-MDWZMJQESA-N 392.480 5.041 30 20 GKED CCC[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 58418095 CKQSRAWOTYNDPD-SFHVURJKSA-N 376.287 5.722 30 20 GKED CC(C)(C)c1ncc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 64328225 XVAHOZLFJMCWAM-UHFFFAOYSA-N 388.496 5.049 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 68917212 VQVSHIUWRFNVRX-UHFFFAOYSA-N 388.471 5.171 30 20 GKED Cc1cccc(-c2nc(CC(=O)Nc3sc4c(c3C#N)CCCC4)cs2)c1 71800580 DBQNXIFSPIRVSZ-UHFFFAOYSA-N 393.537 5.112 30 20 GKED CCCO[C@@H]1CCCN(C(=O)c2ccccc2Sc2ccccc2C#N)CC1 108222834 VWUIXZHDOGHYED-LJQANCHMSA-N 394.540 5.131 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3c(c2)CCCC3)cc1 108376040 VKEIUUGURYNTIN-UHFFFAOYSA-N 396.490 5.463 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)Cc2coc3ccc4ccccc4c23)cc1 111183281 HGEGLFXAWSWWJB-UHFFFAOYSA-N 398.462 5.474 30 20 GKED N#C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)C1CCCCC1 115184402 RUHQIPWXTHMIKG-AWEZNQCLSA-N 378.295 5.064 30 20 GKED N#C[C@H](C(=O)Cc1c[nH]c2ccc(Cl)cc12)c1nc(-c2ccccc2)cs1 124124951 WZCQWBOIEGKNFB-QGZVFWFLSA-N 391.883 5.364 30 20 GKED CSCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 131043811 KAOIJBXYCYIWIP-GFCCVEGCSA-N 385.341 5.436 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 131744084 MFGRAWBFMQSNCG-GFCCVEGCSA-N 395.846 5.351 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 153967227 LWVBRUCREOMMNW-ROUUACIJSA-N 381.545 5.342 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cc(C(C)(C)C)sc1C#N 154258736 FXUWJKBBSFKPNK-UHFFFAOYSA-N 379.485 5.062 30 20 GKED N#CCCCCNC(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 170950390 ICBWVAMTXUHBJS-GOSISDBHSA-N 376.884 5.123 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2ccccc2n1C(F)F 176726662 BKHVBNSKNZNHIA-GFCCVEGCSA-N 397.278 5.079 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ccc(F)nc2)CC1 190934327 ZMWBMTRBUAAPRD-UHFFFAOYSA-N 397.494 5.148 30 20 GKED CC(C)Oc1ccc(-c2nn(-c3ccccc3)cc2CNCCCCC#N)cc1 236819479 HKFUQDSQKVJMGQ-UHFFFAOYSA-N 388.515 5.110 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(-c4ccccc4F)s3)cc12 303171846 WWMUFZHFXAFKDX-BQYQJAHWSA-N 377.444 5.040 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1cccs1 303756693 GPXKLRGABOBRMA-CQSZACIVSA-N 396.899 5.594 30 20 GKED CC(C)c1nc([C@H]2CCCN2C(O)=Nc2ncc(C3CCCCC3)s2)no1 329442411 KGAFBMPAICJUST-CQSZACIVSA-N 389.525 5.080 30 20 GKED CC(C)c1noc([C@H](/N=C(/O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)C2CCOCC2)n1 330285622 ZDYFNUCOLZFUDC-GDAAHCPNSA-N 389.540 5.224 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 429674372 KOQSCSLTCUARNW-CYBMUJFWSA-N 375.325 5.033 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(N[C@H](C(N)=O)c2ccc(C#N)cc2)cc1 437152181 SEVQJYGFKIYCOP-ZHRRBRCNSA-N 387.508 5.050 30 20 GKED Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 438071480 JWNSHHIJHWVJIS-GOSISDBHSA-N 395.572 5.688 30 20 GKED CSc1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 438079706 KOIJNFSFPHZGBD-FUHWJXTLSA-N 385.920 5.366 30 20 GKED C[C@@H]1COCC[C@@H]1c1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 442686188 VBGDUNPCGVTWOQ-ACJLOTCBSA-N 395.846 5.194 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C1CC1 447523235 SVRSJWFAFHSWRR-LJQANCHMSA-N 399.475 5.058 30 20 GKED CC[C@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1 447585467 JCJLWJARDIUUHH-JTHBVZDNSA-N 375.903 5.631 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458806440 WFPXEKJLBQUONL-QHCPKHFHSA-N 388.515 5.161 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(C)[C@@H](C)c1ccc(Cl)cc1Cl 460376182 RWPCSPPYJYPVOB-GUYCJALGSA-N 395.334 5.210 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N(C)Cc2cccc(C#N)c2)cc1 466085463 MSINEJGEUKWJIX-SFHVURJKSA-N 399.494 5.136 30 20 GKED Cc1cc(Cl)c2ccccc2c1NC(=O)c1ccn(-c2cccc(C#N)c2)n1 466330579 IGRQZAUHRRJDIK-UHFFFAOYSA-N 386.842 5.111 30 20 GKED C=CC[C@@H]1N(C(=O)CCc2ncc(-c3ccccc3Cl)o2)CCCC1(C)C 470303672 OVALHIFCWIOKQH-IBGZPJMESA-N 386.923 5.521 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(OCc2cccnc2)c1 471211742 KWXAAPRUNKZYEF-UHFFFAOYSA-N 387.483 5.271 30 20 GKED CCCCN(C(=O)C[C@H](CC#N)c1ccccc1)C1CC(C)(C)NC(C)(C)C1 475664480 ZCILFXWUWVUQCP-FQEVSTJZSA-N 383.580 5.012 30 20 GKED C[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)C(=O)c1ccc(Cl)cc1 487455318 NFEMTOCMFVSXFH-OXJNMPFZSA-N 382.891 5.100 30 20 GKED COc1ccccc1-c1nc(COc2c(C#N)cnc3ccc(C)cc23)cs1 488270098 WVOQSZOXZFEMIW-UHFFFAOYSA-N 387.464 5.126 30 20 GKED N#Cc1ccc(CNc2ccc(Oc3ccc(C(F)(F)F)cn3)c(F)c2)cc1 500391989 GWXRGSHFYPBLSZ-UHFFFAOYSA-N 387.336 5.516 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(-c4ccccc4Cl)o3)CC2)cc1 503959171 AGLLQXVYKDMTQK-UHFFFAOYSA-N 388.854 5.401 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCc3ccccc32)CC1 504420709 YNHPCHNEVXZONQ-GOTSBHOMSA-N 387.527 5.183 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)c1nc(O)c2c(-c3ccco3)csc2n1 509642619 YKJXXGBTLCVGDR-NSHDSACASA-N 379.466 5.382 30 20 GKED Cc1csc(Nc2ccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)cc2)n1 511854833 KBWMRGNCJJTBQR-UHFFFAOYSA-N 394.475 5.122 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 516307047 IVACTIJWLVSECN-DLBZAZTESA-N 389.524 5.750 30 20 GKED C[C@@H](CCc1ccccc1)SCC(=O)Nc1ccccc1S[C@@H](C)CC#N 518655258 HOSMZEIBAVDIPU-ROUUACIJSA-N 398.597 5.774 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Sc2cc(F)ccc2F)c2ccccc2)cc1 519325803 GGGMZEWYRXPBLM-OAQYLSRUSA-N 394.446 5.503 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(F)cc3Cl)cc2)cc1 521093194 WUDSRZSPHFYZJC-UHFFFAOYSA-N 380.806 5.590 30 20 GKED CCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1Cl 521221528 JKASIKNJGZDCDX-UHFFFAOYSA-N 385.895 5.300 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cc(F)ccc2F)c1 522574650 DMLUJKRNBXNUEO-UHFFFAOYSA-N 384.769 5.534 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(CCC#N)CC(C)(C)C 522816178 UTPFWVWLQYGVML-UHFFFAOYSA-N 399.538 5.541 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)N[C@H](C)c1ccc2ccccc2c1 525116294 SZLJGFIVSPOLQT-CABCVRRESA-N 378.472 5.209 30 20 GKED COc1ccccc1-n1c(SCCC(C)(C)C#N)nnc1-c1cccs1 525190608 HZANBSDBWUZTPX-UHFFFAOYSA-N 384.530 5.036 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCOC4(CCCCC4)C3)c2)c1 532269966 MTPBAPQXRIYOAR-QHCPKHFHSA-N 390.527 5.109 30 20 GKED C=CCn1c(SCc2csc(C3CC3)n2)nnc1-c1ccc(Cl)cc1 534606958 YMEIIVRIOFJATA-UHFFFAOYSA-N 388.949 5.411 30 20 GKED Cc1sc(NC(=O)[C@H](C)c2cccc(C(=O)c3ccccc3)c2)c(C#N)c1C 535595550 BWDMWQYDEYBRGO-OAHLLOKOSA-N 388.492 5.210 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 537947524 XRYFIEKCUHYCHF-DNVCBOLYSA-N 378.463 6.037 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CCOC3(CCCCC3)C2)c1 538427005 XCAGYTFOBNGCRG-HSZRJFAPSA-N 390.527 5.109 30 20 GKED N#CCC1CCN(C(=O)c2ccc(Oc3cccc(Br)c3)cc2)CC1 541049377 OOMZGHRFWMUWDG-UHFFFAOYSA-N 399.288 5.007 30 20 GKED CC[C@@H](CSC)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158477 DLVDVSUJWZFOHO-IERDGZPVSA-N 381.545 5.069 30 20 GKED Cc1ccc(NC(=O)CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)c1 543872462 UCXFDIJXURIXLT-IBGZPJMESA-N 383.495 5.131 30 20 GKED C=CCn1c(SCc2ccncc2Cl)nnc1-c1ccc(Cl)cc1 547786382 AJNPLAKRYHRSPQ-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn2ccc(Br)cc2n1 552188965 WCHKJQMQGSFWIU-UHFFFAOYSA-N 398.304 5.201 30 20 GKED Cc1ccc2nc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)ccc2c1 555297017 MGIJRGFNEDTIQI-UHFFFAOYSA-N 394.434 5.163 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(F)cc(F)c3F)cc2)cc1 558240011 BLHUIYADLQCTIS-UHFFFAOYSA-N 382.341 5.215 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1ocnc1-c1ccccc1)c2C#N 562700015 XIMBJNPZGDACEV-OLZOCXBDSA-N 377.469 5.213 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1Cl 574835529 YFIOGUOWLIAPKR-AUSIDOKSSA-N 389.886 5.408 30 20 GKED COc1ccc([C@@H](C)N[C@H](C#N)c2ccc(Cl)cc2)cc1Br 585718985 GPAQPXFMQLTHDG-BDJLRTHQSA-N 379.685 5.027 30 20 GKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 596735557 ZZZAGSBGPDOWFB-OXJNMPFZSA-N 393.556 5.924 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCCC(F)(F)CC2)c1 600254299 OIPCAAWZRVRQKM-UHFFFAOYSA-N 390.817 5.265 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4cc(Cl)ccc4o3)cn2)c1 603623914 PIBHCELCTLVFMX-UHFFFAOYSA-N 389.798 5.397 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc(Br)c1 603968007 GTQSZMTVWRQBCY-UHFFFAOYSA-N 383.270 5.302 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 604487849 DCVDFDVTZGYLMS-HNNXBMFYSA-N 387.405 5.036 30 20 GKED CCOc1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 609298540 VRBZCMPSESUYOK-UHFFFAOYSA-N 376.387 5.141 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 609377081 OIWPNUKTWJORST-ZDUSSCGKSA-N 394.500 5.024 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610319562 SPTUJYXHRDXGHD-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#Cc1cc(CSCc2csc(COc3ccc(Cl)cc3)n2)ccn1 610954226 METZCEPQIUMDMB-UHFFFAOYSA-N 387.917 5.076 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)c(Cl)c1 611505656 LCYXVFAQEFDDNN-INIZCTEOSA-N 389.257 5.370 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4[nH]c(C)c(C)c4c3)n2)cc1 613315380 PNAJWZHMCZCIIS-LJQANCHMSA-N 385.492 5.707 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618804847 MNIFIPXJBZZGKT-ZUOKHONESA-N 377.488 5.467 30 20 GKED Cc1cccc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1F 622485589 RSHCVVXNRKYQEE-AWEZNQCLSA-N 379.275 5.186 30 20 GKED FC(F)(F)C1CCC(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 681007563 QFRFBBJWOZCDMY-KIDURHIOSA-N 399.341 5.854 30 20 GKED C=CCSc1ccccc1C(=O)N(C)C[C@@H]1CCCO[C@H]1c1ccccc1 681623330 KNLXPNMBIZVARJ-UGKGYDQZSA-N 381.541 5.205 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)NCCc1cccs1 727699019 SXBOHPKAJACHJQ-UHFFFAOYSA-N 393.537 5.250 30 20 GKED CCOCc1cc(/C=C\C(=O)c2oc3ccc(OC)cc3c2C)ccc1OC 729150509 KSTDIWGULPHZLF-TWGQIWQCSA-N 380.440 5.191 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(Br)c2)c(Cl)c1OC 730433762 APRFKHGESFIKQV-VURMDHGXSA-N 381.653 5.016 30 20 GKED C=CC[C@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccncc1 734685335 ZMOMZKAMCVXDEB-OALUTQOASA-N 390.314 5.552 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 735172424 ZENSZPBLHUOIMD-NLFFAJNJSA-N 397.522 6.175 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 735366170 MJKLVTJZVPMLCS-HBMCJLEFSA-N 379.529 5.138 30 20 GKED C[C@H](OC(=O)CCC(F)(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 744134896 GVJAHBBCRUNXKU-ZETCQYMHSA-N 382.222 5.671 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2cccc(-c3nnc(C)o3)c2)s1 746153668 RSVYRJTWNGJNRP-UHFFFAOYSA-N 399.520 5.052 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747194380 ZFFRWQRSGULOGZ-MRXNPFEDSA-N 395.553 5.426 30 20 GKED COc1cc(/C=C2/CSc3ccc(F)cc3C2=O)ccc1OCC(F)(F)F 750902595 LNTURACTQRNLKM-SDQBBNPISA-N 398.377 5.147 30 20 GKED Cc1cc(C(=O)O[C@@H](C)c2ccc(C#N)cc2)ccc1NC(=O)c1cccs1 759421448 QLDUNKFEVLSPKO-HNNXBMFYSA-N 390.464 5.099 30 20 GKED CC(Cn1nc(C)cc1C)=NO[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 763180158 PPBSUBSOTCOHPA-MRXNPFEDSA-N 386.883 5.270 30 20 GKED N#Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)c(Cl)c([N+](=O)[O-])c1 764302228 GJIIKGQQBWKTBW-IAGOWNOFSA-N 391.814 5.015 30 20 GKED C=C(C)Cn1c(-c2ccncc2)nn(CN2CC[C@@H](C)c3ccccc32)c1=S 766337594 HOJJDGVFNREMOJ-QGZVFWFLSA-N 391.544 5.023 30 20 GKED CC(C)(C#N)c1ccccc1COc1ccc2c(C(F)(F)F)cc(=O)oc2c1 767824621 LDAXMRZSPMKMSV-UHFFFAOYSA-N 387.357 5.192 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2sc(C3CCCCC3)nc2C)c1 775168718 XHOCCOUEDFHPOJ-GOSISDBHSA-N 397.544 5.110 30 20 GKED Cc1ccc(SCc2cccc(C(=O)OCC3(C#N)CCOCC3)c2)c(C)c1 780547010 DPFWBZJRXAKKMW-UHFFFAOYSA-N 395.524 5.073 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(OC(C)(C)C)cc2)cn1 792889028 CRIZWYJVKRQBHA-ZROIWOOFSA-N 388.467 5.226 30 20 GKED Cc1cnc([C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cn1 793912811 YIRIXSVOKNMQKG-OAHLLOKOSA-N 378.863 5.062 30 20 GKED C[C@H](OC(=O)c1ccc(C(C)(C)C#N)cc1)c1nnc(-c2cccc(Cl)c2)o1 796038202 AQUWYMQXGRRHAW-ZDUSSCGKSA-N 395.846 5.109 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570802 KPYWTOUAHZNYNV-PDOXMOPTSA-N 382.529 5.508 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCC(=O)c2ccc3ccccc3c2)s1 797572618 DNLCLGSVIKIHKQ-SFHVURJKSA-N 390.508 5.433 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2cccc(C)c2)c2cccc(F)c2)c1 800973816 AHXHSMWFXHNCPO-ILBGXUMGSA-N 388.486 5.694 30 20 GKED CC(/C=C\C(=O)c1ccc(C(F)(F)F)nc1O)=C/c1ccccc1OC(F)F 811686784 AJLNCALDPSFWOR-CAVDHDHCSA-N 399.315 5.250 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Oc3cccnc3)cc2)c(Cl)c1 813873722 QOCACQJQKRYKFW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1sc2ncn(N=Cc3sc4c(Cl)cccc4c3C)c(=O)c2c1C 814728716 IANPDNYSRJUIAG-UHFFFAOYSA-N 387.917 5.134 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NCc1cc(C#N)cs1 816664152 WOALCHQJSHBCFF-UHFFFAOYSA-N 397.422 5.598 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)N(CCC#N)CC(C)C 818864997 HNOHTMVVAATFTG-UHFFFAOYSA-N 395.450 5.149 30 20 GKED Cc1c(C(=O)/C=C\c2cn(C3CCCC3)nc2-c2ccccn2)cnn1C(C)C 840719496 GOZXNIGFUFTGCJ-QXMHVHEDSA-N 389.503 5.042 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)c(F)c1)c1ccc(Cl)c(Cl)c1Cl 844239543 JQUUYNSBMQSALT-QHHAFSJGSA-N 396.636 5.263 30 20 GKED CC(C)Oc1ccc(NCc2cccc(F)c2OCC(F)(F)F)cc1C#N 864039077 LKVIFCPWJOFCRS-UHFFFAOYSA-N 382.357 5.038 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(Br)cc1)c1cc(C#N)ccn1 902966095 YZPHBZMZTMEQHG-MEDUHNTESA-N 398.226 5.060 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCOc3cc(C)ccc3C)n2)cc1 916628086 LIANPLMBUANOMK-LJQANCHMSA-N 390.508 5.381 30 20 GKED CCCCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 916928973 ZJPGSCUFPJTNPI-INIZCTEOSA-N 389.282 5.297 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3c(s2)CCCC3)cc1 916948498 WDOFVOBWFDGCHN-KDOFPFPSSA-N 380.513 5.102 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4cccc(C)c4)CCC3)n2)cc1 916975013 UUPZWMIAKQBECP-HXUWFJFHSA-N 386.520 5.725 30 20 GKED Clc1ccc2cccnc2c1CON=Cc1ccc(Br)cc1 917395347 INKZRPRRRRABOT-UHFFFAOYSA-N 375.653 5.201 30 20 GKED N#Cc1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(CC(F)(F)F)C3)c(C2CC2)c1 933857811 CWZNJIRHLFUJSO-HOTGVXAUSA-N 377.410 5.163 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(OCc2ccccc2C)cc1 1776086687 IRAJGWMTBWAGNO-UHFFFAOYSA-N 388.467 5.417 30 20 GKED C=CCCC[C@@H](NCc1cc(Cl)ccc1Oc1ccc(Cl)cc1)C(=O)O 1776174233 FBKDJBSSDCPNDG-GOSISDBHSA-N 394.298 5.685 30 20 GKED CCCCCCCCCCCN(C)Cc1ccc(C(=O)O)cc1Br 1776784540 AOTALDCDFFEGPY-UHFFFAOYSA-N 398.385 6.110 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3cc(F)cc(F)c3)cc2)oc1C(=O)O 1777423198 CXVISZXICYZXEK-DAXSKMNVSA-N 398.361 5.040 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(Br)c1 7276312 NNUXWRRKDMTTBV-UHFFFAOYSA-N 377.241 5.240 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cccc3ccccc23)c1 15247289 XBCSMFZQYLUIBL-UHFFFAOYSA-O 397.523 5.487 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 43788429 GSFODQVJPQAFMF-QRWLVFNGSA-N 390.874 5.273 30 20 GKED COc1cc([C@@H](C)NC(=O)Nc2cc(C#N)ccc2C)ccc1OC1CCCC1 58452320 WWUMBNQFURVFPW-MRXNPFEDSA-N 393.487 5.079 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1CCc1ccccc1 66954607 WZWQBYOXTBEAIS-UYAOXDASSA-N 393.556 5.710 30 20 GKED N#CC1(C(=O)Nc2ccc(Sc3ccc(Br)cc3)cc2)CCC1 97589549 KDGIQKUKWHQQBL-UHFFFAOYSA-N 387.302 5.233 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 112128253 JBXCXHLPBADEGH-JKSUJKDBSA-N 377.579 5.078 30 20 GKED C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)c1ccc(C#N)cc1 118170678 ZDVIRVDGLHMIOP-LLVKDONJSA-N 386.274 5.224 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 122012340 KJNFGJNQEQONDX-MRXNPFEDSA-N 381.888 5.472 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1c(F)cc(C#N)cc1F 126615771 OXASMRIOPXSYDX-ZDUSSCGKSA-N 397.450 5.102 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 159299331 BFHWCOVPQWLEOU-QFBILLFUSA-N 382.533 5.481 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCn1ccnc1C(C)C 174258550 NHTLTFWUEYYSGC-UHFFFAOYSA-N 388.471 5.008 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(CCC(F)(F)F)cc1 176281773 IDKDJDHLHYLOMN-UHFFFAOYSA-N 387.405 5.273 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c(F)c1 177861048 LZAGRTNHEBDEEM-SFHVURJKSA-N 381.451 5.127 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(OC(C)C)cc2)ccc1OC 180811893 OPDZETWYPKYWGE-YLJYHZDGSA-N 382.504 5.014 30 20 GKED CC[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(C)cc1 181683044 KDWAJDBOSXAJIN-MJGOQNOKSA-N 381.545 5.069 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 248649721 ROPJPOXZSWNLJB-XBFCOCLRSA-N 390.430 5.098 30 20 GKED Cc1cc(CON=Cc2cccc(OCc3ccncc3)c2)c2ccccc2n1 255617275 ZNXLUUAYQDPYJZ-UHFFFAOYSA-N 383.451 5.068 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1CCCN1c1ccccc1 330235651 UAZSDSKXWJCNRY-RTWAWAEBSA-N 378.520 5.001 30 20 GKED Cc1c(C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)sc2ccc(C#N)cc12 431659294 RWEDEOSNBYGAIH-UHFFFAOYSA-N 397.503 5.492 30 20 GKED CN(Cc1cc(F)cc(F)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 434156562 CYPLGQSHVUUMEG-UHFFFAOYSA-N 393.393 5.293 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)cc1 437465183 FEONXRMTGGMJMG-RUCARUNLSA-N 386.417 5.183 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(Cc2ccccc2)no1 439577247 VRXSRCDBHZCZGI-KRWDZBQOSA-N 396.450 5.497 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCC1CCC(C#N)CC1)C1CC1 442734656 DXIDKUPLSLPVAS-VIQWUECVSA-N 375.516 5.405 30 20 GKED C[C@H](NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1ccc(C#N)cc1 448219870 JODBVNGJPSIOIL-HNNXBMFYSA-N 399.947 5.239 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@@H](C)C[C@@H](CC(F)(F)F)[C@H]1C 455252284 UDXKWNDHTFURIM-UXLLHSPISA-N 382.470 6.122 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 457349417 CCMXUEJOEYKDLU-LJQANCHMSA-N 389.927 5.033 30 20 GKED CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccccc1S[C@H](C)CC#N 462226660 AUSMZQQQVCKHPT-OAHLLOKOSA-N 385.489 5.388 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Oc2ccccc2)ccn1 465127215 LBIXMWAUUONAMI-MRXNPFEDSA-N 389.480 5.520 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](c1ccc(OC)cc1C)c1ccccc1Cl 466388329 MQPJONQHBRNPQM-OAQYLSRUSA-N 384.907 5.130 30 20 GKED N#C[C@@H](C(=O)c1cc(Oc2ccccc2)ccn1)c1nc(-c2ccccc2)cs1 466975559 DLDJGSKEJCPPKZ-IBGZPJMESA-N 397.459 5.487 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3cc(Cl)ccc3OCC3CCC3)CC2)cc1 468185488 BINFSAJMQBDKNY-UHFFFAOYSA-N 380.875 5.061 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1nc2ccccc2s1 472754689 RQGZJZKVFPBFQE-AWEZNQCLSA-N 396.541 5.055 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@H]1CCC[C@@H](C(F)(F)F)C1 473242637 RTEACPRBSKKKKT-VHSXEESVSA-N 386.311 5.107 30 20 GKED C=C[C@](C)(CCOC)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 473645307 SBNVTQAMWIXXNW-LJQANCHMSA-N 395.286 5.348 30 20 GKED N#Cc1c(NC(=O)CCSCc2ccc(Cl)cc2)sc2c1CCC2 480130082 GHMHDIXEPCUFAF-UHFFFAOYSA-N 376.934 5.024 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 481361913 STVRUXBKCZOQDE-NRFANRHFSA-N 395.528 5.490 30 20 GKED C[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 481915156 BRYMAPOZMZMESL-SIBVEZHUSA-N 397.522 5.651 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](N[C@H](C)CC)c1ccco1 482183901 IDMSUGBCRRDIDX-YLJYHZDGSA-N 383.536 5.382 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(Cc3cncs3)no2)c1 482764541 CJZXBQRBCMBKAJ-UHFFFAOYSA-N 394.843 5.101 30 20 GKED O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc(F)cc1C(F)(F)F 487315921 HDACUHMKFCYBPU-SWLSCSKDSA-N 391.286 5.149 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2)cc1)[C@@H](C)c1ccc(C#N)cc1 497594162 RGANTPRPZCVTQL-IBGZPJMESA-N 383.495 5.394 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2nc3ccccc3s2)cc1 500917236 YPZRUIOAQHLROL-UHFFFAOYSA-N 399.475 5.194 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1nc(-c2ccccc2)cs1 503676493 JREAHUORHGBVDE-LBPRGKRZSA-N 382.876 5.218 30 20 GKED C=CCCc1ccccc1NC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1 505006228 RXRYWXTYJJJFMR-NOTZXAQLSA-N 389.543 5.122 30 20 GKED COc1cc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c(OC)c1 505309312 ARLAWEZZAJTFQN-CYBMUJFWSA-N 385.489 5.051 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)Nc2cc(C#N)cn2C(C)(C)C)C2CC2)o1 508053279 JRJAXJFKBDMRIK-KDOFPFPSSA-N 380.492 5.028 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H](C)[C@@H]2C)cc1 510094309 UBLSMCLDVAUEGB-CVEARBPZSA-N 379.460 5.011 30 20 GKED N#CCC[C@H](NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccccc1 512045870 OOYVLOBVUUAMOL-FQEVSTJZSA-N 384.405 5.026 30 20 GKED C[C@H](NCc1ccccc1CN(C)C1CCCCC1)c1ccc(C#N)cc1F 512626899 XMJAEXVBHIZKSS-SFHVURJKSA-N 379.523 5.313 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)sc1C 517800916 OVWMGICFKMKJMI-QGZVFWFLSA-N 391.521 5.494 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F 521644914 VOGHUJAPKDUKML-UHFFFAOYSA-N 382.822 5.295 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521954891 GCMSEPROJRZQII-HNNXBMFYSA-N 391.858 5.232 30 20 GKED COc1ccc2c(c1)c(C(=O)Nc1ccc(C#N)cc1)c(C)n2Cc1ccccc1 523104805 JVRTULUKOZFHDI-UHFFFAOYSA-N 395.462 5.131 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cncc4ccccc34)cc2F)c1 524455870 FWKJLYAFCKZYOC-UHFFFAOYSA-N 397.409 5.077 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)oc1C 532013795 VPDIKIXYPXTIPE-CYBMUJFWSA-N 391.279 5.817 30 20 GKED Cc1cc(C[C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)n(-c2ccccc2)n1 536840778 SOBWLJTWBYOPLO-VUIBPRDZSA-N 398.554 5.106 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 537945844 AMNYRRUNEXNWKN-AUSIDOKSSA-N 379.548 5.918 30 20 GKED CCOc1cccc([C@@H]2C[C@@H]2NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 539453496 AHPAURMOHFQIDQ-QSFXBCCZSA-N 395.528 5.015 30 20 GKED C=CCCOCCCCC(=O)N1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 540490875 YEJQREJZOGXLEK-QFBILLFUSA-N 383.454 5.378 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cnn1-c1cccc(F)c1 542329269 BJMKCDSMLSZPHZ-INIZCTEOSA-N 396.491 5.034 30 20 GKED C[C@H](NCc1cccc(-n2cccn2)c1)c1ccc(-c2cccc(C#N)c2)cc1 543875917 KQJLODHGFYDSMR-IBGZPJMESA-N 378.479 5.262 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)n(Cc2ccncc2)c1C 547287733 NUKWXGHKZKGIRJ-UHFFFAOYSA-N 399.947 5.092 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cnn(Cc2ccccc2)c1 553104025 HYKQETSKVRSQHH-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)C1(c2cc(F)cc(C#N)c2)CC1 561382925 SISVXMGQNYCQKT-LSDHHAIUSA-N 384.882 5.033 30 20 GKED Cc1c(C(=O)Nc2cccnc2OCc2ccccc2)sc2ccc(C#N)cc12 590072881 NQQNCXBOAPGEAM-UHFFFAOYSA-N 399.475 5.308 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1 596733084 BOVMVIUOHOQBEO-JXFKEZNVSA-N 395.528 5.681 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2nccc3ccccc23)CC1 602259598 JSTIZOPWTOFVNP-INIZCTEOSA-N 387.508 5.157 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2Cl)c1)c1ccc(C#N)cc1 603633597 UYCAISQWCMIHMD-KRWDZBQOSA-N 376.887 5.641 30 20 GKED COc1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 603673168 CNARQQQLHJWSRB-HXUWFJFHSA-N 376.843 5.256 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 603800131 HXXWLJHMEIBQRF-VWLOTQADSA-N 397.522 5.464 30 20 GKED CCCCn1c(S[C@H](C#N)Cc2ccccc2)nc2sc(C)c(C)c2c1=O 603998242 ZWVDMMRRNJLMCJ-KRWDZBQOSA-N 397.569 5.102 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC4(CCCCC4)CC3)cn2)c1 608841361 NXAIUHGVGVQQTK-UHFFFAOYSA-N 390.487 5.324 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 608996070 QPKFWRFLRPOMJB-UHFFFAOYSA-N 377.488 5.203 30 20 GKED N#CCn1c(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)cc2ccccc21 609166481 DOKOCNKZQLGOKF-UHFFFAOYSA-N 393.874 5.392 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3cc4ccccc4n3CC#N)sc2C)s1 609175418 CDSMSGMCVMHNKE-UHFFFAOYSA-N 392.509 5.219 30 20 GKED CCCN(C(=O)c1ccc(Br)cc1F)c1cc(Cl)ccc1C#N 609285990 IYQKLCDAMCMNSY-UHFFFAOYSA-N 395.659 5.170 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CC[C@H]3CCCCO3)cc2Cl)c1 609504004 JEGATTHUFPBJDY-LJQANCHMSA-N 398.890 5.078 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@@H](c3ccccc3)C3CCC3)cc2)nc1 609504777 FRIFLFZALRUDCR-QHCPKHFHSA-N 383.451 5.017 30 20 GKED CCN(CC#N)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610173832 VVRDFHGRRDFAIO-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1ccccc1C(F)(F)F 610227849 NJOLCQNAVPLKAY-UONOGXRCSA-N 392.446 5.699 30 20 GKED C[C@@H](NC(=O)NCC1(Sc2ccccc2)CCCC1)c1cccc(C#N)c1 610355437 QNOSLBWNZGWMJC-QGZVFWFLSA-N 379.529 5.024 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)N[C@H](C)c1cccc(C#N)c1 610356272 NELRVXJNYOGUKF-MSOLQXFVSA-N 389.524 5.654 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)c(Cl)c1 611093772 BYLBMOUKCSUBLD-UHFFFAOYSA-N 377.124 5.275 30 20 GKED COc1ccc2ccccc2c1-c1cc(CSCc2ccnc(C#N)c2)on1 611497300 GFGAKCRIAVNZKX-UHFFFAOYSA-N 387.464 5.203 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)N[C@@](C)(C#N)C(C)(C)C 613365863 ZEDQHYLWCSYNDX-SFHVURJKSA-N 395.450 5.196 30 20 GKED C[C@H](CC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 615939964 NUMGNISNYLFPKR-RAIGVLPGSA-N 399.350 5.345 30 20 GKED CC(=O)c1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cs1 645955531 DNXROCUFDLYQAF-LLVKDONJSA-N 394.399 5.069 30 20 GKED C=CCN(CCCc1nc(-c2cccs2)no1)Cc1ccc(Cl)s1 674866085 JJNNVVOCJRHVFW-UHFFFAOYSA-N 379.938 5.134 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(CCC)[C@H]2CCc3ccccc32)c1=S 726588253 GVPHVPCSKLBXTN-IBGZPJMESA-N 394.544 5.217 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 728182293 HXWMRLWNMXJZKY-IAGOWNOFSA-N 375.390 5.163 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc2ccccc2c1OC(F)F 728695350 UINHOXXZESWSEP-BQYQJAHWSA-N 396.315 5.096 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@@H](CC)c1ccccc1 729069992 OROOYDUQTCUXEZ-TZIWHRDSSA-N 376.500 5.043 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1ccccc1-c1ccccc1 730953457 ZMRFBYVTGNAATN-UHFFFAOYSA-N 389.549 6.168 30 20 GKED Cc1ccccc1-c1nc(C(=O)OCc2cc(Cl)ccc2OCC#N)cs1 735348722 HRHQURJKJSZAOC-UHFFFAOYSA-N 398.871 5.031 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738893989 CNANUUUEWNYYMH-PKTZIBPZSA-N 384.483 5.352 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c(Cl)c1OC 741471588 BMCJSGNRIZIRGU-VURMDHGXSA-N 379.843 5.315 30 20 GKED N#Cc1csc(/C=C(\Cl)c2ncc(-c3ccccc3Br)o2)c1 748440879 RUOKXFNZEXHPAB-NSIKDUERSA-N 391.677 5.774 30 20 GKED Cc1cc(C(=O)N[C@@H](CCC#N)c2ccccc2)c(C)n1[C@@H](C)c1ccccc1 749045940 QUTMFVQXYPIBSU-CYFREDJKSA-N 385.511 5.489 30 20 GKED COc1ccc(/C=C/C(=O)c2ccsc2)cc1OCc1ccc([N+](=O)[O-])cc1 749103881 FFAZJSZSGCFWOI-XBXARRHUSA-N 395.436 5.140 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1ccccc1O)c1ccc(C(F)(F)F)cc1 750440476 ABMIUZHPGHBXBW-GOSISDBHSA-N 392.421 5.260 30 20 GKED C#CCOc1ccc([C@H](C)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)cc1 765607083 LEVAYHZFOVCACC-DFBJGRDBSA-N 395.506 5.026 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(Cl)c(F)c2)ccc1OC 772987885 YYLSHPPODFBOHV-BBRMVZONSA-N 376.859 5.019 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(F)c(C)c2)C2CC2)ccc1OC 774451520 YPIHUZZLIAJGFP-CVDCTZTESA-N 382.479 5.065 30 20 GKED CC(C)(C#N)CCOC(=O)c1cc(Cl)ccc1SCCC(C)(C)C#N 776398705 NZVYJCCSAZARQJ-UHFFFAOYSA-N 378.925 5.469 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1CNc1cccc(OCC#N)c1 779587609 DCDJJWURLGVUSQ-UHFFFAOYSA-N 380.879 5.164 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCc1ccc(Oc2ccccc2)cc1 780668728 FRFQCFHVJLSDJU-KRWDZBQOSA-N 387.439 5.091 30 20 GKED C/C(=C\C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc([N+](=O)[O-])cc1 783975966 XRFBNCZFIOYYRL-SZGUKTLCSA-N 381.457 5.031 30 20 GKED C[C@H]1CCc2ccc(Br)cc2[C@@H](NCc2ccc(OCC#N)cc2)C1 794809678 HORIWVREVLFFRI-BTYIYWSLSA-N 399.332 5.155 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)C1 797573080 OAOKBFVKKFYUKI-SQNIBIBYSA-N 390.593 5.773 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccs2)CCCCC1)c1cnc2ccccc2n1 810716646 KOQLFEPXHSFRPC-QGZVFWFLSA-N 375.497 5.061 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(Br)nc3)cs2)cc1 811695283 CACYBTREIKQATL-FPLPWBNLSA-N 385.286 5.172 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 862719523 YWEZHJGVNJZJJD-UHFFFAOYSA-N 398.528 5.872 30 20 GKED N#CCCC[C@H](NCc1nc(Cl)ccc1Br)c1ccccc1 877549550 NKXXJULMCNTPKG-HNNXBMFYSA-N 378.701 5.022 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC(C)(C)CC(F)F)n2)cc1 892607106 PWLLGBMOKPUOIY-CQSZACIVSA-N 378.444 5.066 30 20 GKED FC(F)(F)Oc1ccc2c(N3CCC4(CC3)C(F)(F)C4(F)F)ccnc2c1 899878822 XBKJWBZISALBMQ-UHFFFAOYSA-N 394.290 5.004 30 20 GKED C#Cc1cccc(NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C2CC2)c1 914721916 UIWLJUADSMTZQY-UHFFFAOYSA-N 395.384 5.002 30 20 GKED Cc1[nH]c2c(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cccc2c1C 917046792 PUTWMWCYTVEMCM-HNNXBMFYSA-N 379.872 5.538 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 918491088 XOYVAFCWBKYKKF-FZKQIMNGSA-N 398.890 5.973 30 20 GKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920806981 VEQPRKFVNSCGDB-CVEARBPZSA-N 396.462 5.848 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccccc3)nc2)cc1 921202587 UWHMDNOPIUDQHC-HSZRJFAPSA-N 390.446 5.051 30 20 GKED O=C(O)Cc1ccc(NN=C/C=C/c2ccc(OCc3ccccc3)cc2)cc1 1776085507 QTVCLCSNZNTSCD-UTAICERQSA-N 386.451 5.004 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1OCCC 1776125937 XEHKKQUNSLIJBQ-CLFYSBASSA-N 396.483 5.475 30 20 GKED C=C(C)COc1cc(/C=C\c2cc(C(=O)O)c3ccc(F)cc3n2)ccc1OC 1776140125 XAEOTILVTCFJBS-DAXSKMNVSA-N 393.414 5.206 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776388582 KXUIWPPSEWTKSI-QBFSEMIESA-N 392.476 5.797 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](Cc2ccc(C)c(C)c2)C(=O)O)c1 1776787196 BBVJKWPJPVKMSG-DEOSSOPVSA-N 397.559 5.438 30 20 GKED CCCCCCCOc1cccc(/C=C/c2ccc3cc(C(=O)O)ccc3n2)c1 1776788960 FSCSWEAMLALKQH-JLHYYAGUSA-N 389.495 6.453 30 20 GKED CCCCCCCOc1cccc(/C=C\C(=O)c2ccc(CC(=O)O)cc2)c1 1776789193 UJVUTWDHRIDBCR-QINSGFPZSA-N 380.484 5.559 30 20 GKED Cc1ccccc1N(C(=O)COc1ccccc1C#N)c1nc2ccccc2s1 7486120 IONXSQVDHLJLJL-UHFFFAOYSA-N 399.475 5.220 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(-c2nccs2)cc1 25732340 WSKASNPAOVIHLX-UHFFFAOYSA-N 381.460 5.601 30 20 GKED N#C[C@H](C(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)c1ccccn1 41481758 KFWPOOWSGMBIJN-SFHVURJKSA-N 383.382 5.033 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1ccc(C(F)(F)F)cn1 41555615 OBUOTTGPMRYAAL-SFHVURJKSA-N 382.341 5.383 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1nc(C2CC2)no1 56215351 SGHWMAMYYLSNPA-GFCCVEGCSA-N 380.835 5.437 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)ccc1Cl 63388512 XNAGOOZKYWDINI-UHFFFAOYSA-N 380.231 5.122 30 20 GKED CCc1nc(CN(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cs1 66953645 PSQDKYUXMGFTBM-UHFFFAOYSA-N 392.484 5.033 30 20 GKED CCCCCCCCC(=O)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 107576457 QDFQHPLZZVYKEF-SFHVURJKSA-N 387.499 5.332 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(Cc1ccco1)C1CCCC1 108359869 LGNCZPBJZJEKEN-QGZVFWFLSA-N 397.544 5.057 30 20 GKED C=CCC(CC=C)C(=O)N1CCc2cc(OC)c(OC)cc2[C@@H]1c1cccs1 121875139 PFFOHFCJHFHZTA-JOCHJYFZSA-N 397.540 5.008 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 122296011 TVEVRWRJVHUBBQ-KRWDZBQOSA-N 394.883 5.303 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2c(F)cc(C#N)cc2F)cc1F 126878502 DMYFJSFQCJSUOX-UHFFFAOYSA-N 398.340 5.029 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1cc(Cl)cs1 134459535 IAPNPNFCJMQUMM-UHFFFAOYSA-N 397.887 5.340 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(OC(F)(F)F)c1 153464756 HCXJQBRHMXETKG-LBPRGKRZSA-N 380.391 5.089 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)Nc3cc(C#N)ccc3OC(F)F)c2)n1 159894413 BSHWXCWOKMWHBW-UHFFFAOYSA-N 398.369 5.076 30 20 GKED N#CCCCCNC(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 170885790 XKJVTCXQDHLQHI-GOSISDBHSA-N 376.287 5.076 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](Cc2ccccc2)C1 173116750 WJYFTQWTKZTRKG-MJGOQNOKSA-N 379.529 5.035 30 20 GKED Cc1cccc2c(CCC(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c[nH]c12 173993647 LLOZIYAEMVMTNK-IBGZPJMESA-N 385.492 5.409 30 20 GKED N#Cc1cc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)ccc1F 183338174 TUSZTQXEJMWVCI-HNNXBMFYSA-N 376.275 5.109 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)cc1)c1nc(-c2ccc(Cl)cc2)cs1 301768204 ZOGXEKWIFKXCFN-QYSIDVQXSA-N 399.302 6.007 30 20 GKED CC(C)(NC(=O)CSCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 303022975 MFERLYYKOKPVNN-UHFFFAOYSA-N 393.339 5.150 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1ccccc1SC[C@H](C)C#N 303271564 HNBBKBJLINWMFO-JUWLWVHDSA-N 394.540 5.768 30 20 GKED CC(C)C1=CC2=CC[C@@H]3[C@](C)(/C(O)=N/Cc4n[nH]c(=N)o4)CCC[C@]3(C)[C@@H]2CC1 329081860 DIKHRLVOMQWJSL-AAUAJYIVSA-N 398.551 5.074 30 20 GKED OC1=Nc2cc(/C(O)=N/[C@@H]3CC[C@@H](c4ccc(F)cc4)C3)ccc2SCC1 329942504 VQJJMOAFOPDPRH-RHSMWYFYSA-N 384.476 5.550 30 20 GKED CCc1cc(C#N)c(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)s1 433417199 JBIHTPMVSPQDKZ-CCHVVGMOSA-N 382.451 5.270 30 20 GKED N#CCc1ccc(NC(=O)C2(c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 435829351 XCAAMXMCOXBRFJ-UHFFFAOYSA-N 378.781 5.095 30 20 GKED CCCCOc1cccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 437851927 TXXRXPIGISYBNO-FGZHOGPDSA-N 377.488 5.169 30 20 GKED CCSCC[C@H](C)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438672842 ROIMGANWQJTRCW-AWEZNQCLSA-N 387.480 5.143 30 20 GKED O=C([C@@H]1CCC[C@@H](C(F)(F)F)C1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 456563242 ADCYPSMAIYTQMK-CHWFTXMASA-N 399.297 5.087 30 20 GKED C=CCn1c(S[C@H](C)c2cccc(C)c2)nnc1[C@@H]1COc2ccccc2O1 463036302 QRQLQBSOVOSTMQ-UZLBHIALSA-N 393.512 5.138 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCCC2CCCC2)cc1 463277163 CRTLJZKKZHMLCY-UHFFFAOYSA-N 376.500 5.631 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@@H](C)c2cccc(C#N)c2)C(C)(C)C)cc1 464427349 PSXFTZUSHPGRGT-SFHVURJKSA-N 376.500 5.054 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@]1(C)C[C@H](NC(=O)[C@@H](C)CC(=C)C)CC(C)(C)C1 467950430 VBMDXLMIXPOVDY-PWSZPPJVSA-N 390.612 5.008 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(Oc2nccc(C)n2)cc1 467964741 UHYLLXUJOABESL-UHFFFAOYSA-N 388.471 5.188 30 20 GKED CN(C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1cc(Cl)ccc1C#N 479575898 LHBIWCWKDGUHPE-UHFFFAOYSA-N 395.890 5.007 30 20 GKED Cc1ccc(OCCCC(=O)Nc2cccc(OCCCC#N)c2)c(Cl)c1 480532001 WQJMCLQDXMLOEG-UHFFFAOYSA-N 386.879 5.129 30 20 GKED C=CCN(C(=O)c1c(F)c(F)cc(F)c1F)c1nc(-c2ccccc2)cs1 481766782 WKJHRVYSVQWFLO-UHFFFAOYSA-N 392.377 5.199 30 20 GKED Cc1nn(CC(F)(F)F)c(C)c1[C@H](C)N[C@H]1CCCCc2cc(C#N)ccc21 482010346 XEFHBLYRFNGDBN-DJJJIMSYSA-N 390.453 5.052 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 482936019 WSBBBODXLRUUHA-NQIIRXRSSA-N 393.487 5.066 30 20 GKED CSc1ccc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)o1 485977520 AUSLMKGHDUPBIZ-UHFFFAOYSA-N 380.444 5.168 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)N[C@H](CCCC#N)c3ccccc3)c2c1 487597492 VNHIHFPALZYHQH-JOCHJYFZSA-N 399.494 5.286 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 488280195 QLVWBXDQDZEISP-HXUWFJFHSA-N 375.472 5.018 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 488384539 AUGFZACJOUWPNQ-ICSRJNTNSA-N 379.891 5.568 30 20 GKED C=CCn1c(S[C@H](Cc2ccccc2)c2ccccc2)nnc1-c1cccnc1 496430941 WFQOIZDVVHTCBM-JOCHJYFZSA-N 398.535 5.602 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2sccc2C#N)cc1 497979471 FLTQNSQNHYHLJK-UHFFFAOYSA-N 384.844 5.326 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)N[C@@H](C)c3ccc(C#N)cc3)cc2)cs1 504173605 WFMYKRFVJVWRLU-GJZGRUSLSA-N 390.512 5.112 30 20 GKED N#CCc1ccc(NC(=O)c2cccc(OCc3ccc(Cl)cc3)c2)cc1 504357869 BJQDMPGRUYHDLF-UHFFFAOYSA-N 376.843 5.237 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)c1 505107263 DKZLHDOYBBPKLO-UHFFFAOYSA-N 389.160 5.058 30 20 GKED CC1(C#N)CCN(C(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)CC1 507827323 FQGVZMTYVLLNCO-UHFFFAOYSA-N 387.719 5.627 30 20 GKED C=CCN(Cc1ccc(OCc2csc(C)n2)cc1)Cc1cccc(C#N)c1 512053113 PTLWIJVMMFJCPZ-UHFFFAOYSA-N 389.524 5.090 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2cccc(F)c2F)cc1 513874140 IRVSTUGPXCDNJY-UHFFFAOYSA-N 395.384 5.210 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc(C)c1OC(F)F 517426090 JNLGZJCBAFEHGI-INIZCTEOSA-N 398.434 5.518 30 20 GKED C[C@]1(Cc2cccc(F)c2)CCCN1C(=O)Nc1ccc(CC#N)cc1Cl 517564450 DULQSMAIDNVXJT-OAQYLSRUSA-N 385.870 5.174 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](Cc2ccccc2)C1 518684893 QGJMHRFLJFFADY-UYAOXDASSA-N 393.556 5.425 30 20 GKED CC(C)c1ccc(OCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518740198 OEKRVEHIAZTNHY-QGZVFWFLSA-N 382.529 5.612 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2ccccc2)nc1)c1ccc(Cl)c(Cl)c1 521016126 JRPRSYRFJQQXRP-SFHVURJKSA-N 398.249 5.175 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC[C@H]2CCCCO2)cc1Cl 521107079 YEXMOLUWXRPWHV-QUCCMNQESA-N 382.891 5.283 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccccc2)CCCC1 521260484 DMRSKEJBXPSAMC-SFHVURJKSA-N 393.556 5.572 30 20 GKED N#Cc1cccc(CNC(=O)Nc2cccc(CSCc3ccccc3)c2)c1 522607156 UXYUSHYKIHRTJP-UHFFFAOYSA-N 387.508 5.313 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 523742762 PWFPYGXLVRGXAT-MRXNPFEDSA-N 376.481 5.032 30 20 GKED N#CC1(c2ccc(C(=O)N(c3ccc(F)c(Cl)c3)c3nccs3)cc2)CC1 538550598 CXRZUVVBBNYDEA-UHFFFAOYSA-N 397.862 5.469 30 20 GKED C=C(C)Cn1c(SCc2nc([C@@H]3CCC[C@@H](C)C3)no2)nnc1-c1ccco1 545640161 JSPRWDYWXKDAPW-HUUCEWRRSA-N 399.520 5.083 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(CC(=O)OC(C)(C)C)c1 547623054 FIJLTXRSAUIHKQ-UHFFFAOYSA-N 383.513 5.101 30 20 GKED N#CCc1cccc(Br)c1OCc1csc(-c2cccs2)n1 550844694 PUPLEYLVNDVISU-UHFFFAOYSA-N 391.315 5.279 30 20 GKED COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554119592 FVPHZIBUJOFNTC-DYESRHJHSA-N 391.515 5.501 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(C(F)(F)F)cn3)o2)cc1 556340205 SMYOUJKGZARUIM-UHFFFAOYSA-N 393.390 5.008 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)[C@H](C)c1ccccc1 569534391 KEXZCWLMFLTPCA-DLBZAZTESA-N 386.455 5.059 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](COC)c1cccc(Cl)c1 582146504 XQPQHDNFFUNJMG-HXUWFJFHSA-N 386.923 5.701 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3ccco3)cc2)c(C(F)(F)F)c1 589309735 FCPGGQKSMNRLRR-UHFFFAOYSA-N 385.345 5.034 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2C(=O)c2cccs2)c1 589552772 IRKWMNQCHDBXCF-UHFFFAOYSA-N 377.465 5.186 30 20 GKED N#CCCC[C@@H](NCc1ccc(Oc2ccccc2F)c(F)c1)c1ccccc1 590068623 HBEKWCUVPIJDAU-JOCHJYFZSA-N 392.449 6.282 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](C)(c2cccc(F)c2)C1 593159496 NQPCDHAKGVMSQL-KSFYIVLOSA-N 397.519 5.273 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3sc4c(c3C#N)CCCCC4)sc2n1 603834616 DIOXYVJLDRERKD-UHFFFAOYSA-N 381.526 5.368 30 20 GKED CC[C@@H](C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccccc1 609384857 KCCSECXQICYMHJ-RTBURBONSA-N 395.572 5.320 30 20 GKED N#C[C@H](NC(=O)CCSc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609460789 MCBWKFQXGJKZNM-INIZCTEOSA-N 398.837 5.222 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)c3cc4ccccc4n3CC#N)ccc2C)c1 610237150 SPGDCLXRNLOGLB-UHFFFAOYSA-N 396.450 5.221 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1csc(COc2ccc(Cl)cc2)n1 618742704 PUQWCEJETGXOKF-FQEVSTJZSA-N 395.915 5.024 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(F)ccc1Cl 644890332 GKFNHEZKMHXSSA-YUMQZZPRSA-N 391.714 5.118 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)s1 647379153 FVIRJUWPTDKCBR-OAHLLOKOSA-N 379.510 5.251 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)N1CCC2(CC1)C(F)(F)C2(F)F 650076445 UUOBMWNFBMKBDN-UHFFFAOYSA-N 398.322 5.080 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 732735065 SBPKTRHIRBUATP-CLFYSBASSA-N 395.871 5.421 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2F)cc1 733207295 XEQJGGWSOYLXFD-YHYXMXQVSA-N 394.368 5.271 30 20 GKED C=CC[C@@H](NC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)c1ccncc1 734664837 SRHHUIHUCGELAQ-OAQYLSRUSA-N 393.437 5.066 30 20 GKED Cc1nc(SCc2cc(Cl)ccc2OCC#N)c2c(C)c(C)sc2n1 735231106 PVDYNWVQEIDZFI-UHFFFAOYSA-N 389.933 5.465 30 20 GKED CC(C)(C)c1ncc(/C=C2\CCOc3cc(Br)ccc3C2=O)s1 736433864 KBTPSTRBMFPINS-DHZHZOJOSA-N 392.318 5.252 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cccc(OC(F)(F)F)c3)c2)s1 740013347 FDTKWCIBXGKILO-UHFFFAOYSA-N 388.414 5.475 30 20 GKED CCCc1ccc([C@@H](NCc2ccc(OC)c(C#N)c2)c2cccs2)cc1 742366371 ZOCTYPIGWONIES-HSZRJFAPSA-N 376.525 5.460 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)c3ccccc3SCC#N)c2)C1 745136053 QWSIAOMLTHRJIY-FXAWDEMLSA-N 394.540 5.650 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)cn1 746686441 DEWHANJHEULTGC-BENRWUELSA-N 390.443 5.036 30 20 GKED Cc1ccccc1[C@H](OC(=O)[C@@H](C)Oc1ccccc1C#N)c1cccs1 748501222 AMTGOZXIBVGFDF-IERDGZPVSA-N 377.465 5.028 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)NCc1cc(C#N)ccc1F)C1CC1 754915995 JNGSEDSGTPUVHC-MRXNPFEDSA-N 387.458 5.286 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cncc(-c3ccc(Cl)cc3)c2)cc1 758200556 CVSOGNCPPXHYIQ-UHFFFAOYSA-N 375.859 5.271 30 20 GKED C=C[C@H](CC(=O)N(Cc1ccccc1)C[C@@H](O)c1cccs1)c1ccccc1 759334146 TWIRCLMLLCRMOV-IFMALSPDSA-N 391.536 5.170 30 20 GKED N#CCOc1cccc(CC(=O)Nc2nc(-c3cccc4ccccc34)cs2)c1 760271070 UTOCEBOHJMIQMO-UHFFFAOYSA-N 399.475 5.047 30 20 GKED N#Cc1cccc([C@H]2CN(C(=O)Nc3ccc4c(c3)oc3ccccc34)CCO2)c1 761839202 RISCDSZSWFEJLT-HSZRJFAPSA-N 397.434 5.063 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@@H]1CCC(F)(F)C1 763842842 SXHRRUVDWFRBTA-UDSFMNFJSA-N 387.270 5.041 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)[C@@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 763939608 BIRYYOVQPBAFBI-AZUAARDMSA-N 388.492 5.033 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C23C[C@H]4C[C@@H](CC(F)(C4)C2)C3)cc1 764838283 BLJPPXLSJWXQAO-NERFXCGQSA-N 388.486 5.589 30 20 GKED Cc1cncc(C(=O)/C=C/c2csc(-c3cccc(Br)c3)n2)c1 767365675 FNKRBYYTOGMNFG-AATRIKPKSA-N 385.286 5.172 30 20 GKED COc1ccc(OC)c(C=NOCc2nc(-c3ccccc3Cl)cs2)c1 774720980 CWFXSWKLEMERDJ-UHFFFAOYSA-N 388.876 5.031 30 20 GKED C=CC[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1ccncc1 776185092 DZSYOAPVRJBPRL-DEOSSOPVSA-N 398.485 5.480 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 780176384 LGMNGIDTADQGRZ-QGZVFWFLSA-N 397.434 5.088 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)CCc2c(Br)cccc21 782889795 MUKXTKFQRPXQJD-BENRWUELSA-N 397.297 5.180 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](CC)c2cccc3ccccc23)ccc1OC 783252346 PFHIRKFTXWHOOB-NFBKMPQASA-N 388.511 5.770 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCc3cc(Br)cc(C)c32)c1 786852696 IGASXSHYEROZSG-QUCCMNQESA-N 399.332 5.216 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=Cc1ccsc1Cl 790148360 HINYEXMVURSFAI-UHFFFAOYSA-N 389.720 5.138 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(C(F)F)c2)cc1 790544211 VRPSQVDJIHLXNE-OAQYLSRUSA-N 376.406 5.461 30 20 GKED CC(C)n1nccc1/C=C1\C(=O)/C(=C/c2ccnn2C(C)C)CC[C@@H]1C1CC1 794942601 PIKUOWLEMLXSPB-RHHMDOPXSA-N 378.520 5.098 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)C[C@@H](CC#N)c1ccccc1 795990142 JOJTTXLSNXHGAA-CMKODMSKSA-N 392.499 5.158 30 20 GKED N#CC[C@H](CC(=O)OCc1ncc(-c2cccc(Cl)c2)o1)c1ccccc1 795993035 SDDVLFHTUDOIQQ-MRXNPFEDSA-N 380.831 5.126 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3CC(c4ccc(F)cc4)C3)n2)cc1 796762851 KEUVMIOXLOWRTE-QLOJAFMTSA-N 390.483 5.628 30 20 GKED N#Cc1cc(NC(=O)c2sccc2SC(F)F)ccc1OC(F)(F)F 799439213 FEHYZQXZLHBUOJ-UHFFFAOYSA-N 394.346 5.085 30 20 GKED CC(C)(C(=O)OCCCC1(C#N)CCOCC1)c1ccc(-c2ccccc2)cc1 800186719 FMCJBXJHOOTEJI-UHFFFAOYSA-N 391.511 5.275 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1cc(F)c(C(F)(F)F)cc1F 804316075 RCYBFMLOULRGPQ-UHFFFAOYSA-N 398.253 5.210 30 20 GKED COc1ccc(C[C@H](Nc2nc(Cl)c(C#N)s2)c2ccccc2)cc1OC 804424982 KXHBNNLPTWYORL-HNNXBMFYSA-N 399.903 5.081 30 20 GKED CC(/C=C/C(=O)c1cc([N+](=O)[O-])ccc1F)=C\c1ccccc1OC(F)F 814192125 YHDNMTMWOWBQPL-LWGDNYCUSA-N 377.318 5.178 30 20 GKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(C(F)(F)F)nc1Cl 862378639 FDRJNCSDCCXZMO-GFCCVEGCSA-N 379.813 5.160 30 20 GKED Fc1ccccc1NC(=S)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 914706790 JDSKLXTVRMPXQX-IUCAKERBSA-N 388.352 5.022 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3ccc(Cl)s3)cc2c1C 914773705 RXNSGNLNYJKIJX-HYXAFXHYSA-N 377.874 5.002 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1 915085856 FTMPEMSFZHBMIA-VWLOTQADSA-N 376.459 5.676 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccccc1OC(F)F 915982687 WFLHRFYVKNYXPW-JXMROGBWSA-N 381.378 5.158 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 916410075 PJMACDAWPLPLGR-UHFFFAOYSA-N 377.831 5.326 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@H](C#N)c3ccc4ccccc4n3)cs2)cc1 916848122 BSXXIEFNDOWSLU-LJQANCHMSA-N 383.476 5.086 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@H]1CCCC[C@@H]1C 920078343 PTHFVYXKSFNIRD-YWZLYKJASA-N 379.529 5.524 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc1C 920105739 LLLWGUUUKSLSPH-LJQANCHMSA-N 390.508 5.167 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 921120757 YQLABTDLBYQRER-OAHLLOKOSA-N 377.469 5.603 30 20 GKED O=C(O)c1ccc(NN=C(CCCc2ccccc2)c2ccc(F)cc2)cc1F 1776075473 KIXDWHNPLBWRLU-UHFFFAOYSA-N 394.421 5.502 30 20 GKED O=C(/C=C\c1cccc(C(=O)O)c1Cl)c1ccccc1OCc1ccccc1 1776126318 IWGSDPBUIYUTET-YPKPFQOOSA-N 392.838 5.513 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(Oc2ccc(F)cc2)cc1 1777268426 KLRJDSYRELPEAH-MLPAPPSSSA-N 392.382 5.221 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Cl)ccc3[N+](=O)[O-])c2c1 1777685626 QAAFLEQHLSCAFZ-KTAJNNJTSA-N 387.800 5.057 30 20 GKED CCOc1ccc(-n2c(SCCCC#N)nnc2-c2ccccc2Cl)cc1 5620547 KHSMZSOIURYXLY-UHFFFAOYSA-N 398.919 5.382 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)C(c1ccccc1)c1ccccc1 22358613 AIKXANONHMJWJO-UHFFFAOYSA-N 393.408 5.005 30 20 GKED Cc1nc(NC(=O)c2ccc(-c3ccccc3Cl)o2)sc1SCC#N 44789234 NYSRQEUBUOLHPX-UHFFFAOYSA-N 389.889 5.233 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)cc1Cl 66954325 WRYBHBGJFXWJAU-ZDUSSCGKSA-N 391.899 5.537 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3cccc(F)c3)n2)cc1 69286479 SWZDIOLOITYJOS-AUUYWEPGSA-N 394.471 5.013 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 120052387 WAZHAGLYGFGLGH-QFSNBGPKSA-N 379.872 5.138 30 20 GKED CC(C)C[C@@H](C)OCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 120777527 BZNBXWFURYNWNZ-KGLIPLIRSA-N 392.471 5.106 30 20 GKED CC(C)c1ccc(-c2nc(C[S@@](=O)Cc3ccc(C#N)cc3)cs2)cc1 125603680 KSJUCZVIORLISE-AREMUKBSSA-N 380.538 5.254 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 151795852 UPIZPKKRXUMRTQ-NRFANRHFSA-N 382.460 5.286 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 183466572 OTHCDLAXLBMRHC-LBPRGKRZSA-N 389.402 5.077 30 20 GKED CC(C)(C)c1csc(-c2cccc(Oc3nccc(C#N)c3[N+](=O)[O-])c2)n1 301650647 JNWWERBEOVLNTK-UHFFFAOYSA-N 380.429 5.075 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2c(C)c(C)nc3ccccc23)ccc1OC 302097004 SOOUOSMTZLIYRN-GOSISDBHSA-N 375.472 5.153 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1 303306711 DUAINRCOSNMZAM-INIZCTEOSA-N 381.545 5.429 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1cccc2ccccc12 303353392 FSGDJWORDPINIA-MRXNPFEDSA-N 375.497 5.413 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)on1 303418494 XNFSUOQXASOHNC-CYBMUJFWSA-N 397.887 5.499 30 20 GKED CCCCCCCC(=O)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 303669921 WUDCBPOOLSANHL-UHFFFAOYSA-N 382.907 5.017 30 20 GKED OC1=NC[C@@H]([C@@H]2CCCCN2C(O)=Nc2cccc(-c3cccc(Cl)c3)c2)C1 329140352 SZGFQZADVATKBM-PXNSSMCTSA-N 397.906 5.383 30 20 GKED C[C@H]1C[C@H](/N=C(/O)CC(C)(C)C2CCCCC2)c2ccsc2S1(=O)=O 329665966 QCKBDLRXJZDILS-BBRMVZONSA-N 383.579 5.308 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 425645385 CFXWIJOYSHFMGN-OAHLLOKOSA-N 381.524 5.032 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 425659823 WGJXLOGRURNHQJ-CVEARBPZSA-N 378.501 5.177 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(OCc3ccccc3F)cc2)c1 429834985 WKBLKEVFOVJRMK-UHFFFAOYSA-N 392.455 5.273 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431931219 NTAYORIVYPTHAT-UTKZUKDTSA-N 381.545 5.594 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 436348693 AOHKRPIOGJXAAP-QANKJYHBSA-N 385.920 5.269 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H](Cc3ccc(OC)cc3)C2)c1 438133357 CHMVLSSEYCGMAL-HXUWFJFHSA-N 394.515 5.137 30 20 GKED CN(CCCCc1ccccc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438646678 BVOTVACIECMNDQ-UHFFFAOYSA-N 375.394 5.064 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@@H](C)c1nc(Cc2ccc(Cl)cc2)no1 463940249 ZZNRONOOAOZOQZ-AWEZNQCLSA-N 396.878 5.146 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(F)c(F)c2F)cc1F 465462413 BNLBUJLCHGUYIF-UHFFFAOYSA-N 386.304 5.159 30 20 GKED CC[C@]1(C)Oc2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2O1 469821889 PPDOVRAMEZZKJD-HSZRJFAPSA-N 389.455 5.095 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CCC(c2ccc(O)cc2)CC1 478953981 MULZUFFDIQIGAP-UHFFFAOYSA-N 398.462 5.076 30 20 GKED COc1ccc([C@H](NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)C(C)C)cc1 480485878 VHZMYIFCOHFYEF-HSZRJFAPSA-N 393.531 5.132 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C)c(NC(=O)N2CCCC[C@H]2C=C)c1 485571713 RTEOFRKQAQZTQX-WOJBJXKFSA-N 396.535 5.140 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1cccc(-c2ccc(Br)cc2)c1)C1CC1 486385341 CWXLKMUYNCQKNG-AWEZNQCLSA-N 398.304 5.272 30 20 GKED CSC[C@@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 494198966 RKOQFIAIQJQNMU-HKUYNNGSSA-N 399.947 5.355 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(C1CC1)C1CC1 498007280 OJJJCKPESMBXJC-FQEVSTJZSA-N 393.918 5.648 30 20 GKED C[C@H]1CCC[C@H](CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 504057808 JETNMCFMTTYDNT-ICSRJNTNSA-N 376.500 5.487 30 20 GKED N#Cc1cccc(OCCCCc2nc(-c3c(Cl)cccc3Cl)no2)c1 505092974 CNMPMIMSYYTTRQ-UHFFFAOYSA-N 388.254 5.317 30 20 GKED COc1ccc(CN(C)Cc2csc3ccccc23)cc1OCCCC#N 506404622 QQSWZZDSHCACOD-UHFFFAOYSA-N 380.513 5.224 30 20 GKED COc1cccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 510681721 NADMBTORBVKBEY-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 511356236 BKLWBXQJHVCJKZ-SFHVURJKSA-N 378.522 5.553 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(CC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 513235296 AKXYQMFEUOTLPM-DBXWQHBBSA-N 393.556 5.102 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513403295 SAZGEHIYDPMXGI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc4ncccc34)cc2)cc1 517655291 GEKOZRSCSXEMTC-UHFFFAOYSA-N 379.419 5.345 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(Cl)cc1Cl 518653124 SGNUJXKMABBHND-GFCCVEGCSA-N 395.311 5.405 30 20 GKED COc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 518681760 JLDUHRRTTUNJNA-MRXNPFEDSA-N 397.544 5.090 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1 520938090 PQORCLKRKOTENY-HRAATJIYSA-N 379.529 5.662 30 20 GKED CCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 521191820 CKQSRAWOTYNDPD-GOSISDBHSA-N 376.287 5.722 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc3c(c2)Cc2ccccc2-3)cc1 521270561 XKMOXSXOTZBVGX-UHFFFAOYSA-N 382.463 5.217 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(F)c(F)c(F)c3F)cc2)cc1 521356651 DMUXHKKNQOBBFJ-UHFFFAOYSA-N 386.304 5.159 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)ccc3F)cc2)c1 524387998 BFRVOLJSWSNBDC-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 525051917 HUMQPKGOKGSGQI-UHFFFAOYSA-N 387.439 5.175 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)Nc1sc2c(c1C#N)CCCCC2 525628553 JIPFZMQYLAFPIG-GFCCVEGCSA-N 399.516 5.019 30 20 GKED C[C@H](C#N)CN(C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)C1CC1 532820127 XYUIYFUPKAMIKQ-MRXNPFEDSA-N 389.474 5.057 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1ccccc1 536182963 SSRGEYLKRYUHDF-BVZFJXPGSA-N 381.479 5.128 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccccc1OCC(F)F 540860631 GZBFRBIWIVJMRF-UHFFFAOYSA-N 394.377 5.247 30 20 GKED N#CCc1ccnc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 545927700 WTEGVRGHPRLPHH-UHFFFAOYSA-N 394.818 5.114 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)c1ccccc1 549268127 QOTJAUMDYRQDRB-FQEVSTJZSA-N 375.472 5.082 30 20 GKED N#CCCC[C@H](NCc1csc(-c2ccc(Cl)cc2)n1)c1ccccc1 552083672 TUFQEIQVRQDCOE-FQEVSTJZSA-N 381.932 5.988 30 20 GKED N#CC[C@@H](CC(=O)NC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1ccccc1 552244047 NLBMOBRPECJHOX-RBBKRZOGSA-N 396.918 5.011 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(CN2CCCCC2)cc1 553273461 MVKCGLMBFYSROS-GOSISDBHSA-N 393.556 5.319 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 566327559 SHKGGXGTGKVWIU-KRWDZBQOSA-N 378.476 5.036 30 20 GKED C=CCn1c(Sc2ncnc3ccc(SC)cc23)nnc1-c1cccs1 570193714 CSSZDUWURIKMJR-UHFFFAOYSA-N 397.554 5.009 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)F)cc1)c1nc2cc(C(F)(F)F)ccc2s1 588349051 RBNZNWXJGPGXAI-LBPRGKRZSA-N 396.340 5.743 30 20 GKED C[C@@H](NC(=O)CC1(C#N)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 590341682 NWRDCQAMMHPYCW-GFCCVEGCSA-N 378.419 5.305 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CCCc3sc(Cl)cc32)c(Cl)c1 590452338 CCSZMYKIVMUGPP-LBPRGKRZSA-N 385.703 5.387 30 20 GKED COc1ccccc1[C@@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 590942346 LXPZQPAFGCUKPR-YADHBBJMSA-N 391.515 5.367 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)CCCCC#N 593984239 NOSUHQYLIGRQCG-UHFFFAOYSA-N 392.478 5.754 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(Cc3nnc4n3CCCCC4)cc2)cc1 594502110 XBAPKWHTKFNIAJ-UHFFFAOYSA-N 399.542 5.009 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)c(Br)cc1F 599047943 GXKMJQKZBSNHHN-DJJJIMSYSA-N 393.275 5.813 30 20 GKED C=CCCCCCN(C)C(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 606967655 MTDYIINIRAGFLF-IBGZPJMESA-N 393.531 5.388 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1cc(F)ccc1F 609370551 CMSDOMFMCHOFEG-LBPRGKRZSA-N 378.469 5.090 30 20 GKED Cc1cccc2c1CCCN2C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609648377 YNDMMKKTZDSYNC-UHFFFAOYSA-N 382.463 5.039 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1-c1ccc(Cl)cc1 610092126 DHGIGRJFPHDEMG-INIZCTEOSA-N 389.886 5.956 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3ccc(C#N)cc3Br)oc12 612494688 MOEGHGALPXJZEO-CYBMUJFWSA-N 399.288 5.316 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 615463517 SBYSJHYBSSGKOB-UHFFFAOYSA-N 398.812 5.588 30 20 GKED CC(C)(c1ccc(NC(=O)N[C@H]2CCc3cc(C#N)ccc32)cc1)C(F)(F)F 618766936 XPNNFZUMWHHGRG-SFHVURJKSA-N 387.405 5.207 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2)ccc1OC 622266300 FBTSZZBTDHZPPH-OAHLLOKOSA-N 379.422 5.520 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 684227565 BDRFZNOQGMQMDH-LDYMZIIASA-N 390.274 5.145 30 20 GKED O=C(/C=C/c1ccccc1-n1cncn1)c1ccc(-c2ccccc2F)s1 726743428 GVKQECLABFPFSM-MDZDMXLPSA-N 375.428 5.031 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(C(F)(F)F)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727266586 ARIBOZKTFRPULU-YVMONPNESA-N 394.305 5.035 30 20 GKED CCN(C(=O)/C=C\c1ccccc1C#N)[C@@H](c1ccccc1)c1ccc(F)cc1 730193660 PNQCJDACJVQZNB-SEPOPDPSSA-N 384.454 5.349 30 20 GKED N#C[C@@H](C(=O)CC1CCC(c2ccccc2)CC1)c1nc2cc(F)ccc2s1 731138628 WSHUKXCWYMTJBW-KVWWFHCMSA-N 392.499 5.976 30 20 GKED N#C[C@H](NC(=O)c1sc2ccccc2c1Cl)c1cccc(C(F)(F)F)c1 731646151 YNGOVCJFLDHNER-ZDUSSCGKSA-N 394.805 5.568 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 738897493 VFJZNWZSEGBGQJ-KSFYIVLOSA-N 389.524 5.465 30 20 GKED N#Cc1ccc(NC(=O)CCN2c3ccccc3Sc3ccccc32)cc1C#N 741943481 PBIZXDLMHQSJRV-UHFFFAOYSA-N 396.475 5.061 30 20 GKED N#Cc1csc(/C=C2/SC(=S)N(c3ccccc3C(F)(F)F)C2=O)c1 748662853 XBFZAPSEZBKVES-AWNIVKPZSA-N 396.440 5.044 30 20 GKED C#CCN(C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1)C1CCCCC1 749126235 RLHVNOCOVIMHTC-UHFFFAOYSA-N 382.529 5.005 30 20 GKED Cc1ccc(-c2nc(/C=C3\SC(=Nc4c(C)cccc4C)NC3=O)co2)cc1 749886925 RGZNIEVJJLDSDB-WQRHYEAKSA-N 389.480 5.158 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C(C)=C\c2ccc(F)cc2)cc1 750685959 AAWQMPDACVTPTJ-FTBYOFJDSA-N 378.447 5.090 30 20 GKED COc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 750685969 AJKWTHSGUNTWSD-OXJNMPFZSA-N 390.508 5.497 30 20 GKED Cc1ncsc1C(=O)/C=C/c1nc(-c2cc(Cl)ccc2Cl)cs1 753901043 SYVHEXBFQQVFAA-SNAWJCMRSA-N 381.309 5.778 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(N3CCCCC3)nc2)cc1 764991157 SIFZPTQQVHFUKO-GOSISDBHSA-N 385.939 5.054 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)c2ccccc12 765142767 QIQSSIPXXXUMTH-CQSZACIVSA-N 379.847 5.278 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 767698852 UZAHBBGRZXCZBS-MRVPVSSYSA-N 399.101 5.384 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1 773076811 PBMWKGFTATUXPN-HNAYVOBHSA-N 379.472 5.041 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H](C#N)C1CCCCC1 776353666 FXBGCJBEPKPNGQ-LJQANCHMSA-N 384.501 5.213 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(C#N)c(Cl)c1 779051660 XKNYTCGMUNHUTH-MRXNPFEDSA-N 390.870 5.321 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C#N)cc2F)ccc1OCc1ccccc1 781109040 WQJUUDXGEVMRHA-FLIBITNWSA-N 387.410 5.181 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1F)C(C)C)c1ccncc1 781941946 WABASOZIZVRLEW-RTBURBONSA-N 375.875 5.188 30 20 GKED Cc1c(C(=O)Nc2cccc(C3SCCS3)c2)sc2ccc(C#N)cc12 794212168 OCRXXTVKWDIUDO-UHFFFAOYSA-N 396.562 5.812 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1Br 798859383 CWJIXISFYPOYBI-MRXNPFEDSA-N 393.284 5.151 30 20 GKED C=CCOc1ccc(CNC(=O)c2ccc(C3SCCCS3)cc2)cc1 803377978 KZDZQLSTHLSTKK-UHFFFAOYSA-N 385.554 5.050 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)CC1 809088661 XPLJNAOUFNLMFT-BETUJISGSA-N 396.434 5.121 30 20 GKED CC(C)c1cccc(NC(=S)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 811707398 AQSZCJCLDOCWOV-UHFFFAOYSA-N 388.496 5.678 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211976 USMKIZWUSOZEPT-LPHOPBHVSA-N 392.446 5.235 30 20 GKED N#CCCC[C@H](NC(=S)Nc1cccc(Br)c1)c1ccccc1 814209974 IKAWLDDWCWJSEW-KRWDZBQOSA-N 388.334 5.171 30 20 GKED N#Cc1cccc(COc2ccc(NCc3conc3Cc3ccccc3)cc2)c1 816565316 KTWAYJBREMBGGH-UHFFFAOYSA-N 395.462 5.328 30 20 GKED C#Cc1cccc(NC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)c1 817840871 KFXKKTDBCJRVHR-UHFFFAOYSA-N 379.415 5.002 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)ccc1NC(=O)OC(C)(C)C 842940858 KJNPJUZIKARGGE-OAHLLOKOSA-N 397.500 5.166 30 20 GKED CC(C)(C)c1nc(C#N)c(NN=C(CCC(F)(F)F)CCC(F)(F)F)o1 853297406 CXWKQKMJOQJDKV-UHFFFAOYSA-N 384.324 5.297 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3ccc(Cl)s3)cn2)cc1 916074670 VECORWDINLBLKF-VQHVLOKHSA-N 381.844 5.112 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Oc3cccc(Cl)c3)n2)cc1 916972336 NGKNJGDTECOCPJ-KBXCAEBGSA-N 396.899 5.416 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CSc3ccccc3Cl)n2)cc1 916973390 WOUIANNGKKWZLS-HNNXBMFYSA-N 398.940 5.741 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1ccc(N(C)C)cc1 919894020 XETZORSTZPFVFS-UHFFFAOYSA-N 399.494 5.296 30 20 GKED COc1cc(C=NOCc2csc(C3CCCCC3)n2)ccc1OC(F)F 920256904 CISHCEBYWMIZBQ-UHFFFAOYSA-N 396.459 5.352 30 20 GKED O=C(O)[C@@H](Oc1cccc(C=NNc2c(F)cccc2Cl)c1)c1ccccc1 1776055717 KZZRXZVVAGLRBI-FQEVSTJZSA-N 398.821 5.130 30 20 GKED C=CCc1cc(C)c(OCCCN(CC(=O)O)[C@@H](CC)c2ccccc2)cc1C 1776188400 XBSBQWBAGFLLAO-QHCPKHFHSA-N 395.543 5.339 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776339832 FDKWVJJQPCIUTQ-FRKPEAEDSA-N 384.475 6.146 30 20 GKED CCCCCCCC[C@@H](C)C(=O)NCc1ccc(C(F)(F)F)c(C(=O)O)c1 1776786211 ZVUUODXRFDUKAF-CQSZACIVSA-N 387.442 5.407 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1 1776869259 QUQZUSTWGSRVHE-VBKFSLOCSA-N 399.490 5.616 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C\c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1777566927 XSJOCJGAZNADGI-SFQUDFHCSA-N 385.444 5.197 30 20 GKED O=C(/C=C/c1ccc(F)c(C(=O)O)c1)c1ccc(-c2c(F)cccc2F)cc1 1777570071 LUCGEFABFXFCRG-VZUCSPMQSA-N 382.337 5.365 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1Cl 15711314 WFKZOYWROYLVJA-HNNXBMFYSA-N 392.842 5.410 30 20 GKED N#Cc1c(NC(=O)CCN2CCC[C@@H]2c2cccs2)sc2c1CCCCC2 21473152 YPKWZGGBXCEUOC-QGZVFWFLSA-N 399.585 5.116 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 41554381 STYWOUJAIQJVLA-NSHDSACASA-N 393.415 5.084 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(C)sc2C)cs1 54897290 ICNQBSDGOVMLRI-YFHOEESVSA-N 396.537 5.711 30 20 GKED COc1cccc(SCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 66037275 FTRHIAXAZGGPPZ-UHFFFAOYSA-N 390.464 5.090 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)cc1Br 66802319 NCHWEWONJPTOKT-LLVKDONJSA-N 393.281 5.235 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1 72025315 XISXBAHRGKTFLC-FCHUYYIVSA-N 386.426 5.540 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Nc1ccc(CC#N)cc1 104985842 MNBOVNRLSSMDHP-AWEZNQCLSA-N 394.475 5.206 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1 121162757 LZUIUVOQJISBKZ-UHFFFAOYSA-N 385.345 5.034 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1csc(-c2ccco2)n1 121433851 HDFRBUDMNFZJLC-UHFFFAOYSA-N 393.921 5.016 30 20 GKED CC(C)c1cnc(S[C@@H](C)C(=O)N(CCC#N)c2ccccc2)n1C(C)C 128933753 ZPHXZIZQMTVBGA-KRWDZBQOSA-N 384.549 5.015 30 20 GKED Cc1nc(C(C)(C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)sc1C 150975039 XKWVMXVVXVXQFX-LBPRGKRZSA-N 388.562 5.211 30 20 GKED Cc1cc(C(=O)N[C@H](CCC#N)c2ccccc2)ccc1NC(=O)OC(C)(C)C 153231442 IICPMMHLTPFBJU-HXUWFJFHSA-N 393.487 5.117 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccccc3S[C@H](C)CC#N)c[nH]c12 155096465 XEKHSUQHKYRPLW-MRXNPFEDSA-N 377.513 5.442 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 160977526 CTOOLLYWHGTHLT-QFIPXVFZSA-N 398.466 5.105 30 20 GKED C[C@@H](SCCC(=O)Nc1ccccc1C(F)(F)F)c1ccc(C#N)cc1 161807951 HJBBINFIBRIMPV-CYBMUJFWSA-N 378.419 5.400 30 20 GKED COc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1NC(=O)c1cccc(F)c1 173921884 PHHUSPBZGYODLB-HNNXBMFYSA-N 389.430 5.131 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 176491685 FYRYTIFIPSDLFO-CQSZACIVSA-N 393.468 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nnn(-c2cccc(Cl)c2)c1C 189900126 YYMSSBNHMPQQEG-UHFFFAOYSA-N 394.906 5.333 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 194226053 UQPXAPDKBWZEPD-UHFFFAOYSA-N 396.830 5.002 30 20 GKED Cc1ccc(C)c(/N=C2\N=C(O)/C(=C\c3ccc(N(C)CCC#N)cc3)S2)c1 207094515 PPRDOVXOZBWCPR-XSFVSMFZSA-N 390.512 5.385 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1c(Cl)nc2sccn12 255431652 WILRBMHVUZYZDD-UPHRSURJSA-N 377.903 5.130 30 20 GKED O/C(=N/[C@@H]1c2ccccc2CC12CCOCC2)c1scnc1C1CCCC1 329772492 KQBPCKJSQGFYEY-HXUWFJFHSA-N 382.529 5.200 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1 330023566 IWNIGKOBSBZBIW-UUKMXZOPSA-N 381.520 5.431 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N(CCC#N)CCC(C)C 428868214 OXPTYCWJYTXQFH-UHFFFAOYSA-N 379.504 5.368 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@H](Cc2ccccc2)C1)c1ccccc1 431916738 PHOSHAPIBNHRHW-MZYLBHOOSA-N 375.516 5.132 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1C(F)(F)F 438643842 VAFWTAMPNLVHSG-KRWDZBQOSA-N 377.341 5.085 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(Cc2ccccc2Cl)C1 438666222 GUVUGTCPCDNJQT-HNNXBMFYSA-N 399.947 5.298 30 20 GKED N#Cc1ccc(CSc2nnc(COc3ccc(Cl)cc3)o2)c(Cl)c1 438890457 OETWJIOWMQYMCJ-UHFFFAOYSA-N 392.267 5.119 30 20 GKED COc1cc2c(cc1OC)[C@H](c1cccs1)N(CCCCC(C)(C)C#N)CC2 444601099 VGCYXIITYWQOPU-JOCHJYFZSA-N 398.572 5.433 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(CC#N)cc1Cl 452643344 JCVYJICRCVIYCG-GFCCVEGCSA-N 380.797 5.242 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(c2cccc(Cl)c2)C1 454753807 NKFYVXXKEGFJNC-AWEZNQCLSA-N 385.920 5.223 30 20 GKED CCCn1ncc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C1CC1 454754327 NQSHRQGDDPSFGV-CQSZACIVSA-N 383.521 5.066 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCOCC2)c2ccccc21 455238544 BNNDGORWLYASPE-UHFFFAOYSA-N 390.527 5.639 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](c1nc(C)cs1)C(F)(F)F)c1ccccc1 455709764 RUGSKGGLSPKLBA-HUUCEWRRSA-N 383.439 5.062 30 20 GKED C=CCC[C@H](CCC)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 461883563 JZMTZNFHSUKTFV-UNMCSNQZSA-N 389.536 5.043 30 20 GKED N#C[C@@H](NC(=O)c1cscc1-c1ccccc1)c1cccc(C(F)(F)F)c1 464397169 LGIISZCTLPXCTB-GOSISDBHSA-N 386.398 5.429 30 20 GKED CCOc1c(Cl)cc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1Cl 466303575 VTRIEWRVADIOHH-UHFFFAOYSA-N 375.255 5.200 30 20 GKED Cc1ccc(-c2cncc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2)cc1 466344707 BQTNYPVQTTYYMJ-QGZVFWFLSA-N 387.508 5.704 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 466406434 WWBMQONTTZXOHV-LBPRGKRZSA-N 395.381 5.027 30 20 GKED C=CCn1c(SCCCSCC#N)nnc1-c1ccc(C(C)(C)C)cc1 466615046 ARAYLQHHLUEBGS-UHFFFAOYSA-N 386.590 5.168 30 20 GKED Cc1c(NC(=O)c2cc(C(F)(F)F)ccc2F)cccc1OCC(F)(F)F 471705509 KHJCUFCLVJMPJO-UHFFFAOYSA-N 395.274 5.346 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@@H]1c1ccccc1OC)c1ccc(F)c(F)c1 477738823 AUMTYZULXBXNNF-CTNGQTDRSA-N 386.442 5.137 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(-c4ccccc4)no3)c2)c1 480188052 YBIQNOGRDKXAEC-UHFFFAOYSA-N 395.418 5.045 30 20 GKED COCCSc1ccc([C@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)cc1 481642361 HXATUZTWIWAOOS-GAJHUEQPSA-N 380.557 5.415 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](CO)c1ccccc1Cl 482216433 VSLCCAGSMJMXSV-QGZVFWFLSA-N 386.923 5.090 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(c3c(F)cccc3F)CC2)cc1 486087496 AUJWCULEYAKEQW-UHFFFAOYSA-N 383.442 5.177 30 20 GKED C[C@@H](NCc1cnc(-c2ccco2)s1)c1ccc(-c2cccc(C#N)c2)cc1 487576815 QKHGWYOONWJUGI-MRXNPFEDSA-N 385.492 5.793 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2cnn([C@H](C)C3CC3)c2)cc1 491004841 UAXKAJNDMIYCSS-MRXNPFEDSA-N 386.455 5.079 30 20 GKED C=CCc1cc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)cc(OC)c1O 500900858 STUIHNXVRIVWDY-KRWDZBQOSA-N 378.299 5.213 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1c(F)cccc1F 505352018 KHEOTCROZNZUMJ-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1nc2ccccc2[nH]1 513742373 WEFYQQDZMVDSJR-FQEVSTJZSA-N 388.430 5.268 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 515504257 BFWSQLFNVBQSMW-LJQANCHMSA-N 399.494 5.146 30 20 GKED C[C@@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(F)c(Cl)c1 517177925 IIFPJNRIYBGCBI-SNVBAGLBSA-N 383.275 5.437 30 20 GKED CNc1snc(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 517820851 MRNMGMATSHPBGI-MRXNPFEDSA-N 396.903 5.054 30 20 GKED Cc1cnn(-c2ccc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)cc2)c1 517841168 JQKXSCKDJCDBCA-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3)ccc2Cl)sc2c1CCC2 518376391 YJDVMIKIYSYVRT-UHFFFAOYSA-N 378.884 5.681 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)CCCCOc1cccc(C#N)c1 520332758 VHGTXWMFIHNMPA-QGZVFWFLSA-N 376.456 5.073 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521259708 QAWNCWIFBXEZJQ-PXNSSMCTSA-N 379.529 5.616 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cc(F)ccc2Cl)c1 522274791 RCOZLWVRSPUOKV-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1cccs1 523108376 OPMHESYVMNHEJA-CQSZACIVSA-N 380.444 5.080 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(N2CCCCCC2)c1 524629275 WTAIAYKBJSUNLM-UHFFFAOYSA-N 388.515 5.159 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)cc1F 533132424 LIVYMAGHGGIDDZ-HNNXBMFYSA-N 397.450 5.091 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)Nc1ncc(Cl)cc1Cl 538947485 DJPZPFOHFRGGSM-QMMMGPOBSA-N 386.691 5.033 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCO[C@H](c2ccc(C(F)(F)F)cc2)C1 542015020 FCXKEHWSEMXCAM-FQEVSTJZSA-N 388.433 5.080 30 20 GKED C[C@H](Oc1ccccc1)c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 545733649 MJBOAVHOUVZZJB-UJGDBWEASA-N 384.439 5.248 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 551222830 MUWFVUFNLWTZPW-OXJNMPFZSA-N 392.490 6.427 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCOc2ccccc2[C@H]1C 596736089 SDMDZJWYFCVVCE-HZPDHXFCSA-N 381.501 5.068 30 20 GKED N#CCc1cccc2c1CCN(C(=O)Nc1ccc(SC3CCCC3)cc1)C2 599724380 WLYATUFZYBHOTO-UHFFFAOYSA-N 391.540 5.378 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3ccc(Cl)s3)cn2)c1 603756563 ZIYYLHIEMUEXNO-UHFFFAOYSA-N 383.860 5.032 30 20 GKED CCC[C@H](NC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608860876 MQHOJIVYEXDJQY-LIRRHRJNSA-N 389.421 5.479 30 20 GKED Cc1ccccc1-c1nc(C(=O)N(Cc2ccco2)c2ccccc2C#N)cs1 608936088 PVNPNFGQRVRURH-UHFFFAOYSA-N 399.475 5.430 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1CCCC[C@H]1C 609078725 KRUCOMDZOHKSGG-IIBYNOLFSA-N 377.488 5.146 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC(c4ccccc4)CC3)c2)cc1 609208928 LBOOMRLCUTXQMD-UHFFFAOYSA-N 397.478 5.762 30 20 GKED CN(C[C@@H]1CCCO[C@H]1c1ccccc1)c1c(C#N)cnc2ccc(Cl)cc12 610274735 APCMFJWAXDWUCR-SBUREZEXSA-N 391.902 5.364 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCCO[C@H](C)c1ccccc1 612203539 HIGHZSXNFLJRMW-MRXNPFEDSA-N 392.952 5.267 30 20 GKED C=CCCOCC(=O)N(Cc1ccccc1)c1nc2c(C)c(C)ccc2s1 620326549 JPJONAPZKGXARH-UHFFFAOYSA-N 380.513 5.039 30 20 GKED C=CCC[C@@H](NC(=O)C[C@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 676731467 ZVRWOVMCBWLMII-HNAYVOBHSA-N 376.422 5.418 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NCC(=O)Nc1ccccc1SCC#N 725794694 LYHVROCJOFTRME-UHFFFAOYSA-N 399.585 5.552 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc3c(c2)nc(C)n3-c2ccccc2)cc1 726941735 JWUFGIVJJWRQQF-UHFFFAOYSA-N 394.478 5.203 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1sccc1SC(F)F 730469641 JJWICIJGIAQZMT-UHFFFAOYSA-N 389.832 5.206 30 20 GKED C#CCOc1ccc(NC(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 731112342 IFOFOZWZMCCQSU-CYBMUJFWSA-N 377.271 5.230 30 20 GKED Cc1cc(C(=O)N(CCC#N)c2ccc(F)cc2)c(C)n1[C@H](C)c1ccccc1 732093594 IPHPVSLXBZESIO-GOSISDBHSA-N 389.474 5.414 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 732591279 TWASFBFTHKSVSP-VXKWHMMOSA-N 393.556 5.482 30 20 GKED CC(C)n1cc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 732878988 VNYGMSJTMFMIAJ-VGOFRKELSA-N 387.487 5.002 30 20 GKED C=CC[C@H](NC(=O)c1sc(-c2cccc(Cl)c2)nc1C)c1ccncc1 734235453 IKPLBLCRBXRNAE-KRWDZBQOSA-N 383.904 5.214 30 20 GKED C=CC[C@H](NC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1ccncc1 734360011 FFBHPIMYEOVLDZ-WBMJQRKESA-N 381.328 5.303 30 20 GKED C=CC[C@H](NC(=O)NCC1(c2cccc(Cl)c2)CCCC1)c1ccncc1 734664785 RECPFMLZSPTUQN-FQEVSTJZSA-N 383.923 5.163 30 20 GKED C=CC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1)c1ccncc1 734678866 JIAMCPHVFFGPPV-FGZHOGPDSA-N 377.532 5.543 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2c(-c3ccccc3)nn(C)c2Cl)cc1 734745228 FTQRSIFSEPDXLH-MRXNPFEDSA-N 380.923 5.549 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)c1 735241573 HIPUBSMXNPSLGJ-UHFFFAOYSA-N 389.436 5.177 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cc(Cl)cs2)cc1 736465041 PEFXFLNPJKLYRG-FQEVSTJZSA-N 380.900 5.628 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccsc1 739155623 JPSGJFFNYGNVHA-BXKDBHETSA-N 380.416 5.357 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)s1 742650684 BNCLJRQTBHMOAF-NPQIQWPPSA-N 394.327 5.142 30 20 GKED C=C(C)[C@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)OCC 756468587 BUVCMXCTQBDCBM-NHYWBVRUSA-N 399.274 5.019 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)Cc1ccccc1CC#N 761103269 CNAUABAJDGVWBP-MRXNPFEDSA-N 376.481 5.032 30 20 GKED Cc1nc([C@H](C)OC(=O)c2ccccc2OCC#N)oc1-c1ccc(Cl)cc1 763942740 HZDUQZJYEBFCOY-AWEZNQCLSA-N 396.830 5.124 30 20 GKED CC(=O)CCCCCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 772596102 YVMNYVPGUQSCON-NRFANRHFSA-N 396.918 5.864 30 20 GKED CC(C)(C#N)CCOC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 776388818 BJAAGTHEIJNLSD-UHFFFAOYSA-N 379.243 5.277 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cccc(-c2nc(C)co2)c1 782789651 LNCFJGWMTLSINC-UHFFFAOYSA-N 377.444 5.192 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C 789720227 VNFDEMAKXPZCES-QFBILLFUSA-N 386.536 5.123 30 20 GKED COc1ccc(NN=Cc2ccc(C#N)cc2C(F)(F)F)c(C(F)(F)F)c1 793099741 VNTRXLGXWMYMQR-UHFFFAOYSA-N 387.283 5.050 30 20 GKED C[C@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(OCC#N)cc1 797040868 MPLZQLNTTZKZKX-XOBRGWDASA-N 390.405 5.289 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(C3CCCCC3)C2=O)c(C(F)(F)F)c1 811624587 JWJITPFNIHZOQY-DHDCSXOGSA-N 396.459 5.111 30 20 GKED CON(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 812935648 GDQXLPAEHPDGJD-AWEZNQCLSA-N 389.908 5.330 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813213899 QTNOKHZKTARPHP-QAPCUYQASA-N 396.796 5.034 30 20 GKED Cc1c(NN=C[C@]2(C(C)(C)C)CCN(Cc3ccccc3)C2)cccc1C(=O)O 857210950 JFQXSJXPCMYUFW-XMMPIXPASA-N 393.531 5.029 30 20 GKED Cc1cncc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 878676182 OSXAVFNSFAVJBM-QFBILLFUSA-N 380.517 5.153 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc(-c2ccco2)nc2ccccc12 914502747 YTAXZIRJCBZUDN-UHFFFAOYSA-N 395.462 5.417 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)/C=C/c1nc2ccccc2s1 914522342 UAUDWTXBXOZBON-VAWYXSNFSA-N 385.448 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1 915085977 GOALZLSKXOMILV-VWLOTQADSA-N 376.459 5.676 30 20 GKED Clc1ccc(OCc2cccnc2)c(C=NNc2nccc3sccc23)c1 915980103 NOWYNRBPCCUKOE-UHFFFAOYSA-N 394.887 5.370 30 20 GKED Cc1cccc(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)c1 916153507 RYOBPYWYLTZMPQ-SEYXRHQNSA-N 379.463 5.198 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc([N+](=O)[O-])cc1 916312218 OMFVBRDYLFMSML-UHFFFAOYSA-N 389.440 5.103 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NNc1ccc(Cl)c(Cl)c1 1776032632 FSYCXLDAGNICCK-UHFFFAOYSA-N 395.286 5.268 30 20 GKED CCc1oc2ccccc2c1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776999516 VMUNUPIIGCLYIO-KHPPLWFESA-N 378.424 5.377 30 20 GKED O=c1c2ccccc2n(C/C(O)=N/c2cccc3ccccc23)c2ccccc12 11246804 GYFNLFCGKLTAGA-UHFFFAOYSA-N 378.431 5.596 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)s1)=C(/S)Nc1ccccc1F 22726998 OYROGMZSIGOWNF-UHFFFAOYSA-O 399.536 5.096 30 20 GKED N#C[C@H](C(=O)[C@H](Oc1cccc(Cl)c1Cl)c1ccccc1)c1ccccn1 106983730 NNVGZNYAFHOBPC-YCRPNKLZSA-N 397.261 5.385 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)s1 120019382 GERVHEOGRJKLMN-LBPRGKRZSA-N 388.901 5.159 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCCCC[C@@H]1c1ccco1 121206440 VHPKOAOWZIIFQY-IEBWSBKVSA-N 397.544 5.230 30 20 GKED CN(C)c1ccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(C(F)(F)F)c1 123465222 YOLTWOUJWJUZCQ-UHFFFAOYSA-N 394.290 5.182 30 20 GKED C[C@H](Oc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 134304840 YOBMWYPECNUIFV-VIFPVBQESA-N 378.190 5.194 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc(Cl)ccc2Cl)ccc1OC 154691282 FBEPZOQVEZKYNY-CJNGLKHVSA-N 393.314 5.534 30 20 GKED N#C[C@@H](C(=O)/C=C/c1nc2ccccc2s1)c1nc(-c2ccccc2)cs1 154804155 ZZEAEDOSCRVOLI-NKSUMMKUSA-N 387.489 5.309 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)Nc3cccc4ccccc34)n2)cc1 155729924 PAVLGLNQHSRXGI-LJQANCHMSA-N 394.459 5.081 30 20 GKED CCO[C@@H](C)c1nc(CN(C)Cc2ccc(-c3ccccc3C#N)cc2)cs1 173662108 FPJRIMAUMHPHHS-KRWDZBQOSA-N 391.540 5.411 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 182122454 ATANQZSXQKUGCT-KGLIPLIRSA-N 376.378 5.129 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)c1nc2ccccc2o1 182308059 TYIVJJJWHJXKJC-OAHLLOKOSA-N 376.485 5.049 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 182941243 OCEIOLYEJSKUEW-IBGZPJMESA-N 396.475 5.066 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccnc(C#N)c2)cc1Cl)c1ccccc1 193130959 QFWQZCYGZCJCAI-AWEZNQCLSA-N 376.847 5.032 30 20 GKED N#CCCCCNCc1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 237814840 MTRAFINXYVXDQT-UHFFFAOYSA-N 378.907 5.035 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 303236593 ZSISRPYKVNBRGV-INIZCTEOSA-N 397.906 5.445 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](C)c1cccc(N2CCCC2)c1 328924049 VERFFIWZMQMCAZ-CRAIPNDOSA-N 399.560 5.012 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1ccccc1C(F)(F)F 425420376 SAGVBBRNLFOTHK-UONOGXRCSA-N 375.394 5.041 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1cncc(C(F)(F)F)c1 425534531 MERBWCAMFYGHFN-LBPRGKRZSA-N 387.327 5.033 30 20 GKED CCN(C(=O)c1cccc(SCC#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 429958413 OLQCXQLOYWFVMA-AWEZNQCLSA-N 392.446 5.544 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2OC3)s1 430602235 KTSUWOZSDDMKBF-CQSZACIVSA-N 394.521 5.552 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(CC#N)cc2)ccc1Br 431583867 UEQYAOODFTYIEP-IBGZPJMESA-N 398.304 5.193 30 20 GKED N#CCCC[C@H](NCC(=O)Nc1ccccc1Cc1ccccc1)c1ccccc1 433010586 CPYGCLQNKHJBNZ-DEOSSOPVSA-N 397.522 5.241 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)C2(c3cccc(C#N)c3)CC2)cc1 435078971 VOLDLTMHYWECTH-GOSISDBHSA-N 396.490 5.143 30 20 GKED CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 436333858 KGYWCDOXFBDBBS-MOXGXCLJSA-N 395.528 5.157 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](Cc4ccccc4)C3)cc2)c1 438066507 QWEZENLCXITHRH-OAQYLSRUSA-N 397.478 5.447 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438650580 RUVZUVOGPBQMST-UHFFFAOYSA-N 399.466 5.159 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)N[C@H](CCC#N)c3ccccc3)oc12 438849029 RBNYNJHLOLQXHJ-QFBILLFUSA-N 391.471 5.237 30 20 GKED N#CC1CCC(CNC(=O)c2ccc(-c3nc4ccccc4s3)s2)CC1 441149054 AXKXBUSEDRAQQK-UHFFFAOYSA-N 381.526 5.085 30 20 GKED C=CCOCCCC(=O)N(Cc1cccs1)c1ccc(Br)cc1 443879274 RUZBZEMEAZQPFQ-UHFFFAOYSA-N 394.334 5.027 30 20 GKED Cc1onc(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)c1C#N 447628052 FQZYFFVOMLDUKB-UHFFFAOYSA-N 386.238 5.010 30 20 GKED N#Cc1c(NC(=O)CCc2cncc3ccccc23)sc2c1CCCCC2 462403714 ZVVLBEGSFJYMLZ-UHFFFAOYSA-N 375.497 5.008 30 20 GKED CO[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 466172754 DKRALPPYFBVSOX-SESVDKBCSA-N 397.906 5.075 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC(C)(C)c2nc(C(F)(F)F)cs2)cc1 467589136 KWAMFISECJIKDZ-UHFFFAOYSA-N 396.438 5.020 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](c2ccc(C)cc2)c2ccccn2)c1 471279911 OURBMHJQEWFZIE-HSZRJFAPSA-N 387.483 5.256 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 473242622 RTEACPRBSKKKKT-NXEZZACHSA-N 386.311 5.107 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 474898243 GSUREOSQSMZGIL-JOCHJYFZSA-N 395.462 5.163 30 20 GKED O=C(N[C@H](CCc1ccccc1)C(F)(F)F)c1ccc(F)cc1C(F)(F)F 479701650 DDAFPZGOIRXDKB-OAHLLOKOSA-N 393.302 5.138 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1 485756959 GYOXEPFCBBFMBN-UHFFFAOYSA-N 376.481 5.749 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)C2)cc1 486640347 NMUFYDKYCNTIRR-XMSQKQJNSA-N 397.478 5.072 30 20 GKED C=CCn1c(SCc2cc(C)nc3ccccc23)nnc1-c1cccs1 489427275 OPFCETPKHZINKC-UHFFFAOYSA-N 378.526 5.342 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1sc(-c2ccccc2)nc1-c1ccccc1 497344129 BNUZUMYTJKQNFP-UHFFFAOYSA-N 375.497 5.099 30 20 GKED CCN(C(=O)c1cc(F)c(F)c(F)c1F)[C@H](C)c1cccc(C(F)(F)F)c1 499119880 WSTGMHMHNJOGPZ-SECBINFHSA-N 393.302 5.485 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 505299681 YYKDFOMQJPWHAX-FOIQADDNSA-N 385.508 5.596 30 20 GKED C=C(C)CCc1noc(/C=C/c2csc(N(C(C)=O)c3ccccc3F)n2)n1 508644064 STIHCGCCIAIMMV-PKNBQFBNSA-N 398.463 5.029 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(C)C[C@@H](C)C#N)cc2Cl)cc1 509226767 LVUONPDQXUUBJS-ZDUSSCGKSA-N 389.908 5.123 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1C(C)C 517455432 IDKNCYUZXZVDSM-SJLPKXTDSA-N 396.556 5.776 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(Cl)c(Cl)c1 517456133 GCUWRJOHTZTOJZ-CYBMUJFWSA-N 393.339 5.816 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc(Cl)c1 517653980 QETFYOVOXPYIOM-UHFFFAOYSA-N 377.831 5.066 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 518170134 ZXMJNIGSMIZUFC-DLBZAZTESA-N 397.544 5.608 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1 518659603 XKGWFEFZMATCBM-DLBZAZTESA-N 396.556 5.642 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccccc1Cl 518740260 ROJCVICHIXXLMH-HNNXBMFYSA-N 388.920 5.532 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(F)c(C(F)(F)F)c1 519099112 XTQDTNBBWYMTNI-UHFFFAOYSA-N 390.361 5.697 30 20 GKED CCC[C@@H](C)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 519129623 GBKCGSMBLHNQLJ-IERDGZPVSA-N 378.476 5.178 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc(C)c1OC(F)F 520924120 JNDBIUKPEQHCCY-CQSZACIVSA-N 390.455 5.551 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(Cc3ccco3)c3ccccc3)cc2)nc1 521087058 KWVVJWHHLOWNCM-UHFFFAOYSA-N 395.418 5.186 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 521251915 SKUKTXHKWZGOOT-UHFFFAOYSA-N 392.471 5.418 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Oc1ccccc1 521734565 QVRIHZMKVUAIPE-KRWDZBQOSA-N 388.492 5.983 30 20 GKED COc1ccc(CN[C@@H]2CCCC[C@@H]2c2ccccc2)cc1OCCCC#N 521830575 KSSLDACUTIEGNW-FGZHOGPDSA-N 378.516 5.194 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2cccc(COc3cccc(C#N)c3)c2)C1 522312519 DAABGBYICKVDBG-HSZRJFAPSA-N 396.490 5.075 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(OC2CCCCC2)c1 523086153 MWRHPCUKKQFTAI-QGZVFWFLSA-N 394.540 5.902 30 20 GKED COc1ccc(C[C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccc(OC)cc2)cc1 525248040 YGQYAHGFRFWEIE-AVRWGWEMSA-N 386.495 5.210 30 20 GKED CC(C)(C#N)c1ccccc1CNC(c1ccc(F)cc1)c1ccc(F)cc1 532263250 UEBXUTOHSVWNPR-UHFFFAOYSA-N 376.450 5.645 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)nn1C1CCCCC1 537381936 AMBSYVQRLSMNSS-SFHVURJKSA-N 390.512 5.310 30 20 GKED COc1cccc(CN(C)C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541158034 SNZOISSECFSQMW-GOSISDBHSA-N 399.494 5.136 30 20 GKED CCC(=O)c1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 542131200 RNZWCSTUROIRNE-AWEZNQCLSA-N 396.418 5.171 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 543304818 PMDZUJPEFFWKCP-IEBWSBKVSA-N 379.529 5.411 30 20 GKED C=C(C)[C@H](Cc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1)OCC 544979345 YWWMYWLOFPNQRE-ZDUSSCGKSA-N 394.315 5.298 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1 553071717 WSCDSULOLANKQC-MISYRCLQSA-N 393.556 5.786 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 555039137 YAJZMQBQTQZGFC-UHFFFAOYSA-N 393.437 5.555 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2occc2C(C)C)cc1 555794359 JMCKESOUCFWWOG-UHFFFAOYSA-N 376.412 5.328 30 20 GKED Cc1cccc(COc2ccc(NC(=O)NCC(C)(C)CCC#N)c(C)c2)c1 558334983 JDGFDZNANJSISG-UHFFFAOYSA-N 379.504 5.334 30 20 GKED N#CCCC1CCN(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 563077392 DKURZQQSWJMOBL-UHFFFAOYSA-N 393.331 5.272 30 20 GKED Fc1cccc([C@@H](NCc2ccccc2OCC(F)(F)F)C(F)(F)F)c1F 577417066 ZDRRVKRWJSJYTD-OAHLLOKOSA-N 399.281 5.299 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1cccc(O)c1)CC1CC1 584689838 IFLOWWINGNQFNK-UHFFFAOYSA-N 378.516 5.688 30 20 GKED COc1ccc(-c2nc3ccccc3[nH]2)cc1NC(=O)CC1(C#N)CCCCC1 597621960 CVCMFKRHTSGNGT-UHFFFAOYSA-N 388.471 5.041 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)C(F)(F)F 599431866 RMQZMJYFDQFUEO-AWEZNQCLSA-N 378.369 5.128 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@H](Nc4ccccc4)C3)c2)cc1 609209075 WJLLZMAGSQLFOS-NRFANRHFSA-N 398.466 5.069 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccccc2)n1 609427627 UMVYGQBEWWXQKE-AWEZNQCLSA-N 379.510 5.457 30 20 GKED CCOc1ccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c(C)c1 609642764 LGKAYBORNVTAMC-UHFFFAOYSA-N 386.451 5.097 30 20 GKED Cc1cc(C(=O)N[C@@H](C)CC#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 610165500 RXQZRLPOEAWKHE-KBPBESRZSA-N 390.314 5.507 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccccc1C(F)(F)F 610172662 UGTOHIMFTOAEOC-AWEZNQCLSA-N 390.405 5.497 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2C(F)(F)C1 610922697 BYLWGUOLBAQUCV-CQSZACIVSA-N 387.455 5.220 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1cc2ccccc2[nH]1 610925827 FDKZGHIAKHAMKX-UHFFFAOYSA-N 397.503 5.163 30 20 GKED CC(C)CCn1ncc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1C(C)C 617172128 CJAVLBZUJMMQHI-UHFFFAOYSA-N 393.318 5.483 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(COCc2ccccc2)cc1 618758071 LBYBNCKCACMJSD-XMMPIXPASA-N 397.478 5.084 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618844926 AKJMUYGZPFCVPU-HXPMCKFVSA-N 388.298 5.255 30 20 GKED C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622879343 MDKIQXHUCXTETH-SKDRFNHKSA-N 389.286 5.144 30 20 GKED Cn1cc2c(n1)CCC[C@@H]2Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647323505 RPVFMKLJVBRIAU-ZDUSSCGKSA-N 395.322 5.199 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)sc2cccc(F)c12 674447905 ZNDOOUBKQICLHD-DTORHVGOSA-N 399.331 5.162 30 20 GKED C=CCC[C@H](NC(=O)NCc1ccc(Cl)cn1)c1ccc(C(F)(F)F)cc1 678845617 GDWZMXRCMXOBQF-KRWDZBQOSA-N 397.828 5.261 30 20 GKED CCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](C)c1cc2ccccc2o1 726477870 ZAJCKSNZEBVJFK-CQSZACIVSA-N 397.931 6.128 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C\c1nc(-c3ccccc3)cs1)CC2 727974499 LCKRIJDAIUEUHU-PTNGSMBKSA-N 393.464 5.101 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1ccc(Cl)s1 730951718 OJWATHPDRBAMJC-ZZXKWVIFSA-N 388.828 5.168 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2Cl)o1)c1ccc(C(F)(F)F)nc1O 731563438 QGEVPODCWPVTCQ-YVMONPNESA-N 393.748 5.616 30 20 GKED C=CC[C@@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)c1ccncc1 734510090 QEVYOKZGBCZFEI-XMMPIXPASA-N 398.510 5.024 30 20 GKED CCOc1ccc(C=Nc2cccc(C[S@@](=O)C3CCCCC3)c2)c(O)c1 734979903 VIQLUYIMLYAVLN-HHHXNRCGSA-N 385.529 5.123 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 739143925 TYGFTYVIONHWMB-DOMZBBRYSA-N 388.414 5.685 30 20 GKED N#C[C@@H](C(=O)CCCC1CCCC1)C(=O)Nc1ccc(SC(F)F)cc1 744026560 YCDOQQDVBQPHHK-INIZCTEOSA-N 380.460 5.009 30 20 GKED N#C[C@H](C(=O)CCCC1CCCC1)C(=O)Nc1ccc(SC(F)F)cc1 744026561 YCDOQQDVBQPHHK-MRXNPFEDSA-N 380.460 5.009 30 20 GKED COc1ccc(CCC(C)=NOCc2coc(-c3ccc(Cl)cc3)n2)cc1 744179354 RWZKMNWDRGPJBH-UHFFFAOYSA-N 384.863 5.529 30 20 GKED C=C(C)CCOC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 744303620 LKSMPTAXADKEAY-UHFFFAOYSA-N 381.856 5.224 30 20 GKED N#Cc1csc(/C=C2/SC(=S)N(c3cccc4ccccc34)C2=O)c1 748660356 FYRLIZVDKRJDKW-RQZCQDPDSA-N 378.503 5.179 30 20 GKED Cc1cccc(C(NC(=O)Nc2cccc(OCC#N)c2)c2cccc(C)c2)c1 752645426 KYLYTBWNMMJNJJ-UHFFFAOYSA-N 385.467 5.117 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3cnc(-c4ccccn4)s3)c(C)c2c1 753142961 BWEXEPZCAOVOOX-FPLPWBNLSA-N 376.437 5.164 30 20 GKED CCCCCCCCNC(=O)N1CCC(C(=O)c2c(F)cc(F)cc2F)CC1 754866566 VWAXQAHJTAKCAX-UHFFFAOYSA-N 398.469 5.069 30 20 GKED C#CC[C@H](NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 757059424 VQFQZJFAHQTEHT-PZJWPPBQSA-N 378.472 5.040 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c(C)noc1C 757781645 RGKNCNJUEMDMPS-NHCUHLMSSA-N 388.471 5.220 30 20 GKED C/C(=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc([N+](=O)[O-])cc1 783975962 XRFBNCZFIOYYRL-PLFFATQSSA-N 381.457 5.031 30 20 GKED Cc1noc(C2CC2)c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784833075 DTXDDJHDJIUEQR-CQSZACIVSA-N 383.860 5.127 30 20 GKED C[C@H](OC(=O)CCc1ccccc1NC(=O)OC(C)(C)C)c1ccc(C#N)cc1 790747024 RMSCPHPBTXKSAR-INIZCTEOSA-N 394.471 5.142 30 20 GKED C=CCC1(C(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)CCC1 791558311 JISLZNMRPDHKLH-UHFFFAOYSA-N 379.481 5.106 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1nccc2ccccc12 792097606 XXVYJKWMLAISHC-SQUSKLHYSA-N 383.838 5.326 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ccc(OC(F)(F)F)cc2)s1 797572420 ZJWCEKMLDQSEMS-AWEZNQCLSA-N 396.434 5.148 30 20 GKED C#CCCCCC(=O)N(Cc1ccco1)Cc1ccc(C)cc1Br 799455768 FMQXQUPGERCTEX-UHFFFAOYSA-N 388.305 5.073 30 20 GKED C#CC[C@@H](Cc1ccccc1)NC(=O)c1ccccc1SCc1cccs1 804456766 IQCMEFSDYSGNKT-IBGZPJMESA-N 391.561 5.405 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccncc1 812047561 HXEOJKBMGYVORF-IEBWSBKVSA-N 390.314 5.456 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2F)o1)c1nc(C2CC2)cs1 842939356 PHBWVEXVRYLMGB-INIZCTEOSA-N 380.444 5.229 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1sc2nc(C)nc(C)c2c1C 863950532 AIHJWCNSRSBEQL-UHFFFAOYSA-N 378.423 5.471 30 20 GKED C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)c1nc(-c2ccccc2Cl)no1 904566413 CZQYPUZTVNOPSO-ZDUSSCGKSA-N 384.263 5.098 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(C(C)C)nc2C)cc1 916951437 YIWXSUNUSIHXJP-CXAGYDPISA-N 383.517 5.050 30 20 GKED CC(C)Oc1ccccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 918034657 SYEVJEPAFIKBBK-QHCPKHFHSA-N 399.494 5.451 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(Oc2ccccc2)cc1 920106414 YKNZPNQBLLDKJJ-NRFANRHFSA-N 394.430 5.474 30 20 GKED O=C(O)c1ccc2scc(C=NNc3ncc(C(F)(F)F)cc3Cl)c2c1 1776019016 UZSJLTNILNFMCN-UHFFFAOYSA-N 399.781 5.113 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2cccc(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269211 HNYSTOGCGQTJCI-KTKRTIGZSA-N 376.496 5.802 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)c1 1776341493 UGGQRELRWLCXJV-KAMYIIQDSA-N 398.502 6.075 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc2ccccc2c1F 1776355534 YHMXPASQIHYFPL-PKNBQFBNSA-N 378.399 5.360 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1776665795 CYHBJLKVZLKOAE-MYMXKZGLSA-N 398.458 5.350 30 20 GKED CCCCCCCCOCCCNc1c(C(=O)O)cnc2c(OC)cccc12 1776785399 RCHHBEMOILJTJC-UHFFFAOYSA-N 388.508 5.121 30 20 GKED CCCCCCCOc1cccc(/C=C/c2ncc([N+](=O)[O-])cc2C(=O)O)c1 1776789223 XGBKFEHSBCBWJU-ZHACJKMWSA-N 384.432 5.208 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776805942 GZMHIOAXPHUBFO-RAXLEYEMSA-N 390.435 5.589 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)CS2 1777371046 CZPNRVPNOUEZNW-GDNBJRDFSA-N 392.432 5.025 30 20 GKED CSc1ccc(NC(=O)[C@@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)cc1 21372864 UOLXPIKSQLWMJO-MRXNPFEDSA-N 388.492 5.353 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 25840911 ZDTGPAXDWPDERB-UHFFFAOYSA-N 397.503 5.763 30 20 GKED Cc1noc(C(C)C)c1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 41548620 XKBJUNGRCIUEMF-LLVKDONJSA-N 393.390 5.225 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cnc(-c3ccccc3Cl)s2)c1 50333659 LALFTFXFIBXLIS-UHFFFAOYSA-N 397.887 5.398 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 58426042 IEJRXKXKGAPGST-UHFFFAOYSA-N 395.462 5.374 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(Cl)s3)n2)cc1 66544650 GOMKYGZPXDLRKK-OAHLLOKOSA-N 397.912 5.206 30 20 GKED CCO[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 67581830 ANVRODYTCKFBBY-UYAOXDASSA-N 397.906 5.028 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 109328703 BVUOOZAVESKKQU-UHFFFAOYSA-N 390.552 5.227 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(CSc2ccccc2)cc1 120188882 JLYIICBFFFNVJA-UHFFFAOYSA-N 392.455 5.273 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)CCCCCC2 151729150 JXKKSZWVEFTOOJ-UHFFFAOYSA-N 390.940 5.041 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC(C(F)(F)F)CC2)cc1 176655252 RXLKIUAUSVABLZ-UHFFFAOYSA-N 388.389 5.074 30 20 GKED Cc1nc(-c2cccnc2)sc1[C@H](C)Nc1cccc(OCCCC#N)c1 179820940 SYVLSVGRPOPZIW-HNNXBMFYSA-N 378.501 5.369 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3ccc(OCC#N)cc3)s2)cc1 180539163 ADWDYGRHTVEQHI-IAGOWNOFSA-N 391.540 5.741 30 20 GKED CCC[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 181767540 RABGICYFTNAGHZ-MJGOQNOKSA-N 381.545 5.150 30 20 GKED COc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1CN1CCCCC1 183370550 QMHXHBLKOQAFMJ-HYBUGGRVSA-N 391.559 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)CC(C)C)c(C)c1 189912093 NGSIZDCCVJFXDE-UHFFFAOYSA-N 392.543 6.084 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2cc(Cl)ccc2C1 192216531 JTEGQKKOBCQBBD-CQSZACIVSA-N 385.920 5.182 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H]1OCCc2sccc21 294196743 VHSPYJXQFHKDRW-TYILLQQXSA-N 386.542 5.031 30 20 GKED C=CCCO[C@H](C)C(=O)N(c1ccc(C(C)C)cc1)c1nc2ccccc2s1 302973501 DOSTYVBUZZOMKA-QGZVFWFLSA-N 394.540 6.066 30 20 GKED Cc1cccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c1Br 323156528 PJYQTKSOZMLNDU-SNVBAGLBSA-N 389.318 5.068 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 328753285 RWKNLAZSRZAOPO-JKSUJKDBSA-N 396.318 5.086 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1cccc(N2CCC(C)CC2)c1 328827444 IKJHLMAMSVQVOK-QGZVFWFLSA-N 399.560 5.218 30 20 GKED CSCc1ccc(N/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)cc1 329408548 ZWLSVFJTEAVMHR-LJQANCHMSA-N 384.549 5.265 30 20 GKED Cc1nc(-c2cccc(NC(=O)N[C@H]3CCCc4cc(C#N)ccc43)c2)oc1C 416787145 ZAPAGPPONHVPNX-NRFANRHFSA-N 386.455 5.029 30 20 GKED Cc1cccc2nc(CCC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)[nH]c12 426287702 GBRVYBCLIBLPOI-UHFFFAOYSA-N 396.450 5.107 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 429823074 TVLMLESJYWMTJC-IBGZPJMESA-N 398.940 5.537 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(-c3cscn3)no2)cc1Cl 432688320 ZPNNKMZVXPLLOB-UHFFFAOYSA-N 380.816 5.177 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(C(F)(F)F)ccc1F)c1ccccc1 432873136 QDXWHWNZBKTPJY-MRXNPFEDSA-N 379.357 5.401 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N1CCCC(C)(C)[C@H]1C#N 434010087 AZLCSQPNTUYMNZ-OAHLLOKOSA-N 392.286 5.111 30 20 GKED N#Cc1ccnc(NC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)c1 436007043 MIZORMBYAHBDMI-IBGZPJMESA-N 379.872 5.079 30 20 GKED CC(C)n1nc(-c2ccccc2)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439398143 SDYIFAWGXCDJRH-FQEVSTJZSA-N 387.487 5.298 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(c2cccc(Br)c2)CC1 439442823 SGGMSJAPPONVPB-UHFFFAOYSA-N 398.304 5.041 30 20 GKED CCOc1ccc(CN(C(=O)N[C@@H](CCC#N)c2ccccc2)C(C)C)cc1 440259375 UAARODBESNRCFF-QFIPXVFZSA-N 379.504 5.050 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)NCC2CCC(C#N)CC2)c1 442477567 VQBNZQYDRNZLQF-UHFFFAOYSA-N 377.488 5.026 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CCCC1(C)C 444923125 GEELGHJRIVQNOU-IBGZPJMESA-N 386.536 5.169 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1 462148209 ZHJLKEYBZJJPSD-ROUUACIJSA-N 384.479 5.215 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1 463092325 HCHJICMVTOULGK-KRWDZBQOSA-N 386.451 5.491 30 20 GKED Cc1c(Br)cccc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 463771346 WSHXITBSDFCZIG-CQSZACIVSA-N 398.087 5.059 30 20 GKED COc1cc(CNC(=O)N(Cc2ccccc2)[C@@H](C)c2ccccc2)ccc1C#N 464387856 GXVNKWZBOIBSET-IBGZPJMESA-N 399.494 5.040 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ncc(-c4cccs4)o3)c2)c1 467269401 SBRGVNHWBCVIQA-UHFFFAOYSA-N 387.464 5.466 30 20 GKED Cc1nc2cc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)ccc2o1 470835072 XOJKRHAUSRDUKF-UHFFFAOYSA-N 397.434 5.034 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc2[nH]ccc2c1 472179912 NHJKTJJMXYHEGU-MRXNPFEDSA-N 392.528 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(OC(F)F)cc1 475571102 UNOXKYCVOGBXRU-HNNXBMFYSA-N 388.458 6.023 30 20 GKED Cc1ccc(CN(C(=O)C[C@H](CC#N)c2ccccc2)c2ccc(F)cc2)o1 475771602 LUMBVTVMFIEVIE-IBGZPJMESA-N 376.431 5.348 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 475928138 SSTOGIIJYSVITI-IBGZPJMESA-N 398.510 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2ccccn2)nc1C 476118449 MGQDLHLSKCZVPM-UHFFFAOYSA-N 377.513 5.618 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(c2ccc(Cl)cc2)CC1)c1ccccc1 477224332 QTVCNJIFFWHXMK-NRFANRHFSA-N 381.907 5.274 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)[C@@H](C)C(F)(F)F 477980097 NTUWIEMASSBZJW-ZDUSSCGKSA-N 378.419 5.122 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1cc2ccccc2o1 486726160 YNLBIQYJXTYHGA-OAHLLOKOSA-N 396.537 5.699 30 20 GKED N#CCCC[C@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccccc1 487482720 GUWPHVFPDJKBOV-DEOSSOPVSA-N 398.506 5.674 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487575139 OLOZUXBHIVUDDL-OXQOHEQNSA-N 388.433 5.435 30 20 GKED N#CCC[C@H](NC(=O)N1CC[C@H](Sc2cccc(Cl)c2)C1)c1ccccc1 489755125 JNEVZVZQCWPJRW-PMACEKPBSA-N 399.947 5.261 30 20 GKED C=CCn1c(S[C@@H](CC)c2ccccc2)nnc1[C@@H]1COc2ccccc2O1 494119287 KFIVVGCZDVWDAR-PMACEKPBSA-N 393.512 5.220 30 20 GKED Cc1ccc2nc(C)c(C(=O)N(Cc3ccco3)c3ccccc3C#N)cc2c1 501020114 SFPKLIDMGWBNJR-UHFFFAOYSA-N 381.435 5.163 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1 505057108 GVMTWFREYZYTBK-OAHLLOKOSA-N 394.450 5.185 30 20 GKED CC1(C#N)CCN(CC(=O)Nc2ccccc2Sc2ccc(Cl)cc2)CC1 506055799 HKYVZBMBVFIYOT-UHFFFAOYSA-N 399.947 5.055 30 20 GKED N#Cc1cc(Cl)ccc1NCc1cccc(NC(=O)c2ccc(F)cc2)c1 511427892 IUIXGHWMOBTVLK-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(F)cc1Cl 516237294 PWZDGONNJBIQKV-UHFFFAOYSA-N 380.806 5.704 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc2ccccc21 517306603 KCRORLNYSCAKQM-INIZCTEOSA-N 391.883 5.445 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)sc1C 517800915 OVWMGICFKMKJMI-KRWDZBQOSA-N 391.521 5.494 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Sc2ccc(F)cc2F)c2ccccc2)cc1 517977891 LVBASJPUECJNOZ-NRFANRHFSA-N 394.446 5.503 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)o1 518308534 CXPJYQWNEPYNHO-DNVCBOLYSA-N 388.492 5.356 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(F)c(F)c1 518370064 BIQXCUFJZFBXLV-UHFFFAOYSA-N 392.405 5.490 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ncc(-c2ccccc2)o1 521727743 ZVGDHDGHTLNZFY-INIZCTEOSA-N 391.496 5.165 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(F)cccc1Cl 524422837 ICTRJVQQJHBICH-UHFFFAOYSA-N 394.833 5.491 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)Cc3cccc(C#N)c3)s2)cc1 531152895 QHQWEIAILMQJRH-QGZVFWFLSA-N 389.524 5.061 30 20 GKED N#C[C@@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1ccc(Cl)c(Cl)c1 542150610 ZFIVEMCDHYACOZ-MBRGGSNBSA-N 393.236 5.433 30 20 GKED C[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543033647 JZHGXAIYYPANJR-PCXSUYPWSA-N 388.536 5.374 30 20 GKED Cc1c(C(=O)N[C@@H](CCC#N)c2ccccc2)oc2c(Br)cccc12 543854310 CXNRVFLDTZVMKF-KRWDZBQOSA-N 397.272 5.279 30 20 GKED N#C[C@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1cccc(C(F)(F)F)c1 544005855 YVEOPPVHGBEEFZ-HGMXIMQMSA-N 392.343 5.145 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1F 551205305 JDGSSGABTDDAQE-KUHUBIRLSA-N 375.285 5.674 30 20 GKED Fc1ccc(C(F)(F)F)c(-c2noc(-c3csc(C(F)(F)F)n3)n2)c1 570854172 RBQNMDWYVMWWCD-UHFFFAOYSA-N 383.248 5.037 30 20 GKED Cc1cc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c(Cl)cc1F 572440615 FAYKIIKFBOKHHX-UHFFFAOYSA-N 384.794 5.084 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)cc2)ccn1 583175133 LCMMMOYUXKRLQB-NHCUHLMSSA-N 389.842 5.141 30 20 GKED N#CCCCCCC(=O)N1CCC[C@@]1(c1c[nH]c2ccccc12)C(F)(F)F 598887906 CSGAFNWPSCHUJJ-LJQANCHMSA-N 377.410 5.022 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCCCc1nc2ccccc2s1 603527297 HZHINRKRHXSENV-UHFFFAOYSA-N 391.540 5.318 30 20 GKED CCOc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c(C)c1 604000126 PCESWSLDZMZCMC-UHFFFAOYSA-N 388.492 5.669 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1ccccc1F 605478989 BXUQXAOFBWCTOA-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C=CCc1cc(CN[C@H](Cc2ccccc2)c2ccccc2F)cc(OC)c1O 607168183 MIYZFRYLXWJBKD-HSZRJFAPSA-N 391.486 5.342 30 20 GKED CCN(C(=O)CCCCCc1ccc(OC)cc1)[C@@H](C)c1ccc(C#N)cc1 608936130 SATKIVUIJTUETR-IBGZPJMESA-N 378.516 5.279 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2cc(F)ccc2[nH]1 609072500 OSCMOWMKEGHSHM-UHFFFAOYSA-N 399.425 5.318 30 20 GKED C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 609079674 GUYUTUJYIPIBPT-HNNXBMFYSA-N 383.879 5.054 30 20 GKED CN(Cc1ccccc1)c1ccccc1NC(=O)c1cc2ccccc2n1CC#N 609167020 LPUWPNIMKZNTMN-UHFFFAOYSA-N 394.478 5.054 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)NCc3ccc(C#N)cc3F)c2)C1 609252233 HNIIKRULGDQCOB-HRAATJIYSA-N 395.478 5.114 30 20 GKED N#Cc1cccc(NC(=O)[C@@H](Sc2cc(F)ccc2F)c2ccccc2)c1 609297376 ALZIDESTNIFVAF-FQEVSTJZSA-N 380.419 5.309 30 20 GKED N#Cc1ccc(NC(=O)CCc2nc3cc(Cl)ccc3s2)cc1Cl 609324083 VCEQIPKEQIYYCG-UHFFFAOYSA-N 376.268 5.046 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1SCCC#N 609375278 BPSMVPNJZOCHBV-IBGZPJMESA-N 382.529 5.612 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1CC(F)(F)F 609430765 WZGIMMRNKZOFOW-ZDUSSCGKSA-N 395.450 5.314 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609730281 YBWQFAACKYLEFJ-CQSZACIVSA-N 396.899 5.899 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C[C@H]3CCOc4ccccc43)cc2)c1 609786435 JZNAQDAUOBBVEW-GOSISDBHSA-N 384.435 5.245 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 610334989 DMWSSOHQXCCWHR-UHFFFAOYSA-N 395.356 5.296 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1cccc(C#N)c1 610360221 TYCCOSFKDDXLOJ-INIZCTEOSA-N 383.476 5.072 30 20 GKED Cc1cncc(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 610754038 YSFPAFDEEKFHBD-UHFFFAOYSA-N 377.831 5.268 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C(F)F)nc1 622284973 XEDFLYCXLQJREN-UHFFFAOYSA-N 384.226 5.309 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](Cn1cccn1)c1ccccc1 682777377 QMUXMKALOKSNQD-QFIPXVFZSA-N 388.515 5.298 30 20 GKED FC(F)c1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 684368021 YTBOXUUIOURUAG-VXGBXAGGSA-N 375.303 5.623 30 20 GKED CCOc1ccccc1C=NOCc1csc(Cc2ccc(Cl)cc2)n1 725791202 KSICUZWZLOYLHX-UHFFFAOYSA-N 386.904 5.337 30 20 GKED CCC(CC)[C@H](NC(=O)NCc1cccc(O[C@H](C#N)CC)c1)c1cccs1 733848020 KDSFBSOMFUPNCS-RXVVDRJESA-N 399.560 5.406 30 20 GKED O=C(/C=C\c1ccc(O)c(Br)c1)c1ccc(SC(F)F)cc1 734981802 UBZLBUGKKSKCNW-XFSBKJJWSA-N 385.229 5.366 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)N[C@H](C)c2cccc3ccccc23)cc1 743462947 NFELFEYACXURQE-UXHICEINSA-N 385.511 5.134 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(Cl)c2)CCCC1)c1nc2ccccc2o1 744039955 UIQAYAMSQWITOJ-KRWDZBQOSA-N 378.859 5.461 30 20 GKED Sc1nnc(-c2cccs2)n1N=Cc1sc2ccccc2c1Cl 744739150 JJBNTLVKTOLUKW-UHFFFAOYSA-N 376.919 5.046 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1 745989983 JBNNCAYOQZWQDM-MDZDMXLPSA-N 381.435 5.043 30 20 GKED CCCn1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cn1 746027073 APVKWQKVOVHMPG-UHFFFAOYSA-N 395.850 5.254 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccc(-c3nnc(C)o3)cc2)s1 746152047 JXMJRSAWNDAVTK-UHFFFAOYSA-N 399.520 5.052 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1O 750915034 BTDKJAIRGXXDSD-RQOWECAXSA-N 390.279 5.335 30 20 GKED C#CC[C@@H](NC(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 757779351 VMYAOCISYRNDGI-JOCHJYFZSA-N 397.478 5.133 30 20 GKED N#CCOc1cc(F)ccc1NC(=S)Nc1ccccc1Oc1ccccc1 760282590 PMDUJKPMFQSZTQ-UHFFFAOYSA-N 393.443 5.329 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cncc4ccccc34)n2)cc1 765591042 QTXVILUIZSXYDY-OAQYLSRUSA-N 397.503 5.476 30 20 GKED Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 769695215 YMDAFCPELSLFRA-OAQYLSRUSA-N 399.450 5.428 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2ccccc2s1 770095846 FEXXMPJGXZBOGN-KXBFYZLASA-N 384.888 5.230 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2[C@@H]3c4ccccc4CC[C@H]32)cc1 772421695 GEPNUFWNSKSQDQ-ZGFBMJKBSA-N 393.490 5.192 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 779094985 GVDIZCQACQNUJK-UHFFFAOYSA-N 385.448 5.219 30 20 GKED CC(C)(C#N)CC(=O)Oc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 781862551 OJFSWRPREBEPCF-UHFFFAOYSA-N 378.472 5.082 30 20 GKED FC(F)(F)c1nc(NN=C2CCC[C@@H](C(F)(F)F)C2)c2ccccc2n1 783515359 ZQRFDVQXQCUIAE-SECBINFHSA-N 376.304 5.169 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C 789890603 SHFXQSLBVXKWKU-INIZCTEOSA-N 396.478 5.026 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2nc(Cl)cs2)cc1Cl 789897798 WKXGHFZSXRQJOJ-CQSZACIVSA-N 388.279 5.358 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3csc(C(F)(F)F)n3)cc2)cc1 790814530 IEJQMUZMIMGDGM-UHFFFAOYSA-N 390.342 5.045 30 20 GKED Cc1cc(CCC(=O)[C@@H](C#N)c2nccc3ccccc23)ccc1Br 792093075 HOXBUBXWJXBZIO-GOSISDBHSA-N 393.284 5.115 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 796461465 IGHGYZRCESQRSY-UHFFFAOYSA-N 386.517 5.036 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc1Cl 797567981 NBPJRIASCAFUPI-OCCSQVGLSA-N 376.909 5.046 30 20 GKED CC(C)(CCC#N)COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 798877444 GTNCEQLPERSEDD-UHFFFAOYSA-N 383.300 5.604 30 20 GKED CC(C)(CCC#N)COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 798879041 ZGXZXLBUFJUQPB-UHFFFAOYSA-N 396.434 5.245 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)[C@H](F)c1ccc(C(F)(F)F)cc1 801701032 YFMFJCRXMWCFGE-IUDNXUCKSA-N 397.334 5.488 30 20 GKED COc1ccc(COCc2cccc(Nc3nc(Cl)c(C#N)s3)c2)cc1 804381075 GXEPDIRHRHBGCL-UHFFFAOYSA-N 385.876 5.137 30 20 GKED CC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C[C@@H]2C[C@H]2C1 815912057 XVBZQYCAWZLADU-MJVIPROJSA-N 391.323 5.729 30 20 GKED N#CC1(CCCOC(=O)c2cc3cc(C(F)(F)F)ccc3s2)CCOCC1 850284636 KCFVDXYGDVDELT-UHFFFAOYSA-N 397.418 5.177 30 20 GKED Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2-c2ccccc2C#N)c1C 863939812 NNYWTFOGNRTWQL-SFHVURJKSA-N 398.462 5.026 30 20 GKED COc1ccc(N=Cc2cc3ccccc3nc2O)cc1NC(=O)OC(C)(C)C 915113218 RLBIPXCQVXQVLX-UHFFFAOYSA-N 393.443 5.047 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3cccc(OCC#N)c3)c3ccccc3n2)cc1 916410108 YHBQOZXXRFSUBZ-UHFFFAOYSA-N 393.446 5.365 30 20 GKED COc1ccc(/C=C\C(=O)c2cccs2)cc1OCc1ccc([N+](=O)[O-])cc1 917030869 KVJUPUBWDFOZJG-POHAHGRESA-N 395.436 5.140 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(=O)/C=C/c3ccc(O)c(Cl)c3)c12 921266345 XQDKEJLNPMUJKO-PKNBQFBNSA-N 391.858 5.039 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccccc3Cl)s2)ccc1Cl 1776033297 AHPAFWRXTXHBAF-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3cccc4c3CCCC4)s2)c1 1776036556 YEYOCCIMMSYXNT-UHFFFAOYSA-N 376.481 5.438 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776144264 KYRXTMMHVVENBF-VOTSOKGWSA-N 383.252 5.127 30 20 GKED CC(C)(C#N)c1ncc(/C=C/c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)s1 1776230595 QWUAAPYWOSXHRI-BQYQJAHWSA-N 399.472 5.075 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1F 1777403231 ZZEAWASRGBKQFV-UUILKARUSA-N 392.451 5.809 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)s1 1777462898 JOCIIGJMLDXHOA-HJWRWDBZSA-N 383.856 5.366 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\COc4c(F)ccc(F)c4C3=O)s2)c1 1777684277 CFVRCLLHLZLXTR-UKTHLTGXSA-N 398.386 5.050 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1ccsc1)C(=O)c1ccccc1 7912928 RGMGKXXTCJIFCA-RCCKNPSSSA-N 389.520 5.778 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 31266606 QVBWPLVKELSPLT-UHFFFAOYSA-N 387.439 5.148 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 47052232 WTDDSRRFYGNTEU-CHWSQXEVSA-N 376.287 5.329 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1COc1ccccc1 56748292 ZLQRYTIOQQSTMA-UHFFFAOYSA-N 378.497 5.547 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cn(Cc2ccccc2)nc1-c1ccccc1 58287790 QYGFBJINAAGEKR-UHFFFAOYSA-N 392.462 5.031 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccccc2C(F)(F)F)c1 98094314 HCWPEYJODOISOC-UHFFFAOYSA-N 396.368 5.408 30 20 GKED C=C1CCN(C(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)CC1 111175428 IJVHLQODSJJTMD-UHFFFAOYSA-N 389.282 5.038 30 20 GKED Cc1nc(-c2ccccc2)ncc1C(=O)Nc1ccccc1S[C@H](C)CC#N 121320445 VQYQEPVHQMBUHH-OAHLLOKOSA-N 388.496 5.099 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 134787695 OZCUFIZUJLVLMK-QGZVFWFLSA-N 377.513 5.182 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)n1 153550460 CFMXZRQRYJTEKW-GRFABLRMSA-N 398.837 5.742 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(-c2cccs2)n1-c1ccc(Cl)cc1 163654730 BHWZMJHPSHHZKP-CYBMUJFWSA-N 399.932 5.185 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2ncc(-c3ccccc3)o2)n1 177759993 GCXPDSVXHOGUNT-MRXNPFEDSA-N 379.485 5.121 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@@H]3/C=C/c3cccs3)o2)cc1 181958350 AMXFFQVYALGMJV-TZZQJPOUSA-N 390.512 5.128 30 20 GKED C=CCN(C(=O)CCc1ncc(C(C)(C)C)o1)c1nc(-c2ccccc2)cs1 187544598 DFAUIPSDOBAQON-UHFFFAOYSA-N 395.528 5.247 30 20 GKED C[C@@H](C#N)Oc1ccc(CNC2CCN(c3ccc(C(C)(C)C)cc3)CC2)cc1 237484495 KETHJVXSRAOTHH-IBGZPJMESA-N 391.559 5.034 30 20 GKED Cc1nc(CN(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)nc2ccccc12 303288669 LYVMWRPYZUSWKQ-UHFFFAOYSA-N 396.469 5.151 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 303429283 FJNNXHQZGKYDPY-VQTJNVASSA-N 386.417 5.119 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](c1ccc(F)cc1)C1CCC1 328808063 LSPAEFBFJNYMBQ-SJLPKXTDSA-N 388.508 5.331 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccc2ccc(Cl)cc2n1 329173020 LFJOUKISPVKUHV-CYBMUJFWSA-N 387.892 5.183 30 20 GKED COc1ccc(N=C(O)C2(/N=C(/O)[C@H]3CC34CCCC4)CCCC2)cc1OC 329969309 UKQGMGKBPBPCOX-MRXNPFEDSA-N 386.492 5.141 30 20 GKED OC(=Nc1nc2ccccc2n1C1CCCC1)C1CCC(/N=C(/O)C2CC2)CC1 330002614 BDWDXPIWBQYBRS-UHFFFAOYSA-N 394.519 5.665 30 20 GKED OC(=Nc1cccc(N2CCCCCC2)c1)C1CCC(/N=C(/O)C2CC2)CC1 330021708 YHHXQHYPRKCZIS-UHFFFAOYSA-N 383.536 5.580 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccnc3)cc2)c1 365161646 XAJNYLRRZJDQER-QFIPXVFZSA-N 384.439 5.115 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21 416823064 XVZGDEBQOSPKLR-DNVCBOLYSA-N 390.512 5.152 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 425639987 OVDSAXDAVSEETB-FZKQIMNGSA-N 385.920 5.151 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)c1 429834213 YHJHFOHECDQXPV-HSZRJFAPSA-N 398.487 5.568 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@H]1c1ccncc1 432799148 AKJIYZQNFKMYET-QFIPXVFZSA-N 398.466 5.361 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(Cl)c(Cl)cn3)cc2)cc1 443965904 OTSVNHHVEKBFIQ-UHFFFAOYSA-N 398.249 5.499 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Oc3ccccc3)nc2)c2ccccc21 444021506 OADJRGMLLFRBAS-UHFFFAOYSA-N 396.450 5.385 30 20 GKED Cc1cnc(C(C)(C)NCCC(C#N)(c2ccccc2)c2ccccc2)s1 444670269 GJJNRLXHHDQNJD-UHFFFAOYSA-N 375.541 5.176 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)CCCC1(C)C 444903961 ZIZKQGLMLHHJOG-WINIVTDRSA-N 390.593 5.332 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3c(F)cc(C#N)cc3F)c2)C1 445960742 QHPOLMXAJWYFEH-KSSFIOAISA-N 384.426 5.184 30 20 GKED O=C(N[C@H](c1cc(F)ccc1F)C(F)F)c1ccc(Cl)cc1C(F)(F)F 448462620 VOOAZCWWDDDEFA-CYBMUJFWSA-N 399.693 5.373 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 458800391 LCMXTKGCVHJVOU-LJQANCHMSA-N 390.314 5.570 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(Cc2cccc(F)c2)CC1)c1ccccc1 458806183 VTBOBBKDQOKQDY-HSZRJFAPSA-N 393.506 5.225 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N1CCC[C@@H]1c1ccc(C(C)C)cc1 460957687 ITAIKVGQWPWPNU-NHCUHLMSSA-N 380.536 5.171 30 20 GKED Cc1ccc(Br)cc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 461089903 PLRQQIUUIYXIBA-AWEZNQCLSA-N 398.087 5.059 30 20 GKED CC(C)(C#N)CCSc1nc2ccccc2c(=O)n1Cc1ccccc1Cl 463030191 BTOPOGPYLFDDIN-UHFFFAOYSA-N 397.931 5.130 30 20 GKED O=C(CCC(F)(F)F)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 464054560 GRKVBCGZNDVTIB-UHFFFAOYSA-N 399.278 5.641 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 467750402 YMCBHTZUQQFLPX-LDYMZIIASA-N 386.336 5.645 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)CCC)c1C 471260276 YNCWHZFUGSQLAK-UHFFFAOYSA-N 379.504 5.344 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)C1CCC(C(F)(F)F)CC1 473250888 UPTBWILIZBSSKK-UHFFFAOYSA-N 386.311 5.107 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(CN3CCCCCC3)cc2)cc1 475316331 BSZNIINCVAUSSH-UHFFFAOYSA-N 375.516 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(=O)OC(C)(C)C)c1 476121702 HLVZCLZLZYNSKP-UHFFFAOYSA-N 379.500 5.746 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cc(Cl)ccc1Cl 477540793 JGUFIWSHKXBMIR-LBPRGKRZSA-N 376.287 5.677 30 20 GKED C=C(C)[C@@H](NCc1nc2ccc(Br)cc2[nH]1)c1ccc(F)c(F)c1 481612355 TYTUHFALYMXAGR-GOSISDBHSA-N 392.247 5.011 30 20 GKED C=CCN1CCC(N[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 482617860 KZXGRJUFQOFCGB-GOSISDBHSA-N 387.980 5.081 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(F)c(F)c(F)c1 484278090 HOHKIJRXLADQPC-UHFFFAOYSA-N 396.368 5.115 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCc4[nH]c5ccccc5c4C3)c2)cc1 484985348 QVEZEULJOVNAOK-UHFFFAOYSA-N 393.446 5.030 30 20 GKED N#CCCC[C@@H](NC(=O)CCC(=O)c1csc2ccccc12)c1ccccc1 487591988 ICNJCZOEHUGIMW-HXUWFJFHSA-N 390.508 5.416 30 20 GKED Cc1cccc2nc(CCC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)[nH]c12 495230720 GCWAIDREXGTLJG-UHFFFAOYSA-N 396.450 5.107 30 20 GKED COc1ccc(-c2ccc(C(=O)N(CCC#N)CC(C)(C)C)c(F)c2)c(F)c1 500724351 GEWPKNWCWWSWAF-UHFFFAOYSA-N 386.442 5.042 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(C#N)c2C)c(C(F)(F)F)c1 509862281 WNNZHKSIIDSARS-GFCCVEGCSA-N 392.446 6.028 30 20 GKED Cc1sc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 512630240 LWBRXWYHFDSYPL-STQMWFEESA-N 399.922 6.195 30 20 GKED CCN(C(=O)NCC(C)(C)C#N)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 512779363 SLTFPNXLMFXOAF-KRWDZBQOSA-N 379.504 5.004 30 20 GKED CCCN(C(=O)NCC(C)(C)CCC#N)[C@@H](C)c1ccc(Cl)c(Cl)c1 513106801 AGIOPTFIZBEFDX-AWEZNQCLSA-N 384.351 5.806 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 516176913 KILVAPVRNWMZEO-MRXNPFEDSA-N 397.569 5.639 30 20 GKED Cc1ccc(C)c(CN(C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 516690605 XNEXNRZACQQKJS-UHFFFAOYSA-N 386.455 5.026 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CSc3ccc(Cl)cc3)cc2)ccn1 516897616 ACPNDUBFABEVJG-UHFFFAOYSA-N 395.871 5.130 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 517530222 LLADSCBPOOKTSN-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1 517665979 QGHCSERWKPGSRF-UHFFFAOYSA-N 391.858 5.456 30 20 GKED COc1cc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)cc(Cl)c1OC 518843865 CHQGIHSNKLVPHA-UHFFFAOYSA-N 395.846 5.028 30 20 GKED CSc1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 518870123 UMOHDQKSDLPQSM-CYBMUJFWSA-N 386.448 5.300 30 20 GKED C=CCOc1cccc(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)c1 520203099 HRFBPVIGZMJIAL-SFHVURJKSA-N 381.516 5.432 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 521016082 FVICEPNWDOECQP-ZBEGNZNMSA-N 398.837 5.220 30 20 GKED COc1ccc(CNCC(C)(C)c2ccccc2Cl)cc1OCCCC#N 521830395 ZKCCRYDCDBHTDS-UHFFFAOYSA-N 386.923 5.099 30 20 GKED CCc1nc(C)c(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)s1 522092988 VOYSOJIZTQRFQF-UHFFFAOYSA-N 393.487 5.180 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC2CCCCC2)cc1 522606930 MKFUVTJFWCIZMQ-UHFFFAOYSA-N 389.499 5.490 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)c2)c1 524153619 MBHCHCVVWPZXFN-GOSISDBHSA-N 385.467 5.328 30 20 GKED N#Cc1cccc(-c2nnc(COc3ccc(-c4ccccc4)cc3Cl)o2)c1 525110753 IOBKDOBKSSOQNG-UHFFFAOYSA-N 387.826 5.508 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC([C@@](C)(O)C(F)(F)F)CC1 530447247 FYTGTVWNQXPWLM-HXUWFJFHSA-N 398.469 5.096 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1ncc(-c2ccc(Cl)cc2)o1 530733437 CZTBRKPYSFCRAD-VQTJNVASSA-N 377.875 5.267 30 20 GKED N#C[C@H](C(=O)c1cccc([C@@H]2CCCOC2)c1)c1nc(-c2ccccc2)cs1 536588782 NABAGDRVONBKMT-WOJBJXKFSA-N 388.492 5.194 30 20 GKED Cc1nnc(N(CCC(C)C)C(=O)c2ccc(Cl)c(C#N)c2)c2ccccc12 541593305 BJWAUUOSHZXTFP-UHFFFAOYSA-N 392.890 5.156 30 20 GKED Cc1sc([C@@H](C)NCc2cccc(C#N)c2F)nc1-c1ccc(Cl)cc1 542575872 SZUGLRIJCNYECI-GFCCVEGCSA-N 385.895 5.634 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N(C2CC2)C2(C#N)CCC2)c1 556451459 AOELYSYBGMTUMC-UHFFFAOYSA-N 391.858 5.055 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 560135484 UICNPLUHLZLVFX-INIZCTEOSA-N 390.439 5.160 30 20 GKED N#Cc1c(F)cccc1SCC(=O)Nc1cc(C(F)(F)F)ccc1Cl 562440412 QIWIOBKPPYKUFZ-UHFFFAOYSA-N 388.773 5.100 30 20 GKED C[C@H]1C[C@@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCC1=O 562638402 CKAOBUMDJLUEJL-KBPBESRZSA-N 398.915 5.307 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 571434817 MECBOAWLUXAULN-JOCHJYFZSA-N 389.499 5.177 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cnc(-c4cccnc4)s3)c2C#N)[C@@H](C)C1 571979226 ZXELSDSNGQYOSM-RYUDHWBXSA-N 394.525 5.076 30 20 GKED Fc1ccc(-c2nc(CN(CCC(F)(F)F)CC(F)(F)F)cs2)cc1 582102277 ZBPXGVHOASFBAG-UHFFFAOYSA-N 386.336 5.266 30 20 GKED CC(F)(F)c1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 590069163 DDVOWIYVIUPHTJ-UHFFFAOYSA-N 379.366 5.110 30 20 GKED CN(c1ccccc1)c1ccc(CNC2(c3cccc(C#N)c3)CCOCC2)cc1 594983195 HIUKGCMWAIHTRP-UHFFFAOYSA-N 397.522 5.122 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@]12CCCC[C@H]1C2(F)F 596790876 SJNJVRHSMPCPPM-WIYYLYMNSA-N 397.425 5.208 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)NCc2ccc(C#N)cc2F)cc1 609254392 MFEAWBZEVZPCGP-NRFANRHFSA-N 379.479 5.042 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)CCCCCc2cccs2)cc1 609448629 MWCYEUYKCOGPON-UHFFFAOYSA-N 394.462 5.314 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609647649 XGBXKYAJWRNUPN-AUSIDOKSSA-N 396.490 5.563 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)cc1C#N 610109405 KCSYEIJGHHZARV-UHFFFAOYSA-N 393.402 5.007 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610290588 GHFZZWKDMSHOBF-INIZCTEOSA-N 389.430 5.092 30 20 GKED Cc1ccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c(OCc2ccccc2)c1 610321759 SRPLRUZSIFRRHQ-SFHVURJKSA-N 385.467 5.328 30 20 GKED C[C@@H](NC(=O)[C@H](Sc1ccccc1F)c1ccccc1)c1cccc(C#N)c1 610359590 KRVHEYZHBXLYJN-OPAMFIHVSA-N 390.483 5.408 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N(C1CC1)C1CC1 626594735 XELXYZGIFFFFTE-UHFFFAOYSA-N 384.295 5.135 30 20 GKED C=CC[C@@H]1CCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 628484924 YBFAZGKPGHFZFL-CYBMUJFWSA-N 379.287 5.006 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2cnc(C3CC3)nc2)cc1)C(F)(F)F 647229775 BZPUWRVUZFJFBE-UHFFFAOYSA-N 393.306 5.256 30 20 GKED Cc1cc(F)cc(C)c1C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 666254015 SCTQVPPHLLPOAS-GHMZBOCLSA-N 385.323 5.082 30 20 GKED C=CCOc1ccc(CNC(=O)c2ccccc2SCc2ccco2)cc1 672057480 JVNAHKASAAQTQQ-UHFFFAOYSA-N 379.481 5.067 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(c2cccc(Cl)c2)CCC1 672239184 HEIZGRXCDPSQOP-UHFFFAOYSA-N 385.939 5.144 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3ccccc3F)n2)cc1 726857867 BAKFLHZUQHWKQQ-QAPCUYQASA-N 378.472 5.628 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)s1)c1sccc1Br 727263810 ITKPOWUYKNWNCS-SREVYHEPSA-N 376.300 5.530 30 20 GKED N#Cc1ccc(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)nc1 730739582 HVJMTDFWAVGYBT-UHFFFAOYSA-N 391.839 5.103 30 20 GKED O=C1/C(=C\c2ncc(-c3ccc(Br)cc3)[nH]2)CCc2ccccc21 732714166 SMMSSICIXHCOKR-PTNGSMBKSA-N 379.257 5.052 30 20 GKED C#CCOc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1 733323194 NZWKZDZFNRBXCD-HSZRJFAPSA-N 393.433 5.179 30 20 GKED N#Cc1ccc(NN=C(CC2CCCCC2)c2ncccn2)cc1C(F)(F)F 733901708 TURZIFPJOLDHMZ-UHFFFAOYSA-N 387.409 5.154 30 20 GKED C[C@@H](Oc1ccccc1Cl)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739594942 ATXOUBIGQWNUQQ-CQSZACIVSA-N 396.899 5.024 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)/C=C\c2ccccc2C#N)cc1 741645894 MLQYQFJCQMJUCD-MBWHEXEYSA-N 396.490 5.467 30 20 GKED C[C@H](CCNCc1ccc(N(C)CCC#N)cc1)c1cccc(C(F)(F)F)c1 746053214 JBPQXQGAZXWRJP-QGZVFWFLSA-N 389.465 5.339 30 20 GKED O=C(COc1ccccc1F)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746438645 ZQZPYAJPIVQISM-HNNXBMFYSA-N 396.258 5.070 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)c1ccc(Sc2ccccc2C#N)cc1 748292873 VOSZWHZWOFUGOS-UHFFFAOYSA-N 393.899 5.030 30 20 GKED CC1(C)CCC[C@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1 756530272 UNEYEYKMLGRRBF-SJLPKXTDSA-N 377.513 5.465 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2CCC[C@H]2c2cccs2)c1=S 764859138 FNCPFOYCDBUMDA-SFHVURJKSA-N 396.585 5.432 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(O)c(Cl)c2)cc1 770834750 PBGFKFXVPBPWRY-KRWDZBQOSA-N 380.806 5.092 30 20 GKED C[C@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccc(OCC#N)cc1 776159598 JWICKADGKKRZQA-UUOWRZLLSA-N 390.914 5.877 30 20 GKED C=CCOc1ccccc1CN[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21 779059472 XMVIQIWMQHTBBC-OAQYLSRUSA-N 394.515 5.376 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3cc(Cl)cs3)SC2=S)cc1Cl 779203494 IRNHFURUBVQNNG-ACAGNQJTSA-N 397.333 5.332 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2cccc(NC(=O)NCC)c2C)cc1 788613671 UMCPHCNGSRDXMZ-MRXNPFEDSA-N 387.911 5.441 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2cccc(Br)c2)s1 797567389 HLNXVOWUFYYTBM-CQSZACIVSA-N 391.334 5.012 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(C#N)cc2C(F)(F)F)ccc1OC(F)F 811687069 LEYFVNGBDLINMX-GQCTYLIASA-N 397.299 5.083 30 20 GKED N#C[C@H](C(=O)CCCCc1nc2ccccc2s1)c1nc(C2CC2)cs1 842937434 GEJPTSPRTKAKFA-CQSZACIVSA-N 381.526 5.219 30 20 GKED CC(C)(CC(F)(F)F)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 850796636 NOTAIRLDZQPFEA-VIFPVBQESA-N 388.361 5.243 30 20 GKED CCC[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Cl)c1cccc(Cl)c1 860468951 GRNVGNDIOVNCJU-HZPDHXFCSA-N 389.282 5.225 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(F)c(Cl)c2)cc1 915085602 NXECZDQGWDGAJJ-IBGZPJMESA-N 394.833 5.152 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1 916000862 WXDQMEIOBUUKNL-IERDGZPVSA-N 379.529 5.002 30 20 GKED O=C(O)/C=C\c1ccc(/C=C/C(=O)c2ccccc2OCc2ccccc2)cc1 1776126658 SOWLHOPAHGTVNY-GGTPAPDOSA-N 384.431 5.260 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)c1 1777033355 DCWUAHIDSSZSQM-NTCAYCPXSA-N 385.463 5.010 30 20 GKED O=C(O)c1cc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)cs1 1777663715 YBUJOIKCENZFIN-XNTDXEJSSA-N 391.473 5.480 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)C(=O)Nc2ccc(Cl)cc2)n1 21514956 IOFINVBGMLHJBX-JTQLQIEISA-N 399.825 5.053 30 20 GKED CCCCN/C(S)=C(/C(=O)c1cc(C)ccc1C)[n+]1ccc(C(C)(C)C)cc1 27325366 WJCVZMZTZHKUOQ-UHFFFAOYSA-O 397.608 5.217 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3nccs3)cc2Cl)cc1 55320631 BBPSXWAEGVNKII-UHFFFAOYSA-N 383.860 5.032 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1 58685587 RIWVQPHPYRVHHB-UHFFFAOYSA-N 386.520 5.020 30 20 GKED Cc1cc([C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)c(C)o1 60138123 XPWZTBOLQQJWJB-OAHLLOKOSA-N 376.481 5.410 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 61165780 PESMBOUDYYVHOB-UHFFFAOYSA-N 381.526 5.602 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C 63961881 PNHHTMBMNXURLU-UHFFFAOYSA-N 386.238 5.389 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1cccc(OCc2ccccc2C#N)c1 65625832 RXZRVTFSCUEHET-INIZCTEOSA-N 376.481 5.032 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)CCC(=O)c1ccc2ccccc2c1 65808102 ABUUMUFLWYGSGB-UHFFFAOYSA-N 387.479 5.026 30 20 GKED CCc1nc([C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)cs1 78881014 HHCWQCGLMCZXLQ-AWEZNQCLSA-N 393.537 5.219 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(-c2ccoc2)c1 120280086 DDSJKLUVDLIOMH-UHFFFAOYSA-N 395.418 5.566 30 20 GKED Cc1cnc(-c2cccc(NCc3cn(CCC#N)nc3-c3ccccc3)c2)o1 131095257 VTVFXSGGCMFNIS-UHFFFAOYSA-N 383.455 5.039 30 20 GKED CN(Cc1cscn1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 146856828 JHOWFDUQCHGFAY-UHFFFAOYSA-N 398.875 5.124 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)C(=O)c1cccc(F)c1 177603745 WKNLSMYOEIKKNI-KDOFPFPSSA-N 392.455 5.035 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 185030347 ROPJPOXZSWNLJB-MRVWCRGKSA-N 390.430 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(C)c(N2CCOC2=O)c1 191492609 BLSHSTMRRNFGRQ-UHFFFAOYSA-N 393.487 5.448 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 191518507 VFBAINMAJAJYHK-RBBKRZOGSA-N 378.516 5.580 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC(c4ccncc4)CC3)c2)cc1 191890029 VWBTUHGIGAMZAB-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CC(C)(CCC#N)COC(=O)c1csc(-c2ccc(Br)s2)n1 195078027 JUMOIBMSGUAHLT-UHFFFAOYSA-N 399.335 5.121 30 20 GKED CC(C)c1ccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)c2cccs2)cc1 236843826 SKNSPSYJZKPUCU-KOSHJBKYSA-N 390.552 6.042 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1nc2ccccc2n1C(F)F 245924392 NPWGNHOHPRWQOU-RRFJBIMHSA-N 385.801 5.065 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccccc2O[C@H](C)C#N)CC[C@@H]1c1ccccc1 248542841 IOORZJUFMPCRCD-GGPKGHCWSA-N 377.488 5.025 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3snc(Cl)c3C#N)s2)cc1 301271469 JSZLPDIOVRMEGL-JTQLQIEISA-N 390.921 5.282 30 20 GKED C[C@@H](Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)c1ccc(-c2cccnc2)cc1 301454388 BFBNRGMSIQFMIF-OAHLLOKOSA-N 395.422 5.250 30 20 GKED C[C@@H]1C(=O)CC[C@@H](C(O)=Nc2nc3c(Br)cccc3s2)C1(C)C 329296248 STGIYEDACXNDJS-ZJUUUORDSA-N 395.322 5.288 30 20 GKED Cc1cccnc1[C@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)C(C)C 329482168 RMPLXKSSPGPISQ-PZJWPPBQSA-N 394.563 5.550 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)Nc1ccc(Cl)cc1CC#N 410969685 PSRDZWUJLNTSSF-UHFFFAOYSA-N 389.908 5.013 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c(Cl)c1 426135411 FEUOJMNEQSZJQG-UHFFFAOYSA-N 378.863 5.104 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2c1 430647897 QQZFSPRUDLDPGI-KRWDZBQOSA-N 389.524 5.665 30 20 GKED Cc1c(Br)cccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 438139504 YJZOZBJBCDTMED-QFBILLFUSA-N 398.304 5.061 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)[C@@H](C)c2ccc3ccccc3c2)c1C 439748766 VFZKWVWEGRCCLD-KRWDZBQOSA-N 394.478 5.256 30 20 GKED C[C@@H](NC(=O)C1(c2ccc(C#N)cc2)CC1)c1ccc(-c2cccc(C#N)c2)cc1 444298946 ZNAIJBSAUZYFDF-GOSISDBHSA-N 391.474 5.006 30 20 GKED CC(C)c1ncc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)s1 448410907 QYTLONJJANIUCJ-UHFFFAOYSA-N 379.510 5.218 30 20 GKED Cc1ccc(OC2CCN(C(=O)Nc3ccc(CC#N)cc3Cl)CC2)cc1C 455701642 KDPCHQOZHGIDOT-UHFFFAOYSA-N 397.906 5.098 30 20 GKED CC[C@@H](CC(F)F)C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 457690535 DZOQNJBLMLDTAR-QPUJVOFHSA-N 377.275 5.106 30 20 GKED Cc1cccc(F)c1NC(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 461920141 KBDKPULJLSSVCF-CQSZACIVSA-N 394.290 5.578 30 20 GKED CN(C(=O)Nc1cc(C(F)(F)F)ccc1F)[C@H]1CCCC[C@H]1C(F)(F)F 463754667 JPVJZIFRBRABMJ-MFKMUULPSA-N 386.311 5.429 30 20 GKED C[C@H](C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1cccc(C#N)c1 464099806 RHKVETUFZYNLQS-ZDUSSCGKSA-N 380.369 5.385 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 465658143 RRKVMWLOFLFKPP-IBGZPJMESA-N 399.878 5.001 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 472135529 ZYNVZFIIAYQABK-QHCPKHFHSA-N 389.474 5.098 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)C3(c4ccc(C#N)cc4)CC3)ccc2C)c1 473899050 ZWPNTEDUUWHMND-UHFFFAOYSA-N 383.451 5.033 30 20 GKED CCN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H](C)c1cccc(C(F)(F)F)c1 475365877 FPPSSZXKCFHKBK-VQIMIIECSA-N 388.433 5.702 30 20 GKED C=CCOCCCSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 475996666 SCFIASNFUOVLLK-GOSISDBHSA-N 379.529 5.239 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 476061291 LPLHRYSIRUHIES-QFIPXVFZSA-N 384.479 5.600 30 20 GKED C=CCCC1(C(=O)N2CCC[C@@H](c3nc(-c4ccccc4OC)cs3)C2)CC1 477088964 NAOYQMHXQWASQJ-QGZVFWFLSA-N 396.556 5.271 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccc(F)cc3)cc2F)c1 477830848 VWYCXBLDSHAMSC-UHFFFAOYSA-N 379.366 5.059 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 479202186 BIJFIVAAOSJVGX-GFCCVEGCSA-N 381.888 5.135 30 20 GKED N#CCC[C@H](NC(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccccc1 487935767 OLQPBFCSYMAUCW-VXKWHMMOSA-N 377.463 5.106 30 20 GKED N#Cc1ccc(SCc2csc(-c3ccc(Br)cc3)n2)nc1 498156879 MNQNZVOVGMVBPE-UHFFFAOYSA-N 388.315 5.132 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(Oc4ccccn4)c3)CC2)cc1 503469781 KZWIHEGJXZBTEZ-UHFFFAOYSA-N 396.450 5.067 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 504134723 GOBOOKIMHDUJRM-KSFYIVLOSA-N 389.886 5.361 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 508880821 XBPPMYLAXNCTGL-UHFFFAOYSA-N 394.418 5.252 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 509725225 SFHXVKCYSIFGCL-XTFSCAMASA-N 395.506 5.343 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)c1 510748045 FAEGJJYQJYRQHL-HNNXBMFYSA-N 393.512 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(CC)nc2onc(C(C)C)c12 511280389 HSPFTLHECCMADF-UHFFFAOYSA-N 391.515 6.013 30 20 GKED Cc1ccc(OCCCCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 517472978 HTIFHCCVQJKAHU-SFHVURJKSA-N 397.544 5.228 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccccc3Br)cc2)c1 518728303 HUVPWYRGCQATPZ-UHFFFAOYSA-N 393.240 5.365 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)NC[C@H](C)c1ccccc1 520268112 WKZVSQHKXQQLFL-RBUKOAKNSA-N 399.494 5.071 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3sccc3Br)cc2)cc1 520557025 ZGMNFLSETYWLHP-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 524160798 OMJOSMWDTWUQPA-UHFFFAOYSA-N 389.886 5.851 30 20 GKED Cc1ccccc1-n1c(S[C@H](C#N)C2CCCCC2)nnc1-c1ccncc1 524534468 VRYSUIANAUGYND-HXUWFJFHSA-N 389.528 5.202 30 20 GKED COc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1Cl 526051255 CIZKZRQQPPZMNZ-HNNXBMFYSA-N 397.906 5.105 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)NC[C@H](C)C#N 532056823 AFBLJBWJCYCRAG-CQSZACIVSA-N 393.466 5.013 30 20 GKED C=C(C)[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)OCC 534475032 UDOIGQOGZLILDZ-HNNXBMFYSA-N 386.439 5.021 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)c(F)c1 538509218 HJCMBOBLWVMUKL-MWTRTKDXSA-N 384.458 5.024 30 20 GKED N#CCc1ccc(CSCc2csc(COc3ccc(F)cc3)n2)cc1 544084933 XUFNDGICBQYFHR-UHFFFAOYSA-N 384.501 5.361 30 20 GKED Cc1cc(Br)c(C(=O)N[C@@H](C#N)c2ccccc2Cl)cc1Cl 553320859 UEXVYUXPBOQENV-HNNXBMFYSA-N 398.087 5.059 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1cc(Cl)ccc1SCC(F)(F)F 554232809 IOIQDRVGJDEDDO-UHFFFAOYSA-N 393.862 5.446 30 20 GKED CC1(C)CN(C(=O)c2c(F)cc(C(F)(F)F)cc2F)CC[C@H]1C(F)(F)F 558567246 VMHITFORNZCDMN-LLVKDONJSA-N 389.286 5.034 30 20 GKED Cc1c(NC(=O)N[C@@H](CCC#N)c2ccccc2)cnn1-c1ccc(Cl)cc1 562894891 HBUFEZCEYNXBDJ-IBGZPJMESA-N 393.878 5.001 30 20 GKED N#CCCN(C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1ccc(F)cc1 565397224 LUNRGZKHUGPYKL-UHFFFAOYSA-N 385.398 5.194 30 20 GKED N#Cc1ccccc1CN(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 574558611 MFWJAIYLQQCJNB-UHFFFAOYSA-N 381.401 5.174 30 20 GKED Cc1ccc(-c2nc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)cs2)cc1 575840816 BXJNNZZWFRCTKC-UHFFFAOYSA-N 398.491 5.790 30 20 GKED Cc1sc(NC(=O)[C@@H](C)Oc2ccccc2C#N)nc1-c1cccc(Cl)c1 584068739 BXCPNTCLAIVDPV-GFCCVEGCSA-N 397.887 5.050 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3cc(C#N)c4ccccc4n3)s2)c(C)c1 589045709 DOASELDHWSVMDY-UHFFFAOYSA-N 384.464 5.099 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)C[C@H]1CCc2ccccc21 596734195 CPNNZBKLJJFZCM-FUHWJXTLSA-N 379.529 5.275 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CSCc1ccc(F)cc1 603532614 IIHSPXKYACKZAQ-UHFFFAOYSA-N 390.483 5.164 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3ccc4ccccc4c3)cn2)c1 603623868 OOHCBAOJRYIRKY-UHFFFAOYSA-N 379.419 5.080 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3nc(-c4ccccc4)cs3)cn2)cc1 603764979 RYUUGCNCLCWMQR-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C=CCn1c(S[C@H](CC)c2ccc(F)cc2)nnc1-c1ccccc1OC 606151403 REJQIEVBLZWNTB-LJQANCHMSA-N 383.492 5.522 30 20 GKED CC(C)C[C@H](C#N)NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 608820322 BSTUPNIXXWCMGI-MRXNPFEDSA-N 376.378 5.166 30 20 GKED COc1cccc(CN(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609208997 NNCSPBRNVWYHID-UHFFFAOYSA-N 387.439 5.023 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1ccc(COCc2ccccc2)cc1 609669627 LJLXWGGTTHDOJQ-UHFFFAOYSA-N 397.400 5.301 30 20 GKED N#Cc1cccc(N[C@@H](c2ccccc2)c2ccc(Br)cc2F)n1 609894805 YNVLVKHQUGIVSH-IBGZPJMESA-N 382.236 5.056 30 20 GKED C=CCCCN(C)C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 609908730 ATTRCVKCCGZODN-CQSZACIVSA-N 378.925 5.041 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccccc2F)CC1 609930288 YXLTWQKFAUGOPQ-INIZCTEOSA-N 397.519 5.631 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 609969146 IZLMIJPOJNKEAX-INIZCTEOSA-N 386.417 5.285 30 20 GKED CC(C)=CCSc1ccccc1C(=O)NCCSCc1ccccc1C#N 610151071 NTLIJMHTMNJVTQ-UHFFFAOYSA-N 396.581 5.280 30 20 GKED C[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1C(F)(F)F 610227847 NJOLCQNAVPLKAY-KGLIPLIRSA-N 392.446 5.699 30 20 GKED C[C@H](NC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)c1cccc(C#N)c1 610359588 KRVHEYZHBXLYJN-AOMKIAJQSA-N 390.483 5.408 30 20 GKED C[C@H](NC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1)c1cccc(C#N)c1 610664085 OWOIVQABDCEBAC-ROUUACIJSA-N 383.495 5.708 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OC(C)C)cc3)n2)cc1 612894633 CSLKYXXLJOAJBC-LJQANCHMSA-N 376.481 5.396 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cn1)c1ccccc1 613292320 HJLHEFZPNULTEC-LAUBAEHRSA-N 393.446 5.260 30 20 GKED FC(F)(F)c1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 618452121 QQGIDMHXVWFLTO-TXEJJXNPSA-N 379.266 5.268 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cn1)c1ccccc1 647377289 ATSSZLBCIGTJJS-KSSFIOAISA-N 389.480 5.046 30 20 GKED COc1cccc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)c1OC 728441635 NADMIFIVDIUUKA-VAWYXSNFSA-N 383.444 5.171 30 20 GKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 728764485 AVYJPTHPEMDDEO-SJORKVTESA-N 382.916 5.956 30 20 GKED O=C(/C=C/c1cnn2ccccc12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 729643920 LDGLQDSUXAVJCU-SNAWJCMRSA-N 384.279 5.268 30 20 GKED Cc1cc(C)cc(Oc2ccc(NC(=O)Cc3ccc(OCC#N)cc3)cc2)c1 731977267 OWUYERQMYJFLQN-UHFFFAOYSA-N 386.451 5.179 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2CCc3ccccc3C2)cc1 732536217 FGIQQIGXADFKLV-UQBPGWFLSA-N 380.491 5.476 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)cc1F)c1ccc(Cl)cc1 733258415 ASPQUSOKFYSMJK-HXUWFJFHSA-N 382.797 5.280 30 20 GKED N#C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C1CCCCC1 734366871 BWEUQWAJGURPAR-PZJWPPBQSA-N 381.545 5.294 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1cnn(-c2ccc(C#N)cc2)c1C 741812265 PPMGVRMLIACNTA-UHFFFAOYSA-N 384.270 5.195 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H](C)c1cccc(O)c1 743096395 QLXNGRDCTCODBC-KOSHJBKYSA-N 399.494 5.663 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Nc2ccc(OC(C)C)c(Cl)c2)cc1 743465205 GLFFHEHSMOYAAP-QGZVFWFLSA-N 399.922 5.183 30 20 GKED CCOCc1cc(/C=C2/CCc3[nH]c4ccc(F)cc4c3C2=O)ccc1OC 747612619 GXBBNRUHGHYFDS-GDNBJRDFSA-N 379.431 5.065 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1OC 753143708 JXLGMWMDMHSALV-MDZDMXLPSA-N 394.496 5.289 30 20 GKED C#CCCCC(=O)Nc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)ccc1C 757878820 YNRDQFKEQKVPNX-UHFFFAOYSA-N 388.389 5.008 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H]1CCCCO1 758536803 XZFXGYYJAZIIRE-FCHUYYIVSA-N 391.515 5.059 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(C(F)(F)F)s2)S1 761390759 FOPYOSROEQOVNP-WQLSENKSSA-N 382.432 5.275 30 20 GKED C[C@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)c(F)c1 777552241 BXAKAMVVXVSTMS-AWEZNQCLSA-N 383.442 5.528 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCc1cccc(Oc2ccccc2)c1 780678462 UNOJXYXEBFONFR-KRWDZBQOSA-N 387.439 5.091 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 781070283 JNLLTXGKVIMYGD-HXUWFJFHSA-N 396.491 5.240 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cccc(F)c1Sc1ccccc1 781171300 SKJQDXJPYCCYAN-HNNXBMFYSA-N 392.455 5.520 30 20 GKED C[C@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(C#N)cc1F 781423681 WUOPUCMZCCJVOJ-AWEZNQCLSA-N 381.838 5.498 30 20 GKED CN(C)Cc1cnc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)s1 794691725 RQJIAAIDXYVQSA-WAYWQWQTSA-N 375.708 5.061 30 20 GKED O=C1/C(=C/c2ccc(Cl)c(C(F)(F)F)c2)C[C@H](C(=O)O)c2ccccc21 806560911 PXVHEGDEAJGPPP-OIOXUXFSSA-N 380.749 5.197 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCCC2)cc1 815635471 DFDRFGCLLYENCP-PXDATVDWSA-N 375.560 6.153 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)C[C@@H](O)c1cccc(C#N)c1 844481882 VYSGOQPUALDTHZ-OAQYLSRUSA-N 379.504 5.002 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CCC[C@]3(C2)CC3(F)F)cc1 844702368 ZEZDPWHUMPJVDR-HXUWFJFHSA-N 399.466 5.363 30 20 GKED COc1cccc(-c2nc(/C=C3/CSc4ccc(F)cc4C3=O)cs2)c1 916128681 WDNMYPMNAFRWBL-QPEQYQDCSA-N 383.469 5.330 30 20 GKED COc1cc(C=NNc2c(Cl)cc(Cl)cc2Cl)ccc1OCC#N 916249189 SVZLGHLOWQHGLA-UHFFFAOYSA-N 384.650 5.004 30 20 GKED CCOc1ccc(C#N)cc1NCc1cc(=O)oc2cc(C)c(C(C)C)cc12 920402724 PSTCCRJJIWLXMG-UHFFFAOYSA-N 376.456 5.107 30 20 GKED CCC(=NNc1cccc(C(=O)O)c1)c1ccc(Br)cc1Cl 1776037018 HQCXWBBJCFHGPO-UHFFFAOYSA-N 381.657 5.027 30 20 GKED Cc1c(NN=Cc2sc(Oc3ccccc3)nc2Cl)cccc1C(=O)O 1776086592 CRTRCEQPGLCLHF-UHFFFAOYSA-N 387.848 5.041 30 20 GKED C=CC[C@@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(Cl)c1)C(=O)O 1776185890 IHADQOIIYMTLEJ-MRXNPFEDSA-N 384.234 5.044 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCCC)c(OCC)c1 1776784729 NNVVWZASJXZSLR-HXUWFJFHSA-N 393.568 5.558 30 20 GKED CCCCCCCOc1ccc(CNC[C@@]2(C(=O)O)CC3CCC2CC3)cc1 1776786217 AYKMAVFCFUDDCZ-HQOBLLPJSA-N 387.564 5.407 30 20 GKED CCCCCCOc1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 1776788999 LPSKQVCLUGIQRR-WQEMPZKUSA-N 378.468 5.484 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(/C=C\C(=O)O)o3)s2)cc1 1777430560 CKAPEPRCDINBKC-IXIPZQGVSA-N 379.437 5.014 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1cc(Br)cc(C(=O)O)c1 1777559881 SCTUDPQIHDRHOF-SREVYHEPSA-N 385.213 5.098 30 20 GKED O=C(O)c1ccc2scc(/C=C3/COc4cc(F)c(Cl)cc4C3=O)c2c1 1777685731 VCADYPSWIOTAKE-KMKOMSMNSA-N 388.803 5.051 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1sc2nc(C(F)(F)F)ccc2c1C 24501151 GCYRGZMJANBTGX-UHFFFAOYSA-N 390.430 5.452 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)c1 32292007 WWXSLJXZQRFIRN-UHFFFAOYSA-N 397.261 5.696 30 20 GKED N#C[C@H](C(=O)CCSc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 60477629 CQEFECJBBMDSCF-QGZVFWFLSA-N 398.940 5.822 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(-c2nc3ccccc3s2)s1 60626006 VTBNZPBEHCJMON-UHFFFAOYSA-N 393.493 5.174 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3sc(C)c(C)c3C#N)cs2)cc1 60666617 JBCHCYDFGBSAJC-UHFFFAOYSA-N 381.526 5.104 30 20 GKED COc1cc(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)ccc1SC 64853605 MOGGOWQLMDYNIG-CMDGGOBGSA-N 385.485 5.576 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 91707844 HGBJWPKRADAIEB-MSOLQXFVSA-N 393.384 5.163 30 20 GKED Cc1nc(/C=C\c2ccc(C#N)cc2)sc1C(=O)/C=C\c1ccc(C#N)cc1 96402173 WMJMEHALUHVKRE-MIMPSMLTSA-N 381.460 5.261 30 20 GKED CCN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)[C@H](C)c1ccc(C#N)cc1 104316861 FCEASTJYJQPXAS-OAHLLOKOSA-N 393.874 5.019 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1coc2ccccc12 113652860 ULMCELRWUDOWRZ-GOSISDBHSA-N 396.402 5.186 30 20 GKED CC(=O)Nc1cc(NCc2cccc(OCc3cccc(C#N)c3)c2)ccc1C 121948708 CYPYOGYMCQIPNJ-UHFFFAOYSA-N 385.467 5.016 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)N(CC#N)C1CCCC1 125360739 PZNSCNIPPXRLNG-UHFFFAOYSA-N 393.434 5.046 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 126128882 QRPYBEMWJVAQMK-UHFFFAOYSA-N 399.372 5.312 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Sc3ccncc3)cc2)c1 153203627 FOTRKJKDBXTHNK-UHFFFAOYSA-N 377.494 5.101 30 20 GKED CCN(C(=O)CCc1nc(C)c(-c2ccccc2)o1)[C@H](C)c1ccc(C#N)cc1 170943548 FKMABRKYEJCMNS-GOSISDBHSA-N 387.483 5.064 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(Oc2ccccc2)c(F)c1 171540952 QYKYTECGOMAKEW-VQHVLOKHSA-N 390.336 5.273 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cc2ccccc2o1 175846677 GJSLLCRHWIVLFE-HNNXBMFYSA-N 379.485 5.348 30 20 GKED CC[C@@H](Cc1ccccc1Br)C(=O)[C@H](C#N)c1nc2ccccc2o1 177137112 ZVEKWUOEGGIDFR-ZFWWWQNUSA-N 397.272 5.035 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H](C)c2ccc(C(F)(F)F)cc2)n1 177768593 WPHUIRKBZDOUFX-IUODEOHRSA-N 380.435 5.655 30 20 GKED Cc1cnc([C@@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 177919832 QJJXFPDCWWTSSA-OAHLLOKOSA-N 393.537 5.107 30 20 GKED CCN(C(=O)c1cccc(-c2csc(C)n2)c1)c1ccc(C#N)c(Cl)c1 179521504 XVAMERGUPSTKRY-UHFFFAOYSA-N 381.888 5.310 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(-c3ccccc3)o2)ccc1OC 180810022 KCCIOAGQJXUAOJ-XLIONFOSSA-N 390.483 5.487 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 181575737 MEJIOAJQAGRVGP-WZONZLPQSA-N 396.556 5.099 30 20 GKED CC(C)c1ccc(-c2nc(C[S@@](=O)Cc3ccc(C#N)c(F)c3)cs2)cc1 190738741 NNKQDJBVARLFSL-MHZLTWQESA-N 398.528 5.393 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccccc2F)C1 191504947 XVMXETOVEOAARB-OAQYLSRUSA-N 382.479 5.283 30 20 GKED C=CCn1c(SC(c2ccc(F)cc2)c2ccc(F)cc2)nnc1C1CC1 248019957 UFOSBNPPHIBREI-UHFFFAOYSA-N 383.467 5.501 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1nccs1)C(F)(F)F 297969055 YPCJZOVIASAJLH-OAHLLOKOSA-N 383.439 5.420 30 20 GKED N#C[C@@H](NC(=O)c1sc2ccccc2c1Cl)c1cccc(Cl)c1Cl 303416891 WVSSHQDNBLLTFT-GFCCVEGCSA-N 395.698 5.856 30 20 GKED CC1(C)C[C@H](/N=C(/O)c2ccc3c(c2)C(C)(C)C(O)=N3)c2ccc(F)cc2O1 330210807 CORCHXFWYSPNEI-KRWDZBQOSA-N 382.435 5.312 30 20 GKED O/C(=N\C1CCC(/C(O)=N\C[C@H]2CCO[C@@H]2c2ccccc2)CC1)C1CCCC1 330238604 ZXFBXYPAFSGBOJ-JYAXOCDNSA-N 398.547 5.426 30 20 GKED N#CC1(CSCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CCC1 419577624 HVNXKWQSESTCMD-MRXNPFEDSA-N 383.344 5.084 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430586583 TZCFDLRDTHUUHG-HNNXBMFYSA-N 395.553 5.286 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1 431722379 LYLVVKZLTHKOEC-QGZVFWFLSA-N 377.366 5.142 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(c3cccc(Cl)c3)CC2)cc1 431818444 QETAQLYAEQUPOU-UHFFFAOYSA-N 381.907 5.553 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(Cl)ccc2c1CCO2 433502736 MCFHOZKJUNIOGR-UHFFFAOYSA-N 383.300 5.210 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)c[nH]c12 437460489 RJWPPRDETDSYJD-UHFFFAOYSA-N 399.425 5.461 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1Cl 441384799 YEEAXURCCXVMQD-HNNXBMFYSA-N 387.936 5.057 30 20 GKED C=CCC[C@@H](NC(=O)N(C)CCC1CCOCC1)c1ccc(C(F)(F)F)cc1 441535120 NASITCROKXNQKR-LJQANCHMSA-N 398.469 5.171 30 20 GKED C=CCN(C(=O)c1cnc([C@H](C)OCC)s1)c1nc(-c2ccccc2)cs1 443816119 MMPHQJRBAHKTPO-AWEZNQCLSA-N 399.541 5.197 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(COC3CCCC3)cc2)c1Br 449917407 ULRIHDFRWAZLJG-UHFFFAOYSA-N 399.288 5.032 30 20 GKED C[C@H](C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)c1cccc(C#N)c1 462124475 VDZPPAAKIYITAO-HNNXBMFYSA-N 387.395 5.001 30 20 GKED Cc1ccc(CCC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)s1 463468493 FRVOIDGOWIUPGV-UHFFFAOYSA-N 392.499 5.229 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 466367283 RVCRMONJEYBCBH-QGZVFWFLSA-N 399.560 5.062 30 20 GKED O=C(Nc1ccc2oc(C(F)(F)F)nc2c1)c1cc(C(F)(F)F)ccc1F 471362902 QZLAQZMJJWIVSA-UHFFFAOYSA-N 392.230 5.257 30 20 GKED CC(C)CN(C(=O)c1cnc(Cc2ccccc2F)s1)c1ccc(C#N)cc1 475335808 MQVJBPXYGQISLM-UHFFFAOYSA-N 393.487 5.047 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(NC(=O)NC(C)C)cc1)c1ccc(F)c(F)c1 480696852 XYMIGLLCZAWLQL-VFNWGFHPSA-N 387.474 5.463 30 20 GKED C=CCn1c(SCc2cc3ccccc3o2)nnc1-c1ccccc1OC 486633609 VRKLCNVZUJOMPY-UHFFFAOYSA-N 377.469 5.178 30 20 GKED CCc1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)oc1CC 487929705 LUSSIVRQJBDAFA-LBPRGKRZSA-N 386.423 5.296 30 20 GKED C=CC[C@H](C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C)c1ccccc1 488653541 ISBUJUFYQDYSEE-QFIPXVFZSA-N 399.494 5.937 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cccc(C#N)c1 493563396 KRDCKBLXYLJKSX-ZDUSSCGKSA-N 397.887 5.127 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ncc(Cc2ccccc2F)s1)c1ccccc1 496334327 UWCAKXTVOFDECA-LJQANCHMSA-N 394.475 5.040 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(C(F)(F)F)ccc3F)n2)c1 501130923 YRCFESLNOYHTNZ-UHFFFAOYSA-N 391.349 5.092 30 20 GKED CC(C)c1cc(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c2ccccc2n1 503903779 XWPHYKCEDGRZFM-UHFFFAOYSA-N 381.479 5.159 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(Oc2ccccc2Cl)CC1 505016573 JHFYTVFMOVSWLX-UHFFFAOYSA-N 384.907 5.534 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1 505041060 YJFBTEPYEVHAFP-FQEVSTJZSA-N 388.870 5.203 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H](C)[C@@H]1C 510104865 MNPABERNPIEXRN-WMZOPIPTSA-N 377.488 5.098 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Br)c2cccnc12)c1ccccc1 511901916 KKRSDZIJYVERKF-HNNXBMFYSA-N 394.272 5.023 30 20 GKED CCCCOc1cccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 517530068 XTLBLMQJLDBBPC-QGZVFWFLSA-N 397.544 5.581 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 519003116 MICVMPZQGBJDOL-UHFFFAOYSA-N 390.314 5.849 30 20 GKED N#CCCCOc1cccc(CN[C@H]2CCOc3c(-c4ccccc4)cccc32)c1 524171032 NHNAPWXFSQYPEZ-VWLOTQADSA-N 398.506 5.650 30 20 GKED CCC[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 535850156 KVFTVRJPIBXRCD-OAHLLOKOSA-N 382.460 5.286 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC=C(C(F)(F)F)CC1 536035682 MOQJOFXYQMRUMV-UHFFFAOYSA-N 388.414 5.044 30 20 GKED N#Cc1c(NC(=O)CCN[C@H](c2cccs2)C2CC2)sc2c1CCCCC2 537165534 KKYRFYGCCISVDD-FQEVSTJZSA-N 399.585 5.020 30 20 GKED C[C@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)c(F)c1 540707515 GRRPQVAZOWLGME-KSFYIVLOSA-N 378.422 5.307 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(C(F)F)c3Cl)CC2)cc1 544633097 CTKWDMRVQPAERZ-UHFFFAOYSA-N 387.817 5.470 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1-c1cccs1 554363967 VMSGZDPOLDQOPM-UHFFFAOYSA-N 394.544 5.803 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCSc1cccc(Cl)c1 554713675 DKYDRNRVKUOFCI-AWEZNQCLSA-N 390.961 5.713 30 20 GKED CCCC(C)(C)N(Cc1nnc(-c2cccc(C#N)c2)o1)Cc1cccs1 555071110 MOWLJHMXHPAKKU-UHFFFAOYSA-N 380.517 5.251 30 20 GKED CC[C@@H](Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2)c1ccc(C#N)cc1 556239932 GOWCSPRZOJNSNU-XMMPIXPASA-N 395.506 5.253 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccc(C#N)c(Br)c1 558214376 PUDDRPXUJMVNAI-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc([N+](=O)[O-])c1 565987397 DXKBJXYIXUUJJM-HNNXBMFYSA-N 387.395 5.001 30 20 GKED C=CCC[C@@H](NC(=O)NCCCc1nccs1)c1ccc(C(F)(F)F)cc1 568940093 WAMOSYCTPQMEOW-MRXNPFEDSA-N 397.466 5.101 30 20 GKED C[C@@H](NC(=O)C1(c2cc(F)cc(C#N)c2)CC1)C(c1ccccc1)c1ccccc1 583956496 KXQYIWUUFCODPK-GOSISDBHSA-N 398.481 5.066 30 20 GKED CC(C)c1nc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cs1 588348961 KJWPFASXVMCDOC-JTQLQIEISA-N 395.431 5.385 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccnc2)cc1)c1nc2cc(F)ccc2s1 592973189 AJBOZOJTWXOYFJ-KRWDZBQOSA-N 389.411 5.113 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)C1CCC(F)(F)CC1 594070576 KFTKIHYTFMATIM-UONOGXRCSA-N 381.492 5.416 30 20 GKED Cc1coc(-c2cc(NC(=O)NC3(c4ccc(C#N)cc4)CCC3)ccc2C)n1 594073701 GCIFIUSLIPQDDB-UHFFFAOYSA-N 386.455 5.031 30 20 GKED CSc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 603991549 CCHPESQLHJSNPR-UHFFFAOYSA-N 376.506 5.360 30 20 GKED CN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604089585 GEUGBNUCUXHDMG-UHFFFAOYSA-N 397.887 5.729 30 20 GKED N#CCCN(C(=O)c1sc2cc(F)ccc2c1Cl)c1ccc(F)cc1 604455771 GCFYXEBARGJHFC-UHFFFAOYSA-N 376.815 5.393 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 605204671 MAADACAUMCITBC-UHFFFAOYSA-N 393.487 5.354 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC(C)(C)CC2)cc1 608893252 MNGZBVNUJQZHCI-UHFFFAOYSA-N 379.460 5.013 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 609207953 RVWXVWQAUNNSPN-UHFFFAOYSA-N 377.366 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1c(F)cccc1Cl 609403114 UEJHABRCNLLGHD-ZDUSSCGKSA-N 391.899 5.395 30 20 GKED CCCOc1ccccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 609640299 ACLRRHXVUAVZTE-UHFFFAOYSA-N 386.451 5.178 30 20 GKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1cccc(Br)c1 609825868 XZWRBSXDJZAPKO-OLZOCXBDSA-N 389.318 5.142 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(OCc2cccnc2)cc1 614180120 XKBGNKDCMWIHJD-IBGZPJMESA-N 385.511 5.313 30 20 GKED Cc1ccc(F)c(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 642410456 GWWVJINKTCIBMP-UWVGGRQHSA-N 386.311 5.165 30 20 GKED C=C(C)CN(CC)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 643087415 XSMOUIIMWOBJEU-UHFFFAOYSA-N 382.554 5.506 30 20 GKED C=CCn1c(SCc2cccc(OC(C)C)c2)nnc1-c1ccccc1OC 643194015 SIZAAFWFLCPPDP-UHFFFAOYSA-N 395.528 5.219 30 20 GKED FC(F)(F)C(F)(c1ccc(NC2CCN(C3CC3)CC2)cc1)C(F)(F)F 647323372 CSJAZJIPIKWTEW-UHFFFAOYSA-N 384.339 5.015 30 20 GKED N#C[C@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1nc2ccccc2s1 727952692 QJRMBYWAJRGJJX-JXOMPUQVSA-N 388.492 5.507 30 20 GKED N#C[C@@H](C(=O)CSCc1cccc(Cl)c1)c1nc2cc(F)ccc2s1 730417087 KNFDNGFSUMTIAS-AWEZNQCLSA-N 390.892 5.198 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](OC1CCCC1)c1ccccc1 730988725 BSNCDXFSGCMOFZ-VGOFRKELSA-N 394.540 5.577 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731973405 XVXSOASIHYJVAE-MBSDFSHPSA-N 386.520 5.709 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc([N+](=O)[O-])cc1 739512341 TYCQSFGTJBUQDU-QFIPXVFZSA-N 399.450 5.167 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)[C@@H]2C[C@H](OCC)C23CCCCC3)c1 741514794 XIAGIWXAEFNHSZ-RTWAWAEBSA-N 384.589 5.205 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nnc(-c2cccc(F)c2)o1 741857963 FAZJAOCOIAWYLV-UHFFFAOYSA-N 388.427 5.102 30 20 GKED C[C@H]1/C(=C\c2cccc(OCCCC#N)c2)C(=O)c2cccc(Br)c21 742435737 XRLNEVQTAMMZKC-RAOBZKRQSA-N 396.284 5.515 30 20 GKED Cc1ccc(O[C@@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 743093910 ZKLLOCQBTBENLY-YADARESESA-N 399.494 5.240 30 20 GKED CS[C@@H]1CC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 743123148 GEKRIQVXNBAQSL-QFBILLFUSA-N 381.501 5.065 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 744017141 ZFAURAGBGGYAOV-LMRWQKIVSA-N 386.398 5.595 30 20 GKED CCCN(C)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 746365461 WQRAZZZBMBUVTL-XMMPIXPASA-N 383.495 5.441 30 20 GKED CCn1nc(C)c(C(=O)/C=C/c2cccc(OCc3ccccc3F)c2)c1C 750911020 WUUYVMMZEKEXCS-OUKQBFOZSA-N 378.447 5.134 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc2ccccc2c1 753395599 OKLMNZVANQPYKG-HXOBKFHXSA-N 392.458 5.444 30 20 GKED CCCc1nc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cs1 754858662 GVBZZPSWRUTVJT-UHFFFAOYSA-N 381.476 5.297 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 756232777 XOWXHWIMRZQAJH-LRDDRELGSA-N 389.282 5.468 30 20 GKED N#Cc1cccc([C@H]2CN(C(=O)Nc3ccc4oc5ccccc5c4c3)CCO2)c1 761813073 RFBRXDFQVWYMAY-HSZRJFAPSA-N 397.434 5.063 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 763944889 OSMRRHZYSZYGIA-KSSFIOAISA-N 391.452 5.007 30 20 GKED N#C[C@H](C(=O)[C@@H](c1ccccc1)C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 765916489 SEBIAHNYCZLSSG-QUCCMNQESA-N 392.911 5.834 30 20 GKED Cc1cc(NC(=O)c2cn(CCCC#N)c3ccccc23)ccc1N1CCCC1 767486184 HDSXIHRLZCRIGO-UHFFFAOYSA-N 386.499 5.106 30 20 GKED COc1ccsc1C(=O)/C=C/c1nc2ccc(Br)cc2s1 773147534 BMVBUKFCMRIXLN-SNAWJCMRSA-N 380.288 5.025 30 20 GKED Cc1nnc([C@H](C)OC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 783703404 JXWMPINBQCWNMM-NSHDSACASA-N 399.859 5.082 30 20 GKED CC(CCCC(F)(F)F)=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 794982182 UCCTXWSFPCGRRF-UHFFFAOYSA-N 390.331 5.683 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1C#N 799334036 FFHBMHOUBGYFPE-UHFFFAOYSA-N 389.402 5.144 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2cnc(-c3ccccc3)s2)C(=O)c2ccccc21 802708076 RFFZJFWNMDHSTK-VMTBQTDASA-N 389.476 5.127 30 20 GKED N#CCCCCCC(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 805858479 RLDIWUJRJVCHTB-DQYWGJDHSA-N 381.545 5.261 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCCOC2=O)cc1 815636662 YQMCLRBVEBYENX-GCJKJVERSA-N 377.488 5.119 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)n1 892804023 ZAEXHUNSFOEJBK-INIZCTEOSA-N 399.516 5.128 30 20 GKED C=CCC[C@H](NCc1c(Cl)cccc1OCc1ccccc1Cl)C(=O)O 901689725 FGUWNMXAWKFOCQ-SFHVURJKSA-N 394.298 5.081 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCC1CCC(C#N)CC1 902567597 NUWIMFKQZSMFQT-KLAILNCOSA-N 387.574 5.083 30 20 GKED Fc1ccc(NC(=S)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 914707644 XXPVFNNLHOFEMD-GDGBQDQQSA-N 388.352 5.022 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@@H]2c2ccncc2)s1 915312034 XUYRNFHKNKVAMG-QGZVFWFLSA-N 387.553 5.205 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc(Cl)c2)cc1 915352978 PNWPGCFBDHXMQF-OAQYLSRUSA-N 375.859 5.317 30 20 GKED O=C1/C(=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)CCc2ccccc21 916135703 JQVFOAKEKOGWRG-QNGOZBTKSA-N 391.474 5.206 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C=C\c1cc(C)c(C)cc1C 916906633 IIKJYUDEDAHZSD-SSSWZJSRSA-N 388.511 5.097 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccccc2Cl)cc1 916912960 KTAOUZXBWHRNAZ-RNUYOQPASA-N 380.875 5.043 30 20 GKED CCCCc1ccc(CC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916917273 GORHRHXIZVJDIM-QFIPXVFZSA-N 384.479 5.072 30 20 GKED CCCCCCCCC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 918173428 MZWXLVYOOHVZDI-UHFFFAOYSA-N 376.884 5.874 30 20 GKED CCCCCCOCc1cccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c1 920874219 GHBWVLJSHRCWPW-SFHVURJKSA-N 379.504 5.538 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2C(=O)O)cc1)c1ccc2c(c1)CCCC2 1776113563 NVCOPBMIKFAMST-WJDWOHSUSA-N 382.459 5.827 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)cc1 1776125668 PRBCGLJMODBZCG-JYFOCSDGSA-N 392.495 6.030 30 20 GKED C=C(Cl)C[C@@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 1776143170 SKYLWISATOVZMR-QGZVFWFLSA-N 398.261 5.265 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccccc2SC(F)(F)F)c1)C(=O)O 1776473367 AFYVIWOHIGASIK-VMPCVLLUSA-N 396.386 5.047 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc([C@@H](C)C(=O)O)cc2)cc1 1776786656 SERNMAVIAITFBF-GOSISDBHSA-N 381.516 6.030 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](CC(=O)O)C2CCCCC2)c1 1776788635 CPZRXTASQQSRMC-JOCHJYFZSA-N 389.580 5.797 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c(C)c1 1777353292 RBRYPGZCEFBWOD-YFHOEESVSA-N 378.449 5.326 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cc1C(=O)O 1777360710 CCLWHCDOHKTLRT-SOFGYWHQSA-N 382.412 5.157 30 20 GKED N#CCc1ccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)cc1 8125764 HQFBJXWBSHHKOR-UHFFFAOYSA-N 381.410 5.359 30 20 GKED Cc1ccc(SCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1C 27444916 MNMJUINZTFILJP-SFHVURJKSA-N 378.522 5.396 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 47956796 WFBMLSKSFKYYSI-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@@H]2C[C@H]2c2ccccc2)cc1 67583163 ZNZCMDXGDNBYJU-LADGPHEKSA-N 397.478 5.009 30 20 GKED C[C@H]1CCCC[C@H]1NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 71922915 OTJCNFORBDSEOJ-HTAPYJJXSA-N 377.488 5.032 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 108825833 FUXOZPQCUNYGSK-UHFFFAOYSA-N 390.870 5.063 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2ccc(Cl)cc2)cc1 111183037 AUMAUCAHALKELF-HNNXBMFYSA-N 388.920 5.166 30 20 GKED C[C@@H](SCc1ccccc1C#N)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 120502181 WEUXFGBDNNQWKH-GFCCVEGCSA-N 393.493 5.111 30 20 GKED CCC(CC)(NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 173288365 KQUOSFIUBUPAGK-UHFFFAOYSA-N 380.879 5.067 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2ccccc2O[C@H](C)C#N)on1 182583883 ZSCDGDVMPPPKJE-MRXNPFEDSA-N 399.450 5.406 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)CC1(c2ccccc2)CC1 190186629 JWXJBZNFMFPJMG-KRWDZBQOSA-N 379.529 5.134 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)cc1 211851700 DHDIVCZOTYMFDF-JYRVWZFOSA-N 381.378 5.296 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 248649720 ROPJPOXZSWNLJB-KWCYVHTRSA-N 390.430 5.098 30 20 GKED CC(C)(C#N)c1ccc(Nc2cc(C(F)(F)F)nc(-c3ccncc3)n2)cc1 301342844 JGMRNOMUNRVPHK-UHFFFAOYSA-N 383.377 5.102 30 20 GKED CCOC(=O)c1oc2ccccc2c1CNc1ccccc1S[C@H](C)CC#N 303326467 IURHMAGAQWLORV-OAHLLOKOSA-N 394.496 5.616 30 20 GKED C[C@H]1CCc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c2[C@H]1C 410988963 UBAVULAXZNAPFF-RYUDHWBXSA-N 397.525 5.203 30 20 GKED O=C(C1CCC(C(F)(F)F)CC1)N(Cc1ccc(F)cc1)CC(F)(F)F 435813359 HFXVDJZFVSKWMX-UHFFFAOYSA-N 385.323 5.085 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1Br 437670045 PWLBCOAQYUEDHJ-HKUYNNGSSA-N 398.304 5.061 30 20 GKED CC1(C)CCCN(C(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)[C@@H]1C#N 442798883 HNMBHPYWLRUQNG-OAHLLOKOSA-N 376.287 5.143 30 20 GKED Cc1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(OC(C)C)c1 446854743 BQPJJLFCSHUWDE-KRWDZBQOSA-N 397.544 5.356 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cscc2C#N)c(C(F)(F)F)c1 460082174 ZVGDTHJRKIYUPG-JTQLQIEISA-N 384.448 5.781 30 20 GKED C=CCn1c(SCCC(C)(C)C#N)nc2sc(-c3ccccc3)cc2c1=O 463044768 SELAPIFFUFQLOG-UHFFFAOYSA-N 395.553 5.343 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3SCCc4sccc43)c2)cc1 463881421 VGUJYQSGVKDEPY-HXUWFJFHSA-N 392.505 5.381 30 20 GKED Cc1oc2ccccc2c1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 464560472 NTPCQACQQJZSSW-UHFFFAOYSA-N 396.446 5.639 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccco2)c2ccccc2)c(Cl)c1 465389665 UTFWPOMNMIONFF-UHFFFAOYSA-N 382.872 5.130 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccc(NC(=O)[C@H](C)CC(=C)C)cc1)C1CC1 467724869 UPMBDVWWELEMPK-MOPGFXCFSA-N 382.548 5.321 30 20 GKED COc1ccc(N(CC(C)C)C(=O)c2cn(CCCC#N)c3ccccc23)cc1 468825195 DLEHJGRIXGHOEJ-UHFFFAOYSA-N 389.499 5.256 30 20 GKED N#CC[C@H](CC(=O)N1CCCCC[C@@H]1/C=C\c1cccs1)c1ccccc1 476671590 OOYDOAXDERKTKR-YVERFSONSA-N 378.541 5.620 30 20 GKED C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)Nc1ccc(C#N)cc1Cl 477947492 VRWZRZPYQQIDFV-LBPRGKRZSA-N 395.812 5.325 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N(CCC#N)CCC(C)C)c1 477947850 AVKHEUDTPGLMGH-UHFFFAOYSA-N 381.524 5.144 30 20 GKED COc1cccc(F)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 478659135 OLTNTDUYGILBII-UHFFFAOYSA-N 396.805 5.404 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CCCc3c(O)cccc32)c1 480469805 DOYBATYCHMTZHC-XMMPIXPASA-N 384.479 5.010 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 485463845 KBENELZEOBLSKL-UHFFFAOYSA-N 392.402 5.030 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c(C)s1 499849949 RZKKKLPAWXCGLU-OAHLLOKOSA-N 395.311 5.016 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccnc(Oc4ccccc4)c3)CC2)cc1 503458450 GEIRKXQAHVTCMW-UHFFFAOYSA-N 396.450 5.067 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)c1 507157871 XXOBIHQVXKBAJX-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N3CCC(C)(C#N)CC3)c2)c(C)c1 507825897 BBXRQRLDXSELQX-UHFFFAOYSA-N 378.541 5.362 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)c1ccccc1C#N 508080689 VZLARZAOGBAXAY-UHFFFAOYSA-N 391.474 5.287 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccccc1C(F)(F)F 508870162 LENCRYCQOUNEDQ-UHFFFAOYSA-N 389.446 5.366 30 20 GKED COc1ccc(-c2ccc(NC(=O)c3cc(C#N)ccc3Cl)nc2)cc1Cl 509403537 MFUGTIIOFNRYRC-UHFFFAOYSA-N 398.249 5.188 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)cc1 509657086 ICXJOWYIXZGOII-QZTJIDSGSA-N 388.389 5.658 30 20 GKED N#Cc1ccc(-c2nnc(CNc3c(F)cc(F)cc3-c3ccccc3)o2)cc1 510119423 OVMMYAMZJRFYBZ-UHFFFAOYSA-N 388.377 5.166 30 20 GKED CCN(C(=O)c1ccc2cc(Br)ccc2c1)c1ccc(C#N)cc1 510373976 MAFOISDYQYCQMA-UHFFFAOYSA-N 379.257 5.141 30 20 GKED CC(C)(C)CN(CCC#N)Cc1csc(COc2ccc(Cl)cc2)n1 513750837 QCUNQMPOGZVBNU-UHFFFAOYSA-N 377.941 5.137 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1cc(Cl)ccc1Cl 518143607 OHXBUIXXSFOCMX-GFCCVEGCSA-N 379.312 5.426 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccc4ncccc4c3)no2)c2ccccc21 519718976 DBJQIGVRSUPIRA-UHFFFAOYSA-N 379.423 5.210 30 20 GKED CCN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)[C@@H](C)C(C)C 520053542 MFLMYSYYBCMTHY-SFHVURJKSA-N 379.504 5.230 30 20 GKED CC(C)c1cc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)nn1C(C)(C)C 520889603 MABVXGLCVUBYBB-LJQANCHMSA-N 380.536 5.054 30 20 GKED CCN(C(=O)c1[nH]c2ccccc2c1Br)[C@@H](C)c1ccc(C#N)cc1 521199822 CKDDIQJYDCFFPP-ZDUSSCGKSA-N 396.288 5.025 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 524558145 GZLRPZIWVPYFQZ-QFIPXVFZSA-N 375.516 5.945 30 20 GKED C[C@@H](Nc1ccc(-c2ccccc2)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 525247843 NQNXMZLFCAWDOA-GOSISDBHSA-N 387.458 5.240 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)c(F)c1 530790482 GEYWRXRHRIOMBH-FQEVSTJZSA-N 382.797 5.009 30 20 GKED C=CCC[C@H](NCc1nnc(-c2c(Cl)cccc2Cl)o1)c1ccccc1 537154238 AMLYPZONXHFQFH-KRWDZBQOSA-N 388.298 5.841 30 20 GKED CCN(C(=O)C[C@H](C)C(=O)c1ccc(Cl)cc1)[C@H](C)c1ccc(C#N)cc1 537479917 YXBVPUTZMZFAHP-JKSUJKDBSA-N 382.891 5.030 30 20 GKED C=CCC[C@H](NCc1nc(-c2cccc(Br)c2)no1)c1ccccc1 538258864 MUYFOXVJCRRQPR-SFHVURJKSA-N 398.304 5.296 30 20 GKED C[C@H](NCc1cc(F)cc2cccnc12)c1ccc(-c2cccc(C#N)c2)cc1 542945921 ZRVFWUJRRRIQGC-KRWDZBQOSA-N 381.454 5.763 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(Cc4cc5ccccc5o4)no3)cc2)nc1 551531739 ZARWXVHRMHSORA-UHFFFAOYSA-N 394.390 5.133 30 20 GKED N#Cc1c(NC(=O)[C@H]2CCC(=O)c3ccccc32)sc2c1-c1ccccc1CC2 560038800 FFAMXHRSJNWAJP-SFHVURJKSA-N 398.487 5.084 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)c1cc(-c2cccc(C#N)c2)no1)C1CC1 578712930 VPCBYCCAHUXDKX-CQSZACIVSA-N 391.858 5.232 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 590252684 INYOBUJGTSEKOW-CHWSQXEVSA-N 391.286 5.606 30 20 GKED N#CCC[C@@H](N[C@@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598677954 LSLRPOPBRZRHFT-SJORKVTESA-N 379.248 5.390 30 20 GKED C=CC1CCN(C(=O)c2cc3c(C)nn(-c4cccc(Cl)c4)c3s2)CC1 599680818 QGKQUKRSRZKQKI-UHFFFAOYSA-N 385.920 5.087 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccsc3)cn2)cc1 603689986 WCICOQKMGMKMOV-IBGZPJMESA-N 390.468 5.176 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c(F)cccc3F)cc2Cl)cc1 604027085 CWKWGQCKQQDFAE-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C[C@H](NC(=O)NCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 604097433 LPFNYAUEMJAALP-INIZCTEOSA-N 389.430 5.050 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1 604497932 VIAWLTRCROIJCE-UHFFFAOYSA-N 375.497 5.295 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(C(=O)OC(C)C)ccc1Cl 608916769 HMQDRNLJGUXTLG-UHFFFAOYSA-N 386.879 5.125 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3c(F)cccc3Cl)cc2F)c1 609107190 WWEOUTKJQGXNEX-UHFFFAOYSA-N 398.796 5.321 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)C[C@@H](c3ccccc3)C(F)(F)F)c2C#N)C1 609125465 ROSUXZBKADKZNZ-LRDDRELGSA-N 392.446 5.419 30 20 GKED Cc1oc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1C 609164623 SJFVENDPEZDULX-IBGZPJMESA-N 378.859 5.766 30 20 GKED N#Cc1ccc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1C(F)(F)F 609448877 NUQCKMGEVJXXSV-AOOOYVTPSA-N 390.249 5.144 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 609636265 KOZDJWYBELQRMH-AZUAARDMSA-N 393.556 5.628 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[C@@H](C)c1cccnc1 609651760 GONPDBGTCOUROX-SFHVURJKSA-N 385.467 5.163 30 20 GKED CCCCn1c(S[C@@H](C)c2ccc(C#N)cc2)nnc1-c1ccc(OC)cc1 609813516 HGVKVMHMGQMIKA-INIZCTEOSA-N 392.528 5.479 30 20 GKED C[C@H](NC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1cccc(C#N)c1 610714010 NHFUITOCKONTFI-INIZCTEOSA-N 396.450 5.173 30 20 GKED C[C@@H]1CSc2ccc(Cl)cc2N(C(=O)c2cc3ccccc3n2CC#N)C1 612243988 ANJJPDUHVBBRAH-AWEZNQCLSA-N 395.915 5.207 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2noc(C3CCC3)n2)cc1)C(F)(F)F 629200331 FLUNTRCFVDTQLB-UHFFFAOYSA-N 397.294 5.239 30 20 GKED Cc1cc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)nn1C 647323452 NILASBHFNSKCAM-JTQLQIEISA-N 383.311 5.191 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C 660666706 XCVXLSSMWZJNPX-NXHRZFHOSA-N 397.544 5.081 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CCC(=O)c3ccccc32)cc1 670776242 IGHKMKSDGANYRJ-NRFANRHFSA-N 382.419 5.049 30 20 GKED C=C[C@@](C)(CCOC)c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 685236088 YUNPTPRQMQEIDK-HNNXBMFYSA-N 394.315 5.254 30 20 GKED C[C@H](Nc1snc(Cl)c1C#N)c1ccc(OCc2ccc(F)cc2)cc1 728569110 KWBWEBUNXUTWBC-LBPRGKRZSA-N 387.867 5.559 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(Cl)nc3Cl)c2)cc1 729656019 MWSJXCRLBUICBS-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1nc(-c2ccccc2)cs1 731546757 RUTNBMAPIAVSJZ-SFHVURJKSA-N 380.538 5.851 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)cc1OC 731937450 HZTYDYYTTUPTOK-KAMYIIQDSA-N 395.455 5.179 30 20 GKED N#CCOc1ccc(COC(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)cc1 733413557 KICGLUZAIQOIBS-FPYGCLRLSA-N 395.764 5.018 30 20 GKED C[C@H](OC(=O)c1ccnc(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733710330 RTRNNGYLXJZRQP-QMMMGPOBSA-N 381.247 5.176 30 20 GKED C=CC[C@H](NC(=O)NCCSCc1cccc2ccccc12)c1ccncc1 734661267 KYSRHNGJBJLHNC-QFIPXVFZSA-N 391.540 5.085 30 20 GKED C=CC[C@H](NC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C)c1ccncc1 734679485 HUYPXYSXSZBRKW-IBGZPJMESA-N 391.437 5.338 30 20 GKED Cc1cc(N(CCC#N)C(=O)CS[C@@H](C)c2cccs2)ccc1Cl 737406565 XCHDZGAUPSWARL-AWEZNQCLSA-N 378.950 5.451 30 20 GKED CS[C@@H](C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 739597651 BBIQSEXODMTCLH-HXUWFJFHSA-N 378.522 5.007 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1ccc(SCC(F)(F)F)cc1 741762708 QWALQDTYWKVPAD-UHFFFAOYSA-N 396.438 5.235 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(SC(F)F)cc1 743056207 QZRAQHYLFZNLQV-XCVCLJGOSA-N 384.407 5.480 30 20 GKED C#CC[C@@H](OC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccccn1 744099768 AJTQORPSGNRGDJ-HXUWFJFHSA-N 381.353 5.087 30 20 GKED CCc1oc2ccccc2c1C=NO[C@@H](C)c1nc(-c2ccccc2C)no1 744445575 RRIJDQLHIGKFPV-HNNXBMFYSA-N 375.428 5.465 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1 753145311 YHQHZEUSSPNFFL-ZHACJKMWSA-N 398.487 5.777 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(Cl)c(C(F)(F)F)c1 754690377 SQCDSCHWEWJZQB-FNORWQNLSA-N 394.805 5.773 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1ccc(Br)c(Cl)c1 754960132 AZYJUHAPXPGHJC-UHFFFAOYSA-N 378.575 5.534 30 20 GKED N#C[C@@H](COC(=O)c1cc(-c2ccccn2)ccc1Cl)Cc1ccc(F)cc1 755054909 VJKCEXDEGXNLTI-INIZCTEOSA-N 394.833 5.080 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CC12CCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 759833646 JUBBSAKKEOGRCG-STQMWFEESA-N 377.296 5.483 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760915924 SMURAWYLIXCIBN-AEFFLSMTSA-N 375.394 5.195 30 20 GKED Cc1cc(-c2cc(C(=O)OCCCCC(C)(C)C#N)c3c(C)noc3n2)c(C)o1 768544847 YXDSSCLKXYANAE-UHFFFAOYSA-N 395.459 5.285 30 20 GKED CS/C=C/C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 771566567 NDAQIPVPDUNLEH-ZHACJKMWSA-N 382.535 5.484 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CC3(CCCCC3)Oc3ccccc32)c1 772982224 GAPJTWQBJAFNEH-REWPJTCUSA-N 390.527 5.684 30 20 GKED O=C(/C=C/c1nc2ccc(Br)cc2s1)c1ccc(Cl)nc1 773143051 LLQDVSRQSXPXCG-GQCTYLIASA-N 379.666 5.003 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cnc3ccccc3c2)cc1 791510747 QZLXBKZHUMRMFW-XMMPIXPASA-N 391.474 5.462 30 20 GKED C=CC[C@H](OC(=O)CCc1nnc(C(C)C)o1)c1ccc(Cl)c(Cl)c1 797552545 DIRPCUXNNCTZHS-HNNXBMFYSA-N 383.275 5.293 30 20 GKED O[C@H](c1ccccc1NCc1cc(F)c(C(F)(F)F)cc1F)C(F)(F)F 809190651 PFFPBLLTTPTCMQ-CQSZACIVSA-N 385.254 5.191 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1nc2ccccc2s1 814301690 BIBUPNNFTNVTFR-WBVHZDCISA-N 378.501 5.092 30 20 GKED CC(C)(C(=O)O[C@H]1CC[C@@](C)(C#N)CC1)c1csc(-c2ccccc2F)n1 836152340 ZLXXAIQDMBQLSU-QCKZDCLWSA-N 386.492 5.242 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917026582 IJBTWZVTMUYRGB-APWZRJJASA-N 390.508 5.579 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cc(-c3ccccc3)cs2)S1 917516255 QNJVTDIODGCZJB-XDHOZWIPSA-N 390.533 5.924 30 20 GKED N#CCOc1ccccc1C(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 919992487 IMFRVHBZVKHQQZ-QHCPKHFHSA-N 384.479 5.083 30 20 GKED O=C(O)c1cc2c(C=NNc3ccc(Cl)cc3Cl)c(F)ccc2s1 1776029676 LWWHRAJRINOISL-UHFFFAOYSA-N 383.231 5.491 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NNc1cc(Cl)cc(Cl)c1 1776058623 XYOTZOZLWOFHTC-CYBMUJFWSA-N 395.286 5.266 30 20 GKED O=C(O)c1cccc(C=NNc2ccc(Cl)c(C(F)(F)F)c2)c1Cl 1776090811 BHCYONDKCGHTRT-UHFFFAOYSA-N 377.149 5.156 30 20 GKED CC1(C)C/C(=C\c2cc(Br)cc(C(=O)O)c2)C(=O)c2ccccc21 1776526697 WTKFHCBXSZNZTJ-RIYZIHGNSA-N 385.257 5.095 30 20 GKED CCCCCCCCCCCN(C)Cc1c(C(=O)O)sc2cccc(F)c12 1776784611 QJRZAPRWKITJDI-UHFFFAOYSA-N 393.568 6.701 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325587 NRMHKZVXHDRVHS-ZRNYENFQSA-N 394.559 5.159 30 20 GKED COc1cccc(S[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 27662421 UUMGBLOPMBOZHU-CYBMUJFWSA-N 386.542 5.017 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)/C(O)=N/c1nnc(-c2ccsc2)s1 52496255 AQUWOUNZMBSIRP-JTQLQIEISA-N 378.910 5.159 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC(F)F)c(F)c1 55542581 UHEYPYOHFAWCMJ-UHFFFAOYSA-N 382.341 5.218 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)oc2ccccc12 60477708 DLZXWOUTFPQCLK-MRXNPFEDSA-N 392.867 6.008 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)cc1 61058794 CQKUAKJYYPZIAA-UHFFFAOYSA-N 398.491 5.174 30 20 GKED CSc1ccc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1 66545481 GPTCBKGJUIBUGI-SFHVURJKSA-N 389.505 5.202 30 20 GKED N#CC1(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccccc3)s2)CCCC1 71919381 HYVXHFHMNGSZTQ-UHFFFAOYSA-N 387.508 5.423 30 20 GKED Cc1nc(NC(=O)c2[nH]c3ccc(Cl)cc3c2Cl)sc1SCC#N 101518272 XKPIGWBNMZXIEG-UHFFFAOYSA-N 397.312 5.108 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1sc2cccc(F)c2c1COC 105917419 QWNZMLICRBLCFO-UHFFFAOYSA-N 396.487 5.111 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)no1 108200631 LVQSVHWIOWQMAB-UHFFFAOYSA-N 383.860 5.253 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1cccc(F)c1 108413170 JZZLJJVYZNWZQD-LSDHHAIUSA-N 388.533 5.653 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CCc2ccc(Cl)cc2Cl)cc1 111184349 XBVNRVYJGXSZSQ-UHFFFAOYSA-N 391.298 5.272 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(C)(c2ccccc2)CC1 119942116 YVTHAFBYZYTLNQ-GOSISDBHSA-N 393.556 5.666 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122026007 POGHHTMLXADCOJ-DNVCBOLYSA-N 375.497 5.138 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 128105601 HAEYXTXVOUQWEJ-NSHDSACASA-N 383.325 5.158 30 20 GKED Cc1cccc([C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccn2)c1 152963002 JHIWBSIUCPINHI-JOCHJYFZSA-N 384.483 5.102 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2noc(Cc3ccccc3)n2)cc1 165462154 RLYVSIWBZJHFKZ-SJORKVTESA-N 397.906 5.204 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3coc(-c4ccccc4)n3)c2)c1 174474893 BROKLXCVYYPGAW-UHFFFAOYSA-N 395.462 5.082 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NC2CCN([C@H](C)c3ccncc3)CC2)cc1 181586577 UQVNNGFQANJAOE-RTBURBONSA-N 399.966 5.089 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)oc2c1ccc1ccccc12 191002174 PJPWSFCSWIDSMH-SFHVURJKSA-N 377.403 5.328 30 20 GKED COc1ccccc1-c1csc(C2CCN(Cc3cccc(C#N)c3)CC2)n1 191836074 PRRQFAACWCTOTM-UHFFFAOYSA-N 389.524 5.070 30 20 GKED N#CCN(C(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccccc1 194954251 GTKLIJJFLCKYFF-UHFFFAOYSA-N 382.419 5.182 30 20 GKED CC(C)[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1nc(-c2cccnc2)no1 329012488 OZDNJXPSGVQICB-AITUJVMLSA-N 382.508 5.392 30 20 GKED CCC(O)=Nc1ccc(C)c(N=C(O)N2Cc3ccccc3C3(CCC3)C2)c1 329411619 BURMSBYDTVAOMG-UHFFFAOYSA-N 377.488 5.476 30 20 GKED Cc1cc(C)c(N=C(O)N2CCC(c3noc4cc(F)ccc34)CC2)c(C)c1 329852330 RJDQDKCPOWPZES-UHFFFAOYSA-N 381.451 5.317 30 20 GKED OC(=Nc1ccc(Cl)c(Br)c1)C1CCC(/N=C(/O)C2CC2)CC1 330002391 BADYSWUPFAMRLM-UHFFFAOYSA-N 399.716 5.616 30 20 GKED CC1(C)C[C@H](/N=C(/O)CCc2nc(C3CCCC3)no2)c2ccc(F)cc2O1 330062244 AOVMIEUYWSTHMT-INIZCTEOSA-N 387.455 5.058 30 20 GKED C[C@H]1C(O)=Nc2cc(/C(O)=N/C3CC(c4cccc(Cl)c4)C3)ccc2N1C 330243373 WRUNGDYNEIUQLF-VWDMACCTSA-N 383.879 5.017 30 20 GKED CSc1cccc(F)c1C(=O)NCc1ccc(-c2ccccc2C#N)cc1 409901531 KLHKCHCVOAWHGY-UHFFFAOYSA-N 376.456 5.016 30 20 GKED C=C(C)[C@H](NCCC(=O)Nc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 411554627 LQAAYHNLNCWIMB-IBGZPJMESA-N 398.375 5.219 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC(F)F)c1ccccc1 422252120 AYRKNMQTWVCJAO-HXUWFJFHSA-N 385.458 5.122 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(COc3ccc(F)cc3)o2)s1 430600304 HHBAMZFJHMRCQK-MRXNPFEDSA-N 398.459 5.242 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1ccccc1Cl 430607257 XZGSYNAIFYGTHE-CYBMUJFWSA-N 398.919 5.078 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 433156905 KTGMDADXDFGARL-PKOBYXMFSA-N 392.528 5.638 30 20 GKED CCSCc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 434621871 XYNNKBCKLQELNQ-HNNXBMFYSA-N 385.439 5.175 30 20 GKED Cc1cccc(-c2nnc(SCCCCC(C)(C)C#N)n2Cc2ccco2)c1 436124906 OIPQGJMODIBKCL-UHFFFAOYSA-N 394.544 5.707 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1 437396467 XHCJPQYBZCZHGR-RUCARUNLSA-N 386.417 5.183 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@@H]3/C=C\c3ccccc3)o2)c1 441048680 SKOPNBWJKFIKQN-KCNXZKISSA-N 384.483 5.066 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)Cc1nnc(-c2cccc(C#N)c2)o1 441276298 JZPQCJCNLMEZPY-LJQANCHMSA-N 394.478 5.372 30 20 GKED C=CC[C@@H]1N(C(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)CCCC1(C)C 443868221 MYDSTBOULBATQA-FQEVSTJZSA-N 380.536 5.097 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)n1 447069648 SUAPWTIKCYPIQH-LJQANCHMSA-N 389.524 5.070 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 447114558 SCZKDRZJHBHVOR-ZDUSSCGKSA-N 375.925 5.217 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 460767005 ICMKOLOLIGLPRR-LEWJYISDSA-N 394.563 5.345 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1 462164151 YURIHCWZOPBNAV-OAHLLOKOSA-N 387.405 5.036 30 20 GKED C[C@H]1CN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C[C@@H](c2ccc(F)cc2)O1 462874749 DRPDTKVFJUVGRC-SGTLLEGYSA-N 399.828 5.004 30 20 GKED C=C(C)COc1ccc(Cl)cc1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 463200340 SMKQKAJGNKGESE-UHFFFAOYSA-N 381.215 5.109 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cccc(-c3cscn3)c2)cc1 463761704 WBWWQNZUFBDXIM-LJQANCHMSA-N 375.497 5.102 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCC(C)(C)c2c(F)cccc2Cl)cc1 466215443 DTKZTPIATBBGRY-UHFFFAOYSA-N 387.886 5.380 30 20 GKED CSc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469274251 RMKOVPULDFCSRM-INIZCTEOSA-N 379.529 5.165 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c(C)c1 470895981 COQFAZNWBBTVRR-APWZRJJASA-N 377.513 5.078 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccn2)cc1 471178268 NECXAJNQKXGALP-QFIPXVFZSA-N 384.483 5.102 30 20 GKED Cc1ccnc(Oc2cc(NCc3nnc(-c4cccc(C#N)c4)o3)ccc2C)c1 471678435 JCZLEUYILZYQQZ-UHFFFAOYSA-N 397.438 5.025 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)[C@@H](C)C(=O)OC 475570648 JSJLBFSYYUJMNX-DYESRHJHSA-N 394.515 5.210 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 476529825 GCRPFMCZHQRXRI-FUHWJXTLSA-N 378.369 5.023 30 20 GKED N#Cc1c(N[C@H](c2ccccc2)c2ccccn2)nc2c(c1C#N)CCCCCC2 479849512 IGDFDHKSFMGSBY-XMMPIXPASA-N 393.494 5.080 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1F 480765312 UGTDOALPTQNLIE-UHFFFAOYSA-N 390.480 5.063 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)cc1 481616946 ZKVFXPDXYYDCLQ-KRWDZBQOSA-N 379.479 5.428 30 20 GKED CN(C(=O)CSc1ccc(C#N)cc1)[C@H](c1ccccc1)c1ccc(F)cc1 482041089 QRNGUXGOWTWXJV-HSZRJFAPSA-N 390.483 5.037 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccc(C(=O)N2CCCCC2)c(Cl)c1 486431793 JOTMUASEBGDVPI-UHFFFAOYSA-N 395.934 5.379 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C 488527511 HASZIABXLCMJQJ-GOSISDBHSA-N 392.478 5.260 30 20 GKED Cc1ccnc2sc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c(C)c12 489840203 RCOGNLGZKPBONF-LBPRGKRZSA-N 397.912 5.666 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]1CC(C)C 501133628 KUMRSRRAEJZWCX-LJQANCHMSA-N 377.488 5.701 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccc(OCC(F)(F)F)cc2)CC1 507651768 GHYSGLZZOJCOCZ-UHFFFAOYSA-N 388.433 5.121 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cscc3Br)cc2)cc1 508173908 IHLPGBNBKMOBOK-UHFFFAOYSA-N 399.269 5.427 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N(Cc2cccs2)C2CC2)cc1 510667552 PRYGURYRAFUOFN-UHFFFAOYSA-N 389.480 5.609 30 20 GKED C=CCOc1ccc(CN[C@@H](CC)c2ccc(OC)c(OC)c2)cc1Cl 512885228 MOXDIDVSJFTWRQ-SFHVURJKSA-N 375.896 5.163 30 20 GKED C=C(C)COc1cc(CNCc2ccc(Oc3ccccc3)nc2)ccc1OC 517545704 YIKIHCANMXQVAA-UHFFFAOYSA-N 390.483 5.127 30 20 GKED C=CCn1c(SCc2ccc(SC)c(OC)c2)nnc1-c1cccc(C)c1 517584245 MLBKATSRRSDVOH-UHFFFAOYSA-N 397.569 5.462 30 20 GKED Cc1nc(NC(=O)C2(Sc3ccccc3)CCCC2)sc1SCC#N 518905689 CHMMOCCGDQDZNT-UHFFFAOYSA-N 389.571 5.111 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Sc1ccc(Cl)cc1 519422697 GGGZUOWXJZLYEF-KBPBESRZSA-N 390.961 5.711 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)N(C)Cc1cccc(C#N)c1 523452390 LSZSIDXBPDAYGR-HXUWFJFHSA-N 399.922 5.149 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)S1 525739462 YSWZIDRCKBWWDS-KHYOSLBOSA-N 399.947 5.353 30 20 GKED N#Cc1ccc(CN(C(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)C2CC2)cc1 541384447 UGOGHQPXLMNQFR-QZTJIDSGSA-N 385.294 5.160 30 20 GKED CCSc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1 541719076 XSSJMSVROYILLX-HNNXBMFYSA-N 399.928 5.461 30 20 GKED CN(C(=O)Cc1ccccc1F)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 543109525 QHHBRAPNBYASFW-MRXNPFEDSA-N 393.302 5.149 30 20 GKED N#CCCCN[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 543980433 FKOCUUDAIVDJPW-NSHDSACASA-N 378.238 5.221 30 20 GKED CCN(C(=O)[C@H](C)CC(=O)c1ccc(Cl)cc1)[C@H](C)c1ccc(C#N)cc1 546794694 LXORKBXZWYVJBH-HZPDHXFCSA-N 382.891 5.030 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)[C@@H](C)Cc3cncc4ccccc34)c2C#N)C1 565266437 NUHANJJGFQMUEB-GJZGRUSLSA-N 389.524 5.110 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1Cn1ccnc1 569393518 HKPJUSWEIITGHH-UHFFFAOYSA-N 388.515 5.105 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(C)[C@H]1CCCc2ccccc21 574386658 DEHCIHRIPMWESJ-UWJYYQICSA-N 393.556 5.029 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](F)(c2ccccc2)C1 576532172 HTENKYRIJJXMFQ-IERDGZPVSA-N 383.492 5.183 30 20 GKED N#Cc1csc(/C=C(/c2nc3ccccc3[nH]2)c2nc3ccccc3s2)n1 578567060 YFEHKQZWFJYETE-LCYFTJDESA-N 385.477 5.090 30 20 GKED N#CC1(NC(=O)Cc2sc(-c3ccccc3)nc2-c2cccs2)CCCC1 585705296 LLKMQFJMFXEYBK-UHFFFAOYSA-N 393.537 5.034 30 20 GKED N#Cc1ccc(CN2CCC[C@H](c3nc4ccccc4o3)C2)c(C(F)(F)F)c1 589494113 DXAFJBXBFXFLBP-INIZCTEOSA-N 385.389 5.098 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c1 589739084 HPSYJNFKVYONPV-NZQKXSOJSA-N 394.515 5.273 30 20 GKED N#C[C@@H](C(=O)c1cccc(C(F)F)c1)c1nc2cc(C(F)(F)F)ccc2s1 591020072 MQZPDYQBMIGXDD-LBPRGKRZSA-N 396.340 5.743 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2cccs2)cc1 596106324 OHWKZTNKOHLKSZ-LAUBAEHRSA-N 381.545 5.296 30 20 GKED C[C@H](Nc1cc(Br)cc(Br)c1)c1cccc(C#N)c1 600852597 QIESRTSPCHLXDW-JTQLQIEISA-N 380.083 5.256 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccccc3OC3CCC3)n2)cc1 605362541 JXNDGDBWBVSJHG-IBGZPJMESA-N 388.492 5.540 30 20 GKED CCc1c(C)sc(NC(=O)C(C)(C)c2cccc(C(F)(F)F)c2)c1C#N 609031203 FNDJUNUARAVSEC-UHFFFAOYSA-N 380.435 5.426 30 20 GKED Cc1ccc(CCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 609378601 YARCKVYFJDCYMS-UHFFFAOYSA-N 392.446 5.591 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)c1c(Cl)cc(C#N)cc1Cl 611094232 BXPPFJGMPUIFOR-BTDLBPIBSA-N 397.689 5.024 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)cc1)c1nc2cc(Cl)ccc2s1 613403950 XRYIECUYUMNOMH-LBPRGKRZSA-N 380.778 5.459 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619754902 OGSTYLLJJQKOCK-INIZCTEOSA-N 376.887 5.738 30 20 GKED O=C(Nc1cc(Cl)ccc1F)NC(CCC(F)(F)F)CCC(F)(F)F 665249904 ATNLEQLGRHBOJX-UHFFFAOYSA-N 394.718 5.654 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1 680523642 HJHRLIUEDADYPC-AWEZNQCLSA-N 393.247 5.050 30 20 GKED C[C@]1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCCc2ccccc21 726323033 WLVNMYAUNISFMH-VFNWGFHPSA-N 380.900 5.420 30 20 GKED C[C@H](NC(=S)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 726480769 LITACIWNFPZZAH-AWEZNQCLSA-N 379.510 5.460 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)NCc1ccc(C#N)cc1 726849369 PEESFPFQLOIDCI-UHFFFAOYSA-N 375.859 5.509 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(-c2ccc(F)cc2)s1 728440081 IKVVVHBQKGGSKJ-VOTSOKGWSA-N 381.259 5.491 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1ccc2ccccc2c1 730954794 KUVHVEHCUMHLNE-OAHLLOKOSA-N 377.538 5.900 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(Cl)nc3Cl)cc2)c1 731331546 ITASGDGJVPRLJR-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1sc2ncn(N=Cc3ccc([C@@H]4C[C@@H]4C)o3)c(=O)c2c1-c1ccccc1 732764131 PYUMDAAUMUYBCS-SUMWQHHRSA-N 389.480 5.032 30 20 GKED Cc1ccc(C2CC(=NNc3cc(C(F)(F)F)nc(-c4ccccn4)n3)C2)cc1 733081269 SNFNEWHBDYKOOP-UHFFFAOYSA-N 397.404 5.211 30 20 GKED COc1ccc([C@@H](Nc2snc(Cl)c2C#N)c2ccccc2Cl)cc1 739898731 CPUAQHPBIBBMDV-MRXNPFEDSA-N 390.295 5.532 30 20 GKED FC(F)(F)c1ccn(-c2ccc(C=NOc3ccccc3C(F)(F)F)cc2)n1 754709020 HWNFMOGOWLYETP-UHFFFAOYSA-N 399.294 5.323 30 20 GKED CC(=O)N(c1nc(CN(CCC#N)CC(C)C)cs1)c1c(C)cc(C)cc1C 755668504 CNZPKCWPWXJQKA-UHFFFAOYSA-N 398.576 5.125 30 20 GKED N#CCCn1ncc(C(=O)Nc2cccc(SC(F)F)c2)c1-c1ccccc1 758256195 GXVVFWJFLPNJEA-UHFFFAOYSA-N 398.438 5.031 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12 759213483 BMYHWSDLADTBHH-NLBZTSMMSA-N 388.854 5.244 30 20 GKED C[C@@H](NC1(c2c(Cl)cccc2Cl)CCC1)c1ccc(OCC#N)cc1 774510991 UJAGNCDHZFKMFA-CQSZACIVSA-N 375.299 5.626 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](COc1ccccc1)c1ccccc1 775393104 DDINVTIBIURMGM-JOCHJYFZSA-N 392.886 5.152 30 20 GKED N#Cc1cc(N[C@@H](c2ccc(F)cc2)C2CCCC2)ccc1N1CCC(O)CC1 777114295 IMTPFYWOXKQDMT-XMMPIXPASA-N 393.506 5.002 30 20 GKED COc1ccc(N[C@H](C)c2ccc(C#N)cc2F)cc1NC(=O)C1CCCCC1 781420268 AXUGJUXURLYDIL-OAHLLOKOSA-N 395.478 5.398 30 20 GKED Cn1nc(Br)cc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 782300637 HMGLRZYGKJSINF-GORDUTHDSA-N 394.483 5.039 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)CC1CCC(C(F)(F)F)CC1 783386299 PCCXVRKWQCNRHV-UHFFFAOYSA-N 389.801 5.275 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)c1ccc(Cl)c(C(F)(F)F)c1 788027513 DDSOUZPCQFIWFQ-UHFFFAOYSA-N 397.813 5.108 30 20 GKED C#CCC1(C(=O)Nc2cccc(C[S@@](=O)C3CCCCC3)c2)CCCCC1 788226181 VYLHTIXMJCYXCR-HHHXNRCGSA-N 385.573 5.180 30 20 GKED C[C@@H](N[C@H]1c2cccc(Br)c2CC1(C)C)c1ccc(OCC#N)cc1 813885097 QCTPZTHHRHUPLP-VLIAUNLRSA-N 399.332 5.326 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCC2)c(F)c1 815635866 KJTDUTAMCVWWHQ-XXBNENTESA-N 379.523 5.902 30 20 GKED C[C@@H](NCc1c(F)cc(F)cc1F)c1ccc(OC(F)F)cc1OC(F)F 815650330 OQUHDWCFXZUVLQ-MRVPVSSYSA-N 397.290 5.158 30 20 GKED C[C@@H](CC(C)(C)C#N)OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 851209352 FBCJUMDKOQMBQD-NSHDSACASA-N 382.407 5.314 30 20 GKED C=C[C@H](CC)CC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 902650258 YWXBWGJKHYVALI-GFCCVEGCSA-N 380.366 5.092 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)c(OC)c1OC 916131455 DSAHKZABFMJSQS-DHZHZOJOSA-N 388.419 5.508 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCOc3c(C)cccc3C)n2)cc1 916974836 SAIQVBIAURFORW-IBGZPJMESA-N 390.508 5.381 30 20 GKED N#C[C@@H](C(=O)CCC1CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 917042597 GPQVLVMMHNJUBF-AWEZNQCLSA-N 380.435 5.852 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc2c(c1)Nc1ccccc1S2 1776083561 NNJPEDKXSTUAMY-UHFFFAOYSA-N 389.480 5.358 30 20 GKED C=CCC[C@@H](CC(C)C)C(=O)NCc1ccccc1-c1cccc(C(=O)O)c1 1776166412 YTIAONTZPVPALQ-IBGZPJMESA-N 379.500 5.297 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1ccc(C(F)(F)F)cc1 1776180273 PCCHYHNZVBHAQG-HNNXBMFYSA-N 389.826 5.234 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cc1)C(=O)O 1776469804 NOERWUYBHGEXNM-BMGYJQCNSA-N 396.439 5.302 30 20 GKED CCCCCCOc1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776789227 PKILTSOYRQINLM-VKAVYKQESA-N 382.456 5.458 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1OC 1776801309 KEUQZCRECUBKOK-VQHVLOKHSA-N 382.456 5.085 30 20 GKED CCc1nc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cs1 57344691 MLHZKROHKVVKDQ-GOSISDBHSA-N 395.915 5.196 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1ccc(OC(F)(F)F)cc1 61139069 UONSNXIZYFFDIO-UHFFFAOYSA-N 389.826 5.057 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc4c3CCCC4)n2)cc1 66544836 ACURLRQVBXJNDO-MRXNPFEDSA-N 389.505 5.112 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C(F)(F)F)c3)n2)cc1 66545024 GSONKUFWDZWTLW-INIZCTEOSA-N 397.381 5.191 30 20 GKED Cc1cnc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)o1 66811606 HGYXTJLOPRLDEX-UHFFFAOYSA-N 379.419 5.441 30 20 GKED COc1c(C)cc(CN(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 108532411 ICKZVBOLCHFQJT-OAHLLOKOSA-N 397.544 5.228 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)/C(=C/c1ccc(F)cc1)c1cccs1 120098397 GVFCNRAGNMGIHX-SFQUDFHCSA-N 396.418 5.108 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3nnc(-c4ccccc4)s3)c2)cc1 121348789 GBMKKZWNCWREEX-UHFFFAOYSA-N 384.464 5.481 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 124025761 LCNQDDOUJXUGME-NQIIRXRSSA-N 398.462 5.238 30 20 GKED C=CCOc1ccc(CNc2cccc(CS(=O)(=O)C3CCCCC3)c2)cc1 132500466 ZCPZMZPIIYSURG-UHFFFAOYSA-N 399.556 5.111 30 20 GKED C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccco1)c1ccc(C#N)cc1 157524467 WVQHPUQMOOKVEG-AWEZNQCLSA-N 392.509 5.373 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccn2)ccc1Cl 165664154 YAJHRFZJQATRLP-UHFFFAOYSA-N 391.858 5.313 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 171797172 SSNFBFQJJQPBIZ-YOEHRIQHSA-N 385.439 5.179 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc(-c2ccncc2)cs1 176555898 OLQDMCYRLYUQHG-INIZCTEOSA-N 387.420 5.080 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c2c1 177605216 IKAZWGYIFMKCPN-INIZCTEOSA-N 392.409 5.030 30 20 GKED C[C@@H](Cc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 179224416 MTHJLHSKUQCYMC-GXTWGEPZSA-N 387.817 5.140 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(Sc2nncs2)cc1)c1ccccc1 186942823 UZYCUXKPEWOERX-GOSISDBHSA-N 381.526 5.378 30 20 GKED C[C@H]1C[C@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 245739603 GAFMCFXHAFINGN-MQJTVSLUSA-N 382.891 5.138 30 20 GKED N#C[C@H](C(=O)/C=C/c1cccc(F)c1)c1nc(-c2ccc(Cl)cc2)cs1 301765465 SWZAVEUAAYELTC-MDGVGCGJSA-N 382.847 5.492 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCCO2)N1CCCC[C@H]1c1ccccc1 329629719 VEHYCEHQMQOODJ-SFHVURJKSA-N 386.879 5.274 30 20 GKED CCC(C)(C)/N=C(/O)c1ccc(NC(=O)[C@H]2CCCC(F)(F)C2)cc1Cl 330416977 VLBQXAKHJXLSMB-LBPRGKRZSA-N 386.870 5.597 30 20 GKED N#CCCCOc1cccc(N[C@H](Cc2cccnc2)c2cccc(Cl)c2)c1 426065527 ZQSWAFWQBJRNSA-HSZRJFAPSA-N 391.902 5.813 30 20 GKED CCN(C(=O)c1cccc(SCC#N)c1)C(c1ccccc1)c1ccccc1 429858614 GRQSXTFTPORZOU-UHFFFAOYSA-N 386.520 5.554 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431811177 QMCHQHDASLNZKT-AVRDEDQJSA-N 379.504 5.269 30 20 GKED N#CCCC[C@H](NC(=O)NCC1(c2cccc(Cl)c2)CC1)c1ccccc1 431973533 QELBXFLNODBVBH-FQEVSTJZSA-N 381.907 5.106 30 20 GKED CN(C)c1cc(C#N)cc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)c1 432070291 WVOXFWSEFSDSMC-UHFFFAOYSA-N 398.491 5.153 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)SCc2ccc(C#N)cc2OC(F)F)c1C 439526592 IEVLRFMMWWREMT-CQSZACIVSA-N 390.455 5.037 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 441291313 RGZQYZSZQXJKPX-LBPRGKRZSA-N 387.270 5.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(C)(C)OC(C)(C)C1 443577647 NAEGIKAGHPLDOW-UHFFFAOYSA-N 393.487 5.080 30 20 GKED CC[C@@H](NCc1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccc(C#N)cc1 447531270 QODYNYVONIOJOL-HSZRJFAPSA-N 387.458 5.191 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(CC#N)cc1Cl 455740902 ZBOPLSDEIBOVEP-QGZVFWFLSA-N 395.812 5.530 30 20 GKED C[C@@H](c1ccc(C(=O)N(CCC(F)(F)F)CC(F)(F)F)cc1)C(F)(F)F 456036683 WYIWNSFZQYHFOP-VIFPVBQESA-N 395.265 5.309 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1)c1cccc(C#N)c1 462076322 NTWWNXCOYKDRHS-KRWDZBQOSA-N 393.446 5.641 30 20 GKED C[C@H](C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462503068 PTGGOIWBXMDYFT-YWZLYKJASA-N 386.417 5.434 30 20 GKED N#Cc1ccc(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)c(F)c1 462893611 DCZBMKYMBGRPKP-UHFFFAOYSA-N 387.336 5.516 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](c1cccc(SC)c1)c1cc(F)ccc1F 466242109 FCZUAFQOFGLIFO-FQEVSTJZSA-N 388.483 5.160 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1CCC(F)(F)F 467949812 QUSDHAKWNQUXLX-UHFFFAOYSA-N 376.422 5.792 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 471911810 OSGPTQOTNOOQOA-GOTSBHOMSA-N 389.543 6.066 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cnc4ccccc4c3)cc2)cc1 475251705 AQAFDDZDVUKUGY-UHFFFAOYSA-N 379.419 5.080 30 20 GKED N#CC[C@@H](CC(=O)N1CCSC[C@H]1c1ccc(Cl)cc1)c1ccccc1 476055384 VUUNMGIIIXTSQP-ICSRJNTNSA-N 384.932 5.044 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CN[C@@H](c1ccccc1)C(F)(F)F 476785329 JXJKUSSYTUZXGB-NRFANRHFSA-N 390.449 5.370 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc3occ(C)c3c2)cc1C 480081204 NHASORFNNNIYPC-UHFFFAOYSA-N 398.466 5.388 30 20 GKED N#Cc1cccc(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)c1 480787908 SKDALYVKDOAZRP-GOSISDBHSA-N 379.916 5.502 30 20 GKED C[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(Br)s1 481988747 GOIHAMJUSURCFD-BLLLJJGKSA-N 375.335 5.501 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1C 482805631 RGUYVXMPTIPCDE-OAHLLOKOSA-N 390.512 5.438 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(OCCC(C)C)c1 483234558 KGHMPTWJTHNNTQ-OAQYLSRUSA-N 388.467 5.158 30 20 GKED C=CCN(CC1CCCCC1)C(=O)NCc1ccc(Oc2cccnc2)c(F)c1 483913769 KGULDVLUSGKSER-UHFFFAOYSA-N 397.494 5.291 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)[C@H](OC)c1ccc(Cl)cc1 486236263 XFKHTQFACIZFPH-LIRRHRJNSA-N 375.921 5.124 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1ccccc1 487517337 TYHUSGXEULUHBB-SFHVURJKSA-N 397.450 5.253 30 20 GKED Cc1ccc(NC(=O)[C@@H](NCC(C)(C)CCC#N)c2ccccc2)cc1Cl 487838828 NPMJLDKRCUHMBE-FQEVSTJZSA-N 383.923 5.248 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1sc(Cc2ccc(F)cc2)nc1C 493678806 QBLGKJWAMCMAKX-UHFFFAOYSA-N 386.517 5.071 30 20 GKED CC(C)N(Cc1ccco1)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 494297741 ITURGNKOLJULTP-UHFFFAOYSA-N 378.403 5.133 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4ccccc4n3)c2)cc1 501443779 NYEIIXHONAEYCA-UHFFFAOYSA-N 393.446 5.132 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2cnoc2-c2ccco2)cc1F 513784065 KLHYFHSWRWGZNL-UHFFFAOYSA-N 375.359 5.350 30 20 GKED COc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(C)c1 517338673 MKPYNLFGATYORD-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C=CC1CCN(C(=O)c2ccccc2CSc2nc3ccccc3o2)CC1 518908122 OELFZMOKQVVXNM-UHFFFAOYSA-N 378.497 5.158 30 20 GKED C[C@@H](NC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)c1ccc(C#N)cc1 520100604 AIOAAKHTNRPLQQ-OPAMFIHVSA-N 390.870 5.209 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccccc3C(F)(F)F)c2)c1 520221200 XIBKWAFPWLOMCH-UHFFFAOYSA-N 396.412 5.446 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1 523699188 APSXGTNAILLWGG-AEFFLSMTSA-N 387.405 5.184 30 20 GKED CCC[C@H](CCc1ccccc1)NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 525573072 UPRUJDIBMSWFKD-JOCHJYFZSA-N 399.494 5.277 30 20 GKED N#CCCCOc1cccc(NC(=O)C[C@H](Cc2ccccc2)c2ccccc2)c1 525654297 ZUVZHEVKDVNFIO-QHCPKHFHSA-N 398.506 5.724 30 20 GKED CCC[C@@H](C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 532072698 GWBOWHQRUDTYDH-IBGZPJMESA-N 389.524 5.137 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc([C@H]2CCCOC2)c1 534300925 JWTNSRWATBHDED-APWZRJJASA-N 380.513 5.085 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 534520038 SHDOBJKVKGYAGE-UHFFFAOYSA-N 387.555 5.663 30 20 GKED C=CCC[C@H](NCc1cnc([C@H]2CCCO2)s1)c1ccc(C(F)(F)F)cc1 535184985 ITCXOEBZGAPHII-ZWKOTPCHSA-N 396.478 5.811 30 20 GKED N#Cc1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl 537167201 VYNBIUFZGGDXDH-UHFFFAOYSA-N 390.830 5.108 30 20 GKED N#CC1(c2ccc(C(=O)Nc3nc4c(C(F)(F)F)cccc4s3)cc2)CC1 538492352 JLUKTZBCXZMXCQ-UHFFFAOYSA-N 387.386 5.123 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@H](c1ccc(C)cc1)c1cccnc1 556845498 ZOIMEIGYTDROCE-ISJGIBHGSA-N 395.506 5.003 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C 558819542 KUVMQISHVQKECY-ZXJUBJKJSA-N 386.967 5.139 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591844252 YODBNNXJDDUITF-UHFFFAOYSA-N 390.377 5.622 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c(C)n1C1CCCCC1 592974399 RRDVYNPUWDPDOE-GOSISDBHSA-N 395.503 5.849 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N1Cc2cccc(C#N)c2C1 593152374 VZTZGSMQJIOSPG-UHFFFAOYSA-N 391.540 5.839 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(C[S@@](=O)C3CCCCC3)c2)cc1 594504033 FWDPHOGILZBFQG-MUUNZHRXSA-N 394.584 5.681 30 20 GKED N#CC1(CC(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)CCCCC1 596809101 LJUFEVKXKCJQEX-UHFFFAOYSA-N 385.483 5.147 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cn2)c1 603621686 PRLYRHVLXPJHRB-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)nc1)c1nc2cc(F)ccc2s1 603627381 BRYUNLODGBOIQW-INIZCTEOSA-N 389.411 5.113 30 20 GKED COc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603673241 QIHSZQNSGMWWQB-LJQANCHMSA-N 376.843 5.256 30 20 GKED CC(C)=C[C@H]1[C@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1(C)C 604003416 ABKIPROAUYSJLC-JTHBVZDNSA-N 388.511 5.509 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 605236079 HYNJTJZAEHUTEL-AWEZNQCLSA-N 393.314 5.461 30 20 GKED CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1cc2ccccc2n1CC#N 609171731 AEECOYBDWGSANP-QFIPXVFZSA-N 387.527 5.428 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1ccc(Cl)c(Cl)c1 609370835 AYHZDVVBKHVLNT-GFCCVEGCSA-N 395.311 5.263 30 20 GKED N#C[C@@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1ccc2ccccc2n1 613292716 RFDAAOUGSPPZNO-JOCHJYFZSA-N 394.499 6.017 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](N[C@H]2CCc4cc(C#N)ccc42)CCC3)cc1 618805752 KFBSDHMNTXLTLB-SFTDATJTSA-N 385.536 5.645 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)Nc3sc(C)c(C)c3C#N)c(C)c2c1 641859809 SKPQBFJHGABEID-UHFFFAOYSA-N 380.469 5.065 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@@H](CC(F)(F)F)C1 666866698 YQUAZTZMTWEYEG-HOCLYGCPSA-N 384.442 5.112 30 20 GKED COc1ccccc1/C(C)=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 727628670 VXAGNNUXGCRIMA-BAILOTOSSA-N 388.492 5.407 30 20 GKED N#C[C@H](C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1nc2cc(F)ccc2s1 730416855 JAMDIXQWVIBAIE-KGLIPLIRSA-N 392.377 5.348 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@@H](C)c1ccccc1 733808054 YMZZACIJEDTQLN-SIKLNZKXSA-N 393.531 5.440 30 20 GKED C=CC[C@@H](NC(=O)c1csc(-c2ccc(OC(C)C)cc2)n1)c1ccncc1 734361208 RNLYZPOXOOXAFW-LJQANCHMSA-N 393.512 5.040 30 20 GKED C=CC[C@@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccncc1 734509236 JMUWZEUSNRLFAQ-GOSISDBHSA-N 389.446 5.631 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/C[C@@H](O)c1cc(Cl)cc(Cl)c1 735618864 GOLNYHRJYHVIKG-QFAMHRKESA-N 379.070 5.158 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@@H]2c2ccc(C)o2)c1 739023268 LJHGFWFFDLFXTR-TZIWHRDSSA-N 395.503 5.096 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156974 SGLPDJYNQWLDKJ-YOEHRIQHSA-N 381.426 5.364 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccnc4ccccc34)n2)cc1 741111432 NRENDIFRUVSSFU-PISNEZEASA-N 395.487 5.556 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccc(F)c1 744037814 DWIVESLOGJVTLQ-QMTHXVAHSA-N 392.377 5.434 30 20 GKED CC(C)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 747930114 YAADZTKZIMZGEF-QRWLVFNGSA-N 376.422 5.483 30 20 GKED CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 748942410 PJVHBIFZXUGVBG-BHDDXSALSA-N 393.556 5.528 30 20 GKED CC[C@H](Oc1ccccc1F)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749027222 YXFWWMLHWQKCOB-APWZRJJASA-N 394.471 5.292 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 749034295 ZONRPMLIKIWMAW-WFASDCNBSA-N 388.851 5.123 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C/SCc2ccco2)cc1 754223216 GPAKGQFVBMPNMR-ACCUITESSA-N 376.437 5.329 30 20 GKED CC(C)n1c(C(F)(F)F)nc2cc(C(=O)OCC3CCC(C#N)CC3)ccc21 755964796 RZVXKCKODJEJIR-UHFFFAOYSA-N 393.409 5.123 30 20 GKED CCOc1ccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)cc1[N+](=O)[O-] 765615963 JJBPGJZGWNNBIF-VOTSOKGWSA-N 386.454 5.075 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 769772886 DUCRFHDUTFGGGA-SWLSCSKDSA-N 399.313 5.429 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 770334084 FMYIIOHSOWTPKS-UHFFFAOYSA-N 385.851 5.119 30 20 GKED N#C[C@@H](C(=O)CC1(CSc2ccccc2)CC1)c1nc2cc(F)ccc2s1 770862819 VAIIOAOOGAYPEY-INIZCTEOSA-N 396.512 5.574 30 20 GKED N#C[C@H](COC(=O)c1ccc(-c2nc3ccccc3s2)o1)Cc1cccs1 772734213 GJYZBJJFJNSQHW-CYBMUJFWSA-N 394.477 5.157 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ccc3c(Cl)cccc3n2)ccc1OC 785831146 WMBQSMAOPLOLBM-OAHLLOKOSA-N 381.863 5.190 30 20 GKED O=C(/C=C\c1ccc(C(F)F)cc1)c1ccc(N2CCOCC2)cc1Cl 794940648 CARFAKHFIKWARF-BAQGIRSFSA-N 377.818 5.010 30 20 GKED CC1CCC(OCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CC1 796651635 QVNUNYPYPIJINW-UBHUBRDASA-N 396.434 5.087 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@](F)(c3ccccc3)C2)cc1 801611037 AFXMMKCSUDQMPM-ZCYQVOJMSA-N 399.469 5.445 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)c1cc(F)c(C(F)(F)F)cc1F 804403081 WCYQSUHKRLKLOU-UHFFFAOYSA-N 383.238 5.341 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)c1 825123460 VVGCLYIITDSUPR-OAQYLSRUSA-N 382.385 5.178 30 20 GKED N#C[C@H](C(=O)CSCc1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842942420 OTEVGQRHHPCSHQ-CYBMUJFWSA-N 397.352 5.437 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)ON=Cc2cccc(Cl)c2Cl)c(Cl)c1 852120757 ZQHBWZCZBIAMFC-GFCCVEGCSA-N 399.705 5.641 30 20 GKED CC(C)c1nn(C)c(Cl)c1C=NNc1ccc(Cl)cc1Br 853438584 HFTRLQJPSMGUTN-UHFFFAOYSA-N 390.112 5.059 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC1CCC(F)(F)CC1 901737042 KEOYNTHRIWLNTI-ZDUSSCGKSA-N 384.517 5.330 30 20 GKED Fc1ccc(NC(=S)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 914707647 XXPVFNNLHOFEMD-IUCAKERBSA-N 388.352 5.022 30 20 GKED Cc1cccc(C)c1OCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915179204 BFBJXCLLVXSHNR-HSZRJFAPSA-N 384.479 5.367 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917043760 OLHDIEGFGUWOHP-WFASDCNBSA-N 388.414 5.685 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(Cl)c(Cl)[nH]1 919893995 VNVSXAFCTQDIKA-UHFFFAOYSA-N 386.238 5.546 30 20 GKED Cc1cc(NN=C2CCCc3cc(C(=O)O)ccc32)nc2ccc(Cl)cc12 1776021467 GQGHNYSWJBSZCP-UHFFFAOYSA-N 379.847 5.047 30 20 GKED COc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c2ccccc12 1776132703 CCVAVNUUMSYPOU-TWGQIWQCSA-N 388.444 5.657 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cn(CC(=O)O)nc2-c2ccccc2)cc1 1776697679 MJXRLDOWGYFMBR-NJWFCXLTSA-N 388.467 5.044 30 20 GKED CCCCCCCOc1cccc(CNCC2(CC(=O)O)CCCCC2)c1 1776788711 QDVVDQILIDDPFP-UHFFFAOYSA-N 375.553 5.551 30 20 GKED CCCCCOc1cc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)ccc1OC 1776793038 IABCAVAYZFOMQS-MBGNVJMVSA-N 394.467 5.102 30 20 GKED CCn1c2ccccc2c2cc(/C=C3/CCc4oc(C(=O)O)c(C)c4C3=O)ccc21 1777002835 JFYRXZPYESJHBR-VBKFSLOCSA-N 399.446 5.627 30 20 GKED Cc1ccccc1C(=O)/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)o1)c1ncc[nH]1 1777465221 WXXHJJWGZXBACY-ZHZULCJRSA-N 398.418 5.100 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cccc(CC(=O)O)c2)cc1 1777472327 YHDPSKVPEJSIKO-ZROIWOOFSA-N 386.447 5.097 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ccc(/C=C\C(=O)O)cc1 1777487697 FQVNPLYEYDYUSN-QXFGSWAMSA-N 393.439 5.252 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)c3oc4ccccc4c3C)CCC2)cc1 1791587679 FBUBBOMTSMOLES-UHFFFAOYSA-N 388.467 5.065 30 20 GKED C[C@@H](C#N)Sc1nnc(-c2ccc(Br)cc2)n1C1CCCCC1 6454320 BFLTVXNVHKXJDR-LBPRGKRZSA-N 391.338 5.217 30 20 GKED Cc1ccsc1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 25998215 GUKRLOMISAIHHZ-UHFFFAOYSA-N 378.522 5.151 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 33178759 WGPLOTODQKYOKY-HNNXBMFYSA-N 394.396 5.735 30 20 GKED Cc1cccc(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 46861525 OSHAGVMRUBKRKK-NRFANRHFSA-N 390.870 5.321 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c1 60036227 IFPKBYYHGCYCNS-SFHVURJKSA-N 385.467 5.407 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3cccc(F)c3)n2)cc1 69286475 SWZDIOLOITYJOS-IFXJQAMLSA-N 394.471 5.013 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1cccnc1 116639016 ZLYNUALEJHAIQX-UHFFFAOYSA-N 377.831 5.066 30 20 GKED Cn1c([C@@H](C#N)C(=O)CCCc2cc(Cl)sc2Cl)nc2ccccc21 119829690 BIGNRKFPRCEHJL-LBPRGKRZSA-N 392.311 5.141 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1nc(C)cs1 124506422 CQRXHWDWNMOZEW-UHFFFAOYSA-N 377.469 5.091 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1c(Cl)ccc(Cl)c1Cl 133313784 SNVHEBFVESGEPH-SNVBAGLBSA-N 399.730 6.151 30 20 GKED C=C[C@H](CC(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl)c1ccccc1 133350389 NCZNNLSLHKNYKH-MRXNPFEDSA-N 384.907 5.119 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1c(F)cccc1F 153463232 XSQBTXFFZSBVDW-KOLCDFICSA-N 376.815 5.208 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2noc(Cc3ccccc3)n2)cc1 165462411 RLYVSIWBZJHFKZ-IAGOWNOFSA-N 397.906 5.204 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC[C@H]1c1nc2ccccc2s1 171136155 ZETMLQBMJQSIPC-INIZCTEOSA-N 393.516 5.093 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3ccccc3SCCC#N)c2)cs1 173134032 BLMPJTVIBXJVTP-UHFFFAOYSA-N 379.510 5.377 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccnc1 177847545 UIKHRMSXHDZPQD-WMZOPIPTSA-N 382.533 5.037 30 20 GKED CCN(C(=O)CCc1nc(C)c(-c2ccccc2)o1)c1ccc(C#N)c(Cl)c1 179523831 RNNSPHHBOKPLOS-UHFFFAOYSA-N 393.874 5.161 30 20 GKED N#Cc1c(NC(=O)c2ccc(Cl)cc2C(F)(F)F)sc2c1CCCC2 184694080 RKHMFJUBXBXYRH-UHFFFAOYSA-N 384.810 5.423 30 20 GKED COc1ccc(-c2ccc(CNCc3ccc(N(C)CCC#N)cc3)cc2)cc1 237432650 YRLLRZBSBBPLLS-UHFFFAOYSA-N 385.511 5.002 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)c1 237882020 FLEFUIPOYXVECB-XMMPIXPASA-N 390.914 5.902 30 20 GKED CCOc1c(Cl)cc(C=NO[C@@H](C)c2ncc(C(C)(C)C)o2)cc1OC 255469678 QVEMEPAGJNCNSO-LBPRGKRZSA-N 380.872 5.145 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c(-c2ccncc2)n1 255847568 SLPYCKYEOFUIRP-HYXAFXHYSA-N 391.780 5.050 30 20 GKED N#Cc1cnc2ccc(OC(F)F)cc2c1NCc1coc(-c2cccs2)n1 301072399 GYGPPUAKSFYHHS-UHFFFAOYSA-N 398.394 5.036 30 20 GKED Cc1ccc(C)c(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 303202295 OODJQTOPWFGXML-GOSISDBHSA-N 380.900 5.499 30 20 GKED CN1CCC[C@H](C/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)[C@@H]1c1cccs1 328852673 VUCHRFDFHUJJOK-DNVCBOLYSA-N 397.544 5.015 30 20 GKED COc1cc(N=C(O)C2CCSCC2)ccc1N=C(O)C1CCSCC1 329245976 VMHINNFEESBEHF-UHFFFAOYSA-N 394.562 5.158 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@H](C)C3)n1 411011732 MFTMWWCNVQTQGK-WDEREUQCSA-N 388.924 5.125 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cccc(SCC#N)c1 429958871 BNYYMAZNROJCIT-ZDUSSCGKSA-N 378.419 5.154 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC[C@@H]2CCC(F)(F)C2)cc1F 432245376 HXHNRUFCIWQMCI-CYBMUJFWSA-N 389.377 5.047 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1cc(Br)ccc1Cl 436101136 HAYXCJFLYMUQHN-FQEVSTJZSA-N 376.747 5.071 30 20 GKED COc1cccc(CCC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 437467592 NQBCFJGJJXXLBE-UHFFFAOYSA-N 390.414 5.070 30 20 GKED C=CCN(C(=O)c1cccc(F)c1SC)c1nc(-c2ccccc2)cs1 439144036 FCRCIWFCMPIFHS-UHFFFAOYSA-N 384.501 5.504 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1ccc(Cl)cc1 453470105 ZHBYEOWBQAVUOW-MOPGFXCFSA-N 386.927 5.091 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457713911 RYCJGHNUJYGWBW-XVKPBYJWSA-N 381.238 5.014 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2c(Cl)cccc2C#N)cn1 462786532 ZDUVCWLSNRLIMJ-UHFFFAOYSA-N 379.847 5.410 30 20 GKED CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H](c1ccccc1)c1ccc(F)cc1 463952036 QQZLADLXDHWDFS-KOSHJBKYSA-N 386.470 5.439 30 20 GKED CCSCc1ccccc1C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 468261922 XSYBDHKMSDKDSH-UHFFFAOYSA-N 394.418 5.005 30 20 GKED N#CCCCOc1cccc(NC(=O)CC2(CSc3ccccc3)CC2)c1 471739405 GGRZICFRYQKCIR-UHFFFAOYSA-N 380.513 5.270 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N(CCC)Cc1ccc(C#N)cc1 471880007 JHDKCZSWXQAVJE-UHFFFAOYSA-N 377.532 6.078 30 20 GKED COCCC1(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCCC1 473784785 IWMALOVZWXTBMP-UHFFFAOYSA-N 393.487 5.069 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)C[C@H](CC#N)c1ccccc1 475458911 OMGNVSCGSBJPIS-ZBFHGGJFSA-N 375.299 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCOc2c(F)cccc21 475544311 AUMVBQZWDZKZJV-FQEVSTJZSA-N 382.479 5.713 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 475547108 IMDPPDNTTVSRES-IBGZPJMESA-N 399.538 6.483 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H](OC)c1ccc(F)cc1 475576367 SZRXHJWKJWQBCU-KSFYIVLOSA-N 384.495 5.575 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(F)cc1-c1ccc(F)cc1)c1ccccc1 475612139 MSSULWNQUOCZKG-SFHVURJKSA-N 376.406 5.658 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 476205682 QDISYRHREGWLDA-CRAIPNDOSA-N 382.435 5.023 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C)[C@@H]1c1ccccc1 480821131 GWMVCVONEXDZJQ-HOYKHHGWSA-N 397.478 5.884 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2c(F)c(F)cc(F)c2F)c1 481853777 AFULUTLUBOTLFK-UHFFFAOYSA-N 397.315 5.458 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 481996138 AONGCUHZZRVHPD-IBGZPJMESA-N 389.377 5.043 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)[C@@H](C)c1ccc(C#N)cc1 482409575 QIPCTRYZDAVWQK-SFHVURJKSA-N 395.462 5.446 30 20 GKED C=CCN1CCC(N[C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1 482628525 KJBIRRWKVIFSQE-LBPRGKRZSA-N 380.376 5.025 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 483190093 AJFKXRUYZJQOCX-BFUOFWGJSA-N 387.405 5.501 30 20 GKED Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 485779146 UZSDWSYGRNSAPX-SFHVURJKSA-N 389.480 5.174 30 20 GKED Cc1nc(-c2ccc(C(=O)N[C@H](CCCC#N)c3ccccc3)cc2)cs1 487367228 BLPATKPOUXAYKG-HXUWFJFHSA-N 375.497 5.284 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccccc3COc3ccccc3)CC2)cc1 503871130 JIJBLWUSMYSVSS-UHFFFAOYSA-N 394.474 5.067 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(OCC(C)C)c(OC)c1 505254709 NHASFPISKZBOJN-LJQANCHMSA-N 396.531 5.189 30 20 GKED CSc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 505297552 ITXYQBNZNQMODE-HUUCEWRRSA-N 385.558 5.543 30 20 GKED CC1(C#N)CCN(C(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)CC1 507826780 DCVQKMVJRWCRCO-UHFFFAOYSA-N 389.282 5.552 30 20 GKED COCCC[C@@H](c1ccc(Cl)cc1)c1noc(-c2ccc(CC#N)cc2)n1 508672302 RHORJESTSAHACB-IBGZPJMESA-N 381.863 5.015 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1csc(-c2ccco2)n1 510207847 MBCUVIYLCYTAHB-UHFFFAOYSA-N 375.478 5.629 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(Oc2ccccc2)cc1 510457989 MGZVGAWIMJULQW-SFHVURJKSA-N 385.467 5.253 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCC(C)(C)CCC#N)C1CC1 513122270 DDGIYODXPDURHC-AWEZNQCLSA-N 381.442 5.270 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)s1 513143371 NBIKDJJMPWPCDA-CQSZACIVSA-N 387.386 5.022 30 20 GKED CCCOc1nc(C(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc2ccccc12 513484837 PJTBSAVVIANUDP-KRWDZBQOSA-N 387.483 5.119 30 20 GKED CCSCc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1 515639965 PQYNGABHYKAFAP-UHFFFAOYSA-N 393.537 5.111 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1cccc(C(F)(F)F)c1 517605415 CMQVNAHUQJDGQW-ACRUOGEOSA-N 394.396 5.343 30 20 GKED C[C@H]1CC[C@H](NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 518166057 MDDZPCUYEXJSPK-IRJFHVNHSA-N 377.488 5.032 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 518168314 AFZCPIVNJYFPMC-WMLDXEAASA-N 385.558 5.541 30 20 GKED CN(C[C@H]1CCCCO1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 518185748 SOWFBPCIKWJMLP-GOSISDBHSA-N 399.878 5.037 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OC2CCCC2)c1 518740193 NRPUMXPZRJLBAV-INIZCTEOSA-N 380.513 5.655 30 20 GKED CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 521951919 XUIGSDQRQIPVJE-UHFFFAOYSA-N 399.450 5.064 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1csc(C2CC2)n1 522056575 KQNWSZRFLLAZGZ-UHFFFAOYSA-N 391.471 5.187 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc(-c4ccccc4)ns3)n2)cc1 533465632 XQYMQCJCYQWAPF-UHFFFAOYSA-N 388.477 5.058 30 20 GKED COc1ccc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)cc1-c1ccccn1 534360629 OMLNNVMMWXUEAF-QFIPXVFZSA-N 399.494 5.049 30 20 GKED C[C@@H](NC1CCC(Oc2ccccc2C#N)CC1)c1cnc2ccsc2c1 537979753 UNZAUJPHQSDQEG-VNCLNFNDSA-N 377.513 5.209 30 20 GKED C[C@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc(-c2cccc(C#N)c2)cc1 543869827 GKWLUDHBIKHQSM-HNNXBMFYSA-N 375.403 5.123 30 20 GKED CC(=O)[C@@H]1C[C@H](CC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1(C)C 545451142 QCZHVGIIZQBBHC-AVIJNYRZSA-N 388.511 5.044 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 550828086 WPVQQATYYRFLJD-VGOFRKELSA-N 376.504 5.056 30 20 GKED N#CCCC[C@@H](N[C@H]1CCCc2cc(Br)ccc21)c1ccccc1 556203383 MBDMBDGGQHSVQH-RTWAWAEBSA-N 383.333 5.851 30 20 GKED COc1cc(CN[C@@H]2CCCc3cc(C#N)ccc32)ccc1OCc1ccccc1 557517316 IXYLTMLZRIHLDC-XMMPIXPASA-N 398.506 5.313 30 20 GKED CC(=O)c1c(C)cc(C)c(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c1C 562232519 RVCXVNHKUICPCB-UHFFFAOYSA-N 385.467 5.486 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21 564113538 VJNUYNKZLNHEGK-QKKBWIMNSA-N 391.515 5.858 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 567038727 HTHQDZHITBQJEG-NEPJUHHUSA-N 379.312 5.223 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2ccc(Oc3ccnc(C#N)c3)cc2)s1 574209447 NGDBEFJSBZCHAB-UHFFFAOYSA-N 390.390 5.141 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(F)cc2)c2cccs2)c(C(F)(F)F)c1 575794215 TXNQTQQYJFIAIQ-IBGZPJMESA-N 390.405 5.657 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CC1 580071114 IBRHDOQLWOBPOM-UHFFFAOYSA-N 384.867 5.075 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2cccnc2)cc1 582324815 JBUQNJKPKKTNNI-UHFFFAOYSA-N 377.419 5.233 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)C1 590772108 HFCDIRUKJKQXCH-ONGXEEELSA-N 386.826 5.386 30 20 GKED C=C1CCN(C(=O)c2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)CC1 594846241 HWBRECVLPCAHPF-UHFFFAOYSA-N 386.451 5.458 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CC[C@@](C)(C#N)C3)cc2Cl)n1 596715701 LDTDMKBKXWPTDQ-KRWDZBQOSA-N 392.937 5.024 30 20 GKED CC(C)(C#N)CCC[S@](=O)Cc1coc(-c2cc(Cl)cc(Cl)c2)n1 600929781 LAMOAHGVTMJEHD-DEOSSOPVSA-N 385.316 5.227 30 20 GKED CC(C)c1noc([C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 604046667 IPHHYNQPCZKPDL-ZDUSSCGKSA-N 382.851 5.683 30 20 GKED C=CCCC(=O)N[C@@H](C)c1sc(-c2ccc(Br)cc2)nc1C 606807107 RJFLCHSNGQVXSJ-NSHDSACASA-N 379.323 5.024 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H](C)c1ccc(F)cc1 609371380 IRUSJSSJEOCPFP-GJZGRUSLSA-N 388.533 5.653 30 20 GKED Fc1ccc(-c2cnc(CN3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)o2)cc1 618453823 UYWWWNIVIKOVOT-VXGBXAGGSA-N 396.306 5.043 30 20 GKED COc1cc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)ccc1OC(F)F 730084337 AZGWJVRWCMJALQ-VQHVLOKHSA-N 387.407 5.316 30 20 GKED C#CCOc1ccc(NC(=O)c2ccccc2CSc2nc(C)cs2)cc1 730979770 DJRGOHWSQBALNH-UHFFFAOYSA-N 394.521 5.008 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)cc1 733324713 VLSXXSBQTZHAIY-LJQANCHMSA-N 393.527 5.270 30 20 GKED CCCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@H](CC)c1ccccc1 733805052 MZLYNWSLOFDADA-FYYLOGMGSA-N 393.531 5.440 30 20 GKED O=C1CCc2cc(C(=O)/C=C/c3ccc(-c4c(F)cccc4F)o3)ccc2N1 734366850 BFXZTFKUSMBSOT-RMKNXTFCSA-N 379.362 5.006 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)Cc1cc(Cl)ccc1OCC#N 735309739 KVXLBSKTLKGQMJ-ZDUSSCGKSA-N 382.813 5.454 30 20 GKED CC(C)(Sc1ccc(Br)cc1)C(=O)Nc1ccc(CC#N)cc1 735994392 PIICARRIAFQIHN-UHFFFAOYSA-N 389.318 5.025 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)cc1C#N 741841057 JLCOACBHLJUHKV-CLFYSBASSA-N 378.428 5.034 30 20 GKED CCOc1ccc(C=Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c(O)c1 743043868 BNBXDYFNUABOMX-OAHLLOKOSA-N 384.476 5.127 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1nc2ccccc2n1C 744738842 OPYAXLXXIYIEPD-UHFFFAOYSA-N 398.495 5.081 30 20 GKED CCCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)[C@@H](C)c1ccccc1 746146373 ASRGODFNMNJGJK-RXVVDRJESA-N 398.510 5.087 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1cccc(OCC#N)c1 746664273 XLZFOJUHKZTYSA-LBPRGKRZSA-N 378.259 5.121 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3sc4ccccc4c3Cl)n2)c1 752375439 AEEOMGKLOPQSGY-UHFFFAOYSA-N 395.896 5.802 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cc(Cl)cs1 758307821 LDLGCQOPZPVNJO-UHFFFAOYSA-N 390.839 5.678 30 20 GKED Cc1nc([C@H](C)OC(=O)CCc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 763909567 PYSMNEBZAPFPFC-HNNXBMFYSA-N 394.858 5.412 30 20 GKED CC(C)c1ccc(C[C@H]2CCN(C(=O)Nc3ccccc3O[C@@H](C)C#N)C2)cc1 764694892 SKTRKZRAIRDIAF-AZUAARDMSA-N 391.515 5.197 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(-c2ccc(F)cc2)cc1 769966733 VDIVLHPVMOXGPJ-MRXNPFEDSA-N 389.430 5.278 30 20 GKED CCOc1ccc(-c2nc(CON=Cc3ccccc3C(F)(F)F)co2)cc1 772874991 JDCVHEWVGAFFEF-UHFFFAOYSA-N 390.361 5.310 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(SC)c(F)c2)cc(OC)c1OC 772946271 LWLIYLQIRFQWDG-CQSZACIVSA-N 375.509 5.144 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(Cl)c(F)c2)ccc1OC 772987887 YYLSHPPODFBOHV-CZUORRHYSA-N 376.859 5.019 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C\c1scnc1C 776773014 VPTHOYWTZKEZLI-HJWRWDBZSA-N 391.471 5.017 30 20 GKED Cn1cc(CNc2cc(F)c(OC(C)(C)C)c(F)c2)c(-c2ccc(C#N)cc2)n1 782219620 BYWADXGWCIEJAB-UHFFFAOYSA-N 396.441 5.026 30 20 GKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 782346833 DXZRMPIZNBPTJW-DPVXCJKMSA-N 391.442 5.218 30 20 GKED N#C[C@]1(F)CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)C1 787374718 SDLZMFIUEPUDRP-RUZDIDTESA-N 398.437 5.011 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570942 MDAXVNCWHRWNKS-JSGCOSHPSA-N 376.909 5.046 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)C1 797573078 OAOKBFVKKFYUKI-KURKYZTESA-N 390.593 5.773 30 20 GKED N#CCSCCCOC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 805351744 OMADMGXFVKPQNI-UHFFFAOYSA-N 396.487 5.097 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1nc(-c2ccccc2)no1 853300437 NYEBFAVUOMFQLP-UHFFFAOYSA-N 380.292 5.190 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccncc2)cc1 915352432 IIDZKDRCUQHFJR-DHIUTWEWSA-N 382.467 5.106 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916050592 CYJCRCWDGVTSQT-KRWDZBQOSA-N 395.256 5.258 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1ccc2ccccc2c1O 916286405 BKOSOCBRSSJIJL-UHFFFAOYSA-N 379.769 5.449 30 20 GKED CC(C)c1ccc(CCC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916916971 CPJUSQWVXNXKPZ-QFIPXVFZSA-N 384.479 5.243 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(C)n(C(C)C)c2C)cc1 916955545 RPIVOOKNQWLKJX-BTYIYWSLSA-N 379.504 5.161 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2)CCC1)c1nc(-c2ccc(Cl)cc2)cs1 916975433 CLJPDNKDSUUQHH-SFHVURJKSA-N 392.911 5.762 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c(F)c1 1776128358 XWEPEEUFTHADQB-JXMROGBWSA-N 382.412 5.157 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cs1 1776280427 IUFZJOCSGOAFLP-YVMONPNESA-N 397.452 5.001 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)c(OC)c(OCC)c1 1776782875 JVUBVPIRBCPIDT-INIZCTEOSA-N 385.932 5.041 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc(OCC3CCC3)c1)C2=O 1777682910 DYCWEZOJYRUQSV-UNOMPAQXSA-N 376.452 5.166 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1Cl 33195182 UWZULGWTRSOKNR-YUMQZZPRSA-N 391.714 5.118 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCc3ccc(F)cc32)cc1 59006131 IKKRHDRZTLJVKF-UHFFFAOYSA-N 388.467 5.193 30 20 GKED C=CCN(C(=O)COC(C)C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 64782131 BEBZLMLLAIYBAT-UHFFFAOYSA-N 385.316 5.061 30 20 GKED C[C@H](NC(=O)CSCc1ccc(C#N)cc1)c1cc(F)c(Cl)cc1Cl 107695785 HNDABUPJVZTRSF-NSHDSACASA-N 397.302 5.115 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 108407672 VVXQCZLZXCYCAY-DZGCQCFKSA-N 387.936 5.339 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 114273203 KGEDSSNTYPKRFN-JTQLQIEISA-N 382.457 5.305 30 20 GKED C[C@@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)c1ccc(C#N)cc1 118172531 UFDWHSBRVGDMAJ-QGZVFWFLSA-N 397.507 5.113 30 20 GKED CC(C)c1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 122544500 RDAFTAVJCCBWSB-CYBMUJFWSA-N 387.917 5.533 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cncc(-c3ccc(Cl)cc3)c2)n1 126115165 IVHSNSYMJJJMPJ-KRWDZBQOSA-N 381.888 5.472 30 20 GKED N#C[C@H](C(=O)C1=Cc2ccccc2OC1)c1nc(-c2ccc(Cl)cc2)cs1 132304714 OKVYFKFAYQOGSA-QGZVFWFLSA-N 392.867 5.116 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 154127995 XFLZNSMDJAYSCW-UHFFFAOYSA-N 388.471 5.274 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3c(F)cccc3F)n2)cc1 154388977 DLXREJCBGYJOCO-SWLSCSKDSA-N 398.434 5.077 30 20 GKED COc1ccccc1-c1nc(CNc2ccccc2SC[C@H](C)C#N)cs1 170983102 JGAMZDPULZPVBI-OAHLLOKOSA-N 395.553 5.683 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccc(Oc4ccc(Cl)cn4)cc3)CC2)cc1 187502482 ZICYMKWCXGPHNV-UHFFFAOYSA-N 389.842 5.069 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(F)c(F)c1 205579875 XVLXRDDNBHOKSO-CLFYSBASSA-N 387.389 5.109 30 20 GKED O=C(Nc1cccc(/C=C2/CCc3ccccc3C2=O)c1)c1ccccc1Cl 212553753 NZRBCADFBPMBMR-JXAWBTAJSA-N 387.866 5.805 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccccc2)c2ccccc2OC)cc1OC 237411163 UCNLWVOUGYCACW-RUZDIDTESA-N 389.495 5.148 30 20 GKED C=CCOc1ccccc1CNCc1cc(Cl)ccc1OCc1cccnc1 237764052 RSWSBXPVPPDHJB-UHFFFAOYSA-N 394.902 5.169 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Oc1cccc(Cl)c1 303506690 NGSOLJAHBJZXMM-CQSZACIVSA-N 388.920 5.388 30 20 GKED C[C@@H](CNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)Cc1cccs1 303961129 WRKUDRNZYQNUAG-MRXNPFEDSA-N 376.481 5.021 30 20 GKED Cc1cc(C)n(-c2ccc(N=C(O)c3cn(C)nc3C3CCCCC3)cc2F)n1 328764706 OUCOVGHUOSSINE-UHFFFAOYSA-N 395.482 5.046 30 20 GKED CSc1nc(C2CC2)nc(C)c1C(O)=Nc1ccc2c(c1)OC1(CCCC1)O2 329733582 JSKZFUYFWQVFRY-UHFFFAOYSA-N 397.500 5.062 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 411512206 RCVJLCZECGAIHH-SQGPQFPESA-N 385.294 5.332 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 425420375 SAGVBBRNLFOTHK-KGLIPLIRSA-N 375.394 5.041 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 429370422 HCGBPUXVNQUTSX-UKRRQHHQSA-N 397.525 5.081 30 20 GKED CCCCOC1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 438049339 KIQRTXNEBICYTJ-UHFFFAOYSA-N 393.487 5.164 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)CCCOCc1ccccc1 439502518 PTANMTMQXPRUDQ-SFHVURJKSA-N 397.544 5.009 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cc(Cl)c(Cl)cn3)c2)cc1 443958109 LPCLRSXCICQDEX-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)CCCC1(C)C 445236036 GGUQQXRHTGQTQE-HXUWFJFHSA-N 395.503 5.439 30 20 GKED CC[C@@H](N[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1)c1ccc(C#N)cc1 447533818 SVLHHQJRJSHZSN-HTAPYJJXSA-N 378.516 5.690 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1ccc(C)c(Oc2ncccc2Br)c1 448062459 BDYPXBOVWRIPQF-CYBMUJFWSA-N 390.281 5.031 30 20 GKED COc1ccc(C)cc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 459403421 QJYPXRXPWBWJND-JKSUJKDBSA-N 383.517 5.138 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)c(-c2nc3ccccc3[nH]2)c1 463574609 PEFCOQMRNMPJEW-INIZCTEOSA-N 380.451 5.152 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1ncc(-c2cccc(Cl)c2)o1 464821730 JORUSVHSOSQAPS-PMACEKPBSA-N 377.875 5.267 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(C)c1ccc(Cl)c(N(C)C(=O)[C@H](C)CC(=C)C)c1 466441174 JDCYUCFIWJBZEM-IAGOWNOFSA-N 390.955 5.470 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cn(-c3ccccc3)nc2C(C)(C)C)n1 467850401 KPIPGIYWDSCVLE-INIZCTEOSA-N 392.528 5.240 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)cc1 469220937 FRWNQZZTVBJIBO-UHFFFAOYSA-N 381.262 5.979 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccncc2)cc1 470501658 ZTUXCIONSSMLLG-AWEZNQCLSA-N 376.847 5.156 30 20 GKED CCc1ccc(O)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 470909274 POQSXTCKORSZSA-UHFFFAOYSA-N 376.387 5.010 30 20 GKED Cc1ccccc1COc1cccc(NCc2nnc(-c3cccc(C#N)c3)o2)c1 471665585 REGCGLUZRLJVRU-UHFFFAOYSA-N 396.450 5.108 30 20 GKED CO[C@H]1CCC[C@@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 475185057 ORCWEJZHOXWFRQ-QUCCMNQESA-N 378.472 5.193 30 20 GKED Cc1ccc(-c2ccc(C)c(NCc3cn(CCC#N)nc3-c3ccncc3)c2)o1 475500747 AQVRJYBYICMLED-UHFFFAOYSA-N 397.482 5.348 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2ccc(Br)cc2[nH]1 476800916 FHQZEOMMHRIIAE-UHFFFAOYSA-N 397.316 6.035 30 20 GKED Cc1csc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c1Cl 478703409 XQQDZJFMXIJONR-UHFFFAOYSA-N 382.872 5.413 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cccc(-c2nc(C)co2)c1)c1ccc(F)c(F)c1 480984027 AEQOUZPGNXNPOV-LJQANCHMSA-N 383.398 5.367 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](C)c1ccc2ncsc2c1)c1ccc(F)c(F)c1 486255718 KRBVXXHXRQUASU-BUXKBTBVSA-N 387.455 5.252 30 20 GKED N#CCCC[C@@H](NC(=O)c1cccc(OCc2cccs2)c1)c1ccccc1 487320508 AJPPAYWXNUUSIN-JOCHJYFZSA-N 390.508 5.492 30 20 GKED CCCCCN(CCO)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 490625273 WXBUYVZNWQNCDN-FQEVSTJZSA-N 399.922 5.012 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(-c2ccccc2OC)c1 492254086 TUWDIJMJWPMCRY-UHFFFAOYSA-N 376.456 5.218 30 20 GKED C=CC[C@@H](C(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 495059648 NWTAARVIJPSCHJ-LJQANCHMSA-N 394.902 5.547 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NCCCC1(C#N)CCOCC1 499604636 FOQORIHCHLPGQL-LJQANCHMSA-N 378.944 5.126 30 20 GKED N#Cc1cccc(NC(=O)[C@@H](Oc2ccc(F)cc2Cl)c2ccccc2)c1 499623387 CPQWLPVXPBQRGT-FQEVSTJZSA-N 380.806 5.110 30 20 GKED N#C[C@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccccc1Cl 499926850 XLLMOCGYESFMRG-KRWDZBQOSA-N 379.312 5.247 30 20 GKED C=CCc1cc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)cc(OC)c1O 500107589 DGOJDSITMFZJMO-NRFANRHFSA-N 399.943 5.723 30 20 GKED CCCCc1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508065922 YTZWBDJRCRWSJW-NRFANRHFSA-N 395.572 5.515 30 20 GKED CC(C)COCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510006025 QQYKJHZPQQRMNH-FQEVSTJZSA-N 399.922 5.180 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc(-c2ccc(F)cc2)no1 510213922 XCLBFXXOYKBVSS-UHFFFAOYSA-N 388.427 5.102 30 20 GKED Cc1nc(C2CC2)ccc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 516413636 AACOCOGBCWCQPG-UHFFFAOYSA-N 385.492 5.219 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc2ccccc2c1 517473532 PKIHIWLTYZVWPS-QGZVFWFLSA-N 389.524 5.755 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(CC)o2)nnc1-c1ccc(C(C)(C)C)cc1 517660283 KATXIYDKOUTVAN-CQSZACIVSA-N 397.548 5.227 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C(C)C)cc1 521260904 KAQNUJLLZOPWCU-IIBYNOLFSA-N 397.544 5.466 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1)OCC 534473975 UYHUUGHHHIQSOG-LJQANCHMSA-N 383.879 5.193 30 20 GKED C[C@@H](NCc1noc(Cc2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 543871395 VEFAZKDPNFUQRD-GOSISDBHSA-N 394.478 5.050 30 20 GKED C=CCNC(=O)c1cccc(-c2noc([C@@H](C)Sc3ccccc3Cl)n2)c1 547063344 VISGFUOWEFGMLJ-CYBMUJFWSA-N 399.903 5.159 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1cccc(Oc3cccc(Cl)c3C#N)c1)CC2 550153970 KEBSNELCSUEKHD-UHFFFAOYSA-N 399.837 5.079 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 565097213 ADAFCBWSFGGDPD-FQEVSTJZSA-N 379.504 5.558 30 20 GKED CCC[C@@H](C#N)NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 569654235 TXZHRPORWIDEOY-NSHDSACASA-N 380.275 5.194 30 20 GKED CC(C)Oc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 576420324 ZLKOIVSTHXABJT-KRWDZBQOSA-N 396.899 5.741 30 20 GKED CC(C)Oc1cc(Br)cc(NC(=O)c2cc(C#N)ccc2Cl)c1 582019086 WWSWADNYACLEAF-UHFFFAOYSA-N 393.668 5.014 30 20 GKED CCOc1cccc2[nH]cc(Cc3noc(-c4ccc(C(C)(C)C#N)cc4)n3)c12 583961207 OZNZVKBYPAQUMX-UHFFFAOYSA-N 386.455 5.009 30 20 GKED C=C(C)COc1cccc(NC(=O)CCc2ncc(-c3ccccc3F)o2)c1 589381927 BVDNGNCSWFIZOS-UHFFFAOYSA-N 380.419 5.007 30 20 GKED COc1cccc(CN(C(=O)CCCCC#N)C23CC4CC(CC(C4)C2)C3)c1 593987627 VISIDLQYRXIBPO-UHFFFAOYSA-N 380.532 5.077 30 20 GKED Cc1c(NCc2ccc(C(C)(C)C#N)cc2)cccc1-c1nnc2n1CCCCC2 594504220 HLKATHWOWJRULI-UHFFFAOYSA-N 399.542 5.393 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc2cc(F)ccc2s1 595869195 DEQPRDYRSJLCFT-KRWDZBQOSA-N 380.444 5.247 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccccc3)s2)sc2c1CCCCC2 603727457 ROQXPDCAGRDFCU-UHFFFAOYSA-N 379.510 5.264 30 20 GKED C=CCOc1ccc(CNC2CCN([C@H](C)c3ccccc3)CC2)cc1Cl 604769945 OKUZRBPIKGXEBR-GOSISDBHSA-N 384.951 5.220 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2cccs2)CCCCC1 609971388 ZHJYEBWVRKOARQ-INIZCTEOSA-N 384.570 5.840 30 20 GKED C[C@@H](NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 610138590 NWZMVMJFCMTXFL-HXOBKFHXSA-N 387.458 5.042 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCSc2ccc(F)cc21 612228580 FHBGGXQPAWXBOX-HNNXBMFYSA-N 396.940 5.475 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3c(F)cccc3Cl)c2)cc1 612391581 SCNMSUVZTABYAH-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1cccc(CN[C@@H](CC(F)(F)F)c2ccc(Br)cc2)c1 612536371 QZRLGETYFAZQGZ-INIZCTEOSA-N 383.211 5.104 30 20 GKED N#C[C@@H](C(=O)c1cccc(F)c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 613347086 WWESALOYRUUNAV-AWEZNQCLSA-N 391.254 5.746 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1oc2ccccc2c1CSC 616167521 SSMYLJHSIDGAKE-UHFFFAOYSA-N 379.525 6.400 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 618805786 LAGNDRANDZZQKT-PMACEKPBSA-N 389.499 5.475 30 20 GKED O=C(C/C=C/c1cccc(F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 619125286 MSZJDTQBNNMGSG-DUXPYHPUSA-N 385.323 5.399 30 20 GKED N#Cc1ccc(CN[C@H]2CCSc3ccc(Br)cc32)cc1Cl 619754473 AHDXFTRUNACVNL-INIZCTEOSA-N 393.737 5.301 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)C3C[C@@H]4CCC[C@H](C3)C4=O)c2C#N)C1 637012844 DCRVVJGKCOUVDR-VFSICIBPSA-N 398.572 5.105 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1c1ccccc1OC 682777349 MQCFKDCTULIXBA-QFIPXVFZSA-N 392.543 6.306 30 20 GKED COc1ccccc1/C(C)=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727304363 ALLUTJLKBHRCRS-RIXQQTFQSA-N 382.463 5.393 30 20 GKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 728770164 OLTCBMKGUISXGW-SFTDATJTSA-N 399.519 5.688 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1F 731411381 XLFKJDIAZSBBKX-MFKMUULPSA-N 392.377 5.434 30 20 GKED CC(C)c1cnc(COC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)o1 735164274 SHJDZMQFTIVYPN-UHFFFAOYSA-N 396.830 5.472 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C2CC2)cc1 735570823 QXDJDNCITRQMEC-UHFFFAOYSA-N 394.906 5.008 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1CNCc1cccc(-c2ccc(C#N)s2)c1 740014489 QGXPWGBPPDMZKJ-UHFFFAOYSA-N 398.535 5.379 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N[C@H](c3cccs3)C3CC3)c2)s1 740466845 HJZFISHKZFZZRU-FQEVSTJZSA-N 393.537 5.299 30 20 GKED Cc1ccc(OC[C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 743294466 KDFOKPNZELTMHX-NTKDMRAZSA-N 399.494 5.240 30 20 GKED C[C@H](ON=Cc1ccccc1OC(F)F)c1nc(-c2ccc(Cl)cc2)no1 744443279 JOVNFGSFBTYMLB-NSHDSACASA-N 393.777 5.103 30 20 GKED O=C(/C=C\c1ccccc1-n1cncn1)c1ccc(Cl)c(Cl)c1Cl 745313343 MEZMMWSUIWTPOO-YVMONPNESA-N 378.646 5.124 30 20 GKED Cc1cc(C)c(Nc2nn(CN(CCC#N)C(C)C)c(=S)s2)c(Cl)c1 745438006 OIVZNAVODGYOLI-UHFFFAOYSA-N 395.985 5.270 30 20 GKED CCOc1ccc(/C=C\C(=O)c2ccc(SC(F)F)c(OC)c2)cc1OC 746346264 OFZHAFXTLNJOIJ-YVMONPNESA-N 394.439 5.313 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2ccccc2F)cc1 751012978 AMBRDOJTPMHZBS-UHFFFAOYSA-N 393.443 5.307 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)Cc1ccccc1CC#N 761103268 CNAUABAJDGVWBP-INIZCTEOSA-N 376.481 5.032 30 20 GKED CC[C@@H]1CCCC[C@@H]1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 766846421 LZFWLVVGHDDJIY-MRRJBJDNSA-N 376.909 5.111 30 20 GKED Cc1ccccc1COc1ccc([C@H](C)NCc2ccc(OCC#N)cc2)cc1 772961088 ZYTVWIFGMXKWQE-FQEVSTJZSA-N 386.495 5.327 30 20 GKED C[C@H](NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)c(F)c1 776741158 CKLXWWNMPQKEHO-HOTGVXAUSA-N 397.494 5.134 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)cn2)cc1Cl 785863284 GYFRLJHHBYEMEN-IBGZPJMESA-N 396.277 5.225 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)c1ccc(-c2cccs2)cc1 788028020 JRAHNLPDERVXFB-UHFFFAOYSA-N 377.498 5.165 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(CC[C@@H](O)c2ccccc2)cc1)c1ccccc1 793629813 SEFQBSLHLBQUCR-ILBGXUMGSA-N 398.506 5.379 30 20 GKED C[C@@H](OC(=O)C(C)(C)c1csc(-c2cccs2)n1)c1cccc(C#N)c1 800293329 OVOOJJIJLRPKIL-CYBMUJFWSA-N 382.510 5.325 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801669672 BUAHTBCUVSYQNH-INIZCTEOSA-N 382.382 5.360 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(C(F)(F)F)cc1F 804615147 IHIRKUGBAAGVRA-UHFFFAOYSA-N 383.360 6.088 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1 810134978 GQRSQKYNEQZNSA-JOCHJYFZSA-N 393.531 5.003 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NCc1ccc(C#N)o1 816663786 IPLSASKJVZKMDX-UHFFFAOYSA-N 381.354 5.129 30 20 GKED CC(C)(C)c1ccc([C@H](O)CCC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 817319607 QAJZDXHNOYHNPW-DHIUTWEWSA-N 392.543 5.349 30 20 GKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(C(F)(F)F)nc1Cl 820593495 AGLPIMMYTBOIBS-SSDOTTSWSA-N 394.706 5.212 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(C2SCCS2)c1 824017306 JTLYLEAVDBAAKK-AWEZNQCLSA-N 383.542 5.262 30 20 GKED C#CC[C@@H](NC(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 861396496 XHVIIHRTSCXOKV-HXUWFJFHSA-N 393.487 5.228 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(SC(F)(F)F)c1 863993140 LRLGVURMYNASEN-CQSZACIVSA-N 380.435 6.154 30 20 GKED N#C[C@@H](C(=O)Cc1ccsc1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917030174 GJXQKRDLLHZKTO-HQHQJUQOSA-N 382.554 5.091 30 20 GKED CCCCCCCOc1ccc(C(C)=NNc2cccc(C(=O)O)c2C)cc1 1776086274 KMKVWAFSGHQXDO-UHFFFAOYSA-N 382.504 5.879 30 20 GKED CCC(=NNc1cccc(C(=O)O)c1C)c1ccc(Br)cc1Cl 1776087746 TZCXPRWZNPPDOH-UHFFFAOYSA-N 395.684 5.335 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)cs2)cc1 1776125627 OEOZQELNKZDGLH-JNSOCZORSA-N 386.513 5.938 30 20 GKED CCOc1c(Cl)cccc1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776910390 VVCBUVQNSNGFEF-NTMALXAHSA-N 388.847 5.120 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@H]2CCCC[C@H]2C)cc1 27490290 UWPDYYMUDLRZIR-NQIIRXRSSA-O 395.592 5.006 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2sc(-c3ccco3)nc2-c2ccccc2)n1 41516251 UVAFBSFNTJHXQC-CQSZACIVSA-N 391.477 5.325 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 56469877 BNUQDKFWSBVYOG-UHFFFAOYSA-N 376.437 5.175 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1ccc(F)c(F)c1 60036164 OGMBTGJLVUBLKE-AWEZNQCLSA-N 393.393 5.068 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1OC1CCCC1 63392158 VAFYEUPQMJXYID-UHFFFAOYSA-N 375.472 5.100 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 66903734 AXZDKZXSBOULQG-SFHVURJKSA-N 385.467 5.407 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 108238290 WTOVDQSNLMDZIG-OAHLLOKOSA-N 380.513 5.157 30 20 GKED CCN(C(=O)CCc1cccc(OC2CCCC2)c1)[C@@H](C)c1ccc(C#N)cc1 110587917 QUFYQGLTURUYSB-IBGZPJMESA-N 390.527 5.422 30 20 GKED C=C[C@@H](CC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1)c1ccccc1 126755485 SIZKHDDQBCBDQG-GHTZIAJQSA-N 387.483 5.150 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1cccc(C#N)c1 126862878 GQTXYUYEMDSWIJ-HNNXBMFYSA-N 376.485 5.215 30 20 GKED CCN(C(=O)CNc1ccccc1S[C@H](C)CC#N)[C@H](C)c1ccc(F)cc1 153953592 PYQVRPKDSQHXGW-IAGOWNOFSA-N 399.535 5.242 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2ccccc2Br)n1 155813049 GXXMNSICSLRSAP-AWEZNQCLSA-N 391.334 5.228 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc3[nH]ccc23)cc1 171040053 ISBPAVMZNMSOMV-UHFFFAOYSA-N 383.476 5.584 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)c1cccc2ccccc12 176675816 VUXCNUUYDSJHLR-OAHLLOKOSA-N 382.510 5.035 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cncc(F)c2)cc1Cl 180781708 KFCBUHRRHXVQGE-HXUWFJFHSA-N 393.849 5.101 30 20 GKED CC(C)[C@H](/N=C(/O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)c1ccc(Cl)cc1 328686537 GJDNAMAAICOQTQ-SBHAEUEKSA-N 398.938 5.005 30 20 GKED O/C(=N\C1CCC(/C(O)=N\CC2(c3ccc(F)cc3)CCCC2)CC1)C1CC1 330033515 VOULTORGGUMPGE-UHFFFAOYSA-N 386.511 5.519 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CC(F)F)c1ccccc1 422255734 HCMKGEXKKKBLCO-HNNXBMFYSA-N 384.879 5.496 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N(CCC#N)CC2CC2)c(C(F)(F)F)c1 429057465 ABMCRAXOQULXPB-CYBMUJFWSA-N 399.482 5.754 30 20 GKED N#CCCC[C@H](NS(=O)(=O)c1c(Cl)ccc2ccccc12)c1ccccc1 431627915 KZFGEPKHKLQIFH-FQEVSTJZSA-N 398.915 5.207 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(OC2CCCC2)c1)c1ccccc1 432699307 MPWLIWJJNVKJFF-JOCHJYFZSA-N 377.488 5.565 30 20 GKED Cc1cc(Br)ccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432743547 ZZJABGKGVUWAAK-GOSISDBHSA-N 386.293 5.314 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Cl)cc(Br)c2F)cc1 435619202 WYGLFGLDGLYYSZ-UHFFFAOYSA-N 395.659 5.295 30 20 GKED N#CCCn1cc(C(=O)CSc2nc(-c3ccccc3)co2)c2ccccc21 436247356 OGXSXYIAGXLPQN-UHFFFAOYSA-N 387.464 5.185 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C)c2c1 437375189 IULXGYKUVXYZGA-LJQANCHMSA-N 394.478 5.106 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 437846965 LRBODPGBWXSKRC-WTOYTKOKSA-N 377.488 5.168 30 20 GKED C[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 438223253 DODVLVNNIKLPOL-QGZVFWFLSA-N 383.451 5.329 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Br)cc1Cl)c1ccccc1 439128110 CZODNQQZVAPXAQ-OAHLLOKOSA-N 392.684 5.269 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)CNc1ccc([C@H](C)Sc2ccccc2)cc1 439550464 NHIHJCCLKAJOCL-JTSKRJEESA-N 381.545 5.006 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(NC(=O)c2ccccc2)c1 439565196 QZLIQASGQYVCLY-IBGZPJMESA-N 399.494 5.795 30 20 GKED Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 444902299 WJQDBTTVWNYVPR-FUHWJXTLSA-N 381.545 5.342 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)CS[C@H](C)c2ccc(C#N)cc2)cc1 447015434 GITGJBGPCZREHO-VGOFRKELSA-N 394.540 5.115 30 20 GKED N#CCCC[C@H](NC(=O)N1CCc2cc(-c3ccccc3)oc2C1)c1ccccc1 458798380 HZLJTLBDLCFVOU-QFIPXVFZSA-N 399.494 5.449 30 20 GKED C[C@@H](C(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462503067 PTGGOIWBXMDYFT-QRWLVFNGSA-N 386.417 5.434 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)oc1ccccc12)c1cc(C(F)(F)F)ccn1 464428423 SRNBDCNZEBSPNI-INIZCTEOSA-N 380.325 5.490 30 20 GKED N#Cc1ccc(CCC(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)cc1 466385206 BJPAGJWJTYITAZ-HXUWFJFHSA-N 388.536 5.187 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NCc1nc(-c2ccccc2F)cs1 472242877 TWBUZRWJFWRSOL-UHFFFAOYSA-N 395.503 5.237 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 473694808 CVXAOFGSAQIRCD-UHFFFAOYSA-N 386.329 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(OC(C)C)c1 475577397 DINVCANDFUMCJZ-UHFFFAOYSA-N 380.532 5.990 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)Cc1ccccc1N1CCCC1)c1ccc(F)c(F)c1 477739164 GTQXXGACVZOYON-JOCHJYFZSA-N 399.485 5.024 30 20 GKED COc1ccccc1[C@H](NCc1ccc(C#N)c(F)c1)c1ccccc1Cl 479455152 RJDIRKVTNVEGSK-JOCHJYFZSA-N 380.850 5.239 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C(C)C 482728809 QNSNXFDTGLEZIU-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1nc2ccccc2o1 483480723 ORTQRCDGAXBWRB-ZDUSSCGKSA-N 391.814 5.189 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 487302933 WOVGPWGHDFPSKL-BJLQDIEVSA-N 386.417 5.360 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 488678336 UMPFTAMEJPCWRE-QHCPKHFHSA-N 398.506 5.936 30 20 GKED Cc1ccc(-c2cnc(CSc3nc(C(F)(F)F)ccc3C#N)o2)cc1 488756374 ZVNDHFVGFSZAEB-UHFFFAOYSA-N 375.375 5.228 30 20 GKED Cc1cccc([C@@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)c2ccccn2)c1 497522589 JQNSMSIWDOEPKF-JOCHJYFZSA-N 386.405 5.290 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@H]1CCCC[C@H]1C 497798217 GTDSWSIXJBILHU-HXOBKFHXSA-N 394.490 5.134 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)c1nc(O)c2c(-c3cccs3)csc2n1 498155772 KSADNHQCZDYRRQ-SNVBAGLBSA-N 396.522 5.245 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)Oc1cccc(Cl)c1Cl 498296321 OSJJLBKAQDXJKY-LBPRGKRZSA-N 393.270 5.058 30 20 GKED CCN(CCc1cccs1)C(=O)c1ccccc1Sc1ccccc1C#N 501123782 XGYQDJBHSXDEKM-UHFFFAOYSA-N 392.549 5.476 30 20 GKED C[C@H](Sc1cc(C#N)ccn1)c1ncc(-c2ccc(Cl)cc2Cl)o1 512757794 QWBFPWVFRLJOPD-JTQLQIEISA-N 376.268 5.768 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)C1CCCCC1 514896648 MXTYOHSMDVHYKN-KRWDZBQOSA-N 378.541 5.549 30 20 GKED CCCc1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 517906062 NJXYVGHJRMAJMQ-UHFFFAOYSA-N 384.479 5.536 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@H]3C[C@H]3c3cccc(Cl)c3)n2)cc1 519939146 LDELMCNGDGPNEJ-IRXDYDNUSA-N 379.872 5.077 30 20 GKED CC(C)Sc1ccc(Cl)cc1NCC(=O)Nc1cc(Cl)ccc1C#N 521536189 UVARNJYQVLBGRR-UHFFFAOYSA-N 394.327 5.416 30 20 GKED C[C@H](C1CC1)N(Cc1ccccc1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523586858 AOCHBBNLFGGXNL-HXUWFJFHSA-N 395.506 5.314 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2)c2ccccc2)c(F)c1 524988159 GKUHRAXGEGOVEU-UHFFFAOYSA-N 376.456 5.023 30 20 GKED C=C[C@H](CC(=O)N[C@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1ccccc1 536182965 SSRGEYLKRYUHDF-IQGLISFBSA-N 381.479 5.128 30 20 GKED COc1ccnc2c(NC(=O)c3ccccc3-c3ccccc3C#N)cccc12 536627965 BWUJUKORQVXJAJ-UHFFFAOYSA-N 379.419 5.034 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C)(COC)CC1)c1ccc(C(F)(F)F)cc1 536976984 XXQFKPSERCEGPE-SFHVURJKSA-N 398.469 5.171 30 20 GKED N#CCCCOc1cccc(N[C@@H]2CCc3c(F)ccc(Br)c32)c1 537424804 GRFINYYVJYPBON-GOSISDBHSA-N 389.268 5.370 30 20 GKED CC(C)(C)c1cc(NC(=O)CSc2ccc(C(F)(F)F)cn2)c(C#N)s1 540274177 GHIHADDZBUWMEJ-UHFFFAOYSA-N 399.463 5.062 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1cccc(COC2CCCCC2)c1 557600404 CQNQSYXEFNQRQB-UHFFFAOYSA-N 397.906 5.112 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 559867091 ZEIRRTQHCKJSRF-OXJNMPFZSA-N 376.422 5.713 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@H](c3c(Cl)cccc3Cl)C3CC3)o2)c1 562047773 ZRJXGSJVHPLGGH-IBGZPJMESA-N 399.281 5.156 30 20 GKED N#CCc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c(Cl)c1 576711061 SUBDPURQGMRSPJ-UEXGIBASSA-N 379.891 5.206 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1Cl 577309633 HTGNTEKGAQDMGH-AWEZNQCLSA-N 392.846 5.282 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)NCc2ccc(C#N)c(OC)c2)c(C)c1 579412481 QFTBOOZOCBEJBF-OAHLLOKOSA-N 383.517 5.088 30 20 GKED COc1ccc(/C=C(/C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1F 588438963 ZBPLGDNHCWTNJP-IKESIWSLSA-N 384.476 5.271 30 20 GKED N#CCCCCCC(=O)N1c2ccc(Br)cc2[C@@H]2CCCC[C@@H]21 589006694 DYAREVFCDUBLFD-RDJZCZTQSA-N 375.310 5.296 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)c3cccc(C#N)n3)c2)cc1 589450867 RWPBQBWBRVGNMF-GOSISDBHSA-N 399.494 5.241 30 20 GKED N#Cc1ccc(CN[C@H]2COc3c2ccc(Cl)c3Cl)c(C(F)(F)F)c1 589507999 NILBOJJHSXHOEG-AWEZNQCLSA-N 387.188 5.107 30 20 GKED CC(C)Oc1ccc(Cl)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 589624480 RFSGDCGGWFXDSA-UHFFFAOYSA-N 395.890 5.638 30 20 GKED CC(C)(CC#N)CNC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 592272269 QCMJOTZWZLTXCH-UHFFFAOYSA-N 399.310 5.037 30 20 GKED N#Cc1cccc(C2(NCc3ccc(-c4ccccc4F)s3)CCOCC2)c1 594985087 VZDZRODNQBOCSY-UHFFFAOYSA-N 392.499 5.221 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N1CCC[C@@H](CC#N)C1 596803930 WMEHMGGHRNQCTJ-KRWDZBQOSA-N 395.528 5.145 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2ccccc2F)n1 606934568 VCJGHJDKYDKDKB-UHFFFAOYSA-N 375.513 5.145 30 20 GKED CCN(Cc1ccoc1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 608819340 WUYOYGNFOZEQTK-UHFFFAOYSA-N 376.481 5.106 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2ccccc2C)CC1 608871531 ZTXQONNKESPZLK-UHFFFAOYSA-N 382.463 5.638 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3cccc(C(F)(F)F)c3)o2)cc1 609053708 YQVRDOUMGUCBFF-UHFFFAOYSA-N 386.329 5.001 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609428564 UTMFDIFNRGMATR-GJZGRUSLSA-N 388.920 5.449 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609499238 CUXNDNFROIZPIH-OAHLLOKOSA-N 391.858 5.232 30 20 GKED C[C@@H](C#N)CNC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 609524305 GCUNPXXTCTYQMG-LBPRGKRZSA-N 379.312 5.175 30 20 GKED COc1ccccc1-c1cccc(NC(=O)c2cc3ccccc3n2CC#N)c1 609526603 IBYAHTDKILVOGN-UHFFFAOYSA-N 381.435 5.093 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@H]1C 610019383 NLEHKYMIBLOIIG-HUUCEWRRSA-N 383.492 5.371 30 20 GKED Cc1nc(NC(=O)c2cccc(N[C@H](C)C(C)C)c2C)sc1SCC#N 610210718 OWTZQZLUNXLYPW-CYBMUJFWSA-N 388.562 5.084 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2cccc(-c3cccnc3)c2)CC1 610889887 VJRUTFRPMVEXTL-UHFFFAOYSA-N 383.495 5.100 30 20 GKED COc1ccc(CN[C@@H]2CCCc3cc(C#N)ccc32)cc1OC1CCCC1 611391865 CCTIFAGZRQXTBB-JOCHJYFZSA-N 376.500 5.055 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](N[C@H]2CCc4cc(C#N)ccc42)CCC3)cc1 618805733 KFBSDHMNTXLTLB-LEWJYISDSA-N 385.536 5.645 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(Cl)ccc1F 619126411 RBXMVNZUDIIARY-UHFFFAOYSA-N 379.703 5.263 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(F)cc2OCCC(F)(F)F)cc1 619699303 MXRLOEXZGYNOQY-UHFFFAOYSA-N 380.385 5.570 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CC2(CCC2)[C@H]1c1ccncc1 665437016 UEPAKGMAARBGBN-JOCHJYFZSA-N 399.519 5.302 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)C[C@@H]1CCCO[C@H]1c1ccccc1 674249808 KCUSKEHUHHSISJ-UNMCSNQZSA-N 387.445 5.157 30 20 GKED CC(=O)Nc1ccc(Cl)c(C(=O)Nc2cccc(C#Cc3cccs3)c2)c1 676036101 OSEGFUFXVAAQLF-UHFFFAOYSA-N 394.883 5.012 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3ccc(Cl)c(C#N)c3)c2c1 730458082 UWMMVIJWZYICOE-UHFFFAOYSA-N 398.853 5.383 30 20 GKED N#C[C@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1cccc(Cl)c1Cl 731195202 AIHMQTTXDAGTKT-ZDUSSCGKSA-N 392.044 5.434 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)NCc3ccc(OCC#N)cc3)sc2c1 732659730 WUVTYEHWRCMUIA-UHFFFAOYSA-N 398.915 5.510 30 20 GKED Cn1cc(-c2cccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)c2)cn1 741545642 NOKXEOXABALWBY-UHFFFAOYSA-N 394.434 5.003 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(SC)c(OC)c2)cc1Br 746342439 ULZZIBSYCMAXMD-QPJJXVBHSA-N 393.302 5.084 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cn1 746687234 UEXUACNFXSREIA-DAXSKMNVSA-N 385.807 5.182 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)co1 752886120 HFXLRZZPJBDZRH-KHPPLWFESA-N 394.858 5.600 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(F)c1O 756380411 UGHJUFKVNHOJES-WYOJIJJFSA-N 391.302 5.231 30 20 GKED C#CC[C@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 756998492 WXTPEXIXNVEHQT-QHCPKHFHSA-N 388.898 5.447 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1 770561544 XMTMQZWOSXQEFV-SANMLTNESA-N 399.538 5.315 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cnc1Cl 771100395 YDKRCPWUZPPUCU-WVRJYTFGSA-N 389.854 5.027 30 20 GKED CC(C)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776156940 OTRBSDOEMKJRRB-QRWLVFNGSA-N 376.422 5.656 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3O[C@@H](C)C#N)s2)c(C)c1 780178362 SOIJIJPNVSKRGH-HNNXBMFYSA-N 391.496 5.279 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1sccc1Cl 782151237 BGOPCLXLSGJMFX-UHFFFAOYSA-N 389.720 5.138 30 20 GKED CO[C@H]1Cc2ccc(NC(=O)c3ccc(Oc4ccc(C#N)cc4C)cc3)cc2C1 784240535 XSRVIVQSOUOISB-QHCPKHFHSA-N 398.462 5.025 30 20 GKED COc1cccc(C(=O)/C(=C/c2cccc(OC3CCCC3)c2)c2ncc[nH]2)c1 787169056 LFJFFTJPNFXYEL-JCMHNJIXSA-N 388.467 5.163 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2ccc(Br)cc21 788353235 FPFRMOQOVHMLLN-WEVVVXLNSA-N 388.208 5.137 30 20 GKED O=C(C#Cc1ccc(C(F)(F)F)cc1)Nc1cccc(COCc2ccco2)c1 790359581 RTERXBARHGGPAQ-UHFFFAOYSA-N 399.368 5.005 30 20 GKED C=CC[C@H](NC(=O)N(CC=C(C)C)Cc1ccc(Cl)cc1)c1ccncc1 798414416 MUNSMSNDBKFSHT-NRFANRHFSA-N 383.923 5.530 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCC[C@H]([C@H]4CCOC4)C3)nc2c1 799111575 TZLOHCHCBKWGQQ-RYUDHWBXSA-N 383.439 5.310 30 20 GKED CCOC1CC(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 805857104 NLXNRRZACCTASM-MMWSSPAHSA-N 395.311 5.108 30 20 GKED COc1ccc([C@H](Cc2ccccc2)NCc2ccc(O[C@H](C)C#N)cc2)cc1 810170894 CIWVFVCVEQOREN-CLOONOSVSA-N 386.495 5.060 30 20 GKED CC(C)(c1noc(Cc2ccc(OCC#N)cc2)n1)c1cccc2ccccc12 815702096 MXIHDHHCDCONEM-UHFFFAOYSA-N 383.451 5.042 30 20 GKED C[C@H](CC(C)(C)C#N)OC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 851209860 PVNRCCPPAAOAPK-LLVKDONJSA-N 394.258 5.061 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cccc(F)c3Br)cc2)ccn1 864038155 IZHOREPYALVBAH-UHFFFAOYSA-N 398.235 5.259 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccc(Cl)s2)cc1 916915414 JAGFQCCUQUINEN-QGZVFWFLSA-N 388.920 5.024 30 20 GKED CCOc1ccc2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)[nH]c2c1 917119469 HDAHFWFIHRTTQD-JOCHJYFZSA-N 395.462 5.474 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3cccs3)n2)cc1 920139302 QSIHTQSCIOKHJV-QGZVFWFLSA-N 382.510 5.079 30 20 GKED Cc1ccc(-c2cc(C(=O)N(C)c3cccc(C#N)c3)c3ccccc3n2)c(C)c1 920346046 GDRQEYWWOQVWCM-UHFFFAOYSA-N 391.474 5.667 30 20 GKED CC(CCCOc1ccc(Cl)c(C)c1)=NNc1ccc(C(=O)O)c(F)c1 1776075170 RJNWRNVYLBXWAP-UHFFFAOYSA-N 378.831 5.133 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccc(Cl)cc1Oc1ccc(Cl)c(F)c1 1776149373 LVTABUUQMRXNQH-AWEZNQCLSA-N 398.261 5.434 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(Cl)cc(Cl)c1 1776354437 IFYMVNNJZKNUOC-HWKANZROSA-N 379.239 5.375 30 20 GKED CC(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776370455 HSMAKAOOXAATLZ-ACCUITESSA-N 376.477 6.133 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](CC(=O)O)C2CCCCC2)cc1 1776786312 OPAVKQOBEFNAIH-QFIPXVFZSA-N 389.580 5.797 30 20 GKED CCc1oc2ccccc2c1/C=C1\S/C(=N\c2c(C)cccc2C)NC1=O 8199295 OMUQSXNCUFPXIG-UNOMPAQXSA-N 376.481 5.504 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(Cl)cc1F 15077724 OEDOZLSELFNJSQ-UHFFFAOYSA-N 382.847 5.754 30 20 GKED C[C@H](Sc1cccc(C(F)(F)F)c1)C(=O)Nc1sc2c(c1C#N)CCC2 21957961 OIZOWCIHBNXRFX-JTQLQIEISA-N 396.459 5.247 30 20 GKED N#C[C@H](C(=O)c1ccccc1NC(=O)c1ccccc1)c1nc2ccccc2s1 41500271 DTVNNDGYOCLLFI-QGZVFWFLSA-N 397.459 5.039 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 45323763 HLJDVBILHMEOSW-DEOSSOPVSA-N 395.462 5.235 30 20 GKED C=CCNc1nnc(S[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)s1 59407678 WJAZIGKQHIBPTB-CQSZACIVSA-N 396.541 5.242 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)cc2Br)sc2c1CCCCC2 61047446 KMHSKDUQDVZODL-UHFFFAOYSA-N 393.281 5.043 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1csc(-c2cccs2)n1 66802335 FXYHJRWBPBFNOU-CYBMUJFWSA-N 399.566 5.447 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66955750 NECKWYMCTBTBHZ-FXAWDEMLSA-N 379.529 5.758 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](C)c1cccc(O)c1 118821951 ZHNSAOMHDYBHMZ-HOTGVXAUSA-N 383.517 5.401 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3CCC[C@H]3C2)cc1Cl 120439915 KUTIZTNUPIAOJP-QKLQHJQFSA-N 379.891 5.259 30 20 GKED CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CCC#N)c2ccccc2)c1 153182075 HVLAZSSWZWXFDU-FQEVSTJZSA-N 397.906 5.099 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(-c2cccnc2)cc1 176607489 XSARMYUUGCHFQI-SFHVURJKSA-N 396.494 5.055 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc2c(cc1Cl)CCC2=O 191795461 HGMSQINEDSSWJD-UHFFFAOYSA-N 386.838 5.260 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N[C@@H](c1cccc(F)c1)c1ccccn1 301853817 BJYJPTBCXKRXGE-QFIPXVFZSA-N 388.833 5.495 30 20 GKED CC(C)c1nc([C@H]2CCCCCN2C(O)=Nc2ncc(C(C)(C)C)s2)no1 329585833 YEOVEKGEKQAIKF-CYBMUJFWSA-N 391.541 5.110 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1Cl 330588602 WXAPIXIUBRFSIJ-CWSCBRNRSA-N 379.209 5.043 30 20 GKED CC(C)Oc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)c(C(F)(F)F)c1 413364043 DCJZVRHXUUJKJV-DLBZAZTESA-N 388.389 5.106 30 20 GKED N#CC1(CC[S@@](=O)Cc2cc(-c3ccccc3Cl)on2)CCCCC1 417255319 FELUYXMPZUDJDP-RUZDIDTESA-N 376.909 5.108 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CN(C)[C@H](C)c1cccc(C#N)c1 425529404 BQOLYUMIVKSSKD-GOSISDBHSA-N 377.532 5.437 30 20 GKED C=CCN(C(=O)c1ccc(F)cc1C(F)(F)F)c1nc2c(s1)CCCC2 428348483 PHRICPWSDLOLRP-UHFFFAOYSA-N 384.398 5.013 30 20 GKED C[C@@H](c1ccccc1)N(Cc1cn(CCC#N)nc1-c1ccncc1)CC1CCC1 435126982 SYVSSWFQTAUHAE-FQEVSTJZSA-N 399.542 5.222 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccccc1 435597652 KTWHSXCPEYYWMC-FQEVSTJZSA-N 375.472 5.787 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccc(C(C)(C)C#N)cc1 437916909 QNKMOZXHGSTGCR-UHFFFAOYSA-N 381.545 6.082 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H](C)c1ccc(F)cc1F 438052272 IJMKHDYVMSLDDQ-KGLIPLIRSA-N 389.471 5.284 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 439313519 KGUQTQFQCSQAFL-HXUWFJFHSA-N 390.418 5.180 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ncc(-c2ccccc2)o1 439571740 MMHQSPNZBDVIIO-KRWDZBQOSA-N 381.435 6.179 30 20 GKED COc1cc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)ccc1C#N 440637085 LJEBFMBLSNFXHJ-IBGZPJMESA-N 394.824 5.480 30 20 GKED C=CCn1c(S[C@H](c2ccccc2)c2ccc(F)c(F)c2)nnc1C1CC1 463037054 VSTSKPWUZULIEV-LJQANCHMSA-N 383.467 5.501 30 20 GKED C[C@H](C(=O)N(Cc1ccco1)C12CC3CC(CC(C3)C1)C2)c1cccc(C#N)c1 463383757 CGUOWOHTPVQJPU-GXSYWRQXSA-N 388.511 5.252 30 20 GKED CCCOc1ccc(CCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 463749736 WHBQNZVOGQLHSZ-GOSISDBHSA-N 391.298 5.096 30 20 GKED N#C[C@H](C(=O)c1cccc2cnccc12)c1nc(-c2c(F)cccc2F)cs1 466985433 VUTLUWGSNQLTKN-OAHLLOKOSA-N 391.402 5.127 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)s1 469121309 VMAWTBBNFAATNP-MRXNPFEDSA-N 387.936 5.548 30 20 GKED N#CCCCn1cc(C(=O)N2CCCCC[C@H]2c2ccco2)c2ccccc21 469448724 SRVHKLZGBUMIGE-NRFANRHFSA-N 375.472 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1CCN(c2ccccc2)CC1 470134184 RHQYOJQHOUJQSO-UHFFFAOYSA-N 391.559 5.577 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3ccc4sccc4c3)s2)cc1 471148454 SPBPTSGSRBLTOV-UHFFFAOYSA-N 375.478 5.073 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 471285016 CEIRHXWUUXDFQK-UGSOOPFHSA-N 389.377 5.155 30 20 GKED Cc1nc(NC(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)sc1SCC#N 471339947 HPSAYAOAQJTFBO-QMMMGPOBSA-N 386.329 5.116 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H](CO)c2c(Cl)cccc2Cl)CC1 475624768 KFNTWAZANXBCIP-IPFXWSOASA-N 389.326 5.021 30 20 GKED C[C@@H](C#N)CN(C)C(=O)N[C@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 479343556 DSQUKZVYXOJDMF-QWHCGFSZSA-N 395.450 5.296 30 20 GKED C[C@H](NCc1ccc(Br)o1)c1ccc(-c2cccc(C#N)c2)cc1 480301444 OVJWMZCDPIEFAE-AWEZNQCLSA-N 381.273 5.432 30 20 GKED Cc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Oc1ccncc1 487576722 RMVJQGHNPDDKET-QFIPXVFZSA-N 385.467 5.347 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Sc2ccccn2)cc1)c1ccccc1 487578694 XFQCOSLAYLNBSV-NRFANRHFSA-N 387.508 5.398 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1cc(C#N)ccc1Cl 511398963 NYONQGSOJOTXKP-NSHDSACASA-N 399.878 5.274 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC(C)(C)CCC#N)C1 513130442 UPKLYAXQMXAQEA-WMLDXEAASA-N 381.442 5.128 30 20 GKED CC(C)c1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 515447857 JOGPVPHWKGGEQO-UHFFFAOYSA-N 383.451 5.186 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N(C)CCOCc1ccc(C#N)cc1 515476733 NMOMJTSCFDCMAK-UHFFFAOYSA-N 393.531 5.315 30 20 GKED N#Cc1c(NC(=O)c2ccc(OCC(F)(F)F)cc2)sc2c1CCCCC2 516071719 PYCRFVHBTJSDEV-UHFFFAOYSA-N 394.418 5.082 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 517530548 WSCIETCPNWTKEU-SFHVURJKSA-N 381.545 5.833 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 519914124 HVKDVSONURHIGR-UHFFFAOYSA-N 379.504 5.344 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)cc1 520457618 LYAJPSPFGRTYOQ-KRWDZBQOSA-N 385.920 5.500 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccccc2)CCCC1 521260482 DMRSKEJBXPSAMC-GOSISDBHSA-N 393.556 5.572 30 20 GKED CCc1ccc(CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 525023731 CAENTDUVNGAARD-UHFFFAOYSA-N 384.479 5.075 30 20 GKED CCC(C#N)(CC)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 528811343 JSBKKNBBYPRXCI-GFCCVEGCSA-N 375.925 5.279 30 20 GKED CC[C@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 533256203 DTLRLAPMDWDFTM-GHTZIAJQSA-N 395.572 5.350 30 20 GKED C=C(C)COCCN[C@H](C)c1sc(-c2ccccc2Br)nc1C 539059461 CIZCVFJDVPFMAT-CYBMUJFWSA-N 395.366 5.124 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C(=O)OC(C)(C)C)c1 539843789 HOCYEOCMZPWGHW-HNNXBMFYSA-N 396.512 5.288 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](C)c1cccc(C#N)c1 540594405 UAQVFPDYPIWYOU-ZIAGYGMSSA-N 381.932 6.055 30 20 GKED COc1ccc(C[C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2)cc1OC 540594630 CSFXIQHNMXGWAB-WZONZLPQSA-N 386.495 5.210 30 20 GKED CC(C)(C#N)c1nc(-c2ccc(Oc3cccc(Cl)c3Cl)nc2)no1 546542513 XVQJZKQRHZGYKD-UHFFFAOYSA-N 375.215 5.032 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCCCC[C@H]2c2ccccc2)c1 551713330 WAYZILXFBIWSNP-SFHVURJKSA-N 385.414 5.309 30 20 GKED N#Cc1ccncc1C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 553981010 QIROKTQWQBAMKX-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cnn(CC(C)C)c1C(F)F 556159274 CXAVCZXVKVRYHT-UHFFFAOYSA-N 387.883 5.020 30 20 GKED O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccc(F)cc1C(F)(F)F 565270980 MKCXPLRHYTZKER-UHFFFAOYSA-N 385.666 5.769 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)ccc12 570847558 RBNFCLTTZCEUAA-UHFFFAOYSA-N 385.448 5.101 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(OCc2ccccn2)cc1 573036722 ADYUADZWHGCZIT-VWLOTQADSA-N 383.495 5.090 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC(CC(F)(F)F)CC3)c2)cc1 585751718 RERHWGLFDLTSDE-UHFFFAOYSA-N 388.389 5.155 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)c1 589739087 HPSYJNFKVYONPV-REWPJTCUSA-N 394.515 5.273 30 20 GKED N#Cc1cccc(C2(NCc3cc(C(F)(F)F)ccc3Cl)CCOCC2)c1 594984070 METQYPYYZGOQFK-UHFFFAOYSA-N 394.824 5.026 30 20 GKED CC[C@H](C)Cc1c(C)sc2nc(S[C@@H](C#N)Cc3ccccc3)nc(O)c12 598795120 FZIUARJITAAZNN-XJKSGUPXSA-N 397.569 5.521 30 20 GKED Cc1ccc(-c2csc(N(C(=O)[C@H](C)CC#N)c3cc(C)ccc3C)n2)cc1 598801686 NRCMYFLWXRTWHP-GOSISDBHSA-N 389.524 5.950 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 599082493 XRROHMFIEXGOCN-LRDDRELGSA-N 380.797 5.522 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)cn2)c1 603626598 CSJCVWWRCBEGRA-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CCC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)CC1 604562214 QOXYHALNCKPSRZ-UHFFFAOYSA-N 379.460 5.013 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)cc1 609033477 XAXKTDSXODFALY-UHFFFAOYSA-N 397.409 5.219 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cccc(Cl)c1Cl 609416367 KPAOVYYAWCKSGA-OAHLLOKOSA-N 378.646 5.123 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 609573054 UOKSLQIKTZFUKI-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 609636235 GZCNHCMYTPIJMD-XLIONFOSSA-N 393.556 5.486 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 609642999 SXLZONVXVUUUBE-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)CSCc2ccc(C#N)cc2)cc1 609979873 ZUBWBAAYHJOUOO-WZONZLPQSA-N 378.541 5.100 30 20 GKED CCSc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 613318180 OMYLCHHSQPANQD-KRWDZBQOSA-N 378.522 5.721 30 20 GKED C=CCN(C(=O)CCCOC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 643127277 BWYUMHIPFZXVQJ-UHFFFAOYSA-N 385.316 5.063 30 20 GKED Cc1nc2c(C(=O)[C@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cccc2o1 672582354 KHGGACAWDNFTJF-LBPRGKRZSA-N 395.390 5.028 30 20 GKED COc1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)[C@@H](C)C2CC2)cc1 726477867 YYIIEHDGRQZCGP-AWEZNQCLSA-N 399.947 5.218 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2sc3cc(C)ccc3c2Cl)c1 729189009 UHHAZFIHCKLPGC-HNNXBMFYSA-N 382.872 5.133 30 20 GKED N#C[C@H](C(=O)CCc1cc(Cl)cs1)c1nc2cc(Cl)ccc2s1 737323881 XXRBRFGEUOIJQE-GFCCVEGCSA-N 381.309 5.474 30 20 GKED N#C[C@H](C(=O)Cc1csc(-c2ccoc2)n1)c1nc2cc(Cl)ccc2s1 739155522 INYPNDWKGXRQQR-CYBMUJFWSA-N 399.884 5.085 30 20 GKED CC[C@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc(OC)c1 741132653 GKRTUSAKMJLSHC-NRFANRHFSA-N 388.423 5.062 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)cc1 743294205 DOYSMCKMEMQNDN-DNVJHFABSA-N 385.442 5.159 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Br)s1 744016616 PFIKBELCXQNBJX-ZJUUUORDSA-N 391.315 5.100 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1F)C1CCCCC1)c1cccc(C#N)c1 745923569 SSRXLCMLEHPWRY-KRWDZBQOSA-N 379.479 5.303 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)n1 747198962 PBTRNVVIIHNRGC-ACVFHECNSA-N 398.837 5.828 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1coc2ccccc12 747706253 SXSZRRDQVXEPDT-CMDGGOBGSA-N 376.393 5.361 30 20 GKED Cc1nc(CCCC(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 750201672 FKQPKAMKMSAWGO-UHFFFAOYSA-N 378.453 5.044 30 20 GKED COc1ccc(OC)c(C=NO[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)c1 752762683 WMDHYFZAAFWFOQ-ZDUSSCGKSA-N 386.835 5.124 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2c(Cl)oc3ccccc23)ccc1OC 761312559 IDXHCBGVVDKAOH-OAHLLOKOSA-N 384.863 5.066 30 20 GKED CCOc1ccc(C(=O)/C=C/c2csc(-c3ccccc3)n2)cc1[N+](=O)[O-] 765615514 GVASIYDNTILZJL-MDZDMXLPSA-N 380.425 5.013 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1NCc1ccc(Cl)cc1 765821480 OZRYMNWKFSFTMK-UHFFFAOYSA-N 389.886 5.199 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2[C@H]3c4ccccc4C[C@H]32)cc1 768969039 JCPBPYBYHLAYGY-LIONHTAISA-N 393.490 5.049 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c(Cl)c1 768995560 JYCDDWKAAQGLSQ-QGZVFWFLSA-N 393.796 5.599 30 20 GKED Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)O[C@H](C#N)C1CCCCC1 776397538 ADFNSRUNUBUDHI-MRXNPFEDSA-N 391.393 5.033 30 20 GKED C[C@H](OC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 784865123 OVSQTSINGNHHHK-LBPRGKRZSA-N 386.329 5.150 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(SC(F)F)cc2)c2ncc[nH]2)c1 787167245 BTMPFJHZCYMUBH-BOPFTXTBSA-N 386.423 5.157 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cn(CCC#N)nc1-c1ccccc1 788350235 MRTJDRYRUMECJZ-SEYXRHQNSA-N 380.451 5.150 30 20 GKED O=[N+]([O-])c1cc(Cl)cc(C=Nc2ccc3nc(C(F)F)sc3c2)c1O 794676636 OTIMAFSXFOADBB-UHFFFAOYSA-N 383.763 5.252 30 20 GKED O=C(C[C@H]1CCC(F)(F)C1)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 797972648 XFNKIAJZIJTTOQ-NOZJJQNGSA-N 389.286 5.251 30 20 GKED Cc1cc(Cl)c2ncc(C#N)c(N3CCC([C@@H](O)c4ccccc4)CC3)c2c1 801667401 LYOVABYTXURQQT-QHCPKHFHSA-N 391.902 5.018 30 20 GKED C=C(C)COc1cc(CNc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)ccc1OC 815166139 ZHSOLEUCHQQCFZ-VGOFRKELSA-N 394.515 5.024 30 20 GKED C=CCCn1cc(CNc2ccc3c(c2)CN(c2ccc(C(C)C)cc2)C3)nn1 848661934 BNCYBSDVIGLHRP-UHFFFAOYSA-N 387.531 5.110 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@](C#N)(c2ccccn2)C1 852332824 WAABGEHPCGDZQA-OPAMFIHVSA-N 392.890 5.008 30 20 GKED O=[N+]([O-])c1cc(C(F)F)ccc1N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 853226735 GEIMXFDGICUFKE-IUCAKERBSA-N 392.246 5.100 30 20 GKED C=C(C)C[C@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 904033697 VYZAIDPLKVQAEY-SFHVURJKSA-N 377.843 5.089 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)cc1)c1nc2cc(Cl)ccc2s1 917046682 MEEYPISFVWVEEI-AWEZNQCLSA-N 375.280 5.412 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(CC2CCCCC2)C2CC2)cc1 918034859 XRURDBGIEMFTQZ-XMMPIXPASA-N 387.527 5.919 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(Cl)nc(Cl)c1 919893280 DACCYAYODHEBPW-UHFFFAOYSA-N 398.249 5.613 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cc3ccccc3s2)cc1 920783110 LMMNCFGBMDFHMM-QFIPXVFZSA-N 397.503 5.878 30 20 GKED Cc1c(NN=Cc2ccc(-c3ccc(C(C)(C)C)cc3)o2)cccc1C(=O)O 1776087136 KNVGVAONDQLTEA-UHFFFAOYSA-N 376.456 5.697 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1cccc(OCc2ccccc2C(=O)O)c1 1776665813 DGTGXMHYRQKWHG-WMWHPZEKSA-N 398.458 5.422 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2)c(Cl)c1 1776782986 UHQAALFPAQNEOR-HXUWFJFHSA-N 387.951 6.300 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O 1777342063 VPCAFVFIZSAAEU-QNCNLXEUSA-N 398.458 5.509 30 20 GKED Cc1cc(COc2ccc(/C=C3\C(=O)c4ccccc4[C@H]3C)cc2)oc1C(=O)O 1777423191 AKTSUMSZWDWPMX-OFNOZLENSA-N 388.419 5.249 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3sccc3Br)c2c1 1777683963 INANLWAOMLKTQM-IWQZZHSRSA-N 393.283 5.320 30 20 GKED Cc1ccc(N2C(=O)/C(=C/c3ccc(C(C)C)cc3)N=C2SCC#N)cc1 4462813 ASQMFQPNSRDCLH-ZHZULCJRSA-N 375.497 5.119 30 20 GKED Cc1ccc(NC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)c(Cl)c1 6409274 NDGDCNAXSGLHIQ-UHFFFAOYSA-N 376.843 5.205 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cccc(Cl)c2)cc1 10830338 WHUFRMXNHRICPK-UHFFFAOYSA-O 395.935 5.241 30 20 GKED N#Cc1ccc(CCC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1 57084399 CKTJGMGTUUNMJD-NRFANRHFSA-N 380.900 5.112 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3nc4ccccc4s3)s2)c(C)c1 61067500 IPVDMQUCFPSMRE-HNNXBMFYSA-N 389.505 5.527 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1csc(-c2ccc(CC)cc2)n1 104834856 FRAFNQWMMRZFGX-UHFFFAOYSA-N 382.554 5.191 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)n1 106982224 QTFXAZLFJQKWNS-MJGOQNOKSA-N 382.485 5.301 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1cscc1C 120611563 NFKZPDOQHKCTMZ-UHFFFAOYSA-N 377.469 5.460 30 20 GKED N#CCC[C@H](Nc1cc(N[C@@H](CCC#N)c2ccccc2)ncn1)c1ccccc1 127935974 MQIGDVJFKXWIJG-VXKWHMMOSA-N 396.498 5.391 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2ccncc2)cc1Cl 129777788 PZTASIYKYPKJCH-LJQANCHMSA-N 393.899 5.121 30 20 GKED C[C@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccsc1 152400196 DYEXTHCMHJQQRN-INIZCTEOSA-N 376.481 5.135 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cnc(-c4ccsc4)s3)n2)c1 161100517 UDJADJPNRCKYAQ-UHFFFAOYSA-N 394.506 5.119 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1ccccc1OCC#N 171085677 VIRIKISJKKPPJX-GOSISDBHSA-N 386.451 5.290 30 20 GKED C=CCOc1ccc(CN(C(=O)C[C@@H](C)c2c(C)noc2C)C(C)(C)C)cc1 188079674 QYWCGDWLMHYIIP-MRXNPFEDSA-N 384.520 5.177 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(-n2ccnn2)cc1 191517707 WITOQONWWNOVNT-KRWDZBQOSA-N 389.503 5.002 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 237957178 NOEDBSNYTCKLGR-UHFFFAOYSA-N 377.400 5.149 30 20 GKED CC(C)(C)c1nc2ccc(N=C(O)N3CCC[C@@H]3C3CCOCC3)cc2s1 329415319 CYKQUCFXAWMVSG-QGZVFWFLSA-N 387.549 5.030 30 20 GKED OC(=Nc1cccc(-c2cc[nH]n2)c1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329447975 MHGQHWQDNMFJOD-SFHVURJKSA-N 389.503 5.172 30 20 GKED C[C@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1cccc(Cl)c1 329802875 ZHTAFXSJLVRABM-MGPUTAFESA-N 384.907 5.000 30 20 GKED CC1(C)CCCC[C@@H]1/C(O)=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1 329866160 AWKKLSCIIUZZSE-IAGOWNOFSA-N 389.540 5.644 30 20 GKED C[C@@H]1C(=O)CC[C@H](C(O)=Nc2nnc([C@H]3CCCc4ccccc43)s2)C1(C)C 330319400 DEUVRIPVHVEKIC-XOKHGSTOSA-N 397.544 5.236 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c2[C@@H]1C 410978170 CMSLOSOOKURJJI-NWDGAFQWSA-N 394.525 5.076 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)Nc2ccccc2C#Cc2ccccc2)cs1 429325223 DFWTWPJWMDCANX-JOCHJYFZSA-N 387.508 5.220 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)c1sccc1C#N 432867260 ROIPFXNNVHOGEK-UHFFFAOYSA-N 380.494 5.173 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(NCCC)cc1 434458627 HDCAPVGDRNGYCE-UHFFFAOYSA-N 377.941 5.121 30 20 GKED CC[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 437839273 HYMNGBWSIUPSDH-QHCPKHFHSA-N 377.488 5.703 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](Cc1ccccc1)c1cccs1)c1ccccc1 438856255 KQVDALGHFIAVJL-LEWJYISDSA-N 389.524 5.376 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)cc2Cl)ccc1OC1CCCC1 439447583 RSYUYYWVASPRDH-HNNXBMFYSA-N 384.907 5.392 30 20 GKED CCO[C@@H](C)c1nc(CSCc2ccc(C#N)cc2OC(F)F)cs1 439538016 WRTKJDKEZYOJSN-NSHDSACASA-N 384.473 5.147 30 20 GKED CCCc1c(NC(=O)Nc2c(C)cccc2Cl)cnn1-c1cccc(C#N)c1 439707464 XLLBQHYONOIVTD-UHFFFAOYSA-N 393.878 5.302 30 20 GKED C[C@H](c1cccc(C#N)c1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 442693003 OFZUAWFIMVWWDS-DNVCBOLYSA-N 392.890 5.202 30 20 GKED Cc1cc(Br)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 443922034 UVIWGLIWWHVQGB-UHFFFAOYSA-N 396.288 5.268 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 444664413 QSHHZDPQPGTVSV-KRWDZBQOSA-N 386.927 5.289 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F)c1ccccc1 458803412 REYZXIGUTKSDQX-YADHBBJMSA-N 397.469 5.637 30 20 GKED Cc1cc(F)cc([C@@]2(F)CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c1 458854163 XBBLLNDNRVAPSW-JTHBVZDNSA-N 397.469 5.149 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 459642948 CFULTOVANSAPBR-HNNXBMFYSA-N 399.350 5.026 30 20 GKED CCC(CC)(CNCc1cn(CCC#N)nc1-c1ccccc1)c1ccccc1 462755785 WGCCBLCTGUVKMO-UHFFFAOYSA-N 386.543 5.311 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H](C)c1cccc(C#N)c1 463345461 POTVRJQTBDBCBX-GOSISDBHSA-N 397.453 5.214 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)Cc1cc(F)ccc1F 463753671 MCVJCRPBDHDBMV-UHFFFAOYSA-N 394.396 5.060 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCC(C)(C)c1c(F)cccc1Cl 466223171 YGRYVSGRKNUTSY-UHFFFAOYSA-N 399.897 5.026 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)CCc2ncc(-c3ccccc3F)o2)CC1 470197195 YPROGQDKOGYFER-UHFFFAOYSA-N 397.494 5.028 30 20 GKED C=CCOc1cccc(NC(=O)c2c(-c3c(Cl)cccc3OC)noc2C)c1 475117363 LGIMKWZJEJCSJV-UHFFFAOYSA-N 398.846 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccc(C)o1)N1CCCC1 475547912 PBLUBSTUBJBLTR-OAQYLSRUSA-N 395.547 5.399 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](COCc1ccccc1)c1ccccc1)c1ccccc1 476094403 HNDQLUHFDYPAKP-DQEYMECFSA-N 398.506 5.148 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2nnc(C(C)(C)C)n2c1 476802478 WOSWKXYCXCPMCB-UHFFFAOYSA-N 376.504 5.131 30 20 GKED N#C[C@H](C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1nc2ccccc2s1 480895273 SWXUXTADXKKUEI-QGZVFWFLSA-N 394.459 5.125 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc4oc(C5CC5)nc4c3)c2)cc1 482838683 JCCATNIUEHDVTA-UHFFFAOYSA-N 395.418 5.621 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(Cl)c1Br)c1ccccc1 484062387 CJDPMUBNEMZGAR-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cnn(C(CC)CC)c1CC 485190635 MIPIUWSMOUJZFB-UHFFFAOYSA-N 384.524 5.035 30 20 GKED Cc1oc(-c2cccs2)nc1CSc1nc(C(F)(F)F)ccc1C#N 488780836 FSBVYWJESOZXSW-UHFFFAOYSA-N 381.404 5.289 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1ccc(C(F)(F)F)cc1 500234141 ULPSVTYOLSIBHO-UHFFFAOYSA-N 395.274 5.428 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(-c4nncs4)cc3)c2)cc1 505295797 MQFSAWWVVPGVCF-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCN(Cc1ccc(OC)c(OCCCC#N)c1)Cc1ccc(Cl)s1 506084619 CXIBOAVVWXSNTN-UHFFFAOYSA-N 378.925 5.115 30 20 GKED COc1ccc([C@H](NC(=O)c2cc(C#N)ccc2Cl)c2ccc(C)cc2)cc1 506773507 FAGLOOVEWBJLJL-JOCHJYFZSA-N 390.870 5.048 30 20 GKED CC(C)N(Cc1cccc(F)c1)Cc1cn(CCC#N)nc1-c1ccccc1 507168984 UANDIJDSORFMEL-UHFFFAOYSA-N 376.479 5.013 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H]2CCC[C@@H](C)C2)cc1 508239032 CFLPSLUEGMLNOB-APWZRJJASA-N 393.487 5.402 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 513114235 YVBKPGSVBJVUCM-QGZVFWFLSA-N 388.442 5.110 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CC1(C(F)(F)F)CC1 513200726 WKRQPNLUPFAKMH-UHFFFAOYSA-N 396.356 5.382 30 20 GKED N#Cc1ccc(F)c(CSCc2nc(-c3ccc(C(F)(F)F)cc3)no2)c1 517177737 DLYNGYLVGNWUKM-UHFFFAOYSA-N 393.365 5.200 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H](C)c1ccccc1F 517512785 CJILOJPHFNLBNJ-QGZVFWFLSA-N 388.442 5.327 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 517913276 DJWCYCQGUZCYEN-QFIPXVFZSA-N 382.479 5.073 30 20 GKED Cc1ccc(OCCCCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518256987 VQYJWKSKZPLUGE-GOSISDBHSA-N 397.544 5.370 30 20 GKED C=CCn1c(SCCCOc2ccccc2C)nnc1-c1ccccc1OC 520014154 NXTTXYLHQYLHQC-UHFFFAOYSA-N 395.528 5.009 30 20 GKED C[C@H](CC(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2)c1cccnc1 522887785 KJYDBKDIFLWDCU-ZBFHGGJFSA-N 381.545 5.298 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F)OCC 533764171 SFNYKJLPKQGXQO-CXAGYDPISA-N 389.483 5.906 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCC(F)(F)F)cc1Cl 537743797 ADNLTIZYWQDTSC-INIZCTEOSA-N 380.797 5.667 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)ccc1OCc1ccccc1 538151204 PRMOAMYMNABCHY-RTBURBONSA-N 386.495 5.558 30 20 GKED CC(C)C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 540343859 NPMBTIGDCNOXRT-NQIIRXRSSA-N 395.572 5.396 30 20 GKED Cc1c(NC(=O)c2ccc(Cl)c(C#N)c2)cccc1C(=O)Nc1ccccc1 541607093 XKVLTHKDCBXIMS-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#CCC1CCN(C(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 543834751 FAIWHZHHTLMRIL-QFIPXVFZSA-N 398.959 5.315 30 20 GKED FC(F)(F)CCc1noc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 545616467 NWMSUYBJASCKMR-UHFFFAOYSA-N 378.194 5.269 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(CC(F)(F)F)c1 554258986 NGCQPKSHZFWNJP-UHFFFAOYSA-N 394.441 5.179 30 20 GKED Cc1sc(C2(NCc3cccc(F)c3C#N)CCC2)nc1-c1ccccc1F 575191813 GNDVZKZBXDOMQW-UHFFFAOYSA-N 395.478 5.437 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC3(CCCCC3)C2)cc1 575755284 IIZBIYZRXWGLFF-UHFFFAOYSA-N 391.471 5.157 30 20 GKED CSc1ccc(C)c(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 579178867 LBTXPSDDTTXNQA-UHFFFAOYSA-N 390.468 5.420 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc([C@H]2CCOC2)cc1 579557977 GTPBCHKZSRTBMA-WBVHZDCISA-N 381.501 5.229 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1cccc(C#N)c1 586791012 RQRNKNIOGHYNED-QGZVFWFLSA-N 377.447 5.264 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1csc(-c2ccccc2Cl)n1 589322608 UUHRKSCFLQIYRS-UHFFFAOYSA-N 398.915 5.301 30 20 GKED COc1cccc(C2(NC(=O)Nc3ccccc3S[C@@H](C)CC#N)CCC2)c1 596737010 YAXXFQSSQABUNB-INIZCTEOSA-N 395.528 5.290 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N3CCC[C@H](CC#N)C3)c2)c1 597909773 OYEMJCLUFGFKRM-LJQANCHMSA-N 378.541 5.362 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1cc(C(F)(F)F)ccc1Cl 599422299 LORKEXCBLWNGAT-SFHVURJKSA-N 380.797 5.004 30 20 GKED C=CC1CCN(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)CC1 600821487 ANPVCORFJSGTQT-UHFFFAOYSA-N 395.450 5.183 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@H]1CCC(F)(F)C1 601059746 KCESEXIKQOGSNX-KGLIPLIRSA-N 384.517 5.188 30 20 GKED CCOc1ccccc1CCC(=O)N(Cc1ccccc1)c1ccccc1C#N 603532641 UIADHHKOOMIETR-UHFFFAOYSA-N 384.479 5.123 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCCc3cccs3)cc2)c1 609064473 XZOZCLJMNJNWIC-UHFFFAOYSA-N 376.481 5.160 30 20 GKED COc1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 609262173 QEDWKBIVXYYLJI-INIZCTEOSA-N 382.872 5.318 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N[C@H](c3cccs3)C3CC3)c2)cc1 609641227 CMHWIFXMBNWMDP-QFIPXVFZSA-N 388.492 5.080 30 20 GKED CCN(Cc1ccoc1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609724067 FKMRTRNKGRERST-UHFFFAOYSA-N 380.831 5.259 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](Cc2ccccc2)c2cccs2)cc1 609743544 CKCOWPPTNPHSPR-FQEVSTJZSA-N 389.524 5.655 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 610172663 UGTOHIMFTOAEOC-CQSZACIVSA-N 390.405 5.497 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611851661 DDHLMACOXZKJPB-MSOLQXFVSA-N 384.483 5.050 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(COc3ccc(Cl)cc3)cc2)n1 613286788 PWHVETJKEDVKGN-SFHVURJKSA-N 382.872 5.174 30 20 GKED N#Cc1ccc(C(F)(F)F)c(NCc2cccc(OCc3ccccn3)c2)c1 613871322 QKFXLRCANHOMOZ-UHFFFAOYSA-N 383.373 5.163 30 20 GKED COc1ccccc1-c1cccc(NC(=O)NCc2ccc(C#N)c(Cl)c2)c1 619788748 RRAQOJVEAKVSHJ-UHFFFAOYSA-N 391.858 5.209 30 20 GKED O=C(c1ccc(C(F)(F)C(F)(F)F)cc1)N(CCC(F)(F)F)CC1CC1 622822788 WJQJNHAVXPXFHG-UHFFFAOYSA-N 389.286 5.145 30 20 GKED C[C@@H](CC(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1)C(F)(F)F 626849075 MAENYUNQFITYRL-NSHDSACASA-N 385.323 5.081 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(COC3CCCCC3)c2)cc1Cl 726481254 RNJPCYOYERGXPC-UHFFFAOYSA-N 399.947 5.870 30 20 GKED Cc1c(C(=O)/C=C\c2ccccc2C(F)(F)F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727267889 VTRBEZHUZVEBEB-FPLPWBNLSA-N 394.305 5.035 30 20 GKED CCn1c(/C(Cl)=C\c2cccc(OCCCC#N)c2)nc2c(F)cccc21 728438755 NCTMRUIPDBMEQH-SAPNQHFASA-N 383.854 5.615 30 20 GKED CC(C)c1ccc(Nc2nn(CN(CCC#N)CC3CC3)c(=S)s2)cc1 728904436 DBPZZXMIDPTYFS-UHFFFAOYSA-N 387.578 5.124 30 20 GKED CC[C@@H](OC(=O)CCc1c(C)nn(CCC#N)c1C)c1ccc(C(C)(C)C)cc1 731778342 IWOCQEQEIIGOHF-JOCHJYFZSA-N 395.547 5.338 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1nc2ccccc2s1 731963416 KHMSQVZVZKMUOG-UHFFFAOYSA-N 399.475 5.431 30 20 GKED O=C(/C=C\c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccc(Cl)s1 732713840 MHJBVMJXZJCIIX-YVMONPNESA-N 393.693 5.450 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(SC(F)F)cc2)c1 733842456 VWRKZQWNXCUBCR-OAHLLOKOSA-N 391.443 5.004 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)cc1 739156593 ZJMMKMCLCPXHJO-YJBOKZPZSA-N 382.891 5.305 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2ccc(-c3ccccc3OC)cc2)c1 741502969 MGUDFWJYHQHVAB-QGZVFWFLSA-N 386.520 5.391 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1C#N 741840899 BGBLEJSDHZFOMV-KRXBUXKQSA-N 377.387 5.117 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C/c1cnc(C(C)(C)C)s1 742486723 XRRGPSQZDLWOHB-VQHVLOKHSA-N 380.966 5.384 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@]34CCCc3ccccc34)n2)cc1 744031566 MVZCMHCDDVSTBA-QVNIBDNGSA-N 398.531 5.589 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 744073811 GDASXGZJPYJZOA-RISCZKNCSA-N 386.398 5.207 30 20 GKED O=C(Cc1ccccc1F)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746435988 BPFLYWKXYQJQMA-OAHLLOKOSA-N 380.259 5.234 30 20 GKED O=[N+]([O-])c1cccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)o2)c1 754710249 SCOAKJSHVOEVGE-UHFFFAOYSA-N 376.290 5.287 30 20 GKED C=CC[C@H](N[C@@H](C)c1cc(Br)cc(Cl)c1O)c1ccncc1 756581460 CULCBKDSKAXNHO-ZBEGNZNMSA-N 381.701 5.171 30 20 GKED C=CCN(C(=O)c1ccc([N+](=O)[O-])c(Cl)c1)c1nc(-c2ccccc2)cs1 764148857 LVVBUEJRUNFNTH-UHFFFAOYSA-N 399.859 5.205 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(Cl)s2)c(OCc2cccnc2)c1 766484881 RBQANOBGWSRUIZ-FNORWQNLSA-N 385.872 5.280 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1ncc(Br)cc1F 777421350 LPKLTKBCEJMCHE-UHFFFAOYSA-N 393.647 5.021 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 780577148 OTNMSTUGKUEHCF-QGZVFWFLSA-N 387.439 5.722 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)C1 784743290 CMWZYMIILDWREM-QHCPKHFHSA-N 389.886 5.321 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2CCC(F)(F)C2)cc1Cl 797831529 RZFHCAPZNMTVNR-KDOFPFPSSA-N 388.845 5.759 30 20 GKED N#CCOc1ccccc1-c1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 809448676 WEWJPMXEFTVWGD-UHFFFAOYSA-N 396.180 5.086 30 20 GKED CC(CCCCNC(=O)OC(C)(C)C)=NNc1ccc(C#N)c(C(F)(F)F)c1 811641197 RMJOPWMRMMOYRD-UHFFFAOYSA-N 398.429 5.060 30 20 GKED Cn1cc(/C=C/C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C(F)F)n1 812241165 DUBPSLBUJUSZKU-NSCUHMNNSA-N 398.253 5.291 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)ON=Cc2cccc(Cl)c2Cl)c(C)c1 818618286 TXDQWAYELGZHGG-AWEZNQCLSA-N 379.287 5.296 30 20 GKED C[C@]1(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1(Cl)Cl 835068619 SHMLHSDUQMJMEC-LRDDRELGSA-N 399.730 5.614 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccc(C#N)cc2)C1 931060844 XKJPAYBPMQVSAY-JOCHJYFZSA-N 389.499 5.016 30 20 GKED CC(=NNc1c(Cl)cccc1Cl)c1oc2cc(C)ccc2c1CC(=O)O 1776048870 HPHVJKQCNGNTSC-UHFFFAOYSA-N 391.254 5.511 30 20 GKED O=C(O)C(=O)/C(=C/c1ccc(-c2ccsc2)cc1)c1ccc2ccccc2n1 1776117232 RITKFJNHLDCBFB-CPNJWEJPSA-N 385.444 5.158 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776697811 PABHZCRKXKJJAF-OBEJXRGXSA-N 390.504 6.523 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CCc3cc(C(=O)O)ccc32)cc1 1776785993 WYFQVBOIUKNSPK-UHFFFAOYSA-N 379.500 5.491 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](C(=O)O)C2CCCCCC2)cc1 1776786300 NMROWOIFDCXZMA-HSZRJFAPSA-N 389.580 5.797 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2cccc(C)c2C)cc1 1776787993 JZBGROFNRRQJDA-XMMPIXPASA-N 397.559 5.958 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccc(/C=C\C(=O)O)cc1 1777488308 ZPXHDZNYRCMMER-XSYHWHKQSA-N 375.449 5.112 30 20 GKED COc1ccc(SCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCCC2)cc1 25795276 UGQFEDZJRORNIC-UHFFFAOYSA-N 397.544 5.221 30 20 GKED Cc1nc(CSc2ccc(C(=O)N[C@H](C)c3ccc(C#N)cc3)cc2)cs1 31433379 JMFXOVYQKMETLB-CQSZACIVSA-N 393.537 5.107 30 20 GKED N#C[C@@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1nc2ccccc2[nH]1 46706402 CACDUDHUGAZGBV-IBGZPJMESA-N 383.476 5.345 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cn1 56750706 ILCNTCCHJYUSEE-UHFFFAOYSA-N 392.846 5.029 30 20 GKED CSc1cccc(NC(=O)[C@@H](C)Nc2ccccc2SC[C@@H](C)C#N)c1 108407477 ZJMAIFAMAKGSBG-LSDHHAIUSA-N 385.558 5.099 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 108531396 LAQASMNPBXAOSA-DNVCBOLYSA-N 399.947 5.961 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 116505747 USDWPNYGTURXMB-HHHXNRCGSA-N 390.593 5.334 30 20 GKED C[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)c1ccc(C#N)cc1 118172538 GYSRLISWAXAGPB-KRWDZBQOSA-N 397.507 5.113 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3cccc(C)c3)n2)cc1 124340781 XFKGLLLDSQETEO-DNVCBOLYSA-N 376.481 5.107 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)ccc1NC(=O)OC(C)(C)C 132184456 MJCQYYXLOAMGOZ-OAHLLOKOSA-N 399.516 5.412 30 20 GKED COc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 153999614 OMUQEDLZFQQCKS-SJORKVTESA-N 395.528 5.111 30 20 GKED CC(C)CN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 164582870 HKOYOWWPVJRQBG-FCHUYYIVSA-N 390.531 5.172 30 20 GKED N#CCCCC[S@@](=O)Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 172841902 UFNVHDPSSRVJLU-XMMPIXPASA-N 382.312 5.728 30 20 GKED N#C[C@@H](C(=O)[C@@H]1SCCc2ccccc21)c1nc2cc(Cl)ccc2s1 174002493 AQDKPRWKOUBMDP-KBXCAEBGSA-N 384.913 5.157 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(Cl)s1 175132962 FYSSCTZIKSNQNE-FZMZJTMJSA-N 397.912 5.377 30 20 GKED N#CCC[C@@H](N[C@H]1CCSc2ccc(Br)cc21)c1ccccc1 181576723 FEYSBYPZNDHEHH-MSOLQXFVSA-N 387.346 5.621 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCOc2c(F)cccc21 181712397 KDCILQUBDKDSKZ-RHSMWYFYSA-N 399.491 5.113 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(NC(C)=O)ccc1Cl)c1ccc(F)c(F)c1 186352119 RKCPTPXYBQFFET-SFHVURJKSA-N 393.821 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](COCc2ccccc2)C1 191476785 DUVZDGIMJOXVCS-OAQYLSRUSA-N 392.543 5.609 30 20 GKED C=CCn1c(-c2cccnc2)nn(CN2CCC[C@@H]2CC2CCCCC2)c1=S 303036040 YLOSWCZALWCDKM-HXUWFJFHSA-N 397.592 5.054 30 20 GKED C=C(C)COc1cc(CNCc2nc(-c3ccccc3F)cs2)ccc1OC 428473673 OAKOSWNBISKJMW-UHFFFAOYSA-N 398.503 5.203 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cccc(SCC#N)c1 429958870 BNYYMAZNROJCIT-CYBMUJFWSA-N 378.419 5.154 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(CSC3CCCC3)c2)c1 430609383 HKXFRGQCOSPWDK-UHFFFAOYSA-N 382.554 5.730 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(OC(F)F)c1 431806534 BRYKIVGMOVMMEI-DNVCBOLYSA-N 387.430 5.083 30 20 GKED COc1cc(-c2nc(CSc3ccc(C#N)cc3Cl)cs2)ccc1O 436766484 DTAHVVOALNERJN-UHFFFAOYSA-N 388.901 5.342 30 20 GKED C[C@H](SCc1ccc(C#N)cc1OC(F)F)C(=O)Nc1ccccc1Cl 439553768 ZFLLJQZNLSFCSY-NSHDSACASA-N 396.846 5.073 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc3oc(C4CC4)nc3c2)c2ccccc21 443950436 HKUMYVUJDPRVAK-UHFFFAOYSA-N 384.439 5.216 30 20 GKED N#CCCCn1cc(C(=O)NC2(c3cccc(Cl)c3)CC2)c2ccccc21 444253350 PAZHCYATBNDNPU-UHFFFAOYSA-N 377.875 5.018 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(F)cc2OCC2CC2)c2ccccc21 444254238 RTSGJYOYKXTIEF-UHFFFAOYSA-N 391.446 5.125 30 20 GKED C=CC[C@H]1N(C(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CCCC1(C)C 444639265 YYLOUJMRIQCFOP-TZIWHRDSSA-N 383.580 5.087 30 20 GKED Fc1ccc([C@@H](NCc2nc(C(F)(F)F)cs2)C(F)(F)F)cc1Cl 444812501 NMPAYHPKVNMTDG-LLVKDONJSA-N 392.727 5.348 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCn2cccc2[C@H]1c1ccccc1)c1ccccc1 458806322 VZKVNIBVMMHNNR-ISKFKSNPSA-N 398.510 5.038 30 20 GKED C=C(C)Cn1c(-c2ccoc2)nnc1N1CCC[C@H]1c1nc2ccccc2s1 460396107 XBORDLINWJHOTD-KRWDZBQOSA-N 391.500 5.065 30 20 GKED C[C@@H]1CCc2c(F)cccc2[C@H]1Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468879138 GLANEUQPDLBPPR-GYCJOSAFSA-N 391.490 5.144 30 20 GKED CC(C)(c1ccc(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1)C(F)(F)F 468920698 JLXCNFCRJLMPPY-UHFFFAOYSA-N 386.417 5.203 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1 469275402 RPBRVEKXPIDZIN-HXUWFJFHSA-N 381.907 5.486 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)c2ccccc21 473663383 SCGWWMNKCVWUAX-UYAOXDASSA-N 389.474 5.150 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccccc1 474410740 GFURQSDASFJOER-LJQANCHMSA-N 380.451 5.256 30 20 GKED N#CC[C@H](CC(=O)Nc1nc(-c2ccccc2Cl)cs1)c1ccccc1 475770613 MXMBWXURQGNILI-OAHLLOKOSA-N 381.888 5.490 30 20 GKED N#CC1(F)CCN(C(=O)Nc2cccc(CSC3CCCCC3)c2)CC1 476129838 BYRCUDKXTAAEEG-UHFFFAOYSA-N 375.513 5.112 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Br)c(Cl)c1)c1ccccc1 476401307 ZJFVLZABDSALIS-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED C=C(C)[C@@H](NCC(=O)Nc1ccccc1-c1ccccc1)c1ccc(F)c(F)c1 481604240 XUAZDLCRDAVEOJ-XMMPIXPASA-N 392.449 5.477 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1csc(CCc2ccccc2)n1 481645982 PLDWUIGTXYRWSF-QHCPKHFHSA-N 387.552 5.357 30 20 GKED CN1CCC[C@H](CN[C@H]2CCCCc3cc(C#N)ccc32)[C@@H]1c1cccs1 481667830 KNBAYLRKYHKQBD-UNWVZKJWSA-N 379.573 5.060 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@H](C#N)c2nccc3ccccc23)cc1 483198467 QMVKAPRZIXZHBG-HSZRJFAPSA-N 390.442 5.264 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 484863389 XMLBIDLKWWVQRY-UHFFFAOYSA-N 388.467 5.416 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 485246541 PWKUBYOWEUWCNE-LAUBAEHRSA-N 381.545 5.908 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCCCCC(=O)C1 486259829 MJYWMEMRZQVPGS-HXUWFJFHSA-N 392.474 5.079 30 20 GKED C[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 487175444 IYHLMOBCCLNGDO-OXQOHEQNSA-N 388.433 5.750 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(CN4CCCC4)cc3)c2)cc1 490192182 BYGSPVBLJNWNGF-UHFFFAOYSA-N 397.478 5.199 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1C1CC1 499607842 HKBQZGQQRYXWDM-UHFFFAOYSA-N 382.533 5.015 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N(Cc1ccc(C#N)cc1)CC(C)C 500303799 AWUJOVAVXWWHFI-UHFFFAOYSA-N 395.553 5.350 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(C)n(C(C)C)c1C 500745560 SJQCKJFYNZIBLI-UHFFFAOYSA-N 387.483 5.911 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)CCc3ccc(C#N)cc3)s2)cc1 502468930 AHTOWZZKFUZOEU-INIZCTEOSA-N 389.524 5.109 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCCc3ccc(Cl)c(Cl)c3)CC2)cc1 503853702 BHSSOWGCKYDPPR-UHFFFAOYSA-N 399.321 5.504 30 20 GKED Cc1c(C(=O)Nc2cc(F)ccc2OCC2CC2)sc2ccc(C#N)cc12 506667504 BSLAYDGSCZBQBH-UHFFFAOYSA-N 380.444 5.262 30 20 GKED COc1ccc(C)cc1NC(=O)[C@H](Sc1ccc(C#N)cc1)c1ccccc1 509654523 XQCIEKSAPRLSAM-JOCHJYFZSA-N 388.492 5.347 30 20 GKED C[C@@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1F 512617993 HHLQSZAKHQSSDC-MRXNPFEDSA-N 379.479 5.067 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)o1 518308533 CXPJYQWNEPYNHO-BEFAXECRSA-N 388.492 5.356 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H](c3ccccc3)[C@H]3CCCO3)c2)c1 520962580 JCAWCAMGUMGGHE-FTJBHMTQSA-N 398.506 5.147 30 20 GKED C=CCN(C(=O)CCc1ccnc2ccccc12)c1nc(-c2ccccc2)cs1 522963811 IIJOZRIYELEVRQ-UHFFFAOYSA-N 399.519 5.510 30 20 GKED COc1ccc(-c2nc(CN3CCC[C@H]3[C@H](C#N)c3ccccc3)cs2)cc1 530970910 SGACSTVTVPCBCP-YADHBBJMSA-N 389.524 5.090 30 20 GKED C[C@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccc(C#N)cc1 532207023 IXRPFUJTHBWWSZ-RBUKOAKNSA-N 396.494 5.197 30 20 GKED COC(=O)c1oc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1C 541085908 RSYDRFRIWFBCPG-IRXDYDNUSA-N 388.467 5.325 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 544735478 WSQRAKWEFFJGMX-UHFFFAOYSA-N 376.500 5.047 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 544741284 UELZRIKDQPSJIF-GOSISDBHSA-N 394.540 5.629 30 20 GKED COCC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 556610004 PQFNRZNBWOACLA-BLVKFPJESA-N 381.278 5.433 30 20 GKED CN(Cc1cccnc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 557484324 FPHRSBBTXILQDO-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1csc(-c2ccccc2C)n1 557609132 BEAGEINJMPBKCF-UHFFFAOYSA-N 394.544 5.114 30 20 GKED Cc1c(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)sc2ccc(C#N)cc12 574342729 CFEIONVHCHHLPA-UHFFFAOYSA-N 392.871 5.173 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2ccccc2CC#N)cc1OCC 576500345 RAUQZMHUCYXNRV-UHFFFAOYSA-N 386.879 5.236 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@@H]2c2ccccc2OC)c1 592338759 HLBUGTCXDSQKOE-OAQYLSRUSA-N 380.488 5.409 30 20 GKED CC1(C)C[C@@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)c2cc(F)ccc2O1 593407717 UUKOICYNPULUGM-WOJBJXKFSA-N 395.478 5.162 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)C1 596936330 JKAUQPWUHXULSD-INIZCTEOSA-N 383.492 5.276 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H](CCO)c2cc(Cl)cc(Cl)c2)cc1 599013836 NCKGWVMBNWKHFM-IBGZPJMESA-N 377.315 5.008 30 20 GKED Cc1cc(Br)c(F)c(C(=O)N[C@H](CCCC#N)c2ccccc2)c1 599969859 GBVROMLYCKSHRB-QGZVFWFLSA-N 389.268 5.062 30 20 GKED N#C[C@@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(F)cc1 603486940 MENUJZXJAHGSAP-GFCCVEGCSA-N 379.243 5.342 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 604547997 RLHBMIZRVGCMSQ-BFUOFWGJSA-N 393.874 5.343 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)o1 609589221 QRUQMYLWPAEVTG-FFSVYQOJSA-N 377.271 5.023 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609730280 YBWQFAACKYLEFJ-AWEZNQCLSA-N 396.899 5.899 30 20 GKED Cc1cccnc1[C@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C(C)C 609990693 IYDXOZKLAPPHFD-JOCHJYFZSA-N 384.483 5.132 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1F 610019170 GAOVACJGCFXPJD-SUMWQHHRSA-N 389.471 5.489 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(Cn2cnc3ccccc32)cc1 611391951 BYJCIJMIJNRYAH-XMMPIXPASA-N 392.506 5.123 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 615971622 PBOHQNYQRSGERH-IAGOWNOFSA-N 377.381 5.163 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1CC[C@H]1c1ccc(F)cc1 628112873 BWLPGCSWRDWCFP-GJZGRUSLSA-N 399.350 5.489 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cnc(-c3ccccc3Cl)nc2)s1 651353115 UXODNHLGCSZZBS-AWEZNQCLSA-N 396.903 5.041 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(c2ccc3cccnc3n2)CC1)c1ccccc1 655269367 JMCHYBATCPBLHC-JOCHJYFZSA-N 385.511 5.086 30 20 GKED O=C(Nc1cc(F)cc(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 675696353 ZSCIPRQKHAJJNC-YUMQZZPRSA-N 392.702 5.074 30 20 GKED Cc1cc(F)ccc1/C=C1\SC(=S)N(c2ccc(C#N)c(Cl)c2)C1=O 726628148 YWABWACKDHZDHY-APSNUPSMSA-N 388.876 5.065 30 20 GKED CC(=NOCc1nc(-c2ccsc2)oc1C)c1ccc(NC(=O)C2CC2)cc1 726787278 INXGKVORFUKELI-UHFFFAOYSA-N 395.484 5.001 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3cccs3)n2)cnn1-c1ccc(F)cc1 728440690 RMJHUPIWAICLBQ-TWGQIWQCSA-N 395.484 5.401 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)cn1 728865401 HMJATIVEFJBZPS-OAHLLOKOSA-N 375.859 5.142 30 20 GKED CC(C)CCO[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 729069941 JIZXRJFEBMIJCY-BBRMVZONSA-N 376.909 5.091 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)C 729888866 JWZGSCGKJONODJ-IEBWSBKVSA-N 378.472 5.199 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(SC(F)F)cc3)cc2)nc1 731953021 LEDNSODVLMYOSS-UHFFFAOYSA-N 397.406 5.313 30 20 GKED C[C@H](CSc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 732495458 ALIUERODSRCPFF-QAPCUYQASA-N 378.522 5.415 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNc1ncnc2c1oc1ccccc12 732923856 LCKZKESRGKHNCT-UHFFFAOYSA-N 388.761 5.077 30 20 GKED CC(C)(CCCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 733052860 RKBRZBOARYARQI-KRWDZBQOSA-N 395.453 5.657 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)c2ccc(C(C)C)cc2)c1 733847706 PSDPFGVDAONAHS-NRFANRHFSA-N 393.531 5.225 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)C(C)C 734063819 OPAXTXGKVDNYOO-UHFFFAOYSA-N 379.382 5.321 30 20 GKED CC(=Nn1cnnc1SCc1ccc(Cl)cc1)c1ccc2ccccc2n1 749809208 CGUUABTXMYWCTJ-UHFFFAOYSA-N 393.903 5.044 30 20 GKED Cn1nnc2cc(/C=C(\C(=O)c3ccccc3)c3nc4ccccc4s3)ccc21 751032146 FHGAVKWSLALPKX-GHRIWEEISA-N 396.475 5.002 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cnc(-c4ccncc4)s3)c2)s1 753372354 RUZITBRVMJJSFN-UHFFFAOYSA-N 388.521 5.095 30 20 GKED C#CC[C@@H](NC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1)c1ccccc1 757618504 UOYXVIJBPUQHJE-JOCHJYFZSA-N 397.478 5.133 30 20 GKED Cc1cc(/C=C2\CSC/C(=C/c3cnc(Cl)c(C)c3)C2=O)cnc1Cl 760263655 OYVLBJSWWAQVEM-OPCYYNASSA-N 391.323 5.183 30 20 GKED C=C(C)C[C@@H](C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 767048601 YPVPYMMAUSJYPC-XMSQKQJNSA-N 389.543 5.084 30 20 GKED CC(CCCC(F)(F)F)=NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1 774385803 PSLGXCGBPHUCSR-UHFFFAOYSA-N 399.438 5.008 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)[C@@H](C)c2ccc(Cl)s2)cc1 774570836 INTPGWWHZUBYMQ-ZDUSSCGKSA-N 377.893 5.153 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(CN[C@H](C)c2ccc(C#N)c(F)c2)cc1 776741152 CKLXWWNMPQKEHO-CVEARBPZSA-N 397.494 5.134 30 20 GKED CC(C)c1nc(/C=C2/CCc3ncc(C(F)(F)F)cc3C2=O)c2ccccn12 777470033 QNGYLPFYNNAIGW-LCYFTJDESA-N 385.389 5.084 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COc2ccc(Oc3ccccc3)cc2)n1 780402775 MAGASRGGFJFZGB-IBGZPJMESA-N 392.480 5.314 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccc(Br)cc2C1 789461617 ZQUNZDSUANQYRG-UHFFFAOYSA-N 399.332 5.849 30 20 GKED N#C[C@@H](C(=O)COc1ccccc1Cc1ccccc1)c1nccc2ccccc12 792101801 HAFGJQNULIQJEL-QHCPKHFHSA-N 392.458 5.081 30 20 GKED O=C1/C(=C\c2cc(C(F)(F)F)ccc2Cl)C[C@@H](C(=O)O)c2ccccc21 806561975 FIZTUCZTXMXKNC-OCOPJHETSA-N 380.749 5.197 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CNCc1ccc(CSC(F)F)o1 808429054 ZPGUQDQPCRFNLF-UHFFFAOYSA-N 387.320 5.322 30 20 GKED C=CCC[C@H](NCc1cnc(C2OCCO2)s1)c1ccc(C(F)(F)F)cc1 809628220 RDZNPPUUSITCQX-INIZCTEOSA-N 398.450 5.004 30 20 GKED C[C@@H](C#N)Oc1ccc(CN(C)[C@@H](C)Cc2ccccc2C(F)(F)F)cc1 809725075 IVLPJGKUEAWCMQ-HOTGVXAUSA-N 376.422 5.059 30 20 GKED CC(/C=C/C(=O)c1ccc(C(F)(F)F)nc1O)=C\c1ccccc1OC(F)F 811686792 AJLNCALDPSFWOR-UMYLGFLZSA-N 399.315 5.250 30 20 GKED N#C[C@H](C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 813213804 QBIJMDOFSMJRIE-GXTWGEPZSA-N 390.258 5.006 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1 815635703 HVUWEWHTZDZKAA-RXVVDRJESA-N 385.552 5.047 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)ccc1NC(=O)OC(C)(C)C 842940857 KJNPJUZIKARGGE-HNNXBMFYSA-N 397.500 5.166 30 20 GKED COc1ccc(CNCc2cn(C(F)F)c3ccccc23)cc1OCCCC#N 858291745 JMRKRWRLEFQTNO-UHFFFAOYSA-N 399.441 5.017 30 20 GKED COc1cc(C=NOCc2cc(Cl)cc3cccnc23)ccc1OC(C)C 914787113 ZSLGFQIHKKSEAQ-UHFFFAOYSA-N 384.863 5.235 30 20 GKED C=CCc1ccc(OC(=O)CCCc2ncc(-c3ccccc3)o2)c(OC)c1 915276036 AJRFNYSNTGMXOY-UHFFFAOYSA-N 377.440 5.007 30 20 GKED C[C@H](SCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916050529 CFTQJDNCUIVNLE-FDDCHVKYSA-N 386.520 5.602 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccc(Cl)s2)cc1 916948869 KEKVSSARUVTZMX-ZIPALELNSA-N 386.904 5.276 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(C)n(C(C)C)c2C)cc1 916955554 RPIVOOKNQWLKJX-QVKFZJNVSA-N 379.504 5.161 30 20 GKED CC(C)(Oc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917046007 FFFISTVBBJKVNS-CQSZACIVSA-N 388.851 5.123 30 20 GKED Cc1c(Cl)cccc1S(=O)(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 917738181 UFKYVAQXGNHNHB-LJQANCHMSA-N 396.899 5.105 30 20 GKED CC(C)Oc1ccccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 918034656 SYEVJEPAFIKBBK-HSZRJFAPSA-N 399.494 5.451 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Cl)ccc3[N+](=O)[O-])c2c1 1777685629 QAAFLEQHLSCAFZ-ORCRQEGFSA-N 387.800 5.057 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(C)C)CC1 1829071310 SRECXDDPACCTHU-OAQYLSRUSA-N 390.612 5.035 30 20 GKED CC(=O)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 41514649 MACUUNRVYDURTK-ZDUSSCGKSA-N 386.885 5.218 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(CC(C)C)cc2)=C(\S)NC)cc1 55012501 FSUVDOHKAUOWKI-UHFFFAOYSA-O 397.608 5.234 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCOc3cccc(C#N)c3)o2)cc1 71961006 BCFBXALILIMMOX-UHFFFAOYSA-N 379.485 5.077 30 20 GKED N#C[C@@H]1CCCC[C@H]1OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 106992178 UPNOYPUMUYQAQU-SWLSCSKDSA-N 380.391 5.068 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 108408317 SMCQIOVENIMFLI-QAPCUYQASA-N 381.545 5.303 30 20 GKED COc1ccc(CN[C@H](C)c2cccc(Cl)c2Cl)cc1OCCCC#N 117951357 APARBNWXRNPJEO-CQSZACIVSA-N 393.314 5.535 30 20 GKED CCc1ccc(N/C(S)=C(\C(=O)c2ccccc2C)[n+]2ccc(C)cc2)cc1 127597451 QBQJQFVFTQIERW-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCN(C(=O)c1ccnn1C(CC)CC)c1nc(-c2ccccc2)cs1 153316576 JAZYTKCVSGEZIO-UHFFFAOYSA-N 380.517 5.201 30 20 GKED CCc1onc(C)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 153977160 QURIWBFPGKUXEE-UHFFFAOYSA-N 381.819 5.115 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3nc(C4CC4)cs3)cc2)cc1 167851379 FKZZFWVNVURDEE-UHFFFAOYSA-N 390.468 5.006 30 20 GKED CCn1nc(C)c(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c1C 172820282 HVHQHKHLCLRFRG-UHFFFAOYSA-N 394.862 5.090 30 20 GKED Cc1csc([C@H](C#N)C(=O)CCSc2ccnc3cc(Cl)ccc23)n1 176080055 IWQCHDXFHFYEDW-CQSZACIVSA-N 387.917 5.012 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccccc1F 182222675 VOAZBRLFMDEBKU-CYBMUJFWSA-N 380.448 5.265 30 20 GKED CCOC1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 194344678 APQRYEGSQFHYKP-HXUWFJFHSA-N 397.906 5.028 30 20 GKED CC(C)c1nc(CCNCc2cccc(OCc3cccc(C#N)c3)c2)cs1 236893784 IUERWFWEZDOJRZ-UHFFFAOYSA-N 391.540 5.049 30 20 GKED COc1cc([C@@H](C)NCc2ccc(O[C@H](C)C#N)cc2)ccc1OC1CCCC1 237252646 NSDGJJMSOKPHHT-QZTJIDSGSA-N 394.515 5.158 30 20 GKED N#C[C@H](C(=O)[C@@H]1CSc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 303734779 WNLGSGYENXHTRH-HZPDHXFCSA-N 396.924 5.529 30 20 GKED OC(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)=Nc1ccc2c(c1)OC1(CCCC1)O2 329013745 PKDIQSGRMDJUJX-KILAXVPQSA-N 383.488 5.038 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@@H]3C[C@@H]3c3ccccc3)c2)cc1 409779548 LJCARNGWFQJJLT-DNQXCXABSA-N 397.478 5.009 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 431861039 KJCLWOWAIJRKRL-KXBFYZLASA-N 389.421 5.501 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1 432700621 WHLGHHYNWNWCLR-INIZCTEOSA-N 393.821 5.498 30 20 GKED N#CCCC[C@H](NCc1csc(CCc2ccccc2)n1)c1ccccc1 433011371 FVRFQOLRDDNXJP-QFIPXVFZSA-N 375.541 5.453 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCCC(F)(F)C1 433141941 BTCLGVAHPYREMW-GJZGRUSLSA-N 381.492 5.418 30 20 GKED CCSCc1cccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 438375879 IKHINTXAVNUQPS-RTWAWAEBSA-N 379.529 5.243 30 20 GKED CC(C)[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 438867012 QUOCPOTZDJYXHP-LJQANCHMSA-N 389.421 5.116 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 439440030 PHEWANYUZWUWPN-OAHLLOKOSA-N 396.878 5.552 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccccc3Cl)o2)c(OC(F)F)c1 439547036 WHDZUGGCOCQLPN-UHFFFAOYSA-N 393.802 5.155 30 20 GKED CCC[C@@H](NC(=O)NCC1CCC(C#N)CC1)c1cccc(C(F)(F)F)c1 441005528 ARVKGMXVLJOTGB-JTTJXQCZSA-N 381.442 5.176 30 20 GKED N#Cc1cc(NC(=O)N2CCCCC[C@@H]2c2ccco2)ccc1OC(F)(F)F 442195356 AOAUSYAQQYUQCJ-OAHLLOKOSA-N 393.365 5.199 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)c1ccc(OC)c(OC)c1 459524365 KAJVNLIZYVZIMP-UHFFFAOYSA-N 382.504 5.614 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 460565705 PCSPJWVNKYGILK-GUYCJALGSA-N 395.334 5.210 30 20 GKED CN1CCC[C@@H](CNc2ccc(C#N)c(C(F)(F)F)c2)[C@H]1c1cccs1 462884669 RBBQVSCNJBTWCA-KSSFIOAISA-N 379.451 5.134 30 20 GKED COc1ccccc1C[C@H](C)N(C)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 464223695 MYDWLAGKEAKZRU-SFHVURJKSA-N 399.494 5.014 30 20 GKED Cc1ccoc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464284485 RNGGVILLDDBKCI-UHFFFAOYSA-N 386.329 5.523 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 467159299 GLHRXKNHQSXVPK-WBMJQRKESA-N 395.812 5.458 30 20 GKED C=CCC(CC=C)C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl 467838069 FHSHSLNZRFSRPM-GOSISDBHSA-N 395.330 5.081 30 20 GKED COc1cccc([C@H](C)CCCC(=O)Nc2cc(C#N)ccc2OC(F)F)c1 469307570 VJLYCDHCKFYFGE-CQSZACIVSA-N 388.414 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCc1ccccc1[N+](=O)[O-] 482167249 GSDZFXNINBMUCP-UHFFFAOYSA-N 381.476 5.153 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3coc4cc(F)ccc34)n2)cc1 483513252 MRQMMGGSMBZYEY-MRXNPFEDSA-N 392.411 5.194 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Sc1nc(C(F)(F)F)ccc1C#N 488804190 UONMZPQYKFKEEN-GFCCVEGCSA-N 393.434 5.215 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1ccccc1SCCC#N 497688739 PMMNIWWXALNYLN-INIZCTEOSA-N 375.497 5.058 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 500306919 QRQZYDILDNHDOB-QFIPXVFZSA-N 390.527 5.062 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)oc2c(Cl)cccc12 504012246 AARBIVRQRJLRBN-UHFFFAOYSA-N 376.843 5.196 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccc(C#N)cc1 504911024 ZMNVXSKXUQGTJV-LLVKDONJSA-N 397.784 5.035 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1 510887160 IKJOYRLLBZKCBM-QFIPXVFZSA-N 397.478 5.137 30 20 GKED C=CCN(C(=O)c1ccc(OCC2CC2)cc1)c1nc(-c2ccccc2)cs1 512395503 WKKFLYVYLPGCHX-UHFFFAOYSA-N 390.508 5.432 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2c1 515686167 ZVTJJGQTBFOJNV-UHFFFAOYSA-N 383.476 5.704 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1F 518235412 WPVORTXUCBKRBE-OAHLLOKOSA-N 392.405 5.158 30 20 GKED N#C[C@H](C(=O)c1sccc1C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 518477118 GCPFMAHQRZOCEI-OAHLLOKOSA-N 384.913 5.892 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4cnco4)c3)cc2)cc1 521102342 YEAXJCNRNYXHCJ-UHFFFAOYSA-N 395.418 5.452 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 521327127 SMUDPDVMAJBYPN-ZWKOTPCHSA-N 396.556 5.919 30 20 GKED Cc1ccc(CCCCC(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)cc1 523529942 VJOSIEBYQHDQQG-UHFFFAOYSA-N 386.499 5.021 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)c(Cl)c1 532664257 ZODJRBVGLSVNQC-AWEZNQCLSA-N 396.903 5.233 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(Cl)c1O 535413425 PBHAQUWITUPBCS-UHFFFAOYSA-N 380.856 5.321 30 20 GKED C[C@H]1CC(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@H](C)O1 535775175 BYGJIBPBCNVIRF-KBPBESRZSA-N 399.878 5.081 30 20 GKED C=CCC[C@@H](NCC(=O)Nc1c(C)cccc1C)c1ccc(C(F)(F)F)cc1 539334432 WRZYUBIHMUQWGC-LJQANCHMSA-N 390.449 5.558 30 20 GKED C[C@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541084194 JLSCABWPNIYAKH-INIZCTEOSA-N 385.492 5.793 30 20 GKED CCCN(CC)Cc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 554325972 WEMOVQQHACFLBD-GOSISDBHSA-N 383.561 5.163 30 20 GKED C[C@@H](Nc1ccc2c(c1)N(CC(F)F)CCS2)c1ccc(C#N)cc1F 560265856 JWHSNPWVFDYJEO-GFCCVEGCSA-N 377.435 5.048 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)c1sc2ccc(C#N)cc2c1C 561068486 DZZUYIGOHQRZGT-UHFFFAOYSA-N 375.497 5.242 30 20 GKED CC(C)Cn1ccc2c(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)cccc21 569468925 NKVBYHDUANSLHR-KRWDZBQOSA-N 385.389 5.201 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCc1cccc(Cl)c1Cl 584398237 RSSMMNDNLHCHKC-UHFFFAOYSA-N 391.685 5.385 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(F)c(Br)c1 590192606 AEVPOBIRSBZLNX-AWEZNQCLSA-N 391.284 5.122 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 590253144 SZFVSCUUWLWIPM-NWDGAFQWSA-N 391.286 5.606 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1nc2cc(F)ccc2s1 592974549 TTWKZRSLNGPJMG-CYBMUJFWSA-N 396.830 5.839 30 20 GKED CC1(C#N)CCC2(CC1)Nc1ccccc1C(=O)N2c1cccc(C(F)(F)F)c1 602754837 BOHDHKHWQIHWSS-UHFFFAOYSA-N 399.416 5.578 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c2ccccc12 603765275 SWJIMHXCYPGRCG-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1ccc(C#N)cc1F 609217049 SQKJPMHUFALOHN-UHFFFAOYSA-N 380.806 5.420 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC2CCCC2)cc1 609376682 HYKFKTDMUPZAET-MRXNPFEDSA-N 380.513 5.512 30 20 GKED CC(C)N(CC(F)(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609727572 LGRQSUCGESQFGC-UHFFFAOYSA-N 396.796 5.417 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H]3CSc4ccccc43)c2)cc1 609811239 VSORMETXHOENEA-FQEVSTJZSA-N 387.464 5.319 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1nc(-c2cccc(C#N)c2)cs1 611052216 YPOVUPPAHGZYES-UHFFFAOYSA-N 398.491 5.028 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC(c3ccccn3)CC2)cc1 611085581 HODBGVIKVSHQRP-UHFFFAOYSA-N 397.478 5.074 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cnco2)cc1)c1nc2cc(Cl)ccc2s1 617898163 RSAJESQQGOXXHH-CQSZACIVSA-N 379.828 5.095 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1c[nH]c2cc(F)ccc12 619127064 RAGSCMIBPLJLSY-UHFFFAOYSA-N 384.295 5.090 30 20 GKED Cc1ccc(F)c(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 642410454 GWWVJINKTCIBMP-NXEZZACHSA-N 386.311 5.165 30 20 GKED Fc1ccccc1-c1csc(N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)n1 645037815 YANBQJVFRGCMGO-NXEZZACHSA-N 384.320 5.126 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(F)cc(Cl)c1 674915296 XGZKJGHTHRMWQV-IUCAKERBSA-N 391.714 5.118 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1cnc2ccccc2n1 682995059 NZXIQNYTOADQOE-IBGZPJMESA-N 383.382 5.051 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1csc(-c2ccccc2OC)n1 684235323 YOWFSKMNFVOCNX-UHFFFAOYSA-N 378.497 5.037 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730417014 KQRQLQCQIKMPIN-WCQYABFASA-N 388.851 5.041 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)n1cccc1 735207175 OVGHWEQFHLVIFW-MRXVHASRSA-N 393.556 5.240 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cc(Cl)cs2)cc1 737317501 YCZNGOOGJHMGNF-SFHVURJKSA-N 388.920 5.024 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cccc(N[C@H](C)C(C)C)c2C)c1 743409804 CQAHQPQRNQVFQH-UYAOXDASSA-N 393.531 5.062 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(Oc4cnccn4)cc3)c2)s1 743500209 ZKSHQFHZTKIXKT-UHFFFAOYSA-N 398.491 5.159 30 20 GKED CCCOc1ccc(C(C)=NNc2oc(C(C)C)nc2C#N)cc1OCCC 745625541 XIAOZQZMRLQPEI-UHFFFAOYSA-N 384.480 5.083 30 20 GKED O=C(O)CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)c1 746685190 ZOXRAEKIAKOWLI-MDZDMXLPSA-N 378.449 5.165 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1 747111621 HMKXXALLZCIONJ-QGZVFWFLSA-N 397.544 5.053 30 20 GKED C#CC[C@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccccc1 757060107 XSAUBJRNTKKSTR-FQEVSTJZSA-N 380.538 5.286 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 760243127 GCQTYWPJWANTPM-UHFFFAOYSA-N 378.888 5.391 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2cccc(Cl)n2)cc1OCC 760433469 SKYYDFGLLIBSFA-UHFFFAOYSA-N 383.275 5.127 30 20 GKED CCCCCCC[S@](=O)[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 764453133 OURXPBRMZNCWOR-NRRJATNASA-N 388.455 5.536 30 20 GKED Cc1cnc([C@@H](C)OC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)o1 771040641 YMHFLSBAJKPADL-CYBMUJFWSA-N 382.803 5.218 30 20 GKED CC(C)(C#N)CCCOC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 783302324 STCSCUOVOPXQLC-UHFFFAOYSA-N 397.327 5.533 30 20 GKED C[C@H](SCC(=O)Nc1ccc(SC(F)F)cc1)c1cccc(C#N)c1 785537573 QWYATYMOSRFKBY-LBPRGKRZSA-N 378.469 5.306 30 20 GKED N#CC[C@H](CC(=O)OCc1nc2ccccc2c2ccccc12)c1ccccc1 795983119 KDRKNEOJTGHVET-LJQANCHMSA-N 380.447 5.519 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C2CC(c3ccc(F)cc3)C2)cc1 796748210 UXDLVLVDTATXRR-BDTBCHSTSA-N 392.474 5.180 30 20 GKED C#CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 806511199 IHDGIFMZCXRAFO-SFHVURJKSA-N 389.524 5.025 30 20 GKED COc1ccc2cc(NC(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)ccc2c1 806614115 LADILJVZMNCZHH-GOTSBHOMSA-N 385.467 5.152 30 20 GKED C=CCC[C@@H](NCc1cnc(C2OCCO2)s1)c1ccc(C(F)(F)F)cc1 809628222 RDZNPPUUSITCQX-MRXNPFEDSA-N 398.450 5.004 30 20 GKED CC(/C=C\C(=O)c1cc([N+](=O)[O-])ccc1F)=C/c1ccccc1OC(F)F 814192122 YHDNMTMWOWBQPL-IXMUGINYSA-N 377.318 5.178 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@@H]2C 839388600 KKZKEBIMSCPVLJ-QWRGUYRKSA-N 390.940 5.068 30 20 GKED C#CCCC[C@H](C)OC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 847866331 MNDNCUNIRVBZKD-ZDUSSCGKSA-N 395.286 5.101 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)[C@@H]1CCCC2(CC2)C1 850759128 GKTYGMOETTXBGG-IEBWSBKVSA-N 388.467 5.097 30 20 GKED CCO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)C 860475930 WNDHKKVGYZDKHQ-CXAGYDPISA-N 397.327 5.354 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccsc2)cc1 915359651 WBKJAJRBKUCDDW-YADHBBJMSA-N 387.508 5.773 30 20 GKED O=C(c1cnc(-c2ccccc2)s1)N1CCCSC1=Nc1ccccc1 915806866 XRLCABBNPBCPHO-UHFFFAOYSA-N 379.510 5.077 30 20 GKED CCCCOc1ccc(C(C)=NNc2ncccc2C(F)(F)F)cc1OC 915960541 HSYSKYIJOOTMBA-UHFFFAOYSA-N 381.398 5.124 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1ccccc1 916134274 FSCLCYWLNMRXCY-XFXZXTDPSA-N 396.273 6.142 30 20 GKED O=C(/C=C/c1cc2ccccc2nc1N1CCOCC1)c1ccc2ccccc2c1 916136228 CDLYHRVOVPURFT-VAWYXSNFSA-N 394.474 5.121 30 20 GKED CC(C)Sc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 917119639 QUTJRUHKVCEOAT-QHCPKHFHSA-N 386.520 6.095 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccc(F)cc2)cc1 918488202 XAPBBQFBZFCVFI-KKSFZXQISA-N 380.463 5.009 30 20 GKED COc1cccc(C=Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1O 920942218 SDKVCYPGGDQYGV-LJQANCHMSA-N 376.843 5.460 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)cc1 1776125655 PAWOPMSRHFKBFI-IDKBZEPQSA-N 398.474 6.015 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1 25841013 BOTUAKNPRPZFTH-UHFFFAOYSA-N 383.373 5.307 30 20 GKED CN(Cc1cccc(C#N)c1)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 26329687 DKOBDDYVKGHLCS-UHFFFAOYSA-N 387.430 5.333 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C[C@@H](C#N)CCC#N)cc1C 27389611 GLCPNIMZEGTETO-OAQYLSRUSA-N 397.526 5.032 30 20 GKED N#C[C@@H](C(=O)CCSc1ccccc1F)c1nc(-c2ccccc2)cs1 51533957 HFEHGFCJGNPSFJ-HNNXBMFYSA-N 382.485 5.308 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccccc3)CC2)cc1Cl 59281286 VZYZWXQANMSLPU-NRFANRHFSA-N 386.882 5.666 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1c(Cl)c2ccccc2n1C 66855946 RYFCRIYTDPTISH-CYBMUJFWSA-N 383.904 5.478 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F 66954440 MDLNUYYXVCYELO-HZSPNIEDSA-N 385.455 5.323 30 20 GKED CSC[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67001710 VSPDCYGDPKNVNO-BXKDBHETSA-N 385.341 5.292 30 20 GKED Cc1csc([C@H](C#N)C(=O)Cc2cccc(OCc3ccc(Cl)cc3)c2)n1 106353525 CQKMQVRNRRMWRK-LJQANCHMSA-N 396.899 5.103 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)Nc1ccccc1SCCC#N 108200348 NFNRFVLIBPSRSN-CYBMUJFWSA-N 376.934 5.465 30 20 GKED N#CCC[C@@H](Nc1cc(N[C@H](CCC#N)c2ccccc2)ncn1)c1ccccc1 127936177 MQIGDVJFKXWIJG-FGZHOGPDSA-N 396.498 5.391 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 132820429 JIRXWBVIOLHRFL-QFBILLFUSA-N 390.512 5.215 30 20 GKED Cc1cc(Br)c(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1Cl 153888972 GCSSIWXJRGNJEN-UHFFFAOYSA-N 389.680 5.218 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(COC2CCCCC2)c1 156125796 QUZWQORVTCBMRL-UHFFFAOYSA-N 381.476 5.077 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1cccc(C(F)(F)F)c1F 156592254 KRISRTZKCRLLPL-UHFFFAOYSA-N 379.275 5.592 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 163158795 QIUIYSKIGNSHPU-QGZVFWFLSA-N 397.544 5.389 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SC[C@H](C#N)CCC#N)n2)o1 181152281 MNRMCBWHMKIJFC-LBPRGKRZSA-N 390.390 5.076 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC2c3ccccc3-c3ccccc32)ccc1OC 183901165 ZCCJBGOOPRYVPM-SFHVURJKSA-N 384.479 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc2c(c1)CCC(=O)N2 191427109 CIYRQGLZULMFMO-MRXNPFEDSA-N 391.515 5.306 30 20 GKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 194182303 HJXPJTUJQXRKFW-KRWDZBQOSA-N 379.510 5.196 30 20 GKED N#C[C@H](C(=O)C12CC3CC(CC(C3)C1)C2)c1nc(-c2ccc(Cl)cc2)cs1 247778314 ZAVYXMLPJNCJPE-IYZRDUGGSA-N 396.943 5.856 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2cnn(-c3ccccc3)c2C1 297981636 ZRMDNGMZWPLHEK-UHFFFAOYSA-N 386.499 5.272 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccncc1 303144362 DLJJMANZBCTASS-CYBMUJFWSA-N 390.434 5.398 30 20 GKED CCS(=O)(=O)c1ccc([C@H](C)/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc1 329149291 QMKFOEYFNBJHIT-LWCVALJOSA-N 377.550 5.104 30 20 GKED CC(C)c1nc([C@@H]2CCCN2/C(O)=N/[C@@H]2CC=C(c3ccc(F)cc3)CC2)no1 329296610 SWXIRUKUEUNSPP-MOPGFXCFSA-N 398.482 5.019 30 20 GKED Cc1cnc(C(C)(C)/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)s1 329436278 JURNIRHTMFQDPW-INIZCTEOSA-N 386.565 5.150 30 20 GKED CC(C)(C)c1nc(C/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)cs1 329474255 AWSGWCJZMQXBJS-QGZVFWFLSA-N 386.565 5.329 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@@H](C)C3)c(C(F)(F)F)o1 411012523 NDNWUGXGLCJJNU-BDAKNGLRSA-N 382.407 5.478 30 20 GKED N#CCCC[C@H](NCc1cc(Cl)cc(Br)c1)c1ccccc1 411760774 SRMHWXREMPTPEB-SFHVURJKSA-N 377.713 5.627 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2csc(C3CCCCC3)n2)cc1 413352334 CGXPPTBMNAGXHO-UHFFFAOYSA-N 383.517 5.150 30 20 GKED CN(Cc1cc(F)cc(F)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 434156457 BUNRYSMJTISBGZ-UHFFFAOYSA-N 393.393 5.293 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c[nH]nc3-c3ccsc3)c2)cc1 436316339 IWMITHWQBQLIPV-UHFFFAOYSA-N 386.436 5.054 30 20 GKED COC(=O)c1cccc(-c2nc(-c3cn(CCC#N)c4ccccc34)cs2)c1 437647934 DQAYDXJYBUZPNM-UHFFFAOYSA-N 387.464 5.132 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 439394224 SBEWIFNENUYDFN-UHFFFAOYSA-N 399.450 5.051 30 20 GKED C=CCC[C@@H](NC(=O)N(CC)Cc1ccncc1)c1ccc(C(F)(F)F)cc1 442284452 MRQSDGIYQVMSHZ-LJQANCHMSA-N 391.437 5.339 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@@H](C)c1ccc(C#N)cc1 444033331 NXVYGTOHLQUUHJ-SFHVURJKSA-N 384.483 5.040 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c(Cl)c1 444999832 WWTVXLMSGLTEEN-UHFFFAOYSA-N 395.890 5.320 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)cc1 445232232 AGUBAWHNUVGPFN-FQEVSTJZSA-N 397.906 5.015 30 20 GKED Cc1ccc(N[C@H]2CCC[C@@H](C#N)C2)cc1Oc1ncccc1Br 448355598 OKZLYQRRGJJCPV-CABCVRRESA-N 386.293 5.439 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1 462049520 OBMRVTWJTACPIQ-LJQANCHMSA-N 388.298 5.158 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(Oc2ncc(C#N)cc2Cl)cc1 463080284 VRPHYFQEDPBJFX-UHFFFAOYSA-N 398.249 5.329 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 464161812 WHYFCOUXSZAKMU-QHCPKHFHSA-N 376.456 5.070 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCCC2)cc1)c1cc(C(F)(F)F)ccn1 464416151 GMBGJMBMOKFQPF-SFHVURJKSA-N 388.389 5.302 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H](Cc2csc3ccccc23)C1 466385505 GIUQYUBNUAOMED-LJQANCHMSA-N 385.573 5.445 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)cc1 467096215 YCGBOKPFXWTBSS-GOSISDBHSA-N 389.524 5.454 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(SCCOC)cc1 471805047 QDTLYYNRCIHZCH-IBGZPJMESA-N 398.572 5.274 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 474420824 HPTDEBBLNJVZGH-IBGZPJMESA-N 398.466 5.357 30 20 GKED C=CCN(C(=O)c1ocnc1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 476687172 JREOZAPJKMBSEY-UHFFFAOYSA-N 394.283 5.246 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1)c1ccccc1 476726826 CBBJLNRELZOOKF-FQEVSTJZSA-N 380.438 5.058 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1Cl 482835220 APHJKZNZGZJMHA-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccc2ncsc2c1 485689934 AAHJWSSHZMWLRH-KRWDZBQOSA-N 399.519 5.598 30 20 GKED N#CCCC[C@H](NC(=O)CCC(=O)c1ccc2c(c1)CCCC2)c1ccccc1 487190704 YNAQNAKIAWZLDN-QHCPKHFHSA-N 388.511 5.080 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 503214714 DOPZAJMDFNOOPN-UYAOXDASSA-N 393.556 5.486 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 505060502 GFERFABSVNOBBR-NFBKMPQASA-N 391.559 5.322 30 20 GKED CCCN(C(=O)Cc1ccc(C#N)cc1)[C@H](C)c1ccc(Cl)c(Cl)c1 505070154 JBEAGHPOHAHGBJ-CQSZACIVSA-N 375.299 5.407 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)c3cc(C#N)ccc3Cl)cc2)cs1 505242646 NHFGIUZJUMVEGE-LBPRGKRZSA-N 381.888 5.135 30 20 GKED CCOC1CC(CSCc2ccc(OCc3cccc(C#N)c3)c(OC)c2)C1 507087604 QSMDRBWNIGCPBC-UHFFFAOYSA-N 397.540 5.194 30 20 GKED CCN(C(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)[C@H](C)c1ccc(C#N)cc1 509574516 JKUBZNCUHOMFHE-GFCCVEGCSA-N 386.282 5.570 30 20 GKED CCc1cccc(C)c1NC(=O)CSc1nc(-c2ccccc2)ccc1C#N 510179488 HLMYDVOVSBPYKM-UHFFFAOYSA-N 387.508 5.222 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc(C#N)cc1 510424071 JSCHBWNSFTUKOF-UHFFFAOYSA-N 383.476 5.248 30 20 GKED N#Cc1c(NC(=O)c2ccccc2OC(F)F)sc2c1CCCCCC2 515449283 NKQARJDTQRONBX-UHFFFAOYSA-N 376.428 5.132 30 20 GKED C[C@@H](NCc1ccc(-c2cccc(Br)c2)o1)c1ccc(C#N)cc1 518779272 LIZDZTJSDGBJJZ-CQSZACIVSA-N 381.273 5.432 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)c1c(F)cc(C(F)(F)F)cc1F 521944334 TZRDBTMQHOUWJD-UHFFFAOYSA-N 399.237 5.177 30 20 GKED CC(C)(C#N)CCSc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1 525503703 RTRWWSJJGUVPFK-UHFFFAOYSA-N 396.947 5.543 30 20 GKED CC(C)(C)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)no1 525658449 YYLUATJMNPIFRF-KRWDZBQOSA-N 393.874 5.533 30 20 GKED N#CCC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1 533496796 MHGSPAOPCIZVNK-LJQANCHMSA-N 377.469 5.458 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCCC(F)(F)F 536114464 VOVVYPSZGWOPFY-UHFFFAOYSA-N 384.345 5.382 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2scnc2C2CC2)c1 536477608 YTBBLIFTHXEWLK-UHFFFAOYSA-N 395.871 5.590 30 20 GKED CCOc1ccc([C@@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc2)cc1 537434151 ZADGBCWSSZDINZ-DEOSSOPVSA-N 396.490 5.160 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl 540470749 GPSMELWQDGCAAN-FUHWJXTLSA-N 392.808 5.271 30 20 GKED C[C@@H](N[C@H](C)c1ccc2ccccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 541175240 CNMQGTPGDCDPID-RTBURBONSA-N 377.491 6.185 30 20 GKED N#CC1CCN(C(=O)c2ccc(Cl)cc2Sc2ccc(Cl)cc2)CC1 543552165 XIXIAGOSCSSKNN-UHFFFAOYSA-N 391.323 5.520 30 20 GKED Cc1c(C(=O)N[C@@H](c2ccccc2)c2nccs2)sc2ccc(C#N)cc12 559564005 AQZAXAGGVNRGHX-SFHVURJKSA-N 389.505 5.057 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(CCc3ccccc3O2)C1 562021367 IGWCKZQOVVWVQY-VWLOTQADSA-N 390.527 5.540 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 565659915 IFIDIVRDHSXSOK-DYESRHJHSA-N 375.541 6.204 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(C#N)cc1C(F)(F)F 576232677 YBDQYNNBMZYGKO-LBPRGKRZSA-N 375.419 5.380 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)[C@H]1CCCc2ccccc21 577684492 ICMXPSIOIYGWLF-QHCPKHFHSA-N 398.466 5.287 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)NC2(c3ccc(C#N)cc3)CCC2)cc1 594512094 BPNMUXPOPYRMLO-SFHVURJKSA-N 390.531 5.162 30 20 GKED N#CCC1(CSc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)CC1 594899330 DHLSDZDMKMIOQL-UHFFFAOYSA-N 394.931 5.433 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CCC[C@@H](CC#N)C3)c(F)c2)cc1 596917384 ZRSQJUJFLWLKLG-KRWDZBQOSA-N 395.478 5.437 30 20 GKED C=CCc1cc(CN[C@@H](Cc2ccccc2)c2sccc2C)cc(OC)c1O 605827535 XNPBQDBLGKIHRP-NRFANRHFSA-N 393.552 5.573 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(OC(F)F)cc2)cc1 609297640 XHLVBRGKNHQBAG-UHFFFAOYSA-N 398.340 5.343 30 20 GKED C/C=C/c1ccc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(OC)c1 609384627 ZFEPFZLWYXEEBA-IEXSPKMKSA-N 396.512 5.140 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(Cl)c1Cl 609416396 ORVFYGCTUQQHKX-CYBMUJFWSA-N 379.243 5.342 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)CCCCOc1cccc(C#N)c1 609497711 BRUMJZYYSAANKK-UHFFFAOYSA-N 390.483 5.075 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)Cc3ccc(C#N)cc3)s2)cc1 610050880 OGAVDQZRPXSCMY-KRWDZBQOSA-N 389.524 5.061 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)C1CC1 610663637 ZHHFJYAGXJERBR-HNNXBMFYSA-N 388.427 5.096 30 20 GKED CC(C)(C#N)c1ccccc1CN1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 610859216 REGGRGFBTYTQHJ-OKILXGFUSA-N 378.360 5.050 30 20 GKED C[C@@H](SCc1ccnc(C#N)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 610954402 TWVKXQOMRIKGAT-LLVKDONJSA-N 390.390 5.016 30 20 GKED N#Cc1ccc(C[C@@H](C#N)c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc1 619508064 GXDNOASWGWVFSZ-QFIPXVFZSA-N 376.419 5.125 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)CCCC1 661847692 DCOZGJWMYOBTBJ-UHFFFAOYSA-N 389.952 5.460 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)cc1 726940055 FHVXOIBXPCDTGL-UHFFFAOYSA-N 399.281 5.048 30 20 GKED N#CCOc1ccccc1C(=O)N(Cc1cccc2ccccc12)C1CCCC1 728006001 XBIWXKFQPZEENZ-UHFFFAOYSA-N 384.479 5.327 30 20 GKED COc1ccc2oc([C@H](C)NC(=S)Nc3ccc(C#N)c(Cl)c3)c(C)c2c1 730152495 LGVBFYFEKXAMAJ-LBPRGKRZSA-N 399.903 5.323 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1ccc(Cl)cc1 730950554 FNJSQTIFIWPTEY-XCVCLJGOSA-N 382.799 5.106 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1csc2ccccc12 731113967 AOTBWLLSYLCUMY-GJZGRUSLSA-N 395.553 6.036 30 20 GKED CC(=NNc1cnnc2ccccc12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733749834 BGPQBUGBTBJPGF-UHFFFAOYSA-N 398.310 5.504 30 20 GKED COc1cccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)c1OC(F)F 734980729 LBEBAQKJLUNKRG-JXMROGBWSA-N 386.366 5.507 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCCc3nc4ccccc4s3)[nH]c12 735791667 BAQDOCYZRHALBA-OAHLLOKOSA-N 388.496 5.070 30 20 GKED C#CCN(C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C)C1CCCCC1 744857756 UVGVAKQBFZPMRG-QGZVFWFLSA-N 381.545 5.157 30 20 GKED CC/C(=C/C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC)cc1 746847033 OPFHLZFRWZDCEZ-UDLNKVAWSA-N 380.513 5.379 30 20 GKED N#Cc1cccc(C2(NC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)c1 748536292 ZMZLFFJDOIPILB-HSZRJFAPSA-N 392.462 5.025 30 20 GKED COc1cc(/C=C\C(=O)c2c[nH]c3ccccc23)ccc1OCC(F)(F)F 750904895 IYXFGZFXBUOCIY-VURMDHGXSA-N 375.346 5.014 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760915931 SMURAWYLIXCIBN-FUHWJXTLSA-N 375.394 5.195 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ncc(-c3ccccc3)s2)S1 770565530 HGCWEFFGRCPNRG-LFIBNONCSA-N 391.521 5.319 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(-c4ccccc4)nc3)cc2)c1 779594000 ANMRUMCQFHPPBL-UHFFFAOYSA-N 392.462 5.206 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cc(Cl)ccc1N1CCCCC1 780459416 SBHRRBKNYJIIKL-HNNXBMFYSA-N 398.894 5.265 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C1(c2c(Cl)cccc2Cl)CCC1 784695680 IYLIHBWAUJYSTA-ZDUSSCGKSA-N 389.282 5.345 30 20 GKED O=C(c1sccc1SC(F)F)N(CCC(F)(F)F)CC(F)(F)F 791118658 ZSZVAFRCFVTXRT-UHFFFAOYSA-N 387.317 5.020 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2[nH]1 793118556 SUVBBEPUIZMHAK-HOCLYGCPSA-N 385.389 5.027 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)[C@@H](Oc2ccccc2)c2ccccc2)s1 797571372 OCAGPVDZGJBEFY-RXVVDRJESA-N 390.508 5.437 30 20 GKED Cc1csc([C@H](C#N)C(=O)C(C)(C)c2csc(-c3ccc(F)cc3C)n2)n1 810520060 QWUAZWJBGIIFQL-OAHLLOKOSA-N 399.516 5.177 30 20 GKED Cc1cccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1Cl 810550280 UTAYMAXCTWLDPD-QGZVFWFLSA-N 391.883 5.063 30 20 GKED N#CCCC[C@H](NC(=S)Nc1ccccc1-c1ccccc1)c1ccccc1 814209747 CYBHIWYEHDCYLI-QFIPXVFZSA-N 385.536 6.075 30 20 GKED C[C@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1(F)F 817713617 UIOHJSORCJDBAD-ZUZCIYMTSA-N 387.238 5.338 30 20 GKED O=C1/C(=C/c2ccc3ncccc3c2)CCOc2cc(Br)ccc21 818470099 HEYOCKSNIJUPRM-RVDMUPIBSA-N 380.241 5.046 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)O[C@@H]1CCC[C@H](C#N)C1 839050405 IVZXNKQNVAGPEU-WCQYABFASA-N 379.243 5.196 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 862718321 GYELZUDVNYNZFE-UHFFFAOYSA-N 393.487 5.396 30 20 GKED Cc1nc(C2CCC2)sc1CC(=O)Nc1ccccc1SC[C@H](C)C#N 888862461 GKYLYZGAHHQOKN-CYBMUJFWSA-N 385.558 5.152 30 20 GKED Oc1nc2ccccc2cc1/C=N/C1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914702728 KGCUDVAEADFBKW-VYAMGVKXSA-N 390.327 5.269 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 914864004 CZVUGSWQGGJIFL-UHFFFAOYSA-N 393.786 5.164 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2ccccc12 915087535 UYCRNGDKTHZYKY-DEOSSOPVSA-N 392.458 5.756 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)on2)cc1 915180260 NBMHBSIWWQLJCJ-JOCHJYFZSA-N 393.446 5.558 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2cc(C)cc(C)c2)cs1 916346562 ITONLJMPFFZZHX-UHFFFAOYSA-N 398.919 5.544 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1cc2c(Cl)cccc2s1 916885557 ZVVWNAXXZZDJHC-ZDUSSCGKSA-N 389.263 5.169 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(C)Cc2cccc3ccccc23)c1=S 917470194 RDJKZCROWDUJJE-UHFFFAOYSA-N 390.512 5.103 30 20 GKED CCN(CC(F)(F)F)C(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 918595397 RXIZYNRWYNBFIO-ARJAWSKDSA-N 393.249 5.148 30 20 GKED C[C@@H](NC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1ccc(C#N)cc1 919881395 IVVAXLQIKMOGRL-QGZVFWFLSA-N 395.462 5.110 30 20 GKED Cc1sc2ncn(N=Cc3c[nH]c4cccc(C)c34)c(=O)c2c1-c1ccccc1 920364468 WFCWJXAGVLCJBV-UHFFFAOYSA-N 398.491 5.105 30 20 GKED CC1(C)CC(=O)C(=CNc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C(=O)C1 920978520 HKUNVUFDTJNZOG-SFHVURJKSA-N 392.886 5.249 30 20 GKED CCCCCCCOc1ccc(C(C)=NNc2ccc(F)c(C(=O)O)c2)cc1 1776061806 ORKISXMKQUFEEN-UHFFFAOYSA-N 386.467 5.709 30 20 GKED CCC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Br)cc1Cl 1776075288 YNFLVJKQFFFXOQ-UHFFFAOYSA-N 399.647 5.166 30 20 GKED CC(=NNc1ccc(Cl)c(C(F)(F)F)c1)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776090857 FIHPQQGZQWAFPY-PWSUYJOCSA-N 376.806 5.284 30 20 GKED CCC(=NNc1cc(Cl)ccc1C)c1ccc(OCCCCC(=O)O)cc1 1776106481 HRUJATRRVCPPOC-UHFFFAOYSA-N 388.895 5.508 30 20 GKED CCCc1ccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)cc1 1776112625 DHIAUDVFXOBNFL-MDWZMJQESA-N 390.435 5.405 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-n2cc(Cl)cn2)cc1C 1776782793 KKOFMZXOZMULKK-IBGZPJMESA-N 391.943 5.128 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3csc4ccc(C(=O)O)cc34)oc12 1776940554 MZDYHASZFWAFCO-VURMDHGXSA-N 392.432 5.641 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2ccc(Cl)nc2)cc1 23372556 PRBGYUZSAYPBHD-UHFFFAOYSA-N 394.883 5.256 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CCc3c[nH]c4ccccc34)c2)c1 32291685 ITLPQOCQBUPYMK-UHFFFAOYSA-N 395.462 5.190 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(O)cc2)cc1Cl 45532728 HATHQJCOGJLWLW-FQEVSTJZSA-N 391.858 5.023 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 57130081 XINKRVJPHKNYHI-LJQANCHMSA-N 389.421 5.174 30 20 GKED COc1ccc(C)cc1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 66954203 YTJKXBZLBCSOJZ-HZPDHXFCSA-N 383.517 5.281 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 103079495 XBMKHERIDIJPEC-UHFFFAOYSA-N 395.409 5.128 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1)c1ccccn1 106353717 SCJBUELPVNOQNR-IERDGZPVSA-N 378.884 5.445 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 112149392 UEGXVSFCFOAUHS-HIFRSBDPSA-N 382.435 5.143 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(Oc3ccncc3)c2)c1 113571887 MUGPCKUCNNGEIA-UHFFFAOYSA-N 388.427 5.200 30 20 GKED Cc1cccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1Br 120706719 NKGDWEDTEDXQTJ-WMZOPIPTSA-N 398.304 5.061 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 153997619 NOYYAMCSWHGFTC-PKOBYXMFSA-N 397.544 6.132 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCCCCC#N)cc2Cl)n1 171400704 FHFFALYHKFKANY-UHFFFAOYSA-N 380.926 5.072 30 20 GKED N#CCN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)c1ccccc1 172810424 OOMKLMIBFDBWIM-UHFFFAOYSA-N 398.249 5.351 30 20 GKED Cc1nc(/C=C/c2ccc(C#N)s2)sc1C(=O)/C=C/c1ccc(C#N)s1 176406153 NVURPHCBZXPSPS-CDJQDVQCSA-N 393.518 5.384 30 20 GKED C=C(C)[C@H](NCc1csc(COc2ccccc2)n1)c1ccc(F)c(F)c1 187375380 TWZDYJCCXADUBP-NRFANRHFSA-N 386.467 5.407 30 20 GKED N#C[C@@H](C(=O)c1coc(C2CCC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 192521800 KIVOEFDXUVWNMJ-AWEZNQCLSA-N 383.860 5.209 30 20 GKED C[C@@]12CC3CC(C(O)=Nc4nnc(C5CCOCC5)s4)(C1)C[C@](C)(C3)C2 329460377 PFGPOFPAMKBKGS-GOSFSIBNSA-N 375.538 5.017 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 332521722 KUXKRTPTSZXOKK-IBGZPJMESA-N 392.890 5.153 30 20 GKED CC(C)(c1ccc(NC(=O)c2cccc(SCC#N)c2)cc1)C(F)(F)F 428454441 RAMZIRJVPQROCT-UHFFFAOYSA-N 378.419 5.394 30 20 GKED Cc1oc(C#N)cc1C(=O)N1CCC(=Cc2cc(Cl)ccc2Cl)CC1 436188335 NCUJUUKCZKSIBD-UHFFFAOYSA-N 375.255 5.086 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(C#N)cc1Cl 439455141 TWQBXGWTXNWXNX-GFCCVEGCSA-N 385.895 5.634 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)cc1 440239569 JPGWZULIDXPXHM-VABKMULXSA-N 375.516 5.318 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H]3CCC[C@@H]32)cc1 444386285 DLGNMUOSRWIWHS-PXNSSMCTSA-N 391.471 5.156 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1 445612011 HTDUMQRGQKKLAN-UHFFFAOYSA-N 398.428 5.115 30 20 GKED N#CCCCOc1cccc(CNC2(c3ccc(OC(F)(F)F)cc3)CC2)c1 449369485 TZUAYNNACFAUQZ-UHFFFAOYSA-N 390.405 5.047 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccccc1 458854203 XDKFBEDDGDDDLH-FQEVSTJZSA-N 396.922 5.059 30 20 GKED O=C(c1cccc(C(F)(F)F)c1)N(Cc1ccc(F)cc1)CC(F)(F)F 460459781 RRDPIGVAHHTLBN-UHFFFAOYSA-N 379.275 5.049 30 20 GKED C[C@H](C(=O)N1CC[C@@H](C)[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462230256 HXYROSPSUUDZKS-SIFCLUCFSA-N 386.417 5.290 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1cc(C(F)(F)F)ccn1 464400710 ABZUMEKRCHITIO-SNVBAGLBSA-N 392.686 5.263 30 20 GKED C[C@@H](C(=O)N(CCC(F)(F)F)CC(F)(F)F)c1ccc(C(F)(F)F)cc1 466357389 NIBZOCQCTCNIDG-SECBINFHSA-N 395.265 5.152 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2C(F)(F)F)ccc(C(F)(F)F)c1F 468020537 GEAPUZPYPMPLBH-UHFFFAOYSA-N 383.238 5.563 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1nc(C(C)(C)C)cs1 468778304 BFZMKJBPCYKBNM-OAHLLOKOSA-N 394.544 5.190 30 20 GKED CC(C)(C#N)CCCN[C@H](Cc1ccccn1)c1ccc(Br)cc1 475727894 QIGBLSJCCYGLKV-LJQANCHMSA-N 386.337 5.047 30 20 GKED C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)C[C@H](CC#N)c1ccccc1 476479194 DYOZOOQKHRSCET-HOCLYGCPSA-N 375.299 5.128 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cnc2ccccc2c1C 482124855 SVWUMIRDAAWPOL-UHFFFAOYSA-N 394.434 5.163 30 20 GKED N#CCCC[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 487160454 UKKXXVGXUZYIJQ-DEOSSOPVSA-N 395.462 5.516 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(-c2cccc3ccccc23)o1 488853643 LZAQFEBGKSTFSC-UHFFFAOYSA-N 385.492 5.983 30 20 GKED CCc1c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1CCC(C)C 494753650 ZSMNKGNWSADEQM-INIZCTEOSA-N 399.564 5.530 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 495101413 YWMYSAIXZGCCRV-HNNXBMFYSA-N 399.416 5.299 30 20 GKED N#Cc1c(NC(=O)c2cccc([C@H]3CCCOC3)c2)sc2c1CCCCC2 499153073 XSAKCJOYJLAFIC-KRWDZBQOSA-N 380.513 5.035 30 20 GKED C=CCOc1ccc(C(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OC 499378206 NBQDMKPPKMEEBL-AWEZNQCLSA-N 393.405 5.112 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)sc2C)cc1 499797517 ICFCFAFXOLUZHF-IBGZPJMESA-N 396.899 5.380 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503497402 GGXODPIZHIWFOB-UHFFFAOYSA-N 375.472 5.057 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1Cl 505704197 BGYUHDBCRDMUCM-SFHVURJKSA-N 398.249 5.175 30 20 GKED CCN(C(=O)NCC(C)(C)C#N)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 512779364 SLTFPNXLMFXOAF-QGZVFWFLSA-N 379.504 5.004 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@@H]2c2ccccc2)c1 513113517 OTJGQNHEZIRDOU-HSZRJFAPSA-N 382.463 5.115 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 513455919 VDMATZKRQFSFMO-KRWDZBQOSA-N 381.545 5.032 30 20 GKED CCCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 518739644 JKFGJXDIOIHQSJ-DLBZAZTESA-N 375.472 5.548 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc2c(s1)-c1ccccc1OC2 519404046 BASZDKFMRYHHJD-UHFFFAOYSA-N 392.505 5.566 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 522127046 MDMGFCRBDLCQEA-LJQANCHMSA-N 385.467 5.261 30 20 GKED CC(C)(C)C(=O)c1ccsc1NC(=O)CCCCOc1cccc(C#N)c1 525661169 QHSGZTQTBCZFBW-UHFFFAOYSA-N 384.501 5.036 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC[C@H](c2ccc(F)cc2)C1 526032089 NRDIIYHKNGGZTF-IBGZPJMESA-N 386.426 5.119 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CC3CCC(=O)CC3)cc2Cl)cc1 530497609 ZLGIVKCVZKMNHI-UHFFFAOYSA-N 382.847 5.092 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CCCCC3)cccc1-c1ccccn1 535845778 HPMKWBISIGYZKM-UHFFFAOYSA-N 387.508 5.511 30 20 GKED N#CC1(c2ccc(C(=O)N3CC=C(c4ccccc4C(F)(F)F)CC3)cc2)CC1 537459261 KYIZNWYTMNLMMV-UHFFFAOYSA-N 396.412 5.190 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 543304913 SHDBEEUNZKXRSA-MOPGFXCFSA-N 393.556 5.719 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 544264091 RBPZAMNTGRSLGY-UHFFFAOYSA-N 382.467 5.125 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)c1nc(O)c2c(C)c(C)sc2n1 551688602 DQBWFVZPFLBQSK-LLVKDONJSA-N 393.965 5.478 30 20 GKED C[C@H](NC(=O)[C@H]1CCC(=O)c2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 560088496 MPKIPENNISUQOD-XDHUDOTRSA-N 394.474 5.163 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1 570415174 VGFBOTPJLBIMHZ-MSOLQXFVSA-N 385.467 5.028 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCOc1ccc2ccccc2c1 572987776 HAKIVHZDGASUKF-UHFFFAOYSA-N 388.854 5.067 30 20 GKED N#CCCCCCc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 589087842 QPJQRTIPNUOKLK-UHFFFAOYSA-N 377.288 5.401 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)c1 589382579 UMPBPSUZAGDTPY-UHFFFAOYSA-N 390.487 5.097 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1Cl 589646727 KFICEUWWBDQBBG-RTWAWAEBSA-N 375.871 5.054 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC2 593975168 OCIRULLHAUBIOH-YJBOKZPZSA-N 380.513 5.148 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 597079087 SBIBPVBLJHWZHQ-KRWDZBQOSA-N 375.394 5.571 30 20 GKED Cc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)oc2ccc(F)cc12 603967991 DZDRSDBPWAOZPG-UHFFFAOYSA-N 376.412 5.733 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3Cl)cc2Cl)cc1 604026950 NJKKVFUXXHMFMI-UHFFFAOYSA-N 383.234 5.910 30 20 GKED C=CC1CCN(C(=O)Nc2cc(-c3nc4cc(F)ccc4n3C)ccc2C)CC1 607403446 BZKFDFWUXFRQLW-UHFFFAOYSA-N 392.478 5.118 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)no1 609427530 HJIUXANKYSRLJY-ZDUSSCGKSA-N 397.887 5.642 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H](Cc1ccccc1)C1CC1 609911931 IOOWTECXCHFOGN-JOCHJYFZSA-N 398.531 5.461 30 20 GKED Cc1cnc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 610320897 ASIQHUNLYIGPME-QGZVFWFLSA-N 396.903 5.082 30 20 GKED CC(C)(CNC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(F)cc1Cl 611094301 GBBIYADYIAKFJY-UHFFFAOYSA-N 399.680 5.365 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(-n4cccc4)c3)n2)cc1 613318010 DZWWPWGBJRLFPA-FQEVSTJZSA-N 383.476 5.399 30 20 GKED CC(C)(CC(F)(F)F)C(=O)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 614528545 KXYGSYCRTQWBKX-HNNXBMFYSA-N 385.323 5.081 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618804844 MNIFIPXJBZZGKT-RNODOKPDSA-N 377.488 5.467 30 20 GKED C=CCN(C(=O)C(c1ccccc1)c1ccccc1)c1nc2c(s1)CCCC2 623331761 PHFBQURRQIVQPY-UHFFFAOYSA-N 388.536 5.373 30 20 GKED C[C@H](CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C(F)(F)F 626369511 GBYBGLFZVPQSPK-RDDDGLTNSA-N 381.238 5.014 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC[C@H](C2CC2)C1 646439094 YAIMWWGWZWQMFL-NSHDSACASA-N 398.322 5.240 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H](c2nc3ccccc3o2)C1)c1ccccc1 676423297 NOVBZANQDASAJV-PMACEKPBSA-N 389.499 5.424 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726456844 JKHSMBSEWIGLTM-UHFFFAOYSA-N 377.900 5.996 30 20 GKED N#CCCCOc1cccc(/C=C2\COc3c(Cl)cc(Cl)cc3C2=O)c1 726743449 ICCFWCPFSBBSKX-RIYZIHGNSA-N 388.250 5.335 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 728116579 NAZYMOWXNJMIOZ-OAQYLSRUSA-N 375.497 5.376 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)c1 729556746 JSMVNQYIOUROCW-HXUWFJFHSA-N 383.879 5.295 30 20 GKED COc1cccc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)c1OC(F)F 730084288 AOQRZVPTZGYBST-KHPPLWFESA-N 387.407 5.316 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2ncnc3sc4c(c23)CC[C@@H](C)C4)c1 733793158 KSSQTEHIJAEVDX-GDBMZVCRSA-N 392.528 5.109 30 20 GKED Cc1cccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)c1C 734305650 ZDQQQDTZLCXDES-FLIBITNWSA-N 376.408 5.070 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](CCc1ccccc1)c1ccccc1)c1ccncc1 734659460 CNXMWDMDFCXEOL-ZEQRLZLVSA-N 385.511 5.372 30 20 GKED FC(F)(F)c1cc(NN=C(CC2CC2)c2ccccc2)nc(-c2ccccn2)n1 735973217 DHEZVOMOIUTGNV-UHFFFAOYSA-N 397.404 5.174 30 20 GKED Cc1cc(C(=O)Nc2ccc3nn(C(C)C)cc3c2)c(C)n1-c1ccc(C#N)cc1 736123449 CDCPUISXBGBXFS-UHFFFAOYSA-N 397.482 5.149 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 739160116 QQKGYZYISFIKES-KKSFZXQISA-N 399.519 5.614 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2c(F)c(F)nc(F)c2F)cc1 741455429 BYEHYGPEHPPXNF-UHFFFAOYSA-N 389.352 5.150 30 20 GKED CC/C(=C\C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC)cc1 746847034 OPFHLZFRWZDCEZ-VAFHRPCXSA-N 380.513 5.379 30 20 GKED CC(=NNc1nc(-c2ccc(NC(=O)C(C)C)cc2)cs1)c1ccccc1 749260447 CWPGYKHGETXZDE-UHFFFAOYSA-N 378.501 5.241 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)OCC 755586186 ZVDLJVBEAVWKGM-DZGCQCFKSA-N 388.360 5.282 30 20 GKED C#CC[C@@H](NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 757059422 VQFQZJFAHQTEHT-CTNGQTDRSA-N 378.472 5.040 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)Nc2ccc(F)cc2OCC#N)cc1 761665918 YANHLNSXVCWPCB-CQSZACIVSA-N 387.480 5.111 30 20 GKED CSc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1F 766355882 OPFUBNLHGOZMOG-LJQANCHMSA-N 376.456 5.455 30 20 GKED C=C[C@@H](CC(=O)N(c1ccc(N(C)C)cc1)[C@@H](C)c1ccccn1)c1ccccc1 766589578 ZGEIQLDDXFUINI-SFTDATJTSA-N 399.538 5.602 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CC3(CSc4ccccc4)CC3)[nH]c12 770870970 MTZWDNZUZWVFDO-KRWDZBQOSA-N 375.497 5.010 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)c1 774243466 KYCGMDWRCNHSMG-ZCYQVOJMSA-N 388.486 5.580 30 20 GKED C[C@@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 779028776 BBYJMZFHOAEYLD-VFNWGFHPSA-N 377.488 5.243 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c(C)cc(C)cc3C)n2)cc1 784497474 CZNRWZCAEIFJPE-FQEVSTJZSA-N 390.508 5.163 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc2ccccc12)c1nccc2ccccc12 792097439 WKXGFAOBZJQWLT-JOCHJYFZSA-N 380.447 5.423 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](CC#N)c3ccccc3)n2)cc1 796633096 GWQUFJFZUWRRJI-PMACEKPBSA-N 385.492 5.382 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)sc2ccc(C#N)cc12 796756828 PHXLNJPSBOTVQJ-KRWDZBQOSA-N 399.500 5.695 30 20 GKED C[C@H](NC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 797006975 ZBBGZPAUZOODLR-KSFYIVLOSA-N 384.907 5.061 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567717 ASCQJSFEACFVKO-RHSMWYFYSA-N 378.497 5.238 30 20 GKED FC(F)(F)c1nc(NN=C2CCC[C@H](c3cccnc3)C2)c2ccccc2n1 799871970 JVFUJDLIJIPHIT-ZDUSSCGKSA-N 385.393 5.169 30 20 GKED N#CC1(CCCOC(=O)[C@H](Sc2ccccc2)c2ccccc2)CCOCC1 800082738 LURRXOZZARMPSW-OAQYLSRUSA-N 395.524 5.164 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2ccccc2o1)c1csc(-c2cccs2)n1 800387667 QUKREUMRAOMHMI-LBPRGKRZSA-N 393.493 5.167 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 800578929 WGFHJSXYGZTKFY-IRLDBZIGSA-N 382.479 5.064 30 20 GKED C[C@@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 801540108 UFTHPAKAHQXVSP-OAHLLOKOSA-N 375.403 5.123 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 804560227 WXZDLQCFXMDPBN-MRXNPFEDSA-N 393.453 5.191 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccnc(C(F)(F)F)c3)cc2)c1 808384587 IRGNSOIBWHHSEC-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1ccc2c(CNc3ccc(Oc4ccnc(C#N)c4)cc3)cc(=O)oc2c1C 811777180 ANBPSZKSGFPTLM-UHFFFAOYSA-N 397.434 5.081 30 20 GKED CC(=NOCc1nc(-c2ccccc2)oc1C)c1nc2ccccc2n1C(F)F 818290177 DMPJCXRTEIBRGR-UHFFFAOYSA-N 396.397 5.336 30 20 GKED O=C(CON=Cc1cccc(Cl)c1Cl)Nc1ccccc1-c1ccccc1 821464699 OYISJHXGNZRSSL-UHFFFAOYSA-N 399.277 5.650 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H](CC)Sc1ccccc1 842291009 YRYZMKREAZKHAJ-WOJBJXKFSA-N 394.540 5.030 30 20 GKED CSc1ccc(NC(=O)[C@H](C)ON=Cc2cccc(Cl)c2Cl)cc1 852120703 XMFZNUMWANNEFC-NSHDSACASA-N 383.300 5.093 30 20 GKED CC1(C)CN(C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)CC[C@@H]1C(F)(F)F 857493562 DXFINESXDODIFI-STQMWFEESA-N 385.323 5.153 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)cc2C(F)(F)F)c1 858379082 VLUJDJVQFZTWAP-CJNGLKHVSA-N 380.385 5.376 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F 860478195 RPRIBKGXVHXKHK-APPZFPTMSA-N 380.313 5.080 30 20 GKED CC(=NNc1ccc(OC(F)(F)F)cc1)c1sccc1Br 915048551 HMZGPUKOXHYPAE-UHFFFAOYSA-N 379.201 5.245 30 20 GKED Oc1ccc(Cl)cc1C=Nc1cccc(COCC(F)(F)C(F)F)c1 915980770 CKXBYTCDTUBUNQ-UHFFFAOYSA-N 375.749 5.213 30 20 GKED Clc1nc2sccn2c1C=NN(Cc1ccccc1)Cc1ccccc1 916367554 GKQRODZFBMQHBT-UHFFFAOYSA-N 380.904 5.086 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 916915448 JMROVEILGOOFAM-XYJFISCASA-N 394.437 5.045 30 20 GKED CC(C)c1ccc([C@@H](C)NN=C2CCC3(CC2)C(=O)Nc2ccccc23)cc1 917553033 WVQTYYDJQKHWJG-BPNWFJGMSA-N 375.516 5.281 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc4ccccc34)n2)cc1 920138037 ACNIRPXRPJWTCI-OAQYLSRUSA-N 398.487 5.391 30 20 GKED C=C(Br)COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921224547 QLTITZSQEJIFMA-UHFFFAOYSA-N 393.089 5.182 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C/C(=O)c3cccc4ccccc34)s2)c1 1776114523 RPZUHMOBNQIRHG-ACCUITESSA-N 384.456 6.163 30 20 GKED C=CC[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776185492 CVXMKHDEJIRYIQ-MRXNPFEDSA-N 384.234 5.044 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CC[C@]3(C(=O)O)CCCC[C@H]23)cc1 1776785952 VFKHFOFCBQUQTG-XUZZJYLKSA-N 385.548 5.449 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)[C@H]2CCc3ccccc32)cc1 1776787901 DNFZXLNIKNVWOP-BJKOFHAPSA-N 395.543 5.309 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776806051 YFHFYEPEZNCSGD-JLHYYAGUSA-N 390.435 5.589 30 20 GKED CCOc1ccc(OCC)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 25733315 UREKWFKTFDLLAX-UHFFFAOYSA-N 386.451 5.275 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 47375920 WZTLPKQXKLNDES-OAHLLOKOSA-N 391.496 5.079 30 20 GKED Cc1ccc(CN(C)C(=O)c2ccccc2SCc2ccc(C#N)cc2)o1 49931289 LZONKHKADZUZDL-UHFFFAOYSA-N 376.481 5.024 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1 62922479 OXMLBUKKRLMJCE-STSQHVNTSA-N 392.499 5.060 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)Oc1ccc(Cl)c(Cl)c1 65839603 JHRAOQUCFMHKPU-LBPRGKRZSA-N 393.270 5.058 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCO[C@H](C)c1ccccc1 66955138 YKWXCHUMHQFKIT-QZTJIDSGSA-N 397.544 5.370 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(F)c1 66955204 CXRYVJJTGAVIMJ-HNAYVOBHSA-N 383.492 5.589 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1cc(Cl)ccc1Cl 108354633 LFSXXKVANUMQID-LBPRGKRZSA-N 394.327 5.296 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1nc2ccccc2n1C(F)F 108407902 BBHSHOFAVWXMBI-KGLIPLIRSA-N 386.471 5.856 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 132105710 SCDNRPNQUBLAOG-KBXCAEBGSA-N 375.394 5.111 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1cccc(SCC#N)c1 153819347 FQKJUHJEKHXSAZ-KRWDZBQOSA-N 379.529 5.242 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@@H]1c1nc2ccccc2s1)c1ccccc1 160626059 CMNAMAQYZWQMOW-PKOBYXMFSA-N 390.512 5.188 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1cccc2ccccc12 170974432 OBQFSUUTFKSEDV-MRXNPFEDSA-N 376.481 5.109 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)cc1NC(C)=O 171158171 YELRDLIWZPVPKD-QPJJXVBHSA-N 397.780 5.222 30 20 GKED Cc1ccc2oc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cc2n1 179621503 YTQOSDLZTZTELH-AWEZNQCLSA-N 393.855 5.403 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)Cc1ccccc1 184308646 WINXUPRWOLGOTM-LJQANCHMSA-N 385.467 5.212 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2ccccc2n1C(F)F 190662679 JBQRGWGDJDZTPK-SNVBAGLBSA-N 397.278 5.079 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2nc(-c3ccccc3)cs2)ccc1OC 237348199 FBUIBELIBAGZIO-QGZVFWFLSA-N 394.540 5.624 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@]2(C)[C@H](C1)C2(Cl)Cl 284490653 BNQFLJAWGXPXDT-ISTRZQFTSA-N 398.359 5.128 30 20 GKED O/C(Cc1c[nH]c2cc(F)ccc12)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329526960 UAGZKUGDIGWTHU-IBGZPJMESA-N 380.467 5.195 30 20 GKED N#Cc1ccc(Cl)cc1N1CCC[C@H](c2n[nH]cc2N=C(O)C2CCCC2)C1 330058171 YOMVPOAUUOSKTG-INIZCTEOSA-N 397.910 5.097 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@H](C)CC3)n1 410988897 TUSAGZPHFSBDOI-GHMZBOCLSA-N 388.924 5.125 30 20 GKED CC(C)Oc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1[N+](=O)[O-] 412077603 JHBMKFRDYBMTPK-AWEZNQCLSA-N 399.472 5.029 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc(C(F)(F)F)c1F 430607682 CSQBCWQPMHCVAD-NSHDSACASA-N 384.398 5.397 30 20 GKED N#CCSc1cccc(C(=O)NC2(c3cccc(C(F)(F)F)c3)CCC2)c1 430646013 VTUBNPMFVPYHJZ-UHFFFAOYSA-N 390.430 5.130 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@H](Sc3cccc(Cl)c3)C2)c(Cl)c1 433285777 SXFVTOFODQPEMI-HNNXBMFYSA-N 392.311 5.264 30 20 GKED CC(C)n1c([C@H]2CCCN2c2nc(C(F)(F)F)ccc2C#N)nc2ccccc21 433758629 NFJPFQQOWDZOFR-QGZVFWFLSA-N 399.420 5.244 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 437914409 YRMLPMJHKFKYAQ-VXKWHMMOSA-N 375.516 5.596 30 20 GKED C[C@@H]1Cc2ccccc2CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 438040500 JTVUANZPEAAGCX-QGZVFWFLSA-N 383.451 5.329 30 20 GKED CCCCn1ncc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C(C)C 455271601 HTKMKTCJOGTXFO-IBGZPJMESA-N 381.524 5.363 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(C)[C@H](C)c1ccc(Cl)cc1Cl 460376181 RWPCSPPYJYPVOB-DYVFJYSZSA-N 395.334 5.210 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCc1cc(C#N)ccc1F 466198151 SMJHSXWDWGYHRO-KRWDZBQOSA-N 387.458 5.267 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nnnn1C1CCCCC1 468834060 DWTGAMQQQXVRKA-INIZCTEOSA-N 388.475 5.015 30 20 GKED COc1cccc([C@H](C)CCCC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 468998404 LIVNQHRBANPWNK-FOVJLYNBSA-N 390.527 5.267 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccccc1)N1CCCC1 475546755 FHUMAOZPVCPCML-HSZRJFAPSA-N 391.559 5.497 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)C[C@H](CC#N)c1ccccc1 476218188 FMCZBVLZHWFHQM-NRFANRHFSA-N 384.479 5.600 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N[C@H](C)c1ccc(C#N)cc1 478075736 AHOBKVWJFAYSNU-GFCCVEGCSA-N 399.372 5.032 30 20 GKED C=CCCCC(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)cs1 478525286 CIELNFAWQDLZMU-GFCCVEGCSA-N 379.323 5.106 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1C)c1ccccc1 488711593 HKYXZEADMKOMPQ-WIYYLYMNSA-N 378.516 5.212 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(F)ccc2F)nnc1-c1ccc(C)cc1 489631746 UHEOSYKVNXXMDK-CQSZACIVSA-N 399.466 5.081 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CCC)c1ccccc1 489653366 SNGLDENNLVOPKF-OAQYLSRUSA-N 376.500 5.064 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cc(Cl)ccc1C(F)(F)F)c1ccccc1 489734106 NCTHQZJLESNLQY-OAHLLOKOSA-N 381.785 5.525 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1)c1c(C)noc1C 493960593 MQNDHAVOVUHVEQ-LJQANCHMSA-N 375.428 5.088 30 20 GKED COc1ccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1Cc1ccccc1 505364302 OFMBGUDRRUVMAW-QGZVFWFLSA-N 385.467 5.040 30 20 GKED CCN(Cc1ccc(OCC(F)(F)F)c(OC)c1)[C@@H](C)c1ccc(C#N)cc1 508605118 PTKODSOJTAWNNN-HNNXBMFYSA-N 392.421 5.091 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(Cl)c2SCC(F)F)c1 512752237 AVQUILYHPUGQLB-UHFFFAOYSA-N 387.238 5.475 30 20 GKED N#Cc1cccc(CNC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c1 515360193 LXMNGNITXQJNCP-UHFFFAOYSA-N 394.805 5.375 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c1 517099403 ZUSMRMQEQYOJDD-ZWKOTPCHSA-N 388.389 5.130 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccccc1Cl 518740261 ROJCVICHIXXLMH-OAHLLOKOSA-N 388.920 5.532 30 20 GKED CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(C#N)c(Cl)c2)c1 525518495 YIHQUXPUZCNBOH-UHFFFAOYSA-N 390.270 5.102 30 20 GKED Cc1ccc([C@@H]2CCCN2CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 532745366 WRFAHQLXYDEXMG-RXVVDRJESA-N 393.556 5.165 30 20 GKED C=CCOc1cccc(CNc2ccccc2CN(C)C(=O)c2cccs2)c1 532898367 OCFHCRPJVNQNAU-UHFFFAOYSA-N 392.524 5.197 30 20 GKED CC(C)Cn1c(-c2cc(Cl)ccc2Cl)nnc1N1CCC(CC#N)CC1 549440426 LIRDRXQJBKAPCB-UHFFFAOYSA-N 392.334 5.038 30 20 GKED N#CCC[C@H](C#N)CNCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 554552186 KLROIWPGHAJXGG-LJQANCHMSA-N 398.466 5.199 30 20 GKED Cc1sc(C2(N[C@H](C)c3cccc(C#N)c3)CCC2)nc1-c1ccccc1F 555773371 SRYUPHLTUNMQJH-OAHLLOKOSA-N 391.515 5.859 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1 565097218 ADAFCBWSFGGDPD-HXUWFJFHSA-N 379.504 5.558 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(F)ccc3Cl)cc2F)c1 571893214 SZPOCZXICXQIEM-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)s2)cc1 574298037 NTTCQTLNMFKOTR-GCJKJVERSA-N 389.568 6.513 30 20 GKED C=C(C)Cn1c(C2CCCC2)nnc1N1CC[C@H](C(F)(F)F)C2(CCC2)C1 581165143 BFOLLMLITZGQDW-INIZCTEOSA-N 382.474 5.071 30 20 GKED COc1ccc(C2(NCc3ccc(-c4ccccc4C#N)cc3)CCOCC2)cc1 591017672 CEQFOZFEHXWRRD-UHFFFAOYSA-N 398.506 5.029 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(OCc3ccc(F)cc3)c2)cc1 603918269 NTBMXUDLCKVJRO-UHFFFAOYSA-N 392.455 5.007 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3cc4ccccc4o3)cc2)c1 609063579 DRYSNFMGAUVLIP-UHFFFAOYSA-N 382.419 5.065 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)N[C@H](c3ccccc3)C3CC3)c2)cc1 609221146 ACSNECNAVGIDCW-RUZDIDTESA-N 397.478 5.030 30 20 GKED Cc1ccc(CCCNC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 609403112 UATRZQZPICKDQE-QGZVFWFLSA-N 381.545 5.310 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)cc2)cc1 609502769 PDQRYFQSSTUIHU-SYURHXKASA-N 386.495 5.196 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 609968712 AONFMWRWVDCXGY-AWEZNQCLSA-N 390.405 5.497 30 20 GKED Cc1nc(SCc2nnc(-c3cccc(C#N)c3)o2)n(C2CCCCC2)c1C 610217299 VHFPZDAVIOSBBW-UHFFFAOYSA-N 393.516 5.219 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC(Cc4ccccc4)C3)c2)cc1 610632438 XLRSHJIIHXWQJQ-UHFFFAOYSA-N 383.451 5.057 30 20 GKED CC(C)(CNC(=O)c1ccccc1Sc1ccccc1C#N)[C@H]1CCCCO1 610718706 YWSVOPFOXQFWQA-OAQYLSRUSA-N 394.540 5.035 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)(F)F)cn3)n2)cc1 613314297 JWMQOSAXZYLONX-AWEZNQCLSA-N 387.386 5.022 30 20 GKED N#C[C@@H](C(=O)c1cc2ccc(F)cc2s1)c1nc(-c2ccccc2)cs1 613392428 OHWOSIDHQKIXNB-HNNXBMFYSA-N 378.453 5.654 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618848336 UFWNEUDBUMDNKK-HXPMCKFVSA-N 388.298 5.255 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)cc1Cl 619754884 NUIZNJROJNGROP-GOSISDBHSA-N 375.697 5.215 30 20 GKED O=C(c1csc(C(F)(F)F)c1)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F 627664553 LTABRVZVILRGDV-APPZFPTMSA-N 399.278 5.112 30 20 GKED Fc1ccc([C@H](CC(F)(F)F)NCc2cccc(F)c2OC(F)F)cc1 660188087 CBSHNGXIWCGBIZ-AWEZNQCLSA-N 381.291 5.350 30 20 GKED C=CCOc1c(Br)cc(CN[C@@H](C)c2ccsc2)cc1OCC 669831132 QQMRAIJSPVYVCF-ZDUSSCGKSA-N 396.350 5.325 30 20 GKED C=CCc1cc(CN[C@@H](c2ccccc2)c2ccc(OC)cc2)cc(OC)c1O 678858715 OYZXSHDXBABSBR-DEOSSOPVSA-N 389.495 5.017 30 20 GKED C[C@@H](OC(=O)c1occc1COc1cccc(C#N)c1)c1cnc2ccccc2c1 726736409 YIAYYSBYTNAQCO-MRXNPFEDSA-N 398.418 5.196 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)cc1C 730950588 HEKJWFMFNVVEGG-UXBLZVDNSA-N 376.408 5.070 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1OC 731113985 BCXWEKNXFRENIC-WBVHZDCISA-N 383.517 5.220 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)Cc1ccccc1Cl 731400911 XSWBSCGALYUAHK-CABCVRRESA-N 387.936 5.487 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)o1 734304828 XODKJWQDSAYCOY-TWGQIWQCSA-N 391.398 5.247 30 20 GKED N#Cc1ccc2ncc(/C=C\C(=O)c3ccc(Oc4ccccc4)c(F)c3)n2c1 736434849 XBWKBNRXSUYDKR-HJWRWDBZSA-N 383.382 5.033 30 20 GKED CCC(C)(C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 745947739 LHSQQSOXPWNIGK-CYBMUJFWSA-N 381.328 6.119 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 746517728 CUZMPSFFCMWKSQ-AWEZNQCLSA-N 398.293 5.232 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COc2ccccc2Cc2ccccc2)n1 747193301 HUXSWKUJNMTAGY-IBGZPJMESA-N 390.508 5.113 30 20 GKED Cc1oc2ccccc2c1C=Nn1cnnc1SCc1ccc(Cl)cc1 758100563 WMNJKWHHQKZFSS-UHFFFAOYSA-N 382.876 5.161 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Br)cc2Cl)cc1 765612797 FQHOYLTWFUBISQ-OXFRDRNISA-N 390.664 5.289 30 20 GKED N#C[C@H](C(=O)[C@@H](F)c1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 769294615 RPGYWBMZDFSXDL-DOMZBBRYSA-N 378.350 5.202 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 772958795 IADTZSPMYRDRRW-OALUTQOASA-N 386.495 5.676 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C2CCC(C(F)(F)F)CC2)cc1 774051025 HKUKSTJNEMUQHD-VDINOMKWSA-N 394.437 5.216 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 780451679 WMHPXVFARCXWKZ-JTQLQIEISA-N 383.757 5.294 30 20 GKED N#Cc1ccc(CNCc2cccc(Oc3cccc(C(F)(F)F)c3)c2)nc1 780556783 QXOAJDQUHMBBMD-UHFFFAOYSA-N 383.373 5.054 30 20 GKED C=CCc1cc(CN[C@H]2CCCSc3ccc(OC)cc32)cc(OC)c1OC 783243354 AAKURNUCGKYNBZ-FQEVSTJZSA-N 399.556 5.158 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(OC)c3ccccc23)c2ncc[nH]2)c1 787170310 VRQWSFIXQZMVSO-RCCKNPSSSA-N 384.435 5.004 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@H]1CCC(F)(F)C1 797869867 BVCUFVNGNFCERB-GOSISDBHSA-N 386.417 5.365 30 20 GKED COc1ccc2cc(NC(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)ccc2c1 806614114 LADILJVZMNCZHH-DHIUTWEWSA-N 385.467 5.152 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)N[C@H](C)c1ccc(Oc2cccnc2)cc1 807898565 HHWFOESDYRXIOU-UTKZUKDTSA-N 383.492 5.022 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2cscc2C(F)(F)F)C(=O)c2ccccc21 811691290 NHGANWWCQUXXME-QARUFBMTSA-N 380.387 5.084 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC12CCSCC2)c1nc(-c2ccc(Cl)cc2)cs1 835068836 UBXKFFDGYITHBF-CABCVRRESA-N 388.945 5.173 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915598055 IYUWRRRBDJLCIA-LJQANCHMSA-N 399.475 5.619 30 20 GKED O=C(/C=C\c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccncc1 916136640 VFLBPMUZTLCOTH-CLTKARDFSA-N 380.787 5.332 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)cc1OC(F)F 916154255 FRFIGSJYAYTLPT-VZUCSPMQSA-N 387.426 5.183 30 20 GKED CC(C)c1nnc(S)n1N=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 916312569 DYNUJTJWLIJBJO-UHFFFAOYSA-N 381.288 5.139 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Nc2cccc(OC(F)F)c2)cc1 917028161 NRYUMTSDVGHHJC-HXUWFJFHSA-N 393.393 5.587 30 20 GKED CCCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 920324104 LDEWAPKDBLNHRZ-NRFANRHFSA-N 398.462 5.393 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cccc(Cl)c2)nnc1-c1ccccc1 9447375 XHVRSQDXQMGCFB-AWEZNQCLSA-N 383.904 5.148 30 20 GKED C=CCn1c(SCc2cccc(C(F)(F)F)c2)nnc1-c1ccoc1C 14063782 QFRRXPJGUNYOAF-UHFFFAOYSA-N 379.407 5.344 30 20 GKED N#Cc1ccc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)c(F)c1 29890427 WASNYUYHVCXSJW-UHFFFAOYSA-N 389.459 5.064 30 20 GKED C[C@H](c1ccccc1)N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161580 BPZCGMYNLWPTJB-LJQANCHMSA-N 399.494 5.557 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(Br)c(F)c1 130215589 HIKROZDEYLFBCR-FNORWQNLSA-N 389.249 5.003 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)NCCCCC#N 178641826 XJQGYUNDVVBYGQ-LBPRGKRZSA-N 378.339 5.226 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 185009659 NLOWAVRWDKOGKA-HXOBKFHXSA-N 398.466 5.361 30 20 GKED C[C@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)c1cccc(C#N)c1 189994688 MPDHRXDHXUUXAG-SJORKVTESA-N 387.458 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCN(Cc2ccccc2)C1 193883883 SZFBEWFHAHTKAX-OAQYLSRUSA-N 391.559 5.182 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc([N+](=O)[O-])cc2)cc(C)c1OCc1ccccn1 206492714 LRYCXIJPLHRXRO-WDZFZDKYSA-N 388.423 5.082 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc([C@@H]4CCCO4)s3)cc2)c1 272650177 MXAROBBMNZEWCY-NRFANRHFSA-N 391.496 5.057 30 20 GKED COc1cccc(C2=CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 272804468 IBYREJILFJPACJ-MRXNPFEDSA-N 393.512 5.021 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1csc(COc2ccccc2)n1 277492318 XFOAOQPMWGZQOS-KRWDZBQOSA-N 390.549 5.016 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(F)cc3OC(F)F)c2)cc1 303967601 RDYYCOOVTXNVAY-UHFFFAOYSA-N 398.340 5.343 30 20 GKED OC(=Nc1nc(C2CCOCC2)cs1)N1CCCCC[C@@H]1c1ccccc1 329406119 BXOPTLXLMYYPDE-LJQANCHMSA-N 385.533 5.200 30 20 GKED C[C@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CCC2 410886168 FNXWXYCARIPEAY-WTNDLDAUSA-N 387.508 5.157 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1C 425659904 LEKATZLRFKVOQW-GOSISDBHSA-N 393.531 5.797 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 429072567 ZADKDDNYWKULRC-UHFFFAOYSA-N 376.460 5.144 30 20 GKED CCc1ccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)cc1 433021919 SFLLULIFCRIBEY-JOCHJYFZSA-N 375.541 5.897 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1-c1csc(C)n1 433782755 LQRRPWDCEAIRRA-UHFFFAOYSA-N 388.496 5.210 30 20 GKED CSc1c(F)cccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 435780390 VXBYCSDETOPJQI-HNNXBMFYSA-N 382.485 5.470 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C 438637828 PWRGEEIGUAYRFI-IBGZPJMESA-N 387.405 5.563 30 20 GKED C=CCC[C@H](NC(=O)C[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441592524 ULEXVXISWSITDP-KXBFYZLASA-N 376.422 5.418 30 20 GKED CC[C@@H](NC(c1cccc(OC)c1)c1cccc(OC)c1)c1ccc(C#N)cc1 447587314 QWDOJBZOTMBQBJ-XMMPIXPASA-N 386.495 5.406 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1ccccc1Cl 453469915 YTCRJKOYCBSZBQ-OALUTQOASA-N 386.927 5.091 30 20 GKED CC[C@H](CC(F)F)C(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 457690533 DZOQNJBLMLDTAR-PELKAZGASA-N 377.275 5.106 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@@H](C)c1cccc(C#N)c1 462039378 OCAISYRTMYSLMR-RBUKOAKNSA-N 384.479 5.749 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C2CCC(c3ccccc3)CC2)c1C 464082108 NMUOQJQHPIPLEK-UHFFFAOYSA-N 398.510 5.273 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 464945276 ZXDHYLSWWBJOCC-MOPGFXCFSA-N 379.529 5.021 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Sc3nc4c(cc3C#N)CCCC4)o2)cc1C 468625313 NAHVIJHLFACYFP-HNNXBMFYSA-N 390.512 5.352 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1 476062745 OTAQFIJJZYZTML-DENIHFKCSA-N 384.479 5.853 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 481361915 STVRUXBKCZOQDE-OAQYLSRUSA-N 395.528 5.490 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F 482429506 AGCFDJSMMMMNCW-HXUWFJFHSA-N 397.400 5.156 30 20 GKED N#Cc1ccccc1COc1cccc(-c2nc([C@@H]3CCC(F)(F)C3)no2)c1 482747924 BPQPUSIDRDVYIQ-OAHLLOKOSA-N 381.382 5.090 30 20 GKED N#CC[C@@H](CC(=O)Nc1nc(-c2cc(F)ccc2F)cs1)c1ccccc1 483075576 PKVNEENBKSVINK-AWEZNQCLSA-N 383.423 5.114 30 20 GKED N#CCSc1cccc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)c1 485545814 OUXIQODTVDFDAH-YPAWHYETSA-N 376.525 5.101 30 20 GKED Cc1ccc(OCc2cccc(C(=O)N[C@H](CCCC#N)c3ccccc3)c2)cn1 487208942 KGMACLGTXPEFJE-XMMPIXPASA-N 399.494 5.134 30 20 GKED CCn1cc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)c2ccccc21 498388141 DSCYNRFBPGIULF-UHFFFAOYSA-N 385.492 5.443 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 504013000 KWRXJZMVDUSKFE-MRXNPFEDSA-N 398.428 5.072 30 20 GKED Cc1c(C(=O)Nc2ccc(OC(C)C)cc2Cl)sc2ccc(C#N)cc12 504340944 JOSMDFRPESWGTE-UHFFFAOYSA-N 384.888 5.774 30 20 GKED CC(C)n1ncc2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc21 504792745 HJZVEUCMFGUICP-UHFFFAOYSA-N 380.451 5.408 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c1 505547479 QTZVDYWIOBAJDD-AWEZNQCLSA-N 385.703 5.363 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2occc2COc2ccccc2)cc1 505840488 YPUQNXRNZMETIS-NRFANRHFSA-N 388.467 5.151 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccnc3ccccc23)cc1 512320132 ABQQJZBVNMTGFO-UHFFFAOYSA-N 395.437 5.088 30 20 GKED Cc1ccc2c(c1)N(C(=O)c1cccc(COc3ccccc3C#N)c1)CCC2 513268924 RBXXSENDZFBINU-UHFFFAOYSA-N 382.463 5.039 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 514121126 RZDPXGOXGABJET-RBBKRZOGSA-N 394.490 5.134 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)cc1Br 517455645 XRQKQCCQTYOIOZ-NSHDSACASA-N 393.281 5.092 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)N(C)Cc3cccc(C#N)c3)c2)C1 520133415 LGAVJUFBXPRUIC-MBSDFSHPSA-N 391.515 5.317 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCc3cccc(C#N)c3)c(C)c2)n1 520908158 UGSFDOIDAUQEPG-UHFFFAOYSA-N 394.525 5.105 30 20 GKED CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)Nc1ccc(CC#N)cc1 521331314 AVSYAXVETCAIKX-INIZCTEOSA-N 376.287 5.202 30 20 GKED N#C[C@@H](NC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1)C1CC1 525055835 PMMVDTGOOHQNCQ-GOSISDBHSA-N 391.323 5.318 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccnc1-c1ccccc1 535110606 ITZRUZPKOQWEKO-IFMALSPDSA-N 382.467 5.052 30 20 GKED N#CCc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 535348323 BTCQYEVKWOZAIS-NRFANRHFSA-N 378.834 5.065 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 537198965 QQBSORDHKYSIKI-LJQANCHMSA-N 383.454 5.522 30 20 GKED C=CCC[C@H](NCc1csc([C@@H](C)OC)n1)c1ccc(C(F)(F)F)cc1 539335576 HJDLXCVKUDDGDW-DYVFJYSZSA-N 384.467 5.666 30 20 GKED Cc1cc(NCc2cn(CCC#N)nc2-c2ccccc2)ccc1Br 540522804 AZDBJCLJGLRSOW-UHFFFAOYSA-N 395.304 5.147 30 20 GKED Cc1cc(C)c(NC(=O)CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)c1 542016529 AEHYBPBDKUEIIR-FQEVSTJZSA-N 397.522 5.440 30 20 GKED CCN(CC)c1ncc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 543070930 MARAVVQSSYNMNS-KRWDZBQOSA-N 390.556 5.379 30 20 GKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 550826447 FYILBAVAHRNWIV-WOJBJXKFSA-N 376.422 6.061 30 20 GKED C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc(NC(=O)c2ccccc2)c1 564432498 SRZXPQWYWFIAEQ-BXKMTCNYSA-N 381.479 5.149 30 20 GKED CCSc1cccc(Br)c1NC(=O)NCC(C)(C)CCC#N 564442194 HZFITDJAJKKXAK-UHFFFAOYSA-N 384.343 5.013 30 20 GKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1 581163696 VBPDGSPHEHDPBD-CYBMUJFWSA-N 381.407 5.445 30 20 GKED N#CCCC[C@H](NCc1cc2cc(Br)ccc2o1)c1ccccc1 582371531 BUPXOGXGIIFTLD-IBGZPJMESA-N 383.289 5.720 30 20 GKED Cc1nc(NC(=O)CCCCCC#N)sc1Cc1ccc(Cl)cc1F 588723875 CJEDMJQLTPKMEH-UHFFFAOYSA-N 379.888 5.247 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccs2)n1)c1nc2cc(F)ccc2s1 592973634 CYMNENFWOMOOEW-JTQLQIEISA-N 385.470 5.110 30 20 GKED C[C@@H](NC(=O)CCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 594012718 NCWCLAMMIOPEIW-CYBMUJFWSA-N 380.435 5.695 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1 603510885 LPTKTWHCRFKHPS-UHFFFAOYSA-N 390.870 5.063 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1Cl 603759228 YOGANUVEAZKPEU-LJQANCHMSA-N 385.854 5.729 30 20 GKED N#Cc1ccc(CNc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c(F)c1 604009488 FLZGCJIHRSSNJI-UHFFFAOYSA-N 388.229 5.804 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nnc(-c2ccco2)n1C1CCCCC1 604044412 MIHNDVRHDQPQPB-SFHVURJKSA-N 378.501 5.270 30 20 GKED C=CCCCN(C)C(=O)c1cccnc1Sc1ccc(Br)cc1 605644599 QSNCCMCUVFEUGM-UHFFFAOYSA-N 391.334 5.034 30 20 GKED CCN(C(=O)CCc1ccc(C#N)cc1)[C@@H](c1ccccc1)c1ccc(F)cc1 609304671 NCLQNKFJKMQFIK-VWLOTQADSA-N 386.470 5.268 30 20 GKED CCC[C@H](NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 609387656 AYLOPPACDRZNLO-HBFSDRIKSA-N 395.572 5.396 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4cc[nH]n4)cc3)cc2)cc1 609514985 KCRIMGVRXKIITP-UHFFFAOYSA-N 394.434 5.187 30 20 GKED C[C@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1cccc(C#N)c1 610345166 WBZSVXCPJVDLCB-INIZCTEOSA-N 389.886 5.315 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccnc1Oc1ccccc1 610629291 AKXVVKJNKKJGLH-RBBKRZOGSA-N 398.466 5.178 30 20 GKED CC(C)(C#N)c1ccc(CN2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)cc1 614176390 ZHKKJJUHIDDFLD-OAHLLOKOSA-N 393.478 5.343 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 615971750 SNZNQILJIBTJAE-UHFFFAOYSA-N 393.462 5.191 30 20 GKED C=CCOc1c(Cl)cc(CN[C@@](C)(CC)c2nc(C)cs2)cc1OC 623430161 DJKXJYJTEIOIEK-IBGZPJMESA-N 380.941 5.093 30 20 GKED C=CCCC(C)(C)CNCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 631222241 UTMKASDQBNGYKF-UHFFFAOYSA-N 375.513 5.049 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(OC)cc2)n1 639303331 PBZQVLNJPLUKEV-LAUBAEHRSA-N 399.560 5.061 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F 648583019 QDOOTLLQAZECPN-ISVAXAHUSA-N 384.295 5.005 30 20 GKED COc1cc(/C=C\C(=O)c2cn(C)c3ccccc23)ccc1OCC(F)(F)F 726740767 PKKQETSLGUCPBR-CLFYSBASSA-N 389.373 5.024 30 20 GKED CCCCCCCC(=O)N1CCC[C@H]1c1ccccc1I 733779925 BAWKOPFTMMHHFO-KRWDZBQOSA-N 399.316 5.315 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1ccc(N2CCCCCC2)cc1 734096949 URUGCTOKZYXJLD-CCEZHUSRSA-N 385.511 5.208 30 20 GKED O=C(/C=C/c1cc(Cl)c2c(c1)OCCO2)c1ccc(-c2ccncc2)cc1 745990144 LQBIHUMUSLNHCR-LZCJLJQNSA-N 377.827 5.069 30 20 GKED N#C[C@@H](Sc1nn(-c2ccccc2)c(=S)s1)c1ccc(Cl)cc1 752909556 ONPJLLDUNQQNML-CQSZACIVSA-N 375.931 5.674 30 20 GKED C#CC[C@@H](NC(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 757017510 ZFHBFUSLKRNMNU-FXAWDEMLSA-N 389.524 5.243 30 20 GKED C=CCOc1ccc(/C=C\C(=O)c2cc(Br)ncc2F)cc1Cl 762422917 BWGVNZUOOXKJPG-HYXAFXHYSA-N 396.643 5.098 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(C#N)s2)cc1OCc1ccccc1 762442971 NAOXUUOSFPSURB-YFHOEESVSA-N 375.449 5.103 30 20 GKED CCSc1ccc(Cl)cc1C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl 764303832 RCGLPLZRVZHBRQ-UHFFFAOYSA-N 396.255 5.138 30 20 GKED C=CC[C@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccncc1 766020440 PMQWDHBNSJQTIG-WBMJQRKESA-N 384.373 5.252 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@H]3CCCOC3)c2)cc1 766355412 LCGWMHUYIXFLMZ-UKILVPOCSA-N 396.490 5.488 30 20 GKED CC(C)(C#N)CCCCSc1nn(-c2ccc(Cl)cc2)c(=S)s1 767033848 PBSQFFYMJCOAMP-UHFFFAOYSA-N 383.995 6.129 30 20 GKED CC(C)(C#N)CCCCOC(=O)Cc1csc(-c2ccc(Cl)s2)n1 768632078 RLSBSCRTQMANND-UHFFFAOYSA-N 382.938 5.331 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)Cc1ccc(O[C@@H](C)C#N)cc1 769469954 IIQYFFAMUCKPIC-WMZOPIPTSA-N 391.540 5.602 30 20 GKED CC(C)(C)[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(F)cc1F 775542512 MTCHAYPTEKCQDA-LJQANCHMSA-N 378.850 5.398 30 20 GKED C[C@H](N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779082369 MPDAJICAAQQDPW-KSFYIVLOSA-N 391.515 5.633 30 20 GKED C=C[C@](C)(CCOC)COC(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 784635403 WQNQAEOBQIOTSC-PNLZDCPESA-N 385.529 5.118 30 20 GKED C[C@@H](OC(=O)CCc1ccccc1NC(=O)OC(C)(C)C)c1cccc(C#N)c1 790749251 GFWVGTBLLPPRRJ-MRXNPFEDSA-N 394.471 5.142 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 791229718 KERXDEQVWJODCV-NXVVXOECSA-N 388.492 5.634 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1ccc(Cl)cc1Cl 795139510 NTNBCHYPABXLED-UHFFFAOYSA-N 397.375 5.546 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 807898563 HHWFOESDYRXIOU-LAUBAEHRSA-N 383.492 5.022 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)c2ccc(C3SCCS3)cc2)cc1 813377302 JIWBUPQQYZUVGO-IBGZPJMESA-N 382.554 5.064 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C2CCN(C(=O)CCCCCC#N)CC2)c1 837847811 WVEVLRIEVKORET-UHFFFAOYSA-N 399.535 5.214 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3ccccc3F)o2)cc1 915087306 RQVGDZZINQHKEP-OAQYLSRUSA-N 396.421 5.993 30 20 GKED Cc1cc(C)cc(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916628308 QVXLZWWFHOEKRO-GOSISDBHSA-N 396.899 5.336 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCOc2ccccc2C)cc1 916949739 PHISUWXYMLFYGE-UTKZUKDTSA-N 392.499 5.015 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2oc3ccc(F)cc3c2C)cc1 916954620 JMAGGFOXQXPMDS-DJJJIMSYSA-N 392.430 5.355 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(SC)ccc2C)cc1 916955470 RBGLIIBEWYBAEI-JLTOFOAXSA-N 380.513 5.192 30 20 GKED Cc1cc(C)cc(C2(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)CC2)c1 917046828 SDTCYPONDPLIMI-INIZCTEOSA-N 380.900 5.475 30 20 GKED COc1cccc(COc2cccc(Cl)c2C=NNCc2ccccc2)c1 917540883 WYBHGKXRSXRETP-UHFFFAOYSA-N 380.875 5.051 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@@H](C)Sc1ccccc1Cl 920104715 XNLDPWREVVSLMK-HIFRSBDPSA-N 396.899 5.202 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccccc3Cl)n2)cc1 920141655 LHZHWKISNQXPSS-KRWDZBQOSA-N 391.883 5.144 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(Cl)nc1Cl 920753844 YFYWFSLLICEQKG-UHFFFAOYSA-N 399.237 5.008 30 20 GKED Cc1cc(Oc2ccc(C=NNc3ccc(C(=O)O)nc3)c(Cl)c2)ccc1F 1776071721 POOJZBFPTFTMMW-UHFFFAOYSA-N 399.809 5.119 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776697901 XYVMAYHAXNSNCH-FPAJZGIOSA-N 378.424 5.549 30 20 GKED CC[C@H](C)n1ncc2c(C(=O)O)cc(/C=C/c3ccc(C(C)(C)C#N)cc3)nc21 1776702139 YNITZXQJGNTUOT-SHQCLWGWSA-N 388.471 5.072 30 20 GKED CCCCCCCCCCNc1c(C(=O)O)cnc2c(OC)cc(OC)cc12 1776787747 KHQRCIOBQANTNM-UHFFFAOYSA-N 388.508 5.503 30 20 GKED CCCCCCCCCCCCCCCC(=O)N[C@@H](CCSC)C(=O)O 16051740 FCVASHHBGGKTGT-IBGZPJMESA-N 387.630 5.790 30 20 GKED in-vitro N#Cc1c(Cl)nsc1NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 111220408 ZKJAMQJZIAWFBP-INIZCTEOSA-N 378.888 5.393 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Oc2ccncc2)c1 112637741 MYMRMOHYFBGBNC-INIZCTEOSA-N 389.480 5.520 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3cccc(C)c3)n2)cc1 124341111 XFKGLLLDSQETEO-BEFAXECRSA-N 376.481 5.107 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 125547830 LFGGALNMIVXWRD-HXUWFJFHSA-N 388.492 5.054 30 20 GKED N#C[C@@H](C(=O)CCOCc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 125660993 MUOIIQKBDSUSGV-SFHVURJKSA-N 396.899 5.247 30 20 GKED CCN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@H](C)c1cc2ccccc2o1 151315006 YSZFXAJHNMBKAC-YLJYHZDGSA-N 375.472 5.570 30 20 GKED C#Cc1cccc(N(C)Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)c1 165451343 ZKYCFZDJGUYCSN-UHFFFAOYSA-N 389.524 5.062 30 20 GKED Cc1csc([C@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C2CC2)n1 174541598 RTMMJEHPJLIUCT-JOCHJYFZSA-N 389.524 5.143 30 20 GKED Cc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c(C)c1O 178788102 FECWOSPBXPCVOP-UHFFFAOYSA-N 388.492 5.425 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)n1 187233081 UNDWNGDFJYJJKZ-LBPRGKRZSA-N 392.358 5.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(COc2ccccc2F)on1 189908136 GBEBQRRKVHBGCU-UHFFFAOYSA-N 394.446 5.497 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCO)[C@@H]1CCc2ccccc21 191444380 LFQJTALTKGXHPP-JOCHJYFZSA-N 378.516 5.052 30 20 GKED OC(=Nc1cccc2ccsc12)N1CCC[C@H](c2ncc(C(F)(F)F)[nH]2)C1 328618826 VKXAYCGUKVGXHZ-LBPRGKRZSA-N 394.422 5.068 30 20 GKED CC(C)(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(F)cc1F 330013409 MCCOJWJMVVMUFM-GSQSYGFSSA-N 392.490 5.934 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c2[C@@H]1C 410976488 ATRCNRSSGLGUOY-GHMZBOCLSA-N 375.444 5.065 30 20 GKED Cc1ccc(C(=O)N[C@H](C#N)c2ccc(OCc3ccccc3)cc2)c(Cl)c1 427387097 NTWSRNMSSCMEOG-JOCHJYFZSA-N 390.870 5.222 30 20 GKED Cc1cscc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 429373187 QMZZUKMTTPUZIC-GFCCVEGCSA-N 393.320 5.977 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1ccc(OC2CCCC2)cc1)c1ccccc1 431319439 RKPXNLZCOHBFSD-HSZRJFAPSA-N 391.515 5.242 30 20 GKED N#C[C@H](C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)c1nc2ccccc2o1 433121339 NIGUOXDURCLFDB-HXUWFJFHSA-N 391.430 5.321 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1cc(C(F)(F)F)ccc1NCc1ccccc1 436172145 MUQHJCQNIUTVKS-UHFFFAOYSA-N 399.372 5.343 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccs1 437475608 CBUBQFCGVXLGQQ-UHFFFAOYSA-N 380.444 5.467 30 20 GKED CSc1ccccc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437487981 VKHJPMOESNUMLS-UHFFFAOYSA-N 378.428 5.464 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1 437669754 SXLJJEOUJYAYBX-UHFFFAOYSA-N 390.251 5.366 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2cc(C#N)cs2)cc1 437695832 DGEUNGHBZJVCNX-OAHLLOKOSA-N 376.481 5.129 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 438065427 MXDXYAWZEYJVAW-NMNUPHIUSA-N 378.516 5.037 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 438986793 RQQNANDPOJKDIK-UHFFFAOYSA-N 378.240 5.142 30 20 GKED CCCc1c(NC(=O)N2CCC[C@H]2c2ccccc2)cnn1-c1cccc(C#N)c1 439682607 MQBBZPAOQLGJTM-QFIPXVFZSA-N 399.498 5.065 30 20 GKED CCOCc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 440439017 BMTLUAPSYMLGLC-UHFFFAOYSA-N 386.451 5.334 30 20 GKED CC[C@H](NCc1nc(-c2ccc(Cl)cc2)c(C)s1)c1ccc(C#N)cc1 447563236 PBSYKBGVSLLLLF-IBGZPJMESA-N 381.932 5.885 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC(c2nc(C(F)(F)F)cs2)CC1 451298136 VMYGAGUHUUCPMA-UHFFFAOYSA-N 393.478 5.343 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1c(F)cccc1F 454779070 ZWEFDCQTMCGGNG-ZDUSSCGKSA-N 375.444 5.023 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)cc1C#N 456117044 QACXGQXNRHEFRT-UHFFFAOYSA-N 380.341 5.146 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1c(F)cccc1F)C1CC1)c1ccccc1 458812187 CLJZNMHAXYRZGP-OAQYLSRUSA-N 383.442 5.074 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(Oc2ccccc2)ccn1 465171315 UDYYRZTUWZORSA-UHFFFAOYSA-N 385.467 5.044 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccnc(Oc2ccc(F)cc2F)c1 468234170 KDSDDYACSUDHON-UHFFFAOYSA-N 386.423 5.042 30 20 GKED CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 470057336 PVAAVNCFEFDVEI-GOSISDBHSA-N 388.389 5.154 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 471240465 KHTCCWQWTHFOAQ-UHFFFAOYSA-N 375.472 5.569 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)c1cc(C(F)(F)F)ccc1F 473262620 XDKAEQUECPMARH-UHFFFAOYSA-N 398.253 5.210 30 20 GKED CCc1c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1C(CC)CC 484139529 GZYQWYFLRKVUSX-OAHLLOKOSA-N 399.564 5.845 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Br)c(F)c1 484765707 GMQUWFBVUSSONH-LBPRGKRZSA-N 379.298 5.595 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCC3)c1-c1ccccc1 489556141 YYEWNYXTVATDPD-UHFFFAOYSA-N 390.512 5.195 30 20 GKED CCSc1ccc([C@H](C)NCc2cc(C#N)ccc2Br)cc1 492586863 ZMNKSCXRNQOBDZ-ZDUSSCGKSA-N 375.335 5.284 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(Cl)c1OCC(F)F)c1ccccc1 497537474 SGTUYQKKEKYKBY-OAHLLOKOSA-N 393.821 5.150 30 20 GKED C=CCN(C(=O)c1cc(C(C)C)nc2ccccc12)c1nc2c(s1)CCCC2 500305240 IYWKNUXOLFWAAN-UHFFFAOYSA-N 391.540 5.526 30 20 GKED C=CCC[C@H](NC(=O)Cc1ccc(OCc2ccccn2)cc1)c1ccccc1 501872337 IHQKNDNJUPZWCZ-DEOSSOPVSA-N 386.495 5.027 30 20 GKED CCOc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)ccc1C 503433463 KWQOBEXYIRVAIE-GOSISDBHSA-N 392.480 5.016 30 20 GKED N#C[C@H](NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl)C1CC1 505961388 XUAKOYAZKKBSRZ-KRWDZBQOSA-N 396.899 5.410 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1/C=C\c1ccccc1 506641498 FKUFEBMLCUYDHZ-HSDOYDEGSA-N 391.540 5.791 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 509607707 IWHLPFBPSZVHAW-JKSUJKDBSA-N 388.389 5.106 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccs2)cc1Cl 510007980 YAPOHDJAHHRLCB-SFHVURJKSA-N 381.888 5.379 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c2ccccc21 511416930 VOQVQDWENNNGDJ-GOSISDBHSA-N 397.478 5.487 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CC)c1ccc(OC)cc1 514571662 FJCKJLBFYAIQES-QGZVFWFLSA-N 378.925 5.259 30 20 GKED CC(C)(C#N)CCCS(=O)(=O)[C@@H](c1ccccc1)c1ccc(Cl)cc1 514681463 XFHMDQZDTYPSHL-IBGZPJMESA-N 375.921 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1nc2ccccc2cc1Cl 516218947 KXQYNUCHRBSBIX-CYBMUJFWSA-N 381.888 5.535 30 20 GKED C=CCOCC(=O)N(Cc1ccccc1)c1nc2c(C(C)C)cccc2s1 517919174 AUVKCROWHXSNMM-UHFFFAOYSA-N 380.513 5.156 30 20 GKED CCC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 520308307 OIXVQFVZGPJYRS-UHFFFAOYSA-N 399.450 5.146 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520603403 GHUCFBCBFGKDDQ-UHFFFAOYSA-N 391.858 5.668 30 20 GKED C[C@H]1CC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 520854528 VPQGEIMCGKQBEI-IRJFHVNHSA-N 377.488 5.032 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 522702583 TWLNLMZCLPXTRL-PXNSSMCTSA-N 381.501 5.146 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@@H](C)S[C@H]1CCCc2ccccc21 523227497 WUFBBGXDFXFXSS-VGSWGCGISA-N 394.540 5.141 30 20 GKED C=CCN(C(=O)c1cnc2ccsc2c1)c1nc(-c2ccccc2)cs1 525117822 BGWREISTQPDQPN-UHFFFAOYSA-N 377.494 5.253 30 20 GKED C[C@@H](c1ccc(F)cc1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 530928685 PPYAOMUMOCIBSM-INIZCTEOSA-N 379.456 5.040 30 20 GKED CN(C(=O)CSc1ccc(C#N)cc1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 532341442 UACRREOVPQQKQS-QGZVFWFLSA-N 398.837 5.066 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)c3ccc(CC#N)cc3)cc2c1 535393961 DSLLAKUUKHJLCN-UHFFFAOYSA-N 384.435 5.243 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1csc(-c2cccc3ccccc23)n1 537575542 YJKTUTFOLQZMGC-UHFFFAOYSA-N 383.476 5.107 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H](c2ccccc2)[C@@H]2CCOC2)c1 537865413 ZUSMKDILVLJDID-RSXGOPAZSA-N 398.506 5.005 30 20 GKED CCN(C(=O)c1ccc(-c2ccsc2)nc1C)c1ccc(C#N)c(Cl)c1 539173998 VTVKITMGRBPJKX-UHFFFAOYSA-N 381.888 5.310 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@H](CCc3ccccc3)c3ccccc3)o2)c1 540376701 RMBFQEVRIDGBJF-HSZRJFAPSA-N 394.478 5.072 30 20 GKED CC(C)(C)[C@H](NC(=O)N1CCC(CC#N)CC1)c1cccc(C(F)(F)F)c1 543823455 QUWSBKSQSKGQFZ-QGZVFWFLSA-N 381.442 5.128 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 544741286 UELZRIKDQPSJIF-SFHVURJKSA-N 394.540 5.629 30 20 GKED Cc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@@H](CCCC#N)c1ccccc1 556202227 KMORMGVMBRQSPE-PXNSSMCTSA-N 383.923 5.390 30 20 GKED C[C@@](C#N)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CCCCC1 559595395 ZOQBUSCAXHORPI-DEOSSOPVSA-N 387.483 5.137 30 20 GKED CC[C@@H](NCc1ccc(Br)cc1C#N)c1ccccc1OC(F)F 561855006 GDWUTRRHIKTFFJ-MRXNPFEDSA-N 395.247 5.163 30 20 GKED CC1(C)CCCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)[C@@H]1C#N 570034484 QLCPQRQDSNIMDP-HXUWFJFHSA-N 381.907 5.106 30 20 GKED C[C@@H](CCNC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1 573372001 SYRHVTGALOLOGE-KRWDZBQOSA-N 386.455 5.061 30 20 GKED CCC[C@@H](CC1CCCC1)C(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1 574933745 HTLWLOZJRUZPGA-IBGZPJMESA-N 386.511 5.064 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc2sccc2c1 576195802 TVQBVXGSCRMVAV-CQSZACIVSA-N 381.526 5.475 30 20 GKED CN(C(=O)c1c(Cl)cc(C#N)cc1Cl)[C@H]1CC[C@@H](C(F)(F)F)CC1 589950008 AKTADBRCFSGHMK-PHIMTYICSA-N 379.209 5.058 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3sccc3OC(F)F)n2)cc1 591861831 FQPKAJXMRAXAPB-LBPRGKRZSA-N 390.436 5.272 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 596691894 QGTOVVHHJYEYJV-ZVDOUQERSA-N 391.902 5.710 30 20 GKED N#CC1(CC(=O)N(c2ccccc2)c2ncccc2Br)CCCCC1 598822496 WLJVOMUTBVRFQA-UHFFFAOYSA-N 398.304 5.373 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)o1 603624272 YDIVIRLUZNIIMB-QRWLVFNGSA-N 387.439 5.033 30 20 GKED CSc1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 604003639 JUCBMDRDQVCWOR-UHFFFAOYSA-N 388.492 5.306 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1F)c1ccccc1C(F)(F)F 607822832 URRWNIFYOKCXEX-VIFPVBQESA-N 379.275 5.606 30 20 GKED CSc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 609062119 YLJQLKNLYUWMLA-UHFFFAOYSA-N 388.492 5.420 30 20 GKED CCCN(C(=O)c1sc(-c2ccc(C)o2)nc1C)c1cc(Cl)ccc1C#N 609286473 XHTFIYVEGZAEBS-UHFFFAOYSA-N 399.903 5.602 30 20 GKED N#C[C@H](NC(=O)CC/C=C\c1ccccc1)c1ccc(OCc2ccccc2)cc1 609988392 ZNWTZPDBFVAEAV-DIWMZYGOSA-N 396.490 5.440 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cc2ccccc2n1CC#N 610471900 IQCFCIPPDGILJV-HZPDHXFCSA-N 379.891 5.082 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)C1 612243345 RRUJBGBJDILTRH-DEOSSOPVSA-N 389.474 5.059 30 20 GKED COC1CCC(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 614815026 SBASRZZTBFMHAK-UHFFFAOYSA-N 384.863 5.148 30 20 GKED O=C(Nc1cccc(Cl)c1F)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618538931 QWRBYKIBUBYJCZ-OCAPTIKFSA-N 392.702 5.074 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccccc2F)n1C1CC1)c1ccc(Cl)cc1 619863421 AQAHYPOMAYIHKV-QGZVFWFLSA-N 384.867 5.429 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)oc2ccc(F)cc12 642281800 REZXYQSIMWUCIC-INIZCTEOSA-N 376.412 5.494 30 20 GKED N#CC1(CC(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)CC1 645953040 JWKUPCBXGDCUIR-UHFFFAOYSA-N 389.505 5.301 30 20 GKED O=C(NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1c(F)cc(C(F)(F)F)cc1F 685778743 TZJCGHPBPFFFHC-RKDXNWHRSA-N 389.286 5.082 30 20 GKED N#C[C@H](C(=O)[C@@H](OC1CCCC1)c1ccccc1)c1nc2ccccc2s1 727039225 UWRMTORMSZHMFN-UTKZUKDTSA-N 376.481 5.173 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2Cl)C(C)C)c1 734529965 CDGITUYTQYFAQG-DYESRHJHSA-N 399.922 5.217 30 20 GKED C=CCCO[C@@H](C)C(=O)O[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 734731109 XLMFLRJVIWAWNW-KBPBESRZSA-N 379.909 5.357 30 20 GKED C=C(C)COc1cccc(NC(=S)Nc2ccc(OC(F)F)c(Cl)c2)c1 735628536 QIZPAMXIQGYGIW-UHFFFAOYSA-N 398.862 5.705 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 739142987 NBXLYTDLPNLXSA-RDTXWAMCSA-N 382.385 5.624 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(C)cc1 739155707 SWZUNJYFSKGHCO-GCJKJVERSA-N 384.479 5.380 30 20 GKED CC(=NNc1cc(Cl)nc(C)n1)c1sc(-c2ccc(Cl)cc2)nc1C 741763886 JFZWVJBIGAZRAC-UHFFFAOYSA-N 392.315 5.360 30 20 GKED Cc1c(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cnn1-c1ccc(C#N)cc1 741852006 HQEAVOJYWNSEGA-QXMHVHEDSA-N 396.475 5.072 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1-c1ccccc1 744037198 PKOQLXXNNDUKHP-SFHVURJKSA-N 383.476 5.306 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C=C(\C)c1cccc(Cl)c1 750684305 PVPXRMUPIGVHBC-IURSYISVSA-N 394.902 5.216 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1)c1nc2ccccc2o1 750687930 CEWXAJGWPJCOBJ-ZDUSSCGKSA-N 385.250 5.433 30 20 GKED O=[N+]([O-])c1cc(C=NOc2ccccc2C(F)(F)F)ccc1N1CCCCC1 754725285 SJBXQNDUGHGDIQ-UHFFFAOYSA-N 393.365 5.017 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2csc(Cl)c2Cl)S1 761392528 NJSYQLLFOCABKG-IZZDOVSWSA-N 383.325 5.563 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2sc(-c3ccccc3)nc2C(F)F)c1 761668973 HPUBVMAISJHMNL-UHFFFAOYSA-N 382.435 5.396 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2o1)c1cccc(C(=O)c2ccccc2)c1 762040465 PWPPSEBSORZJGY-JXFKEZNVSA-N 394.430 5.039 30 20 GKED CC(C)(C)c1nnc(S)n1N=Cc1ccc(SCc2ccccc2)cc1 771871518 NAMRNJTXGTWTLN-UHFFFAOYSA-N 382.558 5.039 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2sccc2C#N)cc1 772019193 BBSUYTHTHCMFFM-UHFFFAOYSA-N 375.457 5.353 30 20 GKED C[C@H](NC(=O)c1cc(Cl)ncc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 781011239 GAHDMRXGFBVGQB-ZDUSSCGKSA-N 396.277 5.418 30 20 GKED N#C[C@H](C(=O)CCCCC(=O)c1ccccc1)c1nc2cc(Cl)ccc2s1 783357642 JNYQOUFPSFBZCW-MRXNPFEDSA-N 396.899 5.569 30 20 GKED Cc1sc2ncn(N=Cc3ccsc3Cl)c(=O)c2c1-c1ccccc1 790148798 NARZCIZYZMLLMJ-UHFFFAOYSA-N 385.901 5.031 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc3c4c(cccc24)CC3)cn1 792870252 PNBQAGCCRIQHSV-ZROIWOOFSA-N 392.458 5.300 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1ccc(CCCC)cc1 795138246 CSNDUYKZCGBEHE-UHFFFAOYSA-N 384.593 5.582 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(C(C)(C)C#N)cc1 796041251 PPRXTNJPHIDUPU-SJORKVTESA-N 392.499 5.185 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCCOC(C)(C)C 796355136 CROHNJPRHTVMKP-UHFFFAOYSA-N 382.479 5.134 30 20 GKED N#Cc1ccc(CNc2ccc(OCC(F)(F)F)c(F)c2)c(C(F)(F)F)c1 810156001 OTSZYQAAMVGCCW-UHFFFAOYSA-N 392.274 5.269 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1cnn(-c2ccccn2)c1C 811691533 NVLMPYCXKAGWAG-JXIMYUQQSA-N 395.409 5.020 30 20 GKED C=CCC(F)(F)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 814817986 ACJAHIAHUDGKLD-UHFFFAOYSA-N 383.341 5.114 30 20 GKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1O 815636247 RPNLBWGFCKOCSZ-RTBURBONSA-N 377.315 6.175 30 20 GKED C=CCc1cc(OCC)ccc1OC(=O)CCc1ncc(-c2ccccc2F)o1 822043612 SZVSUDRJNXJHAX-UHFFFAOYSA-N 395.430 5.146 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(C4CC4)c3)n2)cc1 842296527 YOVCVKXFVUJPSV-HXUWFJFHSA-N 388.492 5.115 30 20 GKED CCOc1ccc(/C=N\C2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(O)c1 914702557 ITMPWVLSRQPBCU-UPAHXGKCSA-N 383.332 5.119 30 20 GKED COc1cc([C@@H](C)Nc2snc(Cl)c2C#N)ccc1OCc1ccccc1 917088668 FMIDFNLNTIPXLH-CYBMUJFWSA-N 399.903 5.429 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776120129 WPACGXMJGJKYKI-YVLHZVERSA-N 384.475 6.245 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NC[C@@H](C)Cc1ccc(C(C)(C)C)cc1 1776782344 KASSSDOMPRWUND-UGKGYDQZSA-N 375.597 5.956 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)c2c[nH]c3ccccc23)c1 1776787897 CIZAVHAVZSNIDK-QHCPKHFHSA-N 394.515 5.433 30 20 GKED Cc1nc(NC(=O)CC(c2ccccc2)c2ccccc2)sc1SCC#N 44789553 FYELECZGONQJNY-UHFFFAOYSA-N 393.537 5.228 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 48161552 RTHPLYJAZIBBCQ-LJQANCHMSA-N 399.494 5.257 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)oc2c1C(=O)CCC2 55430059 JJYKDXLRVWTZME-UHFFFAOYSA-N 386.407 5.023 30 20 GKED N#CC1CCN(C(=O)c2cc(-c3cccc4ccccc34)nc3ccccc23)CC1 61637324 CAIMWSVXQXYKCP-UHFFFAOYSA-N 391.474 5.431 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1cnn(C(C)(C)C)c1 62410799 CXCJKVVDIPZSIX-UHFFFAOYSA-N 389.459 5.255 30 20 GKED COc1cc(C(=O)/C=C/c2cnn(-c3ccccc3)c2)ccc1SC(F)F 63874703 QQPWDMUNMCTUNX-VQHVLOKHSA-N 386.423 5.092 30 20 GKED O=C1CCc2cc(C(=O)/C=C/c3ccc(-c4ccccc4Cl)o3)ccc2N1 72067736 HZVNPCQGIUSCNM-JXMROGBWSA-N 377.827 5.381 30 20 GKED N#CCCCCSc1nnc(COc2ccccc2Cl)n1-c1ccccc1 121712132 SHHJIWPWRFRBIJ-UHFFFAOYSA-N 398.919 5.286 30 20 GKED CC(=O)CCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 123687980 QBUDRBPDJLNVJE-QGZVFWFLSA-N 388.920 5.569 30 20 GKED CC(C)c1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128864751 YPMAEAZJHBBJLC-IBGZPJMESA-N 375.497 5.138 30 20 GKED CCC(=O)Nc1ccc(C)c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 156222882 GBBZTKCHIRBPQV-UHFFFAOYSA-N 398.466 5.211 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3nccn3CC(F)(F)F)s2)cc1 171541979 NXRSWCKQLBPSNE-BQYQJAHWSA-N 391.418 5.082 30 20 GKED COc1ccc([C@@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)cc1 172915664 ZJHPNRANNYISEY-HSZRJFAPSA-N 392.886 5.130 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(Cl)c2Oc2cccnc2)c1 175683279 JSPLCLKNOQCFPR-UHFFFAOYSA-N 395.871 5.395 30 20 GKED C=C[C@@H](CC(=O)N1CCC(n2c(CC)nc3ccccc32)CC1)c1ccccc1 180129701 QDXUAUPVLASZMS-IBGZPJMESA-N 387.527 5.122 30 20 GKED COc1cc(CNc2ccccc2O[C@@H](C)C#N)ccc1OCc1cccs1 181130818 ZNMUFTRJKFBETJ-INIZCTEOSA-N 394.496 5.239 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)c(Sc2ccccc2)c1 181315391 CFSSJXCIQUUWPM-QGZVFWFLSA-N 388.492 5.689 30 20 GKED N#CC1(c2ccc(C(=O)N3CCc4sccc4[C@H]3c3cccs3)cc2)CC1 182586795 FJNOICWVDPOQNR-FQEVSTJZSA-N 390.533 5.153 30 20 GKED CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C1 247309284 JPVGIJGXUXXFNV-OWCLPIDISA-N 377.579 5.124 30 20 GKED C[C@H](/N=C(/O)[C@H]1CCC(=O)N(C2CC2)[C@@H]1c1ccncc1)[C@@H](C)C1CCCCC1 328951993 HWMHPTMSIWPVHT-QMKZIPLGSA-N 397.563 5.085 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2/C(O)=N/[C@H](C)c2nc(C3CCCCC3)no2)cc1 329768859 HCUMXEBBTJWTPL-UXPWSPDFSA-N 397.519 5.611 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1cccc(C(F)F)c1 425092089 YYQQKEUOERBEEL-GFCCVEGCSA-N 382.332 5.197 30 20 GKED Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)c(OCC(F)(F)F)c1 429864036 XXODFKDSIBWELA-UHFFFAOYSA-N 395.274 5.346 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 431775927 LAGIMYYKTPDUAY-BEFAXECRSA-N 387.430 5.083 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cc2cccc(F)c2o1 431920894 HTOUWJJFTQQKSD-HNAYVOBHSA-N 379.435 5.367 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(F)c(Cl)cc1Cl 436341811 PCGINNDVXGYTLR-KDOFPFPSSA-N 377.246 5.044 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccncc2Oc2ccccc2)s1 442542583 KDMZSFHIAAADTM-INIZCTEOSA-N 377.469 5.118 30 20 GKED N#Cc1nc(Sc2nnc(-c3ccc4ccccc4c3)o2)ccc1C(F)(F)F 443519022 MVQXYNIFWZKIKX-UHFFFAOYSA-N 398.369 5.326 30 20 GKED C[C@H](NCc1nc(-c2ccccc2F)no1)c1ccc(-c2cccc(C#N)c2)cc1 444619123 VUOYBSYVWPGXGG-INIZCTEOSA-N 398.441 5.265 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 445007960 PBKLRMBSHXJGJF-QGZVFWFLSA-N 394.478 5.898 30 20 GKED CC[C@H](C)[C@@H](NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 446281386 MIPATUABHAFFCZ-ZWKOPEQDSA-N 388.327 5.095 30 20 GKED CCCCn1ncc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1C 448426001 QYTAMWMUUDDFLR-UHFFFAOYSA-N 388.471 5.216 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c(C)c1 458855414 YAVYDELWABIFEC-JTHBVZDNSA-N 375.516 5.238 30 20 GKED C=CCN(C(=O)CCCC#N)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 463100322 YFMNCBZXINJGMF-UHFFFAOYSA-N 387.508 5.690 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F)C(F)(F)F 464068780 FKUFPZFNDCKOGJ-ZCFIWIBFSA-N 381.288 5.200 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 466523705 AIAMQPTZKGEQKG-CQSZACIVSA-N 381.863 5.616 30 20 GKED C=CCC[C@@H](NC(=O)Nc1c(C)noc1C1CC1)c1ccc(C(F)(F)F)cc1 466892317 YCESUMBUJUDHGO-MRXNPFEDSA-N 393.409 5.708 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H](CC(C)C)C1 467620395 XWVROJFKXKXNBA-LJQANCHMSA-N 377.488 5.559 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OC2CCOCC2)c(C)c1 467899348 GKPVLPZLSUEOEZ-UHFFFAOYSA-N 394.515 5.163 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471247994 ALCBTSWSSFHDOL-VIFPVBQESA-N 394.258 5.907 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(OCCCOC)c1 475573281 RMKPWAUKHAPHDZ-UHFFFAOYSA-N 382.504 5.598 30 20 GKED Cc1ccccc1CN(Cc1ccccn1)C(=O)c1ccc(C(C)(C)C#N)cc1 475595129 ISUQKEKCKDORKG-UHFFFAOYSA-N 383.495 5.034 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)C[C@H](CC#N)c2ccccc2)cc1 476120203 KJMBZCJFRIGETE-XXBNENTESA-N 398.506 5.627 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 476148988 NBWCSFSVRIFXEW-PMACEKPBSA-N 387.445 6.300 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CC=C(c2cccc(Cl)c2)CC1 478915376 JWIVTIOKHMPSBX-UHFFFAOYSA-N 382.895 5.089 30 20 GKED CN(Cc1ccco1)Cc1ccccc1CN[C@H]1CCCCc2cc(C#N)ccc21 481665277 ZUPPBHKLHOGYBJ-SANMLTNESA-N 399.538 5.341 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)C[C@H](c1ccccc1)C(F)(F)F 482464140 OQJXSESJLXRXOZ-LJQANCHMSA-N 398.384 5.421 30 20 GKED CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)[C@H](C#N)c1nccc2ccccc12 483242056 JXFKSALUIKVDQE-HXUWFJFHSA-N 394.478 5.208 30 20 GKED C=CCC[C@@H](C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1 488991430 ZNJHSCCVHNDHQK-GBXCKJPGSA-N 376.544 5.078 30 20 GKED Cc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)c(Br)c1 503044727 JKBCQTNYOFPQCL-UHFFFAOYSA-N 395.304 5.147 30 20 GKED CC[C@@](C)(C#N)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 505163772 IBHDZPUQPJBQOC-VGSWGCGISA-N 379.891 5.009 30 20 GKED Cc1ccc(Br)c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1 505332378 WHRYYXIXZTXULL-CQSZACIVSA-N 398.087 5.059 30 20 GKED CN1CCC[C@H](CNC2CCC(C#N)(c3ccccc3)CC2)[C@H]1c1cccs1 507651983 VNYOBVSPPMRCCC-BXDDPRONSA-N 393.600 5.125 30 20 GKED C[C@H](NCc1ccc(-c2cnn(C)c2)s1)c1ccc(-c2cccc(C#N)c2)cc1 509469835 JTPLPJDIEIPDTG-KRWDZBQOSA-N 398.535 5.538 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[C@@H]1CCc2ccccc2C1 510763335 MZHRRADIRWXNBP-HSZRJFAPSA-N 396.490 5.174 30 20 GKED CCN(C(=O)c1cc(C#N)ccc1Cl)[C@H](c1ccc(C)cc1)c1cccnc1 512334151 MOKDUTGXYZOVQM-JOCHJYFZSA-N 389.886 5.167 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1C 513333769 QAXLKQOGDLPEEA-HSZRJFAPSA-N 392.478 5.610 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(OCC(C)C)c1 513529832 BQABYSQZSDIYPE-UHFFFAOYSA-N 384.524 5.109 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@H]3c3cccs3)s2)cc1 514502954 OSGRWNKNZLKQAM-KRWDZBQOSA-N 394.525 5.036 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3csc4ccccc34)n2)cc1 517800857 LXPXJXKFOHDHDJ-MRXNPFEDSA-N 390.489 5.523 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccccc1Cl 518141547 WBJWGRYNQGPFDT-HNNXBMFYSA-N 388.920 5.389 30 20 GKED CCc1ccc(CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1 518165730 QGNCJMGORRCDBC-QGZVFWFLSA-N 393.556 5.697 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OC2CCCC2)c1 518740194 NRPUMXPZRJLBAV-MRXNPFEDSA-N 380.513 5.655 30 20 GKED CC(C)c1ccc(OCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518740197 OEKRVEHIAZTNHY-KRWDZBQOSA-N 382.529 5.612 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)cc2)c1 519507444 YKKBBZPLKIMUKH-MOPGFXCFSA-N 388.389 5.658 30 20 GKED CCC(C)(C)OCc1ccccc1NCc1cn(C)nc1-c1ccc(C#N)cc1 519568106 MVEMOCGBQLIJHO-UHFFFAOYSA-N 388.515 5.276 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1 520323573 LMKITEHCWNOXSR-UHFFFAOYSA-N 397.689 5.706 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3cccc4cccnc34)cc2)c1 521810988 NDEFOEBBOJDUDF-UHFFFAOYSA-N 394.434 5.220 30 20 GKED CC(C)CN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CCCC1 524492717 GNLOCOWZSGKJPC-UHFFFAOYSA-N 376.500 5.178 30 20 GKED CC(C)=CCSc1ccccc1C(=O)Nc1cccc(OCCCC#N)c1 524964518 LVJMDKSTRULFME-UHFFFAOYSA-N 380.513 5.680 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1-c1ccccc1 524987826 OHOOBIQYSLCCSX-HNNXBMFYSA-N 376.456 5.484 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2sc3ncccc3c2Cl)s1 529011215 WLGKCPVFGBVGOW-SNVBAGLBSA-N 375.906 5.194 30 20 GKED N#CC1(NC(=O)c2sc3ccccc3c2CSc2ccccc2Cl)CC1 535322622 SKQXYIIDFPBMQW-UHFFFAOYSA-N 398.940 5.633 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1csc(-c2cccc3ccccc23)n1 538655967 YDGWXUKJBJIKSX-UHFFFAOYSA-N 376.403 5.154 30 20 GKED C=CCN(C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C1CC1 539016935 VINFKAVLJQKPRN-CYBMUJFWSA-N 375.925 5.193 30 20 GKED C[C@H](NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1cccc(C#N)c1 540596566 FTVHMVSJIOQOSL-FQEVSTJZSA-N 392.506 5.321 30 20 GKED Cc1oc(-c2ccsc2)nc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542013941 QISNNWGQADDJLJ-MRXNPFEDSA-N 399.519 6.101 30 20 GKED C=C(C)COc1cc(CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1OC 542709911 LIHYPDBVFAEGDV-JTHBVZDNSA-N 399.506 5.141 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)Nc1ccc(C#N)c(F)c1 554994727 OROFWJCFLWAVRP-UHFFFAOYSA-N 395.459 5.002 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1oc2ccccc2c1COc1ccccc1 557060815 AAQJWMZVRBZTJI-UHFFFAOYSA-N 397.434 5.177 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(OC(F)F)c(OC)c1 558640171 LVNKOXMLEXTBEN-UHFFFAOYSA-N 390.430 5.079 30 20 GKED Cc1ccc(-n2cc(CN3CCC(C)(C#N)CC3)c(-c3ccc(F)cc3)n2)cc1 570809742 JNYMLSOJUHREEZ-UHFFFAOYSA-N 388.490 5.113 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N2Cc3cccc(C#N)c3C2)c1C 593168244 ZCKIHCFTGJMHTP-UHFFFAOYSA-N 377.488 5.120 30 20 GKED CC(C)CN(C(=O)c1cnc(-c2ccccc2Cl)s1)c1ccc(C#N)cc1 604517399 PRFLHYYSBNQYMR-UHFFFAOYSA-N 395.915 5.638 30 20 GKED N#CCn1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc2ccccc21 609176451 LGPAGKHXOKJDQE-UHFFFAOYSA-N 392.418 5.081 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609176515 KPDHGKVWHHYWJE-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(-c3cnco3)c2)cc1 609298360 OLPUDESGWQPTFO-UHFFFAOYSA-N 399.381 5.397 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@@H]2C2CCC2)c1 609731431 PIUDBMAYCACOJJ-HXUWFJFHSA-N 380.875 5.409 30 20 GKED COc1ccccc1Oc1ccc(Nc2c(C#N)nnc3ccccc23)cc1F 610129680 BEXSKZANZUDIQN-UHFFFAOYSA-N 386.386 5.185 30 20 GKED CC[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 610141258 NTXOGOVKDQKIAF-WIYYLYMNSA-N 391.515 5.422 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 610225652 VIBUALKXTMPFJZ-HOTGVXAUSA-N 375.255 5.006 30 20 GKED Cc1cc(F)cc2c(N(C)C[C@H]3CCCO[C@@H]3c3ccccc3)c(C#N)cnc12 610275067 ZKQGOJGNIVOTBD-HOYKHHGWSA-N 389.474 5.158 30 20 GKED N#CCCCOc1cccc(CNc2cc(F)ccc2SCC(F)F)c1 610911111 YUTIOGSTYKGOEE-UHFFFAOYSA-N 380.435 5.478 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)c1cc2ccccc2n1CC#N 611870878 GIDGNLGOWDVQBL-UHFFFAOYSA-N 394.478 5.338 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1OCC 613291226 WOABKNIYZYRPGA-LJQANCHMSA-N 388.467 5.302 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1C[C@@H]1c1ccc(F)cc1 619126576 ZEHHFAKUVKPCTO-ZIAGYGMSSA-N 385.323 5.099 30 20 GKED N#C[C@@H](Sc1nnc(Cc2cccs2)n1C1CC1)c1ccc(Cl)cc1 619863721 LDENYADOICYRRQ-MRXNPFEDSA-N 386.933 5.276 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc4ccccc4o3)c3ccccc3n2)o1 642282183 RMYDJZVBMUQCKT-KRWDZBQOSA-N 393.402 5.435 30 20 GKED Cc1ccc(F)cc1NC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 642398890 FPHBKJYSWGCVCZ-NXEZZACHSA-N 386.311 5.165 30 20 GKED CCCn1cc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cn1 647229595 BNEKQLSATYDNKE-UHFFFAOYSA-N 383.311 5.195 30 20 GKED N#C[C@H](C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccc2ccccc2n1 675131103 XNYMINPLLJYHFM-FQEVSTJZSA-N 383.838 5.440 30 20 GKED CC(=O)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 679979290 NMDOUXRENPXHCM-CQSZACIVSA-N 388.370 5.008 30 20 GKED CC(C)[C@H](C)N1Cc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2C1 726493891 FVJCUDQNZCFISH-AWEZNQCLSA-N 398.963 5.381 30 20 GKED C[C@@H](C#N)Oc1ccc(C=NNc2ncnc3sc(-c4ccccc4)cc23)cc1 727683314 FZRVDXNQWLGNMM-HNNXBMFYSA-N 399.479 5.095 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)Nc1ccccc1Cl)C12CC3CC(CC(C3)C1)C2 733678703 GNPUFBZUBPJTIL-RHKMNUQISA-N 396.918 5.150 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccsc1 739155626 JPSGJFFNYGNVHA-CABZTGNLSA-N 380.416 5.357 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccc2c(c1)COC2 742435919 BQHDXLZMXFOEDD-VQHVLOKHSA-N 377.421 5.250 30 20 GKED C/C(=C\C(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccc(C(F)(F)F)c1 742628985 AYLCWBBTIOSAOO-YRNVUSSQSA-N 396.315 5.220 30 20 GKED Cc1ccc(-c2cnc(CSCc3cc(Cl)ccc3OCC#N)o2)cc1 742970932 LPWDYWNWBVTUAT-UHFFFAOYSA-N 384.888 5.639 30 20 GKED C[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)c1csc2ccccc12 743475152 NYSQOXZBFJHTBN-JKSUJKDBSA-N 395.503 5.026 30 20 GKED C=C(C)COc1cc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OC 747063304 GPRSHVMGINERCT-OVCLIPMQSA-N 399.834 5.172 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)N1CCC[C@H]1c1nc2ccccc2n1C(C)C 758296187 KPPMNKQHKXOCKZ-SFTDATJTSA-N 398.551 5.252 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12 759213686 GPWODGPCCWIFJZ-TXUZILRVSA-N 388.854 5.244 30 20 GKED COc1cc(C=NOCc2cc3ccccc3nc2Cl)cc(Cl)c1OC 760415821 FGBPHRGTQFULJB-UHFFFAOYSA-N 391.254 5.110 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)c2ccccc12 765142760 QIQSSIPXXXUMTH-AWEZNQCLSA-N 379.847 5.278 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCc3ccc(F)cc3C2)cc1 771462711 LLLLFHAZARLTDT-QHCPKHFHSA-N 385.442 5.071 30 20 GKED C=CCc1cc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1OC 772946386 MNGGFTVQTQHYBK-INIZCTEOSA-N 394.540 5.407 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(-c3cccs3)cc2)c1 772985597 SXPWTLXCUWFNBT-UTKZUKDTSA-N 376.525 5.947 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccc(N(C)C)cc1 775361752 FPWSFOBSPWVQSU-LJQANCHMSA-N 385.511 5.054 30 20 GKED C#CCOc1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 776094997 NYHVZXMJRJZEAS-GOSISDBHSA-N 388.389 5.086 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)nn1[C@@H](C)C1CC1 776813807 NMLILTJSJQZRDS-JTSKRJEESA-N 384.483 5.070 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 776818569 BLFYWGYNMBJLFU-JOCHJYFZSA-N 399.881 5.243 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2ccc(OCc3cccc(F)c3)cc2)cc1 797095724 ZCFZRHSGWTYSOD-MLPAPPSSSA-N 387.410 5.203 30 20 GKED N#CCOc1cccc(NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)c1 799559793 PTCAOHMUCVHWBN-UHFFFAOYSA-N 386.238 5.143 30 20 GKED O=C(/C=C/c1cnn(CC(F)F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 814188920 XZGVFPBDTIUTRJ-OWOJBTEDSA-N 398.253 5.082 30 20 GKED CCC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cccc(N)c1 814765619 MZUXCACEGFANLG-UHFFFAOYSA-N 391.475 5.306 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1 819440582 TURFCBKXQURJTK-CXAGYDPISA-N 396.434 5.125 30 20 GKED N#C[C@H](C(=O)CC[C@H]1CC1(Cl)Cl)c1nc(-c2ccc(Cl)cc2)cs1 850763257 XMBYBDVGOGYMEK-WCQYABFASA-N 399.730 5.614 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCc1cn(C(F)F)c2ccccc12 858896283 VIKAMRMBAZMYHQ-UHFFFAOYSA-N 396.441 5.030 30 20 GKED O=C(Nc1cccc(C/N=C/c2cc(Cl)cc(Cl)c2O)c1)C1CCC1 914599358 FLFWMYCYIUWTQB-SSDVNMTOSA-N 377.271 5.057 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1 915352849 KGMSFZLLOFGNLG-BJKOFHAPSA-N 399.469 5.850 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)c(-c2ccccc2)n1 916137281 YEHMCSOOXMMMEO-NTMALXAHSA-N 396.277 5.667 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccccc2OC(F)F)ccc1OC(F)F 916140216 GJCRGUODKJLALJ-CLFYSBASSA-N 384.325 5.184 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 916847661 ODNCEIKKJVCYJS-GOSISDBHSA-N 390.508 5.478 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916997296 UZUXOACOFBGPLG-YXMGTMDOSA-N 399.302 6.007 30 20 GKED CCC(=NNc1ccc(C(=O)O)cc1)[C@@H](C)c1cccc(Br)c1 1776014238 NOGWLKIBYUOYIR-LBPRGKRZSA-N 375.266 5.129 30 20 GKED O=C(O)c1cc2c(C=NNc3nc(-c4ccccc4)cs3)c(F)ccc2s1 1776022315 GQPHYZKAPYEIRQ-UHFFFAOYSA-N 397.456 5.308 30 20 GKED CC(C)=CCOc1ccc(CCC(C)=NNc2ccc(C(=O)O)c(F)c2)cc1 1776073646 FSSHNCFCOVHZBS-UHFFFAOYSA-N 384.451 5.290 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)c2c(c1)C(C)(C)CC2 1776269194 CXUFEGQSLPJUDV-CLFYSBASSA-N 394.486 5.941 30 20 GKED CC(/C=C\C(=O)c1ccc(OCCCC(=O)O)cc1)=C\c1cc(F)cc(F)c1 1776398802 IDDGJOGJYKSXCP-MBSYDRGCSA-N 386.394 5.051 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC(F)(F)F)cc1F 1776783895 ITEBONQJNVDSDN-AWEZNQCLSA-N 379.394 5.018 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3cccc(C(=O)O)c3)s1)CC2 1777371111 MDZHBYVUVWDCNW-VBKFSLOCSA-N 390.460 5.334 30 20 GKED CSc1ccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)cc1Cl 1777403382 GHOHVQONSQPVFH-ONNFQVAWSA-N 390.888 5.202 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3C3CC3)cc2)CCC1 1786054788 KDMHDPJCQYMOOI-LEWJYISDSA-N 394.559 5.159 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccc(O)cc2)cs1 54895035 BZVSSMQYFQKMSY-IZZDOVSWSA-N 398.871 5.083 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1COc1ccccc1 63393106 FYUIFXJGIROIPH-UHFFFAOYSA-N 397.478 5.357 30 20 GKED COc1ccccc1C(C)(C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 66956137 SHLYWIKVQLVKRC-HNNXBMFYSA-N 383.517 5.146 30 20 GKED C=CCN(CC1CCCCC1)C(=O)CCc1nnc(-c2cc3ccccc3o2)o1 112184068 DSPWJEBTHPCAFC-UHFFFAOYSA-N 393.487 5.010 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C/c2csc(-c3cccs3)n2)S1 112530237 KRLZSOPISKLNCP-DHDCSXOGSA-N 397.550 5.380 30 20 GKED N#CCC[C@@H](NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccccc1 153119654 RJJQLXDQYIGXPO-LJQANCHMSA-N 393.874 5.089 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)o1 153969219 CTUGONUCFUEMCG-VQIMIIECSA-N 397.544 5.989 30 20 GKED CC(C)c1nccn1Cc1cccc(NCc2cccc(OCCCC#N)c2)c1 156748012 GQWUMJCIPOMKPM-UHFFFAOYSA-N 388.515 5.349 30 20 GKED CCS[C@H](C)c1noc(CNc2cccc(Oc3ccc(C#N)cc3)c2)n1 157743811 LLSDGZXJRWIOOL-CQSZACIVSA-N 380.473 5.160 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171742950 DVXCECLHZIMUSH-MRXNPFEDSA-N 390.512 5.007 30 20 GKED C[C@H](C#N)CNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 171839599 HAVZDHGXIMTQEI-CYBMUJFWSA-N 384.888 5.268 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1cccc(SCC#N)c1)c1ccccc1 175975716 NVBINWSLPJFIAA-KRWDZBQOSA-N 388.492 5.695 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 184019491 VRUISEQHCLXUTI-CABCVRRESA-N 380.473 5.016 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1cccc(Cl)c1Cl 194068903 ZOOVEUMEXUWRQN-LBPRGKRZSA-N 379.312 5.426 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccncc1 293265823 JASDXDGDWOJLLN-DNVCBOLYSA-N 380.517 5.091 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N(Cc2cccs2)C2CC2)c1 303538857 HKYJZOSDBYMMON-UHFFFAOYSA-N 388.492 5.004 30 20 GKED C[C@@H]1C[C@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329266335 CSFMNGVQBNAXFQ-LVCJIZJGSA-N 381.520 5.410 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)c1 409779503 KXVORQCHGYABTA-QZTJIDSGSA-N 378.378 5.055 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)s1 430613609 XAYVYCFPRVBNIE-ZDUSSCGKSA-N 385.489 5.136 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(Oc2ccccn2)c1 438662312 WYNGOZUDNIGNQM-UHFFFAOYSA-N 377.419 5.233 30 20 GKED CCc1cc(Br)ccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439485649 KTAMDCHGVANSPA-KRWDZBQOSA-N 386.293 5.178 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1cccc(OC(F)(F)F)c1 441421596 IKLINXWOAMSNDB-ZDUSSCGKSA-N 384.423 5.106 30 20 GKED N#Cc1cc(NC(=O)c2c(Cl)cc(F)cc2Cl)ccc1OC(F)(F)F 441526936 XBPOTGHYVVLXAE-UHFFFAOYSA-N 393.123 5.155 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2nc(-c3cccc4ccccc34)cs2)c(F)c1 445662618 CDLAQGXOYABONR-UHFFFAOYSA-N 391.402 5.365 30 20 GKED COc1ccc(CN[C@H]2c3ccccc3CCC[C@@H]2C)cc1OCCCC#N 462546954 GLUAMTMPWQJVOO-MHECFPHRSA-N 378.516 5.181 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc(-c4cscn4)c3)c2)cc1 463876254 HQDCNIKFWQWGTB-UHFFFAOYSA-N 397.459 5.726 30 20 GKED CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](c1ccccc1)c1ccc(F)cc1 463952038 QQZLADLXDHWDFS-UUOWRZLLSA-N 386.470 5.439 30 20 GKED Cc1nc(C)c(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)s1 465241899 QLILORHVTOYCMF-UHFFFAOYSA-N 394.475 5.005 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c2ccccc21 469779013 HAVKOEDNAUTKJF-IBUXMESJSA-N 383.495 5.263 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Br)ccc1NC1CC1)c1ccccc1 476194885 KZRVOTHONFXBNB-OAHLLOKOSA-N 398.304 5.049 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)cc1 476401236 ZAVDWMLLLNBMCZ-UHFFFAOYSA-N 398.959 5.538 30 20 GKED CCc1c(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)cnn1C(CC)CC 478340749 QBJCAFIBOOKXTF-UHFFFAOYSA-N 393.516 5.054 30 20 GKED CC(C)(CC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(F)(F)F 479743253 KPLSUAOGMXNYQU-UHFFFAOYSA-N 390.405 5.249 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3Cc4ccccc4C4(CC4)C3)cc2)cc1 480805231 NEUVFEOEDGGQEI-UHFFFAOYSA-N 395.462 5.430 30 20 GKED C=CCn1c(S[C@@H]2CCc3ccc(F)cc32)nnc1-c1ccccc1OC 481027264 VJJDJOKQKHDSGV-LJQANCHMSA-N 381.476 5.058 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@@H](C#N)c1nc2ccccc2s1 483440721 NGFAQGPRBARAGF-CQSZACIVSA-N 393.855 5.403 30 20 GKED CCSc1cccc(F)c1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 484927164 NSVHEBUNEIEJEU-UHFFFAOYSA-N 396.443 5.234 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(Br)ccc1OCC 486228492 FCOHQKZXQXTBAY-UHFFFAOYSA-N 392.318 5.378 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(OCc2cscn2)c1)c1ccccc1 488716144 XVVOPOCAAOEOBL-OAQYLSRUSA-N 378.497 5.411 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(-c2ccco2)cc1F 490502244 XLFIOAPKCYCBMJ-WIYYLYMNSA-N 389.430 5.389 30 20 GKED C=CCN1CCC(N[C@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 491033531 FDOYKHVKTPGNHS-JOCHJYFZSA-N 388.527 5.016 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 492000457 OWQGRQATUFVKHS-UHFFFAOYSA-N 387.439 5.206 30 20 GKED N#CC1(CCCN[C@@H](Cc2ccc(Cl)cc2)C2CCCCC2)CCOCC1 499609918 IGSAYBLRYOSUIF-QFIPXVFZSA-N 388.983 5.522 30 20 GKED N#C[C@H](C(=O)Nc1cccc(Cl)c1)c1nc(-c2ccc(Cl)cc2)cs1 505450147 YQSLKMSABYXABT-OAHLLOKOSA-N 388.279 5.363 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)CCCC1 508276263 XPLGCUOPNHXJCS-UHFFFAOYSA-N 392.846 5.098 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCC2CCCCC2)cc1 511327252 YBIKXNCPTODJQK-UHFFFAOYSA-N 377.488 5.033 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)c1 515615498 XIGRGAVHTOERIK-OALUTQOASA-N 388.389 5.130 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](CC)c1ccccc1 517473254 LXBDQMLIQMCQAH-RXVVDRJESA-N 395.572 6.334 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c1C#N 518361530 LKQFFIPABWEBEK-CABCVRRESA-N 378.419 5.252 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@H]3CCc4cc(F)ccc43)cc2)cc1 518375196 FHNFOPGNDARWOZ-QHCPKHFHSA-N 386.426 5.101 30 20 GKED Cc1cccc(COc2c(C)cc(CN(C)C[C@H](C#N)CCC#N)cc2C)c1 523791337 XIIYIAYRNKCNQD-QFIPXVFZSA-N 375.516 5.066 30 20 GKED C=C(C)[C@@H](CC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1)OCC 535158080 VULZVSZWQRXWQL-WZONZLPQSA-N 381.516 5.253 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(CN2CCCC2)cc1)c1ccc(C#N)cc1 538398362 KQMGYOREYZXNQO-NRFANRHFSA-N 395.550 5.672 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2cccs2)o1)c1cccc(C(F)(F)F)c1 543076938 KFJYDHVPYDNWMF-CYBMUJFWSA-N 376.359 5.022 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1cccc2cccnc12 545951398 LWNRMBNNGWEHLX-UHFFFAOYSA-N 379.419 5.175 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)[C@@H]1CC[C@H](C(F)(F)F)C1 552250587 QHZONJOPPQMWHO-ZJUUUORDSA-N 387.295 5.074 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1ccc(OC(F)(F)F)cc1 554262497 BAYSVWJTTIOKFB-NSHDSACASA-N 399.210 5.070 30 20 GKED Cc1nc(NC(=O)C2(Cc3cccs3)CCCCC2)sc1SCC#N 554971909 DIBJUXWLGQLQFD-UHFFFAOYSA-N 391.587 5.260 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c2nccc(C)c2c1 559570875 NKXQKECZZXVZFC-HNNXBMFYSA-N 375.497 5.356 30 20 GKED CCN(C(=O)c1ncc(C#N)cc1C)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 560287105 AIYPGVRRUFZRLR-GOSISDBHSA-N 399.494 5.161 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)c3ccc(C4CCCC4)cc3)CC2)c(F)c1 570133668 LTZVTLDGVZLDRP-UHFFFAOYSA-N 392.474 5.039 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@H]1Cc1ccccc1 577013201 IWBVYIHEEARBMT-QUCCMNQESA-N 393.556 5.710 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3csc(C(C)(C)C)n3)n2)cc1 588348898 GCFJEIYKZQBGGK-CQSZACIVSA-N 397.525 5.063 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H](CC#N)C3)cc2)cc1 596642455 WRPDTTYKSKTIMW-KRWDZBQOSA-N 379.460 5.035 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609496139 XIYHCULDIRQIBJ-UHFFFAOYSA-N 376.843 5.759 30 20 GKED N#Cc1cccc(CNC(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)c1 609556692 RUGFBXJJKYUZOO-VWLOTQADSA-N 391.474 5.300 30 20 GKED C[C@H](NC(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)c1cccc(C#N)c1 610325170 FBXNJOKKXDEAMJ-IEGUWTFLSA-N 391.515 5.536 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H]3c3cccc(F)c3)cc2)cc1 611042783 XFANESDNLKOYOE-QFIPXVFZSA-N 387.414 5.469 30 20 GKED CCC[C@H]1CCc2nc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)sc2C1 611142172 MRNUJJMPHGASLT-JTQLQIEISA-N 394.327 5.479 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(-c2ccc(Cl)c(Cl)c2)oc1C 620305935 WYGKMWOCZHPZCL-OKILXGFUSA-N 377.271 5.280 30 20 GKED C[C@H](C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C(F)(F)F 648494379 MPCUJJGTCKFNKL-ZCFIWIBFSA-N 385.201 5.113 30 20 GKED C=C(CNC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 672481579 VPLUINWFJCOMDG-UHFFFAOYSA-N 390.430 5.077 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3cc4ccccc4o3)SC2=S)cc1Cl 726626203 AXGXUTNTYONSDA-RQZCQDPDSA-N 396.880 5.364 30 20 GKED C#CC[C@H](OC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1ccccn1 727776073 RHYKOVZJJNQRGI-WBMJQRKESA-N 380.296 5.177 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(Cl)c1)c1nc(-c2ccc(Cl)cc2)cs1 727955102 YEBICLFVFWQWRQ-INIZCTEOSA-N 387.291 5.536 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2c(Cl)nc(Cl)n2C)cc1OCCC 728440249 VMHYUWUIWHCAQN-FPLPWBNLSA-N 397.302 5.201 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CNC2(c3ccccc3)CCC2)c1=S 728707705 SXOVNVAFWJJZSC-UHFFFAOYSA-N 390.556 5.202 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(F)c(Cl)c1 730954927 OOOXUUMEGUQWEF-NSHDSACASA-N 379.913 5.540 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cc(C)cc(C)c1 733079693 IPAXYYBTXKNUQN-UHFFFAOYSA-N 385.393 5.010 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1nc2ccccc2s1 734210406 KKRHQKPUKNWIAO-UONOGXRCSA-N 396.541 5.573 30 20 GKED CN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccc2ccccc2c1 734315129 UMMFLONKGXTNOZ-UHFFFAOYSA-N 392.458 5.567 30 20 GKED CCCCCCCCC(=O)N1CCC(=C2C(=O)Nc3cc(Cl)ccc32)CC1 734547986 SUFQUNXOLLFVPB-UHFFFAOYSA-N 388.939 5.419 30 20 GKED C=CC[C@H](NC(=O)N(CCC)Cc1c(F)cccc1Cl)c1ccncc1 734681328 ZHOAHMUMDQYPKR-IBGZPJMESA-N 375.875 5.113 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 734711365 VOKDUVYPHRHILN-GDBMZVCRSA-N 394.446 5.385 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 734711368 VOKDUVYPHRHILN-ZBFHGGJFSA-N 394.446 5.385 30 20 GKED O=C1/C(=C\c2ccccc2F)CC(O)(C(F)(F)F)C/C1=C\c1ccccc1F 735792744 JUJBMLCGOXPDTP-CKOAPEAFSA-N 394.339 5.088 30 20 GKED C=CCCCCCN(C)Cn1nc(-c2ccncc2)n(-c2ccccc2)c1=S 739883760 DCYQWQIJGPZVAF-UHFFFAOYSA-N 393.560 5.101 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 749034293 ZONRPMLIKIWMAW-IUODEOHRSA-N 388.851 5.123 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(OC)cc1 752481375 LFHVWHKDKJGSCC-GUYCJALGSA-N 398.915 5.718 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1cc2c(ccc3ccccc32)o1 753143246 VVKAFJRTYYDIQZ-SREVYHEPSA-N 382.444 6.001 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1OC(F)F 753389076 AJWFPVXWIDBCSY-AINHQSCGSA-N 378.378 5.116 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)c1 760380615 YWGTUFWGYBZPTQ-UHFFFAOYSA-N 392.842 5.216 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@@H]3CCCOC3)c2)cc1 766355407 LCGWMHUYIXFLMZ-NOZRDPDXSA-N 396.490 5.488 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc(Cl)c2ccccc12 766633254 DGZBLOJFXLWETH-ZDUSSCGKSA-N 381.888 5.535 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC=C(c2ccc(Cl)nc2)CC1 773813124 OFALRZDRNHYPSA-UHFFFAOYSA-N 399.881 5.203 30 20 GKED CCCCC[C@@H](NCC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)c1ccccc1 775318106 SQQJIQZSNAPVQP-NHCUHLMSSA-N 398.510 5.135 30 20 GKED N#CCOc1ccc(Cl)cc1CNC1(c2cccc(C(F)(F)F)c2)CCC1 775463724 OASZGNPWLQNCFN-UHFFFAOYSA-N 394.824 5.430 30 20 GKED FC(F)Sc1ccc(C=Nn2c(S)nnc2-c2ccccc2Cl)cc1 781579244 SLBITDURRYBTBX-UHFFFAOYSA-N 396.875 5.084 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc(-c2ccccc2)o1 784829544 TZBKSJBRDFPGAM-AWEZNQCLSA-N 399.233 5.215 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)c2cc(C3CC3)cnc2Cl)cc1 793771699 CTXQFWNRIVNUMM-UHFFFAOYSA-N 387.870 5.081 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccoc1COc1ccc(C=O)cc1 800592990 QCQOTVILWYPYSK-UHFFFAOYSA-N 375.424 5.042 30 20 GKED C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)N[C@@H](CCCC#N)c1ccccc1 816627288 KEIFQDJFRRKOJQ-NRSPTQNISA-N 385.552 5.189 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCCc3n[nH]cc32)cc1)C(F)(F)F 842892480 FHDYVQOZHFRHCP-GFCCVEGCSA-N 381.295 5.189 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 842941510 QOBBWUVDUGZOIS-IAQYHMDHSA-N 389.318 5.153 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)nc1 846902118 QZOAAMCSXMZVJN-GFCCVEGCSA-N 399.237 5.498 30 20 GKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916916970 CPJUSQWVXNXKPZ-JOCHJYFZSA-N 384.479 5.243 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917024915 CJOXTVMGENEIIT-SUMWQHHRSA-N 398.940 5.821 30 20 GKED CCCCCOc1ccc([C@H](C)Nc2snc(Cl)c2C#N)cc1OC 917077732 SBCYLCYPWKNMJJ-LBPRGKRZSA-N 379.913 5.419 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)/C=C\c2ccccc2C#N)cc1F 919894817 PUPCVTVCSRROLR-RAXLEYEMSA-N 388.398 5.150 30 20 GKED Clc1ccc(C=NOCc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1 920399514 UENCPSOIFFFTRT-UHFFFAOYSA-N 382.634 5.248 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cc(F)c(Cl)cc1Cl 920957076 BYUKRORJZFYAJV-CYBMUJFWSA-N 380.294 5.333 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3c(Cl)cccc3Cl)s2)c1 1776049023 WCLNZTWBFFJTMJ-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3cccc(Cl)c3Cl)cc2)c1 1776080972 OUCMWBKCQMHNFF-UHFFFAOYSA-N 399.277 5.734 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)s1 1776339940 RWICKWNLKJKWJV-RMKNXTFCSA-N 396.533 6.269 30 20 GKED CC1(C)C/C(=C/c2cc(C(=O)O)ccc2Br)C(=O)c2ccccc21 1776526616 CEMKIGDNLGXLNS-UVTDQMKNSA-N 385.257 5.095 30 20 GKED C[C@@H]1C/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776589692 RQRVVHOQQCMHFK-VVRYKASASA-N 382.459 5.754 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c[nH]nc1-c1ccc(Cl)cc1 1776783959 MUSSXWOZGANNPN-GOSISDBHSA-N 377.916 5.024 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccccc2)[n+]2ccc(CC)cc2)cc1 10170871 QDDJKNQCMUUOJZ-UHFFFAOYSA-O 389.544 5.150 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(Nc2ccc(SC(F)F)cc2)s1 45458283 WQCUDKLJIBQTFN-SNVBAGLBSA-N 397.501 5.132 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2o1 54736784 HVIVLQFCWRJRKV-PWSUYJOCSA-N 391.279 5.492 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12 58423563 GNRDQCGSRQAURI-UHFFFAOYSA-N 399.450 5.138 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C12CC3CC(CC(C3)C1)C2 59251711 YYVMZTQFCMNQFZ-UHFFFAOYSA-N 387.483 5.209 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1 66346757 HYRHREWPMNLIFJ-IBGZPJMESA-N 381.888 5.379 30 20 GKED C[C@@H](Nc1ccc(Cl)c(C#N)n1)c1cccc(NC(=O)c2ccccc2)c1 67351135 VTLQNKNLLUDVCC-CQSZACIVSA-N 376.847 5.032 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2ccc3oc(C(C)C)nc3c2)c1C#N 106024721 DFNQQWJBZXAVGX-UHFFFAOYSA-N 392.484 5.069 30 20 GKED COc1cc(C(=O)Nc2cc(C#N)ccc2OC(C)C)ccc1OCCC(C)C 115762351 ASWHUINRKDHBCT-UHFFFAOYSA-N 396.487 5.031 30 20 GKED Cn1cc(CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c2ccccc21 120131175 OQVUVSDMRJUXBU-LJQANCHMSA-N 385.492 5.111 30 20 GKED CCCn1ncc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C1CC1 153658749 JCGXYCVZHGRHCY-UHFFFAOYSA-N 386.455 5.087 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(CN2CCCCC2=O)c1)c1ccccc1 155506886 IRJRVHBUBXMDNU-QFIPXVFZSA-N 391.515 5.028 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H](C)C1(C)CC1 175982630 RFLGQWMLLHSWHW-KRWDZBQOSA-N 377.488 5.098 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2C[C@H](C)Sc3sccc32)ccc1OC 180816819 NEZHFOTUGJCLML-QRTARXTBSA-N 388.558 5.153 30 20 GKED COc1ccc([C@@H](C)NCc2ccccc2C(C)(C)C#N)cc1Br 182101467 AFDPYEWRBIDFSF-CQSZACIVSA-N 387.321 5.110 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(COC2CCCC2)cc1 184034176 DUCYSEDKJQTZMD-INIZCTEOSA-N 379.460 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1c2ccccc2C=CN1C(C)=O 189875182 ISZATWUVZMCUOO-QHCPKHFHSA-N 388.511 5.441 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(CN2CCOC2=O)cc1 191470252 LXXYNVYXFUDPGC-UHFFFAOYSA-N 393.487 5.135 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2F)c1 237707220 VDZXVAXSIIKWLX-NRFANRHFSA-N 395.275 5.339 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1CNc1cccc(OCCCC#N)c1 237726737 MDXTYXIJPANMLP-UHFFFAOYSA-N 394.906 5.437 30 20 GKED C[C@H](/N=C(/O)CC1CCCCC1)C(O)=Nc1ccccc1N1C[C@H]2CC[C@H]1C2 328668814 DVGLTFXJPDOCRY-WDSOQIARSA-N 383.536 5.579 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN([C@@H]2CCCc3ccccc32)C1)C1CCCC1 329314684 CMEHBRJYGZSHTC-SIKLNZKXSA-N 392.547 5.445 30 20 GKED Cc1ccc(C)c(-n2ncc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)c2C)c1 330016617 PVOFVKOVXMMNFN-UHFFFAOYSA-N 394.519 5.311 30 20 GKED N#Cc1nc(N[C@@H](c2cccc(Cl)c2)c2ccccn2)ccc1C(F)(F)F 409715191 ZVWHDGUDAMOMQG-SFHVURJKSA-N 388.780 5.222 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@H]3C)s1 410982266 OXSYXSVVQBNDHB-HOSYDEDBSA-N 389.546 5.030 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(C#N)cc2Cl)cc1 426139930 XFLGEYBDLYIUAY-HXUWFJFHSA-N 383.879 5.369 30 20 GKED CCC(CC)n1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)n1 431169614 MQIKFAAABKMCIW-KRWDZBQOSA-N 378.501 5.166 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3nc(-c4ccccc4Cl)cs3)CC2)c1 435167875 FTULSWSBRRFJFC-UHFFFAOYSA-N 379.872 5.005 30 20 GKED CCCCOc1cccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 437851930 TXXRXPIGISYBNO-VXKWHMMOSA-N 377.488 5.169 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(F)c(C(F)(F)F)c1 438078847 IIKHSHCPGVRXKW-YJBOKZPZSA-N 391.368 5.148 30 20 GKED CN(CC1CC1)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 438538983 GXDAOYMUWMRMDR-UHFFFAOYSA-N 389.377 5.243 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@H]1Cc1ccccc1Cl)c1ccccc1 438850972 WORPATCOAHDCMG-PZJWPPBQSA-N 381.907 5.102 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Cl)c1cccc(NC(=O)c2ccccc2)c1 439429646 IROUALCSBBFTTD-INIZCTEOSA-N 389.886 5.315 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccccc1 440245263 UEJNNSUHUOCWDO-QFIPXVFZSA-N 397.469 5.464 30 20 GKED C=CCn1c(COc2ccc(C)cc2)nnc1S[C@H](C)c1cccc(C#N)c1 442917041 FTOOFMAXKAZAON-QGZVFWFLSA-N 390.512 5.077 30 20 GKED Cc1sc([C@@H](C)NCCCCC(C)(C)C#N)nc1-c1ccc(Cl)cc1 444684510 KIPWXJAVXCMMFK-CQSZACIVSA-N 375.969 6.143 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 451504217 FNUFIXMQPGXUKG-IAQYHMDHSA-N 385.323 5.081 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)S[C@H](C)c1ccccc1OC 463196587 DKNQUJREHVSSAU-HZPDHXFCSA-N 375.559 5.154 30 20 GKED O=C(Nc1ccccc1OC(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 463293394 IHSPCIIFYRDCQI-UHFFFAOYSA-N 385.210 5.135 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3cc(C#N)ccc3OC(F)F)o2)cc1 463481677 OBUGXRANYXBCBQ-UHFFFAOYSA-N 382.366 5.234 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)[C@@H](C)c1cccnc1 464964602 ZDBUBABADIYNFI-SFHVURJKSA-N 385.467 5.277 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)Nc1ncccc1C#N 466817939 WIOCLZHYZAFEFY-NSHDSACASA-N 399.317 5.321 30 20 GKED CO[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(C)(C)C 467610406 JNKGBPMVQUFCOG-QUCCMNQESA-N 399.922 5.178 30 20 GKED Cc1ccc([C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CCC2)o1 469281821 GNMRCPNOFFLXOL-QHCPKHFHSA-N 377.488 5.124 30 20 GKED C=C(C)COCCNC(=O)c1oc2ccccc2c1CSc1cccs1 474566498 XTUZKUSSXCAROP-UHFFFAOYSA-N 387.526 5.109 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccccc2OC)C1 475567544 CXHNEKNFBYDROH-IBGZPJMESA-N 378.516 5.569 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2ccccc2C)nc1C 476078895 IHHULCNOFVEWEJ-UHFFFAOYSA-N 390.552 6.531 30 20 GKED C=CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccccc1C 488892318 QABXQAXIJPVMSG-UHFFFAOYSA-N 388.540 5.533 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3nsc4ccc(C)cc34)n2)cc1 496028415 LUWJUCFJJVDXAU-INIZCTEOSA-N 389.505 5.527 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 497808896 KOQPAYDUQGWSHW-SFHVURJKSA-N 380.513 5.062 30 20 GKED C[C@H](NC(=O)Nc1cc(C#N)cn1C(C)(C)C)c1nc(-c2ccccc2)cs1 502051156 QJFOGVKKHASELA-AWEZNQCLSA-N 393.516 5.121 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 518398815 HOLGALLIBOYBTK-JOCHJYFZSA-N 383.451 5.031 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)Nc1ccccc1S[C@H](C)CC#N 519515805 XISLNRQVVDEKRS-QGZVFWFLSA-N 382.529 5.530 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c(C)n1 524389684 WQBCRNALSZRTHO-UHFFFAOYSA-N 391.858 5.055 30 20 GKED Cc1ccnc(C(C)(C)c2noc(/C=C/c3cn(CCC#N)c4ccccc34)n2)c1 528267595 VCAKNPMHLZBPBE-MDZDMXLPSA-N 397.482 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(C(F)(F)F)n2c1CCCC2 529134064 BBSOIJJABUPXQC-UHFFFAOYSA-N 391.437 5.342 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F 530843865 ZNLWDKOUFUBUNH-IBGZPJMESA-N 387.405 5.645 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c(Br)s1 532111370 YKYLLCUWGQEESJ-MRVPVSSYSA-N 395.347 5.129 30 20 GKED Cc1sc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 539496127 IILQJFLXXXODOQ-KGLIPLIRSA-N 381.932 6.055 30 20 GKED O=C(CC1CC1)N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 541229591 PRBROLJXPSJGES-LBPRGKRZSA-N 393.249 5.244 30 20 GKED COCCOc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 543876722 FKDBINPLACDJPT-IBGZPJMESA-N 386.495 5.101 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(Oc2ccc(Cl)cc2)CC1 551575823 OJBPWEYHWFGIDZ-AWEZNQCLSA-N 386.904 5.142 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 553945087 STJGHUXOLBKUMO-CVEARBPZSA-N 377.246 5.183 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1 579568137 AHVJIDGEMQDMEI-UHFFFAOYSA-N 390.487 5.004 30 20 GKED CC(C)[C@H](C#N)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 579639812 DAGDRPCJPMNZGA-ZDUSSCGKSA-N 396.343 5.059 30 20 GKED N#Cc1cc(Oc2ccc(NCc3csc(-c4ccccc4)n3)cc2)ccn1 580635725 DWNAVYUUYQOFBE-UHFFFAOYSA-N 384.464 5.481 30 20 GKED C[C@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 590253262 MQXLPRNPWSPHAA-SNVBAGLBSA-N 393.302 5.996 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC[C@@H](CC#N)C3)c(C)c2)n1 596715020 CQRSJNQTUYWEON-HNNXBMFYSA-N 386.546 5.069 30 20 GKED N#CC1(CC(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)CCCCC1 596971996 USRUCTDZNZJBIR-UHFFFAOYSA-N 383.879 5.117 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1csc(Br)c1 603968599 FBRKZASYFPSSGF-UHFFFAOYSA-N 389.299 5.363 30 20 GKED C=CCCCCCN(C)C(=O)NCc1cccc(NC(=O)C2CCCCC2)c1 606920876 AXVVIEAMLGQXJM-UHFFFAOYSA-N 385.552 5.093 30 20 GKED C[C@@H](NC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccc2ccccc12 609055121 ZOFYLXANWIRTSM-QGZVFWFLSA-N 396.446 5.374 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 609079070 HWHGPFOQKUDGMY-UHFFFAOYSA-N 399.494 5.418 30 20 GKED CC(C)Oc1ccc(NC(=O)CSc2ccc(C#N)cc2)c(C(F)(F)F)c1 609189235 YTPZDGMJKQYNIX-UHFFFAOYSA-N 394.418 5.095 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2c(Cl)cccc2s1 609427774 KPEWCKZTGYSJTK-LBPRGKRZSA-N 386.929 6.201 30 20 GKED CCc1ccc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609770980 XGXSBGSIEXURKF-INIZCTEOSA-N 384.570 5.373 30 20 GKED CC[C@@H](CC(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccc(C)cc1 609970896 POXCWXNLSGQZTD-BVVFMGSASA-N 390.527 5.257 30 20 GKED CCN(C(=O)c1cccc(-c2nc(C)cs2)c1)[C@@H](C)c1ccc(C#N)cc1 610038789 HPASXOUYSWSONK-INIZCTEOSA-N 375.497 5.214 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610322744 OOQKKNVVCAKJLL-QGZVFWFLSA-N 387.508 5.901 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(-c2ccncc2)cc1 611095149 XLUUQWFGKAGNBQ-CYBMUJFWSA-N 396.277 5.418 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 618759113 UAJFPXNKAHTZLR-UZUQRXQVSA-N 388.515 5.055 30 20 GKED C=CCN(CC=C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 641889747 WRQCMOXDYPBNKF-WUKNDPDISA-N 386.520 5.597 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)c[nH]c2c1 726146172 PNHXRWFSGAIGKI-UHFFFAOYSA-N 395.462 5.630 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c[nH]c4cc(C)ccc34)n2)cc1 726322398 SXOSXYJDJJKZDW-LJQANCHMSA-N 385.492 5.327 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 726858454 LFVXTXOEVANCIX-SUMWQHHRSA-N 398.890 5.973 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3cccs3)n2)cnn1-c1ccccc1 728440740 TUFURJNLEZKUTC-KTKRTIGZSA-N 377.494 5.262 30 20 GKED O=C1/C(=C/c2csc(COc3ccc(Cl)cc3)n2)CCOc2ccccc21 728441414 JNWRZQJECZJVFQ-SDNWHVSQSA-N 397.883 5.424 30 20 GKED CCN(C(=S)Nc1c(Cl)ccc(C)c1Cl)[C@H](C)c1ccc(C#N)cc1 728447133 UTHMQOXHRWXACG-CYBMUJFWSA-N 392.355 5.953 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 732903313 UFRDMNHZHHMCCQ-CVEARBPZSA-N 396.462 5.533 30 20 GKED Cc1cc(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)c(C)n1[C@H](C)c1ccccc1 733258569 FGJWKDQTTREIPB-OPAMFIHVSA-N 391.902 5.362 30 20 GKED N#Cc1ccc([C@H](Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)C(N)=O)cc1 734507001 JGOFUPABPPIQMN-FQEVSTJZSA-N 396.277 5.171 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 739594961 BKNGIENZXHYNME-QRWLVFNGSA-N 390.508 5.252 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCC[C@H]3c3cccs3)c2)s1 740060880 YJKFZSMJHIVASB-SFHVURJKSA-N 393.537 5.395 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H](C)c1cccc(O)c1 743096399 QLXNGRDCTCODBC-UUOWRZLLSA-N 399.494 5.663 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 745947713 KAOJQWSMCIEIPA-XJKSGUPXSA-N 384.888 5.231 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1cccc(C(=O)N2CCCC2)c1C 748994837 MOGMJTIJUKEHFJ-UHFFFAOYSA-N 387.568 5.445 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1ccc(Oc2ccccc2)cc1 749360848 IGNNGLAARSMWGM-UHFFFAOYSA-N 393.446 5.228 30 20 GKED CC[C@H](C)n1c(-c2ccccc2)nn(CN(C)Cc2ccc(C#N)cc2)c1=S 749884332 CAZHJWUOZYXCSH-KRWDZBQOSA-N 391.544 5.013 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3csc(Cl)c3Cl)cc2N1 761486519 PPVZNQVHEZODBC-OWOJBTEDSA-N 376.311 5.057 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 762037654 MKCTUXDVYSNWCS-KRWDZBQOSA-N 382.435 5.287 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cc(Br)ncc1F 762427004 RZKWQDIBQVYOCV-OWOJBTEDSA-N 395.278 5.064 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 766619284 VABLKOQVCBRFPB-SMDDNHRTSA-N 385.286 5.039 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1ccc(F)c(F)c1 773290794 OHQLJPSSLNRZPM-XIKOKIGWSA-N 387.455 5.252 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](c1ccc(Cl)cc1)C1CCC1 775380617 ZCOUSFRXJQZORJ-FQEVSTJZSA-N 375.299 5.527 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(OCC2CC2)c(F)c1 775542623 MTVLOQNYAIZKAB-AWEZNQCLSA-N 388.870 5.021 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)OCc3ccc(C4(C#N)CC4)cc3)o2)cc1 777146993 ATHTWYXBFUEGMC-UHFFFAOYSA-N 385.419 5.061 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 779397224 SEORGKJLBMSRSJ-OPAMFIHVSA-N 385.471 5.154 30 20 GKED C=CCSc1ccccc1C(=O)O[C@@H](C)c1nnc(-c2ccc(F)cc2)o1 784812596 JRSQXBCVUXHLQL-ZDUSSCGKSA-N 384.432 5.072 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCc2ccc(O)c(F)c2)cc1 786764243 AHEAPLQURWQUMP-OAQYLSRUSA-N 388.442 5.148 30 20 GKED Cc1c(C(=O)/C=C/c2cccc(OCc3cccc(C#N)c3)c2)cnn1C(C)C 787186930 PXMGXVOZDKTODH-ZHACJKMWSA-N 385.467 5.119 30 20 GKED C=CCOc1ccc(CNC(=S)Nc2ccc(SC(F)F)cc2)cc1 795090964 PPWWYLATLNAHLJ-UHFFFAOYSA-N 380.485 5.053 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571261 PBABWQKSCMOHMO-CMPLNLGQSA-N 397.327 5.391 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2csc(-c3ccccc3)n2)C(=O)c2ccccc21 802708967 MTLIFUOWAZSGHK-GRFAERAESA-N 389.476 5.127 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2csc(-c3ccccc3)n2)C(=O)c2ccccc21 802708969 MTLIFUOWAZSGHK-VMTBQTDASA-N 389.476 5.127 30 20 GKED Cc1cc(NC(=O)c2ccc(C3SCCCS3)cc2)c(C#N)cc1N(C)C 813378971 UPTRIUOAXSYJCU-UHFFFAOYSA-N 397.569 5.054 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 820924649 JFHHVCTWLQVRJT-KDURUIRLSA-N 397.519 5.089 30 20 GKED CCn1c(SCCCOc2ccc(C#N)cc2)nnc1-c1cccc(Cl)c1 915790061 VJENPIXZEQCJEO-UHFFFAOYSA-N 398.919 5.051 30 20 GKED CCCC[C@@H](CC)CNC(=S)N(Cc1ccc(C#N)cc1)CC(F)(F)F 916012775 NULRFAIOAMHNHE-OAHLLOKOSA-N 385.499 5.013 30 20 GKED Cn1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc(Cl)c1Cl 917716741 ZNHWTJUUASJLNW-UHFFFAOYSA-N 376.268 5.184 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(Cl)cc3F)cc2)c1 1776106553 KSZJZMGFXUADLH-UHFFFAOYSA-N 382.822 5.219 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2)cc1 1776125357 GFXBGURAGALRBN-SPQRHKFCSA-N 380.484 5.876 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4ccc(C(=O)O)c(O)c4)o3)coc12 1777449012 CPRDHPYPZGDDDT-TWGQIWQCSA-N 388.375 5.301 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CC=C(C)CC3)cc2)CCC1 1789114188 GHMQDZDYRDBTFJ-HXUWFJFHSA-N 392.543 5.061 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccco3)CCC2)cc1 1789624275 SYUIXDRUIXOYTE-UHFFFAOYSA-N 380.488 5.020 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)cc1)=C(/S)Nc1cccc(C)c1 22729006 JBQAJUKEUZVZEH-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#CCC[C@H](C#N)CSc1nc(Nc2ccccc2Cl)c2ccccc2n1 23674215 CSKROYLCRZHXSS-CQSZACIVSA-N 393.903 5.562 30 20 GKED Cc1cc2cc(NC(=O)c3ccc(OCc4ccccc4C#N)cc3)ccc2[nH]1 32168860 YABLAHIFCCQVDA-UHFFFAOYSA-N 381.435 5.179 30 20 GKED Cc1nc(NC(=O)c2oc3ccc(Cl)cc3c2C)sc1SCC#N 44789254 WWOFTIBUMVLQOT-UHFFFAOYSA-N 377.878 5.028 30 20 GKED N#CCCCOc1cccc(NC(=O)COc2ccccc2-c2ccccc2)c1 55569139 MCTIAVNLJYJYLG-UHFFFAOYSA-N 386.451 5.054 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccnc2)cc1)c1nc(-c2ccccc2)cs1 64682336 VIZPVGLJEJRWFE-HXUWFJFHSA-N 397.459 5.487 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C(C)C)s1 66956062 JZWUSAYFKIKMJK-INIZCTEOSA-N 387.574 5.893 30 20 GKED C[C@H](CC#N)N(C)C(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 103441744 SVUWLNXDCYUWBT-QGZVFWFLSA-N 387.439 5.040 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](Sc2ccccc2F)c2ccccc2)n1 106353508 NNNOEUMOPMRESU-BEFAXECRSA-N 382.485 5.301 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)CSCc2ccc(C#N)cc2)c(C)c1 109641063 ITIYQMJOZYKQIF-INIZCTEOSA-N 384.570 5.629 30 20 GKED Cc1ccc(CO)cc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 132048650 OJLZPMJDCLVOPU-UHFFFAOYSA-N 392.842 5.057 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cncc(-c3ccc(C)cc3)c2)cc1 135339688 LAYHONAWDWXGAV-UHFFFAOYSA-N 385.467 5.016 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2csc(-c3cccs3)n2)c(C#N)s1 154286447 HYYMAWNEABQPAN-UHFFFAOYSA-N 387.555 5.283 30 20 GKED C=CCn1c(SCc2csc(-c3ccsc3)n2)nnc1-c1cccnc1 157276702 WBNDLEHBXWXQFO-UHFFFAOYSA-N 397.554 5.003 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccccc1OCC1CC1 159274947 GYIKNSJDCDHOGN-MRXNPFEDSA-N 395.528 5.049 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 160091648 VQFDPBYTVUMWOF-MRXNPFEDSA-N 381.888 5.326 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 177743004 HVTUEHSCLGRDJQ-AWEZNQCLSA-N 385.489 5.328 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 177749225 QMHAFKQOCLWQBO-OAHLLOKOSA-N 381.526 5.112 30 20 GKED Cc1c([C@H](C)Nc2cccc(OCCCC#N)c2)nnn1-c1cccc(Cl)c1 179821679 WMOXQBFJKWYZHR-HNNXBMFYSA-N 395.894 5.085 30 20 GKED C=C(C)[C@H](NC(=O)Nc1c(C)nn(-c2ccccc2)c1C)c1ccc(F)c(F)c1 185506799 MNAYYCUFWRYSMK-FQEVSTJZSA-N 396.441 5.206 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccncc1 293265846 JASDXDGDWOJLLN-KXBFYZLASA-N 380.517 5.091 30 20 GKED OC1=NCCc2c1ccc(N=C(O)[C@@]1(Cc3ccccc3)C[C@H]3CC[C@H]1C3)c2F 328907939 LVTAUBJNBOHVLE-UAVUOLJFSA-N 392.474 5.324 30 20 GKED CN1CCC(O)=Nc2cc(/C(O)=N/[C@@H]3CC=C(c4ccc(F)cc4)CC3)ccc21 329248576 SNYNCTNDFMYHBX-LJQANCHMSA-N 393.462 5.194 30 20 GKED C[C@@]12CC3CC(/C(O)=N/C[C@H]4CC[C@@H](c5nc(C6CC6)no5)O4)(C1)C[C@](C)(C3)C2 329311384 ZRXRWFXOMCKWID-QRVBFIIFSA-N 399.535 5.120 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1C(F)(F)F 410391161 KZVMSYYXIDHYRL-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)[C@@H]1c1ccc(C(F)(F)F)cc1 412208225 WMGNJJPOQKMQPQ-VJICWTENSA-N 398.428 5.290 30 20 GKED C=CCC[C@@H](NC(=O)CSCc1ccccn1)c1ccc(C(F)(F)F)cc1 441577273 BPGDMPXRCYXDEE-GOSISDBHSA-N 394.462 5.157 30 20 GKED CCN(C(=O)c1c(F)cc(C#N)cc1F)[C@H](C)c1cccc(C(F)(F)F)c1 446066048 HEGQGPGLDMKLQH-LLVKDONJSA-N 382.332 5.079 30 20 GKED CC(C)n1c(S[C@H]2CC[C@@H](C#N)C2)nnc1-c1ccc(Cl)cc1Cl 450592938 HYSQVUPAXMTXSK-YPMHNXCESA-N 381.332 5.617 30 20 GKED Cc1ccc(Br)cc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 461089904 PLRQQIUUIYXIBA-CQSZACIVSA-N 398.087 5.059 30 20 GKED C=CCOc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCC2)cc1OC 462732868 AHJBEQXTRIWWSO-UHFFFAOYSA-N 391.433 5.448 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)c2)n1 464411821 RCRAONIGMFYJHF-OAHLLOKOSA-N 387.386 5.022 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(-c2ccccc2)o1 468948974 JVSUOUVZEJBSAY-SFHVURJKSA-N 399.494 5.703 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)cc1 468974731 MHENRTRDXSQEMH-FQEVSTJZSA-N 381.907 5.486 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 468974778 LJEDNKYNGYASHM-IBGZPJMESA-N 388.511 5.157 30 20 GKED CC(C)Oc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1 470564032 KIWWOEOUCWKIBW-INIZCTEOSA-N 397.887 5.136 30 20 GKED CC(C)c1nccn1Cc1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 474901524 QDHVVWAQZWLMCF-UHFFFAOYSA-N 386.499 5.108 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1 475548236 NRCGMAJHTFKKBT-GOSISDBHSA-N 388.515 5.607 30 20 GKED CCS[C@H]1CCC[C@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 475967451 MNUMUFDYHZTTGQ-XLIONFOSSA-N 382.554 5.113 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1C#N 483007822 AIDDLIMFUCONPO-OAHLLOKOSA-N 376.481 5.428 30 20 GKED CC(C)OCc1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 483376767 OJXUYZDVJKYULE-UHFFFAOYSA-N 386.451 5.528 30 20 GKED Cc1cc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)sc1C 488029766 VIZQOUFGEWDQAC-UHFFFAOYSA-N 378.472 5.218 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1Cl 495431872 FPCFUZQZVFSEQY-NSHDSACASA-N 378.259 5.099 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(C(F)(F)F)cc1 499330594 UKXGDXVYVZVIPY-OAHLLOKOSA-N 386.417 5.262 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(-c3nc4ccccc4s3)o2)cc1 499429949 AMGKNMYUUPLKQT-UHFFFAOYSA-N 387.464 5.610 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)Oc1cccc(F)c1 500744358 PBMUQHXJMCHUAP-INIZCTEOSA-N 390.414 5.204 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CSc1ccc2ccccc2c1 501004092 WXNVIZGLCJEYEO-UHFFFAOYSA-N 398.487 5.630 30 20 GKED C[C@@H](C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(C)(F)F 504181849 MTLZVDPBWVJEFI-GZMMTYOYSA-N 377.275 5.106 30 20 GKED CC[C@@](C)(C#N)C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 505163770 IBHDZPUQPJBQOC-JTSKRJEESA-N 379.891 5.009 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 509651720 JDNHVISPNPQBOS-SNVBAGLBSA-N 384.810 5.350 30 20 GKED CCN(C(=O)c1cc2cc(Br)cc(C)c2o1)c1ccc(C#N)cc1 513162424 YBRPVCNEUIAYJC-UHFFFAOYSA-N 383.245 5.042 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3Cl)cc2)ccn1 514636366 AYKIUZLSCRJTTL-PMACEKPBSA-N 389.842 5.141 30 20 GKED CC(C)c1ccccc1OCC(=O)Nc1sc(-c2ccccc2)cc1C#N 515687293 BUZVJJJSFZOLGL-UHFFFAOYSA-N 376.481 5.428 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cn1 516005023 OEOQTCMWOONHPN-UHFFFAOYSA-N 394.862 5.208 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Nc2cc(C#N)ccc2OC(C)C)c(Cl)c1 516381295 NJADKWYWNKMJHC-OAHLLOKOSA-N 385.895 5.055 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1ccccc1 518043125 JCWQASOYGAKZRZ-UHFFFAOYSA-N 384.407 5.187 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CC1 518906640 MDDXLZOAIBVKBI-KRWDZBQOSA-N 386.451 5.504 30 20 GKED N#CCCCOc1cccc(NC(=O)c2csc(-c3c(F)cccc3F)n2)c1 523540271 LYYOOZKLHMJEDJ-UHFFFAOYSA-N 399.422 5.023 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 524567648 UWEQMLDHZJKWKS-YADHBBJMSA-N 393.408 5.130 30 20 GKED N#CCc1ccnc(NC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)c1 531924602 LZIAXWYAUMYCHM-UHFFFAOYSA-N 398.249 5.499 30 20 GKED C=CCn1c(SCc2ncc(Cl)cc2Cl)nnc1-c1ccccc1F 537428969 OJKDYDZXUBXVFA-UHFFFAOYSA-N 395.290 5.264 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(Cc2ccc(F)cc2)CC1 538949695 JKLQMXYRKXRKLW-MRXNPFEDSA-N 397.519 5.222 30 20 GKED CC[C@H](CSC)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158478 DLVDVSUJWZFOHO-IIBYNOLFSA-N 381.545 5.069 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NCCC(C)(C)C#N 541642226 JSVFLFOVDXDWSQ-GFCCVEGCSA-N 392.366 5.472 30 20 GKED N#Cc1cccc(CNC2(c3noc(C4CCCC4)n3)CCCCCC2)c1F 541698292 OHXBVZHFWBDFIB-UHFFFAOYSA-N 382.483 5.077 30 20 GKED COC[C@@H](C#N)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 542189269 HTTUPRPQNIDOPB-FYYLOGMGSA-N 395.506 5.095 30 20 GKED N#Cc1ccc(NC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)cc1Cl 544055264 JYCXALPRYNWMJA-UHFFFAOYSA-N 391.736 5.138 30 20 GKED N#C[C@H](C(=O)c1oc2ccccc2c1CSc1cccs1)c1ccncn1 546860107 AHOGBBWTHMYALB-AWEZNQCLSA-N 391.477 5.067 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(-c2ccccc2)o1 546864095 TUDKEBVQJISTDA-CQSZACIVSA-N 393.855 5.403 30 20 GKED COc1ccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)cc1 552083096 RPYBKSJIIHAKJZ-NRFANRHFSA-N 377.513 5.343 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](CC)c1cccc(OC)c1 554759738 AHGDSUPCUOOKRD-JOCHJYFZSA-N 380.532 6.162 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@H]1c1cccs1 558450750 VULFLBXZTPXOEW-RDJZCZTQSA-N 398.507 5.146 30 20 GKED CCSc1cccc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 562188851 GOEKCXOLRWMTCF-UHFFFAOYSA-N 375.453 5.110 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1 564581365 LKPJAJVGHPDALH-DHIUTWEWSA-N 390.527 5.087 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1nc3c(s1)C[C@@H](c1ccccc1)CC3)CC2 569009970 IJKFTLALIKXFQM-PZJWPPBQSA-N 385.536 5.064 30 20 GKED Cc1nnc(SCc2ccc(C#N)cc2OC(F)F)n1[C@@H]1CCC[C@H](C)C1 569110811 ONDZXWAQLHUZKQ-BLLLJJGKSA-N 392.475 5.103 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)cc2)cc1 581577643 NVQNKYLCDOXFRP-GOTSBHOMSA-N 381.435 5.774 30 20 GKED C[C@H](N[C@@H](C)c1ccc2nc(O)oc2c1)c1ccc(-c2cccc(C#N)c2)cc1 586792960 DFARYWAXBQPHFA-HOTGVXAUSA-N 383.451 5.484 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)/C=C\c1cccc(Cl)c1 588482819 UPSQPFPQDUBVPU-HCYCVZQXSA-N 392.933 5.147 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2)cn1 604005470 RXHMWJBWJHSTMH-QFIPXVFZSA-N 393.446 5.007 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccc(F)cc1 609723622 NMVKPIBBFIAAKM-UHFFFAOYSA-N 380.806 5.420 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SCC(F)(F)F)c1cccc(C#N)c1 610318317 NTZFNMXOYFSATJ-LBPRGKRZSA-N 379.407 5.095 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccccc1OCc1cccc(Cl)c1)C1CC1 611095581 RXIRYQMWJLHPTB-OAHLLOKOSA-N 383.879 5.075 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1ccc(C(F)(F)F)cn1 613289630 XHPMMVUSAFZBGJ-KRWDZBQOSA-N 397.400 5.341 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)c1ccc(Sc2ccccc2C#N)cc1 614897658 QRTKNYISQUFTQZ-UHFFFAOYSA-N 378.419 5.170 30 20 GKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(SCC(F)(F)F)cc1 618802290 HVTFICRUYKRLCD-YJYMSZOUSA-N 376.447 5.551 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c12 624581472 BXOITPAUPNWTDD-KRWDZBQOSA-N 396.450 5.091 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(c2noc3cc(F)ccc23)CC1)c1ccccc1 685890196 CMDWWRBSFVMLKT-HXUWFJFHSA-N 392.474 5.423 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 726444438 OVOJRVRXNIDNES-NRFANRHFSA-N 376.912 5.397 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1OC 727685312 INXHWRJQSAYIGU-RVDMUPIBSA-N 395.455 5.179 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(-c3ccoc3)n2)cc1 730962166 LQXDLDNWXSHUGD-LJQANCHMSA-N 385.448 5.311 30 20 GKED Cc1ncc(/C=C\C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)s1 732730244 QQALZMHJEOAFFK-CLFYSBASSA-N 391.471 5.017 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3c[nH]c4ccc(OC)cc34)cs2)c1 734306944 JRKFQAIFHMWTRL-TWGQIWQCSA-N 390.464 5.205 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCOc4ccccc43)n2)cc1 735594372 YDXYQNDEXVPTOD-PKOBYXMFSA-N 388.492 5.251 30 20 GKED O=C1/C(=C/c2csc(COc3ccc(Cl)cc3)n2)CCc2c(O)cccc21 742435467 UHRLHWRYFJQNTR-JLHYYAGUSA-N 397.883 5.294 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)ON=C(c2ccccc2)C(F)(F)F)c(Cl)c1 751955044 OAALZFPKJLIRSF-ZDUSSCGKSA-N 398.812 5.267 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(OCC(F)(F)F)cc1 753144038 XDRHNRHOWKIXRT-WAYWQWQTSA-N 390.386 5.042 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)Nc1ccccc1O[C@H](C)C#N 780519747 DMHWVVBVAKXSPC-GFCCVEGCSA-N 393.365 5.039 30 20 GKED CC(C)n1ncc2c(C(=O)OCCCC(C)(C)C#N)cc(-c3ccccc3)nc21 782080932 NOPXSNCJNQGQSQ-UHFFFAOYSA-N 390.487 5.166 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)O[C@H](c1ccccc1)C1CCCCC1 782847863 SXZZUSFHEXYZLF-XMMPIXPASA-N 393.531 5.211 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(C#N)cc2Cl)ccc1OC(F)F 788361078 SYJGWBNGMJFYNH-QPJJXVBHSA-N 377.774 5.108 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(C(F)F)c1)c1nc2cc(Cl)ccc2s1 790773291 LVBAGHXLHMBAGF-ZDUSSCGKSA-N 376.815 5.306 30 20 GKED CC(C)O[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 794219708 BBYKWOANKYCDKB-DNQXCXABSA-N 384.479 5.447 30 20 GKED C=CCC[C@@H](NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccco1 796743210 JHBKBTPDWXQVNF-LJQANCHMSA-N 376.447 5.147 30 20 GKED C=CCC(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 796765941 VAEABXMTHRYQJD-ZDUSSCGKSA-N 379.312 5.895 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](c3cccnc3)C(C)C)n2)cc1 797943982 ZEHXDFOIAQRKEA-QUCCMNQESA-N 375.497 5.130 30 20 GKED C#CC[C@@H](Cc1ccccc1)NC(=O)N(Cc1cccs1)Cc1cccs1 805785859 KALCNPYKPKYVLV-IBGZPJMESA-N 394.565 5.156 30 20 GKED C#C[C@H](NC(=O)N(CCC(F)(F)F)Cc1ccccc1)c1ccc(Cl)cc1 811960877 ARCXURFSZUGDPZ-SFHVURJKSA-N 394.824 5.179 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)(F)F 815911457 BYVNVDRDVNDYAX-KCJUWKMLSA-N 389.254 5.584 30 20 GKED C[C@@H]1CCC[C@@H](c2noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)C1 848605729 ROSSGZUNIHLQGM-BZUAXINKSA-N 376.501 5.013 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)cc1 915991718 NWZPMSKFDLTGBW-FLIBITNWSA-N 399.899 5.385 30 20 GKED COc1cccc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 918034211 JVKIZPVUMNZBEK-GAJHUEQPSA-N 385.467 5.233 30 20 GKED CCC(CCc1ccc(Br)cc1)=NNc1nncc2ccccc12 921139085 HTBNBRJLLJHBJP-UHFFFAOYSA-N 383.293 5.203 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(F)cc1C=NNc1ccc(C(=O)O)cc1 1776012550 VPXLYCVDDLMIDQ-UHFFFAOYSA-N 398.821 5.724 30 20 GKED CC(C)CC(Cc1ccc(Cl)cc1Cl)=NNc1ccccc1C(=O)O 1776030175 MLIODABLECAKGA-UHFFFAOYSA-N 379.287 5.748 30 20 GKED CCCCCCCCOc1ccc(C=NNc2ccc(CC(=O)O)cc2)cc1 1776083639 RLDZGMOQGAMAQQ-UHFFFAOYSA-N 382.504 5.499 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=NNc2cccc(C(=O)O)c2C)CCC3)cc1 1776086776 NXGYLRPUTQYCEP-UHFFFAOYSA-N 391.496 5.278 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776473699 ZRPNXLVESNLSFH-CMUBDUJZSA-N 396.439 5.302 30 20 GKED COc1cc2ccc(C(=O)/C=C\c3cccc(C(=O)O)c3Cl)cc2cc1OC 1777343290 KMCZGZMSWROHNO-HJWRWDBZSA-N 396.826 5.105 30 20 GKED CCOc1ccccc1Nc1nnc(S[C@H](C#N)Cc2ccc(C)cc2)s1 24701712 ONBANYYEKOCYTJ-INIZCTEOSA-N 396.541 5.216 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 56731819 GVCDZCCKOGHHCJ-UHFFFAOYSA-N 388.471 5.274 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(Cl)nc1Cl 64935460 OOFCODLVMYEZLW-UHFFFAOYSA-N 398.249 5.613 30 20 GKED C[C@@H](NC(=O)/C=C\c1cn(CCC#N)c2ccccc12)c1cccc2ccccc12 97985759 XBSBGPKCLRCGSM-VKNLVWNJSA-N 393.490 5.599 30 20 GKED C=CCN(C(=O)c1ccccc1OC(F)F)c1nc(-c2ccccc2)cs1 104700709 CEOQFZPKEBCKCX-UHFFFAOYSA-N 386.423 5.244 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)[C@H](C)C2CC2)cc1 108920905 MBSADWPBGZJSGH-QGZVFWFLSA-N 391.515 5.329 30 20 GKED N#C[C@@H](C(=O)CSC1=Nc2ccccc2C1)c1nc(-c2ccccc2)cs1 118606916 HLXOJTKJRNRNFV-INIZCTEOSA-N 389.505 5.006 30 20 GKED COc1ccc(COCc2cccc(NCc3ccc(F)c(C#N)c3)c2)cc1 124240802 JNQNAUZXIADQJS-UHFFFAOYSA-N 376.431 5.035 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 137447127 OTRIIXKZGJEDSL-DYESRHJHSA-N 393.556 5.924 30 20 GKED N#CC1CCN(C(=O)c2oc3ccccc3c2CSCc2ccccc2)CC1 147102654 MEIGSXLDXFRCQQ-UHFFFAOYSA-N 390.508 5.242 30 20 GKED Cc1ccc(C[C@H](NC(=O)N[C@@H](CCC#N)c2ccccc2)c2ccccn2)cc1 151435564 NJIBGCRBPTXQCU-UPVQGACJSA-N 398.510 5.018 30 20 GKED CCN(C(=O)c1csc(-c2ccc(OC)cc2)n1)c1ccc(C#N)c(Cl)c1 156560880 BRPIMEZCCMQLBG-UHFFFAOYSA-N 397.887 5.010 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 159269751 VLUZTQQJABLRBS-UHFFFAOYSA-N 392.377 5.258 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)CCCCC(=O)c3ccccc3)n2)c1 160784537 YPWFREVLHRBGFP-UHFFFAOYSA-N 389.480 5.064 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1cc(F)cc(F)c1 187542831 UATWHQHMDVMBIZ-CYBMUJFWSA-N 392.496 5.231 30 20 GKED Cc1cccc(OCCCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c1 193616957 MGYJHSNPJMGWMK-KRWDZBQOSA-N 397.425 5.165 30 20 GKED Cc1ccc(-n2c(Cc3ccccc3)nnc2SCCCCC#N)c(C)c1 195549245 WLSXZOKDDOIYQJ-UHFFFAOYSA-N 376.529 5.261 30 20 GKED Cc1ccccc1N(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 217005383 YOIPVDVASPWBEI-KRWDZBQOSA-N 381.545 5.100 30 20 GKED C[C@@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)c1ccc(C#N)cc1 303727781 UFSWONBIGXQTDH-OAHLLOKOSA-N 378.501 5.768 30 20 GKED COc1ccc(N=C(O)[C@@H]2CCC(=O)[C@@H](C)C2)cc1N=C(O)C1CCCCC1 328947627 KFTBHUDDJCWLAQ-GOEBONIOSA-N 386.492 5.457 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1cccc(OC2CCCC2)c1 330308815 MLLKKXVPOIXMPR-OAHLLOKOSA-N 386.517 5.303 30 20 GKED CSc1nc(C(C)C)nc(C)c1/C(O)=N/C1CCC(C(F)(F)F)CC1 331047306 VKVBMEOEYSKHIB-UHFFFAOYSA-N 375.460 5.056 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(C(=O)N(C)c2ccccc2)c1 410365820 OTJQRUUOBFEBKU-UHFFFAOYSA-N 384.479 5.334 30 20 GKED C[C@H](NC(=O)CN[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 433023260 OGHMBBWUPSXMNX-CYFREDJKSA-N 385.511 5.042 30 20 GKED Cc1ccnc(-c2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2)n1 433184192 VFDBFQLQWKCHCG-OAQYLSRUSA-N 385.471 5.009 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cccc3cccnc23)cc1F 437505423 XGVIFKYMNUFXOX-UHFFFAOYSA-N 397.409 5.219 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCCC(F)(F)F 437831632 CIVRSLSYZDHXIP-UHFFFAOYSA-N 377.366 5.123 30 20 GKED CSc1ccc([C@@H](C)NCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 439481736 MEBWAIJCKQWLTG-HZPDHXFCSA-N 399.585 5.092 30 20 GKED C=CCn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCCC[C@H]1c1ccc(Cl)cc1 453412979 JEARTLHJIXBTGB-SNRMKQJTSA-N 386.927 5.089 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](c1nc(C)cs1)C(F)(F)F)c1ccccc1 455709766 RUGSKGGLSPKLBA-LSDHHAIUSA-N 383.439 5.062 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2cccc(CC#N)c2)C1 455910948 UZNCINXWDYPUNQ-KUHUBIRLSA-N 387.405 5.386 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 457593198 YLJCQOBWVMUCBJ-VIFPVBQESA-N 384.345 5.238 30 20 GKED CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H](C)c1cccc(OC)c1 458794260 ATBSYQHWTNQRAJ-PGRDOPGGSA-N 379.504 5.223 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)NCC(C)(C)CC#N)nc1-c1ccccc1 459252899 DEHJEYFBWZUQPO-SFHVURJKSA-N 394.519 5.251 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3scc(C)c3C#N)c3c(C)noc3n2)cc1 464574851 DYMPVUMRUWUTQQ-UHFFFAOYSA-N 388.452 5.001 30 20 GKED CC(C)C[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 467613368 LQOBWEDQZGCBPO-FQEVSTJZSA-N 391.515 5.232 30 20 GKED C=CC[C@H]1N(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)CCCC1(C)C 470296433 MDROYBSYUSWTSF-LJQANCHMSA-N 386.923 5.521 30 20 GKED CC[C@@H](C)Sc1ccc(NCc2nnc(-c3ccc(C#N)cc3)o2)c(C)c1 471629577 QHWFDITZDZIZAA-OAHLLOKOSA-N 378.501 5.419 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 476107103 DCNZZYSOALMFQR-QAPCUYQASA-N 380.797 5.147 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c1 477952605 RSJWTTTYIAOAAD-KRWDZBQOSA-N 387.487 5.105 30 20 GKED CCS[C@H]1CCCCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 480361773 DAJNXBAJOGFXAP-NRFANRHFSA-N 380.513 5.098 30 20 GKED CC(C)[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccccc1 482990541 IWTWUSDUANQGEA-HXUWFJFHSA-N 388.433 5.279 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1cccc(OC)c1 488907923 KMEABZLXWGUWEB-UHFFFAOYSA-N 394.525 5.042 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500750639 BFONZHCYLMQTEK-UHFFFAOYSA-N 398.462 5.569 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 503053652 AGDLFMTVOHBJBW-GHTZIAJQSA-N 396.918 5.340 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c[nH]c2cccc(C)c12 504305050 RXSARBMBZFGWPA-UHFFFAOYSA-N 395.462 5.630 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)COCc1ccccc1 505309686 FILQNPZZXHQOOB-QGZVFWFLSA-N 397.544 5.055 30 20 GKED CCN(Cc1ccc(OCC(F)(F)F)c(OC)c1)[C@H](C)c1ccc(C#N)cc1 508605119 PTKODSOJTAWNNN-OAHLLOKOSA-N 392.421 5.091 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC(C)(c2ccccc2)c2ccccc2)cc1 509623688 ROEBPXCBDUPBES-UHFFFAOYSA-N 383.495 5.573 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 510857224 MHDOIAYKIOZJNX-UHFFFAOYSA-N 387.508 5.682 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCC(=O)c3ccc(F)cc3)cc2)c1 517519568 HRPRRDPCTQBSKN-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520596442 KWYAGQSXUTWXGD-INIZCTEOSA-N 375.428 5.086 30 20 GKED N#CCN(C(=O)Cc1cccc(OCc2ccccc2Cl)c1)c1ccccc1 521568154 VUEYNRLHBGNDJB-UHFFFAOYSA-N 390.870 5.018 30 20 GKED CSc1cccc([C@@H](NCc2ccccc2C#N)c2cc(F)ccc2F)c1 525175261 NTALZDBNJOJWEB-JOCHJYFZSA-N 380.463 5.438 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2ccc(CC#N)cc2)cc1 534671014 CGFANBCYRILIKP-SFHVURJKSA-N 384.479 5.261 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CCC(F)(F)CC2)cc1Cl 536158009 NNIXINBKACBDSS-SFHVURJKSA-N 388.845 5.759 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(Oc3cccnc3)cc2)c(C#N)s1 536973139 NUEDMELGRVRVMV-UHFFFAOYSA-N 377.469 5.357 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nnc(-c2ccccc2)o1 541076762 HEHATEJYXUDQGW-MSOLQXFVSA-N 394.478 5.687 30 20 GKED Cc1ccc(C(C)(C)NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 544799149 JMLGOQQQKOYHQL-SFHVURJKSA-N 398.510 5.224 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Oc3ccc(C)cc3OC)c(F)c2)CC1 554469028 CEAKTYDNMGZURX-UHFFFAOYSA-N 384.451 5.365 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1 554966336 RNIWFSDPGDNTNZ-CYBMUJFWSA-N 388.389 5.158 30 20 GKED CCOc1ccc([C@@H](N[C@@H]2CCc3ccc(C#N)cc32)C(C)C)cc1OCC 554997198 JJDPDLBBAVDULB-QPPBQGQZSA-N 378.516 5.330 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cc2ccccc2c2cccnc12 561241581 VQPIEOWMXNJFCG-UHFFFAOYSA-N 398.510 5.384 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2ncc(C#N)cc2F)nc1-c1ccccc1 566665343 NITQBGJIKHGLBW-SFHVURJKSA-N 376.435 5.212 30 20 GKED CCCOc1ccc(Oc2ncccc2CN[C@@H]2CCc3ccc(C#N)cc32)cc1 567003041 SMPLQPFKXXNJIK-XMMPIXPASA-N 399.494 5.311 30 20 GKED C[C@@H](CCOCc1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 569018744 OMCHCSOTPCPWLS-ZWKOTPCHSA-N 397.544 5.198 30 20 GKED Cn1cc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c(C2CCCCC2)n1 576554687 TWKRDWUAJSVFAP-UHFFFAOYSA-N 387.487 5.139 30 20 GKED CCCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@@H](C)c1ccc(C)o1 590942334 KUHPPBSPLHPNNA-FPOVZHCZSA-N 381.520 5.896 30 20 GKED Cc1cccc(-n2ncc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2C)c1 592273633 OEUOLCBMLRHSPA-NRFANRHFSA-N 387.487 5.046 30 20 GKED C[C@@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 594942422 IFXNBJUKVIXXBU-BCHFMIIMSA-N 398.506 5.244 30 20 GKED N#CCC1CN(C(=O)c2cccc(CSc3cc(Cl)ccc3Cl)c2)C1 598034957 UGCRSUVSQPVDBU-UHFFFAOYSA-N 391.323 5.271 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 599795279 QIZPWOFZCXDSCB-IRXDYDNUSA-N 399.466 5.503 30 20 GKED CC(C)=C[C@H]1[C@@H](C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)C1(C)C 603738431 BRTLORHPGQLTCT-ICSRJNTNSA-N 375.472 5.231 30 20 GKED C=CCCCCCN(C)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606971794 NTLNXLQHHBVYBH-CHWSQXEVSA-N 388.396 5.284 30 20 GKED C[C@H](NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 608481926 AYXATEVBYNOPOZ-SFHVURJKSA-N 382.463 5.066 30 20 GKED Cc1ccccc1S(=O)(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 608954523 WUGMCIGVOHNMDW-IBGZPJMESA-N 396.899 5.105 30 20 GKED C[C@H](NC(=O)NCc1ccc(C#N)cc1F)c1ccc(Oc2ccccc2)cc1 609240675 ZBXXAPFNDKPBGS-INIZCTEOSA-N 389.430 5.050 30 20 GKED CCCN(C[C@H]1CCCCO1)C(=O)c1ccccc1Sc1ccccc1C#N 609304482 HFKOXSKWEKQWCT-LJQANCHMSA-N 394.540 5.131 30 20 GKED COc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 609398406 YVUZIEZZUVWADU-INIZCTEOSA-N 397.544 5.046 30 20 GKED CCN(C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 609967920 QIPSHYGBUIZCMX-HZPDHXFCSA-N 388.433 5.680 30 20 GKED N#Cc1c(NC(=O)c2cc3cccc(F)c3o2)sc2c1-c1ccccc1CC2 610225016 XYEAWFSKKYIXSA-UHFFFAOYSA-N 388.423 5.523 30 20 GKED C[C@H](NC(=O)NCCC(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 610356694 YDCLYZLBPMYLCX-IBGZPJMESA-N 383.495 5.141 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)C1 612294457 YLXUOIBZERWTPC-OAQYLSRUSA-N 376.485 5.121 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Br)c(F)cc1Cl)c1ccccc1 619518617 RLBMJXBBMBUTRG-GFCCVEGCSA-N 395.659 5.268 30 20 GKED Cc1c(F)cccc1C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 622485672 VDFSKOHIAIUHSF-AWEZNQCLSA-N 379.275 5.186 30 20 GKED CCCCN1Cc2cccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2C1 727291054 PKUCPXHDDOJCPI-UHFFFAOYSA-N 384.936 5.136 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cccc(OC(F)(F)F)c2)S1 727976172 MQXAMWLOYZFSSN-XNTDXEJSSA-N 392.402 5.094 30 20 GKED Cc1ccccc1C(=O)/C=C\c1ccc(OCc2cc(C)c(C(=O)O)o2)cc1 729937059 LCCJAZUHCJWYBR-XFXZXTDPSA-N 376.408 5.070 30 20 GKED Oc1nncc(NN=Cc2c3ccccc3c(Cl)c3ccccc23)c1Cl 730571317 PZELKUJFBSVVDC-UHFFFAOYSA-N 383.238 5.241 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3\Cc4ccc(C)cc4C3=O)c2)cc1 730948140 AEUIEJVHUBROBT-DEDYPNTBSA-N 383.447 5.078 30 20 GKED CC[C@H](OC(=O)CCc1c(C)nc(O)c(C#N)c1C)c1ccc(C(C)(C)C)cc1 731778671 QUZNYGNAGZUJNO-NRFANRHFSA-N 394.515 5.200 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(Oc3ccncc3)c(Cl)c2)C(C)C)c1 733932128 MOXDLTHQXFQVHS-UHFFFAOYSA-N 390.870 5.564 30 20 GKED CC[C@@H](Sc1nc(O)c(C#N)c(-c2ccc(OC)cc2)n1)c1ccc(F)cc1 737398890 VTIYIGVJZOKPKI-GOSISDBHSA-N 395.459 5.112 30 20 GKED CCN(Cc1ccccc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740059461 IOJHAFFQUTZRQV-UHFFFAOYSA-N 375.497 5.018 30 20 GKED COc1cccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1OC(F)F 741473225 OMFAKPQILNXCIC-HJWRWDBZSA-N 381.378 5.255 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN2CC[C@H]2c2cccc(F)c2)c1=S 743389029 HISTUCBETGCXSC-FQEVSTJZSA-N 394.519 5.119 30 20 GKED C[C@]1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCc2ccccc2C1 744034519 ACWPXDZZNZJNKJ-KKSFZXQISA-N 380.900 5.321 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2c2ccc(C)cc2)c1 745820137 HTSXKRCBHHHWDH-GMAHTHKFSA-N 391.515 5.113 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)cc1 747377686 ZJEMSYVTEKYTJA-XPWALMASSA-N 386.882 5.738 30 20 GKED CCCc1c(N[C@@H](C)c2ccc(OCC#N)cc2)cnn1-c1cccc(F)c1 753769686 POHMWKBSFLQRML-INIZCTEOSA-N 378.451 5.039 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(C(F)F)c2Cl)c1 758227351 ZUIQVBXIGNFKMR-ZDUSSCGKSA-N 393.821 5.280 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc2cc(Br)ccc2c1 763714716 RMIPEQYLGGFCOZ-UHFFFAOYSA-N 397.297 5.470 30 20 GKED N#Cc1cc(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)c(Cl)c([N+](=O)[O-])c1 764307827 VPYXTCKMNSPPKD-IRXDYDNUSA-N 391.814 5.015 30 20 GKED COc1cc(C=NOCc2nc(C3CCCCC3)cs2)ccc1OC(F)F 766685393 SFKVAWKFXWEGEP-UHFFFAOYSA-N 396.459 5.352 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c(Cl)c1 767849455 FNKPIPLSNPMNPU-AWEZNQCLSA-N 393.796 5.252 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)c1 772983475 KJZAUONOXHQDPR-OCCSQVGLSA-N 381.278 5.664 30 20 GKED C=C(C)[C@H](NC(=O)c1ccc(C(F)(F)F)nc1Cl)c1ccc(F)c(F)c1 774546461 UZPPFCXOIIWCBO-AWEZNQCLSA-N 390.739 5.079 30 20 GKED C=C(C)CN(C)Cn1nc(Nc2ccc(SC(F)F)cc2)sc1=S 777959164 ANWCHGDZYJZHLE-UHFFFAOYSA-N 388.534 5.198 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(-c4ccccc4)[nH]3)cc2)c1 779594670 NUZCATPJPWCCBF-UHFFFAOYSA-N 380.451 5.139 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 780674120 JYXUMBLNCNTYHH-KBPBESRZSA-N 391.393 5.221 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C\c1csc(-c2ccsc2)n1 787179224 OEMZZOLAQRCULO-HYXAFXHYSA-N 389.885 5.208 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 790090718 PBFMWXJXHZWXEO-UHFFFAOYSA-N 395.289 5.908 30 20 GKED Cc1ccc2c(c1)CCN(C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)C2 792228708 OLFGLFWKBQBJNP-DEOSSOPVSA-N 381.479 5.241 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](F)CC3CCCCC3)n2)cc1 796662029 ONIFMVCJGNAUPU-MSOLQXFVSA-N 386.492 5.303 30 20 GKED N#C[C@H](C(=O)C1CC(c2ccc(F)cc2)C1)c1nc2cc(Cl)ccc2s1 796757114 SZHOHJBWKKVEBN-SEEARECTSA-N 384.863 5.459 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2Cl)nnc1-c1ccccc1F 799872265 PQBZOSMDHGTJLK-UHFFFAOYSA-N 395.290 5.264 30 20 GKED N#CCOc1ccccc1-c1nc(-c2ccc(OC3CCCCC3)cc2)no1 809376692 OUGOHLQXKMRMFE-UHFFFAOYSA-N 375.428 5.017 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)Cc2ccccc2O1 814578360 YUHJXLYRZBGKEF-MBSDFSHPSA-N 397.478 5.157 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1sc(-c2ccc(F)cc2)nc1C 814822390 YFGFMIBADHYFBZ-UHFFFAOYSA-N 397.479 5.251 30 20 GKED C/C(=C\C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 817318730 HARNWJBTCVQRBW-VVLLFNJHSA-N 384.426 5.243 30 20 GKED C[C@@H](Cc1ccc(F)cc1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 855930241 KKFJJFVZFZBBIY-NSHDSACASA-N 387.339 5.174 30 20 GKED Cc1sc([C@H](C)N[C@H](C)c2cc(C#N)ccn2)nc1-c1ccc(Cl)cc1 902837200 VHJBUMXAZKYANS-OLZOCXBDSA-N 382.920 5.450 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c(F)cccc3Cl)n2)cc1 916627147 ALOYPYTXCJJDDX-HNNXBMFYSA-N 384.863 5.330 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc(N4CCCC4)cc3)c2)c1 916840259 LVYXFVGOLBZJEW-UHFFFAOYSA-N 383.495 5.350 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)sc21 916846558 YYJXOACDIIUASZ-CQSZACIVSA-N 387.489 5.493 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3ccc(F)cc3)n2)cc1 916974780 QDIBGXCJYBBEPO-GBESFXJTSA-N 376.456 5.238 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 916977325 QBTQLHFNEDXPGG-OALUTQOASA-N 392.911 5.760 30 20 GKED Cc1ccc2c(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)coc2c1 917046693 MGKZHYMXHRKIGC-HNNXBMFYSA-N 380.856 5.423 30 20 GKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140603 ALPLBVXRHDVLDV-UXHICEINSA-N 390.508 5.579 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](Cc2nc(C)cs2)C1 931063282 WUAQQYLQHXJRPK-QGZVFWFLSA-N 383.561 5.400 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3ccccc3Cl)c2)c1 1776014855 ICIPYJSYSIGXPI-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CC(CCCCCCC(=O)O)=NNc1ncnc2sc(-c3ccccc3)cc12 1776021302 QFDDRGLBLCKZGF-UHFFFAOYSA-N 396.516 5.571 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(OC(F)F)cc3)cc2)cc1 1776040804 VURSZXUZNWOGGV-UHFFFAOYSA-N 382.366 5.099 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccccc1Oc1cc(Cl)cc(Cl)c1 1776148928 QSHFMNUBSVQRGR-INIZCTEOSA-N 380.271 5.295 30 20 GKED C[C@H]1/C(=C\c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2c(O)ccc(F)c21 1776586541 CCCPORPEKDANDG-KBVGCWLLSA-N 394.423 5.341 30 20 GKED CCCCCCCOc1ccc(/C=C/c2ncc(C(=O)O)c(C(C)C)n2)cc1 1776788226 RRBHAKMSPUTWCY-SDNWHVSQSA-N 382.504 5.818 30 20 GKED CCCCCCCOc1ccc(CNc2cc(CCC(=O)O)ccc2OC)cc1 1776788915 ANUFRYXBSNJUHL-UHFFFAOYSA-N 399.531 5.674 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786612468 FGTKYPUZVOEZSK-DYESRHJHSA-N 394.490 5.044 30 20 GKED CCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 41549056 VNINDPNBQBOQCM-CQSZACIVSA-N 390.386 5.204 30 20 GKED CCc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)sc1C 47993180 QUFQDDVGUAQBJB-UHFFFAOYSA-N 377.469 5.239 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-c2cnco2)c1 48205363 ZHUSMSRJJBRICF-UHFFFAOYSA-N 397.459 5.617 30 20 GKED N#C[C@@H](C(=O)Cc1cccs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 51284693 NIFUZVOQRPKQEQ-ZDUSSCGKSA-N 393.320 5.597 30 20 GKED CC(C)Cc1ccc(C(=O)/C(=C(\S)NC2CCCCC2)[n+]2ccccc2)cc1 55013028 QRKVSCTUNHNYRP-UHFFFAOYSA-O 395.592 5.034 30 20 GKED Cc1sc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)c(C#N)c1C 104907446 HXEOLHNZSIDGSG-UHFFFAOYSA-N 387.917 5.195 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cccc(OCCCC#N)c2)c1 108292221 QNKWNRYLSHOUBK-GOSISDBHSA-N 380.488 5.207 30 20 GKED CCc1cccc(CC)c1NC(=O)CNc1ccccc1SC[C@@H](C)C#N 108408324 YNNSEZAVJNRRSB-INIZCTEOSA-N 381.545 5.114 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1c[nH]c2ccc(F)cc12 117007178 UURCCAQAXKJHFO-AWEZNQCLSA-N 396.491 5.065 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc1 135483814 HFJACJHPVBEBGT-MRXNPFEDSA-N 395.478 5.247 30 20 GKED CCS[C@@H](C)c1noc(CNc2cccc(Oc3ccc(C#N)cc3)c2)n1 157743655 LLSDGZXJRWIOOL-AWEZNQCLSA-N 380.473 5.160 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)Cc1cccc(OCC#N)c1)C1CC1 179430212 UTCPEEXKQCIIBN-SFHVURJKSA-N 384.479 5.037 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(N2CCCCCC2)c1 184035448 JOSUTEJRFLTCQR-QGZVFWFLSA-N 378.476 5.002 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)c(F)c1 192630732 IXAVYYVFTXMXIK-OAQYLSRUSA-N 382.385 5.178 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2cc3sc4ccccc4c3s2)nc2ccccc21 195556796 QOSZFNVBGNGKGZ-ZDUSSCGKSA-N 387.489 5.493 30 20 GKED N#CCCN(CC(=O)Nc1ccc(N=Nc2ccccc2)cc1)Cc1ccco1 255423169 VEBSBZPYTLUDOV-UHFFFAOYSA-N 387.443 5.049 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1cccc(Cl)c1Cl 303850576 OIAAMGVGTPGMKF-RWSFTLGLSA-N 397.664 5.270 30 20 GKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)[C@@H]1CCCC[C@H]1C(F)(F)F)C(O)=N2 329399604 YJSISNPWRCJLGS-SQWLQELKSA-N 382.426 5.650 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@H]1CCCN1c1ccccc1 330235650 UAZSDSKXWJCNRY-NHCUHLMSSA-N 378.520 5.001 30 20 GKED CC(C)CN(CCCC1(C#N)CCOCC1)Cc1ccccc1Br 410412441 BOGZMNPQYQWPCB-UHFFFAOYSA-N 393.369 5.008 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1cccc(OC(F)F)c1 438641926 ONLXSBOEOQXFNV-JTQLQIEISA-N 399.319 5.061 30 20 GKED CCOc1ccc(NC(=O)c2ccc(C(F)(F)F)c(F)c2)c(C(F)(F)F)c1 439118868 PHIZDEUKGVKCOF-UHFFFAOYSA-N 395.274 5.514 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(c3ccc(C#N)cc3)C2)n1 447690065 AVNPBWGTUMQLCN-QGZVFWFLSA-N 375.497 5.074 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 455211516 CBCGHXVCRASIKA-LJQANCHMSA-N 385.895 5.684 30 20 GKED C[C@H]1CN(C)c2ccccc2N(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 460331652 BUOXWZDGDVKRDO-SFHVURJKSA-N 397.478 5.083 30 20 GKED C=C(C)[C@H](NCc1nc2ccc(Br)cc2o1)c1ccc(F)c(F)c1 463201491 JAXRPPYWUMSVLA-SFHVURJKSA-N 393.231 5.276 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnc(-c3ccc(OC)cc3)s2)c1 463558552 QXSWHNUDFAGCTF-UHFFFAOYSA-N 380.469 5.026 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H](C)c2ccc(C(F)(F)F)cc2)cc1 467249675 GJWPBLGPBLQHQD-OAHLLOKOSA-N 390.405 5.154 30 20 GKED CSc1cccc([C@@H](NCc2ccc(F)c(C#N)c2)c2ccc(F)c(F)c2)c1 467770076 JUJAENXECBUJNL-JOCHJYFZSA-N 398.453 5.577 30 20 GKED COC1CCC(C)(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 471273561 QKOOGNVELCWBPJ-UHFFFAOYSA-N 393.487 5.067 30 20 GKED CC[C@H](c1ccccc1)c1nnc(NC(=O)C[C@H](CC#N)c2ccccc2)s1 475756152 CKRIGBOPKGVMEM-RBUKOAKNSA-N 390.512 5.106 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccc(CO)cc3)cc2)cc1 476370951 GHCXXGCDGQMLNH-UHFFFAOYSA-N 386.451 5.025 30 20 GKED C=CCCC1(C(=O)N2CCC[C@H](Cc3nc(C4CCCCCC4)no3)C2)CC1 476484464 SICPDSHNPSLEHW-GOSISDBHSA-N 385.552 5.035 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@@H](c1ccccc1)C(CC)CC 480570327 ULYKXAZEOFKOKJ-JOCHJYFZSA-N 384.520 5.037 30 20 GKED C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(Cl)c(C#N)c1 482119496 FTCWALIIBJZVFE-AWEZNQCLSA-N 391.858 5.008 30 20 GKED N#Cc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1F 484092225 KLUISVBTKFPJEA-OAHLLOKOSA-N 376.275 5.109 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Br)c1)c1ccccc1 487247875 BDHUVFJRHAKKNZ-UFYCRDLUSA-N 397.316 5.104 30 20 GKED C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 487518891 YFQLJZOFIGSTHV-IFXJQAMLSA-N 391.298 5.312 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1)c1ccccc1 488695359 HKGWYMUTIVKGOT-GOSISDBHSA-N 384.907 5.168 30 20 GKED N#Cc1ccc(Br)c(CN[C@@H](c2ccccc2)c2cccc(F)c2)c1 492651069 JIOOWXNZPHURGG-NRFANRHFSA-N 395.275 5.339 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(F)cc2Cl)cc1C(F)(F)F 499486931 RCILMRAVLPEGBQ-UHFFFAOYSA-N 388.773 5.100 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(Cl)c(Cl)c2)cc1 510971005 WNBBMKXIWAZWMC-UHFFFAOYSA-N 387.188 5.070 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 515689329 TUYSOXYAGCRDCH-UHFFFAOYSA-N 391.477 5.564 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 517256733 IUQAGULZDLDRFC-HOYKHHGWSA-N 396.494 5.228 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cccc(OC(F)F)c3)cc2)c1 517508832 WFUNDUIQMVMIPR-UHFFFAOYSA-N 394.377 5.133 30 20 GKED N#C[C@@H](NC(=O)c1cc(C2CC2)nc2ccccc12)c1cccc(Cl)c1Cl 520888545 PATPMMFZUQDEAG-LJQANCHMSA-N 396.277 5.414 30 20 GKED C=CCCCN(C)C(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1 522979985 ACENQWPXZZUYQC-UHFFFAOYSA-N 391.559 5.057 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1 523783865 XHMBMRDRCXQUPN-GOSISDBHSA-N 385.467 5.362 30 20 GKED C=CC[C@H](C)NC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 523981736 KNVBYYMRZITHHC-ZDUSSCGKSA-N 391.393 5.044 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(NC(=O)CC(C)C)ccc2Cl)c1 525541004 UZNFBFNXZWJEDH-UHFFFAOYSA-N 386.879 5.142 30 20 GKED CC(C)c1nc2cc(NC(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)ccc2o1 531221186 LTUUKXPFOPJZSF-QUCCMNQESA-N 388.471 5.255 30 20 GKED N#CC1(CSc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)CC1 534305134 FPNJRJCKKRPFDY-UHFFFAOYSA-N 380.904 5.043 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C)c1ccccc1 534640260 DTDASTWLMODYMZ-UXHICEINSA-N 390.527 5.308 30 20 GKED C=CCC[C@@H](NCc1csc(-c2ccc(OC)c(OC)c2)n1)c1ccccc1 537155890 JHVQQNCCYUXPJH-HXUWFJFHSA-N 394.540 5.624 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1 538953676 FRKDPHJCDBHYLL-UHFFFAOYSA-N 394.418 5.080 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1OCc1ccccc1 539146539 GBAAUHJSIVZHRU-LJQANCHMSA-N 399.494 5.040 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 540632191 FWVNIIOFEHHQMT-HZPDHXFCSA-N 378.419 5.047 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 540693050 BMHNPFCKRQHGQD-UHFFFAOYSA-N 388.389 5.302 30 20 GKED Cc1sc([C@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 540708185 NHMIJDVIRRSTJN-OLZOCXBDSA-N 399.922 6.195 30 20 GKED Cc1ccccc1NC(=O)[C@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541076016 WESBITIUZJSWAA-MOPGFXCFSA-N 383.495 5.212 30 20 GKED Cc1cnc([C@H](C)NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541121184 ZOULNQMCMQQQDL-HOTGVXAUSA-N 390.512 5.112 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c1 541447236 SFWISKCWCGJYOI-MOPGFXCFSA-N 393.556 5.577 30 20 GKED N#CCCN(C(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)C12CC3CC(CC(C3)C1)C2 548602135 HGCJNPATUXAWBK-ATVGPOOMSA-N 384.539 5.006 30 20 GKED N#CCCCn1cc(C(=O)N2CC[C@@H]2c2ccc(Cl)cc2)c2ccccc21 553324693 NESDQHQVDCKYFI-HXUWFJFHSA-N 377.875 5.186 30 20 GKED C[C@H](Nc1ccc2c(c1)N(CC(F)F)CCS2)c1ccc(C#N)cc1F 560265857 JWHSNPWVFDYJEO-LBPRGKRZSA-N 377.435 5.048 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)NC2(c3cccc(C#N)c3)CC2)c1 582079071 QPAUUTWJJXIHFE-UHFFFAOYSA-N 382.463 5.043 30 20 GKED Cc1c(C(=O)N(C)c2cccc(C#N)c2)sc2ccc(Br)cc12 583300265 ISVUTLZXRAZMSU-UHFFFAOYSA-N 385.286 5.121 30 20 GKED C[C@]1(C#N)CCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)C1 596927807 JBTNRNUBEBVKEA-HXUWFJFHSA-N 396.903 5.130 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(F)cc2)cc1Cl 603673205 KVROKPMSKKLEAZ-FQEVSTJZSA-N 378.834 5.316 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 606942115 NILBDBZHDFWWLQ-UHFFFAOYSA-N 383.467 5.288 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(Cl)s1 609062004 QSDUJYHWHXGMMJ-UHFFFAOYSA-N 382.872 5.413 30 20 GKED Cc1nc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)sc1C 609723344 HOPNTLBFKMXCCK-UHFFFAOYSA-N 383.860 5.330 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N[C@@H](C#N)c2ccc(F)cc2)cc1F 609761503 MYIGVKCLGKMWIN-NRFANRHFSA-N 380.369 5.074 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610318115 LONOSYVMGJNUTR-MRXNPFEDSA-N 387.439 5.242 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C2(c3ccc(Cl)cc3)CCCC2)cc1 641906425 CGZUBPXMULNKDH-UHFFFAOYSA-N 397.906 5.098 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 666170770 ZTNLPCUFNSHOFI-JTQLQIEISA-N 397.290 5.402 30 20 GKED O=C(C/C=C/c1ccc(F)cc1)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 673829617 AAVFNJSWZPIRFG-DKZVVXNFSA-N 397.334 5.255 30 20 GKED N#Cc1ccc(NC(=S)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1Cl 726451861 QNZMGVIVZMIENL-UHFFFAOYSA-N 392.915 5.179 30 20 GKED C#CCOc1cccc(NC(=O)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)c1 731112512 KNMXWIHXIAOBPG-OAHLLOKOSA-N 391.496 5.013 30 20 GKED N#CCOc1ccc(CSc2nnc(-c3ccccc3)n2-c2ccccc2)cc1 731156346 PSRVUZSZDQXJCE-UHFFFAOYSA-N 398.491 5.129 30 20 GKED COc1cccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 731320474 VJPPSBREUNISBK-UHFFFAOYSA-N 375.453 5.168 30 20 GKED O=C(/C=C\c1c(Cl)ccc(Cl)c1Cl)c1ccc(C(F)(F)F)nc1O 731565057 ZFCNNLKMGNDMME-KTAJNNJTSA-N 396.579 5.662 30 20 GKED C=CC[C@@H](NC(=O)NCC1(c2ccc(F)cc2)CCCCC1)c1ccncc1 734663120 HKOOLZVICXAAMA-OAQYLSRUSA-N 381.495 5.039 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C)c1ccncc1 734679487 HUYPXYSXSZBRKW-LJQANCHMSA-N 391.437 5.338 30 20 GKED O=C(/C=C\c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cncc(F)c1 737445107 WBEDONSSRXOTBT-CLTKARDFSA-N 398.777 5.471 30 20 GKED CCc1ccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 739436937 FEVMBBMJVUVBDJ-UHFFFAOYSA-N 377.538 5.336 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=S)Nc3ccc4c(c3)CCC4)c2)s1 739437897 QXHBYLRRRIQDFS-UHFFFAOYSA-N 389.549 5.262 30 20 GKED CC(C)(C)N(N=Cc1c[nH]c2ncccc12)C(=S)Nc1cccc(Cl)c1 741762605 PIKJZMJDGXTWAG-UHFFFAOYSA-N 385.924 5.048 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(C#N)c1 743095488 KOVUMUUBHVSHBP-UZUQRXQVSA-N 380.451 5.096 30 20 GKED Cc1cc(CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)ccc1Br 751824881 CUFBRFYPQPFJQO-KRWDZBQOSA-N 393.284 5.115 30 20 GKED N#CCOc1ccc(CNc2nnc(-c3cc(Cl)cc(Cl)c3)s2)cc1 754475826 YYJNFVXGFKNOSC-UHFFFAOYSA-N 391.283 5.026 30 20 GKED Cc1nc([C@@H](C)OC(=O)c2ccccc2OCC#N)oc1-c1ccc(Cl)cc1 763942743 HZDUQZJYEBFCOY-CQSZACIVSA-N 396.830 5.124 30 20 GKED CC(C)(CC#N)COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 764842809 DUUFJRGHCQPLLQ-UHFFFAOYSA-N 379.243 5.277 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc4[nH]ccc4c3)n2)cc1 765938607 ZABPQRQOHIKKFY-JFKHNGDKSA-N 399.475 5.190 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(Br)cc1F 767736927 OMGNOWLDKJXKLK-RQOWECAXSA-N 389.249 5.003 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2csc(-c3csc(C)n3)c2)c1 772982086 DOQPEMGQDYFYKO-RDTXWAMCSA-N 397.569 5.712 30 20 GKED N#CCC[C@H](NCc1nc2ccc(Br)cc2s1)c1ccccc1 774995283 AJLPOYXUQVCUAT-HNNXBMFYSA-N 386.318 5.193 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)[C@H](O)c1c(Cl)cccc1Cl 777177492 FENPADQGKDMUKH-SGTLLEGYSA-N 396.339 5.123 30 20 GKED O=C1/C(=C\c2cccc(-c3cccnc3)c2)CCc2ncc(C(F)(F)F)cc21 777470612 UPJYPDJDTLYZQT-YBEGLDIGSA-N 380.369 5.375 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCC1=Cc2cc(Cl)cc(Cl)c2OC1 779993015 LEVPQVNKYLRKBK-LBPRGKRZSA-N 375.255 5.172 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cc(Cl)ccc1N1CCCCC1 780459425 SBHRRBKNYJIIKL-OAHLLOKOSA-N 398.894 5.265 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2c(Cl)nc(Cl)n2-c2ccccc2)c(F)c1 781111930 RXVDUYPOWUBBNH-HJWRWDBZSA-N 386.213 5.086 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@@H](C#N)c2nccc3ccccc23)s1 792095021 SGBOYRSVSXHXLH-MRXNPFEDSA-N 389.505 5.147 30 20 GKED Cc1cc(OCCCC(=O)[C@H](C#N)c2nccc3ccccc23)ccc1Cl 792103081 KJHOTKDDUGQKPP-IBGZPJMESA-N 378.859 5.232 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(F)(F)CC1)c1ccc(C(F)(F)F)cc1 793008216 KLOGNSUEYJXSQQ-HNNXBMFYSA-N 376.369 5.153 30 20 GKED CC(F)(F)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 794222955 UABDBNKFYWTAGN-NRFANRHFSA-N 376.406 5.706 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(SC(F)(F)F)cc2)s1 797568246 PGFCYKBKQORACB-GFCCVEGCSA-N 384.448 5.543 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3ccc(SC)s3)cc2c1C 798231994 NGFQLWPBEPXLMR-GQCTYLIASA-N 389.523 5.071 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)OCCCC2(C#N)CCOCC2)c1 800192660 GXKQELRMFWRFMD-UHFFFAOYSA-N 393.483 5.010 30 20 GKED C#C[C@H](NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc(Cl)cc1 811949987 RMBRPCVCXFIEEV-SFHVURJKSA-N 399.277 5.072 30 20 GKED C=CCC(F)(F)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 816131440 WALOITUGYRUEGE-UHFFFAOYSA-N 378.806 5.051 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]1Cc1ccccc1)c1nc2ccccc2n1C(F)F 850768896 AVKANZCGDDRSFC-RCCFBDPRSA-N 393.437 5.267 30 20 GKED COC(=O)c1ccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)cc1F 853355975 MKFBEKXWPVSMLY-UHFFFAOYSA-N 388.283 5.065 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)CSc1ccc(C(C)C)cc1 915824418 NTDGIVGCEKJBSW-UHFFFAOYSA-N 375.877 5.041 30 20 GKED Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1/C=C\C(=O)c1ccncc1 916136411 NIVNZOYFQBUJBW-WAYWQWQTSA-N 391.780 5.144 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCC(=O)c3cccs3)n2)cc1 916627222 GYXQJYCGQLYYKP-OAHLLOKOSA-N 380.494 5.019 30 20 GKED CCSCc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 917669065 MVKXGSMKOVJHMZ-QHCPKHFHSA-N 386.520 5.847 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)c1ccc(C2SCCCS2)cc1 921197158 YOAWPXSFRXMMQC-UHFFFAOYSA-N 385.510 5.045 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1ccc(CC(=O)O)cc1 1776085676 DSJSTZJQRLNJMH-UHFFFAOYSA-N 394.858 5.514 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccccc2SC(F)(F)F)cc1)C(=O)O 1776470533 ZEZQLHADGYAIKA-KGTBHZDVSA-N 396.386 5.047 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2F)s1 1776782687 ALBRSKWVOGJYRB-MRXNPFEDSA-N 377.525 5.848 30 20 GKED CCCCCCCOc1ccc(CNCc2c(C)sc(C)c2C(=O)O)cc1 1776787030 MXIGZHCTCFKFIY-UHFFFAOYSA-N 389.561 5.702 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(-c2ccc(F)cc2)s1 1777640977 KMMXJZXHKFEYKD-YFHOEESVSA-N 396.439 5.304 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2C(=O)c2ccc(F)cc2)cc1 25841748 GCWJQVMCSSJOTM-UHFFFAOYSA-N 386.426 5.110 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(F)cc2)[n+]2ccc(C)cc2)cc1 27205277 WZCPOQJWKHJLRM-UHFFFAOYSA-O 393.507 5.035 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1 33224034 OOEYCYWGRKOLAE-INIZCTEOSA-N 376.481 5.032 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccccc2C)cs1 54897259 PUDWYVJNHLWFAA-XFXZXTDPSA-N 396.899 5.686 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc(Cl)c2)nnc1-c1ccccc1OC 60426841 OWWGOAVMFXRRQO-AWEZNQCLSA-N 385.920 5.646 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CNc1cccc(C(F)(F)F)c1 66931912 WQWUPYYFJIPNHC-CYBMUJFWSA-N 393.434 5.150 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3SC[C@H](C)C#N)c2cc1C 68782282 STBZRFVUTPOMHB-CQSZACIVSA-N 378.497 5.274 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1 107320417 GZMOAEYIXIDZLD-AFMDSPMNSA-N 398.506 5.182 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2sc(C(C)(C)C)nc2C)cc1OC 110087995 CRTVHEYINAKLAJ-MDZDMXLPSA-N 389.517 5.061 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC1CC(c2ccccc2)C1 112530346 QERQRFSXRDMZCO-UHFFFAOYSA-N 384.504 5.385 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1ccc(CC#N)cc1 127869010 GDTYERUUEPZUSW-MRXNPFEDSA-N 390.512 5.410 30 20 GKED CC(C)Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 153383865 AEFANUCWLJGPNK-HXUWFJFHSA-N 389.524 5.213 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F 159062326 VUHFNKWKQLKOEY-UHFFFAOYSA-N 399.514 5.021 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 160112506 DROHOBYIXNWHRL-CQSZACIVSA-N 397.450 5.458 30 20 GKED COc1ccc(CN(C(=O)N[C@@H](CCC#N)c2ccccc2)[C@H](C)C2CC2)cc1 160619569 JXGCVVXSMMVELQ-JPYJTQIMSA-N 391.515 5.050 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1coc(-c2ccccc2)n1 173121557 WBWCXIRNUXEOQZ-HNNXBMFYSA-N 392.484 5.058 30 20 GKED C=CCOCCCC(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 175130019 XHJSZHSTQFTTMW-UHFFFAOYSA-N 381.259 5.102 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 175133001 QRNIXPVETXSYSG-NRJHKNTJSA-N 387.439 5.101 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)CC1(c2ccccc2)CC1 190187328 RGDVKHGGLMIDAI-QGZVFWFLSA-N 379.529 5.276 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]2[C@@H](CCCN2C2CC2)C1 191433585 MHFXQRWZWMYLLJ-SIKLNZKXSA-N 381.564 5.019 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(C2CCCCC2)CC1 191495127 RUPXFSJWVLNXBN-UHFFFAOYSA-N 383.580 5.457 30 20 GKED N#Cc1c(NC(=O)c2ccc(C3SCCS3)cc2)sc2c1CCCC2 192661789 JBTNBIZLQHOSFG-UHFFFAOYSA-N 386.567 5.229 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)c(C)n1[C@@H](C)c1ccccc1 193536973 XXPLFEXOEOQODK-JXFKEZNVSA-N 383.451 5.346 30 20 GKED N#Cc1ccccc1/C=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 255865083 QXUXJYHOOVMYEI-VOCYLRNQSA-N 389.867 5.225 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)CCCCOc1cccc(C#N)c1)C1CC1 303524189 VLSOFMPDPBKREG-QGZVFWFLSA-N 396.918 5.513 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c1C#N 410933110 WBDVNNVAJVOLBW-UHFFFAOYSA-N 397.378 5.097 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@@H]3C)s1 410992448 WZSILTJYORCTOK-SDDRHHMPSA-N 389.546 5.112 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CC(C)(C)Oc2ccccc21 413418440 XYXQMWZTXJDMBG-NVXWUHKLSA-N 380.513 5.222 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CC(F)F)c1ccccc1 421055695 HDJBKSOXCVDXKG-PBHICJAKSA-N 389.471 5.599 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](C)c1ccccc1 428853539 ATWIDKZJJFENSG-OALUTQOASA-N 395.572 5.348 30 20 GKED N#CCC1(CNC(=O)[C@@H](Sc2ccc(F)c(Cl)c2)c2ccccc2)CC1 431131444 BNDYLAUVJWPPDS-SFHVURJKSA-N 388.895 5.123 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(C)(F)F)cc1 431940483 UVJACPLMDFIVMI-UHFFFAOYSA-N 393.393 5.418 30 20 GKED Cc1c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cccc1C(F)(F)F 433284163 DNNJOEOYFBVQAN-SFHVURJKSA-N 375.394 5.571 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 437030094 IUSMWCLKJLAABR-SJCJKPOMSA-N 386.339 5.921 30 20 GKED Cc1cc(C)cc(C[C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 438038493 NMTOVXLQOHKTSZ-MSOLQXFVSA-N 381.545 5.450 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)c(F)c1 445906567 HKKWAQVPYSHIQR-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1 455950641 XXJAJJPGVBKQLO-UHFFFAOYSA-N 390.512 5.161 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458798138 HGBHTJISJJBBMP-IEBWSBKVSA-N 398.576 5.713 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2c(F)cc(F)cc2[C@H]1C 475580578 FVHVELDCGZSRBD-OAHLLOKOSA-N 384.470 5.968 30 20 GKED Cn1c(-c2ccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)cc2)nc2ccccc21 475584474 SHLXLIHZPVLFKR-UHFFFAOYSA-N 394.478 5.294 30 20 GKED CCCCN(C(=O)C[C@@H](CC#N)c1ccccc1)C1CC(C)(C)NC(C)(C)C1 475664481 ZCILFXWUWVUQCP-HXUWFJFHSA-N 383.580 5.012 30 20 GKED C[C@@H]1C[C@@H]1[C@@H](NCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccc(Cl)cc1 478388688 UGSOYHDMQXJXIQ-XFEVJDRUSA-N 390.918 5.099 30 20 GKED CCc1ccc(-c2nc(CC(=O)N(C)c3cc(Cl)ccc3C#N)cs2)cc1 479567642 PSEADFVEHLKAPK-UHFFFAOYSA-N 395.915 5.103 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 479631851 HAFOJRWFSDUJJB-INIZCTEOSA-N 388.471 5.387 30 20 GKED C[C@H](NC(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)c1ccc(C#N)cc1 480354051 WTWTYHVWZYAQBK-STSQHVNTSA-N 391.515 5.536 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(OCc3ccccc3F)cc2)cc1 483551666 KMRIILWLTUMFLR-UHFFFAOYSA-N 392.455 5.007 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(Br)ccc1Cl 486244456 MVFAVVWCGKBENF-UHFFFAOYSA-N 382.710 5.633 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1cc2ccccc2o1 486615469 LBIALXKGCBUWCW-UHFFFAOYSA-N 377.469 5.082 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(F)c(NC(=O)c2ccoc2C)c1)c1ccccc1 488625443 IXHCDFPUIDPJCJ-LJQANCHMSA-N 392.430 5.278 30 20 GKED N#C[C@@H](NC(=O)c1cccc(Oc2ccncc2)c1)c1cccc(Cl)c1Cl 505345099 REYBRPZMGIXRQZ-GOSISDBHSA-N 398.249 5.175 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2c(F)cccc2F)C(F)(F)F)cc1 506254275 MKCSLNMLKZYMLY-INIZCTEOSA-N 397.347 5.191 30 20 GKED COc1c(Cl)cc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1Cl 506310127 YQQQWEQJUNLGJS-UHFFFAOYSA-N 397.261 5.793 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl 509616404 IETBMGZEHAVDJF-UHFFFAOYSA-N 388.254 5.386 30 20 GKED Cc1cccc([C@@H](NCc2ccc(C#N)cc2Br)C(F)(F)F)c1 510470753 JEMQFFROQIHVHG-MRXNPFEDSA-N 383.211 5.022 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1c(F)cccc1F 510645476 DYEOZOJBYGIMKH-CQSZACIVSA-N 393.393 5.511 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(-c2ccccc2F)n1 512517597 YMLOWZXJNXARDX-UHFFFAOYSA-N 384.524 5.305 30 20 GKED C[C@@H](N[C@H](C)c1c(F)cncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 513237283 XIKPENQGBFBMCO-RKDXNWHRSA-N 398.297 5.809 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(CC)no2)nnc1-c1ccc(C(C)(C)C)cc1 513956182 VIYVQYYABZGHML-AWEZNQCLSA-N 397.548 5.227 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C)C(=O)Nc1c(C)cccc1C 516380852 JFLWPFXKNCSMAZ-LJQANCHMSA-N 399.494 5.715 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517128376 UICZEZJRGAAKJN-DEOSSOPVSA-N 397.478 6.028 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(-c2cccc(Cl)c2)n1 518362790 YQGPQZKVYJWYDU-UHFFFAOYSA-N 399.928 5.722 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 519330830 BMTBEWMSQKXLMN-AWEZNQCLSA-N 377.941 5.441 30 20 GKED Cc1cccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 521811667 POYAQESMCNLFBG-KRWDZBQOSA-N 381.545 5.489 30 20 GKED CC(C)(C)[C@H](Cc1ccccc1C(F)(F)F)NCCCC1(C#N)CCOCC1 521944050 FQFNLIGHAODPFN-IBGZPJMESA-N 396.497 5.353 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCOc2c(CC)cccc21 523916812 HNCVMJCXJWVXDE-KRWDZBQOSA-N 390.936 5.185 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(OCc2ccccc2C#N)c1 524512291 NUOTULZYDBLEQD-DVECYGJZSA-N 396.490 5.155 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(F)cc2)c2cccs2)c(OC(F)F)c1 531233836 TYWWELPEJXYLSI-LJQANCHMSA-N 388.414 5.239 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cc1 533920973 JEPRPUOCHALJSC-UHFFFAOYSA-N 387.826 5.322 30 20 GKED C=CCCOCCN[C@@H](C)c1sc(-c2ccccc2Br)nc1C 539052389 XTFGQIGRRQWLJE-ZDUSSCGKSA-N 395.366 5.124 30 20 GKED CC1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)CC1 540963975 IYQNRYUXXKWNCO-ICFOKQHNSA-N 397.478 5.080 30 20 GKED C[C@H](NC(=O)c1ccn(C2CCCC2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542040214 YLQFHIPGBXLTKV-KRWDZBQOSA-N 384.483 5.028 30 20 GKED N#C[C@H](C(=O)c1ccc(SC2CC2)cc1)c1nc2ccccc2n1C(F)F 542127557 CHBDJCMRFBGPSW-OAHLLOKOSA-N 383.423 5.176 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCC[C@H]2CCCCO2)c1 546161128 LHUNWTIKFPRXCA-QGZVFWFLSA-N 398.890 5.083 30 20 GKED N#Cc1cc(NCc2ccc(CO)o2)ccc1Oc1ccc(C(F)(F)F)cc1 555759634 DPZUJHKXRJKJMJ-UHFFFAOYSA-N 388.345 5.067 30 20 GKED N#Cc1c(NC(=O)c2coc(-c3ccccc3Cl)n2)sc2c1CCCC2 557876487 RYLRLJYOPCEHKX-UHFFFAOYSA-N 383.860 5.059 30 20 GKED COc1ccc([C@@H](C)N[C@@H](C#N)c2ccc(Cl)cc2)cc1Br 585718986 GPAQPXFMQLTHDG-BZNIZROVSA-N 379.685 5.027 30 20 GKED Cc1nc2ccccc2n1Cc1cc(NC(=O)CCCCCC#N)ccc1Cl 588360287 SXSPFSACZPMQKT-UHFFFAOYSA-N 394.906 5.459 30 20 GKED Cc1nc2ccccc2n1Cc1cc(NC(=O)CCCCC#N)ccc1Cl 593975448 LBVVEXNQDKNKOG-UHFFFAOYSA-N 380.879 5.069 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c(C)s1 595471229 LCNCAWZYCUYYOP-HNNXBMFYSA-N 395.311 5.016 30 20 GKED N#CC1(c2ccc(CN3CCC(c4nc(C(F)(F)F)cs4)CC3)cc2)CC1 597136707 IUGDOYRXRHEOJS-UHFFFAOYSA-N 391.462 5.097 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)c1sc2cccc(C)c2c1Cl 603521317 BEGGTSYNQAWDGY-UHFFFAOYSA-N 398.915 5.024 30 20 GKED CSCc1c(C(=O)N(Cc2ccc(C#N)cc2)C(C)C)oc2ccccc12 603527422 PBBVGNBPSGGHJV-UHFFFAOYSA-N 378.497 5.218 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccccc2)cc1Cl 603673243 QKMTUBWSORIMFY-HXUWFJFHSA-N 376.843 5.013 30 20 GKED CC(=O)N(c1nc(CSc2cc(C#N)ccn2)cs1)c1ccc(C)cc1C 603727013 XQZHEDWWIWGVLH-UHFFFAOYSA-N 394.525 5.004 30 20 GKED N#Cc1c(NC(=O)CSc2ccc(F)cc2)sc2c1-c1ccccc1CC2 603991551 MDGXGOXWQDBJEB-UHFFFAOYSA-N 394.496 5.255 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)CC2)c1 608876638 QFCNWIHOHLXZGB-UHFFFAOYSA-N 383.451 5.033 30 20 GKED Cc1occc1CNC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079909 LEHVIIMCWMKQEU-UHFFFAOYSA-N 395.846 5.014 30 20 GKED CN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@H]1CCc2ccccc21 609209181 UASSOCWZRYPALH-QHCPKHFHSA-N 383.451 5.502 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CSc2ccccc21 609791623 PLULZQKMNIIYJG-GOSISDBHSA-N 388.517 5.286 30 20 GKED C[C@H](NC(=O)Nc1ccccc1CN1CCc2ccccc21)c1cccc(C#N)c1 610321925 SOUOGNBIOYTCLN-SFHVURJKSA-N 396.494 5.004 30 20 GKED C[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cccc(C#N)c1 611084181 OMHVEJJXBPBPQE-GFCCVEGCSA-N 388.323 5.839 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@@](C)(C#N)C1 612305163 JXWRAPMPNAGWRR-JPYJTQIMSA-N 377.488 5.293 30 20 GKED N#Cc1ccccc1CN[C@@H](CC(F)(F)F)c1ccc(Br)cc1 612539109 RAQYMCTYZNIOHB-INIZCTEOSA-N 383.211 5.104 30 20 GKED CC(C)c1c(C(=O)N[C@H](C)c2cccc(C#N)c2)cnn1-c1ccccc1Cl 616357445 GHDUEXFPYSXBSK-OAHLLOKOSA-N 392.890 5.012 30 20 GKED CC(C)c1ccc(C[S@@](=O)CCCC2(C#N)CCOCC2)c(C(C)C)c1 619589488 DKJZKTOQUWVLGU-SANMLTNESA-N 375.578 5.283 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)sc2cc(F)ccc12 672460262 AFYLJCCFAYFQAJ-PHIMTYICSA-N 399.331 5.162 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1nccc2ccccc12 682993855 CDZBTONJMYEIEI-JOCHJYFZSA-N 382.394 5.656 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccccc2)c2cc3ccccc3o2)c1 726449781 KHGAEXXTKQUWBX-QHCPKHFHSA-N 382.488 5.490 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(O)c(C)c2)cs1 728230221 BMCVMQLHYOUGQW-YRNVUSSQSA-N 392.480 5.046 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)c1 729644220 STARFPIPMBWJBV-SEYXRHQNSA-N 383.447 5.515 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\CCc1nc(-c2ccc(Cl)cc2)no1 731562440 ZEPOZCWLBQWMHP-NKVSQWTQSA-N 396.661 5.064 30 20 GKED N#CCCN(C(=O)c1ccc(C2SCCCS2)cc1)c1ccc(F)cc1 732093371 BBHQYQGXDYLLOS-UHFFFAOYSA-N 386.517 5.255 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 733921047 LVSYAGQCYVGRTE-QGZVFWFLSA-N 398.434 5.566 30 20 GKED Cc1ccc(-c2nnc(S)n2N=Cc2ccc(-c3ccc(F)cc3C)o2)cc1 734297485 NUGJAHPJVKIOOX-UHFFFAOYSA-N 392.459 5.132 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)/C=C\c3ccnc4ccccc34)c2)s1 739595017 CIFGASDGBSLOSK-FLIBITNWSA-N 395.487 5.165 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3nccc4ccccc34)s2)cc1 740765498 DHPPYPHKAUYQRP-QXMHVHEDSA-N 386.476 5.571 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1)c1cccc(C(F)(F)F)c1 744159474 CTWWADYSFQALMS-WQMJKPAKSA-N 383.373 5.170 30 20 GKED COc1cc(/C=C/C(=O)c2cc3ccccc3o2)ccc1OCC(F)(F)F 750896061 MPDPUUWDWDHUHA-SOFGYWHQSA-N 376.330 5.279 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ncc(Cl)s3)cc2Cl)c1 770667331 PLNUEYPDWOYNIG-UHFFFAOYSA-N 390.295 5.513 30 20 GKED Cc1nc(NC(=O)c2ccccc2SCC#N)sc1Cc1ccc(F)cc1 772124175 PXEYNKIVNJNPCC-UHFFFAOYSA-N 397.500 5.049 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)N[C@@H](C)c1ccc(OCC#N)cc1 776165234 ZARLZGHVFFUULH-KKSFZXQISA-N 386.923 5.689 30 20 GKED Cc1sc(NC(=O)Cc2ccccc2CC#N)nc1-c1cccc(Cl)c1 776747166 YRRCVWKODWTTGV-UHFFFAOYSA-N 381.888 5.019 30 20 GKED Cc1cc(Br)cc2cc([C@@H](NCc3ccc(C#N)cn3)C(C)C)oc12 783294876 XQNRDBHNUSITJE-IBGZPJMESA-N 398.304 5.257 30 20 GKED N#CC1(NC(=O)/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCCC1 787728142 CDFVIKMKTJZLQU-SNAWJCMRSA-N 390.327 5.080 30 20 GKED N#C[C@@H](C(=O)CCCCc1nc2ccccc2s1)c1nccc2ccccc12 792095644 WFXCWCNXJAZCRA-SFHVURJKSA-N 385.492 5.434 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OC(=O)C2(C#N)CCCCC2)c(Cl)c1 792136607 BZYBAKJSXIENDI-UHFFFAOYSA-N 378.856 5.066 30 20 GKED COc1ccc(-c2cc(NCc3cccc(C#N)c3F)ccc2OC(F)F)cc1 797853617 JFLFSXLVEXDNNB-UHFFFAOYSA-N 398.384 5.586 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c2ccccc21 813212972 GYFVBFXKENBYQJ-ZOCIIQOWSA-N 386.417 5.594 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813214791 DOESSAPHVVVGSY-PWSUYJOCSA-N 384.810 5.111 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cc(C(F)(F)F)ccn1 813215413 XZQOXJVGELDCFP-MJBXVCDLSA-N 399.199 5.387 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H]2c3cccc(Br)c3CC2(C)C)cc1 813790025 FOKXVSVIWABDOE-XOBRGWDASA-N 399.332 5.153 30 20 GKED O=C(O)c1cc(NN=Cc2c(Cl)ccc(Cl)c2Cl)ccc1Cl 818201463 XRJRBWCBEUOKKU-UHFFFAOYSA-N 378.042 5.444 30 20 GKED Cc1nc(SCC(C)C)sc1CC(=O)[C@H](C#N)c1nc(C(C)C)cs1 850874364 ZLMFLMUOOYJXOC-ZDUSSCGKSA-N 393.603 5.199 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 887764113 QAGXXTAETDXDFN-DEYYWGMASA-N 397.466 5.135 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(-c3ccc(C(F)(F)F)s3)no2)cc1 904971007 HCCOCKTWLVNALS-CYBMUJFWSA-N 390.390 5.030 30 20 GKED Cc1cc(C2=NNC(=Nc3ccccc3F)SC2)c(C)n1Cc1cccs1 916230048 DFQZBWHGDSTSSS-UHFFFAOYSA-N 398.532 5.082 30 20 GKED O=C(/C=C/c1csc([N+](=O)[O-])c1)c1cc2cc(Br)ccc2o1 917143386 ZYEAFNMGYREUSP-HNQUOIGGSA-N 378.203 5.061 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2cccc(C(=O)O)c2C)cc1 1776086532 ZMSBLFZYYCGIGB-IBGZPJMESA-N 396.531 6.125 30 20 GKED Cc1c(NN=Cc2cc(Br)c3ccccc3c2)cccc1C(=O)O 1776090031 RFDKVDQDMPHEFQ-UHFFFAOYSA-N 383.245 5.055 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C/c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1776114285 KZVZXXCPMCKHRM-CXUHLZMHSA-N 396.439 5.652 30 20 GKED O=C(/C=C\c1cc(F)c(C(=O)O)c(F)c1)c1ccccc1OCc1ccccc1 1776126271 HWKWUQLMIOIDTH-KHPPLWFESA-N 394.373 5.138 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC)c(OCC(C)C)c1 1776784252 YNUXRHABFSSCIZ-LJQANCHMSA-N 379.541 5.023 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4ccccc4C(=O)O)cc3)coc12 1777449081 OWZYKJBOQLVPBL-SDNWHVSQSA-N 382.415 6.003 30 20 GKED CCCn1c(S[C@H](C)C(=O)Nc2ccccc2C#N)nc2cc(Cl)ccc21 5919598 LABCWXGVJMLPLO-CYBMUJFWSA-N 398.919 5.091 30 20 GKED C[C@@H](c1ccccc1)n1c(SCc2ccc(C#N)cc2)nc2ccccc2c1=O 6586043 HSWQBGBJQGXKDK-KRWDZBQOSA-N 397.503 5.170 30 20 GKED CCn1c(SCCC#N)nnc1-c1cc(-c2ccc(C)cc2)nc2ccccc12 15248033 RODLWIQNOAQXDM-UHFFFAOYSA-N 399.523 5.494 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2s1 41498028 XJWDCOXULSMJMV-HNNXBMFYSA-N 389.505 5.142 30 20 GKED Cc1nc(COc2cccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2)cs1 47375831 PCZWFFGNDLDWLG-FQEVSTJZSA-N 399.475 5.069 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccccc1 66953989 PNDIEFCFLJPKSD-PKOBYXMFSA-N 379.529 5.320 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 103012457 MQJDWBFHYDAWRE-LBPRGKRZSA-N 379.275 5.519 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1cccc(Cl)c1Cl 108145940 LYJSRHBGSMIHHK-GFCCVEGCSA-N 395.311 5.263 30 20 GKED C=C1CCN(C(=O)c2ccc(CSc3nc4ccccc4s3)cc2)CC1 111072582 WKMLZYMOFJEAFH-UHFFFAOYSA-N 380.538 5.381 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1 120673611 CXBOQNLFUQUENK-UHFFFAOYSA-N 398.340 5.051 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccncc1 136725796 JESFFGDDZZKQED-SUMWQHHRSA-N 381.888 5.229 30 20 GKED N#C[C@H](C(=O)[C@H]1SCCc2ccccc21)c1nc2cc(Cl)ccc2s1 174002461 AQDKPRWKOUBMDP-KDOFPFPSSA-N 384.913 5.157 30 20 GKED CN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](c1ccncc1)c1ccc(Cl)cc1 175131288 NIBUBMPVCMGBMI-OAQYLSRUSA-N 390.874 5.054 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2oc3ccccc3c2C)ccc1OC 180813576 XZIGNQUQJFUWFN-FUHWJXTLSA-N 378.472 5.282 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(CSc2ccccc2)cc1 182096858 QZCSAGGUBDMKRL-KRWDZBQOSA-N 388.492 5.522 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 195454433 CAUUEDMABBHHJZ-UHFFFAOYSA-N 391.496 5.221 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)cc1OC 206857984 CKSJEITYZSTGCF-HJWRWDBZSA-N 380.362 5.017 30 20 GKED COc1cc(C(=O)/C=C\c2cc(Br)cs2)ccc1OC(F)F 210063495 VAJGLGQIJYKKCI-ARJAWSKDSA-N 389.217 5.017 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1cccc(Cl)c1Cl 303389318 OJXWKQLRZRIEFK-OAHLLOKOSA-N 389.213 5.387 30 20 GKED OC1=NC2(CCC2)[C@@H](/N=C(/O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)CC1 328731145 GJRQCKOWCYXPGA-NSKAOLIHSA-N 384.442 5.133 30 20 GKED Cc1[nH]c2ccccc2c1C/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329481932 DOLACQLCDVJPCY-OAQYLSRUSA-N 376.504 5.365 30 20 GKED C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1ccccc1Cl 329776502 JZALTMAHZRUFLD-YWZLYKJASA-N 384.907 5.000 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2COc2ccccc2)s1 430631392 BIUUKORDSWOQIO-LJQANCHMSA-N 390.508 5.510 30 20 GKED Cc1csc(-c2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)n1 432839163 KALCQBMVIUHRBF-FQEVSTJZSA-N 390.512 5.675 30 20 GKED N#CCCC[C@@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1ccccc1 433027097 SUNXZQCYYADWCE-AREMUKBSSA-N 393.534 5.911 30 20 GKED Fc1ccc(F)c([C@@H](NCc2ccc(OCC(F)(F)F)cc2)C(F)F)c1 434664150 SRPMJCCNKDFUOA-OAHLLOKOSA-N 381.291 5.002 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(F)cn1 437031693 ABVSTIQIFAKIRO-MEBBXXQBSA-N 380.307 5.584 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccc(F)c1 437483048 QTATWAVZKHLBOF-CQSZACIVSA-N 378.378 5.371 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 438660752 NPPKVTVXFNZROK-WBVHZDCISA-N 399.491 5.285 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1COC)c1ccc(C(F)(F)F)cc1 442205019 WOSTWGQOSKJDKZ-GOSISDBHSA-N 392.421 5.681 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1cccc(OCCCC#N)c1 444012571 VUPJNCDMEPPKFQ-HXUWFJFHSA-N 376.422 5.461 30 20 GKED Cc1cc(Br)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)s1 457583328 RHOYOUKIUXXMHE-JTQLQIEISA-N 395.347 5.323 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1)c1ccccc1 458843482 POVHDRRZYDKKAA-FPOVZHCZSA-N 381.907 5.274 30 20 GKED COc1cccc2c1CCCN2C(=O)Nc1ccccc1S[C@H](C)CC#N 459392705 FASJOLAISDQTQV-OAHLLOKOSA-N 381.501 5.074 30 20 GKED N#CCc1ccc(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)cc1 462831687 IAGOKJDBJJGMEN-UHFFFAOYSA-N 375.859 5.270 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccn(-c2ccc(Cl)cc2)n1 467258010 WQNJERVVTIPMLU-OAHLLOKOSA-N 382.920 5.390 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 469247099 PWZQSNOYDAXEMI-MSOLQXFVSA-N 396.556 5.859 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 469895039 CBOYGMSMVDRMEN-LBPRGKRZSA-N 381.259 5.100 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCCc3cccc(C(F)(F)F)c3)CC2)cc1 472378263 BXAXNJUBEYWJMZ-UHFFFAOYSA-N 398.428 5.216 30 20 GKED C=C(C)[C@H](CC(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)OCC 474271235 IQZRSCWQQPPOPN-GJZGRUSLSA-N 397.359 5.186 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1COc2ccc(OCC)cc2C1 476131482 BZBGHEVSNZNVNM-LJQANCHMSA-N 379.500 5.127 30 20 GKED COc1ccc(-c2ccc(CNC(=O)C[C@@H](CC#N)c3ccccc3)cc2)cc1 476181012 XJPLVHJYGLDORF-HSZRJFAPSA-N 384.479 5.066 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2cccc(OCCCC#N)c2)s1 476365250 ORMBVGBYWJKMLE-UHFFFAOYSA-N 391.496 5.362 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)n1 476691381 GDVTXGWMXDJOMY-NSHDSACASA-N 380.391 5.002 30 20 GKED C[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 483644104 DQLCCXLBHLQWIT-CABCVRRESA-N 383.879 5.053 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2nccc(C)n2)cc1 486425260 MRGNAXCLZASSSN-UHFFFAOYSA-N 377.469 5.108 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 488369546 RJFGMMLYFCCKGW-UHFFFAOYSA-N 395.425 5.122 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](COC)c1ccc(Cl)cc1 489090462 VQRDPQRWCFECOU-HXUWFJFHSA-N 386.923 5.701 30 20 GKED CC(C)(C)n1ncc(C(=O)Nc2ccc(Cl)c(C#N)c2)c1-c1ccccc1 489298126 QXOQDUBMYQKLLB-UHFFFAOYSA-N 378.863 5.082 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3nsc4ccc(C)cc34)n2)cc1 496028416 LUWJUCFJJVDXAU-MRXNPFEDSA-N 389.505 5.527 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC(C)(C)C1 497767351 GYHISFUDTNPBJL-UHFFFAOYSA-N 377.488 5.100 30 20 GKED COCc1ccsc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 498243447 FJOUBFDKHPXUEC-ZDUSSCGKSA-N 388.558 5.231 30 20 GKED CSc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 505326740 WPRLLGSJNUUDTM-HUUCEWRRSA-N 385.558 5.685 30 20 GKED COc1ccc2c(c1)c(C(=O)N1CCC(C)(C#N)CC1)c(C)n2C1CCCCC1 507839627 DPWDGASPZSQXSS-UHFFFAOYSA-N 393.531 5.229 30 20 GKED C=C(C)CCc1noc(-c2oc3ccccc3c2CSc2ncccn2)n1 508615681 PRAWINQSKPDHAX-UHFFFAOYSA-N 378.457 5.074 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCC(=O)c3cccs3)c2)cc1 519163647 DTKNHWJHXMFUHL-UHFFFAOYSA-N 376.437 5.014 30 20 GKED Cc1cccc(-c2noc(CNc3cccc(Oc4ccc(C#N)cc4)c3)n2)c1 520626468 QFVBPHYULNFJGI-UHFFFAOYSA-N 382.423 5.321 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@@H]1CCC[C@@H](C)C1 522151486 XJUXYHRTZSVYAN-VGOFRKELSA-N 394.490 5.134 30 20 GKED CC(C)N(CCC#N)C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 522585236 KHQFDNQZYGPLMQ-UHFFFAOYSA-N 377.463 5.057 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@]1(C)CCCc2ccccc21 522977181 AXLJZUJURNWJAO-RUZDIDTESA-N 397.478 5.287 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)CCCCOc1cccc(C#N)c1 525366729 LOSCPRAGMDDUMJ-HXUWFJFHSA-N 390.527 5.497 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ncoc3-c3ccccc3)c2)c1 531915623 LYVUFUQJMTYZDP-UHFFFAOYSA-N 395.462 5.082 30 20 GKED C=CCn1c(SCc2cc(Cl)ccc2Cl)nnc1-c1ccccn1 532632436 JGOHTFJODYBMLN-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CSCc1ccccc1 533443642 IBTJGJGQDNMSFY-IRXDYDNUSA-N 384.570 5.446 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccc(C#N)cc1 535627033 RGJWSTKOVILTLF-UHFFFAOYSA-N 387.826 5.152 30 20 GKED CCc1cc(C#N)c(NC(=O)c2oc3c(Br)cccc3c2C)s1 543864939 IODKFAXZKMXIDF-UHFFFAOYSA-N 389.274 5.252 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(-n2ncc3ccccc32)cc1)c1ccccc1 544255362 OLKRBVWNZCDWRS-JOCHJYFZSA-N 395.466 5.192 30 20 GKED CSC[C@](C)(C#N)NC(=O)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 574792924 LAGJCAPUEQQGRP-INIZCTEOSA-N 385.341 5.097 30 20 GKED N#CC1(c2ccc(-c3cc(F)ccc3OCc3ccncc3)cc2)CCOCC1 592987406 RQBFKQCCEXBMQK-UHFFFAOYSA-N 388.442 5.038 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)CCCCC#N 594254750 JHHWMYXPTRAFHE-UHFFFAOYSA-N 378.394 5.398 30 20 GKED Cc1sc(NC(=O)c2nc(-c3ccccc3)n3c2CCCCC3)c(C#N)c1C 603615221 FEVVRGQXXZPDHE-UHFFFAOYSA-N 390.512 5.079 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)oc2c(C)cccc12 604302647 DITOVMZXTDXIOV-UHFFFAOYSA-N 383.407 5.361 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(C)c(OC)c1C 606766898 NFNIVZQXSSSKNS-UHFFFAOYSA-N 379.378 5.148 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 609222202 YJATUMCJPYQCPD-SFHVURJKSA-N 385.467 5.407 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 609433739 FQNFGWWXGZJMFY-SFHVURJKSA-N 385.467 5.884 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609744591 RZQDPUIATSDCRZ-ROUUACIJSA-N 381.545 5.771 30 20 GKED CSCC[C@H](C)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609869856 IUOKYRRNSKYBJP-AWEZNQCLSA-N 388.920 5.218 30 20 GKED CC[C@@](C)(NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc(C)cs1 610184757 KUQFOTXYGGFOCG-JOCHJYFZSA-N 391.496 5.171 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2nc(O)n(C(C)C)c2c1 613900735 IJHZNLUFXWPJBW-UHFFFAOYSA-N 377.488 5.427 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)cc1F 622485350 LOPIIFPUIOBOFN-CYBMUJFWSA-N 383.238 5.017 30 20 GKED CN(Cc1ccoc1)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646436736 ZIMWXCJWBTZRGF-UHFFFAOYSA-N 398.278 5.233 30 20 GKED Cn1ccnc1[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C1CC1 647323371 CMTFNIQWYNJRBR-ZDUSSCGKSA-N 395.322 5.273 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccc(Br)cc2)C(C)C)c1 726477326 SPHDTBOYYURUKF-UHFFFAOYSA-N 387.346 5.038 30 20 GKED C#CC[C@@H](OC(=O)c1sc(-c2cccc(Cl)c2)nc1C)c1ccccn1 727775320 FAPJAUFXCNMWCG-QGZVFWFLSA-N 382.872 5.088 30 20 GKED Cc1cccc(-c2nn(CN(C)[C@H](C)CC#N)c(=S)n2[C@H]2CCCC[C@H]2C)c1 728901861 BNUHBQOISNTOFU-GGPKGHCWSA-N 397.592 5.332 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)c2c1 730092711 QBTPXMFPCHBKKI-OAHLLOKOSA-N 389.238 5.051 30 20 GKED N#C[C@@H](C(=O)/C=C/C1CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 735593494 MVKJRYNCENBLLC-OWNNVSBGSA-N 378.419 5.628 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)c(SC)cc1OC 741165643 PNTPEYWZXMSWBP-RMKNXTFCSA-N 396.480 5.637 30 20 GKED N#Cc1cccc(/C=C(\Cl)c2ncc(-c3ccccc3Br)o2)c1 741840842 AEDJAZWZKVOBEC-SXGWCWSVSA-N 385.648 5.713 30 20 GKED C[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743094612 AMMBGYVTYNPBFI-KOSHJBKYSA-N 381.479 5.321 30 20 GKED Cc1cc(-c2noc([C@@H](C)ON=Cc3cccc(Cl)c3Cl)n2)ccc1F 744443296 KCKUGAGXWJEPGL-LLVKDONJSA-N 394.233 5.603 30 20 GKED Clc1cccc(Cl)c1CON=Cc1cccc(OCc2ccncc2)c1 746331093 YGDDRKAJZQMSBJ-UHFFFAOYSA-N 387.266 5.518 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccccc1OCc1ccccc1 746498349 XABBOSZPNLJLLT-UHFFFAOYSA-N 388.471 5.259 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 747108796 SKBYPQYSVZQORJ-WBMJQRKESA-N 389.282 5.007 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)n1 747199434 TVKFYLVLECZQKU-ZYHUDNBSSA-N 399.368 5.930 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CNc1ccccc1S[C@H](C)CC#N 749272772 WJLCWEXQZJSOGL-OAHLLOKOSA-N 396.947 5.841 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCC#N)c1ccc(Oc2ccccc2)cc1 750810334 CUPFBDMISKMOBW-QGZVFWFLSA-N 388.492 5.586 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 751129882 NRKIRIJPTTXCNT-VMPITWQZSA-N 375.815 5.051 30 20 GKED CS[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)(C)C 752485332 MBSZOVNVPAHDAR-WOJBJXKFSA-N 381.545 5.241 30 20 GKED C=C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 759207471 BINUOBCVAFXUGJ-FZKQIMNGSA-N 387.266 5.001 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(-c3ccoc3)c2)cc1 760969046 MCNFJONGRSIARQ-AOMKIAJQSA-N 386.451 5.421 30 20 GKED CCN(Cc1ccccc1)c1ccc(CN(CCC#N)Cc2ccccn2)cc1 769335976 ZEWPEPFFHAKGHF-UHFFFAOYSA-N 384.527 5.024 30 20 GKED N#CCc1ccccc1CC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 769504768 WEGFKQFGWQVMSE-HXUWFJFHSA-N 386.417 5.068 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(CC[C@@H](O)c3ccccc3)c2)cc1 770557559 CYIRPCHVNZGEMA-KBMIEXCESA-N 386.495 5.256 30 20 GKED CN(CCC#N)c1ccc(CNc2cc(F)ccc2SCC(F)F)cc1 770585174 IRFRSFZXVWUGMT-UHFFFAOYSA-N 379.451 5.145 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)ccc1OC1CCCC1 776154776 WDVQLSPMZHZKOK-MSOLQXFVSA-N 394.515 5.331 30 20 GKED C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1csc2ccccc12 776158189 VGSLKWYVXFLXJJ-QGZVFWFLSA-N 375.541 5.088 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Br)cc2Cl)C2CC2)cc1 783225069 UYUCZEOLGVTWIW-GOSISDBHSA-N 375.697 5.215 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(OC(F)(F)Cl)cc1 783351329 ORMBGPKJXGIFQO-UHFFFAOYSA-N 382.819 5.113 30 20 GKED Cc1cccc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1Cl 788080164 AFOCHMHHKOYMRI-CYBMUJFWSA-N 375.280 5.331 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)[C@H]3CCC(=O)c4ccccc43)cc2)cc1 790814555 JHCDUAVSMDDFJC-QFIPXVFZSA-N 383.403 5.016 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 796745483 KYNHNDCDUYKYEB-FQEVSTJZSA-N 382.419 5.344 30 20 GKED CC(C)c1nc(COC(=O)c2ccccc2SCc2ccc(C#N)cc2)co1 802967341 BXURHFWMNVBGOH-UHFFFAOYSA-N 392.480 5.319 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(Cl)c(SC(=O)N(C)C)c1)c1ccccc1 805441992 WDWYVEFPZNGCTH-INIZCTEOSA-N 388.920 5.412 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1F 810255085 VQXUVOHXELPPIY-QGZVFWFLSA-N 377.341 5.085 30 20 GKED N#C[C@H](C(=O)c1ccc(C2SCCS2)cc1)c1cc(C(F)(F)F)ccn1 813218727 YVJWAYOEKPYROT-AWEZNQCLSA-N 394.443 5.069 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1nnc(-c2ccccn2)s1 853336797 NEKZLOCRVQMICG-UHFFFAOYSA-N 397.348 5.053 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915085796 CFXMTAYDWUFICT-DEOSSOPVSA-N 384.479 5.519 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc(Cl)c1OC 916137313 RYCOEUDSEKOMOM-QPJJXVBHSA-N 396.226 5.205 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2sccc2s1 918488034 ZFZYMZDVQQMKBK-CQSZACIVSA-N 376.462 5.077 30 20 GKED CCCCc1nnc(S)n1N=Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 920360487 APDNRCINZDNGMO-UHFFFAOYSA-N 394.422 5.070 30 20 GKED CC(C)c1ccc(C=NOCc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1 920399585 WVXBTWJWMRAFKP-UHFFFAOYSA-N 390.270 5.718 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1nc(Br)ccc1F 926478940 FYWOSEPOGSWERG-CZUORRHYSA-N 376.273 5.069 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc2c(c1)Cc1ccccc1-2 1776033158 GOOWZEOMIQLQEE-UHFFFAOYSA-N 376.843 5.446 30 20 GKED C[C@@H](Oc1ccc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)cc1)C(=O)O 1776469730 ZMAICBKSKGVVSJ-LZUGORFDSA-N 397.279 5.119 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)o2)cc1 1777472291 JOXUIRRIXMMETE-VAWYXSNFSA-N 376.408 5.070 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccco3)cc2)CCC1 1787270222 JAKKUDCUTVGIOQ-UHFFFAOYSA-N 380.488 5.020 30 20 GKED COc1ccc(-c2nnc(SCc3cccc(C#N)c3)n2-c2ccccc2)cc1 4211636 MMSWONZOZIFMMZ-UHFFFAOYSA-N 398.491 5.107 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cccc(Cl)c2)nnc1-c1ccoc1C 21925267 DEGHYYYDGUPYRV-ZDUSSCGKSA-N 387.892 5.049 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2C)cc1 55803712 WRZWXTOICGWSEX-UHFFFAOYSA-N 386.451 5.064 30 20 GKED CC(C)Oc1ccccc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 108533057 UTNCTEIPOQIOJI-INIZCTEOSA-N 383.517 5.047 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(F)(F)c2ccccc2)cc1 116552865 SUXPUFAXXXUAHV-UHFFFAOYSA-N 394.377 5.090 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccc(C#N)cc1 118445087 IIKXHYZAKKATNK-QWHCGFSZSA-N 378.419 5.398 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2scnc2C2CC2)cc1Cl 120445004 GIWDMTLKJULTBF-QGZVFWFLSA-N 393.899 5.582 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 150975313 LBGXZLHYGKNNDQ-FUHWJXTLSA-N 397.519 5.316 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccccc1 151447571 XBUOSBHQJXJVEQ-FQEVSTJZSA-N 379.485 5.098 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F 154334982 HMRFUIAQHNUYSO-LLVKDONJSA-N 382.382 5.491 30 20 GKED Cc1cc(C)c(Br)c(C(=O)Nc2ccccc2SCCC#N)c1 159886076 JXALQACKROCJOZ-UHFFFAOYSA-N 389.318 5.324 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCc1cccs1 170974845 NLSZOKAQHRKEMX-UHFFFAOYSA-N 384.448 5.344 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 171797789 AWWMWSMGWPDDGA-JNMQVBFRSA-N 387.439 5.101 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 176881517 WFWXWPZCEHKQDN-HXUWFJFHSA-N 392.890 5.153 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C3(Cc4ccccc4)CC3)n2)cc1 181268473 BQXAFLPMVKMMGP-LJQANCHMSA-N 388.492 5.018 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@H]3/C=C/c3cccs3)o2)cc1 181958329 AMXFFQVYALGMJV-CVTTXWKISA-N 390.512 5.128 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccn(-c2ccc(F)cc2F)n1 192199981 HGENBKJWZUBDGE-CQSZACIVSA-N 384.455 5.014 30 20 GKED COc1cc(C=NOCc2ccc(Cl)c(Cl)c2)ccc1OC(F)F 250388848 QTPJTLJUYOLHNP-UHFFFAOYSA-N 376.186 5.154 30 20 GKED N#C[C@@H](C(=O)/C=C\c1nc2ccccc2s1)c1nc2cc(Cl)ccc2s1 255367046 JXBRWWBNOFRFRD-VFFGBVLKSA-N 395.896 5.449 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)c1 303154443 GOGODUXZVJYVCU-SJORKVTESA-N 389.282 5.418 30 20 GKED N#CC1(CNCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CCC1 418145255 WVSFIYGFLJWFMP-UHFFFAOYSA-N 388.298 5.029 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cs1 426293501 XXZIVTULKDWNBP-UHFFFAOYSA-N 377.469 5.077 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)(F)F)cc3)n2)cc1 429681154 BINYAWKMYRQLMZ-KRWDZBQOSA-N 398.434 5.420 30 20 GKED COc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1F 436397905 BDCLWQDYDATJHA-OAHLLOKOSA-N 395.318 5.636 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccc(F)cc2F)C2CCCC2)cc1 437917640 TYPQYSAPEWMBIZ-UHFFFAOYSA-N 397.469 5.743 30 20 GKED CCc1nc(C)c([C@@H](C)N(C)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 438638783 STXVRBODVPEVKT-LLVKDONJSA-N 396.438 5.129 30 20 GKED CC(C)(C)c1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)n(C(C)(C)C)n1 439390919 ZEUNDENNHFRXGR-KRWDZBQOSA-N 381.524 5.102 30 20 GKED CCOCc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 440408070 KCZNZBIEIYXOIA-UHFFFAOYSA-N 390.414 5.278 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(Br)s1 443303464 CJEXZQVDQUNYOU-LLVKDONJSA-N 385.352 5.031 30 20 GKED C=CCOCCCC(=O)Nc1cccc(Cl)c1Sc1nc(C)cs1 443856357 HPMAHDXYGJHRCR-UHFFFAOYSA-N 382.938 5.177 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCc1cccc(C(F)(F)F)c1 463646796 QDQBHIOHHNMZTQ-UHFFFAOYSA-N 398.384 5.336 30 20 GKED CC(C)CO[C@@H](C)c1noc(CSc2nc(-c3ccccc3)ccc2C#N)n1 466662657 ZJUUTMPDNYDSBO-HNNXBMFYSA-N 394.500 5.029 30 20 GKED COc1c(F)cc(F)cc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 472508409 WDFRSPWJDQDIND-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C=C[C@](C)(CCOC)C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 473577156 SMXIHUPCRGSECI-JLTOFOAXSA-N 392.952 5.178 30 20 GKED CC(C)OCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)oc2ccccc12 474433827 KCTBSCQGPSEUOP-OAHLLOKOSA-N 382.485 5.428 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1 475553144 YGGURXRXWNOHCT-UWJYYQICSA-N 380.532 6.445 30 20 GKED CC[C@@H](CN(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 480564795 SBRDFRUWYAIXHT-OALUTQOASA-N 395.572 6.128 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccnc(OCc2ccccc2)c1 481923049 ZHBZLUOMIDAHBR-DEOSSOPVSA-N 383.495 5.090 30 20 GKED COc1ccc(-c2ccncc2)cc1CN1CCC[C@H]1[C@H](C#N)c1ccccc1 481997972 JXFRMVUTBQMHKM-RPWUZVMVSA-N 383.495 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCn2c(cc3ccccc32)C1 482172235 XMQHGQNAGWLKEN-UHFFFAOYSA-N 387.527 5.931 30 20 GKED CSc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(Cl)cc1Cl 487178435 VEZKFYAQJKZGQS-KRWDZBQOSA-N 393.339 5.880 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc(-c2cccc(F)c2)no1 489090014 TWXMBAIKECRRGZ-UHFFFAOYSA-N 394.450 5.049 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(-c2ccccc2F)o1 498450654 QIGVXXQGQCWXNI-UHFFFAOYSA-N 390.458 5.329 30 20 GKED C[C@@H]1CC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@H](C)C1 502633423 KCHBULXPYPYWPD-HMFYCAOWSA-N 391.515 5.278 30 20 GKED CCN(Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](C)c1ccc(C#N)cc1 508622853 YXEDCWNEKOTGTH-OAHLLOKOSA-N 392.484 5.173 30 20 GKED N#C[C@H](NC(=O)CSc1ccccc1Cl)c1cccc(Cl)c1Cl 521293088 GNOJVDJOKQFBMD-ZDUSSCGKSA-N 385.703 5.120 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)CSc2ncc(C(C)C)n2C(C)C)c1 523500235 JVUIZKYYLLGSRR-UHFFFAOYSA-N 398.576 5.243 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)Nc1ccc(F)cc1C#N 532361980 ALFRHPYSEGBUHT-UHFFFAOYSA-N 395.459 5.002 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)c(Cl)c1 532664258 ZODJRBVGLSVNQC-CQSZACIVSA-N 396.903 5.233 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N[C@@H]2CCCC(F)(F)C2)cc1Cl 534154851 UKVJJPCWHJDLFL-OAHLLOKOSA-N 390.817 5.312 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@@H]1CCCO1 534480798 SPWOLUAPSJUAIJ-JBACZVJFSA-N 397.906 5.075 30 20 GKED N#CC1(CCCN[C@@H](c2ccccc2)c2cccc3ccccc23)CCOCC1 540808481 FUIBAOGDOWJYIX-VWLOTQADSA-N 384.523 5.619 30 20 GKED N#C[C@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1c(Cl)cccc1Cl 542148043 DZECLAHZEPTUCZ-MGULZYLOSA-N 393.236 5.433 30 20 GKED N#CCC1CCN(C(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)CC1 542908712 PLPBOWNPLXGLFG-FQEVSTJZSA-N 384.932 5.326 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N(C2CC2)C2(C#N)CCC2)c1 551652775 WCGLJHHECOUQLJ-UHFFFAOYSA-N 391.858 5.055 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(C(C)C)cccc1C(C)C 554352517 NYIZQRHEOSEKEL-UHFFFAOYSA-N 396.579 6.321 30 20 GKED CC[C@@H](C)Oc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 558906089 JEMFIWBEORDNBR-MRXNPFEDSA-N 390.439 5.160 30 20 GKED COc1cccc([C@@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)c1 566827311 VSTMMVVWNFPWHJ-DNQXCXABSA-N 388.898 5.587 30 20 GKED N#CC1CCC(CN[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)CC1 569286064 INVLHHVWOLJSFP-SVGDTCPJSA-N 386.337 5.227 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 572417475 SKOHNKRINLWYDE-SBUREZEXSA-N 390.531 5.160 30 20 GKED Cc1csc(NC(=O)c2ccc(-n3ncc4ccccc43)cc2Cl)c1C#N 572679573 FCOVYPPXOGVVHF-UHFFFAOYSA-N 392.871 5.173 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(Br)cc1 575376378 MYINNGNKNOOFPY-LLVKDONJSA-N 383.211 5.190 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2oc(C3CC3)nc2c1 577611682 CKXCICNAZUXPBC-UHFFFAOYSA-N 393.491 5.093 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1cc(Cl)ccc1C(F)(F)F 588326895 MSXKBJKIVMOGIT-HNNXBMFYSA-N 379.769 5.039 30 20 GKED COc1ccc([C@@H](NC(=O)CCCCCC#N)c2ccccc2Cl)c(C)c1 588625297 XGXOAWOXHHIWLO-JOCHJYFZSA-N 384.907 5.337 30 20 GKED CC(C)CCSc1ccc(C(=O)Nc2ccccc2CC#N)cc1[N+](=O)[O-] 588988374 DXXZCMIWSXRWPV-UHFFFAOYSA-N 383.473 5.051 30 20 GKED CCN(CCSC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 592219866 ZSUIGTXQKPFUPV-SFHVURJKSA-N 387.936 5.212 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1nc2cc(F)ccc2s1 592974230 POCJYEUWFNQDPL-MRXNPFEDSA-N 389.455 5.286 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@@H]1CCCOC1 593143694 MIMDYGSQMAPVBS-UYAOXDASSA-N 397.906 5.028 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2c2ccsc2)cc1 603672258 SDCGPVKBOAHOKH-JOCHJYFZSA-N 388.492 5.176 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3nc(-c4ccccc4)cs3)c2C#N)C1 603727110 COEATTFKKJJVOX-LBPRGKRZSA-N 379.510 5.120 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 603746902 HMNNCFYNLBRKOQ-OAHLLOKOSA-N 389.421 5.260 30 20 GKED CC(C)(C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1ccc(Cl)cc1 603946703 VWYBSKLEOCYOPI-UHFFFAOYSA-N 381.888 5.251 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c1 604088317 PHWAXMLRGGXVIL-JOCHJYFZSA-N 398.466 5.423 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(CSc4ccccc4)cc3)[nH]c12 605362981 BVYNQWSHKFHDOO-FQEVSTJZSA-N 397.503 5.654 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)COc1ccc(C#N)cc1 609066257 AJTJVPAWSPOUTM-SFHVURJKSA-N 386.451 5.024 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2nccc3ccccc23)cc1Cl 609164534 QEIFZRSERHZNTL-NRFANRHFSA-N 397.865 5.796 30 20 GKED COc1cccc([C@@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609209990 ZOZSVJHYYCYITK-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COC2CCCC2)cc1 610097262 BUTKVGJRZJLOHT-UHFFFAOYSA-N 391.515 5.462 30 20 GKED CC[C@H](NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccncc1 610176933 OLZISEMOVVMQEM-FQEVSTJZSA-N 391.858 5.280 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@H]2CCN(c3ccc(Cl)cc3)C2)CC1 611255129 VGMZAXCSAOAVAV-BJRAERQBSA-N 393.962 5.160 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 614930308 UIQHMHYIYHBBTJ-UHFFFAOYSA-N 377.366 5.203 30 20 GKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 618801356 AGXLFPMNMDAWIT-KUHUBIRLSA-N 389.480 5.533 30 20 GKED Cc1ccc(C)c(OCc2nnc(S[C@@H](C#N)c3ccc(Cl)cc3)o2)c1 619863844 JJLJLTOQVFZIRH-KRWDZBQOSA-N 385.876 5.276 30 20 GKED C=CCCO[C@@H](C)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 620574660 GERDMPXWMMOPCN-LIRRHRJNSA-N 378.299 5.180 30 20 GKED C=CCn1c(SCc2cc(-c3ccc(C)cc3)no2)nnc1-c1ccoc1C 642252118 IPFVUTWLHQAEPU-UHFFFAOYSA-N 392.484 5.288 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc1 728698804 PDSCLHAFONQJJF-YBYKNVHQSA-N 377.509 5.908 30 20 GKED CCN(CC)[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 729521350 XJEYSGRPIMHNSK-JWQCQUIFSA-N 397.522 5.364 30 20 GKED Cc1ccc2oc(C(=O)OCCC(C#N)(c3ccccc3)c3ccccc3)cc2n1 729725613 JTHDOGXAOHHJAM-UHFFFAOYSA-N 396.446 5.193 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(O)cc1F 729932092 CGRDATPGUIBPGH-UHFFFAOYSA-N 396.422 5.178 30 20 GKED N#C[C@@H](C(=O)c1sccc1SC(F)F)c1nc2cc(F)ccc2s1 730695860 NXNSDFSJIBGQAV-QMMMGPOBSA-N 384.429 5.302 30 20 GKED COc1ccc(/C=C2/CCOc3ccc(Cl)cc3C2=O)c(Cl)c1OC 733749568 ZWZKJCHMTUOEBP-XFXZXTDPSA-N 379.239 5.059 30 20 GKED C[C@@H]1/C(=C/c2csc(-c3ccccn3)n2)C(=O)c2cccc(Br)c21 742433941 BAHKENCWECWEAF-RLIURORJSA-N 397.297 5.351 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c(F)c(F)cc(F)c2F)cc1 748520911 KZWYIMMRRZXKOJ-HNNXBMFYSA-N 384.332 5.151 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)ON=C(c1ccccc1)C(F)(F)F 751961583 FGNAJTIDTKPAAD-OAHLLOKOSA-N 392.421 5.429 30 20 GKED N#Cc1ccc(F)c(CNCc2nc(-c3cc(Cl)ccc3Cl)cs2)c1 754063135 ASZCCQXNGSRJHL-UHFFFAOYSA-N 392.286 5.417 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)OCC 755586189 ZVDLJVBEAVWKGM-ZFWWWQNUSA-N 388.360 5.282 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)/C=C/c1ccccc1C#N 759291898 WBEPXROTQHFBDE-CLVCIHKQSA-N 387.508 5.223 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3c(F)cccc3F)n2)cc1 764567336 OOOJDDUFWXIPMD-HIFRSBDPSA-N 382.435 5.377 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccc3[nH]ccc3c2)cc1 765914574 CVRLMDQEYYCTHI-USXLCRGKSA-N 385.467 5.042 30 20 GKED CCc1nc2ccccc2n1N=Cc1ccc(OCc2ccccc2)c(OC)c1 767363728 VHULPTOOIITTJZ-UHFFFAOYSA-N 385.467 5.069 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 770651362 GFGUSYQUNVCMNW-HNAYVOBHSA-N 383.879 5.390 30 20 GKED CCn1nc(CNc2ccc(OCc3cccc(C#N)c3)cc2)c2ccccc21 770665115 BCRODIIYPZGTCW-UHFFFAOYSA-N 382.467 5.119 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc3ccc(Br)cc3n2)c(F)c1 771521361 QRBFRORLEFOZRI-TWGQIWQCSA-N 386.220 5.041 30 20 GKED N#C[C@@H]1CCC[C@H](NCCCCCCc2nc(-c3ccc(Cl)cc3)no2)C1 774368947 IHAIJBAVQPGCJW-APWZRJJASA-N 386.927 5.165 30 20 GKED C#CCCCCCC(=O)N(Cc1ccccc1)[C@H](C)c1cccc(NC(C)=O)c1 779769270 VDYVLFYHSHMFNZ-HXUWFJFHSA-N 390.527 5.319 30 20 GKED CC(=O)Nc1ccc(C(=O)/C=C\c2cc(Br)c(Cl)s2)cc1 790223288 JKJONYKAWDSFQY-SREVYHEPSA-N 384.682 5.019 30 20 GKED O=C(/C=C\c1cnnn1Cc1ccccc1)c1ccc(Cl)c(Cl)c1Cl 792860402 VUMSUNBRFATYAZ-TWGQIWQCSA-N 392.673 5.183 30 20 GKED N#C[C@@H](C(=O)[C@@H](Oc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 802040978 VLQKTACKYWFMTQ-NQIIRXRSSA-N 397.261 5.385 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2cc(Cl)cc(Cl)c2O)c1 806147610 YYTYCQINCARGMJ-HNAYVOBHSA-N 393.314 5.621 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 813057339 JYXQZKAMTULGFZ-DNVCBOLYSA-N 384.888 5.230 30 20 GKED C=CC(C)(C)CC(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 884650527 MYLIVURRTXKKFL-UHFFFAOYSA-N 392.908 5.127 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351702 BIMILSNKRCRYCG-JOCHJYFZSA-N 389.886 5.659 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(F)cc2F)cc1OCc1ccccc1 916127556 IZSMSVGJUUJCKH-XFFZJAGNSA-N 380.390 5.449 30 20 GKED C[C@H](/N=C/c1cc2ccccc2nc1O)c1cccc(OCc2ccccn2)c1 917559580 PSZBKHQDGRKQGD-AEIQVQRHSA-N 383.451 5.095 30 20 GKED CCc1cccc(C)c1NN=C(C)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776056739 MDCAVKMRQFLOTR-UHFFFAOYSA-N 388.467 5.884 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cccc(Cl)c2C(F)(F)F)c1)C(=O)O 1776471346 LRCUTDBKJXYABS-TYBABMIJSA-N 398.764 5.107 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)cc(C(F)(F)F)c1 1776783099 XIQADCVTOOCXHM-INIZCTEOSA-N 379.850 5.652 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccnn3-c3ccccc3)cc2)cc1 1777671174 OOMGBIJLDLPIBF-NVNXTCNLSA-N 394.430 5.134 30 20 GKED C[C@H](Sc1nc2ccccc2n1-c1ccccc1)C(=O)Nc1ccccc1C#N 9966640 XWUINIPALPQZNM-INIZCTEOSA-N 398.491 5.016 30 20 GKED Cc1ccc[n+](/C(C(=O)c2cc(C)sc2C)=C(\S)Nc2ccccc2F)c1 11171584 AHXWNGPILDNHHF-UHFFFAOYSA-O 399.536 5.151 30 20 GKED C=CCn1c(SCc2csc(-c3cccs3)n2)nc2ccccc2c1=O 18767720 JZUMGFDXHNHPCL-UHFFFAOYSA-N 397.550 5.060 30 20 GKED CN(C)c1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 46893303 LPJAVTQWYKBPOS-NRFANRHFSA-N 389.886 5.314 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c2cnn(C(C)C)c2n1 47375137 YNSCLKZKIHPDAS-GOSISDBHSA-N 397.482 5.174 30 20 GKED C=CCc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1c(C(C)C)cccc1C(C)C 60738497 VUGHMHCJOIALFP-UHFFFAOYSA-N 396.487 5.588 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C)Cc3cccc(C#N)c3)cc2)n1 63162984 QAYZPYTTZUFJET-UHFFFAOYSA-N 394.525 5.138 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1C 64532624 JGCYEQVAQXLRLG-OAQYLSRUSA-N 377.488 5.331 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc2ccccc2o1 66955175 YPLXOAVKBFGELY-CABCVRRESA-N 379.485 5.710 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccccc3Oc3cccnc3)n2)c1 160830976 GUDFGCUOSQNWRG-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 171742203 HDNOHEXWJZHZNU-APWZRJJASA-N 397.519 5.316 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1ccc(Cl)s1 171840072 SQPILGHGGNOITC-LBPRGKRZSA-N 379.938 5.160 30 20 GKED C#CCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 180739922 KGCIBQPBTWKJRE-CQSZACIVSA-N 377.296 5.487 30 20 GKED CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCO1 181712348 APGZYCGXGWBSHG-IEZWGBDMSA-N 389.565 5.044 30 20 GKED Cc1nn(C(C)(C)C)cc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 184378385 RDDLGOOVCGEVKO-UHFFFAOYSA-N 392.434 5.002 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccnc1)c1ccc(F)cc1F 211155654 SIBUFMWFTXMOHP-FLIBITNWSA-N 387.389 5.109 30 20 GKED O/C(=N/C[C@@H]1CCC2(CCOCC2)[C@H]1O)C1(C2CCCCC2)CCCCC1 328699474 MGMVSUAHYJIRIL-ICSRJNTNSA-N 377.569 5.041 30 20 GKED CC(C)(C)/N=C(/O)CN1CCC(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 329198741 VRRHZWNKIAZTAH-SLFFLAALSA-N 391.600 5.016 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 329974236 XEFONEMVZLRAGC-UHFFFAOYSA-N 380.492 5.002 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@@H](C)CCC#N 411545363 XAXZONAFJOIYQI-NWDGAFQWSA-N 378.339 5.224 30 20 GKED CC(=O)N(c1nc(CSCCC#N)cs1)c1c(C)cc(C)cc1Cl 413010918 IDRZSXIJGUGGAU-UHFFFAOYSA-N 379.938 5.245 30 20 GKED CC(C)=CCOc1cccc(CC(=O)Nc2ccccc2SCCC#N)c1 415152281 HAVTWVDQWODSQH-UHFFFAOYSA-N 380.513 5.219 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1Cc1cc(F)ccc1F)c1ccccc1 419519879 GVWUOUXNOBAZPJ-RBBKRZOGSA-N 397.469 5.116 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 426904837 KVURYYWPQDXBIO-LBPRGKRZSA-N 375.460 5.001 30 20 GKED O=C(Nc1ccc2oc(C(F)(F)F)nc2c1)c1cccc(C(F)(F)F)c1F 429865669 ZETNHMSCGVPHFN-UHFFFAOYSA-N 392.230 5.257 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C(C)(C)C1 434223610 VXBFZVKFAWOXEK-PKOBYXMFSA-N 393.556 5.596 30 20 GKED COc1ccc(C#N)cc1CNc1cc(C(=O)Nc2ccccc2)ccc1Cl 434880888 QVTLYEMHVSDCMR-UHFFFAOYSA-N 391.858 5.085 30 20 GKED CCSCC[C@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 438189569 UCGNVUPYIWTTQK-HNNXBMFYSA-N 399.516 5.012 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)c1 438282646 LHEZZGDKTCUYOY-OAQYLSRUSA-N 394.906 5.236 30 20 GKED N#Cc1ccccc1SCC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 439715461 FCBYLOPLZLZPSU-JOCHJYFZSA-N 392.911 5.210 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 444861962 RZRCDLZIBDZLNS-GOSISDBHSA-N 389.421 5.611 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(F)c(Br)cc2Cl)cc1 466469990 YDHKGQAHHCLWOR-UHFFFAOYSA-N 395.659 5.295 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@](C)(OC)CC1)c1ccc(C(F)(F)F)cc1 474547592 MVCUQCUMJFJBCT-UYAOXDASSA-N 398.469 5.313 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1cccc(C(F)(F)F)c1 476080592 PCWGWMGEMNMWDP-UHFFFAOYSA-N 393.474 6.288 30 20 GKED COc1ccc([C@H](NCc2ccc(Cl)cc2C#N)c2ccc(F)cc2)cc1 478338609 NPADOUGTWZZWSZ-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C[C@@H](CC#N)NC(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 479967895 KXJZJCXJZCSYQW-LBPRGKRZSA-N 390.306 5.024 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cccc(-c2nc(C)co2)c1)c1ccc(F)c(F)c1 480984023 AEQOUZPGNXNPOV-IBGZPJMESA-N 383.398 5.367 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(Oc2ccccn2)c1 481206428 SXHQPUZLKQENRO-UHFFFAOYSA-N 399.903 5.809 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cc(Oc2ccc(F)cc2)ccn1 481898075 AAZPFOKNVTYJOR-XMMPIXPASA-N 387.458 5.442 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC(c4ccsc4)CC3)c2)cc1 485712716 NBFBFGDYRDRPEK-UHFFFAOYSA-N 388.492 5.432 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1)c1c[nH]c2ccccc12 486432316 JUCJIQGCOLIJSP-YJYMSZOUSA-N 385.389 5.061 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccccc1 487249049 GHWXWCRMBIIHIT-BJLQDIEVSA-N 387.310 5.648 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1nc2ccccc2s1)c1ccccc1 487615524 GWSCIJKFTIUGNQ-SFHVURJKSA-N 377.513 5.170 30 20 GKED C=CCn1c(SCc2cccc(OC(F)F)c2)nnc1-c1ccc(F)cc1 496567949 DXKQXLYLSZWCBU-UHFFFAOYSA-N 391.418 5.164 30 20 GKED CC(C)C[C@H](NCCCC1(C#N)CCOCC1)c1cccc(C(F)(F)F)c1 499602143 JYWAYZNBYONPFT-IBGZPJMESA-N 382.470 5.483 30 20 GKED CCCOc1ccc(-c2nc(C(=O)Nc3sc(C)c(C)c3C#N)cs2)cc1 504344154 UISSPBIWKNBYJH-UHFFFAOYSA-N 397.525 5.401 30 20 GKED N#Cc1ccc(CC(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc1 505029712 HXNRQHVGSFRIBR-UHFFFAOYSA-N 394.308 5.231 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@@H](C)CC[C@@H]2C)cc1 510094262 SPAOLYDSBFIZER-HOTGVXAUSA-N 379.460 5.011 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccsc2)nc1C)c1nc2c(s1)CCCC2 523581815 LHIBQVSALXGWNJ-UHFFFAOYSA-N 395.553 5.287 30 20 GKED C[C@@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1cccc(F)c1 525659900 SRVLRYRJYQQUQR-CYBMUJFWSA-N 376.456 5.267 30 20 GKED CCCc1ncc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)s1 525665870 UAWISVQPAVKUKK-UHFFFAOYSA-N 393.487 5.262 30 20 GKED Cc1ccc2oc(C(=O)[C@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cc2n1 534657867 PHUULVWQKDRJIN-NSHDSACASA-N 395.390 5.028 30 20 GKED C[C@@H](NCC#Cc1cccc(Cl)c1)c1cccc(OCc2ccccn2)c1 537052355 CHICWXMZJWNDFC-GOSISDBHSA-N 376.887 5.016 30 20 GKED C[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(C#N)c(F)c1 538507333 XEVVUJQRZYSNLL-INIZCTEOSA-N 378.422 5.266 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)cc1 539100187 RRHOWFVLHZCJTN-WOJBJXKFSA-N 386.417 5.210 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1 539172633 IQCWKRRTVQGYRZ-UHFFFAOYSA-N 377.307 5.241 30 20 GKED CCN(C(=O)c1ccc(CN(CC)C(C)C)cc1)c1ccc(C#N)c(Cl)c1 540274685 WJEJSZVWZUAQSW-UHFFFAOYSA-N 383.923 5.109 30 20 GKED CC(C)C[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 540343858 NPMBTIGDCNOXRT-GHTZIAJQSA-N 395.572 5.396 30 20 GKED CCOc1ccc(C(C)=O)cc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541084592 MWRUMLHBVOOSBI-GOSISDBHSA-N 398.506 5.677 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N5CCC(CC#N)CC5)(C4)C2)C3)cc1C 541976564 MEIUEQWNAUAMTH-URFUVCHWSA-N 390.571 5.294 30 20 GKED CC(=O)Nc1ccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542923161 APAYQQIVDYWAAJ-MRXNPFEDSA-N 398.466 5.066 30 20 GKED Cc1ccnc(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)c1C#N 543137370 GVWMQZOANBARBO-UHFFFAOYSA-N 384.361 5.080 30 20 GKED Cn1ccc([C@H](Nc2ccc(C#N)c(C(F)(F)F)c2)c2ccc(Cl)cc2)n1 546581918 PJFGVXDRYIXPTB-GOSISDBHSA-N 390.796 5.165 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C#N)c(Cl)c3)n2)cc1 547647304 NSBYJDCAEUBQOQ-INIZCTEOSA-N 377.856 5.134 30 20 GKED COc1sc(CN[C@H](CCCC#N)c2ccccc2)cc1Br 556907280 QMXPNYHHJIISFR-MRXNPFEDSA-N 379.323 5.044 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1ccc2[nH]ccc2c1 557808454 SAJPWXPWIBKTHM-UHFFFAOYSA-N 379.463 5.206 30 20 GKED Cc1ccc(C#N)c(Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)n1 561267905 NEMNHUCFCJLAMN-UHFFFAOYSA-N 380.810 5.050 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2cc(Cl)ccc2s1 564511580 WHRYCFXPADXAJC-VIFPVBQESA-N 392.292 5.636 30 20 GKED N#Cc1cc(Oc2ccc(NCc3nc4ccc(F)cc4s3)cc2)ccn1 568332602 GKDHVGXSAQUTSJ-UHFFFAOYSA-N 376.416 5.106 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)N3C[C@@H](C#N)[C@H](c4ccccc4)C3)cc2s1 570167583 GYCWUEIQQMJFCT-CABCVRRESA-N 396.903 5.029 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H](C2CC2)C1 588994743 GGHYIJHXCUMOJH-LJQANCHMSA-N 375.472 5.313 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1)c1cccc(C#N)c1 589789485 LECRMPQMUALPQJ-WOJBJXKFSA-N 383.495 5.592 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CCC3)C1 598407163 HODBFACFINSBFC-MIWMXLOXSA-N 397.478 5.080 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)CC1(C#N)CCOCC1)c1ccccc1 598818377 KMXUOANBEDHJAL-QGZVFWFLSA-N 382.891 5.145 30 20 GKED N#Cc1ccccc1CN[C@H](c1ccccc1)c1ccc(Br)cc1F 604009685 LWGGLZYRIPQJCJ-OAQYLSRUSA-N 395.275 5.339 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 609377203 QVSZNWPGMSDQPE-HNNXBMFYSA-N 389.524 5.285 30 20 GKED C[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)c1cccc(C#N)c1 610361616 CWFGXYKGLSWWST-IPELMVKDSA-N 387.508 5.095 30 20 GKED C[C@H](NC(=O)C1(c2ccc(Br)cc2)CCCC1)c1cccc(C#N)c1 610362146 BRDPRNFHPYVAPJ-HNNXBMFYSA-N 397.316 5.010 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cccnc3Sc3ccccc3)CC2)cc1 611247118 RDNQEELLJVXVPJ-UHFFFAOYSA-N 397.503 5.034 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnn(-c4ccccc4)c3C)n2)cc1 613314713 VBIWCGPYGWAWND-LJQANCHMSA-N 398.491 5.103 30 20 GKED CC(C)(C#N)c1ccc(CNc2cc(Cl)ccc2OC[C@H]2CCOC2)cc1 614480926 HYVHIUUUHGFJOI-KRWDZBQOSA-N 384.907 5.169 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCSc2ccc(Br)cc21 618807997 YJDBCNLIZTZMMT-QZTJIDSGSA-N 385.330 5.135 30 20 GKED O=C(Nc1ccc(Cl)cc1F)NC(CCC(F)(F)F)CCC(F)(F)F 665154081 GCQBIOKDBVIJKD-UHFFFAOYSA-N 394.718 5.654 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C 674866501 MJYYGAQPHGGLTB-INIZCTEOSA-N 390.980 5.849 30 20 GKED C=C(C)C[C@H](C)c1nc(CC(=O)Nc2ccccc2Oc2ccccc2)no1 685358672 AOLJURXOEMEOPN-INIZCTEOSA-N 377.444 5.113 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cn4cc(Cl)ccc4n3)cc2)c1 728052831 OJTAMVZSIGFIPS-UHFFFAOYSA-N 388.858 5.050 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@@H](C)c2ccccc2OC)c1 728475696 PUIYAAMXPOVIIR-GOSISDBHSA-N 389.520 5.465 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3cncc(F)c3)cc2Cl)cc1 729330012 JKSOQCGXAKLGBK-FPYGCLRLSA-N 393.805 5.190 30 20 GKED Cc1ccc(N(Cc2ccco2)C(=O)c2cc3ccccc3n2CC#N)cc1C 729651366 WWVKQSMWDBACHE-UHFFFAOYSA-N 383.451 5.222 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(Br)s2)c(Cl)c1OC 730434460 NCPUHCJYVJHXRS-HWKANZROSA-N 387.682 5.077 30 20 GKED CCCO[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 731108231 INUJUORBAUQTJU-PKTZIBPZSA-N 391.515 5.155 30 20 GKED Cc1ccc(C2CC(=NNc3cc(C(F)(F)F)nc(-c4cccnc4)n3)C2)cc1 733080152 QOCQJJQAPLANAC-UHFFFAOYSA-N 397.404 5.211 30 20 GKED CC(C)c1ccc2cc(C(=O)N[C@H](C#N)c3ccc(Br)cc3)[nH]c2c1 733253360 IPLKPYJAALGJOP-LJQANCHMSA-N 396.288 5.048 30 20 GKED C=CC[C@@H](NC(=O)NCC1(c2cccc(Cl)c2)CCCC1)c1ccncc1 734664787 RECPFMLZSPTUQN-HXUWFJFHSA-N 383.923 5.163 30 20 GKED C[C@H](S[C@@H](C)c1cccs1)C(=O)Nc1sc2c(c1C#N)CCCCC2 737401888 HIFDJCUUXTUZPC-STQMWFEESA-N 390.599 5.772 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)c1cncc(F)c1 737442438 AYYKHNPVBAIGSK-CMDGGOBGSA-N 375.428 5.031 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 742537690 NPCGONWHEKXTBW-JPYJTQIMSA-N 386.470 5.689 30 20 GKED N#C[C@@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc2ccccc2n1C(F)F 744037611 ARGIYHLQWPORLB-ABHNRTSZSA-N 393.437 5.582 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccc(F)c1 744037815 DWIVESLOGJVTLQ-YGRLFVJLSA-N 392.377 5.434 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccncc1 745826610 BSZDXAVETAYSIM-OAQYLSRUSA-N 385.458 5.131 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2cccc(Cl)c2)n1)Cc1ccccc1 750788493 MCORVNPNGMZQNK-OAHLLOKOSA-N 382.872 5.003 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(N2CCCCC2)cc1 753135944 UJUOFCRKGMTHBU-VAWYXSNFSA-N 375.497 5.092 30 20 GKED CN(CCOCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 757196928 AIUVCNWIXCIKEU-DEOSSOPVSA-N 399.494 5.023 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 767420698 LDRQAPQGTPEDQY-SBUREZEXSA-N 391.902 5.099 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@H](O)c2cc(Cl)cc(Cl)c2)CC1 768404648 WTQQYAZURJVARU-KBWCOIMZSA-N 389.326 5.021 30 20 GKED N#CCCn1cc(CN2CCC[C@@H]2c2ccc(F)c(F)c2)c(-c2ccccc2)n1 769428784 UBYUYXVSPGPHCF-JOCHJYFZSA-N 392.453 5.079 30 20 GKED CCCN(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 770111430 RRIPWYSIEMMKJD-IBGZPJMESA-N 375.497 5.146 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Cl)ccc2OC(F)F)c1 772983770 LRPCUJYFNXBIHV-XJKSGUPXSA-N 394.849 5.473 30 20 GKED C=CC[C@@H](C(=O)O[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 778426592 GSEKCMXQEMJLRV-SJLPKXTDSA-N 385.891 5.187 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1CNc1cccc(OCC#N)c1 779586179 OXDYMZUVWSMNOI-UHFFFAOYSA-N 387.270 5.002 30 20 GKED COc1ccc2[nH]c3c(c2c1)C(=O)/C(=C/c1cnc(-c2ccco2)s1)CC3 789147576 ITDVHEFQBFZBLF-FMIVXFBMSA-N 376.437 5.106 30 20 GKED FC(F)c1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)cc1 794481427 KFFLTTKEOOKOED-UHFFFAOYSA-N 399.253 5.360 30 20 GKED Cc1ccnc2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc12 795204282 IOLBLDHLRHTQRA-HSZRJFAPSA-N 377.447 5.451 30 20 GKED C#Cc1cncc(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)c1 798244745 LAYXLQZFGYNOCU-GFCCVEGCSA-N 378.419 5.225 30 20 GKED N#CC(CCOC(=O)CCCc1ccccc1N)(c1ccccc1)c1ccccc1 798681666 QYEBEILVYGVFFZ-UHFFFAOYSA-N 398.506 5.035 30 20 GKED CN(CCOCc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1 808825863 WGGPQWGEXITEDG-UHFFFAOYSA-N 397.544 5.129 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2cc(Cl)nc(Cl)c2)cc1 819832549 ULECVZRCFVFEAJ-UHFFFAOYSA-N 394.306 5.098 30 20 GKED C[C@@]1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1(Cl)Cl 836269587 DCXNGPQFGIBIDS-MJGOQNOKSA-N 388.298 5.047 30 20 GKED C[C@@]1(CNC(=O)c2ccccc2Sc2ccccc2C#N)CC1(Cl)Cl 836828314 BYFDWPPWYLCTPV-SFHVURJKSA-N 391.323 5.023 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)c(F)c1)c1cc2c(ccc3ccccc32)o1 844248267 BJZNYTPDBSDSRX-TWGQIWQCSA-N 383.382 5.202 30 20 GKED Cc1cncc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 878671433 AENBCKKMXWXYMS-APWZRJJASA-N 380.517 5.011 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915293518 PITUPVCBVMXHMQ-IBGZPJMESA-N 375.497 5.483 30 20 GKED CCCCCCCCCC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 916654064 VGEZUUJLFMPMFF-INIZCTEOSA-N 399.560 5.593 30 20 GKED Cc1cc(C)cc([C@H](OC(=O)CSCc2ccc(C#N)cc2)C(F)(F)F)c1 918563959 RFSWYAPCZRSJFV-IBGZPJMESA-N 393.430 5.255 30 20 GKED Clc1ccc(C=NOCc2coc(-c3ccc(Br)cc3)n2)cc1 920486204 TUCFKVUKXASHME-UHFFFAOYSA-N 391.652 5.308 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776113471 KVBLMCQXVMKWHX-ZRDIBKRKSA-N 380.490 5.731 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccsc3)cc2)c1)C(=O)O 1776470730 FUJSYFPYVKFUJL-JOZWUWCOSA-N 378.449 5.163 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776697648 LULIPAPXHHZLGX-VNSQOFGGSA-N 384.475 6.461 30 20 GKED COc1cc(C)ccc1Oc1ccccc1/C=C/C(=O)c1csc(C(=O)O)c1 1777281624 DIOJLKCIFSJTBD-CMDGGOBGSA-N 394.448 5.452 30 20 GKED Cc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1Br 1777433798 OBQRMUXNFIPLBP-PLNGDYQASA-N 385.666 5.067 30 20 GKED CC(C)N(C(=O)COc1ccccc1C#N)c1ccc(Nc2ccccc2)cc1 11342921 MIIRHDHKEVASHS-UHFFFAOYSA-N 385.467 5.122 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CC2)cc1OCCCC#N 64613671 ZZHMCIMRNHKPHF-QFIPXVFZSA-N 384.907 5.272 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1ccc(CC#N)cc1 97173796 XHQLTMFWPUWXDT-HNNXBMFYSA-N 376.485 5.067 30 20 GKED CCc1ccc(-c2noc(CNc3ccccc3SC[C@H](C)C#N)n2)cc1 108354455 AJYSZPDIFAFBTR-OAHLLOKOSA-N 378.501 5.163 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 111766097 FXYVAHOBCWIPBZ-RDJZCZTQSA-N 399.947 5.613 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 121009032 RVOUISAPKBWJDA-KRWDZBQOSA-N 399.475 5.114 30 20 GKED CC1(C)C[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 162545502 TYDPZHIXQYVUIU-HKUYNNGSSA-N 397.906 5.075 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(-c3ccc(F)cc3)o2)ccc1OC 172121550 CMOGZTVXXDMEFG-LJQANCHMSA-N 394.446 5.065 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccccc2CCC(F)(F)F)C2CC2)cc1 176514314 SLDOQZPSGBFUBP-UHFFFAOYSA-N 387.405 5.250 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2c1 177603804 YPQBCWCALGLOFR-LJQANCHMSA-N 385.492 5.409 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CSCc2coc(-c3ccccc3)n2)n1 177768035 BWDZWHINRQKZBS-INIZCTEOSA-N 397.525 5.031 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(NC(=O)OC(C)(C)C)c2)n1 177776198 PKWWCOIZDUDYFI-OAHLLOKOSA-N 385.489 5.104 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 178709798 GEBJYLJYVQPQHF-CYBMUJFWSA-N 398.800 5.365 30 20 GKED C[C@@H](NCc1ccccc1C#N)c1nc(-c2ccc(Br)cc2)cs1 179095813 AMKNWPSVVAWNNA-CYBMUJFWSA-N 398.329 5.295 30 20 GKED CCO[C@@H](C)c1nc(CSCc2ccc(C#N)cc2Br)cs1 183272625 KKRASBXKZPSOSU-NSHDSACASA-N 397.363 5.308 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(c2cccc(C)n2)CC1 191444450 GILNUBPCWCYXGB-UHFFFAOYSA-N 392.547 5.032 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(Br)cs2)cc1 195715526 HTTQXUGJDZLZPM-UHFFFAOYSA-N 399.269 5.427 30 20 GKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccco1 229851083 FAMVYHSIDUEDTN-DAXSKMNVSA-N 388.173 5.106 30 20 GKED COc1cc(C=NOCc2c(Cl)cccc2Cl)ccc1OC(F)F 250400213 YEOXBBOLVOHGSN-UHFFFAOYSA-N 376.186 5.154 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 303269140 GXJAQJZHJMDIQG-AWEZNQCLSA-N 393.537 5.623 30 20 GKED CN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303287282 AKCAXTOLUQPTRK-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C[C@H](/N=C(/O)N1CCCC12CCCCC2)c1nc2ccccc2n1C(F)F 328890490 RQPURUPEISVZLI-AWEZNQCLSA-N 376.451 5.205 30 20 GKED Cc1nc(C2(/N=C(/O)[C@@H]3C[C@H]3c3ccc4ccccc4c3)CCCCC2)no1 329348181 CQTRXMSLWRMFIK-VQTJNVASSA-N 375.472 5.451 30 20 GKED COc1cc(/C(O)=N/[C@@H]2CCCCC23CCCC3)cc(Cl)c1OCC(=N)O 329645791 ZQTKOUAWZNSMRA-MRXNPFEDSA-N 394.899 5.070 30 20 GKED Cc1nc2cc(Cl)c(N=C(O)c3scnc3C3CCCC3)cc2s1 330125410 LYGMCHAOICTFII-UHFFFAOYSA-N 377.922 6.009 30 20 GKED O/C(=N/[C@@H]1CCCC(F)(F)C1)C1(/C(O)=N\[C@@H]2CCCC(F)(F)C2)CCC1 330249525 ZXDABYZQSSZTPV-CHWSQXEVSA-N 378.410 5.226 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC(C#N)(c2ccccn2)CC1 374388281 QMYKAEHHQCJBOA-UHFFFAOYSA-N 390.531 5.418 30 20 GKED CC(C)C1(c2ccccc2)CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 416807598 HHRUVSUJFATMPK-GOSISDBHSA-N 393.556 5.380 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 426325776 WFLYXIXYTULJSF-AWEZNQCLSA-N 395.915 5.982 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(COC(C)(C)CC)c1C 428780290 HQRVOKKXAUQBBY-UHFFFAOYSA-N 386.561 5.982 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ncccc3C(F)(F)F)c2)c1 432302773 NZMQBOXFRZAKRL-UHFFFAOYSA-N 383.373 5.163 30 20 GKED CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 432857759 FUFBLDNDNOGGFT-IIBYNOLFSA-N 399.535 5.938 30 20 GKED CC1(C)CCCN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)[C@@H]1C#N 434022940 QQUKRWIADAZKQI-JOCHJYFZSA-N 388.467 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2ccc(Cl)cc2n1 437558810 NMOOTCBZJPSOAI-ZDUSSCGKSA-N 381.888 5.535 30 20 GKED Cc1cc(C#N)ccc1C(=O)N[C@@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 439052112 CBEMIXWPVDADJO-KRWDZBQOSA-N 398.466 5.002 30 20 GKED CSc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 439494082 DLJPZMCOUXMNSN-GJZGRUSLSA-N 385.558 5.543 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(OC(F)(F)F)c1 441238662 ZDUZCKNVTMPYJI-CYBMUJFWSA-N 391.393 5.269 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C)[C@@H](C)CC#N)cc1 444381204 GZOUOAHUGWLEBR-AWEZNQCLSA-N 387.867 5.297 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(CC#N)cc1Cl)c1ccccc1OC(F)F 455758711 VSEKUYYGQKNEIN-OAHLLOKOSA-N 393.821 5.280 30 20 GKED N#CCCC[C@H](NC(=O)Cc1ccccc1OC1CCCC1)c1ccccc1 457830127 UJGFEAHRQIGUQY-QFIPXVFZSA-N 376.500 5.102 30 20 GKED C=CCCN(C)C(=O)Nc1ccc(Cl)c(C(=O)N(CC)Cc2ccccc2)c1 466393524 YPKZUKJLJSRYBB-UHFFFAOYSA-N 399.922 5.042 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccnn1-c1ccccc1 467361207 BYBKHGLNZSZWME-IBGZPJMESA-N 378.479 5.262 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1 467932512 XUHZLNRGPHFTIA-UHFFFAOYSA-N 390.487 5.212 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCCC[C@H]3c3ccccc3)ccc21 469002355 NIPLEPKGSVMGGF-XZOQPEGZSA-N 387.527 5.408 30 20 GKED CC(C)(C#N)CCCN(Cc1ccc(Cl)cc1)c1ccc2nc(O)[nH]c2c1 472244083 ULSKLIYRKVZLBR-UHFFFAOYSA-N 382.895 5.258 30 20 GKED C=C(C)[C@H](CC(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)OCC 474271234 IQZRSCWQQPPOPN-CABCVRRESA-N 397.359 5.186 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 475259243 NMTZOJYFOYHLCO-UHFFFAOYSA-N 375.428 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](CCc2ccccc2)C1 475549828 PGIJYCXZXCOBCO-QFIPXVFZSA-N 392.543 5.404 30 20 GKED C=C(C)[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)F)c1ccc(F)c(F)c1 475702802 NNYAYUUCZLGLMK-KHYOSLBOSA-N 393.380 5.103 30 20 GKED Cc1nc2ccccc2n1C1CCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1 480837127 JDGCKKRASWMJMI-UHFFFAOYSA-N 384.405 5.077 30 20 GKED N#Cc1cc(Cl)ccc1CN[C@@H](c1ccccc1OC(F)F)C(F)(F)F 481026981 UFPDHKCTEVBWSH-HNNXBMFYSA-N 390.739 5.206 30 20 GKED C=CCn1c(SCc2nc(C(C)(C)C)cs2)nnc1-c1cccs1 481395011 YYUHQQORTBSHDC-UHFFFAOYSA-N 376.576 5.239 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccc(F)c(F)c1 481591172 FVVAKPDFLINPAQ-SGTLLEGYSA-N 389.833 5.636 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 483707766 GRBFGAQAGROHIB-CYBMUJFWSA-N 399.903 5.627 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ncc(-c4ccccc4)cn3)c2)cc1 484700519 INSXZDFWPBCLSP-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccccc1 487455938 PLUJFZFSZMRMTE-LJQANCHMSA-N 375.299 5.477 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1 487562653 FRHHMMCPQONDOX-HSZRJFAPSA-N 397.478 5.104 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CCC2 492075810 MCZRKTLVSDOFME-ZPHPHTNESA-N 381.479 5.097 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(F)c1)c1nc(-c2c(F)cccc2F)cs1 498556637 YRJZYTOMSUKZSJ-SNVBAGLBSA-N 392.789 5.371 30 20 GKED CC(C)(C)c1csc(-c2cccc(OCCCC3(C#N)CCOCC3)c2)n1 499980123 QSDLDJCUEDMQSI-UHFFFAOYSA-N 384.545 5.587 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1c(F)cc(C#N)cc1F 500519359 ANSHKRZZDXHMJQ-UHFFFAOYSA-N 395.409 5.425 30 20 GKED CCOc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1Cl 502630602 MWUNCVQOUNUHPW-UHFFFAOYSA-N 376.843 5.530 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2cccs2)Cc2cccs2)c1 502655349 ZMLIMJUQVRFNNF-UHFFFAOYSA-N 384.526 5.609 30 20 GKED Cc1ccnc2sc(C(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)c(C)c12 505989964 DMWOVTLKBVQRKN-CQSZACIVSA-N 390.295 5.215 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C 510597136 BQAYKUBWBCZFTN-CYBMUJFWSA-N 392.425 5.358 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)c(C)c2c1 516860269 YIDQZFDPDFRCFR-UHFFFAOYSA-N 382.423 5.096 30 20 GKED Cc1ccc2nc(C)c(C(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)cc2c1 520271308 BXRDXVDKCHHSPS-IBGZPJMESA-N 384.266 5.153 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(C#N)cc2)cc1Cl)c1ccccc1 521281374 YBDDPDLNTWOKIT-HNNXBMFYSA-N 375.859 5.637 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CC)c1ccccc1OC(F)F 521732152 HVNMECOZIDRWHZ-IBGZPJMESA-N 399.441 5.009 30 20 GKED C=CCn1c(S[C@@H](CC)c2ccc(F)cc2F)nnc1-c1ccoc1C 523111100 ZULKNZCYZXDIHT-KRWDZBQOSA-N 375.444 5.554 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1 523123401 DKPQADDUFAIWEF-MRXNPFEDSA-N 388.433 5.193 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccc(-c4cnco4)cc3)c2)c1 523710596 PKQCETQXADEKER-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1cc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)ccc1F 534732817 LIVQAPWCVJCMIX-VFNWGFHPSA-N 397.519 5.801 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(OCc2cccnc2)cc1 537021642 GSWCNUDKRDPSRQ-LJQANCHMSA-N 385.511 5.313 30 20 GKED CC(C)c1ccc(-c2nc(C[S@@](=O)Cc3ccc(CC#N)cc3)cs2)cc1 544044639 GBAXZWMXCTYCLY-MHZLTWQESA-N 394.565 5.448 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)NCC2(CC#N)CC2)nc1-c1ccccc1 562386985 CJPHQUJFYUKGJP-GOSISDBHSA-N 392.503 5.005 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c2C#N)[C@H](C)C1 562699420 WYVYLEFGHWHASP-WOSRLPQWSA-N 378.497 5.004 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1SCCc2sccc21 570908720 KTGLMKOPAWZLCO-OAQYLSRUSA-N 390.533 5.184 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@@H]2CC[C@@H](C(F)(F)F)C2)n1 575954908 KTDYCZPVUNDDKJ-YUSALJHKSA-N 382.279 5.593 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1 576024954 PCUNLJJIRXNVIG-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)CCCCCC#N 588157328 FIRWZCCHUMDGGX-ZDUSSCGKSA-N 375.925 5.423 30 20 GKED CCc1ccc(N(C(=O)CCCCCC#N)c2nc3ccccc3s2)cc1 588814457 MLSTWTQDVZEOEH-UHFFFAOYSA-N 377.513 5.997 30 20 GKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(OCc2cccnc2)cc1 594925170 LVNBJHMJDDYMKD-LJQANCHMSA-N 383.495 5.067 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H](C)C(=O)c1ccccc1 602109874 YLUHHSOXIIKIEB-GOSISDBHSA-N 398.462 5.507 30 20 GKED N#Cc1ccc(C(=O)N2CCC(CCc3cccc(C(F)(F)F)c3)CC2)cc1 603990872 AIKGIDMBWIKDFJ-UHFFFAOYSA-N 386.417 5.062 30 20 GKED CN(C(=O)c1cccc(OCc2cccc(Cl)c2)c1)c1ccc(C#N)cc1F 609217051 SRHHTEDYOAGXNN-UHFFFAOYSA-N 394.833 5.206 30 20 GKED Cc1sc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)c(C#N)c1C 609425547 ZZNRIRIQFZRXQS-UHFFFAOYSA-N 399.475 5.811 30 20 GKED COCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)c1ccccc1 609438907 NUZHBUFYWMZQIA-QZTJIDSGSA-N 397.544 5.322 30 20 GKED C[C@H](NC(=O)Nc1ccccc1CN(C)C1CCCCC1)c1cccc(C#N)c1 610319044 FYBPODOWYCJZKY-SFHVURJKSA-N 390.531 5.205 30 20 GKED N#CCC[C@@H](NC(=O)c1cnc(-c2ccccc2Cl)s1)c1ccccc1 610976389 PBTARQAPHNKWGV-QGZVFWFLSA-N 381.888 5.238 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619770322 PQKQCOVPESFSIN-CYBMUJFWSA-N 390.940 5.003 30 20 GKED C=CCOc1c(Cl)cc(CN[C@H](C)c2cn(C(C)(C)C)nc2C)cc1OC 623494637 YALZWWNKXIEYMR-CQSZACIVSA-N 391.943 5.024 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)C1 666081303 OMBANPRLSWDFRK-MRXNPFEDSA-N 397.906 5.412 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 681101488 HFHUFOQBSPWDKA-MRXNPFEDSA-N 398.459 5.113 30 20 GKED Cc1ccc2c(CC(=O)Nc3sc4c(c3C#N)CCCCCC4)c[nH]c2c1 726144508 VEVYZFCKKPDOGB-UHFFFAOYSA-N 377.513 5.250 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1Cl 726449068 ASLJKRXZDAMRLS-UHFFFAOYSA-N 399.903 5.452 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(O)c(F)c1 728438593 IGPSQSWVHTYRBP-CSKARUKUSA-N 395.817 5.333 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCOc3ccccc32)cc1 731280664 SNKNAIIETQRLNA-OFNKIYASSA-N 397.478 5.030 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1c[nH]c2cc(F)ccc12 733083084 CMRGZDCGVYHWFD-FNORWQNLSA-N 393.399 5.235 30 20 GKED C=CC[C@H](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 734361643 VGCHLGYZUGRHMR-HNNXBMFYSA-N 388.311 5.166 30 20 GKED C#Cc1cccc(N(CC)C(=S)Nc2ccc(OC(F)F)c(Cl)c2)c1 735626614 ANKJIANGWAXELQ-UHFFFAOYSA-N 380.847 5.146 30 20 GKED C[C@H](NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 739437631 OKPACRSHMDXAHR-HNNXBMFYSA-N 377.538 5.012 30 20 GKED N#Cc1ccc(NC(=S)N2CC[C@H](CSc3ccccc3)C2)cc1Cl 743019323 VFYNVOLCJXVSBI-AWEZNQCLSA-N 387.961 5.023 30 20 GKED N#C[C@@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 744010951 UAQDIKXKRXMETE-SFTDATJTSA-N 379.463 5.156 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 752521045 KLVSHKDUQHOWFJ-DYVFJYSZSA-N 398.359 5.130 30 20 GKED CC1(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)CCC(F)(F)CC1 753188908 LJVUHQPADFGQCM-UHFFFAOYSA-N 389.471 5.054 30 20 GKED COc1cccc([C@@H](C)CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 753199003 QRDOSWXXUOQBIR-UUOWRZLLSA-N 384.479 5.483 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl)C1CC1 754423416 CCLOCTHSEJSSNR-CHWSQXEVSA-N 398.359 5.128 30 20 GKED CCOCCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCC1 763259149 GMNDNRDSIQLQHR-QFIPXVFZSA-N 376.500 5.268 30 20 GKED CCCCC[C@@H]1NC(=O)N(c2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1=O 771819500 PSMQQUJAEGMRHR-ICSRJNTNSA-N 395.890 5.001 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 774052475 GFJZDUAQICYVNP-UZLBHIALSA-N 398.487 5.607 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O 788694912 XLKSAHMEZICGBX-BMIGLBTASA-N 395.318 5.894 30 20 GKED N#CCOc1cccc(CC(=O)Nc2cccc(-c3cccc(Cl)c3)c2)c1 791207671 MXNSUWJSOWCALJ-UHFFFAOYSA-N 376.843 5.091 30 20 GKED C[C@H]1C[C@@H](C)O[C@@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 800386812 NVCWPYJGDMSVFT-LOVKBYSESA-N 395.311 5.107 30 20 GKED CC(C)(CCC#N)CN[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](c2ccccc2)C1 824395691 IZGCYDDZVNYWPB-PMACEKPBSA-N 385.552 5.047 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C/c1ccsc1 914520246 JPWQYAZUBOSFRZ-RMKNXTFCSA-N 376.456 5.314 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2nc3ccccc3s2)cc1 915180643 QOKIERZBIRWNRQ-JWHUVLAVSA-N 395.487 5.604 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccccc2F)C2CC2)cc1 915351499 DAKPAAKMQIBOII-QHCPKHFHSA-N 399.469 5.678 30 20 GKED N#C[C@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1nc2ccccc2s1 916846360 QTAUWJSOMPUNMT-CYBMUJFWSA-N 392.427 5.284 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccc(OC(C)C)cc2C)cc1OC 917781336 HZDQGUYFWMDUGZ-XYOKQWHBSA-N 381.472 5.008 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@H](C#N)C(=O)Nc3ccc(F)c(Cl)c3)oc12 920110056 MPVDDEVZJUWTNU-AWEZNQCLSA-N 398.821 5.112 30 20 GKED Cc1cccc2[nH]cc(C=Nn3c(C)nc4scc(-c5ccccc5)c4c3=O)c12 920362405 AWNYZACOSUSFGM-UHFFFAOYSA-N 398.491 5.105 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(O)c2)cc1)c1ccccc1 1776469394 GJFSKJFZFRJHKX-VCHSTOLQSA-N 388.419 5.127 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(-c2ccc(Cl)cc2)c1 1776784763 RWJFDNSACSBDPL-QFIPXVFZSA-N 387.951 6.300 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)[C@H]2CCc3ccccc32)c1 1776788204 YSTRARGQMUGCLV-BJKOFHAPSA-N 395.543 5.309 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C/c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777455813 CNZHYYRYTGADFD-NQRZERFFSA-N 398.458 5.656 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1-c1ccccc1 38638431 UMPMCSBIIQGHIT-HSZRJFAPSA-N 392.462 5.089 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(F)cc2F)cc1 45826085 WSMVATVIRFCXKW-UHFFFAOYSA-N 380.419 5.381 30 20 GKED CC(C)c1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cnn1-c1ccc(F)cc1 48858456 LODAZYFISHWWKP-IBGZPJMESA-N 398.441 5.173 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cnc(-c2ccc(C)cc2C)s1 61199475 OYWSNKHBDKNHDG-UHFFFAOYSA-N 387.508 5.127 30 20 GKED Cc1nc(-c2c[nH]c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2)cs1 66856327 ZANIDMJDJOPNBC-LBPRGKRZSA-N 382.514 5.093 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 112128364 XKOMAJRKLPVYCV-HZPDHXFCSA-N 377.579 5.220 30 20 GKED Cc1nc(-c2ccc(NC(=O)Nc3cccc(OCCCC#N)c3)cc2)cs1 113533992 GDLYKUWNCIUWNV-UHFFFAOYSA-N 392.484 5.445 30 20 GKED CN(CCC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116633682 JRLZVEOTTPKHQQ-UHFFFAOYSA-N 382.769 5.028 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128809949 YAOANUHTWMRVAV-LJQANCHMSA-N 391.496 5.120 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128826019 YGNQTFSTNQNTKI-AIADIJKESA-N 387.508 5.392 30 20 GKED C=C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 136643738 UVQATGBOKNDYKC-CZUORRHYSA-N 387.266 5.001 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)cc2F)C(C)C)cc1OCCCC#N 150883171 YQQOKKCSCCZCMI-JOCHJYFZSA-N 388.458 5.143 30 20 GKED N#CCCCOc1cccc(CNc2cccc(NC(=O)C3CCCCC3)c2)c1 152397913 RQIITXUKKKRIOP-UHFFFAOYSA-N 391.515 5.500 30 20 GKED CC(=O)c1csc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 158766297 DNVOGWUAAMDJTE-AWEZNQCLSA-N 386.885 5.218 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cnc(Cc2ccccc2F)s1 185674500 JKHHBQGEJDAEFJ-UHFFFAOYSA-N 397.500 5.131 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 191463129 DIRRHBCFTQMBHC-OAQYLSRUSA-N 377.532 5.647 30 20 GKED N#CCCCOc1cccc(CNc2ccc(C(=O)NC3CCCCC3)cc2)c1 195145556 WIHILJCJLJWQOE-UHFFFAOYSA-N 391.515 5.044 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 255850361 ZFPDPPDIFFPHNL-HCYCVZQXSA-N 385.801 5.365 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)CC2CCCCC2)CC1)C1=CCN(C)CC1 329530643 VUKBAUVBKHQUBJ-RPCJCACASA-N 389.584 5.079 30 20 GKED N#CCCn1ncc(C(=O)Nc2cccc(NC3CCCC3)c2)c1-c1ccccc1 430552278 JSQMDFYYZPQDIK-UHFFFAOYSA-N 399.498 5.071 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(-c3ccccc3Cl)on2)s1 430624184 IMTHCMPYAUHSEV-LBPRGKRZSA-N 385.876 5.239 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1ccccc1 431317577 YWIRCUODCKEGEM-HMXCVIKNSA-N 381.907 5.320 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 431440478 IVHJAIJELMQVFK-UHFFFAOYSA-N 386.329 5.098 30 20 GKED Cc1c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cccc1-c1ncco1 433142030 BYJOSGNOQWRARG-AWEZNQCLSA-N 392.484 5.688 30 20 GKED CCOCc1ccc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 438033429 SNURKXYQBDFBOD-UHFFFAOYSA-N 387.439 5.531 30 20 GKED CCSCc1cccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 438375882 IKHINTXAVNUQPS-SFTDATJTSA-N 379.529 5.243 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(CC)(CC)c2ccccc2)cc1 440384293 OZCNQHSHPQWBQO-UHFFFAOYSA-N 390.527 5.197 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc3c2CN(c2ccccn2)C3)CCCC1(C)C 444926556 XRCJYCBCEMAAIO-NRFANRHFSA-N 390.531 5.200 30 20 GKED Cc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c(C)n1 446417576 JGNRKUOYAUUMJJ-UHFFFAOYSA-N 377.831 5.268 30 20 GKED COc1ccc(F)c(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 446446483 DRMKRXZZUFVIPJ-UHFFFAOYSA-N 381.247 5.124 30 20 GKED C=CCCCNC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 448010506 FMQLLYLLHSKRIB-UHFFFAOYSA-N 391.393 5.045 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F 454743935 DVAMWKWWJXKELM-ILXRZTDVSA-N 399.482 5.571 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1)c1ccccc1 458797424 GHPVZNHWQXRPNS-RTWAWAEBSA-N 381.907 5.622 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c1 460171844 MKLJQQBCTHGTAF-KBPBESRZSA-N 397.208 5.209 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2COc3c2ccc(Cl)c3Cl)cc1 466218106 PTDUJQWUQRKUEU-HNNXBMFYSA-N 390.270 5.050 30 20 GKED CC[C@]1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)C1 467859441 SDRJPMIRDACNHX-JOCHJYFZSA-N 379.460 5.013 30 20 GKED C[C@]1(c2ccccc2)CCCN(C(=O)c2cn(CCCC#N)c3ccccc23)C1 469385566 FRHHFRYAUXYVFD-VWLOTQADSA-N 385.511 5.139 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Nc2ccc(C(F)(F)F)cn2)cc1 469702243 PSEABHHJXFKJSN-UHFFFAOYSA-N 388.374 5.029 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)CC(=O)c1cn(CCC#N)c2ccccc12 472426199 AVFVGYQKLZGTMF-INIZCTEOSA-N 379.891 5.084 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1COCc1ccccc1)c1ccccc1 474902889 PWYXIQFVFHVXOB-JOCHJYFZSA-N 384.479 5.429 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cccc(C(F)(F)F)c1 475573553 SWGLNHAUSMXDMZ-UHFFFAOYSA-N 390.449 6.221 30 20 GKED Cn1c(-c2ccc(NC(=O)C[C@@H](CC#N)c3ccccc3)cc2)nc2ccccc21 475581393 JCMDKYVZRJZQNT-HXUWFJFHSA-N 394.478 5.266 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 476121307 GHOBVZOYTFCTHP-RBUKOAKNSA-N 387.445 6.300 30 20 GKED CCC(CC)[C@@H]1C[C@@H](NC(=O)c2ccccc2Oc2ccccc2C#N)CCO1 479790738 UAMRSYGIMXWSTD-CVDCTZTESA-N 392.499 5.064 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 480566382 ZJWCPJKNLPZXHD-HZSPNIEDSA-N 385.455 5.276 30 20 GKED C[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2n1C(F)F 486436255 MMSXCTUGWLSPKJ-JTQLQIEISA-N 380.320 5.495 30 20 GKED Cc1cc(Cl)ccc1Cc1cnc(NC(=O)NCC(C)(C)CCC#N)s1 496427774 JKXGYYJNWIQEHJ-UHFFFAOYSA-N 390.940 5.147 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@H](C)c1ccc(C#N)cc1 499369189 AYPBTIRKXDWKPS-VOBQZIQPSA-N 397.316 5.034 30 20 GKED N#C[C@H](NC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)c1ccc(Cl)cc1 499842396 VXMANQNXCAKDFW-HNNXBMFYSA-N 378.646 5.123 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@H]3CCCC(F)(F)C3)cc2F)c1 500815842 NSAJNQCVLHIVDF-INIZCTEOSA-N 388.389 5.040 30 20 GKED CC[C@@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 504275005 PMVQDTIGEOWSHS-NRFANRHFSA-N 398.506 5.854 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1 505015997 AGYLJTFZQYCSOJ-JOCHJYFZSA-N 375.447 5.250 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCCC[C@@H]1c1noc(C(C)C)n1 505022173 BBSQKOTWKNFJNQ-LJQANCHMSA-N 382.508 5.461 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cc(C#N)ccc2Cl)c(C(F)(F)F)c1 511396114 UAFNBNSNIFWHNT-UHFFFAOYSA-N 382.769 5.270 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCc1ccsc1 514536980 NDCXELDAJJKZBL-UHFFFAOYSA-N 378.472 5.233 30 20 GKED CCc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)sc1C 517461983 XDFGTPKENITVJV-UHFFFAOYSA-N 398.475 5.896 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c(C)n1C(C)C 518871630 COZDUOWPRUYCGX-OAHLLOKOSA-N 399.466 5.578 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 520195800 MKEQHZTZXNUAIQ-MGPUTAFESA-N 399.535 6.129 30 20 GKED COc1ccc(C2(NC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)CC2)cc1 520283554 FWYQFZGGDSXTCA-UHFFFAOYSA-N 399.450 5.170 30 20 GKED CCCn1c(S[C@H](C)c2ccc(C#N)cc2)nc2cc(Cl)ccc2c1=O 522822556 DJHYFKFXEDWIBE-CYBMUJFWSA-N 383.904 5.185 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCC1CCCCC1 524437871 DPKUPNSMZQMBAO-UHFFFAOYSA-N 377.488 5.148 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1 524859452 NCBIWZVPXFFOML-MMPTUQATSA-N 397.664 5.270 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1ncc(-c2cccc(F)c2)[nH]1 530405656 FKEMCEMERGCLRL-OAQYLSRUSA-N 399.510 5.032 30 20 GKED CC[C@@H](C)n1c(SCc2ccc(OC)c(C#N)c2)nnc1-c1ccccc1 533331789 GMRFMMGKIFVAKR-OAHLLOKOSA-N 378.501 5.089 30 20 GKED C=CCCOCCCCC(=O)N1CC[C@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 538282710 LRVOFRJQFUUGNI-JXFKEZNVSA-N 383.454 5.378 30 20 GKED O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)[C@H]1CCC[C@@H](C(F)(F)F)C1 544061225 FUQFEOKFDHMXPR-IGJMFERPSA-N 389.286 5.053 30 20 GKED N#CC1(c2nc(-c3cc(Cl)ccc3OCC(F)(F)F)no2)CCCCC1 546469816 NNIQUJVAXSLISD-UHFFFAOYSA-N 385.773 5.057 30 20 GKED C=CCC[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccco1 560530013 OPEYLEZGKUXKTB-JOCHJYFZSA-N 384.483 5.324 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccccc2F)C1 569719163 DPQWSFXNRBLMOU-HOTGVXAUSA-N 383.492 5.099 30 20 GKED CCN(CCC1CC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 572084214 AQVUWBWUIPKEEF-UHFFFAOYSA-N 379.460 5.013 30 20 GKED C=C[C@@](C)(CCOC)c1nc(C2(c3cccc(C(F)(F)F)c3)CCC2)no1 574000907 SDJCORLZYRBNOM-SFHVURJKSA-N 380.410 5.039 30 20 GKED N#Cc1cccc(F)c1Cc1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 582326878 YTPRRWPVKASYNK-UHFFFAOYSA-N 398.171 5.118 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccnc3C(F)(F)F)cc2)cc1 582511206 BVGYAHPBOUNZJI-UHFFFAOYSA-N 397.356 5.211 30 20 GKED O=C(Nc1cccc(C#Cc2ccccc2)c1)N1CCCO[C@@H](c2ccccc2)C1 591835501 GKUGGYMBHXBLKC-RUZDIDTESA-N 396.490 5.082 30 20 GKED CC1(CC(F)F)CN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 592836122 SROXYPYQIHJNSH-UHFFFAOYSA-N 390.817 5.121 30 20 GKED CC[C@H](C#N)N(C)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 594089945 YDFIEPZGPUANEA-LLVKDONJSA-N 380.275 5.146 30 20 GKED FC(F)c1nc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2ccccc2n1 595535138 KYSNIZDUSQXXJO-RKDXNWHRSA-N 399.285 5.135 30 20 GKED CCCCc1ccc([C@@H](NC(=O)CC2(C#N)CCOCC2)c2cccs2)cc1 596710041 JLGWILXJCZMLBW-JOCHJYFZSA-N 396.556 5.007 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccccc3Oc3cccnc3)n2)cc1 604523292 VRVNZPRHIUUZFZ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCSc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609073803 YTJXCWLXAIIXJE-UHFFFAOYSA-N 388.492 5.502 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 609222099 SLKQLMZAZDGKMR-SFHVURJKSA-N 399.494 5.913 30 20 GKED CC(C)CN(C)c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609377933 RVTOPCOCHFDIBI-KRWDZBQOSA-N 381.545 5.283 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 609969150 IZLMIJPOJNKEAX-MRXNPFEDSA-N 386.417 5.285 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 610225651 VIBUALKXTMPFJZ-CVEARBPZSA-N 375.255 5.006 30 20 GKED CC(C)c1ccc(CSc2nnc(SCc3ccnc(C#N)c3)s2)cc1 610955235 YGSNKUQIZZJJOA-UHFFFAOYSA-N 398.582 5.513 30 20 GKED C=C(C)CN(CC)C(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1 612345595 BTKTUXYUVJRQCJ-UHFFFAOYSA-N 391.559 5.057 30 20 GKED O=C(CCCF)N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 613419050 JBOFTHSYCBWMLA-LLVKDONJSA-N 399.228 5.194 30 20 GKED C=CCCC1(CNC(=O)c2c(C(F)(F)F)nn(CC)c2C(F)F)CCCC1 617417234 QNHVIVCBVNXEAO-UHFFFAOYSA-N 393.400 5.116 30 20 GKED C[C@@H](CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(F)c1 619125171 KEDDUVLUBMZULM-NSHDSACASA-N 387.339 5.489 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 620310174 WTYSZUNGFWGLGY-GASCZTMLSA-N 378.419 5.152 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccc(C)cc1 623734642 NIKXQUFWODJZTJ-UHFFFAOYSA-N 377.257 5.117 30 20 GKED N#CCSc1ccccc1C(=O)NCc1ccccc1-c1ccc(Cl)cc1 726784614 XWBHGIQCPBWQHD-UHFFFAOYSA-N 392.911 5.553 30 20 GKED CCOc1cc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)ccc1O 728441700 OVFIVAYNQMTCMO-LUAWRHEFSA-N 383.444 5.258 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1cccc(Oc2ccc(C#N)cc2)c1 729160025 GTEHCFYRKXCDPT-UHFFFAOYSA-N 393.899 6.121 30 20 GKED CCCCCCOCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 730922657 XMTZKTGHVLCMQF-CYBMUJFWSA-N 384.423 5.088 30 20 GKED Cc1ccc(-c2ccc(C(=O)OCc3ccc(OCC#N)cc3)c(F)c2)cc1 733490802 XFRVSZNDFLHBKU-UHFFFAOYSA-N 375.399 5.061 30 20 GKED C[C@@H](OC(=O)c1ccnc(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733710329 RTRNNGYLXJZRQP-MRVPVSSYSA-N 381.247 5.176 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)cc1 734059586 BBIFFROZIIJBSX-ZCYQVOJMSA-N 385.511 5.696 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)SCc1cc(Cl)ccc1OCC#N 735319798 CWHAEOFOCPYHTI-AWEZNQCLSA-N 388.920 5.065 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 739155776 VQGPBTIVIYTXFJ-VGOFRKELSA-N 384.479 5.243 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2c1 746126056 RPCJRZCNTKGEOT-DEOSSOPVSA-N 393.490 5.703 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)n1Cc1ccccc1 747197932 OKJDPLORBZJRAD-LJQANCHMSA-N 377.513 5.223 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccc(C)s3)n2)cc1 751154257 ZXCWLBHATNGYKZ-GOSISDBHSA-N 380.538 5.688 30 20 GKED N#C[C@@H](C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1nc2ccccc2o1 751830457 LCMKFVUIWYPAJJ-IKIYBABPSA-N 388.389 5.153 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 752238557 RTODFQVCKQRHFF-KSSFIOAISA-N 385.920 5.713 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)COc2cc(Cl)cc(Cl)c21 758919279 QARQTVKQHKJBFP-WZUFQYTHSA-N 389.263 5.171 30 20 GKED O=C1/C(=C\c2nc(Cl)cs2)CCc2nc(-c3ccc(F)cc3)sc21 759085218 SYSGXBQOUHPSDU-YFHOEESVSA-N 376.865 5.272 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cc(C)ccc2F)cs1 763288517 HXIIXJFQEBTTEB-POHAHGRESA-N 398.434 5.310 30 20 GKED COc1ccc2ccccc2c1-c1cc(COC(=O)C2(C#N)CCCCC2)on1 778107742 MEOHOVALDVSCJV-UHFFFAOYSA-N 390.439 5.021 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=S)Nc1ccccc1Oc1ccccc1 779726015 HMVZYECJCFUHKZ-INIZCTEOSA-N 389.480 5.579 30 20 GKED CC[C@H]1C[C@@H](C=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CCO1 779762508 ZLNSYVCLFOONBZ-BBRMVZONSA-N 384.480 5.100 30 20 GKED C=CC[C@H](N[C@@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccncc1 790679785 VUPQMZXTRYKRCZ-SJCJKPOMSA-N 399.254 5.831 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 798432943 RBGIZBDJGWORKP-ZIAGYGMSSA-N 392.446 5.699 30 20 GKED Cc1ccc(C(=O)N2CCC(c3nc(-c4ccccc4)cs3)CC2)cc1C#N 799619778 IKWOYOFQXKIRRU-UHFFFAOYSA-N 387.508 5.010 30 20 GKED O=[N+]([O-])c1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1F 801539311 WOWKQBSJVQRVGF-AWEZNQCLSA-N 396.262 5.146 30 20 GKED CC(CCCCNC(=O)OC(C)(C)C)=NNc1ccc(C#N)cc1C(F)(F)F 811648671 WMYGIUZTKDZDCI-UHFFFAOYSA-N 398.429 5.060 30 20 GKED CC(/C=C\C(=O)c1ccc2c(c1)CCC(=O)N2C)=C\c1ccccc1OC(F)F 811692701 GYNIZRPBKVVHSB-WBQBQJITSA-N 397.421 5.039 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1csc(-c2ccccc2F)n1 812223319 VNSHCDSWOBQUBN-UHFFFAOYSA-N 389.839 5.137 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1ccc(N2CCCOC2=O)cc1 814694157 YAVUMYMMFYOYGP-UHFFFAOYSA-N 394.862 5.071 30 20 GKED C[C@@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1(F)F 817713613 UIOHJSORCJDBAD-BONVTDFDSA-N 387.238 5.338 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC[C@@]1(C)CC1(Cl)Cl 836387668 CKYIMSPEMQSVOJ-WBMJQRKESA-N 386.348 5.176 30 20 GKED C[C@H](NC(=O)N1CCC[C@@]2(C1)CC2(F)F)c1ccc(-c2cccc(C#N)c2)cc1 845103347 SFFAHMYUHJMETD-AOMKIAJQSA-N 395.453 5.117 30 20 GKED C=C(C)C[C@H](NCc1cc(C)c(OCc2ccccc2Cl)c(C)c1)C(=O)O 864530380 XCXQVRDAQGAMCO-FQEVSTJZSA-N 387.907 5.045 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCc3cc(F)ccc32)cc1 919904263 CQJXUUKZUPHMOG-DHIUTWEWSA-N 385.442 5.290 30 20 GKED COc1ccc(C[C@H](C)C=NNc2cccc(C(=O)O)c2C)cc1C(C)(C)C 1776088716 DSYYMURAODPRNF-HNNXBMFYSA-N 382.504 5.276 30 20 GKED C=CCc1cc(/C=C/c2nc(C(=O)O)c(-c3ccccc3)s2)cc(OC)c1O 1776186383 YSJCCNWURZVFBM-ZHACJKMWSA-N 393.464 5.121 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(COc2ccccc2)c1 1776783725 GAVBOBVDNSDQNN-QFIPXVFZSA-N 383.532 5.559 30 20 GKED CCCCCCCOc1cccc(CN[C@@H]2CCCCCC[C@@H]2C(=O)O)c1 1776787466 VQPVUNLWPLIFKQ-FCHUYYIVSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1cccc(CNc2ccc3nccc(C(=O)O)c3c2)c1 1776787593 JUSOULRUBUPQRC-UHFFFAOYSA-N 392.499 5.894 30 20 GKED C[C@@H]1/C(=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1777407760 BOGPYIZYUXDSCL-TXCSHLTQSA-N 384.431 5.275 30 20 GKED CC(C)(C)CCCCCC(=O)Nc1ccc(C2(NC(=O)CCC#N)CCC2)cc1 1791382141 ZDHAVFOPLPPRDE-UHFFFAOYSA-N 397.563 5.421 30 20 GKED CCCn1c(C)cc(-c2csc(NC(=O)CCc3ccc(C#N)cc3)n2)c1C 10944861 MPIFOSDDLVBXPF-UHFFFAOYSA-N 392.528 5.081 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(-c3csc(C)n3)c2)cc(OC)c1OC 16233224 FWNVHFVKKPBEAH-UHFFFAOYSA-N 394.496 5.117 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cc(C)ccc2C)cc1 22729619 BLKBXARWAJZEPD-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#Cc1ccc(CN2CCC(c3nc4cc(Cl)ccc4s3)CC2)c(F)c1 25037209 WJFGZCCQECXWOT-UHFFFAOYSA-N 385.895 5.340 30 20 GKED C=C(C)COc1cc(/C=C/C(=O)c2ccc(SC)c(OC)c2)ccc1OC 64853596 GZANYNLAOUFIGG-RMKNXTFCSA-N 384.497 5.277 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1cccc2ccccc12 66861019 NURDNTQENADMFR-INIZCTEOSA-N 375.497 5.285 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 68195320 FTMJNHYMXCABMJ-UHFFFAOYSA-N 389.436 5.011 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)c1ccccc1Cl 108356548 YWIKKAAHZLMNRS-GJZGRUSLSA-N 387.936 5.024 30 20 GKED CCOc1ccc2nc(-c3ccc(NC(=O)N(C)[C@H](C)CC#N)cc3)sc2c1 119927752 QXTNCJACDKBQQL-CQSZACIVSA-N 394.500 5.128 30 20 GKED COc1ccc(Cl)cc1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 119993100 MRZJCMQLRMMLOR-ZDUSSCGKSA-N 391.279 5.031 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1nccs1 152871859 YKVAAIPLIMRJHO-GOSISDBHSA-N 392.484 5.388 30 20 GKED Cc1coc(-c2cc(NC(=O)Nc3cccc(OCCCC#N)c3)ccc2C)n1 154109305 WIGMOIDZUIMOID-UHFFFAOYSA-N 390.443 5.285 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2)ccc1OC 174091877 LTXOICOBBHHLJL-BBRMVZONSA-N 393.314 5.534 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 182338354 IZNIVCCYZANFEP-RHSMWYFYSA-N 399.491 5.113 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 183805945 QZMWUOWWQXSIOT-KRWDZBQOSA-N 380.513 5.239 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(OC)cc1 191453918 QSADIBZQKHYVJP-QFIPXVFZSA-N 378.516 5.916 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1ccccc1F 195533269 PEVLDQAPGIKWEO-UHFFFAOYSA-N 394.450 5.250 30 20 GKED Cc1nc(/C=C\c2ccc(C#N)s2)sc1C(=O)/C=C\c1ccc(C#N)s1 255440788 NVURPHCBZXPSPS-VRHVFUOLSA-N 393.518 5.384 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C[C@H]2CCc3ccccc32)cc1 261477183 LCEGUKSZHKCYSC-OAQYLSRUSA-N 396.490 5.390 30 20 GKED CC(C)(C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccc(F)c1 303746341 GBRPKRCBMXOPBJ-UHFFFAOYSA-N 388.442 5.193 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 429661140 WAVJBTWPFHYBLJ-ZDUSSCGKSA-N 377.366 5.121 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(Oc2ccccn2)c1)c1ccccc1 432996949 IXQHBDYQAINQCI-NRFANRHFSA-N 386.455 5.431 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(Sc2ccccn2)cc1 436358630 GKWJQDAKLLTZBX-VXKWHMMOSA-N 399.519 5.145 30 20 GKED Cc1cc(O)c(C(C)C)cc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 436546589 QBSIOVDWTNENFX-INIZCTEOSA-N 377.271 5.126 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(C(F)(F)F)ccc1F 437946459 ILOOXSDVYYCPKQ-MAUKXSAKSA-N 391.368 5.148 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(F)(c3ccc(Cl)cc3)CC2)cc1 439323812 ICIXBZWTUXTFLY-UHFFFAOYSA-N 399.897 5.634 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)c1 441196685 KBNDWMTUDYIJBO-IBGZPJMESA-N 396.878 5.150 30 20 GKED N#CCCCOc1cccc(NCc2cnc(CCc3ccccc3)s2)c1 449042711 TWXCOLLYCMWRMK-UHFFFAOYSA-N 377.513 5.223 30 20 GKED COCCCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1Cl)c1ccccc1 455733651 NUFFVJVLIHIFNP-LJQANCHMSA-N 385.895 5.086 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(Cl)c1 457591576 WTBKRUKRNGCNGE-AWEZNQCLSA-N 388.920 5.631 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 466434301 KFTBBWRYYQWVLR-VGOFRKELSA-N 378.541 5.837 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(CCC)cccc1C(C)C 471900699 GMDKLFCUQKDJLM-UHFFFAOYSA-N 375.516 5.854 30 20 GKED N#CC[C@@H](CC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccccc1 474941068 AAAUGSFNJWFZDU-INIZCTEOSA-N 397.450 5.038 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1ccccc1 476282532 FPUJTLKWNVLQNV-HXUWFJFHSA-N 395.462 5.445 30 20 GKED COc1ccc(CN[C@@H]2CCCC[C@@H]2Cc2ccccc2)cc1OCCCC#N 477335999 FDXKBQMVCMTOBL-DHIUTWEWSA-N 392.543 5.269 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C(F)F)ccc1Cl 478095390 NSCRJPUZRSNONJ-UHFFFAOYSA-N 396.869 5.665 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cc(-c4ccccc4)ccc3Cl)o2)cc1 480171691 UEHMOKZWAFHBEL-UHFFFAOYSA-N 386.842 5.541 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1 482101231 GAGRRQJPWUWWKZ-DEOSSOPVSA-N 398.487 5.302 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1C 482805630 RGUYVXMPTIPCDE-HNNXBMFYSA-N 390.512 5.438 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1Oc1ccncc1 483201234 POPDUGAKXMMASJ-NRFANRHFSA-N 379.419 5.221 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 483362477 AAQFCUBGEPFOGE-UHFFFAOYSA-N 396.438 5.280 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cn(C)c4ccc(F)cc34)n2)cc1 483447296 DYTQCZJAFZXMPP-KRWDZBQOSA-N 389.455 5.239 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CC1 485428855 BAAVSPKQPPCQTG-AWEZNQCLSA-N 385.920 5.545 30 20 GKED Cc1cccc(-c2nc3ccc(F)cc3n2C(C)C)c1NC(=O)CC(C)(C)C#N 485904030 ZSEGOHOXDYDVKC-UHFFFAOYSA-N 392.478 5.610 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)c(C)c2)ccc1OCc1ccccc1 488132882 YAUXYVLLYVYOHN-IBGZPJMESA-N 386.495 5.305 30 20 GKED N#CCC[C@H](NC(=O)Nc1cc(Cl)ccc1C(F)(F)F)c1ccccc1 489734105 NCTHQZJLESNLQY-HNNXBMFYSA-N 381.785 5.525 30 20 GKED Cc1c(NCc2cccc(OCc3cccc(C#N)c3)c2)cccc1-c1ncco1 491580093 XPLXWNSMPYDQOJ-UHFFFAOYSA-N 395.462 5.713 30 20 GKED C=CCC[C@H](NC(=O)C[C@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 496015633 WIYZXUHIGMYPFU-UGSOOPFHSA-N 393.453 5.363 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC=C(c4ccccc4F)C3)cc2)cc1 501563331 CYZHFUFWBJKQJZ-UHFFFAOYSA-N 398.437 5.223 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc4c5c(cccc35)CC4)CC2)cc1 503646313 XAMVCFUXGNMNCK-UHFFFAOYSA-N 379.463 5.131 30 20 GKED N#Cc1cc(F)ccc1CN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 505879017 CARJHXZNHQEAEC-HNNXBMFYSA-N 376.275 5.109 30 20 GKED CCOc1ccc([C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1OC 507654922 YELVPOVRNUIBEB-ZGYBWILLSA-N 378.516 5.149 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1cc(C#N)ccc1Cl 510825975 KPZUCJHCFCLIKT-INIZCTEOSA-N 390.870 5.912 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1ccncc1F)c1ccc(C(F)(F)F)cc1 511531194 YAHLVNRVHOBNHS-ACJLOTCBSA-N 395.400 5.307 30 20 GKED C[C@H]1CCN(C(=O)NCC(C)(C)CCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1 513118410 KKENNLYEZGRXSQ-YOEHRIQHSA-N 381.442 5.128 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cnc(-c4ccccc4F)s3)c2C#N)C1 518648199 MKPGMUAQLIPNDU-LLVKDONJSA-N 397.500 5.259 30 20 GKED CCCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 518739646 JKFGJXDIOIHQSJ-SJORKVTESA-N 375.472 5.548 30 20 GKED Cc1ccc2oc(C(=O)N[C@H](C#N)c3ccc(OCc4ccccc4)cc3)cc2c1 519129518 ZUIZTVOGZMXYFB-JOCHJYFZSA-N 396.446 5.315 30 20 GKED CC[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 519519547 UQCLSCRYZVSACN-OAQYLSRUSA-N 398.915 5.801 30 20 GKED CC(C)(NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 520790212 DZFLGVFTZFPLNU-UHFFFAOYSA-N 399.494 5.388 30 20 GKED CC(C)OCc1ccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 523125904 UJQFQONAYYHBIM-UHFFFAOYSA-N 385.467 5.479 30 20 GKED C=C(C)COc1cccc(NCc2csc(COc3ccc(OC)cc3)n2)c1 533208618 LAFIAXARLCSUML-UHFFFAOYSA-N 396.512 5.298 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1cccc(Br)c1)c1ccccc1 535354113 JEAYFTCMUHCJOO-JXFKEZNVSA-N 384.317 5.473 30 20 GKED COc1ccccc1[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccccc1Cl 538396552 OOWTYNNWFJWBRE-QMHKHESXSA-N 376.887 5.660 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)Nc1cccc(OCCCC#N)c1 540726372 RDNAFVMYDHLURS-KRWDZBQOSA-N 391.540 5.898 30 20 GKED Cc1cccc(C)c1NC(=O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542948141 NTYCBAFDCIRVTC-IBGZPJMESA-N 383.495 5.131 30 20 GKED CC(=O)Nc1cccc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 543921921 ZNIVQBUIFIEVFB-ZWKOTPCHSA-N 383.495 5.595 30 20 GKED C[C@@H](NCc1cc(-n2ccnc2)cs1)c1ccc(-c2cccc(C#N)c2)cc1 544174432 HZFSIIWUUFVIRY-QGZVFWFLSA-N 384.508 5.323 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCCC[C@H]2CCCCO2)c1 546162664 MHOMHVWDZGFKSY-LJQANCHMSA-N 398.890 5.083 30 20 GKED C[C@@H](N[C@H](C)c1cccc(-n2ccnn2)c1)c1ccc(-c2cccc(C#N)c2)cc1 554386450 YNFFRCCVMRMRTI-RTBURBONSA-N 393.494 5.218 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ncc(-c2ccccn2)s1 557388723 KCFVYIKYJSMIND-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](NCc1ccccc1CN[C@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1 558742889 OWXIABKJDGLPII-BGYRXZFFSA-N 394.522 5.132 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)CCCCCC#N)c2)cc1 588647580 KRLCWXIIPFGKNA-FQEVSTJZSA-N 392.543 6.134 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCCCOc1ccc(Cl)cc1 588667657 DABCHAVPAAMUAW-UHFFFAOYSA-N 395.311 5.006 30 20 GKED COc1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C2CC2)cc1Cl 594204036 PBPYQDMHSDJWPN-IBGZPJMESA-N 397.906 5.783 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccccc2Nc2cccc(C(F)(F)F)c2)C1 597916489 NCYQRJSDFOPDGU-OAHLLOKOSA-N 387.405 5.215 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)cn2)cc1 604510946 SSSKXUVCDNGQQE-WOJBJXKFSA-N 389.842 5.141 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NCC(=O)Nc1ccc(CC#N)cc1 608856182 BKWWWWSODFXPDX-UHFFFAOYSA-N 389.886 5.432 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609031076 AEIYTAHCBDHXND-ROUUACIJSA-N 385.294 5.183 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC[C@H]2c2ccccc2Cl)c1 609082667 UJKAINZGTCKQLY-INIZCTEOSA-N 391.805 5.182 30 20 GKED CCc1cccc2c1OCC[C@@H]2NCc1cccc(OCc2cccc(C#N)c2)c1 609223627 QUOXWQVNZRZCTK-VWLOTQADSA-N 398.506 5.313 30 20 GKED C[C@@H](SCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccc(C#N)cc1 609825953 DSGIWTCHRDPKRY-LLVKDONJSA-N 398.837 5.663 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)CSc1ccc(C#N)cc1 609908738 LZYKQGFSXXQETO-HXUWFJFHSA-N 392.549 5.121 30 20 GKED CN(CCC#N)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196209 SFGAJTUKJGMPDZ-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)c(OC)c1 626633578 CQILTRNFLUCYCN-UHFFFAOYSA-N 388.305 5.562 30 20 GKED CSc1ccc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 642281260 UDAXHWWKYAKKEP-GOSISDBHSA-N 378.522 5.639 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F 648583018 QDOOTLLQAZECPN-AMIZOPFISA-N 384.295 5.005 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2sc3c(c2C#N)CCCC3)cc1 669961312 WXAZOJNVAKSNLV-AWEZNQCLSA-N 380.513 5.079 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)ccc1F 675737357 GAALXMNSIMOKSV-SVDPJWKOSA-N 375.303 5.525 30 20 GKED C=CCC[C@@H](NC(=O)N(C)CCC(F)(F)F)c1ccc(C(F)(F)F)cc1 676727630 XRDVVBYOXKBTII-CQSZACIVSA-N 382.348 5.307 30 20 GKED CC(C)[C@H](C(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 677301343 WBHMWVPEGJMRKP-GUTXKFCHSA-N 399.350 5.155 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NCC(=O)Nc1cc(Cl)ccc1C#N 725794507 HTZCPNPUAAGQFH-UHFFFAOYSA-N 387.936 5.461 30 20 GKED CC(=NNc1ccc(OC(F)F)cc1)c1sc2nc(C)nc(C)c2c1C 726426783 GXCDHLOKXBSNSE-UHFFFAOYSA-N 376.432 5.054 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 730742071 SREOLIAOEXUXND-ZWKOTPCHSA-N 377.827 5.083 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3/Cc4ccc(C)cc4C3=O)c2)cc1 730948141 AEUIEJVHUBROBT-MOSHPQCFSA-N 383.447 5.078 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)CSc1ccc2ccccc2c1 735338777 XGKUGHCRPJXCKJ-UHFFFAOYSA-N 397.883 5.231 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 739155787 VRQLMUDAMGOPQQ-VGOFRKELSA-N 390.527 5.215 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)OCC3(C(F)(F)F)CC3)cc2)cc1 739338187 VVLBATNKNNFADO-UHFFFAOYSA-N 375.346 5.044 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2oc(CC(C)C)nc2C#N)cc1 741460585 RXUWTOPQRCPJHU-UHFFFAOYSA-N 388.471 5.256 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)s1 741909318 JBHUMKLENQKKQK-UHFFFAOYSA-N 386.398 5.519 30 20 GKED COc1ccc(CN[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)cc1C#N 742369126 MQLLACDQPONQSN-JOCHJYFZSA-N 397.305 5.753 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc1 745398771 KRJBNIVEYMSGTJ-UHFFFAOYSA-N 393.874 5.183 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1OCCCC#N 745989945 HLFXSCMZEGNIDQ-WMZJFQQLSA-N 398.462 5.336 30 20 GKED Cc1cccc(-c2nn(CN(C)C[C@H](C)C#N)c(=S)n2[C@H]2CCCC[C@@H]2C)c1 746707149 XWKDXLLSGPSYTB-HBFSDRIKSA-N 397.592 5.190 30 20 GKED COc1cc(/C=C2\CCc3cc(SC)ccc3C2=O)ccc1OC(F)F 748146180 FBXRMMAIGMHRJZ-NTEUORMPSA-N 376.424 5.231 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(OC3CCC3)c(F)c2)cc1Cl 748605467 GLUQBORJXKEHLE-UHFFFAOYSA-N 375.856 5.091 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3c[nH]c4cc(F)ccc34)cs2)cc1 749454081 VRHAFCJSLNGSQU-UITAMQMPSA-N 378.428 5.335 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC2CC(c3ccc(Cl)cc3)C2)ccc1OC 753566527 QWRWGFNNBJFRFF-UUKMXZOPSA-N 384.907 5.065 30 20 GKED Cc1nnc(SCc2cc(Cl)ccc2OCC#N)n1[C@@H]1CCC[C@H](C)C1 758168625 JMVRAJAJCLJUSL-SUMWQHHRSA-N 390.940 5.186 30 20 GKED CCOC(=O)/C=C\c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 759317762 ZXFJFKAIZKCRRT-SSZFMOIBSA-N 396.446 5.054 30 20 GKED Cc1cn(-c2ccccc2)nc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 769861566 DQCNWKUYZJUMRN-HSZRJFAPSA-N 392.462 5.089 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(SC(F)F)cc2)c1 772983524 JIQTTXLAJOOYBC-PBHICJAKSA-N 376.472 5.533 30 20 GKED C[C@H]1CSc2ccc(Br)cc2[C@H]1NCc1cc(C#N)ccc1F 775413134 WZPRIXMDOIXGPP-VOJFVSQTSA-N 391.309 5.033 30 20 GKED C[C@H](NCc1ccc(Sc2ccc(F)cc2)cc1)c1ccc(OCC#N)cc1 776172032 RIJSAFLQXKTSFI-KRWDZBQOSA-N 392.499 5.730 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2 776907673 JFWATZGMQJIQGZ-UHFFFAOYSA-N 395.528 5.036 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C(=C/c1ccc(F)cc1)c1cccs1 780156069 CQVIYEGKSVCNJP-COYFKBPASA-N 392.455 5.357 30 20 GKED CCC1(C=NNc2ccc(Br)cc2C(F)(F)F)CCOCC1 781121767 GNFSOQPJDGAVLM-UHFFFAOYSA-N 379.220 5.072 30 20 GKED C=C[C@@](C)(CCOC)COC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 784635528 SSTQJNIZCGDCBG-KRWDZBQOSA-N 387.423 5.009 30 20 GKED CC1(C)[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C[C@@H]1c1ccccc1 786961116 SFBYOSCFSSRYLL-FYYLOGMGSA-N 387.527 5.264 30 20 GKED Cc1ccsc1C(Cc1ccccc1)=NNc1nnc(-c2ccccn2)s1 788024317 NPYDDCWIANEYIM-UHFFFAOYSA-N 391.525 5.029 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(O)ccc2C(F)(F)F)cc1 793043607 NEYLTZKRKWSKMX-IBGZPJMESA-N 396.368 5.319 30 20 GKED C=C(Cl)CNC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 796562334 KLRHNWQNNQHXFW-UHFFFAOYSA-N 389.735 5.263 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)n2)cc1 796890248 SYJRGAHGMZGDFB-MTFMMBMASA-N 389.524 5.465 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 806207268 MNXJERMBWGHZLI-JTSKRJEESA-N 398.466 5.361 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCCc1ccccc1Cl 810521800 RSQLSROPSGZDSD-QGZVFWFLSA-N 378.859 5.044 30 20 GKED N#Cc1ccc(CN2CCCCC[C@@H]2C[C@@H](O)c2ccco2)c(C(F)(F)F)c1 811467160 GWMHNISNIROSIV-IEBWSBKVSA-N 392.421 5.038 30 20 GKED N#CCCC[C@H](NC(=S)Nc1ccc(Cl)cc1Cl)c1ccccc1 814209995 JFIRPXCABBOPKD-INIZCTEOSA-N 378.328 5.715 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(F)c3ccccc23)ccc1OC 815592461 JDBLQGBDDSZYQV-SJLPKXTDSA-N 392.474 5.519 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 820125292 HAUNUPPJBLKJMH-SOUVJXGZSA-N 397.371 5.687 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C[C@@H](C)C1(F)F 860424544 IUGAWWFYEYELAP-QINHECLXSA-N 383.442 5.097 30 20 GKED Oc1nc2ccccc2cc1/C=N/C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914702727 KGCUDVAEADFBKW-VVPZDVFUSA-N 390.327 5.269 30 20 GKED CC(C)(C)SCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 915102836 IOERBMLNNBDPGI-GFCCVEGCSA-N 399.368 5.825 30 20 GKED COCCN(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353216 LYIQBVHACIYNKQ-XMMPIXPASA-N 399.494 5.023 30 20 GKED COc1cccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915353890 ZBVWBGRWHMSGEV-HSZRJFAPSA-N 385.467 5.015 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c2c1 916093750 XVRSOFJPDUQKEH-LLVKDONJSA-N 380.469 5.060 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(F)cc2F)ccc1OCc1ccccc1 916127757 XKSBJXZWUVEMCR-YRNVUSSQSA-N 380.390 5.449 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc(Cl)s3)n2)cc1 916974605 NRVHVJLNJNAYDV-PMGBHYCQSA-N 384.913 5.723 30 20 GKED Cc1cc(Cl)ccc1S(=O)(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 917738289 ZXYQJFKLXOZYAZ-FQEVSTJZSA-N 396.899 5.105 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3csc4ccccc34)n2)cc1 920143438 ZSRGSVNMJAAGHM-GOSISDBHSA-N 399.500 5.315 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3cccc(F)c3)n2)cc1 921132358 PYUHSOKOJDJCDS-KXBFYZLASA-N 378.472 5.313 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)cc1 921280370 GJASDCMKCVDGQH-SFHVURJKSA-N 398.359 5.752 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)N1CC[C@]2(C1)CC(F)(F)C2(F)F 930340910 CNFTYSYXACSZBU-CQSZACIVSA-N 398.322 5.080 30 20 GKED N#CCCc1ccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1 932583501 KGFVFDSPNVETBS-GOSISDBHSA-N 376.485 5.121 30 20 GKED C=C(C)C[C@H](NCc1c(Cl)cccc1Oc1c(C)ccc(C)c1C)C(=O)O 1776137503 DOLVZBJLTRZOHB-IBGZPJMESA-N 387.907 5.567 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(OCCC(=O)O)cc2)cc1 1776788965 GUKIJJDSYFRUBZ-UHFFFAOYSA-N 385.504 5.501 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCC(C)(C)c1ccc(OC)cc1 60577048 VAYILBIAOHAIKE-UHFFFAOYSA-N 392.952 5.086 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@@H](C)c3ccc(OCC#N)cc3)c2)cc1 105487545 QBIOBMTVIJOSRY-IBGZPJMESA-N 399.494 5.001 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 112239574 JPPJOZOUVWFNBY-CSKARUKUSA-N 375.453 5.076 30 20 GKED N#CCCCOc1cccc(CNc2ccc(-c3cn4c(n3)CCCC4)cc2)c1 122101725 VVHSTJWNBLUBHT-UHFFFAOYSA-N 386.499 5.181 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(F)(F)F)cc1 171742446 RNJOWTOAJJUNMD-ZDUSSCGKSA-N 393.434 5.279 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 171839619 LFHXIDFALQSPKY-LKUPVBHCSA-N 395.528 5.123 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1c1c(C)n[nH]c1C 191434745 KCSCHGPKTYEQHE-OAQYLSRUSA-N 394.563 6.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 191516632 WJOUUYWBSNBEDX-GCJKJVERSA-N 378.516 5.532 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccn(-c2ccc(F)cc2F)n1 192200083 MYDKVHSEUCYFKI-AWEZNQCLSA-N 384.455 5.157 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc(Cl)s3)n2)cc1 193666858 XCCVCZLMKNCGGC-ZKKXHLJNSA-N 395.896 5.286 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2sccc2C)cs1 255514122 BIBPPRXMIDDTTI-TWGQIWQCSA-N 382.510 5.402 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2)cc1)C(=O)N(CCC#N)c1ccccc1 302807067 BBEFUGAXVZUJLC-LJQANCHMSA-N 385.467 5.226 30 20 GKED CCN(C(=O)CCOc1ccccc1-c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 302935852 IADZRRDCHMPTKT-FQEVSTJZSA-N 398.506 5.604 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1ccccc1F 303191993 ZKURLGWUEHHCPY-OAHLLOKOSA-N 396.487 5.486 30 20 GKED CC(C)(C)c1nc2ccc(N=C(O)N3CCCC4(CCOCC4)C3)cc2s1 330168747 BBMOGVRIJPSLQP-UHFFFAOYSA-N 387.549 5.032 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)CCCC3(C#N)CCOCC3)s2)cc1 410380988 VQONEFBPIRPLKM-LJQANCHMSA-N 397.588 5.520 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(CCC#N)Cc1ccco1 426086024 SBHSVWLKVDEARL-UHFFFAOYSA-N 393.874 5.856 30 20 GKED C[C@H](NC(=O)NC[C@H]1CCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 430897204 KHNLKOFLVCWQFX-RDJZCZTQSA-N 383.442 5.021 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccccc2)Cc2ccccc2F)c1 431031721 CCOOPPCTISOAJQ-UHFFFAOYSA-N 390.483 5.284 30 20 GKED Cc1cncc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 432008715 WSCWSJPHHSZPAQ-OAQYLSRUSA-N 389.886 5.270 30 20 GKED COc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C(F)(F)F)c1 432642709 FZMLXTCPIWXJGW-KRWDZBQOSA-N 391.393 5.271 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(C(C)C)n(-c3ccccc3)n2)n1 435805826 CQVSTSSVVGHADL-MRXNPFEDSA-N 378.501 5.066 30 20 GKED C[C@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccc(C#N)cc1 438371492 MILUGFRVIUIIRP-SFHVURJKSA-N 385.467 5.158 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccc(C#N)cc1 438633257 MYHDGFPZABQRGC-CQSZACIVSA-N 392.846 5.282 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)c1ccc(C#N)cc1 439599867 YKNJMVMNIBOYAN-AWEZNQCLSA-N 383.373 5.937 30 20 GKED CCc1c(C)sc(NC(=O)[C@H](C)c2ccc(Br)s2)c1C#N 443910344 UIJXUBGJPMQERC-MRVPVSSYSA-N 383.336 5.057 30 20 GKED N#CCSCc1nc(C2(c3cccc(C(F)(F)F)c3)CCCCC2)no1 445524979 RHRQRFMICJOLGK-UHFFFAOYSA-N 381.423 5.095 30 20 GKED C[C@@H]1CCN(C(=O)c2c(F)cc(C#N)cc2F)c2cc(Cl)ccc2S1 446014497 YVFGCMWHPSRMME-SNVBAGLBSA-N 378.831 5.021 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCCCC[C@H]2c2ccncc2)cc1C#N 455801278 SMSOXBSOHSUWFM-FQEVSTJZSA-N 392.503 5.280 30 20 GKED CC(C)CCc1noc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)n1 463232228 ZPFDFFYRGMECAU-UHFFFAOYSA-N 380.423 5.073 30 20 GKED C[C@H](C(=O)Nc1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 463461290 MRNBCYLPQKKESJ-JTQLQIEISA-N 397.194 5.082 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 463962878 GNZVOQKMEPTLEZ-UHFFFAOYSA-N 383.238 5.341 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)[C@@H]2C)cc1 470629550 VMASNTBQJSAJNX-KBXCAEBGSA-N 388.389 5.072 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccccc1)c1cc(C(F)(F)F)ccc1F 471216443 PUVDKWGDRNTPML-CQSZACIVSA-N 379.275 5.268 30 20 GKED C=C[C@@](C)(CCOC)C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 473577166 SMXIHUPCRGSECI-XOBRGWDASA-N 392.952 5.178 30 20 GKED N#CCCn1cc(CN[C@@H]2CC[C@H](c3ccc(F)cc3)C2)c(-c2ccccc2)n1 475346133 MRAASTARRCKUBK-NZQKXSOJSA-N 388.490 5.029 30 20 GKED N#Cc1ccc(C[S@](=O)Cc2ccc(Oc3ccccc3F)c(F)c2)cc1 476894680 XGSXOMFCBWLYCI-MHZLTWQESA-N 383.419 5.078 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(Br)c(Cl)c1 477465669 JHNKIKMGFVCUEN-UHFFFAOYSA-N 393.668 5.014 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(C)(c2nc3ccccc3s2)CC1 478099158 XQGAMFYLRUYKLK-UHFFFAOYSA-N 390.512 5.062 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@H]1CCCc2cccnc21 480819637 RWZOXJRCGYIBAC-FQEVSTJZSA-N 392.503 5.062 30 20 GKED N#CCCC[C@H](NC(=O)COc1ccc(Cl)c2ccccc12)c1ccccc1 487619632 SFELTXLVKHSFFO-NRFANRHFSA-N 392.886 5.423 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@H](C)c3ccccc3[N+](=O)[O-])o2)cc1 489777210 MFMGTVDAGVRCSP-CYBMUJFWSA-N 383.429 5.063 30 20 GKED CCCCCN(CCO)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 490625276 WXBUYVZNWQNCDN-HXUWFJFHSA-N 399.922 5.012 30 20 GKED CCN(C(=O)c1cccc(CC#N)c1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496496763 PRSVOKMOOHXOQX-VWLOTQADSA-N 397.522 5.523 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 499327943 LQPIOJAWFJSTPX-UHFFFAOYSA-N 381.526 5.355 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c(C)s1 499849948 RZKKKLPAWXCGLU-HNNXBMFYSA-N 395.311 5.016 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3Cl)CC2)cc1 503897025 GHVZBAPNZPJHSB-WOJBJXKFSA-N 397.305 5.284 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCc1ccccc1F 510501133 IASHKHLSJJRFTA-UHFFFAOYSA-N 389.430 5.162 30 20 GKED CN(C(=O)NCC(C)(C)CCC#N)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 513113847 STKZDMRYKDALNR-QZTJIDSGSA-N 395.469 5.313 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Cc1coc2ccc3ccccc3c12 514495328 DOTOGUAGEQRFPL-UHFFFAOYSA-N 382.463 5.437 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Oc1ccccc1 521734568 QVRIHZMKVUAIPE-QGZVFWFLSA-N 388.492 5.983 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cnc2ccsc2c1 525643201 KIRRRUFRGPWLDH-UHFFFAOYSA-N 399.475 5.308 30 20 GKED C[C@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1cccc(Cl)c1 525648879 ASXDBQRKBRVPMJ-ZDUSSCGKSA-N 381.888 5.001 30 20 GKED Cc1sc(NC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)c(C)c1C 525700670 LNMMQOXJXMRFBV-UHFFFAOYSA-N 376.481 5.230 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1Cl 543653017 QRGFTZIZAIYSKQ-RDJZCZTQSA-N 389.833 5.581 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4cnc5ccccc5c4)no3)cc2)nc1 545703712 SNPZXYFQUMDPAF-UHFFFAOYSA-N 391.390 5.011 30 20 GKED N#Cc1ccc(C(=O)N2c3ccc(Br)cc3[C@@H]3CCCC[C@@H]32)s1 552763308 AFQXLMDMPCULPZ-ZFWWWQNUSA-N 387.302 5.069 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(Cl)c(F)cc1Cl 556432978 DVSCBTZDIJJUAP-KBXCAEBGSA-N 377.246 5.044 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)c2csc(-c3ccccc3C)n2)cc1 562322695 FNIFSSCSYDUTTP-FQEVSTJZSA-N 375.497 5.018 30 20 GKED CC(C)(C(=O)Nc1cccc(Br)c1Cl)c1cc(F)cc(C#N)c1 568895505 ZWCASKCPVGSATA-UHFFFAOYSA-N 395.659 5.030 30 20 GKED CCSc1cccc(F)c1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 571487258 WIXDLFRTRMYXQE-UHFFFAOYSA-N 385.508 5.499 30 20 GKED CC(C)(CCC#N)CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2 571563751 MGEZYOSHIBZVEP-ICFOKQHNSA-N 399.494 5.374 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC=C(c3ccco3)C2)cc1 583771023 HHFQSNMTIVVOHL-UHFFFAOYSA-N 385.423 5.265 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F 588245350 RLUUCXTYIZHLHZ-RRFJBIMHSA-N 399.482 5.571 30 20 GKED CC(C)(CCC#N)CNC(=O)C1(c2ccc(Br)cc2)CCCCC1 589080241 HEIFCZQWHMYGCZ-UHFFFAOYSA-N 391.353 5.097 30 20 GKED CCCOc1ccc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)cc1OC 589504913 ZYQYGOYPDOZNLZ-AWEZNQCLSA-N 392.421 5.225 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)C1 596650532 KVQQXWJVTCZTLS-QGZVFWFLSA-N 390.512 5.045 30 20 GKED CCc1c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cnn1C(C)(C)C 603996681 OXAKJYYOBPPPAJ-UHFFFAOYSA-N 384.549 5.045 30 20 GKED Fc1ccc2ccc(=NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)[nH]c2c1 608079037 AXXPRHMKEDYFQD-QWRGUYRKSA-N 380.307 5.117 30 20 GKED C[C@H](Nc1ncc(C#N)cc1Cl)c1ccc(NC(=O)c2ccc(F)cc2)cc1 608886034 MRVHNKFOCAKLEZ-ZDUSSCGKSA-N 394.837 5.171 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 609377184 QKWMTMAWDUNZDA-UZLBHIALSA-N 384.570 5.694 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)n1CC(F)(F)F 609382734 RGGHCQCHPJCXRI-GFCCVEGCSA-N 395.450 5.171 30 20 GKED Cc1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c(O)c1 609742549 AZRNFJTZZABBCI-UHFFFAOYSA-N 378.815 5.270 30 20 GKED CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610015348 FZEJMIBZFRKAOE-OXJNMPFZSA-N 378.476 5.178 30 20 GKED Cc1cc(C)c(NC(=O)CCCN2CCC[C@@H]2[C@H](C#N)c2ccccc2)c(C)c1 610844137 BTEBTLSIAUYOKH-DHIUTWEWSA-N 389.543 5.102 30 20 GKED C[C@@H](c1ccc(F)c(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618447757 BEOBIYLNSMYXGM-INTQDDNPSA-N 377.731 5.603 30 20 GKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(OC(F)F)cc1OC(F)F 618803762 IPKYIMYKFOHXMC-GTNSWQLSSA-N 394.368 5.099 30 20 GKED C=C(C)COc1cc(CN[C@H](CC(F)(F)F)c2ccccc2)ccc1OC 622266637 WIMGKLFQXHZADO-GOSISDBHSA-N 379.422 5.433 30 20 GKED Cc1nc(C(C)C)oc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 644786609 BNYCWJLOXGNKFO-LLVKDONJSA-N 393.390 5.225 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)[C@@H]1CCC(F)(F)C1 648494587 ZPFARNOOFNIAEC-MRVPVSSYSA-N 393.249 5.350 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C)nn2)cc1 684230978 OIDWEJAGPLFNIK-UHFFFAOYSA-N 388.471 5.188 30 20 GKED C=CCOc1ccc(/C=C2\SC(=S)N([C@H](C)c3cccs3)C2=O)cc1 726629165 JGZCAAYEILYMEG-KAECEXQPSA-N 387.551 5.275 30 20 GKED C#CCCOc1ccc(/C=C2\SC(=S)N([C@@H](C)c3cccs3)C2=O)cc1 726629744 QKRARIDDGRSAIK-RVAQLADHSA-N 399.562 5.113 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1 727594358 DQYDPRUVEBSGAM-UHFFFAOYSA-N 393.531 5.296 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C/c1ccccc1F 730996693 YPIRHMKIACMEGV-RMKNXTFCSA-N 394.393 5.502 30 20 GKED CC(=NNc1nccnc1Cl)c1c(F)cccc1O[C@H](C)c1ccccc1 733079589 OBZXXAKUTXJJDT-CQSZACIVSA-N 384.842 5.245 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccc(-c3ccccc3Cl)o2)c1 733771598 XSKAQVZGQZBUIC-INIZCTEOSA-N 394.858 5.211 30 20 GKED C=CC[C@H](NC(=O)N(C)Cc1c(CCCC)oc2ccccc12)c1ccncc1 734682779 GAEPNYLORHNXGV-NRFANRHFSA-N 391.515 5.629 30 20 GKED CCn1c2ccccc2c2cc(N[C@H](C(=O)OC)c3ccc(C#N)cc3)ccc21 739991988 VCDNYWPGRAYPBX-QHCPKHFHSA-N 383.451 5.012 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740063586 BQIXCWGQMGHNNS-HNNXBMFYSA-N 393.487 5.328 30 20 GKED COc1cc(C=NNc2ccnc3cc(Cl)ccc23)c(SC)cc1OC 741160631 WJTNZNUFWAASRW-UHFFFAOYSA-N 387.892 5.073 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](c3ccccc3)C(C)C)n2)cc1 744061755 OBIHTRADLNRXOU-FPOVZHCZSA-N 390.508 5.435 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)c1 745820139 HTSXKRCBHHHWDH-JTHBVZDNSA-N 391.515 5.113 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1cc(Cl)ccc1OC(F)F 748440649 DZLAUIHUDGSVPW-AATRIKPKSA-N 392.814 5.356 30 20 GKED Fc1cccc(-c2ccc(C=Nn3c(S)nnc3-c3ccccc3F)s2)c1 750923779 VSGQCPUKGJOHHX-UHFFFAOYSA-N 398.463 5.123 30 20 GKED CCN(CC)[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 755610402 NJOZSAUIGMMJLA-VQIMIIECSA-N 397.931 5.209 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c(C)noc1C 757781646 RGKNCNJUEMDMPS-RTWAWAEBSA-N 388.471 5.220 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)[C@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 763939618 BIRYYOVQPBAFBI-ICSRJNTNSA-N 388.492 5.033 30 20 GKED CCN(c1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1)C(C)C 770480936 SWQGPUGQMKSKBY-UHFFFAOYSA-N 387.531 5.311 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Sc3ccncc3)cc2)cc1Cl 771839880 WGZCDMRGBNNCOP-UHFFFAOYSA-N 396.928 5.567 30 20 GKED CC1(OCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCC1 772972640 UXUGLZHHHXNUGV-ZDUSSCGKSA-N 395.311 5.252 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1 774163386 LTMSGJXMHWHYSZ-UHFFFAOYSA-N 399.516 5.517 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1O[C@@H](C)C#N 780170416 UJLKJGOAEFUIFC-AWEZNQCLSA-N 399.472 5.030 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(COc2ccccc2)c1 780513167 CCNPFIFPUYAFLS-QGZVFWFLSA-N 387.439 5.200 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc3cc[nH]c23)cc1 786079998 ZNUFRXBGBJAXAT-QFIPXVFZSA-N 380.451 5.145 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1[N+](=O)[O-] 796756347 LCFZCTFLFHXNGP-LBPRGKRZSA-N 399.859 5.012 30 20 GKED COc1ccc([C@H](C)NCc2ccc(C#N)c(Cl)c2)cc1CN1CCCCC1 800990463 PKPMCDNHDLIDQL-KRWDZBQOSA-N 397.950 5.057 30 20 GKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1cc(Cl)cc(Cl)c1O 806147608 YYTYCQINCARGMJ-BEFAXECRSA-N 393.314 5.621 30 20 GKED CCN(c1ccc(NC(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc1)C(C)C 809278190 NTDNPOVXOGVZDC-GOSISDBHSA-N 378.520 5.408 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813214475 YAVVWIZPIFPOBL-SZNGSJQDSA-N 399.199 5.687 30 20 GKED FC(F)(F)c1cc(NN=C2CCCC23CCCC3)nc(-c2cccnc2)n1 814850654 XOSZLSWKUKKEBE-UHFFFAOYSA-N 375.398 5.070 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2C[C@@H]3[C@@H](C2)C3(F)F)c1 844519633 HGFIUJPMEABDOZ-RTBURBONSA-N 380.479 5.293 30 20 GKED C[C@@H](NC1(c2ccccc2Br)CCC1)c1ccc(OCC#N)cc1 846175364 USVXVFKQHTZIRN-OAHLLOKOSA-N 385.305 5.081 30 20 GKED N#Cc1c(NC(=O)CCSc2cccc(C(F)(F)F)c2)sc2c1CCC2 912697384 UJSYZFNBWFXLRJ-UHFFFAOYSA-N 396.459 5.248 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2c1 916156119 GZZJCVOWERORKT-JOCHJYFZSA-N 396.446 5.658 30 20 GKED N#C[C@@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1nc2ccccc2o1 917509805 AEJIANBCPQLXKN-WBILKINKSA-N 388.423 5.445 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccc(F)cc2)cc1 918486692 KSGFCTJZPDSZDS-GCKMJXCFSA-N 380.463 5.180 30 20 GKED CC(C)CC(Cc1cccc(Cl)c1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033549 YAXPCMJWRUPHMQ-UHFFFAOYSA-N 379.287 5.748 30 20 GKED C=CCOc1ccc(/C=C(\CC(=O)O)c2nc3ccccc3s2)cc1Cl 1776118587 ZBVWAXRUVRCVKK-GXDHUFHOSA-N 385.872 5.530 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)o2)cc1 1776125569 LYHDQBAZJSWFFJ-MEADNVIHSA-N 396.483 5.869 30 20 GKED CCCCCCCOc1cccc(CNCCCC[C@H](CCC)C(=O)O)c1 1776788724 TXPPMMZMOAPPRF-NRFANRHFSA-N 377.569 5.797 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(/C=C/C(=O)O)o3)s2)cc1 1777430561 CKAPEPRCDINBKC-WGDLNXRISA-N 379.437 5.014 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cnc(-c3cccs3)s1)C2=O 1777682925 GNWPVHYLPARYMA-RAXLEYEMSA-N 381.478 5.172 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)[C@@H](C)Oc3ccc(C#N)cc3)n2)c(C)c1 15323220 UDDWYZDOSCREOO-MRXNPFEDSA-N 391.496 5.013 30 20 GKED CCCN/C(S)=C(/C(=O)c1ccc(CC)cc1)[n+]1ccc(C(CC)CC)cc1 22805980 VDMMRNYYWPRMAD-UHFFFAOYSA-O 397.608 5.379 30 20 GKED Cc1cc(OCCCC(=O)Nc2cccc(OCCCC#N)c2)ccc1Cl 59771081 PENOBACYDUUKPV-UHFFFAOYSA-N 386.879 5.129 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1cccc(OCC)c1 63404835 RABYFWMVRKPCRE-CQSZACIVSA-N 378.925 5.259 30 20 GKED CCOc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1OC 65680205 LGCOIVXYDGLUPX-UHFFFAOYSA-N 388.423 5.010 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCOc1ccc(F)cc1Cl 66802247 KSNNOBTVMDHPHN-CYBMUJFWSA-N 392.883 5.281 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 66955896 KONCEHJOXUBEIO-HNAYVOBHSA-N 399.947 6.103 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C)c1nnc(-c2ccccc2)o1 67989135 WXGTTWMOHQANGQ-QGZVFWFLSA-N 396.450 5.882 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 72041246 QXVWNTKOGARFFQ-UHFFFAOYSA-N 387.439 5.023 30 20 GKED C=C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 136643776 UVQATGBOKNDYKC-BBRMVZONSA-N 387.266 5.001 30 20 GKED CCN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@H](C)c1cc2ccccc2o1 151314851 YSZFXAJHNMBKAC-XLIONFOSSA-N 375.472 5.570 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(C(F)(F)F)CC1 173476661 LSHQGZMWDOLWFF-UHFFFAOYSA-N 393.249 5.139 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C(C)=C/c3ccc(F)cc3)n2)cc1 175132731 ZSXJUONKUNTNNZ-FIIODCPWSA-N 392.455 5.238 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3cccc(-c4cccnc4)c3)C3CC3)cc2)CC1 182105400 AVHNGSSSHOOKOQ-UHFFFAOYSA-N 393.490 5.109 30 20 GKED CC[C@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 193334960 VTBQRCMACYSLRA-QHCPKHFHSA-N 384.479 5.464 30 20 GKED N#CCCCCSc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1 195539732 SBJYKRMUYSRSKR-UHFFFAOYSA-N 382.920 5.297 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(N(C)CCC#N)cc1 237608366 OBVQVJBYBVLZDJ-KRWDZBQOSA-N 390.556 5.319 30 20 GKED Cn1cc(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c(C2CCCCC2)n1 329348548 SFZNDUYMXSIXOR-FQEVSTJZSA-N 395.551 5.162 30 20 GKED CCCCCCCCCC(=O)N1CCCC[C@@H]1c1nnc(C2CCOCC2)o1 372827051 XJMRWTVZFHSWQJ-LJQANCHMSA-N 391.556 5.158 30 20 GKED Cc1nc(COc2ccc(CN[C@@H]3CCCc4cc(C#N)ccc43)cc2)cs1 418153964 ZFXOJFMVLWCONN-HSZRJFAPSA-N 389.524 5.069 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 425664499 RZJJWXRHPPZFJK-CYBMUJFWSA-N 387.430 5.239 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Oc3ccccc3)nc2)s1 430630876 ZHPWULIUGGTVGR-MRXNPFEDSA-N 377.469 5.118 30 20 GKED N#CCCC[C@@H](NC(=O)NCCSc1ccc(Cl)cc1)c1ccccc1 431766538 QLYKLMYIGJSQPQ-LJQANCHMSA-N 387.936 5.166 30 20 GKED C[C@H](C#N)N(C)C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 436724029 MUXRBQKFSMIKME-CYBMUJFWSA-N 384.888 5.363 30 20 GKED CCCCOc1ccc(-c2nnc(COc3ccc(C#N)c(Cl)c3)o2)cc1 438886126 LUKDBJVYFXRPJL-UHFFFAOYSA-N 383.835 5.020 30 20 GKED C[C@@H](CC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 439669743 DOFZIEQCWUEWGS-HNAYVOBHSA-N 385.305 5.104 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](CC)c1nccs1)c1ccc(C(F)(F)F)cc1 441522868 SABGMSXZRJFVJL-CVEARBPZSA-N 397.466 5.620 30 20 GKED C[C@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)c1cccc(C#N)c1 442915678 RFBKFBUGJSUBFO-INIZCTEOSA-N 386.480 5.311 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)s2)o1 443892127 QJXRONOMKPFGLH-UHFFFAOYSA-N 391.374 5.163 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444017461 FBRPRFAMCGWARD-AWEZNQCLSA-N 382.348 5.307 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)[C@@]1(C#N)C[C@@H]1C 449978906 BOWAWCOZYNBCNH-NPMXOYFQSA-N 390.462 5.220 30 20 GKED C=CCn1c(SCc2ccc(C(F)F)cc2)nnc1-c1cccc(OC)c1 460672793 FIBOOKPQPGBGQL-UHFFFAOYSA-N 387.455 5.370 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 463776305 PNXXDQLBTLXSQB-SJCJKPOMSA-N 379.262 5.082 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 466324209 GWMYUNKCPBDRST-KRWDZBQOSA-N 385.895 5.093 30 20 GKED N#Cc1cc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)ccc1F 467768339 VKPWIBGJBUXQOK-DEOSSOPVSA-N 399.469 5.287 30 20 GKED Cc1ccc([C@H](NCC#Cc2ccc(C(F)(F)F)cc2)c2ccccn2)cc1 471070010 FVXOQTSBHZDCNW-QFIPXVFZSA-N 380.413 5.140 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 475184490 RREPTXCKEGVPNR-OAHLLOKOSA-N 376.378 5.130 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCN(Cc2ccccc2)CC1 476084444 HJPBYEJFOSJRQG-UHFFFAOYSA-N 376.544 5.389 30 20 GKED CO[C@H](C)c1nc(CN(Cc2cccc(C#N)c2)c2ccc(F)cc2C)cs1 476829037 MBWOMVQEVNLICE-MRXNPFEDSA-N 395.503 5.377 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)C[C@@H](CC#N)c1ccccc1 476909916 CVQQCPYDHYNNFU-GOSISDBHSA-N 388.433 5.230 30 20 GKED COc1ccc(CN[C@H]2CCCC[C@@H]2Cc2ccccc2)cc1OCCCC#N 477336001 FDXKBQMVCMTOBL-PKTZIBPZSA-N 392.543 5.269 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1ccc(F)c(F)c1 477740731 CNTMYFUYKBCJLI-BWAGFHJFSA-N 395.453 5.063 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccccc3F)cc2F)c1 477821630 IQFFLOFPFSOHAD-UHFFFAOYSA-N 379.366 5.059 30 20 GKED Cc1c(C(=O)NCc2csc(-c3ccccc3)n2)sc2ccc(C#N)cc12 478958623 JYHZUEZMURAHEP-UHFFFAOYSA-N 389.505 5.135 30 20 GKED Cc1ccccc1-n1ncc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1C(C)C 483191310 DVIQUBRYOLFEIF-FQEVSTJZSA-N 394.478 5.342 30 20 GKED N#C[C@@H](C(=O)c1ccccc1COc1ccccc1)c1nccc2ccccc12 483234688 MKLKJNGBAZOHSQ-HSZRJFAPSA-N 378.431 5.304 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccco1)c1ccc(F)cc1F)c1ccccc1 483354230 GMGSKUSXXFJOPV-QGZVFWFLSA-N 380.394 5.179 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N(CCC)CCC)cc1 485756265 KFWUUJKINOMLTR-UHFFFAOYSA-N 396.556 5.479 30 20 GKED C=CCn1cccc1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 488897980 CWSGEOAELAOMJV-UHFFFAOYSA-N 393.874 5.141 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(-c2nc(CC)no2)ccc1C)c1ccccc1 489690198 KYOAJQCOFVFMIF-IBGZPJMESA-N 375.472 5.296 30 20 GKED CN(CC(C)(C)C#N)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 497375828 CYNKVMSWNFSWBN-UHFFFAOYSA-N 395.553 5.089 30 20 GKED C[C@H]1CCC[C@@H](OCCCCCC(=O)N(Cc2ccc(C#N)cc2)C2CC2)C1 499268730 BCTIZHVVLZITSL-WMZHIEFXSA-N 382.548 5.205 30 20 GKED C=CCN(C(=O)c1ccc(N(CC)C(C)C)cc1)c1nc2c(s1)CCCC2 499316816 PPIVQTAVLDIXKP-UHFFFAOYSA-N 383.561 5.089 30 20 GKED CSc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1F 500449735 HLXCIPJSUGRFFR-HNNXBMFYSA-N 382.485 5.470 30 20 GKED CCCN(C(=O)c1ccc(C#N)c(C)n1)[C@@H](C)c1ccc(Cl)c(Cl)c1 502788641 IAQHVUKOKJHREA-ZDUSSCGKSA-N 376.287 5.182 30 20 GKED CC(C)n1ncc2cc(CNc3cccc(OCc4cccc(C#N)c4)c3)cnc21 504210477 KOORRHNXEUYHGH-UHFFFAOYSA-N 397.482 5.075 30 20 GKED Cc1ccc(NC(=O)N(C)Cc2ccc(C#N)cc2)c(OCc2ccccc2)c1 511457260 MYAZTVKYZBAEDW-UHFFFAOYSA-N 385.467 5.110 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@@H]2CCC[C@H](C(F)(F)F)C2)n1 512034108 ZLTKHXLHVKNQEO-KGYLQXTDSA-N 396.306 5.983 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCCC[C@@H]2C)cc1 512567212 YAMVVDSPNCJZLH-INIZCTEOSA-N 379.460 5.156 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)ccc1OC1CCCC1 512662176 VYZYRKWIPINQFY-JKSUJKDBSA-N 382.479 5.439 30 20 GKED CC(C)c1ccc(CN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 517528121 QDIKFBILJWLTBO-QGZVFWFLSA-N 381.545 5.868 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3c[nH]c4cc(F)ccc34)c2)cc1 519122611 OWKVRZAUWWQIQU-UHFFFAOYSA-N 385.398 5.152 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 520601237 JTUIRRWGRCISDH-XMMPIXPASA-N 397.478 6.028 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1OC 520923164 BQCAADBGOFBDFM-MRXNPFEDSA-N 398.528 5.521 30 20 GKED N#Cc1cc(NC(=O)N2CCCC3(CCCCC3)C2)ccc1OCC(F)(F)F 522086135 OTYFTFRIRMWJCN-UHFFFAOYSA-N 395.425 5.078 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)c2ccc(C#N)cn2)c2cccs2)cc1 522677810 WUXMAJJALPUIQG-VFNWGFHPSA-N 375.497 5.048 30 20 GKED N#CCCCCNC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 543483451 PVCXSCLWTHWVJB-UHFFFAOYSA-N 396.409 5.419 30 20 GKED Cc1c(C(=O)Nc2cnn(CC(C)C)c2C2CC2)sc2ccc(C#N)cc12 552483196 WRKFDRVAOCXMJW-UHFFFAOYSA-N 378.501 5.064 30 20 GKED C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc(NC(=O)c2ccccc2)c1 564432502 SRZXPQWYWFIAEQ-OSPHWJPCSA-N 381.479 5.149 30 20 GKED CN(C(=O)CCCCCC#N)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 588957883 CIWBQTLGZJQXJK-HNNXBMFYSA-N 380.332 5.241 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCc4ccc(F)c(Cl)c43)ccc21 593626026 TVURYAJFBAKZJN-SFHVURJKSA-N 397.881 5.161 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(C#N)cc2)CCC1 594070597 KPSVANBNKXVWNQ-INIZCTEOSA-N 390.512 5.011 30 20 GKED N#CCc1ccc(NC(=O)NC[C@@H]2CC3c4ccccc4C2c2ccccc23)cc1 603650875 JSUCNMVXHPLEKK-UTTDKNERSA-N 393.490 5.171 30 20 GKED COc1cc(CNc2ccccc2SC[C@H](C)C#N)ccc1OC(F)F 609384667 FXJNSCUJEJPXOB-CYBMUJFWSA-N 378.444 5.160 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(Br)ccc1F 609431106 ROFVLLUGRALQCJ-GFCCVEGCSA-N 379.298 5.595 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CCCC3)cc1Oc1ccncc1 609640576 GCRLKCACAIZPAC-UHFFFAOYSA-N 389.480 5.247 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)NCCCCC#N)cc2)c1 610019422 AYOAUCGYGJZXAZ-UHFFFAOYSA-N 379.504 5.513 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1cccc(CSC2CCCC2)c1 610122063 OOMIADYBSYBVCO-MRXNPFEDSA-N 380.513 5.140 30 20 GKED N#Cc1ccc(NC(=O)c2sc3cccc(Cl)c3c2Cl)c(Cl)c1 610896703 XUNKSSXPQMELPL-UHFFFAOYSA-N 381.671 5.985 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CC[C@@H](c3ccco3)C2)cc1Cl 611185623 FSZHUNRFLFVTFE-QGZVFWFLSA-N 392.842 5.227 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CC=C(c3c(F)cccc3F)CC2)c(Cl)c1 613813460 WBSCOBMYSRDBTA-UHFFFAOYSA-N 393.220 5.073 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cscc1C(F)(F)F 622835734 AGRJRELIKJSKIC-GFCCVEGCSA-N 385.304 5.330 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C4CC4)[nH]c3C3CC3)n2)cc1 626312585 FWKJVTRSNXEZFM-GOSISDBHSA-N 398.491 5.255 30 20 GKED C[C@@H](CC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C(F)(F)F 630009249 LCEWIHBSFFEGJC-ZETCQYMHSA-N 399.228 5.503 30 20 GKED C[C@@H](C(=O)N(CCC(F)(F)F)CC(F)(F)F)c1ccccc1C(F)(F)F 684161663 ZBKQSXAXKDXMRU-SECBINFHSA-N 395.265 5.152 30 20 GKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](C)c1cc2ccccc2o1 726474345 CRTUZTFTFOUBCC-CYBMUJFWSA-N 383.904 5.738 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1csc2ccccc12 730028767 AOTABWXXHHKMAN-QGZVFWFLSA-N 391.540 5.702 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)s1 732729541 YRSJPLLDMMCPJR-CFNZNRNTSA-N 385.558 5.188 30 20 GKED C=CC[C@H](NC(=O)N(CC)Cc1ccc(Cl)c(Cl)c1)c1ccncc1 734679802 JZRMOTMQDSCIGA-SFHVURJKSA-N 378.303 5.237 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(c2cccc3ccccc23)CC1)c1ccncc1 734681780 ZDDUOZUJKHKIJP-XMMPIXPASA-N 385.511 5.441 30 20 GKED CN(c1ccc(NC(=O)N(CCC#N)Cc2ccco2)cc1F)C1CCCCC1 735088642 UZAJIPPWPZGKEX-UHFFFAOYSA-N 398.482 5.135 30 20 GKED Cc1ccc2[nH]cc(C=Nn3cnc4sc(C)c(-c5ccccc5)c4c3=O)c2c1 735610687 SUHONLZMNDRXJJ-UHFFFAOYSA-N 398.491 5.105 30 20 GKED N#C[C@@H](C(=O)CC/C=C/c1ccccc1)c1nc(-c2c(F)cccc2F)cs1 739159604 HQEKQKMJTQWNQY-UFNQUYMESA-N 394.446 5.758 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 740787281 ZCONOJZSLQRXJZ-UHFFFAOYSA-N 393.915 5.089 30 20 GKED COc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1C#N 742366339 WUMYPZNRVZWOLG-JOCHJYFZSA-N 394.421 5.047 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1cccc([N+](=O)[O-])c1 743445408 STWMADTWHONWHI-UHFFFAOYSA-N 380.351 5.059 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 747805949 JCNGLTFTERXBHQ-AWEZNQCLSA-N 391.323 5.405 30 20 GKED CC(=NNc1nc(O)c2ccccc2n1)c1ccc(Cl)c(Cl)c1Cl 757584103 SPHRHSGMRJMOIR-UHFFFAOYSA-N 381.650 5.132 30 20 GKED COC1CCC(CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CC1 759222482 QHAGBADYTFGOAE-UBHUBRDASA-N 396.434 5.087 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1csc(-c2ccc(F)cc2)n1 767997203 PRBGCINGVSOEHO-UHFFFAOYSA-N 380.444 5.107 30 20 GKED Cc1cccc(C(=O)OCCCCC(C)(C)C#N)c1NC(=O)c1ccccc1F 768642006 ZELOYRVCMGBCML-UHFFFAOYSA-N 396.462 5.263 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1 773076806 PBMWKGFTATUXPN-DNVCBOLYSA-N 379.472 5.041 30 20 GKED O=C(/C=C\c1nc2ccc(Br)cc2s1)c1cccc(F)c1F 773144126 YLRCOWRQMKLEGI-SREVYHEPSA-N 380.213 5.233 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)c1 774449380 PEOSTKWQLAATDY-TZIWHRDSSA-N 399.332 5.371 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](Cc1ccccc1)c1ccccc1F 775455397 RDLCJQNCNATBLE-QFIPXVFZSA-N 394.877 5.455 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775615353 VPXJZZISUKMALF-HOTGVXAUSA-N 382.533 5.030 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)nn1[C@@H](C)C1CC1 776813806 NMLILTJSJQZRDS-HTAPYJJXSA-N 384.483 5.070 30 20 GKED C=C(C)[C@H]1CC=C(COC(=O)[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)CC1 778312234 GUDVOKCMTXYVTG-GUYCJALGSA-N 384.442 5.012 30 20 GKED Cc1cc(C(=O)Nc2ccc(-c3ccccc3)cc2F)nn1-c1cccc(C#N)c1 779832502 OTWJDMAXVAGHCV-UHFFFAOYSA-N 396.425 5.111 30 20 GKED CC(C)Sc1cc(Br)ccc1CNCc1ccc(C#N)cc1 779963207 KHSQOHIJOFHUOH-UHFFFAOYSA-N 375.335 5.111 30 20 GKED Fc1cccc(F)c1[C@H](NCc1c(F)c(F)c(F)c(F)c1F)C(F)(F)F 780415420 RVAFKSXCBVVEKR-AWEZNQCLSA-N 391.208 5.054 30 20 GKED O=C(/C=C\c1scnc1C1CC1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 782346779 CEYLCWXFHNKXRO-DZFYGRHCSA-N 387.476 5.004 30 20 GKED C[C@H]1CCCN(c2ccc(CN[C@H](C)c3ccc(OCC#N)cc3)cc2Cl)C1 800494296 VTVHWYORQCVZON-ZWKOTPCHSA-N 397.950 5.329 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1 800578977 XBSSGZIVMMTGOB-CQSZACIVSA-N 396.878 5.391 30 20 GKED CCc1ccccc1[C@@H]1C[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 802053144 JDTBOYBTCVIFCC-PWRODBHTSA-N 397.503 5.224 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3scc(C)c3C#N)c(F)c2)c(F)c1 809005706 SZPISWJPIAVEDG-UHFFFAOYSA-N 384.407 5.134 30 20 GKED N#C[C@H]1CCC[C@@H](OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 839045292 AALAHVJAJRZQBR-GXTWGEPZSA-N 393.270 5.207 30 20 GKED N#C[C@@H]1CCC[C@H](OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 839045298 AALAHVJAJRZQBR-OCCSQVGLSA-N 393.270 5.207 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3cccc(F)c3)CCC2)cc1 915181045 WKCYSSMFXGIVCH-QHCPKHFHSA-N 384.454 5.542 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 917047084 QRQREDJTMZPOJX-MORRKMRCSA-N 379.293 5.554 30 20 GKED CC(C)(C)c1ccc(C=NOCc2cccc(C(=O)N3CCCCC3)c2)cc1 917623263 QPDJRFSXTDIHME-UHFFFAOYSA-N 378.516 5.161 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N2CCC(c3ccc(C#N)cc3)CC2)c1C1CC1 930597790 KZFLFBJJGWHNPU-INIZCTEOSA-N 391.519 5.015 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(C(C)(C)C)cc2)c2cc(C(=O)O)oc12 1776119537 DHAJVBZMUBTQLF-YRNVUSSQSA-N 378.424 5.333 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2csc(-c3cc4ccccc4o3)n2)CC1 1776169949 VGJXZHSBSIBETM-UHFFFAOYSA-N 396.512 5.189 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(OC2CCCC2)c1 1776355528 XPFXCIVYUSECDX-ZRDIBKRKSA-N 394.467 5.390 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C)c2nc(C(=O)O)cs2)cc1 1776788218 RLXSDFICXTWZRD-HNNXBMFYSA-N 376.522 5.041 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CC=CCC3)CCC2)cc1 1789448796 ICNLSIMIDPANIJ-DENIHFKCSA-N 392.543 5.245 30 20 GKED N#C[C@H](C(=O)c1oc2ccccc2c1CSCc1ccccc1)c1ccccn1 41493960 BQWQVFHBEKYXIY-IBGZPJMESA-N 398.487 5.751 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccccc1OC(C)C 46648999 MJAWDHQVYAOBHP-SFHVURJKSA-N 379.504 5.028 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161446 WHLJPMHOTRODON-DYESRHJHSA-N 377.488 5.032 30 20 GKED CCc1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 51899057 PFNRIJOCZRZMBH-ZDUSSCGKSA-N 387.917 5.281 30 20 GKED C=CCn1c(SCCOc2ccc3ccccc3c2)nnc1-c1ccoc1C 71887652 DBTCMBGJDQZNJW-UHFFFAOYSA-N 391.496 5.357 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1 72025314 XISXBAHRGKTFLC-YADHBBJMSA-N 386.426 5.540 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 108528818 MUEHMLGHZWEUOY-QGZVFWFLSA-N 392.528 5.254 30 20 GKED CCOc1ccccc1CN(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 108531091 NIGMBIPMADMVJV-MRXNPFEDSA-N 383.517 5.001 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Br)c2)cc1)c1ccccn1 112483815 AEPDBXXWTWGKHR-GOSISDBHSA-N 393.240 5.126 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H]2CCC[C@@H]21 120346274 NFDUXUBKYYGBMA-REWPJTCUSA-N 389.499 5.242 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccccc4F)sc32)c(F)c1 151148493 SCCCKDAWIZVTEA-GOSISDBHSA-N 381.451 5.127 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 171740746 JBAADFXKPQGYSR-KXBFYZLASA-N 399.947 5.961 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-n3cnc4ccccc43)cc2)n1 182147137 XAIBZGAUGJDYHH-QGZVFWFLSA-N 386.480 5.095 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@H](C)c3nc4ccccc4o3)o2)cc1 182380078 KSKXYNHGPIIVET-CYBMUJFWSA-N 379.441 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccco1)N1CCCC1 191468518 PGGUZOMLYDCPIV-HXUWFJFHSA-N 381.520 5.090 30 20 GKED O=C1/C(=C\c2ccc(O)c(Cl)c2)CSC/C1=C/c1ccc(O)c(Cl)c1 207714665 IHWKEBBNXPFHHN-GFIWHYBVSA-N 393.291 5.188 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(C(F)F)nn(C)c2s1 280071593 QLBIFPXTEIUQDJ-UHFFFAOYSA-N 389.471 5.677 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 303610303 LIKBFEQTZHZMFD-UHFFFAOYSA-N 386.451 5.097 30 20 GKED O/C(CCc1nc2ccccc2o1)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329339918 NYNXDTUFHKNVTI-SFHVURJKSA-N 378.476 5.106 30 20 GKED O/C(CC1CCCC1)=N/C1CCC(c2nc([C@@H]3CCCCS3)no2)CC1 329503230 APSVMNODWAVAAQ-JCYILVPMSA-N 377.554 5.591 30 20 GKED CC1(C)C[C@H](/N=C(/O)N2CCCC[C@H]2c2nccs2)c2ccc(F)cc2O1 330129009 JROVJKHVAQDJLM-HOTGVXAUSA-N 389.496 5.026 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2C[C@H]3CCCC[C@H]3C2)cc1F 428880852 MFRLPGXPBYPZSU-CALCHBBNSA-N 379.435 5.144 30 20 GKED Cc1ccc(NC(=O)c2cccc(SCC#N)c2)c(OCc2ccccc2)c1 429867126 CATCZYTUWBMFMT-UHFFFAOYSA-N 388.492 5.442 30 20 GKED C=CCSCCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 430783307 MNJGAVGXKCQIIQ-UHFFFAOYSA-N 399.343 5.421 30 20 GKED N#CCCn1cc(CNc2cccc(-c3cccs3)c2)c(-c2ccncc2)n1 433327649 ASDFXDGJADTJEN-UHFFFAOYSA-N 385.496 5.199 30 20 GKED N#Cc1csc(C(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)c1 437389592 LFVCRYWNOAAWPA-JISUQADQSA-N 393.537 5.034 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1 437829241 QVKURIRYLQCWTC-FXAWDEMLSA-N 377.488 5.003 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccnc(Oc2ccccc2)c1 438481130 CLUUWSDPEOHTKK-FCHUYYIVSA-N 398.466 5.178 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(=Cc2ccccc2F)CC1)c1ccccc1 438850313 HJGITBUFYMSIDO-QFIPXVFZSA-N 377.463 5.060 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccccc3-c3cn[nH]c3)cc2)cc1 439768925 UBNWSAMVWIWVCI-UHFFFAOYSA-N 394.434 5.187 30 20 GKED C=C[C@@](C)(CC)C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 443293431 FPNQICWMXSACJJ-NRFANRHFSA-N 385.895 5.203 30 20 GKED Cc1ccc(-c2nc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)cs2)cc1 464938911 VXAPUEFFXQQSGD-PZJWPPBQSA-N 387.508 5.031 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c(Br)s1 471101789 PIJXSQWDLZJQBE-UHFFFAOYSA-N 395.347 5.273 30 20 GKED CCCOc1ccc(C(C)(C)NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 474534082 LERRJZCLZHYQCB-NRFANRHFSA-N 379.504 5.055 30 20 GKED C=C(C)[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccc(F)c(F)c1 481592577 CZPHOCFSIQWXSP-QHCPKHFHSA-N 392.449 5.624 30 20 GKED CCCOc1c(Cl)cc(C(=O)N(CCC#N)C(C)(C)CC)cc1OCC 484460426 XTEZLTHVJHOBIT-UHFFFAOYSA-N 380.916 5.072 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 487485301 LUYDNPRTTCWUET-AQNXPRMDSA-N 386.417 5.360 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)CCCc2ccc(Cl)cc2)cc1 489002248 LQWVDAROBBZSTR-UHFFFAOYSA-N 394.824 5.125 30 20 GKED CCOC(=O)c1c(NC(=O)c2sccc2C#N)sc(-c2ccccc2)c1C 497978709 ADCQSSYFKMDQLH-UHFFFAOYSA-N 396.493 5.086 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1C 500767857 OBQIHUWXQTZQDR-UHFFFAOYSA-N 387.395 5.128 30 20 GKED C=CCC[C@H](NC(=O)[C@@H]1CCO[C@H](CCC)C1)c1ccc(C(F)(F)F)cc1 503630241 QVNJTZYPTITRSB-QRQLOZEOSA-N 383.454 5.424 30 20 GKED N#Cc1ccc(N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1[N+](=O)[O-] 516860260 WPBKONLZCQNARR-INIZCTEOSA-N 394.431 5.219 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cnc(C2CC2)s1 517162604 BDAWRZSBAFBSGP-UHFFFAOYSA-N 391.471 5.187 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCOc2ccc(F)cc21 518168829 LSIHHWJYWMDPAB-YOEHRIQHSA-N 399.491 5.113 30 20 GKED C=C(C)COc1cc(CNCc2nc3cc(Cl)ccc3s2)ccc1OC 518277335 HAMIUGIIJCTOEC-UHFFFAOYSA-N 388.920 5.203 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2OC(C)(C)C1 518609747 MDOIYSVSLHNSDE-MRXNPFEDSA-N 395.528 5.286 30 20 GKED COc1ccsc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 520690928 RKUVHOOIYNLBMB-UHFFFAOYSA-N 384.844 5.326 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCOc1ccc(F)c(Cl)c1 520826145 BIUJECRBDVVJGC-ZDUSSCGKSA-N 392.883 5.138 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 520959999 XGXPFASRBMCGNU-UHFFFAOYSA-N 396.943 5.263 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc2cc(F)ccc2o1 522746429 YRKMRPUYXLZXFC-UHFFFAOYSA-N 386.382 5.797 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)c1nnc(-c2ccc(Cl)cc2Cl)o1 531559709 UNKUDRQTHKOHRR-SNVBAGLBSA-N 376.268 5.768 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)Nc2cccc(-c3ncco3)c2)cc1 536907983 CGNKNSIBOHEAJU-UHFFFAOYSA-N 394.434 5.202 30 20 GKED C[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1Oc1ccccc1 538160248 VKGATFXOAFBMCU-QGZVFWFLSA-N 396.450 5.251 30 20 GKED C=CCC[C@@H](NCc1nc(-c2cccc(Br)c2)no1)c1ccccc1 538258863 MUYFOXVJCRRQPR-GOSISDBHSA-N 398.304 5.296 30 20 GKED COc1ccc(Cl)c(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 540854530 ATLIFCHWDQGPFF-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C[C@@H](NCc1noc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541086375 OJDFWTMIQSYXGC-QGZVFWFLSA-N 380.451 5.126 30 20 GKED C[C@@H](NC(=O)c1c(F)cccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 542989341 OUMBTUQSCGJTFK-CQSZACIVSA-N 378.834 5.509 30 20 GKED N#CCc1ccc(CSc2nnc(-c3ccco3)n2C2CCCCC2)cc1 544049842 BVFPLMLWGRYNGI-UHFFFAOYSA-N 378.501 5.402 30 20 GKED O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)[C@@H]1CCC[C@@H](C(F)(F)F)C1 544061226 FUQFEOKFDHMXPR-JRKPZEMJSA-N 389.286 5.053 30 20 GKED C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1 544254000 MHWBOENDGHWBNI-BJKOFHAPSA-N 375.512 5.521 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc(-c2csc(C)n2)s1 548587226 DXEKWQCIHNQVJB-UHFFFAOYSA-N 386.567 5.388 30 20 GKED C=C(C)Cn1c([C@H](C)CC)nnc1N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 549665556 PQIQZEFTTPTTKX-HZPDHXFCSA-N 397.498 5.032 30 20 GKED CCN(CC(=O)N(CCC#N)c1ccccc1)C(c1ccccc1)c1ccccc1 553083991 IEXDQXUAJMQJAM-UHFFFAOYSA-N 397.522 5.045 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2c(C(C)=O)oc3cc(C)ccc23)c1 553955956 UEXGJHYXVQTYEZ-UHFFFAOYSA-N 377.440 5.080 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ncoc2C2CC2)cc1Cl 555320343 HYUPVQCNOBMUOE-KRWDZBQOSA-N 377.831 5.113 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1 560863371 JAVMXQDQNFJRTD-QFIPXVFZSA-N 376.500 5.030 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ncc(-c2cccnc2)s1 561021931 AJOXRLGRJCUOOC-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(F)c(C(F)(F)F)cc1F 568324404 FVLKAAXKKDJABD-NSHDSACASA-N 386.389 5.990 30 20 GKED Cc1nc2ccc(-c3noc(-c4cn(CCCC#N)c5ccccc45)n3)cc2s1 580126782 LCPPXBKHCXXCAL-UHFFFAOYSA-N 399.479 5.580 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)CCCCC2=O 584143294 TWZKCJWZAWTAAH-OAHLLOKOSA-N 378.497 5.242 30 20 GKED N#CCCCCCC(=O)N(Cc1cccs1)c1ccc(Br)cc1 588886214 JBGAWAFYJHFTCB-UHFFFAOYSA-N 391.334 5.518 30 20 GKED C=CCN(C(=O)[C@@H]1CCCOC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 589897099 MFYINBXLTOUOOF-CYBMUJFWSA-N 397.327 5.063 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)cn2)cc1 604241661 FVNFENMVPNIYJR-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 607433300 PTPCTQUJWHFQHV-INIZCTEOSA-N 390.430 5.649 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2c(s1)CCC2 609061895 JVIRNVAVHUKJCU-UHFFFAOYSA-N 388.492 5.248 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 611549609 AICWSZKQXNOLSS-QGZVFWFLSA-N 391.452 5.135 30 20 GKED CC(F)(F)c1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 644792306 RIUXDVYSTWPDHH-RYUDHWBXSA-N 389.286 5.001 30 20 GKED C=CCC[C@@H](NCc1nnc(C(F)(F)F)s1)c1ccc(C(F)(F)F)cc1 660203530 DOWXLUXMLNFKPA-GFCCVEGCSA-N 395.372 5.373 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)N[C@H](C)c1ccsc1 670175067 FRFOPVIMKUOCEU-GFCCVEGCSA-N 397.313 5.109 30 20 GKED Cc1ccnc2sc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c(C)c12 683810255 WMFALAUPMLIUJL-LBPRGKRZSA-N 381.457 5.152 30 20 GKED COc1ccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)c2ccc(C)cc2)cc1 728712114 UQZZRVMPZITNCZ-KBMIEXCESA-N 386.495 5.174 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cc2ccccc2o1 733080895 FPCZXUIZAIWTEP-UHFFFAOYSA-N 397.360 5.140 30 20 GKED C#Cc1ccc(C(=O)O[C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 733797675 BOMAFZCBLSQTCJ-JTQLQIEISA-N 387.279 5.019 30 20 GKED C=CC[C@H](NC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccncc1 734237553 QGEZPLQMMKGHBX-FQEVSTJZSA-N 395.553 5.186 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccc(Cl)s1 735975994 HFECLDSGILMFCQ-UHFFFAOYSA-N 397.813 5.108 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@H](C)C[C@H]2c2cccc(F)c2)c1=S 742176027 QPVPANPNTCICFH-QAPCUYQASA-N 398.507 5.040 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)c1ccco1 744037742 ZTCVIJJFIOHLDE-KHEQEVDJSA-N 380.513 5.184 30 20 GKED C=CC[C@@H](NC(=O)N(CC)[C@@H](Cc1ccc(F)cc1)C(C)C)c1ccncc1 745828074 QMKLDCQNWNLMQK-YADHBBJMSA-N 383.511 5.137 30 20 GKED COc1cccc(/C=C2\CCc3cc(SC)ccc3C2=O)c1OC(F)F 748148225 RMPDMOBMDRPULT-JLHYYAGUSA-N 376.424 5.231 30 20 GKED C=CCC[C@@H](NC(=O)NCCc1cnc(C)s1)c1ccc(C(F)(F)F)cc1 749849405 QGNHANAMGFOPGB-QGZVFWFLSA-N 397.466 5.020 30 20 GKED Oc1ccccc1C=Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 751521824 BMEVWRYKMFWUFN-UHFFFAOYSA-N 375.815 5.532 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\c1ccc(Cl)nc1 758672794 BZPMBRQGYOMFBI-WZUFQYTHSA-N 389.842 5.359 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc3c(c2)OC2(CCCCC2)O3)cc1 770512847 QVKKHVBKACUCLK-UHFFFAOYSA-N 377.488 5.080 30 20 GKED N#CCOc1cccc(NCc2ccc(-c3cccc(Br)c3)o2)c1 779585518 DXLSREDCECLAKP-UHFFFAOYSA-N 383.245 5.224 30 20 GKED C[C@@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCOC1 781447182 DICWVAXEWPJLTL-FZKQIMNGSA-N 395.311 5.110 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1cccc(OC(F)(F)F)c1 783736211 UZNMPISOLVWWJL-UHFFFAOYSA-N 397.447 5.400 30 20 GKED Cc1cccc(Cl)c1CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 790766400 BAMAJOKITKRMLL-KRWDZBQOSA-N 391.883 5.063 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1nccc2ccccc12 792090294 DJFATLCALAVCSJ-QGZVFWFLSA-N 383.278 5.741 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)cc1 793829377 IBYGZVAYZRHBRE-QGZVFWFLSA-N 386.417 5.136 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 794160101 IBRSEHRVYSULIG-UHFFFAOYSA-N 394.883 6.000 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)o2)cc1 797568352 QNTWCQTUEROHAU-INIZCTEOSA-N 393.512 5.213 30 20 GKED N#CC1(CCCOC(=O)C2(Cc3cccc(Cl)c3)CCCC2)CCOCC1 800173851 WNKUTAYZRFZRMN-UHFFFAOYSA-N 389.923 5.087 30 20 GKED N#CC[C@@H](CC(=O)OCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccccc1 811083707 AVPNYIBMTGOBHZ-ZDUSSCGKSA-N 393.226 5.032 30 20 GKED C=CCOc1ccc(CNc2cc([C@@H](O)c3ccccn3)ccc2C)cc1Cl 812846705 MXDJKKGJCXKEQQ-HSZRJFAPSA-N 394.902 5.302 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1Br 815900035 MHCWCJADVIORPS-GFCCVEGCSA-N 385.286 5.111 30 20 GKED Cc1cc(CN[C@H](C)c2ccc(C#N)cc2F)cc(NC(=O)OC(C)(C)C)c1 834894953 NEHPMLYKHVFZGW-OAHLLOKOSA-N 383.467 5.204 30 20 GKED N#Cc1ccc(C2(NC(=O)Nc3cccc(C4SCCS4)c3)CCC2)cc1 847107880 MSGSGVDMZGZJLN-UHFFFAOYSA-N 395.553 5.238 30 20 GKED CC1(C)C[C@@H](C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C(C)(C)O1 860478272 UHCGKBNKXJVDME-RYUDHWBXSA-N 396.434 5.085 30 20 GKED C[C@@]1(C(F)(F)F)CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 878217591 AWGXXWQMWFULNJ-UYAOXDASSA-N 387.405 5.148 30 20 GKED C=CC[C@H](c1ccccc1)c1nc(-c2ccc(OCc3cccnc3)cc2)no1 904469335 ZHQFUQXBMWOHPA-JOCHJYFZSA-N 383.451 5.419 30 20 GKED C[C@@H](/N=C\c1cc2ccccc2nc1O)c1ccc(OCc2cccnc2)cc1 915271255 QKIGPLYHEPDPEQ-LNIIIOKPSA-N 383.451 5.095 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCSc3ccccc32)cc1 915350526 XPJAPCSMGPPMNP-FCHUYYIVSA-N 399.519 5.701 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3cc(F)ccc3F)c2)cc1 916134176 GEFMZFDEFKEFDL-LFYBBSHMSA-N 393.389 5.122 30 20 GKED CC(C)(C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917042457 BGTMZPMWVZNAEU-AWEZNQCLSA-N 398.915 5.502 30 20 GKED COc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 920805083 GOJQUAAVLDMISG-DOMZBBRYSA-N 398.434 5.077 30 20 GKED Fc1c(Cl)cccc1NN=Cc1cn(-c2ccccc2)nc1-c1cccnc1 921137722 HQVZUCZSPLQKNG-UHFFFAOYSA-N 391.837 5.173 30 20 GKED CC(C)[C@H]1/C(=C/c2c(F)ccc3sc(C(=O)O)cc23)C(=O)c2ccccc21 1776308577 FJELGCTUKHTWEX-SIBGDRKGSA-N 380.440 5.758 30 20 GKED C#CCCCC(=O)NC1(c2ccc(NC(=O)/C=C/C3CCCCC3)cc2)CCC1 1790517935 PHGRDJVPJOYLGP-SFQUDFHCSA-N 392.543 5.061 30 20 GKED C=CCn1c(SCc2csc(-c3cccs3)n2)nnc1-c1cccnc1 10196309 PAJNHYAQNGOALU-UHFFFAOYSA-N 397.554 5.003 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)C(=O)N[C@H](C)c2cccc3ccccc23)n1 22360859 GVXASIAGCHOXDQ-IAGOWNOFSA-N 389.524 5.081 30 20 GKED CC(C)N(C(=O)COc1cccc(C#N)c1)c1ccc(Nc2ccccc2)cc1 23510848 BLUJAWRPFNNQEA-UHFFFAOYSA-N 385.467 5.122 30 20 GKED CSc1ccccc1NC(=O)[C@@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 24033975 LFCPXRVTPZOEEJ-MRXNPFEDSA-N 388.492 5.353 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 43714137 KZYGZESVIGMELO-QFIPXVFZSA-N 389.886 5.143 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 48858920 LNTCQTFXIMLJPG-SFHVURJKSA-N 383.476 5.081 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)no1 56745033 BATRKYOQGAWPIT-HXUWFJFHSA-N 388.427 5.016 30 20 GKED Cc1sc(NC(=O)CCSc2ccc(Br)cc2)c(C#N)c1C 64680327 OFBMJNIVSDRVCY-UHFFFAOYSA-N 395.347 5.120 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Br)c1 66801499 DFUATBABDFSIEQ-GFCCVEGCSA-N 375.291 5.096 30 20 GKED CCCO[C@@H]1CCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 108515278 WOABOWYBPZHNAW-HXUWFJFHSA-N 393.487 5.164 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(OC(F)F)cc1 108981178 SOSHXSWRYXAAGK-AWEZNQCLSA-N 390.455 5.254 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 110655070 PDBMCAJKEYODIT-VCFDLTMXSA-N 380.658 5.834 30 20 GKED C[C@H](SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1)c1ccc(C#N)cc1 118443769 NPYNDHBBMVLNED-LBPRGKRZSA-N 393.493 5.111 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)N(CCC#N)Cc1ccco1 119769237 ZUJZSSCOTUNCRT-UHFFFAOYSA-N 391.427 5.028 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(COC2CCCCC2)c1 120474523 DQANQQVRZPTGAM-UHFFFAOYSA-N 377.488 5.071 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1C 128803153 XPULJAWCIZPXJR-GOSISDBHSA-N 393.537 5.181 30 20 GKED CC(C)(C)OC1CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 129906720 GOSDVTWDPMTSIV-UHFFFAOYSA-N 393.487 5.162 30 20 GKED Cc1cc(CN[C@@H](CCC#N)c2ccccc2)cc(C)c1OCc1ccccn1 130596014 WOAKNNJVKINQBW-DEOSSOPVSA-N 385.511 5.412 30 20 GKED Cc1nc(-c2ccccc2)ncc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 133428869 JLYOGBIMQOBFOE-GOSISDBHSA-N 396.475 5.066 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccc(Cl)cn1 134737007 DWJIAVAPCWNVJS-UHFFFAOYSA-N 398.249 5.329 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)cc1C#N 152607186 CNZDVEQKRRRNKN-UHFFFAOYSA-N 390.402 5.004 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)c1ncc(C(C)(C)C)o1 177249497 CAZYNVQTZABHDI-HNNXBMFYSA-N 382.533 5.194 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC(F)F)c(OC)c1 189885196 PXMAPIAUCYMQEQ-UHFFFAOYSA-N 375.415 5.401 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 189911596 VWHFNYROPUMWOG-LJQANCHMSA-N 375.434 6.213 30 20 GKED Cc1cccc(N=C(O)[C@@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c1C 328700837 MYIINGLNLOJPHE-VGOFRKELSA-N 391.515 5.377 30 20 GKED C[C@@H](c1ccccc1)N1CCC(/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)CC1 328879891 KGVIBAQRFITFGD-INIZCTEOSA-N 391.515 5.096 30 20 GKED CC1(C)C[C@@H](/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)c2ccc(F)cc2O1 328949796 WTBPQEVRCOWBGK-QGZVFWFLSA-N 382.435 5.312 30 20 GKED Cc1cc(NC(=O)N2CCC(C#N)(c3ccccn3)CC2)ccc1-c1ccccc1 374349432 JMMHOHVFHPXLJC-UHFFFAOYSA-N 396.494 5.146 30 20 GKED C=CCCn1cc(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)nn1 425487833 ZBSSLQNURRYNBT-GFCCVEGCSA-N 398.454 5.016 30 20 GKED CCn1ncc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1-c1ccccc1 427607404 TVQSRRXUIUCUBE-MRXNPFEDSA-N 390.512 5.074 30 20 GKED CC(C)(c1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)cc1)C(F)(F)F 429241514 WVBXBEDPXYXUNV-UHFFFAOYSA-N 393.302 5.937 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1occc1C 432771651 YEVGWLQVCJGTQM-UHFFFAOYSA-N 375.428 5.224 30 20 GKED CCN(C(=O)CN[C@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 433009371 HHMCINSEYIHMMU-HSZRJFAPSA-N 385.511 5.217 30 20 GKED Cc1ccc(Br)cc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 442668447 DLCCORGAOPDXGM-INIZCTEOSA-N 397.297 5.371 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)ccc(C(F)(F)F)c1F 443528056 CJCZVNKSSUTCSI-NSHDSACASA-N 378.350 5.253 30 20 GKED N#Cc1ccc(NC(=O)N2Cc3ccccc3C[C@H]2c2ccccc2)c(Cl)c1 448153335 FOXMPFNTEXSCSB-QFIPXVFZSA-N 387.870 5.543 30 20 GKED CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H](C)Cc1ccc(OC)cc1 458827363 DDFYXUUADPNWBS-AUSIDOKSSA-N 393.531 5.093 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 460158863 BUHKDRGLPKVVPV-UHFFFAOYSA-N 378.815 5.265 30 20 GKED N#CCCCC(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 462257048 HWJWWEBSXFEVIF-UHFFFAOYSA-N 395.846 5.206 30 20 GKED N#CCCCn1cc(C(=O)N2CC=C(c3ccc(F)cc3)CC2)c2ccccc21 468927249 LWJRACUEAQNNLP-UHFFFAOYSA-N 387.458 5.014 30 20 GKED N#Cc1ccc(C2(C(=O)N3CCC(Sc4ccc(Cl)cc4)CC3)CC2)cc1 474228102 FMUDLCFDYLRLTI-UHFFFAOYSA-N 396.943 5.027 30 20 GKED Cc1cccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1 477830894 WBRRPVQGKZWPPZ-UHFFFAOYSA-N 375.403 5.229 30 20 GKED CC(C)(C#N)CC(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 478621851 GXEKPAUMJDGORD-QGZVFWFLSA-N 379.891 5.009 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@H]1c1ccccc1 480803300 KKXJDGJTHHYDDX-UZUQRXQVSA-N 383.451 5.575 30 20 GKED CC(C)[C@@H](NCc1ccc(C#N)cc1Br)c1ccc(F)cc1F 481229091 ASZKKXXFYWTXHW-GOSISDBHSA-N 379.248 5.086 30 20 GKED C=CCn1c(COc2ccc(C)cc2)nnc1S[C@H](C)c1ccc(C#N)cc1 481366861 GMASMGAQVMCVSZ-QGZVFWFLSA-N 390.512 5.077 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1 487174364 DIESMUGBSYIMPV-UFYCRDLUSA-N 387.310 5.648 30 20 GKED Cc1ccc2ncc(C#N)c(N3CCC[C@H](c4nc5ccc(F)cc5o4)C3)c2c1 488130924 RAFZTCNOEYBTDR-HNNXBMFYSA-N 386.430 5.079 30 20 GKED Cc1ccc2snc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2c1 496197636 OSUJSERIRIEWRO-HNNXBMFYSA-N 375.478 5.218 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccccc1NC12CC3CC(CC(C3)C1)C2 500033987 ZKRZKQPEGCXCJQ-UHFFFAOYSA-N 377.513 5.253 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 503201696 PSKAWXVUKDDFFZ-QUCCMNQESA-N 393.556 5.628 30 20 GKED CCCCCn1cc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1 503499571 URENJVYNMJCOFP-MRXNPFEDSA-N 399.564 5.098 30 20 GKED CC(C)N(C(=O)c1ccc(OCc2ccccc2C#N)cc1)c1ccc(F)cc1 505078791 UHIHZXNYQJGJJZ-UHFFFAOYSA-N 388.442 5.332 30 20 GKED N#CCc1ccc(NC(=O)NCc2ccc(-c3ccc4c(c3)CCCO4)cc2)cc1 506151178 YIIIWMGOVPWCPB-UHFFFAOYSA-N 397.478 5.066 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 509721980 OFRIYLKMPZZFSY-ZDUSSCGKSA-N 378.369 5.133 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1cc(Cl)ccc1Sc1ccc(F)cc1 510051603 XYLHNIRWFXMYLP-GFCCVEGCSA-N 377.872 5.254 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 517529489 BTBOSORNTDDYQZ-SFHVURJKSA-N 385.467 5.618 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1SC[C@H](C)C#N 518166018 SJYQQHFDJOFAIM-OAHLLOKOSA-N 387.936 5.646 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 518487724 PQXXUFYSFIGWDA-MRXNPFEDSA-N 388.433 5.508 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC(c2noc3cc(F)ccc23)CC1 519824491 HKGSKASHTAKZGG-UHFFFAOYSA-N 396.487 5.265 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520599977 UPBYHMGPJZALBZ-INIZCTEOSA-N 389.430 5.715 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 520940518 VTMCSLHZFOHOIQ-HNNXBMFYSA-N 387.936 5.788 30 20 GKED CCCCN(C)c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 521326958 KNANCBOURKVZAQ-QGZVFWFLSA-N 381.545 5.569 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)o1 521797232 MMOUIQNUWQREBL-AWEZNQCLSA-N 380.444 5.732 30 20 GKED CC(C)C[C@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccs1 524437104 ZIMUHOHEWUYGIN-AWEZNQCLSA-N 379.432 5.130 30 20 GKED CCc1ncc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)s1 525131853 FKDIMIHZBQQSCC-UHFFFAOYSA-N 381.888 5.078 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3ccccc3F)CC2)cc1C(F)(F)F 525228863 ILFWVOSZKYNTMW-UHFFFAOYSA-N 391.368 5.128 30 20 GKED CN(C(=O)c1ccc(NCc2cccc(C#N)c2)cc1Cl)C1CCCCC1 531149574 ADDQWPJGOHBHMS-UHFFFAOYSA-N 381.907 5.228 30 20 GKED CCN(C(=O)c1ccc(-c2ccccc2)nc1C)c1ccc(C#N)c(Cl)c1 533674170 JTLCEQLMPPLYNY-UHFFFAOYSA-N 375.859 5.249 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 533878212 FLLCTOYTLRXWPN-OAQYLSRUSA-N 398.553 5.845 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc([C@@H]2CCCOC2)c1 534300927 JWTNSRWATBHDED-QFBILLFUSA-N 380.513 5.085 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)OCC 535138709 QXYNMLNHDHZENI-TZIWHRDSSA-N 382.891 5.305 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccccc1 536163534 PNSDNJPICMBYGK-LPHOPBHVSA-N 385.891 5.196 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(-c3ccccn3)nc3ccccc23)n1 536225626 MDKXQXVLUUITBH-KRWDZBQOSA-N 398.491 5.367 30 20 GKED C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@H](CCC#N)c1ccccc1 536838884 LPPGVONVUNDXJO-HNAYVOBHSA-N 389.421 5.057 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cccc(OC3CCCC3)c2)C2CC2)cc1 541432480 VSCJVFDUFDUHNF-UHFFFAOYSA-N 375.472 5.076 30 20 GKED C[C@H](NCc1cncc(Br)c1)c1ccc(-c2cccc(C#N)c2)cc1 544115942 BVEDDLAPDBYULI-HNNXBMFYSA-N 392.300 5.234 30 20 GKED N#CCCn1cc(CN2CC[C@H](c3cccc(Cl)c3)C2)c(-c2ccccc2)n1 552316953 VJUCAUGVZQVWCG-FQEVSTJZSA-N 390.918 5.107 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(Cc2ccc(F)cc2)CC1 552787146 QIUFSUGDCGMWLD-MRXNPFEDSA-N 397.519 5.364 30 20 GKED CC(C)(c1cccc(C(F)(F)F)c1)c1noc(C[C@H](CC#N)c2ccccc2)n1 560048831 LHBNCQYGFXQTKJ-INIZCTEOSA-N 399.416 5.654 30 20 GKED C[C@H](NCc1ccc(C(F)(F)F)cn1)c1ccc(-c2cccc(C#N)c2)cc1 560162082 JKLGACFHIDZLAT-HNNXBMFYSA-N 381.401 5.490 30 20 GKED COc1ccc2ccc(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)cc2c1 560816346 BNHVEFCBVLUGFC-UHFFFAOYSA-N 395.418 5.160 30 20 GKED COc1cccc([C@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)c1 566827314 VSTMMVVWNFPWHJ-ZEQRLZLVSA-N 388.898 5.587 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl 579049926 ZZWPAWKZSYHRJI-UHFFFAOYSA-N 386.927 5.018 30 20 GKED N#CCCCCCC(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 588886543 TULMERFFDIKAAO-UHFFFAOYSA-N 375.299 5.673 30 20 GKED C[C@@H]1CCC[C@@H](N(Cc2ccc3c(c2)OCO3)C(=O)CCCCCC#N)[C@@H]1C 588901224 XRZJOVUOXXTQQH-QWFCFKBJSA-N 384.520 5.043 30 20 GKED N#CCCCCC(=O)N(Cc1ccccc1)c1nc2ccc(Cl)cc2s1 593946333 DSCRWRQJHOOVHV-UHFFFAOYSA-N 383.904 5.567 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C[C@@H](C)C1(F)F 599727323 ZLQZIBUTZXUKTK-GASCZTMLSA-N 385.414 5.106 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 604485473 LMEKTAWRNKQJAF-UHFFFAOYSA-N 398.466 5.008 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)nc2ccc(OC)cc12 607447030 FHKFPBMCMDYCJC-UHFFFAOYSA-N 386.904 5.095 30 20 GKED CC(C)c1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 609104658 KPVIJJVWGDBYKN-UHFFFAOYSA-N 394.471 5.714 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3sccc3OC(F)F)c2)cc1 609176848 ZLGGDNCVOUCCJF-UHFFFAOYSA-N 386.379 5.266 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1 609967796 HGUALUCPRMOWDU-MRXNPFEDSA-N 388.433 5.194 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC(C)(C)CC(F)(F)F 614930073 GWGCCDFJMNYTKL-UHFFFAOYSA-N 391.393 5.512 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)Nc1cccc(OCCCC#N)c1 619803886 GKEDCGSBBWVHGD-UHFFFAOYSA-N 385.895 5.964 30 20 GKED CC1(C(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CCC(F)(F)CC1 623983353 YYGUUBUCSTZWLJ-UWVGGRQHSA-N 395.334 5.228 30 20 GKED O=C([C@@H]1CC[C@@H]1c1ccc(F)cc1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 627664990 BLYXRIOSLMFRNQ-APIJFGDWSA-N 397.334 5.051 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc(-c2ccccc2)cs1 642281572 KNPBAISKMIKTHI-OAHLLOKOSA-N 378.840 5.700 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1 665239819 ZYTZBESHDLETRJ-IYBDPMFKSA-N 379.426 5.021 30 20 GKED C=CCC[C@@H](Nc1ccc2nnc(C3CC3)n2n1)c1ccc(C(F)(F)F)cc1 676728872 DUCDSBYAPNRBDH-MRXNPFEDSA-N 387.409 5.140 30 20 GKED CCC[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1cccc(C(F)(F)F)c1 726845901 RHUBZDBJCZZMSZ-GOSISDBHSA-N 391.393 5.271 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@H]1C[C@H](C)CC(C)(C)C1 727627746 QHHBNAKJWWWBJT-SQGPQFPESA-N 382.548 5.311 30 20 GKED Cc1ccccc1Oc1ccccc1CNC(=O)c1ccccc1SCC#N 730223836 JNLQBNLZWCPUPP-UHFFFAOYSA-N 388.492 5.333 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc1Cl 730417360 MZGODMPFQYXMQV-FZMZJTMJSA-N 388.851 5.041 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731972788 NPXCAGXNGIBDCX-GOTSBHOMSA-N 386.520 5.851 30 20 GKED Cc1ccc2c(c1)CCCN2C(=O)c1cccc(COc2ccc(C#N)cc2)c1 734314786 OWAVQZHFPQFNJC-UHFFFAOYSA-N 382.463 5.039 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)SCc1cc(Cl)ccc1OCC#N 735317686 FERNTTNWMMBFEL-HNNXBMFYSA-N 388.920 5.120 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)s1 736432862 IIJSSGKGONGFAJ-CMDGGOBGSA-N 381.453 5.295 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCSc3ccccc32)cc1 741901355 HLBIUSWUHCZIRC-FGZHOGPDSA-N 384.504 5.560 30 20 GKED Cc1ncc(/C=C\C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)s1 741919751 HFNSWGNANQFAPP-KTKRTIGZSA-N 393.899 5.223 30 20 GKED CCCCCCC[C@H](C)CNC(=O)Nc1cc(N2CCOC2=O)ccc1C 743240819 PNXLSOUKFHRRHL-INIZCTEOSA-N 375.513 5.070 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@]12CCCc1ccccc12)c1nc2cc(Cl)ccc2s1 744035125 HUTFTRAWHYZDSV-ZDPZECHZSA-N 392.911 5.420 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)Cc1ccc(-c2ccccc2)cc1 749361309 YJQDCRJBZHGNCS-UHFFFAOYSA-N 391.474 5.032 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC[C@@H](C)c3ccccc3)n2)cc1 750328132 JDWHYYRTBXUTSP-UZLBHIALSA-N 390.508 5.579 30 20 GKED Cc1sc(Cl)nc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 762844302 WUIVFEBXPXPIQA-UHFFFAOYSA-N 397.887 5.002 30 20 GKED C#C[C@H](C)N(C)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 770512232 JNMHIWNUULRBRE-INIZCTEOSA-N 392.478 5.217 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H]2CCc3ccc(-c4ccccc4)cc32)c1 779404912 WFIWCAVJRBHYDS-QHCPKHFHSA-N 383.451 5.065 30 20 GKED N#C[C@@H](NC(=O)CCCc1ccsc1)c1ccc(OCc2ccccc2)cc1 783509222 OEWATTHYYKNTQY-JOCHJYFZSA-N 390.508 5.031 30 20 GKED CC[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 784821074 KWDNJIOFLKPICA-HIFRSBDPSA-N 385.533 5.058 30 20 GKED Cc1c(C(=O)/C=C\c2cccc(OCc3ccccc3C#N)c2)cnn1C(C)C 787187605 SGXUVFXYRBUXML-QXMHVHEDSA-N 385.467 5.119 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1 791012539 DLEVOOALWWUBMO-UHFFFAOYSA-N 397.261 5.815 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2csc(C(F)(F)F)n2)cc1 792340486 KFJKQZABOKRTFG-UHFFFAOYSA-N 388.370 5.058 30 20 GKED N#CC[C@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796653064 XLIAPCUJOJTBOM-ZBFHGGJFSA-N 379.872 5.214 30 20 GKED C[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(C(F)(F)F)cc1 798432941 RBGIZBDJGWORKP-KGLIPLIRSA-N 392.446 5.699 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)c2ccc(C)c(C#N)c2)cc1 799337711 NMUSGNYUUJMREP-XMMPIXPASA-N 383.495 5.076 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2cccc(-c3cccnc3)c2)C(=O)c2ccccc21 802708916 XTTKZWJPAXBUIJ-YSSBIZNGSA-N 383.447 5.065 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C=NNc1ccc(OC(F)(F)F)cc1 812461220 KSHHDSFDXZBGQN-UHFFFAOYSA-N 394.784 5.179 30 20 GKED O=C1/C(=C\c2ccc3ncccc3c2)CCOc2ccc(Br)cc21 818470704 SQBNCHLHMBXHQT-PTNGSMBKSA-N 380.241 5.046 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(Cl)cc2)cc1 915353247 RVKDXRCCWLAOFR-NRFANRHFSA-N 375.859 5.317 30 20 GKED C[C@@H](C=Nn1c(S)nnc1-c1ccc(Cl)cc1Cl)c1ccccc1 916276733 HVNATIVCHQBYEL-NSHDSACASA-N 377.300 5.178 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCSc2ccccc2F)cc1 916948963 KUPGCBXNLINALG-MAUKXSAKSA-N 398.503 5.169 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917041240 ROSKDZQOKSGGSB-OJNOIJSXSA-N 393.437 5.619 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 917046415 BPIXHFVXCRYPAV-LLVKDONJSA-N 381.309 5.474 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2cc(Cl)cc(Cl)c2)cc1 917517781 KRTNKOHBKHHPGF-UQCOIBPSSA-N 387.266 5.202 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1F)c1nc(-c2c(F)cccc2F)cs1 920804807 ZSFBEQUADJFMIN-LJTDUEICSA-N 384.382 5.117 30 20 GKED C=CC[C@@H]1CCN1Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 934458851 BNAARBOGCBEWHB-CQSZACIVSA-N 396.343 5.285 30 20 GKED O=C(O)c1ccc2scc(C=NNc3nc(-c4ccccc4)cs3)c2c1 1776022394 MCZBEGOVBFPZRF-UHFFFAOYSA-N 379.466 5.169 30 20 GKED CCC(Cc1ccc(Br)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776034096 NNSMGUKPXVJHEF-UHFFFAOYSA-N 395.684 5.221 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2csc(C(=O)O)c2)cc1 1776125733 RLSMTQWYJDJSKJ-FGLWMGOFSA-N 386.513 5.938 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2nc(-c3ccc4ccccc4c3)oc2C)C1 1776157025 LZQXALZMHHDFLX-DEOSSOPVSA-N 390.483 5.046 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)cc1 1777472332 YTSCBUQDNRFZIJ-APGQMXJTSA-N 398.458 5.568 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)C(C)(C)C(C)(F)F)cc2)CCC1 1786456229 VFAVKSOFEOMAED-OAHLLOKOSA-N 392.490 5.014 30 20 GKED C=CCn1c(SCC(=O)Nc2c(CC)cccc2CC)nc2ccccc21 5619085 QNMXBBJZYUAPQV-UHFFFAOYSA-N 379.529 5.078 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1ccc(C)s1)[n+]1cccc(C)c1 22732054 RNWYPERXGDCOMB-UHFFFAOYSA-O 395.573 5.266 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(CN2CCCC2)cc1 28180182 ZNWZEDIMMZRVSD-UHFFFAOYSA-N 381.479 5.073 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4ccccc4s3)cs2)cc1 41502481 QQHCVOAPHHSSCL-AWEZNQCLSA-N 375.478 5.218 30 20 GKED CCN(C(=O)c1cc(-c2ccccc2Cl)on1)[C@@H](C)c1ccc(C#N)cc1 47446854 CDVOXBGTSMQOTC-AWEZNQCLSA-N 379.847 5.090 30 20 GKED O/C(=N\c1nnc(-c2ccsc2)s1)N(Cc1ccccc1)Cc1ccco1 52496750 LZFMWFZTHVJVDB-UHFFFAOYSA-N 396.497 5.108 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 66954811 NHNJVKHAMZEVJQ-ZIAGYGMSSA-N 389.471 5.584 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ncccc3OCCCC#N)c(F)c2)cc1 106767325 QOUPCUXSZUMJIZ-UHFFFAOYSA-N 389.430 5.131 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 108238286 WTOVDQSNLMDZIG-HNNXBMFYSA-N 380.513 5.157 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 108240977 RMFNMPWQEZQRAG-MRXNPFEDSA-N 377.513 5.381 30 20 GKED COc1ccc(CCCN(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108533068 OGIBEZDKHNQWSF-KRWDZBQOSA-N 397.544 5.043 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3nnc(C)o3)n2)o1 113778815 XDZLMWZXLZDRQH-VIFPVBQESA-N 394.378 5.085 30 20 GKED N#C[C@H](Sc1nnc(S[C@@H](C#N)C2CCCCC2)s1)C1CCCCC1 115184865 FWSWHFVOHQGAAV-HOTGVXAUSA-N 392.619 5.667 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 151043699 RLDZYAYKYJCELG-IEBWSBKVSA-N 394.544 5.047 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1c(C)nn(CC(C)C)c1Cl 159031388 WELVQNDPHFLKEU-GOSISDBHSA-N 399.926 5.050 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)ccc1OC(F)F 164461899 WVIJGXDYECPYSE-VZUCSPMQSA-N 387.426 5.183 30 20 GKED Cc1ccccc1[C@H]1CCCN1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 170984865 GOEYIMSOWBIDCL-LAUBAEHRSA-N 393.556 5.022 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cccc(C#N)c1 181682176 LJKNETUZSONVEL-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](c1ccccc1)c1cccnc1)c1ccc(F)c(F)c1 185475101 PJUDPAXXVNQBMS-VXKWHMMOSA-N 393.437 5.066 30 20 GKED COc1ccc2c(c1)CN(C(=O)Nc1ccc(CC#N)cc1)[C@H](c1ccccc1)C2 186536383 WCGZAFIEPCDEND-DEOSSOPVSA-N 397.478 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)nc2c1cnn2C(C)C 189887453 YCRNMFQQTSGZNU-UHFFFAOYSA-N 376.504 5.425 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1csc2ccccc12 192598589 OJWHBHSOPODUMN-UHFFFAOYSA-N 385.448 5.521 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3c(Cl)cccc3Cl)s2)cc1 192861270 JEGJIRSICVVSQU-UHFFFAOYSA-N 388.279 5.165 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 303336204 XOGDJLMYNVCMLE-IRXDYDNUSA-N 396.556 5.642 30 20 GKED O/C(=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1)c1sccc1Cl 329162337 FYBRPLXIRVXSDA-CYBMUJFWSA-N 395.912 5.190 30 20 GKED O/C(=N\[C@H]1CC12CCCCC2)[C@H]1CC[C@H](/C(O)=N\[C@@H]2CC23CCCCC3)CC1 329256541 AXWDVPLQXMMOSU-HKJRMUSSSA-N 386.580 6.151 30 20 GKED Cc1cc(CC/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)cc(C)c1O 329913131 XDMXSZRNQCXWGZ-FQEVSTJZSA-N 395.547 5.015 30 20 GKED Cc1c(N=C(O)c2cc(C(C)C)nc3c2cnn3C(C)C)cnn1C1CCCC1 329947793 KGEAHHMSUSXUDX-UHFFFAOYSA-N 394.523 5.392 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 410962740 DIHBZDHQDXLKEL-LSDHHAIUSA-N 378.781 5.167 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)CCc1ccc2[nH]ccc2c1 425080316 AZQBZWWPPNBNJC-OAHLLOKOSA-N 399.416 5.060 30 20 GKED Cn1cc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c(C(C)(C)C)n1 426265586 HUTVEQHBBRZZGT-ZDUSSCGKSA-N 398.576 5.054 30 20 GKED COc1ccccc1[C@@H](NCc1cccc(F)c1C#N)c1ccccc1Cl 427433816 GMMSNZIZMPTMLY-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CCCCOc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 432911153 QCPRALOJOPCHKY-QFIPXVFZSA-N 379.504 5.731 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)N[C@H](CCC#N)c1ccccc1 438860370 QHBCKZRSZZXMSD-WMZHIEFXSA-N 375.516 5.604 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccncc1Oc1ccccc1 440475351 DVTIOJYOMBPFEL-INIZCTEOSA-N 389.480 5.378 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)S[C@H](C)c1cccc(C#N)c1 443158786 PTMZFEKJCXZXKI-KGLIPLIRSA-N 388.920 5.350 30 20 GKED CCCOc1ccc(Cl)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444040755 SOSUNEJXICWDFO-UHFFFAOYSA-N 395.890 5.640 30 20 GKED CC[C@H](C)[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 446281384 MIPATUABHAFFCZ-TVYUQYBPSA-N 388.327 5.095 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2cccc(CC#N)c2)C1 455910947 UZNCINXWDYPUNQ-IFXJQAMLSA-N 387.405 5.386 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@@H](C)c3cccc(C#N)c3)c(C)c2)n1 463724441 WTMPXVUKSUUMQB-HNNXBMFYSA-N 393.537 5.525 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCCC2)cc1)c1cc(C(F)(F)F)ccn1 464416150 GMBGJMBMOKFQPF-GOSISDBHSA-N 388.389 5.302 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C4CCC4)c3)n2)cc1 467199479 BBOQGGFHCAVXNZ-FQEVSTJZSA-N 383.476 5.439 30 20 GKED CC(C)(c1ccc(C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1)C(F)(F)F 468947799 KBVNJOLUMIKBPM-UHFFFAOYSA-N 398.331 5.252 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)COc1ccc(F)cc1F 475561628 BZUZVFKTVXVPLN-OAHLLOKOSA-N 388.458 5.406 30 20 GKED C=CCC1(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)CCC1 478666546 HASWNKHCEWLDKR-QGZVFWFLSA-N 377.488 5.254 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2csc(-c3cccc4ccccc34)n2)n1 480911556 KTPOLFKBQKEIFZ-INIZCTEOSA-N 375.478 5.218 30 20 GKED Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NCc1ccccc1C(C)(C)C#N 486447062 OYGRCWJWBLBAFY-IBGZPJMESA-N 389.543 5.423 30 20 GKED C[C@@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487457485 ZSWQFTACRDYBFM-DNVCBOLYSA-N 385.305 5.104 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1OC(C)C 488412896 DSXMXOITNHEVOK-UHFFFAOYSA-N 387.439 5.094 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc(Br)cc1 489140585 QQMVBPINKLELLZ-KGLIPLIRSA-N 375.335 5.874 30 20 GKED C=CCn1cccc1C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 490038373 AKXYGMJRKUYJLV-UHFFFAOYSA-N 377.444 5.342 30 20 GKED FC(F)Oc1cccc(CN[C@@H](c2ccccc2OC(F)F)C(F)(F)F)c1 491261632 VDVHJHABZDYNOP-AWEZNQCLSA-N 397.290 5.283 30 20 GKED CC(C)(CCC#N)CNC(=O)NCc1ccc(OC(C)(C)C)cc1C(F)(F)F 498376195 ROCULQBDFSTSOH-UHFFFAOYSA-N 399.457 5.012 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1c2cccc(F)c2CC[C@@H]1C 498887676 CZAHLDLWXMKYQA-HTAPYJJXSA-N 398.526 5.014 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)N[C@@H](C#N)c3ccc(Br)cc3)oc12 499392954 QCLXCDXXBRHAEV-INIZCTEOSA-N 397.272 5.115 30 20 GKED CCC[C@@H]1C[C@H](C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 503053660 AGDLFMTVOHBJBW-WIYYLYMNSA-N 396.918 5.340 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)c1 504100203 XKFQBZIPMQFYNQ-OAHLLOKOSA-N 379.485 5.258 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(C1CC1)[C@H](C)c1ccccc1 512270110 NOLZUQNKWDZMME-ZWKOTPCHSA-N 393.556 5.245 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3ccccc3n2)cc1 516391302 DMDKIFWEJUGPFU-UHFFFAOYSA-N 395.487 5.651 30 20 GKED Cc1ccc(OCCCCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 517472977 HTIFHCCVQJKAHU-GOSISDBHSA-N 397.544 5.228 30 20 GKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1cccc(C#N)c1 519546075 AYGNWFORTKAJPU-ICJFFHGUSA-N 393.962 5.476 30 20 GKED C=C[C@H](CC(=O)NCc1cccc(Cn2cnc3ccccc32)c1)c1ccccc1 535391312 BIFJNIMGUMHNON-JOCHJYFZSA-N 395.506 5.061 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(C)cc2)ccc1OCc1cccc(C#N)c1 537027535 BOAITTJIFOKROR-IBGZPJMESA-N 386.495 5.305 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCCOc2cc(F)ccc21 539692144 PBEYRUGYAHERFP-JOCHJYFZSA-N 386.426 5.008 30 20 GKED CCOc1ccc(Oc2cc(CN[C@@H](C)c3ccc(C#N)c(F)c3)ccn2)cc1 540709350 LSIFVERLJRAGNV-INIZCTEOSA-N 391.446 5.134 30 20 GKED CSC[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 540992047 QFISRUOIMLEAKF-RTBURBONSA-N 378.463 5.744 30 20 GKED N#CCCC[C@@H](NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccccc1 552084054 LDCHDVSBRUCVFH-OAQYLSRUSA-N 398.432 5.416 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1 553452625 YHLBHGCHXRLHFE-SFHVURJKSA-N 385.389 5.002 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(C(F)F)c2Cl)c1 563780774 NZRZQQGKMXNGEJ-UHFFFAOYSA-N 379.794 5.604 30 20 GKED Cc1c(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)ccc(C(F)(F)F)c1F 564286727 MYWXVHODBCQHIT-UHFFFAOYSA-N 391.246 5.284 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)c1ccccc1 569629085 KGSXORRYKAVCSA-OAQYLSRUSA-N 389.499 5.472 30 20 GKED COc1ccc([C@@H](CCC#N)NCCOc2cccc(Cl)c2Cl)cc1 572587504 OZUONISNEYVGNM-QGZVFWFLSA-N 379.287 5.015 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)F)cc1)c1nc(-c2c(F)cccc2F)cs1 588348916 HLDWBKXNOZGAOH-LBPRGKRZSA-N 390.361 5.516 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(C(F)F)c1 591009078 NPFAEMLIBKSSLL-GDNZZTSVSA-N 389.286 5.264 30 20 GKED C=CCOc1ccccc1CNC(=O)N(CC)[C@H](C)c1cc2ccccc2o1 600897099 WIPRSDDOGLNTTN-QGZVFWFLSA-N 378.472 5.290 30 20 GKED C[C@@H](NC(=O)c1cc2ccccc2n1CC#N)c1cc(F)c(Cl)cc1Cl 609160000 GKPCOHWDSQSJPD-LLVKDONJSA-N 390.245 5.102 30 20 GKED C[C@H](S[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccc(C#N)cc1 609825803 UMOQUWILNZFRFB-SCLBCKFNSA-N 390.430 5.177 30 20 GKED C[C@@H](NC(=O)c1oc2ccccc2c1COc1ccccc1)c1cccc(C#N)c1 610359184 GQWJXGJYWLQKDE-QGZVFWFLSA-N 396.446 5.374 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC[C@](C)(C#N)C3)cc2)cc1 612293646 KDLSGSTYMJPXCN-JOCHJYFZSA-N 379.460 5.035 30 20 GKED N#Cc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1Cl 619748220 BGIWAUUGJPDJOP-UHFFFAOYSA-N 383.860 5.138 30 20 GKED O=C(CCc1ccccc1F)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 622485736 WUVBAVLFWSKHTB-MRXNPFEDSA-N 393.302 5.197 30 20 GKED C#Cc1cccc(N(CC)C(=O)Cc2csc(-c3ccc(Cl)cc3)n2)c1 728480579 CIKRDHOCWRUMGF-UHFFFAOYSA-N 380.900 5.040 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC(c2c[nH]c3ccccc23)CC1 735305705 CPPUSEKJYPQJRZ-UHFFFAOYSA-N 379.891 5.103 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)Cc3csc(-c4ccoc4)n3)cc2)cc1 737466811 ZVHNNRWAFOXZLI-UHFFFAOYSA-N 386.432 5.090 30 20 GKED COc1cccc(CNCc2cccc(-c3ccc(C#N)s3)c2)c1OC(C)C 740013348 FEIKDVQCJNHDQN-UHFFFAOYSA-N 392.524 5.372 30 20 GKED C[C@H](NC(=S)N[C@@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 743059191 BHYZBRMUHQCUMN-RYUDHWBXSA-N 378.328 5.151 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(C=NNc2ccc(F)cc2C)cs1 750938745 NMCNUIRYDRJYSZ-UHFFFAOYSA-N 382.464 5.030 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc2c(c1)C(C)(C)C(=O)N2 759185569 QDZSCXUETZWFAM-UHFFFAOYSA-N 397.693 5.108 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)c1 772982662 DSCVJSKAVWCBPO-LIRRHRJNSA-N 375.299 5.451 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCc2c(Cl)cccc21)c1nc2cc(Cl)ccc2s1 776080793 JGDBJWYSYNUJOK-ZIAGYGMSSA-N 387.291 5.509 30 20 GKED C=CCc1cc(CN[C@H](C)c2cc3cccc(OC)c3o2)cc(OC)c1OC 776163997 NJPUDSDWICATES-OAHLLOKOSA-N 381.472 5.038 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2cc3ccccc3o2)C(C)C)ccc1OC 776309682 LOYMBDXGXDXHSE-DVECYGJZSA-N 392.499 5.609 30 20 GKED CCc1noc(C2CCC(=NNc3nc(Cl)c(Cl)cc3Cl)CC2)n1 778540696 WTYFJUCOYAYGAD-UHFFFAOYSA-N 388.686 5.113 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cccc(-c2c(F)cccc2F)c1 780153719 YCFMHXZMQNPEOV-AWEZNQCLSA-N 378.378 5.175 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1nc(Br)ccc1F 794964688 HJOKIAVCBOXDTO-HYXAFXHYSA-N 395.278 5.064 30 20 GKED CCCNc1ccc(C#N)cc1NCc1csc(-c2ccccc2OC)n1 795265802 DCOXWMVVBSSBLA-UHFFFAOYSA-N 378.501 5.124 30 20 GKED N#CC[C@@H](CC(=O)OCc1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 795985479 LEDQUOZMEILKCF-NRFANRHFSA-N 398.462 5.070 30 20 GKED N#CC[C@@H](CC(=O)OCc1cc(-c2ccc(Cl)cc2)no1)c1ccccc1 795989388 FZBGFGLJKRRIMC-KRWDZBQOSA-N 380.831 5.126 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](c3cccnc3)C(C)C)n2)cc1 797943980 ZEHXDFOIAQRKEA-AZUAARDMSA-N 375.497 5.130 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCCc3c2[nH]c2ccccc32)ccc1OC 808705860 UXMFJOCZIGRRJI-DYESRHJHSA-N 389.499 5.025 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(Cl)c2F)cc1 810114544 CLKRRFPIIAALOP-LJQANCHMSA-N 378.834 5.316 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)cc1 810160359 DSDCTULZWRBHOH-RNODOKPDSA-N 375.299 5.525 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc([N+](=O)[O-])c3Cl)c2)cc1 813246716 OMXASHWIKSUMQJ-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(-c2ccc3sccc3c2)no1 818385737 XWTMYFITIOICFY-OAHLLOKOSA-N 398.488 5.211 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N(Cc3ccc(C#N)cc3)C3CC3)sc21 914438923 ZLFSWGUJWDLJMO-UHFFFAOYSA-N 385.492 5.069 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccc(Cl)cc2)cc1 916948217 FDUOHLHYWFQYRT-FOIQADDNSA-N 382.891 5.134 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC(F)(F)F 918041596 PLTUSMPFIWEFIT-UHFFFAOYSA-N 396.434 5.527 30 20 GKED FC(F)(F)c1ccc(-c2nc(C=NNc3nncc4ccccc34)cs2)cc1 918707747 DLGMZSYKCZWLFB-UHFFFAOYSA-N 399.401 5.218 30 20 GKED C=C(C)C(=O)OCCCCCCOc1ccc(N=Nc2ccc(OC)cc2)cc1 1083680886 HWMJTYVELYOWLU-UHFFFAOYSA-N 396.487 6.169 30 20 GKED O=C(O)c1ccc(NN=Cc2nc(-c3cc(Cl)ccc3Cl)cs2)cc1 1776013347 RRNUUMWGAPEMLV-UHFFFAOYSA-N 392.267 5.261 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(SC2CCCC2)cc1 1776049769 APZKWMSDLCTWPG-UHFFFAOYSA-N 384.501 5.264 30 20 GKED CCC(=NNc1ccc(Cl)c(C)c1)c1ccc(OCCCCC(=O)O)cc1 1776104866 CNIMFENICVLPNV-UHFFFAOYSA-N 388.895 5.508 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC3CCC2(C(=O)O)CC3)cc1 1776787534 ROOKYCMAODVHKZ-UHFFFAOYSA-N 389.561 5.219 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(/C=C\C(=O)O)o1 1777487700 GLEGCRPDGCNXFC-GOOGBFEESA-N 399.855 5.359 30 20 GKED Cc1sc(NC(=O)c2ccc(C#N)cc2)nc1-c1ccc(Br)cc1 6375915 YONNXFGOEUGRSO-UHFFFAOYSA-N 398.285 5.005 30 20 GKED N#Cc1ccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)cc1 11367383 ATDTVUPCGATVRM-UHFFFAOYSA-N 386.238 5.091 30 20 GKED Cc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1[N+](=O)[O-] 46444696 SXTJQRPUTCFALR-OAHLLOKOSA-N 397.843 5.170 30 20 GKED N#C[C@@H](C(=O)c1cn(Cc2ccccc2)c2ccccc12)c1nc2ccccc2[nH]1 47359126 ZYZWEGPALHPCPW-IBGZPJMESA-N 390.446 5.056 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1cccc(Br)c1 59269314 XXJGHSQOCNIROQ-ZHACJKMWSA-N 394.268 5.319 30 20 GKED C[C@H](NC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)c1ccc(C#N)cc1 65724727 AIOAAKHTNRPLQQ-KSFYIVLOSA-N 390.870 5.209 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)Nc2cc(C#N)ccc2OC(C)C)c(C)c1 65839643 ZJSKLOQJKDHZOW-UHFFFAOYSA-N 392.499 5.262 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4c(s3)CCCC4)n2)cc1 66544868 RENOANHFUKEOBT-MRXNPFEDSA-N 389.505 5.112 30 20 GKED C=CCN(C(=O)CCc1ccc(Cl)s1)c1nc(-c2ccccc2)cs1 107835904 XFAPBPYWRIGIDO-UHFFFAOYSA-N 388.945 5.677 30 20 GKED COc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108532618 YHCDTAXVGPIWPZ-JXFKEZNVSA-N 395.528 5.316 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(Cl)c(C(F)(F)F)c2)c1 113961261 CTHXGFZUMMGQJQ-OAHLLOKOSA-N 382.813 5.330 30 20 GKED C=C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 120031243 CEUSBZJEYOKMOY-PXNSSMCTSA-N 383.476 5.218 30 20 GKED Cc1ccc(C(=O)Nc2cc(C#N)ccc2C)cc1NC(=O)Nc1ccccc1 125935997 FJPBDKRTDZAURD-UHFFFAOYSA-N 384.439 5.071 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1Oc1cccnc1)c1cccc(Cl)c1Cl 157894209 MCTINTMDYXFVIV-QGZVFWFLSA-N 398.249 5.175 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 159280540 QCFWIPJMJMAZSS-QFBILLFUSA-N 382.533 5.338 30 20 GKED N#CC1CCN(C(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1 162368920 JPALDARVNURTKV-UHFFFAOYSA-N 377.246 5.175 30 20 GKED CC(C)CN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@H]1CCCc2cccnc21 164582985 HKOYOWWPVJRQBG-VXKWHMMOSA-N 390.531 5.172 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc(C(F)F)c2)cc1 170636337 MDRDGGVNCXVRQI-UHFFFAOYSA-N 394.446 6.040 30 20 GKED C[C@H](CN(C)C(=O)c1ccccc1Sc1ccccc1C#N)c1nccs1 184885220 RSLGEBVSCWTFQD-OAHLLOKOSA-N 393.537 5.042 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(C)C)nc2onc(C)c12 189899120 YRZGMWGEVXBTJM-UHFFFAOYSA-N 377.488 5.759 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCCOc1cccc(C#N)c1 189906886 DOQCGHYOXUGLSD-UHFFFAOYSA-N 376.500 5.598 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@H](CO)C1CC1 191421576 QTWQVLUIGKSUQX-HSZRJFAPSA-N 392.543 5.344 30 20 GKED COc1cc(O[C@@H](C)c2nnc(-c3ccc(Cl)c(Cl)c3)o2)ccc1C#N 194496346 CNQYPNOFSBNRDG-JTQLQIEISA-N 390.226 5.064 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2nnc(-c3ccccc3Cl)s2)c1 302180649 ZFQVBZWVZYQDDM-CQSZACIVSA-N 384.892 5.152 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3C3CCCC3)cc2)c1 303310110 FJVVMAIAZOIXSO-QFIPXVFZSA-N 375.472 5.537 30 20 GKED C[C@@H](c1ccc(Oc2ccccc2)cc1)S(=O)(=O)CCCCC(C)(C)C#N 414432063 YWBMCTHGEUCYLX-SFHVURJKSA-N 385.529 5.675 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)n[nH]2)c(C)c1 426994176 FYCZCQUDUNMLDB-INIZCTEOSA-N 390.512 5.340 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nnc(Cc3ccccc3)n2-c2ccc(Cl)cc2)C1 430097204 GTFAHGJFACAWSW-QFBILLFUSA-N 394.931 5.296 30 20 GKED Cc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(Br)c1 432746929 GKXOEBIUOKVQGV-QGZVFWFLSA-N 386.293 5.314 30 20 GKED Cc1nc2ccc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc2s1 433121931 PCIVJACSVPOGPT-GFCCVEGCSA-N 383.885 5.358 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(OCc2ccccc2)CC1)c1ccccc1 435103426 ZMHBIUSVEYGEIE-QHCPKHFHSA-N 378.516 5.085 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N(CC)C[C@H](C)C#N 435527728 SWSIMAAQRKRUKC-GFCCVEGCSA-N 394.302 5.223 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)c1nc2ccc(Cl)cc2s1 436452089 MIYMBRDHZDWBIV-UHFFFAOYSA-N 399.903 5.033 30 20 GKED CS[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 437477758 UNFHSIMEIMFZAG-OAQYLSRUSA-N 392.455 5.532 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC[C@H]1c1ccccc1 438639299 VSLXUBGIZCLHDJ-KBXCAEBGSA-N 387.405 5.235 30 20 GKED C[C@H]1c2ccccc2O[C@H]1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438645281 XMSHWPKEQKGQGT-DXEZIKHYSA-N 395.528 5.156 30 20 GKED CSCCCN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 439344643 GGTIVCDFUYSWMA-SFHVURJKSA-N 387.936 5.212 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(CCC(F)(F)F)cc1 440299630 XKQHPVPXCUFMIH-UHFFFAOYSA-N 392.421 5.410 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] 440717570 LHZAJRHKTKYWJJ-UHFFFAOYSA-N 389.436 5.178 30 20 GKED C[C@H](CNC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 443190328 MWPXAPZIWMNOFZ-DNVCBOLYSA-N 389.421 5.153 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c(Cl)c1 444810583 FLJFENXUKKWLLF-OAHLLOKOSA-N 377.168 5.397 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 448938488 ROMSXNGHZUMWFL-SNVBAGLBSA-N 398.372 5.628 30 20 GKED CCCn1ncc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1C1CC1 455752669 LXQUCNNUCRPDEG-UHFFFAOYSA-N 399.498 5.031 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC1CCC(C(F)F)CC1 458147661 PMNGVTCXHPNTDB-UHFFFAOYSA-N 386.467 5.263 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1 464157984 MSHGOVVCRNGRNH-QHCPKHFHSA-N 376.456 5.070 30 20 GKED C[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(F)cc1F 464884129 GJBNFWWQZSDSKU-HNNXBMFYSA-N 376.406 5.037 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](c1cccc(SC)c1)c1cc(F)ccc1F 466242112 FCZUAFQOFGLIFO-HXUWFJFHSA-N 388.483 5.160 30 20 GKED CC[C@H]1CN(C(=O)CCCCOc2cccc(C#N)c2)CC[C@@H]1c1ccccc1 470014233 WYHWYXJHKRKFED-URXFXBBRSA-N 390.527 5.150 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccn2)cc1 471178267 NECXAJNQKXGALP-JOCHJYFZSA-N 384.483 5.102 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)SCCCOc1cccc(C#N)c1 477346198 DPCYASVXFVNKPI-QGZVFWFLSA-N 396.556 5.212 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C 482231031 KIGNPXAVUNWEJW-WZONZLPQSA-N 379.548 5.351 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Sc2ccncc2)cc1 485512900 IUJXDFRAAHARIX-UHFFFAOYSA-N 378.522 5.763 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 487571629 XUGZZNTXROLLJD-QGZVFWFLSA-N 380.797 5.524 30 20 GKED Cc1ccccc1[C@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)C1CC1 491108724 HIKFNVYDALZUOZ-HSZRJFAPSA-N 375.516 5.186 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)C[C@@H](C)C2 492092849 CRLMFUQJWKEGGH-FXBHHXAOSA-N 399.494 5.326 30 20 GKED Cc1cccc([C@@H](NC(=O)c2sc3ccc(C#N)cc3c2C)c2ccccn2)c1 494414202 SPKCNWDUOQXPKC-JOCHJYFZSA-N 397.503 5.304 30 20 GKED CCN(CCCC1(C#N)CCOCC1)[C@@H](C)Cc1ccccc1C(F)(F)F 499775359 UBAOBCAKVJFOQT-KRWDZBQOSA-N 382.470 5.059 30 20 GKED CCCN(CCc1cccc(F)c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 503220321 AZDBMISVNADGIC-QGZVFWFLSA-N 399.535 5.707 30 20 GKED CCOc1ccc([C@@H](NC(=O)Nc2ccc(CC#N)cc2)c2ccccc2)cc1 505535699 HLSVDEHGYKIPQC-QHCPKHFHSA-N 385.467 5.062 30 20 GKED CC(C)N(C)Cc1ccccc1CNC1CCC(C#N)(c2ccccc2)CC1 507637343 PIRPDQCFURQWFH-UHFFFAOYSA-N 375.560 5.021 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccc(Oc4ccccc4)nc3)c2C#N)C1 514450615 FHBGALFFYHNFSR-CQSZACIVSA-N 389.480 5.184 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 518832276 DETVJSGHWJYIGZ-CHWSQXEVSA-N 392.299 5.223 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(Cl)c(Cl)c1 520807996 XQWRVXBKLUUCEF-UHFFFAOYSA-N 379.312 5.570 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2cccs2)n1)c1cccc(Cl)c1Cl 520889838 UTPVGYOBTQAEAM-NSHDSACASA-N 394.308 5.173 30 20 GKED N#C[C@H](NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1cccc(C(F)(F)F)c1 521016245 UQFWQIWZOYJVEQ-FQEVSTJZSA-N 397.400 5.060 30 20 GKED CC[C@](C)(C#N)NC(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 523355550 DJJXFPLCTCEHPB-HSZRJFAPSA-N 387.439 5.088 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)sc1SCC#N 524105119 QZEFEPOQZZHMAK-WDEREUQCSA-N 398.340 5.116 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(Cl)c2c(c1)OCCCO2 531391283 IQRRKNGPHOMJEG-CQSZACIVSA-N 388.920 5.508 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N(C[C@H](C)C#N)C2CC2)cc1F 533132425 LIVYMAGHGGIDDZ-OAHLLOKOSA-N 397.450 5.091 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cccc(Cl)c1 533485780 PBLGTZRQKMFSGI-HNNXBMFYSA-N 387.936 5.057 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F)OCC 533764178 SFNYKJLPKQGXQO-SUMWQHHRSA-N 389.483 5.906 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3c(F)cc(Cl)cc3F)c2)cc1 540449070 TXEXUPDEHVCZDE-UHFFFAOYSA-N 398.796 5.321 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1cccc(Cl)c1C#N)c1cc2ccccc2o1 542102710 NFDJXPYZBYBLDB-QWHCGFSZSA-N 384.888 5.316 30 20 GKED N#Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1Cl 548278762 ABQIJNJUEBYQBU-UHFFFAOYSA-N 395.827 5.440 30 20 GKED N#Cc1ccc(CN(Cc2cccc(C(F)(F)F)c2)Cc2ccccn2)s1 563632386 ZVNPZDNPANCYNL-UHFFFAOYSA-N 387.430 5.236 30 20 GKED C[C@@H](SCC1(C#N)CCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 565647764 NEWLZIRIFZQEON-SNVBAGLBSA-N 376.831 5.113 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc(Cl)sc3Cl)cc2)ccn1 566534334 BTCHCRJYTGFQFX-UHFFFAOYSA-N 390.251 5.366 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 576993351 SUQTWWWZXRJJJR-INIZCTEOSA-N 378.472 5.383 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1csc(-c2ccccc2)n1 588337923 XKUZITKBRBFOEI-RBUKOAKNSA-N 388.496 5.114 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 608866981 YAGCDLHQOTXUNE-UHFFFAOYSA-N 386.260 5.183 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 608919015 YRIWNHPXPNDYPI-LJQANCHMSA-N 399.947 5.369 30 20 GKED CCc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609061230 WWNDNLRZASOQQL-UHFFFAOYSA-N 376.481 5.322 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(C(F)(F)F)c1 609460406 KVLUREWZDMKFBI-CQSZACIVSA-N 378.350 5.054 30 20 GKED CC(C)(NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 609744370 APSPLXNAIIJVMO-UHFFFAOYSA-N 377.469 5.469 30 20 GKED CCN(C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 609967726 ASFGIZFGLAACFI-JKSUJKDBSA-N 388.433 5.365 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1ccc(Oc2ccccc2)c(F)c1 612103154 WTVUOVCFRFDVEP-ZHRRBRCNSA-N 381.451 5.014 30 20 GKED C=CCOc1ccccc1C(=O)N1CCC(Oc2ccc(C(C)C)cc2)CC1 612575392 ITUAAYOCDOIOPN-UHFFFAOYSA-N 379.500 5.058 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)o2)cc1 613290948 PQFYGGAUZDSWBZ-LJQANCHMSA-N 380.403 5.187 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 614395633 OJXDNBIOHNBVOI-UHFFFAOYSA-N 387.464 5.276 30 20 GKED O=C(Cc1cccc(C(F)F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 619126861 OULDUMHKVIHTOG-UHFFFAOYSA-N 391.302 5.337 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cc(F)ccc1Cl 622485347 LLLJMXXZXOGOIO-CYBMUJFWSA-N 399.693 5.531 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2cccc(Br)c2Cl)cc1 630062353 JOLORUKYVNYDNM-UHFFFAOYSA-N 394.700 5.022 30 20 GKED C=CCn1c(S[C@@H](C(=O)c2ccccc2)C(C)C)nnc1-c1ccoc1C 643092528 WYFIDVZPAXLLRT-LJQANCHMSA-N 381.501 5.032 30 20 GKED C=C(C)Cn1c(-c2ccccc2)nnc1N1CCC[C@@H](c2nc3ccccc3o2)C1 670198872 ONRYXNJWLJLPHM-LJQANCHMSA-N 399.498 5.046 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](CO)c1ccc(Cl)cc1 672744573 MXAOBSOMIJPXFE-SFHVURJKSA-N 386.923 5.090 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1sc(C(C)(C)C)nc1C 727262534 SYRBCEFXYYLJCL-UHFFFAOYSA-N 385.455 5.526 30 20 GKED Cc1cccc(C2(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)CCCC2)c1 730416996 JNSDHSIZAKRVFE-QGZVFWFLSA-N 378.472 5.432 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)n1C 731332705 QBVHJWQZZHOCCX-OAHLLOKOSA-N 393.487 5.478 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 731989099 PLCSMXBMEDFUCH-UHFFFAOYSA-N 380.447 5.193 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)c2cccc3ccccc23)c1 733845546 DLEHTLJDNBURLK-FXAWDEMLSA-N 387.483 5.081 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1)c1ccncc1 734458031 SGEGDNCTFAULRH-GOSISDBHSA-N 399.516 5.175 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(O[C@@H](C)C#N)cc2)cc1 742376094 MHTVDGXXGUXCNH-OALUTQOASA-N 386.495 5.504 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1ccccc1)C(=O)c1ccccc1 747150601 RESNNPONDCTDFJ-NKFKGCMQSA-N 383.491 5.716 30 20 GKED CC(C)N(C(=S)Nc1ccc(OC(F)(F)F)cc1)c1cccc(C#N)c1 749766957 GRMXLVOQBQBQAJ-UHFFFAOYSA-N 379.407 5.069 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)ON=C(c1ccccc1)C(F)(F)F 751965514 NTTDMWPQLLYACZ-CQSZACIVSA-N 392.421 5.122 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)co1 752882618 NVMPHLWWMKUNAD-ZHACJKMWSA-N 398.466 5.001 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)c1 753678031 FCJQEHKQUOPRGV-ZJSXRUAMSA-N 389.474 5.089 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2nc(Cl)cs2)CC3)cc1 759085280 UUQYHWQUWNRFOR-DHZHZOJOSA-N 388.901 5.141 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1nc(-c2ccccc2)no1 768498721 DWJJXXHNZTUFLM-QGZVFWFLSA-N 396.450 5.360 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)c(Br)c2)c1 772984276 PKEYKSGPOBIMQW-CZUORRHYSA-N 391.284 5.120 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Cl)c(N)c(Cl)c2)c1 774450276 SZFUCRYMLJIVAG-SWLSCSKDSA-N 378.303 5.107 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC2CCC2)c2ccccc2)c1 778669771 KOGBARYNRAUNDU-GMAHTHKFSA-N 391.515 5.098 30 20 GKED N#CC1(COC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)CCCC1 780534875 UONIHWAEZSQQJK-UHFFFAOYSA-N 381.284 5.358 30 20 GKED N#Cc1cccc(COc2cccc(/C=C\C(=O)c3ccc(C#N)cc3F)c2)c1 781108400 PVOMZIMHGQFIJR-NTMALXAHSA-N 382.394 5.044 30 20 GKED N#C[C@@H](C(=O)C12CCC(CC1)C2)c1nc(-c2ccc(Cl)cc2Cl)cs1 784834217 ZVOGSOCWVWQZQF-MWCFJMDPSA-N 391.323 5.873 30 20 GKED N#Cc1cccc(COc2ccc(NCc3scnc3C3CC3)cc2Cl)c1 787268532 SXYCKBGXBCKMKH-UHFFFAOYSA-N 395.915 5.737 30 20 GKED Cc1cc(C)c(N2CC[C@H](Nc3ccccc3SC[C@H](C)C#N)C2=O)c(C)c1 788689875 DYELORKDZQEZIQ-UZLBHIALSA-N 393.556 5.081 30 20 GKED N#CCOc1ccc(C(=O)/C=C/c2cnc(-c3ccc(Cl)cc3)s2)cc1 789130494 OVCQUSKTFDCKHW-MDZDMXLPSA-N 380.856 5.262 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)c(C#N)s1 790965662 DRFQASJCTIEMAM-UHFFFAOYSA-N 387.814 5.237 30 20 GKED N#CCOc1cccc(CC(=O)N[C@@H]2CCCCC[C@H]2c2ccc(Cl)cc2)c1 791234482 KLRSZKHPMPJSOM-FCHUYYIVSA-N 396.918 5.018 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1nccc2ccccc12 792093074 UOGUSGDGGHXRIH-QHCPKHFHSA-N 384.479 5.365 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1)c1nccc2ccccc12 792101560 OETZRHOYFHIOSV-KRWDZBQOSA-N 395.289 5.840 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3CC(c4ccc(F)cc4)C3)n2)cc1 796762846 KEUVMIOXLOWRTE-AFMYVXGZSA-N 390.483 5.628 30 20 GKED COc1ccc(-c2cc(NCc3ccc(C#N)c(F)c3)ccc2OC(F)F)cc1 797853909 NUTMCBOJGHAPHZ-UHFFFAOYSA-N 398.384 5.586 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2cccc(C)c2)c2cccc(F)c2)c1 800973829 AHXHSMWFXHNCPO-UKILVPOCSA-N 388.486 5.694 30 20 GKED Cn1c([C@@H](C#N)C(=O)C2(Cc3cccs3)CCCCC2)nc2ccccc21 810520618 YRVGKMHYLSKKOO-KRWDZBQOSA-N 377.513 5.004 30 20 GKED N#C[C@@H](C(=O)CC1(CSc2ccccc2)CC1)c1cc(C(F)(F)F)ccn1 813218710 RZZGNZAFQHDWOC-MRXNPFEDSA-N 390.430 5.239 30 20 GKED CC(C)(C)OC(=O)N[C@@H](C=NOc1ccccc1C(F)(F)F)CC1CCC1 814888347 WBZQASMLJDHJJH-CQSZACIVSA-N 386.414 5.154 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C/c1c(Cl)ccc(Cl)c1Cl 817926224 BAVIJNYISQAEDX-KPKJPENVSA-N 375.708 5.149 30 20 GKED Clc1ccc(-c2cc(CON=Cc3ccc(Br)cc3)on2)cc1 913029308 APZQUDCNGSORKD-UHFFFAOYSA-N 391.652 5.308 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(Cl)cc2Cl)cc1 915087106 QGDUMROUWMEZFV-QGZVFWFLSA-N 399.252 6.040 30 20 GKED COc1cc(C(=O)/C=C\c2csc(-c3ccccc3)n2)ccc1OC(F)F 916126926 QMRJLVYVNAOLTF-HJWRWDBZSA-N 387.407 5.316 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccccc2Cl)cc(Br)c1O 916135408 ZGJKGSWIVBHRRW-FPLPWBNLSA-N 381.653 5.103 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCOc3ccc(C)c(C)c3)n2)cc1 916974386 JWQHUTHTYXIPCG-FQEVSTJZSA-N 390.508 5.381 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(CSCC)cc2)cc1 918486449 CPNGTYPPFGGNBY-NRFANRHFSA-N 394.540 5.243 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3[C@@H](C=C(C)C)C3(C)C)n2)cc1 920139385 SQKIDSNZYLXOIJ-ZHALLVOQSA-N 380.513 5.233 30 20 GKED CC(CCc1cccc(C(F)(F)F)c1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033363 QYCSPQYSVWFVII-UHFFFAOYSA-N 384.785 5.478 30 20 GKED CCC(=NNc1ccc(F)c(C(=O)O)c1)[C@@H](C)c1cccc(Br)c1 1776064659 YDSASQGRTHYOOQ-NSHDSACASA-N 393.256 5.268 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2cccc(Cl)c2C(F)(F)F)c1)C(=O)O 1776471343 LRCUTDBKJXYABS-FBOQAHMBSA-N 398.764 5.107 30 20 GKED CCCCCCCOc1cccc(CNCCCC[C@@H](CCC)C(=O)O)c1 1776788725 TXPPMMZMOAPPRF-OAQYLSRUSA-N 377.569 5.797 30 20 GKED N#Cc1ccccc1NC(=O)c1sc2cc(Br)ccc2c1Cl 20501706 HGHWBVYRPAQNLN-UHFFFAOYSA-N 391.677 5.441 30 20 GKED CCSc1nnc(/N=C(\O)c2cc(-c3ccc(OC)cc3)c(C)s2)s1 24002579 XSSLITKXHVOOKN-UHFFFAOYSA-N 391.543 5.332 30 20 GKED CC(C)c1ccc(N/C(S)=C(/C(=O)c2ccc(F)cc2)[n+]2ccccc2)cc1 28605846 GQQGVFAEPKFRHR-UHFFFAOYSA-O 393.507 5.288 30 20 GKED Cc1noc(C(C)C)c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 41514424 ZEJVDAKSBQYWQJ-CQSZACIVSA-N 385.876 5.373 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(C)c1 60127420 WKAHFNJPXSFKEL-SFHVURJKSA-N 385.467 5.407 30 20 GKED O=C(O)CCOc1cccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)c1 60212530 UPDBBLYAOFPELQ-QPJJXVBHSA-N 399.657 5.396 30 20 GKED CCCc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 63236009 PIPJOCOEDBELCQ-HNNXBMFYSA-N 388.414 5.758 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1cccc(CN2CCCCCC2)c1 64237941 RAEPZMHEBQGXEW-UHFFFAOYSA-N 397.588 5.022 30 20 GKED CC[C@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1c(C)noc1C 104417984 KMKGYAPTZZIVSI-FQEVSTJZSA-N 375.428 5.088 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(Cl)cc2)n1 105917977 UKGFEZGUTPAXOP-UHFFFAOYSA-N 395.915 5.388 30 20 GKED N#CCCn1cc(CNCc2ccc(Cl)cc2Cl)c(-c2ccccc2)n1 120227360 RKYNLVKOOYWWMO-UHFFFAOYSA-N 385.298 5.060 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N(CCC#N)CC(C)(C)C)cc2)cc1 125303755 ULFFWENKEMHEEB-UHFFFAOYSA-N 378.472 5.083 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1ccc(C#N)cc1 126846036 XUBZGGMUSOGNPV-HNNXBMFYSA-N 376.485 5.215 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 132833676 PREXIJXPLZOFMM-AWEZNQCLSA-N 375.428 5.088 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cccc(CC#N)c3)c(C)c2)n1 171161393 KUOKYCZABFMYHD-UHFFFAOYSA-N 379.510 5.230 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H]2CCCC[C@H]2C1 176966781 YMJDVULPHHJRTO-SFTDATJTSA-N 389.499 5.100 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(NC(=O)c2ccccc2)c1 182566447 IGVOCSXJMBSJRQ-IBGZPJMESA-N 397.522 5.591 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)c(F)cc1Br 189872838 FPONFQGEHKRPKW-UHFFFAOYSA-N 394.259 5.832 30 20 GKED C[C@H](SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1)c1cccc(C#N)c1 190780705 LTMJFYZQOJZTHE-LBPRGKRZSA-N 393.493 5.111 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1 191433373 XYMFCQCAHFHRRE-WMZHIEFXSA-N 392.543 5.828 30 20 GKED C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 246693444 ISFGIVSLIGMGJC-YRNRMSPPSA-N 397.519 5.692 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)/N=C(/O)C1CCC(=O)CC1 329903911 QPSLTWLAICNNGH-LLVKDONJSA-N 376.909 5.549 30 20 GKED N#Cc1cccc(Cl)c1N1CCC[C@@H](c2n[nH]cc2N=C(O)C2CCCC2)C1 330048028 JUDJXEUGVLSKGC-MRXNPFEDSA-N 397.910 5.097 30 20 GKED COC1(C/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CCC(C)CC1 330061169 NWWCESMOOCNEHP-YZOUICBYSA-N 387.568 5.045 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 429929161 SNZRSRORJYXPKB-OAQYLSRUSA-N 392.911 5.475 30 20 GKED N#CC1CCN(C(=O)Nc2ccc(Cl)cc2-c2cccc3ccccc23)CC1 433841468 KRIAOJWCVPQVSH-UHFFFAOYSA-N 389.886 5.928 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3cncn3Cc3ccccc3)c2)cc1 438313029 CVTWNNMKHVNYCC-UHFFFAOYSA-N 380.451 5.207 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3[C@H]4CCC[C@H]3CC4)cc2Cl)c1 438598361 JUBVBRTXDRJIAA-OALUTQOASA-N 395.890 5.339 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)cc1C(F)(F)F 438646268 ZOMMMVJIPNGKBM-QGZVFWFLSA-N 393.796 5.599 30 20 GKED Cc1cc(F)ccc1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 454754294 NLKFMMVSNKEOOB-FOIQADDNSA-N 397.519 5.755 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 467159298 GLHRXKNHQSXVPK-MLGOLLRUSA-N 395.812 5.458 30 20 GKED COc1ccc(-c2nc(NC(=O)C[C@H](CC#N)c3ccccc3)sc2C)cc1 474396492 VZFMGSXROOVZCS-SFHVURJKSA-N 391.496 5.153 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474701619 GQCCSPFAGACWTJ-GOEBONIOSA-N 375.299 5.600 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1ccc(C)cc1 481379869 YLFXOLCNSQQJLM-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC1(C)CN(C(=O)c2ccccc2-c2ccccc2C#N)CC[C@H]1C(F)(F)F 482051225 FDVRDAMRRVASQO-LJQANCHMSA-N 386.417 5.276 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4c(c3)CCCC4=O)n2)cc1 496028032 KPBUYOSQVWJGRN-IBGZPJMESA-N 386.476 5.128 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(Oc2ccncc2)c1 496190638 TYXPXKPVRIADOG-UHFFFAOYSA-N 384.888 5.417 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 503227005 UQWCIRBXXFRQQC-WZONZLPQSA-N 393.556 5.524 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 505324756 JOYLZQBCERVQGX-INIZCTEOSA-N 387.439 5.242 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1cccc(C(F)(F)F)c1 505981992 ORYOWBVMJKNJHN-FQEVSTJZSA-N 397.400 5.014 30 20 GKED O=C(Nc1c(F)cccc1F)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 506286255 RDAHHYIVTCCEKU-ZDUSSCGKSA-N 398.253 5.409 30 20 GKED N#CCCn1cc(CN2CCC[C@@H]2/C=C/c2ccccc2)c(-c2ccccc2)n1 507872466 CKBPUCPUHOWZNC-DKUDOZJNSA-N 382.511 5.142 30 20 GKED CCCN(CC1CC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510007375 XOFFBLODBITPOZ-HXUWFJFHSA-N 381.907 5.649 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510704469 VBGQYKGERDPGAT-INIZCTEOSA-N 389.430 5.715 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)cc1 511771508 IWKSWBFTKRFELC-RUZDIDTESA-N 386.495 5.507 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1 512522139 OTRAVUCKTPFQQK-KRWDZBQOSA-N 397.498 5.101 30 20 GKED CC(C)OCc1ccccc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 517471966 OCUUBFQUTZZZOC-KRWDZBQOSA-N 397.544 5.185 30 20 GKED Cc1cc(C)cc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 518130899 ARKOMNZWBSVJIF-KRWDZBQOSA-N 384.570 5.570 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@@H](C)C#N 520856456 FYAXOLBIUGTGQF-HNNXBMFYSA-N 387.936 5.646 30 20 GKED CC(C)(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521093914 LPGXZLPTWVKZAM-PMACEKPBSA-N 377.488 5.080 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 522073342 FKYNFIXWAJQZCX-UHFFFAOYSA-N 389.886 5.189 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)Nc1ccc(CC#N)cc1 523024576 PMINGTAPLFGRNP-HXUWFJFHSA-N 375.497 5.228 30 20 GKED COCc1ccccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534173815 PIPGQILHCBXNHR-UHFFFAOYSA-N 392.842 5.403 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)c3ccc(C4(C#N)CC4)cc3)CC2)cc1 537427232 MZRBIEWZZDOZLU-UHFFFAOYSA-N 388.511 5.049 30 20 GKED C[C@@H](Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1cccc(C#N)c1 537531496 QFOBUAQSZJFXAV-LJQANCHMSA-N 395.506 5.253 30 20 GKED CC(C)(C)c1nn(Cc2ccccc2)cc1CN[C@@H](CCC#N)c1ccccc1 539527684 TVJLUPYAHMIBPA-QHCPKHFHSA-N 386.543 5.364 30 20 GKED Cc1ccc(-c2ccc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)s2)o1 541035919 HRVUKORLBHAAEX-ROUUACIJSA-N 376.481 5.229 30 20 GKED CC(C)c1ccc(NC(=O)C[C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 551206109 PPYZCRKUTPSDOA-XXBNENTESA-N 377.532 5.552 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)cn1 558271745 IPIMDXULQFIQPK-JKSUJKDBSA-N 375.447 5.180 30 20 GKED N#CC1(N(C(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)C2CC2)CCC1 560117225 NIILDEQBSQITJJ-UHFFFAOYSA-N 388.439 5.067 30 20 GKED Cc1oc(C(C)C)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 560544860 JYAIAEXUODTRGB-QGZVFWFLSA-N 375.453 5.197 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CCc1ccc(Cl)c(Cl)c1 561240940 NMUHVICSQPHPJE-UHFFFAOYSA-N 394.346 5.308 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(F)c2)CCCCC1 563267853 IEMFPMREDVFGHF-QGZVFWFLSA-N 396.531 5.918 30 20 GKED CCSc1cccc(F)c1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 575959928 PARLVGXBFPXXCI-UHFFFAOYSA-N 381.476 5.131 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)sc12 576785898 BYZVFZDUNMALKL-ZDUSSCGKSA-N 381.407 5.445 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc(-c4ccccc4)ns3)cc2)ccn1 580806458 POAADCBVKNQLMY-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CCc3sc(Cl)cc32)c2ccccc21 582333057 TUCAFMUQNPCEDW-MRXNPFEDSA-N 383.904 5.077 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c2n[nH]cc2c1 588349141 YDRVHCFEVVXEQT-MRXNPFEDSA-N 392.871 5.138 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccs3)cc2)ccn1 589363514 RLLFFUTWZRLELY-LJQANCHMSA-N 390.468 5.176 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1Cl 589646725 KFICEUWWBDQBBG-LEWJYISDSA-N 375.871 5.054 30 20 GKED CCCCCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 592973888 KVVFWFCPDAXAAK-KRWDZBQOSA-N 382.460 5.494 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2cc(F)ccc2s1 592974468 YOODQYGYEJKUGR-AWEZNQCLSA-N 380.375 5.325 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c(Cl)c2ccccc21 592974662 WQYMVIWOGZYQHE-LBPRGKRZSA-N 383.835 5.071 30 20 GKED COc1cccc(C2(NC(=O)Nc3ccccc3SC[C@H](C)C#N)CCC2)c1 596733448 GZKPQECAHCMLIL-MRXNPFEDSA-N 395.528 5.148 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)S3)cc1Cl 600271728 OREOSWPZPZBIRF-SJORKVTESA-N 398.915 5.114 30 20 GKED N#Cc1cc(NC(=O)c2cc3cc(F)ccc3s2)ccc1OCC(F)(F)F 603897420 GKZFKWYJNWKLRO-UHFFFAOYSA-N 394.349 5.105 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(COc2ccccc2C#N)o1 603950784 DGMSMJAXLWWDIE-GOSISDBHSA-N 388.467 5.171 30 20 GKED C[C@H](SCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 609825862 XSUJKAWZXDAWHP-OLZOCXBDSA-N 393.339 5.537 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1Cc1cnc(-c2ccc(C(C)C)cc2)s1 610218650 BPTPLCMFZDMVDU-UHFFFAOYSA-N 399.523 5.420 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COCCc2ccccc2)c1)c1cccc(C#N)c1 610322888 WARSIWKNLUOJIR-LJQANCHMSA-N 399.494 5.200 30 20 GKED C[C@@H](NC(=O)NCc1ccccc1Oc1cccc(F)c1)c1cccc(C#N)c1 610351013 GLLKOAAGEZLWDJ-MRXNPFEDSA-N 389.430 5.050 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1sc(-c2ccccc2)nc1C(F)F 611185438 XAUFPBHAZVKQPT-UHFFFAOYSA-N 391.487 5.540 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)cc1)c1nc2cc(Cl)ccc2s1 613403879 XECGPSNIOCGCBP-GFCCVEGCSA-N 391.677 5.202 30 20 GKED Cc1ccnc(C)c1NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 622866838 UQSOOMDUHLWJQE-UHFFFAOYSA-N 394.290 5.240 30 20 GKED C=C(C)Cn1c(-c2c[nH]c3ccccc23)nnc1N1CCC[C@H]1c1ccc(O)cc1 642725771 HDGZOGMZZIQHAZ-QFIPXVFZSA-N 399.498 5.050 30 20 GKED CN(Cc1cccc(F)c1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 661903476 ZFYFUIFEKWZRNS-UHFFFAOYSA-N 388.327 5.021 30 20 GKED O=C(Nc1cc(F)c(F)c(F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 666167364 RTGRKCWDSHMTIA-UHFFFAOYSA-N 396.253 5.279 30 20 GKED FC(F)(F)Oc1ccccc1CN1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 678207804 DRXFKFUTXJJHGP-PHIMTYICSA-N 395.265 5.148 30 20 GKED C=C(C)[C@@H](NC(=O)c1cccc(Oc2nccs2)c1)c1ccc(F)c(F)c1 681245627 NBXGCAOLNLQPCR-GOSISDBHSA-N 386.423 5.261 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(Oc2cccnc2)cc1 685105165 HPBJMDPMMOZVHH-UHFFFAOYSA-N 389.455 5.103 30 20 GKED Clc1cccc(-c2cnc(CON=Cc3ccc(Br)cc3)o2)c1 727484122 WASROBKIDTZTFR-UHFFFAOYSA-N 391.652 5.308 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(OCc3ccc(F)cc3)cc2)cc1 727685382 LHBYVTHAOPYQHO-UUASQNMZSA-N 389.426 5.259 30 20 GKED N#C[C@H](C(=O)[C@H](OC1CCCC1)c1ccccc1)c1nc2cc(F)ccc2s1 730420393 DDHLEFQXUDHQRU-DYESRHJHSA-N 394.471 5.312 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cccc(OCc2ccc(Cl)cc2)c1 731946401 CEDIUEPHOBDVTF-UHFFFAOYSA-N 393.899 5.600 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccc(C#N)cn3)c3ccccc3n2)c(C)c1 731989260 RWUFJMRRJIOWEY-UHFFFAOYSA-N 378.435 5.038 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC(C)(C)C)c2ccccc2)c1 733808031 YKHNZAPHRMBGTP-UNMCSNQZSA-N 393.531 5.344 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)SCc1cc(Cl)ccc1OCC#N 735317688 FERNTTNWMMBFEL-OAHLLOKOSA-N 388.920 5.120 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CC(c3ccccc3)c3ccccc3)[nH]c12 735792133 IFRIIBUFCBBZJB-NRFANRHFSA-N 379.463 5.270 30 20 GKED CC[C@@H](NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccs1 739438383 WDDVMCYRAFXPFA-QGZVFWFLSA-N 397.594 5.464 30 20 GKED COc1ccccc1-c1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)cc1 741467053 DVOOTERYQUIJJM-GHRIWEEISA-N 388.419 5.174 30 20 GKED CCCN(C(=S)Nc1ccccc1C#N)[C@@H]1C[C@@H](OCC)C12CCCCC2 741513526 QOBSFZYFZHDPEA-WOJBJXKFSA-N 385.577 5.095 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1cnn(-c2cc(C)ccc2C)c1C 741763254 DTISLEFBNBQXTO-UHFFFAOYSA-N 387.409 5.047 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc3c(c2)COC3)cc1OCc1ccccc1 742433904 AQVKJIOHYPQTDH-YRNVUSSQSA-N 386.447 5.201 30 20 GKED C=CCn1c(SCc2cc(Cl)nc(Cl)c2)nnc1-c1ccccc1C 768410463 BSWJQOHGYLBMTF-UHFFFAOYSA-N 391.327 5.434 30 20 GKED N#C[C@@H](COC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)Cc1cccs1 772735730 KHMNUPDATDIXPX-RGZVIEDOSA-N 399.821 5.273 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2cccc(O[C@H](C#N)CC)c2)cc1 772985614 SZPBKSZYKHWGCA-PXNSSMCTSA-N 384.907 5.350 30 20 GKED CC[C@@H]1C[C@@H](C=NNc2ccc(Br)cc2C(F)(F)F)CCO1 779775365 AOXVXRPWZNHSDU-CMPLNLGQSA-N 379.220 5.071 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@@H]2CCO[C@H](C(C)C)C2)c1 781646114 OMJXFPVYEWXONT-KNQAVFIVSA-N 381.541 5.104 30 20 GKED CCCCCCCC[S@@](=O)Cc1nc(-c2cccc(Br)c2)no1 790133530 BYLNYLGDJOPLGT-HSZRJFAPSA-N 399.354 5.108 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc3ncccc3c2)cc1 791749515 GZVQHOJZUHKGIT-QHCPKHFHSA-N 392.462 5.212 30 20 GKED C[C@H](CSCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 794441384 OTLZJYPCGIRMAS-VQIMIIECSA-N 392.549 5.523 30 20 GKED C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571799 QJEHDAITIQDOME-NEPJUHHUSA-N 396.434 5.103 30 20 GKED N#CCCCCCC(=O)N[C@@H](c1c[nH]c2ccccc12)C(Cl)(Cl)Cl 807695988 YCYYKHLMRDHKED-INIZCTEOSA-N 386.710 5.169 30 20 GKED C#C[C@@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccc(Cl)cc1 810195142 YWEDPKORBNOOHB-GOSISDBHSA-N 379.847 5.108 30 20 GKED Cc1cc(C(F)(F)F)ncc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 813276149 SDVPKQHROOEEEN-ZDUSSCGKSA-N 380.263 5.077 30 20 GKED COc1ccccc1C1(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)CCCCC1 815971144 VBHYHDGJGCFFHD-MRXNPFEDSA-N 382.529 5.353 30 20 GKED Fc1cnc(Cl)c(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 824538157 LOMUAGMJKUYVCQ-UHFFFAOYSA-N 386.698 5.202 30 20 GKED CC[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433940 WHAABHMZWUZVKT-DNVCBOLYSA-N 389.421 5.442 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)c1ccc(C2SCCCS2)cc1 841370238 LWQDOYARJJMXRL-HXUWFJFHSA-N 394.565 5.234 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@H]2c2cc(C)no2)s1 916669726 MRLAIANVAHYNFF-HNNXBMFYSA-N 391.541 5.107 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916681010 NJTBUCXYYJLPKJ-VGSWGCGISA-N 387.458 5.706 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1sc2ccccc2c1Cl 916904871 FNSYIRGVEOGXHD-NSHDSACASA-N 389.263 5.169 30 20 GKED C[C@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917044102 PUKKVMVKBXNYBY-IINYFYTJSA-N 391.279 5.247 30 20 GKED CC(C)CCSCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 920108742 BEYDBSDGMNHNMV-OAHLLOKOSA-N 378.950 5.419 30 20 GKED CCC/C(C)=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 920324798 VADQXOUJIPCIPP-DPQIITEBSA-N 379.312 6.040 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccc(Cl)cc3)o2)c1)C(=O)O 1776470990 XBIGJKILRYVHGQ-CFRMROPGSA-N 396.826 5.348 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)C2CCCCC2)cc1 1776786930 CILJYDNWLNZUBY-QFIPXVFZSA-N 375.553 5.549 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1C 1777275250 UQZKXNRZAFVGLQ-CSKARUKUSA-N 392.476 5.635 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)s1 1777316250 KNSZGYPYNHVEMD-YFHOEESVSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cnc(C3CCCCC3)s1)C2=O 1777683165 YWMYPUMREDHWIY-VBKFSLOCSA-N 381.497 5.492 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)n1 5642204 YXFOZUHBGSUYGJ-HXUWFJFHSA-N 391.471 5.181 30 20 GKED N#C[C@H](C(=O)c1cccs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538089 WWLSENHBLGAXCT-LLVKDONJSA-N 379.293 5.668 30 20 GKED N#C[C@@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1ccc(C(F)(F)F)cn1 41556539 MTHBVDHRVKDYOY-LJQANCHMSA-N 396.368 5.169 30 20 GKED COc1cccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 56744501 FOJDPTRMNCKEMD-UHFFFAOYSA-N 387.439 5.023 30 20 GKED CC(C)Oc1ccc(CNCc2cccc(OCc3cccc(C#N)c3)c2)cc1 60975088 LWIFTYOQRDPOMK-UHFFFAOYSA-N 386.495 5.214 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N(C)[C@H](C)CC#N)cc3C2)cc1 91034798 NAJIEOCQIAOHJO-QGZVFWFLSA-N 376.504 5.096 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cccc(Oc3ccccc3)c2)cc1 104796873 MIEKXCPVCDXFOR-UHFFFAOYSA-N 386.451 5.438 30 20 GKED CCOc1cc(C)ccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 123440286 XPILXKSSPUNOBE-MRXNPFEDSA-N 383.517 5.110 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1nc2cc(Cl)ccc2s1 131061675 MTSPVPTVOIVSFM-LBPRGKRZSA-N 392.223 5.001 30 20 GKED COc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 173116605 ARFLQOPLRJRDPE-DLBZAZTESA-N 397.544 5.042 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cnn1C(C)C 181255380 NLGUTLMEJHTUMM-HNNXBMFYSA-N 384.892 5.039 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C\c1cnc(C(C)(C)C)s1 255672880 YNQQIIAHMILXSO-CMUBDUJZSA-N 385.558 5.487 30 20 GKED CCCCS[C@@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 303113423 LHZNVYARADOLMN-HNNXBMFYSA-N 384.501 5.219 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1CCC[C@H](C)C1 303134606 CQYODKSKLFHLCW-JXFKEZNVSA-N 377.488 5.146 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)c2)o1 432991045 IJFPNMNPMUFNIE-JTHBVZDNSA-N 399.494 5.867 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)C3(c4cccc(C#N)c4)CC3)ccc2C)c1 435081074 WTUBZSYBZDYYPO-UHFFFAOYSA-N 383.451 5.033 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1nc2cc(Cl)ccc2s1 435800529 SNQPZIOGVXCULE-GFCCVEGCSA-N 396.686 5.502 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(CC#N)cc1Cl 452643349 JCVYJICRCVIYCG-LBPRGKRZSA-N 380.797 5.242 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)s1 455791406 IXCBKJPOSVRAMT-CYBMUJFWSA-N 386.521 5.034 30 20 GKED N#Cc1cccc(OCCNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1 462236514 RENSQEQNOZRLBC-UHFFFAOYSA-N 399.372 5.255 30 20 GKED N#Cc1cc(NC(=O)C2(C#N)CCC2)ccc1Oc1ccc(C(F)(F)F)cc1 464298542 SNYQNMQIQKDGCB-UHFFFAOYSA-N 385.345 5.002 30 20 GKED CCCCN(C(=O)Nc1ncccc1OCCCC#N)[C@@H](C)c1ccccc1 466605287 ZLUGUBFVZJLTSM-SFHVURJKSA-N 380.492 5.159 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1csc(-c2cccc(F)c2)n1 470645303 CREIUAQUJLLYTJ-UHFFFAOYSA-N 380.488 5.097 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(-c2ccccc2)ns1 475795322 QSDRGRLJLZCFNJ-QUCCMNQESA-N 388.496 5.114 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)OC(C)(C)C)cc1 476134985 GJJUTMSAJPRUHQ-UHFFFAOYSA-N 379.500 5.746 30 20 GKED C=CCC1(C(=O)NC[C@@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)CCC1 478587250 PDOYDWAOFWWQKU-NRFANRHFSA-N 388.511 5.171 30 20 GKED CCN(C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl)[C@H](C)c1ccc(C#N)cc1 480045960 RZWAOFYJUYGRPX-ZIAGYGMSSA-N 391.298 5.242 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1ccccc1C(F)(F)F 481283666 JWBMVGUDFNOFEI-LLVKDONJSA-N 383.211 5.190 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1cccc(F)c1 483236633 PFYKEOLPTZAXBH-HXUWFJFHSA-N 398.441 5.002 30 20 GKED N#Cc1c(NC(=O)c2cc(F)c(F)c(F)c2)sc2c1-c1ccccc1CC2 483355971 SFPJFFIXXCXJQV-UHFFFAOYSA-N 384.382 5.055 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1ccc(Cl)s1 483920753 UXJUFOGYYQGVSX-UHFFFAOYSA-N 398.940 5.397 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)NC(C)(C)CC)cc1 485303060 NSQLOKAGSJEZSF-UHFFFAOYSA-N 385.552 5.205 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1 486435920 PKJAPBZYEJRKBK-ZDUSSCGKSA-N 399.903 5.159 30 20 GKED Cc1c(C(=O)N[C@H](C)c2ccc3ncsc3c2)sc2ccc(C#N)cc12 501353608 KWXLJVJFOATDKW-GFCCVEGCSA-N 377.494 5.182 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 503499381 SQVATGDJHPISHB-UHFFFAOYSA-N 375.472 5.057 30 20 GKED Cc1cc(CSc2nc(-c3ccc(C)o3)cc(C(F)(F)F)c2C#N)on1 504540561 XCHPZZDLBJDDDY-UHFFFAOYSA-N 379.363 5.129 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc3ncccc3c2)cc1 505617547 CYFCFBNJLQPZSU-UHFFFAOYSA-N 395.418 5.160 30 20 GKED N#Cc1c(CSc2nnc(-c3ccc4ccccc4c3)o2)cn2ccccc12 514427832 GTIFLRXIWZNNDY-UHFFFAOYSA-N 382.448 5.306 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cs1 517455638 XFDSZSZWRYQQED-AWEZNQCLSA-N 393.537 5.623 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1SC[C@H](C)C#N 521747922 DNABKMANVOAHNR-CYBMUJFWSA-N 393.965 5.707 30 20 GKED CC(C)(C)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 541421130 LIQRTVPKVMPNKM-FQEVSTJZSA-N 391.515 5.232 30 20 GKED N#CCCN(Cc1ccccn1)Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 541925565 QZOZRFFPKOHHRJ-UHFFFAOYSA-N 385.389 5.276 30 20 GKED C=C(C)[C@H](NC(=O)CCn1c(C2CC2)nc2ccccc21)c1ccc(F)c(F)c1 547492029 DGYHSXOGUAOTQQ-QFIPXVFZSA-N 395.453 5.016 30 20 GKED C=CCC[C@H](NCc1ccc(C(F)(F)F)cn1)c1ccc(C(F)(F)F)cc1 551391926 UHHSWHGJWWFXHS-KRWDZBQOSA-N 388.355 5.916 30 20 GKED N#CC[C@@H](CC(=O)N1CCC([C@H](F)c2ccccc2F)CC1)c1ccccc1 552271339 CNATZJADEVZSQA-CVDCTZTESA-N 382.454 5.162 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 589366879 NCXDUYROJPIYJT-QGZVFWFLSA-N 386.455 5.279 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 590829318 CJSYHXPTMFPALH-ZWKOTPCHSA-N 375.394 5.024 30 20 GKED N#Cc1ccccc1CNc1ccccc1C(=O)Nc1ccc(F)cc1Cl 604007944 WPTMAONJZMVKAX-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1cc(-c2csc(NC(=O)c3ccccc3-c3ccccc3C#N)n2)c(C)o1 604119264 ZEACPSDAGSZMCG-UHFFFAOYSA-N 399.475 5.811 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccccc3C(F)(F)F)cc2)cc1 609496132 WXFZHVNXFDMNEQ-UHFFFAOYSA-N 396.368 5.816 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Cl)c1SCC(F)F)c1ccc(C#N)cc1 609932737 FWKKTKBXARLNCI-LLVKDONJSA-N 395.862 5.452 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1CCSc2ccccc21 610224751 NEYNMQXZMSGPES-QGZVFWFLSA-N 376.506 5.505 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC#N)[C@H](Cc1ccc(F)cc1)C(C)C 610309942 DNCNVEISURLQFD-JOCHJYFZSA-N 391.490 5.033 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(CC(F)(F)F)C1 610743094 JIJDXANNJCSOMX-UHFFFAOYSA-N 389.377 5.075 30 20 GKED CC(C)Oc1ncc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1Cl 611359743 HNGBSERMGUSSKK-UHFFFAOYSA-N 377.897 5.005 30 20 GKED CC(C)CNC(=O)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1Cl 614056101 HRAJECCGKURRTR-UHFFFAOYSA-N 383.923 5.139 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)CCCCc1nc2ccccc2s1 615081375 CLULHUUXFMREKE-UHFFFAOYSA-N 394.540 5.233 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)cc(Cl)c1 619125292 MTEAKTVMOINYIN-UHFFFAOYSA-N 379.703 5.263 30 20 GKED C[C@@H](CC(=O)NCc1ccc(C#N)c(Cl)c1)c1ccccc1C(F)(F)F 619764676 DTBLWVBKMNXLGD-LBPRGKRZSA-N 380.797 5.040 30 20 GKED CCCc1nc(C)c(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 644786899 ZBFTWJBOBMJHPS-NSHDSACASA-N 393.390 5.054 30 20 GKED C=CCC1(C(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCCCC1 648139063 CSIZTSQORMBGGX-CHWSQXEVSA-N 385.392 5.539 30 20 GKED CC(C)(c1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1)C(F)(F)F 683688581 BUNAVYVKWKJMAT-KRWDZBQOSA-N 382.385 5.565 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C)cc3)o2)cc1NC(C)=O 726428723 PAMAMSSQWBWQPN-LUAWRHEFSA-N 375.424 5.118 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)c1 726485609 RYRFHXNYXGTOAB-UHFFFAOYSA-N 399.494 5.391 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 729082565 UOBCOGYPOLJXTI-OXQOHEQNSA-N 390.508 5.579 30 20 GKED Cc1cccc2c1C/C(=C/c1cccc(NC(=O)c3ccccc3Cl)c1)C2=O 729150838 NHFQQRDZPKWGJK-ATVHPVEESA-N 387.866 5.723 30 20 GKED N#C[C@@H](C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1nc2cc(F)ccc2s1 730416849 JAMDIXQWVIBAIE-KBPBESRZSA-N 392.377 5.348 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 731136688 UZSXAAXCPCCAJH-WMLDXEAASA-N 380.900 5.636 30 20 GKED CC(C)(C)n1cc(C=NNc2ncccc2Cl)c(-c2ccccc2Cl)n1 731150696 DNSPHHCKHBPNIH-UHFFFAOYSA-N 388.302 5.453 30 20 GKED CCCN(Cc1ccc(OCC#N)cc1)[C@@H](C)c1ccccc1Br 731211261 DGFVMGUZMCQJTE-INIZCTEOSA-N 387.321 5.325 30 20 GKED C=CC[C@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccncc1 742075924 KJKPRARRBJPROL-IBGZPJMESA-N 399.922 5.157 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)N[C@H]3CCc4ccccc4C3)cc2)cc1 742990181 KWUVCEYDFYMQOG-NRFANRHFSA-N 399.519 5.194 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)c1 742997376 HHUXLIKUGFAYSF-LBPRGKRZSA-N 391.949 5.552 30 20 GKED CCCOc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 744114931 FRTOSZAEBIMIJC-KRWDZBQOSA-N 382.460 5.033 30 20 GKED CON=Cc1ccc(C(=O)Nc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)cc1 745136065 RECBTGMAPGSMGE-VGOFRKELSA-N 380.488 5.015 30 20 GKED O=C(/C=C\c1c(Cl)ccc(Cl)c1Cl)c1ccc(N2CCOC2=O)cc1 748584667 RJWOWZLRGHCWLN-YVMONPNESA-N 396.657 5.500 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CON=C(c1ccccc1)C(F)(F)F 751955028 GMACCUAQXSQJHD-UHFFFAOYSA-N 378.394 5.040 30 20 GKED C[C@@H](c1ccccc1)n1cnnc1SCC#Cc1ccc(C(F)(F)F)cc1 754274845 GQYLICJVBJWDPW-HNNXBMFYSA-N 387.430 5.050 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1nc2ccccc2s1 759184165 QXTLVUBIPJJJRZ-SCOAYWHSSA-N 389.867 5.388 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)C1 766619253 SMZVZAZDDRYOSN-GIVPXCGWSA-N 378.516 5.567 30 20 GKED Cc1c(C#N)cccc1NC(=O)Nc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1 770291012 QVPLYMLKZFBXJJ-OAHLLOKOSA-N 394.475 5.096 30 20 GKED CCCC[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(OC)cc1 780669503 LFASPBJSFCFCDS-APWZRJJASA-N 381.476 5.039 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccncc2)cc1 788349604 LQPJJTHZRBOMFC-ZHACJKMWSA-N 384.483 5.097 30 20 GKED CC(CCC(F)(F)F)=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 794982476 XUWCBGBXBJRTAV-UHFFFAOYSA-N 376.304 5.293 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)sc2cc(F)ccc12 805859106 YDQGBWPRZZNWKP-CYBMUJFWSA-N 399.397 5.584 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)cn1 809439103 LDHXFIDHNGFCEQ-INIZCTEOSA-N 378.501 5.262 30 20 GKED CC(C)(Cc1cccc(Cl)c1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813214233 UWUZUFRPBXZBTR-OAHLLOKOSA-N 380.797 5.199 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@]23CCCC[C@@H]2C3(F)F)cc1 821861131 PGYCAZYYNINAOR-URVUXULASA-N 380.438 5.496 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]1c1ccccc1)c1nc2ccccc2n1C(F)F 835072029 ADWLTRBBVHWLAX-GVDBMIGSSA-N 379.410 5.192 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1cc(C#N)ccc1Cl 862718651 KFPWCKQBWTWLIJ-UHFFFAOYSA-N 385.851 5.119 30 20 GKED Cc1nc(/C=C/c2cncn2C(C)C)sc1C(=O)/C=C\c1cncn1C(C)C 901457389 KHWSNNGJLJQLOQ-MKKAVFGOSA-N 395.532 5.073 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3ccccc3)CC2)cc1 915350424 VMHXNHSRFJHLQR-VWLOTQADSA-N 395.506 5.754 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353962 RTTISIJKJDXYFF-KKSFZXQISA-N 375.497 5.156 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)N1CCC(C(=O)Nc2ccccc2)CC1 918019268 BTIFMNAFCXVEKB-LJQANCHMSA-N 387.568 5.043 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1ccc2c(c1)CCO2 918711843 CKZLJDHPMOOKDP-QPJJXVBHSA-N 397.883 5.207 30 20 GKED FC(F)(F)c1ccc(-c2ccc(C=Nn3cnnc3-c3ccccc3)o2)cc1 920372843 DUVXWYDPMVSHCC-UHFFFAOYSA-N 382.345 5.106 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3\Cc4cc(C)ccc4C3=O)c2)cc1 921264656 WRVTZHKUGMAPNH-DEDYPNTBSA-N 383.447 5.078 30 20 GKED O=C(O)c1cc(Br)cc(/C=C\C(=O)c2cccc3ccccc23)c1 1776114704 YBBIVUFXSWVJIW-HJWRWDBZSA-N 381.225 5.197 30 20 GKED O=C(O)c1ccc2[nH]cc(/C=C/C(=O)c3ccc(OCc4ccccc4)cc3)c2c1 1776127333 PWWWJZDUZAMEPM-UKTHLTGXSA-N 397.430 5.341 30 20 GKED Cc1ccc(C)c(C(=O)/C=C\c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c1 1776132755 DSUMXHVCFVCLCM-FLIBITNWSA-N 390.435 5.378 30 20 GKED C=CCC[C@H](CC(C)C)C(=O)NCc1ccccc1-c1cccc(C(=O)O)c1 1776166419 YTIAONTZPVPALQ-LJQANCHMSA-N 379.500 5.297 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccsc2)nc1 1776354585 NZBBGPBQPFIKHD-QPJJXVBHSA-N 393.464 5.192 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(C)cc(Br)c1F 1776783957 MPPJGQCSPNUDGE-OAHLLOKOSA-N 388.321 5.190 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1777372661 RUERYYQDQNVRQD-SGEFVQMOSA-N 378.449 5.067 30 20 GKED O=C1/C(=C\c2ccccc2OCc2ccccc2)C[C@H](C(=O)O)c2ccccc21 1777698109 HSACEPCGKSASAS-DJAVKIJBSA-N 384.431 5.104 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc23)n1 22360861 GVXASIAGCHOXDQ-SJORKVTESA-N 389.524 5.081 30 20 GKED O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)c1cc(F)c(F)c(F)c1F 26287795 RHOZMZFHSFMSNQ-UHFFFAOYSA-N 394.271 5.124 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OCc1ccc(F)cc1)c1nc2ccccc2o1 41545628 YQERLHKOQQAPHR-SFHVURJKSA-N 386.382 5.036 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc(C(C)(C)C)s3)n2)cc1 63236785 GLTVPUHIKJJSED-CQSZACIVSA-N 397.525 5.063 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)nn1C(C)(C)C 66801051 QYCODIBAWATERG-OAHLLOKOSA-N 384.549 5.408 30 20 GKED N#Cc1cccc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c1 71802565 IIBLYNSGZIZOAO-UHFFFAOYSA-N 380.281 5.302 30 20 GKED N#CC1(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)CCCC1 105017796 BMQWWTMLVZTDSH-GOSISDBHSA-N 391.902 5.153 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccc(F)cc1F)c1ccccc1)c1ccccn1 106353756 LHIUDRKQZBOWQE-IERDGZPVSA-N 380.419 5.070 30 20 GKED CSc1cccc(NC(=O)[C@@H](C)Nc2ccccc2SC[C@H](C)C#N)c1 108407475 ZJMAIFAMAKGSBG-HUUCEWRRSA-N 385.558 5.099 30 20 GKED Cc1cccc(C)c1NC(=O)CCCSCCCOc1cccc(C#N)c1 125094863 CWEMMGZELGSXNN-UHFFFAOYSA-N 382.529 5.096 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccccc1 159983862 REUAMDPOVCMFHW-GOSISDBHSA-N 383.542 5.332 30 20 GKED N#CCCn1cc(CNc2ccc(-c3ccccc3)cn2)c(-c2ccccc2)n1 162227136 ASVMVPZSBXQJIE-UHFFFAOYSA-N 379.467 5.138 30 20 GKED Cc1c(C(=O)Nc2ncccc2OCCCC#N)oc2c1ccc1ccccc12 171059341 QONMEVLBLWWMIE-UHFFFAOYSA-N 385.423 5.224 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1nc(Cc2ccc(Cl)cc2)no1 173968640 PESQKVVVZLYBGW-OAHLLOKOSA-N 396.878 5.169 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 181042463 MHBAIZLSFBAYGP-QGZVFWFLSA-N 378.501 5.166 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CSc2nccn2C)o1 188058623 PVNQQOJESZSSCN-UHFFFAOYSA-N 395.528 5.410 30 20 GKED CC(F)(F)c1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 189412543 UYMDBISDBSWVEK-UHFFFAOYSA-N 382.366 5.094 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)cc1 303218016 QZNYQBPSAVNZPY-SCFJZMLDSA-N 383.447 5.453 30 20 GKED O/C(=N/Cc1noc2c1CCCC2)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 330221046 QSAWRPRISNQLCN-HUUCEWRRSA-N 393.512 5.370 30 20 GKED CC(C)[C@@H]1C[C@@H](/N=C(/O)c2cc(NC(=O)CC(C)(C)C)ccc2Cl)CCO1 330644456 YIPXGYHLUXPFQP-YJBOKZPZSA-N 394.943 5.223 30 20 GKED N#Cc1ccnc(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)c1 436001363 BQMHVQMVUMDYFF-UHFFFAOYSA-N 382.659 5.380 30 20 GKED N#CCSc1cccc(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)c1 440873484 SXLJUYYITCXKEB-QZMUEMGWSA-N 376.525 5.400 30 20 GKED N#Cc1cc(NC(=O)N2CCCCC[C@H]2c2ccco2)ccc1OC(F)(F)F 442195355 AOAUSYAQQYUQCJ-HNNXBMFYSA-N 393.365 5.199 30 20 GKED CC[C@]1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 443572152 RZWLCQGKRKSPNH-DENIHFKCSA-N 397.906 5.028 30 20 GKED CCOc1ccc(C2=CCN(C(=O)Nc3ccc(CC#N)cc3Cl)CC2)cc1 455712021 ZQGACXGOTQSONJ-UHFFFAOYSA-N 395.890 5.126 30 20 GKED O=C(C1CCC(C(F)(F)F)CC1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 456575991 NILPNCGUUXWJPM-WFBLGPOFSA-N 399.297 5.087 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 463956560 XTMMLMSEOQIWKM-INIZCTEOSA-N 386.499 5.092 30 20 GKED CSc1ccc(F)cc1CNC(=O)c1ccccc1-c1ccccc1C#N 465206209 NBSHJZITKQZZDY-UHFFFAOYSA-N 376.456 5.016 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3C[C@H](c4ccccc4)c4ccccc43)on2)c1 469320267 GGTMNOAFHNTNOT-OAQYLSRUSA-N 391.430 5.006 30 20 GKED C=CCc1cc(C(=O)Nc2c(CCC)cccc2C(C)C)cc(OC)c1OC 472684728 HDBKASHONVPNBY-UHFFFAOYSA-N 381.516 5.761 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)c1ccccc1-c1ccccc1C#N 474775805 URXOTAQUSLWDGZ-UHFFFAOYSA-N 398.506 6.101 30 20 GKED COc1cc(OC)cc(Oc2ccc(CN[C@H](C)c3ccc(C#N)cc3)cc2)c1 477318911 GUUYWKUZAHDYNU-QGZVFWFLSA-N 388.467 5.219 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1cc(Cl)ccc1C#N 479573477 IYNUCIYMKJTESJ-UHFFFAOYSA-N 387.826 5.152 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 482650963 UPUYOAWBPKPMQM-KRWDZBQOSA-N 386.451 5.192 30 20 GKED Cc1c(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)oc2ccc(F)cc12 486546297 DOZKXGMMKAMUJP-UHFFFAOYSA-N 380.463 5.205 30 20 GKED C[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 487384653 AZRLLAQRWFHLDY-OXQOHEQNSA-N 388.433 5.750 30 20 GKED C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487498936 GSBRGRQVALHLRB-DNVCBOLYSA-N 390.405 5.024 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cnn(CC(C)C)c1C(C)C 500013761 ZDFOHUAQQVCHQD-UHFFFAOYSA-N 395.551 5.224 30 20 GKED C[C@@H](CC#N)N(C)C(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 505163538 DZYYQIAHSXGBDM-KRWDZBQOSA-N 393.918 5.036 30 20 GKED N#C[C@H](NC(=O)C(c1ccccc1)c1ccccc1)c1cccc(C(F)(F)F)c1 505954563 PADIYGAHPLDHSU-FQEVSTJZSA-N 394.396 5.218 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1 509657085 ICXJOWYIXZGOII-MSOLQXFVSA-N 388.389 5.658 30 20 GKED CCc1cc(C#N)c(NC(=O)CCSc2ccccc2Br)s1 511041505 XIXDYEBVVPCZQQ-UHFFFAOYSA-N 395.347 5.066 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1OC 518780096 FLNQASZHNRGNNN-QFIPXVFZSA-N 399.943 5.854 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3OCC3CC3)n2)cc1 522487574 BTVSJIZTKLEFAY-LJQANCHMSA-N 388.492 5.397 30 20 GKED CCSc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cn1 524377475 FRILXYGRJYKHNL-MRXNPFEDSA-N 379.510 5.116 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 524988379 MNKDWRGRQORZAK-OAHLLOKOSA-N 376.456 5.803 30 20 GKED CCC(CC)N(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 531422488 KDKDAVGLVLDVLX-UHFFFAOYSA-N 391.515 5.517 30 20 GKED C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1cccc(Cl)c1Cl 540595335 ZMKGEGAKSRMMFX-OAHLLOKOSA-N 388.342 5.180 30 20 GKED COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)Nc2ccc(C#N)cc2)c1 542192131 JMSSQLHOPRFJIA-DNQXCXABSA-N 397.478 5.330 30 20 GKED Cc1nc2ccccc2nc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542943677 QBKLOWZVNSMFLG-QGZVFWFLSA-N 378.479 5.328 30 20 GKED C[C@@H](c1ccccn1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543017933 QPTXLGGGXNRSOW-MSOLQXFVSA-N 384.483 5.084 30 20 GKED CN(Cc1ccccc1)Cc1cccc(C(=O)N[C@@H](CCC#N)c2ccccc2)c1 543155243 NFAFDEMEOLNIAI-VWLOTQADSA-N 397.522 5.093 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccncc1F 559841998 DJFBDJJBQZZGGK-ZUZCIYMTSA-N 380.307 5.584 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 559861123 WDODBKOEKBWQKR-KKSFZXQISA-N 393.531 6.343 30 20 GKED CC(C)(CCC#N)CNc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 560289786 XKVKUHXODDBESO-JOCHJYFZSA-N 375.516 5.406 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@H]1c1c(F)cccc1F 565943524 RGVQTNXZYKBVME-MOPGFXCFSA-N 388.417 5.173 30 20 GKED CC(C)O[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 567813429 BPBKPFRBDGTZNW-GOSISDBHSA-N 399.878 5.035 30 20 GKED N#CCCC1CCN(C(=O)[C@@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)CC1 567947903 ZIHGVLASRIFKJZ-JTAQYXEDSA-N 384.951 5.231 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCCCC2 575898043 HUIKOVVGSHAMOU-HNNXBMFYSA-N 389.524 5.254 30 20 GKED N#CC[C@H](Cc1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1)c1ccccc1 576146756 HDUHQWHPFRJXMN-QAPCUYQASA-N 389.352 5.387 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(-c2ccc(Oc3ccccc3F)c(F)c2)no1 577478779 UFXJJRGCKRSGSE-AUUYWEPGSA-N 384.382 5.256 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)C[C@@H](C)C[C@H]4C)ccc12 577597994 FMGSJIXEFSZRJB-WCQYABFASA-N 391.496 5.120 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)Cc1ccccc1C(F)(F)F 582356006 POIVBUITHMQIQT-HOCLYGCPSA-N 394.462 5.115 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC(F)(F)C(F)F)cc1Cl 582793063 VULWVYRKBSAFIA-CQSZACIVSA-N 399.775 5.017 30 20 GKED CCc1nccn1[C@@H](C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 592755798 ZGYKJFAVYYPEEM-KRWDZBQOSA-N 388.471 5.008 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccccc2[C@@H](C)C1 593159110 JPSCNEZURDRCHI-SJORKVTESA-N 379.529 5.132 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC1(c2ccccc2)CC1 608841485 QKNSZWQPBZRRFJ-UHFFFAOYSA-N 383.451 5.470 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCC(C)(C)c2ccccc21 608920645 WYRLAZIPKIEGTH-JOCHJYFZSA-N 375.516 5.291 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)CCc1ccc(C#N)cc1 609066431 FXVSVPVFGVQSKV-IBGZPJMESA-N 384.479 5.578 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)NCc3ccsc3)cc2Cl)c1 609079980 OTRIKYZHCFANRZ-UHFFFAOYSA-N 397.887 5.174 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)oc2c(Cl)cccc12 609377013 NUPBFIRIHPXQFE-GFCCVEGCSA-N 384.888 5.899 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccccc2)CCC1 609436525 ONWMRCFCLQZUIH-KRWDZBQOSA-N 379.529 5.324 30 20 GKED CCN(C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 609967921 QIPSHYGBUIZCMX-JKSUJKDBSA-N 388.433 5.680 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@@H]1C 610019382 NLEHKYMIBLOIIG-GJZGRUSLSA-N 383.492 5.371 30 20 GKED C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1cccc(C#N)c1 610359786 OGSMPSOAVKNJFG-MUEKUWCCSA-N 396.490 5.118 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)[C@@H](Sc1ccccc1)c1ccccc1 618789811 PXLLOPTZWAJFDM-PKTZIBPZSA-N 384.504 5.195 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2cccc(C)c2C)n1 662079434 GEQFKQXZCMCXLJ-BGYRXZFFSA-N 381.545 5.128 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)cs1 671751008 JMBGXLZPWWWYEX-ZDUSSCGKSA-N 393.320 5.977 30 20 GKED N#C[C@@H](C(=O)c1ccoc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 684948553 XLSPBYPIIRHTHI-LBPRGKRZSA-N 376.359 5.276 30 20 GKED C#Cc1cccc(NC(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)c1 726072923 RDUKFCSIQGWVHJ-UHFFFAOYSA-N 387.483 5.200 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=S)Nc3ccc(C#N)c(Cl)c3)oc12 726448723 JNKMQHWDALRXRK-GFCCVEGCSA-N 399.903 5.404 30 20 GKED O=C(/C=C\c1csc(-c2ccc3c(c2)OCO3)n1)c1cc2ccccc2o1 728437673 GJMCHCDFKOPRGI-SREVYHEPSA-N 375.405 5.181 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1ccc2ccccc2c1 730954793 KUVHVEHCUMHLNE-HNNXBMFYSA-N 377.538 5.900 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@H](C#N)c3ccc(F)cc3)sc2c1 732654838 KOQCEKCKHPQDKU-MRXNPFEDSA-N 386.879 5.812 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744035284 LGAHSXIHCSHTNA-WFASDCNBSA-N 386.879 5.534 30 20 GKED C=CCN(C(=O)N[C@@H](c1cccc(SC)c1)c1cc(F)ccc1F)C(C)C 745903705 MIASRWGGIQVRSO-FQEVSTJZSA-N 390.499 5.382 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CSc2cccc(C(F)(F)F)c2)n1 747197624 KQAIHYJTVSJYMX-ZDUSSCGKSA-N 384.448 5.254 30 20 GKED COc1cc(/C=C2\CSc3c(F)cccc3C2=O)ccc1OCC(F)(F)F 750903390 BVLFGADYPCHIBI-KPKJPENVSA-N 398.377 5.147 30 20 GKED C=CCC(CC=C)C(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 759012711 YJEOMEIWLXTCPD-JTQLQIEISA-N 390.694 5.285 30 20 GKED O=C(/C=C\c1nc(Cl)cs1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 759075844 ONDOYPRVAWTAHG-YVMONPNESA-N 376.846 5.329 30 20 GKED CC(C)c1ccc(NC(=O)N2CCO[C@@H](c3cccc(C#N)c3)C2)c(C(C)C)c1 761825534 SLTXYMQLSPYXDF-HSZRJFAPSA-N 391.515 5.410 30 20 GKED COc1ccc2[nH]c3c(c2c1)C(=O)/C(=C/c1cccc(OCCCC#N)c1)CC3 765612790 FPKHKRHBVZINNY-GHRIWEEISA-N 386.451 5.072 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1C(=O)/C=C/c1cncs1 767727915 CVYLLTZTGHYRIZ-VOTSOKGWSA-N 391.315 5.234 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)c1 772982723 HLUFURZVZQRXDW-OXQOHEQNSA-N 391.540 5.650 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(Br)c1 774130709 NMFBXJXOGXSOBB-CQSZACIVSA-N 391.334 5.147 30 20 GKED C[C@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779071764 DYKAPZAYQPGORR-BTYIYWSLSA-N 377.488 5.243 30 20 GKED CCCCC[C@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C(C)C 787514388 BEVWNDLOKZLMIV-FQEVSTJZSA-N 383.536 5.061 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)c1 789430932 OLNDSYWQUFVMAK-HNAYVOBHSA-N 375.472 5.030 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NCc1ccccc1)c1nccc2ccccc12 792104862 YOYQEEBQAXTWTO-JOCHJYFZSA-N 377.447 5.337 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nnc(-c2cccc(Cl)c2)o1 795980981 AODLMWHDVINKSE-ZBFHGGJFSA-N 395.846 5.082 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797572877 KBVUDQNHTNJSJH-SWLSCSKDSA-N 394.462 5.829 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 797969038 LUBCDJOZLJXVKF-UHFFFAOYSA-N 385.467 5.356 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CC3CC(c4ccccc4)C3)n2)cc1 798819717 HUYWIKIIZJJEGJ-FBPXKMNZSA-N 397.503 5.442 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(C2CCCC2)cc1 810529362 FACFOIVGESPZAP-JOCHJYFZSA-N 388.511 5.430 30 20 GKED COc1cccc(O)c1C=Nc1ccc(O)c(-c2nc3ccccc3s2)c1 812392904 ADXLDWCIGBRUDK-UHFFFAOYSA-N 376.437 5.134 30 20 GKED N#CCCCn1cc(C(=O)OC[C@H]2CC[C@H](c3ccccc3)O2)c2ccccc21 814056942 NLURKSSIXRERJH-AUSIDOKSSA-N 388.467 5.022 30 20 GKED CC(=NNc1cnnc2ccccc12)c1sc(-c2ccccc2F)nc1C 814848969 ATKGGEAAWKUDLM-UHFFFAOYSA-N 377.448 5.037 30 20 GKED CC1(/C=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 822528661 HRNUMGMUXPQCDH-QJRAZLAKSA-N 394.902 5.307 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 836304137 MFZGITMNMYKZNY-IHRRRGAJSA-N 398.359 5.176 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@]2(C1)CC2(F)F 844517991 DOCRYRIXHHEXQR-OAQYLSRUSA-N 397.425 5.312 30 20 GKED C=CCN(C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C)C(C)C 915153544 PPLBTQJGWVLIHB-UHFFFAOYSA-N 396.560 5.394 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccccc1Oc1cccc(Cl)c1 1776063860 MORPTPQKSKPBNM-UHFFFAOYSA-N 398.821 5.806 30 20 GKED O=C(O)c1cc(C=NNc2ccc(OCc3ccccc3)cc2)sc1Cl 1776093189 DBCMFQMODLIKMC-UHFFFAOYSA-N 386.860 5.125 30 20 GKED CC1(C)Sc2ccccc2C(=O)/C1=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 1776572973 DALSPBFUGKZLQC-AQTBWJFISA-N 390.460 5.795 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C/c1ccc(-c2ccccc2C(=O)O)cc1 1777038307 AYMTYQMJUZNOTG-NTEUORMPSA-N 389.426 5.153 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(-c2ccc(F)cc2)s1 1777640976 KMMXJZXHKFEYKD-JXMROGBWSA-N 396.439 5.304 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)c(Cl)c1 1777673175 DQHKYUIMJJYQFB-GXDHUFHOSA-N 395.867 5.374 30 20 GKED C=CCn1c(SCc2ccc3ccccc3n2)nnc1-c1ccc(Cl)cc1 7206985 GIFUUSBWDYIAFV-UHFFFAOYSA-N 392.915 5.625 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1ccc(F)cc1Cl 7664156 GQAUVQDUWGNQTM-NSHDSACASA-N 387.307 5.209 30 20 GKED N#Cc1ccc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)cc1Cl 14686323 CHGKEBBNAASXNV-UHFFFAOYSA-N 395.460 5.473 30 20 GKED Cc1ccc(CCC2CCN(C(=O)c3ccccc3SCC#N)CC2)cc1 22061964 RARLCWIETIUAHA-UHFFFAOYSA-N 378.541 5.096 30 20 GKED N#C[C@H](C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)c1ccccn1 41492792 LJBXEYBRLIOHFG-FQEVSTJZSA-N 383.426 5.178 30 20 GKED N#CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)CC1 61584839 VYYLUEVQQHQXAI-VKAVYKQESA-N 399.519 5.159 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc(CC(C)C)n3)n2)cc1 64101524 QUYXVFAODFOSNH-HNNXBMFYSA-N 381.526 5.264 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2cccc(-c3nccs3)c2)cc1OC 108053890 KBXDGXTYZZYMJW-CSKARUKUSA-N 392.480 5.035 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1ccc(F)cc1Cl 108408213 ITPWXRYKDFRGOP-CHWSQXEVSA-N 391.899 5.170 30 20 GKED CCOc1cccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108533247 JRARTEGVHKIAMS-CVEARBPZSA-N 383.517 5.220 30 20 GKED N#C[C@@H](C(=O)c1ncoc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 112149130 YXIAUSDSARADIZ-ZDUSSCGKSA-N 379.828 5.095 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(-c3nccs3)c2)c1 113551037 MUWRDHLJQVPUAG-UHFFFAOYSA-N 378.457 5.137 30 20 GKED CSc1cc(C(=O)Nc2nc3c(cc2C#N)CCCC3)c(Cl)cc1Cl 121949936 FZAZFFXHMAWTSI-UHFFFAOYSA-N 392.311 5.113 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccccc2)c2nccs2)cc1 123360192 JCECQKKFYFRCNT-JXFKEZNVSA-N 384.932 5.715 30 20 GKED CC[C@@H](C(=O)Nc1nc(C)c(SCC#N)s1)c1cccc(C(F)(F)F)c1 176954711 YVBAJNABKIKCLV-CYBMUJFWSA-N 399.463 5.218 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 192482436 OWBAWEPJALYRCJ-OAQYLSRUSA-N 385.854 5.314 30 20 GKED N#C[C@H](C(=O)c1cc2cc(F)ccc2s1)c1nc2ccccc2n1C(F)F 193284883 QHSWKGPXLHFYEM-GFCCVEGCSA-N 385.370 5.275 30 20 GKED C=CCc1cc(C(=O)N(C)c2cc(Cl)cc(Cl)c2)cc(OC)c1OC 303651702 XFCOOVCIZYOMLQ-UHFFFAOYSA-N 380.271 5.016 30 20 GKED OC(C[C@H]1CCCC(O)=N1)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329357661 ZYILBGPKNITXIK-CQSZACIVSA-N 375.444 5.481 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cc(F)cc2cccnc12 329535501 ZKDREOBLLHSSAY-LJQANCHMSA-N 378.451 5.068 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCO[C@@H](c2ccsc2)C1 329881761 OYCDDYKIUKTRGW-HXUWFJFHSA-N 398.528 5.130 30 20 GKED C/C(O)=N/[C@H](C(O)=Nc1ccc(N2CCCCC2)c2ncccc12)C1CCCC1 329910679 NJTSOUFCOFBVAI-NRFANRHFSA-N 394.519 5.348 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1c(F)ccc(Br)c1F 410325381 XTPSMHRUKCWRRQ-LLVKDONJSA-N 397.288 5.734 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@@H]1CCCC[C@H]1C(F)(F)F 410401842 XYZOOQJGHSBRJH-GHMZBOCLSA-N 387.295 5.074 30 20 GKED CO[C@@H]1CCc2c(sc(NC(=O)c3sc4ccc(C)cc4c3C)c2C#N)C1 410965008 HOQJEIAZYKLYDX-CYBMUJFWSA-N 396.537 5.207 30 20 GKED CC(C)[C@@H]1CCc2c(sc(NC(=O)c3ncsc3C(F)(F)F)c2C#N)C1 411004305 CFJVSQLBYZKFPX-SECBINFHSA-N 399.463 5.108 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)CSc1ccc(F)cc1 426381609 NYXYCLOHXGEXLP-CABCVRRESA-N 388.533 5.587 30 20 GKED COCCC1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCC1 431901522 IWJTYCHZFRCCNZ-LJQANCHMSA-N 397.906 5.076 30 20 GKED Cc1cc(F)ccc1C1CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1 432700471 SSCRQXBQKIDVIC-UHFFFAOYSA-N 379.479 5.347 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1 433130567 AMGSJBWCVBCKFJ-NVXWUHKLSA-N 399.947 5.613 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 435653166 FPCXDNZADJCDHC-HXUWFJFHSA-N 395.528 5.408 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1C(=O)N1CCCCC1)c1ccccc1 435657216 VFWZTRMSWSHCJR-NRFANRHFSA-N 391.515 5.142 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Sc3ccncc3)cc2)cc1OC 435783590 WJNBSRMDBMPSBY-UHFFFAOYSA-N 392.480 5.059 30 20 GKED Cc1ccc(-c2ocnc2C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 442670688 JTIWMXQILGVMKM-CQSZACIVSA-N 393.855 5.403 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(Sc3ncccn3)cc2C)CCCC1(C)C 445243231 NFFBPLYLFUXLRS-IBGZPJMESA-N 396.560 5.535 30 20 GKED COc1ccc([C@H](NCc2cccc(C#N)c2)c2ccccc2Cl)c(C)c1 462746028 ODVGJXJGUZMXFN-QHCPKHFHSA-N 376.887 5.408 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 464176882 XIPGCLOPAQNBIU-UHFFFAOYSA-N 380.831 5.344 30 20 GKED COc1ccc([C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C(C)C)cc1 468936207 JHLFOLSXYHAKAC-DEOSSOPVSA-N 391.515 5.087 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1cccc(C)c1)c1ccccn1 475566194 SALGFVYEHSJLFX-RUZDIDTESA-N 399.538 6.153 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(-c2nc(C)co2)ccc1C 475567365 WUROUUJVZBJAEI-UHFFFAOYSA-N 389.499 6.454 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCCc2cc(OC)ccc21 476174841 YBUUYRTZQQWXTA-HXUWFJFHSA-N 377.528 5.996 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 476662585 FKYQMQBKJIQBKQ-DFBJGRDBSA-N 393.490 5.490 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Cc1ccc(OCc2c(C)noc2C)cc1 482751500 PVNCUXMEUMGPGY-UHFFFAOYSA-N 396.531 5.008 30 20 GKED CC(C)(CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)C(F)(F)F 483336776 GHNYJLCHUIAICI-UHFFFAOYSA-N 378.419 5.302 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(OCC(F)F)cc1 483617234 CHDAQJORSHTNKO-CYBMUJFWSA-N 391.443 5.226 30 20 GKED CO[C@H]1CCC[C@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)C1 483625869 OXKCMJXIIQQAQA-AVRDEDQJSA-N 396.918 5.340 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1c(Cl)cccc1Cl 486424951 LZYNEAWZUPEVIV-LNLATYFQSA-N 385.703 5.193 30 20 GKED COc1cc(NC(=O)c2sc3ccc(C#N)cc3c2C)cc(OC)c1C(C)C 498444131 SMOGZTQVYQFFRU-UHFFFAOYSA-N 394.496 5.474 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](c2cccc(F)c2)c2ccccn2)c1 499580221 TWOSQTSPPJYIMQ-QFIPXVFZSA-N 391.446 5.087 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(-c4nccs4)c3)CC2)cc1 503631841 ZYWCQOQYCXUDAY-UHFFFAOYSA-N 386.480 5.003 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)C[C@@H](CC)c2ccccc2)cc1 504319155 VZSUPJWPKLXIBB-LJQANCHMSA-N 376.500 5.023 30 20 GKED N#CCCCOc1cccc(CN(Cc2cccs2)Cc2cccs2)c1 506045738 KEIUMNAWTJYGKH-UHFFFAOYSA-N 382.554 5.695 30 20 GKED Cc1cc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2ccccc2Cl)ccc1F 508410767 GJZNJNQFBJYZLF-FQEVSTJZSA-N 399.897 5.212 30 20 GKED N#Cc1cc(NCc2cn(Cc3ccccc3)nc2-c2cccnc2)ccc1Cl 508638976 PRFCLNVLIXUNPJ-UHFFFAOYSA-N 399.885 5.131 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1sc(C)c(C)c1C#N 512008849 QWCNBNGRAHKLDX-UHFFFAOYSA-N 387.917 5.574 30 20 GKED C[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(C#N)cc1F 512617711 GLORCBYOBPJMJK-INIZCTEOSA-N 378.422 5.266 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)cc2)n1 513555010 UPFPKUDIIAHEHJ-AWEZNQCLSA-N 394.525 5.357 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3o2)cc1Cl 515240966 GALFXNHFFXSWDX-LJQANCHMSA-N 386.838 5.994 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517128377 UICZEZJRGAAKJN-XMMPIXPASA-N 397.478 6.028 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 518256205 PYHCDGLEUQHGRV-DLBZAZTESA-N 397.544 5.751 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1OC 518648454 HLKGCXOGCJZPIF-UHFFFAOYSA-N 384.501 5.132 30 20 GKED C[C@H](CNC(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 521012612 OWQZNARDGUSEJI-RTBURBONSA-N 399.494 5.071 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 521729907 JHMLRLKJAUMQNZ-LBPRGKRZSA-N 383.498 5.216 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2CCC(F)(F)F)cc1C(F)(F)F 534052598 LEVLIVGLWPUGKR-UHFFFAOYSA-N 386.295 5.324 30 20 GKED C=CCOc1ccc(CNc2cccc3c2CN(c2nccs2)C3)cc1Cl 534645788 UAVBUFBXPZITGD-UHFFFAOYSA-N 397.931 5.494 30 20 GKED C=C(C)[C@H](CC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2OC)cc1)OCC 535158078 VULZVSZWQRXWQL-JPYJTQIMSA-N 381.516 5.253 30 20 GKED CCN(C(=O)c1coc(-c2ccccc2Cl)n1)[C@@H](C)c1ccc(C#N)cc1 538432485 KLCAVTSNXFVAAK-AWEZNQCLSA-N 379.847 5.090 30 20 GKED N#CCC1CCN(C(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 542907642 MPZSZNDTDUSRRJ-UHFFFAOYSA-N 389.282 5.552 30 20 GKED N#C[C@H](C(=O)c1ccc([C@H]2CCCOC2)cc1)c1nc2cc(Cl)ccc2s1 543734490 HPBVEZIBXJHDBV-DOTOQJQBSA-N 396.899 5.334 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C1CC1 554205382 DUFRWHANFZNIAV-HNNXBMFYSA-N 397.548 5.312 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cn1 573065955 RYFOGVXYLWTPDV-INIZCTEOSA-N 389.480 5.520 30 20 GKED Cc1nc(-c2cccc(-c3noc([C@H](C)Oc4ccc(C#N)cc4)n3)c2)cs1 580492978 SJHFWUBHQZYADC-ZDUSSCGKSA-N 388.452 5.180 30 20 GKED N#Cc1ccc(CNc2cccc(OCc3cscn3)c2)c(C(F)(F)F)c1 580743623 GMTCSOVDEXRPNT-UHFFFAOYSA-N 389.402 5.225 30 20 GKED Cc1ccc(-c2ccc(C(=O)N(CCC#N)c3ccc(F)cc3)c(F)c2)cc1 581684929 JKYXINMOSWKCFI-UHFFFAOYSA-N 376.406 5.501 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ncc(-c2ccc(Cl)cc2)o1 581899792 BFJWDYOECWLYID-UHFFFAOYSA-N 384.911 5.351 30 20 GKED CCc1cc(Br)cc2sc(NC(=O)CCCCCC#N)nc12 588728225 MPRWTHCUJAKHOO-UHFFFAOYSA-N 380.311 5.034 30 20 GKED CC[C@@H]1CC[C@@H](C)N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 596693675 ARURWOBAKUQPFJ-RTBURBONSA-N 391.515 5.374 30 20 GKED C[C@]1(C#N)CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)C1 596704634 CFKPLDBAZLBKJX-LJQANCHMSA-N 389.377 5.265 30 20 GKED CCN(C[C@H](C)C#N)C(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1 603900326 CALMSFOJPXOJMX-IIBYNOLFSA-N 386.948 5.171 30 20 GKED N#Cc1c(NC(=O)c2ccc(Cl)cc2Cl)sc2c1-c1ccccc1CC2 603992059 YACVEPHOGIYCAO-UHFFFAOYSA-N 399.302 5.944 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2ncccc12 609061176 LEMYVBGGCQYSLY-UHFFFAOYSA-N 393.446 5.246 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2nccc3ccccc23)cc1Cl 609164537 QEIFZRSERHZNTL-OAQYLSRUSA-N 397.865 5.796 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCC(C)(C)c1ccccc1 609398174 JIVQDWWXIGDIGZ-KRWDZBQOSA-N 381.545 5.428 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1ccc(F)cc1F 609432519 VXUXVNOXRSQDFU-CQSZACIVSA-N 393.393 5.068 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)c1c(Cl)cccc1Cl 609579946 KYOPXZPVLGOGIG-LBPRGKRZSA-N 377.271 5.394 30 20 GKED CSCC[C@@H](C)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609870012 BWVKENWUPLWSCK-CQSZACIVSA-N 388.920 5.218 30 20 GKED C[C@H](c1ccccc1)n1c(SCCC(C)(C)C#N)nc2ccccc2c1=O 610285626 SBNLJERQZWOSQQ-MRXNPFEDSA-N 377.513 5.038 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610719387 DLZAJIZPJOJSEJ-QZTJIDSGSA-N 376.504 5.128 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1coc(C(F)F)c1 626404512 GNGGQLNAOZIPJV-LLVKDONJSA-N 387.226 5.269 30 20 GKED COCc1ccsc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 679367964 CAMKMNVGUBJKPK-NSHDSACASA-N 396.415 5.013 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1Br 726426477 ZOZPSOSYFPRFOB-UHFFFAOYSA-N 382.183 5.176 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 727629185 PBCPXNIJFMRTMN-UZLBHIALSA-N 380.538 5.431 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3sc(C)c(C)c3C#N)c(F)c2)c(F)c1 730446492 AMDVXUOWJKDVAD-UHFFFAOYSA-N 398.434 5.443 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1ccc2ccccc2c1 731039948 FQTYHIXXCLJSQL-IAGOWNOFSA-N 389.524 5.531 30 20 GKED Cc1cccnc1[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)C 734643866 JDNLNPGXGHHVEF-PKTZIBPZSA-N 398.510 5.564 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)C[C@@H](c1ccccc1)C(F)(F)F 735350587 YFZJUAQZNYBIHU-INIZCTEOSA-N 397.780 5.022 30 20 GKED C[C@@H](CC#N)N(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 740743833 FJUBVHGPRPEEID-INIZCTEOSA-N 382.463 5.307 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)N[C@@H]3CCc4ccccc4C3)c2)cc1 742996091 WJGQYVRVWHXSKP-OAQYLSRUSA-N 399.519 5.194 30 20 GKED C[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1nc(-c2cccc(F)c2)no1 743045478 MACHVVMLGJXWOD-MXVVBNHJSA-N 380.206 5.068 30 20 GKED O=C(c1csc(-c2ccccc2)n1)N1CCCSC1=Nc1ccccc1 743833077 PSVMJRKSUAEXFV-UHFFFAOYSA-N 379.510 5.077 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccccc3)n2C)cc1 744033487 RSTISYKTOCNVOE-LAUBAEHRSA-N 399.494 5.167 30 20 GKED C=CCOCCCC(=O)O[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 744149618 IDGDLBXDBMHLHJ-CQSZACIVSA-N 379.909 5.359 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(OCc2cc(Cl)ccc2OCC#N)c1 747857767 KWASILCGGBZQSS-UHFFFAOYSA-N 388.851 5.168 30 20 GKED C=CCn1c(SCCSc2ccc(C)c(C)c2)nnc1-c1ccncc1 750951877 WZUFMBUHCXRBPB-UHFFFAOYSA-N 382.558 5.027 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1cc(Cl)ccc1OCC#N 756647278 ZNHWPPKQDXVQKB-CQSZACIVSA-N 377.941 5.324 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3nc(C)ccc3c2)cc1 759207543 CYDDWZMGIZVDFN-VFNWGFHPSA-N 385.467 5.018 30 20 GKED C=CCOc1ccc(-c2nnc(SCCC(Cl)(Cl)Cl)o2)cc1 767124896 DGJSGLMMYSVJDP-UHFFFAOYSA-N 379.696 5.154 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)c1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 769294650 RPGYWBMZDFSXDL-WFASDCNBSA-N 378.350 5.202 30 20 GKED CCO[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 770180538 TYVIQDYQIDZEFH-RPWUZVMVSA-N 399.494 5.241 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)ccc2c1 770872501 UJAQFQSMFXTJSA-YWZLYKJASA-N 383.451 5.013 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 780675409 WPOVFSCFOLUHGD-ZIAGYGMSSA-N 391.393 5.221 30 20 GKED CSc1ccc2cc(CSc3nnc(C)c(C)c3C#N)c(Cl)nc2c1 781377917 BEEGLOMHFBRYMF-UHFFFAOYSA-N 386.933 5.181 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2cn(C)nc2-c2ccccc2)cc1 782776581 AZDGHHLWCPOIIP-QGZVFWFLSA-N 381.907 5.069 30 20 GKED Cn1c([C@@H](C#N)C(=O)CC(C)(C)Cc2ccc(Cl)cc2)nc2ccccc21 783067631 ZMNXRIAWARLQDF-KRWDZBQOSA-N 379.891 5.062 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1nccc2ccccc12 792102867 JWUOUQDAQYFKHA-QYZOEREBSA-N 381.262 5.522 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)C1 797573077 OAOKBFVKKFYUKI-FGTMMUONSA-N 390.593 5.773 30 20 GKED C#Cc1ccc(CN[C@H](c2ccc(Cl)cc2)C2C[C@@H]3CC[C@H](C2)N3C)cc1 809663284 NCEKHIYWEMEFKM-VTAUTDEMSA-N 378.947 5.025 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(N2CCCCC2)c1)c1ccccc1 814621722 MWEZXDBLFJFCHL-JOCHJYFZSA-N 376.504 5.234 30 20 GKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1O 815636410 UUYPFKYVGCHVRN-MOPGFXCFSA-N 387.321 5.631 30 20 GKED COc1cc(C(=O)/C=C\c2ncc(CSC)s2)ccc1SC(F)F 834420652 JPZLCNOMEXMKRU-XQRVVYSFSA-N 387.498 5.226 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1F)c1nc(-c2ccc(Cl)cc2)cs1 916977032 HHDRKDQTKIONAX-BJIFSAINSA-N 382.847 5.492 30 20 GKED N#Cc1c(NC(=O)C(F)(F)c2ccccc2)sc2c1-c1ccccc1CC2 917774333 KDLUJMLILKSKBZ-UHFFFAOYSA-N 380.419 5.116 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 920017874 NCFNXFVWVMDALZ-NSHDSACASA-N 397.780 5.338 30 20 GKED CC(=NNc1ccc(F)cc1F)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776032543 XDUXXACFLSBEJY-UHFFFAOYSA-N 382.366 5.291 30 20 GKED CCC(=NNc1ccc(Cl)cc1F)c1ccc(OCCCCC(=O)O)cc1 1776106665 PDOHIDZWNDBEBN-UHFFFAOYSA-N 392.858 5.339 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776125659 PFPMMAPPJMDDPT-WQLSENKSSA-N 377.440 5.331 30 20 GKED CC(C)(C)COc1cccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)c1 1776250454 WFRRKIVPZKLQQU-NTEUORMPSA-N 396.483 5.251 30 20 GKED CC(C)CCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776326953 IZMXWCRCHKNBDS-XFFZJAGNSA-N 396.483 5.493 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C\c1ccc(-c2cccc(CC(=O)O)c2)cc1 1776665791 CVFYHOAGAFVIEI-HZRSJKMUSA-N 382.459 5.439 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Cl)c(Br)c1 1776784187 MFECXUGCFMXFOO-CQSZACIVSA-N 390.749 5.396 30 20 GKED CCCCCCOc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776788955 KJXHTIKKCGCEMQ-SILNSSARSA-N 392.495 5.947 30 20 GKED Cc1cc(COc2ccc(/C=C3/C(=O)c4ccccc4[C@H]3C)cc2)oc1C(=O)O 1777423193 AKTSUMSZWDWPMX-VRCTWVPOSA-N 388.419 5.249 30 20 GKED Cc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1Br 1777433799 OBQRMUXNFIPLBP-SNAWJCMRSA-N 385.666 5.067 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)c(Cl)c1 1777673476 YCUBHJJQIOBQQN-KPKJPENVSA-N 394.826 5.565 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(Br)c3ccccc3c2)c1 1777684890 MQFQTNWOSFSFQL-HJWRWDBZSA-N 381.225 5.197 30 20 GKED CC(=O)Nc1ccc(/C=C/c2cc(Cl)n3c(nc4ccccc43)c2C#N)cc1 18063953 MDHYJXIOEJWXEA-RMKNXTFCSA-N 386.842 5.141 30 20 GKED N#Cc1cccc(/C=C(/Cl)c2nc(O)c3c(-c4cccs4)csc3n2)c1 40034699 WOHCDLNCNMFNQV-RIYZIHGNSA-N 395.896 5.734 30 20 GKED CCC(=O)Nc1ccc(C)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 44547856 DRMPMCCXFBYXOD-UHFFFAOYSA-N 383.451 5.135 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc(C(C)(C)C)s3)n2)cc1 63235830 XQAAEGFWUQQRFG-CQSZACIVSA-N 381.526 5.363 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(N2CCCC2)c(F)c1 66801906 UGSMNXSUSOHUFX-HNNXBMFYSA-N 383.492 5.072 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1OC(F)F 66954458 PVKOYRGGPCODHU-ZDUSSCGKSA-N 391.443 5.004 30 20 GKED COc1cc(/C=C/C(=O)c2oc3ccccc3c2C)c(Br)cc1O 72042090 KYMPSQCLNATCPY-BQYQJAHWSA-N 387.229 5.114 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1sccc1SC(F)F 107118388 BAWFFOYVNYPADH-UHFFFAOYSA-N 392.477 5.915 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(Cl)c(OCC(C)C)c(OC)c2)s1 108396196 OELNTUBNTHARPY-UHFFFAOYSA-N 392.908 5.131 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1nc(C(C)(C)C)no1 108408664 YGBWXGYFXPPWIR-NSHDSACASA-N 398.454 5.565 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1Cl 114620372 RSVQZFXSTGLKHW-IVOILVROSA-N 379.872 5.138 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCc4ccccc43)n2)cc1 115909009 XASNWQNVNIVEAO-YLJYHZDGSA-N 388.492 5.115 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cccnc1SCC1CCCCC1 120339012 BRCXQEIDYAUVQD-UHFFFAOYSA-N 399.491 5.048 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCc4ccsc4C3)cc2)cc1 131639085 SDXJBESKBNQJTI-UHFFFAOYSA-N 375.453 5.002 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccco1 150974244 KFXPRHSWNBEZIR-FUHWJXTLSA-N 383.517 5.823 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)sc1-c1ccc(F)cc1 171146613 MDNQDYIKRJZDCX-OAHLLOKOSA-N 376.412 5.494 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccn(-c2c(F)cccc2F)n1 180589115 LDHAKQJPCJDFNT-AWEZNQCLSA-N 384.455 5.014 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)c1 183344036 CKNVQSMNVAWPTM-OAHLLOKOSA-N 376.275 5.109 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC(=O)Nc1cccc(Cl)c1 191417227 NOBRNNYKTFQNFW-UHFFFAOYSA-N 399.922 5.294 30 20 GKED N#Cc1cc(NC(=O)N2CCC(c3ccncc3)CC2)ccc1Oc1ccccc1 191939913 DGFDJQJEEHKXGP-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1 193052773 ZWYXOMIPMNHTRB-UHFFFAOYSA-N 384.483 5.290 30 20 GKED COc1cc(C(=O)/C=C\c2c(C)nc3sc(C)cn23)ccc1SC(F)F 214925648 NVEIDODIPCZTDB-WAYWQWQTSA-N 394.468 5.232 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 247063022 BPWVMINZBLPICY-YQVWRLOYSA-N 379.529 5.491 30 20 GKED N#C[C@H](C(=O)CCCOc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 247778827 ZNQXDQVQBIEFKF-GOSISDBHSA-N 396.899 5.499 30 20 GKED C[C@@]1(/C(O)=N/CC2(c3cc(C(F)(F)F)ccc3Cl)CC2)CCC(O)=NC1 328785758 KNMWZSBXCCERLC-MRXNPFEDSA-N 388.817 5.104 30 20 GKED CC(C)(C(=O)Nc1ccc(C#N)cc1Cl)c1csc(-c2cccs2)n1 409974871 YAUKALADAMHDMC-UHFFFAOYSA-N 387.917 5.313 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 426668545 FUUPLWRULGMXLH-IRLDBZIGSA-N 389.886 5.247 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(Cl)c1 426912832 YVZKZBRYLUSOKS-UHFFFAOYSA-N 398.837 5.925 30 20 GKED C=CC[C@@H](C(=O)NCCc1nc(-c2ccccc2)c(C)s1)c1ccccc1 427459447 MZQPLPRVTWRLIM-HXUWFJFHSA-N 376.525 5.137 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1cccc(SCC#N)c1 429938750 CMRGQHBNAVIHGK-LBPRGKRZSA-N 379.312 5.442 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Cl)c1ccccc1 433135496 UVIPWKVVPMBSAB-INIZCTEOSA-N 395.812 5.915 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)Nc1ccc(C#N)c(Cl)c1 437588204 ITYMQRUIEGKDMD-UHFFFAOYSA-N 390.874 5.328 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638857 ZECUCGCVWMDOCG-NSHDSACASA-N 381.785 5.455 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)C[C@H]1C 439508653 CLADYSVCQSHNOX-GGPKGHCWSA-N 393.556 5.881 30 20 GKED CC[C@@H](Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1ccc(C#N)cc1 447598032 ULKOLZWRRXQKOO-XMMPIXPASA-N 395.506 5.253 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](c1ccccc1)C(C)C 463103862 JIHSKWKCPXLNMK-JOCHJYFZSA-N 385.467 5.432 30 20 GKED Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)CCCCOc2cccc(C#N)c2)cc1 464049865 LVURLLNQMQRIRF-DNQXCXABSA-N 390.527 5.211 30 20 GKED CSc1ccccc1C[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469321125 HBFWESWHZBAPPD-QGZVFWFLSA-N 393.556 5.035 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 471255291 SAACHBDCGIXCEU-SUMWQHHRSA-N 389.377 5.155 30 20 GKED CSc1cc(C(=O)Nc2cc(C#N)ccc2OC(C)C)c(Cl)cc1Cl 471360554 PZYNPYZBKVSDIW-UHFFFAOYSA-N 395.311 5.626 30 20 GKED COc1cc(-n2cccc2)c(Cl)cc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 474451043 YHBHUCQAGLCXDZ-AWEZNQCLSA-N 399.903 5.209 30 20 GKED CN(C(=O)c1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1)c1ccccc1 475032330 LOGYIOGBUUZRBC-UHFFFAOYSA-N 397.478 5.017 30 20 GKED CCCC(C#N)(CCC)NC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 475737416 ZLPWLNSPNDBTSK-UHFFFAOYSA-N 397.466 5.226 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)C[C@H](CC#N)c1ccccc1 475918677 LJVRJNRGEUIKHK-SFHVURJKSA-N 377.488 5.006 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)NCC(C)(C)CCC#N)c2cccs2)cc1 476933133 YTICLFVKEUPTJI-HXUWFJFHSA-N 383.561 5.590 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)c(F)c2)c2ccccc2Cl)cc1 479456285 SJTMGAXWQZSZIX-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1c1ccccc1 480803299 KKXJDGJTHHYDDX-SBUREZEXSA-N 383.451 5.575 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C 483840151 LJCABZGSECPJPN-HNNXBMFYSA-N 389.459 5.471 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@H](CCC#N)c1ccccc1 489377181 FZHWKBBLSIAUIF-HSZRJFAPSA-N 390.531 5.542 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2)cc1)[C@H](C)c1ccc(C#N)cc1 497594163 RGANTPRPZCVTQL-LJQANCHMSA-N 383.495 5.394 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)CC1 508514189 VELHPIGFMPDUDD-HSZRJFAPSA-N 383.495 5.264 30 20 GKED CCN(C(=O)c1cc2cc(Br)ccc2[nH]1)[C@H](C)c1ccc(C#N)cc1 509573464 RPPZDWQBFMCWAJ-CYBMUJFWSA-N 396.288 5.025 30 20 GKED C=CCC[C@@H](NC(=O)N1CCCCC[C@H]1c1c(C)n[nH]c1C)c1ccccc1 510630655 TXZXGUNTQQFTAM-RTWAWAEBSA-N 380.536 5.361 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2Cc2ccccc2)cc1 510679077 GQPLYAZRVFHOEB-QFIPXVFZSA-N 397.478 5.590 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)cs2)o1 515204877 VZFAZUNNKSJOHT-SNVBAGLBSA-N 383.498 5.022 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CCc3ccc(-c4ccccc4)[nH]3)n2)cc1 516700669 BPTXGGXGCAJLRL-UHFFFAOYSA-N 398.491 5.248 30 20 GKED C=CCOc1ccc(C(=O)N(CCc2ccccc2F)C2CCCC2)cc1OC 520150260 XDVLUZUGAYEJMR-UHFFFAOYSA-N 397.490 5.027 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1C1CC1 534249206 GERWKXSEMKFNRX-KRWDZBQOSA-N 393.535 5.293 30 20 GKED C=C[C@H](CC(=O)NCCCCc1nc(-c2cccnc2)cs1)c1ccccc1 535344342 JUANJJAKSIHOOT-GOSISDBHSA-N 391.540 5.004 30 20 GKED C=CCCOCCCCC(=O)N1CCc2ccccc2[C@@H](c2ccccc2)[C@@H]1C 538281567 MKZQUCWELBPJFB-HFZDXXHNSA-N 391.555 5.355 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccc(C)cc1 539759733 WAWHJUVROWMRKG-HNNXBMFYSA-N 376.485 5.434 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3ccc(C(F)(F)F)cc3[nH]2)c1 539843324 KFBCQNICHISWDP-UHFFFAOYSA-N 387.361 5.122 30 20 GKED C=CCn1c(SCc2nc(C3CC3)cs2)nnc1-c1ccc(Cl)cc1 542215331 ZMRVNUMZCDXDRV-UHFFFAOYSA-N 388.949 5.411 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 543986834 AYDXBMDAKRQLNN-LJQANCHMSA-N 396.471 5.326 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(CCC(C#N)(c2ccccc2)c2ccccc2)C1 554265656 UJVGNXMQVJZXMR-OFVILXPXSA-N 381.523 5.364 30 20 GKED N#Cc1cc(Oc2ccc(NCc3c(F)cccc3N3CCCC3)cc2)ccn1 558494058 VSBSHFKJDHBRPG-UHFFFAOYSA-N 388.446 5.097 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)Cc1cnc(-c2ccc(Cl)cc2)s1 574239333 BFMHQAOFRCTBGE-UHFFFAOYSA-N 388.920 5.127 30 20 GKED COc1cccc(C(=O)/C(=C\c2csc(-c3ccsc3)n2)c2ncc[nH]2)c1 588514590 LCTOCKWNBLIYDE-LICLKQGHSA-N 393.493 5.027 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)CCC2 593975093 LYWVJIFQJZTTBT-QAPCUYQASA-N 380.513 5.006 30 20 GKED Cc1ccc([C@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2ccc(F)cc2Cl)cc1 596283404 VHPATYSIYISAFD-KKSFZXQISA-N 399.897 5.212 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 596695133 PXDQEHFDFNNTMH-HSZRJFAPSA-N 377.488 5.032 30 20 GKED CC(C)Sc1ccc(C(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 603962091 ZAVBVGGYRXGLDB-UHFFFAOYSA-N 392.446 5.263 30 20 GKED C[C@@H](C(=O)Nc1cccc(OCCCC#N)c1)c1c(Cl)cccc1Cl 604566859 PAXGALQUSRPSQT-CYBMUJFWSA-N 377.271 5.418 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)cc1 608945332 GPTVPDAGEGWQKR-FQEVSTJZSA-N 386.417 5.263 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C2CC2)cc1Cl 609137793 ASMAVHRSOJMLDL-FPOVZHCZSA-N 379.891 5.402 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCCC[C@@H]2c2noc(C3CC3)n2)cc1 609144289 IIUYSYHYYLGIMM-JOCHJYFZSA-N 384.483 5.213 30 20 GKED N#CCn1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc2ccccc21 609167536 CZWRGAVGJZNGTG-UHFFFAOYSA-N 392.418 5.081 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)c(F)c1 609252771 HOSHTERPXJIRHB-HSZRJFAPSA-N 399.425 5.032 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc2ccccc2c1 609369374 BHNDRHZAOHVPCZ-MRXNPFEDSA-N 392.549 5.965 30 20 GKED COc1cc(C)ccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723708 VVNHAXWUFFXOOI-UHFFFAOYSA-N 392.842 5.573 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610356218 MBNJAXYRCZRORC-YJYMSZOUSA-N 388.298 5.473 30 20 GKED C[C@@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1cccc(C#N)c1 610884639 HLDCNHIPPOBUMQ-GOSISDBHSA-N 396.494 5.055 30 20 GKED C=CCn1c(S[C@H](C)c2cc(F)ccc2F)nnc1-c1ccc(F)cc1 615346719 YSRWIBFQBSLRFP-GFCCVEGCSA-N 375.419 5.402 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1c(C(C)C)cccc1C(C)C 615466751 IXCIPDYOUOBBLN-UHFFFAOYSA-N 380.532 6.162 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2cccc(OC)c2)cc1 615554328 KPXIKHCKJPZPFY-UHFFFAOYSA-N 394.496 5.769 30 20 GKED Fc1cccc(-c2nc(CN3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)co2)c1 618453435 UPLNRFZDALXIJI-VXGBXAGGSA-N 396.306 5.043 30 20 GKED CC(F)(F)c1ccc(C(=O)NCc2cc(F)c(C(F)(F)F)cc2F)cc1 622601117 PJYSMTPMGPFYNY-UHFFFAOYSA-N 379.275 5.025 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@@H]2c2nc3ccccc3s2)cc1Cl 726439679 HTYCTNPMPYXJQW-MRXNPFEDSA-N 398.944 5.355 30 20 GKED Cc1cc(C(=O)Nc2scnc2-c2ccccc2)c(C)n1-c1ccc(C#N)cc1 728270537 KINOAYMTSCPQJM-UHFFFAOYSA-N 398.491 5.342 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(Cl)c1Cl 731195860 PBHSFHJFMOCBDA-SECBINFHSA-N 380.083 5.356 30 20 GKED O=C(O)COc1cccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)c1 733205072 JRACMHJLBJHVEJ-QPJJXVBHSA-N 385.630 5.006 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3cccc(Cl)c3)n2)cc1 744061128 GWCMYHSPKAUWGJ-ACJLOTCBSA-N 396.899 5.452 30 20 GKED FC(F)(F)c1cccc(NN=C(Cc2ccccn2)c2ccc(Cl)cc2)n1 745205257 UBGJUIUWRZFGNJ-UHFFFAOYSA-N 390.796 5.208 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](c3ccccc3)C2)cc1 746763295 ASBWERHTHOTYSN-LADGPHEKSA-N 381.479 5.363 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)c2ccccc2SCC#N)c1C 749510434 TUKVSFHIYHCLHO-UHFFFAOYSA-N 382.529 5.568 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccccc1C1CC1 751129034 AYCCDODALWEGAS-UHFFFAOYSA-N 385.492 5.193 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)nc2)CCc2sc(Br)cc21 754687956 OMILMUHPGMJSKI-RIYZIHGNSA-N 397.297 5.180 30 20 GKED O=C1/C(=C\c2coc(-c3ccccc3)n2)Cc2c(F)ccc(Br)c21 759091999 RXILCIHMDUNYGW-WQLSENKSSA-N 384.204 5.066 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCC(C)(C)CC#N 764839103 USNRQWQFBSMOMD-CYBMUJFWSA-N 392.908 5.100 30 20 GKED Cc1cc(Cl)c2ccccc2c1NC(=O)NCc1ccc(OCC#N)cc1 765350255 PPJAVAMVSIZBRH-UHFFFAOYSA-N 379.847 5.026 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCC(=O)c3ccccc32)cc1 785852743 VFDMPGITIBLWLA-XZOQPEGZSA-N 380.447 5.041 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)[C@H]3CC[C@H](C(F)(F)F)C3)cc2)cc1 797097648 ACMAEKIVEVXJEK-GJZGRUSLSA-N 375.346 5.235 30 20 GKED N#Cc1ccccc1C(=O)/C=C/c1cccc(/C=C/C(=O)c2ccccc2C#N)c1 799499200 SXDPCFYYHQXBLB-QUMQEAAQSA-N 388.426 5.222 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc(N2CCCCCC2)cc1C 806635707 WBRHLNRVANTWHB-UHFFFAOYSA-N 375.516 5.043 30 20 GKED C[C@@H]1C[C@H](C=NOc2ccccc2C(F)(F)F)CCN1C(=O)OC(C)(C)C 807981294 GKTMKGOUDMPWDK-ZIAGYGMSSA-N 386.414 5.106 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1sc2nc(C)nc(C)c2c1C 863951912 XERJJYMXYRKERN-UHFFFAOYSA-N 395.919 5.654 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C/c1ccc(Cl)cc1 915054593 GRKODBYBSGSSTJ-IZZDOVSWSA-N 389.842 5.359 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2nc3ccccc3o2)cc1 915086051 RBRHUNJVIYWHKC-IBGZPJMESA-N 399.475 5.214 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)SCc3ccccc3)n2)cc1 916974372 JHXOHJUTBXSLRT-VQIMIIECSA-N 392.549 5.617 30 20 GKED N#C[C@H](C(=O)CCC1CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 917042598 GPQVLVMMHNJUBF-CQSZACIVSA-N 380.435 5.852 30 20 GKED CC(C)c1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 920140423 GXMMGNXRLNUMEA-NRFANRHFSA-N 399.519 5.614 30 20 GKED C=C(Cl)Cn1c(-c2ccc(CC)cc2)nnc1N(C)CCc1cccs1 1690335696 GPDMOERLNVQEQM-UHFFFAOYSA-N 386.952 5.000 30 20 GKED O=C(O)c1ccccc1NN=C1CCCCC[C@H]1c1ccccc1C(F)(F)F 1776030276 FJIXEYXPRVYXHY-HNNXBMFYSA-N 390.405 5.919 30 20 GKED O=C(/C=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccccc1Cl 1776115392 XFCVEUNCFIHPMH-MBWOQUJGSA-N 392.838 5.441 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc2nc(C(F)F)sc12 1776783685 CJXLSTQUMBBHHB-CQSZACIVSA-N 384.492 5.527 30 20 GKED CCCCOc1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)cc1OCC 1776801273 GTWZZVICCFVNHT-VBKFSLOCSA-N 398.455 5.076 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C\c1c(F)ccc2sc(C(=O)O)cc12 1777316242 JEBDFZHZOLLYNE-XQRVVYSFSA-N 390.819 5.297 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(C)cc3)n2)nnc1-c1ccccc1 24446657 HHWRTOBSFWZQFG-UHFFFAOYSA-N 388.496 5.387 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-c2ccn[nH]2)c1 24890706 BXKLBJFEADERGE-UHFFFAOYSA-N 396.475 5.352 30 20 GKED COc1cc(C#N)ccc1OC(=O)c1csc(-c2ccc(C(C)C)cc2)n1 29568512 UIBUHGKBWJCWDX-UHFFFAOYSA-N 378.453 5.033 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cc(C)ccc2C)cs1 54897333 GFBWQXIPUUFJLO-FLIBITNWSA-N 394.471 5.480 30 20 GKED N#CC1CCN(C(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)CC1 61584178 MTKGKCWQIKJDOV-UHFFFAOYSA-N 375.255 5.161 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3sc4c(c3C#N)CCC4)s2)c(C)c1 63569095 ZHTROZYKIFXBGU-UHFFFAOYSA-N 393.537 5.410 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N(Cc2cccs2)C2CC2)c1 65635762 ZDLIRCWZWAPXAG-UHFFFAOYSA-N 388.492 5.004 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)cc2)C2CCC2)cc1OCCCC#N 105431099 DBKYKTIPYCGWLM-HSZRJFAPSA-N 382.479 5.148 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cc2)c1 122554650 OMOYIHLVFSQSEY-UHFFFAOYSA-N 391.427 5.028 30 20 GKED C=C[C@H](CC(=O)Nc1ccccc1NC(=O)Cc1cccs1)c1ccccc1 131514499 YJTUFELHFBRLIU-QGZVFWFLSA-N 390.508 5.228 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1Oc1cccnc1)c1ccc(Cl)c(Cl)c1 161179362 KBUCZIJPGPGFOE-GOSISDBHSA-N 398.249 5.175 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-n2cc[nH]c2=S)cc1 170977147 PFDCHJPLGFFSGF-AWEZNQCLSA-N 394.525 5.039 30 20 GKED N#CCCCCNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 171500423 BOPGBAUOHDKXKU-UHFFFAOYSA-N 398.915 5.802 30 20 GKED CC(C)[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 172545536 HEJOYRNWTOMMHB-IRXDYDNUSA-N 381.426 5.123 30 20 GKED Cc1scc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1C 179793789 PWEMZAILLQAFDK-UHFFFAOYSA-N 376.481 5.262 30 20 GKED C[C@@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Br 190899247 SBJPUBJAEJDDTA-CHWSQXEVSA-N 389.318 5.142 30 20 GKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(OCC(F)(F)F)cc1 301307784 VZOCCGHOSHCUAU-SNVBAGLBSA-N 389.299 5.086 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 303507159 SGFGYALIHKJQMJ-KGLIPLIRSA-N 391.323 5.741 30 20 GKED C=CCN(Cc1ccccc1)Cc1ncc(-c2ccccc2Br)o1 303960563 ZHZFMHMSNGVUQL-UHFFFAOYSA-N 383.289 5.292 30 20 GKED Cc1cccc(C)c1N=C(O)[C@H](C)N1CCC([C@H]2C(O)=Nc3ccccc32)CC1 328712467 RSMWWERFMDYFFV-LAUBAEHRSA-N 391.515 5.377 30 20 GKED COc1c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)cc(Cl)cc1C(=O)N(C)C 329151212 SGMZHYYZFWYBEM-FVQBIDKESA-N 392.927 5.245 30 20 GKED CC1=C(C)CN(C(O)=Nc2ccc(Cl)c(/C(O)=N/C3CCCCC3)c2)CC1 330283271 BGDSLFDJFGOJEO-UHFFFAOYSA-N 389.927 5.565 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@H]1CCCC[C@@H]1C(F)(F)F 410401844 XYZOOQJGHSBRJH-QWRGUYRKSA-N 387.295 5.074 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)c1 413332866 IUZMYFYMTKVCBM-QKNQBKEWSA-N 398.428 5.434 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@@H](CC#N)c1ccccc1 425082499 GCJRIBVNNFRHKB-VQIMIIECSA-N 399.416 5.034 30 20 GKED Cc1ccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1NC(=O)C(C)(C)C 425651400 LGGJXEDJQIQKBY-MRXNPFEDSA-N 392.503 5.076 30 20 GKED N#CCCC[C@H](NC(=O)NCc1ccccc1OC1CCCC1)c1ccccc1 431810199 HHFYKAQDCNKALG-QFIPXVFZSA-N 391.515 5.242 30 20 GKED Cc1ccc(-c2noc(CCCN[C@@H](CCCC#N)c3ccccc3)n2)cc1F 433014680 SWNCKLAWUZJXHE-NRFANRHFSA-N 392.478 5.142 30 20 GKED COc1ccc(C#N)cc1CN[C@@H](c1ccccc1Cl)c1ccccc1OC 434886754 LGCFFSKPTGPFIY-QHCPKHFHSA-N 392.886 5.108 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(Br)cc1Cl 436111381 YQDJOVAHWHHTIY-HXUWFJFHSA-N 376.747 5.071 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(F)cn1 437031686 ABVSTIQIFAKIRO-BMIGLBTASA-N 380.307 5.584 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438842676 QGALQABMTYDKRR-LIRRHRJNSA-N 390.314 5.741 30 20 GKED C[C@H]1CC[C@H](CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)O1 439111852 NIUJKWRTZORKNN-WMLDXEAASA-N 384.863 5.290 30 20 GKED N#CCC[C@@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccccc1 439656063 QARJPOUYJMRIOF-HSZRJFAPSA-N 384.479 5.284 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H](COCC)C1)c1ccc(C(F)(F)F)cc1 441532838 LNRZRTDSSDJINQ-APWZRJJASA-N 398.469 5.171 30 20 GKED C[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c2c(O)cccc21 469318153 XCBPUVJSTRDRLU-MRXNPFEDSA-N 384.435 5.210 30 20 GKED CC[C@H](CC1CCCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 470845485 UJYCFIIATMUPDA-LJQANCHMSA-N 395.547 5.205 30 20 GKED COCCC[C@H](Cc1ccccc1)NC1CCC(C#N)(c2ccccc2)CC1 475357577 VCYXXLYCBFNOPU-OADZCNSWSA-N 376.544 5.018 30 20 GKED C[C@H](NC(=O)Nc1cccc(COC2CCCCC2)c1)c1ccc(C#N)cc1 480316526 KLCGNKXPGGOKEM-KRWDZBQOSA-N 377.488 5.290 30 20 GKED C[C@@H](Sc1nnc(-c2ccccn2)n1-c1ccccc1)c1ccc(C#N)cc1 481352636 ZMQUOAVHGGFDMK-MRXNPFEDSA-N 383.480 5.054 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC[C@@H](c2nc3ccc(C)cc3[nH]2)C1 486469345 UKFYIEYECOPGOJ-QGZVFWFLSA-N 391.540 5.169 30 20 GKED N#CCCC[C@H](NC(=O)c1cnc(Cc2ccccc2F)s1)c1ccccc1 487485332 LZZWTORBVMEMRF-IBGZPJMESA-N 393.487 5.038 30 20 GKED CCC1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCOCC1 487702983 NJGCYCHWEGGAQB-UHFFFAOYSA-N 384.863 5.149 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1coc(-c2ccc(Cl)cc2)n1 488794974 KZQCHVFLBDADIZ-UHFFFAOYSA-N 395.793 5.573 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccccc1 490176385 NTZKKJFOTRRVNB-JOCHJYFZSA-N 388.511 5.064 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC)[C@@H](C)c1cc2ccccc2o1 495425817 GIKMPNZYGIPJLJ-HNNXBMFYSA-N 377.444 5.318 30 20 GKED COc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)c(C(F)(F)F)c1 503097770 VDKJUICMCXLCEO-UHFFFAOYSA-N 381.247 5.124 30 20 GKED CCN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@@H](C)c1ccc(F)cc1 510463760 XKKADTXIEXUTIY-SFHVURJKSA-N 376.479 5.186 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCCOc1cccc(C#N)c1 518375368 HTRJVWQAPRKVGS-UHFFFAOYSA-N 384.907 5.524 30 20 GKED N#CC[C@@H](Cc1nc(Cc2c[nH]c3cc(Cl)ccc23)no1)c1ccccc1 518436996 SSFCIOBPLLLQPY-HNNXBMFYSA-N 376.847 5.035 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520724784 XCJQWVKUJBLXMW-AWEZNQCLSA-N 392.455 5.311 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccccc1SC[C@H](C)C#N 520826157 BZRKZCWMINEPMZ-AEFFLSMTSA-N 394.540 5.396 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(-c2cccs2)no1 520923308 JZMHZJUYUJCLBK-CQSZACIVSA-N 388.452 5.635 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CC)c1cc(F)ccc1F 524926180 HGKMEJQSMVERFJ-INIZCTEOSA-N 384.879 5.529 30 20 GKED N#Cc1cc(N2CCC(c3nc4cc(Cl)ccc4o3)CC2)nc2ccccc12 538083441 IPTCSBDWZALRJF-UHFFFAOYSA-N 388.858 5.285 30 20 GKED Cc1ncc(CNCc2ccc(-c3ccccc3C#N)cc2)n1-c1ccccc1 538609940 DIJSQWFGZVMTBT-UHFFFAOYSA-N 378.479 5.009 30 20 GKED Cc1cccc(NC(=O)CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C 542946770 YEPDYFGZYYZMCY-LJQANCHMSA-N 383.495 5.131 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cc(F)cc(F)c3)no2)c2ccccc21 546288626 LRBHFXGUXWQKEZ-SREVYHEPSA-N 376.366 5.054 30 20 GKED Cc1cc(-c2ncco2)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 552537063 HHYJOAPSKUTLQT-UHFFFAOYSA-N 384.439 5.161 30 20 GKED C=CCn1c(S[C@@H](CC)C(=O)c2ccccc2)nnc1-c1ccc(F)cc1 558409692 ZCSMCCSIDXNRIU-SFHVURJKSA-N 381.476 5.024 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCc1cccc([N+](=O)[O-])c1 558789827 VGCSZPGLEHOJEF-UHFFFAOYSA-N 381.476 5.153 30 20 GKED N#CC1(CC[S@](=O)Cc2nc(-c3c(F)cccc3F)cs2)CCCCC1 561137476 DAZPERKGDMAMKP-SANMLTNESA-N 394.512 5.201 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccccc1Cl 566578275 JJTPLEMCYSUCSS-CQSZACIVSA-N 390.961 5.606 30 20 GKED N#CCn1c(/C=C\c2cn(C3CCCC3)nc2-c2ccccn2)nc2ccccc21 574051590 WRMCPIJNBNDBDV-SEYXRHQNSA-N 394.482 5.104 30 20 GKED Cc1sc2nc([C@H](C)Sc3nc4c(cc3C#N)CCCC4)nc(O)c2c1C 585688264 BEXPJQKXCQPSIC-LBPRGKRZSA-N 396.541 5.013 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OCc2ccccc2)cc1 590257319 JPYZEHGSTWOHHF-RLWLMLJZSA-N 384.523 6.351 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 597186565 JSLAEGIBLCQXBV-IEZWGBDMSA-N 380.513 5.222 30 20 GKED C=CCOc1ccccc1CNC(=O)c1sc2cc(F)ccc2c1Cl 599813499 GWJNYWXYMXPYEY-UHFFFAOYSA-N 375.852 5.189 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(Cl)c1Cl 603470513 UNHSWYIKJGPUFZ-UHFFFAOYSA-N 399.302 6.269 30 20 GKED C[C@@H](C(=O)NCCSCc1ccccc1C#N)c1c(Cl)cccc1Cl 604565510 SWJYDUJKHHQSCK-CYBMUJFWSA-N 393.339 5.018 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)c1occc1COc1cccc(C#N)c1 608803537 PKVWDHFQLSDKGN-UHFFFAOYSA-N 396.446 5.156 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609031690 LHPPPTGGCYAIFI-UONOGXRCSA-N 375.255 5.006 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCCCOC3CCCCC3)c2)cc1 609209096 XVTYDSQCXJUSHO-UHFFFAOYSA-N 393.487 5.211 30 20 GKED CCOc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378451 JFJDCVAQXIBDJA-UHFFFAOYSA-N 394.418 5.362 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 609414166 PWYBRSUDIHMDCY-LJQANCHMSA-N 398.293 5.082 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609641685 FFDNQQVDWWFIGN-QGZVFWFLSA-N 388.442 5.110 30 20 GKED CSCc1c(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)oc2ccccc12 610388513 OMWALLMNCYUCHL-UHFFFAOYSA-N 390.386 5.439 30 20 GKED C=CCSc1ccccc1NC(=O)COc1ccc(Cl)cc1C(=O)CC 620711888 KHBSGWOAWQFNOM-UHFFFAOYSA-N 389.904 5.228 30 20 GKED FC(F)c1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cn1 631037714 MXSYEXDKLKHQMK-NXEZZACHSA-N 376.291 5.018 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OCc3ccc(F)cc3)cc2)cc1O 727685509 PPQLQPRYCNQPSL-QCDXTXTGSA-N 378.399 5.015 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 728181793 CKUKYHWATYHODI-SJORKVTESA-N 391.458 5.631 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 731167101 KYUDDUPSXUPKNK-XZOQPEGZSA-N 391.474 5.079 30 20 GKED Oc1ccc2ccccc2c1C=Nc1ccc(Oc2ccc(Cl)nn2)cc1 733205200 NAMPOXAPTZWKEO-UHFFFAOYSA-N 375.815 5.532 30 20 GKED COCc1cccc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)c1 742434218 FYRJTIHDPQHHMB-ATVHPVEESA-N 379.456 5.308 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)c2ccccc12 743056760 LGKJGSSZOOZEOD-WQLSENKSSA-N 382.419 5.327 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SCc1ccccc1)c1cccc(C#N)c1 743081271 BGBVIDOSHQNZID-KRWDZBQOSA-N 387.508 5.733 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Br)s1)c1ccc2ccccc2n1 747103603 CITOZLKOQUNJII-OAHLLOKOSA-N 399.313 5.258 30 20 GKED CN(C(=S)Nc1ccccc1C#N)[C@@H](c1ccncc1)c1ccc(Cl)cc1 749014028 SRONHYFHYKNONY-HXUWFJFHSA-N 392.915 5.025 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)c1 753876664 OMGSXIUJZJITJV-QZMUEMGWSA-N 375.472 5.079 30 20 GKED N#Cc1ccc(Br)c(CSc2nnc(-c3ccccc3)s2)c1 754862855 OJJPOYOYKFZCRI-UHFFFAOYSA-N 388.315 5.132 30 20 GKED Cc1nc(CSc2ccc(C(=O)OCC3CCC(C#N)CC3)cc2)cs1 755952470 FSNWZJNQXKKAJP-UHFFFAOYSA-N 386.542 5.231 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCCc3c(Cl)cccc32)ccc1OC 756705139 KJHBCJWHGLBTPF-JXFKEZNVSA-N 384.907 5.197 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3nc(C)sc3c2)cc1 763944016 LUIDKOZFQDRBBU-SCLBCKFNSA-N 391.496 5.079 30 20 GKED N#Cc1ccc(F)c(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)c1 773024603 JMTQAISGSDBTGH-SFHVURJKSA-N 397.906 5.641 30 20 GKED C[C@@H](N[C@H](COCc1ccccc1)c1ccccc1)c1ccc(OCC#N)cc1 776163979 TXMUVZUSHFGVHV-CJFMBICVSA-N 386.495 5.198 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cc(F)cc(Cl)c1 776724515 XANFQRPBTCOMKW-UHFFFAOYSA-N 397.862 5.108 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1 780670540 LUYXJHBIIAIDDF-XOBRGWDASA-N 395.459 5.089 30 20 GKED C[C@H](C=Nn1c(S)nnc1CSc1ccccc1)c1cccc(Cl)c1 782244562 IMOWISLSUKCWGJ-CYBMUJFWSA-N 388.949 5.150 30 20 GKED Cc1ccc(-c2ncccc2NC(=O)Nc2ccccc2O[C@H](C)C#N)s1 782913098 QAHRRACQNZYRCW-CYBMUJFWSA-N 378.457 5.053 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc(Br)cc1Cl 788353680 IKHXEZPEQZLMSI-ONEGZZNKSA-N 396.615 5.474 30 20 GKED N#C[C@H](C(=O)CO[C@@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 797549633 OVQVYGPVJVHFFI-VQIMIIECSA-N 396.899 5.220 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2cnc(-c3ccccc3)s2)C(=O)c2ccccc21 802708074 RFFZJFWNMDHSTK-GRFAERAESA-N 389.476 5.127 30 20 GKED C[C@@H](OC(=O)CCCCCC#N)C(=O)N1c2ccccc2Sc2ccccc21 805698140 STPWSWUKNCHTMB-MRXNPFEDSA-N 394.496 5.222 30 20 GKED C=CCC(F)(F)C(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 815571956 QSVUJHFYMHWHMF-IBGZPJMESA-N 386.467 5.446 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)ncc1F 815636234 RFQXPIKMVDKCRJ-DYVFJYSZSA-N 376.273 5.069 30 20 GKED COc1ccccc1C1(C(=O)[C@H](C#N)c2nccc3ccccc23)CCCCC1 816045147 CNJRYBFETOBANX-HXUWFJFHSA-N 384.479 5.322 30 20 GKED CSc1ccc(CCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 842711822 JGCCTLMFGZVCGQ-MRXNPFEDSA-N 384.501 5.356 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)ON=Cc2ccccc2C(F)(F)F)c(Cl)c1 851982143 FBVYVDCBZBPDER-ZDUSSCGKSA-N 398.812 5.353 30 20 GKED N#CC[C@@H]1CCCN(C(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)C1 855258695 BWKDQWAUXCNZKB-XESZTULISA-N 382.866 5.172 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc([C@@H](O)C(F)(F)F)cc2)cc1 864021006 FJEBVUYAVVCCIE-FZKQIMNGSA-N 385.813 5.587 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C(C)(C)c2cccc(C(F)(F)F)n2)s1 870339608 LEBLBJUNEFKNIT-LLVKDONJSA-N 395.450 5.008 30 20 GKED C[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CC2)cc1 914557506 HQBGMELNGHNDNZ-NQWZYWRBSA-N 377.271 5.228 30 20 GKED Cc1ncsc1C(=O)/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2)c1 915988508 YLFZTZSYBBBWTR-BJMVGYQFSA-N 382.872 5.253 30 20 GKED Cn1cc(C=NNc2ccccc2Br)c(-c2cc3ccccc3o2)n1 920371779 NDLLVDDXBOLYSW-UHFFFAOYSA-N 395.260 5.042 30 20 GKED CC(=NNCc1cccc(Cl)c1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776048426 USAHAFNXDLVSCT-UHFFFAOYSA-N 394.858 5.344 30 20 GKED C=C[C@H](CCC(=O)O)NCc1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1 1776148388 FUWKVDUZCGDQQZ-CQSZACIVSA-N 398.261 5.434 30 20 GKED C=CCc1cc(C)c(OCCCN2CC[C@H](CC(=O)O)c3ccccc32)cc1C 1776186133 BPYDVHQECYFKEF-OAQYLSRUSA-N 393.527 5.269 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2sc3ccccc3c2Cl)c1)C(=O)O 1776472558 DZUYCNHIMXLTMT-PRDAAYKISA-N 386.856 5.303 30 20 GKED CCc1cccc2c1OC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1776977646 VOLVIWRAKVVESB-ATVHPVEESA-N 390.460 5.334 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc1C(=O)O 1777361038 PFMRNTZRDJILHX-SDQBBNPISA-N 382.481 5.324 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(-c3ccco3)n2)n1 22518806 YLIDVNLNMBMZJU-UHFFFAOYSA-N 381.404 5.289 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCc1ccc(C(F)(F)F)cc1 25731609 KJCUIAHCOZIWET-UHFFFAOYSA-N 394.396 5.217 30 20 GKED CC(=O)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 41548757 MEHOZTZTYGKERT-SNVBAGLBSA-N 394.399 5.069 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(COCc2ccco2)c1 56630541 WGTREZGJRROAQP-UHFFFAOYSA-N 394.446 5.356 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(OC(F)(F)F)cc1 66801046 PRONTGYRLQPFBI-ZDUSSCGKSA-N 394.418 5.161 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)ccc1Br 66802340 SQCPDXJKSOPPKS-NSHDSACASA-N 393.281 5.235 30 20 GKED Cc1nc(/C=C/c2ccc(C#N)cc2)sc1C(=O)/C=C\c1ccc(C#N)cc1 96402174 WMJMEHALUHVKRE-PJABCKPXSA-N 381.460 5.261 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F 106771757 NJJIWCHJFOJNJX-UHFFFAOYSA-N 393.849 5.097 30 20 GKED Cc1[nH]c2ccccc2c1CCNC(=O)Nc1ccccc1SC[C@H](C)C#N 108531913 ZISKOSZGJQZHRG-OAHLLOKOSA-N 392.528 5.092 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)sc2cccc(F)c12 114619530 XHWXSZBAZNFTJK-ZDUSSCGKSA-N 393.468 5.357 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C)(C)c1cccs1 115026810 VJGBNBWSAVFVFN-UHFFFAOYSA-N 377.469 5.032 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(F)cc3OCC#N)s2)c(C)c1 120774319 DBHLWCGKMXEIFP-UHFFFAOYSA-N 395.459 5.029 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1ccc(N(C)CCC#N)cc1 160428269 PKFIIESVROLVCY-UHFFFAOYSA-N 394.519 5.304 30 20 GKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 171402674 PBHLCODUDFSOEQ-DLBZAZTESA-N 381.426 5.438 30 20 GKED CCc1cnc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 173052700 PHUQJDRYCRGQEG-UHFFFAOYSA-N 379.510 5.122 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](C)C(=O)c1cccc(F)c1 174730091 JZWXNXQOLLNMGV-GJZGRUSLSA-N 384.476 5.068 30 20 GKED C[C@@H](CN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nccs1 183659063 ATCLNGDCZKQMLJ-HNNXBMFYSA-N 392.484 5.074 30 20 GKED N#CCc1ccc(NC(=O)N2CCc3ccccc3[C@@H]2Cc2ccccc2)cc1 186536332 XWTKKTDKRBYAGA-DEOSSOPVSA-N 381.479 5.127 30 20 GKED C=CCC1(C(=O)Nc2ccccc2[C@@H](C)NC(=O)C2(CC=C)CCC2)CCC1 189858423 BVVJJFUEDLTQRL-GOSISDBHSA-N 380.532 5.295 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@]3(CC=CCC3)C2)cc1 303604333 VNBLIUFSTUJWIM-RUZDIDTESA-N 386.495 5.100 30 20 GKED O/C(CC1CCCCC1)=N/C1CCC(c2nc([C@H]3CCCS3)no2)CC1 329549127 BKMWZPAJUJVYCF-OFLPRAFFSA-N 377.554 5.591 30 20 GKED Cc1csc(-c2cccc(N=C(O)N3CCC[C@@H]3c3csc(C)n3)c2)n1 330132798 GEFMZJYCIRUJSO-QGZVFWFLSA-N 384.530 5.266 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H]1CCCC(F)(F)C1 409996749 HBAFUIWWWJQPTI-JQWIXIFHSA-N 389.286 5.251 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425660394 XGFFOJLKVRBNMX-HOTGVXAUSA-N 378.501 5.035 30 20 GKED N#CCCC[C@H](NC(=O)NCC1(c2ccccc2Cl)CC1)c1ccccc1 431457523 JEZJXORTAIGDOI-FQEVSTJZSA-N 381.907 5.106 30 20 GKED N#CCC1(CNC(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)CC1 431971429 UCHGZKCQDFLNIQ-UHFFFAOYSA-N 389.377 5.313 30 20 GKED CC(C)(C)OC(=O)CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 433600880 WBCZABBVHCFMHH-GOSISDBHSA-N 398.890 5.056 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 433855886 VTHZAWFZINSHPH-LWYUSKRHSA-N 393.453 5.202 30 20 GKED N#Cc1ccc(C2(c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)CC2)cc1 435999501 YIOXZWXTKJOKRA-UHFFFAOYSA-N 398.397 5.015 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cccc(-c3ccccn3)c2)cc1 437251298 ZPVXJBJJSOCSJC-UHFFFAOYSA-N 383.495 5.175 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1C[C@H](c2ccccc2)C1 437448957 QERQRFSXRDMZCO-MXVIHJGJSA-N 384.504 5.385 30 20 GKED Cc1cccc(COc2cccc(NC(=O)NCC3CCC(C#N)CC3)c2)c1 441660260 RWCOPAPPMRJIPE-UHFFFAOYSA-N 377.488 5.026 30 20 GKED CC(C)(C#N)CCCCN(Cc1cccc(Br)c1)C1CCOCC1 444675538 NVQFULICHDKLCL-UHFFFAOYSA-N 393.369 5.150 30 20 GKED C=CCCCC[C@H](C)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 449249386 LWKKBIJPFWFWIJ-INIZCTEOSA-N 382.470 5.035 30 20 GKED CC(C)N(Cc1cccc(Cl)c1)C(=O)Nc1ccc(CC#N)cc1Cl 455696901 DCCLOMFATIMDEF-UHFFFAOYSA-N 376.287 5.502 30 20 GKED CC1CCC(OC2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)CC2)CC1 458795834 DAWQXRXAOZGZLD-IRSIHTCSSA-N 397.563 5.191 30 20 GKED Cc1cc(Br)c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)s1 459347804 LIIQZPDONVEICG-SECBINFHSA-N 383.336 5.063 30 20 GKED CC(C)(C#N)CCCN1CCN(CCCC(C)(C)C#N)[C@H](c2ccccc2)C1 459503739 FPCDQLMMOAJDMU-QFIPXVFZSA-N 380.580 5.005 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1Cl 461046303 PFFMZCOECCTPHN-VYDXJSESSA-N 379.674 5.131 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ncccc2OCCCC#N)c1 466610665 QQNGOEAGCIUEEO-FQEVSTJZSA-N 392.503 5.222 30 20 GKED CSCCc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 468767522 ATZTWZXHWROXHG-UHFFFAOYSA-N 377.513 5.103 30 20 GKED CN(CCc1cccc2ccccc12)C(=O)c1cn(CCCC#N)c2ccccc12 469119893 XIUGSDDXRQUNFR-UHFFFAOYSA-N 395.506 5.413 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccccc1C(F)(F)F 473772896 AMIZOGZQMHAEHI-UHFFFAOYSA-N 383.435 5.358 30 20 GKED CC[C@H](CC#N)NC(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 475001920 LXVXAPZVCJEOSN-LLVKDONJSA-N 380.926 5.070 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)Oc1cccc(OC)c1 475576200 VKTJZBCYNRDIOC-QGZVFWFLSA-N 382.504 5.136 30 20 GKED C=CCCC1(C(=O)N[C@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)CC1 475788152 BFLADCLNINPQEY-SFHVURJKSA-N 382.529 5.059 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 476149001 NBWCSFSVRIFXEW-VQTJNVASSA-N 387.445 6.300 30 20 GKED CO[C@@H](C)c1nc(CSCc2ccc(-c3ccccc3C#N)cc2)cs1 476941979 DUBGAVJGCLSLFC-HNNXBMFYSA-N 380.538 5.823 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)[C@H](C#N)c3cnc4ccccc4n3)o2)c1 483200253 KYJASNUYLFRTHF-GOSISDBHSA-N 381.435 5.503 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 485602955 GMEXDVNFRUWOEW-DEOSSOPVSA-N 399.494 5.523 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1 492805062 FUMFYAZIQUVCFZ-CABCVRRESA-N 396.478 5.021 30 20 GKED C=CCC[C@H](NC(=O)N(CC(=C)C)Cc1cnn(C(C)C)c1)c1ccccc1 500179725 GLKPOGCTRYTXTJ-QFIPXVFZSA-N 380.536 5.259 30 20 GKED Cc1cc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2ccccc2Cl)ccc1F 508410768 GJZNJNQFBJYZLF-HXUWFJFHSA-N 399.897 5.212 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(C#N)cc1F 512619777 NCIKKXVPCVTYPH-GFCCVEGCSA-N 383.810 5.369 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)Cc3csc4ccccc34)s2)cc1 514042048 ZTCLVDCTRDYZEI-UHFFFAOYSA-N 389.505 5.001 30 20 GKED CCN(CC)Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 515534169 RDWZQUBTFJWIME-FQEVSTJZSA-N 389.524 5.142 30 20 GKED Cc1c(C(=O)NC2CCC(Oc3ccccc3C#N)CC2)oc2c(C)cccc12 517665524 FQYRQTFQPRROJL-UHFFFAOYSA-N 388.467 5.041 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](C)c2oc3ccc(OC)cc3c2C)c1 518580377 UZSVXEBZBWTBRZ-OAHLLOKOSA-N 380.444 5.197 30 20 GKED COc1cccc(SCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 521792495 KHFUVNXVTDXXKL-UHFFFAOYSA-N 390.464 5.090 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC2(c3ccccc3F)CC2)cc1 523014856 LSUWOJACHKGEMO-UHFFFAOYSA-N 387.414 5.300 30 20 GKED N#C[C@H](NC(=O)c1ccc(F)cc1Cl)c1ccc(OCc2ccccc2)cc1 524109834 ZANRKRJBARAGJD-NRFANRHFSA-N 394.833 5.053 30 20 GKED N#C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C1CCCCC1 524534322 NJIMEVGMLMAIOE-OAQYLSRUSA-N 389.524 5.009 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3c3cccs3)c2)cc1 524664578 SKKRSTSDBWBKBR-HXUWFJFHSA-N 389.480 5.781 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(=O)n(-c2cccc(F)c2)c1 530560154 CWMHHZRYGQNXAF-UHFFFAOYSA-N 390.458 5.081 30 20 GKED N#CCc1ccnc(NC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)c1 531670357 HZVBSTDXFWKXGQ-UHFFFAOYSA-N 393.899 5.346 30 20 GKED CC(C)(C)C[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 537114497 UKCNUHZHCBMSJE-LJQANCHMSA-N 394.906 5.529 30 20 GKED N#C[C@@H](C(=O)c1cccc2ncccc12)c1nc(-c2c(F)cccc2F)cs1 537261785 DATMFJTXDCBNEG-AWEZNQCLSA-N 391.402 5.127 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 538073060 GBGSVYRWMGYQBA-KRWDZBQOSA-N 391.298 5.303 30 20 GKED CC(C)C[C@H]1C[C@@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 539718496 SVPCYXDRGNHZMK-UGKGYDQZSA-N 393.487 5.066 30 20 GKED CCCCc1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 541036691 WAJYDQQYOPQNNW-JOCHJYFZSA-N 395.572 5.515 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC(CC#N)CC1 541042607 MQBRWYJHBRSBOR-SFHVURJKSA-N 377.488 5.293 30 20 GKED N#CCCCOc1cccnc1NCc1csc(-c2ccc(Cl)cc2)n1 545221149 ADAQYGAEZDPMEM-UHFFFAOYSA-N 384.892 5.153 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1cccc(-c2cscn2)c1 562533438 CHDDQFIUBHVVOF-UHFFFAOYSA-N 395.487 5.529 30 20 GKED COc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(Br)c1 565882746 FZZUWZGMKJHWCD-QRWLVFNGSA-N 387.321 5.543 30 20 GKED CCC(C)(C)C1CCC2(CC1)C[C@@H]2C(=O)N1CCC(C#N)(c2ccccn2)CC1 583743981 FQGXGOAGBBNDTG-ITGJCUMNSA-N 393.575 5.098 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)c1 589381989 HPLKZURGZDZOLR-UHFFFAOYSA-N 386.373 5.461 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3ccc4ccccc4n3)sc2c1 591020062 JTTLOEHAOVRAAC-OAHLLOKOSA-N 376.868 5.901 30 20 GKED C=CCC1(NC(=O)Nc2cccc(C[S@](=O)c3ccccc3)c2)CCCC1 596745823 HEZGOKLKHBGMPA-MHZLTWQESA-N 382.529 5.005 30 20 GKED Cc1ccc(-c2ccc(CN(C(=O)CC3(C#N)CCOCC3)C(C)C)s2)cc1 596926340 SXIYAICQAAFHHM-UHFFFAOYSA-N 396.556 5.171 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCc1cccc(OC2CCCC2)c1 609016708 WHLMIAPEARAPBC-UHFFFAOYSA-N 388.511 5.027 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609682686 WDEMLKGEGCTBBJ-PXNSSMCTSA-N 398.466 5.155 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1ccccc1C(F)(F)F 610228156 ORMQUGDARBIDJT-UONOGXRCSA-N 392.446 5.842 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(Br)c2)CCCC1)c1cccc(C#N)c1 610360824 HZDZYDFPTIRDEG-OAHLLOKOSA-N 397.316 5.010 30 20 GKED COc1ccc(F)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320225 VBJQQLSSFUASSJ-HNNXBMFYSA-N 386.835 5.101 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2COCc2ccccc2)n1 626355952 KBQOQKRBKWAHRF-HXUWFJFHSA-N 390.508 5.473 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H]1c1ccc(Br)cc1C 629079374 SNCSLOMNSFKFKP-IBGZPJMESA-N 394.353 5.184 30 20 GKED C=CCC[C@H](NC(=O)CCCc1ccccn1)c1ccc(C(F)(F)F)cc1 676731382 XFJFMQSWHDPMJN-IBGZPJMESA-N 376.422 5.247 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 679978399 YFBGWECDYKGOPH-QFIPXVFZSA-N 390.442 5.264 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)N[C@@H]1CCCC[C@@H]1C 727978214 CMWQWNJXHYIUFA-HRAATJIYSA-N 393.556 5.311 30 20 GKED C#CCOc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1 733323195 NZWKZDZFNRBXCD-QHCPKHFHSA-N 393.433 5.179 30 20 GKED N#CCOc1ccc(COC(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)cc1 733413548 KICGLUZAIQOIBS-BAQGIRSFSA-N 395.764 5.018 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3c(F)cccc3F)o2)cc1NC(C)=O 734368637 VYGMKACGEJMSHX-CLFYSBASSA-N 397.377 5.088 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@H](C)c3ccc(C(F)(F)F)cc3)[nH]c12 735792117 HUNFPWOKTFDLSM-BBRMVZONSA-N 385.389 5.260 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)c(SC)cc1OC 741165224 IECJJFUBEAMYFU-RMKNXTFCSA-N 382.403 5.341 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3cccc(Cl)c3)n2)cc1 744061131 GWCMYHSPKAUWGJ-UGSOOPFHSA-N 396.899 5.452 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc2c(c1)-c1ccccc1C2)c1nc2ccccc2o1 747559051 IXOIZUPUXZYJSP-QFIPXVFZSA-N 392.458 5.598 30 20 GKED N#CC1CCC(COC(=O)CCSc2ccnc3cc(Cl)ccc23)CC1 755955359 KCSASWPBXICPCX-UHFFFAOYSA-N 388.920 5.244 30 20 GKED C#CC[C@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 757764665 YIWIMXGHUUBQEA-RXVVDRJESA-N 392.549 5.231 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(F)c(SC)c2)cc1 766623435 QXZWXSWTELVXHU-CXAGYDPISA-N 384.476 5.022 30 20 GKED Cc1oc(-c2ccccc2)nc1COC(=O)c1cn(CCCC#N)c2ccccc12 769545821 BXHGEWXTAFCWFT-UHFFFAOYSA-N 399.450 5.266 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2c(F)cccc2Cl)cs1 769827372 VFCMBRLIFJGTGQ-UHFFFAOYSA-N 388.855 5.066 30 20 GKED CC(C)Oc1ccc(NCC(=O)Nc2ccccc2-c2ccccc2)cc1C#N 771879805 FSGUVXCEEGYCHS-UHFFFAOYSA-N 385.467 5.063 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)cc(OC)c1OC 772953745 LYEFLGIJCZTZLN-SFHVURJKSA-N 388.511 5.345 30 20 GKED C=C(C)[C@@H](NCc1ccc(NC(=O)OC(C)(C)C)nc1)c1ccc(F)c(F)c1 775319389 TVPOKIVSLCMCCY-LJQANCHMSA-N 389.446 5.114 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(-c2ccncc2)cc1 775526196 IVPSYKCRAMMIIN-INIZCTEOSA-N 377.875 5.155 30 20 GKED CCOC(=O)Nc1ccc(NCc2cnc(-c3ccc(C)cc3)s2)cc1C#N 779603054 CVUVIOMJWHMFAF-UHFFFAOYSA-N 392.484 5.171 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780678690 QMLCOWAGYDBQML-HFSMHLIXSA-N 377.488 5.086 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C\c1ncc(C(F)(F)F)s1)C2 788355987 SSCXOSNASYIHET-UITAMQMPSA-N 388.208 5.055 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 793042051 FNWBDRSOYGEOTD-LADGPHEKSA-N 379.463 5.368 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccccc1 793135980 PQBICHWBDGIWOI-SFHVURJKSA-N 381.907 5.356 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCCc2cccc(C(F)(F)F)c2)s1 797571751 PPCVZLZHOVDLIC-HNNXBMFYSA-N 394.462 5.659 30 20 GKED Cc1cccc(-c2nnc(-c3ccc(C(=O)OCC(C)(C)CCC#N)cc3)o2)c1 798877871 LRANIERTQYMJOT-UHFFFAOYSA-N 389.455 5.199 30 20 GKED N#CCCC[C@H](NC(=O)NCc1cn(C(F)F)c2ccccc12)c1ccccc1 858894562 KANKWILJAFWFKF-IBGZPJMESA-N 396.441 5.271 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(-c3ccccc3)n2)cc1 915086008 FCJWTLSHIZWBMJ-NRFANRHFSA-N 395.487 5.718 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1C=NNc1ccccn1 916273839 UQXMFNGWMNGVBH-UHFFFAOYSA-N 394.693 5.041 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 920055901 WCSPKNFZHJGZNA-SBUREZEXSA-N 387.458 5.406 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H](C)Sc1ccc(Cl)cc1 920102344 SFCTYONETFVXHI-CXAGYDPISA-N 396.899 5.202 30 20 GKED CCO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805634 OKGKXOKTSFGOMP-JLTOFOAXSA-N 398.434 5.042 30 20 GKED CC(=NN=C(c1ccccc1)c1ccccc1)c1cnc2ccccc2c1C(=O)O 1776012348 ATXWDOLYWLKNDR-UHFFFAOYSA-N 393.446 5.195 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc4c(c3)CCCC4)cc2)cc1 1776113994 YFSRAZDCLLFVCP-APSNUPSMSA-N 382.459 5.827 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(OCC2CCC2)c1 1776355481 RJHIMCXLRYDHJE-LUAWRHEFSA-N 394.467 5.247 30 20 GKED CC(C)c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1[N+](=O)[O-] 1776372399 ARYCOKSBSUTVRA-MHWRWJLKSA-N 379.412 5.019 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(C[C@H](C)C(=O)O)cc2)cc1 1776788973 HPNGNDITXLHZHF-IBGZPJMESA-N 383.532 5.911 30 20 GKED COc1ccc(/C=C2\CCCc3ccc(Cl)cc3C2=O)c2cc(C(=O)O)oc12 1777359984 MPWWXRRISNIIQF-NTEUORMPSA-N 396.826 5.396 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3cccc(Cl)c3)cc2)oc1C(=O)O 1777423238 MZQGIQPVIIHDJH-JXMROGBWSA-N 396.826 5.415 30 20 GKED O=C1/C(=C\c2cccc(OCc3ccccc3)c2)C[C@@H](C(=O)O)c2ccccc21 1777698379 KCEWMACXPYSJOI-FYVGXUMQSA-N 384.431 5.104 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])sc2c1CCCCCC2 6329451 WGHXMPUJIAFWNB-UHFFFAOYSA-N 389.864 5.093 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(CC(C)C)cc2)=C(/S)NC(C)(C)C)cc1 55013998 AFINWGNRTDBGFN-UHFFFAOYSA-O 397.608 5.062 30 20 GKED N#CCCN(C(=O)CSCc1cccc(Cl)c1)c1cccc(Cl)c1 63126757 RBMANUZAUCFKFM-UHFFFAOYSA-N 379.312 5.173 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 66801601 IDOJMMCQKBNZTM-ZBFHGGJFSA-N 392.446 5.756 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1 66954787 DIBIIBLOHRNZOT-QVKFZJNVSA-N 395.528 5.362 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(\S)Nc2cc(C)ccc2F)cc1 68313844 PZERLSLHTKOAIP-UHFFFAOYSA-O 393.507 5.089 30 20 GKED N#Cc1ccc(CSCC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 108286999 JDQFFHFDBABQIR-JOCHJYFZSA-N 389.524 5.027 30 20 GKED CN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 115014712 BNXHKHPIIOIESJ-UHFFFAOYSA-N 399.475 5.024 30 20 GKED CSc1ccc(O[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 131803440 RKNINQAXRMOZMO-LSDHHAIUSA-N 386.542 5.066 30 20 GKED Cc1nc(NC(=O)CCCCCO[C@H]2CCC[C@@H](C)C2)sc1SCC#N 159619933 WHEBHAQBCYWMKO-ZBFHGGJFSA-N 395.594 5.161 30 20 GKED Cc1ccc(-c2c(C)sc3nc(CSCCCCC#N)[nH]c(=O)c23)cc1 161095455 LOFHGVQKPVJOQR-UHFFFAOYSA-N 383.542 5.196 30 20 GKED CC[C@H](C)c1ccc([C@@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 175502621 GVSJBUZPLWTFIN-SBUREZEXSA-N 388.515 5.609 30 20 GKED Cc1c([C@H](C)Nc2cccc(OCCCC#N)c2)nnn1-c1ccc(Cl)cc1 179819322 IHLJRQHOUAUNKY-HNNXBMFYSA-N 395.894 5.085 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc(C2(C#N)CC2)cc1 179823632 MAQXBJDFQFKRKI-HNNXBMFYSA-N 387.508 5.165 30 20 GKED COc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1OC1CCCC1 182636921 VZGQICXZCZLPKY-UHFFFAOYSA-N 396.512 5.275 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccsc2Cl)cc1 189502958 OJPABJVEOOAHLF-UHFFFAOYSA-N 384.913 5.818 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccccc2)cc1OCC 189906494 JKVGLTAVMOUNNX-UHFFFAOYSA-N 389.499 5.375 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 191518496 VFBAINMAJAJYHK-IFMALSPDSA-N 378.516 5.580 30 20 GKED C[C@@H](Oc1ccc(-c2ccc(C#N)cc2)cc1)c1nc(Cc2ccccc2)no1 303954713 WTZUCDXZKMAWNX-QGZVFWFLSA-N 381.435 5.339 30 20 GKED CCC(O)=Nc1ccc(C)c(N=C(O)NC2[C@H]3CC[C@H]2Cc2ccccc2C3)c1 329493675 WQAQJNKQMQTFTI-OALUTQOASA-N 391.515 5.322 30 20 GKED OC(=Nc1ccccc1)c1cc(N=C(O)N2CC[C@@H]3CCC[C@H]32)ccc1Cl 330231074 DUXVALVDEXMTTI-IFXJQAMLSA-N 383.879 5.396 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425659826 WGJXLOGRURNHQJ-JKSUJKDBSA-N 378.501 5.177 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430585121 QZBBKQLVWOBCON-CQSZACIVSA-N 376.909 5.371 30 20 GKED Cc1c(C(=O)Nc2ccc(-c3nccs3)cc2)sc2ccc(C#N)cc12 431355117 HXKMVHSLCFVNNC-UHFFFAOYSA-N 375.478 5.457 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 431465547 OOXBUWWPFOPYEK-NHCUHLMSSA-N 383.442 5.316 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)Nc1ccc(F)c(C#N)c1)C1CC1 437969429 IORUYVKTIJKUFG-GFCCVEGCSA-N 391.368 5.474 30 20 GKED C=C(C)COc1cccc(NC(=O)NC[C@H]2CCCO[C@@H]2c2ccc(C)cc2)c1 438126952 ZMLQMZJQSMBFCU-NFBKMPQASA-N 394.515 5.239 30 20 GKED Cc1cncc(N(Cc2ccc(F)cc2)C(=O)C[C@H](CC#N)c2ccccc2)c1 441411471 NIWSYTAMSZAJFY-NRFANRHFSA-N 387.458 5.150 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccc(Br)s2)ccc1OC 443016138 VBAAMXCNPODHES-CYBMUJFWSA-N 396.350 5.325 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc3ccoc3c2)cc1 443371156 RBWJACQTTQUXIE-UHFFFAOYSA-N 399.425 5.678 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 444385724 XDGVJKLUUIMHIC-LBPRGKRZSA-N 395.356 5.403 30 20 GKED Cc1cccc2nc(C3CCN(C(=O)Nc4ccc(C#N)cc4Cl)CC3)oc12 444872812 JGOAMPVLAGVKRU-UHFFFAOYSA-N 394.862 5.073 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F 453086997 LOSSWXPKALNVQZ-LBPRGKRZSA-N 395.406 5.477 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455702359 LEGXLYCHFBYBOL-ZDUSSCGKSA-N 376.287 5.154 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1cccs1 465728815 XFPJSUYPTFQBQA-AABGKKOBSA-N 381.545 5.317 30 20 GKED CCN(c1ccccc1)c1ccc(CNC(=O)N(C)Cc2ccc(C#N)cc2)cc1 466245290 SQSXQXGSYMETEW-UHFFFAOYSA-N 398.510 5.058 30 20 GKED C=CCCN(C)C(=O)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 466668490 CZNGKLPOEBKUPU-UHFFFAOYSA-N 394.928 5.321 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1)c1ccccc1 472507226 VDCXOGKVRBBOFG-JXFKEZNVSA-N 381.435 5.193 30 20 GKED N#CC[C@@H](CC(=O)NCc1cccc(COCc2ccccc2)c1)c1ccccc1 474891996 HABJVDLPGUQKPW-VWLOTQADSA-N 398.506 5.107 30 20 GKED Cc1ccc(Cl)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 475466525 DMRVWLKBQDREIX-UHFFFAOYSA-N 392.911 6.065 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(Cc2ccccc2Cl)c1 476124404 URNQHIQXAZGTDF-UHFFFAOYSA-N 393.918 5.689 30 20 GKED C=CCN(C(=O)COCC1CC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 476129537 BWFUEDZNLXJTPC-UHFFFAOYSA-N 397.327 5.063 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc2ccccc2n1C(F)F)c1ccc(F)c(F)c1 480702923 XENSMQWIWKCOHZ-SGTLLEGYSA-N 377.385 5.678 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(OC(C)C)c1 482858790 LOFAKSYWSGZNQX-KRWDZBQOSA-N 386.517 5.333 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2c1 483199233 ONXNMCYCIFQUKT-NRFANRHFSA-N 377.447 5.459 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccccc2)cc1)c1nccc2ccccc12 483201382 PGNNVMZMDZEWCD-HSZRJFAPSA-N 378.431 5.304 30 20 GKED COc1ccc([C@H](NCc2cccc(C#N)c2)c2ccc(C(F)(F)F)cc2)cc1 486199693 VHNPXCUDLSXILM-JOCHJYFZSA-N 396.412 5.465 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Br)c(C)cc1C 486362936 ABAJJYJHIDMCGG-UHFFFAOYSA-N 398.304 5.158 30 20 GKED N#CCCC[C@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccccc1 487543622 PPHWZWGNWRAIIW-FQEVSTJZSA-N 386.948 5.764 30 20 GKED CC(C)CO[C@H](C)c1noc(CNc2ccc(Oc3ccccc3)c(C#N)c2)n1 488160455 SXKFVVYUBPJIES-MRXNPFEDSA-N 392.459 5.079 30 20 GKED CC[C@@H](c1ccc(F)cc1F)[S@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488805635 MTOTWZSPAHBFIN-YHAMSUFESA-N 398.343 5.662 30 20 GKED CCc1c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cnn1CCC(C)C 494864434 JNHCCCLZNAQUSI-UHFFFAOYSA-N 395.551 5.053 30 20 GKED N#CCCCn1cc(C(=O)N2CC3(CCC3)[C@H]2c2ccccc2)c2ccccc21 495443218 BHOAARNOSSVEIN-HSZRJFAPSA-N 383.495 5.312 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CSc2ccc(C#N)cn2)cs1 498160250 BDUVDOQIGSMJON-UHFFFAOYSA-N 394.525 5.004 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 499833486 LZRFGYVSMLLXSI-LRDDRELGSA-N 379.312 5.103 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@@H](C)Oc1ccc(C#N)cc1 500744940 QHOJDYKXGMFHID-QGZVFWFLSA-N 388.492 5.424 30 20 GKED N#CCCN(Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)Cc1ccco1 505776440 JHHLXGMOFSKDAA-UHFFFAOYSA-N 395.390 5.035 30 20 GKED C[C@H](Nc1ccc(C#N)cc1F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 506834416 WDIYNCQJAWEHFR-AWEZNQCLSA-N 377.394 5.262 30 20 GKED Cc1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2ccc(F)cc2Cl)cc1 508513720 SXBPZQYUCYTXBO-FQEVSTJZSA-N 399.897 5.212 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)c1 509227746 TWNHAFXGSXOYMT-UHFFFAOYSA-N 390.874 5.307 30 20 GKED C[C@H](Nc1ccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)cc1)c1ccccc1 510008625 VRQWGJTZHUBXAQ-KRWDZBQOSA-N 399.469 5.541 30 20 GKED N#C[C@@H](NC(=O)c1cccc(COc2cccc(F)c2)c1)c1ccc(Cl)cc1 511150774 QSDYZGVXGLZKCE-OAQYLSRUSA-N 394.833 5.053 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)Nc1ccccc1S[C@@H](C)CC#N 517517628 FKABMSTVSLPHKZ-RMJJICAUSA-N 388.577 5.497 30 20 GKED CN(C[C@@H]1CCCCO1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 518185752 SOWFBPCIKWJMLP-SFHVURJKSA-N 399.878 5.037 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)cc1 519026543 LNRGLIIOMZPERB-CVEARBPZSA-N 388.389 5.658 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc2c(c1)CCC1(CCC1)O2 529169520 GBGDLZXZDOXJOS-INIZCTEOSA-N 375.472 5.031 30 20 GKED C=C(C)[C@@H](CC(=O)N(CC)[C@H](c1ccc(Cl)cc1)c1ccccn1)OCC 533712156 FVUQNXKYCIQMNX-IFMALSPDSA-N 386.923 5.044 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 533924594 FHVNDPDCCBHEIR-LBPRGKRZSA-N 383.341 5.188 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)cc1 534684999 UNESLBMBDGDWBX-UHFFFAOYSA-N 379.419 5.345 30 20 GKED CCOc1cccc([C@@H]2C[C@@H]2NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 537256774 LNEJINIIPAELOW-QSFXBCCZSA-N 395.528 5.157 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)c1 540081656 SPUFMPWAIHBVNF-HXUWFJFHSA-N 395.462 5.129 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)CC1CCC(c2ccccc2)CC1 553434957 YLKVVVSNGBJROG-UHFFFAOYSA-N 381.516 5.041 30 20 GKED CCC[C@]1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOC1 554133697 CRVWMDYNSSQTLI-UGKGYDQZSA-N 397.906 5.076 30 20 GKED N#CCc1ccccc1NC(=O)c1cccc(OCc2cccc(Cl)c2)c1 561798526 ZRURNMRFXNLTLM-UHFFFAOYSA-N 376.843 5.237 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC23CCC(CC2)CC3)cc1 579558258 VUVBRXRCQXLBLI-UHFFFAOYSA-N 389.499 5.176 30 20 GKED C[C@H](NCc1ncc(-c2ccccc2)[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 581766015 NHZACRUVEQLMDR-SFHVURJKSA-N 378.479 5.466 30 20 GKED C=C(CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 588237455 BTJOCXFUCRDFER-UHFFFAOYSA-N 397.478 5.167 30 20 GKED N#CCCC[C@H](NC(=O)c1cccc(Oc2nccs2)c1)c1ccccc1 590477673 GPUSIHMCBJQQGT-IBGZPJMESA-N 377.469 5.100 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 598229637 FDSWFPSISRYHPI-QFIPXVFZSA-N 391.515 5.094 30 20 GKED N#CCCC[C@@H](NCc1ccc(Br)c(F)c1F)c1ccccc1 598980729 PRLDCVBPHARJNX-MRXNPFEDSA-N 379.248 5.252 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCc1ccc2ccccc2c1 603956202 CWTJTEYVSGXRTI-UHFFFAOYSA-N 380.447 5.470 30 20 GKED N#Cc1c(NC(=O)c2ccc3ncsc3c2)sc2c1-c1ccccc1CC2 603992502 WPOSPRGLTZEVGA-UHFFFAOYSA-N 387.489 5.247 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 605236080 HYNJTJZAEHUTEL-CQSZACIVSA-N 393.314 5.461 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 609435218 YZKUFGBKNPXVOX-DEPCRRQNSA-N 397.588 5.903 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc(C#N)c1 610322167 KACLDHZTOSJSGO-MRXNPFEDSA-N 382.423 5.105 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@H](CCC#N)c2ccccc2)c2ccccc2)cc1 610973733 DCFILXZODKDNOP-RPWUZVMVSA-N 399.494 5.129 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC[C@](C)(C#N)C3)o2)cc1 612366667 UAKMVNAMRPZZBY-XMMPIXPASA-N 385.467 5.083 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3nccc4ccccc34)s2)c(C)c1 682995440 WBCVNGWQHMMQSR-IBGZPJMESA-N 383.476 5.465 30 20 GKED Cc1cccc(COc2ccc(NC(=O)NCc3ccc(C#N)cc3)c(C)c2)c1 729877916 DWGCTPBPLOSNQV-UHFFFAOYSA-N 385.467 5.076 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1nc(-c2ccccc2)cs1 730085090 MZWIWOCHKSQZRL-SREVYHEPSA-N 380.519 5.891 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3ccc(Cl)c(C#N)c3)c(F)c2)cc1 730166146 KVPCPUGWPSTVPL-UHFFFAOYSA-N 380.806 5.279 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1nc2ccccc2s1 730688077 ZAEGHNPUQOHQNF-MELADBBJSA-N 387.291 5.583 30 20 GKED N#CCSc1ccccc1C(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl 733273030 IZWFCRGFCZOVNZ-OAHLLOKOSA-N 377.296 5.026 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(SCC(F)(F)F)cc1 741845036 XSPHOTGJOOZQIR-VOTSOKGWSA-N 395.233 5.277 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)ccc1SC 746342449 UTGFIGKNVATJHX-OQFOIZHKSA-N 394.448 5.271 30 20 GKED COc1cc(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)ccc1SC 747614336 DYBLCYJFWAPKFG-KTKRTIGZSA-N 381.522 5.745 30 20 GKED CC(=NO[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1cc2ccccc2o1 747828204 VLVUNPOBINBNDU-CYBMUJFWSA-N 381.819 5.638 30 20 GKED CC(=NO[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1cc2ccccc2o1 749255520 BWRLYAOKCSRYHW-CYBMUJFWSA-N 390.361 5.219 30 20 GKED CCOc1cc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)ccc1O 750915069 BZSPFMQTPOPJDT-NTEUORMPSA-N 376.424 5.318 30 20 GKED CCCCCCCCNC(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 754866450 VBPAJVMUIMKWHC-STQMWFEESA-N 376.385 5.119 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@@H]4CCCC[C@@H]4C3)n2)cc1 756530160 SSUAWSPVNBDBMZ-MTFMMBMASA-N 389.524 5.465 30 20 GKED C#CC[C@H](NC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccccc1 757894151 GHWHHCVWKBQPDM-QFIPXVFZSA-N 389.499 5.092 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 757977017 DXCBQYRVGCIWIZ-INIZCTEOSA-N 381.476 5.327 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759181186 AOCLGLBXBHXGKW-LVMGUKCRSA-N 376.843 5.125 30 20 GKED C=CC[C@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1ccncc1 762220034 FPQKIYLYZQFXNA-WBILKINKSA-N 380.797 5.114 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NCc3ccc(OCC#N)cc3)cc2)c1 772959376 KZTCQOTYRJLBJA-HXUWFJFHSA-N 386.495 5.327 30 20 GKED C[C@H](N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(OCC#N)cc1 772961098 XPEVWWONIQDESN-SJCJKPOMSA-N 377.271 5.070 30 20 GKED CC[C@H](NC(=O)[C@H](C#N)C(=O)c1sc2ccccc2c1Cl)c1ccccc1 787034148 ZOFYNBZPHBNDMH-CVEARBPZSA-N 396.899 5.145 30 20 GKED Cc1nc(Cl)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 790243476 KVECSNMWLOUAAU-UHFFFAOYSA-N 381.794 5.099 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3ccc(C(F)F)cc3)cc2c1C 794936927 HEUCYLVSUFPWFV-VMPITWQZSA-N 387.407 5.225 30 20 GKED Cc1nc(/C=C/c2ccnn2C(C)C)sc1C(=O)/C=C\c1ccnn1C(C)C 794938422 PIWGHBJFNBKNOJ-MKKAVFGOSA-N 395.532 5.073 30 20 GKED N#C[C@H](C(=O)[C@@H](F)CC1CCCCC1)c1nc(-c2c(F)cccc2F)cs1 796668957 BTJMHDVRKLLUKW-CJNGLKHVSA-N 392.446 5.573 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ccccc2OC(F)(F)F)s1 797568487 SCTLUDWIMYIEDS-CYBMUJFWSA-N 396.434 5.148 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(NC(=O)OC)c1C 798028264 IMDKETAVDWPXRN-UHFFFAOYSA-N 393.896 5.108 30 20 GKED N#C[C@@H](C(=O)CCCC1CCOCC1)c1nc(-c2ccc(Cl)cc2)cs1 798816229 IRZJHGAPJPEXQV-KRWDZBQOSA-N 388.920 5.237 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2CCC(F)(F)CC2)cc1 800518984 ICLUZPFNDZKLKW-FQEVSTJZSA-N 383.442 5.289 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccncc1 812047563 HXEOJKBMGYVORF-PKOBYXMFSA-N 390.314 5.456 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813212335 BQDOOMRVEGEWQU-QGZVFWFLSA-N 390.405 5.143 30 20 GKED COCC1(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCCCC1 857010523 QBKDMUAFOIAJSI-CYBMUJFWSA-N 396.434 5.088 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 857439333 KCNOQTCZALRJOI-HNNXBMFYSA-N 393.302 5.393 30 20 GKED Cc1cccc(CSCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915088234 LTAUZHNEWXKQEU-QHCPKHFHSA-N 386.520 5.522 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352864 OGAALYJTOPTSOD-JTHBVZDNSA-N 384.483 5.050 30 20 GKED Clc1nc(Oc2ccccc2)sc1C=NNc1ncnc2sccc12 915954957 RDEILAOLLVQDIA-UHFFFAOYSA-N 387.877 5.040 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC 916137371 ZLZVYBDVGPRYES-DAXSKMNVSA-N 396.226 5.205 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3cc4ccccc4o3)c2)cc1 916138418 NKVNTUWPVMDSDT-NTEUORMPSA-N 397.430 5.590 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2c(Cl)cccc2Cl)cc1 916546514 VXFLDWNTPJDZLQ-UHFFFAOYSA-N 397.718 5.413 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCSc2ccc(F)cc2)cc1 916949034 ZYFBRSCLJILQRX-MGPUTAFESA-N 398.503 5.169 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804235 MQTBBJKTAXTIAR-DZGCQCFKSA-N 382.435 5.458 30 20 GKED Cc1cc(NN=Cc2cccc(OCc3cccc(C(=O)O)c3)c2)ccc1Cl 1776104791 YMKAYXWLNOWTOL-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(C)c(F)cc1Br 1776784154 UXBIXRFYYHNWHN-HNNXBMFYSA-N 388.321 5.190 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(C[C@@H](CC)C(=O)O)cc2)c1 1776787582 FOQJOLJBNCORAJ-JOCHJYFZSA-N 397.559 6.301 30 20 GKED CCCCCCOc1cccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)c1 1776790293 LDJWNZAFJGGIOU-JIDPPIHHSA-N 378.468 5.484 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc(F)c(C(=O)O)cc3F)s2)cc1 1777430587 LVOUPCGJOWPSOX-FPLPWBNLSA-N 399.418 5.299 30 20 GKED Cc1ccccc1-c1cccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)c1 1777461748 NQJWVICQHNKXFX-QNGOZBTKSA-N 382.459 5.963 30 20 GKED N#Cc1ccc(F)c(CSc2nnc(-c3ccco3)n2C2CCCCC2)c1 11152410 OVVLMUCSTVDFLI-UHFFFAOYSA-N 382.464 5.346 30 20 GKED N#Cc1ccsc1NC(=O)CSc1ccc(Cl)c(C(F)(F)F)c1 15127064 KHQYGYRZKNCDGK-UHFFFAOYSA-N 376.812 5.023 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)cc1 29151195 BTHBZNFQQCFGJW-UHFFFAOYSA-N 395.915 5.446 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1nc2ccccc2[nH]1 41495400 KWQVWLNFTQOQAO-HXUWFJFHSA-N 393.446 5.069 30 20 GKED N#CCCCOc1cccc(NCc2ccc(C(=O)Nc3ccccc3)cc2)c1 55876833 RJQYWEBPABAQOM-UHFFFAOYSA-N 385.467 5.234 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 61332506 GOBOOKIMHDUJRM-ZHRRBRCNSA-N 389.886 5.361 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1COc1ccccc1 66160587 KHEAMLBJXOVEIC-UHFFFAOYSA-N 399.494 5.580 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1Cl 66956267 GLUCLZGVCJTYFF-LSDHHAIUSA-N 387.936 5.959 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1 67813089 UGPVNFQADKFIQC-YADHBBJMSA-N 384.504 5.136 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCn1cnc2ccccc21 72025265 LIOOVPPABYLFBP-UHFFFAOYSA-N 396.450 5.038 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 97169160 FYWICMMIQBELNB-UXHICEINSA-N 386.417 5.118 30 20 GKED Cc1ccccc1-c1nnc(SCc2ccccc2C#N)n1Cc1ccco1 98074162 RMSCCZQPLOXXBD-UHFFFAOYSA-N 386.480 5.059 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(OC(F)(F)F)cc1 108200224 HBGTVZZAQORKSZ-UHFFFAOYSA-N 394.418 5.162 30 20 GKED N#C[C@H](C(=O)[C@@H]1CSc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 118600136 KSUKEJZFCHUOKP-CHWSQXEVSA-N 398.459 5.154 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nnc(-c2ccccc2Cl)o1 133835465 MRYCCDOIWUQOOI-CYBMUJFWSA-N 384.892 5.254 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 150968538 CNVXHCOBAOAVDZ-AEFFLSMTSA-N 397.519 5.174 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCOc2c(F)cccc21 181712453 KDCILQUBDKDSKZ-YOEHRIQHSA-N 399.491 5.113 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1coc(-c2ccc(F)cc2)n1 189894519 FCQSPHWXKQNWFJ-UHFFFAOYSA-N 378.447 5.514 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1coc(C2CCC2)n1 194319332 ALTOMRZWEGYRJN-UHFFFAOYSA-N 395.406 5.219 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 237602516 GJGVQCQZMDLDRO-MSOLQXFVSA-N 390.458 5.760 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CNCc1cccc(C#N)c1 237712055 KPWKKWLPMSKRJN-UHFFFAOYSA-N 378.479 5.009 30 20 GKED N#Cc1ccccc1/C=C(\Cl)c1nc(O)c2c(-c3cccs3)csc2n1 255116608 QVEOUQUIUZVRDB-ZSOIEALJSA-N 395.896 5.734 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)c2cccc(SCC#N)c2)c1C 429857303 JJDVBIDSWOEFML-UHFFFAOYSA-N 389.480 5.359 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCc4ccc(F)cc4C3)cc2)c1 434222143 FTQDMFOCJGCAAZ-UHFFFAOYSA-N 387.414 5.080 30 20 GKED C=CCN(C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C1CC1 444036379 SWZBELQDLABRBA-CQSZACIVSA-N 380.332 5.059 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(C[S@@](=O)C(C)(C)C)c2)CCCC1(C)C 444903962 ZIZKQGLMLHHJOG-XHCCPWGMSA-N 390.593 5.332 30 20 GKED C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 469525851 UBWXFICTUHENFE-TZIWHRDSSA-N 385.511 5.038 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(CNc3ccccc3)cc2)cc1OC 478812874 LFDKOCCPWGFDCP-UHFFFAOYSA-N 388.467 5.124 30 20 GKED CCCCOC1CCN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)CC1 480061327 XSYLUVRQKVWKAJ-UHFFFAOYSA-N 394.540 5.131 30 20 GKED CCSc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 480939350 IUIOZAMWDLOCIC-SFHVURJKSA-N 394.521 5.421 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](C4CC4)C3)cc2Cl)cc1 482951690 CBNVNDQPEZBOOR-MRXNPFEDSA-N 381.863 5.268 30 20 GKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)csc2c1 483511195 CHPRMMIIQAOZEZ-QGZVFWFLSA-N 399.500 5.695 30 20 GKED Cc1sc(NC(=O)C2(c3ccc(Br)cc3)CCC2)c(C#N)c1C 483759718 PYHVPCUSDHXSND-UHFFFAOYSA-N 389.318 5.060 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1C 484079828 GAPACXQPZXLTOI-UHFFFAOYSA-N 392.890 5.196 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccc(CC(F)(F)F)cc1 487375414 HOGVPLMNYQOLJE-UHFFFAOYSA-N 380.435 5.120 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)N[C@@H](CCCC#N)c3ccccc3)c2c1 487597494 VNHIHFPALZYHQH-QFIPXVFZSA-N 399.494 5.286 30 20 GKED C=CCN(Cc1cccs1)[C@H](C(=O)Nc1cccc(OC)c1)c1ccccc1 499056268 PWSVFCSIKNMDAK-QFIPXVFZSA-N 392.524 5.125 30 20 GKED Cc1cc(F)ccc1N(CCCC1(C#N)CCOCC1)Cc1ccc(C#N)cc1 499545384 OWSYKMCUUBXAIJ-UHFFFAOYSA-N 391.490 5.113 30 20 GKED N#CC1(CCCN[C@H](Cc2ccccc2Cl)c2ccccc2)CCOCC1 499599325 CFYGRSJRZQHLCF-JOCHJYFZSA-N 382.935 5.314 30 20 GKED C=CCOc1cccc(NC(=O)Nc2cccc(COCc3ccco3)c2)c1 502648713 OZQQUFOVIAQPKP-UHFFFAOYSA-N 378.428 5.205 30 20 GKED CC[C@H]1C[C@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCO1 502924265 HGZTUFBGWGEZAQ-WBVHZDCISA-N 384.863 5.148 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 505046637 WVFQPSKPENZXHP-KRWDZBQOSA-N 393.462 5.497 30 20 GKED C[C@@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(F)(C#N)CC1 510936602 MISPFXHZYOBITC-INIZCTEOSA-N 396.897 5.127 30 20 GKED N#CCCCOc1cccc(NCC(=O)N(c2ccccc2)C2CCCCC2)c1 511091814 HBZYWIPODBHBKP-UHFFFAOYSA-N 391.515 5.147 30 20 GKED Cc1cc([C@@H](C)Nc2cccc(OCCCC#N)c2)sc1Br 512136061 PNLUZPJAWRWCKL-CYBMUJFWSA-N 379.323 5.675 30 20 GKED Cc1ccccc1CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 512803582 YBDQIJUFXYJZTL-UHFFFAOYSA-N 385.467 5.631 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(Br)cc2F)cc1OC 513048107 XSNKSXUOUANCDJ-CYBMUJFWSA-N 394.284 5.012 30 20 GKED C[C@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1ccc2n[nH]cc2c1 513192836 SCGMGNDRDYLRNZ-IBGZPJMESA-N 380.495 5.113 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1C 513333774 QAXLKQOGDLPEEA-QHCPKHFHSA-N 392.478 5.610 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)N(Cc1ccco1)c1ccccc1C#N 515636885 REKQCORRZFYMBT-HNNXBMFYSA-N 396.899 5.519 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 520195799 MKEQHZTZXNUAIQ-FOIQADDNSA-N 399.535 6.129 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1oc2ccc(OC)cc2c1C 521246155 PLNLKWADXOXVJQ-QGZVFWFLSA-N 378.472 5.209 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N(Cc1ccco1)C1CCCC1 522070853 NJQJGQQCCDSYIG-UHFFFAOYSA-N 385.467 5.051 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 522702650 WNUXGDXKKCZQPN-YLJYHZDGSA-N 381.501 5.146 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 524258496 QBFGZPASQPWZBR-MJGOQNOKSA-N 390.936 5.019 30 20 GKED CC[C@@H]1CCC[C@@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 524724631 GMYXSAFMVKZGKC-YLJYHZDGSA-N 378.541 5.549 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H](c3cccnc3)C3CC3)cc2)c1 533996910 OYBJCGVKRLQVID-QFIPXVFZSA-N 384.439 5.018 30 20 GKED N#Cc1cccc(CC(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 537994644 FGBGFYAFIIFDQT-IBGZPJMESA-N 392.808 5.040 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)Nc1cc(C#N)ccc1OC(F)F 538190006 CFIIRGLSRHZDQU-UHFFFAOYSA-N 391.443 5.225 30 20 GKED COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)c2cccc(CC#N)c2)c1 541441609 HWEVAEJMJANYKM-LOSJGSFVSA-N 396.490 5.132 30 20 GKED Cc1ccccc1C(NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1C 545500325 OIPUQIQMHJYCGM-UHFFFAOYSA-N 383.495 5.106 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1)[C@H](C)c1ccc(C#N)cc1 546018405 PTGTZHGICFEQMI-ZWKOTPCHSA-N 386.495 5.433 30 20 GKED CC(C)(c1noc([C@H](C#N)Cc2ccc(C#N)cc2)n1)c1cccc2ccccc12 551119381 COLPZBAFLIOXOF-FQEVSTJZSA-N 392.462 5.270 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)c3cc(C#N)ccc3Cl)CC2)cc1 560438168 WIQGTGPYYGBGQM-UHFFFAOYSA-N 382.891 5.019 30 20 GKED Cc1c([C@H](C)NCC(C)(C)CCC#N)cnn1-c1ccc(Cl)cc1Cl 562045143 JAGHTWMSDNDPEQ-ZDUSSCGKSA-N 379.335 5.468 30 20 GKED N#CCCN(C(=O)CCC(=O)c1cc(Cl)sc1Cl)c1ccc(F)cc1 562563657 KNRKYJCJTFGWMU-UHFFFAOYSA-N 399.274 5.104 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccc(Oc4ccnc(C#N)c4)cc3)o2)cc1 581222585 AEPBCDLQSOJCRW-MRXNPFEDSA-N 397.438 5.277 30 20 GKED N#CC[C@H](Cc1nc(-c2ccc(Oc3cccnc3)cc2)no1)c1ccccc1 582451915 ILFLREZQZZKCHJ-LJQANCHMSA-N 382.423 5.164 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 582882359 DUWHNERSJWYMSO-GHTZIAJQSA-N 379.504 5.269 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 588227368 ZFWASNAFKNLNQR-UHFFFAOYSA-N 381.320 5.176 30 20 GKED N#Cc1ccc(CNCc2ccc(Oc3ccccc3)nc2)c(C(F)(F)F)c1 589311660 SQCRFDPKSITNOW-UHFFFAOYSA-N 383.373 5.054 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@@H](NCc1cccc(F)c1C#N)c1ccc(Cl)cc1)C2 589994038 FWFLILXPBRUQFE-JTAQYXEDSA-N 397.925 5.054 30 20 GKED CC(C)(C#N)c1ccc(CNCc2cccc(COCc3ccccc3)c2)cc1 594494476 GPGXWKKCYCGMGR-UHFFFAOYSA-N 384.523 5.494 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)o1 603765402 UESSDMRGQBRSJX-FOIQADDNSA-N 387.439 5.033 30 20 GKED Cc1ccc(CCC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c(C)c1 604003952 UCCWVKCLVBHJEZ-UHFFFAOYSA-N 398.506 5.520 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(-c4cccs4)on3)cc2)cc1 604458709 ZMISYEFOJROLEX-UHFFFAOYSA-N 387.420 5.319 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)[C@H](C)c1ccc(C#N)cc1 609031015 AJRNYCVEBLSACI-FSPWUOQZSA-N 387.310 5.578 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCCc3nc4ccccc4[nH]3)cc2)c1 609429667 XKMPKLDBHZMQNC-UHFFFAOYSA-N 396.450 5.188 30 20 GKED N#Cc1ccc(CNc2cc(C(=O)Nc3ccccc3)ccc2Cl)c(F)c1 609537201 DCASPDOPHBZINI-UHFFFAOYSA-N 379.822 5.215 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)CCCc3ccccn3)c2C#N)C1 609579448 QDTBUXNEQZVZQG-HNNXBMFYSA-N 381.545 5.127 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@H]2Cc2ccccc2)cc1 610203920 VLYVCWGHAWPOTN-GGAORHGYSA-N 398.531 5.212 30 20 GKED C[C@@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1cccc(C#N)c1 610358153 ZLOZIROENPGNKL-OAHLLOKOSA-N 381.526 5.154 30 20 GKED C[C@H](NC(=O)N(Cc1c(Cl)cccc1Cl)C1CC1)c1cccc(C#N)c1 610406792 LQTMQUNJXDPPTD-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1noc(-c2ccc(Cl)cc2)n1 614185358 FVOKEWOTGGJZLJ-AWEZNQCLSA-N 380.879 5.042 30 20 GKED C=CCN(C(=O)c1ccccn1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891514 WNZUWOJMCUKWNJ-UHFFFAOYSA-N 397.503 5.705 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1)C(C)(C)C 661755673 XPVISHMMDSBNQY-UHFFFAOYSA-N 385.577 5.539 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)cn1)c1nc2cc(F)ccc2s1 669601474 DINQWVVGKISFOB-INIZCTEOSA-N 389.411 5.113 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c1 678572139 CXSMHRJSKORHQF-QFIPXVFZSA-N 392.458 5.791 30 20 GKED CC(C)COc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 730398165 FYIHRSSRTAOBNG-HXUWFJFHSA-N 390.508 5.264 30 20 GKED CCOc1cc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)ccc1O 731937728 LDMSYBILRSGMGQ-KAMYIIQDSA-N 395.455 5.266 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccccc3)[nH]2)cc1 732495917 KQAKBCKYNPMWPG-OXQOHEQNSA-N 385.467 5.156 30 20 GKED CC(C)(CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 733052861 RKBRZBOARYARQI-QGZVFWFLSA-N 395.453 5.657 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1cc2c(ccc3ccccc32)o1 734095093 JUNVRLGLORCFDF-ACCUITESSA-N 378.431 5.727 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)cc1 735787989 AZDOYIKFRJRTBV-IBGZPJMESA-N 387.483 5.053 30 20 GKED O=C(/C=C/c1cc(Cl)ccc1OC(F)F)c1c(Cl)nc2ccccn12 737446634 YXPDCTXSZBREPH-GQCTYLIASA-N 383.181 5.139 30 20 GKED C[C@@H]1c2c(F)cccc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738897979 YGTWIWMVPDNKRI-VGSWGCGISA-N 399.469 5.632 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(OC3CCC3)cc2)cc1 744033106 MVXVKDRDBCRVMF-OPAMFIHVSA-N 390.483 5.093 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 745828825 WCXYXMUILMGDQD-YADARESESA-N 385.511 5.768 30 20 GKED Cc1ccc(C(=O)OCC2CCC(C#N)CC2)cc1NC(=O)Nc1ccccc1 755977776 XVQUMEVILHWZNI-UHFFFAOYSA-N 391.471 5.126 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccc2ccccc2n1 759188571 WBFRQOYABRHJJP-XASXRRJKSA-N 383.838 5.326 30 20 GKED C=CC[C@@H](N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccncc1 766018743 GQQMSYXXQOCATF-MAUKXSAKSA-N 379.485 5.686 30 20 GKED CC(C)(C)c1ncc(COC(=O)c2cn(CCCC#N)c3ccccc23)s1 774538574 QJFDWUPTVVTXMM-UHFFFAOYSA-N 381.501 5.056 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(C#N)c(F)c1 776860012 AKQBUULEVHZKJL-GFCCVEGCSA-N 383.810 5.369 30 20 GKED CCc1cccc(F)c1C=Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O 794474519 OQONMAWEXPWLBM-UHFFFAOYSA-N 391.471 5.017 30 20 GKED C[C@@H](Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccc(OCC#N)cc1 794836549 UBFWBBNOTDDMBI-LLVKDONJSA-N 386.320 5.382 30 20 GKED Cc1cc(N[C@H]2CCCCc3cc(C#N)ccc32)ccc1OC1CCOCC1 795809651 NNHRZQUDXMXHRV-QHCPKHFHSA-N 376.500 5.304 30 20 GKED COc1cc(C2SCCS2)ccc1OC(=O)C[C@H](CC#N)c1ccccc1 796540177 QGKXGNZLYGOLPR-INIZCTEOSA-N 399.537 5.167 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568930 YCYPZNDRGVCHQY-BXUZGUMPSA-N 378.950 5.451 30 20 GKED C#Cc1cncc(C(=O)Nc2ccc(-c3nc4cc(F)ccc4s3)cc2C)c1 807223573 FHXTYWSBQPHYQV-UHFFFAOYSA-N 387.439 5.039 30 20 GKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1 813216215 PAXXWIYFZOPKDA-DOTOQJQBSA-N 380.797 5.370 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1cccc(C(F)(F)F)c1 819840468 QILPKHXUNJEOAV-VAWYXSNFSA-N 383.369 5.576 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc2ccccc12)c1nc(C2CC2)cs1 842937543 DNOSOROXXCHSTJ-SFHVURJKSA-N 376.481 5.209 30 20 GKED CC[C@H](c1ccccc1)N(CC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)C(C)C 852690965 UYEOYKWXUGXUNK-IFMALSPDSA-N 398.510 5.085 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352179 ILZDSXDSNBZSRG-JOCHJYFZSA-N 387.508 5.624 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1ccc2ccccc2n1 916848816 IHATZGHSIYUWNI-MRXNPFEDSA-N 399.277 5.577 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)sc1C 916904361 BEJUSENSJULGCY-KRWDZBQOSA-N 390.464 5.118 30 20 GKED N#C[C@@H](C(=O)c1cc2c(F)cccc2s1)c1nc2cc(Cl)ccc2s1 917046636 LVXMIBCQEUXYDX-NSHDSACASA-N 386.860 5.794 30 20 GKED CCCCCOc1ccc(C(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc1 920106524 QXXKJHVHAMMZHC-FQEVSTJZSA-N 388.467 5.251 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1/C=C\C(=O)c1c(C)nn(C)c1C 920832119 FRBZBJIRGPWQOQ-PFONDFGASA-N 396.494 5.094 30 20 GKED CCN(c1ccccc1)c1ccc(C=NNc2ccc(C(=O)O)c(F)c2)cc1 1776074058 FNIWNXQYTXUQBJ-UHFFFAOYSA-N 377.419 5.128 30 20 GKED O=C(O)c1ccc(C=NNc2ccc(OCc3ccccc3)cc2)c(Cl)c1 1776093454 RZVYYNBCEWSVDV-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2F)cc1 1776125372 GWPOSYVVWSBTHX-OKACTXMXSA-N 398.474 6.015 30 20 GKED COc1ccc(C(=O)/C=C\c2c(Cl)ccc(Cl)c2Cl)cc1CC(=O)O 1776131758 FQFNONNGXVNMAE-UTCJRWHESA-N 399.657 5.179 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccccc2SC(F)(F)F)c1)C(=O)O 1776473368 AFYVIWOHIGASIK-ZWLSGLHFSA-N 396.386 5.047 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Oc2ccc(OC)cc2)cc1 1776784741 PBPRRQHPPXMPGX-HXUWFJFHSA-N 399.531 5.781 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2cccc(C)c2)c1 1776788106 SBSGVTYJQQTBNN-QHCPKHFHSA-N 383.532 5.650 30 20 GKED CCOc1cccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776937443 PZQHFNKUEWLNIC-LUAWRHEFSA-N 378.449 5.408 30 20 GKED Cc1c(/C=C2\Cc3cccc4cccc(c34)C2=O)nc2ccccc2c1C(=O)O 1777414137 AUYJVLZPKDVDEJ-GHRIWEEISA-N 379.415 5.217 30 20 GKED N#CCOc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(Cl)cc2)cc1 7360172 AZZLWIMJIAVXKL-OAQYLSRUSA-N 389.842 5.013 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4cc[nH]c4c3)c2)cc1 53997460 JVKHXTUQAPYVAM-UHFFFAOYSA-N 381.435 5.065 30 20 GKED COc1cccc(C(=O)/C=C\c2csc(N(C(C)=O)c3ccc(C)cc3)n2)c1 54895704 LRYAYSROWVRFRZ-XFXZXTDPSA-N 392.480 5.041 30 20 GKED CCOc1cc(CNc2ccc(C#N)cc2C(F)(F)F)ccc1OC(F)F 71919646 MLRZKOKCBWVIAD-UHFFFAOYSA-N 386.320 5.189 30 20 GKED CSc1ccc(NC(=O)[C@H](C)Nc2ccccc2SC[C@@H](C)C#N)cc1 108407607 UZGASDVSYQLYLX-GJZGRUSLSA-N 385.558 5.099 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1 113572735 OENCTXLUAWFQSN-UHFFFAOYSA-N 394.862 5.142 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(OCc3ccccn3)c(Cl)c2)cc1 124036852 CTFSXXAFEOPLHS-INIZCTEOSA-N 393.874 5.217 30 20 GKED C=CCn1c(SCc2csc(C3CCCCC3)n2)nnc1-c1ccccn1 124923123 YMROJKMNJGEODY-UHFFFAOYSA-N 397.573 5.323 30 20 GKED CSCC[C@@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 150849646 OIELYBXMJNIJNZ-QGZVFWFLSA-N 397.544 5.051 30 20 GKED COCc1ccsc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 181422591 DJKAIFXPXJVCLV-CQSZACIVSA-N 388.901 5.161 30 20 GKED CCC[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 181774606 FUPNLJBQCNFFLT-MJGOQNOKSA-N 381.545 5.008 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1 182123177 XKRXVFQVZZXQMI-KBOKABMXSA-N 399.491 5.279 30 20 GKED CCOc1ccc(-c2nc(CNc3ccccc3O[C@H](C)C#N)cs2)cc1 182590095 WAIJCLILZZGFPJ-OAHLLOKOSA-N 379.485 5.112 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 185009641 NLOWAVRWDKOGKA-GAJHUEQPSA-N 398.466 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1C(F)(F)F 189908269 WOWSWZYVLATMMH-UHFFFAOYSA-N 381.825 6.463 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(SC(F)(F)F)cc2)c1 237020082 MVDPAAVRQYCOET-INIZCTEOSA-N 380.435 5.269 30 20 GKED Cc1cc(N[C@@H](C)c2ncc(-c3ccc(Cl)cc3Cl)o2)nn1CCC#N 271040236 RMSSGNFAFBSECK-LBPRGKRZSA-N 390.274 5.240 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C(C)(C)c1csc(-c2cccs2)n1 283472125 JTCIFKLVXLWGIN-ZDUSSCGKSA-N 397.525 5.079 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1snc(Cl)c1C#N 301204621 QZVJULHCTZFFNX-SECBINFHSA-N 378.885 5.412 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(N3CCCCC3)c(F)c2)cc1 303205236 MXHFQTKHAWEOON-SNQZOLJRSA-N 378.447 5.003 30 20 GKED C/C(O)=N/[C@H](C/C(O)=N/C1CCC(N2CCC(C)CC2)CC1)c1cccs1 328655292 MSFTZWUOVFYMMP-CTWPCTMYSA-N 391.581 5.155 30 20 GKED OC1=NC2(CCC2)[C@@H](/N=C(/O)C2(c3ccc(Cl)c(Cl)c3)CCC2)CC1 328755222 SRXVPKJWMXJDNI-HNNXBMFYSA-N 381.303 5.413 30 20 GKED Cc1ccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)c(OCC2CC2)c1 431301772 WUXJOMWWZCTHGA-JOCHJYFZSA-N 391.515 5.018 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccc(F)cc2)C1 432073813 DZRMWMNFPVCBOS-RDJZCZTQSA-N 383.492 5.241 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432666897 HCKYJXJKHITBQE-HXUWFJFHSA-N 392.503 5.146 30 20 GKED Cc1c(Br)cccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 438139505 YJZOZBJBCDTMED-VQIMIIECSA-N 398.304 5.061 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 439397819 QXZUGSBPQDDJQV-QHCPKHFHSA-N 396.450 5.517 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCC(c4cccc5ccccc45)CC3)o2)cc1 441520672 BVEZHXZKKACGEB-UHFFFAOYSA-N 394.478 5.141 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1cc(C#N)ccc1Br 444790852 KWVVLSWVZWEKQF-KRWDZBQOSA-N 397.238 5.413 30 20 GKED CCN(C(=O)CCC(=O)c1csc2ccccc12)[C@@H](C)c1ccc(C#N)cc1 445914027 XPMMUENKJHGGCK-INIZCTEOSA-N 390.508 5.346 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)C1 452560618 GLSLSXRREIBCJQ-KNBMTAEXSA-N 384.932 5.372 30 20 GKED N#CC1CCC(CNC(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)CC1 463425315 HPPYQDXUIIKDLR-UHFFFAOYSA-N 394.346 5.212 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 467869959 XLPMWLULLDHRLW-FPOVZHCZSA-N 385.511 5.353 30 20 GKED COc1ccc(-c2nnc(S[C@H](C)CCC#N)n2-c2ccc(C)cc2)cc1 470447308 ZGKMMHVYCJZGPJ-MRXNPFEDSA-N 378.501 5.036 30 20 GKED C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 472757320 VYYBXYNHRNHSFM-WSTZPKSXSA-N 393.556 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccc(OC)cc1OC 475582428 STTDJAFOBRDHGP-UHFFFAOYSA-N 396.531 5.610 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 475851393 QDISXTNGCBVYPI-UHFFFAOYSA-N 375.428 5.098 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)no2)nnc1-c1ccccc1C 481366690 CFJXZNITKBALGU-UHFFFAOYSA-N 388.496 5.387 30 20 GKED CC(C)Oc1ccc(NC(=O)c2c(F)c(F)cc(F)c2F)c(C(F)(F)F)c1 481437419 PJYPTJKLLKPZKC-UHFFFAOYSA-N 395.274 5.301 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCCSC2)cc1Cl 483473083 TVFFZPVYFCQABO-SJLPKXTDSA-N 385.920 5.013 30 20 GKED C=CCN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1ccccc1 484226927 AMODIYGEAHXVQV-UHFFFAOYSA-N 398.384 5.726 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1 485753541 VLHJNXVKCLTLRV-UHFFFAOYSA-N 394.521 5.531 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)c1ccc(F)c(F)c1 489654294 YPUHITWOGIZKDQ-AWEZNQCLSA-N 387.455 5.175 30 20 GKED C=CCNC(=O)Nc1ccc(N[C@H](C)c2ccc(OC(F)(F)F)cc2)cc1 495592309 NOBOYFDHZTVDKG-CYBMUJFWSA-N 379.382 5.066 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H](C)c1ccc(C(F)(F)F)cc1 495627086 VVMWIKPDAWKPDZ-LSDHHAIUSA-N 396.478 5.021 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)N[C@H](CCC#N)c1ccccc1 500117918 BTGVDPUVYRNCMO-BWAGFHJFSA-N 391.515 5.223 30 20 GKED CCSc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccn1 500738139 KYARKIMMJYEADV-UHFFFAOYSA-N 389.480 5.418 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1OCCc1ccccc1)c1ccc(C#N)cc1 505309396 BWSXCAYWILEOFB-GOSISDBHSA-N 385.467 5.062 30 20 GKED Cc1ccc2c(CCC(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)c[nH]c2c1 505327524 VXTKGKKCPHPWSP-GOSISDBHSA-N 386.282 5.097 30 20 GKED Cc1cc(N[C@@H](c2ccccc2)c2nccs2)n2c(nc3ccccc32)c1C#N 505559100 HYBGJCPJVJCWJX-NRFANRHFSA-N 395.491 5.326 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2ccccc2)o1)c1cccc(C(F)(F)F)c1 505938719 PHNXCOLRHWYWTO-INIZCTEOSA-N 386.329 5.085 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3cc(C#N)ccc3OC(C)C)o2)cc1 509601265 NSNSLTXKHHFBQW-UHFFFAOYSA-N 388.423 5.060 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512617766 GQYOWZDOANVWMZ-UPCLLVRISA-N 392.449 5.480 30 20 GKED C[C@@H](c1nnc(-c2ccccc2F)s1)N1CC=C(c2ccc(C#N)cc2)CC1 514125878 AFBZUNWEPYVWBE-HNNXBMFYSA-N 390.487 5.066 30 20 GKED CCCCn1c(SCC(=O)c2cn(CCC#N)c3ccccc23)nc(C)c1C 514964268 XFUMJUDHHUZBCC-UHFFFAOYSA-N 394.544 5.143 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NC[C@@H]3CCOc4ccccc43)c2)cc1 517503726 BNPWVHOSHUANBP-SFHVURJKSA-N 399.450 5.038 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 517659188 XPMQWHMZGOTAFM-JOCHJYFZSA-N 396.490 5.483 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 518256206 PYHCDGLEUQHGRV-IAGOWNOFSA-N 397.544 5.751 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCOc1ccc(F)c(Cl)c1 518738979 IUYXHHNBQYABON-CYBMUJFWSA-N 392.883 5.281 30 20 GKED C[C@@H](CC(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2)c1cccnc1 522887784 KJYDBKDIFLWDCU-HOCLYGCPSA-N 381.545 5.298 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1c(F)cc(Cl)c(C)c1F 534176662 ICDNROPIGBRTLI-UHFFFAOYSA-N 380.822 5.155 30 20 GKED N#CCC[C@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccccc1 536832640 KGROVZRHICCFGC-PMACEKPBSA-N 391.515 5.961 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)ccc1OC1CCCC1 537406050 BCNXUOYRKPNRQR-HZPDHXFCSA-N 382.479 5.439 30 20 GKED Cc1ncsc1CNc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1 542748240 AOXYDGASVRCBBE-UHFFFAOYSA-N 394.447 5.001 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1oc2c(Br)cccc2c1C 542936857 VQBKNZPYMSBPPK-UHFFFAOYSA-N 399.244 5.026 30 20 GKED C=CCOc1cccc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 553384178 BZNBIXFZFZETQL-QFIPXVFZSA-N 375.472 5.492 30 20 GKED COc1cc(C)c(NC(=O)c2cn(CCCC#N)c3ccccc23)c(C)c1C 554080922 SWNKIBPAOZOTNW-UHFFFAOYSA-N 375.472 5.131 30 20 GKED CCOC1CC(N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 554398649 XTRUTFFMZFALEB-AFMYVXGZSA-N 397.906 5.027 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 554418798 GKHYIOSUIULDTH-UHFFFAOYSA-N 396.878 5.455 30 20 GKED C=CCNC(=O)c1cccc(-c2noc(-c3cscc3-c3ccccc3)n2)c1 558507636 CLIUPPWUIMCHOG-UHFFFAOYSA-N 387.464 5.048 30 20 GKED C[C@@H]1C[C@@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCC1=O 562638403 CKAOBUMDJLUEJL-KGLIPLIRSA-N 398.915 5.307 30 20 GKED COc1cc(CN[C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)ccc1C#N 567284789 BQTFQGSYRTYXOZ-QGZVFWFLSA-N 390.458 5.136 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CN[C@H](CC(F)(F)F)c1ccccc1 567499853 UJUJXBRYPNXKKB-OAHLLOKOSA-N 383.282 5.767 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)c1 567510382 XUKLNMHQMZUHHG-UHFFFAOYSA-N 381.766 5.092 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@]3(C#N)CC34CCCC4)c(C)c2)n1 572580325 NFHBSDDRRUCLRT-HXUWFJFHSA-N 383.542 5.324 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 573171082 ZYFKRFMTGMQVMW-QFIPXVFZSA-N 378.476 5.180 30 20 GKED C=CCCC(=O)NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12 588017151 FALURYWHDZGIPP-QGZVFWFLSA-N 387.310 5.689 30 20 GKED COc1ccc(COCc2cccc(NCc3cccc(F)c3C#N)c2)cc1 589970497 GIBHUYIYFRCRBN-UHFFFAOYSA-N 376.431 5.035 30 20 GKED C[C@@H](c1ccccc1)n1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cn1 592025099 IGRMTCXNZCBACX-PGRDOPGGSA-N 387.487 5.049 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CSC[C@H]1c1ccccc1 593059763 WSIFAOVNRRAOBG-RYQLBKOJSA-N 382.554 5.024 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1[C@@H]1CCCOC1 599410092 XICOMFSRYFCRJT-SJLPKXTDSA-N 397.544 5.103 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC[C@@H](O)CC2(C#N)CCOCC2)cc1 600742112 JUAYABCETNWZKY-RXVVDRJESA-N 396.556 5.023 30 20 GKED C=CCOc1c(Cl)cc(CNc2ccccc2CCSC)cc1OC 600862122 UNSARKGUSWMBRF-UHFFFAOYSA-N 377.937 5.431 30 20 GKED COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C3(C#N)CC3)cc2)cc1 602757236 GRVHLXXXYJLOPH-HSZRJFAPSA-N 395.462 5.021 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)oc2c1ccc1ccccc12 605363117 JOWHXPPZAHHCHX-GOSISDBHSA-N 379.419 5.569 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1c[nH]c2cc(Cl)ccc12 609020515 WOJZDFILMTUTJL-UHFFFAOYSA-N 391.883 5.603 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@@H]1CCC[C@H](C)C1 609575677 MSSLKQPKWXHXLX-HTAPYJJXSA-N 394.490 5.134 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)o1 609589220 QRUQMYLWPAEVTG-AXAPSJFSSA-N 377.271 5.023 30 20 GKED CSCc1cccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c1 609627686 CUKNCPMCFIDWSJ-UHFFFAOYSA-N 388.492 5.253 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3ccnc4ccccc34)cc2)c1 609907584 MNHSKZLXDUUYCF-UHFFFAOYSA-N 393.446 5.470 30 20 GKED CCC[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 610319792 KDWYVWHUNQNJDT-JOCHJYFZSA-N 378.476 5.180 30 20 GKED CC(C)COc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 613402473 AVMKCGUQBLJUAL-MRXNPFEDSA-N 384.888 5.475 30 20 GKED N#Cc1ccc(CNC(=O)c2ccc(-c3nc4ccccc4s3)o2)cc1Cl 619776668 LBSWOXWRGHOCQB-UHFFFAOYSA-N 393.855 5.011 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccc(OC)cc2)cc1 620759639 SESFOFNNEMOAOH-DEOSSOPVSA-N 377.459 5.278 30 20 GKED C[C@H](CC(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C(F)(F)F 626405022 VOKSCNGOCGXUPA-RDDDGLTNSA-N 381.238 5.014 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)s1)c1nc2cc(C(F)(F)F)ccc2s1 642282290 ZREKRKOJFNETGW-MRVPVSSYSA-N 386.807 5.520 30 20 GKED C#CCCOc1ccc(/C=C2\SC(=S)N([C@H](C)c3cccs3)C2=O)cc1 726629747 QKRARIDDGRSAIK-VVTMIQRTSA-N 399.562 5.113 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(F)c(Cl)nc1Cl 727748235 LLFWDXXEFMLROV-UHFFFAOYSA-N 379.671 5.071 30 20 GKED Cc1cc(C(=O)N2CCC[C@@H]2c2ccsc2)c(C)n1-c1ccc(C#N)cc1 728267585 CUCIYCXGLUSGOX-OAQYLSRUSA-N 375.497 5.005 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1sccc1SC(F)F 730470773 FUUKYADNVAIVAK-UHFFFAOYSA-N 380.485 5.233 30 20 GKED COc1ccc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)cc1OC(F)F 732570745 HPICKKKSEGNVEO-VQHVLOKHSA-N 387.407 5.316 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H]3CCc4ccccc4C3)n2)cc1 732596589 YFYMJRRHELLLQT-UTKZUKDTSA-N 397.503 5.053 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3sccc3C)c2)cc1 733748528 BIPFQXZEJJAZBA-IZZDOVSWSA-N 377.465 5.214 30 20 GKED Cc1ccc(-c2nc(C(=O)OCc3cc(Cl)ccc3OCC#N)cs2)cc1 735338899 CKGNZOORIYVZMD-UHFFFAOYSA-N 398.871 5.031 30 20 GKED N#Cc1nnc2ccccc2c1Oc1ccc2c(-c3ccccc3)cc(=O)oc2c1 740864696 LGPIXUWTVFWXQE-UHFFFAOYSA-N 391.386 5.067 30 20 GKED N#C[C@H](C(=O)C1CCCCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 744038319 QEALURRXLJARJF-CQSZACIVSA-N 380.435 5.852 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1ccc(Cl)c(Cl)c1 745695737 UFCWCTWRNOUSDB-UHFFFAOYSA-N 392.355 5.720 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 746871835 OETOSHJDYGVSHB-QFIPXVFZSA-N 387.483 5.029 30 20 GKED N#CCOc1cccc(NC(=O)NCc2ccc(Sc3ccccc3)cc2)c1 747243689 DCEBJVAZWHSEPZ-UHFFFAOYSA-N 389.480 5.062 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2ccccc2OCc2cccnc2)cc1 751514468 RXROXKOFSNFRMQ-JLHYYAGUSA-N 395.462 5.051 30 20 GKED Cc1cc(C(=O)O[C@H](C)c2cccc(C#N)c2)ccc1NC(=O)c1cccs1 759306872 QIWUETOWKZBVEE-OAHLLOKOSA-N 390.464 5.099 30 20 GKED COc1cc(F)c(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)cc1OC 760269961 KOJLNFLOSOWPOS-CMDGGOBGSA-N 383.444 5.171 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 765909472 OCHIQBGYXGILKP-LADGPHEKSA-N 396.494 5.415 30 20 GKED Cc1ccc(C)c(Sc2ccc(NC(=O)NCc3ccc(C#N)cn3)cc2)c1 780649815 XMHJDLMDRGNRTF-UHFFFAOYSA-N 388.496 5.043 30 20 GKED CC(C)Oc1ccc([C@H]2CCCC2=NNc2ccc3c(=O)[nH]ccc3c2)cc1 789070786 MRFVYWBXXVUOMW-HXUWFJFHSA-N 375.472 5.051 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CCCCC1)c1cnc2ccccc2n1 792110465 LYOCRNKWFZPDDW-SFHVURJKSA-N 389.886 5.362 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(OC(C)C)c(Cl)c2)c1 793539911 KPBJHYUEXPAHPC-APWZRJJASA-N 386.923 5.659 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)sc2ccc(C#N)cc12 796861134 OMRXCFBGRPJDDP-CQSZACIVSA-N 391.452 5.320 30 20 GKED CC[C@](C)(C#N)C(=O)O[C@H](C)c1cnc(-c2ccc(Br)cc2)s1 797172351 RWFYSEMDVIBFBL-PIGZYNQJSA-N 393.306 5.117 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@H]1CCC(F)(F)C1 797869840 BGRDUTMJWWFDAR-MRXNPFEDSA-N 386.417 5.365 30 20 GKED N#CCC[C@H](Nc1cc(Br)cnc1Br)c1ccccc1 804566001 WYHMYZDPMPEOAI-ZDUSSCGKSA-N 395.098 5.064 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c2ccccc21 813212966 GYFVBFXKENBYQJ-JVPBZIDWSA-N 386.417 5.594 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842940362 BZEMGFSIIYPRRO-USYSOWRXSA-N 376.403 5.319 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 842943627 YBUNSCUQLZCJRW-SFHVURJKSA-N 380.513 5.202 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=S)Nc3ccc(F)cc3)c2)cc1 916025895 OOQXUDBSBPNPPG-UHFFFAOYSA-N 391.471 5.280 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 916847293 BVCWPZWYUACERN-RHSMWYFYSA-N 378.497 5.238 30 20 GKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1C 916918108 MBNFFPMOECPYSC-GJCOWUBNSA-N 382.463 5.126 30 20 GKED Cc1cccc(OC[C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 919773606 TYDFQSCUJNTUFO-NTKDMRAZSA-N 399.494 5.240 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Cl)c(Cl)c1Cl 1776073345 PPJTZRZFQQUEDO-UHFFFAOYSA-N 375.614 5.320 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cs1 1776380459 BHFSUEIKFJQCHM-HYXAFXHYSA-N 375.446 5.215 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2cccc(SC(F)(F)F)c2)cc1)C(=O)O 1776470385 MIIIFFYUVARKNZ-MQGYJPLLSA-N 396.386 5.047 30 20 GKED CCCCCCCOc1ccc(CNCCCCC2(C(=O)O)CCC2)cc1 1776787131 WHPFADZZQQENPF-UHFFFAOYSA-N 375.553 5.551 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C)c2ccc(OC)c(C(=O)O)c2)c1 1776787660 JPNUFVHBEIFDSE-SFHVURJKSA-N 399.531 5.593 30 20 GKED COc1cc(/C=C\C(=O)c2sc(-c3ccc(C)cc3)nc2C)ccc1C(=O)O 1777290414 HXHUOLLLFWEXOK-XFFZJAGNSA-N 393.464 5.030 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1F 1777352364 VBYQSJYRDUHKBM-QCDXTXTGSA-N 376.383 5.096 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)c(C)c1 1777353306 WJBFLVYYHQXBBA-MDWZMJQESA-N 386.447 5.194 30 20 GKED Cc1cccc2c1C/C(=C/c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777456058 DOUYVWJZTMFZSV-YSPNNUNSSA-N 384.431 5.022 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3c(Br)cccc3C2=O)c(Cl)c1 1777673529 VFSIZPAVJMBQQE-FLIBITNWSA-N 391.648 5.013 30 20 GKED O=C(O)c1ccc2scc(/C=C3\Cc4cc(Br)ccc4C3=O)c2c1 1777685471 FASIZTUWYNIJQU-WUXMJOGZSA-N 399.265 5.184 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1791246809 DGSZEEUFFUQNDK-KRWDZBQOSA-N 396.556 5.027 30 20 GKED C=CC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)CCCCC)CC1 1831466932 MOBLIOQNQKLKIS-ONTIZHBOSA-N 390.612 5.035 30 20 GKED N#CCCN(CCC#N)Cn1c(-c2ccccc2)c(-c2ccccc2)oc1=S 21960009 VPGDLALSXIQWAZ-UHFFFAOYSA-N 388.496 5.231 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CSc3ccc(F)cc3)c2)c1 31776852 DNCGWPUPHYWCQJ-UHFFFAOYSA-N 392.455 5.007 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2SCCCS2)cc1)c1nc2ccccc2o1 41544221 DVPCVJHCIFVDSK-HNNXBMFYSA-N 380.494 5.187 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)oc2ccc(Cl)cc12 41554623 IERWISOGBNORGQ-CYBMUJFWSA-N 378.737 5.299 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl 66861031 FGCWFZAIJUNGNN-LBPRGKRZSA-N 394.327 5.438 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 66955100 BFWSZKJXICCWCZ-VQIMIIECSA-N 397.519 5.459 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)Nc3ccccc3SCCC#N)o2)cc1 78668837 BCIRHPWCKNUYOG-UHFFFAOYSA-N 391.496 5.227 30 20 GKED N#C[C@H](C(=O)c1coc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 113656861 NRINWORPUYDKNN-GFCCVEGCSA-N 380.375 5.325 30 20 GKED C=CCOc1ccc(C(=O)N(CC)[C@H](C)c2cc3ccccc3o2)cc1OC 115740850 DEXMIYNZBKPQHW-MRXNPFEDSA-N 379.456 5.230 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 123266710 QCMRMBXHUOOJGE-HTAPYJJXSA-N 380.451 5.048 30 20 GKED N#Cc1ccc(-c2nnc(CSc3nc(-c4ccccc4)cs3)o2)cc1 133718808 QTOUMLWQVNNZDI-UHFFFAOYSA-N 376.466 5.024 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1ccc(SC2CCCC2)cc1 134615591 VTMRAHSJFQWXMZ-UHFFFAOYSA-N 380.517 5.064 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(OC2CCC2)cc1Cl 159032271 AHWPRZMCMVMHPQ-UHFFFAOYSA-N 384.863 5.182 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H](C)COCc1ccccc1 171838738 QEDBVKSDGAMYSR-MSOLQXFVSA-N 397.544 5.055 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccccc2C(F)(F)F)ccc1OC 180810730 CGIMIDUKAAEPTQ-HOCLYGCPSA-N 392.421 5.246 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(OCC#N)cc1 181598182 LEVZIRIDXMHXOL-BVZFJXPGSA-N 382.463 5.775 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2ccc(F)cc2F)n1 189884204 QFELGOBCRCMEIK-UHFFFAOYSA-N 395.453 5.563 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 237509925 PNJLZZBHAJFASV-DCFHFQCYSA-N 392.502 6.010 30 20 GKED Cc1ncc(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 255679964 SITRRMNLEPANSL-IDTUSYRASA-N 385.901 5.118 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2 283157471 CHNWATKMDYWTLD-WOJBJXKFSA-N 390.531 5.124 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccccc1Sc1ccccc1 303320783 RDKKEUPPAMRWBV-UHFFFAOYSA-N 387.508 5.051 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCO2)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2 328732102 GYIYYRQRYAXFLR-MUJYYYPQSA-N 384.863 5.025 30 20 GKED CC(=O)N1CC[C@H](/N=C(/O)c2cc(C3CC3)nc3ccc(C)cc23)c2ccccc21 328806265 LCNBPGBZRYNAKT-QFIPXVFZSA-N 399.494 5.223 30 20 GKED C[C@H](SCc1nc(C#N)cs1)c1nc(-c2cccc(C(F)(F)F)c2)no1 419446866 WAOHHXKNEBIOEJ-VIFPVBQESA-N 396.419 5.078 30 20 GKED C=CC[C@H](C(=O)NCCc1nc(-c2ccccc2)c(C)s1)c1ccccc1 427459445 MZQPLPRVTWRLIM-FQEVSTJZSA-N 376.525 5.137 30 20 GKED N#CCCNC(=O)c1sc2ccccc2c1CSc1ccccc1Cl 427634549 UQRMRSLVFGIOHN-UHFFFAOYSA-N 386.929 5.490 30 20 GKED C=CCN(C(=O)c1ccn(C(CC)CC)n1)c1nc(-c2ccccc2)cs1 432357226 KSIMDLVZXGSZHO-UHFFFAOYSA-N 380.517 5.201 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1 435095416 QNAASMOQSNORCU-YLJYHZDGSA-N 375.472 5.409 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)O1 440372839 DSBBNDGVJGXEJB-XFQXTVEOSA-N 382.891 5.282 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@H]2Cc2ccccc2Cl)c(Cl)c1 455702960 LRYZPEDPPKAWDR-INIZCTEOSA-N 388.298 5.298 30 20 GKED N#CCc1ccc(NC(=O)N2CC[C@](F)(c3cccc(Cl)c3)C2)c(Cl)c1 455737696 ULAXMWGCUQOCFC-LJQANCHMSA-N 392.261 5.162 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)Nc1cccc(CC#N)c1)C1CC1 455917542 JXECZQZOFSGSRL-AWEZNQCLSA-N 387.405 5.529 30 20 GKED COc1ccc(C2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)CC2)cc1 458799082 JDRHYHPEJVWQGS-QHCPKHFHSA-N 391.515 5.019 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)Cc2csc(-c3cccs3)n2)CC1 470183804 DTYZAVISCBSLJX-UHFFFAOYSA-N 387.574 5.029 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 471285013 CEIRHXWUUXDFQK-ACJLOTCBSA-N 389.377 5.155 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C 472750508 JSZTUMRWKQOKEO-GGPKGHCWSA-N 393.556 5.423 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H](COc2ccccc2Cl)C1)c1ccccc1 476508050 OVWGHICGAOFNIU-UYAOXDASSA-N 396.918 5.045 30 20 GKED C=C(C)[C@H](NCc1cc(-c2ccncc2)ccc1OC)c1ccc(F)c(F)c1 479387003 FDDBKAPBUKPSNU-QHCPKHFHSA-N 380.438 5.442 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nnc(-c4ccccc4)s3)c2)cc1 481950338 CWGXVNADXWVLIH-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C=CCN(C(=O)C[C@H](C)c1ccccc1OC)c1nc(-c2ccccc2)cs1 482275812 ZAIHHHOAQPOENH-KRWDZBQOSA-N 392.524 5.532 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccccn1)c1ccc(Cl)cc1)c1ccccc1 483358961 NHGCHKDNOPBJEP-LJQANCHMSA-N 389.886 5.356 30 20 GKED C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NCc2ccccc2C(C)(C)C#N)C1 486440551 BOQDUFBFMSQKJE-OALUTQOASA-N 389.543 5.218 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](COc2ccccc2F)C(C)(C)C)cc1 490666405 FWHGFJPPQQWNTK-HXUWFJFHSA-N 397.494 5.242 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1 503845386 KOMDOMZTKXPYTA-VWLOTQADSA-N 397.522 5.464 30 20 GKED Cc1ccccc1N(C(=O)Cc1ccc(C#N)cc1)c1nc2ccccc2s1 504336856 PYCWJGCGKKBKGE-UHFFFAOYSA-N 383.476 5.384 30 20 GKED N#Cc1c(NC(=O)c2sccc2C2CC2)sc2c1-c1ccccc1CC2 504732598 JEFNBFFIDORQPX-UHFFFAOYSA-N 376.506 5.577 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 505949608 VKOZWYWNZMWZTK-MRXNPFEDSA-N 379.312 5.489 30 20 GKED CC1(C#N)CCN(C(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)CC1 509408484 ZPNIMZBKTSHGIF-UHFFFAOYSA-N 390.380 5.277 30 20 GKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccc(OCc2ccccn2)c1 512646526 AVWUZJWCXZAOGN-IRXDYDNUSA-N 375.447 5.083 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4ccccc4s3)n2)cc1 516270312 RLRRSBLKJUNYOX-INIZCTEOSA-N 385.473 5.387 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CNc3cccc(Cl)c3C#N)c2)cc1 518994209 MESZQZOPWZEVCI-UHFFFAOYSA-N 375.859 5.385 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 519155003 IDLRBHLULFXYNC-UHFFFAOYSA-N 392.503 5.123 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCc3ccnc4ccccc34)c2)cc1 524241119 PRWUTHHQOPFQRL-UHFFFAOYSA-N 393.446 5.470 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(CCCC)[C@H](CC)c2ccccc2)cc1 524482357 OOPVJNIUDAVJHY-JOCHJYFZSA-N 393.531 5.388 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F 524784387 FUJMFFIASIDLJV-HNNXBMFYSA-N 392.421 5.173 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 533993749 DBFQIKWIWHYFBT-FOIQADDNSA-N 379.891 5.240 30 20 GKED C=CCC[C@H](NCc1nc(-c2ccsc2)no1)c1ccc(C(F)(F)F)cc1 537129364 RCHVEGHUVIRHHR-INIZCTEOSA-N 393.434 5.614 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 538680167 KJCHEGZKIYNRSQ-UHFFFAOYSA-N 376.387 5.141 30 20 GKED CC(C)(C)[S@@](=O)Cc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 539931663 LPTNYQLLMWYOSD-UMFKEYKBSA-N 394.584 5.550 30 20 GKED N#Cc1cc(NC(=O)[C@H]2CCC(=O)c3ccccc32)ccc1Oc1ccccc1 551314168 LNCODJZOQJBGSF-NRFANRHFSA-N 382.419 5.049 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F)c1ccccc1 556035001 XVTXUHXHIHTMJY-HNNXBMFYSA-N 377.406 5.791 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)c1sc2ccc(C#N)cc2c1C 556498906 UIAOMEWEASLNOY-UHFFFAOYSA-N 392.524 5.957 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1ccc(C#N)c(F)c1 558500454 QVJTVFGVVFQRBV-AWEZNQCLSA-N 394.475 5.354 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(-c2cccs2)nc1C 561237485 FZNHVIDPOKVAMC-UHFFFAOYSA-N 394.544 5.114 30 20 GKED N#CCCN(C(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)c1ccc(F)cc1 561916373 QAMHGDMIFAKYFU-UHFFFAOYSA-N 376.218 5.174 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc([C@H]4CCOC4)cc3)c2)cc1 565558612 DVWLLZQOJHZBOB-FQEVSTJZSA-N 384.435 5.107 30 20 GKED N#Cc1csc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)n1 584522543 PDOCBUHFINFZDY-GOSISDBHSA-N 379.451 5.445 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCCCCc2ccc(Cl)s2)c(Cl)c1 586826114 VVBNKBJHIGNYOY-UHFFFAOYSA-N 387.719 5.333 30 20 GKED Cn1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(C2CCCCC2)n1 588739094 VXZCNSGHXSCFAF-CQSZACIVSA-N 398.919 5.221 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccccc3OC(F)F)no2)c2ccccc21 589085646 WPGLZFRUILHZKI-UHFFFAOYSA-N 394.381 5.263 30 20 GKED CCCN(C(=O)c1cccc([C@@H]2CCCOC2)c1)c1cc(Cl)ccc1C#N 598810067 KWTRJBKULPCMAC-LJQANCHMSA-N 382.891 5.162 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@@H]21 599736843 IPAWKXLEOAIFGS-FWMLUHEOSA-N 397.931 5.052 30 20 GKED CC(C)(C(=O)Nc1sc2c(c1C#N)CCCC2)c1cccc(C(F)(F)F)c1 608896320 CKJBTQGYSXCOMG-UHFFFAOYSA-N 392.446 5.434 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)c2)cc1 609177113 KCBUPTCCAXFKQF-CVEARBPZSA-N 388.389 5.658 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 609427885 AVSZUTSJDOZGLR-UHFFFAOYSA-N 393.446 5.152 30 20 GKED CN(CCc1ccccc1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723734 YPRHLUJGSUFKAE-UHFFFAOYSA-N 390.870 5.319 30 20 GKED CCc1ccc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609770981 XGXSBGSIEXURKF-MRXNPFEDSA-N 384.570 5.373 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccc(Br)cc2)s1)C1CCCC1 609976704 AODBGJPIPVRJFP-UHFFFAOYSA-N 389.318 5.086 30 20 GKED C[C@@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1cccc(C#N)c1 610829694 FJFLSOAGIMJURP-AUUYWEPGSA-N 377.488 5.549 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c(Cl)c1 610877390 KRLNEZLOLRKPPF-INIZCTEOSA-N 378.863 5.104 30 20 GKED Cc1c(C#N)c(NC(=O)CSC2CCCCC2)n(Cc2ccc(F)cc2)c1C 611142471 SKWSKWQEBXHMSN-UHFFFAOYSA-N 399.535 5.168 30 20 GKED Cn1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c2ccccc21 613319119 PDPNSTFEBVNTBV-MRXNPFEDSA-N 391.883 5.445 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Br)cc2)C2CC2)cc1Cl 619754885 NUIZNJROJNGROP-SFHVURJKSA-N 375.697 5.215 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)C[C@@H]1CCCO[C@H]1c1ccccc1 669727566 OAZDVXPKERZZRV-GMAHTHKFSA-N 378.516 5.437 30 20 GKED COc1cc(OC)c(OC)cc1/C=C\C(=O)c1sc(-c2ccccc2)nc1C 727780572 PBDVGMLTSYCAGT-KHPPLWFESA-N 395.480 5.040 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(O)c(F)c2)ccc1OCc1ccccc1 728439238 YXROMRQTKJNFPL-YFHOEESVSA-N 378.399 5.015 30 20 GKED CC(=O)c1csc(C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)c1 730356845 OYDYRXFMJFPLTJ-UHFFFAOYSA-N 389.476 5.007 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730422097 TYMFEFALBWGTKT-ZIGSKRJUSA-N 388.508 5.089 30 20 GKED C#CCCOc1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 733324204 MXKJIWBSUOJXKM-GJZGRUSLSA-N 393.371 5.088 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 739835912 FVHXOVNSGQLSAZ-HSZRJFAPSA-N 399.542 5.217 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCCc4sccc4C3)c2)s1 740058095 QEQZGTPIGBGOBO-UHFFFAOYSA-N 393.537 5.006 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCC[C@@H]3c3ccccc3)c2)s1 740059463 IOMXDFFNHZPRNQ-OAQYLSRUSA-N 387.508 5.333 30 20 GKED C#CCCCNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 742790435 JBCKIAIFHNVXEW-UHFFFAOYSA-N 383.900 5.522 30 20 GKED COc1ccc2c(-c3ccccc3)cc(=S)n(CN(C)C[C@H](C)C#N)c2c1 746705291 AGCUKIUOXAPAGI-MRXNPFEDSA-N 377.513 5.095 30 20 GKED CCc1oc2ccccc2c1C=NO[C@H](C)c1nnc(-c2ccc(C)cc2)o1 748098190 XQYATOHNZZNATC-OAHLLOKOSA-N 375.428 5.465 30 20 GKED O=C(/C=C\c1cc2ccccc2o1)c1ccc(S(=O)(=O)C2CCCC2)cc1 749004191 AVYSUVVAHTUJNS-KAMYIIQDSA-N 380.465 5.045 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760365146 KLKFVOSGMIRVGX-PKTZIBPZSA-N 376.500 5.408 30 20 GKED Cc1nc([C@H](C)OC(=O)c2ccccc2CC#N)oc1-c1ccc(Cl)cc1 763908239 IANDGNRZKRSEAC-AWEZNQCLSA-N 380.831 5.288 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(Cl)c1 766238166 QASYZDISJOTILZ-KRWDZBQOSA-N 378.859 5.232 30 20 GKED C#C[C@@H](C)N(C)C(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 770784964 LQTITVBYQYTVBY-GFCCVEGCSA-N 385.876 5.227 30 20 GKED N#Cc1ccc(CNCc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)nc1 780555101 NYUUMVNISVWRNU-UHFFFAOYSA-N 398.293 5.129 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1ccc(SC(F)F)cc1 781548315 AGNSCNJTJNFPTG-JXMROGBWSA-N 382.403 5.062 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=S)Nc1cccc(OC(F)(F)F)c1 783729073 HAKGLPUMAPQLTC-UHFFFAOYSA-N 393.434 5.064 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(Br)ccc1F 791741927 KQVFZNQQRWUSTI-UHFFFAOYSA-N 377.257 5.087 30 20 GKED Cc1cc(/C=C/C(=O)[C@H](C#N)c2cnc3ccccc3n2)c(C)n1C1CCCCC1 792105913 YYLVRHNZKRCSJG-JNCYCUAHSA-N 398.510 5.443 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1ccc(OC(C)C)cc1 795140748 WGYOKBFOEPMZNV-UHFFFAOYSA-N 386.565 5.026 30 20 GKED C[C@@H](OC(=O)Cc1ncccc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 795791523 HSCUVOGFTJLEMU-SECBINFHSA-N 395.274 5.105 30 20 GKED COc1cc(/C=C/C(=O)c2c(F)cccc2Cl)ccc1OCC(F)(F)F 809159784 WSIBVBBTDBEVNB-FNORWQNLSA-N 388.744 5.325 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2csc(-c3ccccc3F)n2)cc1 812245120 PXIQPEIRCPUVJF-KOTGUFOOSA-N 378.428 5.136 30 20 GKED C=CCC1(O)CCN(C(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)CC1 887739832 FXXLZAMVRLZFDS-IBGZPJMESA-N 394.515 5.070 30 20 GKED CC(C)c1ccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915124579 QHKBPPACXROOQN-HSZRJFAPSA-N 385.536 6.274 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 916128467 FLISZPWGEQRNNK-SDNWHVSQSA-N 385.467 5.149 30 20 GKED CCCCOc1ccc(-c2nnc(CON=Cc3ccc(CC)cc3)o2)cc1 917395862 YOCDENJDYDOVDX-UHFFFAOYSA-N 379.460 5.029 30 20 GKED Cc1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)s1 918712788 NBFGYZLLTSFRER-YVMONPNESA-N 375.902 5.642 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2cccc(Cl)c2)c1 1776032853 ZUBSIEIKPRGWDM-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cccc(CC(=O)O)c2)cc1 1776125903 WAVJZHUTXJURCK-XATQLNLPSA-N 394.511 5.805 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc3cc(Cl)ccc23)cc1CC(=O)O 1776133281 RTZJDYXQVCXYFF-WEVVVXLNSA-N 380.827 5.025 30 20 GKED CCOc1cccc(F)c1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776939646 MKPJNHORDRUKIE-ZHACJKMWSA-N 380.371 5.079 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@H]3CCC5)s2)cc1 1777671020 UEHWNXFSCAMNCV-ACRNLXFHSA-N 386.472 5.813 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4cc(O)ccc4C3=O)s2)c1 1777684287 FBIVQTOGWBXESN-QINSGFPZSA-N 376.433 5.031 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1C)=C(/S)Nc1ccccc1F 55011583 BGSHGTSIOGNVTA-UHFFFAOYSA-O 393.507 5.035 30 20 GKED COc1cc(Cl)ccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 66954327 ITOWEAFKEGPERP-ZDUSSCGKSA-N 389.908 5.065 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1c(F)cccc1F 69057529 QCUNYUYJWDBVHT-CQSZACIVSA-N 393.393 5.068 30 20 GKED Cc1cc(C#N)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 129457718 FVIAAQMAIRFHRV-QGZVFWFLSA-N 377.856 5.134 30 20 GKED C[C@H](Sc1nc2ccccc2s1)C(=O)Nc1cccc(OCCCC#N)c1 134773520 OWLKSFYYGDIGGK-AWEZNQCLSA-N 397.525 5.098 30 20 GKED CC(C)C1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 175374606 VJNLKXCNLUAOJE-UHFFFAOYSA-N 391.515 5.232 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccncc1)c1ccc(F)c(F)c1 185464565 BFVUECLIAMONGQ-FGZHOGPDSA-N 393.437 5.066 30 20 GKED CC(C)(CC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 195715353 WQNAEAICCJKGIA-UHFFFAOYSA-N 397.478 5.117 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1C[C@]12CCOc1ccccc12 329494737 IMOMASRKANIWLX-ROKPMTFOSA-N 391.515 5.073 30 20 GKED Cc1sc(C/N=C(/O)C2(C3CC3)CCOCC2)nc1-c1ccc(Cl)cc1 329635290 UKBHXKPNHWJLSQ-UHFFFAOYSA-N 390.936 5.435 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)C1CCC(C(F)(F)F)CC1 435624778 KGYQSYZUBFARGU-UHFFFAOYSA-N 376.378 5.053 30 20 GKED N#Cc1ccnc(NC(=O)[C@H](Oc2cccc(Cl)c2Cl)c2ccccc2)c1 436028134 OAVYMVAYGAIJID-LJQANCHMSA-N 398.249 5.019 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 437826548 CHLVLAJVADIBRJ-OAQYLSRUSA-N 377.488 5.413 30 20 GKED CSc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 439494078 DLJPZMCOUXMNSN-CABCVRRESA-N 385.558 5.543 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])n1 442028650 KGGOZJNMJFILSJ-CQSZACIVSA-N 395.465 5.001 30 20 GKED Cc1c(NC(=O)c2cn(CCCC#N)c3ccccc23)sc2c1CCCC2 444262995 WRKJFMAERWZNLR-UHFFFAOYSA-N 377.513 5.446 30 20 GKED C[C@@H]1c2cc(F)cc(F)c2CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458808018 YQGOTSKJVRTENM-QVKFZJNVSA-N 383.442 5.029 30 20 GKED CCCCN(C(=O)CCCC#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 463110187 SMTIKGBBJHAMSC-UHFFFAOYSA-N 396.343 5.944 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(N2CCC[C@@H](C)C2)c1 464480243 JECKAVBDTXDZAM-GOSISDBHSA-N 377.532 5.422 30 20 GKED C=CCCCCNC(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 473680923 WEBYZOUAHXCEQE-UHFFFAOYSA-N 385.895 5.094 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 475120969 PUPZISKZAUKTHP-UHFFFAOYSA-N 381.435 5.404 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(CC)n(-c2ccccc2F)n1 476123873 WQTILENDQYMGNG-UHFFFAOYSA-N 392.478 5.073 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccccc1 477081929 AWBRZLIYLIMQPL-ACJLOTCBSA-N 398.787 5.286 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1nccc2ccccc12 483218940 RGXTYNNIJHROBY-KRWDZBQOSA-N 389.867 5.502 30 20 GKED CCCOC1(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCCCC1 483617025 CWXUJUOCJPNJJY-KRWDZBQOSA-N 389.565 5.189 30 20 GKED C=CCN(C(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1)c1ccccc1 484222427 QYOBFWUQQOAFHQ-UHFFFAOYSA-N 395.462 5.545 30 20 GKED C=CCN(CCOC)C(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 484355871 YLUFAATVRFCZIV-UHFFFAOYSA-N 399.491 5.077 30 20 GKED COCc1c(C(=O)N[C@H](CCCC#N)c2ccccc2)sc2cccc(F)c12 487298398 MRMZFMIVYKLPGW-GOSISDBHSA-N 396.487 5.352 30 20 GKED C[C@H](NC(=O)CSCc1ccc(F)cc1C#N)c1ccc(Cl)cc1Cl 488480949 KHAPWTFGWYPIHB-NSHDSACASA-N 397.302 5.115 30 20 GKED COc1cccc([C@@H](NC(=O)NCC(C)(C)CCC#N)c2ccccc2Cl)c1 498034890 ADOSBSUYLLARNU-HXUWFJFHSA-N 399.922 5.067 30 20 GKED C[C@@H](NC(=O)c1cc(O)ccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 498945311 AEPIHIRVBHXXCT-CQSZACIVSA-N 376.843 5.075 30 20 GKED N#Cc1c(NC(=O)c2cc(F)cc3cccnc23)sc2c1-c1ccccc1CC2 505127055 YBKLQNYXSUGEFG-UHFFFAOYSA-N 399.450 5.325 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 506483085 WVQPFNJGPXQTAA-SFHVURJKSA-N 393.874 5.668 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1 506788615 HHOKDGNRIISVAR-HZPDHXFCSA-N 388.389 5.576 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)NCc2ccc(C)s2)cc1 508254799 ZCYKNLRLPDNGMW-UHFFFAOYSA-N 393.468 5.051 30 20 GKED COCCC[C@H](c1ccc(Cl)cc1)c1noc(-c2ccc(C#N)cc2C)n1 508668494 YNCNYKUZPYIJKL-LJQANCHMSA-N 381.863 5.129 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 509259065 CVXCKZNJFAWDHJ-GFCCVEGCSA-N 395.356 5.260 30 20 GKED Cc1sc(NC(=O)c2ccc(Br)cc2OC(C)C)c(C#N)c1C 512380260 YQGHAFFYSBNVKW-UHFFFAOYSA-N 393.306 5.039 30 20 GKED C[C@@H]1CCCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 512729465 JRDFLDMGHUYYLE-GOSISDBHSA-N 377.488 5.128 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4nc5ccccc5s4)cc3c2C1 513682828 YWKBIBCYBYGUSR-SUMWQHHRSA-N 385.492 5.392 30 20 GKED Cc1cccc2sc(N(Cc3ccccc3)C(=O)c3cccc(CC#N)c3)nc12 516464304 XTQHUACSKSNRMY-UHFFFAOYSA-N 397.503 5.518 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1CNc1ccc(Oc2ccnc(C#N)c2)cc1 519607312 DSYBWDLYJXXFQW-UHFFFAOYSA-N 395.466 5.160 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1oc2ccc(OC)cc2c1C 520715907 AFVFMSRATNGYDV-OAHLLOKOSA-N 384.501 5.270 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCc1ccc(Cl)cc1 520940370 PHNCDXMEAKXNDE-HNNXBMFYSA-N 387.936 5.489 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc(F)cc2F)c1 522575050 OVJSMYXNBBJLBV-UHFFFAOYSA-N 384.769 5.534 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](C)c2cccs2)cc1 523092959 ABMPSYHDPLUZNR-CQSZACIVSA-N 378.453 5.163 30 20 GKED Cc1cccc(C)c1CSCC(=O)Nc1ccccc1S[C@H](C)CC#N 523389548 YHIPLGAASLKYAL-QGZVFWFLSA-N 384.570 5.570 30 20 GKED COc1cc(Cl)ccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 524386374 ZAXZRSUWVUXZKI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CCC[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 534775137 CSUZXJOLCBBHIJ-UYAOXDASSA-N 397.906 5.028 30 20 GKED Cc1scc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1C 538018548 RCXFADVMHNNTMK-UHFFFAOYSA-N 380.444 5.207 30 20 GKED C[C@@H](Oc1ccccc1)c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 545733646 MJBOAVHOUVZZJB-GZKZCVOOSA-N 384.439 5.248 30 20 GKED CC[C@@H](CC#N)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 545874355 AGXBOSZZSZISAS-HNNXBMFYSA-N 376.287 5.028 30 20 GKED C=CCC[C@@H](NC(=O)[C@H]1CCCc2cccnc21)c1ccc(C(F)(F)F)cc1 551611222 XBVPIUCUJJOTFQ-RBUKOAKNSA-N 388.433 5.344 30 20 GKED C[C@H]1CC(CCNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C[C@H](C)O1 564741053 NQUSIOPWAXYIFY-IRXDYDNUSA-N 393.487 5.066 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(Cc3ccccc3OC)CC2)c1 589741501 IJNGFJFSKVLXIV-UHFFFAOYSA-N 394.515 5.137 30 20 GKED N#C[C@@H](NC(=O)C1CC(c2ccc(F)cc2)C1)c1c(Cl)cccc1Cl 590227232 RWPHZGNHHWZSNW-QWQCLYJRSA-N 377.246 5.007 30 20 GKED Cc1cccc(-c2nc3ccc(F)cc3n2C(C)C)c1NC(=O)CCCCC#N 593984662 YOCPAWHEMJCMDD-UHFFFAOYSA-N 392.478 5.754 30 20 GKED N#CCC1(CSc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)CC1 594892353 USYAHGAIFXTMQV-UHFFFAOYSA-N 384.892 5.026 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(OC2CCOCC2)c(C)c1 606593713 KJDGABNGACQBEV-UHFFFAOYSA-N 386.536 5.153 30 20 GKED C[C@@H](NC(=O)c1occc1COc1cccc(C#N)c1)c1cccc2ccccc12 608802441 HVJVWJBFLZTHBA-QGZVFWFLSA-N 396.446 5.374 30 20 GKED CC(C)[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608838351 MBZDSFBMVCUPGQ-LJQANCHMSA-N 389.421 5.116 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N(C)Cc3cccc(C#N)c3)c(C)c2)c1 609254549 WVTOTJHYXACLCK-UHFFFAOYSA-N 399.494 5.418 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1 609546883 UTXSRPDRHZJFSJ-XZOQPEGZSA-N 375.516 5.062 30 20 GKED N#Cc1ccc(NC(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)cc1Cl 609711424 NQJXSXUIKQGLRU-KRWDZBQOSA-N 392.311 5.187 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609929261 JLSDOYRNHHOJHW-UHFFFAOYSA-N 383.879 5.221 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)c1cccc(C#N)c1 610364313 OLCQRFZIOVYXHZ-OAHLLOKOSA-N 386.417 5.266 30 20 GKED COc1cccc([C@H](C)c2noc(/C=C\c3cn(CCC#N)c4ccccc34)n2)c1 612917850 QYZXUEDGLGQFOG-CPFIRTDXSA-N 398.466 5.269 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H]1CCc2cc(C#N)ccc21 618804527 AUSPYABCEAOJNT-XCLFUZPHSA-N 393.943 5.982 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)cc1 619435945 VLIWBKDKHHGWAV-UHFFFAOYSA-N 389.474 5.128 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)c(Cl)c2)c2ccc(F)cc2)cc1 619754584 FAIFPNRZYCKMIE-JOCHJYFZSA-N 380.850 5.239 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3nc(C4CC4)sc3c2)cc1Cl 726484915 FPELQMDKZJMXFH-UHFFFAOYSA-N 384.917 5.508 30 20 GKED C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 728006980 WGZGDTAOABKWNZ-KRWDZBQOSA-N 388.442 5.094 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(NC(=O)c3cccs3)cc2)C(C)C)c1 728247328 AWRSACGZOBWJBG-UHFFFAOYSA-N 388.492 5.037 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc2ccccc2n1 730687663 ZGMQDLQRBXHBKC-ULQDDVLXSA-N 381.262 5.522 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccccc2OC(F)F)cc1 735634646 UUVVQUOWBSGYGQ-FQEVSTJZSA-N 392.405 5.125 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)CCS[C@H](C)c3cccs3)c2C#N)C1 737406888 ZWZXCWCNLJYAJK-QWHCGFSZSA-N 390.599 5.629 30 20 GKED O=C(/C=C\c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cncc(F)c1 737444611 RTXGWTVZIMIXGR-ALCCZGGFSA-N 398.777 5.471 30 20 GKED C#Cc1cccc(NC(=O)N(C)[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 740435500 ZAKCUCYMEXCZFH-QGZVFWFLSA-N 389.524 5.633 30 20 GKED COc1c(Cl)cc(Cl)cc1/C=C/C(=O)c1c(Cl)nc2sccn12 741842755 BPFSHDIVQILVDU-NSCUHMNNSA-N 387.675 5.261 30 20 GKED CCCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)[C@@H](C)c1ccccc1 746146363 ASRGODFNMNJGJK-GHTZIAJQSA-N 398.510 5.087 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)/C=C\c1ccccc1C#N 750823401 ZWGQXQMLGOLWDO-NXVVXOECSA-N 399.494 5.098 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(-c2cccs2)n1 768319332 MPDHQKGPVJZMRY-LJQANCHMSA-N 398.491 5.056 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)Cc1ccc(O[C@H](C)C#N)cc1 769469951 IIQYFFAMUCKPIC-AEFFLSMTSA-N 391.540 5.602 30 20 GKED N#C[C@H](COC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)Cc1cccs1 772735725 KHMNUPDATDIXPX-DZZSIBQASA-N 399.821 5.273 30 20 GKED CCCCCCCCCC(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 777230424 AQVSSZYDHLZHOI-VXKWHMMOSA-N 398.591 5.421 30 20 GKED Cc1noc(-c2ccc(N[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)nc2)n1 782378439 OQBSCCLDSHWEKV-OAHLLOKOSA-N 381.439 5.152 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCCc3c(O)cccc32)cc1 789739177 SRKLVNPOLMWEPX-XZOQPEGZSA-N 382.463 5.106 30 20 GKED CC(=NNc1nc(O)c2ccccc2n1)c1cc(F)ccc1SC(C)(C)C 790294301 JIFUHAAFCNNBIF-UHFFFAOYSA-N 384.480 5.201 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(OC(F)F)c(C(F)(F)F)c2)cc1 793317920 UPMWTHPPYVKFRR-LLVKDONJSA-N 386.320 5.210 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)[C@@H](OC2CCCC2)c2ccccc2)s1 797568694 LINZISAGMFJTAP-PXNSSMCTSA-N 382.529 5.317 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1ccccc1NC(=O)OC(C)(C)C 800157108 BGJRJASIJJIFTP-UHFFFAOYSA-N 380.488 5.333 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 805857420 UMQAHKRONSBJAS-KKSFZXQISA-N 397.503 5.413 30 20 GKED Fc1ccc(NC(=S)NC(CCC(F)(F)F)CCC(F)(F)F)c(F)c1 849303114 WBLMZBRPYXTTFX-UHFFFAOYSA-N 394.331 5.305 30 20 GKED C=CCCC[C@@H](C(=O)N(C)C1CCN(CCC(F)(F)F)CC1)c1ccccc1 883986525 WBZQKCZXRNZVHL-HXUWFJFHSA-N 396.497 5.002 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)[C@H](C#N)c5ccccn5)(C4)C2)C3)cc1C 916627034 OZMTUOQMKGOTOH-PNAZIJHISA-N 384.523 5.413 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 916941899 BGPQEPYSOAEGJG-QGZVFWFLSA-N 375.255 5.078 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1F)c1nc(-c2ccc(Cl)cc2)cs1 916977033 HHDRKDQTKIONAX-BSDKJSHOSA-N 382.847 5.492 30 20 GKED O=C(O)c1cc2ccccc2c(C=NN=C(c2ccccc2)c2ccccc2)c1O 1776012345 ATILQWLQYJLLDY-UHFFFAOYSA-N 394.430 5.115 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C=NNc3ccc(C(=O)O)c(F)c3)o2)cc1 1776074200 NJUZTYVMGBWARH-UHFFFAOYSA-N 380.419 5.527 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(F)c(Cl)c3)cc2)c1 1776097797 CPKWYVBSFHNEBS-UHFFFAOYSA-N 382.822 5.219 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccccc2)cc1 1776354336 AZJOCVBLQJXWIL-GXDHUFHOSA-N 386.447 5.735 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2ncc([N+](=O)[O-])cc2C(=O)O)cc1 1776785545 LCHWLVTUGCBODY-JLHYYAGUSA-N 398.459 5.598 30 20 GKED CCCCOc1cc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)ccc1OC 1776799754 XPYZBMCEFLYJTI-AQTBWJFISA-N 394.467 5.175 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2c(Cl)oc3ccccc23)cc1 1777639347 CRPCFUNIIPKYTD-QXMHVHEDSA-N 384.815 5.226 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2cccc(SC)c2)nc2ccccc21 22351077 AOSPUKRDRZLWDU-CQSZACIVSA-N 383.542 5.064 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 41522511 QQRCMNJDOJYHEV-SFHVURJKSA-N 399.475 5.193 30 20 GKED Cc1[nH]c2c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cccc2c1C 41556905 CTQXPOLNQXVKHL-OAHLLOKOSA-N 378.382 5.020 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1sc2c(c1C#N)CCCC2 60915395 XMAAUSWBOWGXBU-UHFFFAOYSA-N 383.476 5.290 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccc(C)cc2C)s1 61140118 WSCDHHODNKHSJD-UHFFFAOYSA-N 389.524 5.351 30 20 GKED CCc1ccc(C(=O)CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66856461 QFIHROKIJBHOHA-INIZCTEOSA-N 380.513 5.245 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)cccc1-c1ccccn1 118979977 VRRDNCCJQSIROM-MRXNPFEDSA-N 387.508 5.704 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 120721920 QHOLZIHSZNFFQV-UHFFFAOYSA-N 386.835 5.362 30 20 GKED O=C(Nc1cccc2oc(C(F)(F)F)nc12)c1ccc(F)cc1C(F)(F)F 124292546 JLNPVFVPPOYBKR-UHFFFAOYSA-N 392.230 5.257 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc3c(c2)CCCC(=O)N3)c1 130451825 NVQIQINYUDTRQZ-UHFFFAOYSA-N 397.478 5.024 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Cc2ccc(Br)cc2)n1 162460692 SILSDLHQEXXOOJ-WFASDCNBSA-N 391.334 5.084 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)C(=O)N1CCC[C@H]1c1cccs1 163310626 SZZHQTLPRHSEKB-DOMZBBRYSA-N 376.934 5.117 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H]2CCCC[C@H]2C1 176966757 YMJDVULPHHJRTO-OYRHEFFESA-N 389.499 5.100 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1S[C@H](C)CC#N 178392111 ZXCRAPLOLBGGMJ-MRXNPFEDSA-N 397.569 5.410 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(Cl)cn1 189730914 SEVNOFZEFJWMAY-AWEZNQCLSA-N 393.899 5.249 30 20 GKED COc1cc(/C=C2\CCSc3ccc(Cl)cc3C2=O)ccc1OCC#N 255151200 OYPUFNRLZDKDNV-GXDHUFHOSA-N 385.872 5.013 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccc(CC#N)cc1 302657679 RELDYOAOAFCQGW-UHFFFAOYSA-N 391.474 5.458 30 20 GKED CCN(C(=O)CCCCOc1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 303439722 HNYUJMVSBKMKSC-GOSISDBHSA-N 390.483 5.463 30 20 GKED O/C(=N/[C@@H]1CCO[C@@H](c2ccccc2)C1)NC1CC(c2cccc(Cl)c2)C1 329744019 QKYJAEPBUYKASN-BCKAPOECSA-N 384.907 5.010 30 20 GKED C[C@H](C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1c(Cl)cccc1Cl 330005981 CKLKLEOIVSHTCZ-DNOWBOINSA-N 397.346 5.979 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1c1nc2ccccc2s1)c1ccccc1 375682250 FCEMEXYAMKRZGV-IEBWSBKVSA-N 375.497 5.047 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 409751308 FQZAUMGHOBMZBB-UHFFFAOYSA-N 396.418 5.603 30 20 GKED CCCN(CC)C(=O)c1ccc(C(=O)Nc2scc(C(C)(C)C)c2C#N)cc1 410923770 CNTZWNJXOYDKBO-UHFFFAOYSA-N 397.544 5.042 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@H](C)C3)s1 411021914 XEZCTVSQYWFYIX-JBLDHEPKSA-N 389.546 5.030 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425663029 PGOXKIUOFHJMOW-RBUKOAKNSA-N 390.531 5.470 30 20 GKED COc1ccc2cc([C@H](C)SCC(=O)Nc3ccc(C#N)cc3)ccc2c1 438795604 YPKRVRPYIIYQJD-HNNXBMFYSA-N 376.481 5.153 30 20 GKED CCO[C@H](C)c1nc(CSCc2ccc(C#N)cc2OC(F)F)cs1 439538015 WRTKJDKEZYOJSN-LLVKDONJSA-N 384.473 5.147 30 20 GKED CCC[C@H](NC(=O)NCC1CCC(C#N)CC1)c1cccc(C(F)(F)F)c1 441005526 ARVKGMXVLJOTGB-JMLCCBQJSA-N 381.442 5.176 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(-c3ccccc3)ns2)c2ccccc21 444796581 AYUNJQXADJFMQG-UHFFFAOYSA-N 386.480 5.321 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N[C@H](c1cc(F)ccc1F)C(F)F 447711629 ZDPJMUMAIMYOPN-HKJQSTPSSA-N 385.323 5.146 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCC(=O)C2CC2)cc1Cl 448709152 OHXBRHLYYGGCNE-IBGZPJMESA-N 380.875 5.083 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)c1C#N 460172823 OONMQZITGZLMON-UHFFFAOYSA-N 383.517 5.036 30 20 GKED Fc1ccc([C@H](NCc2cncc(C(F)(F)F)c2)C(F)(F)F)cc1Cl 463210396 NETOBTOXZIVUIZ-ZDUSSCGKSA-N 386.698 5.286 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 465803806 DPJNBZHBRXOFGA-FKBYEOEOSA-N 391.515 5.018 30 20 GKED CC1(C)CCC(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 466011225 OBWCIKPWYYWETP-UHFFFAOYSA-N 391.515 5.422 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1cc(F)ccc1F)C(F)F 470121681 LAKSANLYGWZOGG-GOSISDBHSA-N 380.385 5.059 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1ccccc1Sc1ccccc1C#N 470621968 RTTWEACNTXVWAP-CJNGLKHVSA-N 390.430 5.122 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCSc2ccc(F)cc21 475551870 YLMJPUQJNUKPGX-IBGZPJMESA-N 384.520 6.036 30 20 GKED Cc1sc([C@H](C)NC(=O)c2ccc(C#N)s2)nc1-c1ccc(Cl)cc1 479202556 COPWYFAOJVNGJA-JTQLQIEISA-N 387.917 5.196 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1ccc(F)cc1 483198402 QCCGEUGJEMJMAK-FQEVSTJZSA-N 398.441 5.002 30 20 GKED CCc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1C(CC)CC 485514624 CPXRYNXVASMKFB-OAHLLOKOSA-N 384.549 5.311 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@H](CCCC#N)c1ccccc1 487537910 OBGVUPYOSISZDY-NZQKXSOJSA-N 376.500 5.057 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nnc1-c1ccccn1 488917763 WOYFMKXWLVCISD-UHFFFAOYSA-N 393.903 5.020 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 490312177 DVMNAVWLCPRPSP-VGOFRKELSA-N 395.572 6.108 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccn3C3CCCC3)n2)cc1 496576389 ZBAACAXVAJKGCG-SFHVURJKSA-N 375.497 5.525 30 20 GKED Cc1cccc(C)c1OC[C@@H](NCCCC1(C#N)CCOCC1)c1ccccc1 499605772 LAPJSXOXAIYDMZ-HSZRJFAPSA-N 392.543 5.114 30 20 GKED C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)o1 499837939 JIXPAYCJBBSOEO-CRQFQMBKSA-N 389.282 5.194 30 20 GKED Cc1ccccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 502317041 LCQJMSALQRMTAU-LJQANCHMSA-N 375.859 5.948 30 20 GKED CCC[C@H]1C[C@@H](C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 502799652 SPIVZEITCQITAZ-UNMCSNQZSA-N 394.490 5.134 30 20 GKED C=C(C)[C@H](NC(=O)C[C@@H](c1cccs1)n1cccc1)c1ccc(F)c(F)c1 505965484 VDNPEIANROGUOD-RXVVDRJESA-N 386.467 5.241 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)cc12 507885839 FXJNHALFJQKLQI-UHFFFAOYSA-N 398.422 5.262 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSc2cc(C)c3ccccc3n2)c1C 510384490 MMJAMRUSUARNFX-UHFFFAOYSA-N 389.524 5.199 30 20 GKED Cc1cc(Cl)ccc1OCCCNC(=O)Nc1ccc(C(C)(C)C#N)cc1 510781232 SXXYUVHLSQRLSJ-UHFFFAOYSA-N 385.895 5.040 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)cc1 511695117 HCGNSCXOWMSETG-UHFFFAOYSA-N 385.398 5.152 30 20 GKED N#Cc1ccnc(SCC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)c1 514563600 AHNUOKXJBSJGAF-UHFFFAOYSA-N 395.871 5.130 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccccc2SC2CCCC2)cc1 515158114 DINAGSZJTVUQRU-UHFFFAOYSA-N 382.554 5.465 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 518168310 AFZCPIVNJYFPMC-PBHICJAKSA-N 385.558 5.541 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(c4ccccc4)CC3)cc2)c1 518256774 ORFYGIYDYJVWMR-UHFFFAOYSA-N 397.478 5.762 30 20 GKED N#Cc1ccc(CC(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)cc1 518311658 YKUAVFFIAWPFRJ-AREMUKBSSA-N 376.459 5.160 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc(Cl)ccc2Oc2ccc(F)cc2)n1 520446187 URVMBINIYNIIJE-MRXNPFEDSA-N 386.835 5.526 30 20 GKED C=C(C)COc1cc(CNCc2ccnc(OC3CCCCC3)c2)ccc1OC 521827155 CTXMEJLOYMXMSP-UHFFFAOYSA-N 396.531 5.046 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1Cl 522074873 DHSWAQFTJCMJDA-UHFFFAOYSA-N 398.812 5.588 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1cccc(CSCc2ccccc2)c1)C1CC1 533138872 YXINBQYVQBTSIZ-KRWDZBQOSA-N 379.529 5.276 30 20 GKED COc1ccc(CN2CCS[C@H](C)[C@@H]2c2ccccc2)cc1OCCCC#N 536662066 NFBYYTIGRGWUHK-WZONZLPQSA-N 396.556 5.056 30 20 GKED C[C@H](NC(=O)[C@@H](C)n1cnc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 541133117 QQOCEKJBFDUMQA-ZWKOTPCHSA-N 394.478 5.013 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC=C(c2ccccc2F)C1 542022999 GNCOJQKZBLMPLT-HNNXBMFYSA-N 381.476 5.151 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC=C(c2ccccc2F)C1 542023001 GNCOJQKZBLMPLT-OAHLLOKOSA-N 381.476 5.151 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1cccc(OCCCC#N)c1 542718177 PVPIMBGUESRESN-UHFFFAOYSA-N 395.503 5.718 30 20 GKED CC(C)CN(C(=O)Nc1ccc(C#N)cc1Cl)[C@@H]1CCCc2cccnc21 547830772 VWPFZORSESZTHH-LJQANCHMSA-N 382.895 5.174 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)Nc1ccc(C#N)c(Cl)c1 548928090 RUFSVIZPTQSLPH-UHFFFAOYSA-N 376.847 5.150 30 20 GKED CC(C)(CNC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C(F)(F)F 548959507 SZUVBIBQUDZNNM-UHFFFAOYSA-N 395.356 5.200 30 20 GKED N#CCC[C@H](NC(=O)NCc1cccc(OCc2ccccc2)c1)c1ccccc1 554020683 LLWVCKWAPVOZIQ-DEOSSOPVSA-N 399.494 5.110 30 20 GKED C=CCN(C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)c1nc2c(s1)CCCC2 567524734 DUFJLZKQGWUHLU-MRXNPFEDSA-N 396.556 5.183 30 20 GKED N#CCc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c(Cl)c1 576711053 SUBDPURQGMRSPJ-DBXWQHBBSA-N 379.891 5.206 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)cc1 577511675 VQZQJBWCEZGPPC-HUUCEWRRSA-N 394.540 5.325 30 20 GKED CC(C)(C)c1ccccc1NC(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1 578924293 LBMYLUSNPCOVEP-UHFFFAOYSA-N 395.478 5.070 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nnc(Cc2ccccc2)n1-c1ccccc1 590742182 DROPRNQOYUVIDG-QFIPXVFZSA-N 396.519 5.085 30 20 GKED CCN(C(=O)[C@@H](C)Cc1ccc(C#N)cc1)[C@H](c1ccc(C)cc1)c1cccnc1 593972407 CBYKGACTHYRHHF-NBGIEHNGSA-N 397.522 5.078 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N2CCc3sccc3[C@H]2c2ccc(Cl)cc2)C1 596613518 YRMFKOJVDASRRC-GZRFBZBPSA-N 399.947 5.141 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 603527341 KGBQWSSIZCYHBP-OALUTQOASA-N 386.417 5.118 30 20 GKED Cc1cc(F)cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 608552906 QFNMJGBIRIOEDE-ZDUSSCGKSA-N 378.350 5.253 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1cccc(Cl)c1Cl 609416366 KPAOVYYAWCKSGA-HNNXBMFYSA-N 378.646 5.123 30 20 GKED CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 609439024 SNRYWOJJEDMEPX-MJGOQNOKSA-N 381.545 5.614 30 20 GKED Cc1cccnc1[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C(C)C 609645727 POMCHJSUTRSVEO-JOCHJYFZSA-N 385.467 5.181 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCS[C@@H](c2ccccc2)C1 609791874 VKKMPRMRNKMQCP-HSZRJFAPSA-N 384.504 5.156 30 20 GKED N#C[C@@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc2ccccc2n1 613292580 OYARPZZMNANEFS-GFCCVEGCSA-N 397.286 6.246 30 20 GKED C=CCn1c(S[C@@H](C)c2cc(F)ccc2F)nnc1-c1ccccc1OC 615346685 VHVFDEABYAGAQJ-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccoc1C(F)(F)F 619129856 UFOJRYHHVHKECQ-UHFFFAOYSA-N 385.226 5.082 30 20 GKED Cc1cc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)nn1C 647323453 NILASBHFNSKCAM-SNVBAGLBSA-N 383.311 5.191 30 20 GKED C[C@H](CC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1cccc(C(F)(F)F)c1 650352301 OZEFYVJRSDVJFR-LLVKDONJSA-N 397.334 5.092 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 661118124 WVMOHAOOHBITGC-CTNGQTDRSA-N 397.588 5.669 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCOc2c(OC)cccc21 682776948 BFMQXNPKVURCMF-LJQANCHMSA-N 380.488 5.192 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)Cc2coc(-c3cccs3)n2)c1 729949380 GLPYAGLSDIJHDK-UHFFFAOYSA-N 398.487 5.160 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1sccc1-c1ccc(F)cc1 730988745 CODMRGKZRRCPKW-AWEZNQCLSA-N 396.512 6.058 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 731136687 UZSXAAXCPCCAJH-RHSMWYFYSA-N 380.900 5.636 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 731287427 BGKSGRIGSVTQGS-YPAWHYETSA-N 392.458 5.325 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 734644725 UBPDVEUGCJMWJZ-RZPHLTDDSA-N 395.506 5.752 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1ccccc1)Cc1ccccc1)c1ccncc1 734684533 TXMPBSLIKGLFLH-XMMPIXPASA-N 385.511 5.153 30 20 GKED C#CCOc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1OCC 741473527 RVFODBKBDBYAFL-NTMALXAHSA-N 383.447 5.055 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Oc3ccc(F)c(F)c3)n2)cc1 744936592 TZKLOUONMSDOOO-CJNGLKHVSA-N 398.434 5.041 30 20 GKED C#Cc1cccc(N(Cc2nc([C@@H](C)OCC(C)C)no2)Cc2cccs2)c1 745983674 DALFAQHQCKZPIW-QGZVFWFLSA-N 395.528 5.053 30 20 GKED CC(=NO[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1cc2ccccc2o1 749255522 BWRLYAOKCSRYHW-ZDUSSCGKSA-N 390.361 5.219 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(Cl)nc1C 751700615 NVKPCJOFXXHSDO-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C[C@@H](OC(=O)c1ccc(C(F)(F)F)cc1C#N)c1ncc(-c2ccccc2)o1 758120806 ADIMOQRKCNQBCG-GFCCVEGCSA-N 386.329 5.150 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN(C)Cc2ccc(C)s2)c1=S 764973475 PYCZOKSBKOFXHP-UHFFFAOYSA-N 384.574 5.035 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3cccc(O[C@H](C#N)CC)c3)oc12 776163381 AGFHCWQFDBABSY-LPHOPBHVSA-N 378.472 5.363 30 20 GKED Fc1ccccc1NC(=S)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 776203370 NOCXBJWXHCZFNT-ZDUSSCGKSA-N 396.331 5.435 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3cccs3)cc2F)C(=O)c2ccccc2C1 778519579 IVAJADQFIIXJGV-YBFXNURJSA-N 391.467 5.183 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1 780670539 LUYXJHBIIAIDDF-VLIAUNLRSA-N 395.459 5.089 30 20 GKED C=CCC[C@H](NC(=O)Cc1ccc(Cl)cn1)c1ccc(C(F)(F)F)cc1 786434666 BUSQYUOXPUYESZ-KRWDZBQOSA-N 382.813 5.120 30 20 GKED Cn1ccc2cccc(NC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c21 788284881 KRYMMOSLBPZTEU-OAQYLSRUSA-N 380.451 5.478 30 20 GKED CCCCOc1ccc(C=NO[C@H](C)c2noc(-c3ccccc3)n2)cc1OC 789578287 WNYQZONUOAKNJE-MRXNPFEDSA-N 395.459 5.036 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)Nc1ccsc1 790319355 HEQSHAGWGXLUQE-UHFFFAOYSA-N 387.477 5.582 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 793281855 NRVHMSRVAWKVIR-UUOWRZLLSA-N 392.458 5.546 30 20 GKED C=CCCC[C@H](C)Sc1nnc([C@H]2CCCN(C(=O)OC(C)(C)C)C2)o1 795257906 HNPBWDRVDYJLEP-GJZGRUSLSA-N 381.542 5.021 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCC(C)(C)c3ccccc32)ccc1OC 795803207 ODFMUZHXFGQDJX-GHTZIAJQSA-N 378.516 5.278 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1ccc(OCC2CCOCC2)cc1 795808696 AOBOWRDODKELPU-XMMPIXPASA-N 376.500 5.243 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cs2)c1 797571499 SELQHRBUFBKNTF-INIZCTEOSA-N 395.553 5.292 30 20 GKED COCC[C@@H](Nc1nc(Cl)c(C#N)s1)c1ccc(Cl)c(Cl)c1 804708862 UVRINPRXDMUIMH-LLVKDONJSA-N 376.696 5.165 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C/c3ccc(-c4ccncc4)cc3F)cc12 806577452 RANXCASHYDCOGE-AATRIKPKSA-N 377.444 5.040 30 20 GKED Cc1ccc(-c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)cc1C#N 809532551 GFEOEODTHMVOBA-UHFFFAOYSA-N 396.328 5.258 30 20 GKED C=CC[C@H](C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817870536 RUXGYJGUEFBCMB-WFASDCNBSA-N 382.813 5.291 30 20 GKED N#C[C@@H](C(=O)Cc1ccccc1OC1CCCC1)c1nc2ccccc2s1 838782312 JYWDRTHKZPIIHB-KRWDZBQOSA-N 376.481 5.037 30 20 GKED Cc1cc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n(C)n1 842892487 FIGLMUFDFZSMHP-SNVBAGLBSA-N 383.311 5.191 30 20 GKED C=CCOc1ccc(CC(=O)Nc2cccc(NC(=O)OC(C)(C)C)c2C)cc1 862718033 BFMBLJSRPNLXOZ-UHFFFAOYSA-N 396.487 5.088 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1ccccc1[N+](=O)[O-] 914555254 CGNJIJJJFVSCNS-UHFFFAOYSA-N 383.839 5.003 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CCCc2ccccc21 915352404 HXFLCTSKDJRUJU-JWQCQUIFSA-N 395.506 5.883 30 20 GKED Cc1ccc(Sc2ccc(CNCc3ccc(C#N)cc3)cc2[N+](=O)[O-])cc1 915681102 PGJSFXJPEHGKEG-UHFFFAOYSA-N 389.480 5.216 30 20 GKED O=C1/C(=C/c2cn(-c3ccccc3)nc2-c2cccnc2)CCc2ccccc21 916135686 HQLAWHFGRVMJKY-XDJHFCHBSA-N 377.447 5.147 30 20 GKED Cc1cccc(O[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916977270 OTCZHDVAXBBFBD-KDOFPFPSSA-N 396.899 5.416 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2cccc(Cl)c2Cl)SC1=S 917644559 HONMJAPEGUIRIB-ZSOIEALJSA-N 391.304 5.271 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)c(O)n1 1630154297 QORVHWOEJNRTFT-UHFFFAOYSA-N 395.871 5.024 30 20 GKED C/C(=C\c1ccc(-c2ccccc2C(=O)O)cc1)c1nc2ccccc2n1CC#N 1776197235 OZNNPHFWAVWCFA-WUKNDPDISA-N 393.446 5.486 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(OC(C)(C)C)c1 1776355353 BOVVGJMUCOVYSM-LUAWRHEFSA-N 382.456 5.245 30 20 GKED CC(=C/c1cc(F)cc(F)c1)/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776398810 KDUWDEPTXSXFNJ-CPUPZMNPSA-N 394.373 5.765 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc1)C(=O)O 1776469847 URDUHZVTYDRCDP-YMDFIQGPSA-N 396.508 5.469 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Cl)c(Br)c1 1776784184 MFECXUGCFMXFOO-AWEZNQCLSA-N 390.749 5.396 30 20 GKED O=C(O)c1ccc2scc(/C=C3\COc4cc(F)c(Cl)cc4C3=O)c2c1 1777685734 VCADYPSWIOTAKE-XCVCLJGOSA-N 388.803 5.051 30 20 GKED O=C(O)c1ccc2scc(/C=C3/Cc4cc(Cl)cc(Cl)c4C3=O)c2c1 1777685792 YHNRSDJJULWTHB-WCIBSUBMSA-N 389.259 5.729 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)C3CCCC3)CCC2)cc1 1789451937 WZXIKDCGSYODNF-NRFANRHFSA-N 380.532 5.079 30 20 GKED Cc1ccc(-n2c(SC[C@H](C#N)CCC#N)nnc2-c2ccccc2)cc1C 15232753 WVSTYGWCWFUONN-SFHVURJKSA-N 387.512 5.087 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccccc2F)[n+]2ccc(C)cc2)cc1 27161942 UMSOBBMJHTWKGJ-UHFFFAOYSA-O 393.507 5.035 30 20 GKED CCOc1cccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 54812288 PCXDHGJFLUOBGV-CQSZACIVSA-N 390.386 5.204 30 20 GKED CCCN/C(S)=C(\C(=O)c1ccccc1C)[n+]1ccc(C(CC)CC)cc1 55012838 BQXVVAUWEZPOOW-UHFFFAOYSA-O 383.581 5.125 30 20 GKED COc1ccc(CNC(c2ccccc2)c2ccccc2)cc1OCCCC#N 64613252 PLQZXTODTPHSCH-UHFFFAOYSA-N 386.495 5.257 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc4c3CCCC4)n2)cc1 66544835 ACURLRQVBXJNDO-INIZCTEOSA-N 389.505 5.112 30 20 GKED CCc1cc(C#N)c(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)s1 98115044 BJMGAJYHBPEKMB-UHFFFAOYSA-N 393.946 5.202 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)s1 108529252 CERRWPSHFISOSY-TZMCWYRMSA-N 388.562 5.237 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108531192 JFXRSXWTVRMVKS-KRWDZBQOSA-N 395.528 5.167 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccnc(SCC(F)(F)F)c1 112580792 IPIRVULMIUVNAW-UHFFFAOYSA-N 398.303 5.146 30 20 GKED C[C@H](N[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 123873310 UDIBIVWIGINPEC-RYUDHWBXSA-N 387.270 5.327 30 20 GKED C[C@@H](Sc1cc(C#N)ccn1)c1nnc(-c2ccc(Cl)cc2Cl)o1 155513094 OBNSFEATCKONGV-SECBINFHSA-N 377.256 5.163 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C/C=C/c1ccc(F)cc1 174984322 HVXKJYMUAHSTQV-DUXPYHPUSA-N 387.414 5.235 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccn3)ccc2Cl)sc2c1CCCC2 178805771 KPURGXNDRUKQSP-UHFFFAOYSA-N 393.899 5.466 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc3cc(C)c(C)cc3o2)ccc1OC 180815051 REVJQUVWFAJNSO-PXNSSMCTSA-N 392.499 5.590 30 20 GKED CC(=O)CC(C)(C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 191742598 SINRFIOACZMFOR-IBGZPJMESA-N 382.891 5.329 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2c(C)c(C)nc3ccccc23)ccc1OC 302097006 SOOUOSMTZLIYRN-SFHVURJKSA-N 375.472 5.153 30 20 GKED N#C[C@@H](C(=O)[C@H]1CSc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 303734776 WNLGSGYENXHTRH-HOTGVXAUSA-N 396.924 5.529 30 20 GKED Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2N=C(O)[C@H]2CCC(=O)[C@@H](C)C2)n1 328929032 YHAAYECVPMUUAY-FZMZJTMJSA-N 393.409 5.101 30 20 GKED COc1c(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc(Cl)cc1C(=O)N(C)C 329150357 RMHWIHPNVAWXNC-SOUVJXGZSA-N 392.927 5.245 30 20 GKED O/C(=N/[C@@H]1CCCc2nc(O)ccc21)[C@@]1(Cc2ccccc2)C[C@H]2CC[C@H]1C2 330090797 PNZAGASMDNVJCT-NIMADECDSA-N 376.500 5.170 30 20 GKED C=CCC[C@@H](NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)c1ccccc1 378102734 SEYFHVIBZPQEIW-WOJBJXKFSA-N 394.519 5.281 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@@H]2C 410980791 NFLYEIKZVVAFEU-RYUDHWBXSA-N 395.484 5.043 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CC(F)F)c1ccccc1 421055701 HDJBKSOXCVDXKG-WMLDXEAASA-N 389.471 5.599 30 20 GKED CCN(C(=O)Nc1cccc(C#Cc2ccccn2)c1)[C@@H](C)Cc1ccsc1 429430221 AQYAJICGGDSBLE-SFHVURJKSA-N 389.524 5.028 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2c[nH]nc2-c2cc3ccccc3o2)s1 430609712 IMZPNMXZSBXDBH-ZDUSSCGKSA-N 390.468 5.067 30 20 GKED CN(Cc1ccc(C#N)cc1)Cc1csc(-c2ccc(Br)cc2)n1 431386624 PBWANAIEDJSHME-UHFFFAOYSA-N 398.329 5.076 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc2c(cc1Cl)OCCCO2)c1ccccc1 432699615 NUOWIKKEERBUTI-QGZVFWFLSA-N 399.878 5.058 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1Cc1ccccc1 437596188 VPWMLSMSLMPTHA-NOZRDPDXSA-N 395.506 5.581 30 20 GKED N#Cc1ccc(CNc2ccccc2NC(=O)C[C@H]2C=CCC2)c(OC(F)F)c1 439558931 ZDVCXONFEWRUNA-HNNXBMFYSA-N 397.425 5.067 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccccc1 440245319 UTQZWPNDJCDMKZ-QFIPXVFZSA-N 397.469 5.464 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2cscn2)c1)c1nc(-c2ccccc2)cs1 442673572 SVCIEQUJRKXTKO-KRWDZBQOSA-N 387.489 5.424 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1SCCc2sccc21 443854823 KTQSWVFEENHOGO-QGZVFWFLSA-N 382.535 5.317 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 444452924 ZXGSRCJPLOGJOG-UHFFFAOYSA-N 385.398 5.532 30 20 GKED CC[C@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1nc(C)cs1 444678648 XNZZKHRKKNUVPX-NRFANRHFSA-N 375.541 5.392 30 20 GKED C[C@@H]1C[C@@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCO1 456897193 KASWJTRXWMIFPN-KGLIPLIRSA-N 386.904 5.116 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc2cc(C(F)(F)F)ccc2n1C 463413297 CYHFLVKRSZOIGA-UHFFFAOYSA-N 399.416 5.121 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cccc2cc[nH]c12 466428443 MVHWANYTRBKMJN-UHFFFAOYSA-N 396.450 5.462 30 20 GKED CC(C)(C)Nc1ccccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 466441835 QKNATFHDIIEDRW-UHFFFAOYSA-N 389.455 5.193 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)Cc3cccc(C(F)F)c3)c2)c1 468291008 OQHQPEPJSBMICM-UHFFFAOYSA-N 392.405 5.256 30 20 GKED C[C@H](c1ccccc1)N(Cc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1 468504817 HXFJPMYWYMOJNV-GOSISDBHSA-N 380.451 5.376 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCc4c(Cl)cccc43)ccc21 469180427 JCOHFNHEXSQMRP-HXUWFJFHSA-N 379.891 5.022 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 471911811 OSGPTQOTNOOQOA-PKTZIBPZSA-N 389.543 6.066 30 20 GKED CSc1cccc(C)c1NC(=O)c1cccc(COc2ccccc2C#N)c1 472226559 XGGAVJUVXMPVEJ-UHFFFAOYSA-N 388.492 5.420 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(OC)c1 475557291 XRJQQIPNHOWBLR-FDDCHVKYSA-N 392.543 6.162 30 20 GKED CC(C)Oc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c(C(F)(F)F)c1 475636473 BQSBDFYSNWBPNI-MRXNPFEDSA-N 390.405 5.519 30 20 GKED CC(C)(CNC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 476957638 DLMXLJNNOMVSDH-KRWDZBQOSA-N 388.433 5.187 30 20 GKED CC(C)CO[C@H](C)c1noc(COc2ccc(Oc3ccc(C#N)cc3)cc2)n1 480324028 CJLLLDOSGRZMPS-MRXNPFEDSA-N 393.443 5.046 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2c(F)cc(F)cc2F)cc1 481860144 PYVISYFRCWRQLC-UHFFFAOYSA-N 384.382 5.379 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(OC2CCCC2)c1 482854947 GYZZFNYTEYVWFP-QGZVFWFLSA-N 384.501 5.087 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(CCCC)c1C(C)C 485170410 KQKJDWSGVTWRIS-UHFFFAOYSA-N 394.972 5.742 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccccc2F)n1 500315277 GWSWUYRYOOMDCY-UHFFFAOYSA-N 393.487 5.119 30 20 GKED Cc1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)NCCCCC#N)cc1 505085581 BGAKJVZBJPDOOH-JZJYNLBNSA-N 395.506 5.454 30 20 GKED Cc1ccc(Cl)cc1NC(=O)CSc1nc(-c2ccccc2)ccc1C#N 510213236 VSIBOPUNKTXAQL-UHFFFAOYSA-N 393.899 5.313 30 20 GKED C=CCN(C(=O)c1sc(C(C)C)nc1C)c1nc(-c2ccccc2)cs1 515086735 OBIQDESTFBJOGD-UHFFFAOYSA-N 383.542 5.531 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)Cc1ccsc1 516640411 QOVNSXYSNOXEEG-INIZCTEOSA-N 391.496 5.473 30 20 GKED CC[C@@H](NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)(C)C 518485492 BLMCKSAQZAXOEO-OAQYLSRUSA-N 379.504 5.278 30 20 GKED CCOc1cccc(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 518754351 HWFALNQHNGYRDS-UHFFFAOYSA-N 387.439 5.071 30 20 GKED Cc1ccccc1C[C@@H](C)NC(=O)c1ccccc1Sc1ccccc1C#N 519114289 JVMCWPHCHBVOMB-GOSISDBHSA-N 386.520 5.379 30 20 GKED C=C(C)COc1cccc(NC(=O)NCc2csc(-c3ccccc3)n2)c1 523768288 MGXZNTFYYJGFCJ-UHFFFAOYSA-N 379.485 5.087 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3cc(C(C)(C)C)sc3C#N)s2)o1 536012123 ZRYMBHMGROYWGQ-UHFFFAOYSA-N 385.514 5.503 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccccc1 540147411 UMGRGGQKNKBBLV-DVECYGJZSA-N 397.584 5.761 30 20 GKED C=CCC[C@H](NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 542627967 UFXHGOPEADEXPL-HNNXBMFYSA-N 392.833 5.040 30 20 GKED CC(C)[C@H]1C[C@@H](CC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542928916 XFLGPIWEVPTJPU-AXHZCLLHSA-N 390.527 5.244 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1ccc2ncsc2c1 548599959 KSJWGUHESJTQOW-ZIAGYGMSSA-N 396.541 5.431 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCC[C@@H]1c1ccccc1 553071718 WSCDSULOLANKQC-RLLQIKCJSA-N 393.556 5.786 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(CCC(C#N)(c2ccccc2)c2ccccc2)C1 554265658 UJVGNXMQVJZXMR-PXDATVDWSA-N 381.523 5.364 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(-c2cccs2)c1 554424991 LBAPFPFFYPVSPR-UHFFFAOYSA-N 394.544 5.803 30 20 GKED N#CCCCn1cc(-c2nc(Cc3nccc4ccccc34)no2)c2ccccc21 554830377 PCORQGRIEPTOIG-UHFFFAOYSA-N 393.450 5.134 30 20 GKED CCc1oc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1C(=O)OC 555320326 HAARVXWROPBOIG-INIZCTEOSA-N 388.467 5.018 30 20 GKED N#CCc1ccc(NC(=O)CNc2cccc(-c3cccc(Cl)c3)c2)cc1 559946674 QZFBFBHQXYYTHT-UHFFFAOYSA-N 375.859 5.124 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 561624491 YNBKSYPOWMCFHX-KRWDZBQOSA-N 390.508 5.643 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c2)cc1 565069681 JCZWNLTVORMSPP-JOCHJYFZSA-N 382.419 5.049 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)NC[C@@H](C)C#N)c2)cc1 570000587 UNJGKVZIGJDOCL-ZWKOTPCHSA-N 379.504 5.003 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(-n2cccn2)c1 581847000 QQYOCBVBKBHALU-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#C[C@H](C(=O)c1cccc(C(F)F)c1)c1nc2cc(C(F)(F)F)ccc2s1 591020071 MQZPDYQBMIGXDD-GFCCVEGCSA-N 396.340 5.743 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC[C@H]1CCCCC1(F)F 596393313 JVVZVBJLBIVVTQ-HUUCEWRRSA-N 398.544 5.436 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N1CC[C@](C)(C#N)C1 596828974 JZBCZVQRARRQAZ-OAQYLSRUSA-N 394.475 5.178 30 20 GKED CC(C)Oc1ncc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1Cl 603969785 NLQWIERJNZJFDU-UHFFFAOYSA-N 397.887 5.375 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(OCC(F)(F)F)c(C(F)(F)F)c2)CC1 605938897 NVZMOMQUBWYSCB-UHFFFAOYSA-N 396.331 5.076 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)c2ccc(COc3ccc(C#N)cc3)o2)c(C)c1 609056335 HGUAWJUUCLCWGJ-SFHVURJKSA-N 388.467 5.180 30 20 GKED CCCN(C(=O)Cc1nc(-c2ccccc2)oc1C)c1cc(Cl)ccc1C#N 609286031 JJYBOMMTTIOMMY-UHFFFAOYSA-N 393.874 5.161 30 20 GKED COc1cccc([C@@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609500027 IDNFDFVXDIHCJM-QGZVFWFLSA-N 386.451 5.045 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)Cc3ccc(C#N)cc3)s2)cc1 610050881 OGAVDQZRPXSCMY-QGZVFWFLSA-N 389.524 5.061 30 20 GKED CC(C)C[C@@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361799 BTLYZMNOBHDYND-MJGOQNOKSA-N 381.442 5.128 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 676723679 DCXKBYZMYNHTDF-KDOFPFPSSA-N 377.410 5.168 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1c[nH]c2ccc(OC)cc12 682777201 HSFVCXDAFHWVIZ-UHFFFAOYSA-N 391.515 5.393 30 20 GKED C=CCCC1(c2nc([C@H](OCC)c3ccc(F)cc3C(F)(F)F)no2)CC1 685402255 UTNWFOPKYVMMAP-OAHLLOKOSA-N 384.373 5.351 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 728182292 HXWMRLWNMXJZKY-DLBZAZTESA-N 375.390 5.163 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420762 FXOKWTUFHIRQAH-KDOFPFPSSA-N 394.471 5.130 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc(-c2ccccc2)cs1 731287670 IAQPFSPNHSHJBZ-BHIFYINESA-N 394.499 5.943 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1cnn(-c2cccc(Cl)c2)c1C 731557601 SQQTWCGOBUKGPP-UHFFFAOYSA-N 393.800 5.084 30 20 GKED CC(=NNc1nc(-c2ccc(Cl)cc2)no1)c1sc(C(C)(C)C)nc1C 732925415 KHXVUJTTWPDQKI-UHFFFAOYSA-N 389.912 5.289 30 20 GKED C[C@@H]1CCCC[C@@H]1OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679246 DSWOKLKHABCRPB-NRXGSXMXSA-N 388.920 5.235 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1)c1ccccc1C(F)(F)F 744161517 UOPABRKXNIFHBM-WVUXNXBLSA-N 383.373 5.170 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)Cc1ccccc1Cl 746214834 BXCTXVPIPBDOPD-KRWDZBQOSA-N 383.923 5.010 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CSCc2ccc(Cl)cc2Cl)n1 747194405 ZLXPBAHWPVCXCI-CYBMUJFWSA-N 399.368 5.683 30 20 GKED Cc1cccc(-n2c(C)cc(C(=O)Nc3nc(C)c(SCC#N)s3)c2C)c1 747210564 IFMPMIPHUAPZRF-UHFFFAOYSA-N 396.541 5.035 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(-c3cccs3)s2)ccc1OC(F)F 751513666 SFGYDLVIIAVEIU-AATRIKPKSA-N 393.436 5.378 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CC[C@H]1c1ccc(Cl)cc1 752239846 FVVHVIZKYOBOJM-QFIPXVFZSA-N 387.870 5.114 30 20 GKED CC(C)CN(CCC#N)C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 753512118 UBJXLPFOIBEQGE-UHFFFAOYSA-N 392.286 5.193 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)[C@@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 763939637 BIRYYOVQPBAFBI-UYAOXDASSA-N 388.492 5.033 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C/C=C\c2ccc(C(C)C)cc2)c1 764235016 AZQFXYLZIXDDIR-DYRFGFBLSA-N 376.500 5.211 30 20 GKED COc1ccc(/C=C\C(=O)c2csc(Cl)c2)c(OCc2cccnc2)c1 766492436 XXDMSLXOLOVESY-ALCCZGGFSA-N 385.872 5.280 30 20 GKED N#CC1(c2ccccc2)CCC(NC2CCN(CC3CCCCC3)CC2)CC1 768401194 JIEJGHRJSUHVNG-UHFFFAOYSA-N 379.592 5.025 30 20 GKED N#Cc1ccc(F)c(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 771971351 RXFUBTITLQICGE-UHFFFAOYSA-N 376.275 5.025 30 20 GKED CC(C)(C#N)CCCN[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1 775527112 OFDKNMVGGTYMRZ-OAQYLSRUSA-N 395.547 5.325 30 20 GKED C[C@@H](Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cncc(F)c1 777691996 IOWNUVQSENYXNS-SECBINFHSA-N 382.279 5.354 30 20 GKED CC(=NNc1ncncc1Cl)c1sc(-c2ccc(Cl)cc2)nc1C 780275980 WWWCLAPTJWAPMP-UHFFFAOYSA-N 378.288 5.051 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)c1C 780585118 WPNCGCXFUWYJNR-INIZCTEOSA-N 395.503 5.635 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cnc(-c4ccco4)s3)c2)s1 785476668 ZBKUSZTXAOZFOF-UHFFFAOYSA-N 377.494 5.293 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 785767792 IXIUIZFMNHTOHA-LJQANCHMSA-N 392.908 5.127 30 20 GKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1cc(Br)ccc1F 789144283 UVHXNUNTWWANKN-XQRVVYSFSA-N 378.222 5.201 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 789423919 WGFQQJVVKNJNOO-KSSFIOAISA-N 396.487 5.594 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccnc(F)c1 794720617 GVPYGQBUJCULLS-WTKPLQERSA-N 380.806 5.023 30 20 GKED N#CC[C@@H](CC(=O)O[C@@H](c1cccc(Cl)c1)C(F)(F)F)c1ccccc1 796694201 VITJBSWIOJRIJY-KSSFIOAISA-N 381.781 5.574 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3cnn(C4CCCC4)c3)cs2)c1 799895415 GPVSXSDTMMUOJA-KTKRTIGZSA-N 379.485 5.026 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1c2c(nc3ccccc13)CCCCC2 801690068 VVVBFGIIPBTXIL-MRXNPFEDSA-N 385.467 5.047 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)C(=O)Nc3ccc(Cl)cc3)c2c1 805854141 RCWRELZJIBZPEF-KRWDZBQOSA-N 380.831 5.171 30 20 GKED COc1cccc(CC2(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)CCCCC2)c1 805929333 AQBIHFRPXXQFJE-FQEVSTJZSA-N 399.494 5.008 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790595 IOJBNLUSQWVSFB-CBAPKCEASA-N 380.313 5.080 30 20 GKED CCOc1cc(/C=C\C(=O)c2sccc2Br)cc(Cl)c1O 915112571 FBAVATLSLBJLQS-ARJAWSKDSA-N 387.682 5.164 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 915180226 MAHVVCJLNCOLLE-GOSISDBHSA-N 391.814 5.156 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2oc3c(ccc4ccccc43)c2C)cc1 916909446 JQLGXTPGINDTJK-OAQYLSRUSA-N 396.446 5.418 30 20 GKED C=CCn1c(-c2ccc(Cl)cc2)nn(CN2CC[C@H]2c2ccccc2)c1=S 917446326 MQQCBNWYFIZBHE-IBGZPJMESA-N 396.947 5.325 30 20 GKED Cc1c(NN=C2CCC(O)(c3ccc(C(C)C)cc3)CC2)cccc1C(=O)O 1776087685 QKLJKJHWFLUFAZ-UHFFFAOYSA-N 380.488 5.046 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)c(F)c1 1776128388 YVUMEARESZBPAJ-PQMHYQBVSA-N 376.383 5.096 30 20 GKED COc1ccc(C(=O)/C=C/c2cc(C)n(C3CCCCC3)c2C)cc1CC(=O)O 1776131871 QSOGORNSFXAJEF-PKNBQFBNSA-N 395.499 5.142 30 20 GKED COc1ccccc1-n1c(-c2ccccc2)cnc1SC[C@H](C#N)CCC#N 7043393 AFNYVHORXPOWBU-KRWDZBQOSA-N 388.496 5.084 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3cccc(C#N)c3)o2)cc1 26457201 HMCOKJQTXMJEJL-UHFFFAOYSA-N 379.419 5.441 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)c1 32799019 FGPLCRJNIHVXOB-PKNBQFBNSA-N 388.448 5.411 30 20 GKED Cc1nc(NC(=O)c2sc3cc(F)ccc3c2Cl)sc1SCC#N 44789558 UDLHWUCJZKFVPC-UHFFFAOYSA-N 397.909 5.327 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 56800327 AKVXVRBCJUFBOC-UHFFFAOYSA-N 396.450 5.195 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1csc(-c2ccccc2)n1 108237721 ZRYOFJRARGTKGY-HNNXBMFYSA-N 393.537 5.243 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 116593221 XAUKESHGPCRIHK-SOUVJXGZSA-N 380.419 5.068 30 20 GKED N#Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1Cl 123869920 LWDIWRBEKUHRDE-HNNXBMFYSA-N 398.274 5.479 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCC3)ccc1NC(=O)CC(C)C 172678572 TVYBRZWPUNRDEK-UHFFFAOYSA-N 395.528 5.044 30 20 GKED Cc1csc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)n1 173123251 OJXIOVSBAUMLPC-GUYCJALGSA-N 386.546 5.119 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@@H](C)c1ccc(OCC#N)cc1 180538082 LDNMNPYNSYMLFR-JKSUJKDBSA-N 377.513 5.433 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C[C@H]1C 296857944 ZDIJRSIKNZFLPM-MCIONIFRSA-N 385.455 5.133 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 303450267 JJMORSNUIGCSGR-ZWKOTPCHSA-N 377.381 5.163 30 20 GKED CC(C)[C@H](Oc1ccccc1C#N)C(=O)Nc1ccc(COC2CCCC2)cc1 303828677 QMZOECQSLKCVFU-QHCPKHFHSA-N 392.499 5.060 30 20 GKED CC(C)(C)/C(O)=N/Cc1ccc(Cl)c(/C(O)=N/[C@@H]2CCOC3(CCC3)C2)c1 328793003 ANNPQPXTPNHQPV-OAHLLOKOSA-N 392.927 5.249 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/CC1(c2ccc(Cl)cc2)CC1 328884645 YREYJDAMFBLMFW-AWEZNQCLSA-N 390.936 5.035 30 20 GKED O/C(=N/[C@@H]1CCCSC1)C12CCC(/C(O)=N\[C@@H]3CCCSC3)(CC1)CC2 329320956 RLCLQCMLQYBROP-JZFKGDSASA-N 396.622 5.031 30 20 GKED N#Cc1c(NC(=O)CCc2cccc(OC3CCCC3)c2)sc2c1CCC2 409734580 QQLNJFSVRZTQQN-UHFFFAOYSA-N 380.513 5.001 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1 409836702 OMBBBTPQAOFSEW-ZWKOTPCHSA-N 389.282 5.418 30 20 GKED CCN(C(=O)c1cscc1C#N)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 410472988 IPZUAWMLXJINOC-JOCHJYFZSA-N 389.524 5.390 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@H]3C)s1 410992444 WZSILTJYORCTOK-IJLUTSLNSA-N 389.546 5.112 30 20 GKED CO[C@H](c1ccc(F)cc1)c1noc(-c2sc3ccc(C#N)cc3c2C)n1 426418735 XUTONQADLYPBAG-QGZVFWFLSA-N 379.416 5.006 30 20 GKED Cc1ccnc2[nH]c([C@H](C#N)C(=O)c3ccc(SCc4ccccc4)cc3)nc12 429572413 UJAHJFRJPDQKHG-LJQANCHMSA-N 398.491 5.049 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)c1 429941685 ZGBQOMFXBCARJQ-UHFFFAOYSA-N 392.455 5.273 30 20 GKED CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(C#N)cc2Cl)c1 430371929 QVSMRJIKQTWLPK-UHFFFAOYSA-N 390.270 5.102 30 20 GKED CC(C)c1noc(-c2ccccc2C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)n1 430594497 GJDSRQBJWHHLPJ-HNNXBMFYSA-N 394.500 5.104 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCCOc2c(Cl)cccc21)c1ccccc1 431468170 CXRYZKZHRYRMBU-UXHICEINSA-N 397.906 5.288 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OCC(F)(F)F)cc1)c1ccccc1 432692221 HBHWMULGNQGEIY-GOSISDBHSA-N 391.393 5.184 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 433134511 LBPYZNIQKPSHHL-IEBWSBKVSA-N 392.528 5.495 30 20 GKED Cc1ccnc(-c2cccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2)n1 433144311 LUGGLPPXORSMDQ-OAQYLSRUSA-N 385.471 5.009 30 20 GKED CC(C)n1nc(-c2ccco2)cc1NC(=O)Nc1cccc(OCCCC#N)c1 433920352 FEQQIAHOLOEXID-UHFFFAOYSA-N 393.447 5.051 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 434287431 KBWGZOXYFSTCCP-QGZVFWFLSA-N 382.529 5.149 30 20 GKED C[C@H](SCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 437277595 QURMNNGQYQBJRT-NSHDSACASA-N 390.295 5.909 30 20 GKED CC(C)C1CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 437743542 IATHJCZRAOENPN-UHFFFAOYSA-N 391.515 5.232 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 440999340 OMYRIHZMBSOERD-BUNACBEFSA-N 399.897 5.198 30 20 GKED CSc1ccccc1[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 442861754 UVNMOBLWRVYACD-INIZCTEOSA-N 379.529 5.165 30 20 GKED CC[C@@H](Nc1ccc(Cc2nnc3n2CCCCC3)cc1)c1ccc(C#N)cc1 447592814 NVYFJDRZNSRARW-JOCHJYFZSA-N 385.515 5.030 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3noc(C)n3)n2)o1 450839227 QUDSULRXBYBVSH-SECBINFHSA-N 394.378 5.085 30 20 GKED COc1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)ccc1OC(C)C 455165331 UJIPAWDWOCIDFL-LJQANCHMSA-N 381.476 5.039 30 20 GKED CCSCc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 455869341 WROBZGKSVFEFPS-UHFFFAOYSA-N 377.513 5.133 30 20 GKED C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1ccccc1Oc1ccccc1C#N 456116599 JBDFUJYQZFZLNT-HOCLYGCPSA-N 388.389 5.154 30 20 GKED CN(C)c1cccc([C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458796398 DXRNUZLELYJPGG-DHIUTWEWSA-N 390.531 5.034 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C 466121537 IAUPWAGZUKWMRR-KNXBSLHKSA-N 393.918 5.307 30 20 GKED N#C[C@@H](C(=O)c1cccc2ccsc12)c1nc(-c2c(F)cccc2F)cs1 467838963 MJFHGPFUANDMFO-ZDUSSCGKSA-N 396.443 5.793 30 20 GKED CCCCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)C1CC1 480411651 WPBZHKASKMXNJX-UHFFFAOYSA-N 379.460 5.156 30 20 GKED CC(C)c1c(NC(=O)CCc2ccc(C#N)cc2)cnn1-c1ccc(Cl)cc1 482742430 SPKYOZNWJKBSRO-UHFFFAOYSA-N 392.890 5.092 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 483000274 ZTCSUDRLBYRWDP-RXVVDRJESA-N 393.487 5.066 30 20 GKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)c2c(F)cc(C#N)cc2F)c1 484683330 VTMZEBDIUVTPQY-UHFFFAOYSA-N 382.797 5.718 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)c1ccccc1Sc1ccccc1C#N 494723573 PCMNWYOKWANZDH-UHFFFAOYSA-N 394.446 5.260 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1Cl 503530219 BYYRQIBWWHNOPS-LBPRGKRZSA-N 388.826 5.540 30 20 GKED C[C@@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(F)cc1C(F)(F)F 504891654 KVWGEVDKQVSFOR-JTQLQIEISA-N 393.302 5.224 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OCc3cccnc3)c(Cl)c2)c1 505314142 LFTQCKGODAEHNF-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CCOc1ccc(-c2nc(NC(=O)c3cc(C#N)ccc3Cl)sc2C)cc1 506031375 PUFLOADMOQUEGM-UHFFFAOYSA-N 397.887 5.295 30 20 GKED COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)c1cccc(CC#N)c1 509130426 WYFQQZGRZCINTL-FQEVSTJZSA-N 398.506 5.035 30 20 GKED CCCN(CC#N)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 510790280 GRGKWXUOOVSDBA-UHFFFAOYSA-N 393.339 5.661 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)cc2)ccn1 514636368 AYKIUZLSCRJTTL-VQTJNVASSA-N 389.842 5.141 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 517351657 VPKWUKGXSCVGAS-LIRRHRJNSA-N 390.911 5.321 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 517641005 DBTUJPFOWMLBJQ-NRFANRHFSA-N 388.854 5.450 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ncoc1-c1ccccc1Cl 522046866 JQFJABSZEPHJPS-UHFFFAOYSA-N 393.874 5.165 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)c[nH]3)cc2Cl)c1 524405828 LIDGJQXIGOQHCM-UHFFFAOYSA-N 386.238 5.024 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H](C)CC1 524441001 MTLUAASJSVAAQP-KRWDZBQOSA-N 377.488 5.100 30 20 GKED C=CCCCC(=O)Nc1ccc(N(C)C(=O)CCCC=C)c(Br)c1 534372041 FGRXNITZOHZXBU-UHFFFAOYSA-N 393.325 5.063 30 20 GKED C=CCC[C@H](NCc1noc(-c2ccsc2)n1)c1ccc(C(F)(F)F)cc1 540433587 WMRAJKKOWZVMCA-INIZCTEOSA-N 393.434 5.614 30 20 GKED N#CC1(CSc2nnc(-c3ccccc3Cl)n2-c2ccccc2F)CC1 540857626 AJSMLKKQFRGTPI-UHFFFAOYSA-N 384.867 5.123 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1F 542960110 NCRWZKVATMAYBU-SFHVURJKSA-N 387.430 5.309 30 20 GKED N#Cc1cccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)c1F 543160673 ORAMMSJLDOMBKO-OAQYLSRUSA-N 395.275 5.339 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)c(F)c1 551211714 KPVHNICACNQJBY-KUHUBIRLSA-N 375.285 5.674 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3c(Cl)cncc3Cl)cc2)c1 559534882 ONASQYZZRYENNN-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 569844241 OIDAXAJFKYJYGL-UHFFFAOYSA-N 391.446 5.207 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)cc2)ccn1 573495203 NBOMHSFHNYLUPH-IAGOWNOFSA-N 395.871 5.203 30 20 GKED CS[C@H](CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)C(C)(C)C 583717713 CVCMZBRCIRMBSA-HXUWFJFHSA-N 398.597 5.358 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 588162121 PBEFRWKNQNJKPI-UHFFFAOYSA-N 394.862 5.488 30 20 GKED C[C@@H](CSc1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 593159019 HHFHVFJGAQPNRC-SJORKVTESA-N 399.585 5.583 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(Cl)cc1Cl 602696745 BOZIBWDQBYDAMY-UHFFFAOYSA-N 399.302 6.269 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)Nc1sc(-c2ccccc2)cc1C#N 603969063 YPAXLOPXFUKXQG-OAHLLOKOSA-N 378.522 5.547 30 20 GKED CC(C)(C)c1ccc([C@H](NC(=O)Nc2ccc(CC#N)cc2)C(F)(F)F)cc1 604290951 VFEMSFPJQYXDFJ-SFHVURJKSA-N 389.421 5.475 30 20 GKED CCCOc1ccc(Oc2ncccc2CNc2ncc(C#N)cc2Cl)cc1 608886107 WHRFNPBFMXHWJE-UHFFFAOYSA-N 394.862 5.195 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@H]3CCCc4ccccc43)cc2)c1 609064921 OWEYZWVWWLHCGW-DEOSSOPVSA-N 382.463 5.196 30 20 GKED N#Cc1ccc(CNCc2ccc(-c3ccc(Br)cc3)o2)c(F)c1 609239850 HEJSPGAOCUJPPQ-UHFFFAOYSA-N 385.236 5.010 30 20 GKED Cc1nc(-c2ccc(CCNc3nc(C(F)(F)F)ccc3C#N)cc2)cs1 609668971 IJJNMPHGMLDMGI-UHFFFAOYSA-N 388.418 5.059 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(c4cccnc4)CC3)cc2)c1 611261380 WVGQXXUPTKYHLP-UHFFFAOYSA-N 398.466 5.157 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ccc(OC)cc1)C(C)C 612200010 JJCFMDZDEYRUNR-LJQANCHMSA-N 392.952 5.505 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)C2)cc1 612298981 MEMOIAQVRBFZHB-FQEVSTJZSA-N 398.466 5.075 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nc2ccccc2c1=O 643092138 RFJHYWYTXYIBOI-UHFFFAOYSA-N 393.899 5.076 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)sc2c1 643779761 OQJPTGGKEJDBGN-LBPRGKRZSA-N 394.805 5.767 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccco2)Cc2cccs2)cc1Cl 726440004 PGWOJBLRJICZIJ-UHFFFAOYSA-N 387.917 5.265 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccccc2F)cc1 726858703 SRBQGYHWEUDZDM-RZQQEMMASA-N 380.463 5.180 30 20 GKED CC(=NNc1cccc2ccccc12)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 727257413 MFYQGCKUCKSQDA-UHFFFAOYSA-N 378.388 5.109 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 730215400 FCPNRGMIMZEJGP-UHFFFAOYSA-N 378.444 5.028 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1 730532114 BBEQJXGHCAGQBS-UHFFFAOYSA-N 397.450 5.042 30 20 GKED CC(C)[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 740531433 UBTZXENPQSFRES-IRXDYDNUSA-N 382.916 5.641 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(N(C)CCC#N)cc2)cc1 742376516 VVVUCODJSVOHBY-FQEVSTJZSA-N 399.538 5.563 30 20 GKED COCc1cccc(/C=C/C(=O)c2sc(-c3ccc(OC)cc3)nc2C)c1 742435392 WXCOFOMRBSQLRI-KPKJPENVSA-N 379.481 5.170 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1ccc2c(c1)COC2 742437041 QHVCJYKKUMVZDL-KTKRTIGZSA-N 378.859 5.069 30 20 GKED CC(C)(C)c1nc(C#N)c(NN=Cc2c(OC(F)F)ccc3ccccc23)o1 746497731 KKMDOUQIEDRDOH-UHFFFAOYSA-N 384.386 5.044 30 20 GKED Cn1cc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)c(-c2ccncc2)n1 750917627 VTXHAPZZUWHAMX-GDNBJRDFSA-N 397.450 5.009 30 20 GKED CC(C)C[C@H](C)N(C(=O)c1ccc(C#N)c(Cl)n1)c1ccc2[nH]ccc2c1 753012662 DWHYFMZJVOXVLE-AWEZNQCLSA-N 380.879 5.169 30 20 GKED N#C[C@H](C(=O)CC(Cc1ccccc1)Cc1ccccc1)c1nc2ccccc2o1 753400883 XFQKWOMLSUDAJG-JOCHJYFZSA-N 394.474 5.496 30 20 GKED CC(C)(Cc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 753807702 VEOQTZGDXGNGDG-HNNXBMFYSA-N 386.879 5.534 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(C(F)(F)F)nn2)cc1 754710991 QDQYQEFXNKYXML-UHFFFAOYSA-N 386.377 5.007 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1 764755024 LQNFDPAHDXJVFJ-IAGOWNOFSA-N 398.934 5.578 30 20 GKED COc1cc(C=NNCc2cnc3ccccc3c2)c(-c2ccccc2)cc1OC 764787361 CDVCHNVXRLHQNY-UHFFFAOYSA-N 397.478 5.043 30 20 GKED C=CC[C@@H](N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccncc1 766018753 ITIUCAKKYSXGQU-UXHICEINSA-N 391.540 5.498 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=S)Nc1ccc(C#N)c(Cl)c1 766547135 CHGFPKWUTRBYGG-MRXNPFEDSA-N 397.853 5.500 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)cc1 768969041 JCPBPYBYHLAYGY-VPBXCIAMSA-N 393.490 5.049 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CC=C(c3ccc(Cl)nc3)CC2)c1 774039447 SCNICPQHCBMIES-UHFFFAOYSA-N 383.879 5.011 30 20 GKED N#CCc1ccccc1CC(=O)Nc1cccc(Oc2ccnc3ccccc23)c1 776927494 DFCXDIILROQBAS-UHFFFAOYSA-N 393.446 5.274 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784402882 OUTKNYKYVIUYQR-GJZGRUSLSA-N 382.847 5.354 30 20 GKED CC(C)(C)n1cc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)nn1 790219152 HFPWCTFSMNPBBT-RAXLEYEMSA-N 398.919 5.023 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@H](C(F)(F)F)C3)n2)cc1 796800975 XMPRTMROYIGHAM-QLFBSQMISA-N 378.419 5.273 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc1Cl 797567980 NBPJRIASCAFUPI-JSGCOSHPSA-N 376.909 5.046 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)/C=C/c2ccccc2C#N)c1 798651362 BZMJWNVUKAYDQB-PKNBQFBNSA-N 387.870 5.162 30 20 GKED COCc1nc(Cl)cc(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)n1 814977840 DTTGSBAAOPOCNC-CYBMUJFWSA-N 398.816 5.031 30 20 GKED CCOc1cc(/C=C2/CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1O 818242823 LZNXAXUCZKLRIN-MICXRRPDSA-N 399.830 5.182 30 20 GKED Cc1ccc([C@H](C)c2noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)cc1 848607169 SLTAVWQNXOCKQF-WMZOPIPTSA-N 398.507 5.180 30 20 GKED O=C(O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ocnc1C(F)F 860578080 UNHQVXUKILUBCJ-SNVBAGLBSA-N 389.198 5.091 30 20 GKED N#C[C@@H](C(=O)CCCC1CCCCC1)C(=O)Nc1ccc(SC(F)F)cc1 916885756 BBLDIRCHSNCZLO-KRWDZBQOSA-N 394.487 5.399 30 20 GKED CCCCCCCCCC(=O)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1 919832664 JDSHTVHKXAHVSZ-UHFFFAOYSA-N 392.971 5.155 30 20 GKED Cc1cccc(OCCCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 920112670 GJNOOXFFLYAQSD-KRWDZBQOSA-N 398.915 5.684 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2ccc(F)c(Cl)c2)cc1 924806700 DSECXNGECVCWOR-CQSZACIVSA-N 376.884 5.215 30 20 GKED O=C(O)Cc1ccc(NN=C2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 1776084540 XVDXBBCBTZTMSK-SFHVURJKSA-N 390.405 5.458 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2cc(C(=O)O)cs2)cc1)c1ccccc1 1776469460 YLSZMIMXIUWMPD-AYJWMTRPSA-N 378.449 5.482 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776697206 AHKYRSHICXPASI-LMRWQKIVSA-N 390.435 5.760 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](CCC(=O)O)C(F)(F)F)cc1 1776786317 PJIPFFDEHHINOS-KRWDZBQOSA-N 389.458 5.169 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@H](C(=O)O)CC23CC3)cc1 1776787505 HVSNSVREQJLZEX-SFHVURJKSA-N 389.561 5.219 30 20 GKED Cc1ccccc1C(=O)/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)o1)c1ncc[nH]1 1777465220 WXXHJJWGZXBACY-XSFVSMFZSA-N 398.418 5.100 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)oc2ccc(F)cc12 20676047 VRAYGPJZQJOKLV-UHFFFAOYSA-N 377.400 5.128 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 47956795 WFBMLSKSFKYYSI-KRWDZBQOSA-N 398.466 5.002 30 20 GKED Cc1c(NC(=O)c2ccccc2Sc2ccccc2C#N)cccc1[N+](=O)[O-] 60519202 OOSHHEXHMHEZBW-UHFFFAOYSA-N 389.436 5.178 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)cc(Br)c1 66800163 HLTLADMMXRNMCX-LLVKDONJSA-N 393.281 5.235 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc(C(C)(C)C)s3)n2)cc1 67893543 XQAAEGFWUQQRFG-AWEZNQCLSA-N 381.526 5.363 30 20 GKED CC[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1nc(C)cs1 78514985 VTVJECLGROOXFI-KRWDZBQOSA-N 393.537 5.356 30 20 GKED N#C[C@H](C(=O)c1scnc1C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 127894824 QQNOQHNFMQRJSM-CYBMUJFWSA-N 385.901 5.287 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)N[C@@H](CCC#N)c2ccccc2)s1 151440268 QJNRUTRXNFLGOG-NRFANRHFSA-N 393.512 5.406 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 153995957 XRKGIKHMECFBGD-QZTJIDSGSA-N 381.545 5.484 30 20 GKED Cc1coc(-c2cc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)ccc2C)n1 154155708 KLWWRBUSIOPADP-UHFFFAOYSA-N 388.471 5.273 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(NC(C)=O)ccc1Cl 157504990 RALTVAGCYLQVFN-UHFFFAOYSA-N 398.315 5.233 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1cc(F)ccc1F 170992196 WIYNLBDIJUOOPB-ZDUSSCGKSA-N 392.496 5.088 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3ccccc3F)C3CCCCC3)o2)cc1 173666203 ZVVUGONTFYIOFH-UHFFFAOYSA-N 390.462 5.082 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Cc2ccc(C(F)(F)F)cc2)n1 177761379 VCFUOVUJQMSGMH-WFASDCNBSA-N 380.435 5.340 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)c1cccs1 180033598 ADBHHWAPQXCAMC-LPHOPBHVSA-N 391.496 5.144 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1cc2ccccc2o1 182627541 ZRVCBTRYQHLNCM-JKSUJKDBSA-N 393.512 5.116 30 20 GKED N#C[C@H](C(=O)c1scnc1C1CCCC1)c1nc2cc(Cl)ccc2s1 185257622 LGDQBIKIZWRPCR-GFCCVEGCSA-N 387.917 5.554 30 20 GKED C=C(C)[C@H](NCc1coc(-c2c(F)cccc2F)n1)c1ccc(F)c(F)c1 187779436 LGVVWWWSKYGJPE-IBGZPJMESA-N 376.353 5.305 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(OC)c(Br)s1 189902200 BVAAOYHLYBAWQT-UHFFFAOYSA-N 394.334 5.623 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1c2ccccc2CCN1C(C)=O 189904139 QADJKLCMJPXXFW-QHCPKHFHSA-N 390.527 5.013 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccccc2OCc2ccccc2)cc1 208251815 DNMPYDCRKMCXBV-XCTGESOMSA-N 383.447 5.453 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(CN3CCCCCC3)cc2)c1 237823971 IKUSMUHNTQLELQ-UHFFFAOYSA-N 391.559 5.035 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 303352480 YOWPJYSWJVRYAU-UHFFFAOYSA-N 398.434 5.160 30 20 GKED C[C@@H](SC1CCOCC1)C(O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328764543 GGXMSMSEJYNPCD-CQSZACIVSA-N 377.506 5.007 30 20 GKED CC(C)(C)N(CCCC1(C#N)CCOCC1)Cc1ccccc1Br 410413111 HVIJUXJPSNEXIJ-UHFFFAOYSA-N 393.369 5.150 30 20 GKED CCCN(Cc1ccc(C#N)cc1)[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 411170338 WTCPXZQURZEUPB-HNNXBMFYSA-N 380.879 5.235 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cn1 429442311 BDQJRSKWDZSEKR-OAHLLOKOSA-N 387.443 5.162 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(F)c(C(F)(F)F)c1)c1ccccc1 432770483 GXHGIEJKNBVOLS-KRWDZBQOSA-N 379.357 5.401 30 20 GKED N#CCCC[C@H](NCc1ccc(OCc2ccccc2F)nc1)c1ccccc1 433018163 FMZPVXNPWXWHBT-QHCPKHFHSA-N 389.474 5.324 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3ccccc3C2)cc1F 438660896 OFLZCCNVMRUXSA-UHFFFAOYSA-N 387.414 5.080 30 20 GKED N#Cc1ccc(CSCc2cccc(C(=O)N3CCCCC3)c2)c(Cl)c1 438876904 NXSAWTOIQJFMJF-UHFFFAOYSA-N 384.932 5.271 30 20 GKED COCc1ccc([C@@H]2CCCN2c2c(C#N)cnc3ccc(C(C)C)cc23)o1 447678433 ZUMPGWOOSODHLX-NRFANRHFSA-N 375.472 5.311 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 448511623 HWSIARLUMYWYDU-UHFFFAOYSA-N 394.833 5.898 30 20 GKED Cc1cccc([C@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)C(F)(F)F)c1 455175329 FPERHFIUMHDMHQ-MOPGFXCFSA-N 389.421 5.333 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2ccccc2)c1)c1cc(C(F)(F)F)ccn1 464412919 UTDYVKWZQWLECV-GOSISDBHSA-N 382.341 5.383 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 466227628 SASCVOTXNVVQCH-HNNXBMFYSA-N 377.315 5.520 30 20 GKED COc1ccccc1-c1nnc(S[C@H](C)CCC#N)n1-c1ccc(Cl)cc1 470444340 FHPPYJUHLCZASK-CQSZACIVSA-N 398.919 5.381 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C 472750521 JSZTUMRWKQOKEO-QWFCFKBJSA-N 393.556 5.423 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cn(CCCCC)nc1C 475547502 NYAMDAOXZAPUNK-UHFFFAOYSA-N 382.552 5.555 30 20 GKED CC(C)c1ccc2c(c1)[C@H](NCc1cn(C)nc1-c1ccc(C#N)cc1)CCC2 478272136 FSTMZHNBWULCBT-XMMPIXPASA-N 384.527 5.249 30 20 GKED CCC(CC)[C@H]1C[C@@H](NC(=O)c2ccccc2Oc2ccccc2C#N)CCO1 479790739 UAMRSYGIMXWSTD-WMZHIEFXSA-N 392.499 5.064 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1 480517627 XFPHXYDIMSEEQX-GOTSBHOMSA-N 390.527 5.157 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccc(F)c(F)c1 480929030 PUSWZOUQCFLWKX-ORAYPTAESA-N 388.462 5.449 30 20 GKED C=CCCO[C@H](C)C(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 481063087 VAICXOZTXPLYCU-VGOFRKELSA-N 394.540 5.215 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1ccc(C(F)(F)F)cc1 481265762 BTUNAHRRBQADOL-LLVKDONJSA-N 383.211 5.190 30 20 GKED Cc1ccc([C@H](Cn2ccnc2)N[C@@H]2CCCCc3cc(C#N)ccc32)c(C)c1 481649416 FAILGIFDLYHHPY-RPBOFIJWSA-N 384.527 5.170 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(NC(=O)c2cccs2)cc1 482911578 RDZUKNRFWABQLN-UHFFFAOYSA-N 382.529 5.209 30 20 GKED CC(C)(C#N)c1ccccc1CSc1n[nH]c(COc2ccc(Cl)cc2)n1 488174407 HPDNOBDTTYRGCD-UHFFFAOYSA-N 398.919 5.131 30 20 GKED C=CC[C@H](C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 488619796 ANGKYPGZGKSGEC-DVECYGJZSA-N 398.506 5.476 30 20 GKED Cc1cccc(C)c1OC[C@H](NCCCC1(C#N)CCOCC1)c1ccccc1 499605773 LAPJSXOXAIYDMZ-QHCPKHFHSA-N 392.543 5.114 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Oc2ccc(F)c(Cl)c2)c2ccccc2)cc1 499743392 ZVFAORJPBGJTEI-OAQYLSRUSA-N 394.833 5.304 30 20 GKED COCCOc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 503220297 AWUPCISWEQDYFR-INIZCTEOSA-N 399.516 5.059 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 503352766 DZJXOEUCJJXTJY-PKTZIBPZSA-N 386.451 5.066 30 20 GKED C=C(C)CCc1noc(CCc2ncc(-c3ccc(Cl)cc3Cl)o2)n1 508636013 JZZKEXLAWGUUJZ-UHFFFAOYSA-N 378.259 5.325 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1 509564213 PIOKJPSYCHVFRT-SFTDATJTSA-N 386.948 5.217 30 20 GKED N#CCc1ccc(NC(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1 514504634 VTXAUGAHHCLRJB-QFIPXVFZSA-N 394.478 5.188 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)cc2c1 514726827 JAOAWMQDHPHMOT-UHFFFAOYSA-N 384.464 5.099 30 20 GKED CCc1ccc(CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1 518165725 QGNCJMGORRCDBC-KRWDZBQOSA-N 393.556 5.697 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1 518710267 UWXDVZOFBAMDOC-XHDPSFHLSA-N 397.689 5.104 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 520199092 RXBNEEZCARNZDG-MRXNPFEDSA-N 385.508 5.662 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)Cc1csc(-c2ccc(Cl)cc2)n1 520809920 XYIWUBACASLESA-UHFFFAOYSA-N 398.919 5.073 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3nccc4ccccc34)c2)cc1 522141882 UUPRZLLCLFNGNF-UHFFFAOYSA-N 393.446 5.132 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2cc(Cl)cc(Cl)c2)c1 522483603 WRCCCSWNTJZKIF-UHFFFAOYSA-N 387.222 5.289 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 524502655 VFLQHKJLJDAZDL-UHFFFAOYSA-N 384.479 5.821 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1ccc2c(c1)OCCO2 530507630 MQEJSOYKJVKJPC-UHFFFAOYSA-N 383.513 5.041 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C1CC1 534967369 OFSWBSIVQDQQGT-LSDHHAIUSA-N 397.548 5.627 30 20 GKED COc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)c(Cl)c1OC 536888726 DBCUEAXXGXDCSU-UHFFFAOYSA-N 392.886 5.186 30 20 GKED Cc1nc(-c2cc([C@@H](C)Nc3cccc(OCCCC#N)c3)cs2)cs1 538526510 LIDGOBCQOJVFIA-CQSZACIVSA-N 383.542 6.036 30 20 GKED COc1ccc(N(Cc2cccs2)C(=O)[C@H](C#N)CCc2ccccc2)cc1 538834842 XYJGQBJHBLXMBL-IBGZPJMESA-N 390.508 5.062 30 20 GKED CCCN(C(=O)c1ccc(C#N)s1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 539657616 QFNYFTXTWPSJHB-OAQYLSRUSA-N 393.487 5.104 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N1CCC(CC#N)CC1 541972834 WAYLKDDLGNFQOK-UHFFFAOYSA-N 395.528 5.145 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)N(CCC#N)c2ccc(F)cc2)cc1 554286198 BIQBWYPEQQLMIO-UHFFFAOYSA-N 380.463 5.078 30 20 GKED COC(=O)c1csc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 560548795 BUAKOVLLPHBHSH-HOTGVXAUSA-N 390.508 5.485 30 20 GKED Cc1sc(C2(N[C@H](C)c3ccc(C#N)cc3)CCC2)nc1-c1ccccc1F 583091711 IPEOXRQJKMOVBP-OAHLLOKOSA-N 391.515 5.859 30 20 GKED C[C@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1F 588360846 FIUVAGJDGHGVPU-NDBYEHHHSA-N 399.350 5.345 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nccc2ccccc12 589343923 ICGPMQUWYJRLNQ-MOPGFXCFSA-N 377.491 6.185 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1 596733085 BOVMVIUOHOQBEO-OXJNMPFZSA-N 395.528 5.681 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1 603638049 HOUGVXQOWSQKDS-KRWDZBQOSA-N 388.442 5.110 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cncc3ccccc23)cc1 604004521 CBPVGARWTQSKAL-UHFFFAOYSA-N 393.446 5.132 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 608785017 PRFNVYXUYOWQSB-UHFFFAOYSA-N 392.484 5.250 30 20 GKED CC(C)(C)[C@@H](NC(=O)CCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608899139 QIVCLAQFBZBXEV-FQEVSTJZSA-N 388.433 5.413 30 20 GKED C=CCN(C(=O)C[C@@H](C)CC(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 609009591 FVBRSXCEMMONQK-HNNXBMFYSA-N 387.505 5.310 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1c[nH]c2cc(Cl)ccc12 609020507 OOGCMEPNVSOUSC-UHFFFAOYSA-N 389.842 5.062 30 20 GKED C[C@@H]1Cc2ccccc2N1Cc1occc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 609316890 UOQHTAHHZOFURY-QGZVFWFLSA-N 399.494 5.284 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccsc1 609968255 RMWVYVYPSXMWIF-IFXJQAMLSA-N 380.900 5.799 30 20 GKED CN(C(=O)CSc1ccc(C#N)cc1F)C(c1ccccc1)c1ccccc1 610165754 MISUSRIYJCRJPM-UHFFFAOYSA-N 390.483 5.037 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 610358009 XGSQFIGIYRXXNC-UONOGXRCSA-N 375.394 5.041 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](C)c1cccc(C#N)c1 610406497 BXRWMLBRNAATHS-CQSZACIVSA-N 390.314 5.546 30 20 GKED C[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1cccc(C#N)c1 619670729 ANRUDVANKGYERU-GFCCVEGCSA-N 384.266 5.351 30 20 GKED O=C(c1cc(C(F)(F)F)ccc1F)N1CC(c2cccc(C(F)(F)F)c2)C1 622661392 DBXPOFRLIXQNCD-UHFFFAOYSA-N 391.286 5.103 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622847630 APSRBOFZRGEEHW-CABZTGNLSA-N 389.286 5.144 30 20 GKED O=C(CC1CCC(F)(F)CC1)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 623982673 CZSRZOJAISGHHV-QWRGUYRKSA-N 395.334 5.228 30 20 GKED CC(C)C1CN(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)C1 646439002 GNGFLEDBEXOVOV-UHFFFAOYSA-N 386.311 5.096 30 20 GKED CCc1[nH]ccc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 653036008 PGWWOIHVCYFFQE-UHFFFAOYSA-N 382.279 5.119 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 680523737 XRCUUNOCGBSCMJ-CQSZACIVSA-N 393.247 5.050 30 20 GKED FC(F)(F)c1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 683352454 CZFSPPORVYUVQR-HTQZYQBOSA-N 385.295 5.330 30 20 GKED COc1ccc(NC(=S)Nc2cccc(C#Cc3cccs3)c2)cc1F 726459229 LGCORKXTQZEQED-UHFFFAOYSA-N 382.485 5.105 30 20 GKED COc1cccc(COc2cccc(Cl)c2C=NNc2ccc(C)cn2)c1 727260090 QLEVSXVZGYHDBJ-UHFFFAOYSA-N 381.863 5.077 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)N[C@H]1CCCC[C@H]1C 727978215 CMWQWNJXHYIUFA-IERDGZPVSA-N 393.556 5.311 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccccc1OC(F)F 728695437 XEGGHRBJXJEKFC-MDZDMXLPSA-N 375.371 5.447 30 20 GKED CC/C(=C/C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 728811582 CMRWHVNSDOXHHT-SDXDJHTJSA-N 383.451 5.486 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1)c1ccncc1 734660758 AGQCNEDJLLBKRU-WMZHIEFXSA-N 385.511 5.219 30 20 GKED N#CCOc1ccc(Cl)cc1CN(Cc1cccs1)Cc1cccs1 735305998 GJUJHMAWZCRLCZ-UHFFFAOYSA-N 388.945 5.568 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 739144441 XSVCZYPBMLYDCR-RDTXWAMCSA-N 382.385 5.309 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3c[nH]c4ccc(C)cc34)n2)cc1 747109468 SQFYCRPVYMHPQB-FQEVSTJZSA-N 399.519 5.717 30 20 GKED CCn1cc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2ccccc21 748174744 FRMSCXDBAYDRCL-XMMPIXPASA-N 393.490 5.498 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ncc(-c3ccccc3)s2)ccc1OC 750027521 JFEZXWSHGRWNQB-QGZVFWFLSA-N 379.485 5.112 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C/SCc1ccco1 754223211 FTEJBBASJFNFDP-ZRDIBKRKSA-N 390.464 5.638 30 20 GKED CC(=NNc1ccc(C(F)(F)F)nn1)[C@@H](C)Oc1ccc(Cl)cc1Cl 754710416 YOQKQHNGCRCKQT-SECBINFHSA-N 393.196 5.058 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(F)c(Cl)c1 755518011 GGCKCJIFRNISSS-UHFFFAOYSA-N 397.862 5.108 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1cc(Cl)cs1 759432031 SFWQSKRVMIOGHT-HNNXBMFYSA-N 396.855 5.155 30 20 GKED N#C[C@@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1ccc2ccccc2n1 760962806 CEBZQTKKFNDSNY-LJQANCHMSA-N 387.870 5.500 30 20 GKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1cc(Br)ccc1F 761480155 OZPLFUJBYJZWFR-AATRIKPKSA-N 380.213 5.233 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N1CCO[C@H](c2cccc(C#N)c2)C1 761837940 DRKFBRMPSSNFQO-DEOSSOPVSA-N 397.478 5.139 30 20 GKED CCOCc1cc(/C=C/C(=O)c2cc(Br)ccc2F)ccc1OC 763120564 AHWNCQWOLSIYFW-XBXARRHUSA-N 393.252 5.029 30 20 GKED C[C@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1ccc(Cl)c(Cl)c1 764304688 CQTBNNTUSJUAIE-QMMMGPOBSA-N 398.633 5.169 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(F)c(SC)c2)cc1 766623446 QXZWXSWTELVXHU-GUYCJALGSA-N 384.476 5.022 30 20 GKED C[C@@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccc(OCC#N)cc1 776157405 AXXSQOUMCLNVQB-OSPHWJPCSA-N 392.449 5.502 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 789423920 WGFQQJVVKNJNOO-RDTXWAMCSA-N 396.487 5.594 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1OC(F)F 792102560 QFUIVYQQHARUFL-RXXLQFRUSA-N 378.378 5.116 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(Cl)cc2)CCCCC1)c1cnc2ccccc2n1 792111598 VXXQOIAXACBJPC-SFHVURJKSA-N 389.886 5.362 30 20 GKED COc1ccccc1-c1ncc(/C=C2/Cc3cc(Cl)cc(Cl)c3C2=O)cn1 792885617 HPGNFNWHCLMLFG-NSIKDUERSA-N 397.261 5.281 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2cc(Br)ccc21 794956964 LAYDNJMPXPWSDN-RMKNXTFCSA-N 388.208 5.137 30 20 GKED N#CC[C@@H](CC(=O)OCc1coc(-c2ccc(Cl)cc2)n1)c1ccccc1 795987794 WXLOOKGYIBFMJK-KRWDZBQOSA-N 380.831 5.126 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)nc1 809445686 GMICYCZMSCUWIY-INIZCTEOSA-N 378.501 5.262 30 20 GKED CSC(C)(C)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 857296381 ZQJWBWDLVYXUAY-UHFFFAOYSA-N 377.325 5.056 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2nc3ccccc3o2)cc1 915085590 CRFXFNDOBSEOEJ-HXUWFJFHSA-N 381.435 5.055 30 20 GKED CCc1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915352736 JYZPJIMJRSPWJG-XMMPIXPASA-N 383.495 5.568 30 20 GKED N#C[C@@H](C(=O)Cc1csc2ccccc12)c1nc2ccccc2n1C(F)F 917041225 RIBJOXVFUVTCKK-AWEZNQCLSA-N 381.407 5.065 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 917428178 ORRDCULJYAHLAE-DEQJRXDXSA-N 378.884 5.743 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 921034985 JIFGXEPLEZFKCO-UHFFFAOYSA-N 385.448 5.219 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(Oc2ccc(Cl)cc2)cc1 1776085604 YROBBJMQHRXDFO-UHFFFAOYSA-N 394.858 5.596 30 20 GKED O=C(O)C(=O)/C(=C\c1ccc(-c2ccsc2)cc1)c1ccc2ccccc2n1 1776117233 RITKFJNHLDCBFB-UYRXBGFRSA-N 385.444 5.158 30 20 GKED CC(/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O)=C\c1ccccc1OC(F)F 1776200111 UFLSWAFCVXOSAR-KQVSHLSWSA-N 384.378 5.073 30 20 GKED CCCCCCCOc1cccc(CN[C@](C)(COc2ccccc2)C(=O)O)c1 1776787871 AUACTQOMAMBHGR-XMMPIXPASA-N 399.531 5.048 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3ccoc3C)CCC2)cc1 1789453209 NXJLGLVFHZNHNO-HXUWFJFHSA-N 392.499 5.104 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1SCc1ccccc1C#N 7022231 JXFVLJXNMYNXLS-UHFFFAOYSA-N 392.528 5.067 30 20 GKED CCOc1ccccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 41549054 GOLZBISGJMSRJS-ZDUSSCGKSA-N 390.386 5.204 30 20 GKED C=CCOc1c(Br)cc(CNCc2ccc(C)cc2)cc1OCC 60816887 JGJUJKFZROXTBA-UHFFFAOYSA-N 390.321 5.011 30 20 GKED COc1ccc(SCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66801133 ILGBITBTHBDGDY-OAHLLOKOSA-N 386.542 5.210 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)CC1 66954925 ZHZXXWFCMJSJSV-ICSRJNTNSA-N 393.556 5.882 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](C)c1cccc(F)c1 115992021 AXWGXYRKUDTDLY-OAHLLOKOSA-N 389.430 5.325 30 20 GKED COc1ccc2c(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)coc2c1 120012629 JGYDIECKZYQJFF-HNNXBMFYSA-N 396.855 5.123 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)n1 125449809 WTKWWALXABWFGM-APWZRJJASA-N 380.517 5.153 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1ccc(F)cc1C(F)(F)F 150721935 HGMMWFKKQQFIDE-UHFFFAOYSA-N 379.275 5.592 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1c[nH]c2ccc(Cl)cc12 151865888 XFVIGRKYYVRELD-ZDUSSCGKSA-N 383.904 5.397 30 20 GKED N#CC1CCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1 162359947 NVARFMWUPMVHMV-UHFFFAOYSA-N 375.255 5.161 30 20 GKED CC(C)(C)O[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 179224547 KKVABRSKINJSGO-HNAYVOBHSA-N 397.425 5.164 30 20 GKED CC(C)Cc1ccc([C@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C2CC2)cc1 179793182 RGLNSYJSPPGYCQ-QHCPKHFHSA-N 386.499 5.048 30 20 GKED C=CCn1c(SCc2ncc(Cl)cc2Cl)nnc1-c1ccoc1C 183177787 BVVHRCOEVMOLBI-UHFFFAOYSA-N 381.288 5.027 30 20 GKED COCCC1(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCCCC1 187112416 AGJPKXUSHDDJBI-KRWDZBQOSA-N 389.565 5.047 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1nc(C(F)(F)F)cs1 191420042 UVKQWGOTWBWIEL-UHFFFAOYSA-N 397.466 5.378 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccccc2F)C1 191504934 XVMXETOVEOAARB-NRFANRHFSA-N 382.479 5.283 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc(OCCCC#N)c4)cc3c2C1 195569122 XLOSGFBLSRHSKK-INIZCTEOSA-N 387.483 5.228 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1 298482700 PYYILQDKUNEYSD-LQWHRVPQSA-N 391.515 5.147 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 304064598 SLTQTRLJOLLCBO-XMMPIXPASA-N 398.506 5.231 30 20 GKED O=C(Nc1ccc(N=C(O)c2cc3c(s2)CCC3)cc1)N1CCCCCC1 329292245 RCIPRQKKWRPPRA-UHFFFAOYSA-N 383.517 5.281 30 20 GKED C=CCOc1ccc(/C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)cc1Cl 409709301 ADJXWKJSTCSQSZ-UVTDQMKNSA-N 399.277 5.212 30 20 GKED C=C[C@@H](C)NC(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 434122434 BAEXQMKNBGIVRY-OAHLLOKOSA-N 397.544 5.046 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](c1cccnc1)C(C)C 439105065 BTGVWBKBQBSGJN-HSZRJFAPSA-N 385.467 5.432 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 439587858 DJHSVKKRHPFVNL-QGZVFWFLSA-N 381.435 6.179 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)CCC1 444468022 COTHEYKBEKSLSI-UHFFFAOYSA-N 383.860 5.374 30 20 GKED C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1C(=O)N[C@H](CCCC#N)c1ccccc1 458846665 RETLYLHSTXRCEQ-CQIJRDABSA-N 375.516 5.398 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3cc[nH]c23)cc1Cl 463388326 BBUDEEGAQUESOA-HXUWFJFHSA-N 385.854 5.729 30 20 GKED CC[C@H]1CCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 465158628 SBVKSBVLZMGRJJ-RXVVDRJESA-N 377.488 5.032 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)c1 465658148 RRKVMWLOFLFKPP-LJQANCHMSA-N 399.878 5.001 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C)c1Br 469671338 PXMHJHMHFYWFLA-UHFFFAOYSA-N 386.293 5.073 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c2ccccc21 469779012 HAVKOEDNAUTKJF-DDAIRQTISA-N 383.495 5.263 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 472122466 PBJJZCXFFHIMNI-LJQANCHMSA-N 394.412 5.607 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2[nH]ccc2s1 475587629 ZUIZYHJEWQCYIC-UHFFFAOYSA-N 387.464 5.241 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 476796022 WZLCKDMWTQMJIY-QGZVFWFLSA-N 375.497 5.724 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 483190097 AJFKXRUYZJQOCX-ORAYPTAESA-N 387.405 5.501 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl)c1c[nH]c2ccccc12 486436354 SXDDPTJFAFMPQY-KPZWWZAWSA-N 386.282 5.349 30 20 GKED Cc1cccc(OCCCCC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 500308585 ZCZWHQGLXRLMHP-UHFFFAOYSA-N 378.516 5.101 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC=C(c4ccccc4)C3)cc2)cc1 501573383 YQGGRQQLCSINIE-UHFFFAOYSA-N 380.447 5.084 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H]1c2ccccc2CC[C@H]1n1ccnc1 505036361 WBHZZMTUJXSDJC-DHIUTWEWSA-N 386.499 5.052 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(SCc3cccnc3)cc2)c1 505922426 HGBMHALZWHOVGE-UHFFFAOYSA-N 379.872 5.151 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4nccc5ccccc45)no3)cc2)nc1 507688988 FEOSVBKEBUOAMU-UHFFFAOYSA-N 391.390 5.011 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N5CCC(C)(C#N)CC5)(C4)C2)C3)cc1C 507840877 LQGCMECELPVKJL-QJMPUOCTSA-N 390.571 5.294 30 20 GKED Cc1nc(-c2ccc(CNC(=O)Nc3ccc(C#N)c(Cl)c3)s2)cs1 515380423 NRGCEWXFPFWTQU-UHFFFAOYSA-N 388.905 5.027 30 20 GKED CCN(C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1)[C@H](C)c1ccc(C#N)cc1 516209420 KYXOYCYKZRTSHT-RTBURBONSA-N 399.494 5.317 30 20 GKED N#Cc1cccc(NC(=O)[C@H](Sc2ccc(F)cc2F)c2ccccc2)c1 518491810 FLHYHVSOHVYHNJ-HXUWFJFHSA-N 380.419 5.309 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCc3nc4ccccc4[nH]3)cc2)cc1 520607866 ZKJMLBDVGAPHHO-UHFFFAOYSA-N 396.450 5.188 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F 522537816 LACUHIMWDAJHGI-LSDHHAIUSA-N 380.419 5.307 30 20 GKED CC(C)Cn1nccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522576178 WZKOOWQODRPTRP-UHFFFAOYSA-N 394.862 5.109 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccc(OC)nc1)C1CC1 529083309 UZNFTUQQMAMDFE-NRFANRHFSA-N 379.504 5.215 30 20 GKED COc1ccc(CN2CCS[C@@H](C)[C@H]2c2ccccc2)cc1OCCCC#N 536662065 NFBYYTIGRGWUHK-MBSDFSHPSA-N 396.556 5.056 30 20 GKED CC(C)Sc1ccc([C@@H](C)NCc2ccc(C#N)cc2OC(F)F)cc1 538202400 MFEJFZFMLHUQSF-CQSZACIVSA-N 376.472 5.511 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1COC(C)(C)CC 543647572 NMJHIXZVPGXARP-UHFFFAOYSA-N 384.495 5.751 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CCC(CC#N)CC1 543829263 QKZHXZPDIZOAOV-UHFFFAOYSA-N 397.450 5.093 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@@H](c1ccc(C)cc1)c1cccnc1 556845496 ZOIMEIGYTDROCE-GVAUOCQISA-N 395.506 5.003 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)Nc2ccc(CC#N)cc2)cs1 558476310 UBYWCJOPDNWPSX-UHFFFAOYSA-N 393.487 5.240 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nccnc1C(F)F 578692044 CKLXULYUOWYMNN-UHFFFAOYSA-N 385.258 5.088 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1CCCCC1(F)F 596396714 TZUBAIUFWDGCJM-CABCVRRESA-N 398.544 5.578 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)cn2)c1 603756025 CSMORURXHYBESH-HUUCEWRRSA-N 389.377 5.053 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cn2)cc1 603765262 SDYILNDMVMWSRI-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)Cc1ccc(OCc2ccccn2)cc1 604493123 PBZMQYSQUGFLFF-UHFFFAOYSA-N 385.511 5.190 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609081382 LXCUIXOADBMWTL-UHFFFAOYSA-N 399.397 5.132 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N(Cc3ccccc3)C3CC3)c2)cc1 609208920 KRBXEHZMGDXACJ-UHFFFAOYSA-N 383.451 5.547 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccc(F)cc2)n1 609428540 TUUCNMXMKYCNJJ-ZDUSSCGKSA-N 397.500 5.596 30 20 GKED CC(C)COc1ccccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 609436764 FFKWNJHALAKPSU-KRWDZBQOSA-N 397.544 5.437 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)N(CCC#N)Cc1ccco1 610876356 AWDXRAWBOBJYAA-UHFFFAOYSA-N 375.428 5.328 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](CC1CC1)c1ccccc1 611395598 JJIFEVVANWQQDH-UWJYYQICSA-N 393.556 5.008 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(Cl)cc(Cl)c3)n2)cc1 612894895 YGZOTRKDEHMPTD-INIZCTEOSA-N 387.291 5.915 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1ccc2ccccc2n1 613292747 VIFYATYWVVWIHZ-FQEVSTJZSA-N 379.463 5.475 30 20 GKED C[C@@H](NC(=O)NC(C)(C)CC(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 614822496 CUYLGIOFXWSNGT-CQSZACIVSA-N 389.421 5.316 30 20 GKED Cc1cc(F)c(C(=O)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)cc1F 622572104 WZQFHZYKZHWTKG-UHFFFAOYSA-N 381.247 5.146 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)C[C@@H](C)C1(F)F 626369192 SLNMZXQUMHMYTN-NXEZZACHSA-N 386.311 5.096 30 20 GKED O=C(Nc1ccc(F)c(F)c1F)NC(CCC(F)(F)F)CCC(F)(F)F 665150443 GBFKKRNWXNNIOJ-UHFFFAOYSA-N 396.253 5.279 30 20 GKED O=C(Nc1cccc(Cl)c1F)NC(CCC(F)(F)F)CCC(F)(F)F 665222495 DMMXZFFMVPFGPA-UHFFFAOYSA-N 394.718 5.654 30 20 GKED CN(C(=O)c1occc1COc1cccc(C#N)c1)c1ccc2ccccc2c1 726500440 YXAWZOBCKHOQOJ-UHFFFAOYSA-N 382.419 5.160 30 20 GKED CC(=NNc1ccc(Br)cc1F)c1sccc1Br 728432251 LMUYATOKIIKOJT-UHFFFAOYSA-N 392.091 5.248 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(O)c4ccccc34)c2)cc1 728599264 CYQQUVVOAPKXSQ-UHFFFAOYSA-N 380.403 5.462 30 20 GKED Cc1ccc(CN(CCc2ccccc2)Cc2ccc(OCC#N)cc2)s1 729267271 OQPBSDAVSDBUHG-UHFFFAOYSA-N 376.525 5.204 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 730749364 KVZNLZJYSYIJAE-XZOQPEGZSA-N 391.474 5.079 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc([C@H]2C[C@H]2C)o1 732764708 VGLGAFQEMBYMHE-DYVFJYSZSA-N 389.480 5.032 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C\c3cc(OC)ccc3O)s2)cc1 733750294 SLUKGTPLRXEUFU-IKTNTUJMSA-N 382.485 5.021 30 20 GKED CC(C)(C)C[C@H](NC(=O)Cc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 741589347 KIAKVGAKHDZZBO-FQEVSTJZSA-N 384.907 5.079 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C(C)(C)c2ccc3ccccc3c2)c1 741934047 PGTQLGLJMRHUKP-JOCHJYFZSA-N 386.495 5.115 30 20 GKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccc2c(c1)COC2 742438020 ZAZJCTSWBYWLJN-DAXSKMNVSA-N 395.798 5.435 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3occc3[nH]2)cc1Cl 750846307 YLMHUPZDYBYTID-MRXNPFEDSA-N 375.815 5.322 30 20 GKED C[C@H](OC(=O)CCC(=O)c1cc(Cl)sc1Cl)c1ccc(C#N)cc1 756300112 LZSQDORIUMFBBP-JTQLQIEISA-N 382.268 5.194 30 20 GKED Fc1ccc(/C=C\C=Nn2cnnc2SCc2ccc(Cl)cc2)c(F)c1 758097437 TYJRYEWHRMNJNS-YEXUNZOFSA-N 390.846 5.049 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 767048600 YPVPYMMAUSJYPC-PGRDOPGGSA-N 389.543 5.084 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCC(=O)c2cccc(F)c2)cc1 767250795 PFJKSRUIXVRNPG-JOCHJYFZSA-N 386.426 5.083 30 20 GKED Cc1nc(CON=Cc2ccccc2OC(F)F)oc1-c1ccc(Cl)cc1 768510693 BBPGTCWRVJBMSE-UHFFFAOYSA-N 392.789 5.456 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ccc(Sc2ccccc2Cl)nn1 768766401 CBRBRFJPUILRKB-UHFFFAOYSA-N 389.908 5.158 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(Oc3ccccc3)o2)S1 779708432 WSGQKGAEEUWXSD-AQTBWJFISA-N 390.464 5.580 30 20 GKED CCc1c(C(C)=NNc2nnc(-c3ccccn3)s2)oc2ccc(C)cc12 788026921 HODSIBYNMQAUAY-UHFFFAOYSA-N 377.473 5.053 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)cn1 792867472 WACLEORNLVMHQL-SOFGYWHQSA-N 390.826 5.448 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2ccc(-c3ccccc3F)s2)cc1 792925546 LCMJKZOQVQKZBD-ACCUITESSA-N 379.456 5.152 30 20 GKED Cc1cc(C(=O)/C=C/c2ncc(C(F)(F)F)s2)sc1Br 794732015 FPYGWZCYJAQGTC-NSCUHMNNSA-N 382.226 5.190 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C[C@@H](c2ccccc2)C(F)(F)F)s1 797573145 OITKIPJPLOYKFR-KBPBESRZSA-N 380.435 5.353 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)COc2ccc(-c3ccccc3)cc2)s1 797573304 QNVJBWSCDCAWLF-IBGZPJMESA-N 390.508 5.363 30 20 GKED N#CCCCCCC(=O)O[C@@H](c1cccnc1)c1cccc(C(F)(F)F)c1 805902036 GQSCCOQZFQKORU-LJQANCHMSA-N 376.378 5.207 30 20 GKED C#C[C@H](NC(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccc(Cl)cc1F 806373989 OJPMQSSLKDWBRV-PXAZEXFGSA-N 388.874 5.020 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc2ccccc2c1OC(F)F 814924229 IPAXFSQUACVRAE-UHFFFAOYSA-N 393.393 5.119 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915124843 ZNESGHPGZRDMKX-IBGZPJMESA-N 391.927 6.113 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)sc2n1 915179420 DRSHMRZOFXTEPX-OAQYLSRUSA-N 397.503 5.821 30 20 GKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1ccc2c(c1)OCCO2 916138630 QHAWBWXFZMMHQZ-VOTSOKGWSA-N 383.856 5.131 30 20 GKED N#C[C@H](C(=O)/C=C\c1cc(Br)ccc1F)c1ccc2ccccc2n1 916848620 FRNGZQKSYSCARE-DIEDAUMRSA-N 395.231 5.026 30 20 GKED CCOc1c(Br)cc(/C=C\C(=O)c2ccc(C)s2)cc1OC 917043375 HXLUWLWDDZZRAE-SREVYHEPSA-N 381.291 5.122 30 20 GKED N#C[C@H](C(=O)COc1cccc2ccccc12)c1nc2cc(Cl)ccc2s1 917046205 HRCBQALBQOHFKV-MRXNPFEDSA-N 392.867 5.358 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1F 1776062859 NYSYLRYXGCUVKG-CQSZACIVSA-N 380.341 5.278 30 20 GKED CC1(C)/C(=C\c2csc3ccc(C(=O)O)cc23)C(=O)c2cc([N+](=O)[O-])ccc21 1776515304 AZKKROUJVYHXJX-IUXPMGMMSA-N 393.420 5.065 30 20 GKED COc1c(C)cc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1Cl 1777252670 TWAZCINQXABXOZ-CLFYSBASSA-N 396.826 5.511 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/Cc4c(F)ccc(F)c4C3=O)s2)c1 1777684292 GXRPPTWSEAADLY-LCYFTJDESA-N 382.387 5.214 30 20 GKED N#Cc1ccccc1CSc1nnc(Cc2ccccc2)n1-c1ccccc1 12105894 OQYHPUIBLMQNPN-UHFFFAOYSA-N 382.492 5.022 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 25439083 JZIVFOFKTWNKGK-UHFFFAOYSA-N 395.915 5.825 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1SCC(F)(F)F)c1ccc(C#N)cc1 43960371 VKSPVCOYYZNQTR-GFCCVEGCSA-N 379.407 5.095 30 20 GKED O/C(=N\c1nnc(-c2ccsc2)s1)c1ccccc1Oc1cccnc1 51983113 WZMOXPLWEBWKIM-UHFFFAOYSA-N 380.454 5.090 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c2c(C)noc2n1 56469951 VBQHIHVFUGSVKP-UHFFFAOYSA-N 398.422 5.064 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1sc2cc(Cl)ccc2c1Cl 60625951 GSUPAUHNZQDLHG-UHFFFAOYSA-N 379.268 5.357 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(C(F)(F)F)cc1 66861191 OJLINNPJTNFQTH-ZDUSSCGKSA-N 393.434 5.150 30 20 GKED COc1cc(C(=O)/C=C/c2cc3cccc(OC)c3o2)ccc1SC(F)F 72047596 VGZUTEDFMXGDDE-BQYQJAHWSA-N 390.407 5.661 30 20 GKED CCN(C(=O)c1csc(-c2ccc(F)cc2)n1)[C@H](C)c1ccc(C#N)cc1 97174682 QKBRKSLWMKFAJD-CQSZACIVSA-N 379.460 5.044 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1nc(-c2cc(Cl)sc2Cl)cs1 109234248 SGXDAVZNRVOKKP-MRVPVSSYSA-N 377.318 5.098 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 133044163 CLASIGYNQZDXHA-AWEZNQCLSA-N 394.456 5.114 30 20 GKED N#CC1CCN(C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1 171645187 IOSMRUGDISUHLT-UHFFFAOYSA-N 388.298 5.028 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCc1ccc(OCC#N)cc1)C1CC1 175790415 RQZSEQYSBJYIHN-SFHVURJKSA-N 399.494 5.177 30 20 GKED N#C[C@H](C(=O)c1scnc1C1CCCC1)c1nc2ccccc2n1C(F)F 185257410 VUHQZOIEOWERMM-GFCCVEGCSA-N 386.427 5.036 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 195712961 YNWLMJQKDZIPJZ-JOCHJYFZSA-N 396.487 5.532 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC/C=C\c1ccccc1 255599733 VGCXZYTVHJQBOI-YHYXMXQVSA-N 383.451 5.486 30 20 GKED Cc1sc2nc(CN3CCCC3)nc(Oc3ccc(C#N)cc3Cl)c2c1C 301078224 QUFGNZZLGVQTJI-UHFFFAOYSA-N 398.919 5.221 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H](c1ccccc1)C(C)(C)C 303397464 PYFZNEPSGDVWIE-VGOFRKELSA-N 395.572 5.254 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)CC(O)=N1 329398382 AIRYZNZNELRPRQ-CXHZTBPHSA-N 396.453 5.833 30 20 GKED Cc1csc(C2(/N=C(/O)Nc3ccc(N4CCCC[C@H]4C)cc3C)CCC2)n1 329867727 WLMUPBQCDZPQOJ-QGZVFWFLSA-N 398.576 5.544 30 20 GKED O/C(=N/[C@H]1CCCc2ccc(F)cc21)C1CCN(c2nc3ccccc3o2)CC1 330068015 VAOVKCXNMZKQAJ-IBGZPJMESA-N 393.462 5.217 30 20 GKED C[C@H]1CCN(C(=O)c2cccc(SCC#N)c2)c2cc(Cl)ccc2S1 429825215 XJPOBRMBSDPLJE-ZDUSSCGKSA-N 388.945 5.487 30 20 GKED Cc1cnc(C(C)(C)NC(=O)c2ccc(Sc3ccccc3C#N)cc2)s1 430521401 AMEXNWGDIDPTCR-UHFFFAOYSA-N 393.537 5.140 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1c1ccncc1 432766390 CGQZAJHMVVATCW-JOCHJYFZSA-N 398.466 5.361 30 20 GKED O=C(Cc1cccs1)Nc1ccccc1NCC#Cc1ccc(Cl)cc1 443540737 RMHRFDKJJUWPCZ-UHFFFAOYSA-N 380.900 5.046 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)CS[C@H](C)c2ccc(C#N)cc2)cc1 447015436 GITGJBGPCZREHO-VGSWGCGISA-N 394.540 5.115 30 20 GKED CC[C@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1 447585466 JCJLWJARDIUUHH-GMAHTHKFSA-N 375.903 5.631 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)N[C@@H](c1cc(F)ccc1F)C(F)F 447720855 SXYUCUISWCJAQJ-CJNGLKHVSA-N 393.302 5.123 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]1C(F)(F)F 450965483 DQRFRVTZRVAJCL-GMTAPVOTSA-N 393.249 5.014 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)cc1 458849976 TYOODEUBOLPKSP-UEVCKROQSA-N 375.516 5.318 30 20 GKED C[C@H](C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1)c1cccc(C#N)c1 462035774 KFQOTEMTAIXLJS-LBPRGKRZSA-N 399.422 5.025 30 20 GKED C=CCn1c(S[C@@H](c2ccccc2)c2ccc(F)c(F)c2)nnc1C1CC1 463037053 VSTSKPWUZULIEV-IBGZPJMESA-N 383.467 5.501 30 20 GKED C[C@@H](Sc1ccccc1C#N)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471250025 KYVLHJTVTBRUKK-SNVBAGLBSA-N 376.268 5.768 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(Br)cc3ccccc23)n1 474425617 IEJCDDQWRDFNQR-INIZCTEOSA-N 399.313 5.672 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1)c1ccccc1 475469429 IWIXUYGAAXKTOZ-DENIHFKCSA-N 383.495 5.886 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 475542924 BAUUJWHTVZXVBM-MRXNPFEDSA-N 381.476 5.638 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(NC(=O)CC(C)C)cc1 475568865 BRTCNKBTZVOCCX-UHFFFAOYSA-N 393.531 6.167 30 20 GKED C=C(C)[C@@H](NC(=O)NCc1csc(-c2ccccc2)n1)c1ccc(F)c(F)c1 477204599 KMOJJAJSDFIKHK-LJQANCHMSA-N 399.466 5.205 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1)c1ccc(F)c(F)c1 481598084 YJUMZRWSFLOLPZ-BFUOFWGJSA-N 387.405 5.430 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2C[C@H](OC(C)C)c1ccccc1 488257805 CXDRNTXIXCTVGU-FQEVSTJZSA-N 380.875 5.001 30 20 GKED C=CCn1c(SCc2c(Cl)cccc2[N+](=O)[O-])nnc1-c1cccs1 488777698 CQFDLYGWYLUUSN-UHFFFAOYSA-N 392.893 5.047 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@H](C)c1ccc(F)cc1F 489662355 SRGROJRWKSFNPS-CQSZACIVSA-N 387.455 5.175 30 20 GKED CC(C)c1ccsc1C(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1 505321440 USDOHPRINROJSW-OAQYLSRUSA-N 390.508 5.445 30 20 GKED CN(Cc1ccc(C#N)cc1)Cc1cn(-c2ccccc2)nc1-c1cccs1 508968443 QFXITTYOLBIAIE-UHFFFAOYSA-N 384.508 5.104 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510022098 BLRSCPDAHBPPQY-UYAOXDASSA-N 381.907 5.792 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1F 512611342 KHVSHKLBKJPALO-OLZOCXBDSA-N 383.467 5.680 30 20 GKED N#Cc1ccccc1CN[C@H](c1ccccc1)c1ccc(Br)cc1 521329394 HEUGKEBRLDXGAF-OAQYLSRUSA-N 377.285 5.200 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc2ccccc2n1 521720089 MDSFMFTYXVOTIG-HNNXBMFYSA-N 393.537 5.360 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)Nc1ccc(C#N)cc1 524407539 UFSXBZPUMOGXJC-UHFFFAOYSA-N 375.403 5.229 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(CC#N)C1CCCC1 524583417 ZFUARFCYBMGPID-UHFFFAOYSA-N 383.495 5.048 30 20 GKED C[C@H](NCc1cccc(C#N)c1F)c1ccc(OCc2ccc(F)cc2)cc1 537099372 WEGWQCDAPLVNRV-INIZCTEOSA-N 378.422 5.266 30 20 GKED N#CC1(CCCNc2ccccc2OCc2cccc(Cl)c2)CCOCC1 537507631 MFXQZYFTLGIMBU-UHFFFAOYSA-N 384.907 5.431 30 20 GKED C=CCC[C@H](NCc1cccc(C(=O)N(C)C)c1)c1ccc(C(F)(F)F)cc1 539334122 NYOYFYLQILAOFH-FQEVSTJZSA-N 390.449 5.204 30 20 GKED N#CCC1CCN(C(=O)c2ccccc2Nc2cccc(C(F)(F)F)c2)CC1 541975386 NFAYKYBGTROEJF-UHFFFAOYSA-N 387.405 5.215 30 20 GKED Cc1c(Cl)cnc(N[C@@H](C)c2ccc(OCc3cccnc3)cc2)c1C#N 543205700 GCLQYEOMYAIXBX-HNNXBMFYSA-N 378.863 5.062 30 20 GKED C=C(C)[C@@H](Cc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1)OCC 544979339 YWWMYWLOFPNQRE-CYBMUJFWSA-N 394.315 5.298 30 20 GKED N#Cc1cccc(C2(N[C@H]3CCSc4ccc(Br)cc43)CC2)c1 560269306 UOPDRPQGBHEBKR-KRWDZBQOSA-N 385.330 5.137 30 20 GKED N#Cc1c(F)cccc1SCc1nc(-c2cccc(C(F)(F)F)c2)no1 565577968 OIVVTFHAQQDTEA-UHFFFAOYSA-N 379.338 5.058 30 20 GKED COc1cc([C@@H](C)N[C@@H]2CCc3ccc(C#N)cc32)ccc1OCCC(C)C 580015918 IKEMHCOCQWOZQF-VGOFRKELSA-N 378.516 5.330 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)c(OC)c2)c2ccccc2Cl)cc1 580863640 ZDUUCSXKLJYRHX-QHCPKHFHSA-N 392.886 5.108 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1 591528746 WXQXLEGSCFLTJQ-UHFFFAOYSA-N 395.462 5.009 30 20 GKED CCOc1ccc(Oc2cc(CNc3cccc(Cl)c3C#N)ccn2)cc1 603871825 WGCOPSNYPWUGQM-UHFFFAOYSA-N 379.847 5.410 30 20 GKED CSc1ccc(-c2csc(NC(=O)CSc3ccc(C#N)cc3)n2)cc1 603918208 CETMDRLWQOPRDD-UHFFFAOYSA-N 397.550 5.134 30 20 GKED N#CCCCOc1cccc(/C=C(/CCC(=O)O)c2nc3ccccc3s2)c1 608845939 JZIMKLDVQLTDDS-VKAVYKQESA-N 392.480 5.384 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc3ccccc3c2c1 608915252 PVZGFTZWGNAYAF-UHFFFAOYSA-N 383.451 5.900 30 20 GKED C[C@@H](CN(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1)c1ccccc1 608947950 JYKBNDOCBMPBRR-IBGZPJMESA-N 384.479 5.013 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccccc3OC(F)F)c2)cc1 609176627 PXVYUYYPVSUMBF-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)c(C)c2)c1 609254132 IOBGXXGKTUVKLO-IBGZPJMESA-N 399.494 5.637 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccccc1Cl 609377969 SJYMNOCCWICOHU-AWEZNQCLSA-N 390.961 5.464 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](Cc2ccccc2)C1 609438933 OZHZYAUWISYIMR-AZUAARDMSA-N 393.556 5.567 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 609460487 BGPQICXCDVMPOK-FQEVSTJZSA-N 398.293 5.082 30 20 GKED CSc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613319347 CPYSZOIDXOVFHC-OAHLLOKOSA-N 384.913 5.675 30 20 GKED Cc1cc(C)n(-c2ccc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2)n1 613392560 UOVXQFLDKWWGBE-FQEVSTJZSA-N 398.491 5.103 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 614405968 KWIRLBLYYHQIGX-CQSZACIVSA-N 381.932 5.803 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NS(=O)(=O)c1cccc(CC#N)c1 619462183 LZZPLHDXISCWAA-UHFFFAOYSA-N 394.521 5.013 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)c1ccc(Cl)cc1 619863779 CVHMMHNAJBVLNJ-CQSZACIVSA-N 393.802 5.348 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2cc3n(n2)CCCC3)cc1)C(F)(F)F 650117953 PXAFDUJVRXEXMM-UHFFFAOYSA-N 395.322 5.121 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)C1 652488963 AMTHTNGMAXHSOM-UHFFFAOYSA-N 390.274 5.147 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccccc2F)n1 661118061 VWSASERAVZROEN-LPHOPBHVSA-N 387.524 5.191 30 20 GKED C[C@@H](NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)C1CCC(F)CC1 661896943 AKWXLSRIKYNXSR-VOMCLLRMSA-N 394.375 5.256 30 20 GKED CCOc1cc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)ccc1O 727685764 ZTQTYIFHHCSRMK-RVDMUPIBSA-N 395.455 5.266 30 20 GKED CC(C)C[C@H](C)CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 727953358 GMTAEZAWTOJLPN-HKUYNNGSSA-N 378.472 5.199 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccccc2Cl)c1 728227320 GSMNZUBHSLMSQJ-UHFFFAOYSA-N 376.912 5.725 30 20 GKED Cc1ccc(Cl)c(NC(=S)N(c2cccc(C#N)c2)C(C)C)c1Cl 728444392 ICGAUNAUGLKKTR-UHFFFAOYSA-N 378.328 5.785 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(Nc2ccccc2F)sc1=S 729470248 GYPLURMWHCNBCK-UHFFFAOYSA-N 393.557 5.166 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(OC(F)F)cc1 731321234 OGCWMZVTTKNWBJ-GFCCVEGCSA-N 393.484 5.491 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Oc3ccccn3)cc2)cc1Cl 733751244 CIYOPORIOYIHPK-UHFFFAOYSA-N 380.860 5.208 30 20 GKED C=CC[C@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccncc1 734509238 JMUWZEUSNRLFAQ-SFHVURJKSA-N 389.446 5.631 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)NC(C1CC1)C1CC1 734758291 ODVVUSJXJXWISF-UHFFFAOYSA-N 393.531 5.076 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1coc(-c2cccs2)n1 735318799 QMLTYFTYUNXLAF-UHFFFAOYSA-N 376.890 5.392 30 20 GKED C=CCc1cc(C(=O)O[C@H](C)c2ncc(-c3ccccc3)o2)cc(OC)c1OC 741309137 RGJMGDYFMKQWQU-OAHLLOKOSA-N 393.439 5.005 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccccc2CC(F)(F)F)cc1OC 741990128 XCHGETSKURGABH-LUAWRHEFSA-N 391.389 5.017 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(C2SCCS2)cc1 752038208 GFPDBMHFFQNSMU-VQTJNVASSA-N 394.565 5.077 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc2ccccc2c1 753400290 MANYTTMXWBDBEP-HRAATJIYSA-N 382.488 5.943 30 20 GKED C[C@@H](CSc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 756277018 VLCUKYDWZBYNNI-XHDPSFHLSA-N 388.464 5.179 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2cc(Br)ccc2F)c1 763122295 PTSRXSFGLCOPMZ-RMKNXTFCSA-N 388.236 5.167 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)c(Cl)c1 765606363 VMWMOSKYVPVHDY-RUDMXATFSA-N 382.872 5.540 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)OCCCCC(C)(C)C#N 768341909 RFLVTRUTQVAPOO-UHFFFAOYSA-N 386.517 5.461 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 770095350 BVTVYCXPQHZEFJ-PGRDOPGGSA-N 378.859 5.168 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Br)ccc2F)c1 772986495 XPZFCOXYLVYEAU-CJNGLKHVSA-N 391.284 5.120 30 20 GKED N#CCOc1cc(F)ccc1NCc1ccc(OCc2ccc(F)cc2)cc1 773372144 OYAMXAQBVNBKPP-UHFFFAOYSA-N 380.394 5.058 30 20 GKED O=C(/C=C\c1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCOC2=O)cc1 780186973 ONWMXMZLKJJGTD-BHQIHCQQSA-N 395.764 5.212 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@@H]1/C=C/c1ccccc1 780678899 QOQQWCFFCMPIAO-WHAUSFDRSA-N 389.499 5.467 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)cc1 782544306 CAMSHJYVAQDNKE-QRVBRYPASA-N 392.911 5.799 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 785767788 IXIUIZFMNHTOHA-IBGZPJMESA-N 392.908 5.127 30 20 GKED CC[C@@H](CC#N)OC(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 787084713 RFANDIKWSIVGLK-HNNXBMFYSA-N 396.516 5.207 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(O[C@H](C)c3ccccc3)cc2)c1 788350026 CIQWEXIFZJEAAN-JPYJTQIMSA-N 398.462 5.096 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)c(F)c1)c1nc2cc(Cl)ccc2s1 791106867 DIJZIMGDQZAGOI-LLVKDONJSA-N 379.243 5.161 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CCC)[C@H](O)c1ccccc1 791874999 KYAIHDGQSCCRKL-FYYLOGMGSA-N 380.532 5.562 30 20 GKED C=CCC(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 796765940 VAEABXMTHRYQJD-CYBMUJFWSA-N 379.312 5.895 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ncc(-c3ccccc3F)o2)s1 797568398 RBXSPDLXPSFZPF-CQSZACIVSA-N 397.475 5.044 30 20 GKED COc1ccc(SCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797569660 UPCRVVGGTWNLPO-INIZCTEOSA-N 388.558 5.198 30 20 GKED C#CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1COCc1ccccc1 806209078 OOUCNCFNWSYSRX-DEOSSOPVSA-N 398.506 5.160 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1csc2ccccc12 806745597 UNLPXRINIYTCNP-KRWDZBQOSA-N 396.560 5.528 30 20 GKED N#Cc1cc(NC(=O)c2ccc(C3SCCCS3)cc2)nc2ccccc12 809072411 NJJSERFZHTWJIU-UHFFFAOYSA-N 391.521 5.227 30 20 GKED O=C(/C(=C\c1cnn(CC(F)F)c1)c1ccccc1)c1nc2ccccc2s1 814187611 OAGNYDZYMSHOTH-YBEGLDIGSA-N 395.434 5.181 30 20 GKED C=CCc1cc(CNc2cccc(NC(=O)OC(C)(C)C)c2C)cc(OC)c1O 858232903 AJMGBZCDTKRXHI-UHFFFAOYSA-N 398.503 5.397 30 20 GKED N#Cc1c(F)cc(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])cc1F 864016944 BWSPJJGIABHGAA-UHFFFAOYSA-N 391.683 5.029 30 20 GKED C=C(C)Cn1c(SCc2nc(C3CCCCCC3)no2)nnc1-c1ccco1 904679870 BLTNZRFNJPEZRD-UHFFFAOYSA-N 399.520 5.227 30 20 GKED Cc1noc(C)c1CCC(=O)N1CCCSC1=Nc1ccccc1C(C)C 916550382 ZKVJRUGQSIYKIE-UHFFFAOYSA-N 385.533 5.001 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(SC(C)C)cc2)cc1 916949806 PVTQAFSSOVNUMF-IERDGZPVSA-N 394.540 5.662 30 20 GKED C=CCn1c(-c2ccco2)nn(CN[C@@H](c2ccccc2)C(C)(C)C)c1=S 917432119 JWYXFZICKOSZNT-SFHVURJKSA-N 382.533 5.195 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 919852214 IZOMIRQMZJHLOM-UHFFFAOYSA-N 397.261 5.815 30 20 GKED CCCc1ccc(NC(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)cc1 920850115 XSPRRAZJKHPFFD-UHFFFAOYSA-N 386.499 5.285 30 20 GKED C[C@@H](Cc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921131346 IYTWQTPGPWRFIO-UGSOOPFHSA-N 398.890 5.658 30 20 GKED O=C(O)c1ccc(NN=Cc2ccccc2Oc2ccc(F)c(Cl)c2)cc1 1776012155 GCYKQSCVTBZWBI-UHFFFAOYSA-N 384.794 5.416 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(Sc3ccccc3)cc2)ccc1Cl 1776033722 XJXACJIGWDEENF-UHFFFAOYSA-N 382.872 5.635 30 20 GKED O=C(O)c1ccc2scc(C=NNCc3c(Cl)cccc3Cl)c2c1 1776065341 LYUXOEIJHMDICL-UHFFFAOYSA-N 379.268 5.030 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1Cl 1776388577 INWKSCHKGMWWDK-ALCCZGGFSA-N 379.239 5.375 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(Cl)cccc1Br 1776783171 GZQHUWADQWUPLM-CYBMUJFWSA-N 390.749 5.396 30 20 GKED CCCCCCCOc1ccc(CNC2(C(=O)O)CCC(F)(F)CC2)cc1 1776786564 UNYGDIZSBILMJM-UHFFFAOYSA-N 383.479 5.158 30 20 GKED COc1ccc(/C=C/C(=O)c2csc(C(F)(F)F)c2)c2cc(C(=O)O)oc12 1777361539 LFNFZDRLBBNGET-DUXPYHPUSA-N 396.342 5.116 30 20 GKED C=CCN(C(=O)CCCc1nc2ccccc2s1)c1nc2c(s1)CCCC2 23653639 VTFYEWCPQWMJMI-UHFFFAOYSA-N 397.569 5.174 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 53776303 ZPFXHADYJJHGRJ-UHFFFAOYSA-N 378.522 5.151 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1nc2ccccc2[nH]1 60932196 IESXLTXSSKVYHN-OAHLLOKOSA-N 398.491 5.077 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1 66346759 HYRHREWPMNLIFJ-LJQANCHMSA-N 381.888 5.379 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(OC)c1OC 66800322 XSBBFWFKUXMNKW-HNNXBMFYSA-N 396.512 5.079 30 20 GKED Cc1csc([C@@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 67938961 FMMLKFZMNHPEDA-OAHLLOKOSA-N 393.537 5.107 30 20 GKED N#CCOc1cccc(NC(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)c1 107965569 PCBCJSMGYDPJDE-PKNBQFBNSA-N 394.883 5.623 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1sccc1SC(F)F 108239397 CKZSIOCKQJXXDG-JTQLQIEISA-N 384.498 5.567 30 20 GKED Cc1cc(Cl)cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1 123258462 VMDCFYCWRUFZDH-QGZVFWFLSA-N 377.856 5.134 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@@H](C)c3cccc([N+](=O)[O-])c3)o2)cc1 126278017 YHDXHALJJHWSIK-ZDUSSCGKSA-N 383.429 5.063 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1S[C@@H](C)CC#N)COCc1ccccc1 171838743 QEDBVKSDGAMYSR-ROUUACIJSA-N 397.544 5.055 30 20 GKED COc1ccc(-c2ncc(C(=O)Nc3ccccc3SCCC#N)s2)cc1 173133978 LEBYGWYKYHCJGS-UHFFFAOYSA-N 395.509 5.077 30 20 GKED N#C[C@H](NC(=O)c1occc1CSc1ccccc1)c1ccccc1Cl 179554506 SWWQUDNNOAZNIM-SFHVURJKSA-N 382.872 5.220 30 20 GKED CC#CCCCC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 185337885 HTRRVJREEJXTHL-UHFFFAOYSA-N 388.389 5.090 30 20 GKED C[C@]1(O)CCCN(C(O)=Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 329824192 HSOHAYSGWXXWDG-FQEVSTJZSA-N 390.936 5.274 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@H]2CCCc3ccc(F)cc32)CC1)C1CCCC1 330042256 CBUGYNAPTXZVBC-XTXLOEGASA-N 386.511 5.865 30 20 GKED N#C[C@H](C(=O)c1ccc(F)cc1OC(F)F)c1nc2cc(Cl)ccc2s1 429735961 NKNHBSPHXJDMMO-LLVKDONJSA-N 396.777 5.180 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 432901749 QLKGYTIPWHAPOZ-UHFFFAOYSA-N 396.859 5.169 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3cc(C#N)oc3C)s2)cc1 435459183 SHXHMENULNNHDM-CQSZACIVSA-N 379.485 5.033 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c(Br)c1 437647904 FDCAZJLAXDGOKN-LPHOPBHVSA-N 398.304 5.061 30 20 GKED CCOc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1Cl 437756851 IWWGXPIUROHMKR-IEBWSBKVSA-N 383.879 5.042 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 438377093 WESMMLZWYFOSCK-NHCUHLMSSA-N 377.488 5.168 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OC4CCC4)cc3)n2)cc1 442678544 JNILSPMMUWNWEB-FQEVSTJZSA-N 388.492 5.540 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(c3cccc(F)c3C#N)C2)n1 447689527 QGKQGHNMPSXSJR-HNNXBMFYSA-N 393.487 5.213 30 20 GKED N#CCCC[C@H](NC(=O)N1CCc2c1cccc2C(F)(F)F)c1ccccc1 458796285 DMTZCGBVWXWILF-SFHVURJKSA-N 387.405 5.213 30 20 GKED C[C@H](C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1cccc(C#N)c1 461802271 JLQWWOCZYNPWCQ-FDDCHVKYSA-N 393.490 5.091 30 20 GKED C[C@H](C(=O)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1cccc(C#N)c1 462316460 SIUJGJPILOLATC-LBPRGKRZSA-N 392.808 5.139 30 20 GKED C[C@@H](N[C@H](C)c1ccc(Cl)c2ccccc12)C(=O)Nc1ccccc1C#N 462354821 WFLJLMYQQGYGRC-HUUCEWRRSA-N 377.875 5.043 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)S[C@@H](C)c1ccccc1OC 463196586 DKNQUJREHVSSAU-HOTGVXAUSA-N 375.559 5.154 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 464715100 XJENSUIQBGGREZ-MRXNPFEDSA-N 376.884 5.298 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 465669841 WZJWSHCIAFSNLA-MOPGFXCFSA-N 383.495 5.689 30 20 GKED C=CCC(CC=C)C(=O)N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21 467525853 QMUQVQDATDBCNZ-SFHVURJKSA-N 382.529 5.081 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(C[S@@](=O)CCCC(C)(C)C#N)cc1 476888823 UKWNECPXXIMEHR-SANMLTNESA-N 389.948 6.019 30 20 GKED CN(Cc1nc2ccccc2s1)C(=O)c1ccccc1Oc1ccccc1C#N 480129368 BWAFZXUNAPXHAJ-UHFFFAOYSA-N 399.475 5.232 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)c1ccc(OC)c(OC)c1 482203484 YEDQBNUJOMPVPU-FQEVSTJZSA-N 396.531 5.829 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 483088847 OERQPFPOSVJPFQ-NQIIRXRSSA-N 393.487 5.066 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1cnc2ccccc2n1 483231697 FPQQAAJOOSOULC-IBGZPJMESA-N 399.837 5.566 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2sc(C3CC3)nc2-c2ccccc2)nc2ccccc21 483464366 DPWIUZZHMXHTDI-INIZCTEOSA-N 398.491 5.064 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 487799701 OZHAYLCLLLIYIP-JOCHJYFZSA-N 385.467 5.629 30 20 GKED C=C(CNC(=O)c1ccccc1SCc1cn2ccccc2n1)c1ccccc1 488896134 XXDQQTWRUXMANI-UHFFFAOYSA-N 399.519 5.070 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(-c2ccccc2)no1 489739388 FGBFIACMXHMAMI-MRXNPFEDSA-N 382.423 5.574 30 20 GKED C=CCN(CCc1ccco1)C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 497365194 JQICFCAHKVGPAH-KRWDZBQOSA-N 395.528 5.213 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccc(C)cc1C 502661503 RCMPTZHIWVECCQ-UHFFFAOYSA-N 391.284 5.425 30 20 GKED CCC[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 504258104 NJTVSBBERJUEHV-MBSDFSHPSA-N 383.495 5.381 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2cc(-c3ccco3)on2)cc1 505800867 FJZJPVJDKMAPSU-UHFFFAOYSA-N 387.414 5.148 30 20 GKED CCN(C(=O)c1sc(-c2cccs2)nc1C)[C@H](C)c1ccc(C#N)cc1 509563260 FGOPLPIIZHIUCF-CQSZACIVSA-N 381.526 5.275 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](CC)c1ccccc1 517473253 LXBDQMLIQMCQAH-NQIIRXRSSA-N 395.572 6.334 30 20 GKED CCN(C(=O)CCCCOc1cc(C)ccc1C)[C@@H](C)c1ccc(C#N)cc1 517906140 RTKPPZZVAGXKRK-FQEVSTJZSA-N 378.516 5.334 30 20 GKED CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)Nc3ccccc3CC#N)c12 518000352 MSIGZSDYUJADSI-UHFFFAOYSA-N 388.471 5.007 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccs1 518681985 OBKQQYQGYVMKNC-WBVHZDCISA-N 387.574 5.909 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 520601236 JTUIRRWGRCISDH-DEOSSOPVSA-N 397.478 6.028 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 520806015 TVBGBBACAROTFP-UHFFFAOYSA-N 376.378 5.704 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 520865599 KOQVZFMEGGEYDT-TYCQWZJGSA-N 386.520 5.834 30 20 GKED CCn1c(S[C@@H](C)c2ccc(C#N)cc2)nc2sc3c(c2c1=O)CCCC3 522822252 NOEJUMGEGINJNB-ZDUSSCGKSA-N 395.553 5.082 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)s1 524464856 RRLWVFVZAYWSGN-UHFFFAOYSA-N 392.440 5.086 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)CSCc1ccc(C#N)cc1 524844599 OFRGTINCXZOMQM-GOSISDBHSA-N 378.541 5.181 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(-c2ccccc2)c(C)nc1O 530686173 DADQGJJMPPFWJU-UHFFFAOYSA-N 398.915 5.306 30 20 GKED N#CCC1CCN(C(=O)c2ccccc2Oc2cccc(Br)c2)CC1 541046437 LOYWYAZEIKLWDL-UHFFFAOYSA-N 399.288 5.007 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cnc4ccccc4c3)no2)c2ccccc21 545705634 OQCBEXAHENCNHS-ZHACJKMWSA-N 391.434 5.324 30 20 GKED Cc1ccc(-c2nc(Cc3noc(-c4ccc(C5(C#N)CC5)cc4)n3)cs2)cc1 547026317 VFFMSCGNVMETDC-UHFFFAOYSA-N 398.491 5.315 30 20 GKED CC(C)CNC(=O)c1ccc(NCc2ccc(F)c(C#N)c2Cl)cc1Cl 551452325 PTOZHDCHOCSRBB-UHFFFAOYSA-N 394.277 5.002 30 20 GKED C[C@@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccc(C#N)cc1 551563489 HNHJZOOPSDGZHS-QVKFZJNVSA-N 388.433 5.396 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1C1CC1 551622415 RGZOOBIOOUWQOT-MRXNPFEDSA-N 379.508 5.046 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3nc(-c4cccc(F)c4)[nH]c3c2)c1 552133072 WBCWFLDAIOJUSZ-UHFFFAOYSA-N 390.805 5.146 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCCSCc1ccccc1 560978546 CSCYCRXZBSVIJL-UHFFFAOYSA-N 382.916 5.159 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(SCC(F)(F)F)cc2)ccc1C#N 566885298 LLWQUZCCAKNGGD-ZDUSSCGKSA-N 380.435 5.072 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2occc2CSc2ccccc2)cc1 567962014 ROCFXNZGVGFZIF-HXUWFJFHSA-N 376.481 5.129 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3coc(C4CCCCC4)n3)cc2)ccn1 572450884 ZXLKCMXYTZUIJM-UHFFFAOYSA-N 388.427 5.034 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cc2)ccn1 589471476 UAJKLSZRPLBWDL-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc(-c4ccoc4)n3)n2)cc1 595127560 YYDJDZJYLLEFNN-HNNXBMFYSA-N 391.477 5.325 30 20 GKED CCc1sc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1C 604004101 VEDYLOSOVVBHTE-UHFFFAOYSA-N 390.508 5.516 30 20 GKED Cc1ccc(C(=O)C2CCN(c3c(C#N)cnc4c(C)cccc34)CC2)c(C)c1 607948891 AXTCPSSAHAHWQU-UHFFFAOYSA-N 383.495 5.131 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 609080709 MHUYDZYBLUSIQL-LJQANCHMSA-N 399.494 5.671 30 20 GKED N#Cc1cnccc1NC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 609285628 TVDAXUUOCJCHHD-UHFFFAOYSA-N 379.872 5.151 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc4cnccc34)cc2)cc1 609547553 RMEWGVMBKDZMNI-UHFFFAOYSA-N 379.419 5.345 30 20 GKED N#CCn1c(-c2nc(-c3cccc(-c4cscn4)c3)no2)cc2ccccc21 612957635 JRXWXICVGDMBNQ-UHFFFAOYSA-N 383.436 5.005 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 615815624 CNPIZBWLVZTLJC-GOSISDBHSA-N 380.385 5.217 30 20 GKED C[C@@H](c1ccc(OC(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 619726856 UYRARAIHJMUVNJ-ZMLRMANQSA-N 391.302 5.412 30 20 GKED C[C@H]1C[C@H](NCc2ccc(C#N)c(Cl)c2)c2cccc(Br)c21 619755345 XNXNNHJFDQUSEZ-GTNSWQLSSA-N 375.697 5.312 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccccc3F)n2)CCCCC1 625937442 ZNPLEYFHIJUAMG-UHFFFAOYSA-N 387.524 5.335 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(N[C@@H](C)c2cc(C)c(OC)cc2C)cc1 630061811 XHOLJYNNVDVHDT-IBGZPJMESA-N 378.516 5.299 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 678207922 IDGOIDHBGHCIJY-QWRGUYRKSA-N 397.256 5.407 30 20 GKED N#C[C@H](C(=O)c1ccoc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 684948552 XLSPBYPIIRHTHI-GFCCVEGCSA-N 376.359 5.276 30 20 GKED COc1ccc2cc(CN(C)C(=S)Nc3ccc(C#N)c(Cl)c3)ccc2c1 726448385 PHMLLSIVFJPPLW-UHFFFAOYSA-N 395.915 5.202 30 20 GKED Cc1nc(CCC(=O)[C@@H](C#N)c2nc3ccccc3s2)oc1-c1ccccc1 730395943 ZYCQIQVCVSASON-MRXNPFEDSA-N 387.464 5.069 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1c(Cl)nc2ccccn12 737445624 CAZRWZRPONJLSQ-NTMALXAHSA-N 393.786 5.052 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccccc3OC(F)(F)F)c2)s1 740014030 LHGDNLBSPMBGOG-UHFFFAOYSA-N 388.414 5.475 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=S)Nc2ccccc2C#N)cc1 741500924 BFDMFNPIFAPGLA-INIZCTEOSA-N 387.508 5.281 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)[C@H]2C[C@H](OCC)C23CCCCC3)c1 741514795 XIAGIWXAEFNHSZ-SFTDATJTSA-N 384.589 5.205 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1OC 741841264 FFIILNHZQWFTIF-OQFOIZHKSA-N 382.403 5.254 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cc(Cl)ccc2Cl)cc1 748174167 BQQTXZCAFBPCME-FQEVSTJZSA-N 395.289 5.830 30 20 GKED N#Cc1ccc(/C=C\C(=O)c2ccc(Br)cc2Br)s1 748994112 GDSNFXQBAMOZMI-XQRVVYSFSA-N 397.091 5.041 30 20 GKED N#Cc1ccc(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)c(F)c1 761626194 UKOVQTDNTNSRQK-UHFFFAOYSA-N 388.370 5.115 30 20 GKED C=CC[C@H](N[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccncc1 766018749 GQQMSYXXQOCATF-YJBOKZPZSA-N 379.485 5.686 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c(C)oc4ccccc34)n2)cc1 767959346 MCNFSJSPNMOQAE-LJQANCHMSA-N 386.476 5.592 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 770095840 FEXXMPJGXZBOGN-DNVCBOLYSA-N 384.888 5.230 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1)c1ccccc1 778775342 GBKCYTFWRBBAED-HXUWFJFHSA-N 380.488 5.010 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCCc1ccc2c(c1)-c1ccccc1C2 780178560 UJZJSTDHVIRMAM-GOSISDBHSA-N 396.490 5.510 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)Nc3ccccc3O[C@@H](C)C#N)cc2)nc1 780579059 SRVTYTKWPDQNTH-INIZCTEOSA-N 388.427 5.117 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)Oc1ccc(C#N)cc1F 781734251 AZCHIZHOHNEUSS-UHFFFAOYSA-N 391.185 5.187 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)N(Cc1ccco1)C1=CCCCC1 782917082 CUFUZESENROPET-UHFFFAOYSA-N 386.904 5.383 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1 797510778 PXRGAEQYEPRATB-UHFFFAOYSA-N 380.275 5.056 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(C(F)(F)F)cc1 798827437 HGEYCERSCMNBHN-HZMBPMFUSA-N 392.377 5.434 30 20 GKED N#CC1CCC(CN[C@H](Cc2ccccn2)c2ccc(Br)cc2)CC1 799726303 MZIQEBJLAGTMGJ-MYKUNDNFSA-N 398.348 5.047 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801654171 HGGCHQWTOVJGJE-AWEZNQCLSA-N 395.274 5.296 30 20 GKED C=CC[C@@H](NCc1cc(C(F)(F)F)ccc1Br)c1ccncc1 810145355 AAHRBRZZAKEBRQ-MRXNPFEDSA-N 385.227 5.270 30 20 GKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccc(C(F)(F)F)cc1O 810226438 YAMIGSGDLBICIX-APWZRJJASA-N 392.421 5.333 30 20 GKED C[C@H](NCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)c1cccc(C#N)c1 820803004 IHVCPCGECLFGSY-KRWDZBQOSA-N 391.515 5.097 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC[C@]1(C)CC1(Cl)Cl 836387667 CKYIMSPEMQSVOJ-MLGOLLRUSA-N 386.348 5.176 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2ccc(F)cc2)CC1)c1ccccc1 838604459 SNBZEBZTBJBUBL-QFIPXVFZSA-N 379.479 5.150 30 20 GKED CC(C)(C)Sc1c(F)cc(NC(=O)N2Cc3cccc(C#N)c3C2)cc1F 844694077 HCXLSWFBKLJXAG-UHFFFAOYSA-N 387.455 5.275 30 20 GKED CC(C)(C)Sc1c(F)cc(NC(=O)N2Cc3ccc(C#N)cc3C2)cc1F 847194017 UOAPPICANHEJTB-UHFFFAOYSA-N 387.455 5.275 30 20 GKED C[C@H](OC(=O)CC1(C#N)CCCCC1)C(=O)Nc1ccccc1-c1ccccc1 849904393 IECAUJGOVAXUDM-SFHVURJKSA-N 390.483 5.088 30 20 GKED Cc1cc(Br)ccc1CNc1ccccc1S[C@@H](C)CC#N 864005559 BJHUJDJHRWWPFF-AWEZNQCLSA-N 375.335 5.764 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccc(Cl)cc2)cc1 915352585 MMJPOHSMGQPPSO-QFIPXVFZSA-N 389.886 5.360 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2Cl)cc1Cl 916056829 IZMISATXNBTOKS-KRWDZBQOSA-N 382.250 5.296 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 916846610 ZWGSTNUEWLGWPD-PBHICJAKSA-N 378.497 5.238 30 20 GKED N#C[C@H](C(=O)CCc1ccc2ccccc2c1)c1nc2cc(Cl)ccc2s1 917430654 RCPIYCSLWCFWKF-GOSISDBHSA-N 390.895 5.912 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N(Cc1cccs1)c1ccc(F)cc1F 917782243 VZTIECBVFJHPFW-JXMROGBWSA-N 380.419 5.145 30 20 GKED CC(C)=C[C@@H]1[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1(C)C 920140355 BYTQZVRCRJFPSX-YQVWRLOYSA-N 375.497 5.096 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)cc1 1776125486 JVTXXDBVNCFYCB-KZIRBZLESA-N 394.511 5.805 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)C2CCCCC2)cc1 1776787875 CILJYDNWLNZUBY-JOCHJYFZSA-N 375.553 5.549 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)CC2 1777371042 CNTVQKNJPPJHEK-KGENOOAVSA-N 384.431 5.273 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4ccc(O)cc4C3=O)s2)c1 1777684323 PTWBGUNFUTVQCP-PTNGSMBKSA-N 376.433 5.031 30 20 GKED Cc1nc(-c2ccc(CNC(=O)c3ccccc3-c3ccccc3C#N)o2)cs1 16298490 HRYCXCCTWNKIGO-UHFFFAOYSA-N 399.475 5.180 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1nc2ccccc2o1 54734729 KKHPTJMTGWGDIC-LJLILKBBSA-N 390.748 5.390 30 20 GKED COc1ccc(-c2nc(CSCCOc3cccc(C#N)c3)cs2)cc1 60515604 UMRCVLFNFYKGKK-UHFFFAOYSA-N 382.510 5.003 30 20 GKED COCc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccccc12 66801880 LEVNRVYKAKCLHU-AWEZNQCLSA-N 380.469 5.226 30 20 GKED CCC[C@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 66861215 RBDBOPDCRPJOKH-MJGOQNOKSA-N 381.545 5.150 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955000 NYRPIGMLJKBBQX-QGZVFWFLSA-N 395.528 5.310 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)Nc1ccc(CC#N)cc1 104985839 MNBOVNRLSSMDHP-CQSZACIVSA-N 394.475 5.206 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)c1ccc(COc2ccccc2C#N)o1 108089434 OUQUAXLGKDZNPB-UHFFFAOYSA-N 394.858 5.046 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 108408276 BFFVMNSLTJYCGY-SJORKVTESA-N 381.545 5.501 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1 108866779 PYPIDBOPEHNFSE-UHFFFAOYSA-N 381.435 5.114 30 20 GKED CC[C@H](OC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 113656884 FLNJPUSIPOIWNT-GUYCJALGSA-N 390.455 5.002 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)c1ccccn1 126063586 MDYJCFASDNKQFK-ZDUSSCGKSA-N 384.222 5.066 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccccc3S[C@@H](C)CC#N)c[nH]c12 155096360 XEKHSUQHKYRPLW-INIZCTEOSA-N 377.513 5.442 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2c(Cl)cccc2C1 159276796 AYGXCPFWKZDRPC-AWEZNQCLSA-N 385.920 5.182 30 20 GKED N#CCC[C@H](Nc1nn2cc(-c3ccc(F)cc3)nc2s1)c1ccccc1 164325281 VRTKPNMRPBVCKH-KRWDZBQOSA-N 377.448 5.054 30 20 GKED C=CCN(CC=C)Cc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 164806199 USBBENKCYDFTBM-UHFFFAOYSA-N 395.450 5.021 30 20 GKED CCn1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1Cl 172883386 ABEWDOXPMNVFGX-UHFFFAOYSA-N 394.862 5.090 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 177749241 QMHAFKQOCLWQBO-HNNXBMFYSA-N 381.526 5.112 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 178699801 COCTXIDLZOLHIK-HNNXBMFYSA-N 397.446 5.179 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCC[C@H]1CCCCO1 184091287 XFQKDPAPDLQUBE-LJQANCHMSA-N 393.487 5.130 30 20 GKED C[C@H](NCCCC(C)(C)C#N)c1nc(-c2ccc(Br)cc2)cs1 184955653 GQIYTJHMHGETFB-ZDUSSCGKSA-N 392.366 5.553 30 20 GKED N#C[C@H](C(=O)CCc1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 194182400 FAYAGANGMWPEBD-HXUWFJFHSA-N 383.476 5.167 30 20 GKED CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1S[C@H](C)CC#N 246784156 ZNPFBCDJCKBMAM-HLLBOEOZSA-N 377.579 5.267 30 20 GKED Cc1oc(-c2ccsc2)nc1CC(=O)Nc1ccccc1SC[C@H](C)C#N 264577137 VYTQBVSXKYSTDL-CYBMUJFWSA-N 397.525 5.145 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H]1CCCC[C@@H]1C(C)(C)C 303412093 VAGRPSYXTYGJTE-FGTMMUONSA-N 387.593 5.071 30 20 GKED N/C(=N/Cc1csc(-c2ccco2)n1)Nc1cccc(Oc2ccccc2)c1 305048923 CAHZDSNVUFULGR-UHFFFAOYSA-N 390.468 5.122 30 20 GKED N#C[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccccc1Cl 329385541 SARGBLNYZSBGED-UZLBHIALSA-N 396.922 5.368 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c2[C@H](C)C1 411024021 YZGIMSCUTLKAEC-VXGBXAGGSA-N 394.525 5.076 30 20 GKED CC1(C)[C@H](c2ccccc2)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 422209305 UJRKFHCTCGYPKT-FCHUYYIVSA-N 375.516 5.399 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ncc(C(F)(F)F)s1 425363132 AXXZOMVVIDWLAB-SNVBAGLBSA-N 393.356 5.095 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 426325777 WFLYXIXYTULJSF-CQSZACIVSA-N 395.915 5.982 30 20 GKED CCCOc1ccc(Cl)cc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 429342503 ZJRMDBPHOOKZSU-CQSZACIVSA-N 382.769 5.033 30 20 GKED Cc1c(NC(=O)c2cccc(C(F)(F)F)c2F)cccc1OCC(F)(F)F 429798935 LUDUFGIHHGUEAQ-UHFFFAOYSA-N 395.274 5.346 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@H]1c1cccnc1 432754511 KYYZZEXGYAYKKW-QFIPXVFZSA-N 398.466 5.361 30 20 GKED N#C[C@@H](NC(=O)c1c(Cl)cc(F)cc1Cl)c1cccc(C(F)(F)F)c1 432991441 JYDLJGOXBXDBMD-CYBMUJFWSA-N 391.151 5.146 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)N(Cc1cccs1)Cc1cccs1 433231873 ZBWIROIIRGGUCZ-SFHVURJKSA-N 380.538 5.111 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1c(-c2ccc(Cl)c(Cl)c2)noc1C 435705266 MTHJFCFTSRXNEG-UHFFFAOYSA-N 386.238 5.389 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C1CC1)[C@H](C)C1CC1 437834031 CGNQBCZQQQSWAU-MRXNPFEDSA-N 375.472 5.454 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)c2cc(C#N)oc2C)n1 439117601 ZUYLAPZZSYWLRI-UHFFFAOYSA-N 389.889 5.282 30 20 GKED Cc1cccc(NC(=O)[C@H](C)SCc2ccc(C#N)cc2OC(F)F)c1C 439526589 IEVLRFMMWWREMT-AWEZNQCLSA-N 390.455 5.037 30 20 GKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ncc(-c2ccccc2)o1 439557001 JJNDSIJPDKNCJG-GOSISDBHSA-N 395.462 5.965 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cc(Cl)c(Cl)cn3)c2)cc1 443962483 SJVSMPITSRGUBV-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(c2cccc(Cl)c2)C1 454753808 NKFYVXXKEGFJNC-CQSZACIVSA-N 385.920 5.223 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1Cl 461046292 PFFMZCOECCTPHN-INMHGKMJSA-N 379.674 5.131 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3SCCc4sccc43)c2)cc1 463881420 VGUJYQSGVKDEPY-FQEVSTJZSA-N 392.505 5.381 30 20 GKED CCCN(C(=O)NCc1cc(C#N)ccc1F)[C@@H](C)c1cc2ccccc2o1 466201119 XEAAZCUVKDOMDB-HNNXBMFYSA-N 379.435 5.126 30 20 GKED Cc1cc(NC(=O)c2cn(CCCC#N)c3ccccc23)ccc1OC(C)C 469452662 PVYGWHKUOVNHBC-UHFFFAOYSA-N 375.472 5.293 30 20 GKED N#C[C@H](NC(=O)c1cc(F)ccc1-c1ccoc1)c1cccc(C(F)(F)F)c1 471087093 RBXIEVGWMUKJGT-SFHVURJKSA-N 388.320 5.099 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cs2)c(C)c1 474422847 XGSNKZMODAJNNK-OAHLLOKOSA-N 381.526 5.497 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480244301 ALTURFOTAZINCW-HNNXBMFYSA-N 377.469 5.165 30 20 GKED CCc1cnc(CN(C)C(=O)c2ccc(Sc3ccccc3C#N)cc2)s1 480479922 WJKSDETVIAUVTH-UHFFFAOYSA-N 393.537 5.001 30 20 GKED N#CCCC[C@H](NC(=O)CCc1ccc(Cl)c(Cl)c1)c1ccccc1 487455937 PLUJFZFSZMRMTE-IBGZPJMESA-N 375.299 5.477 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 490251969 TZDGUSGWIIJXPU-XMSQKQJNSA-N 395.572 6.250 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1COCc1ccccc1 490821495 FYJKOQOZSGMUOU-UHFFFAOYSA-N 390.483 5.259 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H]2CCCC(F)(F)C2)cc1 500816833 PWXSKBXZSAJLAF-OAHLLOKOSA-N 386.398 5.123 30 20 GKED CCCC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(OC)cc1 503794947 KJDIQFDOZWLEBS-HSZRJFAPSA-N 391.515 5.172 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 505326774 XDIHPIWPXSFXHM-FOIQADDNSA-N 385.508 5.739 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1 505344817 QIGOTIVMFVDZBE-CQSZACIVSA-N 385.703 5.363 30 20 GKED N#C[C@@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc(Cl)cc1 505797641 WVIORLGUPNFYPG-UEWUEVEISA-N 396.840 5.170 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 510482738 RFVXPOPZFHZMIB-UHFFFAOYSA-N 390.436 5.510 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc(C#N)cc1[N+](=O)[O-] 511416221 RVTHLEHDDHZOEM-LLVKDONJSA-N 382.420 5.211 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc(COc2ccccc2C#N)o1 515646874 BVCNGPGPCFSQSU-OAQYLSRUSA-N 388.467 5.344 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 518256156 NWSLNXCMGZDBTP-VLIAUNLRSA-N 399.947 6.007 30 20 GKED CC(C)C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 518265632 ZJEBBFBWOPUTHN-KRWDZBQOSA-N 378.476 5.036 30 20 GKED Cc1cc(Br)ccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 518709233 NSRNPCNERZMRSE-AWEZNQCLSA-N 398.087 5.059 30 20 GKED CC(C)[C@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 518885680 NNSMJPQYRFTZHN-PZJWPPBQSA-N 381.907 5.648 30 20 GKED CCc1nc2ccccc2c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C 521733472 HKDYOEHHMFSINK-HNNXBMFYSA-N 389.524 5.610 30 20 GKED COc1ccc(CN[C@H]2CCCC[C@@H]2c2ccccc2)cc1OCCCC#N 521830577 KSSLDACUTIEGNW-YADHBBJMSA-N 378.516 5.194 30 20 GKED CCOc1ncccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522575013 MXNDCLZUKMFXSW-UHFFFAOYSA-N 393.830 5.050 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)N(Cc1ccccc1)Cc1ccccc1 525081891 UZWAVEQKPYIDJE-IBGZPJMESA-N 386.520 5.268 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc(Oc4ccccc4)ccn3)n2)cc1 525822579 QAULRBLKGSTLNA-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#Cc1c(NC(=O)c2cccc([C@@H]3CCOC3)c2)sc2c1CCCCCC2 534913413 QGZIBKLNJFICDH-QGZVFWFLSA-N 380.513 5.035 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 543618754 VUNHFOHAVOYKJU-BIELFDCTSA-N 378.491 5.040 30 20 GKED COc1ccc(Oc2ccc(CN[C@@H](CCCC#N)c3ccccc3)cc2)cc1 552082900 IONDSVCXVWWXKA-VWLOTQADSA-N 386.495 6.012 30 20 GKED Cc1ccc2nc([C@@H]3CCCN3C(=O)Nc3ccc(C(C)(C)C#N)cc3)[nH]c2c1 554536637 HFQMORCABRHKBI-FQEVSTJZSA-N 387.487 5.042 30 20 GKED CC(C)Cn1ncc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1C1CC1 557973578 UJIHQWVNIAONPG-UHFFFAOYSA-N 399.498 5.284 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN1CC(C)(C)[C@@H]1c1cccs1 558175800 JUXFMBRNAZHDQG-QRWLVFNGSA-N 399.585 5.021 30 20 GKED N#Cc1cccc(C2(N[C@@H]3CCCc4nc(-c5ccc(F)cc5)sc43)CC2)c1 563800252 IDZFNPLOVAITRC-HXUWFJFHSA-N 389.499 5.477 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1OC(C)C 564368532 IRGBVHMYMXLKCR-UHFFFAOYSA-N 385.895 5.443 30 20 GKED N#Cc1csc(CNc2cc(C(F)(F)F)ccc2SCC(F)F)n1 574004989 UCSYKCUXNLFZLQ-UHFFFAOYSA-N 379.379 5.003 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(F)(F)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 574093126 DKXHBENVIKKXEJ-BBRMVZONSA-N 390.396 5.399 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)NCC(C)(C)CCC#N)o2)cc1 580917432 BYPNXNOJNGIJJI-UHFFFAOYSA-N 387.483 5.377 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCCC[C@H]3c3ccccc3)cc2)ccn1 589363737 HSTYTIBQDNEEFN-QHCPKHFHSA-N 398.466 5.505 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1N(C)Cc1ccccc1 590141084 LREAQCRBRPAWMI-UHFFFAOYSA-N 391.540 5.605 30 20 GKED CCSc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 590208089 NBYQYBMTAWTQCX-HNNXBMFYSA-N 399.928 5.461 30 20 GKED C[C@@H](CSc1ccccc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 593157120 GFNLQNDZWYMZGI-DLBZAZTESA-N 399.585 5.725 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 595453582 QFVJMHGNXXNJLY-NSHDSACASA-N 394.347 5.173 30 20 GKED N#CCC[C@H](N[C@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598677947 LSLRPOPBRZRHFT-DLBZAZTESA-N 379.248 5.390 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1coc(-c2cc(Cl)cc(Cl)c2)n1 600929431 DNEJLPBWXFYUNK-VWLOTQADSA-N 399.343 5.617 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cccc(CC#N)c3)cc2Cl)n1 608874248 HWFQVFXLXQFNIH-UHFFFAOYSA-N 399.928 5.575 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 609398769 PJKZBGVCZYKSPC-XLIONFOSSA-N 381.545 5.943 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccccc2c1Cl)c1cccc(Cl)c1Cl 609414108 KMSSEAQYIYBMDL-ZDUSSCGKSA-N 378.646 5.123 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC2CCCC2)cc1 609427491 DSGMXPAFRVPCKY-INIZCTEOSA-N 380.513 5.655 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cccc(Oc4nccs4)c3)c2C#N)C1 609910967 VWUQOHQLPADLMQ-GFCCVEGCSA-N 395.509 5.246 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)C1CC1 609929639 IAARPCDVNKSYOO-JXFKEZNVSA-N 379.529 5.081 30 20 GKED N#CCN(C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)C1CCCC1 609976968 SQGOELUMRBYMHN-UHFFFAOYSA-N 388.389 5.406 30 20 GKED C[C@@H](NC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)c1cccc(C#N)c1 610363134 ULFBPFOHQRXVAP-OAHLLOKOSA-N 399.475 5.433 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H]3c3cccc(F)c3)cc2)c1 611049355 SAUAAMZHNAEHRC-JOCHJYFZSA-N 387.414 5.469 30 20 GKED COc1cc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)ccc1OCC(C)C 614179835 OKZOYLGFAKDUPA-SFHVURJKSA-N 380.532 5.382 30 20 GKED CCc1ccc([C@@H](NCc2ccc(C#N)c(Cl)c2)c2ccc([N+](=O)[O-])cc2)o1 619755875 XCDBKFBIRABOHX-NRFANRHFSA-N 395.846 5.154 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CC1)C(F)(F)C2(F)F 650154277 HTLCFANPMNCQRP-UHFFFAOYSA-N 384.417 5.437 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1 732015724 BUUJSJXNHMYMDP-UHFFFAOYSA-N 392.842 5.074 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)c2ccc(C(C)C)cc2)c1 733847707 PSDPFGVDAONAHS-OAQYLSRUSA-N 393.531 5.225 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 734206409 ZNSAAVMYUWBMNN-CVDCTZTESA-N 375.516 5.632 30 20 GKED C=CC[C@@H](NC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccncc1 734460950 SXLZFQXWDWYMAF-OAQYLSRUSA-N 392.886 5.214 30 20 GKED N#Cc1cccc(CN(Cc2ccc(Cl)cc2)c2ccc3nc(O)[nH]c3c2)c1 735873264 GXSKHZDKQUZLFW-UHFFFAOYSA-N 388.858 5.000 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@@H](C)c3cccc(C(F)(F)F)c3)[nH]c12 739190610 IIKBAIYWXQILND-CJNGLKHVSA-N 385.389 5.260 30 20 GKED CC(C)(C)c1ccccc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740431542 UUXQAYVXUCNMAA-UHFFFAOYSA-N 389.524 5.906 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccc(CC#N)cc2)c(Cl)c1 740776962 QFIGYYVJHOKGAJ-UHFFFAOYSA-N 385.851 5.005 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1ccc(SCC(F)(F)F)cc1 741757754 YVIRBWSGQSNKTR-UHFFFAOYSA-N 397.319 5.129 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1cnc(-c2ccc(C)cc2)s1 741842336 RWTSIBXQAQEMMX-KHPPLWFESA-N 397.471 5.179 30 20 GKED Cc1cccc(F)c1CNC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 743140349 APRMRCGHALYAMV-UHFFFAOYSA-N 375.403 5.120 30 20 GKED Cc1ccc(C(=O)Nc2sc(C)c(C)c2C#N)cc1NC(=O)OC(C)(C)C 744352690 OBNCOTMFIQBFLM-UHFFFAOYSA-N 385.489 5.144 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)NCc2ccc(OC)c(C#N)c2)c(C)c1 747275555 OYSAREJAZDLLSO-HNNXBMFYSA-N 383.517 5.088 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cc(Cl)ccc2OC(F)F)cc1 748440501 LPDUSTUORFJOHF-WNPFHQFXSA-N 377.774 5.128 30 20 GKED CC(C)[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(C(F)(F)F)cc1 748562322 FJSWETIAVGGZQQ-SFHVURJKSA-N 391.393 5.127 30 20 GKED C=CCC[C@H](NC(=O)Cc1ccccc1NC(=O)OC(C)(C)C)c1ccccc1 756013933 QCWZALFDGVZORJ-FQEVSTJZSA-N 394.515 5.400 30 20 GKED C#CCCCCC(=O)N(Cc1ccc2ccccc2n1)c1ccc(N(C)C)cc1 776341816 MPXKGHDOUXMFCU-UHFFFAOYSA-N 385.511 5.028 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCCC(C)(C)C#N 776378545 KHICKSOKBQJHLL-ZDUSSCGKSA-N 392.908 5.100 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)Nc1ccsc1 790314479 NSUPOVPKZFTYGP-UHFFFAOYSA-N 379.510 5.316 30 20 GKED N#C[C@@H](C(=O)CCSCc1ccccc1)c1nc(-c2ccccc2)cs1 796642754 HOKRFHMCAAWTAL-SFHVURJKSA-N 378.522 5.310 30 20 GKED CCN(c1ccc(NC(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc1)C(C)C 809278191 NTDNPOVXOGVZDC-SFHVURJKSA-N 378.520 5.408 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)o2)c1 814311009 DRLDNNAEUSDBCT-UHFFFAOYSA-N 386.329 5.120 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccccc1C(F)(F)F 819440544 SIHDYWPMLGDXOL-CXAGYDPISA-N 380.435 5.245 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(SC)ccc2Cl)c1 824478969 PXDJKEZNOYNLEJ-AWEZNQCLSA-N 389.908 5.065 30 20 GKED CC(F)(F)C(C)(C)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835072287 CTDYYBILIMZKKY-SECBINFHSA-N 376.350 5.173 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 847433395 BSJAZOGOWCJLNN-QRWLVFNGSA-N 386.417 5.119 30 20 GKED Cc1[nH]c2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2c1C 915088423 QIXCNFAPJSQMIG-QHCPKHFHSA-N 379.463 5.693 30 20 GKED N#C[C@H](C(=O)CSCc1cccc(Cl)c1)c1nc(-c2ccccc2)cs1 915101699 GTGLELIRRNFNMN-QGZVFWFLSA-N 398.940 5.573 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(-c2c(F)cccc2F)cc1 1776050715 WYAATSIMGVEBCM-UHFFFAOYSA-N 396.393 5.175 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4cccc(C(=O)O)c4)s3)coc12 1777449102 VGTAFAZZDOXDBU-CSKARUKUSA-N 388.444 6.064 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C/c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1777566926 XSJOCJGAZNADGI-ATVHPVEESA-N 385.444 5.197 30 20 GKED C#CCCC(=O)NC1(c2ccc(NC(=O)CC3CCC(C)(C)CC3)cc2)CCC1 1790570386 DESPPZQIQAGMNN-UHFFFAOYSA-N 394.559 5.140 30 20 GKED CCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@H](C)c1ccc(C#N)cc1 45501074 BWSHPLKWJWZDBO-GOSISDBHSA-N 397.478 5.034 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1OC1CCCC1 48824129 SFNSBFMLAJWXMD-INIZCTEOSA-N 392.480 5.116 30 20 GKED N#CCc1cccc(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c1 49620947 DLKFFZAGUMVMGF-UHFFFAOYSA-N 395.915 5.036 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(OCc2cccnc2)c1 56630112 SIGBEEDIVOIVFD-UHFFFAOYSA-N 391.446 5.020 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCOc1ccccc1-c1ccccc1 62905326 IGSBRYLRVXKJMG-UHFFFAOYSA-N 396.490 5.209 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)COC3)cc1Cl 64390793 XTDPUBJDKCLSOV-OAQYLSRUSA-N 388.854 5.278 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccccc1Br 66802229 APHSNXDPTIKSOL-CYBMUJFWSA-N 389.318 5.025 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2F)on1 66802260 PADBXEIVGOXPQK-ZDUSSCGKSA-N 381.432 5.127 30 20 GKED CCOc1cccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66954729 KCISPPUCLGMBAG-CVEARBPZSA-N 383.517 5.362 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c2c1 108238885 FOIGNTWJCAGDLV-ZDUSSCGKSA-N 380.469 5.254 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108528568 KQOZOLJETDYFIK-YLJYHZDGSA-N 379.529 5.616 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 112738206 DUZZAISTMHAHFF-DYESRHJHSA-N 381.545 5.799 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)n1 125031462 CTNQSMXJXDYCAT-BEFAXECRSA-N 380.517 5.011 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 128086169 CDFGVUXLZDBNOQ-QGZVFWFLSA-N 377.856 5.181 30 20 GKED COc1ccc(CNc2ccc(-c3nccs3)cc2)cc1OCCCC#N 156166298 CUJACRKWMGBNGM-UHFFFAOYSA-N 379.485 5.113 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)[C@H]1c1ccc(C(F)(F)F)cc1 156547401 XYZOCPKIRRQZEX-AUUYWEPGSA-N 387.405 5.386 30 20 GKED N#C[C@@H](C(=O)c1cccc2cc[nH]c12)c1nc(-c2ccc(Cl)cc2)cs1 173988637 PXLMBHDVVTVBCD-INIZCTEOSA-N 377.856 5.435 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1 176517956 LIPPRWCXEHRODR-SFHVURJKSA-N 394.459 5.076 30 20 GKED CSc1ccccc1C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 195644134 OPTXYNJILCPQIN-UHFFFAOYSA-N 390.483 5.262 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1Cl 303278338 JJLGSKMEHICRGV-UKRRQHHQSA-N 388.920 5.306 30 20 GKED CN(C(=O)C1CCC(/N=C(/O)CC2CCCCC2)CC1)c1ccc2cc[nH]c2c1 329927842 LXWADMHXEHNEKH-UHFFFAOYSA-N 395.547 5.616 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c2[C@@H]1C 410988907 TWPSDBQSHRQPNE-NWDGAFQWSA-N 394.525 5.076 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)c1c(C)noc1C 430410150 VQXJGXNOLZWDOC-UHFFFAOYSA-N 389.455 5.180 30 20 GKED C=CCn1c(SCc2nc(C3CCCCC3)cs2)nnc1-c1cccnc1 435687082 CHMOUUOIIHQVIE-UHFFFAOYSA-N 397.573 5.323 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1 437108948 PMMXMFMFVZMABG-NHCUHLMSSA-N 379.529 5.048 30 20 GKED Cc1cc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)ccc1OC(C)C 438405646 WYJBKUAWLBMBSB-SFTDATJTSA-N 377.488 5.086 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)c(Br)c1)c1ccccc1 439477435 KKDABVXEOUTROZ-INIZCTEOSA-N 392.684 5.269 30 20 GKED N#CCC[C@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccccc1 440037161 LBMPFDYPACAICW-FHSBBHSISA-N 390.449 5.297 30 20 GKED N#CC1CCC(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)CC1 441328974 JKLKILRUAYKAOF-UHFFFAOYSA-N 384.527 5.018 30 20 GKED C[C@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)c1c[nH]c2ccccc12 447356556 FTQBRNYOFPAMGZ-QGZVFWFLSA-N 383.451 5.360 30 20 GKED N#CCCC[C@@H](NC(=O)N(C1CC1)[C@H]1CCCc2ccccc21)c1ccccc1 458798375 HYXDOGGPPCUWJX-RPWUZVMVSA-N 387.527 5.673 30 20 GKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 458853660 WXXAJBMJVMWREP-FGTMMUONSA-N 381.442 5.184 30 20 GKED C=CCn1c(SCc2cncc(C(F)(F)F)c2)nnc1-c1cccc(C)c1 460880592 KLRBOPZXSUDZTM-UHFFFAOYSA-N 390.434 5.146 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)c1cccc(C#N)c1 461926658 QEQFZHUKNQOUTE-KRWDZBQOSA-N 381.435 5.273 30 20 GKED C[C@@H](C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 463242965 PCJBODDMVPMEQH-OSPHWJPCSA-N 380.447 5.314 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H](C#N)C(C)(C)C 464706943 CSEFUGFPLYVANH-ZDUSSCGKSA-N 394.302 5.440 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1cccs1 465728826 XFPJSUYPTFQBQA-UFYCRDLUSA-N 381.545 5.317 30 20 GKED CCOc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c2ncccc12 469802240 VKGWCGYUEAFKAQ-UHFFFAOYSA-N 398.466 5.144 30 20 GKED CC(C)CN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)CC(C)(C)C 474221943 VUTOEDXKMWNENU-KRWDZBQOSA-N 375.582 5.023 30 20 GKED CCN(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H](C)c1cccc(C(F)(F)F)c1 475365869 FPPSSZXKCFHKBK-LPHOPBHVSA-N 388.433 5.702 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2cccc(OC)c2)CC1 475546581 MHEMTHMINXAALD-UHFFFAOYSA-N 390.527 5.868 30 20 GKED CC[C@@H](CN(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 480564794 SBRDFRUWYAIXHT-MOPGFXCFSA-N 395.572 6.128 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2coc3ccccc23)cc1 488837337 LBVBFAKWFWVEKQ-UHFFFAOYSA-N 398.487 5.527 30 20 GKED N#Cc1ccc(Br)c(CSCc2nc(C(F)(F)F)cs2)c1 491977865 IZZONZCVSHJYDA-UHFFFAOYSA-N 393.253 5.229 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 495535167 OJSJTCOWBNEQHX-UHFFFAOYSA-N 399.237 5.177 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3ccccc3C(C)C)n2)cc1 505777296 OJWMMVFWDQMGHO-SFHVURJKSA-N 375.497 5.488 30 20 GKED Cc1nccn1-c1ccc([C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1 507619744 XATTXFCFAMLCPZ-ZUNDZUCBSA-N 384.527 5.236 30 20 GKED Cc1c(C(=O)N2CCC(F)(c3ccccc3)CC2)sc2ccc(C#N)cc12 509094559 BGVNBXRBYFKOAP-UHFFFAOYSA-N 378.472 5.182 30 20 GKED Cc1ccccc1[C@@H](C)NC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 511515567 WMDMSDFQTIZATN-QGZVFWFLSA-N 398.466 5.002 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1 515136136 UEHIUYUOUDBDQG-UHFFFAOYSA-N 377.419 5.233 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccccc3F)s2)sc2c1CCCC2 518648237 RMYKBLVOYTYRIR-UHFFFAOYSA-N 383.473 5.013 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519029266 CAGYQZCJWBOPJU-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)COc3ccccc3Cl)cc2)c1 519512280 XWZCURRBDJBCLG-UHFFFAOYSA-N 378.815 5.021 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1cc2ccccc2o1 523531216 PVNSNJNRUPNGES-UHFFFAOYSA-N 398.487 5.428 30 20 GKED C=CCN(C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C)C1CC1 536815450 ODEVUARVBQVSBR-UHFFFAOYSA-N 394.544 5.148 30 20 GKED CCN(C(=O)c1cc(C(C)C)n(-c2ccccc2)n1)c1ccc(C#N)c(Cl)c1 540274076 AGOQKUGWLIWMAM-UHFFFAOYSA-N 392.890 5.187 30 20 GKED C[C@@H](NCc1cnn(-c2ccccc2)c1)c1ccc(-c2cccc(C#N)c2)cc1 542186267 UKEKOYIHKCBRQF-LJQANCHMSA-N 378.479 5.262 30 20 GKED N#CCc1ccc(CN2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)cc1 542281005 QIEBCMILNDHKPA-UHFFFAOYSA-N 389.326 5.241 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 542881760 LBVXEAFOMXNTLL-VGSWGCGISA-N 378.472 5.130 30 20 GKED CC(=O)Nc1ccc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 543034853 VVCZAEUYBPBKFF-QZTJIDSGSA-N 383.495 5.595 30 20 GKED C=CCC[C@@H](NC(=O)Cc1ccc2c(c1)COC2)c1ccc(C(F)(F)F)cc1 543457054 IRTCXPZXOMHBPA-HXUWFJFHSA-N 389.417 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(C(=O)Nc2ccccc2)c1 552472882 NQSIDNQDJQWMAD-UHFFFAOYSA-N 398.506 6.043 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(-c2ccc(OC)nc2)ccc1C 555035158 LKUFCSQRWUJONI-UHFFFAOYSA-N 393.512 5.347 30 20 GKED CCC[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)c1ccccn1 555559434 NFFDVHBECPIWKO-JOCHJYFZSA-N 399.494 5.363 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 563655143 GGTCQRSXDZKWDC-INIZCTEOSA-N 389.480 5.112 30 20 GKED Cc1ccc(Br)cc1-c1noc(C[C@@H](CC#N)c2ccccc2)n1 570171785 VOKCLCJIYSVGHR-OAHLLOKOSA-N 382.261 5.048 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC=C(c3ccco3)C2)cc1 584830717 NRJYYTMVUMLDKP-UHFFFAOYSA-N 384.435 5.182 30 20 GKED N#C[C@@H](C(=O)c1cc2c(Cl)cccc2s1)c1nc2cc(F)ccc2s1 592974574 ULCCZGCOMYAOMN-NSHDSACASA-N 386.860 5.794 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CCc2ccccc21 593159108 JPSCNEZURDRCHI-IAGOWNOFSA-N 379.529 5.132 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(O[C@H](C)c2ccccc2)cc1 595683639 XBPMIZHPHPWHKH-NHCUHLMSSA-N 392.543 5.578 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 598841747 HEYABYMHTZBTHJ-GFCCVEGCSA-N 382.332 5.046 30 20 GKED N#Cc1csc(CN[C@@H]2CCCSc3ccc(Br)cc32)c1 598997062 UJXZWZIHFXNNGX-OAHLLOKOSA-N 379.348 5.099 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(OC2CCCC2)c1 608915616 PXUMZLQVFHULJW-UHFFFAOYSA-N 377.488 5.322 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c(C)s1 609061447 CHMQPENAFBRQQI-UHFFFAOYSA-N 376.481 5.376 30 20 GKED N#Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1F 609103140 QFXSOUWYBJHORL-UHFFFAOYSA-N 393.399 5.009 30 20 GKED CCN(C(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 609432395 JCSMSFQLCONXAX-GOSISDBHSA-N 385.467 5.204 30 20 GKED CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609439025 SNRYWOJJEDMEPX-PKOBYXMFSA-N 381.545 5.614 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)c1 619350906 PKVYXRIRZIIXDY-MRXNPFEDSA-N 393.512 5.273 30 20 GKED Cc1cc(Br)cc2c1[C@H](NCc1ccc(C#N)c(Cl)c1)CC2 619755766 RWUFUVBVOXXYDA-QGZVFWFLSA-N 375.697 5.060 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)c1 730437257 GAFHJRYEWWPDSY-DEOSSOPVSA-N 398.531 5.069 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)Cc1ccccc1Cl 731115315 DJGYMUWUNYFOEH-HUUCEWRRSA-N 387.936 5.344 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 732903320 UFRDMNHZHHMCCQ-JKSUJKDBSA-N 396.462 5.533 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)c1 733789911 YSJVWSLTHNXGRW-LJQANCHMSA-N 389.499 5.076 30 20 GKED CCc1ccc([C@@H](NC(=O)NCc2cccc(O[C@@H](C#N)CC)c2)C(C)C)cc1 733806547 JXSUEXCTMNQERI-GGAORHGYSA-N 393.531 5.126 30 20 GKED C=CC[C@H](NC(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680199 NVQBTQDIVCUSPF-KXBFYZLASA-N 391.437 5.510 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3ccc(Cl)cc23)cc1 739511749 MNFFMIDVYQCSQW-QFIPXVFZSA-N 399.881 5.658 30 20 GKED Cc1c(C(=O)/C=C/c2cnc3ccc(Br)cn23)oc2ccccc12 740764885 JIGQGGHGHIQQKA-BQYQJAHWSA-N 381.229 5.048 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCc2c[nH]c3c(C)cccc23)c1 741557752 YHPIZCDUNJWCPG-UHFFFAOYSA-N 382.463 5.217 30 20 GKED CCOc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc(Cl)c1OC 741842795 BZDLXGQLLKATRL-PLNGDYQASA-N 397.283 5.006 30 20 GKED C#CCCCNC(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 743183629 DASLAFVOHDGUDE-UHFFFAOYSA-N 392.478 5.267 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(Cl)c(Cl)c1 747117433 QHUOBTXKSLZJHX-CABZTGNLSA-N 393.270 5.722 30 20 GKED O=C(c1csc(-c2cccs2)n1)N1CCCSC1=Nc1ccccc1 747459213 NCCLBMPWPHYSAI-UHFFFAOYSA-N 385.539 5.138 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@@H](C)c1ccc(C#N)cc1 749064934 VJENVETUSBHDGK-HNNXBMFYSA-N 392.480 5.373 30 20 GKED N#Cc1ccc(/C=C2/CC3(CCOCC3)C/C(=C\c3ccc(C#N)cc3)C2=O)cc1 751517245 KDPPXGOZHQBTAE-NQGGHMMCSA-N 394.474 5.057 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C/c2ccc(Cl)nc2)cc1 758652202 HZDLXJKGNALEDN-WUXMJOGZSA-N 375.815 5.051 30 20 GKED C=CC[C@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccncc1 766018072 FTQFMWFPNDDCGP-OALUTQOASA-N 379.504 5.629 30 20 GKED C#CCCCCCC(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 772824758 WBAGXOVAIWFPQQ-SFHVURJKSA-N 396.556 5.108 30 20 GKED Cc1ccc2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)ccc2n1 773020705 LPPWZWTYFOONIO-QHCPKHFHSA-N 377.447 5.451 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(Br)c1 774130706 NMFBXJXOGXSOBB-AWEZNQCLSA-N 391.334 5.147 30 20 GKED CCCN(C(=O)Cc1ccccc1CC#N)[C@@H](C)c1ccccc1Br 776825170 UTRFTYINPISBOS-INIZCTEOSA-N 399.332 5.057 30 20 GKED CCOc1c(Cl)cccc1/C=C1\SC(=Nc2c(C)cccc2C)NC1=O 779753005 UEYWMWZSPWXBAO-WJDWOHSUSA-N 386.904 5.247 30 20 GKED N#C[C@@H](C(=O)[C@@H](Oc1ccccc1)c1ccccc1)c1nccc2ccccc12 792102870 IHILSEDDFPYHHK-RDGATRHJSA-N 378.431 5.231 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 793279809 ALUHVSOLVTWKJW-OXJNMPFZSA-N 396.412 5.699 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2nc3cc(Br)ccc3o2)c(F)c1 794740190 TUGMSCNPFDJIDW-WUXMJOGZSA-N 377.600 5.338 30 20 GKED N#CC[C@@H](CC(=O)OCc1nc(-c2c(F)cccc2F)cs1)c1ccccc1 795982442 QAUHRXIAONZEJL-HNNXBMFYSA-N 398.434 5.219 30 20 GKED COc1ccc(SCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797569661 UPCRVVGGTWNLPO-MRXNPFEDSA-N 388.558 5.198 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C[C@H]3CCC(F)(F)C3)cc2F)c1 797856889 QVQJDUBQDRSSNA-CQSZACIVSA-N 388.389 5.040 30 20 GKED Cc1nc(C(F)(F)F)ccc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801709374 NWRJMEXPAJCGKJ-ZDUSSCGKSA-N 380.263 5.077 30 20 GKED Cc1sc2ncn(N=Cc3ccc(-c4ccccc4Cl)s3)c(=O)c2c1C 874041589 AIRWAZOOUBVYBU-UHFFFAOYSA-N 399.928 5.339 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(COc2cccc(F)c2)no1 904720462 LIJKUULCSVYBMF-UHFFFAOYSA-N 394.324 5.038 30 20 GKED Cc1ncsc1C(=O)/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1 915054322 YYIDYPPJZUWTHF-KTKRTIGZSA-N 382.872 5.253 30 20 GKED CCCCCCCC(=O)Nc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1 915650786 FBPIJGZUDDBDQS-UHFFFAOYSA-N 386.467 5.386 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2ccc(Cl)cc2Cl)cc1 916546055 CRIJUHUHSKXVTM-UHFFFAOYSA-N 397.718 5.413 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccc2ccccc2n1 916849622 WBZRLSZHSRELIO-XEDBTPMOSA-N 398.462 5.992 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2csc(CC)n2)cc1OCC 920399162 LTPKVXQVIOXAOD-UHFFFAOYSA-N 382.913 5.097 30 20 GKED N#Cc1ccc(COC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)cc1 921225176 SFGRCVQKMLPEDZ-UHFFFAOYSA-N 389.263 5.346 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776339890 MYJXGMVBZHCKKK-VQHVLOKHSA-N 382.456 5.833 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(O)c2)cc1)c1ccccc1 1776469395 GJFSKJFZFRJHKX-WPMUKRGUSA-N 388.419 5.127 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(Cl)c(Br)c1F 1777436149 NFJZHVUYFXWWAQ-ALCCZGGFSA-N 397.627 5.144 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](C)c1ccc(F)cc1 57473241 HNEMNMLOTIMSLU-HNNXBMFYSA-N 389.430 5.325 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 60127417 PYAGFIBILLWBCP-GOSISDBHSA-N 385.467 5.407 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 66037303 ZJVCVSZXXRRXEG-UHFFFAOYSA-N 399.475 5.094 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](Oc2ccc(Cl)cc2)c2ccccc2)n1 68721863 FCAGSMVPHNDHOT-HKUYNNGSSA-N 382.872 5.102 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)ccc1OC 113308872 OXECDSILXZYQNE-KDOFPFPSSA-N 392.421 5.246 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1 120787597 PHSSOHVIYAKYCW-SJLPKXTDSA-N 378.501 5.247 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 163222434 GGHANCCUERBVLM-KRWDZBQOSA-N 397.544 5.532 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2CN2CCc3ccccc32)c1 175649712 GBGHTMFSBXWQSI-UHFFFAOYSA-N 399.519 5.117 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc(Cl)sc2Cl)ccc1OC 180812016 VUFRKMRBGVCRCE-AAEUAGOBSA-N 399.343 5.595 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CC1CCC(C(F)(F)F)CC1 183105402 PZUDFFLHVKNLRO-WLYUNCDWSA-N 384.467 5.636 30 20 GKED CCCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@@H](C)c1cc2ccccc2o1 184312016 BOIOOPWNOLNFOE-IRXDYDNUSA-N 391.471 5.729 30 20 GKED COc1ccc(CN[C@@H]2CCc3ccc(C(C)C)cc32)cc1OCCCC#N 189615977 MRWWGJHWNWSXPE-JOCHJYFZSA-N 378.516 5.278 30 20 GKED C=CCC(CC=C)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 191743973 UWHNRNSLYCQLST-UHFFFAOYSA-N 396.556 5.293 30 20 GKED C=C(C)COc1cc(CNc2ccc(NC(=O)CC(C)C)cc2)ccc1OC 237191408 KXWWKDUKKKJRQW-UHFFFAOYSA-N 382.504 5.247 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1ccoc1C(F)(F)F 292189040 GXVAHVYGXLKCLN-UHFFFAOYSA-N 385.235 5.021 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(Oc2snc(Cl)c2C#N)cc1 301967264 WJKQIJYYIFGTLW-UHFFFAOYSA-N 375.862 5.083 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(SC)c(OC)c3)cs2)c1 303021089 LTQZDXRJMUTLBY-CMDGGOBGSA-N 397.521 5.445 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1Cl 303281866 KIFLDYLQCXRBAF-ZIAGYGMSSA-N 390.961 5.711 30 20 GKED C[C@H](Oc1ccc(-c2ccc(C#N)cc2)cc1)c1nc(Cc2ccccc2)no1 303954711 WTZUCDXZKMAWNX-KRWDZBQOSA-N 381.435 5.339 30 20 GKED Cc1ccc(N=C(O)[C@@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c(C)c1 328712096 RPPZTIAUPDUKOC-VGOFRKELSA-N 391.515 5.377 30 20 GKED Cc1ccc(-c2nc(C)sc2C/C(O)=N/[C@@H]2CCOC3(CCCC3)C2)cc1 330216986 NOBZPJOHSYECLV-GOSISDBHSA-N 384.545 5.418 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2)n1 430600723 IBGNLFDHNKESEI-HNNXBMFYSA-N 381.526 5.363 30 20 GKED COC(=O)c1cc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)oc1C 431120540 NNCXPEIBNDSGKH-CVEARBPZSA-N 388.467 5.325 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(-c2nccs2)cc1 437563367 XEWGIBOQHBUGTR-WOJBJXKFSA-N 388.496 5.114 30 20 GKED N#Cc1cc(Cl)ccc1CNc1cccc(C[S@@](=O)c2ccccc2)c1 442133977 WBCGCYVYGDUSKY-AREMUKBSSA-N 380.900 5.132 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)Nc1cccc(CC#N)c1)C1CC1 455917547 JXECZQZOFSGSRL-CQSZACIVSA-N 387.405 5.529 30 20 GKED COC1CCC(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 459235748 GFJAREVETGFIFP-NLPFYKDJSA-N 397.906 5.075 30 20 GKED Cc1ccc(-c2csc(Cc3noc([C@H](C)c4cccc(C#N)c4)n3)n2)cc1 461795182 JHTFWUDLORBCPC-OAHLLOKOSA-N 386.480 5.116 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(COc2ccccc2)cc1 464947494 FMBAMSBHQIBNCG-DQEYMECFSA-N 396.490 5.178 30 20 GKED Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 466955819 UWHCCCYWUYEDBN-SIKLNZKXSA-N 391.515 5.086 30 20 GKED Cc1ccc(-n2cc(C(=O)[C@H](C#N)c3nc4ccccc4o3)c(C(C)(C)C)n2)cc1 467429549 PACVRYLZTVPNOP-KRWDZBQOSA-N 398.466 5.110 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cccc(COC4CCCCC4)c3)o2)c1 471608598 FCFCFJNZJHRUIP-UHFFFAOYSA-N 388.471 5.070 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1c(F)cccc1Cl 477799359 HVQHPZREMNXGQD-OLZOCXBDSA-N 391.899 5.614 30 20 GKED C=C(CNC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 478899073 JLBRVJGGCCHEHE-IBGZPJMESA-N 399.494 5.013 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)[C@H](C)c1ccc(C#N)cc1 482409568 QIPCTRYZDAVWQK-GOSISDBHSA-N 395.462 5.446 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2c1 483227911 CNZLOMQPDSCVBE-JOCHJYFZSA-N 391.474 5.767 30 20 GKED N#Cc1ccc(NCc2ncc(-c3ccccc3Br)o2)c(Cl)c1 486579580 YDFOPHXJTXIICH-UHFFFAOYSA-N 388.652 5.241 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@@H]1[C@H]2Cc3ccccc3[C@H]21 494917747 BZWGTQXSNDEXGB-PQNGQFLHSA-N 396.515 5.025 30 20 GKED CC[C@H](CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)cc1 503018625 VPXOQGRYKUKHRO-DLBZAZTESA-N 382.529 5.612 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 503214713 DOPZAJMDFNOOPN-QUCCMNQESA-N 393.556 5.486 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCc2c([nH]c3c(F)cccc23)C1 505000617 HROZLBBTIJUBNA-UHFFFAOYSA-N 377.463 5.406 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 505060503 GFERFABSVNOBBR-NZQKXSOJSA-N 391.559 5.322 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCC2CCC(C#N)CC2)c1 508344966 FTXCXSQUNKZJER-UHFFFAOYSA-N 393.874 5.064 30 20 GKED N#Cc1ccc(CNc2nc(-c3cccnc3)nc3sc4c(c23)CCCC4)cc1 510110141 RHZBCBVUKFNXBA-UHFFFAOYSA-N 397.507 5.116 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2coc3ccccc23)cc1 512529356 RSPKUZOWQJKBHP-UHFFFAOYSA-N 383.407 5.418 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 513877927 HJSLOGCMJLVORT-UHFFFAOYSA-N 385.467 5.793 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C(=O)c1ccccc1)C(C)C 514563155 FYKNXXZZULMPNJ-JOCHJYFZSA-N 391.540 5.055 30 20 GKED COc1cccc([C@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 520197808 PZEOMLPTCQIZOR-INIZCTEOSA-N 387.439 5.242 30 20 GKED COc1cc(C(=O)Nc2ccccc2SCCC#N)ccc1OCCC(C)C 520807309 AEYHQEQHWJCDPB-UHFFFAOYSA-N 398.528 5.378 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(C#N)c(Cl)c2)[C@H](C)C2CC2)cc1 521804268 UECNMKGXNAKSOS-CQSZACIVSA-N 383.879 5.053 30 20 GKED CSc1cccc([C@@H](NCc2cc(C#N)cs2)c2cc(F)ccc2F)c1 537330266 WJVMSGPXQNTFNC-HXUWFJFHSA-N 386.492 5.499 30 20 GKED Cc1ccsc1CCNC(=O)c1ccccc1SCc1ccc(C#N)cc1 539102461 NCWWJMITMXDHQA-UHFFFAOYSA-N 392.549 5.193 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2ncc(-c3ccccc3)s2)CC1 539950735 NREDHGCISVLTRQ-UHFFFAOYSA-N 389.524 5.162 30 20 GKED COc1ccc(C(=O)Nc2sc3c(c2C#N)CCCC3)cc1OC1CCCC1 544058221 WLXLQFZZTUULFW-UHFFFAOYSA-N 396.512 5.081 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCSc1ccc(C)c(C)c1 554874092 OSMPXZJWCUGPMT-UHFFFAOYSA-N 382.916 5.244 30 20 GKED N#Cc1ccc(-c2nnc(CN3CC4(CCCCC4)[C@H]3c3ccccc3)o2)cc1 560599161 YRWXMBRMMSAVGP-JOCHJYFZSA-N 384.483 5.116 30 20 GKED N#Cc1csc(CNc2cccc(Oc3cccc(C(F)(F)F)c3)c2)n1 582330361 NHBTVJXNOCNWMW-UHFFFAOYSA-N 375.375 5.438 30 20 GKED Cc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1-c1ccncc1 590415507 HBCXHTNVGGXEOK-UHFFFAOYSA-N 382.250 5.488 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2 599728028 POYOAUWZAWOILN-IRXDYDNUSA-N 397.425 5.453 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H]2CCCC[C@@]21C 599742060 GFIOKJCRHASQDN-RDPSFJRHSA-N 389.499 5.242 30 20 GKED COCc1c(C(=O)N(Cc2ccccc2)c2ccccc2C#N)oc2ccccc12 603532633 RFHFKKQFWKSYGS-UHFFFAOYSA-N 396.446 5.298 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603828912 DCNZOJPWPRSZCM-OAHLLOKOSA-N 390.418 5.110 30 20 GKED CCN(C(=O)Nc1cccc(C#Cc2cccs2)c1)[C@H](C)c1cccc(O)c1 605409033 ZJHACPPJAHBIGO-QGZVFWFLSA-N 390.508 5.469 30 20 GKED C[C@@H](Nc1ncc(C#N)cc1Cl)c1cccc(NC(=O)c2ccccc2)c1 608886100 VJHQITZLRIVGQE-CQSZACIVSA-N 376.847 5.032 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(Cl)sc3Cl)c2)cc1 609176526 LJLRHAKMAFNQOR-UHFFFAOYSA-N 389.263 5.971 30 20 GKED CCN(c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1)C(C)C 609377116 PAKWUNVICLZIPE-KRWDZBQOSA-N 381.545 5.425 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 609501227 AZYGRZOXENZRKJ-UONOGXRCSA-N 375.255 5.006 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(Cl)nc2)cc1 727074682 NTFMOMQTMCCPDE-GOSISDBHSA-N 378.888 5.199 30 20 GKED Cc1ccc(NN=Cc2c(C)nn(-c3cccc(C(F)(F)F)c3)c2Cl)nc1 727259570 GUBSRAZDGAMGCV-UHFFFAOYSA-N 393.800 5.002 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 730982043 IMWKOZZZZNIBJC-UHFFFAOYSA-N 394.446 5.890 30 20 GKED CCc1oc2ccccc2c1C=NOCc1noc(-c2ccc(Cl)cc2)n1 731445413 AJDQJTUWBXEUIT-UHFFFAOYSA-N 381.819 5.249 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C\c3c(O)cccc3OC)s2)cc1 733750060 KUMUPEADZKUJLD-QGNWGPJTSA-N 382.485 5.021 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1ccccc1Oc1ccccc1)c1ccncc1 734665980 VOXLBJWSYKYHSI-PGRDOPGGSA-N 387.483 5.552 30 20 GKED CCOc1ccc(C#N)cc1NC(=S)Nc1ccc(OC(F)F)c(Cl)c1 735623538 LNIIXOTWUDOKIQ-UHFFFAOYSA-N 397.834 5.021 30 20 GKED CSCC[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 736958961 BMKNKHYPJVCDMT-KDOFPFPSSA-N 387.936 5.259 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)Nc1cccc(OCC#N)c1 736960946 UWPZDWPRHNFLEX-HXUWFJFHSA-N 391.496 5.064 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC3(CCCC3)C2)cc1Cl 743104927 KHWZHYCTEPWXBZ-HXUWFJFHSA-N 393.918 5.793 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCSc4ccccc43)n2)cc1 744036123 YADLWKRVUGDUDM-ZWKOTPCHSA-N 390.533 5.574 30 20 GKED CCOc1ccc(O)c(C=Nc2ccc(N3CCc4sccc4C3)cc2)c1 748586349 USYGDIPBSBOXIC-UHFFFAOYSA-N 378.497 5.166 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1CCC(C)C 749769338 OOPZBNOFWDWHRC-QFIPXVFZSA-N 386.499 5.145 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Oc3ccc(-c4cscn4)cc3)cc2)nc1 750751210 BYXHFSDOCDAHHN-UHFFFAOYSA-N 399.431 5.088 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc3ccc(C)cc3o2)ccc1OC 756040281 JBSMYIIEQXCPIE-VQIMIIECSA-N 378.472 5.282 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3nc(C)ccc3c2)cc1 759207544 CYDDWZMGIZVDFN-YCRPNKLZSA-N 385.467 5.018 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1cc(C(C)C)nc2ccccc12 790891574 PDVXCHBVMKRCGZ-UHFFFAOYSA-N 394.478 5.107 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccnc(C(F)(F)F)c3)cc2)cc1 808307861 FJHAOHLRGKTAJL-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1cc(C#N)ccn1)CC(C)(C)O2 811862168 CYJWQJGRYJELBH-KRWDZBQOSA-N 394.475 5.015 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC[C@@]1(C)CC1(Cl)Cl 836385550 HNQMXHZEQGUXQP-LRDDRELGSA-N 386.348 5.034 30 20 GKED C=CCN(C(=O)c1cc(Cl)nc(CC)c1)c1nc(-c2ccccc2)cs1 901348352 QGEYKGPZJQIDMJ-UHFFFAOYSA-N 383.904 5.254 30 20 GKED CCOc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1OC 915086651 MDGPWGOEDUHBAN-OAQYLSRUSA-N 386.451 5.002 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccnc1)c1cc2ccccc2o1 916138487 QYRQGWPYHUSYDF-SEYXRHQNSA-N 391.430 5.577 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)c1 916411361 RSLNSNSPQVWZAN-UHFFFAOYSA-N 392.842 5.074 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccc(Cl)cc2)cc1 916914337 YNYXOJSTXDUXIS-PCLFDXGNSA-N 380.875 5.043 30 20 GKED N#C[C@H](C(=O)CN1CCCCC[C@H]1c1ccccc1)c1nc2ccccc2s1 917155559 YZDPFOFLVLZJCA-QUCCMNQESA-N 389.524 5.090 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3[C@H](C=C(C)C)C3(C)C)n2)cc1 920139386 SQKIDSNZYLXOIJ-ZIFCJYIRSA-N 380.513 5.233 30 20 GKED C=CC(C)(C)CCCNc1c(C(=O)O)cnc2c(OC)cc(Cl)c(OC)c12 1776147397 JLBVSZCMFMEBIH-UHFFFAOYSA-N 392.883 5.008 30 20 GKED CCCOc1ccc2c(c1)C(=O)/C(=C\c1csc3ccc(C(=O)O)cc13)CO2 1776824619 UHEJDQZGNJQVTH-ZSOIEALJSA-N 394.448 5.047 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)c(Cl)c1 1777352337 MBRLQWHKIFGLOA-YFHOEESVSA-N 382.799 5.203 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2coc(-c3ccc(F)cc3)n2)n1 26529817 HGRJFIRPOZAQRD-UHFFFAOYSA-N 393.365 5.367 30 20 GKED Cc1ccc[n+](/C(C(=O)c2sc3ccccc3c2C)=C(/S)NC(C)(C)C)c1 55014112 DWMZIWAGZWQBQL-UHFFFAOYSA-O 397.589 5.133 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(Cl)cc2F)cc1 55823785 NVPKQPJWMDXRBX-UHFFFAOYSA-N 394.833 5.376 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66955751 NECKWYMCTBTBHZ-XLIONFOSSA-N 379.529 5.758 30 20 GKED N#Cc1ccc(/C=C\C(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 96316137 JMDDMLQOCOIUBN-LOJRPPCJSA-N 384.401 5.344 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 108408273 BFFVMNSLTJYCGY-IRXDYDNUSA-N 381.545 5.501 30 20 GKED CCCO[C@@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 109027630 PIDHZUGEKAJMGN-HXUWFJFHSA-N 393.487 5.164 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1cccc(OC(F)F)c1 113570104 PIPHJBGMIJTTSV-LBPRGKRZSA-N 377.416 5.184 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)ncc3Cl)cc2)c1 134132430 ZTPZDDBPDWBSAJ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171838694 DWPZSLHOTVPPJD-INIZCTEOSA-N 390.512 5.149 30 20 GKED Cc1ncc(CN(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 172230932 GBSQAAPZMMUBCB-UHFFFAOYSA-N 397.887 5.041 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)CNc1ccccc1S[C@@H](C)CC#N 178391466 CDAQMCJPASRQFE-MAUKXSAKSA-N 399.585 5.090 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(F)c(F)c1 186449245 FSPUGRYYEUYRAW-SZNDQCEHSA-N 385.458 5.217 30 20 GKED COc1cc(C(=O)/C=C\c2ccccc2OC(F)F)ccc1SC(F)F 214928213 BYZVTZBRZPADSM-VURMDHGXSA-N 386.366 5.507 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](COc2ccccc2F)c2ccccc2)cc1 237505345 YCGDNIFZCCFUIX-FDDCHVKYSA-N 390.458 5.026 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 255887253 REMJTSRRRHJUIO-LMRWQKIVSA-N 385.801 5.365 30 20 GKED N#Cc1c(NC(=O)c2cccc(F)c2Br)sc2c1CCCCC2 322926077 NEBMCDUYFSTRMM-UHFFFAOYSA-N 393.281 5.043 30 20 GKED Cc1ccccc1C1(C/N=C(/O)[C@@H]2CCCO[C@H]2c2ccnn2C)CCCCC1 329028578 AFXMGFGDVBHGCJ-DENIHFKCSA-N 395.547 5.055 30 20 GKED C[C@@H](N[C@H](C)c1nc(-c2cccnc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 368060528 NKUKOXKXGCXMCC-IAGOWNOFSA-N 395.466 5.082 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1 428847674 BZBYHFDSRJDXHC-UHFFFAOYSA-N 380.488 5.144 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ncoc2-c2ccccc2Cl)s1 430643217 QQFZDZSRMWRAJC-LBPRGKRZSA-N 385.876 5.239 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)Nc1cccc(C#N)c1C 432301582 JWPWXJSCBIYTKT-UHFFFAOYSA-N 391.496 5.171 30 20 GKED CC(C)c1ccc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cn1 435065456 JITMTNGFSJDGGW-UHFFFAOYSA-N 387.458 5.058 30 20 GKED CCS[C@H]1CC[C@@H](N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C1 437107342 PHUZDFOUGVHTBD-AEFFLSMTSA-N 398.503 5.236 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1cc(C#N)cs1 437566557 IHGQGURRVRRDCD-JTQLQIEISA-N 387.917 5.196 30 20 GKED N#CCC[C@@H](NC(=O)N1CCc2cc(Cl)cc(Cl)c2C1)c1ccccc1 438841599 ZUMMGZSVCMXHIP-LJQANCHMSA-N 388.298 5.106 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(Br)sc(C)c1C 440885043 WOXWCISUWGPABQ-UHFFFAOYSA-N 392.362 6.232 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 441002224 JNLQZKDAXFYCLU-MYKUNDNFSA-N 381.907 5.059 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 447123579 YVHOEDRWUXFWIQ-CYBMUJFWSA-N 377.941 5.441 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccccc1 458797733 GPVZBUMLGIUQAL-LEWJYISDSA-N 381.907 5.622 30 20 GKED C[C@@H]1CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)[C@H]1c1cccc(F)c1 458808622 ZGNNSOSGYCQVIV-VOQZNFBZSA-N 379.479 5.353 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CC[C@@H]2CCCCO2)c1 460337018 FLIOTLKFTOAXSN-NRFANRHFSA-N 382.891 5.094 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)[C@H](C)c2cccc(C#N)c2)ccc1Br 462345407 XQQQYKVSWFSDFP-FOIQADDNSA-N 397.316 5.096 30 20 GKED COc1ccc(CN[C@@H]2c3ccccc3CCC[C@H]2C)cc1OCCCC#N 462546953 GLUAMTMPWQJVOO-KOSHJBKYSA-N 378.516 5.181 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@H](C)c3cccc(C#N)c3)c(C)c2)n1 463724442 WTMPXVUKSUUMQB-OAHLLOKOSA-N 393.537 5.525 30 20 GKED Cc1cc(C(F)(F)F)ncc1NC(=O)c1ccccc1-c1ccccc1C#N 464656654 OFBMYNNCLMMTIK-UHFFFAOYSA-N 381.357 5.200 30 20 GKED CCO[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C1=CCCC1 465151085 LYODGCNQBSRMGL-JOCHJYFZSA-N 394.446 5.334 30 20 GKED C[C@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)c(F)c1 468030791 MMOZEEZYWBMAGM-INIZCTEOSA-N 378.422 5.266 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCC[C@H]3Cc3ccccc3)ccc21 469258587 SMPAPPBVLAUVNA-NZQKXSOJSA-N 387.527 5.093 30 20 GKED CN(CCCC(C)(C)C#N)Cc1cn(-c2ccccc2)nc1-c1cccs1 471715018 ROKGAMNLWWVIKQ-UHFFFAOYSA-N 378.545 5.363 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1Cc1c(F)cccc1Cl)c1ccccc1 474968156 NDIXLUJRGGRJAI-ZWKOTPCHSA-N 384.882 5.100 30 20 GKED C=CCOc1ccccc1CN[C@@H](c1ccccc1)c1nc(-c2ccccc2)no1 475773256 PZWBFUSOKRSXPI-QHCPKHFHSA-N 397.478 5.181 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(OC(C)(C)C)n1 476128126 BNGNSSFWBICFBI-UHFFFAOYSA-N 380.532 5.682 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-n2ncc3ccccc32)cc1)c1ccccc1 476594816 BHKDFQMFMJJOKN-IBGZPJMESA-N 380.451 5.052 30 20 GKED O=C(N[C@@H](CCc1ccccc1)C(F)(F)F)c1ccc(F)cc1C(F)(F)F 479701649 DDAFPZGOIRXDKB-HNNXBMFYSA-N 393.302 5.138 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(OC(F)F)c(OC)c1)c1ccc(F)c(F)c1 480704099 ZNVREPUQTIPJPO-BLVKFPJESA-N 383.385 5.543 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nccc2ccccc12 483244405 NSWLFDOTFCMZMZ-GOSISDBHSA-N 391.452 5.134 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1ccc(-n2nc(C)cc2C)cc1 486348961 XTKYCSZQUDKHGT-GOSISDBHSA-N 391.540 5.258 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)CCCC1(C)C 490419494 TWEYHTYTACTQGN-OAHLLOKOSA-N 390.434 5.273 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)c(F)c(C)c3)n2)cc1 490717328 FBWLFZDSQSDYQN-QGZVFWFLSA-N 380.444 5.065 30 20 GKED FC(F)Oc1ccccc1CN[C@H](c1ccccc1OC(F)F)C(F)(F)F 491272948 VXWKWCSLNGSGPX-CQSZACIVSA-N 397.290 5.283 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)cc1 499239626 MLICFBDDOOUDQD-UHFFFAOYSA-N 393.446 5.470 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(OCCC)cc1 499673740 GQGLXBIFANUDPI-UHFFFAOYSA-N 378.925 5.088 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1sc(C)c(CC)c1C#N 503014306 FEOYXAJGYVQGIN-UHFFFAOYSA-N 389.502 5.153 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 505700399 OZJJCTSNHVMYSW-UHFFFAOYSA-N 375.394 5.300 30 20 GKED COc1ccc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1Cl 515697636 LBTRIRWDWHGWNF-UHFFFAOYSA-N 396.899 5.520 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cncnc3-c3ccccc3)c2C#N)CC[C@H]1C 515795590 ITWFIEMNBGYYQH-KGLIPLIRSA-N 388.496 5.015 30 20 GKED N#CCc1cccc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)c1 518621837 XECSVWLZYUJGDZ-UHFFFAOYSA-N 386.417 5.013 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(F)cccc1F 519988096 DVTVSQPDHPSROV-AWEZNQCLSA-N 393.393 5.511 30 20 GKED COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)ccc1C 520836971 GGTHFDRNIMOIHR-UHFFFAOYSA-N 394.418 5.281 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc4oc(C5CC5)nc4c3)c2)cc1 523427342 ZGRYTQWAEBSXEI-UHFFFAOYSA-N 394.434 5.573 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1CNCc1ccc(-c2ccccc2C#N)cc1 539104162 BDBXQLMPSXAZFW-UHFFFAOYSA-N 392.506 5.318 30 20 GKED C=CCC[C@H](NC(=O)Nc1cn(CC(C)C)nc1C(F)F)c1ccccc1 540111941 ZJDOUNSZMOVQOG-INIZCTEOSA-N 376.451 5.306 30 20 GKED COc1ccc(COCc2cccc(NCc3cccc(C#N)c3F)c2)cc1 541307802 SWFODRKXMQPVBE-UHFFFAOYSA-N 376.431 5.035 30 20 GKED COc1ccccc1[C@H](NCc1cccc(C#N)c1F)c1ccccc1Cl 542222241 GCSPKMQXFFHEPO-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc(Sc3ccccc3C#N)cc2)C1 542585011 QGCRBFPNLILLQC-HTAPYJJXSA-N 399.519 5.328 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c(C)c1 549921934 RMKZTPWSFJJKIO-LBPRGKRZSA-N 393.434 5.423 30 20 GKED CC(C)Sc1cccc(Cl)c1CN1CCC(C#N)(c2ccccn2)CC1 554558444 ZFYITBSYGSIWIV-UHFFFAOYSA-N 385.964 5.293 30 20 GKED C=C(C)[C@H](NC(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(F)c(F)c1 554961257 GGTTZDGKRCLNKY-BTYIYWSLSA-N 385.454 5.341 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc2ccccc2n1C(F)F 558866866 SGKUYUNRLBMERZ-ZDUSSCGKSA-N 396.784 5.123 30 20 GKED Cc1sc([C@@H](C)NC(=O)[C@]2(C#N)CC23CCCC3)nc1-c1ccc(Cl)cc1 562684100 HJKKWOJFWIKGTH-LRTDBIEQSA-N 399.947 5.423 30 20 GKED N#Cc1csc(CNCc2ccc(Oc3ccc(C(F)(F)F)cc3)cc2)n1 568686239 PNJYUWJJJAWSIK-UHFFFAOYSA-N 389.402 5.116 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)C2CCC(F)(F)CC2)cc1 568875332 KGEHHBAWGFJBOF-UHFFFAOYSA-N 384.426 5.309 30 20 GKED C[C@H](Sc1nc2c(cc1C#N)CCCC2)c1nnc(-c2cccc(Cl)c2)o1 585688494 PIGUYLHZAPWWLV-LBPRGKRZSA-N 396.903 5.389 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 585720966 SBWGMCYCXDJLQB-HSZRJFAPSA-N 395.453 5.100 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)C1 591350621 YZLTWRZBMLLNKQ-OAQYLSRUSA-N 383.492 5.276 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC(CCC#N)CC3)cc2)n1 592221114 GTMVPNUQPNLKGT-UHFFFAOYSA-N 386.546 5.150 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1CCC2(CC1)CC2(F)F 596735479 NYYWWXUOCKNVHX-VNSJNIRKSA-N 379.476 5.170 30 20 GKED N#CC[C@@H]1CCCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)C1 597916220 VMKLPDOGWMSTRF-KRWDZBQOSA-N 389.474 5.059 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)cc1 598931134 NGJJPFXDZFXAGE-UHFFFAOYSA-N 393.393 5.350 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)c(Br)cc1F 599047945 GXKMJQKZBSNHHN-YJYMSZOUSA-N 393.275 5.813 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 603969390 PRIZOKAPCBBXJX-UHFFFAOYSA-N 385.448 5.503 30 20 GKED CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1cc2ccccc2n1CC#N 609171722 AEECOYBDWGSANP-JOCHJYFZSA-N 387.527 5.428 30 20 GKED CCCc1nnc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 609722170 IPHJNEQASOUMSF-UHFFFAOYSA-N 398.875 5.060 30 20 GKED N#C[C@@H](NC(=O)CC/C=C/c1ccccc1)c1ccc(OCc2ccccc2)cc1 609988395 ZNWTZPDBFVAEAV-XIHLAWMYSA-N 396.490 5.440 30 20 GKED C[C@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1cccc(C#N)c1 610329384 DYYSSEYOMKQQQK-SFHVURJKSA-N 385.467 5.158 30 20 GKED O=C(C/C=C/c1ccc(F)cc1)NC(CCC(F)(F)F)CCC(F)(F)F 619125842 WZNSUGMSHVOYNX-OWOJBTEDSA-N 385.323 5.399 30 20 GKED CCOc1ccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c(C(F)(F)F)c1 620698128 QGRPREJDQVYDMN-UHFFFAOYSA-N 395.274 5.514 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3c(c2)OC2(CCCC2)O3)cc1Cl 726441871 UDUAMEQVGLUUCS-UHFFFAOYSA-N 385.876 5.062 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 727957133 MAHVNDJDRCWRFP-CZUORRHYSA-N 396.462 5.631 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1F 727980405 JSARMUJQJHKVPW-UHFFFAOYSA-N 391.471 5.394 30 20 GKED C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 728411931 PSLQAHNQPDJGGQ-PXNSSMCTSA-N 396.446 5.062 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1Cl 728439254 GBSAGVOMCZHWSR-WAYWQWQTSA-N 391.901 5.438 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(N4CCCC4)c3)c2)cc1 728467718 OWDBXNYELGTLKM-UHFFFAOYSA-N 383.451 5.203 30 20 GKED C#Cc1cccc(NC(=O)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 729552570 HRRICVJEWGMRJU-AWEZNQCLSA-N 379.460 5.122 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Br)ccc2c1Cl)c1ccccn1 729888490 GJLSKEUYFDXLBS-LLVKDONJSA-N 391.677 5.202 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 731410450 ICYAWXNVTGMREP-WBMJQRKESA-N 384.863 5.583 30 20 GKED O=C(/C=C/c1ccc(-c2cccs2)cc1F)c1ccc(C(F)(F)F)nc1O 731562834 HMFOHRVNHCRROO-FNORWQNLSA-N 393.361 5.570 30 20 GKED COc1cc(C(=O)O[C@@H](C)CC#N)ccc1OCc1ccc(Cl)cc1Cl 733710637 FYXDBLZUTJJDEB-LBPRGKRZSA-N 394.254 5.040 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)C(c1ccccc1)c1ccccc1 735333703 LFEIUEMVAPIYIU-UHFFFAOYSA-N 391.854 5.118 30 20 GKED CSc1ccc2c(c1)CC/C(=C/c1cnc3ccc(Br)cn13)C2=O 740764774 FLJMWOZYEASUDN-JYRVWZFOSA-N 399.313 5.031 30 20 GKED COc1ccc(OC(F)F)c(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1 741469763 MSUAVJSQXICXRU-ALCCZGGFSA-N 381.378 5.255 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(C(F)(F)F)cc2)cc1OCCCC#N 747361867 ZVYUYMWYOQQGJB-WMZJFQQLSA-N 389.373 5.293 30 20 GKED CC(C)CCCCCC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 749022950 LNVLEDANRUFOMN-OAHLLOKOSA-N 385.533 5.058 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(N(C)Cc2ccccc2)cc1 750591541 FAQRYFSZQPAELO-UHFFFAOYSA-N 378.520 5.117 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(-c2cccc(F)c2)s1 750930155 GZIYCEBGRBGFCA-UHFFFAOYSA-N 394.500 5.292 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc([C@@H](C)CC)cc1 756233171 IHTFTOHLOXHUKT-KKSFZXQISA-N 376.500 5.286 30 20 GKED COc1cc(F)c(C(=O)/C=C\c2ccc(Oc3cccnc3)c(C)c2)cc1OC 760264781 MYSQDJJHRZOCCR-VURMDHGXSA-N 393.414 5.235 30 20 GKED CCCOc1ccc(Br)cc1CNc1ccccc1O[C@@H](C)C#N 764953456 HWTZFRIPSKHRMF-AWEZNQCLSA-N 389.293 5.141 30 20 GKED N#CCCCn1cc(C(=O)N2CCC(c3ccc(F)cc3)CC2)c2ccccc21 767949147 LZWIURFCLFGLKG-UHFFFAOYSA-N 389.474 5.104 30 20 GKED O=C(/C=C\c1cscc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 771859529 NIFSCAYESXFUJK-YFHOEESVSA-N 380.918 5.014 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1 774302185 LBPNNVARVKPQOE-HXUWFJFHSA-N 377.488 5.419 30 20 GKED CCCOc1c(Cl)cc(CNc2ccc(F)cc2OCC#N)cc1OCC 779608479 BIKXUKJPVANUHE-UHFFFAOYSA-N 392.858 5.181 30 20 GKED CSCCCCCCNC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782196332 WMOQIVFKEDSFKA-NRFANRHFSA-N 397.613 5.552 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCCc1ccsc1 783043953 GNQJYLARDUOKTI-UHFFFAOYSA-N 390.508 5.469 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 796650730 NTIRKHPZVBZQIZ-YUTCNCBUSA-N 396.434 5.087 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 797943538 SHNHGXFNHXDPSP-ONGXEEELSA-N 388.361 5.317 30 20 GKED N#Cc1ccc(NC2CC2)c(NC(=O)c2ccc(C3SCCCS3)cc2)c1 798266415 ULKXPHIBHDRHPR-UHFFFAOYSA-N 395.553 5.254 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)CCCCCC#N 808359960 ROOKCWAAJLVCSJ-UHFFFAOYSA-N 399.413 5.465 30 20 GKED CC(/C=C/C(=O)c1ccc(N2CCOC2=O)cc1)=C\c1ccccc1OC(F)F 811689938 POJYPIRGNCQTPS-ZDQSRFTLSA-N 399.393 5.087 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(Br)c1 813057708 PYSAYBZVNJHEMA-SMDDNHRTSA-N 385.286 5.039 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813217832 JPXRWJLKMFFVHU-LJQANCHMSA-N 382.385 5.453 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)Nc2ccc(C#N)cc2Cl)cc1 841155830 YEGCGTOMFJQTMV-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED CCc1nc(SCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)sc1C 845326719 YEUPREQMVMOFIP-AWEZNQCLSA-N 399.566 5.106 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Cc2noc(CC3(C#N)CCCCC3)n2)cc1 854038918 SONMWMVPVFCSKT-UHFFFAOYSA-N 396.491 5.024 30 20 GKED O=C(/C=C/c1csc(C(F)(F)F)c1)N(CCC(F)(F)F)CC(F)(F)F 861409294 ANHAUEJHHOPPFR-OWOJBTEDSA-N 399.278 5.123 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(Cl)cc2)cc1 915085617 DDXBJFHJNHUTLI-NRFANRHFSA-N 376.843 5.013 30 20 GKED CC(C)c1cccc(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915179820 JAOPTJKXIKKZPY-DEOSSOPVSA-N 384.479 5.483 30 20 GKED CCOc1cc(/C=C/C(=O)c2cc3cc(Br)ccc3o2)ccc1O 916130008 DTVAXIXURHQKSP-QPJJXVBHSA-N 387.229 5.196 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccc(OC)cc2F)cc1OC 916549571 SHGMJQFNMFMVMO-YVMONPNESA-N 378.827 5.181 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnc(Cl)c(Cl)c1 919893303 DJALRINHRDZZAM-UHFFFAOYSA-N 398.249 5.613 30 20 GKED CCn1c2ccccc2c2cc(C=NNc3ccc(Cl)c(C(=O)O)c3)ccc21 1776033268 VSPATKGACAEKTG-UHFFFAOYSA-N 391.858 5.612 30 20 GKED Cc1ccc(C)c(C(=O)/C=C/c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c1 1776132754 DSUMXHVCFVCLCM-DHZHZOJOSA-N 390.435 5.378 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1cc(Cl)cc(Cl)c1 1776785337 WUFLIQCYFAGERE-LJQANCHMSA-N 388.379 6.582 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1C 1777275253 VDJFKJXMGNPIFR-RAXLEYEMSA-N 386.447 5.573 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(F)ccc2Oc2cccc(Cl)c2)c1 1777684987 RDQBYUFAWXFKQK-VQHVLOKHSA-N 396.801 5.866 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)[C@H](C)Oc3ccc(C#N)cc3)n2)c(C)c1 15323222 UDDWYZDOSCREOO-INIZCTEOSA-N 391.496 5.013 30 20 GKED C=CCN(C(=O)c1ccc(CSC)cc1)c1nc(-c2ccccc2)cs1 21247836 MZOOICFXQOSPOZ-UHFFFAOYSA-N 380.538 5.506 30 20 GKED N#Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)cc1 41538292 YPGZDACBGXJJGK-OAHLLOKOSA-N 398.274 5.479 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Nc2cccc(OCCCC#N)c2)c(Cl)c1 56199540 MYOMQUZWTATDKT-MRXNPFEDSA-N 385.895 5.079 30 20 GKED CCOc1ccc([C@H](NC(=O)N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 62067809 QNJVAJRQLGVVMS-HOYKHHGWSA-N 399.494 5.107 30 20 GKED CC(C)Oc1ccc(C#N)cc1NCc1ccc(C(=O)Nc2ccccc2)cc1 63469697 MLXXKKNCWGKWCF-UHFFFAOYSA-N 385.467 5.210 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(O[C@H](C)C#N)cc1 105494655 WEZMPHIFYMTIPT-CABCVRRESA-N 395.503 5.399 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C(/C)c3ccc(F)cc3)n2)cc1 109323142 GOQVEIVGDZOXJO-RNUYOQPASA-N 392.455 5.238 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)s1 114272585 GNXHDHLKLOBYAB-JTQLQIEISA-N 382.457 5.162 30 20 GKED CCc1c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1CC(C)C 124619141 RXWDVJDIZVUASJ-HNNXBMFYSA-N 385.537 5.140 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1)c1nc(-c2ccc(Br)cc2)cs1 126149193 JURMNCAGUCOJQH-CYBMUJFWSA-N 398.329 5.295 30 20 GKED CC[C@@H](C)N/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1cccc(C)c1 154484906 DIUOQUHSAFLDDV-OAHLLOKOSA-O 397.589 5.133 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 156798623 TVJHETQVPBHINJ-UHFFFAOYSA-N 390.936 5.472 30 20 GKED Cc1ccc(SCc2cccc(C(=O)NC3(C#N)CCSCC3)c2)c(C)c1 162525918 IWGAQARWJDPNJP-UHFFFAOYSA-N 396.581 5.115 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 178556426 NZZNXCKMSSMSQM-UHFFFAOYSA-N 382.467 5.125 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 178960334 NJXVUOBLMBNDRC-OALUTQOASA-N 393.531 5.097 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCCO[C@H]1c1ccccc1 191453512 NMWDEOYESSFFIX-QPPBQGQZSA-N 392.543 5.828 30 20 GKED CCO[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 194485195 CRSVEYBYWFRYBV-PXNSSMCTSA-N 396.899 5.418 30 20 GKED N#C[C@@H](C(=O)c1csc(C2CC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 194990018 KUQHPOOTXHFVLL-ZDUSSCGKSA-N 385.901 5.287 30 20 GKED COc1cc([C@H](C)NCc2ccc(O[C@@H](C)C#N)cc2)ccc1OC1CCCC1 237277138 NSDGJJMSOKPHHT-ROUUACIJSA-N 394.515 5.158 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ccc(Cl)c(C#N)n3)s2)cc1 301246716 BOTOPYGZOGMDIK-NSHDSACASA-N 384.892 5.220 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccc(F)cc1 303229249 XYLKLFSFWMGFAU-UHFFFAOYSA-N 388.442 5.193 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 303719651 VXEBSWXZFDAACM-PXNSSMCTSA-N 381.501 5.146 30 20 GKED OC(CSC[C@@H]1CCCCO1)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328891438 SPVQGORVRVIMTN-INIZCTEOSA-N 377.506 5.009 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(O)=Nc2nc(C3CCOCC3)cs2)c1 329427904 JJPLQVRVNKJTBF-LJQANCHMSA-N 385.533 5.037 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ccc(C(F)(F)F)cn1 425535273 NDPDYYOGZAWHOC-LBPRGKRZSA-N 387.327 5.033 30 20 GKED N#Cc1ccc(NC(=O)c2c(Cl)cc(F)cc2Cl)cc1C(F)(F)F 432934097 RHRBLLNUHUDHOJ-UHFFFAOYSA-N 377.124 5.275 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)s1 442207607 JUKNNOAJABUQHY-AWEZNQCLSA-N 395.406 5.196 30 20 GKED CN(CCc1cccc2ccccc12)C(=O)N[C@H](CCCC#N)c1ccccc1 458804345 SIMKTFKIWCZJLZ-XMMPIXPASA-N 385.511 5.459 30 20 GKED CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H](C)Cc1ccc(OC)cc1 458827382 DDFYXUUADPNWBS-XXBNENTESA-N 393.531 5.093 30 20 GKED O=C(CC12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)N(CCC(F)(F)F)CC(F)(F)F 468537780 SDPPVPNXLKQUBH-HGWMRPEMSA-N 389.355 5.028 30 20 GKED CN(Cc1ccn(C(F)F)n1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 468544879 UURVLTMWBGQAOE-LBPRGKRZSA-N 387.274 5.032 30 20 GKED CC(C)c1nc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 469795522 FDPYDOFUUKZGCY-IAGOWNOFSA-N 375.541 6.217 30 20 GKED CC(C)[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)C(F)(F)F 470778699 IULORDTXAKAXMD-KRWDZBQOSA-N 378.419 5.026 30 20 GKED CC(C)(NCc1cccc(OCCCC#N)c1)c1ccc(OC(F)(F)F)cc1 474004343 FMGIYMWWKUDORT-UHFFFAOYSA-N 392.421 5.293 30 20 GKED C=C(C)[C@@H](NC(=O)N(CCC)Cc1ccc(C#N)cc1)c1ccc(F)c(F)c1 477756365 VOYXQOADXHQMHZ-OAQYLSRUSA-N 383.442 5.075 30 20 GKED C=CCC1(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)CCC1 478666545 HASWNKHCEWLDKR-KRWDZBQOSA-N 377.488 5.254 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 484146483 YGGBKDNCCNYXNR-AWEZNQCLSA-N 394.862 5.446 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)CCCCOc1cccc(C#N)c1 485660792 FCFGDPOBHJUTTC-DEOSSOPVSA-N 378.516 5.272 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)N(Cc1ccco1)c1ccccc1C#N 501019520 QEBQXFVZAMCWST-HNNXBMFYSA-N 396.899 5.519 30 20 GKED C[C@H](C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(C)(F)F 504181850 MTLZVDPBWVJEFI-KCJUWKMLSA-N 377.275 5.106 30 20 GKED Fc1cccc(F)c1[C@@H](NCc1cccc(OCC(F)(F)F)c1)C(F)(F)F 506268270 IEJUMWSNNMMZKA-OAHLLOKOSA-N 399.281 5.299 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc2c(F)cccc2[nH]1 510269310 KBISNHSTPOQXDH-UHFFFAOYSA-N 385.398 5.532 30 20 GKED CC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(Cl)s1 513078795 WHEPUIMFHPPNJI-MRXNPFEDSA-N 375.925 5.344 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 513865048 AWEOKBZBFOFMNS-UHFFFAOYSA-N 385.467 5.793 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 513942748 SDPCZBAJBSPEDI-UHFFFAOYSA-N 390.512 5.048 30 20 GKED CCN(C(=O)Cc1coc2ccc3ccccc3c12)[C@@H](C)c1ccc(C#N)cc1 514515127 CYOUGJUZGBZTKR-KRWDZBQOSA-N 382.463 5.610 30 20 GKED CCCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 518668023 RHJOIFNEDBXAIP-IBGZPJMESA-N 376.481 5.261 30 20 GKED N#Cc1ccc(NC(=O)c2oc3ccccc3c2CSc2cccs2)cc1 521384806 BQZXIPXDYMNSFD-UHFFFAOYSA-N 390.489 5.911 30 20 GKED C[C@@H]1c2cccn2CCN1C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 522635727 VBTMZXUTZMQEHT-OAHLLOKOSA-N 391.858 5.022 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCn3ccc4ccccc43)cc2)c1 524124287 NHNMDUMBYNQNHB-UHFFFAOYSA-N 395.462 5.121 30 20 GKED Cc1cccnc1[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(C)C 524513902 DXJDMYUBRTVPNZ-QHCPKHFHSA-N 399.494 5.376 30 20 GKED C=CCN(C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 525006072 DABZERVNYXJBSP-SJORKVTESA-N 396.462 5.411 30 20 GKED N#Cc1ccc(C2(NCc3ccc(-c4ccc(F)cc4)s3)CCOCC2)cc1 527812813 UOIFDNVZPYAUTO-UHFFFAOYSA-N 392.499 5.221 30 20 GKED C[C@@H](CC(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)Cc1cccc(F)c1 530589390 SKNFQHGOYMKABP-CQSZACIVSA-N 379.460 5.028 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3cc(F)ccc3F)C3CCCC3)cc2)CC1 540759041 RGPGXKITOCFOGH-UHFFFAOYSA-N 380.438 5.105 30 20 GKED CCn1c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2cc(F)ccc21 541087017 NULNLAWNBUVZEV-KRWDZBQOSA-N 398.485 5.585 30 20 GKED CC[C@@H](CSC)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158479 DLVDVSUJWZFOHO-KKSFZXQISA-N 381.545 5.069 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccc4ncccc4c3)no2)c2ccccc21 545632336 QGJGQWFRSBVTIE-LUAWRHEFSA-N 391.434 5.324 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 553320154 ROLKBIINVISQHL-INIZCTEOSA-N 382.423 5.105 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2cccc(Cl)c12)c1ccc(Cl)c(Cl)c1 559700257 JCJUHUCCPRKUTB-MRXNPFEDSA-N 392.673 5.052 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 559856975 APIYGOZBORYKFD-KNQAVFIVSA-N 377.532 5.552 30 20 GKED N#CCCC[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccccc1 560564580 MNAFTVPWWZFSAY-IBGZPJMESA-N 387.508 6.081 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3occc3-c3ccc(F)cc3)cc2)ccn1 569278837 IBYATAFSJTWXOE-UHFFFAOYSA-N 399.381 5.397 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1ccc(Cl)s1 582800977 HNFHTUNDXQMCFB-UHFFFAOYSA-N 380.900 5.439 30 20 GKED CC(C)c1ccc([C@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2cccs2)cc1 596106326 OHWKZTNKOHLKSZ-UWJYYQICSA-N 381.545 5.296 30 20 GKED CC(C)(C)[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596243090 GOCMOXLAKJWKLH-RHSMWYFYSA-N 381.442 5.128 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(O[C@H]2CC2(F)F)cc1 599410104 XMJOQUIFRYLIBB-ACJLOTCBSA-N 388.439 5.120 30 20 GKED N#Cc1ccc(F)c(CSCc2ccc(C(=O)Nc3ccccc3)cc2)c1 603442435 KMFLAUMMBOCITB-UHFFFAOYSA-N 376.456 5.383 30 20 GKED O=C(NCCCC(F)(F)F)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 608482093 FQRQVTCVDLTOQG-UHFFFAOYSA-N 393.302 5.584 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cs1 608846915 ILWAIACBOGKSAU-UHFFFAOYSA-N 391.496 5.286 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609078609 CJMVGURZITYPRG-HXUWFJFHSA-N 377.488 5.242 30 20 GKED N#C[C@H](NC(=O)c1ccc2ccccc2c1)c1ccc(OCc2ccccc2)cc1 609171965 KBCXYQJAUQNIEF-VWLOTQADSA-N 392.458 5.413 30 20 GKED Cc1cc(OCC(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1C(C)C 609377975 NBMBBWSXLZSYEU-INIZCTEOSA-N 382.529 5.388 30 20 GKED C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 610190113 DWMMLRWFZDHDMO-UPVQGACJSA-N 384.504 5.169 30 20 GKED C[C@H](NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1cccc(C#N)c1 610318128 PWRRETVMCRAUIF-HNNXBMFYSA-N 382.423 5.249 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2cccc(OCc3ccccn3)c2)CC1 611255131 VNTXPDSRQLTDNS-UHFFFAOYSA-N 397.522 5.154 30 20 GKED Cc1cc(C)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1O 613031523 HESCODBHIKFOKF-UHFFFAOYSA-N 388.492 5.425 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SCc1ccco1)c1ccc2ccccc2n1 613292456 KNNYFQFQHSRSHN-LJQANCHMSA-N 384.460 5.610 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccccc2c1)c1nc2cc(C(F)(F)F)ccc2s1 613404996 SDQUZTPMQGAZMA-INIZCTEOSA-N 396.393 5.958 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 614400953 QVIDZUFIILYZHT-UHFFFAOYSA-N 385.496 5.234 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(OCc3ccccc3)cs2)n1 626355919 IEJJGQJLZTUZIK-MRXNPFEDSA-N 382.510 5.397 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)C[C@@H](C)C1(F)F 626369191 SLNMZXQUMHMYTN-AOOOYVTPSA-N 386.311 5.096 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ocnc1C1CC1 648494216 DTVVVWUZHJFAIV-UHFFFAOYSA-N 396.262 5.094 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1Cl 728117070 INRNJUCAPDTMTE-QGZVFWFLSA-N 393.796 5.599 30 20 GKED N#CCOc1ccc(CC(=O)N(Cc2ccccc2)c2ccc(Cl)cc2)cc1 731975913 IWSXTWRISFKZOV-UHFFFAOYSA-N 390.870 5.018 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(Oc3cccnc3)c(C)c2)c(OC)c1 732714183 TVNICDLTKNFEDS-POHAHGRESA-N 375.424 5.096 30 20 GKED C=C(C)CNC(=S)N(C)Cc1cc(C)c(OCc2ccc(C)cc2)c(C)c1 734310000 SKLGUNZVUGYIJM-UHFFFAOYSA-N 382.573 5.073 30 20 GKED Cc1c(Cl)cccc1NC(=O)CSCc1cc(Cl)ccc1OCC#N 735320157 LXGIGSVIEGSQGX-UHFFFAOYSA-N 395.311 5.076 30 20 GKED CCCCSCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 740530730 ADXXVJOTCLQDDS-LBPRGKRZSA-N 386.464 5.415 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2s1 743216016 CHKUGMGUOUMBGE-SNVBAGLBSA-N 390.390 5.069 30 20 GKED CCOc1cc(/C=C\C(=O)c2c(C)nn(-c3ccccc3)c2C)cc(Cl)c1O 745625906 GDTODXPWZQINQS-KHPPLWFESA-N 396.874 5.143 30 20 GKED CC(C)CN(C(=S)Nc1cc(Cl)cc(Cl)c1)c1ccc(C#N)cc1 745688876 RWYVVYJYKCEYJH-UHFFFAOYSA-N 378.328 5.724 30 20 GKED Fc1ccccc1CC(=NOCc1cccnc1)c1ccccc1Br 746577141 OLYKMYPKNMVXGB-UHFFFAOYSA-N 399.263 5.147 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCC[C@@H]2[C@H](CC)c2ccccc2)c1=S 746713099 RMTDBOWKOXLSAS-WOJBJXKFSA-N 382.577 5.093 30 20 GKED CC(C)[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(C(F)(F)F)cc1 747928179 HEBJDGIFPZUTLZ-NRFANRHFSA-N 389.465 5.542 30 20 GKED CCCCC[C@H](OC(=O)CCc1c(C)nc(O)c(C#N)c1C)c1ccccc1 748114698 CREOOCCOOZDELG-NRFANRHFSA-N 380.488 5.073 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3c[nH]c4cc(F)ccc34)c(Cl)nc21 749454372 YXGVWLOYWJEUED-ZZXKWVIFSA-N 382.826 5.182 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 749616610 YGVSSWLEVZPHRF-YIEVGGLXSA-N 392.343 5.182 30 20 GKED COc1cccc(C(=O)/C(=C/c2csc(Cl)c2Cl)c2ncc[nH]2)c1 761475814 GFMQJQZUYAPEFN-JYRVWZFOSA-N 379.268 5.210 30 20 GKED N#Cc1cnccc1Sc1nnc(Nc2ccc(SC(F)F)cc2)s1 775421714 SBMJLEUKWHNXJR-UHFFFAOYSA-N 393.469 5.014 30 20 GKED C[C@H](NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccc(OCC#N)cc1 776154564 UPPXSRQEIUIPJO-KRWDZBQOSA-N 376.431 5.371 30 20 GKED Cc1ncsc1/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 776782575 KUWLNTAOKSUQCZ-HJCTWCACSA-N 393.899 5.412 30 20 GKED N#Cc1ccc(CN[C@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)nc1 783292865 CSJSQRXIEMUIJE-JOCHJYFZSA-N 395.478 5.245 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O 788694915 XLKSAHMEZICGBX-ZUZCIYMTSA-N 395.318 5.894 30 20 GKED C=CCC1(C(=O)Nc2ccc(N3CCC(OC)CC3)c(C(F)(F)F)c2)CCC1 790582870 NVPCROYFSSVRPZ-UHFFFAOYSA-N 396.453 5.006 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(Br)c(Cl)c1 791021894 VNNSBLZRBUKJJC-UHFFFAOYSA-N 393.712 5.602 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792092385 QENJZOFIRHCXJQ-BZSNNMDCSA-N 396.368 5.113 30 20 GKED O=C1/C(=C\c2ccc(-c3c(F)cccc3F)o2)C[C@H](C(=O)O)c2ccccc21 806559562 CJRGEELSUHLWHK-DMIOIOJGSA-N 380.346 5.063 30 20 GKED C=CC[C@@H](NC(=O)N(CC(C)C)[C@@H](C)c1ccccc1Cl)c1ccncc1 806820200 UMXSADCGZUZJPR-LAUBAEHRSA-N 385.939 5.781 30 20 GKED CC(=NNc1cnc2ccccc2n1)c1sc(-c2ccccc2F)nc1C 814829767 JOILKCNRAMUNHF-UHFFFAOYSA-N 377.448 5.037 30 20 GKED C#CC[C@H]1CCCN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)C1 831406080 HYMBZBWVHVDVEN-INIZCTEOSA-N 385.558 5.178 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1 845841540 OWKGUQUNPVYRDE-GOSISDBHSA-N 392.524 5.123 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 857435812 LCBNZJHCQMISRQ-HNNXBMFYSA-N 393.302 5.393 30 20 GKED N#CCCC[C@@H](NC(=O)/C=C\c1csc(C(F)(F)F)c1)c1ccccc1 861824046 PEDYTOFULJCXGH-ZBTGYSDGSA-N 378.419 5.331 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2cccs2)cc1 915352174 ILLOVKKNNMLUSH-RTWAWAEBSA-N 387.508 5.773 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=S)Nc1ccccc1C#N 915995348 PHENMZPNICAMLF-UHFFFAOYSA-N 379.407 5.175 30 20 GKED Cc1ccccc1C[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916681185 QNENTOPGEVBWRV-CYFREDJKSA-N 383.495 5.403 30 20 GKED Cc1ccc(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3s2)c(Br)c1 916846116 IABIGUQRQZXKIS-CKXPSTMWSA-N 397.297 5.257 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 916905737 PDQRSWVSQMRWQR-NRFANRHFSA-N 398.462 5.563 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1C 917026603 JEJPUTCYYWGWDF-IBGZPJMESA-N 392.549 5.786 30 20 GKED Cc1cc(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1Cl 917046206 HSMQUZMIRHXEGK-CYBMUJFWSA-N 391.279 5.167 30 20 GKED Cc1nn(C)cc1C(=O)/C=C\c1ccc(-c2ccccc2Br)s1 917519797 FNAKTWLJFNFNAD-CLFYSBASSA-N 387.302 5.116 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)nc(Cl)c2)sc2c1CCCCCC2 917784572 WSCGJDLQAWKVJQ-UHFFFAOYSA-N 380.300 5.233 30 20 GKED C=CCC[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)O)c1)c1ccc(C(F)(F)F)cc1 1776167877 OOURHNRLJFNCAM-MRXNPFEDSA-N 394.349 5.431 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1c[nH]c3ccc(C(=O)O)cc13)CCO2 1776374741 WBMPYOLJORJQJE-DHDCSXOGSA-N 375.424 5.038 30 20 GKED CC(C)c1cccc2c1OC/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776378002 LGMJBOVRQNXBJD-RGEXLXHISA-N 398.458 5.834 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)/C=C/C3CCCC3)CCC2)cc1 1791730612 NCJSETLNUQXFQJ-SFQUDFHCSA-N 392.543 5.061 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2coc(-c3cccc(F)c3)n2)n1 26049136 DGNMPQVYIPOPCS-UHFFFAOYSA-N 393.365 5.367 30 20 GKED O=C(/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 34870056 UBMDKSDHGCZDJY-NBVRZTHBSA-N 386.432 5.628 30 20 GKED N#C[C@@H](C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1nc2ccccc2s1 41499653 KSWIIYHUSTVVKC-SFHVURJKSA-N 397.459 5.039 30 20 GKED Cc1csc([C@H](C#N)C(=O)CCN2c3ccccc3Sc3ccccc32)n1 41519466 CETNYBJWOKVTSR-OAHLLOKOSA-N 391.521 5.321 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1nc2ccccc2o1 54734252 WHSPWQHOVOCFCV-CYBMUJFWSA-N 379.828 5.095 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(SC(C)C)cc2)cc1 65870096 BFFAYEPOXCCQBF-UHFFFAOYSA-N 394.540 5.254 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)cc1 66802112 HTWFFUYPOOGYPY-LBPRGKRZSA-N 375.291 5.096 30 20 GKED N#CC1CCN(C(=O)Nc2cc(Cl)ccc2Sc2ccc(F)cc2)CC1 104980614 RGKNSDAQVIEQJX-UHFFFAOYSA-N 389.883 5.398 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 105039762 PZMSYSZARTZPRS-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ncc(-c2cccc(Cl)c2)o1 108354946 MZIPTXOHENXQBP-CQSZACIVSA-N 383.904 5.859 30 20 GKED CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(F)cccc1F 115678688 ROLYOZYHJNYNLY-UHFFFAOYSA-N 383.238 5.279 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)Nc1ccc(F)cc1OCC#N 120113479 HAPKRVGKYDKCEP-UHFFFAOYSA-N 396.443 5.108 30 20 GKED C#CCCCCC(=O)Nc1c(C)cccc1-c1nc2cc(F)ccc2n1C(C)C 121264097 WCJZLNODIFIEFT-UHFFFAOYSA-N 391.490 5.864 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(SC)cc3)n2)cc1 121865456 DRVNTYCJOMYEKZ-KRWDZBQOSA-N 380.494 5.031 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 128086360 CDFGVUXLZDBNOQ-KRWDZBQOSA-N 377.856 5.181 30 20 GKED C#CCCOc1ccc(CNc2cccc(CSC3CCOCC3)c2)cc1 151024735 ZAVBBAWFTIOVSP-UHFFFAOYSA-N 381.541 5.113 30 20 GKED N#CCSc1cccc(C(=O)N(CCc2cccc(F)c2)C2CCCC2)c1 152538710 ULLUSHVURGPHDS-UHFFFAOYSA-N 382.504 5.069 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c1C1CC1 159658537 YMTUGAJCFBPOIU-FOIQADDNSA-N 378.520 5.024 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3cccc(C#N)c3)s2)cc1 178178903 NTTADFPSFQUSQU-CABCVRRESA-N 377.513 5.411 30 20 GKED N#C[C@@H](C(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2[nH]1 178988463 COVKIBRDMKHODW-GFAPJHNFSA-N 389.764 5.038 30 20 GKED Cc1cc(Br)cc2cc(C(=O)[C@H](C#N)c3nc4ccccc4o3)oc12 187579247 DSWOPKYHIXPKPQ-ZDUSSCGKSA-N 395.212 5.135 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(C#N)c1 190891151 UQHRHNOEBYVHKF-CVEARBPZSA-N 395.553 5.385 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCOC[C@@H]1c1ccc(CC)o1 191506761 VNMNXFPNSURHQM-HXUWFJFHSA-N 382.504 5.299 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@]1(O)CCC[C@@H](C(F)(F)F)C1 191511879 XLOIHPNIOZLZKK-UZLBHIALSA-N 398.469 5.144 30 20 GKED C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cccc(C#N)c1 237406213 DYUFLXJHNZQCIW-OAHLLOKOSA-N 391.402 5.249 30 20 GKED Cc1cc(NCc2cccc(-c3ccc(C#N)s3)c2)nc(-c2cccnc2)n1 301344163 GGWDFODGBIUPLZ-UHFFFAOYSA-N 383.480 5.059 30 20 GKED CC(C)COc1ccc(C2(/C(O)=N/[C@@H]3CCC(O)=NC34CCC4)CCC2)cc1 328732282 HBFNENQVFCAGED-LJQANCHMSA-N 384.520 5.141 30 20 GKED O/C(=N/CCOC1CCCCCC1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329449251 MOKATRUNOBAVPG-LJQANCHMSA-N 387.568 5.189 30 20 GKED Cc1c(/C(O)=N/[C@@H]2c3ccccc3CC23CCOCC3)cnn1C1CCCCC1 329606909 MRARLNRZIZXRFI-JOCHJYFZSA-N 393.531 5.096 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(CN2CCCC[C@@H]2C)cc1 410343559 DOIYAETXKJHCJO-IBGZPJMESA-N 397.588 5.020 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])c1C#N 410931571 RDSOVUWAEVRDOW-UHFFFAOYSA-N 397.378 5.097 30 20 GKED C[C@H](c1ccccc1Br)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426131694 RMYJOUAGQFMZFZ-LLVKDONJSA-N 392.684 5.199 30 20 GKED CC(C)O[C@@H](CSCC(=O)Nc1cc(Cl)ccc1C#N)c1ccccc1 427711603 AKLZPXIAKGXQKS-IBGZPJMESA-N 388.920 5.050 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc(-c3cnco3)cc2)c1 432665811 CRJQMOPJQXRZFO-UHFFFAOYSA-N 381.435 5.404 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)CC1 433658633 CNVADTNIDROWDC-UHFFFAOYSA-N 393.274 5.006 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC4(CCCCC4)C3)cc2)cc1 438229266 VPLDDIINKKTWKE-UHFFFAOYSA-N 375.472 5.539 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 438494692 UCMJINVKYFYOTL-XLIONFOSSA-N 397.906 5.431 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438646036 FEQHFBKOLRRSEV-CQSZACIVSA-N 395.459 5.304 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 445971797 PGFOEKXVGIIEIF-IINYFYTJSA-N 397.334 5.066 30 20 GKED C=CCC1(C(=O)Nc2cccc(CS(=O)(=O)C3CCCCC3)c2)CCCC1 449853817 DJXMBURBFFBFAJ-UHFFFAOYSA-N 389.561 5.009 30 20 GKED C=CCC1(NC(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)CCCCC1 454604824 IYEKKGKGOGYUEQ-UHFFFAOYSA-N 381.476 5.241 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cc(OC)c(Cl)cc2C1 455240379 DRUPOWWDPCKCCL-UHFFFAOYSA-N 398.934 5.791 30 20 GKED CC(F)(F)c1ccccc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 455812788 UDNLOQDNOWHGEU-UHFFFAOYSA-N 399.441 5.182 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c1 458801998 OLELBLWYZHKFIF-GGAORHGYSA-N 375.516 5.238 30 20 GKED C=CC(C)(C)CNC(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 458992293 VQCIYVYIIJZKMN-UHFFFAOYSA-N 391.437 5.024 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)[C@H](C)c2cccc(C#N)c2)cc1 462148207 ZHJLKEYBZJJPSD-MSOLQXFVSA-N 384.479 5.215 30 20 GKED CSc1cc(C(=O)Nc2cc(C#N)cn2C(C)(C)C)c(Cl)cc1Cl 468218720 CFMWBLJHPZOVAW-UHFFFAOYSA-N 382.316 5.396 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2(O)CCCCC2)cc1Cl 468438759 XMNVLEWQWMMZJZ-LJQANCHMSA-N 382.891 5.019 30 20 GKED COc1ccccc1[C@@H](CNC1CCC(C#N)(c2ccccc2)CC1)OC(C)C 471597375 DTTKMZQCYIVGBH-OOAAYMRMSA-N 392.543 5.155 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1nc(C(C)(C)C)cs1 475553329 ULDDBRIVKXFXME-UHFFFAOYSA-N 385.577 5.657 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccc(F)c(F)c1 480799399 QDTAOADKCVCQJH-HXUWFJFHSA-N 397.425 5.676 30 20 GKED CCOc1ccc(-c2nc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)cs2)cc1 481601635 VIHRNOATUWTOIB-UHFFFAOYSA-N 391.496 5.262 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 482023423 ZVMRINXPUSWNAY-KUHUBIRLSA-N 387.405 5.105 30 20 GKED N#CC[C@H](CC(=O)Nc1c(-c2ccccc2)nc2ccccn12)c1ccccc1 483108525 ZEYOVOYZEGQSFX-HXUWFJFHSA-N 380.451 5.027 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 485461193 CQCILRLDEVHGQN-UHFFFAOYSA-N 391.540 5.585 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Br)c(Cl)c1)c1ccccc1 487443172 GAXATBQALWAJBQ-QGZVFWFLSA-N 391.696 5.267 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 502799524 RZULCDBMUSBWTH-RBBKRZOGSA-N 394.490 5.134 30 20 GKED Cc1ncc(CNc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)cn1 506280212 NKNONJYRYJOWPP-UHFFFAOYSA-N 384.361 5.080 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(Oc2ccc(C)cc2OC)nc1 512518001 DGMMKWVOPWUZTR-UHFFFAOYSA-N 390.439 5.008 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc3c4c(cccc24)CC3)o1 516212389 NELHSULUJPCMFX-UHFFFAOYSA-N 394.430 5.234 30 20 GKED C[C@@H](SCc1cccc(Cl)c1)C(=O)N(CCC#N)c1ccc(F)cc1 518661028 QQFPSXKJXRLSNL-CQSZACIVSA-N 376.884 5.048 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1COC(C)C 519970372 FYCNDXLSVZPZNE-UHFFFAOYSA-N 392.952 5.224 30 20 GKED Cc1cccc(COc2c(C)cc(CN(C)C[C@@H](C#N)CCC#N)cc2C)c1 523791336 XIIYIAYRNKCNQD-JOCHJYFZSA-N 375.516 5.066 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OC)c2ccccc12 529255226 IMSRUUIMSPWYON-UHFFFAOYSA-N 392.503 5.236 30 20 GKED Cc1ccc(S[C@H](C(=O)Nc2cc(CC#N)ccn2)c2ccccc2)c(C)c1 531924321 OBMNBEYDYCGUBB-QFIPXVFZSA-N 387.508 5.237 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(C)c1cccc2ccccc12 532486832 SDBLTQYZDJOMKK-QGZVFWFLSA-N 389.524 5.309 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)c1ccccc1 534647678 SGFMAUFKXRYJNW-IEBWSBKVSA-N 376.525 5.362 30 20 GKED C=CCC[C@H](NCc1nnc(-c2ccco2)o1)c1ccc(C(F)(F)F)cc1 537132795 QNESQVKVEIBNLZ-HNNXBMFYSA-N 377.366 5.146 30 20 GKED C[C@@H]1CC(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@@H](C)O1 539841960 MGYCYGPLOXMCTR-ZIAGYGMSSA-N 384.863 5.146 30 20 GKED N#CC1(CCCNc2ccccc2C(=O)Nc2cccc(Cl)c2)CCOCC1 540809411 BSKPEIFZWAUHCM-UHFFFAOYSA-N 397.906 5.105 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NCC(C)(C)CCC#N 554185987 DJBSZGALUFNGCX-GOSISDBHSA-N 379.504 5.587 30 20 GKED C[C@H](Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2)c1ccc(C#N)cc1F 556243033 YVGIVNQJWZVECR-KRWDZBQOSA-N 399.469 5.002 30 20 GKED N#CCCC[C@@H](NCc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccccc1 559266441 CIRCAZDGHBSYCC-GOSISDBHSA-N 377.366 5.138 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 559865626 SDVNOJIKYPMLPK-CJFMBICVSA-N 384.523 6.448 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)c3cc(C#N)ccc3Cl)ccc2C)c1 560531819 NZPPJDUZYOHCDY-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)C1(c2cc(F)cc(C#N)c2)CC1 561382923 SISVXMGQNYCQKT-GJZGRUSLSA-N 384.882 5.033 30 20 GKED N#CCCC[C@H](NC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1 565707038 AVTONXBUFZUIKQ-QHCPKHFHSA-N 381.951 5.329 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)N3CCC(CCC#N)CC3)c2)C1 573561305 CMXBYLMJWUEYII-AVRDEDQJSA-N 383.536 5.330 30 20 GKED C[C@@H]1C[C@@H](C(C)(C)C)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 574308602 ICGWADDIUGILTD-APWZRJJASA-N 377.488 5.032 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC4(CCC4)CC3)cc2F)c1 588243255 PZPWFUGIMNINNU-UHFFFAOYSA-N 393.462 5.074 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1cccc(Br)c1)c1ccccc1 590477535 KFJZLZQJOBFHSV-FQEVSTJZSA-N 399.332 5.323 30 20 GKED CS[C@H](C)CC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 592678814 GBQURZOJBZTETR-MRVPVSSYSA-N 377.325 5.056 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3c(F)ccc4ccncc34)c2C#N)CC[C@H]1C 598845809 IZROZTUAFBASBI-NEPJUHHUSA-N 379.460 5.245 30 20 GKED C=CCN(C(=O)[C@@H](C)c1ccc(F)c(F)c1)c1nc(-c2ccccc2)cs1 607766397 RRZRSBWVHPLYQL-AWEZNQCLSA-N 384.451 5.411 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC(F)F)[C@@H]1CCc2ccccc21 609080959 QHSHRZLXTTVTEF-GOSISDBHSA-N 385.414 5.091 30 20 GKED C[C@H](CN(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccccc1 609643849 WYOAEMNQIAYRQW-LJQANCHMSA-N 384.479 5.013 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)CSCc2ccc(C#N)cc2)o1 610050523 OADHEACCUSOKHY-HXUWFJFHSA-N 382.529 5.091 30 20 GKED C[C@H]1C[C@@H](C)N(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 610142448 LWXJMWNMBDIVBA-LSDHHAIUSA-N 383.879 5.053 30 20 GKED C[C@H](CC(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 610171991 ZHJOBGDIVHKAHA-OAHLLOKOSA-N 390.405 5.520 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)N[C@@H](C)c1cccc(C#N)c1 610407290 UQJCFHGWUKCRQP-KRWDZBQOSA-N 389.499 5.550 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(C#N)c1 610829961 UFKYXSXWQNOEKS-LSDHHAIUSA-N 377.469 5.607 30 20 GKED CC(C)(C#N)c1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 614160719 YAIUVBYZYCASSS-GASCZTMLSA-N 378.360 5.050 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1N1CCCCCC1 615492385 QLNQYWQDDOWFSZ-UHFFFAOYSA-N 393.531 5.296 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(CC(=O)Nc2cc(C)ccc2C)n1 661115253 AWZFWALUEPKWRY-ICSRJNTNSA-N 397.588 5.166 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(Nc2cccc(C)c2)sc1=S 729472273 ZIJOHQAGRQLOSU-UHFFFAOYSA-N 389.594 5.335 30 20 GKED Cn1c2ccccc2c2cc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)sc21 730937184 YYPDGLBYJLLXAD-UHFFFAOYSA-N 376.485 5.073 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3cccc(C)c3)CCCCC2)c1 733772655 BZRPPHOPKNKQKY-QFIPXVFZSA-N 390.527 5.194 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1nc2ccccc2s1 734209703 FEQJWWVOIRFSBG-UONOGXRCSA-N 396.541 5.431 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)C)c1ccncc1 734666884 NMUMGEMSISNMGZ-RTBURBONSA-N 391.437 5.414 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCSc4ccccc43)n2)cc1 744036119 YADLWKRVUGDUDM-QZTJIDSGSA-N 390.533 5.574 30 20 GKED C=CCN(C(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1)C(C)C 745902943 BKMUOMCNNSYLDY-HXUWFJFHSA-N 390.499 5.382 30 20 GKED C=C(C)COc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)ccc1OC 745990522 RYAUBNOJWYWJMN-WMZJFQQLSA-N 385.463 5.608 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2C[C@H]2c2sccc2C)cc1 748835198 UNFIIRRAJFUVCR-JGNHQEBTSA-N 380.513 5.021 30 20 GKED CC[C@H](Oc1ccccc1F)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 749025593 PVHXPXKNYAOOFW-WFASDCNBSA-N 388.851 5.123 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2ccc(OCc3ccccc3)c(OC)c2)c1C 750913926 RRLOGTAHQRUGES-QBFSEMIESA-N 390.483 5.004 30 20 GKED O=[N+]([O-])c1cccc(-c2nc(C=NOc3ccccc3C(F)(F)F)cs2)c1 754712835 UTWSUKOLYTXAQG-UHFFFAOYSA-N 393.346 5.150 30 20 GKED C=CC[C@H](NCc1c(C(C)C)nn(Cc2ccccc2)c1Cl)c1ccncc1 776186536 UVNPUEPSBQFIJN-NRFANRHFSA-N 394.950 5.510 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1ccc(SC(F)F)cc1 781548316 AGNSCNJTJNFPTG-YFHOEESVSA-N 382.403 5.062 30 20 GKED C[C@@H](NCc1cc(Cl)nc(Cl)c1)c1ccc(-c2cccc(C#N)c2)cc1 782525586 ZWKKNKIVGLBBFV-CQSZACIVSA-N 382.294 5.778 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2cn(C)nc2-c2ccccc2)cc1 782776580 AZDGHHLWCPOIIP-KRWDZBQOSA-N 381.907 5.069 30 20 GKED c1ccc(-c2cc3c(NN=C4CCC5(CCCO5)CC4)ncnc3s2)cc1 788015305 UDYHONUHQQBRKQ-UHFFFAOYSA-N 378.501 5.249 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CSc2ccc3ccccc3c2)s1 797573511 SUXBHWSWMKBWBK-KRWDZBQOSA-N 380.538 5.562 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1cc2ccccc2nc1Cl 801666830 YLXVRNFBPBDTHZ-UHFFFAOYSA-N 394.261 5.085 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1cc(F)c(C(F)(F)F)cc1F 804334180 ARECAONCKMOTAY-UHFFFAOYSA-N 381.247 5.146 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1nc(Cl)c(C#N)s1 804432052 OTTFNHKQJFMYOT-SECBINFHSA-N 378.885 5.412 30 20 GKED CC(C)[C@H](c1ccc(Cl)cc1)c1noc(Cc2ccc(OCC#N)cc2)n1 809500107 CUGSTTQDJAOMSX-HXUWFJFHSA-N 381.863 5.004 30 20 GKED N#CCCCOc1cccc(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1 811468643 AWTZGZKLTZSMKT-UHFFFAOYSA-N 380.231 5.196 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1sc(-c2ccc(F)cc2)nc1C 814820742 OPOTUMKBOVMHCI-UHFFFAOYSA-N 383.452 5.077 30 20 GKED O=C(O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1CC2(C1)CC2(F)F 850870425 PPPZHCBCENERCL-SAVVLTDYSA-N 388.254 5.287 30 20 GKED N#CCCCCC(=O)O[C@H](c1ccc(Br)cc1Cl)C(F)(F)F 851278219 NOUISLGSUXQQIF-CYBMUJFWSA-N 398.606 5.333 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc(-c3ccc(COc4ccccc4)cc3)no2)c1 904446599 QCTGQWFGRMMTBD-XZOQPEGZSA-N 393.446 5.458 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354019 SVLQUAUMSJTRTC-SBUREZEXSA-N 387.458 5.706 30 20 GKED C[C@@H](CCc1ccc(O)cc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354038 TUIXMEBYAWVINP-UUOWRZLLSA-N 399.494 5.190 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 916051838 UOMDVCLTNXEKRE-CMKODMSKSA-N 386.417 5.649 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1ccccc1OC(F)F 916286449 FJZZMMKOQALPCZ-UHFFFAOYSA-N 379.716 5.191 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(C2CCCCC2)cc1 916904736 CXYPSKGIKXPXDD-GOSISDBHSA-N 380.875 5.349 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1ccc(OC(F)(F)F)cc1 918164695 YTQDNATZJSIEFU-UHFFFAOYSA-N 384.398 5.109 30 20 GKED COc1ccc(/C=C2\CCOc3c(ccc(Cl)c3Cl)C2=O)cc1OC 921138613 VCPGORMHLRVKQG-FMIVXFBMSA-N 379.239 5.059 30 20 GKED CN(Cc1cccs1)c1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033899 VZUDSBMLWYNALP-UHFFFAOYSA-N 399.903 5.182 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(-c3ccccc3Br)cc2)c1 1776036992 FAJXUHWZUXXLIX-UHFFFAOYSA-N 395.256 5.260 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](CC2CCCC2)C(=O)O)cc1 1776786240 FERBIOQTQHZUAZ-OAQYLSRUSA-N 375.553 5.407 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776950888 GGRXVGLHZHYHCQ-QBFSEMIESA-N 394.517 6.121 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(-c2ccccc2F)s1 1777268097 ATEYTUNZGSEOLG-HJWRWDBZSA-N 382.412 5.157 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1c[nH]c2ccc(C(=O)O)cc12 1777488166 GTVIKTNJPJILLY-NTMALXAHSA-N 388.448 5.194 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccccc1SCc1cccs1 45244408 BWWLHHABUJWZKI-UHFFFAOYSA-N 378.522 5.184 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1 56300134 HGXVNZWEUWIKTB-UHFFFAOYSA-N 389.282 5.060 30 20 GKED O/C(=N\c1nc(-c2ccccc2Cl)n[nH]1)c1sccc1-c1ccccc1 97576536 NHRGIFCWVIWYKW-UHFFFAOYSA-N 380.860 5.490 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C(C)C 128397148 MIIFNIJPSIQSHN-ZDUSSCGKSA-N 383.517 5.296 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(C[S@@](=O)C3CCCCC3)c2)cc1 133307619 FFDZHSRDCYDLOJ-WRHNGFHOSA-N 396.556 5.171 30 20 GKED C=CCn1c(SCc2csc([C@@H](C)OCC)n2)nnc1-c1cccs1 155882126 BOVCNGCPWDQBPX-GFCCVEGCSA-N 392.575 5.039 30 20 GKED COc1cccc(-c2nc(CNc3ccccc3S[C@H](C)CC#N)cs2)c1 171000042 UPHCNIQBQXIAQR-OAHLLOKOSA-N 395.553 5.825 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1c(F)c(F)cc(F)c1F 175654179 QFCILHPBFAIUPP-UHFFFAOYSA-N 376.334 5.095 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)NCc1ccc(OCC#N)cc1 180551329 RGKYAXYZDTXVCZ-AWEZNQCLSA-N 381.476 5.011 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1NC(=O)c1ccccc1 192823234 VRLBANZXVRYCJV-UHFFFAOYSA-N 397.478 5.301 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(F)c3)s2)c1 237023050 UNEZNQMDRXNSGX-IBGZPJMESA-N 380.488 5.525 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-c3nc4ccccc4s3)o2)c1 237828636 QRFGWXQYRQSWGG-UHFFFAOYSA-N 389.480 5.851 30 20 GKED CC[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1nc(C(F)(F)F)cs1 301432516 PIRDFSVBOOFNIZ-QMMMGPOBSA-N 380.317 5.011 30 20 GKED C=CCOc1c(Br)cc(CN[C@H](C)c2ccc(C)cc2)cc1OC 302979385 UUTWBQLGCMFUSC-OAHLLOKOSA-N 390.321 5.182 30 20 GKED COc1ccc2sc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c(C)c2c1 304067305 TUARJNOLYBOTAM-ZDUSSCGKSA-N 396.537 5.865 30 20 GKED O/C(=N/C1CCN(/C(O)=N\CC2CC(c3ccccc3)C2)CC1)C1CCCCC1 328727159 CZVQTNQMJXAHKJ-UHFFFAOYSA-N 397.563 5.095 30 20 GKED CCCCCCCCCC(=O)N1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 377469274 IVYXEAPMXDIAKJ-ZWKOTPCHSA-N 377.529 5.115 30 20 GKED Cc1c([C@@H](C)NC(=O)c2cnn(CCC#N)c2-c2ccccc2)oc2ccccc12 428218840 CSTYWPMJABCWMQ-QGZVFWFLSA-N 398.466 5.009 30 20 GKED Cc1ccnc2[nH]c([C@H](C#N)C(=O)c3cc4sc5ccccc5c4s3)nc12 429581639 VFISVIDDXFLTMX-GFCCVEGCSA-N 388.477 5.186 30 20 GKED Cc1coc(-c2cc(NC(=O)N[C@H](CCCC#N)c3ccccc3)ccc2C)n1 433281081 APZVXDAHEZBRLX-OAQYLSRUSA-N 388.471 5.515 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc3ncccc23)cc1F 437468899 QLVRGYRSVAZPQU-UHFFFAOYSA-N 383.382 5.290 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c(Br)c1 437647902 FDCAZJLAXDGOKN-APWZRJJASA-N 398.304 5.061 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 438076689 UHHCJEKIUGRZSM-NQIIRXRSSA-N 393.556 6.148 30 20 GKED CC(=O)c1ccc(C#N)c(NCc2nc(-c3ccc(Cl)cc3)c(C)s2)c1 443448067 TUCZFDFLHHQIFT-UHFFFAOYSA-N 381.888 5.458 30 20 GKED C=CCn1c(SCc2nc(C)sc2C)nnc1-c1cccc(Cl)c1 443456181 ROENJGYJIVWMKM-UHFFFAOYSA-N 376.938 5.150 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1-c1ccc(F)cc1 447038182 KVISNJZAGCWUMD-MRXNPFEDSA-N 384.501 5.933 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC)c(OC)c1 459391730 CVIMDWCGVSDCGW-OAHLLOKOSA-N 399.516 5.014 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(C4CC4)CCOCC3)cc2Cl)cc1 462484002 OWQKBEIOQBBVOM-UHFFFAOYSA-N 396.874 5.149 30 20 GKED CC(C)(C#N)CCSc1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1 463035659 HLEMEFPUSQCZPK-UHFFFAOYSA-N 383.904 5.071 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc2ccccc2c1Br 464456720 CPLUUKYGRAZDKA-UHFFFAOYSA-N 379.323 5.208 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc2cnccc12 465170447 WJVFDFGEBYMWNA-UHFFFAOYSA-N 379.419 5.460 30 20 GKED Cc1c(NCC(C)(C)C)cccc1C(=O)Nc1cccc(OCCCC#N)c1 465411231 WGXHDWSPYPILPF-UHFFFAOYSA-N 379.504 5.388 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCC[C@H](C)c1ccc(OC)cc1 466035749 OAJCYTTVFJHQLW-HNNXBMFYSA-N 392.952 5.302 30 20 GKED CCc1oc2ccccc2c1CNc1ccc2c(c1)CCC(=O)N2CCCC#N 469084784 WBNMDAYUPJOTMP-UHFFFAOYSA-N 387.483 5.190 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F 475550066 NHZNLHZLHFORQR-VGOFRKELSA-N 380.507 6.293 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2ccc(C#N)s2)nc1-c1ccc(Cl)cc1 479202557 COPWYFAOJVNGJA-SNVBAGLBSA-N 387.917 5.196 30 20 GKED C=CCn1c(SCc2ncc(C(C)(C)C)o2)nnc1-c1cccc(Cl)c1 481336309 BBYDWPPQEIISBP-UHFFFAOYSA-N 388.924 5.362 30 20 GKED COc1c(Cl)cccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 483329248 ZGGMZTFOPOGJIN-UHFFFAOYSA-N 378.815 5.265 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 483669465 JRXHRUPZPVLMLG-UHFFFAOYSA-N 377.394 5.167 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2cc(Br)ccc2[nH]1)c1ccccc1 487208926 KDNPWQBEIKSOLE-QGZVFWFLSA-N 396.288 5.095 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1ccccc1C(F)(F)F 492585460 WTXUFSCMUDFKFC-NSHDSACASA-N 383.211 5.190 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc2ccccc2n1CC(F)(F)F 493082424 TXPBFFOFLFJHQN-UHFFFAOYSA-N 378.419 5.094 30 20 GKED C=CCc1cc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc(OC)c1O 500153244 YGYXBVRJSDMPGI-QHCPKHFHSA-N 393.914 5.662 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccc(F)cc3)n2)sc2c1CCCC2 502765434 IVCNOCYISVCANR-UHFFFAOYSA-N 383.473 5.013 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Cc1csc(-c2ccccc2Cl)n1 503080122 DQWGENXWNYOAOM-UHFFFAOYSA-N 382.916 5.221 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NCCC3CCCC3)c2)cc1 503287332 OOMJAXZTOBOVIL-UHFFFAOYSA-N 377.488 5.033 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cccc(C)c1)Cc1ccccn1 505041082 YRBMIVLXYDQXGT-UHFFFAOYSA-N 385.511 5.743 30 20 GKED C=CCCc1ccccc1NC(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1 505057302 ICMADDVBOAVDCF-QFIPXVFZSA-N 391.559 5.181 30 20 GKED O=C(Cc1cccc(C(F)(F)F)c1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 509277216 SWFNSHRSROGUPB-HNNXBMFYSA-N 393.302 5.197 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1c(F)cccc1F 510215048 ZHUVJZWWFBJCGI-CYBMUJFWSA-N 395.434 5.018 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 510676057 VCKBTDKIVGMKIP-UHFFFAOYSA-N 383.879 5.197 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2ccccc2OC(F)F)cc1 522811016 QPEFLRBBRTWQPK-UHFFFAOYSA-N 394.377 5.133 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2ccc(C#N)s2)nc1-c1ccccc1 530675835 XLCOYCJDNJIWOK-KRWDZBQOSA-N 391.496 5.375 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)Nc1cccc(C#Cc2ccccn2)c1 534733565 ODAUIPMWYXOTBN-UHFFFAOYSA-N 394.434 5.089 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C1CC1 534967367 OFSWBSIVQDQQGT-GJZGRUSLSA-N 397.548 5.627 30 20 GKED CC(C)c1ccc([C@@H](NCCCC2(C#N)CCOCC2)c2cccs2)cc1 537508171 AWPMXTQKCCNKKY-JOCHJYFZSA-N 382.573 5.651 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2sc(C(C)(C)c3ccccc3)nc2C)n1 537667149 YAXAFPMJXOSYES-OAHLLOKOSA-N 381.526 5.032 30 20 GKED COc1ccccc1CSc1ccccc1NCCCC1(C#N)CCOCC1 538610566 FVQMRWPFIPZNLH-UHFFFAOYSA-N 396.556 5.500 30 20 GKED C=CC[C@H](C)[C@H](C)Nc1ccc(NC(=O)[C@H](C)n2nc(C)cc2C)c(Cl)c1 538634112 HEHYNDRCGHQSKY-JQFCIGGWSA-N 388.943 5.366 30 20 GKED Cc1ccccc1C1=CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 543883478 NYOOKRBLVCHOQO-MRXNPFEDSA-N 377.513 5.178 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944196 IUYUWQVNJCIFIZ-MSOLQXFVSA-N 399.494 5.394 30 20 GKED COc1cccc(C2CCN(C(=O)c3sc4ccc(C#N)cc4c3C)CC2)c1 550306360 XOTWQOOAUXZOBI-UHFFFAOYSA-N 390.508 5.110 30 20 GKED C=CCn1c(-c2sccc2C)nnc1N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 554930963 QLWFRFRPLMMKQW-CQSZACIVSA-N 396.482 5.060 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1cccc2c1CN(c1nccs1)C2 563340817 YNPJSTISWSFEBQ-OAQYLSRUSA-N 386.524 5.415 30 20 GKED Cc1ccc(C[C@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)cc1 564533115 LMDIMYCVYVBYRX-QFIPXVFZSA-N 395.428 5.354 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC23CCC(C(F)(F)F)(CC2)CC3)cc1 571973503 ZYPXMWMBKDGCDD-UHFFFAOYSA-N 379.426 5.265 30 20 GKED C[C@@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)c(F)c1 578611973 DSIMQUKQVSQMET-CWTRNNRKSA-N 378.369 5.398 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 584870542 PNFNNIDOKUFSPR-HNNXBMFYSA-N 390.405 5.004 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N3Cc4cccc(C#N)c4C3)c2)C1 593150319 CDXJKGWOYCIIBE-VGOFRKELSA-N 389.499 5.201 30 20 GKED CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)N(C)CC(C)(C)C#N 597053402 ZMWYDUAZPMJUIM-UHFFFAOYSA-N 379.835 5.094 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccc(SC)c(OC)c1 597504639 AUHGUAHZGSKLKJ-UHFFFAOYSA-N 397.569 5.078 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 599737602 NBUODMMOHYUTBR-KKUMJFAQSA-N 391.487 5.122 30 20 GKED N#Cc1cccnc1N[C@@H](c1ccccc1)c1ccc(Br)cc1F 603871200 YDDHDDAXHIPMCZ-SFHVURJKSA-N 382.236 5.056 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 603968966 PVBRWTSRJPNBBL-UKRRQHHQSA-N 378.419 5.594 30 20 GKED COCc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)oc2ccccc12 603969448 WCHCRMHACMDWHU-UHFFFAOYSA-N 388.448 5.432 30 20 GKED C[C@H](Oc1ccccc1)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378318 CBPZOCASEZBNTN-ZDUSSCGKSA-N 394.418 5.117 30 20 GKED CCOCc1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609503504 AZOLQSJIOHPBMZ-UHFFFAOYSA-N 386.451 5.334 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Nc2ccccc2)c1 609820873 ONSKUMPUWYCNAJ-KRWDZBQOSA-N 387.508 6.077 30 20 GKED COc1ccc([C@H](NC(=O)N[C@H](C)c2cccc(C#N)c2)c2ccc(C)cc2)cc1 610355546 USGLMKVHTQTRRH-HOYKHHGWSA-N 399.494 5.025 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4[nH]c(C)c(C)c4c3)n2)cc1 613315379 PNAJWZHMCZCIIS-IBGZPJMESA-N 385.492 5.707 30 20 GKED N#Cc1ccc(C(F)(F)F)c(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 613873627 AJKZZUJRSLXVOF-UWVGGRQHSA-N 390.249 5.144 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(C(C)(C)C#N)cc1 614185047 IOLASEMJMHCJCD-INIZCTEOSA-N 375.541 5.771 30 20 GKED CC(C)(C#N)CCS(=O)(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 616188394 FNPWXMDXPORWJJ-UHFFFAOYSA-N 396.339 5.437 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H]1CCCCC1(F)F 622485549 QKNFWROSOUOSIK-VXGBXAGGSA-N 389.286 5.251 30 20 GKED C=CCOc1c(Br)cc(CN[C@H](C)c2ccsc2)cc1OCC 669831131 QQMRAIJSPVYVCF-CYBMUJFWSA-N 396.350 5.325 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1C 726081067 IDMPXVQEVASNII-UHFFFAOYSA-N 395.572 6.201 30 20 GKED Clc1ccc(Cl)c(C=NNc2ccc(Br)cn2)c1Cl 727266526 XDMMADFBEKKBJM-UHFFFAOYSA-N 379.472 5.250 30 20 GKED C#Cc1cccc(N(C(=O)c2oc3ccc(CCC(C)=O)cc3c2C)C(C)C)c1 728247834 JEXSFPNXKKAMJK-UHFFFAOYSA-N 387.479 5.299 30 20 GKED Cc1cc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)ccc1N1CCCC1 728463200 WTZDRCHHDLZQCT-UHFFFAOYSA-N 397.478 5.512 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(O)c3ccccc23)cc1 730274628 MSTMIJNGZGJUKP-UHFFFAOYSA-N 398.393 5.601 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(Oc2ccnc3ccccc23)cc1 733212680 NEGIOXIKRLYPKZ-UHFFFAOYSA-N 396.475 5.708 30 20 GKED COc1ccc(/C=C2\CCCc3ccc(Cl)cc3C2=O)cc1OCCCC#N 735232534 OPFHACUHXDIFHI-QGOAFFKASA-N 395.886 5.634 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1c(Cl)nc2ccccn12 737446384 RPRCAGCXCPJJMX-HJWRWDBZSA-N 383.835 5.146 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2C[C@H](C)[C@@H]2c2ccccc2)c1=S 743392654 STGDOPRZPBRHRF-OXJNMPFZSA-N 394.519 5.057 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccc2ccccc2n1 744015367 OYAHOGUDUPGIAO-SQNIBIBYSA-N 381.262 5.522 30 20 GKED N#C[C@@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 744017085 YCXZKESTKASWMK-BJKOFHAPSA-N 390.486 5.828 30 20 GKED N#C[C@@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc(-c2ccccc2)cs1 744037237 QUIUXYHDQDTTBW-MNLRITNHSA-N 386.520 5.960 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)c1)C(=O)O 745021406 NTJQQNFLHLWIHK-WOLCWHLNSA-N 378.449 5.163 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccc(C(F)(F)F)cc1)C(C)C)c1ccncc1 749202006 LARMVVMKTMDJBL-OALUTQOASA-N 391.437 5.414 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)cc1 751517554 MBKSUPFCYVDBBL-WCIBSUBMSA-N 395.462 5.051 30 20 GKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1nc(-c2ccccc2)no1 762810798 DKLJHROSUGMTKF-ZDUSSCGKSA-N 385.876 5.287 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCc1cccc(C(F)(F)F)c1 766838231 WEXRPQUSZDTPDF-KRWDZBQOSA-N 398.384 5.020 30 20 GKED N#C[C@@H](COC(=O)c1ccc(-c2nc3ccccc3s2)o1)Cc1cccs1 772734216 GJYZBJJFJNSQHW-ZDUSSCGKSA-N 394.477 5.157 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Cl)ccc2OC(F)F)c1 772983766 LRPCUJYFNXBIHV-BBRMVZONSA-N 394.849 5.473 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(Cl)c(F)c2)ccc1OC 772987888 YYLSHPPODFBOHV-XJKSGUPXSA-N 376.859 5.019 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@H]1/C=C\c1cccs1 783088546 SIYSYDPONYXSCP-ASDDNKKMSA-N 395.528 5.529 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(-c2ccccc2F)s1 789085141 GNYWQFAIXOYJIY-UHFFFAOYSA-N 377.444 5.232 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1nc2ccccc2s1 789719469 QOUWGRRATOMPCW-OAHLLOKOSA-N 396.581 6.268 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc3c4c(cccc24)CC3)cn1 792870251 PNBQAGCCRIQHSV-NTEUORMPSA-N 392.458 5.300 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1nc(Br)ccc1F 794964686 HJOKIAVCBOXDTO-HWKANZROSA-N 395.278 5.064 30 20 GKED COc1ccc(C(=O)CCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797567100 YNVHBWHPVYCVCK-QGZVFWFLSA-N 398.528 5.069 30 20 GKED C=CCCc1ccccc1NC(=O)CC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C 800591777 DACGWLWYTSQCEH-CTXDPNEZSA-N 398.547 5.312 30 20 GKED Cc1ccc(-c2csc(COC(=O)C[C@@H](CC#N)c3ccccc3)n2)cc1 803512123 IQNVUSAGVFLUGX-LJQANCHMSA-N 376.481 5.249 30 20 GKED Cc1cc(CN[C@@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)ccc1C#N 810135117 IWBOUDRULMWQNZ-QFIPXVFZSA-N 393.531 5.003 30 20 GKED N#C[C@H](C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1cc(C(F)(F)F)ccn1 813217701 NZAJLCKZHYJLSU-KBPBESRZSA-N 386.295 5.013 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2csc(-c3ccccc3)n2)c1 840730157 TZRBANOAFLKCEY-VQIMIIECSA-N 377.513 5.342 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842941543 QRNGEXXHIXTGEG-KOTGUFOOSA-N 376.403 5.319 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2cccnc2)C2CCCCC2)ccc1OC 846151100 VKFOQKISBFJKGT-ZJSXRUAMSA-N 393.531 5.182 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)ON=Cc2cccc(Cl)c2Cl)c(Cl)c1 852120758 ZQHBWZCZBIAMFC-LBPRGKRZSA-N 399.705 5.641 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(C(F)F)cc1)c1nc2ccccc2n1C(F)F 870159237 YLUDOMSSCUPKAA-AWEZNQCLSA-N 389.352 5.178 30 20 GKED Cc1ccc(Nc2nc(Cl)c(C=NNc3nncc4ccccc34)s2)cc1 915909917 UVGSSSVODMIYEQ-UHFFFAOYSA-N 394.891 5.238 30 20 GKED COc1cc(C(C)=NNc2cc(C)c3cc(Cl)ccc3n2)cc(OC)c1OC 916543975 LONKBLUYSSHQOB-UHFFFAOYSA-N 399.878 5.059 30 20 GKED Cc1cc(C)n([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 916975254 AZXAWMASYJTVBI-YOEHRIQHSA-N 398.919 5.104 30 20 GKED N#CCCc1ccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1 932583502 KGFVFDSPNVETBS-SFHVURJKSA-N 376.485 5.121 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1SC(F)(F)F 1776034717 VMCOFYKFLWPJSG-UHFFFAOYSA-N 388.798 5.486 30 20 GKED CC(=NOc1ccccc1C(F)(F)F)c1oc2cc(C)ccc2c1CC(=O)O 1776052018 YVDIYYQWUVWXLK-UHFFFAOYSA-N 391.345 5.190 30 20 GKED Cc1ccc(C)c(C(=O)/C=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c1 1776133762 QEKJFOISPZKSEE-XXFRDUSWSA-N 386.447 5.404 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)ccc1OC1CCCC1 1776782884 JVYKYSQDEXBPRL-LJQANCHMSA-N 395.971 5.955 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(N(C)c2ccccc2)nc1 1776783862 CCIUVFLMQGQFIA-HXUWFJFHSA-N 383.536 5.143 30 20 GKED C=CCC(F)(F)C(=O)Nc1ccc(C2(NC(=O)CCC=C(C)C)CCC2)cc1 1791300421 PMAHNGUJVIELIC-UHFFFAOYSA-N 390.474 5.078 30 20 GKED C=CC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)CCCCC)CC1 1831376297 LTUFVWTYTURMFF-JAXLGGSGSA-N 390.612 5.035 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1cc(Cl)ccc1OC 7664159 WHZZWMAXZWGYBU-GFCCVEGCSA-N 399.343 5.079 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Sc1nc2c(c(C)c1C#N)CCC2 24851598 WBDGCDRSZNFIEI-HOCLYGCPSA-N 393.556 5.383 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCC(=O)c1ccc2ccccc2c1 32789199 UOECBAGLZQWYHG-UHFFFAOYSA-N 399.519 5.183 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)cc1Cl)c1nc2ccccc2n1C(F)F 41558795 GOOLNLVXSKUBGM-LBPRGKRZSA-N 394.208 5.157 30 20 GKED CN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCCCCC1 48161661 KBRMSLKRXPBSSC-UHFFFAOYSA-N 391.515 5.518 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 60043800 REIHFAFQMQXLQP-LJQANCHMSA-N 385.492 5.469 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2cccc(Cl)c2)cc1 65028759 ZOVUOMDYQIFAET-UHFFFAOYSA-N 393.849 5.585 30 20 GKED N#Cc1ccc(CSC/C(O)=N/c2nc(-c3cccc4ccccc34)n[nH]2)cc1 65514565 RKDRWTNDQTWPHY-UHFFFAOYSA-N 399.479 5.018 30 20 GKED N#CCc1ccc(NC(=O)c2cccc(OCc3cccc(Cl)c3)c2)cc1 65632393 KZOPWHYALQCPRV-UHFFFAOYSA-N 376.843 5.237 30 20 GKED Cc1ncsc1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 105012728 JYSHESCJSYZVIC-UHFFFAOYSA-N 398.875 5.091 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(C2CC2)n(C(C)(C)C)n1 108237908 CBCHEJBBLCTSNC-AWEZNQCLSA-N 382.533 5.020 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 123266244 QCMRMBXHUOOJGE-JTSKRJEESA-N 380.451 5.048 30 20 GKED CSCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 131044049 KAOIJBXYCYIWIP-LBPRGKRZSA-N 385.341 5.436 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3cccc(OCCCC#N)c3)c2)n1 150755177 BMBMOJWHYXLHOC-UHFFFAOYSA-N 377.469 5.053 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)N(CCC#N)CCC(C)C 152579663 QVGXTUSPTXCGBM-UHFFFAOYSA-N 388.512 5.136 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(c2ccccc2C)CC1 170703571 JNNSWBNZLWAJIC-UHFFFAOYSA-N 383.451 5.033 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3cccs3)c3ccc(F)cc3)o2)cc1 173307505 JWGMAZKTDOEPFB-UHFFFAOYSA-N 390.443 5.016 30 20 GKED Cc1cc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)c(C)s1 175956521 DJMAEGQAMVVKEO-QGZVFWFLSA-N 381.526 5.083 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(CCC(F)(F)F)cc2)C2CC2)cc1 176302822 QIPWNCOYNDQMTM-UHFFFAOYSA-N 387.405 5.250 30 20 GKED Cc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c(-c2nc3ccccc3[nH]2)c1 179824280 PCQZSCBVLINALB-UHFFFAOYSA-N 392.462 5.346 30 20 GKED N#CC1(C(=O)Nc2ccc(Br)c(Cl)c2Cl)CCCCC1 183633621 DQBNNOCMKRFKSI-UHFFFAOYSA-N 376.081 5.168 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1nc(-c2ccc(F)cc2)cs1 189888719 FOOQIYXIUJQRMK-UHFFFAOYSA-N 394.515 5.982 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCc2noc(C)n2)c1 189913231 XEPLYJNVYKGAEP-UHFFFAOYSA-N 391.471 5.061 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(C#N)c1 190879272 IXRRZEZCFZLLJE-CVEARBPZSA-N 395.553 5.243 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)ON=Cc2ccccc2OC(C)C)c(Cl)c1 255712764 LEAXBBBNWOLMDF-INIZCTEOSA-N 388.895 5.122 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C)Sc2nc(N)c(C#N)cc2C#N)c(C(C)C)c1 303231439 XYYAETUMMXXIAI-AWEZNQCLSA-N 392.528 5.017 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C(/O)N3CCCC34CCC4)s2)cc1 328606377 KISFWTPCDZUWCI-OAHLLOKOSA-N 385.533 5.121 30 20 GKED CCC1(CC)Oc2ccc(N=C(O)N3CCC[C@@H]3c3csc(C)n3)cc2O1 329935550 COEANBFMWHVTMN-MRXNPFEDSA-N 387.505 5.122 30 20 GKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccccc1Cl 330000915 XHKNWCAYIPPGDJ-UHFFFAOYSA-N 376.928 5.499 30 20 GKED CC(C)(C)c1ccc(C(C)(C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1 330007667 DTTPANGGKFLZRD-UHFFFAOYSA-N 384.564 6.101 30 20 GKED CC1CCN(c2cccc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)c2)CC1 330021923 YRWSZMZHWAKCRB-UHFFFAOYSA-N 383.536 5.436 30 20 GKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)CC13C[C@H]4C[C@@H](CC(O)(C4)C1)C3)C(O)=N2 330128811 JQEIKAYZHPFANN-JRHJTHGVSA-N 396.531 5.002 30 20 GKED CO[C@](C)(/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1F 330277156 NWEHEMDLHKINIT-UGKGYDQZSA-N 385.483 5.033 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1c1cccnc1 432771816 ZSFOIHJLEVDHEH-JOCHJYFZSA-N 398.466 5.361 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc(Cl)ccc1F 434149461 ZPJUQKDFYXTXAX-CYBMUJFWSA-N 391.899 5.537 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 436329540 BNMOCTWOYKOUHX-ZVZYQTTQSA-N 399.947 5.802 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)c2ccccc2n1 436867731 FFVRWJWXXAPVEK-CYBMUJFWSA-N 381.888 5.392 30 20 GKED Cc1cc(C)cc(C[C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 438078178 WRSFPLDBDKKPSD-QZTJIDSGSA-N 381.545 5.308 30 20 GKED Cc1cc(C#N)ccc1C(=O)N(C)[C@@H](C)c1sc(-c2ccccc2)nc1C 438933660 PGFIBYYJWQZNCA-INIZCTEOSA-N 375.497 5.132 30 20 GKED C=C(C)CCNC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 452714837 AEWQVNJCFTVGGS-HHUWHTLVSA-N 397.403 5.191 30 20 GKED CCCN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@H](C)c1ccccc1Br 459012190 OKCDTJAYZZPLJC-PMPSAXMXSA-N 392.341 5.014 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1Cl 461046304 PFFMZCOECCTPHN-ZOBUZTSGSA-N 379.674 5.131 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 475580489 YVFJEBKSDQMFHS-DOTOQJQBSA-N 382.470 6.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](CC)Cc1ccc([N+](=O)[O-])cc1 476080901 QLBFWTWXONEDPD-GOSISDBHSA-N 380.488 5.654 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 476342899 VWOVTZPFTOHGNX-HXUWFJFHSA-N 386.499 5.376 30 20 GKED Cc1c([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)oc2ccccc12 479242033 NPDTZXPXVVTVSK-QGZVFWFLSA-N 375.472 5.294 30 20 GKED N#CC[C@H](CC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)c1ccccc1 483094380 XXVIXDJPRHDHQC-CQSZACIVSA-N 383.423 5.114 30 20 GKED COc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)c12 486784433 BIXBJCAXPRUCTO-UHFFFAOYSA-N 397.434 5.022 30 20 GKED Cc1cccc(CN(Cc2ccccn2)C(=O)Nc2ccc(C#N)c(Cl)c2)c1 489049228 XVLKRQKKYYNVPE-UHFFFAOYSA-N 390.874 5.149 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccccc3C(C)(C)C#N)o2)cc1 489811222 KLDRMXXFPGDHGO-UHFFFAOYSA-N 391.496 5.395 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2oc3c(C)cc(Br)cc3c2C)n1 494867914 IEGLUKFTUCNFJD-CYBMUJFWSA-N 389.274 5.067 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 497989250 RIIBHONECWZHKK-UHFFFAOYSA-N 390.251 5.366 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 500449730 HJMZZAVGLXJWKM-QZTJIDSGSA-N 390.508 5.177 30 20 GKED CN(C)Cc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)ccc1Cl 500787253 MYUIYMUTSXJVNN-UHFFFAOYSA-N 389.886 5.193 30 20 GKED CCc1cccc(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 502621250 JYOPNVJRPOXCRR-UHFFFAOYSA-N 385.467 5.538 30 20 GKED CC(C)C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cccs1 504077813 LACHYKVUNHABDD-HXUWFJFHSA-N 379.529 5.206 30 20 GKED N#C[C@@H](NC(=O)c1ccc(C(F)F)cc1)c1ccc(OCc2ccccc2)cc1 505320591 MAFJFDRAUJFQLG-OAQYLSRUSA-N 392.405 5.198 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(Br)c1)c1nc2ccccc2s1 511918707 OXJIHOQIIJFLOF-SNVBAGLBSA-N 391.677 5.202 30 20 GKED N#C[C@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc(-c2ccncc2)cs1 517891577 RMEZYQVHDOCUKP-HXUWFJFHSA-N 387.508 5.743 30 20 GKED N#C[C@@H](NC(=O)C1CC(c2cccc(F)c2)C1)c1c(Cl)cccc1Cl 522204319 VGTSYMZQGWHGPV-QWQCLYJRSA-N 377.246 5.007 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cccc1-c1ccccn1 533650102 SUWICQRASFAOQQ-HXUWFJFHSA-N 396.277 5.359 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)NCCC(C)(C)C#N 541644584 IXEKEYRMBOLHMO-GFCCVEGCSA-N 392.366 5.472 30 20 GKED C[C@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn12)c1ccc(C#N)cc1 548935967 FEJRQZUGQDRORJ-AWEZNQCLSA-N 392.915 5.439 30 20 GKED C[C@H]1CC(CCNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C[C@H](C)O1 549232067 YTLCNHVRPZNBPN-IRXDYDNUSA-N 393.487 5.066 30 20 GKED Cc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)nnn1-c1cccc(Cl)c1 556201129 PXKWSIMSOZAOEZ-IERDGZPVSA-N 393.922 5.315 30 20 GKED CCc1c(C(F)(F)F)noc1NC(=O)c1ccccc1-c1ccccc1C#N 562323012 IOYXRWMNCRHXGX-UHFFFAOYSA-N 385.345 5.047 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)[C@@H](C)c1ccccc1 569534397 KEXZCWLMFLTPCA-SJORKVTESA-N 386.455 5.059 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)CC1 581368178 QCCIQFGUMLITSB-UHFFFAOYSA-N 375.900 5.209 30 20 GKED N#CCCCCC(=O)N(Cc1ccsc1)c1ccc(Br)cc1 593965490 CFHRYRRQUTVZKW-UHFFFAOYSA-N 377.307 5.128 30 20 GKED C[C@H](Nc1ccc(-c2ccccc2)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 598772472 BGTSUUHCQBOFBV-HNNXBMFYSA-N 387.508 5.215 30 20 GKED CCCN(C(=O)[C@H](C)CC#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 598802412 WFYDUQYVHDMIQQ-LLVKDONJSA-N 382.316 5.410 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N1CCc2c(CC#N)cccc2C1 599780041 UTEQBHNGCLEMEU-UHFFFAOYSA-N 391.515 5.048 30 20 GKED N#C[C@@H](C(=O)c1nccc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 603627416 JIBUNHNNIZDNMA-AWEZNQCLSA-N 397.381 5.353 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1ccc(Oc2ccccc2)nc1 603754898 HVOUYDIULGEQDC-UHFFFAOYSA-N 395.418 5.186 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CSc2ccc3ccccc3c2)c1 609066204 BMKLMBZJNGYUBM-UHFFFAOYSA-N 384.407 5.044 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)NC(c2ccccc2)c2ccccc2)c1 609081084 GGWNJTCAAJUPIF-UHFFFAOYSA-N 393.393 5.071 30 20 GKED CC(C)CN(CCc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 609435488 QPLHCPWEJOCIJI-LJQANCHMSA-N 395.572 5.813 30 20 GKED Cc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 609438499 IDAUJXYJQUTNFX-KRWDZBQOSA-N 381.545 5.489 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610323712 ANAJVJUNWYKZPP-RBUKOAKNSA-N 399.494 5.889 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1cccc(COCC(F)(F)C(F)F)c1 611468598 MNMSNWNIZCFXBZ-IBGZPJMESA-N 392.396 5.465 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(-c3ccc(Cl)cc3Cl)no2)cc1 618417229 XQZHVODEPPTGMA-KRWDZBQOSA-N 385.254 5.257 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)C[C@@H](c1ccccc1)C(F)(F)F 728460457 MGJXKPFMBNPNTL-AWEZNQCLSA-N 397.780 5.252 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 729091176 YQQBJSSLQLZOJI-GDBMZVCRSA-N 396.462 5.848 30 20 GKED COc1cc(C2(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)CCCC2)ccc1C 731136519 PIJAZRCZURPVLO-FQEVSTJZSA-N 384.479 5.240 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1OC 731400383 OBCOUGMKLKFVBS-WBVHZDCISA-N 383.517 5.362 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3nccn3Cc3ccccc3)s2)cc1 734095755 SCYLOAXWUMMYJA-SEYXRHQNSA-N 399.519 5.568 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)o1 734304508 LZKZYCZJAXZNTB-YFHOEESVSA-N 391.398 5.247 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(N4CCCC4=O)cc3)s2)cc1 734306412 OGWTUYREPDJPMT-SEYXRHQNSA-N 388.492 5.141 30 20 GKED C=CCN(C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1)C(C)C 735577160 PTLASDMBAFIILP-UHFFFAOYSA-N 381.307 5.224 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC[C@H](C)c3ccccc3)n2)cc1 750328126 JDWHYYRTBXUTSP-JXFKEZNVSA-N 390.508 5.579 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(C)cc3)o2)cc(OC)c1OC 750897174 XRRDFOMKFJKCPN-PKNBQFBNSA-N 378.424 5.177 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)CCCc2cc(Cl)sc2Cl)c1 756233683 NQGSJMXYZWZGSH-CQSZACIVSA-N 395.311 5.034 30 20 GKED COc1cc(Cl)cc(CNc2ccc(OCc3cccc(C#N)c3)cc2)c1O 761213870 JVGYMBZFOAQBJY-UHFFFAOYSA-N 394.858 5.117 30 20 GKED COc1cc(C(=O)/C=C/c2ncc(-c3ccccc3)s2)ccc1OC(F)F 770567447 TXAXZILZXXYNSD-CSKARUKUSA-N 387.407 5.316 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2(Cc3ccccc3)CC2)cc1 775487011 FXLCAKHKVFWSIB-HSZRJFAPSA-N 381.479 5.239 30 20 GKED C#CCCCCC(=O)N(Cc1ccccc1)c1nc2ccc(OC)cc2s1 775610622 IYFBFIOTPWMLKU-UHFFFAOYSA-N 378.497 5.032 30 20 GKED N#Cc1cccc([C@@H](NCc2cc(Cl)ccc2OC(F)F)C(F)(F)F)c1 783672975 YCUCOHZRLKXUTR-OAHLLOKOSA-N 390.739 5.206 30 20 GKED CC(C)(C#N)CCCOC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 783782926 AANJPRSPOUZDEY-UHFFFAOYSA-N 380.872 5.174 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)CCC1 791564188 BJFJDFVVFLCGQE-UHFFFAOYSA-N 398.528 5.234 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1 798008489 MCGAGVAXVRBXAG-AGILITTLSA-N 399.469 5.549 30 20 GKED CC[C@H](NC(=S)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccs1 811708476 ZNHBJAXHFLKXNQ-SFHVURJKSA-N 394.525 5.245 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccc(OCc3ccccc3)cc2)SC1=S 814290857 PYZDFMQBPKSDDI-XDHOZWIPSA-N 381.522 5.043 30 20 GKED C=CC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 837864233 RSIGOAVJRZTBRJ-UHFFFAOYSA-N 386.517 5.008 30 20 GKED Cc1ccc(C/N=C(/NCc2nc(C)c3ccccc3n2)Nc2ccccc2)cc1 849074010 XDHIBLRJNMJUPH-UHFFFAOYSA-N 395.510 5.005 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2csc(CCc3ccccc3)n2)CCC1 899395573 TVBKHCLEEJVTAU-AREMUKBSSA-N 386.586 5.041 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c1 904447010 FUAKXTGARXONFT-VQTJNVASSA-N 380.407 5.067 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3ccccc3SCC#N)sc2C)cc1 912659520 LQADCQMBYFBPHN-UHFFFAOYSA-N 379.510 5.295 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3F)on2)cc1 915086327 TVUHKMVXQGADBN-FQEVSTJZSA-N 397.409 5.388 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 915352556 MFAANNNOMUIJIB-BJKOFHAPSA-N 399.494 5.623 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C)cc2)cc(Br)c1OC(F)F 917143472 FRBLADYYPJSAPR-YVMONPNESA-N 397.215 5.264 30 20 GKED CC(C)c1sc(NC(=O)c2ccccc2OCC#N)nc1-c1ccccc1 920003057 VDZXJQFAACJZSY-UHFFFAOYSA-N 377.469 5.088 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)c(C)n1-c1cccc(Cl)c1 920115970 SWCPQBHZMVTTAN-GOSISDBHSA-N 389.842 5.379 30 20 GKED CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)Nc1ccc(C#N)cc1C1CC1 933843055 VXFRFKSLNFQATJ-NFBKMPQASA-N 389.499 5.067 30 20 GKED CC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1cnc2ccccc2c1C(=O)O 1776022615 ZAZXIRSKJCNEFE-UHFFFAOYSA-N 398.466 5.243 30 20 GKED O=C(O)c1cc2c(C=NNc3ccc(Cl)c(Cl)c3)c(F)ccc2s1 1776032738 OKDRGARAYQSAPE-UHFFFAOYSA-N 383.231 5.491 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(SCc3ccccc3)cc2)cc1F 1776074495 DHQWWTCMEVSVCM-UHFFFAOYSA-N 380.444 5.262 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776120046 UGAPPKNBYLSRQU-CXUHLZMHSA-N 398.502 6.174 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1ccc(Cl)cc1Cl 1776179910 ASQSOHLBTRTIOH-QGZVFWFLSA-N 384.690 5.461 30 20 GKED C[C@@H]1/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2c(O)ccc(F)c21 1776586542 CCCPORPEKDANDG-MKVLZVNKSA-N 394.423 5.341 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc2nc(C(F)F)sc12 1776783684 CJXLSTQUMBBHHB-AWEZNQCLSA-N 384.492 5.527 30 20 GKED CCCCCCCOc1cccc(CN[C@](C)(CCc2ccccc2)C(=O)O)c1 1776788081 PUFJNYYXWKFNPN-RUZDIDTESA-N 397.559 5.602 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)CC2 1777371126 OJZOISSDOQEHHK-RGEXLXHISA-N 384.431 5.273 30 20 GKED CSc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1Cl 1777403488 ZXWCXDSYGYNZTG-KRXBUXKQSA-N 398.867 5.916 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ccc(/C=C/C(=O)O)cc1 1777487696 FQVNPLYEYDYUSN-PWHKKFIBSA-N 393.439 5.252 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ccc(/C=C/C(=O)O)cc1 1777488365 WNAYYDAJYDCNGP-DCIPZJNNSA-N 393.439 5.252 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 24710039 LDSPRNHIBIMITI-UHFFFAOYSA-N 376.843 5.575 30 20 GKED COc1ccc(S[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 51534835 NOUUWEHUZRPFLV-KDOFPFPSSA-N 394.521 5.176 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(CC)cc3)n2)nnc1C1CC1 57594168 MGRRYJCGMYLFOS-UHFFFAOYSA-N 382.558 5.320 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccn(-c2ccccc2Cl)n1 108239464 JNUFQQXUGDAUDR-CQSZACIVSA-N 396.903 5.030 30 20 GKED C[C@@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1F 108965857 RZVJJQSUSGSKOJ-QGZVFWFLSA-N 388.442 5.213 30 20 GKED CN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1nc2ccccc2s1 115014720 PBWVSJAAADZOND-UHFFFAOYSA-N 399.475 5.024 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Oc2nccs2)c1 134747649 VXHCHEXAIDNBKY-CQSZACIVSA-N 395.509 5.582 30 20 GKED C[C@@H](Nc1ccn(CCC#N)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 152780737 IZDPNSXVBICBBL-SNVBAGLBSA-N 376.304 5.007 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)[C@@H]1c1ccc(C(F)(F)F)cc1 156547166 XYZOCPKIRRQZEX-KUHUBIRLSA-N 387.405 5.386 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(NC(=O)c2ccccc2)c1C)c1ccccc1 156657607 OZRNEJZFZZMDQH-LJQANCHMSA-N 384.479 5.546 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCO[C@@H](c4ccccc4)C3)c2)c1 157261656 IXXQWALOTACEIS-AOYPEHQESA-N 398.506 5.147 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccc(F)cc3C(F)(F)F)n2)c1 160775019 KFDVFQFUPINYJI-UHFFFAOYSA-N 391.349 5.092 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)Nc1cccc(COCc2ccco2)c1 171149281 FHLJUDUCMJMAEA-UHFFFAOYSA-N 392.459 5.069 30 20 GKED O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)c1ccccc1C(F)(F)F 181607676 KJKISPACPQSOQZ-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 185322229 AOCXERYBCGPDTR-LPHOPBHVSA-N 379.529 5.307 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2C)c1 189899608 FNDRHMVYHRANMR-HRAATJIYSA-N 376.500 5.385 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2ccccn2)n1 189904338 IOXNYMMHYGTPNZ-UHFFFAOYSA-N 377.513 5.238 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CCSc3ccccc32)c1 237840121 KFXIPIOBFLVXMV-HSZRJFAPSA-N 386.520 5.464 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1cc(F)ccc1F 303390282 XYCFDGJUTZKKHT-AWEZNQCLSA-N 393.393 5.068 30 20 GKED Cc1cccc(N=C(O)[C@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c1C 328700835 MYIINGLNLOJPHE-HTAPYJJXSA-N 391.515 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(n2cc(Cl)cn2)CC1 373701508 SBDRTNKQVUFNBC-UHFFFAOYSA-N 386.927 5.257 30 20 GKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1csc(-c2ccccc2F)n1 417366779 NQWVHFHWKROCEM-JLTOFOAXSA-N 377.488 5.549 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Sc2ccccc2)c1 429917960 CASJQDWJSOCZHA-UHFFFAOYSA-N 376.506 5.706 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ncc(Cc2cccc(Cl)c2Cl)s1 432630455 KOMZNSBYFVVVLQ-UHFFFAOYSA-N 397.331 5.054 30 20 GKED CCOc1ccc(N(C(=O)CC(C)(C)C#N)c2nc3ccccc3s2)cc1 447199452 KUYOPUHKDYXWCF-UHFFFAOYSA-N 379.485 5.300 30 20 GKED FC(F)(F)CCN(Cc1nc2cc(C(F)(F)F)ccc2o1)CC(F)(F)F 447825420 DZKNHNATUABHSN-UHFFFAOYSA-N 394.237 5.163 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@H](C2CCC2)C2CC2)cc1 454532647 VWEVSVGVARHCAA-HSZRJFAPSA-N 389.499 5.032 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccc(Cl)cn2)c1 460326358 CFZFOWSZMXTCAR-UHFFFAOYSA-N 382.250 5.107 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3CC(F)(F)F)c2)cc1 461241930 FHSDOCICOIPKMB-UHFFFAOYSA-N 395.384 5.659 30 20 GKED CCCOc1ccc(CCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 463742808 DAFDESRZNDKWAT-LJQANCHMSA-N 391.298 5.096 30 20 GKED Cc1nc(-c2cccc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)c2)cs1 464944925 ZAZVPWJOKYCOHU-IRLDBZIGSA-N 387.508 5.031 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)cc1 467837949 GAXOPAJWDUNWMX-SHTZXODSSA-N 391.323 5.020 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 468947943 LSBHTXQMPMKIJI-UHFFFAOYSA-N 398.821 5.420 30 20 GKED CSc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1Cl 475973296 AMUOWFBYIFXABJ-SJLPKXTDSA-N 385.920 5.366 30 20 GKED N#CCCn1cc(CN[C@H]2CC[C@H](c3ccccc3F)C2)c(-c2ccccc2)n1 481812273 CPYDNEVHTPUGMK-FPOVZHCZSA-N 388.490 5.029 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)CCCCOc1cccc(C#N)c1 482044210 PYMJSAQGHVHHTN-UHFFFAOYSA-N 393.270 5.061 30 20 GKED CC1(C)C[C@@]1(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 484908258 KNNWFBNVTHUMAU-QFIPXVFZSA-N 394.858 5.087 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl 485031554 HCHWREHJDUZIJV-UHFFFAOYSA-N 389.927 5.067 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@H](C)c2ccccc2Cl)cc1 486113500 DJNWCTXBFAYWOD-MRXNPFEDSA-N 397.906 5.037 30 20 GKED C=CCn1c(SC[C@H](OC(C)C)c2ccccc2)nnc1-c1ccoc1C 488287785 RDVHBGRXJLNFKS-IBGZPJMESA-N 383.517 5.291 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1ccccc1 488697197 VTNZYULNHHQATO-GHTZIAJQSA-N 375.472 5.103 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2ccco2)cc1F 490555008 JZFBBGOKTKAABN-UHFFFAOYSA-N 377.419 5.401 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2-c2c(F)cccc2F)cc1 494519054 AQJOFIDMWYZHJO-UHFFFAOYSA-N 380.419 5.234 30 20 GKED C[C@@H](CC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 501478128 NEQQIBUJVHWQAH-IBGZPJMESA-N 384.479 5.464 30 20 GKED N#C[C@H](NC(=O)[C@H](Sc1ccccc1F)c1ccccc1)c1ccccc1F 505942517 IYKMHLMOZHDKKF-PZJWPPBQSA-N 394.446 5.179 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)ccc2Cl)sc2c1-c1ccccc1CC2 511094967 MZESBVUAGVEUTE-UHFFFAOYSA-N 399.302 5.944 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1)c1ccccc1 513031002 KAKXKNVMUOJCPW-SFHVURJKSA-N 390.405 5.266 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)NC[C@H](C)c1ccccc1 513209645 KNLPNWRPAHUPSA-OALUTQOASA-N 399.494 5.071 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)s2)o1 514224111 XSGPRHVFEWYCHA-ZDUSSCGKSA-N 382.510 5.821 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c1C#N 518361536 LKQFFIPABWEBEK-HUUCEWRRSA-N 378.419 5.252 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)Nc1cccc(C#Cc2ccccn2)c1 522073649 UYIMTMUXZXJUQH-UHFFFAOYSA-N 391.474 5.299 30 20 GKED C=CCCCCCN(C)C(=O)c1ccccc1SCc1cn2ccccc2n1 523545394 ZTSIZTDVNRZGRJ-UHFFFAOYSA-N 393.556 5.445 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl)c1c(Cl)cccc1Cl 524854209 NWNRROAHFSVTBY-FTGAXOIBSA-N 397.664 5.270 30 20 GKED N#Cc1cccc(CN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)c1 532092450 HAHKGGDUGXSCLF-OAQYLSRUSA-N 395.275 5.339 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 532968782 OQJBCBCUIYAOQJ-UHFFFAOYSA-N 391.968 5.659 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1ccc(CC#N)cc1 533940866 YTVKNCCNKRBYMW-CYBMUJFWSA-N 395.915 5.329 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC[C@H]1c1ccc(Br)s1 542403987 CFLOPLWKDWREHS-AWEZNQCLSA-N 390.306 5.060 30 20 GKED C[C@H](NC(=O)c1cccc([C@H]2CCOC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 542929078 QGZIVQHHZSMUIS-BVZFJXPGSA-N 396.490 5.220 30 20 GKED Cc1ccc(-c2csc(Cc3noc(C4(c5cccc(C#N)c5)CC4)n3)n2)cc1 545541294 FFADJBRQIHREDA-UHFFFAOYSA-N 398.491 5.044 30 20 GKED N#CCCn1cc(/C=C/c2nc([C@H]3CCOc4ccccc43)no2)c2ccccc21 545691219 RGDKSQOTPMZEGG-CFGKVWFZSA-N 396.450 5.023 30 20 GKED N#CCCN(C(=O)c1cccc(-c2cscn2)c1)C12CC3CC(CC(C3)C1)C2 547621724 JDOSZOJOAVIDTF-UHFFFAOYSA-N 391.540 5.135 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1nc2ccccc2o1 550417678 SELWKUNZMOOKJR-CQSZACIVSA-N 378.840 5.700 30 20 GKED COc1cc([C@H](C)N[C@@H]2CCc3ccc(C#N)cc32)ccc1OCc1ccccc1 558503969 KBHAIVZBLBCBSO-MHECFPHRSA-N 398.506 5.484 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(c3cccc(F)c3F)CC2)cc1 568461224 FHGXNHUJWZOUIM-UHFFFAOYSA-N 383.442 5.177 30 20 GKED Cc1c(C(=O)N2CCS[C@@H](c3ccccc3)C2)sc2ccc(C#N)cc12 590037049 VFWRVVRLIZFWND-LJQANCHMSA-N 378.522 5.012 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OCc2ccccc2)cc1 590257316 JPYZEHGSTWOHHF-HFZDXXHNSA-N 384.523 6.351 30 20 GKED CC[C@H](OCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 593158037 SDEMQLQFRQOUOQ-PXNSSMCTSA-N 397.544 5.370 30 20 GKED N#CC1(CC(=O)Nc2ccc(Sc3nncs3)c(Cl)c2)CCCCC1 597127978 UPZMWXULRDIVDF-UHFFFAOYSA-N 392.937 5.145 30 20 GKED CCSc1ccccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603623925 POPHXMYLWAQHTH-UHFFFAOYSA-N 375.453 5.110 30 20 GKED CSc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1[N+](=O)[O-] 603969139 GAXIRGNJATTYBA-UHFFFAOYSA-N 395.465 5.169 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 608841405 OKIWLTLYGHGQIC-UHFFFAOYSA-N 395.846 5.651 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Br)cc1F 609384757 QNDMJZOEUFERPA-GFCCVEGCSA-N 379.298 5.452 30 20 GKED COc1ccccc1-c1cccc(NC(=O)CSCc2ccc(C#N)cc2)c1 609526593 GZQUVSSZFIALMD-UHFFFAOYSA-N 388.492 5.106 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C[C@H]3CCc4ccccc43)c2)cc1 609652060 UQEBNWNOKKWECW-JOCHJYFZSA-N 396.490 5.390 30 20 GKED Cc1cccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c1Cl 610399700 YFVVCMPCQMBGCR-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1c(C#N)c(NC(=O)c2cc(F)c(F)cc2Cl)n(-c2ccccc2)c1C 611467185 DACOBXARGBXLPY-UHFFFAOYSA-N 385.801 5.150 30 20 GKED C=CCOc1cccc(CNCc2ccccc2-c2ccc(CN(C)C)cc2)c1 642340411 NJFWNBROHWUKOL-UHFFFAOYSA-N 386.539 5.270 30 20 GKED COc1ccc2c(c1F)CC[C@@H]2NC(CCC(F)(F)F)CCC(F)(F)F 658252984 HEHAOLDUHSPPFL-ZDUSSCGKSA-N 387.339 5.465 30 20 GKED CCCCCN(Cc1ccc(F)cc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726444062 GHCIFTYXQAGQGS-UHFFFAOYSA-N 389.927 5.740 30 20 GKED COc1cc(C(=O)/C=C\c2cccc(OC(F)(F)F)c2)ccc1OC(F)F 727975633 GKIMCNPWFTYRQU-ALCCZGGFSA-N 388.288 5.091 30 20 GKED C=CC1CCN(CC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)CC1 732206288 XPUFOENDRHQJRV-UHFFFAOYSA-N 382.118 5.137 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 732496131 NWOJQKDHUBCZAZ-DZGCQCFKSA-N 385.439 5.036 30 20 GKED Cc1cccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)c1C 734305649 ZDQQQDTZLCXDES-DHZHZOJOSA-N 376.408 5.070 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1)c1ccncc1 734667510 GUFHYYQKLOLDGG-LEWJYISDSA-N 383.923 5.583 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)c(Cl)c1OC 734981700 SCDDCHVIKBNNLQ-UITAMQMPSA-N 384.831 5.568 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](Cc2ccccc2)C2CC2)cc1 736955104 FCWTWEKQQUWKHH-JWQCQUIFSA-N 395.506 5.485 30 20 GKED COc1cc(C(C)=NNc2cccc(C(F)(F)F)n2)ccc1SC(F)F 739421179 FSBSVDTVVSYPGC-UHFFFAOYSA-N 391.365 5.260 30 20 GKED COCc1ccc(/C=C\C(=O)c2sc(-c3ccc(OC)cc3)nc2C)cc1 741841077 JUYAPFCJLDYHNC-JYRVWZFOSA-N 379.481 5.170 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2SCCc3sccc32)cc1 742537762 PGKZEFYNVUZLFR-PZJWPPBQSA-N 390.533 5.373 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(C)(C)C#N 753606463 KGDCTNBVZVWXLQ-SNVBAGLBSA-N 383.300 5.141 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)c1ccc(N2CCOC2=O)cc1 753712529 SPJWEETVIXBAMU-FPYGCLRLSA-N 395.764 5.212 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc3ccc(C)cc3o2)ccc1OC 756040278 JBSMYIIEQXCPIE-APWZRJJASA-N 378.472 5.282 30 20 GKED N#CCCN(C(=O)c1ccc(SC(F)F)cc1)C12CC3CC(CC(C3)C1)C2 763179311 APNVVHWSQGJBJM-UHFFFAOYSA-N 390.499 5.326 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)[C@H](C)c2ccccc2C(F)(F)F)cc1 766484923 BWXZBBHZLWCZJO-OWCLPIDISA-N 376.422 5.278 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2cn(C(C)(C)C)nc2C)cc1 768279185 KYJXPNATMIIUNJ-CVEARBPZSA-N 375.944 5.490 30 20 GKED C#C[C@H](C)N(C)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 770513926 XEYKFADXLAKPGT-INIZCTEOSA-N 392.478 5.217 30 20 GKED C#CCCCCC(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 773376814 SUFNAVZACLGNFC-QHCPKHFHSA-N 376.525 5.428 30 20 GKED Cc1cc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c(C)c(C)c1O 774828895 GPJCOBDJMIBFNV-UHFFFAOYSA-N 386.451 5.020 30 20 GKED Cn1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)c(-c2ccc(C#N)cc2)n1 777917521 AZXZASOTOSAULW-DHZHZOJOSA-N 395.434 5.170 30 20 GKED N#CCOc1ccc(CNC(c2ccccc2Cl)c2ccccc2Cl)cc1 779093138 MDBIYMGLGOUYTG-UHFFFAOYSA-N 397.305 5.775 30 20 GKED N#CCOc1cccc(NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 779585839 KAUVUWYHTSQWIO-UHFFFAOYSA-N 391.858 5.107 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792100014 CLOGUBMCINGJEK-UGKGYDQZSA-N 378.859 5.168 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(C(C)(C)C#N)cc1 796041249 PPRXTNJPHIDUPU-IRXDYDNUSA-N 392.499 5.185 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 796793418 NWRCLDHTBDASQD-XZDPQHSOSA-N 393.314 5.247 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(OC(F)(F)F)cc2)S1 797060574 CENIZSPAFNRFNR-XNTDXEJSSA-N 392.402 5.094 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(F)c(C(F)(F)F)cc1F 804357153 ZSIMLFGPVMHZJP-UHFFFAOYSA-N 386.345 5.242 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)Nc2ccccc2C(F)F)s1 819725698 HRKLQSJNWRAUSK-UHFFFAOYSA-N 388.892 5.415 30 20 GKED CCC[C@@H](OC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 835071002 XTLGDRABWYJTIQ-SWLSCSKDSA-N 383.300 5.108 30 20 GKED CCC(C)(C)OCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 838785808 DUQLEILAVLWYJA-ZDUSSCGKSA-N 397.327 5.498 30 20 GKED Cc1ccc(OCCN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915353533 VBVGZICUILXXNB-DEOSSOPVSA-N 399.494 5.193 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354169 WMCFRVUOUJKXOA-FQEVSTJZSA-N 391.421 5.284 30 20 GKED C/C(C=Nn1c(C)nc2scc(-c3ccccc3)c2c1=O)=C\c1ccccc1 916310357 XYTARSCLPBSBAK-AVLWQJNKSA-N 385.492 5.371 30 20 GKED Cc1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 916652559 CPUHLOLPWLEYFX-SFHVURJKSA-N 380.900 5.499 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 916847665 ODNCEIKKJVCYJS-SFHVURJKSA-N 390.508 5.478 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776113174 AMRULKXNDXMYIE-PKNBQFBNSA-N 380.490 5.731 30 20 GKED CC(C)(C#N)c1ccc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)cc1 1776123519 QQLOYVDRAKFECN-DTQAZKPQSA-N 376.481 5.503 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1cccc(OCc2ccccc2C(=O)O)c1 1776665810 DGTGXMHYRQKWHG-HIQXPHMNSA-N 398.458 5.422 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccc(C(F)(F)F)cc1 1776785296 RMRVQMPWIDJNIT-LJQANCHMSA-N 387.486 6.294 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc(OC)c1O 6639643 MCCBLDGBFYLDIA-ZZXKWVIFSA-N 387.646 5.266 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)n1 41520365 GMRZAXIBLXDZND-QGZVFWFLSA-N 386.398 5.627 30 20 GKED N#C[C@@H](C(=O)c1cccc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 41549145 FMGCCSBFHUPNTM-LBPRGKRZSA-N 380.778 5.459 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)oc1C 56114007 XSFFGJUETBCWQG-UHFFFAOYSA-N 393.446 5.749 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cs1)C1CC1 114991421 OEZAHFKSEHORCO-JXMROGBWSA-N 394.521 5.283 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 116593215 XAUKESHGPCRIHK-RRFJBIMHSA-N 380.419 5.068 30 20 GKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 171402678 PBHLCODUDFSOEQ-SJORKVTESA-N 381.426 5.438 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)CNc1ccccc1S[C@@H](C)CC#N 178391477 CDAQMCJPASRQFE-YJBOKZPZSA-N 399.585 5.090 30 20 GKED CC(C)(C)C[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 179707774 DAKSALPTSCKSAD-LJQANCHMSA-N 394.906 5.529 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccccc2C(F)(F)F)ccc1OC 180810766 CGIMIDUKAAEPTQ-ZBFHGGJFSA-N 392.421 5.246 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C[C@H]1C 247169259 JJZDLCHWPJQVEU-LMMKCTJWSA-N 379.529 5.348 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(F)c(F)c(F)c1 303821364 FPQAUNHANIHEND-UHFFFAOYSA-N 384.382 5.379 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCCC2(C#N)CCOCC2)C1 410413325 KHFIUNXGWKPEEC-VQIMIIECSA-N 380.454 5.189 30 20 GKED COc1cccc([C@@H](NCc2cccc(F)c2C#N)c2ccccc2Cl)c1 427434588 KASNUYYLPOLSII-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2OC3)s1 430602228 KTSUWOZSDDMKBF-AWEZNQCLSA-N 394.521 5.552 30 20 GKED COc1cccc(C)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 436226373 MWDUUQYBSYWBFZ-UHFFFAOYSA-N 392.842 5.573 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2Cl)cc1C(F)(F)F 438644085 VSVUVFQGFAODNM-QGZVFWFLSA-N 393.796 5.599 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 442675481 YVZVMPRQYLVVPN-INIZCTEOSA-N 393.537 5.723 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 446640973 AJGVBERFLGDWQA-OLZOCXBDSA-N 388.327 5.095 30 20 GKED Clc1ccc(OCc2nnc(SCC#Cc3ccccc3Cl)o2)cc1 446973331 CPMLJGOUJMWNKV-UHFFFAOYSA-N 391.279 5.099 30 20 GKED N#CCCC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)c1ccccc1 458809313 AIQAMDUPEKTNNX-JLLPCOHGSA-N 387.527 5.399 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)C2CCC(c3ccccc3)CC2)cc1 463498201 FXMDZRSSTCTDNP-UHFFFAOYSA-N 376.500 5.306 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)cs2)cc1 474434322 SLAQJITVKMMPTL-HNNXBMFYSA-N 397.525 5.279 30 20 GKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 475757827 VMGMIGDYUJAAJZ-APWZRJJASA-N 375.497 5.075 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(C(F)(F)F)c1C 476569127 QHRMJKLQJPHHFZ-UHFFFAOYSA-N 394.441 5.401 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1cccc(-c2ccc(Br)cc2)c1)C1CC1 486385342 CWXLKMUYNCQKNG-CQSZACIVSA-N 398.304 5.272 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl)c1c[nH]c2ccccc12 486436358 SXDDPTJFAFMPQY-XIKOKIGWSA-N 386.282 5.349 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)N[C@H](CCCC#N)c2ccccc2)c1 487328398 VBVXFBYWBLZHCS-JOCHJYFZSA-N 378.516 5.439 30 20 GKED C=CC[C@H](C(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 489705437 VOJHUVPMAMTKTA-HOTGVXAUSA-N 394.462 5.228 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)[C@H](C)c1ccc(C#N)cc1 493976475 IBGIKHBMQRCPKD-VOBQZIQPSA-N 397.316 5.034 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CSc1cccc(C(F)(F)F)c1 498447310 PIRWAOBMTRIMFE-UHFFFAOYSA-N 392.446 5.108 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc(-c3ncco3)cc2)c1 500246756 XTGNWELFADXIMQ-UHFFFAOYSA-N 381.435 5.404 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C(F)(F)F)nc1 500755353 QVNBGIMERMOHHY-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@@H]1C[C@@H](NC2CCC(C#N)(c3ccccc3)CC2)CCN1Cc1ccccc1 507651508 UCBRWMJEZMWOSB-HQMWTILSSA-N 387.571 5.033 30 20 GKED N#Cc1cccc(CN[C@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)c1 512640959 BUDPKYKVPQIJLN-NRFANRHFSA-N 384.376 5.595 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCc2ccccc2CC1 515129962 UYVAYKOTQBSREP-QGZVFWFLSA-N 379.529 5.104 30 20 GKED CC(C)(C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccc(Cl)cc1 515641994 WTIHUFGGTHZKAS-UHFFFAOYSA-N 395.915 5.175 30 20 GKED CC(C)c1ccc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 517447832 SDZVYKLMXKSBHI-QGZVFWFLSA-N 398.597 5.934 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(S[C@@H](C)CC)cc2C)CC1 518514874 CQOHMQRHWSUMNT-KRWDZBQOSA-N 375.582 5.048 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2ccccc2)nc1)c1cccc(Cl)c1Cl 518709347 TYLUZBYKJWWMPV-KRWDZBQOSA-N 398.249 5.175 30 20 GKED C=CCCO[C@H](C)C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 519999990 NWJRUEFKDWMJHX-APWZRJJASA-N 396.918 5.051 30 20 GKED CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520940963 AVWZSRHCWXOVPR-YJBOKZPZSA-N 395.528 5.289 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc3ncsc3c2)cc1 521237118 KIGUNZIASCFOKE-UHFFFAOYSA-N 389.411 5.352 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 522085347 DSOPGWXUFFOCNS-CQSZACIVSA-N 392.484 5.252 30 20 GKED C=CCCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 523227012 RAZJGFMWLFMQID-QAPCUYQASA-N 378.903 5.823 30 20 GKED C=C(C)COc1cc(CNc2ccc(C)c(NC(=O)C(C)(C)C)c2)ccc1OC 532892036 SKJXRFIBAXVPEA-UHFFFAOYSA-N 396.531 5.555 30 20 GKED C[C@H](NC(=O)c1ccnn1C1CCCC1)c1ccc(-c2cccc(C#N)c2)cc1 541072045 FZFQXNIHPDVUAH-KRWDZBQOSA-N 384.483 5.028 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)C[C@H]2CC=CCC2)cc1 541475479 MJZODCXGYIFSBC-KRWDZBQOSA-N 391.471 5.179 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2ccc(Cl)cc2Cl)CC1 552955045 LOYXDDDRUVZOBX-UHFFFAOYSA-N 384.347 5.462 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1csc(-c2ccccc2F)n1 556201649 HMMOLKWIHGATKE-UZLBHIALSA-N 379.504 6.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(Cc2ccccn2)ccc1C 558796987 NQSNRFUDRIOTPM-UHFFFAOYSA-N 399.538 6.477 30 20 GKED CC(C)(C)c1ncc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2OC3)s1 575342247 VMBFHQTVOHSPAP-UHFFFAOYSA-N 395.509 5.185 30 20 GKED N#C[C@@H](C(=O)c1csc(C2CCCCC2)n1)c1cc(C(F)(F)F)ccn1 579937058 BEGSBAMZIYNSKY-CYBMUJFWSA-N 379.407 5.095 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)C(F)(F)F 584251981 OJFSBSGWLZUUPH-CYBMUJFWSA-N 376.378 5.070 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2(C(F)F)CCCC2)cc1 588995042 ZDTSHXUZFYVUMK-UHFFFAOYSA-N 399.441 5.031 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccnc2)cc1)c1nc2cc(F)ccc2s1 592973194 AJBOZOJTWXOYFJ-QGZVFWFLSA-N 389.411 5.113 30 20 GKED COc1ccc2cc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)[nH]c2c1 604458611 OIZQJPWUYCFCDY-UHFFFAOYSA-N 383.407 5.093 30 20 GKED CCCn1c(C)c(C(=O)Nc2cc(C#N)cn2C(C)(C)C)c2cc(OC)ccc21 609358714 PDJYDAATGLKNKJ-UHFFFAOYSA-N 392.503 5.049 30 20 GKED CC[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 609381742 UGCWUCGFGUMEJN-MRXNPFEDSA-N 392.446 5.843 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609724328 KJIBKKOVNDSYMM-UHFFFAOYSA-N 396.796 5.418 30 20 GKED COc1cccc(Oc2ccc(CNc3ccc(C#N)cc3C(F)(F)F)cn2)c1 609961446 MPGGIADHTRDVOK-UHFFFAOYSA-N 399.372 5.385 30 20 GKED CCc1ccc(CC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 610171459 JVFRXTOKWOGIRF-UHFFFAOYSA-N 384.479 5.075 30 20 GKED Cc1ccc(F)c(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 622485204 HHFGXFWQFVFRFU-CQSZACIVSA-N 379.275 5.186 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)cc1Cl 622485711 WDLWGTUMUFSSIO-ZDUSSCGKSA-N 399.693 5.531 30 20 GKED C[C@H]1CC[C@H](c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)O1 624688505 XNSKGCOFZIJNCE-GZMMTYOYSA-N 398.278 5.266 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(C(=O)c3ccc(O)cc3)CC2)cc1 642187867 RDHTZJXDQMGAHO-UHFFFAOYSA-N 396.490 5.026 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1OCC 647374919 OFSWJDNGOGONSP-MRXNPFEDSA-N 384.501 5.088 30 20 GKED CC(CCc1ccco1)=NNc1ncnc2scc(-c3ccc(F)cc3)c12 725839469 RZDUNFNGYCSSDO-UHFFFAOYSA-N 380.448 5.511 30 20 GKED C#Cc1cccc(NC(=S)/C(=C(/O)c2ccc(C)cc2)[n+]2ccccc2CC)c1 726572953 RRZYPSZZHCYARC-UHFFFAOYSA-O 399.539 5.150 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 728175613 YGASBXOBOXOBIA-QRWLVFNGSA-N 397.519 5.141 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)NC1CCCCC1 730954947 POLDOOPVMYHIMC-UHFFFAOYSA-N 387.496 5.330 30 20 GKED CCOc1cc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)ccc1O 731937729 LDMSYBILRSGMGQ-SDNWHVSQSA-N 395.455 5.266 30 20 GKED Cc1ccccc1-n1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 732634237 YEZDTTJXFCAMSM-QHCPKHFHSA-N 392.462 5.089 30 20 GKED N#CCCCCOC(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 733867340 YHVPFSNZVWSBTA-SFHVURJKSA-N 377.868 5.550 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2ccc(Cl)nc2)CC3)cc1 748998755 SGBFEDXMFANQSD-UVTDQMKNSA-N 382.872 5.080 30 20 GKED Cc1cccnc1/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 758951423 DTWKIEUKZBWNEO-YVNCXZRQSA-N 387.870 5.351 30 20 GKED COCCc1nc(C)c(C(C)=NNc2c(Cl)cc(Cl)cc2Cl)s1 770587220 CORFOVUXTCYUJV-UHFFFAOYSA-N 392.739 5.437 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccc(OC(F)(F)F)cc2)cc1C#N 771838541 QVCBUKPYKDMFDW-UHFFFAOYSA-N 395.406 5.053 30 20 GKED C=CC[C@H](NC(=O)c1ccc2cc(Br)ccc2c1)c1ccncc1 773057877 DGNXOLHYEHVDRV-IBGZPJMESA-N 381.273 5.045 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](COc1ccccc1)c1ccccc1 775393105 DDINVTIBIURMGM-QFIPXVFZSA-N 392.886 5.152 30 20 GKED N#Cc1cc(N[C@H](c2ccc(F)cc2)C2CCCC2)ccc1N1CCC(O)CC1 777114294 IMTPFYWOXKQDMT-DEOSSOPVSA-N 393.506 5.002 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(OCC2CCCCC2)cc1 780165931 IWJPCPBJDRNXQN-QGZVFWFLSA-N 378.472 5.189 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CCC)[C@H](O)c1ccccc1 791875002 KYAIHDGQSCCRKL-JTHBVZDNSA-N 380.532 5.562 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 796469113 FLJUMWNHVQKBME-VBKZILBWSA-N 390.405 5.117 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CCO2 806200559 HAXMGIKZLDOPMA-HSZRJFAPSA-N 397.478 5.077 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cn(C)nc2C(F)F)cc1 812241152 DOEWFSMHQBSKNM-XFXZXTDPSA-N 382.410 5.141 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)c2cccc(Br)c2)n1 813072088 HYJWYKSOKKEIMK-RISCZKNCSA-N 377.307 5.009 30 20 GKED Cc1ccc2ncc(C#N)c(N3CCC([C@@H](O)c4ccc(Cl)cc4)CC3)c2c1 813594318 YUWFGTFDCOIMFF-QHCPKHFHSA-N 391.902 5.018 30 20 GKED CCC(=NNc1cccc2cnccc12)c1ccc(OCCCCC(=O)O)cc1 814835757 AQDGCZIROHKJRV-UHFFFAOYSA-N 391.471 5.095 30 20 GKED Cc1cc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)ccc1-c1ccccc1 816775119 MSPJCYDQGSMZKB-UHFFFAOYSA-N 381.357 5.200 30 20 GKED C/C(=C/C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 817318727 HARNWJBTCVQRBW-BDEQVGPYSA-N 384.426 5.243 30 20 GKED O=C(Nc1cccc(NCC(F)(F)F)c1)[C@@H](F)c1ccc(C(F)(F)F)cc1 819569233 JHNHIKMVPRLSBQ-AWEZNQCLSA-N 394.290 5.329 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cnc(-c3ccc(C)c(C)c3)s2)c1 848536479 PRMGWJNVQZOKTF-FQEVSTJZSA-N 391.540 5.398 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)[C@@H](C#N)CCc1ccccc1 862719030 RHIPURSNNJZOSY-GOSISDBHSA-N 393.487 5.053 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC(F)(F)F)cc2)cc1 915086183 IBYVXJPTDKHTGU-HXUWFJFHSA-N 396.368 5.493 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C2CC2)cc1 915350350 UFTKGNLZVRDLTA-RPBOFIJWSA-N 395.506 5.923 30 20 GKED CCCCS[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 918488981 IMKAJFKWAXVLAJ-SWLSCSKDSA-N 378.950 5.562 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3c(Cl)cccc3Cl)cc2)cc1 1776048895 KHDSWPXRDXZRNY-UHFFFAOYSA-N 385.250 5.805 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(OCc2ccc(F)cc2)cc1 1776086696 JAILJENHVYILJY-UHFFFAOYSA-N 392.430 5.247 30 20 GKED O=C(O)[C@@H](Oc1cccc(C=NNc2ccc(F)cc2Cl)c1)c1ccccc1 1776106327 AEKSESRPASZEJQ-FQEVSTJZSA-N 398.821 5.130 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)c1 1776127938 JYVUNHMPYFWSIG-CMDGGOBGSA-N 397.377 5.047 30 20 GKED C=C(Cl)C[C@@H](NCc1cc(F)ccc1Oc1ccc(SC)cc1)C(=O)O 1776142365 YAXVFKUIAOCTKD-QGZVFWFLSA-N 395.883 5.025 30 20 GKED CCCCCOc1cc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)ccc1OC 1776793043 IABCAVAYZFOMQS-QUHSPFQSSA-N 394.467 5.102 30 20 GKED C[C@@H](C#N)Sc1nnc(-c2ccc(Cl)cc2Cl)n1-c1ccccc1 5360757 HDSKWXNCGWEXNG-NSHDSACASA-N 375.284 5.245 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1ccccc1Oc1ccccc1 7975283 ACHRPHGKPHMELA-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C=CCn1c(SCc2ccc(C#N)cc2F)nnc1-c1ccc(Cl)cc1 11389587 JZOALRQWUPZFIJ-UHFFFAOYSA-N 384.867 5.088 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nc2ccccc2n1CC 26035427 YUCNPXONKPNXAE-UHFFFAOYSA-N 383.542 5.065 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(Cl)cc1F 33196127 SVSLUAVFTMQJQF-YUMQZZPRSA-N 391.714 5.118 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2)c1)c1cccc(N2CCOC2=O)c1 60203577 JUZWGWUTQRILEB-OUKQBFOZSA-N 399.446 5.118 30 20 GKED COc1ccc(CC[C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66953926 AGPRAIBMUBSNRF-SJORKVTESA-N 397.544 5.232 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2C[C@H]2c2ccccc2)cc1 67813092 UGPVNFQADKFIQC-FCHUYYIVSA-N 384.504 5.136 30 20 GKED CC(C)(CCC#N)CN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 93317913 JIZVHNSJAIVHNU-UHFFFAOYSA-N 394.494 5.158 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 98028694 VKVBLTXRRVZCGG-UHFFFAOYSA-N 392.846 5.063 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCCCC[C@H]1c1ccncc1 111769211 ALUKMHRALJDDLO-DEOSSOPVSA-N 396.494 5.026 30 20 GKED CCCCCCCCC(=O)N1CCC(C(=O)c2c(F)cc(F)cc2F)CC1 114692173 MPQSGYWFIVSXNI-UHFFFAOYSA-N 383.454 5.276 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1cc2ccccc2o1 159294491 JMHOYETVDKPLAO-HNNXBMFYSA-N 379.485 5.191 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 181042480 MHBAIZLSFBAYGP-KRWDZBQOSA-N 378.501 5.166 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 186320441 ICYMLVIXXFSJNI-QGZVFWFLSA-N 387.458 5.109 30 20 GKED C=C(C)[C@@H](N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 187786286 YZLHUYKJJBUYOS-KPZWWZAWSA-N 398.375 5.218 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(Cc2ccccn2)c1C 188071043 VJJPTTRRVOXPAS-UHFFFAOYSA-N 387.527 5.652 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(-c2ccccn2)c1 189907577 NFISDOXFNDBZJO-UHFFFAOYSA-N 386.495 5.861 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)s1)C(=O)Nc1ccc(Cl)cc1Cl 193467611 QSYPLQKCZHATSQ-DGXRNCNBSA-N 399.686 5.069 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2occc2C)cs1 254985212 JSWBWUCRUMWQMA-YVMONPNESA-N 386.860 5.279 30 20 GKED CCCc1ccc(C(=O)/C(=C(\S)N[C@@H]2CCCC[C@H]2C)[n+]2ccccc2)cc1 280503686 CYEBDQLZFWYAGO-WIYYLYMNSA-O 395.592 5.034 30 20 GKED CN(Cc1ccccc1Cl)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 303611247 LJNNTDNSRFIABL-UHFFFAOYSA-N 390.870 5.063 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 303622335 DERVOXYRUALYKV-JKSUJKDBSA-N 396.462 5.411 30 20 GKED Cc1csc(-c2cccc(N=C(O)N3CCC[C@H](c4nc(C)cs4)C3)c2)n1 328601896 GHYCNYUIANDWIS-INIZCTEOSA-N 398.557 5.309 30 20 GKED O/C(=N/[C@@H]1CC12CCCCC2)C1CCN(c2noc3ccc(Cl)cc23)CC1 329044954 UNOMUPSWDLMMNY-GOSISDBHSA-N 387.911 5.377 30 20 GKED OC(=Nc1ccc(F)cc1Cl)N[C@H]1CCCc2cn(C3CCCC3)nc21 329384832 PRFIEWLOWPGHTJ-KRWDZBQOSA-N 376.863 5.003 30 20 GKED CC[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1nc(C)cs1 329492643 WDMGHODPLGSWQG-AEFFLSMTSA-N 386.565 5.366 30 20 GKED C[C@H](C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 409746283 AANMMLGSMALIKW-YSSFQJQWSA-N 386.417 5.107 30 20 GKED CC1(C)CCC[C@@H]1N(Cc1ccccc1)Cc1nnc(-c2ccc(C#N)cc2)o1 426829480 ZRHQPIQUDITWFC-NRFANRHFSA-N 386.499 5.189 30 20 GKED C=CC[C@@H](C(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644378 IAVNKRYFHXISCR-PKOBYXMFSA-N 378.447 5.033 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1-c1cccs1)c1ccccc1 432685742 HQRSIISHZKZCNK-IBGZPJMESA-N 375.497 5.972 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(Br)ccc1F)c1ccccc1 433157225 LMAHZXRXLWHBGV-INIZCTEOSA-N 390.256 5.145 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@@H]1c1cccc2ccccc12)c1ccccc1 438869513 SFYDZRQNFJUEIJ-BJKOFHAPSA-N 383.495 5.731 30 20 GKED CC[C@H](NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccc(C#N)cc1 447586637 OOEPJDXRYDLPKY-QHCPKHFHSA-N 387.458 5.191 30 20 GKED Cc1ccccc1[C@H]1CN(C(=O)c2ccccc2-c2ccccc2C#N)[C@@H](C)CO1 460379084 FQXRSLNIXAFMAQ-UQBPGWFLSA-N 396.490 5.136 30 20 GKED CC(C)c1nc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 469795524 FDPYDOFUUKZGCY-SJORKVTESA-N 375.541 6.217 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1cn(-c2ccccc2)nn1 471643968 SZTGPKNFFQIJHX-QGZVFWFLSA-N 381.439 5.104 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC[C@@H]1c1ccccc1 472683857 NZFMXUIELSANAN-AVRDEDQJSA-N 375.516 5.535 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@H]1c1cccc(F)c1 475550466 TWOMJSNFYWJEFD-SBUREZEXSA-N 380.507 6.293 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2c(F)cccc2F)C1 475554901 ZNQDQPQPOWADIH-KRWDZBQOSA-N 384.470 5.838 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1 476658333 IISPCJAHAAUGDX-KRWDZBQOSA-N 386.417 5.136 30 20 GKED N#Cc1csc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)c1 476925801 SYVXQTHTWDEGNX-UHFFFAOYSA-N 379.388 5.014 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(Sc3ccc(Cl)cc3)o1)CC2 477704074 PLRPOHVQMMJECD-UHFFFAOYSA-N 380.856 5.159 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)[C@H](C)C(F)(F)F 477967313 PVHABWAXQFNDMY-GFCCVEGCSA-N 396.796 5.417 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1cnn(-c2ccccc2Cl)c1C(C)C 482714837 FHZFGYKDYDZUKH-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CC(C)[C@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccccc1 482990540 IWTWUSDUANQGEA-FQEVSTJZSA-N 388.433 5.279 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)Nc2nccs2)cc1)c1ccccc1 488630168 VMKFQQCQPXKWBQ-LJQANCHMSA-N 391.496 5.084 30 20 GKED C=C(C)CN1CCC(N[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 491037231 OBWPYPXLOWYTOS-QFIPXVFZSA-N 386.486 5.008 30 20 GKED CCN(C(=O)c1ccc(C#N)c(C)n1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496535514 NDFZBMVWVCDKFW-DEOSSOPVSA-N 398.510 5.032 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCc1ccc(OC)c(Cl)c1 497490030 DCLIUGAWWMRDRR-UHFFFAOYSA-N 384.328 5.211 30 20 GKED C=CCn1c(SCc2ccc(OC(F)F)cc2)nnc1-c1ccc(F)cc1 497685064 AXFVVAXXWXBHFI-UHFFFAOYSA-N 391.418 5.164 30 20 GKED Cc1ccc(-c2nnc([C@H](C)N3CC=C(c4ccc(C#N)cc4)CC3)o2)cc1C 502529157 NCCTUXKASUMRIB-SFHVURJKSA-N 384.483 5.075 30 20 GKED COc1ccc(Cl)cc1N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 510746339 GKTVYJJHKLHFBQ-UHFFFAOYSA-N 392.842 5.289 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 514594909 RMUXZOTYNGZKCJ-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1c(Cl)cccc1Cl 517343269 GSGGCYVRLQEFEO-AWEZNQCLSA-N 385.703 5.120 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518166017 SJYQQHFDJOFAIM-HNNXBMFYSA-N 387.936 5.646 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 518661254 WAGLYDQKXSCUDJ-CYBMUJFWSA-N 396.903 5.234 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)cc12 521789590 JBPXWEAKXOJXSS-UHFFFAOYSA-N 398.422 5.262 30 20 GKED CC(C)n1cc([C@@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cn1 522133433 BWLBDKOBZSBDNL-MRXNPFEDSA-N 389.459 5.011 30 20 GKED Cn1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c2ccccc21 524496444 OFHGFGCMZILCEK-UHFFFAOYSA-N 399.425 5.020 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 525521125 HJOIQAXFGUWPGM-SJLPKXTDSA-N 396.462 5.411 30 20 GKED Cc1nc(-c2cccc(NCc3cccc(OCc4ccccc4C#N)c3)c2)no1 533211408 OYWALFNLQZXLQL-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=CCN(C(=O)[C@H]1CCO[C@@H]1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 536123586 YBIVKODVHWZESR-YPMHNXCESA-N 397.327 5.061 30 20 GKED CCN(C(=O)Cc1ccc(N[C@H](C)c2cccc(C#N)c2)cc1)c1ccccc1 538642232 YZAMACXRTSRBLD-LJQANCHMSA-N 383.495 5.327 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)C(=O)Nc1ccccc1C(F)(F)F 540047064 MXPMNWISJSYNHE-SNVBAGLBSA-N 384.810 5.350 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(CCN(CC)CC3CC3)CC2)c1 540049749 FZRRXBUIHAGHGY-UHFFFAOYSA-N 399.579 5.007 30 20 GKED COc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)c(OC(F)F)c1 540202142 MUESRDVEJMEHGN-UHFFFAOYSA-N 394.421 5.125 30 20 GKED C[C@@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541085086 PRGZNGWLQVLVFO-MRXNPFEDSA-N 385.492 5.793 30 20 GKED Cc1occc1-c1nnc(SCc2ccc(CC#N)cc2)n1-c1ccccc1 542216089 BNCAZGBGVZBKOP-UHFFFAOYSA-N 386.480 5.194 30 20 GKED CCOCc1ccc(-c2noc(/C=C/c3cn(CCC#N)c4ccccc34)n2)cc1 545634795 ANBUEVFFHCGOID-OUKQBFOZSA-N 398.466 5.312 30 20 GKED Cc1oc(-c2ccsc2)nc1COc1c(Br)cccc1CC#N 550447773 CXGINMBYYYCHJS-UHFFFAOYSA-N 389.274 5.119 30 20 GKED CC(C)c1ccc(-c2noc(CNc3ccccc3SC[C@H](C)C#N)n2)cc1 553010491 LSYUQQWQOSAUPM-MRXNPFEDSA-N 392.528 5.724 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1 557043646 BZZBPUBITCZKEJ-AWEZNQCLSA-N 391.151 5.038 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)cn1 558271442 IPIMDXULQFIQPK-CVEARBPZSA-N 375.447 5.180 30 20 GKED N#CCCC[C@H](NCc1ccc(Br)c(Cl)c1)c1ccccc1 560561994 MVKUAYODOXAMTE-SFHVURJKSA-N 377.713 5.627 30 20 GKED C=C(C)COc1cccc(NC(=O)N(CC(=C)C)Cc2cnn(C(C)C)c2)c1 563740412 ZQZYCZJDJJNBJG-UHFFFAOYSA-N 382.508 5.029 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccnc3-c3ccccc3)cc2)nc1 565671762 QJFBPEFXQAQSLY-UHFFFAOYSA-N 392.418 5.060 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cn1)c1ccccc1 571972196 DXPVNFGTORSUQL-HTAPYJJXSA-N 393.446 5.260 30 20 GKED Cc1oc(C#N)cc1-c1nc(-c2ccnc(Oc3ccccc3Cl)c2)no1 576312386 WEPHMHNSECIMAZ-UHFFFAOYSA-N 378.775 5.017 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(Br)s1 580864916 CFRNYQYNDILYCD-SECBINFHSA-N 389.240 5.252 30 20 GKED CCOc1ccc([C@H](NC(=O)CCCCCC#N)c2cccc(Cl)c2)cc1 588655107 OQXNGSRFNAGDEG-QFIPXVFZSA-N 384.907 5.418 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(-c2ccccc2C)n1 589288381 PANPLVNMRCGZIH-UHFFFAOYSA-N 388.945 5.662 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3CC(c4ccc(F)cc4)C3)cn2)c1 590069272 NRVDOLDDURVKNU-UHFFFAOYSA-N 387.414 5.017 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 604547999 RLHBMIZRVGCMSQ-ORAYPTAESA-N 393.874 5.343 30 20 GKED N#C[C@@H](C(=O)c1cccc(Nc2ccccc2)c1)c1nc2cc(F)ccc2s1 607274474 JCXJNAQVUSDHMF-SFHVURJKSA-N 387.439 5.669 30 20 GKED Cc1csc(Sc2ccc(NC(=O)CCc3ccc(C#N)cc3)c(C)c2)n1 608848373 PKQHQPRHWPVJHN-UHFFFAOYSA-N 393.537 5.354 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccccc3Cl)cc2)c1 609076474 CMWAKRYAMLOYFQ-UHFFFAOYSA-N 377.831 5.435 30 20 GKED C[C@H](NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1cccc(C#N)c1 610363396 ZBVBDIYYIBVWMG-ZDUSSCGKSA-N 398.434 5.379 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1C1CC1 611197843 GVXAOGWQLHCTRL-SNVBAGLBSA-N 377.275 5.162 30 20 GKED C=CCn1c(S[C@@H](C)c2cc(F)ccc2F)nnc1-c1ccc(F)cc1 615346720 YSRWIBFQBSLRFP-LBPRGKRZSA-N 375.419 5.402 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc(COc2ccc(Cl)cc2)nc1C 620314302 YUPYQYURAWNUOQ-IYBDPMFKSA-N 388.920 5.007 30 20 GKED CC(C)c1[nH]ccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 651266266 JQUNSWIXBIDYFN-LBPRGKRZSA-N 377.391 5.257 30 20 GKED C=CCCc1ccccc1NC(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 669727162 MPXDLIUMDLXAFI-ZIAGYGMSSA-N 394.359 5.400 30 20 GKED Cc1cc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2cc(F)ccc2n1 675789522 DSIDAQSXVILMLA-PHIMTYICSA-N 380.307 5.249 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)C3CCCCC3)n2)cc1 726324454 AFPMVYQZZJWIOE-DNVCBOLYSA-N 382.529 5.601 30 20 GKED N#Cc1ccc(NN=Cc2ccc(CSC(F)F)o2)cc1C(F)(F)F 726425713 CWPZOPVUPFDDRU-UHFFFAOYSA-N 375.322 5.072 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)CCc1ccc(C(C)(C)C)cc1 726755241 CNVOIMIOAYELCE-UHFFFAOYSA-N 385.511 5.052 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccc(O)c(F)c1 728439014 UBNARYZUILBNII-YWEYNIOJSA-N 389.835 5.116 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3c(Cl)nc(Cl)n3C)s2)cc1 728440798 VGZHRHXNWLTKTL-HJWRWDBZSA-N 392.311 5.363 30 20 GKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 728770161 OLTCBMKGUISXGW-LEWJYISDSA-N 399.519 5.688 30 20 GKED CC/C(=C\C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 728811580 CMRWHVNSDOXHHT-OBGWFSINSA-N 383.451 5.486 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 729091208 YQQBJSSLQLZOJI-HOCLYGCPSA-N 396.462 5.848 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)C 729888868 JWZGSCGKJONODJ-MJGOQNOKSA-N 378.472 5.199 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416445 DDRATZUVGXPPTQ-BBRMVZONSA-N 382.460 5.204 30 20 GKED Cc1nc2c(s1)C(=NNc1ncnc3sc(-c4ccccc4)cc13)CCC2 730946406 UDWXDHISYQPKKI-UHFFFAOYSA-N 391.525 5.276 30 20 GKED CC(=O)c1ccc(OC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(F)c1 731989250 ZDIGPLUEQXZHPM-UHFFFAOYSA-N 389.382 5.106 30 20 GKED Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 734644595 SMTIIMAIHDTUJJ-DEOSSOPVSA-N 398.510 5.038 30 20 GKED Cc1ccc(OC(F)F)c([C@@H](C)OC(=O)c2ccccc2SCC#N)c1 734737188 IZAQGOMSRWAUJJ-CYBMUJFWSA-N 377.412 5.130 30 20 GKED Cc1cc(C(=O)CSCc2cc(Cl)ccc2OCC#N)c(C)n1C1CC1 735320236 NIPWGTJFNMRURA-UHFFFAOYSA-N 388.920 5.112 30 20 GKED COc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc(Cl)c1OC 744866396 UERRSHWWPLUYNF-ONEGZZNKSA-N 377.676 5.622 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(-c3ccccc3)s2)c1 756708727 HSZOEPAYDWTECA-PXNSSMCTSA-N 376.525 5.947 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCC[C@@H]2c2ccccc2)cc1 762819096 RDNAZKQGQHFUJS-JWQCQUIFSA-N 395.506 6.101 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)C2CCC(C(F)(F)F)CC2)cc1 766895308 RETDUJGVIJTZMC-UHFFFAOYSA-N 383.410 5.003 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)Cc1csc(-c2cccc(F)c2)n1 767985261 XGDDNSAXLCDESU-UHFFFAOYSA-N 394.471 5.036 30 20 GKED C[C@@H](Nc1ccc(CN2CCc3ccccc32)cc1)c1ccc(OCC#N)cc1 777657435 DFTNEBQZEURWTO-LJQANCHMSA-N 383.495 5.325 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1cccc(Oc2ccc(Cl)cc2)c1 778297663 KKZSFWFNKNDEIZ-HXUWFJFHSA-N 390.826 5.093 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2cccnc2)c2cc3ccccc3o2)c1 779411732 HIXQYOQEZSKVSU-BWKNWUBXSA-N 397.478 5.388 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1csc(Cl)c1 787158227 SCNIQTKRMALJMI-UHFFFAOYSA-N 397.813 5.108 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792101204 FUDZNPLOCQEBKK-WBMJQRKESA-N 385.250 5.185 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc(Br)cc1Cl)c1ccccc1 792865808 CCLAQIIMCVRYDU-ZDUSSCGKSA-N 378.653 5.095 30 20 GKED N#CC[C@@H](CC(=O)OCc1coc(-c2cccc(Cl)c2)n1)c1ccccc1 795989972 IMWPDNAURWRXPO-INIZCTEOSA-N 380.831 5.126 30 20 GKED C[C@@H](Cn1ccc2ccccc21)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 796809449 AJTDZBMYDUCAIE-BBRMVZONSA-N 393.899 5.417 30 20 GKED N#Cc1cccc([C@H]2CN(c3cc(C(F)F)nc4ccc(Cl)cc34)CCO2)c1 808009434 GHQJJLJTYIPOEY-HXUWFJFHSA-N 399.828 5.275 30 20 GKED C=CCOc1c(Br)cc(/C=C\C(=O)c2ccc(F)cc2)cc1OC 810196172 KAIYBOUQKOKSGV-WTKPLQERSA-N 391.236 5.058 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCCc1ccccc1Cl 810529162 AJASCCDQTNTERE-IBGZPJMESA-N 396.918 5.135 30 20 GKED CO[C@@](C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 813060558 DGARTPBCSAASIP-SCLBCKFNSA-N 395.311 5.108 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211975 USMKIZWUSOZEPT-APWZRJJASA-N 392.446 5.235 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1F 814578312 YAJRIJLQVKOFCS-HXUWFJFHSA-N 387.458 5.538 30 20 GKED Cc1sccc1C=Nn1c(C)nc2scc(-c3ccc(Cl)cc3)c2c1=O 814729353 MZVSCUZDIRSCAN-UHFFFAOYSA-N 399.928 5.339 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCC23CCOCC3)cc1)C(F)(F)F 842893671 OMRDABFDFWGWSN-CYBMUJFWSA-N 385.323 5.347 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl 863897780 VRNLHQKNPKIDGR-UHFFFAOYSA-N 385.851 5.119 30 20 GKED N#CC1(CCCC[S@](=O)Cc2nc(-c3ccccc3Cl)cs2)CCC1 899407805 UVNPKHBITBSIOJ-VWLOTQADSA-N 392.977 5.576 30 20 GKED Fc1cc2nc(NN=Cc3c(Cl)ccc(Cl)c3Cl)[nH]c2cc1F 912822300 CFDWIZBBMBYARS-UHFFFAOYSA-N 375.593 5.247 30 20 GKED COc1cc(C(C)=NNc2cc(C)c3ccc(C)c(C)c3n2)cc(OC)c1OC 916542820 AGEDTBUHKOZHAG-UHFFFAOYSA-N 393.487 5.022 30 20 GKED O=C(O)c1cc(NN=CCCCc2ccc(Cl)c(Cl)c2)ccc1Cl 1776033671 PGVOOQHDPGJDIE-UHFFFAOYSA-N 385.678 5.766 30 20 GKED CC(C)c1ccc(NN=Cc2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)cc1 1776060266 MJNCMXJZIPNPGK-HSZRJFAPSA-N 388.467 5.461 30 20 GKED CCCCCCCCCCCCC(C)(C)C(=O)N1CCC2(CC1)C[C@@H]2C(=O)O 1776785268 MOLBVTKXXDHRJP-HXUWFJFHSA-N 393.612 6.037 30 20 GKED CCN(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776855346 CIFFIIUKUGZVQV-UBKPWBPPSA-N 385.463 5.404 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4ccc(C(=O)O)cc4)cc3)coc12 1777449022 FWQJDQLOUBJANJ-AUWJEWJLSA-N 382.415 6.003 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2ccc(C(C)C)cc2)[n+]2ccccc2)cc1 10173286 VWTYRIUHZDYDCA-UHFFFAOYSA-O 389.544 5.457 30 20 GKED N#Cc1cccc(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)c1 36318338 JMTDLFKCTKICKN-UHFFFAOYSA-N 388.279 5.165 30 20 GKED C=CCOc1cccc(N[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c1 62238452 BGZMODLCIFQUSV-JOCHJYFZSA-N 376.431 5.182 30 20 GKED CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 69032042 VJIMIGCVKOBTEQ-ICSRJNTNSA-N 397.906 5.028 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1 120691985 WKNVNWHHWGMVGG-UHFFFAOYSA-N 393.245 5.095 30 20 GKED CCc1c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1CC(C)C 124619369 RXWDVJDIZVUASJ-OAHLLOKOSA-N 385.537 5.140 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 153995845 XRKGIKHMECFBGD-ROUUACIJSA-N 381.545 5.484 30 20 GKED CSc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 171068498 VNPNYPGZCNXZIK-UHFFFAOYSA-N 388.492 5.420 30 20 GKED C=CCCCC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 175647329 VNKVZGMXSDAPDZ-UHFFFAOYSA-N 376.378 5.253 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](CCC#N)c3ccccc3)s2)cc1 181576890 KHOSLBGTCFHYDR-KKSFZXQISA-N 391.540 5.823 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CNC1(c2ccccc2)CCCC1 183538812 MWZBLZZACUNNEH-SFHVURJKSA-N 393.556 5.078 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC/C=C\c1ccccc1 255895613 JHLBCTHJJATREK-JEZWAEDTSA-N 382.554 5.466 30 20 GKED N#Cc1c(Cl)nsc1N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 301955232 LFEXEFNXEWMYSB-ZDUSSCGKSA-N 390.896 5.420 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl 303834711 PFZMJJVKBCUZHS-HZSPNIEDSA-N 388.895 5.473 30 20 GKED C/C(O)=N/[C@H](C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1ccc(F)cc1F 329605808 ZNBZBGDLPDWOFB-DKYLXPRQSA-N 378.463 5.688 30 20 GKED N#CCSc1cccc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)c1 429842718 ZUKIVHZUMBPPIN-UHFFFAOYSA-N 380.419 5.500 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@H](Cc2ccccc2)C1)c1ccccc1 431916740 PHOSHAPIBNHRHW-PUHATCMVSA-N 375.516 5.132 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccccc1 440245456 QBKGKAGRSOQXQC-JOCHJYFZSA-N 397.469 5.464 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCC1CCC(C#N)CC1 441035478 VNYABAYTVFCKFC-MWXLCCTBSA-N 375.516 5.289 30 20 GKED CC[C@@]1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 443572155 RZWLCQGKRKSPNH-UGKGYDQZSA-N 397.906 5.028 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 457449381 ILWHDZJNULATRT-LRDDRELGSA-N 380.797 5.522 30 20 GKED CC(C)Cn1ccc2c(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)cccc21 464417810 IGKDNLMOCCABOJ-QGZVFWFLSA-N 385.389 5.201 30 20 GKED CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 464885074 KLZNXZDUTAZYNF-AVRDEDQJSA-N 394.515 5.263 30 20 GKED CC(=O)c1cc(F)c(NC(=O)c2ccc(C(F)(F)F)c(F)c2C)c(F)c1F 467985284 SFIKLYNLYSHGNY-UHFFFAOYSA-N 393.258 5.025 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 475253295 BWVZAEDVYGUBFB-UHFFFAOYSA-N 381.435 5.404 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccc(F)cc1)N(C)C 475555343 WGRAWZOOVGXFLE-OAQYLSRUSA-N 383.511 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCO[C@@H]1c1ccccc1 475571189 UXECLPUUDHOWKL-NZQKXSOJSA-N 378.516 5.438 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NC(=O)c1ccsc1)c1nccc2ccccc12 483192222 GRMVOYBYQZIBJN-LJQANCHMSA-N 397.459 5.039 30 20 GKED N#C[C@H](C(=O)c1ccccc1NC(=O)c1cccs1)c1nccc2ccccc12 483193260 FEFQAANQFDTZAO-SFHVURJKSA-N 397.459 5.039 30 20 GKED C=C(C)Cn1c(SCc2csc(CCC(C)C)n2)nnc1-c1ccncc1 489404943 JJSYPUVZZBYEIQ-UHFFFAOYSA-N 399.589 5.254 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccccc1Cl 499956879 KFKRTVORBSRZSU-ZQIUZPCESA-N 379.674 5.131 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)n1 506003130 RPLMYRDFGFTZHB-LLVKDONJSA-N 389.452 5.158 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)c1 507659991 MDWJSGYZDQLWAR-UHFFFAOYSA-N 388.279 5.165 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(-c2cccs2)no1 510171951 FGKZGPDIJALDQO-ZDUSSCGKSA-N 390.493 5.585 30 20 GKED CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccccc2)[C@@H]1c1cccs1 517439414 XEQFGAAHUMQMBE-OAQYLSRUSA-N 376.529 5.108 30 20 GKED CCSCc1ccc(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)cc1 518025761 RRUQZRQWGPBUTQ-MRXNPFEDSA-N 379.312 5.241 30 20 GKED N#C[C@@H](NC(=O)Cc1ccc(-c2ccccc2)cc1)c1cccc(C(F)(F)F)c1 518320423 KRARFWOTYTYZFD-OAQYLSRUSA-N 394.396 5.296 30 20 GKED CCC[C@@H](C)[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 519129624 GBKCGSMBLHNQLJ-IIBYNOLFSA-N 378.476 5.178 30 20 GKED N#Cc1csc(CN[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)c1 519725412 KQLPNOQBJJGWML-QGZVFWFLSA-N 386.318 5.031 30 20 GKED C[C@H](NC(=O)NCC1(Sc2ccccc2)CCCC1)c1ccc(C#N)cc1 521347962 BSNFSKDECQFYAK-KRWDZBQOSA-N 379.529 5.024 30 20 GKED N#Cc1cc(Br)ccc1NCc1ccc(Oc2cccnc2)c(F)c1 522900982 JUQMZDKQTIZWIJ-UHFFFAOYSA-N 398.235 5.259 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccs1 524437105 ZIMUHOHEWUYGIN-CQSZACIVSA-N 379.432 5.130 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cccc(OCc2cn3ccccc3n2)c1 532207021 IXRPFUJTHBWWSZ-MOPGFXCFSA-N 396.494 5.197 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC=C(C(F)(F)F)CC3)c2)cc1 535303581 OXQDESWYAIKVDO-UHFFFAOYSA-N 387.361 5.077 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](c1ccc(C)cc1)c1cccnc1 537422517 IJBWZLPLKGDXIZ-XMMPIXPASA-N 395.506 5.197 30 20 GKED C[C@@H](NC(=O)N1CCC(CC#N)CC1)c1ccccc1-c1ccc(Cl)cc1 542849497 HFZWKHUIQSDIRZ-MRXNPFEDSA-N 381.907 5.403 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542974876 QMQGIUMDLXVOBT-MSOLQXFVSA-N 398.510 5.304 30 20 GKED C=CCC(CC=C)C(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1 544254006 MHWBOENDGHWBNI-ZEQRLZLVSA-N 375.512 5.521 30 20 GKED Cc1c(CN2CCC(C#N)(c3ccccn3)CC2)sc2c(Cl)cccc12 552038019 CURICASOEOAGEJ-UHFFFAOYSA-N 381.932 5.316 30 20 GKED COc1ccc(Oc2ccc(CN[C@H](CCCC#N)c3ccccc3)cc2)cc1 552082899 IONDSVCXVWWXKA-RUZDIDTESA-N 386.495 6.012 30 20 GKED CC(C)(CCC#N)CN(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 564496419 LASZTZITQXOMMM-UHFFFAOYSA-N 376.331 5.721 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)NCC(C)(C)CCC#N 568310122 LGGGVVOSDXHDMM-UHFFFAOYSA-N 380.275 5.017 30 20 GKED N#Cc1cc(Oc2ccc(NCc3nc(-c4ccccc4)cs3)cc2)ccn1 571812927 SWUGDIOCULVTIW-UHFFFAOYSA-N 384.464 5.481 30 20 GKED CC[C@@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(C#N)cc1 576695857 HIAXCTQBTAZASR-HOYKHHGWSA-N 383.495 5.612 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1ccc(Br)cc1C(F)(F)F)CC2 580803544 LTSRFFILAKDHGR-QGZVFWFLSA-N 395.222 5.117 30 20 GKED C[C@@]1(Cc2ccccc2C(F)(F)F)CCCN1CCCC1(C#N)CCOCC1 595866820 LZXLDOXVUJEZGO-FQEVSTJZSA-N 394.481 5.203 30 20 GKED N#CCCn1cc(CN[C@@H]2CCCc3ccc(Cl)cc32)c(-c2ccccc2)n1 599023014 PQHQDQTUFCGAFV-JOCHJYFZSA-N 390.918 5.284 30 20 GKED Cc1ccccc1N(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(C)C 609504864 ORRPEUTUSHLJGA-UHFFFAOYSA-N 384.479 5.909 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](Cc1ccccc1)C1CC1 609929641 IAARPCDVNKSYOO-OXQOHEQNSA-N 379.529 5.081 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OC2CCCCC2)c1 609970719 DLTJSZDWLIPPGR-KRWDZBQOSA-N 394.540 6.045 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1cc(F)c(C(F)(F)F)c(F)c1 683189707 NRWNTENVTDZNJI-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 728411930 PSLQAHNQPDJGGQ-FXAWDEMLSA-N 396.446 5.062 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2cc(-c3cc(C)oc3C)nc3onc(C)c23)c1 728479099 HWQKHLWWPQKTME-UHFFFAOYSA-N 399.450 5.056 30 20 GKED CC(=NNc1nncc2ccccc12)c1ccc(SCC(F)(F)F)cc1 741760613 PTNAYRNTQKZLBK-UHFFFAOYSA-N 376.407 5.120 30 20 GKED C/C(=C/C(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 742068374 MMVDZWYVWZVAMT-XSLBHYSZSA-N 378.781 5.143 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(-c3ccccc3)[nH]2)ccc1SC(F)F 742432763 HFQGDHWUSVUNPZ-CMDGGOBGSA-N 386.423 5.296 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 742773809 VWMNQHYKFGGREN-VZUCSPMQSA-N 375.815 5.051 30 20 GKED COc1cc(C(C)=NNc2ncc(C(F)(F)F)cc2Cl)ccc1SC 747601987 HQJNQWRLWQUBOE-UHFFFAOYSA-N 389.830 5.320 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(-c3ccc(C(F)(F)F)cc3)n2)s1 762442206 GZSLLAVEMZYLIH-ALCCZGGFSA-N 390.411 5.658 30 20 GKED C=C(C)Cn1c(-c2ccncc2)nn(CN(CC2CC2)C2CCCCC2)c1=S 764974639 ZZWCKKLFCFPPMG-UHFFFAOYSA-N 397.592 5.054 30 20 GKED C=CC[C@H](N[C@H]1CCCc2nc(-c3ccc(C)cc3)sc21)c1ccncc1 766018874 JLDXETMKRQHZHZ-PMACEKPBSA-N 375.541 5.798 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCCCO[C@H]3CCC[C@@H](C)C3)[nH]c12 766648035 HNGVBEKMUFPAHC-NZSAHSFTSA-N 381.520 5.203 30 20 GKED N#Cc1ccc2ncc(CN(Cc3c(O)ccc4ccccc34)C3CCCC3)n2c1 769383651 GCTOGWWQJVCNPL-UHFFFAOYSA-N 396.494 5.010 30 20 GKED C[C@H]1CN(c2ccc(NC3CCC(C#N)(c4ccccc4)CC3)cc2)C[C@@H](C)O1 770420845 NCXCXVIWWGNQAL-QSSFBDHNSA-N 389.543 5.116 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc(Cl)cc(Cl)c2)ccc1OC 772985020 IMGULKASQVCGQP-FZKQIMNGSA-N 393.314 5.534 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc([C@@H]3CCCOC3)cc2)cc1 779836207 AFRIGVLMMXLKEI-ILBGXUMGSA-N 396.490 5.488 30 20 GKED O=C1/C(=C/c2scnc2C2CC2)CSC/C1=C/c1scnc1C1CC1 782315868 YWZCNPXZFNCJLD-FUJGBLOQSA-N 386.567 5.137 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1c[nH]c2ccccc12 786305544 GUSCVVTXDWVYLU-JXFKEZNVSA-N 395.462 5.162 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2nc(C(F)(F)F)cs2)cc1 787017703 JEDZDDIHKNZDCW-VXGBXAGGSA-N 390.858 5.705 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)COc2c1ccc(Cl)c2Cl 788356302 SLXPPOCWDXJKSP-UTCJRWHESA-N 380.174 5.127 30 20 GKED N#CCOc1cccc(CC(=O)Nc2cc(-c3ccccc3)ccc2Cl)c1 791974167 OFDNYOAXWOANHY-UHFFFAOYSA-N 376.843 5.091 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cc(C)c(OC)c(Cl)c2)cn1 792905263 KOQWNAINTCGGBG-CMDGGOBGSA-N 394.858 5.019 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1csc2cc(C)ccc12 796631656 IAJKJTAZZCGRTD-GOSISDBHSA-N 390.508 5.296 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C2c3ccccc3Oc3ccccc32)s1 797571144 MCGQHKHUQOHQSF-MRXNPFEDSA-N 388.492 5.555 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc2ccccc2c1 813215301 WJZUUXKWLVNCSN-SFHVURJKSA-N 382.385 5.408 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccccc2OCc2ccccc2)SC1=S 814290887 RCMCCBAMBRNOHU-UNOMPAQXSA-N 381.522 5.043 30 20 GKED O=C(/C=C/c1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(C(F)F)nc1 853009630 MHYOFXSRTPNHJG-IEXSPKMKSA-N 393.817 5.127 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc([C@H](O)C(F)(F)F)cc2)cc1 864021008 FJEBVUYAVVCCIE-UGSOOPFHSA-N 385.813 5.587 30 20 GKED C=C[C@@H](CC)CC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 901783513 LKWWYOQWCJHWOZ-LBPRGKRZSA-N 380.366 5.092 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352862 OGAALYJTOPTSOD-GMAHTHKFSA-N 384.483 5.050 30 20 GKED CC(=NNc1ccc(S(=O)(=O)c2ccc(C(C)C)cc2)cc1)c1ccco1 916316705 ITOFKMOSAHZZJS-UHFFFAOYSA-N 382.485 5.072 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc2ccccc2c1 916944552 HRDHSLQRISIWLC-GOSISDBHSA-N 383.234 5.108 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3cc4ccccc4o3)cs2)cc1 920065598 ZZANQXDZMZPYCM-WDZFZDKYSA-N 391.448 5.373 30 20 GKED O=C(O)c1ccccc1NN=Cc1cccc(OCc2ccc(Cl)cc2)c1 1776031967 GUDCROXZYRRKGC-UHFFFAOYSA-N 380.831 5.063 30 20 GKED Cn1c(-c2ccccc2)c(C=NNc2ccc(C(=O)O)c(F)c2)c2ccccc21 1776073109 CNCRDOYZPBOPHY-UHFFFAOYSA-N 387.414 5.129 30 20 GKED Cc1c(/C=C\C(=O)c2ccc(OCC(C)C)cc2)nc2ccccc2c1C(=O)O 1776126332 JCZGYSAGLOZINL-SEYXRHQNSA-N 389.451 5.172 30 20 GKED CC(C)[C@@H]1/C(=C\c2cc(Br)cc(C(=O)O)c2)C(=O)c2ccccc21 1776308794 QEAMFRRQNIESDD-GONKEYIRSA-N 385.257 5.167 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C[C@H](C)c2ccccc2)C(=O)O)c1 1776787929 GMFYLCYMZBUJMN-RDPSFJRHSA-N 397.559 5.772 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(C[C@H](CC)C(=O)O)cc2)cc1 1776789207 VENBAUALQBDDAO-QFIPXVFZSA-N 397.559 6.301 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(/C=C/C(=O)O)o1 1777487701 GLEGCRPDGCNXFC-PNQPDEHRSA-N 399.855 5.359 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2c(Cl)oc3ccccc23)cc1 1777639348 CRPCFUNIIPKYTD-VAWYXSNFSA-N 384.815 5.226 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@@H]3CCC5)s2)cc1 1777671022 UEHWNXFSCAMNCV-RXWSAZGZSA-N 386.472 5.813 30 20 GKED Cc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc(C)c1OCc1cccnc1 32638996 NDYPYELZAJVORH-UHFFFAOYSA-N 399.494 5.331 30 20 GKED CCN(C(=O)CCCCc1nc2ccccc2s1)[C@H](C)c1ccc(C#N)cc1 45499985 HFKCYECNMHKJJX-QGZVFWFLSA-N 391.540 5.490 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccccc2C)cs1 54897224 QBTUMFYZMQRWQE-JLHYYAGUSA-N 376.481 5.341 30 20 GKED CCc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[nH]c(C)c1C(C)=O 65680406 JLJOMLXGEBSNKO-UHFFFAOYSA-N 387.439 5.004 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 108240529 RYVSTGODDYKORG-DLBZAZTESA-N 382.529 5.154 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](c1ccccc1)C1CCC1 108372869 UBPQPOYPICZTEZ-GAJHUEQPSA-N 393.556 5.150 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108529534 GIXAMEJFCANJLH-HZPDHXFCSA-N 383.517 5.220 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1ccc(C2SCCCS2)cc1 110842560 CWAVZNUSTVDPNF-QFIPXVFZSA-N 396.581 5.200 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccccc1OC1CCC1 118544466 VLFAXMXPRPWOLW-MRXNPFEDSA-N 395.528 5.191 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](COCc2ccccc2)c2ccccc2)cc1 123903032 SCRAQVLUKDQIDB-CJFMBICVSA-N 386.495 5.025 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3cc[nH]c23)cc1 173673328 DORXLCVAKZZNTN-UHFFFAOYSA-N 381.435 5.065 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccccc1S[C@H](C)CC#N 174730128 ANYWQFBYGYSRDY-CQSZACIVSA-N 377.469 5.297 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(OCC#N)cc1 181598239 LEVZIRIDXMHXOL-IQGLISFBSA-N 382.463 5.775 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-n3cnc4ccccc43)cc2)n1 182147116 XAIBZGAUGJDYHH-KRWDZBQOSA-N 386.480 5.095 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cn(C(C)(C)C)nc1C 184197165 OPWZPJMLSXHNQK-UHFFFAOYSA-N 388.471 5.171 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1cn(C)c2ccccc12 185727782 NSMYLBFZFSCCKB-JKSUJKDBSA-N 377.513 5.315 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)cc1Cl 189910842 IUDMEIVWAZCGDU-UHFFFAOYSA-N 392.724 6.207 30 20 GKED COc1ccccc1-c1csc(C2CCN(Cc3ccc(C#N)cc3)CC2)n1 191836363 DFIOMLSYQBBSKF-UHFFFAOYSA-N 389.524 5.070 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 247169292 JJZDLCHWPJQVEU-ZIFCJYIRSA-N 379.529 5.348 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1nc(-c2c(F)cccc2F)cs1 278063935 ZFXIACSJACTOTF-RUZDIDTESA-N 382.501 5.057 30 20 GKED C[C@@H](Nc1ccc(CC#N)cc1)C(=O)Nc1ccccc1Sc1ccccc1 302810960 KRANTYZIBOJSJF-QGZVFWFLSA-N 387.508 5.343 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)CCC1=O 329004436 WXHZAVKEVMMQFR-LQNXUBFPSA-N 377.484 5.063 30 20 GKED Cc1cccc2cc(/C(O)=N/[C@@H]3CC4(CCN(C)CC4)Oc4ccccc43)oc12 329406037 BVVKGWKMPJSGLB-LJQANCHMSA-N 390.483 5.034 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1 410393325 PGDGPYQPWYIPKR-UHFFFAOYSA-N 384.479 5.334 30 20 GKED C[C@@H](c1ccc(Oc2ccccc2)cc1)[S@@](=O)CCCC1(C#N)CCOCC1 417194219 MKZSTEUKISTAPO-VKGTZQKMSA-N 397.540 5.389 30 20 GKED N#CCCC[C@H](NC(=O)NC1CC(c2ccc(F)c(Cl)c2)C1)c1ccccc1 431304828 JGDOLNLKZBBROX-NGICGMGXSA-N 399.897 5.459 30 20 GKED COc1ccc2cc(CNC(=O)N[C@H](CCCC#N)c3ccccc3)ccc2c1 431697881 JSKNICSZEPZMEV-HSZRJFAPSA-N 387.483 5.083 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@H](Sc3cccc(Cl)c3)C2)cc1 432697147 GAGNQBQNUWNFMT-IBGZPJMESA-N 399.947 5.540 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(F)ccc1Cl 432880476 NTKFGDZWJUJJNV-UHFFFAOYSA-N 380.806 5.704 30 20 GKED CC(C)c1ccc2ncc(C#N)c(N3CCC(c4ncc5n4CCCC5)CC3)c2c1 432938482 LFSOXHQNUQBYAU-UHFFFAOYSA-N 399.542 5.147 30 20 GKED C[C@@H](NC(=O)CN[C@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 433017285 YCTYGQNJPRYLMZ-NTKDMRAZSA-N 385.511 5.042 30 20 GKED N#Cc1csc(C(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)c1 437389598 LFVCRYWNOAAWPA-KQZSUJQPSA-N 393.537 5.034 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(Cc2ccccc2)no1 439596036 OVDVPKCLZVMTJP-KRWDZBQOSA-N 396.450 5.497 30 20 GKED COCc1nc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(-c2ccccc2)s1 442555995 WITXIZMPRRDJAR-AWEZNQCLSA-N 397.525 5.026 30 20 GKED C=CC[C@@H]1N(Cc2csc(CC(=O)Nc3ccccc3C)n2)CCCC1(C)C 444779722 LGCIMJAMFKVXOS-FQEVSTJZSA-N 397.588 5.199 30 20 GKED C[C@@H](Cc1ccccc1)N1CCC(N[C@H](CCCC#N)c2ccccc2)CC1 449342200 ZTDJMVLDIHBTBR-SQJMNOBHSA-N 375.560 5.107 30 20 GKED Cc1ccccc1N(C(=O)[C@@H](C)c1cccc(C#N)c1)c1nc2ccccc2s1 463066088 BDVIELQQIRJEMF-KRWDZBQOSA-N 397.503 5.945 30 20 GKED C=CCN(C(=O)c1cnnc(-c2ccccc2)c1)c1nc(-c2ccccc2)cs1 463112118 ZCBUKUHDZOYRNQ-UHFFFAOYSA-N 398.491 5.100 30 20 GKED N#CCSc1cccc(C(=O)NC2(c3ccc(Cl)c(Cl)c3)CC2)c1 466790135 SAOMNNWHRVSCTF-UHFFFAOYSA-N 377.296 5.028 30 20 GKED C=CCN(C(=O)c1cc(Oc2ccccc2)ccn1)c1nc2c(s1)CCCC2 467106879 WRSUTTWGPADKAY-UHFFFAOYSA-N 391.496 5.042 30 20 GKED CCOc1ccc(-n2c(Cc3ccccc3)nnc2S[C@H](C)CCC#N)cc1 470453052 STWCNMYHCXLIPM-QGZVFWFLSA-N 392.528 5.041 30 20 GKED CO[C@@]1(C)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 471204550 YVUGNIGWKOFNAO-UGKGYDQZSA-N 397.906 5.028 30 20 GKED N#Cc1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c(OC(F)F)c1 474211615 DQIFUWQDJHGPPT-QGZVFWFLSA-N 383.398 5.028 30 20 GKED CC(C)(CNC(=O)C[C@H](CC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 475532333 ZDYSTSRPJSLUOV-KRWDZBQOSA-N 388.433 5.187 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1 475550467 TWOMJSNFYWJEFD-UZUQRXQVSA-N 380.507 6.293 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](COCc1ccccc1)c1ccccc1)c1ccccc1 476094406 HNDQLUHFDYPAKP-LOSJGSFVSA-N 398.506 5.148 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cc2)cc1 477825468 WKYVTFDLDBVEMZ-FQEVSTJZSA-N 393.402 5.176 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cnc2ccccc12 482570211 UMBGWWPHCKVMJD-UHFFFAOYSA-N 395.487 5.494 30 20 GKED Cc1ccc(Br)cc1NC(=O)c1ccccc1-c1ccccc1C#N 501481546 SQJRHBJIGZLVPT-UHFFFAOYSA-N 391.268 5.549 30 20 GKED C[C@@H](C#N)CN(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 507510115 VPUBMONWVXHCFG-NSHDSACASA-N 396.343 5.013 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1ccc2oc3ccccc3c2c1 514771962 DHSNNXQTHOZGLR-UHFFFAOYSA-N 387.464 5.252 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1cccc(Cl)c1Cl 518207910 ZHVVVOQVMIPHSG-IBGZPJMESA-N 398.293 5.302 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1nc(C(C)(C)C)cs1 520616579 KETPRMVWJMXKCQ-UHFFFAOYSA-N 397.997 5.096 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC[C@H]2CCCCO2)cc1Cl 521107080 YEXMOLUWXRPWHV-UYAOXDASSA-N 382.891 5.283 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C3(C)CCC(F)(F)CC3)n2)cc1 528935109 PZXAVLGYICYBIH-HNNXBMFYSA-N 390.455 5.211 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2c(cccc2[N+](=O)[O-])C1 530394750 YAQJHVWOZRGVBU-UHFFFAOYSA-N 379.460 5.037 30 20 GKED N#Cc1cccc(CC(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)c1 530669872 GONHXFUWUPZYAH-UHFFFAOYSA-N 379.419 5.080 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1ccccc1CCC(F)(F)F 533885908 JGQFYWUSEZZPCV-UHFFFAOYSA-N 394.396 5.229 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)cccc1-c1ccccn1 535845151 NUFULLBUDOTVIN-AWEZNQCLSA-N 387.508 5.367 30 20 GKED C=CCCOCCCCC(=O)N1Cc2cc(OC)ccc2C[C@H]1C1CCCCC1 537188576 KTBHYJVSZJGTEY-DEOSSOPVSA-N 399.575 5.292 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@@H]3CCC[C@H]3c3ccc(C(F)(F)F)cc3)CC2)c1 538579822 ZQLDLMBHMHWYLR-VQTJNVASSA-N 398.428 5.061 30 20 GKED C[C@@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](C)c1ccccc1C(F)(F)F 540741351 FWABJUAZPHMAOZ-LSDHHAIUSA-N 386.417 5.183 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 541076279 ZOUMMOKKLYXCRH-NSHDSACASA-N 382.382 5.144 30 20 GKED C[C@@H](NC1CCN(c2nccs2)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543962829 KWQSNRVRRSNEDY-QGZVFWFLSA-N 388.540 5.001 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccncc3)cc2)sc2ccc(C#N)cc12 550286659 ONCXHSNMSARWLH-UHFFFAOYSA-N 385.448 5.521 30 20 GKED COc1ccc(C[C@@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc2)cc1OC 554997893 QSCCJNDUAWGTAX-DNQXCXABSA-N 398.506 5.136 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC2(CCC2)C[C@@H]1C 555804723 HUPMSXNCAYOHDC-SFHVURJKSA-N 389.499 5.242 30 20 GKED N#Cc1ccc(CS(=O)(=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1F 559191822 KOOPFQSLTALGQZ-NRFANRHFSA-N 399.874 5.055 30 20 GKED Cc1oc(C(C)C)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 560544858 JYAIAEXUODTRGB-KRWDZBQOSA-N 375.453 5.197 30 20 GKED CCSc1cccc(Br)c1NC(=O)N(CCC#N)CCC(C)C 564133510 QVNYQYWCLCXYAP-UHFFFAOYSA-N 398.370 5.355 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)NC[C@H](C)C#N)c2)cc1 570000584 UNJGKVZIGJDOCL-MSOLQXFVSA-N 379.504 5.003 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 576030720 MBPVWJMQSJQKTE-UHFFFAOYSA-N 394.349 5.048 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 581749426 SCTCJRKZIKKIIF-UHFFFAOYSA-N 399.837 5.786 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(Oc3cccnc3)cc2)cc(OC)c1O 583028139 HIXSVQLIWRWNHT-QGZVFWFLSA-N 390.483 5.167 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1 589075288 HYPATQMIJRGIBY-MRXNPFEDSA-N 397.450 5.305 30 20 GKED C=C(C)COc1cccc(NC(=O)CCCc2ncc(-c3ccccc3)o2)c1 589383013 TZACGWCIRCFKPR-UHFFFAOYSA-N 376.456 5.258 30 20 GKED CCCc1c(N[C@@H](C)c2ccc(C(F)F)nc2)cnn1-c1cccc(C#N)c1 595043716 ZJJNJGFSEFEVPR-AWEZNQCLSA-N 381.430 5.202 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3CC[C@@H](C3)C2)cc1Cl 596689985 DKJHFKOWOMJLRZ-TWOQFEAHSA-N 379.891 5.259 30 20 GKED Cc1oc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1C 609164624 SJFVENDPEZDULX-LJQANCHMSA-N 378.859 5.766 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1N[C@H](C#N)Cc1ccccc1 609387072 JGWQQTALHKYCCO-INIZCTEOSA-N 375.419 5.258 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCO[C@H](c2ccccc2)C1 609435040 MRIPFXLDRYROAU-PXNSSMCTSA-N 395.528 5.076 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)CC1 609636133 VDDZKQYTIOLHLI-GOSISDBHSA-N 378.476 5.036 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 610187189 YQWVONHWNCKGOO-PNCHPQGNSA-N 397.478 5.152 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 610343399 FTFWAJHXUZAJST-NEPJUHHUSA-N 386.339 6.008 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(C#N)c1 610408108 IUYDIPDYAMZJDH-FQEVSTJZSA-N 383.495 5.340 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1ccncc1 610722650 QJNAVRVWDPBENK-QGZVFWFLSA-N 387.458 5.128 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)cc1)c1nc2cc(Cl)ccc2s1 613403885 XECGPSNIOCGCBP-LBPRGKRZSA-N 391.677 5.202 30 20 GKED Fc1cccc2ncnc(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c12 614305662 KKEYDHMXBVZFNS-RKDXNWHRSA-N 381.295 5.090 30 20 GKED C[C@H](NC(=O)NC(C)(C)CC(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 614822495 CUYLGIOFXWSNGT-AWEZNQCLSA-N 389.421 5.316 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1c1ccccc1Br)c1ccccc1 619439293 VYACEKZBXZMNDN-XLIONFOSSA-N 397.316 5.200 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 619804392 UPCYALQVDAPEJZ-RXVVDRJESA-N 395.934 5.941 30 20 GKED Cc1noc(C(F)F)c1C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 673632254 VJNNYUUBBLUFKW-UHFFFAOYSA-N 388.214 5.211 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccc(C)cc2)c2ccc(OC)cc2)c1 726479260 XVRCVRDULFZBEI-QHCPKHFHSA-N 386.520 5.061 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCCCc2nc3ccccc3s2)cc1 726941817 KZQBHXMYTRWRMY-UHFFFAOYSA-N 377.513 5.264 30 20 GKED N#CCOc1ccc(CC(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1 731959725 RSQFXDFDGSWNQB-UHFFFAOYSA-N 399.475 5.047 30 20 GKED C=CCN(CC1CCCCC1)C(=S)Nc1cc(OCC)ccc1OCC 732625575 QFLPKGPRZTUNCW-UHFFFAOYSA-N 376.566 5.249 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)OC(=O)c1ccccc1OCC#N 734737728 BAWWCMCNJQSISI-AWEZNQCLSA-N 396.443 5.078 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cccc(CSC2CCCCC2)c1 735018807 VVGNWIAPULVGBR-UHFFFAOYSA-N 380.513 5.407 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc(N2CCCC2)c1 739522609 DXCPABISFYHSJZ-UHFFFAOYSA-N 390.405 5.123 30 20 GKED O=C(/C=C\c1cnc2ccccn12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 740765378 YHDQNHAHDRKOAO-PLNGDYQASA-N 384.279 5.268 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(COCc2ccccc2)cc1 741712456 BMYHDWJVDOTKMD-UHFFFAOYSA-N 388.492 5.271 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccccc2)n1C)c1nc(-c2ccccc2)cs1 741884427 DTYVVBIBOJRNSG-UHFFFAOYSA-N 399.519 5.648 30 20 GKED C[C@H]1/C(=C/c2cnc(-c3ccccc3)nc2)C(=O)c2cccc(Br)c21 742435100 QCLDEURUWCXKEE-NWRYFCBHSA-N 391.268 5.290 30 20 GKED N#Cc1ccc(F)c(CNC(=O)c2ccc(-c3ccc(Cl)cc3)cc2F)c1 742733696 NKSKMLLHPZQJKF-UHFFFAOYSA-N 382.797 5.087 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1sc2ccccc2c1Cl 744754883 BUIVEONNHGAKLM-UHFFFAOYSA-N 384.917 5.293 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746660935 VTMDKMIVJLAWHZ-VWLOTQADSA-N 397.522 6.032 30 20 GKED N#Cc1csc(/C=C/C(=O)c2ccc(Br)cc2Br)c1 748439572 WHZNXZAQKNZYOZ-DUXPYHPUSA-N 397.091 5.041 30 20 GKED Cc1cccc(C)c1N=C1NN=C(c2cc(C)n(CC(F)(F)F)c2C)CS1 749951780 CJEPOMODPSHKSN-UHFFFAOYSA-N 394.466 5.012 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCCOc3ccccc32)cc1 750304020 UUHNPCFPEPWYRQ-DHIUTWEWSA-N 397.478 5.377 30 20 GKED C[C@@H]1CCC[C@@H](CC(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)C1 750667753 KUWAXBTWQCXFNT-GGPKGHCWSA-N 390.483 5.343 30 20 GKED C#CCN(C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C1CCCCC1 750733370 MALFIMHKDDVHNY-UHFFFAOYSA-N 392.446 5.237 30 20 GKED Cc1sc2ncn(N=Cc3ccccc3C3CC3)c(=O)c2c1-c1ccccc1 751130242 VLPXBKSDTAZVFI-UHFFFAOYSA-N 385.492 5.193 30 20 GKED C[C@@H](OC(=O)/C=C/c1ccccc1C#N)c1ncc(-c2ccc(Cl)cc2)o1 751656635 CPXFMDWHJBJNDE-BMGYJQCNSA-N 378.815 5.184 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCc2[nH]c3ccc(F)cc3c21 753143608 WFEIJJXHGGWQKU-LCYFTJDESA-N 375.428 5.038 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=S)Nc1ccccc1C#N 753905658 LYOIAQYAKHWRNV-UHFFFAOYSA-N 382.489 5.023 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C 757852307 TURNEWWAFDPVDV-NRFANRHFSA-N 395.503 5.157 30 20 GKED N#CCCCOc1cccc(CN2CCCCC[C@@H]2C[C@@H](O)c2cccs2)c1 770291007 GMJZUTKMBPEGJF-IFMALSPDSA-N 398.572 5.299 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(C#N)c(F)c1 776860013 AKQBUULEVHZKJL-LBPRGKRZSA-N 383.810 5.369 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)C(=O)c2ccccc2C1 778520296 SFZJCVYGCGBHAM-LDADJPATSA-N 391.854 5.228 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@@H]1/C=C\c1cccs1 783088547 SIYSYDPONYXSCP-YXZPIEPFSA-N 395.528 5.529 30 20 GKED Clc1ccc(Cl)c(C=NNc2nnc(-c3ccccn3)s2)c1Cl 788030932 SBVLLVYCQZUMEH-UHFFFAOYSA-N 384.679 5.006 30 20 GKED COc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1C(F)(F)F 790605970 ANIDDQOKSBHUIU-UHFFFAOYSA-N 385.798 5.048 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CCc3c(Cl)cccc3C2=O)cn1 792889632 ILNAWIZQAMGYAG-RVDMUPIBSA-N 376.843 5.018 30 20 GKED C#Cc1cccc(NC(=O)N2CCC(F)(c3ccccc3C(F)(F)F)CC2)c1 799205779 FVJWDALGHKHJBJ-UHFFFAOYSA-N 390.380 5.179 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](c1ccccc1)[C@H](O)c1ccccc1 808722591 DLQRPGJCROHTBI-KKUQBAQOSA-N 382.507 5.390 30 20 GKED N#Cc1ccccc1NC(=S)N(CC1CC1)c1cccc(C(F)(F)F)c1 811712904 KVXCXCKOTAJCDD-UHFFFAOYSA-N 375.419 5.190 30 20 GKED C[C@@H](CC(C)(C)C#N)OC(=O)c1csc(-c2ccc(Br)s2)n1 851208650 ADZUZANBOHUOQH-VIFPVBQESA-N 399.335 5.119 30 20 GKED CCc1ccccc1NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1 915051633 KQUVZIGNJDAIPX-UHFFFAOYSA-N 381.483 5.002 30 20 GKED CCOc1ccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915124278 CBHVAEIVCHOCDN-JOCHJYFZSA-N 387.508 5.550 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2Cc2ccccc2)cc1 915352380 HCKQWCDJRCFZAU-JWQCQUIFSA-N 395.506 5.581 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccsc1)c1nc2cc(C(F)(F)F)ccc2s1 917043874 PRVQVUMMSYCBQZ-AZEYQONTSA-N 378.400 5.266 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(OCc3nccn3C)cc2)c2ccccc12 917517469 FZZSMVSMYGPFSO-UKTHLTGXSA-N 398.462 5.057 30 20 GKED CCCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Cl)cc1Cl 1776033620 JELSCUOPQYNEQF-UHFFFAOYSA-N 385.678 5.961 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1 1776125575 MATPLMUZYDAOMD-XATQLNLPSA-N 394.511 6.185 30 20 GKED CCCCCCCOc1cccc(CN[C@@H]2CCCC[C@H]2CCC(=O)O)c1 1776787277 KJZGBRPDBHPOJK-RBBKRZOGSA-N 375.553 5.549 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CSc4c(F)cccc4C3=O)s2)c1 1777684366 WHJHXXAZDGDETR-GXDHUFHOSA-N 396.464 5.624 30 20 GKED N#CCCCSc1nnc(-c2cccnc2)n1-c1ccc(Cl)c(Cl)c1 21738852 IMLSRZGHVKUWKU-UHFFFAOYSA-N 390.299 5.032 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1ccoc1C 25520284 ZUJHZMPDAPYWSY-UHFFFAOYSA-N 384.486 5.041 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C[C@H](C#N)CCC#N)cc1C 27389608 GLCPNIMZEGTETO-NRFANRHFSA-N 397.526 5.032 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)N[C@H]2CCCC[C@@H]2C)cc1 27486990 CJDOVOIPSCARKS-FPOVZHCZSA-O 395.592 5.006 30 20 GKED Cc1nc(-c2ccccc2)c(/C(O)=N/c2nnc(Cc3ccccc3)s2)s1 29474914 MIZKRBZKIJMLTK-UHFFFAOYSA-N 392.509 5.197 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H](Oc2ccccc2)c2ccccc2)c1 55570467 KXMPFBHBWGGZLS-QHCPKHFHSA-N 386.451 5.128 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1sc2c(c1C#N)CCC2 61046916 MUIXZPOPNKQQDM-UHFFFAOYSA-N 399.928 5.446 30 20 GKED CCOc1ccc(-c2noc(CNc3ccccc3S[C@@H](C)CC#N)n2)cc1 66861323 SHDPVHAXEIDQBS-HNNXBMFYSA-N 394.500 5.142 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1 66954789 DIBIIBLOHRNZOT-VFNWGFHPSA-N 395.528 5.362 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cc(F)ccc1F 66956085 CUDJUAVBOMDAKZ-ZIAGYGMSSA-N 389.471 5.584 30 20 GKED C[C@H](Sc1cc(C#N)ccn1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 127202365 DOFBVMZNZFSTKT-VIFPVBQESA-N 377.256 5.163 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 129674696 XZADAKFMCOCUBQ-CYBMUJFWSA-N 391.899 5.395 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccccc3Sc3ccccc3)o2)cc1 132924636 JTZQULZCCOCLOC-UHFFFAOYSA-N 384.464 5.372 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2F)n1)[C@H](C)c1ccc(C#N)cc1 148389489 AOPOJKGFCSSCDX-CQSZACIVSA-N 379.460 5.044 30 20 GKED CCN(C(=O)CNc1ccccc1S[C@@H](C)CC#N)[C@@H](C)c1ccc(F)cc1 153953342 PYQVRPKDSQHXGW-IRXDYDNUSA-N 399.535 5.242 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 170992910 VJLCZSORICGJRI-HXUWFJFHSA-N 389.503 5.355 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 179440755 OLOZVZGVPIAPDR-GDBMZVCRSA-N 394.462 5.228 30 20 GKED O=C(CCSc1ccccc1Cl)NCC#Cc1cccc(C(F)(F)F)c1 247755097 CVNFPQYYCJPIQJ-UHFFFAOYSA-N 397.849 5.009 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(Oc2ccc(Cl)c(C#N)n2)cc1 301510020 DWTYDTJPJWEPPO-UHFFFAOYSA-N 398.249 5.329 30 20 GKED OC(=Nc1cccc(-c2cnco2)c1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329418343 DSTVRFJEPADPJX-GOSISDBHSA-N 390.487 5.436 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1sc2ccc(C#N)cc2c1C 429925482 LODRVLZYYJHWIN-UHFFFAOYSA-N 386.480 5.136 30 20 GKED CO[C@@H]1CCC[C@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 432713053 GZDRRXBIYPWYIK-HQRMLTQVSA-N 382.891 5.139 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 433117799 OQQJIZXIBGNDFM-XLIONFOSSA-N 393.556 5.522 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2c1 435480206 FSBSTEICSBECBX-KRWDZBQOSA-N 383.476 5.520 30 20 GKED C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 437984139 GLZFVOGDEOPGKL-IAGOWNOFSA-N 395.478 5.319 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)Nc1ccc(F)cc1C(F)(F)F 437988473 RPJWMWZGERWTDW-UHFFFAOYSA-N 380.263 5.593 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442732484 MXCMTAQOVCLPNA-UHFFFAOYSA-N 378.303 5.390 30 20 GKED Cc1sc(C(=O)Nc2ccccc2SCCC#N)cc1-c1ccc(F)cc1 445799710 PRPMNRWMHRLDRG-UHFFFAOYSA-N 396.512 6.121 30 20 GKED CC[C@@]1(C)Oc2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2O1 455251510 KKLQUMQOWKSOIU-AVRDEDQJSA-N 379.460 5.141 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)cc1 458836828 KYIVIAUUXRBHPM-GOTSBHOMSA-N 375.516 5.183 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)oc1ccccc12)c1cc(C(F)(F)F)ccn1 464428429 SRNBDCNZEBSPNI-MRXNPFEDSA-N 380.325 5.490 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1ccncc1Cl 467099736 IPLLTDWWORQZIF-UHFFFAOYSA-N 382.250 5.107 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C(F)F 470880576 QJCCSDNWPQQCPE-UHFFFAOYSA-N 378.806 5.020 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C 471252223 XPIFPHDXEZHFNM-IBGZPJMESA-N 393.531 5.134 30 20 GKED Cc1cc(Br)cc2c(C(=O)[C@@H](C#N)c3nc4ccccc4o3)coc12 473490897 PJRTWLWJLQARNJ-CYBMUJFWSA-N 395.212 5.135 30 20 GKED C=CCCC1(C(=O)N2CCC(c3nc(-c4ccccc4OC)cs3)CC2)CC1 477020773 PWIPNUUVBXOGSH-UHFFFAOYSA-N 396.556 5.271 30 20 GKED CN(C(=O)CCCc1ccc(Br)s1)c1cc(Cl)ccc1C#N 479571691 VUMYWNSIHCQCBO-UHFFFAOYSA-N 397.725 5.021 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)N[C@@H](C#N)c1ccc(Cl)cc1 480813629 CZAARQUFMVHONT-AWEZNQCLSA-N 398.087 5.059 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-c2ccc(Cl)s2)cn1)c1ccccc1 481145124 PYXBVOYMZODLMM-HNNXBMFYSA-N 381.888 5.490 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCCSc4ccccc43)c2)cc1 481930709 JQESIMLBFUTYSW-UHFFFAOYSA-N 386.476 5.493 30 20 GKED N#CC[C@@H](CC(=O)Nc1nc2c(C(F)(F)F)cccc2s1)c1ccccc1 483130690 PEEIGUZARGQTJV-ZDUSSCGKSA-N 389.402 5.341 30 20 GKED COc1ccc(C(=O)Nc2ccccc2SCCC#N)c(OCCC(C)C)c1 485514583 CCTFAMFXMXKFQD-UHFFFAOYSA-N 398.528 5.378 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc2ncsc2c1 485699878 IKEOVTDFKBNELJ-KRWDZBQOSA-N 399.519 5.598 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1csc2ccc(Cl)cc12)c1ccccc1 487221726 SMVXVPCLWNCGPX-LJQANCHMSA-N 382.916 5.649 30 20 GKED CC(C)(C)OCc1cccc(CNc2c(C#N)cnc3c(F)cc(F)cc23)c1 488242013 NEPUIVCHJPAXIG-UHFFFAOYSA-N 381.426 5.312 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)Nc2nccs2)cc1)c1ccccc1 488630167 VMKFQQCQPXKWBQ-IBGZPJMESA-N 391.496 5.084 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 494750715 AAPHGCVMGRXYPF-MTMYEVCSSA-N 379.529 5.506 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c1C 499521101 VBZYODAHMHRZPP-LBPRGKRZSA-N 394.418 5.088 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cc2ccccc2s1 504455240 DQBFSAKGRBPZSZ-MRXNPFEDSA-N 377.513 5.454 30 20 GKED Cc1csc(-c2cccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)c2)n1 509224181 KDIIJZRLVSOGET-UHFFFAOYSA-N 379.460 5.046 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 509328163 PMUBXWYWCHVAAP-YRGRVCCFSA-N 385.323 5.304 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c(Cl)c1 510069949 GSTCOSNMHVNWPN-HNNXBMFYSA-N 385.748 5.166 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(Cc1cccc(C)c1)Cc1ccco1 510859116 ZTRKSYXBBMQHLV-UHFFFAOYSA-N 389.455 5.093 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCCC[C@H]2C)cc1 512567213 YAMVVDSPNCJZLH-MRXNPFEDSA-N 379.460 5.156 30 20 GKED COc1ccc(COCc2cccc(Nc3ncc(C#N)cc3Cl)c2)cc1 513603778 RLNUJWRIGRLLSZ-UHFFFAOYSA-N 379.847 5.076 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c(C)s1 515101355 UPIZZKDHQBBLOP-CYBMUJFWSA-N 396.541 5.167 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 515735386 BRIDTKCYLCXPJO-AWEZNQCLSA-N 396.878 5.903 30 20 GKED CC(=O)c1csc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)c1 517345714 INXAEQJZRXDABX-UHFFFAOYSA-N 392.455 5.117 30 20 GKED CC(C)c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C(C)C)c1 517779531 RIVKYSBXXPEZFQ-UHFFFAOYSA-N 377.532 6.248 30 20 GKED COc1ccccc1C(C)(C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 518683116 IXZGXZOIEMWWCK-OAHLLOKOSA-N 383.517 5.004 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccccc1Cl 519190915 ZWMIDEWOTBSNKQ-AWEZNQCLSA-N 398.915 5.610 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCc2c(Cl)cccc21 521257041 BJHMBJMKEQLFLG-DYVFJYSZSA-N 385.920 5.401 30 20 GKED CS[C@@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 523502928 VDJDDDYUIYMYQD-JOCHJYFZSA-N 388.492 5.180 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1ccc(C#N)cc1F 532569721 VOQWMUHZASZWPZ-LBPRGKRZSA-N 385.895 5.634 30 20 GKED C=CCCOCCCCC(=O)N1CCC(=Cc2cc(Cl)ccc2Cl)CC1 538288099 VPEKIVZAWLHHCR-UHFFFAOYSA-N 396.358 5.762 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 540821533 JRAYTXSLCDXTJZ-OALUTQOASA-N 387.405 5.229 30 20 GKED N#CCc1ccc(CN[C@H](c2ccc(OC(F)(F)F)cc2)C(F)(F)F)cc1 542255654 KTHIWZKTTCTUPU-MRXNPFEDSA-N 388.311 5.044 30 20 GKED CSCc1ccccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 546117624 ZTEHWUHUWVOYPK-UHFFFAOYSA-N 392.455 5.605 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 546219902 NXANPMDECRUSIV-INIZCTEOSA-N 392.446 5.311 30 20 GKED C[C@H](Oc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cn1)c1ccccc1 554519218 LVCGYEWJCRIYEU-WMZHIEFXSA-N 399.494 5.387 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)NCC(C)(C)CCC#N 563991445 SXKNQVFZEJTCTL-UHFFFAOYSA-N 380.275 5.017 30 20 GKED Cc1nc(-c2cc([C@@H](C)N[C@H](CCCC#N)c3ccccc3)cs2)cs1 567296268 HQJURPRSWKBFEF-DNVCBOLYSA-N 381.570 6.266 30 20 GKED C[C@@H](NC(=O)c1cc(C#N)ccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 586806206 DGCCOUAYOASZBY-OAHLLOKOSA-N 385.854 5.241 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 588157949 TVAQQMWGWUNNIK-UHFFFAOYSA-N 395.356 5.444 30 20 GKED COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC(=O)CCCCCC#N)c1 588541563 FHPCXOXEEDTRCA-QHCPKHFHSA-N 378.516 5.186 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1nc2cc(F)ccc2s1 592973614 IGAURJRNUVRSNO-AWEZNQCLSA-N 396.443 5.793 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1OC 592975747 OQLIXRRMIMNZEU-OAHLLOKOSA-N 398.459 5.113 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 605925030 SEMCEVCCMSWPBY-JOCHJYFZSA-N 391.515 5.094 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1csc2ccccc12 609061214 MDUJQFMURDJQOD-UHFFFAOYSA-N 398.487 5.913 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609078608 CJMVGURZITYPRG-FQEVSTJZSA-N 377.488 5.242 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)c1cc2ccccc2n1CC#N)C1CC1 609166069 CKAFGNUPAULSBA-HNNXBMFYSA-N 377.875 5.184 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H]1CCc2ccccc21 609398017 BKNGMLWDEAATHB-DYESRHJHSA-N 393.556 5.870 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCCC1 609437042 LZIVCJZYJJJYMS-VGSWGCGISA-N 393.556 6.134 30 20 GKED CCc1cccc(CC)c1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609496294 MGEKGULZTFPDDD-UHFFFAOYSA-N 384.479 5.922 30 20 GKED Cc1cccc([C@H](C)C(=O)N[C@H](C#N)c2ccc(OCc3ccccc3)cc2)c1 610063326 OTKZQOAZXKTGOG-YADARESESA-N 384.479 5.059 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1ccncc1 610723580 SXXBEVQKEDNRSE-QGZVFWFLSA-N 389.886 5.334 30 20 GKED Cc1c([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cnn1-c1cccc(Cl)c1 619754974 PTCWVYXJZZCBNQ-CYBMUJFWSA-N 385.298 5.210 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2sc(-c3ccccc3)nc2C(F)F)n1 677793448 UPYXIBAUMFKODO-NSHDSACASA-N 375.425 5.003 30 20 GKED N#Cc1ccc(NC(=S)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1Cl 726489298 IYPVHEQBQBHFKI-CZUORRHYSA-N 395.837 5.073 30 20 GKED CC(C)(Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420812 GZLMAOJAFJUQOJ-CQSZACIVSA-N 388.851 5.123 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1ccccc1S[C@@H](C)CC#N 731332736 QUIJGYOPLWRBSW-QUQQQVAWSA-N 394.540 5.910 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2F)s1)c1ccc(C(F)(F)F)nc1O 731564920 UPUXTDHJBWAJDT-VMPITWQZSA-N 393.361 5.570 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 740535862 PNBJXQQREGBOHS-KDOFPFPSSA-N 380.900 5.752 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1c(Cl)nc2sccn12 741838208 QOTQVFYRZYUENZ-UHFFFAOYSA-N 395.102 5.241 30 20 GKED Cc1ccc([C@@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)o1 742569719 OULVRKOCFMCLDP-CQSZACIVSA-N 380.831 5.648 30 20 GKED CN(CCc1cccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743093191 OGUAYVOPXKVWLK-OAQYLSRUSA-N 375.497 5.110 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1Br 745990245 PDVBSXHNVRRPAO-WAPJZHGLSA-N 394.268 5.416 30 20 GKED CCCCN(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)[C@H](C)c1ccc(C)o1 746164829 CJZYFHIBAUASBI-IAGOWNOFSA-N 395.528 5.237 30 20 GKED COc1ccc(CNC(=O)N(Cc2ccccc2)[C@@H](C)c2ccccc2)cc1C#N 746781125 MBGSUCUYAAYTPO-IBGZPJMESA-N 399.494 5.040 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2cnc(-c3cccs3)s2)cc1 751515417 ZKHODQGVZASADZ-KTKRTIGZSA-N 397.525 5.298 30 20 GKED CC(C)(C)O[C@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1 754535526 ZXGVEYLTBFTVKW-KXBFYZLASA-N 382.460 5.168 30 20 GKED C#CC[C@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)c1ccccc1 756998453 VXPOAQASLSKCBQ-VWLOTQADSA-N 395.506 5.076 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 757681043 XDLPPCFMYKGUQQ-BUKVSMQUSA-N 389.898 5.528 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccncc1 759223426 UKADTUDRPTYDFH-BXUZGUMPSA-N 389.402 5.080 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccc[nH]1 760743890 VVBDCHHLZHCTJP-RDTXWAMCSA-N 378.863 5.206 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(Cl)cc2F)cc1 763548442 LQKNGWSPXFFQJG-QGZVFWFLSA-N 382.797 5.526 30 20 GKED C=CCn1c(-c2cccs2)nn(CN(Cc2cccs2)C(C)C)c1=S 764913887 OAGPFXNKJRKFGV-UHFFFAOYSA-N 390.603 5.258 30 20 GKED CC(C)n1c([C@@H]2CCCN2Cc2ccc(O[C@H](C)C#N)cc2)nc2ccccc21 769403203 FPFKYIUOPUFQEI-JPYJTQIMSA-N 388.515 5.245 30 20 GKED C=CC[C@@H](NC(=O)c1sc(C(C)(C)c2ccccc2)nc1C)c1ccncc1 769859133 OAQNVJMBQNNXEH-LJQANCHMSA-N 391.540 5.220 30 20 GKED CCOCCC1(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCC1 769945342 JILQULQYSRESAN-ZDUSSCGKSA-N 396.434 5.088 30 20 GKED Cc1cccc(Cc2sc(NC(=O)c3ccccc3SCC#N)nc2C)c1 772125596 WFSXTIIYNYGVAI-UHFFFAOYSA-N 393.537 5.219 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2nc(-c3ccccc3)cs2)c1 772982982 GQFAIMBUBAJTLS-APWZRJJASA-N 377.513 5.342 30 20 GKED CC(C)c1nccnc1NN=Cc1c(C(C)C)nn(-c2ccccc2)c1Cl 773090012 DOTBIFKWLALXIR-UHFFFAOYSA-N 382.899 5.009 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c(Br)c1 773956377 SBMAQHCJMYUKBV-CQSZACIVSA-N 399.313 5.176 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1cc(Br)ncc1F)c1ccc(F)c(F)c1 775559137 WBKJNLJFUOCZLN-BMLIUANNSA-N 385.227 5.229 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(F)c4cccnc34)cc2)c1 779594355 HWJHTTRTEWEFEU-UHFFFAOYSA-N 383.426 5.437 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]nc2-c2ccsc2)cc1 780345092 AHABOTXVWGIJQU-LJQANCHMSA-N 384.464 5.046 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccc(SCc2cccnc2)cc1 780978586 IGFBAXUDYBKDPP-HXUWFJFHSA-N 385.533 5.284 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCc2cn(C(C)C)nc21 789457611 JOFTTWKVLJOLPD-FQEVSTJZSA-N 380.536 5.515 30 20 GKED CCc1c(NC(=S)Nc2ccc(C#N)c(Cl)c2)cnn1C(CC)CC 790353839 YTWRZCFSZXUIDU-UHFFFAOYSA-N 375.929 5.141 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2cccc(C(F)F)c2)cc1 790767557 NGHKOKLYTGDPAF-KUHUBIRLSA-N 384.426 5.028 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 796744397 IRQFVYCPANWMFS-CYBMUJFWSA-N 397.208 5.066 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnc(Cl)c(F)c1 803170037 GCDWDNDQGYPXDA-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813214474 YAVVWIZPIFPOBL-RSPDNQDQSA-N 399.199 5.687 30 20 GKED CN(C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)[C@H]1CCCC[C@H]1C(F)(F)F 813253191 CREKNMUUHOJGFJ-HZSPNIEDSA-N 385.323 5.296 30 20 GKED C[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCOC2=O)cc1 815634232 GQMLTSCZJGJACH-HXOBKFHXSA-N 389.499 5.023 30 20 GKED N#C[C@@H](C(=O)C1CC2(C1)CC2(F)F)c1nc(-c2ccc(Cl)cc2)cs1 850762944 RMXDOIYNZUTQFE-XKZABGERSA-N 378.831 5.075 30 20 GKED CC(=NO[C@@H](C)C(=O)N[C@H](C)c1ccc(Cl)cc1)c1cc2ccccc2o1 852017600 DZFUUOXWSAOQFK-HIFRSBDPSA-N 384.863 5.093 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2cccc(C(F)(F)F)c2)cc1 912698898 UPSMIWQLEHEMBQ-OAHLLOKOSA-N 392.446 5.441 30 20 GKED CCCOc1c(Br)cc(/C=C/C(=O)c2ccccc2F)cc1OC 916136544 PLAIMVJURIYNHJ-CMDGGOBGSA-N 393.252 5.282 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2ccc(Br)s2)cc1Cl 916154872 YOKPPTYGIBQNDV-HWKANZROSA-N 387.682 5.077 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 917043819 OKVLGWFHRQVEAW-OAHLLOKOSA-N 388.414 5.433 30 20 GKED C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917045799 ABQQHRYFWCGWCR-SJKOYZFVSA-N 396.899 5.082 30 20 GKED C=CCn1c(SCc2cc(Cl)nc(Cl)c2)nnc1-c1ccc(F)cc1 920071347 CWXYSMUNJXISAT-UHFFFAOYSA-N 395.290 5.264 30 20 GKED O=C(O)c1cc(-c2ccc(C=NN(c3ccccc3)c3ccccc3)o2)ccc1O 1776032518 UUZIJYYEFCERAN-UHFFFAOYSA-N 398.418 5.523 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cccc4ccccc34)s2)cc1 1776114092 FTUSUUJGIWDHRQ-WYMLVPIESA-N 384.456 6.163 30 20 GKED C=CCn1cc(/C=C/c2nc3ccccc3c(-c3ccccc3)c2CC(=O)O)cn1 1776189809 YUHTUVKBQGXJNF-OUKQBFOZSA-N 395.462 5.082 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776339914 PSKOVSQPOAYPCR-FLIBITNWSA-N 390.435 5.445 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 1776782787 JXJJNEVMXXFNET-KRWDZBQOSA-N 388.464 5.148 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cnc(-c3ccccc3)s1)C2=O 1777683142 WFTJHHRSLNUHDJ-FOWTUZBSSA-N 375.449 5.111 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cccc(Cl)c1)=C(/S)Nc1ccccc1 10170360 RBAXRGUWBRSORK-UHFFFAOYSA-O 395.935 5.241 30 20 GKED CCC(CC)c1nnc(/N=C(\O)c2sc(Cc3ccccc3)nc2C)s1 30597443 KCASKEURQICOIT-UHFFFAOYSA-N 386.546 5.434 30 20 GKED Cn1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c2ccccc21 51656655 JCDRDPCTFYSHQY-ZDUSSCGKSA-N 399.397 5.297 30 20 GKED C=CCCO[C@H](C)C(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 69315816 DPYAFZCXFRGFCN-MRXNPFEDSA-N 396.512 5.341 30 20 GKED C[C@@H](Sc1cc(C#N)ccn1)C(=O)Nc1ccccc1Sc1ccccc1 71918503 MOBNQBJTHXXDFG-OAHLLOKOSA-N 391.521 5.224 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl 108352937 WRKDZTWDKKQXAD-UHFFFAOYSA-N 380.300 5.050 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 109159671 RTUKVUQXFQDQEL-INIZCTEOSA-N 387.439 5.281 30 20 GKED COc1ccc(COCc2cccc(NCc3ccc(C#N)cc3F)c2)cc1 127199423 IMGPHHANBQDBSC-UHFFFAOYSA-N 376.431 5.035 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccn1)c1nc(-c2ccc(Cl)cc2)cs1 136726598 NDXILVLMUHHRAS-KRWDZBQOSA-N 381.888 5.058 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 152834216 HZLVBZATJBSKHS-UHFFFAOYSA-N 386.293 5.108 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccccc1CCC(F)(F)F 155348789 PXZRDEAVDSZWDP-UHFFFAOYSA-N 394.396 5.972 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccc(F)cc1C(F)(F)F 158947887 DEMSZNYIHLYEQT-UHFFFAOYSA-N 385.666 5.769 30 20 GKED COCc1c(C(=O)N(CCC#N)c2ccc(C)cc2)sc2cccc(F)c12 171029046 FVWHZHRDOGOGEV-UHFFFAOYSA-N 382.460 5.056 30 20 GKED CC[C@](C)(NCc1cccc(OCc2cccc(C#N)c2)c1)c1nc(C)cs1 174498532 AKFDQRMLBIGKJC-QHCPKHFHSA-N 391.540 5.317 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 177090039 OIUMABBYZWOTDV-ZDUSSCGKSA-N 389.471 5.416 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)c2ccccc2Sc2ccccc2C#N)s1 184069173 TUEKTPQVKIJUIX-AWEZNQCLSA-N 393.537 5.008 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C)nc2)c1)[C@H](C)c1ccc(C#N)cc1 303516898 DKIOVUKPSZCRHH-LJQANCHMSA-N 399.494 5.064 30 20 GKED C=CCCc1ccccc1NC(=O)CSc1ncnc2sc(C)c(C)c12 410356630 XTIRCINYAUAJOB-UHFFFAOYSA-N 383.542 5.158 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC1(C#N)CCC1 416345782 IWZFZMMDFBRKAV-UHFFFAOYSA-N 392.286 5.195 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)C1 424968583 WVVUXVHFNIUPGW-QWHCGFSZSA-N 375.255 5.208 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)CCc1c[nH]c2ccccc12 425091908 YNBLWOALNMDHHB-HNNXBMFYSA-N 399.416 5.060 30 20 GKED CC(C)COc1ncc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1Cl 430597920 RHEMGGFFDYIBMY-ZDUSSCGKSA-N 391.924 5.014 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc2nc(C3CC3)sc2c1)c1ccccc1 432762119 CUDDEEJPQNAYTA-GOSISDBHSA-N 390.512 5.730 30 20 GKED CCCC(=O)Nc1cccc(NCC#Cc2ccc(OC(F)(F)F)cc2)c1C 433469371 HNCQWRXUJSQOSK-UHFFFAOYSA-N 390.405 5.096 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Br)c(C)c1F 433747230 LCTQDTQYNZWNSU-UHFFFAOYSA-N 383.286 5.178 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 437039812 NTBPXALJTBBRGM-YVEFUNNKSA-N 386.339 5.921 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 438066814 RPLILLDHUMVBOU-QUCCMNQESA-N 395.572 5.732 30 20 GKED CC[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)C1 438184879 LKKLXLVJAYFINL-HSZRJFAPSA-N 393.487 5.403 30 20 GKED CN(C(=O)c1cc(F)c(F)c(F)c1F)c1ccc(C(F)(F)F)cc1Cl 439125999 YMYTWKJRLKOFIR-UHFFFAOYSA-N 385.666 5.192 30 20 GKED N#Cc1ccc(CSCc2ncc(-c3cccs3)o2)c(OC(F)F)c1 439532427 ABOHTQWFMMTNLT-UHFFFAOYSA-N 378.425 5.310 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(Cc2ccccc2)no1 439596040 OVDVPKCLZVMTJP-QGZVFWFLSA-N 396.450 5.497 30 20 GKED CC(C)N(C)c1ccccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 446143110 FYZHRVGZLKTEHK-KRWDZBQOSA-N 396.560 5.247 30 20 GKED COc1ccc(CN[C@H]2c3ccccc3CCC[C@H]2C)cc1OCCCC#N 462546952 GLUAMTMPWQJVOO-HOYKHHGWSA-N 378.516 5.181 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466239583 DMPXFCGDLRKPST-FQEVSTJZSA-N 390.499 5.384 30 20 GKED N#CCCCn1cc(C(=O)N2CC3(CCCC3)c3ccccc32)c2ccccc21 469524608 BQWZXEDNIRXYJF-UHFFFAOYSA-N 383.495 5.417 30 20 GKED Cc1ccc([C@@H](NCC#Cc2ccc(C(F)(F)F)cc2)c2ccccn2)cc1 471070009 FVXOQTSBHZDCNW-JOCHJYFZSA-N 380.413 5.140 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 471279954 PIYYKBXVEJWSTH-UHFFFAOYSA-N 393.531 5.590 30 20 GKED C=CCn1c(SCC[C@@H](C)OCc2ccccc2)nnc1-c1ccoc1C 473413438 ROKUDADTHCWUJA-MRXNPFEDSA-N 383.517 5.120 30 20 GKED COCCC1(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCCC1 473821940 MPNAUODFKANJCS-UHFFFAOYSA-N 393.487 5.069 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477507539 GEOFHLXPMLIPAQ-UHFFFAOYSA-N 376.287 5.458 30 20 GKED C=C(C)[C@H](NCc1nc(-c2cccc(Cl)c2)no1)c1ccc(F)c(F)c1 481606311 QPFLRWMDCDANCY-SFHVURJKSA-N 375.806 5.075 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)C[C@@H](CC#N)c1ccccc1 483324175 OVEWSZMSRDNCIO-CQSZACIVSA-N 391.696 5.437 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 485471345 YURFNNSCNDNVKO-GFCCVEGCSA-N 386.464 5.321 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N[C@@H](CCCC#N)c1ccccc1 487302451 WBNQOMLEQDFDRU-INIZCTEOSA-N 381.526 5.345 30 20 GKED Cc1ccc(CN(C(=O)c2cccc(CC#N)c2)[C@@H]2CCc3ccccc32)cc1 489335595 YJZZBXWDGFYAJP-RUZDIDTESA-N 380.491 5.391 30 20 GKED C=CCc1cc(C(=O)Nc2cnn(CCC(C)C)c2C(C)C)cc(OC)c1OC 490476769 BTSGEWGRDLUJQS-UHFFFAOYSA-N 399.535 5.051 30 20 GKED C[C@@H](C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(C)(F)F 504181851 MTLZVDPBWVJEFI-KWQFWETISA-N 377.275 5.106 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 509721976 OFRIYLKMPZZFSY-CYBMUJFWSA-N 378.369 5.133 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCc1ccc(-c2ccccc2)[nH]1 513044101 MIJPAHQAZHXUAD-UHFFFAOYSA-N 384.932 5.544 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c1 514423990 DBWKXQVNVOMAQX-UHFFFAOYSA-N 383.476 5.205 30 20 GKED N#C[C@H](NC(=O)c1ccc(Cl)cc1Sc1ccc(Cl)cc1)C1CC1 515557305 VYPXCPSBDJOPDP-INIZCTEOSA-N 377.296 5.177 30 20 GKED CCOc1ccc(CN(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 518169086 NANHOHQOPSJEIP-MRXNPFEDSA-N 383.517 5.001 30 20 GKED N#Cc1ccc(/C=C\c2nc(-c3ccccc3OCc3ccccc3)no2)cc1 518340390 DHUMCNADNDVAMB-PFONDFGASA-N 379.419 5.358 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 518751093 FBLBWLGQOWGNHH-UHFFFAOYSA-N 377.469 5.384 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 521152182 YCYQPRXEVGIGIO-CHWSQXEVSA-N 376.287 5.329 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)oc2c(Cl)cccc12 521352753 NPDCFFHSXRUBPS-OAHLLOKOSA-N 392.764 5.408 30 20 GKED Cc1c(CNCc2cccc(OCc3cccc(C#N)c3)c2)oc2ccccc12 523740370 IUDLJDXIQNWSIF-UHFFFAOYSA-N 382.463 5.482 30 20 GKED Cc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1SC[C@H](C)C#N 524565689 DBTQSEDFNUICOT-MRXNPFEDSA-N 381.545 5.346 30 20 GKED Cc1ccc2cccc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)c2n1 524633451 HTDXMHHPFZLBCI-UHFFFAOYSA-N 393.446 5.246 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)c1c(F)cccc1F 524641593 SHAUCJPFRVQWQR-UHFFFAOYSA-N 397.315 5.593 30 20 GKED C=CC[C@H](C)[C@H](C)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 532239000 KXTWQFDIRQLDPO-QYWGDWMGSA-N 391.964 5.023 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)cccc1-c1ccccn1 533649468 NKICXXSECBSVER-LJQANCHMSA-N 396.277 5.359 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2csc(-c3cccc(F)c3)n2)c(C#N)s1 533807699 WVIMIHIENHDOQR-UHFFFAOYSA-N 399.516 5.361 30 20 GKED C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@@H](CCC#N)c1ccccc1 536838847 LPPGVONVUNDXJO-BEFAXECRSA-N 389.421 5.057 30 20 GKED CCCOc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1OCCC 537393485 DOKGZNCIKFLHMH-UHFFFAOYSA-N 378.472 5.072 30 20 GKED N#CCc1ccc(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 537995919 PDPSBNKLLPGSNW-SFHVURJKSA-N 392.808 5.306 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccccc1C(F)(F)F 542417677 FZQVARGWEHFXPE-HNNXBMFYSA-N 386.417 5.262 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3ccc(C#N)cc3OC(F)F)oc12 543517074 MSGZSQLZJNREFD-ZDUSSCGKSA-N 386.398 5.155 30 20 GKED Cc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)cnn1-c1ccc(F)cc1 550827909 SDBGPBCXPAUIBA-GAJHUEQPSA-N 376.479 5.406 30 20 GKED N#Cc1cc(NC(=O)[C@@H]2CCC(=O)c3ccccc32)ccc1Oc1ccccc1 551314169 LNCODJZOQJBGSF-OAQYLSRUSA-N 382.419 5.049 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1 554246383 WEJFTAKJMWJAHQ-FQEVSTJZSA-N 383.495 5.323 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(Oc2cccnc2)cc1 554727255 ZTHYFAOZDUTBKD-IBGZPJMESA-N 387.483 5.407 30 20 GKED C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)CCCCOc2cccc(C#N)c2)C1 561276196 RRXRIKCDWRUXQR-AUSIDOKSSA-N 376.500 5.107 30 20 GKED CC(C)(C#N)Cc1nc(-c2ccc(-c3csc(-c4ccncc4)n3)cc2)no1 569854062 FGGIKNPREDHDLW-UHFFFAOYSA-N 387.468 5.014 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1sc(-c2ccccc2)cc1C#N 575156021 AMZLQBTXHAATRY-INIZCTEOSA-N 397.503 5.652 30 20 GKED COc1cc(CNC(C)(C)c2cccs2)ccc1OCc1cccc(C#N)c1 578282817 VMQLAKOHFZRFPR-UHFFFAOYSA-N 392.524 5.232 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589471501 YYTZOUSOCMIKLY-UHFFFAOYSA-N 395.418 5.160 30 20 GKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cc(F)c(Br)cc1F 598992014 JDEWWOIGLZPNSS-GFCCVEGCSA-N 391.259 5.133 30 20 GKED CN(C)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 603759003 REOJCVSFWNRZFD-NRFANRHFSA-N 389.886 5.314 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccc(Cl)c1 609056631 QNTGIEBOXVZTMF-UHFFFAOYSA-N 380.831 5.050 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1[N+](=O)[O-] 609322055 VQCVFEOSEXXWBD-ZDUSSCGKSA-N 397.431 5.131 30 20 GKED N#Cc1ccc(S[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c(F)c1 610165673 AHYHLDXSFLXTLI-HXUWFJFHSA-N 380.419 5.309 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)c2)C1 610325172 FBXNJOKKXDEAMJ-PNCHPQGNSA-N 391.515 5.536 30 20 GKED N#Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccncc2)cc1C(F)(F)F 610331070 LOJPMBPAXZLPJX-SFHVURJKSA-N 388.393 5.121 30 20 GKED COc1ccccc1NC(=O)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 614057186 BMPOSRNQWUHONT-UHFFFAOYSA-N 399.494 5.361 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1ccc2ccccc2n1 619753015 YKHDNRRLYDEMTI-GFCCVEGCSA-N 395.896 5.563 30 20 GKED FC(F)(F)[C@@H]1CC(N[C@H](c2ccccc2)C(F)(F)F)C[C@@H](C(F)(F)F)C1 643307151 ZZNZIGUIMHWELP-GMXVVIOVSA-N 393.293 5.789 30 20 GKED CC[C@@H](C(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1cccc(C(F)(F)F)c1 650352729 CPRATTHKSOXDJV-CYBMUJFWSA-N 397.334 5.092 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(CC(C)C)c1CC 681415513 ITOWJNXXBRAKDZ-UHFFFAOYSA-N 380.945 5.037 30 20 GKED C=CCSc1ccccc1C(=O)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 681623329 KNLXPNMBIZVARJ-SIKLNZKXSA-N 381.541 5.205 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1SC(F)F 726078802 LNTTYNIIBZRSJV-UHFFFAOYSA-N 381.835 5.190 30 20 GKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 727264423 SNTWNEWBYMFZFD-WAPJZHGLSA-N 395.808 5.092 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1sc(-c2ccc(C)cc2)nc1C 727650664 QACAUSIMVYYNPJ-UHFFFAOYSA-N 399.903 5.615 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1Cl 728812828 CQAUYAYKVBKOTQ-HXUWFJFHSA-N 388.898 5.912 30 20 GKED Cc1cccc(-c2nn(CN(C)[C@H](C)CC#N)c(=S)n2[C@@H]2CCCC[C@H]2C)c1 728901864 BNUHBQOISNTOFU-QWFCFKBJSA-N 397.592 5.332 30 20 GKED Cc1ccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1F 729160344 MTTFCSPZOAURED-UHFFFAOYSA-N 377.444 5.607 30 20 GKED N#CCSc1ccccc1C(=O)NCc1ccccc1Oc1cccc(F)c1 731016644 LQLCABQMICEQIT-UHFFFAOYSA-N 392.455 5.164 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)c(C#N)c2n1CCC2 731937833 NDZKZFJVNWYLCE-FNORWQNLSA-N 378.781 5.183 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@H](C#N)C(=O)Nc3ccccc3)sc2c1 732708005 JKUFIVCXTQWTIK-INIZCTEOSA-N 396.899 5.639 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2CCC(C)C)c1 733843907 DNILILHPSBKAHY-HXUWFJFHSA-N 379.504 5.278 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(COc3ccc(C)nc3)c2)C(C)C)c1 733932780 YVIBNVMQBKSPAK-UHFFFAOYSA-N 384.479 5.006 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 734666481 YNUFYSRAYVYZBY-FDDCHVKYSA-N 387.483 5.552 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740483663 DVQRGLQALHCXOM-UHFFFAOYSA-N 389.524 5.407 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(N3CCOCC3)cc2)cc1 741469431 SBWUSGNYXMGLTI-OVCLIPMQSA-N 399.490 5.095 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3cccc(-c4ccncc4)c3)cs2)c1 741473847 SKCGNNSIUJNFRF-HJWRWDBZSA-N 398.487 5.777 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)COc2c(Cl)cc(Cl)cc21 743056701 JXUFGHHRFCPSAD-NTUHNPAUSA-N 399.233 5.234 30 20 GKED COc1ccc([C@H](C)CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 749910511 FOVYZGIYZMAJTH-HOYKHHGWSA-N 384.479 5.483 30 20 GKED COc1cc(/C=C2\Cc3c(Cl)cccc3C2=O)ccc1OCC(F)(F)F 750909837 NWCDODAQYYPVJD-KPKJPENVSA-N 382.765 5.112 30 20 GKED O=C(CON=C(c1ccccc1)C(F)(F)F)Nc1ccccc1-c1ccccc1 751955764 UPRWJGAFLXLNFL-UHFFFAOYSA-N 398.384 5.275 30 20 GKED C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 754110270 UGUVTYGPZMESGT-GGJDQLKOSA-N 397.434 5.292 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3ccc(C)cc3o2)cc1OCCCC#N 754831077 VJPOLYABRUIVRM-RMKNXTFCSA-N 375.424 5.329 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(C3CCC3)s2)ccc1SC(F)F 760264700 MAERROMTXBVIJP-SREVYHEPSA-N 381.469 5.630 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(Br)cc2)c1 760480475 ZWKGTVJBDURKTI-UYAOXDASSA-N 387.321 5.371 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccccc2F)c2nccn2C)cc1 764814665 OBYGNZJQCWPWDE-IERDGZPVSA-N 399.897 5.131 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(NC(=O)c3ccco3)cc2)cc1 776804308 GWXIRBCKDNCKTB-INIZCTEOSA-N 396.874 5.836 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)CCCCC(=O)c1ccc(F)cc1 778571505 MNYTUNPKONVYBX-UHFFFAOYSA-N 381.447 5.113 30 20 GKED O=C1/C(=C\c2ccc(-c3cccc(C(F)(F)F)c3)o2)CCc2nc(O)ccc21 781549462 FRTNUPFYUYTCBP-QBFSEMIESA-N 385.341 5.279 30 20 GKED CCCCC[C@@](C)(CC)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 787514541 DVOJWFZAZXVVLR-HSZRJFAPSA-N 383.536 5.205 30 20 GKED N#C[C@@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1cnc2ccccc2n1 792105066 TUJOAUKIGSYXJX-FGZHOGPDSA-N 391.474 5.223 30 20 GKED C[C@@H](C#N)COC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 797162363 SVZNMQUTPODGCH-JTQLQIEISA-N 383.300 5.097 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)COc2ccccc2-c2ccccc2)s1 797570090 DEUWDRKQOKWYCQ-SFHVURJKSA-N 390.508 5.363 30 20 GKED C[C@@H](O)c1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)ccc1F 804799901 KKYLJKBQTIGCPA-CQSZACIVSA-N 392.455 5.154 30 20 GKED CC(C)(CCC#N)CNC(=O)CCN1c2ccccc2Sc2ccccc21 805281266 VMUMNPFMRQBWAV-UHFFFAOYSA-N 379.529 5.126 30 20 GKED N#CCCCCCC(=O)Oc1ccc(Oc2ccc(Br)cn2)cc1 808756389 JXSPNIBXYMRJPO-UHFFFAOYSA-N 389.249 5.016 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=Cc1cc2ccccc2o1 812395973 JJWSEVPXXRAMTG-UHFFFAOYSA-N 389.267 5.169 30 20 GKED N#C[C@H](C(=O)CCCC1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 813060596 DXIYABHUWKUKQV-CQSZACIVSA-N 379.312 5.873 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1cc(C(F)(F)F)ccn1 813211646 NTTDOGNJXRXWJA-KKUMJFAQSA-N 399.199 5.387 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)CC4(OC)CCC4)c23)cc1 814761145 HHVAOYRCAMUFIX-UHFFFAOYSA-N 396.516 5.114 30 20 GKED CC(C)c1cccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(SC(F)F)cc2)c1 850755797 IQNPYTUNJHJTQT-QGZVFWFLSA-N 388.439 5.086 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccnc(Br)c1 853333286 CZSQUVUJNOFLJI-UHFFFAOYSA-N 392.141 5.297 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)co1 913137317 SLATZWFZRKSZKB-UHFFFAOYSA-N 379.419 5.441 30 20 GKED Sc1nnc(-c2ccco2)n1N=Cc1ccc(-c2cccc(Cl)c2)s1 914691957 JDBTVILJSUJISH-UHFFFAOYSA-N 386.889 5.091 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2ccc(Cl)cc2)cc1 915088365 NSAQHFQVSYRAAA-OAQYLSRUSA-N 392.911 5.726 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2)cc1 915352330 GYVSXDJHWOUJQZ-BJKOFHAPSA-N 381.479 5.711 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2Cc2ccccc2)cc1 915352379 HCKQWCDJRCFZAU-DQEYMECFSA-N 395.506 5.581 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)cnn1-c1ccccc1 915987217 ZEMNIVQJYWDSQO-FMIVXFBMSA-N 395.462 5.051 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(CC)[C@@H](C)c2ccc(F)cc2)cc1OC 916486182 BEQZHNAZEQQOFI-AAKUMTKESA-N 383.463 5.022 30 20 GKED N#C[C@H](C(=O)COc1ccc(Cl)c2ccccc12)c1ccc2ccccc2n1 916848707 NUGTUIMTSJJRQZ-SFHVURJKSA-N 386.838 5.297 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccc(Cl)cc3)s2)c1 916896974 GCYFFSVWEIKCEN-KRWDZBQOSA-N 394.883 5.338 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)sc2cccc(F)c12 917026455 ZJWKQWYDYNLQMX-AWEZNQCLSA-N 392.480 5.962 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1ccc(Cl)cc1 917644382 COFFUTCOENXHKA-UHFFFAOYSA-N 380.831 5.050 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(-c2ccc(C(C)(C)C)cc2)o1 1776050061 UDELFKOXDJTDRB-UHFFFAOYSA-N 392.455 5.397 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)c1 1776341457 OSUBDNLACRSUFG-VURMDHGXSA-N 382.456 5.833 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776471525 YNLOXJMAAQVKJT-MLRPBERTSA-N 378.468 5.482 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(N(CC)c2ccccc2)cc1 1776784267 ZMTITOYLCZJREB-JOCHJYFZSA-N 396.575 6.138 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1sc2c(Cl)cccc2c1C 1776786872 XIJSOSPDRRAMLG-OAHLLOKOSA-N 381.969 6.157 30 20 GKED CCCCCCCOc1cccc(/C=C/c2nc3c(C(=O)O)cccc3o2)c1 1776789126 TYMVGRJJPQILEJ-BUHFOSPRSA-N 379.456 6.046 30 20 GKED Cc1ccc(-c2ncc(/C=C3/C[C@H](C(=O)O)c4ccccc4C3=O)s2)cc1C 1777431447 LLANPBWGSYODOP-PDANQNNMSA-N 389.476 5.265 30 20 GKED Cc1cccc2c1C(=O)/C(=C\c1cccc(OCc3ccccc3C(=O)O)c1)C2 1777455649 IUSBHZVVVSSGIS-NDENLUEZSA-N 384.431 5.095 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(CC2CC2)s1 1777569417 PRMGXJMZQWHSJX-XBXARRHUSA-N 394.448 5.261 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3sccc3Br)c2c1 1777683962 INANLWAOMLKTQM-HNQUOIGGSA-N 393.283 5.320 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)Nc2ccccc2)cc1 10170416 XUMDTDCQNLSRRJ-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1ccc(C)c(F)c1 11082854 IRGSMWWERGAPRS-UHFFFAOYSA-O 393.507 5.035 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NC(=O)c1ccsc1)c1ccc2ccccc2n1 48855368 ZZFWBQOBBGDABL-GOSISDBHSA-N 397.459 5.039 30 20 GKED CCOc1cccc([C@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)c1 63319330 ROZOHQPWQWTQEM-IBGZPJMESA-N 386.495 5.387 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 64737967 UKBVXUXJZISQOJ-MSOLQXFVSA-N 385.467 5.137 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2sc3c(c2C#N)CCC3)cc1 69609975 IBDLPQMXPHUIOC-UHFFFAOYSA-N 393.537 5.030 30 20 GKED CSc1ccsc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 107119992 IXKAIQDLEAYODF-UHFFFAOYSA-N 394.521 5.367 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1scnc1C1CC1 121446213 MCJAFHYGGPMZMG-UHFFFAOYSA-N 375.453 5.245 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 170974600 DJDFSMZMUHANDR-LBPRGKRZSA-N 397.481 5.314 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCCc4ccccc43)n2)cc1 171777553 FJGNXEVPHGYFJK-PZJWPPBQSA-N 397.503 5.368 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1nc2cc(Cl)ccc2s1 174002640 FZWVUVTYPATTHQ-JHJVBQTASA-N 388.826 5.208 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2c(F)cccc21 181714836 PHOMMIVNNSQOSQ-YOEHRIQHSA-N 399.491 5.255 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 193273018 RMJZBWVLHBIKRG-AWEZNQCLSA-N 387.386 5.022 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)ccn1C 194889654 DUOHTOKBVXBLMN-AWEZNQCLSA-N 390.295 5.254 30 20 GKED N#CCN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1ccccc1 195121947 GLIABRWIOAGBLG-UHFFFAOYSA-N 397.356 5.063 30 20 GKED Cc1cc(OCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1C(C)C 197577205 PUECPWROOGXSKL-HXUWFJFHSA-N 390.508 5.497 30 20 GKED COc1ccc([C@H](NCc2cc(C#N)cs2)c2ccccc2Cl)c(C)c1 237356756 BLNMYDSLQDYBKQ-NRFANRHFSA-N 382.916 5.469 30 20 GKED CN(Cc1ccccc1F)C(=O)c1ccccc1SCc1ccc(C#N)cc1 255942002 ZCDYQIJEMSCULR-UHFFFAOYSA-N 390.483 5.262 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCOC2(CCSCC2)C1 276400836 KLYZTPIWESXBRE-GOSISDBHSA-N 388.577 5.105 30 20 GKED COc1ccccc1[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccn1 301868755 IXXVVCGGKWRXOC-HXUWFJFHSA-N 383.373 5.182 30 20 GKED N#Cc1cnc2ccc(OC(F)F)cc2c1N[C@H]1CCO[C@H](c2ccccc2)C1 302155020 DMXYPSIRTZILFU-JXFKEZNVSA-N 395.409 5.040 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(COc3cccc(F)c3)c2)cc1 303513845 CVFWIEIITLISGB-UHFFFAOYSA-N 388.442 5.458 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](C)c1cccc(N2CCCC2)c1 328924054 VERFFIWZMQMCAZ-MAUKXSAKSA-N 399.560 5.012 30 20 GKED CC(C)(C)c1ccccc1N=C(O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 329252839 CBQAMIRWRPCYQH-HXUWFJFHSA-N 380.536 5.508 30 20 GKED Cc1cc([C@H]2CCCN2C(O)=Nc2cccc(CSC3CCCC3)c2)on1 329556547 HKGHFBUCGVNDNU-LJQANCHMSA-N 385.533 5.541 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(F)(F)F 361442893 UBYUNGSBSPZTJE-MJGOQNOKSA-N 387.405 5.095 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCc2cc(C#N)ccc21 416823061 XVZGDEBQOSPKLR-BEFAXECRSA-N 390.512 5.152 30 20 GKED C=CC[C@H](C(=O)Nc1nnc(SCc2cccs2)s1)c1ccccc1 429021927 SDOLHLWCAYWWEJ-HNNXBMFYSA-N 387.555 5.190 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2cc(Cl)ccc2OC2CCCC2)nc2ccccc21 429357722 XDSOQBMSMBZYLA-KRWDZBQOSA-N 393.874 5.038 30 20 GKED Fc1cccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1F 436407236 IOVHOKGZXPVTIZ-CQSZACIVSA-N 383.282 5.767 30 20 GKED N#CC1CCC(CNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)CC1 441145168 KUKMFYXJGSNGTB-UHFFFAOYSA-N 386.417 5.432 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 444254869 VSPRSRYVEPRBJJ-OAQYLSRUSA-N 382.463 5.119 30 20 GKED C/C=C\COc1cccc(CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 448944766 TWOBWHXCTWSWQE-CWIOURORSA-N 380.513 5.217 30 20 GKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H]1CCC[C@H]1c1ccccc1 458855470 YGNSVRKRGLZNOE-YTFSRNRJSA-N 375.516 5.399 30 20 GKED C=C[C@@H]1OCC[C@H]1C(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 459846719 WUCBSRUOEUIQPI-XLIONFOSSA-N 392.524 5.676 30 20 GKED C[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Oc1cccc(Cl)c1 460412990 PUNQQRRRNISZTQ-INIZCTEOSA-N 390.870 5.076 30 20 GKED C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 469525848 UBWXFICTUHENFE-CTNGQTDRSA-N 385.511 5.038 30 20 GKED CC1(c2ccccc2)CCN(C(=O)c2cn(CCCC#N)c3ccccc23)CC1 469688282 UGEGIIUXJLODNZ-UHFFFAOYSA-N 385.511 5.139 30 20 GKED CCCN(CCc1cccs1)C(=O)c1cn(CCCC#N)c2ccccc12 469801283 UZCGCMGBIBXZEL-UHFFFAOYSA-N 379.529 5.101 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1Br 473679476 VGEMIBVIFADEQH-GFCCVEGCSA-N 389.318 5.262 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1 474388623 KCEFYHJSNOHGGV-HXUWFJFHSA-N 392.549 5.399 30 20 GKED C[C@@H](NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1ccc(C#N)c(F)c1 477853418 GCBAZEQQADERTE-LLVKDONJSA-N 382.788 5.709 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(Cl)cc3C#N)s2)cc1 481028939 VRSLCDRDAYHCPD-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED C=CCn1c(SCc2ccn(C3CCCC3)n2)nnc1-c1cccc(Cl)c1 481389785 BJDCYQJREZWUDA-UHFFFAOYSA-N 399.951 5.388 30 20 GKED CC(C)Oc1ccc(F)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 484318805 MJPLXLGNJKNCAA-UHFFFAOYSA-N 390.414 5.529 30 20 GKED CC[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 484350031 DORJTNBLGZYZKM-AWEZNQCLSA-N 384.888 5.410 30 20 GKED COc1cccc2[nH]cc(CC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)c12 485602297 FBIQGLBULIOGIE-UHFFFAOYSA-N 397.434 5.022 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3ccsc3)CC2)cc1C(F)(F)F 486525256 CZUQIXGMAAGOSZ-UHFFFAOYSA-N 379.407 5.050 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCCC[C@@H]1c1nc(-c2ccccc2)no1 487385948 AVPYQGCQFJTMEL-OAQYLSRUSA-N 386.499 5.265 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@H](C)Sc1nc(C(F)(F)F)ccc1C#N 488729852 DPMGEHCUYBYBLO-JTQLQIEISA-N 399.825 5.053 30 20 GKED CCCCc1noc([C@H](C)SCc2cc(C#N)ccc2Br)n1 492262973 YRTXXWUZGHOYGX-NSHDSACASA-N 380.311 5.041 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Nc2c(F)cccc2F)c1 494157271 RIXYMFGRTDJEMA-UHFFFAOYSA-N 395.434 5.576 30 20 GKED CCCC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(OC)cc1 503798743 SMTYSNXVZYPJBR-HSZRJFAPSA-N 393.531 5.418 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3c3cccc4ccccc34)CC2)cc1 503901013 LCZVLONCPZHDIR-JWQCQUIFSA-N 378.475 5.131 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc(C)cs3)c3ccccc3n2)cc1 505300614 WYMGEBRFWWHJJL-IBGZPJMESA-N 383.476 5.465 30 20 GKED COc1cc([C@@H](C)NC(=O)Nc2ccc(CC#N)cc2)ccc1OCCC(C)C 506231655 OQJVCWAOJUIHMM-QGZVFWFLSA-N 395.503 5.069 30 20 GKED CCN(Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)C[C@H](C)C#N 509820274 PNRUHXZNCAOZBB-CQSZACIVSA-N 390.314 5.227 30 20 GKED C[C@@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1ccc2n[nH]cc2c1 513192837 SCGMGNDRDYLRNZ-LJQANCHMSA-N 380.495 5.113 30 20 GKED N#CCCN(Cc1ccccn1)Cc1ccc(-c2cccc(Cl)c2Cl)o1 513726029 WFRNGZTZSXEPIN-UHFFFAOYSA-N 386.282 5.564 30 20 GKED C=CC[C@@H](C(=O)N(C)c1ncc2c(n1)-c1ccccc1SC2)c1ccccc1 514970203 SBGJDKFLCZIEGX-GOSISDBHSA-N 387.508 5.072 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 517658334 GZTUNRZMMQRNNO-OLZOCXBDSA-N 391.286 5.606 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc(-c2ccccc2F)s1 519427929 ZKCFXEGCQOYXPY-ZDUSSCGKSA-N 397.500 5.453 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)C[C@@H](C)C2 520113548 PFKXKEBMEBWDKB-QDUFWUKNSA-N 399.494 5.182 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1csc2ccccc12 521260125 WDXGVCFZLNOCTA-AWEZNQCLSA-N 381.526 5.475 30 20 GKED CCn1c(S[C@@H](C#N)C2CCCCC2)nc2cc3ccccc3cc2c1=O 524535243 VPPITIPGEOMWSY-FQEVSTJZSA-N 377.513 5.134 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccn(-c2ccc(F)cc2)n1 530401839 BSWCXIGGTDIYQD-UHFFFAOYSA-N 377.463 5.045 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C)c1ccccc1 534640262 DTDASTWLMODYMZ-WOJBJXKFSA-N 390.527 5.308 30 20 GKED C[C@@H](NCC#Cc1ccc(Cl)cc1)c1cccc(OCc2ccccn2)c1 537053735 CBBCLKCDNQBHLZ-GOSISDBHSA-N 376.887 5.016 30 20 GKED C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1ccc(C#N)cc1 540596612 RREMNRSHZOWDEV-GOSISDBHSA-N 396.469 5.401 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(Br)cc1 544165526 DBCUHNQCKMZBJO-HNNXBMFYSA-N 397.316 5.006 30 20 GKED Cc1c(C(=O)Nc2scnc2-c2ccccc2)sc2ccc(C#N)cc12 550247065 AULUNWJANCONER-UHFFFAOYSA-N 375.478 5.457 30 20 GKED COc1ccc([C@H](CCC#N)NCc2cc(F)c(C(F)(F)F)cc2F)cc1 558255588 GFOLNZWAJACXQB-SFHVURJKSA-N 384.348 5.127 30 20 GKED N#Cc1cnc(N[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c(Cl)c1 588050053 BJGUUIYQOSCINQ-QGZVFWFLSA-N 395.812 5.205 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)CC2)c1 588838260 HBDVVIWOZAEYLD-UHFFFAOYSA-N 397.409 5.176 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(OCC(F)(F)F)cc1 590252675 GWRUCHVXLVBNTH-UHFFFAOYSA-N 381.247 5.038 30 20 GKED CC(C)Cn1cc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c2ccccc21 592973932 LIDPXMICRRTEMP-INIZCTEOSA-N 391.471 5.536 30 20 GKED CCC(C#N)(CC)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 599501565 RBWKTPSSBDZXKK-UHFFFAOYSA-N 377.366 5.161 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)o1 603624270 YDIVIRLUZNIIMB-FOIQADDNSA-N 387.439 5.033 30 20 GKED N#Cc1cccc(C(=O)N2CCC(CCc3cccc(C(F)(F)F)c3)CC2)c1 603990921 FORYTCHFFKIQPI-UHFFFAOYSA-N 386.417 5.062 30 20 GKED N#CCCCOc1cccc([C@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)c1 608860465 OALJIHJWNVLPBO-DEOSSOPVSA-N 397.478 5.136 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c1C#N 609032607 UABDKKFJAJSDLV-UONOGXRCSA-N 378.419 5.252 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)oc12 609063679 JKTDOCIZRFCSHC-UHFFFAOYSA-N 398.418 5.144 30 20 GKED Cc1nc(-c2ccc(NC(=O)CCCCOc3cccc(C#N)c3)cc2)oc1C 609501094 MLCGSCBJLVJSSM-UHFFFAOYSA-N 389.455 5.018 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N(C)Cc1cccc(C#N)c1 609936589 PGTITDZGBNJMOW-OAQYLSRUSA-N 389.524 5.054 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 610357256 JODSARQIKKRYSU-AOMKIAJQSA-N 389.886 5.361 30 20 GKED COc1ccc(CNc2ccc(-c3nc(C)c(C)o3)cc2)cc1OCCCC#N 610910446 IBSGTJLVSHUIDE-UHFFFAOYSA-N 391.471 5.262 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1)c1ccccc1 610972591 KCFCSVXDOCLUFD-NHCUHLMSSA-N 386.499 5.102 30 20 GKED COc1ccc([C@H](NC(=O)N[C@@H](CCC#N)c2ccccc2)c2ccccc2)cc1 610973731 DCFILXZODKDNOP-BJKOFHAPSA-N 399.494 5.129 30 20 GKED C[C@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccsc1 619787414 WIXSAMBVRQDQEB-INIZCTEOSA-N 391.496 5.276 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 620314075 RKFJWJQUESIDAJ-GASCZTMLSA-N 391.298 5.291 30 20 GKED O=C(/C=C\c1cccnc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 728697199 KFHJQHZONAONMX-ARJAWSKDSA-N 379.687 5.669 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(SC(F)F)cc1 730996221 WLYWRNBCIWRUOM-LBPRGKRZSA-N 378.469 5.505 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc3c(c2)CCC(C)(C)O3)S1 731562862 IOEDVPXABZAVEK-CPNJWEJPSA-N 392.524 5.299 30 20 GKED N#CCOc1ccc(CC(=O)Oc2ccc(-c3ccccc3)cc2Cl)cc1 731959438 JPWMAUCOXHCEQG-UHFFFAOYSA-N 377.827 5.057 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 732064193 AVVLCBHQFYWECJ-UHFFFAOYSA-N 395.462 5.414 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 732495578 DNJDVSYFOXYRMX-AZUAARDMSA-N 392.549 5.866 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 732591280 TWASFBFTHKSVSP-YADHBBJMSA-N 393.556 5.482 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C/c3cc(OC)ccc3O)s2)cc1 733750296 SLUKGTPLRXEUFU-UMYHVIPVSA-N 382.485 5.021 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 734666483 YNUFYSRAYVYZBY-JPYJTQIMSA-N 387.483 5.552 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)NC(C1CC1)C1CC1 734758756 VMNHBQWAYAXDCH-UHFFFAOYSA-N 393.531 5.076 30 20 GKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1ccc(Cl)c([N+](=O)[O-])c1 741840461 VRGOCRHAMYYGRG-SOFGYWHQSA-N 385.725 5.085 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2C[C@@H](C)[C@@H]2c2ccccc2)c1=S 743395851 UQRZAXZHQDQNIL-OXQOHEQNSA-N 394.519 5.057 30 20 GKED Cc1ncsc1C(=O)/C=C/c1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 745625436 AIURLWOKUABLML-PKNBQFBNSA-N 379.441 5.024 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CC(OCc3ccccc3)C2)cc1 746827540 GKCHICSIMLKAHT-DWJCEPTDSA-N 396.490 5.276 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C#N)cc2Cl)cc1NC(=O)OC(C)(C)C 769727438 ATNJNHUZERDPBP-UHFFFAOYSA-N 385.851 5.119 30 20 GKED O=C(/C=C/c1nc2ccc(Br)cc2s1)c1ccnc(Cl)c1 773142533 AQGCOQKXLYVCTG-ONEGZZNKSA-N 379.666 5.003 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(COc2ccccc2)c1 780513162 CCNPFIFPUYAFLS-KRWDZBQOSA-N 387.439 5.200 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2c(Cl)nc(Cl)n2-c2ccccc2)c(F)c1 781111927 RXVDUYPOWUBBNH-CMDGGOBGSA-N 386.213 5.086 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(Cl)c1SC(F)F)c1ccccc1 793335567 FTZQZPUVQKFBOA-ZDUSSCGKSA-N 380.847 5.681 30 20 GKED Cc1c(C(=O)N[C@H](C)c2nc3ccccc3s2)sc2ccc(C#N)cc12 794329375 RETGSVGXKKKKLM-GFCCVEGCSA-N 377.494 5.182 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2cccc(OC3CCCC3)c2)s1 797570127 CZNGXZZVHUDOJW-LJQANCHMSA-N 396.556 5.571 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C\c2ccc3ccc(Cl)cc3n2)s1 797571474 RYCQLPMUOCDIHQ-HLRDLLSLSA-N 395.915 5.532 30 20 GKED CC(=NNc1ccc(F)cc1Br)c1nc2ccccc2n1C(F)F 812465048 FEDAKWHBFRSFIL-UHFFFAOYSA-N 397.198 5.169 30 20 GKED N#C[C@H](C(=O)CCCCCc1ccc(F)cc1)c1cc(C(F)(F)F)ccn1 813216817 ZYYVVBIWQBREGW-KRWDZBQOSA-N 378.369 5.219 30 20 GKED CC(=NNc1ccc(F)c([N+](=O)[O-])c1)c1sc(-c2ccccc2F)nc1C 814904280 BPRHDGDWOVJHJS-UHFFFAOYSA-N 388.399 5.141 30 20 GKED O=C(/C=C/c1ccc(N2CCOCC2)cc1)c1ccc(-c2cccs2)cc1 818260019 OAYNBCPVZJCIQD-LFYBBSHMSA-N 375.493 5.148 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1cc(Cl)sc1Cl 819842284 MHVNPOLOZRSLKR-HJWRWDBZSA-N 390.291 5.925 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CC12CCSCC2)c1nc(-c2ccc(Cl)cc2)cs1 835068861 UBXKFFDGYITHBF-GJZGRUSLSA-N 388.945 5.173 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842940950 GENRCWVQUMRZCC-NHYWBVRUSA-N 378.419 5.094 30 20 GKED O=C(/C=C/c1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(C(F)F)nc1 853009633 MHYOFXSRTPNHJG-RRGWEWPQSA-N 393.817 5.127 30 20 GKED C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)c1nc(-c2cccc(Cl)c2)no1 904287942 DDNGJKFWGJHUDC-ZDUSSCGKSA-N 384.263 5.098 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2Cl)cc1 915352496 LLUSRUQCLVLBMU-HXUWFJFHSA-N 375.859 5.317 30 20 GKED CCn1c(SCCCOc2ccc(C#N)cc2)nnc1-c1ccc(Cl)cc1 915791561 LHQPKKREDLFIQI-UHFFFAOYSA-N 398.919 5.051 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccc2ccccc2n1 916849616 WBZRLSZHSRELIO-IMTHGLKYSA-N 398.462 5.992 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 919936243 HUCALDABPKHAGJ-TYOLEZHBSA-N 378.884 5.192 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCSc3ccccc3)n2)cc1 920140637 AMRPSTKJXJABFP-GOSISDBHSA-N 394.521 5.177 30 20 GKED C=CCN(Cc1ccc(C)cc1)Cc1csc(-c2cccc(C(=O)O)c2)n1 1776179917 CVBQCTUHSBECRI-UHFFFAOYSA-N 378.497 5.005 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CCC[C@@]3(C(=O)O)CCCC[C@H]23)cc1 1776786009 ZUFKTIXWTNKZRQ-DHLKQENFSA-N 399.575 5.839 30 20 GKED Cc1nn(C2CCCC2)cc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777554811 UTJLBNAIQHJAGL-KHPPLWFESA-N 390.439 5.161 30 20 GKED CC1(C)OB(c2ccc(-c3ccc(C#N)cc3)c3c2oc2ccccc23)OC1(C)C 2382215626 ZHMAPCQSTJCKFC-UHFFFAOYSA-N 395.267 5.424 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Sc2nc(C)cc(C(F)(F)F)c2C#N)c1 10399601 LWAIECZBESHIAS-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED C=CCN(CC=C)C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 21995393 QEGYPAQRQUNBLF-UHFFFAOYSA-N 394.544 5.172 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)C(=O)N[C@@H](C)c2cccc3ccccc23)n1 22360860 GVXASIAGCHOXDQ-DLBZAZTESA-N 389.524 5.081 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1sccc1C#N 24362724 RBNQEUZMPOQDKB-UHFFFAOYSA-N 393.415 5.323 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 24698170 SMHWZHDERGJKCG-UHFFFAOYSA-N 383.476 5.406 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2ccccc2)c1)c1ccc(C(F)(F)F)cn1 41555455 HERLJPALYDXDNU-GOSISDBHSA-N 382.341 5.383 30 20 GKED N#C[C@H](C(=O)Cc1cccc2ccccc12)c1nc2ccccc2n1C(F)F 41559138 JSBPGVRKNBSSCO-QGZVFWFLSA-N 375.378 5.004 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cccc(-c3cnco3)c2)c1 55315615 YSIQPIJFQNFJHX-UHFFFAOYSA-N 395.418 5.045 30 20 GKED COc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108532610 YHCDTAXVGPIWPZ-OXJNMPFZSA-N 395.528 5.316 30 20 GKED Cc1cc(Br)oc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 120060587 MZMICFJDLHGIIP-VIFPVBQESA-N 395.665 5.104 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccccn1 124872515 APTRTWUATGVASO-HNNXBMFYSA-N 389.484 5.034 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Sc2nnc(C)s2)cc1C)c1ccccc1 125121744 NJIIARXNRVEOFG-MRXNPFEDSA-N 395.553 5.605 30 20 GKED COc1ccc(/C=C(/Cl)c2nc3cc(F)ccc3o2)cc1OCCCC#N 130024258 SEBUFBFFWVARLQ-XNTDXEJSSA-N 386.810 5.395 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)oc12 147306355 NETRRPRPZFCVDT-QGZVFWFLSA-N 383.432 5.226 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 173002048 BAJXKMYTZNYJNP-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED COc1cccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 175946584 UEXLTYZAXNOPMC-KXBFYZLASA-N 376.481 5.189 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2cccs2)C2CCCC2)ccc1OC 180809793 HIPHONGLDQPJRA-PGRDOPGGSA-N 384.545 5.459 30 20 GKED N#CCc1ccc(NC(=O)N2CCc3ccccc3[C@H]2Cc2ccccc2)cc1 186536311 XWTKKTDKRBYAGA-XMMPIXPASA-N 381.479 5.127 30 20 GKED N#Cc1c(NC(=O)Cc2cnc3ccccc3c2)sc2c1-c1ccccc1CC2 188627481 FPGHOTPWMKUFPJ-UHFFFAOYSA-N 395.487 5.115 30 20 GKED N#CCCn1cc(CN[C@H](c2ccc(Cl)cc2)C2CC2)c(-c2ccccc2)n1 237744932 AHJPVQRMVSVXTE-QFIPXVFZSA-N 390.918 5.358 30 20 GKED Cc1ccc2cccc(N=C(O)N3CCC[C@H](c4nc(C)c(C)s4)C3)c2n1 328611855 OVDKOZLMANEAJU-KRWDZBQOSA-N 380.517 5.042 30 20 GKED O/C(=N/CC1(c2cccc(Cl)c2)CCOCC1)c1coc(C2CCCC2)n1 328842116 ZYPZJACWMCUSCH-UHFFFAOYSA-N 388.895 5.039 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCC([C@@H]2C(O)=Nc3cc(Cl)ccc32)CC1 329507068 HQMCTARZDVSHKL-SZNDQCEHSA-N 379.891 5.370 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cc1 410047948 RLUREUIQPQDGRR-UHFFFAOYSA-N 388.470 6.073 30 20 GKED Cc1c(-c2nc(Cc3csc(C(C)C)n3)no2)sc2ccc(C#N)cc12 426409177 GDNYNMXLDVQMNI-UHFFFAOYSA-N 380.498 5.302 30 20 GKED FC(F)(F)c1ccc(C#CCNC2(c3ccc(Cl)cc3)CCOCC2)cc1 427011421 FUJUBAQOJMJPBX-UHFFFAOYSA-N 393.836 5.006 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)NCc2cc(C#N)ccc2F)c1C 428788293 MFPHZQOWUWHDNC-UHFFFAOYSA-N 383.467 5.033 30 20 GKED C[C@H](NCc1c(F)cc(F)c(F)c1F)c1ccc(OCC(F)(F)F)cc1 430756019 RTSKTIFGBDPWGP-VIFPVBQESA-N 381.291 5.035 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(-c3cc[nH]n3)s2)cc1 431465413 ODUZADPWUTWRTJ-UHFFFAOYSA-N 386.436 5.054 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(OCC(F)(F)F)c1)c1ccccc1 432699817 PVZCBYWSWSKXCG-GOSISDBHSA-N 391.393 5.184 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C(F)(F)F)cc1)c1cc(Cl)ccc1C#N 433839066 OEJILZUVAMGXCL-UHFFFAOYSA-N 380.797 5.328 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 436365848 NCNKDKPVMFWDQB-IRLDBZIGSA-N 387.508 5.031 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(F)c(O)c(Cl)c3)c2)cc1 436981577 RBWNNMDUCLEXTE-UHFFFAOYSA-N 382.778 5.101 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2csc(C3CC3)n2)cc1F 437463901 AZUYBVZQEBVECR-UHFFFAOYSA-N 379.416 5.076 30 20 GKED CCCCOc1ccccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 437884718 XFIQZJRAMPOLQE-PZJWPPBQSA-N 377.488 5.169 30 20 GKED CCCc1c(NC(=O)c2sccc2C(C)C)cnn1-c1cccc(C#N)c1 440084259 YYRWXQNVRRPUCF-UHFFFAOYSA-N 378.501 5.134 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1csc(CCc2ccccc2)n1 444400180 RDPZGQSDJQYXIU-KRWDZBQOSA-N 393.581 5.935 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C1(C(F)(F)F)CCC1 448900134 ZTBHNQMTNCMCGG-UHFFFAOYSA-N 388.389 5.117 30 20 GKED CC(C)c1ncsc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 460008280 HAADBIMFHHRGJP-UHFFFAOYSA-N 379.510 5.218 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cscc2C#N)c(C(F)(F)F)c1 460082178 ZVGDTHJRKIYUPG-SNVBAGLBSA-N 384.448 5.781 30 20 GKED CC[C@@H]1CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c2ccccc2O1 460635592 SRXOVIBNXQZQQL-HXUWFJFHSA-N 398.462 5.363 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(-c2ncc3n2CCCC3)c1)c1ccccc1 463687457 ZBPGKZVIKWISHU-QFIPXVFZSA-N 399.498 5.053 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1CCC(c2ccccc2)CC1 463744520 JFZQJFHUDHHENY-KKXNLOMOSA-N 378.541 5.851 30 20 GKED N#Cc1ccccc1OC1CCC(NCC2CCC(C(F)(F)F)CC2)CC1 466474712 QHBBUCVZVGRRIY-UHFFFAOYSA-N 380.454 5.207 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3ccc(-c4ccccc4)o3)ccc21 468859427 GDEBOPAPMVKECH-UHFFFAOYSA-N 385.467 5.142 30 20 GKED N#CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1)c1ccccc1 470838665 DYCOBXKNSJXANH-UHFFFAOYSA-N 380.806 5.442 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](c1ccc(C)cc1)c1ccccn1 472485777 YZAMWAJIRVELRJ-QHCPKHFHSA-N 389.474 5.016 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2ccccc2COC(C)(C)CC)cc1 480164829 VGTOZGSSJQFDDY-UHFFFAOYSA-N 382.504 5.278 30 20 GKED C=CCn1c(SCc2coc(-c3cccc(F)c3)n2)nnc1-c1cccs1 481391602 QJXUKWGLAFTDGE-UHFFFAOYSA-N 398.488 5.279 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](N[C@@H](C)CC)c1ccco1 482183895 IDMSUGBCRRDIDX-FXAWDEMLSA-N 383.536 5.382 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1ccnc2ccccc12 483356650 TYKZVEJBOCAZRB-UHFFFAOYSA-N 395.437 5.401 30 20 GKED CC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cc(F)cc(Br)c1 486083472 CXPQDFOENPBPFC-ADLMAVQZSA-N 379.248 5.401 30 20 GKED C[C@H](S[C@@H](C)c1cccc(Br)c1)C(=O)Nc1ccccc1C#N 487903511 DLUMHCXPHBJCOX-STQMWFEESA-N 389.318 5.142 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CC4(CCC4)[C@@H]3c3ccccc3)o2)cc1 495353871 MCLWQWJNDZXGPW-QHCPKHFHSA-N 398.462 5.098 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)NCc3cccc4ccccc34)s2)cc1 502003753 WNUACBBSWBFEDZ-UHFFFAOYSA-N 398.491 5.080 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)sc2cccc(F)c12 503867834 ASJNRPQDFOYEAI-UHFFFAOYSA-N 376.456 5.150 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]3c3cccc4ccccc34)CC2)cc1 503901012 LCZVLONCPZHDIR-DQEYMECFSA-N 378.475 5.131 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc3ccccc3n2C2CCCCC2)c1 509069120 ZOHDRUKXEHGTGM-UHFFFAOYSA-N 378.863 5.319 30 20 GKED N#C[C@@H](C(=O)c1cc2sc3ccccc3c2s1)c1nc2ccccc2s1 513687475 TXPBNTPCAJRSSY-LBPRGKRZSA-N 390.514 6.216 30 20 GKED C=CCN(C(=O)C[C@H]1CCO[C@H](C(C)C)C1)c1nc(-c2ccccc2)cs1 514152025 QTPNUONIUJLQLH-PXNSSMCTSA-N 384.545 5.170 30 20 GKED N#Cc1c(NC(=O)CCOc2ccc3ccccc3c2)sc2c1CCCC2 514487995 VQQBOJBZNHPZDK-UHFFFAOYSA-N 376.481 5.059 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 517491711 BYKPQHSMNDVMNO-LBPRGKRZSA-N 382.316 5.051 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCc1ccc2ccccc2c1 518684816 NPOHPWKWCKFBSW-KRWDZBQOSA-N 389.524 5.456 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 518743031 JKBSVFVZWZNMCT-CYBMUJFWSA-N 396.903 5.377 30 20 GKED FC(F)(F)c1cccc(C2(NCC#Cc3ccc(Cl)cc3)CCOCC2)c1 518896019 VFFHOQPVKSECOE-UHFFFAOYSA-N 393.836 5.006 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 519450859 LNYOAZVQQIWTQA-GOSISDBHSA-N 381.545 5.691 30 20 GKED N#C[C@H](NC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1)C1CC1 520884629 DOPJKWXRMAHVNB-KRWDZBQOSA-N 391.323 5.318 30 20 GKED N#C[C@@H](NC(=O)CSc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 521353002 ZZODLKGVMDTZRL-CQSZACIVSA-N 385.703 5.120 30 20 GKED CCC(C#N)(CC)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 527731869 YSNOFOKMTKRRGV-UHFFFAOYSA-N 388.414 5.232 30 20 GKED Cc1ccccc1-c1cnc(CNc2cccc(OCc3cccc(C#N)c3)c2)o1 533816297 RSQVLKAMHVTBTJ-UHFFFAOYSA-N 395.462 5.713 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)c2c(Cl)cccc2Cl)cc1 537996009 QIFQPEDVTBENAU-UHFFFAOYSA-N 381.262 5.462 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc(Cl)c(C#N)c1 539369715 ZMDCPZPSLDKWBP-UHFFFAOYSA-N 384.060 5.188 30 20 GKED C=CCC[C@@H](NCc1noc(-c2ccsc2)n1)c1ccc(C(F)(F)F)cc1 540433588 WMRAJKKOWZVMCA-MRXNPFEDSA-N 393.434 5.614 30 20 GKED C=CCC[C@@H](NC1CCN(CC(F)F)CC1)c1ccc(C(F)(F)F)cc1 543090927 UHPOTQSYAQWHMN-QGZVFWFLSA-N 376.413 5.032 30 20 GKED N#C[C@H](C(=O)c1ccc([C@@H]2CCCOC2)cc1)c1nc2cc(Cl)ccc2s1 543734491 HPBVEZIBXJHDBV-NVXWUHKLSA-N 396.899 5.334 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC1CCN(c2ccc(C#N)cc2)CC1 552055670 YREAIXHFEOLIHS-NRFANRHFSA-N 387.449 5.119 30 20 GKED C=CCC[C@H](Nc1ccc(Cc2nnc3n2CCCCC3)cc1)c1ccco1 560550025 SXRNFXYQJIHKJB-FQEVSTJZSA-N 376.504 5.308 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2c3c(cccc13)CC2 562044679 LYXNYXBQFNVHTK-UHFFFAOYSA-N 388.515 5.326 30 20 GKED CC(C)(CCC#N)CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 571563750 MGEZYOSHIBZVEP-BMRADRMJSA-N 399.494 5.374 30 20 GKED CCCCOc1ccc(CNCc2ccc(C#N)cc2C(F)(F)F)cc1OC 579696946 VIDAUOMHOXTWEE-UHFFFAOYSA-N 392.421 5.054 30 20 GKED Cc1nc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)ccc1-c1ccccc1 580803434 KCZLRKNQGZQVMB-DHIUTWEWSA-N 396.494 5.361 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1OC(F)F 582656535 CFRCSIXTAAKCDW-KBXCAEBGSA-N 378.850 6.027 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)CC2)c1 587110550 VXTKMHXLKAVYIX-VQTJNVASSA-N 398.428 5.061 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1[C@H]2CC[C@H]1CC1(CC1)C2 599726196 BWZVWGKTLQMQSH-OALUTQOASA-N 387.483 5.598 30 20 GKED Cc1sc(NC(=O)c2sc3cccc(Cl)c3c2Cl)c(C#N)c1C 603484062 HNZXUYGKGOEGJJ-UHFFFAOYSA-N 381.309 6.010 30 20 GKED Cc1cc(C)cc(C2(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)CC2)c1 603960361 MDEQHNDXHFJDQY-UHFFFAOYSA-N 383.451 5.033 30 20 GKED CCO[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 604428882 MOSWRTAVOWERGR-GOSISDBHSA-N 399.878 5.037 30 20 GKED CCc1c(C)sc(NC(=O)[C@H](Oc2ccccc2)c2ccccc2)c1C#N 609032587 QRHBEAQTAQWEGO-HXUWFJFHSA-N 376.481 5.249 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c(C)o1 609063204 PIGKRUYMMXLTDO-UHFFFAOYSA-N 380.831 5.253 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccccc1C(C)(C)C 609428194 CNOIGNMDOIFGKM-INIZCTEOSA-N 382.529 5.396 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1c(F)cccc1F 609433205 JBFIVCVAOPALFP-INIZCTEOSA-N 378.422 5.266 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)NCc1ccc(C#N)cc1F 609452042 HUMLGSSYBSWGQC-UHFFFAOYSA-N 375.403 5.120 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 610334707 VPVCXMPKRGBFLB-CQSZACIVSA-N 395.459 5.304 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1cccs1)c1cccc(C#N)c1 610360790 GNXYHKBZKGWOAP-OAHLLOKOSA-N 378.522 5.403 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1coc2ccc(F)cc12 648239709 WQLFQZTYSPRBII-RKDXNWHRSA-N 397.290 5.211 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)c(F)c1 673627895 XAPYWIARLFFSQF-LSJOCFKGSA-N 375.303 5.525 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccc(Cl)c(C(F)(F)F)c2)SC1=S 727490716 WZHUEXDUSARDMW-SDQBBNPISA-N 377.840 5.136 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2sc3cc(C(C)C)ccc3c2Cl)nc(C)n1 732708043 JZQQEFYLAFQFAW-OAHLLOKOSA-N 383.904 5.575 30 20 GKED CC(=NNc1ccc(Br)nc1)c1cc(F)c(Cl)cc1Cl 732713211 SSNBOIYNDBWDMS-UHFFFAOYSA-N 377.044 5.126 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccc(O)c4ccccc34)c2)c1 734543643 RVBHIJDELVSHEK-UHFFFAOYSA-N 394.430 5.248 30 20 GKED C=CC[C@@H](NC(=O)NC[C@@H](C)c1c(Cl)cccc1Cl)c1ccncc1 734666755 JTAVOIDFLQJLFC-CXAGYDPISA-N 378.303 5.109 30 20 GKED O=C(/C=C\c1nccs1)c1ccc(-c2ccc(Br)cc2)s1 735228906 KWBHDBLQRGFRLT-YVMONPNESA-N 376.300 5.530 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)CCS[C@H](C)c3cccs3)c2C#N)C1 737406864 ZWZXCWCNLJYAJK-CHWSQXEVSA-N 390.599 5.629 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 739153970 ANMIWQAWMFZKFW-GXSJLCMTSA-N 380.416 5.357 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCC[C@H]3c3ccccc3)c2)s1 740059462 IOMXDFFNHZPRNQ-NRFANRHFSA-N 387.508 5.333 30 20 GKED O=C(/C=C/c1cc(Cl)c2c(c1)OCCO2)c1cccc(-c2ccncc2)c1 741473143 MIZDWBODJXLCNP-SNAWJCMRSA-N 377.827 5.069 30 20 GKED Cc1c(C(=O)/C=C\c2cnc3ccccn23)cnn1-c1ccc(Cl)cc1Cl 743056505 WPEVPGKQOVUCQY-VURMDHGXSA-N 397.265 5.031 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)COc2c(Cl)cc(Cl)cc21 743056702 JXUFGHHRFCPSAD-QPEQYQDCSA-N 399.233 5.234 30 20 GKED CC1(C)C(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)[C@@H]2CCCO[C@@H]21 743429573 SRFWMYCOMFJZFF-KSSFIOAISA-N 396.491 5.100 30 20 GKED COc1ccc(CCC(C)=NOCC(=O)Nc2c(C)cccc2C(C)C)cc1 744185197 OQLKJOSPBYUIIB-UHFFFAOYSA-N 382.504 5.091 30 20 GKED CC(C)CN(CCC#N)C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 751375151 ZBPDDIURHZAMSG-UHFFFAOYSA-N 382.316 5.129 30 20 GKED C#CC[C@H](N[C@@H](C)c1cc(Br)cc(Cl)c1O)c1ccccc1 756777560 ZTMMYVSCDDHPKW-SJCJKPOMSA-N 378.697 5.223 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-c2cn[nH]c2)c1 762393874 RBHKCTQGCVVAEG-UHFFFAOYSA-N 396.475 5.352 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2cc(Br)ccc2c1 764220913 ZWHOPRYSMINFSG-UHFFFAOYSA-N 394.272 5.138 30 20 GKED CC(C)[C@@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1cccc(Cl)c1 764307204 OSEFESPCCYHCBR-MRXNPFEDSA-N 392.242 5.152 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c(Cl)c1 769729813 JLUJIZULFDKKPP-UHFFFAOYSA-N 384.826 5.074 30 20 GKED CCCc1ccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776153640 BRQGSWURKBKYKN-HOYKHHGWSA-N 390.552 6.043 30 20 GKED C=CC[C@H](OC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 778744987 LJXRVVNMGUFCID-SFHVURJKSA-N 382.847 5.183 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccccc2Cl)nc1 780153276 WSHYYBGVGROLTK-CQSZACIVSA-N 393.830 5.070 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccc([N+](=O)[O-])cc1Cl 782189621 UOPRJCFCWDUWPN-GQCTYLIASA-N 376.846 5.329 30 20 GKED C=CCSc1ccccc1C(=O)O[C@H](C)c1nnc(-c2ccc(F)cc2)o1 784812581 JRSQXBCVUXHLQL-CYBMUJFWSA-N 384.432 5.072 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(-c3cccc(F)c3F)o2)cnn1-c1ccccn1 790219907 OITBXFUHCFIDBB-NTMALXAHSA-N 391.377 5.010 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H]1CCC(F)(F)C1 796747449 YCLDNHMKMKCJDN-KOLCDFICSA-N 376.243 5.287 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797566859 UXQUCUKHENNOPW-AWEZNQCLSA-N 383.448 5.033 30 20 GKED C#Cc1cncc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)c1 798165341 GCYKHMOHVIHHAO-OAHLLOKOSA-N 375.859 5.142 30 20 GKED CN(C(=O)Cc1cccc(OCC#N)c1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 798542712 DZZZWDZFCWFCFT-HSZRJFAPSA-N 396.918 5.175 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(Cl)c(Cl)c1 813211462 KTTALXCCLFFLLG-JOYOIKCWSA-N 387.188 5.387 30 20 GKED CC(C)(C)c1ccc(SCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813215914 LUQWVZXLRCIIJG-MRXNPFEDSA-N 392.446 5.366 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@H]1c1cccnc1 814577510 PIUQBXPURKAWTE-GOTSBHOMSA-N 396.494 5.352 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(OC(F)(F)Cl)cc1)c1ccccc1 817325171 YVSCALPIRDEPKW-KRWDZBQOSA-N 378.806 5.019 30 20 GKED COc1cccc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c1O 842733529 HSTVRUZIKYGNJW-UHFFFAOYSA-N 397.290 5.302 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1nc(C2CC2)cs1 842939766 XDWXNMJNQUNYRW-YIALFULDSA-N 396.821 5.582 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N2CCc3c(CC#N)cccc3C2)cc1 860575316 VBVVLWSOLBVHDB-UHFFFAOYSA-N 379.529 5.233 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1 915354108 VNMCALLFFFAHNA-QHCPKHFHSA-N 394.478 5.188 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)sc21 916848105 BIALOXGYCXBIFQ-KRWDZBQOSA-N 381.460 5.431 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(F)cc1F 918711788 AJLBYYBERZMUSP-VURMDHGXSA-N 395.352 6.003 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NN[C@H](C)c2ccccc2)cs1 920383871 ZJOUDCOISHIZJX-CQSZACIVSA-N 398.919 5.166 30 20 GKED N#CCCN(C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(F)cc1 920968462 QVZIBESRVATTAS-UHFFFAOYSA-N 395.437 5.601 30 20 GKED CCCCCCCCCCCN(C)Cc1cc(Br)ccc1C(=O)O 1776784638 ZQPGWHNKXJKTGY-UHFFFAOYSA-N 398.385 6.110 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](Cc2ccccc2)C(=O)O)c1 1776788657 HTTYEGGNWAXGGY-JOCHJYFZSA-N 383.532 5.069 30 20 GKED CCCCc1oc2ccccc2c1/C=C1\CCc2ncc(C(=O)O)cc2C1=O 1776807969 KKGCFIFMFZRTPG-SDNWHVSQSA-N 375.424 5.081 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)ccc1Cl 1777263149 ANRKHJNIEWJEKP-JXMROGBWSA-N 382.799 5.203 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3ccsc3)cc2)CCC1 1787287246 WGOLJFQIVMXKGU-HXUWFJFHSA-N 394.540 5.264 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)[C@H]3CC=CCC3)CCC2)cc1 1789455993 ICNLSIMIDPANIJ-SIKLNZKXSA-N 392.543 5.245 30 20 GKED Cc1ccc(-c2ccsc2C(=O)NCCSCc2ccccc2C#N)cc1 15826976 OFMZEUAFYGWLLO-UHFFFAOYSA-N 392.549 5.258 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(c3nc4ccccc4s3)CC2)c1 56772197 DEBCHWIQKUPVII-UHFFFAOYSA-N 393.512 5.273 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 58287748 ZZAUQPKKCRAIJC-UHFFFAOYSA-N 379.419 5.441 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 69285809 OHQMRTFOIRHXMS-SNVBAGLBSA-N 399.884 5.465 30 20 GKED Cc1ccc2c(CNc3ccccc3SC[C@H](C)C#N)cc(=O)oc2c1C 108355154 QOEFUBPVBLVWIC-CQSZACIVSA-N 378.497 5.274 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)[nH]c2c1C(=O)CC(C)(C)C2 108998792 DSMMSPLSCMMZAT-ZDUSSCGKSA-N 395.528 5.125 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2sccc2C#N)c1 116618368 QOAIYJGIOWBWEM-UHFFFAOYSA-N 379.828 5.189 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F)c1ccccc1 122879362 AIHJHQLGTMGAAY-OAHLLOKOSA-N 385.389 5.190 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccc(-c2ccoc2)c1 127867938 DVQMJFSYNWDEKR-INIZCTEOSA-N 399.233 5.215 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C/c2cncs2)C(=O)c2ccccc2)c(Cl)c1 129979503 UBXOXGSWDRUCII-LICLKQGHSA-N 396.899 5.318 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1cccc(OCCCC#N)c1 131916237 NUDMQMBDONAETC-UHFFFAOYSA-N 379.504 5.274 30 20 GKED C[C@H](N[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 152806008 VOTHXRLHPQODCG-STQMWFEESA-N 386.282 5.932 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)C(=O)Nc1ncc(Cl)cc1Cl 154179959 NPGCGBVBJUZTHF-MRVPVSSYSA-N 386.691 5.033 30 20 GKED C[C@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccc(C#N)cc1 154345030 SCTSXTBIGVQOFC-IFXJQAMLSA-N 377.488 5.549 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](Cc2ccccc2)c2cccs2)c1 175980085 VVOQHZUEBVKLJW-LJQANCHMSA-N 378.522 5.078 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Cc2cccc(C(F)(F)F)c2)n1 177746618 WPFLOZGKXKOUHJ-SWLSCSKDSA-N 380.435 5.340 30 20 GKED N#CCOc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 180547594 KNTMSLOLGKTBFB-LJQANCHMSA-N 393.487 5.019 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@@H](C)c1ccc(OCC#N)cc1 181777634 SWYKMULFBGKBNO-AVRDEDQJSA-N 376.525 5.594 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(C(F)(F)F)cc1 182122474 ATANQZSXQKUGCT-UONOGXRCSA-N 376.378 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(NC(=O)C(C)C)cc1 191467656 QDQTUGAJDLLUTL-UHFFFAOYSA-N 393.531 5.455 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1 191468857 HWOALCKQCKAFGV-OAQYLSRUSA-N 382.479 5.283 30 20 GKED C[C@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 246537627 SNWPMYXVFWIXQM-ZIFCJYIRSA-N 379.529 5.348 30 20 GKED Cc1nc(-c2ccccc2Br)sc1C(=O)/C=C\c1cncs1 255302556 RAXICKRXZSXBJD-SREVYHEPSA-N 391.315 5.234 30 20 GKED C[C@H](Nc1ccc(C#N)cc1F)c1cccc(NC(=O)Cc2ccccc2F)c1 301137849 DKXWUJITHOBTAU-HNNXBMFYSA-N 391.421 5.191 30 20 GKED O/C(=N/CC1(c2cccc(F)c2F)CCCC1)c1cnc([C@H]2CCCO2)s1 330258465 MLBKCYVLBBECHG-OAHLLOKOSA-N 392.471 5.089 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(CN2CCCC[C@H]2C)cc1 410343561 DOIYAETXKJHCJO-LJQANCHMSA-N 397.588 5.020 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@@H]3C)c1C1CC1 410973279 IANQFJYSZINIRI-OLZOCXBDSA-N 382.533 5.213 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2-c2c(F)cccc2F)cc1OC 428141111 LKQWOMGEDPGDIE-UHFFFAOYSA-N 395.405 5.458 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 432859482 OLANATPNRTYXRT-FDDCHVKYSA-N 393.556 5.442 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1csc([C@@H](C)OCC)n1)c1ccccc1 435104157 DPSGHOIACCUDOE-APWZRJJASA-N 387.549 5.090 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 435615507 PLYQHAMEHIMQRU-IEBWSBKVSA-N 379.529 5.910 30 20 GKED C=CCC[C@H](NC(=O)N(Cc1cccs1)C[C@H]1CCCO1)c1ccccc1 435759528 KXKNPDZQRFUVCS-CTNGQTDRSA-N 384.545 5.146 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccco2)n1Cc1ccccc1 436137551 YRWJZRCYGZFOEZ-UHFFFAOYSA-N 380.517 5.399 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(F)cn1 437031691 ABVSTIQIFAKIRO-BONVTDFDSA-N 380.307 5.584 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(OC(C)(C)C)cc1 438068652 AGEAMJKEADLWQY-HNNXBMFYSA-N 383.517 5.902 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)NCc1cc(C#N)ccc1F)c1ccccc1 438501097 JYTPGWPGLCEYOU-MRXNPFEDSA-N 389.430 5.159 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc3cc(OC)ccc3c2)nnc1-c1ccco1 439280728 SNGODJUJAOQFFA-HNNXBMFYSA-N 391.496 5.739 30 20 GKED O=[S@](Cc1cccc(NCC#Cc2ccc(Cl)cc2)c1)c1ccccc1 442119856 DEBLJIZKUJFJDH-AREMUKBSSA-N 379.912 5.111 30 20 GKED C[C@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 443190325 MWPXAPZIWMNOFZ-BEFAXECRSA-N 389.421 5.153 30 20 GKED Cc1cc(Oc2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2)n[nH]1 444306138 JOWPKJCKUNISFW-UHFFFAOYSA-N 399.454 5.021 30 20 GKED C=C(C)[C@H]1OCC[C@H]1C(=O)Nc1nc(-c2cc(Cl)sc2Cl)cs1 447127980 KZQALIUAWHAARC-PRHODGIISA-N 389.329 5.098 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1cccc(OCc2ccccc2C#N)c1 448509348 COSKOABLOBGTNV-UHFFFAOYSA-N 394.833 5.491 30 20 GKED C[C@H]1C[C@@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCO1 456897177 KASWJTRXWMIFPN-KBPBESRZSA-N 386.904 5.116 30 20 GKED N#Cc1ccccc1Oc1ccc(Nc2c(C#N)nnc3ccccc23)cc1F 463066130 BVMYRMTXXPGVTL-UHFFFAOYSA-N 381.370 5.048 30 20 GKED COc1cccc(F)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 467978056 GMDJNJMJKRPRJH-UHFFFAOYSA-N 396.805 5.404 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 470268508 YYSUIFHYUMGASD-GUYCJALGSA-N 389.377 5.155 30 20 GKED C=CCN(C(=O)c1ccc2oc(C)nc2c1)c1nc(-c2ccccc2)cs1 470733672 SZWRJAFGNXDWJK-UHFFFAOYSA-N 375.453 5.093 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)C[C@@H](CC#N)c2ccccc2)cc1 474413967 NRQZYKWJVPMZEW-GGAORHGYSA-N 376.500 5.226 30 20 GKED C=CCC[C@@H](NC(=O)c1cc(O)nc(C2CC2)c1)c1ccc(C(F)(F)F)cc1 474507655 XLHPFOWMKKUCJD-QGZVFWFLSA-N 390.405 5.121 30 20 GKED Cc1nc(NC(=O)C[C@H](CC#N)c2ccccc2)sc1Cc1ccc(F)cc1 474953514 LKBWMQZKPMNECB-SFHVURJKSA-N 393.487 5.208 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476531143 IZBIBBHOGYHLQQ-UHFFFAOYSA-N 385.305 5.626 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 482648086 QFWPRMXCSPUZQF-UHFFFAOYSA-N 382.769 5.050 30 20 GKED C[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(Oc2ccccc2)c(F)c1 484299204 WISBSTYDDBSOIT-MRXNPFEDSA-N 383.467 5.308 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N(CC=C)CC=C)cc1 486239573 BWMLWAYAWMNEQM-UHFFFAOYSA-N 392.524 5.031 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc(-c4ncco4)cc3)c2)c1 500241139 DFOALPOWQGQTAC-UHFFFAOYSA-N 381.435 5.404 30 20 GKED CCc1cc(C(=O)N(CC)c2ccc(C#N)c(Cl)c2)c2c(C(C)C)noc2n1 509271189 PRWVCPPMXUWJER-UHFFFAOYSA-N 396.878 5.100 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510022097 BLRSCPDAHBPPQY-QUCCMNQESA-N 381.907 5.792 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3ccc(F)cc3C#N)C2)nc2ccccc21 512257139 AKWKTQFFQWQPAK-SFHVURJKSA-N 376.479 5.008 30 20 GKED C[C@H](CN(C)C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccccc1 513299178 CWQHTZWUQAHNEH-LJQANCHMSA-N 384.479 5.013 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(Cl)cc2cccnc12 515768793 IWIKZFAMSGZNKV-UHFFFAOYSA-N 381.863 5.117 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1cc(Cl)ccc1Cl 517448434 FJABCQWRYYZDET-GFCCVEGCSA-N 395.311 5.405 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(F)cc1Br 518660111 KDVSEVFFFNHCPU-LBPRGKRZSA-N 379.298 5.452 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)on1 518745424 AWIKHNMNXDRTGB-ZDUSSCGKSA-N 397.887 5.642 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](Cc1ccccc1)c1ccccc1 520476416 WLZQVNQUTAAERE-RUZDIDTESA-N 397.522 5.462 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521088232 MPSSNKXIOBHDMC-UHFFFAOYSA-N 391.858 5.061 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)CC1CCC1 521809283 YTJAGQILLRHNQI-GOSISDBHSA-N 393.556 5.915 30 20 GKED Cc1ccc([C@@H]2CCCN2CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 532745365 WRFAHQLXYDEXMG-NQIIRXRSSA-N 393.556 5.165 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3ccc(C#N)cc3F)C2)nc2ccccc21 533392805 GFGUPPCDZSCWAY-LJQANCHMSA-N 376.479 5.008 30 20 GKED N#C[C@H](C(=O)c1cc(C2CCCCC2)[nH]n1)c1nc(-c2ccccc2)cs1 535404370 LSJPIYALLBNOQU-MRXNPFEDSA-N 376.485 5.071 30 20 GKED Cc1ccc([C@H](Cn2ccnc2)NC2CCC(C#N)(c3ccccc3)CC2)c(C)c1 537327469 OFCNDWCQMDCBHA-DHWVBAGJSA-N 398.554 5.235 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1cccc(Cl)c1 540856267 URZLTKCTPZGPGM-ZDUSSCGKSA-N 396.903 5.779 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)C[C@@H]2CC=CCC2)cc1 541475480 MJZODCXGYIFSBC-QGZVFWFLSA-N 391.471 5.179 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(Br)c(Cl)c1Cl)OCC 541634771 VKKZGEVBYBKCJU-NSHDSACASA-N 381.097 5.066 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccnc(C3CC3)c2)cc1Cl 543095918 UQZPFXGVMYHLAA-FQEVSTJZSA-N 387.870 5.520 30 20 GKED N#Cc1cc(C(=O)N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)ccc1Cl 553139939 HTHXYVISIJJUQZ-OAHLLOKOSA-N 392.808 5.250 30 20 GKED N#Cc1ccc(C[C@H](C#N)c2nc(-c3ccccc3OCC3CCCC3)no2)cc1 554816808 VFRXTTNSNAJUGM-HXUWFJFHSA-N 398.466 5.027 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(-c3ccc(F)cc3Cl)n2)c1 557385519 BEDIBWDSUKMANY-UHFFFAOYSA-N 386.213 5.318 30 20 GKED C=CCN(C(=O)c1ccc(Oc2ccccc2)cn1)c1nc2c(s1)CCCC2 559728231 BNKYRZYPJFPPNA-UHFFFAOYSA-N 391.496 5.042 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1ccc(C(F)(F)F)cc1 565889628 JZPRKXNNPXXBBI-LJQANCHMSA-N 393.453 5.438 30 20 GKED CC(F)(F)c1ccc(-c2noc(-c3cc(-c4cccc(C#N)c4)no3)n2)cc1 567654573 NYTRNRHOUNKOEL-UHFFFAOYSA-N 378.338 5.042 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(-n2cncn2)cc1Cl 570230277 OCPSFFNTLCDFDK-KKSFZXQISA-N 379.895 5.006 30 20 GKED Cc1csc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c1Br 571113798 UTRLSGIYMIAPSE-MRVPVSSYSA-N 395.347 5.129 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cncnc1-c1ccccc1)c2C#N 584515777 FAQHCLZORFOLLZ-KGLIPLIRSA-N 388.496 5.015 30 20 GKED CCOc1ccc(-c2noc([C@H]3CCCN3c3ccc(C#N)cc3)n2)cc1Cl 585731311 WTIFUPVAKYURIY-GOSISDBHSA-N 394.862 5.002 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H](OC(C)C)C1 593149840 WKPBUNWUTBASIL-NRFANRHFSA-N 393.487 5.080 30 20 GKED N#Cc1ccc(CC(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 609507521 STUCKUAVWKILJI-SANMLTNESA-N 376.459 5.160 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 609773684 QRIHKZBQIMSOIR-LJQANCHMSA-N 383.879 5.369 30 20 GKED C[C@@H](S[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccc(C#N)cc1 609825802 UMOQUWILNZFRFB-FZKQIMNGSA-N 390.430 5.177 30 20 GKED CSCCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 609928137 KBOBOHONBYGPRQ-SFHVURJKSA-N 387.936 5.260 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CCSc3ccccc32)cc1 610226032 BGPKLRGKAJIFHD-FQEVSTJZSA-N 386.476 5.569 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1nc(-c2cc3ccccc3o2)cs1 614159899 ZJEZFANHLGNLQD-IBGZPJMESA-N 385.492 5.595 30 20 GKED CC(C)C[C@H](NC(=O)c1ccccc1OCC#N)c1cccc(C(F)(F)F)c1 726756632 DEMSRRKLIZNFEL-SFHVURJKSA-N 390.405 5.125 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(SC(F)F)c1 727598091 WYKYFBPJEXUODH-UHFFFAOYSA-N 378.444 5.230 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(Br)s1 728437810 JJUAZNNLYCXCMU-ARJAWSKDSA-N 382.329 5.592 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)c3ccc(F)cc3)n2)cc1 728766753 JCMSYMVWAROIIY-GOSISDBHSA-N 378.472 5.412 30 20 GKED COc1ccc(/C=C2\CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)c(Cl)c1OC 730433920 KFNZMYGAXCIFDD-NCZFFCEISA-N 399.830 5.095 30 20 GKED C[C@H](/N=C\c1c(O)ccc2ccccc12)c1ccc(NC(=O)c2ccncc2)cc1 733750322 UBPXDDRXYQKBGO-YMOZLIFUSA-N 395.462 5.373 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=S)Nc2ccc(Cl)c(Cl)c2)c1 733755510 TVAURLTWTWCRNY-AWEZNQCLSA-N 394.327 5.161 30 20 GKED C[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 734080694 ZTYLVGLPHUHYKZ-SMDDNHRTSA-N 380.435 5.708 30 20 GKED C=CC[C@H](NC(=O)N(CCc1ccccc1)Cc1ccccc1)c1ccncc1 734684532 TXMPBSLIKGLFLH-DEOSSOPVSA-N 385.511 5.153 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cccc(C(F)F)c3)c2)s1 740447688 JPZUNDJTRMEFMN-UHFFFAOYSA-N 383.423 5.546 30 20 GKED CCc1ccc(-c2ccc(C(=O)NCc3cccc(O[C@@H](C#N)CC)c3)o2)cc1 742675359 BOVCJWNTGGIUHG-HXUWFJFHSA-N 388.467 5.120 30 20 GKED COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCC2(CC#N)CC2)cc1 744279606 UPKPGFQBSFYMPB-UHFFFAOYSA-N 388.467 5.013 30 20 GKED C[C@H](NC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1)c1cccc(C#N)c1 745922965 FYBCXZNNAXFILW-UUOWRZLLSA-N 381.479 5.128 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](Sc2ccccc2)c2ccccc2)n1 747197307 DFGXTAVWTIFNHL-WIYYLYMNSA-N 392.549 5.976 30 20 GKED CC(C)c1ccc(S(=O)(=O)c2ccc(NN=C3CC(C(F)F)C3)cc2)cc1 766007766 OKDDVLQEKYCHSM-UHFFFAOYSA-N 392.471 5.086 30 20 GKED C#CCCN(CC(F)(F)F)C(=O)c1ccc(CSc2ccccc2)cc1 767204390 QTOGLOIBHZYOTB-UHFFFAOYSA-N 377.431 5.007 30 20 GKED CC(C)c1nccnc1NN=C1CCCc2nc(-c3ccccc3F)sc21 773086274 PRWQWAYCAHPJED-UHFFFAOYSA-N 381.480 5.015 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1nc2ccccc2o1 777941374 PXZKUVVASCQBFH-OAHLLOKOSA-N 387.414 5.591 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cc(Br)c(Cl)s1 790171060 DVZJIJREZJABTO-UHFFFAOYSA-N 384.604 5.596 30 20 GKED C#CCCCCC(=O)Nc1ccc(C)c(Oc2ncccc2Br)c1 790597991 IHTFLBORPXIZSQ-UHFFFAOYSA-N 387.277 5.077 30 20 GKED COc1ccc(-c2cc(NCc3ccc(F)c(C#N)c3)ccc2OC(F)F)cc1 797854335 ZPFPTTUBVJJHQF-UHFFFAOYSA-N 398.384 5.586 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1ccccc1NC(=O)OC(C)(C)C 800155447 ZSZVUBSEIFGCPB-UHFFFAOYSA-N 394.515 5.724 30 20 GKED C[C@H](NCc1cccc2c1CCCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1 806181059 KLBZPJUMIVSLHD-KRWDZBQOSA-N 391.515 5.097 30 20 GKED CC(=NNc1nncc2ccccc12)c1sc(-c2ccc(F)cc2)nc1C 814705657 IYUYQBWRQYPLGG-UHFFFAOYSA-N 377.448 5.037 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@]3(CCSC3)C2)cc1 836274297 SUASYBSDGDZUJT-GMAHTHKFSA-N 391.540 5.093 30 20 GKED CC1(C)C[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c2ccccc2O1 842291765 NUMKVGCZLVJGHD-ZWKOTPCHSA-N 388.492 5.331 30 20 GKED CCc1nc(SCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)sc1C 845326740 YEUPREQMVMOFIP-CQSZACIVSA-N 399.566 5.106 30 20 GKED CSCC1(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 845445662 RCJYASOUOJJMRP-CQSZACIVSA-N 376.934 5.173 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc3cc(Br)ccc3o2)c1 850137959 ZGIFSUNUKVCVTC-QGZVFWFLSA-N 399.288 5.166 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)ON=C(C)c1cc2ccccc2o1 852016648 HPTZFPGLBKXQCH-MRXNPFEDSA-N 378.472 5.325 30 20 GKED O=C(c1ccc(Oc2cccnc2)cc1)N(O)Cc1cc(Cl)cc(Cl)c1 900096960 WWPJYUHWKGAKDS-UHFFFAOYSA-N 389.238 5.212 30 20 GKED C=C[C@@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 909529589 MIXKPKASOGTMOE-KRWDZBQOSA-N 386.517 5.090 30 20 GKED Clc1cc(Cl)c(NN=Cc2csc(-c3ccccn3)n2)nc1Cl 915946951 XFCMWUSWZADKEN-UHFFFAOYSA-N 384.679 5.006 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1cccc(Oc2ccccc2)c1 916881001 HXBDCKIINCDJGQ-FQEVSTJZSA-N 390.826 5.093 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(Cc2ccccc2)[C@@H](C)C2CC2)c1=S 917437462 VVGBYXHPBHXRJU-KRWDZBQOSA-N 394.544 5.118 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 919773343 FGTRKWIHRHPFHV-UZLBHIALSA-N 375.497 5.595 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C/c1ccccc1C#N 919893237 BYWLZYNWUNWZIY-MDWZMJQESA-N 379.419 5.183 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(C)=NNc2cccc(C(=O)O)c2)cc1 1776036806 WKBUVUDIHGNTRZ-GOSISDBHSA-N 382.504 5.816 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cc1)c1cc(C(=O)O)ccc1OC(C)C 1776052092 GZNMEXKEXHGPDK-UHFFFAOYSA-N 380.366 5.027 30 20 GKED CC(C)(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776265708 VLDPMCJFTGNFQU-OWBHPGMISA-N 390.435 5.718 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2c(Cl)ccc(Cl)c2Cl)c1)C(=O)O 1776470863 ZBIRSCIFCUXKRX-NVDWLVSRSA-N 399.657 5.395 30 20 GKED COCc1ccccc1/C=C(C)/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1777237679 WSIQSTDBBCDJSS-NQASNHIQSA-N 394.467 5.161 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1 32054903 SKFOPUIQGFJGTI-KRWDZBQOSA-N 388.442 5.110 30 20 GKED C[C@H](SC1=Nc2ccccc2CS1)C(=O)N(CCC#N)c1ccc(F)cc1 42512946 ATKPNBHVKWVXJW-AWEZNQCLSA-N 399.516 5.129 30 20 GKED Cc1ccc2oc(C(=O)[C@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cc2c1 64715436 WCQVDJOLKRHZKB-ZDUSSCGKSA-N 394.402 5.633 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)n2)cc1 66544422 QYWSMYORVKXDTN-QGZVFWFLSA-N 387.464 5.099 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2cccc(F)c2)C1 66954358 IATHNZGPWHLGGL-NVXWUHKLSA-N 383.492 5.241 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2c(C)cccc2C)cc1 127583003 QKYOBLGTUPTDIF-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F 154257813 PZPUVIYBISXANV-LLVKDONJSA-N 382.382 5.349 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1SCc1cccs1)c1ccccc1F 161404273 SKGKGTOJXGXLEU-GOSISDBHSA-N 382.485 5.174 30 20 GKED Cc1csc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)n1 173123270 OJXIOVSBAUMLPC-DYVFJYSZSA-N 386.546 5.119 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1ccc(OC)cc1OC 189907691 CEJPQYOSNLAESH-UHFFFAOYSA-N 381.516 5.517 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(OC)cc1 191453901 QSADIBZQKHYVJP-JOCHJYFZSA-N 378.516 5.916 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3c(c2)CCC3)cc1 255949579 ZYSAPSBVPQXPAZ-UHFFFAOYSA-N 384.504 5.592 30 20 GKED C[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1cccc(C#N)c1 301465708 XEMQYCYOIOAQCC-CQSZACIVSA-N 376.847 5.032 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 303450265 JJMORSNUIGCSGR-QZTJIDSGSA-N 377.381 5.163 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 303640004 QSSFQVCMJLVJRU-UHFFFAOYSA-N 384.479 5.821 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc(Br)ccc1F 321920410 TXOKSFHAADOFJY-ZDUSSCGKSA-N 377.257 5.444 30 20 GKED CC(C)(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329207676 YNGDPWYTHXQURF-DFQSSKMNSA-N 391.577 5.594 30 20 GKED OC(=Nc1ccc(Cl)c(C(F)(F)F)c1)C1CCC(/N=C(/O)C2CC2)CC1 329985396 DFPNYFSWHZAURV-UHFFFAOYSA-N 388.817 5.872 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)c(Cl)c1 329994461 MFLNAWAVWKFFDZ-ZOODHJKOSA-N 383.319 5.936 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C(F)F)cc1 425085972 MQHYIOMQWVYJPY-LBPRGKRZSA-N 382.332 5.197 30 20 GKED N#Cc1c(F)cccc1CNc1ccccc1C(=O)Nc1ccc(F)cc1Cl 427529610 WZKYZELVRDFHAY-UHFFFAOYSA-N 397.812 5.354 30 20 GKED CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)N[C@@H](CCCC#N)c1ccccc1 431279736 HDUMXHFIIVTHRL-KNQAVFIVSA-N 393.531 5.407 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 432833245 VSLQHSJVVKGTDC-AVRDEDQJSA-N 395.572 6.442 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H](c1cccnc1)C(C)C 435707174 VWCCKBDPHQSRAN-DEOSSOPVSA-N 399.494 5.219 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c(F)c1 436402692 ZXOGCADIIHPKKN-INIZCTEOSA-N 390.302 5.499 30 20 GKED CCn1nc(C(C)C)cc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437485669 RSPHMRJMJUYDIW-UHFFFAOYSA-N 392.434 5.082 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 438072838 LJUULBSGHJCWMR-JXFKEZNVSA-N 399.535 5.466 30 20 GKED C[C@H](NCc1cnc(C(F)(F)F)s1)c1ccc(-c2cccc(C#N)c2)cc1 443980302 AQUGBEOACNWRAX-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 444448605 KUDZLEGIMXWFTR-UHFFFAOYSA-N 397.503 5.893 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 446640975 AJGVBERFLGDWQA-STQMWFEESA-N 388.327 5.095 30 20 GKED C[C@@H](c1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1)C(F)(F)F 453797165 ZVTRFMZLDNZDTM-HZMBPMFUSA-N 386.295 5.256 30 20 GKED C=CCOc1ccc(CNC[C@@H]2CCCN(C)[C@H]2c2cccs2)cc1Cl 462729515 QYURJWHCLWQQPF-LAUBAEHRSA-N 390.980 5.139 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCCCC1 465998913 BOGWBLXKIUKUGX-GOSISDBHSA-N 391.515 5.422 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cc(CNC(=O)[C@H](C)CC(=C)C)ccc1Cl 466415469 GNRHLSGGCVLIDR-CVEARBPZSA-N 376.928 5.099 30 20 GKED CSc1ccc(F)cc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 467704719 LRRLPKWFZPBTMR-ZDUSSCGKSA-N 389.521 5.264 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H](OC)c1ccc(OC)cc1 475549198 NXHOCOMJNHPATF-HXOBKFHXSA-N 396.531 5.445 30 20 GKED CCS[C@H]1CC[C@@H](N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 475652307 FWEHRSNHILKDFZ-KNQAVFIVSA-N 394.540 5.291 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NS(=O)(=O)c1ccccc1CC#N 475822226 SBIAHCWCERCKOA-UHFFFAOYSA-N 394.521 5.013 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3c[nH]c4ccc(F)cc34)CC2)c(Cl)c1 478173942 WPKUDIFDIGAOBP-UHFFFAOYSA-N 396.853 5.244 30 20 GKED N#Cc1cc(Cl)ccc1CNc1cc(Cl)ccc1C(=O)N1CCCCC1 478353118 XYIXSWLVGJZGKJ-UHFFFAOYSA-N 388.298 5.103 30 20 GKED C[C@H](NCc1cccc(C#N)c1)c1ccc(Br)cc1C(F)(F)F 479274492 GFWOCNQNMCRPRV-NSHDSACASA-N 383.211 5.190 30 20 GKED N#Cc1ccc(F)c(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)c1 480150962 YDOJRVFXXRJMOG-UHFFFAOYSA-N 377.366 5.452 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(-c4cnco4)cc3)c2)cc1 483022152 WMKIYQWKFBBKTD-UHFFFAOYSA-N 381.391 5.258 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1 483089556 NVRUMQIGWRMXFD-UHFFFAOYSA-N 383.423 5.142 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@@H](CCCC#N)c1ccccc1 487565684 LTRXDEARJHLDTA-KRWDZBQOSA-N 397.544 5.206 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F 488371068 NHLWPACZQHKNEF-KRWDZBQOSA-N 382.451 5.009 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(COC2CCCCC2)c1 490588410 KKVNQPKLJQMSCT-UHFFFAOYSA-N 382.504 5.392 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1c[nH]c2ccccc12 495095172 VGDCNEJHTRWYKX-OAHLLOKOSA-N 399.416 5.124 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 499316402 LDUAZPOWGYZWPW-UHFFFAOYSA-N 397.544 5.216 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1 505970019 FPEIQJSYDYBYEE-HNNXBMFYSA-N 385.703 5.363 30 20 GKED CC(C)[C@H](Sc1nc2c(cc1C#N)CCCC2)C(=O)Nc1ccccc1Cl 511368081 BNXHNMRNWHZZNJ-IBGZPJMESA-N 399.947 5.241 30 20 GKED C=CCn1c(-c2c[nH]c3ccccc23)nnc1N1CCC[C@H]1c1ccsc1 515559094 KGFLGLCRIUVEPY-IBGZPJMESA-N 375.501 5.015 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)NCC(C)(C)CCC#N 516595557 FFLSJAVNILTEHK-UHFFFAOYSA-N 380.275 5.017 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 517256736 IUQAGULZDLDRFC-UUOWRZLLSA-N 396.494 5.228 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1Br 518146916 OAMIDOJHVUDNBZ-UONOGXRCSA-N 375.335 5.874 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCOc2ccc(F)cc21 518168828 LSIHHWJYWMDPAB-WMLDXEAASA-N 399.491 5.113 30 20 GKED CCc1noc(C)c1-c1noc(-c2ccc(Oc3cccc(F)c3C#N)cc2)n1 519636792 KKZGEJILJOIURZ-UHFFFAOYSA-N 390.374 5.066 30 20 GKED CCc1cccc2c1OCC[C@H]2NC(=O)Nc1ccccc1SC[C@H](C)C#N 520855692 XULAJYIBTPNTBP-CRAIPNDOSA-N 395.528 5.146 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3ncccc3c2)cc1Cl 523318073 NTEUKDKJYFFQNC-OAQYLSRUSA-N 397.865 5.796 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 524461434 ZCRBIZAUDZTAKQ-HNNXBMFYSA-N 380.419 5.086 30 20 GKED C[C@H](C#N)CN(C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)C1CC1 533602038 SGIWXJYEZZIJOT-SECBINFHSA-N 386.826 5.338 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1F 534174267 LGIMBAOXPZVFDW-WMLDXEAASA-N 389.833 5.230 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC[C@@H]3c3ccc(Cl)c(Cl)c3)cc2)CC1 538581859 VEFZNQFJDDEQGK-LJQANCHMSA-N 385.294 5.526 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(Cn2cccn2)cc1)c1cccc(C#N)c1 539494390 FHKQVXVMTCAMIL-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C=CCCOCCCCC(=O)N1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 540490874 YEJQREJZOGXLEK-LPHOPBHVSA-N 383.454 5.378 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OCc2nccn2C)cc1 551211183 NMRJTGMIXUIBSC-CVDCTZTESA-N 388.515 5.085 30 20 GKED C=CCC[C@@H](NCc1ccc(C(F)(F)F)cn1)c1ccc(C(F)(F)F)cc1 551391927 UHHSWHGJWWFXHS-QGZVFWFLSA-N 388.355 5.916 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC[C@H](c2ccccc2F)C1 554187033 BXYGVYSLQWEHHE-SFHVURJKSA-N 386.426 5.119 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(F)c2ccccc12 554621247 ZXOBFJFXSMFBGL-INIZCTEOSA-N 387.458 5.286 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)c1 556919007 HXYZTCPHXPQWIZ-UHFFFAOYSA-N 392.242 5.380 30 20 GKED CC(C)N(CCC#N)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 558901657 PFHAUFVWHQRFHQ-UHFFFAOYSA-N 395.553 5.232 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](F)(c2ccccc2)C1 563861370 GIFLLXORZXEUEB-IERDGZPVSA-N 383.492 5.041 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 565929273 KXTPJMHHDYBRLL-ZVZYQTTQSA-N 383.492 5.288 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2F)C1 569719165 DPQWSFXNRBLMOU-JKSUJKDBSA-N 383.492 5.099 30 20 GKED C=CCn1c([C@@H]2OCC[C@@H]2C)nnc1N1CCC[C@H]1c1ccc(C(C)C)cc1 580603928 YIXBWPZOJXLBKQ-DZFGPLHGSA-N 380.536 5.027 30 20 GKED N#CC1CCN(C(=O)NCc2cccc(Oc3cccc4ccccc34)c2)CC1 581741163 DRFNYLZFSPXFHO-UHFFFAOYSA-N 385.467 5.077 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 588348050 SLYMLSRGDIUYJC-UHFFFAOYSA-N 377.366 5.305 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3CC(F)(F)C4)cc2)cc1 599732289 VGABAUYQYISMPX-IRXDYDNUSA-N 383.398 5.145 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3csc(Cc4ccccc4)n3)c2C#N)C1 603615368 QIWCBBOEGAUHMR-ZDUSSCGKSA-N 393.537 5.044 30 20 GKED C=CCCCCCN(C)C(=O)N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 606924773 PUTIHFJRKZSLRG-MRXNPFEDSA-N 389.540 5.706 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 608917600 LDTKOIAGLXUUKF-HNNXBMFYSA-N 389.421 5.258 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@H]1c1ccccc1 609208752 JIVOZEPSRNICBF-QHCPKHFHSA-N 397.478 5.966 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297086 FTJQRIAGBOJOBC-OAHLLOKOSA-N 392.405 5.462 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccc(F)c(F)c3)no2)c2ccccc21 609476038 YWLDMYVDVGDANU-CLFYSBASSA-N 376.366 5.054 30 20 GKED CC(C)N(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1 609503277 KTUACDYXRROBDD-UHFFFAOYSA-N 391.858 5.454 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1 619350962 AKUFDFUBXNWCAV-SFHVURJKSA-N 375.472 5.144 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 680989231 AUBPOKSLXWXLHM-UHFFFAOYSA-N 399.450 5.046 30 20 GKED O=C(/C=C\c1ccccc1-n1cncn1)c1ccc(-c2ccccc2F)s1 726743427 GVKQECLABFPFSM-KTKRTIGZSA-N 375.428 5.031 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C/c1cccs1 730993840 DCPSKPRYKZBUMA-FNORWQNLSA-N 382.432 5.425 30 20 GKED CC(C)COc1ccc(C2(C(=O)[C@H](C#N)c3nc4ccccc4o3)CCC2)cc1 731767826 MJYZMCXHCHSMGA-IBGZPJMESA-N 388.467 5.161 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cc(C)ccc1C 733080017 PKMIFQLQRYMITM-UHFFFAOYSA-N 385.393 5.010 30 20 GKED C=CC[C@@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccncc1 734508600 BARXCSHZOZQHIL-JOCHJYFZSA-N 391.902 5.394 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c[nH]c4c(C)cccc34)n2)cc1 741431124 PLCAYSFDXASSSN-LJQANCHMSA-N 385.492 5.327 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccccc3OCC(F)(F)F)c2c1 741841044 JFXQDENYCAULFC-RMKNXTFCSA-N 375.346 5.014 30 20 GKED CC(=NNc1c(Cl)cc(Br)cc1Cl)c1scnc1C 741845848 XJABSLKOTWXMJI-UHFFFAOYSA-N 379.110 5.357 30 20 GKED COc1ccc(CNCc2ccc(OC(C)(C)C)cc2C(F)(F)F)cc1C#N 742393196 WFMZEHWMPAYNCP-UHFFFAOYSA-N 392.421 5.053 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2C[C@@H](C)[C@H]2c2ccccc2)c1=S 743392656 STGDOPRZPBRHRF-UZLBHIALSA-N 394.519 5.057 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1)c1ccccc1 746326759 UMJARNWLHPGLSV-VJBWXMMDSA-N 396.506 5.131 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nccs1 752485699 PRRIBHAOFDXMBH-OXQOHEQNSA-N 390.512 5.066 30 20 GKED COc1ccc(/C=C\C(=O)c2c[nH]c3ncccc23)cc1OCc1ccccc1 761810997 BBBROSWSTGXNRM-LUAWRHEFSA-N 384.435 5.047 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(OCc2ccccc2)c1 766227347 ZZJJIWNZODHUSN-UXHICEINSA-N 386.495 5.407 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)Nc2ccccc2O[C@H](C)C#N)c1C 780585120 WPNCGCXFUWYJNR-MRXNPFEDSA-N 395.503 5.635 30 20 GKED Cc1nc(NN=Cc2scnc2C2CC2)c2cc(-c3ccccc3)sc2n1 782133529 ZFBHPPBFDCVXMY-UHFFFAOYSA-N 391.525 5.447 30 20 GKED O=C1/C(=C/c2scnc2C2CC2)CSC/C1=C\c1scnc1C1CC1 782315867 YWZCNPXZFNCJLD-ACFHMISVSA-N 386.567 5.137 30 20 GKED CC(C)O[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796757522 ZJXVORAMYKYDHL-DNVCBOLYSA-N 384.888 5.292 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 796797159 LGMGGSMUTCJYQG-RCCFBDPRSA-N 378.884 5.443 30 20 GKED CC(C)(C)OCCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 796811129 LCUYHZTZZARVIU-LBPRGKRZSA-N 384.423 5.087 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 800385613 CLXQFIGLXHENRO-MNOVXSKESA-N 382.382 5.090 30 20 GKED N#C[C@@H](C(=O)C1(F)CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810532756 SYMGCQAXCOEXGP-ZDUSSCGKSA-N 397.302 5.966 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2CCC[C@@H]2c2ccccc2)c1=S 836445842 KWADRBFBQFNLKB-HXUWFJFHSA-N 394.519 5.201 30 20 GKED Cc1sc(NC(=O)c2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c(C#N)c1C 841008806 WXTVPGDOIJMWHX-ZDUSSCGKSA-N 399.516 5.075 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 845840781 FOSAJDNTBXCXDH-XJKSGUPXSA-N 386.278 5.107 30 20 GKED N#C[C@H](C(=O)Nc1ccc(SC(F)F)cc1)C(=O)C1CC2(CCCCC2)C1 850756354 POCCIMYOPYGKKJ-INIZCTEOSA-N 392.471 5.009 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@H]1Cc1ccccc1)c1nc(-c2ccncc2)cs1 850791581 VZKGZAHEGBTFIC-SLFFLAALSA-N 387.508 5.040 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1ccc(NC(=O)NC(C)C)cc1 915048938 LRMUDLCYGIWECK-UHFFFAOYSA-N 393.516 5.176 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2ccc(Cl)cc2)cc1 915088364 NSAQHFQVSYRAAA-NRFANRHFSA-N 392.911 5.726 30 20 GKED Cc1cc(C)c(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 920140496 DPWVESMUMZLSST-MHNQQFQPSA-N 397.503 5.497 30 20 GKED CCOc1ccc(C(CC)=NNc2ccc(C(F)(F)F)cn2)cc1OCC 920826627 QAVZFIXTFAHAFZ-UHFFFAOYSA-N 381.398 5.124 30 20 GKED CC(=NNc1ccccc1Cl)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776014834 GIYCHDJBVZJMJJ-UHFFFAOYSA-N 380.831 5.667 30 20 GKED CCC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1cc(C(=O)O)ccc1F 1776022432 OIQQBJMOAFOFOL-UHFFFAOYSA-N 379.435 5.224 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Oc2ccc(Cl)cc2)cc1 1776076111 WTDDNKMKIBPHSZ-UHFFFAOYSA-N 398.821 5.806 30 20 GKED C=CCOc1ccc(/C=C\c2nc(C(=O)O)c(-c3ccccc3)s2)cc1Cl 1776183971 WOCBOCWQINZZES-LUAWRHEFSA-N 397.883 5.897 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1csc3ccc(C(=O)O)cc13)CC2 1776374606 CFYIDKOJHWZGEC-CXUHLZMHSA-N 376.477 5.935 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2cccc(F)c2)s1 1776783070 WNQSJGXLFMIJGK-GOSISDBHSA-N 377.525 5.848 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](c2ccccc2)[C@H](C)C(=O)O)cc1 1776786498 MTCAASVLKSIUJW-WMZHIEFXSA-N 383.532 5.587 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1csc(-c2ccco2)n1 30969693 ABLWRTURCOEIGV-UHFFFAOYSA-N 394.525 5.064 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)coc2c1 46667857 OVZGRLKPNJYQLM-UHFFFAOYSA-N 397.434 5.290 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 65776533 IKCIYLRBKSJADP-UHFFFAOYSA-N 398.506 5.118 30 20 GKED Cc1ccc(CN(C)C(=O)c2ccccc2Sc2ccccc2C#N)s1 97542616 VBECIEHYBBMAQV-UHFFFAOYSA-N 378.522 5.352 30 20 GKED C=CCN(C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 107835430 FJWJMIWUKGJPPP-HZPDHXFCSA-N 394.462 5.698 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCCSc2ccccc21 108356744 UXJKIWFGGXIALN-INIZCTEOSA-N 397.569 5.022 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 123750716 RLZQOMDQTKXDAW-HUUCEWRRSA-N 399.564 5.224 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 135768864 OHILSMWCDAJNMN-HRCADAONSA-N 377.579 5.219 30 20 GKED N#CCC[C@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccccc1 153236497 PXESTAZDYROHEF-SFHVURJKSA-N 377.513 5.170 30 20 GKED Cc1cc(C)c(Br)c(C(=O)Nc2cccc(OCCCC#N)c2)c1 159122925 DETVJLKGOWEZOW-UHFFFAOYSA-N 387.277 5.001 30 20 GKED Cc1nn(CC(C)C)c(Cl)c1[C@@H]1CCCN1C(=O)Nc1cccc(C#N)c1C 178569276 MCSNBHGWBPUCTO-SFHVURJKSA-N 399.926 5.050 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(COC(C)(C)C)on1 191496815 KPEATAYFQHWGRO-UHFFFAOYSA-N 385.508 5.163 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C(C)(C)C)cc1)=C(\S)N[C@H](C)CC 194973136 BPGIQEKQNUFPHK-QGZVFWFLSA-O 397.608 5.161 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 255324611 YRHSKKRICYCUST-XQRVVYSFSA-N 397.447 5.128 30 20 GKED N#Cc1ccc(NC(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)c(Cl)c1 426129235 QRRRAYASEOLJEC-QGZVFWFLSA-N 392.311 5.187 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)n[nH]2)c(C)c1 426993169 VHFOCWUQLHJQEP-HNNXBMFYSA-N 390.512 5.198 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 429066432 UCYIJKGAJVCZSB-MSOLQXFVSA-N 388.298 5.325 30 20 GKED Cc1nsc(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 431397894 UZLLNPPRCGYUNV-UHFFFAOYSA-N 383.860 5.330 30 20 GKED Cc1ccc(Cl)c(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1C 434026943 WBDOKYGYKBJAOY-UHFFFAOYSA-N 380.831 5.253 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)c1cn(CCCC#N)c2ccccc12 434975566 DIUAWPDKAXKCNW-UHFFFAOYSA-N 379.891 5.261 30 20 GKED CS[C@H]1CCCCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 435719960 SGJKWQGDVZEHEE-IBGZPJMESA-N 396.581 5.208 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 437846964 LRBODPGBWXSKRC-MTNREXPMSA-N 377.488 5.168 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CNCC1CCC(C#N)CC1 441358635 PPCGHCVUJUTHDF-UHFFFAOYSA-N 384.527 5.267 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]2CCC[C@H]21 444380429 DJMYEMLHCWCTJP-XMSQKQJNSA-N 375.472 5.455 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)CCCC1(C)C 445241737 RQIOAQMCFVGVSN-IBGZPJMESA-N 381.476 5.131 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3csnn3)n2)o1 450834539 DIMDNQFLANTHQC-SECBINFHSA-N 396.419 5.245 30 20 GKED CCc1ccc(CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C2CC2)cc1 458797773 GTMVQYHAOWGEDN-QHCPKHFHSA-N 375.516 5.358 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 460171911 MRGFHVJUWYQRRP-JKSUJKDBSA-N 391.323 5.741 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC1CCCCC1)c1cc(C(F)(F)F)ccn1 464421758 VRFXSZQZVKQLDY-KRWDZBQOSA-N 388.389 5.302 30 20 GKED COCC[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 467157167 FLYLCCCERQSWOY-GOSISDBHSA-N 393.487 5.021 30 20 GKED C[C@H](CNC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 468299724 HKVRHMAIPHLLLG-SNVBAGLBSA-N 393.302 5.397 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3cc(Cl)ccc3Cl)ccc21 469241400 VNHHTKAFRBTWLN-UHFFFAOYSA-N 388.298 5.188 30 20 GKED Cc1cc(NC(=O)c2cn(CCCC#N)c3ccccc23)c2cccnc2c1C 469484709 XJTSZEZPSDTKQP-UHFFFAOYSA-N 382.467 5.362 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 473676965 PLCBLJPUNRTGMA-IAGOWNOFSA-N 399.585 5.549 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc1 474421816 PEJYEWRLZIUWCF-UHFFFAOYSA-N 387.508 5.427 30 20 GKED CCc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1C1CCCC1 475503927 PMKINYYHLXFXSF-OAHLLOKOSA-N 382.533 5.065 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1c(CCC)cccc1C(C)C 482231033 KIZMOKZRMGUWLP-UHFFFAOYSA-N 384.520 5.458 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)nc(-c2ccc(Cl)cc2)n1 483196300 CRSIIVZYHBKAMJ-IBGZPJMESA-N 398.853 5.144 30 20 GKED N#CCCC[C@@H](NC(=O)CC1(CSc2ccccc2)CC1)c1ccccc1 487510156 ATDYMVLFHAFPLW-OAQYLSRUSA-N 378.541 5.500 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1sc(-c2ccc(F)cc2)nc1C 499320424 RNMDSNADMKLERM-UHFFFAOYSA-N 380.488 5.129 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](c2cccc(C)c2)c2ccccn2)c1 499580248 UBTKIJPHQAOYFX-HSZRJFAPSA-N 387.483 5.256 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)Nc3ccc(CC#N)cc3)cc2)cs1 504166105 RJCZRWBSTRTIAR-AWEZNQCLSA-N 376.485 5.067 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1cccc(C(F)(F)F)c1 505948265 OCMAZIPOWJNDCX-INIZCTEOSA-N 388.320 5.099 30 20 GKED CCSc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 509502789 JSMFBDLGENKDEO-KRWDZBQOSA-N 381.545 5.351 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc4ccccc34)n2)cc1 517800856 LXPXJXKFOHDHDJ-INIZCTEOSA-N 390.489 5.523 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1cccc2ccccc12 518168498 JFMJUAXMMPXFMN-IRXDYDNUSA-N 389.524 5.974 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 519978415 FCURTWMKGFMFDC-UHFFFAOYSA-N 384.435 5.261 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520939249 ORFZERVHOCPHBW-INIZCTEOSA-N 389.430 5.715 30 20 GKED CCCC[C@@H](C)N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 521120897 PETHLMVITPRCDU-GOSISDBHSA-N 379.504 5.374 30 20 GKED CC(C)c1ccc(CCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521259624 PTFKGEIMZODVQM-KRWDZBQOSA-N 381.545 5.426 30 20 GKED C=CCn1c(SCC/C=C\c2ccc(Br)cc2)nnc1C1CC1 522684040 LBYJRMRBKSLFER-HYXAFXHYSA-N 390.350 5.300 30 20 GKED COc1ccc2c(c1)[C@H](N(Cc1ccccc1)Cc1ccc(C#N)cc1)CCO2 525124312 RXAHXRLAYDTBHZ-XMMPIXPASA-N 384.479 5.093 30 20 GKED C[C@@H](NCC1(c2ccc(Cl)cc2Cl)CCOCC1)c1cccc(C#N)c1 527485298 WPWQNNAEOSFEBV-OAHLLOKOSA-N 389.326 5.264 30 20 GKED CN(c1ccccc1)c1ccc(CNC2(c3ccc(C#N)cc3)CCOCC2)cc1 527811794 NSYWKZOFYODEQH-UHFFFAOYSA-N 397.522 5.122 30 20 GKED COc1ccc(CNc2ccc3nc(C4CC4)sc3c2)cc1OCCCC#N 532727741 WOAZSXNJOXXWMA-UHFFFAOYSA-N 393.512 5.477 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C)c1ccccc1 535366683 CADXKVNTYSNCCZ-UYAOXDASSA-N 390.527 5.166 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NCCCC2(C#N)CCOCC2)cc1 538612208 ZZMXOZAAQNMGMU-IBGZPJMESA-N 380.557 6.052 30 20 GKED C[C@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)c(F)c1 539610514 ZBWBWZNDHNKAOK-INIZCTEOSA-N 379.479 5.067 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 540364173 XDNDCWRFEJZJDM-CQSZACIVSA-N 393.434 5.403 30 20 GKED CC(C)(C#N)NC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 541900451 ZREZVUUYXMCSGM-UHFFFAOYSA-N 379.312 5.318 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2ccccc2[C@H]1C 548488977 RXSSRVBDXWUQKA-GOSISDBHSA-N 397.478 5.810 30 20 GKED C[C@@H](NCc1cnc2ccc(C#N)cn12)c1ccccc1-c1ccc(Cl)cc1 551547668 SQFOHVGLPXMUNJ-MRXNPFEDSA-N 386.886 5.377 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(F)c(-c3cccs3)c2)CC1 554558891 KYRNSXSGISQEFZ-UHFFFAOYSA-N 377.488 5.007 30 20 GKED COc1cc(CN[C@@H](C)c2ccc3ccccc3c2OC(F)F)ccc1C#N 558508182 DKDSWRYHXBUHBL-AWEZNQCLSA-N 382.410 5.172 30 20 GKED C=C(C)Cn1c([C@@H](CC)c2ccccc2)nnc1N1CCC(OC(C)(C)C)CC1 559011141 QOSSHPRSEJFXKQ-NRFANRHFSA-N 396.579 5.180 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC(c2c(Cl)cccc2Cl)CC1 561722944 WHWYPLDYGMIGFQ-UHFFFAOYSA-N 382.335 5.212 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CCc1ccc2ccccc2c1 565102527 FVVIJXTXHUVARI-UHFFFAOYSA-N 375.516 5.155 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1nc3c(s1)C[C@H](c1ccccc1)CC3)CC2 569009974 IJKFTLALIKXFQM-TZIWHRDSSA-N 385.536 5.064 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(C#N)cc1C(F)(F)F 576232674 YBDQYNNBMZYGKO-GFCCVEGCSA-N 375.419 5.380 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F 577550770 OYCRIUIFTMSCMA-UXHICEINSA-N 388.417 5.173 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 579853698 CVYMROFBAJBBFP-JHJVBQTASA-N 376.934 5.538 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSC1CCCCC1 585719962 AEDWXPDBCQYICE-QFIPXVFZSA-N 384.545 5.667 30 20 GKED N#CCCCCCC(=O)Nc1ncc(Cc2cc(Cl)ccc2Cl)s1 588265614 KZLFADCLSHUVAH-UHFFFAOYSA-N 382.316 5.453 30 20 GKED Cc1csc(Sc2ccc(NC(=O)CCCCCC#N)cc2Cl)n1 588909273 IFFFOHPKQPBMCI-UHFFFAOYSA-N 379.938 5.669 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCc3ccc(Cl)s3)cc2)ccn1 589470652 CBPBPGFHKWHWHU-UHFFFAOYSA-N 383.860 5.032 30 20 GKED N#Cc1cc(F)cc(NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 600860589 JCKIOWBCDYPECW-UHFFFAOYSA-N 379.822 5.215 30 20 GKED CSCc1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)oc2ccccc12 603613773 RRRJBMXDBUCBKT-CYBMUJFWSA-N 378.478 5.396 30 20 GKED CCCCS[C@H](C)C(=O)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 604115963 NEJLUWVKFIKROM-QGZVFWFLSA-N 384.520 5.461 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 604495672 CNCAPVITEXKPOE-IBGZPJMESA-N 393.531 5.274 30 20 GKED C=CCCOCC(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 607330770 JJMUZHJUYITSPT-UHFFFAOYSA-N 395.478 5.263 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1sccc1C1CC1 608876494 OHAFWNYBMXAUMA-UHFFFAOYSA-N 375.453 5.245 30 20 GKED CC(C)CN(C(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccc(C#N)cc1 608897274 VSHCIMPZZDNJIM-UHFFFAOYSA-N 393.487 5.047 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)CCc3ccc(C#N)cc3)cc2)c1 609033332 SIXSGRHGZCWHTB-HXUWFJFHSA-N 398.506 5.256 30 20 GKED CCN(C(=O)c1cccc(Oc2nccs2)c1)[C@H](C)c1ccc(C#N)cc1 609907141 NCTRYYQBIDFRFV-OAHLLOKOSA-N 377.469 5.030 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 610196449 BYWKWIMZICTXMG-UHFFFAOYSA-N 377.271 5.550 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(Br)cc1)c1ccc(C#N)cc1 612574844 KEQBMYMLTWDSBQ-YVEFUNNKSA-N 397.238 5.665 30 20 GKED C=C(C)CN(CC)C(=O)CNc1ccc(Oc2ncc(Cl)cc2Cl)cc1 615048898 XOXOOGPSUPVKLE-UHFFFAOYSA-N 394.302 5.017 30 20 GKED C=CCCC1(CNC(=O)CCc2nnc(-c3cc4ccccc4o3)o2)CCCC1 617416576 WZNOSJCZRXJQDS-UHFFFAOYSA-N 393.487 5.058 30 20 GKED N#CCCN(C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1ccc(F)cc1 619535547 GDEXMSJOPVLZSU-UHFFFAOYSA-N 378.378 5.318 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1-c1ccc(F)cc1 647378241 HARAMWQLFLJJDL-MRXNPFEDSA-N 382.485 5.687 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)c(F)c(F)c1 675739617 ZGSLPXSSNIKCRT-CPOMMVLXSA-N 393.293 5.664 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(CCCc2ccccc2)c1 726785450 JKUCGJGSTZBWIE-UHFFFAOYSA-N 386.520 5.730 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCCO[C@H](C)C2)c1 727590500 GBBGDZSOJHVRBQ-LJQANCHMSA-N 376.541 5.206 30 20 GKED Cc1csc(SCc2ccc(C(=O)Nc3ccc(F)c(C#N)c3)cc2)n1 728191443 DKHRUZJYNPUOQI-UHFFFAOYSA-N 383.473 5.007 30 20 GKED O=C(/C=C\c1csc(-c2ccc3c(c2)OCO3)n1)c1ccc(Cl)s1 728438290 SFYNZHPPNMIRRN-IHWYPQMZSA-N 375.858 5.150 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C/c1ccc(-c2ccc(Cl)cc2)s1 730575482 PPULOWIHBRWBSD-GZTJUZNOSA-N 388.945 5.571 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C/c1cccc(F)c1 730995743 SDQPOAQZTVZNOF-VMPITWQZSA-N 394.393 5.502 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(O[C@@H](C)C#N)cc2)c1 731298256 DVCKRGGEEJLQKZ-SBUREZEXSA-N 383.451 5.057 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 732417826 KPRUEGLPSDTFKK-KXBFYZLASA-N 390.512 5.244 30 20 GKED C=CC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1ccncc1 734457539 LHRJYTSWGGNDOH-DSITVLBTSA-N 398.506 5.198 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@H]2CCOc3ccccc32)c1 735439673 PMCKVWWUZKTONL-LJQANCHMSA-N 387.504 5.219 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1 740443153 AJPFDLNLANPWSH-UHFFFAOYSA-N 381.973 5.103 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1cccc([N+](=O)[O-])c1 740763952 JROASQHWLWIGDO-ZHACJKMWSA-N 395.846 5.006 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(N3CCOCC3)cc2)cc1 741467990 BURISXIXOKRQDI-NVNXTCNLSA-N 399.490 5.095 30 20 GKED Cc1cccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1C 743035778 JSWHEKLQGXGHCN-UHFFFAOYSA-N 391.471 5.915 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3cccc(Cl)c3)n2)cc1 744035396 RIGGTFKBTZLWFI-RDTXWAMCSA-N 380.900 5.752 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccccc1OCc1ccccc1)c1cccc(C#N)c1 745727404 GYDCMHCQFZYFOR-RBUKOAKNSA-N 399.494 5.259 30 20 GKED CC[C@@H](/N=C\c1cc(Br)ccc1O)c1nc(C(F)(F)F)cs1 745975909 CPFDDCYIPUTTOE-FFVKGDJCSA-N 393.228 5.200 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(Oc3ccccc3Cl)cc2)c1 746831582 CBGVPNPBKKPZEV-UHFFFAOYSA-N 378.815 5.287 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2cncc(SCc3ccccc3)n2)c1 754056665 NMCPAADKQWJMOE-IBGZPJMESA-N 390.512 5.062 30 20 GKED CC(C)n1ncc2cc(C=NOc3ccccc3C(F)(F)F)c(Cl)nc21 754712846 VMAWJXIRXKEKSK-UHFFFAOYSA-N 382.773 5.097 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12 759213685 GPWODGPCCWIFJZ-GUCAUAJOSA-N 388.854 5.244 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1 760800268 FTGAOWIKZMYDNN-HXUWFJFHSA-N 388.442 5.083 30 20 GKED CCO[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 761049741 QHUNOWMAVWASGU-QAPCUYQASA-N 376.909 5.091 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 762067506 HVANUMSUJKQWOA-BXKDBHETSA-N 383.325 5.046 30 20 GKED Cc1cc(Cl)ncc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 766796387 VGCSMPQUJPFGEM-UHFFFAOYSA-N 377.831 5.154 30 20 GKED CC1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)Cc2ccccc2C1 768867847 JSXZQVVSEJSPLH-HSZRJFAPSA-N 381.479 5.021 30 20 GKED O[C@@H](CN[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 775191986 NQYQBEHEGWUKHI-HOTGVXAUSA-N 395.318 5.161 30 20 GKED N#CCc1ccccc1CC(=O)N(c1ccccc1)c1nc2ccccc2s1 776749352 AXTSINJWEDYRSK-UHFFFAOYSA-N 383.476 5.270 30 20 GKED N#C[C@H](C(=O)CCCCC(=O)c1ccc(F)cc1)c1nc2ccccc2s1 778598215 IXHINIATTQTRPG-MRXNPFEDSA-N 380.444 5.055 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(C(F)(F)F)cnc1Cl 779769711 VYYIONFQILRCLI-SNVBAGLBSA-N 399.825 5.400 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1O[C@H](C)C#N)c1c(Cl)cccc1Cl 780666599 AFPZHYUSCMXAAH-CHWSQXEVSA-N 392.286 5.209 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)cc1 782544302 CAMSHJYVAQDNKE-GUDVDZBRSA-N 392.911 5.799 30 20 GKED Cc1ccncc1/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 783906259 GWUGKVJCOJNVPX-PWYGHMFVSA-N 387.870 5.351 30 20 GKED N#C[C@@H](C(=O)C(Cc1ccccc1)Cc1ccccc1)c1nccc2ccccc12 798861890 SUHMSPDPQWRPJK-RUZDIDTESA-N 390.486 5.513 30 20 GKED C[C@H](OC(=O)c1cccc(C(F)(F)F)c1F)c1ccc(C(F)(F)F)nc1 803059676 WWTXRBLPZUQVLU-QMMMGPOBSA-N 381.247 5.176 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 805877569 LDAQXFWJPHWSDJ-SCLBCKFNSA-N 389.455 5.039 30 20 GKED CON(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 812933941 NVKYXLYPFNZXSW-CQSZACIVSA-N 389.908 5.187 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)c(F)c1)c1ccc(-c2ccccc2)s1 844255363 PWAUVJRPOALDQA-VQHVLOKHSA-N 375.428 5.031 30 20 GKED Cc1cc(F)ccc1N(CC#N)C(=O)c1ccc(C2SCCCS2)cc1 875980921 INIFSYWCTKMPHG-UHFFFAOYSA-N 386.517 5.173 30 20 GKED CCCCOc1ccc(C=NOCc2cc(-c3ccc(F)cc3)no2)cc1OC 915212834 FURLKXGHGXULTM-UHFFFAOYSA-N 398.434 5.219 30 20 GKED C[C@H](CCc1ccccc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353467 UKRHIFMCKFYOAK-NTKDMRAZSA-N 383.495 5.485 30 20 GKED CCCC(=O)Nc1ccc(O)c(C(C)=NNc2ccc(Cl)cc2Cl)c1 916338661 RUWFPXAXLAECMX-UHFFFAOYSA-N 380.275 5.274 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2c(F)cccc2s1 916910342 WWLPFLVBPHZZSQ-INIZCTEOSA-N 394.471 5.126 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N(Cc1cccs1)c1ccc(F)cc1F 917782244 VZTIECBVFJHPFW-YFHOEESVSA-N 380.419 5.145 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1c[nH]c2ccccc12 918712332 JQDITMZRMOGHPC-JXMROGBWSA-N 394.883 5.753 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccccc1-c1ccccc1Cl 1776050906 KQJPHNBTOPPUIV-UHFFFAOYSA-N 380.831 5.160 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CSCC=C(C)C)C(=O)O)c1 1776787453 RJPCPCDUCGZORS-NRFANRHFSA-N 393.593 5.278 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccc(/C=C/C(=O)O)cc1 1777488307 ZPXHDZNYRCMMER-PHEQNACWSA-N 375.449 5.112 30 20 GKED N#Cc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 41538034 GXPXYUNQIJGPGL-HNNXBMFYSA-N 398.274 5.479 30 20 GKED N#Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)cc1 41538298 YPGZDACBGXJJGK-HNNXBMFYSA-N 398.274 5.479 30 20 GKED C=C(C)CN(CC)C(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12 58436715 DHCBFUIHBFZBLV-UHFFFAOYSA-N 376.500 5.201 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1)c1ccccn1 106983684 COQFENGDIVLXPH-KKSFZXQISA-N 396.874 5.584 30 20 GKED COc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1OCC(C)C 108325073 PGVPVXPWVVNEKF-INIZCTEOSA-N 398.528 5.234 30 20 GKED Cc1cccc([C@@H]2CCCN2CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 108360408 RUGFNVDYWHRUGR-RXVVDRJESA-N 393.556 5.165 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc1 109571302 GCZKBVHFQIZASL-UHFFFAOYSA-N 386.436 5.088 30 20 GKED CNC(=O)c1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)cc1 121765230 WXBPXUWCTOWKSX-CYVLTUHYSA-N 398.487 5.079 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1CCC(F)(F)F 126181619 HURCMCAAHQEAKP-UHFFFAOYSA-N 392.421 5.410 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(C(=O)Nc2ccccc2OC)cc1 157842038 SDDXRODJIBHSQB-UHFFFAOYSA-N 395.503 5.158 30 20 GKED N#CCC[C@H](Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccccc1 164276343 KXNYIKQAXVWPPN-INIZCTEOSA-N 383.377 5.014 30 20 GKED CCN(C(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1ccc(C#N)cc1 174077998 GCQCLNKRIMKUQI-UHFFFAOYSA-N 389.069 5.234 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1csc(-c2ccccc2F)n1 179831719 LFOIATDWBJIMTG-AWEZNQCLSA-N 383.517 5.956 30 20 GKED CCn1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c2ccccc21 193665060 YTYCTPADFNJDLK-GOSISDBHSA-N 396.475 5.146 30 20 GKED O=C(Cc1ccccc1)Nc1cc(N=Cc2cc3ccccc3nc2O)ccc1F 255889212 SYQDKDMSNBOREF-UHFFFAOYSA-N 399.425 5.011 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1coc(-c2ccc(C(F)(F)F)cc2)n1 277516439 CIIUQLUVXZQMGH-HHHXNRCGSA-N 398.450 5.329 30 20 GKED C[C@@H]1CN(C(O)=Nc2cccc(-c3ncc4n3CCCC4)c2)[C@@H]1c1ccccc1 330265912 ZXCHBJQUUWBAIM-VGSWGCGISA-N 386.499 5.125 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCc1ccc(C#N)s1)C1CC1 422213440 GAKUHNROIRRCBY-LBPRGKRZSA-N 393.434 5.074 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](C)c1c[nH]c2ccccc12 426333384 UJIQYMMMICSFML-HOTGVXAUSA-N 377.513 5.694 30 20 GKED C=CCC[C@@H](C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1 428037511 ZAEVBMCQMIORGP-FGZHOGPDSA-N 377.532 5.242 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1)c1ccccc1 431303627 ZVNRAHMBSYXJAL-JQVVWYNYSA-N 379.479 5.196 30 20 GKED Cc1c(C(=O)N2CCCCC[C@H]2c2ccncc2)sc2ccc(C#N)cc12 432007169 OJHVMDVMACUGED-IBGZPJMESA-N 375.497 5.234 30 20 GKED C=CCN(Cc1cccs1)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 433530397 YSRZDSFAVMTTCX-MYMYQCDVSA-N 383.479 5.412 30 20 GKED Fc1ccc(F)c([C@H](NCc2ccccc2OCC(F)(F)F)C(F)F)c1 434666010 OQWJTPZUVMNENG-HNNXBMFYSA-N 381.291 5.002 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 438845389 BBRKSVFYSDNYQR-ZWKOTPCHSA-N 385.920 5.221 30 20 GKED C=CC[C@@H]1N(C(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)CCCC1(C)C 443857228 HXJHUNNJUXTUQL-QFIPXVFZSA-N 390.527 5.170 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H]3Cc3ccccc3)cc2)cc1 443859537 NUWIOYRYSBZMOM-NRFANRHFSA-N 383.451 5.199 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CCc3c(Cl)cccc32)c2ccccc21 444018807 ILCUTJSTIHHQJU-HXUWFJFHSA-N 377.875 5.016 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCc1cc(Cl)sc1Cl 445799726 QBKNOVJPZQCIKW-UHFFFAOYSA-N 399.368 6.022 30 20 GKED CC[C@H](Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1ccc(C#N)cc1 447598025 ULKOLZWRRXQKOO-DEOSSOPVSA-N 395.506 5.253 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cccc(C#N)c1Br 448761013 HVLJWEJIOMYSMC-UHFFFAOYSA-N 385.305 5.820 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)cc1 454453538 VQXYITZQUJOQFS-UHFFFAOYSA-N 387.405 5.138 30 20 GKED CC[C@H](CNc1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 454747938 ALMZMMXMHYXQMQ-IAGOWNOFSA-N 382.533 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H]1OCCc2sccc21 455254923 XOURFKKLVZAATI-YCRPNKLZSA-N 384.545 5.424 30 20 GKED COc1cccc([C@H]2C[C@H](N(C)C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c1 458842421 PKPPELCAPFGVIG-FUDKSRODSA-N 391.515 5.018 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@@H]3CCC[C@H]32)c1 460395887 WBOBQYAMEOCURR-MGPUTAFESA-N 380.875 5.409 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(C)cc3)o2)nnc1-c1ccoc1C 463035735 HURAXJOQDMHLQU-UHFFFAOYSA-N 392.484 5.288 30 20 GKED C=CCn1c(SCCC(C)(C)C#N)nc2cc(-c3ccccc3)sc2c1=O 463252060 XQCLYDZBEIGECB-UHFFFAOYSA-N 395.553 5.343 30 20 GKED Cc1cc(Br)cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 463713645 RVWRRRZVLYEBOW-CYBMUJFWSA-N 389.318 5.262 30 20 GKED Cc1nc(C)c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 465394553 KXZVTGVHGUGWLV-UHFFFAOYSA-N 383.860 5.330 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 469008510 NJDYALQFFQRCPI-UHFFFAOYSA-N 396.830 5.035 30 20 GKED CCC1(CC)Oc2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2O1 470545758 HUZXOOXGTUDGGA-SFHVURJKSA-N 379.460 5.141 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)c1ccccc1Sc1ccccc1C#N 470621970 RTTWEACNTXVWAP-XJKSGUPXSA-N 390.430 5.122 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(N(CC)CC)nc1 475553852 PTVGLGADZNCZNP-UHFFFAOYSA-N 380.536 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCO[C@H]1c1ccc(C)cc1 475571537 GFZLCNLPOVHFLR-UPVQGACJSA-N 392.543 5.889 30 20 GKED CSc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1Cl 475956662 KLMMOVATIFPPLD-UHFFFAOYSA-N 375.881 5.388 30 20 GKED N#CC[C@H](CC(=O)N[C@H](COCc1ccccc1)c1ccccc1)c1ccccc1 476094404 HNDQLUHFDYPAKP-JWQCQUIFSA-N 398.506 5.148 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cc(C2CC2)nc2c1cnn2C(C)C 482911006 KZYDAYBRHGLDMV-UHFFFAOYSA-N 380.536 5.098 30 20 GKED N#CCCC[C@@H](NC(=O)c1cnc(-c2ccccc2F)s1)c1ccccc1 487410371 XSYBYOCVOQRGMT-GOSISDBHSA-N 379.460 5.114 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(CN2CCSCC2)ccc1C)c1ccccc1 488703573 PDBYDNPLTKDIIB-QFIPXVFZSA-N 394.584 5.232 30 20 GKED CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)c1sccc1C#N 497988021 FWKJALLWJJRKIW-UHFFFAOYSA-N 384.501 5.538 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CN[C@@H](C)c1ccc(C#N)cc1 498116707 HWKGQFQMYHGSRJ-FQEVSTJZSA-N 392.506 5.570 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCSc1ccccc1F 501004096 XACDOWOOSMRPHY-UHFFFAOYSA-N 380.444 5.006 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)cc1 502796716 SHUMROMBFKSMEJ-UHFFFAOYSA-N 383.423 5.142 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1 503357755 FTERYBOEPGHODS-UHFFFAOYSA-N 390.487 5.123 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 503974014 TYIPQFKECPJTGQ-LEWJYISDSA-N 397.305 5.284 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1OCC 505262362 SGFMDKPQMYOBSO-MRXNPFEDSA-N 395.503 5.168 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)c1csc2ccccc12 506645121 HAOFGLJICWNLSU-CYBMUJFWSA-N 388.539 5.096 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(F)cc1)CCC2 509229827 IOOFPLFTAONLGM-FBMGVBCBSA-N 399.469 5.236 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1ccncc1F)c1ccc(C(F)(F)F)cc1 511531196 YAHLVNRVHOBNHS-SCLBCKFNSA-N 395.400 5.307 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 518685113 ZVZVGUXJSNLWRM-LSDHHAIUSA-N 387.936 5.817 30 20 GKED N#Cc1cc2c(nc1SCc1ccc(OCc3ccncc3)cc1)CCCC2 519939418 DRCRYDCETXLCAB-UHFFFAOYSA-N 387.508 5.098 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600487 AAEXMDJPENIHRC-UHFFFAOYSA-N 391.858 5.668 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1cccc(Cl)c1 520813931 WUKWHQKQMGQCMU-CQSZACIVSA-N 390.961 5.606 30 20 GKED COCCSc1ccc([C@@H](C)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1 520988890 LWNCXRTUJDYUEJ-CYBMUJFWSA-N 380.435 5.489 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc(C)c(OCc2cccnc2)c(C)c1 521486478 ODXLJFGAHXQINB-UHFFFAOYSA-N 393.531 5.070 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1ccc(C#N)cc1 521764198 IWVBOMIILPEAID-GOSISDBHSA-N 381.479 5.271 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1 524113686 CPLWOYNGKNIVGA-RYUDHWBXSA-N 397.208 5.209 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CC1 533132606 VTNSOUCRTFSGAW-AWEZNQCLSA-N 394.862 5.160 30 20 GKED C[C@@H](C#N)CN(C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)C1CC1 533602041 SGIWXJYEZZIJOT-VIFPVBQESA-N 386.826 5.338 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CCCCC2)[nH]n1)c1nc(-c2ccccc2)cs1 535404369 LSJPIYALLBNOQU-INIZCTEOSA-N 376.485 5.071 30 20 GKED COc1ccc(C[C@H](C)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 536244713 OIHXDKRBJNPGTC-IRXDYDNUSA-N 397.544 5.090 30 20 GKED C=CCC[C@@H](NCc1nc(C2CCCC2)no1)c1ccc(C(F)(F)F)cc1 537129053 DKDAIFQHQVBXJK-QGZVFWFLSA-N 379.426 5.543 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(-c2ccc(F)cc2)cc1 537724577 DBNLEKWWMXVBAN-KRWDZBQOSA-N 387.458 5.267 30 20 GKED CCN(C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccc(C#N)c(Cl)c1 540274238 JXOSVUKDCXHXBZ-UHFFFAOYSA-N 396.277 5.594 30 20 GKED COc1ccc(C#N)cc1CN[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 542576108 XJLQDOHJCXMQJA-CYBMUJFWSA-N 397.931 5.503 30 20 GKED Cc1c(F)cccc1NC(=O)CCSc1ccc(C#N)c(C(F)(F)F)c1 542936595 RYCNZLAWRCOWHW-UHFFFAOYSA-N 382.382 5.146 30 20 GKED C[C@H](NCc1csc(-c2ccc(Br)cc2)n1)c1ccc(C#N)cc1 548936539 HCEJWRYPCVIZOF-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ncc(Br)cc1F 550826389 DOAKKQWYWWPMOG-GUYCJALGSA-N 376.273 5.069 30 20 GKED CC(C)(NC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 551667730 IVZIHFLMRSSPPR-UHFFFAOYSA-N 394.858 5.049 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc(F)cc1 553944952 HYNHBVIFNUMPBJ-IAGOWNOFSA-N 377.246 5.183 30 20 GKED N#Cc1c(F)cc(CNC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1F 555600223 VMRZEVZMGISZMM-UHFFFAOYSA-N 397.233 5.288 30 20 GKED Cc1cc(Br)c(C(=O)N[C@@](C)(C#N)C2CCCCC2)cc1Cl 557533845 PWQVHUDGTWKAGP-KRWDZBQOSA-N 383.717 5.003 30 20 GKED N#CCc1ccc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 561777454 NREJQVQNLYYCRW-IBGZPJMESA-N 378.825 5.666 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)o2)cc1 565857602 GTUBYELQPGMWNT-OAHLLOKOSA-N 378.501 5.308 30 20 GKED CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567203601 WTAGTAWAVSFLBM-UHFFFAOYSA-N 386.455 5.108 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1ccccc1Cl 572785659 WHFVKUURBYLFGS-UHFFFAOYSA-N 380.831 5.050 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c2[C@H](C)C1 579445960 MWJTWTJXGICOLO-UONOGXRCSA-N 388.496 5.015 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(C(C)C)nc3C)o2)cc1 583275764 WNRXRHSLVFKMBK-UHFFFAOYSA-N 381.501 5.421 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)c2sc3cccc(F)c3c2COC)cc1 584814939 CJOXFIVBHGOFSN-GOSISDBHSA-N 396.487 5.086 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1cccnc1)c1nc2cc(F)ccc2s1 592974029 MMHVYUHTQFNIOV-MRXNPFEDSA-N 389.411 5.113 30 20 GKED Cc1c(Cl)cccc1-n1c(SCC2(CC#N)CC2)nnc1-c1ccncc1 594882364 SIMWMZMZYCWGFQ-UHFFFAOYSA-N 395.919 5.077 30 20 GKED N#CC1(c2ccc(CNc3cccc(C[S@@](=O)C4CCCCC4)c3)cc2)CC1 594933426 FNBMQKBPJMCXEE-MUUNZHRXSA-N 392.568 5.435 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(O[C@@H]2CC2(F)F)cc1)c1ccccc1 597115724 CAYDRCWTQGFFIC-RBUKOAKNSA-N 385.414 5.030 30 20 GKED CCCCSc1ccc(C(=O)N2CCC[C@@H](CC#N)C2)cc1C(F)(F)F 597904214 FNGFIJDIJCKLCL-AWEZNQCLSA-N 384.467 5.363 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C(c1ccccc1)c1ccccc1 603530255 BWAGSBJMVOMVHO-UHFFFAOYSA-N 382.507 5.375 30 20 GKED N#CCc1ccc(NC(=O)NC[C@H]2CC3c4ccccc4C2c2ccccc23)cc1 603650873 JSUCNMVXHPLEKK-SGAUDOEVSA-N 393.490 5.171 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1ccc(C(F)F)cc1 608804072 OHYTXLNAYBHFQZ-UHFFFAOYSA-N 394.396 5.790 30 20 GKED N#CCn1c(C(=O)N(Cc2ccccc2)Cc2ccccc2)cc2ccccc21 609161439 RKRHKRXNQYFFIG-UHFFFAOYSA-N 379.463 5.007 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccc(F)c(Cl)c1 609370756 VECOIYAWOPQUPX-LBPRGKRZSA-N 394.924 5.462 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CC[C@@H]3CCCCO3)cc2Cl)c1 609504003 JEGATTHUFPBJDY-IBGZPJMESA-N 398.890 5.078 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2nc(/C=C\c3ccccc3)cs2)cc1 609757098 JAQRSLOOZRQCCR-KHPPLWFESA-N 391.521 5.057 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccsc1 609970419 CUQWFCFBNWSCGK-AWEZNQCLSA-N 396.899 5.594 30 20 GKED CCN(C(=O)C[C@@H](C)c1ccccc1C(F)(F)F)[C@H](C)c1ccc(C#N)cc1 610171622 XQAZPRYOSCTAAT-HZPDHXFCSA-N 388.433 5.680 30 20 GKED C[C@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1cccc(C#N)c1 610408423 WSQOBLKDBIKJKL-XOBRGWDASA-N 393.537 5.100 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(OC(F)(F)F)c2)c(Cl)c1 611093061 UKQKDPCEBBRXCT-UHFFFAOYSA-N 375.133 5.016 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 611872016 OKHWCHRLUIISOD-KRWDZBQOSA-N 394.883 5.512 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)c(C(F)(F)F)c1 612303394 GDTZAASBMMTUHI-UGSOOPFHSA-N 399.482 5.754 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H]1CCc2cc(C#N)ccc21 618804517 AUSPYABCEAOJNT-RBZFPXEDSA-N 393.943 5.982 30 20 GKED C=CC[C@@H]1CCCN(Cc2nc3ccccc3c(-c3ccccc3)c2C(=O)O)C1 656759407 FQQZUEDUVAQDEI-GOSISDBHSA-N 386.495 5.388 30 20 GKED CCN(C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cccnc1 668059552 PZQKKIUHYMOICV-UHFFFAOYSA-N 394.290 5.038 30 20 GKED C[C@@H](CNC(=O)c1ccccc1SCC#N)c1c(Cl)cccc1Cl 726176507 QNANHQJXJKQXCA-LBPRGKRZSA-N 379.312 5.143 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1ccc(OC)c(Cl)c1 726898400 XBCXXYBMBKOSRT-UHFFFAOYSA-N 387.357 5.449 30 20 GKED C=CCOc1ccc(/C=C2/SC(=Nc3c(C)cccc3C)NC2=O)cc1Cl 727264309 QEMKXDIOPOYEAM-LDADJPATSA-N 398.915 5.413 30 20 GKED CN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc2ccccc2c1 727984107 LHXOJFCXBCGJBO-UHFFFAOYSA-N 382.419 5.160 30 20 GKED CCCCc1noc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)n1 728051785 JYNXDRCHSVVWAJ-UHFFFAOYSA-N 396.878 5.128 30 20 GKED N#CCOc1ccc(CSc2nnc(-c3ccco3)n2C2CCCCC2)cc1 729242500 VPICCEYEWZMNJU-UHFFFAOYSA-N 394.500 5.238 30 20 GKED C[C@H](SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1 731939484 MCXLKSHRYBJAFU-KSSFIOAISA-N 396.512 5.620 30 20 GKED N#C[C@@H](NC(=O)/C=C/c1cccc(OC2CCCC2)c1)c1ccc(Cl)cc1 733258991 OLMWOICZGDDRLK-CDDKBXLESA-N 380.875 5.056 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@](C)(C#N)C3CCCCC3)c(F)c2)cc1 734239637 GONJUTMTHVHMIJ-HSZRJFAPSA-N 380.463 5.094 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(C4SCCCS4)cc3)[nH]c12 735788054 BPLAUKNESBFJIV-MRXNPFEDSA-N 393.537 5.230 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)cc1 739156590 ZJMMKMCLCPXHJO-CRAIPNDOSA-N 382.891 5.305 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3SCCc4ccccc43)n2)cc1 744031556 MQGPLJWZEBEZLQ-RXVVDRJESA-N 390.533 5.325 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)c1 746523555 RYLLMDIBDAADTC-CZUORRHYSA-N 391.298 5.094 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)/C=C/c2cccs2)cc1 750842521 XBQRQNLHTDHLMF-PKNBQFBNSA-N 376.437 5.073 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)Nc2ccc(F)cc2OCC#N)c1C 761661162 BZVFWNJYPLZRSG-UHFFFAOYSA-N 399.466 5.386 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)Cc2ccc(OCC#N)cc2)cc1 764281626 GPKZKIPVAIBRNA-HSZRJFAPSA-N 376.500 5.009 30 20 GKED C=CCn1c(SCc2cccnc2Cl)nnc1-c1cccc(Cl)c1 765334512 RVODMTTXBQSCCU-UHFFFAOYSA-N 377.300 5.125 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(-c2ccccc2)cc1)c1nc2cc(F)ccc2s1 768125828 HUBBOWUTQHIPTQ-SFHVURJKSA-N 387.439 5.348 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(OC[C@@H]3CCCO3)cc2)CC1 770404933 UJDYWKLNOHSLBK-RZMWZJFBSA-N 376.500 5.060 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc4[nH]ccc4c3)n2)cc1 776078610 ZTBVLTNXWRZCHU-IBGZPJMESA-N 385.492 5.409 30 20 GKED C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)Nc1ccccc1O[C@H](C)C#N 780667646 KLBJYZMHSSQGNG-CHWSQXEVSA-N 392.286 5.037 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3scnc3C3CC3)s2)cc1 782324089 AZVZNZNQUPMYGZ-KTKRTIGZSA-N 382.510 5.357 30 20 GKED C=CCN(CCc1ccccc1)C(=S)Nc1cccc(OC(F)(F)F)c1 783730415 PYHWMKWDFYAGMW-UHFFFAOYSA-N 380.435 5.013 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 785696096 BWLVWPFAJNKDSI-KGLIPLIRSA-N 385.360 5.545 30 20 GKED CCCCCCCC[S@](=O)Cc1nc(-c2cccc(Br)c2)no1 790133532 BYLNYLGDJOPLGT-QHCPKHFHSA-N 399.354 5.108 30 20 GKED N#C[C@@H](C(=O)Cc1cc(Cl)ccc1Br)c1nccc2ccccc12 790798297 DJJWARNSTJJZNN-INIZCTEOSA-N 399.675 5.070 30 20 GKED Cc1csc(SCc2c(C(=O)OCCCCC#N)oc3ccccc23)n1 791402234 KPSUGDNJMFKWSI-UHFFFAOYSA-N 386.498 5.341 30 20 GKED N#C[C@H](C(=O)COc1ccccc1-c1ccccc1)c1nccc2ccccc12 792107484 VXBIGEHZYQQKCP-JOCHJYFZSA-N 378.431 5.157 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](C)c1nc2ccccc2s1 796750991 KJNJWSMNAPXTAB-SOLBZPMBSA-N 378.497 5.419 30 20 GKED C=C[C@@H](CC(=O)O[C@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 798206942 CTFDINMBLGOEPH-SCLBCKFNSA-N 375.346 5.334 30 20 GKED CC(C)(C)CCCCC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 805844790 MYRRYWDVRPTJAR-CQSZACIVSA-N 385.533 5.058 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 806200965 QKJIFYVTXJNSGL-UKDVSSAZSA-N 395.506 5.957 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2cccc(C)c2s1 808980236 XGZDKDMSXNFBSW-SFHVURJKSA-N 390.508 5.296 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813214794 DONKNTNBTDUZQN-GXFFZTMASA-N 386.295 5.099 30 20 GKED N#C[C@H](NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccc(F)cc1 841740761 KVJLHUXXIRIOAC-XASXRRJKSA-N 380.419 5.088 30 20 GKED N#CC[C@@H]1CCCN(C(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)C1 855258693 BWKDQWAUXCNZKB-JPOGYNCRSA-N 382.866 5.172 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(-n2ccnc2)cc1 916319158 GBAMHNZSCOUFLO-UHFFFAOYSA-N 380.666 5.064 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NNc1ccc(C(F)(F)F)cn1 917534122 OXLTZQWWRXJQOM-UHFFFAOYSA-N 393.800 5.002 30 20 GKED Cc1ccc(C(=O)Nc2cccc(C/N=C/c3cc4ccccc4nc3O)c2)cc1 917557444 MXDJNWGKLBVJBV-WGOQTCKBSA-N 395.462 5.120 30 20 GKED CCCCCCOCc1cccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c1 920874218 GHBWVLJSHRCWPW-GOSISDBHSA-N 379.504 5.538 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2OC)cc1 1776125691 QFIUABXEQBKMIV-GXDHUFHOSA-N 396.483 5.639 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776308755 LJTFZUMYJXWCMN-RISWYLRJSA-N 396.486 6.000 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(COc2ccccc2)c1 1776783712 GAVBOBVDNSDQNN-JOCHJYFZSA-N 383.532 5.559 30 20 GKED CCCCCCCOc1ccc(/C=C\c2cnc(C(=O)O)cn2)cc1OCC 1776788253 UTKTXKIUCREQRD-LUAWRHEFSA-N 384.476 5.093 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)cc1 1777472334 YTSCBUQDNRFZIJ-VRNBXGKJSA-N 398.458 5.568 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)Cc3ccc(Cl)c(Cl)c3)n2)cc1 14497556 KWLKWWZTZZARKG-UHFFFAOYSA-N 388.279 5.170 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)c(F)c2)[n+]2ccccc2)cc1 14872472 LKVULQNYNBJSST-UHFFFAOYSA-O 393.507 5.035 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)cc1 16406020 ZVZDQOIAWXEEAG-RMKNXTFCSA-N 378.771 5.276 30 20 GKED Cc1csc([C@H](C#N)C(=O)CSc2ccc(Cl)c(C(F)(F)F)c2)n1 20067067 TUJPZKQCOASLRS-SNVBAGLBSA-N 390.839 5.092 30 20 GKED COc1ccc(S[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 51534829 NOUUWEHUZRPFLV-KBXCAEBGSA-N 394.521 5.176 30 20 GKED C=CCn1c(SCCCOc2ccc(Cl)cc2)nnc1-c1ccoc1C 57780368 LIJDWBJWYFCCDK-UHFFFAOYSA-N 389.908 5.247 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(Oc2ccccc2)c1 63394652 KHWUDKWUIFQDEF-UHFFFAOYSA-N 383.451 5.571 30 20 GKED Cn1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c2ccccc21 64714745 PPEXZUOBCOBFFN-CYBMUJFWSA-N 393.418 5.070 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CSc3ccc(C)cc3)n2)cc1 66543805 IJBONDXHSPVNIP-GOSISDBHSA-N 394.521 5.096 30 20 GKED N#CCCSc1ccccc1NCc1ccc(C(=O)Nc2ccccc2)cc1 108353136 LWGKNHRBRUNLLP-UHFFFAOYSA-N 387.508 5.557 30 20 GKED Cc1cc(Br)ccc1NC(=O)Nc1cccc(OCCCC#N)c1 113529705 CBEYDEHKAHQTQS-UHFFFAOYSA-N 388.265 5.084 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCc1cccnc1)c1ccc(C#N)cc1 128056427 HVEGZOAOIKITDF-INIZCTEOSA-N 377.875 5.036 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1C(F)(F)F 132105315 SCDNRPNQUBLAOG-KSSFIOAISA-N 375.394 5.111 30 20 GKED CC(C)(C)[C@H](NC(=O)CNc1ccccc1SCCC#N)c1cccs1 153923998 OJMGWEMUDVHVPL-LJQANCHMSA-N 387.574 5.069 30 20 GKED N#C[C@@H](C(=O)c1ccnc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 162096342 WXPIGSVOGGAFJX-AWEZNQCLSA-N 391.402 5.127 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)c(Br)c1 173265584 ZDQXKIVHHRUAIG-NSHDSACASA-N 393.281 5.235 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1 180021637 SBUPDWRERWAXBA-AVRDEDQJSA-N 397.478 5.157 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 181425107 WECCFGPMLFNARZ-KRWDZBQOSA-N 385.448 5.264 30 20 GKED CCOc1ccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccccc2)cc1 181599758 MAKAPJFGSKICOF-DFBJGRDBSA-N 386.495 5.428 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ncc(Br)cc1F)c1ccc(F)c(F)c1 187567715 QIWDINDTRVBIKC-HWPZZCPQSA-N 385.227 5.229 30 20 GKED CC(C)N(C)c1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1F 236695545 KBWOJFIAAXZCCL-UHFFFAOYSA-N 391.494 5.060 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 237499516 SSPZYFSYKFYOOZ-OALUTQOASA-N 399.494 5.081 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303372953 KNAJMWANPVJBLU-IAGOWNOFSA-N 397.544 5.608 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@@H]3CCC[C@H](C(F)(F)F)C3)n2)s1 328801728 ZMJNDYGDGQHMJE-MNOVXSKESA-N 389.468 5.840 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2c2cccnc2)cc1 362654403 YRHLPQNYJLRQHE-NRFANRHFSA-N 384.439 5.115 30 20 GKED CCCCCCCCCC(=O)N1CCCC[C@H]1c1nnc(C2CCOCC2)o1 372827050 XJMRWTVZFHSWQJ-IBGZPJMESA-N 391.556 5.158 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 425423013 NNFYFBSBRABFJJ-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED COc1cc([C@H](C)NCc2cccc(F)c2C#N)ccc1OCc1ccccc1 428315786 DXFGXGRAOAPBLQ-KRWDZBQOSA-N 390.458 5.136 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](C)c1ccccc1 428849158 HQUGZLDTZNUFAG-RBUKOAKNSA-N 395.572 5.491 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1OC 430579700 CQPUFCSKERJCCJ-OAHLLOKOSA-N 386.517 5.118 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Br)c(Cl)c2)s1 430598010 NFIYURNFSPCMNT-SNVBAGLBSA-N 397.725 5.347 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1ccccc1 430621002 CSBQYGHKFCISHM-MRXNPFEDSA-N 392.528 5.240 30 20 GKED CCSc1cccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 433145151 PAPUPDQVTMVCDX-OAHLLOKOSA-N 385.558 5.515 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@H](C#N)CCc3ccccc3)cc2)n1 433302275 XIFDNTQCIUJJGS-KRWDZBQOSA-N 393.537 5.314 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 433359766 CCGWMPZFDKKYCZ-QGZVFWFLSA-N 391.858 5.238 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 434123990 LZZATEDHUHKMRQ-UHFFFAOYSA-N 390.405 5.438 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCc4ccc(F)cc4C3)cc2)cc1 434220093 ZSEMPXJBLGQKLA-UHFFFAOYSA-N 387.414 5.080 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)c1cccc(C#N)c1 442772226 VDFVKBQBVQQPQA-AWEZNQCLSA-N 383.373 5.937 30 20 GKED COc1ccc(COCc2cccc(NCc3cn4ccccc4c3C#N)c2)cc1 446620864 SXOSCKHTIXRLSF-UHFFFAOYSA-N 397.478 5.148 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CC12CCSCC2 448952329 RQJYFQYPMRHAOI-FQEVSTJZSA-N 394.515 5.072 30 20 GKED C[C@H](N[C@@H]1CCC[C@H](C#N)C1)c1nc(-c2ccc(Br)cc2)cs1 463241095 CBEZVUZTGDRONG-HEHGZKQESA-N 390.350 5.306 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cn(C)nc1C1CC1)c1ccc(C(F)(F)F)cc1 463846012 AUJMSLSZTBPPJA-MRXNPFEDSA-N 392.425 5.145 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(N(C)C(=O)[C@H](C)CC(=C)C)c(Cl)c1 466873449 JHMKMVHLFQCYCF-JKSUJKDBSA-N 376.928 5.446 30 20 GKED CCc1nc(C)c([C@H](C)N(C)C(=O)c2cn(CCCC#N)c3ccccc23)s1 469462633 LJUBVUYZXDTWCW-INIZCTEOSA-N 394.544 5.106 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(F)ccc3-c3ccoc3)n2)c1 471049137 ZKCPKMUKTUTIMK-UHFFFAOYSA-N 389.411 5.333 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1 471244900 GACGDESVHNQLHD-UHFFFAOYSA-N 399.922 5.090 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)NCCCCC#N)c2)cc1 471554768 IZGXYRJPBCTXEI-IBGZPJMESA-N 393.531 5.537 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(NC(=O)Nc2ccccc2)s1 474592304 GBNVWNCMLQERBJ-UHFFFAOYSA-N 398.532 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(OC(F)F)c1 475546013 KKXXRHPQBNHEFQ-HNNXBMFYSA-N 388.458 6.023 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC(OC2CCCCC2)CC1)c1ccc(F)c(F)c1 477746160 SHZDFGBSGDEPBW-NRFANRHFSA-N 392.490 5.105 30 20 GKED Cc1sc([C@H](C)NC(=O)C2(C#N)CCCCC2)nc1-c1ccc(Cl)cc1 479213428 UOVIPIXKBITDIT-ZDUSSCGKSA-N 387.936 5.423 30 20 GKED C[C@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccc(C#N)cc1 479226048 ZMTZRIOVPRJEJR-NSHDSACASA-N 383.211 5.190 30 20 GKED Cc1cc(Br)cc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 486356042 UADVTADSZGJLIM-MOPGFXCFSA-N 398.304 5.061 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccco2)Cc2ccc(C)s2)c1 502418004 QMLXMTUCOGXITI-UHFFFAOYSA-N 396.512 5.839 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 502799650 SPIVZEITCQITAZ-RBBKRZOGSA-N 394.490 5.134 30 20 GKED Cc1ccc(Br)c(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c1 505531957 HWELQDIXUBBAOQ-AWEZNQCLSA-N 398.087 5.059 30 20 GKED N#CCCN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1ccco1 505746092 RSGCBLKNBVLYPO-UHFFFAOYSA-N 376.300 5.233 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(SCC)cc1 508577206 GHGRUWWJNWFCHP-KRWDZBQOSA-N 381.545 5.353 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 509565438 YFUUSTKYQLPFNS-ZOCIIQOWSA-N 386.417 5.290 30 20 GKED C=C(C)CN(Cc1ccc(OCc2ccccn2)cc1)Cc1cnn(C(C)C)c1 512542251 MMQOJECLIAUPMR-UHFFFAOYSA-N 390.531 5.016 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N(C[C@H](C)C#N)C2CC2)cc1 513661896 WUHFRRYBOSNLME-MRXNPFEDSA-N 379.460 5.034 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cc(C)n(C3CCCCC3)c2C)cc1 515180518 QHCRLMDWYDUWHF-UHFFFAOYSA-N 394.519 5.170 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)c1 517653126 JISXEKRFYOEVGN-UHFFFAOYSA-N 390.870 5.942 30 20 GKED CCSCc1ccc(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)cc1 518025756 RRUQZRQWGPBUTQ-INIZCTEOSA-N 379.312 5.241 30 20 GKED Cc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520939202 NOUWOFSGXZPFHU-KRWDZBQOSA-N 381.545 5.532 30 20 GKED N#CCCCCNC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 525421915 ZXXQQOBTJRHILN-UHFFFAOYSA-N 399.360 5.175 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)Nc1sc2c(c1C#N)CCCCC2 525628555 JIPFZMQYLAFPIG-LBPRGKRZSA-N 399.516 5.019 30 20 GKED C[C@@H]1O[C@H](C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@H]1C 525841980 ANGQERBQDSNAKS-NARAOEGZSA-N 397.906 5.025 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)c3c(F)cc(C#N)cc3F)n2)c(C)c1 531264344 FRZNXMOHLPXHGC-UHFFFAOYSA-N 383.423 5.138 30 20 GKED C=C(C)[C@@H](CC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)OCC 535154350 WEUVPROZYXSKRT-CXAGYDPISA-N 392.952 5.320 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC2CC2)cc1)c1nc2cc(Cl)ccc2s1 542130813 SPSQJJHKXZHXQQ-HNNXBMFYSA-N 384.913 5.694 30 20 GKED C=C(C)[C@H](CC(=O)N(c1nc2ccccc2s1)c1ccccc1C)OCC 549930292 GGKSFDSJAWSYQB-IBGZPJMESA-N 380.513 5.641 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccc(C#N)cc2)cc1 569396423 UQRDBXPMOFDZFA-UHFFFAOYSA-N 376.843 5.067 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC[C@@H](Cc2ccccc2)C(F)(F)F)cc1 572170785 IUVOHKNRUBAIPA-QGZVFWFLSA-N 389.421 5.030 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1CC(F)(F)F 576452411 IDOBACVSXKLIFI-UHFFFAOYSA-N 394.441 5.179 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1cc(C#N)cc(N(C)C)c1)c1ccccc1 578676875 GWHQZTGQHPFYLG-QGZVFWFLSA-N 385.467 5.017 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)ns1 582645786 WMMWWLGXEWUTGR-NSHDSACASA-N 394.308 5.372 30 20 GKED N#CCCCCCC(=O)N[C@H](Cc1ccccc1)c1nc2ccccc2s1 590880603 HGLJQUUASPMLNI-LJQANCHMSA-N 377.513 5.170 30 20 GKED Cc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 604476546 QWRHFAVUCSLPOR-MRXNPFEDSA-N 397.843 5.170 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nc2ccccc2c1=O 605364576 XMISONLLZMZEMR-HNNXBMFYSA-N 389.480 5.091 30 20 GKED CC(C)C[C@H](C#N)NC(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 608822540 KICKSLPZDBCZQZ-QGZVFWFLSA-N 383.561 5.234 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609498567 NIZLNRLWRDFUNM-MRXNPFEDSA-N 397.434 5.325 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc3n[nH]cc3c2)c1 609723093 LQNZRVWGNZRUAR-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CC[C@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccc(C)cc1 609968566 QWIMCDURBAFDLK-LJQANCHMSA-N 388.433 5.342 30 20 GKED N#CCn1c(-c2nc(CSc3ccc(Cl)cc3)no2)cc2ccccc21 612869783 DMCZQPCEYHEUJN-UHFFFAOYSA-N 380.860 5.161 30 20 GKED CSc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613319339 CPYSZOIDXOVFHC-HNNXBMFYSA-N 384.913 5.675 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 613515402 ZIFSSZPBXOYOMK-KNQAVFIVSA-N 399.563 5.454 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1C2CCC1CC2 646437051 HUJIYQGVLPBSJO-UHFFFAOYSA-N 384.295 5.135 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 647373691 MWTGZCIFAVNOQX-CQSZACIVSA-N 399.928 5.596 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 728175611 YGASBXOBOXOBIA-FOIQADDNSA-N 397.519 5.141 30 20 GKED CSc1ccc(C(=O)/C=C/c2csc(-c3ccc4c(c3)OCO4)n2)cc1 728438934 CQDSWLGLHGCGHM-VMPITWQZSA-N 381.478 5.157 30 20 GKED COc1ccc(OCc2nc(/C=C/C(=O)c3cc(C)cc(C)c3)cs2)cc1 730435768 BFSMDJOUDAAHFL-RUDMXATFSA-N 379.481 5.244 30 20 GKED N#Cc1cccc(OCCCCC(=O)OCc2csc(-c3ccsc3)n2)c1 732397035 MADLLGSKKANCCA-UHFFFAOYSA-N 398.509 5.036 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1 733327779 GXZFZWJDAKPNCD-SFHVURJKSA-N 390.552 5.680 30 20 GKED FC(F)(F)c1ccc(N2CCC(C(F)(F)F)(C(F)(F)F)C2)nc1Cl 735304128 GEUOGSCMAPMJCU-UHFFFAOYSA-N 386.645 5.075 30 20 GKED O=C1/C(=C/c2cccc(F)c2)CC(O)(C(F)(F)F)C/C1=C\c1cccc(F)c1 735792239 AOILMMNYZGEMBL-BGPOSVGRSA-N 394.339 5.088 30 20 GKED N#Cc1ccc2ncc(/C=C\C(=O)c3ccc(Cl)c(Cl)c3Cl)n2c1 736433339 SIFQCOMPNGGDFH-DJWKRKHSSA-N 376.630 5.062 30 20 GKED COCc1cccc(/C=C2/CCc3nc(-c4ccc(OC)cc4)sc3C2=O)c1 742434850 OVOYEXSTDGVBBQ-AQTBWJFISA-N 391.492 5.178 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(C)c(NC(=O)OC(C)(C)C)c2)c1 742579496 STGULUQHLNFRSW-UHFFFAOYSA-N 382.460 5.159 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)c2cccc(Cl)c2)cc1 744029808 WNSJKYACXWNVMI-QRWLVFNGSA-N 382.891 5.134 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)Nc1ccccc1 745724937 ZUNITGCRMMYZMC-UHFFFAOYSA-N 375.472 5.409 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1cc(Cl)ccc1OC(F)F 748442192 PYQXJAWYNHMQKR-VQHVLOKHSA-N 388.801 5.082 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1SC(F)F 752620085 DLOBBJSAXQMJHU-DOTOQJQBSA-N 387.455 5.305 30 20 GKED FC(F)(F)c1ccc(C#CCSc2nnc(CCc3ccccc3)o2)cc1 754279775 PAGMJDSAWJHZKR-UHFFFAOYSA-N 388.414 5.017 30 20 GKED COC(=O)c1ccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)o2)cc1 754712842 VHSTXKSZYBJQTI-UHFFFAOYSA-N 389.329 5.165 30 20 GKED C[C@H](N[C@@H](C)c1cc(Br)cc(Cl)c1O)c1cccc(C#N)c1 756628865 YLQMIZZDQHDPEZ-QWRGUYRKSA-N 379.685 5.092 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cnc(Cl)c(Br)c1C 760061744 XFWLMIWMZVAUFT-UHFFFAOYSA-N 394.700 5.026 30 20 GKED C[C@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1c(Cl)cccc1Cl 764300552 AAZBMXOIOQPCDJ-QMMMGPOBSA-N 398.633 5.169 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCCc3sccc32)cc1 767582741 CVWMJWQQIRZNDD-NHCUHLMSSA-N 387.508 5.603 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 774052459 GFJZDUAQICYVNP-JXFKEZNVSA-N 398.487 5.607 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 780674123 JYXUMBLNCNTYHH-ZIAGYGMSSA-N 391.393 5.221 30 20 GKED CC(C)(O)c1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 789935228 OSJICJPFKMJCPL-UHFFFAOYSA-N 388.492 5.189 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1 793892361 SNFLWAINXWMIGT-LEWJYISDSA-N 396.535 5.102 30 20 GKED N#Cc1ccccc1CN[C@H](c1c[nH]c2ccccc12)C(Cl)(Cl)Cl 796467638 AFGJQXQNXDCEJJ-QGZVFWFLSA-N 378.690 5.241 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CSc2cccc(C(F)(F)F)c2)s1 797567003 CHRVINHKEIKVAK-ZDUSSCGKSA-N 398.475 5.428 30 20 GKED CC(C)=CCN(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(OCC#N)c1 799208203 STBJCKRNVQRQEB-UHFFFAOYSA-N 383.879 5.243 30 20 GKED Cc1cc(/C=C/C(=O)OCCCC2(C#N)CCOCC2)c(C)n1C1CCCCC1 800122992 FPZWQKMINPAAHB-MDZDMXLPSA-N 398.547 5.267 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@H]2c2ccc(Cl)cc2F)n1 835201434 WBFJURDDMPPVTI-NWANDNLSSA-N 376.884 5.429 30 20 GKED CCCCCCCC(=O)Nc1ccc(C)c(NS(=O)(=O)c2ccccc2)c1 915647104 ZAUOWPMCJVMKCT-UHFFFAOYSA-N 388.533 5.095 30 20 GKED O=C(O)c1cc(NN=C2CC=C(c3ccc(Cl)cc3)CC2)ccc1Cl 1776033904 WXWGPCPUSXAIJW-UHFFFAOYSA-N 375.255 5.727 30 20 GKED CCCCCCCSc1ccc(C(=O)NCC(CC)(CC)C(=O)O)cc1 1776787544 VDNDTLOLZDUTHZ-UHFFFAOYSA-N 379.566 5.370 30 20 GKED O=C1/C(=C/c2ccccc2OCc2ccccc2)C[C@H](C(=O)O)c2ccccc21 1777698112 HSACEPCGKSASAS-SLTDHEAWSA-N 384.431 5.104 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1[N+](=O)[O-] 46443578 YFUQAEDYZBFWRA-HNNXBMFYSA-N 397.843 5.170 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1-c1ccccn1 66856240 FBTFSCXLPDISNV-MRXNPFEDSA-N 390.512 5.136 30 20 GKED Cc1nc(/C=C\c2cccc(C#N)c2)sc1C(=O)/C=C/c1cccc(C#N)c1 96402178 WFJGFTZVNVGONM-GOOGBFEESA-N 381.460 5.261 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2ccccc2)c1)c1nc(-c2ccncc2)cs1 114620749 WCTSEUQIJSOOGX-HXUWFJFHSA-N 397.459 5.487 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2c([nH]c3ccccc23)C1 129456171 VVYXTVRKGQMOKY-OAHLLOKOSA-N 390.512 5.152 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nccs1 152800464 NVCZSUVUMMHAFZ-QGZVFWFLSA-N 378.457 5.080 30 20 GKED Cc1ccccc1COc1cccc(CC(=O)[C@@H](C#N)c2nc3ccccc3o2)c1 171627183 WGWHQEMIRKMCLF-OAQYLSRUSA-N 396.446 5.134 30 20 GKED CS[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 172378591 MFIUHFXVAUMAQV-HXUWFJFHSA-N 389.480 5.097 30 20 GKED C=CCn1c(SCc2ncc(-c3cccc(F)c3)o2)nnc1-c1ccoc1C 177184303 JDQSKCOZIGEQBB-UHFFFAOYSA-N 396.447 5.119 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COC(c2ccccc2)c2ccccc2)n1 177767277 XNACNLYGQLRHKC-IBGZPJMESA-N 390.508 5.249 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H]1CCCN(C2CCC2)C1 191435301 JLYZTIDYVIDVLM-QUCCMNQESA-N 383.580 5.313 30 20 GKED CC[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1nc(C(F)(F)F)cs1 302199011 QKCTXODEFJHAOT-LLVKDONJSA-N 379.329 5.616 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl 303834712 PFZMJJVKBCUZHS-MCIONIFRSA-N 388.895 5.473 30 20 GKED Cc1cccc2c(CCC(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)c[nH]c12 303887886 JZDPCBWBKRLEJP-KRWDZBQOSA-N 386.282 5.097 30 20 GKED O/C(=N/[C@@H]1CCCc2c[nH]nc21)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 330153589 MWBPVJPNOAZCON-BFYDXBDKSA-N 378.501 5.103 30 20 GKED CCN(C(=O)c1csc(CCc2ccccc2)n1)[C@H](C)c1ccc(C#N)cc1 409801615 PSIVJFUVQHYLAX-QGZVFWFLSA-N 389.524 5.023 30 20 GKED N#CCCC[C@@H](NCc1cc(Cl)cc(Br)c1)c1ccccc1 411760773 SRMHWXREMPTPEB-GOSISDBHSA-N 377.713 5.627 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cnc(Cc3ccc(F)cc3)s2)s1 430612424 RGBWJXLZCZRSLB-CQSZACIVSA-N 399.516 5.117 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)NCC1(CC#N)CC1 430732039 YIDPRNINJWGGJA-GFCCVEGCSA-N 390.350 5.226 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 432100943 WHPMWPRHTPNOPS-OPAMFIHVSA-N 397.519 5.273 30 20 GKED CCC(CC)n1nccc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 432646845 SIDUSPXKXCMEIU-UHFFFAOYSA-N 390.512 5.195 30 20 GKED Cc1ccc(Nc2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)cc1 433026227 DICBVCRPJVKNIU-OAQYLSRUSA-N 376.529 5.720 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 433134512 LBPYZNIQKPSHHL-MJGOQNOKSA-N 392.528 5.495 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 436285013 CLMGXFVKPNUHSG-QBIMZIAESA-N 376.953 5.404 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C#N)oc2C)c(C(F)(F)F)c1 439109143 FCKAHCFSMRUHPT-SNVBAGLBSA-N 382.407 5.621 30 20 GKED CCO[C@H](C)c1nc(CN(C)c2c(C#N)cnc3ccc(C(C)C)cc23)cs1 447673346 XQLNWIVEPXATAJ-OAHLLOKOSA-N 394.544 5.420 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1ccc(CC#N)cc1Cl 455699411 HEEPPNJUOMYJRK-UHFFFAOYSA-N 385.895 5.674 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C)c(C#N)cn2)c(C(F)(F)F)c1 460070640 CYSKSRIQEFEIRD-GFCCVEGCSA-N 393.434 5.423 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)c(C)c1 462172620 VYHJEERGLPYXKC-HSZRJFAPSA-N 394.877 5.547 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)n(C)c2ccccc12 471279443 ZTSCHRDCYBTMTN-HNNXBMFYSA-N 392.528 5.203 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3nn(-c4ccccc4)cc3C)n2)cc1 473486574 HLHVQVPFUDKSBQ-IBGZPJMESA-N 398.491 5.103 30 20 GKED C[C@@H](Sc1ccccn1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 475512529 OUYRKADOPBNOAG-CQSZACIVSA-N 393.443 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn([C@H](C)CC)c1C1CC1 475564665 NLLKBHVEXJLZIX-MRXNPFEDSA-N 380.536 6.227 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 475570803 LKIRONJKIBPVQK-JTHBVZDNSA-N 378.516 5.580 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1Cc1ccccc1OC 475572622 PUDGEXXNFYUAQX-OAQYLSRUSA-N 392.543 5.786 30 20 GKED Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 475600040 JDAGJSOHZYBCMD-QFIPXVFZSA-N 398.510 5.171 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(F)cc1-c1ccc(F)cc1)c1ccccc1 475612138 MSSULWNQUOCZKG-GOSISDBHSA-N 376.406 5.658 30 20 GKED Cc1cc2n[nH]cc2cc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 481347360 XSHXOSDKQUMINO-UHFFFAOYSA-N 398.491 5.288 30 20 GKED C[C@H](SCCC(=O)Nc1ccccc1C#N)c1cccc(Br)c1 487885817 ZRAGPBRIRJYQFM-ZDUSSCGKSA-N 389.318 5.144 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)NCc2cscc2C)cc1 488362348 ZFVIXJJFMGNGCC-UHFFFAOYSA-N 393.468 5.051 30 20 GKED CCN(C(=O)CCCCC(=O)c1ccc(F)cc1)[C@H](C)c1ccc(C#N)cc1 495132147 XJRDDYCTMCDWBR-QGZVFWFLSA-N 380.463 5.050 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2OC2CCCC2)cc(OC)c1OC 502614612 AGGRRBJBRJNIAJ-UHFFFAOYSA-N 381.472 5.006 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 518029435 KNJWUMPMSQWLFE-CQSZACIVSA-N 398.915 5.610 30 20 GKED C=CCOc1cccc(N[C@@H](C(=O)Nc2ccc(OC)cc2)c2ccccc2)c1 518248081 DBTMOZFVMUEGRW-HSZRJFAPSA-N 388.467 5.052 30 20 GKED N#CCCCn1cc(-c2nc(-c3cnc4ccsc4c3)no2)c2ccccc21 519848857 HXDOXBMPSPMJDF-UHFFFAOYSA-N 385.452 5.272 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCCc3cc(F)ccc32)cc1 520714559 ZGLGPPGCTWHGLG-UHFFFAOYSA-N 390.389 5.222 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@H](c3ccccc3)C2)cc1 521213560 LKWVENIXWAOJJV-QFIPXVFZSA-N 398.531 5.480 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccccc1Cl)CC1CC1)c1ccccc1 521416096 DOHCOWDHNZFSBH-NRFANRHFSA-N 381.907 5.307 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc(OC(F)F)c3)c2)cc1 521493776 NPDNSOQNLWUPFB-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1ccccc1SC[C@H](C)C#N 521729906 JHMLRLKJAUMQNZ-GFCCVEGCSA-N 383.498 5.216 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)sc1SCC#N 525656750 YREAVMJMTUCNBF-OLZOCXBDSA-N 398.340 5.116 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 539716158 KJDBCCLSZNPWIO-TZIWHRDSSA-N 393.487 5.066 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Br)c(Cl)c2Cl)CC1 542716679 RXNNJSIXFIVGCK-UHFFFAOYSA-N 378.097 5.186 30 20 GKED Cc1cccc(-c2noc(CN[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)n2)c1 542941803 GQPBVTZBLBDURB-GOSISDBHSA-N 394.478 5.435 30 20 GKED CN(C(=O)Cc1cccc(F)c1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 543106702 DIIXDROQEPJMLF-MRXNPFEDSA-N 393.302 5.149 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccccc3C(C)(C)C#N)s2)cc1 544490349 PUJAVIGSFVPJKT-KRWDZBQOSA-N 389.568 6.079 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 546190482 VXWLWZIWMUCLNV-KUHUBIRLSA-N 389.421 5.316 30 20 GKED Cc1cc(Br)cc2c1[C@@H](N[C@@H](CCCC#N)c1ccccc1)CC2 551214490 FOAYJWUTKMAROK-PMACEKPBSA-N 383.333 5.770 30 20 GKED N#CCCn1ncc(C(=O)Nc2cccc(-c3ccccc3)c2)c1-c1ccccc1 554033343 KRKLURJEYMDAIN-UHFFFAOYSA-N 392.462 5.383 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCCCc3c(F)cccc3Cl)ccc21 556040355 ZRZYTJATOXYFOK-UHFFFAOYSA-N 399.897 5.107 30 20 GKED C[C@H](NC(=O)c1sc2ccccc2c1Br)c1ccc(C#N)cc1 562052659 OMGOEWKEUKZKMD-NSHDSACASA-N 385.286 5.026 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@@H]3C3CCCCC3)cc2)ccn1 568144259 ASOUMDRTQBDGJR-JOCHJYFZSA-N 390.487 5.322 30 20 GKED COc1cccc(CN(C)CCCC(C)(C)C#N)c1OCc1ccccc1F 571063918 VIZHTEYRQLTDDU-UHFFFAOYSA-N 384.495 5.175 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)F)cc3)n2)cc1 588349031 PQYFWVVKIGYHHX-MRXNPFEDSA-N 379.391 5.109 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)CCCCCC#N)cc1 588895347 QXWIKKHOMBTHLG-UHFFFAOYSA-N 383.879 5.029 30 20 GKED CCc1nc(C#N)cc(N2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)n1 596139369 RZFBBYDZPIVALG-GOSISDBHSA-N 387.487 5.031 30 20 GKED CCOc1cc(CNc2ccc(C(F)(F)F)cc2C#N)ccc1OC(F)F 599025121 JYWVRRUAEXWRQW-UHFFFAOYSA-N 386.320 5.189 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 604461406 VLBMRLOBKZVDIR-DEOSSOPVSA-N 397.478 6.028 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)Cc1ccc(C#N)cc1 609305193 BQXCMALTQDWYMH-CYBMUJFWSA-N 395.915 5.064 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@@H]1CCc2ccccc21 609371396 IYPSLCVIMGUVOF-DNVCBOLYSA-N 382.554 5.298 30 20 GKED CC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1F 610009967 MBLGPVVISXAXHS-XMMPIXPASA-N 392.449 5.656 30 20 GKED CCN(C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)[C@H](C)c1ccc(C#N)cc1 617454468 XQKPMJXUBHEUJN-LLVKDONJSA-N 382.332 5.079 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)N1[C@H]2CC[C@H]1CC(F)(F)C2 626368905 FKHWXQHLFVCOIS-RYUDHWBXSA-N 384.295 5.135 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2ccc(Oc3ccccc3Cl)cc2)nc(C)n1 673812111 QMEZVOWIAKBBNH-QGZVFWFLSA-N 377.831 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCOc2cc(OC)ccc21 682777191 IADQNFWUHORUID-FQEVSTJZSA-N 380.488 5.192 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3ccc(OC)cc3F)cc2F)s1 730482136 OQIJRJWKYGSDMZ-UHFFFAOYSA-N 398.434 5.388 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1nc(-c2ccccc2)cs1 730922012 IYCUPYOSMODIQR-BHIFYINESA-N 394.499 5.943 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)c(Cl)c1 733083741 QCXHJVGXNBXYBW-FNORWQNLSA-N 388.807 5.407 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1ccccc1)c1ccncc1 734684358 VFXZSKHXEJRDLT-GBXCKJPGSA-N 385.511 5.672 30 20 GKED C=CC[C@H](NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccncc1 734684606 WEHBYXJOMPGNOB-RBUKOAKNSA-N 389.421 5.264 30 20 GKED N#CCCCOC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 735551827 AZLOAYMXYZHPAE-UHFFFAOYSA-N 392.242 5.098 30 20 GKED COc1cccc(-c2nc(/C=C3\CCc4ccc(OC)cc4C3=O)cs2)c1 741848241 OBODHADNSYHZDD-XNTDXEJSSA-N 377.465 5.040 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cc(OC)c1OC 747188311 LYVCDJZQFBZEBQ-MDZDMXLPSA-N 380.465 5.337 30 20 GKED C[C@@H](ON=Cc1ccccc1C(F)(F)F)c1nnc(-c2cccc(Cl)c2)o1 747826279 HFEXFXGMVAKXNX-LLVKDONJSA-N 395.768 5.521 30 20 GKED COc1cccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 753397333 ZGQZJECAGOKXPV-OXJNMPFZSA-N 390.508 5.497 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Cl)c(Cl)c2O)c1 756708621 DZYFOEXXGLCSMT-TZMCWYRMSA-N 379.287 5.231 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccc(Cl)nc1 759083074 JYUJGALLOSHANT-DAXSKMNVSA-N 391.279 5.320 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 761046847 GPXAZGLUNXBZLG-AZUAARDMSA-N 382.529 5.423 30 20 GKED Cc1nc([C@H](C)OC(=O)/C=C/c2ccccc2C#N)oc1-c1ccc(Cl)cc1 763907815 GTTJRLZXSXMXJA-RZXPCSSPSA-N 392.842 5.493 30 20 GKED N#Cc1ccc(NC(=O)c2cnc(Cl)c3ccccc23)cc1C(F)(F)F 766762333 RAVWCXABMLPKIH-UHFFFAOYSA-N 375.737 5.031 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCOc3c(C(C)C)cccc32)c1 772983734 KLNWVVNURJXFBS-CVDCTZTESA-N 378.516 5.494 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@@H](O)c2c(Cl)cccc2Cl)CC1 773017598 SJKCCLJJFAWCSS-IPFXWSOASA-N 389.326 5.021 30 20 GKED N#Cc1ccc(F)c(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c1 773022184 BSKUQVUKVPBULK-SFHVURJKSA-N 381.451 5.127 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(F)c2F)cc(Br)c1OC 776268925 WZTFLUYLTVXSJB-BQYQJAHWSA-N 397.215 5.031 30 20 GKED COc1ccc(NC(=S)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782204015 HOMFHXUWCIYCDG-MRXNPFEDSA-N 387.508 5.281 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=O)c2ccccc2SCC#N)cc1F 782740203 DTKXBGMCZCSWBR-UHFFFAOYSA-N 376.428 5.010 30 20 GKED N#Cc1cnc2c(c1)CC/C(=C\c1ccc(-c3nc4ccccc4s3)o1)C2=O 788357354 QKMHAGDJVNCHJC-XNTDXEJSSA-N 383.432 5.035 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(OC(F)F)c(C(F)(F)F)c2)cc1 793317922 UPMWTHPPYVKFRR-NSHDSACASA-N 386.320 5.210 30 20 GKED N#CC[C@H](CC(=O)O[C@@H](c1cccc(Cl)c1)C(F)(F)F)c1ccccc1 796694198 VITJBSWIOJRIJY-KDOFPFPSSA-N 381.781 5.574 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 797944615 JSBGTCMYLAKVJG-MNOVXSKESA-N 382.382 5.090 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)OCC(C)(C)CCC#N)cccc2c1=O 798876843 NTWFCHRYGAKICS-UHFFFAOYSA-N 389.451 5.255 30 20 GKED C#C[C@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccc(Cl)cc1F 806348082 LOIQTVVCQLABMG-SFHVURJKSA-N 397.837 5.247 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 808817469 GYKCUDFMWDZQFY-IAQYHMDHSA-N 381.785 5.068 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(F)c2ccccc12 808842762 FWSLCFHDWHSAAC-CABCVRRESA-N 377.419 5.152 30 20 GKED Oc1cc(F)c(Cl)cc1CNC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 816532608 OFKVKXOFOHEOBO-RKDXNWHRSA-N 393.730 5.184 30 20 GKED Sc1nnc(-c2cccs2)n1N=Cc1c(Cl)ccc(Cl)c1Cl 818234276 WKZYMEGGMKVDLR-UHFFFAOYSA-N 389.720 5.138 30 20 GKED CC(C)c1csc(SCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)n1 845327727 KIYJZKCAJCCCRX-AWEZNQCLSA-N 399.566 5.359 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC[C@H]3CC3(Cl)Cl)n2)cc1 850763268 XTBQBOYRKYHOPP-KBPBESRZSA-N 379.312 5.269 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)CCN1c2ccccc2Sc2ccccc21 914450420 XXHLRECAKZRARP-UHFFFAOYSA-N 399.519 5.210 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2Br)cc1 915086033 GVVDTPNLGLHXNV-LJQANCHMSA-N 391.268 5.357 30 20 GKED Cc1ccc(Cn2nc(C)c(C=NNc3cccc4ncccc34)c2Cl)cc1 915964985 YIKIQCRHQCNVNI-UHFFFAOYSA-N 389.890 5.196 30 20 GKED CCC(=NNc1ncnc2sc(C)c(C)c12)c1ccc(OC(F)F)cc1 916310199 UHFVDNWPGLYUCZ-UHFFFAOYSA-N 376.432 5.136 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 916906133 RHNPBFBSFMLWNS-RXVVDRJESA-N 398.462 5.320 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccccc2)cc1 916915951 SEYKGFTWBOFNKV-QHCPKHFHSA-N 390.442 5.468 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\Sc3ccccc3)n2)cc1 916971584 BUWHUDKRYWSNIF-YUIUBULTSA-N 376.506 5.601 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cccc(OC3CCCC3)c2)S1 917515834 BHWCNRWJCUBDNR-ZHZULCJRSA-N 392.524 5.516 30 20 GKED COc1ccccc1Nc1nc(Cl)c(C=NNc2ncccc2Cl)s1 917548996 FSVLRGAWDHMAKR-UHFFFAOYSA-N 394.287 5.043 30 20 GKED CCCCCCCCCN(C)C(=O)C1CCN(c2nc3ccccc3o2)CC1 918397368 ATUVDRXNHQXTET-UHFFFAOYSA-N 385.552 5.253 30 20 GKED O=C(O)c1ccccc1NN=Cc1cc(F)ccc1Oc1ccc(Cl)cc1 1776031830 ZPKZUCQEFBVURL-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cc3[nH]c(C(=O)O)cc3o2)cc1 1776125919 WLQHMWBTWFVLII-QXMHVHEDSA-N 395.455 5.704 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C/C(=O)c3ccc(C(=O)O)cc3O)o2)cc1 1776271464 MJULNTWSJIDJRC-FMIVXFBMSA-N 390.435 5.544 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cn(C(C)(C)C)nc1C(C)C 1776355021 ZHGQSWRUKWDHER-NTMALXAHSA-N 398.503 5.143 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1nc(-c2ccccc2)cs1 1776355030 ABLXVHDDBQAKOQ-LUAWRHEFSA-N 393.464 5.192 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1nc2cc(Cl)ccc2n1C(C)C 1776786848 TZVPACLMKQNKQQ-QGZVFWFLSA-N 393.959 5.564 30 20 GKED Cc1ccc(Br)cc1/C=C1\CCCc2cc(C(=O)O)ccc2C1=O 1777433120 DAQJJWOVUOUSOM-GXDHUFHOSA-N 385.257 5.058 30 20 GKED Cc1cccc2c1C(=O)/C(=C\c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2 1777455779 YYVAFQWABLFWFI-BKVHRCCISA-N 384.431 5.022 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)c(Cl)c1 1777673254 IIOPHDFCEPVRFB-VMPITWQZSA-N 387.671 5.619 30 20 GKED O=C(O)c1ccc2scc(/C=C3\Oc4cc(Cl)cc(Cl)c4C3=O)c2c1 1777685695 UHJBAYKEFCHETP-CPSFFCFKSA-N 391.231 5.523 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 41500192 HFESERGMRJKARW-IBGZPJMESA-N 379.444 5.325 30 20 GKED CCOc1ccccc1CCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 41534389 QPOAXTCPEMSYNC-GOSISDBHSA-N 376.481 5.018 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nnc(-c3cccs3)o2)cc1 45773241 FGVSJIICFLGPET-UHFFFAOYSA-N 375.478 5.629 30 20 GKED N#C[C@@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1nc2ccccc2[nH]1 48813742 VRZIIWFAGSWALE-IBGZPJMESA-N 383.476 5.345 30 20 GKED Cc1ccc(C[C@H](NC(=O)Nc2ccc(C#N)c(Cl)c2)c2ccccn2)cc1 97573088 RLLLBKVQWHROMW-NRFANRHFSA-N 390.874 5.021 30 20 GKED C[C@H](c1ccccn1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 128658249 XGPLYFXAUCQHSG-OAHLLOKOSA-N 391.858 5.232 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1c(F)cccc1F 140244366 YGOZKIZKJXUJPU-AWEZNQCLSA-N 393.393 5.068 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Cl)c(F)c3)n2)cc1 162081775 AADZYERUYHWWOX-AWEZNQCLSA-N 386.835 5.101 30 20 GKED Cc1ccc(CCCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)s1 175604593 HNKHDNAJGPWRKA-UHFFFAOYSA-N 391.496 5.385 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2 185096926 HQZMSIZGGJWCHS-UHFFFAOYSA-N 395.528 5.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1noc(-c2ccccc2)n1 191447469 IKCZKCWBBHBYQA-MRXNPFEDSA-N 390.487 5.471 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccsc2)cs1 194614257 JABPTTPRZPWQGO-QPJJXVBHSA-N 388.901 5.439 30 20 GKED Fc1ccc([C@H](NCc2ccc(OCC(F)(F)F)cc2)C(F)(F)F)cc1 237781141 POKFANDLQOMIJC-HNNXBMFYSA-N 381.291 5.160 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 255906733 YGNQTFSTNQNTKI-QBUQCISBSA-N 387.508 5.392 30 20 GKED C[C@@H](Nc1ccc(OCc2ccccc2)cc1)C(=O)N(CCC#N)c1ccccc1 302817751 RXMVEMCFQNEBSK-HXUWFJFHSA-N 399.494 5.013 30 20 GKED O/C(=N/CC1CCC(C/N=C(/O)[C@@H]2CC23CCCC3)CC1)[C@@H]1CC12CCCC2 330025217 KHCLYCGWBFQPPJ-GUMHCPJTSA-N 386.580 5.866 30 20 GKED OC(CC/C(O)=N/C1CCCC1)=Nc1cc(F)c(F)cc1N1CCCCC1 330318183 QUERYDUOMROKKE-UHFFFAOYSA-N 379.451 5.222 30 20 GKED N#CCCCCNC(=O)N(CC1(c2ccc(Cl)c(Cl)c2)CCC1)C1CC1 429491788 MWIVCPKYEGWVPN-UHFFFAOYSA-N 394.346 5.283 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cnc(Cc3ccccc3F)s2)s1 430607329 BXXJYTKPKCOCSU-CYBMUJFWSA-N 399.516 5.117 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(/C=C\c3ccccc3)cs2)c1 430634158 RFBQRLXJVPQNSC-KTKRTIGZSA-N 377.494 5.181 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1cccc(C#N)c1C 432257335 JUCDEKIIRRSXEO-HNNXBMFYSA-N 376.485 5.181 30 20 GKED N#Cc1ccc(NC(=O)NCC[C@H](c2ccccc2)C(F)(F)F)c(Cl)c1 433288070 YGSYSQUMXGOUIG-CQSZACIVSA-N 381.785 5.069 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1 437839197 HVBTUMNHDBDBHG-MGPUTAFESA-N 381.451 5.100 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H](C)CCC[C@@H]2C)cc1 438219455 YIGPYYPDTWZPHR-SJORKVTESA-N 393.487 5.402 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccc(C#N)cc1 439946518 XZQNAGNWXHXQGH-UHFFFAOYSA-N 387.826 5.152 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cccc(-c2cscn2)c1 443835035 JRHMCHPJGWKLER-UHFFFAOYSA-N 385.448 5.122 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3[nH]2)cc1 454449112 OYXGJEUMOSBQKA-FQEVSTJZSA-N 387.487 5.123 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(CF)CC3)cc2Cl)cc1 454541176 GNLNOAVFYBRQDW-UHFFFAOYSA-N 387.842 5.217 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)c2)cc1 460872478 ADLYBMMTEGLHNM-UHFFFAOYSA-N 397.409 5.737 30 20 GKED C[C@@H](C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 461964387 JZVRGIFMKKNLRV-JLTOFOAXSA-N 380.900 5.282 30 20 GKED CCN(C(=O)[C@H](C)c1cccc(Br)c1)[C@H](C)c1ccc(C#N)cc1 462143684 ZJZHKSIAOJEIEQ-HUUCEWRRSA-N 385.305 5.034 30 20 GKED CCCCN(C(=O)Nc1ncccc1OCCCC#N)[C@H](C)c1ccccc1 466605286 ZLUGUBFVZJLTSM-GOSISDBHSA-N 380.492 5.159 30 20 GKED C=CCC(CC=C)C(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 467825207 CUBIHIJKRLDLNO-UHFFFAOYSA-N 389.326 5.686 30 20 GKED Cc1ccccc1C1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)CC1 469370397 ZOJYXOGWJXHWEV-UHFFFAOYSA-N 385.511 5.273 30 20 GKED CCO[C@H](CCNC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CCCC1 473631784 ZLOIPLYVZSPSOD-VQIMIIECSA-N 389.565 5.045 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN(Cc1ccccc1)C(C)(C)C 474264068 HMCGWDONFFVQAZ-SFHVURJKSA-N 395.572 5.178 30 20 GKED N#Cc1cccc(-c2nnc(CSCc3ccc(C(F)(F)F)cc3)o2)c1 475866678 OBYLUPDOZVXOMX-UHFFFAOYSA-N 375.375 5.060 30 20 GKED N#CC[C@H](CC(=O)Nc1nc(-c2c(F)cccc2F)cs1)c1ccccc1 479719074 NEXRERMBKSMEBF-CQSZACIVSA-N 383.423 5.114 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(Br)cc1 479727721 CXTZLWISAUWAMZ-GFCCVEGCSA-N 390.306 5.487 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H]1CCc2ccccc2C1 480303234 VYWDIRSCYPRSCJ-SFHVURJKSA-N 397.478 5.188 30 20 GKED CC(C)CC(=O)Nc1cccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)c1 481922685 MQCJZPOYNZMMTJ-HSZRJFAPSA-N 375.516 5.100 30 20 GKED COc1ccc(CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C2CC2)cc1 481991498 MCAPXMNLIIQGDS-UHFFFAOYSA-N 398.462 5.164 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)CCCc2cccs2)cc1 487971784 ADIVEPACARAGKX-UHFFFAOYSA-N 392.499 5.311 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccccc1 488817544 DXKIERMCLQVAGL-FQEVSTJZSA-N 378.516 5.668 30 20 GKED N#CCC[C@H](NC(=O)Nc1ncc(Cc2ccccc2F)s1)c1ccccc1 496334326 UWCAKXTVOFDECA-IBGZPJMESA-N 394.475 5.040 30 20 GKED C[C@@H](NC(=O)Nc1cc(C#N)cn1C(C)(C)C)c1nc(-c2ccccc2)cs1 502051157 QJFOGVKKHASELA-CQSZACIVSA-N 393.516 5.121 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 503214711 DOPZAJMDFNOOPN-ICSRJNTNSA-N 393.556 5.486 30 20 GKED CCN(C(=O)c1cccc(Br)c1Cl)c1ccc(C#N)c(Cl)c1 503648916 LLICMKGXBDZOCF-UHFFFAOYSA-N 398.087 5.294 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1F 510381551 RNZZVNPNEPDWOY-UHFFFAOYSA-N 389.430 5.428 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](Nc3ccccc3)C2)cc1 517111854 UTWAJESKUXCPGY-OAQYLSRUSA-N 398.466 5.069 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@H](C)C#N 520856457 FYAXOLBIUGTGQF-OAHLLOKOSA-N 387.936 5.646 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1cccc(COc2ccccc2)c1 523756758 CUZVYALKAFWMGX-UHFFFAOYSA-N 383.373 5.163 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1cc(F)cc(C(F)(F)F)c1 531263276 KIHMQMNAJNMUSW-UHFFFAOYSA-N 399.237 5.177 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c(-c2ccccc2)s1 541723530 KBIFBCHBULGEAX-AWEZNQCLSA-N 387.386 5.022 30 20 GKED N#CCc1ccc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)cc1 542237115 ZOYSFJCVPWHNFV-UHFFFAOYSA-N 393.849 5.410 30 20 GKED C=CCC[C@@H](Nc1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 542281807 KWCFEHJEIFHAPI-GOSISDBHSA-N 383.435 5.228 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc(Sc3ccccc3C#N)cc2)C1 542585012 QGCRBFPNLILLQC-JTSKRJEESA-N 399.519 5.328 30 20 GKED N#Cc1ccc(CN(C(=O)[C@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)C2CC2)cc1 543224557 CAJOYSLWGAZOOJ-ROUUACIJSA-N 385.294 5.160 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc2ncsc2c1 548599957 KSJWGUHESJTQOW-KGLIPLIRSA-N 396.541 5.431 30 20 GKED N#C[C@H](C(=O)c1coc(C2CCCC2)n1)c1nc(-c2c(F)cccc2F)cs1 549079872 JTAFHCZNPFKQRX-GFCCVEGCSA-N 399.422 5.224 30 20 GKED COc1ccc([C@@H](Cc2ccncc2)Nc2cccc(OCCCC#N)c2)cc1 556887106 ZNZWWXUIMHZHBN-XMMPIXPASA-N 387.483 5.169 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2c[nH]c3ccc(F)cc23)CC1)c1ccccc1 561709581 CIVASUGONAJDIE-KRWDZBQOSA-N 376.475 5.373 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 572345755 COINPAOHPZAETF-UHFFFAOYSA-N 389.411 5.352 30 20 GKED C=CCN(CCc1ccccc1)Cc1nnc(-c2c(Cl)cccc2Cl)o1 588168119 IPWMFWTZNMCCNG-UHFFFAOYSA-N 388.298 5.274 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N[C@@H](c3cccs3)C3CC3)cc2)ccn1 589362551 KLKZZAKGVZRKKY-HXUWFJFHSA-N 390.468 5.080 30 20 GKED COc1ccc(CNCc2ccc(C(C)(C)C#N)cc2)cc1OC1CCCC1 594502026 GXDULDCYZVFNGA-UHFFFAOYSA-N 378.516 5.108 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)C1 598410023 JFYVBJLVSMJFOP-LFRSYBKYSA-N 399.519 5.159 30 20 GKED Cc1ccc(C[S@](=O)CC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1C#N 600928611 RXRSIJXNCYAMQU-NDEPHWFRSA-N 396.556 5.001 30 20 GKED C=CCN(CC1CCCCC1)C(=O)NCc1ccnc(Oc2ccccc2)c1 601885097 MVGBUGRXUZGVJR-UHFFFAOYSA-N 379.504 5.152 30 20 GKED CCN(C(=O)Cc1sc(C)nc1-c1cccs1)[C@H](C)c1ccc(C#N)cc1 603530494 NPSMZXXJEFREQS-CQSZACIVSA-N 395.553 5.204 30 20 GKED N#Cc1c(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)sc2c1CCCCCC2 603996119 AADMBMRIHCLEEH-QWHCGFSZSA-N 384.467 5.586 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2)cs1 608552947 BHTJUVNHBRUTCE-OAHLLOKOSA-N 393.468 5.357 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)Nc1ncc(C#N)cc1Cl 609289231 QFWPKKJSYFHZAD-SNVBAGLBSA-N 389.311 5.865 30 20 GKED COc1cccc([C@H]2C[C@H]2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 609298318 SRSILKSPCHIHHF-DHIUTWEWSA-N 398.462 5.410 30 20 GKED Cc1ccc([C@H](NC(=O)Cc2ccc(C#N)cc2)c2ccc(F)cc2Cl)cc1 609374290 OFBDPKCYQFMIHE-QHCPKHFHSA-N 392.861 5.108 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NC[C@@H]3CCOc4ccccc43)cc2)c1 609437211 WDUXBZGZIOBWPI-SFHVURJKSA-N 399.450 5.038 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC2CCCCC2)cc1 609786416 IDNJGUZGWWYSQN-QGZVFWFLSA-N 394.540 5.902 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CN[C@@H](C)c1cccc(C#N)c1 610344637 BSTAXMJLMHOSLM-FQEVSTJZSA-N 392.506 5.570 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)C2)cc1 612299035 OVHTWDMIEIRHPN-HXUWFJFHSA-N 398.466 5.075 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N1CCC[C@@](C)(C#N)C1 612315946 WAMFTGPNVOXNJB-QFIPXVFZSA-N 395.528 5.145 30 20 GKED N#Cc1ccc(CN[C@H](Cc2ccccc2)c2cccs2)c(Br)c1 612482078 LLKWUDVOPVZHPD-LJQANCHMSA-N 397.341 5.456 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3ccc(C#N)c(Cl)c3)c2C(C)C)cc1 616564256 RKNJHJVAHVKJQL-UHFFFAOYSA-N 378.863 5.082 30 20 GKED N#Cc1ccc(CNC(=O)c2ccccc2SCc2cccs2)cc1Cl 619766801 GQMPWYWNCGQOLE-UHFFFAOYSA-N 398.940 5.495 30 20 GKED C=C(C)Cn1c([C@H]2CC[C@@H](C)O2)nnc1N1CCC[C@H]1c1ccc(Cl)cc1 624984087 YOOXYSYZPQBAOJ-AYOQOUSVSA-N 386.927 5.089 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)o2)c(C)c1 647377481 NIMFXQMAHTZFIC-KRWDZBQOSA-N 392.480 5.299 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Sc2nc(C)cs2)cc1C 665928356 BMVIJYSFRRHHGS-IYBDPMFKSA-N 385.558 5.626 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2n1C(F)F 726426213 RVYJIXMNOSJJCJ-UHFFFAOYSA-N 393.319 5.158 30 20 GKED C=CCN(Cc1cccs1)C(=S)NCCc1ccc(Cl)cc1Cl 726442916 KAPUXWXNGBGHOU-UHFFFAOYSA-N 385.385 5.160 30 20 GKED C=CCNC(=O)c1ccccc1NC(=O)c1cc(C)c(-c2ccc(F)cc2)s1 726500435 YBAJMRIIGDXWLB-UHFFFAOYSA-N 394.471 5.031 30 20 GKED C=CCOc1ccc(/C=C2\SC(=Nc3c(C)cccc3C)NC2=O)cc1Cl 727264310 QEMKXDIOPOYEAM-PDGQHHTCSA-N 398.915 5.413 30 20 GKED COc1cccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)c1OC 727267103 CNUIFYDINCQUGD-XFXZXTDPSA-N 383.444 5.171 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=S)Nc1ccccc1C#N 727981618 PQKVRTUGSRIUKN-KRWDZBQOSA-N 387.508 5.816 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc2ccccc2c1OC(F)F 728438306 TXLZAIFCFPMBRE-HJWRWDBZSA-N 397.208 5.378 30 20 GKED CCCCO[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 729071135 XKQFCUBRJJYACJ-BXUZGUMPSA-N 397.327 5.498 30 20 GKED CCC(CC)CN(CCC#N)C(=S)Nc1ccccc1Oc1ccccc1 729642378 KNTGYLSIEQEMRB-UHFFFAOYSA-N 381.545 5.828 30 20 GKED Cc1sc(CNCc2ccc(O[C@@H](C)C#N)cc2)nc1-c1ccc(Cl)cc1 729680522 TXJMZRIQXCVZBK-AWEZNQCLSA-N 397.931 5.353 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)nc2ccccc12 731332519 NLFFWNHXDAIHRV-CYBMUJFWSA-N 381.888 5.535 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CC[C@@H](c3ccco3)C2)s1 732413945 HULOYYPAMKQPSO-OAHLLOKOSA-N 376.526 5.056 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cc(Cl)cs2)cc1 737321799 BFTMUUWIJHKXCS-ACJLOTCBSA-N 388.920 5.195 30 20 GKED Cc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)ccc1Oc1cccnc1 741847673 JUVRPQRCFXMDLX-GQCTYLIASA-N 395.871 5.441 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1[N+](=O)[O-] 743445343 QMENSPQAWVGRKV-UHFFFAOYSA-N 380.351 5.059 30 20 GKED C=CC[C@H](NC(=O)NCC[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 746420412 DTPDCHSYENHNAD-KXBFYZLASA-N 391.437 5.211 30 20 GKED CC/C(=C/C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)cc1 746847032 OPFHLZFRWZDCEZ-MUBYSKIDSA-N 380.513 5.379 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1O 750915028 BTDKJAIRGXXDSD-DUXPYHPUSA-N 390.279 5.335 30 20 GKED CCN(CC#N)C(=O)c1cc(-c2ccc3cc(OC)ccc3c2)nc2ccccc12 751109283 QFVWSHUZODSNMH-UHFFFAOYSA-N 395.462 5.049 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2ccc(Br)s2)cc1 753589536 IVKIXFPALXUBLZ-XJKSGUPXSA-N 391.334 5.139 30 20 GKED FC(F)(F)c1ccccc1ON=CC1=Cc2cc(Br)ccc2OC1 754713081 YXKFGWHXAFFPOL-UHFFFAOYSA-N 398.178 5.309 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(Cl)cs1 757916894 YHVYFANGLUXFSI-UHFFFAOYSA-N 382.872 5.413 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 758508555 STFBMFRSMJVBCA-HJPURHCSSA-N 394.877 5.649 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2ccc(Br)cc2)c1 760480471 ZWKGTVJBDURKTI-ICSRJNTNSA-N 387.321 5.371 30 20 GKED CCOc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)cc1[N+](=O)[O-] 765617022 SPEMLBMDRIQMPE-MDZDMXLPSA-N 380.425 5.013 30 20 GKED CN(CCC#N)c1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 769524203 LVTJKVDUSOTBSJ-UHFFFAOYSA-N 396.538 5.263 30 20 GKED CC(=O)N1C/C(=C\c2ccc(Sc3ccccc3)cc2)C(=O)c2ccccc2C1 778520195 PQTJNLMTEBZNOU-RCCKNPSSSA-N 399.515 5.466 30 20 GKED Cc1nc(-c2cc3c(s2)CCN(Cc2ccc(O[C@@H](C)C#N)cc2)C3)cs1 779608149 IYEDNROIXKPMMH-AWEZNQCLSA-N 395.553 5.029 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 780486686 ZJFPCDQIOGRYKH-LAUBAEHRSA-N 396.450 5.277 30 20 GKED CC(=O)Nc1ccc(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)cc1 781552856 DFPXFVHNMDTYSY-KHPPLWFESA-N 382.872 5.318 30 20 GKED CN(C(=O)Nc1cccc(OCC#N)c1)[C@@H](c1ccc(Cl)cc1)C1CCCC1 799208231 SYHOTFXYQFMKCG-OAQYLSRUSA-N 397.906 5.638 30 20 GKED Cc1nc(C(F)(F)F)ccc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801709373 NWRJMEXPAJCGKJ-CYBMUJFWSA-N 380.263 5.077 30 20 GKED CSCCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 860502935 PXEBMPFZUDSFKY-KRWDZBQOSA-N 383.542 5.172 30 20 GKED CCOc1cc(Br)c(N[C@H](C)c2cccc(C#N)c2)cc1OCC 864007439 YCDOTKQARRCFEZ-CYBMUJFWSA-N 389.293 5.291 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(-c2noc([C@]3(C#N)CC4CCC3CC4)n2)c1 904636954 VOMULRAKRPTPEX-AWBPIWROSA-N 394.475 5.055 30 20 GKED Cc1nc2ccccc2c(=O)n1N=Cc1c2ccccc2c(Cl)c2ccccc12 916292807 NDWFFSDCLVYFCM-UHFFFAOYSA-N 397.865 5.547 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\Sc3ccccc3)n2)cc1 916971583 BUWHUDKRYWSNIF-JYBLJSLWSA-N 376.506 5.601 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCOc2ccccc2F)cc1 918323042 RDWNWDCKSVNQGK-OAQYLSRUSA-N 388.442 5.279 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1oc2cc(C)ccc2c1CC(=O)O 1776029750 SDYPHVIFDPLPDV-UHFFFAOYSA-N 391.254 5.511 30 20 GKED CCC(Cc1ccc(Cl)cc1Cl)=NNc1ccc(Cl)c(C(=O)O)c1 1776033442 HULVJUMHIZNADK-UHFFFAOYSA-N 385.678 5.766 30 20 GKED Cc1c(C=NNc2ccc(Cl)c(C(=O)O)c2)sc2c(Cl)cccc12 1776033810 KHXVTVNUHBSNAL-UHFFFAOYSA-N 379.268 5.661 30 20 GKED COc1ccc(C[C@@H](C)C=NNc2ccc(C(=O)O)c(F)c2)cc1C(C)(C)C 1776075786 DPJQFFWVWSMNAK-CQSZACIVSA-N 386.467 5.107 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)cs2)cc1 1776125630 OEOZQELNKZDGLH-YUQCYMQKSA-N 386.513 5.938 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2C(=O)O)c1)c1ccc(F)c(F)c1 1776126003 ZHYSBLLCOOMNAB-DHZHZOJOSA-N 394.373 5.138 30 20 GKED CC(C)(C)Oc1cccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)c1 1776264967 KGUNATWNCWXBMT-ZROIWOOFSA-N 382.456 5.004 30 20 GKED CC(C)(C)c1cnc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)s1 1776277080 PQHLSYSCVQGZMK-FLIBITNWSA-N 381.453 5.295 30 20 GKED CC(F)(F)c1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776444963 XPOKIPSPDKFGJW-BJMVGYQFSA-N 382.362 5.653 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(N(C)c2ccccc2)nc1 1776783861 CCIUVFLMQGQFIA-FQEVSTJZSA-N 383.536 5.143 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Sc2ccccc2)cc1 1776784726 NNHGJDNDCGWUDB-FQEVSTJZSA-N 385.573 6.131 30 20 GKED O=C1/C(=C\c2cccc(SC(F)(F)F)c2)C[C@@H](C(=O)O)c2ccccc21 1777698385 KKWDKNOFRWBIBI-IYCSXQJISA-N 378.371 5.137 30 20 GKED CCOc1ccccc1OCCCC(=O)Nc1sc2c(c1C#N)CCCCC2 14500494 ROKJPWZLJANGAM-UHFFFAOYSA-N 398.528 5.085 30 20 GKED N#CCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 17368378 WDUZUKISWMZNMV-UHFFFAOYSA-N 389.436 5.064 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)cc2)=C(/S)Nc2ccc(C)cc2)cc1 22730886 AJRDYIVDYNHFOY-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CC(C)(C#N)c1ccc(N[C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)cc1 28373787 OCHUROSTSOOWDM-XMMPIXPASA-N 393.490 6.005 30 20 GKED CCCCCCCCCC(=O)N1CCC(c2nc(-c3ccccc3)no2)CC1 98016577 IHIGZXLAKIHUMX-UHFFFAOYSA-N 383.536 5.583 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 108530855 DAFUOYDVRPQPOK-UONOGXRCSA-N 389.471 5.441 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)Cc1ccc(OCC#N)cc1 110247378 JRTFZWKSKVKQFN-UHFFFAOYSA-N 388.492 5.230 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@@H](Nc2ccccc2)C1 111015543 MTIRCXHJRMIPHO-HXUWFJFHSA-N 399.519 5.036 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 111948029 AWWMWSMGWPDDGA-BZPDREMPSA-N 387.439 5.101 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 121341887 OLZFYWGQFKBTMI-GOSISDBHSA-N 375.394 5.348 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 152775858 OPLJTQFPGKOGDK-SFHVURJKSA-N 383.451 5.352 30 20 GKED C[C@@H](c1ccccn1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 172233897 OLZUEHOJTQVZMG-HNNXBMFYSA-N 391.858 5.232 30 20 GKED O=C(CCC(F)(F)F)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 173436563 VALVITABIVGUKM-UHFFFAOYSA-N 396.262 5.313 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 175770019 KDGKTVURSDCGFT-UHFFFAOYSA-N 385.448 5.219 30 20 GKED CSc1cccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1[N+](=O)[O-] 186180410 HOOWRSMUHQIZEQ-UHFFFAOYSA-N 395.465 5.169 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)cc1 187259090 ICWCPWBFYOABMC-UHFFFAOYSA-N 386.329 5.164 30 20 GKED COc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 193614748 RNMKYLRWUPFTKV-UGSOOPFHSA-N 396.899 5.452 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 194739894 MHFULZYRRATTAC-NRFANRHFSA-N 385.854 5.048 30 20 GKED CC(C)c1ccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)c2cccs2)cc1 236800427 SKNSPSYJZKPUCU-HOYKHHGWSA-N 390.552 6.042 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 237877737 FLEFUIPOYXVECB-DEOSSOPVSA-N 390.914 5.902 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 303369062 RYHZNUJUQTWMQZ-SJORKVTESA-N 396.556 5.784 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(OC2CCCC2)c1 303382262 MVCLAYMUOLIJNI-INIZCTEOSA-N 380.513 5.512 30 20 GKED C[C@@H]1C[C@@H](C(O)=Nc2nc(-c3ccc(Br)s3)cs2)CCC1=O 329399176 VKHHLLDQRDRORI-BDAKNGLRSA-N 399.335 5.227 30 20 GKED Cn1ccc2cccc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)c21 329979616 JXZOKIQRWABWBO-SFHVURJKSA-N 376.504 5.273 30 20 GKED COc1cc(CSCC2(C#N)CCC2)ccc1OCc1cccc(C#N)c1 419408860 MEEKKLQWOYHUFY-UHFFFAOYSA-N 378.497 5.073 30 20 GKED CCc1cc(Br)ccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425651931 IDRRXWWSYGTFEC-ZDUSSCGKSA-N 386.293 5.108 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(N2CCCCCC2)c1 425654010 PRIJCDUHZIUSHY-GOSISDBHSA-N 376.504 5.164 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccnc(Oc3ccc(F)cc3F)c2)cc1 433535833 XRGCNHSLXKZEMU-UHFFFAOYSA-N 393.393 5.206 30 20 GKED N#Cc1c(NC(=O)c2cc(F)c(F)cc2F)sc2c1-c1ccccc1CC2 437283397 HNBRTRDUKQAUKO-UHFFFAOYSA-N 384.382 5.055 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@H]3c3ccc(Cl)cc3)o2)cc1 441404883 OOAWUVMCHWPOFQ-FQEVSTJZSA-N 392.890 5.379 30 20 GKED COCCC[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(F)cc1 442863974 FGKHLLICSWLWOV-VWLOTQADSA-N 388.486 5.622 30 20 GKED CCOc1ccc(C(=O)N2CCCCC2)cc1N[C@@H](CC)c1ccc(C#N)cc1 447592101 JXBVQBZQHKSLIF-NRFANRHFSA-N 391.515 5.146 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC4(CCC4)[C@H]3c3ccco3)cc2)c1 454768181 SFYJRSZDMRFMFN-JOCHJYFZSA-N 399.450 5.703 30 20 GKED Fc1cc(CN2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)cc(C(F)(F)F)c1 459643519 CVMTWSHKORHQOP-HNNXBMFYSA-N 399.350 5.026 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(-c2ccccc2Cl)o1 464944234 WQGOAHRYGBFDAF-ICSRJNTNSA-N 390.870 5.512 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1C(C)(C)C 468808314 CDQCLDQBQRVYAH-GOSISDBHSA-N 389.543 5.740 30 20 GKED C[C@H]1C[C@@H](C)CN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@@H]1C 474505356 HBXSVHMPGDXIRL-CEXWTWQISA-N 391.515 5.230 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)[C@H]1CCCc2cccnc21 475571214 VDLIGPJZGMLOJE-QFIPXVFZSA-N 391.559 6.255 30 20 GKED C=C(C)[C@H](N[C@@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccc(F)c(F)c1 481570611 GTERCDKWLOHCPK-BTYIYWSLSA-N 386.486 5.324 30 20 GKED O=C(NC[C@@H]1CCCC[C@@H]1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 483675280 ZNZYTSSSNZBOFU-ONGXEEELSA-N 386.311 5.335 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 488307095 JXVMTGHDAGVNRE-CMKODMSKSA-N 393.556 5.657 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 499833488 LZRFGYVSMLLXSI-WBMJQRKESA-N 379.312 5.103 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccc(F)c(C)c1)C1CC1 500520341 CSNAAGAGPDQBLQ-JOCHJYFZSA-N 398.526 5.151 30 20 GKED CC[C@H]1C[C@@]1(NCc1ccc(OC)c(OCCCC#N)c1)c1cccc(C)c1 500526692 FNTKTLOMTIXARI-RDPSFJRHSA-N 378.516 5.101 30 20 GKED N#Cc1ccc(CSCC(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc1 500555188 GJKLDGNLQNVFSL-HSZRJFAPSA-N 386.520 5.308 30 20 GKED Cc1cc(OCCn2cc(C#N)c(=O)c3cc(Cl)ccc32)ccc1C(C)C 502860533 YMRNTMMESPZSLN-UHFFFAOYSA-N 380.875 5.037 30 20 GKED C=CCCc1ccccc1NC(=O)N(CCC(F)(F)F)Cc1ccccc1 505037327 AKNBNPAVXOLQIX-UHFFFAOYSA-N 376.422 5.792 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)ccc2o1 505424313 ZRWRCBPYRQEMQU-UHFFFAOYSA-N 379.435 5.052 30 20 GKED N#Cc1cc(NC(=O)c2cc(Cl)sc2Cl)ccc1OC(F)(F)F 508193695 XJIBBIIHHDNHMI-UHFFFAOYSA-N 381.162 5.077 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Cn1ccc2ccccc21 511695598 OKVFNCHOQAAJIG-IRXDYDNUSA-N 377.513 5.310 30 20 GKED C[C@H](Oc1ccccc1C#N)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 511980943 JBCLIJCASLVJMM-ZBEGNZNMSA-N 391.324 5.159 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-c4cnco4)cc3)n2)cc1 518174480 BWMBAHNOFMSSPP-GOSISDBHSA-N 385.448 5.264 30 20 GKED CCCc1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)s1 518516534 JLEGMARDRKQVTK-HNNXBMFYSA-N 397.525 5.026 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(F)c(F)c1 518906827 WQOMZOLPEURNPD-UHFFFAOYSA-N 378.378 5.100 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2cccc(Cl)c2)CC1 524832354 TXUWPNOKAJEPMT-HNNXBMFYSA-N 399.947 5.588 30 20 GKED Cc1cc(C(=O)CS[C@H](C)c2ccc(C#N)cc2)c(C)n1CC(F)(F)F 533814027 PMOHUPYRHLOWOM-CQSZACIVSA-N 380.435 5.216 30 20 GKED N#CCc1ccc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc1 534744599 RBLBQYGEULFCQF-UHFFFAOYSA-N 394.308 5.497 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)c2ccc(F)cc2C(F)(F)F)cc1 536890298 PEROVPWWWQGUBC-UHFFFAOYSA-N 398.359 5.313 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc(F)c3ccccc3c2)cc1 555417068 SDCOQAXPKALMAZ-UHFFFAOYSA-N 386.348 5.055 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 557895591 WBBRNWGOBKSNGR-ACRUOGEOSA-N 394.396 5.343 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC(CCC#N)CC1 567816313 OYPYUBWDRLLXQQ-LJQANCHMSA-N 391.515 5.683 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@H]2CC[C@H](C(F)(F)F)C2)C(C)(C)C)cc1 572075293 NKZBGJXLMNWUGK-IRXDYDNUSA-N 383.454 5.357 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1sc2cccc(Cl)c2c1Cl 603511291 LZGMCTQKULVJFX-UHFFFAOYSA-N 375.280 5.352 30 20 GKED CCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 604495637 UWLZJCQOGFWGJH-LSDHHAIUSA-N 389.421 5.431 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)c1 607821638 VELHVWAFJLLZTB-UHFFFAOYSA-N 380.488 5.187 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1ccc(Cl)c(Cl)c1 609370836 AYHZDVVBKHVLNT-LBPRGKRZSA-N 395.311 5.263 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1cccc(Cl)c1Cl 609796504 WIXOFCPCEKFDMG-CQSZACIVSA-N 391.298 5.292 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cn1)c1ccccc1 613292322 HJLHEFZPNULTEC-UWJYYQICSA-N 393.446 5.260 30 20 GKED C[C@@H](Nc1nc(C(C)(C)C)ccc1C#N)c1ccc(NC(=O)c2ccncc2)cc1 613423845 QIURNJASJJWEBF-MRXNPFEDSA-N 399.498 5.071 30 20 GKED Cc1ccc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(F)c1 622485540 QIKXKDPHFHPKIX-AWEZNQCLSA-N 379.275 5.186 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)(F)F)c(Cl)c1)c1nc(C2CC2)cs1 626466611 HRGTZQWQRXWHRT-JTQLQIEISA-N 386.782 5.063 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3cccs3)c2)[C@@H]1c1ccncc1 644980419 MQHWBCTWNOAMNR-OAQYLSRUSA-N 387.508 5.158 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(SCc3cccnc3)cc2)c1 726450972 TUXIMDPICBCMQF-UHFFFAOYSA-N 375.522 5.164 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3ccccc3SC[C@H](C)C#N)cc2c1 730993861 DQELHXLMNWBNDZ-CQSZACIVSA-N 391.496 5.056 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C\c1ccccc1Cl 730997405 GMLCZPVXXFCUMW-IWMPZKFUSA-N 392.933 5.004 30 20 GKED Cn1c(CC(=NOCc2cccc(Cl)c2)c2ccccc2)nc2ccccc21 731664260 GPXMWXQJXIPQCP-UHFFFAOYSA-N 389.886 5.390 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2OC2CCCC2)c1 733843149 BEZGSJGXLHLOIK-GOSISDBHSA-N 393.487 5.011 30 20 GKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1ccc(-c2ccncc2)cc1 745990523 SCKWQYSSTMYMFT-KTKRTIGZSA-N 383.369 5.586 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(Cl)s1 749910937 IRUWNICRHPSZOR-RDTXWAMCSA-N 380.900 5.799 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1SC(F)F 752620087 DLOBBJSAXQMJHU-NVXWUHKLSA-N 387.455 5.305 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H](C)c1ccc2ccccc2c1 753389788 JAMZVTISCWDNOH-YCRPNKLZSA-N 380.447 5.325 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 755261427 UXUAPISHKZHARW-ZDUSSCGKSA-N 395.450 5.207 30 20 GKED N#CC1CCC(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)CC1 755977115 LVXVQRFDUGZYOI-UHFFFAOYSA-N 376.428 5.234 30 20 GKED C#CC[C@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1ccccc1 756777555 ZTMMYVSCDDHPKW-PXAZEXFGSA-N 378.697 5.223 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)Cc1cccc(OCC#N)c1 760379421 KRWLHGMWWYZEPC-UHFFFAOYSA-N 394.540 5.503 30 20 GKED N#C[C@H](C(=O)CC1CCSCC1)c1nc2cc(C(F)(F)F)ccc2s1 762067437 GOTZNXSGBUOVTM-GFCCVEGCSA-N 384.448 5.025 30 20 GKED C=CC[C@@H](N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccncc1 766023643 VXZWOUBZUGKBRQ-YADARESESA-N 398.510 5.276 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)c(Br)c2)c1 772984277 PKEYKSGPOBIMQW-XJKSGUPXSA-N 391.284 5.120 30 20 GKED C=CCOc1cccnc1C(=O)O[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 775245565 ZPCHFFWZWSYBCI-AWEZNQCLSA-N 398.459 5.135 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1ccc(Br)cc1Cl 788353673 IKHXEZPEQZLMSI-ARJAWSKDSA-N 396.615 5.474 30 20 GKED N#CCOc1cccc(CC(=O)N[C@@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 791234484 KLRSZKHPMPJSOM-FGZHOGPDSA-N 396.918 5.018 30 20 GKED N#CCCCCCC(=O)OCc1cc(Cl)c(Br)c(Cl)c1 805927722 HEDACZHNKDQBFR-UHFFFAOYSA-N 379.081 5.273 30 20 GKED Cc1sc(NC(=O)c2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c(C#N)c1C 841008803 WXTVPGDOIJMWHX-CYBMUJFWSA-N 399.516 5.075 30 20 GKED C=CCOc1c(Cl)cc(CNc2cccc(NC(=O)OC)c2C)cc1OC 858161208 HBHQEOFGSJTAPM-UHFFFAOYSA-N 390.867 5.012 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl 863862049 HGQYARDTPURIKX-UHFFFAOYSA-N 385.851 5.119 30 20 GKED O=C(c1cccc(Oc2nccs2)c1)N(O)Cc1cccc2ccccc12 901371006 KHVOVBZXQXVQCP-UHFFFAOYSA-N 376.437 5.120 30 20 GKED CCCCn1nc(C)c(/C=C/C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1Cl 916137004 FMVBYDHMCQAJJJ-SOFGYWHQSA-N 382.247 5.103 30 20 GKED Cc1nc2sc3c(c2c(=O)n1N=Cc1ccc2ccccc2c1)CCCCC3 916272549 BCKWWQNJJHBASG-UHFFFAOYSA-N 387.508 5.071 30 20 GKED Cc1ccc(/C=C/C(=O)[C@H](C#N)c2nc3ccccc3s2)c(Br)c1 916846119 IABIGUQRQZXKIS-VFNNOXKTSA-N 397.297 5.257 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3cccc(C(C)C)c3)n2)cc1 916974742 OUDRQZLQGAOFFF-HXUWFJFHSA-N 390.508 5.497 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917430149 FHBFCSJSQIHSAM-SAAWKEMMSA-N 386.398 5.595 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1cccc(Cl)c1Cl 1776785351 YFVKJGUJVFNMET-LJQANCHMSA-N 388.379 6.582 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C/c1ccc(-c2cccc(C(=O)O)c2)s1 1777316286 PRGLNMVIWPZCEQ-RMKNXTFCSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ncc(Cl)cc3Cl)c2c1 1777684122 WLHWTUWIEYIAKB-HNQUOIGGSA-N 378.236 5.197 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@@H]2CCCC[C@H]2C)c1 27490069 RFWRHXWPOWVUAV-WIYYLYMNSA-O 395.592 5.006 30 20 GKED N#Cc1cccc(NC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c1 43329374 YCSIDLSVETXSKP-UHFFFAOYSA-N 396.903 5.233 30 20 GKED N#C[C@H](C(=O)c1ccccc1CSc1nc2ccccc2o1)c1ccccn1 49457033 NPJVBISOFVQDKA-KRWDZBQOSA-N 385.448 5.005 30 20 GKED C=C(C)COc1cc(/C=C(/C#N)C(=O)Nc2cccc3ccccc23)ccc1OC 60790051 YFTOLAMFQLIUBB-MOSHPQCFSA-N 398.462 5.349 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1 62923205 YZHHYSFDSXETFA-FGSXEWAUSA-N 392.499 5.060 30 20 GKED CCOc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 66510055 GVONPVDTVGSKFM-IBGZPJMESA-N 376.481 5.018 30 20 GKED CC(C)(C)n1cc(CNCc2ccc(C#N)cc2F)c(-c2ccccc2Cl)n1 66594084 ISSXYUSBUMPHLC-UHFFFAOYSA-N 396.897 5.259 30 20 GKED Cc1cc(SCC(=O)c2cn(CCC#N)c3ccccc23)nc2ccccc12 104583945 WAAMFXZVPZOITK-UHFFFAOYSA-N 385.492 5.387 30 20 GKED CCc1ccccc1O[C@@H](C(=O)[C@@H](C#N)c1nc(C)cs1)c1ccccc1 107407926 OLMSAZBYDHDEPI-WIYYLYMNSA-N 376.481 5.011 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1cccc(F)c1F 108409301 YVEVBAADSLLFPK-ZDUSSCGKSA-N 392.496 5.231 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 123692696 ZLOLXGJJPUXVOX-LSDHHAIUSA-N 399.564 5.081 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3c(F)cc(F)cc3F)c2)cc1 151408337 PLOIYFNGLFCGGT-UHFFFAOYSA-N 396.368 5.001 30 20 GKED Cc1cc(Cl)ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 151657482 HIJRBVKXJGUKJN-KRWDZBQOSA-N 377.856 5.134 30 20 GKED CCc1noc(C)c1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 156452680 AISLZRLUDJCODC-KRWDZBQOSA-N 394.862 5.498 30 20 GKED CC[C@]1(C)CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 175374358 SCNKQMIEHGNGOT-XMMPIXPASA-N 391.515 5.376 30 20 GKED CSCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1F 177603908 WBDINDZOCIUTHR-MRXNPFEDSA-N 382.485 5.302 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c2c1 177605203 IKAZWGYIFMKCPN-MRXNPFEDSA-N 392.409 5.030 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2occc2CSc2ccccc2)n1 177763414 PQSJWQJFVPYHHA-MRXNPFEDSA-N 382.510 5.642 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1OC 177775813 KEUXEYFJFCGGDZ-ZDUSSCGKSA-N 392.908 5.207 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccccc1SCc1cc(C)no1 192798480 JBCFSRDXSIHPRB-UHFFFAOYSA-N 384.526 5.165 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 303338164 LBEPYPGJLJSAPV-MSOLQXFVSA-N 396.556 5.919 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H]3CCc4cc(F)ccc43)cc2)c1 303365719 RDIRLCFJLPDUIP-QFIPXVFZSA-N 387.414 5.299 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1scnc1C1CCCC1 329511643 KRLYTRZOUJQLCY-KRWDZBQOSA-N 384.549 5.495 30 20 GKED C=CCC1(C(=O)N2CCC(c3ccc(Cl)cc3Cl)CC2)CCOCC1 424836127 SEPORMMIMMFYPE-UHFFFAOYSA-N 382.331 5.072 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 429370416 HCGBPUXVNQUTSX-DZGCQCFKSA-N 397.525 5.081 30 20 GKED N#CCSc1cccc(C(=O)N2CCc3ccccc3[C@@H]2c2ccccc2)c1 430703399 KDRMWOAODPWMNM-QHCPKHFHSA-N 384.504 5.090 30 20 GKED N#CCSc1cccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 431168676 ITZSFUZYIZGSEY-GOSISDBHSA-N 391.323 5.586 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@H]1c1ccncc1 432766392 CGQZAJHMVVATCW-QFIPXVFZSA-N 398.466 5.361 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)o1 432877982 GYOMXJVSJYQNHP-UHFFFAOYSA-N 375.428 5.160 30 20 GKED N#CCCC[C@@H](NCC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccccc1 433014922 UPATUPJJVVOXTN-XMMPIXPASA-N 399.494 5.442 30 20 GKED CS[C@@H]1CCCCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 435719961 SGJKWQGDVZEHEE-LJQANCHMSA-N 396.581 5.208 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccccc1 435761174 PFWSGEIFQNQWHU-QFIPXVFZSA-N 381.495 5.119 30 20 GKED N#CCCCOc1cccc(CNc2cccc3cncc(Br)c23)c1 444009880 NEJMDFLYUGIXRU-UHFFFAOYSA-N 396.288 5.292 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc(C3CCSCC3)no2)cc1 445534512 UDOWQKHFQXJYRF-UHFFFAOYSA-N 381.432 5.150 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(C(C)(C)C(F)(F)F)cc3)[nH]c12 447511556 ULONHQZTKAYJSV-HNNXBMFYSA-N 385.389 5.201 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC4(CCC4)[C@@H]3c3ccco3)c2)cc1 454734553 XMPVIAABANDNEA-QFIPXVFZSA-N 399.450 5.703 30 20 GKED C[C@@H]1C[C@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCO1 456897197 KASWJTRXWMIFPN-ZIAGYGMSSA-N 386.904 5.116 30 20 GKED COc1ccc(/C=C/c2ccc(OCCCC3(C#N)CCOCC3)cc2)cc1 461072940 FVJWGAIBWRRLQN-ONEGZZNKSA-N 377.484 5.345 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1cccc2cnccc12 465129513 KPOUSVNQOCHTNH-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C[C@]1(c2ccccc2)CC[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C1 469267467 QTGHLLFQFMIMFX-DHLKQENFSA-N 387.527 5.192 30 20 GKED Cc1cc2occ(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)c2cc1C 471726581 NJOJJVXZXYZDLG-UHFFFAOYSA-N 397.434 5.669 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc2[nH]ccc2c1 472179911 NHJKTJJMXYHEGU-INIZCTEOSA-N 392.528 5.027 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)c(C#N)s1 472361105 DNNRZRAMZMMHHW-UHFFFAOYSA-N 386.826 5.842 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)Nc2cc(C#N)ccc2C)cc1 473358120 XOANEJMLOFAUSB-SFHVURJKSA-N 399.494 5.767 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)[C@@H](C)c1ccc(Cl)cc1 475203006 KVTGCILRSWCGOM-SJORKVTESA-N 395.934 5.527 30 20 GKED CC[C@H](c1ccccc1)c1nnc(NC(=O)C[C@@H](CC#N)c2ccccc2)s1 475756159 CKRIGBOPKGVMEM-RTBURBONSA-N 390.512 5.106 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 476148993 NBWCSFSVRIFXEW-UXHICEINSA-N 387.445 6.300 30 20 GKED C=C(C)[C@H](N[C@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccc(F)c(F)c1 481570614 GTERCDKWLOHCPK-VFNWGFHPSA-N 386.486 5.324 30 20 GKED CCN(C(=O)Nc1ccc(F)c(C#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 481683955 IVHBPHQPMDWQBT-GFCCVEGCSA-N 379.357 5.331 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)C1CCOCC1 483377745 QVYHBBFHFLXBPX-UHFFFAOYSA-N 378.472 5.050 30 20 GKED CC(C)(C)c1ccc(-c2csc(NC(=O)c3ncc(C#N)cc3Cl)n2)cc1 485801741 YOEUGPVPBDZZAZ-UHFFFAOYSA-N 396.903 5.280 30 20 GKED Cc1cc(Br)cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 486342601 FXQIAYSXXBWHEP-UHFFFAOYSA-N 386.293 5.072 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@H](CCCC#N)c2ccccc2)s1 487622977 AQUXKHBHZALNIG-HXUWFJFHSA-N 389.524 5.592 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 488707209 CLQKXEAUAXEEDA-HXUWFJFHSA-N 390.508 5.689 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 490228090 YSDKYHADPRRXTI-HRAATJIYSA-N 379.529 5.662 30 20 GKED N#C[C@H](C(=O)c1cnc2c(F)ccc(F)c2c1)c1nc2cc(Cl)ccc2s1 496408251 UEWVUVNSTUAGBO-GFCCVEGCSA-N 399.809 5.266 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 499815439 SRWDMFSMCPGUJF-VYDXJSESSA-N 379.674 5.131 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 500244565 GOGFCZMZOFBCKG-HNNXBMFYSA-N 394.368 5.183 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cc2ccccc2s1 504694989 LSSXEAZJWNOQSS-MRXNPFEDSA-N 387.508 5.333 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CCCOc4ccccc43)cc2)cc1 506631356 FJGVJEKHTJASAB-QFIPXVFZSA-N 399.450 5.386 30 20 GKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(OCc2ccccn2)c1 512646525 AVWUZJWCXZAOGN-IAGOWNOFSA-N 375.447 5.083 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(COc3ccccc3C#N)o2)s1 513381739 CAYIIHJQEBQBNC-SFHVURJKSA-N 392.480 5.078 30 20 GKED COC(=O)[C@@H](Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1Cl 513438836 UBZPDPMIIRLRTG-KRWDZBQOSA-N 377.271 5.121 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccccc1 515932441 MWTULTXPHXERKO-YLJYHZDGSA-N 379.529 5.697 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccc3)cc2)ccn1 516859992 UWQVWNNHGJQNQY-QFIPXVFZSA-N 384.439 5.115 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 518756759 HURACTOQYRUIPS-HNNXBMFYSA-N 387.936 5.788 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 521796706 FPGRBEQTOXUGCR-GOSISDBHSA-N 382.529 5.577 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N[C@H](CC(F)(F)F)c1ccccc1 524441691 XGTZFDYTFKAKOR-CQSZACIVSA-N 394.290 5.660 30 20 GKED C[C@H](N[C@@H](C)c1cc2ccccc2s1)C(=O)N(CCC#N)c1ccc(F)cc1 527485531 LGTGQAJFWRMEGT-HOTGVXAUSA-N 395.503 5.026 30 20 GKED C[C@@H](c1ccc(CNC2(c3ccc(C#N)cc3)CCOCC2)cc1)C(F)(F)F 528780015 AHWMFIGYIYAXRR-INIZCTEOSA-N 388.433 5.020 30 20 GKED C=CCOc1ccc(CN(Cc2nnc(-c3cc(C)oc3C)o2)C(C)(C)C)cc1 535555947 GCJOPUHUAKHYBF-UHFFFAOYSA-N 395.503 5.312 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C(C)(C)Cc1nc2ccccc2[nH]1 537304028 VAYNKKDOSPHQJX-UHFFFAOYSA-N 387.936 5.061 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)C1CCCCC1 541602198 HVADHMHEJVGDNC-SQNIBIBYSA-N 387.593 5.071 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 542086829 WTXDTRHKEDQDNW-UUOWRZLLSA-N 396.494 5.228 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 542372087 INPIBYWURYWYFH-HKUYNNGSSA-N 379.529 5.411 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc(F)cc1 553944950 HYNHBVIFNUMPBJ-DLBZAZTESA-N 377.246 5.183 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 554180861 YVYCNADINKUVAX-UHFFFAOYSA-N 398.404 5.232 30 20 GKED N#Cc1csc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)c1 556617081 WMVLLUWJPNCHJP-JOCHJYFZSA-N 387.508 5.209 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C1CC1)[C@@H](C)c1ccccc1 562167198 IMBFFUNYBKOVBF-IRXDYDNUSA-N 379.529 5.696 30 20 GKED N#CCCCn1cc(-c2nc(Cc3c[nH]c4cc(F)ccc34)no2)c2ccccc21 566704471 RTRHQAQZYUEZHY-UHFFFAOYSA-N 399.429 5.206 30 20 GKED CC[C@](C)(C#N)c1nc(-c2ccc(-c3csc(-c4ccncc4)n3)cc2)no1 571206730 WEPSNTWRSVZKQK-OAQYLSRUSA-N 387.468 5.113 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(F)(F)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 574093129 DKXHBENVIKKXEJ-XJKSGUPXSA-N 390.396 5.399 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2ccccc2n1C(F)F 577850257 GMPZADVGXKGQAI-SECBINFHSA-N 390.802 5.118 30 20 GKED Cc1cc(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)c2nccc(C)c2c1 581316381 VLYGWHHBZZGPRU-UHFFFAOYSA-N 387.527 5.176 30 20 GKED N#CCCCCCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 588887938 IUEOXHFBCZGTLY-FQEVSTJZSA-N 375.299 5.673 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)C3CC3)cc2C(F)(F)F)c(Cl)c1 600851324 ZFUTYIYTQRYJEV-UHFFFAOYSA-N 393.796 5.191 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)[C@@H]1c1ccccc1 604362044 CVFHORLBDNDTBE-JOCHJYFZSA-N 398.466 5.361 30 20 GKED COc1ccc([C@@H](Nc2nc(C(F)(F)F)ccc2C#N)c2ccccc2)cc1 609669452 MVSOFTOITNLKRM-IBGZPJMESA-N 383.373 5.182 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 610778436 YFTCIGAVWOVLBS-JTSKRJEESA-N 380.451 5.048 30 20 GKED CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 610792647 SLHZFPRQSPYWSJ-HTAPYJJXSA-N 393.556 5.868 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc2cc(Cl)ccc2s1 613407245 NCYWHESGLQSCEZ-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 619674384 YSGVDUSHAPKOLD-GOSISDBHSA-N 396.277 5.277 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)nc1 685783920 JWQAXTSCUUFCFY-ZDUSSCGKSA-N 389.402 5.324 30 20 GKED N#C[C@@H](C(=O)CSCc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 727090826 BZLGTEMTCPSKCI-KRWDZBQOSA-N 398.940 5.573 30 20 GKED N#C[C@H](C(=O)Cc1ccc(-c2ccccc2)cc1)c1nc2cc(F)ccc2s1 730417720 QEVIJCCRDMMNMM-LJQANCHMSA-N 386.451 5.521 30 20 GKED Cc1ccc(C)c(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)c1 730951413 NABLJQYYUZNUSW-YFHOEESVSA-N 376.408 5.070 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/C[C@@H](O)c1ccc(Cl)cc1Cl 731938066 QWZYUMKMSILLSI-QFAMHRKESA-N 379.070 5.158 30 20 GKED Cc1cc(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)c(C)n1[C@@H](C)c1ccccc1 733258568 FGJWKDQTTREIPB-KSFYIVLOSA-N 391.902 5.362 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@H]1c1ccc(OC)cc1)c1ccncc1 734681873 ZYVXYIJLHWAMKY-VXKWHMMOSA-N 379.504 5.034 30 20 GKED CCC[C@@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccn1 740048215 RESYVBYNTHBNDM-HXUWFJFHSA-N 390.512 5.022 30 20 GKED Cc1cc2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)oc2cc1C 742536586 AUKKASMSZFPOKO-QFIPXVFZSA-N 380.447 5.957 30 20 GKED CS[C@@H]1CC[C@H](NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 742744329 JNMGWFNRKGGESU-GOEBONIOSA-N 386.904 5.018 30 20 GKED C#CCCCNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 742785717 LMOHRZDUESQZCB-UHFFFAOYSA-N 383.900 5.522 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1ccc(Oc2cnccn2)cc1 743056355 DYCLSEHRGJOBJR-YFHOEESVSA-N 379.485 5.227 30 20 GKED C=CCn1c(SC[C@H](O)c2cc(C)cc(C)c2)nnc1-c1ccc(Cl)cc1 743253950 WYFRELKNJYQSTD-IBGZPJMESA-N 399.947 5.227 30 20 GKED CCc1oc2ccccc2c1C=NO[C@H](C)c1nc(-c2ccccc2C)no1 744445576 RRIJDQLHIGKFPV-OAHLLOKOSA-N 375.428 5.465 30 20 GKED CCC(=NNc1oc(C(C)(C)C)nc1C#N)c1cc(Cl)cc(Cl)c1O 746497884 NCMZRAXCGFHSEI-UHFFFAOYSA-N 381.263 5.082 30 20 GKED Clc1ccc(CSc2nncn2N=C[C@H]2CCCc3ccccc32)cc1 752163272 UPELFCRNPCRGAB-QGZVFWFLSA-N 382.920 5.178 30 20 GKED C[C@H](Cc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 756515767 FPUYYMDCVOUXGN-DOMZBBRYSA-N 387.817 5.140 30 20 GKED C#CC[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)c1ccccc1 756998038 QHEFAHZCKYZKRW-LJQANCHMSA-N 397.341 5.427 30 20 GKED Fc1ccc(CON=Cc2csc(COc3ccc(Cl)cc3)n2)cc1 758143041 CPULZBXJIQYBCH-UHFFFAOYSA-N 376.840 5.065 30 20 GKED CC(C)(C)OC1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 759494480 KUBYJBICKIQQGS-JOCHJYFZSA-N 391.515 5.153 30 20 GKED CCCCN(C(=O)Nc1ccc(F)cc1OCC#N)[C@H](CC)c1ccccc1 761664790 KYHXXKDLQWSUQA-HXUWFJFHSA-N 383.467 5.513 30 20 GKED COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 766258460 DIGVHXQGDPTECK-IBGZPJMESA-N 390.508 5.281 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)C2CCC(C(F)(F)F)CC2)c1 766608301 GALVGUICTKHXDS-UHFFFAOYSA-N 375.390 5.163 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)CCc2ccc(Br)cc21 769616848 LIJXFNMGJVMCCO-LCYFTJDESA-N 397.297 5.180 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 772971346 LYLPWTXILMWNHL-VQIMIIECSA-N 392.549 5.556 30 20 GKED CS[C@@H](C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773771984 USVWSLKYOSODNJ-GXFFZTMASA-N 399.368 5.825 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccccc1SCc1ccco1 780166283 KFRAKUUVEBEZDX-HNNXBMFYSA-N 378.453 5.115 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1C1CCCCC1 781134804 HHPHZPZJBLVGCG-HSZRJFAPSA-N 398.510 5.605 30 20 GKED COc1ccc(SCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 781444240 GMRZQXYRXADLCW-MRXNPFEDSA-N 382.510 5.054 30 20 GKED CC(C)Sc1cccc(Cl)c1C=NNc1c(F)c(F)nc(F)c1F 786039643 WRKDJBCANAFXMN-UHFFFAOYSA-N 377.794 5.238 30 20 GKED CC(C)(C)OC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)c(Cl)c2)c2ccccc21 800989396 CESHWXJBVYVFGH-UXHICEINSA-N 397.906 5.012 30 20 GKED C=C(C)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 804860882 RHYARKFCCZXHAO-WJDWOHSUSA-N 394.452 5.255 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(N2CCCCC2)c1 806226998 FUHMIZIRXUOYGZ-UHFFFAOYSA-N 395.551 5.065 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](c1ccccc1)[C@H](O)c1ccccc1 808722593 DLQRPGJCROHTBI-UODIDJSMSA-N 382.507 5.390 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1F 916667011 BDVBUMURVYTETF-UHFFFAOYSA-N 393.399 5.009 30 20 GKED COc1cc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc(OC)c1OC 917517622 TUHNPMOITLNMFZ-KTKRTIGZSA-N 380.465 5.337 30 20 GKED COc1cccc(Oc2ccc(NC(=S)Nc3ccccc3C#N)cc2)c1 917597758 QOWBTCPAXXYRGV-UHFFFAOYSA-N 375.453 5.168 30 20 GKED CCN(Cc1c(-c2ccccc2)nc2sccn12)[C@H](C)c1ccc(C#N)cc1 919741223 KALBDEHNIPXMMV-QGZVFWFLSA-N 386.524 5.518 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(C(F)(F)C(F)(F)F)cc2)ccc1Cl 1776034615 PIOLEXIXOJKWCC-UHFFFAOYSA-N 392.711 5.138 30 20 GKED Cc1cc2ccccc2nc1NN=Cc1ccc(-c2ccc(C(=O)O)cc2)cc1 1776052802 TZBSDHDLBNRLIG-UHFFFAOYSA-N 381.435 5.354 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(OCc3ccccc3Cl)c2)ccc1F 1776061945 WULQLACILHTPLQ-UHFFFAOYSA-N 398.821 5.202 30 20 GKED Cc1c(NN=C(CC2CC2)c2cccc(Br)c2)cccc1C(=O)O 1776090153 WKAQAQHWIUAJCM-UHFFFAOYSA-N 387.277 5.072 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(C(F)(F)F)c1 1776355478 QQNNORVJCUDWPU-VURMDHGXSA-N 378.346 5.087 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)cc(Cl)c1OC 1776782843 FZAHGOQVJMQQHS-HNNXBMFYSA-N 376.324 5.295 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C)c2ccc(OC)c(C(=O)O)c2)cc1 1776787076 SHAXUUAAKINKKT-SFHVURJKSA-N 399.531 5.593 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(C(=O)O)c(F)c3)s2)cc1 1777430608 QIMYEYGVPPXARJ-POHAHGRESA-N 381.428 5.160 30 20 GKED O=C(O)/C=C\c1ccc(/C=C/C(=O)c2ccc(N3CCCCCC3)cc2)cc1 1777624134 QDWWZCSFKCUNIM-TYVLLQCESA-N 375.468 5.061 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)[C@H](C#N)c1nc2ccccc2o1 41543884 GYSFBBHHXPVNFX-AWEZNQCLSA-N 393.855 5.403 30 20 GKED CN(C)c1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 46893306 LPJAVTQWYKBPOS-OAQYLSRUSA-N 389.886 5.314 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c2cc1C 51655481 HTACTDZVAQXMKJ-MRXNPFEDSA-N 393.393 5.213 30 20 GKED Cc1ccccc1NCCC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 58425479 JOYAEMYTHSYMEA-UHFFFAOYSA-N 399.494 5.081 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 65680359 WECOZBOCOSVXSE-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccccc1S[C@H](C)CC#N 66800235 MQVJKLUNBCYVHR-OAHLLOKOSA-N 389.524 5.427 30 20 GKED CCOc1ccc2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)[nH]c2c1 66856300 JWTRPCUAMPKDTR-CQSZACIVSA-N 379.485 5.213 30 20 GKED C[C@@H](Sc1cc(C#N)ccn1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 71918313 CDNOLSCGVRJJSH-MRVPVSSYSA-N 386.691 5.033 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 108407556 CETNJMPGFMMWDP-UKRRQHHQSA-N 387.936 5.339 30 20 GKED CC(C)CC(=O)Nc1cccc(CNc2ccc(C#N)c(C(F)(F)F)c2)c1 111217924 GIZFJTMPHIVXHL-UHFFFAOYSA-N 375.394 5.174 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1F 121696854 BAKGCXTTZUVUOJ-CQSZACIVSA-N 386.835 5.101 30 20 GKED C=C(C)Cn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccncc1 123345777 JBEZLPOVHSBKDG-CQSZACIVSA-N 383.521 5.055 30 20 GKED CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 150781369 XSLSKKAYRMKXBE-UHFFFAOYSA-N 397.906 5.378 30 20 GKED N#CCC[C@@H](Nc1nn2cc(-c3ccc(F)cc3)nc2s1)c1ccccc1 164325152 VRTKPNMRPBVCKH-QGZVFWFLSA-N 377.448 5.054 30 20 GKED C=CC1CCN(Cc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)CC1 165788283 SOUBZIFTUKXHTK-UHFFFAOYSA-N 383.561 5.151 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc12 173265371 WANSFWCVEUVVGZ-CYBMUJFWSA-N 398.557 5.405 30 20 GKED CCSc1ccc(Cl)cc1C(=O)Nc1nc(C)c(SCC#N)s1 176954684 QFQOGFHZJVICGQ-UHFFFAOYSA-N 383.951 5.085 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](Cc1ccccc1)c1cccs1 180033623 ADBHHWAPQXCAMC-QFBILLFUSA-N 391.496 5.144 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(Cl)cc1F 188912013 XCHGVZSTMODWIF-GFCCVEGCSA-N 377.872 5.053 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 190868135 LFWQQVRIWGXQLD-HNNXBMFYSA-N 379.510 5.018 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)s1 411008774 UUZPWLGPAZPDPZ-UHFFFAOYSA-N 397.378 5.097 30 20 GKED CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1 425653085 OJCCHDXBOQQRCE-CQSZACIVSA-N 399.878 5.002 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)CCCCC(=O)c2ccc(F)cc2)cc1 426991841 OWEVZQWSXUJRDC-OAQYLSRUSA-N 394.490 5.247 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(C2CCCC2)C1 431988669 YLYYSOVROJIMPO-UHFFFAOYSA-N 375.472 5.313 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1c(-c2ccc(Cl)cc2Cl)noc1C 435702181 YAQNWGFDMYTWQW-UHFFFAOYSA-N 386.238 5.389 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc2nc(C3CC3)sc2c1)c1ccccc1 439367430 ATYMMKHKTDRVQO-KRWDZBQOSA-N 376.485 5.340 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)c(Br)c1)c1ccccc1 439477436 KKDABVXEOUTROZ-MRXNPFEDSA-N 392.684 5.269 30 20 GKED CC(F)(F)c1ccc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cn1 460018466 VVDGBSYMNCMSPR-UHFFFAOYSA-N 375.444 5.038 30 20 GKED CCSc1cc(Cl)ccc1C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 461113346 YXEKFOYEKKWNEW-OAHLLOKOSA-N 398.837 5.465 30 20 GKED CCN(C(=O)CCCCc1ccc(Br)cc1)c1ccc(C#N)cc1 461533431 AIIVDOYLYFJVAL-UHFFFAOYSA-N 385.305 5.087 30 20 GKED CC(C)[C@H](C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 463275911 NHRKKWUDCACVQN-QHCPKHFHSA-N 397.478 5.189 30 20 GKED Cn1ccc([C@H](Nc2ccc(C(F)(F)F)c(C#N)c2)c2ccc(Cl)cc2)n1 463487010 ONIWPYXJTRLREU-GOSISDBHSA-N 390.796 5.165 30 20 GKED COc1ccc(N(C)C(=O)c2ccccc2-c2ccccc2C#N)cc1Cl 466915331 JDYSFIWSMDNHDW-UHFFFAOYSA-N 376.843 5.164 30 20 GKED CCCCn1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)n1 473487071 JJKCRXIRXCADEX-INIZCTEOSA-N 398.919 5.259 30 20 GKED COc1ccc(C)cc1-c1csc(NC(=O)C[C@@H](CC#N)c2ccccc2)n1 475759276 ADECJJYJKZDXCF-QGZVFWFLSA-N 391.496 5.153 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2ccc(F)cc2C)n1 476110168 MKMRDGPGMZQXNS-UHFFFAOYSA-N 377.463 5.424 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 476121500 NTMZKIBKOXVJMW-CQSZACIVSA-N 375.871 5.737 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 476529828 GCRPFMCZHQRXRI-WMZOPIPTSA-N 378.369 5.023 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)Nc3ccc(F)c(C#N)c3)cc2)cs1 481592779 DKDLATMOHKBWGM-GFCCVEGCSA-N 380.448 5.012 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1)c1c[nH]c2ccccc12 486432314 JUCJIQGCOLIJSP-DJJJIMSYSA-N 385.389 5.061 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](c1c[nH]c2ccccc12)C(F)(F)F 490757213 HOFDCIDZJAKBHN-LJQANCHMSA-N 387.405 5.169 30 20 GKED CCN(CC#N)C(=O)c1oc2ccccc2c1CSc1ccccc1Cl 492127017 LVKOVNRZMDFPBJ-UHFFFAOYSA-N 384.888 5.364 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 494268372 ODWQHEPSRAYBCW-UHFFFAOYSA-N 395.846 5.673 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)C[C@H](C)C2 509230233 REJNGZKQGGTYNY-CIJMEZBMSA-N 395.506 5.343 30 20 GKED N#Cc1cnc(NCc2ccccc2-c2ccc(Cn3cccn3)cc2)c(Cl)c1 513608080 JJCVJBOAHCSKLA-UHFFFAOYSA-N 399.885 5.131 30 20 GKED C[C@H](Nc1ccc(-c2ccccc2)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 525247844 NQNXMZLFCAWDOA-SFHVURJKSA-N 387.458 5.240 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)[C@H](C)C#N)cc2Cl)c(Br)c1 530815594 MFZFFRMLGNULEZ-LLVKDONJSA-N 393.668 5.301 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1ccc(C#N)cc1Cl 534483884 IKTBVHUIYPVQDJ-LBPRGKRZSA-N 376.913 5.325 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2CC(=O)Nc2ccccc2SCC#N)cc1 536236883 CKEVWQVZHYANRW-NRFANRHFSA-N 393.556 5.201 30 20 GKED N#Cc1cc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)ccc1Cl 544398179 WFQVVBDWGSAKMW-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C=CCC[C@H](NCc1nc2cc(F)ccc2o1)c1ccc(C(F)(F)F)cc1 557572095 XYJCDXFSCMUGPH-INIZCTEOSA-N 378.369 5.783 30 20 GKED C[C@@H](NCc1cc(F)c(C(F)(F)F)cc1F)c1nc(C(F)(F)F)cs1 566991297 YMPCSCIQEPWYLG-ZCFIWIBFSA-N 390.299 5.310 30 20 GKED Cc1c(Cl)cccc1-n1c(S[C@@H](C)CCC#N)nnc1-c1ccncc1 568302764 RHGMGXOHBHCNIR-ZDUSSCGKSA-N 383.908 5.076 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 571607874 NGRNPVJUTHGMGU-QFIPXVFZSA-N 396.412 5.465 30 20 GKED CCCN(CC#N)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 580020686 XVPQIYMZCHKPQJ-UHFFFAOYSA-N 393.339 5.661 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 583282564 HOWOFVPAHUHODP-UHFFFAOYSA-N 392.286 5.240 30 20 GKED C=CCOc1ccc(CNCc2ccc(Oc3cccnc3)c(F)c2)cc1Cl 589644088 AEDJMXMDWQTIIA-UHFFFAOYSA-N 398.865 5.521 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3c(F)ccc4ccncc34)c(C#N)c2[C@@H]1C 598845812 IZROZTUAFBASBI-NWDGAFQWSA-N 379.460 5.245 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc(Cl)ccc1Br 603527558 OTXHWJCMNULPDO-UHFFFAOYSA-N 391.696 5.025 30 20 GKED CCN(C(=O)c1oc2ccccc2c1CSC)[C@@H](C)c1ccc(C#N)cc1 603530501 QQRVPSQRSKISTH-HNNXBMFYSA-N 378.497 5.391 30 20 GKED Cc1occc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 604316399 ISDRMXHGLGPMJL-IBGZPJMESA-N 379.847 5.219 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)o1 604505395 UVYHRRRHPMOWLB-UHFFFAOYSA-N 389.455 5.038 30 20 GKED Cc1nc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)cc2)oc1C 609042563 APKZQFXFRUXXRN-UHFFFAOYSA-N 386.455 5.027 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209567 CEJNRWQNTRWQDH-UHFFFAOYSA-N 385.467 5.793 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N(C2CCCCC2)C2CC2)cc1 609297342 IJEHFUZZUOGZJN-UHFFFAOYSA-N 378.447 5.427 30 20 GKED C/C=C\c1ccc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(OC)c1 609384626 ZFEPFZLWYXEEBA-HQQUCIOCSA-N 396.512 5.140 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 609501457 RBXPQCLITKTGSP-HSZRJFAPSA-N 376.500 5.251 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc3n[nH]cc3c2)c1 609722948 GNBPXCQUUYGMSR-UHFFFAOYSA-N 388.814 5.133 30 20 GKED Cc1ccccc1OCc1nnc(SCCC(C)(C)C#N)n1-c1ccccc1 610165541 HYLUKQSXOBJDDI-UHFFFAOYSA-N 392.528 5.187 30 20 GKED CC(C)(CNC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cccc(Cl)c1F 613627360 HYEXALZECUULCG-UHFFFAOYSA-N 399.680 5.365 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)oc2ccc(F)cc12 618297767 NFZBIRIYJGFCKF-UWVGGRQHSA-N 397.290 5.083 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H]3CCc4cc(C#N)ccc43)cc2)c1 618753933 DRVJSDCUNBWYQP-HSZRJFAPSA-N 394.434 5.031 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1cc(Cl)cc2cccnc12 619791628 NTVYXZVJMFOIOD-UHFFFAOYSA-N 394.261 5.085 30 20 GKED C[C@@H]1CC[C@H](c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)O1 624688511 XNSKGCOFZIJNCE-LDYMZIIASA-N 398.278 5.266 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1 727401241 KPFQLTUVAZRSEY-UHFFFAOYSA-N 392.480 5.208 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3cccc(OCCCC#N)c3)c(C)c2c1 729148772 ATZLVWTUXQZSTF-CSKARUKUSA-N 375.424 5.329 30 20 GKED C=CC[C@H](NC(=O)c1sc2cc(C(C)C)ccc2c1Cl)c1ccncc1 734457551 LNWPTZBWCIKORB-KRWDZBQOSA-N 384.932 6.120 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F 735575898 XHMPPTBMQPVXHZ-UHFFFAOYSA-N 399.466 5.393 30 20 GKED CC(=NNc1c(F)cc(F)cc1Br)c1nc2ccccc2s1 741771585 LBRMHLJDGHVQAQ-UHFFFAOYSA-N 382.233 5.173 30 20 GKED Cc1csc(SCc2ccccc2C(=O)N[C@@H](C)c2cccc(C#N)c2)n1 743775475 NQLWPQKOQQEBPL-HNNXBMFYSA-N 393.537 5.107 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Cl)c(C#N)c2)cc1NC(=O)OC(C)(C)C 743822573 GSDPKLGHUNDTCA-UHFFFAOYSA-N 385.851 5.119 30 20 GKED CCCOc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 744035512 NCDMSUDBPQVKAN-QGZVFWFLSA-N 398.915 5.548 30 20 GKED COc1ccc2sc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c(C)c2c1 744117170 UXIYUXLIFRKKRB-CQSZACIVSA-N 396.468 5.457 30 20 GKED CCCn1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 746024749 AHTVQCQPFUWYDX-LJQANCHMSA-N 393.878 5.246 30 20 GKED Cc1cc(CCC(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc1Br 751824917 GAGGGCFLJPTEOM-CQSZACIVSA-N 399.313 5.176 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@@H](C#N)C1CCCCC1 776353653 FXBGCJBEPKPNGQ-IBGZPJMESA-N 384.501 5.213 30 20 GKED Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 776905287 ZIRZZJRDVIGIAU-VWLOTQADSA-N 395.506 5.549 30 20 GKED C=CC[C@@H](OC(=O)c1nc(-n2nc(C)cc2C)ccc1Cl)c1ccccc1 778738959 KYWQFKMJRQHSHU-GOSISDBHSA-N 381.863 5.012 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccc(F)cc1OCC#N)c1ccc(Cl)cc1F 781872231 IEARSPCOFJWPDY-GOSISDBHSA-N 393.821 5.039 30 20 GKED CC(C)(C#N)CCCOC(=O)CCC(=O)c1ccc2c(c1)-c1ccccc1C2 783287336 XNHFBFYMZXYBLU-UHFFFAOYSA-N 375.468 5.094 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2[nH]1 793118549 SUVBBEPUIZMHAK-GDBMZVCRSA-N 385.389 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C\Sc1cc(F)ccc1F 797867713 RXMQMAHGENBUJC-PRWOLLLXSA-N 390.480 5.604 30 20 GKED O=C1/C(=C/c2ccc(-c3cccc(F)c3F)o2)C[C@H](C(=O)O)c2ccccc21 806560435 LXUJDUVVSDDJPF-JICACKBISA-N 380.346 5.063 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2cscc2C(F)(F)F)C(=O)c2ccccc21 811691287 NHGANWWCQUXXME-OCOPJHETSA-N 380.387 5.084 30 20 GKED CC(C)(C)OC(=O)N1CCc2cc(NCc3ccc(C4(C#N)CC4)cc3)ccc21 850210199 AVMADVQEVNAXNF-UHFFFAOYSA-N 389.499 5.151 30 20 GKED CN(CCCN1c2ccccc2Sc2ccccc21)C(=O)CCCCC#N 863548984 WRSASFRYGYCEBZ-UHFFFAOYSA-N 379.529 5.222 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)C(=O)N1c2ccccc2Sc2ccccc21 913615449 YSIWGJSLMDIFMN-CQSZACIVSA-N 389.505 5.263 30 20 GKED N#C[C@@H](C(=O)C[C@H]1C[C@H]2CC[C@H]1C2)c1nc2cc(C(F)(F)F)ccc2s1 915103841 GNGBDYXVYVQXJZ-FMSGJZPZSA-N 378.419 5.318 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2c(Cl)nc3sccn23)cc1OC 915990776 XGJALLIZNBOWRS-SREVYHEPSA-N 390.892 5.133 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CSc3ccccc3Cl)n2)cc1 916973391 WOUIANNGKKWZLS-OAHLLOKOSA-N 398.940 5.741 30 20 GKED O=C(O)c1cc(NN=C/C=C/c2ccc(OCc3ccccc3)cc2)ccc1F 1776063380 NQMZLAFPIXJPBX-OPLMDEQRSA-N 390.414 5.214 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1cc(C(=O)O)ccc1Br)CC2 1776374589 CTWXGNFRFKUFAM-DHDCSXOGSA-N 399.284 5.483 30 20 GKED C[C@H]1/C(=C/c2ccc(C(=O)O)cc2Cl)C(=O)c2cccc(Br)c21 1776586511 ALWHINMIVUDBLH-XSHGTHSTSA-N 391.648 5.184 30 20 GKED O=C(/C=C\c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570100 SLRPAGJBUAKAKU-VURMDHGXSA-N 397.770 5.103 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C(C1CC1)C1CC1 51643630 IIBWERAKKRAARW-UHFFFAOYSA-N 375.472 5.311 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(C)sc2C)cs1 54897293 ICNQBSDGOVMLRI-JXMROGBWSA-N 396.537 5.711 30 20 GKED COc1ccc(/C=C/c2nc(-c3ccccc3)cs2)cc1OCCCC#N 64367310 CYMOJLVPGLPXJS-ZRDIBKRKSA-N 376.481 5.672 30 20 GKED Cc1sc(NC(=O)C2(C#N)CCCCC2)nc1-c1ccc(OC(F)F)cc1 72030023 OOXSPYWKASGFQU-UHFFFAOYSA-N 391.443 5.133 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2nccc3ccccc23)cc1 72075906 ZFJNSRUFQQHNQQ-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CCCN(C(=O)c1ccc(C#N)cc1C)[C@@H](c1ccc(F)cc1)c1cccnc1 121722272 ZWQBGJHBGLWTKW-QHCPKHFHSA-N 387.458 5.043 30 20 GKED CC(=O)CCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 123688190 QBUDRBPDJLNVJE-KRWDZBQOSA-N 388.920 5.569 30 20 GKED CCc1cc(C#N)c(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)s1 126767723 FLNOHRIRSRVQDP-UHFFFAOYSA-N 395.098 5.443 30 20 GKED CC(C)(C)c1cnc(SCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)o1 129997151 WRNXAKJQRYXYAK-CQSZACIVSA-N 397.525 5.064 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)Cc1ccccc1F 151978118 UHMXAUHKQFWBFF-INIZCTEOSA-N 389.430 5.010 30 20 GKED Cc1nnc([C@@H](C)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)o1 174270993 BJRVDTMFAHFHRK-LLVKDONJSA-N 388.349 5.234 30 20 GKED C#CCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 180739940 KGCIBQPBTWKJRE-AWEZNQCLSA-N 377.296 5.487 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(F)ccc1Br 189907555 QLQPPKFWXYCZSO-UHFFFAOYSA-N 390.296 5.621 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCOC)Cc1ccc(C#N)cc1 191462827 YZMMUAVAGIMLEI-UHFFFAOYSA-N 391.515 5.091 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1cccc(Br)c1 206943428 XXJGHSQOCNIROQ-KHPPLWFESA-N 394.268 5.319 30 20 GKED CCC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 237033701 NFEUIBNCJGGZNB-YWZLYKJASA-N 376.422 5.627 30 20 GKED CCc1ccc(C(=O)/C=C\c2csc(N(C(C)=O)c3ccc(C)cc3)n2)o1 254984568 CJLUWXAFMIQQHW-XFFZJAGNSA-N 380.469 5.188 30 20 GKED COc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)ccc1OCCC(C)C 302928165 CZBLSRWKJXEYCF-UHFFFAOYSA-N 380.488 5.174 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)CCc3ccc(C#N)cc3)c2)C1 303013566 ROFVXJTYKGWZOO-WZONZLPQSA-N 376.500 5.225 30 20 GKED O/C(=N\[C@H]1CCCSC1)C12CCC(/C(O)=N\[C@@H]3CCCSC3)(CC1)CC2 329320955 RLCLQCMLQYBROP-BANKROOTSA-N 396.622 5.031 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccc(F)c(C(F)(F)F)c1 330323521 SXULINVWASTNAF-JTQLQIEISA-N 388.386 5.140 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccoc3C3CC3)cc2Cl)cc1 409491936 OLMRZBIWBLEUQW-UHFFFAOYSA-N 378.815 5.727 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)Cc3csc(-c4ccoc4)n3)c2C#N)[C@H](C)C1 410983315 PQEMCYONEICRGB-VXGBXAGGSA-N 397.525 5.203 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1sc(C(C)(C)C)cc1C#N 411009095 WKFAITIYAHXGQJ-UHFFFAOYSA-N 379.485 5.062 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CC(F)F)c1ccccc1 422255735 HCMKGEXKKKBLCO-OAHLLOKOSA-N 384.879 5.496 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)c(C)c2c1 425471123 GOANAJIQDUAEBP-JKSUJKDBSA-N 391.471 5.085 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCCCCC#N 430566388 SCBAZGYRUGIYTJ-UHFFFAOYSA-N 380.275 5.025 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1OC1CCCC1)c1ccccc1 432678079 FXOUSOGTQWVWJV-FQEVSTJZSA-N 377.488 5.565 30 20 GKED Cc1nc(CN[C@@H](CCCC#N)c2ccccc2)oc1-c1ccc(Cl)cc1 433007586 AMFNFELOFKOVRO-FQEVSTJZSA-N 379.891 5.828 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1C#N 435564019 OANJNOJSQDVDIM-KRWDZBQOSA-N 391.393 5.161 30 20 GKED N#Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)cc1C(F)(F)F 438631738 JKIFRJXIURSXBH-INIZCTEOSA-N 377.366 5.319 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C#N)cc3Cl)s2)cc1 439461283 ZPYSDVGQQCJOMZ-CYBMUJFWSA-N 397.931 5.503 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cn(CCCC#N)c3ccccc23)n1 447611665 ZYENYIMTVSPLTO-INIZCTEOSA-N 376.485 5.015 30 20 GKED C=CCc1cc(C(=O)N(c2cnc3ccccc3c2)C(C)C)cc(OC)c1OC 448460421 ZWXFFLRMJQNCEB-UHFFFAOYSA-N 390.483 5.036 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccncc2)cc1C#N 455801287 SMSOXBSOHSUWFM-HXUWFJFHSA-N 392.503 5.280 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@@H](C)c1cccc(C#N)c1 461902200 LXUKNJOCRZSZFC-KRWDZBQOSA-N 398.466 5.253 30 20 GKED C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1ccc(C#N)cc1 466803197 BACZUKYZDOQZOI-LBPRGKRZSA-N 387.270 5.108 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)c1ccccc1-c1ccccc1C#N 469493884 LNTWBUQLFNXNDG-UHFFFAOYSA-N 376.843 5.530 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 472683007 LOCOVTNJUJZYHS-GOSISDBHSA-N 385.467 5.328 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](OC)c1cccc(Cl)c1 475575536 RGWPADYTIWXVFJ-HXUWFJFHSA-N 386.923 5.701 30 20 GKED CSc1ccc(CSCCC(=O)Nc2sc3c(c2C#N)CCC3)cc1 478743531 YNVWDZXXYCNNKU-UHFFFAOYSA-N 388.583 5.092 30 20 GKED CSc1cc(O)ccc1NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 486956440 NLAMLYWIDANMFK-UHFFFAOYSA-N 391.452 5.422 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 488384543 AUGFZACJOUWPNQ-UYAOXDASSA-N 379.891 5.568 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(COc2ccccc2C#N)o1 495111861 YFMLFMKCVXPMHL-QHCPKHFHSA-N 388.467 5.200 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1 502351184 GGRMNUIBEFNKAC-UHFFFAOYSA-N 393.443 5.055 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H]2CCCC[C@@H]2C)cc1 508278313 KVFRIGLIMCCFGH-JXFKEZNVSA-N 393.487 5.402 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccccc2)Cc2ccc(F)cc2)c1 508951246 QFFQZXWTJKTCHJ-UHFFFAOYSA-N 390.483 5.284 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510509016 SQXVHKIFNVEZCV-INIZCTEOSA-N 375.428 5.086 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)c2ccc(C#N)cc2F)cc1 512617768 GQYOWZDOANVWMZ-VOIUYBSRSA-N 392.449 5.480 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(C#N)CCCCC3)cc2Cl)cc1 512802347 SNBFUYPCCXALTM-UHFFFAOYSA-N 379.847 5.417 30 20 GKED Cc1c(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)sc2ccc(C#N)cc12 513262973 WLEXLXVLBPWDOR-MRXNPFEDSA-N 392.446 5.276 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 517789921 LKECKLQEDOAQNS-UYAOXDASSA-N 392.396 5.068 30 20 GKED N#CCCSc1ccccc1NCC(=O)N(C1CCCCC1)C1CCCCC1 519423699 AYOAPZANRVINCM-UHFFFAOYSA-N 399.604 5.598 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)nc3)cc2)c1 521317245 ZYSYRRMERDLOTK-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 524326838 NRYUONAIECJIPY-QZTJIDSGSA-N 387.310 5.407 30 20 GKED Cc1ccc([C@@H](C)N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 532931184 VGCYBKIMQBELLI-RTBURBONSA-N 395.572 5.329 30 20 GKED C=CCC[C@@H](N[C@@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 536839489 MSOHUUIIJFYVAC-QFBILLFUSA-N 390.449 5.720 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)c(F)c1 538508575 TVLAUEIMRMHCKL-QWHCGFSZSA-N 383.467 5.680 30 20 GKED Oc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc2cc(F)ccc12 541256664 CHMAOZVQWYJOAD-UHFFFAOYSA-N 376.231 5.179 30 20 GKED C[C@H](NC(=O)C[C@H]1OCCc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 542927624 KXFIRQVXGHOCMP-AVRWGWEMSA-N 396.490 5.107 30 20 GKED C[C@H](N[C@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1ccc(C#N)cc1 558872896 QTGJMXBMIIDIRE-ICJFFHGUSA-N 393.962 5.476 30 20 GKED CC[C@@H](CSC)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 560964914 FTGJWYHTWXEGHL-INIZCTEOSA-N 387.480 5.095 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)c1cc(C#N)ccc1Cl 563242066 JNEFVRHZTSRZKR-UHFFFAOYSA-N 384.060 5.188 30 20 GKED CC1CCN(CCC[C@@H](NCC2CCC(C#N)CC2)c2ccc(F)cc2)CC1 565143461 WJWIJOBKVNAPLG-SLXFGWRHSA-N 385.571 5.298 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCN(C)c2ccccc21 581471338 MDWJTFIFLRAZJE-WMZOPIPTSA-N 394.544 5.031 30 20 GKED CS[C@@H](CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)C(C)(C)C 583717712 CVCMZBRCIRMBSA-FQEVSTJZSA-N 398.597 5.358 30 20 GKED CCOc1ccc(C[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 591173683 AZONBEZPWOZQML-DLBZAZTESA-N 382.529 5.154 30 20 GKED Cc1cc(F)ccc1-c1ccc(CNC2(c3cccc(C#N)c3)CCOCC2)o1 594985093 WDBNSVHEVFSNMG-UHFFFAOYSA-N 390.458 5.061 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(COc2ccc(C)cc2)n1 603681449 OVQNECVJLKVQLC-UHFFFAOYSA-N 391.540 5.314 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Cl)sc3Cl)cn2)cc1 603764518 JVLLKZJFGXGLPD-UHFFFAOYSA-N 390.251 5.366 30 20 GKED Cc1ccc(F)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603765892 BXBJEOXSGGKAKH-HXUWFJFHSA-N 378.834 5.695 30 20 GKED CCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 604495635 UWLZJCQOGFWGJH-GJZGRUSLSA-N 389.421 5.431 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1Cl 608110437 ZVMJHQAQBJQIJM-HTQZYQBOSA-N 391.714 5.118 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)CC2)c1 609063494 BGHMEQPZYMRWQU-UHFFFAOYSA-N 382.463 5.116 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)Nc3cc(Cl)ccc3F)c2)cc1 609221298 QRPYRZZTKCHAQS-UHFFFAOYSA-N 395.821 5.194 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)CSCc2ccc(C#N)cc2)c1 609791903 TUCDOAJYKITSFP-QFIPXVFZSA-N 378.541 5.244 30 20 GKED CC[C@H](C)C(=O)Nc1cccc(CNc2ccc(C#N)cc2C(F)(F)F)c1 609961382 JBEFKALNYXIEMI-ZDUSSCGKSA-N 375.394 5.174 30 20 GKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 611391179 YQYOOLDDASGDMP-BVZFJXPGSA-N 383.495 5.260 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc(-c2ccccc2)cs1 613392124 KWLSBLKXFHOTOW-QFIPXVFZSA-N 392.483 5.871 30 20 GKED FC(F)n1ccnc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647229890 XNUMYDRVTAODSD-UHFFFAOYSA-N 391.237 5.180 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1conc1C1CC1 649228069 ZNRKAWFOMVTDHB-UHFFFAOYSA-N 396.262 5.094 30 20 GKED CC(C)Oc1ncc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1Cl 678325195 TWQRAAHRKCXSHO-HNNXBMFYSA-N 397.887 5.136 30 20 GKED CC(C)[C@H](C)N1Cc2ccc(N=Cc3cc(Cl)cc([N+](=O)[O-])c3O)cc2C1 726429837 RWOXBKYEUKYPMN-ZDUSSCGKSA-N 387.867 5.065 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(NC(=O)Nc3ccccc3)s2)c1 728479346 OKINZGXBBXNZHB-UHFFFAOYSA-N 389.480 5.040 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc3ccccc3c2)cc1 729553502 RAZNARUCFMBTES-VWLOTQADSA-N 391.474 5.817 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1sccc1-c1ccc(F)cc1 730988746 CODMRGKZRRCPKW-CQSZACIVSA-N 396.512 6.058 30 20 GKED Cc1c(C(=O)/C=C\c2c(OC(F)F)ccc3ccccc23)c(C#N)c2n1CCC2 731939594 ZHJNIJMIJAEWEB-KTKRTIGZSA-N 392.405 5.265 30 20 GKED C=CC1CCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)CC1 732421545 PMZODPBXPGSRQV-CQSZACIVSA-N 385.360 5.402 30 20 GKED CC(C)[C@@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 734706442 HTAFQUICAIQDHM-IAGOWNOFSA-N 387.474 5.850 30 20 GKED CC(C)(C)c1csc(-c2cccc(OC(=O)c3ccccc3OCC#N)c2)n1 740793917 QBEQKUQFDOVBDY-UHFFFAOYSA-N 392.480 5.229 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c[nH]c12 741178906 VLRVXPXLECYKFB-QHCPKHFHSA-N 379.463 5.313 30 20 GKED CCOCc1cc(/C=C\C(=O)c2ccc(SCC(F)F)cc2)ccc1OC 741841358 GAJQQGVCMXDCTH-WMZJFQQLSA-N 392.467 5.485 30 20 GKED COc1ccc(CN[C@@H](c2cc(F)ccc2F)c2ccccc2Cl)cc1C#N 742378353 GBUZPIOMLGXRIC-JOCHJYFZSA-N 398.840 5.378 30 20 GKED Cc1c(C(=O)/C=C/c2cnc(-c3ccccc3)[nH]2)cnn1-c1cccc(Cl)c1 742434656 MEFLPLIVECTQEG-ZHACJKMWSA-N 388.858 5.120 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1 753143905 LDDBZRDAZIADTE-VOTSOKGWSA-N 382.872 5.233 30 20 GKED C=CC[C@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 766018229 GTSQQEYDIRADFS-PXAZEXFGSA-N 388.355 6.087 30 20 GKED CCN(C(=O)c1cccc(NC(=O)OC(C)(C)C)c1)c1ccc(C#N)c(Cl)c1 774147873 JHBBQPPDNLVPEA-UHFFFAOYSA-N 399.878 5.225 30 20 GKED C#CC[C@@H](N[C@@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccccc1 775413993 CHZGKEGMTPUXNE-GBXCKJPGSA-N 376.544 5.096 30 20 GKED CC(=NNc1ccccc1OC(F)(F)F)c1sc(-c2cccnc2)nc1C 777453039 KNWZURGYCPDJTO-UHFFFAOYSA-N 392.406 5.248 30 20 GKED C=CC[C@@H](C(=O)Nc1cnc(Cl)c(Br)c1C)c1ccccc1 777784741 OMZNIFNYNOVNCL-CYBMUJFWSA-N 379.685 5.104 30 20 GKED CC(C)(C)Oc1c(F)cc(NC2CCN(Cc3ccc(C#N)cc3)CC2)cc1F 782776776 HKCJEKFKHMVRHL-UHFFFAOYSA-N 399.485 5.090 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(C#N)cc2Cl)ccc1OC(F)F 788361077 SYJGWBNGMJFYNH-DAXSKMNVSA-N 377.774 5.108 30 20 GKED COCC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(Cl)c(Cl)c1 790614349 QJTSCZFPTTXMCS-XOBRGWDASA-N 393.314 5.152 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 796694956 ZHCMCLDANGHUAB-SCLBCKFNSA-N 390.439 5.232 30 20 GKED COc1cc(C(C)=NNc2ccc(OC(F)(F)F)cc2)ccc1OC(F)F 812461087 GIVKFRFPYOOTJJ-UHFFFAOYSA-N 390.308 5.031 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211228 GIOGMWSKSUOCGY-FUHWJXTLSA-N 390.405 5.258 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)OC(=O)[C@@H](C)CC#N 850865001 HLDNMPISPUIKMC-JQWIXIFHSA-N 393.306 5.035 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 916057699 VQZJSJXHIUDZNN-FLSMSTFGSA-N 397.865 5.519 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(F)(F)F)cc3)o2)cc1 920064333 DJAMGJIGTQEIBW-LUAWRHEFSA-N 397.352 5.764 30 20 GKED Cc1cc(NN=Cc2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)ccc1Cl 1776104379 DFNKTCZNGWEGQQ-UHFFFAOYSA-N 398.846 5.273 30 20 GKED CCCCCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2O)cc1 1776785923 RWCVSFMPZDGNNM-LCYFTJDESA-N 382.456 5.336 30 20 GKED CCCCCCCOc1cccc(CN[C@@](C)(CCc2ccccc2)C(=O)O)c1 1776788082 PUFJNYYXWKFNPN-VWLOTQADSA-N 397.559 5.602 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CCOc2ccccc2)C(=O)O)cc1 1776788431 FBYPXNJALGQQKQ-HSZRJFAPSA-N 399.531 5.048 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(Oc3ccc(F)cc3)cc2)cc1C(=O)O 1777361051 SJYJYPLCWCYMFU-SWGQDTFXSA-N 392.382 5.221 30 20 GKED O=C(/C=C/c1ccc(C(=O)O)s1)c1ccc(OCc2ccc(F)cc2)cc1 1777569681 CWBAJUSKPTYDKP-PKNBQFBNSA-N 382.412 5.061 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCOc4c(Cl)cccc4C3=O)o2)cc1 1777670958 GQVBNQOPLYFHLN-QINSGFPZSA-N 394.810 5.347 30 20 GKED C=C(C)CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1 8645741 AUFVSCMNWYUWFT-UHFFFAOYSA-N 390.306 5.017 30 20 GKED Cc1cc(C)cc(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2ccccc2)c1 10172678 VMDGEFDXHALAQK-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1nc(CSc2ccccc2C(=O)N[C@H](C)c2ccc(C#N)cc2)cs1 26126678 LDYDSLQNMBPVNI-CQSZACIVSA-N 393.537 5.107 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(-c2ccc(C)o2)n1 33158161 VTSFLGCODSEABH-UHFFFAOYSA-N 378.906 5.255 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccc(C2SCCS2)cc1 55891116 XZXVFYNJTXVJIX-UHFFFAOYSA-N 385.554 5.002 30 20 GKED C[C@H](Nc1cccc(F)c1C#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1 59420538 OGBSDFOEAIORPI-AWEZNQCLSA-N 377.394 5.262 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 108531400 LAQASMNPBXAOSA-HNAYVOBHSA-N 399.947 5.961 30 20 GKED N#CCCCOc1cccnc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 110309399 IHZYBDIYIHWICI-UHFFFAOYSA-N 391.858 5.337 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(F)ccc1[N+](=O)[O-] 116096586 VCZCLFKXAXLNAQ-UHFFFAOYSA-N 396.218 5.024 30 20 GKED CCc1cc(C#N)c(NC(=O)COc2ccc3oc4ccccc4c3c2)s1 117594357 NNZJQWAUFQDGMR-UHFFFAOYSA-N 376.437 5.099 30 20 GKED N#Cc1c(NC(=O)c2ccc(Cl)nc2Cl)sc2c1CCCCCC2 122550638 PXCVLMGFZIDYRV-UHFFFAOYSA-N 380.300 5.233 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](c1cccc(Cl)c1)c1ccccn1 133767039 XJENEGMHGVYIKA-QFIPXVFZSA-N 375.903 5.415 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc([N+](=O)[O-])c1 146951354 JFOPHBXWLVRSQO-MRXNPFEDSA-N 397.843 5.170 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(OC(F)F)c2)ccc1OC(F)F 149481753 QWVQUORXUAFHNR-SOFGYWHQSA-N 384.325 5.184 30 20 GKED CC(C)n1nccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 151637312 XQPQVGHTOGBYLD-GOSISDBHSA-N 378.863 5.025 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](c1ccccc1)c1nccs1)c1ccccc1 160510409 ZWWRBEBOFWTSDC-PMACEKPBSA-N 377.513 5.239 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1 163897577 YJVMLGHHQYXHOO-HNNXBMFYSA-N 393.903 5.123 30 20 GKED Cc1ccccc1-n1c(SCCCCC#N)nnc1-c1c[nH]c2ccccc12 195556511 SIXZHNAPJYCJBJ-UHFFFAOYSA-N 387.512 5.510 30 20 GKED N#CCCCOc1cccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)c1 237831252 QPUFSOUZUTYCSV-LJQANCHMSA-N 375.299 5.453 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1cccnc1 293277613 JPIPFKMUFHDDGI-DNVCBOLYSA-N 380.517 5.091 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/Cc1cc(Cl)sc1Cl 329037710 RSSUNPZHUXBCGX-VIFPVBQESA-N 391.345 5.219 30 20 GKED Cc1csc(C(C)(C)/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)n1 329442377 LECCBNOWKHVDHP-MRXNPFEDSA-N 386.565 5.150 30 20 GKED O/C(C[C@@H]1OCCc2ccccc21)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329527932 UKJKUEXNNQDMCN-SFTDATJTSA-N 379.504 5.036 30 20 GKED CC(O)=Nc1ccc(N=C(O)N[C@@H]2C[C@H]2C2CCCCC2)c(C(F)(F)F)c1 330318958 CUYMGTRGCXNLRX-WMLDXEAASA-N 383.414 5.417 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1cccc(OC(F)F)c1 409827709 JINPFRCHUWEXBX-UHFFFAOYSA-N 384.407 5.069 30 20 GKED Cc1coc(-c2cc(NC(=O)N[C@@H]3CCCc4cc(C#N)ccc43)ccc2C)n1 416924218 WNADSCKKUHQMPC-OAQYLSRUSA-N 386.455 5.029 30 20 GKED C=CCN(C(=O)c1oc(CC)cc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 428336129 HAROZWKERIVOSK-UHFFFAOYSA-N 397.456 5.015 30 20 GKED N#CCSc1cccc(C(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)c1 429829898 QWQMHKPBDKQBKG-QHCPKHFHSA-N 384.504 5.090 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1)c1ccccc1 431922920 BUKLOCQEOJICEK-YADHBBJMSA-N 379.479 5.401 30 20 GKED CC(=O)N(c1nc(COc2ccc(C#N)c(C)c2)cs1)c1ccc(C)cc1C 434648703 NNJKIWFMZVRIGD-UHFFFAOYSA-N 391.496 5.204 30 20 GKED Cc1cc(C)c(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(Br)c1 439478359 NYUZDIGBESWXAL-KRWDZBQOSA-N 386.293 5.233 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C 439508656 CLADYSVCQSHNOX-QWFCFKBJSA-N 393.556 5.881 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C1CC1 447523234 SVRSJWFAFHSWRR-IBGZPJMESA-N 399.475 5.058 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)[C@@]1(C#N)C[C@H]1C 450004783 SQRAHHWYRNVWOU-IQMFZBJNSA-N 390.462 5.220 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 454477916 DTHHZXFQHKJACX-KNBMTAEXSA-N 392.890 5.199 30 20 GKED C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1ccccc1Oc1ccccc1C#N 456116600 JBDFUJYQZFZLNT-ZBFHGGJFSA-N 388.389 5.154 30 20 GKED C[C@@H]1CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)[C@@H]1c1cccc(F)c1 458808623 ZGNNSOSGYCQVIV-WTNAPCKOSA-N 379.479 5.353 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3csc(-c4ccncc4)n3)c2)cc1 463396293 YJJRWXTXZLRLDR-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1c(C(=O)Nc2ccccc2OCC(F)(F)F)ccc(C(F)(F)F)c1F 467369551 ZIIHQBYSWJVXNZ-UHFFFAOYSA-N 395.274 5.346 30 20 GKED COc1ccc2c(c1)[C@@H](NCc1ccc(-c3ccccc3C#N)cc1)CCS2 467407117 LZWIVXKESBJXRF-QHCPKHFHSA-N 386.520 5.561 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CC[C@@H](Cc4ccccc4)C3)ccc21 468971090 LJHZVBFXQJGICD-RBBKRZOGSA-N 387.527 5.093 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc2sccc2c1 471230056 KSNAAMLPZROBTI-UHFFFAOYSA-N 385.448 5.521 30 20 GKED COc1c(CNCc2cccc(OCc3cccc(C#N)c3)c2)oc2ccccc12 474017346 RFWMFRUSCQTEKK-UHFFFAOYSA-N 398.462 5.182 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1CN1CCc2ccccc21)c1ccccc1 474955104 RBJKKRVKMDUEAH-QFIPXVFZSA-N 395.506 5.275 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1-c1nc2ccccc2[nH]1)c1ccccc1 475936204 FDLQRURTJBZJKF-GOSISDBHSA-N 380.451 5.256 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(-c2ncco2)ccc1C)c1ccc(F)c(F)c1 480929726 QCXVVSRRDAJJSI-LJQANCHMSA-N 383.398 5.367 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485824381 XEFXEVQVWWLNEZ-CQSZACIVSA-N 394.833 5.424 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)Nc3cccc(-c4ccccc4)c3)CC2)c1 495500117 UMLQFJIVVKSXCG-UHFFFAOYSA-N 397.478 5.301 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 497349196 BCQHVCILHTWBNO-UHFFFAOYSA-N 396.487 5.486 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)c1 499210868 LTHRXHBGZAWOMS-UHFFFAOYSA-N 379.419 5.345 30 20 GKED C=CCCc1ccccc1NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 500393805 CIWKIVCBCDWBOH-UHFFFAOYSA-N 395.503 5.698 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cccc(COC3CCCCC3)c2)cc1 502321469 YBXLUFDSIVYXEN-UHFFFAOYSA-N 394.540 5.279 30 20 GKED C=CCCc1ccccc1NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1 505060442 FOAVBDFQPMLQDB-LJQANCHMSA-N 377.532 5.152 30 20 GKED CCN(C(=O)c1cccc(C#N)c1C)[C@@H](c1ccc(Cl)cc1)c1cccnc1 509454131 MZAOOPXBPKJLAW-QFIPXVFZSA-N 389.886 5.167 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](Nc2ncc(C#N)cc2Cl)CCC3)cc1 513735139 JYEFILSLOVEZEN-INIZCTEOSA-N 396.903 5.228 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(C)c(Oc3ccncc3)c2)c1C#N 517547338 WATLBVWQPWRNIV-UHFFFAOYSA-N 377.469 5.239 30 20 GKED CC(C)[C@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 518885681 NNSMJPQYRFTZHN-TZIWHRDSSA-N 381.907 5.648 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1oc2ccc(OC)cc2c1C 520715906 AFVFMSRATNGYDV-HNNXBMFYSA-N 384.501 5.270 30 20 GKED CC(C)Sc1ccc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 521770951 ZPFVNMBXELRPLX-MRXNPFEDSA-N 379.312 5.489 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2ncc(-c3ccccc3)o2)n1 522856205 LKLITAAYYXUEAO-GFCCVEGCSA-N 389.402 5.789 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 523981733 KNVBYYMRZITHHC-CYBMUJFWSA-N 391.393 5.044 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F 525559396 OYUQVXAYPPIVEE-JKSUJKDBSA-N 380.419 5.307 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 531444297 KOHHAKVKNLGJBG-VLCRHTCISA-N 391.515 5.016 30 20 GKED CCN(C(=O)c1cnn(-c2ccc(Cl)cc2)c1C)c1ccc(C#N)c(Cl)c1 536972495 YFQXUMLUIQGFOK-UHFFFAOYSA-N 399.281 5.026 30 20 GKED Cc1csc([C@@H](C)CNC(=O)c2ccc(Sc3ccccc3C#N)cc2)n1 541652950 COOYRZNBLCFZGX-AWEZNQCLSA-N 393.537 5.008 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)[C@H](C)C1CCCCC1 542533683 XGLVMVKCBSAGHM-FGTMMUONSA-N 387.593 5.214 30 20 GKED C[C@H](NC(=O)N1CCc2sccc2C1)c1ccc(-c2cccc(C#N)c2)cc1 543016034 DJFIWVNPMSXGKW-INIZCTEOSA-N 387.508 5.116 30 20 GKED N#CCc1ccc(-c2nc(-c3cc(Cl)ccc3OCC(F)(F)F)no2)cc1 547171877 JAMOOXXSYYBOJB-UHFFFAOYSA-N 393.752 5.064 30 20 GKED COc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1F 553284480 WVCRSKFCFQRZRU-OAHLLOKOSA-N 381.291 5.246 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 559865635 SDVNOJIKYPMLPK-NBGIEHNGSA-N 384.523 6.448 30 20 GKED Cn1c(CN[C@@H](CCCC#N)c2ccccc2)nc2cc(C(F)(F)F)ccc21 561315371 SFWBYSUAXGTDSY-KRWDZBQOSA-N 386.421 5.117 30 20 GKED C[C@@H](Nc1cccc(Br)c1C#N)c1nc2ccccc2n1C(F)F 570893752 XAQOCTVIVMAJHC-SNVBAGLBSA-N 391.219 5.239 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c2[C@@H]1C 571170352 PBLRAIWHDAQKLB-CHWSQXEVSA-N 377.469 5.213 30 20 GKED C[C@H](N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccc(C#N)cc1 584861778 KYLCEVHFQKVTEI-RNODOKPDSA-N 394.316 5.530 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 588316061 FRSGDFVNKYANJV-QHCPKHFHSA-N 388.515 5.056 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC[C@H](c2ccccn2)C1 590564951 GVSCTJJUVUNONN-IBGZPJMESA-N 399.519 5.124 30 20 GKED Cc1sc(CC(=O)Nc2ccccc2SC[C@H](C)C#N)nc1-c1ccco1 602094836 GBISAOZWEGCBIB-CYBMUJFWSA-N 397.525 5.145 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)cn2)c1 603623660 LEXJSTXHBZELMB-RBUKOAKNSA-N 389.842 5.141 30 20 GKED COc1cc(C)sc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 603779750 INFPCQPLIZNFOC-SNVBAGLBSA-N 396.415 5.184 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cccc(Oc4ccc(C#N)cc4)c3)[nH]c12 605363076 GMYQGLJXQYQHEN-HXUWFJFHSA-N 392.418 5.025 30 20 GKED CCC[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608864418 IMCOVBNMAQWIOB-LJQANCHMSA-N 389.421 5.260 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 609031014 AJRNYCVEBLSACI-DOPJRALCSA-N 387.310 5.578 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)sc2c1CCCC2 609496350 MPWPQLIUNVOSCK-HUUCEWRRSA-N 390.430 5.260 30 20 GKED CCc1ccc([C@@H](C)CC(=O)NC2CCC(Oc3ccccc3C#N)CC2)cc1 609970793 JWDIMEKOEPYNHA-NWLLBJEDSA-N 390.527 5.121 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(OC3CCC3)c(F)c2)c(Cl)c1 611095057 PFVPSSIVTVUPGT-UHFFFAOYSA-N 379.218 5.188 30 20 GKED N#Cc1ccc(CSCc2ccc(C(F)(F)F)cn2)c(Br)c1 618113966 CPTOIQYIFKGIQG-UHFFFAOYSA-N 387.224 5.168 30 20 GKED N#CC(CCN1CCC(c2cccnc2)CC1)(c1ccccc1)c1ccccc1 618295037 MBWBQNJATNBXTE-UHFFFAOYSA-N 381.523 5.161 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1C 618349577 KNXXDAZAWMRCHP-UHFFFAOYSA-N 388.427 5.015 30 20 GKED CC(C)c1nnc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 647633772 BPRLEEWHZNHKEP-UHFFFAOYSA-N 385.283 5.095 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(SC2CCCC2)cc1 728698662 LZEINYIOWSSSHO-KTKRTIGZSA-N 380.435 5.376 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1 728870848 AEMQULMUCFIZEJ-UHFFFAOYSA-N 389.499 5.149 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccccc2SC[C@H](C)C#N)cc1 730955001 RGZWHPMCJRPOPY-OAHLLOKOSA-N 385.558 5.534 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)c1 733799739 DVNHEPCHDQIOCZ-FPOVZHCZSA-N 399.922 5.217 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1nc2ccccc2s1 734164096 JRGQIKMYYKROEH-KRWDZBQOSA-N 399.519 5.598 30 20 GKED N#CCOc1ccc(Cl)cc1COc1ccc2ccc(C(F)(F)F)nc2c1 735303574 WDYMSZQJCMSIHY-UHFFFAOYSA-N 392.764 5.388 30 20 GKED Clc1nc(N2CCCC2)sc1C=NN(Cc1ccccc1)c1ccccc1 735970934 LKCHGVONXIKORR-UHFFFAOYSA-N 396.947 5.437 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(OC)c(OCCCC#N)c2)oc2ccccc12 747361803 XSQKHRMHGVFVHZ-BENRWUELSA-N 389.451 5.582 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](Cc2ccccc2F)c2ccccc2)c1 760002308 XIJDYGQECUFQPB-WIOPSUGQSA-N 388.486 5.580 30 20 GKED N#C[C@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1ccc2ccccc2n1 760962798 CEBZQTKKFNDSNY-IBGZPJMESA-N 387.870 5.500 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2cccc(C#N)c2)C1 761783303 QKDCMDQQQWFEQP-JOCHJYFZSA-N 391.515 5.410 30 20 GKED C[C@@H](Oc1ccccc1C#N)c1nc(-c2ccc(SC(C)(C)C)cn2)no1 762404753 MPRNZFAQOCCXPR-CYBMUJFWSA-N 380.473 5.034 30 20 GKED CCCCCCCCC(=O)N1[C@H]2CCC[C@H]1CC(NC(=O)OC(C)(C)C)C2 769677174 WOENPSISGCNDBK-OALUTQOASA-N 380.573 5.174 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1ccc(C(F)(F)F)nc1Cl 772783461 FGVYTJNFKIJKLM-UHFFFAOYSA-N 386.654 5.164 30 20 GKED Cc1c(C(=O)/C=C/c2nc3ccc(Br)cc3s2)cnn1C(C)C 773148784 HVPPKMJVTADPGI-VOTSOKGWSA-N 390.306 5.041 30 20 GKED C[C@@H](Nc1cccc(COc2cccc(F)c2)c1)c1ccc(OCC#N)cc1 777640363 AGZKBCXATABXSW-QGZVFWFLSA-N 376.431 5.480 30 20 GKED CC(C)(C)c1ccc(C=Nn2c(S)nnc2CSc2ccccc2)s1 782240819 MYBWFXGPNQRQMD-UHFFFAOYSA-N 388.587 5.100 30 20 GKED CC(C)(C#N)CCCOC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 783864255 ILXIYXUCEOJXBU-UHFFFAOYSA-N 394.258 5.062 30 20 GKED CCC1(CC)Oc2ccc(NCc3ccc(OC)c(OCCCC#N)c3)cc2O1 786830438 CKNMPRONIOOZIO-UHFFFAOYSA-N 396.487 5.277 30 20 GKED C=CCC[C@H](C)OC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 786968232 AGIXITSDSYHGKD-LBPRGKRZSA-N 383.275 5.264 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)n1Cc1ccccc1 792098080 BAPDAFZVNVHVBP-QHCPKHFHSA-N 379.463 5.192 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc(C(=O)c2ccc(F)cc2)cc1)c1ccccc1 792866250 GYTUJYGTLRHTRN-HXUWFJFHSA-N 387.410 5.050 30 20 GKED CC(C)(Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797573076 OAIYPSDODBXQBH-CQSZACIVSA-N 376.909 5.128 30 20 GKED Cc1nc(NN=C2CCCC23CCOCC3)c2cc(-c3ccccc3)sc2n1 799867858 PIUFFCITIXZJJG-UHFFFAOYSA-N 392.528 5.415 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801656844 APEWZDOKWWAIHJ-SFHVURJKSA-N 378.369 5.026 30 20 GKED Cc1csc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2Cl)c1C#N 809003211 NNHXOIDEQYLFGD-UHFFFAOYSA-N 391.880 5.181 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(F)c(Br)c2)cc(Cl)c1OC 810248345 XCIAOQGWCHYHOM-UTCJRWHESA-N 399.643 5.155 30 20 GKED CC(C)(CC#N)COC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 810674717 ATMNJVITHIQIJZ-UHFFFAOYSA-N 394.899 5.363 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 811707621 FPNRDDDFJIHCOR-UHFFFAOYSA-N 378.432 5.002 30 20 GKED CCCCN(C)c1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 814633436 FLBHWQSDPBCGFL-JOCHJYFZSA-N 378.520 5.480 30 20 GKED N#C[C@@H](C(=O)CSC1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 835068378 GSLWOOBGBLVJQN-LBPRGKRZSA-N 383.325 5.189 30 20 GKED O=C(N[C@@H](c1ccccc1)C(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 857441577 QWZFFGFXEFKHKB-KBPBESRZSA-N 379.275 5.136 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSCc2ccc(F)cc2)cc1 915088426 QNYSWPQFZBFXDF-JOCHJYFZSA-N 390.483 5.353 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 915179160 AQCZNLJZSFUWCN-IBGZPJMESA-N 391.814 5.156 30 20 GKED O=C(/C=C\c1ccc(O)c(Br)c1)c1ccc(N2CCCCC2)cc1 916154724 QTLIRGPWPZDWBO-WMZJFQQLSA-N 386.289 5.041 30 20 GKED CC(C)Oc1cccc(CNCc2cccc(OCc3cccc(C#N)c3)c2)c1 916837181 KBVIQNURKSQKQT-UHFFFAOYSA-N 386.495 5.214 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc2ccccc2c(Cl)n1 917716527 HCPFKAFQFMSFOD-UHFFFAOYSA-N 389.867 5.741 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(-c3ccc(C(F)(F)F)cc3)n2)cc1 918714345 ZQHMEEPEKLNXGA-KTKRTIGZSA-N 384.382 5.597 30 20 GKED CC(=NNc1ncccc1Cl)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776036191 MEMCMMOLLHZGAM-UHFFFAOYSA-N 381.819 5.062 30 20 GKED Cc1c(NN=Cc2cc(F)ccc2Oc2cccc(Cl)c2)cccc1C(=O)O 1776088818 KHSWZPHGLVMDJT-UHFFFAOYSA-N 398.821 5.724 30 20 GKED O=C(O)c1ccccc1-c1ccc(/C=C/C(=O)c2cccc3ccccc23)cc1 1776114365 NLPPDRIXQCRPHR-SAPNQHFASA-N 378.427 6.101 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCC(C)(C)c1ccc(Br)cc1 1776782434 ZIJAEEROUDPELR-SFHVURJKSA-N 398.385 5.520 30 20 GKED CCc1cc(OC)ccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776963399 RQJUKLODNHEXHW-LUAWRHEFSA-N 376.408 5.112 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3C(=O)O)c2)o1 1776965937 IGFHRUDKSIHHPP-ZRDIBKRKSA-N 376.408 5.015 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1777372615 OBESNOWCLTWDLS-HADWXUJASA-N 388.419 5.112 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)s1 1777545332 JAZYFKLEHSCFDI-LUAWRHEFSA-N 394.496 5.404 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3nc4ccccc4s3)cc2)c1 1777650907 BJQWQPMDRQEOOL-JLHYYAGUSA-N 399.471 5.487 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3occc3C)cc2)CCC1 1788691303 PIFOPFNNTIEZKJ-HXUWFJFHSA-N 392.499 5.104 30 20 GKED C=CCn1c(SCc2nnc(-c3ccc(Cl)cc3)o2)nc2ccccc21 24786810 ZKSIKOBHIODYKU-UHFFFAOYSA-N 382.876 5.218 30 20 GKED N#Cc1ccc(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)cc1 26366438 HTSBJOVNXRETON-UHFFFAOYSA-N 388.279 5.165 30 20 GKED N#C[C@H](C(=O)c1sccc1Br)c1nc(-c2ccccc2)cs1 51534051 BINZWAGZWKCSLR-LLVKDONJSA-N 389.299 5.124 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955448 AIWITRCQLNHRJZ-KRWDZBQOSA-N 392.528 5.397 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)CC1 108528346 CJYCBVAMIWLUJD-QUCCMNQESA-N 393.556 5.740 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)c1 110310508 JBPVKMWUEFOEEQ-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 133043964 CLASIGYNQZDXHA-CQSZACIVSA-N 394.456 5.114 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1ccc(CCCc2ccccc2)cc1 134889663 PWHIRBIQDFAQGD-UHFFFAOYSA-N 398.510 5.205 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1)c1ccccc1 155813200 WMMYNQQPZVYXPB-QHCPKHFHSA-N 391.515 5.027 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2cccs2)C2CCCC2)ccc1OC 180809845 HIPHONGLDQPJRA-GCJKJVERSA-N 384.545 5.459 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1N1CCCCCC1 183626911 HJIKMEZIPOXASI-QGZVFWFLSA-N 378.476 5.002 30 20 GKED Cc1cc(Br)c(F)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 184819188 AZEVCZCNBOVZNU-INIZCTEOSA-N 390.256 5.063 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cs1 255063474 CBADUVCLVLHOQE-KTKRTIGZSA-N 390.464 5.311 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)c1ccc(C(C)(C)C#N)cc1 280450877 GETZNVCZFVRVGQ-UHFFFAOYSA-N 377.488 5.033 30 20 GKED Cc1cccc(C2(C/N=C(/O)[C@@H]3CCCO[C@H]3c3ccnn3C)CCCCC2)c1 328979772 DAGLCJRSVSMRTH-IFMALSPDSA-N 395.547 5.055 30 20 GKED CC(C)c1nc([C@H]2CCCCCN2C(O)=Nc2cccc3ccccc23)no1 329586225 YIBSGYFUULVNKV-LJQANCHMSA-N 378.476 5.509 30 20 GKED CC(C)c1cc(Br)ccc1N/C(O)=N/CC1CCC(C#N)CC1 331260784 BJKXEIHDWDEEQF-UHFFFAOYSA-N 378.314 5.228 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)Cc2ccccc2O1 432796237 FXWVEAKVNNGLHH-KRWDZBQOSA-N 399.450 5.166 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC(C)C)cc1Cl 445036088 CWLFTIRLVDRREX-UHFFFAOYSA-N 383.879 5.219 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C1CC1 455058619 RSONXGUORJNBCI-VQIMIIECSA-N 379.508 5.288 30 20 GKED COCc1cccc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)c1 460338706 LJPNVYLVEFRWHJ-UHFFFAOYSA-N 390.870 5.205 30 20 GKED CC(C)CN(C(=O)[C@H](C)c1ccc(Br)s1)c1ccc(C#N)cc1 463591751 QNZRHPQEVHKMPF-CYBMUJFWSA-N 391.334 5.175 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3cnccc23)cc1 465167696 IIHQVTGGLCMXOW-UHFFFAOYSA-N 395.418 5.160 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 467147749 KDRFQKYYTXETER-NSHDSACASA-N 397.784 5.466 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1cc(OC)ccc1Cl 473763316 SPQCUZMJEJFZLG-UHFFFAOYSA-N 379.909 5.001 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](OC)c1cccc(Cl)c1 475575535 RGWPADYTIWXVFJ-FQEVSTJZSA-N 386.923 5.701 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 475579589 WEINAPCJMLHXRT-IBGZPJMESA-N 399.538 6.483 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C)c(Oc2ccncc2)c1 476124059 SFJXRVAYPKNRQK-UHFFFAOYSA-N 386.495 6.287 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccccc1 487249050 GHWXWCRMBIIHIT-GGPKGHCWSA-N 387.310 5.648 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2cccc(C#N)c2)c1)c1ccccc1 487348409 XTUCARUKPVBPII-UHFFFAOYSA-N 375.859 5.100 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1 505058069 PGEOACOBGRZOJC-INIZCTEOSA-N 377.488 5.036 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2F)cc1Cl 510006340 PKRYGOBUGGMBKX-LJQANCHMSA-N 393.849 5.456 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3CCC(OC(F)F)CC3)cc2)c1 511729429 LSOCXQJMUBSYFI-UHFFFAOYSA-N 386.398 5.087 30 20 GKED N#CCC[C@@H](NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1)c1ccccc1 512045871 OOYVLOBVUUAMOL-HXUWFJFHSA-N 384.405 5.026 30 20 GKED CCn1c([C@@H]2CCCN2Cc2cccc(OCCCC#N)c2)nc2ccccc21 512589829 CFKJDKABWWTWQX-QHCPKHFHSA-N 388.515 5.076 30 20 GKED C=CC[C@H](C(=O)N(C)c1ncc2c(n1)-c1ccccc1SC2)c1ccccc1 514970204 SBGJDKFLCZIEGX-SFHVURJKSA-N 387.508 5.072 30 20 GKED C[C@H](Oc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 515241056 RZSNSRBNIBCDOV-HRAATJIYSA-N 390.870 5.401 30 20 GKED CCOc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1F 518388232 WNGLBJXGYRIQCW-UHFFFAOYSA-N 390.414 5.335 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1ccc2ccccc2c1 518753422 MZFHZFZFKYZDJU-KRWDZBQOSA-N 389.524 5.598 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 521932406 NHQNIQXBHASRSU-LJQANCHMSA-N 386.882 5.508 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2)n1 525327586 XCDQJVBZNNYLMA-HNNXBMFYSA-N 375.478 5.218 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)CCCC1 534595620 FGLKUYCJFJTPFF-UHFFFAOYSA-N 394.471 5.430 30 20 GKED Cc1nc(C)c(CNC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 536405492 LTHXGJBMDRHKGT-UHFFFAOYSA-N 397.887 5.007 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(CN3CCSCC3)c2)CC1 539936010 RLEWPXSTQHBIBA-UHFFFAOYSA-N 391.584 5.051 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 546085895 OBPUCSOEWUNSRV-UHFFFAOYSA-N 390.527 5.295 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC=C(c4ccco4)C3)cc2)cc1 557080734 SYRMOWONSPQQNK-UHFFFAOYSA-N 384.435 5.067 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 558852755 MPKHRVHAWXCCMA-UHFFFAOYSA-N 379.435 5.052 30 20 GKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc2cc(Br)ccc2o1 560263327 ZMPPRTWNPGFVPX-CYBMUJFWSA-N 381.273 5.407 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1 567385227 VQKDYRXJRNKTSX-IBGZPJMESA-N 386.948 5.620 30 20 GKED N#CCCCCCC(=O)N(c1cccc(Cl)c1)c1nc2ccccc2s1 588814383 GDANAECWOVNQMN-UHFFFAOYSA-N 383.904 6.088 30 20 GKED O=C(CSc1cccc(C(F)(F)F)c1)Nc1ccc(F)cc1C(F)(F)F 590254274 YUQNZDYEJXBKEE-UHFFFAOYSA-N 397.315 5.594 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)c1 608902188 IKUKTGGIZPJAGC-UHFFFAOYSA-N 391.471 5.069 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 608914830 BGVZHUPJBFBJHR-UHFFFAOYSA-N 377.488 5.322 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C2CC2)cc1Cl 609137792 ASMAVHRSOJMLDL-CTNGQTDRSA-N 379.891 5.402 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(Cl)c1 609438054 AJUBNLZDLRQKPP-RHSMWYFYSA-N 387.936 6.007 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c1 609933016 VVHZOIPZWMEZFW-ZDUSSCGKSA-N 393.434 5.404 30 20 GKED CC(C)(NC(=O)c1ccc(COc2ccccc2C#N)o1)c1cccc(Cl)c1 609976545 VBVGLUKZOIQQBH-UHFFFAOYSA-N 394.858 5.049 30 20 GKED Cc1ccc(SCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccccc2)cc1 609985721 KTJMKNNXUJBECY-UHFFFAOYSA-N 389.524 5.064 30 20 GKED N#Cc1cc(CSCc2coc(-c3ccc(C(F)(F)F)cc3)n2)ccn1 611113451 OLIZFVNVLXNHPF-UHFFFAOYSA-N 375.375 5.060 30 20 GKED CC[C@@H](C(=O)NCc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 619765804 IKXLISCFSLGBHL-MRXNPFEDSA-N 380.797 5.040 30 20 GKED CCc1onc(C)c1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494368 LQUOTLKKZPZCNL-UHFFFAOYSA-N 398.278 5.087 30 20 GKED Clc1ccc(-c2cnc(CON=Cc3ccc(Br)cc3)o2)cc1 727483901 UJQUMIZVLXSIMU-UHFFFAOYSA-N 391.652 5.308 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(O[C@H](C)C#N)cc2)c1 731298259 DVCKRGGEEJLQKZ-UZUQRXQVSA-N 383.451 5.057 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 732591277 TWASFBFTHKSVSP-FCHUYYIVSA-N 393.556 5.482 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Nc1ccc(OC2CCCC2)cc1 732915923 CLGWRBHWXKXIRN-QGZVFWFLSA-N 384.545 5.085 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 733637498 NYJSGGZXFNEHEK-UHFFFAOYSA-N 389.455 5.069 30 20 GKED C=CCc1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc(OC)c1O 734982125 XIBKWWNTEUCBNB-BJMVGYQFSA-N 376.424 5.340 30 20 GKED C[C@H](NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccs1 739438565 ZPXDABQJPCPALS-ZDUSSCGKSA-N 383.567 5.074 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F 740455480 SOVBNMZYQQHRKN-UHFFFAOYSA-N 379.476 5.383 30 20 GKED N#Cc1ccc(-c2cccc(CNC3CCN(Cc4ccccc4)CC3)c2)s1 742372213 UXIGIWHIJBZVLD-UHFFFAOYSA-N 387.552 5.041 30 20 GKED N#Cc1ccc(CN(C(=S)Nc2ccc(Cl)cc2Cl)C2CC2)cc1 745652834 GFWMFTZTGXWKNM-UHFFFAOYSA-N 376.312 5.226 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccccc1Cl)c1nc(-c2ccccc2)cs1 748003664 GHIYDZXOTGGVPU-INIZCTEOSA-N 396.899 5.499 30 20 GKED N#C[C@H](C(=O)CCCc1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 762037670 MKCTUXDVYSNWCS-QGZVFWFLSA-N 382.435 5.287 30 20 GKED COc1ccccc1CN(CCCCC(C)(C)C#N)c1ccc2nc(O)[nH]c2c1 769752462 OSMZRRWSWVLLLU-UHFFFAOYSA-N 392.503 5.004 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ncccc2C(F)(F)F)cc1 770645180 QEHSLNIIPCEOCM-KRWDZBQOSA-N 381.357 5.008 30 20 GKED N#CCCCn1cc(C(=O)Oc2ccccc2Oc2ccccn2)c2ccccc21 774064768 NUASXYHKGZTSNY-UHFFFAOYSA-N 397.434 5.352 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nnc(-c2cccc(Cl)c2)o1 795980958 AODLMWHDVINKSE-GDBMZVCRSA-N 395.846 5.082 30 20 GKED N#CCCCOc1cccc(CNc2ccc(OCC(F)(F)F)c(F)c2)c1 800290271 XBKGMCJHAHRPQI-UHFFFAOYSA-N 382.357 5.061 30 20 GKED Cn1cc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c(C(F)F)n1 812240970 YSMHATSVWWCIKV-RVDMUPIBSA-N 395.434 5.391 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1csc(C)n1 812393078 FLNGLIAWONETNC-UHFFFAOYSA-N 379.514 5.268 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)(F)F 815911456 BYVNVDRDVNDYAX-GZMMTYOYSA-N 389.254 5.584 30 20 GKED N#C[C@H](C(=O)[C@H]1CC[C@H]1c1ccc(Cl)cc1F)c1cc(C(F)(F)F)ccn1 835455454 NBYRTHLTZQJLHO-QEJZJMRPSA-N 396.771 5.263 30 20 GKED CCCCCCCCCC(=O)N1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 837773625 MFJUVCGGYJBQCB-QGZVFWFLSA-N 377.491 5.335 30 20 GKED N#C[C@H]1CCC[C@H](OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)C1 839048259 CMYATEBYFSBJTD-FZMZJTMJSA-N 380.391 5.068 30 20 GKED C=CCCC[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C(=O)O 900068520 JYNBIASIGPAWHM-CQSZACIVSA-N 385.316 5.016 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cccc(O)c1 916155786 ZZYPBGQVTKNHSV-GHXNOFRVSA-N 377.827 5.194 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(C)n(C3CCCCC3)c2C)cc1 916914405 ZJGFABROQMWAGD-QFIPXVFZSA-N 391.515 5.134 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccc(Cl)s2)cc1 916915856 QMVBNQVFSWSZQQ-CCCPALQASA-N 386.904 5.105 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(C=NOCc2ccccc2)cs1 917546460 YXLHRKZYAZPFOJ-UHFFFAOYSA-N 385.876 5.032 30 20 GKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140624 ALPLBVXRHDVLDV-WOJBJXKFSA-N 390.508 5.579 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(C1)CC(F)(F)C2(F)F 931063293 XCOYPXWVIIUEBN-GOSISDBHSA-N 384.417 5.437 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(C)=NNc2ccc(C(=O)O)cc2)cc1 1776012022 RGDARQBTVZGXCX-GOSISDBHSA-N 382.504 5.816 30 20 GKED Cc1cc2ccccc2nc1NN=Cc1ccc(-c2cccc(C(=O)O)c2)s1 1776052877 ZVJWCAZQOYUPED-UHFFFAOYSA-N 387.464 5.416 30 20 GKED C[C@@H]1C/C(=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776589758 WFLHKILMDDXWBP-MWXDNJBGSA-N 398.458 5.665 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CCc2ccccc2)CC(=O)O)c1 1776787237 GCEXSOOHMOUJGE-QHCPKHFHSA-N 397.559 5.602 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](CC2CCCC2)C(=O)O)c1 1776788743 VYTWRWSIXGYAPE-OAQYLSRUSA-N 375.553 5.407 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1N1CCCC1 66954534 HSSBVPCLAVYTTA-KRWDZBQOSA-N 394.544 5.003 30 20 GKED C=CCn1c(S[C@@H](C)c2ccncc2)nc2sc3c(c2c1=O)CC[C@@H](C)C3 72033789 ABFJURVEOZOMAK-KGLIPLIRSA-N 397.569 5.017 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccccc3)cc2)cc1 104862142 CWTDVIJVKUHMIB-UHFFFAOYSA-N 386.451 5.438 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 120038586 BQUIHQWZXOLFGO-OAHLLOKOSA-N 397.887 5.034 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1cncs1)C(=O)c1ccccc1 129980160 XTUPQXOVHFAADM-DEDYPNTBSA-N 390.508 5.173 30 20 GKED CC[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1nccs1 130406473 VZKQIYMWBXPOAC-GOSISDBHSA-N 393.537 5.188 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2csc(COc3ccc(Cl)cc3)n2)s1 134504578 HYSNEJGAPJKVCD-XVNBXDOJSA-N 386.885 5.205 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CCO[C@@H](c3ccccc3)C2)c1 157312604 VKLQHBZNPYPUGH-AZGAKELHSA-N 398.506 5.147 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cn2cc(Cl)cc(Cl)c2n1 177235617 VZNXHVCKEDRLEW-GFCCVEGCSA-N 391.327 5.505 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccccc1F 182222656 VOAZBRLFMDEBKU-ZDUSSCGKSA-N 380.448 5.265 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)Cc1ccsc1 188911980 BYDPRIMNVVZLRW-HZPDHXFCSA-N 387.574 5.485 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1 193883869 SZFBEWFHAHTKAX-NRFANRHFSA-N 391.559 5.182 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1(c2cncc(Br)c2)CC1 282160922 IKUBEZYGPKQUES-UHFFFAOYSA-N 399.332 5.366 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2csc(-c3ccoc3)n2)c1 303256772 DIRHAFSHEYEVFS-UHFFFAOYSA-N 390.489 5.293 30 20 GKED O/C(=N/C[C@@H]1CCOc2ccccc21)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329354873 GNNCDPVKWGSHBE-MOPGFXCFSA-N 393.531 5.016 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)Nc1ccc(-c2ncco2)cc1 329507672 LWWQNJYFMXODOB-LJQANCHMSA-N 391.475 5.057 30 20 GKED Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1N=C(O)c1cccnc1C1CC1 329608056 BMBVQZGLDZMGAX-IYBDPMFKSA-N 391.515 5.022 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 409472684 ZAYJOTAKSQMYSW-ROUUACIJSA-N 387.310 5.406 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 410974322 XRIVUCOSWHMNQU-CVEARBPZSA-N 378.781 5.167 30 20 GKED C=CCn1cc(CN[C@H](C)c2ccc(-c3ccc(C(F)(F)F)cc3)s2)nn1 424292811 HMSHVMQBJSAMGM-CYBMUJFWSA-N 392.450 5.062 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1ccc(C#N)cc1Cl 426147854 FJTGWXKTMNGMBW-CYBMUJFWSA-N 396.903 5.526 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc4c(F)cccc4c3)n2)cc1 429679208 FETPBBWZYSYINJ-QGZVFWFLSA-N 387.439 5.296 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430638875 GKMMFKJGFJYUIB-HNNXBMFYSA-N 398.919 5.078 30 20 GKED CCOc1ccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)co2)cc1 433027485 LFTAIPXOHVBBTR-QFIPXVFZSA-N 375.472 5.265 30 20 GKED CSc1c(F)cccc1C(=O)NCc1ccc(-c2ccccc2C#N)cc1 436157212 WMTUGUUYXYNRSS-UHFFFAOYSA-N 376.456 5.016 30 20 GKED C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438039332 FIQNUPLPKIQXHO-HOYKHHGWSA-N 399.469 5.236 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H](C)c1ccc(F)cc1F 438046144 WNHDFBDRZJBZFS-UONOGXRCSA-N 389.471 5.142 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)cc2)cs1 442037236 XAIOTEKJOAEQCC-HNNXBMFYSA-N 387.386 5.022 30 20 GKED CC(C)(C)C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)C(F)(F)F 444267326 HHXXQGBVVWYIQT-QGZVFWFLSA-N 379.426 5.042 30 20 GKED C=CCC1(C(=O)Nc2ccc(C)c(NC(=O)c3ccncc3)c2)CCCCC1 448815014 YZNJCTHSCYFXBI-UHFFFAOYSA-N 377.488 5.107 30 20 GKED Cc1cc(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c(C(F)(F)F)o1 472353462 RGMVHFOHLKEKKB-GFCCVEGCSA-N 383.263 5.169 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)cc1F 479480565 DSBLJKVEOPZUNW-XMMPIXPASA-N 399.469 5.287 30 20 GKED C=CCOCCCS[C@@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 479599018 FIFDVGYMOQMGSP-LBPRGKRZSA-N 376.503 5.044 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@H](CCC#N)c2ccccc2)s1 480007667 ULJYLQZUGKRUCW-LJQANCHMSA-N 375.497 5.202 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 480354655 HKRXMYHDXGBCKE-BLLLJJGKSA-N 395.812 5.315 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)[C@@H]1CCC(F)(F)C1 483622958 WAINFHTZBTVUCV-MRVPVSSYSA-N 391.258 5.020 30 20 GKED CC1(C)Oc2ccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)cc2O1 484655829 PUIKDPSPGALWEZ-UHFFFAOYSA-N 386.407 5.110 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(Br)c1COC 485411390 KDRRKPYWUCXVTA-UHFFFAOYSA-N 395.341 5.196 30 20 GKED N#CCCC[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccccc1 487511351 DEEOAVQZUZYVGR-QFIPXVFZSA-N 384.483 5.110 30 20 GKED N#Cc1cc(NC(=O)c2cnc(-c3ccncc3)s2)ccc1Oc1ccccc1 490480466 OKSFOIHVXVWGSU-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)N2CCC(C)(C#N)CC2)c1 506300562 SHWUANUHBKKWBO-UHFFFAOYSA-N 383.879 5.598 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@@H](C)c2cc(C)sc2C)cc1 510723285 ZEODYOFKTDJAAZ-INIZCTEOSA-N 397.544 5.062 30 20 GKED CCn1c(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc2ccccc21 511916480 MRWWOHOFUUZOSU-UHFFFAOYSA-N 396.450 5.281 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3sc4c(c3C#N)CCCCC4)on2)cc1 512142418 KHMRBNLHPVNBBL-UHFFFAOYSA-N 377.469 5.104 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)sc2ccc(C#N)cc12 519843831 TXKDMIFWDWDPFQ-CYBMUJFWSA-N 391.521 5.728 30 20 GKED C=CCCC(=O)Nc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)ccc1C 522530693 QODGQMZKGVPGEE-UHFFFAOYSA-N 376.378 5.171 30 20 GKED CC1CCN(c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)CC1 525343037 HQSUINLXPUCWNK-UHFFFAOYSA-N 390.531 5.237 30 20 GKED C=CCN(C(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1)C1CC1 540109898 ABUZICDOFJHIQW-HXUWFJFHSA-N 388.483 5.136 30 20 GKED C[C@H](NC(=O)N(C)CCc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541158534 GUEOFXDGMPWMDC-KRWDZBQOSA-N 389.524 5.232 30 20 GKED CCc1ncsc1NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542964160 HAIFUAWHQAMWHB-AWEZNQCLSA-N 376.485 5.127 30 20 GKED COc1cc(C#N)ccc1CN[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 543520266 WKIYHDUGSDAKRZ-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED C=CCOc1c(Br)cc(CNc2cccc3cc[nH]c23)cc1OC 547497848 AFOUUFQGSYSALA-UHFFFAOYSA-N 387.277 5.116 30 20 GKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(SCC(F)(F)F)cc1 551557941 CPUCMTMQVAGWTC-CQSZACIVSA-N 376.447 5.553 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC1(c2cccc(C#N)c2)CC1 551812545 UZBWUCVWMZYNJN-OAHLLOKOSA-N 393.943 5.984 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 553311160 WAXVXCLTYKVEPI-XMMPIXPASA-N 397.478 6.028 30 20 GKED C=CCn1c(SCc2ccc(Cl)cn2)nnc1-c1cccc(Cl)c1 554426212 JLKLNWBGHCQCOR-UHFFFAOYSA-N 377.300 5.125 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@H]3C3CCCCC3)cc2)ccn1 568144260 ASOUMDRTQBDGJR-QFIPXVFZSA-N 390.487 5.322 30 20 GKED COc1ccc([C@H](CCC#N)Nc2ccc(-c3cn4ccccc4n3)cc2)cc1 570010427 CUYDDCFXLAPPMW-QFIPXVFZSA-N 382.467 5.467 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c2[C@@H]1C 571170354 PBLRAIWHDAQKLB-QWHCGFSZSA-N 377.469 5.213 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1[C@H]2CC[C@H]1c1ccccc12 578941076 VGXNKTLPJWNYEU-ZEQRLZLVSA-N 395.462 6.083 30 20 GKED C=CCCC(=O)NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12 588017150 FALURYWHDZGIPP-KRWDZBQOSA-N 387.310 5.689 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C)sc2c1 591019462 RJOMCZIAWZSREI-CYBMUJFWSA-N 379.872 5.240 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cc(F)c(F)c(F)c1F 591781349 RYMVIJZURILQOE-UHFFFAOYSA-N 387.201 5.149 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)N3Cc4cccc(C#N)c4C3)c2)C1 593150317 CDXJKGWOYCIIBE-HTAPYJJXSA-N 389.499 5.201 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1csc(-c2ccoc2)n1 594408133 FEAIKPLHCRLCDE-UHFFFAOYSA-N 394.525 5.064 30 20 GKED CCCCSc1ccc(C(=O)N2CCC[C@H](CC#N)C2)cc1C(F)(F)F 597904216 FNGFIJDIJCKLCL-CQSZACIVSA-N 384.467 5.363 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 598838166 KKNQFAAZJQLJOW-QGZVFWFLSA-N 396.359 5.506 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1cccnc1C(F)(F)F 599440405 SETGDBXKOVIMQI-LBPRGKRZSA-N 387.327 5.033 30 20 GKED Cc1ccc(CCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c(C)c1 603739108 RFYGXFYNKYGJMO-UHFFFAOYSA-N 385.467 5.242 30 20 GKED N#CCn1c(C(=O)N(Cc2cccs2)Cc2cccs2)cc2ccccc21 609163145 USSPLAHZMKLKET-UHFFFAOYSA-N 391.521 5.130 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cc2occc2s1 609858941 UWUJYHUOBCWUFE-UHFFFAOYSA-N 396.415 5.771 30 20 GKED CC[C@](C)(NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc(C)cs1 610184759 KUQFOTXYGGFOCG-QFIPXVFZSA-N 391.496 5.171 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1)c1cccc(C#N)c1 610406697 JDSJIVNJBHOYRF-CYBMUJFWSA-N 388.298 5.300 30 20 GKED Cc1cc(F)c(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1F 610706153 AARWQGUVNISYOV-UHFFFAOYSA-N 392.405 5.171 30 20 GKED C[C@@H]1CCc2c(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)csc2C1 613392141 JQOQRXXAXQLNCM-CJNGLKHVSA-N 378.522 5.486 30 20 GKED N#CC[C@H](CC(=O)Nc1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 619516313 OOWGAIWYAUDAFC-CYBMUJFWSA-N 389.402 5.341 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(C(F)(F)F)ccc1F 622278776 LRKLLLCFYRRGKX-UHFFFAOYSA-N 379.275 5.136 30 20 GKED Fc1cc(-c2ccncc2)ccc1CN1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 678297601 NCGKXGLASBBXML-GASCZTMLSA-N 392.318 5.060 30 20 GKED Cc1ccc(-c2cc(C(=O)N(C)c3ccc(C#N)cc3F)c3ccccc3n2)cc1 726367370 BKXUZZLQFGPOBC-UHFFFAOYSA-N 395.437 5.498 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1sc2ccc(F)cc2c1C 726755828 JCEGFFPKVMPZKF-UHFFFAOYSA-N 389.455 5.098 30 20 GKED C=CCn1c(-c2ccc(C(C)(C)C)cc2)nn(CN(CC)C[C@@H](C)C#N)c1=S 726964009 QYWZYCKYJKQTRS-KRWDZBQOSA-N 397.592 5.004 30 20 GKED CC(=NNc1ccc(Br)cn1)c1cc(F)c(Cl)cc1Cl 727266181 LQJKKPLCFTUNOP-UHFFFAOYSA-N 377.044 5.126 30 20 GKED CC(=NNc1ncnc2sccc12)c1ccc(OCc2ccc(F)cc2)cc1 727684266 WEUQDQJZRQDSOW-UHFFFAOYSA-N 392.459 5.246 30 20 GKED COc1ccc(-c2nc3c(s2)C(=NNc2ncccc2Cl)CCC3)cc1 727778489 JVUYAHNQPJUEMA-UHFFFAOYSA-N 384.892 5.020 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)N[C@@H]1CCCC[C@H]1C 727978216 CMWQWNJXHYIUFA-IIBYNOLFSA-N 393.556 5.311 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)cc2)co1 728463349 MCMMEBJNAMSGNL-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C=CCn1c(C2CC2)nn(CNC(CC)(CC)c2ccc(Cl)cc2)c1=S 728900918 XGKLPVGEJRCUNK-UHFFFAOYSA-N 390.984 5.393 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 729070532 XCHXYEHTVZUIQD-XJKSGUPXSA-N 389.282 5.225 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(C)c3)cc2C)c1 729821493 QBIZYXCDQDOMEJ-UHFFFAOYSA-N 386.520 5.673 30 20 GKED CCc1ccccc1O[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1ccccc1 730690270 QZZIZPSJBSUWKT-NTKDMRAZSA-N 396.446 5.387 30 20 GKED C[C@@H](SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1 731939480 MCXLKSHRYBJAFU-KDOFPFPSSA-N 396.512 5.620 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1oc2ccccc2c1C)C(C)C)c1ccncc1 734668517 IPHGKSGSDXBWNY-CTNGQTDRSA-N 377.488 5.450 30 20 GKED C[C@@H](CNC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)C(C)(C)C 734674990 SAVCVQZVQLHNFD-KRWDZBQOSA-N 381.495 5.091 30 20 GKED C=CCNC(=S)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 741859785 DTZFJTNMKPCFBY-UHFFFAOYSA-N 382.508 5.204 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2cccc(CC(F)(F)F)c2)cc1OC 742826444 HOEQGIZVBMWELK-NTMALXAHSA-N 391.389 5.017 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744034544 AZGZNMKMEQJPFE-WBMJQRKESA-N 386.879 5.534 30 20 GKED C#CCCCNC(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 745902021 XCJLMGFEIVVBTF-UHFFFAOYSA-N 390.405 5.053 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748618613 KIPZTUMTRVNZLJ-HSZRJFAPSA-N 384.479 5.310 30 20 GKED Cc1cc(CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)ccc1Br 751824882 CUFBRFYPQPFJQO-QGZVFWFLSA-N 393.284 5.115 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCC1CCC(C#N)CC1 755972414 GUCDCHNOIIIHMQ-WLYUNCDWSA-N 388.920 5.242 30 20 GKED CC(=NNc1cncc(Br)c1)[C@H](C)c1nc2ccccc2s1 758123771 XFLDGTNBPOROPP-JTQLQIEISA-N 375.295 5.045 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(Cl)c(O)c(Cl)c1 767160899 CKXOJFKWJSCXBV-UHFFFAOYSA-N 383.234 5.490 30 20 GKED C[C@@H](CSCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 772981356 VXVIMIXCCBTDTG-XJKSGUPXSA-N 384.501 5.181 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3ccc(C(C)C)cc32)c1 772982317 CRJIIUQTYNLIIP-NZQKXSOJSA-N 378.516 5.494 30 20 GKED N#CCc1ccccc1CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 776959462 ZWLSQIDNKDSMLV-UHFFFAOYSA-N 399.881 5.054 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cccc(F)c1Sc1ccccc1 781171304 SKJQDXJPYCCYAN-OAHLLOKOSA-N 392.455 5.520 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 789400000 QFEJTIZVRXEVIR-CRAIPNDOSA-N 378.497 5.455 30 20 GKED C=C(C)Cn1c(S[C@@H]2CCc3cc(Cl)ccc32)nnc1-c1ccncc1 795221697 GNAMRPIPUCWSFT-GOSISDBHSA-N 382.920 5.349 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571005 MUFZHGJFFNUPJZ-OCCSQVGLSA-N 376.909 5.128 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCC(=O)c2ccc3c(c2)CCCC3)s1 797573429 SGDFKRRPMGPYSM-SFHVURJKSA-N 394.540 5.159 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801672867 VRVCRHDUDZZKQA-CYBMUJFWSA-N 383.238 5.513 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cc(Cl)c(O)cc1F 805260413 SVWYRXXCNQFRTD-UHFFFAOYSA-N 382.778 5.101 30 20 GKED CCN(c1ccc(NC(=O)Nc2ccccc2SCCC#N)cc1)C(C)C 809277794 ATNXQWCTXPLMCB-UHFFFAOYSA-N 382.533 5.571 30 20 GKED N#C[C@H](C(=O)Cc1c[nH]c2cccc(Cl)c12)c1nc(-c2ccccc2)cs1 815912280 GPYTXCKMMLIILJ-OAHLLOKOSA-N 391.883 5.364 30 20 GKED Cc1cc(Cl)ccc1C1=CCN(C(=O)Nc2ccccc2O[C@@H](C)C#N)CC1 860897028 JOAHZCIZQWTFGD-INIZCTEOSA-N 395.890 5.261 30 20 GKED CNC(=O)c1ccc(/C=C/C(=O)c2ccc(-c3ccc(Cl)cc3)s2)cc1 912859379 PEOCDJGIBFBVOZ-NYYWCZLTSA-N 381.884 5.324 30 20 GKED CCc1nc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 920278907 CXPZQCGVSQCDLH-HXUWFJFHSA-N 390.512 5.025 30 20 GKED COc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 920805085 GOJQUAAVLDMISG-SWLSCSKDSA-N 398.434 5.077 30 20 GKED Cc1cc(Oc2cc(Cl)ccc2C=NNc2ccc(C(=O)O)cc2)ccc1F 1776012275 MUDJQNSQDKKZFZ-UHFFFAOYSA-N 398.821 5.724 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)s1 1776339834 FPXJLIHVGBSBLO-DAXSKMNVSA-N 393.302 5.303 30 20 GKED Cc1ccccc1C(=O)/C(=C\c1csc2ccc(C(=O)O)cc12)c1ncc[nH]1 1777465124 KELMMOQSMQUSGC-WOJGMQOQSA-N 388.448 5.055 30 20 GKED Cc1ccccc1-n1c(SCCC#N)nnc1-c1ccc(Cl)cc1Cl 5355765 VCEFAUXGDXBZLQ-UHFFFAOYSA-N 389.311 5.555 30 20 GKED CCCN/C(S)=C(/C(=O)c1ccc(C)s1)[n+]1ccc(C(CC)CC)cc1 22805565 KPYVOUHJHKCZMR-UHFFFAOYSA-O 389.610 5.186 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3ccc(C(C)(C)C#N)cc3)cs2)cc1 26036869 ANWKRZHMLSDXQA-UHFFFAOYSA-N 389.524 5.355 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)oc2ccc(Cl)cc12 41558237 VGCGSFWWLWRCQX-CYBMUJFWSA-N 399.784 5.630 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc2ccccc2n1C(F)F 41558281 ZIKOTLODDGWNOY-CYBMUJFWSA-N 395.340 5.321 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1OC 47376790 ZWWMVHDDHGARQR-INIZCTEOSA-N 394.858 5.176 30 20 GKED CCCN(C(=O)Nc1cccc(C#N)c1)[C@H](C)c1ccccc1Br 71972768 XHQYYXZLUVJMBJ-CQSZACIVSA-N 386.293 5.326 30 20 GKED CCc1nc([C@H](C)NCc2cccc(OCc3ccccc3C#N)c2)cs1 111407353 ONQDFJCHEHRGDF-INIZCTEOSA-N 377.513 5.007 30 20 GKED C#CCCOc1ccc(CNc2cccc(C[S@](=O)c3ccccc3)c2)cc1 133230597 CSPFCQDILXUKLX-MUUNZHRXSA-N 389.520 5.009 30 20 GKED N#Cc1cn(CCCOc2cccc3ccccc23)c2ccc(Cl)cc2c1=O 133525569 HMKSRXKMKQWUPE-UHFFFAOYSA-N 388.854 5.149 30 20 GKED C=CCN(CCc1ccccc1)Cc1csc(N(C(C)=O)c2ccccc2)n1 165044794 QZVVHZWFJICIBZ-UHFFFAOYSA-N 391.540 5.058 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc(Cl)c2O)cc1 172357631 VATGEGMAFSJSHV-UHFFFAOYSA-N 394.883 5.462 30 20 GKED COc1cc([C@H](C)NCc2ccc(F)c(C#N)c2)ccc1OCc1ccccc1 179709038 CENGYZKTOOLHNG-KRWDZBQOSA-N 390.458 5.136 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 191518468 VFBAINMAJAJYHK-IRLDBZIGSA-N 378.516 5.580 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(F)cc2)n1)c1ccccc1 191972186 YFEPRZFQMUIRPQ-UHFFFAOYSA-N 381.476 5.159 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1 288672435 CFKIIXCZVHSSDS-KFWWJZLASA-N 399.482 5.523 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(C)cs1 303357417 PCZASDLFWGTJQY-LJQANCHMSA-N 392.484 5.388 30 20 GKED O/C(Cc1cccc2ccccc12)=N/C1CCN(/C(O)=N\C2CCCCC2)CC1 328904683 AHBYZZWWGONKPP-UHFFFAOYSA-N 393.531 5.050 30 20 GKED CC[C@@H]1C[C@H](C(O)=Nc2cc(Cl)ccc2OC[C@H]2CCCCO2)CC(O)=N1 330271550 WCHVGTSRXCMVPL-NUEKZKHPSA-N 394.899 5.021 30 20 GKED COC(=O)[C@H](C)c1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 416822623 XKGZJYQFTOQZKT-HUUCEWRRSA-N 397.500 5.001 30 20 GKED COc1ccccc1-c1nnc(S[C@H]2CC[C@H](C#N)C2)n1-c1ccc(C)cc1 430145839 KAGWQHZHNXJYHJ-WMZOPIPTSA-N 390.512 5.036 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 438845968 GPURGGUVPHQUGU-FZKQIMNGSA-N 376.287 5.399 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(Cl)c(Cl)cc1F 439967889 PLEHLSOZCFWVIA-FZKQIMNGSA-N 392.261 5.436 30 20 GKED C=CCOCCCC(=O)Nc1nc(-c2cc(Cl)sc2Cl)cs1 443850262 FPZRFUCZKRBFCZ-UHFFFAOYSA-N 377.318 5.100 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2noc(-c3ccsc3)n2)cc1F 444401128 VJGDVALAQVALEZ-UHFFFAOYSA-N 392.415 5.213 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccco1 454752167 LEVKDKJCZBSGAH-BEFAXECRSA-N 381.501 5.290 30 20 GKED C[C@H](C(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462200220 FSRISFBXAVDKAY-YWZLYKJASA-N 386.417 5.434 30 20 GKED COc1ccccc1-c1nc(CN2CCC[C@H]2[C@@H](C#N)c2ccccc2)cs1 464824157 ULQMFWDUXCDXGJ-SFTDATJTSA-N 389.524 5.090 30 20 GKED Cc1nc(-c2cccc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)c2)cs1 464944924 ZAZVPWJOKYCOHU-IFMALSPDSA-N 387.508 5.031 30 20 GKED C=C[C@@H](C)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 465145571 LNLQXIZOSPYTTL-LLVKDONJSA-N 396.390 5.069 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3C[C@H](c4ccccc4)[C@@H]4CCCC[C@H]43)on2)c1 469335186 ORJHLGNWLKKRDB-QZNHQXDQSA-N 397.478 5.012 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1 475115987 WXNJUBUBLNAMDZ-HNNXBMFYSA-N 389.524 5.411 30 20 GKED C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1C(=O)C[C@H](CC#N)c1ccccc1 476342209 NMNXESPYUCGDND-ZBFHGGJFSA-N 387.310 5.527 30 20 GKED C[C@@H]1CCC[C@H](N(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 481621609 HRRRCBGRXOBGBM-UZLBHIALSA-N 395.478 5.319 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 487600852 HAJXBNYADAIFMA-ZWOKBUDYSA-N 387.310 5.648 30 20 GKED C=CCN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 497541744 OGTFPIQNNRGZPO-ROUUACIJSA-N 396.462 5.411 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 498447938 GWASNALWQVDMJG-VQTJNVASSA-N 386.417 5.119 30 20 GKED COc1cc(C#N)ccc1CNc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 500876171 MHGYJJNMZWQJMT-UHFFFAOYSA-N 399.372 5.385 30 20 GKED COc1ccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c(C(F)(F)F)c1 503057175 IUZGRZBBMKFKLO-UHFFFAOYSA-N 390.386 5.361 30 20 GKED C=CCCc1ccccc1NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 504277021 MZDRBYIMUCHMQO-FQEVSTJZSA-N 377.532 5.251 30 20 GKED CCc1ccc(N(C(C)=O)c2nc(CSc3ccc(C#N)cc3)cs2)cc1 509662490 CBJGQCBZXVDJDX-UHFFFAOYSA-N 393.537 5.554 30 20 GKED CC(C)(C)n1cc(C#N)c(NC(=O)CCCCc2ccc(Cl)c(Cl)c2)n1 510381359 XCCSXZHKWKXYPP-UHFFFAOYSA-N 393.318 5.168 30 20 GKED CCc1ccc2occ(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c2c1 513659872 DULVJLVOYVGSFR-AWEZNQCLSA-N 379.366 5.230 30 20 GKED C=CCCO[C@@H](C)C(=O)N(c1cccc(Cl)c1)c1nc2ccccc2s1 519070227 VZAUFWYRVUTHTD-AWEZNQCLSA-N 386.904 5.596 30 20 GKED CC[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc(C)cs1 519193068 YIMIFKJMJIXNGC-IBGZPJMESA-N 392.484 5.388 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccccc1)c1ccc(F)cc1 520132004 BONMQNIFGMRSOS-XMMPIXPASA-N 399.469 5.185 30 20 GKED C=CCN(C(=O)c1cccc(OC2CCCC2)c1)c1nc2c(s1)CCCC2 521262772 QGGJMEUXQHMXDO-UHFFFAOYSA-N 382.529 5.176 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccs1 523101737 YQTQEEYXUSVNEQ-ZDUSSCGKSA-N 382.872 5.808 30 20 GKED N#Cc1ccc(C2(NCc3ccc(F)c(-c4cccs4)c3)CCOCC2)cc1 527811776 NLRZZSQYJZKGPQ-UHFFFAOYSA-N 392.499 5.221 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(CC#N)cc2)cc1Cl)c1ccccc1 533907988 XDNYDSZTQVAOPB-MRXNPFEDSA-N 389.886 5.831 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1)c1ccccc1 534625536 JOROROGWZIWTEO-INIZCTEOSA-N 384.907 5.024 30 20 GKED C=C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1OCCOC)c1ccccc1 536087754 IJIVYZGNXJTYGJ-OAHLLOKOSA-N 393.405 5.029 30 20 GKED C=CCCOCCCCC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 537319119 RZCUMRVGZHOFRX-UHFFFAOYSA-N 380.513 5.087 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCOc2cc(Cl)ccc21 539476727 OBVNNZGDJUEMBI-FQEVSTJZSA-N 397.906 5.046 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](N[C@@H](C)c2cccc(C#N)c2)CCC3)cc1 539495148 FSVZRJYAYIQCFF-MGPUTAFESA-N 389.524 5.419 30 20 GKED CN(C(=O)c1oc2ccccc2c1CSCc1ccccc1)C1(C#N)CCC1 542894234 FWORYVPDOFNDRK-UHFFFAOYSA-N 390.508 5.384 30 20 GKED CCCc1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)co1 544738016 SHMXGVLHETVTAD-KRWDZBQOSA-N 379.847 5.188 30 20 GKED O=C(Nc1cccc(NCC(F)(F)F)c1)c1ccc(F)c(C(F)(F)F)c1 547750871 ZGQXPHIMOCTZDL-UHFFFAOYSA-N 380.263 5.071 30 20 GKED N#CCCN(C(=O)C1CC(c2cccc(F)c2)C1)C12CC3CC(CC(C3)C1)C2 548601994 QRFREDULONMCHL-UHFFFAOYSA-N 380.507 5.030 30 20 GKED N#CCCN(C(=O)c1cc2sc3ccccc3c2s1)c1ccc(F)cc1 561917855 GMDWLXFZIDUKBF-UHFFFAOYSA-N 380.469 5.816 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2cccc(F)c2F)CC1 564622978 PCZVXVYMGHHXNS-UHFFFAOYSA-N 398.497 6.228 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1O[C@H](C)C(F)(F)F 565798610 GPKTVPZISXIFMV-OAHLLOKOSA-N 378.394 5.236 30 20 GKED COCCSc1ccc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)cc1 565865914 OAVMPLBSGLWKTF-AWEZNQCLSA-N 394.462 5.166 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1 570939999 AKNMIPVPOLVOJO-UHFFFAOYSA-N 386.542 5.110 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 582444769 ROSNFMRQYBUDLS-QGZVFWFLSA-N 399.368 5.487 30 20 GKED C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 588438934 RQVJMBISXBMLDD-SEWDUPMJSA-N 381.457 5.031 30 20 GKED N#Cc1cc(NC(=O)N2CCC3(CC2)CC3(F)F)ccc1Oc1ccccc1 593183834 LFHYUJOYMWDLMR-UHFFFAOYSA-N 383.398 5.004 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)cc1 609105017 IHWRVQOGVMQLPF-UHFFFAOYSA-N 397.409 5.219 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3cc(C#N)ccc3OC(C)C)sc2c1 609149573 MZLMAESLSZXMEC-UHFFFAOYSA-N 384.888 5.774 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 609434554 XSWAIVDLGNWNKZ-DEOSSOPVSA-N 397.478 6.028 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1c(Cl)cccc1Cl 609581104 HVRGREHEQROEIK-AWEZNQCLSA-N 375.299 5.406 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(CC(F)(F)F)c3ccccc3)c2)cc1 609786122 CMFKRROLLKSYSG-UHFFFAOYSA-N 396.368 5.560 30 20 GKED COc1ccc(COc2cccc(F)c2)cc1N[C@@H](C)c1ccc(C#N)cc1 609825238 MADVJMJSCDBURA-INIZCTEOSA-N 376.431 5.458 30 20 GKED Cc1cccc([C@@H](C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 610040717 AXFROTCJGZILHE-LJQANCHMSA-N 384.479 5.382 30 20 GKED CC(C)CC(=O)Nc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 611092845 JPMGIDWZPOKOBA-UHFFFAOYSA-N 390.270 5.102 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 613292262 FEGZDKYZTKOTPA-QGZVFWFLSA-N 384.460 5.462 30 20 GKED Cc1ccc(F)c(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 642410455 GWWVJINKTCIBMP-URLYPYJESA-N 386.311 5.165 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)(F)F)s3)n2)cc1 671751180 VTPMUYGASLEMPN-LBPRGKRZSA-N 392.427 5.689 30 20 GKED Fc1ccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c(C(F)(F)F)c1 678298859 ZCJKOIQMBSJKFL-QWRGUYRKSA-N 383.229 5.017 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 680639499 WBLDCLIMCUBVQP-VIFPVBQESA-N 378.263 5.193 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1 725715450 AVOBPGJNAFLNLO-UHFFFAOYSA-N 395.871 5.395 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)C2CC2)o1 726457246 LASUOJNRTQJNBY-SJKOYZFVSA-N 385.920 5.289 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc3cc(Br)ccc3o2)cc1 726940234 ARTHUENHZKPBBS-UHFFFAOYSA-N 383.245 5.064 30 20 GKED CC(=NNc1nc2cc(F)c(F)cc2[nH]1)c1csc(-c2csc(C)n2)c1 729143781 RCCHHJSMSYCRJU-UHFFFAOYSA-N 389.456 5.171 30 20 GKED CC(=NNc1ccc(Cl)nn1)c1c(F)cccc1O[C@@H](C)c1ccccc1 730143960 GFUYTPVHHSWJJT-AWEZNQCLSA-N 384.842 5.245 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C2/Cc3c(Cl)cccc3C2=O)cc1 730948757 KRKHWYXSBKNZIX-UVTDQMKNSA-N 394.810 5.033 30 20 GKED CC(CCc1ccccc1F)=NNc1nc(C(F)(F)F)nc2ccccc12 734093047 NIGZMMJHTVIPHV-UHFFFAOYSA-N 376.357 5.208 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(SC(F)F)cc1 734981820 UNJNXJWLBAHXII-UTCJRWHESA-N 379.478 6.082 30 20 GKED CCOc1cc(/C=C\C(=O)c2cncc(F)c2)ccc1OCc1ccccc1 737442521 BQIVSVOJWMZINJ-NTMALXAHSA-N 377.415 5.095 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1 745989982 JBNNCAYOQZWQDM-KTKRTIGZSA-N 381.435 5.043 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)cc1)c1ccc(SC2CCCC2)cc1 750904251 HFLVZLWSVIHJGV-VGOFMYFVSA-N 375.497 5.198 30 20 GKED C#CC[C@@H](OC(=O)CCSc1ccnc2cc(Cl)ccc12)c1ccccn1 751834345 BHGKEGVDVIHLAV-LJQANCHMSA-N 396.899 5.073 30 20 GKED Cc1ccc(/C=C/C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cn1 754257343 XUSIHOXOILEZIR-VMPITWQZSA-N 391.418 5.067 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCc4c(F)cccc4C3)cc2)cc1 757883187 XSYOTGIOTLAMRX-UHFFFAOYSA-N 387.414 5.080 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCn3ccc4cc(Cl)ccc43)[nH]c12 760995551 XHMFNAKJQDHKBK-KRWDZBQOSA-N 390.874 5.136 30 20 GKED CCn1c(NC(=S)Nc2ccc(Cl)c(Cl)c2)nc2cc(C#N)ccc21 763294152 OKAFUVYCDFRGQX-UHFFFAOYSA-N 390.299 5.044 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(-c3ccccn3)noc2C)s1 764998704 CHNGCGKULISGPM-UHFFFAOYSA-N 399.520 5.052 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3COc4cc(C)c(C)cc43)n2)cc1 770848141 SGIVWYJLBQBZGR-MOPGFXCFSA-N 388.492 5.088 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(N3CCCCCC3)cc2)c1 772984855 RIWALHICIHWCDZ-HYBUGGRVSA-N 391.559 5.599 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)C1CCCCC1 780671437 XQAUTDZJUBKBJV-SFHVURJKSA-N 377.488 5.344 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2nc(-c3ccccc3)sc21 788357276 XQKKQNRKIBMURJ-FLIBITNWSA-N 392.427 5.498 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1nc(-c2c(F)cccc2F)cs1 798287027 AKZCQVVYVZSBJC-RRFJBIMHSA-N 398.409 5.207 30 20 GKED N#CCOc1ccccc1-c1nc(C2(c3cccc(C(F)(F)F)c3)CCC2)no1 809483338 UHPFCFGHUKQYMJ-UHFFFAOYSA-N 399.372 5.128 30 20 GKED C#C[C@@H](NC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccc(Cl)cc1 810197612 SAYIQTREYAQEFV-LJQANCHMSA-N 379.847 5.108 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1 915086247 ITPWDBKZTFQKCH-LJQANCHMSA-N 381.262 5.901 30 20 GKED N#C[C@@H](C(=O)COc1ccc(Cl)c2ccccc12)c1ccc2ccccc2n1 916848706 NUGTUIMTSJJRQZ-GOSISDBHSA-N 386.838 5.297 30 20 GKED Cc1c(O)ccc2c(CNc3ccc(Oc4ccc(C#N)cc4)cc3)cc(=O)oc12 921065455 ATQGOJIASOZRDW-UHFFFAOYSA-N 398.418 5.083 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3ccccc3Br)cc2)cc1 1776012768 MDDLXFBOKPJBQT-UHFFFAOYSA-N 395.256 5.260 30 20 GKED COc1ccc2c(c1)CC/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776126960 CKDFULDREANZOZ-RGEXLXHISA-N 384.431 5.273 30 20 GKED C=CCc1ccccc1CNC[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O 1776189649 NBJOQUTZCMWSKP-VWLOTQADSA-N 385.507 5.115 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ccccc1)c1ccccn1 43296453 KVYPZAQPKZDVJO-FQEVSTJZSA-N 397.931 5.284 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cccc(OCc3cccs3)c2)c1 55570264 QHLDIWAZOVGLJW-UHFFFAOYSA-N 392.480 5.262 30 20 GKED CC(C)COC1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 56745336 CYVRMRFBELYHIQ-UHFFFAOYSA-N 393.487 5.019 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1 120558252 ICNSDRCUTDIMKX-UHFFFAOYSA-N 398.340 5.051 30 20 GKED CCC[C@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 135507427 NOGWAERGKBTYNN-FQEVSTJZSA-N 391.515 5.376 30 20 GKED CC(C)C[C@H]1CCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 154204612 LPNHLVVQXZIYBZ-OAQYLSRUSA-N 391.515 5.374 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C(F)F)c3)n2)cc1 171569515 ZGVQLWJCKJJSJI-MRXNPFEDSA-N 384.407 5.246 30 20 GKED CC[C@](C)(NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1nc(C)cs1 173123964 LYTVSZDHEVGUGV-LIRRHRJNSA-N 388.562 5.293 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(Oc2ccccc2)o1 176520725 USHAWQHGQLLPPY-QGZVFWFLSA-N 384.391 5.067 30 20 GKED CCC(CC)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1C 181101703 RMVSJAXEWSHERR-QGZVFWFLSA-N 378.501 5.166 30 20 GKED C[C@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(OCC#N)cc1 181622507 JXTVXUBCBXOCBJ-FDDCHVKYSA-N 390.458 5.199 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F 297990575 JEFLWZUOCVKGFO-UHFFFAOYSA-N 392.377 5.718 30 20 GKED N#CC1(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)CCCC1 302819578 VWBBOIWVTXLEHN-UHFFFAOYSA-N 380.300 5.063 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 302952964 DTHNFKAWNWAFCT-MRVPVSSYSA-N 375.708 5.483 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H]2Cc2ccccc2Cl)cc1 302965622 HFVSVKSLGSPJHO-IBGZPJMESA-N 381.907 5.380 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3cccc(OC(C)C)c3)cc2c1C 303088182 YMNWLLOYUKHSRS-CMDGGOBGSA-N 395.480 5.075 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NC3(c4ccccc4F)CC3)cc2)c1 303948123 ZWDWLCQRVVDECQ-UHFFFAOYSA-N 387.414 5.300 30 20 GKED OC1=Nc2cc(F)ccc2[C@H](/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)C1 329525706 SRPPIMZUWJQGTG-QZTJIDSGSA-N 396.466 5.247 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c2[C@@H](C)C1 411015040 PZQBQFIUDUSPIO-YUMQZZPRSA-N 385.436 5.033 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1coc(-c2cccs2)n1 425529927 DBWAPXPQALVJAG-ZDUSSCGKSA-N 391.418 5.336 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 426668547 FUUPLWRULGMXLH-UNMCSNQZSA-N 389.886 5.247 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H]2CCCC[C@H]2C1 429030958 SQPPWISQDZHBDK-KDURUIRLSA-N 375.472 5.313 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)Nc1ccc(CC#N)cc1 430111598 SGGCGJYUPSDSAX-UHFFFAOYSA-N 386.238 5.275 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N[C@H](CCCC#N)c1ccccc1 431845430 OIMLMWAEMWRALG-WOJBJXKFSA-N 379.504 5.336 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(Br)c(F)c1)c1ccccc1 432974144 UEALYJCFJIQKSY-KRWDZBQOSA-N 390.256 5.145 30 20 GKED C=CCC[C@H](NC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1)c1ccccc1 435112431 XFRDCSIFPIVBHQ-QFIPXVFZSA-N 386.499 5.069 30 20 GKED Cc1ccc(-c2nnc(SCCCCC(C)(C)C#N)n2Cc2ccco2)cc1 436194636 PPTAWPNUMQMXJF-UHFFFAOYSA-N 394.544 5.707 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(F)cn1 437031696 ABVSTIQIFAKIRO-ZUZCIYMTSA-N 380.307 5.584 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cc(-c3nc(CC)no3)ccc2C)CCCC1(C)C 444906309 WFLRBNNPRNIXIL-SFHVURJKSA-N 382.508 5.206 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1csc(-c2ccccc2F)n1 462813470 MHUHXWXEZSSBBP-OAHLLOKOSA-N 381.476 5.805 30 20 GKED CCC(C)(C)CC[S@@](=O)Cc1ccc(OCc2cccc(C#N)c2)c(OC)c1 462990304 NYOJBYSPLDWGBX-MUUNZHRXSA-N 399.556 5.221 30 20 GKED COCCC[C@H](c1ccc(Cl)cc1)c1noc([C@H](C)c2cccc(C#N)c2)n1 463053661 JEEMVNNBKRJELQ-FOIQADDNSA-N 395.890 5.305 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 464944446 OTAPKEUACLRIJM-XCJLJZCSSA-N 398.428 5.107 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 470127914 GMSSSXYJQRLMPE-UHFFFAOYSA-N 393.446 5.749 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c(C)c1 471280586 WFBNAKAKTLRQLO-RBUKOAKNSA-N 393.556 5.719 30 20 GKED O=C(Cc1ccc(F)cc1)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474265124 HUXLLZAVKVYGDO-OAHLLOKOSA-N 393.302 5.197 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2ccc3c(c2)CCO3)C2CCCC2)cc1 475599625 IELOXZXYBHKYDW-UHFFFAOYSA-N 388.511 5.008 30 20 GKED COc1cccc([C@@H](NCc2ccc(C#N)c(F)c2)c2ccccc2Cl)c1 479453475 NFQDTIDMRHCHLB-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)c1cc([N+](=O)[O-])ccc1C 484647831 XFRYOEHXPACLFE-MRXNPFEDSA-N 394.500 5.125 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(-c2ccccc2F)n1)c1ccccc1 487289320 VKSGBVNVKIFFRA-GOSISDBHSA-N 379.460 5.114 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1coc(-c2ccc(F)c(F)c2)n1 488753282 MUMAVNOOERTLPZ-UHFFFAOYSA-N 397.328 5.198 30 20 GKED CCN(C(=O)c1cccc(CC#N)c1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 497900094 QSOVIMMQDFFXSE-QFIPXVFZSA-N 389.886 5.053 30 20 GKED CC(C)c1cc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)nn1C(C)(C)C 505344160 NWHSCRKMWLTWEW-HNNXBMFYSA-N 393.318 5.063 30 20 GKED N#C[C@@H](NC(=O)[C@H](Sc1ccccc1F)c1ccccc1)c1ccccc1F 505942518 IYKMHLMOZHDKKF-TZIWHRDSSA-N 394.446 5.179 30 20 GKED CC(C)c1nc(C2CCN(Cc3ccc(-c4ccccc4C#N)cc3)CC2)no1 506597062 XEOYWZHCOJSXLE-UHFFFAOYSA-N 386.499 5.111 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2NC(=O)CSCC#N)c(C)c1 512176279 UUCJEKROSOLRFP-UHFFFAOYSA-N 376.934 5.303 30 20 GKED Cc1c(C(=O)Nc2ccc(Cl)c(CN(C)C)c2)sc2ccc(C#N)cc12 512285394 HURNTLLAPBICFK-UHFFFAOYSA-N 383.904 5.049 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC(C)(C)CCC#N)C1 513130441 UPKLYAXQMXAQEA-RHSMWYFYSA-N 381.442 5.128 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)sc2Cl)sc2c1CCCCCC2 515449294 UFZXKVWSWORHAC-UHFFFAOYSA-N 385.341 5.899 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518667693 IXAOOEAIHINADE-LAUBAEHRSA-N 398.597 5.835 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)CCCc2ccc(Cl)cc2)CC1 521965312 CBAWCRZUYPYQEM-UHFFFAOYSA-N 396.918 5.041 30 20 GKED C=C(C)CN(CC)C(=O)[C@](C)(Cc1nc2ccccc2s1)c1ccccc1 523722055 RTAPFOGABYFCFQ-HSZRJFAPSA-N 378.541 5.221 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)c[nH]c12 525471876 LXROCIOZYBLFFY-UHFFFAOYSA-N 381.435 5.322 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCCC2(CCCCC2)C1 533440881 NWNHBNIUILSLPG-SFHVURJKSA-N 385.577 5.066 30 20 GKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 537926727 HFTFQLIFJREMDL-KXBFYZLASA-N 381.451 5.071 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(SCC(F)F)cc1 540727698 WWPITENMGLQTSQ-HNNXBMFYSA-N 376.472 5.899 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cnn1-c1cccc(F)c1 542329270 BJMKCDSMLSZPHZ-MRXNPFEDSA-N 396.491 5.034 30 20 GKED CCN(C(=O)CCCCC(=O)c1ccc(C)cc1)[C@@H](C)c1ccc(C#N)cc1 545381252 SUJKSDFDUARKHL-IBGZPJMESA-N 376.500 5.220 30 20 GKED N#Cc1ccc(SCc2nc(-c3cc(F)ccc3C(F)(F)F)no2)cc1 546285161 UCYFTINEAHSBBF-UHFFFAOYSA-N 379.338 5.058 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc(SCc3ccccc3Cl)cn2)c1 546920019 GXQUSLNUJBBXLC-UHFFFAOYSA-N 393.899 5.080 30 20 GKED N#CCC[C@H](NC(=O)NCCCCc1ccc(Cl)s1)c1ccccc1 551292535 YQIXMQBEMHQKEV-KRWDZBQOSA-N 375.925 5.068 30 20 GKED CC(C)Nc1ccc(Br)cc1NC(=O)c1cc(C#N)ccc1Cl 552286508 RSZUINSIDNHUQC-UHFFFAOYSA-N 392.684 5.047 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc2c(c1)OCCCO2 552756560 KHAOBYWOHRHGJQ-SFHVURJKSA-N 384.479 5.237 30 20 GKED CC(C)(C)O[C@@H](C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 559066680 MUMFAKMUZMXTFZ-LJQANCHMSA-N 391.496 5.177 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccc(C(F)(F)F)s3)n2)c1 586800657 WWLXDOPDWQFQIZ-UHFFFAOYSA-N 379.388 5.014 30 20 GKED COc1ccc([C@@H](NC(=O)CCCCC#N)c2ccc(C(F)(F)F)cc2)cc1 594003427 BCBLXYFSTCITBG-FQEVSTJZSA-N 390.405 5.004 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccccc1SCC(F)(F)F 601102176 BRRZAKBMZFMFEU-UHFFFAOYSA-N 396.434 5.228 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1 603754861 FIRFYEAUYWSFLS-GDBMZVCRSA-N 376.378 5.053 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1ncnc2scc(-c3ccc(F)cc3)c12 604045224 KGEDSTWXRJUPSL-KRWDZBQOSA-N 391.496 5.724 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 605917450 UXQIZQUQTVRTJL-UHFFFAOYSA-N 378.394 5.928 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ncoc1-c1ccccc1Cl 607770988 KNYHJFJIVGCPEY-UHFFFAOYSA-N 393.295 5.538 30 20 GKED CCCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1Cl 608916229 QXXCAMMYQXARIT-UHFFFAOYSA-N 385.895 5.443 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1ccc(C#N)cc1F 609254179 DDSKIXLIKAPUTQ-MRXNPFEDSA-N 393.487 5.232 30 20 GKED CC[C@H](C)c1ccc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 609384567 QCFSAMFTUSENJJ-DLBZAZTESA-N 382.529 5.612 30 20 GKED CS[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 610047518 BUMSVLSKXPMPIS-JOCHJYFZSA-N 388.492 5.180 30 20 GKED CC[C@H]1CCC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 610141257 NTXOGOVKDQKIAF-RXVVDRJESA-N 391.515 5.422 30 20 GKED COc1ccc2sc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c(C)c2c1 610227934 XYAOOISMWDQRLA-CYBMUJFWSA-N 396.537 5.722 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 610321118 HMRHMCKJYRYGPB-QFIPXVFZSA-N 378.476 5.180 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1cc2cccc(OCC)c2o1 612199138 QCMHRFOHTYQEFT-QGZVFWFLSA-N 378.472 5.290 30 20 GKED C=CCN(C(=O)Cc1cn(C)c2ccccc12)c1nc(-c2ccccc2)cs1 620259516 YIIPPJNWZFNEFI-UHFFFAOYSA-N 387.508 5.064 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(NC3CCCCC3)cc2)cc1OC 623815174 NQOFXPYUCGYOKP-UHFFFAOYSA-N 380.488 5.257 30 20 GKED C[C@@H](CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C(F)(F)F 626369512 GBYBGLFZVPQSPK-WRWORJQWSA-N 381.238 5.014 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccc2ccccc2n1 674407903 NGQTVALVOSANDU-IBGZPJMESA-N 381.410 5.290 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(C)c(OCc3cccnc3)c(C)c2)cc1 726940245 BAZXCBYGRXAVPH-UHFFFAOYSA-N 399.494 5.146 30 20 GKED CCN(C(=S)Nc1c(Cl)ccc(C)c1Cl)[C@@H](C)c1ccc(C#N)cc1 728447220 UTHMQOXHRWXACG-ZDUSSCGKSA-N 392.355 5.953 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2SC[C@H](C)C#N)cc1Cl 730954641 GKBRHODKXIAKML-GFCCVEGCSA-N 391.949 5.409 30 20 GKED CCCO[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 731108224 INUJUORBAUQTJU-DHIUTWEWSA-N 391.515 5.155 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1cc(Cl)cc(Cl)c1 731318110 BMNYKNSCWRUPDB-NSHDSACASA-N 396.368 6.197 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1F 731411380 XLFKJDIAZSBBKX-GXFFZTMASA-N 392.377 5.434 30 20 GKED O=S(=O)(Cc1cccc(N=Cc2cc(Cl)ccc2O)c1)C1CCCCC1 732621056 CJAKCAHVACCNJV-UHFFFAOYSA-N 391.920 5.044 30 20 GKED C=CC[C@H](NC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1)c1ccncc1 734460164 POIIQODJHCUAKI-FQEVSTJZSA-N 378.497 5.174 30 20 GKED C#CCN(C(=O)c1cc(C(C)C)nc2c1c(C)nn2C(C)(C)C)C1CCCCC1 743691338 YXYIRMPSZCUMDA-UHFFFAOYSA-N 394.563 5.026 30 20 GKED FC(F)(F)c1ccc(CON=Cc2ccccc2OCc2ccncc2)cc1 746576831 NQJNAWKEGHUVGC-UHFFFAOYSA-N 386.373 5.230 30 20 GKED C#CC[C@H](OC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccccn1 750695772 BRAWZAFSNMOLSE-LIRRHRJNSA-N 396.899 5.072 30 20 GKED Cc1cccc(-c2nnc([C@@H](C)ON=C(c3ccccc3)C(F)(F)F)o2)c1 751953641 ZYPHLVNECMAXJR-CYBMUJFWSA-N 375.350 5.089 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1OC 753143160 IGFHMIUNVBYDOO-SREVYHEPSA-N 394.496 5.289 30 20 GKED Cc1sc([C@H](C)/N=C/c2ccc(O)c(O)c2O)nc1-c1ccc(Cl)cc1 755032574 XYIOPCHQFLQVPZ-LUKZVCJISA-N 388.876 5.069 30 20 GKED CC(C)C[C@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccn1 761381455 FHPXNGRFCMQXEB-NRFANRHFSA-N 387.439 5.085 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1cccc(Cl)c1 770651358 GFGUSYQUNVCMNW-BEFAXECRSA-N 383.879 5.390 30 20 GKED CCCCCCCCc1nc(CC(=O)Nc2c(Cl)cccc2Cl)no1 771028346 FDPFRCFYSIMTKP-UHFFFAOYSA-N 384.307 5.461 30 20 GKED C=CCc1cc(CN[C@H](C)c2cc(Cl)c(N)c(Cl)c2)cc(OC)c1OC 774442286 ZLILVWWCYOVWFQ-GFCCVEGCSA-N 395.330 5.172 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=S)Nc1ccc(OC(F)F)c(Cl)c1 779726786 JWVIUYULDNAJSL-SNVBAGLBSA-N 397.834 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@@H]2SCCS[C@@H]21 789460309 SDSUWFNRTVAIHG-ZIFCJYIRSA-N 376.591 5.040 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)[C@@H]2CCC(=O)c3ccccc32)cc1 792658742 CGIINAQQPWPYKD-HSZRJFAPSA-N 381.431 5.029 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cscc2Br)S1 794684453 BRAAAOJUUVFGQM-MLPAPPSSSA-N 393.331 5.019 30 20 GKED CC[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1O 796683273 MPXIULBRBYSBMD-IUCKATPISA-N 387.339 5.482 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCCc2ncc(-c3ccccc3)o2)s1 797570140 DGJNSYJSRREDQQ-MRXNPFEDSA-N 393.512 5.295 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797570157 DKZWXVRAHBJWIL-HNNXBMFYSA-N 399.516 5.278 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797573581 UOKCHAGNBSKPSR-KSSFIOAISA-N 378.497 5.238 30 20 GKED COc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1F 797615069 ONNBCIYKSUAYTG-QGZVFWFLSA-N 394.471 5.075 30 20 GKED CC(C)N(C)c1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1F 814601720 PMYAQDDYFISAJY-FQEVSTJZSA-N 382.483 5.227 30 20 GKED C[C@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(-c2cccc(C#N)c2)cc1 815615378 OPJXJOYCWPSZQB-JKSUJKDBSA-N 386.455 5.127 30 20 GKED C[C@@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C[C@@H]2C[C@@H]2C1 815912059 XVBZQYCAWZLADU-XWQJJJGRSA-N 391.323 5.729 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(-c2ccc(C(C)(C)C)cc2)no1 818423967 JBRWEUINVGWWJC-QGZVFWFLSA-N 398.507 5.294 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1 825428995 FHOOPRJITQDDKX-SFHVURJKSA-N 398.551 5.224 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(C2CCCCCCC2)no1 848611886 SPKAQXPYOPOWMF-QGZVFWFLSA-N 390.528 5.547 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3scnc3C)cc2)c1 850137546 QQINYXNEPBVKRG-HXUWFJFHSA-N 377.513 5.089 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@H]2Nc1nc(Cl)c(C#N)s1 853850105 HBPJBQXAHDWMFJ-CYBMUJFWSA-N 390.896 5.115 30 20 GKED CC(C)(C)N(N=Cc1cnc(C2CC2)o1)C(=S)Nc1cccc(Cl)c1 863082606 OCCJCENIQQZNPO-UHFFFAOYSA-N 376.913 5.037 30 20 GKED CC(=O)[C@](C#N)(CCN(C)[C@H](C)c1sc(C(C)C)nc1C)c1ccccc1 878301800 CEYOYNNKAWOIFZ-VGOFRKELSA-N 383.561 5.008 30 20 GKED C=CC(C)(C)CC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 888228049 ZYUAPUDPYMCWDR-UHFFFAOYSA-N 380.366 5.092 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3cccs3)on2)cc1 915087891 XRDVLTXEOPEVQH-GOSISDBHSA-N 385.448 5.311 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccncc2)cc1 915352434 IIDZKDRCUQHFJR-GOTSBHOMSA-N 382.467 5.106 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)no1 915354257 YKADFRQLFCNQFB-RBBKRZOGSA-N 386.455 5.008 30 20 GKED Cc1ccc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)c(Cl)n1 916046885 KLPIJOMQKNTCQO-UHFFFAOYSA-N 393.849 5.210 30 20 GKED CCCCCCCCCNC(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 919654886 NANCERMSFRXHLV-KBPBESRZSA-N 390.412 5.509 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1csc(-c2ccsc2)n1 920065692 GQGVECDXBYSURF-DCQZTHCWSA-N 394.477 5.610 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2ccc(OC)c(CC(=O)O)c2)cc1 1776131840 OWMBAHDGKDBBEB-LCYFTJDESA-N 396.483 5.178 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2)c1)C(=O)O 1776470796 IQQTVOWKRJWEMT-SAAWKEMMSA-N 378.449 5.163 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776697904 XYVMAYHAXNSNCH-MARXPDLDSA-N 378.424 5.549 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1OC 1776814649 JLYMYWIOTWURFW-SOFGYWHQSA-N 388.847 5.040 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(Cl)c(C(F)(F)F)c1 1777640946 GTGAHDMEBXAMQH-SOFGYWHQSA-N 398.764 5.108 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ccsc3Br)c2c1 1777684164 YYZSQHAPGBVPLO-IWQZZHSRSA-N 393.283 5.320 30 20 GKED COc1ccc(-c2csc3ncnc(Oc4ccc(C#N)cc4Cl)c23)cc1 15117066 CKQFTSBRFYNZIZ-UHFFFAOYSA-N 393.855 5.684 30 20 GKED CCOc1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 15336656 UXLQLGBBGRSHMR-KRWDZBQOSA-N 386.451 5.030 30 20 GKED CCCCN/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccc(C(C)(C)C)cc1 27327766 AJSIXKOGMLSAEF-UHFFFAOYSA-O 397.608 5.217 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2nc3ccccc3s2)s1 32615354 XMBBCPWGVRMRQW-UHFFFAOYSA-N 389.505 5.169 30 20 GKED CSc1ccccc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 46346540 BUNMVUMWRLDBQO-UHFFFAOYSA-N 388.492 5.306 30 20 GKED Cc1ccccc1OCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 46861756 CKAUXNUUHXMUKG-HXUWFJFHSA-N 390.870 5.321 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc(C#N)cc1 56712722 BWELEPZFDGOAOZ-MRXNPFEDSA-N 382.423 5.105 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc3cc[nH]c3c2)cc1 58515721 LSZSQLYUYVJJGG-UHFFFAOYSA-N 383.426 5.021 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccoc2)n1)c1nc(-c2ccccc2)cs1 108624712 FPMIETFHFVMEMC-CQSZACIVSA-N 377.450 5.017 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1 110404254 PIBAXBUUHYZCMR-KPKJPENVSA-N 381.859 5.397 30 20 GKED CC(C)N(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)C1CCOCC1 121587047 PLMBATNKYZFSOV-UHFFFAOYSA-N 398.890 5.034 30 20 GKED C[C@@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 128746534 ZAQBJTZAFDCLOY-HNNXBMFYSA-N 391.858 5.232 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(F)cc2Br)c(C#N)s1 154267234 JDAYVRVGNGAJNW-UHFFFAOYSA-N 381.270 5.071 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 175119594 ICWBJBIUMFVBRF-ZJUUUORDSA-N 379.819 5.126 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)c1 175571334 KYHVIVOSAHNHHQ-UHFFFAOYSA-N 390.430 5.126 30 20 GKED Cn1c(-c2ccc(NC(=O)c3cccc(SCC#N)c3)cc2)nc2ccccc21 175754868 FPQIBMJZKMODLQ-UHFFFAOYSA-N 398.491 5.108 30 20 GKED CCN(C(=O)c1ccc(Oc2cccnc2)cc1)c1ccc(C#N)c(Cl)c1 179532276 GIIMAUZOTXNOSL-UHFFFAOYSA-N 377.831 5.066 30 20 GKED C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)c1cccc(C#N)c1 189784020 GBTCFHYOIKWOPP-INIZCTEOSA-N 383.480 5.054 30 20 GKED CC[C@@H]1C[C@H](/C(O)=N/Cc2nc3c(s2)C[C@H](c2ccccc2)CC3)CC(O)=N1 329796986 FGMMFELERZEOJZ-IXDOHACOSA-N 397.544 5.017 30 20 GKED O/C(=N\C1(c2ccc(F)cc2F)CCC1)C1CCC(/N=C(/O)C2CC2)CC1 330019772 VPPBQATWEFJLGQ-UHFFFAOYSA-N 376.447 5.226 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C 429250619 GLWBXAVJBYVQKM-UHFFFAOYSA-N 393.531 6.145 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cncs2)cc1Cl 432713719 LEMGWTKUZZTSAY-SFHVURJKSA-N 381.888 5.023 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccccc2CSCC)cc1 436444945 ROSQMUUYXCOCKH-UHFFFAOYSA-N 394.540 5.006 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 438060168 PMOREFNJZVDJCL-RXVVDRJESA-N 393.556 6.006 30 20 GKED Cc1cc(NC(=O)Nc2cccc(OCCCC#N)c2)ccc1C(F)(F)F 438536640 PSFLDFIMCQXHER-UHFFFAOYSA-N 377.366 5.340 30 20 GKED Cc1nc(-c2ccc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)cc2)cs1 442669440 CRSZURDOBMJAON-IRLDBZIGSA-N 387.508 5.031 30 20 GKED CN(C(=O)NCC1CCC(C#N)CC1)[C@H](c1ccc(Cl)cc1)C1CCCC1 442731407 UAYDQSCHYBRNLN-BPZDKFOGSA-N 387.955 5.543 30 20 GKED CC1(C#N)CCC(N[C@H](CC(F)(F)F)c2ccc(Br)cc2)CC1 449237530 ODNUMIRKPDOYNW-HWOWSKLDSA-N 389.259 5.505 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)[C@]1(C#N)C[C@H]1C 449978896 BOWAWCOZYNBCNH-CMJOXMDJSA-N 390.462 5.220 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2F)c(Cl)c1 455738175 UXNLKCPTKOPUJD-GOSISDBHSA-N 375.806 5.053 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 460767012 ICMKOLOLIGLPRR-NHCUHLMSSA-N 394.563 5.345 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 466367157 QHKFHNURTCMZAJ-HNNXBMFYSA-N 377.941 5.193 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cncc(-c4ccccc4)c3)n2)cc1 467067809 GWWRQRSBZLHTBB-NRFANRHFSA-N 395.487 5.671 30 20 GKED Cc1ccc([C@H]2CCC[C@H]2Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469273477 VUJFDVPDEIGGPP-DHIUTWEWSA-N 387.527 5.326 30 20 GKED Cc1nc2cc(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)ccc2o1 470971781 LLTQQVDVPADYQL-UHFFFAOYSA-N 387.370 5.192 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Oc3ccc(F)cc3F)cc2)n1 474429788 URVSIOWZESPMOR-INIZCTEOSA-N 398.434 5.827 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2c(F)cccc2F)n1 476168702 XRHWUTMXWWKXLP-UHFFFAOYSA-N 395.453 5.563 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)[nH]1)c1nc2cc(Cl)ccc2s1 477882095 RREUJLPSTDGTSC-AWEZNQCLSA-N 377.856 5.435 30 20 GKED Cc1c([C@@H](NC(=O)N[C@H](C)c2ccc(C#N)cc2)C(C)C)oc2ccccc12 483778030 XZSHAJTZZKXIBT-IERDGZPVSA-N 375.472 5.370 30 20 GKED Cc1nc2ccccc2n1CCC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 486293974 QMQPYEOZPSCLGD-UHFFFAOYSA-N 396.450 5.038 30 20 GKED N#CCCC[C@H](NC(=O)CCn1ccc2cc(Cl)ccc21)c1ccccc1 487220622 PDXQYSUSMYIOKE-FQEVSTJZSA-N 379.891 5.236 30 20 GKED C=CCn1c(SCc2csc([N+](=O)[O-])c2)nnc1-c1cccc(Cl)c1 489649011 BVFFLIQLOJSINL-UHFFFAOYSA-N 392.893 5.047 30 20 GKED N#CCC[C@@H](NCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)c1ccccc1 494567065 RNKCBCLIJNMXOL-OAQYLSRUSA-N 398.432 5.085 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](Cc1ccccc1)c1ccccc1 503825441 GUPBOJCFICTTEN-JOCHJYFZSA-N 376.525 5.430 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c1 505547480 QTZVDYWIOBAJDD-CQSZACIVSA-N 385.703 5.363 30 20 GKED CCN(C(=O)CCc1ccc(Cl)c(Cl)c1)[C@H](C)c1ccc(C#N)cc1 508942312 PVDAGTJNOJKQLY-CQSZACIVSA-N 375.299 5.407 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 510584306 LRQSWTMEMFHITF-QFIPXVFZSA-N 389.543 6.154 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)s1 512561794 YJBNNGQXPBTOMY-OLZOCXBDSA-N 393.965 6.069 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1F 512611344 KHVSHKLBKJPALO-STQMWFEESA-N 383.467 5.680 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1c(F)cccc1F 513638406 RVNAWNQXXQDJKP-MRXNPFEDSA-N 378.422 5.266 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1oc2ccccc2c1CN(C)C 515243324 BULRNTAJQZCGHZ-UHFFFAOYSA-N 388.920 5.038 30 20 GKED C=CCn1c(-c2c[nH]c3ccccc23)nnc1N1CCC[C@@H]1c1ccsc1 515559095 KGFLGLCRIUVEPY-LJQANCHMSA-N 375.501 5.015 30 20 GKED Cc1ccc(-n2c(SCc3cccc(C#N)c3)nnc2-c2ccccn2)c(C)c1 515565861 PBHFWLIUPQELAH-UHFFFAOYSA-N 397.507 5.110 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c(C)s1 518847955 OOWGEGLBXMMVPT-MRXNPFEDSA-N 395.311 5.016 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 519029730 UFLZGYPVRDKGLN-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1ccccc1C(C)(C)C 519423942 LIKFMELHJSPWBC-INIZCTEOSA-N 382.529 5.253 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 520533572 YEROLGHNAQOPED-UHFFFAOYSA-N 386.451 5.319 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccccc1SC[C@@H](C)C#N 520826158 BZRKZCWMINEPMZ-FUHWJXTLSA-N 394.540 5.396 30 20 GKED CC[C@@H](C)Oc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 521209013 NGXSQUUQJGXSFV-GOSISDBHSA-N 379.504 5.426 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2c(c1)CCC2 524389024 KCXAZIXXQYDTCU-UHFFFAOYSA-N 382.463 5.187 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3c(F)cccc3F)cc2Cl)c1 524390983 OEVNWIZZGOMUIR-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1ccc2oc(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cc2n1 534657866 PHUULVWQKDRJIN-LLVKDONJSA-N 395.390 5.028 30 20 GKED CCC[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 535851379 WJEZXPCYOHHQEC-AWEZNQCLSA-N 382.460 5.286 30 20 GKED COc1cccc(CNCc2ccc(-c3ccccc3C#N)cc2)c1OC(F)F 538000160 JSNLWTGTZZVTMD-UHFFFAOYSA-N 394.421 5.125 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)[C@@H](C#N)c2nc3ccccc3o2)c1 540681198 FSJORHPXACARBT-QGZVFWFLSA-N 376.481 5.661 30 20 GKED COc1cc(C#N)ccc1NC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 546002832 QTBXRIPKZUTRCF-MRXNPFEDSA-N 386.455 5.384 30 20 GKED N#CCCN(C(=O)c1cccc(OCc2cccs2)c1)c1ccc(F)cc1 553821049 GHPJKBJEJQYDKW-UHFFFAOYSA-N 380.444 5.027 30 20 GKED Cc1oc(C2CC2)nc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 560518234 XTBFTLSHVFZJBD-CQSZACIVSA-N 383.860 5.127 30 20 GKED N#C[C@H](C(=O)c1ccn(C2CCCCC2)n1)c1nc(-c2ccccc2)cs1 567537019 VFTFFKFSDNYWAT-QGZVFWFLSA-N 376.485 5.002 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)CCCSCCC(C)(C)C#N 568130737 URTPIOZNIFFGOP-UHFFFAOYSA-N 397.382 5.458 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CCc3sc(Cl)cc32)c2ccccc21 582333056 TUCAFMUQNPCEDW-INIZCTEOSA-N 383.904 5.077 30 20 GKED N#Cc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)c(Cl)c1 584569571 OWDYZZNYOVVIPY-UHFFFAOYSA-N 394.824 5.026 30 20 GKED C[C@@H](N[C@H](C)c1noc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 585753904 MKKLHYCIPDQDLB-QZTJIDSGSA-N 394.478 5.687 30 20 GKED CCN(C(=O)CCCCCC#N)[C@H](c1cccnc1)c1csc2ccccc12 588927150 NZMHEUJDTCENCW-HSZRJFAPSA-N 391.540 5.708 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1CCC2(CC1)CC2(F)F 596734075 NSLGJRNWENHFLP-VNSJNIRKSA-N 379.476 5.028 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc2c(c1)CCCO2 596736160 UIMHOWDGAXVVHH-CVEARBPZSA-N 395.528 5.289 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1[C@@H]2Cc3c(Cl)cccc3[C@@H]21 599737589 MKZRPCLQHFAHFG-HHLQROKJSA-N 397.931 5.194 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@H]1c1ccccc1 601184780 OCFDXJVEWXVZAH-QHCPKHFHSA-N 381.479 5.096 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCC[C@H]1CCc1ccccc1 601187627 YZIHVASYIFMAFK-VWLOTQADSA-N 395.506 5.111 30 20 GKED C[C@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)o1 603765403 UESSDMRGQBRSJX-MGPUTAFESA-N 387.439 5.033 30 20 GKED C[C@@H]1CCN(C(=O)c2cccc(C#N)c2)c2cc(C(F)(F)F)ccc2S1 603961824 KOLPRDSLOWKOHI-GFCCVEGCSA-N 376.403 5.108 30 20 GKED C=CCn1c(S[C@H](C)c2ccncc2)nc2sc3c(c2c1=O)CCCCC3 605075913 VYXDNAPFGBVVKC-CQSZACIVSA-N 397.569 5.161 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2ccc(OCc3ccccc3)cc2)oc2ccccc12 609028811 QWIBLHMMAZFZAP-JOCHJYFZSA-N 396.446 5.315 30 20 GKED C[C@H](CC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(C(F)(F)F)cc1 609067234 ZBHZUMKELWBPSE-LLVKDONJSA-N 398.331 5.311 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(Br)c1 609377985 SSPBDKKMCXGNSK-JTQLQIEISA-N 381.320 5.015 30 20 GKED Cc1cccc(C)c1OCCCNC(=O)Nc1ccccc1SC[C@@H](C)C#N 609398422 OUFWKXFUAGDFCK-INIZCTEOSA-N 397.544 5.146 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2COc3ccccc32)cc1Cl 609587060 UDIRAWMZAITFKV-WOJBJXKFSA-N 388.854 5.110 30 20 GKED COc1ccc(Cl)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 612894586 BPCVMQWQVKJODL-INIZCTEOSA-N 382.872 5.271 30 20 GKED CCCCOc1ccc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1OC 614178756 CVOBUNRCVRXNLP-GOSISDBHSA-N 380.532 5.526 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3CCC(C(F)(F)F)CC3)cn2)c1 618080913 BBAJCPCBIKZZNR-UHFFFAOYSA-N 389.377 5.053 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3sccc3C(C)C)n2)cc1 619753919 JNMPEMKEIWBCTH-INIZCTEOSA-N 382.510 5.494 30 20 GKED C=CCOc1c(Cl)cc(CN[C@H](C)c2ccc3ncsc3c2)cc1OC 623496179 LABSPARKZDASKA-CYBMUJFWSA-N 388.920 5.374 30 20 GKED C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 682089726 CIJUNKCIVALEQF-GHMZBOCLSA-N 397.334 5.066 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726449651 PZLYIBZJIIDTRA-UHFFFAOYSA-N 383.904 5.349 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 727955659 MIXVRWQZWFOFID-MGPUTAFESA-N 390.508 5.361 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2cc(C#N)ccc2OC(C)C)c1Cl 728447058 QWQPAIHPDQYJTA-UHFFFAOYSA-N 394.327 5.770 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(SC2CCCC2)cc1 728698664 LZEINYIOWSSSHO-MDZDMXLPSA-N 380.435 5.376 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416772 IJDHSXZJERCYES-WMZOPIPTSA-N 396.487 5.593 30 20 GKED N#C[C@H](C(=O)CSc1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 730420137 AAMBOGCZILZDJG-QGZVFWFLSA-N 392.480 5.557 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2coc3ccccc23)cc1 734059972 KZARHQBXQXHSHC-QFIPXVFZSA-N 381.435 5.410 30 20 GKED C=CC[C@@H](NC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1ccncc1 734456787 CTYWQOCXWLNQKV-JOCHJYFZSA-N 397.478 5.189 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)c3cccc(Cl)c3)n2)cc1 737321788 AUIQFERSJVSWST-GOSISDBHSA-N 394.927 5.926 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccc(-c3ccccc3OC)cc2)SC1=S 743282693 QJHBMXJIUMXHIC-XDHOZWIPSA-N 381.522 5.140 30 20 GKED O=c1c2c3c(sc2ncn1N=Cc1sc2ccccc2c1Cl)CCCC3 744597613 XUNFFLZHRDCYLG-UHFFFAOYSA-N 399.928 5.087 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)ccc1SC(F)F 746346965 VZGBVYPXWCCBQB-CLFYSBASSA-N 398.434 5.363 30 20 GKED CC(=NNc1nc(-c2cc(C)n(CC(F)(F)F)c2C)cs1)c1ccccc1 749260921 FTACSKMEKPKODG-UHFFFAOYSA-N 392.450 5.627 30 20 GKED CSc1cc(O)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 754481091 IXGFMCFWGQYLRH-UHFFFAOYSA-N 394.427 5.169 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 756232778 XOWXHWIMRZQAJH-MLGOLLRUSA-N 389.282 5.468 30 20 GKED C=C(C)[C@@H](NC(=S)Nc1cc(OC)ccc1Cl)c1ccc(F)c(F)c1 774206681 OJWGKWAGFZTGCV-QGZVFWFLSA-N 382.863 5.231 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](CC(C)(C)C)c2ccccc2)ccc1OC 776165883 YCEYFJBDTZUDLM-NHCUHLMSSA-N 380.532 5.643 30 20 GKED CCC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](O)c1ccccc1 791816916 CIXBVNPSXLDDNH-PBEJRMEISA-N 397.544 5.105 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797571034 LIAYCRDVTXPFNE-HUUCEWRRSA-N 394.462 5.829 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 797613065 BFXNUPPJIALIDH-RBBKRZOGSA-N 375.516 5.632 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801670974 SYWARHCBQSCSHK-SJKOYZFVSA-N 396.409 5.606 30 20 GKED COc1ccc2cc(NC(=O)c3ccc(COc4ccc(C#N)cc4)o3)ccc2c1 803456464 WGQOLIAYNXEWPS-UHFFFAOYSA-N 398.418 5.144 30 20 GKED O=C1/C(=C\c2ccc(SC(F)(F)F)cc2)C[C@@H](C(=O)O)c2ccccc21 806561211 SHCDJOBSUPACSJ-HMWXGYMHSA-N 378.371 5.137 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1ccccc1Nc1ccc(SC(F)F)cc1 817611359 HQWASUKNCDKRSZ-UHFFFAOYSA-N 389.471 5.367 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1CCC[C@@H](c2cccc(Cl)c2)C1 837190606 UUIZFSBKWMKDOH-AEFFLSMTSA-N 384.932 5.412 30 20 GKED N#C[C@@H](C(=O)Cc1csc(-c2ccccc2Cl)n1)c1nc(C2CC2)cs1 842937782 IZWGGUODIDDVKR-AWEZNQCLSA-N 399.928 5.216 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1CC2(C1)CC2(F)F 850868651 GMUNWSAMMXHZKA-DMLGSKKGSA-N 388.254 5.287 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(c2ccnc3ccccc23)CC1)c1ccccc1 854758370 OTEGBCCLJQKKFD-NRFANRHFSA-N 383.495 5.028 30 20 GKED C=CCOc1c(Cl)cc(CN[C@H](C)c2nc3ccccc3s2)cc1OC 858137840 HLIXUAUEKXBJAV-CYBMUJFWSA-N 388.920 5.374 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(OC3CCC3)c(F)c2)c1 864017044 LGQDFBHCIHMUGA-UHFFFAOYSA-N 375.241 5.003 30 20 GKED N#Cc1ccsc1NC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 908133137 YSUDTOIZWMXSCD-UPHRSURJSA-N 390.308 5.309 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(SC(F)F)cc3)cn2)c1 915175231 QRRAVSQKYMFWQF-UHFFFAOYSA-N 397.406 5.313 30 20 GKED Cc1cccc(OCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 915181050 WKJGKOKSQAQLPV-QHCPKHFHSA-N 384.479 5.367 30 20 GKED CC[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 915352367 KMNXXJUUMOVKPB-CYFREDJKSA-N 383.495 5.657 30 20 GKED C=CCN(C(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C)C(C)C 917659431 ZNJABYSRFVQNIY-UHFFFAOYSA-N 394.899 5.138 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C/c1csc(-c3ccsc3)n1)CC2 920066298 WTTXYYULVLJUAD-XYOKQWHBSA-N 399.493 5.162 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 921006071 PGPFOUBSZAIVOL-RAIGVLPGSA-N 399.350 5.030 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C/C(=O)c3ccc(F)cc3F)c2)c1 1776125470 JPPZXUPQPFVPTO-JXMROGBWSA-N 394.373 5.138 30 20 GKED C=C(C)COc1cc(/C=C/c2cc(C(=O)O)c3ccc(F)cc3n2)ccc1OC 1776140126 XAEOTILVTCFJBS-QPJJXVBHSA-N 393.414 5.206 30 20 GKED C=CCOc1ccc(/C=C\c2nc3c(s2)CCC[C@H]3C(=O)O)cc1Cl 1776184140 KSBKTSZKHDICHO-FNOHHLHBSA-N 375.877 5.036 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C(F)F)c(F)c1 1776354453 LGYNTJQKHOGNIL-DAXSKMNVSA-N 378.346 5.145 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1cc(C(=O)O)c(Cl)s1)CCO2 1776374706 UMRQFPKXLQNEID-KPKJPENVSA-N 376.861 5.272 30 20 GKED CC(F)(F)c1ccccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776446845 MHLYXCOKOUNIGE-ZHACJKMWSA-N 382.362 5.653 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)s1 1776965992 MTWIPPZNIHRSIH-PKNBQFBNSA-N 392.476 5.484 30 20 GKED C=CCC(CC=C)C(=O)NC1(c2ccc(NC(=O)c3ccoc3C)cc2)CCC1 1787361763 LAKBVUWAKFPGQD-UHFFFAOYSA-N 392.499 5.104 30 20 GKED C=CCN(C(=O)c1ccc(CC)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 7724827 USUXRYPZGWLZHR-UHFFFAOYSA-N 393.468 5.114 30 20 GKED N#C[C@H](C(=O)c1ccc2ccccc2c1)c1nc(-c2ccc(Cl)cc2)cs1 60477539 KRBNSJNKRNYJEA-LJQANCHMSA-N 388.879 6.107 30 20 GKED C=C(C)CN(CC)C(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 60624961 LKCRFNSKUSSEAY-UHFFFAOYSA-N 397.569 5.498 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc(Cl)cc3)n2)cc1 66545040 KEWHOQHIPOFWOO-DNXKIMQPSA-N 389.867 5.225 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955449 AIWITRCQLNHRJZ-QGZVFWFLSA-N 392.528 5.397 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCSc1ccccc1 106116856 MVASOLQFQIQSQJ-UHFFFAOYSA-N 389.480 5.175 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(F)c1 108413168 JZZLJJVYZNWZQD-CABCVRRESA-N 388.533 5.653 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1c(F)cccc1Oc1ccccc1 124591367 GHRJFPXJOZTWAW-UHFFFAOYSA-N 379.391 5.159 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 125693855 WXFIDIHTRURNES-UHFFFAOYSA-N 399.815 5.226 30 20 GKED COc1cc(CN[C@@H](CCC#N)c2ccccc2)ccc1OCc1cccs1 130449899 LEBYQHHYYFPXTB-NRFANRHFSA-N 392.524 5.470 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 161422855 ZUYHAOYNMLVYCP-GFCCVEGCSA-N 376.268 5.157 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c2ccccc2n1 161901023 UEQSFHJAFCDQBB-INIZCTEOSA-N 383.373 5.262 30 20 GKED CC(C)c1csc([C@H]2CCCN(C(=O)Nc3cc(C#N)cn3C(C)(C)C)C2)n1 173220943 XBILGYSQZIGQRH-INIZCTEOSA-N 399.564 5.106 30 20 GKED CC#CCCCC(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 184913171 DFMPQKJQRVLPRM-UHFFFAOYSA-N 378.497 5.553 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 194739877 MHFULZYRRATTAC-OAQYLSRUSA-N 385.854 5.048 30 20 GKED COc1ccc(CNC2(c3ccc(Cl)cc3)CCCC2)cc1OCCCC#N 237343348 VBBVSQARTGYADP-UHFFFAOYSA-N 398.934 5.590 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cccc(C)c2C)cs1 263633503 NURZVEWWMVPENX-RAXLEYEMSA-N 390.508 5.649 30 20 GKED N#Cc1ccc2nc(NCc3ccc(NC(=O)c4ccc(F)cc4)cc3)ccc2c1 301972063 HELXESPYXAGEQL-UHFFFAOYSA-N 396.425 5.110 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/CC2(c3ccc(Cl)cc3Cl)CCOCC2)CCC1=O 328919546 LMNAFMRTESTYHR-ZIAGYGMSSA-N 398.330 5.003 30 20 GKED OC(=Nc1ccccc1Oc1cccc(F)c1)N1CCCC2(CCOCC2)C1 330169465 BLJGQOFMOBGTHU-UHFFFAOYSA-N 384.451 5.056 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 425642810 ZYFUQMNMIWMLHC-RRZMJASDSA-N 390.449 5.227 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425650349 JTTLFCRQAWDYNU-QGZVFWFLSA-N 381.545 5.733 30 20 GKED CC(C)Oc1cc(Br)cc(C(=O)Nc2ccc(C#N)cc2Cl)c1 430351781 GSVGTAFCNGOUBH-UHFFFAOYSA-N 393.668 5.014 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc(C(C)C)nc2c1c(C)nn2C(C)(C)C 431845854 PXLHFIPINFCZKO-UHFFFAOYSA-N 389.503 5.051 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cccc(-c3cccnc3)c2)cc1 437260756 DYQLBTHFBXUXQD-UHFFFAOYSA-N 383.495 5.175 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(=Cc2ccccc2F)CC1)c1ccccc1 438850311 HJGITBUFYMSIDO-JOCHJYFZSA-N 377.463 5.060 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@H]3/C=C\c3ccccc3)o2)c1 441048681 SKOPNBWJKFIKQN-MBWOQUJGSA-N 384.483 5.066 30 20 GKED N#Cc1ccc(CNc2ccc3c(c2)CN(CC(F)(F)F)C3)c(C(F)(F)F)c1 453607125 ASXVJGHLOJGOPD-UHFFFAOYSA-N 399.338 5.067 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 463748576 WDSQSUASMSMFTP-KZULUSFZSA-N 379.262 5.082 30 20 GKED Cc1sc2nc([C@H](C)Sc3ccc(C#N)cc3Cl)nc(O)c2c1C 465389899 VGGVXJFIPTUWBY-JTQLQIEISA-N 375.906 5.392 30 20 GKED COc1cc(CSCc2ccc(F)cn2)ccc1OCc1cccc(C#N)c1 469278649 RTUMICWCHRBRSC-UHFFFAOYSA-N 394.471 5.113 30 20 GKED Cc1csc(Nc2ccc(NC(=O)C[C@@H](CC#N)c3ccccc3)cc2)n1 475762209 MCSQOSDJGDQLDC-QGZVFWFLSA-N 376.485 5.221 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccccc1 475768589 OBMWXLLCNLMERQ-SFHVURJKSA-N 382.454 5.324 30 20 GKED CC(C)(C#N)CNC(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 478071736 IPJDBZHZXHKNLH-UHFFFAOYSA-N 384.892 5.288 30 20 GKED CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 480657152 DBESKJUJDDXVDV-KSFYIVLOSA-N 377.488 5.098 30 20 GKED CC[C@@H](C)CN(CC)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 483447949 UZEKZGRNVPNNNA-GOSISDBHSA-N 379.504 5.232 30 20 GKED N#C[C@@H](C(=O)c1sc(C2CC2)nc1-c1ccccc1)c1nc2ccccc2o1 484120430 WFGCWIMGNXNETF-HNNXBMFYSA-N 385.448 5.319 30 20 GKED N#Cc1cc(C(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)ccc1F 485083013 XMUSODYWINYQOS-UHFFFAOYSA-N 377.246 5.024 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1COCc1ccccc1 485345439 KAEAEZCHPZODQS-UHFFFAOYSA-N 392.543 6.004 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)cc2c1 487382966 AOEGKXLNRXRALF-UHFFFAOYSA-N 398.491 5.023 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 487776616 MMTGVNFAADWDMR-LJQANCHMSA-N 384.863 5.274 30 20 GKED C=CCC[C@H](C(=O)NC1CCN([C@H](C)c2ccccc2)CC1)c1ccccc1 488991433 ZNJHSCCVHNDHQK-YKSBVNFPSA-N 376.544 5.078 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N(CC(C)C)c3ccc(C#N)cc3)s2)o1 499306670 KUSKDEUZZUQTCR-UHFFFAOYSA-N 379.485 5.194 30 20 GKED Cc1ccccc1NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 502449611 MECYRGLOKDBCKH-UHFFFAOYSA-N 375.403 5.229 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](Cn1ccnc1)c1ccc(C)cc1C 505035123 JSKNHZFCYRRBRU-HSZRJFAPSA-N 388.515 5.182 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)N[C@H](C#N)c1ccccc1F 505946688 ARGYSHLKXODWCU-LJQANCHMSA-N 390.414 5.011 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCCc1ccc(-c2csc(C)n2)cc1 508105336 XFABPOQWEYJHDP-UHFFFAOYSA-N 397.569 5.120 30 20 GKED Cc1cc(Cl)ccc1NC(=O)CSc1nc(-c2ccccc2)ccc1C#N 510207248 BXTBGUGMHNRTSZ-UHFFFAOYSA-N 393.899 5.313 30 20 GKED Cc1ccccc1-n1ncc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1C 511149880 KPXDOULEGBOPIF-UHFFFAOYSA-N 398.491 5.342 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)on1 517455328 BQGQKXVTMSVQEY-CYBMUJFWSA-N 397.887 5.499 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)c1nc(O)c2c(-c3ccco3)csc2n1 525503633 LTVQHKLHKFSFLW-JTQLQIEISA-N 397.456 5.521 30 20 GKED C=C(C)CN1CCC(NCc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 533148771 HXPITXJVNYOJCG-UHFFFAOYSA-N 396.387 5.247 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2scnc2C2CC2)cc1Cl 534248967 MKEVPKPSYFHECZ-UHFFFAOYSA-N 395.871 5.590 30 20 GKED C[C@H](NCc1cc(C#N)ccc1F)c1ccc(OCc2ccc(F)cc2)cc1 537101251 FRABRRYUYUTEBQ-INIZCTEOSA-N 378.422 5.266 30 20 GKED COc1ccc([C@@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)c2ccc(C)cc2)cc1 537429646 VDZCULIIIXQUCD-DEOSSOPVSA-N 396.490 5.078 30 20 GKED N#CCCCCN[C@@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 538222229 OWUHEWDOYPQLPN-IBGZPJMESA-N 380.385 5.248 30 20 GKED CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 542024169 XGZDRRWUHLCWAN-HXOBKFHXSA-N 384.483 5.132 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1c(CC)cccc1CC 553892436 PTJBVZSKIZEFRK-OAHLLOKOSA-N 390.980 5.542 30 20 GKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555007828 UAMXYJUNRSLFAR-HRAATJIYSA-N 378.476 5.178 30 20 GKED Cc1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)ccc1C#N 556407543 LFIJBSCENKFHJR-NRFANRHFSA-N 388.433 5.143 30 20 GKED N#CCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)c1ccccc1 561658336 PGYZGBGCKAEPHI-KMDXXIMOSA-N 387.527 5.227 30 20 GKED C=CCn1c(-c2c[nH]c3ccccc23)nnc1N1CCC[C@@H]1c1cccs1 562032450 FZNJGQDASGSEDB-GOSISDBHSA-N 375.501 5.015 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(Cl)cc(F)c1Br 569011925 TVROREVXMYPIRS-UHFFFAOYSA-N 382.660 5.613 30 20 GKED Cc1ccc(OCc2nc(CN[C@H]3CCCc4cc(C#N)ccc43)cs2)cc1 571745802 JANBWJNAPMITNK-QFIPXVFZSA-N 389.524 5.069 30 20 GKED COc1cc(CSCc2cccnc2C)ccc1OCc1cccc(C#N)c1 589575366 YGHKHWTYKJCPPN-UHFFFAOYSA-N 390.508 5.283 30 20 GKED N#CC[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)C1 596297598 RTRIUOMLQVBMNS-CYFREDJKSA-N 383.495 5.264 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)C(F)(F)F 599390761 PKZQMTLLIUOBMY-VIFPVBQESA-N 384.345 5.238 30 20 GKED CSc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 602493467 KEFKWOMITGRONH-VIFPVBQESA-N 382.388 5.120 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Cl)ccc3Cl)cn2)cc1 603763867 JEEFTVLFXFSSPZ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1F 603946407 ZDXIANBFKTVDER-UHFFFAOYSA-N 396.218 5.024 30 20 GKED N#CCCN(C(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(F)cc1 609522207 BONPBFZHVCDIEK-UHFFFAOYSA-N 393.270 5.908 30 20 GKED Cc1nc2ccccc2nc1CN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 609631475 JTTFSBKZIDNMIJ-UHFFFAOYSA-N 396.469 5.151 30 20 GKED C[C@H](c1ccccc1)N1CCC(Nc2c(C#N)cnc3c(F)cc(F)cc23)CC1 609704142 BPXKTMZFPHOLRD-OAHLLOKOSA-N 392.453 5.022 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 609773525 IVHTWHRIVMSXFH-IBGZPJMESA-N 397.906 5.028 30 20 GKED CCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 610355386 PFRLLOMLOAXDQP-HUUCEWRRSA-N 389.421 5.431 30 20 GKED C[C@@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cccc(C#N)c1 610830299 KSLVYGYIAZKBJW-AUUYWEPGSA-N 377.488 5.549 30 20 GKED N#Cc1cc(CSc2ncnc3cc(-c4ccc(F)cc4)sc23)ccn1 610956998 IIILCIALSDTEMR-UHFFFAOYSA-N 378.457 5.056 30 20 GKED CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1c(Cl)cc(C#N)cc1Cl 611094231 BXPPFJGMPUIFOR-BMLIUANNSA-N 397.689 5.024 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(Oc3nccs3)c2)c(C#N)s1 611359715 LMIYMGGUJCTUDT-UHFFFAOYSA-N 383.498 5.418 30 20 GKED N#C[C@H](C(=O)c1cc2cc(F)ccc2s1)c1nc2cc(Cl)ccc2s1 613403059 LUALQHQBZZYODL-GFCCVEGCSA-N 386.860 5.794 30 20 GKED O=C(Nc1ccc(F)c(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618539020 GDIQNABKDANXPO-OCAPTIKFSA-N 392.702 5.074 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)oc2ccccc12 620304095 ATNXOYNIHYOELS-CYBMUJFWSA-N 394.402 5.633 30 20 GKED Fc1cccc(-c2cnc(CN3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)o2)c1 673856485 MGOCTXJTFUDUIA-RYUDHWBXSA-N 396.306 5.043 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCc1ccc(Cl)c(Cl)c1 726317705 CJMPZDMIDYYPSN-OAHLLOKOSA-N 399.277 5.308 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)c(OC)c1OC 727780158 IHVRTEGDJREPED-ZRDIBKRKSA-N 395.480 5.040 30 20 GKED CCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730422408 XKHRDKTXOOOOCL-KRWDZBQOSA-N 394.471 5.227 30 20 GKED COCCc1ccc(Oc2ccc(N=Cc3cccc(OC)c3O)cc2)cc1 730950302 CTTHWWWZZPOSKW-UHFFFAOYSA-N 377.440 5.133 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4ccccc4SCCC#N)cc3c2C1 731014860 MXLPVFCZNGTOOB-OAHLLOKOSA-N 389.524 5.551 30 20 GKED Cc1c(C(=O)/C=C\c2c(Cl)nc3ccccn23)cnn1-c1cccc(Cl)c1 731565722 ZCPWHGJZWDZVFZ-HJWRWDBZSA-N 397.265 5.031 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(Cc2cccc(C)c2)CC(C)C)c1 733808240 YTAWRIVTABXFMI-JOCHJYFZSA-N 393.531 5.044 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)NC(C3CC3)C3CC3)cc2Cl)cc1 734756701 UIGJBPMIWKIBBU-UHFFFAOYSA-N 397.931 5.479 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 735171987 QPUAXGWLFWMCSC-LJQANCHMSA-N 375.497 5.460 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1cccc(Cl)c1 737323243 QYSKLNMMKTXSKS-CQSZACIVSA-N 389.307 5.757 30 20 GKED CC(=NNc1nc(-c2ccc(Cl)cc2)no1)c1cccc(-c2ccncc2)c1 741460822 QJILURMBMWZXGJ-UHFFFAOYSA-N 389.846 5.288 30 20 GKED C[C@@H](NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 743776778 HAVMNGJRKSCKTG-CTFRJJSNSA-N 376.456 5.177 30 20 GKED C=CCn1c(SCc2cscn2)nc2cc(-c3ccccc3)sc2c1=O 749787927 ITSGIQDRGRACNQ-UHFFFAOYSA-N 397.550 5.060 30 20 GKED C=CCC[C@@H](NC(=O)CCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 749948406 JOPSINBKODAJPG-QGZVFWFLSA-N 382.451 5.227 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2c[nH]c3cc(Cl)ccc23)cc1OC 750911949 BDQHJWCMBSBDSX-VMPITWQZSA-N 385.847 5.133 30 20 GKED C/C(=C\C(=O)Nc1ccccc1SCCC#N)c1ccccc1OC(F)F 753218975 ASNULLOPCOIKKN-BUHFOSPRSA-N 388.439 5.336 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C/c1ccnc(Cl)c1 757933402 LQBUSXOIEHVSTM-RUDMXATFSA-N 389.842 5.359 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccccc3SCc3ccccc3)o2)c1 760447597 FHTIRDOTYNHMHJ-UHFFFAOYSA-N 398.491 5.513 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2SC(F)F)c2ccccc21 767478680 ZDFIRFKLDMZNLD-UHFFFAOYSA-N 385.439 5.512 30 20 GKED Cc1nc(O)c(C#N)c(C)c1CCC(=O)O[C@H](C)c1sc2ccccc2c1C 767566800 QWOYLDNJJZYOCP-OAHLLOKOSA-N 394.496 5.036 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C 767851897 SHEUDHHBIHRCFT-NRFANRHFSA-N 395.503 5.157 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1Cc2ccccc2C[C@@H]1c1nnc(C)o1 775488725 LTQRIKUYAQDQJA-PGRDOPGGSA-N 397.563 5.781 30 20 GKED N#C[C@H](C(=O)c1ccc(N2CCCCC2)cc1)c1nc(-c2ccccc2)cs1 777303499 BHQFIVNKQGSNEV-HXUWFJFHSA-N 387.508 5.290 30 20 GKED C[C@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(C#N)c(F)c1 777657213 CIZFRHWQHWXANY-AWEZNQCLSA-N 381.838 5.498 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(OCc3cccc(C#N)c3)cc2)cc1 779594055 BXYNNMVYOJDLIU-UHFFFAOYSA-N 396.494 5.099 30 20 GKED Cc1cccc(-c2nnc([C@H](C)Sc3ccc(C#N)c(C(F)(F)F)c3)o2)c1 782233753 FGIJGAZVEYQKAB-LBPRGKRZSA-N 389.402 5.789 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC(C)(c2ccc(Cl)cc2)CC1 791861143 HIBXITADBFMHOD-INIZCTEOSA-N 397.906 5.216 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567716 ASCQJSFEACFVKO-PBHICJAKSA-N 378.497 5.238 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)s1 797571154 MDJVWCTXQSCICH-CQSZACIVSA-N 392.446 5.367 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)cc1 797571885 WQRJNKPZGZDTRT-BXUZGUMPSA-N 391.334 5.183 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc(C2=CCCC2)cc1 810530379 CFSPYADOQREHCN-QGZVFWFLSA-N 399.277 5.522 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(SC(F)F)cc3)cc2)ccn1 810822352 XAWQEOGWTUSKMC-UHFFFAOYSA-N 397.406 5.313 30 20 GKED Sc1nnc([C@H]2CCCCO2)n1N=Cc1ccc(-c2ccccc2)c(Cl)c1 863097191 FDTYCCMEJRSJQA-GOSISDBHSA-N 398.919 5.011 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1 915085976 GOALZLSKXOMILV-RUZDIDTESA-N 376.459 5.676 30 20 GKED Cc1nc2ccccc2c(=O)n1N=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 916292509 ANLMIJLJLXTXTO-UHFFFAOYSA-N 398.249 5.154 30 20 GKED C=CCn1c(C2CC2)nn(CN(CC)Cc2ccc3ccccc3c2)c1=S 919954269 VEIFZAWSHJNVPQ-UHFFFAOYSA-N 378.545 5.110 30 20 GKED Cc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3C(=O)O)c2)c(C)c1 1776132727 CWXQLQGGHYYQPI-QBFSEMIESA-N 386.447 5.477 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)c1 1776341515 WQXJKXSTLYFZPS-JXMROGBWSA-N 390.435 5.445 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(CC2CCC2)c1 1776355379 FRIPSUHITRHTTP-LUAWRHEFSA-N 378.468 5.411 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C(C)(C)C#N)cc3)s2)cc1 25438892 JGTHEGZLEKJIES-UHFFFAOYSA-N 391.496 5.181 30 20 GKED COc1cc(OC)c(NC(=O)c2ccccc2-c2ccccc2C#N)cc1Cl 25724310 HMTWUBIGIAYVTB-UHFFFAOYSA-N 392.842 5.148 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1OCC 41546765 HXWGKRSKSRMPNV-CQSZACIVSA-N 398.846 5.159 30 20 GKED N#C[C@H](C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1)c1ccccn1 49457914 ASVQCNXCDRUTHV-SFHVURJKSA-N 384.332 5.397 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 65744036 JEMQMTWRUZTQNB-AWEZNQCLSA-N 394.377 5.035 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 66903733 AXZDKZXSBOULQG-GOSISDBHSA-N 385.467 5.407 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(Oc2ncccn2)cc1C 70048158 DZALALKNFHRSIT-UHFFFAOYSA-N 380.492 5.178 30 20 GKED O/C(CN1CCc2cc(F)ccc2C1)=N\c1c(Cl)cccc1C(F)(F)F 91892225 SRILKVGWHVDIRW-UHFFFAOYSA-N 386.776 5.144 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccccc2F)cc1Cl 107876495 VULRQAGDDDAXTO-SFHVURJKSA-N 394.833 5.152 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)Nc1ccccc1SCCC#N 108200343 NFNRFVLIBPSRSN-ZDUSSCGKSA-N 376.934 5.465 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCc1ccsc1 108241968 RULWVOMMWAHSCU-UHFFFAOYSA-N 384.448 5.344 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccoc2)n1)c1nc2cc(Cl)ccc2s1 108624779 AFDJDYLWYRHCCD-NSHDSACASA-N 385.857 5.156 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(CCC#N)CCCN(C)C 120318627 DTNOJRSSTOFXKV-UHFFFAOYSA-N 398.938 5.015 30 20 GKED C=CCn1c(SCc2cc(Cl)nc3ccccc23)nnc1-c1cccnc1 126166014 YPPMREXSRHQZNU-UHFFFAOYSA-N 393.903 5.020 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)SCCCOc2cccc(C#N)c2)c(C)c1 126498481 PDKMAAAXWNSGKM-SFHVURJKSA-N 382.529 5.013 30 20 GKED N#Cc1ccccc1NC(=O)CCCC(=O)Nc1cccc(Nc2ccccc2)c1 151689037 KXXFIWSOSILMJN-UHFFFAOYSA-N 398.466 5.049 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c2c(C(C)C)noc2n1 170974206 WOHCLTFVRWYJFM-CYBMUJFWSA-N 394.500 5.159 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1cccc(O)c1 171307777 WZEKGDYFVAZQKE-INIZCTEOSA-N 388.492 5.047 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](Oc2ccccc2)c2ccccc2)n1 177748843 NBINXRQWRSGYCO-RXVVDRJESA-N 376.481 5.263 30 20 GKED COc1cccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2cc(F)ccc2OC)c1 181847636 OYKBSOKHHMOWHQ-UPCLLVRISA-N 390.458 5.155 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc3cc(OC)ccc3c2)cc1OC 206859025 IDZZQKSRTGCMRN-WDZFZDKYSA-N 392.451 5.160 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(CNc3ccc(Cl)c(C#N)n3)c2)c1 301187761 WJUYFGILPVFZJC-UHFFFAOYSA-N 391.862 5.171 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3c(Cl)nc4sccn34)cs2)cc1 303888082 JWSOYVOTQWKXPC-VOTSOKGWSA-N 385.901 5.377 30 20 GKED Cc1cccc(Cc2cnc(N=C(O)[C@@H]3CCC(=O)[C@@H](C)C3)s2)c1Cl 328942341 UAXIVVFNMNYIPV-GXTWGEPZSA-N 376.909 5.289 30 20 GKED N#Cc1c(N=C(O)CCN2CCC[C@@H]2c2cccnc2)sc2c1CCCCC2 329484146 QJNDGGGDHYELIV-LJQANCHMSA-N 394.544 5.099 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCC([C@@H]2C(O)=Nc3cc(Cl)ccc32)CC1 329507057 HQMCTARZDVSHKL-QKKBWIMNSA-N 379.891 5.370 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)[C@H](C)c1ccc(C#N)cc1 409803986 ZWYVAYVMLIQEOW-ZNZDAUKMSA-N 387.310 5.578 30 20 GKED CC(C)(c1ccc(NCc2cccc(OCCCC#N)c2)cc1)C(F)(F)F 428548371 QMTNACZUSGTFMT-UHFFFAOYSA-N 376.422 5.821 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(Cl)cc(Br)c2)s1 430631309 UMJSMXUJHSEUFH-GFCCVEGCSA-N 397.725 5.347 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(Br)cc1F)c1ccccc1 431692012 NJWJKRAMJQVESD-INIZCTEOSA-N 390.256 5.145 30 20 GKED Cc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Br 432685484 GIRNBJYHTZYFCY-SFHVURJKSA-N 386.293 5.314 30 20 GKED CO[C@@H]1CCC[C@@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 432713056 GZDRRXBIYPWYIK-YVWKXTFCSA-N 382.891 5.139 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(C)(F)F)cc1 433139673 CDVMKBKXGMCIEZ-AWEZNQCLSA-N 389.471 5.514 30 20 GKED N#C[C@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1cccc(Cl)c1Cl 436019733 COQVHXPASZFYHS-ZPPKWKGLSA-N 379.209 5.043 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F 437844873 IYZHIIDUDMHROF-QRWLVFNGSA-N 381.451 5.100 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H](C)c1ccc(F)cc1F 438052268 IJMKHDYVMSLDDQ-KBPBESRZSA-N 389.471 5.284 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638856 ZECUCGCVWMDOCG-LLVKDONJSA-N 381.785 5.455 30 20 GKED C=CCC[C@H](NCc1cnc(C(F)(F)F)s1)c1ccc(C(F)(F)F)cc1 443993665 MWGIJLYHJBWURV-AWEZNQCLSA-N 394.384 5.978 30 20 GKED CC(C)(C)C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)C(F)(F)F 444267324 HHXXQGBVVWYIQT-KRWDZBQOSA-N 379.426 5.042 30 20 GKED N#CCCCn1cc(C(=O)NC[C@H](c2ccccc2)C(F)(F)F)c2ccccc21 444284397 UFUDDYGQILHVPD-LJQANCHMSA-N 399.416 5.021 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(COCc3ccco3)c2)CCCC1(C)C 444856114 JDOBQCDSYPTKFS-OAQYLSRUSA-N 382.504 5.595 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458857481 ZSMHGHHZVBXUFN-GOTSBHOMSA-N 391.515 5.149 30 20 GKED Cc1ccc(-c2nc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)cs2)cc1 464938910 VXAPUEFFXQQSGD-FPOVZHCZSA-N 387.508 5.031 30 20 GKED CC(C)C[C@@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 467715246 QPGYSYUVSQSQPO-SFHVURJKSA-N 395.478 5.176 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)cc1 469465128 QXDSKWXTGTZIER-UHFFFAOYSA-N 397.469 5.253 30 20 GKED COc1csc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 473658465 LYGGQQCKPJVJKN-KRWDZBQOSA-N 382.872 5.318 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCC1(CCOCC)CCCC1 473669246 HGIXMJUBDIYNHW-UHFFFAOYSA-N 384.973 5.086 30 20 GKED N#CC[C@H](CC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1)c1ccccc1 475935047 XEVWQNZNJBJYLN-LJQANCHMSA-N 389.474 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccc(C(F)(F)F)cc1 476168726 XSOGVMLWSHOKPE-OAHLLOKOSA-N 391.433 5.963 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)CC(C)(C)C(F)(F)F 479881885 IJYUBVUACSODRO-UHFFFAOYSA-N 396.222 5.081 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cn(CC(C)C)nc1C(F)F)c1ccc(F)c(F)c1 481082596 NSMQYJJRTHRQAL-MRXNPFEDSA-N 398.404 5.194 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3OC(F)(F)F)c2)cc1 481952408 MAJCEDNWPBMUBY-UHFFFAOYSA-N 398.340 5.501 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc(-c2ccccc2)cs1 484549359 VGIAKUKIZJMNJM-KRWDZBQOSA-N 386.432 5.685 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 488323215 IIFDDOKBHNFLMV-CMKODMSKSA-N 393.556 5.799 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 488672020 INESVQBWLCYSCX-QHCPKHFHSA-N 395.462 5.109 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2ccccc2Br)c1 490138379 UUICQKOFZJZCIM-NRFANRHFSA-N 377.285 5.200 30 20 GKED CO[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 504078974 WUILYUXDVYPZAQ-RBBKRZOGSA-N 390.870 5.322 30 20 GKED C=CCCc1ccccc1NC(=O)CNC(=O)c1sc2ccccc2c1Cl 504283287 AGXIGWBVLMFGEE-UHFFFAOYSA-N 398.915 5.042 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1Sc1cccc(F)c1C#N 506875028 OTUIQFKOJIHLNA-UHFFFAOYSA-N 396.491 5.065 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1nc2ccccc2o1 507008529 SKQXBGNIBBVEQI-GOSISDBHSA-N 388.810 5.764 30 20 GKED CCN(C(=O)CCCC(=O)c1c(C)cc(C)cc1C)[C@@H](C)c1ccc(C#N)cc1 509568406 DHWYVKVTYFNPIZ-FQEVSTJZSA-N 390.527 5.446 30 20 GKED N#CC1(c2ccc(C(=O)N3CCc4ccccc4[C@@H]3c3ccccc3)cc2)CC1 512537907 AAMCJWPLAFQAEZ-DEOSSOPVSA-N 378.475 5.030 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1 517349032 JKFFQCVWZWECET-INIZCTEOSA-N 398.576 5.241 30 20 GKED N#C[C@@H](NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1cccc(C(F)(F)F)c1 521016246 UQFWQIWZOYJVEQ-HXUWFJFHSA-N 397.400 5.060 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 522027037 MJMSIRFHJCRFBT-UUOWRZLLSA-N 396.494 5.228 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1ccc(F)cc1 524406613 PDFPUFRUQRLHHA-UHFFFAOYSA-N 375.403 5.229 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC[C@@H]2c2cccc(Cl)c2)c1 524436737 ICQHLJWDMBZGRQ-MRXNPFEDSA-N 391.805 5.182 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1ncc(-c2ccc(Cl)cc2)o1 530733438 CZTBRKPYSFCRAD-WOJBJXKFSA-N 377.875 5.267 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nc2sc(C)c(C)c2c1=O 537557712 PZAIICFBGIFBDE-ZDUSSCGKSA-N 397.525 5.255 30 20 GKED Cc1ccc(C(=O)Nc2cc(CC#N)ccn2)c(Sc2ccc(Cl)cc2)c1 546756623 XXBSCUAZVMJEQE-UHFFFAOYSA-N 393.899 5.513 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)ccn1 567433812 CDLAAMNDYMGTHL-ZIAGYGMSSA-N 389.377 5.053 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(C)C[C@H]1c1ccccc1 577916727 IPAXCHCYUXATHE-QFIPXVFZSA-N 377.532 5.059 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)[C@]3(C#N)CC34CCCC4)s2)cc1 581766356 NUMDJZFQHUXSRW-KSFYIVLOSA-N 379.529 5.078 30 20 GKED N#Cc1ccc(-c2nc(Cc3nc4cc(Cl)ccc4s3)no2)cc1Cl 584018975 HVNJSRZALMKUTO-UHFFFAOYSA-N 387.251 5.116 30 20 GKED N#CCCCn1cc(-c2nc(Cc3cccc4cccnc34)no2)c2ccccc21 584495137 RYPAZRIGGHSWHI-UHFFFAOYSA-N 393.450 5.134 30 20 GKED N#CCc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 588988405 WZBRHAHAFMDLKZ-UHFFFAOYSA-N 387.826 5.322 30 20 GKED CCCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H](C)c1ccc(C)o1 590942335 KUHPPBSPLHPNNA-PZJWPPBQSA-N 381.520 5.896 30 20 GKED CCCCn1c(S[C@H](C#N)c2ccc(Cl)cc2)nnc1[C@@H](CC)N(C)C 594884557 ZYDYRQXRTSGFBU-IAGOWNOFSA-N 391.972 5.101 30 20 GKED C[C@H](N[C@@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)cc1F 595075969 DZJPMYLWDPNCIP-BBATYDOGSA-N 391.309 5.099 30 20 GKED CCc1c(C)sc(NC(=O)c2csc(-c3c(F)cccc3F)n2)c1C#N 609031832 XMAXUPLSOFLILX-UHFFFAOYSA-N 389.452 5.145 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 609080347 HLGOWDOSGJTOAS-RTBURBONSA-N 399.494 5.889 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)c1 609429665 WYXFBDFIWPPMJA-UHFFFAOYSA-N 380.403 5.863 30 20 GKED CC[C@H](C)[C@@H](C)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CC1 609644191 PVACAMDVAZZSGE-ZWKOTPCHSA-N 376.500 5.176 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(CCc2ccc(Cl)cc2)CC2CC2)cc1 609743684 IAINSJMTCOSYGI-UHFFFAOYSA-N 395.934 5.628 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)c(Cl)c2)c2ccc(F)cc2)cc1 619754585 FAIFPNRZYCKMIE-QFIPXVFZSA-N 380.850 5.239 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H]1CCCCC1(F)F 622485548 QKNFWROSOUOSIK-RYUDHWBXSA-N 389.286 5.251 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)c(F)c1 673627894 XAPYWIARLFFSQF-JMJZKYOTSA-N 375.303 5.525 30 20 GKED FC(F)(F)c1cnc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)s1 682916164 DDGDYAVQOMOHJX-WDSKDSINSA-N 386.283 5.483 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 726143205 ZWOBHCQZVNNHOY-QFIPXVFZSA-N 393.446 5.558 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1Cl 726473880 ABQRRCAQYDVGJE-INIZCTEOSA-N 394.931 5.269 30 20 GKED N#C[C@H](C(=O)CSCc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 727090827 BZLGTEMTCPSKCI-QGZVFWFLSA-N 398.940 5.573 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCCCCC1 728119025 GPNIQTRMPZVDLT-UHFFFAOYSA-N 377.488 5.244 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C/c1csc(-c3cccs3)n1)CC2 728440494 PAQXKXBSDSZESR-FMIVXFBMSA-N 399.493 5.162 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 733031119 NJTYEFDCXYYUTC-DQEYMECFSA-N 397.522 6.203 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1sccc1C 733744773 QJQQFNPVYWCQIO-UHFFFAOYSA-N 382.489 5.703 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680111 QOZIKWKKROJIFM-KDOFPFPSSA-N 377.410 5.120 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2ccc(S(C)(=O)=O)c(F)c2)c1 741848079 VHGJCGRKCJDHEU-BENRWUELSA-N 394.467 5.101 30 20 GKED C[C@@H](CCNCc1ccc(N(C)CCC#N)cc1)c1cccc(C(F)(F)F)c1 746053208 JBPQXQGAZXWRJP-KRWDZBQOSA-N 389.465 5.339 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1cccc(OCc2ccccc2)c1 746497856 DYZJJMXHPDLCNQ-UHFFFAOYSA-N 388.471 5.259 30 20 GKED C[C@H](C=Nn1cnnc1SCc1ccc(Cl)cc1)CCc1ccccc1 749158978 VRZXSFCBDKFUCM-INIZCTEOSA-N 384.936 5.327 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2nc(-c3cc(Cl)ccc3Cl)cs2)cn1 753899957 BRPAMQQEYIJBRL-WAYWQWQTSA-N 392.311 5.790 30 20 GKED O=C(/C=C/c1ccc(OC(F)F)c(F)c1)c1sccc1Br 754684238 FRXZDBPMLCLGCI-HNQUOIGGSA-N 377.181 5.147 30 20 GKED Cc1nc2ccc(C=Nn3cnnc3SCc3ccc(Cl)cc3)cc2s1 754919353 XSDUSTXBKVLQLN-UHFFFAOYSA-N 399.932 5.024 30 20 GKED Cc1ccc(-c2c(C)sc3nc(CN(CCC#N)CC(C)C)nc(O)c23)cc1 755673492 YMRYUGXDNHXKRF-UHFFFAOYSA-N 394.544 5.052 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)OC3CCCCCC3)n2)cc1 761048958 OMLAIUSZRDLPPV-LPHOPBHVSA-N 382.529 5.423 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1 761668830 RBJKZEJZOJOAMF-UHFFFAOYSA-N 399.441 5.234 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 766619282 VABLKOQVCBRFPB-FZMZJTMJSA-N 385.286 5.039 30 20 GKED CCCCOc1ccc(C=NO[C@@H](C)c2noc(-c3ccccc3)n2)cc1OC 789578278 WNYQZONUOAKNJE-INIZCTEOSA-N 395.459 5.036 30 20 GKED N#C[C@@H](C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1nccc2ccccc12 792096401 OORROFSUJVLEPQ-GOSISDBHSA-N 398.359 5.301 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(Cl)c1SC(F)F)c1ccccc1 793335566 FTZQZPUVQKFBOA-CYBMUJFWSA-N 380.847 5.681 30 20 GKED Cc1nc(-c2ccccc2NC(=O)Nc2ccccc2O[C@H](C)C#N)cs1 797669262 JUMVIHNGVSFGHN-CYBMUJFWSA-N 378.457 5.053 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(OCC(F)(F)F)c(Cl)c2)cc1 800290673 NMMUKFKIIAGFHE-UHFFFAOYSA-N 397.828 5.243 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2ncc(-c3ccccc3)s2)C(=O)c2ccccc21 802709113 ZQSJGMLHGRCOJL-NRMGUKERSA-N 389.476 5.127 30 20 GKED O=C(/C=C\c1ccc(Oc2cccc(Br)c2)cc1)c1ccnc(O)c1 806556735 YUVQGMCHUANWLZ-TWGQIWQCSA-N 396.240 5.238 30 20 GKED N#Cc1ccc(C(=O)O[C@H](c2ccc(C(F)(F)F)cc2)C(F)(F)F)s1 809126354 LTBIEGBMQYYYRF-GFCCVEGCSA-N 379.281 5.099 30 20 GKED C[C@H](OC(=O)CCCC#N)c1nc2cc(Cl)ccc2n1Cc1ccccc1 812617138 FOGAASCEVKYPLL-HNNXBMFYSA-N 381.863 5.036 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C2(c3cccc(OC(F)(F)F)c3)CC2)n1 845480823 PQDLQIBJMHQVTC-AWEZNQCLSA-N 394.418 5.073 30 20 GKED CC(C)c1ccoc1-c1noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n1 848613158 DEMSOYVTHJAJTL-OAHLLOKOSA-N 388.468 5.103 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1 858248598 CKKCEFQESCLZPF-UHFFFAOYSA-N 377.488 5.225 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2c(OC(F)F)ccc3ccccc23)cc1 916151835 FLYDOQQXDPVMHF-KHPPLWFESA-N 379.362 5.240 30 20 GKED N#Cc1ccccc1/C=C\C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 917043685 NLYNFXRFCMTUDU-ZQMJAJRESA-N 397.381 5.076 30 20 GKED COc1cc(/C=C/C(=O)C2CCCCC2)cc(Br)c1OC(F)F 917143640 NVXMEMIONUUFEP-BQYQJAHWSA-N 389.236 5.222 30 20 GKED N#C[C@@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1nc2ccccc2o1 917509798 AEJIANBCPQLXKN-MOKGIYGOSA-N 388.423 5.445 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Oc1ccc(C#N)cc1 920021005 ZBBMHWWUXDOUOC-CYBMUJFWSA-N 398.871 5.094 30 20 GKED Cn1cc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)c(-c2ccncc2)n1 920066169 SWCXGYJXGOBOMM-DHZHZOJOSA-N 389.524 5.413 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1cc(F)ccc1SC(C)(C)C 1776075005 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HLNIAXVIHXSPFQ-MRXNPFEDSA-N 389.455 5.597 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1CCC(F)(F)CC1 682732929 OCQYTDRMJUDMJV-XEZLXBQYSA-N 381.351 5.700 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1 733842005 OWGBHWATGVCOKI-QGZVFWFLSA-N 399.922 5.467 30 20 GKED CC(=NOCc1nccn1CC(F)(F)F)c1ccc(-c2ccc(F)cc2)s1 736608718 MGSBTCVQRZTRQE-UHFFFAOYSA-N 397.397 5.254 30 20 GKED Cc1ccc(SCC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 739595114 VVLRLXPCUGISGG-UHFFFAOYSA-N 378.522 5.004 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnc3ccc(Cl)cn23)cc1 741470746 UKHUCVXOPMARMJ-VAWYXSNFSA-N 388.854 5.559 30 20 GKED CC(=NOCc1nc(-c2ccoc2)no1)c1ccc(-c2ccc(F)cc2)s1 742355146 XBSZRWDHWUQGOU-UHFFFAOYSA-N 383.404 5.138 30 20 GKED CCOc1cccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c1 743002058 CTJPXQYBURTCNQ-UHFFFAOYSA-N 393.537 5.172 30 20 GKED C[C@H](NC(=O)Nc1ccc(N(C)Cc2ccccc2)cc1)c1cccc(C#N)c1 743114642 GWGLUICTFJJCJO-SFHVURJKSA-N 384.483 5.077 30 20 GKED CC(=NNc1ccc(C#N)cc1)c1cnn(-c2ccc(Cl)cc2Cl)c1C 743438540 VQFRYEMUBDZUJG-UHFFFAOYSA-N 384.270 5.195 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 744028531 LUXYCIBHJOIEIP-QFIPXVFZSA-N 399.494 5.037 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3ccccc3OC3CCCC3)cc2N1 758027264 VTVGUUPXIBPULU-KTKRTIGZSA-N 385.510 5.010 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)COc2cc(Cl)cc(Cl)c21 758912078 LNDBRPUIBJUOMH-BJMVGYQFSA-N 389.263 5.171 30 20 GKED C[C@@H](C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1cccc(Cl)c1 764749925 DBFLIKGADLBMIW-SSDOTTSWSA-N 398.677 5.158 30 20 GKED C[C@@H](C#N)Oc1ccc(CN(C)[C@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 770323267 FZWGJDCNWVROII-SCLBCKFNSA-N 382.813 5.366 30 20 GKED C[C@@H](CCCC(F)(F)F)OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 774732963 XPCHWITTYWBQLZ-ZDUSSCGKSA-N 378.350 5.023 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2sc(C3CCCCC3)nc2C)c1 775168722 XHOCCOUEDFHPOJ-SFHVURJKSA-N 397.544 5.110 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CON=Cc2ccccc2OC(F)F)c1 775678342 ZDIHHAFFANDRCY-UHFFFAOYSA-N 392.402 5.186 30 20 GKED C=CCC[C@H](C(=O)OCC(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 778558533 CIHGOZSNKOBFCC-NRFANRHFSA-N 379.500 5.350 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cnc1N1CCCC[C@H]1C 779726096 UECKBHISEFOCSE-CQSZACIVSA-N 399.951 5.103 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)Cc2csc(-c3cccc(F)c3)n2)s1 797569953 BYNAEAUPFXVHEV-HNNXBMFYSA-N 399.516 5.122 30 20 GKED C[C@@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccc(OCC#N)cc1 810243945 NMZWDNRZZLDJRQ-ZUOKHONESA-N 375.299 5.698 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cc(N)ccc1F 814765764 SBBPGXIUQJGHFQ-UHFFFAOYSA-N 395.438 5.055 30 20 GKED N#Cc1cc(CSC2=NC(=O)/C(=C\c3csc4ccccc34)S2)ccn1 814771104 LJDPFNOZNAXYBV-CAOOACKPSA-N 393.518 5.072 30 20 GKED C=CCC(C)(C)c1noc(CC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 815709344 ZXPVNTOXFUGFLB-KRWDZBQOSA-N 385.508 5.122 30 20 GKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1ccc2nc(O)[nH]c2c1 834835653 IGORMONONIFUSF-TWGQIWQCSA-N 387.420 5.034 30 20 GKED CO[C@@H]1CC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 850765153 UFJGPKUMTPTZEK-SUHUHFCYSA-N 395.311 5.108 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)c1nc2cc(Cl)ccc2s1 850771696 WMNXALOFVQTSNC-GRYCIOLGSA-N 386.826 5.495 30 20 GKED O=C(c1ccc(-c2nc3ccccc3s2)s1)N(O)Cc1ccc(F)cc1 901379187 RNJGLHGBIKTIMH-UHFFFAOYSA-N 384.457 5.196 30 20 GKED C=CCc1ccc(OCc2nc(-c3ccsc3C(F)(F)F)no2)c(OC)c1 904927318 XNHANTHSBIILKD-UHFFFAOYSA-N 396.390 5.133 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(Cl)cc2)cc1 915124366 HLZUFXXDAIGDHT-HXUWFJFHSA-N 377.900 5.804 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1OC 915352017 FHRNAQPFRXNAFF-DHIUTWEWSA-N 399.494 5.623 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccc(Cl)cc2)cc1 916947639 PBAAJTIAFKZAGJ-SIIXWHAESA-N 380.875 5.214 30 20 GKED C=CCCO[C@@H](C)C(=O)Oc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 921149577 VLQRBXXFDVXXFA-KRWDZBQOSA-N 395.499 5.123 30 20 GKED CC(C)c1ccc(NN=Cc2ccccc2OCc2ccc(C(=O)O)o2)cc1 1776060272 MNXMPJRRZFNOHQ-UHFFFAOYSA-N 378.428 5.126 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2ccccc2OCCC(=O)O)cc1 1776125990 YYSHUPHMXKBIRH-SDNWHVSQSA-N 382.456 5.005 30 20 GKED C=CCCC1(C(=O)O)CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 1776168419 MVDKHSBWQVPMIU-OAQYLSRUSA-N 383.919 5.562 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccc(F)cc2)o1 1776354579 NYXZKKKDROFJHN-NTMALXAHSA-N 394.398 5.467 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)c1)C(=O)O 1776470905 LPFGBHWPCMMZGU-RBJHHQRMSA-N 396.826 5.348 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)cc1 1776794138 WIPWVBYWLFDEAZ-WKOYGUFESA-N 382.456 5.004 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c(Cl)c1 1777353248 DWASZFKAJQSKHY-YFHOEESVSA-N 398.867 5.671 30 20 GKED C=CCn1c(SCc2ccc(Br)cc2)nnc1-c1ccoc1C 6911841 QZQBWSOWKDDEGU-UHFFFAOYSA-N 390.306 5.087 30 20 GKED Cc1nc(CSc2ccc(C(=O)N[C@@H](C)c3ccc(C#N)cc3)cc2)cs1 31433381 JMFXOVYQKMETLB-AWEZNQCLSA-N 393.537 5.107 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 41522509 QQRCMNJDOJYHEV-GOSISDBHSA-N 399.475 5.193 30 20 GKED CCCCOc1ccc(-c2nnc(CSc3nc(C)cc(C)c3C#N)o2)cc1 42116865 ABQLALMHIILNEO-UHFFFAOYSA-N 394.500 5.091 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(CCN2CCCC2)cc1 65876646 CTSAAHITAZIECX-UHFFFAOYSA-N 395.506 5.116 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1)c1ccccn1 106983702 ZDRSKPZCOAMHQI-AWEZNQCLSA-N 388.370 5.199 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(-c2ccc(F)cc2)o1 121014462 MNVBPGGRPBQPEU-QGZVFWFLSA-N 386.382 5.081 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(C2SCCCS2)cc1 127880880 SRWIQEMPXHMGFJ-UHFFFAOYSA-N 375.584 5.445 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 128897659 BPVJXUOUEMWQKR-OCCSQVGLSA-N 399.928 5.216 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(CCC#N)Cc1ccccn1 128995965 CPZZNSBBGMDHEB-UHFFFAOYSA-N 382.533 5.228 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 131948171 GFISSKZQWRDMOQ-KSSFIOAISA-N 375.394 5.111 30 20 GKED C=CCNC(=O)Nc1ccc(N[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)cc1 154548031 FOBQKOWNXLQTJK-AWEZNQCLSA-N 396.878 5.476 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 171740738 JBAADFXKPQGYSR-HNAYVOBHSA-N 399.947 5.961 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Cc2cccc(C(F)(F)F)c2)n1 177746603 WPFLOZGKXKOUHJ-WFASDCNBSA-N 380.435 5.340 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1nc(-c2cccs2)no1 189899717 WXZXSUKXRQSNEM-UHFFFAOYSA-N 395.528 5.611 30 20 GKED CCCCc1nnc(NC(=O)c2ccccc2Sc2ccccc2C#N)s1 255951155 WANHRECXXXJTTH-UHFFFAOYSA-N 394.525 5.156 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/Cc1cc(Cl)sc1Cl 329037703 RSSUNPZHUXBCGX-SECBINFHSA-N 391.345 5.219 30 20 GKED OC(CN1CCCCCC1)=Nc1cccc(N=C(O)[C@@H]2CCC(F)(F)C2)c1 330043411 HFJBAWQJYXPDJS-OAHLLOKOSA-N 379.451 5.174 30 20 GKED OC1=Nc2cc(/C(O)=N/C[C@@H]3SCCc4ccccc43)ccc2SCC1 330194336 ZAKWFKBOFKOPCG-SFHVURJKSA-N 384.526 5.106 30 20 GKED Fc1ccc(NCc2nc(C(F)(F)F)cs2)c(OCCC(F)(F)F)c1 409859607 QNDICBCZDLVHJT-UHFFFAOYSA-N 388.308 5.244 30 20 GKED C=CCC[C@@H](NC(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1)c1ccccc1 413392729 DHFMOUYEAGXIDO-DHIUTWEWSA-N 390.527 5.257 30 20 GKED Cc1oc2ccccc2c1CCNC(=O)N[C@H](CCCC#N)c1ccccc1 431467175 YOUOYYHLHCOGLE-OAQYLSRUSA-N 375.472 5.018 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1C[C@H]1c1ccccc1 432075641 JICRRAJJOHJUHX-LADGPHEKSA-N 397.478 5.123 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1C(F)(F)F 438639916 YWTMPJVNFRTGHV-QGZVFWFLSA-N 377.341 5.085 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)c1cccc(C#N)c1 442772227 VDFVKBQBVQQPQA-CQSZACIVSA-N 383.373 5.937 30 20 GKED Cc1c(C(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)ccc(C(F)(F)F)c1F 442934650 JAPBENXTWBDHRJ-AEFFLSMTSA-N 390.380 5.065 30 20 GKED CCCOc1cc(C)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444030303 DXGLEPXTAJXOOW-UHFFFAOYSA-N 375.472 5.295 30 20 GKED C=CC[C@@H]1N(C(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CCCC1(C)C 444639262 YYLOUJMRIQCFOP-CTNGQTDRSA-N 383.580 5.087 30 20 GKED C[C@@H](C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 461964389 JZVRGIFMKKNLRV-VLIAUNLRSA-N 380.900 5.282 30 20 GKED C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1ccc(C#N)cc1 466803191 BACZUKYZDOQZOI-GFCCVEGCSA-N 387.270 5.108 30 20 GKED C=CCN(C(=O)c1ccc2nc(C)oc2c1)c1nc(-c2ccccc2)cs1 470735092 ZDFACFXNAMQGHX-UHFFFAOYSA-N 375.453 5.093 30 20 GKED CCN(C(=O)c1cccc(OCc2ccccc2C#N)c1)c1ccc2[nH]ccc2c1 472295971 SIGRNCDQBBNQKF-UHFFFAOYSA-N 395.462 5.285 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1cccc(Br)c1 476141283 HUADKPMPQFMNCM-PMACEKPBSA-N 398.344 6.043 30 20 GKED C[C@H](N[C@@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccc(C#N)cc1 479251155 JHAWRQKYKNQGTG-RYUDHWBXSA-N 397.238 5.751 30 20 GKED FC(F)(F)Cn1cc(CNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 479442815 YUMZSSUXLJAKKL-UHFFFAOYSA-N 391.237 5.095 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 480890751 GFBRRMVMSOQUHG-KRWDZBQOSA-N 395.443 5.450 30 20 GKED Cc1c([C@H](NC(=O)N(C)Cc2cccc(C#N)c2)C(C)C)oc2ccccc12 483744654 JCTMUMUWBDMAMB-OAQYLSRUSA-N 375.472 5.152 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(COc3ccc(C(C)(C)C)cc3)cc2)CC1 507825403 NBHWQFJNGIKJFV-UHFFFAOYSA-N 390.527 5.329 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N(CC2CCCCC2)C2CC2)cc1 510987412 ZQZKJOPXHHQFBH-UHFFFAOYSA-N 395.547 5.077 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)ccc1Cl 513520086 MWYSQENZXNPHMK-UHFFFAOYSA-N 381.307 5.381 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)c(C)c1 516074798 BKYCIQQCGQWALH-UHFFFAOYSA-N 386.520 5.397 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1 519310210 PHSGGKJUWYTLHN-LBPRGKRZSA-N 397.997 5.614 30 20 GKED CC(=O)c1cccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 524250500 FRWGIFNFYQMCQW-UHFFFAOYSA-N 399.450 5.292 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl 524822820 PKLMGECPJDASEK-GHTZIAJQSA-N 390.845 5.304 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc2ccccc2s1 527497256 FEQJHDRZKYHJET-CABCVRRESA-N 395.553 6.178 30 20 GKED N#C[C@H](C(=O)[C@H]1[C@H]2c3cccc(Cl)c3C[C@H]21)c1nc2cc(Cl)ccc2s1 528925008 QWKMBTGVFXRQDK-COCCGSRQSA-N 399.302 5.365 30 20 GKED CC[C@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 533256241 JHWGTOIUQZHKMJ-GHTZIAJQSA-N 395.572 5.493 30 20 GKED C[C@@H](NCc1cccc2c1OCCCO2)c1ccc(-c2cccc(C#N)c2)cc1 542017282 VNVFYGLEDOHKGI-GOSISDBHSA-N 384.479 5.237 30 20 GKED CCc1cc(Br)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 542385148 LXWIGDZPIITQFL-UHFFFAOYSA-N 398.304 5.080 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1ccc(C#N)c(Cl)c1 547959327 ACKQXXGAHNBNBD-CQSZACIVSA-N 395.915 5.477 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCC2)c1nc(-c2ccccc2)cs1 549192224 UXYZINNQDWVECC-INIZCTEOSA-N 378.522 5.631 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(-c3ccc(OC(F)F)cc3)s1)CC2 555771943 AKFOKBHBVQDFDE-UHFFFAOYSA-N 396.418 5.091 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(F)c(Br)c(Cl)c2)c1 557715366 UVGMZGAIFRLJST-UHFFFAOYSA-N 388.023 5.019 30 20 GKED Cc1c(C(=O)N2CC[C@H](CSc3ccccc3)C2)sc2ccc(C#N)cc12 560054336 OBTXRAYSINDERB-KRWDZBQOSA-N 392.549 5.336 30 20 GKED CCN(Cc1nnc(-c2ccc(C#N)cc2)o1)C(c1ccccc1)c1ccccc1 581922778 DLLITCWMLSOYHB-UHFFFAOYSA-N 394.478 5.220 30 20 GKED N#Cc1ccc(CCC(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)cc1 583167046 LNADUTJEXCFXGZ-UHFFFAOYSA-N 387.310 5.204 30 20 GKED N#Cc1ccc(C2(NCc3nnc(-c4ccc(Cl)cc4Cl)o3)CCC2)cc1 594032165 QMJGLJOCHFVYTD-UHFFFAOYSA-N 399.281 5.084 30 20 GKED N#CCCCCC(=O)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1 594052634 UCSPOOMDKDRNFP-UHFFFAOYSA-N 375.516 5.089 30 20 GKED COc1ccc(-c2nc(CSCc3ccc(C#N)cc3)cs2)c(OC)c1 603502770 GFTPEYWAJZBDNV-UHFFFAOYSA-N 382.510 5.132 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cccc4ccccc34)cn2)c1 603622063 IQRFEHCGTGHHEP-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603689929 DYDFUSQXQFZZTH-QFIPXVFZSA-N 398.466 5.423 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2cccc(N(C)C)c2)c1 605197669 CVNJULLANYDXSS-JOCHJYFZSA-N 379.504 5.077 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C[C@@H](C)c2ccc(C(C)C)cc2)cc1 606348594 HJNFBTXCSSQEDT-QGZVFWFLSA-N 379.504 5.250 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1C[C@H]1C[C@H]2CC[C@H]1C2 609435217 YZKUFGBKNPXVOX-CXQPBAHBSA-N 397.588 5.903 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1Oc1cccc(F)c1)c1cccc(C#N)c1 610322662 UWEQGKQBQNBGCL-OAHLLOKOSA-N 375.403 5.372 30 20 GKED C[C@H](NC(=O)NC[C@H](C)c1c(Cl)cccc1Cl)c1cccc(C#N)c1 610355447 QVSGTYGEIZVELB-STQMWFEESA-N 376.287 5.029 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccc(Cl)cc3)n2)sc2c1CCC2 610420801 VMZFBVKODMTWFM-UHFFFAOYSA-N 385.901 5.138 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccccc1S[C@@H](C)CC#N 611205310 SVGWEHDOBZAUAB-LBPRGKRZSA-N 383.904 5.776 30 20 GKED Cc1cc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c(C)c(C)c1O 615497198 QSXJIKVMYODTRO-UHFFFAOYSA-N 388.427 5.020 30 20 GKED C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622842155 FDXGFWBQTPSPPK-SKDRFNHKSA-N 389.286 5.144 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3nc4ccccc4s3)cs2)c1 726427857 ZSPQYECVNKIPGP-KTKRTIGZSA-N 378.478 5.325 30 20 GKED CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726488424 VBPDGXADYMBDQD-YLJYHZDGSA-N 399.947 5.008 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2)CCCC1)c1nc2cc(F)ccc2s1 730422400 XHHZSHFCSFKSPN-INIZCTEOSA-N 382.435 5.263 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)cc1 730948710 KAFZYLYWKCAYJE-WCIBSUBMSA-N 394.448 5.175 30 20 GKED CCc1ccc(/C=C2\SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)s1 731231367 MGUWNIALTZVENB-NVNXTCNLSA-N 390.942 5.241 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(OCc3ccccc3)cc2)cc1 734157291 FQKDACXFKUVAAN-UHFFFAOYSA-N 387.483 5.185 30 20 GKED O=[S@@](Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1)C1CCCCC1 734979661 SSFLMROMSXRMOW-NDEPHWFRSA-N 391.536 5.877 30 20 GKED C[C@H](OC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1ccc(C#N)cc1 735676244 UEAZUCVWDBNAIS-INIZCTEOSA-N 379.419 5.086 30 20 GKED CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738896239 MYORIACEIQVYAX-OFAXGOBFSA-N 375.516 5.775 30 20 GKED C[C@@H](Cc1ccccc1F)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 739157441 WLDLKHLVNBKZCL-SUMWQHHRSA-N 398.890 5.658 30 20 GKED C#Cc1cccc(N(C(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)C(C)C)c1 741186200 RFKOYUUQHQTELV-RBUKOAKNSA-N 387.401 5.112 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)NCc1cc(C#N)ccc1F 743146264 KIUZLXKRESHQED-UHFFFAOYSA-N 375.403 5.120 30 20 GKED Cc1ccc(N=C2NN=C(c3cc(C)n(CC(F)(F)F)c3C)CS2)c(C)c1 750000672 RLWGOAJZNKFZQY-UHFFFAOYSA-N 394.466 5.012 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2c(Cl)oc3ccccc23)S1 761177691 UIEKLUKPXSJVFB-MHWRWJLKSA-N 382.872 5.595 30 20 GKED C[C@@H](OC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1cccc(C#N)c1 764613484 NMJMKELRXLXSPF-MRXNPFEDSA-N 379.419 5.086 30 20 GKED C#CC[C@@H](N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccccc1 773113807 FAEFZNGEDVEJSY-HRAATJIYSA-N 376.525 5.542 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccccc1O[C@H](C)C#N 780667050 FQKBRNZKFABGSQ-QUCCMNQESA-N 379.504 5.161 30 20 GKED Cc1c(C(=O)/C=C/c2cccc(OCc3ccccc3C#N)c2)cnn1C(C)C 787187606 SGXUVFXYRBUXML-VAWYXSNFSA-N 385.467 5.119 30 20 GKED C#CC[C@H](NC(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 790797991 ZUGFFDQPEZVRGL-IBGZPJMESA-N 395.915 5.027 30 20 GKED N#Cc1cccc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c1 796468650 CXPXLCQOLISRJT-QGZVFWFLSA-N 378.690 5.241 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccc3[nH]ccc3c2)cc1 799386688 IEOALCNEDKCTKX-QHCPKHFHSA-N 394.478 5.188 30 20 GKED FC(F)(F)c1ccc([C@H]2CCC(=NNc3ccc(C(F)(F)F)nn3)C2)cc1 799483092 TWOFNCZZHFWITK-NSHDSACASA-N 388.315 5.250 30 20 GKED CCCCCn1cc(C(=O)OCCCC2(C#N)CCOCC2)c2ccccc21 800196091 VBEBLXVBEFVTEK-UHFFFAOYSA-N 382.504 5.089 30 20 GKED O=C1/C(=C\c2cc(Cl)cc(C(F)(F)F)c2)C[C@@H](C(=O)O)c2ccccc21 806560424 LPGFCWWTDLOYLL-YLBKJFSISA-N 380.749 5.197 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccc(-c3nc4ccccc4s3)o2)SC1=S 814292186 PPCZQXRDDHLYNC-SXGWCWSVSA-N 398.534 5.334 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2CCC[C@H]2c2ccccc2)c1=S 836445841 KWADRBFBQFNLKB-FQEVSTJZSA-N 394.519 5.201 30 20 GKED N#C[C@@H](C(=O)CC1CCC(F)(F)CC1)c1nc(-c2c(F)cccc2F)cs1 860506402 FLOMNVXMRIAHSM-LBPRGKRZSA-N 396.409 5.480 30 20 GKED Cc1cc(OCCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)ccc1Cl 916848281 IWLQBJPZWRZUDT-GOSISDBHSA-N 378.859 5.232 30 20 GKED CC(C)Cc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 916928636 PTHCONZLQWJLCN-INIZCTEOSA-N 389.282 5.153 30 20 GKED N#CCCCOc1cccc(NC(=O)/C=C\c2ccc3ccc(Cl)cc3n2)c1 917726925 QDSZFYPSQWSVKK-KHPPLWFESA-N 391.858 5.223 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1[N+](=O)[O-] 1776115914 MTEIGEXNJRFPMA-VQHVLOKHSA-N 393.420 5.226 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc4ccccc4c3)s2)cc1 1776130955 CGNOIGHFPWHTHB-ACCUITESSA-N 384.456 6.163 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1csc(C(F)(F)F)c1 1776355257 ZDDVSMADSWYVOU-HWKANZROSA-N 384.375 5.148 30 20 GKED CCCCCCCCCCCCC(C)(C)C(=O)Nc1nc(CC(=O)O)cs1 1776785047 AZUOYJPEMVHHGP-UHFFFAOYSA-N 396.597 6.046 30 20 GKED COCc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1777232413 ONOIGSXFHYQYBD-LUAWRHEFSA-N 378.449 5.156 30 20 GKED O=C(O)c1cnc(/C=C/c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)s1 1777692956 AOKNVFCBFZUCGQ-ZZXKWVIFSA-N 399.287 5.301 30 20 GKED CC(=O)c1ccc(OCCCC(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)cc1 14905819 WOULAFYDGYLQAG-UHFFFAOYSA-N 399.446 5.192 30 20 GKED N#Cc1cccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3F)o2)c1 29600147 PTBQHNVPPLUWJG-UHFFFAOYSA-N 383.382 5.272 30 20 GKED N#C[C@@H](C(=O)c1oc2ccccc2c1CSCc1ccccc1)c1ccccn1 41493961 BQWQVFHBEKYXIY-LJQANCHMSA-N 398.487 5.751 30 20 GKED N#CCCCCS(=O)(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 67225125 PRODNSULYICQPP-UHFFFAOYSA-N 382.312 5.191 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(OC(F)(F)F)c1 121936968 JPHUIIBZGXVOEL-ZDUSSCGKSA-N 394.418 5.161 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2sccc2C#N)c(C(F)(F)F)c1 124537117 MJNJEWWRTKESQG-SNVBAGLBSA-N 384.448 5.781 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2cc(C)ccc2C)cc1 127590199 ZVDLEZUMUCWYBG-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 131338159 WXUXOIICEDVZCY-KDOFPFPSSA-N 375.394 5.111 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@@H]3CCO[C@H](c4ccccc4)C3)c2)cc1 133214949 CMDQMORWQYDTIS-QPPBQGQZSA-N 398.462 5.001 30 20 GKED COc1cc(-c2noc(CNc3ccccc3S[C@@H](C)CC#N)n2)ccc1C 136572027 SOHTZGDQDHVYJB-HNNXBMFYSA-N 394.500 5.060 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSCc1ccccc1 148293628 UDXNMGKRKIPMEJ-INIZCTEOSA-N 378.497 5.098 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3ccccc3F)n2)cc1 170673822 OEHZTLKGCFCVIM-KSSFIOAISA-N 394.471 5.328 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cccc(C(F)(F)F)c1 171292759 JSWQHGYVVNSWOM-CQSZACIVSA-N 387.405 5.012 30 20 GKED C[C@@H](C#N)CNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 171839602 HAVZDHGXIMTQEI-ZDUSSCGKSA-N 384.888 5.268 30 20 GKED N#CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccccc1 179214991 JZXLWZMGXUBEQN-UHFFFAOYSA-N 387.826 5.174 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1csc(-c2ccccc2F)n1 179831189 ZSWMIKKQIRBZSV-AWEZNQCLSA-N 383.517 5.813 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccccc1SCc1cccs1 182118243 NFVXYHBFDQTXCZ-OAHLLOKOSA-N 394.521 5.584 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCc1ccccc1)[C@H]1CCOC1 191420127 DQDUDYSOYIOASF-QFIPXVFZSA-N 392.543 5.404 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(/C(O)=N/C[C@@H]3CCCn4cc(C)nc43)c2c1 328654891 MFUBWNAWLBAEGG-SFHVURJKSA-N 388.515 5.116 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CC[C@@H](Cc2ccccc2)C1 329036522 YVEQEPSTZVLPFB-IPMKNSEASA-N 384.545 5.062 30 20 GKED Cn1ccc2cccc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)c21 329979615 JXZOKIQRWABWBO-GOSISDBHSA-N 376.504 5.273 30 20 GKED C[C@H](NC(=O)Nc1ccc(OC2CCCC2)c(Cl)c1)c1ccc(C#N)cc1 409510249 ZDPIONFRKNYUQF-AWEZNQCLSA-N 383.879 5.416 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)Nc3ccc(C#N)cc3Cl)c(C)c2c1 426134746 WWRITAGGFRBOOO-GFCCVEGCSA-N 383.835 5.158 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1 433931023 MACWXBKPRWPHOW-INIZCTEOSA-N 388.492 5.248 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc2ccccc2n1C(F)F 437374794 RZVVTHDWEMFKNC-ZDUSSCGKSA-N 394.406 5.045 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc1 437449722 IEJSZZZDDWSWIG-HZCBDIJESA-N 398.531 5.527 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2cncn2Cc2ccccc2)cc1F 438327124 WVNIJSFLTPCZCZ-UHFFFAOYSA-N 398.441 5.347 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccccc2)Cc2ccco2)cc1C(F)(F)F 438632184 CRQWOCHEERSHPF-UHFFFAOYSA-N 399.372 5.404 30 20 GKED C[C@@H](C(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccc2ccccc2c1 439794057 NWRQSTADOAYLHX-MRXNPFEDSA-N 396.412 5.406 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@@H]3/C=C/c3ccccc3)o2)c1 441048679 SKOPNBWJKFIKQN-DGXIYAMASA-N 384.483 5.066 30 20 GKED Cc1ccc(NCc2ccc(C#N)cc2)cc1Oc1ncccc1Br 447889788 SWFMQGYMZCFPIH-UHFFFAOYSA-N 394.272 5.429 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](c1nc(C)cs1)C(F)(F)F)c1ccccc1 455709760 RUGSKGGLSPKLBA-CABCVRRESA-N 383.439 5.062 30 20 GKED COc1ccc([C@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)C(C)C)cc1 457536491 ZMWVJLKWJOYTFD-FCHUYYIVSA-N 379.504 5.127 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)Cc1cccc(F)c1 459399419 LUUPWMDAGXSIFR-JKSUJKDBSA-N 385.508 5.172 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2cccc(NC(=O)C3CC3)c2)c1 462676759 NSZUFADIULLXMB-UHFFFAOYSA-N 397.478 5.098 30 20 GKED C=CCOc1ccc([C@H]2Nc3ccc(Cl)cc3C(=O)N2c2ccncc2)cc1 463005021 CEIQOBATNOZHHF-NRFANRHFSA-N 391.858 5.071 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1c(F)cc(C(F)(F)F)cc1F 463709237 VKIPFAQCYABWNJ-UHFFFAOYSA-N 387.201 5.394 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)Nc2ccc(CC#N)cc2)cc1 466078122 SQVYQVGENLBTQX-KRWDZBQOSA-N 385.467 5.311 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cccc(C(F)F)c3)cc2)c1 468308008 RGEBYYQWTYQZTR-UHFFFAOYSA-N 378.378 5.469 30 20 GKED CCN(C(=O)c1cc(-c2cccc(C#N)c2)no1)[C@H](C)c1cc2ccccc2o1 469020652 PYAYBMKEXIFUNC-OAHLLOKOSA-N 385.423 5.183 30 20 GKED CCOc1ccc([C@@H](NC(=O)C[C@H](CC#N)c2ccccc2)c2ccccc2)cc1 474786211 QIFHBZVAASAVIU-OZXSUGGESA-N 398.506 5.378 30 20 GKED N#Cc1ccc([C@@H](Nc2cccc(Sc3ccc(Cl)cc3)c2)C(N)=O)cc1 476526886 XCPDGTDOBZKQRU-HXUWFJFHSA-N 393.899 5.001 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c1 477952606 RSJWTTTYIAOAAD-QGZVFWFLSA-N 387.487 5.105 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@H](c4ccc(F)cc4)C3)c2)cc1 478243277 USJLFFKJAMMKFN-FQEVSTJZSA-N 386.426 5.119 30 20 GKED CC(C)CN(Cc1cccc(OCCCC#N)c1)[C@@H]1CCCc2cccnc21 482266346 HTBBSYOLBAALQF-HSZRJFAPSA-N 377.532 5.300 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1sc(NC(=O)c2ccco2)cc1C 482759478 FIEPIWDZQUWYRY-UHFFFAOYSA-N 386.517 5.110 30 20 GKED N#C[C@@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1nccc2ccccc12 483189852 CWAPAZQFAPTANV-HXUWFJFHSA-N 381.460 5.271 30 20 GKED Cc1c([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccccc12 484155761 FFMXFXWLGXFWFZ-GDBMZVCRSA-N 393.512 5.876 30 20 GKED CCc1c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cnn1C(CC)CC 485174187 BUMTXNBXEDPQNK-SIKLNZKXSA-N 393.535 5.110 30 20 GKED CC(C)(C)c1cc(NC(=O)c2c(F)ccc(Br)c2F)c(C#N)s1 486435660 KHIFVLHTIOMOFK-UHFFFAOYSA-N 399.260 5.210 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc[nH]c2C2CCC2)cc1F 486554225 ADKRJFYRAJZHTM-UHFFFAOYSA-N 375.403 5.338 30 20 GKED C=CCSc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 487002727 WDMHYMAEKZHZDJ-CQSZACIVSA-N 383.423 5.200 30 20 GKED C=C[C@@H]1CCCCN1C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 488866074 LFRWQCPZSPIRDQ-WMLDXEAASA-N 390.936 5.184 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccc(C)cc1 489662517 ALVNVXAFBNCWIS-OAHLLOKOSA-N 382.533 5.578 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C2CC2)cc1 489745677 WULVQEJEDVVWFG-UHFFFAOYSA-N 393.796 5.427 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cc(C)ccc1F 502676853 BSTFYDNAJHXJAQ-UHFFFAOYSA-N 395.247 5.256 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1Cl 503552380 WNGNZMMEBKBWFK-OAHLLOKOSA-N 387.291 5.915 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 503974016 TYIPQFKECPJTGQ-RTWAWAEBSA-N 397.305 5.284 30 20 GKED N#CC1CCN(Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)CC1 512677894 MRUCCGJXCVPTOE-UHFFFAOYSA-N 382.467 5.021 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(-c3ccc(Cl)s3)nc2)c1 512920190 PSDRIZJPTGNOTG-UHFFFAOYSA-N 385.901 5.331 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 513983657 SCSUVFYRDSODCO-UHFFFAOYSA-N 383.495 5.819 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CC[C@@H](c4ccccc4F)C3)c2)cc1 517262672 BAAWJQSQYXEJTF-LJQANCHMSA-N 385.442 5.071 30 20 GKED C=CCN(Cc1nnc(-c2cccc(Cl)c2)o1)Cc1ccc(Cl)s1 517383040 GPTHHCGFWFKRDQ-UHFFFAOYSA-N 380.300 5.293 30 20 GKED Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CNCc2cccc(C#N)c2)cc1 518269550 JVTAIMSYYXYYMD-UHFFFAOYSA-N 396.469 5.148 30 20 GKED C[C@H](CCc1ccccc1)SCC(=O)Nc1ccccc1S[C@H](C)CC#N 518655257 HOSMZEIBAVDIPU-QZTJIDSGSA-N 398.597 5.774 30 20 GKED C[C@H](CC(C)(C)c1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 518755417 HTTGMUFLMAQLGL-QZTJIDSGSA-N 395.572 5.959 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1 519310209 PHSGGKJUWYTLHN-GFCCVEGCSA-N 397.997 5.614 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 522701633 PXFCPUMNSKBMGZ-GOSISDBHSA-N 377.488 5.703 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccnc(Oc4ccccc4)c3)c2C#N)C1 523870038 NOEULCQYEDNMMJ-CQSZACIVSA-N 389.480 5.184 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 524258494 QBFGZPASQPWZBR-HKUYNNGSSA-N 390.936 5.019 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl 524822822 PKLMGECPJDASEK-RXVVDRJESA-N 390.845 5.304 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H](C)[C@H](C)C1CCCCC1 541602195 HVADHMHEJVGDNC-FGTMMUONSA-N 387.593 5.071 30 20 GKED C=CCn1c(SCc2ccc3ncccc3c2)nnc1-c1ccc(F)cc1 546020631 JJCKYFAVYDUFCD-UHFFFAOYSA-N 376.460 5.111 30 20 GKED COCC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)c(Cl)c1 551818050 SMNVTVBOPKCMRR-HXPMCKFVSA-N 381.278 5.433 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(c3c[nH]c4ccc(F)cc34)CC2)cc1 554076065 YNYVKJGADBWZFF-UHFFFAOYSA-N 389.474 5.128 30 20 GKED N#CCCCn1cc(-c2nc(CCn3ccc4ccccc43)no2)c2ccccc21 564269427 PISMZGCLZDBZCB-UHFFFAOYSA-N 395.466 5.192 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnc(C(F)F)s1 565942900 HNVSHQRFJBYCSG-UHFFFAOYSA-N 391.287 5.150 30 20 GKED N#CCCN(C(=O)c1cccc(COc2cccc(F)c2)c1)c1ccc(F)cc1 579576944 QJZCXFLDJYFZTQ-UHFFFAOYSA-N 392.405 5.104 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cc1 580730944 WJLUPYIVCLCBTP-PGRDOPGGSA-N 399.506 5.189 30 20 GKED COc1cc([C@@H](C)N[C@H]2CCc3ccc(C#N)cc32)ccc1OC1CCCC1 581518270 UFIZHJUAEPYFMW-ZHRRBRCNSA-N 376.500 5.226 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 584150393 MPQUXZMVKGZCRJ-QGPMSJSTSA-N 383.492 5.145 30 20 GKED Cc1ccc(N(C(=O)CCCCCC#N)c2nc3ccccc3s2)c(C)c1 588895673 VBTRXMVFOIVPKV-UHFFFAOYSA-N 377.513 6.052 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 590335366 KKFWBRUPBVMLIK-UHFFFAOYSA-N 394.290 5.527 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](C)(c2cccc(F)c2)C1 593159497 NQPCDHAKGVMSQL-OPAMFIHVSA-N 397.519 5.273 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1sc2c(c1C#N)CCCCC2 602774760 AUPOERMGELFZGN-UHFFFAOYSA-N 377.469 5.104 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604460620 KPUMNPSIVVMTCN-UHFFFAOYSA-N 389.430 5.196 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@@H]1c1cccc(F)c1 608213022 CIIWWXXBFRBUSI-OAHLLOKOSA-N 391.286 5.451 30 20 GKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@@H]1CCc2ccccc21 609434565 YLRQSSWKBYNZOZ-HSZRJFAPSA-N 383.451 5.502 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)CC1 609772746 IJDUAMOOSVLQBL-IBGZPJMESA-N 391.515 5.490 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cc3occc3s2)cc1 609856208 NNSXIZOGIGDXKG-UHFFFAOYSA-N 390.439 5.348 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)Cc3c[nH]c4ccc(Cl)cc34)c2C#N)C1 610037078 UQOCJHKIHZYXLQ-NSHDSACASA-N 383.904 5.060 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@@H]2CCCc3cc(C#N)ccc32)cn1 611391045 NRAJLYLPODIDSI-JOCHJYFZSA-N 399.494 5.311 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 612894571 ABHILHISYOAIMD-HXUWFJFHSA-N 398.487 5.770 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 613515398 ZIFSSZPBXOYOMK-DENIHFKCSA-N 399.563 5.454 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(NC(=O)c2ccccc2)c1 614179819 OFNZSMRXEHUJHA-IBGZPJMESA-N 397.522 5.591 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N3CC[C@@](F)(C#N)C3)cc2)c1 615538514 PGMVBCFXFOVLDH-HSZRJFAPSA-N 395.478 5.167 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnc(-c3ccccc3Cl)s2)n1 673813605 DQUMYPOQEBCPKQ-LBPRGKRZSA-N 387.917 5.533 30 20 GKED C=CCn1c(SCc2cccnc2Cl)nnc1-c1ccc(Cl)cc1 727054400 PRUMHLZXYJHAIR-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CCOc1cc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)ccc1O 727267882 VGEKWMVEWRILPH-VZUCSPMQSA-N 383.444 5.258 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(Br)s1 728437811 JJUAZNNLYCXCMU-ONEGZZNKSA-N 382.329 5.592 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(OCc2ccccc2)cc1 728439309 HDZKCJXGGZDJMQ-VAWYXSNFSA-N 387.266 5.202 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1cccc(OCCCC#N)c1 729827661 RVKXTODXWRDAAH-HWOXTHGCSA-N 378.472 5.198 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(C)=NNc2cnnc(O)c2Cl)cc1 730567897 DBDSFFCRJYYUKP-OAHLLOKOSA-N 390.915 5.267 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(O)c4ccccc34)cc2)cc1 732262882 HXXPWVHPXSWHHJ-UHFFFAOYSA-N 394.430 5.656 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)CSc2ccc(Cl)cc21 743056182 CQBONEBPMACKKU-NTEUORMPSA-N 380.856 5.294 30 20 GKED Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 743096270 PQILZUYBJCHEMT-HXOBKFHXSA-N 387.483 5.386 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 743447715 RVFREFSYAFDFKL-GOSISDBHSA-N 394.927 6.008 30 20 GKED C#CC[C@H](OC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccccn1 744099767 AJTQORPSGNRGDJ-FQEVSTJZSA-N 381.353 5.087 30 20 GKED C#CCOc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1OCC 745989909 GKXHJJSKYCDBIZ-WZUFQYTHSA-N 383.447 5.055 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745990110 KFAWPVRHQUIKSI-VAWYXSNFSA-N 397.453 5.586 30 20 GKED Cc1noc(C(F)F)c1C(=O)N1CCCSC1=Nc1ccccc1C(C)C 746404397 KEWBCIBVRLXYCL-UHFFFAOYSA-N 393.459 5.311 30 20 GKED COc1ccc(OCc2nc(/C=C3\CCc4cc(F)ccc4C3=O)cs2)cc1 747440802 VMLBQZHJDVHQEG-RVDMUPIBSA-N 395.455 5.082 30 20 GKED O=C(/C=C/c1sc2ccccc2c1Cl)c1ccc(N2CCOC2=O)cc1 748583597 HKIURWDRYKFTNJ-MDZDMXLPSA-N 383.856 5.407 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]nc2-c2ccccc2F)cc1 755167054 QUZFWHYGFVZUMH-FQEVSTJZSA-N 396.425 5.124 30 20 GKED N#C[C@H](C(=O)Cc1c(F)cccc1F)c1nc2cc(C(F)(F)F)ccc2s1 756240293 GPBPGTAJMLFDHI-LLVKDONJSA-N 396.340 5.012 30 20 GKED N#C[C@@H](C(=O)CCCc1csc2ccccc12)c1nc2cc(F)ccc2s1 756274748 IMOJKRYWXIEHKD-INIZCTEOSA-N 394.496 5.849 30 20 GKED CC(C)[C@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1 756516225 GCNCHUWDHSUALS-YJBOKZPZSA-N 385.389 5.187 30 20 GKED C[C@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1ccc2ccccc2c1 764306405 WLWVQRJGXQLEHF-LBPRGKRZSA-N 379.803 5.015 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CCC(C(F)(F)F)CC2)cc1 766397537 AUAFLZOZBFZYDO-QLOJAFMTSA-N 386.417 5.649 30 20 GKED N#CCCCCOC(=O)Cc1csc(-c2cccc(Oc3ccccc3)c2)n1 767268711 UWOPIMQSQZOOQJ-UHFFFAOYSA-N 392.480 5.382 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1ccccc1C(=O)c1cccs1 767980552 AIVVPZVWDPQJBU-UHFFFAOYSA-N 389.476 5.137 30 20 GKED CCCOc1cccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 770143936 ATDKXFMBDUAJIX-XMMPIXPASA-N 384.479 5.312 30 20 GKED CCO[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 770180539 TYVIQDYQIDZEFH-ZEQRLZLVSA-N 399.494 5.241 30 20 GKED CC(C)Oc1cc(Br)cc(NCc2ccc(O[C@@H](C)C#N)cc2)c1 770599288 STUUAQKCJVLVSP-AWEZNQCLSA-N 389.293 5.139 30 20 GKED C[C@@H](CSCc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 772971345 LYLPWTXILMWNHL-QFBILLFUSA-N 392.549 5.556 30 20 GKED C[C@@H](NCc1ccc(COCc2ccccc2)cc1)c1ccc(OCC#N)cc1 776153765 HOANVBHNSXBUOM-HXUWFJFHSA-N 386.495 5.157 30 20 GKED CCNc1ccc(C#N)cc1NCc1ncc(-c2ccc(Br)cc2)o1 776849561 TXJJRPVZDCDVIL-UHFFFAOYSA-N 397.276 5.020 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)C(=O)c1ccc(Cl)cc1 777295713 QAYHSOYBXHESIW-DOMZBBRYSA-N 382.872 5.035 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(Cl)c1SC(F)F 780543026 BFCIZMLOGZNVIH-JTQLQIEISA-N 397.834 5.590 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(C#N)cc2F)cc1OCc1ccccc1 781109845 AVHLSDKITOKPIS-DHZHZOJOSA-N 387.410 5.181 30 20 GKED CC(C)(NCc1cc(Cl)ccc1OCC#N)c1ccc(OC(F)(F)F)cc1 789513701 MQKCGWWHRKADSD-UHFFFAOYSA-N 398.812 5.166 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2nccc3ccccc23)c(C)c1 792094135 NCUXBMOCRNOCCN-NRFANRHFSA-N 384.479 5.390 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)C#Cc1ccc(C(F)(F)F)cc1 794091668 FGPJHAPAXLFSJU-UHFFFAOYSA-N 380.369 5.066 30 20 GKED N#C[C@H](C(=O)C(C1CCC1)C1CCC1)c1nc(-c2c(F)cccc2F)cs1 796906424 VZNVNGBBQDSITG-CQSZACIVSA-N 386.467 5.481 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCC3(CCO3)CC2)c1 800530302 JJLSKHKQTIBFTA-UHFFFAOYSA-N 388.552 5.351 30 20 GKED N#Cc1sc(N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)nc1Cl 804617793 JKEGOSDUPINVAN-LLVKDONJSA-N 390.896 5.420 30 20 GKED C#C[C@@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccc(Cl)cc1 810151966 QVBKCDZTMFMFCP-QGZVFWFLSA-N 388.945 5.315 30 20 GKED COc1cccc(-c2nc(/C=C3\CCc4cc(OC)ccc4C3=O)cs2)c1 916153632 YYVHWYXNRYWLOH-XNTDXEJSSA-N 377.465 5.040 30 20 GKED CCOc1ccc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 919815256 UWZONZZTPCJFBH-XMMPIXPASA-N 384.479 5.312 30 20 GKED CCC(=NNc1c(C)cccc1CC)c1ccc(OCCCCC(=O)O)cc1 1776056682 IBYPWGGGDSBZPU-UHFFFAOYSA-N 382.504 5.417 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cccc4ccccc34)cc2)cc1 1776114330 MLHRJKFFVGEEKN-YVLHZVERSA-N 378.427 6.101 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2)cc1 1776125592 MPBLWJHSVGBRFQ-YZIPPPLESA-N 380.484 5.876 30 20 GKED CC(C)Oc1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776361069 QXHKNBRLQIUANO-IZZDOVSWSA-N 376.408 5.328 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2ccccc21 1776526456 GMWYLDIFMAORIJ-QNGOZBTKSA-N 382.459 5.999 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C\c1ccc(-c2ccccc2C(=O)O)cc1 1777316305 UTVCEORFESZZPA-JYRVWZFOSA-N 392.838 5.610 30 20 GKED CCOc1ccc(-n2c(SCCCC#N)nnc2-c2ccc(Cl)cc2)cc1 5640599 JKBVUKSUJLXKOX-UHFFFAOYSA-N 398.919 5.382 30 20 GKED N#Cc1c(NC(=O)CSc2cccc(C(F)(F)F)c2)sc2c1CCCC2 6404765 GDBJZUFMAMHSSD-UHFFFAOYSA-N 396.459 5.248 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2cccc(Cl)c2Cl)S1 7165041 OIHIMUGJVFPXTL-NTEUORMPSA-N 377.296 5.502 30 20 GKED C=CCn1c(SCc2c(C)cc(C)c(C(C)=O)c2C)nnc1-c1ccco1 23201980 ZZNGWBKPBVXZSU-UHFFFAOYSA-N 381.501 5.144 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)ccc1C 41548729 OWZRNAGMSAJHNN-CYBMUJFWSA-N 390.386 5.122 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C/c1nc2ccccc2s1 66801220 PTUCLIRODJNJFL-VNDWYCCKSA-N 379.510 5.342 30 20 GKED Cc1csc([C@H](C#N)C(=O)Cc2cccc(OCc3ccccc3Cl)c2)n1 106353528 DEKKWUUOJBONAI-GOSISDBHSA-N 396.899 5.103 30 20 GKED CC(=O)c1ccc(OCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 108981614 OFTLWVTZPDJCMK-INIZCTEOSA-N 396.512 5.081 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(SC(F)F)c2)c1 114005546 HCAAJJZZIMJGSS-OAHLLOKOSA-N 391.443 5.004 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC[C@@H]3CCC[C@@H]32)cc1 120156354 SFGBCUFQFVEWPD-CVDCTZTESA-N 389.499 5.128 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)s1 121568017 ASDLAHZPXXKENS-LLVKDONJSA-N 395.311 5.314 30 20 GKED CN(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc(OCc2ccccc2)cc1 187922847 OFMVHLPERLFLHR-UHFFFAOYSA-N 382.463 5.097 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccccc1Br 189907659 FXUZARPCAHNRDT-UHFFFAOYSA-N 388.305 5.319 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2Cl)o1)c1cccc(N2CCOC2=O)c1 214908393 AXYUJLPVUMZXEI-NTMALXAHSA-N 393.826 5.453 30 20 GKED CC[C@](C)(/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1nccs1 329491575 VNKWAEBIANZXHA-IERDGZPVSA-N 386.565 5.232 30 20 GKED OC(=Nc1ncn(C2CCCCC2)n1)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 329561264 MPPHRXRQNXROJI-BAUKFBFWSA-N 396.457 5.520 30 20 GKED Cc1nc(C/N=C(/O)[C@H](C)N2[C@H](C)CC[C@H]2C)oc1-c1ccc(Cl)cc1 329805755 KWCVOYLSHOGOQC-NFAWXSAZSA-N 375.900 5.021 30 20 GKED C[C@@H]1Cc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c2[C@@H](C)C1 410995172 CEFLMUCMYKPUSQ-RYUDHWBXSA-N 397.525 5.203 30 20 GKED C=C(C)[C@H](CC(=O)Nc1csnc1-c1cccc(C(F)(F)F)c1)OCC 425608429 MLHXRSNNNZJYTR-HNNXBMFYSA-N 384.423 5.139 30 20 GKED N#CCCC[C@H](NC(=O)NC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1 431304323 GBPUDONMQRTUNH-FUHYEJFZSA-N 399.897 5.402 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1 435100270 DVKLOMHFJIMIHV-HTAPYJJXSA-N 391.515 5.103 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)c2c1 435468064 AQKCVPPMOTWPHF-QGZVFWFLSA-N 395.384 5.325 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(Cl)c(C(F)(F)F)c1 437342980 CBQWACJCAXBVRZ-UHFFFAOYSA-N 385.666 5.769 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCS1 437854524 ZBKUWXMXUJNUTN-IBGZPJMESA-N 381.501 5.018 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](Cc4ccccc4)C3)cc2)cc1 438222818 BNONVJOAAZYUMN-NRFANRHFSA-N 397.478 5.447 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)C(C)(C)C)nc1 451328880 JBUDECZINWMTMU-UHFFFAOYSA-N 379.504 5.170 30 20 GKED CC[C@H](NC(=O)Nc1ccc(CC#N)cc1Cl)c1ccccc1OC(F)F 455758710 VSEKUYYGQKNEIN-HNNXBMFYSA-N 393.821 5.280 30 20 GKED Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 469129332 WTYKMIUHFWBVOR-LJQANCHMSA-N 389.480 5.174 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@@H]3Cc3ccccc3)cc2)cc1 472195199 VJOIPXXGPSRWLZ-JOCHJYFZSA-N 382.463 5.002 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 476080613 PIVMZSXUFRGXTO-UHFFFAOYSA-N 392.446 5.703 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](c4ccccc4)C3)cc2)cc1 477398666 ZTLYKQOVWDGBRA-HXUWFJFHSA-N 383.451 5.372 30 20 GKED CC1(C)CC[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc21 481996583 DHYNXLICGJOQDA-QFIPXVFZSA-N 387.527 5.494 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482062864 DNKNDJLFWCWYHO-UHFFFAOYSA-N 397.478 5.512 30 20 GKED COc1ccc2sc(C(=O)N[C@H](CCCC#N)c3ccccc3)c(C)c2c1 487371667 LTXUQDFVWFYQJL-LJQANCHMSA-N 378.497 5.383 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(-c2ccncc2)cc1 507612727 HUMMUVSAEQVBFR-WOEOTAOXSA-N 381.523 5.803 30 20 GKED C=C(C)COc1cc(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)ccc1OC 507822870 JUMWGHRMZFZUDC-GOSISDBHSA-N 397.412 5.573 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(OC(F)F)cc1 513048706 FEUBCWQAVRQRPJ-OAHLLOKOSA-N 392.405 5.318 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccs1 522313195 UMWPRZDDEKQKDG-UHFFFAOYSA-N 376.481 5.115 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1F)c1ccc(OCc2ccc(F)cc2)cc1 537101252 FRABRRYUYUTEBQ-MRXNPFEDSA-N 378.422 5.266 30 20 GKED C[C@@H](N[C@H](C)c1nnc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 541076767 HEHATEJYXUDQGW-QZTJIDSGSA-N 394.478 5.687 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cccc(C(F)F)c1Cl 543505623 VELPVSXNFIEWRJ-UHFFFAOYSA-N 398.796 6.194 30 20 GKED CC(C)S(=O)(=O)c1ccc(CSc2ccc(C#N)c(C(F)(F)F)c2)cc1 543861980 OKNGGESYDBGJGE-UHFFFAOYSA-N 399.459 5.051 30 20 GKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 551803229 NMYMHKKHNIDYTQ-HNNXBMFYSA-N 389.480 5.535 30 20 GKED C=CCC[C@@H](Nc1cccc(CS(=O)(=O)Cc2ccccc2)c1)c1ccco1 552284375 XZJMFVZMLOVEPN-JOCHJYFZSA-N 395.524 5.514 30 20 GKED CSCc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 558343903 JSJPLLLDTNOMRF-HNNXBMFYSA-N 385.558 5.266 30 20 GKED Cc1cc(Br)c(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)cc1Cl 561132451 YDGGDITWGUQCGN-HNNXBMFYSA-N 398.087 5.059 30 20 GKED COc1ccc(-c2cncc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2)cc1 563830500 WFVMVZVDALVDCI-GOSISDBHSA-N 391.496 5.001 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCOCc1ccc(C#N)cc1 563913716 FAKDYWNCYIHWHN-UHFFFAOYSA-N 391.515 5.091 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2ccc(C#N)c(Cl)c2)cn1 570591166 GIQLCQIHJOEUMA-UHFFFAOYSA-N 379.847 5.410 30 20 GKED N#Cc1c(F)cccc1SCC(=O)Nc1ccc(Cl)cc1C(F)(F)F 571547182 GERNWPOOWIEXIS-UHFFFAOYSA-N 388.773 5.100 30 20 GKED CSC[C@](C)(C#N)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 572109612 VAKYVTSXBHCJCO-AWEZNQCLSA-N 393.748 5.237 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cnc(-c4ccsc4)s3)cc2)ccn1 589323735 YZOPYNOEEHMYKF-UHFFFAOYSA-N 390.493 5.543 30 20 GKED C=CCOc1ccc(CNCc2ccnc(Oc3ccccc3)c2)cc1Cl 589639876 XIONRSCDBXHABK-UHFFFAOYSA-N 380.875 5.382 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccccc3OC(C)C)n2)cc1 592360734 ABMPTQAKJWDXDH-SFHVURJKSA-N 392.480 5.096 30 20 GKED N#CC1(CC(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)CCCCC1 596707094 JLRIYFPLUMHULT-UHFFFAOYSA-N 376.460 5.133 30 20 GKED N#CCCn1cc(CNCCc2cccc(Cl)c2Cl)c(-c2ccccc2)n1 609598793 QAMWVPKJGWBMQX-UHFFFAOYSA-N 399.325 5.103 30 20 GKED Cc1cc(CN(C)C(=O)C(C)(C)C#N)cc(C)c1OCc1ccccc1Cl 609653024 XDSMFMSHUGEYGX-UHFFFAOYSA-N 384.907 5.044 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@@H](C)c1cccnc1 609663050 RLNZSDBSMRVGHC-QGZVFWFLSA-N 387.458 5.128 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nc4ccsc4s3)c2)cc1 609795389 RIXVOZNUISEXRE-UHFFFAOYSA-N 377.450 5.274 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](Cc1ccccc1)C(C)C 610040471 VGFOZEMINQJBGN-JOCHJYFZSA-N 399.494 5.507 30 20 GKED Cc1ccc(-c2csc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)n2)cc1 611094594 RRBMFCUUFQZUQS-UHFFFAOYSA-N 388.279 5.549 30 20 GKED CCC[C@@H]1CCc2nc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)sc2C1 611142173 MRNUJJMPHGASLT-SNVBAGLBSA-N 394.327 5.479 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)oc2ccccc12 612894656 DLZXWOUTFPQCLK-INIZCTEOSA-N 392.867 6.008 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)C1 661379031 RAQMVQSQEWUCQI-INIZCTEOSA-N 389.952 5.269 30 20 GKED Cc1nc2c(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cccc2o1 672580847 FNDGGIFSVVZTGN-OAHLLOKOSA-N 393.855 5.403 30 20 GKED C=CCOc1ccc(C(=O)N(CCC(C)C)c2nnc(C)c3ccccc23)cc1 678538542 WIWZADVGFDGFDN-UHFFFAOYSA-N 389.499 5.196 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccccc1O 725838088 GKKVXCQFGDSACK-UHFFFAOYSA-N 378.432 5.039 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccc(Cl)c(Cl)c2)C(C)C)c1 726468290 BVQZVNFOEDGPFY-UHFFFAOYSA-N 377.340 5.582 30 20 GKED N#C[C@@H](C(=O)[C@@H](OC1CCCC1)c1ccccc1)c1nc2ccccc2s1 727039228 UWRMTORMSZHMFN-UWJYYQICSA-N 376.481 5.173 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1Cl 727629047 QPUFAQTUXKHUEV-MSKHEQNASA-N 387.291 5.883 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)cc1 728697884 YWJHPZRFIIDUGF-ATTDUZETSA-N 385.435 5.505 30 20 GKED C[C@@H]1C[C@H]1c1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)o1 732763788 HUMJWNJHQKWLOK-BXKDBHETSA-N 393.299 5.139 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(Br)s2)c(OC(F)F)c1 734097155 ZQXGFENQSAVSNT-HWKANZROSA-N 389.217 5.017 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CC1)c1nc(-c2ccc(Cl)cc2)cs1 734706531 LRXJNBVULDOTJS-QGZVFWFLSA-N 396.874 5.511 30 20 GKED FC(F)(F)COc1ccc(NN=Cc2ccccc2OCC(F)(F)F)cc1 741761162 HBUIFEZLDDDKQP-UHFFFAOYSA-N 392.299 5.015 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccccc2)n1C 741925001 LWRRFUFYQICDOT-INIZCTEOSA-N 375.497 5.339 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)s1 749322906 DWRXXJRYWYGCBE-JTQLQIEISA-N 383.325 5.158 30 20 GKED CCn1nc(C)c(C(=O)/C=C/c2ccc(OCc3ccccc3F)cc2)c1C 750909611 NNRSJULLZWKYAB-SDNWHVSQSA-N 378.447 5.134 30 20 GKED C=CC[C@@H](NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1)c1ccncc1 754921918 UBCDROQSVNBVFZ-HOYKHHGWSA-N 385.511 5.787 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(Cc3cccc(OCC#N)c3)n2)cc1 762347864 PHDQADZZQSSJLG-UHFFFAOYSA-N 379.485 5.120 30 20 GKED O=C1/C(=C\c2cncc(Br)c2)CCc2nc(-c3ccccc3)sc21 767362333 RXJOEZZBAIPLPL-ZSOIEALJSA-N 397.297 5.180 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2cccc(F)c2)c2ccccn2)cc1 773133693 RKYAWVJSIKZPOM-SBUREZEXSA-N 396.893 5.792 30 20 GKED CC(C)C[C@H](C)N(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc2[nH]ccc2c1 776873093 MUKQEYDXZXGITJ-SFHVURJKSA-N 385.511 5.804 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 779105057 RLLFIAWFXUIRRO-UPVQGACJSA-N 390.914 5.900 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(SC2CCCC2)cc1 780479328 IZMRHCRCXKRNFU-OAHLLOKOSA-N 381.501 5.656 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)c1ccccc1SCC#N 782782532 VCOVGZXPLWUFRZ-UHFFFAOYSA-N 387.508 5.475 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1nccc2ccccc12 792104928 SJCXBMHHYAMDBO-KSZLIROESA-N 381.262 5.522 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 796797155 LGMGGSMUTCJYQG-KSZLIROESA-N 378.884 5.443 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(F)c2)CCCCC1)c1cnc2ccccc2n1 805929556 JDWCLAQVMBHQPI-IBGZPJMESA-N 387.458 5.138 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccccc1CN(C)C1CCCCC1 806135549 LHLASLUSHRBUOH-UHFFFAOYSA-N 389.543 5.118 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](N[C@H]1CCC[C@H](C#N)C1)CC(C)(C)O2 810258235 SLTCQLXTNPDKJP-TXPKVOOTSA-N 399.535 5.308 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccc(C(F)(F)F)c1 819440320 QGWYIRISWDTKOF-SUMWQHHRSA-N 380.435 5.245 30 20 GKED Cc1cc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)ccc1NC(=O)OC(C)(C)C 825959348 IFWHPHAAKKEZBQ-OAHLLOKOSA-N 394.475 5.096 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1cc(C)c(OCc2ccccc2Cl)c(C)c1 841810098 FHRGXPHKBANVHI-IBGZPJMESA-N 387.907 5.045 30 20 GKED N#C[C@H](C(=O)CC1(C#N)CCCCC1)c1nc(-c2ccc(Cl)cc2)cs1 850763089 VYQTXZIJVDUFEU-MRXNPFEDSA-N 383.904 5.504 30 20 GKED CC(=NNc1nc(C)nc2sc3c(c12)CCCC3)c1ccc(C(F)F)nc1 853267278 LAPUDXYJEWSXCR-UHFFFAOYSA-N 387.459 5.047 30 20 GKED Oc1ccc2ccccc2c1/C=N/C1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914703229 RSGPFNJTPCPAIM-PFTKLDNOSA-N 389.339 5.874 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(-c2ccc(F)cc2)s1 916882614 HDTRXQORDGSKQK-MRXNPFEDSA-N 398.846 5.169 30 20 GKED O=C1/C(=C\c2ccccc2)CC2(C/C1=C\c1ccccc1)C(=O)Nc1ccccc12 917518036 QRJLENXDUUJOHP-KBNZVFGVSA-N 391.470 5.407 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cc(Cl)cc(C(F)(F)F)c2)c1)C(=O)O 1776470951 RFEQEZYSLDHELA-ISALQUGTSA-N 398.764 5.107 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Br)c(F)c1F 1776782799 KSNSNXSZPHADDG-ZDUSSCGKSA-N 392.284 5.021 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(Cl)cccc1SC(C)C 1776783273 LPWLKWVIIPVBQR-MRXNPFEDSA-N 386.001 6.134 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@H](C(=O)O)C23CCC3)cc1 1776787484 COIDRQJYLZJUCL-LJQANCHMSA-N 389.561 5.219 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CSC(C)(C)C)C(=O)O)c1 1776787652 HEWCLXGCDTTZCH-IBGZPJMESA-N 381.582 5.110 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3cccc(Br)c3)o2)c1 1777686153 QVCJWOOFIDIAKA-CLFYSBASSA-N 397.224 5.303 30 20 GKED C=CCCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H](C)CC)CC1 1824343331 YAHGVQQWYRDXEU-FPOVZHCZSA-N 390.612 5.035 30 20 GKED C=CCN(C(=O)c1cnc(Cl)c(Cl)c1)c1nc(-c2ccccc2)cs1 7724803 RCVIRVYBAGNVHT-UHFFFAOYSA-N 390.295 5.345 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccc(OC(F)F)cc3)c2)c1 47697975 WWJXPIMECXKFPI-UHFFFAOYSA-N 394.421 5.028 30 20 GKED N#Cc1cc(NC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)ccc1F 97544179 FDVVRDRMDAGFDR-UHFFFAOYSA-N 391.349 5.092 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 108240533 RYVSTGODDYKORG-IAGOWNOFSA-N 382.529 5.154 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1sc(-c2ccccc2)nc1C 129376580 IQIYRXODRNHWSC-MRXNPFEDSA-N 390.512 5.524 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3cccnc3-c3ccccc3)o2)cc1 152695604 HDASHCUHIJPYLV-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1csc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)n1 173123242 OJXIOVSBAUMLPC-SUMWQHHRSA-N 386.546 5.119 30 20 GKED N#C[C@H](C(=O)CC[C@@H]1CCOC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 176098033 ZTNRFNDMRXPYNR-BXUZGUMPSA-N 395.311 5.110 30 20 GKED CCc1cccc2c(C3CCN(C(=O)c4ccc(C5(C#N)CC5)cc4)CC3)c[nH]c12 180147805 NTQMSIOSMPAFAD-UHFFFAOYSA-N 397.522 5.305 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(Oc3ccccc3)o2)ccc1OC 180946131 GNOUSHMDGVPOJN-GOSISDBHSA-N 392.455 5.051 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(C2SCCCS2)cc1 182111864 XWPSUWHXEXGPKF-AWEZNQCLSA-N 384.526 5.098 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 185323939 BASYIMCOWPGEET-VQIMIIECSA-N 379.529 5.450 30 20 GKED COc1cccc(-c2nnc(SCCCCC#N)n2-c2ccc(Cl)cc2)c1 195546219 LVMHOUQHDRQSDC-UHFFFAOYSA-N 398.919 5.382 30 20 GKED C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 246693429 ISFGIVSLIGMGJC-RZQQEMMASA-N 397.519 5.692 30 20 GKED N#Cc1ccc(NC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)cc1C#N 304113950 ZGYMEXSQPCPNSF-UHFFFAOYSA-N 399.262 5.113 30 20 GKED COc1ccc(N=C(O)[C@H]2CCC(=O)[C@@H](C)C2)cc1N=C(O)C1CCCCC1 328947628 KFTBHUDDJCWLAQ-HOCLYGCPSA-N 386.492 5.457 30 20 GKED C[C@H]1CC(=O)CC[C@H]1C(O)=Nc1nc(-c2ccc(Br)s2)cs1 329188518 BQNAHNKEPMECOT-WCBMZHEXSA-N 399.335 5.227 30 20 GKED O/C(=N/[C@H]1CCCc2sccc21)Nc1cccc2c1CN(c1nccs1)C2 329831686 KPUPXLZCPLOLDT-INIZCTEOSA-N 396.541 5.128 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ncc(-c2cccs2)o1 425531570 HTGCQTBSKWSEKP-ZDUSSCGKSA-N 391.418 5.336 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(C(=O)OC(C)(C)C)cc1 434878127 CIHSVNSMZURLOI-MRXNPFEDSA-N 382.529 5.506 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ncc(Cc2cc(Cl)ccc2Cl)s1 436132814 WISOKEMJAFVHOO-UHFFFAOYSA-N 392.267 5.066 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 438065429 MXDXYAWZEYJVAW-YSZBQJHXSA-N 378.516 5.037 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)cc1 440239565 JPGWZULIDXPXHM-RJGXRXQPSA-N 375.516 5.318 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H](COCC)C1)c1ccc(C(F)(F)F)cc1 441532841 LNRZRTDSSDJINQ-LPHOPBHVSA-N 398.469 5.171 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1ccc(O)cc1)c1ccc(C(F)(F)F)cc1 442303897 XWRKDDUFPYYJOT-LJQANCHMSA-N 392.421 5.260 30 20 GKED C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccc(Br)s1 443811958 HJSUSOZCXSMLKE-SECBINFHSA-N 395.347 5.065 30 20 GKED CCSCc1ccccc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 448347365 XYRPOTJKAPIVTA-QGZVFWFLSA-N 379.312 5.241 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 466602207 QVODDOUGZRXEMX-UWJYYQICSA-N 376.500 5.027 30 20 GKED CSc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 466856042 GBIVELAHTZCDAI-QGZVFWFLSA-N 381.545 5.209 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NCc1ccc(CC#N)cc1 467258311 CNMMPKURULOJAS-UHFFFAOYSA-N 389.886 5.579 30 20 GKED Cc1cccc(C[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CC2)c1 469292488 IVTIXOBOPVPTKW-HSZRJFAPSA-N 387.527 5.011 30 20 GKED N#CCCCn1cc(C(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)c2ccccc21 469553565 FCBRZBMJYLGZOC-YJBOKZPZSA-N 391.437 5.044 30 20 GKED C=C[C@@](C)(CCOC)C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 473577163 SMXIHUPCRGSECI-VLIAUNLRSA-N 392.952 5.178 30 20 GKED CC(C)COc1ccc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 473674641 JMANLSGGXFQAOQ-QGZVFWFLSA-N 398.528 5.133 30 20 GKED CCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1[N+](=O)[O-] 473928596 PFTINCOGNAFHSC-KRWDZBQOSA-N 391.452 5.079 30 20 GKED CCN(C(=O)C[C@H](CC#N)c1ccccc1)[C@H](C)c1cccc(C(F)(F)F)c1 475365861 FPPSSZXKCFHKBK-APWZRJJASA-N 388.433 5.702 30 20 GKED CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 480474739 DFNLMBCABQEPDB-LIRRHRJNSA-N 385.895 5.039 30 20 GKED CSCCCCCNC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 480661510 RYRQHLZXSWZXBR-UHFFFAOYSA-N 397.544 5.101 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 482023421 ZVMRINXPUSWNAY-AUUYWEPGSA-N 387.405 5.105 30 20 GKED CC(C)(CC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)C(F)(F)F 483313593 WMCJHIRGVGQXBM-UHFFFAOYSA-N 392.396 5.205 30 20 GKED Cn1c([C@H](C#N)C(=O)c2sc(C3CC3)nc2-c2ccccc2)nc2ccccc21 483464367 DPWIUZZHMXHTDI-MRXNPFEDSA-N 398.491 5.064 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(NC(=O)c2cccs2)c1 485008312 JZIAXYGYJCZSSU-UHFFFAOYSA-N 397.544 5.601 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)c(F)c1 485473631 ZYRIGWBQKBFWTG-MJGOQNOKSA-N 391.895 5.017 30 20 GKED Cc1c(C(=O)N[C@@H](CCCC#N)c2ccccc2)ccc(C(F)(F)F)c1F 487408780 UZQVYYRRRDQTTN-KRWDZBQOSA-N 378.369 5.318 30 20 GKED C[C@@H](Nc1ccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1)c1ccccc1 502387619 NMIYZGOZXBEFDO-GOSISDBHSA-N 398.510 6.305 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC 505062045 OWNDZFSRIBMCPB-OAQYLSRUSA-N 380.488 5.191 30 20 GKED CCN(C(=O)c1sc(-c2ccc(C)o2)nc1C)[C@@H](C)c1ccc(C#N)cc1 509586771 TTYBYGMCEPLDFW-HNNXBMFYSA-N 379.485 5.115 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc(-c2cccs2)no1 510186637 PZJNTKQKGPOHSG-UHFFFAOYSA-N 376.466 5.024 30 20 GKED N#Cc1c(NC(=O)CSCc2ccc(Cl)cc2Cl)sc2c1CCC2 512359548 IGEPOVBLTQTVSN-UHFFFAOYSA-N 397.352 5.287 30 20 GKED C=C(C)Cn1c(S[C@H]2CCCc3ccc(F)cc32)nnc1-c1ccncc1 512728463 GPKUVNHRFBTOMK-IBGZPJMESA-N 380.492 5.225 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 513320084 JMBKTFZZXOMKBA-UHFFFAOYSA-N 397.503 5.628 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(Br)c[nH]1 516648653 HANIABCXKCDIRT-UHFFFAOYSA-N 396.244 5.002 30 20 GKED C[C@H](NC(=O)N[C@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 520416284 TVQGKZNKIBRNDD-YADARESESA-N 383.495 5.293 30 20 GKED C=CCOc1cccc(NC(=O)N(CC)Cc2cccc(Br)c2)c1 521208086 CYRBWHKAYBAOAS-UHFFFAOYSA-N 389.293 5.068 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)c1 530913187 NLMVUADCWWAHKS-UHFFFAOYSA-N 387.439 5.155 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C 531320338 FEGBVJFCTRVLGP-AWEZNQCLSA-N 394.475 5.320 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C1CC1 534229825 OPQCVJRNBBMPOB-CABCVRRESA-N 397.548 5.770 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2CCC(F)(F)CC2)cc1 536410371 ZTBYJIWBZBIMDR-UHFFFAOYSA-N 399.441 5.031 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 538073971 QMFXVAOBNYIZQE-GOSISDBHSA-N 390.405 5.015 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(-c2cn3cccc(C)c3n2)cc1 538299127 QRIKIQUMZBBECV-UHFFFAOYSA-N 377.488 5.011 30 20 GKED C=CCC[C@@H](NC(=O)NC[C@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 542536223 DLAJMNDQRIQRBI-XJKSGUPXSA-N 397.466 5.272 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cccc(Cl)c1Cl 544293562 ZAFYVEFMKAPGSM-CYBMUJFWSA-N 388.298 5.300 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC1CCN(c2ccc(C#N)cc2)CC1 552281665 FXLRFLWYVHAXNZ-UHFFFAOYSA-N 377.532 5.263 30 20 GKED N#CCCC[C@@H](NCc1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 552312008 LYEWEWJCIYNIKD-HSZRJFAPSA-N 380.495 5.550 30 20 GKED CC(C)Cn1c(-c2ccc(Cl)cc2Cl)nnc1N1CCC(CC#N)CC1 559133303 OSHUFDIZWPOFQJ-UHFFFAOYSA-N 392.334 5.038 30 20 GKED C=C(C)Cn1c(SCc2nc([C@H]3CCCC[C@H]3C)no2)nnc1-c1ccco1 562214898 ZIGBPFKRIOTDOW-CABCVRRESA-N 399.520 5.083 30 20 GKED C=CCn1c(-c2ccc3ccccc3n2)nnc1N1CCC[C@@H]1c1cccs1 567086587 NTVSYWYWQZRQLE-LJQANCHMSA-N 387.512 5.082 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 568306570 SNENNJXGPSMJIS-UHFFFAOYSA-N 379.460 5.046 30 20 GKED CCc1cncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 573314437 GNUUFRKKXBXXCX-FQEVSTJZSA-N 375.859 5.205 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2ccccc2F)CC1)c1ccccc1 576562418 DEWNTWBZAQCXPH-JOCHJYFZSA-N 379.479 5.150 30 20 GKED Cc1cc(C#N)ccc1CNC1(c2nc(-c3ccccc3F)c(C)s2)CCC1 590209519 GLHARKCXTVVVMM-UHFFFAOYSA-N 391.515 5.607 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@H]21 599410151 YWKDOIMAIGWXNO-DJGFWBNSSA-N 382.916 5.259 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 600202835 BYKFBIHPCDUHCT-ROUUACIJSA-N 398.478 5.253 30 20 GKED CSCc1c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)oc2ccccc12 602756571 VLDCFQKAMMXFQU-LBPRGKRZSA-N 396.537 5.606 30 20 GKED CCc1c(C)sc(NC(=O)c2csc(-c3ccccc3Cl)n2)c1C#N 609031326 JXOLAJKWZWFNJV-UHFFFAOYSA-N 387.917 5.520 30 20 GKED CC(C)CCSc1ccc(C(=O)N(CCC#N)CC(C)(C)C)cc1[N+](=O)[O-] 609191338 DDTOLNODDHSMSI-UHFFFAOYSA-N 391.537 5.135 30 20 GKED CCCN(C(=O)c1cc(Br)ccc1F)c1cc(Cl)ccc1C#N 609286327 USKBYQUFOQOKRC-UHFFFAOYSA-N 395.659 5.170 30 20 GKED C[C@H](Nc1nc(C(C)(C)C)ccc1C#N)c1ccc(NC(=O)c2ccncc2)cc1 613423832 QIURNJASJJWEBF-INIZCTEOSA-N 399.498 5.071 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 619762449 FLCSADITSYPWLI-HZPDHXFCSA-N 375.497 5.408 30 20 GKED FC(F)(F)c1cccnc1NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 642226893 XCKPVEKSJGUBQY-HTQZYQBOSA-N 380.254 5.422 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 661902512 OKPRIYCRMGORJL-UHFFFAOYSA-N 388.327 5.021 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cnn(-c2ccccc2Cl)c1C(C)C 666877206 ZSHHRTQJOMRRNE-IYBDPMFKSA-N 384.911 5.364 30 20 GKED Cc1cccc(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1F 678897263 HXOJDMYOXBTCLU-URLYPYJESA-N 386.311 5.165 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1nccc2ccccc12 682993859 CDZBTONJMYEIEI-QFIPXVFZSA-N 382.394 5.656 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 726469557 KTXUSIXVDVIRLN-UHFFFAOYSA-N 384.719 5.347 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2sc(-c3ccc(C)cc3C)nc2C)cc1 726940397 SHUYANUERIATDA-UHFFFAOYSA-N 389.524 5.604 30 20 GKED CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727935244 SAWJXRPZMCGJCV-UPVQGACJSA-N 383.495 5.485 30 20 GKED CCCCO[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 729071140 XKQFCUBRJJYACJ-SMDDNHRTSA-N 397.327 5.498 30 20 GKED Cc1c([C@@H](NCc2ccc(N(C)CCC#N)cc2)C(C)C)oc2ccccc12 732672185 AKEZPRAUWVHRTQ-QHCPKHFHSA-N 375.516 5.578 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cc(C)cc(C)c1 733080754 ADWDNGYLNJSKKQ-UHFFFAOYSA-N 385.393 5.010 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(-c3c(F)cccc3F)o2)c(C#N)c2n1CCC2 734368939 ZZCJGKLZSCXCJK-CLFYSBASSA-N 378.378 5.049 30 20 GKED C=CC[C@@H](NC(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680198 NVQBTQDIVCUSPF-HNAYVOBHSA-N 391.437 5.510 30 20 GKED CC(C)c1ccc(-c2nnc(SCc3cc(Cl)ccc3OCC#N)o2)cc1 735233220 MLNDOGZXUHZSSN-UHFFFAOYSA-N 399.903 5.708 30 20 GKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1nc(-c2cccs2)no1 735318977 TXFZQKGVHRLCHV-LLVKDONJSA-N 391.905 5.348 30 20 GKED O=C(/C=C\c1cccc2c1OCCCO2)c1ccc(SCC(F)F)cc1 741841904 IJDRPSKKIFTJSW-YFHOEESVSA-N 376.424 5.101 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 743573073 SIVVNYWCHCBPLY-IBGZPJMESA-N 375.472 5.599 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 749488173 UBVOWFBNOBVIQO-HXUWFJFHSA-N 397.434 5.080 30 20 GKED O=C1/C(=C\c2coc(-c3ccccc3)n2)CC/C1=C/c1coc(-c2ccccc2)n1 749886856 QYOAXVKQRKVYQS-AXPXABNXSA-N 394.430 5.827 30 20 GKED O=C(/C=C\c1cncc(F)c1)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 750215414 GUYSKJKUEAFMMF-YVACAVLKSA-N 393.258 5.100 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccc(F)cc2)CC1 752677381 KQHSZTQCOMTADA-MRXNPFEDSA-N 397.519 5.631 30 20 GKED C/C(=C\C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1OC(F)F 753201448 UAIGHQMWGSFLMM-FYWRMAATSA-N 386.398 5.013 30 20 GKED C=CC[C@H](NC(=O)N(CCc1cccc(F)c1)C1CCCC1)c1ccncc1 757213121 ZNUCXOXIUHNLSY-QFIPXVFZSA-N 381.495 5.035 30 20 GKED C=C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 759279324 NNOOGUCRBUTARG-HOCLYGCPSA-N 394.446 5.624 30 20 GKED CCOc1ccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] 765615325 FIEDSHRMGQGFNM-PKNBQFBNSA-N 380.425 5.013 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c2ccccc21 767920935 IBSPBSFMLQEZEH-OAQYLSRUSA-N 393.437 5.201 30 20 GKED N#C[C@H](C(=O)C1(c2c(Cl)cccc2Cl)CCC1)c1nc2ccccc2o1 774054398 OXEHSYLZZSECRN-GFCCVEGCSA-N 385.250 5.433 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](Cc1ccccc1)c1ccccc1 780678957 ZKXTVDMDVKJVQT-PGRDOPGGSA-N 385.467 5.083 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1c[nH]c2ccccc12 786401095 IKIUTVRWMWVTDN-IUODEOHRSA-N 377.444 5.287 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(Cl)ccc1O 786956397 DCSPTLUXUUQAMY-LJQANCHMSA-N 397.906 5.192 30 20 GKED C[C@@H](Cn1ccc2ccccc21)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 796811815 QUSKCIOBMIOBDL-LPHOPBHVSA-N 385.492 5.277 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)cc1 798505569 RRGAKENJJZCQNR-JQFCIGGWSA-N 375.299 5.320 30 20 GKED O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 801985473 WGMWNUMQSBQLCN-KBPBESRZSA-N 397.334 5.297 30 20 GKED N#C[C@H](C(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 819946354 MEQNDRSTGUGSNS-MDUKQBBOSA-N 393.295 5.028 30 20 GKED N#C[C@]1(c2nc(-c3ccccc3OCc3ccccc3)no2)CC2CCC1CC2 904465690 MLMYDQAQQNQUQB-VWLBVBLESA-N 385.467 5.287 30 20 GKED CCN(Cc1cccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353660 PZFPJFZVNMXQAZ-OAQYLSRUSA-N 375.497 5.458 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 916847413 GTPDPBCOGZUKRM-DOTOQJQBSA-N 378.497 5.372 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@H](C#N)c2nc3ccccc3s2)c1 916847994 ZXZCWRISSYLPGK-WBVHZDCISA-N 378.497 5.372 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CC3(Cl)Cl)cc2Cl)cc1 917876584 MMJRVFFWTRFNDY-ZDUSSCGKSA-N 381.646 5.136 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 1776042173 QNJDMMDCQQCSEW-UHFFFAOYSA-N 395.802 5.059 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1sc2c(Cl)cccc2c1C 1776076206 BOCFFMSUSIGUFR-UHFFFAOYSA-N 376.840 5.537 30 20 GKED Cc1c(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cccc1C(=O)O 1776088072 NUIHOXWBIOMYRI-MRXNPFEDSA-N 376.378 5.448 30 20 GKED CCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776112844 MMGVFPGKTOYGHH-XFXZXTDPSA-N 376.408 5.199 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)o2)cc1 1776125570 LYHDQBAZJSWFFJ-OSFMQXNQSA-N 396.483 5.869 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(C)c(C(=O)O)c3)s2)cc1 1776133145 OLOONSYWGAMKES-WDZFZDKYSA-N 393.464 5.030 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c(C)s1 1776133469 XQQPTBRXALYFEM-LEQVUBRHSA-N 392.476 5.466 30 20 GKED CC(C)(C)Oc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776265492 KEQVFRASDLZQCK-NTMALXAHSA-N 398.455 5.812 30 20 GKED CC(C)[C@@H]1/C(=C/c2c(F)ccc3sc(C(=O)O)cc23)C(=O)c2ccccc21 1776308575 FJELGCTUKHTWEX-CPYXBQISSA-N 380.440 5.758 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cc1)C(=O)O 1776469805 NOERWUYBHGEXNM-KOTGUFOOSA-N 396.439 5.302 30 20 GKED O=C(/C=C\c1ccc(C(=O)O)s1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1777569812 NGEVALOYHRDETA-IWQZZHSRSA-N 394.292 5.380 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@@H]3CCC5)cc2)cc1 1777671066 YRYJXNDSYKBFFH-CPOKCXMASA-N 380.443 5.752 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)c3cc(C(C)(C)C)oc3C)CCC2)cc1 1791587536 OSBDUSXPBCXVDQ-UHFFFAOYSA-N 394.515 5.209 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)cs2)cc1 48858425 QLFNEHQCZYLMLO-GOSISDBHSA-N 399.475 5.247 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3c3ccncc3)c2)cc1 105039766 KYBGUPAZXSMYIX-JOCHJYFZSA-N 384.439 5.115 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C1CCC1 108372877 AVSFOSBEAIQJSG-HXOBKFHXSA-N 393.556 5.008 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Nc1ccc(F)cc1OCC#N 135307192 ZHFFERXUZALYEO-KGLIPLIRSA-N 389.858 5.037 30 20 GKED COc1ccc(CNc2cccc(N3CCC(C)CC3)c2)cc1OCCCC#N 151507620 XPAHESCTHIYSRU-UHFFFAOYSA-N 393.531 5.226 30 20 GKED C=CCCC(=O)N[C@@H](C)c1sc(-c2ccccc2Br)nc1C 160412640 IOOADCZBHKKYBQ-NSHDSACASA-N 379.323 5.024 30 20 GKED Cc1nccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1Cl 163851517 VRYAYHSHMGTZII-UHFFFAOYSA-N 379.872 5.319 30 20 GKED CCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 170866768 VISDSPXMLZIDHN-UHFFFAOYSA-N 391.515 5.002 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)c1cccc(CC#N)c1 172805081 ZLCMLVVLTDVDND-UHFFFAOYSA-N 398.441 5.006 30 20 GKED C[C@H]1CCN(C(=O)c2cc(C#N)cs2)c2cc(C(F)(F)F)ccc2S1 176951907 VKRRMIPZSADCPY-JTQLQIEISA-N 382.432 5.170 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1 182035404 KSHXXUMEOKCCAX-CQSZACIVSA-N 394.377 5.300 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](c1c(C)nn(-c2ccccc2)c1C)C(F)(F)F 186316613 CHPDKHWBWIAKLH-OAQYLSRUSA-N 398.432 5.062 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccnc3C(F)(F)F)c2)cc1 188376694 ZRFRJFXBFRUNQN-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(NC(=O)C(C)(C)C)n1 189901590 PJVBZSRPKMNITI-UHFFFAOYSA-N 399.560 5.161 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1nc(-c2ccccc2)cs1 191837795 MFPLKHIOWCKCGK-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc2ccccc2n1)c1nc2cc(Cl)ccc2s1 255550184 ZRVBSPSDAOHYRW-HLRDLLSLSA-N 389.867 5.388 30 20 GKED C=C(Cl)CSc1nnc(-c2ccccc2OC)n1CCc1ccccc1 255927722 JZPQHQNBTBGWNZ-UHFFFAOYSA-N 385.920 5.041 30 20 GKED CC(C)c1ccc2ncc(C#N)c(N3CCC[C@@H](c4ncc5n4CCCC5)C3)c2c1 409642426 WCRXCIANKHUCPN-LJQANCHMSA-N 399.542 5.147 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1cccc(Cl)c1 430600025 RLVBTOJCJJAATG-HNNXBMFYSA-N 398.919 5.078 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccccc1 431773039 NOTGVUAJGBUSED-SFTDATJTSA-N 381.907 5.525 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)N[C@@H](CCCC#N)c1ccccc1 431877364 HBARVPHBVVYQBB-RTWAWAEBSA-N 379.504 5.271 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1ccccc1 431980654 KAADULXEWRIZRN-SNRMKQJTSA-N 385.870 5.069 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1 434211988 PSVQMPISAKOQNQ-MJGOQNOKSA-N 393.556 5.738 30 20 GKED CSc1ccc(CCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 436350107 FOIRABAERKERRT-HNNXBMFYSA-N 385.558 5.024 30 20 GKED COc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H](CCC#N)c1ccccc1 438859597 PTBHCTAYNPEDKE-SFTDATJTSA-N 379.504 5.127 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)CCCOCc1ccccc1 439519043 TWMOOURJAUJVFT-GOSISDBHSA-N 397.544 5.151 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1 455512317 JSJTZQQWMJFCJF-KBPBESRZSA-N 392.446 5.856 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1)c1ccccc1 458842356 PHBVKXWDBUTOKN-MSOLQXFVSA-N 393.453 5.186 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1c(Cl)cccc1Cl)C1CC1 462050203 IOHQJJPGXGRBQL-LJQANCHMSA-N 388.298 5.158 30 20 GKED C[C@H](SCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)c(Cl)c1 463201678 WMUDJQYRXJOFJA-NSHDSACASA-N 390.295 5.909 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1cn(-c2ccccc2)nn1 471643967 SZTGPKNFFQIJHX-KRWDZBQOSA-N 381.439 5.104 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccc(F)cc1 476503495 IFBROAVVHPOUSR-CYBMUJFWSA-N 386.496 5.409 30 20 GKED CC(C)CN(C(=O)C[C@H](CC#N)c1ccccc1)[C@H]1CCCc2cccnc21 476828251 WOWFRBSJBHBTGQ-VXKWHMMOSA-N 375.516 5.031 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(C#N)c(Cl)c1 483075233 ODSITGNITANOFZ-UHFFFAOYSA-N 386.238 5.335 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1 485370047 AUYBMSGVGLTQBT-LJQANCHMSA-N 397.563 5.301 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2ccc(Cl)s2)on1)c1ccccc1 487207843 IEHYOSODLMQZHF-AWEZNQCLSA-N 385.876 5.221 30 20 GKED N#CCCC[C@@H](NC(=O)CCCn1ccc2cc(Cl)ccc21)c1ccccc1 487245890 ZPMCFEGGNCHTCB-OAQYLSRUSA-N 393.918 5.626 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)C(c3ccccc3)c3ccccc3)CC2)cc1 503901990 PXRGEPRNRMIZLS-UHFFFAOYSA-N 378.475 5.006 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H]1CCC[C@@H](C)C1 510858895 GFWCPCKGDCFSNE-VQIMIIECSA-N 377.488 5.701 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Cl)cc1Sc1ccc(Cl)cc1)C1CC1 515557313 VYPXCPSBDJOPDP-MRXNPFEDSA-N 377.296 5.177 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc2ccccc12 518389748 CENGCQGCCNSFFC-KRWDZBQOSA-N 393.446 5.390 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 520603449 IWJNBBBQUIXUST-MRXNPFEDSA-N 382.423 5.105 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1F 524565322 PODCDNBAQNYBQA-CHWSQXEVSA-N 375.444 5.099 30 20 GKED N#CCCCOc1cccc(CNc2ccnn2Cc2ccc(Cl)c(F)c2)c1 531917622 XXVBLPCGMVYICF-UHFFFAOYSA-N 398.869 5.019 30 20 GKED C=CCC[C@H](NCc1cc(-c2cccnc2)n[nH]1)c1ccc(C(F)(F)F)cc1 533069612 MHLBZLZWPKUQIO-IBGZPJMESA-N 386.421 5.288 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)cccc1-c1ccccn1 535093305 BDLCPKKDKLLAGL-FQEVSTJZSA-N 395.384 5.071 30 20 GKED N#CC1(CCCSc2nnc(-c3ccc4ccccc4c3)o2)CCOCC1 538612354 STCCQZRFFQJMOI-UHFFFAOYSA-N 379.485 5.082 30 20 GKED COc1cccc([C@H](NCCCC2(C#N)CCOCC2)c2ccccc2Cl)c1 540809932 ZNNLVWFKYWMJAH-QFIPXVFZSA-N 398.934 5.128 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)C1(C#N)CC(C)C1 541530603 YJZNMEOCBBXKBA-UHFFFAOYSA-N 379.460 5.289 30 20 GKED C[C@@H](NCc1ccn(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541994980 OIPSGAKCZVRBBV-LJQANCHMSA-N 378.479 5.262 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2cccc(C(F)F)c2Cl)cc1 544634075 WBTYYPKUAHYWTA-UHFFFAOYSA-N 394.809 5.229 30 20 GKED CCC(CC)N(C(=O)c1ccc(Cl)c(C#N)c1)[C@@H]1CCCc2cccnc21 549047710 ZWGJNQUSPUUJSC-HXUWFJFHSA-N 381.907 5.315 30 20 GKED N#CCCN(C(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccc(F)cc1 553820647 RPSNDPZPKIOJQN-UHFFFAOYSA-N 399.878 5.092 30 20 GKED C=CCN(C(=O)c1ccc(C(F)(F)F)cn1)c1nc(-c2ccccc2)cs1 561576243 SIVCHHOVBCXRFE-UHFFFAOYSA-N 389.402 5.057 30 20 GKED CC(C)(CCC#N)CNC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 561733157 PMIQABUJKBQDTJ-UHFFFAOYSA-N 382.316 5.177 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(Br)cc1C#N 561866918 KXPQYZLRRKMZSO-GFCCVEGCSA-N 386.318 5.123 30 20 GKED C[C@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-c2cccc(C#N)c2)cc1 569301284 NAWFQPBXHRRPHB-SJORKVTESA-N 399.450 5.114 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC12CCC(C(F)(F)F)(CC1)CC2 570826087 FZJGZEUQTMKSKD-UHFFFAOYSA-N 398.428 5.610 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@H]1c1ccccc1 577563480 RZPFTCDQODFUIQ-PXNSSMCTSA-N 392.478 5.085 30 20 GKED O=C(Nc1cc(F)ccc1Cl)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 590338801 LPOIQVURFOMEJN-OCAPTIKFSA-N 392.702 5.074 30 20 GKED CC[C@@H](C#N)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 593487002 JUMKRSFYMBAYQT-HNNXBMFYSA-N 378.451 5.220 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1Cl 603759197 XLQCJDNJZJDCJD-HNNXBMFYSA-N 397.843 5.217 30 20 GKED N#C[C@@H](C(=O)c1cc2ccc(F)cc2s1)c1nc(-c2ccncc2)cs1 604005419 GCWBYILJTJREBZ-AWEZNQCLSA-N 379.441 5.049 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)o2)cc1 608552962 DKNLDIAMOBHITI-MRXNPFEDSA-N 390.439 5.748 30 20 GKED CCc1c(C)sc(NC(=O)Cc2csc(-c3cccc(C)c3)n2)c1C#N 609032742 AHYNIDUJBUQXKE-UHFFFAOYSA-N 381.526 5.104 30 20 GKED Cc1cccc2sc(C(=O)Nc3cc(C#N)ccc3OC(F)F)c(Cl)c12 609066182 AIAMHHRWBPIQBY-UHFFFAOYSA-N 392.814 5.589 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)NCc1ccc(C#N)cc1F 609254099 ICWMYGDOYZKMGA-UHFFFAOYSA-N 377.872 5.173 30 20 GKED CSCc1c(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)oc2ccccc12 609414998 HYQPTCTVDLNDOV-IBGZPJMESA-N 392.524 5.588 30 20 GKED CCN(CCc1cccs1)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609986907 LADBPVOONXGEQJ-UHFFFAOYSA-N 375.497 5.068 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)CCc2ccc(C(C)C)cc2)c1C 610053870 RYXQYTHDCMNWLP-UHFFFAOYSA-N 386.499 5.056 30 20 GKED C[C@@H](c1ccccc1)n1c(SCc2ccnc(C#N)c2)nnc1-c1ccccc1 610956626 YGKKWXWSQLJISV-KRWDZBQOSA-N 397.507 5.113 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCCc4sccc43)cn2)cc1 613460930 DMWRIFRRRKUECH-GOSISDBHSA-N 390.468 5.006 30 20 GKED CSC[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(C(F)(F)F)cc1 619755270 VGEWJJIPZRWXEE-QGZVFWFLSA-N 384.854 5.424 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCC12CCCC2 650246671 CDSIBOMTWZQXJG-UHFFFAOYSA-N 398.322 5.526 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCOCC2)[C@H]1c1ccco1 666866233 JWKWAPWEDQJCNO-JOCHJYFZSA-N 394.515 5.517 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1 666866603 VWWMYLAIRDJYBL-QFIPXVFZSA-N 378.516 6.281 30 20 GKED N#C[C@@H](C(=O)c1coc(C2CCC2)n1)c1nc2cc(C(F)(F)F)ccc2s1 683689686 IARGOWTWJSSBAV-NSHDSACASA-N 391.374 5.061 30 20 GKED CCOc1ccc(C(C)=NNc2ncnc3c2oc2ccccc23)cc1OCC 725843906 HFYTXCJBNCQLEH-UHFFFAOYSA-N 390.443 5.010 30 20 GKED C#Cc1cccc(NC(=S)N(CC)[C@H](C)c2cccc(C(F)(F)F)c2)c1 726484109 DCQNKKSVTJWSJQ-CQSZACIVSA-N 376.447 5.467 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1ccccc1F)c1ccc(F)cc1 729822172 MGYGLDAHCFIBRR-UHFFFAOYSA-N 379.435 5.240 30 20 GKED CC(C)(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730416164 BIHVBKFVPQFTOK-QGZVFWFLSA-N 380.488 5.542 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)nc2ccccc12 730990150 TVTWSXZAKDVKAV-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@H](C)c1csc2ccccc12 732918572 OLPOKPKVCHHLFO-HZPDHXFCSA-N 384.570 5.217 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2ncnc3sc4c(c23)CC[C@@H](C)C4)c1 733793161 KSSQTEHIJAEVDX-ZBFHGGJFSA-N 392.528 5.109 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1 734430062 RXDMUIKDSBDEAW-UHFFFAOYSA-N 395.462 5.006 30 20 GKED C[C@@H](CNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)(C)C 734645384 DOKLMIDWCUYVSG-KRWDZBQOSA-N 379.504 5.135 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2ccnc3cc(Br)ccc23)c1 734834037 YSWMFJOUHZBQOA-INIZCTEOSA-N 396.288 5.290 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](Cc1ccccc1)c1ccccc1 735306091 IANPJWGNPLGPMK-QFIPXVFZSA-N 376.887 5.316 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1nc(-c2ccccc2F)oc1C 737476350 UXNCQMPPXKDRFL-UHFFFAOYSA-N 390.867 5.332 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 737818425 HRPZRCCJJHZZNP-UHFFFAOYSA-N 380.451 5.171 30 20 GKED C/C(=C/C(=O)Nc1nc(C)c(SCC#N)s1)c1ccccc1C(F)(F)F 741901704 BTPRNGZAEZHDEH-KTKRTIGZSA-N 397.447 5.128 30 20 GKED Cc1cc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)ccc1-n1cncn1 742432183 UHZUDQAGYAXCFC-JXMROGBWSA-N 379.419 5.371 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc([N+](=O)[O-])c1Cl 752985724 XKBXQEGMGLGLNF-UHFFFAOYSA-N 377.787 5.039 30 20 GKED CCN(CC)[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 755610398 NJOZSAUIGMMJLA-QFBILLFUSA-N 397.931 5.209 30 20 GKED N#Cc1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1C(F)(F)F 761740609 QQECBHIGIWBTFG-UHFFFAOYSA-N 393.579 5.790 30 20 GKED CCCn1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C1CC1 765625636 UJQYWGSVWSQLTA-OAQYLSRUSA-N 384.483 5.078 30 20 GKED C[C@H]1CN(c2ccc(NCC(C)(C)CCC#N)cc2C(F)(F)F)C[C@H](C)O1 770565340 QTNWZIIWSQMQQA-GJZGRUSLSA-N 383.458 5.061 30 20 GKED CCCN(C[C@H]1CCCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775487523 JJPCZLKBYDWDIM-PKTZIBPZSA-N 391.515 5.155 30 20 GKED COc1ccc(N[C@H](C)c2ccc(C#N)c(F)c2)cc1NC(=O)C1CCCCC1 777697773 OYBLJFQUGQMZFX-OAHLLOKOSA-N 395.478 5.398 30 20 GKED C#CCOc1cccc(Cl)c1CNc1cccc(C[S@@](=O)C(C)(C)C)c1 778173482 JDNKWGZOUGNMOO-AREMUKBSSA-N 389.948 5.011 30 20 GKED C=CCC[C@@H](NC(=O)NC(C)(C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 787296320 QZFBCTLWXGZSMN-GOSISDBHSA-N 398.469 5.217 30 20 GKED C=CCn1c(SCc2cnc(Cl)cn2)nnc1-c1ccc(C(C)(C)C)cc1 789999215 FQHRNBGORDEURU-UHFFFAOYSA-N 399.951 5.164 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2c(Cl)ccc(F)c2C)cc1OC 791042991 OIFIXWGTCCDNPZ-POHAHGRESA-N 375.827 5.013 30 20 GKED CCOC(=O)c1scnc1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 794940437 ZSFXXMRHEXHHJI-CMDGGOBGSA-N 377.421 5.115 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2coc3cc(F)ccc23)cc1 796630214 OIHKPOVWDVNUFO-UGSOOPFHSA-N 378.403 5.047 30 20 GKED C=CCCCCCCNC(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl 806259977 DWUDGMRBIMBPPS-UHFFFAOYSA-N 379.932 5.078 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc(C2=CCCC2)cc1 810530377 CFSPYADOQREHCN-KRWDZBQOSA-N 399.277 5.522 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)sc2cc(F)ccc12 813210303 LYYIXFSHURSWSB-ZDUSSCGKSA-N 378.350 5.253 30 20 GKED N#C[C@H](C(=O)C(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813215494 ZQLBWLHYGWJVAS-SFHVURJKSA-N 380.369 5.109 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@]23CCCC[C@@H]2C3(F)F)cc1 821861129 PGYCAZYYNINAOR-RZUBCFFCSA-N 380.438 5.496 30 20 GKED C=CCc1cc(OC)ccc1OC(=O)CCc1ncc(-c2ccccc2Cl)o1 822196091 VZNSQLWXKHMYAE-UHFFFAOYSA-N 397.858 5.270 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)N(C(=O)OC(C)(C)C)C1CC1 830897499 OHSZZLTXMPRQRZ-INIZCTEOSA-N 386.536 5.265 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842946167 VTRRMUVBFBESHB-MGPUTAFESA-N 388.492 5.331 30 20 GKED CC[C@H](C)n1ncc(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)c1C1CC1 860484610 OYFCETUCBPQTCT-INIZCTEOSA-N 376.504 5.054 30 20 GKED CC(C)(C)c1nnc(S)n1N=Cc1ccc(-c2ccccc2Cl)s1 874040758 SWQHVLJLSVKXEA-UHFFFAOYSA-N 376.938 5.128 30 20 GKED N#C[C@H](C(=O)[C@@H]1Cc2ccccc2S1)c1nc(-c2ccc(Cl)cc2)cs1 915102341 XKCSZAVXODVXJR-QAPCUYQASA-N 396.924 5.357 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCc1ccc(C(C)C)cc1 916905141 ATLALSDBODHQNK-JOCHJYFZSA-N 390.527 5.215 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Cl 917026198 AKVSTVYSWSYKKB-RHSMWYFYSA-N 396.899 5.416 30 20 GKED CCN(CC)c1ccc2cc(C(=O)/C=C\c3ccc4ncccc4c3)c(=O)oc2c1 917615250 OSVTXKKKKZPFOP-WQLSENKSSA-N 398.462 5.084 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1 917749858 NZGROFIXTXTJSW-AWEZNQCLSA-N 377.296 5.096 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3sccc3Br)cs2)cc1 918713681 SZCCVTGXMQPMFQ-VOTSOKGWSA-N 390.327 5.839 30 20 GKED C/C=C\COc1ccc(CCC(C)=NNc2c(F)c(F)nc(F)c2F)cc1 920365302 OTBOKODDEUJTES-AMZAPTKDSA-N 381.373 5.014 30 20 GKED CC#CC[C@H](NCc1c(Cl)cccc1Oc1c(C)ccc(C)c1C)C(=O)O 1776193653 AAQZJDZMKANCQP-IBGZPJMESA-N 385.891 5.014 30 20 GKED CC#CC[C@@H](NCc1c(Cl)cccc1Oc1c(C)ccc(C)c1C)C(=O)O 1776193654 AAQZJDZMKANCQP-LJQANCHMSA-N 385.891 5.014 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776339939 RQGFUMMVSDTIJO-XNTDXEJSSA-N 398.502 6.075 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2)cc1OC 1776782804 LCIIIXCHRJPHRT-JOCHJYFZSA-N 383.532 5.656 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@H](C(=O)O)CC[C@@H]2C)cc1 1776787563 XWRWOUVTFMPKKN-FUHWJXTLSA-N 377.550 5.074 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)[C@@H]2CCc3ccccc32)cc1 1776787907 DNFZXLNIKNVWOP-RPWUZVMVSA-N 395.543 5.309 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1OC 1776801031 BIFMTCJNUWKFGP-CLFYSBASSA-N 388.847 5.122 30 20 GKED N#Cc1ccc(/C(=C(/c2ccccc2)c2ccc(C#N)cc2)c2ccccc2)cc1 1848350062 PXMVEKBIIOGHRB-DQSJHHFOSA-N 382.466 6.437 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1OCc1ccc(Cl)cc1 32615236 BXNDYADZYGWHHE-UHFFFAOYSA-N 390.870 5.063 30 20 GKED Cc1nc(NC(=O)c2ccccc2Oc2ccccc2)sc1SCC#N 44789219 MXAWJUQSBKOOII-UHFFFAOYSA-N 381.482 5.112 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cccc(F)c2)cs1 54895221 UWGXQVMBHICEJP-FLIBITNWSA-N 380.444 5.171 30 20 GKED CN(C(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1cccc(C#N)c1 63325365 AAUMSGOYBIHWHT-UHFFFAOYSA-N 382.419 5.160 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)n1 67785647 KVOYYJAAWLFOTF-NSHDSACASA-N 394.308 5.372 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 113321685 IBBYUJLIVYTYSR-HXUWFJFHSA-N 398.506 5.192 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H](C)c1cccs1 134005453 WQXKINODQLBYJJ-KBPBESRZSA-N 376.572 5.575 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(F)cc2OCC#N)o1 135316245 PFKHJIWHTJTBGG-SFHVURJKSA-N 385.439 5.033 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1nc2cc(Cl)ccc2s1 174002629 FZWVUVTYPATTHQ-YNEHKIRRSA-N 388.826 5.208 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc2ccccc2c1 175956481 ZYBWTYOFQUYXDG-YWZLYKJASA-N 383.476 5.338 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)c(C#N)s1 179553561 ZWXFIUXHDGIWDG-UHFFFAOYSA-N 392.484 5.097 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)ccc1OC 180175196 WZGVIOHLSCFMFU-DENIHFKCSA-N 384.907 5.270 30 20 GKED Cc1cccc(COc2cccc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c2)c1 182152843 GHMABAKYFAXNTN-SFHVURJKSA-N 386.451 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 188061885 BYBYODBUXIXBIT-UHFFFAOYSA-N 375.512 5.629 30 20 GKED C[C@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Br 190899213 SBJPUBJAEJDDTA-OLZOCXBDSA-N 389.318 5.142 30 20 GKED N#CCCCOc1cccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 237827209 ZZIXHCGXMBTVMM-UHFFFAOYSA-N 397.478 5.432 30 20 GKED C=CCn1c(Sc2ncnc3sc(-c4ccccc4)cc23)nnc1C1CC1 301087329 LUMMVJONZQUJEP-UHFFFAOYSA-N 391.525 5.164 30 20 GKED COc1ccc([C@H](Nc2ncccc2C#N)c2ccc(C(F)(F)F)cc2)cc1 302022732 IZJJZXSOLZLOFZ-LJQANCHMSA-N 383.373 5.182 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1cccc(C#N)c1 303256382 CCDIDRXWYABLND-GFCCVEGCSA-N 381.888 5.135 30 20 GKED O/C(=N/[C@@H]1CCOC2(CCCCC2)C1)c1cc(-c2ccccn2)ccc1Cl 328717429 FHXMSEBUDSBDPW-QGZVFWFLSA-N 384.907 5.589 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@H]3CCC[C@H](C(F)(F)F)C3)n2)s1 328801729 ZMJNDYGDGQHMJE-QWRGUYRKSA-N 389.468 5.840 30 20 GKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)C1CCC(/N=C(/O)C2CCCC2)CC1 329288944 QEKPIDNDFBHLFP-HTPOPCQBSA-N 391.556 5.182 30 20 GKED OC(=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)[C@@H]1C[C@@]12CCOC2 329633861 WUUFKMHJSCYHAK-RCDICMHDSA-N 393.512 5.185 30 20 GKED N#Cc1cc(Cl)ccc1N1CCC[C@@H](c2n[nH]cc2N=C(O)C2CCCC2)C1 330043839 HLMPEMWECMKMLB-OAHLLOKOSA-N 397.910 5.097 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@@H](C)C[C@H](C)C2 411015393 QCURGNGXFKMBBV-YUMQZZPRSA-N 399.463 5.342 30 20 GKED O=C(Nc1cc(F)ccc1SCC(F)F)c1ccc(F)cc1C(F)(F)F 429529455 PNJLHQLOGLSHIP-UHFFFAOYSA-N 397.315 5.593 30 20 GKED N#CCCC[C@H](N=c1ccc(Br)c(C(F)(F)F)[nH]1)c1ccccc1 431510666 HNDGLGZKLYWVEJ-AWEZNQCLSA-N 398.226 5.132 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(OCC(F)(F)F)c1)c1ccccc1 432699818 PVZCBYWSWSKXCG-SFHVURJKSA-N 391.393 5.184 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(C2CC2)c1 451116786 RYTWOFJTHIPSDF-SJORKVTESA-N 393.556 5.105 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(Cl)cc2)cc1 454536102 ZTIKFLIEKUOGGC-HXUWFJFHSA-N 397.906 5.015 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 454634708 CQWAHJDVFSGVFA-LJQANCHMSA-N 393.878 5.156 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F)c1ccccc1 456578158 PHKPVUUNNYFXDA-BJJXKVORSA-N 379.344 5.078 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c(Cl)c1 464415531 XUOJEQKJJFKRCD-OAHLLOKOSA-N 396.796 5.423 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)[C@@H]1CCOC(C)(C)C1 464684704 HLWRYICBGPIQBQ-LJQANCHMSA-N 394.540 5.129 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)[C@@H]1CCOC(C)(C)C1 464689073 IYUDAGNOLCLUKX-HXUWFJFHSA-N 392.499 5.079 30 20 GKED CCC[C@H](CC1CCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 470771204 FFVIJBDRDNPKPG-HXUWFJFHSA-N 395.547 5.205 30 20 GKED CCC(=O)c1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 471700791 DGNSANMESRKDPM-UHFFFAOYSA-N 398.462 5.291 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 475567982 FGTHPULFKRHWRT-UHFFFAOYSA-N 385.511 5.731 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1C)[C@@H](C)c1cccc(C(F)(F)F)c1 476845900 JOZFBQZIEFCFNZ-AWEZNQCLSA-N 375.394 5.501 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc2ccccc12 480321756 VXKIKOSDERCGCJ-LJQANCHMSA-N 385.511 5.640 30 20 GKED CC(C)n1nccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 480675865 NDZSCWOGPVPGPR-UHFFFAOYSA-N 380.835 5.034 30 20 GKED N#CCCC[C@@H](NC(=O)CCOc1ccc(Cl)cc1Cl)c1ccccc1 487578718 XLMWDKUHDXVSEP-GOSISDBHSA-N 391.298 5.314 30 20 GKED N#CC1(C(=O)Nc2nc(-c3cc(Br)cs3)cs2)CCCCC1 497935180 CTKLTYGJWHHTKX-UHFFFAOYSA-N 396.335 5.047 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(F)c(F)c(F)c1F 498995828 DCSMYEWLGXPWDS-MRVPVSSYSA-N 379.275 5.095 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCC1 504968604 GRAGHEILCGKFOP-KRWDZBQOSA-N 381.442 5.176 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510465108 SRXDUBXZENLCRJ-UHFFFAOYSA-N 394.862 5.208 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCCCC[C@@H]1c1ccc(OC)cc1 510859190 HTWGFJTXUVCWPY-OAQYLSRUSA-N 393.487 5.115 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc(C#N)cc1[N+](=O)[O-] 511416223 RVTHLEHDDHZOEM-NSHDSACASA-N 382.420 5.211 30 20 GKED C[C@H](c1ccc(Br)cc1)c1noc(C[C@@H](CC#N)c2ccccc2)n1 515182335 VDCGPSKKNKHYJL-RHSMWYFYSA-N 396.288 5.224 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)CCCCCc2cccs2)CC1 520336703 PIVUMNLZMNBGFC-UHFFFAOYSA-N 396.556 5.229 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 521366579 ORQYWPKWNUUIFH-UHFFFAOYSA-N 385.467 5.447 30 20 GKED CCN(CC)C(=O)[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 522547760 SJXRUQLHBPALOU-XMMPIXPASA-N 399.494 5.372 30 20 GKED C=CCC[C@@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)c1ccccc1 536126617 WSHPHZMDVZPQPJ-XMMPIXPASA-N 386.495 5.027 30 20 GKED CSc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1C 537142826 FETGJTWBTKXGDX-UHFFFAOYSA-N 390.533 5.992 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 538046408 WRRDGCLEOSOYFO-SJLPKXTDSA-N 385.492 5.392 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](Cc1ccc(F)cc1)C(C)C 539657608 PZBVLBVIXHLBKI-JOCHJYFZSA-N 378.491 5.110 30 20 GKED COc1ccc([C@H](NCc2cccc(C#N)c2)c2ccccc2Cl)cc1OC 539809383 LGOPWXNVFQRHIV-QHCPKHFHSA-N 392.886 5.108 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 540220330 YTZQCCSWPPYPOQ-QDSKXPNFSA-N 397.522 5.204 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cccc(C(F)(F)F)c1 542297055 OIDDFPKFNANCIZ-OAHLLOKOSA-N 386.417 5.262 30 20 GKED Cc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)c(-c2ccnn2C)c1 548981706 KWIANBROINNNHL-UHFFFAOYSA-N 392.506 5.224 30 20 GKED N#C[C@H](C(=O)c1coc(C2CCCC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 549420826 MVPFNDZNZMDQON-OAHLLOKOSA-N 397.887 5.599 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3Cc4cccc(Cl)c4C3)cc2)cc1 554417687 LJFNXNJCMDTEIO-UHFFFAOYSA-N 389.842 5.552 30 20 GKED Cc1ccc(NC(=O)C[C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Cl 574588774 AWHGRFBAMMCZIA-LAUBAEHRSA-N 383.923 5.390 30 20 GKED CC[C@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 594092999 LGJDPFAJDPQKOO-YHKKIHSWSA-N 385.467 5.079 30 20 GKED N#CC1(c2ccc(CNCc3cccc(NC(=O)C4CCCCC4)c3)cc2)CC1 594916754 BRPSGJTVDORATH-UHFFFAOYSA-N 387.527 5.050 30 20 GKED N#CCN1CCC(NCc2ccc(N(c3ccccc3)c3ccccc3)cc2)CC1 609334784 HFMBGGIPCCFQFV-UHFFFAOYSA-N 396.538 5.234 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)o1 609378012 UFRFDODZVCTUTH-AWEZNQCLSA-N 380.444 5.590 30 20 GKED Cc1cccc(OCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 609381635 ASLJCCJHBJYBHF-UHFFFAOYSA-N 394.418 5.037 30 20 GKED Cc1nc(-c2ccc(CNc3nc(C(F)(F)F)ccc3C#N)s2)cs1 609668986 KIWJAVWYYFRQPA-UHFFFAOYSA-N 380.420 5.078 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCS[C@H](c2ccccc2)C1 609791877 VKKMPRMRNKMQCP-QHCPKHFHSA-N 384.504 5.156 30 20 GKED Cc1cc(Cl)cc2nc(SCc3nnc(-c4cccc(C#N)c4)o3)oc12 610218772 RQDCVKFQCGJAIS-UHFFFAOYSA-N 382.832 5.004 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(COCc2ccccc2)cc1 611390602 KLCLDVANDCYPGC-AREMUKBSSA-N 382.507 5.442 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618848333 UFWNEUDBUMDNKK-CWTRNNRKSA-N 388.298 5.255 30 20 GKED CC(F)(F)c1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 644792307 RIUXDVYSTWPDHH-TXEJJXNPSA-N 389.286 5.001 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)nc([C@@H](C)CC)nc1C 653760224 MBGSMNCDQYPJDZ-INIZCTEOSA-N 379.548 5.640 30 20 GKED Fc1cnc2c(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)ccnc2c1 672162013 UGILIHXVKJSBFI-JZYVYDRUSA-N 381.295 5.090 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)c(F)c(F)c1 675739627 ZGSLPXSSNIKCRT-SNXWAXQRSA-N 393.293 5.664 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c(C(F)(F)F)c1 678298855 ZCJKOIQMBSJKFL-GHMZBOCLSA-N 383.229 5.017 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 681718967 IJEPSCBURLTHNA-GFCCVEGCSA-N 398.768 5.598 30 20 GKED C=CCCOCc1nc(-c2ccc(-c3csc(-c4ccncc4)n3)cc2)no1 685006954 RAAJIYRCTHHNEX-UHFFFAOYSA-N 390.468 5.015 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(Cl)s1 730988729 BXJCHDMBUYGLAW-GFCCVEGCSA-N 396.990 5.525 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 731322210 WRHKWKYOSYVLSQ-GFCCVEGCSA-N 386.933 5.415 30 20 GKED Cc1ccccc1C(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C1CC1 733080103 DTTLBOACPCGWJU-UHFFFAOYSA-N 397.404 5.092 30 20 GKED N#C[C@H](NC(=O)/C=C/c1cccc(OC2CCCC2)c1)c1ccc(Cl)cc1 733258993 OLMWOICZGDDRLK-LNYGYFNRSA-N 380.875 5.056 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccncc1 734661016 DFXXTYWUBIGYCX-ICSRJNTNSA-N 397.931 5.503 30 20 GKED Cc1ccc(-c2nnc(SCc3cc(Cl)ccc3OCC#N)o2)cc1C 735231055 OEEJMZFARRFVSG-UHFFFAOYSA-N 385.876 5.202 30 20 GKED COc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)ccc1OC(C)C 740013623 HNXURKDKZOEOAP-UHFFFAOYSA-N 392.524 5.372 30 20 GKED C[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743094614 AMMBGYVTYNPBFI-UUOWRZLLSA-N 381.479 5.321 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](c3ccccc3)C(C)C)n2)cc1 744061758 OBIHTRADLNRXOU-TZIWHRDSSA-N 390.508 5.435 30 20 GKED CC(=NO[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1)c1cc2ccccc2o1 744444176 SCMBIADYLITZPK-AWEZNQCLSA-N 379.391 5.432 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1nc(C)c(-c2ccccc2)s1 745261224 OKXXNPZGDKYPGM-UHFFFAOYSA-N 388.496 5.210 30 20 GKED N#CCSc1ccccc1C(=O)NCc1ccc(Sc2ccccc2)cc1 746919084 DIXDRKGFBGAJGT-UHFFFAOYSA-N 390.533 5.383 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(OC)cc1 752495998 PINGQDXZQLXSIW-SUMWQHHRSA-N 382.460 5.204 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3cnc(-c4ccccn4)s3)oc12 753143649 XNYBDRNNCZDIJJ-MDZDMXLPSA-N 376.437 5.246 30 20 GKED Clc1cc(Cl)c(NN=Cc2c(C3CC3)nc3sccn23)nc1Cl 755545720 KWLVTYYJOTXSOS-UHFFFAOYSA-N 386.695 5.074 30 20 GKED C=CC[C@@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccncc1 761704294 KTXZUYXDMVUVJQ-OAHLLOKOSA-N 385.439 5.190 30 20 GKED C[C@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779071770 DYKAPZAYQPGORR-YCRPNKLZSA-N 377.488 5.243 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1 780670535 LUYXJHBIIAIDDF-JLTOFOAXSA-N 395.459 5.089 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2cc(Br)cs2)c1 782370971 YMWRFUDKLALEJY-SREVYHEPSA-N 376.275 5.089 30 20 GKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 782779430 YNFFETGXRUFAMI-RBUKOAKNSA-N 381.479 5.539 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)OCCCC(C)(C)C#N)c12 782951626 DMZHPHKQRVZATC-UHFFFAOYSA-N 384.524 5.105 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@@H]1/C=C\c1cccs1 783066078 XKRXVFQVZZXQMI-XZVRFQMRSA-N 399.491 5.279 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C/c1cccc(-c2cccnc2)c1 787179866 RXYLAVXBCOFAHJ-JXMROGBWSA-N 377.827 5.085 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2cccc(OC(C)C)c2)C(F)F)c1 788645284 OPQMTGAHTCUUHE-WIYYLYMNSA-N 388.458 5.251 30 20 GKED Cc1cc(C)c(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1C=O 793129819 IXDVZDMGVDYCMI-UHFFFAOYSA-N 398.462 5.013 30 20 GKED COc1ccc(CCCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797571194 MXUNUOAKTHPTBL-GOSISDBHSA-N 384.545 5.429 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1O 806162337 UWONDEYISOEUHE-LJQANCHMSA-N 397.906 5.192 30 20 GKED CC(/C=C\C(=O)c1cc([N+](=O)[O-])ccc1F)=C\c1ccccc1OC(F)F 814192130 YHDNMTMWOWBQPL-QTJHGLNVSA-N 377.318 5.178 30 20 GKED N#C[C@H](C(=O)CSc1cc(Cl)ccc1Cl)c1nc(C2CC2)cs1 842938245 JFBLNVMEFORNFK-LLVKDONJSA-N 383.325 5.296 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2cc(C(F)(F)F)cc(Cl)n2)ccc1OC 848665207 PIMZZCBECLAJTD-CYBMUJFWSA-N 399.800 5.055 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C2CC2)[C@@H](C)c2ccccc2)cc1OC 914481668 RAKKMAOOSSXHQF-RXBGNRNISA-N 377.484 5.025 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3nc4ccccc4o3)n2)cc1 915102140 SIMVRODTZAGODA-INIZCTEOSA-N 387.464 5.069 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1 915352855 KGMSFZLLOFGNLG-ZEQRLZLVSA-N 399.469 5.850 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3coc4cc(C)ccc34)n2)cc1 916650362 IJWPXDREXFXIKE-IBGZPJMESA-N 386.476 5.592 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@H](C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc1 916938900 MRSYKBNROOJRGK-KOJMWDNASA-N 398.865 5.137 30 20 GKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 920790058 NJVHMRFLTLMLBE-GGPKGHCWSA-N 390.483 5.343 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Sc2ccccc2Cl)cc1 920884192 UVROALOLMQVNDT-UHFFFAOYSA-N 394.883 5.646 30 20 GKED Cc1c(NN=Cc2cc3cc(Br)ccc3s2)cccc1C(=O)O 1776089710 DSIDPQSBBSTIAT-UHFFFAOYSA-N 389.274 5.116 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1)C(=O)O 1776469764 HJSRAKAWMYOSHJ-FWAPLPHYSA-N 399.657 5.395 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccccc2OC2CCCCC2)c1)C(=O)O 1776471050 DPSCHADFMPRIDK-IAOULYHDSA-N 394.467 5.146 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(OCCC(=O)O)cc2)oc2ccc(C)cc12 1776956137 FVDPYNSIDLUAJX-JXMROGBWSA-N 378.424 5.053 30 20 GKED Cc1cc2c(c(C)c1Cl)C(=O)/C(=C\c1ccc3oc(C(=O)O)cc3c1)CO2 1777427899 SVKXGZOGGNQARW-AUWJEWJLSA-N 382.799 5.060 30 20 GKED Cc1ccc(C)c(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2ccccc2)c1 22729816 YSFFFHNRUUQFFK-UHFFFAOYSA-O 381.546 5.012 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2cccc(C)c2C)cc1 27175665 VKPFNXKGOPTZAL-UHFFFAOYSA-O 395.573 5.320 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3csc(-c4cccs4)n3)c2C#N)C1 61198050 FRYIVUOKWFHFSU-JTQLQIEISA-N 385.539 5.182 30 20 GKED Cc1ccc(-c2nc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)cs2)c(C)c1 63927307 RZADJPIKHUDYKN-UHFFFAOYSA-N 389.524 5.349 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3cccc(OCCCC#N)c3)cs2)c(C)c1 63938022 LUPQQSLSQHZGJU-UHFFFAOYSA-N 391.496 5.362 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1cccc(C(F)(F)F)c1 78714744 DBVALINGDFBRGD-CYBMUJFWSA-N 393.434 5.279 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)nc2)c(C(F)(F)F)c1 115050020 XNTOAVYHMWFJHY-NSHDSACASA-N 379.407 5.115 30 20 GKED COc1ccc(CNC(c2cccs2)c2cccs2)cc1OCCCC#N 119447515 TZEWGMFVPYOXAD-UHFFFAOYSA-N 398.553 5.380 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1cccc(OC(F)(F)F)c1 121828903 QNUSJLXXNLKQHM-ZDUSSCGKSA-N 394.418 5.018 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N(CCC#N)Cc2ccccn2)c(C)c1 128973459 PSNWHCCHFCYZKP-KRWDZBQOSA-N 382.533 5.228 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2cnc([C@@H]3CCCO3)s2)s1 134285029 PUKHEXXOGVYLTI-ZDUSSCGKSA-N 394.566 5.001 30 20 GKED CSc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)ccc1F 159029341 XVBHVPFOMRPATR-UHFFFAOYSA-N 393.443 5.167 30 20 GKED COc1cccc([C@@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)c1 172921212 PNWCDFDGAKJKSL-HSZRJFAPSA-N 392.886 5.130 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 173993563 SOMZCBWZHDEIRL-DJIMGWMZSA-N 380.419 5.068 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1 184323442 NBCBRYNSCNNXFF-ZHRRBRCNSA-N 389.430 5.028 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 185337812 DLXOZEMFZUIXHX-AWEZNQCLSA-N 390.405 5.499 30 20 GKED Cc1cccc2nc(C3CCN(Cc4cccc(OCCCC#N)c4)CC3)oc12 188885651 VBLFSHGDMYNOBX-UHFFFAOYSA-N 389.499 5.198 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(OC(F)(F)F)c1 189884298 PXBJCIIYLIHGHL-UHFFFAOYSA-N 377.406 5.618 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)CSc2ccc(C#N)cc2)c1 303940992 YRZFTYGTMKQDSF-UHFFFAOYSA-N 396.459 5.252 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@H]3C)n1 410974755 JFDFKDJTAJMBKU-WDEREUQCSA-N 388.924 5.125 30 20 GKED N#CCc1ccc(NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)c(Cl)c1 411021065 VWENXRYAJYBDFJ-UHFFFAOYSA-N 396.771 5.234 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 425915152 GYBHNSNCRHBLRG-GXTWGEPZSA-N 383.439 5.230 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCS1 433012191 JJORRXQMMPQWEH-UHFFFAOYSA-N 399.491 5.239 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CC[C@H](CSc3ccccc3)C2)c1 438139610 LXBXJGOBAKGNSY-SFHVURJKSA-N 382.529 5.288 30 20 GKED CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)N(Cc1ccco1)c1ccccc1C#N 443832539 DWRNHXPQPSVZNN-JLMWRMLUSA-N 380.488 5.058 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c(Cl)c1 445008746 QYTIWEJZGYPYBY-GHTZIAJQSA-N 397.906 5.431 30 20 GKED C[C@H](N[C@@H]1CCC[C@@H](c2ccnn2C)C1)c1ccc(-c2cccc(C#N)c2)cc1 448024558 ZAFUCOHJBPCMBL-NTUVXCKYSA-N 384.527 5.336 30 20 GKED C=CCc1cc(CNCc2ccc(-c3ccc(OC)cc3)cc2)cc(OC)c1O 462735675 LNJBJZXFFVUFMH-UHFFFAOYSA-N 389.495 5.095 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)[C@H](C)c1cccc(C#N)c1)C1CC1 463384673 MCAARVQIONXJQJ-CABCVRRESA-N 386.417 5.433 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 468115106 KURRTNCAJAFIDK-UHFFFAOYSA-N 395.418 5.566 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cc(F)c(OC(F)F)cc1F 468197849 ZHEXQOGGEYPSMX-SNVBAGLBSA-N 395.274 5.241 30 20 GKED CC(C)Oc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469303758 XWJFDRZKPCHDOX-GOSISDBHSA-N 391.515 5.230 30 20 GKED Cc1ccc(-c2csc3nc(S[C@@H](C)CCC#N)n(C)c(=O)c23)cc1C 470451899 MQVZIXSSJFZPNP-AWEZNQCLSA-N 383.542 5.063 30 20 GKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C(c1ccccc1)c1ccccc1 474791211 QXXKJIXBLPQHRI-HYBUGGRVSA-N 382.507 5.411 30 20 GKED CCc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1C1CCCC1 475503925 PMKINYYHLXFXSF-HNNXBMFYSA-N 382.533 5.065 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)N(C)Cc1ccccc1 475547257 GQZXDAOYGQVGNG-IBGZPJMESA-N 379.548 5.181 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 476149009 NBWCSFSVRIFXEW-WOJBJXKFSA-N 387.445 6.300 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc(C3CC3)nc2c1 477542430 MPCBIGGIPUBMQL-UHFFFAOYSA-N 388.471 5.267 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(-c2ncco2)cc1 479624306 RFWCPIGDXXGTBP-UHFFFAOYSA-N 381.391 5.258 30 20 GKED C[C@@H](C(=O)Nc1cc(Cl)ccc1NCc1ccccc1)c1cccc(C#N)c1 486622273 ALAGQQUUAJANIO-MRXNPFEDSA-N 389.886 5.566 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 487476340 RXABSXWRZRALDE-UHFFFAOYSA-N 376.485 5.015 30 20 GKED C=CCC[C@H](C(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1 490200727 IWDJCDXCEXKYDL-XPWALMASSA-N 381.491 5.254 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CC1 490315625 VHEOUHRKIFGFBN-BTYIYWSLSA-N 379.529 5.520 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccccc2c1Cl)c1c(Cl)cccc1Cl 499846053 IDBUINCYGLTNRI-ZDUSSCGKSA-N 378.646 5.123 30 20 GKED Cc1c(C#N)c(S[C@@H](C)c2nnc(-c3cccc(Cl)c3)o2)nc2c1CCC2 501393886 CVKHITFECQVRBS-LBPRGKRZSA-N 396.903 5.307 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)cc1 502400409 RIKUHISDKGUSDY-QGZVFWFLSA-N 388.298 5.604 30 20 GKED CC(C)CN(C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1ccc(C#N)cc1 502747316 DPRSYVCJOPMNTP-UHFFFAOYSA-N 397.450 5.263 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(C(F)(F)F)c1 505976522 MCQMANWQXKBYFH-AWEZNQCLSA-N 378.737 5.100 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1Oc1ccccc1 510341346 LRJRNSNUZLOJOP-GOSISDBHSA-N 385.467 5.253 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@@H]3CC[C@@H](C(F)(F)F)C3)cc2)c1 510843899 YCWIREMOJOVWFT-IAGOWNOFSA-N 388.389 5.054 30 20 GKED CCCN(C(=O)[C@@H](C)Oc1ccccc1C#N)[C@H](C)c1cc2ccccc2o1 516623174 QPSIKUXGGZNAEA-IAGOWNOFSA-N 376.456 5.072 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517131692 HPQYZNOPOHIPNY-XMMPIXPASA-N 397.478 6.028 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 518137719 PZCIUFADGVXSON-GJZGRUSLSA-N 388.920 5.306 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)[C@H](Oc1cccc(Cl)c1Cl)c1ccccc1 518545806 GCGULSHRJHKYAD-IFXJQAMLSA-N 391.298 5.122 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(F)cc(Br)c1 518662802 QZORYHJHNBBXQW-LLVKDONJSA-N 393.281 5.092 30 20 GKED Cc1ccccc1-c1nnc(Sc2c(C#N)cnc3c(F)c(F)c(F)cc23)o1 519013716 ABIDWTHSANHFFI-UHFFFAOYSA-N 398.369 5.033 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc(OC(C)C)c1 519896977 NHUJEGYDGACIJR-LJQANCHMSA-N 393.531 5.274 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2ccc(F)cc21 520197079 SHLIQNFCFBBTAU-YOEHRIQHSA-N 399.491 5.255 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1OC(F)F 522290109 KSUARGUEFSVBRN-GFCCVEGCSA-N 391.443 5.492 30 20 GKED Cc1cccc(CCNC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 524438562 KPVRUNVNPPMHNS-UHFFFAOYSA-N 399.494 5.118 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)c1ccc(F)cc1F 525545815 VPEKIPYJNSXLGC-UHFFFAOYSA-N 397.315 5.593 30 20 GKED CC(C)(C#N)CCCNc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 532159078 VSKVFMKLUGSZHP-JOCHJYFZSA-N 375.516 5.406 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3ccccc3cc2OC(F)F)c1 534909044 LDKQBWOXLWPBIS-UHFFFAOYSA-N 396.393 5.376 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1C1CC1 535532172 HHSDTWZZDAACPC-CQSZACIVSA-N 396.560 5.576 30 20 GKED C=CC[C@H](C)[C@H](C)Nc1ccc(NC(=O)[C@@H](C)n2nc(C)cc2C)c(Cl)c1 538634113 HEHYNDRCGHQSKY-RRQGHBQHSA-N 388.943 5.366 30 20 GKED CC1(C)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)[C@@H]1c1ccncc1 560547953 ITIXSBNWBHIEDV-XMMPIXPASA-N 383.495 5.115 30 20 GKED CC(C)c1scnc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 579415703 PGMUXEGTUJRHNE-SNVBAGLBSA-N 389.452 5.158 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cc(Cl)ccc2Br)c1 589381946 DHUGLIHBGRBUCN-UHFFFAOYSA-N 380.669 5.310 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Nc3ccc4oc(CO)cc4c3)c2)cc1 590607004 DWUOUVDFEPUSAN-UHFFFAOYSA-N 399.406 5.233 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cs2)o1 603968935 NUJXKITYKUBAGK-UHFFFAOYSA-N 391.477 5.564 30 20 GKED CCCOc1ccc(Cl)cc1NC(=O)c1ccccc1-c1ccccc1C#N 603977593 RPCZSLFDTKYBEP-UHFFFAOYSA-N 390.870 5.920 30 20 GKED CSc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 608901926 UHSDDXKUKALMCQ-UHFFFAOYSA-N 377.494 5.079 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(F)cc2Cl)cc1 609297429 HDODELSYAVSEQK-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1SCCC#N 609375279 BPSMVPNJZOCHBV-LJQANCHMSA-N 382.529 5.612 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccccc2F)CC1 609930293 YXLTWQKFAUGOPQ-MRXNPFEDSA-N 397.519 5.631 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(C(F)(F)F)cc3)no2)c(F)c1 610165721 IKKUXVILQRLNDX-UHFFFAOYSA-N 379.338 5.058 30 20 GKED C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(-c2cccc(C#N)c2)cc1 611807433 GFGDBPAYGJLKBB-HNNXBMFYSA-N 375.403 5.123 30 20 GKED CC(C)N(CC(F)F)C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 612590830 QMRLHRAHHNNTHL-UHFFFAOYSA-N 395.265 5.092 30 20 GKED Cc1cccc2c(N3CCC(c4nc5cccc(C)c5o4)CC3)c(C#N)cnc12 614832338 TXGHKGSJDLYFGP-UHFFFAOYSA-N 382.467 5.249 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cn(CCCC#N)c2ccccc12 618174543 DFUUFNAPQGFZNT-UHFFFAOYSA-N 399.416 5.236 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H]1Cc2ccc(F)cc21 619435689 KKSAKZVDJSLLDH-OAHLLOKOSA-N 394.393 5.129 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C#N)c(Cl)c3)s2)cc1 619754508 BQMWKYUKWOEHTK-CQSZACIVSA-N 381.932 5.803 30 20 GKED C=C(C)[C@H](N[C@H]1CC[C@H](C(=O)OCC)c2ccccc21)c1ccc(F)c(F)c1 619822815 PNENDQWRBLTUQY-NYVOZVTQSA-N 385.454 5.353 30 20 GKED C[C@H](CC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1ccccc1C(F)(F)F 650351945 APKXPDOIWHDCGY-LLVKDONJSA-N 397.334 5.092 30 20 GKED CCc1c(C)sc(NC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)c1C#N 727790823 UJAGMUQGJBDKIF-UHFFFAOYSA-N 399.516 5.019 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)c1 728182294 HXWMRLWNMXJZKY-IRXDYDNUSA-N 375.390 5.163 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCCCc3cccs3)n2)cc1 731546400 NPASKJPIHVYGQV-IBGZPJMESA-N 394.565 6.159 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=S)Nc2c(C)cc(C)cc2Cl)c1 733755610 WMVNIUGJDOZLFI-INIZCTEOSA-N 387.936 5.124 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)ccc1SC 734304516 MGYDPHWMNZNFEL-MDZDMXLPSA-N 381.522 5.745 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734683545 NSJPRUNISFVEGX-ACJLOTCBSA-N 378.303 5.408 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)c2)s1 739590757 PENUOQYLCGOFAK-CVEARBPZSA-N 392.446 5.272 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1cccc(OC2CCCC2)c1 741840673 BRHOQRWJRQRDLS-OUKQBFOZSA-N 384.447 5.068 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)c1ccco1 744035190 LDEXTILXWBMOBB-GXFFZTMASA-N 391.279 5.690 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(OCCC(C)C)cc2)c1 745821727 UAHASORRRQSMAH-HXUWFJFHSA-N 395.503 5.114 30 20 GKED CC(C)Oc1ccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)cc1 747706857 RMKFCMTZMQEYMD-UHFFFAOYSA-N 393.556 5.487 30 20 GKED CC[C@@H](Oc1ccccc1F)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749027227 YXFWWMLHWQKCOB-VQIMIIECSA-N 394.471 5.292 30 20 GKED O=C(/C=C\c1cncc(F)c1)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 750215408 GUYSKJKUEAFMMF-IYKSTZQJSA-N 393.258 5.100 30 20 GKED Cc1sc([C@@H](C)/N=C/c2ccc(O)c(O)c2O)nc1-c1ccc(Cl)cc1 755032575 XYIOPCHQFLQVPZ-PRMNVEQPSA-N 388.876 5.069 30 20 GKED C#CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccccc1 757006804 ZKRKCJCHDUMTMN-HRAATJIYSA-N 389.524 5.243 30 20 GKED N#Cc1cc(NC(=O)c2sccc2-c2ccccc2)c(Cl)c([N+](=O)[O-])c1 764300917 GOFMKKWZZAEPGO-UHFFFAOYSA-N 383.816 5.101 30 20 GKED CC(C)(C#N)c1ccccc1CN(Cc1ccccc1)C[C@@H](O)c1ccsc1 767902468 PVIUQSFJLNXVSQ-HSZRJFAPSA-N 390.552 5.285 30 20 GKED CN(CCC#N)c1ccc(CNc2cccc(COC3CCCCC3)c2)cc1 770543068 PUIMAMYZWOGJMQ-UHFFFAOYSA-N 377.532 5.498 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@H](O)c2c(Cl)cccc2Cl)CC1 773017570 SJKCCLJJFAWCSS-BSLVTKGXSA-N 389.326 5.021 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)N[C@H](C)c1ccc(OCC#N)cc1 776165229 ZARLZGHVFFUULH-IIBYNOLFSA-N 386.923 5.689 30 20 GKED CC(C)n1cc2c(n1)[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC2 780422116 GZEIVTVDEHQVSL-YJBOKZPZSA-N 397.548 5.057 30 20 GKED Cc1ccc(-c2cc(C(=O)N3CCC(C)(C#N)CC3)c3ccccc3n2)c(C)c1 780779723 WKIDZTKHKXFCQZ-UHFFFAOYSA-N 383.495 5.285 30 20 GKED COCCOc1c(Cl)cc(N[C@H](C)c2ccc(C#N)cc2F)cc1Cl 781420931 GOYMNSFXWMBJBV-LLVKDONJSA-N 383.250 5.202 30 20 GKED N#CC1(CSc2nnc(-c3cccs3)n2Cc2ccccc2)CCCC1 806581127 VRXXOICMYMMHQA-UHFFFAOYSA-N 380.542 5.231 30 20 GKED N#Cc1c(NC(=O)c2ccnc(C(F)(F)F)c2)sc2c1-c1ccccc1CC2 808284893 NSCOQDRFAMGYQZ-UHFFFAOYSA-N 399.397 5.051 30 20 GKED N#C[C@H](C(=O)c1ccccc1SC(F)(F)F)c1cc(C(F)(F)F)ccn1 813211163 FIBHDRYTWAAKNQ-NSHDSACASA-N 390.308 5.202 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(F)cc2F)cc1OCc1ccccc1 916127557 IZSMSVGJUUJCKH-YRNVUSSQSA-N 380.390 5.449 30 20 GKED CCC(=NNc1c(F)c(F)nc(F)c1F)c1ccc2cc(OC)ccc2c1 916326518 AHGJDPCTVUEIEH-UHFFFAOYSA-N 377.341 5.026 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)nc1)c1ccc(N2CCCCC2)c(F)c1 917142389 BUERFTKZUJHUHI-FMIVXFBMSA-N 387.458 5.169 30 20 GKED C=CCn1c(=S)sc2c(=O)n(Cc3ccc(C(C)C)cc3C(C)C)cnc21 920305379 KOGUVNWHQJBWMS-UHFFFAOYSA-N 399.585 5.470 30 20 GKED O=C(O)c1cc(NN=C(CCCc2ccccc2)c2ccc(F)cc2)ccc1F 1776063105 AHQOKAUZGOFRLA-UHFFFAOYSA-N 394.421 5.502 30 20 GKED C=C(C)COc1cc(/C=C/c2ccc3cc(C(=O)O)ccc3n2)ccc1OC 1776140131 YWUIXPPMWZCZSF-XBXARRHUSA-N 375.424 5.067 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cc(C(=O)O)ccc3C)s2)cc1C 1777431469 PVEZZMSHTXEZFR-CMDGGOBGSA-N 377.465 5.330 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Cl)sc3Cl)c2c1 1777685486 IEKUUKNNSKBESU-HNQUOIGGSA-N 383.277 5.864 30 20 GKED C=C(C)CC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(C)C)cc1 1799708021 MIZRYDVCSSMNLS-KOUNCHBCSA-N 396.575 5.054 30 20 GKED N#Cc1c(NC(=O)COc2ccccc2-c2ccccc2)sc2c1CCCC2 16004805 ZJAYCJYHJHHLPV-UHFFFAOYSA-N 388.492 5.183 30 20 GKED C[C@H](Oc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443765 VKFAWUJGDJTUJJ-GUYCJALGSA-N 382.872 5.107 30 20 GKED CCOc1cc(/C=C2/Cc3c(Cl)cccc3C2=O)cc(Br)c1O 60132810 TVAOSOLWVUUBRW-WDZFZDKYSA-N 393.664 5.029 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 60488349 VRQRWYJEWLPJOC-AWEZNQCLSA-N 386.929 5.886 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1sccc1SC(F)F 66801318 WACJGRLJBSPVBW-JTQLQIEISA-N 384.498 5.709 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(N3CCCCC3)c2)c1 113553152 JPZNXNPQOXOEJM-UHFFFAOYSA-N 378.476 5.003 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)F)cc1)c1nc2cc(Cl)ccc2s1 119977309 KPXQGPRHCWLCHM-GFCCVEGCSA-N 378.787 5.041 30 20 GKED N#CCc1ccc(NC(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 121098379 RMGTZVZQCDJQBR-UHFFFAOYSA-N 382.467 5.011 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3ccccc3)n2)cc1 121855144 BRFXMWDVIMAJMK-DNVCBOLYSA-N 376.481 5.189 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/SCc3ccco3)n2)cc1 151135979 GESIHBGYBHUMBF-VMSUTVGLSA-N 396.493 5.035 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2ncco2)cc1 156843006 PDWAOVXKVKPPPK-UHFFFAOYSA-N 397.459 5.617 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 171552181 YWIKEVYPXIPYDF-JOCHJYFZSA-N 386.455 5.058 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(NC(=O)c3ccco3)c2)c(C#N)s1 179549934 CSTGIKLVWQKRIR-UHFFFAOYSA-N 393.468 5.015 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc(Cl)sc2Cl)ccc1OC 180812033 VUFRKMRBGVCRCE-WCQYABFASA-N 399.343 5.595 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2cc(F)ccc21 182341943 PBJBLKBTBGERLU-PBHICJAKSA-N 399.491 5.255 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(F)cc1Br 189913954 LBFHSYQMFJQYRC-UHFFFAOYSA-N 390.296 5.621 30 20 GKED Cc1nc(/C=C/c2cc(C#N)cs2)sc1C(=O)/C=C\c1cc(C#N)cs1 255003223 INMMBMDUZCZUOV-VOERYJCWSA-N 393.518 5.384 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 255943514 DBWKQACDULWHGI-UHFFFAOYSA-N 392.911 6.065 30 20 GKED CC1(C)OB(c2ccc3ccccc3c2-c2ccc3ccccc3c2)OC1(C)C 261506978 DECUNBBDNMWCLZ-UHFFFAOYSA-N 380.296 5.959 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1csc(Cc2ccc(Cl)cc2)n1 277971227 SHAGYMNBKFRLJJ-RUZDIDTESA-N 394.993 5.356 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)nn1-c1ccccc1 302956359 BJVRFUPHNUFNGI-UHFFFAOYSA-N 394.434 5.097 30 20 GKED COc1cc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)sc1Br 411006893 KXORQOKZYOUVII-UHFFFAOYSA-N 399.335 5.002 30 20 GKED C=C(C)Cn1c([C@H]2CCCS2)nnc1N1CCC[C@@H]1c1ccc(F)cc1F 424258815 XERAOHKPQSVZHP-QZTJIDSGSA-N 390.503 5.042 30 20 GKED N#Cc1cc(NCc2cnc([C@H]3CCCO3)s2)ccc1Oc1ccccc1 428409374 BPVPLTGCMPECEL-HXUWFJFHSA-N 377.469 5.271 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)Cc2ccccc2O1 432796238 FXWVEAKVNNGLHH-QGZVFWFLSA-N 399.450 5.166 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1)c1ccccc1 435096918 YSVPUZMCURBCTP-QHCPKHFHSA-N 390.527 5.307 30 20 GKED Cc1oc(C#N)cc1C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 436178540 VORYFLAXMNUBQI-SNVBAGLBSA-N 385.876 5.036 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccccc2)C2CCCCC2)cc1 437919110 UCKYNQHGLVTGJM-UHFFFAOYSA-N 375.516 5.855 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 441999921 JVJOKIAYKSFQGZ-UHFFFAOYSA-N 388.254 5.138 30 20 GKED Cc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)c2cccnc2c1C 443931258 UWXULXATODQSHT-UHFFFAOYSA-N 377.447 5.643 30 20 GKED COc1cccc([C@@H]2C[C@H](C)CN2C(=O)Nc2ccc(CC#N)cc2Cl)c1 455725144 CXYICYAZHZCEHZ-XOBRGWDASA-N 383.879 5.030 30 20 GKED C[C@H](C(=O)N1CC[C@H](C)[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462230253 HXYROSPSUUDZKS-AVYPCKFXSA-N 386.417 5.290 30 20 GKED COc1ccc(F)cc1CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 462905773 ZJMIAIAGRSNGIA-OAHLLOKOSA-N 395.318 5.636 30 20 GKED CCN(C(=O)c1cccc(-c2csc(C)n2)c1)[C@H](C)c1ccc(C#N)cc1 463147387 VIYDASXGBAGTEA-OAHLLOKOSA-N 375.497 5.214 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(F)cc(Cl)c3)n2)cc1 465417361 NHQUVVQWMDJIEP-INIZCTEOSA-N 386.835 5.101 30 20 GKED CCc1ccccc1CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 468122674 XBGJSVYWISPMKX-UHFFFAOYSA-N 384.479 5.075 30 20 GKED Cc1nc2c(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)cccc2o1 470878400 XWHVFPGJGXHRCL-UHFFFAOYSA-N 397.434 5.148 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)C[C@@H](CC#N)c1ccccc1 475458908 OMGNVSCGSBJPIS-GOEBONIOSA-N 375.299 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 475555838 YTZNSKWDPRDZGQ-NRFANRHFSA-N 394.515 5.740 30 20 GKED C[C@H](C#N)CN(C)C(=O)N[C@@H](C)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 479343555 DSQUKZVYXOJDMF-OLZOCXBDSA-N 395.450 5.296 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)cc1F 479454564 QAVOIDLXWDHKPM-NRFANRHFSA-N 395.275 5.339 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)c(F)c2)c2ccc(F)c(F)c2)c1 479478661 GTUGUALCRRDQRI-QFIPXVFZSA-N 398.453 5.577 30 20 GKED N#Cc1csc(/C=C(/c2nc3ccccc3[nH]2)c2nc3ccccc3s2)c1 480338178 RPAVVVOBXRQZLQ-GDNBJRDFSA-N 384.489 5.695 30 20 GKED C=CCCCC(=O)Nc1c(C)cccc1-c1nc2ccc(F)cc2n1C(C)C 481852851 GJMIYIMZDSGYJR-UHFFFAOYSA-N 379.479 6.027 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487575140 OLOZUXBHIVUDDL-UZLBHIALSA-N 388.433 5.435 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(CN(C[C@@H]2CCCCO2)C(C)C)cc1 488562979 SWYRZEDYHOGBML-GOTSBHOMSA-N 399.579 5.039 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc3nc(C(F)F)sc3c2)C2CC2)cc1 493007975 IWNIFIDHGNBCIP-UHFFFAOYSA-N 398.438 5.302 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)n1 494007574 SPOMLTMCSAAKIC-UHFFFAOYSA-N 392.846 5.170 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)o1 495335040 DNYDFKDIWHBLJE-QHCPKHFHSA-N 398.462 5.098 30 20 GKED CCCn1ccc2cc(NC(=O)Nc3ccccc3SC[C@@H](C)C#N)ccc21 503228009 YLOQTZXFDXKIFD-INIZCTEOSA-N 392.528 5.947 30 20 GKED CC[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(Cl)s1 504050993 TWYWAULCCQBFDF-KRWDZBQOSA-N 385.920 5.223 30 20 GKED Cc1ccsc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 504813166 SPTZBMOYVSMTFZ-SFHVURJKSA-N 395.915 5.687 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)Cc1c(F)cccc1C#N)C1CC1 506766437 ITIAQANNCPCRAI-ZDUSSCGKSA-N 390.380 5.011 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513530650 BKHNRYBEAVZMPI-FQEVSTJZSA-N 398.428 5.420 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 515504256 BFWSQLFNVBQSMW-IBGZPJMESA-N 399.494 5.146 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)CCc1ccccc1 521811752 SKTWMZITZDJZDL-KRWDZBQOSA-N 381.545 5.614 30 20 GKED C[C@H](C#N)CNC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 525059754 LZBNZOMWZIAASC-GFCCVEGCSA-N 379.312 5.175 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccccc2CN2CCSCC2)CC1 538834605 IABQAHAJAXVJAU-UHFFFAOYSA-N 391.584 5.051 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 538982644 QIVZVRHATIEWRT-LJQANCHMSA-N 398.487 5.852 30 20 GKED C[C@H](NC(=O)c1ccccc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 541070630 JVRHPYDHCHCIGF-HNNXBMFYSA-N 394.396 5.735 30 20 GKED N#Cc1cc(NC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)ccc1Cl 541263492 VHZHXTRUPOKNTI-UHFFFAOYSA-N 391.736 5.138 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)cnn1C1CCCC1 544148602 KLFAOWBFWIZKSO-HNNXBMFYSA-N 378.501 5.050 30 20 GKED C=CCN(C(=O)c1ccc2ccc(OC)cc2c1)c1nc2c(s1)CCCC2 551650869 SVZZRHFVZZRYAW-UHFFFAOYSA-N 378.497 5.017 30 20 GKED Cc1cc(NC(=O)c2cn(CCCC#N)c3ccccc23)ccc1-c1ccncc1 561098549 APDWOMOQBWGMLZ-UHFFFAOYSA-N 394.478 5.568 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1cnc(-c2ccc(Cl)cc2)s1 561337446 UCUQDKITZANFJM-UHFFFAOYSA-N 394.809 5.361 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccc4nc(C(F)F)sc4c3)CC2)cc1 580378644 WPCHQHVEDYUEQU-UHFFFAOYSA-N 384.455 5.186 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H]1CCc2ccc(C#N)cc21 589339157 URCAUIYREYDVOI-RBZFPXEDSA-N 393.943 5.982 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)Nc1ccc(F)cc1C(F)(F)F 590334703 IPFVETTVWWDBOU-UHFFFAOYSA-N 394.290 5.527 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)C1 597912209 SORIUPDHMFXNRN-GFCCVEGCSA-N 379.312 5.488 30 20 GKED C=CCOc1ccccc1CN[C@@H](C(=O)Nc1ccc(C)cc1)c1ccccc1 600796962 KDTQDNANBJDQHA-XMMPIXPASA-N 386.495 5.029 30 20 GKED Cc1sc(NC(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)c(C#N)c1C 603728483 GRJLGTUJSGUWLV-UHFFFAOYSA-N 380.473 5.026 30 20 GKED COc1ccc(OCCCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603969466 YJPIEGYXTHOUBI-UHFFFAOYSA-N 392.480 5.093 30 20 GKED Cc1ccc(C[C@H]2CCCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)cc1 604522359 UOFZEYBQUDRHBD-HXUWFJFHSA-N 375.516 5.283 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2cccc(N(C)C)c2)c1 605197670 CVNJULLANYDXSS-QFIPXVFZSA-N 379.504 5.077 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(C)cs1 609206827 GYHJBHNVJHNZGI-SFHVURJKSA-N 392.484 5.388 30 20 GKED COc1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(Cl)c1 609372558 DACDMEBJYWMRGF-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc2ccccc2[nH]1 609434294 QHTRXIOKKNXAOL-HNNXBMFYSA-N 397.438 5.110 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@H]2C2CCC2)c1 609731473 WRNXTFCUAQZXJR-FQEVSTJZSA-N 380.875 5.409 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1SCCC#N 609971384 ZGIVDUJZQHBPIN-AWEZNQCLSA-N 392.446 5.528 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)CCCCOc2cccc(C#N)c2)o1 610050288 FGNIFJJSVGTYOC-QFIPXVFZSA-N 394.515 5.407 30 20 GKED Cc1ccc(F)cc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 613404874 PRYMNXQVOQDUTK-ZDUSSCGKSA-N 378.350 5.253 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(C3SCCS3)c2)cc1Cl 726447669 FONNUYBPMOPRQS-UHFFFAOYSA-N 391.974 5.499 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 728061969 CKRNXTODZXJGCB-LJQANCHMSA-N 399.494 5.193 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 732596302 PDNLTSLIJBNXBA-SWLSCSKDSA-N 388.414 5.370 30 20 GKED N#C[C@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C1CCCCC1 734366869 BWEUQWAJGURPAR-CTNGQTDRSA-N 381.545 5.294 30 20 GKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)C(=O)Nc1cccc(Cl)c1 735320531 WTAXREPBCJAGQT-GFCCVEGCSA-N 395.311 5.156 30 20 GKED CCN(CCc1ccccc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740060591 VSPNZOMDISSXAW-UHFFFAOYSA-N 389.524 5.061 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(Oc3ccccn3)c2)cc1Cl 743037336 BDEKARHNVMPTRK-UHFFFAOYSA-N 380.860 5.208 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1nc(-c2ccccc2)cs1 743055637 HRGQYLGUQDCQJR-DHZHZOJOSA-N 385.448 5.289 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)cc1)c1ccc(-c2ccccc2F)s1 750907286 VSWAMDSIUFFJMX-YFHOEESVSA-N 375.428 5.031 30 20 GKED C[C@@H](ON=Cc1ccccc1OC(F)F)c1ncc(-c2ccc(Cl)cc2)o1 752754549 SSQMHVHTCNVLFC-GFCCVEGCSA-N 392.789 5.708 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C1CC1 760350434 KIRZHWMQRUXRJI-VGSWGCGISA-N 398.510 5.639 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c(Cl)c1 768996603 SNVPPVSDKIJYPT-UHFFFAOYSA-N 378.863 5.104 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 772958805 IADTZSPMYRDRRW-RTBURBONSA-N 386.495 5.676 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)c1 772983471 KJZAUONOXHQDPR-GXTWGEPZSA-N 381.278 5.664 30 20 GKED Cc1ccc(/C=C\C(=O)[C@H](C#N)c2nccc3ccccc23)c(Br)c1 792104228 NZXUYUPJNMXSTI-GIFJBRJJSA-N 391.268 5.195 30 20 GKED CCC(CC)[C@@H](c1ccc(Cl)cc1)N(C)C(=S)Nc1ccccc1C#N 794998156 DMVCHVRISHFIIR-FQEVSTJZSA-N 385.964 6.018 30 20 GKED CN(C(=S)Nc1ccccc1C#N)[C@@H](c1ccc(Cl)cc1)C1CCCC1 798374217 HLVULIAJZKCQRX-HXUWFJFHSA-N 383.948 5.772 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1[C@H](OC(=O)CCCCCC#N)C(F)(F)F 805890018 XUEVNYQCFZZVIN-IBGZPJMESA-N 393.409 5.110 30 20 GKED CCCCCOc1ccc(C=NOCc2cccc3cccnc23)cc1OC 809830601 WOMWCJGPYIYMID-UHFFFAOYSA-N 378.472 5.363 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(CSC(F)F)o3)cc2)ccn1 810166151 DKFPFPVTIKPSRC-UHFFFAOYSA-N 387.411 5.406 30 20 GKED C#C[C@@H](NC(=O)N(C)[C@@H](C)c1nc2ccccc2s1)c1ccc(Cl)cc1 811959347 NOKKDYOZTFVPNI-XJKSGUPXSA-N 383.904 5.027 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)sc2ccc(F)cc12 813213345 IIFSYVYLZJMQMB-ZDUSSCGKSA-N 378.350 5.253 30 20 GKED CC(C)(C#N)CCCCN1CCC(c2nccc(-c3cccc(F)c3)n2)CC1 854108829 LEPZRGPCDGCWRI-UHFFFAOYSA-N 380.511 5.182 30 20 GKED Cc1nc(C2CCC2)sc1CC(=O)Nc1ccccc1S[C@H](C)CC#N 888870491 WJUVVTREYBINIU-CYBMUJFWSA-N 385.558 5.295 30 20 GKED C=CCN(C(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12)C(C)C 915153532 PCRWFUUYHODUBZ-UHFFFAOYSA-N 376.500 5.199 30 20 GKED Clc1nc(Oc2ccccc2)sc1C=NNc1cccc2ncccc12 915963860 OWPRONWFIDRYLO-UHFFFAOYSA-N 380.860 5.583 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C=C\C(=O)c1ccc(F)cc1F 916128321 YODQXTLZLHVOAB-HJWRWDBZSA-N 390.792 5.207 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 916915442 JMROVEILGOOFAM-JFIYKMOQSA-N 394.437 5.045 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3c(F)cccc3s2)cc1 916955689 SXCPJIGGLDXAQA-DYVFJYSZSA-N 394.471 5.515 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3cnco3)cc2)cc1 917515089 FOUYUHXNXMLDQW-JOCHJYFZSA-N 379.419 5.249 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)Nc3ccccc3F)cc2Cl)cc1 917599988 GGRVPHVHNDJLOH-UHFFFAOYSA-N 397.862 5.952 30 20 GKED Cc1c(NN=Cc2cccc(OCCCc3ccccc3)c2)cccc1C(=O)O 1776087113 JCMLYSDSBQBQEP-UHFFFAOYSA-N 388.467 5.151 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776125297 CRVYTMPXEHWQEQ-MDZDMXLPSA-N 378.877 5.565 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3F)s2)cc1CC(=O)O 1776131858 QCRHINZHSRELEW-VQHVLOKHSA-N 396.439 5.086 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cs1 1776380491 JQDCAHALQFYILE-VQHVLOKHSA-N 383.494 5.589 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776470882 JMDWITROQAPGNY-CFRMROPGSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(Cl)cccc1SC(C)C 1776783266 LPWLKWVIIPVBQR-INIZCTEOSA-N 386.001 6.134 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(N(CC)c2ccccc2)cc1 1776784268 ZMTITOYLCZJREB-QFIPXVFZSA-N 396.575 6.138 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)[C@@H](C)c2ccccc2)c1 1776789048 MPYGWLPAMVTVLU-WMZHIEFXSA-N 383.532 5.382 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777038391 QVGOSKWETAHKTD-LHHJGKSTSA-N 389.426 5.153 30 20 GKED O=C(O)C1(/N=C/c2cc3ccccc3nc2SCc2ccc(Cl)cc2)CC1 1857777228 MFGJWXMOHFMBBU-FSJBWODESA-N 396.899 5.217 30 20 GKED C=CCn1c(SCC(=O)c2ccc3ccccc3c2)nnc1-c1ccoc1C 21925232 DMAGOOSQPWEBRE-UHFFFAOYSA-N 389.480 5.161 30 20 GKED CCn1c(C)cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1C 51677664 ZKHRDCVMGRILAS-AWEZNQCLSA-N 391.418 5.243 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)on1 66953495 WBXSZOFNYBYWND-FQEVSTJZSA-N 388.427 5.016 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)c1 108868506 OXPPYYORUZFPJI-UHFFFAOYSA-N 387.439 5.148 30 20 GKED Cn1nc(-c2ccccc2)c(CNc2cccc(OCCCC#N)c2)c1Cl 116335681 CMDLVQAEBZBFRX-UHFFFAOYSA-N 380.879 5.035 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1cccc(F)c1F 161549278 OWFRMJYXDQDKJG-STQMWFEESA-N 375.444 5.099 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3[nH]ccc23)cc1 175031310 CMLGMDXUOUFEQB-UHFFFAOYSA-N 381.435 5.065 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccccc1OC(F)(F)F 180203012 OWAYCSHVQCXAIH-GFCCVEGCSA-N 380.391 5.232 30 20 GKED C[C@H](N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1cccc(C#N)c1 181687743 BXUAAILAUXERDV-SBUREZEXSA-N 384.458 5.139 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(-c2nnc(CC)o2)cc1)c1ccc(F)c(F)c1 187414846 CMXFGRKVGJFKCS-LJQANCHMSA-N 398.413 5.016 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1NC[C@H]1CCCO[C@@H]1c1ccccc1 195670098 NPRHGGHCYHWQBK-IVZQSRNASA-N 395.865 5.479 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 217227254 ILHBCGCNAWGYDD-QZTJIDSGSA-N 381.545 5.913 30 20 GKED N#Cc1ccc2nc(NCc3cccc(NC(=O)c4cccc(F)c4)c3)ccc2c1 301989250 WVFMZJCADMXZOA-UHFFFAOYSA-N 396.425 5.110 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1 303154437 GOGODUXZVJYVCU-DLBZAZTESA-N 389.282 5.418 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1cccc(Br)c1C 328779247 DVUBQNGKCMNCQI-LBPRGKRZSA-N 395.322 5.053 30 20 GKED Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1N=C(O)[C@H](C)c1ncccc1F 329902119 PEGHXXWKTFYRPU-HLLBOEOZSA-N 397.494 5.039 30 20 GKED N#CC1(CCCN[C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CCOCC1 367532189 YGJFFYOJOWYQPY-RTBURBONSA-N 380.454 5.032 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 409472685 ZAYJOTAKSQMYSW-ZWKOTPCHSA-N 387.310 5.406 30 20 GKED CC[C@@H](C(=O)Nc1ccc(CC#N)cc1Cl)c1cccc(C(F)(F)F)c1 411018156 RCHFUDQJQIGCSY-OAHLLOKOSA-N 380.797 5.557 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1ccc(C#N)cc1 429476628 YKNUVWSLZWHIPK-CYBMUJFWSA-N 375.394 5.281 30 20 GKED Cn1cc(CN(Cc2ccc(Cl)cc2)Cc2ccccc2C(C)(C)C#N)cn1 430278309 PVUOQQKTQPHAFR-UHFFFAOYSA-N 392.934 5.077 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 431726338 GVZOXFBFZWKLCB-IFXJQAMLSA-N 390.314 5.789 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1 432073521 WYWQSWOWADLYAZ-IXDOHACOSA-N 397.519 5.678 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 433134513 LBPYZNIQKPSHHL-PKOBYXMFSA-N 392.528 5.495 30 20 GKED CCSc1ccc(Cl)cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 437561883 XPASZKTUDLEFNB-CYBMUJFWSA-N 390.961 5.956 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c(Br)c1 437647907 FDCAZJLAXDGOKN-VQIMIIECSA-N 398.304 5.061 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1ccc(Cl)c(F)c1 441411317 GEFGGTPGDWVTDC-UHFFFAOYSA-N 398.821 5.189 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CC(C)(C)CC(=O)c1ccccc1 442729662 BENUNXPYJIQCJH-QGZVFWFLSA-N 394.540 5.709 30 20 GKED C=CC(C)(C)CNCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 449485490 NETAKWMDTSMWPS-UHFFFAOYSA-N 397.466 5.148 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@@H](C)c1cccc(C#N)c1 462039377 OCAISYRTMYSLMR-OALUTQOASA-N 384.479 5.749 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1csc(Br)c1 462205800 GPJFTTHZJMFUKL-UHFFFAOYSA-N 386.274 5.182 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1ccccc1-c1ccccc1 464819155 RJAXLBGSVXLTAK-NOZRDPDXSA-N 395.506 5.064 30 20 GKED CCOc1ccc(N(CC)C(=O)c2cn(CCCC#N)c3ccccc23)cc1 468777252 BKXCCDKDDUHHAT-UHFFFAOYSA-N 375.472 5.010 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN2CCSCC2)cc1 476113907 WIBBUMQZCVUSRC-UHFFFAOYSA-N 394.584 5.340 30 20 GKED N#CC[C@H](CC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1)c1ccccc1 476463982 WISWISPESYZKSG-RSXGOPAZSA-N 394.518 5.443 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)C(=O)c1ccc(Cl)cc1 476793729 DVFJWQXYSGQLSX-INIZCTEOSA-N 383.919 6.040 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)SCCCOc1cccc(C#N)c1 477348172 FWAVWJMOGZKJNK-KRWDZBQOSA-N 382.529 5.211 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 477419619 BASKPSCQVAFSQI-LIRRHRJNSA-N 388.389 5.154 30 20 GKED C=CCC1(C(=O)N[C@@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)CCC1 480085962 VHGLOZNYYWIVQR-GOSISDBHSA-N 382.529 5.059 30 20 GKED CC(C)(C)c1noc(-c2ccccc2C(=O)[C@H](C#N)c2nccc3ccccc23)n1 483217530 NMZFICFJPSOCOX-LJQANCHMSA-N 396.450 5.072 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1C 484081155 INYQWLCPGXFZQH-SFHVURJKSA-N 392.890 5.169 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(C#N)s2)cc1F 486681534 CITOBKIVCNLRPO-UHFFFAOYSA-N 382.416 5.121 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1c2cccc(F)c2CC[C@H]1C 498887679 CZAHLDLWXMKYQA-VGSWGCGISA-N 398.526 5.014 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N[C@@H](C#N)c2ccccc2Cl)C1 501728264 UBWUVTGNBMDQAL-UWVAXJGDSA-N 376.928 5.177 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(-c4cccs4)c3)CC2)cc1 503471721 RMWKJRPRIOXRLW-UHFFFAOYSA-N 385.492 5.608 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1 503825442 GUPBOJCFICTTEN-QFIPXVFZSA-N 376.525 5.430 30 20 GKED C=CCOc1cccc(CN[C@H](C)c2sc(-c3ccc(OC)cc3)nc2C)c1 506290585 BSRUGPXWCPTERC-MRXNPFEDSA-N 394.540 5.543 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCCOc1ccccc1Br 507599870 XXKBFHUEIBSALH-AWEZNQCLSA-N 391.334 5.192 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H](C)[C@H]2C)cc1 510094311 UBLSMCLDVAUEGB-HZPDHXFCSA-N 379.460 5.011 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1cccc(C#N)c1C 510508122 BZKAVKOAHCHCPZ-UHFFFAOYSA-N 384.439 5.071 30 20 GKED COc1ccccc1-c1cccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)c1 511927586 PEDXVIBNNNWMCE-UHFFFAOYSA-N 386.426 5.043 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1F 512661051 PSCQDZNJKSLWLR-CHWSQXEVSA-N 399.922 6.195 30 20 GKED Cc1ccc([C@@H]2CCCN2Cc2cn(CCC#N)nc2-c2ccccc2)s1 513472410 DWBQUPQHRFVWRW-FQEVSTJZSA-N 376.529 5.171 30 20 GKED N#C[C@H](C(=O)c1cnc2ccccc2c1C(F)(F)F)c1nc2ccccc2s1 517280804 COQFOBPAUNOKMH-GFCCVEGCSA-N 397.381 5.353 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc3cccnc23)cc1 517357779 NOPGMFJRNHZBRM-UHFFFAOYSA-N 383.382 5.290 30 20 GKED N#C[C@H](NC(=O)CCCCCc1cccs1)c1ccc(Cl)c(Cl)c1 518321096 GPQBPDJUPHNXMX-KRWDZBQOSA-N 381.328 5.539 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N(C)Cc3cccc(C#N)c3)c2)C1 520133416 LGAVJUFBXPRUIC-WZONZLPQSA-N 391.515 5.317 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(-c3cnc[nH]3)cc2)cc1 520730319 PLCUPBQVYARCEL-UHFFFAOYSA-N 398.397 5.132 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(F)ccc2s1)c1ccc(Cl)c(Cl)c1 521886011 FHVHTXHQEKSEKW-CQSZACIVSA-N 379.243 5.342 30 20 GKED Cc1cccc(CNC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 524438072 MSRIZYRDMCRSEI-UHFFFAOYSA-N 385.467 5.076 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CC[C@@H](Cc4ccccc4)C3)c2)cc1 524653744 HDVXZRHKDDKALY-NRFANRHFSA-N 381.479 5.007 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 524938049 KNFNNEXECROHJF-SJORKVTESA-N 393.380 5.043 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cnc(-c4cccnc4)s3)c2)cc1 536379768 WKFWUFUVDKRESZ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](NCc1nc(-c2ccc(F)cc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541085366 CBQGHJOSCUDXHJ-INIZCTEOSA-N 398.441 5.265 30 20 GKED Cc1csc([C@H](C)CNC(=O)c2ccc(Sc3ccccc3C#N)cc2)n1 541652951 COOYRZNBLCFZGX-CQSZACIVSA-N 393.537 5.008 30 20 GKED CCc1oc(C(=O)OC)cc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542942027 KJCCXNPSRHNVQG-MRXNPFEDSA-N 388.467 5.018 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 544747288 SWRFHWSXUAUXCC-UHFFFAOYSA-N 378.472 5.036 30 20 GKED C=C(C)[C@@H](Cc1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1)OCC 546549985 NDTYBUKCXXJPLL-CYBMUJFWSA-N 377.218 5.040 30 20 GKED CCOC(=O)[C@@H]1CC[C@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 550827133 KOIQZDKDRZLMQT-VJBWXMMDSA-N 376.500 5.193 30 20 GKED C=CCn1c(SCc2ccc(C(C)C)nc2CC)nnc1-c1ccoc1C 554971719 REWWIJRTAPABNA-UHFFFAOYSA-N 382.533 5.406 30 20 GKED N#CCCN(C(=O)c1cc(Br)cc2ccccc12)c1ccc(F)cc1 558146562 IMHYMERBDZBJES-UHFFFAOYSA-N 397.247 5.302 30 20 GKED N#Cc1c(NC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)sc2c1-c1ccccc1OC2 560682006 AHJQFSCITQWEOO-WDEREUQCSA-N 392.402 5.096 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)[C@H]1CC[C@H](C(F)(F)F)C1 560686814 WBTYLZGTQAWITK-YUMQZZPRSA-N 391.258 5.224 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(Cl)c(C(F)(F)F)c1 561239598 BILUPRBODGTTNC-UHFFFAOYSA-N 399.844 5.355 30 20 GKED C=CCn1cccc1-c1nc([C@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 561932930 BREFFWQTYWEFLW-MRXNPFEDSA-N 395.356 5.008 30 20 GKED Oc1cc(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)cc(C(F)(F)F)c1 563658493 XQAUDVIHIJNWLK-OAHLLOKOSA-N 381.291 5.333 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 566526639 MQRHDGJTSXUXHB-UZLBHIALSA-N 397.544 5.562 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 570324145 WDHFWDQUFSSRQI-HSZRJFAPSA-N 398.466 5.423 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)Cc3cccc4ccccc34)cc2)ccn1 573888596 TUDKLRNMDAUSQC-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 574588775 AWHGRFBAMMCZIA-UTKZUKDTSA-N 383.923 5.390 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1csc(-c2ccccc2)n1 588337924 XKUZITKBRBFOEI-RTBURBONSA-N 388.496 5.114 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCc1ccc(C#N)cc1F 589784801 DWHLCMUDMAQENR-SFHVURJKSA-N 387.458 5.170 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccc3)cn2)c1 603691221 JAGKMNXUXPEJQY-NRFANRHFSA-N 384.439 5.115 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1Oc1ccncc1 604690907 NSGLQXXUQBCLKO-QGZVFWFLSA-N 385.448 5.282 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1c1ccccc1 609208749 JIVOZEPSRNICBF-HSZRJFAPSA-N 397.478 5.966 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609501314 DUOLBPCSXGUDDZ-UHFFFAOYSA-N 386.451 5.504 30 20 GKED N#Cc1ccc(NCCc2coc(-c3ccc(F)cc3)n2)c(C(F)(F)F)c1 609962788 ANEPKSUSRXQNSP-UHFFFAOYSA-N 375.325 5.026 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@H](C)c3cccc(C#N)c3)cs2)cc1 610363314 VQRXRJXJNYGZJQ-MRXNPFEDSA-N 389.524 5.225 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)c2)oc1C 611093568 RBRZZHHMTOIDTI-UHFFFAOYSA-N 386.238 5.389 30 20 GKED Cc1c(Cl)cnc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1C#N 612070336 ZNRSDKNCTWEKGW-MYJAWHEDSA-N 385.739 5.237 30 20 GKED C=CCN(C(=O)c1ccc(NC(=O)Nc2ccccc2)s1)c1ccccc1 641968073 UYZKRVMKDZUIQH-UHFFFAOYSA-N 377.469 5.225 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1OC 644623075 JZUBAYGGJOTNJA-UHFFFAOYSA-N 397.418 5.167 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1-c1ccc(F)cc1 674895189 YVAGVDZSNAAHEM-LJQANCHMSA-N 386.451 5.901 30 20 GKED C=CCOc1ccc(/C=C2/SC(=S)N([C@H](C)c3cccs3)C2=O)cc1 726629166 JGZCAAYEILYMEG-LVLBFHFTSA-N 387.551 5.275 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 728287517 FGOVCWRUTAQKTE-OASPWFOLSA-N 393.293 5.829 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 729949000 ZHODFKAYGWXIOW-UHFFFAOYSA-N 378.378 5.154 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(-c3ccccc3)cc2)c1 733841711 JRCRTLWCQGTALT-JOCHJYFZSA-N 385.467 5.356 30 20 GKED Cc1c(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)oc2ccccc12 734645057 ZYWFLBLWDFUMAU-JOCHJYFZSA-N 395.462 5.718 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)s1 744117125 UNRFBXWKZSVGEL-CFHLNLSMSA-N 385.489 5.079 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)NC1CCCCC1 745724795 XHASMYYDEVJUQB-UHFFFAOYSA-N 381.520 5.220 30 20 GKED Cc1cc(CCCC(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)c(C)s1 753390383 OCSJRXUNKJDBPV-SFHVURJKSA-N 378.497 5.069 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)c1nc(-c2ccc(SC(C)(C)C)nc2)no1 762351892 RNUZRFCPWHMWEI-CYBMUJFWSA-N 380.473 5.034 30 20 GKED O=C(/C=C\c1ccc(F)cc1C(F)(F)F)c1cc(Br)ncc1F 762428140 VVZJXQCNDSBAGB-RQOWECAXSA-N 392.121 5.037 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(Cl)cc2F)cc1 763548440 LQKNGWSPXFFQJG-KRWDZBQOSA-N 382.797 5.526 30 20 GKED CCOc1ccc(C(=O)/C=C\c2cnc(-c3cccs3)s2)cc1[N+](=O)[O-] 765615962 JJBPGJZGWNNBIF-SREVYHEPSA-N 386.454 5.075 30 20 GKED Cc1cc(CN[C@H]2CCCc3cc(NC(=O)OC(C)(C)C)ccc32)ccc1C#N 767686017 YBPYICNSAYTHKJ-QFIPXVFZSA-N 391.515 5.381 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC([C@H](O)c2ccc(Cl)cc2)CC1 767901734 VAQIAAGRUCGJGA-JOCHJYFZSA-N 382.935 5.087 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cccc(OC(F)(F)F)c2)c1 772984834 QZQIIAZSAVGOSV-YOEHRIQHSA-N 378.394 5.117 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NCc1cc(C#N)ccc1F 775413132 WZPRIXMDOIXGPP-ADLMAVQZSA-N 391.309 5.033 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnc(Cl)c(Br)c1 776873676 DXJNLZGFZZVJPA-UHFFFAOYSA-N 383.698 5.028 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC2CCC2)c2ccccc2)c1 778669770 KOGBARYNRAUNDU-GGAORHGYSA-N 391.515 5.098 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCO[C@H](C(C)C)C3)n2)cc1 781765506 OELSSKPPZZHSFC-BLIXFSHQSA-N 382.529 5.136 30 20 GKED Cc1ccc2cc(C(=O)/C=C\c3cn(CCC#N)nc3-c3ccccc3)oc2c1 788353323 GHQXHRJZFAREGB-KHPPLWFESA-N 381.435 5.415 30 20 GKED N#CCCn1cc(/C=C2/C(=O)c3cccc4c3[C@H]2CCC4)c(-c2ccccc2)n1 788355984 SRROXORIYGLYRN-QCBCRBAMSA-N 379.463 5.164 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cscc3Br)c2)s1 796309866 MCTXGYHWRXXZLL-UHFFFAOYSA-N 389.343 5.401 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C[C@H]2CCC(F)(F)C2)cc1 797850778 WGNMCCFULSQSKY-CQSZACIVSA-N 386.398 5.123 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3ncsc3C(F)(F)F)cc2)cc1 801680256 NHBHCWUHIJMJCY-UHFFFAOYSA-N 390.342 5.045 30 20 GKED C#CCN(Cc1ccccc1)C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 806511197 IHDGIFMZCXRAFO-GOSISDBHSA-N 389.524 5.025 30 20 GKED COc1cc(CNC(=O)Nc2ccc(SC(C)(C)C)cc2C)ccc1C#N 810176591 QGGMLRPIQHXULT-UHFFFAOYSA-N 383.517 5.088 30 20 GKED N#CCCC[C@H](NC(=S)Nc1cccc(OC(F)(F)F)c1)c1ccccc1 814209479 BBMIZWSXMKZOHU-KRWDZBQOSA-N 393.434 5.307 30 20 GKED COc1cc(Cl)cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 814306124 WSEVQFZJPYWGEN-OAQYLSRUSA-N 376.843 5.256 30 20 GKED N#Cc1ccc(C(=O)Nc2sc3c(c2-c2nc4ccccc4s2)CCC3)o1 815558750 MWQNDFSLVLZOAJ-UHFFFAOYSA-N 391.477 5.230 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 821445137 YFOHFQPGICPJLV-UHFFFAOYSA-N 386.517 5.090 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)c(C)n1[C@@H](C)c1ccccc1 842936984 BCGAHAWVFOQRIB-MGPUTAFESA-N 389.524 5.538 30 20 GKED CCCC[C@@H](CC)CNC(=S)Nc1ccccc1Oc1ncccc1C#N 916000206 GNCAZKAULNDQOD-MRXNPFEDSA-N 382.533 5.248 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)n1[C@H](C)c1ccccc1 916848184 DMYYWLBPDDAVAE-WZONZLPQSA-N 393.490 5.753 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1cc2c(Cl)cccc2s1 916885556 ZVVWNAXXZZDJHC-CYBMUJFWSA-N 389.263 5.169 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/Sc2ccccc2)cc1 916953545 DAYCKIQANMVCPC-OUNRHQKTSA-N 378.497 5.153 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(COC(C)C)cc2)cc1 916954756 KCCAYJGAHPNANL-VGSWGCGISA-N 392.499 5.086 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCOc3ccccc3F)n2)cc1 918488507 AGHHCASVSJRQJE-KRWDZBQOSA-N 394.471 5.293 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccccc3Cl)n2)cc1 920138860 LGZOBGZKUQJKQM-SDMNGIDPSA-N 394.883 5.362 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@H]3CCC5)s2)c1 1777684380 ZFAQNWNTJRLLJE-ACRNLXFHSA-N 386.472 5.813 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)c1 22732381 WMMZNUYHEAJEFP-UHFFFAOYSA-O 395.573 5.266 30 20 GKED C=CCn1c(SCc2coc(-c3cccc(F)c3)n2)nnc1-c1ccccc1 26007767 FFWZDDVHKJJMIQ-UHFFFAOYSA-N 392.459 5.218 30 20 GKED CC(C)c1c(C(=O)N[C@@H](C)c2ccc(C#N)cc2)cnn1-c1ccc(Cl)cc1 26130645 UVAYEELVARUTBR-HNNXBMFYSA-N 392.890 5.012 30 20 GKED CCN(C(=O)c1sc(NC(=O)C(C)(C)C)cc1C)[C@H](C)c1ccc(C#N)cc1 45500677 PDORLJBJLOHDED-OAHLLOKOSA-N 397.544 5.136 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)ccc1OC1CCCC1 48857898 OEPQCSBHPRCATF-IBGZPJMESA-N 386.451 5.055 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2c2ccccn2)cc1 56745379 QDAMEAIYEVCASJ-OAQYLSRUSA-N 384.439 5.115 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC)c1cccc(Cl)c1 63401711 AACVLVMOZRSWDT-IBGZPJMESA-N 387.867 5.097 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1nc2ccccc2o1 65652495 OJPKLGMVGSSNTI-GFCCVEGCSA-N 389.238 5.170 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 66347874 RSTULXDPYKNPDY-HXUWFJFHSA-N 395.915 5.204 30 20 GKED Cc1cccc(-n2ncc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2C)c1 66801993 FMPPMCYCIAWMPC-MRXNPFEDSA-N 390.512 5.136 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 109578156 LQAYYZZIMVLPHD-KRWDZBQOSA-N 395.915 5.575 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1 110174792 PJJPXYYWBKHXSL-UHFFFAOYSA-N 399.475 5.047 30 20 GKED C[C@@H](c1cccnc1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116635157 WGRKUQDOAJIFKK-HNNXBMFYSA-N 391.858 5.232 30 20 GKED CSc1ccc(O[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 131803207 RKNINQAXRMOZMO-HUUCEWRRSA-N 386.542 5.066 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1c(F)cc(C#N)cc1F 132261120 AGOIDGJGRGLHIZ-OAHLLOKOSA-N 392.405 5.537 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccs1 134005646 WQXKINODQLBYJJ-KGLIPLIRSA-N 376.572 5.575 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1c(F)cc(C#N)cc1F)c1ccccc1 151802499 WGLDMPUODXOUCB-AWEZNQCLSA-N 378.378 5.229 30 20 GKED CN(C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1cc(Cl)ccc1C#N 156786834 LOTDIVMSWGFWRE-UHFFFAOYSA-N 398.249 5.329 30 20 GKED N#C[C@H](C(=O)/C=C\c1nc2ccccc2s1)c1nc(-c2ccccc2)cs1 255012318 ZZEAEDOSCRVOLI-JQPIKURYSA-N 387.489 5.309 30 20 GKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 273298222 DYNPEOOLJWHDPA-LEWJYISDSA-N 395.478 5.011 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)c(C(F)(F)F)o1 283240488 JIEWICREFSHMDL-UHFFFAOYSA-N 399.262 5.329 30 20 GKED Cc1ccc(Cc2cnc(N=C(O)[C@@H]3CCC(=O)[C@H](C)C3)s2)cc1Cl 328915479 QUHOOGURUFGKRO-TZMCWYRMSA-N 376.909 5.289 30 20 GKED O=C1CC[C@H](/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c2ccccc21 329124064 XLKSRNHLXRRFTM-PMACEKPBSA-N 377.488 5.092 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1nc(C2CCCCC2)no1 330002818 BHMQIXNCKQIARN-IGEOTXOUSA-N 388.512 5.060 30 20 GKED Cc1ccc(CN(CCCC2(C#N)CCOCC2)[C@@H]2CCc3ccccc32)cc1 410421893 NPYQPOBFIAOYQB-RUZDIDTESA-N 388.555 5.585 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21 416812152 LNPNNXRRCAOBOX-DNVCBOLYSA-N 390.512 5.009 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C#N)cc3Cl)s2)c(C)c1 430371734 YDZPTPCXXAXQAB-UHFFFAOYSA-N 381.888 5.513 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 431810502 NLEBQPLHQMPHDZ-AVRDEDQJSA-N 379.504 5.269 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2)cs1 432637990 IHYFSKIVCXZKKE-HXUWFJFHSA-N 390.512 5.675 30 20 GKED CC1(C)CCCN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)[C@@H]1C#N 434017103 LHZXEEYMAMKDEW-QGZVFWFLSA-N 381.526 5.179 30 20 GKED N#CC1CCN(C(=O)c2c(Cl)cccc2Oc2ccc(F)c(Cl)c2)CC1 436234119 VSFXUYXMMSGTHP-UHFFFAOYSA-N 393.245 5.301 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1SC[C@H](C)C#N 438072840 LJUULBSGHJCWMR-OXQOHEQNSA-N 399.535 5.466 30 20 GKED CCCc1c(NC(=O)c2ccc(-c3ccccc3)o2)cnn1-c1cccc(C#N)c1 440090020 SKAREJVRZYMIOA-UHFFFAOYSA-N 396.450 5.209 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1ncc(C)s1)c1ccc(C(F)(F)F)cc1 440849395 XWCFDYYOOJLXOL-XJKSGUPXSA-N 397.466 5.538 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)c1 442688850 QAUJGJSQUFGKKK-QGZVFWFLSA-N 382.872 5.271 30 20 GKED C=CCOc1ccccc1CNc1ccc(C(=O)Nc2ccccc2OC)cc1 446908448 MYEHZGFFUVRYST-UHFFFAOYSA-N 388.467 5.124 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 464001813 BKDAJQIKYVOJEE-UHFFFAOYSA-N 389.858 5.161 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)C(F)(F)F 464058275 QXMWVQCSOPALNY-ZCFIWIBFSA-N 399.278 5.497 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(OC)c(OCc2ccc3ccccc3n2)c1 464448376 WATSHSRPOFTLTA-QGZVFWFLSA-N 390.483 5.363 30 20 GKED N#CCSCCCSc1ncnc2cc(-c3ccc(F)cc3)sc12 466613774 JRDSXYAGQKDWJL-UHFFFAOYSA-N 375.519 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 475574280 VODNYBTXYIWVGZ-VGSWGCGISA-N 380.507 6.293 30 20 GKED CCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1ccccc1Cl 477025182 MIPZHJOFPCFNHY-UHFFFAOYSA-N 392.890 5.142 30 20 GKED COc1ccccc1SCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 479800986 FWSDEAXEFAUSLU-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CCN(CC)C(=O)c1ccc(NCc2ccccc2C(C)(C)C#N)cc1Cl 486433283 MDDHFQXMACXSSX-UHFFFAOYSA-N 383.923 5.235 30 20 GKED C=CCOc1ccc(C(=O)N(CC)[C@@H](c2ccc(C)cc2)c2cccnc2)cc1 496447492 MDFFZBHTNKLOLS-DEOSSOPVSA-N 386.495 5.207 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1cccc(F)c1F 500234302 VLTMBQNNQWSIGA-INIZCTEOSA-N 378.422 5.266 30 20 GKED Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)c2cccc(C#N)c2C)c1C 509433341 XJXLLYOWQHYQLA-UHFFFAOYSA-N 399.281 5.228 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 512753050 UUDIXLVMKHOYLS-UHFFFAOYSA-N 378.472 5.727 30 20 GKED N#Cc1cccc(CSc2nnc(-c3ccco3)n2C2CCCCC2)c1F 513236841 PJNWKYZWJARYFL-UHFFFAOYSA-N 382.464 5.346 30 20 GKED CCN(CC)Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 515534177 RDWZQUBTFJWIME-HXUWFJFHSA-N 389.524 5.142 30 20 GKED Cc1cccc(CN(CC(C)C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 519449002 QQGRXEKLUVMNMS-IBGZPJMESA-N 395.572 5.937 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@H](C)C(C)C 520055276 BUWCCNRCPUVHPG-UZLBHIALSA-N 383.923 5.894 30 20 GKED Cc1cccc(-c2nc(CC(=O)Nc3ccccc3SCCC#N)cs2)c1 520804130 BZTJQHFVEORXKQ-UHFFFAOYSA-N 393.537 5.306 30 20 GKED Cc1nc(CC(C)C)sc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 524374450 CZVDRCSGAGZPDP-OAHLLOKOSA-N 381.526 5.264 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)CC2)c1 524386464 BKWYHLTVIHYPBA-UHFFFAOYSA-N 396.490 5.424 30 20 GKED Cc1ccc2c(CCC(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)c[nH]c2c1 524793399 PLCGCSRBLSQRQC-UHFFFAOYSA-N 386.480 5.043 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 532810852 WWQZMEQHKPRUGW-MGPUTAFESA-N 392.890 5.151 30 20 GKED C[C@H](N[C@@H](CO)c1cccc(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 536867406 DECOZUVAALGANX-QFYYESIMSA-N 395.318 5.248 30 20 GKED N#CCC1CCN(C(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)CC1 541983457 GPGGNDJZNOZUQF-UHFFFAOYSA-N 395.572 5.332 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccs2)o1)c1nc(-c2ccccc2)cs1 543986526 XXTOAFUASXWYER-AWEZNQCLSA-N 376.462 5.622 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)N[C@@H](CCC#N)c1ccccc1 544280548 KYTJJMXXUAXZEB-SFHVURJKSA-N 376.485 5.285 30 20 GKED CC[C@@H](CC#N)NC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 547275967 MRGIIYGQPXLFIV-FQEVSTJZSA-N 393.918 5.084 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc2n[nH]cc2c1 553312079 TWZUXLHHNVHCMT-HNNXBMFYSA-N 398.491 5.077 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(-c4ccncc4)cc3F)cc2)ccn1 558493972 PKWZWYCXYTZWFX-UHFFFAOYSA-N 396.425 5.559 30 20 GKED N#CCCCN1C(=O)CCc2cc(NC(=O)c3ccc(C4=CCCC4)cc3)ccc21 558552310 QHENUFQWGQDDFG-UHFFFAOYSA-N 399.494 5.089 30 20 GKED Cc1c(C(=O)NCc2ccc(Oc3ccccc3)nc2)sc2ccc(C#N)cc12 559377987 CHMIZVHVNQQLNY-UHFFFAOYSA-N 399.475 5.199 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F 577550772 OYCRIUIFTMSCMA-WOJBJXKFSA-N 388.417 5.173 30 20 GKED Cc1sc(NC(=O)c2c(F)cc(C#N)cc2F)nc1-c1cccc(Cl)c1 583911061 KFFLPHSMTQZJTG-UHFFFAOYSA-N 389.814 5.174 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 596739799 BFPLOYCOOHAUSV-MRXNPFEDSA-N 383.879 5.077 30 20 GKED CC(C)(C#N)C[C@H](O)CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1 598704157 MDEWDNQBTSNENC-LBPRGKRZSA-N 389.571 5.260 30 20 GKED N#C[C@@H]1CCC[C@]2(C1)Nc1ccccc1C(=O)N2c1ccc(Cl)c(Cl)c1 602754054 AXXOFDBSXCDHNJ-XCLFUZPHSA-N 386.282 5.476 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603689924 DYDFUSQXQFZZTH-JOCHJYFZSA-N 398.466 5.423 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)c1ccc(C#N)c(C)n1)C1CCCC1 609064555 DSBBNFKVHHOSGH-UHFFFAOYSA-N 399.494 5.009 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609434963 HTYGQJIBRKJOPA-MSOLQXFVSA-N 381.545 5.923 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)oc2c(F)cccc12 609594496 WBFIAAKOIBPTLG-AWEZNQCLSA-N 377.202 5.182 30 20 GKED Cc1c([C@H](NC(=O)N[C@@H](C)c2cccc(C#N)c2)C(C)C)oc2ccccc12 610403045 ZJVWACOJYQVFRN-HRAATJIYSA-N 375.472 5.370 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(COC3CCCC3)cc2)c(Cl)c1 611094379 ICYXFERCDRGCJO-UHFFFAOYSA-N 389.282 5.577 30 20 GKED Cc1cc(C(F)F)oc1C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 623983603 GIELDMQBDPPOOX-YUMQZZPRSA-N 393.274 5.165 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccccc2F)n1 661118060 VWSASERAVZROEN-APWZRJJASA-N 387.524 5.191 30 20 GKED Fc1cnc2c(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)ccnc2c1 672162012 UGILIHXVKJSBFI-IUCAKERBSA-N 381.295 5.090 30 20 GKED Fc1ccc2c(c1)[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CCCO2 675737597 IJROCXKFEJKXGB-MDHDOXDCSA-N 399.350 5.539 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3F)s2)cc1NC(C)=O 726429466 UIWDBLPWMDAOOW-CSKARUKUSA-N 395.455 5.417 30 20 GKED CC(C)[C@@H](NC(=S)Nc1ccccc1C#N)c1cccc(C(F)(F)F)c1 726494689 UUXRUXJQAQUWAO-QGZVFWFLSA-N 377.435 5.261 30 20 GKED CC(C)(C)c1nc(CC(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)cs1 726750455 QSACYTZBKADVIF-UHFFFAOYSA-N 376.481 5.127 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(N2CCCCCC2)cc1 726876006 BWLJHNIJVQOOPN-KHPPLWFESA-N 378.303 5.003 30 20 GKED Cc1c(NN=Cc2c(C(C)C)nn(-c3ccccc3)c2Cl)cccc1[N+](=O)[O-] 727973081 CSYCRJAEQFMLJS-UHFFFAOYSA-N 397.866 5.312 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nnc(-c2ccccc2)s1 729939448 IXTACOZUTVJKLQ-UHFFFAOYSA-N 399.566 5.214 30 20 GKED Cn1c2ccccc2c2cc(C(=O)Nc3ccccc3SCCC#N)sc21 730982228 MQMAQIHZGGJHDX-UHFFFAOYSA-N 391.521 5.651 30 20 GKED CC(C)c1ccc2cc(C(=O)N[C@@H](C#N)c3ccc(Br)cc3)[nH]c2c1 733253359 IPLKPYJAALGJOP-IBGZPJMESA-N 396.288 5.048 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2Cl)C(C)C)c1 734529977 CDGITUYTQYFAQG-LAUBAEHRSA-N 399.922 5.217 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2nc(-c3ccccc3)cs2)c1Cl 734746326 XHEWDIOOOAEPTA-UHFFFAOYSA-N 393.903 5.310 30 20 GKED CCN(CC)c1ccc(C=Nc2cccc(CSC3CCOCC3)c2)c(O)c1 734752862 KPUSJKXLCNALCQ-UHFFFAOYSA-N 398.572 5.401 30 20 GKED COC(=O)[C@@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(Cl)c1 735508147 VNUJPTDXWJURHG-VXKWHMMOSA-N 390.870 5.322 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cc(Cl)cs2)cc1 737321800 BFTMUUWIJHKXCS-FZKQIMNGSA-N 388.920 5.195 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(Br)s3)c2)s1 740013717 JDEKUYMDEBLLCB-UHFFFAOYSA-N 389.343 5.401 30 20 GKED CC(C)(O)c1cccc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1 760904667 DFANCEGTUWFUTK-UHFFFAOYSA-N 388.492 5.189 30 20 GKED C[C@@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccc(F)cc1 764752830 WUMMBBWMNUILIB-QMMMGPOBSA-N 396.249 5.034 30 20 GKED CCN(Cc1ccccc1)c1ccc(CN(CCC#N)Cc2cccnc2)cc1 768139331 DJHHPPNNGFNTBP-UHFFFAOYSA-N 384.527 5.024 30 20 GKED Cc1ccc(-c2cnc(NC(=O)c3ccccc3SCC#N)s2)c(C)c1 769640481 GLIBOKMNLQTEDC-UHFFFAOYSA-N 379.510 5.295 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(F)c(C)c2)C2CC2)ccc1OC 774451522 YPIHUZZLIAJGFP-XXBNENTESA-N 382.479 5.065 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3ccccc3Cl)o2)C(=O)c2ccccc2C1 778520152 PFKZCUHWMSYKGD-ATVHPVEESA-N 391.854 5.228 30 20 GKED C=CC[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1 778739640 WFECQRZUQHSLMX-QHCPKHFHSA-N 383.447 5.015 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cccc(OCc2ccccc2F)c1 779989395 RTWBGZLQNKFBBK-QGZVFWFLSA-N 376.431 5.308 30 20 GKED Cc1cc(/C=C\C(=O)c2cnn(C(C)C)c2C)cc(C)c1OCc1ccccn1 787187371 QXXMSEDPKYFTGV-KTKRTIGZSA-N 389.499 5.259 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CO[C@@H]2CCCc3ccccc32)cc1 797433478 DZUMESOFQHHUCC-JWQCQUIFSA-N 396.490 5.375 30 20 GKED C[C@@H](CSc1ccc(F)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570138 DGBHIAKGHAVQIM-WFASDCNBSA-N 376.522 5.184 30 20 GKED Cc1cccc(-c2nnc(SCC3(C#N)CCCC3)n2Cc2ccco2)c1 806585421 CVJIVPCCYHKDEM-UHFFFAOYSA-N 378.501 5.071 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C34CC(C(F)(F)F)(C3)C4)n2)cc1 810532242 PQSSDJBFFOYOEJ-TZYSRNFLSA-N 376.403 5.027 30 20 GKED C[C@@]12CC[C@H]3[C@H](CC=C4C[C@@H](OC(=O)CCCC#N)CC[C@@]43C)[C@@H]1CCC2=O 813072141 FVKHJRGCYYRFPX-RESQQWCNSA-N 383.532 5.124 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccccc2C)C2CCCC2)ccc1OC 813860251 PSPYUGLMONLEOJ-BWKNWUBXSA-N 392.543 5.706 30 20 GKED Cc1nc(NC(=O)N[C@H](CCCC#N)c2ccccc2)sc1-c1ccccc1 814309471 GCDITVAXTOVPSP-LJQANCHMSA-N 390.512 5.675 30 20 GKED N#C[C@H](C(=O)C1(C(F)(F)F)CCC1)c1nc2cc(C(F)(F)F)ccc2s1 835074011 QNMYMWNPXXXXFT-SECBINFHSA-N 392.324 5.224 30 20 GKED C[C@H](N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cc(C#N)ccn1 902965482 SZALSGKWEJOSSU-MGPUTAFESA-N 392.503 5.028 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917025483 LUVBBNGXUTYSBC-WMLDXEAASA-N 396.899 5.416 30 20 GKED COc1ccc(C(=O)/C=C/c2c(C)nn(-c3ccc(Cl)cc3)c2C)c(F)c1 917145315 QTFGYBVFMRNKRF-ZHACJKMWSA-N 384.838 5.186 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ncc(C(F)(F)F)cc2Cl)c1 925416011 BTUVNRWANLEUCT-DOMZBBRYSA-N 397.828 5.286 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3nc(-c4ccccc4)cs3)cc2)cc1 1776022448 PGNFHRXKRBMSBC-UHFFFAOYSA-N 399.475 5.621 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c1)C(=O)O 1776126352 JRYZVMWHRWQTJY-XBNGYDHASA-N 388.419 5.227 30 20 GKED C=C[C@H](CCC(=O)O)NCc1cc(F)ccc1Oc1ccc(Cl)cc1C 1776148466 KZPRKAXDIYCALL-QGZVFWFLSA-N 377.843 5.089 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2nc(-c3ccc4ccccc4c3)oc2C)C1 1776157027 LZQXALZMHHDFLX-XMMPIXPASA-N 390.483 5.046 30 20 GKED CC(C)c1cccc2c1OCC/C(=C/c1ccc3oc(C(=O)O)cc3c1)C2=O 1776377928 FZJSJSUMBXZUOE-GDNBJRDFSA-N 376.408 5.303 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776697894 XYVMAYHAXNSNCH-CFRMROPGSA-N 378.424 5.549 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776697941 YNIZWLFFSPCPCM-RZXPCSSPSA-N 390.435 5.760 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(Oc2ccc(F)cc2)cc1 1777268424 KLRJDSYRELPEAH-AWNIVKPZSA-N 392.382 5.221 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccnn3-c3ccccc3)cc2)cc1 1777671175 OOMGBIJLDLPIBF-OVCLIPMQSA-N 394.430 5.134 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)[C@@]3(C)CC=CCC3)CCC2)cc1 1791730003 BWWJLXZFWMLVLF-DEOSSOPVSA-N 392.543 5.061 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccc(OC[C@@H](C#N)CCC#N)cc2)cc1 27213577 SFRLBXVLMSBSAF-QGZVFWFLSA-N 375.472 5.059 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)nn1C(C)(C)C 51534726 HABSYOLDACUHHS-MRXNPFEDSA-N 392.528 5.375 30 20 GKED CCC[C@H](NC(=O)NCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 58222777 SZPWTJMRMUDSJB-SFHVURJKSA-N 376.287 5.206 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H]1CCCc2ccccc21 58986465 OHUQDLGXIGAPGX-HXUWFJFHSA-N 395.503 5.352 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 65473548 JUOWKMVGHPQWEN-INIZCTEOSA-N 381.476 5.015 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 65839457 IWHLPFBPSZVHAW-CVEARBPZSA-N 388.389 5.106 30 20 GKED Cc1nc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2)cs1 66158597 AKCGCXDMRNKXSV-UHFFFAOYSA-N 390.512 5.433 30 20 GKED CCOc1ccc2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)[nH]c2c1 66856299 JWTRPCUAMPKDTR-AWEZNQCLSA-N 379.485 5.213 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 72025313 XISXBAHRGKTFLC-FGZHOGPDSA-N 386.426 5.540 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 90665065 BHYQVSUGWAZLQY-GCJKJVERSA-N 378.520 5.256 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1ccccc1-c1ccccc1 108199830 AVONSTFTVXZCKL-UHFFFAOYSA-N 388.492 5.377 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 108357252 IKNCNYZDZBAWSE-VGSWGCGISA-N 381.545 5.006 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C(C)C)s1 108529401 NEDNSABPBJBLIW-OAHLLOKOSA-N 387.574 5.751 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cc(-c2ccccc2)on1 109029637 DBNNHRVDEFALQX-HNNXBMFYSA-N 392.484 5.058 30 20 GKED CCc1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)s1 117153914 YGVZHDXWKVAKLS-UHFFFAOYSA-N 378.522 5.263 30 20 GKED CC(C)c1noc(-c2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2)n1 120530590 WJHQPYNCJLBSCK-IBGZPJMESA-N 389.459 5.027 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccncc1 120713843 MILIJHZUEWJRQR-KKSFZXQISA-N 389.886 5.523 30 20 GKED CC[C@@H](NCc1cccc(OCCCC#N)c1)c1nc(C(F)(F)F)cs1 174137546 SUXRWKBKPYGDOE-OAHLLOKOSA-N 383.439 5.085 30 20 GKED Cc1cc(CCCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)c(C)s1 175956539 DJMAEGQAMVVKEO-KRWDZBQOSA-N 381.526 5.083 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3cc(Br)ccc3o2)n1 177767957 NGNVEDYYHUVKEO-LBPRGKRZSA-N 389.274 5.265 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccccc1Cl 178861437 KGOBOMPSGRCYSL-IBGZPJMESA-N 382.250 5.050 30 20 GKED N#CC1CCN(C(=O)N[C@@H](c2ccccc2)c2cc(Cl)ccc2Cl)CC1 182643684 JZVNOCSTIRQFGI-IBGZPJMESA-N 388.298 5.028 30 20 GKED C[C@H](NCc1ccc(Cl)cc1C#N)c1cccc(OCc2ccccn2)c1 187415878 RGCKLQUNSXDGJK-INIZCTEOSA-N 377.875 5.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(N2CCCC2=O)ccc1F 189911872 LKZLHTJHWOJFTF-UHFFFAOYSA-N 380.463 5.057 30 20 GKED CCc1nc2ccccc2c(C(=O)Nc2sc3c(c2C#N)CCCC3)c1C 247939503 UHJZRHXZNQHCOI-UHFFFAOYSA-N 375.497 5.170 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CC/C=C\c3ccccc3)n2)cc1 255496924 JEFFLBAVOGNITF-HOKKKISVSA-N 383.476 5.352 30 20 GKED C[C@H](/N=C(/O)C1CCCC1)C(O)=Nc1ccc(N2CCCCC2)c2ncccc12 328821312 RDBPACOVTDXXDM-INIZCTEOSA-N 394.519 5.348 30 20 GKED O/C(CC1CCCCC1)=N/C1CCC(c2nc([C@@H]3CCCS3)no2)CC1 329549125 BKMWZPAJUJVYCF-JCYILVPMSA-N 377.554 5.591 30 20 GKED OC(=Nc1cccc(CSC2CCCCC2)c1)N1CCCC[C@H]1c1nc[nH]n1 329807829 BNEHZVORQDRWSW-IBGZPJMESA-N 399.564 5.143 30 20 GKED OC(=Nc1cc(N=C(O)[C@@H]2C[C@H]3C=C[C@H]2C3)c(F)cc1F)[C@H]1C[C@H]2C=C[C@H]1C2 329907456 KYEKFRVSJWLEJU-OJFNHCPVSA-N 384.426 5.565 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccccc1OC1CCCC1 330346183 GDYCUZHQNUYGHP-OAHLLOKOSA-N 386.517 5.303 30 20 GKED Cc1c([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 431857356 LGPIASYNIULPAB-YLJYHZDGSA-N 375.472 5.537 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2Cc2cn(CCC#N)nc2-c2ccncc2)cc1 435136225 ZPEIRHFRQNDHAU-DEOSSOPVSA-N 399.542 5.319 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1cc(C#N)oc1C 435677137 CFIVDHLUJGLIDO-UHFFFAOYSA-N 380.831 5.253 30 20 GKED CN(C(=O)CSCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1Cl 439121119 XLAWSVVLRJAHGG-UHFFFAOYSA-N 398.837 5.127 30 20 GKED CC(=O)c1cccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 440749132 QNUBJQJWDSYMSH-UHFFFAOYSA-N 389.386 5.336 30 20 GKED Cc1c(CNC(=O)N(C)Cc2ccc(C#N)cc2)sc2ccc(Cl)cc12 440994113 VJSXFGKFTQLKFB-UHFFFAOYSA-N 383.904 5.076 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)CCCC1(C)C 444896428 DLLZGKYOYMIXJM-OAQYLSRUSA-N 385.552 5.042 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c(Cl)c1 445008750 QYTIWEJZGYPYBY-WIYYLYMNSA-N 397.906 5.431 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1)c1cccc(C#N)c1 462076323 NTWWNXCOYKDRHS-QGZVFWFLSA-N 393.446 5.641 30 20 GKED CC(C)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)nc1 463954149 YSVVCMIESPKDHP-UHFFFAOYSA-N 393.434 5.482 30 20 GKED N#C[C@@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccc(Cl)cc1 464402948 JIUHJCMHYKSYPD-GOSISDBHSA-N 396.874 5.625 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCS2)cc1Cl 465156753 PXARVABDNXHDCC-WMZOPIPTSA-N 385.920 5.013 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)Nc2ncccc2OCCCC#N)cc1 466604155 LFEYAFOYYVHSOK-INIZCTEOSA-N 398.532 5.147 30 20 GKED C[C@H](c1c(F)cccc1F)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 468758678 AEZIZKLZPUMDIH-OAHLLOKOSA-N 381.426 5.056 30 20 GKED N#Cc1cccc(-c2nnc(CNc3c(F)cccc3Oc3ccccc3)o2)c1 471677280 FXTGWZUHQQOOKW-UHFFFAOYSA-N 386.386 5.152 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cn(CC(C)C)nc1C(F)F 475569848 RBZGNCBEZBFFLM-UHFFFAOYSA-N 390.478 5.973 30 20 GKED C=CCCC1(C(=O)Nc2cccc(CNC(=O)Nc3ccccc3Cl)c2)CC1 476225569 XEXCWTPQICTHIR-UHFFFAOYSA-N 397.906 5.347 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476398043 NKDXJXQSOYWOMQ-UHFFFAOYSA-N 386.451 5.541 30 20 GKED N#CC[C@H](CC(=O)Nc1c(F)cc(F)cc1-c1ccccc1)c1ccccc1 483348754 MZSRIFJDLFVDOV-GOSISDBHSA-N 376.406 5.658 30 20 GKED N#C[C@H](C(=O)c1cc(F)ccc1-c1ccoc1)c1nc2cc(Cl)ccc2s1 483494205 VOQQBOGXOOSFPJ-MRXNPFEDSA-N 396.830 5.839 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1C 485428475 AFNMQIVTNGIGSC-UHFFFAOYSA-N 397.563 5.268 30 20 GKED N#CCCC[C@@H](NC(=O)CCC(=O)c1ccc2ccccc2c1)c1ccccc1 487268443 MLBMXYGANZFJMT-HSZRJFAPSA-N 384.479 5.354 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 488350148 FUOUXPKIHSPDHL-QGZVFWFLSA-N 383.398 5.363 30 20 GKED C=CCC[C@@H](NC(=O)NCC1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1 489774498 TUIIQWSTMXZGRU-OAHLLOKOSA-N 376.369 5.057 30 20 GKED C=CCN(Cc1cccs1)[C@H](C)c1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3 499055906 YNNMVERGZUHZIW-UONOGXRCSA-N 399.585 5.332 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 499709476 BTURNKPKHKEFFN-LJQANCHMSA-N 387.886 5.198 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Oc2ccc(F)c(Cl)c2)c2ccccc2)cc1 499743391 ZVFAORJPBGJTEI-NRFANRHFSA-N 394.833 5.304 30 20 GKED Fc1ccc(NCc2ncc(C(F)(F)F)s2)c(OCCC(F)(F)F)c1 500567975 SQJVGDVOUREMJV-UHFFFAOYSA-N 388.308 5.244 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1csc(-c2ccccc2)n1 501003673 YKQHCEPEJOXKQZ-UHFFFAOYSA-N 385.448 5.122 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1cccc2c1CN(c1nccs1)C2 505050973 HKFLPDLKSBEFRA-UHFFFAOYSA-N 390.512 5.426 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc(C)cs3)c3ccccc3n2)c(C)c1 505294693 YEOGSEZWUAREOI-HXUWFJFHSA-N 397.503 5.774 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccccc1C#N 508101864 XEIKCRNUMJOOHL-UHFFFAOYSA-N 387.826 5.152 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@H]2CCOc3c(-c4ccccc4)cccc32)c1 509068393 XSEFHTQILSHZGJ-NRFANRHFSA-N 388.854 5.132 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 509886474 OAUOZJUWZXQMIJ-DOTOQJQBSA-N 380.435 5.021 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc([C@@H]4C[C@H]4c4ccccc4)no3)cc2)nc1 512026790 QVFVFCBOFOKXIY-VQTJNVASSA-N 380.407 5.067 30 20 GKED CCCCCOc1ccc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cc1 513206333 KBYNUHWAXVESOB-QGZVFWFLSA-N 376.378 5.159 30 20 GKED CC(C)Cn1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 513715065 LGDJQRDARKEEOQ-FQEVSTJZSA-N 392.890 5.100 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(F)c(F)c1 516817315 TXMSOFPGLRCCFA-UHFFFAOYSA-N 393.393 5.259 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(Cl)cc1Cl 518255922 JYGDABNKNZJOKZ-GFCCVEGCSA-N 394.327 5.709 30 20 GKED Cc1ccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520195930 RCSIPOVXGJZJIM-KRWDZBQOSA-N 381.545 5.489 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccc(Cl)cc12 520827733 ZBNKNFQUSCSVSG-GFCCVEGCSA-N 384.888 5.899 30 20 GKED C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 523032812 VPZRCUTXLQRGIY-RXVVDRJESA-N 399.469 5.030 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3sc(CC(C)C)nc3C)n2)cc1 524377327 ATLBHOYYCLSRST-MRXNPFEDSA-N 395.553 5.572 30 20 GKED CC1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CC1 524440879 GHDVATFCYWABIH-UHFFFAOYSA-N 383.879 5.054 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2C(C)(C)C1 534036745 SKWWLCGTAGPHOC-INIZCTEOSA-N 379.529 5.264 30 20 GKED CN(C(=O)c1ccc(CC#N)cc1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 537334028 NSBJJROBQGLXLL-VQTJNVASSA-N 386.417 5.180 30 20 GKED C=CCOc1ccc(CN(C)Cc2nc(C(F)(F)F)cs2)cc1Cl 537620595 WRWUYEQLFBFHBG-UHFFFAOYSA-N 376.831 5.012 30 20 GKED N#Cc1ccc(NC2CC2)c(NC(=O)c2cc(-c3ccccn3)ccc2Cl)c1 538819626 JIJRJFHNRKDFIL-UHFFFAOYSA-N 388.858 5.100 30 20 GKED N#CC1(CCCSc2nc(-c3cccs3)nc3ccccc23)CCOCC1 539510451 AMNJYUNWGBDNHS-UHFFFAOYSA-N 395.553 5.551 30 20 GKED Cc1ccc(C)c(-n2ncc([C@@H](C)N[C@H](CCCC#N)c3ccccc3)c2C)c1 550835687 LYKBARIJKCBTGB-HYBUGGRVSA-N 386.543 5.883 30 20 GKED C=CCC[C@H](NCc1cc(-c2c(OC)ccc3ccccc23)no1)c1ccco1 552068387 UZGWEMSHQZHEQT-FQEVSTJZSA-N 388.467 5.894 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1c(F)cccc1F 557084846 IRKRRVCKUVWXDG-AWEZNQCLSA-N 393.393 5.511 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1csc(-c2ccoc2)n1 557517968 UCHSNBDHXYIFAW-UHFFFAOYSA-N 385.448 5.122 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 565266421 NUHANJJGFQMUEB-CABCVRRESA-N 389.524 5.110 30 20 GKED COc1ccc(NC(=O)[C@H](Sc2cccc(F)c2C#N)c2ccccc2)cc1 567565683 XVKCJKWINXXDLO-OAQYLSRUSA-N 392.455 5.178 30 20 GKED N#Cc1cc(C(=O)N2CCC(c3ccc(Cl)cc3Cl)CC2)ccc1F 581670434 FJKPSZBECGXSII-UHFFFAOYSA-N 377.246 5.024 30 20 GKED COc1cccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c1OC 602292919 PWKZXFUVLKHLDQ-CYBMUJFWSA-N 398.528 5.040 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCOc1ccccc1 603532321 BCBJZFLEBPLDNC-UHFFFAOYSA-N 388.442 5.008 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C)cc1C 606590564 KPOUUSDIMIAWGM-UHFFFAOYSA-N 380.467 5.118 30 20 GKED N#Cc1ccc(NCC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1 608878369 UXANFTXKASWXHE-UHFFFAOYSA-N 377.831 5.055 30 20 GKED CC(C)(C)[C@H](NC(=O)CCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608899140 QIVCLAQFBZBXEV-HXUWFJFHSA-N 388.433 5.413 30 20 GKED CC(C)c1ccc(OCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609377380 DHDQTUIBOKBTRE-KRWDZBQOSA-N 382.529 5.469 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 609652445 ZDZNNMQFBKCAKC-ROUUACIJSA-N 386.451 5.104 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3[C@H]4C=CC[C@H]3CC4)cc2Cl)c1 611049104 SOBVUAOTWGYXFE-OALUTQOASA-N 393.874 5.115 30 20 GKED C[C@H](NC(=O)N1CC[C@@H](c2ccco2)C1)c1ccc(-c2cccc(C#N)c2)cc1 611854956 FBUUHJLOOTXFIC-HTAPYJJXSA-N 385.467 5.078 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 614931219 LYHICUAMACMZGQ-UHFFFAOYSA-N 377.366 5.203 30 20 GKED O=C(c1cscc1C(F)(F)F)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F 622880797 GFTKSTMGOOHTOQ-APPZFPTMSA-N 399.278 5.112 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@H](C)c1cccs1 726477998 CTUSEVBYOMBHJM-OAHLLOKOSA-N 393.537 5.768 30 20 GKED N#Cc1cccc(COc2ccc(N=Cc3cc4ccccc4nc3O)cc2)c1 727973133 RTLOGGBELBGOIQ-UHFFFAOYSA-N 379.419 5.142 30 20 GKED O=C(/C=C/c1csc(-c2ccc3c(c2)OCO3)n1)c1c[nH]c2cc(F)ccc12 728439756 FHNFFTBJUIPILM-HWKANZROSA-N 392.411 5.055 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)ccc1SC 734304515 MGYDPHWMNZNFEL-KTKRTIGZSA-N 381.522 5.745 30 20 GKED C=CC[C@@H](NC(=O)c1cc(-c2ccc(C)o2)nc2ccccc12)c1ccncc1 734458321 XKUBDCIIVVFXES-HXUWFJFHSA-N 383.451 5.245 30 20 GKED C[C@H]1/C(=C\c2nccn2Cc2ccccc2)C(=O)c2cccc(Br)c21 742434991 PFGQDCJUYHPURI-IQGJIOQQSA-N 393.284 5.077 30 20 GKED N#Cc1cc(NC(=O)N2CCCCC2)ccc1Oc1ccc(C(F)(F)F)cc1 743814591 RULHHLLPZPKWIP-UHFFFAOYSA-N 389.377 5.387 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744036966 LIUPTNKXNIVRAD-KXBFYZLASA-N 378.472 5.394 30 20 GKED CC(C)CN(C(=S)Nc1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 745688000 NMVXSMXQBNWOBB-UHFFFAOYSA-N 378.328 5.724 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2coc3cc(F)ccc23)cc1 748296811 RZOXSWFAKZGDEG-QFIPXVFZSA-N 384.410 5.409 30 20 GKED C[C@H](ON=Cc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1C(F)(F)F 749256657 VOLLYZDQEDDXMO-AWEZNQCLSA-N 392.421 5.381 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CNc1ccccc1SC[C@@H](C)C#N 749272786 XERGNQHENWQNSV-HNNXBMFYSA-N 396.947 5.698 30 20 GKED C[C@@H](Cc1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 754531808 MMLYWFVCPOPFGJ-YOEHRIQHSA-N 380.900 5.519 30 20 GKED C=C[C@@H](CC(=O)Oc1ccc(NC(=O)c2ccsc2)cc1)c1ccccc1 759009645 NZJPYSJPIKODES-INIZCTEOSA-N 377.465 5.266 30 20 GKED N#CCCCCNC(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(Cl)cc1 763930798 ZKGFAGYHOHNDHT-UHFFFAOYSA-N 396.922 5.108 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2nc3cccc(Cl)c3n2C)cc1 775562606 KRIKRJOBIXQTEJ-AWEZNQCLSA-N 390.314 5.209 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1Cl 778973130 VNPVHIMGPWPDGV-JOCHJYFZSA-N 390.870 5.130 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 780668676 DTIJXSYJAXZZRX-YCRPNKLZSA-N 381.451 5.170 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1c[nH]c2ccccc12 786354852 KDYVANFATMDHDJ-YOEHRIQHSA-N 386.480 5.056 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(Cl)cc2Nc2ccccc2)c1 790172749 XPHMUXCVZAEZEH-UHFFFAOYSA-N 391.858 5.167 30 20 GKED C[C@@H](OC(=O)CCc1ccccc1NC(=O)OC(C)(C)C)c1ccc(C#N)cc1 790747031 RMSCPHPBTXKSAR-MRXNPFEDSA-N 394.471 5.142 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C/Sc2cc(F)ccc2F)s1 797964257 FPRJWJQNTODNES-SYTKJHMZSA-N 378.469 5.201 30 20 GKED N#C[C@@H](C(=O)CCCCCc1ccc(F)cc1)c1cc(C(F)(F)F)ccn1 813216818 ZYYVVBIWQBREGW-QGZVFWFLSA-N 378.369 5.219 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)ON=Cc2cccc(Cl)c2Cl)c(C)c1 818618289 TXDQWAYELGZHGG-CQSZACIVSA-N 379.287 5.296 30 20 GKED CC[C@@H](CC(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790883 LJOFTNCVRZEXKQ-WCBMZHEXSA-N 376.350 5.173 30 20 GKED O=C(O)c1cc(NN=C(CCC(F)(F)F)CCC(F)(F)F)ccc1Cl 853257678 BGRBXIWJASWGPE-UHFFFAOYSA-N 390.711 5.491 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](OC2CCC2)CC1 878675245 DTJUXIYDYDFMTC-SJLPKXTDSA-N 387.549 5.036 30 20 GKED C=C(C)C[C@@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 904033696 VYZAIDPLKVQAEY-GOSISDBHSA-N 377.843 5.089 30 20 GKED Clc1ccc(-c2cc(CON=Cc3ccccc3Br)on2)cc1 913029338 DMASYPHHVHGWQO-UHFFFAOYSA-N 391.652 5.308 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)oc12 915085410 LNGXBPOTHPYYJG-HXUWFJFHSA-N 382.419 5.349 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-n3cccc3)cc2)cc1 915085753 BIKNGMDDTBZVGC-XMMPIXPASA-N 377.447 5.385 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 915352558 MFAANNNOMUIJIB-RPWUZVMVSA-N 399.494 5.623 30 20 GKED CC(C)(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917039719 CECGPOUFWICWTR-QGZVFWFLSA-N 395.453 5.538 30 20 GKED CC(C)(C)c1ccc(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917044176 QYOFYKBNRBZDOZ-INIZCTEOSA-N 398.915 5.502 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCc1ccccc1Cl 918153462 VNUQLBZKFWHYBV-UHFFFAOYSA-N 387.314 5.426 30 20 GKED CCCCS[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 918492984 YKEMFMFHJQHABZ-CMPLNLGQSA-N 386.464 5.413 30 20 GKED C=CCN(C(=O)/C=C\c1ccsc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 919673309 LVSRADBPPKFHSD-BAQGIRSFSA-N 397.481 5.012 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 1776170676 AXAPBDHPDBEEQZ-SFHVURJKSA-N 391.870 5.479 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(Cl)cc(Cl)c1 1776354438 IFYMVNNJZKNUOC-HYXAFXHYSA-N 379.239 5.375 30 20 GKED C[C@@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2c(O)ccc(F)c21 1776586677 MCXFOYRCOVOWLD-FDIDITGRSA-N 388.394 5.280 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2ccccc2C(=O)O)cc1 1777559806 FLPJIJANSMTQJL-NTCAYCPXSA-N 382.415 6.003 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CC4(CC4)c4ccccc4C3=O)s2)cc1 1777670920 BBUIVMUGOLHXCT-GHRIWEEISA-N 386.472 5.815 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc4cc(Cl)ccc4o3)c2c1 1777685724 VBMOHRXIIYWXNA-DAFODLJHSA-N 382.824 5.895 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1cccc(OCc2cccc(C#N)c2)c1 56153473 TYVFXXVKIDPEBG-SFHVURJKSA-N 399.494 5.139 30 20 GKED CCc1c(C)sc(NC(=O)CSCc2coc(-c3ccccc3)n2)c1C#N 68677411 SOWPPQPBYOSVHH-UHFFFAOYSA-N 397.525 5.018 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 135760704 JFHOSTQKINNUEH-HRCADAONSA-N 377.579 5.076 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)c2cccc(SCC#N)c2)c1 158059034 CCHPNJCVFFQWDC-UHFFFAOYSA-N 390.512 5.218 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1C(F)(F)F)c1nc2cc(Cl)ccc2s1 161400760 BDBYUWFIIMXGJH-SNVBAGLBSA-N 395.793 5.214 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 183101060 GTSRQASHAAVTDK-GOSISDBHSA-N 395.462 5.233 30 20 GKED CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 185349576 TUPGFFSNHZVYFE-RDJZCZTQSA-N 397.500 5.054 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)o1 248586585 XXSLGYPDTHPWGU-MDZRGWNJSA-N 397.544 5.845 30 20 GKED Cc1ccc(C)c(SCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1 303303438 DCWRMTINCDMMND-OAHLLOKOSA-N 379.312 5.083 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3c(Cl)nc4ccccn34)cs2)cc1 303750257 FDZCJEHLMJFEGW-MDZDMXLPSA-N 379.872 5.316 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(COC3CCCC3)cc2)c1 303760185 DXYYFWOHGKASCP-UHFFFAOYSA-N 392.499 5.205 30 20 GKED Cn1c(C(C)(C)C)nc2cc(N=C(O)[C@H]3CCC(=O)c4ccccc43)ccc21 328823678 RGFXMFQXRUCHKA-KRWDZBQOSA-N 375.472 5.219 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1c(Cl)cc(F)cc1Cl 432934049 QRMAUWBXOISLAT-JTQLQIEISA-N 383.275 5.637 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@@H](C)c1ccccc1Cl 437825448 AJJMWFHWKAWWDZ-AWEZNQCLSA-N 383.879 5.368 30 20 GKED C[C@@H](SCc1nc(-c2cc(F)c(F)c(F)c2)no1)c1cccc(C#N)c1 443144354 KXFKKRGLMFTOKY-SNVBAGLBSA-N 375.375 5.020 30 20 GKED CN1CCC[C@H](CNC2CCC(C)(C#N)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 449153737 FUTPSPPMKHCSBS-MAKTXDPSSA-N 393.497 5.150 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 457897710 HPZIGDXXRPUGQW-OALUTQOASA-N 389.421 5.414 30 20 GKED C[C@@H](c1ccc(Br)cc1)c1noc([C@@H](C)c2cccc(C#N)c2)n1 463062772 YNRZLQKEIZQJHR-STQMWFEESA-N 382.261 5.007 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2nccc(-c3ccco3)n2)cc1 464443375 BBTZRFIKLIIQCA-UHFFFAOYSA-N 398.447 5.012 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)c1cn(CCCC#N)c2ccccc12 469113926 VSGFAZAOSJZJAG-IBGZPJMESA-N 377.513 5.156 30 20 GKED CCN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccc2[nH]ccc2c1 472292674 CGYJAPGPUZVVAU-UHFFFAOYSA-N 395.462 5.285 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1ccccc1 476218891 FXSAAFMMTTYQSS-MRXNPFEDSA-N 394.396 5.797 30 20 GKED COC(=O)[C@H](Nc1ccc(C(C)(C)C#N)cc1)c1cc(Cl)cc(Cl)c1 477531197 ZOMHZPAPPCBQOI-QGZVFWFLSA-N 377.271 5.121 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)s1 478555839 VOCIVPSJUDIBNZ-INIZCTEOSA-N 386.480 5.102 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480382888 ZATOLPYVDIRJST-OAHLLOKOSA-N 377.469 5.165 30 20 GKED C[C@H]1CCN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@@H](c2ccco2)C1 480558498 BHHXHKITILBCAG-PGRDOPGGSA-N 385.467 5.080 30 20 GKED Cc1cccc([C@H](NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)C(F)(F)F)c1 482023672 BGXXBMYKWMVZEE-IBGZPJMESA-N 389.421 5.090 30 20 GKED CC(C)C[C@H](C)n1nccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482928533 GSYRZWOFOIGBHW-KRWDZBQOSA-N 388.471 5.406 30 20 GKED N#C[C@@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1nc2ccccc2s1 483437269 FVHNQGQCPKWLJC-INIZCTEOSA-N 395.443 5.595 30 20 GKED COc1ccc(-c2nnc(CNc3ccc(Oc4ccccc4)c(C#N)c3)o2)cc1 488192722 LIGQGULJSGNXLL-UHFFFAOYSA-N 398.422 5.021 30 20 GKED C=C(C)[C@H](NC(=O)c1scc(C)c1Br)c1ccc(F)c(F)c1 488914322 JBDAIGGDICNOCQ-AWEZNQCLSA-N 386.261 5.144 30 20 GKED O=C(N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1CCC(F)(F)F 489649943 SCDOTKNHOCYKCX-HNNXBMFYSA-N 393.302 5.354 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 490250949 PGCHGNKJAMNGGI-INIZCTEOSA-N 387.361 5.054 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(Cl)c3C)n2)cc1 490727194 ABULLYOXYBRVHQ-MRXNPFEDSA-N 382.872 5.271 30 20 GKED CCc1cccc(NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c1 502654199 NRUXJXKYPBZWLA-UHFFFAOYSA-N 384.439 5.017 30 20 GKED Cc1cc(F)cc([C@]2(F)CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)c1 503821692 IBGZTWCAOQSVGY-QFIPXVFZSA-N 383.442 5.038 30 20 GKED C[C@@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(C)(C#N)CC1 506040685 DLGIUPWCBLFZBR-KRWDZBQOSA-N 392.934 5.425 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H]2CCCC[C@H]2C)cc1 508278316 KVFRIGLIMCCFGH-OXQOHEQNSA-N 393.487 5.402 30 20 GKED O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513516831 BILQJJFLUCCHGC-CYBMUJFWSA-N 383.307 5.039 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)CCCCC1 520534576 MHWIBAVLDQGKQE-UHFFFAOYSA-N 389.377 5.305 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N[C@H](c2cccs2)C2CC2)cc1 520721162 BQKZFGDPUKNUBD-NRFANRHFSA-N 392.455 5.432 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)Cc1ccccc1-2 521729736 GSYDNAYCAYEWEV-INIZCTEOSA-N 384.504 5.762 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(C4CCCC4)[nH]n3)cc2)cc1 524576631 SBEMRJYKHRNLFM-UHFFFAOYSA-N 386.455 5.178 30 20 GKED Cc1sc([C@H](C)NC(=O)Cc2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 531038591 KVJCGMJFQPTZGH-ZDUSSCGKSA-N 395.915 5.064 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@H](c3cccc(Cl)c3)C3CCCC3)o2)c1 537125858 JQVGGALBINHOIU-NRFANRHFSA-N 392.890 5.283 30 20 GKED N#Cc1cccc(C2(NCc3csc(Cc4ccc(Cl)cc4)n3)CC2)c1 551713453 ANDPSBUXFKVZBD-UHFFFAOYSA-N 379.916 5.038 30 20 GKED Cc1cc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)s1 557560796 HKGIKQLGRKRUPJ-ZDUSSCGKSA-N 390.599 5.631 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 576484523 VNSHEJMXJDSTFF-UHFFFAOYSA-N 399.825 5.378 30 20 GKED C=C(C)CN(CC)C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 577665347 NWGBPNCUPKBTIZ-UHFFFAOYSA-N 380.916 5.305 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 577699558 ZUMPPHOUZBGTPQ-QGPMSJSTSA-N 383.492 5.288 30 20 GKED Cc1cccc(-n2nc(C(C)(C)C)cc2NC(=O)N2CCC(CCC#N)CC2)c1 579350137 CSAPZMNYAGXJAD-UHFFFAOYSA-N 393.535 5.026 30 20 GKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(OC(F)F)cc1 582936171 RNXULSUVULJHHH-CQSZACIVSA-N 381.382 5.520 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cc4c(s3)SCC(=O)N4)s2)cc1 588450295 WQOHZUTWTWLMEC-SREVYHEPSA-N 398.534 5.120 30 20 GKED CCOc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609062378 HWVHZSMVFOZYNE-UHFFFAOYSA-N 386.451 5.097 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 609402861 DXJGTOXZYNTIAI-WIYYLYMNSA-N 393.556 6.088 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(Cl)c1 609427175 SAARZCGVPZGOJE-UHFFFAOYSA-N 378.815 5.265 30 20 GKED CC(C)Sc1ccc(C(=O)NC2CCC(Oc3ccccc3C#N)CC2)cc1 609509017 QPDVUDUIMZXXAF-UHFFFAOYSA-N 394.540 5.179 30 20 GKED N#Cc1cccc(C(=O)N(c2cccc(Br)c2)C2CCCCC2)c1 610046607 NRHLYKLYWDHLRF-UHFFFAOYSA-N 383.289 5.300 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)cn2)c1 610238063 FLCNUTXHKTUOOE-UHFFFAOYSA-N 398.397 5.132 30 20 GKED Cc1ccc(F)cc1NC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 642398891 FPHBKJYSWGCVCZ-UWVGGRQHSA-N 386.311 5.165 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)cs1 671750997 JMBGXLZPWWWYEX-CYBMUJFWSA-N 393.320 5.977 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2SCc2ccco2)s1 684673643 BARPCPMTORMJCV-MRXNPFEDSA-N 396.537 5.816 30 20 GKED CC(C)c1scnc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 685784319 YYKRTVLKEGJTPI-SNVBAGLBSA-N 395.431 5.385 30 20 GKED CCC[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc(C(F)(F)F)c1 726797671 OULPKKSVBCQAAR-OAQYLSRUSA-N 389.465 5.686 30 20 GKED N#CCOc1cccc(NC(=O)NCc2ccccc2-c2ccc(Cl)cc2)c1 726845594 MDNUEPJOBSSDMJ-UHFFFAOYSA-N 391.858 5.231 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)c1 727330339 DIUCWNANXXOWKH-UHFFFAOYSA-N 382.460 5.241 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccncc1 734655868 VIJXFKMQHFMCIQ-JOCHJYFZSA-N 391.446 5.130 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@@H]1c1ccc(OC)cc1)c1ccncc1 734681870 ZYVXYIJLHWAMKY-FCHUYYIVSA-N 379.504 5.034 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2cccc(F)c2)cc1 734965977 RWKUEMUDBUYGJV-MRUHUIDDSA-N 380.463 5.180 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1OC(F)F 734980770 LFVVRXUGGLYDIH-KRXBUXKQSA-N 386.366 5.507 30 20 GKED CC(C)(C)c1ncc(/C=C2\CCOc3ccc(Br)cc3C2=O)s1 736434248 RIDAGHXVCRBXAU-DHZHZOJOSA-N 392.318 5.252 30 20 GKED CCCCC/C(C=Nn1c(S)nnc1[C@@H]1CCCCO1)=C\c1ccccc1 743451370 FCBQRZXTTCCTGL-IABSIUQHSA-N 384.549 5.306 30 20 GKED N#C[C@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc2cc(F)ccc2s1 744118140 FTTKJXMHYMZZAW-LEOMRAHMSA-N 378.472 5.586 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1cccc(OCC#N)c1 746662881 ITLYBJBTPKMDAC-QGZVFWFLSA-N 391.496 5.446 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(N2CCCCC2)c(F)c1 753140304 AMDRRAPNPDMQRI-NTMALXAHSA-N 393.487 5.231 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cc(Cl)ccc1OC[C@H]1CCCO1 754710626 VLRKSEDQFAZRAP-OAHLLOKOSA-N 399.796 5.330 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)N1CCC[C@@H]1c1nc2ccccc2n1C(C)C 758296181 KPPMNKQHKXOCKZ-NHCUHLMSSA-N 398.551 5.252 30 20 GKED C=C[C@@H](CC(=O)OCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 758919117 DVMUCLYHUPXNRI-IBGZPJMESA-N 385.463 5.195 30 20 GKED N#CCc1cccc(C(=O)O[C@H](c2cccnc2)c2cccc(C(F)(F)F)c2)c1 759586803 DZZHEJBPZPGLBE-FQEVSTJZSA-N 396.368 5.113 30 20 GKED N#CC1(c2ccc(COC(=O)CCC(=O)c3ccc4ccccc4c3)cc2)CC1 777347176 UHQPNIOWWATBOA-UHFFFAOYSA-N 383.447 5.101 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)Nc2ccccc2O[C@@H](C)C#N)c1 780671009 OHPGGBBYHIDGFL-SFHVURJKSA-N 389.455 5.113 30 20 GKED O=C1/C(=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)CCc2nc(O)ccc21 781549461 FRTNUPFYUYTCBP-ACCUITESSA-N 385.341 5.279 30 20 GKED CCc1cnc(/C=C2/CCc3nc(-c4ccc(OC)cc4)sc3C2=O)s1 783707016 LPDKJFYABPQCBE-RAXLEYEMSA-N 382.510 5.050 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 791876138 BYQRSRKMVABJSG-REWPJTCUSA-N 375.516 5.286 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccccc1O[C@H](C)C#N 796924921 VOWYSCRVDPHDEU-CYBMUJFWSA-N 395.846 5.101 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570109 CTIUTVZNKFGESM-GXTWGEPZSA-N 394.462 5.829 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 800387901 WPTUYSFFRQIMCK-TZMCWYRMSA-N 380.847 5.465 30 20 GKED COc1ccccc1-c1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 806561005 QMVXCCOXUBNANR-MTPVXSITSA-N 384.431 5.200 30 20 GKED N#C[C@H](C(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1nc(C2CC2)cs1 842938638 OIMGIVWCCHGCFP-OAHLLOKOSA-N 399.928 5.216 30 20 GKED N#C[C@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc(C2CC2)cs1 842941233 OUUJZMJKMBAIRO-LLVKDONJSA-N 385.341 5.588 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)/C=C/c1ccccc1C#N)C1CC1 914482166 LZRADYNXIYKFIY-SAAWKEMMSA-N 384.401 5.342 30 20 GKED CCc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 915359023 IHCNJPBHEATRMV-NRFANRHFSA-N 375.497 5.288 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 916628524 WNHIOXAWRWVFHH-HXUWFJFHSA-N 390.508 5.462 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916916553 VUWQSWBAEUVGSX-ORYIKVKISA-N 396.490 5.498 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 918034652 SXVXHAQJYUKBJU-DQEYMECFSA-N 395.506 6.020 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1ccc(Oc2ccccc2)cc1 918164661 XUFQOEYOAMZKHF-UHFFFAOYSA-N 392.499 6.003 30 20 GKED Cc1c(C(=O)O)oc2c1C(=O)/C(=C\c1csc(-c3ccc(Cl)cc3)n1)CC2 920067783 CVQCIEGQHBCADO-WQLSENKSSA-N 399.855 5.276 30 20 GKED Cc1cc(C=NNc2ccc(Cl)c(C(=O)O)c2)c(C)n1-c1ccccc1F 1776033599 GCJMMCJLBMXTIU-UHFFFAOYSA-N 385.826 5.031 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cccc(CC(=O)O)c2)cc1 1776125662 PKOUUDWZEPUPNW-XNTDXEJSSA-N 380.484 5.559 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(C2(NC(=O)c3ccoc3C)CCC2)cc1 1786103861 KWKVFJXJFDUVPB-UHFFFAOYSA-N 392.499 5.104 30 20 GKED Cc1nnc(SCc2ccc(-c3ccccc3C#N)cc2)n1Cc1ccccc1 22415603 XDVIAIHRYYCXCV-UHFFFAOYSA-N 396.519 5.466 30 20 GKED Cc1ccccc1OCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 46861753 CKAUXNUUHXMUKG-FQEVSTJZSA-N 390.870 5.321 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc2oc(=O)ccc2c1 54253997 BXIUUAPJKLHSSF-UHFFFAOYSA-N 398.443 5.068 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 63641437 OICLVZZPGVVSGH-SFHVURJKSA-N 399.494 5.661 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCOCc1ccccc1 64919186 WDPMGEWGZPXRFU-UHFFFAOYSA-N 376.481 5.222 30 20 GKED N#C[C@@H](C(=O)CSCc1ccc(Cl)cc1Cl)c1nc2ccccc2o1 66516442 SXVUSGIMNXTASS-ZDUSSCGKSA-N 391.279 5.244 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCOc1ccc(F)cc1Cl 66802246 KSNNOBTVMDHPHN-ZDUSSCGKSA-N 392.883 5.281 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)cc1OC 72067725 CKSJEITYZSTGCF-CMDGGOBGSA-N 380.362 5.017 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(-n2ccnc2)c(Cl)c1 109684683 VULSYLIIZSOYBO-UHFFFAOYSA-N 398.853 5.317 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(Cc2cccc(Cl)c2)C(C)C)c1 114037955 GKOPOMCFRAVBOI-HXUWFJFHSA-N 399.922 5.141 30 20 GKED N#CCC[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccccc1 130485239 WBLQNVGKVMPIGD-LJQANCHMSA-N 384.405 5.026 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Oc2cccc(F)c2)c1 175676952 HWEQDDOLNXDKCC-UHFFFAOYSA-N 378.428 5.486 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc(Cl)cc3)n2)cc1 198043891 WXEKFLQJKPPKOO-VZCJILNPSA-N 394.883 5.362 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1ccccc1SC[C@@H](C)C#N 255068008 BZFVRBPXIJFBDG-NOCRFKNCSA-N 380.513 5.074 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C(C)=C\c3ccc(F)cc3)n2)cc1 255632132 ZSXJUONKUNTNNZ-KWRJMZDGSA-N 392.455 5.238 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1ccccc1Cl 303383879 WRKPJNAQIJOZGL-OAHLLOKOSA-N 391.858 5.443 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1/C(O)=N/[C@@H](C)c1oc2ccccc2c1C 330277632 ONOVAICXQHWTCW-WMZOPIPTSA-N 380.492 5.160 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)CCCC2(C#N)CCOCC2)cc1 410379722 GZONPMROGJQBAN-FQEVSTJZSA-N 392.543 5.456 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)nc1OCC 429022992 DIMQGQQPCKOCPZ-UHFFFAOYSA-N 392.421 5.603 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cccc(SCC#N)c3)cc2)n1 430036529 FKHKMMJCZLHEJF-UHFFFAOYSA-N 397.550 5.471 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ncccc2Cl)cc1Cl 432005445 FMUAGFCJOUOQJS-MRXNPFEDSA-N 382.250 5.296 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)N[C@H](c1cc(F)ccc1F)C(F)F 433009981 ATYFEUOIJTWOBJ-CQSZACIVSA-N 394.290 5.198 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@@H](CC(F)(F)F)C3)c2)cc1 434158974 WJERZVINANHXNK-HNNXBMFYSA-N 389.377 5.157 30 20 GKED CCSCc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 434621872 XYNNKBCKLQELNQ-OAHLLOKOSA-N 385.439 5.175 30 20 GKED C=CCn1c(SCc2nc(C3CCCCC3)cs2)nnc1-c1ccncc1 435687678 HYZKWSJVQVBDEV-UHFFFAOYSA-N 397.573 5.323 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)c1cc(C#N)oc1C 436167567 GRUJMGAOYNEWML-UHFFFAOYSA-N 378.453 5.013 30 20 GKED COc1ccccc1CCC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437480813 LRRHTWADFIVLMZ-UHFFFAOYSA-N 390.414 5.070 30 20 GKED N#CCC[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 439662106 PIUDPHGTDKHGLY-QHCPKHFHSA-N 381.435 5.125 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC1CCCCC1)c1nc2ccccc2s1 442624610 YTHYIHDTTDKNBX-QGZVFWFLSA-N 376.481 5.498 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(C)[C@@H](C)CC#N)cc2Cl)cc1 444391743 LJFMMBJUKQSZBA-ZDUSSCGKSA-N 389.908 5.266 30 20 GKED O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc(CCC(F)(F)F)cc1 447711358 XBANKPZCNNHXQY-HNNXBMFYSA-N 393.302 5.196 30 20 GKED COc1cc(C#N)ccc1CNC(C)(C)c1nc(-c2ccccc2F)c(C)s1 451163444 DEZVMTYZKKBUKT-UHFFFAOYSA-N 395.503 5.163 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1 455677066 SXKTVEJMDFDHOH-MBSDFSHPSA-N 391.515 5.058 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)n2C)c(C(F)(F)F)c1 460074642 KKQYJULRMACYOR-NSHDSACASA-N 381.423 5.058 30 20 GKED N#CCCN(C(=O)c1ccc2ccc(Cl)cc2n1)C12CC3CC(CC(C3)C1)C2 460467382 DALSZMMPNBJLAD-UHFFFAOYSA-N 393.918 5.213 30 20 GKED Cc1c(NC(=O)c2occc2COc2cccc(C#N)c2)sc2c1CCCC2 461662937 KKQJAYRAVFBFHR-UHFFFAOYSA-N 392.480 5.231 30 20 GKED C[C@H](C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 461916920 AOMFYUZXMZYDTE-XOBRGWDASA-N 380.900 5.282 30 20 GKED CC(C)c1c(NC(=O)[C@@H](C)c2cccc(C#N)c2)cnn1-c1ccccc1Cl 462341396 MJCCREIKLSQSAT-HNNXBMFYSA-N 392.890 5.263 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CC(c3ccccc3F)C2)cc1 463022767 WHQPEBRNNUXENS-UHFFFAOYSA-N 388.467 5.088 30 20 GKED C[C@@H](c1cccc(C#N)c1)c1nc([C@H](C)c2ccc(Br)cc2)no1 463062770 YNRZLQKEIZQJHR-OLZOCXBDSA-N 382.261 5.007 30 20 GKED N#C[C@H](NC(=O)c1nc2ccccc2cc1Cl)c1ccc(Cl)c(Cl)c1 464408576 VTOIZKUZWRXJBR-INIZCTEOSA-N 390.657 5.190 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4cc(C(F)(F)F)ccn4)cc3c2C1 464458017 DIIYOTAKVNWODH-PXAZEXFGSA-N 397.400 5.197 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1C(C)(C)C 468808450 CDQCLDQBQRVYAH-SFHVURJKSA-N 389.543 5.740 30 20 GKED CO[C@H]1CCC[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 476205695 QDISYRHREGWLDA-YJBOKZPZSA-N 382.435 5.023 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)cc1F 479480564 DSBLJKVEOPZUNW-DEOSSOPVSA-N 399.469 5.287 30 20 GKED CC(C)(CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C(F)(F)F 480182387 OPUVUHPDUODWPF-UHFFFAOYSA-N 380.341 5.407 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C(F)(F)F)nc1 480899231 KJKGUBIOGQCPKV-UHFFFAOYSA-N 375.803 5.035 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481739832 JVDHACNJDGXISV-OAHLLOKOSA-N 393.418 5.094 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnn(-c4ccccc4C)c3)n2)cc1 483278604 WJXZEFXOPLZMHL-LJQANCHMSA-N 398.491 5.103 30 20 GKED C=CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1cccs1 489425156 AGZSEIBRQCLFRW-UHFFFAOYSA-N 380.542 5.286 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 490431251 IDDWUGNRDCBIHX-UHFFFAOYSA-N 387.439 5.206 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1nc2ccccc2o1 492122362 LXDYMCKYPDCOTL-INIZCTEOSA-N 390.345 5.388 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC=C(c2ccccc2)C1 497327676 RPKLTXLOHPPCFQ-QGZVFWFLSA-N 377.513 5.260 30 20 GKED CC(C)(C)[C@@H](NCCCC1(C#N)CCOCC1)c1cccc(C(F)(F)F)c1 499605391 ZETZUNXXHSAEAY-SFHVURJKSA-N 382.470 5.483 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1 504770066 KJNIIQXVGQSFEB-UHFFFAOYSA-N 380.831 5.344 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N1CCC(C)(C#N)CC1 506958080 YBOOLEUEFVJGNL-UHFFFAOYSA-N 397.906 5.385 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)c(Cl)c1 509586506 JHRAOQUCFMHKPU-GFCCVEGCSA-N 393.270 5.058 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1cccc(C#N)c1C 510343803 TTWCBPCMHMHYNE-INIZCTEOSA-N 375.497 5.132 30 20 GKED Cc1c(C(=O)Nc2ccc(CN(C)C)c(Cl)c2)sc2ccc(C#N)cc12 510815242 YUYRJZOQEYRILA-UHFFFAOYSA-N 383.904 5.049 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 518740254 RDWHYFIBXJQSEZ-YLJYHZDGSA-N 396.556 6.000 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1C#N)c1ccc(OC(F)(F)F)cc1 519948472 CEYFIVLXNVYUJX-QWHCGFSZSA-N 394.418 5.278 30 20 GKED C=C1CCN(C(=O)c2oc3ccccc3c2CSc2ccccc2F)CC1 520823520 ABVBUDARUJRJFT-UHFFFAOYSA-N 381.472 5.656 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3c[nH]nc23)cc1Cl 524706787 KDBPAJVDVJRPDJ-LJQANCHMSA-N 386.842 5.124 30 20 GKED COc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)c(OCc2ccccc2)c1 526136409 PWEDHDVJMIRORD-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 536079587 FSGKFEVEQRIGNL-HSZRJFAPSA-N 376.456 5.070 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](N[C@@H](CCC#N)c2ccccc2)CCC3)cc1 536838486 LNAQTFNQKQQBJI-LEWJYISDSA-N 387.552 6.131 30 20 GKED CC[C@H](C)n1ncc(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1C1CC1 536885853 NPJWEKVIEFBEKD-KRWDZBQOSA-N 398.510 5.200 30 20 GKED CC(C)C[C@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 539716156 KJDBCCLSZNPWIO-FPOVZHCZSA-N 393.487 5.066 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1ccc(C#N)c(Cl)c1 547959326 ACKQXXGAHNBNBD-AWEZNQCLSA-N 395.915 5.477 30 20 GKED Cc1ccc(C)c(-n2ncc([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)c2C)c1 550835691 LYKBARIJKCBTGB-YKSBVNFPSA-N 386.543 5.883 30 20 GKED COc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Br 551211544 JGYXOHIIEWIHGE-DNVCBOLYSA-N 387.321 5.543 30 20 GKED CCCN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)CC1CCCCC1 553026561 RYCVKMLZSPPODL-GOSISDBHSA-N 387.593 5.169 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(C(F)(F)F)c1 553967802 CPPMNLCGYVRMBP-CQSZACIVSA-N 378.350 5.054 30 20 GKED Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@H](CCCC#N)c1ccccc1 556202229 KMORMGVMBRQSPE-YLJYHZDGSA-N 383.923 5.390 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 558338273 GGUWZFAYMJIXGE-APWZRJJASA-N 397.544 5.704 30 20 GKED Cc1ccc(NC(=O)c2cc(C#N)ccc2Cl)c(-c2nc3ccccc3[nH]2)c1 563564949 JVKFZHYMZOHFPP-UHFFFAOYSA-N 386.842 5.316 30 20 GKED CC(C)(C#N)CCCCN1CCN(CCCCC(C)(C)C#N)[C@@H]2CCCC[C@H]21 569943724 BTQLDQYRYHPLOV-FGZHOGPDSA-N 386.628 5.355 30 20 GKED N#CC1(CNC(=O)[C@@H](Sc2cc(Cl)ccc2Cl)c2ccccc2)CC1 574141156 BMVAXVVHCAMOND-KRWDZBQOSA-N 391.323 5.247 30 20 GKED C[C@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc([N+](=O)[O-])c1 574336955 CUWDJLSSEOSPLW-HNNXBMFYSA-N 387.395 5.001 30 20 GKED O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 574948302 RBILZPYQRGJRIN-LLVKDONJSA-N 397.265 5.060 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C(C)=O)oc2cc(C)ccc12 580898338 LGRFOGOWXKJPAN-UHFFFAOYSA-N 389.495 5.977 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1OCc1ccccc1 581146576 WAPKLWQTZIDXOD-SQJMNOBHSA-N 384.523 6.351 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2noc3cc(F)ccc23)CC1)c1ccccc1 581698671 QNODEXUSWMPMIA-MRXNPFEDSA-N 378.447 5.033 30 20 GKED CC(C)C[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589363548 FXKLOZSHRPNDAF-IBGZPJMESA-N 378.476 5.178 30 20 GKED C=CCCC(C)(C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 596695669 VQYTXWIPANAWPR-UHFFFAOYSA-N 377.488 5.198 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1nc(C)cc(C)c1C#N 603867527 XVWVMDLKNKPYMK-UHFFFAOYSA-N 388.471 5.158 30 20 GKED CCCOc1ccc(OCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603969437 VCHOISKAZUXSQP-UHFFFAOYSA-N 392.480 5.093 30 20 GKED Cc1cccc(CCC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 604003579 GCADMOHHLNEZEC-UHFFFAOYSA-N 384.479 5.211 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCCC2)c1)c1ccc(C(F)(F)F)cn1 606753845 NTETXIFJEDWQGR-GOSISDBHSA-N 388.389 5.302 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)s1 609078900 CGXWDDXAIQVORS-UHFFFAOYSA-N 391.496 5.137 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(Cl)cc1Cl 609377366 CXVFUNKFAAQFFC-GFCCVEGCSA-N 379.312 5.426 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 609428871 CXSWIHMSBWOHOM-UHFFFAOYSA-N 395.418 5.141 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 609967838 KJKXNOVMIYBQNQ-INIZCTEOSA-N 388.433 5.509 30 20 GKED N#Cc1cccc(-c2nnc(CSc3ncc(-c4ccc(Cl)cc4)o3)o2)c1 610217386 BCPHWNVPHZGTPB-UHFFFAOYSA-N 394.843 5.209 30 20 GKED C=CCN(CC=C)C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 611630995 LDQUAGRBKMZYKM-IBGZPJMESA-N 393.918 5.337 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C(C)C)N1Cc2ccccc2C1=O 622852285 ZZBIPJQNESZGMP-QHCPKHFHSA-N 390.527 5.158 30 20 GKED Cc1cccc2sc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c(Cl)c12 682995185 QCMDIVNJJUIGPC-HNNXBMFYSA-N 376.868 5.901 30 20 GKED CC(C)c1occc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 684631283 NUIXDHVYEXDSAJ-GFCCVEGCSA-N 378.375 5.522 30 20 GKED O=C(Cc1ccc(N=Cc2c(O)ccc3ccccc23)cc1)Nc1ccccc1F 727973158 SVIPOSGOLVVVBH-UHFFFAOYSA-N 398.437 5.616 30 20 GKED Cc1c(NN=Cc2sc(Oc3ccccc3)nc2Cl)cccc1[N+](=O)[O-] 727973291 GORHQUNHONLMDA-UHFFFAOYSA-N 388.836 5.251 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2sc3nc(C(F)(F)F)ccc3c2C)c1 728479452 UGZFZBYQKCHEIY-UHFFFAOYSA-N 388.414 5.272 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cc1 728698394 JCGKENNGKYGNJW-MEODZPNASA-N 377.440 5.741 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(OCC#N)c1 729037639 WGXIJONOZUZGFZ-UHFFFAOYSA-N 391.393 5.050 30 20 GKED CC(=NNc1cc(F)c(F)cc1F)c1cnn(-c2cccc(Cl)c2)c1C 734302821 QGXYKGBUEZKWEF-UHFFFAOYSA-N 378.785 5.088 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)cc(OC)c1OC 734303606 WCRCVUSWEAHCME-KTKRTIGZSA-N 395.480 5.040 30 20 GKED COCCOc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3OC)cc2)c1 741468273 DTJAHUVTLPZDNV-GDNBJRDFSA-N 388.463 5.284 30 20 GKED COc1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc2ccccc12 742303191 DQVRVIIAVYOUMC-JOCHJYFZSA-N 393.446 5.151 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2ccc(-c3ccccc3OC)cc2)cc1 742375518 DBUAOWCXONZLBN-HXUWFJFHSA-N 385.507 5.615 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccc(-c2ccncc2)cc1 745990536 SUBWFOMPMSNAPL-KMKOMSMNSA-N 392.458 5.619 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 747109211 YGVIATFOJFVGJQ-HZMBPMFUSA-N 395.673 5.098 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(C(C)(C)C)cc2)cc1OCCCC#N 747361622 SNMAYCMXXCCNMC-QPEQYQDCSA-N 377.484 5.571 30 20 GKED N#C[C@@H](C(=O)CCCCc1ccc(Cl)c(Cl)c1)c1nc2ccccc2o1 753542886 WTGZDAOIYLEGEO-AWEZNQCLSA-N 387.266 5.724 30 20 GKED C=CCN(C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1)C(C)C 766250480 VXNCXWSFCAKOET-UHFFFAOYSA-N 389.858 5.160 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@@H]3CCCOC3)c2)cc1 766355388 LCGWMHUYIXFLMZ-ILBGXUMGSA-N 396.490 5.488 30 20 GKED C=CC[C@@H](NC(=O)NCc1c(OC(C)C)ccc2ccccc12)c1ccncc1 768363623 PIEQRZYWIDEHBP-JOCHJYFZSA-N 389.499 5.139 30 20 GKED O=C(CCCC(F)(F)F)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 770751507 XIFWSASETHXRLU-LLVKDONJSA-N 382.222 5.585 30 20 GKED CCCCCCN(C)CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 778607832 SHWKPZLSKCYOAA-AWEZNQCLSA-N 397.466 5.003 30 20 GKED CCOC(=O)c1sc2cccc(F)c2c1CNc1ccccc1O[C@@H](C)C#N 779742882 UQFILUSLGHKZEX-ZDUSSCGKSA-N 398.459 5.120 30 20 GKED Cc1cc(Br)cc2cc([C@H](NCc3ccc(C#N)cn3)C(C)C)oc12 783294881 XQNRDBHNUSITJE-LJQANCHMSA-N 398.304 5.257 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1-c1ccncc1 793258919 BBHIZJLWSUIGGH-UHFFFAOYSA-N 378.888 5.391 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 796688326 AHOHANMTTNNVTO-APWZRJJASA-N 376.481 5.502 30 20 GKED CCNc1ccc(C#N)cc1NC(=O)c1ccc(C2SCCCS2)cc1 797173179 VBBPNFQIGHQHJW-UHFFFAOYSA-N 383.542 5.111 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567177 ZGMJBAZDPMLCOY-RYUDHWBXSA-N 378.950 5.451 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)OCCCC1(C#N)CCOCC1 800202150 PROQPEIWWMJRJS-OWBHPGMISA-N 382.287 5.040 30 20 GKED C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)nc1Cl 817862815 NTZNNXHWRJJHNJ-NSHDSACASA-N 395.812 5.046 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3[C@H]4CCCCCC[C@H]43)n2)cc1 850791567 VVAGVFMWCDHASE-HLNWXESRSA-N 375.497 5.074 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C[C@@H](C)C1(F)F 860424545 IUGAWWFYEYELAP-YRNRMSPPSA-N 383.442 5.097 30 20 GKED O=C1/C(=C/c2ccccc2)CC2(C/C1=C\c1ccccc1)C(=O)Nc1ccccc12 917518037 QRJLENXDUUJOHP-YHARCJFQSA-N 391.470 5.407 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc2c(c1)-c1ccccc1C2 920105411 GCTPSBZUELDTMK-QFIPXVFZSA-N 390.442 5.253 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)CC2 1776374689 SKNZEUUSMULWFF-PXLXIMEGSA-N 396.486 6.388 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2cccc(C(=O)O)c2)cc1OC 1776788905 FNMFKOKBYDXKBW-ZRDIBKRKSA-N 382.456 5.249 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2cccc(O[C@H](C)C(=O)O)c2)cc1 1776794133 WIPWVBYWLFDEAZ-GWKQRERASA-N 382.456 5.004 30 20 GKED O=C1/C(=C\c2ccccc2Oc2cccc(F)c2)C[C@@H](C(=O)O)c2ccccc21 1777698068 BNQDTPLFOGMEDK-MJGOQDMVSA-N 388.394 5.456 30 20 GKED O=C(/C(=C\c1ccc2ncccc2c1)c1nc2ccccc2s1)c1ccccc1 34704604 UOFCHTCVGFXOSX-CAPFRKAQSA-N 392.483 6.268 30 20 GKED N#C[C@H](C(=O)Cc1ccc2ccccc2c1)c1nc2ccccc2n1C(F)F 41559273 VNHSEYILSUXYEL-QGZVFWFLSA-N 375.378 5.004 30 20 GKED CCN(C(=O)CCCCc1nc2ccccc2s1)[C@@H](C)c1ccc(C#N)cc1 45499983 HFKCYECNMHKJJX-KRWDZBQOSA-N 391.540 5.490 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1F 60958754 MLBIVLAMHMQFCW-INIZCTEOSA-N 378.422 5.266 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc4c(c3)COC4)cc2Cl)cc1 64394779 IJRCQFFXCLWIKV-UHFFFAOYSA-N 390.826 5.286 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCCCc1nc2ccccc2s1 65839578 YILSJORXVYSBSN-UHFFFAOYSA-N 393.512 5.307 30 20 GKED CN(C(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(F)c(F)c1 65845632 OZUAAXXTUDBGTL-UHFFFAOYSA-N 380.419 5.264 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(Br)c1 66801424 BNQUNAPEMKTDCR-JTQLQIEISA-N 381.320 5.157 30 20 GKED C=CCN(C(=O)c1sc(CCC)nc1C)c1nc(-c2ccccc2)cs1 106279408 FTNWPSHGZFWVGV-UHFFFAOYSA-N 383.542 5.360 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F 108533310 OFFHYWLEBQSNOE-MELADBBJSA-N 385.455 5.181 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3c(F)cccc3F)o2)c1 115618498 AUOFUKMLFZZYPL-INIZCTEOSA-N 382.410 5.196 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cc3c(s2)CCC3)cc1 117738569 PKJVORJCMKYKBM-UHFFFAOYSA-N 390.483 5.090 30 20 GKED Cc1cc(C(=O)N(C)c2cc(Cl)ccc2C#N)ccc1NC(=O)OC(C)(C)C 132633890 BRUKSWJVACXYCQ-UHFFFAOYSA-N 399.878 5.144 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)Nc1ccccc1CCC(F)(F)F 177024257 ULSZJLSAWGEOIF-UHFFFAOYSA-N 378.398 5.254 30 20 GKED CCC[C@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 181774565 FUPNLJBQCNFFLT-HKUYNNGSSA-N 381.545 5.008 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CC1CCC(C(F)(F)F)CC1 183287940 QLCJMTWVQNWOHW-WLYUNCDWSA-N 384.467 5.778 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)c(F)c1 183338642 TVXJIASKTGQTRE-OAHLLOKOSA-N 376.275 5.109 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(NC(=O)C2CC2)ccc1C)c1ccc(F)c(F)c1 186203686 UWBGTMVILBLFSU-FQEVSTJZSA-N 399.441 5.061 30 20 GKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1cccc(NC(=O)c2ccccc2)c1 187413031 ROBYEZKAQJHGFB-MRXNPFEDSA-N 389.886 5.315 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(OCC2CCCC2)CC1 191492734 WFMXOSRANLNKOB-UHFFFAOYSA-N 384.564 5.742 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)o1 193482425 BFUPNTAZWSVKCK-UHFFFAOYSA-N 389.455 5.207 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 195547995 AVUVFBDUSTXJOY-HNNXBMFYSA-N 392.421 5.173 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(O[C@H](C)C#N)cc1 237603196 DNBWTSFMWQHVRH-CVEARBPZSA-N 377.513 5.260 30 20 GKED CCS[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1S[C@H](C)CC#N 246784136 ZNPFBCDJCKBMAM-BFYDXBDKSA-N 377.579 5.267 30 20 GKED CSc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 303425251 BSKVGVTYKGTEFF-MRXNPFEDSA-N 382.872 5.563 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c1 304053100 PDGWUDYOOKZCRQ-MOPGFXCFSA-N 389.282 5.418 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 304120799 ZZUASGWFIKBOEL-VQTJNVASSA-N 385.294 5.183 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)c(Br)c2)sc2c1CCCCC2 323152513 NUFSTTIPRZIKGS-UHFFFAOYSA-N 393.281 5.043 30 20 GKED CC(C)n1ncc2ccc(N=C(O)N3CC[C@H](C(F)(F)F)C4(CCC4)C3)cc21 328705864 YUXVPPTZAGONJG-KRWDZBQOSA-N 394.441 5.217 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/Cc1oc2ccc(F)cc2c1C 328882841 MAEWCUIRFKWXRY-CYBMUJFWSA-N 388.464 5.044 30 20 GKED COc1c(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc(Cl)cc1C(=O)N(C)C 329151210 SGMZHYYZFWYBEM-CWRNSKLLSA-N 392.927 5.245 30 20 GKED Cc1cc(N(C)C)cc(C)c1N/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329403916 YVSOLZALRGSJLU-FQEVSTJZSA-N 395.551 5.085 30 20 GKED Cc1cc(N2CCCCCC2)ccc1N/C(O)=N/[C@@H]1CCCC12CCOCC2 329422199 HKMOSIUASOHLPG-OAQYLSRUSA-N 385.552 5.051 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1C[C@]12CCOc1ccccc12 330174696 IMOMASRKANIWLX-SKPFHBQLSA-N 391.515 5.073 30 20 GKED Cc1cccc(CCNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 409534882 KKHAECCRKZEWPZ-UHFFFAOYSA-N 399.494 5.004 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(NC(=O)CC(C)C)ccc1Cl 410346740 XAJIEXBPLWUUDK-UHFFFAOYSA-N 384.907 5.696 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(-c2c(F)cccc2Cl)noc1C 410354048 OWKBHVADKMSXDS-UHFFFAOYSA-N 384.838 5.813 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)[C@@H](C#N)CCc2ccccc2)cc1 433236089 WTYRVHHWACXTRY-LJQANCHMSA-N 386.451 5.199 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc(F)cc(F)c1 434150123 JKWXXGOOOHXOMD-ZDUSSCGKSA-N 375.444 5.023 30 20 GKED CC(C)(C)n1cc(NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cn1 438664401 HORCSUIZZCGCPQ-UHFFFAOYSA-N 393.422 5.085 30 20 GKED C=CCC[C@@H](NC(=O)N(C)C1CCC(OC)CC1)c1ccc(C(F)(F)F)cc1 442283056 JSSGPZHPEJDKKV-CTWPCTMYSA-N 398.469 5.312 30 20 GKED C=CCN(C(=O)c1ccc(OC2CCC2)cc1)c1nc(-c2ccccc2)cs1 443812822 IFRDNCVGKQRDPM-UHFFFAOYSA-N 390.508 5.574 30 20 GKED C=CCC[C@H](NC(=O)CCCc1ncc(C)o1)c1ccc(C(F)(F)F)cc1 450192748 AZYMPADAZFMVHS-KRWDZBQOSA-N 380.410 5.148 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1c(F)cccc1F 454779068 ZWEFDCQTMCGGNG-CYBMUJFWSA-N 375.444 5.023 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(-c2csc(C)n2)c1 463462949 ACMWMPOBXMAXEH-UHFFFAOYSA-N 388.945 5.662 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3cccc4cc[nH]c34)cc2)cc1 466567798 RBGNXYAIUOTHQQ-UHFFFAOYSA-N 382.423 5.154 30 20 GKED C=CCN(C(=O)C[C@@H](OCC)C1=CCCC1)c1nc(-c2ccccc2)cs1 467099338 FAXJPAQJAHBTNO-HXUWFJFHSA-N 382.529 5.235 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 468683248 ZOLCBDWVRLMMQT-UHFFFAOYSA-N 382.891 5.324 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)Oc1cccc(OC)c1 475576199 VKTJZBCYNRDIOC-KRWDZBQOSA-N 382.504 5.136 30 20 GKED N#Cc1ccc(OCc2cccc(-c3nc([C@H]4CCC(F)(F)C4)no3)c2)cc1 484550612 HTPGBJXYMRXAFI-KRWDZBQOSA-N 381.382 5.090 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1)c1ccccc1 495040715 DBVXUJOVHWFQES-QFIPXVFZSA-N 385.467 5.022 30 20 GKED C=C(C)CN(CC)C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 497495532 ZBZVGJRWXKIQEW-AWEZNQCLSA-N 378.925 5.041 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 499330720 VHKJIGQTUAQYLV-UHFFFAOYSA-N 375.497 5.293 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)cc1 499431850 PZDUDKAFJYFZEF-UHFFFAOYSA-N 396.490 5.756 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1Cl 499943252 HYSUBOFIUITPED-IGCXYCKISA-N 379.674 5.131 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2c1 504555026 OEIUUURRAKJZLP-KRWDZBQOSA-N 399.475 5.221 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(NC(=O)[C@@H](C)CC)c1 505028361 CJIVYMWYFRWYQJ-KRWDZBQOSA-N 379.504 5.112 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H]1CCC[C@@H](C)C1 510858891 GFWCPCKGDCFSNE-APWZRJJASA-N 377.488 5.701 30 20 GKED Cc1ccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c(OCc2ccccc2)c1 511500101 VWWFMVIRXFLKIV-GOSISDBHSA-N 385.467 5.328 30 20 GKED N#C[C@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(F)cc1 511700799 ZFLBPMMZZDHOGW-NRFANRHFSA-N 376.456 5.113 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3nc(C)ccc3o2)cc1 511937942 ATFSIUOAXJMSHX-UHFFFAOYSA-N 399.406 5.061 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)c1 512558587 FTCCDXMZJAJUJF-XMMPIXPASA-N 387.483 5.705 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)Nc1ccc(C#N)cc1 517865836 QNEULAOTKJAHCE-CYBMUJFWSA-N 380.448 5.012 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1 518028919 ASLNPGTUENIZGT-ROUUACIJSA-N 380.513 5.030 30 20 GKED Cc1ccc(Oc2ccccc2CNC(=O)N(C)Cc2ccc(C#N)cc2)cc1 518541031 PMYUIGCRDGKFPA-UHFFFAOYSA-N 385.467 5.001 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)CCO3)cc1Cl 521473768 RXFAWYQPCVYFHO-HXUWFJFHSA-N 388.854 5.183 30 20 GKED CC(C)(C)c1ccc(Oc2ccc(C(=O)N(CC#N)c3ccccc3)cn2)cc1 525479210 SAHKCULNSCAEEL-UHFFFAOYSA-N 385.467 5.342 30 20 GKED CC1(C)[C@H](c2cccc(F)c2)CCN1C(=O)Nc1ccc(CC#N)cc1Cl 529108937 RAZUHUULRUVMQU-KRWDZBQOSA-N 385.870 5.345 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(Br)ccc2Cl)c(C#N)s1 533807464 NDVMNMDIRKXEFG-UHFFFAOYSA-N 397.725 5.585 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 534756981 JRUHFOPWOLWSHV-UHFFFAOYSA-N 394.434 5.518 30 20 GKED COc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(C#N)c(F)c2)cc1 540707660 BMYJJCDUJBDXIU-INIZCTEOSA-N 376.431 5.349 30 20 GKED N#CCC[C@@H](NC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1 543068049 DFIGBDHUCKTMLB-GOSISDBHSA-N 388.298 5.327 30 20 GKED N#CCCCOc1cccc(N[C@H](c2cccnc2)c2ccc(F)cc2F)c1 543424917 JBYVWBFMADIJQI-JOCHJYFZSA-N 379.410 5.244 30 20 GKED N#CCCSc1ccccc1NC(=O)CCSc1cccc(Cl)c1 554714211 TZJNTSUOWLZBFX-UHFFFAOYSA-N 376.934 5.467 30 20 GKED COCC(C)(C)CCCNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 558306988 URARKLFIVIOEAZ-UHFFFAOYSA-N 395.503 5.233 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)C1(c2cc(F)cc(C#N)c2)CC1 561382924 SISVXMGQNYCQKT-HUUCEWRRSA-N 384.882 5.033 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(Cl)cncc1Cl 567057799 RMQOIUDDLZQEIC-UHFFFAOYSA-N 398.249 5.613 30 20 GKED Cc1c(C(=O)N[C@H](C)c2nc(C3CCCCC3)no2)sc2ccc(C#N)cc12 568071916 BVTYABJOLAQXCO-CYBMUJFWSA-N 394.500 5.003 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 580319628 RLORSLLRLBDYGN-QHCPKHFHSA-N 398.466 5.423 30 20 GKED N#Cc1cc(NC(=O)c2occc2CSc2ccccc2)nc2ccccc12 582205161 AHIDGTDKEDTYIJ-UHFFFAOYSA-N 385.448 5.244 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CC1(C(F)(F)F)CC1 588866710 QTXBEAXHKKFNON-UHFFFAOYSA-N 390.380 5.272 30 20 GKED C[C@@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)CCCCCC#N 588940027 WNARZPJVPFIDGU-ZDUSSCGKSA-N 379.291 5.212 30 20 GKED CC[C@H](C)c1nc(C)c(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1 593976471 WRTBTJGUPZKOJU-GJZGRUSLSA-N 396.560 5.182 30 20 GKED CSCC1(CCNC(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1 597981564 LWHJWAGGPUGWSP-UHFFFAOYSA-N 396.581 5.114 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604461375 MNHSCJPNIFZBPZ-INIZCTEOSA-N 389.430 5.715 30 20 GKED CC1(c2ccccc2)C/C(=C/c2cncs2)C(=O)/C(=C\c2cncs2)C1 606442426 HPJGEXVGRSDPLK-DUGOVBPYSA-N 378.522 5.387 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc(C#N)cc1 609254154 JDQQDSDOTSSJJC-NSHDSACASA-N 383.320 5.095 30 20 GKED CCCN(C(=O)c1cc(C(C)C)n(C(C)(C)C)n1)c1cc(Cl)ccc1C#N 609286357 VOXDJVUVIUBLSE-UHFFFAOYSA-N 386.927 5.343 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc3ncccc23)cc1 609296538 YACGNJVRGFYWNC-UHFFFAOYSA-N 383.382 5.290 30 20 GKED Cc1ccc(-c2ccsc2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609377636 IYBAGNKHZFANRD-INIZCTEOSA-N 392.549 6.228 30 20 GKED Cc1cccc2c1N(C(=O)c1cccc(COc3cccc(C#N)c3)c1)CCC2 609641484 YWINYICBLZBGGS-UHFFFAOYSA-N 382.463 5.039 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609682694 QODYHSDAQDPVCQ-NQIIRXRSSA-N 397.478 5.760 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N[C@@H](C)c1cccc(C#N)c1 610361831 LDZRODHPFRXFDM-RYUDHWBXSA-N 379.312 5.223 30 20 GKED C[C@@H](N[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)c1cccc(C#N)c1 610755232 VPYGVYRUHIPSCN-VXGBXAGGSA-N 387.270 5.327 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@H](c2cc3ccccc3[nH]2)C1)c1ccccc1 610972593 KCFCSVXDOCLUFD-SFTDATJTSA-N 386.499 5.102 30 20 GKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 613392488 ULARGSLFGMZRRS-SFHVURJKSA-N 378.522 5.801 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 613836954 SFLQAVAFEAPAJY-GFCCVEGCSA-N 379.312 5.084 30 20 GKED C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622879342 MDKIQXHUCXTETH-JOYOIKCWSA-N 389.286 5.144 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C 660666713 XCVXLSSMWZJNPX-RYQLBKOJSA-N 397.544 5.081 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)cc1Br 678173226 VXBKOFSHEWJEDH-INIZCTEOSA-N 379.257 5.104 30 20 GKED N#Cc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 725845918 PKJMECOELDRUIM-UHFFFAOYSA-N 393.830 5.202 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ccc(O[C@H](C)C#N)cc1 728699473 VJORRKGINGXZIX-FWLQQBITSA-N 392.455 5.445 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2ccccc2)C2CCC2)cc1 729552363 FPQSMSMOQORWDG-RPBOFIJWSA-N 395.506 6.005 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416169 BKCMSTCUYIXFPL-IRLXHUAMSA-N 394.471 5.502 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1-n1cccc1 730416222 BWFDGGQKCKEJHO-MRXNPFEDSA-N 375.428 5.025 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CCCC1)c1nc2cc(F)ccc2s1 730417082 KKFAEHSEIJZKMI-MRXNPFEDSA-N 382.435 5.263 30 20 GKED CC[C@@](C)(NC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 730818513 MWJSSYXVMHYYJF-JOCHJYFZSA-N 390.512 5.052 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1csc2ccccc12 731113966 AOTBWLLSYLCUMY-CABCVRRESA-N 395.553 6.036 30 20 GKED N#Cc1ccc(C(=O)O[C@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 731994985 YPJBWONTGOVUKZ-OAHLLOKOSA-N 398.178 5.171 30 20 GKED C=CC[C@H](NC(=O)N[C@H](CCC)c1ccc(Cl)c(Cl)c1)c1ccncc1 734664409 VPOWMEHZHYMSGZ-RBUKOAKNSA-N 392.330 5.846 30 20 GKED C=CC[C@H](NC(=O)NCc1ccccc1Oc1ccccc1C)c1ccncc1 734668284 AKYBLEDIKBGQHX-NRFANRHFSA-N 387.483 5.299 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NNc1cccc(C(F)(F)F)n1 739421677 OSDJEQPLMNVJKY-UHFFFAOYSA-N 393.800 5.002 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1csc(-c2ccc(C)cc2)n1 741842084 RISDJYIBPFYHHS-ZHACJKMWSA-N 397.471 5.179 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2ncc(-c3ccccc3Br)o2)cc1 741842375 KHQDFDULMOUBAV-SXGWCWSVSA-N 385.648 5.713 30 20 GKED C[C@@H](ON=Cc1ccccc1OC(F)F)c1nc(-c2ccc(Cl)cc2)no1 744443278 JOVNFGSFBTYMLB-LLVKDONJSA-N 393.777 5.103 30 20 GKED C[C@H](ON=Cc1ccccc1C(F)(F)F)c1nnc(-c2cccc(Cl)c2)o1 747826294 HFEXFXGMVAKXNX-NSHDSACASA-N 395.768 5.521 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCc3ccccc3C2)cc1 749423093 PLHUCWCHZYDFFR-BJKOFHAPSA-N 381.479 5.021 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(Cl)cc2Cl)cc1OC 750895304 FUZGLQRSJRZFJN-VMPITWQZSA-N 381.255 5.305 30 20 GKED COc1cccc([C@H](C)CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 753198999 QRDOSWXXUOQBIR-KOSHJBKYSA-N 384.479 5.483 30 20 GKED Clc1cc(Cl)c(NN=Cc2cnc([C@H]3CCCO3)s2)c(Cl)c1 755465625 LVUMRDQCKZHCEE-GFCCVEGCSA-N 376.696 5.401 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2csc([C@H]3CCCO3)n2)s1 755618439 LELHFIVGPQMCFY-CQSZACIVSA-N 394.566 5.001 30 20 GKED CCc1ccc(CCC=Nn2cnnc2SCc2ccc(Cl)cc2)cc1 758096589 MSSKQUMMCFRCSW-UHFFFAOYSA-N 384.936 5.253 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(NC(=O)C(C)C)cc2)cc1 764744025 QONIQNUTMHNTCK-QGZVFWFLSA-N 386.923 5.263 30 20 GKED C=CC[C@H](N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccncc1 766017330 ABGITQBGKHLCCP-KUHUBIRLSA-N 383.948 6.135 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)C1 766616497 HUHUMUJHFGRWTQ-SQNIBIBYSA-N 384.545 5.628 30 20 GKED O=C(/C=C/c1nc2ccc(Br)cc2s1)c1cc(F)ccc1F 773122826 AEDSUAQZPBTYOR-AATRIKPKSA-N 380.213 5.233 30 20 GKED CC(=O)N1C/C(=C\c2cccc(Oc3ccccc3)c2)C(=O)c2ccccc2C1 778519959 MEADKNMRJZXVNZ-KGENOOAVSA-N 383.447 5.107 30 20 GKED Cc1cccc2nc(C3CCN(Cc4cc(Cl)ccc4OCC#N)CC3)oc12 782000996 ZQVQYRRDABPMKC-UHFFFAOYSA-N 395.890 5.072 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)c1cc2c(ccc3ccccc32)o1 788030626 PWCUNNMKIUBZTD-UHFFFAOYSA-N 385.452 5.336 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)Nc1ccsc1 790313963 XHKWTRHEJDEQTF-UHFFFAOYSA-N 381.501 5.471 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1 792093406 ICRRTUHDOUPFHE-IBGZPJMESA-N 387.439 5.072 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 793042053 FNWBDRSOYGEOTD-UPVQGACJSA-N 379.463 5.368 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc2ccc(C(F)(F)F)nc2c1)c1ccccc1 796663554 JUGAZZXMJMSQDK-INIZCTEOSA-N 384.357 5.247 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccc(N3CCCCCCC3)c(F)c2)CC1 799410622 XBMXCUDQWOKNPF-UHFFFAOYSA-N 386.515 5.048 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 802077170 KTHDLYSVWJOZLG-GUYCJALGSA-N 394.471 5.254 30 20 GKED N#CCCCCCC(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 805858480 RLDIWUJRJVCHTB-XDHFQJGLSA-N 381.545 5.261 30 20 GKED CC(C)Oc1ccc(-c2nc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)cs2)cc1 809089050 MYTVMXMUPLCWMM-IYBDPMFKSA-N 384.501 5.084 30 20 GKED C#C[C@@H](NC(=O)Nc1cc(-c2cccnc2)ccc1C)c1ccc(Cl)cc1 810226633 HUHZDQGBCDFFCL-HXUWFJFHSA-N 375.859 5.206 30 20 GKED FC(F)(F)c1cc(NN=C2CCCC23CCCC3)nc(-c2ccccn2)n1 814847986 LGUWVLPICWXJFB-UHFFFAOYSA-N 375.398 5.070 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccc(C(F)(F)F)c1 819440318 QGWYIRISWDTKOF-GUYCJALGSA-N 380.435 5.245 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 861398619 NFVKTXXCPCCKLN-UHFFFAOYSA-N 375.513 5.552 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1cnc(Cl)c(Cl)c1 914515566 WFZZETVGANUGIV-UHFFFAOYSA-N 382.250 5.107 30 20 GKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1sccc1Br 915113709 STJXUALRIZEUTR-VOTSOKGWSA-N 376.300 5.530 30 20 GKED Cc1ccc(NC(=S)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1C 916001013 YEEIOTFYKCJDPU-UHFFFAOYSA-N 387.508 5.563 30 20 GKED Cc1ccc(C=Nn2c(C)nc3scc(-c4ccc(Cl)cc4)c3c2=O)cc1 916272942 NYUGNDRFCZQEGO-UHFFFAOYSA-N 393.899 5.277 30 20 GKED N#C[C@H](C(=O)C1c2ccccc2Oc2ccccc21)c1nc2ccccc2s1 916626986 LPOLXXFASZSLPH-MRXNPFEDSA-N 382.444 5.410 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2c(F)cccc2s1 916917225 GKKPLBCGGBDPIE-MRXNPFEDSA-N 388.423 5.155 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1ccccc1Oc1ccccc1 918164313 RJESTGOGJNQKRW-UHFFFAOYSA-N 392.499 6.003 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)CO2 1776374732 VPQIDJQLYCBVRK-WQRHYEAKSA-N 388.419 5.427 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)C(C)(C)C(C)(F)F)cc2)CCC1 1786456228 VFAVKSOFEOMAED-HNNXBMFYSA-N 392.490 5.014 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2CCC[C@H]2c2ccccc2)c1=S 14308363 JXYUAPLLAWMTPQ-FQEVSTJZSA-N 394.519 5.201 30 20 GKED C[C@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(C#N)CC1 57876042 FTMWQCIXFNQOSK-MRXNPFEDSA-N 378.907 5.035 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](CC(C)(C)C)c1ccccc1 63402203 KAIMXRXZZNKXOB-JOCHJYFZSA-N 375.516 5.433 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1c(C)noc1C 66788873 RCKFFBUHAXXJOP-FQEVSTJZSA-N 375.428 5.088 30 20 GKED N#CCCCOc1cccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1 102598666 VGTLGPXFPMEFCI-QJOMJCCJSA-N 385.423 5.261 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1 104974714 HHRKLSSHJYXDRB-UHFFFAOYSA-N 377.488 5.065 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(C3CCC3)nn2-c2ccccc2)c1 120666406 JEQJCMNOYHNTSO-UHFFFAOYSA-N 388.496 5.008 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 137457248 ONSNEKRVFVJPKQ-NQIIRXRSSA-N 393.556 6.067 30 20 GKED CN(CCC#N)c1ccc(CNc2cccc(NC(=O)C3CCCCC3)c2)cc1 152390654 APRVNKRXAXBKGZ-UHFFFAOYSA-N 390.531 5.167 30 20 GKED CC(C)Oc1ccccc1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 155493333 LRVHMDZPXIXGMJ-OAHLLOKOSA-N 384.888 5.156 30 20 GKED N#CCCCCS(=O)(=O)Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 173951425 NNAYHXLRXMQZIU-UHFFFAOYSA-N 398.311 5.394 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1cc(Cl)cc(C(F)(F)F)c1 184561787 JSKDWOLNKWIQOT-UHFFFAOYSA-N 399.825 5.025 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 255621731 VCIIOEJDAAMNNN-WUKNDPDISA-N 385.467 5.128 30 20 GKED COc1ccccc1[C@@H](Nc1c(C#N)cnc2c(C)cc(C)cc12)c1ccccn1 301870897 KDIKGHZELZXMKY-RUZDIDTESA-N 394.478 5.328 30 20 GKED C[C@@H]1CCCC[C@H]1/N=C(/O)C1CCN(c2noc3ccc(Cl)cc23)CC1 328729986 FVHLRFAJDYWWKB-CXAGYDPISA-N 375.900 5.233 30 20 GKED CC(C)c1csc(C/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)n1 329255722 ARBQHSFBPANWQD-MRXNPFEDSA-N 386.565 5.230 30 20 GKED Cc1nn(CC(C)C)c(C)c1C/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329499462 JZPDAGQOIIQNMS-NRFANRHFSA-N 397.567 5.044 30 20 GKED Cc1noc2nc(C3CC3)cc(C(O)=Nc3ccccc3N3C[C@H]4CC[C@H]3C4)c12 329863774 SEKKZISVYBSCDN-HOCLYGCPSA-N 388.471 5.034 30 20 GKED CCO[C@H](C)c1ncc(/C(O)=N/[C@H]2CC3(CCCC3)Oc3ccccc32)s1 330172543 XZPVYDRJVWITMF-ZBFHGGJFSA-N 386.517 5.382 30 20 GKED Cc1ccc(N=C(O)N2CC[C@]3(C)[C@H](C2)C3(F)F)cc1N=C(O)C(C)(C)C 330335861 RXULSNCPWGROCE-HNAYVOBHSA-N 379.451 5.152 30 20 GKED C[C@@H](NCc1cnc([C@H]2CCCO2)s1)c1ccc(-c2cccc(C#N)c2)cc1 374696867 ZAPDKCHSMMGKOZ-OPAMFIHVSA-N 389.524 5.384 30 20 GKED CCCCCCCCCC(=O)N1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 377469273 IVYXEAPMXDIAKJ-QZTJIDSGSA-N 377.529 5.115 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OC2CCCC2)cc1)c1ccccc1 432701149 ZAIPSAMJBJQRFO-QFIPXVFZSA-N 377.488 5.565 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)Nc1ccc(F)cc1C#N 433974967 DCIOSOBGVCKWLA-NSHDSACASA-N 385.851 5.018 30 20 GKED COC(=O)[C@@H](Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1Cl 439544993 UQPHLDPIRQUWIU-KRWDZBQOSA-N 377.271 5.121 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)c1ccc(C#N)cc1 439929768 DENGWLCMVIAYQS-UHFFFAOYSA-N 398.249 5.329 30 20 GKED Cc1sc(Br)c(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1C 442558402 ZDYASIMKHFSKOW-AWEZNQCLSA-N 385.286 5.166 30 20 GKED N#C[C@@H]1CCC[C@H](N[C@@H](CC(F)(F)F)c2ccc(Br)cc2)C1 446764918 AOYJFTQZYOQXCJ-UGFHNGPFSA-N 375.232 5.115 30 20 GKED Cc1cc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)ccc1C#N 447285441 AENZNROQLJTESD-UHFFFAOYSA-N 389.528 5.318 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)N[C@H](c1cc(F)ccc1F)C(F)F 447720856 SXYUCUISWCJAQJ-CZUORRHYSA-N 393.302 5.123 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C2CC2)o1 458809102 ZVYIQMZPOLTUIM-YHYVQYDKSA-N 391.515 5.512 30 20 GKED Cc1nc(N2CCC[C@H]2c2nc3ccccc3n2C(C)C)c(Cl)cc1C#N 461952493 AZCQNLFNSQEBKI-IBGZPJMESA-N 379.895 5.187 30 20 GKED C[C@@H](C(=O)N(C)[C@H](c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 464272914 PQJPXBHJQRBQBX-SJKOYZFVSA-N 380.797 5.077 30 20 GKED N#Cc1cc(NC(=O)CC(F)(F)F)ccc1Oc1ccc(C(F)(F)F)cc1 464299972 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N#Cc1ccc(C(F)(F)F)nc1SCc1ncc(-c2ccccc2F)o1 488739470 WJICBSQBNXEQKA-UHFFFAOYSA-N 379.338 5.058 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1C 488894466 UJPGEAXLMOYHGX-HNNXBMFYSA-N 380.473 5.201 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cs1 495229961 CZMMRLVASMKDOX-UHFFFAOYSA-N 377.469 5.077 30 20 GKED N#CCc1ccc(NC(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1 502359959 OBAWNUUIFDFYNB-UHFFFAOYSA-N 390.874 5.662 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)c1 503066327 XGJQEFSHSXSSDG-QZTJIDSGSA-N 395.409 5.012 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCCO[C@H]2CCCc3ccccc32)cc1 506727387 YMDXVHYJOAJKIY-QFIPXVFZSA-N 391.515 5.094 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cnn1-c1ccccc1 509674025 SLVJYLJIWNMQCT-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2ccc(Cl)s2)cc1 510659800 SOKDZEVIQRNHOW-UHFFFAOYSA-N 383.860 5.387 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)N(C)Cc2ccc(C#N)cc2)c1C 515797423 ZXXRODDSXRMIHY-UHFFFAOYSA-N 386.455 5.026 30 20 GKED COc1ccc(-c2noc(-c3cccc(Oc4ccc(C#N)cc4)c3)n2)cc1OC 517622625 MPISEKYHTHPVJK-UHFFFAOYSA-N 399.406 5.085 30 20 GKED C=CC1CCN(C(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)CC1 517656307 CQAMPOFGZMSZIN-UHFFFAOYSA-N 393.874 5.095 30 20 GKED COCc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)oc2ccccc12 518232802 WUQVFNJPDKAFFQ-UHFFFAOYSA-N 398.418 5.495 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3Br)cc2)cc1 520610559 FCAKADJIFRQBFD-UHFFFAOYSA-N 393.240 5.365 30 20 GKED CCc1cccc(CC)c1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 524492855 OAROXAPYUPSWCS-UHFFFAOYSA-N 384.479 5.514 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)CCc2ccc(C#N)cc2)cc1 525529007 MMZIPRKRIWAQHB-IBGZPJMESA-N 398.506 5.386 30 20 GKED N#CC1(C(=O)NCc2ccc(Oc3cccc(Cl)c3Cl)cc2)CCC1 525610184 QMKGRDLJGQENQS-UHFFFAOYSA-N 375.255 5.096 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1ncc(-c2ccc(Cl)cc2)o1 530733436 CZTBRKPYSFCRAD-UXHICEINSA-N 377.875 5.267 30 20 GKED C=C[C@H](CC(=O)N(C[C@@H]1CCCO1)c1nc2ccccc2s1)c1ccccc1 536215594 URWRCORVKFKUBN-MJGOQNOKSA-N 392.524 5.168 30 20 GKED C[C@@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2cccc(C#N)c2)cc1 543871221 XUTLZQVLIUENGD-MRXNPFEDSA-N 375.541 5.830 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(-c2ccc(Br)s2)s1 543912242 JSFTYALCZLCTKT-UHFFFAOYSA-N 395.347 5.005 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 544527609 ABLGAHUMIXBYBZ-LEWJYISDSA-N 391.408 5.048 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(Cc3cscn3)no2)c1 544987932 IPNYELJKIOLVPZ-UHFFFAOYSA-N 394.843 5.101 30 20 GKED CC(=O)c1cc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)cs1 556028700 SBDUDSLGIPVPBN-UHFFFAOYSA-N 392.455 5.117 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN1CC(C)(C)[C@H]1c1cccs1 558175795 JUXFMBRNAZHDQG-FOIQADDNSA-N 399.585 5.021 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(Oc3cccnc3)cc2)cc1OC 561748946 REDCUFZKJZDHPL-SFHVURJKSA-N 390.483 5.298 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccoc3C(F)(F)F)c2)c1 563783941 YVPQIRZCUAZXQO-UHFFFAOYSA-N 386.329 5.001 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2cc(C#N)ccc2NC2CC2)s1 566577578 NMKRHASPASEPLX-UHFFFAOYSA-N 388.496 5.125 30 20 GKED Cc1c(C(=O)Nc2cccc(OCc3ccccn3)c2)sc2ccc(C#N)cc12 571468329 UYGXLCBENFRNQT-UHFFFAOYSA-N 399.475 5.308 30 20 GKED C=CCC[C@H](N[C@@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 572020917 MJUKHYLAWMJZMS-PMPSAXMXSA-N 381.360 5.412 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC(C)(C)[C@H]2C2CC2)cc1 573007852 MBUZMHWIMGEQTO-OAQYLSRUSA-N 391.471 5.011 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccccc2Cl)CC2CC2)cc1 580229466 BJSODDPIMADIOH-UHFFFAOYSA-N 381.907 5.585 30 20 GKED N#Cc1cscc1C(=O)N1CCC(CCc2cccc(C(F)(F)F)c2)CC1 582643333 SNGPILUFVTYLSW-UHFFFAOYSA-N 392.446 5.124 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C)c1 589382009 IIODJMWRQHMMBS-UHFFFAOYSA-N 381.863 5.041 30 20 GKED N#CCCCCCC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 592678816 GCNHEOJYFPFMIF-UHFFFAOYSA-N 384.295 5.389 30 20 GKED COc1cccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c1OC 602292920 PWKZXFUVLKHLDQ-ZDUSSCGKSA-N 398.528 5.040 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@H]2c2cccc(Cl)c2)c1C 603853692 HJQTWCHSOSEZNR-QFIPXVFZSA-N 395.934 5.041 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc2nnc(-c3cc(Cl)cc(Cl)c3)n2n1 609132480 CSLGFCSNZRPMNN-UHFFFAOYSA-N 396.237 5.071 30 20 GKED N#CCn1c(C(=O)Nc2nc(-c3ccccc3Cl)cs2)cc2ccccc21 609215601 PAEPZCCZNFFMBL-UHFFFAOYSA-N 392.871 5.194 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2F)c2ccc(F)cc2)cc1 609230379 FKPFKPCHPWMPOB-UHFFFAOYSA-N 394.446 5.162 30 20 GKED Cc1ccc(-c2ccncc2)cc1NC(=O)CCCCOc1cccc(C#N)c1 609503741 LMGOCOYZPFDUOK-UHFFFAOYSA-N 385.467 5.117 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ncoc3-c3ccccc3)cc2)c1 609558589 OMUUBYVOXXEXKY-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(Br)cc3)cc2)CCCC1 609613895 OMWOCDAXWLONAT-UHFFFAOYSA-N 385.261 5.264 30 20 GKED Cc1oc2nc(SCCC(C)(C)C#N)nc(NC(=O)c3ccccc3)c2c1C 610166861 UHOIQPIEJQUAPX-UHFFFAOYSA-N 394.500 5.124 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1F 611905403 ARVZZEGAHQHSBL-UHFFFAOYSA-N 399.224 5.573 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)CCCc1ncc(-c2ccccc2)o1 615971245 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C=CC[C@H](NC(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)c1ccncc1 746898524 KMEOEAUXQNOFBG-FQEVSTJZSA-N 387.414 5.076 30 20 GKED CC(=NNc1ccc(OC(F)(F)F)cc1)c1sc(-c2cccnc2)nc1C 747612292 ZSSKOQXLASLYLA-UHFFFAOYSA-N 392.406 5.248 30 20 GKED Cc1ccsc1[C@@H]1C[C@@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 748833485 CRQNPUWNLRQCAH-XHSDSOJGSA-N 398.940 5.813 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(SCc2ccccc2)cn1 754185964 PUYMFAHODDSYGO-UHFFFAOYSA-N 391.521 5.242 30 20 GKED Cc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(C#N)c(C)c3)s2)cc1 766488704 BFPBSDUCDDKCHO-LICLKQGHSA-N 394.887 5.016 30 20 GKED COc1ccc(/C=C/C(=O)c2coc3ccccc23)c(OCc2cccnc2)c1 766492106 VBXDNFJARUVAEF-PKNBQFBNSA-N 385.419 5.312 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)/C=C\c3ccc4ccc(Cl)cc4n3)CC2)cc1 767976821 AEUUIVKAVWMNIU-KTKRTIGZSA-N 399.881 5.089 30 20 GKED CC(C)Cn1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C1CC1 768316243 BCLXEFFGBZBSLR-QFIPXVFZSA-N 398.510 5.324 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3cccnc3)CC2)cc1 768867844 JRGSBHCQSLLSES-XMMPIXPASA-N 396.494 5.149 30 20 GKED CCCCCCCCN(Cc1ccccc1)C(=O)Nc1c(C)ccn(C)c1=O 777601282 YEPPWCAEUXRBIO-UHFFFAOYSA-N 383.536 5.088 30 20 GKED C=CC[C@@H](OC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)c1ccccc1 778738833 JEWAISJFNBSSCC-GOSISDBHSA-N 388.423 5.276 30 20 GKED C=CC[C@@H](N[C@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccncc1 790679786 VUPQMZXTRYKRCZ-SJKOYZFVSA-N 399.254 5.831 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 793283364 ZSIMQMQAJONXEN-RDJZCZTQSA-N 397.400 5.094 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)C[C@H](CC#N)c1ccccc1 793733745 WXVTZUFOOHUVBY-SFHVURJKSA-N 393.487 5.368 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(OCc3cccc(F)c3)cc2)c1 796990944 IUOHQRDGGQIBFS-RAXLEYEMSA-N 389.426 5.259 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2ccc(C3SCCCS3)cc2)cc1 809257880 RCXCGVSUAJJXBX-LJQANCHMSA-N 382.554 5.112 30 20 GKED Cc1c(NCc2ccccc2C(C)(C)C#N)cccc1NC(=O)OC(C)(C)C 863356505 BYPLFTWFMMIXQA-UHFFFAOYSA-N 379.504 5.755 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1nc(-c2ccccc2)cs1 917024863 BFETUHSUIIDPGE-HXUWFJFHSA-N 398.487 5.879 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2sccc2s1 918486997 IADUWZZNRUAVJC-CQSZACIVSA-N 382.510 5.049 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@H]1C[C@H]2CC[C@H]1C2 920078282 AJMSDURCABITEI-FIKGOQFSSA-N 377.513 5.134 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1cc(C)c2cc(C(C)C)ccc(C)c1-2 1776049654 OSANCBWCRKOFPC-UHFFFAOYSA-N 390.483 5.684 30 20 GKED Cc1ccc(Cl)cc1NN=Cc1cccc(OCc2cccc(C(=O)O)c2)c1 1776106381 CLWHUDQAYXFRIW-UHFFFAOYSA-N 394.858 5.372 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=Nn2c3ccccc3c3ccccc32)C1 1776112782 KJBZGJHMEUXKLX-UHFFFAOYSA-N 388.854 5.468 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)cc1 1776125832 UASRDBSRHWJMLJ-AAKUMTKESA-N 398.474 6.015 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C/C(=O)c1cccc(OCC(=O)O)c1 1776398866 MKHKZNWIIXAOTR-POLRJCGMSA-N 390.357 5.011 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1-c1ccc(C)cc1C 1776783993 RWAXIVHBLPMYLC-QFIPXVFZSA-N 381.560 6.264 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cnc(-c2ccccc2F)s1 1776785680 RIRUBDODBPPXTD-HNNXBMFYSA-N 378.513 5.243 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1sc2cc(Cl)ccc2c1Cl 32615436 MYIIHSDFGCCDCR-UHFFFAOYSA-N 375.280 5.352 30 20 GKED CCN(C(=O)CCc1ncc(-c2ccc(C)cc2)o1)[C@H](C)c1ccc(C#N)cc1 45500778 MEIXPZPJKLVPGE-GOSISDBHSA-N 387.483 5.064 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(C)cc2)cs1 54894951 PXCDBJKLNWVMGV-RAXLEYEMSA-N 376.481 5.341 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cccc2cccnc12 56470059 LTHATHWILIMAIH-UHFFFAOYSA-N 393.446 5.388 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)CCC2)c1nc(-c2c(F)cccc2F)cs1 64714666 DPXLNSIXLFSKDG-HNNXBMFYSA-N 380.419 5.067 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 66800234 MQVJKLUNBCYVHR-HNNXBMFYSA-N 389.524 5.427 30 20 GKED CCn1cc(CC(=O)Nc2ccccc2S[C@H](C)CC#N)c2ccccc21 66801949 FYKGWXVUOMJPQY-MRXNPFEDSA-N 377.513 5.237 30 20 GKED CCCCCCCCOc1ccc(OCCCCCCCC)c(C#N)c1C#N 100313552 GKGPSCRTAALNMD-UHFFFAOYSA-N 384.564 6.909 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1nc2ccccc2s1 108145835 VFPMPACPFMDKJP-CYBMUJFWSA-N 399.566 5.279 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1ccccc1F 108147823 IGRJKQKQJRKGDX-LSDHHAIUSA-N 388.533 5.510 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccccc1SCCC#N 108201659 YCDZCDMOQMSMNP-QGZVFWFLSA-N 380.513 5.150 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 108530986 DRLQPXASSDPPMJ-HRAATJIYSA-N 393.556 5.924 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 121342032 OLZFYWGQFKBTMI-SFHVURJKSA-N 375.394 5.348 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2ccc(C)c(C)c2)cc1 127585468 MEDYAAHSZKRRSF-UHFFFAOYSA-O 389.544 5.259 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)N[C@H](CCC#N)c3ccccc3)c(C)c2c1 132807792 GPVNHXRYIPEHIX-OXJNMPFZSA-N 391.471 5.155 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cc(Cl)ccc2C1 192217364 IDUKOHDTHPXYCG-CQSZACIVSA-N 385.920 5.324 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246106607 OHILSMWCDAJNMN-BZUAXINKSA-N 377.579 5.219 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1)C1CC1 271548103 ZYNJYQRVVBVBRL-UHFFFAOYSA-N 389.952 5.248 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301767148 WQESQFFJFCLVDO-QZTJIDSGSA-N 380.900 5.834 30 20 GKED Cc1nc(-c2cccc(NC(=O)[C@H](Oc3ccccc3C#N)C(C)C)c2)cs1 302953149 KPQVAXMDKYICLC-OAQYLSRUSA-N 391.496 5.032 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccccc1Oc1ccc(Cl)cc1Cl 303099512 GXKBQSTZOSLNQN-CYBMUJFWSA-N 377.271 5.407 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Nc1ccc(-c2csc(C)n2)cc1 303576071 ZHJTYCSJHSKRNT-HNNXBMFYSA-N 397.569 5.195 30 20 GKED C[C@@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)c1ccc(C#N)cc1 303707855 PGBXFDSKSGQERN-GOSISDBHSA-N 396.519 5.583 30 20 GKED O=C1CC[C@H](/C(O)=N/[C@H]2CC3(CCCC3)Oc3ccccc32)c2ccccc21 328850712 ZGNBALOOYGNUOZ-ICSRJNTNSA-N 375.468 5.540 30 20 GKED CN1CCC[C@H](C/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)[C@H]1c1cccs1 328852670 VUCHRFDFHUJJOK-BEFAXECRSA-N 397.544 5.015 30 20 GKED O/C(=N\C1CCCCC1)N1CCC(/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 329024345 UTWAWGQNPJKYMS-DZFGPLHGSA-N 389.584 5.261 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H](CC2CC2)c2cc(F)cc(Br)c2)CC(O)=N1 330284137 XCAVYJNQMVGDIO-HICWGWBUSA-N 397.288 5.141 30 20 GKED O=[N+]([O-])c1cc(C(F)(F)F)ccc1/C(O)=N/[C@@H]1CCC[C@H](C(F)(F)F)C1 330929567 YUAHHMMWRKIGSC-WCBMZHEXSA-N 384.276 5.039 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N2CCC(C#N)(c3ccccn3)CC2)cc1 374376476 DWFUFAZGFFBOSP-UHFFFAOYSA-N 394.544 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@H]1C1CCOCC1 425663405 LLUNBIKTBXLUDC-JOCHJYFZSA-N 382.548 5.352 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1 428856959 PTRYGVHXHVDOQZ-UHFFFAOYSA-N 377.488 5.230 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC[C@H]4CCC[C@@H]43)cc2Cl)c1 429428816 JPLQSOMJEYQYEX-XLIONFOSSA-N 395.890 5.197 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1[C@@H](C)[C@@H]1c1ccccc1 430392851 KIEGSKZSYUNHFV-KNXBSLHKSA-N 383.451 5.042 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2-c2ccccc2C#N)s1 430589773 BIEPSGPMIDZDDG-LJQANCHMSA-N 385.492 5.469 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc(-c3ccc(F)cc3)n2)s1 430642236 OEYYVMGIBGUUGB-CYBMUJFWSA-N 385.489 5.193 30 20 GKED CCC(CC)n1nccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 431779307 SIROGRWJGLVDDQ-UHFFFAOYSA-N 388.471 5.469 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)c1nc2cc(Cl)ccc2s1 435973789 GKEKAAJCTTUCAQ-UHFFFAOYSA-N 399.903 5.033 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)c1ccc(C#N)cc1C 438833952 YTSCMYXBRFHFCT-UHFFFAOYSA-N 398.441 5.120 30 20 GKED N#CC1CCC(CNC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)CC1 442723300 RZWMSONEHZKBMC-LADRWXRNSA-N 393.453 5.272 30 20 GKED N#CC(CCN1CCC[C@H](c2nccs2)C1)(c1ccccc1)c1ccccc1 444603410 SSXDAMOQERKJRA-FQEVSTJZSA-N 387.552 5.222 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1 462049511 OBMRVTWJTACPIQ-IBGZPJMESA-N 388.298 5.158 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1)C(F)(F)F 463805834 NHUUBKLUSCACCK-QMMMGPOBSA-N 396.262 5.169 30 20 GKED O=C(CCC(F)(F)F)Nc1cc(C(F)(F)F)ccc1SCC(F)F 464070023 HTUHPEDBPNGJBR-UHFFFAOYSA-N 381.288 5.344 30 20 GKED N#C[C@@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1cc(C(F)(F)F)ccn1 464467987 OOQUZIMFQAWIHX-MRXNPFEDSA-N 399.397 5.137 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C)c1ccccc1 467105797 XPGSLVKPCVHUHX-JOCHJYFZSA-N 390.527 5.166 30 20 GKED CCc1c(NC(=O)c2cn(CCCC#N)c3ccccc23)cnn1CCC(C)C 469871867 PAVDMYQOZMBACR-UHFFFAOYSA-N 391.519 5.002 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)s2)c(C)c1 474449165 UFILJLHRHCKTSQ-MRXNPFEDSA-N 395.553 5.805 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)cc1 476267193 SKWIJRKOFMTWCK-UHFFFAOYSA-N 389.499 5.259 30 20 GKED C[C@@H](c1nnc(SCCCC(C)(C)C#N)n1-c1ccccc1)N1CCCCC1 476482239 IVJPBMUMFRPWNW-SFHVURJKSA-N 397.592 5.236 30 20 GKED CCC(CC)[C@H]1C[C@H](NC(=O)c2ccccc2Oc2ccccc2C#N)CCO1 479790737 UAMRSYGIMXWSTD-AUSIDOKSSA-N 392.499 5.064 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CCO)c1ccc(Cl)cc1 482156129 CUEZFVRVJCNSMT-FQEVSTJZSA-N 386.923 5.437 30 20 GKED C=CCN(C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1nc2c(s1)CCCC2 482368742 VRJXTMZYRKYRDP-OAHLLOKOSA-N 394.462 5.277 30 20 GKED N#CCCC[C@@H](NC(=O)COC(c1ccccc1)c1ccccc1)c1ccccc1 487416912 DCYFXERBDUCLQC-XMMPIXPASA-N 398.506 5.344 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccccc1 487935768 OLQPBFCSYMAUCW-YADHBBJMSA-N 377.463 5.106 30 20 GKED CC(C)CN(C(=O)c1cc(Br)ccc1Cl)c1ccc(C#N)cc1 499320227 PRVNKOBEANNJSF-UHFFFAOYSA-N 391.696 5.277 30 20 GKED N#C[C@@H](C(=O)c1ccc([C@H]2CCCOC2)cc1)c1nc(-c2ccccc2)cs1 505435266 UHJZVNFXOIZWLL-PMACEKPBSA-N 388.492 5.194 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccc(OCc3ccccn3)cc2)CC1 507657263 BMLWKEBWVLRXAC-UHFFFAOYSA-N 397.522 5.154 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 509902520 ZKSQKHWCJRCAJE-UHFFFAOYSA-N 399.494 5.304 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)Cc1c(F)cccc1C#N 510829257 URYADWVCYBLMNJ-KRWDZBQOSA-N 388.442 5.327 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](CCO)c1ccc(Cl)c(Cl)c1 512215249 ZSZUYKWZOSJIFB-LJQANCHMSA-N 377.315 5.008 30 20 GKED COc1ccc2c(c1)CN(C(=O)NCC(C)(C)CCC#N)[C@H](C1CCCCC1)C2 513141652 SWFJPAAGEZQKJH-QFIPXVFZSA-N 397.563 5.042 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(F)cc2)n1)c1nc2ccccc2s1 513681408 BNRVVCJONDBFLD-CYBMUJFWSA-N 379.441 5.049 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)CSCc1ccc(C#N)cc1 515158842 PKIKWPDBTRAHSE-AWEZNQCLSA-N 392.446 5.030 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)Sc1ccc(OC)cc1 515638706 JTYJHCBSGUAGOU-CYBMUJFWSA-N 381.950 5.106 30 20 GKED C[C@@H](NC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)c1ccc(C#N)cc1 520100605 AIOAAKHTNRPLQQ-ZHRRBRCNSA-N 390.870 5.209 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cnn(-c2ccc(F)cc2)c1C(F)(F)F 522041013 OFTHXADLYOIORI-UHFFFAOYSA-N 398.404 5.240 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(C)c(-c2ccc(F)cc2)s1 523257781 KDSSPPKKYCHQBQ-UHFFFAOYSA-N 380.444 5.385 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1F 524391711 ZAQIPHVUHHSHPP-UHFFFAOYSA-N 384.332 5.635 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cccc3nc[nH]c23)c1 524567880 GVWSEDPOKVEJKY-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C[C@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)c(F)c1 525658945 YLRGVATZBQUQOZ-HNNXBMFYSA-N 392.405 5.158 30 20 GKED C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1cc2ccccc2s1 527197838 RJXPYIAUYNKYNM-KRWDZBQOSA-N 375.541 5.088 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCn1ccc2cc(Cl)ccc21 533944289 VRNDPNXXZCFFBV-HNNXBMFYSA-N 397.931 5.718 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnn(C)c3-c3ccccc3)n2)cc1 537076073 QCMUURDKBGXVQU-GOSISDBHSA-N 398.491 5.009 30 20 GKED C=CCC[C@@H](NCc1nc(-c2cccs2)no1)c1ccc(C(F)(F)F)cc1 538229458 QKNDGYISHYDSRV-OAHLLOKOSA-N 393.434 5.614 30 20 GKED C[C@H](C#N)CN(C(=O)c1ccc(-c2ccc(Br)s2)s1)C1CC1 543943979 VMMCHPAIZVGEDM-SNVBAGLBSA-N 395.347 5.003 30 20 GKED N#Cc1ccc(CN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C2CC2)cc1 544111980 KDOZLCFYISNPPP-UHFFFAOYSA-N 399.281 5.080 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1)c1ccncn1 544815863 FCWROIVVPBSFLB-OAHLLOKOSA-N 384.222 5.066 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(-c2nc(C)no2)ccc1C)c1ccc(F)c(F)c1 548162545 AHJVHPWHENVKLE-LJQANCHMSA-N 398.413 5.071 30 20 GKED C[C@H](NC(=O)[C@@H]1CCC(=O)[C@@H](C)C1(C)C)c1ccc(-c2cccc(C#N)c2)cc1 548374515 JMCKOLDYAGOKIZ-JLHGSKIFSA-N 388.511 5.044 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Nc2cccc3cc[nH]c23)cc1 548483348 JUDOAEUMDYWBLX-UHFFFAOYSA-N 396.450 5.457 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@H](NCc1ccc(C#N)cc1F)c1ccc(Cl)cc1)C2 548992825 DJSBCGSAFRDUFG-QNWVGRARSA-N 397.925 5.054 30 20 GKED C[C@@H]1CC(CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@@H](C)O1 558812654 LZUIEBAAPIAAOW-IAGOWNOFSA-N 394.540 5.033 30 20 GKED CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 559867807 VMGNENGVDNXDSR-XMSQKQJNSA-N 378.520 5.302 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cn(C)nc1C1CCCCC1 564174219 WMDMCBWHVXNENT-UHFFFAOYSA-N 393.535 5.030 30 20 GKED O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1cc(C(F)(F)F)ccc1F 570967260 ZSWSEPYPEBOTIZ-UHFFFAOYSA-N 385.666 5.769 30 20 GKED N#Cc1ccc(CNc2cccc(COCc3ccco3)c2)c(C(F)(F)F)c1 580059836 ALZCOONFODXKPM-UHFFFAOYSA-N 386.373 5.499 30 20 GKED COc1ccc(C[C@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccc(OC)cc2)cc1 581303431 ZLQTWSRVNJIIMJ-UIOOFZCWSA-N 398.506 5.136 30 20 GKED C[C@@]1(CCNC(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1(F)F 598215890 MOTSQWVWNCRLLU-HXUWFJFHSA-N 386.467 5.016 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1Oc1ccncc1 604690906 NSGLQXXUQBCLKO-KRWDZBQOSA-N 385.448 5.282 30 20 GKED CC(C)CCC[C@@H](C)n1c(SC[C@H](C#N)CCC#N)nc2ccccc2c1=O 608864456 JGGIJFFVHADKOV-MSOLQXFVSA-N 396.560 5.319 30 20 GKED CCCN(C(=O)NCc1ccc(C#N)cc1F)[C@H](C)c1cc2ccccc2o1 609253079 RLBQUNIADCLCPX-OAHLLOKOSA-N 379.435 5.126 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1cc(C#N)ccc1OC(C)C 609261882 HXBYYLZDJWXDFA-FQEVSTJZSA-N 380.488 5.265 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1cccc(C#N)c1 610362128 BMWYLQRGULPNSJ-KRWDZBQOSA-N 397.503 5.213 30 20 GKED C[C@@H](NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 610400922 SNFKLAOOHDNHSK-RTBURBONSA-N 383.495 5.139 30 20 GKED Cc1cncc(C)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 610756081 MGBWNPHBHOONFY-UHFFFAOYSA-N 391.858 5.055 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccc(C(F)F)cc3)cn2)cc1 613199147 WKUZCNQASMPEBQ-UHFFFAOYSA-N 394.381 5.005 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)cc2C)ccc1OCc1ccccc1 614407286 MODKJRLGKPVPHX-IBGZPJMESA-N 386.495 5.305 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3ccc4ccccc4n3)s2)c(C)c1 621676737 QLBNFYURFMQFQI-LJQANCHMSA-N 397.503 5.774 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)c1cc(C(F)(F)F)ccc1F 622292909 QAUVKBPOSSPQJJ-UHFFFAOYSA-N 379.275 5.136 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1C[C@H](C(F)(F)F)CC[C@@H]1C 679526701 OIPBJBFMLXPBSE-WCQYABFASA-N 395.343 5.073 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CN2CCCCCC2)CC1 682777343 MKBKHDLNITVMMF-UHFFFAOYSA-N 397.607 5.658 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)CSc1ccc(C(C)C)cc1 726754411 GLMHCXYIILXBLV-UHFFFAOYSA-N 389.524 5.038 30 20 GKED N#C[C@H](NC(=O)c1cc2c(F)cccc2s1)c1cccc(C(F)(F)F)c1 731645868 TVPXPZBHUSLKDH-AWEZNQCLSA-N 378.350 5.054 30 20 GKED COc1cccc(O)c1C=Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 733902891 CVIYNSATYLMIOV-UHFFFAOYSA-N 388.345 5.358 30 20 GKED CCc1ccc(-c2noc(CSCc3cc(Cl)ccc3OCC#N)n2)cc1 735317629 DPTDFNYUERHLJO-UHFFFAOYSA-N 399.903 5.288 30 20 GKED O=C1/C(=C\c2ccc(F)cc2)CC(O)(C(F)(F)F)C/C1=C/c1ccc(F)cc1 735792328 BSNZPVUWBPXVCY-VULZFCBJSA-N 394.339 5.088 30 20 GKED COc1cc(/C=C\C(=O)c2ccc3c(c2)COC3)ccc1OCc1ccccc1 742437336 SVWNHFCRGLTAJU-XFFZJAGNSA-N 386.447 5.201 30 20 GKED N#Cc1cc(NC(=O)c2ccc(-c3ccccc3)cc2)c(Cl)c([N+](=O)[O-])c1 746481742 NOQDXSIAJMRZDL-UHFFFAOYSA-N 377.787 5.039 30 20 GKED CC(=NNc1ccccc1Br)c1sc(-c2cccnc2)nc1C 747611827 PPOADQYBLSBQJT-UHFFFAOYSA-N 387.306 5.112 30 20 GKED CCn1cc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc21 748482744 NWZPTKNHBRVBML-MRXNPFEDSA-N 393.899 5.343 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 750691484 RINGRHDBJDGAQT-WIOPSUGQSA-N 395.506 5.672 30 20 GKED C[C@@H]1C[C@@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2c(O)ccc(F)c21 756380533 VTXUZMQRAUGZOD-CFDXXZMTSA-N 399.350 5.579 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCc2c(Cl)sc(Cl)c21 760266201 YSVPOBACOBOLBI-YFHOEESVSA-N 393.320 5.786 30 20 GKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C\c1cnc(-c3ccncc3)s1)CCO2 767738286 RSUXCHYSMMZDKS-UVTDQMKNSA-N 382.872 5.216 30 20 GKED C[C@H]1CN(c2ccc(NCC(C)(C)CCC#N)cc2C(F)(F)F)C[C@@H](C)O1 770565338 QTNWZIIWSQMQQA-GASCZTMLSA-N 383.458 5.061 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCO1 781763533 JNDNBGVFCBAMNW-XKQJLSEDSA-N 388.920 5.235 30 20 GKED O=C(/C=C/c1cccc2cnccc12)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 782889171 DRUXOGALGAOCND-JCOOBLOPSA-N 391.442 5.218 30 20 GKED COc1cccc(C(=O)/C(=C\c2cccc(OC3CCCC3)c2)c2ncc[nH]2)c1 787169058 LFJFFTJPNFXYEL-PXLXIMEGSA-N 388.467 5.163 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccc(Cl)cc2)n1 789720059 UKFVFUVLQXENOZ-UHFFFAOYSA-N 380.879 5.025 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1nc(Br)ccc1F 794972869 UOLXVUVDAKUJSK-HNQUOIGGSA-N 395.278 5.064 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2cccc(C(F)(F)F)c2)s1 797570081 CIDNNGVICMVJQI-CQSZACIVSA-N 380.435 5.268 30 20 GKED C=C[C@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 909531086 VFSKIJHJHDZPPG-QGZVFWFLSA-N 386.517 5.090 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2occc2-c2ccccc2)cc1 915086334 TYIXEEUPPCDDQO-HSZRJFAPSA-N 378.431 5.854 30 20 GKED C[C@H](SCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916050531 CFTQJDNCUIVNLE-MBSDFSHPSA-N 386.520 5.602 30 20 GKED C=CCn1c(C)nn(CN(C2CC2)[C@@H](C)c2cccc(C(F)(F)F)c2)c1=S 920304803 BDQIVWDNDOXIEJ-ZDUSSCGKSA-N 396.482 5.110 30 20 GKED O=C(O)c1cc(-c2ccc(C=NNc3c(Cl)cccc3Cl)o2)ccc1O 1776048942 NVYHQRUQLWLJON-UHFFFAOYSA-N 391.210 5.103 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)CC(C)(C)c1c[nH]c2ccccc12 1776050369 MLBSBKNMLDEGAX-UHFFFAOYSA-N 379.460 5.030 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)cc2)cc1 1776051813 HHPCWBIYHYEXOR-UHFFFAOYSA-N 385.341 5.484 30 20 GKED C[C@@H]1C/C(=C\c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2ccccc21 1776589820 ZOHQPPNFQDASNP-OVGFGYAMSA-N 388.419 5.330 30 20 GKED CC(C)c1ccc([C@H](NCC(=O)Nc2ccc(C#N)cc2)c2cccs2)cc1 7876726 RMTGOZDGMZWTHX-QHCPKHFHSA-N 389.524 5.061 30 20 GKED Cc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)s1 8080343 WLQUMILRYQQKTE-ZHACJKMWSA-N 381.884 5.858 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(COc3ccc4ccccc4c3)o2)n1 47358480 OGXUOIQGVHGTNK-LJQANCHMSA-N 388.448 5.267 30 20 GKED CSc1nc(C2CC2)cc(C(=O)N(C)Cc2csc3ccccc23)c1C#N 58281134 PXPBSWDBTPVBSK-UHFFFAOYSA-N 393.537 5.039 30 20 GKED Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 101847991 ZOIQQLNKSBSLST-UHFFFAOYSA-N 389.458 5.848 30 20 GKED CSc1ccsc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 107411113 QINPJVIVGPLSDK-VIFPVBQESA-N 392.477 5.362 30 20 GKED C=C[C@H](CC(=O)Nc1cc(Cl)ccc1-c1nc(C2CC2)no1)c1ccccc1 127568172 LJNHQWVGOBJNDT-CQSZACIVSA-N 393.874 5.566 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Br)cc2F)c1 127926670 RTVATCDXZHEHMN-CZUORRHYSA-N 391.284 5.120 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2noc(Cc3ccccc3)n2)cc1 165462288 RLYVSIWBZJHFKZ-DLBZAZTESA-N 397.906 5.204 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)c(Br)c1 173137465 TWDIXZPBSZUGDJ-LLVKDONJSA-N 393.281 5.092 30 20 GKED Cc1cc(NC(=O)c2cccc(SCC#N)c2)ccc1Oc1cccnc1 175691490 KYASGNRPNWPACF-UHFFFAOYSA-N 375.453 5.050 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)Cc1ccc(Cl)cc1 179808305 ILIJVHIBBXMXHK-KDOFPFPSSA-N 395.915 5.304 30 20 GKED Cc1ccc(-n2nc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2C)cc1 180537819 OQBHMTYZDQGOGO-KRWDZBQOSA-N 390.512 5.136 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cn(Cc2ccccc2)c2ccccc12 183101043 GTSRQASHAAVTDK-SFHVURJKSA-N 395.462 5.233 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 183617650 QRMDIAWXZNKGQE-HNNXBMFYSA-N 398.422 5.430 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(F)ccc2C)cc1 303084941 AXMIOWYCQHLQMO-UHFFFAOYSA-N 376.387 5.059 30 20 GKED Cc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 303184655 IUUWDTAMBYKLNN-GOSISDBHSA-N 394.927 5.926 30 20 GKED C[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(F)c(F)c1 303208427 QMOCVMOAZRLRKK-AWEZNQCLSA-N 378.378 5.120 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](C)c2cccc(F)c2)cc1 304088332 WTWNGEUCKVAZBX-OAHLLOKOSA-N 390.414 5.240 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2C/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)cc1 328891538 SKZGGGQJXQCWIA-NQIIRXRSSA-N 392.499 5.347 30 20 GKED Cc1scc(/C(O)=N/C2(c3noc([C@@H]4CCCO4)n3)CCCCCC2)c1C 329191857 SPNJPIMKSRLXJP-INIZCTEOSA-N 389.521 5.154 30 20 GKED C[C@@H]1C[C@@H](C(O)=Nc2nc(-c3cc(Cl)sc3Cl)cs2)CCC1=O 329384067 OWLGGCFNPNSTOB-SFYZADRCSA-N 389.329 5.772 30 20 GKED OC(=Nc1ccccc1N1CCCC1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329402262 ZHOCZPGPJSLLLU-LJQANCHMSA-N 392.547 5.382 30 20 GKED C[C@@H]1CCCC[C@@H]1OCC/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329414395 CPRNTTDQGNBMSO-LMNJBCLMSA-N 387.568 5.045 30 20 GKED N#CCC1(CN[C@@H](c2ccc(Br)cc2C(F)(F)F)C2CC2)CC1 430750028 AQDHVZQXOGWBHY-OAHLLOKOSA-N 387.243 5.202 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NC1CC(F)(c2cccc(Cl)c2)C1 431080737 MXVROGAZUURVBG-UHFFFAOYSA-N 399.897 5.159 30 20 GKED N#CCCC[C@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 433019197 IQQYGZURFBFOJR-DEOSSOPVSA-N 383.495 5.464 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 435171448 QFIKVEULTNBQGO-FCHUYYIVSA-N 375.516 5.424 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc(Cl)c2)cc1C(F)(F)F 438643640 UYUJYVIQNVTSGM-KRWDZBQOSA-N 393.796 5.599 30 20 GKED N#Cc1cnc2c(Br)cccc2c1NCc1cccc2cccnc12 440655781 WXXVECNOHFRULK-UHFFFAOYSA-N 389.256 5.029 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1 444395933 ZHWMJOOUQWRADH-INIZCTEOSA-N 387.439 5.701 30 20 GKED C=C(C)Cn1c(-c2ccccc2OC)nnc1N1CCC[C@@H]1c1ccc(C)s1 460558016 WNEZPZOQKGOHNI-GOSISDBHSA-N 394.544 5.241 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1 461661549 HMTSOAYXFSGLTL-UHFFFAOYSA-N 387.439 5.095 30 20 GKED CN(CCc1cccs1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 464341487 MLFMAGPRVOCZNG-UHFFFAOYSA-N 392.549 5.227 30 20 GKED CSc1nc(C2CC2)cc(C(=O)N2CCCC3(CCCCCC3)C2)c1C#N 464666367 SFFGLQRSESIOCV-UHFFFAOYSA-N 383.561 5.129 30 20 GKED Cc1c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cccc1C(F)(F)F 473829293 LAROLHQWSSIOSH-QFBILLFUSA-N 387.405 5.318 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](COCC(C)C)c1ccco1 475547698 HNZRENWZIZOZOC-HXUWFJFHSA-N 384.520 5.667 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1 476172691 WZZDIGWIVOXDEX-VQTJNVASSA-N 398.344 6.043 30 20 GKED C[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(Br)s1 481990993 GOIHAMJUSURCFD-WBMJQRKESA-N 375.335 5.501 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)c1 500237012 JAHCGXJMNUQAJY-UHFFFAOYSA-N 377.831 5.326 30 20 GKED C=CCN(C(=O)c1cc(C)nc2ccc(Br)cc12)c1ccccc1 508799809 HXVFMZXICWREDS-UHFFFAOYSA-N 381.273 5.139 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2ccccc2OC2CCCC2)cc1 510584515 NSVGLSGAGUIREI-UHFFFAOYSA-N 377.488 5.131 30 20 GKED CCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)sc1C 516269980 IFBHJDZEUOVWHD-INIZCTEOSA-N 382.510 5.241 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H]1CCCc2ccccc21 518127706 IGPAOLJGEXQZOU-JXFKEZNVSA-N 396.581 5.830 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N(Cc1ccc(C#N)cc1)C(C)C 522392168 UCGQTPXHRJCSCN-UHFFFAOYSA-N 375.497 5.041 30 20 GKED Cc1cccc(NC2CCN(c3c(C#N)cnc4c(F)ccc(Cl)c34)CC2)c1 525366177 AVBJPBUUQMHMJV-UHFFFAOYSA-N 394.881 5.288 30 20 GKED CC[C@@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccncc1 525563964 XNECYYRVCQSLRO-HXUWFJFHSA-N 391.858 5.280 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1scnc1C1CC1 534967989 PUPDWWBSLITTBZ-UHFFFAOYSA-N 377.494 5.296 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(-n2ccnc2)cc1 538112489 HMBSTALJJGXWEH-LJQANCHMSA-N 378.479 5.262 30 20 GKED CC(C)(C)c1cc(NC(=O)c2c(F)cc(Br)cc2F)c(C#N)s1 539171996 BXTFTUJLVDDKAJ-UHFFFAOYSA-N 399.260 5.210 30 20 GKED C[C@@H](C1CC1)N(C(=O)c1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 540735279 CORXWFSYTRJGRL-HNNXBMFYSA-N 398.428 5.706 30 20 GKED Cc1cnc([C@H](C)CNC(=O)c2ccc(Sc3ccccc3C#N)cc2)s1 541643286 YWXZUSPSHPWQQL-CQSZACIVSA-N 393.537 5.008 30 20 GKED C[C@H](NC(=O)NC1CCC(F)(F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543007503 UTJFQMNAJKCWFO-HNNXBMFYSA-N 383.442 5.163 30 20 GKED CN(C(=O)c1ccc(C#N)c(Cl)c1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 547960602 OIUSWJZHLSFICQ-HNNXBMFYSA-N 387.188 5.241 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)s1 551822224 XLXWSPWSGJDVKR-QFIPXVFZSA-N 387.508 5.209 30 20 GKED Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 554869277 BIEIHJHAQNNTMA-UHFFFAOYSA-N 386.411 5.079 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(Cl)cc1-c1ccc(Cl)cc1 571469171 IQCQDODLVUYIPI-UHFFFAOYSA-N 382.250 5.488 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)[C@@H]2CC23CCOCC3)cc1 573328857 GKQQIHIHYLIBFQ-SFHVURJKSA-N 398.915 5.118 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCCCC2 575898044 HUIKOVVGSHAMOU-OAHLLOKOSA-N 389.524 5.254 30 20 GKED N#CCC[C@@H](NC(=O)c1sc2ccccc2c1Br)c1ccccc1 582212726 VTYKKKRWDHGAGV-OAHLLOKOSA-N 399.313 5.439 30 20 GKED C[C@@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1F 588360848 FIUVAGJDGHGVPU-WUHRBBMRSA-N 399.350 5.345 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Sc2ncccn2)cc1C 591512047 IRHMCMNQOSNFAJ-UHFFFAOYSA-N 390.512 5.156 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC23CCCC3)cc1Cl 593143907 PUHNFLRMGYBFPW-IBGZPJMESA-N 379.891 5.546 30 20 GKED Cc1ccc(-c2ncc(CN[C@@H](CCCC#N)c3ccccc3)s2)cc1C 594521808 VDKBMJWNBWHZQF-QFIPXVFZSA-N 375.541 5.952 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC[C@H]1CCC(F)(F)C1 601059981 MBLGUIUXWMRABG-KGLIPLIRSA-N 384.517 5.045 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)Nc1ncc(-c2ccccc2)s1 604455222 OFIWEHLQVWCZGW-UHFFFAOYSA-N 378.457 5.113 30 20 GKED C[C@@H](c1cccs1)N(CCC(=O)Nc1sccc1C#N)Cc1ccccc1 604493086 YUYOWBAQOCUTAU-INIZCTEOSA-N 395.553 5.273 30 20 GKED CSCc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1 609064472 XZLZKEDHXTXUEG-UHFFFAOYSA-N 388.492 5.253 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(C)cs1 609207973 SRHLRRRDPDIPMM-IBGZPJMESA-N 392.484 5.388 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccccc1Cl 609370975 NVGNMNVSSWHAPB-ZDUSSCGKSA-N 376.934 5.323 30 20 GKED CC(C)[C@@H]1CC[C@H](C)C[C@H]1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 609376693 HYAXYRZLLNOAHP-HLNWXESRSA-N 388.577 5.354 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)sc2n1 609427562 KGUTXJJRVYVLKT-CQSZACIVSA-N 381.526 5.560 30 20 GKED C[C@H](NCc1csc(-c2cccc(Br)c2)n1)c1cccc(C#N)c1 610345149 UYTPBEVBISLBEF-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED CSCc1c(C(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)oc2ccccc12 610599155 NWYGTKUDFLZVRO-QUCCMNQESA-N 390.508 5.208 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCc1ccc(C#N)cc1F)C1CC1 610664004 LUYZGCLDTVEIFO-INIZCTEOSA-N 387.458 5.286 30 20 GKED CCCN(Cc1ccc(C(C)(C)C#N)cc1)[C@H](C)C(=O)Nc1ccccc1C 618778726 MKXNRUMUZBFLEI-LJQANCHMSA-N 377.532 5.035 30 20 GKED N#C[C@@H](Sc1nnc(COc2ccc(Cl)cc2)o1)c1ccc(Cl)cc1 619864143 UCSLNOLZRLMEQO-OAHLLOKOSA-N 392.267 5.312 30 20 GKED CCCN(CC)Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 672583934 OIXFXDLBQCGNKC-SFHVURJKSA-N 395.503 5.157 30 20 GKED O=C(c1ccc(C(F)(F)F)s1)N(Cc1ccc(F)cc1)CC(F)(F)F 674195925 KODAYEXODISRLR-UHFFFAOYSA-N 385.304 5.111 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)c(Cl)c1 676036804 CHJVRITZRSJVHN-MYJAWHEDSA-N 391.714 5.118 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCC(C4CCCCC4)CC3)o2)cc1 727990223 PDQGFWLACOIMRX-UHFFFAOYSA-N 392.499 5.163 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(OCC(F)(F)F)cc1 728440786 VBTYUVSIOLHBMQ-YVMONPNESA-N 395.427 5.709 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\Cc1cccc(COC2CCOCC2)c1 731937340 JEWZUUKLSGNRNE-FMCGGJTJSA-N 394.298 5.014 30 20 GKED CCn1cc(/C=C\C(=O)c2ccc(-c3ccccc3Br)s2)cn1 732531359 YCCGZDCUESWMEI-FPLPWBNLSA-N 387.302 5.290 30 20 GKED C[C@@H]1CCCC[C@H]1OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679247 DSWOKLKHABCRPB-VVFCZOMOSA-N 388.920 5.235 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c1 735009566 AVCIKMQCNRATPH-UHFFFAOYSA-N 386.838 5.262 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1cncc(F)c1 737420309 DTKXIYVMBGSUIH-UHFFFAOYSA-N 377.448 5.037 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3cccc(Cl)c3)n2)cc1 744035395 RIGGTFKBTZLWFI-KSSFIOAISA-N 380.900 5.752 30 20 GKED Cc1ccc2c(CCC(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c[nH]c2c1 745947842 PNHDQNPHMWXOHL-MRXNPFEDSA-N 392.409 5.030 30 20 GKED C[C@H](CCNC(=O)c1ccccc1SCC#N)c1cccc(C(F)(F)F)c1 746348465 YLKKGTGJVGUYGQ-CQSZACIVSA-N 392.446 5.245 30 20 GKED N#Cc1cc(CNc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)ccn1 746654183 JUHREEMDGMSQIO-UHFFFAOYSA-N 383.373 5.163 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3coc4cc(F)ccc34)n2)cc1 749026342 OJVLFHZVXVZZAB-GOSISDBHSA-N 390.439 5.423 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1sc(C(C)C)nc1C 751134677 OBYLFFPLNHHWEQ-UHFFFAOYSA-N 393.438 5.373 30 20 GKED C#CC[C@@H](NC(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 757760797 JCGCCHORQUAFDH-JOCHJYFZSA-N 397.478 5.133 30 20 GKED COC1CCC(CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CC1 759040829 NBVRDDOXJHVBNM-UHFFFAOYSA-N 394.490 5.134 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1ccc2ccccc2n1 759188568 WBFRQOYABRHJJP-FMAYLGMYSA-N 383.838 5.326 30 20 GKED N#CCCN(C(=O)CNc1cccc(Cl)c1SC(F)F)c1ccccc1 759776827 CITNFDLNPLAXFL-UHFFFAOYSA-N 395.862 5.013 30 20 GKED N#C[C@@H](C(=O)[C@@H](c1ccccc1)C1CC1)c1nc(-c2c(F)cccc2F)cs1 765932478 ZDEYACHMNBQNPH-KXBFYZLASA-N 394.446 5.458 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1csc(Cc2ccccc2F)n1 768028446 MXFOAEBXDKIASA-UHFFFAOYSA-N 394.471 5.031 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)c(Br)c2)c1 772984275 PKEYKSGPOBIMQW-CJNGLKHVSA-N 391.284 5.120 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)OC[C@H](C#N)Cc2cccs2)s1 774277289 HIQVZHCKVYHYGC-HNNXBMFYSA-N 382.510 5.028 30 20 GKED N#C[C@H]1CCC[C@@H](NCCCCCCc2nc(-c3ccc(Cl)cc3)no2)C1 774368955 IHAIJBAVQPGCJW-QFBILLFUSA-N 386.927 5.165 30 20 GKED CC(C)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776156936 OTRBSDOEMKJRRB-MGPUTAFESA-N 376.422 5.656 30 20 GKED C=CC[C@@H](NCc1c(C(C)(C)C)nn(-c2ccccc2)c1Cl)c1ccncc1 776185736 KYLCSFHLDZNLTP-HXUWFJFHSA-N 394.950 5.625 30 20 GKED C/C(=C\C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc([N+](=O)[O-])cc1 783975959 XRFBNCZFIOYYRL-BUYIWHAFSA-N 381.457 5.031 30 20 GKED CCCCCCCCCNC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 811995957 YUVGVLJUBZSVSR-SFHVURJKSA-N 376.545 5.324 30 20 GKED CC(C)[C@H](CCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 815913637 XJSIGQAIJZXIDM-ROUUACIJSA-N 395.453 5.513 30 20 GKED COc1cccc(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1F 822666469 HOWPWUGGNAKLLE-UHFFFAOYSA-N 390.299 5.009 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)OC(=O)[C@H](C)CC#N 850865003 HLDNMPISPUIKMC-PWSUYJOCSA-N 393.306 5.035 30 20 GKED Cc1c(NCc2cc(C#N)ccc2Br)cccc1OCC(F)(F)F 864011225 WADRTFNECXMAPS-UHFFFAOYSA-N 399.210 5.182 30 20 GKED COC(=O)CCSc1cc(Cl)ccc1N[C@H](C)c1ccc(C#N)c(F)c1 864025077 MZHQOBHOAVMGKH-GFCCVEGCSA-N 392.883 5.179 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352860 OGAALYJTOPTSOD-FYYLOGMGSA-N 384.483 5.050 30 20 GKED C[C@H](Cc1ccco1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 916510037 ZOPZAYINDGIIFA-QRWLVFNGSA-N 393.874 5.341 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 916628523 WMVWWNNFMBDOQT-BSDKJSHOSA-N 399.302 6.007 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCSc3ccc(F)cc3)n2)cc1 916650408 MKQPMISFNOQJOT-SFHVURJKSA-N 396.512 5.616 30 20 GKED Cc1ccc(Oc2ccc(OCC(=O)[C@@H](C#N)c3nc4ccccc4o3)cc2)cc1 917510185 VJGGTVQMKMLVGQ-HXUWFJFHSA-N 398.418 5.184 30 20 GKED CCCCCCCCCN(C)C(=O)C(=O)Nc1ccc(Cl)c2cccnc12 918477333 YNNOMBBRSJIRCV-UHFFFAOYSA-N 389.927 5.036 30 20 GKED CCCCCCOCc1cccc(NC(=O)N(C)Cc2ccc(C#N)cc2)c1 920875195 XEYJNVKHNWLSSL-UHFFFAOYSA-N 379.504 5.319 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)c2c(c1)C(C)(C)CC2 1776269183 AMSJWCFQVVJBIP-CLFYSBASSA-N 394.486 5.941 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@H](C(=O)O)C2(C)C)cc1 1776787494 DVDXWBAKSKKJFS-GOSISDBHSA-N 377.550 5.074 30 20 GKED CCCCCOc1cc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)ccc1OC 1776793056 IQYQQWHTMVPWHT-DHZHZOJOSA-N 382.456 5.167 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776801350 LFUNMLKVJCGXPV-XYOKQWHBSA-N 382.456 5.247 30 20 GKED Cc1c(/C=C2\CSc3ccc(Cl)cc3C2=O)nc2ccccc2c1C(=O)O 1777414276 WETIGHCOKNDEAP-XYOKQWHBSA-N 395.867 5.267 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nnc(-c3ccco3)n2C2CCCCC2)cc1 7442290 CBUQFMHQXDDWGN-LJQANCHMSA-N 392.528 5.579 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)ccc1OCC#N 18065492 CKUROPJYTXEXAH-VQHVLOKHSA-N 375.449 5.222 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2nc(C(C)C)sc2c1 63394714 ZURDTPKEGFSLQW-UHFFFAOYSA-N 390.512 5.511 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 65680135 GHHMRIHTLQJWIN-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Sc1nc2c(cc1C#N)CCCC2 96995101 KLFQLGUNGDOQRV-HNNXBMFYSA-N 379.529 5.075 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)cc1OC 110088928 KYBKGZKBMNUDQZ-FNORWQNLSA-N 386.831 5.398 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 118446281 HJEVNKAIBJJOKS-HOTGVXAUSA-N 395.553 5.385 30 20 GKED N#C[C@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc2ccccc2o1 176733173 VBVOMWKSHRVOTL-LLVKDONJSA-N 379.268 5.395 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 181131431 ONIIAPRUSNZMJP-AWEZNQCLSA-N 379.441 5.226 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(F)F)cc1 183846507 SWLQIRSYMSLWPF-ZDUSSCGKSA-N 375.444 5.340 30 20 GKED N#CCCN(C(=O)c1csc(-c2cccs2)n1)C12CC3CC(CC(C3)C1)C2 185095687 ROXZVQWWJMOOGG-UHFFFAOYSA-N 397.569 5.196 30 20 GKED Cc1c(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1C1CCCC1 193557999 STCZDJVABYWHOO-AWEZNQCLSA-N 383.521 5.202 30 20 GKED COc1cccc([C@@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 195633885 XQMHXTQYLWOLEQ-QGZVFWFLSA-N 386.451 5.410 30 20 GKED CC1(C#N)CCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)CC1 272559889 TVVAISVUDZJKLM-UHFFFAOYSA-N 389.474 5.059 30 20 GKED CC[C@@H](C)CN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 303425149 AMOSKBZJDYRWEW-OAHLLOKOSA-N 385.895 5.300 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C)c2ccc(C#N)cc2)nnc1-c1cccnc1 303653655 BUGPCGUFBKAAIQ-KRWDZBQOSA-N 397.507 5.363 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](C)c1oc2ccccc2c1C 328982514 FFAUESQYOLTEDI-DZGCQCFKSA-N 384.501 5.466 30 20 GKED O/C(=N/C[C@@H]1C[C@H]1C1CCCCC1)C1CCN(c2nc3ccccc3o2)CC1 329320046 ITCPBZYJGDEIPF-OALUTQOASA-N 381.520 5.217 30 20 GKED N=C(O)N1CCc2ccc(N=C(O)[C@]3(Cc4ccccc4)C[C@H]4CC[C@H]3C4)cc21 330334227 YOQAFRVHESWGQV-WVMBUTMQSA-N 389.499 5.179 30 20 GKED N#CC1(CCSc2nnc(-c3ccc(OC(F)F)cc3)o2)CCCCC1 412984479 QJTVGKPOWAYCGW-UHFFFAOYSA-N 379.432 5.294 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2ccc(Cl)cc2n1 437557933 ODCRCZFFKVQVRX-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED Cc1cc(C)cc(C[C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 438038494 NMTOVXLQOHKTSZ-QZTJIDSGSA-N 381.545 5.450 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccco2)C2CCCC2)cc1C(F)(F)F 438634655 JCPHMCYDKXYPMU-UHFFFAOYSA-N 377.366 5.147 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccc2ccccc2c1)C1CC1)c1ccccc1 440255524 LXCHTDCPQQIVJJ-XMMPIXPASA-N 383.495 5.559 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)[C@H](C#N)c3nc(C)cs3)c2)c1 442601008 SCWBYJJWXWTHTA-IBGZPJMESA-N 392.549 5.851 30 20 GKED Cc1cc(CNCc2ccc(Oc3ccccc3C(F)(F)F)nc2)ccc1C#N 443982193 AEMOKGJREQCOAM-UHFFFAOYSA-N 397.400 5.363 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1csc(CCc2ccccc2)n1 444400187 RDPZGQSDJQYXIU-QGZVFWFLSA-N 393.581 5.935 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 447114557 SCZKDRZJHBHVOR-CYBMUJFWSA-N 375.925 5.217 30 20 GKED COCC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 453336952 GEFORHMVSPCDKG-ORAYPTAESA-N 380.385 5.145 30 20 GKED Cc1ccc(Br)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 455042606 YXVFDAXTILNXIA-KRWDZBQOSA-N 386.293 5.314 30 20 GKED Cc1cccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1Br 455172166 ROWIOZSXAPWTDQ-MRXNPFEDSA-N 386.293 5.314 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)c1 455913434 ZCCMQUYOIBAZFZ-LJQANCHMSA-N 393.878 5.041 30 20 GKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H]1CCC[C@@H]1c1ccccc1 458855467 YGNSVRKRGLZNOE-DNVJHFABSA-N 375.516 5.399 30 20 GKED Cc1nc(-c2cccc(C(=O)N(Cc3ccc(C#N)cc3)CC(C)C)c2)cs1 463571251 AGLCTZOPRWVFLH-UHFFFAOYSA-N 389.524 5.289 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cccc(C(F)F)c3)cc2)cc1 468317883 QLHLMNYYJAGMJG-UHFFFAOYSA-N 378.378 5.469 30 20 GKED CCCOc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469276578 VKQFIYFKIZNQGS-GOSISDBHSA-N 391.515 5.231 30 20 GKED CCS[C@H]1CCCCN(C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C1 480346787 HLTLUDSELQCOOR-SFHVURJKSA-N 398.503 5.237 30 20 GKED CN(CCC#N)C(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 484004416 GTNPJULKSOASFJ-UHFFFAOYSA-N 380.835 5.058 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2)c2ccc(C(F)(F)F)cc2)cc1 486031155 RVPFIHVXLTWTPR-JOCHJYFZSA-N 396.412 5.465 30 20 GKED C[C@@H](CC(=O)Nc1nc(-c2cccc(C#N)c2)cs1)c1c[nH]c2ccccc12 486304378 KTQINBURABCYPZ-AWEZNQCLSA-N 386.480 5.295 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Br)cc1OCC 486415071 ZCPVPPLNWUIJNW-UHFFFAOYSA-N 392.318 5.378 30 20 GKED Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NCc1ccccc1C(C)(C)C#N 486450280 WDJZBFCJTHLZKC-SFHVURJKSA-N 389.543 5.280 30 20 GKED C=CCC[C@H](C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 487762773 QXJKCOJDOCOVRX-RDJZCZTQSA-N 383.442 5.359 30 20 GKED CCCN(Cc1ccccc1C(C)(C)C#N)[C@@H](C)C(=O)Nc1ccccc1C 490046229 UFJSALUECSKRTP-IBGZPJMESA-N 377.532 5.035 30 20 GKED N#Cc1ccc(Br)c(CN2CCCC[C@H]2c2nc3ccccc3o2)c1 492744753 HPGFDRHPVLRBSU-SFHVURJKSA-N 396.288 5.189 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CC4(CCC4)[C@@H]3c3ccccc3)cc2)nc1 495354510 RVXLNYLHSQGCFT-QHCPKHFHSA-N 395.462 5.113 30 20 GKED Cc1ccc(Br)c(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c1 505531958 HWELQDIXUBBAOQ-CQSZACIVSA-N 398.087 5.059 30 20 GKED N#C[C@H](NC(=O)c1cccc(C(F)(F)F)c1F)c1ccc(Cl)c(Cl)c1 505959527 IERQJPOIPDNYNX-ZDUSSCGKSA-N 391.151 5.146 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3c(Cl)cccc3Cl)C3CC3)o2)cc1 513258859 ZZCUREGFJRSQNB-UHFFFAOYSA-N 399.281 5.080 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3cc4ccccc4s3)c2)c1 515676287 CLJBXIOUGGXUFH-UHFFFAOYSA-N 397.459 5.278 30 20 GKED CC(C)N(Cc1cccc(F)c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 517533432 WGLHUEVVAKCVRM-MRXNPFEDSA-N 385.508 5.662 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CSc1ccccc1 518147543 DMKCBKKPWHLIBV-UHFFFAOYSA-N 396.459 5.442 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 521257975 ODZJBKXANIFWSI-WMZOPIPTSA-N 379.529 5.268 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@H]1CCC[C@H](C)C1 522151485 XJUXYHRTZSVYAN-JTSKRJEESA-N 394.490 5.134 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)sc1-c1cccc(Cl)c1 524013393 NBAKVOXESQKBQL-HNNXBMFYSA-N 391.883 5.743 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1-c1ccccc1 524987827 OHOOBIQYSLCCSX-OAHLLOKOSA-N 376.456 5.484 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)c(F)c1 530790484 GEYWRXRHRIOMBH-HXUWFJFHSA-N 382.797 5.009 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 533959322 DXKDIVUEEOYLNQ-INIZCTEOSA-N 376.481 5.299 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc([C@H]2CCCOC2)c1 535037288 SIIKEQOYLPJTJH-LPHOPBHVSA-N 380.513 5.227 30 20 GKED Cc1sc(NC(=O)[C@@H](C)c2cccc(C(=O)c3ccccc3)c2)c(C#N)c1C 535595548 BWDMWQYDEYBRGO-HNNXBMFYSA-N 388.492 5.210 30 20 GKED COc1cc([C@@H](C)NCc2ccccc2C(C)(C)C#N)ccc1OCC(C)C 538167393 DMGMZZOHAMIHFH-GOSISDBHSA-N 380.532 5.382 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ncccc3C(F)(F)F)n2)cc1 542648299 JQUVFKCOWDTQJY-CYBMUJFWSA-N 387.386 5.022 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N[C@](C)(C#N)CC(C)C 542895659 MEMJNOHEZAPLKP-SFHVURJKSA-N 380.275 5.015 30 20 GKED C=CCSc1ccccc1NC(=O)CN[C@@H](C)c1nc(C(C)(C)C)cs1 544484384 SVFOWXMTUPREJY-AWEZNQCLSA-N 389.590 5.008 30 20 GKED N#Cc1ccc(C(=O)CSc2nnc(-c3ccccc3)c3ccccc23)cc1 545132402 NVSKFIUMOKCNNA-UHFFFAOYSA-N 381.460 5.143 30 20 GKED N#CCc1ccccc1NC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 550101505 SHRJOKSTZSFRKI-UHFFFAOYSA-N 388.279 5.435 30 20 GKED CC(C)(C)CCOc1cnccc1CNCc1ccc(C#N)cc1C(F)(F)F 562078656 RCDLARPFFIWYAL-UHFFFAOYSA-N 391.437 5.077 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(OCc2ccccc2Cl)cc1 572551997 ZZSFWJDUAXTMLT-UHFFFAOYSA-N 385.895 5.370 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(F)c(Br)cc2Cl)c1 577796119 IMRYTJOLNBEOGG-UHFFFAOYSA-N 388.023 5.019 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)c1 589739082 HPSYJNFKVYONPV-NFBKMPQASA-N 394.515 5.273 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCCc2sccc2C1 593447598 RGFCTANTRVTIQE-UHFFFAOYSA-N 378.522 5.190 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(Cl)c3Cl)cn2)cc1 603763461 AMHZFRRWBUHRNQ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CCN(C(=O)c1ccc(Br)cc1Cl)[C@H](C)c1ccc(C#N)cc1 603956418 RTKWSCGQCAPYNV-GFCCVEGCSA-N 391.696 5.197 30 20 GKED CCN(C(=O)c1ccc(-n2cnc3ccccc32)cc1)[C@@H](C)c1ccc(C#N)cc1 604343372 YUCJSZNQVAAZMZ-SFHVURJKSA-N 394.478 5.120 30 20 GKED CCC[C@@H](NC(=O)NCc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 604499045 SZPWTJMRMUDSJB-GOSISDBHSA-N 376.287 5.206 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(C)c(C)s1 609062068 UYNAHPYJOWZICV-UHFFFAOYSA-N 376.481 5.376 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Cc1ccccc1 609378056 PQVQRVLVOSKIGQ-SFHVURJKSA-N 386.520 5.781 30 20 GKED C=CC[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 609738696 GOIWSUURQOOQRT-LBPRGKRZSA-N 376.865 5.094 30 20 GKED C[C@H](NC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)c1cccc(C#N)c1 610363131 ULFBPFOHQRXVAP-HNNXBMFYSA-N 399.475 5.433 30 20 GKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(NC(=O)c2ccccc2)c1 611390655 MZLXJYMWGYPJHK-BVZFJXPGSA-N 395.506 5.539 30 20 GKED N#C[C@H](C(=O)c1cc2c(Cl)cccc2s1)c1nc(-c2ccccc2)cs1 613392524 YDOVFCIHLHSCBH-CQSZACIVSA-N 394.908 6.168 30 20 GKED COCc1c(C(=O)Nc2cccc(C#Cc3cccs3)c2)oc2ccccc12 626628255 YREMKMQONKCNAI-UHFFFAOYSA-N 387.460 5.293 30 20 GKED C=CCN(C(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1)c1ccccc1 647741697 DBLJFEIANBCTRH-UHFFFAOYSA-N 395.462 5.545 30 20 GKED O=C(Nc1ccc(F)cc1Cl)NC(CCC(F)(F)F)CCC(F)(F)F 665155074 ZRCXGBICLVMDMS-UHFFFAOYSA-N 394.718 5.654 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(OCc2ccccc2F)CC1)c1ccccc1 681668330 XXYZNVBHRBEWKG-JOCHJYFZSA-N 381.491 5.083 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 726074337 PRWHFNBQJQJSKJ-JOCHJYFZSA-N 389.524 5.846 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(CCN3CCCCC3)cc2)cc1Cl 726471910 HOPLLCKGAAKXMT-UHFFFAOYSA-N 398.963 5.049 30 20 GKED CCOc1cc(/C=C2/CCc3sccc3C2=O)cc(Br)c1OC 726892042 KYRLANVHRWSLSX-WQLSENKSSA-N 393.302 5.130 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)cc1 727263482 DHBOBEVLVGHAJQ-OUKQBFOZSA-N 391.496 5.236 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1cccc(C#N)c1 727636815 ZBRNEVGCNIJJTB-NSHDSACASA-N 388.901 5.244 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)c(Cl)c1OC 730434777 SQIIZQLOILJFDH-XYOKQWHBSA-N 385.891 5.244 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730476013 YEQRJEPSCKIRPM-YADARESESA-N 398.506 5.558 30 20 GKED CC(C)(C)n1cc(C=NNc2ccccc2C(=O)O)c(-c2ccccc2Cl)n1 731151720 SMAXSTKACLVRNL-UHFFFAOYSA-N 396.878 5.103 30 20 GKED C=CCN(C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C)cc1C)C(C)C 738954513 HVAADKMOLOBKHI-UHFFFAOYSA-N 380.467 5.116 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cccc(Br)c3)c2)s1 740013367 FNFSWQCXJDPUTH-UHFFFAOYSA-N 383.314 5.339 30 20 GKED CSc1ccc2c(c1)CC/C(=C\c1cnc3ccc(Br)cn13)C2=O 740764775 FLJMWOZYEASUDN-MDWZMJQESA-N 399.313 5.031 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2cccs2)CC(F)(F)F)cc1Cl 751896116 AMNDRJBZDMQAAL-UHFFFAOYSA-N 389.855 5.034 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1csc2ccccc12 767216197 IPEXJIXPFZKKHJ-MRXNPFEDSA-N 387.508 5.333 30 20 GKED Sc1nnc(-c2ccco2)n1N=Cc1ccc(SCc2ccccc2)cc1 771871225 KRSDOEICEZZSNM-UHFFFAOYSA-N 392.509 5.001 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)[C@H](C)c2nc3ccccc3s2)c1 772983799 LGHZVYGSDNJJNB-LZLYRXPVSA-N 379.529 5.259 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 774446617 CRMYSBXYZBFSOO-PZJWPPBQSA-N 388.433 5.627 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3cccc(F)c3C)o2)C(=O)c2ccccc2C1 778519537 HPESZWJMAMSQJF-PDGQHHTCSA-N 389.426 5.023 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3ccc(-c4ccccc4F)o3)cc2N1 779462643 PWLQANAVIMYCRA-FNORWQNLSA-N 385.441 5.088 30 20 GKED C=CCN(C(=O)c1ccnc(C(F)(F)F)c1)c1nc(-c2ccccc2)cs1 807964039 USZKJVQVZOCXOC-UHFFFAOYSA-N 389.402 5.057 30 20 GKED Cc1nc(CSc2ccccc2C(=O)OC[C@H]2CC[C@@H](C#N)CC2)cs1 809091851 OSYWVOLJBPTHQF-IYBDPMFKSA-N 386.542 5.231 30 20 GKED CC(C)(C)OC(=O)N1CCC(CCN[C@H](CCCC#N)c2ccccc2)CC1 814304555 NUKRMSFXKDOEIM-OAQYLSRUSA-N 385.552 5.048 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(COc2ccccc2)c1)c1ccccc1 814619799 UYEQKQZPTNJKPX-DEOSSOPVSA-N 399.494 5.822 30 20 GKED N#CCCC[C@@H](NC(=O)OCc1ccc(Br)cc1)c1ccccc1 859169119 VYDQSVKVQJDROH-GOSISDBHSA-N 387.277 5.110 30 20 GKED Cc1cc(NCc2cc(C#N)ccc2Br)ccc1OCC(F)(F)F 864012304 DTPYCIBBIDNRFR-UHFFFAOYSA-N 399.210 5.182 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3nc4ccccc4s3)cn2)cc1 916074801 ZEELTIYCFOQPSA-ZRDIBKRKSA-N 398.447 5.007 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917045821 AKBJHROQXRIAKI-LLVKDONJSA-N 399.884 5.465 30 20 GKED CCOc1ccccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919773631 VHIVCPKCDCCNFS-QFIPXVFZSA-N 385.467 5.062 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@H]1c1ccccc1 919904875 XEHBPGZGBPEENY-RPWUZVMVSA-N 395.506 5.957 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(OCCC(C)C)cc1 920106046 JMVRUKLISFZSCW-FQEVSTJZSA-N 388.467 5.107 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1cc(-c2cccc3ccccc23)nc2ccccc12 920449071 AOTXWOQOXNSPNV-QGZVFWFLSA-N 379.463 5.287 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2csc(C(=O)O)c2)cc1 1776125734 RLSMTQWYJDJSKJ-JQPKSGMCSA-N 386.513 5.938 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2ccc(O)c(C(=O)O)c2)cc1)c1ccccc1 1776469419 KWXNAIPMJLBBER-VXXVJXPCSA-N 388.419 5.127 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc(C3(C(=O)O)CC3)cc2)cc1 1776786628 NRAAHFPXAMJYNG-UHFFFAOYSA-N 393.527 5.958 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C\c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777455812 CNZHYYRYTGADFD-DMGPTTAYSA-N 398.458 5.656 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 14463160 PMRXGEYXTIJDQP-UHFFFAOYSA-N 394.883 5.624 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc([N+](=O)[O-])cc2)cc(C)c1OCc1ccccn1 46658486 LRYCXIJPLHRXRO-IZZDOVSWSA-N 388.423 5.082 30 20 GKED COCc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 46861706 RTDSNXXPVUFSRT-OAQYLSRUSA-N 390.870 5.394 30 20 GKED N#C[C@@H](C(=O)c1sccc1Br)c1nc(-c2ccccc2)cs1 51534050 BINZWAGZWKCSLR-NSHDSACASA-N 389.299 5.124 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C/c2ccc(Cl)cc2Cl)cc1 59324379 LGNABKGBTUICKN-WEVVVXLNSA-N 387.266 5.202 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(Cl)sc2Cl)cc1 65680256 YLYZNPKXTSJSCX-UHFFFAOYSA-N 389.263 5.971 30 20 GKED CC(=O)c1ccc(Cl)c(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 183230526 QNIVAWBWUTWYDR-UHFFFAOYSA-N 390.826 5.459 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@H](C)c1ccccc1 183337525 ZLEJGFRFWOLDQK-IRXDYDNUSA-N 384.570 5.414 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1NC[C@@H]1CCCO[C@@H]1c1ccccc1 195670096 NPRHGGHCYHWQBK-OYHNWAKOSA-N 395.865 5.479 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3ccc(C(C)C)cc3)n2)cc1 197667320 RESIVSMZFYPBFC-HXUWFJFHSA-N 390.508 5.497 30 20 GKED N#Cc1cc(Cl)ccc1NCc1cccc(NC(=O)c2cccc(F)c2)c1 303237826 ZDVVQEGDIRFRDR-UHFFFAOYSA-N 379.822 5.215 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H]1CC[C@H](C#N)C1 424968705 XIFVKZFVSQWTRE-NWDGAFQWSA-N 392.286 5.194 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432956585 UQCDXCWVCXUASR-QFIPXVFZSA-N 395.572 6.193 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCc4ccc(F)cc4C3)c2)cc1 434222844 NPBDIMXLTZIQHJ-UHFFFAOYSA-N 387.414 5.080 30 20 GKED C=CC1CCN(C(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)F)CC1 438376928 PZWOXOGCCDFYGZ-UHFFFAOYSA-N 394.409 5.493 30 20 GKED Cc1sc(Br)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C 440759338 XDTCPZUOHPWQPP-UHFFFAOYSA-N 377.307 5.181 30 20 GKED N#Cc1ccc(-c2nnc(CN3CC=C(c4cccc5ccccc45)CC3)o2)cc1 441538322 ZCNXDTSFCQBFEL-UHFFFAOYSA-N 392.462 5.051 30 20 GKED C=CCC[C@@H](NC(=O)c1ncc(C#N)cc1Cl)c1ccc(C(F)(F)F)cc1 441563161 FXKWILKWVSCVND-MRXNPFEDSA-N 393.796 5.063 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CS[C@H](C)c1cccc(C#N)c1 443158593 ZIGXWMQPULAYHV-QGZVFWFLSA-N 380.557 6.238 30 20 GKED CCCCOc1ccccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444033734 ONNJFSYCEYZBGL-UHFFFAOYSA-N 375.472 5.376 30 20 GKED C=CCN(C(=O)[C@H]1CCCc2sc(C)nc21)c1nc(-c2ccccc2)cs1 447201358 TVRRDRURFPDMBU-INIZCTEOSA-N 395.553 5.214 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)Nc2ccc(CC#N)cc2Cl)cc1 455742604 CAYIDASKUHKPKQ-HXUWFJFHSA-N 383.879 5.174 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 458801940 OIBDNJSXHYYRJT-LJQANCHMSA-N 389.421 5.282 30 20 GKED COCCN(C(=O)c1cc2sc3ccccc3c2s1)c1ccc(C#N)cc1 460358693 YAHPSGUNKCIQIQ-UHFFFAOYSA-N 392.505 5.281 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(C2CC2)nc2ccc(F)cc12 463795569 WXKCIPGHNFTDQS-UHFFFAOYSA-N 391.471 5.509 30 20 GKED N#Cc1cc(CNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)ccc1F 467767372 FKHSBBBAXCHDOT-UHFFFAOYSA-N 387.336 5.516 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)cc1F 469120267 WDOOCVWHMWZTRY-HXUWFJFHSA-N 383.442 5.111 30 20 GKED C=CCN(C(=O)c1cccc2oc(C)nc12)c1nc(-c2ccccc2)cs1 470734588 XCSUPUUPKMCJIJ-UHFFFAOYSA-N 375.453 5.093 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1OCCc1ccccc1)c1ccccc1 474889807 IMMACYCYSZPAMS-QFIPXVFZSA-N 384.479 5.334 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cc(Cl)ccc1Cl 476138564 GUICOTUMUKJKON-UHFFFAOYSA-N 378.299 5.863 30 20 GKED CCCN(C(=O)Nc1ccc(OC(C)C)c(C#N)c1)[C@H]1CCCc2cccnc21 480967936 YOXXEWKZUAFSMN-FQEVSTJZSA-N 392.503 5.062 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(CC(F)(F)F)cc1 481209250 PFVILTRGVQNGHU-UHFFFAOYSA-N 388.842 5.726 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(COC3CCCCC3)c2)cc1 483378332 MQPDQSOPMZUBKL-UHFFFAOYSA-N 380.513 5.138 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OCc2ccccn2)c(F)c1 486423324 GLFVOSKLPHSFTQ-UHFFFAOYSA-N 394.471 5.330 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccccc1 487176405 MIXODASJECHIOZ-LNLFQRSKSA-N 387.310 5.648 30 20 GKED CCOc1ccc(-n2c(SCCCCC#N)nnc2-c2cccs2)cc1 489676027 GJTKSWAJKOJAAK-UHFFFAOYSA-N 384.530 5.180 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2Cc2nnc(-c3ccc(C#N)cc3)o2)cc1 490610363 WPOINTSUEVZLTC-JOCHJYFZSA-N 386.499 5.459 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2ccc(C#N)c(C)n2)C(C)C)s1 498422380 JDVOYUMVJKNDBL-UHFFFAOYSA-N 389.524 5.349 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)N[C@@H](C)c1ccc(F)cc1 499489210 ZZWKNXLRKIBCON-RYUDHWBXSA-N 396.409 5.074 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503873058 MEAOUBMPVJWULC-INIZCTEOSA-N 398.428 5.072 30 20 GKED N#C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1F)c1ccc(Cl)c(Cl)c1 505922306 GDIQIOYOARPGMN-AWEZNQCLSA-N 391.151 5.146 30 20 GKED CCN(C(=O)c1cc2ccc(Br)cc2[nH]1)[C@@H](C)c1ccc(C#N)cc1 509565362 WYRVFVSROGTHDG-ZDUSSCGKSA-N 396.288 5.025 30 20 GKED Cc1ccc(CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)s1 512277823 ORXHPZNCRDRUJD-UHFFFAOYSA-N 378.472 5.152 30 20 GKED CCCOc1nc(C(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc2ccccc12 513484839 PJTBSAVVIANUDP-QGZVFWFLSA-N 387.483 5.119 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)o2)c(C)c1 515089385 FUHXVFMGHRQIKZ-GOSISDBHSA-N 399.450 5.150 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ncc(Cc2cccc(F)c2)s1 515218692 NMDVSNQRNGZVSD-UHFFFAOYSA-N 387.505 5.155 30 20 GKED CC(C)c1ccc(OCCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518259358 KLBSJBWUVLMRDH-QGZVFWFLSA-N 397.544 5.405 30 20 GKED COc1ccc(C2(NC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)CC2)cc1 518313769 JMGUXZGUABZVIX-UHFFFAOYSA-N 399.450 5.170 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)NCc2ccc(Cl)s2)cc1 518536115 DIWIQMKHTPMABS-UHFFFAOYSA-N 386.835 5.135 30 20 GKED COC(=O)c1sc2ccccc2c1CNc1ccccc1S[C@H](C)CC#N 520943470 CAGLYDHLENWDJG-CQSZACIVSA-N 396.537 5.694 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cccc(-c4cnco4)c3)c2)cc1 524523756 OAQUHURSKKHPMY-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#C[C@H](C(=O)c1ccnn1C1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 532243950 YMFBFABHBOAITR-MRXNPFEDSA-N 396.903 5.265 30 20 GKED COc1ccc(N(Cc2cccs2)C(=O)c2ccc(C3(C#N)CC3)cc2)cc1 538495168 OYRMLERSHANBOK-UHFFFAOYSA-N 388.492 5.159 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H](c2nc3ccccc3n2C(C)C)C1 539401347 QYRFQBJCLMJNHS-HXUWFJFHSA-N 397.563 5.086 30 20 GKED C=CCC[C@H](NCc1nnc(-c2ccccc2)o1)c1ccc(C(F)(F)F)cc1 540428847 FNMFALRQJDAIKB-SFHVURJKSA-N 387.405 5.553 30 20 GKED N#CCC1CCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1 541050085 CREWIFJOOULYHE-UHFFFAOYSA-N 389.282 5.552 30 20 GKED CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 542024168 XGZDRRWUHLCWAN-GAJHUEQPSA-N 384.483 5.132 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542968352 XDKNWYRVEMQTEJ-CVEARBPZSA-N 387.483 5.201 30 20 GKED C[C@@H](NCc1cnc(-c2ccccc2)[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543873675 ARCXXZQVJPHHQY-GOSISDBHSA-N 378.479 5.466 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc2c1CN(c1nccs1)C2)c1ccccc1 548614832 KMFRQCFTUVWYHI-LJQANCHMSA-N 389.524 5.352 30 20 GKED C[C@H](NCc1cccc(CN[C@@H](C)c2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 548933408 SWUQVOSQNNMVIE-PMACEKPBSA-N 394.522 5.132 30 20 GKED C[C@@H](NCc1cccc(CN[C@H](C)c2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 548933409 SWUQVOSQNNMVIE-WOJBJXKFSA-N 394.522 5.132 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccccc2N2CCCCCC2)C2CC2)cc1 551139289 XCUIOZAYZAJIJN-UHFFFAOYSA-N 388.515 5.135 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 554262179 AFBZCFSUGAWQPB-QGZVFWFLSA-N 391.393 5.201 30 20 GKED C=CCC(C)(C)C(=O)Nc1ccc(OC)c(OCc2ccc3ccccc3n2)c1 555834515 HSYCMEPSCAIBCS-UHFFFAOYSA-N 390.483 5.363 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1cccc(CSc2cc(C)ccc2C)c1 574283893 YSYWPRICPGYCBC-QFIPXVFZSA-N 398.597 5.361 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1cccc(F)c1F 580852444 ZYKDTXZKJTXQLQ-UHFFFAOYSA-N 376.406 5.002 30 20 GKED N#CCCCCCC(=O)Nc1nc2ccccc2n1Cc1ccc(Cl)cc1 588727686 LHXXSDUQXBNNMS-UHFFFAOYSA-N 380.879 5.151 30 20 GKED C[C@]1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1(F)F 596692029 USLUTOXYBKIHBG-VQIMIIECSA-N 389.833 5.162 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 596739798 BFPLOYCOOHAUSV-INIZCTEOSA-N 383.879 5.077 30 20 GKED C=CCN(C(=O)c1occc1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 603338996 ZTLKTQJWOIIMBF-UHFFFAOYSA-N 393.295 5.851 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)NCCSCc1ccccc1C#N 603643825 RKDVCCHBXLALKX-UHFFFAOYSA-N 395.572 5.860 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccc(F)cc1 604113363 JAUHROCNLICNBH-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CCc1ccccc1)c1ccccc1 604128984 FQLZJLKTFUBQGZ-XMMPIXPASA-N 383.495 5.074 30 20 GKED N#Cc1ccc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)c(F)c1 609229238 XBBJUCRRDJAYRP-UHFFFAOYSA-N 379.243 5.149 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCc2ccccc21 609398591 CEYGJKSFTFPXJC-FUHWJXTLSA-N 379.529 5.180 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1c1ccccc1 609434472 OLYOQFGPLIOCJU-HSZRJFAPSA-N 397.478 5.966 30 20 GKED Cc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609438501 IDAUJXYJQUTNFX-QGZVFWFLSA-N 381.545 5.489 30 20 GKED CCSCc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 610178922 BNHHRWZFUZYYQO-UHFFFAOYSA-N 389.480 5.251 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ncc(Cl)s2)cc1 610492774 SGCZDJCZFFXOJS-UHFFFAOYSA-N 385.901 5.213 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 610624717 YKUWIBJMXGEHNP-UHFFFAOYSA-N 384.479 5.793 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 612235773 HBPFTHKXJXAGFS-NRFANRHFSA-N 396.537 5.552 30 20 GKED O=C(CSc1ccc(F)cc1)NC(CCC(F)(F)F)CCC(F)(F)F 619124893 DIXNWSGEEYSNQR-UHFFFAOYSA-N 391.352 5.088 30 20 GKED C=CCCOCC(=O)N(Cc1ccccc1)c1nc2cc(C)cc(C)c2s1 620326631 QWAPYDXWYSIQPM-UHFFFAOYSA-N 380.513 5.039 30 20 GKED Fc1ccccc1-c1nc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)co1 625102364 ZIIJXGZDAORUCG-GHMZBOCLSA-N 396.306 5.043 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)c1 647378500 ASTHPZHEVVVZIS-IBGZPJMESA-N 388.492 5.576 30 20 GKED COC1(c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)CCC1 664820341 SSSORGQMTFSPQW-UHFFFAOYSA-N 398.278 5.052 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Br)c1)c1ccc2ccccc2n1 676590803 IMJBHEJUQPZUBU-OAHLLOKOSA-N 385.648 5.141 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)c1 726463912 BSGJUWFUXOUTBG-INIZCTEOSA-N 394.540 5.046 30 20 GKED C#Cc1cccc(N(C(=O)c2sc(NC(=O)C(C)(C)C)cc2C)C(C)C)c1 728247594 MFRYTKAACITMEJ-UHFFFAOYSA-N 382.529 5.078 30 20 GKED Cc1cc(C(=O)Nc2ccc(COC(C)C)cc2)c(C)n1-c1ccc(C#N)cc1 728269164 BNABKVMZQKZAEL-UHFFFAOYSA-N 387.483 5.143 30 20 GKED COc1ccc2cc(/C=C/C(=O)Nc3ccccc3SCCC#N)ccc2c1 730981987 GIMMFRAVTSWBFT-XYOKQWHBSA-N 388.492 5.506 30 20 GKED COc1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc2ccccc12 742303192 DQVRVIIAVYOUMC-QFIPXVFZSA-N 393.446 5.151 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(C(C)(C)C)cc2)ccc1OC 743477174 PNFSSVSFMBGTII-DYESRHJHSA-N 380.532 5.524 30 20 GKED Cc1cc(-c2noc([C@H](C)ON=Cc3ccccc3C(F)(F)F)n2)ccc1F 744443787 OROVCMZAOIZEOC-LBPRGKRZSA-N 393.340 5.315 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3ccc4ccccc4c3)C2=O)s1 749016923 LXNIBTHOZIDEGN-YVLHZVERSA-N 378.503 5.179 30 20 GKED Cc1ccc(C)c(N=C2NN=C(c3cc(C)n(CC(F)(F)F)c3C)CS2)c1 749948804 AZGXQQHDXMAPAS-UHFFFAOYSA-N 394.466 5.012 30 20 GKED N#Cc1cc2ccccc2nc1NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 750014642 BVSXMBFLOAVQRK-CHWSQXEVSA-N 387.327 5.428 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H]2c2cccc(F)c2)cc1 752185127 NECIGQUKIWCIEG-PKTZIBPZSA-N 385.442 5.460 30 20 GKED C[C@@H]1/C(=C/c2cnc(-c3ccccn3)s2)C(=O)c2cccc(Br)c21 753143850 IQSIMZUTTCIBBN-RLIURORJSA-N 397.297 5.351 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc2sccc2c1 761035282 GZFXPZJGZFIZDM-HNNXBMFYSA-N 389.263 5.169 30 20 GKED FC(F)SCc1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)o1 768993606 WQNXSLQLHRTXNN-IUCAKERBSA-N 397.331 5.298 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(OCc3ccc(F)cc3)c2)cc1 770489943 VYVWFQOOGXKCQV-KRWDZBQOSA-N 376.431 5.308 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CCCc4sccc43)n2)cc1 771578757 OJDIXLLFJDMDRS-SJORKVTESA-N 378.522 5.476 30 20 GKED C#CC[C@H](N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccccc1 773115214 NBCZFLDETZGDLO-CPJSRVTESA-N 395.506 5.329 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2nc(-c3cc4ccccc4o3)cs2)cc1 775320977 JVZKACLICZMKGE-OAHLLOKOSA-N 389.480 5.137 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3ccccc3Oc3ccccc3C#N)cc2)co1 777929709 DNCFNAYBWYXRGD-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC=C(c4ccccc4)C3)c2)cc1 782568238 BRLBRSFAPYUQNT-UHFFFAOYSA-N 381.435 5.282 30 20 GKED C[C@H](NCc1ccc(C#N)cc1)c1ccc(Br)cc1C(F)(F)F 790678245 SHQIDRZBPXCNMR-NSHDSACASA-N 383.211 5.190 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cc(Cl)cc(Cl)c2)cn1 792885023 NGXPADYMNYOKQW-VOTSOKGWSA-N 385.250 5.355 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(F)F 796644479 WTQKKJGGDHNZDI-SNVBAGLBSA-N 389.254 5.584 30 20 GKED CSCc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)oc2ccccc12 797573086 ODVKQILYNXWJQA-ZDUSSCGKSA-N 384.526 5.540 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)c1sc2cc(C(C)C)ccc2c1Cl 798038306 WGFDXTTXXHDDGY-KDOFPFPSSA-N 377.937 5.389 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801682146 MSYYBKCEKWYYJO-OAHLLOKOSA-N 393.302 5.850 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccnc(C(F)(F)F)c3)n2)cc1 808980307 XSZZWVUIFSFELI-AWEZNQCLSA-N 387.386 5.022 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1csc2ccccc12 814298215 FVEZHNHKEKXFJG-OXJNMPFZSA-N 377.513 5.697 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)nc1Cl 817867024 RAJQHUJHPUMREN-GXTWGEPZSA-N 395.812 5.019 30 20 GKED C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C2(C#N)CC2)cc1 819468954 NESDZTAVMFXJJW-IBGZPJMESA-N 399.538 5.214 30 20 GKED Cc1ccc(-c2noc([C@@H](N)CCCCC#N)n2)c(Sc2ccccc2)c1 848627312 XATKRDVUEUHBBJ-SFHVURJKSA-N 378.501 5.280 30 20 GKED CCOc1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915352547 MAJBLQCDSMAZDP-XMMPIXPASA-N 399.494 5.405 30 20 GKED Cc1ccc(-c2ccc(/C=C3/SC(=Nc4c(C)cccc4C)NC3=O)o2)cc1 915983580 OAVJRTMVLDNYPH-DEDYPNTBSA-N 388.492 5.763 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2)CC1)c1nc(-c2ccc(Cl)cc2)cs1 916976422 ODEPLDNVZMLBFP-QGZVFWFLSA-N 378.884 5.372 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 918034486 QSAIKRMWZJSZNS-NLFFAJNJSA-N 397.522 6.184 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2cccc(Cl)c2F)cc1 921137835 NVPLTLOWCQJBNO-UHFFFAOYSA-N 376.863 5.189 30 20 GKED O=C(O)c1ccc(NN=C2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1F 1776074576 ILBAEFUMMSUCFJ-GFCCVEGCSA-N 381.234 5.566 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NNc1cccc(Cl)c1Cl 1776081051 UCNNLIHPHQVKMJ-UHFFFAOYSA-N 395.286 5.268 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cc1)C(=O)O 1776469807 NOERWUYBHGEXNM-ZHZWZMEUSA-N 396.439 5.302 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3)s2)c1)C(=O)O 1776470924 NOIOJNFAPRFEBV-QQBNSCQMSA-N 396.439 5.302 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 45323766 HLJDVBILHMEOSW-XMMPIXPASA-N 395.462 5.235 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cc2ccccc2c2cccnc12 62905868 UDJBTVPQHPILKV-UHFFFAOYSA-N 377.447 5.088 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 66956226 MOUMVRDVEAVWDK-QZTJIDSGSA-N 393.556 5.913 30 20 GKED C[C@@H](C#N)Oc1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 93818167 XZMDGYBAXURSQH-IBGZPJMESA-N 383.495 5.204 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\C2=Cc3cc(Cl)cc(Cl)c3OC2)c1 96315694 XSRCKMRXJCADMW-WAYWQWQTSA-N 388.250 5.167 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(Cl)cc3)n2)cc1 121893874 WXOURNJRIXHFSA-SFHVURJKSA-N 391.883 5.144 30 20 GKED Cc1csc(-c2cccc(NCc3cn(CCC#N)nc3-c3ccccc3)c2)n1 125820237 VZYYLUWZCWWYRG-UHFFFAOYSA-N 399.523 5.508 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 131855338 USZXFSXCEZSWRZ-GJZGRUSLSA-N 386.542 5.209 30 20 GKED CC(C)(C#N)CCC[S@@](=O)Cc1cn(-c2ccccc2)nc1-c1ccccc1 153532501 KYNZTNJQXFMFFK-NDEPHWFRSA-N 391.540 5.118 30 20 GKED N#CCC[C@@H](Nc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccccc1 164343080 DGJGCSOOBRDWKX-MRXNPFEDSA-N 383.377 5.014 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1nc2ccccc2o1 171530590 WVKHUVPSZCSVEO-MRXNPFEDSA-N 379.375 5.126 30 20 GKED COc1ccc([C@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)cc1 172915660 ZJHPNRANNYISEY-QHCPKHFHSA-N 392.886 5.130 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C\c2cncs2)C(=O)c2ccccc2)c(Cl)c1 178321766 UBXOXGSWDRUCII-YVLHZVERSA-N 396.899 5.318 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl 178379293 WSEREUJYFXMMIN-UHFFFAOYSA-N 383.879 5.147 30 20 GKED CCN(C(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccc(C#N)c(Cl)c1 179520533 PERZZIXLIGAWRQ-UHFFFAOYSA-N 399.878 5.065 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)Nc3ccccc3O[C@H](C)C#N)oc12 180026068 PBRDWSMOEWNYEW-HUUCEWRRSA-N 393.443 5.005 30 20 GKED N#CCC[C@@H](N[C@@H]1CCSc2ccc(Br)cc21)c1ccccc1 181576687 FEYSBYPZNDHEHH-QZTJIDSGSA-N 387.346 5.621 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 185355545 CYCPRUZBGNWZFQ-GFCCVEGCSA-N 380.366 5.092 30 20 GKED N#Cc1cc(Br)ccc1N[C@H](c1cccc(F)c1)c1ccccn1 302062712 CZBUYKIMIJNDIQ-LJQANCHMSA-N 382.236 5.056 30 20 GKED CC(=O)c1ccc(C#N)c(N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)c1 302200915 RUKLNOLLRXAQQD-SFHVURJKSA-N 391.471 5.513 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(Br)ccc1OCC 303213341 RYXZBCFWBPCINC-UHFFFAOYSA-N 389.293 5.068 30 20 GKED O/C(=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1)c1sccc1Cl 329162344 FYBRPLXIRVXSDA-ZDUSSCGKSA-N 395.912 5.190 30 20 GKED Cc1nc2cc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)ccc2o1 329506869 ZSFWMMZRHMUQIT-MRXNPFEDSA-N 378.476 5.231 30 20 GKED O/C(=N/[C@H]1CC2(CCCC2)Oc2ccccc21)c1cc(O)nc2ccc(F)cc12 330102742 FXAZDOCJIBVVBV-IBGZPJMESA-N 392.430 5.221 30 20 GKED C=CCC1(C(=O)N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)CCOCC1 424740847 RYNYIXVBTQGDLA-UHFFFAOYSA-N 394.342 5.372 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)cc2)o1 425662409 ZMBXFMPRGTUSIY-MRXNPFEDSA-N 388.471 5.562 30 20 GKED CCOc1ccc(OCC)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 432636431 YDECWWWKOCQGDB-LJQANCHMSA-N 381.476 5.041 30 20 GKED Cc1ccc(N[C@@H]2CCC[C@H](C#N)C2)cc1Oc1ncccc1Br 448355601 OKZLYQRRGJJCPV-LSDHHAIUSA-N 386.293 5.439 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c(C(F)(F)F)c1 454641342 CAZXGJRLONFYOZ-IHRRRGAJSA-N 399.482 5.800 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 455169352 ZDDAAOCDSMAZSF-HNNXBMFYSA-N 377.822 5.834 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccccc1)CC1CCC1)c1ccccc1 458801158 MTQSJUZUHHCYRX-HSZRJFAPSA-N 375.516 5.433 30 20 GKED C=C(C)Cn1c(COc2ccc(C)cc2)nnc1N1CCC[C@H]1c1cccs1 460549242 PUKHBJOJCIZQQK-IBGZPJMESA-N 394.544 5.145 30 20 GKED C[C@H](c1cccc(C#N)c1)c1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 463054871 SBGNRKYRNLHUNP-SNVBAGLBSA-N 394.208 5.540 30 20 GKED C[C@H](C(=O)N(C1CC1)[C@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 463384676 MCAARVQIONXJQJ-LSDHHAIUSA-N 386.417 5.433 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(CN(C(=O)[C@H](C)CC(=C)C)C2CC2)cc1 467724871 UPMBDVWWELEMPK-RBUKOAKNSA-N 382.548 5.321 30 20 GKED Cc1ccc(-c2nnc(SCc3ccccc3C#N)n2Cc2ccco2)cc1 468460268 OBEGNVYKNTWQAO-UHFFFAOYSA-N 386.480 5.059 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)CC1 471399163 MMHNMMRJPCYGAX-UHFFFAOYSA-N 388.298 5.818 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1ccccc1 475379187 HQNBBLIRTWCDDG-HSZRJFAPSA-N 386.470 5.442 30 20 GKED CCS[C@H]1CCC[C@@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 475967449 MNUMUFDYHZTTGQ-PXNSSMCTSA-N 382.554 5.113 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C)[C@H]1c1ccccc1 480821132 GWMVCVONEXDZJQ-KOSHJBKYSA-N 397.478 5.884 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ncccc2Cl)c1 480879943 BVGBLHOZJDLIMA-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COc1cccc(Oc2ccc(CN[C@@H]3CCCCc4cc(C#N)ccc43)cn2)c1 481920668 KGPQKVICHYJNPB-XMMPIXPASA-N 399.494 5.311 30 20 GKED N#Cc1ccc(/C=C(/CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)s1 484471655 VDZPUWZAAIJOPY-UITAMQMPSA-N 394.399 5.264 30 20 GKED C[C@@H](NC(=O)c1ccoc1Br)c1ccc(-c2cccc(C#N)c2)cc1 486145769 OJWSLDLMUXTSPU-CYBMUJFWSA-N 395.256 5.072 30 20 GKED COc1ccc(CN[C@H]2CCC[C@@H](c3ccccc3)C2)cc1OCCCC#N 486904106 SCTRFHCPPKPCJA-YADHBBJMSA-N 378.516 5.194 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)s2)cc1 495096013 ZIGYUTQIZBXFKB-HUUCEWRRSA-N 399.928 5.063 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl 501044532 GQDJIEQSHZDXGJ-INIZCTEOSA-N 381.328 5.440 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2ccc(NCC3CCCC3)cc2)cc1 502385520 HMBZBABHFMXWRL-UHFFFAOYSA-N 376.504 5.734 30 20 GKED N#C[C@@H](NC(=O)c1cccc(-c2cscn2)c1)c1cccc(Cl)c1Cl 505302365 UKTOXRYAHHXYEI-OAHLLOKOSA-N 388.279 5.112 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 505427064 DKPDVMUCGQWREQ-FQEVSTJZSA-N 395.487 5.671 30 20 GKED Cc1ccc(-c2csc(Cn3cc(C#N)c(=O)c4cc(Cl)ccc43)n2)cc1 505525716 HPMRQBPOLARJGQ-UHFFFAOYSA-N 391.883 5.007 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3cccc(C#N)c3F)C2)nc2ccccc21 512455689 IGCCHRQAKDTKNF-IBGZPJMESA-N 376.479 5.008 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ncc(-c2cccc(Cl)c2)o1 512522807 ZIMNYZIYZQZDOJ-UHFFFAOYSA-N 384.911 5.351 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCCc2cccc(C(F)(F)F)c2)cc1 513982334 BCLVIFFWAHLHSE-UHFFFAOYSA-N 389.421 5.261 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518683113 IXYIMOZJEIBJER-INIZCTEOSA-N 385.508 5.522 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 520131924 RKDIVSXATVCTEK-FQEVSTJZSA-N 399.466 5.219 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccccc2F)o1 520827731 ZAORLCQYDQTVLH-AWEZNQCLSA-N 380.444 5.590 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(F)c(F)c(F)c3F)cc2)c1 521316434 MUIGZDBASWXFTQ-UHFFFAOYSA-N 386.304 5.159 30 20 GKED C[C@@H](NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1ccc(C#N)cc1 521606143 GKHGGQLZEYYOPB-OPAMFIHVSA-N 390.483 5.408 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)c1ccc(F)c(F)c1 525140346 LSBZYJHNUZJPDL-HNNXBMFYSA-N 392.405 5.679 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 533443641 IBTJGJGQDNMSFY-IAGOWNOFSA-N 384.570 5.446 30 20 GKED C=C[C@H](CC(=O)NCCc1nc(-c2ccccc2)c(C)s1)c1ccccc1 534671281 OMPWWNSZRBIWDV-GOSISDBHSA-N 376.525 5.137 30 20 GKED N#CCc1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 535348350 BTCQYEVKWOZAIS-OAQYLSRUSA-N 378.834 5.065 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccc(Br)s1)c1ccccc1 541367156 HSKONZXZGCDPGP-ZBFHGGJFSA-N 390.346 5.534 30 20 GKED Cc1ccc(Oc2ccc(Cl)cc2NC(=O)CN2CCC(CC#N)CC2)cc1 542879512 QZWFPLDAFKHOQW-UHFFFAOYSA-N 397.906 5.005 30 20 GKED C=C(C)COc1cccc(NC(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)c1 544232228 SDOPUVFBTRGFNJ-IBGZPJMESA-N 393.531 5.087 30 20 GKED C=CCN(CCC#N)C(=O)c1oc2ccccc2c1CSCc1ccccc1 557398109 WUDIFALYEWHNEX-UHFFFAOYSA-N 390.508 5.408 30 20 GKED C[C@@H]1CC(=O)CC[C@@H]1C(=O)Nc1ccc(Sc2ccc(Cl)cc2C#N)cc1 562954298 ZKZTZTHGHCTWNC-YJYMSZOUSA-N 398.915 5.307 30 20 GKED CC(C)c1scnc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 579415700 PGMUXEGTUJRHNE-JTQLQIEISA-N 389.452 5.158 30 20 GKED CC(C)(C)OC(=O)C1CCC(Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 579532826 DBEXYKFYNUHUFD-UHFFFAOYSA-N 393.487 5.058 30 20 GKED COc1cc(C#N)ccc1CNc1cc(C(=O)Nc2ccccc2)ccc1Cl 580276198 UQZHTCUXYZZYTI-UHFFFAOYSA-N 391.858 5.085 30 20 GKED N#CCCCCCc1nc(-c2ccc(NC(=O)Nc3ccccc3)cc2)no1 589082539 LXBZQTGYRUTSAT-UHFFFAOYSA-N 375.432 5.007 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3sc(C)c(C)c3C#N)cc2)cs1 591589424 OXXNYKZYMYUOOY-UHFFFAOYSA-N 399.566 5.546 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc2cc(F)ccc2s1 592974734 YHAIFSGRWDEAJG-ZDUSSCGKSA-N 380.375 5.325 30 20 GKED CC[C@@H](OCCNC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 593158631 BZXPATHVHCHECC-FXAWDEMLSA-N 397.544 5.228 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C#N)ccn2)c(C(F)(F)F)c1 598809341 VZUVHLIGFQYQMN-LLVKDONJSA-N 379.407 5.115 30 20 GKED N#CCc1cccc(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)c1 603727608 CGRDZRAPSRROMH-UHFFFAOYSA-N 385.448 5.407 30 20 GKED Cc1nc(NC(=O)c2sc3cccc(C)c3c2Cl)sc1SCC#N 603775450 FAXYYQSHCLQCDP-UHFFFAOYSA-N 393.946 5.496 30 20 GKED CCN(CC(C)C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079880 KLSMNOSIDHAPBL-UHFFFAOYSA-N 385.895 5.300 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n[nH]1 609164567 QPRUMEGNHHSRGJ-KRWDZBQOSA-N 378.863 5.094 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3cc4ccccc4n3CC#N)sc2C)cc1 609165058 NZOSALRGZIELRW-UHFFFAOYSA-N 386.480 5.158 30 20 GKED Cc1cc(CNCc2cn(CCC#N)nc2-c2ccccc2)c2[nH]c(C)c(C)c2c1 609599615 BWZXMTCQMFKXMF-UHFFFAOYSA-N 397.526 5.160 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 609660143 NCJLXXDLDWSOEQ-IERDGZPVSA-N 389.886 5.523 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1Cl 609807525 YFDRYIIAYLWMHU-LBPRGKRZSA-N 376.287 5.677 30 20 GKED CC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1cc(F)ccc1F 610146561 DVGSTLIEVMZTBV-NRFANRHFSA-N 385.458 5.155 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2Cl)c1)c1cccc(C#N)c1 610345119 SENWDIYZWTYCPO-QGZVFWFLSA-N 376.887 5.641 30 20 GKED C=CCCCCNCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 639056027 HCDIZUUDZJLGJE-UHFFFAOYSA-N 397.466 5.292 30 20 GKED N#C[C@@H](C(=O)c1scnc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 677709294 GFKFXNRMKKNKEX-JTQLQIEISA-N 393.415 5.139 30 20 GKED CCOc1c(Cl)cc(C=NOCc2ccc(OC(C)C)cc2)cc1OC 726594964 SFAMPHZWAJHPER-UHFFFAOYSA-N 377.868 5.085 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@@H](C#N)C(=O)Nc2ccc([C@@H](C)CC)cc2)cc1 727954731 SZGKGKQWQDCYQV-PNLZDCPESA-N 376.500 5.214 30 20 GKED N#Cc1ccc(OCCCSCc2coc(-c3ccc(F)c(F)c3)n2)cc1 728592024 UTRWVVGWPOJLHO-UHFFFAOYSA-N 386.423 5.194 30 20 GKED O=C(/C=C/c1nccs1)c1ccc(Oc2ccc(Br)cc2)cc1 735232067 HURLUQGLQQSCMU-MDZDMXLPSA-N 386.270 5.594 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1ccc2ccccc2n1 741427308 IMGWWPPJHQWWGN-IKGGRYGDSA-N 396.368 5.113 30 20 GKED Clc1ccc(C=NOCc2ncc(-c3ccccc3Br)o2)cc1 742350826 KPTCSEIMKNAYKH-UHFFFAOYSA-N 391.652 5.308 30 20 GKED COc1cc(/C=C2\Cc3cc(Cl)ccc3C2=O)ccc1OCC(F)(F)F 742437426 NPBCAQWYOHLNHK-AWNIVKPZSA-N 382.765 5.112 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 747109212 YGVIATFOJFVGJQ-IINYFYTJSA-N 395.673 5.098 30 20 GKED CCCOc1c(Br)cc(/C=C\C(=O)c2ccsc2)cc1OC 749102329 QSLMLBDDVJQHIP-PLNGDYQASA-N 381.291 5.204 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)N(C)Cc1ccccc1-c1ccccc1 751189880 GBWKXAZWBGCLFY-UHFFFAOYSA-N 395.462 5.190 30 20 GKED Cn1c(CNCc2cccc(-c3ccc(C#N)s3)c2)nc2cc(Cl)ccc21 752080280 STUDRSXPXRBVMZ-UHFFFAOYSA-N 392.915 5.117 30 20 GKED C#CC[C@@H](NC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 757901522 VFKYJVFAUIVHAV-LJQANCHMSA-N 393.487 5.228 30 20 GKED Cc1c(NCc2cccc(OCCCC#N)c2)cnc(Cl)c1Br 759105387 QHXCJQDJCHEMNK-UHFFFAOYSA-N 394.700 5.101 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccc[nH]1 760743888 VVBDCHHLZHCTJP-KSSFIOAISA-N 378.863 5.206 30 20 GKED C=CCOc1ccc(/C=C/C(=O)c2cc(Br)ncc2F)cc1Cl 762422915 BWGVNZUOOXKJPG-HWKANZROSA-N 396.643 5.098 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 765909473 OCHIQBGYXGILKP-UPVQGACJSA-N 396.494 5.415 30 20 GKED CCC(CSc1ccccc1[N+](=O)[O-])=NNc1nc(C(F)(F)F)cs1 766711229 JXNUBLYHUICUHQ-UHFFFAOYSA-N 390.412 5.040 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1ccc(SCc2ccccc2)cc1 771850406 KMONDNPZPSWVEH-ZHZULCJRSA-N 394.565 5.481 30 20 GKED C=CCC[C@H](NC(=O)Cc1ccccc1CC#N)c1ccc(C(F)(F)F)cc1 777051237 ULRRMQZZOINQLI-FQEVSTJZSA-N 386.417 5.138 30 20 GKED N#C[C@H](C(=O)CCOc1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 780359302 SRMDWBOWJULUOI-GOSISDBHSA-N 390.439 5.234 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](F)CC3CCCCC3)n2)cc1 796662974 UHULMOCYNDUQCC-ROUUACIJSA-N 381.476 5.167 30 20 GKED Cc1oc(C#N)cc1C(=O)O[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 797884773 VTWFZHNMNNZHFG-SNVBAGLBSA-N 391.210 5.340 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C/C(=O)c2nccc3ccccc23)cc1 811698201 IZAGVUHJRFPVLA-JXMROGBWSA-N 399.402 5.001 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)OC(=O)CCCC#N 813071860 YOUNKSVVTBTNPJ-LBPRGKRZSA-N 393.306 5.179 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1 814475539 QMDVXMNIARFGMP-KRWDZBQOSA-N 375.444 5.558 30 20 GKED CCN(C(=O)c1ccc(C#N)o1)[C@H](c1cccnc1)c1csc2ccccc12 815571844 NQAVQTMMEDUPNH-OAQYLSRUSA-N 387.464 5.013 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccccc2Cl)cc1 916947628 OWDDZDSEPCVDNP-GTWLYFKLSA-N 380.875 5.214 30 20 GKED Sc1nnc(-c2ccccc2Cl)n1N=Cc1cc(-c2ccccc2)cs1 917538741 NTDVGWSDEBASFX-UHFFFAOYSA-N 396.928 5.498 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(-c2cccs2)nc2ccccc12 920017337 MWNDMRSDVBCGGJ-UHFFFAOYSA-N 399.475 5.486 30 20 GKED COc1ccc(OCc2nc(/C=C/C(=O)c3c[nH]c4ccccc34)cs2)cc1 920068044 HXOZKTBRKVOVLV-IZZDOVSWSA-N 390.464 5.108 30 20 GKED CC(CCCCCCC(=O)O)=NN=C(C(=O)c1ccccc1)c1ccccc1 1776015072 GQXAUDYVCMWKTP-UHFFFAOYSA-N 378.472 5.160 30 20 GKED O=C(O)c1cc(Br)sc1C=Nn1c2ccccc2c2ccccc21 1776112909 PTEWMYQBLMWNMD-UHFFFAOYSA-N 399.269 5.199 30 20 GKED Cc1ccc(C)c(C(=O)/C=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c1 1776133760 QEKJFOISPZKSEE-XIQMRYHBSA-N 386.447 5.404 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1F 1777353252 FTPNBVQEEBMQRD-YRNVUSSQSA-N 390.410 5.025 30 20 GKED CCCc1nc(C)c(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)s1 32291572 CXKGJCNUABRMFA-UHFFFAOYSA-N 391.496 5.107 30 20 GKED CCN(C(=O)c1sc2cccc(F)c2c1COC)[C@@H](C)c1ccc(C#N)cc1 45500139 FWEMDFHWQUJICF-AWEZNQCLSA-N 396.487 5.282 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 60306232 JWICZKKNJRCBHM-STQMWFEESA-N 375.456 5.516 30 20 GKED Cc1ccc(OCc2nc(CSCCOc3ccccc3C#N)cs2)cc1 60522194 HZVTWIZQRACKPZ-UHFFFAOYSA-N 396.537 5.214 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(Cl)c(F)c2)cc1 63839321 XDMWRNWGFIXNHP-UHFFFAOYSA-N 396.874 5.895 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1C(F)(F)F 92874572 HNMHFBUBSQJOJH-AWEZNQCLSA-N 379.275 5.268 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H]1C1CCC1 102954480 HECAPLXOLOXYLV-HSZRJFAPSA-N 389.499 5.242 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)Cc1cccc(F)c1 108241892 QVDXRECNOKVDAX-UHFFFAOYSA-N 382.382 5.031 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(Oc3cccnc3)c(C)c2)c1 113960722 FTEHTOVVRQSNOJ-OAQYLSRUSA-N 387.483 5.153 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCc4ccccc43)n2)cc1 115909003 XASNWQNVNIVEAO-FXAWDEMLSA-N 388.492 5.115 30 20 GKED C=CCn1c(S[C@@H](c2ccccc2)c2ccccc2C)nnc1-c1cnccn1 124041992 MOEDUCLPIBZMBU-NRFANRHFSA-N 399.523 5.111 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 124361548 PNYPNEUMQPNALL-UHFFFAOYSA-N 381.382 5.173 30 20 GKED CC[C@@H](C)n1ncc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 127919683 PMRNWDUTEFIEQF-BXUZGUMPSA-N 398.919 5.485 30 20 GKED COc1cc(CN[C@H](CCC#N)c2ccccc2)ccc1OCc1cccs1 130450106 LEBYQHHYYFPXTB-OAQYLSRUSA-N 392.524 5.470 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@@H](C)C(C)(C)C#N 131690681 DYILTVLVJYUUGS-LBPRGKRZSA-N 390.892 5.057 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5s4)cn3)cc2)CC1 182491236 ORVPYRQNILHLSK-UHFFFAOYSA-N 396.475 5.166 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 185030389 ROPJPOXZSWNLJB-BNOWGMLFSA-N 390.430 5.098 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](c1ccccc1)c1nccs1)c1ccc(F)c(F)c1 185460440 WYSYQKNMZCUBJZ-RTBURBONSA-N 399.466 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2[nH]c(C(=O)OCC)cc2c1 189880428 SQBCJFXYBDUYOF-UHFFFAOYSA-N 390.483 5.449 30 20 GKED CC(C)c1noc2ncc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc12 193775339 HEKHWVXQZVXETO-ZDUSSCGKSA-N 396.859 5.099 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](CC)Sc2ccccc2)cc1 303503085 RTZGGIXVZUDBAS-OAQYLSRUSA-N 394.540 5.010 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(COC2CCCC2)cc1 303826594 NWDRBFPXDSEAAJ-UHFFFAOYSA-N 378.516 5.408 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCC[C@@H]1[C@H]1CCCC[C@H]1O 328851190 WQDCWBVSCXFUJF-YPAWHYETSA-N 398.547 5.011 30 20 GKED OC(C[C@@H]1CCCC(O)=N1)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329357656 ZYILBGPKNITXIK-AWEZNQCLSA-N 375.444 5.481 30 20 GKED CC(C)[C@@H]1C[C@H](/N=C(/O)c2cc(NC(=O)CC(C)(C)C)ccc2Cl)CCO1 330644454 YIPXGYHLUXPFQP-QAPCUYQASA-N 394.943 5.223 30 20 GKED Cn1c([C@H](C#N)C(=O)c2cc(Cl)ccc2OC2CCCC2)nc2ccccc21 429357723 XDSOQBMSMBZYLA-QGZVFWFLSA-N 393.874 5.038 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430610633 LSIOIYGXVDDNHE-AWEZNQCLSA-N 379.485 5.148 30 20 GKED Cc1cnc(C2CCN(c3c(C#N)cnc4c(F)ccc(Cl)c34)CC2)s1 432878742 QUJPHVBMTMIPFX-UHFFFAOYSA-N 386.883 5.048 30 20 GKED Cc1cc(Cl)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1Cl 433273858 KYONNJZYFNMUFF-QGZVFWFLSA-N 376.287 5.859 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC[C@@H](CC(F)(F)F)C2)cc1 433734521 ATIDMEQGMGOOCX-INIZCTEOSA-N 388.389 5.074 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1 441663200 OCMXXLFUWDJPGD-LMDPOFIKSA-N 393.556 5.991 30 20 GKED CC(C)Oc1ccc(F)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444127662 WQOCDCFMPRLWCI-UHFFFAOYSA-N 379.435 5.124 30 20 GKED C[C@H](CC#N)NC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 444938805 ZCEZERNBECLAQS-LLVKDONJSA-N 386.864 5.166 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nnc(CCc3ccccc3)o2)cc1 463218001 IAHOBYIVTKRDMO-UHFFFAOYSA-N 397.503 5.686 30 20 GKED Cc1cc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C(F)(F)F)o1 472002109 KPDAVKNSQGZHSP-AWEZNQCLSA-N 398.384 5.637 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1NC(=O)c1cccs1)c1ccccc1 475538089 QPELFKVSRQCYGO-QGZVFWFLSA-N 389.480 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)[C@H]1Cc2ccccc2O1 475564467 BEYGCGOZHDCYRV-VGOFRKELSA-N 378.516 5.394 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(Br)c1 476160407 SEFPDABEPYTXDF-UHFFFAOYSA-N 376.269 5.692 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc2c(cc1Cl)OCO2 479936432 ATQPDSADUSXEAB-UHFFFAOYSA-N 385.272 5.004 30 20 GKED N#Cc1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)c(Br)c1 481095385 SDCWIZMNPSOZDM-SFHVURJKSA-N 396.288 5.189 30 20 GKED Cc1sc(NC(=O)c2occc2CN2c3ccccc3C[C@H]2C)c(C#N)c1C 482271114 WIIPTLCKAPHIOF-CYBMUJFWSA-N 391.496 5.033 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCCc4c(F)cc(F)cc43)c2)cc1 482783027 SOGLPNLCNVWLQB-UHFFFAOYSA-N 390.389 5.222 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1cccc(Oc2ccccn2)c1 487389488 DNHUFSKHUSMNIH-UHFFFAOYSA-N 391.496 5.203 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)CC(C)(C)C#N 498889452 JRFQMFJVDISOKP-UHFFFAOYSA-N 392.478 5.610 30 20 GKED N#CC1(CCCN[C@@H](c2ccccc2)[C@H]2CCCc3ccccc32)CCOCC1 499611668 OXVPSDCEJGBFKT-DQEYMECFSA-N 388.555 5.538 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Oc2ccc(F)cc2Cl)c2ccccc2)cc1 499748252 JDIZVBIDWKRYHO-OAQYLSRUSA-N 394.833 5.304 30 20 GKED CC(C)C[C@H]1CCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 501127622 CLIHIVCRXHSZIA-JOCHJYFZSA-N 391.515 5.374 30 20 GKED COc1c(Cl)cc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1Cl 502532481 SJGPWHVMRJRSAT-UHFFFAOYSA-N 394.258 5.329 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 505427066 DKPDVMUCGQWREQ-HXUWFJFHSA-N 395.487 5.671 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NCc1cc(C#N)ccc1Br 509496248 ZVMRLKOJPBYXCT-UHFFFAOYSA-N 392.300 5.227 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2cc(C#N)ccc2Cl)c1 512792040 HSVKEUUXRSENDS-UHFFFAOYSA-N 384.810 5.427 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 517518027 ZLPKUURRTBCONY-LJQANCHMSA-N 399.494 5.118 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cccc2ccccc12 520856769 QIOHAXICMMCYRQ-KRWDZBQOSA-N 389.524 5.755 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1-c1nccs1 520929358 WNSRVMAOIPBSRZ-AWEZNQCLSA-N 396.541 5.197 30 20 GKED CCN(CC)C(=O)[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 522547759 SJXRUQLHBPALOU-DEOSSOPVSA-N 399.494 5.372 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)c2c1 525559457 RUQWTHHXAWUUKC-UHFFFAOYSA-N 399.475 5.404 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(OCc2cccnc2)cc1 525885973 XNZSDBLYSSYGRZ-MRXNPFEDSA-N 377.875 5.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc2ncsc2c1 530447177 NAWJWRNNXNQUBP-HNNXBMFYSA-N 379.529 6.031 30 20 GKED CC(C)(C#N)CCCN[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl 531648078 VTNSNBKLERTJMN-NRFANRHFSA-N 384.907 5.120 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(-c2csnn2)cc1 537571257 CMFVTMCOJUEESB-UHFFFAOYSA-N 398.447 5.121 30 20 GKED COc1ccc(C[C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccc(OC)cc2)cc1 538397697 SWQDKMGSOIWQMX-AVRWGWEMSA-N 386.495 5.210 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(CCC(F)(F)F)cc2)c(C#N)s1 539173933 KNQWEMBPVGMFCM-UHFFFAOYSA-N 380.435 5.664 30 20 GKED C[C@H](NCc1nc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541085654 IAYJJKWTISUYAT-KRWDZBQOSA-N 380.451 5.126 30 20 GKED C[C@H](NC(=O)N(C1CC1)[C@@H](C)c1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 543943244 FWYHVLYNLGUNID-ROUUACIJSA-N 399.494 5.814 30 20 GKED C=CC[C@@H](C(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 547954278 FLGMTGOBPYDTNM-YADARESESA-N 386.495 5.198 30 20 GKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc2ccccc2c1OC(F)F 551813945 VIFPISNZQYUAKO-HNNXBMFYSA-N 378.422 5.653 30 20 GKED C=CCc1cc(C(=O)Nc2ccc(-c3ccncc3)c(C)c2)cc(OC)c1OC 553239990 NWIQFJHPXXVHDP-UHFFFAOYSA-N 388.467 5.055 30 20 GKED N#Cc1ccc(CNc2ccccc2OC[C@H]2CCCCO2)c(C(F)(F)F)c1 562575916 MRXZOURYIKZFDE-QGZVFWFLSA-N 390.405 5.137 30 20 GKED N#CCCC1CCN(C(=O)c2sc(-c3ccco3)nc2-c2ccccc2)CC1 583936450 BYNFAAJJHZZBKB-UHFFFAOYSA-N 391.496 5.226 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 590942453 JOSCRVANYBEFKG-LJQANCHMSA-N 389.421 5.282 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)oc12 592975356 CBWIECKCGFVUGK-AWEZNQCLSA-N 378.428 5.597 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N2Cc3ccc(C#N)cc3C2)c1 594069275 NXZSVNHJNVZYMW-UHFFFAOYSA-N 391.418 5.069 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)C1 596730993 KLQVXAYAAAVSJE-AWEZNQCLSA-N 394.475 5.260 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N1CCC[C@H](CC#N)C1 596793892 QLCWRFALQJJVIC-CQSZACIVSA-N 386.293 5.068 30 20 GKED CCc1ccc(CCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 603601083 NCQTXBPPRRLTRG-UHFFFAOYSA-N 385.467 5.188 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 603656464 ZVTKHMNLSUMQTP-JOCHJYFZSA-N 391.515 5.646 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(F)cc1C(F)(F)F 606191513 WSNXXOLBJQJIOP-SNVBAGLBSA-N 393.302 5.681 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2nc(C)cs2)c1 608841571 UYYFCPAZPPKNQM-UHFFFAOYSA-N 390.512 5.434 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)Cc3c[nH]c4cc(Cl)ccc34)c2C#N)C1 609018556 FNJYHRGJQNDUCZ-LLVKDONJSA-N 383.904 5.060 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 609075939 SSUUNHOFJCNCGI-UHFFFAOYSA-N 385.467 5.076 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccccc1S[C@H](C)CC#N 609430390 UPAQKTWLRAXNPL-CQSZACIVSA-N 376.485 5.032 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 609636234 GZCNHCMYTPIJMD-PXNSSMCTSA-N 393.556 5.486 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccccc2OCc2cccc(Cl)c2)c1 609931135 CRYINLNGTNRZKH-UHFFFAOYSA-N 391.858 5.112 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc2ccccc12 615761921 CDFGPHXGHCTPHZ-XMMPIXPASA-N 397.522 5.986 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(OC(F)F)c1 619124295 NUFQETAHSPSJNR-UHFFFAOYSA-N 393.274 5.071 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)c(Cl)c1 619423371 FMALPYBVDSPUGY-DZGCQCFKSA-N 377.246 5.070 30 20 GKED CCCCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 619756520 RNEPHTTVGIVNJZ-HXUWFJFHSA-N 385.492 5.514 30 20 GKED C=CCn1c(SCc2nc(CCC)no2)nnc1-c1ccc(C(C)(C)C)cc1 629143903 BEABPBWQDHFXNL-UHFFFAOYSA-N 397.548 5.056 30 20 GKED C=CCC1(CNCc2csc(N(C(C)=O)c3ccc(OC)cc3)n2)CCCC1 639248649 DLANWEHZTWGAQX-UHFFFAOYSA-N 399.560 5.062 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)ccc1F 675737356 GAALXMNSIMOKSV-IVZWLZJFSA-N 375.303 5.525 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2c1 676997609 CWDRHQPTWLZCCR-FQEVSTJZSA-N 393.446 5.159 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1[nH]c(-c2ccccc2)nc1C 726425695 BTYURXLPPUOQNT-UHFFFAOYSA-N 383.377 5.112 30 20 GKED N#Cc1c(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)sc2c1CCCC2 726912289 XHPQQMQJUDLDMS-FQEVSTJZSA-N 380.513 5.138 30 20 GKED N#C[C@@H](NC(=O)c1sc2ccccc2c1Cl)c1c(Cl)cccc1Cl 730092354 GNFDDSSRBKLRGO-GFCCVEGCSA-N 395.698 5.856 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730417305 OUXQGCNAUOHKOI-YOEHRIQHSA-N 396.487 5.511 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(Cl)c(Cl)c1 731319813 HTTNQPOTEQGZJN-LLVKDONJSA-N 396.368 6.197 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3oc4ccccc4c3c2)c1 733842177 RBEHJTDJROQFQB-SFHVURJKSA-N 399.450 5.589 30 20 GKED C=CC[C@@H](NC(=O)N(CC)Cc1ccc(Cl)c(Cl)c1)c1ccncc1 734679799 JZRMOTMQDSCIGA-GOSISDBHSA-N 378.303 5.237 30 20 GKED Cc1ccc(/C=C2/CC(O)(C(F)(F)F)C/C(=C\c3ccc(C)s3)C2=O)s1 735793047 QJLKLFBTGJFMEQ-MFUUIURDSA-N 398.471 5.550 30 20 GKED O=C(/C=C\c1ccc(OC(F)F)c(Cl)c1)c1c(Cl)nc2ccccn12 737449052 METWEVYDNXASQQ-XQRVVYSFSA-N 383.181 5.139 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@@H](CC)c1ccc(C)cc1 739153296 AIVHQCJSZFZEQL-IFMALSPDSA-N 390.527 5.351 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nccs1 740435952 XXTCPIYJNOWCEX-DENIHFKCSA-N 390.512 5.245 30 20 GKED CC(C)(C)n1cc(CNCc2cc(C#N)ccc2F)c(-c2ccccc2Cl)n1 742381821 LLLFISABLBXUCW-UHFFFAOYSA-N 396.897 5.259 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1SCc1ccccc1)c1cccc(C#N)c1 743081272 BGBVIDOSHQNZID-QGZVFWFLSA-N 387.508 5.733 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1cccc(Cl)c1 744031399 VWAGCKDGOIVQCH-QMTHXVAHSA-N 395.673 5.098 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)nc2Cl)cc1 747637607 NRYMMDSKSYAVMP-QGZVFWFLSA-N 382.250 5.296 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(F)c(Cl)c2Cl)c2ncc[nH]2)c1 761475355 DTIXWPJBEDZWIT-GXDHUFHOSA-N 391.229 5.288 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(Cl)cc(Br)c2F)cc1 767752839 AIWZSTFLVSCDHK-UHFFFAOYSA-N 395.659 5.111 30 20 GKED CC1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)Cc2ccccc2C1 768867848 JSXZQVVSEJSPLH-QHCPKHFHSA-N 381.479 5.021 30 20 GKED Cc1cc2c(cc1C)[C@@H](C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CO2 769862681 OWHDYWGHSAQQDS-GOTSBHOMSA-N 382.463 5.074 30 20 GKED CC[C@@H](C)n1nc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 775489691 XQLGBIMEFKLMLH-IERDGZPVSA-N 387.487 5.462 30 20 GKED O=C1/C(=C/c2csc(-c3cccs3)n2)CCc2ncc(C(F)(F)F)cc21 777468123 OYKKMCQWSYQMRL-UXBLZVDNSA-N 392.427 5.498 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 787431508 NQBDIZKBBLEUTR-VQTJNVASSA-N 399.416 5.111 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2cnc(-c3ccc(Cl)cc3)s2)c1 789127016 JOTKPUVAPPNJRP-KTKRTIGZSA-N 382.872 5.318 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(Br)cc1 792091599 LTRQMQOJUPTVKX-KUHUBIRLSA-N 393.284 5.367 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2SCCS2)cc1)c1nccc2ccccc12 792096214 ZNYAQDDYWVQUTB-GOSISDBHSA-N 376.506 5.203 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cc(Cl)sc2Cl)cn1 792868513 FUTBPCJJUHZABM-VOTSOKGWSA-N 391.279 5.417 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)o1 794289551 VTDJTSCUKIXLKQ-UHFFFAOYSA-N 386.329 5.001 30 20 GKED N#Cc1cccc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c1 796468205 CXPXLCQOLISRJT-KRWDZBQOSA-N 378.690 5.241 30 20 GKED CN(CCC#N)c1ccc(CN[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)cc1 797880524 SLUNZKYUXJQDMU-KESTWPANSA-N 387.449 5.091 30 20 GKED CC1(C)C[C@@H](OC(=O)CCCCCC#N)c2cc(Br)ccc2O1 805962692 VCMJZNYBOKTMDK-MRXNPFEDSA-N 380.282 5.069 30 20 GKED CC[C@@H](NC(=S)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccs1 811708475 ZNHBJAXHFLKXNQ-GOSISDBHSA-N 394.525 5.245 30 20 GKED N#Cc1sc(NC(=O)[C@@H](Sc2ccccc2)c2ccccc2)nc1Cl 813369614 CVTRMTDIKWAQGS-HNNXBMFYSA-N 385.901 5.140 30 20 GKED C[C@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccc(N2CCCOC2=O)cc1 814264509 UXOPRBSYWYGHIR-ZDUSSCGKSA-N 389.377 5.097 30 20 GKED CC(C)(C)c1csc(NC(=O)N2CCC(C(=O)c3ccccc3)CC2)c1C#N 821487978 IDSIHZPAHCCMNL-UHFFFAOYSA-N 395.528 5.044 30 20 GKED C=CCC(C)(C)C(=O)N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1 837844161 GZMMOUVNMBZGQN-UHFFFAOYSA-N 386.536 5.342 30 20 GKED C[C@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790587 IOJBNLUSQWVSFB-APPZFPTMSA-N 380.313 5.080 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c(Cl)cccc2Cl)cc1 915087359 SGAOUGJSRAYNNE-LJQANCHMSA-N 395.289 5.830 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915354068 UMXCKHZYKNXFNV-UUOWRZLLSA-N 399.494 5.576 30 20 GKED Cc1c(O)nc2ccccc2c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 1442232484 JDSGZNBICGXHDZ-UHFFFAOYSA-N 395.418 5.165 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776106008 NCJRPLZYNUFLPW-HNNXBMFYSA-N 392.455 5.159 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cc1)C(=O)O 1776126766 WLULMXCRESLLJP-NDCSFFLDSA-N 388.419 5.227 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2cccc(F)c2)s1 1776783072 WNQSJGXLFMIJGK-SFHVURJKSA-N 377.525 5.848 30 20 GKED CCCCCCCOc1ccc(CNC2(C(=O)O)CCC(C)(C)CC2)cc1 1776786468 LZQBYSZMSLNUSD-UHFFFAOYSA-N 375.553 5.549 30 20 GKED COc1ccc(C(=O)O)cc1/C=C\C(=O)c1sc2c(Cl)cccc2c1C 1777354596 BKZMIEAOOAZNHQ-VURMDHGXSA-N 386.856 5.466 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1C(=O)O 1777360843 VZNVTHUQQHNDIY-WAPJZHGLSA-N 382.412 5.157 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1cn(-c2ccccc2)nc1C(C)(C)C 1777436394 QPUWFBDVAZUTFY-SEYXRHQNSA-N 388.467 5.073 30 20 GKED COc1ccc([C@@H]2C[C@H]2/C(=N/c2ccsc2C(=O)O)c2ccccc2)cc1 1857777178 MVMWXAVSPAGSHI-QVYPKILJSA-N 377.465 5.379 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2ccccc21 66953845 FWEQSNYFUPGQAG-DOTOQJQBSA-N 381.501 5.116 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C)O[C@H](c2ccccc2)C1 66954895 IWPOPUFMXTYWPT-UWVAXJGDSA-N 395.528 5.075 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 66956277 UBEANTZHFSPFAP-JKSUJKDBSA-N 393.512 6.052 30 20 GKED N#Cc1c(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])sc2c1CCCCCC2 110234325 MVQKYYCSAJJONP-UHFFFAOYSA-N 389.864 5.093 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)c2cc(Cl)sc2Cl)CC1 110534402 MWGAGPVPNGOPRT-UHFFFAOYSA-N 395.311 5.047 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccsc1 120188288 UPMYBQFAMUIDLG-LLVKDONJSA-N 384.448 5.515 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 120800088 DCBSLLAWPRWBLH-UHFFFAOYSA-N 383.816 5.101 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC/C=C/c3ccccc3)n2)cc1 122013682 WHVZNIZXTJIRSG-MVHVFESUSA-N 388.492 5.489 30 20 GKED C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(C)(C)C#N 131555073 DGNYHZODHJTPGS-LLVKDONJSA-N 381.259 5.062 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)c1nc(-c2ccccc2)cs1 155436092 JVARYHWUXLAZMF-CYBMUJFWSA-N 388.279 5.363 30 20 GKED CCN(Cc1csc(-c2ccccc2OC)n1)[C@@H](C)c1ccc(C#N)cc1 172650955 WNCCQJVXPHYILB-INIZCTEOSA-N 377.513 5.273 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCSC2(CCCCC2)C1 177088691 HQGJCRTUCPHVLS-MRXNPFEDSA-N 389.590 5.222 30 20 GKED C=CCc1ccc(OCC(=O)Nc2ccc(Nc3ccccc3)cc2)c(OC)c1 302170109 IXKKYVTWQJUCDX-UHFFFAOYSA-N 388.467 5.185 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N(CCC#N)Cc2ccco2)cc1F 303694336 QJZPKEKJMBBCKQ-UHFFFAOYSA-N 380.394 5.089 30 20 GKED CCC(C)(C)C1CCC(C/C(O)=N/[C@@H]2CCO[C@H](c3cncn3C)C2)CC1 328667311 DKBSBMRIFHSZLW-ZZVGESKWSA-N 375.557 5.229 30 20 GKED COc1c(Cl)cc(N=C(O)N2CCC(OCCC(C)C)CC2)cc1Cl 330448446 WZFAIKFSAJGHIU-UHFFFAOYSA-N 389.323 5.075 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1ccccc1C(F)(F)F 425420378 SAGVBBRNLFOTHK-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 429233593 XCOHBWZZKYGGGC-UHFFFAOYSA-N 376.460 5.288 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1cccc(SCC#N)c1 429938748 CMRGQHBNAVIHGK-GFCCVEGCSA-N 379.312 5.442 30 20 GKED CC(C)c1ccccc1-n1c(S[C@H]2CC[C@H](C#N)C2)nnc1-c1cccnc1 430100654 MAXIDDRSMJLRAU-WMZOPIPTSA-N 389.528 5.237 30 20 GKED Cc1c(Br)ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c1F 433734980 GWQASTLOSYGLSV-OAHLLOKOSA-N 390.256 5.063 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)c3cc(C#N)cs3)cc2c1 435925867 HGWYSTHQCTZLGX-UHFFFAOYSA-N 376.437 5.110 30 20 GKED CCCc1c(NC(=O)c2occc2-c2ccccc2)cnn1-c1cccc(C#N)c1 440078762 NJMBGGKPQWPQFQ-UHFFFAOYSA-N 396.450 5.209 30 20 GKED CCCc1c(NC(=O)c2cccc(SCC)c2)cnn1-c1cccc(C#N)c1 440085307 BGLLJTAMWIGRAS-UHFFFAOYSA-N 390.512 5.061 30 20 GKED C=CC[C@@H]1N(C(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)CCCC1(C)C 443872245 ZACRDUWOIZVUAC-QFIPXVFZSA-N 390.527 5.170 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1C 446896965 TYFHXWYNFOWMHK-QGZVFWFLSA-N 382.451 5.448 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c(C)n1C1CCCCC1 464467679 NOXNSIWEGLYSRP-GOSISDBHSA-N 389.421 5.514 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1ccccc1-c1ccccc1 464819156 RJAXLBGSVXLTAK-UKILVPOCSA-N 395.506 5.064 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1Cl 467277745 JGUYRUUPGJDWCD-CQSZACIVSA-N 387.817 5.698 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 467449201 ILSXBVJBSGIMQZ-NRFANRHFSA-N 393.849 5.456 30 20 GKED C[C@H](CCC#N)Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 470447311 XWJWCVHTUQTVEK-OAHLLOKOSA-N 382.920 5.431 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2cccc(C#N)c2)C1 471870904 MAPVKQJEFUNAJW-QFIPXVFZSA-N 391.515 5.240 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2csc(-c3ccc(Cl)cc3)n2)n1 474445229 LEHFUVNIVZDSHD-ZDUSSCGKSA-N 387.917 5.533 30 20 GKED CO[C@H](C)c1nc(CN(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)cs1 476825085 IAXRWVVWXVIVGZ-MRXNPFEDSA-N 395.503 5.377 30 20 GKED CC1(c2ccc(Cl)cc2)CCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1 477154014 WEMHWMHJPFVDRS-IBGZPJMESA-N 380.919 5.308 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F 477524408 CHOFPLGTIKNNET-WFASDCNBSA-N 387.471 5.569 30 20 GKED CC[C@H](CN(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 480564797 SBRDFRUWYAIXHT-RTBURBONSA-N 395.572 6.128 30 20 GKED CCN(CC1CC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 485442306 YHBQEVGBELBSJC-UHFFFAOYSA-N 383.879 5.054 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1ccccc1S[C@H](C)CC#N 497577734 HTSWSIKRCAFXAA-DLBZAZTESA-N 389.524 5.446 30 20 GKED Cc1c(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cnn1CC(C)C 499557996 PIPMMFMSJJFPFG-UHFFFAOYSA-N 389.459 5.156 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(C(F)(F)F)c1 505980379 AVTNUMAIZGSWGV-JTQLQIEISA-N 379.190 5.068 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(SC(C)C)cc1 508582165 YYPBHIDYEQSAII-SFHVURJKSA-N 395.572 5.742 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)Nc1ccc(CC#N)cc1 512115381 LDODCYUWZOCYFW-GFCCVEGCSA-N 395.812 5.254 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCSc1ccccc1Cl 517522811 ZKMHGHLCZZEITM-AWEZNQCLSA-N 390.961 5.855 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1cccc(Cl)c1Cl 518684917 RBLCJTBCGSLMEI-GFCCVEGCSA-N 394.327 5.567 30 20 GKED CCc1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 519105585 ZNCWRSQPZIXOLJ-GOSISDBHSA-N 380.900 5.872 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3[nH]c4ccccc4c3Cl)c2)cc1 519122793 XXRZIADPEJPKED-UHFFFAOYSA-N 387.826 5.738 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N(CC2CC2)C2CCCCC2)cc1 522088941 PSDKTNZBICDJAM-UHFFFAOYSA-N 395.547 5.077 30 20 GKED N#C[C@H](C(=O)c1csc(-c2c(F)cccc2F)n1)c1nc2ccccc2s1 522527923 DDUMVAXPDABRBB-SNVBAGLBSA-N 397.431 5.188 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1ccnc(Oc2ccccc2)c1 523184153 MPALXKUADVTCCT-UHFFFAOYSA-N 395.418 5.186 30 20 GKED CC(C)c1cc(Cl)ccc1NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1 529245610 VYNYUAJCMJVBEY-UHFFFAOYSA-N 397.906 5.410 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccccc2C)C1 530447173 JFYTVKRYYXHPKQ-JOCHJYFZSA-N 378.516 5.452 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(Cl)c1 533485783 PBLGTZRQKMFSGI-OAHLLOKOSA-N 387.936 5.057 30 20 GKED C/C(=C\c1cccc(OCc2ccccc2C#N)c1)c1nc(O)c2ccsc2n1 537652054 LQTBTDPBGQGYNI-RVDMUPIBSA-N 399.475 5.408 30 20 GKED CSc1ccccc1NC(=O)[C@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 541075970 SKOYQWIVIRSPDI-NSHDSACASA-N 396.459 5.418 30 20 GKED N#CC1(c2nc(-c3ccc(NC(=O)Nc4ccccc4)cc3)no2)CCCCC1 544057095 JEDMEGUQOHHXNX-UHFFFAOYSA-N 387.443 5.106 30 20 GKED Cc1ccsc1CN(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 549195711 ZFSPZFFKHUOKBT-UHFFFAOYSA-N 376.481 5.187 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCc1ccc(Cl)c(Cl)c1 553000011 ZYUXDYGEOKNJKD-UHFFFAOYSA-N 393.339 5.961 30 20 GKED CCOC(=O)c1oc2c(c1C)[C@@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 556202362 MOWMTTHNRNECHS-OALUTQOASA-N 380.488 5.167 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Cl)cc1OCC(F)F)c1ccccc1 557933999 RKEZZZRPYRSNSG-CQSZACIVSA-N 378.806 5.010 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccccc1 560594518 FQQBDTPVTUNZIN-DEOSSOPVSA-N 391.474 5.677 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1N1CCCCC1 578228866 XVEBWYRZVAAYNC-UHFFFAOYSA-N 395.551 5.065 30 20 GKED CC[C@@H](C)c1nc(C)c(CC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1 593976474 WRTBTJGUPZKOJU-HUUCEWRRSA-N 396.560 5.182 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccs3)cn2)cc1 603690591 LXJKEAFNUQTKTJ-SFHVURJKSA-N 390.468 5.176 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c1 604086557 LPASPMQMXDXZPQ-QFIPXVFZSA-N 398.466 5.423 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 609376695 HYAXYRZLLNOAHP-SOAMZJECSA-N 388.577 5.354 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2ccc(C#N)cc2)c1)c1ccccc1 610000302 XTRVSMKNKOQLEB-UHFFFAOYSA-N 375.859 5.100 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 610387535 BZPHCCJMWTWNGZ-AWEZNQCLSA-N 379.460 5.028 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2Oc2cccnc2)cc1C(F)(F)F 610388493 UYGCWMCQHOVVFI-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H](C)c1cccc(C#N)c1 610543459 WCGYMDPROKMGPU-KGLIPLIRSA-N 395.915 5.118 30 20 GKED CCCCOc1ccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1OC 614178761 CVOBUNRCVRXNLP-SFHVURJKSA-N 380.532 5.526 30 20 GKED CC(C)n1ncc2cc(NC(=O)c3cn(CCCC#N)c4ccccc34)ccc21 618216051 PJYJTYDVPQGGLO-UHFFFAOYSA-N 385.471 5.128 30 20 GKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(OC(F)F)cc1OC(F)F 618803759 IPKYIMYKFOHXMC-APPDUMDISA-N 394.368 5.099 30 20 GKED COc1ccc2oc(C(C)=NNc3ncnc4sc(C)c(C)c34)c(C)c2c1 729140193 AJYBDGGGCIGHRQ-UHFFFAOYSA-N 380.473 5.207 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730418625 XYDZLQQUCFUPMA-MRXNPFEDSA-N 382.460 5.123 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730422029 SBGKVCMAUHZOMI-GUYCJALGSA-N 382.460 5.203 30 20 GKED C[C@H]1C[C@H]1c1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)o1 732763790 HUMJWNJHQKWLOK-JOYOIKCWSA-N 393.299 5.139 30 20 GKED CC(=O)Nc1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1C 733622633 WNNCNJNHZXBMQA-QFIPXVFZSA-N 398.466 5.253 30 20 GKED CCOc1cc(/C=C/C(=O)c2c[nH]c3ccc(OC)cc23)cc(Cl)c1OC 734306150 AYKUSTSAWPVEJP-VMPITWQZSA-N 385.847 5.133 30 20 GKED O=C1/C(=C\c2csc(-c3ccc4c(c3)OCO4)n2)Cc2cc(Cl)ccc21 742436649 DLGHPHLOGQNXSA-QPEQYQDCSA-N 381.840 5.015 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)s1 742646343 LZAQOZJPLDQWGZ-NPQIQWPPSA-N 394.327 5.142 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccc(F)cc1 743462076 FAPWRGYAQHVPJE-RZXPCSSPSA-N 398.409 5.507 30 20 GKED C[C@H](NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 743777027 NEIRIUANAYTOEF-ZCRIDZFUSA-N 378.781 5.121 30 20 GKED CC(C)c1nc(C#N)c(NN=Cc2sc(Oc3ccccc3)nc2Cl)o1 745613285 DCCOGFUWMMKFIB-UHFFFAOYSA-N 387.852 5.018 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)c(C)n1C1CCCCC1 748585518 ZXHFVUOVAVUGKH-RAXLEYEMSA-N 392.499 5.463 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N(C)C2CCCCCCC2)cc1 748985841 LEICJZVMVZCEAE-UHFFFAOYSA-N 383.536 5.077 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1cccc(Cl)c1 750684276 OYTYVMVEZPEINZ-LFDGNKEFSA-N 388.854 5.244 30 20 GKED CC1(C)CCCC[C@H]1CC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 752473874 MTXGERRVGYSQPK-DZGCQCFKSA-N 397.544 5.058 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(N2CCCCC2)c(F)c1 753142059 NPDHTHGQUJVFTP-ALCCZGGFSA-N 393.487 5.231 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cn1 779280101 COPVGIHCBKUZNP-UHFFFAOYSA-N 395.871 5.395 30 20 GKED CSCCCCCCNC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782196333 WMOQIVFKEDSFKA-OAQYLSRUSA-N 397.613 5.552 30 20 GKED COc1ccccc1NC(=S)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782204277 KWQZAJOQHQLIGU-MRXNPFEDSA-N 387.508 5.281 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCc2ccc(O)c(F)c2)cc1 786764233 AHEAPLQURWQUMP-NRFANRHFSA-N 388.442 5.148 30 20 GKED CC(=C\c1cccc([N+](=O)[O-])c1)/C=C1/SC(=Nc2c(C)cccc2C)NC1=O 787170261 WHHNLSDJZHSKDJ-HWVXOFFASA-N 393.468 5.050 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cc(F)cc(C#N)c1 795204650 KAMUWENUCSLVLB-HSZRJFAPSA-N 397.453 5.269 30 20 GKED C[C@H](OC(=O)c1ccc(C#N)o1)c1ncc(-c2ccc(Cl)cc2Cl)o1 796148961 UFXGRJKEKKMRSN-VIFPVBQESA-N 377.183 5.031 30 20 GKED C=C[C@H](CC(=O)O[C@@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 798206940 CTFDINMBLGOEPH-ACJLOTCBSA-N 375.346 5.334 30 20 GKED CC(C)(CCC#N)COC(=O)c1ccc(SCc2cn3ccccc3n2)cc1 798877063 DQMWDZXRVNSXCY-UHFFFAOYSA-N 393.512 5.113 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)ccc1SC(F)F 800990357 OGPYLAFNUDKCMD-LLVKDONJSA-N 382.863 5.386 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(F)(F)F 801612811 QUGZHDCSGVKTER-KRWDZBQOSA-N 375.394 5.052 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2csc(-c3ccccc3)n2)C(=O)c2ccccc21 802708971 MTLIFUOWAZSGHK-WNJRYGEDSA-N 389.476 5.127 30 20 GKED CC[C@@H](C)n1c(Sc2nc(Cl)c(C#N)s2)nnc1-c1ccccc1 804399947 AXFJEGBDQDCOTF-SNVBAGLBSA-N 375.910 5.049 30 20 GKED C#CC[C@@H](NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1)c1ccccc1 805234875 SHGQYATUOIIGSA-YADHBBJMSA-N 382.454 5.023 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1 825428994 FHOOPRJITQDDKX-GOSISDBHSA-N 398.551 5.224 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2coc(C3CC3)n2)cc1)C(F)(F)F 842733680 LYQKBYCXQNEMKN-UHFFFAOYSA-N 382.279 5.454 30 20 GKED C[C@@H]1CCCN(Cc2ccc(NCc3cc(C#N)ccc3Br)cc2)C1 864004518 MMJXNFAGRQVHNB-MRXNPFEDSA-N 398.348 5.165 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N(O)Cc2cc(Cl)cc(Cl)c2)c1C1CC1 901378917 MHHRQLOKCAAPIV-LLVKDONJSA-N 382.291 5.070 30 20 GKED CC(C)n1ncc2cc(/C=C3\CSc4c(F)cccc4C3=O)c(Cl)nc21 913617842 VYJJLCWUHUUNMN-NTUHNPAUSA-N 387.867 5.177 30 20 GKED COc1ccc(-c2ccc(/C=C\C(=O)c3ccc(F)cc3F)o2)c([N+](=O)[O-])c1 916128010 CVUPNJBJTKVIMM-YWEYNIOJSA-N 385.322 5.038 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)c(C)n1[C@H](C)c1ccccc1 916845214 QVGNBMIUAGKZAN-DYESRHJHSA-N 396.494 5.091 30 20 GKED CCc1ccc(C(=O)/C=C/c2csc(COc3ccc(OC)cc3)n2)s1 920064127 PTCJHKDWPHWDER-ONNFQVAWSA-N 385.510 5.251 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccsc1C(F)(F)F 1776354860 CMHDRRAWIVEGGI-HWKANZROSA-N 384.375 5.148 30 20 GKED CC(C)c1cc(O)cc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776369329 QARNWEOJSFIZDR-BAQGIRSFSA-N 376.408 5.370 30 20 GKED COCc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1777232289 GJHJGIYFHGYKJY-ZROIWOOFSA-N 386.447 5.023 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(F)cc3)o2)nnc1-c1ccccc1 11056246 FMZJLPGTQYDFAC-UHFFFAOYSA-N 392.459 5.218 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2ccc(Cl)cc2)[n+]2ccccc2)c1 14872002 PCCFTAIBZISGPX-UHFFFAOYSA-O 395.935 5.241 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1SCc1cccc(C#N)c1 25619534 BTPFEILENXFIIV-UHFFFAOYSA-N 392.528 5.067 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)ccc1C)=C(/S)NC1CCCCC1 27329849 YIRDULGBOVNPOD-UHFFFAOYSA-O 395.592 5.014 30 20 GKED C[C@H](NC(=O)C1(c2ccc(Br)cc2)CCCC1)c1ccc(C#N)cc1 33180092 DORCYAWOOOGCIJ-HNNXBMFYSA-N 397.316 5.010 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OC(F)F)cc3)n2)cc1 46443317 UVXBITOMGKCRDE-INIZCTEOSA-N 384.407 5.210 30 20 GKED Cc1ccc(F)c(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)c1 65940495 VQGVMPRJCUKSAB-UHFFFAOYSA-O 393.507 5.089 30 20 GKED C#CCOc1cccc(NC(=O)c2ccccc2SCc2csc(C)n2)c1 78667766 NHPYTDHXKNFDQS-UHFFFAOYSA-N 394.521 5.008 30 20 GKED CCOc1ccc(SCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 108146930 XRFJBVMRQKOHEM-HNNXBMFYSA-N 386.542 5.210 30 20 GKED CCc1ccc(-c2noc(CNc3ccccc3S[C@@H](C)CC#N)n2)cc1 109002887 BRBHRDRFMBQWJM-HNNXBMFYSA-N 378.501 5.305 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccccc1O[C@H](C)C#N 180053092 QLSISNPOMQBIGB-MSOLQXFVSA-N 377.488 5.373 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 193685286 JECWNHNWWPBDNG-OAQYLSRUSA-N 386.455 5.058 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C[C@H]1C 247063044 BPWVMINZBLPICY-ZHALLVOQSA-N 379.529 5.491 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cc(F)ccc1F 303859656 MGDAPWNPEVVQNH-DYVFJYSZSA-N 389.471 5.489 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1)[C@@H]1CCCO1 328979311 CUXDAIQYHYTVBG-WJMWBRGCSA-N 384.520 5.517 30 20 GKED Cc1nc(-c2cccc(N=C(O)[C@H]3CCCC[C@@H]3C(=O)N3CCCC3)c2)cs1 329227292 BAFFYTZSAHPGSQ-OALUTQOASA-N 397.544 5.135 30 20 GKED Cc1ccc(N=C(O)N2Cc3ccccc3C3(CCC3)C2)cc1/C(O)=N/C(C)C 329479855 QPWRQSCTVHDOBF-UHFFFAOYSA-N 391.515 5.191 30 20 GKED C[C@@H]1c2ccsc2CCN1C(O)=Nc1cccc(-c2ncc3n2CCCC3)c1 329620818 MTLALXOGELLRRE-OAHLLOKOSA-N 392.528 5.113 30 20 GKED Cc1nc2ccccc2n1C1CCN(/C(O)=N/[C@H]2CCCc3sccc32)CC1 329961548 OPTPQKNDONTIMQ-SFHVURJKSA-N 394.544 5.035 30 20 GKED CC(C)c1nc2ccc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)cc2s1 330006022 CMPZECOKYKTWLT-UHFFFAOYSA-N 385.533 5.933 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 360641795 LNKYWDFNQMSWGX-TUISQQNRSA-N 392.421 5.065 30 20 GKED Cc1ccc(C#N)cc1NC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 429738489 PDWFOIMBTMINQV-UHFFFAOYSA-N 397.450 5.185 30 20 GKED C=CCC[C@H](NC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccccc1 435761178 DVMNLKNNPUYVID-DEOSSOPVSA-N 392.543 5.332 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(ccc3ccccc32)[nH]1 436336408 VQTFLVNELVHHRB-URXFXBBRSA-N 379.463 5.233 30 20 GKED C[C@@H](SCc1ccc(F)cc1C#N)c1nc(Cc2ccc(Cl)cc2)no1 437268225 LLZKNYDWCXFHMA-GFCCVEGCSA-N 387.867 5.319 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 438839484 XETRWAKEDNSDMD-UHFFFAOYSA-N 397.356 5.325 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 454730897 YXWGYCHVTLAZDN-HBFSDRIKSA-N 377.488 5.339 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F)c1ccccc1 458531743 ZOOSFAQNJMMIBI-BZSNNMDCSA-N 381.442 5.089 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464461187 MNWNNNMFRXVFRN-AWEZNQCLSA-N 387.386 5.022 30 20 GKED Cc1ccc(-c2nnc(SCCCSCC#N)n2-c2ccc(C)cc2)cc1 466611913 SEEHAGIJFAXZRI-UHFFFAOYSA-N 394.569 5.290 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(CC(F)(F)F)cc2)c2ccccc21 469460799 LRHOSPFYUSPICW-UHFFFAOYSA-N 385.389 5.302 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)c3ccc(C#N)nc3)c2)cc1 470662796 MCVIQLMGNMPSDB-GOSISDBHSA-N 399.494 5.241 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccccc1 474696473 REKTXMNBPJXDDR-KRWDZBQOSA-N 386.417 5.284 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 477745473 VNACRVFXXOOYQK-CWTRNNRKSA-N 380.385 5.263 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(OC(F)F)c2cccnc12)c1ccccc1 482063834 ACPHWMXHQLIODB-INIZCTEOSA-N 396.397 5.003 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)ccc1OC(F)F 482539057 WJAGZWHJCAJEMK-NSHDSACASA-N 396.846 5.445 30 20 GKED N#CC[C@H](CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1 483362520 ZNQLSEBFUIUUBG-GOSISDBHSA-N 397.503 5.411 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485824380 XEFXEVQVWWLNEZ-AWEZNQCLSA-N 394.833 5.424 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cccc(OCc2ccccc2OC)c1C 488936301 GJTAWJGGBBOOHM-IBGZPJMESA-N 380.488 5.155 30 20 GKED C=CCN1CCC(N[C@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 491034543 HIJJOYYMDRABQO-JOCHJYFZSA-N 388.527 5.016 30 20 GKED C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2cc(C#N)ccc2OC(F)F)C1 499369221 NUNGSMZNGYGBEM-DOTOQJQBSA-N 394.462 5.254 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(-c2ncco2)cc1 500406816 PMKGWGLKUMPZBQ-UHFFFAOYSA-N 388.345 5.178 30 20 GKED C[C@H](NC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(C#N)cc1 505320243 WBAWSVKEIPSBKR-QWRGUYRKSA-N 380.250 5.126 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)N(C)CCC2CCCCC2)cc1C 506170815 RGJGGQVPQXTSGP-UHFFFAOYSA-N 392.547 5.123 30 20 GKED Cc1ccc(CN(C(=O)NCC(C)(C)CCC#N)[C@H]2CCc3ccccc32)cc1 513136265 VFNXBXWUJGSWNG-QHCPKHFHSA-N 389.543 5.524 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C[C@H](C#N)CCC#N 513502516 AJBPBCBMUORSJR-HNNXBMFYSA-N 375.394 5.231 30 20 GKED C=CCN(C(=O)C[C@H]1CCO[C@@H](C(C)C)C1)c1nc(-c2ccccc2)cs1 514152024 QTPNUONIUJLQLH-FXAWDEMLSA-N 384.545 5.170 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)CCCc2nc3ccccc3s2)cc1 517491862 FMCLKOHNRJGKNA-IBGZPJMESA-N 391.540 5.298 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 518667692 IXAOOEAIHINADE-DYESRHJHSA-N 398.597 5.835 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2cnc(-c3ccccc3)s2)CC1 518977723 AFQPDSZGFRVJRB-UHFFFAOYSA-N 389.524 5.162 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccc(Cl)cc2)CC1 520940252 KIBJGZGKCHGJHZ-HNNXBMFYSA-N 399.947 5.588 30 20 GKED C[C@H](SCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(C#N)cc1 522840582 SMUMQNQRFHJXSU-HNNXBMFYSA-N 394.496 5.033 30 20 GKED CC(=O)c1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)cc1 523879378 GPWLJXAGGQKARX-UHFFFAOYSA-N 390.826 5.459 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)c1nccn1C 530500170 TXPQLUDZYCOLQU-QFIPXVFZSA-N 388.515 5.183 30 20 GKED C[C@@H]1CN(c2ccccc2NC2CCC(C#N)(c3ccccc3)CC2)C[C@@H](C)O1 535840960 OSQLLGOAOMWXIJ-WXAJSYMVSA-N 389.543 5.116 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1nc(-c2cccnc2)cs1 540887864 LIRULDSIUFYBRW-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1ccc(C#N)cc1F 545943975 YHTKRZZWWMKNJI-YJBOKZPZSA-N 391.515 5.277 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc2cc(Cl)ccc2s1 549080655 BNJTWGDTXZYDBF-ZDUSSCGKSA-N 398.274 5.641 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1cc2ccccc2s1 554258267 NJJOWNOMTXBDIE-UHFFFAOYSA-N 377.513 5.141 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1cccc(Oc3ccc(Cl)cc3C#N)c1)CC2 559474742 BTJLHNXHLJBOCC-UHFFFAOYSA-N 399.837 5.079 30 20 GKED CC(C)(C)[C@H](NCc1cnc2ccc(C#N)cn12)c1cccc(C(F)(F)F)c1 563739409 PTKGCFBMLBVCJO-LJQANCHMSA-N 386.421 5.102 30 20 GKED Cc1cccc(CSc2nc(-c3ccc(C)o3)cc(C(F)(F)F)c2C#N)n1 565681183 FCCCKGCHGVCGST-UHFFFAOYSA-N 389.402 5.536 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccccc3Nc3ccccc3)on2)c1 566409955 PJGCBFMCPVZAJW-UHFFFAOYSA-N 380.407 5.209 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 568353323 YAGDQTAZQZHLCZ-ROUUACIJSA-N 396.556 6.002 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc(-c2ccccc2)cs1 581197030 OZFIEWZZHMFPPJ-MRXNPFEDSA-N 389.867 5.502 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CNCc1ccc(OC(F)F)c(F)c1 581392981 YSSSXLXVEXXFRP-UHFFFAOYSA-N 385.254 5.014 30 20 GKED Cc1nc(N[C@H](C)c2ccc(OCc3cccnc3)cc2)c(Cl)cc1C#N 589685153 IIRROCNDRTVBPO-CQSZACIVSA-N 378.863 5.062 30 20 GKED CN(CCC(C)(C)C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 592223696 XMFAYLSIAZGGNN-UHFFFAOYSA-N 379.504 5.232 30 20 GKED N#CCCCCC(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 593944926 AXVHZMYJHNJGAT-GOSISDBHSA-N 379.891 5.153 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 593998152 SJWOMRXFJZRZAB-INIZCTEOSA-N 398.959 5.174 30 20 GKED CC(C)(NC(=O)Nc1ccc(CCC(F)(F)F)cc1)c1cccc(C#N)c1 596786097 IIQPJBUTSKTIST-UHFFFAOYSA-N 375.394 5.110 30 20 GKED Cc1cc(C)cc(Oc2cccc(F)c2NC(=O)N2CCC[C@H](CC#N)C2)c1 596949355 XUXIRTDBWLLSPA-QGZVFWFLSA-N 381.451 5.392 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)Nc4ccc(C#N)c(Cl)c4)CC3)c[nH]c2c1 603681369 WCLANANLADQKPV-UHFFFAOYSA-N 390.874 5.323 30 20 GKED Cc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cnn1-c1ccccc1 603969050 XUKQSOMZMVTMHG-UHFFFAOYSA-N 384.464 5.033 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)ccn3)cc2Cl)c1 609062839 HUFMRZZCRDBYET-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(C)[nH]c2ccccc12 609072624 VMQOWQPRKGIHID-UHFFFAOYSA-N 395.462 5.488 30 20 GKED N#CCn1c(C(=O)Nc2cccc(COC3CCCCC3)c2)cc2ccccc21 609167824 YAXARTFGAOLOEE-UHFFFAOYSA-N 387.483 5.266 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1ccccc1 610343739 RFUHXWVHKUBLRR-MSOLQXFVSA-N 385.467 5.028 30 20 GKED Cc1cncc(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 610753852 XSCKANNCXVHUEK-IBGZPJMESA-N 375.859 5.260 30 20 GKED O=[N+]([O-])c1cc(F)c(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 610988143 IYSXFXUJBSJYHE-JIGDXULJSA-N 392.246 5.194 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 611872017 OKHWCHRLUIISOD-QGZVFWFLSA-N 394.883 5.512 30 20 GKED CC(C)(C#N)CCCN[C@@H](CC(F)(F)F)c1ccc(Br)cc1 612536261 LPYQLDKCWBTQIL-AWEZNQCLSA-N 377.248 5.362 30 20 GKED N#C[C@H](C(=O)c1ccc2ccccc2n1)c1nc(-c2ccc(Cl)cc2)cs1 612894681 HPTYKALDWCKLAY-MRXNPFEDSA-N 389.867 5.502 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2-c2c(F)cccc2F)cc2ccccc21 614575138 DZWAAWFAFUYXEN-UHFFFAOYSA-N 387.389 5.362 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 615971626 PBOHQNYQRSGERH-SJORKVTESA-N 377.381 5.163 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(F)c(C(F)(F)F)c(F)c1 617504084 HSBJCFWRPAAMRF-UHFFFAOYSA-N 386.345 5.242 30 20 GKED C=CCCOCC(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 620208723 DLBHAFPPGCKPDG-UHFFFAOYSA-N 393.405 5.049 30 20 GKED N#C[C@H](C(=O)c1cc[nH]c1C1CCC1)c1nc2cc(C(F)(F)F)ccc2s1 651266424 PQYOLKLHVBTDJO-CYBMUJFWSA-N 389.402 5.401 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676725030 KAYDKRCQDZAPMY-SJKOYZFVSA-N 395.425 5.378 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)COc1ccc(C#N)cc1 726766302 QWFVWGNPITVRIW-UHFFFAOYSA-N 376.843 5.205 30 20 GKED Cc1cccc(COc2ccc(C(=O)/C=C/c3cnc4c(c3)c(C)nn4C)cc2)c1 727654991 QUSNYMIQNDRKOF-KPKJPENVSA-N 397.478 5.060 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 728766684 GCDXPSCLDMWVBT-QFBILLFUSA-N 390.508 5.497 30 20 GKED Cc1cccc2c1CCN(C(=O)Nc1ccc(Oc3ccccc3C#N)cc1)C2 729562143 OTMKPYWLBGRZTK-UHFFFAOYSA-N 383.451 5.249 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C/c3c(O)cccc3OC)s2)cc1 733750061 KUMUPEADZKUJLD-UMYHVIPVSA-N 382.485 5.021 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 734966023 STNKLRBEWSHIOC-XJKSGUPXSA-N 389.282 5.143 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)[C@H](C)Cc3ccc(Cl)cc3Cl)[nH]c12 735788544 DZUNKDZLRAANRU-DOMZBBRYSA-N 386.282 5.233 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)ccc1SC(F)F 736434851 XDQFYRVQROHDNB-VOTSOKGWSA-N 383.485 5.660 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3c[nH]nc3-c3ccc(F)cc3)c2)s1 740014860 WWECPSOKQKUHPB-UHFFFAOYSA-N 388.471 5.106 30 20 GKED Cc1ccc2c(CCC(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c[nH]c2c1 745947841 PNHDQNPHMWXOHL-INIZCTEOSA-N 392.409 5.030 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)n1[C@H](C)c1ccccc1 747198501 XYFPKISPSGNDOQ-OXQOHEQNSA-N 391.540 5.784 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Nc2ccc(COC(C)(C)C)cc2)cc1 752247203 IVVOOVYPUWAJFI-IBGZPJMESA-N 393.531 5.057 30 20 GKED Fc1cc(C=NOc2ccccc2C(F)(F)F)ccc1OCC(F)(F)F 758128885 LLKAIGBRPVSUED-UHFFFAOYSA-N 381.247 5.199 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760365145 KLKFVOSGMIRVGX-GOTSBHOMSA-N 376.500 5.408 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(Cc3ccc(OCC#N)cc3)n2)cc1 762351895 KJLBOXXJVLIZBA-UHFFFAOYSA-N 379.485 5.120 30 20 GKED CCOc1ccccc1C=NO[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 763169118 PQVOXLULYNGEPT-HNNXBMFYSA-N 384.863 5.814 30 20 GKED Cc1cncc(C(=O)/C=C/c2cnc(-c3ccc(Br)cc3)s2)c1 767366434 GLSMENNPRXGBSQ-VOTSOKGWSA-N 385.286 5.172 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(C#N)cc1Cl 768996096 NRRYLOYWYKWETD-UHFFFAOYSA-N 381.785 5.284 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2ccccc2Br)cc1 769534252 UJCHQYNFRXTQOD-MGPUTAFESA-N 385.305 5.077 30 20 GKED Cc1csc(SCc2ccccc2C(=O)Nc2cccc(C#N)c2C)n1 770729362 WLDRUPLUDIHNOV-UHFFFAOYSA-N 379.510 5.176 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Br)s2)c1 772985930 UZTFGDSSBDROHZ-JSGCOSHPSA-N 379.323 5.042 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 779054045 IXDVBVHITAJBKR-UHFFFAOYSA-N 377.444 5.038 30 20 GKED C#CCCCCCC(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 779864151 FAGMMHSGJBCQHN-UHFFFAOYSA-N 382.891 5.139 30 20 GKED Cn1ncc(Cl)c1/C=C/C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 780187977 WSZVJGAUKLEADG-NSCUHMNNSA-N 382.691 5.007 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCc1ccc(OC2CCCCC2)cc1 780676900 AATYCNJXFQTREL-QGZVFWFLSA-N 393.487 5.011 30 20 GKED Cc1ccc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(Cl)c1 790773915 QLTAGQDXOQBZEY-CYBMUJFWSA-N 375.280 5.331 30 20 GKED COc1cc(C=NO[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)cc(OC)c1 794726990 GINHTYQEPVBBHQ-CYBMUJFWSA-N 386.835 5.124 30 20 GKED N#Cc1ccc(F)c(COC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)c1 795144238 MSWCLELUWALMAR-WQRHYEAKSA-N 381.403 5.182 30 20 GKED CC(C)(C(=O)OCc1ncc(-c2cccc(Cl)c2)o1)c1cc(F)cc(C#N)c1 796945357 PSWYHWCLXLTTBP-UHFFFAOYSA-N 398.821 5.027 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1csc(-c2ccc(Cl)cc2)c1 814119896 LZEGDCAETKZCDQ-UHFFFAOYSA-N 386.835 5.362 30 20 GKED CCCC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1cccnc1 814926991 RZTXWBOXTCDASJ-UHFFFAOYSA-N 385.393 5.174 30 20 GKED CCOC(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CCCC#N)c2ccccc2)c1 820479107 RUEZHUCFFFNTQZ-LJQANCHMSA-N 399.878 5.073 30 20 GKED Cc1cccc(C(=O)O[C@H]2CC[C@@](C)(C#N)CC2)c1NC(=O)c1ccccc1F 836158455 UMFQNJHKFDQQBZ-PAVFIEEWSA-N 394.446 5.016 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1 836457361 WRDPGWJMVUCNSO-GOSISDBHSA-N 387.842 5.141 30 20 GKED CCN(C(=O)c1cc2c3ccccc3n(C)c2s1)[C@@H](C)c1ccc(C#N)cc1 914509449 LIUPTRBXHCSXKK-HNNXBMFYSA-N 387.508 5.488 30 20 GKED Cc1ncsc1C(=O)/C=C\c1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 915987945 OBROQWUZXLVVDP-WAPJZHGLSA-N 384.388 5.187 30 20 GKED CC(CCc1ccc(OC(F)F)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 916260328 WUEKXQRPNMKPQX-UHFFFAOYSA-N 382.794 5.060 30 20 GKED Cc1cc(NN=Cc2c(Cl)nc3sccn23)nc2ccc(Cl)cc12 916543603 UUHZRIXQTDJJDW-UHFFFAOYSA-N 376.272 5.005 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc(Cl)s3)n2)cc1 916974604 NRVHVJLNJNAYDV-LYASGUKUSA-N 384.913 5.723 30 20 GKED Cc1ccc(OCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c(C)c1 917026613 JOAMKCOKPWMVKN-SFHVURJKSA-N 376.481 5.072 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C=C(C2CC2)C2CC2)cc1Cl 917675088 ZWUSQRCEFWCJKF-NRFANRHFSA-N 376.887 5.680 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3sccc3s2)cc1 918486112 CTOBGFTXEDITPA-IUODEOHRSA-N 382.510 5.437 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(CSCC)cc2)cc1 918486451 CPNGTYPPFGGNBY-OAQYLSRUSA-N 394.540 5.243 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3sccc3s2)cc1 918486769 FTCLOUYISFWGDN-OAHLLOKOSA-N 382.510 5.267 30 20 GKED COc1ccccc1Nc1nc(Cl)c(C=NN[C@@H](C)c2ccccc2)s1 920382760 NXHOWOLJKPLDEV-ZDUSSCGKSA-N 386.908 5.233 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C\c1ccc(-c2cccc(C(=O)O)c2)s1 1777316287 PRGLNMVIWPZCEQ-TWGQIWQCSA-N 398.867 5.671 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3[nH]ccc3C)cc2)CCC1 1787102807 JRSMERPISWTNGZ-UHFFFAOYSA-N 393.531 5.063 30 20 GKED N#Cc1c(NC(=O)CCCOc2ccc(Cl)cc2Cl)sc2c1CCC2 6329638 DALKWFAURNXKOX-UHFFFAOYSA-N 395.311 5.213 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 7202361 RUDFXEFJMMWWOC-CQSZACIVSA-N 385.924 5.249 30 20 GKED N#Cc1ccc(F)c(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)c1 11372525 RRESRDJCZWFPRL-UHFFFAOYSA-N 393.921 5.620 30 20 GKED C=C(C)CN(CC)C(=O)c1cc2c(C)nn(Cc3ccc(Cl)cc3)c2s1 24458387 CFPADTLTWYERQN-UHFFFAOYSA-N 387.936 5.146 30 20 GKED CN(C(=O)c1cccc(OCc2ccccc2C#N)c1)c1nc2ccccc2s1 57260431 PIVDZTYBBVDQSU-UHFFFAOYSA-N 399.475 5.024 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCOc1ccc(F)cc1Cl 108237390 FGZMSQNNTOSDMI-ZDUSSCGKSA-N 392.883 5.138 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 116594575 AQMLLKREYJPOBW-UZLBHIALSA-N 385.492 5.360 30 20 GKED N#C[C@H](C(=O)[C@H]1CSc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 118600138 KSUKEJZFCHUOKP-OLZOCXBDSA-N 398.459 5.154 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)c1 127458134 ZRDATGWRCOOSGW-YADARESESA-N 383.495 5.206 30 20 GKED C[C@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 128746741 ZAQBJTZAFDCLOY-OAHLLOKOSA-N 391.858 5.232 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2ccc(-c3nnco3)cc2)cc1 175399096 HQXLYZQASDVUEW-UHFFFAOYSA-N 398.447 5.012 30 20 GKED Cc1cnc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 176921417 IZYWUISNHCWVLS-OAHLLOKOSA-N 392.484 5.307 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2ccccc2Cl)n1)Cc1cccs1 180088855 JLQVBRWMSATROR-GFCCVEGCSA-N 388.901 5.064 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccncc3C(F)(F)F)c2)cc1 193079321 QKULLBJRQIMFTE-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)ccn1C 194889635 DUOHTOKBVXBLMN-CQSZACIVSA-N 390.295 5.254 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(-c3ccc4c(c3)CCCO4)cc2)cc1 237611056 WDKUMRVEUFIJQY-LJQANCHMSA-N 398.506 5.259 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)CCc3ccc(C#N)cc3)c2)C1 303013562 ROFVXJTYKGWZOO-JPYJTQIMSA-N 376.500 5.225 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1cc(F)ccc1F 303390283 XYCFDGJUTZKKHT-CQSZACIVSA-N 393.393 5.068 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1F 303651896 FAVMTCXRKKRWGT-GOSISDBHSA-N 387.389 5.307 30 20 GKED O/C(=N/[C@@H]1CCOC2(CCSCC2)C1)Nc1cccc(C(F)F)c1Cl 329837395 MDISIOXZGOJXCD-LLVKDONJSA-N 390.883 5.048 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426147369 BBKQVJSSNXNUNV-LLVKDONJSA-N 381.785 5.455 30 20 GKED N#Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 429691571 WZMKMBQSRLULDR-GFCCVEGCSA-N 388.235 5.072 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)c1cc(C#N)cs1 432094062 FTDSONCKPUEPDW-UHFFFAOYSA-N 380.494 5.173 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 432463139 MJQHUGKMXRGLJQ-MRXNPFEDSA-N 395.812 5.915 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 438046448 XQDJYEIZUBAKOS-JXFKEZNVSA-N 399.535 5.609 30 20 GKED Cc1ccccc1[C@H]1C[C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 439509373 DVVRHOBHMOIYFL-BZSNNMDCSA-N 379.529 5.457 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 441036309 QWISWQFCROFXQH-CPAJTMIGSA-N 399.897 5.198 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1csc(C)n1)c1ccc(C(F)(F)F)cc1 441535901 VVFHOQPTENMQRA-QGZVFWFLSA-N 397.466 5.319 30 20 GKED C[C@@H](c1ccccc1)N(Cc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1 442890831 AYUHVIHSKVJSTA-SFHVURJKSA-N 380.451 5.376 30 20 GKED C=CC[C@H]1N(Cc2csc(N(C(C)=O)c3ccc(C)cc3)n2)CCCC1(C)C 444776920 QLWXHAMUARRYOS-OAQYLSRUSA-N 397.588 5.703 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cnn(CCC)c1C1CC1 452999397 WBXPIXYXSWHNHQ-UHFFFAOYSA-N 393.409 5.006 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 454477917 DTHHZXFQHKJACX-RIFZZMRRSA-N 392.890 5.199 30 20 GKED COC(=O)c1ccc(C(C)C)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 455248139 GXDRYKXLEORHED-FQEVSTJZSA-N 393.487 5.153 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@H](CSc2ccccc2)C1)c1ccccc1 458799908 KJAZYSVTXAONCN-UGKGYDQZSA-N 393.556 5.245 30 20 GKED C=C[C@@H]1OCC[C@H]1C(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 460057896 QMZUWIHAGHMSRE-APWZRJJASA-N 378.497 5.169 30 20 GKED N#Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(Cl)c(Cl)c2)o1 463018226 ZIGDNCZNCZZOHI-GOSISDBHSA-N 384.222 5.229 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCCc1cccc(C#N)c1 464319834 QVTMVRRDANUSJY-HXUWFJFHSA-N 383.495 5.074 30 20 GKED N#C[C@H](NC(=O)c1nc2ccccc2cc1Cl)c1cccc(Cl)c1Cl 464396516 IMAQNSKSUMLSJQ-HNNXBMFYSA-N 390.657 5.190 30 20 GKED N#Cc1cnccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 465130584 WDDWIOXIMVKJJK-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)Nc3cc(C#N)ccc3OC(F)F)c2c1 473727952 AMIRPIGNANBNED-UHFFFAOYSA-N 393.393 5.146 30 20 GKED CC(=O)c1sc(NC(=O)C[C@H](CC#N)c2ccccc2)nc1-c1ccccc1 474402937 NWYAUXFJSRSYRW-SFHVURJKSA-N 389.480 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 475545573 FHQKEYAMIXGQDP-QGZVFWFLSA-N 376.500 6.510 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1CN(C)C(C)C 475564853 CFIGNNFIBZOGGX-UHFFFAOYSA-N 393.575 5.700 30 20 GKED CCN(CC)c1ccc(-c2nnc(SCCCC(C)(C)C#N)n2CC)cc1 475932677 KEVPBXJLJUJRDB-UHFFFAOYSA-N 385.581 5.233 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)c(F)c1 476109266 LYXGTIGUTJMOHG-UHFFFAOYSA-N 376.269 5.692 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl 476803014 YDFURLFYYGIISJ-UHFFFAOYSA-N 387.310 6.579 30 20 GKED C=C(C)[C@H](NC(=O)N(CCOC)[C@H](C)c1ccccc1)c1ccc(F)c(F)c1 477733109 ZEDCGFGMPLQLSQ-IERDGZPVSA-N 388.458 5.001 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1)c1ccc(F)c(F)c1 481589678 AREXBIBLUFSBON-DJJJIMSYSA-N 387.405 5.430 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccccc1OC[C@@H]1CCCCO1)c1ccccc1 488688632 JBQDRVHRCUIBOH-LEWJYISDSA-N 379.500 5.323 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 490312178 DVMNAVWLCPRPSP-VGSWGCGISA-N 395.572 6.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccc(Cl)cc1 500746141 UWHKITRWQROQAX-UHFFFAOYSA-N 376.843 5.494 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)CCc3ccc(C#N)cc3)s2)cc1 502468931 AHTOWZZKFUZOEU-MRXNPFEDSA-N 389.524 5.109 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 502576035 RMAYPFHEUCMEQN-ZHRRBRCNSA-N 399.535 5.145 30 20 GKED COc1ccc(NC(=O)c2ccc(C(F)(F)F)c(F)c2C)c(C(F)(F)F)c1 503057301 HRECNJHEJJXHPL-UHFFFAOYSA-N 395.274 5.433 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCc2cc(Br)ccc2C1 505010884 NBOZROVYJAOJRC-UHFFFAOYSA-N 385.305 5.158 30 20 GKED CN(Cc1cccc(C#N)c1)Cc1cnc(-c2ccc(Br)cc2)s1 507243694 NRHYHGQTJSNHLK-UHFFFAOYSA-N 398.329 5.076 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(C#N)cc1 510374607 OBDOTXFGPWPKNO-UHFFFAOYSA-N 381.435 5.083 30 20 GKED CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510663777 ORPDEUIWXUSKOQ-UHFFFAOYSA-N 389.430 5.544 30 20 GKED COc1ccc(-c2ncc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)s2)cc1 519612450 QLKYHBWRQNFDRK-UHFFFAOYSA-N 397.525 5.302 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Br 519847679 ZAVIOALGBUJHTL-LIRRHRJNSA-N 375.285 5.674 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cccc(Cl)c3F)c2)cc1 522313598 OTZLNAQLUCSSPM-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)cc1 522421599 IBRJNAGHVRFNQH-UHFFFAOYSA-N 388.298 5.385 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1F 523456783 SOARXMSJRWPROI-DYVFJYSZSA-N 389.471 5.632 30 20 GKED CO[C@@H](C)CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(C)C 525417032 SVKYWPUCWKDVLE-JXFKEZNVSA-N 399.922 5.273 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1c(C)noc1C 533833224 UQQADLODBBOLPU-FQEVSTJZSA-N 389.455 5.145 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 535499552 KIDFYWYLJVJIRI-SBUREZEXSA-N 376.887 5.301 30 20 GKED Cc1ccc([C@@H](Cn2ccnc2)NC2CCC(C#N)(c3ccccc3)CC2)c(C)c1 537327468 OFCNDWCQMDCBHA-CNWYCCFASA-N 398.554 5.235 30 20 GKED CC[C@@H](NCc1ccc(C#N)cc1OC(F)F)c1ccccc1OC(F)F 539253671 YEDSIXGXAWPKLX-OAHLLOKOSA-N 382.357 5.002 30 20 GKED COc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Br 551211538 JGYXOHIIEWIHGE-BEFAXECRSA-N 387.321 5.543 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(C(F)(F)F)c1 554354782 NWFQVQODPASRMJ-UHFFFAOYSA-N 380.414 5.093 30 20 GKED C=CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 561015305 NBQXHQFIMRSQFG-ZZEZOPTASA-N 393.490 5.263 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C#N)c1nc(-c2ccccc2)cs1 561894653 RJSNXQOMCPKCCY-CYBMUJFWSA-N 398.329 5.295 30 20 GKED O=C(c1ccoc1C(F)(F)F)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 564531241 NKRYWLQUHWKBTK-HNNXBMFYSA-N 395.274 5.028 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cccc(F)c2Cl)c1 582451288 DCVBJDHHWSILKS-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)CCCCCC#N)n1 588904176 XVFSXABAAGBZFS-UHFFFAOYSA-N 379.938 5.669 30 20 GKED N#Cc1cnccc1CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 592345839 CNUNHBLSGPBWFT-UHFFFAOYSA-N 395.919 5.273 30 20 GKED CCn1c(S[C@H](C#N)Cc2ccccc2)nnc1-c1ccc(C(C)(C)C)cc1 604044798 CFJUOXVCGJDBKE-FQEVSTJZSA-N 390.556 5.489 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC4(CCCCC4)CC3)cn2)cc1 608840526 JSIKHPDXQALKAE-UHFFFAOYSA-N 390.487 5.324 30 20 GKED COc1ccccc1C(C)(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176162 AEFHKTQMCQOAPA-UHFFFAOYSA-N 386.451 5.275 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(C)(C)C)cc1 609438211 FZZCJAXKUMHUPA-INIZCTEOSA-N 381.545 5.700 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC(C)(C)c1cccs1 609744174 LUVBTPSMCUHHMS-UHFFFAOYSA-N 391.496 5.777 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)c1cccc(C(F)(F)F)c1 609993923 CLIKAZHRGLSXSD-SJKOYZFVSA-N 380.797 5.233 30 20 GKED N#C[C@H](C(=O)c1cc2c(Cl)cccc2s1)c1cc(C(F)(F)F)ccn1 643777199 YSBHFPXRSYFDPF-NSHDSACASA-N 380.778 5.459 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1nc(C2CC2)cs1 647379544 SBYOGOZPJYOIHP-CYBMUJFWSA-N 389.402 5.028 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)Nc2cccc(C#Cc3cccs3)c2)C1 680450956 XUTJBPGVVJJKKQ-HTAPYJJXSA-N 387.508 5.158 30 20 GKED N#C[C@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1nc2ccccc2s1 730685034 GFWFMZYVOJNJBH-GFCCVEGCSA-N 397.912 5.368 30 20 GKED N#CCOc1cccc(NC(=O)NC2(c3ccc(Cl)cc3)CCCCC2)c1 730938234 YRNKYNRSAYMLFY-UHFFFAOYSA-N 383.879 5.223 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc2ccccc2c(Cl)n1 730989162 HZJIMLUHXBFEES-CYBMUJFWSA-N 381.888 5.392 30 20 GKED Cc1c(C(=O)/C=C/c2c(Cl)nc3ccccn23)cnn1-c1cccc(Cl)c1 731565721 ZCPWHGJZWDZVFZ-CMDGGOBGSA-N 397.265 5.031 30 20 GKED C#CCCOc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1 733324761 XHZCLPQSTPMLQJ-QFIPXVFZSA-N 381.928 5.683 30 20 GKED CC(=O)Nc1ccc(NCc2cccc(OCc3ccccc3C#N)c2)cc1C 734157195 SHJONQWHSWUUBQ-UHFFFAOYSA-N 385.467 5.016 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@H](C#N)C3CCCCC3)c2c1 734508622 JVOGRUPPYHKNKQ-HSZRJFAPSA-N 385.467 5.235 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(C)cc1 739159217 IMLGURDACWUPGG-WIYYLYMNSA-N 399.519 5.750 30 20 GKED Cc1cccc([C@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 741396738 RWJCDEBSTOYFOV-DVECYGJZSA-N 383.495 5.576 30 20 GKED CCC[C@@H](CC1CCCCC1)C(=O)OCc1nnc(-c2ccc(C#N)cc2)o1 745027239 NRPAWNOFJFDZJV-IBGZPJMESA-N 381.476 5.038 30 20 GKED COC(=O)c1ccc(-c2ccc(/C=C/C(=O)c3c(C)nn(C(C)C)c3C)o2)cc1 746346977 VZTLWRISSRWOSH-ZRDIBKRKSA-N 392.455 5.024 30 20 GKED Cc1nc(NC(=O)c2c3ccccc3cc3ccccc23)sc1SCC#N 746514968 CVUNSFDOKCYWMO-UHFFFAOYSA-N 389.505 5.626 30 20 GKED CC(C)CN(CCC#N)C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 751380017 JDTXFBJLAOQLER-UHFFFAOYSA-N 388.842 5.585 30 20 GKED Cc1ncc(CNCc2cccc(-c3ccc(C#N)s3)c2)n1-c1ccccc1 752264878 JHJOWPYYFQHEMK-UHFFFAOYSA-N 384.508 5.071 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2cccc(OC)c2)cc1 753392795 DXRSKJPXYFRVDU-GSHUGGBRSA-N 392.499 5.050 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(SCc3ccccc3)cn2)cc1 754074715 DDOCAKXWQPXMPE-QGZVFWFLSA-N 375.497 5.277 30 20 GKED CCn1c(NC(=S)Nc2ccc(Cl)cc2Cl)nc2cc(C#N)ccc21 763293431 LVNUCGDDKSTBAP-UHFFFAOYSA-N 390.299 5.044 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(OC)cc1 776076920 KXBWEHHEIBBTJX-PMACEKPBSA-N 390.508 5.497 30 20 GKED C#CCOc1ccc([C@@H](C)Nc2ccc(NC(=O)N3CCCCCC3)cc2)cc1 777232582 UTXFNROFODYFPQ-LJQANCHMSA-N 391.515 5.280 30 20 GKED C=C(C)[C@@H]1CC=C(COC(=O)[C@@H](C)c2c(C)nn(CC(F)(F)F)c2C)CC1 778312235 GUDVOKCMTXYVTG-SUMWQHHRSA-N 384.442 5.012 30 20 GKED CC[C@H](C#N)Oc1cc(CNC2CC(c3cccc(Cl)c3)C2)ccc1OC 783569532 UJOAORWKPPEEMQ-LYBXBRPPSA-N 384.907 5.065 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2cccc(NC(=O)NCC)c2C)cc1 788613670 UMCPHCNGSRDXMZ-INIZCTEOSA-N 387.911 5.441 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1cnc2ccccc2n1)c1ccc(-c2ccccc2)cc1 792115515 ZKBWMEPLNHYMJZ-OAQYLSRUSA-N 391.474 5.451 30 20 GKED C#C[C@H](NC(=O)c1cnc2ccccc2c1C(F)(F)F)c1ccc(Cl)cc1 794060531 PCKIRHGUJYGFDL-INIZCTEOSA-N 388.776 5.011 30 20 GKED C=CCCc1ccccc1NC(=S)Nc1ccc(OC(F)F)c(Cl)c1 799901145 VZHJENQJNLCEHN-UHFFFAOYSA-N 382.863 5.869 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1C 800152998 OSZPQFKXJVIATA-UHFFFAOYSA-N 380.488 5.713 30 20 GKED N#Cc1cc(Br)ccc1CSc1nnc(-c2ccccc2)s1 804906071 DNUBNPNPVDEDHF-UHFFFAOYSA-N 388.315 5.132 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 806201281 VXRTULJETMZWFD-XMMPIXPASA-N 397.478 5.229 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C\c3csc(-c4ccc(F)cc4)n3)cc12 806578475 HAPLAEDJJSTGMQ-FPLPWBNLSA-N 383.473 5.102 30 20 GKED CC(C)c1ccc(C2(O)CCC(=NNc3nccnc3C3CCC3)CC2)cc1 807994238 NVXINWITNUIMSQ-UHFFFAOYSA-N 378.520 5.097 30 20 GKED N#Cc1ccc(/C=C\C(=O)c2sccc2Br)c(C(F)(F)F)c1 811688368 PABTWTXYVLBILJ-ARJAWSKDSA-N 386.192 5.297 30 20 GKED Cc1csc(SCc2c(C(=O)N[C@@H](C#N)C(C)(C)C)oc3ccccc23)n1 813283948 KDCVDSFYSXWXTK-INIZCTEOSA-N 399.541 5.158 30 20 GKED N#CCCC[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccccc1 814210517 QDCWBANEFCWKDU-KRWDZBQOSA-N 377.435 5.427 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccc(SC(F)(F)F)cc2)SC1=S 814292081 MNARGVJDIGWSCW-KPKJPENVSA-N 375.462 5.076 30 20 GKED CCc1c(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)cnn1C(CC)CC 861297477 USCPMKVJYQMBHR-UHFFFAOYSA-N 378.520 5.129 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1ccc(Cl)c(Cl)c1Cl 916325267 FRKYNCBNMZWLIS-UHFFFAOYSA-N 386.563 5.434 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Oc3cccc(Cl)c3)n2)cc1 916972340 NGKNJGDTECOCPJ-KSSFIOAISA-N 396.899 5.416 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1ccc(N2CCOCC2)cc1C 918548023 IGENMKPXFJJBBN-UHFFFAOYSA-N 375.557 5.046 30 20 GKED COc1ccc(C(=O)/C=C/c2c(Cl)nc(Cl)n2-c2ccccc2)c(F)c1 920065180 WRWYPOIYRNBHPV-MDZDMXLPSA-N 391.229 5.223 30 20 GKED Cc1cccc(COc2c(C)cc(C=NNc3ccccc3C(=O)O)cc2C)c1 1776030149 HGQOTXNULUXTIK-UHFFFAOYSA-N 388.467 5.335 30 20 GKED CCCCC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Cl)cc1Cl 1776074622 KNDQEKWXEJBXSX-UHFFFAOYSA-N 383.250 5.837 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ccc(Br)s3)c2c1 1776115310 UMLINMYZKVIHII-IWQZZHSRSA-N 393.283 5.320 30 20 GKED O=C(O)c1ccc2[nH]cc(/C=C\C(=O)c3ccc(Oc4ccccc4)cc3)c2c1 1776126483 MZJWOGXZSCHNMX-LCYFTJDESA-N 383.403 5.555 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(F)c1)C(=O)O 1776170716 DEHHSHXZQFOOIV-SFHVURJKSA-N 395.833 5.310 30 20 GKED CCCCCCCC[C@H](C)C(=O)Nc1ccc(C(=O)O)c(Br)c1 1776786017 CAUAMJUZMNPVHW-ZDUSSCGKSA-N 384.314 5.473 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1 25105553 YHWQEAFRDIMATF-UHFFFAOYSA-N 386.417 5.047 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SCc1cccs1)c1nc2ccccc2o1 41544273 BZYKMBJPRPJDMJ-INIZCTEOSA-N 390.489 5.672 30 20 GKED N#C[C@H](C(=O)c1ccccc1NC(=O)c1ccsc1)c1ccc2ccccc2n1 48855372 ZZFWBQOBBGDABL-SFHVURJKSA-N 397.459 5.039 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cccc(C)c2)cs1 54897109 ZHAMSRSHOFGARC-XFXZXTDPSA-N 376.481 5.341 30 20 GKED CCc1ccc(C(=O)/C(=C(\S)NC(C)C)[n+]2ccc(C(CC)CC)cc2)cc1 55009810 DISPOCQVRRSSEU-UHFFFAOYSA-O 397.608 5.377 30 20 GKED Cc1csc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2)n1 66161857 CSTVYGGZNOXMBR-UHFFFAOYSA-N 390.512 5.433 30 20 GKED C=CCN(C(=O)c1csc(-c2ccoc2)n1)c1nc(-c2ccccc2)cs1 78665934 OJULEGQOIYQGOG-UHFFFAOYSA-N 393.493 5.359 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3c(c2)COC3)cc1 92049190 RCUFKYWFWXTOSB-UHFFFAOYSA-N 386.476 5.133 30 20 GKED CCCO[C@H]1CCCN(C(=O)c2ccccc2Sc2ccccc2C#N)CC1 108222838 VWUIXZHDOGHYED-IBGZPJMESA-N 394.540 5.131 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2cccnc2)cc1 108239816 QJDOMXZMAPENEV-INIZCTEOSA-N 389.480 5.378 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1cccc2ccccc12 108354588 IFHNYSGUCMCLBG-INIZCTEOSA-N 375.497 5.142 30 20 GKED Cc1ccc(-c2noc([C@@H](C)Nc3ccccc3SC[C@@H](C)C#N)n2)cc1F 108408013 QCHUPLVMYAIHNW-DZGCQCFKSA-N 396.491 5.609 30 20 GKED Cc1ccc(N2CCCC2)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 116641751 WRIYIDQMPAFHFM-KRWDZBQOSA-N 379.529 5.099 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nc2cc(Cl)ccc2s1 119970187 PCRFNOISQAKMSC-NSHDSACASA-N 392.223 5.001 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2scnc2C2CC2)cc1F 126709753 GNQCGCOEISIRPX-UHFFFAOYSA-N 379.416 5.076 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C(F)F)c3)n2)cc1 171569539 OCQWTVQRKGKONN-MRXNPFEDSA-N 379.391 5.109 30 20 GKED COc1ccc(-c2cnc(CNc3ccccc3S[C@@H](C)CC#N)o2)cc1 174310623 BCKUZSKLSSVRPV-HNNXBMFYSA-N 379.485 5.357 30 20 GKED C[C@H](c1ccccn1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174497408 CMHIMSVIBWLNMC-OAHLLOKOSA-N 390.418 5.110 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC(OCC2CCCC2)CC1 175600415 FBOWCGOHFKVGOA-UHFFFAOYSA-N 388.511 5.037 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 176599244 QZNLCSGZYVPBCR-IBGZPJMESA-N 398.510 5.303 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccccc1Sc1ccccc1C#N 182025634 SECQJWVCZUADRG-MRXNPFEDSA-N 399.475 5.253 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccnc3-c3ccc(Cl)s3)cc2)CC1 187135308 DJNNNKWGCQVYJZ-UHFFFAOYSA-N 379.872 5.271 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]2[C@H](CCCN2C2CC2)C1 191433555 MHFXQRWZWMYLLJ-DENIHFKCSA-N 381.564 5.019 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C(=O)NCCCC)CC[C@@H]1C 191488286 YEHOYYJWFCFHAB-ICSRJNTNSA-N 399.579 5.087 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)cc2F)nnc1-c1ccccc1F 195593712 OJHDFKCRBYJHLK-LBPRGKRZSA-N 375.419 5.402 30 20 GKED C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 246683522 HLMUPWFHNKYUEK-RZQQEMMASA-N 397.519 5.692 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)o1 248586583 XXSLGYPDTHPWGU-FCEWJHQRSA-N 397.544 5.845 30 20 GKED COc1cc(C=NOCc2nc(-c3cccs3)oc2C)ccc1OC(C)C 255640653 UTOQHILIWXGCNM-UHFFFAOYSA-N 386.473 5.058 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccsc2)cs1 255768984 JABPTTPRZPWQGO-DAXSKMNVSA-N 388.901 5.439 30 20 GKED N#Cc1ccc(/C=C2/CCn3c2nc2scc(-c4ccccc4)c2c3=O)s1 255911862 BNIWGEKURDECCJ-UVTDQMKNSA-N 387.489 5.002 30 20 GKED C[C@H](Nc1ccc(OCc2ccccc2)cc1)C(=O)N(CCC#N)c1ccccc1 302817748 RXMVEMCFQNEBSK-FQEVSTJZSA-N 399.494 5.013 30 20 GKED Cc1cc(Cl)cc2nc(S[C@H](C)C(=O)N(CCC#N)c3ccccc3)oc12 303688801 OVTMZBAEDRJCFE-CQSZACIVSA-N 399.903 5.217 30 20 GKED C[C@]1(/N=C(/O)C2CCN(c3nc4ccccc4o3)CC2)CCCc2ccccc21 328636238 ACOKUMYANXAUAV-DEOSSOPVSA-N 389.499 5.252 30 20 GKED Cn1nccc1[C@@H]1OCCC[C@H]1C(O)=Nc1ccc2nc(C(C)(C)C)sc2c1 329191036 RGRHEDXQFPCZQF-RDTXWAMCSA-N 398.532 5.083 30 20 GKED Cc1c(/C(O)=N/C2CCC(N3CCC(C)CC3)CC2)cnn1C1CCCCC1 329531698 WRNITKDXSGHVDP-UHFFFAOYSA-N 386.584 5.044 30 20 GKED CCc1ccc2c(c1)[C@@H](CC/N=C(/O)CC13C[C@H]4C[C@@H](CC(O)(C4)C1)C3)C(O)=N2 330128812 JQEIKAYZHPFANN-OMYRSMHSSA-N 396.531 5.002 30 20 GKED CCn1ccnc1[C@H]1CCCCN1C(O)=Nc1ncc(C2CCCCC2)s1 330332683 PCPPRAYTQRFECI-MRXNPFEDSA-N 387.553 5.180 30 20 GKED CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1cccc(C#Cc2ccccc2)c1 431610776 ZMMAQIRZBKCLJQ-HSZRJFAPSA-N 398.510 5.062 30 20 GKED N#CCCC[C@@H](NC(=O)NCCCSc1ccc(F)cc1)c1ccccc1 431728544 XQXMNSFJFDLOPK-HXUWFJFHSA-N 385.508 5.042 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCC(=O)c1ccc2ccccc2c1 436364958 QPQLQWCOHRJKGP-ZEQRLZLVSA-N 396.490 5.101 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 438040891 VMFMAFUGWUJKBA-ICSRJNTNSA-N 395.572 5.874 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H](Oc3ccccc3Cl)C2)cc1 443820585 AMODCYOFDGYRNY-GOSISDBHSA-N 397.906 5.216 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1ccc(C#N)cc1Cl 444901660 MTNVGRCYUANXQP-INIZCTEOSA-N 381.785 5.335 30 20 GKED C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCC[C@H]1c1ccc(Cl)cc1 453468734 YOOXYSYZPQBAOJ-SNRMKQJTSA-N 386.927 5.089 30 20 GKED Cc1cccc(F)c1NC(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 461920140 KBDKPULJLSSVCF-AWEZNQCLSA-N 394.290 5.578 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(F)c(Br)c1 462232611 NKLWWKULJQNBGY-GFCCVEGCSA-N 379.298 5.595 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nnc(-c2cccs2)o1 463253165 BPDTZDSDKJVPMS-ZDUSSCGKSA-N 390.493 5.585 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(Cl)c2ccccc12 463267121 PPZUQVBUZFZFSK-OAHLLOKOSA-N 377.875 5.267 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)Nc1ncccc1C#N 466817938 WIOCLZHYZAFEFY-LLVKDONJSA-N 399.317 5.321 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@]4(CCCCO4)[C@@H]3C#N)o2)c1 468143513 HYSGFDQAYLFABQ-LADGPHEKSA-N 392.499 5.137 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(CCOCc2ccccc2)CC1 471823662 FCBRZQBLYJXWMR-SFHVURJKSA-N 394.540 5.264 30 20 GKED C[C@@H](C(=O)N[C@@](C)(C#N)CCc1ccccc1)c1ccc(Cl)c(Cl)c1 471969535 JIMLIKFSLOVXQM-JLTOFOAXSA-N 375.299 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(N2CCC(C)CC2)nc1 476118003 AFMQPIUTLRUJTJ-UHFFFAOYSA-N 377.532 5.422 30 20 GKED C=CCCC1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CC1 476674518 ITANFOIJMUNUAU-UHFFFAOYSA-N 386.854 5.416 30 20 GKED C=C(C)[C@H](NC(=O)N(CCC)Cc1ccc(C#N)cc1)c1ccc(F)c(F)c1 477756364 VOYXQOADXHQMHZ-NRFANRHFSA-N 383.442 5.075 30 20 GKED Cc1ccccc1[C@H](C)SCC(=O)Nc1ccccc1SC[C@H](C)C#N 480369029 FSOKGWGTIYKKAF-WBVHZDCISA-N 384.570 5.680 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2SCCC#N)c(Cl)c1 481817698 ZYXJHQPKGHXJQK-UHFFFAOYSA-N 388.920 5.452 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc(F)c(F)c(F)c3)c2)cc1 482879734 RNXGIRCMUGTFBM-UHFFFAOYSA-N 396.368 5.001 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(NC(=O)CCC)ccc1Cl)c1ccccc1 489619167 OVXVQKRGEVCEQE-GOSISDBHSA-N 384.907 5.767 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)c1sc2ccc(C#N)cc2c1C 499462286 KADAJXULXXFSJJ-UHFFFAOYSA-N 392.524 6.039 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N[C@@H](C#N)c2ccc(Cl)cc2)C1 501208867 LIBBNWKLZOOTGK-UXPWSPDFSA-N 376.928 5.177 30 20 GKED CCCn1ccc2ccc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)cc21 503495945 HYHBUKAYNAASHX-UHFFFAOYSA-N 384.483 5.244 30 20 GKED CCN(C(=O)CCc1ccc(Cl)c(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 508942311 PVDAGTJNOJKQLY-AWEZNQCLSA-N 375.299 5.407 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2ccc(SCc3ccccc3)cc2)nc2ccccc21 513677393 VTRQFHDKMIPLGG-FQEVSTJZSA-N 397.503 5.356 30 20 GKED CC1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCC(=O)CC1 518900431 VGUCGZPJLVDDGJ-UHFFFAOYSA-N 382.847 5.092 30 20 GKED CCOc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1OC 521791832 FQNPAOZISLWFND-UHFFFAOYSA-N 388.423 5.010 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccc(C#N)c2)c(C)c1 521820467 ZWTZGKCNEZQZEM-UHFFFAOYSA-N 392.506 5.318 30 20 GKED COc1ccc(C[C@H](N[C@@H](C#N)C2CCCCC2)c2ccccc2)cc1OC 522380940 URIGOTSZXBNVCC-VXKWHMMOSA-N 378.516 5.050 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccn3c2)cc1Cl 530811308 FYDJKBAASLAGGP-OAQYLSRUSA-N 385.854 5.500 30 20 GKED Cc1cccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1Cl 534353359 JJCRLRYJZAOIPN-UHFFFAOYSA-N 390.870 5.546 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c(C)c1O 536408509 XUZNMCBFYQACCP-UHFFFAOYSA-N 392.842 5.579 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)Nc1cccc(C#Cc2ccccn2)c1 536897747 PMZHKJPAMVQMTP-UHFFFAOYSA-N 384.479 5.049 30 20 GKED C[C@H](NCC(=O)Nc1sccc1C#N)c1ccccc1-c1ccc(Cl)cc1 537114762 GYMSCSWLGQZHLO-AWEZNQCLSA-N 395.915 5.229 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 537947538 YFYWPKDWFWEXML-IERDGZPVSA-N 380.438 6.137 30 20 GKED N#CCC1CCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1 541041735 LTVXNMLAHVORQG-UHFFFAOYSA-N 376.485 5.121 30 20 GKED COCCOc1ccc(C#N)cc1N[C@H](C)c1sc(-c2ccccc2)nc1C 541558577 FJGUKWDJTVXHOW-OAHLLOKOSA-N 393.512 5.189 30 20 GKED N#C[C@@H](C(=O)c1coc(C2CCCC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 549420804 MVPFNDZNZMDQON-HNNXBMFYSA-N 397.887 5.599 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H]1CC[C@@H](C#N)C1 549933784 BQWWAGCGPIZOTB-YUTCNCBUSA-N 390.350 5.224 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1cscc1Br 550520067 VNOWXTJRMOPNLQ-NSHDSACASA-N 395.347 5.086 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 550828087 WPVQQATYYRFLJD-VGSWGCGISA-N 376.504 5.056 30 20 GKED CC(C)(CCC#N)CNC(=O)C1(c2cccc(C(F)(F)F)c2)CCCCC1 563918310 OLEMHMPWDRZSBW-UHFFFAOYSA-N 380.454 5.353 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 570845988 PNNBHENIDZEJFK-HNNXBMFYSA-N 398.491 5.047 30 20 GKED Cc1ccccc1-c1cc(C(=O)Nc2ccccc2C#N)c2cnn(C(C)C)c2n1 590612853 QXKZVMIMXJEYGS-UHFFFAOYSA-N 395.466 5.112 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccc(F)cc2[C@@H](C)C1 593158408 VKTXRWPFNYVWBW-HOTGVXAUSA-N 397.519 5.414 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCCC(F)(F)CC2)cc1 600255776 RDAYJSBYWUVLLE-UHFFFAOYSA-N 386.467 5.112 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(COc3ccccc3C#N)o2)c(Cl)c1 603945684 MMLHMJQAEUJKFW-UHFFFAOYSA-N 380.831 5.253 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cn2)cc1 604242424 TYPJILFUKRYYJK-UHFFFAOYSA-N 388.814 5.133 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc3oc(C4CC4)nc3c2)c1 608804180 USICCAJYZCLGNU-UHFFFAOYSA-N 399.406 5.001 30 20 GKED N#Cc1c(NC(=O)Cc2cccc(Cl)c2)sc2c1-c1ccccc1CC2 609010736 GEFHUYGSQSMVJD-UHFFFAOYSA-N 378.884 5.220 30 20 GKED N#CCn1c(C(=O)N(Cc2ccco2)c2ccc(Cl)cc2)cc2ccccc21 609215650 HJICGZXHNOYZID-UHFFFAOYSA-N 389.842 5.258 30 20 GKED CC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)C(C)(C)C 609254872 ZIEHHAJCHSYPCA-OAQYLSRUSA-N 381.495 5.234 30 20 GKED N#Cc1ccc(CSCc2nc(-c3c(Cl)cccc3Cl)no2)cc1 609474219 URQUSHMDBQSHRI-UHFFFAOYSA-N 376.268 5.348 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 609566860 SKOFDGWRCYWWHD-FQEVSTJZSA-N 397.478 5.018 30 20 GKED CC(C)(Cc1ccccc1)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 609784709 RMDFLHVIIWRSNK-UHFFFAOYSA-N 397.478 5.018 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(-c3ncc[nH]3)c2)cc1 609875840 DRJXPRHSTJHBBV-UHFFFAOYSA-N 398.397 5.132 30 20 GKED C[C@@H](CC(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccc(C(F)(F)F)c1 609970520 NPRSTXRBBLCJNV-NSHDSACASA-N 398.331 5.311 30 20 GKED CC[C@@H]1CCCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 610093406 ITUVRSPOOBTEMI-JOCHJYFZSA-N 391.515 5.518 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 610196271 WSDSMRWAXWOLKK-CYBMUJFWSA-N 393.339 5.517 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1CN1CCc2ccccc21)c1cccc(C#N)c1 610321924 SOUOGNBIOYTCLN-GOSISDBHSA-N 396.494 5.004 30 20 GKED Cc1cc(F)ccc1NC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 642422353 JRRLREQRHBHQJY-IAZYJMLFSA-N 386.311 5.165 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 684632062 PKGOQZVXYHDKLN-CQSZACIVSA-N 391.427 5.143 30 20 GKED O=C(/C=C/C1=Cc2ccccc2OC1)c1ccc(OC(F)F)cc1OC(F)F 728156138 BWKLEOZQHVPRRY-VMPITWQZSA-N 394.320 5.104 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 730993592 BQXWHGMMAUAJCM-LBPRGKRZSA-N 396.459 5.803 30 20 GKED C=C(C)CN1CCC(NC(=O)c2sc3cc(C(C)C)ccc3c2Cl)CC1 732659425 BSDAZCXNIIMHDX-UHFFFAOYSA-N 390.980 5.448 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2c1C 735035538 FHMFKAONCUTOJD-QFIPXVFZSA-N 379.463 5.693 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cc(-c4ccccc4)on3)cc2)cc1 736007932 YMUOQESEIQGKIO-UHFFFAOYSA-N 395.418 5.187 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ncccc2C(F)(F)F)cc1 741460114 MJQNQYSLWAKYDV-UHFFFAOYSA-N 385.389 5.612 30 20 GKED N#CC1(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CCCC1 746224179 FQYHZSCLUMKBBE-UHFFFAOYSA-N 394.474 5.499 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2O)cc1Cl 748447050 JKSFDOXQFCTIKK-LJQANCHMSA-N 391.858 5.023 30 20 GKED C=CCN(C(=O)C[C@H](C)OC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 749474572 QIIUAJFGZZZCEX-KRWDZBQOSA-N 392.524 5.421 30 20 GKED CC(C)c1ccc(C=NO[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)cc1 749528227 UQYXMBQPWYYFNL-CQSZACIVSA-N 378.394 5.207 30 20 GKED FC(F)Sc1ccc(NC(=S)NN=C2CCC3(CCOCC3)CC2)cc1 751520176 DCJSMLVBQGLJSV-UHFFFAOYSA-N 399.532 5.015 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(Cl)c(C(F)(F)F)c1 754690656 XVPYGBUYPXHXFO-FNORWQNLSA-N 394.805 5.773 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(Cl)c(C(F)(F)F)c1 754690741 ZBJYIWJAHATADV-SNAWJCMRSA-N 383.584 5.295 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)NCc2ccc(OCC#N)cc2)cc1 764400958 YHLFKZVUMLBSAO-HSZRJFAPSA-N 391.515 5.149 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 775722177 FRVFLQXRAYWRJN-RBUKOAKNSA-N 399.494 5.869 30 20 GKED Cc1c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cccc1N(C)C 775815563 CKVYKIQJCSXNRL-UHFFFAOYSA-N 385.467 5.172 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2cccc(Cl)c2)cc1 780165309 OMQJCOMNUNDKPF-OAHLLOKOSA-N 392.842 5.675 30 20 GKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 782346835 DXZRMPIZNBPTJW-HUCIYCNJSA-N 391.442 5.218 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3ccco3)s2)ccc1SC(F)F 789126506 FZCSDXAQUYAAOS-WAYWQWQTSA-N 393.436 5.623 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@](C)(O)c1cccc(Cl)c1 789455437 LCJUOAHIOWPZMX-JOCHJYFZSA-N 386.923 5.221 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792097949 ZGEBJWHLHRHAEC-SCLBCKFNSA-N 383.278 5.597 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792106450 QUFCHHRRKLGBBO-LJQANCHMSA-N 387.439 5.072 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C[C@H]1CCC(F)(F)C1 797866482 TUTJOJFWBUXJBT-LLVKDONJSA-N 392.393 5.475 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2cccc(OCc3ccccc3)c2)SC1=S 814290817 OTVXQXJEVJPYAX-XDHOZWIPSA-N 381.522 5.043 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)Cc2ccccc2O1 814578362 YUHJXLYRZBGKEF-WZONZLPQSA-N 397.478 5.157 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2sc3ccc(Br)cc3c2C)n1 815898139 UMUIESHLCJVRRX-GFCCVEGCSA-N 391.315 5.227 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C\c1ccc(Cl)cc1 915054594 GRKODBYBSGSSTJ-WDZFZDKYSA-N 389.842 5.359 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1 915087356 SRVRAFTUWVOIBC-IBGZPJMESA-N 378.378 5.196 30 20 GKED O=C(/C=C\c1cc(Br)cs1)c1ccc(Br)s1 916134196 FMFWBUBVMIUDJB-UPHRSURJSA-N 378.110 5.231 30 20 GKED O=C(/C=C/c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccncc1 916136642 VFLBPMUZTLCOTH-XVNBXDOJSA-N 380.787 5.332 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(Cl)s1)C(=O)Nc1cc(Cl)cc(Cl)c1 916946002 HRVHGRBJQNLMPV-KNVIWWDSSA-N 399.686 5.069 30 20 GKED O=C(/C(=C\c1ccc2c(c1)CCO2)c1nc2ccccc2s1)c1ccccc1 917516208 OMHQJPRIQWVQFA-XDJHFCHBSA-N 383.472 5.655 30 20 GKED CC(C)(C)C1CCN(N=Cc2cccc(OCc3ccccc3C(=O)O)c2)CC1 1776057880 MVSCLAMMXKXVGJ-UHFFFAOYSA-N 394.515 5.056 30 20 GKED C=CCc1cc(C)c(OCCCN2CC[C@@H]3C[C@@H](CC(=O)O)CC[C@H]3C2)cc1C 1776186203 PKZYIWGYAJGCKA-WWNPGLIZSA-N 399.575 5.014 30 20 GKED CC1(C)/C(=C/c2csc3ccc(C(=O)O)cc23)C(=O)c2cc([N+](=O)[O-])ccc21 1776515303 AZKKROUJVYHXJX-CAOOACKPSA-N 393.420 5.065 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1777341311 FKIRTTPCZOSYDS-SLTDHEAWSA-N 384.431 5.200 30 20 GKED O=C(/C=C/c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 1777570125 WDJRRUAPDQMWHZ-SOFGYWHQSA-N 397.383 5.057 30 20 GKED C[C@H](C#N)Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1Cc1ccccc1 4287584 PHXJCJNSDLMKPD-MRXNPFEDSA-N 376.529 5.295 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccccc1 4362045 KSDJUUGHFNPBAA-KRWDZBQOSA-N 377.513 5.111 30 20 GKED C=CCN(CC(=O)Nc1c(C)cccc1C(C)C)Cc1ccc(Cl)s1 8164100 XTQCAKYSVBAYKA-UHFFFAOYSA-N 376.953 5.460 30 20 GKED Cc1ccc(C)c(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)c1 20834573 SVLOSWNJNRLUGM-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cc1nc(COc2ccccc2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cs1 25440094 XSKFIYCEJMAXHB-UHFFFAOYSA-N 391.496 5.084 30 20 GKED C=CCn1c(SCC(=O)c2ccc(Oc3ccccc3)cc2)nnc1C1CC1 31613031 SDAAFTYKNQDCJD-UHFFFAOYSA-N 391.496 5.109 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N(C)Cc3cccc(C#N)c3)c2)C1 63398908 LGAVJUFBXPRUIC-JPYJTQIMSA-N 391.515 5.317 30 20 GKED CCOc1ccc(C(=O)CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66856191 WEIBPIAUBSGMOZ-INIZCTEOSA-N 396.512 5.081 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1cc(F)ccc1F 72040926 BDBZABLETGFNKE-CQSZACIVSA-N 393.393 5.068 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Oc2nccs2)c1 134747625 VXHCHEXAIDNBKY-AWEZNQCLSA-N 395.509 5.582 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)on1 136980027 JBLNAJSVMMOESK-CYBMUJFWSA-N 381.432 5.127 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 155147645 FIIJRDKKOACPTF-MRXNPFEDSA-N 394.902 5.547 30 20 GKED COCCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 178843479 RHYLATUEDJIOOZ-CYBMUJFWSA-N 395.311 5.110 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 189280368 QKXYOOJHLNFHEU-UHFFFAOYSA-N 390.292 5.108 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2C)c1 189899572 FNDRHMVYHRANMR-KKSFZXQISA-N 376.500 5.385 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(F)ccc2s1)c1nc(-c2ccncc2)cs1 194181389 JNTLYDBXKKMARK-AWEZNQCLSA-N 379.441 5.049 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC/C=C\c3ccccc3)n2)cc1 255895438 WHVZNIZXTJIRSG-JUIXODQZSA-N 388.492 5.489 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 303299660 CNBHBGBHUFSHGD-UHFFFAOYSA-N 387.439 5.023 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N(C)Cc2ccc(C#N)cc2)cc1F 303653499 FOTQSVNLVHRSPW-UHFFFAOYSA-N 376.406 5.084 30 20 GKED CC(C)(COc1cc(Cl)cc(Cl)c1)/C(O)=N/[C@@H]1CCC(O)=NC12CCC2 328729368 FKDSSIOEMZTNMG-OAHLLOKOSA-N 399.318 5.397 30 20 GKED CN1CCC(O)=Nc2cc(/C(O)=N/[C@@H]3CCCc4sc(Cl)cc43)ccc21 329233510 LZJPZWJMPKWOOG-CYBMUJFWSA-N 389.908 5.212 30 20 GKED OC(=Nc1ccccc1N1CCCC1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329402261 ZHOCZPGPJSLLLU-IBGZPJMESA-N 392.547 5.382 30 20 GKED O/C(=N/C1(c2nccs2)CCCC1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329410499 BMKCPIALGQOPIO-KRWDZBQOSA-N 398.576 5.376 30 20 GKED CC(O)=Nc1ccc(C/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)cc1 329497358 JHAIPDBRGHKNAN-HXUWFJFHSA-N 380.492 5.183 30 20 GKED OC(=Nc1cccc(COC2CCCCC2)c1)N1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 329720779 AOECQIDQRJYPSF-VXKWHMMOSA-N 398.547 5.115 30 20 GKED CC(C)(CC(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1)C(F)(F)F 410176231 YDFMIOWSCOUBQD-UHFFFAOYSA-N 399.350 5.471 30 20 GKED N#Cc1ccc(NC(=O)CCOc2ccccc2-c2ccccc2)c(Cl)c1 430357332 RVPIDDWRQSXSRM-UHFFFAOYSA-N 376.843 5.286 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 431861665 VMNCBCNXSBWSBG-UHFFFAOYSA-N 384.357 5.109 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)c2)o1 432991042 IJFPNMNPMUFNIE-FYYLOGMGSA-N 399.494 5.867 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1F 437494474 MMUIZELHOXIUGU-UHFFFAOYSA-N 385.398 5.152 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccccc1 438838174 RYDGWGQABXSWHL-DHIUTWEWSA-N 387.458 5.259 30 20 GKED CCCc1c(NC(=O)Nc2c(C)cc(C)cc2C)cnn1-c1cccc(C#N)c1 439222184 JNFWXUDCPNYRDI-UHFFFAOYSA-N 387.487 5.266 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nc(C(F)(F)F)cs2)cc1F 443466619 ZWOXQDJGMFGBBH-UHFFFAOYSA-N 393.365 5.577 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(OC(F)F)c(F)c1 448944886 UDYFHTVDENHWRX-GFCCVEGCSA-N 394.418 5.003 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccccc1 455302571 MNGGZDASMOFHBL-ROUUACIJSA-N 393.384 5.005 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 457449380 ILWHDZJNULATRT-BLLLJJGKSA-N 380.797 5.522 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464461190 MNWNNNMFRXVFRN-CQSZACIVSA-N 387.386 5.022 30 20 GKED C=C(C)C[C@@H](C)C(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 466602206 QVODDOUGZRXEMX-UTKZUKDTSA-N 376.500 5.027 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)C2(c3ccc(C#N)cc3)CC2)cc1 473884518 IIEOYCPORKHCNN-GOSISDBHSA-N 396.490 5.143 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc([N+](=O)[O-])cc1Cl 475563676 JQLHNOZBPLISEH-UHFFFAOYSA-N 387.867 5.422 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccccc1 476253196 DYXNYNDMVKFRDC-FQEVSTJZSA-N 389.499 5.231 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(F)ccc(F)c2F)cc1F 476665039 GSOFCDSWMDWNFY-UHFFFAOYSA-N 386.304 5.159 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccc3ccccc23)n1)c1nc2ccccc2[nH]1 480936842 DROXWKMNEMILKJ-QGZVFWFLSA-N 394.459 5.330 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(Oc2ccncc2)c1 482819824 BZXCVAZIFLYHSJ-UHFFFAOYSA-N 391.430 5.665 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1cc(-c2cc(C)sc2C)nc2onc(C)c12 488843543 USBKPOBZNIXJCH-HNNXBMFYSA-N 381.501 5.057 30 20 GKED Cn1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1C1CCC1 497446286 XTQBZERZLCJCBK-CQSZACIVSA-N 397.450 5.184 30 20 GKED CCCCc1noc([C@@H](C)Sc2nc3c(c(-c4ccco4)c2C#N)CCC3)n1 498056121 ANOFAQAHLCMJBG-CYBMUJFWSA-N 394.500 5.281 30 20 GKED CCc1c(C)nn(-c2cccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c2)c1C 499199334 ABVFCDMWFLBCCR-UHFFFAOYSA-N 386.499 5.105 30 20 GKED Cc1ccc(-c2nc(C(=O)N(Cc3ccc(C#N)cc3)C3CC3)cs2)c(C)c1 499323256 JRAIVVTWARWKPO-UHFFFAOYSA-N 387.508 5.103 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc3c4c(cccc24)CC3)cc1 508150461 VZTXVLDRAQCMAK-UHFFFAOYSA-N 396.490 5.005 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1 509564210 PIOKJPSYCHVFRT-LEWJYISDSA-N 386.948 5.217 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510642359 AYIAUDPQNVHRGW-UHFFFAOYSA-N 397.887 5.729 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]1C1CCCC1 510858584 WVIPWOJXQBMOCN-HSZRJFAPSA-N 389.499 5.846 30 20 GKED N#Cc1c(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)sc2c1CCCC2 512384300 NILMWNSPQXNPBK-UHFFFAOYSA-N 375.497 5.065 30 20 GKED C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](COC(F)F)C1 512850908 MBTUGTDQZQLQOJ-ZJUUUORDSA-N 391.302 5.346 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N[C@@H](c2cccs2)C2CC2)c1 513122562 GBZFBNUFGHQRJG-JOCHJYFZSA-N 388.492 5.080 30 20 GKED C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1C(=O)NCC(C)(C)CCC#N 513139958 ABNRNMPHYMZJBM-WMZHIEFXSA-N 389.543 5.105 30 20 GKED C=CCC[C@@H](NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccco1 513678057 HQJSOQXFEIKITO-OAQYLSRUSA-N 378.447 5.468 30 20 GKED CN(Cc1cc(C#N)cs1)[C@H]1CCSc2ccc(Br)cc21 513733918 XPXYTXAXLRKAGF-HNNXBMFYSA-N 379.348 5.051 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 519888501 AFTIXCNDBJOSQQ-UONOGXRCSA-N 375.394 5.041 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1 521670823 YZHHYSFDSXETFA-KGVIQGDOSA-N 392.499 5.060 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Cl)cc1Cl 525266515 YNZIAVUNSKKSJN-UHFFFAOYSA-N 375.708 5.928 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccccc2OCC2CC2)c1 525367723 UVAYYLHPVNHBLS-UHFFFAOYSA-N 398.462 5.178 30 20 GKED C[C@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1cccc(F)c1 525659901 SRVLRYRJYQQUQR-ZDUSSCGKSA-N 376.456 5.267 30 20 GKED C[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1cccc(-c2ccncc2)c1 525859226 QLINNRHUZGNOSC-BIOCXDLKSA-N 398.510 5.056 30 20 GKED C=CCCc1ccccc1NC(=O)N1[C@H]2CC[C@H]1c1cnc(C(C)C)nc1C2 529093831 VNJUUVIPUWZYLB-UWJYYQICSA-N 376.504 5.012 30 20 GKED N#CCC[C@@H](NC(=O)CCc1nc2cc(Cl)ccc2s1)c1ccccc1 533051677 OTOGWKCEDGUURA-MRXNPFEDSA-N 383.904 5.044 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)NCc1ccc(-c2ccccc2C#N)cc1 538000622 RAZRMTARTJXMDP-SFHVURJKSA-N 384.479 5.044 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 538434606 QELOIBGDQPMLNV-CVEARBPZSA-N 378.419 5.047 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 539506586 CGANBLIPBFXNOL-KBXCAEBGSA-N 383.289 5.891 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cc(Cl)ccc1SC1CCCC1 542535933 HQOWWIAAKIGLCI-UHFFFAOYSA-N 386.904 5.507 30 20 GKED O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)[C@H]1CCC[C@H](C(F)(F)F)C1 544061227 FUQFEOKFDHMXPR-MWODSPESSA-N 389.286 5.053 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1csc(-c2cccc3ccccc23)n1 546005830 XZMAIJKYOCTUBC-UHFFFAOYSA-N 385.448 5.096 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc2nc(C(F)F)sc2c1 553655323 MSZLCYJVEXFRBD-UHFFFAOYSA-N 376.453 5.764 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(O[C@@H](C)CC)c1 554159775 MBFYVMLJRAEWKL-SFHVURJKSA-N 384.524 5.252 30 20 GKED Cc1c(C(=O)N[C@H](c2ccccc2)c2nccs2)sc2ccc(C#N)cc12 559564002 AQZAXAGGVNRGHX-GOSISDBHSA-N 389.505 5.057 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2ccc(C(F)(F)F)cn2)cc1F 559947524 YNIURHYZUSGJCU-UHFFFAOYSA-N 387.336 5.516 30 20 GKED CN(C)Cc1ccc(-c2ccccc2CN[C@H]2CCc3ccc(C#N)cc32)cc1 565568870 OTKRUPIRSUUWPG-SANMLTNESA-N 381.523 5.064 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1nc(Cc2ccccc2)cs1 574000121 XFUCHVJEGXOVPM-UHFFFAOYSA-N 390.512 5.050 30 20 GKED C=CCOc1ccc(/C=C\c2nc(-c3cccc4cnccc34)no2)cc1OC 579819138 JWJACOHHQAIHGU-NTMALXAHSA-N 385.423 5.029 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)C1 583857599 NZZXPPBOOQRJOY-RDJZCZTQSA-N 393.453 5.242 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)F)cc1)c1nc(-c2c(F)cccc2F)cs1 588348915 HLDWBKXNOZGAOH-GFCCVEGCSA-N 390.361 5.516 30 20 GKED Cc1cccc2sc(C(=O)N[C@H](CCCC#N)c3ccccc3)c(Cl)c12 590477900 CUYRTKHGOAYHIR-MRXNPFEDSA-N 382.916 6.028 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1 591773950 HYUBTTWGOBRVRC-WMLDXEAASA-N 394.462 5.115 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCC3(C#N)CCCC3)c(C)c2)n1 593151299 RGWLMYJIXGXNIL-UHFFFAOYSA-N 386.546 5.117 30 20 GKED CC[C@@H](OCCn1cc(C#N)c(=O)c2cc(C)cc(Cl)c21)c1ccccc1 593424500 IGMYPBHBCSIXMV-HXUWFJFHSA-N 380.875 5.003 30 20 GKED CSc1ccsc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 593595449 YXCHPMRDQRJTLG-VIFPVBQESA-N 398.456 5.589 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1C1CCOCC1 597187994 WCBKQXWPNWGCKJ-INIZCTEOSA-N 397.544 5.103 30 20 GKED COc1ccc(CN[C@H]2CCCc3ccc(Cl)cc32)cc1OCCCC#N 599008258 XKXXGQOGRYBWDR-FQEVSTJZSA-N 384.907 5.198 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N[C@@H](C)c1ccc(C#N)cc1 603872432 SPPTVUYODUBZDB-RYUDHWBXSA-N 379.312 5.223 30 20 GKED N#Cc1ccc(CNc2ccccc2Oc2ncc(Cl)cc2Cl)c(F)c1 604009931 GIGLOYHJYWXGHX-UHFFFAOYSA-N 388.229 5.804 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1 604550611 KKPNVHSURZKXSA-UHFFFAOYSA-N 375.859 5.005 30 20 GKED CCCOc1ccc(CNCc2cccc(OCc3ccccc3C#N)c2)cc1 609432612 AJMTXFNPMXTBJI-UHFFFAOYSA-N 386.495 5.216 30 20 GKED N#Cc1cccc(/C=C/c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c1 609475663 ZASDWHZOYKJKGF-ONNFQVAWSA-N 384.370 5.105 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)sc2c1CCCC2 609496351 MPWPQLIUNVOSCK-LSDHHAIUSA-N 390.430 5.260 30 20 GKED Cc1ccccc1-n1c(S[C@H](C#N)C2CCCCC2)nnc1-c1cccnc1 609648704 QJTYQWRNBGIKAF-HXUWFJFHSA-N 389.528 5.202 30 20 GKED CC(C)c1cc(CNC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)on1 609724873 SYINQINEJDJSCC-UHFFFAOYSA-N 395.846 5.045 30 20 GKED COc1ccc(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)n2CC(C)C)cc1 609813574 LZVKLWPJEJNZTO-MRXNPFEDSA-N 392.528 5.335 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 618742760 RJZZEFCDEJIAKQ-IBGZPJMESA-N 399.441 5.478 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H]1CCCCC1(F)F 622485546 QKNFWROSOUOSIK-NEPJUHHUSA-N 389.286 5.251 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)s1 681351605 DKVQVXWFVUYIEZ-SFHVURJKSA-N 383.476 5.465 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c12 728813614 PBZCZBVZXSEUOY-JOCHJYFZSA-N 379.463 5.313 30 20 GKED Cc1cccc(-c2nn(CN(C)[C@H](C)CC#N)c(=S)n2[C@@H]2CCCC[C@@H]2C)c1 728901862 BNUHBQOISNTOFU-NLWGTHIKSA-N 397.592 5.332 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sccc1SC(F)F 730469900 QLBVOACWKVJOLT-UHFFFAOYSA-N 379.906 5.606 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 730895262 FSNLRAZDJIKDTD-ZCYQVOJMSA-N 383.495 5.789 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CCc2nc(-c3ccccc3F)sc21 731938012 NWVZSHVJGQPKHP-RAXLEYEMSA-N 380.400 5.070 30 20 GKED COc1cc(/C=C2/CCOc3c(Cl)cccc3C2=O)cc(Cl)c1OC 733749497 YLOHRYSOBJDXNV-WQLSENKSSA-N 379.239 5.059 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734683552 NSJPRUNISFVEGX-UGSOOPFHSA-N 378.303 5.408 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCOC2CCCCCC2)cc1 735742654 IIDJRDWVQMTLNV-QHCPKHFHSA-N 391.515 5.203 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1cnn(-c2cc(C)ccc2C)c1C 741760926 UXHHQRWHIURZNY-UHFFFAOYSA-N 387.409 5.047 30 20 GKED CC(C)(C#N)CCSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1 742448125 WCCVEDFRLCHOPX-XMHGGMMESA-N 393.487 5.242 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)CCc3cccc(F)c3)n2)cc1 744035005 MAUNLGHDNQPLFJ-UZLBHIALSA-N 392.499 5.703 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc2ccccc2c1 744119667 UOKRRQNOCSHJSF-GOSISDBHSA-N 388.467 5.743 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C(=C/c2ccc(F)cc2)c2cccs2)n1 747196784 BKBQATAEQHZLKU-BRVCPTFNSA-N 396.512 5.884 30 20 GKED C#CC[C@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1 757616720 FZUXUMOKOIHMER-FQEVSTJZSA-N 376.843 5.022 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cnc1Cl 771100393 YDKRCPWUZPPUCU-UABRLCRWSA-N 389.854 5.027 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(OC)c1)c1ccccc1 777552125 NYKYPHBRLPZTBJ-GOSISDBHSA-N 396.487 5.341 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)ccc1OC 779408849 DADUBGHDCXFNRK-YADHBBJMSA-N 394.490 5.241 30 20 GKED C#CCCCCCC(=O)N(Cc1ccccc1)[C@@H]1CCOc2ccc(OC)cc21 779967345 KPSUOGDJRPZXBC-HSZRJFAPSA-N 391.511 5.131 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@@H](C#N)c3nccc4ccccc34)cs2)c1 792094171 DHERXJIKNBLCHO-HXUWFJFHSA-N 383.476 5.086 30 20 GKED CCOC(=O)c1scnc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 794931900 RMRHHYDPEVZRAZ-AATRIKPKSA-N 390.675 5.176 30 20 GKED N#CC[C@@H](CC(=O)O[C@@H](Cc1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 796672748 AXSIKRGNTZFSLB-WMZOPIPTSA-N 395.808 5.444 30 20 GKED N#CC[C@H](CC(=O)Oc1cc(Br)ccc1Cl)c1ccccc1 796786269 HRDJBWKDTXIBPB-CYBMUJFWSA-N 378.653 5.095 30 20 GKED C[C@@H]1[C@H](C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)[C@@H]1c1ccccc1 797551649 MXEJVLRAWLMKCY-BYNNNNKLSA-N 394.446 5.314 30 20 GKED C[C@H](Nc1ccc(N2CCCCCC2)cc1)C(=O)Nc1ccc(C#N)c(Cl)c1 799289642 GQOGXYCJASSSBY-INIZCTEOSA-N 396.922 5.031 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1sc(Cc2ccccc2)nc1C 814801361 HVDLAQVGNZOJST-UHFFFAOYSA-N 390.434 5.292 30 20 GKED C[C@@H](Sc1nc2ccccc2s1)C(=O)N[C@H](CCCC#N)c1ccccc1 817325020 VBFGSBKIMKBFLM-NVXWUHKLSA-N 395.553 5.328 30 20 GKED Cc1ccc(NN=Cc2cc(Br)ccc2OCc2ccccn2)cc1 818198204 PTRKTQNBMDEXAM-UHFFFAOYSA-N 396.288 5.178 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1)c1ccccc1 819475132 HBWKYCMAGIITEV-CTNGQTDRSA-N 387.527 5.122 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2nnc(C(C)C)s2)cc1OCC 842018855 IKYQPZGLTKWCRT-UHFFFAOYSA-N 397.928 5.053 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(-c3cnc(C4CC4)o3)cc2)c1 864002590 NPAADHKNIPOHAG-UHFFFAOYSA-N 394.272 5.465 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C\c1ccccc1Cl 915055334 HVQVWZMOOOFNIP-FLIBITNWSA-N 389.842 5.359 30 20 GKED Cc1ccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976489 POYNSLBOZAZDPG-RDTXWAMCSA-N 396.899 5.416 30 20 GKED CCCCCCCCOc1ccc(C=NNc2cccc(C(=O)O)c2C)cc1 1776086537 ZWCFIMLZGJUCSF-UHFFFAOYSA-N 382.504 5.879 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776120065 UTBYKAVJQNSOEY-XFXZXTDPSA-N 390.435 5.544 30 20 GKED CC(C)c1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)c1 1776375479 RLGYNUMAFUWYEN-JXMROGBWSA-N 376.408 5.370 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1ccc(OCc2occc2C(=O)O)cc1 1776665961 PHAODDFMAUBHIK-NWGMWSOJSA-N 388.419 5.015 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776698014 ZHSPKYCSXNJIAN-VPEZWSJASA-N 398.502 6.390 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2csc(C(=O)O)c2)cc1OCC 1776815305 LMUGMJRTOCZCAY-AATRIKPKSA-N 394.876 5.183 30 20 GKED CCN(CC)c1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1F 1776860344 DEUXFGGRFFZXFT-DHZHZOJOSA-N 399.462 5.053 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1OC 1777353261 IELYCRPPHZGMPX-CLFYSBASSA-N 394.448 5.027 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)c1 1777686121 MQENUDHMWNQHDG-VMPITWQZSA-N 397.770 5.103 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 24499168 ITOOOIWPHAXLTG-UHFFFAOYSA-N 385.467 5.159 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(OC(F)F)c3)n2)cc1 46442778 GHKJQHQVUKRHJZ-MRXNPFEDSA-N 384.407 5.210 30 20 GKED N#C[C@H](C(=O)CCSc1ccccc1F)c1nc(-c2ccccc2)cs1 51533958 HFEHGFCJGNPSFJ-OAHLLOKOSA-N 382.485 5.308 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1cccc(Cl)c1Cl 56199967 KBPYGCPJQBCAGQ-CYBMUJFWSA-N 392.286 5.115 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCCOc2ccc(F)cc21 65546971 ALPCMSJTTMAICO-MRXNPFEDSA-N 394.899 5.152 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 114098322 AJSMHDSPHIJARU-CQSZACIVSA-N 393.874 5.153 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 160045745 JFJSIWISKYCJCV-UZLBHIALSA-N 379.529 5.622 30 20 GKED Cc1c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1CCC(C)C 160225098 JAWRPYPGEDIWQK-HNNXBMFYSA-N 385.537 5.276 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3cc(-c4ccccc4)oc3C2)cc1 176293170 RFTAUZZKTSDEPQ-UHFFFAOYSA-N 385.467 5.338 30 20 GKED O=C(Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 181948373 YYAMHPSESONFAM-UHFFFAOYSA-N 396.218 5.024 30 20 GKED C[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(OCC#N)cc1 182866890 CUDFIVVYYMHVEE-GOSISDBHSA-N 392.503 5.170 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccccc1O[C@H]1CCOC1 191478468 BIOLGUHFMCQXEM-SFHVURJKSA-N 380.488 5.350 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCC[C@H](C)c2cccc(C(F)(F)F)c2)cc1 237566777 HNGSADOEAXTBCA-HOTGVXAUSA-N 376.422 5.280 30 20 GKED C[C@H](N[C@H](C)c1nc(-c2cccnc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 368060526 NKUKOXKXGCXMCC-DLBZAZTESA-N 395.466 5.082 30 20 GKED C=CCCc1ccccc1NC(=O)c1sc(NC(=O)c2ccco2)cc1C 410393000 NGLRYPJKGCLFRL-UHFFFAOYSA-N 380.469 5.273 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c[nH]c(C(F)(F)F)c1 429813778 SAWKJLGOJOCBIZ-UHFFFAOYSA-N 385.345 5.258 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(-c3ccccc3Cl)cs2)c1 429959223 UANBRTPQCBSNRH-UHFFFAOYSA-N 385.901 5.331 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(COCc2ccccc2)cc1 438372078 NVPLLEURSFPINA-UHFFFAOYSA-N 392.524 5.685 30 20 GKED CCCc1c(NC(=O)Nc2ccsc2Cl)cnn1-c1cccc(C#N)c1 439678800 QZACNSZLASYTBH-UHFFFAOYSA-N 385.880 5.055 30 20 GKED N#Cc1c(NC(=O)c2cccc(F)c2Cl)sc2c1-c1ccccc1CC2 443885898 ZYAMJKLRQVTFEN-UHFFFAOYSA-N 382.847 5.430 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(c3ccc(C#N)cc3F)C2)n1 447693740 NYYFLRMEUWWYLD-INIZCTEOSA-N 393.487 5.213 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1cccc(C2CC2)c1 451113857 JWOCLBRPFSUVDG-DLBZAZTESA-N 393.556 5.248 30 20 GKED CCCN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@@H](C)c1ccccc1Br 459012183 OKCDTJAYZZPLJC-JYJNAYRXSA-N 392.341 5.014 30 20 GKED COc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1SC 459393872 GHBLRJHINHBQSC-CYBMUJFWSA-N 387.530 5.455 30 20 GKED CCN(Cc1nc2ccc(Br)cc2o1)[C@@H](C)c1ccc(C#N)cc1 463076169 HKFRCDZFCRWQLJ-ZDUSSCGKSA-N 384.277 5.045 30 20 GKED Cc1ccccc1-c1nc(C(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cs1 464933822 BCFJENHOSZLTNO-FPOVZHCZSA-N 387.508 5.031 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 465389985 WUIKHSDTMYJJGK-SNVBAGLBSA-N 386.820 5.023 30 20 GKED C=CC[C@H](CC)NC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 466323869 BQKKOSYQTLIXEG-INIZCTEOSA-N 392.330 5.455 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCN1c2ccccc2CC[C@@H]1C 469197243 ZDIJQINENINRQZ-ROUUACIJSA-N 393.556 5.251 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(Sc2ccccc2Cl)nn1 469670032 BYTUOJPNENOLKS-UHFFFAOYSA-N 375.925 5.100 30 20 GKED Cc1nc2ccc(C(=O)Nc3sc4c(c3C#N)-c3ccccc3CC4)cc2o1 470834260 WAAWRQVRQLEJNW-UHFFFAOYSA-N 385.448 5.087 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1ccccc1 474416413 RZTDNXRMHGECME-SFHVURJKSA-N 380.451 5.256 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 476119369 QLELFYCCLGBMAZ-PMACEKPBSA-N 387.445 6.300 30 20 GKED N#CCC[C@@H](NCc1ccc(Br)c2cccnc12)c1ccccc1 478264157 XKTQQJLEJVYPJA-LJQANCHMSA-N 380.289 5.132 30 20 GKED CCCCn1ncc(NC(=O)Nc2cc(C#N)ccc2OC(C)C)c1C(C)C 483851182 LBAWAIKZADKQGX-UHFFFAOYSA-N 383.496 5.109 30 20 GKED COc1cccc([C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)c1 496802195 HFROUCZSKIULJM-INIZCTEOSA-N 388.492 5.209 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2coc3ccccc23)cc1 499568119 ACFPCORKXHVDFN-UHFFFAOYSA-N 384.391 5.358 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccccc1Cl 499956877 KFKRTVORBSRZSU-KEYYUXOJSA-N 379.674 5.131 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 503142593 WXNNQNXPTSMDJV-APWZRJJASA-N 380.513 5.227 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3cccnc3)n2)o1 504486556 CXSNDKTXFUSFIX-LBPRGKRZSA-N 389.402 5.789 30 20 GKED C[C@H](NC(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccc(C#N)cc1 505311542 RISRMZDHTFFTKX-NSHDSACASA-N 397.784 5.035 30 20 GKED Cc1oc(C(C)C)cc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 507205055 TWZJOCYZRCFFDN-UHFFFAOYSA-N 388.467 5.609 30 20 GKED Cc1nc(-c2ccc(CNC3CCC(C#N)(c4ccccc4)CC3)o2)cs1 507645784 TWCQJHKOLSVOEG-UHFFFAOYSA-N 377.513 5.205 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2nc3cc(Cl)ccc3s2)CC1 507654696 WIBNHNJSYUQDFJ-UHFFFAOYSA-N 381.932 5.443 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1 509497670 BSZKXXXLJDEUEB-KRWDZBQOSA-N 393.556 5.494 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc(-c3ccccc3)nc2)cc1 520759359 SDMXHJDJOOQXSU-UHFFFAOYSA-N 392.418 5.060 30 20 GKED C=C(C)COc1cc(CNCc2ccc(F)cc2C(F)(F)F)ccc1OC 520947952 HMNVEVWMDPLTBI-UHFFFAOYSA-N 383.385 5.098 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@@H](C)O1 522088414 XGTPFLFQIPNROZ-PBHICJAKSA-N 399.878 5.035 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cc1Oc1ccncc1 522480553 DDCYKFHJSYXRDP-QGZVFWFLSA-N 397.356 5.086 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccccc1C(F)(F)F 525591929 FYNHSIISUIXQCG-HNNXBMFYSA-N 390.405 5.004 30 20 GKED Cc1c(C(=O)Nc2cccc(C3CCOCC3)c2)sc2ccc(C#N)cc12 529936014 YNNVCUPMMORAAZ-UHFFFAOYSA-N 376.481 5.228 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cn(CC(C)C)nc1C(F)F)c1ccccc1 540111943 ZJDOUNSZMOVQOG-MRXNPFEDSA-N 376.451 5.306 30 20 GKED CC[C@@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1c(C)noc1C 541071981 DZGMLRMVJZVXHE-OYHNWAKOSA-N 387.483 5.201 30 20 GKED COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)Nc2cccc(C#N)c2)c1 541260934 AFGHTAZYPJWPPA-RPWUZVMVSA-N 397.478 5.330 30 20 GKED C=CCOc1ccc(CN[C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1Cl 543642428 PMTXFJUJRXZJQF-RXVVDRJESA-N 375.871 5.054 30 20 GKED CC(C)OCCCc1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1 545755706 JMILNPXUGJBENF-UHFFFAOYSA-N 379.485 5.117 30 20 GKED N#Cc1ccccc1OCc1cccc(-c2nc([C@@H]3CCCCS3)no2)c1 547222085 DWDUFQDWYTUCSV-IBGZPJMESA-N 377.469 5.145 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1 548809377 YHIMKWOZCHRURH-SFHVURJKSA-N 391.540 5.826 30 20 GKED CC(C)(CCC#N)CN[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl 558237078 GADHVQTYRIOHOE-OAQYLSRUSA-N 384.907 5.120 30 20 GKED C[C@H](Sc1cccc(F)c1C#N)C(=O)Nc1ccccc1-c1ccccc1 580516301 KIFOEGJNACPXCL-HNNXBMFYSA-N 376.456 5.484 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2cccc(Br)c2)nc1 588155001 WYWURKOZMUBRHW-UHFFFAOYSA-N 388.265 5.049 30 20 GKED CC(C)(C)n1cc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)nn1 588579806 XZJBBSSVSLFZFH-GHRIWEEISA-N 388.496 5.066 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N1CCC[C@H](CC#N)C1 596724496 YUTWQMFSBSJNPL-QGZVFWFLSA-N 397.906 5.385 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692842 OVLFKWBBOYCUDV-UHFFFAOYSA-N 398.875 5.124 30 20 GKED C[C@@H](c1ccccc1)n1cnnc1SCc1ccc(-c2ccccc2C#N)cc1 603917779 AAYBVVZHRXQXSS-SFHVURJKSA-N 396.519 5.718 30 20 GKED C[C@H](S[C@H]1CCCc2ccccc21)C(=O)N(CCC#N)c1ccc(F)cc1 608801743 MIKFFMRPKSCBTK-KKSFZXQISA-N 382.504 5.272 30 20 GKED CC(C)CCC[C@@H](C)n1c(SC[C@@H](C#N)CCC#N)nc2ccccc2c1=O 608864466 JGGIJFFVHADKOV-QZTJIDSGSA-N 396.560 5.319 30 20 GKED CC(C)Oc1ncc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 609427726 GSMYPJMLJQBAEV-ZDUSSCGKSA-N 389.908 5.169 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(OC(F)F)c(Cl)c2)c1 609496423 VRFZDZUGKFSFEN-UHFFFAOYSA-N 394.805 5.001 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609647652 XGBXKYAJWRNUPN-WMZHIEFXSA-N 396.490 5.563 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C1 609976285 DMDZMETUQROXJO-GHTZIAJQSA-N 397.478 5.072 30 20 GKED C[C@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610584077 ZMJWLGIBVKUALK-HTAPYJJXSA-N 398.466 5.155 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@H]1c1ccccc1Br 610677910 GKBRRNCNEJUGFB-AWEZNQCLSA-N 396.210 5.076 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccsc1 619787983 QQLHESISGLLFLD-CQSZACIVSA-N 395.459 5.221 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccnc(Oc2ccccc2)c1 681591929 XEZADENACVNYDS-UHFFFAOYSA-N 376.481 5.082 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(C)c(-c3ccc(F)cc3)s2)cc1 726940042 DQRAETUVXCYLHF-UHFFFAOYSA-N 378.472 5.732 30 20 GKED N#C[C@@H](C(=O)CCSc1ccc(Cl)cc1)c1nc2cc(F)ccc2s1 730416127 ASTXFWAEMGQPPE-AWEZNQCLSA-N 390.892 5.447 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(SC(F)F)c2)c1 731986417 OHRPWYLEPVBNGK-UHFFFAOYSA-N 376.428 5.061 30 20 GKED Cc1csc(-c2cccc(OC(=O)CCCCOc3cccc(C#N)c3)c2)n1 731987138 UFCUEZSKNAWTJP-UHFFFAOYSA-N 392.480 5.145 30 20 GKED CCCC[C@H]1CCCC1=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1 733079850 KZUUQPMQEGNVRW-ZDUSSCGKSA-N 377.414 5.316 30 20 GKED CCOc1ccc(N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 739621401 IXASUQWMEVRJFP-UHFFFAOYSA-N 386.451 5.220 30 20 GKED Clc1ccc(C(Cc2ccccn2)=NNc2nccc3sccc23)cc1 745197304 QAMRYEKNVSZTAW-UHFFFAOYSA-N 378.888 5.404 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1 747111407 JIKJVTYPXQGMDG-GUYCJALGSA-N 397.544 5.224 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)n1 747199116 PBTRNVVIIHNRGC-VUUYWXRKSA-N 398.837 5.828 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)/C=C(\C)c1ccc(C(F)(F)F)cc1 748179843 FCIFJAXHLYLEPP-FOWTUZBSSA-N 384.401 5.195 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 749616609 YGVSSWLEVZPHRF-DWTRPJMMSA-N 392.343 5.182 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccnc1 751543829 RRKIPLWEXDVYFY-BJKOFHAPSA-N 398.510 5.298 30 20 GKED COc1cccc(/C(C)=C/C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 751826177 DMUBTEXSGUCWMX-PRDNPTHXSA-N 388.492 5.407 30 20 GKED C=C[C@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1 764751018 XDSUSIADMJAEHF-SNVBAGLBSA-N 390.270 5.061 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccccc2CN(C)C2CCCCC2)cc1 770510840 KBFJVTIYTGGAPV-LJQANCHMSA-N 377.532 5.354 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc3c(s2)CCCC3)ccc1OC 772984294 CSNVTCIPALOEIV-QAPCUYQASA-N 384.545 5.167 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@H]1c1ccccc1 775489781 XVEHDEDLQZAHAC-DQMJNTIXSA-N 381.479 5.567 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 780519766 DMHWVVBVAKXSPC-LBPRGKRZSA-N 393.365 5.039 30 20 GKED C=C[C@@H](CC(=O)O[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784402878 OUTKNYKYVIUYQR-CABCVRRESA-N 382.847 5.354 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1csc(-c2ccc(Cl)cc2)c1 796750043 ZMKPVDNEVYPIMJ-QGZVFWFLSA-N 380.856 5.030 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C1(Cc2cccc(F)c2)CCCCC1 808714502 XQDGGMQKLPJOLP-KRWDZBQOSA-N 380.463 5.248 30 20 GKED C#C[C@@H](NC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccc(Cl)cc1 810185169 NHMWSYWKFDDDQV-GOSISDBHSA-N 397.906 5.129 30 20 GKED Cc1nc2sc3c(c2c(=O)n1N=Cc1csc2ccccc12)CCCCC3 812393985 MMYFNYYUHYJWRK-UHFFFAOYSA-N 393.537 5.132 30 20 GKED N#Cc1cscc1C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 839256920 SLXRKJIZWCJETR-NSHDSACASA-N 383.325 5.158 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](c1ccccc1)c1cc2ccccc2o1 915998559 AVWHJHNBPOBOBF-QFIPXVFZSA-N 383.476 5.380 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916681004 NJTBUCXYYJLPKJ-JTSKRJEESA-N 387.458 5.706 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3ccc(F)cc3s2)cc1 916914620 OXAIDCWDVPOFTB-GOSISDBHSA-N 394.471 5.344 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)Cc2coc3cc(C)ccc23)cc1 916955706 TUYDZTMMMBPJTM-IIBYNOLFSA-N 388.467 5.145 30 20 GKED COc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 920109995 ITWWVENSRAUPKO-KXBFYZLASA-N 376.481 5.107 30 20 GKED CC[C@H](C)c1nnc(N2CCC(CC#N)CC2)n1Cc1ccc(C)cc1SC 1291496225 GQXDBXKMNKKAKM-KRWDZBQOSA-N 397.592 5.000 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NNc1ccc(Cl)cc1Cl 1776029538 ACLLVRQNLUHNLA-UHFFFAOYSA-N 395.286 5.268 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cs1 1776280434 KMXOXKBFMYLFID-NTMALXAHSA-N 397.521 5.763 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)o2)cc1 1777472299 LQTDAGUPRAOTLL-PMJBJKLVSA-N 388.419 5.161 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)CCc2ccc(C#N)cc2)c2cccs2)cc1 10762571 MFWXOTLKILIOKZ-XMMPIXPASA-N 388.536 5.582 30 20 GKED C=CCN(C(=O)c1sc(-c2ccc(C)o2)nc1C)c1nc2c(s1)CCCC2 33155434 ZMKGOWQLGVCUEC-UHFFFAOYSA-N 399.541 5.188 30 20 GKED O/C(=N\c1nnc(-c2ccco2)s1)[C@H](Oc1ccccc1)c1ccccc1 49616410 DOSGKXBWKXGJDL-QGZVFWFLSA-N 377.425 5.206 30 20 GKED C[C@H](Sc1cc(C#N)ccn1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 71918312 CDNOLSCGVRJJSH-QMMMGPOBSA-N 386.691 5.033 30 20 GKED CCc1cccc(C)c1NC(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1 105396597 QXRZCZZWLXOSFA-UHFFFAOYSA-N 385.467 5.272 30 20 GKED Cc1noc(-c2ccccc2)c1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 123858789 YZSSZFCTHUOXKY-UHFFFAOYSA-N 394.434 5.518 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)c1c(C)noc1C 131836824 YZAKWKIFRDRBBD-AWEZNQCLSA-N 375.428 5.006 30 20 GKED C[C@@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccsc1 152400286 DYEXTHCMHJQQRN-MRXNPFEDSA-N 376.481 5.135 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 163108754 MXTNKDFDFUEQNZ-ICSRJNTNSA-N 398.528 5.123 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 176543249 DFTLOZVBECENIJ-SFHVURJKSA-N 395.443 5.341 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 177776635 RYZXBPUTDVARII-ZDUSSCGKSA-N 385.876 5.373 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)Nc1cccc(C#N)c1C 181759330 LDUZJAGLSLCURR-UHFFFAOYSA-N 385.345 5.101 30 20 GKED COc1cc(CNc2ccc(Cl)c(C#N)c2)ccc1OCc1c(C)noc1C 191156980 JZGDWGRUFHWTPK-UHFFFAOYSA-N 397.862 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1 191453495 NMWDEOYESSFFIX-URXFXBBRSA-N 392.543 5.828 30 20 GKED OC1=NC2(CCC2)[C@@H](/N=C(/O)N(Cc2ccccc2Cl)C2CCCC2)CC1 328694043 JVHUCFOQBRTUCV-SFHVURJKSA-N 389.927 5.040 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2/C(O)=N/CC2(c3ccncc3)CCCC2)cc1 329449243 LGMDOAMWNHSVSP-VXKWHMMOSA-N 378.516 5.326 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1ccc(OCc2c(C)noc2C)cc1 410355482 UHNXYWWJTFTEBE-UHFFFAOYSA-N 390.483 5.170 30 20 GKED N#CC1(CC[S@](=O)Cc2coc(-c3cccc(Cl)c3)n2)CCCCC1 417148461 CAASWLNEKXGVPP-VWLOTQADSA-N 376.909 5.108 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@@H](c2ccccc2F)C1)c1ccccc1 431303628 ZVNRAHMBSYXJAL-KNKQGSTJSA-N 379.479 5.196 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1OCC(F)(F)F)c1ccccc1 432695203 ZFAMCHVHHJTEEP-MRXNPFEDSA-N 391.393 5.184 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 437474188 NSQNMJJMEZPCJU-UHFFFAOYSA-N 381.432 5.069 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 441253666 BCMRPRNANISLGH-GFCCVEGCSA-N 387.270 5.108 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H](C)c1cccc(C#N)c1 442895485 FCOKMLGDBINPQL-AWEZNQCLSA-N 398.919 5.255 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 443850657 BAKLODFFTORWDZ-LBPRGKRZSA-N 383.498 5.093 30 20 GKED C=CCC(CC=C)c1nc(CC(=O)Nc2ccccc2Oc2ccccc2)no1 445323768 PWKDYXJTLYOIAG-UHFFFAOYSA-N 389.455 5.279 30 20 GKED COc1ccc(C(=O)CC(C)(C)CC(=O)Nc2ccc(CC#N)cc2Cl)cc1 452641708 DZYAIXAHZXHCQJ-UHFFFAOYSA-N 398.890 5.042 30 20 GKED Cc1cc(F)ccc1[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458857424 ZMZHTCKCRHZCJC-FCHUYYIVSA-N 379.479 5.416 30 20 GKED C=CCN(C(=O)c1cncc(-c2ccccc2)c1)c1nc(-c2ccccc2)cs1 466392599 NUNJIPCZXGSYRE-UHFFFAOYSA-N 397.503 5.705 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)ccc(C(F)(F)F)c1F 468015425 DTCMXGWDCDIZPK-UHFFFAOYSA-N 382.382 5.411 30 20 GKED Cc1c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)sc2ccc(F)cc12 468539634 DRCVRZFPKMCYQC-UHFFFAOYSA-N 387.320 5.306 30 20 GKED CCOc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2ccccc2)cc1 470436692 DEJMCNNLKGUJKG-INIZCTEOSA-N 378.501 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C 475558086 HIAPNOZZAWZILR-INIZCTEOSA-N 382.552 5.681 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C2CCC2)cc1Cl 480118665 CCUJLANCDDQNNB-IFMALSPDSA-N 393.918 5.792 30 20 GKED CC(C)OCCOCc1cccc(N[C@H]2CCCCc3cc(C#N)ccc32)c1 481997566 INRBYRWNFNAMNM-DEOSSOPVSA-N 378.516 5.379 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CSc1ccc(C#N)cc1 482406889 ITAZNTLPODBJJL-LBPRGKRZSA-N 379.312 5.177 30 20 GKED C=CC[C@H](C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 489694285 HKQVVTNOZAYYFL-FXAWDEMLSA-N 379.891 5.240 30 20 GKED CSc1ccc(N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 496261153 DLHIKOPZXMJUQC-UHFFFAOYSA-N 388.492 5.543 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1sc(-c2cccs2)nc1C 498449440 MCYLGDHHTSZABW-UHFFFAOYSA-N 381.526 5.104 30 20 GKED Cc1ccc(-c2ccc(C(=O)N(CCC#N)Cc3ccccn3)c(F)c2)cc1C 500723237 UYVLFEWQTXBGNE-UHFFFAOYSA-N 387.458 5.061 30 20 GKED N#CCCN(CC1CC1)C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 505187042 DLDTWTSZVFWHMC-UHFFFAOYSA-N 389.474 5.059 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)[C@H]3CC[C@@H](C(F)(F)F)C3)c2)c1 506443676 HBWOWNCOWMAGFS-DLBZAZTESA-N 388.389 5.054 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1 512522140 OTRAVUCKTPFQQK-QGZVFWFLSA-N 397.498 5.101 30 20 GKED C[C@H](CC(=O)Nc1sc2c(c1C#N)CCC2)c1ccc(C(F)(F)F)cc1 512961997 NJGSRFOIYSWQSP-LLVKDONJSA-N 378.419 5.260 30 20 GKED CC[C@@H]1C[C@H](CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 513654612 WWSJWPKNSKWBCQ-OZOXKJRCSA-N 396.918 5.529 30 20 GKED N#Cc1ccc(CCC(=O)N(c2ccccc2)c2nc3ccccc3s2)cc1 514868221 AZSMAGGIZZQOGM-UHFFFAOYSA-N 383.476 5.465 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1csc2ccccc12 520195984 TVLNLUYVKMOMHS-HNNXBMFYSA-N 395.553 5.660 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC[C@@H]2CCCCO2)cc1Cl 521107078 YEXMOLUWXRPWHV-ICSRJNTNSA-N 382.891 5.283 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2ccccc2)n1)c1ccc(Cl)c(Cl)c1 521352640 CZRBLRUQEWWKAV-OAHLLOKOSA-N 388.279 5.112 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2ccccc2C#N)c1)c1ccccc1 523395807 GXJIUJJMPZHZSK-UHFFFAOYSA-N 375.859 5.100 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)c1 523948879 BAOWUXIMFATTFA-HXUWFJFHSA-N 391.858 5.309 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@H]3C[C@H]3c3c(F)cccc3Cl)n2)cc1 524824333 JPRZVZCQQXYAPN-KGLIPLIRSA-N 397.862 5.216 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ccccc2F)CC1 530394505 MLLIOAGMHZBIBR-UHFFFAOYSA-N 380.507 6.089 30 20 GKED C=CCC[C@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1 537157328 AAJQDAQIAIALPM-FQEVSTJZSA-N 377.444 5.089 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 537517664 RBCSZQCYMJVRMQ-DENIHFKCSA-N 393.487 5.066 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)Cc2cnc3ccc(C#N)cn23)cc1 539836024 UERMRTBASNKMCI-SFHVURJKSA-N 396.494 5.075 30 20 GKED N#CCCCNC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 541297363 JIFOZKDHOQEBKE-QGZVFWFLSA-N 379.312 5.247 30 20 GKED C=CCC[C@@H](NC(=O)C(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 542627969 UFXHGOPEADEXPL-OAHLLOKOSA-N 392.833 5.040 30 20 GKED C[C@@H](NCc1ncc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543870346 TZFGUAWGIQSHJA-GOSISDBHSA-N 379.463 5.731 30 20 GKED CC(C)OCCCc1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 546465134 TVOIENZHQREGDJ-UHFFFAOYSA-N 397.862 5.412 30 20 GKED O=C(Nc1c(F)cccc1F)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 553267857 NHICNPPABBYTFA-ZDUSSCGKSA-N 398.253 5.409 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc(-c2ccccc2)cs1 564509713 GWKIUOQXAXJYBM-GFCCVEGCSA-N 383.885 5.496 30 20 GKED CN(C)Cc1ccc(-c2ccccc2CN[C@@H]2CCc3ccc(C#N)cc32)cc1 565568869 OTKRUPIRSUUWPG-AREMUKBSSA-N 381.523 5.064 30 20 GKED CC(C)(C)OCc1cccc(CNCc2ccc(C#N)cc2C(F)(F)F)c1 577249749 DTQUAJWOQNOLRO-UHFFFAOYSA-N 376.422 5.182 30 20 GKED C[C@@H](NC[C@@H](C#N)CCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 578313870 PTTIAJYGDAYECS-ZIAGYGMSSA-N 377.435 5.528 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCC23CCC3)cc1Cl 580513108 XLZQLDIAYWEUPI-IBGZPJMESA-N 379.891 5.546 30 20 GKED CCn1c(SCc2cn3ccccc3c2C#N)nnc1-c1cccc(Cl)c1 589957919 VCKZLNNZQHDEHM-UHFFFAOYSA-N 393.903 5.035 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H]1OCc2cc(Cl)ccc21 593976757 XZWSFEKXESHHLE-UGSOOPFHSA-N 386.904 5.334 30 20 GKED Cc1cc(C#N)cc(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1 596928423 VASMAJCMUYSLDZ-UHFFFAOYSA-N 381.320 5.042 30 20 GKED C=CCN(C(=O)CSCc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 603458722 IKRQOIXEWGKNNE-UHFFFAOYSA-N 398.528 5.402 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1cccc(F)c1C#N 603867397 PPMSKHCEMNFLTE-UHFFFAOYSA-N 377.419 5.286 30 20 GKED CCCN(C(=O)c1cc(C2CC2)n(C(C)(C)C)n1)c1cc(Cl)ccc1C#N 609286603 XYCPROHNYMRXIO-UHFFFAOYSA-N 384.911 5.097 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1SCCC#N 609375903 JRAJJBJGZOAVJZ-MRXNPFEDSA-N 382.529 5.396 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)c1nc(-c2ccccc2OCc2ccccc2)no1 609475644 QLNSRIODLMGHAX-QGZVFWFLSA-N 397.434 5.327 30 20 GKED COc1ccc(Sc2ccc(NC(=O)c3ccc(C#N)nc3)cc2Cl)cc1 609643247 JQJCMLXEHAAPTC-UHFFFAOYSA-N 395.871 5.019 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609657757 XEPNGJUODHIPAA-UHFFFAOYSA-N 386.451 5.780 30 20 GKED COc1cc(C)ccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609723686 SVGBGZXOPIFJHR-UHFFFAOYSA-N 392.842 5.573 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2nc3ccsc3s2)c1 609795052 JLUWLQZGNNZWQK-UHFFFAOYSA-N 391.477 5.061 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1Cl 609807524 YFDRYIIAYLWMHU-GFCCVEGCSA-N 376.287 5.677 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)CCC1 609856521 DWFQEBFOAPJWCB-UHFFFAOYSA-N 378.325 5.269 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccccc3OCC3CC3)c2)c1 610089526 ZMBBWWMNBXSANL-UHFFFAOYSA-N 398.506 5.216 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1c(C)noc1C(F)F 610431493 VMPXVFCNBBBNGS-UHFFFAOYSA-N 399.372 5.087 30 20 GKED C[C@@H](NC(=O)CCSc1ccnc2cc(Cl)ccc12)c1cccc(C#N)c1 610577578 VNBGUJDSYVVPOH-CQSZACIVSA-N 395.915 5.119 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1CCc2cc(F)ccc21 619129137 OLFLMLFTAPUKQF-CQSZACIVSA-N 385.323 5.025 30 20 GKED Cn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccccc1Cl 619864105 PXCOEBFOCOHMDC-HNNXBMFYSA-N 375.284 5.146 30 20 GKED CCn1cc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cn1 647323149 LVYMQBSWTHMNNR-SNVBAGLBSA-N 383.311 5.366 30 20 GKED COc1ccc([C@H](C)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 675737981 LCZMKUSGQCOCLQ-MVWJERBFSA-N 387.339 5.394 30 20 GKED COc1ccc(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 676416066 WUJATXXTDTZYEF-UHFFFAOYSA-N 381.291 5.162 30 20 GKED C#Cc1cccc(NC(=S)NC(c2ccc(F)cc2)c2ccc(F)cc2)c1 726474323 CHBARSCNOTYSJC-UHFFFAOYSA-N 378.447 5.022 30 20 GKED Cc1cc(C(=O)N2CCC[C@H]2c2cccs2)c(C)n1-c1ccc(C#N)cc1 728264260 AHRQTPUCXKFREV-FQEVSTJZSA-N 375.497 5.005 30 20 GKED C=CCc1cc(/C=C(/Cl)c2nc3c(F)cccc3n2CC)cc(OC)c1O 728438652 JVGDVQMOMPAKQK-RVDMUPIBSA-N 386.854 5.375 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)OCc1c(F)c(F)c(F)c(F)c1F 728653714 KSPIQJUBZHCDBO-JTQLQIEISA-N 398.249 5.162 30 20 GKED C=CCc1cc(CNCc2cc(Cl)cc(Cl)c2OC)cc(OC)c1OC 729683415 OFLXQWTYZZEQKE-UHFFFAOYSA-N 396.314 5.038 30 20 GKED C[C@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730380363 UMPLNCNTVWCYKC-UUOWRZLLSA-N 381.479 5.493 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)NCCSc1ccccc1 731322426 ZLYKRICQRCRWOB-OAHLLOKOSA-N 387.599 5.160 30 20 GKED C#CC[C@H](OC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccccn1 733692781 LHPRIDDLJIPYCR-INIZCTEOSA-N 390.489 5.341 30 20 GKED C[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 734116988 ORMUUWDUNRFZAD-OAHLLOKOSA-N 399.475 5.451 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1nc2ccccc2s1 734209696 FEQJWWVOIRFSBG-KBPBESRZSA-N 396.541 5.431 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(N(CC)Cc2ccccc2)cc1)c1ccncc1 734455202 BBHJPZWBNINWKX-XMMPIXPASA-N 385.511 5.155 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC[C@@H](c2cc3ccccc3[nH]2)C1 735308673 ODKOGSCAOUBONF-QGZVFWFLSA-N 379.891 5.103 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 739141803 CTOCCRVJZQFAKB-IUODEOHRSA-N 388.414 5.370 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1ccc(SCC(F)F)cc1 741761011 HPICRHBHZQTHBD-UHFFFAOYSA-N 375.366 5.294 30 20 GKED COc1ccc(CN[C@H](C)c2ccccc2-c2ccc(Cl)cc2)cc1C#N 742372002 MAPPBGLBJHVVMK-MRXNPFEDSA-N 376.887 5.738 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](CC2CC2)c2ccccc2)cc1 743097995 ZCXVPWVYUPIDHC-LOSJGSFVSA-N 395.506 6.005 30 20 GKED C[C@H](Nc1ccc(OC2CCCCC2)cc1)C(=O)N(CCC#N)c1ccccc1 743477981 WOIBSPYMMKUAPJ-IBGZPJMESA-N 391.515 5.145 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)O1 744037206 PONCUSJPDRZPQU-VQBMHJACSA-N 398.572 5.135 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)[C@H](C)c1ccccc1 746371797 GSAHVYSFXMWIIP-ZDUSSCGKSA-N 385.393 5.149 30 20 GKED CC/C(=C\C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)cc1 746892088 PHATZHUEGQDBQG-IBOXJLQUSA-N 380.513 5.522 30 20 GKED N#C[C@@H](C(=O)C(C1CC1)C1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 753539240 JQZVCFYAUGRKFO-AWEZNQCLSA-N 391.323 5.729 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2nc(-c3ccccc3)cs2)ccc1OC 756964693 DGRFLNARPDKNMB-KRWDZBQOSA-N 379.485 5.112 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3cnc(C4CCC4)s3)cc2c1C 760263110 NFPAUHYHQYIHEY-SREVYHEPSA-N 398.509 5.011 30 20 GKED CC(C)N(C(=O)Cc1cccc(OCC#N)c1)c1ccc(Nc2ccccc2)cc1 760402217 AARUNTVETOYKRZ-UHFFFAOYSA-N 399.494 5.317 30 20 GKED N#Cc1cccc([C@@H]2CN(C(=O)Nc3ccc4oc5ccccc5c4c3)CCO2)c1 761813077 RFBRXDFQVWYMAY-QHCPKHFHSA-N 397.434 5.063 30 20 GKED Cc1nc([C@@H](C)OC(=O)Cc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 763957333 YQZDDLVQNKAKRW-CQSZACIVSA-N 380.831 5.022 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(NC(=O)CCC)cc2)cc1 764977756 ZOLNLAHUUCCSAQ-QGZVFWFLSA-N 386.923 5.407 30 20 GKED CC(C)Oc1ccc(Br)cc1NCc1ccc(O[C@H](C)C#N)cc1 771198253 RMFWHRMTYPCYBK-CQSZACIVSA-N 389.293 5.139 30 20 GKED CC[C@@H](NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 774234950 YQAJXKBWXAYOSY-HTAPYJJXSA-N 393.531 5.385 30 20 GKED CC[C@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(C#N)cc1 774331119 PGOUNUMNOKYJIO-NRFANRHFSA-N 377.875 5.749 30 20 GKED CC(C)(C)OC(=O)N[C@@H]1C[C@@H](N[C@@H](CCC#N)c2ccccc2)c2ccccc21 780730491 SXJCKBCSPCVQSX-BHDDXSALSA-N 391.515 5.332 30 20 GKED CCOc1cc(/C=C\C(=O)c2cnn(C(C)C)c2C)ccc1OCC(F)(F)F 787185990 DWEGXAOWFOBVLZ-VURMDHGXSA-N 396.409 5.008 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cn1 792883743 MRRJBWZZXQIMGS-IZZDOVSWSA-N 398.434 5.363 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)cc1 792925000 QVSVZDJKRNNZJT-ACCUITESSA-N 379.843 5.198 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2F)cc1 792925518 SGLYIBDDIPMNFL-QXMHVHEDSA-N 379.456 5.152 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCOCC1 796635904 VHSDZMMBXNUGDK-MRXNPFEDSA-N 388.920 5.093 30 20 GKED N#CC[C@H](CC(=O)O[C@@H](c1ccc(Cl)cc1)c1cccnc1)c1ccccc1 796691189 KBGRYHFEIYQIOQ-XXBNENTESA-N 390.870 5.455 30 20 GKED C#Cc1cccc(NC(=O)N2CCC[C@H]2c2ccc(Br)c(C)c2)c1 797610925 HIFDDBYRGLOSJJ-IBGZPJMESA-N 383.289 5.108 30 20 GKED CC(C)(CC(=O)c1ccccc1)CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 799629698 CTLJEPOASWAVAC-INIZCTEOSA-N 382.529 5.306 30 20 GKED COCCn1nc(C)c(C(=O)/C=C/C(C)=C\c2cccc(C(F)(F)F)c2)c1C 806573550 MLXLNJYQNWAUNA-BYKJOZEVSA-N 392.421 5.008 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@H](CCCC#N)c1ccccc1 814210549 QUSRSXZTLGLKLG-JOCHJYFZSA-N 393.600 6.655 30 20 GKED CC1(C)C[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c2ccccc2O1 842291763 NUMKVGCZLVJGHD-QZTJIDSGSA-N 388.492 5.331 30 20 GKED C=CCN(Cc1ccccc1)Cn1nc(-c2ccc(C)cc2)c2ccccc2c1=O 915203396 PDYRIGPTCBLLIC-UHFFFAOYSA-N 395.506 5.018 30 20 GKED Cc1cc(C)c(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)c(C)c1 916283532 GGVFONGILRODEZ-UHFFFAOYSA-N 387.508 5.241 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Oc2ccccc2OC)cc1 1776784746 QVNWLCKPMDVRAY-FQEVSTJZSA-N 399.531 5.781 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3c(Br)cccc3C2=O)c(Cl)c1 1777673528 VFSIZPAVJMBQQE-DHZHZOJOSA-N 391.648 5.013 30 20 GKED N#C[C@@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1nc2ccccc2o1 41546679 NEDRIYFMRKGFHV-IBGZPJMESA-N 384.460 5.610 30 20 GKED Cc1csc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 45357771 XWXKGSYXWXELGJ-KRWDZBQOSA-N 396.903 5.082 30 20 GKED COc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66954009 YYFPQXKECCABIB-OXJNMPFZSA-N 395.528 5.458 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 67800481 UGFQZQHWPXSJKG-IBGZPJMESA-N 385.492 5.226 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 111781326 JDHHECNBAZGOST-UHFFFAOYSA-N 385.533 5.261 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccccc2F)CCC1 128251255 KGTMSHUBTBAAQP-UHFFFAOYSA-N 380.444 5.040 30 20 GKED C[C@@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(OCC#N)cc1 171768602 IFUDITGJBXBNCO-GOSISDBHSA-N 390.458 5.158 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)Sc1ccccc1 173122365 JUMYOBIQFGBJHT-CVEARBPZSA-N 385.558 5.383 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1cc2ccccc2o1 182627563 ZRVCBTRYQHLNCM-HZPDHXFCSA-N 393.512 5.116 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2-c2nc(C(C)(C)C)no2)n1 183380367 ULXNRWUVJCHIPN-OAHLLOKOSA-N 394.500 5.104 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(Sc2nnc(C)s2)cc1C)c1ccccc1 187392824 LLENNAAJUAMIDP-SFHVURJKSA-N 395.553 5.605 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 246596752 PZFNUJCOAWLCKC-ARFHVFGLSA-N 380.419 5.068 30 20 GKED C=CCOc1cccc(/C=C(/Cl)c2nnc(C(=O)Nc3ccccc3)s2)c1 255836529 HATVCBVNXDUJLY-GHRIWEEISA-N 397.887 5.092 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](c4ccccc4)C3)cc2)c1 303299683 CNZIEKFFLZGUOS-FQEVSTJZSA-N 383.451 5.372 30 20 GKED CC(C)C[C@H](C)N(C(=O)Cc1ccc(OCC#N)cc1)c1ccc2[nH]ccc2c1 303470214 NAWGQOJTEUFFII-SFHVURJKSA-N 389.499 5.081 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC(C#N)(c2ccccn2)CC1 369207710 QNRNYGQHNBYXQW-MRXNPFEDSA-N 392.890 5.008 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cccc(SCC#N)c3)c2C#N)[C@H](C)C1 410977175 KOTDEVKWRXAITG-CHWSQXEVSA-N 381.526 5.174 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 425380560 DFIZJXSOGBBKOG-KBPBESRZSA-N 375.394 5.041 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2c(-c3ccc(Cl)cc3Cl)noc2C)n1 435779333 WOIANBGJIXKFJK-GFCCVEGCSA-N 392.267 5.212 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](c1cccnc1)C(C)C 439105066 BTGVWBKBQBSGJN-QHCPKHFHSA-N 385.467 5.432 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1[C@@H](C)C[C@H](CC(F)(F)F)[C@H]1C 454748026 APBKPIPAAGLVGO-BYNSBNAKSA-N 399.482 5.664 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)C2(c3ccc(C#N)cc3)CC2)cc1 473884519 IIEOYCPORKHCNN-SFHVURJKSA-N 396.490 5.143 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CCO)c1ccc(Cl)cc1 482156130 CUEZFVRVJCNSMT-HXUWFJFHSA-N 386.923 5.437 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(Cc3cncs3)no2)c1 482712095 JTFOYVZFZHEOOE-UHFFFAOYSA-N 394.843 5.101 30 20 GKED N#C[C@@H](C(=O)c1cc2[nH]ccc2s1)c1nc(-c2ccc(Cl)cc2)cs1 483460799 LPTNXJKYGZHKIS-LBPRGKRZSA-N 383.885 5.496 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)CSc1nc(C)c(C)c(C)c1C#N 484846996 KSAGWMDJXKFZED-UHFFFAOYSA-N 381.545 5.043 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Sc2nccn2C)cc1 485756190 PQPBVOPRDDQITL-UHFFFAOYSA-N 381.526 5.102 30 20 GKED N#CCCC[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccccc1 487511350 DEEOAVQZUZYVGR-JOCHJYFZSA-N 384.483 5.110 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 488350146 FUOUXPKIHSPDHL-KRWDZBQOSA-N 383.398 5.363 30 20 GKED N#Cc1cc(F)ccc1CSCC(=O)Nc1ccccc1Oc1ccccc1 488530640 RAMOOGXEPYSPRW-UHFFFAOYSA-N 392.455 5.362 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Cc1cncc2ccccc12 497577737 HTSWSIKRCAFXAA-SJORKVTESA-N 389.524 5.446 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl)c1c(Cl)cccc1Cl 499816664 VARUCBFGTXHJGT-OZVIIMIRSA-N 379.674 5.131 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)cc1 502400408 RIKUHISDKGUSDY-KRWDZBQOSA-N 388.298 5.604 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(C)[C@@H](c2ccccc2Cl)C(C)C)cc1 502619770 VZPYCXYWSRKQFH-HXUWFJFHSA-N 399.922 5.117 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccc(F)cc1C 502660792 GXJCMFGNIZUJBH-UHFFFAOYSA-N 395.247 5.256 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3/C=C\c3ccccc3)cc2)nc1 505359512 KVNUYRNFDLYHOO-OJTSNAHWSA-N 395.462 5.064 30 20 GKED Cc1ccc(CN(CCc2ccccc2)C(=O)NCC(C)(C)CCC#N)s1 513108385 NLHXABHQAHPPTL-UHFFFAOYSA-N 383.561 5.141 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1nc(-c2ccccc2)cs1 513656760 XFVBPWAWXWHZLO-QGZVFWFLSA-N 388.540 5.001 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(COc3ccccc3C#N)o2)c1 515980624 TUPGZLVYMMEUQZ-OAQYLSRUSA-N 386.451 5.016 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3nc4ccccc4o3)cc2)c1 517514033 SJDGJSQXBWAODJ-UHFFFAOYSA-N 383.407 5.063 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)c2)cc1 517841303 KEFJVZBQZAXJDQ-MOPGFXCFSA-N 388.389 5.658 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc2cc(Cl)ccc2s1 518220435 IHIKSIWTXRGIBM-QGZVFWFLSA-N 396.899 5.761 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(N3CCCCCC3)c2)c1 525383676 UFNZMOVBBVZJMY-UHFFFAOYSA-N 391.515 5.126 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)c(F)c1 538509220 HJCMBOBLWVMUKL-WAIKUNEKSA-N 384.458 5.024 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1nc(-c2ccc[nH]2)cs1 540888263 AXAKYJMLHHUMFC-UHFFFAOYSA-N 386.436 5.054 30 20 GKED C[C@H](N[C@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543033648 JZHGXAIYYPANJR-QLPUUCHCSA-N 388.536 5.374 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)C2CC2)cc1 543299177 FVZSWXLYYWUNAB-LJQANCHMSA-N 397.931 5.123 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 543513300 SUGMFLJOUGRXDS-HOYKHHGWSA-N 397.478 5.163 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)ccn1 551507717 VXHKYZMAJKBMSI-CQSZACIVSA-N 388.279 5.310 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)[C@H]1CC[C@@H](C(F)(F)F)C1 552250586 QHZONJOPPQMWHO-VHSXEESVSA-N 387.295 5.074 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(O[C@H](C)CC)c1 554159772 MBFYVMLJRAEWKL-GOSISDBHSA-N 384.524 5.252 30 20 GKED Cc1ccc([C@H]2OCCC[C@H]2NC(=O)c2sc3ccc(C#N)cc3c2C)cc1 560135013 KCZHQTCGFPJDPP-TZIWHRDSSA-N 390.508 5.040 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1C1CC1 560295022 OUYNGWWIPBQAQL-SCWSEQNSSA-N 391.519 5.035 30 20 GKED N#CCCn1cc(CN2CC3(CCC3)[C@@H]2c2ccccc2)c(-c2ccccc2)n1 560569751 JTZSXZZNEDGLDC-DEOSSOPVSA-N 382.511 5.191 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 569397523 OWCMUEJMUNMRJG-INIZCTEOSA-N 378.476 5.036 30 20 GKED COc1ccc([C@@H](CCC#N)NC[C@H](c2ccccc2Cl)N2CCCC2)cc1 575207151 NPDLNBADVUMNLT-DHIUTWEWSA-N 397.950 5.120 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(OC(F)(F)F)cc1 576273172 IMTJDPBDMLCLBC-NSHDSACASA-N 388.311 5.326 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCC2(CCCCC2)O1 577562379 LWNIAWYLEMTLFV-IAGOWNOFSA-N 387.549 5.084 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2)cc1 577689713 KIWNIFJWUGUQFT-GOSISDBHSA-N 375.497 5.301 30 20 GKED N#CC[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)C1 596297601 RTRIUOMLQVBMNS-YADARESESA-N 383.495 5.264 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N2CCc3sccc3[C@@H]2c2ccc(Cl)cc2)C1 596613527 YRMFKOJVDASRRC-VHFSOBRXSA-N 399.947 5.141 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1ccccc1-c1ccccc1C#N 603773731 HVJGFRAPXSUHLI-GOSISDBHSA-N 384.479 5.503 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 604461407 VLBMRLOBKZVDIR-XMMPIXPASA-N 397.478 6.028 30 20 GKED N#Cc1cccc(COc2cccc(CNCCc3ccc4ccccc4n3)c2)c1 604484899 RTVJFRRGKCJRIR-UHFFFAOYSA-N 393.490 5.018 30 20 GKED N#CCn1c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc2ccccc21 609216673 QHHISDAIWBOONX-UHFFFAOYSA-N 388.496 5.009 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 609398833 VXZHZDCEKWZUAY-AEFFLSMTSA-N 381.545 5.780 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCc2ccccc2C1 609773129 YFPJEECRFKCCFV-SJORKVTESA-N 379.529 5.007 30 20 GKED C[C@@H](CC#N)N(C)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196736 BDSZVTVKANOCKS-ZDUSSCGKSA-N 393.339 5.660 30 20 GKED C[C@]1(C#N)CCCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)C1 612242616 QULMRPRRKHNKPF-XMMPIXPASA-N 389.474 5.059 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)s1 612593519 NIUQRVUIJYSLEW-CQSZACIVSA-N 389.240 5.166 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C(F)(F)F)c3)n2)cc1 612894718 KJCQVPGKAFGRBT-MRXNPFEDSA-N 386.398 5.627 30 20 GKED C=CCCC(C)(C)NC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 620856966 HTNDGMRLBZFPGI-UHFFFAOYSA-N 396.318 5.227 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 730171650 XSFHOKDGAXGMHP-KMDXXIMOSA-N 382.463 5.093 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(SC)c(F)c3)cs2)c1 741847507 ONPXEUSGECWDQR-FPLPWBNLSA-N 385.485 5.576 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 743446920 GHXIONWKQHVSQR-LVMGUKCRSA-N 396.874 5.882 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(Cl)c1 744061334 KDZFAEZNVVDVQL-ACJLOTCBSA-N 391.883 5.315 30 20 GKED CC(C)CN(C(=S)Nc1ccccc1-c1ccccc1)c1ccc(C#N)cc1 751008543 YXURUFSLJLCSHW-UHFFFAOYSA-N 385.536 6.085 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Oc1cccc(Oc2ncccn2)c1 751194091 MDPQGHOUWWBSKU-UHFFFAOYSA-N 393.402 5.027 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)OCC3CCC(C#N)CC3)c2c1 755976794 ZZHSQTNYEWLGPD-UHFFFAOYSA-N 385.467 5.092 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NCc1nnc(-c2cccc(C#N)c2)o1 760455699 NKXRWWKORSHAHP-UHFFFAOYSA-N 378.501 5.419 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C/C=C\c2ccc(C(C)C)cc2)c1 764235018 AZQFXYLZIXDDIR-ICTHTSFCSA-N 376.500 5.211 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1cc(Cl)c(Cl)cc1O 766033297 DRSHDLMZAGNZJU-OWOJBTEDSA-N 377.252 5.114 30 20 GKED COc1ccc(/C=C2\CCOc3cc(Cl)ccc3C2=O)cc1OCCCC#N 774560859 WYWXDFYWHZHIHM-FOWTUZBSSA-N 397.858 5.080 30 20 GKED C=CC[C@@H](N[C@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccncc1 775392621 HVBUGAZZMABDQA-AUSIDOKSSA-N 379.548 5.044 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3cccc(F)c3)s2)C(=O)c2ccccc2C1 778519601 JFFAQJJFXLDZRR-LDADJPATSA-N 391.467 5.183 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)nc1 783299431 CCOLTSWLHLSPPF-FQEVSTJZSA-N 399.828 5.087 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)NCCc2ccc(F)cc2)cc1 789188572 YPDFINUYSUNSIM-JOCHJYFZSA-N 389.499 5.010 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Oc3cccc(-c4nccs4)c3)cc2)nc1 790874198 BFVAEXCEQDWHDP-UHFFFAOYSA-N 399.431 5.088 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nccc3ccccc23)c(Br)c1 792096691 PYFXKTVMAFGUGC-GOSISDBHSA-N 393.284 5.115 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)NCCCCC(F)(F)F 794976817 KFLRKTIINQTWJQ-UHFFFAOYSA-N 391.462 5.172 30 20 GKED C[C@@H](OC(=O)Cc1ccc(F)cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 795895172 VEANIAXQFIGEJF-SECBINFHSA-N 395.274 5.105 30 20 GKED CCCCc1nc(-c2ccc(OC(=O)C[C@@H](CC#N)c3ccccc3)cc2)no1 796661966 NBCBRLSUOYPOQR-LJQANCHMSA-N 389.455 5.072 30 20 GKED C#CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1COC(C)(C)CC 806418794 NLLHWCFLYIYRJI-NRFANRHFSA-N 378.516 5.148 30 20 GKED N#Cc1cccc(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)n1 810533962 BAZKNJGAEQJLIL-UHFFFAOYSA-N 391.839 5.103 30 20 GKED CCOC(=O)[C@H]1C/C(=C/C(C)=C/c2ccccc2COC)C(=O)c2ccccc21 814191646 RWMFZWZXXHTAEW-ILHPHJIQSA-N 390.479 5.096 30 20 GKED COc1ccc2c(c1)CCCN2C(=O)Nc1ccccc1S[C@H](C)CC#N 838923958 ZZGVFWARPQTGPJ-OAHLLOKOSA-N 381.501 5.074 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915085740 FDNUTAIRSXPLTL-FQEVSTJZSA-N 392.911 5.970 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2ccccc2Cl)cc1 915088437 RNRHYWZUEJJHRM-LJQANCHMSA-N 392.911 5.726 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 915354084 UZAUSUDHSMRNLD-QHCPKHFHSA-N 383.495 5.441 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(COc3ccccc3)c2)cc1OC 918379293 MQTAKWLVEWULDV-UHFFFAOYSA-N 389.451 5.091 30 20 GKED CC[C@@H](NN=C1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21)C(=O)O 1776067574 DXSAKOWDOFHGKQ-SCLBCKFNSA-N 391.298 5.076 30 20 GKED C=CCN(CCC(=O)O)Cc1ccc(-c2nc3cccc(Cl)c3s2)cc1 1776178058 YUYQGHLEOAJAKI-UHFFFAOYSA-N 386.904 5.079 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1cccc(Cl)c1Cl 1776180583 SWKMVKLRMYNPOX-QGZVFWFLSA-N 384.690 5.461 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)s1 1776339820 CPQBAYYRORGQKE-YWEYNIOJSA-N 396.464 5.507 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)C2(C)CCCCC2)cc1 1776788217 RKMIXHOIKFBTPG-OAQYLSRUSA-N 375.553 5.549 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(N2CCCCC2)cc1 63277017 CWBYIEKCYDAOHT-RMKNXTFCSA-N 380.538 5.758 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2o1)c1nc(-c2c(F)cccc2F)cs1 64714413 JMLFIDVRKHXHDA-LBPRGKRZSA-N 380.375 5.325 30 20 GKED C=CCN(C(=O)CCCOc1ccccc1Cl)c1nc2c(s1)CCCC2 64894418 ZXHQJXJNXWGPFQ-UHFFFAOYSA-N 390.936 5.054 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66801579 GLBBDHPMBWQKJY-CQSZACIVSA-N 377.469 5.297 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 102800039 PIXXZKBRQANGRX-UHFFFAOYSA-N 382.357 5.073 30 20 GKED N#CC1CCN(C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)CC1 104979972 CZDHYHVZWQIMMG-UHFFFAOYSA-N 390.270 5.553 30 20 GKED CCN(CC)Cc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 106067179 FCRGWCDWKGVPKM-UHFFFAOYSA-N 383.495 5.319 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccccc1Cl)c1ccccc1)c1ccccn1 106353719 SCJBUELPVNOQNR-IIBYNOLFSA-N 378.884 5.445 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccncc1 117665099 VCAGTQRABBNHRR-UHFFFAOYSA-N 377.831 5.066 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(-c2ccccn2)ccc1Cl 118967517 WFWFOUVIZCZIGW-UHFFFAOYSA-N 393.899 5.660 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](COCc2ccccc2)c2ccccc2)cc1 123902248 SCRAQVLUKDQIDB-CPJSRVTESA-N 386.495 5.025 30 20 GKED Cc1ccc(OCc2nc(CN[C@@H](CCC#N)c3ccccc3)cs2)cc1 130414413 ZVVSDHKKNSHDJV-NRFANRHFSA-N 377.513 5.165 30 20 GKED COc1ccc(C[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 136902752 XFWLUOTWUBRCSZ-BLLLJJGKSA-N 384.888 5.013 30 20 GKED Cc1cc(Cl)ccc1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 170991747 LYQDXENKLXYXMH-HIFRSBDPSA-N 387.936 5.339 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccccc2SC[C@H](C)C#N)c(Cl)c1 170991836 ZOQCIOHPOAGDCR-HUUCEWRRSA-N 387.936 5.339 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)c2ccco2)c1 189877033 MCCZYIBINCKAKO-UHFFFAOYSA-N 388.467 5.636 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(C#N)ccc1Br 191696773 WLTQXBCXDODBER-CYBMUJFWSA-N 386.318 5.185 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)cc1 212562123 KARVXNUOUBBNPD-ZROIWOOFSA-N 391.854 5.497 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(N2CCCCC2)cc1 214015000 CWBYIEKCYDAOHT-TWGQIWQCSA-N 380.538 5.758 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc(Cl)s3)n2)cc1 255010071 XCCVCZLMKNCGGC-PKYBCLHXSA-N 395.896 5.286 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(C)cc2O)cs1 255831267 IWULPWBRIPMTOR-XFFZJAGNSA-N 392.480 5.046 30 20 GKED N#CCCCOc1cccc(Nc2nc(-c3ccncc3)nc3ccccc23)c1 301113925 WUVMLRUBQGYKPS-UHFFFAOYSA-N 381.439 5.118 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(-n2cccn2)cc1 302955669 FNXNUJYWDQNEGX-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC(O)=Nc1cccc(N=C(O)[C@H](C)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 328727215 DBPXLMJYSZSJHL-SUMWQHHRSA-N 397.441 5.326 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccccc1 431922916 BUKLOCQEOJICEK-FGZHOGPDSA-N 379.479 5.401 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@H](C)c1ccc(Cl)cc1 437854572 ZKSBWFNYXYRPAQ-CQSZACIVSA-N 383.879 5.368 30 20 GKED C=C(C)COc1cccc(NC(=O)NC[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)c1 438126954 ZMLQMZJQSMBFCU-NZQKXSOJSA-N 394.515 5.239 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)N[C@@H](CCC#N)c3ccccc3)oc12 438849021 RBNYNJHLOLQXHJ-APWZRJJASA-N 391.471 5.237 30 20 GKED N#Cc1ccc(C2(C(=O)N3CCC(c4ccccc4C(F)(F)F)CC3)CC2)cc1 440480063 QERZUNKAXPFMCT-UHFFFAOYSA-N 398.428 5.015 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1COC)c1ccc(C(F)(F)F)cc1 442205021 WOSTWGQOSKJDKZ-SFHVURJKSA-N 392.421 5.681 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CCC1(F)F 455936642 CNLICDMFUFNVKG-AWEZNQCLSA-N 387.455 5.218 30 20 GKED C=C(C)Cn1c(-c2cccnc2)nnc1N1Cc2ccccc2-c2ccccc2C1 460803896 MGZRSARYJUYYLQ-UHFFFAOYSA-N 393.494 5.103 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)c1sccc1C#N 464460752 LUJIECSAPGUWQX-UHFFFAOYSA-N 395.871 5.086 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccc(C#N)cc1 465655800 GBBNYYDUBLHFKH-HNNXBMFYSA-N 383.442 5.052 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CC2(CSc3ccccc3)CC2)c1 471816164 MLEPQDRGPUFCQD-UHFFFAOYSA-N 388.439 5.061 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(Cc2ccccc2)CCC1 473823376 LLSGUMLZQYKYME-KRWDZBQOSA-N 379.529 5.368 30 20 GKED CCc1cccc2c(C3CCN(C(=O)C[C@H](CC#N)c4ccccc4)CC3)c[nH]c12 475028871 CEVBDBXJZRIEKZ-QFIPXVFZSA-N 399.538 5.524 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2c(F)cccc2F)C1 475554902 ZNQDQPQPOWADIH-QGZVFWFLSA-N 384.470 5.838 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1 476090274 JQKMSZAVQNHDEB-SFHVURJKSA-N 387.523 6.443 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COC(c1ccccc1)c1ccccc1 476117173 GPKLBGAHNYJFQA-UHFFFAOYSA-N 399.534 6.283 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(Br)c(Cl)c1Cl 480209406 ZCUFJGCUHMTPRI-UHFFFAOYSA-N 393.112 5.207 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)[C@@H]1C 483644114 DQLCCXLBHLQWIT-HUUCEWRRSA-N 383.879 5.053 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 486242474 WIUASSRERPAQDP-UHFFFAOYSA-N 388.492 5.469 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(NC(=O)CCC)ccc1Cl 486939002 DTPNYNRAFCRVOC-UHFFFAOYSA-N 399.922 5.341 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)CSCc1ccc(C#N)cc1)C1CC1 489094006 KGNJTMFEHDOLHQ-OAHLLOKOSA-N 384.932 5.197 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 491432809 MQUPTZWHYKNBPA-UHFFFAOYSA-N 377.394 5.167 30 20 GKED N#Cc1ccc(C(=O)CSc2nnc(-c3ccc(F)cc3)c3ccccc23)cc1 504198927 GGMASTNMNYKHRR-UHFFFAOYSA-N 399.450 5.283 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc1 510769817 XJYZKPNRKSNZLB-HSZRJFAPSA-N 383.495 6.010 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccc(F)cc2Cl)c1 513363285 IHGVIMGEWUBMSV-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2cc3ccccc3o2)cc1 516223679 YYUVLYBOTGCCGL-UHFFFAOYSA-N 383.407 5.418 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc2cccnc12 516670585 SVDUHAKOFQMNKO-UHFFFAOYSA-N 379.419 5.460 30 20 GKED Cc1csc(-c2cccc(NC(=O)CCCCOc3cccc(C#N)c3)c2)n1 517645846 LYBXGBLQQUPTMV-UHFFFAOYSA-N 391.496 5.178 30 20 GKED CCN(CCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccc(C)c1 518252729 BHFJUYULDOHBIB-SFHVURJKSA-N 396.560 5.037 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1 519186779 SFXDXVISUWKYAU-UHFFFAOYSA-N 383.439 5.183 30 20 GKED N#Cc1csc(CN[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)c1 519725347 KQLPNOQBJJGWML-KRWDZBQOSA-N 386.318 5.031 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(Cc3ccccc3F)CC2)cc1 531520562 UVJHXHPRPNMXOV-UHFFFAOYSA-N 379.479 5.113 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 537238126 UQVUPUGHNXNNKV-KRWDZBQOSA-N 380.492 5.505 30 20 GKED COc1ccc2nc(C(=O)[C@H](C#N)c3nc(-c4ccc(C)cc4)cs3)ccc2c1 537665684 OEFISFFHMJYTHB-SFHVURJKSA-N 399.475 5.165 30 20 GKED C=CCC[C@@H](N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21)c1ccccc1 539396660 MCZUDVCFVVYIMF-PKTZIBPZSA-N 376.544 5.272 30 20 GKED CSc1cccc([C@@H](NCc2ccc(CC#N)cc2)c2cc(F)ccc2F)c1 543149870 ICOPVQMDZPURDM-HSZRJFAPSA-N 394.490 5.632 30 20 GKED CCOc1ccccc1-c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 544976878 FZIHUPFABBCWFC-SEYXRHQNSA-N 384.439 5.174 30 20 GKED C=CCN(C(=O)c1cncnc1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 546859504 NBARIAYSLZNAEK-UHFFFAOYSA-N 398.491 5.100 30 20 GKED COc1cc2c(cc1F)CC[C@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 549204397 KDDHGCUOMLIAKE-CXAGYDPISA-N 399.491 5.038 30 20 GKED N#CCCC[C@H](NC1CCN(Cc2c(F)cccc2Cl)CC1)c1ccccc1 550832543 KWWHJFZVDHNKNB-QHCPKHFHSA-N 399.941 5.468 30 20 GKED CCCN(C(=O)Nc1ccc(CC#N)cc1Cl)[C@@H]1CCCc2cccnc21 562914180 ZSLKKRWNXAWRQC-LJQANCHMSA-N 382.895 5.123 30 20 GKED CC(C)c1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1ccccc1 570378903 AKLYZKRHVNVRBN-HXUWFJFHSA-N 380.451 5.034 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CSc2ccccc21 573062500 XWHDHPPBIDQAAE-CABCVRRESA-N 383.542 5.092 30 20 GKED C=CCN(CCC#N)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 575905093 GCNFLLXNQIXTBR-UHFFFAOYSA-N 392.286 5.314 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@@]1(C#N)CC12CCCC2 582646218 FNKNQVVOJIFLTO-QHCPKHFHSA-N 378.447 5.126 30 20 GKED CC(C)SCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 583162320 XMROSPVHTHLUCD-GOSISDBHSA-N 387.936 5.259 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Nc3ccc(-c4ncon4)cc3)cc2)c1 584494292 DIGRLDXSOJFIQP-UHFFFAOYSA-N 397.394 5.045 30 20 GKED COc1cc(C(=O)N(Cc2ccc(C#N)cc2)C(C)C)ccc1OCCC(C)C 603527375 KAQIENWPCXGBFJ-UHFFFAOYSA-N 394.515 5.043 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H](C)Oc1ccccc1 603532275 ADXBXDBYSFUTOI-GOSISDBHSA-N 388.442 5.007 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cc(F)c(Cl)cc1Cl 603658284 YLNILDISPQWCDS-NSHDSACASA-N 394.277 5.816 30 20 GKED Cc1nn(-c2ccccc2)cc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176379 IWZJCRNGYZVKMK-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC[C@H](SCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 609389465 RXDPJBFCJSAWDO-LPHOPBHVSA-N 384.570 5.904 30 20 GKED CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1SC[C@H](C)C#N 609402833 CLUBFPCLAUWLCY-IEBWSBKVSA-N 381.545 5.471 30 20 GKED CC[C@@H](C)[C@@H](C)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CC1 609644189 PVACAMDVAZZSGE-QZTJIDSGSA-N 376.500 5.176 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)c(F)c1 612409661 MCAFCAIBNKWSTL-XMMPIXPASA-N 385.417 5.264 30 20 GKED N#C[C@H](C(=O)c1cccc(-n2cccc2)c1)c1nc2cc(Cl)ccc2s1 613407436 SPVYEAHYSWJKFP-MRXNPFEDSA-N 377.856 5.230 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(C2CCOCC2)c1C 613900338 CXDRCLKTCPTFTM-UHFFFAOYSA-N 380.532 5.561 30 20 GKED CC1(c2ccc(Cl)cc2)CCN(C(=O)c2cc3ccccc3n2CC#N)CC1 619321605 HLOZHXRDBKXNDU-UHFFFAOYSA-N 391.902 5.012 30 20 GKED Cc1[nH]nc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1-c1cccc(Cl)c1 619489531 NDIBYVMYLGIRPP-MRXNPFEDSA-N 378.863 5.065 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccsc1 619787415 WIXSAMBVRQDQEB-MRXNPFEDSA-N 391.496 5.276 30 20 GKED COCc1ccc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 647229862 PJGYXAKREAOVLU-UHFFFAOYSA-N 385.279 5.328 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cccc1-c1ccccn1 677274697 CYFMXXMZQFUDDZ-QGZVFWFLSA-N 387.439 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1c(F)c(F)cc(F)c1F 682777316 KFNGKBACRSQPBJ-UHFFFAOYSA-N 380.385 5.417 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Oc2nccs2)c1 682803641 JNJMBLYCXARWEC-UHFFFAOYSA-N 378.497 6.040 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)c1 726484885 KBGKELKHEAYECP-VGOFRKELSA-N 378.541 5.572 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730170389 DDBFLUIJUSLIBW-YKZVTOKOSA-N 396.490 5.478 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@@H](C#N)c3ccc(C(C)(C)C)cc3)c2c1 731197974 BMSUEEXTNAPWRQ-IBGZPJMESA-N 376.456 5.042 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(C[S@@](=O)C3CCCCC3)c2)c1 734986769 NDSQNQNZZIEHSD-HHHXNRCGSA-N 396.581 5.058 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(-c2c[nH]c3ccccc23)o1 735230438 BUSRQUSWZHWPPS-UHFFFAOYSA-N 396.859 5.066 30 20 GKED C[C@@H](SCC(=O)Nc1sc2c(c1C#N)CCCCC2)c1cccs1 737401833 GFWLFTQAWWUYHK-GFCCVEGCSA-N 376.572 5.383 30 20 GKED COC(=O)[C@@H](Nc1ccc(Oc2ccccc2Cl)cc1)c1ccc(C#N)cc1 739992147 WDSKDPWZSFGEQT-NRFANRHFSA-N 392.842 5.330 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cc(F)ccc3Cl)c2)s1 740446702 BLHMYBNXKYMUDA-UHFFFAOYSA-N 385.851 5.401 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Nc2ccccc2OCC2CC2)cc1 741058548 DTFMTTOOGIZNSO-JOCHJYFZSA-N 397.478 5.775 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 742259688 OIMFJAANKJWVFQ-SANMLTNESA-N 378.475 5.621 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(Cl)ccc2Br)c1 742709961 XLHLEHZRQFXYPY-MRXNPFEDSA-N 393.712 5.073 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3c(C)nn(C(C)C)c3C)cs2)c1 746346280 OMZFSYRLKPZWIJ-MDZDMXLPSA-N 381.501 5.109 30 20 GKED COc1cc(C(C)=NNc2ncccc2C(F)(F)F)ccc1SC(F)F 746490428 WQRGGBWCUHSCFA-UHFFFAOYSA-N 391.365 5.260 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc3c(c2)CCCC3)cc1OCCCC#N 747361287 KDOVJZFLEKNITR-WQLSENKSSA-N 375.468 5.153 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CC12CCCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 747477566 BVDYMLPYDXIRDH-KBPBESRZSA-N 391.323 5.873 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 747667934 RHRNWFHICOLWLN-OLZOCXBDSA-N 392.355 5.686 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)CCc1ccc(-c2ccccc2)o1 749360680 BDQJQILPIFZVGK-UHFFFAOYSA-N 395.462 5.015 30 20 GKED C=CCC[C@H](NC(=O)c1ccccc1OCC#N)c1ccc(C(F)(F)F)cc1 749945344 XOBFMEJRZYNUNA-SFHVURJKSA-N 388.389 5.045 30 20 GKED Cc1cc(C(F)(F)F)c(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nn1 750465286 XTVJASVUOSGTOI-BRPSZJMVSA-N 395.269 5.125 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)COc2c1ccc(Cl)c2Cl 753145154 SPEKLJGOSMBKGI-XFFZJAGNSA-N 389.263 5.171 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1ccc([N+](=O)[O-])cc1 754695582 WCMRCQDGJKMMDA-UHFFFAOYSA-N 397.866 5.062 30 20 GKED COc1cc(F)c(C(=O)/C=C/c2ccc(-c3ccccc3OC)cc2)cc1OC 760271137 ZHDVSCHIAULMGT-JLHYYAGUSA-N 392.426 5.415 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1cc(Br)ccc1F 763123012 XRSZQJIRTVSMLE-DUXPYHPUSA-N 389.249 5.003 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc2[nH]ccc2c1)c1nc2cc(Cl)ccc2s1 765917160 ZARJKBQGRQPSSW-IJJSQOHJSA-N 377.856 5.321 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(-c2cccnc2)cc1 775540861 YZJFYXKERYACBB-MRXNPFEDSA-N 377.875 5.155 30 20 GKED CCCC[C@@H](NC(=O)Nc1ccccc1O[C@@H](C)C#N)c1ccc(OC)cc1 780669505 LFASPBJSFCFCDS-QFBILLFUSA-N 381.476 5.039 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(CN[C@H](C)c2ccc(C#N)cc2F)cc1 781421175 FNQDMFJTLDUNNE-HZPDHXFCSA-N 397.494 5.134 30 20 GKED CCCCOc1ccc(CNC(=O)c2ccccc2SCC#N)cc1Cl 786237913 QVBSHPQPLOPUDP-UHFFFAOYSA-N 388.920 5.065 30 20 GKED C#CCCCCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 797464795 HFBQXBCCDRJSJQ-UHFFFAOYSA-N 379.287 5.305 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCC(F)(F)C2)cc1 800519272 NCJHOUOEHYNOEF-OXJNMPFZSA-N 383.442 5.289 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(C2CCCC2)cc1 810529363 FACFOIVGESPZAP-QFIPXVFZSA-N 388.511 5.430 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)sc21 813218480 WHFIPGOETIKHRN-AWEZNQCLSA-N 399.397 5.297 30 20 GKED Cc1ccc2oc(-c3noc([C@@H](CCCC#N)NC(=O)OC(C)(C)C)n3)cc2c1 818421556 FRZQYZVEBVHYCI-OAHLLOKOSA-N 396.447 5.051 30 20 GKED Cc1c(NCc2cccc(OCCCC#N)c2)cccc1NC(=O)OC(C)(C)C 858232948 BJPNYFGABPLDDA-UHFFFAOYSA-N 395.503 5.637 30 20 GKED FC(F)Oc1ccc(NCc2ccccc2CC(F)(F)F)c(OC(F)F)c1 864025692 OOUPEKKTIOXCEB-UHFFFAOYSA-N 397.290 5.606 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(F)cc2F)cc1 915124816 YMUPHWICRIPFEB-GOSISDBHSA-N 379.435 5.429 30 20 GKED CCCCCCCCC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 916846795 FNUHMFFLXBSROY-OAHLLOKOSA-N 385.533 5.203 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(Oc3ccccc3)cc2)cc1 916908916 GJKZPKXVHCWQNX-JOCHJYFZSA-N 384.435 5.002 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917024912 CJOXTVMGENEIIT-CXAGYDPISA-N 398.940 5.821 30 20 GKED C=CCn1c(-c2ccncc2)nn(CN(C2CCC(CC)CC2)C2CC2)c1=S 917439993 JWXCGVLHVQQQKC-UHFFFAOYSA-N 397.592 5.053 30 20 GKED CCO[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805648 OKGKXOKTSFGOMP-XOBRGWDASA-N 398.434 5.042 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1cccc(Cl)c1Cl 1776180582 SWKMVKLRMYNPOX-KRWDZBQOSA-N 384.690 5.461 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(F)cc(Br)cc1F 1776784239 YYCXEELUOQOAPB-ZDUSSCGKSA-N 392.284 5.021 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2O)cc1 1776785630 XRFXPBMCOTXEKP-UVTDQMKNSA-N 396.483 5.726 30 20 GKED CCCCCCCOc1ccc(CN[C@H]2CCCC[C@@H]2CCC(=O)O)cc1 1776786446 VZCAKNPWQZGMEO-IRLDBZIGSA-N 375.553 5.549 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccsc3)CCC2)cc1 1791243463 ODBGOTFRINBKSJ-CEUCYRDJSA-N 394.540 5.108 30 20 GKED C=CCN(C(=O)c1csc(-c2ccc(C)cc2)n1)c1nc2c(s1)CCCC2 17365512 CHWRSWWJRVKOTJ-UHFFFAOYSA-N 395.553 5.287 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2OCc2ccc(F)cc2)cc1 25438274 YKTSDJCCPKPGCD-UHFFFAOYSA-N 388.442 5.458 30 20 GKED C=CCn1c(S[C@H](C)c2nc(-c3cccs3)no2)nnc1-c1ccccc1 26007771 HBGYXCDCODKIIT-CYBMUJFWSA-N 395.513 5.096 30 20 GKED CC(=O)N(c1nc(COc2ccc(C#N)c(F)c2)cs1)c1ccc(C)cc1C 66750503 JPFRBCJBJXOHJC-UHFFFAOYSA-N 395.459 5.034 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1cccc2cccnc12 68745089 IUVCSJVFEVVCBR-UHFFFAOYSA-N 395.487 5.188 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1ccccc1F 108146139 HAGHTIBDTIIMNM-UHFFFAOYSA-N 398.488 5.279 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccncc1 108532097 VAVMKKRMIUMULN-YLJYHZDGSA-N 394.544 5.483 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 112796568 BEOJEMSXYQKOEJ-QHCPKHFHSA-N 392.499 5.008 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1ccc(F)cc1Cl 112817941 OLLACAPMZIGLSM-CHWSQXEVSA-N 392.883 5.137 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 114009037 FDGGCKNVLFDBAB-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1cccnc1[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 115769543 BCMLJYJAMNVSPK-BEFAXECRSA-N 382.533 5.161 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H]1CCCc2sccc21 119595772 GMKKUHGALCPHSD-SFHVURJKSA-N 389.480 5.174 30 20 GKED Cc1nc([C@H](C)Nc2cccc(OCCCC#N)c2)oc1-c1ccc(Cl)cc1 130026486 DMMHPLCUXXFETB-INIZCTEOSA-N 395.890 6.159 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)N(CCC#N)Cc1ccccn1 134948368 ZEFVPDZEOQNBLC-UHFFFAOYSA-N 388.924 5.183 30 20 GKED Cc1[nH]c(=S)sc1CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 173536216 IEZWBLHLWBXNTO-UHFFFAOYSA-N 399.472 5.098 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(Cl)cc1F 188917908 LPKFWEWNRVDVEB-GFCCVEGCSA-N 377.872 5.195 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@]2(C)[C@H](C1)C2(F)F 292720393 UMUVBRPQCRSCJP-FPOVZHCZSA-N 397.425 5.168 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccccc1N(C)C1CCCC1 328941992 TYIOJJULJLRFLK-INIZCTEOSA-N 399.560 5.361 30 20 GKED Cc1cccc(Cc2cnc(N=C(O)[C@H]3CCC(=O)[C@H](C)C3)s2)c1Cl 328942346 UAXIVVFNMNYIPV-OCCSQVGLSA-N 376.909 5.289 30 20 GKED CC(C)(c1ccc(NC(=O)CSCc2ccc(C#N)cc2)cc1)C(F)(F)F 428439313 CBCJQCRVGAZCFQ-UHFFFAOYSA-N 392.446 5.270 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cs1 428482642 MPIGAHFDEBSZII-OAQYLSRUSA-N 388.496 5.044 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(OC(F)(F)F)c1)c1ccccc1 432688956 YDBKDLACZCQLHB-QGZVFWFLSA-N 377.366 5.142 30 20 GKED CC1(C)CCCN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)[C@H]1C#N 434033964 ZIECJHRBPFCLSF-HNNXBMFYSA-N 394.327 5.271 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1nc2ccccc2s1 437551496 UWFYXBIFYPAFRK-SNVBAGLBSA-N 380.778 5.459 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C2CC2)[C@H](C)C2CC2)cc1 438192038 YUHYDYUSSJYYJL-OAHLLOKOSA-N 391.471 5.154 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 439695380 YNRRBTHXFDQPPO-HNNXBMFYSA-N 394.496 5.109 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCC(=O)c2csc3ccccc23)cc1 445716270 OBSRQMCWVZCDBP-UHFFFAOYSA-N 376.481 5.304 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3CCCSc4ccc(Cl)cc43)on2)c1 448252418 OTNBJECPTFOVOZ-UHFFFAOYSA-N 395.871 5.009 30 20 GKED COc1cc(CNC(=O)N(C2CC2)[C@H](C)c2ccc3ccccc3c2)ccc1C#N 462472196 HJQNCINZLQWGEZ-QGZVFWFLSA-N 399.494 5.155 30 20 GKED C[C@H](C(=O)Nc1ccccc1OCc1cccc(Cl)c1)c1cccc(C#N)c1 463943300 DTIVDPRTNZNUQF-INIZCTEOSA-N 390.870 5.533 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1CN(C)C(=O)c1cc2ccccc2o1 466432477 XIBISSJDOUEHDF-KRWDZBQOSA-N 390.483 5.246 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1 467281043 ISTJCSYIYKLBOR-UHFFFAOYSA-N 397.906 5.331 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ncoc1-c1ccc(F)cc1 471362812 HVFNVNFABBYVIE-UHFFFAOYSA-N 376.840 5.024 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccccc1 476135743 GMRYNMZGKXMYFW-QGZVFWFLSA-N 391.858 5.553 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccco3)n2C2CCCCC2)cc1F 478521287 ZCCSFTGOXXFVRU-UHFFFAOYSA-N 382.464 5.346 30 20 GKED COc1cc2c(cc1OC)[C@H](NCc1ccc(-c3ccccc3C#N)cc1)CC2 479425548 WUHKMQCJDVBBDN-HSZRJFAPSA-N 384.479 5.020 30 20 GKED Cc1ccccc1[C@@H](C)SCC(=O)Nc1ccccc1S[C@H](C)CC#N 480380076 AYHRGCHVPWTBTE-IAGOWNOFSA-N 384.570 5.822 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cc1 486097713 QQGWYTJJTWMGBW-DNVJHFABSA-N 387.527 5.678 30 20 GKED Cc1cccc([C@H](C)S(=O)(=O)Cc2ccc(-c3ccccc3C#N)cc2)c1 494729609 RCVPEHZRWJWHFD-SFHVURJKSA-N 375.493 5.210 30 20 GKED CC(C)c1noc([C@H](C)Sc2nc3c(c(-c4ccco4)c2C#N)CCC3)n1 498057205 GWDNKJCFGFEHFJ-LBPRGKRZSA-N 380.473 5.062 30 20 GKED CC(C)CN(C(=O)c1cc(-c2cccc(Cl)c2)no1)c1ccc(C#N)cc1 499405299 IPODDRJNPZMWJS-UHFFFAOYSA-N 379.847 5.169 30 20 GKED CCC(CC)(CNC(=O)N1CCC(C)(C#N)CC1)c1ccc(Cl)c(Cl)c1 503204019 YCKFZXMWZGNPDY-UHFFFAOYSA-N 396.362 5.386 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1 507765497 DODFZUWYVVTTNV-BEFAXECRSA-N 393.487 5.258 30 20 GKED CCC(CC)N(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H]1CCCc2cccnc21 511334888 RQEKYBVBUHYGBN-QFIPXVFZSA-N 389.543 5.591 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc2ccccc2nc1C 511566120 WFRJUHMJQTYWRV-UHFFFAOYSA-N 393.446 5.768 30 20 GKED CC(C)(CC(=O)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1)C(F)(F)F 512372159 RSPHTJPVTMYDPA-HNNXBMFYSA-N 385.323 5.081 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1F 512665509 GIDPCCVZIRMKLU-QMHKHESXSA-N 384.458 5.024 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(-c2ccccc2)cn1 512719603 DICYVYZGIOGDGV-UHFFFAOYSA-N 375.431 5.540 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517656150 SIDYXSKKIJRNDP-UHFFFAOYSA-N 376.843 5.759 30 20 GKED CC(C)CN(CC(F)(F)F)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 521087054 KUMDSJFTEKCDQP-UHFFFAOYSA-N 390.405 5.205 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 521768313 CGTKPVPHGSAVIT-LJQANCHMSA-N 396.277 5.359 30 20 GKED CC(C)C[C@H](NC(=O)NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 522994398 YFGRLSGYUBNCID-IBGZPJMESA-N 389.421 5.164 30 20 GKED CCN(CC)C(=O)[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 523849972 KHQSRPMLLADTCS-DEOSSOPVSA-N 399.494 5.372 30 20 GKED CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(COc2ccccc2C#N)o1 524847163 KGBCRGGHLOVAHG-IBGZPJMESA-N 380.488 5.161 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 533900377 HOQYELAMPJOUHV-IBGZPJMESA-N 384.479 5.262 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 538044016 QSBBKBNVPJAOMV-MRXNPFEDSA-N 398.915 5.755 30 20 GKED C[C@@H]1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)c2cc(Cl)ccc2S1 539628535 FTDNSMVTTYZICP-CQSZACIVSA-N 382.916 5.426 30 20 GKED COCc1cccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541997310 ZARWEGXIDCPJLH-QGZVFWFLSA-N 385.467 5.254 30 20 GKED N#CCc1ccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)cc1 542225063 YBDNCIPJLYFZLQ-UHFFFAOYSA-N 389.528 5.204 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1cnc2cnccc2c1 543063895 GEAMTBPZIGWKRV-UHFFFAOYSA-N 398.853 5.002 30 20 GKED N#Cc1cccc(CNc2cc(C(=O)Nc3ccccc3)ccc2Cl)c1F 544095814 BONGMDPRCOEFCN-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1ccccc1C(NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1C 545500973 XABUHYVNQDFVFZ-UHFFFAOYSA-N 383.495 5.106 30 20 GKED N#CCCC[C@H](N[C@H]1CCc2c(F)ccc(Br)c21)c1ccccc1 551206097 PNMVVSDJRLXRLH-OALUTQOASA-N 387.296 5.600 30 20 GKED Cc1c(C(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)ccc(C(F)(F)F)c1F 554810382 AESZNWRIGKUNAY-PHIMTYICSA-N 385.323 5.346 30 20 GKED CCC[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)c1ccccn1 555559436 NFFDVHBECPIWKO-QFIPXVFZSA-N 399.494 5.363 30 20 GKED CC[C@](C)(C#N)c1nc(-c2ccc(Oc3cccc(Cl)c3Cl)nc2)no1 561903315 NLPBIWHJZDYYTD-GOSISDBHSA-N 389.242 5.422 30 20 GKED C[C@@H]1Cc2sc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c(C#N)c2[C@H](C)C1 569685835 XCMOZOFOKGBFIX-WOSRLPQWSA-N 378.497 5.004 30 20 GKED Cc1cccc([C@@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)c1 573971380 VSECIJFMRUYJDR-OAQYLSRUSA-N 381.401 5.160 30 20 GKED Cc1sc(NC(=O)c2cc(F)c(Br)c(Cl)c2)c(C#N)c1C 579635364 RNHCTUADFRMUAU-UHFFFAOYSA-N 387.661 5.044 30 20 GKED N#Cc1cscc1C(=O)N1CCC(Cc2cc(Cl)ccc2Cl)CC1 580224592 URLRUAZXVJPHAK-UHFFFAOYSA-N 379.312 5.021 30 20 GKED N#CCCCn1cc(-c2nc(-c3nccc4ccccc34)no2)c2ccccc21 581215982 ZRRDMQOEYBFRRA-UHFFFAOYSA-N 379.423 5.210 30 20 GKED CC(F)(F)c1cccc(-c2noc([C@H]3CCCN3c3ccc(C#N)cc3)n2)c1 590779344 OGICJEAMABAOQM-GOSISDBHSA-N 380.398 5.061 30 20 GKED N#CCCC[C@H](NCc1noc(-c2c(F)cccc2Cl)n1)c1ccccc1 592121693 BGIZWLNOQPCEFM-KRWDZBQOSA-N 384.842 5.054 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N2CCC[C@@H](CC#N)C2)cc1 596641046 BBRDNJTULJHJPX-HNNXBMFYSA-N 399.878 5.298 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1cccc(C#N)c1 600848882 LTOSJAWVYFPNTF-ZDUSSCGKSA-N 399.372 5.595 30 20 GKED N#Cc1ccc(CSCc2csc(COc3ccc(F)cc3)n2)c(F)c1 604058497 VYUREZNCDISSQQ-UHFFFAOYSA-N 388.464 5.305 30 20 GKED Cc1cccc(OCCCCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1 609416368 MCDRPFWKPVZRFO-GOSISDBHSA-N 391.298 5.232 30 20 GKED C[C@H](C1CC1)N(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)C1CC1 609723227 VQSDYVARAYDRGL-CQSZACIVSA-N 380.875 5.407 30 20 GKED C[C@@H](NC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1cccc(C#N)c1 610359510 KTRHKPAMIWIAEG-MRXNPFEDSA-N 390.870 5.135 30 20 GKED CCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@H](Cc1ccc(F)cc1)C(C)C 610406608 GIQJQWPUCFZZKM-VGOFRKELSA-N 381.495 5.057 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1CC2)c1ccc2ccccc2n1 613291104 UJZRAZFKWSEAKZ-IBGZPJMESA-N 380.472 5.552 30 20 GKED CCc1noc(C)c1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494514 VNEJFNWVIHSQKD-UHFFFAOYSA-N 398.278 5.087 30 20 GKED O=C(C/C=C\c1cccc(F)c1)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 674080665 MKNKDMKKNWUTOZ-UZMLQMNBSA-N 397.334 5.255 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 678207920 IDGOIDHBGHCIJY-GHMZBOCLSA-N 397.256 5.407 30 20 GKED N#C[C@H](C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1nccc2ccccc12 683225177 FFYCXWJFVGYYQU-ZDUSSCGKSA-N 376.284 5.022 30 20 GKED N#CCCCOc1cccc(C=NN(Cc2ccccc2)Cc2ccccc2)c1 726737048 FWBBEZMPKDOXRL-UHFFFAOYSA-N 383.495 5.405 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1csc2ccccc12 730067937 IFJKUIVENDSRTM-INIZCTEOSA-N 377.513 5.454 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2ccccc2c(Cl)n1 731332671 PPWPTEJZDMPCPV-ZDUSSCGKSA-N 381.888 5.535 30 20 GKED CC[C@H](OC(=O)CCc1c(C)nn(CCC#N)c1C)c1ccc(C(C)(C)C)cc1 731778343 IWOCQEQEIIGOHF-QFIPXVFZSA-N 395.547 5.338 30 20 GKED CC(=O)Nc1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1C 733622632 WNNCNJNHZXBMQA-JOCHJYFZSA-N 398.466 5.253 30 20 GKED CCSc1cccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 733843793 VWUCGVWVLPUBDR-JOCHJYFZSA-N 387.508 6.098 30 20 GKED N#C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C1CCCCC1 734366872 BWEUQWAJGURPAR-TZIWHRDSSA-N 381.545 5.294 30 20 GKED COc1cc(C(=O)/C=C\c2cc(Cl)ccc2[N+](=O)[O-])ccc1SC(F)F 739424392 IZPWCLZNVGBHGO-KXFIGUGUSA-N 399.802 5.468 30 20 GKED Cc1ccc(C)c(-n2ncc(C(=O)/C=C\c3cccc(OCCCC#N)c3)c2C)c1 741845388 ZUWNEXHONBORKQ-QXMHVHEDSA-N 399.494 5.376 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(O[C@H](C)C#N)cc2)cc1 742376096 MHTVDGXXGUXCNH-RTBURBONSA-N 386.495 5.504 30 20 GKED C#Cc1cccc(N(C(=O)[C@H](C)c2ccc(Br)s2)C(C)C)c1 742673599 ZFBHCWWLWJLMSB-CYBMUJFWSA-N 376.319 5.037 30 20 GKED COc1ccc(-c2nn(Cc3ccccc3)cc2C=NNc2ccccc2)cc1 744535779 KOIXGJSCHNFTOB-UHFFFAOYSA-N 382.467 5.053 30 20 GKED CCCN(CCC)c1ccc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)cc1 748584247 NBVLLXHOMPNADY-VGOFMYFVSA-N 392.499 5.166 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1cccc(Cl)c1 750684275 OYTYVMVEZPEINZ-IZLCOFNUSA-N 388.854 5.244 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2cnc(-c3cccs3)s2)cc1 751512214 HLLKGGXLAWBGNT-KTKRTIGZSA-N 399.493 5.011 30 20 GKED Cc1nc2sccn2c1C=NO[C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1 752781409 IOYXLECFNRDVFU-LBPRGKRZSA-N 386.864 5.124 30 20 GKED N#C[C@H](C(=O)C1CC(F)(F)C1)c1nc(-c2ccc(Cl)cc2Cl)cs1 753802674 QHIVKTHDDSQPTI-LLVKDONJSA-N 387.238 5.338 30 20 GKED N#Cc1ccc(F)c(CN[C@H]2CCCc3nc(-c4ccccc4F)sc32)c1 773030591 UIIOPRUIPMKBJM-SFHVURJKSA-N 381.451 5.127 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cc(Br)cs1 782370352 UETXFSDSXJFBNH-OWOJBTEDSA-N 382.329 5.592 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)O[C@@H](C)c3cccc(C#N)c3)c(C)c2c1 782622429 YKTUVLLCDBUTEV-INIZCTEOSA-N 375.424 5.053 30 20 GKED CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCCCC(C)(C)C#N)c12 782935050 WYLUINJFJRFXGC-UHFFFAOYSA-N 383.492 5.176 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC(F)(F)Cl)cc1 783353446 CFWLFSZFBDMPAZ-LBPRGKRZSA-N 396.846 5.501 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 788349060 IKBZEBOTMUFFGZ-YVMONPNESA-N 393.342 5.016 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc3ncccc3c2)cc1 791749514 GZVQHOJZUHKGIT-HSZRJFAPSA-N 392.462 5.212 30 20 GKED Cc1ccc2c(Cl)c(C(=O)OCCCC3(C#N)CCOCC3)sc2c1 800162979 VQVCHKHWJJDMHW-UHFFFAOYSA-N 377.893 5.121 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 805163740 GSVDDGCIXBVAAI-GOSISDBHSA-N 396.277 5.605 30 20 GKED Cc1c(NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)n[nH]c1C1CC1 806314842 GJXCROQIRYUHKO-UHFFFAOYSA-N 391.406 5.043 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942367 XSDBKMNPASCRMS-QAPCUYQASA-N 375.497 5.116 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1)c1nccc2ccccc12 847694611 KTAHOBLCFDJUIB-LJQANCHMSA-N 394.396 5.552 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086256 IXLHUEQBJZOIHZ-QFIPXVFZSA-N 393.446 5.558 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3/CCc4ccccc4C3=O)c2)cc1 916135644 BYLWURFPCSAYTF-HKWRFOASSA-N 383.447 5.160 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)cc2)CC1)c1nc2cc(Cl)ccc2s1 917047328 WWTZRWDGVDWDGB-AWEZNQCLSA-N 387.291 5.511 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc2c(c1)Cc1ccccc1-2 920103884 GFMRXTDAMOOFET-QFIPXVFZSA-N 390.442 5.253 30 20 GKED N#C[C@@H](C(=O)/C=C\Sc1ccccc1)c1nc(-c2c(F)cccc2F)cs1 920803818 DOSSGFHQXRWEAB-CMUBDUJZSA-N 398.459 5.571 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(COc3ccccc3)c2)ccc1Cl 1776034476 IWJZERXOUMWUAD-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)o2)cc1 1776125802 SWNVXTTVMRCBPK-VCFJNTAESA-N 382.456 5.623 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C1\CCCc2cc(C(=O)O)ccc2C1=O 1776200011 JGYSCXWUTFGUDZ-HLXKFHDQSA-N 398.405 5.535 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)o2)cc1)c1ccccc1 1776469411 KOZKYMKAGWRLBI-QOGCNJHPSA-N 388.419 5.414 30 20 GKED CCCCCCCOc1ccc(CN[C@@H]2CCCC[C@H]2CCC(=O)O)cc1 1776786447 VZCAKNPWQZGMEO-RBBKRZOGSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1cccc(CNCc2c(C)sc(C)c2C(=O)O)c1 1776787653 HJVJQBHJMJQNAC-UHFFFAOYSA-N 389.561 5.702 30 20 GKED CCCCCCCOc1ccc(CN[C@](C)(CCC(C)(C)C)C(=O)O)cc1 1776788231 SGWYMZQJKSRFFT-HSZRJFAPSA-N 377.569 5.795 30 20 GKED CCCCCCOc1cccc(/C=C/C(=O)c2cccc(OCC(=O)O)c2)c1 1776790221 AVDLEGSCGMYZCN-OUKQBFOZSA-N 382.456 5.005 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)c(F)c2)[n+]2ccccc2)cc1C 14872448 WFVRHVXGOUDLNV-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2nnc(-c3ccccc3)o2)n1 36781105 ZCFGWGDWUIHNSY-LLVKDONJSA-N 390.390 5.184 30 20 GKED CCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1OCC 41535239 SJBUHJXXNBGPSR-QGZVFWFLSA-N 392.480 5.098 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)cs2)cc1 48858422 QLFNEHQCZYLMLO-SFHVURJKSA-N 399.475 5.247 30 20 GKED CC(=O)Nc1c(C)ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C 55888910 ZPCILMLGUKJBPG-UHFFFAOYSA-N 383.451 5.053 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1 60014543 LUIQXLBZBQIFIN-UHFFFAOYSA-N 381.435 5.114 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66856114 MGRHIKDZBOHFBO-QGZVFWFLSA-N 380.513 5.299 30 20 GKED CC(C)COc1ccccc1NC(=O)c1occc1COc1cccc(C#N)c1 102235328 RDBVJHKINIPQGJ-UHFFFAOYSA-N 390.439 5.017 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 108530846 DAFUOYDVRPQPOK-KBPBESRZSA-N 389.471 5.441 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 112128367 XKOMAJRKLPVYCV-CVEARBPZSA-N 377.579 5.220 30 20 GKED CCC(=O)Nc1ccc(NCc2cccc(OCc3ccccc3C#N)c2)cc1 114768759 KNHSHUZBQCVQOX-UHFFFAOYSA-N 385.467 5.098 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc(Cc2ccccc2)s1 151004931 MNXXPAQAVIGGJR-OAHLLOKOSA-N 393.537 5.380 30 20 GKED C=C(C)COc1cc(CN[C@H](c2ccco2)c2ccccc2OC)ccc1OC 151108856 DEMOIAXHKOAGFD-DEOSSOPVSA-N 393.483 5.131 30 20 GKED Cc1nc(C)c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 170974808 IXGUMJPZHNVDIT-UHFFFAOYSA-N 385.436 5.037 30 20 GKED CC(C)Oc1ccc(F)cc1NCc1cn(CCC#N)nc1-c1ccccc1 180881828 IRFFOGZRFORHOJ-UHFFFAOYSA-N 378.451 5.002 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)s2)o1 181522385 SNZNJAPXUKZHBA-GFCCVEGCSA-N 397.406 5.551 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nccs1 183676258 YZTLBQJHUCRGEE-HNNXBMFYSA-N 392.484 5.074 30 20 GKED Cc1csc(-c2ccc(NC(=O)Nc3ccccc3O[C@@H](C)C#N)cc2)n1 183943764 FJWOVEQFEBITMA-AWEZNQCLSA-N 378.457 5.053 30 20 GKED O/C(CC1CC(c2ccccc2)C1)=N/C1CCN(/C(O)=N\C2CCCCC2)CC1 328678754 SXUOFMHAESBPAS-UHFFFAOYSA-N 397.563 5.238 30 20 GKED Cc1ccc2nc(C3CC3)cc(/C(O)=N/[C@@H]3CCc4cnn(C(C)C)c4C3)c2c1 330175488 ZSZLQWSIBXREPD-GOSISDBHSA-N 388.515 5.060 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 425729012 VNKOMJPDJPSPDD-UGSOOPFHSA-N 393.384 5.093 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(Cl)c(F)c1 441415041 OBYFZLLLSYXIKC-UHFFFAOYSA-N 398.821 5.189 30 20 GKED CCC[C@H](Cc1ccccc1)N(CCC)Cc1nnc(-c2cccc(C#N)c2)o1 441502680 QVCSNQSUNMUSGE-JOCHJYFZSA-N 388.515 5.232 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1ccccc1Sc1ccccc1C#N 444452173 BHDOYGXIGJAYNQ-UHFFFAOYSA-N 383.476 5.752 30 20 GKED Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)CC(C)(C)C#N)nc2c1 447130604 ZVGACINMRJCKTK-UHFFFAOYSA-N 377.513 5.386 30 20 GKED N#Cc1cccc(COc2cccc(NCc3noc(C4CCCCC4)n3)c2)c1 448059788 FBOHTYHBZBNAJN-UHFFFAOYSA-N 388.471 5.180 30 20 GKED N#C[C@@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 464465189 FXJWFDXEAGYRFY-LJQANCHMSA-N 396.368 5.169 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc2cc(Br)cc(C)c2o1 471175905 IWHJXLARWVLGNL-UHFFFAOYSA-N 377.282 5.048 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cn2cc(Cl)ccc2n1 475581834 HXWOWNNFXASSJG-UHFFFAOYSA-N 382.895 5.161 30 20 GKED C[C@@H](Sc1ccc(F)c(Cl)c1)C(=O)N(CCC#N)c1ccc(F)cc1 480545204 KDEXUJMPANPTTQ-GFCCVEGCSA-N 380.847 5.046 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1 482197135 COFQXABBQXWXTK-OAQYLSRUSA-N 383.511 5.102 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1ncc(-c2cccc(F)c2)o1 488733506 JYDWSKLHJWQBRU-UHFFFAOYSA-N 379.338 5.058 30 20 GKED CCn1c(SCc2ccc(-c3ccccc3C#N)cc2)nnc1-c1ccccn1 489415696 TYNQCTPEQWGEJK-UHFFFAOYSA-N 397.507 5.191 30 20 GKED COc1ccc2ccc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc2c1 496408255 UITDTPSYMATNJC-KRWDZBQOSA-N 392.867 5.602 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@@H]1CCCC[C@@H]1C 497803787 IXINPCATBZNGAK-GAJHUEQPSA-N 394.490 5.134 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(F)c1)c1nc(-c2c(F)cccc2F)cs1 498556633 YRJZYTOMSUKZSJ-JTQLQIEISA-N 392.789 5.371 30 20 GKED CCC[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccn1 499891692 XRRCHIMDZVCJHB-SFHVURJKSA-N 389.430 5.407 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCSc1ccc(Cl)cc1 501021235 VHDFPYGSQOHOGS-UHFFFAOYSA-N 396.899 5.520 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 503417890 HFRQCRXIBYSMLV-SIKLNZKXSA-N 396.918 5.340 30 20 GKED N#C[C@@H](NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1ccccc1F 505917164 NMUDDZIAMZHJFO-NHCUHLMSSA-N 394.446 5.179 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(OC(C)C)nc1 510238984 JHKUIOUWXBUYSZ-UHFFFAOYSA-N 387.439 5.094 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)CCCCC1 510572517 KTOKMKGSEFTQNO-UHFFFAOYSA-N 389.377 5.305 30 20 GKED C=CCOc1cccc(NC(=O)N2CC=C(c3c(C)[nH]c4ccccc34)CC2)c1 513224006 PJDBBBJYBYFKEK-UHFFFAOYSA-N 387.483 5.362 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@H](C)c2ccc(Cl)c(Cl)c2)n1 515850760 JWUSLJQQRZPEFY-SNVBAGLBSA-N 381.284 5.290 30 20 GKED Cc1cccc(CN(CC(C)C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 520941285 IRJVZMYLPGWOEB-IBGZPJMESA-N 395.572 6.079 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Nc1ccccc1SC[C@@H](C)C#N 524565785 IVGOPPCOPOKKJY-KSSFIOAISA-N 397.544 5.675 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 524572721 PIURYWMLANAZLL-BLLLJJGKSA-N 379.312 5.164 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c2)cs1 525284158 VISWVGAMRFFPKB-LBPRGKRZSA-N 393.537 5.429 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1 525756676 ONHKFMMSOWUTTC-ZIAGYGMSSA-N 381.932 6.055 30 20 GKED C[C@H]1CN(c2ccccc2NC2CCC(C#N)(c3ccccc3)CC2)C[C@H](C)O1 535840959 OSQLLGOAOMWXIJ-NHJJBMEFSA-N 389.543 5.116 30 20 GKED C=CCn1c(SCc2ncc(Cl)cc2Cl)nnc1-c1ccc(F)cc1 538531204 KSPGKURUVCGESS-UHFFFAOYSA-N 395.290 5.264 30 20 GKED CCN(C(=O)Cc1ccc(N[C@@H](C)c2cccc(C#N)c2)cc1)c1ccccc1 538642231 YZAMACXRTSRBLD-IBGZPJMESA-N 383.495 5.327 30 20 GKED CCc1c(C)sc(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)c1C#N 540391837 XJROZEFHFBIBFT-UHFFFAOYSA-N 389.502 5.152 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC=C(c2ccccc2F)C1 542954583 JFKADYCAQVHVDW-HNNXBMFYSA-N 381.476 5.009 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1 554966337 RNIWFSDPGDNTNZ-ZDUSSCGKSA-N 388.389 5.158 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1nc2ccccc2nc1C1CC1 576682559 KIJZFGKIVZJSHH-AWEZNQCLSA-N 388.496 5.011 30 20 GKED CC(C)Oc1ccc(N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 577072943 FJBKOKLIERBCJN-INIZCTEOSA-N 383.517 5.394 30 20 GKED COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)CCCCCC#N)c1 588676319 CEQSDWCNTMWOHB-ISKFKSNPSA-N 376.500 5.226 30 20 GKED CCCC[C@@H](CC)COCc1cccc(NC(=O)N2CCC[C@H](CC#N)C2)c1 596705126 VIUDNNNYKLPUJK-WOJBJXKFSA-N 385.552 5.577 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)[C@@H](C)CC#N 597289928 QLKPSFFCHWYQJQ-AWEZNQCLSA-N 378.451 5.220 30 20 GKED Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1N[C@@H](C)c1cccc(C#N)c1 600847256 BERWZSLQDOXPDZ-LMMKCTJWSA-N 375.516 5.158 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cn2)c1 603622257 PXANGENKAKDOJH-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCSc1cc(C#N)ccn1 603724978 ABZFWOVQCFAXLN-UHFFFAOYSA-N 387.936 5.242 30 20 GKED Cc1ccc(-c2ccsc2C(=O)Nc2nc(C)c(SCC#N)s2)cc1 603775789 SAQCFJDEEDXITR-UHFFFAOYSA-N 385.539 5.356 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(Br)s3)cc2)cc1 604457046 MIKHDEGYIVSKHA-UHFFFAOYSA-N 399.269 5.427 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 606180961 MPOPXDFSNACKMD-INIZCTEOSA-N 391.433 5.107 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(Sc2ccccc2)CC1 609469783 KVWRGUYGKPZHLT-MRXNPFEDSA-N 397.569 5.527 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCCc4sccc4C3)cc2)cc1 609520364 QPSBVDDBMWEDKZ-UHFFFAOYSA-N 388.492 5.195 30 20 GKED Cc1ccccc1-n1c(S[C@H](C)c2ccc(C#N)cc2)nnc1-c1ccncc1 609813510 FJKXQVGLPNSAPE-QGZVFWFLSA-N 397.507 5.363 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 610778437 YFTCIGAVWOVLBS-VGOFRKELSA-N 380.451 5.048 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N2CCC[C@](C)(C#N)C2)cc1 612293711 TZMFLBLFPFUJAC-JOCHJYFZSA-N 379.460 5.035 30 20 GKED N#Cc1ccc(CNC(=O)c2sc3cc(F)ccc3c2Cl)cc1Cl 619763571 KTAYMYGLPOSBMP-UHFFFAOYSA-N 379.243 5.149 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C 620314258 XKTUUBJMAWOKEM-IYBDPMFKSA-N 392.528 5.064 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)c1cc(F)c(C(F)(F)F)c(F)c1 622288602 ISEUFGJFUZXCLC-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@](NC(=O)c1cscc1C(F)(F)F)(c1ccc(F)cc1)C(F)(F)F 622842683 LQDVPHFTJCRKDM-ZDUSSCGKSA-N 385.304 5.114 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnc(-c3ccccc3Cl)s2)n1 673813604 DQUMYPOQEBCPKQ-GFCCVEGCSA-N 387.917 5.533 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2CC2)cn1)c1nc2cc(C(F)(F)F)ccc2s1 674893625 ABMKWDWDFRKBCT-ZDUSSCGKSA-N 387.386 5.078 30 20 GKED N#Cc1ccc(NC(=S)N(CCc2ccccc2)c2ccccc2)cc1Cl 726482097 YTUDAYISAIFYMG-UHFFFAOYSA-N 391.927 5.658 30 20 GKED CCCCCCCCc1nnc(NC(=O)N[C@@H](C)c2nc(C)cs2)s1 727935352 PRCJHMLJGSRWHM-ZDUSSCGKSA-N 381.571 5.089 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 732596303 PDNLTSLIJBNXBA-WFASDCNBSA-N 388.414 5.370 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)N(CCC#N)Cc3ccccn3)sc2c1 732657678 RNHYARDVDXWLLC-UHFFFAOYSA-N 397.931 5.629 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3ccccc3C)n2)cc1 734964971 GHULWFJAQBYEOF-JXFKEZNVSA-N 390.508 5.497 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCSc2ccccc21)c1nc2cc(Cl)ccc2s1 744035810 RYWVHTHVIJONRT-KGLIPLIRSA-N 384.913 5.406 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 747194275 VWDZEZWZOZNGFY-WASHYIJTSA-N 378.419 5.565 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCOc2cccc3ccccc23)n1 747196546 MVRIXGNZMGBIOZ-GOSISDBHSA-N 378.497 5.455 30 20 GKED C[C@H](OC(=O)CCc1ccc(C#N)cc1)c1ccc(NC(=O)c2ccccc2)cc1 748011687 FFGYUHVYYILWBG-SFHVURJKSA-N 398.462 5.048 30 20 GKED C=CCC[C@@H](NC(=O)NCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1 749776206 DNLUXUZYFVXAPO-MRXNPFEDSA-N 397.828 5.261 30 20 GKED C#CCC(C)(C)C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 767044753 BYHNKVOKYRQAFL-SFHVURJKSA-N 378.903 5.119 30 20 GKED C=CCn1c(SCc2cnc(Cl)s2)nnc1-c1ccc(Cl)cc1 768228858 DOSYPLHCRIZNLI-UHFFFAOYSA-N 383.329 5.187 30 20 GKED N#C[C@@H](C(=O)Cc1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 772641207 QKBZMIFJJPTXHA-ZDUSSCGKSA-N 377.252 5.129 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 773260075 LLIMDPCKZHGLHK-NRFANRHFSA-N 387.487 5.291 30 20 GKED Cc1nc2sccn2c1C=NOCc1nc(-c2ccccc2Cl)cs1 774768499 IIQRCXSQXNFGDP-UHFFFAOYSA-N 388.905 5.032 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)s1 776910167 YAIPSPAODVHDIH-AATRIKPKSA-N 397.588 5.165 30 20 GKED CN(C)C(=O)Sc1cccc(CSc2nc(C(F)(F)F)ccc2C#N)c1 777569073 DWWNKAQBOSLSKJ-UHFFFAOYSA-N 397.447 5.038 30 20 GKED Cc1cc(C(=O)Nc2ccc(Nc3ccccc3)cc2)nn1-c1cccc(C#N)c1 779881176 IITOBRDWWOWRDC-UHFFFAOYSA-N 393.450 5.048 30 20 GKED COc1ccc(O)c(C=Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)c1 788317736 KUPUYRRYDOVDEW-UHFFFAOYSA-N 390.226 5.041 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1sc(C)nc1C 794981317 LGVVSHKQWNBVPG-UHFFFAOYSA-N 391.422 5.072 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(-c3cccnc3)noc2C)s1 795458948 XDLBSDGAPZJAHV-UHFFFAOYSA-N 399.520 5.052 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ccc(Cl)c(Cl)c2)s1 797567084 YIFHKBOTCMVCRR-LBPRGKRZSA-N 381.328 5.556 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4cccnc4)CCCC3)n2)cc1 808979654 KTNFEDXMPSNAHK-IBGZPJMESA-N 387.508 5.202 30 20 GKED Cn1cc(/C=C2\CC(C)(C)c3ccc(Br)cc3C2=O)c(C(F)F)n1 812241202 ABAZKDDXIDHNHL-UXBLZVDNSA-N 395.247 5.068 30 20 GKED COCC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 834891509 IRHHXHVUHKZDKN-QRWLVFNGSA-N 392.421 5.036 30 20 GKED CC1(C)C[C@@H](C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C(C)(C)O1 860478270 UHCGKBNKXJVDME-NEPJUHHUSA-N 396.434 5.085 30 20 GKED CC1CCN(c2ccc(NCc3cc(C#N)ccc3Br)cc2)CC1 864036219 MOUINURFJAFGLK-UHFFFAOYSA-N 384.321 5.169 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNc1ccc(F)cc1 916268005 CWLRLFUZSRRULX-UHFFFAOYSA-N 377.250 5.132 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2cc(F)ccc2s1 916903699 QQRNMSPMGILPJZ-KRWDZBQOSA-N 394.471 5.126 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(Cl)cc3)n2)cc1 916975302 XICRBHAHNVOCIH-GOSISDBHSA-N 380.900 5.581 30 20 GKED C=CCOc1ccccc1/C=C1/SC(=S)N([C@@H](C)c2ccccc2)C1=O 917643612 HMNGBOOONJBIEP-FHHIAAGZSA-N 381.522 5.214 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1 917749859 NZGROFIXTXTJSW-CQSZACIVSA-N 377.296 5.096 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cc(F)ccc2F)cc1 919713845 ISIDWLHWHCJJCC-OAQYLSRUSA-N 376.406 5.192 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(C(F)(F)F)c(Cl)c1Cl 1776031594 ODYUWNPLWQLOML-UHFFFAOYSA-N 377.149 5.156 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(-c3ccc(Cl)cc3)c2)ccc1Cl 1776034531 KZAPLZPCMRKWAN-UHFFFAOYSA-N 385.250 5.805 30 20 GKED Cc1c(NN=Cc2cccc(OCc3ccccc3Cl)c2)cccc1C(=O)O 1776086512 YVJZJUSZDGDDBB-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cs1 1776280436 KPLLXGLUECWGCA-RAXLEYEMSA-N 391.492 5.702 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3ccc(Br)cc3)o2)c1 1777686110 KVBNTBXGTCRCNB-NTMALXAHSA-N 397.224 5.303 30 20 GKED C=CCN(C(=O)c1csc(-c2ccc(F)cc2)n1)c1nc2c(s1)CCCC2 26770212 VAMVWYDRVVGMSO-UHFFFAOYSA-N 399.516 5.117 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1c(C)cc(Br)cc1C 48465349 PEFIPBJVAQCEIR-UHFFFAOYSA-N 379.323 5.348 30 20 GKED CCC[C@@H](NC(=O)NCc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 58234745 UETPHDQEXLIBSC-GOSISDBHSA-N 376.287 5.206 30 20 GKED C[C@H](C#N)Oc1ccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 93818168 XZMDGYBAXURSQH-LJQANCHMSA-N 383.495 5.204 30 20 GKED C=C(Br)CNC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 109224265 DYBNFTMXSLJCQA-UHFFFAOYSA-N 384.195 5.011 30 20 GKED C#CCN(CC(=O)Nc1c(C(C)C)cccc1C(C)C)Cc1ccc(F)cc1 109357358 IHKBTBPZLGBGIZ-UHFFFAOYSA-N 380.507 5.146 30 20 GKED CN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 126081539 GOKXBURDJRXUEF-UHFFFAOYSA-N 381.329 5.014 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)Nc1ccc(CC#N)cc1 157362304 JHBISMNFCOKKJX-UHFFFAOYSA-N 391.496 5.057 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2cc3cc(C)c(C)cc3o2)ccc1OC 174977975 CYOUBSYTNWLJII-LJQANCHMSA-N 378.472 5.029 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(COc3ccc(F)cc3)o2)n1 177762038 SECJVZZIPZPIDY-MRXNPFEDSA-N 384.432 5.068 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C1CCCC1)C(F)(F)F 184011879 BQHMYPCGLIOBKN-WBMJQRKESA-N 385.455 5.323 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)c1ccccc1 188044677 UZYGBDLQVXTPDV-ZBLYBZFDSA-N 383.557 5.422 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccn2)ccc1Cl 189890558 ACIXVMYUBZOEAC-UHFFFAOYSA-N 390.914 6.506 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CN2CCC(C)CC2)C1 191488412 IUZIZCNKZLJKKE-NRFANRHFSA-N 397.607 5.514 30 20 GKED Cc1ccc(NC(=O)C[C@@H](C)Nc2cccc(OCCCC#N)c2)cc1Cl 237441949 KGTFCBZJUKSUEX-MRXNPFEDSA-N 385.895 5.160 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccccc2CN(C)C2CCCCC2)cc1 237597310 FZBOZSXOQGIBLU-HXUWFJFHSA-N 391.559 5.032 30 20 GKED N#Cc1csc(/C=C(\Cl)c2nc(O)c3cc(-c4ccccc4)sc3n2)c1 254939874 RNUSHCMGUQOAKC-CHHVJCJISA-N 395.896 5.734 30 20 GKED Cc1nc([C@H](C)ON=CC(=O)Nc2ccccc2)oc1-c1ccc(Cl)cc1 255279411 YQEDIKQKSXFBFC-AWEZNQCLSA-N 383.835 5.006 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCC([C@H]2C(O)=Nc3cc(Cl)ccc32)CC1 329507063 HQMCTARZDVSHKL-SPLOXXLWSA-N 379.891 5.370 30 20 GKED CC[C@@H](/N=C(/O)Nc1ccc(Br)cc1C(C)C)C1CCOCC1 330500312 OAXBBOLTRLTPKF-MRXNPFEDSA-N 383.330 5.104 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc2c(c1)C(=O)CCCC2)c1ccccc1 421149383 FSRIZJSQWNGVFC-NRFANRHFSA-N 375.472 5.152 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC2CC(F)(c3cccc(Cl)c3)C2)cc1 431123058 XAITZDDASPCXAW-UHFFFAOYSA-N 385.870 5.290 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1)c1ccccc1 431330216 FZBFXYNFCJDDDV-BVSLBCMMSA-N 379.479 5.196 30 20 GKED CCS[C@H]1CC[C@@H](N(C)C(=O)c2ccccc2Sc2ccccc2C#N)C1 437113869 CEOXDZQMONPTMN-MSOLQXFVSA-N 396.581 5.456 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1c(C)noc1C 437472146 XXKBZYJGMQOZKB-QGZVFWFLSA-N 393.418 5.227 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CO)c1cccc(Cl)c1F 439375382 DFMFZLTXSFNTBZ-SFHVURJKSA-N 390.886 5.186 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)cc1 444854139 DPWZTVOUZVVORI-ZDUSSCGKSA-N 386.293 5.133 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)c(Cl)c1 455698114 FOPHHAKBYIHFJZ-INIZCTEOSA-N 385.870 5.347 30 20 GKED CSC[C@@H]1CCCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)C1 455938895 FVOVSVOGWIRCJL-MRXNPFEDSA-N 397.569 5.316 30 20 GKED CO[C@H](c1ccccc1Cl)[C@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 458670866 XOVSHALTQPQDFS-NDXORKPFSA-N 399.922 5.150 30 20 GKED CCOc1ccc(CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C(C)C)cc1 458795755 CXXSXQZZULOWKH-QHCPKHFHSA-N 393.531 5.440 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=O)N[C@H](CCCC#N)c1ccccc1 458807933 YFWXPAOFZVEVAG-LJQANCHMSA-N 390.314 5.570 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1cccc(C#N)c1 463343275 DBPWTCMRAJKBJQ-GOSISDBHSA-N 397.453 5.214 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1cccc(Br)c1 464483544 QPDLBNXRHXYDEI-HNNXBMFYSA-N 386.333 6.043 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCC[C@@H]3c3ccc(F)cc3)ccc21 469304549 HUVLSYTWILMWCH-YADHBBJMSA-N 391.490 5.157 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1nc2ccccc2[nH]1)C(C)C 471492541 SLFZEMGEBLKCRL-OAQYLSRUSA-N 376.504 5.048 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1cnccc1C)c1ccc(C(F)(F)F)cc1 474545899 FYJKJSPQYXZIED-LJQANCHMSA-N 391.437 5.258 30 20 GKED CC[C@@H](CC#N)NC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 475010847 ZCLOCJYKHASFJC-ZDUSSCGKSA-N 377.366 5.311 30 20 GKED Cc1nc2cc(Cl)c(NCc3cn(C)nc3-c3ccc(C#N)cc3)cc2s1 480300460 JLCVKYCLBDBIGT-UHFFFAOYSA-N 393.903 5.142 30 20 GKED CCc1cccc2c(C(=O)[C@H](NCc3cccc(C#N)c3)c3ccccc3)c[nH]c12 489859444 MZABSOAIINGUST-RUZDIDTESA-N 393.490 5.316 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1 493666170 KXUVYPAXPYHAGY-UHFFFAOYSA-N 392.311 5.069 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1csc(-c2ccc(OCC)cc2)n1 497805448 NNWRXZMHBXTODD-UHFFFAOYSA-N 378.497 5.037 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)CCCc1cccs1 500124682 XIUZAUHCPUHSDY-UHFFFAOYSA-N 396.325 5.187 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 503045193 AYPHTJRASAXHFR-UHFFFAOYSA-N 387.483 5.624 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@@H]2C[C@H]2c2ccccc2)cc1 509910539 RDLCBSZMILPJJD-GMAHTHKFSA-N 398.531 5.384 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H]1CCC[C@H](C)C1 510858894 GFWCPCKGDCFSNE-QFBILLFUSA-N 377.488 5.701 30 20 GKED Cc1cccc([C@@H](NC(=O)c2ccc(F)cc2C(F)(F)F)C(F)(F)F)c1 511705506 FFLZFBIIDYVRCU-CQSZACIVSA-N 379.275 5.186 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)NCC(C)(C)CCC#N 513148086 JSRNWLVOPZTOMQ-INIZCTEOSA-N 384.549 5.151 30 20 GKED C[C@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccc(C#N)cc1 516603396 HBIKZIYXDOPCQR-SFHVURJKSA-N 379.463 5.052 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4nccs4)c3)cc2)nc1 518374387 HWITVUONOVBHAL-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)cc2)n1 519979166 QPIMNAHCVSNGNI-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3cc4ccccc4o3)cc2)c1 520196929 KEUJAVAFDBWCBE-UHFFFAOYSA-N 383.407 5.418 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 520808550 IWTNYQFRDUDKLS-UHFFFAOYSA-N 384.439 5.031 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1cc(F)ccc1F 520835378 LURIHIGILPSIJW-LLVKDONJSA-N 386.389 6.162 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cc(F)ccc3Cl)c2)c1 522313587 NYKZRWXIRGGOEF-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCCC(=O)Nc2cccc(Cl)c2)n1 525111099 IQCNQHFXJQEMTE-UHFFFAOYSA-N 399.825 5.055 30 20 GKED Cc1ccc(NC(=O)[C@@H](Sc2ccc(C#N)cc2F)c2ccccc2)cc1 525503934 NTOBJQBDXCRLBP-NRFANRHFSA-N 376.456 5.478 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)c2c1 531067123 YHANBASBICLGCZ-UHFFFAOYSA-N 386.480 5.043 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3c(F)cc(Cl)cc3F)c2)cc1 539350593 KRGPREMLHAEDQR-UHFFFAOYSA-N 384.769 5.534 30 20 GKED COC(=O)c1oc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1C 541085904 RSYDRFRIWFBCPG-DLBZAZTESA-N 388.467 5.325 30 20 GKED C[C@@H](NCc1ccc([N+](=O)[O-])cc1F)c1ccc(-c2cccc(C#N)c2)cc1 543869828 GKWLUDHBIKHQSM-OAHLLOKOSA-N 375.403 5.123 30 20 GKED COCCOc1cccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 543875203 NTQKKNKFVHZMST-IBGZPJMESA-N 386.495 5.101 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cnn1-c1ccc(F)cc1 543879195 SOWSCJYONAKWKV-INIZCTEOSA-N 396.491 5.034 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(OC3CCCC3)cc2)C2CC2)cc1 544220928 CQANITQQJHPGEO-UHFFFAOYSA-N 375.472 5.076 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 554223613 BEJQKMAFVICTCN-UHFFFAOYSA-N 375.394 5.222 30 20 GKED C[C@@H](N[C@H](CO)c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 560912962 DXWVZSHCHUNZLK-QLJPJBMISA-N 395.318 5.248 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1cc2ccccc2s1 561205687 HAIIOVOGNSUNDA-CQSZACIVSA-N 381.526 5.475 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccccc1SCc1cccs1)CC2 573929915 QVHVHUGSCZJVOX-UHFFFAOYSA-N 376.506 5.115 30 20 GKED C[C@H](NC(=O)[C@H]1CC[C@H](C(F)(F)F)C1)c1ccc(-c2cccc(C#N)c2)cc1 586806317 SXMDZCDAVZFECA-GKCIPKSASA-N 386.417 5.381 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)oc2c(F)cccc12 603624265 YAGWMRJYKQNTRP-UHFFFAOYSA-N 387.370 5.192 30 20 GKED CN(C(=O)c1cc2ccccc2n1CC#N)c1ccc(Oc2ccccc2)cc1 609170157 NWTIVIIVVLBBIJ-UHFFFAOYSA-N 381.435 5.234 30 20 GKED C[C@H](S[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccc(C#N)cc1 609825804 UMOQUWILNZFRFB-UGSOOPFHSA-N 390.430 5.177 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)c(C)c2)c1 610324059 LABMEWWWNSUBSQ-IBGZPJMESA-N 399.494 5.637 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 610434272 RKGOFXHNWSVZHG-UHFFFAOYSA-N 395.450 5.231 30 20 GKED COCCOc1cccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)c1 727266721 DGTNMEAYEYPFCC-JXAWBTAJSA-N 391.492 5.048 30 20 GKED COC(=O)c1ccc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)o1 728438717 LWMSOKYFWJEZNI-ZRDIBKRKSA-N 399.855 5.056 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)cc1OC 728441385 IRXUZUQEHDJELF-NTMALXAHSA-N 383.444 5.171 30 20 GKED N#C[C@H](C(=O)CSCc1cccc(Cl)c1)c1nc2cc(F)ccc2s1 730417088 KNFDNGFSUMTIAS-CQSZACIVSA-N 390.892 5.198 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@H](C)c1ccc(C)o1 733804875 KPBNXWLZPHXXAL-UYAOXDASSA-N 397.519 5.342 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680110 QOZIKWKKROJIFM-KBXCAEBGSA-N 377.410 5.120 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1 737466346 DXBIOBMGSRKHGC-UHFFFAOYSA-N 398.393 5.547 30 20 GKED Cc1nn(-c2ccccc2)cc1CNCc1cccc(-c2ccc(C#N)s2)c1 740011257 MFXHKAAZHDKWGS-UHFFFAOYSA-N 384.508 5.071 30 20 GKED CCOc1cccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)c1 742990285 DYTPRZAQPNFORS-UHFFFAOYSA-N 387.508 5.361 30 20 GKED Cc1ccc(O[C@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 743093907 ZKLLOCQBTBENLY-DVECYGJZSA-N 399.494 5.240 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@@H](C)c3ccccc3C(F)(F)F)[nH]c12 744161928 WZDRHSHCYBCBFN-UKRRQHHQSA-N 385.389 5.260 30 20 GKED Cc1ccc(-c2noc([C@H](C)ON=Cc3ccccc3C(F)(F)F)n2)cc1F 744442255 AXROHRDSUKYXLE-LBPRGKRZSA-N 393.340 5.315 30 20 GKED CCC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)C1CCOCC1 745193719 FKWCVHHQIBNIQC-UHFFFAOYSA-N 380.517 5.271 30 20 GKED C=CCn1c(C2CC2)nn(CN(Cc2cccc(F)c2)C2CCCC2)c1=S 746064184 HKBBUJXJKFTQBU-UHFFFAOYSA-N 386.540 5.019 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)cc1 750818704 AWDAQUZMYCTGQU-GOSISDBHSA-N 398.359 5.752 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)cc1)c1ccc(-c2ccccc2F)s1 750907285 VSWAMDSIUFFJMX-JXMROGBWSA-N 375.428 5.031 30 20 GKED Cc1cc(CCC(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1Br 751824916 GAGGGCFLJPTEOM-AWEZNQCLSA-N 399.313 5.176 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 756242589 HBOVBDMIGNGYRU-MGPUTAFESA-N 385.492 5.685 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2cccc(OCc3ccccc3)c2)cc1 766227340 ZZJJIWNZODHUSN-PMACEKPBSA-N 386.495 5.407 30 20 GKED Cc1oc2ccccc2c1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 767072032 KVWWRBRIHOPHAB-QHCPKHFHSA-N 380.447 5.578 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1nc2cc(F)ccc2s1 771282929 OAILHZCSXGCHNU-HNNXBMFYSA-N 384.863 5.288 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1ccc2ccc(Br)cc2n1 771558240 XZGYGKWDGTWDAJ-UHFFFAOYSA-N 395.178 5.429 30 20 GKED C[C@@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1nc(C2CC2)cs1 774186874 FODGZXUJPNSWEN-CQSZACIVSA-N 379.485 5.197 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)C1CCSCC1 777430283 QHSOREBNUXYQSX-UHFFFAOYSA-N 386.521 5.428 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCCC(c1ccccc1)c1ccccc1 780016226 GBWDCJSDMRYKNU-IBGZPJMESA-N 399.494 5.321 30 20 GKED CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCCCC(C)(C)C#N 783080847 RYWSNBNUGISJCC-UHFFFAOYSA-N 385.291 5.219 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1nc2ccccc2s1 789451218 VJKSFNHXPZGHKV-OAHLLOKOSA-N 379.529 6.031 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1nccc2ccccc12 792101937 HLHCLZQSFAEBKG-GOSISDBHSA-N 376.406 5.201 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cn1 792886717 XIMFPXZJAVMHRL-IZZDOVSWSA-N 393.446 5.110 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(C3CC3)cnc2Cl)cc1 793169996 QHISHPHBZZZJEY-UHFFFAOYSA-N 389.842 5.529 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(OC(=O)C[C@H](CC#N)c2ccccc2)cc1 793579812 YNJYDAJOTFBLQW-SFHVURJKSA-N 394.471 5.051 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 796790652 UFQCCECDUNFXAA-PLACYPQZSA-N 380.532 5.065 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3cccc(OC(F)F)c3)cs2)cc1 797127570 MTFCJXWXQDWOTI-JXMROGBWSA-N 387.407 5.316 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2ccc(-c3ccccc3)s2)cs1 797156136 AOHPGGYQYAECPE-MDZDMXLPSA-N 382.510 5.141 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 805857440 UQCHLGZZJKWBJX-CYBMUJFWSA-N 379.312 5.729 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cnn(CC(F)F)c1 814188659 QHUIWBFOPBNHTA-FARCUNLSSA-N 393.846 5.130 30 20 GKED COc1cc(/C=C2/CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1OC 818242013 HAYKVTYSKIQRQV-MICXRRPDSA-N 399.830 5.095 30 20 GKED C[C@@H](OC(=O)CCCCC#N)c1nc2cc(Cl)ccc2n1Cc1ccccc1 848862663 POLBIFMABHWXHU-MRXNPFEDSA-N 395.890 5.426 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 857431068 GHOPRTCIDRAXGW-OAHLLOKOSA-N 393.302 5.393 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354234 XUOYWCMWEIMCBX-OXJNMPFZSA-N 375.497 5.628 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(N2CCCCC2)cc1 915985692 YIFNNWWYZGPSQY-FMIVXFBMSA-N 375.497 5.092 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3c(Cl)cccc3s2)cc1 916912837 MHGDOAIJEDBWOM-HNNXBMFYSA-N 382.872 5.078 30 20 GKED CC[C@@H](C)c1nnc(N2CCC(C)(C#N)CC2)n1Cc1ccc(C)cc1SC 1495386170 UOHQJSAMCPJKLS-QGZVFWFLSA-N 397.592 5.000 30 20 GKED O=C(O)c1ccccc1NN=Cc1nc(-c2cc(Cl)ccc2Cl)cs1 1776030420 YHBKYUCFFALSTM-UHFFFAOYSA-N 392.267 5.261 30 20 GKED O=C(O)c1ccc(NN=C(CCc2ccccc2Cl)c2ccccc2)cc1F 1776074019 CBHVNUAZIOBBMW-UHFFFAOYSA-N 396.849 5.626 30 20 GKED CC(C)(C)[C@@H]1C/C(=C/c2ccccc2C#N)c2nc3ccccc3c(C(=O)O)c2C1 1776121941 YGZYGISWVPBJAR-XLXASQRYSA-N 396.490 5.954 30 20 GKED O=C(/C=C/c1cccc(C(=O)O)c1Cl)c1ccc(Oc2ccccc2)cc1 1776126302 IRCNKAMGKAVKEM-SDNWHVSQSA-N 378.811 5.727 30 20 GKED C=C(Cl)C[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 1776142342 TWXFXWCYKMFLBR-INIZCTEOSA-N 398.261 5.265 30 20 GKED C=CCC[C@@H](CC(C)C)C(=O)Nc1cc(C(=O)O)cc(Br)c1C 1776166362 WWTXKIWVDZCXIX-ZDUSSCGKSA-N 382.298 5.023 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1c(Cl)cccc1Cl 1776785242 JSBCAGWXKHSEKH-LJQANCHMSA-N 388.379 6.582 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C/C(=O)c1csc(C(=O)O)c1 1777341939 GFUPJCYMXHMRJK-VQHVLOKHSA-N 378.449 5.326 30 20 GKED CCC[C@H]1CC[C@H](C(=O)NC2(c3ccc(NC(=O)CCC#N)cc3)CCC2)CC1 1787889434 JWASFQKREIIXDJ-WGSAOQKQSA-N 395.547 5.031 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCC(=O)Nc2cccc(C(C)C)c2)n1 10399618 MCSGRKLRQMNUAG-UHFFFAOYSA-N 393.434 5.135 30 20 GKED C=CCc1cc([N+](=O)[O-])ccc1OCC(=O)Nc1ccccc1-c1ccccc1 60738564 WKTKBGFHHIEGMG-UHFFFAOYSA-N 388.423 5.008 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 65680328 PMNQWYQEJRSRMT-UHFFFAOYSA-N 399.475 5.094 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66802212 XXLCITMHVIBYOJ-AWEZNQCLSA-N 377.469 5.297 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1nc(C(C)(C)C)cs1 66955959 XARISSVVCOPDOS-CYBMUJFWSA-N 388.562 5.157 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(-c3ccc(Cl)s3)nc2C)s1 109202884 TYHNMTBCSZOQHS-UHFFFAOYSA-N 393.946 5.581 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 158530822 QJHDMFSXRVAVEU-UHFFFAOYSA-N 389.883 5.395 30 20 GKED C=CCn1c(SCc2nnc(C(C)C)o2)nnc1-c1ccc(C(C)(C)C)cc1 170697286 CMHGGBLTXQRAGU-UHFFFAOYSA-N 397.548 5.227 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1 171895344 ULJHEJVPARXXGE-UHFFFAOYSA-N 397.478 5.430 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 183836115 SGZQDRAEAQWVGR-INIZCTEOSA-N 398.422 5.285 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(OC(F)(F)F)cc1 189882054 CHGUHOJRONZNNL-UHFFFAOYSA-N 377.406 5.618 30 20 GKED COc1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)OCCCC#N)cc1 208464869 ZSXAZDNGKXXFEY-VLGSPTGOSA-N 398.462 5.191 30 20 GKED Cc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)cc1 212530517 FGJMOMHBUTUBLM-KAMYIIQDSA-N 375.855 5.797 30 20 GKED O=C(/C=C\c1sc2ccccc2c1Cl)c1cccc(N2CCOC2=O)c1 214909551 OQDXTJQJKFBSRB-HJWRWDBZSA-N 383.856 5.407 30 20 GKED N#Cc1c(NC(=O)c2occc2CSc2ccccc2)sc2c1CCCC2 247706498 FIEVGWCVDDUQNF-UHFFFAOYSA-N 394.521 5.636 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1cccc(Cl)c1 255507962 NPQCUVVHEBJOJS-LMRWQKIVSA-N 385.801 5.365 30 20 GKED Cc1sc(Br)c(C(=O)Nc2cccc(OCCCC#N)c2)c1C 281697316 SLFDVMCWKALKRQ-UHFFFAOYSA-N 393.306 5.062 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1cccnc1 293277606 JPIPFKMUFHDDGI-BEFAXECRSA-N 380.517 5.091 30 20 GKED COc1cc([C@@H](C)Nc2snc(Cl)c2C#N)ccc1OC1CCCC1 301062412 BJDAKUMLGFFSQZ-LLVKDONJSA-N 377.897 5.171 30 20 GKED CC(=O)c1ccc(C#N)c(NCc2nc3c(s2)C[C@H](c2ccccc2)CC3)c1 302192972 CJDCFEZSOFGXAU-GOSISDBHSA-N 387.508 5.102 30 20 GKED C[C@@H]1c2c(sc(NC(=O)Cc3csc(-c4ccoc4)n3)c2C#N)CC[C@H]1C 410988960 UBAVULAXZNAPFF-NEPJUHHUSA-N 397.525 5.203 30 20 GKED Cc1oc(-c2cccs2)nc1CC(=O)Nc1sc(C(C)(C)C)cc1C#N 411007188 LZCNNKQSLHAGIN-UHFFFAOYSA-N 385.514 5.123 30 20 GKED CCCN(CC)C(=O)c1ccc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)cc1 411008677 TZIOJJDBVNSKAY-UHFFFAOYSA-N 397.544 5.042 30 20 GKED CC(=O)c1ccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 419502539 GAAKVQXVCZGIGI-OAHLLOKOSA-N 398.553 5.155 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2cc(F)ccc2F)C2CCCC2)c1 434251050 UFYXRURHDCKHRP-UHFFFAOYSA-N 386.467 5.165 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 437030093 IUSMWCLKJLAABR-PXAZEXFGSA-N 386.339 5.921 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 437359973 SONDVXREUBVNNM-NSHDSACASA-N 398.837 6.005 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(OCC2CC2)c(F)c1 438842333 OVVBWAKHWDYMQN-IERDGZPVSA-N 395.478 5.020 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438845882 FTYSMECMRBARFE-HNAYVOBHSA-N 389.421 5.453 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)CC1 441895878 YEIMCACHZFPCSP-KXXGJQBSSA-N 387.483 5.151 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 464182066 HPHYFOHXPGRLTC-LLVKDONJSA-N 393.415 5.084 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H](C)c1c[nH]c2ccccc12 469410665 VMGGSGYXJAUPCA-HOTGVXAUSA-N 377.513 5.552 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCCC4(CCC4)C3)cc2F)c1 471272461 KIBATFKTGSQBGN-UHFFFAOYSA-N 393.462 5.074 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)C[C@@H](CC#N)c3ccccc3)cc2)cs1 474701857 OMIIUBFKDDPOKY-HRAATJIYSA-N 389.524 5.383 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(F)cc1F)C1CC1 475569524 JGTBOSWSOARZAO-UHFFFAOYSA-N 384.470 6.013 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(OC)c(C(C)C)c(OC)c1 476089308 GJRGDUPAHBSKCA-UHFFFAOYSA-N 381.516 5.931 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCCC[C@H]2/C=C/c2cccs2)cc1 476667261 KCPSSXRYAUVUHI-AIGDTVQASA-N 378.541 5.647 30 20 GKED Cc1cc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)ccc1C#N 488303958 VPZNUSUKMKKAKK-QGZVFWFLSA-N 397.238 5.413 30 20 GKED COc1cc(C#N)ccc1CN[C@H](c1ccccc1Cl)c1ccccc1OC 500852277 MCUHDCTWTUBMDM-HSZRJFAPSA-N 392.886 5.108 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cccc(F)c1F 502648378 OQROEASEZBLVDH-UHFFFAOYSA-N 399.210 5.087 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 504014892 XSBGYIVOLDOCOJ-UHFFFAOYSA-N 388.511 5.040 30 20 GKED CC1CCC(N(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 509857388 ZBEWNTDAZZOLMR-UHFFFAOYSA-N 391.515 5.374 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1cnn(-c2ccccc2Cl)c1C(C)C 511370884 KHNWBGIMVZPGCU-UHFFFAOYSA-N 378.863 5.082 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccc(Br)cc2)s1 512143061 PITFBUSGBZTRRJ-UHFFFAOYSA-N 389.299 5.363 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1)[C@@H]1CCOC(C)(C)C1 514870694 SRIVUCISNVOFPW-LJQANCHMSA-N 393.487 5.162 30 20 GKED CCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 515431290 YIAYWPILWZJXQB-KRWDZBQOSA-N 382.872 5.352 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1 518016309 JREUFICKRDWBAA-UHFFFAOYSA-N 398.397 5.132 30 20 GKED C=CCn1c(SCc2nnc(-c3cccc(Cl)c3)o2)nc2ccccc21 518556243 CWJDSKXVXCKADD-UHFFFAOYSA-N 382.876 5.218 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1cccs1 519068805 XGBDDFSGQQSSGO-UHFFFAOYSA-N 375.497 5.729 30 20 GKED C=CCN(C(=O)c1cccc(OCC=C(C)C)c1)c1nc2c(s1)CCCC2 525119230 SQDNIQSRFLVPHA-UHFFFAOYSA-N 382.529 5.200 30 20 GKED C[C@H](C#N)CNC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 531800191 MMLPNZMTMFODNL-GFCCVEGCSA-N 398.825 5.101 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)cs1 538499827 OQLVPDKTMJNZHW-OAHLLOKOSA-N 387.508 5.165 30 20 GKED CCOc1ccc(-c2csc(NC(=O)c3ccc(C4(C#N)CC4)cc3)n2)cc1 538538154 TVUIFEZUMHFFPJ-UHFFFAOYSA-N 389.480 5.016 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccccc1C#N)c1ccc(-c2ccc(F)cc2)cc1 539853424 DPPIGJYETODMIZ-DLBZAZTESA-N 387.458 5.042 30 20 GKED C[S@](=O)Cc1cc(NC2CCC(C#N)(c3ccccc3)CC2)ccc1Cl 543114710 OTLZPCSVXHGWIY-MPZYELNSSA-N 386.948 5.035 30 20 GKED C=CCOc1cccnc1-c1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 546554047 GUCOPLROLWOXPR-UHFFFAOYSA-N 398.196 5.143 30 20 GKED N#CC1(N(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)C2CC2)CCC1 551287079 INBCBRUELPAQFQ-UHFFFAOYSA-N 392.311 5.168 30 20 GKED Cc1c(C(=O)Nc2cc(C(F)(F)F)ccc2F)sc2ccc(C#N)cc12 559536262 UHIUVASPUHFTMK-UHFFFAOYSA-N 378.350 5.492 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H](C)c1ccccc1F 561138588 SARRGERJPZZBJT-GJZGRUSLSA-N 388.533 5.653 30 20 GKED N#Cc1c(NC(=O)c2cscc2Br)sc2c1CCCCCC2 566641323 MKDOOSLIQAQMGI-UHFFFAOYSA-N 395.347 5.355 30 20 GKED CSc1ccc([C@@H](CNC2CCC(C#N)(c3ccccc3)CC2)N(C)C)cc1 580338114 IZCYBCDUGSIUST-SHSGKGFPSA-N 393.600 5.005 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)c1 589740880 HAUGRMIQRMSFNU-UHFFFAOYSA-N 387.483 5.444 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@]4(CCSC4)C3)c2)cc1 590815257 MGGSBEXXMHGNBN-QFIPXVFZSA-N 393.512 5.102 30 20 GKED COc1ccc(-c2nc(CNc3cccc(OCCCC#N)c3)cs2)cc1 603835281 IKVZFIQTABEYAG-UHFFFAOYSA-N 379.485 5.113 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)COc1ccc(F)c(Cl)c1 603969070 ZBBVLWGYIRKWHL-UHFFFAOYSA-N 386.835 5.097 30 20 GKED Cc1nc2ccc(NC(=O)c3ccc(Oc4cccc(F)c4C#N)cc3)cc2o1 609297546 WPXHCFBYSUXWFO-UHFFFAOYSA-N 387.370 5.192 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1csc(-c2ccccc2Cl)n1 609358426 PKEDQUAMEZPUHO-UHFFFAOYSA-N 384.892 5.144 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 609378094 RIXUZBCLELEUPV-CQSZACIVSA-N 397.500 5.396 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCCC1 609398214 KMWROGKNGPAGHU-MRXNPFEDSA-N 397.519 5.668 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 609399213 GGAYXGZKWLYZFJ-GOSISDBHSA-N 381.545 5.628 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(-c4ccccc4)nc3)cc2)c1 609427034 KOPXIGQMQIXUPP-UHFFFAOYSA-N 392.418 5.060 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)oc2c(F)cccc12 609460902 JJUQTEALIVPWRE-OAHLLOKOSA-N 377.202 5.182 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 609822946 YAJCUVRFDRALRV-CQSZACIVSA-N 381.932 5.762 30 20 GKED Cc1csc(-c2cccc(C(=O)N(Cc3ccco3)c3ccccc3C#N)c2)n1 610038787 HHYCREPROGBQLP-UHFFFAOYSA-N 399.475 5.430 30 20 GKED CC(C)(C)c1ccc(C#N)c(N2CCC[C@@H](c3nc(C(F)(F)F)cs3)C2)n1 613427860 PVULQVKDMKCVEV-CYBMUJFWSA-N 394.466 5.110 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1CN(C)c1ccccc1)c1cccc(C#N)c1 619020921 DZPRNJXSPTZKEL-GOSISDBHSA-N 384.483 5.077 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)ccn1C(C)C 645955567 MIZMYSBXZPQFJX-AWEZNQCLSA-N 391.418 5.496 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1cnc2ccccc2n1 682993823 BGEJMVQAMXKRNR-KRWDZBQOSA-N 399.837 5.566 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@@H]2c2ccccc2Cl)cc1Cl 726473579 MHNWWBQEFAWWIY-QGZVFWFLSA-N 376.312 5.399 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c(Cl)n1 727997381 ZTCYGXYPTCEKEQ-UHFFFAOYSA-N 391.858 5.055 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nc(C)cs1 729553300 NYATZLAFNDTJQP-WOJBJXKFSA-N 390.512 5.380 30 20 GKED N#C[C@@H](C(=O)C(c1ccccc1)c1ccccc1)c1nc2cc(F)ccc2s1 730416088 AGCCWRRLMAJEOL-SFHVURJKSA-N 386.451 5.444 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416170 BKCMSTCUYIXFPL-PMGRVEHTSA-N 394.471 5.502 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730417018 KQRQLQCQIKMPIN-YPMHNXCESA-N 388.851 5.041 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420761 FXOKWTUFHIRQAH-KBXCAEBGSA-N 394.471 5.130 30 20 GKED CC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCC1 731767720 GULPVQLESGMICN-ZDUSSCGKSA-N 379.312 5.873 30 20 GKED C[C@H](N[C@H](C)c1csc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCC2 732919087 YVRKSHUDQIFZLV-OLZOCXBDSA-N 395.553 5.001 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2OC2CCCC2)c1 733843150 BEZGSJGXLHLOIK-SFHVURJKSA-N 393.487 5.011 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@@H](C)Cc3ccc(Cl)cc3Cl)[nH]c12 735788550 DZUNKDZLRAANRU-SWLSCSKDSA-N 386.282 5.233 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 737477292 FUVPNTPJHGSMSC-ZDUSSCGKSA-N 377.362 5.075 30 20 GKED COc1ccccc1[C@H](C)CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739598234 FOPFPMZERQMAFD-MRXNPFEDSA-N 390.508 5.105 30 20 GKED CS[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 740536378 RZMPBMYNMVAHSZ-VQIMIIECSA-N 398.940 5.744 30 20 GKED O=C(/C=C/c1cnn(-c2ccc(Cl)cc2)c1)c1cccc(-c2ccncc2)c1 741473144 MLVKJLOSCBPBQD-RUDMXATFSA-N 385.854 5.484 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc1OCC 741843361 FITWAIGEPSKYFG-ALCCZGGFSA-N 390.892 5.133 30 20 GKED CCOc1cccc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 745267863 AKGQDTVQGKBHQY-UUOWRZLLSA-N 399.494 5.623 30 20 GKED CN(C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)C1(C#N)CCC1 746163560 PBZCPNCHPSLLFZ-UHFFFAOYSA-N 394.474 5.452 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccc(O)cc2)n1 746237407 DQAUJVZDYUIUGD-CYBMUJFWSA-N 395.509 5.020 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1cccc(OCC#N)c1 746664268 XLZFOJUHKZTYSA-GFCCVEGCSA-N 378.259 5.121 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)sc21 752046802 COQLIAYLYVFDQJ-CTNGQTDRSA-N 399.519 5.305 30 20 GKED C[C@H](Sc1ncc(C(C)(C)C)s1)C(=O)N(CCC#N)c1ccc(F)cc1 759719306 KMIRTXXDGVOXGW-ZDUSSCGKSA-N 391.537 5.007 30 20 GKED Cc1nn2c(C=NNCc3ccc(-c4ccccc4)cc3)c(C(C)C)nc2s1 766712034 MOUNCEDKSUROTE-UHFFFAOYSA-N 389.528 5.013 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(CC)cc2)n1 767700722 HURRCOXNPGZSQB-HNNXBMFYSA-N 386.517 5.036 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc3ccsc23)cc1 767960417 RCVCCJCGPYIUND-AUUYWEPGSA-N 376.481 5.376 30 20 GKED O=C1/C(=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCc2nc(O)ccc21 769609050 GHGPPECIXHPDGG-BJMVGYQFSA-N 387.279 5.037 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(-c4ccncc4)s3)cc2)c1 779594627 KXQNIEGOYQHROZ-UHFFFAOYSA-N 398.491 5.268 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2)cc1 779725461 FHMUDHFEHHDOIG-MRXNPFEDSA-N 389.480 5.579 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1 780393653 ZAGRKSBOZUEBKU-MRXNPFEDSA-N 388.311 5.001 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC1(c2c(Cl)cccc2Cl)CC1 780669343 CAWAABWVZYGHDC-LBPRGKRZSA-N 390.270 5.095 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(Br)c1 792105220 UBEZLMRNYVQGIG-SFHVURJKSA-N 393.284 5.151 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](F)CC3CCCCC3)n2)cc1 796662038 ONIFMVCJGNAUPU-ZWKOTPCHSA-N 386.492 5.303 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@H](OC2CCCC2)c2ccccc2)s1 797568696 LINZISAGMFJTAP-YLJYHZDGSA-N 382.529 5.317 30 20 GKED C[C@@H](Nc1ccc(N2CCCCCC2)cc1)C(=O)Nc1ccc(C#N)c(Cl)c1 799289643 GQOGXYCJASSSBY-MRXNPFEDSA-N 396.922 5.031 30 20 GKED C=CCC[C@@H](C(=O)N1CCC([C@H](O)c2ccccc2C)CC1)c1ccccc1 804515456 JWZRNTOJVDAWDK-RPWUZVMVSA-N 377.528 5.017 30 20 GKED CSCC(C)(C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 810533088 VCCVOCVYAZHUJX-GFCCVEGCSA-N 399.368 5.682 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(-c2cccc(Cl)c2)no1 848603806 SOVSHIFPVZQUEP-HNNXBMFYSA-N 390.871 5.040 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)[C@H](F)c1ccc(C(F)(F)F)cc1 857434188 ZNRFOKXBFUIXMQ-CQSZACIVSA-N 395.274 5.296 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3ccc(Cl)cc3[N+](=O)[O-])c2)cc1 864010565 FSQZMCFYEONVFE-UHFFFAOYSA-N 379.803 5.524 30 20 GKED Fc1cccc(F)c1C(F)(F)c1nc(-c2ccsc2C(F)(F)F)no1 904922882 MAZSSPVYFDNSIQ-UHFFFAOYSA-N 382.260 5.235 30 20 GKED N#Cc1cccnc1Oc1ccccc1NC(=S)Nc1ccc(Cl)cc1 916001045 UEXHCDHKGAXORP-UHFFFAOYSA-N 380.860 5.208 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047320 WVHKXKXMYBSFKQ-BBRMVZONSA-N 398.915 5.718 30 20 GKED CCN(CC(=O)[C@H](C#N)c1nc2ccccc2s1)Cc1ccc2ccccc2c1 920089383 PPKLDHOBRSECDS-FQEVSTJZSA-N 399.519 5.148 30 20 GKED Cc1c(NN=C(CCc2ccccc2Cl)c2ccccc2)cccc1C(=O)O 1776087314 UTHYZTOZPQMFBJ-UHFFFAOYSA-N 392.886 5.796 30 20 GKED O=C(O)c1cc2ccccc2c(C=Nn2c3ccccc3c3ccccc32)c1O 1776113084 WHXZSGCUFCRTIC-UHFFFAOYSA-N 380.403 5.234 30 20 GKED CC(C)[C@H]1/C(=C\c2c(F)ccc3sc(C(=O)O)cc23)C(=O)c2ccccc21 1776308576 FJELGCTUKHTWEX-RIMDVYMRSA-N 380.440 5.758 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1ccc(OCc2occc2C(=O)O)cc1 1776665963 PHAODDFMAUBHIK-PJMHOZITSA-N 388.419 5.015 30 20 GKED CCN(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776855533 VPONMCWFIYNFEP-SXGWCWSVSA-N 399.490 5.333 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccsc3)cc2)CCC1 1786944396 ZAMNYWRTMKZION-SCBHQAGPSA-N 394.540 5.108 30 20 GKED C=CCn1c(SCC(=O)c2ccc3ccccc3c2)nnc1-c1ccccc1C 9592974 XDCIGIINDMIHBV-UHFFFAOYSA-N 399.519 5.568 30 20 GKED CCOc1ccc(NC(=O)[C@@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)cc1 15336580 DGQFZBFUKJXLOW-QGZVFWFLSA-N 386.451 5.030 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 66956027 SPDHXFLIAFMQIJ-JSGCOSHPSA-N 388.562 5.379 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 71948250 ULYSIAILXGLAHV-SFHVURJKSA-N 380.900 5.663 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@@H](C(=O)N1CCCCC1)c1ccccc1 108407402 NWUDCIOWUFNOGR-XMSQKQJNSA-N 393.556 5.104 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCCC(=O)c1ccccc1 108463556 UZHKUDQXXIKOQV-QGZVFWFLSA-N 380.513 5.320 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(Cl)cc1Cl 109002682 NNEOGLLKHJSGLA-GFCCVEGCSA-N 394.327 5.438 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)cc2)C(C)(C)C)cc1OCCCC#N 120007921 BSHQGKIEAMFSOE-JOCHJYFZSA-N 384.495 5.394 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 128381715 VGOHQMPQMBZSHW-AWEZNQCLSA-N 392.446 5.686 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 153995743 XRKGIKHMECFBGD-MSOLQXFVSA-N 381.545 5.484 30 20 GKED N#C[C@H](NC(=O)c1c(F)cccc1Cl)c1ccc(OCc2ccccc2)cc1 157674147 LBAFIGYNTFYBNJ-FQEVSTJZSA-N 394.833 5.053 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1cccc(Cl)c1 172349323 WQIKFZHLMJYEEG-CQSZACIVSA-N 387.817 5.239 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)nn1C 173309042 RNUQXMOKMOWWCY-GOSISDBHSA-N 392.890 5.105 30 20 GKED COc1ccc(CN[C@H](c2cccc(F)c2)C(C)(C)C)cc1OCCCC#N 178614605 RSXNZNBXVNGOMN-JOCHJYFZSA-N 384.495 5.394 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)ccc1OC 180815353 SPZJGUSVPXNDCF-KSSFIOAISA-N 392.421 5.246 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cs1 187004201 MMAUIVJKETVLNF-OAQYLSRUSA-N 389.480 5.093 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNCc1cn(CCC#N)nc1-c1ccccc1 188909992 GUELESVMASBUGI-UHFFFAOYSA-N 398.432 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cnn(Cc2ccccc2)c1 191456100 BOCVMHQVCLCVGK-UHFFFAOYSA-N 388.515 5.105 30 20 GKED CC(C)Oc1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)c(C(F)(F)F)c1 236718619 JGTLBGGXCMFLQC-HNNXBMFYSA-N 392.421 5.073 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@H]4CCCC[C@@H]4C)no3)C2)c1 329547106 AYMWZCFADOAUIM-LNLFQRSKSA-N 382.508 5.097 30 20 GKED CCN(Cc1ccccc1Br)C(=O)Nc1ccc(C#N)cc1Cl 426141097 BTWSHYBSZYBSDC-UHFFFAOYSA-N 392.684 5.028 30 20 GKED CO[C@@H](c1ccc(F)cc1)c1noc(-c2sc3ccc(C#N)cc3c2C)n1 426418734 XUTONQADLYPBAG-KRWDZBQOSA-N 379.416 5.006 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C[C@H]1CCCO1)C1CCCC1 428889445 RWZAXFQAPUWWOM-SJLPKXTDSA-N 387.549 5.036 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Cl)c(C(F)(F)F)c2)s1 430602064 KJQVODBTZHCNDO-SNVBAGLBSA-N 386.826 5.603 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3ccc(F)cc3C2)cc1 434207632 FZGGDZQILPCIAH-UHFFFAOYSA-N 387.414 5.080 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 438377095 WESMMLZWYFOSCK-SFTDATJTSA-N 377.488 5.168 30 20 GKED C=CCn1c(SCc2ccc(C#N)cc2Cl)nnc1-c1ccccc1F 438814903 OOZIFDCJNKIXCL-UHFFFAOYSA-N 384.867 5.088 30 20 GKED N#Cc1ccc(C2(C(=O)N3CCC(c4ccc(C(F)(F)F)cc4)CC3)CC2)cc1 440737962 TWLYTHVLDYAGKT-UHFFFAOYSA-N 398.428 5.015 30 20 GKED N#CC1CCC(CNCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 441329049 JSIYNTNAZZKZOU-UHFFFAOYSA-N 381.907 5.012 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H](Oc3ccccc3Cl)C2)cc1 443820587 AMODCYOFDGYRNY-SFHVURJKSA-N 397.906 5.216 30 20 GKED N#Cc1cc(F)ccc1CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444740783 XVZMYBBNBRQEAG-MRXNPFEDSA-N 390.302 5.499 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3csnn3)n2)o1 450834547 DIMDNQFLANTHQC-VIFPVBQESA-N 396.419 5.245 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)cc1 458850464 UMWCNUJZNRACOR-UPVQGACJSA-N 375.516 5.103 30 20 GKED CC(C)CN(C(=O)c1cc2cc(C(F)(F)F)ccc2n1C)c1ccc(C#N)cc1 463563729 QGDPYERGLDVGLW-UHFFFAOYSA-N 399.416 5.372 30 20 GKED COc1cc(CNc2cccc(Oc3ccc(C#N)cc3)c2)c([N+](=O)[O-])cc1F 464088645 HJCZFMVTKVZWNM-UHFFFAOYSA-N 393.374 5.019 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 464881527 UDOURALUBWXWPM-GHTZIAJQSA-N 380.513 5.097 30 20 GKED Cc1oc2ccccc2c1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 467333247 BREBLBPYUSKEKS-AWEZNQCLSA-N 379.485 5.457 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)Nc2cc(C#N)ccc2C)cc1 473334305 OOYQYUYJKLQXBB-KRWDZBQOSA-N 385.467 5.425 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1SC(C)C 476513539 PLQARJUGERZBHQ-UHFFFAOYSA-N 386.565 5.575 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1nccc2ccccc12 483242812 VCBLSKONDNDNOB-QGZVFWFLSA-N 387.826 5.342 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc4nc(-c5ccccc5)oc4c3)[nH]c12 483631912 CAVFTJQPWBISNL-QGZVFWFLSA-N 392.418 5.170 30 20 GKED N#CCCC[C@@H](NC(=O)CCn1ccc2cc(Cl)ccc21)c1ccccc1 487220623 PDXQYSUSMYIOKE-HXUWFJFHSA-N 379.891 5.236 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(CCc2ccccc2)n1)c1ccccc1 487368376 FFKLJOMJMKZZCU-FQEVSTJZSA-N 389.524 5.093 30 20 GKED N#Cc1cc(F)ccc1CSCc1csc(COc2ccc(F)cc2)n1 488538079 CRBJITNCBQJEPU-UHFFFAOYSA-N 388.464 5.305 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1 503188262 HGZJGPNQVIUHSK-UHFFFAOYSA-N 392.462 5.621 30 20 GKED CCN(C(=O)c1cccc(OCc2cccs2)c1)[C@@H](C)c1ccc(C#N)cc1 509569701 GXKLHHQATJAOIW-KRWDZBQOSA-N 390.508 5.422 30 20 GKED O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513520427 VBCAJZKUQVQLKE-CYBMUJFWSA-N 383.307 5.039 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4c(F)cccc4[nH]3)c2)cc1 515576939 CJRQZDGNHXADAL-UHFFFAOYSA-N 399.425 5.204 30 20 GKED C=CCCO[C@@H](C)C(=O)N(Cc1cccs1)c1ccc(Br)cc1 519080424 CPGLQQLAEPATAJ-AWEZNQCLSA-N 394.334 5.025 30 20 GKED N#C[C@H](NC(=O)CCCCCc1cccs1)c1cccc(C(F)(F)F)c1 520271488 SHBJMQPKAMXRRQ-KRWDZBQOSA-N 380.435 5.251 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccc(F)cc3F)cc2)c1 524249089 UIFCMLUDCCZHNC-UHFFFAOYSA-N 379.366 5.059 30 20 GKED CCC[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 535850155 KVFTVRJPIBXRCD-HNNXBMFYSA-N 382.460 5.286 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 537406243 FATSDOCNEWLOBJ-FYSMJZIKSA-N 392.449 5.480 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 539660170 JTGPMEULFSCIAY-VQTJNVASSA-N 394.540 5.033 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)NCc1ccc(-c2ccccc2C#N)cc1 557342117 GFYBEFBQNUZXOB-UHFFFAOYSA-N 398.510 5.230 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1C 565076664 JQFXDXXVXGSCQS-GOSISDBHSA-N 393.556 5.894 30 20 GKED Cc1ccc([C@H](NC(=O)CSc2cccc(F)c2C#N)c2cccs2)cc1 566047608 ZHRUPJZSRUFMGM-NRFANRHFSA-N 396.512 5.065 30 20 GKED Cc1sc(C2(NCc3ccc(C#N)cc3)CCC2)nc1-c1ccccc1F 568904744 LGMHWJCUVJZOTL-UHFFFAOYSA-N 377.488 5.298 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cccc(F)c3Cl)c2)cc1 574483341 KVYUFSMUQYDQBU-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c2[C@H](C)C1 579445961 MWJTWTJXGICOLO-ZIAGYGMSSA-N 388.496 5.015 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c(F)c1 581031530 HAXFHOPZAUPMMQ-UHFFFAOYSA-N 379.435 5.124 30 20 GKED COc1ccc(CN(C(=O)CCCCCC#N)[C@@H]2CCCC[C@H]2C)cc1OC 588953914 OOABNQXFTJDTFI-UYAOXDASSA-N 386.536 5.085 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2F)n1)c1nc2cc(F)ccc2s1 592973988 LXKLNADDEABEAK-GFCCVEGCSA-N 397.431 5.188 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccncc1 596736974 XTRPOCIMHDZEHP-OXJNMPFZSA-N 392.528 5.235 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C 606940831 MUJFWHYHQNIYTC-UHFFFAOYSA-N 379.504 5.457 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1csc(C(C)(C)C)n1 608803826 BQCSJZDYROUDOL-UHFFFAOYSA-N 392.484 5.060 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)CC(C)(C)c1ccccc1 608918187 OSSLYFASAPCHOZ-LJQANCHMSA-N 377.532 5.235 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609080384 HRGFKCRBQDMBIM-LBPRGKRZSA-N 385.370 5.131 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609428567 UTMFDIFNRGMATR-LSDHHAIUSA-N 388.920 5.449 30 20 GKED N#C[C@@H](NC(=O)C1CC(c2cccc(F)c2)C1)c1ccc(Cl)c(Cl)c1 609460546 NWSQKJIVARFKKK-WTNGLUPJSA-N 377.246 5.007 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)CCCCOc2cccc(C#N)c2)cc1 609504973 SKTBZPIHGCLNOG-SFHVURJKSA-N 396.556 5.485 30 20 GKED O=C(Cc1cccc(C(F)F)c1)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 622572394 HAOVLDONPKUATG-UHFFFAOYSA-N 395.274 5.426 30 20 GKED CSc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 642282190 SIRNHRPAICZTCA-ZDUSSCGKSA-N 392.427 5.527 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)NC3CCCCC3)cc2Cl)c1 727977954 CUXLTUHPDOHCOD-UHFFFAOYSA-N 399.947 5.410 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)c2nc(-c3ccccc3)oc2C)c1 728185586 MBWJLWINHPBFQJ-UHFFFAOYSA-N 382.419 5.071 30 20 GKED Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 730130689 GYHVCRBQQMCETP-DNQXCXABSA-N 381.479 5.460 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccccc2SCCC#N)c(Cl)c1 730953053 LINVYQWCBRKISP-UHFFFAOYSA-N 375.950 5.772 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)nc2ccccc12 731332520 NLFFWNHXDAIHRV-ZDUSSCGKSA-N 381.888 5.535 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccccc2Oc2ccncc2)cc1Cl 731943431 ZCSNDMIOCQFSFB-UHFFFAOYSA-N 380.860 5.208 30 20 GKED CCCN(C(=O)/C=C/c1ccccc1C#N)[C@@H](c1ccc(F)cc1)c1cccnc1 732085541 LJPMAGPLRPEQOD-MYILAFDMSA-N 399.469 5.134 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2coc3ccccc23)cc1 734059971 KZARHQBXQXHSHC-JOCHJYFZSA-N 381.435 5.410 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3ccccc3F)n2)cc1 739157838 XIDKGJZJUQWWEE-YJBOKZPZSA-N 378.472 5.313 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c(Cl)c1OC 741471586 BMCJSGNRIZIRGU-SOFGYWHQSA-N 379.843 5.315 30 20 GKED N#CCOc1cccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)c1 741841371 GCNKVLUEMDRDHS-WTKPLQERSA-N 377.387 5.139 30 20 GKED Cc1ccc(-c2noc([C@H](C)ON=Cc3ccccc3OC(C)C)n2)cc1F 744442695 DYYAWHJHVAUTSC-HNNXBMFYSA-N 383.423 5.083 30 20 GKED COc1ccc(OCc2ccccn2)c(C=NNc2cccc3ccccc23)c1 747060602 ZUVIJNYREKOCBM-UHFFFAOYSA-N 383.451 5.268 30 20 GKED C[C@H](OC(=O)/C=C/c1ccccc1C#N)c1ccc(NC(=O)c2ccccc2)cc1 748015419 SRYGWIHERYTQEZ-QCUIPMNBSA-N 396.446 5.128 30 20 GKED Cc1cc(CCCC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)c(C)s1 753397031 XHHYGDWVNXUVQC-HXUWFJFHSA-N 390.508 5.188 30 20 GKED CC(C)c1ccc(C2(O)CCC(=NNc3oc(C(C)C)nc3C#N)CC2)cc1 753923038 BCTTXXYKBIHSKS-UHFFFAOYSA-N 380.492 5.023 30 20 GKED C=C[C@H](CC(=O)Oc1ccc(NC(=O)c2ccsc2)cc1)c1ccccc1 759009652 NZJPYSJPIKODES-MRXNPFEDSA-N 377.465 5.266 30 20 GKED CCCc1c(NC(=O)c2ccccc2SCC#N)cnn1-c1ccc(C)cc1 762649915 ABYUGDDXMMLPJO-UHFFFAOYSA-N 390.512 5.001 30 20 GKED CCCOc1cccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 770143935 ATDKXFMBDUAJIX-DEOSSOPVSA-N 384.479 5.312 30 20 GKED Cc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 775226588 GNWBOGLOFYKKBB-CQSZACIVSA-N 391.279 5.437 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc3c(c2)N(C(=O)NCC)CC3)cc1 777697858 WZUJBOMGEWMLOS-MRXNPFEDSA-N 399.922 5.083 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=S)Nc1ccc(SC(F)F)cc1 779727947 QQUDYBPZLKJZNW-LLVKDONJSA-N 379.457 5.101 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)c1 783044743 URYYOAXNVLRMJC-RXQFDZFGSA-N 381.501 5.140 30 20 GKED N#C[C@@H](C(=O)CN(Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 792103297 KVRRSWLSBFJNOX-DEOSSOPVSA-N 391.474 5.118 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 792230219 VMLWTQYVMZHMPH-HRAATJIYSA-N 387.487 5.462 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568931 YCYPZNDRGVCHQY-FZMZJTMJSA-N 378.950 5.451 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)cc2)cs1 799601418 YEISLIHIGHRPGV-GOSISDBHSA-N 399.475 5.114 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)s1 802250312 QNXLCEUWCGTYII-TZMCWYRMSA-N 384.398 5.346 30 20 GKED C[C@@H]1CCC[C@@H](c2noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)C1 848605730 ROSSGZUNIHLQGM-OAGGEKHMSA-N 376.501 5.013 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 915179165 AQRHWJWVSLGZNS-LJQANCHMSA-N 391.814 5.156 30 20 GKED C[C@@H](NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 916000811 TYHUOZZVWXJCHA-QGZVFWFLSA-N 387.508 5.185 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCSc3ccccc3)n2)cc1 916628099 LRRZTXWGGMTJNS-SFHVURJKSA-N 378.522 5.477 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)/C=C/c2cccc(F)c2)cc1 918629639 LPEZBBLHOZJHAO-VAWYXSNFSA-N 388.417 5.079 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1sc2ccccc2c1Cl 920105576 HRTSQSUKPCFBIS-CQSZACIVSA-N 392.867 5.550 30 20 GKED CCOc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 920111369 VAQPUJOFFOCFGT-HXUWFJFHSA-N 390.508 5.326 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 920142590 LNIUKDQDVVFLOV-IFXJQAMLSA-N 389.455 5.191 30 20 GKED C#CCCOc1ccc(/C=C2/SC(=S)N([C@@H](C)c3ccccc3)C2=O)cc1 920472945 POZGTYCWUVUNPC-WLVMFVESSA-N 393.533 5.051 30 20 GKED N#C[C@H](COC(=O)c1occc1CSc1ccccc1)Cc1ccc(F)cc1 920877223 YINVZBNKHPAVDN-QGZVFWFLSA-N 395.455 5.250 30 20 GKED CC(=NNc1ncc(Cl)cc1Cl)c1sc2ccccc2c1C(=O)O 1776022054 KKBCONLKXSNQDM-UHFFFAOYSA-N 380.256 5.137 30 20 GKED O=C(O)c1cc(NN=C2CCC(c3cccc(C(F)(F)F)c3)CC2)ccc1F 1776063080 ZODLXLLSULMSAW-UHFFFAOYSA-N 394.368 5.668 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)o2)cc1 1776125805 SWNVXTTVMRCBPK-ZNOBWPMYSA-N 382.456 5.623 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776473411 FNXFQDDZYSUCQV-JLVNDZCYSA-N 396.386 5.047 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3ccccc3s2)c2cc(C(=O)O)oc12 1777360769 MOMFUBWKWRVSMT-VURMDHGXSA-N 378.405 5.250 30 20 GKED N#CCCCOc1cccc(/C=C/c2nc(C(=O)O)c(-c3ccccc3)s2)c1 1777566306 IFIOBRJWGAPTQK-VAWYXSNFSA-N 390.464 5.361 30 20 GKED O=C(O)c1cccc(/C=C/C(=O)c2ccccc2Oc2cccc(Cl)c2)c1 1777685356 PEADQNQXGYWMKE-VAWYXSNFSA-N 378.811 5.727 30 20 GKED C=CCc1cc(C(=O)Nc2ccc(-c3csc(C)n3)cc2)cc(OC)c1OC 16236883 IHHWNWYNMAQTQD-UHFFFAOYSA-N 394.496 5.117 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc(F)c(Cl)cc3Cl)n2)cc1 17342023 XSXBRAYKLOBYQS-UHFFFAOYSA-N 392.242 5.380 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1cccc(Br)c1 25174729 OAQKLKZZSQBKHN-VAWYXSNFSA-N 394.268 5.319 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccn1 43181763 MLYDBENZAPBHQQ-HNAYVOBHSA-N 390.874 5.273 30 20 GKED N#C[C@@H](C(=O)CCSc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 51533369 VHLSLYRTPRWMEP-KRWDZBQOSA-N 382.485 5.308 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2sccc2C2CC2)cc1 60354641 MTZVDMZTWZZWBY-UHFFFAOYSA-N 390.464 5.550 30 20 GKED CC(C)(NCc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 67011470 VILPFTGLBCRUTJ-UHFFFAOYSA-N 376.422 5.413 30 20 GKED CCCCCOc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 78671261 PKENSKIOEGBIEB-KRWDZBQOSA-N 382.529 5.760 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 109028523 RXVVPECTQOHKQU-UZLBHIALSA-N 395.528 5.458 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)Nc1ccccc1SC[C@H](C)C#N 129446015 LHDLTOXQZAGIFO-CQSZACIVSA-N 392.484 5.546 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)c1 175627543 GPAIVBDGEGOQQM-UHFFFAOYSA-N 393.899 5.198 30 20 GKED COc1ccc(/C=C(\C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1F 183861552 JHALGWNYFVKOSW-MFYHJKBNSA-N 384.476 5.128 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1ccccc1 188036711 ZFASPPVVGBEEFP-QDPGVEIFSA-N 389.520 5.293 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2o1 189962447 RTGALYAFSBACHO-HUUCEWRRSA-N 379.485 5.567 30 20 GKED C=CCn1c(-c2cccnc2)nn(CN2CCC[C@H]2CC2CCCCC2)c1=S 303036039 YLOSWCZALWCDKM-FQEVSTJZSA-N 397.592 5.054 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 303338166 LBEPYPGJLJSAPV-QZTJIDSGSA-N 396.556 5.919 30 20 GKED CC1CCC(/N=C(/O)[C@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)CC1 328678430 BEBRRIJDSFMOKP-VELDQMPNSA-N 383.536 5.008 30 20 GKED OC(=Nc1csc(-c2ccccn2)n1)C1CCC(/N=C(/O)C2CCCC2)CC1 329471252 ZIVDXESKKGYLOM-UHFFFAOYSA-N 398.532 5.499 30 20 GKED O/C(CCc1nc(C2CCCC2)no1)=N/[C@H]1COc2c1ccc(Cl)c2Cl 330001294 XTWPYJKTHJJKOB-ZDUSSCGKSA-N 396.274 5.057 30 20 GKED O/C(CC1CCCCC1)=N/C1CCC(/C(O)=N\[C@@H]2CCOC3(CCC3)C2)CC1 330179873 FOXYFNNCMWRUIU-SOAGJPPSSA-N 390.568 5.530 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)Cc1csc(-c3ccoc3)n1)c2C#N 410983307 PQEMCYONEICRGB-NEPJUHHUSA-N 397.525 5.203 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 425667397 CXOTVLFIHFZKFT-YVEFUNNKSA-N 395.812 5.218 30 20 GKED CC(C)OCc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)oc2ccccc12 430589975 GNTFMYHKNDOMJC-HNNXBMFYSA-N 396.512 5.602 30 20 GKED CC1(C)Cc2ccc(Cl)c(NC(=O)N[C@@H](CCC#N)c3ccccc3)c2O1 435326772 JXDSZPAERXASIJ-KRWDZBQOSA-N 383.879 5.220 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccnc1 437459459 JEEVUXZJPUVLCF-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CCCn1ccc2ccc(NC(=O)Nc3cccc(OCCCC#N)c3)cc21 438294351 JWBABHUDZHQBSE-UHFFFAOYSA-N 376.460 5.378 30 20 GKED N#CCC[C@@H](NC(=O)N1Cc2ccccc2-c2ccccc2C1)c1ccccc1 438865642 RXZVMUHPGJHAHF-XMMPIXPASA-N 381.479 5.424 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@H](C)c2ccc3cc(OC)ccc3c2)n1 439276848 PXTRCTLNPPMNNB-CQSZACIVSA-N 392.480 5.145 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2ccccc2Sc2ccccc2)nc2ccccc21 442608759 WNKDLAHCCOZIDA-SFHVURJKSA-N 383.476 5.215 30 20 GKED CCCN(C(=O)c1ccc(C#N)cc1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 461536521 NHAIAILSEBCBAG-HSZRJFAPSA-N 387.458 5.043 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1cccc(C#N)c1 462219732 OGAQJVCNPONZMA-CQSZACIVSA-N 377.831 5.141 30 20 GKED C=CCOCCCC(=O)N(Cc1c(OC)ccc2ccccc12)C1CCCC1 463476111 OQCFHMLJBQATQD-UHFFFAOYSA-N 381.516 5.102 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c2ccccc2n1 464400371 HKIQFWCZTHOGQG-MRXNPFEDSA-N 383.373 5.262 30 20 GKED CCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@H](Cc1ccc(F)cc1)C(C)C 465672011 XQGOIGAIQPOFOO-HTAPYJJXSA-N 381.495 5.057 30 20 GKED C[C@H](N(Cc1ccccc1)C(=O)Nc1ncccc1OCCCC#N)C(C)(C)C 466623491 RFEAFFWPTLRDCR-SFHVURJKSA-N 394.519 5.233 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@]1(C)CCCS1 467915285 CPQGIMRKCYUIIZ-NRFANRHFSA-N 381.501 5.066 30 20 GKED COc1cc(C)c([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1C 469226999 LHEAHYRBZVSFHO-SFHVURJKSA-N 391.515 5.068 30 20 GKED C=CCCC1(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)CC1 474916009 SQWVOASNTQOQNQ-KRWDZBQOSA-N 377.488 5.254 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1 475457773 PBUPSSHLILWSPS-QGZVFWFLSA-N 391.858 5.553 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccccc1-n1cccn1 475553238 OAWJMEXNQYNDDA-SFHVURJKSA-N 388.515 5.607 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1 477475726 YJYZKGBMRYTSBH-UHFFFAOYSA-N 395.506 5.962 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2ccn(C3CCCC3)n2)cc1F 477586145 BHUFOTREIHKLFX-UHFFFAOYSA-N 376.435 5.413 30 20 GKED C[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc(C#N)cc1 479498634 DMMSJIVJKGBAMA-MRXNPFEDSA-N 383.476 5.072 30 20 GKED CC(C)CN(C(=O)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCCc2cccnc21 479956100 JOLGJAITFHFDSY-IBGZPJMESA-N 382.895 5.174 30 20 GKED C[C@H](CC(=O)Nc1nc(-c2cccc(C#N)c2)cs1)c1c[nH]c2ccccc12 486304379 KTQINBURABCYPZ-CQSZACIVSA-N 386.480 5.295 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(F)ccc2F)nnc1-c1ccc(C)cc1 489631743 UHEOSYKVNXXMDK-AWEZNQCLSA-N 399.466 5.081 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1cccc(OCc2ccccc2)c1 499734699 NTENIGHGHAVFPQ-HXUWFJFHSA-N 378.516 5.017 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC2CC(c3ccccc3)C2)cc1 500930268 IEJSZZZDDWSWIG-UHFFFAOYSA-N 398.531 5.527 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 505364514 RCOINOIGQCSSSK-OPAMFIHVSA-N 389.886 5.361 30 20 GKED N#C[C@H](NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1)C1CC1 505916476 CZGCGBRJLGTSHN-SFHVURJKSA-N 396.899 5.410 30 20 GKED C[C@@H](NC(=O)c1ccncc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 506998169 WJDFJFCTHZUQLS-CQSZACIVSA-N 395.384 5.130 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)CC1 508367977 JLCFTSBGLBTOSS-MRXNPFEDSA-N 399.844 5.145 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Sc3nc(-c4ccccc4)ccc3C#N)o2)cc1 510174036 XAAQQIJAQBCMHV-INIZCTEOSA-N 398.491 5.832 30 20 GKED N#CC1(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)CCCCC1 512983398 QMACCCPSBYZJLO-UHFFFAOYSA-N 396.335 5.047 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)o2)cc1 513187310 XYKIVRWJADUABE-MRXNPFEDSA-N 398.340 5.053 30 20 GKED N#C[C@@H](C(=O)c1ccccc1N1CCCCC1)c1nc2cc(Cl)ccc2s1 513665921 IJOWGMYQTAELHL-INIZCTEOSA-N 395.915 5.430 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nc1 514639862 SFLCFQIANSMOQA-MRXNPFEDSA-N 381.888 5.472 30 20 GKED CSC[C@](C)(C#N)NC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 518003072 YGOSWHMBYZRGTL-SFHVURJKSA-N 395.311 5.161 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(F)cc(Br)c1 518662803 QZORYHJHNBBXQW-NSHDSACASA-N 393.281 5.092 30 20 GKED COc1ccc2c(CC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)coc2c1 519125525 OVXIFNRRHDXXRX-UHFFFAOYSA-N 398.418 5.287 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 519519544 UQCLSCRYZVSACN-NRFANRHFSA-N 398.915 5.801 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(OC(F)F)c3)cc2)cc1 519977166 OACXSHJZEPIIFU-UHFFFAOYSA-N 380.350 5.204 30 20 GKED CC(C)(C)[C@@H](Cc1ccccc1C(F)(F)F)NCCCC1(C#N)CCOCC1 521944051 FQFNLIGHAODPFN-LJQANCHMSA-N 396.497 5.353 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCc3sccc3C2)c1 522574405 VZLBPZXAPRUGRM-UHFFFAOYSA-N 394.883 5.264 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(OCc2ccccc2C#N)c1 524512290 NUOTULZYDBLEQD-CYFREDJKSA-N 396.490 5.155 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(Cl)cn1 527178648 MCKRZWIBYLJBJN-HNNXBMFYSA-N 391.858 5.084 30 20 GKED Cc1sc([C@@H](C)NC(=O)Cc2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 531038590 KVJCGMJFQPTZGH-CYBMUJFWSA-N 395.915 5.064 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 537945847 AMNYRRUNEXNWKN-XXBNENTESA-N 379.548 5.918 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)cc1 538406509 ILJBETXBBASJOV-QMHKHESXSA-N 376.887 5.660 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 539049437 JEJYLGAQFIXPJU-APWZRJJASA-N 391.496 6.019 30 20 GKED CC(C)C[C@H]1C[C@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 539660169 JTGPMEULFSCIAY-UXHICEINSA-N 394.540 5.033 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccn(Cc2ccccc2)c1 541007201 RCPDEJQMLRYEPN-KRWDZBQOSA-N 375.497 5.183 30 20 GKED COC(=O)c1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1F 541086169 NVIHPHUXUSMLIF-MRXNPFEDSA-N 388.442 5.002 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C(F)(F)F)ccc1F 554185654 NQQGKJJAKPNPEY-UHFFFAOYSA-N 398.404 5.232 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCc1cccc(Cl)c1Cl 558460813 PVUNSCORWPVFRF-UHFFFAOYSA-N 395.334 5.059 30 20 GKED CC(C)[C@H](NC(=O)N1CCC(CCC#N)CC1)c1cccc(C(F)(F)F)c1 572597223 CNYNIGKPYPQYKE-SFHVURJKSA-N 381.442 5.128 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 573641171 FEIKVFDDMMYVML-OXJNMPFZSA-N 397.544 5.704 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cccc(-c4ccccn4)c3)cc2)ccn1 576152638 QUHVKDUKTZEGSW-UHFFFAOYSA-N 378.435 5.420 30 20 GKED CC(C)(C#N)c1ccc(CNC(CCC(F)(F)F)CCC(F)(F)F)cc1 594989533 UNUFVMROMOBUAG-UHFFFAOYSA-N 380.376 5.631 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CSc1cccc(C(F)(F)F)c1 603527408 NDHUIJZYBUJNJJ-UHFFFAOYSA-N 392.446 5.106 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 604480865 ZIMPOOSQQZKTLH-SNVBAGLBSA-N 399.566 5.490 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176582 RSIVIMAXNOMCPG-KRWDZBQOSA-N 386.451 5.491 30 20 GKED CCC1(C)CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)CC1 609208405 IMYWFEKFKMLQRV-UHFFFAOYSA-N 395.478 5.320 30 20 GKED Cc1ccc(C)c(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609371621 OVBPMPXZMLPCOV-KRWDZBQOSA-N 384.570 5.570 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)o1 609461068 XXVBZIYUKJJOJI-JDSLSITLSA-N 377.271 5.023 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ncoc2-c2ccccc2)cc1F 610313333 LYXIEIDXFXXAEG-UHFFFAOYSA-N 399.381 5.397 30 20 GKED CCn1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c2ccccc21 613314250 GJYAJDVVHLDCQW-GOSISDBHSA-N 385.492 5.583 30 20 GKED Fc1ccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1C(F)(F)F 678296545 FYVGHCZMPBSTKT-UWVGGRQHSA-N 383.229 5.017 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c1-c1ccccc1 683105835 FZIBQZSZASHARX-IBGZPJMESA-N 380.451 5.169 30 20 GKED CN(c1ccc(CNCc2cccc(OCCCC#N)c2)cc1)C1CCCCC1 726797733 URHFDSITUOKYHE-UHFFFAOYSA-N 391.559 5.428 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccc(Cl)cc3)cc2)c1 727980428 KUHXUPVETNMMHA-UHFFFAOYSA-N 393.899 5.600 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc1Cl 730417358 MZGODMPFQYXMQV-BXUZGUMPSA-N 388.851 5.041 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc([C@@H]2C[C@@H]2C)o1 732764713 VGLGAFQEMBYMHE-SUMWQHHRSA-N 389.480 5.032 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2-c2cccs2)c1 733843820 WFOJJTUOCVQSFT-KRWDZBQOSA-N 391.496 5.418 30 20 GKED FC(F)(F)COc1ccc(NN=C(CC2CCCCC2)c2ncccn2)cc1 733901373 MCXHXCBKSZYJPL-UHFFFAOYSA-N 392.425 5.204 30 20 GKED N#C[C@H](C(=O)/C=C\C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 735593382 KOTHSCSGAQMYDU-CNNWTFKKSA-N 388.467 5.263 30 20 GKED C[C@H](Cc1ccc(Cl)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 736448785 VXBFRALVXRVXAO-GFCCVEGCSA-N 378.328 5.125 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc(C)cc1 739153923 GNUUTAAQGYWINT-YOEHRIQHSA-N 386.854 5.019 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2c(C)nc3sc(C)cn23)cc1 741470075 QAEOUNOGZPPMPP-SEYXRHQNSA-N 388.492 5.584 30 20 GKED Cc1c(Cl)cccc1NC(=S)N(Cc1ccccc1)c1ccccc1C#N 745723697 FHVIHPYSSBUYDI-UHFFFAOYSA-N 391.927 5.924 30 20 GKED O=C1/C(=C\c2c(Cl)nc3sccn23)COc2c(Cl)ccc(Cl)c21 748584346 QZXQLIMEZVCTAS-ALCCZGGFSA-N 385.659 5.015 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)cc1 754320199 OUZBJNBADCSYKD-CYBMUJFWSA-N 399.878 5.050 30 20 GKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1c[nH]c2ncccc12 761811083 CJAQEQNSQKJZBT-DAXSKMNVSA-N 393.786 5.281 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1cccc(C(=O)c2ccccc2)c1 762040484 PWPPSEBSORZJGY-OXQOHEQNSA-N 394.430 5.039 30 20 GKED C[C@H](C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1cccc(Cl)c1 764749927 DBFLIKGADLBMIW-ZETCQYMHSA-N 398.677 5.158 30 20 GKED C[C@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccc(F)cc1 764752829 WUMMBBWMNUILIB-MRVPVSSYSA-N 396.249 5.034 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3ccc(C#N)cc3Cl)c2c1 769737591 QONJZUWOGGVYBQ-UHFFFAOYSA-N 398.853 5.383 30 20 GKED Cc1nc(-c2ccc([C@H](C)N[C@@H](C)c3ccc(OCC#N)cc3)cc2)cs1 776153658 CAGKOTGUQBWTBK-HOTGVXAUSA-N 377.513 5.433 30 20 GKED C[C@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccc(OCC#N)cc1 776157406 AXXSQOUMCLNVQB-XDHUDOTRSA-N 392.449 5.502 30 20 GKED N#Cc1cc2c(nc1NC(=O)c1ccc(-c3ccc(F)cc3)cc1F)CCCC2 776348560 ARVMZXAFSYUNDZ-UHFFFAOYSA-N 389.405 5.030 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2nc3cc(Cl)ccc3n2C)cc1 779073838 QYGYLYFUTWIANO-CQSZACIVSA-N 390.314 5.209 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3ccc(C)cc3)n2)cc1 779195174 SAQIMZYOQHNLLZ-OXJNMPFZSA-N 390.508 5.182 30 20 GKED CCOC(=O)Nc1ccc(NCc2csc(-c3ccc(C)cc3)n2)cc1C#N 779603296 RUBCVVDTLYZNPX-UHFFFAOYSA-N 392.484 5.171 30 20 GKED N#Cc1ccc(CNc2nc(C3CC3)nc3scc(-c4ccccc4)c23)nc1 780613209 VUFMWVHPJCNSHU-UHFFFAOYSA-N 383.480 5.114 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccc2ccccc2c1)C1CC1 780681824 PYZZNVFQCDPIGW-KRWDZBQOSA-N 385.467 5.327 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)O[C@@H](c1ccccc1)C1CCCCC1 782847862 SXZZUSFHEXYZLF-DEOSSOPVSA-N 393.531 5.211 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)n1 793165502 XWLYGNVPKZQNFW-JXFKEZNVSA-N 390.508 5.577 30 20 GKED C[C@@H](OC(=O)c1ccc(C#N)o1)c1ncc(-c2ccc(Cl)cc2Cl)o1 796148960 UFXGRJKEKKMRSN-SECBINFHSA-N 377.183 5.031 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)Nc1ccc(C#N)cc1Cl 796826252 KWNQLFMZIOVIQV-UHFFFAOYSA-N 385.851 5.119 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)Cc2coc3ccc4ccccc4c23)s1 797568070 OGRKQVJVSBASBC-QGZVFWFLSA-N 388.492 5.759 30 20 GKED CC(C)n1c(C(F)(F)F)nc2cc(C(=O)OCC(C)(C)CCC#N)ccc21 798877796 GKRVCOZOLRQPGI-UHFFFAOYSA-N 381.398 5.123 30 20 GKED COc1ccc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1CN1CCCCC1 800990464 PKPMCDNHDLIDQL-QGZVFWFLSA-N 397.950 5.057 30 20 GKED C[C@@H](OC(=O)c1cscc1C#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 814615585 NJKVEWHBSOUPJP-SECBINFHSA-N 393.251 5.500 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c2C#N)CC[C@H]1C 839390774 KLFJSANOIJUXTD-ZJUUUORDSA-N 389.864 5.119 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)CCCCC#N)c23)cc1 841611520 VXQCZPDFWRMTKE-UHFFFAOYSA-N 379.489 5.239 30 20 GKED CCC1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCC(F)(F)CC1 850771741 YDGKSNVBMKFNNR-GFCCVEGCSA-N 382.863 5.732 30 20 GKED N#Cc1ncc(C(F)(F)F)cc1NC(CCC(F)(F)F)CCC(F)(F)F 853872998 ONNMBYKLIAHQRK-UHFFFAOYSA-N 393.253 5.438 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1 856372635 NMFRRXSRTZYHBA-UHFFFAOYSA-N 398.528 5.872 30 20 GKED Cc1ccccc1CO[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 860478587 CMPSVGPACYOULO-XJKSGUPXSA-N 384.888 5.040 30 20 GKED Cc1cc(C#N)cc(C)c1C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 906069574 IRVDLSJNAHXXKB-UHFFFAOYSA-N 379.460 5.083 30 20 GKED N#CCOc1cccc(NC(=O)COc2ccc(Cl)cc2C2CCCCC2)c1 916410720 ISRFKYOZOCRJQP-UHFFFAOYSA-N 398.890 5.308 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2ccc(F)cc2s1 920102070 ORJJRRRORAIUGI-HNNXBMFYSA-N 376.412 5.036 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776038641 VUOLZVJWSPHPFB-UHFFFAOYSA-N 378.516 5.742 30 20 GKED O=C(O)c1cc2c(C=NNCc3c(Cl)cccc3Cl)c(F)ccc2s1 1776065516 ZJEJJNCYLXZAMW-UHFFFAOYSA-N 397.258 5.169 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(OCc2ccccc2C)cc1 1776074213 OGNPRJKNCLQILC-UHFFFAOYSA-N 392.430 5.247 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2)cc1 1776125589 MPBLWJHSVGBRFQ-QJKHOBJASA-N 380.484 5.876 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CCCCCCC)CC(=O)O)cc1 1776786595 ZDXUDSWGRNWGTA-QFIPXVFZSA-N 391.596 6.329 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@@H](C(=O)O)C23CCC3)cc1 1776787483 COIDRQJYLZJUCL-IBGZPJMESA-N 389.561 5.219 30 20 GKED CSCc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1777401448 BWJUKRWIDINITB-WDZFZDKYSA-N 378.449 5.404 30 20 GKED Cc1c(/C=C2/COc3ccc(C(C)C)cc3C2=O)nc2ccccc2c1C(=O)O 1777414152 DZDKEFJTQHEXDE-WJDWOHSUSA-N 387.435 5.024 30 20 GKED C=CCn1c(SCC(=O)Nc2c(C)cc(C)cc2Cl)nc2ccccc21 4492770 KVNRIWBMUHZWDB-UHFFFAOYSA-N 385.920 5.223 30 20 GKED C=CCOc1ccc(C(=O)Nc2nc(-c3ccc(C)s3)cs2)cc1OC 11516874 AXGHHXWFHUYUJS-UHFFFAOYSA-N 386.498 5.006 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCCSc1ccc(F)cc1 15533515 TYMZLKXHFZHUPR-UHFFFAOYSA-N 390.483 5.277 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2ccccc2F)cc1 55011581 TUWOUQXIJMKPNN-UHFFFAOYSA-O 393.507 5.035 30 20 GKED CCCCC[C@@H](C)n1c(SC[C@H](C#N)CCC#N)nc2ccccc2c1=O 66400047 DBILMCKESRXKOE-SJORKVTESA-N 382.533 5.073 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1csc2ccccc12 66954779 KHIVHELLSYYYRH-OAHLLOKOSA-N 395.553 5.959 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCO[C@@H](C)c1ccccc1 108531608 CMUNQGPWMGLFHW-ROUUACIJSA-N 397.544 5.228 30 20 GKED CC(C)CCO[C@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 109195687 JIIHDFLQEUCLAE-UZLBHIALSA-N 384.907 5.385 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(C#N)cc2)ccc1OCc1ccc(F)cc1 128058700 XITVXMRXTCMLMR-KRWDZBQOSA-N 390.458 5.136 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C)C(C)(C)C#N 131155519 SOAUBOPJSPCHGW-QWHCGFSZSA-N 392.908 5.098 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cc(F)ccc3Oc3ccccc3)o2)cc1 133744500 IIYXRGUOZCLJRV-UHFFFAOYSA-N 386.386 5.152 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccco1 150974290 KFXPRHSWNBEZIR-SJLPKXTDSA-N 383.517 5.823 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 155159382 VGZGMHHYNSOSTQ-BDJLRTHQSA-N 399.903 5.438 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)cc1 171028365 PMWPXZOQZPXJNT-UHFFFAOYSA-N 388.471 5.093 30 20 GKED C[S@@](=O)Cc1ccc(Cl)c(NCc2ccc(-c3ccccc3C#N)cc2)c1 174877017 CIWDJAUUNVLYFJ-HHHXNRCGSA-N 394.927 5.369 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)n1 177770001 DFFOMPIVYLTRKZ-CYBMUJFWSA-N 391.418 5.267 30 20 GKED CCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(C#N)c(Cl)c1 179529520 LEKOBKARHOIKRP-UHFFFAOYSA-N 385.832 5.001 30 20 GKED Cc1ccccc1Cc1nnc(CSc2ccc(C#N)c(C(F)(F)F)c2)o1 180390862 WLYZUGZDVWGDDW-UHFFFAOYSA-N 389.402 5.152 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 181572468 JMNFKOTYYANMQF-FOIQADDNSA-N 379.504 5.953 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCCN1C(=O)OC(C)(C)C 188073440 GIFURLFIZWNISO-SFHVURJKSA-N 386.536 5.267 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cccc(OC)c2CC1 193694284 YGSJFMDOEGIPDU-UHFFFAOYSA-N 378.516 5.180 30 20 GKED COc1cc(O[C@H](C)c2nnc(-c3ccc(Cl)cc3Cl)o2)ccc1C#N 194489622 BOOUUXZHUGWISV-SNVBAGLBSA-N 390.226 5.064 30 20 GKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(OCC(F)(F)F)cc1 301307783 VZOCCGHOSHCUAU-JTQLQIEISA-N 389.299 5.086 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccccc1N1CCCCCC1 330245115 DOYZZITZULBCJQ-QGZVFWFLSA-N 399.560 5.362 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)c3cccc(SCC#N)c3)cc2)cs1 429916431 AMPJMVATUALFGF-AWEZNQCLSA-N 393.537 5.225 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)Cc2ccccc2O1 432771703 YOKUDEKQVBPVIX-KRWDZBQOSA-N 399.450 5.166 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccccc1 435114576 UJVMCMKGUPPKAW-SFTDATJTSA-N 394.515 5.258 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F)c1ccccc1 458803410 REYZXIGUTKSDQX-FGZHOGPDSA-N 397.469 5.637 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458804740 SVLIGBIFBSZZAK-SJLPKXTDSA-N 392.528 5.434 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@H](C)c1cccc(C#N)c1 462035463 WESSCYCFPWXKBA-QGZVFWFLSA-N 388.442 5.327 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1c(C)oc2ccccc12 464559540 VEZIDLSDCUKOBL-UHFFFAOYSA-N 397.434 5.290 30 20 GKED C[C@]1(c2ccccc2)CC[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C1 469267512 QTGHLLFQFMIMFX-RDGATRHJSA-N 387.527 5.192 30 20 GKED CCC1(CC)Oc2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2O1 470545757 HUZXOOXGTUDGGA-GOSISDBHSA-N 379.460 5.141 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCOC1 475575768 SNDBSJGIOWONHI-IRLDBZIGSA-N 378.516 5.438 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)COc1ccccc1OC 475578852 QZRABVRNAXYIBE-SFHVURJKSA-N 396.531 5.384 30 20 GKED C=CCC(CC=C)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1 475857814 PAJGNQALZQJAJC-UHFFFAOYSA-N 381.438 5.091 30 20 GKED COc1cccc(-c2ccc(CNC(=O)C[C@H](CC#N)c3ccccc3)cc2)c1 476136213 FJLVYFMCMWBBIU-QHCPKHFHSA-N 384.479 5.066 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477539638 HFFGSYLMXVVURZ-CQSZACIVSA-N 389.421 5.731 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2nccc3ccccc23)s1 483237327 VMJMUTUYERDBJI-IBGZPJMESA-N 383.476 5.465 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 485769735 CACMHYALKGRSJC-UHFFFAOYSA-N 378.472 5.273 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 497588081 BYWXUBKYFZYPQT-HXUWFJFHSA-N 388.433 5.096 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3sccc3C#N)cc2Cl)cc1 497988047 GHVZVALXYTYZSW-UHFFFAOYSA-N 379.828 5.189 30 20 GKED CC(C)(C(=O)Nc1ccc(Cl)c(C#N)c1)c1csc(-c2cccs2)n1 501575219 LBQCPONNDHQRDO-UHFFFAOYSA-N 387.917 5.313 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Nc2cccc(C)c2C)cc1 502478635 RHALBYOLSWBQEL-UHFFFAOYSA-N 387.439 5.620 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@@H]1c1cccc2ccccc12 503081182 ATWMJUPTSGXUCT-FGZHOGPDSA-N 393.408 5.130 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C2(c3ccccc3)CC2)cc1 505686933 YBEOETNVKKNACC-UHFFFAOYSA-N 384.435 5.029 30 20 GKED CC1(C#N)CCN(Cc2ccc(OCc3ccccc3)c(Br)c2)CC1 507708853 NVPNUTLGEZDWNU-UHFFFAOYSA-N 399.332 5.154 30 20 GKED Cc1cccc(C2=CCN(Cc3cn(CCC#N)nc3-c3ccccc3)CC2)c1 507714272 OBVIGPNHCMIZRI-UHFFFAOYSA-N 382.511 5.062 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2ccccc2)CCC1 511578952 UDUICXAYNBEZAV-UHFFFAOYSA-N 382.463 5.719 30 20 GKED N#Cc1c(NC(=O)c2cc3c(s2)-c2ccccc2CC3)sc2c1CCC2 514607825 RWOLOQPUXPGDMR-UHFFFAOYSA-N 376.506 5.188 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4ccccc4s3)n2)cc1 516270313 RLRRSBLKJUNYOX-MRXNPFEDSA-N 385.473 5.387 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517338787 IGEUADDKEKVDPP-GOTSBHOMSA-N 384.435 5.101 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCCc1cccs1 519433693 AKOHENCBEHUCNG-UHFFFAOYSA-N 398.475 5.734 30 20 GKED C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 520117758 INGZHKXYWSQMHR-VXGBXAGGSA-N 390.961 5.583 30 20 GKED C=CCN(C(=O)c1cccc(-c2nc(C)cs2)c1)c1nc2c(s1)CCCC2 523511027 QDGGLARROXWRIY-UHFFFAOYSA-N 395.553 5.287 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N(C)Cc3cccc(C#N)c3)c2)c1 523614008 XUYKHNDKUSDLHC-UHFFFAOYSA-N 385.467 5.110 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(CC#N)cc1 535472624 OGOHGWSRUPXZNV-UHFFFAOYSA-N 389.402 5.030 30 20 GKED COc1ccccc1[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccccn1 537953870 KXGAZDUOYOCBAN-DOTRQFKVSA-N 397.522 5.173 30 20 GKED C=CCSc1ccccc1NC(=O)CN[C@H](CC(F)(F)F)c1ccccc1 538176258 IWBGEPCFUWZFKZ-QGZVFWFLSA-N 394.462 5.187 30 20 GKED N#CCC1CCN(CC(=O)Nc2ccccc2Sc2ccc(Cl)cc2)CC1 541019830 KNCIHIWANXIVJS-UHFFFAOYSA-N 399.947 5.055 30 20 GKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)oc2c(Br)cccc12 541068062 QTLAIYHBCCOJCN-UHFFFAOYSA-N 389.636 5.281 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)[C@@H](Oc1ccccc1C#N)C(C)C 544461391 KXULFJXIVHNTPY-QFIPXVFZSA-N 394.515 5.306 30 20 GKED N#CC1(c2ccc(-c3nc(Cc4csc(-c5ccccc5)n4)no3)cc2)CC1 544916519 CONPUCFRXSTDPL-UHFFFAOYSA-N 384.464 5.006 30 20 GKED N#Cc1ccc(C(=O)Nc2ncccc2OCc2cccc(Cl)c2)cc1Cl 548287595 WRVHQTZBEOSUGV-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#CCCn1cc(/C=C/c2nc(Cc3cc4ccccc4o3)no2)c2ccccc21 560048681 XKOFGORPRDUVSR-ZHACJKMWSA-N 394.434 5.445 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC(C)(C)c1ccccc1 560167172 XXMAYVIUBQVRQI-UHFFFAOYSA-N 399.494 5.503 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 567316172 XCTTYFRIZQSDSP-GOSISDBHSA-N 398.466 5.075 30 20 GKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1nc(-c2cccs2)no1 574209412 LQTJVXZDXAAGCG-ZDUSSCGKSA-N 389.440 5.030 30 20 GKED C[C@@H](C(=O)N(Cc1ccccc1)c1ccccc1C#N)c1ccc(F)c(F)c1 576274802 VHKZLHUPSBHSOX-MRXNPFEDSA-N 376.406 5.173 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)C[C@@H](C)C[C@@H]4C)ccc12 577597992 FMGSJIXEFSZRJB-AAEUAGOBSA-N 391.496 5.120 30 20 GKED CC(C)n1c(Cc2c[nH]c3ccccc23)nnc1N(C)[C@H](C)c1cccc(C#N)c1 580063207 OVYDIFCLIJUMSD-QGZVFWFLSA-N 398.514 5.000 30 20 GKED COc1ccc(CN2CCC(=Cc3cccc(F)c3)CC2)cc1OCCCC#N 582030592 YOCBKOHMOQSPEI-UHFFFAOYSA-N 394.490 5.196 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)F)cc3)n2)cc1 588348929 HZGGHWNJOMWAPK-INIZCTEOSA-N 384.407 5.246 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2CC1(c1ccccc1)C2 596734575 HGIDFWCTMDDFEW-CSZIGFGKSA-N 377.513 5.234 30 20 GKED Cc1cc(Br)ccc1[C@@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1 599706805 NJMNXLFUGMERAJ-IBGZPJMESA-N 398.304 5.193 30 20 GKED FC(F)c1noc(CSCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 600634742 ZWLUIQORBVFWLL-UHFFFAOYSA-N 392.271 5.478 30 20 GKED N#Cc1ccnc(SCc2csc(-c3ccc(Br)cc3)n2)c1 603725044 JSSUDVBMIWFNFW-UHFFFAOYSA-N 388.315 5.132 30 20 GKED Fc1cc2ncc(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)nc2cc1F 605568748 UBRYMNROEXULIH-YUMQZZPRSA-N 399.285 5.229 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cc3c(s2)-c2ccccc2CC3)c1 609068413 QSKJISYDEDGKSF-UHFFFAOYSA-N 396.418 5.239 30 20 GKED Cc1sc(NC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)c(C#N)c1C 609296244 OCYUGOXAZABGOJ-IBGZPJMESA-N 396.512 5.848 30 20 GKED CC(C)CCN(CCC(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609437024 LNBZVWCSPVKGRT-SFHVURJKSA-N 375.582 6.007 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCSc1ccccc1 609438061 ANFZFRUQCZTNOR-MRXNPFEDSA-N 385.558 5.385 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 609773682 QRIHKZBQIMSOIR-IBGZPJMESA-N 383.879 5.369 30 20 GKED CC[C@H](CC(=O)N[C@H](C#N)c1ccc(Br)cc1)c1ccc(C)cc1 609986492 ZHEOWEWVUWGELF-DNVCBOLYSA-N 385.305 5.022 30 20 GKED CCSCc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 610179011 MRXDCUDRTXCWKY-UHFFFAOYSA-N 392.480 5.236 30 20 GKED COc1ccc([C@H](NCc2ccccc2C#N)c2ccccc2Cl)c(OC)c1 610259069 GGEXYOVNKJXQBN-HSZRJFAPSA-N 392.886 5.108 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cncc(-c4ccccc4)c3)cn2)c1 610706094 BZKDNLLVSWHZPB-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CC[C@H](c3ccco3)C2)cc1Cl 611185622 FSZHUNRFLFVTFE-KRWDZBQOSA-N 392.842 5.227 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 613402020 ZXKGXOKWBMXZCK-KRWDZBQOSA-N 397.425 5.346 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccccc1OC(F)F 622571698 FDIYTWQCQHJKAH-UHFFFAOYSA-N 397.246 5.161 30 20 GKED FC(F)Oc1ccc(NN=Cc2c(-c3ccccc3)nc3sccn23)cc1 726427167 RVEYBJMZPWQEPE-UHFFFAOYSA-N 384.411 5.110 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@H]2c2nc3ccccc3s2)cc1Cl 726439678 HTYCTNPMPYXJQW-INIZCTEOSA-N 398.944 5.355 30 20 GKED CC(C)C[C@@H](C)CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 727953360 GMTAEZAWTOJLPN-MJGOQNOKSA-N 378.472 5.199 30 20 GKED O=C1/C(=C\c2csc(-c3ccc4c(c3)OCO4)n2)CSc2ccc(F)cc21 728439321 HJXCIJBUKISOKU-XGICHPGQSA-N 397.452 5.050 30 20 GKED COC(=O)CCSCc1cccc(N=Cc2c(O)ccc3ccccc23)c1 728785450 GTJPFMSEALVIMA-UHFFFAOYSA-N 379.481 5.092 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2)CCCC1)c1nc2cc(F)ccc2s1 730422401 XHHZSHFCSFKSPN-MRXNPFEDSA-N 382.435 5.263 30 20 GKED CC(=NNc1nccnc1Cl)c1c(F)cccc1O[C@@H](C)c1ccccc1 733079588 OBZXXAKUTXJJDT-AWEZNQCLSA-N 384.842 5.245 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@@H](C)c1ccc(C)o1 733804872 KPBNXWLZPHXXAL-AZUAARDMSA-N 397.519 5.342 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 734706312 CHKHCTMOBHZQCO-LPHOPBHVSA-N 392.911 5.760 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(N2CCCC2)cc1 739483522 OFGPYMZYNNCLKZ-UHFFFAOYSA-N 390.405 5.123 30 20 GKED O=C1/C(=C\c2ccc(OCc3occc3C(=O)O)cc2)Cc2cc(Cl)ccc21 742438243 UNLZDQFCQGJUKG-DHDCSXOGSA-N 394.810 5.033 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744036919 KARZFBFBDRHGBQ-MAUKXSAKSA-N 378.472 5.394 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)c2sc3cccc(F)c3c2C)cc1C#N 752192609 BQPASCDUFJVRLW-UHFFFAOYSA-N 397.431 5.041 30 20 GKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)c1ccccc1SCC#N 766531523 QKOVUZWSFMRVIH-ZIAGYGMSSA-N 392.446 5.243 30 20 GKED CCCCN(C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 770109000 BZGZRQZTYXVEJM-KRWDZBQOSA-N 396.441 5.158 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)cc1 772617055 KNIYQACIAWXVIT-HXUWFJFHSA-N 392.842 5.066 30 20 GKED N#CCOc1ccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2Cl)cc1 772960177 UALYYBXZLIIQKH-HSZRJFAPSA-N 394.877 5.455 30 20 GKED COc1cccc(C(=O)/C(=C\c2cc(C)c(OC(F)F)c(C)c2)c2ncc[nH]2)c1 776433259 DPYKQAIIVJIDNT-WOJGMQOQSA-N 398.409 5.060 30 20 GKED CCOc1cc(/C=C2\CCc3ncc(C(F)(F)F)cc3C2=O)cc(Cl)c1O 777468733 XELJYBOSEHBPIC-VZUCSPMQSA-N 397.780 5.071 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(=O)/C=C\c3scnc3C3CC3)c12 782324025 WSPAPHXHAQBDSD-KHPPLWFESA-N 388.496 5.013 30 20 GKED CC(C)(SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 783631644 GLZDPGSQKSFBSJ-GOSISDBHSA-N 392.549 5.655 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3ccccc3SCC#N)c2C(C)C)cc1 791189745 CQNNVAQAXKHPJM-UHFFFAOYSA-N 390.512 5.172 30 20 GKED CC(C)[C@](C)(NCc1ccc(OCC#N)cc1)c1ccc(Br)cc1 792344830 LPZDWSKNLWFANQ-FQEVSTJZSA-N 387.321 5.012 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 796650728 NTIRKHPZVBZQIZ-MRVWCRGKSA-N 396.434 5.087 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797567289 GACLKHIHWUUYTN-MAUKXSAKSA-N 384.545 5.599 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(C3SCCS3)cc2)s1 797569048 MSYDJMGTMJEFFX-CQSZACIVSA-N 388.583 5.409 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)[C@@H](C)Cc2cncc3ccccc23)c1 808365287 PJXPGZHLIKBKLV-IBGZPJMESA-N 394.474 5.221 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 813091379 ZKRPCZMHYJXIPZ-SIKLNZKXSA-N 378.859 5.168 30 20 GKED Cc1ccccc1[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)C1CCCC1 813862917 YSCFSNYKVROCOC-RUZDIDTESA-N 389.543 5.171 30 20 GKED CSc1ccc(CCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 842690265 RCYMZMDKZFZQGL-MRXNPFEDSA-N 399.466 5.352 30 20 GKED CC(C)(C)NC(=S)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 843278205 YHAKUXTYRXCMHZ-UHFFFAOYSA-N 376.341 5.061 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 916135339 SZBWRJIIXQUBEY-JYOAFUTRSA-N 388.354 5.294 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)COc2c(Cl)cc(Cl)cc21 917146268 XUEOPVVUTMRWPT-NSIKDUERSA-N 383.234 5.109 30 20 GKED O=C(O)c1cc(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)ccc1F 1776063048 YGCXOBLOEMBKLZ-LBPRGKRZSA-N 380.341 5.278 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776697204 AHKYRSHICXPASI-HMVFGEFZSA-N 390.435 5.760 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc2cc(Br)ccc2o1 1776783052 WGNNHDIPSPIUSV-MRXNPFEDSA-N 396.325 5.489 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(NC(=O)OC(C)(C)C)cc1 1776783908 LHZAKKFVIUOPSL-LJQANCHMSA-N 392.540 5.327 30 20 GKED CCOc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776937470 XERBZRNZIKDQBC-ZRDIBKRKSA-N 378.449 5.408 30 20 GKED COCc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1777232288 GJHJGIYFHGYKJY-NTEUORMPSA-N 386.447 5.023 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc3nc(C(F)F)sc13)C2=O 1777682963 ISZNAJPJQWGDBZ-ZRDIBKRKSA-N 399.418 5.535 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3csc(-c4ccccc4)n3)c2c1 1777683954 GWPNSJVECJHEMM-SOFGYWHQSA-N 391.473 5.619 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)OCc3ccc(C#N)cc3)cs2)cc1 9555096 CRAXTCSCAXMPMP-UHFFFAOYSA-N 376.481 5.091 30 20 GKED Cc1cc(C)c(C(=O)/C(=C(/S)Nc2ccccc2F)[n+]2ccccc2)cc1C 41465986 AQFDRWWUDDNMAR-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2OCc2ccccc2Cl)n1 41519958 QTPSXSHNMRKCLH-INIZCTEOSA-N 382.872 5.174 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@H]2CCc3ccccc32)cc1 48161663 FUGICYZAWRENMU-DEOSSOPVSA-N 397.478 5.141 30 20 GKED N#C[C@@H](C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1ccc2ccccc2n1 48857346 QTZCLAJCNBHTIX-OAQYLSRUSA-N 397.478 5.244 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(OC(F)F)cc1 108238030 QSHHXEARCJEJBV-AWEZNQCLSA-N 390.455 5.111 30 20 GKED C=CCN(C(=O)c1cnc(C(C)(C)C)s1)c1nc(-c2ccccc2)cs1 108987661 SXDCEZZZSCEJNB-UHFFFAOYSA-N 383.542 5.397 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H](C)c1c(C)n[nH]c1C 119121447 GDCLGDMLDALHMP-OAHLLOKOSA-N 388.471 5.131 30 20 GKED C=C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 120031400 CEUSBZJEYOKMOY-XLIONFOSSA-N 383.476 5.218 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3ccccc3F)n2)cc1 122012810 VPDCSUSPJLPLHJ-RDTXWAMCSA-N 394.471 5.013 30 20 GKED COc1ccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c(C)nc2c1 122375195 QDTVVAYCAPZTJR-IBGZPJMESA-N 399.475 5.165 30 20 GKED N#CCC[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccccc1 130485451 WBLQNVGKVMPIGD-IBGZPJMESA-N 384.405 5.026 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C1CCC(F)(F)CC1 132211177 TXOVENORTZBCHJ-UHFFFAOYSA-N 392.393 5.475 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 132820629 JIRXWBVIOLHRFL-VQIMIIECSA-N 390.512 5.215 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccc(F)cc1OCC#N 135248491 LMCMZDLYKANPDZ-NSHDSACASA-N 396.249 5.260 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 153967458 LWVBRUCREOMMNW-MSOLQXFVSA-N 381.545 5.342 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccccc3SC[C@@H](C)C#N)c[nH]c12 155018908 GVNNAKXHXZPSGC-HNNXBMFYSA-N 377.513 5.299 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 161422996 ZUYHAOYNMLVYCP-LBPRGKRZSA-N 376.268 5.157 30 20 GKED CC[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(C)cc1 181683007 KDWAJDBOSXAJIN-HKUYNNGSSA-N 381.545 5.069 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(OCc2nccn2C)cc1)c1ccc(F)c(F)c1 186447516 MFXFCWGPNWXCAW-MWTRTKDXSA-N 397.469 5.245 30 20 GKED COc1cccc(F)c1[C@@H](C)NCc1cccc(OCc2cccc(C#N)c2)c1 237286956 LZLKFDSQPGTOOA-QGZVFWFLSA-N 390.458 5.136 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1cccc(Cl)c1 255507960 NPQCUVVHEBJOJS-HMVFGEFZSA-N 385.801 5.365 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1cncc(F)c1 255736896 SEJAQLGZMPLBFU-HJWRWDBZSA-N 380.806 5.023 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC)c(F)c2)cc1OCCCC#N 255911288 FBHGDIKTASVBTD-YVMONPNESA-N 385.460 5.135 30 20 GKED Cc1ccc(C)c(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303273744 IBVNLRPOQIRUBZ-MRXNPFEDSA-N 384.570 5.427 30 20 GKED Cc1ccc(Cc2cnc(N=C(O)[C@@H]3CCC(=O)[C@@H](C)C3)s2)cc1Cl 328915476 QUHOOGURUFGKRO-GXTWGEPZSA-N 376.909 5.289 30 20 GKED O/C(=N/[C@@H]1CC[C@@H]2CCC[C@@H]2C1)C1CCN(c2ccc3cccc(O)c3n2)CC1 329528947 UWCSNRVDPSMWED-PWIZWCRZSA-N 393.531 5.082 30 20 GKED CC[C@H]1CCc2nc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)sc2C1 330002724 ZDAQJHZTYZDLPT-GRTSSRMGSA-N 375.538 5.171 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 429674378 KOQSCSLTCUARNW-ZDUSSCGKSA-N 375.325 5.033 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(Oc3ccccc3)ccn2)s1 430614246 YTVNWTNPYJNEDK-INIZCTEOSA-N 377.469 5.118 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)c1 430699106 GKVGAFMULPWJDU-MRXNPFEDSA-N 377.296 5.026 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1 435096112 UWERBSLOGINFQQ-FQEVSTJZSA-N 388.515 5.159 30 20 GKED C=CCC[C@@H](NC(=O)C[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441592523 ULEXVXISWSITDP-HNAYVOBHSA-N 376.422 5.418 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)[C@H](c2ccco2)C1 442054211 JFQGXSYTJXVZID-DOMZBBRYSA-N 393.365 5.055 30 20 GKED C=CCC1(CNCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)CCCC1 449601580 AKOHYQCDGHJULF-UHFFFAOYSA-N 383.561 5.362 30 20 GKED C=C(C)CCNC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 452714834 AEWQVNJCFTVGGS-AUPQCFOMSA-N 397.403 5.191 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 455251378 MCYIRXBHUBFBQO-JOCHJYFZSA-N 377.532 6.319 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCC[C@H]1c1ccc(F)cc1)c1ccccc1 458807860 YAAHOTDYLQSQFQ-VXKWHMMOSA-N 379.479 5.497 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(F)cc1F)c1ccccc1 458840580 NTYXIPUJCCMIOO-RTWAWAEBSA-N 383.442 5.246 30 20 GKED Cc1cc(C(F)(F)F)ncc1NC(=O)c1ccc(C(F)(F)F)c(F)c1C 464665765 TXQZJCLPABWELB-UHFFFAOYSA-N 380.263 5.127 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)C[C@@H](c1ccccc1)C(F)(F)F 464957470 ZBYWILRFKZQHGZ-AABGKKOBSA-N 386.417 5.021 30 20 GKED CC[C@H]1CCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 465158626 SBVKSBVLZMGRJJ-GHTZIAJQSA-N 377.488 5.032 30 20 GKED C=C(C)C[C@H](C)C(=O)N(C)c1cccc2c1CCCN2C(=O)[C@@H](C)CC(=C)C 466273905 NYEPDDLUMXLJMF-OALUTQOASA-N 382.548 5.133 30 20 GKED Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 466955817 UWHCCCYWUYEDBN-DENIHFKCSA-N 391.515 5.086 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cccc(F)c1C 467357475 XMEGFCDLAIYFFV-UHFFFAOYSA-N 395.247 5.256 30 20 GKED C[C@@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1F 468033103 GNTSGFSIILKOAU-YJYMSZOUSA-N 395.478 5.688 30 20 GKED COCCCC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 471178647 SAQVRIDYNHBUHI-NRFANRHFSA-N 379.504 5.167 30 20 GKED Cc1ccc(CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c(Cl)c1 474162423 XXOLGUGGDQMJPU-UHFFFAOYSA-N 391.858 5.197 30 20 GKED N#CCC[C@H](NC(=O)N1CC=C(c2cccc(Cl)c2)CC1)c1ccccc1 474532730 FEYSCZQPVXECLA-NRFANRHFSA-N 379.891 5.184 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 474948549 BOEOFTBEMCKNOM-JXFKEZNVSA-N 387.310 5.744 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCN(C)C)Cc1cccc(F)c1 475572169 OKARYWYLYQVIJP-UHFFFAOYSA-N 397.538 5.273 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476061290 LPLHRYSIRUHIES-JOCHJYFZSA-N 384.479 5.600 30 20 GKED CC(C)(C#N)CCC[S@@](=O)Cc1ccc(Oc2ccccc2F)c(F)c1 476891485 PDNUYIAFNOQMES-AREMUKBSSA-N 377.456 5.336 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 480541387 POEQMCYFOTZKAL-RDBSUJKOSA-N 385.455 5.133 30 20 GKED COc1ccccc1C(C)(C)NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 485986793 FNUOEQNMDVLUBY-UHFFFAOYSA-N 386.451 5.024 30 20 GKED C[C@@H](Nc1c(C#N)cnc2c(F)cc(F)cc12)c1cccc(OC(F)F)c1 488177251 LHQWUFAWVFBIJC-SNVBAGLBSA-N 375.325 5.159 30 20 GKED C=CCC(C)(C)C(=O)NC[C@@]1(C)C[C@@H](NC(=O)C(C)(C)CC=C)CC(C)(C)C1 493954661 KEMQZSJPVNRVHY-UUOWRZLLSA-N 390.612 5.008 30 20 GKED N#C[C@H](NC(=O)CSc1cc(Cl)ccc1Cl)c1ccc(Cl)cc1 499813671 PDYOMBOUCZWAMU-AWEZNQCLSA-N 385.703 5.120 30 20 GKED N#CCCN(Cc1ccco1)Cc1nc(-c2cc(Cl)ccc2Cl)cs1 505772158 QVQBYJKHDUZISQ-UHFFFAOYSA-N 392.311 5.626 30 20 GKED C=CCOc1ccccc1CN(CC)CC(=O)Nc1c(Cl)cccc1Cl 506307069 DUIUFDXVDFUTAW-UHFFFAOYSA-N 393.314 5.019 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H]1CCO[C@H](C(C)C)C1 513658768 WOANQJRTJJOCFV-XXBNENTESA-N 392.499 5.439 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cc(F)c(Cl)cc2Cl)cc1 517491755 DKNSZYKFUPIEFP-KRWDZBQOSA-N 379.262 5.425 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1 518168811 LHCRXPUAISKYHL-HOTGVXAUSA-N 393.512 5.909 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)Cc1ccccc1-2 518239477 GGRDSGPGSOPZRP-MRXNPFEDSA-N 384.504 5.904 30 20 GKED CCc1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 519105586 ZNCWRSQPZIXOLJ-SFHVURJKSA-N 380.900 5.872 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2C)cc1 520924155 LMEHHQQVYNNKTH-INIZCTEOSA-N 390.512 5.136 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 522027036 MJMSIRFHJCRFBT-MHECFPHRSA-N 396.494 5.228 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 531145811 LDAZHCVFHZMZOI-NRFANRHFSA-N 385.854 5.048 30 20 GKED COc1ccc(CNc2cc(C(=O)Nc3ccccc3)ccc2Cl)cc1C#N 533005491 ALUUJMUKQXYYPH-UHFFFAOYSA-N 391.858 5.085 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2cnc(C3CC3)s2)cc1 535080903 KBVKISHWOCRCTL-UHFFFAOYSA-N 377.488 5.234 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 536840596 RLRPNDBWMXBLQW-UWJYYQICSA-N 375.541 5.738 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N3CCC(CC#N)CC3)c2)c(C)c1 541975354 JHCLHNVYWZVCFD-UHFFFAOYSA-N 378.541 5.362 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)C(=O)N1CCC[C@H]1c1cccs1 543960161 XPCLUPIOQXEROC-DOMZBBRYSA-N 376.934 5.117 30 20 GKED N#C[C@H](C(=O)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1)c1ccncn1 546153572 NTQWFCRKYAGYPP-HNNXBMFYSA-N 386.213 5.080 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 554735843 YDYNODNZDMSGJI-ORAYPTAESA-N 398.293 5.101 30 20 GKED N#CCCC[C@@H](NCc1ccc(Br)c(Cl)c1)c1ccccc1 560561989 MVKUAYODOXAMTE-GOSISDBHSA-N 377.713 5.627 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc4sccc4s3)cc2)ccn1 562188738 FNJNBRKEXQUWEH-UHFFFAOYSA-N 377.450 5.274 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)N1CCC(CCC#N)CC1 581367977 DLCVLMZEGGTREI-UHFFFAOYSA-N 383.414 5.042 30 20 GKED C[C@H](NCc1cc(C(F)(F)F)ccc1Br)c1cccc(C#N)c1 589314238 UNNITAMFGILGTE-NSHDSACASA-N 383.211 5.190 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 604547425 ZBLXUQVFBVOLPD-FZMZJTMJSA-N 385.533 5.118 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(Oc2ccccc2)c1 609377064 PBOXSIIINAVMEM-QGZVFWFLSA-N 388.492 5.983 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 609499280 FCAKOBIGFMJRPN-GOSISDBHSA-N 385.467 5.196 30 20 GKED Cc1cccc(-c2nnc(S[C@H](C#N)C3CCCCC3)n2Cc2ccco2)c1 609649069 VQISRRZHKNEVKM-HXUWFJFHSA-N 392.528 5.459 30 20 GKED CCOc1ccc(Oc2cc(CN[C@H]3CCCc4cc(C#N)ccc43)ccn2)cc1 611390929 LUFBEMIYNPEZPH-DEOSSOPVSA-N 399.494 5.311 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 612377684 RXDHXCJKMOQRSY-WMZOPIPTSA-N 399.844 5.145 30 20 GKED CCCc1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 613319213 WFUPCAJHMVMDMV-HNNXBMFYSA-N 381.526 5.326 30 20 GKED CCSCc1ccccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 619107286 QPZNRHMHWGQXLN-UHFFFAOYSA-N 389.480 5.251 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cnc(-c3ccccc3Cl)nc2)s1 651353116 UXODNHLGCSZZBS-CQSZACIVSA-N 396.903 5.041 30 20 GKED Cc1ccccc1C1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 727038063 DQFTWXVDNWKTNA-KRWDZBQOSA-N 392.911 5.680 30 20 GKED O=[N+]([O-])c1ccc(NN=Cc2c(-c3ccccc3)nc3sccn23)c(Cl)c1 727650269 UCGBHHDBHXONEC-UHFFFAOYSA-N 397.847 5.070 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@H](C#N)C(=O)Nc2ccc([C@H](C)CC)cc2)cc1 727954730 SZGKGKQWQDCYQV-JLHGSKIFSA-N 376.500 5.214 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccccc3F)cc2)c1 727980628 PBPFVWIUVKDGDQ-UHFFFAOYSA-N 377.444 5.085 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)ccc1O 728232074 SDHLGMFZAOFFTA-PKNBQFBNSA-N 391.854 5.502 30 20 GKED Cc1cc(C(=O)Nc2ccccc2-c2cccs2)c(C)n1-c1ccc(C#N)cc1 728266186 LJAJOZVLWCPGHM-UHFFFAOYSA-N 397.503 5.947 30 20 GKED COc1cc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)ccc1OC(F)F 730084334 AZGWJVRWCMJALQ-CLFYSBASSA-N 387.407 5.316 30 20 GKED N#CCOc1cccc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)c1 730151602 NWBFGQNMZHJCQK-BOPFTXTBSA-N 399.219 5.276 30 20 GKED CC(=NNc1ccc(Br)cc1C(F)(F)F)c1sc(C)nc1C 731487323 PXLSPXLAPSZIQQ-UHFFFAOYSA-N 392.244 5.377 30 20 GKED CC1(c2ccccc2)CC(=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C1 733079869 LLHXVPVCRPYLEF-UHFFFAOYSA-N 397.404 5.077 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 733259633 FZAOXMICNKNIMQ-GFCCVEGCSA-N 392.267 5.013 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)c1 733807029 QAZHUNXHZCXRDK-TZIWHRDSSA-N 397.906 5.068 30 20 GKED Cc1cccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c1C 739436378 AGUTXSAFAFVPRJ-UHFFFAOYSA-N 377.538 5.390 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OC(C)C)cc2)cc1OCCCC#N 747361133 CJJHKJGTWZVKOA-SDQBBNPISA-N 379.456 5.061 30 20 GKED O=C1/C(=C/c2coc(-c3ccccc3)n2)Cc2c(F)cc(Br)cc21 749891409 JIPVTOKFVFHQNL-WUXMJOGZSA-N 384.204 5.066 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 754690372 SOUINRCRXXLYHL-REPPVQDKSA-N 379.765 5.546 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(Cl)c(C#N)c1 754906599 SLGLYPRNJHXOAP-UHFFFAOYSA-N 398.890 5.254 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2csc([C@@H]3CCCO3)n2)s1 755618406 LELHFIVGPQMCFY-AWEZNQCLSA-N 394.566 5.001 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccc(F)c(F)c3)n2)cc1 756232513 UNGOCNJGGVROKX-KRWDZBQOSA-N 396.462 5.596 30 20 GKED Cc1ccc(OC(F)F)c(/C=C2/SC(=Nc3c(C)cccc3C)NC2=O)c1 756783768 LUQSKSUERJJDKW-MHWRWJLKSA-N 388.439 5.105 30 20 GKED N#C[C@H](NC(=O)c1c(Cl)cc(F)cc1Cl)c1cccc(Cl)c1Cl 763195607 LSRVZAZAUZEKBJ-LBPRGKRZSA-N 392.044 5.434 30 20 GKED C=CC[C@@H](N[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)c1ccncc1 766019194 KQFZQAMUKQYLPR-MOPGFXCFSA-N 395.959 6.143 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776167857 HVRBCKIMUDDHDE-HRAATJIYSA-N 388.433 5.966 30 20 GKED C=CCSc1ccccc1C(=O)OCc1ccccc1NC(=O)c1ccco1 777322457 GGQQHHXVOZBIFL-UHFFFAOYSA-N 393.464 5.167 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C(C)=C/c3ccc(C)cc3)n2)cc1 779195146 RKCLJMDYEBGHNI-ZRNYNZGJSA-N 388.492 5.407 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=S)N[C@H](C)c1ccc(Cl)cc1Cl 779729257 YSDKMOMLHHZUSR-VXGBXAGGSA-N 394.327 5.332 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 780674298 MDQULLCOLNNQKV-GFCCVEGCSA-N 390.270 5.095 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc(-c2ccccc2)o1 784829547 TZBKSJBRDFPGAM-CQSZACIVSA-N 399.233 5.215 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccc3cc(Br)ccc3c2)CC1 799404452 DFGPTZAFVQRRCE-UHFFFAOYSA-N 386.293 5.054 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(N3CCC[C@@H](C)C3)c(Cl)c2)cc1 800277761 ZGUSXNFTCVBNGL-MSOLQXFVSA-N 397.950 5.157 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(N2CCCCCC2)cc1 801778255 LVRBEVXBQJUPAO-UHFFFAOYSA-N 388.515 5.159 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC([C@H](O)c2ccccc2C)CC1 806518689 GAQCTELJYZTTJC-QHCPKHFHSA-N 378.516 5.091 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H](c3ccccc3)C2)cc1 814576880 IJPZXXPCHFDDSI-UKILVPOCSA-N 395.506 5.754 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(-c2cccc3ccccc23)no1 818285844 DUZGBXHNRKZXHL-SFHVURJKSA-N 392.459 5.149 30 20 GKED CN(Cc1cccs1)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1 824434845 SCMZUDKZTMAEBB-DEOSSOPVSA-N 389.568 5.909 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2csc(Cl)n2)cc1)C(F)(F)F 853061695 HFZPNFURXTVMJN-UHFFFAOYSA-N 392.727 5.698 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)/C=C\c1nc2ccccc2s1 914522337 UAUDWTXBXOZBON-QXMHVHEDSA-N 385.448 5.008 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915124844 ZNESGHPGZRDMKX-LJQANCHMSA-N 391.927 6.113 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1ccccc1Cl 916333675 QKFFQFNAPNDLNP-UHFFFAOYSA-N 383.691 5.076 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccc(Cl)s2)cc1 916950153 RKUOLVGQJLBYCT-GUYCJALGSA-N 388.920 5.195 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)cc1)c1nc2cc(Cl)ccc2s1 917046501 DVUGKPKPUVDDKA-HNNXBMFYSA-N 389.307 5.802 30 20 GKED Cc1ccc(C)c(OCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046774 MPPIHIDZHYSPLD-HNNXBMFYSA-N 384.888 5.212 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)OCC(C)C)c1 920233359 VUHSCVZHISNUTQ-UHFFFAOYSA-N 381.476 5.111 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cc1)C(=O)O 1776469863 WPTQURNFDHBJSW-NNSJBKGDSA-N 378.449 5.163 30 20 GKED CCc1c(C(=O)/C=C\c2cccc(OCCC(=O)O)c2)oc2ccc(C)cc12 1776956191 JLJMYWVQJOVNQY-HJWRWDBZSA-N 378.424 5.053 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2ccc(O)c(C(=O)O)c2)o1 1777559865 OQORBJCNDOCERJ-YFHOEESVSA-N 388.375 5.301 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Oc2cccnc2)cc1 63304429 JOAAYMXCKXXPGN-UHFFFAOYSA-N 397.459 5.726 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3ncccc3c2)cc1 63835525 TWKXDLBBOZZTEZ-UHFFFAOYSA-N 395.487 5.651 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 65699381 NSZQPDHCGBJHPR-LJQANCHMSA-N 387.321 5.146 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(CSCC)cc2)cc1 65869906 XRCPRBHFNKJCMM-UHFFFAOYSA-N 394.540 5.006 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2ccc(/C=C\C(=O)c3cccc(C#N)c3)cc2)c1 96297956 UBTXMIPXDVKZMO-XSYHWHKQSA-N 388.426 5.222 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Br)s1 114273213 ZCJXDTWRGOUCCC-NSHDSACASA-N 395.347 5.086 30 20 GKED CC(C)OCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 122390457 RGDJFRJSJUTSAW-CYBMUJFWSA-N 383.300 5.108 30 20 GKED Cc1ccc(F)c(N/C(S)=C(/C(=O)c2cccc(Cl)c2)[n+]2ccccc2)c1 125894487 SAJSXSSEXANGHE-UHFFFAOYSA-O 399.898 5.126 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 135255920 HWHNFAOULOMLEA-KKSFZXQISA-N 381.451 5.042 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)CCc2ccc(C#N)cc2)C1 136069796 RSPNSUSXHJVIDD-MGPUTAFESA-N 386.417 5.119 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cccc(Cl)c2F)cc1C 151916044 XYVLSHUZKSVYRC-UHFFFAOYSA-N 396.853 5.125 30 20 GKED COc1ccc(-c2nnc(SCCCCC#N)n2-c2ccc(C)cc2)cc1 195556605 HIEDYOCSDANRBF-UHFFFAOYSA-N 378.501 5.037 30 20 GKED CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1O[C@H](C)C#N 248523207 BZBJKSPEJKFXAU-YFVAEKQCSA-N 377.488 5.168 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3scnc3C(F)(F)F)c2C#N)[C@@H](C)C1 297940421 UBRSZVRERVKWAQ-YUMQZZPRSA-N 385.436 5.033 30 20 GKED CCn1ncc2ccc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)cc21 329500493 YKGCKNWDLSZOFB-QGZVFWFLSA-N 391.519 5.151 30 20 GKED CC(C)n1c([C@H](C)/N=C(/O)[C@@H]2C[C@@]23CCOc2ccccc23)nc2ccccc21 329692485 GVXAOBAAEVVNBK-READRUSDSA-N 389.499 5.375 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1ncc(-c2ccc(OC)cc2)o1 410348316 WMSJYKKURRDDSO-UHFFFAOYSA-N 376.456 5.040 30 20 GKED N#CCCC[C@@H](NCc1csc(COc2ccc(F)cc2)n1)c1ccccc1 433020833 UPDWLSRZAWWLPA-OAQYLSRUSA-N 395.503 5.386 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2c(-c3ccc(Cl)cc3Cl)noc2C)n1 435779334 WOIANBGJIXKFJK-LBPRGKRZSA-N 392.267 5.212 30 20 GKED Cc1cccc([C@H](C)SCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 437457288 ZZZXTFRWRKEOGG-IRXDYDNUSA-N 384.570 5.822 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccccc1 439311454 YQHNLAIVOGMAKA-FQEVSTJZSA-N 396.450 5.661 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441500765 NQUZCNZFMPHTRC-KBXCAEBGSA-N 377.410 5.168 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3[nH]2)c(Cl)c1 455713139 BPDCYNKGVRJMRC-IBGZPJMESA-N 393.878 5.041 30 20 GKED O=C([C@H]1CCC[C@H](C(F)(F)F)C1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 456563246 ADCYPSMAIYTQMK-XWLWVQCSSA-N 399.297 5.087 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 467279548 DGKBSJSHQZKNDY-UHFFFAOYSA-N 385.895 5.331 30 20 GKED Cc1ccc(C[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CC2)cc1 469244519 NIRJIMSCVILXAA-HSZRJFAPSA-N 387.527 5.011 30 20 GKED CC1(c2ccc(Cl)cc2)CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)CC1 470680127 CFXAMRJUINVGAL-UHFFFAOYSA-N 378.903 5.089 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@H]3CCC[C@@H]3c3ccccc3C(F)(F)F)CC2)cc1 474144932 FLGUGMYDBWEUHR-QUCCMNQESA-N 398.428 5.061 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@H]3CCC[C@@H]3c3ccc(C(F)(F)F)cc3)CC2)cc1 474160803 VQFZMKGOLKFQEN-UXHICEINSA-N 398.428 5.061 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1cc(C#N)cn1C(C)(C)C 475041910 TWYJZHYNEDHDCN-UHFFFAOYSA-N 382.508 5.382 30 20 GKED COCCC[C@@H](Cc1ccccc1)NC1CCC(C#N)(c2ccccc2)CC1 475357576 VCYXXLYCBFNOPU-BQCMWAFGSA-N 376.544 5.018 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(OC(C)(C)C)n1 475556553 QYBHMANIJLRELE-UHFFFAOYSA-N 381.520 5.433 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H]1CCc2ccc(F)cc21 481080471 ZDFGFJBNVSGCMD-IBGZPJMESA-N 399.466 5.101 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1S[C@H](C)CC#N 482526522 CABVYSWKAKBUQZ-RHSMWYFYSA-N 388.920 5.530 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1nc2cc(C(F)(F)F)ccc2o1 483223770 WQUNNEVZRWPHEM-AEFFLSMTSA-N 385.389 5.118 30 20 GKED Cn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccc(Cl)cc1 486995528 HNICPIVFFRFLRO-UHFFFAOYSA-N 382.920 5.229 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc2nc(C(F)F)sc2c1)c1ccccc1 490686143 UXXHMWMOAVTCKK-AWEZNQCLSA-N 386.427 5.400 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 499815438 SRWDMFSMCPGUJF-UXLLHSPISA-N 379.674 5.131 30 20 GKED Cn1c(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c(Cl)c2ccccc21 499837197 IDQOYABTIQLNTH-ZDUSSCGKSA-N 392.673 5.133 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)Nc1cccc(OCCCC#N)c1 500041700 RLTNAFIVSCRCFT-UHFFFAOYSA-N 385.439 5.330 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)o1 505354178 UYRMVEFPFSLQQP-SQZREULQSA-N 398.462 5.048 30 20 GKED C=C(C)[C@H](NC(=O)[C@H](C)Cc1cncc2ccccc12)c1ccc(F)c(F)c1 505965457 URMUXUGKJRWXSE-QRQCRPRQSA-N 380.438 5.125 30 20 GKED COc1ccc(CN(C)Cc2ccccc2C(F)(F)F)cc1OCCCC#N 506324228 CKHQSWPVTDNEFN-UHFFFAOYSA-N 392.421 5.029 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccc(Cl)s1 509567618 GCQGJUNRGTZDBJ-UHFFFAOYSA-N 382.872 5.555 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 509631922 GCAGKNLEBLXZDK-NWDGAFQWSA-N 379.312 5.223 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 510529536 NQUAOXINNPPTDU-UHFFFAOYSA-N 398.249 5.613 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc([N+](=O)[O-])cc3C#N)s2)cc1 518594201 SKJSFZQPLHDPDV-CYBMUJFWSA-N 378.457 5.380 30 20 GKED Cc1cc(Cl)c(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1F 518824582 FDHZKLXZJXYEHU-ZDUSSCGKSA-N 392.883 5.199 30 20 GKED C[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 521710950 PTYUIPHSGMOTQF-UZLBHIALSA-N 381.907 5.649 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)OCC 535138707 QXYNMLNHDHZENI-FPOVZHCZSA-N 382.891 5.305 30 20 GKED N#CCCCCNC(=O)N[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 537873829 BNLYARLEGKOHCJ-SJLPKXTDSA-N 381.442 5.115 30 20 GKED C[C@@H]1CCCC[C@H]1OCc1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 544336499 POQQLMXSNPNTQW-BUGVJISQSA-N 390.487 5.204 30 20 GKED COc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1OC(C)C 546160191 YGPGXPBHWRFHEJ-UHFFFAOYSA-N 386.451 5.273 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 557710149 RMSIVLVTSUVANR-HNNXBMFYSA-N 376.275 5.109 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C4=CCCC4)cc3)n2)cc1 558546383 PNGSDBNKONRHAY-OAQYLSRUSA-N 395.487 5.739 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccnc2)cc1 564175603 QQYJQQFWLGDXLL-DHIUTWEWSA-N 398.466 5.178 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cc2ccccc2s1 567527065 OIDLRYYCBCIYJC-UHFFFAOYSA-N 376.934 5.514 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1ccc(Sc2ccc(Cl)cc2)o1 569390086 QKNNYRKEJDNRDN-UHFFFAOYSA-N 397.887 5.035 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)Nc3ccccc3C(F)(F)F)cc2)ccn1 569752117 IJLNSKHQHXAWPY-UHFFFAOYSA-N 398.344 5.408 30 20 GKED CC(C)c1cc(Cl)ccc1NC(=O)CCCC(=O)Nc1ccccc1C#N 600369240 NNAGTGAVSJVGRX-UHFFFAOYSA-N 383.879 5.083 30 20 GKED CCOc1ccc([C@H](NC(=O)Nc2ccc(CC#N)cc2)C(C)C)cc1OCC 603650706 BHBNHVPKSWBSQF-JOCHJYFZSA-N 395.503 5.069 30 20 GKED N#Cc1ccnc(SCc2nc3cc(Cl)ccc3n2Cc2ccccc2)c1 603724903 LVRKUEREUFECSD-UHFFFAOYSA-N 390.899 5.297 30 20 GKED Cc1cccc(O[C@H](C)C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1 603991764 QITUWGJCRTUGMC-OAHLLOKOSA-N 388.492 5.100 30 20 GKED N#Cc1c(NC(=O)c2ccccc2C(F)(F)F)sc2c1CCCCCC2 603996384 MSOZWSPTWJDBEA-UHFFFAOYSA-N 378.419 5.550 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1cc2ccccc2o1 609432656 FOXLGWOUHCHWSF-SFHVURJKSA-N 382.463 5.734 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCC3(c4ccccc4)CC3)cc2)cc1 609498752 FNRHJOYVLJXXNF-UHFFFAOYSA-N 382.463 5.007 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccnc2Oc2ccccc2)c1 609600976 HPXANTHANADNRX-UHFFFAOYSA-N 388.427 5.200 30 20 GKED C[C@H](NC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)c1cccc(C#N)c1 610361617 CWFGXYKGLSWWST-KFKAGJAMSA-N 387.508 5.095 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC(Cc4ccccc4)C3)cc2)cc1 610630490 RBIQEGGUKMMXHL-UHFFFAOYSA-N 383.451 5.057 30 20 GKED C[C@@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(-c2cccc(C#N)c2)cc1 611807438 GFGDBPAYGJLKBB-OAHLLOKOSA-N 375.403 5.123 30 20 GKED N#CCCn1cc(/C=C\c2nc([C@@H]3CCc4ccccc43)no2)c2ccccc21 612933231 OSJWBDSGDPFMGL-JNSUZQQQSA-N 380.451 5.186 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cc(Cl)ccc4o3)n2)cc1 613318050 KFEYFZHMQFXLLY-INIZCTEOSA-N 392.867 6.008 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1C[C@H](C(F)(F)F)CC[C@H]1C 679526698 OIPBJBFMLXPBSE-DGCLKSJQSA-N 395.343 5.073 30 20 GKED Cn1c(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc2c(F)cccc21 684888140 FVVDCZIGPVGKQV-RKDXNWHRSA-N 383.311 5.034 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Oc2ccccc2)cc1 726073361 IMVODJSZOVEDOL-QGZVFWFLSA-N 387.439 5.264 30 20 GKED CCCCCCCC(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1 726517960 CYNFKPVPFSNKGO-UHFFFAOYSA-N 389.517 5.181 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccc(F)cc3)cc2)c1 727980671 QNBHKNIMFMLNPW-UHFFFAOYSA-N 377.444 5.085 30 20 GKED CC(C)N(CCC#N)C(=O)c1sc2cc(Br)ccc2c1Cl 729842699 KLFROWSGAZFNJW-UHFFFAOYSA-N 385.714 5.081 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2cnnc(O)c2Cl)cc1 730567896 DBDSFFCRJYYUKP-HNNXBMFYSA-N 390.915 5.267 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)c1 731331926 WSGAZSPPUBLTFL-UHFFFAOYSA-N 393.786 5.164 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccc(C(F)(F)F)nc1O 731564474 GIJNRTKXIVAOSK-YVMONPNESA-N 393.361 5.570 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 732591278 TWASFBFTHKSVSP-FGZHOGPDSA-N 393.556 5.482 30 20 GKED N#Cc1ccc(SCC(=O)O[C@@H](Cc2ccc(Cl)cc2)C(F)(F)F)cc1 733948738 YCGRKMIZAKUDQD-INIZCTEOSA-N 399.821 5.021 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(COc3ccccc3C#N)c2)C(C)C)c1 734102084 FTDONWVJFIQFPA-UHFFFAOYSA-N 394.474 5.174 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccccc3OCC(F)(F)F)c2c1 741841046 JFXQDENYCAULFC-TWGQIWQCSA-N 375.346 5.014 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)/C=C(\C)c1cccc(C(F)(F)F)c1 742592376 AONDHIBIOKWAGG-LFIBNONCSA-N 384.401 5.195 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 743194798 PIXNJGLKGFPXAC-CYBMUJFWSA-N 394.368 5.081 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744017070 YAOCTZPESLFURE-AINHQSCGSA-N 380.369 5.533 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCSc2ccccc21)c1nc2cc(Cl)ccc2s1 744035807 RYWVHTHVIJONRT-KBPBESRZSA-N 384.913 5.406 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1 747377687 ZJEMSYVTEKYTJA-YTFSRNRJSA-N 386.882 5.738 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cn4ccccc4n3)cc2Cl)c1 753121756 GMZGWHVQHCNCOX-UHFFFAOYSA-N 388.858 5.050 30 20 GKED C/C(=C/C(=O)Nc1ccccc1SCCC#N)c1ccccc1OC(F)F 753218986 ASNULLOPCOIKKN-YPKPFQOOSA-N 388.439 5.336 30 20 GKED N#C[C@@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1ccc2ccccc2n1 759530748 IVUNCURKBQTXMV-CQSZACIVSA-N 381.262 5.450 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](Cc2nc(C)no2)c2ccccc2)cc1 760052940 UGXJXCKSVPBKOR-KKSFZXQISA-N 397.906 5.144 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 761535486 UFZVSYCOSDFDAX-LADGPHEKSA-N 382.463 5.019 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 766867396 SFRAHGXMGDQIPY-AWEZNQCLSA-N 392.377 5.263 30 20 GKED C[C@@H]1C(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C[C@@H]1c1ccccc1 767783092 TZHNNJKYCOLIOO-BBRMVZONSA-N 397.404 5.149 30 20 GKED N#Cc1ccc(OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)c(F)c1 769737634 CVCQSNGHDNGAPC-UHFFFAOYSA-N 392.333 5.059 30 20 GKED COc1ccc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1C#N 773430429 YWYRNXPOGWSRDM-LJQANCHMSA-N 394.824 5.480 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nc4c(s3)CCCC4)cc2F)c1 779595228 FYSOJUDOZKSHOF-UHFFFAOYSA-N 393.487 5.224 30 20 GKED C=CC[C@H](N[C@H](CC)c1ccc(Br)cc1Cl)c1ccncc1 783247488 YTAUUKSXSHCYQD-MSOLQXFVSA-N 379.729 5.856 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 785765212 FRGUJBGOWUOFEY-FQEVSTJZSA-N 379.529 5.566 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C\c1cnc(-c2ccccc2)s1 787179895 SGSSSMIHWXBSAW-NTMALXAHSA-N 383.856 5.146 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@H]2SCCS[C@@H]12 789460305 SDSUWFNRTVAIHG-LMMKCTJWSA-N 376.591 5.040 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cccc(CC(C)C)c2)ccc1OC 796827961 UACURMQZHCTLTJ-XMSQKQJNSA-N 380.532 5.425 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 802250010 KUCPJAFFNHOGJX-RHSMWYFYSA-N 382.529 5.259 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)ncc1F 815636236 RFQXPIKMVDKCRJ-SUMWQHHRSA-N 376.273 5.069 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@@H](CC)Sc1ccccc1 842291008 YRYZMKREAZKHAJ-VQTJNVASSA-N 394.540 5.030 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942911 RKVWMANHPIGNAD-IINYFYTJSA-N 379.312 5.382 30 20 GKED Cc1ccc(C(=O)N(C)c2ccc(OC(=O)CC3(C#N)CCCCC3)cc2)cc1 850766867 VZNPPLDGKCKHCN-UHFFFAOYSA-N 390.483 5.041 30 20 GKED O=C(NOCCC(F)(F)F)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 857492996 QANWRSRAJPTUCY-UHFFFAOYSA-N 395.274 5.125 30 20 GKED O=C(/C=C/c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccnc1 916136990 DISDLHXGFDLUMP-WEVVVXLNSA-N 380.787 5.332 30 20 GKED O=C(/C=C/c1ccc(O)c(Br)c1)c1ccc(N2CCCCC2)cc1 916154723 QTLIRGPWPZDWBO-ONNFQVAWSA-N 386.289 5.041 30 20 GKED Fc1ccccc1-c1nnc(S)n1N=CC(c1ccccc1)c1ccccc1 916319969 VTJCPUMIMYGTRL-UHFFFAOYSA-N 388.471 5.039 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nn(-c2ccc(Cl)cc2)c(=S)s1 917839022 TZJCOCWOUQRTNR-HNNXBMFYSA-N 389.958 5.544 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1oc2c(C)cccc2c1C 920109550 QXHAWJMHJVBXJA-LJQANCHMSA-N 388.467 5.136 30 20 GKED CCc1ccc(-c2csc(NC(=O)c3ccccc3SCC#N)n2)s1 921200598 UFMDZMVXTDTISA-UHFFFAOYSA-N 385.539 5.302 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(Cc1ccccc1)c1ccc(C)c(C)c1 1776049981 JRMPLDDYXCXROB-UHFFFAOYSA-N 388.467 5.069 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)cc1OCCC 1776125810 SYFKMMXSARZXND-SPEXVAAVSA-N 394.467 5.258 30 20 GKED COc1ccc2c(c1)CC/C(=C/c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1776127590 XSFVNTWFEXFEMW-SSZFMOIBSA-N 390.460 5.334 30 20 GKED CC1(C)/C(=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1776515352 RCBMVGVPDLBBGK-HZHRSRAPSA-N 398.458 5.521 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)o1 1777489733 JTBAUHCWMHEGFQ-LUAWRHEFSA-N 395.480 5.603 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cc[nH]c3C)CCC2)cc1 1785841927 DLDUCAWFJQOFIW-UHFFFAOYSA-N 393.531 5.063 30 20 GKED N#CCCCSc1nc2cc(Cl)ccc2c(=O)n1-c1cccc(Cl)c1 7536582 GXVODGFASMHKCO-UHFFFAOYSA-N 390.295 5.088 30 20 GKED C=CCn1c(S[C@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(F)cc1 7736926 IYUJKNWGGSTJLD-CYBMUJFWSA-N 384.436 5.032 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2SCc2cccs2)cc1 25438680 BXGQRFBXUIUGPG-UHFFFAOYSA-N 392.549 6.094 30 20 GKED CCN(C(=O)CCCc1ncc(-c2ccccc2)o1)[C@@H](C)c1ccc(C#N)cc1 44573002 NNOBKMQOCMBRBF-SFHVURJKSA-N 387.483 5.146 30 20 GKED N#C[C@@H](C(=O)CCCOCCc1ccccc1)c1nc(-c2ccccc2)cs1 51534422 RDAZRQMCBMYMGA-FQEVSTJZSA-N 390.508 5.026 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(Cl)s2)cc(Br)c1O 57437862 JAWTZVLAQYXWBH-ONEGZZNKSA-N 387.682 5.164 30 20 GKED CN(CCC#N)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 57814278 NHRCTUKXSDNLLS-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ncc(-c2cccc(Cl)c2)o1 108354948 MZIPTXOHENXQBP-AWEZNQCLSA-N 383.904 5.859 30 20 GKED N#CCCCOc1cccc(CN[C@@H](Cc2ccccc2)c2cccs2)c1 116923064 WVFLQGBPWFYMEU-QFIPXVFZSA-N 376.525 5.504 30 20 GKED Cc1ccc(-c2nnco2)cc1NCc1cccc(OCc2cccc(C#N)c2)c1 119853587 PGDMKONCOIMFSI-UHFFFAOYSA-N 396.450 5.108 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)[C@H](Sc1ccccc1)c1ccccc1 120271689 XZQGPCHGPDQEMQ-OAQYLSRUSA-N 392.455 5.200 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 160970416 ZIBJXVICZWHFMF-SJLPKXTDSA-N 390.936 5.019 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc2ccccc2n1)c1nc2cc(Cl)ccc2s1 176462576 ZRVBSPSDAOHYRW-FDMDGMSGSA-N 389.867 5.388 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nc(C)cs1 177896748 RZHSTXMNTRARRU-UHFFFAOYSA-N 379.510 5.141 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1cccc(C#N)c1C 178403870 CWPZHCHGPHYOID-UHFFFAOYSA-N 386.238 5.389 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccccc1SC[C@H](C)C#N 189962517 GOMJEYFCBHLLPR-CQSZACIVSA-N 383.517 5.720 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccncc3C(F)(F)F)cc2)cc1 193067360 HDFFBLVIVNQNGT-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 236917293 NFEUIBNCJGGZNB-FOIQADDNSA-N 376.422 5.627 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccccc3Cl)n2)cc1 255030290 GEOPAHBNSROLIV-IBSYWUHOSA-N 389.867 5.225 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(Br)cc1F 255033333 GIPMTXBFFZBMQZ-ALCCZGGFSA-N 389.249 5.003 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 303384961 WZEYQFMMCARBJN-XZOQPEGZSA-N 384.435 5.101 30 20 GKED C[C@@H]1C[C@H](C(O)=Nc2sc3c(c2C(=O)c2ccccc2)CCC3)CCC1=O 329403846 WVDFGCREOXOJEG-UKRRQHHQSA-N 381.497 5.061 30 20 GKED N#CCC[C@@H](NC(=O)c1c(F)ccc(SCC2CC2)c1F)c1ccccc1 410600075 CCQMKWBOMPXAEZ-QGZVFWFLSA-N 386.467 5.242 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1OC1CCCC1 430629431 QGNHXWNPIFBGTC-MRXNPFEDSA-N 398.528 5.261 30 20 GKED N#CCCC[C@H](NC(=O)NCC1(Cc2ccccc2)CCC1)c1ccccc1 431289369 GBPMJVZKLSWDAK-QFIPXVFZSA-N 375.516 5.134 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1c(C)cc(C)cc1Br 431980400 HSBFZYFMZHQMDZ-UHFFFAOYSA-N 379.323 5.348 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 436132727 NBXWQOFEKHENNV-UHFFFAOYSA-N 388.210 5.206 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3ccco3)c3ccc(Cl)cc3)o2)cc1 440327030 ISAOFNDAJOKXBN-UHFFFAOYSA-N 390.830 5.061 30 20 GKED C[C@H]1COCC[C@H]1c1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 442693060 YKOCKMDMRKJNDJ-XJKSGUPXSA-N 395.846 5.194 30 20 GKED N#CCCC[C@H](NC(=O)C[C@H](c1cccs1)n1cccc1)c1ccccc1 452141418 UPXUJIFJPNUULT-VQTJNVASSA-N 377.513 5.080 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nn1C(C)C 453594789 GCGFEQHIUZKHTD-HNNXBMFYSA-N 384.892 5.039 30 20 GKED C=C(C)COc1cccc(NC(=O)c2sc(C)c(Br)c2OC)c1 463560808 WWQZVJZUGFZNLB-UHFFFAOYSA-N 396.306 5.035 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1cccc(C(F)(F)F)c1 463728620 MNRHFPDVWDVDRU-UHFFFAOYSA-N 378.419 5.282 30 20 GKED N#Cc1cc(NC(=O)c2cscn2)ccc1Oc1ccc(C(F)(F)F)cc1 464296808 OSMWWPFZKZRANJ-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#Cc1cc(NC(=O)c2cccnc2)ccc1Oc1ccc(C(F)(F)F)cc1 464297161 QYSJQEKKCZNHFK-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1cc(C(F)(F)F)ncc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 464662092 RYYAPRZAPMWTCG-UHFFFAOYSA-N 397.356 5.325 30 20 GKED CCCCOC1CCN(C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)CC1 464801324 DVTSTLVGLUJZGZ-UHFFFAOYSA-N 392.499 5.080 30 20 GKED Cc1nc(CNC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)sc1C 464955384 UAZXFFRVFOJPCL-UHFFFAOYSA-N 397.887 5.007 30 20 GKED C[C@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)c(F)c1 468032095 YYXIWBZNKUQELD-ORAYPTAESA-N 395.478 5.688 30 20 GKED Cc1cc2cc(CNc3ccc4c(c3)CCC(=O)N4CCCC#N)oc2cc1C 468821569 FDVOMUUNTVUKCY-UHFFFAOYSA-N 387.483 5.245 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCCC[C@@H]3c3ccccc3)ccc21 469002112 NIPLEPKGSVMGGF-PKTZIBPZSA-N 387.527 5.408 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H](CC3CCC3)c3ccccc3)ccc21 469240812 PWDODKKPAMMGLI-QHCPKHFHSA-N 387.527 5.613 30 20 GKED N#CC[C@@H](CC(=O)Nc1ncc(Cc2ccc(F)cc2F)s1)c1ccccc1 475186594 ZNTTUMQNUVCAAV-HNNXBMFYSA-N 397.450 5.038 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCc2cscn2)c1 476116856 FHUPSLUIYDJYKS-UHFFFAOYSA-N 392.524 5.826 30 20 GKED N#CC[C@H](CC(=O)N1CCCCC[C@@H]1CC(=O)c1ccccc1)c1ccccc1 476240413 UPVBRTHWZGRZCN-DHIUTWEWSA-N 388.511 5.118 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480382917 ZHIPPIHBXBVGJO-UHFFFAOYSA-N 381.476 5.019 30 20 GKED CCN(CCc1cccs1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482521479 ZHXFPPXIJHZRDP-UHFFFAOYSA-N 376.481 5.117 30 20 GKED Cc1c([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccccc12 484143599 UOSBHPJDSQRISI-GOEBONIOSA-N 393.512 6.018 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 484895407 SKLWZZFFDJTFOT-XMMPIXPASA-N 398.462 5.336 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(C(C)(C)C)cc1 488271768 IZRLOGVWYKIGJO-SFHVURJKSA-N 389.543 5.740 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 499055399 MQVKCBKTEZZCCS-MRXNPFEDSA-N 386.417 5.285 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1ccccc1-c1ccc(Cl)cc1 499604802 GGJDPFRUBGFVTL-GOSISDBHSA-N 382.935 5.758 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccc(Cl)cc1 499814090 QGNXAXVCOWUYLQ-DZKIICNBSA-N 379.674 5.131 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCCc1c[nH]c2ccccc12 500994183 GHSRWBUXPKHZTR-UHFFFAOYSA-N 383.451 5.189 30 20 GKED C[C@@H](N[C@H](C)c1cnn(C2CCCC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 502412773 GZRQDIGLORCAQK-RTBURBONSA-N 384.527 5.949 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccco3)s2)sc2c1CCCCCC2 504265999 HBZHDGXATUCCQN-UHFFFAOYSA-N 383.498 5.248 30 20 GKED N#Cc1ccc(Cl)c(C(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)c1 506760941 XGRCFWZPRPUDTG-UHFFFAOYSA-N 382.797 5.009 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccccc2)CCCC1 506866947 YKKYUJATHYWHCC-KRWDZBQOSA-N 379.529 5.672 30 20 GKED N#CC[C@H](Cc1nc(-c2ccc(F)cc2C(F)(F)F)no1)c1ccccc1 508052861 HAJBJBJOUOAWBB-CYBMUJFWSA-N 375.325 5.134 30 20 GKED CCc1ccsc1C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 509490260 XBKFRMGWQLLHQZ-UHFFFAOYSA-N 378.472 5.164 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Cl)c(Br)c1 510551587 KAUZIMYDSQRCGA-UHFFFAOYSA-N 395.709 5.361 30 20 GKED CC(C)(C(=O)NCCCCC#N)c1csc(-c2c(Cl)cccc2Cl)n1 511154124 CLFQJDONXMYTTD-UHFFFAOYSA-N 396.343 5.205 30 20 GKED N#Cc1cccc(C2(c3nc([C@H](F)c4ccc(C(F)(F)F)cc4)no3)CC2)c1 512027377 UJXMLMSANQDIMR-MRXNPFEDSA-N 387.336 5.099 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nc(-c2ccccc2)cs1 515542931 IGOGVDUCJTXSJU-OAQYLSRUSA-N 380.472 5.967 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 518259325 ITFSGLYRMRBBQO-APWZRJJASA-N 397.519 5.459 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 518259328 ITFSGLYRMRBBQO-VQIMIIECSA-N 397.519 5.459 30 20 GKED CC[C@@H](NCc1cccc(NC(=O)c2ccc(C)cc2)c1)c1ccc(C#N)cc1 521536049 AOWICUZASLKZGW-XMMPIXPASA-N 383.495 5.360 30 20 GKED N#Cc1ccccc1CNc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 521884956 GBXXIKOJOVDUJW-XMMPIXPASA-N 381.479 5.148 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 532569923 AINZDPXQZIQSRK-RBUKOAKNSA-N 395.572 5.329 30 20 GKED CC(C)[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc2nc(O)oc2c1 537013716 PIASAWDBAZZZHU-DEOSSOPVSA-N 397.478 5.559 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(Oc4ccc([N+](=O)[O-])cc4)c3)cc2)CC1 537419535 CLJNQKISWGBLPL-UHFFFAOYSA-N 399.406 5.195 30 20 GKED Cc1c([C@@H](C)Nc2cccc(OCCCC#N)c2)cnn1-c1cccc(Cl)c1 537428422 ZCSUVVZATNGBCU-MRXNPFEDSA-N 394.906 5.690 30 20 GKED CCN(C(=O)c1coc(-c2ccccc2Cl)n1)[C@H](C)c1ccc(C#N)cc1 538432487 KLCAVTSNXFVAAK-CQSZACIVSA-N 379.847 5.090 30 20 GKED CC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(OC)c(OC)c1 540319302 YANLUTOATZZGSJ-HSZRJFAPSA-N 386.495 5.483 30 20 GKED N#Cc1ccc(CN(Cc2coc(-c3ccc(C(F)(F)F)cc3)n2)C2CC2)cc1 541389747 KHEQFOFAJPVNLN-UHFFFAOYSA-N 397.400 5.397 30 20 GKED C[C@@H](NC(=O)CCc1nc2ccccc2o1)c1ccc(-c2cccc(C#N)c2)cc1 542990311 PYQAGZMAWCAKQW-QGZVFWFLSA-N 395.462 5.176 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc3nc(C4CC4)sc3c2)C2CC2)cc1 543279596 CNIXIHMSRFUBDX-UHFFFAOYSA-N 388.496 5.242 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(Cc3ccncc3)no2)cc1Cl 547010765 FBLYVNKRWGHKGI-UHFFFAOYSA-N 388.814 5.040 30 20 GKED N#Cc1ccc(Cl)c(C(=O)NCc2nc(-c3cc4ccccc4o3)cs2)c1 552460380 JJWSIINIIHNUQA-UHFFFAOYSA-N 393.855 5.011 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)CCOCc1ccccc1 554440595 ALVLVSWYDMGIRD-ROUUACIJSA-N 397.544 5.055 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cc(C#N)cc(N(C)C)c2)cc1)c1ccccc1 555696975 IMFGBHNRCSPCCK-KRWDZBQOSA-N 384.483 5.050 30 20 GKED Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NCc1ccc(F)c(C#N)c1Cl 556338015 DFJRHWNFABGXBH-CQSZACIVSA-N 399.897 5.143 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4c(c3)CCC=C4)n2)cc1 556553511 GTALAMGOZKSMOY-HXUWFJFHSA-N 381.460 5.131 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1 557653367 QTTCLPUOESLYLB-IBGZPJMESA-N 391.490 5.014 30 20 GKED CC(C)(C#N)c1ccc(-c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1 564283190 XFKAEQCDUCDAIM-INIZCTEOSA-N 389.352 5.615 30 20 GKED Cc1cc(CN[C@H](c2ccc(Cl)cc2)C2C[C@@H]3CC[C@H](C2)N3C)ccc1C#N 574332912 JLMZZXBGOHNZJI-VTAUTDEMSA-N 393.962 5.224 30 20 GKED COc1ccc(CNc2ccnc(Oc3ccccc3)c2)cc1OCCCC#N 575171874 LEBNAWIYNHLNFX-UHFFFAOYSA-N 389.455 5.177 30 20 GKED COc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1C(F)(F)F 589960103 UVSSBVMKRAYNPS-UHFFFAOYSA-N 389.160 5.145 30 20 GKED CCOC(=O)c1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)ccc1Cl 590108913 GPPSOSBRRMXSJT-LJQANCHMSA-N 399.878 5.073 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 596694955 MRSWBSKXKVFMQG-OYRHEFFESA-N 387.483 5.047 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)C[C@H]1CCc2ccccc21 596734196 CPNNZBKLJJFZCM-SJLPKXTDSA-N 379.529 5.275 30 20 GKED Cc1c(C#N)cccc1NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 596803155 KXCAUFMOJKCRCX-UHFFFAOYSA-N 381.320 5.042 30 20 GKED CCCN(C(=O)NCc1cccc(C#N)c1)[C@@H](C)c1ccc(Cl)c(Cl)c1 604131142 WPOKNEBSXGQZAO-AWEZNQCLSA-N 390.314 5.548 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C3(C(F)(F)F)CC3)cc2Cl)c1 609062311 LPXSXBPYPSLMAZ-UHFFFAOYSA-N 394.780 5.072 30 20 GKED Cc1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)nn1-c1ccccc1 609177062 GWTQJVIATTZUCP-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@H]1CCCc2cc(OC(F)F)ccc21 609669863 YGYGWBKNHUOHAC-AWEZNQCLSA-N 383.320 5.063 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 609823548 ONFOEWYGTQSVJA-GOSISDBHSA-N 396.494 5.322 30 20 GKED CC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1cc(F)ccc1F 610146562 DVGSTLIEVMZTBV-OAQYLSRUSA-N 385.458 5.155 30 20 GKED Cc1ccc(-c2ncc(C(=O)N(C)c3cc(Cl)ccc3C#N)s2)c(C)c1 610794109 DEVPMNHTNWTHEP-UHFFFAOYSA-N 381.888 5.229 30 20 GKED CC(C)Sc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 613407478 URLNNKFBBOVUAL-HNNXBMFYSA-N 386.929 5.940 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)[C@H](Sc1ccccc1)c1ccccc1 618789809 PXLLOPTZWAJFDM-DHIUTWEWSA-N 384.504 5.195 30 20 GKED C[C@@H](NCc1ccc(OC(F)(F)F)c(Br)c1)c1cccc(C#N)c1 619427376 TXAUUFJYJWSLQB-LLVKDONJSA-N 399.210 5.070 30 20 GKED N#Cc1ccc(CNCc2cc(Cl)ccc2OCc2cccnc2)cc1Cl 619748734 MTUSCAUXXNYMAM-UHFFFAOYSA-N 398.293 5.129 30 20 GKED O=C(Nc1ccccc1OCCF)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 622628675 GVASQPOXIRACBT-UHFFFAOYSA-N 395.274 5.325 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3nccc4ccccc34)s2)c(C)c1 682995441 WBCVNGWQHMMQSR-LJQANCHMSA-N 383.476 5.465 30 20 GKED CCCCCCCCC(=O)N1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1 727855280 HCKDSCPURYUSBX-FQEVSTJZSA-N 387.568 5.106 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C/c1ccccc1C#N 728005584 ADKKALZRDGEBJS-FMIVXFBMSA-N 386.426 5.237 30 20 GKED CCOCc1cc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)ccc1OC 732571201 NEZGRKJWCJYNBZ-PKNBQFBNSA-N 379.481 5.251 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1Br 733266204 GAQCSTDERIIFFI-FQEVSTJZSA-N 391.268 5.111 30 20 GKED C[C@H](CNC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)C(C)(C)C 734674991 SAVCVQZVQLHNFD-QGZVFWFLSA-N 381.495 5.091 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735570520 TVVZRAYMGBNCSQ-UHFFFAOYSA-N 396.922 5.256 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(F)c1 736955542 MFMJWYTZUFJOEG-QFIPXVFZSA-N 387.458 5.538 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc(C)cc1 739153915 GNUUTAAQGYWINT-PBHICJAKSA-N 386.854 5.019 30 20 GKED Cc1cc([C@@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)ccc1F 742261453 YGZONWUHBJZDPK-HSZRJFAPSA-N 394.877 5.569 30 20 GKED CCC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1cc(F)ccc1F 743431347 XAYAVGZBIKCPRT-UHFFFAOYSA-N 380.320 5.153 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNc1ccc(Cl)nc1 743449717 FYWUXBPNAMUKRF-UHFFFAOYSA-N 394.693 5.041 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(OCc2ccccc2)cc1 746497183 BNLLXCWVGLTSJB-UHFFFAOYSA-N 388.471 5.259 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)n1 747198673 JUKFGZCTTMQSEY-BFHYXJOUSA-N 379.312 5.553 30 20 GKED Cc1cccc(CC2CN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)C2)c1 752634817 CBFPHOMTJBHENI-VWLOTQADSA-N 395.506 5.357 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@@H](C#N)C(C)(C)C 765633028 HOSYVVVDSOJOLA-LRDDRELGSA-N 392.908 5.098 30 20 GKED C=CCc1cc(CN[C@@H](C)c2cc(Cl)c(N)c(Cl)c2)cc(OC)c1OC 774442287 ZLILVWWCYOVWFQ-LBPRGKRZSA-N 395.330 5.172 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccnc(Cl)c2)cs1 782193826 JEANIRJTVXQPEX-VMPITWQZSA-N 397.887 5.081 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)Cc2ccc(C(F)(F)F)cc2)n1 786461846 YEOJNTPNOJISKB-HNNXBMFYSA-N 394.462 5.730 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ncc(C(F)(F)F)s2)cc1 788355102 LSFYKXXSENTUIE-KHPPLWFESA-N 389.398 5.734 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)c1 788361315 ZKSCVYVJZQCPIA-FNORWQNLSA-N 395.827 5.139 30 20 GKED N#C[C@H](C(=O)[C@H]1CC(=O)c2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 789349457 YRYKWFNTMVLNGE-DLBZAZTESA-N 392.867 5.010 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(F)cc2OCCC(F)(F)F)cc1 800312172 UAWLNOHUOKYQSU-UHFFFAOYSA-N 395.400 5.119 30 20 GKED C[C@H](OC(=O)CCCCCC#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 805695995 RTDNGUBZIZHZDC-LBPRGKRZSA-N 381.259 5.727 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3conc3Cc3ccccc3)c2)s1 815125722 MBCLRTGVAIECBM-UHFFFAOYSA-N 385.492 5.155 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nnc(C4CC4)s3)cc2Cl)c1 834549256 ZVTZOICDZRXCLM-UHFFFAOYSA-N 396.903 5.132 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(NCc2cccc(OCCCC#N)c2)cc1 858248389 YWKNXTVXAWEBNZ-UHFFFAOYSA-N 395.503 5.353 30 20 GKED CSCCCCCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 860507362 SXBJBSSJECDNGV-ZDUSSCGKSA-N 394.512 5.578 30 20 GKED CCc1oc2ccccc2c1C=NOCc1cc(-c2ccc(OC)cc2)no1 913031549 YQAOHJMZQJESKH-UHFFFAOYSA-N 376.412 5.210 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCc1ccc2ccccc2c1 920104275 OZYGLEPVUDEULW-OAQYLSRUSA-N 380.447 5.154 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(Oc2ccccc2)c(F)c1 1776086917 WUBLNPILVDTVNM-UHFFFAOYSA-N 378.403 5.461 30 20 GKED CCCCCCCOc1ccc(CN[C@H]2C[C@@H](CCC(=O)O)C2(C)C)cc1 1776789183 UAMFIAWXVNRLNP-CTNGQTDRSA-N 375.553 5.405 30 20 GKED CCCCOc1ccccc1/C=C/C(=O)c1ccc(OCCCC(=O)O)cc1 1776803758 OBGBEVWGDODDBZ-NTCAYCPXSA-N 382.456 5.005 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)c(OCCC)c1 1776819106 KCPYNHGTQFVZPS-PKNBQFBNSA-N 382.456 5.167 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC(C)C)cc2)c2cc(C(=O)O)oc12 1777361016 KPKKLBCKQBPJNA-POHAHGRESA-N 396.464 5.536 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1777372463 CFTUAEZQTLFYMP-DNPFKWNUSA-N 398.458 5.519 30 20 GKED O=C(Nc1cccc(/C=C2\CCc3ccccc3C2=O)c1)c1ccccc1Cl 6339700 NZRBCADFBPMBMR-NBVRZTHBSA-N 387.866 5.805 30 20 GKED CC(C)c1ccc([C@@H](NCC(=O)Nc2cccc(C#N)c2)c2cccs2)cc1 15362171 HBLYDFSYFDTEAT-HSZRJFAPSA-N 389.524 5.061 30 20 GKED C=CCN(Cc1ccccc1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 45934245 NGFJSOFVRQLBJU-UHFFFAOYSA-N 380.875 5.142 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(F)cc1 60933478 JCPMICAOTQFGKV-UHFFFAOYSA-N 379.275 5.530 30 20 GKED N#CC1(NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CCCCC1 61620645 YARVDLZZSJUUOF-UHFFFAOYSA-N 394.327 5.002 30 20 GKED CC(C)Cc1nnc(NC(=O)c2ccccc2Sc2ccccc2C#N)s1 69161280 UAIZHFNLBDODDI-UHFFFAOYSA-N 394.525 5.012 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(C)[nH]c3ccccc23)cc1 72072371 DBFYXUXUAXZASO-UHFFFAOYSA-N 397.434 5.401 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1nc2ccccc2s1 78665507 LFPTVKWCMLUHRI-CYBMUJFWSA-N 399.566 5.421 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@H](C)CC)cc2)nnc1-c1ccoc1C 104598575 SCZDNARTMGYOCA-OAHLLOKOSA-N 395.528 5.521 30 20 GKED COc1ccccc1[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccco1 121608536 BWBBJOSKSBGTMC-NRFANRHFSA-N 389.455 5.000 30 20 GKED Cc1noc(C2CC2)c1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 152907171 JPYIHYXYALRDTF-UHFFFAOYSA-N 375.453 5.136 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 155692643 ACKXZJJERSWFMN-AWEZNQCLSA-N 388.279 5.363 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 159280688 QCFWIPJMJMAZSS-APWZRJJASA-N 382.533 5.338 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 190934155 ZZTWHIWKWJIWGA-QGZVFWFLSA-N 382.470 5.981 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccncc2C(F)(F)F)s1 194548019 JRVHPSIVRUFGGR-UHFFFAOYSA-N 386.443 5.107 30 20 GKED C=CCn1c(SCc2cccc(OC(F)F)c2)nnc1-c1ccccc1F 215696226 XHPOZYZQIZPKKO-UHFFFAOYSA-N 391.418 5.164 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccccc3N3CCCC3)c2)c1 237855862 REPIKTAJGOCFGO-UHFFFAOYSA-N 383.495 5.350 30 20 GKED CO[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)[C@@H](C)C1 282662970 JWMNHTQIMKFLEQ-CVAIRZPRSA-N 397.906 5.027 30 20 GKED N#C[C@H](C(=O)c1coc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 303583197 KTNBFBXWDIPOFS-OAHLLOKOSA-N 378.840 5.700 30 20 GKED O/C(=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1)C1CCC(F)(F)CC1 328884791 NAQVNWAEHGQELJ-HNNXBMFYSA-N 397.466 5.253 30 20 GKED N=C(O)[C@@H]1CCCN1Cc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 328975071 BFEZBCSMZBBGTL-PMXSJFBMSA-N 383.536 5.381 30 20 GKED C[C@H](CC(=O)N1CCCC[C@H]1c1nc2ccccc2o1)/N=C(/O)C1CCCCC1 330022886 HTYSRNLXJDENPK-APWZRJJASA-N 397.519 5.197 30 20 GKED CSc1nc(C(C)C)nc(C)c1/C(O)=N/[C@@H]1CCC[C@@H](C(F)(F)F)C1 331043556 SDXOUFNSLPAZJG-VXGBXAGGSA-N 375.460 5.056 30 20 GKED CCCc1occc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 409643775 FRQHMNNFXSALGN-UHFFFAOYSA-N 378.403 5.074 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@@H]2C 410973989 IOFUIHYOIPDHOL-SFYZADRCSA-N 399.463 5.342 30 20 GKED N#CCSc1cccc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)c1 430986351 CQDJWUFCXARIFM-UHFFFAOYSA-N 376.485 5.010 30 20 GKED Fc1ccc(C#CCSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)cc1 433405902 JWBOBZXBMFZXCW-UHFFFAOYSA-N 388.471 5.044 30 20 GKED N#Cc1ccnc(NC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)c1 436010484 KNHDJVWUTMRMHG-UHFFFAOYSA-N 385.320 5.030 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H](C)CCC[C@H]1C 437965674 UFNHVBRQHLJKKT-IEBWSBKVSA-N 391.515 5.488 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 441534980 RYCVTQVTXFWWKK-YOEHRIQHSA-N 380.410 5.708 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)c1 455923833 VACMPGWZJBSNAW-IBGZPJMESA-N 387.405 5.531 30 20 GKED CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@H](CCCC#N)c1ccccc1)CCC2 458794588 BHRHXBSCKOCIHF-IEBWSBKVSA-N 396.560 5.159 30 20 GKED O=C(c1ccc(F)c(C(F)(F)F)c1)N(Cc1ccc(F)cc1)CC(F)(F)F 460469110 FVQCHVPPSPCUEU-UHFFFAOYSA-N 397.265 5.188 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 461538987 FTSPTWCTBANLLD-UHFFFAOYSA-N 386.295 5.263 30 20 GKED C=C[C@@](C)(CC)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 468025896 SJTWMRYMVIBGBD-IBGZPJMESA-N 378.394 5.111 30 20 GKED CC(C)C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccs1 469212339 LZMWCKGSBLPZOS-LJQANCHMSA-N 381.545 5.530 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2noc(C)n2)CCCCCC1 475547061 NLDLIBHPKKSMAQ-UHFFFAOYSA-N 396.535 5.601 30 20 GKED N#CC[C@@H](CC(=O)Nc1c(O)c(Cl)cc(Cl)c1Cl)c1ccccc1 476570638 JMXDBMGXIXNURC-NSHDSACASA-N 383.662 5.378 30 20 GKED C=CCn1c(SCc2ccn(C3CCCC3)n2)nnc1-c1ccc(Cl)cc1 477524851 DZMOPRMTWFWBME-UHFFFAOYSA-N 399.951 5.388 30 20 GKED CC(C)C[C@H](NC(=O)CNc1ccccc1SC[C@H](C)C#N)c1ccccc1 487400082 ZDVTVOCHHAFPOC-NQIIRXRSSA-N 395.572 5.254 30 20 GKED C[C@H](Sc1nc(C(F)(F)F)ccc1C#N)c1ncc(-c2ccccc2)o1 488800693 OIJQVNFKLKNTDR-NSHDSACASA-N 375.375 5.480 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C)(OCC)CC1)c1ccc(C(F)(F)F)cc1 489760559 ZXKNYVOEMXCCAK-GOSISDBHSA-N 398.469 5.313 30 20 GKED CCC(CC)(NCCCC1(C#N)CCOCC1)c1ccc(Cl)c(Cl)c1 499515148 NPIUPXAIEFCPCZ-UHFFFAOYSA-N 383.363 5.699 30 20 GKED Cc1cc(F)ccc1N(CCCC1(C#N)CCOCC1)Cc1cccc(C#N)c1 499541211 APDKGFQMACLLJU-UHFFFAOYSA-N 391.490 5.113 30 20 GKED CC[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 501455149 ZTOYPEHKMIJFDP-XMMPIXPASA-N 384.479 5.464 30 20 GKED N#CCSc1cccc(C(=O)N2CCCC[C@H]2CCCc2ccccc2)c1 502395045 VAIXBVJYKAYBCX-NRFANRHFSA-N 378.541 5.320 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(COc4ccccc4)cc3)CC2)cc1 504012310 BNPJUZWBYIPQKF-UHFFFAOYSA-N 394.474 5.067 30 20 GKED N#C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1F)c1cccc(Cl)c1Cl 505325180 GUNAXWMYIUJNEN-CYBMUJFWSA-N 391.151 5.146 30 20 GKED CCCOc1ccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1OCCC 505325930 QSMHXAHEFRLVMQ-MRXNPFEDSA-N 381.476 5.019 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)CC1 506935422 SIXWQJNETVCWRR-UHFFFAOYSA-N 383.879 5.077 30 20 GKED CCC1(c2ccc(Cl)cc2)CCN(C(=O)NCC(C)(C)CCC#N)CC1 513113282 MEGZDXIMDLPEHT-UHFFFAOYSA-N 375.944 5.123 30 20 GKED CCN(C(=O)Cc1coc2ccc3ccccc3c12)[C@H](C)c1ccc(C#N)cc1 514515129 CYOUGJUZGBZTKR-QGZVFWFLSA-N 382.463 5.610 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(OC3CCCC3)c2)c1 518906933 CSNSBVOUXLLGHT-UHFFFAOYSA-N 378.472 5.067 30 20 GKED CN(C(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1)C1(C#N)CCC1 520723963 FPDVVYOBHJJOTC-HXUWFJFHSA-N 384.932 5.067 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3cccc(OCCCC#N)c3)cc2)cs1 521807051 HQDWYEIPPRAKNV-QGZVFWFLSA-N 391.540 5.652 30 20 GKED C[C@@H]1CCC[C@@](C#N)(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)C1 523966549 ZZIHVVCKJTYUKK-MZNJEOGPSA-N 388.467 5.214 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C 524442602 SYTSHAGQBOAJNR-HXOBKFHXSA-N 391.515 5.488 30 20 GKED CCCCCOc1ccc([C@@H](C)Nc2c(C#N)nnc3ccccc23)cc1OC 524846762 HHAKKWPLEPUIIT-MRXNPFEDSA-N 390.487 5.252 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(Oc3ccccc3)nc2)c(C#N)s1 538072534 HBZVSNLUZAKHOR-UHFFFAOYSA-N 377.469 5.357 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2csc(Cc3ccccc3)n2)c(C#N)s1 540274472 RSQLOOXHZBBUAP-UHFFFAOYSA-N 395.553 5.146 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)c2ccc(Sc3ccccc3C#N)cc2)s1 541643285 YWXZUSPSHPWQQL-AWEZNQCLSA-N 393.537 5.008 30 20 GKED C[C@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(-c2cccc(C#N)c2)cc1 542941873 GZCFLPOWKWOOAE-HNNXBMFYSA-N 398.422 5.125 30 20 GKED Cc1ccc(C2CCN(C(=O)c3ccccc3Oc3ccccc3C#N)CC2)cn1 543085143 WXOPZXLVVNOVQT-UHFFFAOYSA-N 397.478 5.074 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 543776936 HMXFEZLPGDTTJE-VFNWGFHPSA-N 390.449 6.022 30 20 GKED CC(C)(C)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(F)cc1 544304554 FAYIJCJCDYCVRX-NRFANRHFSA-N 379.479 5.159 30 20 GKED C[C@H](NCc1ccc(Cl)cc1C#N)c1ccc(OCc2cccnc2)cc1 547833593 DUQLFQJGEPTYMU-INIZCTEOSA-N 377.875 5.036 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)cc(F)c2Br)cc1Cl 551099017 SZJWLKCBXDKVLX-UHFFFAOYSA-N 388.023 5.019 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)C[C@H](CC#N)c1ccccc1 553219801 MRYLQPJXPQMTBI-VCOUNFBDSA-N 376.500 5.082 30 20 GKED Cc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)c(-c2cnn(C)c2)c1 554918753 MJTOCJXXUHVUFZ-UHFFFAOYSA-N 392.506 5.224 30 20 GKED CCOc1ccc([C@H](N[C@@H]2CCc3ccc(C#N)cc32)C(C)C)cc1OCC 554997204 JJDPDLBBAVDULB-ZJSXRUAMSA-N 378.516 5.330 30 20 GKED CCc1c(C)sc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)c1C#N 560002070 OIVJKNFQENSYEY-UHFFFAOYSA-N 378.419 5.180 30 20 GKED C[C@@H](NCc1ccncc1OCc1ccccc1)c1ccc(C#N)cc1Cl 560570707 FSNHZQSYUXRSRV-MRXNPFEDSA-N 377.875 5.036 30 20 GKED Cc1cc2cc(CNC(=O)Nc3ccccc3SC[C@@H](C)C#N)ccc2[nH]1 562166741 WOHIVPQMKVSIEY-AWEZNQCLSA-N 378.501 5.050 30 20 GKED CCC[C@@H](C#N)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 564144660 PQQDWCUJDXOKHY-NSHDSACASA-N 396.343 5.203 30 20 GKED CCO[C@H](c1ccccc1)c1noc(-c2cn(CCCC#N)c3ccccc23)n1 572045414 RSRRSOSHCMSQOO-OAQYLSRUSA-N 386.455 5.121 30 20 GKED CC(C)[C@@H](CNC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 572537564 XEHKLQHZLIBSKY-UYAOXDASSA-N 395.572 5.049 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 573397397 XOSDXIAWBZDDMH-GOSISDBHSA-N 389.499 5.128 30 20 GKED COc1ccc([C@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)cc1 578638041 NKSVNYDEPHORLT-ZEQRLZLVSA-N 388.898 5.587 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1oc(C(C)C)nc1C 579147188 HALPXNOUNWVYKO-UHFFFAOYSA-N 389.455 5.118 30 20 GKED COc1ccc2c(c1)[C@@H](N(Cc1ccccc1)C(=O)CCCCCC#N)CCO2 588755458 JAXBAXRHWSTOTM-QFIPXVFZSA-N 392.499 5.022 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H](C2CC2)C1 588997682 QGJGIMGCLFQGIS-NRFANRHFSA-N 389.499 5.100 30 20 GKED N#Cc1cccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c1 603940470 FRYVDBYEELGTGX-FQEVSTJZSA-N 377.806 5.122 30 20 GKED CCc1cc(C#N)c(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)s1 604028848 VLMDVQAZIOTWET-UHFFFAOYSA-N 385.876 5.062 30 20 GKED CC(=O)Nc1c(C)ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1C 609126764 LILGZXKUSSPNEQ-UHFFFAOYSA-N 399.450 5.178 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1coc2cc3c(cc12)CCC3 609427739 HGRFODMUYGMYHW-HNNXBMFYSA-N 390.508 5.497 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2nc3ccc(Cl)cc3s2)c1 609496168 DDBCRZKDYBTTNC-UHFFFAOYSA-N 385.876 5.009 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)o1 609589222 QRUQMYLWPAEVTG-KFNAQCHYSA-N 377.271 5.023 30 20 GKED N#Cc1ccc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1Cl 611184251 XVUJPSDVASZONM-UHFFFAOYSA-N 389.814 5.525 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(OCc2ccccn2)c1 614179069 BIPGJTSJCJCOTA-IBGZPJMESA-N 385.511 5.313 30 20 GKED C=CCOc1cccc(CN[C@H](c2ccc(F)cc2)c2ccc(OC)cc2)c1 620759731 XEHIKIMQEGEAOV-XMMPIXPASA-N 377.459 5.278 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 623983601 GIELDMQBDPPOOX-BRPSZJMVSA-N 393.274 5.165 30 20 GKED C=CCn1c(SCc2csc(CCC)n2)nnc1-c1ccc(Cl)cc1 630301988 WCAMHEGIGASZRK-UHFFFAOYSA-N 390.965 5.486 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c(C)[nH]1 642281678 OTSOQLNUDSCCLP-CQSZACIVSA-N 390.295 5.552 30 20 GKED C=CCC1(NC(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)CCOCC1 665966549 IOBUALAMFHDLST-LJQANCHMSA-N 394.515 5.382 30 20 GKED C[C@@H](Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1nc(C(F)(F)F)cs1 681139844 OQZIJACMJMDBHN-SSDOTTSWSA-N 390.299 5.989 30 20 GKED CCCn1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc2ccccc21 682497934 KIDPQEGLFLBJKR-OAHLLOKOSA-N 377.444 5.290 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NCc1ccnc(Oc2ccccc2)c1 684254539 XPHPZSAXOVAXIQ-UHFFFAOYSA-N 387.483 5.162 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccccc3F)cc2F)c1 728175059 HLBLTHNMVOHODL-UHFFFAOYSA-N 395.434 5.224 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730417301 OUXQGCNAUOHKOI-RHSMWYFYSA-N 396.487 5.511 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730421534 LWMSSLLMIOOQHI-QGZVFWFLSA-N 396.487 5.478 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1nc2ccccc2s1 734117927 UJXCRFJNVBFFOZ-HNNXBMFYSA-N 383.476 5.326 30 20 GKED Cc1c(C#N)c(NC(=O)CSC2=Nc3ccccc3C2)n(C2CCCC2)c1C 740767180 MJRZJHGWAURCLC-UHFFFAOYSA-N 392.528 5.050 30 20 GKED Cc1ccc([C@@H]2CCCCN2CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 741792644 CXADOYFKRWCGFD-ICSRJNTNSA-N 389.524 5.008 30 20 GKED C[C@@]1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCc2ccccc2C1 742536624 BHFQUMGJXCVOOP-AOYPEHQESA-N 380.491 5.476 30 20 GKED Cc1ccc([C@@H](C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 742542053 CGUIQMXMGYYJCD-DNVCBOLYSA-N 378.859 5.639 30 20 GKED C#Cc1cccc(NC(=S)NCC[C@H](C)c2cccc(C(F)(F)F)c2)c1 746392468 FSOXUXHTRBWKFB-AWEZNQCLSA-N 376.447 5.167 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747194377 ZFFRWQRSGULOGZ-INIZCTEOSA-N 395.553 5.426 30 20 GKED C[C@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1F 753763387 PWWOVZWLXZBMHK-LHSJRXKWSA-N 395.478 5.382 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)c(Cl)c1 754408498 FMQZHTMOPHLICI-UHFFFAOYSA-N 375.042 5.006 30 20 GKED N#C[C@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc2ccccc2s1 756228671 SDTKOIIPOCUTOX-LLVKDONJSA-N 395.336 5.864 30 20 GKED C=CCC[C@@H](NC(=O)C(F)(F)c1nccs1)c1ccc(C(F)(F)F)cc1 756526298 FJZZKCGZNWUVOJ-CYBMUJFWSA-N 390.377 5.077 30 20 GKED C=CC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1ccncc1 756941903 GUDCPZYWQIIGEZ-QFIPXVFZSA-N 383.451 5.101 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 764840055 MIXVBKYKGGMYJG-QHCPKHFHSA-N 395.462 5.010 30 20 GKED COc1cc(Cl)ccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 772906022 AWAUYCAWQVJKLT-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC(C)C[C@@H](C)N(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc2[nH]ccc2c1 776873092 MUKQEYDXZXGITJ-GOSISDBHSA-N 385.511 5.804 30 20 GKED CN(C)C(=O)Sc1ccc(CSc2nc(C(F)(F)F)ccc2C#N)cc1 777570574 PFFTVHMGQUEWMW-UHFFFAOYSA-N 397.447 5.038 30 20 GKED CC(C)n1c(C(F)(F)F)nc2cc(C(=O)OCCCC(C)(C)C#N)ccc21 783681193 GXQMKTNIDRNLLB-UHFFFAOYSA-N 381.398 5.123 30 20 GKED Cc1cccc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1Cl 788080170 AFOCHMHHKOYMRI-ZDUSSCGKSA-N 375.280 5.331 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(SC)cc2Cl)cn1 792884869 GBWIBVVDPQINGC-JXMROGBWSA-N 396.899 5.424 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)OCC(C)(C)CCC#N 798878518 JCORLTZLNGVIDN-UHFFFAOYSA-N 380.366 5.156 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813212661 FNYWTZVRXZXNJG-KBXCAEBGSA-N 390.405 5.259 30 20 GKED CO[C@@H]1C[C@@H]2CC(=NNc3ncnc4scc(-c5ccc(F)cc5)c34)C[C@@H]2C1 819803064 GRHIDKFKAKLYEJ-HALDLXJZSA-N 396.491 5.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(F)(F)F)O[C@H](C)C1 879352574 WNENJFQTZIKKLS-RHSMWYFYSA-N 384.442 5.112 30 20 GKED COc1cc2c(cc1NC(=O)/C=C\C(=O)c1ccc(C)cc1)oc1ccccc12 900020717 GUORFZPBCBBZPR-QXMHVHEDSA-N 385.419 5.281 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2ccc(F)c(F)c2)cc1 915086575 LKMQEDHASNZKIV-IBGZPJMESA-N 394.446 5.351 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1cc2ccccc2o1 916138485 QYRQGWPYHUSYDF-OUKQBFOZSA-N 391.430 5.577 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCc1ccc(C)c(Cl)c1 916903615 PTOJVQHQLUYKCN-LJQANCHMSA-N 396.918 5.053 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNc1ncccc1Cl 917546403 LPWBUGDGRWQJQH-UHFFFAOYSA-N 394.693 5.041 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2c1 917712996 BLGIEYVOOTWMDO-UHFFFAOYSA-N 399.475 5.404 30 20 GKED N#C[C@H](C(=O)CCCOc1ccccc1F)c1nc2cc(Cl)ccc2s1 918492150 OKYCJEXEUDTFEU-CYBMUJFWSA-N 388.851 5.124 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(F)c(Br)c1 920065685 GALZLIVIDRDBRC-RQOWECAXSA-N 394.290 5.669 30 20 GKED C=C(C)C[C@@H](NCc1ccccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776139141 VYMPKLBLOJUWSN-QGZVFWFLSA-N 380.271 5.295 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 1776155515 UUOBUMGKDOMDBE-HSZRJFAPSA-N 399.918 5.684 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776473570 QXBWAUHCUGSAAV-XBNGYDHASA-N 378.468 5.482 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C)c2nc(C(=O)O)c(C)s2)cc1 1776787839 ALDLSNDXFXPXEP-HNNXBMFYSA-N 390.549 5.350 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3cccc(Cl)c3)cc2)oc1C(=O)O 1777423239 MZQGIQPVIIHDJH-YFHOEESVSA-N 396.826 5.415 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1nc2ccccc2c(C(=O)O)c1C 1777489963 MHUJUUILCHDHJH-KHPPLWFESA-N 394.496 5.200 30 20 GKED C=C(C)CC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C(C)C)cc1)C2 1798592081 DHWZFYOMACEVRW-KOUNCHBCSA-N 396.575 5.054 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(Cl)cc2)[n+]2ccccc2)cc1C 24033712 QPCRSVSMLKBABO-UHFFFAOYSA-O 395.935 5.295 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccccc1Br 25720383 MHGYMEBLTNEMLJ-UHFFFAOYSA-N 377.241 5.240 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@H]2CCCC[C@@H]2C)c1 27490065 RFWRHXWPOWVUAV-RXVVDRJESA-O 395.592 5.006 30 20 GKED Cc1ccc(C(=O)CCC(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)s1 29468228 BJZSXMYRNKKFQS-UHFFFAOYSA-N 375.449 5.164 30 20 GKED Cc1cccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 47565674 SKGKZONZMMGGHI-HXUWFJFHSA-N 390.874 5.021 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 54839330 NARZTLPUJJMECV-GOEBONIOSA-N 390.512 5.112 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)c1 56772724 QYLGIKYSNSMFPZ-UHFFFAOYSA-N 398.890 5.032 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1c[nH]c2cc(Cl)ccc12 66801596 SVYBNIYTPQLHFD-ZDUSSCGKSA-N 383.904 5.397 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1OC(C)C 66856266 DADKOJQRKXMZKT-OAHLLOKOSA-N 384.501 5.129 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 108407709 JDABZYICLCLCDI-DLBZAZTESA-N 395.572 5.502 30 20 GKED N#Cc1ccc(NCc2ccc(Oc3cccnc3)c(F)c2)cc1C(F)(F)F 111121159 IAQMCCOHGCRLBP-UHFFFAOYSA-N 387.336 5.516 30 20 GKED Cc1cc(-c2cc(C(=O)Nc3ccccc3C#N)c3c(C)noc3n2)c(C)s1 122228036 KBTTZKXZJMFKFH-UHFFFAOYSA-N 388.452 5.001 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 123095827 GJUBUAMPXDRZCL-GUYCJALGSA-N 388.920 5.425 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1)c1ccccc1 155762337 RYQAKSZDBPEHEC-RBTNQOKQSA-N 398.572 5.563 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1cccc(F)c1 170992207 ZTOMQNRHLIVBCD-HUUCEWRRSA-N 388.533 5.510 30 20 GKED N#CCCCCNC(=O)c1oc2ccccc2c1COc1ccccc1Cl 171500128 FIZNXCSELZBALE-UHFFFAOYSA-N 382.847 5.089 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c2c(C(C)C)noc2n1 171819176 HPQWLWWQKUIMNT-AWEZNQCLSA-N 394.500 5.301 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1nc2ccccc2o1 171980060 SNQLMTQLSMIGJN-INIZCTEOSA-N 390.345 5.388 30 20 GKED N#C[C@@H](C(=O)Cc1cc(F)ccc1F)c1nc(-c2ccc(Cl)cc2)cs1 173988549 WZJCTCLCGDTNQA-HNNXBMFYSA-N 388.826 5.161 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 185009624 NLOWAVRWDKOGKA-UZUQRXQVSA-N 398.466 5.361 30 20 GKED N#Cc1ccccc1-c1ccc(CS(=O)(=O)Cc2ccc(C(F)F)cc2)cc1 185708297 QKXJEZZEPXFMHR-UHFFFAOYSA-N 397.446 5.278 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2ncccn2)nc1C 189900009 CTKXQUWINMOULI-UHFFFAOYSA-N 378.501 5.013 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2o1)c1nc(-c2ccc(Cl)cc2)cs1 301765493 UEFNLKHRNCWNMV-OAHLLOKOSA-N 378.840 5.700 30 20 GKED N#Cc1cc2c(nc1N1CCC(c3nc4cc(Cl)ccc4o3)CC1)CCCC2 302000374 VZVHRLXASLJSFQ-UHFFFAOYSA-N 392.890 5.011 30 20 GKED OC(=Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)N1[C@H]2CC[C@H]1c1ccccc12 329792069 UXVNAAFHTIQVEH-YSSFQJQWSA-N 398.890 5.335 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)s1 421886584 SAXAIXDVFUUCCF-MRXNPFEDSA-N 385.945 5.564 30 20 GKED Cc1c(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)sc2ccc(C#N)cc12 428113792 ACNBESIWJFFCTJ-UHFFFAOYSA-N 391.496 5.318 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1csc(-c2ccc(Cl)cc2)c1 429801683 AWLSNESMCSBZKC-UHFFFAOYSA-N 381.888 5.020 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1ccc(-c2ccco2)cc1F)c1ccccc1 431904913 APONEDKAIYVZOE-OAQYLSRUSA-N 391.446 5.320 30 20 GKED CCCc1c(NC(=O)c2cccc(SCC#N)c2)cnn1-c1ccc(C)cc1 432558305 OLPZHNYGJMQHLH-UHFFFAOYSA-N 390.512 5.001 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 435097558 SNIFSJKKZZVWRZ-HUUCEWRRSA-N 397.466 5.620 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H](C)CCC[C@H]1C 437965678 UFNHVBRQHLJKKT-PKOBYXMFSA-N 391.515 5.488 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(CCC(F)(F)F)cc1 440295376 NBLAXZKSFYZTTK-UHFFFAOYSA-N 378.394 5.068 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CC1 441641108 CBAYZITWCQYKEN-UHFFFAOYSA-N 385.414 5.209 30 20 GKED CCCN(CCc1cccc(F)c1)C(=O)c1cn(CCCC#N)c2ccccc12 444221412 DOJOMUCQIIEELX-UHFFFAOYSA-N 391.490 5.179 30 20 GKED C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1C(=O)Nc1ccccc1S[C@H](C)CC#N 454748048 APBKPIPAAGLVGO-YJNKXOJESA-N 399.482 5.664 30 20 GKED CCCCn1ncc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C(C)C 455271602 HTKMKTCJOGTXFO-LJQANCHMSA-N 381.524 5.363 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1ccc(CC#N)cc1Cl 455740901 ZBOPLSDEIBOVEP-KRWDZBQOSA-N 395.812 5.530 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(Cl)c1 457585149 RYCWMAVHJFBTSD-AWEZNQCLSA-N 388.920 5.774 30 20 GKED C[C@H](C1CC1)N(Cc1ccccc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798333 HUUDURSTMRWYOI-XXBNENTESA-N 375.516 5.432 30 20 GKED C[C@@H](SCCC(=O)Nc1ccccc1C#N)c1ccc(Cl)c(Cl)c1 463206279 RMKXVPBQSFHJNI-GFCCVEGCSA-N 379.312 5.688 30 20 GKED CN(CCc1cccs1)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 464337889 CQDJJSSZKUZSDZ-UHFFFAOYSA-N 396.899 5.380 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21 467525852 QMUQVQDATDBCNZ-GOSISDBHSA-N 382.529 5.081 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](Sc1cccc(C#N)c1)c1ccccc1 468640157 VIRJFRHOVRBHQR-QFIPXVFZSA-N 388.492 5.429 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc2nc(-c3cccc(Cl)c3)sc2c1 470591808 UQUILRMJGJIZLA-GFCCVEGCSA-N 384.892 5.383 30 20 GKED N#Cc1ccc(CN(C(=O)CCCc2cccc(C(F)(F)F)c2)C2CC2)cc1 472028552 WKUSLULXDGPEFR-UHFFFAOYSA-N 386.417 5.091 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2cc(C)ccn2)CC1 475565837 QQLZIIDHKDCSNB-UHFFFAOYSA-N 393.531 5.317 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(Cc2ccccc2)nc1C 476130655 CTQPCYPPVOCVQU-UHFFFAOYSA-N 390.552 6.147 30 20 GKED C[C@@H](C1CC1)n1nccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 480863671 DLYCYNNMLCLFSU-HNNXBMFYSA-N 388.496 5.129 30 20 GKED N#Cc1ccc(Br)c(CN[C@H](c2ccc(Cl)cc2)C2CC2)c1 492581558 IIYBUJNQRORIRZ-SFHVURJKSA-N 375.697 5.215 30 20 GKED Cc1c(C(=O)Nc2cn(CC(C)C)nc2C(F)F)sc2ccc(C#N)cc12 493114709 SJIRMJIEJSBOQH-UHFFFAOYSA-N 388.443 5.124 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc(Cl)ccc3F)c2)cc1 501434371 IUMDWDXQZCYHAL-UHFFFAOYSA-N 394.833 5.376 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C)c(Cl)c3)n2)cc1 503540753 XZZGRZVZCIIWGB-INIZCTEOSA-N 382.872 5.271 30 20 GKED N#C[C@@H](NC(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccccc1F 505955438 WSVBKAOPPKXMFI-NHCUHLMSSA-N 376.456 5.040 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 507903655 TVNJNPKXVSOIST-ZDUSSCGKSA-N 376.378 5.106 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2cc(F)cc(F)c2)cc1 513948935 STXOTMDCDPEALI-UHFFFAOYSA-N 395.384 5.210 30 20 GKED C=CCc1cc(C(=O)Nc2nc(-c3cc(C)oc3C)cs2)cc(OC)c1OC 515459191 DQCRKZHOOHCZOF-UHFFFAOYSA-N 398.484 5.018 30 20 GKED CC(C)c1ccc(SCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 519414580 MMSBDZSHCNIVOE-INIZCTEOSA-N 384.570 5.793 30 20 GKED Cc1cccc(OCCCCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1 521015084 ITJMPAVHEGEBMJ-IBGZPJMESA-N 391.298 5.232 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c2)C1 521081704 MHPGLBJKMMUQFS-WZONZLPQSA-N 391.515 5.317 30 20 GKED CC[C@H](C)[C@@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 521111809 MYBNUAKQRFJXGJ-HNRNTVDCSA-N 390.527 5.194 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1ccc(C(C)(C)C)cc1 521731244 OQYKGBHBLKKTHK-IAGOWNOFSA-N 395.572 5.675 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)c2ccccc2Sc2ccccc2C#N)C1 522669713 DOSGTUSFBJQBOD-SJORKVTESA-N 382.554 5.113 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(Cl)ccc1N1CCSCC1 525344917 DGOCFOOKCNWRGS-UHFFFAOYSA-N 381.973 5.103 30 20 GKED COc1ccccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534912780 NXBIEFISPNNUOX-UHFFFAOYSA-N 378.815 5.265 30 20 GKED Cc1ccc(C(=O)C2CCN(Cc3cccc(OCCCC#N)c3)CC2)c(C)c1 535785476 HCIXSLBQIZQZRV-UHFFFAOYSA-N 390.527 5.081 30 20 GKED CC(C)C[C@H]1C[C@@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 537511928 DPRLWWFGLAITBF-UGKGYDQZSA-N 393.487 5.066 30 20 GKED N#CCCCOc1cccc(N[C@H]2CCCc3nc(-c4ccccc4)sc32)c1 538526720 WZPZWAAYBNYLHO-FQEVSTJZSA-N 389.524 5.982 30 20 GKED N#Cc1cccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)c1F 541307562 MNFHYRWZPYSONU-QHCPKHFHSA-N 399.469 5.287 30 20 GKED N#CCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC2CCCC2)cc1 541583732 WXKQLCRPDBEKOO-UHFFFAOYSA-N 395.484 5.195 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(Cc3ccncc3)no2)c1 545001990 FNCDQOSOHLXCLU-UHFFFAOYSA-N 388.814 5.040 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)C)s3)n2)cc1 545516169 RGBCSHHQYDUCRV-OAHLLOKOSA-N 382.510 5.494 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1OC(C)(C)C 554472692 DYPUTCXXKUPIAW-UHFFFAOYSA-N 384.524 5.252 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1sc(-c3ccco3)nc1-c1ccccc1)CC2 555770970 WGJZTPUANJSVJW-UHFFFAOYSA-N 397.459 5.145 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1oc3ccccc3c1COc1ccccc1)CC2 555772284 UNLLLPBESPADHI-UHFFFAOYSA-N 394.430 5.086 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)cn1 558271743 IPIMDXULQFIQPK-HOTGVXAUSA-N 375.447 5.180 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cc2ccccn2)ccc1C 558852267 JAWUXYMRRALRPO-UHFFFAOYSA-N 398.510 5.297 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)N[C@@H]2CC[C@H](C#N)C2)nc1-c1ccccc1 566616872 GVJAMCAUYQJFBW-UHOSZYNNSA-N 392.503 5.004 30 20 GKED Cc1c(C(=O)N[C@](C)(C#N)C2CCCCC2)oc2ccc(Br)cc12 573637413 RGLXKYSSBSWDQR-LJQANCHMSA-N 389.293 5.096 30 20 GKED N#CCCCCCC(=O)NCc1ccccc1-c1ccc(Cl)cc1Cl 588161422 IXEBKLWMNXENCF-UHFFFAOYSA-N 375.299 5.751 30 20 GKED N#CC1(CC(=O)Nc2ccc(Sc3ccc(Br)cc3)cc2)CC1 590126775 DDEGUUHMECLYCV-UHFFFAOYSA-N 387.302 5.233 30 20 GKED CCCOc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1OC 599930376 NLKWVKSPHSAFBM-LJQANCHMSA-N 381.476 5.041 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC[C@H](O)CC2(C#N)CCOCC2)cc1 600742102 JUAYABCETNWZKY-GHTZIAJQSA-N 396.556 5.023 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 608914896 FOAILUHZWQZAMC-UHFFFAOYSA-N 383.495 5.976 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)N(CCC#N)c2ccc3c(c2)OCCO3)cc1 609988314 SZRFXUDIMYEREU-GOSISDBHSA-N 392.499 5.022 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CC[C@H]2c2cccc(F)c2)cc1 610305177 KKVXZIKUQSBOQX-NRFANRHFSA-N 390.389 5.216 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)cc2ccccc21 610655094 SHQMGYDLASSRRR-JXVRESAISA-N 383.495 5.263 30 20 GKED N#Cc1cc(NCc2cccc(OCc3ccccn3)c2)ccc1C(F)(F)F 613268561 AMERFYJCLKDRGR-UHFFFAOYSA-N 383.373 5.163 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(OCc2cccc(OC)c2)c1C 666447134 NULGBCWDOIELMP-BGYRXZFFSA-N 392.499 5.298 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 676723681 DCXKBYZMYNHTDF-RDTXWAMCSA-N 377.410 5.168 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2cccc(F)c2)C2CCCC2)cc1Cl 726485144 VGVROZKHCGHTAB-UHFFFAOYSA-N 387.911 5.492 30 20 GKED Clc1ccc(-c2cnc(CON=Cc3ccccc3Br)o2)cc1 727470150 FDLAGAPALASJJB-UHFFFAOYSA-N 391.652 5.308 30 20 GKED CCc1oc2ccccc2c1C=Nn1c(S)nnc1SCc1ccccc1 730553518 ZRGBRYGNEQLTMO-UHFFFAOYSA-N 394.525 5.050 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731536668 JNPIXPPKTLKKGL-GAJHUEQPSA-N 385.467 5.273 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(OCc2cccnc2)cc1 732699310 HNHINGXLHIHPPC-UHFFFAOYSA-N 379.504 5.261 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)c(OC)c1 732714185 TVNICDLTKNFEDS-UXBLZVDNSA-N 375.424 5.096 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccc(-c3c(F)cccc3F)o2)SC1=S 734556109 JXONITFMRPJWSO-OVCLIPMQSA-N 377.437 5.002 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 737469242 HAPITYUIGXVDSF-LLVKDONJSA-N 395.459 5.099 30 20 GKED CN(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)[C@@H]1CCc2ccccc21 740483441 AOZPWVPNKLYTCA-OAQYLSRUSA-N 387.508 5.116 30 20 GKED C/C(=C\C(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 742559808 XHIWNZMIQVTMPP-NTCAYCPXSA-N 388.389 5.430 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccncc1 745826357 UTEMVTCXCYJOHE-OAQYLSRUSA-N 385.458 5.131 30 20 GKED CCCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)[C@H](C)c1ccccc1 746146368 ASRGODFNMNJGJK-NQIIRXRSSA-N 398.510 5.087 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCSc2ccc(Cl)cc2)n1 747193071 DGLAPIHQFMUPNZ-OAHLLOKOSA-N 378.950 5.669 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C(=C/c2ccc(F)cc2)c2cccs2)n1 747196789 BKBQATAEQHZLKU-KGZWWPETSA-N 396.512 5.884 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cc1OCCCC#N 747361615 RRQYFJJVNLNQMB-YWEYNIOJSA-N 390.266 5.581 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)C#Cc2ccccc2)nc1-c1ccccc1 747399620 SOFDNFJLANRTNG-OAQYLSRUSA-N 384.479 5.180 30 20 GKED CC(C)CN(CCC#N)C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 751374725 PYQDEWKPKLJTLK-UHFFFAOYSA-N 382.316 5.129 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 752159463 HIHOFLBNAHKCLW-MSOLQXFVSA-N 382.385 5.624 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1OC(F)F 753390106 JPTLMWQORWVSQR-GAJOTYCWSA-N 384.407 5.177 30 20 GKED N#CCc1ccc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1 758548040 SANQVUNIUVCRTN-HNNXBMFYSA-N 391.323 5.291 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 760789607 JHAAXXMEWBBPHF-JXMROGBWSA-N 396.418 5.248 30 20 GKED N#Cc1ccc(F)c(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)c1 761626002 NDABAZZTYKTLBY-UHFFFAOYSA-N 388.370 5.115 30 20 GKED C=CC[C@H](N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccncc1 766018746 GQQMSYXXQOCATF-QAPCUYQASA-N 379.485 5.686 30 20 GKED CN(Cc1cccc(N(C)C)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 770233140 XANQNIUJCDVGJA-DEOSSOPVSA-N 398.510 5.072 30 20 GKED O=C(/C=C/c1cncc2ccccc12)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 772803683 WGASEUODWVJAMZ-MFUYTVRRSA-N 391.442 5.218 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(CC(C)C)cc2)ccc1OC 772979024 JZJUQRPBBNKMOK-PGRDOPGGSA-N 380.532 5.425 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCOc3c(C)cc(Cl)cc32)c1 772984552 OJGOJHFDOBWSAJ-RXVVDRJESA-N 384.907 5.333 30 20 GKED CCCCc1ccc([C@H](C)Nc2ccc(N3CCC(O)CC3)c(C#N)c2)cc1 777117983 PVCDVIJDUGXIQJ-SFHVURJKSA-N 377.532 5.035 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cn(Cc2ccccc2)nc1C(C)(C)C 780781197 NIUZCKOIQAIAMX-GOSISDBHSA-N 388.515 5.132 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 781770259 KZTSFTSXIKJPMV-YUTCNCBUSA-N 396.434 5.087 30 20 GKED C[C@H](NC(=S)NCc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 782204842 LXYXTSSJHIJYRF-HNNXBMFYSA-N 377.538 5.012 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Br)cs2)c1 786851366 CNNALTFXXWFDJH-SWLSCSKDSA-N 379.323 5.042 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl 789454651 CVMCYLHYUZSKOY-UHFFFAOYSA-N 387.867 5.422 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)C[C@@H](CC#N)c1ccccc1 795990146 JOJTTXLSNXHGAA-NLWGTHIKSA-N 392.499 5.158 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)Cc2csc(-c3cccc(F)c3)n2)s1 797569955 BYNAEAUPFXVHEV-OAHLLOKOSA-N 399.516 5.122 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)/C=C\c3ccc(Cl)s3)cc2)ccn1 810821579 HGLXBAGTMYAFFL-VURMDHGXSA-N 381.844 5.112 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(c3ccsc3)C2=O)c(C(F)(F)F)c1 811624799 RJCJDWVKKZITNM-AWNIVKPZSA-N 396.440 5.044 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1cc(C(F)(F)F)ccn1 813215794 BTUQQJYLIPHOQE-OTWHNJEPSA-N 380.369 5.234 30 20 GKED CC(C)(C)OC(=O)N1CC[C@@H](NCC2CCC(C#N)CC2)C[C@H]1c1ccccc1 824333743 ZUXCVSGDIDIHJI-FGGKUVOCSA-N 397.563 5.047 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(OCc2ccccc2)cc1)c1nc(C2CC2)cs1 851100381 IBVKJSOKPUPUQL-FQEVSTJZSA-N 388.492 5.018 30 20 GKED Cc1cccc(Cl)c1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 864353027 CDVBNQDTDJXFCM-ZFWWWQNUSA-N 387.936 5.339 30 20 GKED N#CC1C/C(=C/c2scnc2C2CC2)C(=O)/C(=C\c2scnc2C2CC2)C1 899379408 HRXWUUNTKIRECU-DUGOVBPYSA-N 393.537 5.324 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(F)cc2F)ccc1OCc1ccccc1 916127756 XKSBJXZWUVEMCR-XFFZJAGNSA-N 380.390 5.449 30 20 GKED N#C[C@H](C(=O)CCCSc1ccc(Cl)cc1)c1ccc2ccccc2n1 916848451 KNUFKGRJVYHGKV-SFHVURJKSA-N 380.900 5.637 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccccc1SCc1cc(C)no1 918170892 SJYGGYOFUNCNEG-UHFFFAOYSA-N 396.487 5.243 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cc3ccccc3s2)cc1 920783107 LMMNCFGBMDFHMM-JOCHJYFZSA-N 397.503 5.878 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCCCC[C@@H]1c1ccc(Cl)cc1 1776050407 QOSYCEOWEKKQMN-QGZVFWFLSA-N 386.879 5.563 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C\C(=O)c2cccc3ccccc23)cc1 1776114294 LDPUEGJFYWYBOO-RAXLEYEMSA-N 398.414 5.606 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3cc(Cl)ccc3Cl)o2)c1 1777686200 VZMOCRLDLCYEIV-YVMONPNESA-N 387.218 5.848 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 6889016 AGRAQOIEZXGMNL-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2c(C)cccc2C)[n+]2ccccc2)s1 22694005 KLFKVZJRVCIUOU-UHFFFAOYSA-O 381.546 5.012 30 20 GKED C=CCNc1nnc(SCc2csc(Cc3ccc(Cl)cc3)n2)s1 32321071 YWLGQEKVBJHGCG-UHFFFAOYSA-N 394.978 5.129 30 20 GKED Cn1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)c(-c2ccncc2)n1 63275638 GLIYJNAFORBBNG-GORDUTHDSA-N 392.673 5.338 30 20 GKED COc1ccc(CNCC(C)(C)c2ccc(Cl)cc2)cc1OCCCC#N 64614227 JABZSVPPIAWQEN-UHFFFAOYSA-N 386.923 5.099 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccn3)cc2)cc1 69202947 JWNUZXREEBTKKN-JOCHJYFZSA-N 384.439 5.115 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl 108355038 CMYIPDDCGBQWIH-GFCCVEGCSA-N 394.327 5.296 30 20 GKED CCN(CCC(=O)Nc1cc(Cl)ccc1Cl)[C@H](C)c1ccc(C#N)cc1 110982794 UEGDKLMBJNRRDY-CQSZACIVSA-N 390.314 5.277 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(Cl)c(C(F)(F)F)c2)c1 113961258 CTHXGFZUMMGQJQ-HNNXBMFYSA-N 382.813 5.330 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 120798061 HGORZCYEEINEQL-UHFFFAOYSA-N 383.816 5.101 30 20 GKED FC(F)CSc1ccc(C(F)(F)F)cc1NCc1nccn1C(F)F 154940115 GRXJFBOJPOHICC-UHFFFAOYSA-N 387.324 5.266 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 170974599 DJDFSMZMUHANDR-GFCCVEGCSA-N 397.481 5.314 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(CC(F)(F)F)c1 174312591 VCIMMBSHFAAVEY-UHFFFAOYSA-N 378.394 5.020 30 20 GKED Cc1nc(NC(=O)c2cccc(NCC(C)(C)C)c2C)sc1SCC#N 177073693 LXYBMUDZAUBICU-UHFFFAOYSA-N 388.562 5.086 30 20 GKED C[C@H](Cc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 179224449 MTHJLHSKUQCYMC-OCCSQVGLSA-N 387.817 5.140 30 20 GKED CCN(C(=O)c1ccc(NC(=O)CC(C)C)c(C)c1)c1ccc(C#N)c(Cl)c1 179522984 RYIHSZZJRMDKJD-UHFFFAOYSA-N 397.906 5.171 30 20 GKED CCCCN(CCCO)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 181718308 QRUACSMSRDICNG-HXUWFJFHSA-N 399.922 5.012 30 20 GKED Cc1csc([C@@H](C)CNC(=O)c2ccccc2Sc2ccccc2C#N)n1 186044505 QNXLFABKEYTGGW-AWEZNQCLSA-N 393.537 5.008 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCSc3cc(C)c(C)cc32)ccc1OC 187338227 OPQZSLKXKOGTDX-ICSRJNTNSA-N 396.556 5.320 30 20 GKED COc1cccc(C(=O)/C(=C/c2csc(-c3cccs3)n2)c2ncc[nH]2)c1 187580460 OFLIDBUFAVAMTN-WJDWOHSUSA-N 393.493 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(N2CCCC2=O)ccc1Cl 189873146 IEVHDJFOQVIKED-UHFFFAOYSA-N 396.918 5.571 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2ccc(C)cc2)n1 189881147 KMNZNFRMBCQLJZ-UHFFFAOYSA-N 390.552 6.152 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-n2cnc3ccccc32)nc1 189895965 SLJJOIMZRJWMJM-UHFFFAOYSA-N 396.494 5.525 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1nc2ccccc2[nH]1 191439399 FJHNNEUPZYWCPW-UHFFFAOYSA-N 376.504 5.169 30 20 GKED CC[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(F)cc1F 303756639 NGRGENLNXFIVCT-JOCHJYFZSA-N 376.406 5.385 30 20 GKED C[C@@]1(C(O)=Nc2nc(-c3sccc3Br)cs2)CCCOC1 329358651 XDOVBKZZPQNYSJ-CQSZACIVSA-N 387.324 5.039 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@@H](C)[C@H](C)CC2 410976503 ATRUJAOMVBQJPE-SFYZADRCSA-N 399.463 5.342 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(CCCc2ccccc2)c1 426070633 DKFAVEXCLQEQOA-UHFFFAOYSA-N 387.483 5.403 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(-c3nc4cccc(Cl)c4s3)cc2)cn1 430818055 YDPWCMRUDBKOAR-UHFFFAOYSA-N 390.855 5.136 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c(F)c1 436402693 ZXOGCADIIHPKKN-MRXNPFEDSA-N 390.302 5.499 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccncc1)c1ccc(F)c(Br)c1 442403904 BEEYLZDCTAJWAU-CQSZACIVSA-N 391.284 5.119 30 20 GKED N#CCCCn1cc(C(=O)Nc2nc3c(F)c(F)ccc3s2)c2ccccc21 444351380 JZMFEVQTSNYCDR-UHFFFAOYSA-N 396.422 5.085 30 20 GKED CC1(C#N)CCC(NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)CC1 449234348 PQZNITWWSCBNMS-UHFFFAOYSA-N 380.363 5.020 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2SCCc3ccccc32)cc1 463144705 LMXFMTHEVIKNMV-QFIPXVFZSA-N 386.476 5.320 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1 465970152 SPRROWHVVKWJCK-HXUWFJFHSA-N 383.923 5.531 30 20 GKED C=C(C)C[C@H](C)C(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 466434300 KFTBBWRYYQWVLR-JTSKRJEESA-N 378.541 5.837 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)c(Cl)c1 469285457 UOUSOGDUUGKRSG-CQSZACIVSA-N 385.870 5.235 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)ccc1-c1ccoc1)c1cccc(C(F)(F)F)c1 471087092 RBXIEVGWMUKJGT-GOSISDBHSA-N 388.320 5.099 30 20 GKED CC(=O)c1ccc(Cl)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 475312613 CADCHGHDUMIKFC-UHFFFAOYSA-N 390.826 5.459 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(-c2ccccc2)ns1 475795316 QSDRGRLJLZCFNJ-AZUAARDMSA-N 388.496 5.114 30 20 GKED C[C@H](CC#N)NC(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 479967894 KXJZJCXJZCSYQW-GFCCVEGCSA-N 390.306 5.024 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CSc1ccc(C#N)cc1 482406888 ITAZNTLPODBJJL-GFCCVEGCSA-N 379.312 5.177 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cnc2ccccc12 484554888 ILXFABSTJXPVOT-SFHVURJKSA-N 394.459 5.028 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)s1 487331183 WUELRSNFRGMQGZ-UHFFFAOYSA-N 378.419 5.224 30 20 GKED C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487427121 HQVLVRCKCZRHMO-OXQOHEQNSA-N 382.891 5.100 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccccc1 487544223 QTGNGNFRXRLMFP-IBGZPJMESA-N 388.492 5.472 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3ccccc3n2CC(F)(F)F)n1 491211416 DCGCOHAIPNKBAG-ZDUSSCGKSA-N 391.418 5.274 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1ccc(C#N)cc1Cl 494638654 VSACAABSLQVGLY-UHFFFAOYSA-N 388.279 5.549 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2c(F)cccc2F)C(F)(F)F)cc1 506254276 MKCSLNMLKZYMLY-MRXNPFEDSA-N 397.347 5.191 30 20 GKED C=CCC(C)(C)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 508373319 YVWYVXMUVBGKPD-INIZCTEOSA-N 384.545 5.127 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC(C2CC2)C2CC2)cc1Cl 510023162 JHHYQQGMTBXLGU-IBGZPJMESA-N 379.891 5.306 30 20 GKED C[C@@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)NCC(C)(C)C#N 512906702 HYHGFWVEKUMRRP-HNNXBMFYSA-N 389.952 5.094 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCc1ccccc1)c1ccc(C(F)(F)F)cn1 513157073 YCZHVTSIUMWAFA-FQEVSTJZSA-N 394.396 5.376 30 20 GKED CSc1ccc(N(C)C(=O)c2cccc(COc3ccccc3C#N)c2)cc1 513279099 KQXUHVBCMIZVOO-UHFFFAOYSA-N 388.492 5.136 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3o2)cc1Cl 515240960 GALFXNHFFXSWDX-IBGZPJMESA-N 386.838 5.994 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCC(=O)c4ccccc43)cc2)cc1 517044549 BXNVLMATTPRYIQ-QFIPXVFZSA-N 382.419 5.049 30 20 GKED CC1CCC(CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 517228709 WNSRCXFWGCHWHD-UHFFFAOYSA-N 376.500 5.487 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1OC1CCCC1 519062611 BVXGWHDUOMODGI-UHFFFAOYSA-N 377.488 5.322 30 20 GKED Cc1cccc(CN(CC(C)C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 519449003 QQGRXEKLUVMNMS-LJQANCHMSA-N 395.572 5.937 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1[N+](=O)[O-] 521715794 ADXROMFRBVOLGF-UHFFFAOYSA-N 383.473 5.150 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(F)ccc1Br 521725383 AUYGSOPECQCDSD-NSHDSACASA-N 393.281 5.092 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 522702649 WNUXGDXKKCZQPN-XLIONFOSSA-N 381.501 5.146 30 20 GKED C=CCCCN(C)C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1 523024508 LIBIJGISOCABBK-UHFFFAOYSA-N 383.439 5.183 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(-c3nc4cc(F)ccc4n3C)cc2C)CC1 523446246 RUWRNXKWPCMONM-UHFFFAOYSA-N 392.478 5.118 30 20 GKED CCN(C(=O)c1sc(-c2cccs2)nc1C)c1ccc(C#N)c(Cl)c1 533676440 SEGDDQTXDNRNHJ-UHFFFAOYSA-N 387.917 5.372 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)cc1 535387128 BIBIKPROVLWDJF-UHFFFAOYSA-N 396.372 5.162 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 542149306 DNOICPGRHZNWNA-HGMXIMQMSA-N 399.350 5.694 30 20 GKED C[C@H](NC(=O)N(C1CC1)[C@H](C)c1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 543943245 FWYHVLYNLGUNID-ZWKOTPCHSA-N 399.494 5.814 30 20 GKED N#CCCN(C(=O)c1ccc(C(F)(F)F)cc1)C12CC3CC(CC(C3)C1)C2 545886541 OJYNFEQBMUOVJW-UHFFFAOYSA-N 376.422 5.030 30 20 GKED COc1ccc([C@H](Cc2ccncc2)Nc2cccc(OCCCC#N)c2)cc1 556887105 ZNZWWXUIMHZHBN-DEOSSOPVSA-N 387.483 5.169 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc(-c2ccccc2)cs1 564509721 GWKIUOQXAXJYBM-LBPRGKRZSA-N 383.885 5.496 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)sc1-c1ccc(F)cc1 588348332 JGOFYUCJJSKUTJ-HNNXBMFYSA-N 392.480 5.962 30 20 GKED CCN(CCSC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 592219865 ZSUIGTXQKPFUPV-GOSISDBHSA-N 387.936 5.212 30 20 GKED CC(C)n1c([C@@H]2CCCN(C(=O)CC3(C#N)CCCCC3)C2)nc2ccccc21 597213585 DZRYQXOBPHSVOI-LJQANCHMSA-N 392.547 5.187 30 20 GKED Fc1ccc2ccc(=NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)[nH]c2c1 608079034 AXXPRHMKEDYFQD-GHMZBOCLSA-N 380.307 5.117 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 608553126 UMYITFMUICTQDK-ZDUSSCGKSA-N 385.489 5.348 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H]3CCc4ccc(F)cc43)c2)cc1 609323046 YWAMSSMZFXDZLC-JOCHJYFZSA-N 387.414 5.299 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3c[nH]c4ccc(F)cc34)c2)cc1 609644126 YLQKVINTWUCJSQ-UHFFFAOYSA-N 385.398 5.152 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)c1cc2ccccc2n1CC#N 609755712 QZQBSRZUUZHRQF-UHFFFAOYSA-N 395.462 5.305 30 20 GKED CC(C)(C)OC(=O)C[C@](C)(C#N)C(=O)Nc1cccc(Sc2ccccc2)c1 611540491 JOPNIPIHHHUFEG-JOCHJYFZSA-N 396.512 5.038 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)NCc1ccccc1OC1CCCC1 615705773 WHNBZLLWKYMSCY-UHFFFAOYSA-N 382.479 5.045 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1oc2ccccc2c1C 615707817 OOHOXIXDKSUTMZ-QGZVFWFLSA-N 378.472 5.209 30 20 GKED C[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccc(F)cn1 647323569 ZHLNLEYTQBEYSM-VIFPVBQESA-N 384.270 5.683 30 20 GKED CCC(CC)(CNC(=O)c1ccccc1SCC#N)c1ccc(Cl)cc1 725760269 RASMEITWHPLFHF-UHFFFAOYSA-N 386.948 5.443 30 20 GKED N#CCn1c(C(=O)OCc2csc(C3CCCCC3)n2)cc2ccccc21 729767272 ZAKWIWKZYYDZPA-UHFFFAOYSA-N 379.485 5.026 30 20 GKED CCCCCCOCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 730920513 MUKMLMZQEKSNCY-INIZCTEOSA-N 376.909 5.237 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)CCc1ccc(C#N)cc1 733072400 NYIGEYPGTRTUTA-INIZCTEOSA-N 376.481 5.227 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCc3ccc(Cl)c(Cl)c3)[nH]c12 735789769 QEIZUMGASGPYDA-AWEZNQCLSA-N 386.282 5.377 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cnc(-c4ccccc4)nc3)c2)s1 740011624 PCXWLYYSUJJJDL-UHFFFAOYSA-N 382.492 5.034 30 20 GKED COc1ccc(OC(F)F)c(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1 741469764 MSUAVJSQXICXRU-FNORWQNLSA-N 381.378 5.255 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc(Cl)c1OC 741472471 JMPKMEMGDFNDLH-VOTSOKGWSA-N 379.843 5.315 30 20 GKED COc1ccccc1[C@@H](C)S[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1 742455093 JRQHUARWCKLSNX-QZTJIDSGSA-N 382.529 5.133 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2s1 743216012 CHKUGMGUOUMBGE-JTQLQIEISA-N 390.390 5.069 30 20 GKED Cc1ccccc1C1CC(=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C1 743440465 PKNWTZHKFHGYTR-UHFFFAOYSA-N 397.404 5.211 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(C(C)(C)C)cc2)ccc1OC 743477179 PNFSSVSFMBGTII-UWJYYQICSA-N 380.532 5.524 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744016550 OLYPRUPQXZUANP-GAJOTYCWSA-N 386.398 5.595 30 20 GKED N#C[C@H](C(=O)CCCOc1ccccc1Cl)c1nc(-c2ccccc2)cs1 748003669 GHIYDZXOTGGVPU-MRXNPFEDSA-N 396.899 5.499 30 20 GKED CC[C@H](Oc1ccccc1C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 750689902 NDZCENJMXGKSAC-ZBFHGGJFSA-N 384.888 5.292 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c1ccc2ccccc2c1 753396983 WWYGNXLUBBRRMB-SBUREZEXSA-N 398.506 5.416 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(SCc2ccccc2)cn1 753898067 HVPAFLSBWKSLLV-UHFFFAOYSA-N 376.510 5.054 30 20 GKED C[C@H](C#N)CN(C(=O)c1sc2cc(Br)ccc2c1Cl)C1CC1 754173822 AZBVIGHSQXKRQN-SECBINFHSA-N 397.725 5.081 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C\c2ccc(Cl)nc2)cc1 758652198 HZDLXJKGNALEDN-SDQBBNPISA-N 375.815 5.051 30 20 GKED Cc1ccc(C2=CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)cc1 762291869 WWSCCTQJPXVMMT-UHFFFAOYSA-N 378.475 5.463 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COC/C=C\c3ccccc3)n2)cc1 763479771 XKKAKYADGLCIJU-VORVDVFJSA-N 388.492 5.025 30 20 GKED Cc1cc(C(=O)Nc2ccc(Cl)c(C#N)c2)ccc1NC(=O)OC(C)(C)C 772032867 MMBYRUVDKXJYHC-UHFFFAOYSA-N 385.851 5.119 30 20 GKED N#CC1(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)CCCCC1 780483495 MBARDDWFZWGYRA-UHFFFAOYSA-N 376.428 5.379 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl 780682408 VSOINMCQJQPTRT-QWRGUYRKSA-N 396.249 5.306 30 20 GKED C[C@@H](OC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 784865122 OVSQTSINGNHHHK-GFCCVEGCSA-N 386.329 5.150 30 20 GKED C=CC[C@@H](NC(=O)N(CC=C(C)C)Cc1ccc(Cl)cc1)c1ccncc1 798414417 MUNSMSNDBKFSHT-OAQYLSRUSA-N 383.923 5.530 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCC[C@H]([C@@H]4CCOC4)C3)nc2c1 799111574 TZLOHCHCBKWGQQ-NWDGAFQWSA-N 383.439 5.310 30 20 GKED CCOC(=O)c1csc([C@H](C#N)C(=O)CC2CCC(C(C)(C)CC)CC2)n1 802056412 NEHWDOMPEZSBBT-UYSNPLJNSA-N 390.549 5.129 30 20 GKED COc1ccc(NC(=O)c2cc(F)c(C(F)(F)F)cc2F)c(C(F)(F)F)c1 804276831 FGQPYRQLNCGOGK-UHFFFAOYSA-N 399.237 5.263 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N(C)CC(C)(C)C#N)cc3C2)cc1 836490548 FPACOZNXQOHKKZ-UHFFFAOYSA-N 390.531 5.344 30 20 GKED CO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CCC1 850763455 APSFHAYLKRJPFF-CXAGYDPISA-N 395.311 5.108 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C[C@@H](C)C1(F)F 860424543 IUGAWWFYEYELAP-JXXFODFXSA-N 383.442 5.097 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CC[C@@H](c2ccccc2)C1)c1nc2ccccc2n1C(F)F 860478264 TZKOWLUSCXMASH-ZACQAIPSSA-N 379.410 5.192 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 862718775 PFUGIZDNKICCCY-GOSISDBHSA-N 380.488 5.640 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)Oc3ccc(F)cc3)n2)cc1 915101905 OCRZUBOUAJMGHF-SFHVURJKSA-N 394.471 5.292 30 20 GKED CCc1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915352732 JYZPJIMJRSPWJG-DEOSSOPVSA-N 383.495 5.568 30 20 GKED CCOc1c(Br)cc(/C=C/C(=O)c2ccc(F)c(F)c2)cc1OC 916127760 XORBWUHVVRRSHQ-QPJJXVBHSA-N 397.215 5.031 30 20 GKED COc1cccc(/C=C/C(=O)c2ccc(Br)s2)c1OC(C)C 916134629 UOXUOEDMHRKPAH-BQYQJAHWSA-N 381.291 5.203 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4ccc(C#N)cc4)c23)cc1 916357242 GUPJDOYWCCYLPP-UHFFFAOYSA-N 399.479 5.075 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4ccc(C)o4)c23)cc1 916357558 XTOWXXADBCFNGI-UHFFFAOYSA-N 378.457 5.104 30 20 GKED O=C1c2cccc3cccc(c23)C(=O)N1c1ccc(N=Cc2ccccc2O)cc1 916662379 GUYRXRJDAZSKHJ-UHFFFAOYSA-N 392.414 5.097 30 20 GKED N#C[C@@H](C(=O)CCCSc1ccc(Cl)cc1)c1ccc2ccccc2n1 916848442 KNUFKGRJVYHGKV-GOSISDBHSA-N 380.900 5.637 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2oc3c(ccc4ccccc43)c2C)c1 916897572 KMLQDYBVGKGPMS-HXUWFJFHSA-N 382.419 5.164 30 20 GKED CCCCCCCC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 918357023 MLEMKWUALKJECF-UHFFFAOYSA-N 384.486 5.147 30 20 GKED Cc1cccc(OCCCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 920112671 GJNOOXFFLYAQSD-QGZVFWFLSA-N 398.915 5.684 30 20 GKED CCCCCCCOc1ccc(C=NNc2ccc(C(=O)O)cc2OC)cc1 1776049842 OVSWMWDODLKBIR-UHFFFAOYSA-N 384.476 5.189 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc2ccccc2c1 1776131432 QVAGZOUNEWMTNP-FLIBITNWSA-N 384.387 5.400 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776388624 UUQRSXQYTSSZHW-DHZHZOJOSA-N 392.407 5.034 30 20 GKED C[C@@H]1C/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776589687 RQRVVHOQQCMHFK-FEMWLQECSA-N 382.459 5.754 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cnc(-c2ccccc2F)s1 1776785681 RIRUBDODBPPXTD-OAHLLOKOSA-N 378.513 5.243 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCCC[C@H]1c1ccc(C(=O)O)n1C 1776786877 YOBKTGMKCLVPIP-HKUYNNGSSA-N 376.541 5.164 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(Cl)c(Br)c1 1777436130 KPIOCNWHBAZDAA-QPJJXVBHSA-N 379.637 5.005 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H](C)CC)CC1 1829068131 GOVIYLXFVLSZAQ-PZJWPPBQSA-N 390.612 5.035 30 20 GKED CCOc1ccc(-n2c(SCCCC#N)nnc2-c2cccc(C)c2)cc1 5279570 KJNIUCCNRHMESY-UHFFFAOYSA-N 378.501 5.037 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1F 41514773 GKGNVZVLPWFIHW-CQSZACIVSA-N 386.835 5.101 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(C)ccc2C)cs1 54897323 ZXKMPHIUKZWEJQ-FMIVXFBMSA-N 390.508 5.649 30 20 GKED COc1ccc(CCCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 61165773 SXRDTJDTMLMWKF-UHFFFAOYSA-N 376.481 5.257 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2)cc1)[C@H](C)c1ccc(C#N)cc1 105909118 SKQVZRSOIMXQAW-LJQANCHMSA-N 384.479 5.361 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1cc(-c2ccccn2)ccc1Cl 119342559 GSEBSZJHPKZENR-QHCPKHFHSA-N 389.886 5.047 30 20 GKED CCCCCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128817413 RNCVADBDZRMQCQ-LJQANCHMSA-N 391.496 5.264 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)nnc1C1CC1 161953457 PVULWISBDZETQF-LBPRGKRZSA-N 386.908 5.503 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1c(Cl)cccc1Cl 170985982 YNYWNBROZBJKKV-LBPRGKRZSA-N 395.311 5.263 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCCc2nc3ccccc3s2)n1 177762614 RVEPHWWBHKQQPG-CQSZACIVSA-N 383.542 5.465 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)ccc1OCC(C)C 181599243 YJKHLQMGLSJSBR-ZWKOTPCHSA-N 382.504 5.044 30 20 GKED C[C@H](NCc1ccc(Cl)cc1C#N)c1cccc(NC(=O)c2ccccc2)c1 187413007 ROBYEZKAQJHGFB-INIZCTEOSA-N 389.886 5.315 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccccc1 188065079 PJJWZLMOTHSGRU-QHCPKHFHSA-N 378.516 5.132 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(Br)c1F 192291096 ZAGTYAPFEKWBTI-LLVKDONJSA-N 393.281 5.092 30 20 GKED N#CC1(CCCN[C@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CCOCC1 367532187 YGJFFYOJOWYQPY-OALUTQOASA-N 380.454 5.032 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@H]2C 410973988 IOFUIHYOIPDHOL-JGVFFNPUSA-N 399.463 5.342 30 20 GKED C=CCC1(C(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)CCOCC1 424786493 UDQMABHYHCFEDX-SFHVURJKSA-N 383.557 5.055 30 20 GKED C=CCOc1ccccc1CN[C@H](Cc1cccnc1)c1cccc(Cl)c1 426050096 KSPKVFZMGZZIQR-JOCHJYFZSA-N 378.903 5.373 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(F)cc1OCC1CC1)c1ccccc1 432954608 INTLLGKCRCIWTB-IBGZPJMESA-N 381.451 5.171 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CC=C(c3ccc(Cl)cc3)CC2)c1 434250504 RMPTWADSHLGFEL-UHFFFAOYSA-N 394.902 5.077 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CN[C@H](c1ccc(F)cc1)c1cnc2ccccc2c1 436303536 CVXMZPIYAHIBPV-IEXUWNMDSA-N 376.475 5.034 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)CC[C@@H]1c1ccccc1 438067851 QOQVVRYQANQRIT-NLFFAJNJSA-N 395.506 5.139 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 438670161 VPVKHFTWYYBUOO-ILXRZTDVSA-N 399.482 5.429 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1sccc1Br 448941063 CAMUTEVNLDYTSU-LLVKDONJSA-N 395.347 5.086 30 20 GKED CC[C@H](CC(F)F)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457750609 MGBJVEODXFVHAB-BXKDBHETSA-N 391.302 5.497 30 20 GKED CCN(C(=O)[C@@H](C)c1cccc(Br)c1)[C@@H](C)c1ccc(C#N)cc1 462143683 ZJZHKSIAOJEIEQ-GJZGRUSLSA-N 385.305 5.034 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)N(CCC(F)(F)F)CC(F)(F)F 468518898 YLSLDQRNSHERTJ-LLVKDONJSA-N 395.265 5.066 30 20 GKED CC(C)[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)c(F)c1 469235769 MANAOFUTZSWVGO-QHCPKHFHSA-N 397.469 5.357 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1cccc2ccccc12 469407426 FRNUGDHYFHZAAW-IAGOWNOFSA-N 390.508 5.498 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 471171755 AXFCENACMQLCBE-UHFFFAOYSA-N 394.393 5.390 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(Br)cc1)c1ccccc1 475022406 JFGGYXZBWTYHHN-AZUAARDMSA-N 397.316 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(Cc2ccccc2)C[C@@H]1C 475577285 DEFPHDWDCLAMHI-FQEVSTJZSA-N 391.559 5.277 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C[C@@H](C)c1ccccc1)[C@@H](C)CO 482076047 MPCLVTKNDAOLLR-UXHICEINSA-N 394.559 5.557 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)N[C@H](c1ccc(F)cc1)C(F)(F)F 482503919 VSOIGAMTTXSJRM-GDBMZVCRSA-N 393.302 5.282 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C(=O)Nc1sc(C)c(C)c1C#N 482549911 DQEULMQALHASCK-UHFFFAOYSA-N 398.919 5.004 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cc(C(F)(F)F)ccc1F 484319176 NZQFKEQTFPAOHQ-LBPRGKRZSA-N 379.275 5.519 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cnn(-c2ccccc2Cl)c1C(C)C 485727498 VZPGGFVNYASBRF-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)N[C@H](CCCC#N)c1ccccc1 487597383 UNCBMCZMHCVHKH-OAQYLSRUSA-N 388.467 5.038 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CSCc1ccc(F)cc1C#N 488571559 SZVWSXANBBXJCZ-UHFFFAOYSA-N 384.520 5.816 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 488856117 OTFPTHQQKPXXGD-AWEZNQCLSA-N 388.920 5.143 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 500089111 PBMXMMSZUIZRMS-UHFFFAOYSA-N 381.451 5.071 30 20 GKED COc1cc(NC(=O)c2sc3ccc(C#N)cc3c2C)ccc1OC(C)C 500362343 SMEACAZGCJGWBP-UHFFFAOYSA-N 380.469 5.130 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(-c3cccc(Cl)c3)o2)nc2ccccc21 501340557 KCMWOBPHKWTFIC-ZDUSSCGKSA-N 396.903 5.779 30 20 GKED CC(C)CN(C(=O)NCC1CCC(C#N)CC1)[C@H](C)c1ccccc1Cl 503922716 YDBDMRJFOSOQPO-WWDZGPRUSA-N 375.944 5.399 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503964778 IFWMNMZPHDVMLQ-OAHLLOKOSA-N 382.916 5.008 30 20 GKED N#C[C@@H](NC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1ccccc1F 505955439 WSVBKAOPPKXMFI-RTWAWAEBSA-N 376.456 5.040 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cc(C#N)ccc1Cl 506743648 MJTMTRZIGUZYTJ-GFCCVEGCSA-N 381.888 5.135 30 20 GKED N#CC1(c2ccccc2)CCC(NCCc2ccc(Br)s2)CC1 507629604 KELHLLWGBJCSAR-UHFFFAOYSA-N 389.362 5.047 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1CSC1CCCCC1 509723726 ZEPFGPFWMOMIEK-MRXNPFEDSA-N 384.545 5.620 30 20 GKED N#Cc1cccc(F)c1CC(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F 511465130 RCCNDUYDWVUDHN-IBGZPJMESA-N 390.380 5.012 30 20 GKED CC(C)Cn1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c2ccccc21 517456299 KPIKMCQMHVMZGH-KRWDZBQOSA-N 391.540 5.801 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c[nH]nc3-c3ccc(F)cc3)cc2)c1 518237886 JUIQUAJQPSCPRJ-UHFFFAOYSA-N 398.397 5.132 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)c1ccc(F)cc1 518757088 WHZPZRFPPCCLIX-OAHLLOKOSA-N 385.508 5.319 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3[C@H]4CC[C@H]3c3ccccc34)c2)cc1 527021337 HJVCCEVZLFJDGB-ZEQRLZLVSA-N 380.447 5.169 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 530832583 LOIPONGAGISCPL-UHFFFAOYSA-N 397.356 5.325 30 20 GKED Cn1cc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c(-c2ccccc2)n1 538034466 JPBQTKXSHOQLAK-UHFFFAOYSA-N 394.434 5.003 30 20 GKED C=CCCOCCCCC(=O)N1CC[C@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 538282717 LRVOFRJQFUUGNI-OXJNMPFZSA-N 383.454 5.378 30 20 GKED Cc1ccc(C)c(Oc2ccc(CN[C@H](C)c3ccc(C#N)c(F)c3)cn2)c1 538506894 KBOPEXWUFJBUPC-QGZVFWFLSA-N 375.447 5.352 30 20 GKED CCN(C(=O)c1cc(C)n(-c2cccc(Cl)c2)n1)c1ccc(C#N)c(Cl)c1 538563896 BEWSCIQWWXMWIU-UHFFFAOYSA-N 399.281 5.026 30 20 GKED CC[C@@H](CC#N)NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 547292705 DCYVGIAJRZZEGN-AWEZNQCLSA-N 396.409 5.418 30 20 GKED COc1ccc([C@@H](Cc2ccccc2)NC(=O)C[C@H](CC#N)c2ccccc2)cc1 555172121 UHHUEWXOKFPJBQ-UKILVPOCSA-N 398.506 5.183 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cn1 555926143 GQEKOKUHZRRULV-UHFFFAOYSA-N 375.453 5.132 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 557895596 WBBRNWGOBKSNGR-HKBOAZHASA-N 394.396 5.343 30 20 GKED Cn1cc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c(C2CCCCC2)n1 562875713 MICYFIVQTSFWDY-UHFFFAOYSA-N 391.397 5.002 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCSC2)cc1Cl 579040063 FAYMUQDREOHANZ-BEFAXECRSA-N 399.947 5.260 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(Cl)s1 579655118 CCDORHBQJOVAOL-GFCCVEGCSA-N 383.860 5.203 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC4(CC3)CC4(F)F)c2)cc1 593155977 DXRQSUOESRJKDE-UHFFFAOYSA-N 383.398 5.004 30 20 GKED CC(C)c1ccccc1N(C(=O)CCCCC#N)c1nc2ccccc2s1 593940935 GMOBBEMHDWRMPM-UHFFFAOYSA-N 377.513 6.168 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(-c3nnc4n3CCCCC4)c2)cc1 594505237 QYJXQANTRWMPMS-UHFFFAOYSA-N 385.515 5.085 30 20 GKED N#CC1(CC(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)CCCCC1 597653417 FJQHAPLXYGPBNP-UHFFFAOYSA-N 399.947 5.212 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)C1 598410027 JFYVBJLVSMJFOP-ODTUPPAISA-N 399.519 5.159 30 20 GKED C[C@@H](CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)c1ccccc1 602148294 QLLHQIAKBTXTAS-KRWDZBQOSA-N 384.435 5.198 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4ccc(F)cc4s3)cn2)cc1 603765384 TYEZAUMVPJTRAL-UHFFFAOYSA-N 389.411 5.352 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCc1ccc(Cl)cc1Cl 608917361 ACYHVOUVSVZHRU-UHFFFAOYSA-N 390.314 5.028 30 20 GKED CCc1c(C)sc(NC(=O)CCCCc2nc3ccccc3s2)c1C#N 609032906 MBWNEKKQESPPEQ-UHFFFAOYSA-N 383.542 5.452 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2SC2CCCC2)cc2ccccc21 609162628 FJYHQBXHBWFUGP-UHFFFAOYSA-N 375.497 5.452 30 20 GKED CCCN(C(=O)c1ccc(OC(F)(F)F)cc1)c1cc(Cl)ccc1C#N 609285833 GNQYXAPMFJGILB-UHFFFAOYSA-N 382.769 5.167 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCC2(CCCCC2)CC1 609388503 RGJUPPCDNVOOPI-GOSISDBHSA-N 385.577 5.066 30 20 GKED Cc1cccc(C)c1OCCCNC(=O)Nc1ccccc1SC[C@H](C)C#N 609398423 OUFWKXFUAGDFCK-MRXNPFEDSA-N 397.544 5.146 30 20 GKED CN(C)c1ccccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723085 KUMYKGCYXTWXEW-UHFFFAOYSA-N 391.858 5.322 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccsc1 609970596 UXOYUAKMYXKUSB-CQSZACIVSA-N 380.444 5.080 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3sc4c(c3C#N)CCCCC4)c2c1 610167939 DXOISXGKUVXWIY-UHFFFAOYSA-N 391.496 5.006 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CC1CC1)c1ccccc1 610324157 AWXMBVCKIUUDFZ-UZLBHIALSA-N 379.529 5.744 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1sc2c(c1C#N)CCCCC2 612539719 MUIQAOGVKCSDAR-UHFFFAOYSA-N 387.508 5.511 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(OC)c(F)c1 666866056 GZSHESKWRNUCRQ-OAQYLSRUSA-N 396.506 6.055 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3cccs3)c2)n1 675835618 ZLOKBZXDDCQYRS-JOCHJYFZSA-N 387.508 5.220 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)c(Cl)c1 677198058 CCFUBHRVEFJGEV-UHFFFAOYSA-N 395.245 5.348 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCC#N)c1ccccc1Oc1ccccc1 725743544 MAVALXUSGVYQHF-QGZVFWFLSA-N 388.492 5.586 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(-c2ccccc2F)s1 728440822 WCZJCDKPPPNICF-SREVYHEPSA-N 381.259 5.491 30 20 GKED Cc1ccc(Cl)c(NC(=S)N(CC(C)C)c2ccc(C#N)cc2)c1Cl 728445838 VKSRRACHXVWKOD-UHFFFAOYSA-N 392.355 6.033 30 20 GKED Cc1cc(COc2ccc(/C=C3/CCc4ccccc4C3=O)cc2)oc1C(=O)O 729936343 ACCDQCAAQMTHRP-AQTBWJFISA-N 388.419 5.078 30 20 GKED Cc1cc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)c(C)s1 730952472 WWBQWTGARZVBEF-YVMONPNESA-N 382.437 5.131 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 732700282 OMNCMYNFTVCIRH-UHFFFAOYSA-N 387.524 5.634 30 20 GKED C#CCCOc1ccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc1 733325259 HDZHGPMHZYBNJQ-UHFFFAOYSA-N 377.434 5.246 30 20 GKED COc1cc(/C=C2\CCOc3c(Cl)cccc3C2=O)cc(Cl)c1OC 733749498 YLOHRYSOBJDXNV-XYOKQWHBSA-N 379.239 5.059 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2csc(-c3ccc(Cl)cc3)n2)c1 733800552 ZCOJQARTTLOREM-LJQANCHMSA-N 397.931 5.434 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)c(C)c(Cl)c2)c1 733844337 JFLHXQWZMWGQCH-OAHLLOKOSA-N 392.286 5.305 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680113 QOZIKWKKROJIFM-RDTXWAMCSA-N 377.410 5.120 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cccc(Cl)c3Cl)c2)s1 739596050 PBZCYAYVJBENBT-UHFFFAOYSA-N 387.291 5.524 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2ccc(-c3ccccc3OC)cc2)c1 741502966 MGUDFWJYHQHVAB-KRWDZBQOSA-N 386.520 5.391 30 20 GKED C[C@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 743038363 YJFFNKADAHXBPK-HNNXBMFYSA-N 391.471 5.537 30 20 GKED Cc1cccc(-c2nn(CN(C)C[C@H](C)C#N)c(=S)n2[C@H]2CCCC[C@H]2C)c1 746707147 XWKDXLLSGPSYTB-GGPKGHCWSA-N 397.592 5.190 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 749322428 DNRWEPCSOKMCMM-BEFAXECRSA-N 391.496 5.067 30 20 GKED COc1ccc([C@@H](C)CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 749910515 FOVYZGIYZMAJTH-MHECFPHRSA-N 384.479 5.483 30 20 GKED N#Cc1csc(C(=O)O[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 752195006 HNXPOBDHSSICAE-LBPRGKRZSA-N 379.281 5.099 30 20 GKED COc1cc(C(C)=NNc2nc(C(F)(F)F)cs2)ccc1SC(F)F 755902669 FPOPELHTFYHYQZ-UHFFFAOYSA-N 397.394 5.321 30 20 GKED CCn1c(NC(=S)Nc2c(C)cc(C)cc2Cl)nc2cc(C#N)ccc21 763294890 UOJKVLLSOAVTLO-UHFFFAOYSA-N 383.908 5.007 30 20 GKED N#CCOc1ccc(CNCc2ccccc2Oc2ccc(F)cc2Cl)cc1 763463737 HNYIOZICHWLDIX-UHFFFAOYSA-N 396.849 5.464 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2SCCCS2)cc1)c1nccc2ccccc12 792095948 YOAHZPGKIGLLGU-LJQANCHMSA-N 390.533 5.594 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)cc1 797571886 WQRJNKPZGZDTRT-FZMZJTMJSA-N 391.334 5.183 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 797942750 IFFOMMGRAWANPY-FZMZJTMJSA-N 380.847 5.465 30 20 GKED N#C[C@H](C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1nc2cc(F)ccc2s1 802077337 RCSZBOJWKNPAON-DOMZBBRYSA-N 396.340 5.341 30 20 GKED CN(C)c1ccc(C#N)cc1CNc1ccccc1CN(C)C1CCCCC1 864026104 QEMKUTGSGOAXBR-UHFFFAOYSA-N 376.548 5.001 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2F)o1)c1ccc2ccccc2n1 916848837 JBIQTJKFSVQTCF-IBGZPJMESA-N 384.410 5.443 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)cc1 919825247 DIKOJHNQRJUASR-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3F)c2)cc1 920064683 IXFUDLYRXVDOEP-JYRVWZFOSA-N 387.410 5.203 30 20 GKED O=C(O)c1cccc(NN=Cc2sc(Sc3ccccc3)nc2Cl)c1 1776037304 WVMKZPNUQNBUIG-UHFFFAOYSA-N 389.889 5.092 30 20 GKED Cc1cc(C=NNc2ccc(F)c(C(=O)O)c2)c2c(C)ccc(C(C)C)cc1-2 1776062005 ZHAHCICNUADXDL-UHFFFAOYSA-N 378.447 5.815 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)cc1 1776119849 NDEPZTBNTIVVSW-XFFZJAGNSA-N 387.273 5.341 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)cc1 1776125658 PAWOPMSRHFKBFI-SHRNQRGKSA-N 398.474 6.015 30 20 GKED O=C(/C=C\c1cc(F)c(C(=O)O)c(F)c1)c1ccc(Oc2ccccc2)cc1 1776126588 QBIWJZLFDBPYGO-WDZFZDKYSA-N 380.346 5.351 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1F 1777403152 BRQAUCQIZMGSSY-VQHVLOKHSA-N 398.480 5.870 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777566928 ZPINNJQTEKQLRJ-FMCGGJTJSA-N 393.442 5.065 30 20 GKED O=C(O)c1ccc2scc(/C=C3/Cc4c(ccc(Cl)c4Cl)C3=O)c2c1 1777685684 UFVZKARMTQSBPL-YHYXMXQVSA-N 389.259 5.729 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)Nc2cccc(C)c2)cc1 27173923 HYIPHDPOFKUFFN-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCCCc2ccccc2)cc1 48161414 XJCTUSSPLFBPGN-UHFFFAOYSA-N 399.494 5.086 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(CNc3snc(Cl)c3C#N)c2)c1 52472940 AZHDFMSYEQJELP-UHFFFAOYSA-N 397.891 5.233 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccc(F)cc2)cs1 54895558 QODNSMYISGNKMS-FLIBITNWSA-N 384.407 5.002 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2c(C)cccc2C)c1 55011435 MMQCJOUCJVGLIV-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66800428 BGWPNRRPVCKXSJ-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED COc1ccc2oc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c(C)c2c1 66800877 IAPNIYZJFSZWBD-CYBMUJFWSA-N 380.469 5.396 30 20 GKED N#CCCCOc1cccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)c1 123811505 UFABCAJYHYEUEY-UHFFFAOYSA-N 383.662 5.582 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 160970541 ZIBJXVICZWHFMF-FUHWJXTLSA-N 390.936 5.019 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1csc2ccccc12 171740700 QSQGXJIEFVHAPT-OAHLLOKOSA-N 395.553 5.817 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)c1cccc(O)c1 173116250 LXFUGQDAQLMLMG-CVEARBPZSA-N 383.517 5.259 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)c2ccc(Br)s2)n1 177765470 QSMJYVSEXZDYBL-ZJUUUORDSA-N 383.336 5.070 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)C2CC2)cc1 180143437 OYABOFQHFDJYIG-UHFFFAOYSA-N 391.805 5.010 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1cc(F)cc(F)c1 187539570 WWTVYZQVVURAFX-CYBMUJFWSA-N 392.496 5.088 30 20 GKED CN(CCC#N)c1ccc(CNCc2ccc(OC3CCCCC3)cc2)cc1 237206445 CXMAZYUFSDGUDI-UHFFFAOYSA-N 377.532 5.038 30 20 GKED CC1CCC(N(CC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)CC1 303368756 JIIIJDUHSDQCOB-LXPRWKDFSA-N 385.577 5.062 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2ccc3nc(C(C)C)sc3c2)no1 329389958 SDLLXESZNLZQTK-INIZCTEOSA-N 399.520 5.274 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2/C(O)=N/[C@@H](C)c2nc(C3CCCCC3)no2)cc1 329768860 HCUMXEBBTJWTPL-VDGAXYAQSA-N 397.519 5.611 30 20 GKED CC[C@H]1OCCC[C@@H]1C(O)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 330245273 KPFVWONLTQDCDC-QFBILLFUSA-N 376.472 5.787 30 20 GKED Cc1cc(-c2ncccc2NC(=O)c2sc3ccc(C#N)cc3c2C)cs1 429878951 IOIBTQOWAXPYRY-UHFFFAOYSA-N 389.505 5.766 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1c(F)cc(F)c(F)c1F 432589407 VDASPTQCUZZWQR-UHFFFAOYSA-N 380.385 5.417 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1csc([C@H](C)OCC)n1)c1ccccc1 435104161 DPSGHOIACCUDOE-QFBILLFUSA-N 387.549 5.090 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccc(C(F)(F)F)cn1 435468493 DBQQJIGODCXXLE-INIZCTEOSA-N 399.347 5.155 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1cccc2ccccc12 435856376 NIZVYIJAFAZLGM-IAGOWNOFSA-N 390.508 5.640 30 20 GKED C[C@H](Oc1ccc(C#N)c(Cl)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 438907905 RBENNHBFHRLDQT-VIFPVBQESA-N 394.645 5.708 30 20 GKED CN(C(=O)c1cccc(SCC#N)c1)c1ccc(C(F)(F)F)cc1Cl 439123089 JQTRSJFGHWKWDF-UHFFFAOYSA-N 384.810 5.251 30 20 GKED CC(C)c1c(NC(=O)NCC2CCC(C#N)CC2)cnn1-c1ccc(Cl)cc1 441745992 YRWJPHGZXHSSSJ-UHFFFAOYSA-N 399.926 5.101 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443884697 OAUPQOBMWYQDBK-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 443948108 UXHINIAQYNICJN-CYBMUJFWSA-N 382.851 5.162 30 20 GKED C=CCC1(C(=O)N2CCC(C(=O)c3c(F)cc(F)cc3F)CC2)CCCCC1 449874829 XPMLKHZAPPWTQL-UHFFFAOYSA-N 393.449 5.052 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3cccc(Cl)c3)CC2)c(Cl)c1 455700317 ASRGONRDNQCSCL-UHFFFAOYSA-N 388.298 5.471 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)[C@H](C)c2cccc(C#N)c2)ccc1Br 462345409 XQQQYKVSWFSDFP-QRWLVFNGSA-N 397.316 5.096 30 20 GKED C[C@H](C(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccc(C(F)(F)F)cc1 466356126 MVVDFRLWKBRMMJ-QMMMGPOBSA-N 395.274 5.327 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1)c1ccccn1 466976851 LKOZHOKSGBAVOL-MRXNPFEDSA-N 383.234 5.671 30 20 GKED C=CC[C@H]1N(C(=O)c2sc(NC(=O)c3ccco3)cc2C)CCCC1(C)C 470289010 REJYOUZQUQFRJJ-MRXNPFEDSA-N 386.517 5.109 30 20 GKED COc1cc(C)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1F 478044670 HULSMTZIBVBROY-UHFFFAOYSA-N 394.377 5.198 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)[C@H](C#N)c3cnc4ccccc4n3)cs2)cc1 483195646 IMFMURQTPAMSAN-QGZVFWFLSA-N 398.491 5.367 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 487239522 JHMTYOREMPMMLN-KNQAVFIVSA-N 378.516 5.437 30 20 GKED N#CCCC[C@@H](NC(=O)CSc1cccc(C(F)(F)F)c1)c1ccccc1 487515134 ODFVBWFTBSKHRG-GOSISDBHSA-N 392.446 5.349 30 20 GKED N#CCCC[C@@H](NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccccc1 487541214 SXHWIRNKTISWHP-GOSISDBHSA-N 397.450 5.253 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2ccccc2Cl)n1)c1ccc(Cl)cc1 499851248 WLRCHHJEOBZCDF-OAHLLOKOSA-N 388.279 5.112 30 20 GKED CC(C)N(Cc1ccc(-c2ccccc2F)s1)C(=O)Cc1ccc(C#N)cc1 501017166 WPWDADDCCJUSLP-UHFFFAOYSA-N 392.499 5.406 30 20 GKED COc1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)c(C(F)(F)F)c1 503048248 AVJCRCALQQBIEU-UHFFFAOYSA-N 381.247 5.124 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cc1 504075086 XNIUTOICXIOSHP-UHFFFAOYSA-N 387.826 5.057 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(CC(C)C)[C@H](C)c1ccccc1Cl 504129275 SXMPOCPSNZDDKV-UWVAXJGDSA-N 378.944 5.050 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(F)cc1OCC(F)(F)F 506870341 FSXDHIZCMFMLPA-UHFFFAOYSA-N 396.384 5.029 30 20 GKED C=C[C@@H](CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 507278118 DNLQDEGMFRWGBK-CVDCTZTESA-N 385.511 5.490 30 20 GKED N#Cc1cc(F)cc(C2(c3nc(-c4ccc(Oc5ccccc5)nc4)no3)CC2)c1 508051197 FNPPBFWRBNXDQG-UHFFFAOYSA-N 398.397 5.015 30 20 GKED C=CCSCCNC(=O)N(C)[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 509179055 POQKXKUCHUZSAY-MRXNPFEDSA-N 389.590 5.049 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl 516838989 YMWRHRCLZXLTCU-GFCCVEGCSA-N 392.286 5.091 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1ccc(C#N)cc1 518736909 QXMLGXLYXGKMTP-JLTOFOAXSA-N 395.915 5.423 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cn1ccc2ccc(Cl)cc21 518739267 VTBBTYUQKKSQSB-AWEZNQCLSA-N 383.904 5.328 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@@H](c3ccccc3)C3CCCC3)cc2)nc1 518884733 LJSKZMFKDGRTFW-DEOSSOPVSA-N 397.478 5.407 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 520865596 KOQVZFMEGGEYDT-CZAAIQMYSA-N 386.520 5.834 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCSC[C@@H]1c1ccccc1 522458699 URFQOTJDNGBQOY-VQIMIIECSA-N 397.569 5.260 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1OC1CCC1 522826975 WKXPDYFKWHWWJU-UHFFFAOYSA-N 390.936 5.231 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCc1cc(Cl)sc1Cl 537820494 VKVJKADAZUVODH-UHFFFAOYSA-N 382.316 5.047 30 20 GKED CC(C)C(=O)Nc1ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)cc1 538690061 JUEMPKOPQALKCV-UHFFFAOYSA-N 399.450 5.197 30 20 GKED Cc1sc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 539496128 IILQJFLXXXODOQ-UONOGXRCSA-N 381.932 6.055 30 20 GKED C[C@H](NCc1noc(C2CCCCC2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541085182 MYURKUXPQOSOGL-KRWDZBQOSA-N 386.499 5.507 30 20 GKED N#CCC1CCN(Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 541921796 RYOQRKMEWSSFAP-UHFFFAOYSA-N 385.851 5.166 30 20 GKED C=CCC(C)(C)c1noc(CSc2nnc(-c3ccccc3)n2[C@@H](C)CC)n1 551136348 LBXXKXKCJHFRSE-HNNXBMFYSA-N 397.548 5.445 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3c[nH]c4ccc(F)cc34)CC2)cc1Cl 554344443 QYIBWCRQAQVYIB-UHFFFAOYSA-N 396.853 5.244 30 20 GKED C[C@@H](CCOCc1ccccc1)NC(=O)Nc1ccccc1SC[C@H](C)C#N 554440590 ALVLVSWYDMGIRD-MSOLQXFVSA-N 397.544 5.055 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2cccc(Cl)c2)CC1 570252468 NWPUGRYBVNBZPF-AWEZNQCLSA-N 385.920 5.545 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2csc(-c3cccc(F)c3)n2)c1 589382734 YRCKVWBOTUWNEI-UHFFFAOYSA-N 382.460 5.085 30 20 GKED Cc1cc(C)cc(Oc2cccc(F)c2NC(=O)N2CCC(C)(C#N)CC2)c1 593254671 UVGVBKGBTILKTC-UHFFFAOYSA-N 381.451 5.392 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@@H](C)NC1(c2ccc(C#N)cc2)CCC1 594514577 IRBXEAWTARJISZ-GOSISDBHSA-N 375.516 5.068 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184954 ZCRVEBXEDCIHGW-XMMPIXPASA-N 381.479 5.159 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 604087413 ICGODBYCRYMQDO-UHFFFAOYSA-N 375.403 5.154 30 20 GKED CCN(C(=O)Nc1cccc(C#Cc2cccs2)c1)[C@H](C)c1cccnc1 604612334 NKMGJWXVRSEOLS-QGZVFWFLSA-N 375.497 5.158 30 20 GKED N#CCc1ccc(NC(=O)NCc2ccccc2-c2ccc(Cl)cc2)cc1 608863039 QRWSHUROZWRBIM-UHFFFAOYSA-N 375.859 5.395 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 609222095 SLKQLMZAZDGKMR-GOSISDBHSA-N 399.494 5.913 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 609398064 AWCIFTZKUXSQAX-QVKFZJNVSA-N 397.519 5.740 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(OCc2ccccc2C#N)cc1 609647417 NAFLIKFXJSJVJU-CYFREDJKSA-N 396.490 5.155 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(COC3CCCC3)cc2)c1 610093303 INYHUCLQAUVMFT-UHFFFAOYSA-N 393.487 5.472 30 20 GKED C[C@H](NC(=O)[C@H](Sc1ccccc1F)c1ccccc1)c1cccc(C#N)c1 610359589 KRVHEYZHBXLYJN-KSFYIVLOSA-N 390.483 5.408 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)C1 612370318 QVYLRWOIOOENJR-QHCPKHFHSA-N 387.508 5.243 30 20 GKED CC(C)n1nccc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494319 JGXKSOWRGKZZGQ-UHFFFAOYSA-N 397.294 5.006 30 20 GKED CCc1oc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1C 675513344 YEAJPTRZJPLBGZ-NSHDSACASA-N 378.375 5.269 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CNC2(c3ccccc3)CCC2)c1=S 728708228 ZWZASOYHUZVSEZ-UHFFFAOYSA-N 394.519 5.033 30 20 GKED C#CCOc1ccc(CN[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1 733327700 CDHIPWLRLXUVBO-QGZVFWFLSA-N 376.525 5.290 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCc1ccc(OCC#N)cc1 733419581 CFOUNDDJFYDZKP-UHFFFAOYSA-N 398.871 5.031 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)c2ccc(Cl)s2)c1 734013119 MJNHTJPLRRGOCO-GOEBONIOSA-N 391.924 5.033 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cccc(Nc3ccccc3)c2)c1 735658319 BXAXCLRXEXMHJF-QFIPXVFZSA-N 385.467 5.041 30 20 GKED COc1ccc(C(=O)/C=C\c2cnc(C(C)(C)C)s2)cc1Br 736432686 DVMPYLOQLPWDGD-SREVYHEPSA-N 380.307 5.108 30 20 GKED N#Cc1nnc2ccccc2c1Oc1ccc2c(=O)c(-c3ccccc3)coc2c1 740864878 QKGWDWBEWQKGRD-UHFFFAOYSA-N 391.386 5.067 30 20 GKED Cc1c(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cnn1-c1ccc(C#N)cc1 741845507 XLLKWVTVJGJJGH-QXMHVHEDSA-N 396.475 5.072 30 20 GKED O=C(/C=C/c1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1F 743056829 MUMCSHXYNNEMEI-LERPRCHQSA-N 378.802 5.072 30 20 GKED CCOc1cccc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 745267860 AKGQDTVQGKBHQY-MHECFPHRSA-N 399.494 5.623 30 20 GKED COc1cccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1OC(F)F 745989836 CFHLEZVKKZJVQC-KTKRTIGZSA-N 381.378 5.255 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Oc2ccc(Cl)c(Cl)c2)n1 747194109 SKIIWWOGSDYZAB-PWSUYJOCSA-N 383.300 5.217 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 748535575 FHSXBSYHOJFGPF-RPWUZVMVSA-N 394.478 5.509 30 20 GKED CCS[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748942208 NGWNMVPSQWOECI-PCCBWWKXSA-N 379.529 5.138 30 20 GKED Cc1cccc(CC2CN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)C2)c1 752634808 CBFPHOMTJBHENI-RUZDIDTESA-N 395.506 5.357 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)nc1Cl 753006533 ZWSOZBMHCHCCGQ-UHFFFAOYSA-N 390.855 5.136 30 20 GKED CC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)cc1C 756909325 NOJZVTFCIVFEGK-UHFFFAOYSA-N 399.450 5.178 30 20 GKED C=C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 759207476 BINUOBCVAFXUGJ-UGSOOPFHSA-N 387.266 5.001 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 759216686 FKDCOFMWIIPPPH-BJRSVTDJSA-N 378.884 5.743 30 20 GKED C=CCSc1ccccc1C(=O)NCC[C@@H](O)c1ccc(Cl)c(Cl)c1 760688168 ACZDUUWGFNDRPH-QGZVFWFLSA-N 396.339 5.125 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C=C2CCSCC2)cc1Cl 772232199 MZXNTVHRPBPXDJ-LJQANCHMSA-N 382.916 5.387 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](NCc2cc(C#N)ccc2F)CCC3)cc1 773030371 PKKIYCYZUFVOJV-LJQANCHMSA-N 377.488 5.297 30 20 GKED CC(=O)CCCCCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 773983796 OJGCICPNZLNALS-CQSZACIVSA-N 396.434 5.421 30 20 GKED C[C@H](Nc1ccc(OCc2cn3ccccc3n2)cc1)c1ccc(C#N)c(F)c1 777685579 YQRYDNKRQKFUKL-INIZCTEOSA-N 386.430 5.097 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)O[C@H](C)c3cccc(C#N)c3)c(C)c2c1 782622430 YKTUVLLCDBUTEV-MRXNPFEDSA-N 375.424 5.053 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)NCCCCC(F)(F)F 794977722 IOHDGWZPTARTPY-GFCCVEGCSA-N 375.485 5.100 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)C[C@@H](CC#N)c1ccccc1 795980127 BUAIWEYOWZILML-AZUAARDMSA-N 392.499 5.076 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)Nc1ccccc1S[C@H](C)CC#N 801629424 YWWLTYOSFXQQDZ-QGZVFWFLSA-N 397.544 5.621 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813218826 ZQOBUFUFJUCDPL-QYZOEREBSA-N 380.369 5.234 30 20 GKED CCCOc1ccc(C=NOCc2nc(-c3cccs3)oc2C)cc1OC 818260212 PSBGYCWRHGGGJX-UHFFFAOYSA-N 386.473 5.060 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)c(F)c1)c1cc2c(ccc3ccccc32)o1 844248265 BJZNYTPDBSDSRX-RMKNXTFCSA-N 383.382 5.202 30 20 GKED C[C@@H](OC(=O)CC1(C#N)CCOCC1)c1ccc(Sc2ccccc2)cc1 851102582 UXKCISUAFMCNKX-QGZVFWFLSA-N 381.497 5.152 30 20 GKED COc1ccc(-c2nc(/C=C3/CCOc4ccc(F)cc4C3=O)cs2)cc1 861415474 CJSONGOSLBKJAI-UVTDQMKNSA-N 381.428 5.007 30 20 GKED COc1ccc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1F 915087770 XLYHMBJQADSFNM-NRFANRHFSA-N 388.442 5.061 30 20 GKED CCO[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805645 OKGKXOKTSFGOMP-VLIAUNLRSA-N 398.434 5.042 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3ccc(F)cc3)n2)cc1 921133791 YINKRAZLIUOBAS-BEFAXECRSA-N 378.472 5.313 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(-c2ccc(Cl)cc2)s1 1776049871 SGDKMORZJANSRC-UHFFFAOYSA-N 386.860 5.221 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc(F)cc2)s1 1776783018 VTQYGUARPWGOEH-SFHVURJKSA-N 377.525 5.848 30 20 GKED CCCCCCOc1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776789220 PKILTSOYRQINLM-SAPNQHFASA-N 382.456 5.458 30 20 GKED Cc1ccccc1COc1c(C)cc(/C=C/c2nc(C(=O)O)ccc2C#N)cc1C 1777471936 QASLMNBOSYNXMG-CSKARUKUSA-N 398.462 5.326 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cccc(CC(=O)O)c2)cc1 1777472326 YHDPSKVPEJSIKO-NTEUORMPSA-N 386.447 5.097 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 1777640986 MSXLNBRXOKDSAY-VMPITWQZSA-N 399.657 5.396 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2ccccc2n1C(F)F 41558870 NYTTVVOMXIXYHS-NSHDSACASA-N 394.208 5.157 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2cc(OC)ccc2OC)c1 72093579 WYEOPGPLVWJQBG-NRFANRHFSA-N 396.487 5.028 30 20 GKED CCc1ccc2c(CNc3ccccc3S[C@H](C)CC#N)cc(=O)oc2c1 109323615 SMGSGHKZQJURKJ-OAHLLOKOSA-N 378.497 5.362 30 20 GKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1 114620440 YRPZLUGPZCPAGF-RBUKOAKNSA-N 375.497 5.211 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)NC1(C#N)CCCCC1 115509710 JYYACDLOMLGUPG-UHFFFAOYSA-N 393.434 5.094 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 121813878 AXTQELKFMZXUGX-NRFANRHFSA-N 393.487 5.120 30 20 GKED CC(C)Oc1ccc(NC(=O)N(C)[C@H](C)c2nc3ccccc3s2)cc1C#N 157660336 DFJDUCUQWUHXOZ-CQSZACIVSA-N 394.500 5.180 30 20 GKED N#Cc1ccc(F)c(CSc2nnc(-c3ccncc3)n2C2CCCCC2)c1 159331154 HACDDELQOATHIL-UHFFFAOYSA-N 393.491 5.148 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)c1cc2ccccc2o1 176056364 XMOJRBXJXCWEDF-INIZCTEOSA-N 397.434 5.542 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ncc(Cl)cc3Cl)o2)cc1 179988892 YQQLVJHKDHSOCZ-UHFFFAOYSA-N 394.283 5.296 30 20 GKED COc1ccccc1-c1nnc(S[C@H](C)CCC#N)n1-c1ccc(C)cc1 188248611 FGOORQRYNHJTMA-MRXNPFEDSA-N 378.501 5.036 30 20 GKED COc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c(OCc2ccccc2)c1 188611101 LFKHHYSPJHIKQF-UHFFFAOYSA-N 398.462 5.082 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)o1 193050355 ZBVRCGWWCVAOEH-FOIQADDNSA-N 377.488 5.401 30 20 GKED CCN(CCC(=O)Nc1sccc1C#N)[C@@H](C)c1cccc(C(F)(F)F)c1 195732847 YMDOWYFCEMMAMB-ZDUSSCGKSA-N 395.450 5.050 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)o1 248540281 BFSBXJKBRNBODK-SUMDDJOVSA-N 397.544 5.987 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 303453148 DEOISRPVLHBCDY-WZONZLPQSA-N 395.572 5.206 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)C2(c3cccc(C(F)(F)F)c3)CCCC2)CC1 328735581 JCFSDQKYWAPUBZ-MRXNPFEDSA-N 394.437 5.515 30 20 GKED Cc1onc(-c2ccccc2)c1/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329475953 BJHYRGZVMIZUJO-IBGZPJMESA-N 390.487 5.344 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C1CCC(/N=C(/O)C2CC2)CC1 330001538 AIMQHIGXIJXLHW-ODIFPOPNSA-N 391.581 5.020 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nnc(Cc3ccccc3)n2-c2ccc(Cl)cc2)C1 430097207 GTFAHGJFACAWSW-VQIMIIECSA-N 394.931 5.296 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431931217 NTAYORIVYPTHAT-DYESRHJHSA-N 381.545 5.594 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]nc3-c3ccsc3)cc2)cc1 436305665 IXEPDXMKELCFML-UHFFFAOYSA-N 386.436 5.054 30 20 GKED N#Cc1ccccc1SCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 439687986 DXXCUHAGRSCSIA-QGZVFWFLSA-N 391.323 5.321 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](NCC2CCC(C#N)CC2)CCC3)cc1 442856999 OZISQFWGGRVJAV-RJYAGPCLSA-N 381.545 5.116 30 20 GKED C[C@H]1CC[C@H](CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)O1 443876932 HQQZKOGFLKBMPL-HRAATJIYSA-N 382.891 5.093 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)N[C@H]3CC[C@@H](CC#N)C3)s2)cc1 455273833 NLIPZIHUFJZQLE-AOIWGVFYSA-N 396.560 5.212 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 457554032 OGXCRBANDJGIHE-MOPGFXCFSA-N 399.947 5.611 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1)c1ccccc1 458810647 BCIPYRXFWWPUKB-GOTSBHOMSA-N 387.527 5.748 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)s1 460160493 JAHZBWCNZRZTPZ-UHFFFAOYSA-N 394.883 5.323 30 20 GKED C=C(C)COc1cc(CN[C@@H]2COc3c2ccc(Cl)c3Cl)ccc1OC 462744733 ZXVVLLDXJGWFPS-MRXNPFEDSA-N 394.298 5.180 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3SCCc4ccccc43)cc2)c1 463740350 BWAWWQMXTZFTQI-JOCHJYFZSA-N 386.476 5.320 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1 464472438 PVWLQLFWJHCWLB-GOSISDBHSA-N 382.935 5.657 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NCc2cccc(C#N)c2)cc1 465516462 OMJDBSKJADJFTF-GOSISDBHSA-N 399.494 5.136 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl 467763139 RFKBPLDSCCZRSN-QGZVFWFLSA-N 378.903 5.818 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Cl)ccc1N1CCCCC1)c1ccccc1 474571295 AHELCLOBOPRVOM-SFHVURJKSA-N 381.907 5.356 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cn(C)nc1-c1ccccc1 481097307 WTNOSBSGQKVSIJ-UHFFFAOYSA-N 386.908 5.022 30 20 GKED N#CCCC[C@@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccccc1 487211049 OKDNBYZUTXGLDA-LJQANCHMSA-N 391.540 5.560 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2ccc(C#N)s2)cc1 487597881 LZDDVGSANHTFGD-OAHLLOKOSA-N 376.481 5.129 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](CCc1ccccc1)C(F)(F)F 488371069 NHLWPACZQHKNEF-QGZVFWFLSA-N 382.451 5.009 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2coc3ccccc23)cc1 499392633 UPBZRPWADCUQQS-UHFFFAOYSA-N 384.410 5.286 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2cccnc2)Cc2ccccc2C)c1 502598837 YSZBYADTZVVLTA-UHFFFAOYSA-N 387.483 5.189 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1cccc(OCc2ccccc2C#N)c1 502601401 SMJYAFOQBYNJRS-UHFFFAOYSA-N 390.508 5.250 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1OCC 505262361 SGFMDKPQMYOBSO-INIZCTEOSA-N 395.503 5.168 30 20 GKED C=C(C)[C@@H](NCc1nc2cc(Br)ccc2o1)c1ccc(F)c(F)c1 509133759 BFKZTLLNPHOERH-GOSISDBHSA-N 393.231 5.276 30 20 GKED N#CCN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)C1CCCC1 510245495 QJKMLLLZPPRBAA-UHFFFAOYSA-N 390.270 5.089 30 20 GKED C[C@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(C#N)cc1F 512613587 SNJMYNSXBTYQHI-LBPRGKRZSA-N 384.348 5.287 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc(C#N)cc1 512957593 RNIKTVKRCDOWNN-ZDUSSCGKSA-N 397.887 5.127 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2s1)c1nc(-c2c(F)cccc2F)cs1 521259106 KPPDZOWXAOREBE-LBPRGKRZSA-N 396.443 5.793 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2ccc(C#N)cc2F)c1)c1ccccc1 523396875 JQZUSTBNMAUEGY-UHFFFAOYSA-N 393.849 5.239 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(OC(F)(F)F)cc1 534630561 ABONHXAEMPDFDC-GFCCVEGCSA-N 395.406 5.623 30 20 GKED C=C[C@@H](CC(=O)N(CC)[C@H](c1ccc(C)cc1)c1cccnc1)c1ccccc1 535399046 UVBXYGCRTXFQBI-HFZDXXHNSA-N 384.523 5.688 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 537511925 DPRLWWFGLAITBF-DENIHFKCSA-N 393.487 5.066 30 20 GKED Cc1ccc(CCCSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 541294698 UQZZMBQIKBFHIN-GOSISDBHSA-N 398.597 5.694 30 20 GKED COC(=O)c1ccc(F)c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 542017519 DZHSPHWFBDRJBY-INIZCTEOSA-N 388.442 5.002 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC2CC2)cc1)c1nc(-c2ccccc2)cs1 543056990 GVBGGYXPHASAQD-SFHVURJKSA-N 376.506 5.555 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC(CC#N)CC3)c(C)c2)c1 543827470 GFUCOSCYCFVAKN-UHFFFAOYSA-N 377.488 5.040 30 20 GKED COc1ccc2ccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2c1 550912573 VLJSKRNRNJRVID-OAHLLOKOSA-N 376.481 5.495 30 20 GKED C=CCOc1cccc(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)c1 556134264 LPQYHWKNNXGDFY-UHFFFAOYSA-N 376.378 5.081 30 20 GKED CCOC(=O)c1oc2c(c1C)[C@H](N[C@@H](CCCC#N)c1ccccc1)CCC2 556202363 MOWMTTHNRNECHS-RBUKOAKNSA-N 380.488 5.167 30 20 GKED CC(C)[C@H](c1ccc(Cl)cc1)c1noc([C@@H](C#N)Cc2ccc(C#N)cc2)n1 558388519 NIFYNKIIOXWAIT-UYAOXDASSA-N 390.874 5.232 30 20 GKED CC(C)(C(=O)Nc1cccc(C#N)c1)c1csc(-c2c(F)cccc2Cl)n1 575166956 YALMQGBTCQAVJF-UHFFFAOYSA-N 399.878 5.391 30 20 GKED N#CCCC[C@@H](Nc1ncnc2ccc(Br)cc12)c1ccccc1 581228514 ULKBBZLOQFIWHT-QGZVFWFLSA-N 381.277 5.239 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 585720256 VJMCNMBUHURYKM-QHCPKHFHSA-N 392.524 5.534 30 20 GKED CCN(C(=O)CCCCCC#N)[C@@H](c1cccnc1)c1csc2ccccc12 588927157 NZMHEUJDTCENCW-QHCPKHFHSA-N 391.540 5.708 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cccc(NC(=O)c3cccs3)c2)c1 589381905 AUXUUXQJGHFSLH-UHFFFAOYSA-N 392.480 5.208 30 20 GKED N#CC1(c2ccc(CNCc3nc4c(s3)C[C@H](c3ccccc3)CC4)cc2)CC1 594944043 GWVAGDVRFRPOOB-HXUWFJFHSA-N 399.563 5.261 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@@H]21 599390672 OOPVXDIYDNKNCI-FWMLUHEOSA-N 382.916 5.116 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 603969752 DJAKSPFAZGZUHP-UHFFFAOYSA-N 397.297 5.610 30 20 GKED N#Cc1ccc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)cc1 604007922 TVZQFBMJOWZIES-UHFFFAOYSA-N 379.822 5.215 30 20 GKED C[C@H](CC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 604699262 KELIQCMAUDHXCG-RAIGVLPGSA-N 399.350 5.345 30 20 GKED CSCc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)oc2ccccc12 609068005 DAWLBFFMSKRETJ-UHFFFAOYSA-N 388.395 5.021 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H](C)c1ccccc1 609078671 GTGNPVWVXIXAKV-IBGZPJMESA-N 399.494 5.671 30 20 GKED N#Cc1ccc(CC(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)cc1 609507520 STUCKUAVWKILJI-AREMUKBSSA-N 376.459 5.160 30 20 GKED CC[C@@H](C)[C@H](C)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CC1 609644188 PVACAMDVAZZSGE-MSOLQXFVSA-N 376.500 5.176 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3ccnc4ccccc34)cc2)cc1 609906753 MJHADZFZCILOGI-UHFFFAOYSA-N 393.446 5.470 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N[C@H](C)c2cccc(C#N)c2)c1 610326295 MMOJSVHOJPFSLS-CYBMUJFWSA-N 393.434 5.404 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c[nH]c2c(C)cc(F)cc2c1=O 672251090 GYVODBWHFVFDDE-UHFFFAOYSA-N 378.447 5.080 30 20 GKED CC(C)N(C(=S)N[C@@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 726491241 XANRCIHCOYCGEO-ZDUSSCGKSA-N 392.355 5.716 30 20 GKED Cc1ccccc1C1(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)CC1 727051259 WCCQNVNHCKKASW-AWEZNQCLSA-N 394.446 5.305 30 20 GKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1cccc(N2CCOC2=O)c1 727266847 HXNKEXYWLFCYHU-FNORWQNLSA-N 395.764 5.212 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 727955122 YSFYKGKOOIIFKZ-SGTLLEGYSA-N 389.282 5.007 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(SC(C)C)cc2)cc1OC 728440977 BHUYECKWSJBQPN-KPKJPENVSA-N 386.513 5.499 30 20 GKED O=C(/C(=C/c1cccnc1Cl)c1nc2ccccc2s1)c1ccccc1 728695432 WXMZLQIYBQMFGO-SSZFMOIBSA-N 376.868 5.768 30 20 GKED COc1ccc2cc(/C=C\C(=O)Nc3ccccc3SCCC#N)ccc2c1 730981986 GIMMFRAVTSWBFT-WQLSENKSSA-N 388.492 5.506 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccnc3ccccc23)cc1 735429307 RPEFQZBTFZWUND-JBDIQEJZSA-N 389.458 5.542 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 736003275 WZZCOCNSFSPSIB-FQEVSTJZSA-N 391.814 5.156 30 20 GKED C=C(Cl)CNC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 736238389 JOSKMLGWYMXJRR-UHFFFAOYSA-N 375.852 5.347 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)cc1 742888822 ZQXVTGFLLDCGLY-INIZCTEOSA-N 396.487 5.089 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743629444 QHYPAYITWWAHQH-MGPUTAFESA-N 392.405 5.026 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)c2cccc(Cl)c2)cc1 744029806 WNSJKYACXWNVMI-FOIQADDNSA-N 382.891 5.134 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(C(F)(F)F)ccc2C)c1 746728281 GXFDWQFEAKMPTO-MRXNPFEDSA-N 391.393 5.017 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747197572 IGJKLFGOUZGBKE-SFHVURJKSA-N 382.529 5.304 30 20 GKED N#Cc1ccsc1C(=O)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750204857 LYSZJRDHCBANSS-LBPRGKRZSA-N 379.281 5.099 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(-c2ccc(Br)cc2)s1 751379495 CXIVCKNQEUOLRC-UHFFFAOYSA-N 391.334 5.189 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CC[C@@H]1c1ccc(Cl)cc1 752239841 FVVHVIZKYOBOJM-JOCHJYFZSA-N 387.870 5.114 30 20 GKED C[C@H](OC(=O)c1cc(C#N)cs1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753379759 GZNOBJMRNAAIFV-VIFPVBQESA-N 393.251 5.500 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cc(Br)ncc1F 762423198 OZTMZBLJLOGLTN-ONEGZZNKSA-N 395.278 5.064 30 20 GKED FC(F)SCc1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)o1 768993607 WQNXSLQLHRTXNN-RKDXNWHRSA-N 397.331 5.298 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1 780675798 VQXDCAGRXKYVCS-LBPRGKRZSA-N 392.286 5.341 30 20 GKED CC[C@H](CC#N)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 787079192 QHBLLAGXMDVHTQ-CYBMUJFWSA-N 376.239 5.073 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)/C=C/c1cn(CCC#N)nc1-c1ccccc1 788350213 MRTJDRYRUMECJZ-OUKQBFOZSA-N 380.451 5.150 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2c(CC=C)cccc2C(C)C)cc1OC 789720472 LUVKWLAYXLKWIG-SQFISAMPSA-N 391.511 5.764 30 20 GKED N#C[C@H](C(=O)CC(c1ccccc1)c1ccccc1)c1nccc2ccccc12 792103702 KSCHKPRWWUETLY-XMMPIXPASA-N 376.459 5.633 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1cnc2ccccc2n1 793283353 ZSIMQMQAJONXEN-DOTOQJQBSA-N 397.400 5.094 30 20 GKED C=CCCCCCSc1nnc([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)o1 795259991 VXQLJYWOYYKWRK-OAHLLOKOSA-N 381.542 5.023 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1[N+](=O)[O-] 796756332 LCFZCTFLFHXNGP-GFCCVEGCSA-N 399.859 5.012 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801673661 VMYAVWDTHHBOET-YVEFUNNKSA-N 396.409 5.749 30 20 GKED C[C@H](OC(=O)c1cc(C#N)ccc1Cl)c1ncc(-c2ccc(Cl)cc2)o1 803834567 JSDPXXWMEZNQEQ-NSHDSACASA-N 387.222 5.438 30 20 GKED COCC[C@H](Nc1nc(Cl)c(C#N)s1)c1ccc(Cl)c(Cl)c1 804708863 UVRINPRXDMUIMH-NSHDSACASA-N 376.696 5.165 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccc(F)c([C@H](C)O)c2)cc1 804790708 CPUDJXHGWSRNDA-HNNXBMFYSA-N 390.414 5.104 30 20 GKED Cc1ccccc1[C@H](C)c1noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n1 848610086 JJKSUVVCHCHNGD-WMZOPIPTSA-N 398.507 5.180 30 20 GKED FC(F)(F)[C@H]1CCC[C@@H](C=Nn2c(S)nnc2-c2ccccc2Cl)C1 853269098 KFMCXPCBGWNEPP-MNOVXSKESA-N 388.846 5.090 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1 915085854 FTMPEMSFZHBMIA-RUZDIDTESA-N 376.459 5.676 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(N3CCCCC3)cc2)ccc1OC(F)F 916127041 XEWZHCHQMCSYHR-YRNVUSSQSA-N 387.426 5.183 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(C=NNc2cccc(Cl)c2C)cs1 917548243 KTUHHAHNONAXSS-UHFFFAOYSA-N 398.919 5.544 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805627 DQRFFGDENSBMAO-WVUXNXBLSA-N 380.419 5.368 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1cc(F)ccc1Oc1cccc(F)c1 1776085683 FCOUTRCWQSOHLU-UHFFFAOYSA-N 396.393 5.220 30 20 GKED CCCc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776112954 QUEVMTQTHGAHHA-ACCUITESSA-N 376.477 5.962 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(OCC(=O)O)cc2)cc1 1776125539 LHJHDQSMUAJSDW-CXUHLZMHSA-N 396.483 5.395 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2cncc(C(=O)O)c2)cc1 1776125710 QVQLHGGDJMKFFI-PJCWUCBCSA-N 381.472 5.271 30 20 GKED CCc1ccc(-c2ccc(/C=C\C(=O)c3ccc(OC)c(CC(=O)O)c3)o2)cc1 1776131855 QCOBXXWPOLDURD-LUAWRHEFSA-N 390.435 5.041 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776364819 LSNXVYTZWMQJPL-LCYFTJDESA-N 392.476 6.041 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC(F)(F)F)cc1F 1776783896 ITEBONQJNVDSDN-CQSZACIVSA-N 379.394 5.018 30 20 GKED CCCCCCCOc1cccc(CNc2cccc(C(=O)O)c2OC(C)C)c1 1776787600 MXXXLVAAFDSGQB-UHFFFAOYSA-N 399.531 6.133 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1ccc(C)cc1C 10168485 ILLRNDVYQNAQHS-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2OCc2ccc(Cl)cc2)cc1 15029175 RPKKCLPHPVREPV-UHFFFAOYSA-N 376.843 5.237 30 20 GKED CC(C)n1c(SC[C@@H](C#N)CCC#N)nnc1-c1ccc(Cl)cc1Cl 15244618 GIIRPYRRPVTXOB-GFCCVEGCSA-N 394.331 5.368 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1 66954788 DIBIIBLOHRNZOT-BTYIYWSLSA-N 395.528 5.362 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(OC(F)F)cc2)nc2ccccc2c1=O 72031354 MGAHVDNMTKTNBW-ZDUSSCGKSA-N 388.439 5.037 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1nc2ccccc2s1 78714738 HGSJVZVVAKPXHT-CQSZACIVSA-N 396.541 5.212 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(F)c(Cl)nc1Cl 108241181 XGLPTLNULIBQPR-VIFPVBQESA-N 384.263 5.032 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1F)C1CC1 108533458 BPIFNEMXUKIKRI-OAHLLOKOSA-N 383.492 5.274 30 20 GKED CC(C)Oc1ccc(NC(=O)N(C)[C@@H](C)c2nc3ccccc3s2)cc1C#N 157660211 DFJDUCUQWUHXOZ-AWEZNQCLSA-N 394.500 5.180 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2/CC/C(=C/c3ccc(O[C@H](C)C#N)cc3)C2=O)cc1 171536361 GDNBJFVFRZPWJC-AXQOLIKFSA-N 398.462 5.098 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)c1 174103591 CWHKPIPUQMKOMX-LJQANCHMSA-N 389.480 5.040 30 20 GKED C=C[C@H](CC(=O)N1CCC(n2c(CC)nc3ccccc32)CC1)c1ccccc1 180129684 QDXUAUPVLASZMS-LJQANCHMSA-N 387.527 5.122 30 20 GKED C[C@@H](N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 181687689 VXPZUANWJNTTTP-HXOBKFHXSA-N 384.458 5.139 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](O)c1cccc(OC(C)C)c1 191419931 JOIOXSZOTBTULN-JOCHJYFZSA-N 396.531 5.181 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CC(=O)OC(C)C)C1 191435400 DMSNNYSWSAXOIL-GOSISDBHSA-N 386.536 5.124 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 303338168 LBEPYPGJLJSAPV-ROUUACIJSA-N 396.556 5.919 30 20 GKED Cc1cc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)c(Br)s1 411004295 CFDOIJPRIMMCNX-UHFFFAOYSA-N 383.336 5.302 30 20 GKED COc1ccc(-c2nc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 430599911 QUAKYCGKTFTNJW-AWEZNQCLSA-N 397.525 5.063 30 20 GKED Cc1sc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)c(C#N)c1C 433514941 JDMXAZOLUXVZIH-NLKGSNSHSA-N 382.451 5.324 30 20 GKED N#Cc1csc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)c1 437548621 LVPMMYMFSYAQSI-UHFFFAOYSA-N 378.419 5.224 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)c1C 437853010 WBFWSOGTZYZHBJ-NRFANRHFSA-N 377.488 5.331 30 20 GKED Cc1ccc(/C=C\CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 440582836 INGXTUZDAPGJPD-PLNGDYQASA-N 396.490 5.682 30 20 GKED CCN(C(=O)c1ccc(-c2csc(C)n2)cc1)c1ccc(C#N)c(Cl)c1 441075624 WILXFANSGMARQF-UHFFFAOYSA-N 381.888 5.310 30 20 GKED Cc1cncc(N(Cc2ccc(F)cc2)C(=O)C[C@@H](CC#N)c2ccccc2)c1 441411474 NIWSYTAMSZAJFY-OAQYLSRUSA-N 387.458 5.150 30 20 GKED C=CCN(C(=O)[C@H]1SCCc2ccccc21)c1nc(-c2ccccc2)cs1 443814856 JXHMTVUQOBYOGX-FQEVSTJZSA-N 392.549 5.360 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCSc2ccccn2)cc1F 446029499 ATLKGYNHAYDKRD-UHFFFAOYSA-N 393.443 5.006 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1ccc(Cl)cc1 453470106 ZHBYEOWBQAVUOW-OALUTQOASA-N 386.927 5.091 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 464942220 IIGQNVMWSLEQPG-BQJUDKOJSA-N 398.428 5.107 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(CC(F)(F)F)C2CCC2)cc1 465462345 ALUZNWJALCVVIY-UHFFFAOYSA-N 388.389 5.216 30 20 GKED N#CCCSc1ccccc1NCc1ccc(Br)c(Cl)c1 468783380 AZLLFYYCAQJNIP-UHFFFAOYSA-N 381.726 5.720 30 20 GKED Cc1cc(Cl)cc(C)c1CNc1ccc2c(c1)CCC(=O)N2CCCC#N 469247933 WXAJKVMUFNNXOE-UHFFFAOYSA-N 381.907 5.152 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1ccc(C(F)(F)F)c(F)c1 473871261 FLJJLDQSVYCKAD-UHFFFAOYSA-N 379.275 5.592 30 20 GKED COc1c(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccccc12 474710212 KCPFGMKOARERPR-AWEZNQCLSA-N 395.484 5.157 30 20 GKED C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1C(=O)C[C@@H](CC#N)c1ccccc1 476342206 NMNXESPYUCGDND-GDBMZVCRSA-N 387.310 5.527 30 20 GKED CC[C@H](CN(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 480537183 FVBFUNZLOSEZOG-RTBURBONSA-N 395.572 5.986 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(F)cc(Cl)cc1F 480715060 IKSAEIAIEKYOGC-UHFFFAOYSA-N 382.842 5.006 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCCCC[C@@H]3c3ccncc3)c2)cc1 482963307 NEEYDRQHNZAPQE-XMMPIXPASA-N 397.478 5.503 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N(Cc1ccco1)c1ccccc1C#N 488804993 LFDCTVJTAVQTRV-UHFFFAOYSA-N 379.485 5.061 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(-c2ccsc2)nn1C 489726254 CPCKVZJUDKBDCE-UHFFFAOYSA-N 392.937 5.084 30 20 GKED C=CCSCCNC(=O)N(C)[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 509179052 POQKXKUCHUZSAY-INIZCTEOSA-N 389.590 5.049 30 20 GKED Cc1noc(C)c1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 509737757 ZAXCUWADJVVJGL-UHFFFAOYSA-N 382.807 5.253 30 20 GKED N#Cc1ccc(SCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1 515572175 MPAQOIWJAIQVHI-SFHVURJKSA-N 391.323 5.321 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1[nH]c2ccc(F)cc2c1Cl 517455379 DYHSPZUBQBNAQN-NSHDSACASA-N 387.867 5.464 30 20 GKED C[C@H](NC(=O)Nc1ccccc1Oc1cccc(F)c1)c1ccc(C#N)cc1 520433509 DAXZLDBLFQIKNL-HNNXBMFYSA-N 375.403 5.372 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CCc4ccc(F)cc43)cc2)cc1 521655414 DABBYMCLHJFGIB-QFIPXVFZSA-N 387.414 5.299 30 20 GKED CN(C(=O)c1ccc(C#N)c(Cl)c1)c1ccc(OCc2ccccc2)cc1 526092717 QTGVDSOYVNDIDV-UHFFFAOYSA-N 376.843 5.067 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 533299080 JNIRDRBACVDQPT-PKOBYXMFSA-N 395.572 5.187 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N(C[C@H](C)C#N)C1CC1 533599303 OTRKIAMKOOYVHL-AEFFLSMTSA-N 377.488 5.291 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccc(F)cc1 537558157 XEPCPOXBHKJQPZ-ZDUSSCGKSA-N 380.448 5.265 30 20 GKED Cc1ncc(-c2ccc(NC(=O)c3ccccc3Oc3ccccc3C#N)cc2)o1 540876583 KEBOHJGRUFDIKF-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542974879 QMQGIUMDLXVOBT-ZWKOTPCHSA-N 398.510 5.304 30 20 GKED CC(=O)Nc1ccc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 543034851 VVCZAEUYBPBKFF-MSOLQXFVSA-N 383.495 5.595 30 20 GKED CCc1sc(C(=O)Nc2cccc(OCCCC#N)c2)cc1Br 549906404 ZNDVHWAHPOCECO-UHFFFAOYSA-N 393.306 5.008 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NCC(C)(C)CCC#N 554185988 DJBSZGALUFNGCX-SFHVURJKSA-N 379.504 5.587 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc([C@H]2CCOC2)cc1 563962303 TWMSKZQQFCSJTJ-IBGZPJMESA-N 384.435 5.107 30 20 GKED N#CCCC1CCN(C(=O)c2csc(-c3cccc4ccccc34)n2)CC1 567738338 IGTHVQKCAUIELY-UHFFFAOYSA-N 375.497 5.119 30 20 GKED N#CCc1ccc(NC(=O)N2C[C@H](c3ccccc3)C3(CCC3)C2)c(Cl)c1 573222908 SONZWKNTXXEONR-GOSISDBHSA-N 379.891 5.208 30 20 GKED Cc1csc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1C#N 589034723 XBWOLLWYKJRLIH-UHFFFAOYSA-N 378.297 5.218 30 20 GKED Cc1oc(-c2cccs2)nc1CC(=O)Nc1sc2c(c1C#N)CCCCC2 591711892 GGOBDTRTJADRID-UHFFFAOYSA-N 397.525 5.095 30 20 GKED C[C@H](CSc1ccccc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 593406649 KFAGOGLTUCPOKD-NQIIRXRSSA-N 381.545 5.244 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)CCCc3c[nH]c4ccccc34)c2C#N)C1 602755015 DWGVNRRJCQEBEP-AWEZNQCLSA-N 377.513 5.187 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccc(CC#N)cc3)c2C2CC2)cc1Cl 603565711 RMJBMOKYESFHNR-UHFFFAOYSA-N 390.874 5.030 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3F)on2)sc2c1CCCCCC2 604118436 XXPSGQLZERWMCW-UHFFFAOYSA-N 395.459 5.325 30 20 GKED N#C[C@H](C(=O)c1cc2occc2s1)c1nc(-c2c(F)cccc2F)cs1 606145718 JPICFCOBEUCXJP-SECBINFHSA-N 386.404 5.386 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(Oc3ccc(C(C)(C)C)cc3)nc2)n1 607433195 IJJBUDRXHYNJCQ-SFHVURJKSA-N 391.496 5.426 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)c1C#N 609032605 UABDKKFJAJSDLV-KBPBESRZSA-N 378.419 5.252 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1 609070406 WMNVMVYMTLFHCZ-QFIPXVFZSA-N 386.451 5.016 30 20 GKED C[C@@H]1C[C@@H](C)CN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 609079731 HHFQKULHYWDJTO-HZPDHXFCSA-N 397.906 5.300 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C(c1ccccc1)c1ccccc1 609427801 MSMBAYFJYFSOTA-GOSISDBHSA-N 386.520 5.851 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 609504261 JPBJMFXGSIOIOG-UHFFFAOYSA-N 377.875 5.687 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1C[C@H]1Cc1ccccc1 610187214 ZMZPUYQZIGRRTH-TZIWHRDSSA-N 384.504 5.070 30 20 GKED C[C@H]1CCc2c(sc3nc([C@H](C)Sc4ccc(C#N)cc4F)nc(O)c23)C1 610218740 NXLDBXDHXHUGDP-QWRGUYRKSA-N 399.516 5.386 30 20 GKED C[C@H](NC(=O)Nc1ccccc1N(C)Cc1ccccc1)c1cccc(C#N)c1 610325179 GAZHBTRGLCDMFA-SFHVURJKSA-N 384.483 5.077 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@H]1F 611503326 WMKGXHZVTIEXSH-HEFCMCLBSA-N 385.870 5.207 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cnco2)cc1)c1nc2cc(Cl)ccc2s1 617898162 RSAJESQQGOXXHH-AWEZNQCLSA-N 379.828 5.095 30 20 GKED N#CCn1c(C(=O)N2CCCC[C@H]2c2cccc(Cl)c2)cc2ccccc21 618166373 ZMXNLXWJGSEWME-FQEVSTJZSA-N 377.875 5.186 30 20 GKED COc1cc([C@@H](C)NC(CCC(F)(F)F)CCC(F)(F)F)ccc1F 658253472 ITDURKHSXPXQPF-SNVBAGLBSA-N 375.328 5.539 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2cc(F)ccc2s1 682234176 BZFKANWDMGSSIA-SNVBAGLBSA-N 382.313 5.083 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1ccccc1Cl 727628117 HRKJBVGTHUKUIV-MOJYJUKOSA-N 376.843 5.125 30 20 GKED O=C(/C=C\c1csc(-c2ccc3c(c2)OCO3)n1)c1nc2ccccc2s1 728439357 HZXWCTPSKPUVBV-SREVYHEPSA-N 392.461 5.045 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(COc3ccc4ccccc4c3)o2)c1 728483327 YFTKSWWYFCPZOX-UHFFFAOYSA-N 381.431 5.270 30 20 GKED Cc1cccc(Oc2ccccc2CNC(=O)c2ccccc2SCC#N)c1 730223890 MJCMINQUSWNAIU-UHFFFAOYSA-N 388.492 5.333 30 20 GKED CC(=NNc1cccc2ncccc12)c1cnn(-c2cccc(Cl)c2)c1C 731559076 SNHDRUXLFZKKQA-UHFFFAOYSA-N 375.863 5.218 30 20 GKED C[C@@H](N[C@H](C)c1csc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCC2 732919084 YVRKSHUDQIFZLV-CHWSQXEVSA-N 395.553 5.001 30 20 GKED C#CC[C@H](OC(=O)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccccn1 733692880 QGSZLURNHRSNAD-KRWDZBQOSA-N 382.872 5.088 30 20 GKED COCCC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(F)cc1 734746248 GIBKAJNOFMEQQQ-UHFFFAOYSA-N 376.646 5.034 30 20 GKED CSCC[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 736958963 BMKNKHYPJVCDMT-KSSFIOAISA-N 387.936 5.259 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cc(Cl)c(O)c(OC)c2)cc1 741470626 UFHKOXSSKVMJRH-GHXNOFRVSA-N 394.854 5.626 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 741520484 JVBMSVDROSWHJI-CYBMUJFWSA-N 377.362 5.075 30 20 GKED COc1ccc(-c2nc(/C=C3\CCc4ccc(OC)cc4C3=O)cs2)cc1 741847685 KFIBTYJPTZVWIQ-LFIBNONCSA-N 377.465 5.040 30 20 GKED CCOC(=O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc4c(c3)COC4)o2)cc1 742437776 XLAAZWUNQBXZOX-LUAWRHEFSA-N 388.419 5.050 30 20 GKED CCC[C@]1(C)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 743093518 VOXNSRLWUIWJFR-LADGPHEKSA-N 375.516 5.776 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccncc1)c1cc(F)ccc1F 747150564 QCTLCUGMITVQTE-TWGQIWQCSA-N 387.389 5.109 30 20 GKED COC(=O)c1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)o1 749454215 ZGDSDILRDCJAJW-DTQAZKPQSA-N 389.432 5.099 30 20 GKED C[C@]1(c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCCO1 763331681 GYWODYICWRCSRR-HXUWFJFHSA-N 381.819 5.080 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2cn(C(C)(C)C)nc2C)cc1 768279187 KYJXPNATMIIUNJ-HZPDHXFCSA-N 375.944 5.490 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cccc(-c4cccnc4)c3)c2)s1 769398061 ZRHSOSUEDDLJKJ-UHFFFAOYSA-N 381.504 5.639 30 20 GKED CS/C=C\C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 771566552 NDAQIPVPDUNLEH-KHPPLWFESA-N 382.535 5.484 30 20 GKED CC[C@H](C#N)Oc1cc(CNC2CCC(c3ccccc3)CC2)ccc1OC 772987457 WENSNCGJHDNUEW-LZBANZJXSA-N 378.516 5.192 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1cccc2ccccc12)c1ccc(OCC#N)cc1 776155975 JQNCNYAGPPMFKD-CCLHPLFOSA-N 392.502 6.182 30 20 GKED Cc1nc2c(s1)[C@H](NCc1cccc(OCc3ccccc3C#N)c1)CCC2 779987784 GOHNWNVYPVCKHO-OAQYLSRUSA-N 389.524 5.069 30 20 GKED N#Cc1ccnc(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)c1 790003686 UBMNOVXBBIXBFW-UHFFFAOYSA-N 384.826 5.074 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccnc(F)c1 794722794 VMJGCGPUZYSTSE-HJWRWDBZSA-N 380.806 5.023 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(SC(F)(F)F)cc2)cc(OC)c1OC 796991508 BBFIPYXBUQMSKT-RMKNXTFCSA-N 398.402 5.220 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(SC(F)F)c(OC)c2)cc1 797005952 FCQGZCYPWZZBDX-CQSZACIVSA-N 379.472 5.426 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)Cc2ccc(Br)c(Cl)c2)n1 810604917 BSBHTGHCWDWAOX-NSHDSACASA-N 397.725 5.101 30 20 GKED CC(/C=C/C(=O)c1ccc2c(c1)CCC(=O)N2C)=C\c1ccccc1OC(F)F 811692697 GYNIZRPBKVVHSB-IGTWKLTNSA-N 397.421 5.039 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)sc2ccc(F)cc12 813213344 IIFSYVYLZJMQMB-CYBMUJFWSA-N 378.350 5.253 30 20 GKED C=CCC(C)(C)CNC(=O)c1cc(Cl)c(NC(=O)OC(C)(C)C)cc1OC 814419895 BPSWJGVINPFMQW-UHFFFAOYSA-N 396.915 5.028 30 20 GKED C[C@@H](Nc1ccc(CCC#N)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 903297082 ASUQLOCRJUNQAN-QGZVFWFLSA-N 382.529 5.032 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 916846619 ZWGSTNUEWLGWPD-YOEHRIQHSA-N 378.497 5.238 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 917026542 GUQIECZLSLENDC-SFHVURJKSA-N 380.900 5.663 30 20 GKED O=C(O)Cc1ccc(NN=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)cc1 1776083459 HSEQPNMNJVCTSR-UHFFFAOYSA-N 389.238 5.327 30 20 GKED Cc1c(NN=Cc2ccccc2Oc2ccc(F)c(Cl)c2)cccc1C(=O)O 1776088842 LTAFZGFXFUDJKO-UHFFFAOYSA-N 398.821 5.724 30 20 GKED COc1ccc2c(c1)CC/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1776127637 ZCTCVATTZJDLIF-LPYMAVHISA-N 398.458 5.202 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1ccc(Cl)c(Cl)c1 1776179915 CPYHUBUBJYKKIZ-KRWDZBQOSA-N 384.690 5.461 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CSC(C)(C)C)C(=O)O)c1 1776787416 HEWCLXGCDTTZCH-LJQANCHMSA-N 381.582 5.110 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786612470 FGTKYPUZVOEZSK-LAUBAEHRSA-N 394.490 5.044 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)[C@@H](C#N)c1ccccn1 41482315 SDPHOHLIELEAPO-AWEZNQCLSA-N 387.386 5.022 30 20 GKED Cc1cc2cc(NC(=O)c3cccc(OCc4ccccc4C#N)c3)ccc2[nH]1 65636840 DESVRYZRGMDAOF-UHFFFAOYSA-N 381.435 5.179 30 20 GKED Cc1ccc2c(CCNC(=O)Nc3ccccc3S[C@H](C)CC#N)c[nH]c2c1 66953840 NEUNMYBSIUYTJO-MRXNPFEDSA-N 392.528 5.235 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)cc1Cl 66954326 WRYBHBGJFXWJAU-CYBMUJFWSA-N 391.899 5.537 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(F)c(C)c2)cc1 78414816 HNNCUQPJMMNIJV-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C=CCN(CCc1ccccc1)Cc1nnc(-c2ccc(Cl)cc2Cl)o1 109357367 JOEAUAWPFOEKCR-UHFFFAOYSA-N 388.298 5.274 30 20 GKED C[C@H](Nc1c(F)cc(C#N)cc1F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 109809262 QRNPGLUHMWZLRR-ZDUSSCGKSA-N 395.384 5.401 30 20 GKED CC(C)(C)OC1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 129089535 LXLCXYXPUWCRBE-UHFFFAOYSA-N 393.487 5.162 30 20 GKED CCc1noc(C)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 132759675 HTAFPXRCJOSIFI-UHFFFAOYSA-N 381.819 5.115 30 20 GKED CCCn1ncc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C1CC1 152512513 XTMOMUCAJSCGOL-UHFFFAOYSA-N 386.455 5.087 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1c(C)nn(CC(C)C)c1Cl 159031510 WELVQNDPHFLKEU-SFHVURJKSA-N 399.926 5.050 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCCc2ccccc21)c1nc2ccccc2n1C(F)F 171777087 WSWOOONGCOSDMM-DOTOQJQBSA-N 379.410 5.118 30 20 GKED CCn1nc(C)c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1C 172814316 CKOKNAWGGKVQAG-UHFFFAOYSA-N 394.862 5.090 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(NC(=O)c3cccs3)cc2)n1 177742823 PAQREHOHZBIITG-HNNXBMFYSA-N 395.509 5.070 30 20 GKED CN1CCc2ccc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)cc21 183039431 OGSWCYHXFYHWEQ-UHFFFAOYSA-N 399.519 5.095 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(NC(=O)C2CC2)cc1 189912332 WFNLEZDFFPPCNG-UHFFFAOYSA-N 376.500 5.068 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3ccc(C)s3)c2)cc1 215885576 UZOZLJHSPICONG-GHXNOFRVSA-N 377.465 5.214 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1nc2cc(Cl)ccc2s1 221719489 WZQTUEKJSTZMEF-CKYFFXLPSA-N 386.826 5.495 30 20 GKED Cc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1OCC(F)F 432850946 MCSMMMBMUUXRSW-SFHVURJKSA-N 387.430 5.196 30 20 GKED C=CCC[C@H](NCc1ncc(C(F)(F)F)s1)c1ccc(C(F)(F)F)cc1 433337423 YWGUXBHVKIZITQ-ZDUSSCGKSA-N 394.384 5.978 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(F)(F)F)c1 438561801 MKWQPRHPDMSNFA-OALUTQOASA-N 387.405 5.095 30 20 GKED C[C@@H](Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1ccc(C#N)cc1 439561680 OYRFVJOFRRZNKA-CYBMUJFWSA-N 384.266 6.225 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2cc(Cl)ccc2s1 439655391 ZDGHADFTUXBKDF-SNVBAGLBSA-N 398.768 5.598 30 20 GKED CN(C(=O)c1oc2ccccc2c1COc1ccccc1)c1ccc(C#N)cc1 440054866 TWJKLFFSNJEKSH-UHFFFAOYSA-N 382.419 5.160 30 20 GKED COc1cc(CS[C@@H](C)c2cccc(C#N)c2)c([N+](=O)[O-])cc1OC(F)F 443154889 QSKFLLZRQUTDHX-NSHDSACASA-N 394.399 5.071 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)o2)cc1 443891939 OEBVDLATZKFMGX-UHFFFAOYSA-N 398.340 5.292 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c(Cl)c1 455708376 TXZXXHIODJTWQY-LJQANCHMSA-N 389.833 5.443 30 20 GKED N#CCc1cccc(NC(=O)N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1 455911632 WKEBBESAVQGNOI-QGZVFWFLSA-N 387.405 5.183 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCc2c1cccc2C(F)(F)F)c1ccccc1 458796276 DMTZCGBVWXWILF-GOSISDBHSA-N 387.405 5.213 30 20 GKED CN(C)c1cccc([C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458796400 DXRNUZLELYJPGG-PKTZIBPZSA-N 390.531 5.034 30 20 GKED C=C(C)Cn1c(COc2ccc(C)cc2)nnc1N1CCC[C@H]1c1ccsc1 460390719 WTVVZWBDEVOCLU-FQEVSTJZSA-N 394.544 5.145 30 20 GKED C[C@H](C(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F)c1cccc(C#N)c1 462571821 AIPRIBMTVYNMHY-VBKZILBWSA-N 382.385 5.235 30 20 GKED Cc1ccc(NC(=O)CNc2ccc(Oc3ccccc3C#N)c(F)c2)c(C)c1 463222914 PZNDULFOSGBDLT-UHFFFAOYSA-N 389.430 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1cccc(C(F)(F)F)c1 463711767 LVJBFNNWZYEAPD-AWEZNQCLSA-N 392.446 5.528 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 463773158 BKOZCMTYNWHQIL-SJKOYZFVSA-N 379.262 5.082 30 20 GKED N#Cc1cccc(CCNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 466426791 XAHPBYVWYRFPDB-UHFFFAOYSA-N 387.430 5.033 30 20 GKED C=CCCN(C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 466591262 ZBAVFZDHZXZJKO-UHFFFAOYSA-N 382.851 5.115 30 20 GKED C[C@@H](c1ccccc1)n1c(SCCCSCC#N)nnc1-c1ccccc1 466630440 HRSDEUQSGXEYJI-KRWDZBQOSA-N 394.569 5.293 30 20 GKED C=C[C@@](C)(CC)C(=O)N(C)c1ccc(Cl)c(N(C)C(=O)[C@@](C)(C=C)CC)c1 467971652 WZZPNUONWHYLDZ-VXKWHMMOSA-N 390.955 5.470 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@]1(CO)Cc1ccccc1 475549941 RNWHMJCGWDHTQR-VWLOTQADSA-N 392.543 5.140 30 20 GKED N#CCCSc1ccccc1NCC(=O)N[C@H](c1ccccc1)C1CCCC1 476398218 OELIPCKFMDEIRS-HSZRJFAPSA-N 393.556 5.152 30 20 GKED COC(=O)c1ccc(-c2ccc(CNc3cccc(OCCCC#N)c3)o2)cc1 482005797 FQYZHNSBNRSNIT-UHFFFAOYSA-N 390.439 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)c1ccc(OC)c(OC)c1 482203494 YEDQBNUJOMPVPU-HXUWFJFHSA-N 396.531 5.829 30 20 GKED CCc1c(C)nn(-c2cccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2)c1C 483210727 YYYONKOEBAZVEM-QHCPKHFHSA-N 394.478 5.090 30 20 GKED Cc1cc(CN(C(=O)[C@H](C)c2cccc(C#N)c2)C2CCCC2)c2ccccc2n1 486234248 WZBUJUMVLHFXNF-LJQANCHMSA-N 397.522 5.490 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(CN2CCSCC2)cc1C 486258540 WKVMGOAPYIAUEN-UHFFFAOYSA-N 398.597 5.074 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1ccc(C)cc1 489646160 OENBTQAKFRWUEJ-UHFFFAOYSA-N 394.525 5.448 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)N[C@@H](C)CCCC(C)C)cc1C 497207514 XANDHWSKJYTQDC-IBGZPJMESA-N 380.536 5.025 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 502576033 RMAYPFHEUCMEQN-KSFYIVLOSA-N 399.535 5.145 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc(OC)c1 502651204 IONLNBVLDWJWNP-UHFFFAOYSA-N 389.411 5.012 30 20 GKED N#CCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(Cl)cc1)CCC2 503652373 BADAJYKKRGBAEH-PEZBUJJGSA-N 387.870 5.018 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H]1CCOc2c(Br)cccc21 503889215 WBUIJRUTGPZNSU-UXHICEINSA-N 397.316 5.202 30 20 GKED Cc1cc(C)cc(NC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 505773003 XCYPKHURNTZKMW-QGZVFWFLSA-N 381.888 5.326 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508049469 GQMRMLTUKZDFJP-HXUWFJFHSA-N 381.545 5.296 30 20 GKED CC(C)[C@H](Sc1ccc(C#N)cn1)C(=O)Nc1cc(Cl)ccc1Cl 511850409 UFAYAGOUTAUBBW-INIZCTEOSA-N 380.300 5.015 30 20 GKED C[C@@H](NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccncc1F 513387501 BWCKVCMYXKGMMO-CYBMUJFWSA-N 395.821 5.029 30 20 GKED N#Cc1ccc(C2(c3nc([C@@H](F)c4ccc(C(F)(F)F)cc4)no3)CC2)cc1 516347218 PXPRHGNWSYYPPU-INIZCTEOSA-N 387.336 5.099 30 20 GKED CC(C)c1ccc(OCCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518259357 KLBSJBWUVLMRDH-KRWDZBQOSA-N 397.544 5.405 30 20 GKED Cc1ccc(CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C2CC2)cc1C 524850161 VJNFRQVWJQMVTL-UHFFFAOYSA-N 397.478 5.167 30 20 GKED Cc1ccccc1N(C(=O)Cc1cccc(C#N)c1)c1nc2ccccc2s1 531151775 ZWEMMIKTQDZODY-UHFFFAOYSA-N 383.476 5.384 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(-c3cccc(C(F)(F)F)c3)cn2)cc1 534066347 UYALCLRAXONDLD-UHFFFAOYSA-N 381.357 5.086 30 20 GKED N#CCC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccccc1 537324684 DOTZYSDJOJJJTE-FQEVSTJZSA-N 395.846 5.643 30 20 GKED C=CCCOCCCCC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 540611472 ZBEOFUNQDIOXNC-UHFFFAOYSA-N 382.888 5.363 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 546710679 WRTFDSCDOQCMMZ-UHFFFAOYSA-N 395.418 5.141 30 20 GKED COC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 550833492 YMEYLIUUBWIWQH-WOJBJXKFSA-N 376.422 5.418 30 20 GKED Cc1cc(Br)ccc1-c1noc(C[C@H](CC#N)c2ccccc2)n1 564274471 JDCOSGAJTMGEJX-HNNXBMFYSA-N 382.261 5.048 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)SCc1ccc(OC)c(C#N)c1 573836248 CHSVROSPQBBAFH-HOTGVXAUSA-N 382.529 5.341 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(c2cccc(OC)c2)CC1 574726573 YWIJYEDOLPMFLO-UHFFFAOYSA-N 378.516 5.400 30 20 GKED N#CCc1ccccc1NC(=O)Cc1cccc(OCc2ccc(Cl)cc2)c1 576310190 VNVUOQOUWLWKID-UHFFFAOYSA-N 390.870 5.166 30 20 GKED N#Cc1ccc(NC2CC2)c(NC(=O)c2sc3cc(F)ccc3c2Cl)c1 586819575 OVTMXJWFRGOYNL-UHFFFAOYSA-N 385.851 5.392 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 590252686 INYOBUJGTSEKOW-QWHCGFSZSA-N 391.286 5.606 30 20 GKED COc1cc2ccc([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)cc2cc1OC 595040305 XKTXZNNCFMROLD-JPYJTQIMSA-N 388.511 5.943 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 600201770 JXMZXUFLPGGAPB-ROUUACIJSA-N 382.410 5.061 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)c1ccccc1 602163620 PLSQLBCYMHEJEO-QGZVFWFLSA-N 384.435 5.198 30 20 GKED C=CCn1c(S[C@@H](CC)c2ccc(F)cc2)nnc1-c1ccccc1OC 606151399 REJQIEVBLZWNTB-IBGZPJMESA-N 383.492 5.522 30 20 GKED C[C@H](C[C@@H]1CCCO1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 608841363 NXFYCDJMLNRXKL-MOXGXCLJSA-N 397.906 5.075 30 20 GKED CCCCS[C@H](C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609060904 PIDBDQQLODLOBG-QGZVFWFLSA-N 382.529 5.306 30 20 GKED C[C@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccccc1C(F)(F)F 609082963 HZJOEERPKJGZFY-JTQLQIEISA-N 399.319 5.061 30 20 GKED N#Cc1c(NC(=O)Cc2coc(-c3cccs3)n2)sc2c1CCCCCC2 609261938 ABKHNBMOOVQGEE-UHFFFAOYSA-N 397.525 5.176 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H]3CCc4ccc(F)cc43)c2)cc1 609323048 YWAMSSMZFXDZLC-QFIPXVFZSA-N 387.414 5.299 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(OC(F)F)cc3)cc2)c1 609426813 GMOBBPVMBYEQFV-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cccc1[N+](=O)[O-] 609497339 HPESDRIATVKAKP-UHFFFAOYSA-N 387.395 5.014 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C[C@@H]3CCOc4ccccc43)c2)cc1 609785456 GGXJCPLCZQRPHE-SFHVURJKSA-N 384.435 5.245 30 20 GKED C[C@@H](CC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)n1cccc1 610207699 CCAVSOOBCSBSTQ-KRWDZBQOSA-N 377.875 5.198 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)CSc2ccc(C#N)cc2F)cc1 610218863 DMHDXDOFBGSWMI-UHFFFAOYSA-N 392.455 5.529 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCC(F)(F)C2)cc1Cl 610793228 RYZSAJNIRHLTSO-NVXWUHKLSA-N 389.833 5.305 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H]1F 611503325 WMKGXHZVTIEXSH-DJKXOVBDSA-N 385.870 5.207 30 20 GKED N#Cc1ccc(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1Cl 619748528 NNKLPRWISFIYKV-UHFFFAOYSA-N 392.730 5.539 30 20 GKED N#C[C@@H](C(=O)c1occc1-c1ccccc1)c1nc2ccccc2n1C(F)F 642282332 FFTHOPOXBTZGMZ-HNNXBMFYSA-N 377.350 5.181 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 661118127 WVMOHAOOHBITGC-TZIWHRDSSA-N 397.588 5.669 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Br)cc1C(F)(F)F 665800290 INONOMNRGHVSHY-TXEJJXNPSA-N 389.215 5.183 30 20 GKED CCOc1ccc(OCC)c(NC(=S)N(CC)[C@H](C)c2ccc(C#N)cc2)c1 726903880 PQPNITYVNJLAOY-MRXNPFEDSA-N 397.544 5.136 30 20 GKED C#CC[C@@H](OC(=O)c1ccc(CSc2nc(C)cs2)cc1)c1ccccn1 727775347 FKKWXKQARHTALK-LJQANCHMSA-N 394.521 5.060 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 727784213 BYDNHHLHTNPVQQ-NWDGAFQWSA-N 396.657 5.236 30 20 GKED C#Cc1cccc(N(C(=O)c2cc(Cl)c(OCCC)c(OC)c2)C(C)C)c1 728247667 DMJARPRQUGEYBA-UHFFFAOYSA-N 385.891 5.174 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cccc(OCC#N)c2)cc1 730150882 YOAZFICRHJEAGC-NTEUORMPSA-N 383.447 5.373 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 730689258 CLJNKPMKBLEXCC-XJKSGUPXSA-N 398.915 5.403 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C\c1nc2ccccc2s1 730988888 DOYCXCNOSATQTF-IWMPZKFUSA-N 379.510 5.200 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccccc2Oc2cccc(F)c2)cc1 731041485 BQCJHEMQIVKQAB-QGZVFWFLSA-N 376.431 5.199 30 20 GKED CCCCCCCCCC(=O)N1CCC(C(=O)c2c(F)cc(F)cc2F)CC1 734129712 IANVBVKTOUQRBA-UHFFFAOYSA-N 397.481 5.666 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156971 SGLPDJYNQWLDKJ-WMLDXEAASA-N 381.426 5.364 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3ccccc3F)n2)cc1 739157836 XIDKGJZJUQWWEE-MAUKXSAKSA-N 378.472 5.313 30 20 GKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1ccc(OCc2ccncc2)cc1 742437798 XQBKQEOQHAOFRB-YQNUULROSA-N 379.506 5.483 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@]12CCc1ccccc12)c1nc2cc(Cl)ccc2s1 744036407 YGDSKAUXHRNMNF-IUSZMWJPSA-N 378.884 5.030 30 20 GKED C#Cc1cccc(N(Cc2nc([C@H](C)OCC(C)C)no2)Cc2cccs2)c1 745983673 DALFAQHQCKZPIW-KRWDZBQOSA-N 395.528 5.053 30 20 GKED COc1ccc2nc(/C=C\c3ccc(OC)c(OCCCC#N)c3)sc2c1 747361503 QUDAFPOIIDUSIM-POHAHGRESA-N 380.469 5.166 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(Cl)s1 749910936 IRUWNICRHPSZOR-KSSFIOAISA-N 380.900 5.799 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1 751516586 DQFQPIXOLCAXDB-RMKNXTFCSA-N 377.494 5.262 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)/C=C/c1ccccc1C#N 759291928 WBEPXROTQHFBDE-TUQDCPSNSA-N 387.508 5.223 30 20 GKED C[C@@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 762234882 QQSNMQPHQIAZBE-HJPCULJESA-N 378.781 5.035 30 20 GKED CN(C)C(=O)Sc1ccc(CSCCCOc2cccc(C#N)c2)cc1 763214349 YURSXLOIYSAJJF-UHFFFAOYSA-N 386.542 5.034 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F)c1ccncc1 766800809 REJCWVCAVWNKAA-DOXZYTNZSA-N 391.437 5.209 30 20 GKED C#CCC(C)(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 767091492 MCOMMIADLYJVFI-UHFFFAOYSA-N 380.341 5.020 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccccc3SC(F)F)CC2)cc1 767816014 CAMWYAOBYIKBDF-UHFFFAOYSA-N 385.439 5.194 30 20 GKED N#C[C@H](C(=O)C1(c2c(Cl)cccc2Cl)CCC1)c1cnc2ccccc2n1 774271635 SMCUYHYUUDUEAN-ZDUSSCGKSA-N 396.277 5.235 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 785768864 MCJUROPJEPSQJX-NRFANRHFSA-N 386.517 5.090 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 793443619 RFLIWQSQRTZQFV-UHFFFAOYSA-N 379.460 5.087 30 20 GKED C#C[C@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1F 796085831 FYJWQSKZAUCKEH-NRFANRHFSA-N 378.834 5.701 30 20 GKED C=CC[C@@H](OC(=O)[C@H]1CCC(=O)c2cccn21)c1ccc(Cl)c(Cl)c1 797555214 VYPDEPPVWVOFTG-SJLPKXTDSA-N 378.255 5.173 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 797613064 BFXNUPPJIALIDH-IRLDBZIGSA-N 375.516 5.632 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)cc1 836269794 JBNUABJFRRGNNW-PQMPYMPHSA-N 383.495 5.018 30 20 GKED N#CCSc1ccccc1C(=O)N[C@@H]1CCC[C@H](c2cccc(Cl)c2)C1 837190612 UUIZFSBKWMKDOH-FUHWJXTLSA-N 384.932 5.412 30 20 GKED COc1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1NC(=O)OC(C)(C)C 850205468 FSHLILYMNLUEHI-UHFFFAOYSA-N 393.487 5.209 30 20 GKED Cc1cc(NC(=O)[C@H](C#N)CCc2ccccc2)ccc1NC(=O)OC(C)(C)C 856371787 AIHCCLWNQXTTTP-SFHVURJKSA-N 393.487 5.053 30 20 GKED N#C[C@@H](C(=O)C1c2ccccc2Oc2ccccc21)c1nc2ccccc2s1 916626985 LPOLXXFASZSLPH-INIZCTEOSA-N 382.444 5.410 30 20 GKED N#C[C@@H](C(=O)CCC1CCCC1)C(=O)Nc1ccccc1Oc1ccccc1 916904562 GGUCGVPSOSGASC-IBGZPJMESA-N 376.456 5.097 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2cn(CCC#N)nc2-c2ccccc2)cc1 917552190 OLVYFGNSWGLDHY-IBGZPJMESA-N 385.515 5.272 30 20 GKED Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919904645 QTMFNXJADCDSIM-DNQXCXABSA-N 381.479 5.460 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccc(Cl)cc3)cc2)ccc1Cl 1776033901 WJCXICCHECEXEW-UHFFFAOYSA-N 385.250 5.805 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCC(F)(F)F)c(F)c1 1776783891 HVTQZBBYPYWVMI-HNNXBMFYSA-N 393.421 5.060 30 20 GKED COc1cc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)ccc1SC 1777263882 NEHGAXJIELDRGB-UTCJRWHESA-N 384.478 5.226 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3ccc(Br)cc3)o2)c1 1777686109 KVBNTBXGTCRCNB-CSKARUKUSA-N 397.224 5.303 30 20 GKED C=CCCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC(C)(C)C)CC1 1826331873 YRTFTLUIKMDDEI-HXUWFJFHSA-N 390.612 5.035 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC(F)F)c(Cl)c1 18118007 AECWGDBWMJTSPA-UHFFFAOYSA-N 398.796 5.732 30 20 GKED C[C@H](NC(=O)c1oc2ccccc2c1COc1ccccc1)c1ccc(C#N)cc1 26121526 BBKHZCJSZCPJOB-KRWDZBQOSA-N 396.446 5.374 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Cc2ccncc2)cc1 52835214 GRTNKOVOKKWLQZ-UHFFFAOYSA-N 389.458 5.463 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Cl)cc2NC(=O)c2ccco2)cc1 56979188 NEDBHWOIYSIGJV-UHFFFAOYSA-N 396.830 5.002 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c2)C1 63398909 MHPGLBJKMMUQFS-JPYJTQIMSA-N 391.515 5.317 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 66037395 NIDSYHBIQBSVNC-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(C#N)CCCCC2)cc1Cl 72030214 KCXVXBUCJXTLSY-LJQANCHMSA-N 377.875 5.408 30 20 GKED CC(C)CCO[C@@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 109195686 JIIHDFLQEUCLAE-JXFKEZNVSA-N 384.907 5.385 30 20 GKED CCCCCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 128817639 RNCVADBDZRMQCQ-IBGZPJMESA-N 391.496 5.264 30 20 GKED CC(C)(C)c1cc(NC(=O)CCc2ncc(-c3ccccc3)o2)c(C#N)s1 154256862 ZAZXUYFQDOAZHL-UHFFFAOYSA-N 379.485 5.144 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccncc1 160928060 JKKAPEYQIBAVEB-HNNXBMFYSA-N 375.403 5.017 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 178379192 UBTHFAPZFZNSQM-UHFFFAOYSA-N 395.871 5.086 30 20 GKED COc1cc(CNc2ccccc2O[C@H](C)C#N)ccc1OCc1ccccc1 181132746 VGXSAUIMIDKJEX-GOSISDBHSA-N 388.467 5.177 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(CSc2ccccc2)cc1 182096875 QZCSAGGUBDMKRL-QGZVFWFLSA-N 388.492 5.522 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1 184357655 ZOFSCLCUHYKQGA-AOMKIAJQSA-N 389.430 5.028 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 193607965 IXPYLIHIEJAPKH-UHFFFAOYSA-N 394.544 5.336 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)N1CCC(OC2CCCC2)CC1 330338982 WCQTZYNNIJSQMD-UHFFFAOYSA-N 379.504 5.026 30 20 GKED Cc1cc(Br)c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)s1 410617164 JEGXOMICSGBRDW-UHFFFAOYSA-N 383.336 5.302 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)N(Cc1ccco1)Cc1cccs1 419616233 SDHKQPZJDZINFO-OAQYLSRUSA-N 391.496 5.002 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 427245061 YNYCDKRCQBXJJR-ZWKOTPCHSA-N 392.808 5.271 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Nc1ccc(-c2ccncc2)c(C)c1 427824111 IFNVJVIUVJJATO-GOSISDBHSA-N 391.540 5.134 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 429929159 SNZRSRORJYXPKB-NRFANRHFSA-N 392.911 5.475 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1ccccc1 430620999 CSBQYGHKFCISHM-INIZCTEOSA-N 392.528 5.240 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ncoc2-c2ccccc2Cl)s1 430643216 QQFZDZSRMWRAJC-GFCCVEGCSA-N 385.876 5.239 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCCOc2cc(Cl)ccc21)c1ccccc1 431454931 CMPXTYBLDASIGS-VQTJNVASSA-N 397.906 5.288 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1ccccc1C#Cc1ccccc1 432243987 ZOQYUBWNNBJKJT-QHCPKHFHSA-N 398.510 5.062 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccn1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 434229976 UWKMOKSJIMEVNL-LBPRGKRZSA-N 395.278 5.055 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2s1 435185943 ZQTVXRODQWKCMF-HNNXBMFYSA-N 384.892 5.425 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(Oc2ccccc2F)c(F)c1 436108343 ZEYGXVCWNUREES-HHHXNRCGSA-N 391.483 5.726 30 20 GKED CCOCc1ccc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 438061984 LWJFQHSOCIGXFG-UHFFFAOYSA-N 387.439 5.531 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 438221452 AQQNITFUEMYNNN-MTNREXPMSA-N 377.488 5.168 30 20 GKED N#CC1CCC(CNC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)CC1 441147317 ZZDOQRSPQXHPRK-UHFFFAOYSA-N 391.496 5.130 30 20 GKED C=C[C@](C)(CC)C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 443293433 FPNQICWMXSACJJ-OAQYLSRUSA-N 385.895 5.203 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443892504 WMWAZKBHUCDHRS-UHFFFAOYSA-N 379.407 5.252 30 20 GKED COc1ccc(C[C@H](NC2CCC(C)(C#N)CC2)c2ccccc2)cc1OC 449117373 OHWAUTYSZVHKCV-DQBMGFJSSA-N 378.516 5.050 30 20 GKED Cc1cc2cc(C(=O)N(Cc3ccc(C#N)cc3)CC(F)(F)F)oc2cc1C 463290893 VZMFRBIXPNHISB-UHFFFAOYSA-N 386.373 5.126 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)CCCCOc2cccc(C#N)c2)cc1 464049863 LVURLLNQMQRIRF-BJKOFHAPSA-N 390.527 5.211 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 464945278 ZXDHYLSWWBJOCC-RBUKOAKNSA-N 379.529 5.021 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(COc2ccccc2)cc1 464947497 FMBAMSBHQIBNCG-RPBOFIJWSA-N 396.490 5.178 30 20 GKED CN(C(=O)CSc1cccc(C#N)c1)[C@@H](c1ccccc1)c1ccc(F)cc1 468637346 IHNKLROTGAIUPU-QHCPKHFHSA-N 390.483 5.037 30 20 GKED C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 472750514 JSZTUMRWKQOKEO-HBFSDRIKSA-N 393.556 5.423 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2cccc(Cl)c2)n1 476081935 AXAKDAGBNYHCKG-UHFFFAOYSA-N 379.891 5.630 30 20 GKED C=C(C)[C@H](NC1CCC2(CC1)C(=O)Nc1ccccc12)c1ccc(F)c(F)c1 480663838 CIUUELAPXKUHLN-JCVMYPOKSA-N 382.454 5.004 30 20 GKED Cc1ccc(-n2ncc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2C(C)C)cc1 483213834 WDGTZHWRMMBDKJ-NRFANRHFSA-N 394.478 5.342 30 20 GKED CC(C)[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccncc1 483722130 MMWGWTUXMGQFOR-XMMPIXPASA-N 399.494 5.105 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)C12CC3CC(CC(C3)C1)C2 486117863 QTLZBVXEWGVFDA-VTZXFWRVSA-N 388.964 5.216 30 20 GKED CN(C(=O)c1ccc(C#N)nc1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 488255260 WUPQFSCBTPDWAP-UHFFFAOYSA-N 396.277 5.122 30 20 GKED C=CCN(Cc1coc(-c2ccc(F)c(F)c2)n1)Cc1ccc(Cl)s1 492166486 FKJXPJOLTQHACZ-UHFFFAOYSA-N 380.847 5.523 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)Oc1cccc(Cl)c1Cl 498296320 OSJJLBKAQDXJKY-GFCCVEGCSA-N 393.270 5.058 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 500102343 CDFXIBJGUFXRKJ-ZDUSSCGKSA-N 395.381 5.027 30 20 GKED CCOc1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)ccc1C 503419988 QFIHICKXNUCPHL-CQSZACIVSA-N 398.434 5.286 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1 510887159 IKJOYRLLBZKCBM-JOCHJYFZSA-N 397.478 5.137 30 20 GKED N#CCCC1CCN(C(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)CC1 516295716 YJAAXYPZTLGEDJ-UHFFFAOYSA-N 394.327 5.273 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 521800504 OGDIMZALPKUXQO-AWEZNQCLSA-N 396.512 6.201 30 20 GKED Cc1nc(NC(=O)c2cccc(Nc3ccccc3)c2)sc1SCC#N 522814508 NLIZLQXTOCFMFK-UHFFFAOYSA-N 380.498 5.063 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC)c1ccccc1OCC 523644185 WZLGGEUJZAWHEO-NRFANRHFSA-N 379.504 5.030 30 20 GKED CC(C)(C)Cc1nc(-c2ccc(C(=O)Nc3ccc(Cl)c(C#N)c3)cc2)no1 525534690 NJSWFJGOEWCZIS-UHFFFAOYSA-N 394.862 5.103 30 20 GKED N#Cc1ccsc1C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 525549117 WSEVCLBSUFILTP-UHFFFAOYSA-N 392.374 5.248 30 20 GKED COc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)c(OCc2ccccc2)c1 525891246 CHZMQVZHLSWKJQ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 532569897 AINZDPXQZIQSRK-MOPGFXCFSA-N 395.572 5.329 30 20 GKED COc1ccc([C@@H](Cc2ccccc2C)NCCCC(C)(C)C#N)cc1OC 539275136 AFPGWEUCDQLFSH-OAQYLSRUSA-N 380.532 5.216 30 20 GKED COc1ccc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543034543 OBMLEPSBRGNFDK-ROUUACIJSA-N 386.495 5.654 30 20 GKED CC(C)c1ccc(NC(=O)C[C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 551206107 PPYZCRKUTPSDOA-CVDCTZTESA-N 377.532 5.552 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1c1ccccc1 553071716 WSCDSULOLANKQC-HOJAQTOUSA-N 393.556 5.786 30 20 GKED CC(C)c1scnc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 555065251 HNWSIGYTICGENE-CYBMUJFWSA-N 387.917 5.533 30 20 GKED O=C([C@@H]1CC[C@H](C(F)(F)F)C1)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 557033603 KYTMZPCQRJUQAX-DIOULYMOSA-N 397.334 5.081 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(Oc3ccccc3C#N)c(Cl)c1)CC2 560142717 XXWMFJBDNGCJDV-UHFFFAOYSA-N 399.837 5.079 30 20 GKED Cc1cccc2c(CCC(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c[nH]c12 562213057 BVBIMQBFKJMIEI-ZDUSSCGKSA-N 377.513 5.106 30 20 GKED N#CC1(CC(=O)Nc2ccc(Oc3ccc(F)cc3)c(Br)c2)CC1 590362730 JXKXMQGIDIRHKI-UHFFFAOYSA-N 389.224 5.013 30 20 GKED Cc1ccc(C(C)(C)c2noc(/C=C/c3cn(CCC#N)c4ccccc34)n2)nc1 596625457 QUFWYRIOHWIZRZ-ZRDIBKRKSA-N 397.482 5.138 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 603559423 OBGWUPBMORDCFM-MSOLQXFVSA-N 390.508 5.177 30 20 GKED Cc1[nH]c2c(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)cccc2c1C 603626542 AMPNEIRAINYRKZ-UHFFFAOYSA-N 382.423 5.096 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@@H]1Cc2ccccc21 604364105 NYJHQRHFBIHCLS-IBGZPJMESA-N 383.451 5.120 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(OCC(F)(F)F)c2)c(Cl)c1 611097255 ZTLQDKCOAPKUCI-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C[C@H](N[C@H]1CCc2c(Cl)cc(Br)cc21)c1cccc(C#N)c1 611166866 PHDSDBCAFKEJGX-VOJFVSQTSA-N 375.697 5.312 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc(-c2ccccc2)cs1 613392505 QQATXIRVGJQSSY-KRWDZBQOSA-N 388.423 5.699 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccccc4)sc32)cc1Cl 619754986 QDVFHQSYADFHKM-SFHVURJKSA-N 379.916 5.502 30 20 GKED CC1(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)CCC(F)(F)CC1 628112895 DBCZDMVFTYBPHW-UHFFFAOYSA-N 383.323 5.372 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)s2)c(C)c1 647377328 DIEKFEZIPDSETA-MRXNPFEDSA-N 393.537 5.559 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 661115689 DLJPTXPDOVIMKR-PZJWPPBQSA-N 397.588 5.669 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1)C(C)(C)C 661755358 PLMNTCQHXBKZGJ-UHFFFAOYSA-N 377.941 5.268 30 20 GKED C=C(CNC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccccc1 672647273 WZXHDCLCRPKDBV-UHFFFAOYSA-N 395.846 5.020 30 20 GKED C=C(C)COc1cccc(NCc2ccc(OC)c(OCc3cccnc3)c2)c1 676322769 QLBVZCUODAOCEV-UHFFFAOYSA-N 390.483 5.236 30 20 GKED CCc1c(C)nn(-c2cccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2)c1C 678028852 YHBYVSZQCJVNAK-JOCHJYFZSA-N 394.478 5.090 30 20 GKED COc1cc(C2(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)CCC2)ccc1C 730417025 KVQDJAIWRQDGQD-INIZCTEOSA-N 394.471 5.051 30 20 GKED CCc1cccc2c(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c[nH]c12 731573877 KCVCZYYHUQHFGP-DEOSSOPVSA-N 393.490 5.567 30 20 GKED CCC(CC)[C@H](NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1cccs1 733848019 KDSFBSOMFUPNCS-NQIIRXRSSA-N 399.560 5.406 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@H](C)/N=C/c1cc(Br)ccc1O 735978745 KSEZKHOKACXWLF-BHSFVVSZSA-N 382.685 5.003 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)OC(=O)CCc1ccc(C#N)cc1 739589347 LOJYHCJSQJLZSR-KRWDZBQOSA-N 390.508 5.151 30 20 GKED Cc1ccc2oc(CN(Cc3ccc(OCC#N)cc3)Cc3ccco3)cc2c1 739914011 XAPZFDNDWDFERL-UHFFFAOYSA-N 386.451 5.439 30 20 GKED CC/C(=C/C(=O)Nc1nc(C)c(SCC#N)s1)c1cccc(Cl)c1 744489551 MIKZLYKJARXCTA-BENRWUELSA-N 377.922 5.153 30 20 GKED C[C@H](OC(=O)/C=C\c1ccccc1C#N)c1ncc(-c2ccc(Cl)cc2)o1 751656639 CPXFMDWHJBJNDE-MSKHEQNASA-N 378.815 5.184 30 20 GKED CN(CCC#N)c1ccc(CN2CCC[C@@H](c3nc4ccccc4s3)C2)cc1 768185438 PJBUKAOUSKWZGR-LJQANCHMSA-N 390.556 5.026 30 20 GKED Cc1nc2cc(C(=O)OCCCCC(C)(C)C#N)ccc2n1Cc1ccsc1 768892714 QYRLIMXUWYLBPQ-UHFFFAOYSA-N 395.528 5.331 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2ccc(Br)cc2)cc1 768936552 MSPWBXJJDPRZKB-FOIQADDNSA-N 385.305 5.077 30 20 GKED Cc1c(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1C1CCCC1 770177141 DPOSPWZGLSPBTI-JOCHJYFZSA-N 399.498 5.606 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2cccc(O[C@H](C#N)CC)c2)cc1 772985616 SZPBKSZYKHWGCA-XLIONFOSSA-N 384.907 5.350 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Br)s2)c1 772985932 UZTFGDSSBDROHZ-TZMCWYRMSA-N 379.323 5.042 30 20 GKED Cc1c(C(=O)/C=C\c2nc3ccc(Br)cc3s2)cnn1C(C)C 773148782 HVPPKMJVTADPGI-SREVYHEPSA-N 390.306 5.041 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)CNc2ccccc2O[C@H](C)C#N)C(C)C)cc1 773369259 SPPRCJGSXIOUJK-KOSHJBKYSA-N 393.531 5.026 30 20 GKED N#CC1(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)CC1 775827930 YSUQCJYWQNGICU-SSZFMOIBSA-N 384.435 5.165 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1ncc(C(F)(F)F)s1 788353607 AURMIDMQUVHSLM-VOTSOKGWSA-N 398.406 5.629 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)Cc2coc3cc4c(cc23)CCC4)s1 797568503 JETHDBVRIJQOKK-KRWDZBQOSA-N 378.497 5.094 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccc(-c4cc[nH]n4)cc3)no2)c2ccccc21 809294216 DLOGNNZMMQSPNB-UHFFFAOYSA-N 394.438 5.052 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Br)c1 813096422 LTBLXOXENPFHLM-RISCZKNCSA-N 391.334 5.183 30 20 GKED O=C(c1ccccc1Oc1cccnc1)N(O)Cc1cc(Cl)cc(Cl)c1 901379076 VAXDDPVIYOQXRB-UHFFFAOYSA-N 389.238 5.212 30 20 GKED CC(C)c1ccccc1OCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086503 LFUAQPNSRFFICQ-QHCPKHFHSA-N 384.479 5.483 30 20 GKED COc1cccc(/C=C\C(=O)c2sccc2Br)c1OC(C)C 915113958 YTBOROWCHUWXEF-FPLPWBNLSA-N 381.291 5.203 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 915747259 YFSMUJKFXQUJGW-ZAGZISDZSA-N 378.884 5.192 30 20 GKED COc1cc(Cl)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 921281252 OGVTZVZEZMTRKF-FQEVSTJZSA-N 376.843 5.256 30 20 GKED O=C(O)c1cc(NN=Cc2ccccc2OCc2ccc(Cl)cc2)ccc1F 1776064385 MDSSWYSLJWWBHZ-UHFFFAOYSA-N 398.821 5.202 30 20 GKED O=C(/C=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccc(F)cc1F 1776125484 JUTFNQRUIFXBDY-RYGYDFEPSA-N 394.373 5.066 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776327494 YYSWJVYHIFJMIT-POHAHGRESA-N 377.440 5.187 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2ccc(Cl)cc2)[n+]2ccccc2)c1 10832510 HSVHPVOCLIVUMX-UHFFFAOYSA-O 395.935 5.295 30 20 GKED N#CCCn1cc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)c(-c2ccccc2)n1 33466631 QHZPABNRQSBJOL-KHPPLWFESA-N 395.422 5.091 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1OC(C)C 41535903 QCRKAXHTNUIPOK-QGZVFWFLSA-N 392.480 5.096 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2sccc2C(C)C)cc1 60351445 WAIYQWXKWGABPW-UHFFFAOYSA-N 392.480 5.796 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cn(-c2ccccc2)nc1-c1cccs1 63960487 SJRNUEAFQAXIOV-UHFFFAOYSA-N 384.464 5.033 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccn3)cc2)c1 66953301 SWUBRFKHUGVBAL-QFIPXVFZSA-N 384.439 5.115 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2sc(C)c(C)c2C#N)cc1 69620157 LMYMYJAKTYTOLI-UHFFFAOYSA-N 381.526 5.158 30 20 GKED Cc1nc(CCC(=O)Nc2ccccc2SCCC#N)oc1-c1ccccc1 108201006 AAASDCMZISDYBC-UHFFFAOYSA-N 391.496 5.227 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(=O)oc2cc3c(cc12)CCC3 109323623 JGPIBNGZHFDBNK-OAHLLOKOSA-N 390.508 5.288 30 20 GKED C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccccc1SC[C@H](C)C#N 112817945 OLLACAPMZIGLSM-OLZOCXBDSA-N 392.883 5.137 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2ccccc2F)n1Cc1ccco1 122754927 QWLHJCQKJSSMHE-UHFFFAOYSA-N 384.480 5.148 30 20 GKED COc1cccc(NCc2nnc(SCCCCC#N)n2C2CCCCC2)c1 123975778 NSDSVYLVEBTYRO-UHFFFAOYSA-N 399.564 5.190 30 20 GKED C[C@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccc(C#N)cc1 154331215 UWXULYZVKXNHBT-LIRRHRJNSA-N 377.488 5.549 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(NC(=O)CCC)c1C)c1ccccc1 155401122 GRTQFNBFJLQCBA-OAQYLSRUSA-N 379.504 5.563 30 20 GKED C=CCC(CC=C)C(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 157671399 YZPLHLZXQYSJMT-UHFFFAOYSA-N 382.331 5.269 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Nc3ccccc3C(C)C)n2)cc1 160114405 HBWFFNYDRUTGRY-GOSISDBHSA-N 391.496 5.188 30 20 GKED COc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 173116617 ARFLQOPLRJRDPE-IAGOWNOFSA-N 397.544 5.042 30 20 GKED COc1ccc(CNc2ccc(OC(F)F)c(Cl)c2)cc1OCCCC#N 178800735 YTHZAXSUAKLKGE-UHFFFAOYSA-N 396.821 5.245 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 182081794 KMKOLANNTASKHY-GFCCVEGCSA-N 395.390 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(CC(C)C)c1C(F)F 189895993 AVFNTTYBJXSUCX-UHFFFAOYSA-N 375.463 5.581 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C(=O)N(C)CCCC)CC1 191417504 QSPHGBZOCBFEED-UHFFFAOYSA-N 399.579 5.041 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC/C=C\c1ccccc1 255547206 ZNJFPSGIISDLBG-JEZWAEDTSA-N 382.554 5.323 30 20 GKED COc1ccccc1[C@@H]1CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 303170512 ISMRVDXVVYEOSM-QHCPKHFHSA-N 398.462 5.336 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 303487712 KFYVOKHPYWKNQO-RBBKRZOGSA-N 396.918 5.672 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Br)cc1F 321888035 OBHCDYSKAXNCSJ-CYBMUJFWSA-N 377.257 5.444 30 20 GKED OC(=Nc1ccc(F)cc1NC1CC1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329478392 QCONZMCIUIXJGU-MRXNPFEDSA-N 396.510 5.495 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)c1ccc(OC2CCC2)cc1Cl 410974258 XGOWIWQEIWSCRP-UHFFFAOYSA-N 375.255 5.243 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@H]2C 410980792 NFLYEIKZVVAFEU-VXGBXAGGSA-N 395.484 5.043 30 20 GKED C=C[C@H](CCC(=O)O)NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1 417625007 LFAGWVWEVVAOMR-MRXNPFEDSA-N 379.378 5.007 30 20 GKED CC(=O)c1cccc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 419512247 WVFLLPGGHRQQNG-OAHLLOKOSA-N 398.553 5.013 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 426126351 GWPWGWYOBYIGNR-UHFFFAOYSA-N 377.469 5.077 30 20 GKED CC(C)c1ccccc1-n1c(S[C@H]2CC[C@@H](C#N)C2)nnc1-c1cccnc1 430100628 MAXIDDRSMJLRAU-AEFFLSMTSA-N 389.528 5.237 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Sc3ccccn3)cc2)s1 430595662 HXYNXORBFKSDEC-MRXNPFEDSA-N 393.537 5.477 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(Cl)cc(Br)c2)s1 430631310 UMJSMXUJHSEUFH-LBPRGKRZSA-N 397.725 5.347 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C2CC2)cc1F 433149133 SKXBFHASMAIOFA-AWEZNQCLSA-N 383.492 5.419 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1ccc(SC)c(OC)c1)c1ccccc1 435109713 DUVCDHREBJQGLS-IBGZPJMESA-N 384.545 5.266 30 20 GKED CC(C)c1ccc(-c2ncc(C[S@@](=O)CCCCC(C)(C)C#N)s2)cc1 436109554 VIFZEMOOGSKESR-SANMLTNESA-N 388.602 5.902 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@H]3/C=C\c3ccccc3)o2)cc1 441181935 OVMUFWSGZRLXNS-QKWZMAAQSA-N 384.483 5.066 30 20 GKED CCCOc1ccc(CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 463748249 XRUQBQQTUHPHQP-KRWDZBQOSA-N 382.529 5.298 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(-c2cscn2)c1 463751989 AALFQMVKGGHLFZ-AWEZNQCLSA-N 379.510 5.457 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N[C@](C)(C#N)C(C)(C)C 464162053 KIRZBRWYUCCYFP-GOSISDBHSA-N 380.275 5.015 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccc(OC)cc1)c1ccc2nc(C)[nH]c2c1 466443407 GITUYFOKPCWDNU-INIZCTEOSA-N 377.488 5.015 30 20 GKED CCCC1(CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 470796372 WDUAWAJUPCODRG-UHFFFAOYSA-N 377.488 5.033 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccccc1 474895570 MZMCCFZJUDXFSV-GCJKJVERSA-N 394.927 5.695 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2ccc(Cl)cc2)n1 476138434 GMRQCXFHMMIQDA-UHFFFAOYSA-N 393.918 5.938 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nccc4ccccc34)cs2)c(C)c1 483205360 SUZZWYDKHAXRAP-IBGZPJMESA-N 383.476 5.465 30 20 GKED Cc1c(C(=O)Nc2nc3c(cc2C#N)CCCC3)oc2c1ccc1ccccc12 484173432 XRNXVGLNSZWPFJ-UHFFFAOYSA-N 381.435 5.292 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)[C@H](c2cccc(Cl)c2)C(C)C)cc1 486620909 PELLWXJLLQNHTQ-IBGZPJMESA-N 385.895 5.026 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1nc2ccccc2o1 492122363 LXDYMCKYPDCOTL-MRXNPFEDSA-N 390.345 5.388 30 20 GKED CC(C)Oc1cc(F)ccc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 492183802 ZUEZNSWMXVOCQL-AWEZNQCLSA-N 387.480 5.651 30 20 GKED N#C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1c(Cl)cccc1Cl 505540208 MJBMNLAVIBOPON-CYBMUJFWSA-N 391.151 5.146 30 20 GKED N#CC1(CCCSCCOC(c2ccccc2)c2ccccc2)CCOCC1 507702513 LJACEHYJUZUAQC-UHFFFAOYSA-N 395.568 5.626 30 20 GKED CCN(CCNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(C)c1 518252728 BHFJUYULDOHBIB-GOSISDBHSA-N 396.560 5.037 30 20 GKED CC(C)Sc1ccc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 520271733 GIVKHOWSTVZVJW-KRWDZBQOSA-N 379.312 5.489 30 20 GKED C=CCN(C(=O)c1ccc(Cl)cc1OC)c1nc(-c2ccccc2)cs1 520690790 NXRGALSHDHOFJJ-UHFFFAOYSA-N 384.888 5.305 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2ccccc2)nc1)c1ccc(Cl)c(Cl)c1 521016125 JRPRSYRFJQQXRP-GOSISDBHSA-N 398.249 5.175 30 20 GKED Cc1cc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1C(C)C 521800985 VMADVWVBXJKDHV-KRWDZBQOSA-N 382.529 5.530 30 20 GKED COC(=O)[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc(Cl)c1 522753684 ZKCZITUCCHIRJK-OAQYLSRUSA-N 392.842 5.330 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(OC)c(OC(F)F)c1 529134772 FQFMNTXGSIQQJP-UHFFFAOYSA-N 389.442 5.330 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc2c1CCN2C(C)=O 530500171 XRDXXFAGZXYXMM-UHFFFAOYSA-N 377.488 5.092 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C)c1ccccc1 535366680 CADXKVNTYSNCCZ-AZUAARDMSA-N 390.527 5.166 30 20 GKED C=CCCC[C@H](C)NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 537230458 LVLRUAYEJFDWBX-ZDUSSCGKSA-N 381.303 5.442 30 20 GKED CSc1cccc([C@H](NCc2cc(C#N)cs2)c2cc(F)ccc2F)c1 537330261 WJVMSGPXQNTFNC-FQEVSTJZSA-N 386.492 5.499 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)Nc1cccc(OCCCC#N)c1 539335732 UKOHHHCUQYWLOH-UHFFFAOYSA-N 383.517 5.434 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1OC1CCCC1 542285480 VPXUTERVGICMKK-MRXNPFEDSA-N 392.480 5.116 30 20 GKED N#CCC1CCN(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 543828179 NNZMCEIHDCVFRR-UHFFFAOYSA-N 385.920 5.649 30 20 GKED COc1ccc(CN2CC3(CCC3)[C@@H]2c2ccccc2)cc1OCCCC#N 552316493 BUYDSDFTLMCWHF-QHCPKHFHSA-N 376.500 5.105 30 20 GKED N#Cc1nc(N[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)ccc1Cl 553562784 QUGZZDJSRPNXSV-GOSISDBHSA-N 395.812 5.205 30 20 GKED Cc1ccc(NCCCC(C)(C)C#N)cc1Oc1ncccc1Br 555123509 KFIISUKEXGEGTP-UHFFFAOYSA-N 388.309 5.687 30 20 GKED Cn1c(CN[C@H](CCCC#N)c2ccccc2)nc2cc(C(F)(F)F)ccc21 561315372 SFWBYSUAXGTDSY-QGZVFWFLSA-N 386.421 5.117 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1 565617955 AJUIPSISESBHFN-SOUVJXGZSA-N 399.482 5.666 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)CCCCC2=O 572811177 QXKNHFRRUQMUGC-HNNXBMFYSA-N 378.497 5.100 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)SCCOc1cccc(C#N)c1 575212317 QDGWVZOWGUSYGY-SJORKVTESA-N 382.529 5.211 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@@H]2CC[C@H](C(F)(F)F)C2)n1 575954906 KTDYCZPVUNDDKJ-ADEWGFFLSA-N 382.279 5.593 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1Oc1ccncc1 581048652 KSADDPMQJSUTQB-QGZVFWFLSA-N 391.496 5.426 30 20 GKED CC(C)c1ccccc1N(C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 582145542 LLLZDTRGCDHEIL-KRWDZBQOSA-N 381.545 5.137 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@H]1CCOC(C)(C)C1 589243749 OZXGNTZHTYZSKM-IBGZPJMESA-N 393.487 5.162 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2sc(C)c(C)c2C#N)cs1 591311562 FZLOJVHBOHUJGX-UHFFFAOYSA-N 399.566 5.546 30 20 GKED N#CCCC[C@H](NC(=O)N1CCc2oc(-c3ccccc3)cc2C1)c1ccccc1 593407005 PHYRGDZXKOKBKU-QFIPXVFZSA-N 399.494 5.449 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(C(=O)N3CCCCCC3)cc2)cc1 593945564 ZJKGAARGSFDFIJ-UHFFFAOYSA-N 375.516 5.116 30 20 GKED Cc1sc(C2(N[C@H](C#N)c3ccccc3)CCC2)nc1-c1ccccc1F 595504468 CXTVYSNOHMGPCD-LJQANCHMSA-N 377.488 5.491 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1CCC(F)(F)C1 601059748 KCESEXIKQOGSNX-UONOGXRCSA-N 384.517 5.188 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603691951 ZKRACNOCWQWDHA-QFIPXVFZSA-N 398.466 5.423 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccccc1SCCC#N 609375837 AVYVOINBMCVSAU-ZDUSSCGKSA-N 393.339 5.816 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 609546878 UTXSRPDRHZJFSJ-DHIUTWEWSA-N 375.516 5.062 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccc(C#N)cc1F 609563298 RKSPIQZKOQCFBE-UHFFFAOYSA-N 382.341 5.044 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCc2ccc(Cl)o2)c1 609731073 LDKWKAHCASOLEZ-UHFFFAOYSA-N 387.222 5.180 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)c(F)c1 609778510 KSHUHETWLOIXQS-FQEVSTJZSA-N 385.870 5.178 30 20 GKED C[C@@H](CCC(C)(C)C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 609927757 LFCRTAHOPKAFQL-SFHVURJKSA-N 393.531 5.668 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCC(F)(F)C2)cc1Cl 610793231 RYZSAJNIRHLTSO-WBVHZDCISA-N 389.833 5.305 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)C1 612294456 YLXUOIBZERWTPC-NRFANRHFSA-N 376.485 5.121 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)n(CC(F)(F)F)c1C 616083560 WLDKWSJAQUKMON-UHFFFAOYSA-N 390.858 5.211 30 20 GKED O=C(c1cc2cc(F)ccc2s1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618363756 NKDBPTZHVHZNPE-AOOOYVTPSA-N 399.331 5.243 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(CC(C)C)cc3)n2)cc1 619756476 YRHXRNQJMDMFJM-HXUWFJFHSA-N 390.508 5.507 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)C1CCCCCC1 726319893 PIJOHJOGZONSMG-IBGZPJMESA-N 376.456 5.097 30 20 GKED COc1cc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)ccc1O 728438802 OYCGFFVDWRHMOQ-UVTDQMKNSA-N 397.883 5.390 30 20 GKED CC(C)C[C@H](C)N(C(=O)c1cc2ccccc2n1CC#N)c1ccc2[nH]ccc2c1 729653942 RDFYQPGBJQCWGC-SFHVURJKSA-N 398.510 5.728 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCc2cccc(F)c2)cc1 731753117 XNKWMKIVBYBJSD-HSZRJFAPSA-N 387.458 5.235 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H](C)c1c(Cl)cccc1Cl 733098686 DHJDCADNXLYVGI-AWEZNQCLSA-N 398.293 5.232 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(SC(C)(C)C)cc2)cc1 733632368 XJMQAPPRQWQBKI-UHFFFAOYSA-N 398.532 5.529 30 20 GKED CC[C@H](OC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679440 HZMOOVCDLBATNZ-AEFFLSMTSA-N 388.920 5.378 30 20 GKED C=CC[C@@H](NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccncc1 734234035 FGCCEUHNXMGNKG-WAEYIKQSSA-N 378.472 5.396 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccncc1 734664772 RCHIYIBYYMZNPK-PMACEKPBSA-N 397.931 5.503 30 20 GKED COc1cc(C(=O)/C=C/c2cnc3ccc(Cl)cn23)ccc1SC(F)F 737445151 WUZTUODAONBKSA-SNAWJCMRSA-N 394.830 5.207 30 20 GKED CCCCCCCC(=O)N(CC)C1CCN(c2cc(C)nc(C(C)C)n2)CC1 740787065 ZXYVAQNKDAKIQF-UHFFFAOYSA-N 388.600 5.086 30 20 GKED Cc1ccc(OC[C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 743294467 KDFOKPNZELTMHX-YADARESESA-N 399.494 5.240 30 20 GKED O=C(COc1ccccc1F)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746438646 ZQZPYAJPIVQISM-OAHLLOKOSA-N 396.258 5.070 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Cc2ccc(Cl)cc2Cl)n1 747197391 YVGOYTHCSFLJQZ-BXUZGUMPSA-N 381.328 5.628 30 20 GKED N#CCC[C@H](NC(=S)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1 747708549 HOCJCXHHTPVNEW-HNNXBMFYSA-N 395.862 5.273 30 20 GKED CCO[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 761049740 QHUNOWMAVWASGU-MAUKXSAKSA-N 376.909 5.091 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(OCC)c(OC)c2)cc1 764912732 IVCBREBEDNKUSG-MRXNPFEDSA-N 375.896 5.076 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C#N)CCc1ccccc1 774091632 VBXNVRSMRLYXFJ-NZQKXSOJSA-N 398.506 5.255 30 20 GKED CCCCCn1cc(C(=O)Nc2ccc(F)cc2OCC#N)c2ccccc21 777413683 BHXSUGJQXMWZTE-UHFFFAOYSA-N 379.435 5.125 30 20 GKED Cc1ccc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(Cl)n1 782485261 GESRXQBNOWRGMO-HNNXBMFYSA-N 375.859 5.073 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCc2c(Br)cccc21 782890847 UJOUUADSSBOQSR-JLHYYAGUSA-N 397.297 5.180 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1cc(Cl)ccc1OC 792671457 FGGNOVHAKJMBMD-UHFFFAOYSA-N 387.357 5.449 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CCc3c(Cl)cccc3C2=O)cn1 792889629 ILNAWIZQAMGYAG-PTNGSMBKSA-N 376.843 5.018 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 793164954 QYYPPBYLXCHNCU-GOEBONIOSA-N 394.462 5.730 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)NCc1ccc(C#N)c(Cl)c1 800825108 DEKIMEDTGWIXMR-UHFFFAOYSA-N 385.964 5.945 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 805877567 LDAQXFWJPHWSDJ-ACJLOTCBSA-N 389.455 5.039 30 20 GKED N#Cc1c(F)cccc1/C=C(\Cl)c1nc2ccc(Br)cc2o1 812249081 WGPOWSRXZSUHOP-SDQBBNPISA-N 377.600 5.338 30 20 GKED N#C[C@@H](C(=O)CCSc1cccc(Cl)c1)c1cc(C(F)(F)F)ccn1 813209934 GNEMRDQDVHYVEK-CQSZACIVSA-N 384.810 5.112 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC(F)F)c(F)c2)cc1 815010621 LYCHTMXTZGAWNU-SFHVURJKSA-N 396.368 5.335 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2nsc3ccc(C)cc23)cc1 815909967 MFTOTXBSBCANOM-KBXCAEBGSA-N 391.496 5.079 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817861023 BGCSGLITNKUZPS-STQMWFEESA-N 382.813 5.291 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2scc(C(C)(C)C)c2C#N)cc1[N+](=O)[O-] 839370004 QJERGQOCMXMBCZ-UHFFFAOYSA-N 377.853 5.040 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H]2CCSc3ccccc32)cc1 842289594 RKUCZMVFLXYYRG-YSSFQJQWSA-N 392.524 5.127 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@H]2N[C@H]1CCc2ccc(C#N)cc21 850539025 PTWFAEUEAQKMAR-YADHBBJMSA-N 389.499 5.170 30 20 GKED O[C@@H]1CCc2cc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)cnc21 854203548 QKPWRMYWYLSGGY-CYBMUJFWSA-N 379.275 5.018 30 20 GKED CC1(C)C[C@H](C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C(C)(C)O1 860478273 UHCGKBNKXJVDME-VXGBXAGGSA-N 396.434 5.085 30 20 GKED C=CCC[C@@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 901689885 JHJYXOIRJZSRAC-LJQANCHMSA-N 377.843 5.089 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CSc3ccccc3C)n2)cc1 916628294 PRMXWPNNDSZOPE-QGZVFWFLSA-N 378.522 5.396 30 20 GKED N#C[C@@H](C(=O)COc1ccccc1Cc1ccccc1)c1ccc2ccccc2n1 916848151 CSQUIPMPQYTBGS-JOCHJYFZSA-N 392.458 5.081 30 20 GKED Cc1c(C(=O)/C=C/c2csc(-c3ccsc3)n2)cnn1-c1ccccc1 920065700 GYVJTPCTZHICNH-BQYQJAHWSA-N 377.494 5.262 30 20 GKED N#C[C@@H](C(=O)/C=C/Sc1ccccc1)c1nc(-c2c(F)cccc2F)cs1 920803819 DOSSGFHQXRWEAB-HBWSCVEGSA-N 398.459 5.571 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3ccc(Cl)cc3)c2)c1 1776032785 SBWLPDIWJOTGAQ-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CCCCCC/C(C=NNc1ccc(C(=O)O)cc1OC)=C/c1ccccc1 1776049765 ACTQYBZUHJBVOO-VMJWAYEFSA-N 380.488 5.845 30 20 GKED C[C@@H](ON=Cc1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccccc1 1776083234 STOSXKQSZQCVEZ-VGOFRKELSA-N 375.424 5.003 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)C1 1776155561 BEGWLNHZWDHEKC-JOCHJYFZSA-N 385.891 5.375 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cnc(-c2c(F)cccc2F)s1 1776785658 OWUCFULUFQNQEY-AWEZNQCLSA-N 396.503 5.382 30 20 GKED CCCCCCCOc1cccc(CN[C@@H]2CCCC[C@@H]2CCC(=O)O)c1 1776787275 KJZGBRPDBHPOJK-IFMALSPDSA-N 375.553 5.549 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 1777268205 QDENHEZTZNXYMI-QPJJXVBHSA-N 385.630 5.250 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2csc(C(=O)O)c2)cc1 1777472315 SZMGOVUQTLPOMK-WDZFZDKYSA-N 378.449 5.230 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cccc(C)c2C)[n+]2ccccc2)s1 22729420 LJTGKWIMCTXGEX-UHFFFAOYSA-O 381.546 5.012 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(C)c(C)cc2C)nnc1-c1ccco1 28503282 UHEAPZXSGAVRHI-MRXNPFEDSA-N 381.501 5.013 30 20 GKED O/C(=N\c1nnc(C2CCCCC2)s1)c1c[nH]c(=S)n1-c1ccccc1 29089370 HJDVKSSIKSWVTM-UHFFFAOYSA-N 385.518 5.070 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CCCc3cccs3)c2)c1 32288485 RPBCSHLGLSEGHK-UHFFFAOYSA-N 376.481 5.160 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2o1 41543197 GWVBCZONUYIING-AWEZNQCLSA-N 393.855 5.403 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccccc2)cs1 54894934 JEWGRCGBJIFMDU-XFXZXTDPSA-N 382.872 5.377 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cccc(Br)c1 63274657 OUAJVLKEXKERNI-SNAWJCMRSA-N 376.300 5.530 30 20 GKED CCc1ccc(C(=O)CCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66856462 QFIHROKIJBHOHA-MRXNPFEDSA-N 380.513 5.245 30 20 GKED COc1ccc(CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1 108532774 RAKNHJSWMFKNCH-MRXNPFEDSA-N 395.528 5.143 30 20 GKED CCOc1cccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108533242 JRARTEGVHKIAMS-HZPDHXFCSA-N 383.517 5.220 30 20 GKED Cc1cc2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc2[nH]1 116897267 CCVSBXWTFVMPLS-UHFFFAOYSA-N 383.476 5.752 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccccc2)c2nccs2)cc1 123360939 JCECQKKFYFRCNT-OXQOHEQNSA-N 384.932 5.715 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1C1CC1 157881247 PBBLNQQXAOEXSX-BDJLRTHQSA-N 391.302 5.033 30 20 GKED C[C@H](Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(OCC#N)cc1 183053349 RHWYWPMEEGGVPW-KRWDZBQOSA-N 389.524 5.386 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)Nc1ncccc1OCCCC#N)C1CC1 188710828 AJCAQWQJYBBHNE-HNNXBMFYSA-N 398.894 5.175 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@H](C)[C@H](C)CC2 410987569 RFFFHMBEACMPOL-VXGBXAGGSA-N 395.484 5.043 30 20 GKED N#CCCC[C@H](NCc1cccc(Br)c1Cl)c1ccccc1 411756355 JZJQMKUPUSPATQ-KRWDZBQOSA-N 377.713 5.627 30 20 GKED C[C@H](NCc1ccc(C#N)s1)c1ccc(Br)cc1C(F)(F)F 421848820 APEFNRMAEGJBST-VIFPVBQESA-N 389.240 5.252 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc3nc(-c4ccccc4)[nH]c3c2)c1 427789232 NLEXIJRHYXOIJL-UHFFFAOYSA-N 384.464 5.098 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ncc(-c2ccccc2)o1 431977325 LPDBOLXQFHGUIW-PXNSSMCTSA-N 388.471 5.137 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OCC(F)(F)F)c1 432677810 KSTPZZUOIATQON-ZDUSSCGKSA-N 394.418 5.274 30 20 GKED Cc1oc(C#N)cc1C(=O)N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 436153078 JISKMOSVXWNXNJ-INIZCTEOSA-N 382.769 5.013 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCOc2ccccc2F)cc1F 437485373 YJUCKIFONBGBJA-UHFFFAOYSA-N 394.377 5.036 30 20 GKED Cc1cscc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 439307188 VSXINVIUJOXQET-QGZVFWFLSA-N 381.888 6.009 30 20 GKED C[C@@H]1CCC[C@@](C#N)(NC(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)C1 444021870 JEPOVDPAFUKTBJ-BFUOFWGJSA-N 392.377 5.047 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H]1CC12CCSCC2 448948911 GGVMEVPKIUASBI-HXUWFJFHSA-N 394.515 5.072 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CCC(C#N)CC3)c(F)c2)cc1 455513398 LGQPBMIRHXREAT-UHFFFAOYSA-N 381.451 5.047 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCC[C@H]1c1ccc(F)cc1)c1ccccc1 458807861 YAAHOTDYLQSQFQ-YADHBBJMSA-N 379.479 5.497 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)cc1 458849977 TYOODEUBOLPKSP-WWPVKYPJSA-N 375.516 5.318 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(c4cccc(Cl)c4Cl)CC3)cc2)CC1 462389635 CUQHPHNQBGORGS-UHFFFAOYSA-N 399.321 5.568 30 20 GKED N#C[C@@H](C(=O)c1cccc(Nc2ccccc2)c1)c1cc(C(F)(F)F)ccn1 464472349 OPOWWLDCQGOVBY-GOSISDBHSA-N 381.357 5.334 30 20 GKED Cc1ccccc1-c1nc(C(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cs1 464933823 BCFJENHOSZLTNO-PZJWPPBQSA-N 387.508 5.031 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 464944445 OTAPKEUACLRIJM-PXCRPINLSA-N 398.428 5.107 30 20 GKED CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 469689671 HUFPFKKUUISIBZ-ICSRJNTNSA-N 395.572 5.956 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 470621720 CZDAOEBLSDCUCL-RDDDGLTNSA-N 393.249 5.137 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(C(C)(C)C#N)cc1 474901881 SBMIAYVQKIFGIJ-UHFFFAOYSA-N 397.478 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cc(OCCC)ccc2C1 475551877 YNFQEKYFMLWEDW-UHFFFAOYSA-N 392.543 5.918 30 20 GKED COc1ccc(CN[C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc1OCCCC#N 475673878 XQZATESHMYKDDP-KESTWPANSA-N 384.907 5.067 30 20 GKED C=CCn1c(SCc2ccn(C3CCCC3)n2)nnc1-c1cccc(C)c1 477531374 QFKKNYTXEKTNAZ-UHFFFAOYSA-N 379.533 5.043 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(Cc3ccco3)C3CCCC3)c2)cc1 482505769 OLKRWMSKYSXXMC-UHFFFAOYSA-N 386.451 5.529 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(Cc2ccccc2F)n1)c1ccccc1 487506963 WTLKYDPTKZYPAK-IBGZPJMESA-N 393.487 5.038 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2ccc(Cl)c(C#N)c2)cc1 494678977 ISCYANVPVSCDRQ-UHFFFAOYSA-N 381.888 5.133 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 497588080 BYWXUBKYFZYPQT-FQEVSTJZSA-N 388.433 5.096 30 20 GKED CCc1cnccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 499405721 NMXLYIQYNADQLH-HXUWFJFHSA-N 375.859 5.205 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)CC2)cc1 503897021 GHVZBAPNZPJHSB-PMACEKPBSA-N 397.305 5.284 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC(F)F)cc1F 512477825 CXQVVQNFAFKRNI-UHFFFAOYSA-N 382.341 5.218 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 515321874 YVRBNQPGAXVEPM-UHFFFAOYSA-N 379.510 5.435 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 515598812 CDOBCDPGWNUEFR-JTQLQIEISA-N 389.318 5.068 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 518729952 IITPRHCTLMHCRA-UHFFFAOYSA-N 386.451 5.528 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccc4nc(C(F)F)sc4c3)on2)c1 520268574 SYWPNNPXUUGIIT-UHFFFAOYSA-N 396.378 5.013 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCc1csc2ccccc12 521261753 XGJPSCLIURWHNN-OAHLLOKOSA-N 395.553 5.517 30 20 GKED N#C[C@H](NC(=O)CCc1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 521352612 AZUCDDJTTKQXTB-FQEVSTJZSA-N 382.385 5.172 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2cc(F)ccc2F)c2ccccc2)cc1 523891337 UVHNPNAGMSYUSC-UHFFFAOYSA-N 376.406 5.002 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3ccccc3cc2OC(F)F)n1 536417033 CCFBGMYAYSHPJB-OAHLLOKOSA-N 386.423 5.511 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543944107 GOWMKJPSLYHSFA-MSOLQXFVSA-N 394.478 5.218 30 20 GKED COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 544236245 FZTNSXSNKMEEKG-IERDGZPVSA-N 377.488 5.111 30 20 GKED Cc1ccccc1C(NCc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1C 544844778 CBVGYWGYHQOYKU-UHFFFAOYSA-N 394.478 5.104 30 20 GKED CC(C)CN(Cc1nnc(-c2cccc(C#N)c2)o1)[C@H](C)c1ccccc1Cl 560180048 XLRMWENPYJVELK-MRXNPFEDSA-N 394.906 5.481 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ncc(-c2ccccc2)o1 560949886 RTHYJJMCDSGGRN-GOSISDBHSA-N 379.463 5.731 30 20 GKED Cc1ccccc1-n1nc(C)c2cc(C(=O)Nc3ccccc3CC#N)sc21 571002729 PPINOEGTCUUBSU-UHFFFAOYSA-N 386.480 5.022 30 20 GKED CCSc1cccc(Br)c1NC(=O)N1CCC(CCC#N)CC1 576702320 UMKAPDAXXVGQPP-UHFFFAOYSA-N 396.354 5.109 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C(F)F)cc1 588025569 IZBGWETWRYNMDJ-GDNZZTSVSA-N 389.286 5.264 30 20 GKED N#CCCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 593943075 JWMWUPXDOGPFHB-UHFFFAOYSA-N 378.501 5.193 30 20 GKED C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)[C@H](C)CC#N 596714635 ROGNTXKMVWHUTF-RVKKMQEKSA-N 391.902 5.406 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3sc(C)c(C)c3C#N)c2C(C)C)cc1 603564431 JDUJXWYXOGJNQP-UHFFFAOYSA-N 378.501 5.106 30 20 GKED N#Cc1ccc(NCC(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 604006029 RVFRYTYJZYPAPC-UHFFFAOYSA-N 377.831 5.055 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)NCc3cccc(C#N)c3)cc2)c1 609042878 DNFAQOIJZHTYKQ-LJQANCHMSA-N 399.494 5.006 30 20 GKED CCCN(CC#N)C(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 609071529 CZGCLEMLWDXNOS-UHFFFAOYSA-N 393.918 5.038 30 20 GKED CCOc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 609297477 KVQBCBBXBLMAAX-UHFFFAOYSA-N 376.387 5.141 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CCc2ccc(F)cc21 609303768 FTRRZMFQLLUDJJ-HXUWFJFHSA-N 388.467 5.266 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 609546882 UTXSRPDRHZJFSJ-PKTZIBPZSA-N 375.516 5.062 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2cccc(F)c2)CC1 609643086 MAWHSZYQZLCKIM-UHFFFAOYSA-N 386.426 5.468 30 20 GKED CC[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 610141256 NTXOGOVKDQKIAF-NQIIRXRSSA-N 391.515 5.422 30 20 GKED Cc1c[nH]cc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 613344719 NTDCPZGVWRZOOV-LBPRGKRZSA-N 376.268 5.244 30 20 GKED O=C(Cc1c(F)cccc1Cl)NC(CCC(F)(F)F)CCC(F)(F)F 619124683 UPEVINQGKYGFSQ-UHFFFAOYSA-N 393.730 5.191 30 20 GKED N#Cc1ccc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c([N+](=O)[O-])c1 619516440 GEEGOMMGMZVOKW-UHFFFAOYSA-N 398.875 5.114 30 20 GKED C=CCN(CC=C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 641889746 WRQCMOXDYPBNKF-MSUUIHNZSA-N 386.520 5.597 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccccc2F)n1 661118063 VWSASERAVZROEN-VQIMIIECSA-N 387.524 5.191 30 20 GKED C=CCn1c(SCc2csc(-c3cccs3)n2)nnc1-c1ccco1 670477260 CGOYMXQQUXRNBQ-UHFFFAOYSA-N 386.527 5.201 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416129 AUBXNARPJRFMFI-AWEZNQCLSA-N 395.484 5.395 30 20 GKED N#C[C@@H](C(=O)Cc1coc2cc3c(cc12)CCC3)c1nc2cc(F)ccc2s1 730421509 LKSPCBMGMYPOHH-KRWDZBQOSA-N 390.439 5.089 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccccc2O)C2CCCCC2)cc1Cl 731899838 WRABGKOODYNSJF-UHFFFAOYSA-N 383.879 5.284 30 20 GKED CC1(c2ccccc2)CC(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1 733080283 ISBJQVRROLWAEY-UHFFFAOYSA-N 397.404 5.077 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(C)cc1 739154900 FXYPKIZHSYWITQ-RDJZCZTQSA-N 381.426 5.500 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 743093522 VOXNSRLWUIWJFR-VWNXMTODSA-N 375.516 5.776 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)s1 744016726 SLJSXRJKNCHNST-AAEUAGOBSA-N 385.286 5.039 30 20 GKED COc1cc(C(=O)/C=C\c2cccc3c2OCCCO3)ccc1SC(F)F 746345328 DPRGAXKLTOCARY-VURMDHGXSA-N 392.423 5.067 30 20 GKED N#Cc1cccc(C2(NC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)c1 748536308 ZMZLFFJDOIPILB-QHCPKHFHSA-N 392.462 5.025 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2Cl)o1)c1ccc(N2CCOC2=O)cc1 748584630 SXLXHFBIBNLITE-PKNBQFBNSA-N 393.826 5.453 30 20 GKED C=CCC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 749841222 VGCMXBZYQSAJMC-HRAATJIYSA-N 388.433 5.793 30 20 GKED COc1ccc(C(F)(F)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 755511926 ZCSCVPOZTZHWOL-NRFANRHFSA-N 392.405 5.081 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 759218005 OZUJLYQTOZBBFR-BLSFAOBESA-N 378.884 5.743 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c(C)c1 766350683 OKHIPPSONDSALL-INIZCTEOSA-N 382.460 5.088 30 20 GKED Cc1nc(CSc2ccccc2C(=O)OCCCCC(C)(C)C#N)cs1 768457337 VFMCLKPNAULHAJ-UHFFFAOYSA-N 388.558 5.621 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cc(Br)ccc2F)cc1 779017180 HEXUXHMPNAEPES-NRFANRHFSA-N 395.275 5.339 30 20 GKED C#CCCCCCC(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 779923454 QSWLUMKWVWMXTM-UHFFFAOYSA-N 390.405 5.093 30 20 GKED CC(C)(C#N)CCCOC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 782201601 QBUDFCCKGNPEEY-UHFFFAOYSA-N 392.377 5.379 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccc(C)c(-c2ncco2)c1 782788650 FXUYPPWTDIWYQK-UHFFFAOYSA-N 377.444 5.192 30 20 GKED COc1ccc2[nH]c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2c1 786767849 ZWMBUFVZMSXLDV-OAQYLSRUSA-N 381.435 5.084 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2cc(Cl)cc(Cl)c2)c(-c2ccncc2)n1 788354010 DVVUADJTFMLFFI-IHWYPQMZSA-N 397.265 5.062 30 20 GKED C=CCn1c(=S)sc2c(=O)n(Cc3c(C)cc(C(C)(C)C)cc3C)cnc21 791563917 UHNVTJWCHAAUPK-UHFFFAOYSA-N 399.585 5.138 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ncsc2C(F)(F)F)cc1 792058360 UVOAKBQOSPBBSW-HNNXBMFYSA-N 387.386 5.070 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2ccc(-c3ccccc3F)s2)cc1 792925547 LCMJKZOQVQKZBD-QBFSEMIESA-N 379.456 5.152 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)C1 813217329 KNPHBYFZITYEAT-BPQIPLTHSA-N 396.453 5.432 30 20 GKED CC(C)c1cnc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 843301739 YQCUFBPNMPAFFF-UHFFFAOYSA-N 384.295 5.700 30 20 GKED Fc1cc(NCc2ccccc2CC(F)(F)F)ccc1OCC(F)(F)F 864036719 YNAKPWZWLGHZGD-UHFFFAOYSA-N 381.291 5.484 30 20 GKED C=CCOc1cccc(CNc2ccc([C@@H]3C[C@H]3NC(=O)OC(C)(C)C)cc2)c1 864042221 AKHCXLNLBQDOOV-FCHUYYIVSA-N 394.515 5.244 30 20 GKED N#Cc1ccc(CSCc2nc(-c3ccc(C(F)(F)F)s3)no2)cc1 904974135 CNGQOQCLISCOLG-UHFFFAOYSA-N 381.404 5.122 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc(Cl)ccc3o2)cc1 915087926 YHVUDQKJWUMARM-HXUWFJFHSA-N 386.838 5.994 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=Cc1cccs1 916273349 YQOSUMOLWHIJPA-UHFFFAOYSA-N 385.901 5.031 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 916847430 IAQOVBOANGIZLR-SFHVURJKSA-N 390.508 5.334 30 20 GKED N#C[C@@H](C(=O)CCn1ccc2ccccc21)c1nc2cc(Cl)ccc2s1 917044531 TWZFOEZLEOWQOK-HNNXBMFYSA-N 379.872 5.171 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1ccc(OCC(F)(F)F)cc1 920482551 MNNAFVOHMCLHSY-UHFFFAOYSA-N 394.422 5.085 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 921006072 PGPFOUBSZAIVOL-WXHSDQCUSA-N 399.350 5.030 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 1776050329 GYFZFOGASKOWPE-CYBMUJFWSA-N 392.377 5.148 30 20 GKED O=C(/C=C/c1c(F)ccc2sc(C(=O)O)cc12)c1ccc2ccccc2c1 1776131401 PZNXYGMCWBKJOA-VQHVLOKHSA-N 376.408 5.788 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C2\CCc3occ(C(=O)O)c3C2=O)cc1Cl 1776353563 BYLVWTUITCHZOE-BJMVGYQFSA-N 395.238 5.284 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cccc(Oc3ccccc3)c2)c1)C(=O)O 1776471057 FBRLQFKDAQNMMW-TUQDCPSNSA-N 388.419 5.227 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cnc(-c3ccsc3)s1)C2=O 1777683020 LAXQSTKFBLEJSM-UKTHLTGXSA-N 381.478 5.172 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)/C=C\C=C\C)cc2)CCC1 1791241239 QQCJIWHRRJXIPJ-XCCCRBDCSA-N 378.516 5.021 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(OCC#N)c(OC)c2)oc2ccc(C)cc12 16394322 ANVBQFJZFLBKDG-SOFGYWHQSA-N 375.424 5.111 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cccc(Cl)c3Cl)c2)c1 31777128 WOKOXBBYUVDRBD-UHFFFAOYSA-N 397.261 5.696 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccc(C)cc2)cs1 54894958 ZTYVEDMKVQCGKE-XFXZXTDPSA-N 396.899 5.686 30 20 GKED Cc1ccc(NC(=O)[C@H](Nc2cccc(OCCCC#N)c2)c2ccccc2)cc1 56199918 OPRHWMXMIRQTEJ-XMMPIXPASA-N 399.494 5.470 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2csc(C)n2)cc1 62379814 QVLWTMOLXXGZOJ-UHFFFAOYSA-N 377.513 5.381 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccncc1 108532106 VAVMKKRMIUMULN-XLIONFOSSA-N 394.544 5.483 30 20 GKED CN(Cc1nc(-c2cn(CCC#N)c3ccccc23)cs1)C(=O)OC(C)(C)C 122555540 SHKCYJKQKQIRFP-UHFFFAOYSA-N 396.516 5.045 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2c[nH]c3cccc(F)c23)cc1 124185682 FIHMCMDOUJASFL-UHFFFAOYSA-N 399.425 5.204 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(-c3ccccc3)o2)ccc1OC 180809985 KCCIOAGQJXUAOJ-PXNSSMCTSA-N 390.483 5.487 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCSc4ccccc43)c2)c1 237855703 JJHBOTYNFRHGQM-QHCPKHFHSA-N 386.520 5.464 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 255211380 VPSNIVBVFPKJCH-UHFFFAOYSA-N 387.464 5.196 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1OC 264991040 KHRSKHOISCEJEW-AWEZNQCLSA-N 385.489 5.051 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c1 303475825 NVECDUKFMJIDLT-RTBURBONSA-N 388.389 5.130 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)c1cccc(COc2cccc(C#N)c2)c1 303609353 LFGTZWISROAVHX-UHFFFAOYSA-N 390.870 5.063 30 20 GKED O/C(=N/[C@@H]1COc2ccc(Cl)cc21)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329476461 PKISVXCWNCELNI-DNVCBOLYSA-N 399.922 5.237 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCC[C@@H]1c1ccsc1 329813199 NHLZQAVQAUDREC-HXUWFJFHSA-N 392.528 5.331 30 20 GKED OC(=Nc1cc(N=C(O)[C@@H]2CC23CCCC3)c(F)cc1F)[C@@H]1CC12CCCC2 329960462 RDNJXFVZKPIZNR-KBPBESRZSA-N 388.458 6.301 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@H]1CCC[C@@H](C(F)(F)F)C1 410399332 DKGPMJPVABXMOO-VHSXEESVSA-N 387.295 5.074 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cn(Cc2ccccc2)nc1-c1cccs1 432838892 HRAZMIIFXVLZBB-UHFFFAOYSA-N 398.491 5.092 30 20 GKED N#CCCC[C@@H](NCc1nc(-c2ccccc2Cl)cs1)c1ccccc1 433030389 VUPJADQMJNOSIU-LJQANCHMSA-N 381.932 5.988 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)c2ccccc2n1 436867732 FFVRWJWXXAPVEK-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)C[C@H]1c1cccc(F)c1 437839205 HVBTUMNHDBDBHG-YWZLYKJASA-N 381.451 5.100 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2ccccc2)c2cccc(F)c2)cc1 446954528 PMHQYNUABYITTK-JOCHJYFZSA-N 387.458 5.538 30 20 GKED CCSc1cc(Cl)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 461014227 JGTGFJIDFDCZTE-ZDUSSCGKSA-N 390.961 5.956 30 20 GKED C[C@H](C(=O)Nc1cccc(COCCc2ccccc2)c1)c1cccc(C#N)c1 461922741 NZUYOFVMAKQITP-IBGZPJMESA-N 384.479 5.060 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)s1 463454942 KUFPIHHDVZFQQY-UHFFFAOYSA-N 391.374 5.108 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3ccccc3SC[C@H](C)C#N)o2)cc1 463743384 CNUKMFVZLXSROH-MRXNPFEDSA-N 390.508 6.013 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(F)c(Br)cc2Cl)c1 466446368 PHYZLWDVEMBEJN-UHFFFAOYSA-N 399.672 5.110 30 20 GKED Cc1ccc(C(=O)CCCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 467516636 NLEYRONBXOYFQH-KRWDZBQOSA-N 389.282 5.036 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@]1(C)C[C@H](NC(=O)[C@H](C)CC(=C)C)CC(C)(C)C1 467950431 VBMDXLMIXPOVDY-UECWXEIQSA-N 390.612 5.008 30 20 GKED C[C@@H](CCNC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 470494912 ADFVAJXUMWWERL-AWEZNQCLSA-N 375.394 5.087 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccccc1 474410771 IKTOWIQMLHFMGD-SFHVURJKSA-N 376.456 5.144 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 474415747 PTQAUZBWMGQBIB-MRXNPFEDSA-N 390.405 5.520 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)cc1 474740445 NKRNRVIGWDNWKS-UHFFFAOYSA-N 398.409 5.373 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(F)c(Br)cc1Cl)c1ccccc1 476406594 DMWISCZETLITBQ-MRXNPFEDSA-N 395.659 5.016 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 477150639 MJTJPAGJLVMKLW-UHFFFAOYSA-N 383.495 5.376 30 20 GKED COc1ccc([C@@H](NCc2ccc(Cl)cc2C#N)c2ccc(F)cc2)cc1 478338615 NPADOUGTWZZWSZ-QFIPXVFZSA-N 380.850 5.239 30 20 GKED C=CCn1c(S[C@H](C)c2cc([N+](=O)[O-])ccc2C)nnc1-c1ccoc1C 484588066 FOUGZRWWQZWEBW-CQSZACIVSA-N 384.461 5.102 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(-c2nc(CC)no2)ccc1C)c1ccccc1 489690199 KYOAJQCOFVFMIF-LJQANCHMSA-N 375.472 5.296 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@H]2c2ccccc2)c1 497437881 AFKRUKXWQPPIJU-DEOSSOPVSA-N 382.463 5.115 30 20 GKED N#CC1CCC(CNC(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)CC1 508348729 TXACHYPFKBWKFL-UHFFFAOYSA-N 390.455 5.076 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccc(-c3cnco3)cc2)c1 513468599 IKFFKXKCMORVJR-UHFFFAOYSA-N 395.418 5.045 30 20 GKED COC(=O)c1sc2ccccc2c1CNc1ccccc1SC[C@H](C)C#N 518661887 LDAOOTDCKIAWJD-CQSZACIVSA-N 396.537 5.552 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)Cc1ccc(-c2nc3ccccc3s2)o1 519673920 UOVZFAJDYBIMMM-UHFFFAOYSA-N 394.496 5.220 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3nc(-c4ccccc4)cs3)cc2)nc1 520326000 GWPBGAATRXQHPO-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C=CCOc1ccc(CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)cc1Cl 522062039 DQSHQPADHDAUKJ-FRIKZZABSA-N 396.962 5.190 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H](C)CC2)cc1 522952039 FHIILHSOTYWZOH-MRXNPFEDSA-N 379.460 5.013 30 20 GKED CC(C)CN(C(=O)c1csc(-c2c(F)cccc2F)n1)c1ccc(C#N)cc1 523852383 LRZYFUSMWNYTBK-UHFFFAOYSA-N 397.450 5.263 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 525657883 FZTAUHSAOCDJAZ-UHFFFAOYSA-N 378.815 5.265 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)c2ccc(C#N)c(F)c2)cc1 537406261 FATSDOCNEWLOBJ-UPCLLVRISA-N 392.449 5.480 30 20 GKED Cc1ccc(-c2nnc(CN[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)o2)cc1 542018500 YPKUKDNCDUROTK-GOSISDBHSA-N 394.478 5.435 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(CC#N)cc3)s2)cc1 543502983 DCUVYSFUQDUAFD-HNNXBMFYSA-N 377.513 5.044 30 20 GKED CCCc1nc(C)c(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)o1 559713399 SBTBLMSSRUXDFN-UHFFFAOYSA-N 391.446 5.102 30 20 GKED C=CCN(CCC(=O)N[C@@H](c1ccccc1)c1cccs1)Cc1cccs1 561198922 AUSUCQFPOFBKKY-QFIPXVFZSA-N 396.581 5.094 30 20 GKED N#Cc1ccccc1C(=O)/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1 588618089 FEOSTUSDQKVQFD-SEYXRHQNSA-N 386.838 5.360 30 20 GKED N#C[C@@]1(C(=O)Nc2ccc(O)c(-c3nc4ccccc4s3)c2)CC12CCCC2 590687832 GWFDHURIBVICIC-JOCHJYFZSA-N 389.480 5.081 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OCc2ccncc2)cc1 591515300 SXSUHSONTIXHCR-UHFFFAOYSA-N 391.446 5.020 30 20 GKED N#CCC1CN(C(=O)c2cccc(CSc3c(Cl)cccc3Cl)c2)C1 598034516 ZHLBHQKMWHCZTC-UHFFFAOYSA-N 391.323 5.271 30 20 GKED Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)Nc2ccccc2C#N)c1 598544332 TWPUQRMUJRDTCG-UHFFFAOYSA-N 396.425 5.111 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3c(F)ccc4ccncc34)c2C#N)[C@H](C)C1 598840737 ZDGICWBINPEJOZ-NWDGAFQWSA-N 379.460 5.245 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)cc2c1 609061022 PZFGBQQRISHKTA-UHFFFAOYSA-N 396.446 5.753 30 20 GKED C[C@H](CSc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609504085 NVYQHABXQSCUOU-MRXNPFEDSA-N 389.480 5.112 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c(F)c1 610219055 QCHAKXFHWXZEGY-UHFFFAOYSA-N 388.773 5.100 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(F)c1 610224537 WZXKUVFHLABSAE-VFNWGFHPSA-N 392.861 5.877 30 20 GKED C[C@@H](NC(=O)N1CCc2cc(-c3cccc(F)c3)ccc21)c1cccc(C#N)c1 610408294 RRVBITMWTMGLBC-MRXNPFEDSA-N 385.442 5.198 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618841882 COYKMIBIIJRIRY-LJQANCHMSA-N 388.298 5.084 30 20 GKED COc1ccc([C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 619425490 SFBCYOQGEOHUDE-HSZRJFAPSA-N 384.479 5.016 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)c(C)n1CC(F)(F)F 620734475 QEDMURSNDUTJCE-UHFFFAOYSA-N 382.279 5.077 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2nnc(C3CC3)s2)cc1)C(F)(F)F 647634308 UPFABKYMLSDZTG-UHFFFAOYSA-N 399.335 5.317 30 20 GKED O=C(NC[C@H]1CCC[C@H](C(F)(F)F)C1)c1c(F)cc(C(F)(F)F)cc1F 685778742 TZJCGHPBPFFFHC-IUCAKERBSA-N 389.286 5.082 30 20 GKED C[C@H](NC(=S)N[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 726481077 WOZMEDUVXCBIJJ-NEPJUHHUSA-N 378.328 5.151 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)ccc1F 728392000 DOWCIBHOUVZDSK-QGZVFWFLSA-N 377.341 5.085 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 729553425 POXKZKMNXHOGJY-GOSISDBHSA-N 375.394 5.148 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)c(C)c1 730951257 MGRIORDFBGEOKC-UXBLZVDNSA-N 376.408 5.070 30 20 GKED CCCCc1ccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)cc1 731322329 XEERRPANDWNWLS-MRXNPFEDSA-N 383.586 6.232 30 20 GKED CC(=NNc1ccc(Br)cc1C(F)(F)F)c1scnc1C 731487423 ULBFXXOFRQTBFB-UHFFFAOYSA-N 378.217 5.069 30 20 GKED N#CCn1c(C(=O)O[C@@H](c2cncc(F)c2)C2CCCCC2)cc2ccccc21 731776436 ZXDGCWCBLFIHAW-JOCHJYFZSA-N 391.446 5.177 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 734706307 CHKHCTMOBHZQCO-APWZRJJASA-N 392.911 5.760 30 20 GKED Cc1csc(C(C)(C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 734930642 WLQKPKRIKBASCL-IBGZPJMESA-N 390.512 5.164 30 20 GKED CCN(Cc1cccs1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740058766 BMBTXCVBVOOTBL-UHFFFAOYSA-N 381.526 5.080 30 20 GKED C=C(C)COc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)ccc1OC 741473179 NSGJPFQTLSMNTL-VQHVLOKHSA-N 385.463 5.608 30 20 GKED N#Cc1cccc(COc2cccc(/C=C3\CCc4cc(C#N)ccc4C3=O)c2)c1 742438345 WIJXOJVUHNBQBF-FSJBWODESA-N 390.442 5.221 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cnc3ccccc3c2C)cc1 749025430 FCXYSWYRZQCTBO-FOIQADDNSA-N 385.467 5.018 30 20 GKED C[C@@H]1CCC[C@@H](CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 750668186 PAQPEZMXKVHYFX-BZPMIXESSA-N 380.435 5.708 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Nc2ccc(COC(C)(C)C)cc2)cc1 752247205 IVVOOVYPUWAJFI-LJQANCHMSA-N 393.531 5.057 30 20 GKED C#CC[C@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 757880829 ONAIECOBVRLYRW-DEOSSOPVSA-N 384.479 5.290 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)OC3CCCCCC3)n2)cc1 761048961 OMLAIUSZRDLPPV-QFBILLFUSA-N 382.529 5.423 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(Br)ncc2F)c2ccccc12 762426465 PNRYBKZJLHMZOR-SOFGYWHQSA-N 386.220 5.041 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](c1ccc(Cl)cc1)C1CCC1 775380618 ZCOUSFRXJQZORJ-HXUWFJFHSA-N 375.299 5.527 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cc(Br)cc2ccccc12 780154742 ZVCRKUJABKINDB-CYBMUJFWSA-N 395.256 5.145 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(CN[C@@H](C)c2ccc(C#N)cc2F)cc1 781421174 FNQDMFJTLDUNNE-HOTGVXAUSA-N 397.494 5.134 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782383198 MBZXXJNVRUIOSZ-RTBURBONSA-N 381.479 5.367 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1Cl 789156773 DJPPHMDYHRSPNS-PLNGDYQASA-N 384.888 5.542 30 20 GKED N#Cc1ccc([C@H](O)C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)cc1 790089601 IMTKOZGKVAHJDE-FQEVSTJZSA-N 397.261 5.204 30 20 GKED O=C(C#Cc1ccc(C(F)(F)F)cc1)Nc1ccccc1CCC(F)(F)F 790762859 AMEXVUPBVHUROK-UHFFFAOYSA-N 385.307 5.191 30 20 GKED N#C[C@@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1nccc2ccccc12 792103785 SZNCYCQTALCSMZ-KRWDZBQOSA-N 386.398 5.222 30 20 GKED N#CC[C@@H](CC(=O)OCc1nc(-c2ccccc2Cl)cs1)c1ccccc1 795991718 OTUBDBAOZCBQTK-INIZCTEOSA-N 396.899 5.594 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(F)cc2OCCC(F)(F)F)cc1 800311265 FPWXIZQIJKOQIE-ZDUSSCGKSA-N 382.357 5.060 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cccc2cccc(Br)c12 803083945 NDYOAFCJDUVQMT-CYBMUJFWSA-N 395.256 5.145 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2csc(-c3ccccc3F)n2)c1 812724886 OVEGAOLKTZGCKI-WBVHZDCISA-N 395.503 5.481 30 20 GKED N#C[C@@H](C(=O)CCSc1ccc(Cl)cc1)c1cc(C(F)(F)F)ccn1 813218806 ZPIVNJGTDLGPIO-CQSZACIVSA-N 384.810 5.112 30 20 GKED C=C(C)COc1cc(CNc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)ccc1OC 815166140 ZHSOLEUCHQQCFZ-VGSWGCGISA-N 394.515 5.024 30 20 GKED C#CC[C@H]1CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 862565520 SZJRMVLAJYZJBH-HNNXBMFYSA-N 381.522 5.272 30 20 GKED C=CC[C@@H](c1ccccc1)c1nc(-c2cccc(OCc3cccnc3)c2)no1 904502750 MAQGIRBMIMCAHQ-QFIPXVFZSA-N 383.451 5.419 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cc(OC)c1O 914773687 QWWDQERITMUEQQ-FPLPWBNLSA-N 384.428 5.173 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c(F)cccc2Cl)cc1 915085305 AAZCWUIFOYKTBC-LJQANCHMSA-N 378.834 5.316 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(Cc2cccs2)C2CC2)cc1 915351611 AFBBSXTVNPHARW-QFIPXVFZSA-N 387.508 5.600 30 20 GKED N#C[C@@H](C(=O)CSc1cccc2cccc(Cl)c12)c1nc2ccccc2[nH]1 916626943 HOUGDVJQKHBGFZ-AWEZNQCLSA-N 391.883 5.338 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)Nc1ccc(CCC#N)cc1 928402589 WWLAUSXCHRDHDF-UHFFFAOYSA-N 393.487 5.061 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)c2cc(C(=O)O)oc12 1776131545 UNVQSSGJBGMJBR-QBFSEMIESA-N 398.414 5.703 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(Br)c1Cl 1776784767 SWEOULGYKIJWPB-CQSZACIVSA-N 390.749 5.396 30 20 GKED O=C(/C=C\c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 1777570126 WDJRRUAPDQMWHZ-VURMDHGXSA-N 397.383 5.057 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)C3(F)CCC3)cc2)CCC1 1792055573 HCPGIACUACEDDS-UHFFFAOYSA-N 386.511 5.005 30 20 GKED Cc1cc(S[C@H](C)C(=O)N(CCC#N)c2ccc(F)cc2)nc2ccccc12 23410265 GUHRYVLRXKSRJR-MRXNPFEDSA-N 393.487 5.110 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(OC(F)F)c1 57543542 CBEOLIDBGVDTAN-UHFFFAOYSA-N 396.418 5.563 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(Cc2ccccc2)CC1 66955794 HLQDCTLPEUKVOC-GOSISDBHSA-N 393.556 5.567 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 105402611 PERDJXBKHKAYOX-SFHVURJKSA-N 385.467 5.407 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 108407678 VVXQCZLZXCYCAY-HIFRSBDPSA-N 387.936 5.339 30 20 GKED C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)c1ccc(C#N)cc1 118172125 QNADGTYEDGUVBM-INIZCTEOSA-N 383.480 5.054 30 20 GKED C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)c1ccc(C#N)cc1 118172573 GGIUQCRFKQNQFP-INIZCTEOSA-N 386.480 5.311 30 20 GKED N#C[C@@H](C(=O)CSc1ccc(F)c(F)c1)c1nc2cc(Cl)ccc2s1 120021172 KCFVMBZDIUVLBC-NSHDSACASA-N 394.855 5.196 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(SCc2ccccc2)cc1 120765838 NJVPWUFLINTXHG-UHFFFAOYSA-N 392.455 5.273 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)Cc1cccc(OCC#N)c1 126611538 BVLVROCUWSMPFQ-IBGZPJMESA-N 384.479 5.018 30 20 GKED C#CCCOc1ccc(CNc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1 157181356 CKXBLOHXDSZNPW-UHFFFAOYSA-N 394.858 5.200 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(N2CCCC2)c1 158602106 NRJMMFZNGVFMFJ-UHFFFAOYSA-N 375.925 5.222 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2)cs1 159997839 HPEGWAVLCVPUPK-LJQANCHMSA-N 376.485 5.285 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Oc2cccc(Cl)c2Cl)n1 177773116 MWCNMRAKSZVNTK-MNOVXSKESA-N 383.300 5.217 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 179634620 BROSCYGIGQPPOF-CLYVBNDRSA-N 384.545 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc2cccc(F)c2c1COC 189875114 CWFJKWFJIWNIRM-UHFFFAOYSA-N 397.515 6.291 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cc(Cl)ccc2C1 192217360 IDUKOHDTHPXYCG-AWEZNQCLSA-N 385.920 5.324 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2cc(F)ccc2s1 193453120 IQXDGDAIYFZWEA-QGZVFWFLSA-N 388.423 5.155 30 20 GKED O=C(Nc1ccc2oc(C(F)(F)F)nc2c1)c1ccc(F)c(C(F)(F)F)c1 195748567 AGSNIMVLRLOHCJ-UHFFFAOYSA-N 392.230 5.257 30 20 GKED CC(C)c1ccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2cccs2)cc1 236843795 SKNSPSYJZKPUCU-UUOWRZLLSA-N 390.552 6.042 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(N(C)CCC#N)cc1 237502499 OBVQVJBYBVLZDJ-QGZVFWFLSA-N 390.556 5.319 30 20 GKED C[C@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1ccc(C#N)cc1 303670141 GDMHKQNXDGSROM-VIFPVBQESA-N 382.798 5.126 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1c(Cl)nc2sccn12 303888037 JWIRMVXXHYSZPW-FNORWQNLSA-N 399.815 5.114 30 20 GKED O/C(=N/[C@@H]1CCOc2ccc(F)cc21)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329219306 AUVXAGTVDUTAPV-OXQOHEQNSA-N 397.494 5.113 30 20 GKED C[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)[C@@H]1COc2ccccc21 329482653 RPDLXPOWOSRQFA-CDXJDZJCSA-N 393.531 5.014 30 20 GKED O/C(CC1CCOCC1)=N/[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21 329671343 UCFHOIPKDUHLKQ-QGZVFWFLSA-N 391.309 5.081 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nn(Cc2ccc(Cl)cc2)c1C 410343218 DVXRPLJLZVFCJE-UHFFFAOYSA-N 393.918 5.573 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3cscc3C#N)s2)cc1 410512056 UKBQVZFAAMGSPO-AWEZNQCLSA-N 381.526 5.193 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F 410973701 WPVNJZXEWVDDRP-CABCVRRESA-N 394.780 5.047 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3cccc(SCC#N)c3)c2)C1 429854509 PVVFCHVROPBQFZ-UWJYYQICSA-N 394.540 5.650 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1sc2c(c1C#N)CCCCC2 429931944 XCGVTYDATQWVIZ-UHFFFAOYSA-N 377.469 5.104 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1csc(-c2ccccc2)n1)c1ccccc1 431283819 ROROLIHFMGBCOB-HXUWFJFHSA-N 390.512 5.044 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)Cc2ccccc2O1 432754180 JGQKICDLSJERRZ-QGZVFWFLSA-N 399.450 5.166 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccccc1OC(F)F 435358672 OTGOWRIOTPTBBD-HNNXBMFYSA-N 397.425 5.037 30 20 GKED N#CCCC[C@H](NC(=O)N1CCn2cccc2[C@H]1c1ccccc1)c1ccccc1 458806337 VZKVNIBVMMHNNR-LADGPHEKSA-N 398.510 5.038 30 20 GKED C=C(C)Cn1c(Cc2ccccc2Cl)nnc1N1CCC[C@@H]1c1ccco1 460959447 PALDYYMLHPTOIN-GOSISDBHSA-N 382.895 5.033 30 20 GKED C[C@H](C(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462200218 FSRISFBXAVDKAY-MGPUTAFESA-N 386.417 5.434 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(N2CCC[C@H](C)C2)c1 464480244 JECKAVBDTXDZAM-SFHVURJKSA-N 377.532 5.422 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccc2cccnc12 466434770 MVADSCAWCSQUFX-UHFFFAOYSA-N 393.446 5.370 30 20 GKED CC(C)CCOc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 467394616 DZNWICBQWYMFBL-UHFFFAOYSA-N 381.476 5.438 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 467950094 UQRUDWLJCVBAFW-UHFFFAOYSA-N 388.471 5.224 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)c1cc(-c2cccc(C#N)c2)no1 469070471 PEVFMWOMLDTESW-UHFFFAOYSA-N 389.455 5.089 30 20 GKED C[C@@]1(c2ccccc2)CC[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C1 469267503 QTGHLLFQFMIMFX-RCZVLFRGSA-N 387.527 5.192 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(N2CCCCC2)c2ncccc12)c1ccccc1 477137323 MXTKZVCLKDBTNO-HXUWFJFHSA-N 398.510 5.251 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N(C)c3cc(Cl)ccc3C#N)o2)c(C)c1 479572910 FSRZVTYOWOHEMI-UHFFFAOYSA-N 394.858 5.277 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1ccccc1C(F)(F)F 481283668 JWBMVGUDFNOFEI-NSHDSACASA-N 383.211 5.190 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@H](C)[C@@H]1C 482925975 YCLXFMSQUAYVKR-JKSUJKDBSA-N 381.501 5.017 30 20 GKED C=C(C)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(F)c(F)c1 483296411 NHKFJFUHQRFBMH-OAQYLSRUSA-N 383.442 5.074 30 20 GKED C=CCN(CC1CCCCC1)C(=O)NCc1ccc(Oc2ccccc2)nc1 483694528 FHQROZKYXJFYQM-UHFFFAOYSA-N 379.504 5.152 30 20 GKED Cc1c([C@@H](NC(=O)N(C)Cc2cccc(C#N)c2)C(C)C)oc2ccccc12 483744653 JCTMUMUWBDMAMB-NRFANRHFSA-N 375.472 5.152 30 20 GKED COc1ccc([C@H](NCc2ccccc2C#N)c2ccc(C(F)(F)F)cc2)cc1 486027072 GSXSHEAPLMJWCL-JOCHJYFZSA-N 396.412 5.465 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Nc2nc(C)cs2)cc1 487322547 MPIVCLUXTDXBEN-UHFFFAOYSA-N 391.540 6.299 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 500098696 MYBOOKLPNQSAKM-KSFYIVLOSA-N 375.447 5.384 30 20 GKED CC(C)c1sc(NC(=O)c2c(F)cc(C#N)cc2F)nc1-c1ccccc1 504370538 MFTRTJMNKCFWLY-UHFFFAOYSA-N 383.423 5.336 30 20 GKED Cc1cccc([C@H](NC(=O)Nc2cccc(OCCCC#N)c2)C(F)(F)F)c1 512919079 WTLKWCKYWBQNLR-SFHVURJKSA-N 391.393 5.103 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)c1 512939230 BUWGBTHVSLPLQM-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N(C)Cc1ccc(C#N)cc1 515553230 YVHZTDDIGSWEEA-LBPRGKRZSA-N 379.312 5.004 30 20 GKED C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1ccc(C#N)cc1F 515659235 CIOOEYWERRZCJC-GASCZTMLSA-N 399.897 5.366 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3sccc3Br)c2)cc1 519122463 HPNORTAFZSZOCK-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1nc(NC(=O)CC2CCC(c3ccccc3)CC2)sc1SCC#N 519394829 VOLRCKIGVXHKDQ-UHFFFAOYSA-N 385.558 5.370 30 20 GKED N#CCC[C@@H](C#N)CNc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 520633784 LHWXPRUTVAVXHL-LBPRGKRZSA-N 378.234 5.780 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 522434560 KORBSLXFGJFKDD-WIYYLYMNSA-N 397.478 5.760 30 20 GKED CC(C)c1nc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cs1 523272787 FWLCPRYAERWFIU-UHFFFAOYSA-N 391.496 5.164 30 20 GKED CCOc1ccc(-c2nc(CN(CC)[C@@H](C)c3ccc(C#N)cc3)co2)cc1 532999834 LBWZHMBAOUUPBP-KRWDZBQOSA-N 375.472 5.195 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc(Oc3ccccc3C#N)cc1)CCO2 562155012 QKBHBGNOLLKWJD-UHFFFAOYSA-N 399.450 5.086 30 20 GKED CCCOc1ccccc1Oc1ncccc1CN[C@@H]1CCc2ccc(C#N)cc21 574946295 ALSNREJIWZQVEA-JOCHJYFZSA-N 399.494 5.311 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2)cc1 590880722 DGXQHEPUCNDSPS-QFIPXVFZSA-N 389.414 5.389 30 20 GKED C=CCOc1cccc(CNCc2nc(-c3ccc(Cl)cc3)c(C)s2)c1 591700034 DOJOOWAYRAZYFT-UHFFFAOYSA-N 384.932 5.627 30 20 GKED C[C@@H]1CCCC[C@H]1CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 604441506 HUOHUGPAAZSQRW-QUCCMNQESA-N 376.500 5.487 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C(C)(C)C)ccc1OC 604488428 SNNKDKIZLCIEHG-UHFFFAOYSA-N 397.475 5.121 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(C2CC2)[C@H](C)c2ccc(Cl)cc2)cc1 605412077 JQXQAVJFEVMQRG-OAHLLOKOSA-N 397.906 5.013 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCc1c(Cl)cccc1Cl 608918401 UIXFKQJKVFIVDG-UHFFFAOYSA-N 390.314 5.028 30 20 GKED C[C@H](NC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccc2ccccc12 609055120 ZOFYLXANWIRTSM-KRWDZBQOSA-N 396.446 5.374 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(F)cc3Cl)cc2)c1 609064394 SOWDTOLDDUNETR-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC1CCCCCC1 609078727 KRXWBNDXYVJVOT-UHFFFAOYSA-N 377.488 5.290 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(F)c(F)c1 609497414 SAEVDAJMEQTEOB-OAHLLOKOSA-N 392.405 5.314 30 20 GKED C[C@H](CN(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccccc1 609643729 GUAXRXMXUVVCJR-LJQANCHMSA-N 384.479 5.013 30 20 GKED CS[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 610047519 BUMSVLSKXPMPIS-QFIPXVFZSA-N 388.492 5.180 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Oc3ccncc3)cc2)cc1Cl 726487039 JCKYNOHAHBLOFE-UHFFFAOYSA-N 380.860 5.208 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccc(C)cc4)sc3C2=O)cc1O 727655308 VGDQDKSRAZJUSQ-WJDWOHSUSA-N 377.465 5.045 30 20 GKED COc1ccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(OC)c1 733621254 IFGOPCCKHFJGPZ-FQEVSTJZSA-N 387.439 5.003 30 20 GKED CCCOc1ccccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733622050 OWTTYJWOSANLSR-OAQYLSRUSA-N 385.467 5.775 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(OC3CCCC3)c2)c1 733842814 ABYZUSNHFGPBLG-IBGZPJMESA-N 393.487 5.011 30 20 GKED N#CCOc1ccc(Cl)cc1CSCCC(=O)Nc1ccc(Cl)cc1 735320182 MOKPGIIYTQYLTM-UHFFFAOYSA-N 395.311 5.158 30 20 GKED C=CCN(C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C)C(C)C 741402995 HUCWWXVWACVZTK-UHFFFAOYSA-N 380.467 5.116 30 20 GKED CC(=NNc1cnnc2ccccc12)c1ccc(SCC(F)(F)F)cc1 741763216 DDWRCKPYYBIVGH-UHFFFAOYSA-N 376.407 5.120 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)c1 746523552 RYLLMDIBDAADTC-CJNGLKHVSA-N 391.298 5.094 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)nc2ccc(C)cc12 747406100 SNOPFWUFZCNLQL-UHFFFAOYSA-N 393.446 5.343 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2ccc(SC)c(OC)c2)cc1OC 747614941 QBQUTYDANSOQRQ-VURMDHGXSA-N 392.904 5.374 30 20 GKED C=C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 759207474 BINUOBCVAFXUGJ-SCLBCKFNSA-N 387.266 5.001 30 20 GKED CC(=NNc1c(C)cc(C)cc1C)c1ccc(CNC(=O)OC(C)(C)C)nc1C 760249816 TVPHXHVWMYAIDC-UHFFFAOYSA-N 396.535 5.176 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccccc2O)C2CCCCC2)c(Cl)c1 768994573 FVXYBWMJSYCFKR-UHFFFAOYSA-N 383.879 5.284 30 20 GKED N#CCOc1cccc(NC(=O)NC2(c3c(Cl)cccc3Cl)CCC2)c1 772230100 KLIIUDQDVAQBHF-UHFFFAOYSA-N 390.270 5.097 30 20 GKED CC[C@H](NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 774234951 YQAJXKBWXAYOSY-JTSKRJEESA-N 393.531 5.385 30 20 GKED N#C[C@H]1CC[C@H](Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)C1 788097399 VPJYQHJYCHLKHF-CABZTGNLSA-N 384.502 5.381 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Cc3cccc(C(F)F)c3)c2)s1 790554755 KSVKPEDPDZVVAA-UHFFFAOYSA-N 382.435 5.083 30 20 GKED CC(C)n1nccc1/C=C/C(=O)c1ccc(Br)cc1C(F)(F)F 794943504 LOZYOWQKHRBLAA-GQCTYLIASA-N 387.199 5.141 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(c2ccc(N(C)C)cc2)CC1 800577160 IPIQLFJZCQBUCA-UHFFFAOYSA-N 377.532 5.283 30 20 GKED C#C[C@H](N[C@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccc(Cl)cc1 811516579 QCMAQASBAXXJMQ-DYVFJYSZSA-N 394.824 5.040 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 813057635 OBPJMNIVPCAKPU-GCJKJVERSA-N 378.859 5.168 30 20 GKED C#CCN(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)C1CCCCC1 822767727 PJJIYSBCTRZHJP-UHFFFAOYSA-N 386.380 5.018 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2Cl)CCC1)c1cc(C(F)(F)F)ccn1 845574824 OPGGRJWHJAEIEK-ZDUSSCGKSA-N 378.781 5.052 30 20 GKED Cc1ccc(OCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 915085664 ONWYAJQSFSLMEY-DEOSSOPVSA-N 384.479 5.367 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(-n3cccc3)cc2)cc1 915086320 SSWMGJALFJTWSA-RUZDIDTESA-N 391.474 5.314 30 20 GKED O=C(O)c1cc(NN=Cc2cc(Cl)cc(C(F)(F)F)c2)ccc1Cl 1776033615 ISTKRTYSCPBQDG-UHFFFAOYSA-N 377.149 5.156 30 20 GKED O=C(O)c1cccc(NN=Cc2ccccc2Oc2ccc(F)c(Cl)c2)c1 1776038162 VPXAUWMDJKXCAU-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CCCCCCCC/C=C\CCCCCCCC(=O)N1CCCC[C@H]1C(=O)O 1776785237 JARCNTJKQPPSSM-DYYZXQNHSA-N 393.612 6.490 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)C2CCCCC2)c1 1776787440 NCSOYXZATDLDCZ-JOCHJYFZSA-N 375.553 5.549 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776805923 CPSLMEXJSQGMAU-ZRDIBKRKSA-N 378.424 5.378 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)c1 1777033356 DCWUAHIDSSZSQM-QINSGFPZSA-N 385.463 5.010 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)o2)cc1 1777472300 LQTDAGUPRAOTLL-QUMQEAAQSA-N 388.419 5.161 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)c1ccccc1-c1ccccc1C#N 24861651 QYPXHPCXFXHBMB-UHFFFAOYSA-N 381.479 5.386 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 41557218 SEKKAXSFRKRQNM-GOEBONIOSA-N 397.425 5.200 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N(C)Cc2ccc(C#N)cc2)cc1 43900175 DEHFLJTUXHHXLT-UHFFFAOYSA-N 387.439 5.023 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCC(=O)c1cccs1 56469598 MZORPCHRPIINLW-UHFFFAOYSA-N 390.464 5.322 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)(F)F)cc3)n2)cc1 66545019 DUGRDYRJHFCXQM-INIZCTEOSA-N 397.381 5.191 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1ccc(F)cc1Cl 108408215 ITPWXRYKDFRGOP-QWHCGFSZSA-N 391.899 5.170 30 20 GKED COc1ccc(F)cc1[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 109028915 PSLQZYGDEYNVOE-ZIAGYGMSSA-N 387.480 5.111 30 20 GKED C[C@H](Cc1nc(-c2cn(CCC#N)c3ccccc23)cs1)n1cc(Cl)cn1 110567528 TUCHNEAXNBQJFC-CQSZACIVSA-N 395.919 5.332 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(F)c(Cl)c2)ccc1OC 113308847 OXEXBCNIUAMRGI-BBRMVZONSA-N 376.859 5.019 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2cc(F)ccc2o1 117605900 MHVSAYWYFLNCJU-UHFFFAOYSA-N 387.370 5.192 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(CCC(F)(F)F)c1)c1ccccc1 121305696 RQXBQEIGLYYNNE-GOSISDBHSA-N 375.394 5.348 30 20 GKED Cc1cc(CSc2ccccc2C(=O)Nc2ccc(Cl)c(C#N)c2)on1 122113922 RHUVXRCTVQWUGL-UHFFFAOYSA-N 383.860 5.053 30 20 GKED COc1ccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c(C(F)(F)F)c1 147822414 ZTCRHJOSUWZACH-UHFFFAOYSA-N 381.247 5.124 30 20 GKED COc1ccc(CNc2ccc3c(c2)OC2(CCCC2)O3)cc1OCCCC#N 178813423 SVTQUKUCATWFEQ-UHFFFAOYSA-N 394.471 5.031 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccc(N(C)CCC#N)cc1 237210050 JOKIPWXXTMAASB-HSZRJFAPSA-N 389.568 5.480 30 20 GKED CC(C)(C)c1csc(CNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)n1 303253618 NSDHAZLWRLZFTI-UHFFFAOYSA-N 391.496 5.035 30 20 GKED CC(C)CCN(CCC(C)C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 303381816 MSNQVCRHGDFBPX-SFHVURJKSA-N 375.582 5.864 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1 303933008 QCBDWKYNNFUFOT-GFCCVEGCSA-N 379.262 5.421 30 20 GKED Cc1csc(C2(/N=C(/O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)CCC2)n1 329408856 BCAGTYOFSVHLJS-QGZVFWFLSA-N 398.576 5.294 30 20 GKED OC(=Nc1cccc(COC2CCCCC2)c1)N1CC2(CCC2)[C@H]1[C@@H]1CCCO1 329720776 AOECQIDQRJYPSF-FCHUYYIVSA-N 398.547 5.115 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCCO2)N1CC2(CCC2)[C@@H]1c1ccccc1 330341295 ZBKSRKUIOKZGAP-FQEVSTJZSA-N 398.890 5.274 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)sc1SCC#N 409817903 IKHVVHGMXMTPMT-RYUDHWBXSA-N 398.340 5.116 30 20 GKED CC(C)C[C@H](C)N(C(=O)c1cccc(SCC#N)c1)c1ccc2[nH]ccc2c1 429796303 OIFOVXSQFQXVOW-KRWDZBQOSA-N 391.540 5.865 30 20 GKED N#CCCC[C@@H](NC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F)c1ccccc1 431379892 ZOOSFAQNJMMIBI-KZNAEPCWSA-N 381.442 5.089 30 20 GKED CC(C)c1ccc([C@H](NC(=O)c2ncc(C#N)cc2Cl)c2cccs2)cc1 431580025 UIVWCFOFKMBTOR-IBGZPJMESA-N 395.915 5.311 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCc2ccc(F)cc21 432081231 QZRXKVXMFKAQRT-RDTXWAMCSA-N 383.492 5.419 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)Nc2cccc(C(C)(F)F)c2)c1 435920250 HSVMBAJONINRBW-KRWDZBQOSA-N 385.458 5.162 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccc(O)cc3Cl)no2)c2ccccc21 436873065 OKTZLXQZBQMFMY-UHFFFAOYSA-N 378.819 5.021 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 455131463 BUPDHZHPYCPUBJ-NRFANRHFSA-N 393.531 5.948 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1CCc1ccccc1)c1ccccc1 458795669 CVABKUUDQAJXKQ-XZOQPEGZSA-N 375.516 5.228 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H](c2ccccc2)CC1)c1ccccc1 458799707 JUASYSJXEWQNGT-FYYLOGMGSA-N 375.516 5.401 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccc(F)cc1F)C1CC1)c1ccccc1 458805635 UYFADWIQMPUVCM-NRFANRHFSA-N 383.442 5.074 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)c1nc(C(F)(F)F)ccc1C#N 462913669 MMIDLQMDPIYDBG-UHFFFAOYSA-N 382.389 5.061 30 20 GKED N#Cc1c(NC(=O)c2nc3ccccc3cc2Cl)sc2c1CCCCC2 463069508 XLCPTKZLQGURFZ-UHFFFAOYSA-N 381.888 5.343 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc4ccsc34)n2)cc1 467837868 CMKYYQHNOWDTIM-QGZVFWFLSA-N 390.489 5.523 30 20 GKED C[C@H](NC(=O)Nc1cc(C#N)cn1C(C)(C)C)c1ccc(-c2cccnc2)cc1 475030694 SIUJGXPHBSZVJX-INIZCTEOSA-N 387.487 5.059 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3Cc4ccccc4C4(CC4)C3)c2)cc1 480559745 WVRCGQSAWUWMBR-UHFFFAOYSA-N 395.462 5.430 30 20 GKED N#Cc1cc(Cl)ccc1CN[C@H](c1ccccc1OC(F)F)C(F)(F)F 481026983 UFPDHKCTEVBWSH-OAHLLOKOSA-N 390.739 5.206 30 20 GKED C[C@H](Nc1ccc(NC(=O)C(C)(C)Oc2ccc(C#N)cc2)cc1)c1ccccc1 481290712 WLWLKRHUJBUGNH-SFHVURJKSA-N 399.494 5.527 30 20 GKED C=C(C)[C@@H](N[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)c(F)c1 481627014 MVOBXFVVLSIISZ-HRAATJIYSA-N 386.486 5.631 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nnc(-c3ccccc3)c3ccccc23)cc1 494138959 RDEXXBROLYDBEK-HXUWFJFHSA-N 381.504 5.832 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4c(c3)CCCC4=O)n2)cc1 496028033 KPBUYOSQVWJGRN-LJQANCHMSA-N 386.476 5.128 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)F)cc1 505834604 UQZCMJILGSCSKT-OTWHNJEPSA-N 398.453 5.070 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)c2cc(C#N)ccc2Cl)cc1 513466506 GUPPENBGWQSWSP-HNNXBMFYSA-N 390.870 5.378 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)cc1F 513712459 CSQDGMWTPUDOQP-JSGCOSHPSA-N 392.352 5.407 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)s2)o1 515076760 QPEYWGUFBOMBSS-SNVBAGLBSA-N 397.525 5.330 30 20 GKED C=CCn1c([C@@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@@H]1c1cccs1 516895967 VLEGMJZZDIVRHT-CRAIPNDOSA-N 398.507 5.146 30 20 GKED COc1cc(Cl)ccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 520077038 SYAVBXRZLNVOSB-LBPRGKRZSA-N 377.252 5.102 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)C(C)(C)c1ccccc1 520856631 LNRXVMHWQCOTIZ-IAGOWNOFSA-N 381.545 5.426 30 20 GKED C=CCN(C(=O)CCc1cccc(OC)c1F)c1nc(-c2ccccc2)cs1 521495932 JOOODNSGSXBLDB-UHFFFAOYSA-N 396.487 5.110 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522635584 PTNQLLRAOPUOBE-AWEZNQCLSA-N 396.899 5.899 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccs1 524492935 UHCRJPDYFDXLMV-SFHVURJKSA-N 394.927 5.973 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@@H]2Cc3c(Cl)cccc3[C@H]21)c1nc2cc(Cl)ccc2s1 528925219 QWKMBTGVFXRQDK-XHSVMWQWSA-N 399.302 5.365 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N[C@](C)(C#N)CC(C)C 536079579 FJRSGPOUWFRBES-VWLOTQADSA-N 385.511 5.197 30 20 GKED N#CC1(c2ccc(C(=O)N3Cc4ccccc4[C@H](c4ccccc4)C3)cc2)CC1 538586505 FLFYCRJHOSMGPE-DEOSSOPVSA-N 378.475 5.030 30 20 GKED N#CC1(CCCNc2ccccc2C(=O)Nc2ccc(Cl)cc2)CCOCC1 539710138 JHHAKQFOZTWCKL-UHFFFAOYSA-N 397.906 5.105 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@H](C)c1nc2ccccc2o1 539757220 TXNQKBMVSBZXEC-OAHLLOKOSA-N 392.484 5.038 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N(C)C[C@@H](C)C#N 543318583 UOPHCSWCEAYDCF-LBPRGKRZSA-N 382.464 5.034 30 20 GKED C[C@H]1C[C@H](c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCO1 546510390 KMTQHKMIADFPCG-UONOGXRCSA-N 395.846 5.336 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 553119354 IMPGWFZQXKNCCD-DNQXCXABSA-N 387.527 5.326 30 20 GKED C=CCC[C@@H](NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccco1 560529279 LWXHKMPGDHYJFL-RUZDIDTESA-N 397.522 5.989 30 20 GKED CC(C)CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccoc1 560552030 JXEVPZVWRLFQIY-OAQYLSRUSA-N 379.504 5.452 30 20 GKED CC(C)c1nc2cc(NC(=O)c3cn(CCCC#N)c4ccccc34)ccc2o1 567602271 QHLNXPRGHJBYOS-UHFFFAOYSA-N 386.455 5.462 30 20 GKED CC(C)(C)OC1CC(CC(=O)N(Cc2ccccc2)c2ccccc2C#N)C1 569179703 KRSGOXNNSWZINZ-UHFFFAOYSA-N 376.500 5.075 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC4(CCCC4)CC3)cc2)cc1 582873526 RXKRIGWDVZNQQK-UHFFFAOYSA-N 375.472 5.539 30 20 GKED CCN(C(=O)CCCCCC#N)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 588647540 CQAUTHUBOBUZDO-LJQANCHMSA-N 378.516 5.746 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)sc2c1CCCC2 589191030 AZANWHFDMRSNIO-ZIAGYGMSSA-N 390.430 5.260 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1[C@@H]2c3cccc(Cl)c3C[C@H]21 599737587 MKZRPCLQHFAHFG-DDAIWRKXSA-N 397.931 5.194 30 20 GKED N#Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2cccc(C(F)(F)F)c2)s1 602754802 AYODMDXGKHQCNO-GOSISDBHSA-N 399.397 5.410 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)Cc1cccs1 609078996 VUIVAOUZYOALEK-UHFFFAOYSA-N 391.496 5.171 30 20 GKED COC(=O)[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc(Cl)c1 609804074 BFKDEHFLPZUVKA-NRFANRHFSA-N 392.842 5.330 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccc(C#N)cc1 609825159 JBYCSGZPVSZGDY-CYBMUJFWSA-N 375.419 5.756 30 20 GKED CN(Cc1ccccc1NCc1ccccc1C#N)C(=O)c1cc2ccccc2o1 609915074 XFPFUBRWFGXXIS-UHFFFAOYSA-N 395.462 5.189 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 610223476 LWECCHSTZZPYMC-INIZCTEOSA-N 388.433 5.365 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@H]3c3cccc(F)c3)cc2)cc1 610304874 VWCHWRDFIHCJCP-QHCPKHFHSA-N 386.426 5.271 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 610355456 REGSCSGJFVLVMF-RBUKOAKNSA-N 383.495 5.689 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1cccc(C#N)c1 610362395 QRFLNKKWWYSTLV-CQSZACIVSA-N 378.378 5.120 30 20 GKED C[C@@H](NC(=O)NCc1ccc(Cl)o1)c1ccc(-c2cccc(C#N)c2)cc1 611807223 SGTLHJCPHRULTP-CQSZACIVSA-N 379.847 5.032 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 618762886 SOWVYAFTYHKXNG-SFHVURJKSA-N 398.304 5.253 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)C1 665609869 VOBVLZABJJMDOX-GOSISDBHSA-N 392.503 5.459 30 20 GKED C=C(CNC(=O)c1c(-c2ccc(C(F)(F)F)cc2)noc1C)c1ccccc1 673343058 KVKCHHYSFOISFG-UHFFFAOYSA-N 386.373 5.112 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 730451831 QDPGTCQXSDGRNL-UHFFFAOYSA-N 390.480 5.063 30 20 GKED N#C[C@H](C(=O)c1sccc1SC(F)F)c1nc2cc(F)ccc2s1 730695856 NXNSDFSJIBGQAV-MRVPVSSYSA-N 384.429 5.302 30 20 GKED CC(=NNc1cccc2cnccc12)c1cnn(-c2cccc(Cl)c2)c1C 731558341 SNPZOTLCTIDQBU-UHFFFAOYSA-N 375.863 5.218 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(CSCc3ccccc3)c2)c1 734763789 RWTLMKOEAIOCHJ-UHFFFAOYSA-N 388.561 5.910 30 20 GKED CCCCOc1cc(/C=C\C(=O)c2c(Cl)nc3ccccn23)ccc1OC 737446642 ZIRPGLZAWQRHKX-NTMALXAHSA-N 384.863 5.071 30 20 GKED Cc1nc(S[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)sc1C 741855631 FBPMRVJRTKKPAG-GFCCVEGCSA-N 391.587 5.081 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1ccc(C(=O)N2CCCC2)cc1C 748443326 MINAZDVOHNMSDS-UHFFFAOYSA-N 387.568 5.445 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cnc3ccccc3c2C)cc1 749025433 FCXYSWYRZQCTBO-QRWLVFNGSA-N 385.467 5.018 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H](C)c1ccc(C#N)cc1 749064935 VJENVETUSBHDGK-OAHLLOKOSA-N 392.480 5.373 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC(Cc3ccccc3)C2)cc1 752638532 YGYMADAZCRVRLX-XMMPIXPASA-N 381.479 5.048 30 20 GKED N#C[C@@H](C(=O)CCCc1csc2ccccc12)C(=O)Nc1ccccc1Cl 756234191 RWAQKHRCTALERU-INIZCTEOSA-N 396.899 5.225 30 20 GKED COc1cccc2c1CC[C@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760010567 XAVHVPDECUAESH-XZOQPEGZSA-N 397.478 5.160 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCCCO[C@@H]3CCC[C@@H](C)C3)[nH]c12 766648026 HNGVBEKMUFPAHC-BHIYHBOVSA-N 381.520 5.203 30 20 GKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccccc1-c1ccc(Cl)cc1 776162074 CLLYVSSQFWYFAY-MSOLQXFVSA-N 390.914 6.321 30 20 GKED O=C1/C(=C\c2ncc(-c3ccccc3)s2)CCc2ncc(C(F)(F)F)cc21 777466723 FOGABOMJTIQVBX-JYRVWZFOSA-N 386.398 5.436 30 20 GKED CC(=NNc1ncncc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 780282242 HAUINLZXKMKHRW-UHFFFAOYSA-N 382.695 5.004 30 20 GKED CCCCN(Cc1ccccc1Cl)C(=O)Nc1ccccc1O[C@@H](C)C#N 780670175 ICWCUGAHTLZFJT-INIZCTEOSA-N 385.895 5.465 30 20 GKED COc1ccc(C(=O)/C=C/c2ccnc(Cl)c2Cl)cc1Br 791434209 IRLNQCWNRHKMHV-DUXPYHPUSA-N 387.060 5.056 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1nccc2ccccc12 792095137 JRTAKYUPAVCOAS-RCZVLFRGSA-N 394.499 5.945 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc2nc(-c3ccccc3)oc2c1 793787311 COOXWSOCFYINHM-HNNXBMFYSA-N 383.407 5.038 30 20 GKED CCCNc1ccc(C#N)cc1NCc1csc(-c2cccc(OC)c2)n1 795267389 XEYGYRRTLZLOFC-UHFFFAOYSA-N 378.501 5.124 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccc(OCc3ccccc3F)cc2)c1 796992201 SMFHCFCRCRIRRS-SDNWHVSQSA-N 389.426 5.259 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 798394234 FTEZCMAWLITXQO-GOSISDBHSA-N 376.456 5.455 30 20 GKED N#Cc1c(NC(=O)c2cc(F)c(C(F)(F)F)cc2F)sc2c1CCCC2 807933879 ARPNQLLBZSWVAX-UHFFFAOYSA-N 386.345 5.048 30 20 GKED C=CC[C@@H](NCc1cc(Br)cc(Br)c1)c1ccncc1 808390016 YRQSVUYVECCYKG-MRXNPFEDSA-N 396.126 5.014 30 20 GKED C#C[C@H](NC(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C)c1ccc(Cl)cc1 810185120 LTJOCGNNLDPLKS-SFHVURJKSA-N 397.906 5.129 30 20 GKED Cc1cccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1Cl 810550140 UTAYMAXCTWLDPD-KRWDZBQOSA-N 391.883 5.063 30 20 GKED N#C[C@H](C(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1nc(C2CC2)cs1 842939755 XDWXNMJNQUNYRW-ACVFHECNSA-N 396.821 5.582 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1nc(C2CC2)cs1 842940710 DHIBQOJLUSPRNO-POGDKVGISA-N 378.497 5.232 30 20 GKED C[C@@H](c1cccs1)N1C(=O)/C(=C/c2ccc(C(C)(C)C#N)cc2)SC1=S 846756872 NQOZDZBXFFNCTO-MFVBVHDHSA-N 398.578 5.512 30 20 GKED Cc1c(NCc2ccc(O[C@@H](C)C#N)cc2)cccc1NC(=O)OC(C)(C)C 858233376 MPHABTQGANIGPN-HNNXBMFYSA-N 381.476 5.245 30 20 GKED CC(C)n1ncc2cc(C=NN=C3c4ccccc4-c4ccccc43)c(Cl)nc21 874102547 WBNIPIBNWIGUDV-UHFFFAOYSA-N 399.885 5.518 30 20 GKED COc1ccc2oc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c(C)c2c1 915088221 LIXDELPWCWCIBC-QFIPXVFZSA-N 396.446 5.658 30 20 GKED COCCN(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353215 LYIQBVHACIYNKQ-DEOSSOPVSA-N 399.494 5.023 30 20 GKED Cc1cnn(-c2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2)c1 916050746 FVXFIASOGOCBMH-DEOSSOPVSA-N 392.462 5.089 30 20 GKED Cc1cnn(-c2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2)c1 916050747 FVXFIASOGOCBMH-XMMPIXPASA-N 392.462 5.089 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(-c2ccccc2)cc1 916900683 RKDOGWAMJVQSAK-HSZRJFAPSA-N 396.490 5.440 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCSc2ccc(F)cc2)cc1 916949036 ZYFBRSCLJILQRX-YWZLYKJASA-N 398.503 5.169 30 20 GKED Cc1cccc(OCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 917047482 YMWKURXWIABJLH-HNNXBMFYSA-N 384.888 5.212 30 20 GKED CS(=O)(=O)c1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc1 918156092 KXNWUOAHRQTBOF-NVNXTCNLSA-N 386.538 5.021 30 20 GKED CN(c1ccccc1)c1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033319 FTFOKILIZBMUGP-UHFFFAOYSA-N 379.847 5.252 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NN[C@@H](C)C(C)(C)C 1776065100 VBIPXFMDNBOHLV-SFHVURJKSA-N 396.531 5.297 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1777566784 IQJPBIQIRXBYBY-LDADJPATSA-N 385.444 5.197 30 20 GKED O=C(O)/C=C/c1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 1777624243 YOKBLTWHIQCDJE-VTBWALSUSA-N 380.749 5.353 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1791243214 FQUZDXCWFYKWSH-LAUBAEHRSA-N 394.490 5.044 30 20 GKED C#CCCC(=O)Nc1ccc(C2(NC(=O)CC3CCC(C)(C)CC3)CCC2)cc1 1792268666 WNUOUBNHVAPUQH-UHFFFAOYSA-N 394.559 5.140 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1cccc(Cl)c1 10830351 QDLFPMWCNHEXAC-UHFFFAOYSA-O 395.935 5.241 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(C(C)C)cc2)c1 15248428 IBBXLEPPQMKIMB-UHFFFAOYSA-O 389.544 5.457 30 20 GKED COc1cc(C(=O)/C=C/c2cc(Br)cs2)ccc1OC(F)F 16385131 VAJGLGQIJYKKCI-ONEGZZNKSA-N 389.217 5.017 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(C(C)C)cc2)=C(/S)NC)cc1 22734485 IXMNPFYRLNJRRC-UHFFFAOYSA-O 383.581 5.159 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCCCc2nc3ccccc3s2)cc1 25839400 IPMKEWIYWAJYIB-UHFFFAOYSA-N 377.513 5.449 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 47442765 PYTIJUUCUVXEOO-UHFFFAOYSA-N 390.508 5.137 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccc(C)s2)cs1 54897656 TWONWDUASLTICM-TWGQIWQCSA-N 386.473 5.233 30 20 GKED CCCC(CCC)SCC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1 64048676 GEFBJKMRXCCMFF-UHFFFAOYSA-N 387.549 5.258 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(OCc2nccn2C)cc1)c1ccccc1 90580879 VEUCOOCSXYLWCY-CVDCTZTESA-N 375.516 5.357 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108533383 GXBZDBIGRLLQKK-HOTGVXAUSA-N 383.517 5.172 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H](C)c1cccs1 119525630 CJGHUTITAIWBBU-INIZCTEOSA-N 376.481 5.249 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)o1 153968910 CTUGONUCFUEMCG-LPHOPBHVSA-N 397.544 5.989 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(Cl)cc2Cl)ccc1OC 174091862 HOKKKDVXXIXEQM-CZUORRHYSA-N 393.314 5.534 30 20 GKED Cc1ccc(CCCC(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)s1 176019690 CYPXMMVHGQBPSS-CQSZACIVSA-N 395.311 5.034 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1 180021681 SBUPDWRERWAXBA-XMSQKQJNSA-N 397.478 5.157 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccncc1)c1ccc(F)c(F)c1 185464526 BFVUECLIAMONGQ-YADHBBJMSA-N 393.437 5.066 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)o1 193404899 FQQVBEMVXIEVKY-UHFFFAOYSA-N 379.485 5.144 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)[C@@H]1OCCc2sccc21 294196731 VHSPYJXQFHKDRW-LPMFXHHGSA-N 386.542 5.031 30 20 GKED CSc1ccc(C)c(N/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 329476334 BLGCEYUEOJIRQP-GOSISDBHSA-N 384.549 5.432 30 20 GKED CC(C)c1nc([C@@H]2CCCCCN2C(O)=Nc2csc3ccccc23)no1 329566478 SVMUGDIRLDJZOD-INIZCTEOSA-N 384.505 5.571 30 20 GKED Cc1cc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cnc1N1CCCC[C@H]1C 330019068 UNHJTJONYICSCX-IPJUCJBFSA-N 398.551 5.282 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1c[nH]c2cccc(Br)c12 410356193 WHPHITKNIRQKPA-UHFFFAOYSA-N 383.289 5.230 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Cl)c(Br)c2)s1 430595352 XMVCDPMHADBZMS-JTQLQIEISA-N 397.725 5.347 30 20 GKED CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 432675039 HOAXIPQSAVBMIH-SFHVURJKSA-N 398.894 5.245 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 433314264 YUJOEFPZHKFINI-RXVVDRJESA-N 394.927 5.380 30 20 GKED Fc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1F 436399967 GWARQLNAEHLGKT-OAHLLOKOSA-N 383.282 5.767 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 437039807 NTBPXALJTBBRGM-PXAZEXFGSA-N 386.339 5.921 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccncc2)c1 438167410 OVWZRTJUEBALJR-XZOQPEGZSA-N 398.466 5.178 30 20 GKED C[C@H]1c2ccccc2O[C@H]1[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 438667227 KBXAJKJCJXGAFU-DXEZIKHYSA-N 395.528 5.013 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(c2cccc(Br)c2)CC1 439426283 AWAZPFZPLZZIEF-UHFFFAOYSA-N 398.304 5.041 30 20 GKED C[C@@H](SCc1cccc(C(=O)NCc2ccco2)c1)c1cccc(C#N)c1 443150077 ZWWVHGDLYGFVCO-MRXNPFEDSA-N 376.481 5.076 30 20 GKED CC(C)CCN(CCC#N)C(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 446354966 KEDATHVRBGUGDL-OAHLLOKOSA-N 393.812 5.054 30 20 GKED C=CC(C)(C)CNC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 452779157 SFNFSAARSSDADM-UHFFFAOYSA-N 394.899 5.043 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)C1 454284315 XVBGGRBWJJNOSV-YOEHRIQHSA-N 376.485 5.167 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)oc2ccc(Cl)cc12 464470627 WMZQRWCLBOVETQ-CYBMUJFWSA-N 378.737 5.299 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 464938037 GRVPVNJEPYNTEG-RCTAOEEJSA-N 380.491 5.242 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1cc(F)cc(C(F)(F)F)c1 465122190 SJNOWUJZKGXIMN-UHFFFAOYSA-N 379.275 5.592 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCS2)cc1Cl 465156752 PXARVABDNXHDCC-SJLPKXTDSA-N 385.920 5.013 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 467826046 JTFDCPGOEDAACU-QGZVFWFLSA-N 377.488 5.276 30 20 GKED N#CCCCN1C(=O)CCc2cc(NC(c3ccccc3)c3ccccc3)ccc21 469204517 LEIAERNPVGFRSI-UHFFFAOYSA-N 395.506 5.471 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H](c3ccccc3)C3CCCC3)ccc21 469347438 IFSBLHKUNOMIBP-VWLOTQADSA-N 387.527 5.613 30 20 GKED N#CCCSc1ccccc1NC(=O)CC1(CSc2ccccc2)CC1 471846125 OMCMEEXOOYFNQO-UHFFFAOYSA-N 382.554 5.593 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@@H]1CCCC[C@@H]1C(F)(F)F 473254849 KKJKOOYJDYFWPM-OLZOCXBDSA-N 386.311 5.107 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c(Cl)c1 473493950 WTHGILOUBKUXHD-OAHLLOKOSA-N 396.796 5.423 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1nc2ccccc2o1 474361828 ZRSGUNQJEPXSOH-QGZVFWFLSA-N 391.475 5.015 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnn(-c3ccc(F)cc3)c2C(C)C)n1 474428123 CRZUOAPKMBMINI-INIZCTEOSA-N 396.491 5.205 30 20 GKED N#Cc1cc(Cl)ccc1CN[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F 481018891 FOIXJEACCLSMKR-OAHLLOKOSA-N 390.739 5.206 30 20 GKED CC[C@H](NCc1cc(C#N)ccc1Br)c1ccccc1OC(F)F 492747188 KWCOLAHHLKESHS-INIZCTEOSA-N 395.247 5.163 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(Cl)c(F)c2)cc1 498178069 FXVGFZSUGGFCRX-UHFFFAOYSA-N 394.833 5.376 30 20 GKED CC(C)c1cc(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)nn1C(C)(C)C 499866848 ZLONVCPUUWADBW-OAHLLOKOSA-N 393.318 5.063 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@@H](CC1CCCC1)c1ccccc1 499946307 AXOGTZQGUKVCHO-QHCPKHFHSA-N 396.531 5.181 30 20 GKED CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)C(=O)Cc1ccc(C#N)cc1 500982146 JYUPOGBNZHKRPQ-UHFFFAOYSA-N 392.499 5.406 30 20 GKED N#CCN(C(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1ccccc1 504687477 RJHWWGRFDFUTOK-UHFFFAOYSA-N 376.843 5.089 30 20 GKED CCN(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@@H](C)c1ccc(C#N)cc1 506758976 NSDJWTGQAHGITK-SFHVURJKSA-N 397.478 5.034 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1F 506774593 HHVVYQSIUYUTPV-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CN1CCC[C@H](CNC2CCC(C#N)(c3ccccc3)CC2)[C@@H]1c1cccs1 507651985 VNYOBVSPPMRCCC-VCERZCPPSA-N 393.600 5.125 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)[C@H]1CCC[C@@H](C(F)(F)F)C1 509328162 PMUBXWYWCHVAAP-OUCADQQQSA-N 385.323 5.304 30 20 GKED N#CC1(CCCSCc2nc(-c3c(F)cccc3F)cs2)CCOCC1 512382401 GLJKNPVEVBKIBH-UHFFFAOYSA-N 394.512 5.422 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)c1 512750392 VPQRJQDIMDSYSY-UHFFFAOYSA-N 397.261 5.696 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCOc2ccc(F)cc21 518168826 LSIHHWJYWMDPAB-RHSMWYFYSA-N 399.491 5.113 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)CCCC1 520449200 WKOBXSALQZGTKN-UHFFFAOYSA-N 392.352 5.659 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SC[C@H](C)c1ccccc1 522573342 OPTYIIMFIJXAFS-INIZCTEOSA-N 383.492 5.078 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 525190736 MPYLJGGFPOFNFB-UHFFFAOYSA-N 383.908 5.015 30 20 GKED CC(C)(C)c1ccc(Oc2ccc(C(=O)N(CC#N)C3CCCC3)cn2)cc1 525475193 XDAKVZQXLDROIX-UHFFFAOYSA-N 377.488 5.080 30 20 GKED N#Cc1ccc(SCCCC(=O)c2ccc(Br)cc2)c(F)c1 525630706 GSBZBLIHSAOYSK-UHFFFAOYSA-N 378.266 5.215 30 20 GKED N#CCCCOc1cccc(NC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)c1 525654296 ZUVZHEVKDVNFIO-HSZRJFAPSA-N 398.506 5.724 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2cnc(-c3cccs3)s2)CC1 530722937 KBPOGSUKNKDGHU-UHFFFAOYSA-N 395.553 5.223 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Sc2ncccn2)cc1C)c1ccccc1 534697689 SNJRMPXEIFJAEZ-KRWDZBQOSA-N 375.497 5.235 30 20 GKED N#C[C@@H](C(=O)c1cccc([C@H]2CCCOC2)c1)c1nc(-c2ccccc2)cs1 536588779 NABAGDRVONBKMT-PMACEKPBSA-N 388.492 5.194 30 20 GKED COc1ccc([C@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2Cl)cc1 537306346 UHFJGPPFACFYAO-MWTRTKDXSA-N 376.887 5.660 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(OCc4ccc(F)cc4)c3)cc2)CC1 540703240 STHFLEJHAYUGRA-UHFFFAOYSA-N 386.426 5.212 30 20 GKED N#CCCN(C(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccc(F)cc1 553945666 QZCWTFQCFANLET-UHFFFAOYSA-N 399.878 5.092 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H](C)Cc1cncc2ccccc12 554678668 KODDCJQIMULIGK-HNNXBMFYSA-N 384.932 5.343 30 20 GKED Cc1ccnc2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc12 556895620 QEXIJJCLEIDBHO-LJQANCHMSA-N 394.459 5.028 30 20 GKED N#CC[C@@H](CC(=O)N1CC[C@H](Sc2cccc(Cl)c2)C1)c1ccccc1 558115483 AIXRIRHESVNEAJ-PXNSSMCTSA-N 384.932 5.121 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)sc2c1-c1ccccc1OC2 560681993 AHJQFSCITQWEOO-GHMZBOCLSA-N 392.402 5.096 30 20 GKED COCCC[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 560708745 NEMRVZLKPUFMQR-LJQANCHMSA-N 398.934 5.081 30 20 GKED COc1ccccc1[C@H]1C[C@@H](C)CCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 562087203 MSHAOTNUUFXRKL-LAUBAEHRSA-N 391.515 5.501 30 20 GKED C[C@H]1CN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CCC1(F)F 564502981 FFKSTDAGBKIRGF-ZDUSSCGKSA-N 390.817 5.121 30 20 GKED N#CCCC1CCN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CC1 577376636 GUZWKFDKJRCYPZ-UHFFFAOYSA-N 393.874 5.160 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)CC2 583663677 QKIOEYNDZPHBTQ-UXHICEINSA-N 385.280 5.188 30 20 GKED CCC(C)(C)C1CCC2(CC1)C[C@H]2C(=O)N1CCC(C#N)(c2ccccn2)CC1 583743982 FQGXGOAGBBNDTG-VIHQBZHPSA-N 393.575 5.098 30 20 GKED COc1ccc(C[S@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1C#N 584041457 HIULPCBWKHWCOI-CUNXSJBXSA-N 395.911 5.259 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 588316058 FRSGDFVNKYANJV-HSZRJFAPSA-N 388.515 5.056 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2nc(-c3cccc(Cl)c3)cs2)cc1 603740412 XXPKIBKDHYALCA-UHFFFAOYSA-N 399.928 5.207 30 20 GKED C=CCc1cc(C(=O)Nc2ccc(COC3CCCC3)cc2)cc(OC)c1OC 606824811 IBBDXHAIHUIISR-UHFFFAOYSA-N 395.499 5.144 30 20 GKED Cn1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c(C2CCCCC2)n1 608847176 ODXHNIBWSPGHIF-UHFFFAOYSA-N 396.560 5.312 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 609773520 IOVXIIPPLAWQFN-PKOBYXMFSA-N 381.501 5.146 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)c3cccc(CC#N)c3)cc2c1 610070491 CXXKIDKGFBRAPZ-UHFFFAOYSA-N 384.435 5.243 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1cccc(C#N)c1 610361292 YEPMHCIGIYPUBF-CQSZACIVSA-N 378.378 5.120 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1cc(C(C)(C)C)sc1C#N 611131305 FNNIIMQWFVMDNV-UHFFFAOYSA-N 377.513 5.264 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1 611394002 XIXAUZNKUZASCS-DEOSSOPVSA-N 399.469 5.117 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3SCC(F)(F)F)cc2)CC1 611466446 OBRHWGMTXKOYAU-UHFFFAOYSA-N 376.403 5.148 30 20 GKED CC(C)Oc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c(Cl)c1 614896412 YDGUMJIJJSHGCA-UHFFFAOYSA-N 383.662 5.558 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cc1CO 615893110 JZFQXYXFMJPCGE-UHFFFAOYSA-N 388.492 5.071 30 20 GKED CCN(C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)[C@@H](C)c1ccc(C#N)cc1 617454472 XQKPMJXUBHEUJN-NSHDSACASA-N 382.332 5.079 30 20 GKED O=C(C/C=C/c1cccc(F)c1)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 674080666 MKNKDMKKNWUTOZ-WVSCJACDSA-N 397.334 5.255 30 20 GKED Fc1ccc(F)c2c1CC[C@@H]2NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 677129546 MPRVFKMVZOKKQR-NUPCCRGMSA-N 387.314 5.451 30 20 GKED Cc1ccc(C)c(CC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 728146775 GMIOYCILURYFHB-HNNXBMFYSA-N 382.435 5.124 30 20 GKED COc1cc(C#N)ccc1OC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 731325483 QCWWNWQTHVRPKY-UHFFFAOYSA-N 396.402 5.108 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 731643623 JFIPNFTWPAPMQT-CYBMUJFWSA-N 392.267 5.013 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1 731980330 LMDXBLXXWQWPMW-UHFFFAOYSA-N 392.842 5.216 30 20 GKED C[C@H](CC1CCCC1)C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 734079501 RBTLZJOQRBYFQT-XLIONFOSSA-N 390.483 5.343 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2Cl)C(C)C)c1 734529984 CDGITUYTQYFAQG-UWJYYQICSA-N 399.922 5.217 30 20 GKED FC(F)Oc1ccc(NN=Cc2ccc(Br)cc2Cl)cc1 743437506 FLPJCYCFDASHKM-UHFFFAOYSA-N 375.600 5.150 30 20 GKED CCCCCCCC(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 743956600 PDFIHILRDHGRPN-UHFFFAOYSA-N 398.513 5.489 30 20 GKED C=C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 759279323 NNOOGUCRBUTARG-GOEBONIOSA-N 394.446 5.624 30 20 GKED C[C@H](NC(=O)c1ccccc1SCC#N)c1ccc(Cl)c2ccccc12 765820480 YDMJVXOQMVABNW-AWEZNQCLSA-N 380.900 5.600 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(C3SCCS3)c2)CCCC1(C)C 770112723 BNQCTFKOLHXAKJ-KRWDZBQOSA-N 376.591 5.764 30 20 GKED CCCCCCCOc1ccc([C@H](C)N[C@H]2CCOC3(CCOCC3)C2)cc1 773077574 FCMULJFWWURVQB-UNMCSNQZSA-N 389.580 5.415 30 20 GKED CCCCCCCOc1ccc([C@H](C)N[C@H]2CCO[C@@]3(CCOC3)C2)cc1 773154116 XENNMDWAOSIANI-RRPUWOKSSA-N 375.553 5.025 30 20 GKED CCN(CC)c1ccc2cc(C(=O)/C=C\c3ccc4cnccc4c3)c(=O)oc2c1 782314438 SOSHNQYSBLVNII-POHAHGRESA-N 398.462 5.084 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@H]2/C=C/c2cccs2)c1 783044747 URYYOAXNVLRMJC-ZGKFYVQTSA-N 381.501 5.140 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Br)cs2)c1 786851365 CNNALTFXXWFDJH-IUODEOHRSA-N 379.323 5.042 30 20 GKED N#C[C@@H](C(=O)Cc1cc(Cl)ccc1Br)c1ccc2ccccc2n1 790768254 UKHPYTDIVXDBOU-OAHLLOKOSA-N 399.675 5.070 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C(C)(C)c2cccc(Cl)c2F)s1 797568255 PJDOGKGPGWXMQD-LLVKDONJSA-N 378.900 5.387 30 20 GKED C[C@H]1CCCN(c2ccc(CNCc3ccc(O[C@H](C)C#N)cc3)cc2Cl)C1 800277775 ZGUSXNFTCVBNGL-ZWKOTPCHSA-N 397.950 5.157 30 20 GKED C=CC[C@@H](C(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817870534 RUXGYJGUEFBCMB-IUODEOHRSA-N 382.813 5.291 30 20 GKED CC(C)CN(C(=O)c1ccc(C2SCCS2)cc1)c1ccc(C#N)cc1 914510677 TZBIPERDOUVWJS-UHFFFAOYSA-N 382.554 5.340 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3cccc(Cl)c3)CC2)cc1 915085386 LIQAJOLXCRVZQW-JOCHJYFZSA-N 386.882 5.666 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(F)cc2Cl)cc1 915087661 WKYCMKJJEVDLMD-LJQANCHMSA-N 394.833 5.152 30 20 GKED C(=NNCc1cccc2cccnc12)c1c(-c2ccccc2)[nH]c2ccccc12 915962542 JXBAYVGQAWYPJD-UHFFFAOYSA-N 376.463 5.507 30 20 GKED CC(C)=CCC[C@H](C)CC=Nn1cnnc1SCc1ccc(Cl)cc1 916546534 WZTSSMCJKQBTOF-INIZCTEOSA-N 376.957 5.830 30 20 GKED CCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 916907614 ZDLGDWPLPGPOKF-HXUWFJFHSA-N 384.435 5.002 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccccc2Cl)cc1 916947448 KPPZGBCKJMUBGK-BEFAXECRSA-N 382.891 5.134 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3sccc3s2)cc1 918486114 CTOBGFTXEDITPA-WFASDCNBSA-N 382.510 5.437 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H](C)Sc1ccccc1Cl 920104716 XNLDPWREVVSLMK-UKRRQHHQSA-N 396.899 5.202 30 20 GKED N#Cc1ccc(CN(CC/C=C\c2ccccc2)c2ccc3nc(O)[nH]c3c2)cc1 1653642882 KLODMDVZGKOEOG-YWEYNIOJSA-N 394.478 5.250 30 20 GKED O=C(O)c1cccc(NN=Cc2ccccc2OCc2ccc(Cl)cc2)c1 1776038439 KHHQDJKAWCBNNL-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)nc2)cc1 1776125341 FIUZUYDXDXBIJT-LEHPZIBWSA-N 381.472 5.271 30 20 GKED O=C(O)c1cc(Br)cc(/C=C/C(=O)c2ccc3ccccc3c2)c1 1776131166 JYIXTURFPANOEJ-VMPITWQZSA-N 381.225 5.197 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(Cl)cc1Cl 1776354382 KCQNIKZOOYAIAJ-DAXSKMNVSA-N 379.239 5.375 30 20 GKED CC1(C)/C(=C/c2ccc(/C=C\C(=O)O)cc2)C(=O)c2cc(Br)ccc21 1776515254 SQIOWIRZRKZNHB-WSVRQDSFSA-N 397.268 5.104 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776697813 PABHZCRKXKJJAF-WCRPCQDQSA-N 390.504 6.523 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2cc(C(=O)O)ccc2Cl)cc1 1776786637 PEPFYTYSLOGOOO-UHFFFAOYSA-N 387.907 6.194 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c(Cl)c1 1777353247 DWASZFKAJQSKHY-JXMROGBWSA-N 398.867 5.671 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C\c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777455895 KKMPNWWBYUVYNM-WTWSVLSHSA-N 398.458 5.583 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(O)c(C(=O)O)c1 1777487715 JHOQJMIZIKEESD-OQFOIZHKSA-N 399.855 5.072 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1csc(C(=O)O)c1 1777487790 UXJLWTVLUNUPKZ-UQCOIBPSSA-N 389.885 5.428 30 20 GKED Cc1ccc(-n2c(SCc3ccc(C#N)cc3)nnc2-c2ccncc2)cc1C 5356163 KMXHGBSIYSLQJJ-UHFFFAOYSA-N 397.507 5.110 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)cc2C)[n+]2ccccc2)cc1 20834562 DHLZXXVUNWEVSV-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CCC(CC)c1nnc(NC(=O)c2ccccc2-c2ccccc2C#N)s1 25725178 BPUZRLLJJWNOTQ-UHFFFAOYSA-N 376.485 5.233 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 69589090 GDAKJYCGEFHLLH-KRWDZBQOSA-N 389.455 5.150 30 20 GKED Cc1nc(/C=C\c2ccc(C#N)cc2)sc1C(=O)/C=C/c1ccc(C#N)cc1 96402175 WMJMEHALUHVKRE-FAEGWCMCSA-N 381.460 5.261 30 20 GKED CCC[C@H](NC(=O)CNc1ccccc1SC[C@@H](C)C#N)c1ccccc1 108353904 WAMSPVHHIRJLKG-HKUYNNGSSA-N 381.545 5.008 30 20 GKED Cc1ccc2cc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)[nH]c2c1 108695632 KKCUQDGFQLCELR-UHFFFAOYSA-N 395.462 5.374 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1nc(-c2ccncc2)cs1 114619851 FONHLRSIEDFWFE-LJQANCHMSA-N 399.475 5.274 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cnc(-c3ccc(C)cc3)s2)c1 115618506 CHAWQGBSLQHCFS-LJQANCHMSA-N 377.513 5.089 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3cccc(F)c3)n2)cc1 116594545 AEZXYLIPBSNPHU-IFXJQAMLSA-N 394.471 5.328 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@H](C)c1ncc(C(C)(C)C)o1 122718815 ARZRTFGXXBNKCM-OAHLLOKOSA-N 398.532 5.182 30 20 GKED COc1cc(CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1Cl 127724479 HNTFXJPVUOYSOK-AWEZNQCLSA-N 388.920 5.314 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3cc(C#N)ccc3OC(C)C)c2)n1 150845113 QFORQYIWYGWTPP-UHFFFAOYSA-N 377.469 5.030 30 20 GKED CC(C)C[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 174788294 JMJDPLZUYABBSU-FQEVSTJZSA-N 391.515 5.232 30 20 GKED Cc1cccc(C2=CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CC2)c1 179382505 FSEDVJYMOFYKSI-SFHVURJKSA-N 391.540 5.568 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1cccs1)Cc1cccs1 184351559 ISPHDNYHCDWIMC-HNNXBMFYSA-N 397.525 5.335 30 20 GKED C[C@@H](CN(C)C(=O)c1ccccc1Sc1ccccc1C#N)c1nccs1 184885203 RSLGEBVSCWTFQD-HNNXBMFYSA-N 393.537 5.042 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1 187131230 GAYZXGREBRCWST-OAHLLOKOSA-N 385.558 5.411 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1c(F)cc(F)cc1Br 192293829 UZCWIZPHQLZPIZ-UHFFFAOYSA-N 387.249 5.009 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3c(c2)CCO3)cc1 192831855 KKCTUVZAUWSQFE-UHFFFAOYSA-N 386.476 5.038 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CCCOc3ccccc32)c1 237839930 VPTYMEOPJDGXFK-XMMPIXPASA-N 384.479 5.141 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc([C@H]4CCCO4)s3)cc2)c1 272650178 MXAROBBMNZEWCY-OAQYLSRUSA-N 391.496 5.057 30 20 GKED CCn1c(CSc2nc(C)cc(C(F)(F)F)c2C#N)nc2cc(F)ccc21 303197450 YKZXVLVSHIYDJC-UHFFFAOYSA-N 394.397 5.082 30 20 GKED Cc1sc2nc(CC/C(O)=N/[C@]3(C)CCCc4ccccc43)nc(O)c2c1C 328646300 GUPGFTZKMGGARV-JOCHJYFZSA-N 395.528 5.155 30 20 GKED Cc1nc([C@H]2CCCN2C(O)=Nc2ncc(C3CCCCC3)s2)cs1 330158662 QCNCZHBBEHJYCR-OAHLLOKOSA-N 376.551 5.338 30 20 GKED Cc1ccc(-c2nc(C)sc2C/C(O)=N/[C@@H]2CCOC3(CCCCC3)C2)cc1 330233688 YAKHCPQHXQRNJS-LJQANCHMSA-N 398.572 5.808 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O 331983504 VVUUKGGNOPRDIX-MVWVFHAYSA-N 384.564 5.332 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc(F)c2)cc1Cl 410168671 MDYLRCUDBTYRKC-FQEVSTJZSA-N 393.849 5.456 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c2[C@H]1C 410983736 KOHLAEFYTQSDNE-UWVGGRQHSA-N 389.864 5.119 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(OC)(C(F)(F)F)CC1 417038319 IYOMEGCQLJJVLR-UHFFFAOYSA-N 384.442 5.114 30 20 GKED C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[S@@](=O)CCC1(C#N)CCCCC1 417149990 PHBOBSVKHRDHGB-RXBISOJRSA-N 391.924 5.064 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cccc(C(F)(F)F)c1F 429917221 BSHGYSAKBPJULF-UHFFFAOYSA-N 399.237 5.177 30 20 GKED N#Cc1ccc(NC(=O)C2(c3ccc(Br)cc3)CCC2)c(Cl)c1 430355731 QISWPMVGKZIZSM-UHFFFAOYSA-N 389.680 5.035 30 20 GKED C=CCC[C@@H](NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1)c1ccccc1 435277117 IRXXLXSNZIRANR-HXUWFJFHSA-N 396.437 5.376 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2cc(C#N)cs2)C(C)C)cc1 437697908 UWBOFNCTIKADKS-UHFFFAOYSA-N 390.508 5.346 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Br)c(Cl)c1)c1ccccc1 439486399 LRQPXFLBWMKXEA-MRXNPFEDSA-N 392.684 5.269 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(C#N)c(C)c2)CCC3)cc1 443990646 ULHPECXXYKAJDO-HXUWFJFHSA-N 389.524 5.166 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ncc(-c2ccccc2)o1 444253029 YFGMRYHGUPJOJP-KRWDZBQOSA-N 398.466 5.091 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)CCCC1(C)C 444893348 DYUMBYBKQOCROB-LJQANCHMSA-N 385.552 5.578 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCCC1CC(F)(F)C1 454690068 IIQGCYINBOGJHJ-UHFFFAOYSA-N 399.441 5.003 30 20 GKED CC(C)(CC#N)CNC(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 458030969 RPPGUKQKXKDXHN-UHFFFAOYSA-N 395.553 5.137 30 20 GKED Cc1cc(NC(=O)N2CCO[C@@H](c3cccc(C#N)c3)C2)ccc1-c1ccccc1 460250183 GHODUXKOTGGMRQ-XMMPIXPASA-N 397.478 5.139 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc(F)c2Cl)cc1 463610681 HRXKBAJESYEISZ-UHFFFAOYSA-N 396.805 5.404 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cc(F)c(OC(F)F)cc1F 468197848 ZHEXQOGGEYPSMX-JTQLQIEISA-N 395.274 5.241 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)c2cn(CCCC#N)c3ccccc23)cc1 469380427 BXLWOZKDEKPTQO-NRFANRHFSA-N 385.511 5.101 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 471874445 RFTBCGXMPUDJOJ-UHFFFAOYSA-N 377.532 6.077 30 20 GKED CN(Cc1nccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 472700571 DLNHKSBGSCHOPG-UHFFFAOYSA-N 398.875 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1 476120828 DKPWEVYMYVVTOZ-UHFFFAOYSA-N 387.479 6.253 30 20 GKED N#Cc1ccc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)s1 476925692 SBJXLOBJTDHPJB-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CO[C@@]1(C)CCCN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CC1 477838997 WSBPFOSZDHNTBY-QFIPXVFZSA-N 398.890 5.035 30 20 GKED CC[C@@H](C)c1ncc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 478304858 AUGQNFBEBPZEGL-OAHLLOKOSA-N 388.496 5.265 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1ccc(OC(F)(F)F)cc1 481272008 VCTOTJGADZOEMY-NSHDSACASA-N 399.210 5.070 30 20 GKED CC(C)C[C@H]1CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481738259 GOUSMBWZBHPYIK-HXUWFJFHSA-N 395.478 5.319 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@H](c3ccccc3)c3ccco3)c2)cc1 482026587 SBHJDBFMIFMZEN-XMMPIXPASA-N 394.430 5.463 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 483443944 XYJHJZWBUFKZPG-UHFFFAOYSA-N 397.434 5.262 30 20 GKED N#C[C@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1nccc2ccccc12 483985032 USIOKWKFYVBEGR-FQEVSTJZSA-N 389.414 5.533 30 20 GKED Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 485753370 JYNKJAQUCZYPKD-LJQANCHMSA-N 389.480 5.174 30 20 GKED N#Cc1c(F)cccc1CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 488230870 HGPNRRNYDFZDOD-UHFFFAOYSA-N 389.459 5.064 30 20 GKED C=CCN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 497541712 OGTFPIQNNRGZPO-MSOLQXFVSA-N 396.462 5.411 30 20 GKED CC[C@@H](C)Sc1ccc(NCC(=O)Nc2ccccc2SCC#N)c(C)c1 498636268 ALAMVOUWLGOENQ-MRXNPFEDSA-N 399.585 5.552 30 20 GKED Cc1ccc(CCC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 501443386 MYGIVZSKTBCRQP-UHFFFAOYSA-N 384.479 5.211 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@@H]2c2ccc(Cl)cc2)c1C 501848133 IHFOEDGMHNESRW-JOCHJYFZSA-N 395.934 5.041 30 20 GKED COCCOc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 503220299 AWUPCISWEQDYFR-MRXNPFEDSA-N 399.516 5.059 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3Cl)CC2)cc1 503900069 HERBSYJDQQYSCA-MOPGFXCFSA-N 397.305 5.284 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)c1 505928038 HYXCYKOLWJWKOZ-UHFFFAOYSA-N 393.796 5.083 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1occc1-c1ccccc1 508391838 VJOMHJXOGIAFRP-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C=CCOc1ccc(CN(C(=O)CCc2ncc(C(C)(C)C)o2)C(C)(C)C)cc1 510447299 ZHGIGQCTMHGXMK-UHFFFAOYSA-N 398.547 5.297 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c(F)c1 513200393 IYOCPUPRYYHYDX-INIZCTEOSA-N 389.430 5.237 30 20 GKED CCCN(CC)c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518740328 VSNCUOVDSQIYLU-KRWDZBQOSA-N 381.545 5.569 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 520199091 RXBNEEZCARNZDG-INIZCTEOSA-N 385.508 5.662 30 20 GKED CCCN(C(=O)NCc1ccc(C#N)cc1)[C@H](C)c1ccc(Cl)c(Cl)c1 523005406 UHHSRAQOXUNHQU-CQSZACIVSA-N 390.314 5.548 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccnc(Oc4ccccc4)c3)c2C#N)C1 523870037 NOEULCQYEDNMMJ-AWEZNQCLSA-N 389.480 5.184 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c2c1 530589340 AJBSCDAESLAQSC-AWEZNQCLSA-N 377.513 5.106 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(Cl)c3SCC(F)F)cc2)CC1 539667354 XSQVPFZKTCZAIC-UHFFFAOYSA-N 392.858 5.505 30 20 GKED Cc1sc([C@@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 540708186 NHMIJDVIRRSTJN-QWHCGFSZSA-N 399.922 6.195 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 543304914 SHDBEEUNZKXRSA-OALUTQOASA-N 393.556 5.719 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1 554886081 HCPSGBAACBDYKS-LJQANCHMSA-N 396.490 5.062 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1ccc(Cl)cc1Cl)c1ccncn1 562138535 CYPYRZSJHOPMKQ-CQSZACIVSA-N 384.222 5.066 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](F)(c2ccccc2)C1 563861369 GIFLLXORZXEUEB-HRAATJIYSA-N 383.492 5.041 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC4(CC3)CC4(F)F)cc2)cc1 593151898 UWWYAHCEJUQGJA-UHFFFAOYSA-N 383.398 5.004 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC[C@H](CC#N)C3)c(C)c2)c1 596731208 HDPPXLKRHRVART-LJQANCHMSA-N 377.488 5.040 30 20 GKED COc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1C 597180527 QQWWLIAPYACTPZ-UHFFFAOYSA-N 394.418 5.281 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C[C@H](C)C1(F)F 599738442 WCNFGDNAKVPDTG-GJZGRUSLSA-N 385.414 5.106 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ncccc1Cl 600640242 IJEOHNMYYIFXEW-ZDUSSCGKSA-N 391.949 5.001 30 20 GKED Cc1cc(-c2ccccc2)ccc1NCC(=O)Nc1ccccc1SCC#N 603580690 PBGXHLFIYIMFJP-UHFFFAOYSA-N 387.508 5.328 30 20 GKED C=CCCOCC(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 607848079 NKKGCSGLIXGBIK-UHFFFAOYSA-N 395.478 5.263 30 20 GKED CO[C@H](C)c1cccc(N[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 608889108 IIBLLPDJAJEOKJ-HUUCEWRRSA-N 397.544 5.035 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)c3cccc(CC#N)c3)cc2)c1 609032694 BYUABYQDSKMGQU-IBGZPJMESA-N 384.479 5.131 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccc(F)c(Cl)c1 609370755 VECOIYAWOPQUPX-GFCCVEGCSA-N 394.924 5.462 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(Cl)cc1 609370935 KQSGEHHOAWKYBG-ZDUSSCGKSA-N 376.934 5.465 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccccc1 609399174 DLEGFGHHOPKALO-OXJNMPFZSA-N 379.529 5.553 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cc(F)ccc1F 609502900 MASAVJHRHUZSSX-UHFFFAOYSA-N 378.378 5.100 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4ccccc4)cn3)cc2)nc1 609505086 LXMAMFOAHPWCOM-UHFFFAOYSA-N 392.418 5.060 30 20 GKED Cc1ccccc1-c1noc(CSc2nc(-c3ccccc3)ccc2C#N)n1 609620552 QAGVKJACUMTOQI-UHFFFAOYSA-N 384.464 5.271 30 20 GKED CC(C)c1nnc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 609722213 KFDFXMRWJYLOCO-UHFFFAOYSA-N 398.875 5.231 30 20 GKED C[C@@H](S[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O)c1ccc(C#N)cc1 609825801 UMOQUWILNZFRFB-ACJLOTCBSA-N 390.430 5.177 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2ccccc2)C(F)(F)F)cc1C(F)(F)F 610330938 IFPPCGBKMMVOSG-CQSZACIVSA-N 387.283 5.002 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1cccc(C#N)c1 610345426 JHGBSOHZGGXMOM-WDEREUQCSA-N 380.250 5.126 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3ccccc3CC)n2)C1 661378918 OLYKWYVJPGLCFY-SFHVURJKSA-N 383.561 5.178 30 20 GKED C=C(C)COc1cc(CNc2ccc(-c3nc(C)c(C)o3)cc2)ccc1OC 676319667 SAWVTSSGPJLKBG-UHFFFAOYSA-N 378.472 5.534 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1Br)c1ccccc1 677564709 CGLCZUMYEOSHEV-OXQOHEQNSA-N 384.317 5.473 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c[nH]c4cc(C)ccc34)n2)cc1 726322397 SXOSXYJDJJKZDW-IBGZPJMESA-N 385.492 5.327 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C(F)(F)c3ccccc3)cc2F)c1 728183336 RYCYMPBHONKVDJ-UHFFFAOYSA-N 396.368 5.007 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)nc1 728819632 BCAGZZJZMNQODI-LBPRGKRZSA-N 378.419 5.225 30 20 GKED C=CCc1cc(OCC)ccc1OC(=O)CCc1nc(C)c(-c2ccccc2)o1 730396922 UWMPAEKBDYMUDS-UHFFFAOYSA-N 391.467 5.315 30 20 GKED C[C@@]12CC3CC(C(=O)[C@H](C#N)c4nc5cc(F)ccc5s4)(C1)C[C@](C)(C3)C2 730416818 IONAJTCFBAZOEM-RCUTVYSTSA-N 382.504 5.608 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 730993590 BQXWHGMMAUAJCM-GFCCVEGCSA-N 396.459 5.803 30 20 GKED CC(C)CN(CCC#N)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 735038983 HUKKMYCVQOMZEQ-UHFFFAOYSA-N 381.863 5.016 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 744017145 ZFAURAGBGGYAOV-SAAWKEMMSA-N 386.398 5.595 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)c1 744028633 MQXQYONWGBUSKM-JOCHJYFZSA-N 398.462 5.146 30 20 GKED Fc1ccccc1C=NOCc1csc(-c2ccc(C(F)(F)F)cc2)n1 744180562 SZJMJFUMKATKQZ-UHFFFAOYSA-N 380.366 5.519 30 20 GKED CC(=NNc1ccc(OC(F)(F)F)cc1)c1c(C)nn(-c2ccccc2)c1C 746489510 BLTYYLYPRRIFBO-UHFFFAOYSA-N 388.393 5.224 30 20 GKED CC[C@H](C(=O)Oc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(C)noc1C 748688507 ZIZCJOOPYPPDKV-FQEVSTJZSA-N 376.412 5.055 30 20 GKED C[C@H](CCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 750330236 GFOCETKQJCSJAM-GDBMZVCRSA-N 396.462 5.848 30 20 GKED COC(=O)c1ccccc1-c1ccc(C=NOc2ccccc2C(F)(F)F)o1 754712235 HOAXKJDKSZNFSS-UHFFFAOYSA-N 389.329 5.165 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2ccccc2[C@@H](O)C(F)(F)F)cc1 758110479 WTFAPRUAKYZZMD-OAQYLSRUSA-N 382.385 5.433 30 20 GKED O=C(Nc1cccc(C=NOCc2ccc(F)cc2)c1)c1ccccc1Cl 758143008 OFBFHJSEWUHNFQ-UHFFFAOYSA-N 382.822 5.282 30 20 GKED C[C@H](OC(=O)Cc1cccc(OCC#N)c1)c1ccc(Cl)c(C(F)(F)F)c1 760627441 PSSXPIUNFVBWAO-LBPRGKRZSA-N 397.780 5.108 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(Br)c(Br)c2)s1 762437954 JBUITIXEZIEAFW-DJWKRKHSSA-N 397.091 5.041 30 20 GKED CC(C)(C)c1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 763003802 BMOJXFJILBUNBT-HXUWFJFHSA-N 399.519 5.398 30 20 GKED N#CCc1ccnc(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)c1 764205631 HWMUMWQLFRCKOD-UHFFFAOYSA-N 398.853 5.269 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@@H](C)c1cccc(C#N)c1 764614232 QRXWMVIWRRZFBI-HNNXBMFYSA-N 392.480 5.373 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1nc(C(F)(F)F)cs1 767358474 ANYWRUJSTXKTOX-UHFFFAOYSA-N 388.724 5.065 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCC(=O)c3cccc(F)c3)n2)cc1 767433599 VOCQBAZOXLALCL-SFHVURJKSA-N 392.455 5.097 30 20 GKED O=C(/C=C\c1cncs1)c1ccc(-c2ccccc2Br)s1 767722965 UQGSZNCJPWJMOZ-WAYWQWQTSA-N 376.300 5.530 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(N2CCCC2=O)cc1 774479955 STQVUBVQNNMMLC-LJQANCHMSA-N 395.506 5.203 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1cc(F)c(Cl)cc1Cl 774808151 IGKOLACLRQNXEX-SNVBAGLBSA-N 387.669 5.539 30 20 GKED CCCOc1ccc(NCc2cn(C)nc2-c2ccc(C#N)cc2)cc1Cl 778076837 DZQXIZWZJLXUOK-UHFFFAOYSA-N 380.879 5.013 30 20 GKED C#CCCCCCC(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 780254963 KNTHBHKIUKBKBN-LBPRGKRZSA-N 381.259 5.231 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1csc(Cl)c1 787186996 WJQFOFLXXLFWLP-ZZXKWVIFSA-N 388.828 5.168 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 796461436 GVIKBBCDSRPVJL-UHFFFAOYSA-N 386.517 5.090 30 20 GKED C#CCCCCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1CCC 797464730 FEXHJYJMXOQTPZ-UHFFFAOYSA-N 379.287 5.134 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)s1 797568194 OVOIVSAUOJQAEM-UWVGGRQHSA-N 397.363 5.245 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C[C@@H](c2ccccc2)C(F)(F)F)s1 797573146 OITKIPJPLOYKFR-KGLIPLIRSA-N 380.435 5.353 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1cc(Cl)sc1Cl)c1nc(C2CC2)cs1 842941268 PDHXXALGAORZSU-SNVBAGLBSA-N 399.324 5.228 30 20 GKED CC[C@H](C)n1ncc(C(=O)N(O)Cc2cc(Cl)cc(Cl)c2)c1C1CC1 901378919 MHHRQLOKCAAPIV-NSHDSACASA-N 382.291 5.070 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(C2CCCCC2)cc1 916904737 CXYPSKGIKXPXDD-SFHVURJKSA-N 380.875 5.349 30 20 GKED Cc1ccc(Cl)c(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917043000 FPBDTKXVEPYYDE-LBPRGKRZSA-N 391.279 5.167 30 20 GKED Cc1c(NN=Cc2ccc(-c3nc4ccccc4s3)o2)cccc1C(=O)O 1776086269 KFSXWRGVCUCGQO-UHFFFAOYSA-N 377.425 5.009 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2cccc(SCc3ccccc3)c2)C1 1776155724 RPBSDZSDCJDFPD-HSZRJFAPSA-N 381.541 5.222 30 20 GKED C=CCCCCCCNc1c(C(=O)O)cnc2c(OC)cc(Cl)c(OC)c12 1776173964 YQLGMUHUDIKORZ-UHFFFAOYSA-N 392.883 5.152 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4ccc(O)c(C(=O)O)c4)o3)coc12 1777449111 YLBSXAOEMXHSAN-RMKNXTFCSA-N 388.375 5.301 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1SCc1ccccc1F 14088247 CGXAMZMBISFRKW-UHFFFAOYSA-N 389.883 5.128 30 20 GKED N#CCc1ccc(NC(=O)c2cc3sc(Nc4ccccc4)nc3s2)cc1 27133298 KHULELQYTUOCAX-UHFFFAOYSA-N 390.493 5.420 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2nc3ccccc3s2)o1)c1nc2ccccc2o1 41546741 KHANDRRLJSSQCC-LBPRGKRZSA-N 385.404 5.188 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nc2ccccc2[nH]1 56562720 BKLHDPNOHBJAFA-HNNXBMFYSA-N 397.438 5.110 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(F)c(C(F)(F)F)c1 64621597 HKESYZXGRYSAAC-UHFFFAOYSA-N 379.275 5.136 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)/C=C\c2cccc(F)c2)cc1 108373874 JPBDCOFUXVZCON-RAXLEYEMSA-N 386.426 5.123 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2scnc2C2CC2)cc1Cl 120445143 GIWDMTLKJULTBF-KRWDZBQOSA-N 393.899 5.582 30 20 GKED CCC(CC)n1nccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 132672664 YYXXTXYHBUDQLM-INIZCTEOSA-N 398.919 5.511 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N(c2ccccn2)C2CCCC2)c1 154634941 LGMXSIHSTNVPEC-UHFFFAOYSA-N 397.478 5.122 30 20 GKED CC(C)(CCC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 155263757 IJTIRXWKUPDLLP-HXUWFJFHSA-N 399.519 5.616 30 20 GKED CCCN(Cc1nnc(-c2ccc(C#N)cc2)o1)[C@H](C)c1cc2ccccc2o1 173562831 XTUJSBGMEYQAAL-MRXNPFEDSA-N 386.455 5.328 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1cccc(OCc2ccccn2)c1 179695385 UUFKVARIOKMLNA-IBGZPJMESA-N 385.511 5.313 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1 184357696 ZOFSCLCUHYKQGA-KSFYIVLOSA-N 389.430 5.028 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)s1 184556737 WCKDTVDCDPQCSC-HNNXBMFYSA-N 377.494 5.357 30 20 GKED Cc1csc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1Br 190928069 YGCGDWXQOFJTSU-LLVKDONJSA-N 395.347 5.466 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)s1 303800062 WPSYAUZHDVSABJ-OAHLLOKOSA-N 376.481 5.082 30 20 GKED CCN(CC1CCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 432034200 WZZLFNGLGBALBY-UHFFFAOYSA-N 379.460 5.013 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)Nc2ccc(OC(C)C)c(C#N)c2)cc1 435543255 KBRLKFPXFCJQPO-OAQYLSRUSA-N 393.487 5.113 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Cl)c1ccccc1 439399802 YOPYYGHESGAGSR-HNNXBMFYSA-N 381.785 5.525 30 20 GKED CCN(C(=O)c1ccc(C#N)c(O)c1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 442966749 KQSAPUUHDTVVED-XMMPIXPASA-N 399.494 5.034 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H]3CCC[C@H]32)cc1 444386287 DLGNMUOSRWIWHS-YLJYHZDGSA-N 391.471 5.156 30 20 GKED CCOc1ccc(Oc2ccc(C(F)(F)F)cc2NC(=O)CCCC#N)cc1 463069823 LVQUNXWVZOWIFM-UHFFFAOYSA-N 392.377 5.529 30 20 GKED COc1ccc([C@H](N[C@@H]2CCC[C@H](C#N)C2)c2ccccc2)cc1Br 463294473 DKXZEFJQDQRZFM-RRMPHLOHSA-N 399.332 5.219 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 463773156 BKOZCMTYNWHQIL-PXAZEXFGSA-N 379.262 5.082 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(F)cc1F 467307459 GDEBZGMMLJYTAW-ZDUSSCGKSA-N 392.496 5.088 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cc1nc(C)c(-c2ccc(Cl)cc2)o1 468273977 FZUGPOOAUGWIGC-UHFFFAOYSA-N 377.875 5.363 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)C2CCC(C(F)(F)F)CC2)cc1 469766348 BTJKZCCHQRFIAA-UHFFFAOYSA-N 386.417 5.210 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 471919699 QAAVFJKQZJNROL-UHFFFAOYSA-N 387.527 5.955 30 20 GKED CCOc1ccc([C@@H](NC(=O)C[C@@H](CC#N)c2ccccc2)c2ccccc2)cc1 474786209 QIFHBZVAASAVIU-BVAGGSTKSA-N 398.506 5.378 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN(CC)CCC)cc1 476128360 AYVSFNZUNSPTIP-UHFFFAOYSA-N 378.560 6.023 30 20 GKED Cc1cc(-c2csc(NC(=O)c3cccc(SCC#N)c3)n2)ccc1F 476684587 FBLNRVVYQGNXRN-UHFFFAOYSA-N 383.473 5.126 30 20 GKED N#Cc1csc(/C=C2/CCn3c2nc2scc(-c4ccccc4)c2c3=O)c1 480325119 IEBBBYDWNHCFGJ-DHDCSXOGSA-N 387.489 5.002 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(C)(C)C#N)cc3)n2)cc1 483450566 MPNILFJESIUYHG-LJQANCHMSA-N 385.492 5.410 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(Cl)c1Br)c1ccccc1 484062385 CJDPMUBNEMZGAR-CYBMUJFWSA-N 377.669 5.129 30 20 GKED CCSc1cccc(F)c1NC(=O)c1ccc(COc2ccccc2C#N)o1 484932094 DOHADOQYYDJATQ-UHFFFAOYSA-N 396.443 5.234 30 20 GKED COc1ccccc1-c1csc(C2CCN(CC#Cc3ccccc3)CC2)n1 485106060 KLQZGXPWLCYLML-UHFFFAOYSA-N 388.536 5.050 30 20 GKED C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 486432525 KVFIBHPMOGPPKY-SECBINFHSA-N 379.275 5.354 30 20 GKED C[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)C(=O)c1ccc(Cl)cc1 487455320 NFEMTOCMFVSXFH-UZLBHIALSA-N 382.891 5.100 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 487547349 ZESKYVKECSCDJW-QFIPXVFZSA-N 390.527 5.516 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1cccs1 489430142 GJCFBEWBHNNUQH-CQSZACIVSA-N 394.525 5.701 30 20 GKED COc1cc(NC(=O)Nc2cccc(OCCCC#N)c2)cc(OC)c1C(C)C 490586491 HIFBPYXKXXITRB-UHFFFAOYSA-N 397.475 5.154 30 20 GKED C=C(C)CN1CCC(NC(=O)N(CC(C)C)[C@@H](C)c2ccccc2Cl)CC1 493788935 NUVQOZMRPZPDIP-SFHVURJKSA-N 391.987 5.109 30 20 GKED Cc1c(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)sc2ccc(C#N)cc12 494996171 HFRBHRHBRYIVPT-UHFFFAOYSA-N 377.252 5.346 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2Cc2ccccc2)c1 502693680 JUFTWYMJPIXTQQ-UHFFFAOYSA-N 385.467 5.604 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)c1cccc(Cl)c1Cl 505321884 ZTLQNKZJJMDIMP-XWIASGKRSA-N 379.209 5.043 30 20 GKED Cc1ccc(N(C(=O)c2ccc(C#N)c(C)n2)c2nc3ccccc3s2)c(C)c1 508590231 SXTAGKUMQZSVSY-UHFFFAOYSA-N 398.491 5.467 30 20 GKED FC(F)Oc1ccc([C@@H](NCc2ccccc2OC(F)F)C(F)(F)F)cc1 510420213 OUTIIZJZMYEIDB-CQSZACIVSA-N 397.290 5.283 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NCC(C)(C)CCC#N)cc1 513107820 IOFNWQYESZXNMV-GOSISDBHSA-N 393.531 5.395 30 20 GKED N#Cc1ccc(CN[C@H]2CCc3c(Br)cccc32)c(C(F)(F)F)c1 516898750 FGFKEXHVZIVYNT-KRWDZBQOSA-N 395.222 5.117 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2ccccc2C(F)(F)F)c1 517099402 ZUSMRMQEQYOJDD-ROUUACIJSA-N 388.389 5.130 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 517168617 GUBSKZRGNHSHGA-KRWDZBQOSA-N 385.467 5.352 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c1C#N 518361538 LKQFFIPABWEBEK-LSDHHAIUSA-N 378.419 5.252 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1CN1CCc2ccccc21)c1ccc(C#N)cc1 518883668 RSMGRCHVONNUOZ-GOSISDBHSA-N 396.494 5.004 30 20 GKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1cccc(C#N)c1 519546080 AYGNWFORTKAJPU-UNEAEHENSA-N 393.962 5.476 30 20 GKED N#CCCN(C(=O)c1ccc(C2CCCCC2)cc1)c1ccc2c(c1)OCCO2 520495899 KHXIBOXTEMUXRE-UHFFFAOYSA-N 390.483 5.066 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 521975928 QFIGXBIWAJZDMY-CYBMUJFWSA-N 398.553 5.433 30 20 GKED C[C@H](C1CC1)N(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)C1CC1 522640150 WDFDHBNMFBWUHM-CQSZACIVSA-N 380.875 5.407 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCCC[C@H]3c3ccco3)cc2)nc1 522947602 NNUFCKKTNQGZDG-FQEVSTJZSA-N 387.439 5.096 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1COc1ccccc1Cl 523283713 XVSCXQPYTJSZGE-OAHLLOKOSA-N 396.874 5.287 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cccc(-c4cscn4)c3)c2C#N)C1 524767437 HTCJAZHSFCUOAD-GFCCVEGCSA-N 379.510 5.120 30 20 GKED CCC(CC)c1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)on1 525033223 XSLBRMMDDSKWCO-UHFFFAOYSA-N 389.455 5.281 30 20 GKED CSc1cccc([C@H](NCc2ccccc2C#N)c2cc(F)ccc2F)c1 525175262 NTALZDBNJOJWEB-QFIPXVFZSA-N 380.463 5.438 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(Cl)cc2O)cc1 534709403 MBLLVBXFXYUGJU-UHFFFAOYSA-N 394.883 5.462 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)Nc3sc(C)c(C)c3C#N)cc2)cc1 535475279 NXDNGYMWBNXGKE-UHFFFAOYSA-N 390.464 5.484 30 20 GKED Cc1cccn2c(NC(=O)c3ccc(C4(C#N)CC4)cc3)c(-c3ccccc3)nc12 538492306 FUPSAFVSOGDEMZ-UHFFFAOYSA-N 392.462 5.117 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(OCc4cccc(F)c4)c3)cc2)CC1 539629626 AMDYPUVVSRVVHX-UHFFFAOYSA-N 386.426 5.212 30 20 GKED O=C(NC[C@H]1CCCC[C@H]1C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 564536459 GUSSBQXHXFXJRU-PSASIEDQSA-N 389.286 5.082 30 20 GKED Cc1ccccc1C1=CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 564680969 JZYRMYVYANOECL-QGZVFWFLSA-N 377.513 5.320 30 20 GKED N#CC[C@H](Cc1nc(-c2ccccc2OCc2ccccc2)no1)c1ccccc1 570550841 KBRSSRRLDDOQQE-OAQYLSRUSA-N 395.462 5.556 30 20 GKED Cc1nc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)ccc1-c1ccccc1 572768969 WJBLKXNMGZHVTC-UHFFFAOYSA-N 384.483 5.371 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc(-c4ccccn4)cc3)o2)cc1 579774868 ZUPAOPJDYYKKFM-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1ccc(C#N)c(F)c1 582055544 SCRQZXLWLFSFBM-CYBMUJFWSA-N 380.448 5.012 30 20 GKED Cc1ccccc1-c1cccc(CNC2(c3cccc(C#N)c3)CCOCC2)c1 594984071 MFEGWGKOJUREBE-UHFFFAOYSA-N 382.507 5.329 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)cc1F 596704061 ZKYWLIOHRYRXEO-INIZCTEOSA-N 397.450 5.093 30 20 GKED C=CCOc1ccccc1CNC(=O)c1ccccc1SCc1ccco1 599819453 NWPCGUGGJFRMRP-UHFFFAOYSA-N 379.481 5.067 30 20 GKED C=CCN(C(=O)c1cccc(C)c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603458938 QOAYEUQHORRLNZ-UHFFFAOYSA-N 393.468 5.168 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCCc1cccs1 603533041 NOGCRVGAHOXVPP-UHFFFAOYSA-N 392.499 5.623 30 20 GKED Cc1csc(Sc2ccc(NC(=O)Cc3ccc(C#N)cc3)cc2Cl)n1 608875149 ZFJRCEQOZYRQHR-UHFFFAOYSA-N 399.928 5.309 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 609501228 AZYGRZOXENZRKJ-ZIAGYGMSSA-N 375.255 5.006 30 20 GKED Cc1cccnc1[C@@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C(C)C 609990694 IYDXOZKLAPPHFD-QFIPXVFZSA-N 384.483 5.132 30 20 GKED CN1CCC[C@H](CNCC(C)(C)CCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1 610271071 OTXFMOPFUBEUPK-MJGOQNOKSA-N 381.486 5.008 30 20 GKED C[C@H](NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 610356651 XFOAGGZVAGNXGU-SBUREZEXSA-N 387.458 5.042 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cc(Br)c(F)cc1Cl 610585177 DHXSYEWDMSBYAU-UHFFFAOYSA-N 390.684 5.035 30 20 GKED Cc1cc(F)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc1F 610706598 SIYYWOYJOCBDMN-UHFFFAOYSA-N 396.368 5.115 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccccc1OC(C)C 612651302 DPHTYJPAYDOATG-OAHLLOKOSA-N 392.952 5.648 30 20 GKED C[C@@H]1CCc2sc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2C1 613392033 BEDHYCNWPQTZQM-CZUORRHYSA-N 378.522 5.486 30 20 GKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cc2cc(Br)ccc2o1 618803210 HMLXJGOTTOMDME-XIKOKIGWSA-N 381.273 5.405 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)ccc1OC(F)F)c1nc2cc(F)ccc2s1 674045309 FETPYNNXMONWGU-NSHDSACASA-N 396.777 5.180 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1 727267994 XYHZMQAAPFUPMY-XGICHPGQSA-N 380.444 5.112 30 20 GKED N#CCOc1cccc(NC(=O)[C@@H](Sc2ccccc2F)c2ccccc2)c1 729947663 YDJTVBAIHJGMSL-NRFANRHFSA-N 392.455 5.200 30 20 GKED COc1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)cc1[N+](=O)[O-] 730149215 CTTWFASMOBJKMF-MDWZMJQESA-N 391.395 5.131 30 20 GKED C/C(=C/C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1cccc(F)c1 731972875 PJZLBQYCXUYGPO-QINSGFPZSA-N 387.414 5.235 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4cccc(F)c4)CC3)n2)cc1 734706356 DZXVTJUHIRRDCP-GOSISDBHSA-N 376.456 5.166 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2OC2CCC2)cc1 735634135 LMUZCGFMMHKTAU-HSZRJFAPSA-N 382.463 5.526 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](Cc2ccccc2)c2sccc2C)c1 736447446 OQDQAKXRMXWPBC-FQEVSTJZSA-N 376.550 5.308 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3ccc(Cl)cc3Cl)c2)s1 739594748 PVYBTXVFDXFAKS-UHFFFAOYSA-N 387.291 5.524 30 20 GKED Cc1ncsc1/C=C\C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1C 743056545 YCMQSGLJAYRHNC-WAYWQWQTSA-N 378.284 5.149 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCc2cccc(OC3CCCC3)c2)n1 747196520 LUZOONWBARTBQT-LJQANCHMSA-N 382.529 5.397 30 20 GKED C=CCC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 749841225 VGCMXBZYQSAJMC-KKSFZXQISA-N 388.433 5.793 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccccc1Nc1ccc(SC(F)F)cc1 751338184 RJHYEGYHQBZWMR-AWEZNQCLSA-N 389.471 5.367 30 20 GKED CC(C)CN(CCC#N)Cc1nc2cc(Cl)ccc2n1Cc1ccccc1 755668512 CRPFFHLMHCLRNG-UHFFFAOYSA-N 380.923 5.110 30 20 GKED N#Cc1cnc(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)s1 759625740 FAVKCVIYSHQCCX-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 765041116 WYOCSQTWXUTOSD-HOTGVXAUSA-N 384.907 5.114 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Br)cc2F)ccc1SC 767738306 SFNYLUGBJPNBNU-XVNBXDOJSA-N 381.266 5.215 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCC3)ccc1NC(=O)OC(C)(C)C 772020705 ZUUZVRZCQLBFLW-UHFFFAOYSA-N 397.500 5.016 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1cccc(Cl)c1F 774071074 DQIVOAMGDGLXNZ-NSHDSACASA-N 390.842 5.382 30 20 GKED C#CCCCCC(=O)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 779062251 UKZSXOJSRHEQNR-OAQYLSRUSA-N 389.417 5.113 30 20 GKED COc1ccc(SCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 781444229 GMRZQXYRXADLCW-INIZCTEOSA-N 382.510 5.054 30 20 GKED N#CCC1CCN(C(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)CC1 782056595 KVAJMNOUYJHCPS-UHFFFAOYSA-N 395.915 5.383 30 20 GKED CC(C)c1ccc(Nc2nn(CN3CCC[C@](C)(C#N)C3)c(=S)s2)cc1 784013464 IRDLKYWXYRZYIV-LJQANCHMSA-N 387.578 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)C1CCOCC1 789457486 UGDMWSWCMWEOBL-HSZRJFAPSA-N 392.543 5.828 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccc(NC(=O)OC)cc1 789460804 VZWHGRIKOYUDAB-UHFFFAOYSA-N 395.503 5.081 30 20 GKED CCCCCCOc1ccc(CC(=O)[C@@H](C#N)c2cnc3ccccc3n2)cc1 792107136 BFLUPSCCEFLYLI-FQEVSTJZSA-N 387.483 5.008 30 20 GKED N#C[C@@H](C(=O)C1CC(c2ccc(F)cc2)C1)c1nc(-c2ccccc2)cs1 796757283 VDMWAEVFSNOVGH-TVPLGVNVSA-N 376.456 5.319 30 20 GKED C#C[C@H](NC(=O)c1ccccc1SCc1cscn1)c1ccc(Cl)cc1 811947958 UFVGDFKBPJDMJN-SFHVURJKSA-N 398.940 5.193 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2c(C)cccc2C(C)C)cs1 812233030 QHEGKYRPFGEPPX-UHFFFAOYSA-N 392.528 5.706 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccccc2C)C2CCCC2)ccc1OC 813860259 PSPYUGLMONLEOJ-SQJMNOBHSA-N 392.543 5.706 30 20 GKED Cc1ccc(CC2CCN(C(=O)c3ccccc3SCC#N)CC2)cc1C 816785573 OFZKFWDTVVRSSL-UHFFFAOYSA-N 378.541 5.014 30 20 GKED O=C1/C(=C\c2ccc3ncccc3c2)CCOc2cc(Br)ccc21 818470098 HEYOCKSNIJUPRM-PTNGSMBKSA-N 380.241 5.046 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1nc2cc(C(F)(F)F)ccc2s1 860478306 VCMZULOFHUTWLP-MJSCVDMRSA-N 398.409 5.077 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086572 LITIYEKKUDLPRH-QHCPKHFHSA-N 395.437 5.590 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2c(s1)CCCCC2 916915870 QRZMAFDQFLWKPT-GOSISDBHSA-N 388.492 5.131 30 20 GKED CC(C)c1cccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 917574024 APPRANGZBFQEPI-HSZRJFAPSA-N 385.536 6.274 30 20 GKED CCCCOc1ccc(/C=C2/SC(=S)N(c3ccccc3C#N)C2=O)cc1 917645049 SBFHDCGRWLVMEK-CPNJWEJPSA-N 394.521 5.143 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 921006070 PGPFOUBSZAIVOL-PBOSXPJTSA-N 399.350 5.030 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ncc(Cl)cc3Cl)s2)cc1 1776022202 ZAPVIQFOKFAOJV-UHFFFAOYSA-N 392.267 5.261 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 1776154587 MFQGWAFRPVBRSL-IFMALSPDSA-N 387.882 5.311 30 20 GKED CC(C)(C#N)c1ccc(/C=C(\CC(=O)O)c2nc3cc(Cl)ccc3s2)cc1 1776230932 QHHCIRGHLHDVKW-NTEUORMPSA-N 396.899 5.766 30 20 GKED CC(C)CCOc1ccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)cc1 1776326948 HJGLWGHHEITYHC-VGOFMYFVSA-N 396.483 5.251 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C(C)C)c([N+](=O)[O-])c1 1776354432 HQXKMMCARARPCY-TWGQIWQCSA-N 397.427 5.100 30 20 GKED COc1c(C)cc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1Cl 1777252671 TWAZCINQXABXOZ-VQHVLOKHSA-N 396.826 5.511 30 20 GKED N#Cc1c(NC(=O)c2sc3ccccc3c2Cl)sc2c1CCCCC2 6341824 XQDOYVIGZWRESU-UHFFFAOYSA-N 386.929 6.009 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1OCCC(C)C 60477213 DDDPIUWRQIWLCA-INIZCTEOSA-N 394.496 5.220 30 20 GKED Cc1[nH]c2ccc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc2c1C 66544838 XKKDTAOXLRSKLV-IBGZPJMESA-N 396.475 5.270 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c1 72087103 ZJFZQTMLEFMCGI-QGZVFWFLSA-N 386.451 5.097 30 20 GKED C=CCN(CCc1ccccc1)CC(=O)Nc1ccc(Cl)cc1C(F)(F)F 109356718 SXMSPSWCCKFGIT-UHFFFAOYSA-N 396.840 5.028 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCOc2ccccc21)c1nc2cc(Cl)ccc2s1 118143507 VAYSCTBIIZZKFX-IUODEOHRSA-N 382.872 5.082 30 20 GKED C[C@@H](Sc1nnc(-c2ccccc2Br)o1)c1ccc(C#N)cc1 118172838 JGIPBDWGBRGBBT-LLVKDONJSA-N 386.274 5.224 30 20 GKED Cc1ccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)ccc2n1 120038074 ZABQPAWHIXLLRS-IBGZPJMESA-N 394.459 5.028 30 20 GKED N#C[C@H](C(=O)c1coc(-c2ccccc2)n1)c1nc2cc(Cl)ccc2s1 121845935 CJCFODOAPWVMOD-CYBMUJFWSA-N 379.828 5.095 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 124025871 LCNQDDOUJXUGME-RXVVDRJESA-N 398.462 5.238 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3nccnc3c2)cc1Cl 129772329 VRJPXKUDVIEGCC-IBGZPJMESA-N 398.853 5.191 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c2)n1 151832715 JJTRXAPJBSVJDY-AWEZNQCLSA-N 393.537 5.623 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 155692525 ACKXZJJERSWFMN-CQSZACIVSA-N 388.279 5.363 30 20 GKED Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 172883362 OBSNANZRVMZOFD-UHFFFAOYSA-N 387.395 5.128 30 20 GKED N#CC1CCN(C(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 172919866 UOIVYYGWEMVQFD-UHFFFAOYSA-N 375.255 5.161 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)C(=O)c1cccc(F)c1 174730079 JZWXNXQOLLNMGV-HUUCEWRRSA-N 384.476 5.068 30 20 GKED C[C@@H]1CCN(C(=O)c2cc(C#N)cs2)c2cc(C(F)(F)F)ccc2S1 176951893 VKRRMIPZSADCPY-SNVBAGLBSA-N 382.432 5.170 30 20 GKED Cc1cc(CSc2ccccc2C(=O)[C@H](C#N)c2nc(C(C)C)cs2)on1 177753845 OHUAMWUWYKOUPH-INIZCTEOSA-N 397.525 5.345 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@@H](c3cccc(Cl)c3)C3CCCC3)o2)cc1 181035906 SZQBBSSIACVSOG-OAQYLSRUSA-N 392.890 5.283 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(CNC(=O)OC(C)(C)C)c1 188066184 JUCJAJFJOCODLI-UHFFFAOYSA-N 398.503 5.409 30 20 GKED Cc1csc(CCCCNCc2cccc(OCc3cccc(C#N)c3)c2)n1 237634244 JWXNASPZANJJDZ-UHFFFAOYSA-N 391.540 5.015 30 20 GKED C=CCOc1ccc(C(=O)N(Cc2cccs2)Cc2cccs2)cc1OC 302897439 LXGMULMKGFGASU-UHFFFAOYSA-N 399.537 5.226 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1 303567577 BBUSHMSRAWDIQD-UHFFFAOYSA-N 395.462 5.191 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(CC(F)(F)F)cc3)c2)cc1 303845762 JENQXJBWJRGWTP-UHFFFAOYSA-N 396.368 5.708 30 20 GKED O=S1(=O)CC[C@H](/N=C(/O)C2(C3CCCCC3)CCCCC2)c2ccccc21 329925708 VPPOHQHKXOVTRD-IBGZPJMESA-N 389.561 5.392 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cnccc1C(C)(C)C 416804475 DAJZORMUBPTHNZ-HNNXBMFYSA-N 382.533 5.095 30 20 GKED COCCCOc1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 431214048 QVLNRIIWOSGVFT-INIZCTEOSA-N 399.516 5.140 30 20 GKED Cc1c([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 431857346 LGPIASYNIULPAB-FXAWDEMLSA-N 375.472 5.537 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Cl)c1ccccc1 433135499 UVIPWKVVPMBSAB-MRXNPFEDSA-N 395.812 5.915 30 20 GKED CSc1ccc(CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 436342739 VHTNPGHENDHEIV-OAHLLOKOSA-N 385.558 5.167 30 20 GKED CCOc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1Cl 437756856 IWWGXPIUROHMKR-PKOBYXMFSA-N 383.879 5.042 30 20 GKED CN(Cc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1Oc1ccccc1 439948145 XXAWLHPCZKPKBO-UHFFFAOYSA-N 382.423 5.037 30 20 GKED Cc1sc(Br)c(C(=O)[C@H](C#N)c2nc3ccccc3s2)c1C 442024519 DFABAWXMLSMHFN-JTQLQIEISA-N 391.315 5.227 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)c2cccc(SCC#N)c2)c1 442416896 HGIMQTDFMPNBLD-UHFFFAOYSA-N 388.492 5.442 30 20 GKED O=C(c1ccccc1CCC(F)(F)F)N(CCC(F)(F)F)CC(F)(F)F 448061684 XLQHQYSTAFBZOT-UHFFFAOYSA-N 395.265 5.138 30 20 GKED CC[C@H](CC(F)F)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 457799558 VYTPSXZMTHPMBL-SNVBAGLBSA-N 391.302 5.364 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(Cc2cccc(F)c2)CC1)c1ccccc1 458806185 VTBOBBKDQOKQDY-QHCPKHFHSA-N 393.506 5.225 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)NCC(C)(C)CC#N)s2)cc1 459256400 IGADSXMQLFDNSO-INIZCTEOSA-N 384.549 5.069 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccsc2)nc1C 461708626 OPVREESIPFNGKN-UHFFFAOYSA-N 376.485 5.064 30 20 GKED N#C[C@@H](NC(=O)c1nc2ccccc2cc1Cl)c1c(Cl)cccc1Cl 464398160 NZDGGHJCIKWPAT-OAHLLOKOSA-N 390.657 5.190 30 20 GKED O=C(c1ccc(-c2ccc(F)cc2)o1)N(CCC(F)(F)F)CC(F)(F)F 468523253 LFZKJYQUUJRZBF-UHFFFAOYSA-N 383.263 5.043 30 20 GKED CCC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(OC)cc1 469203711 ZTYXZFHZEHJCCK-QFIPXVFZSA-N 391.515 5.231 30 20 GKED COc1ccc(/C=C/c2ccc3cc([N+](=O)[O-])ccc3n2)cc1OCCCC#N 471466414 GDSNVWCXXTXTMB-QPJJXVBHSA-N 389.411 5.005 30 20 GKED Cc1cccc(C)c1Oc1ccccc1NCc1nnc(-c2ccc(C#N)cc2)o1 471616794 CQOYKHOBZSRIGS-UHFFFAOYSA-N 396.450 5.630 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1 475577871 JCOUSUHGGIBUSO-HNNXBMFYSA-N 385.577 6.175 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)nc2c1cnn2[C@@H](C)CC 476082618 YVVGCCWQBNYBDK-KRWDZBQOSA-N 390.531 5.815 30 20 GKED CC1(c2cccc(Cl)c2)CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)CC1 478467366 YOQSRCWSRCWFDQ-UHFFFAOYSA-N 378.903 5.089 30 20 GKED C=C(C)[C@H](NC(=O)CCCc1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 478919320 LRKYDVMMQRNSGN-QHCPKHFHSA-N 396.437 5.376 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1nccc2ccccc12 483187959 AEOADNXDIXNVBV-CYBMUJFWSA-N 395.896 5.563 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)C1 483625876 OXKCMJXIIQQAQA-XMSQKQJNSA-N 396.918 5.340 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 485383288 LDMCHYNJTVDCIW-HRAATJIYSA-N 381.545 5.766 30 20 GKED C=CCC[C@H](NC(=O)NCc1oc(CC)nc1C)c1ccc(C(F)(F)F)cc1 489759706 YLARDTPXAWHEPX-INIZCTEOSA-N 395.425 5.071 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 495107788 APGBPWMJWDPWNK-UHFFFAOYSA-N 381.435 5.104 30 20 GKED N#C[C@@H](NC(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccccc1Cl 499924527 UFBITTHLLPXSEN-QGZVFWFLSA-N 381.690 5.351 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N[C@H](C#N)c2ccccc2Cl)C1 501728254 UBWUVTGNBMDQAL-FUHIMQAGSA-N 376.928 5.177 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc2c(cc1Cl)OCCO2 501756938 TUDSJJOWIGNQPH-UHFFFAOYSA-N 399.299 5.046 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 509607705 IWHLPFBPSZVHAW-HZPDHXFCSA-N 388.389 5.106 30 20 GKED Cc1ccc2oc(C(=O)N(Cc3ccc(C#N)cc3)c3ccc(F)cc3C)cc2n1 511540279 GPPJCDDLQYZGSF-UHFFFAOYSA-N 399.425 5.302 30 20 GKED Cc1sc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c(C#N)c1C 514348233 OLKUCQHMHOTYAZ-UHFFFAOYSA-N 392.440 5.141 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517905390 AKOYOWQLMXBPAD-UHFFFAOYSA-N 391.858 5.668 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(Cl)cc1)C1CC1 521259537 OUBYSORQLLQIHH-HNNXBMFYSA-N 399.947 5.788 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@@H]1CCC[C@H](C)C1 522151484 XJUXYHRTZSVYAN-HTAPYJJXSA-N 394.490 5.134 30 20 GKED C=CCN(C(=O)C1CCCCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 523183986 BLHSNYHSMFURKV-UHFFFAOYSA-N 385.489 5.208 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2cc(C#N)cs2)nc1-c1ccccc1 531457968 MAZHSJKQPCDJJT-QGZVFWFLSA-N 391.496 5.375 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 532206764 YWAFTFVGIXEJIC-CABCVRRESA-N 377.469 5.607 30 20 GKED N#CCc1ccc(C(=O)Nc2cc(Cl)ccc2NCc2ccccc2)cc1 534725189 KFWYGDAQSMCTNB-UHFFFAOYSA-N 375.859 5.270 30 20 GKED C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)c1ccc(CC#N)cc1 535501599 NJIUPWYEWJCLHG-CYBMUJFWSA-N 399.281 5.118 30 20 GKED N#CCCCCNC(=O)N[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 537873827 BNLYARLEGKOHCJ-FUHWJXTLSA-N 381.442 5.115 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)c(F)c1 538509841 VTTDETHCQCUBTH-STQMWFEESA-N 399.922 6.195 30 20 GKED N#Cc1cccc(CNCc2ccc(Oc3ccccc3C(F)(F)F)nc2)c1 539500333 BHCRYGAYIOWNQG-UHFFFAOYSA-N 383.373 5.054 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccn(Cc2ccccc2)c1 541007202 RCPDEJQMLRYEPN-QGZVFWFLSA-N 375.497 5.183 30 20 GKED C[C@H](NC(=O)Cc1c[nH]c2ccccc12)c1ccc(-c2cccc(C#N)c2)cc1 541072442 BFNRBYYZCSMOIQ-KRWDZBQOSA-N 379.463 5.126 30 20 GKED C=C(C)COc1cccc(N[C@@H](C)CC(=O)Nc2ccccc2C(F)(F)F)c1 542139225 XTGBQBQRTBZKTO-HNNXBMFYSA-N 392.421 5.490 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(SC3CC3)cc2)cc1 542167416 OAWRVWBYAWULDG-UHFFFAOYSA-N 390.430 5.017 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 554860903 RZNWYYXNDYTQQY-QGZVFWFLSA-N 382.426 5.228 30 20 GKED COC(=O)c1ccccc1-c1ccc(CN[C@H](CCCC#N)c2ccccc2)o1 556907029 FMDJWFDQKGESAY-JOCHJYFZSA-N 388.467 5.258 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 558805885 RHLGLTWMRYBQBZ-SJORKVTESA-N 394.540 5.662 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 560738392 RPGXQVDERCDJLI-OAQYLSRUSA-N 375.516 5.402 30 20 GKED CC(C)(C#N)CCCCSc1nc(-c2ccc(Br)cc2)n[nH]1 570150736 KOADHBOFTQHERG-UHFFFAOYSA-N 379.327 5.046 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCCCN1Cc1ccc(C#N)cc1C(F)(F)F 573497113 WXGIGMOSTQPAJV-SFHVURJKSA-N 376.426 5.034 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2ccccc2F)CC1)c1ccccc1 576562419 DEWNTWBZAQCXPH-QFIPXVFZSA-N 379.479 5.150 30 20 GKED Cc1cccc2sc(N(Cc3ccccc3)C(=O)CCCCCC#N)nc12 588815628 IRDJQJLEXIDPPU-UHFFFAOYSA-N 377.513 5.612 30 20 GKED CCN(C(=O)CCCCC#N)[C@H](c1cccnc1)c1csc2ccccc12 593972353 AIRYDNRVOJGJAY-JOCHJYFZSA-N 377.513 5.318 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)C1 597915070 BSCMITPSAOFAER-HNNXBMFYSA-N 388.389 5.264 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3ccc(Cl)cc3Cl)cn2)cc1 603765318 VQZAITQYSPTKIG-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@@H]2C2CCCCC2)ccc1OCC(F)(F)F 603827941 DYTZGYJMPUCVGA-QGZVFWFLSA-N 395.425 5.076 30 20 GKED C=CCN(CC=C)C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1 605213081 CIJHNPPNERPWIG-UHFFFAOYSA-N 379.291 5.002 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc(-c4ccccc4)cn3)o2)cc1 609071760 ZHUCKLDPCHGOHH-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccc(C(F)(F)F)c1 609081000 CIKBFEZRMLMCQU-SNVBAGLBSA-N 399.319 5.061 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)CCCCOc1cccc(C#N)c1 609503579 YOQQPHKNKJGRBZ-UHFFFAOYSA-N 398.506 5.433 30 20 GKED COc1ccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1Cl 609643021 ZGNLAGZFRIBXKG-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C[C@H](SCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccc(C#N)cc1 609825235 LWLXYPACXGBNLE-LBPRGKRZSA-N 389.402 5.621 30 20 GKED N#CC1(NC(=O)c2cccc(CSc3cc(Cl)ccc3Cl)c2)CC1 609990578 YFDIDHFEFWMLNY-UHFFFAOYSA-N 377.296 5.072 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3F)cn2)cc1 618808338 SMGCDWUBFAVEHP-UHFFFAOYSA-N 398.397 5.132 30 20 GKED Cc1nc(NC(=O)C[C@H](CC#N)c2ccccc2)sc1Cc1ccccc1 619429931 YFDWBCGZTXELKQ-IBGZPJMESA-N 375.497 5.068 30 20 GKED C[C@H](CC(=O)NCc1ccc(C#N)c(Cl)c1)c1ccc(C(F)(F)F)cc1 619767253 GIYFAEINLIZMCG-GFCCVEGCSA-N 380.797 5.040 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622842154 FDXGFWBQTPSPPK-JOYOIKCWSA-N 389.286 5.144 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)s2)CC/C1=C\c1cccc([N+](=O)[O-])c1 727264395 QKKQJOPNUVWSJC-JAFZKPNWSA-N 388.448 5.548 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1Cl 727627481 GQORCZOJEJTHRE-VWILAXROSA-N 378.884 5.743 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccc(OC)c3OC)s2)cc1 727973879 BCRQOYZDHWPPKP-JLHYYAGUSA-N 395.480 5.040 30 20 GKED Cc1csc(Nc2cccc(NC(=O)c3ccccc3SCC#N)c2)n1 729334901 QNIJMIPDZBSRQU-UHFFFAOYSA-N 380.498 5.063 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)F)cc1)c1nc2cc(F)ccc2s1 730417004 JOKLYIZYHIFIAM-LBPRGKRZSA-N 378.400 5.240 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1csc2ccccc12 731400054 KQYRQHIMPGWCCW-GJZGRUSLSA-N 395.553 6.178 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3ccc(N4CCCC4=O)cc3)s2)cc1 734306411 OGWTUYREPDJPMT-OUKQBFOZSA-N 388.492 5.141 30 20 GKED C[C@H](C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1)c1ccsc1 738831024 NZKGNYSEQRQFEK-SFHVURJKSA-N 375.493 5.295 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nccs1 740435955 XXTCPIYJNOWCEX-UGKGYDQZSA-N 390.512 5.245 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(SCC(F)(F)F)cc1 741761549 NSMSEBZBLQKRHG-UHFFFAOYSA-N 396.438 5.334 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)s1 742650685 BNCLJRQTBHMOAF-WBTMPAOCSA-N 394.327 5.142 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)c2ccc(Cl)s2)cc1 750683834 IPULSONCIQDUID-XJKSGUPXSA-N 388.920 5.195 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)/C=C\c2ccsc2)cc1 750842224 FRYWIQWSVKRJSJ-OQFOIZHKSA-N 376.437 5.073 30 20 GKED CCOC(=O)Nc1ccc(NC(=S)Nc2ccc(C(C)C)cc2)cc1C#N 752766419 YINSIVUCALQARQ-UHFFFAOYSA-N 382.489 5.059 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(C)nc3ccccc23)cc1 760182823 IIEPRQXAHWHQDU-YCRPNKLZSA-N 385.467 5.018 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(Br)c1)c1ccc2ccccc2n1 761009134 BRZPGMALOXANAI-SFHVURJKSA-N 393.284 5.196 30 20 GKED C[C@H](N[C@H](C)CCc1ccc(Br)cc1)c1ccc(OCC#N)cc1 776154471 CEFCKTMMXFMCFT-CVEARBPZSA-N 387.321 5.023 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2cc3ccccc3c(Cl)n2)cc1 776389712 PAIZGBRETLVLET-UHFFFAOYSA-N 394.858 5.150 30 20 GKED C[C@@H](Nc1cccc(COCCc2ccccc2)c1)c1ccc(OCC#N)cc1 776887049 SHUXKFFOJZETOF-HXUWFJFHSA-N 386.495 5.521 30 20 GKED C[C@H](Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cncc(F)c1 777691997 IOWNUVQSENYXNS-VIFPVBQESA-N 382.279 5.354 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1ccc(SCC(F)F)cc1 788356632 ULHROSQGQIPPPH-WAYWQWQTSA-N 379.375 5.415 30 20 GKED COc1cc(OC2CC2)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 790292187 HYTORHFVPPUWNF-QHCPKHFHSA-N 398.462 5.144 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3ccccc3OC(F)F)cs2)cc1 797029329 ZNFDMDCDZRFLCQ-FLIBITNWSA-N 387.407 5.316 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1F 814578309 YAJRIJLQVKOFCS-FQEVSTJZSA-N 387.458 5.538 30 20 GKED COc1ccc2cc(/C=C\C(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2c1 817314138 OXXQFWOKUFOXNU-XIIDQYHESA-N 384.479 5.413 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 842945427 QRXSYOTVCZPDRO-KRWDZBQOSA-N 380.513 5.195 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915085666 DNRKARGIGZEDBP-DEOSSOPVSA-N 392.458 5.756 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)cc1 916948194 DWHAZBZNCHVDQD-ACJLOTCBSA-N 394.858 5.561 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047300 WMRQJYWLZAQSJK-DOMZBBRYSA-N 386.929 5.448 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cc(-c3ccccc3)cs2)S1 917516254 QNJVTDIODGCZJB-UNOMPAQXSA-N 390.533 5.924 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CSc1ccc(C(C)C)cc1 920105526 HMLYDYNUGRSMFT-IBGZPJMESA-N 390.508 5.284 30 20 GKED CC(C)N(C(=O)CCc1ccc(C#N)cc1)c1ccc(Nc2ccccc2)cc1 920223120 COXXZMDISOCLLL-UHFFFAOYSA-N 383.495 5.676 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804238 MQTBBJKTAXTIAR-ZFWWWQNUSA-N 382.435 5.458 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc(CCC(F)(F)F)s1 932392199 BZOICUFSWLQTDJ-LLVKDONJSA-N 399.463 5.285 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccccc1Oc1cccc(Cl)c1 1776076540 UBCYXYAIRKPPNN-UHFFFAOYSA-N 398.821 5.806 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2ccc(F)c(Cl)c2)c1 1776097935 LPZMVFMZOMOXOB-UHFFFAOYSA-N 398.821 5.202 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2ccc(F)cc2Cl)c1 1776106340 AOZWBYKAJCKCFT-UHFFFAOYSA-N 398.821 5.202 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc2cccnc12 1777420915 NNNKOMZDMCISAD-WTKPLQERSA-N 383.403 5.398 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)CCC2)cc1 1791587936 VZXZTJZCVQTVQE-STZQEDGTSA-N 394.559 5.303 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(Cl)cc3)n2)nnc1-c1ccco1 23202228 JGPZQJXJWAWOQP-UHFFFAOYSA-N 398.875 5.325 30 20 GKED Cc1nc(-c2ccc(N[C@@H](C)C(=O)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 28912669 SQXOGCQVYRTOBK-LBPRGKRZSA-N 396.903 5.083 30 20 GKED C[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(C#N)cc1 31436050 YVALLYFKDFBALA-SNVBAGLBSA-N 375.280 5.571 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1cccc(O)c1 56800427 WDVVQWHAZKEJJA-UHFFFAOYSA-N 387.439 5.029 30 20 GKED C=CCN(CCc1ccccc1)Cc1csc(-c2cccc(OC)c2OC)n1 62364199 LRJQGGJWNBCJEK-UHFFFAOYSA-N 394.540 5.058 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nccs2)cc1 66158338 IQZMBICMAPASHJ-UHFFFAOYSA-N 376.485 5.124 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Cl)c(Cl)c3)n2)cc1 66545036 CFFPFYWSMOBRKL-CQSZACIVSA-N 398.274 5.479 30 20 GKED COc1ccc(S[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66800282 SUTNIMKPKGPVBZ-GJZGRUSLSA-N 386.542 5.209 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)c2cccnc12 108237439 XJNICJRQGYHCQS-CYBMUJFWSA-N 381.888 5.392 30 20 GKED COCc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 108242406 QVQQPXHISFJTHT-UHFFFAOYSA-N 394.418 5.110 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccoc2)n1)c1nc(-c2ccccc2)cs1 108624710 FPMIETFHFVMEMC-AWEZNQCLSA-N 377.450 5.017 30 20 GKED CC(C)(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 114620307 FRLPBCMYWLYZNU-LJQANCHMSA-N 389.524 5.312 30 20 GKED CSC[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 122953388 HCPIGKKPYNVFCE-KRWDZBQOSA-N 381.501 5.018 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 153991505 XGMIWRYGDJMYNX-JOCHJYFZSA-N 386.455 5.361 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1nc(C(F)(F)F)cs1)c1ccccc1 160484025 ZZGGZVFTFRKSAQ-AWEZNQCLSA-N 383.439 5.011 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](Cc2ccccc2)C1 173116744 WJYFTQWTKZTRKG-PKOBYXMFSA-N 379.529 5.035 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1C 173122706 JPJGLQBGCOSUBN-UTKZUKDTSA-N 393.556 6.067 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3ccc(Cl)c(Cl)c3)C3CC3)o2)cc1 173550713 QBTLHABDMDSUET-UHFFFAOYSA-N 399.281 5.080 30 20 GKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 214123426 ZXFSJUIFHDZIAG-BAQGIRSFSA-N 385.725 5.085 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC)c1nnc2n1CCCCC2 276362551 AVBHNRIPPFPLJQ-LJQANCHMSA-N 395.551 5.129 30 20 GKED CCN(C(=O)CSc1ccc(C#N)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 303207284 QCZKFSIWQAKIJR-AWEZNQCLSA-N 392.446 5.279 30 20 GKED C[C@@]1(/N=C(/O)C2CCN(c3nc4ccccc4o3)CC2)CCCc2ccccc21 328636242 ACOKUMYANXAUAV-XMMPIXPASA-N 389.499 5.252 30 20 GKED O/C(CCc1nc(C2CCCC2)no1)=N/[C@@H]1COc2c1ccc(Cl)c2Cl 330001293 XTWPYJKTHJJKOB-CYBMUJFWSA-N 396.274 5.057 30 20 GKED COc1ccc(Cl)cc1C1(c2noc(C[C@H](CC#N)c3ccccc3)n2)CC1 420513424 JYMTVXHNYWXMHS-INIZCTEOSA-N 393.874 5.051 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)Nc2ccccc2C(F)F)CC1 425689410 CFHHBFMBCRSIFI-UHFFFAOYSA-N 385.414 5.008 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC2(CCC2)C[C@@H]1C 433496763 GYIQXPLTHPUXFP-KRWDZBQOSA-N 375.472 5.455 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1cccc(OC(F)F)c1 435913204 HNCRRCFFXVSZDJ-OAHLLOKOSA-N 397.425 5.037 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(F)c(O)c(Cl)c3)cc2)c1 436994193 KYXNHNITZWZMDV-UHFFFAOYSA-N 382.778 5.101 30 20 GKED N#CCCN(C(=O)c1ccc(C(F)(F)F)c(F)c1)C12CC3CC(CC(C3)C1)C2 438942496 KNEQKQYAWFEPCL-UHFFFAOYSA-N 394.412 5.169 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ncc(-c2ccccc2)o1 439574173 QTGPQZLNHZTNLJ-QGZVFWFLSA-N 381.435 6.179 30 20 GKED C=CCn1c(SCc2nc(C(F)(F)F)cs2)nnc1-c1ccc(C)cc1 443453538 KTPRPRBWGZISCK-UHFFFAOYSA-N 396.463 5.207 30 20 GKED Cc1cc(O)ccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 443567863 CYGVOHNQTWGHRI-IBGZPJMESA-N 391.858 5.654 30 20 GKED Cc1cc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)ccc1C#N 443972332 MBWKJURNXMEQDF-UHFFFAOYSA-N 392.506 5.068 30 20 GKED CC(C)(C)OCc1cccc(CNC(=O)Nc2ccc(CC#N)cc2Cl)c1 455709930 VWGFKLBLUJJSPY-UHFFFAOYSA-N 385.895 5.043 30 20 GKED COc1ccc(C2CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)cc1 465379906 USBZKBNGZQENFG-UHFFFAOYSA-N 396.490 5.254 30 20 GKED N#CCCCCNC(=O)NCc1ccc(Oc2cccc(Cl)c2Cl)cc1 465890650 NOHBKCDCSSYGQL-UHFFFAOYSA-N 392.286 5.279 30 20 GKED C[C@H](C#N)CN(C)C(=O)NCc1ccc(Oc2cccc(Cl)c2Cl)cc1 465963423 AZCYQTQKJTZSOQ-CYBMUJFWSA-N 392.286 5.087 30 20 GKED N#Cc1ccc(CSCc2nc(-c3ccc(N4CCCCC4)cc3)no2)cc1 467252450 ZIFKNCREFWRGDB-UHFFFAOYSA-N 390.512 5.032 30 20 GKED C=CCC[C@H](NC(=O)NCC1(C(F)F)CC1)c1ccc(C(F)(F)F)cc1 472122060 KTVJFAHLBLGJLB-AWEZNQCLSA-N 376.369 5.057 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccnn1Cc1cccc2ccccc12)c1ccccc1 475524574 BEDTYVMIEMUFIV-NRFANRHFSA-N 394.478 5.111 30 20 GKED COc1ccc([C@@H](NCc2ccc(Cl)cc2C#N)c2ccccc2OC)cc1 478362161 OVKRFKKKXLPADG-HSZRJFAPSA-N 392.886 5.108 30 20 GKED Cc1cccc(-c2cccc(CNCc3cn(C)nc3-c3ccc(C#N)cc3)c2)c1 479980137 NDTADBNFVYLWRM-UHFFFAOYSA-N 392.506 5.224 30 20 GKED COc1ccccc1CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480377170 KHHPNBMHWVFIMK-UHFFFAOYSA-N 387.439 5.023 30 20 GKED CO[C@@H](c1ccccc1Cl)[C@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 480474737 DFNLMBCABQEPDB-IFXJQAMLSA-N 385.895 5.039 30 20 GKED CC(C)CN(Cc1cccc(OCCCC#N)c1)[C@H]1CCCc2cccnc21 482267047 HTBBSYOLBAALQF-QHCPKHFHSA-N 377.532 5.300 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 485520499 VCNUSWWBGZYILD-IBGZPJMESA-N 381.545 5.084 30 20 GKED N#CCCN(C(=O)c1cc(C2CC2)nc2ccccc12)C12CC3CC(CC(C3)C1)C2 486553328 ZIDSBUUOAOHFGQ-UHFFFAOYSA-N 399.538 5.437 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CC(F)(F)F)C1CCC1 488666223 OFZPYUVDTXFTIS-UHFFFAOYSA-N 393.249 5.281 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C)c1ccccc1 488709300 BOOOXLVBNBWWDR-GCJKJVERSA-N 390.527 5.166 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2cccc(CC#N)c2)C(C)C)s1 498425214 KQSYFDUKJNZIQX-UHFFFAOYSA-N 388.536 5.840 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 499815440 SRWDMFSMCPGUJF-ZOBUZTSGSA-N 379.674 5.131 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCCc1cccs1 500743004 KMGBLWKMWCEEOQ-UHFFFAOYSA-N 376.481 5.682 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cc2ccccc2s1 504463273 WWBVOVGNIICHOT-MRXNPFEDSA-N 377.513 5.456 30 20 GKED Cc1ccc(C)c(Sc2ccc(NC(=O)N3CCC(C)(C#N)CC3)cc2)c1 506294051 VTQQVBMXEFBJMX-UHFFFAOYSA-N 379.529 5.612 30 20 GKED CC[C@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)c1ccc(OC)cc1 507578755 RGFLTALVTZLYCM-GOSISDBHSA-N 388.467 5.277 30 20 GKED CCCOc1ccc(-c2nc(C(=O)N(CC)c3ccc(C#N)cc3)cs2)cc1 510364615 WYVFBNFZDUINPL-UHFFFAOYSA-N 391.496 5.137 30 20 GKED Cc1cccc([C@H](NCc2ccc(C#N)cc2Br)C(F)(F)F)c1 510470746 JEMQFFROQIHVHG-INIZCTEOSA-N 383.211 5.022 30 20 GKED COc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc(OC)c1C(C)C 511034039 ZLYQLVGJNOPXBU-OAHLLOKOSA-N 398.528 5.331 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1cccc(Br)c1)C(C)C 513865336 DVZFHZASSMHERY-UHFFFAOYSA-N 386.293 5.072 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)cnn1C1CCCCC1 514829210 MZBIDVIEJCDXAQ-ZDUSSCGKSA-N 382.533 5.007 30 20 GKED Cc1ccc(-c2noc(CNc3cccc(Oc4ccc(C#N)cc4)c3)n2)cc1 517156899 TUPMQKWCTQKVAE-UHFFFAOYSA-N 382.423 5.321 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCC[C@@H]1c1ccccc1 519062658 VEPOZPSDNZRKLQ-DHIUTWEWSA-N 375.516 5.205 30 20 GKED N#C[C@@H](NC(=O)CSc1ccccc1Cl)c1c(Cl)cccc1Cl 519305503 WFVMUNTXYHDGKV-CYBMUJFWSA-N 385.703 5.120 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CN(Cc1ccc(C#N)cc1)CC(C)C 520174119 UPCPOXQBSCDWFR-UHFFFAOYSA-N 377.532 5.087 30 20 GKED N#C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 521016258 VNGFOOUDKHMMQS-OAHLLOKOSA-N 385.703 5.120 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@@H](c1ccc(Cl)cc1)c1ccsc1 522408557 GIDBMOFHNKXEQP-INIZCTEOSA-N 393.821 5.888 30 20 GKED CC(C)Cc1ccc([C@H](NC(=O)N(C)Cc2cccc(C#N)c2)C2CC2)cc1 523940340 HWCRDZWMCVURFT-QHCPKHFHSA-N 375.516 5.049 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(C#N)c(F)c2)c2ccc(F)cc2)cc1 537405630 RDLBEXPWGCERCN-CMJOXMDJSA-N 378.422 5.285 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@H](c3nc4c(s3)CCCC4)C2)c1 537660740 ISGQKNWCYLJOQE-IBGZPJMESA-N 395.572 5.084 30 20 GKED N#Cc1cccc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)c1F 538146732 CYBIAKSYAYTPOB-UHFFFAOYSA-N 389.459 5.064 30 20 GKED C[C@H](NC(=O)Nc1scnc1C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 542960065 LCHLIMRDUYCGSD-AWEZNQCLSA-N 388.496 5.442 30 20 GKED COCCCCc1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 547096672 GZNZGCHHAHTKQL-UHFFFAOYSA-N 383.835 5.023 30 20 GKED Cc1sc(C2(NCc3cc(C#N)ccc3F)CCC2)nc1-c1ccccc1F 550159474 ZGZMFFQAXSVUAI-UHFFFAOYSA-N 395.478 5.437 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 561129891 COWDTFWMRQFUFU-LHSJRXKWSA-N 391.515 5.858 30 20 GKED Cc1cc(Br)c(C(=O)N[C@@H](CCC#N)c2ccccc2)cc1Cl 561336148 WQCCZRICZFHEOU-KRWDZBQOSA-N 391.696 5.186 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)s1 568411027 FLRGPMPDEIGLLO-UHFFFAOYSA-N 381.530 5.071 30 20 GKED Cc1nc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)ccc1-c1ccccc1 573292186 SCKUVLCRNXPZTR-UHFFFAOYSA-N 394.478 5.250 30 20 GKED COc1ccccc1[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccco1 576676391 LGCJJBQCFQCIQJ-FQEVSTJZSA-N 386.373 5.058 30 20 GKED N#CCCC1CCN(C(=O)[C@H]2CCCO[C@H]2c2ccc(Cl)cc2Cl)CC1 579477283 DIUXCIWZVHBOLN-HKUYNNGSSA-N 395.330 5.003 30 20 GKED CCc1nc2cc(CN[C@H]3CCCCc4cc(C#N)ccc43)ccc2n1C1CC1 582015794 QKRSQIQDVFIIOP-QFIPXVFZSA-N 384.527 5.363 30 20 GKED N#Cc1cnc2c(F)c(F)c(F)cc2c1Nc1ccc2c(cnn2C(F)F)c1 588004502 GHQXRKHOIUABSR-UHFFFAOYSA-N 389.287 5.012 30 20 GKED N#CCCCCCC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 588164415 OSGYEESIBQRFLU-UHFFFAOYSA-N 387.842 5.144 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1nc2cc(F)ccc2s1 592975787 RWAMMUHPIACFIX-SFHVURJKSA-N 388.423 5.718 30 20 GKED C[C@@H](NC1CCC(Oc2ccc(C#N)cn2)CC1)c1ccc(-c2ccccc2)cn1 593608654 OFZOADREQRRUBC-WDGBRCNXSA-N 398.510 5.056 30 20 GKED CCCN(C(=O)Nc1ccc(C#N)cc1)[C@H](C)c1ccccc1Br 604073034 MFERNCIXIIRBPT-CQSZACIVSA-N 386.293 5.326 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(CC(C)C)CC(C)C 609078908 CPAUYIVSEFIYFE-UHFFFAOYSA-N 393.531 5.592 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1)c1ccccc1 609168738 DFBMHIBUEYWYAA-GOSISDBHSA-N 394.478 5.590 30 20 GKED CCCN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609398841 WWHKPSZSINTJKP-INIZCTEOSA-N 385.508 5.522 30 20 GKED N#C[C@@H](NC(=O)CC/C=C\c1ccccc1)c1ccc(OCc2ccccc2)cc1 609988397 ZNWTZPDBFVAEAV-XNZHOLMXSA-N 396.490 5.440 30 20 GKED CCN(CC#N)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 610173409 HVQKNKJUQOPYKD-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C[C@@]1(c2ccccc2)C[C@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 610205629 ROSUKYVBKCCBJO-NOZRDPDXSA-N 398.531 5.311 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)NC2CCC(OC(C)C)CC2)cc1 611051971 YWZIIKXHVWOXDQ-UHFFFAOYSA-N 392.499 5.125 30 20 GKED C[C@H](NCc1csc(-c2ccc(Br)cc2)n1)c1cccc(C#N)c1 611388945 URJUBVZWUXHGEW-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccc(OCC)cc1 612276159 BMJHFRQYCLBTLD-AWEZNQCLSA-N 378.925 5.259 30 20 GKED C[C@H]1C[C@@H](NCc2ccc(C#N)c(Cl)c2)c2cccc(Br)c21 619755343 XNXNNHJFDQUSEZ-APPDUMDISA-N 375.697 5.312 30 20 GKED CC(C)Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 619756504 HCUXDLSRWYQPCL-HXUWFJFHSA-N 385.492 5.370 30 20 GKED Cc1c(F)cccc1C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 622485673 VDFSKOHIAIUHSF-CQSZACIVSA-N 379.275 5.186 30 20 GKED CC(=O)c1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)ccc1OC(C)C 656394985 ARSGSSICHOZSTR-UHFFFAOYSA-N 384.501 5.159 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)CCCC1 661849826 HQNWTYKQAKMPAS-UHFFFAOYSA-N 383.561 5.423 30 20 GKED CCCCCCCCC(=O)N1CCC([C@H]2C(=O)Nc3cc(Cl)ccc32)CC1 727414081 ZVDVELIZVUEOIX-OAQYLSRUSA-N 390.955 5.365 30 20 GKED N#C[C@H](C(=O)c1sccc1-c1ccc(F)cc1)c1nc2cc(F)ccc2s1 730422421 XPGGXURWSSJESZ-OAHLLOKOSA-N 396.443 5.793 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)CCCCOc1cccc(C#N)c1 731986713 MBOFAALLICUFGM-UHFFFAOYSA-N 396.556 5.945 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2sc3cccc(C)c3c2Cl)c1 733770320 GKBRKGKBRRACFS-HNNXBMFYSA-N 398.915 5.474 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccccc2Oc2ccccc2)c1 733770454 ADBURAWKVQRWDR-IBGZPJMESA-N 386.451 5.090 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2F)CC1)c1nc(-c2ccc(Cl)cc2)cs1 737322868 MNUFSHRXBROAQR-OAHLLOKOSA-N 396.874 5.511 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc4scnc4c3)c2)s1 740443701 HTGIKUUCDSRART-UHFFFAOYSA-N 390.493 5.218 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 740538702 IZPZKBLGXJXNEU-UKRRQHHQSA-N 382.435 5.377 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 741539681 UDYTXPBHYUKEJS-SFHVURJKSA-N 392.890 5.105 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)/C=C\c1cnc(C(C)(C)C)s1 742595094 DGSRBBGKRRSDJH-KHPPLWFESA-N 381.545 5.010 30 20 GKED CS[C@@H]1CC[C@@H](NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 742743246 VIXYYWJHZVDRQS-SJLPKXTDSA-N 386.904 5.018 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1cccc(Cl)c1 744033655 UIHGLCKBXNAJGK-HWPZZCPQSA-N 395.673 5.098 30 20 GKED COc1cc(/C=C2/CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)ccc1SC 746341685 GPRNAVIDVZMMAC-VUTUTYQISA-N 381.453 5.155 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cccc(-c3ccccn3)c2)S1 747691954 XUSFFSOELOJBEE-XSFVSMFZSA-N 385.492 5.257 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)cc1)c1ccc(-c2ccc(F)cc2)s1 750904922 JCDCOKNZIQPFPP-KMKOMSMNSA-N 375.428 5.031 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCC4(CCOCC4)CC3)nc2c1 751529910 UKFKLVPDGYWFJA-UHFFFAOYSA-N 383.439 5.454 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(Br)c(Cl)c2)c1 755196639 XLTSAZFAADXTNB-OAHLLOKOSA-N 393.712 5.073 30 20 GKED COC1CCC(CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CC1 759222486 QHAGBADYTFGOAE-UXUKBGGZSA-N 396.434 5.087 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)c(Cl)c2F)cc1 760519384 KRYGWJLYCZYNKF-QGZVFWFLSA-N 382.797 5.526 30 20 GKED CC(C)(C)C1CCC(CC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)CC1 766327050 SAJBBMXAGIEAAZ-VMWRSERWSA-N 381.545 5.624 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 769772884 DUCRFHDUTFGGGA-DOMZBBRYSA-N 399.313 5.429 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3cn(C)c4ccccc34)n2)cc1 773983594 ZALWSPUDPSOPTL-VQIMIIECSA-N 399.519 5.590 30 20 GKED CC(/C=C1\SC(=Nc2c(C)cccc2C)NC1=O)=C\c1cccc([N+](=O)[O-])c1 787170263 WHHNLSDJZHSKDJ-IWIADCQQSA-N 393.468 5.050 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)nc1C(F)(F)F 790006073 UWVBEMNTPGGSGF-JTQLQIEISA-N 399.825 5.258 30 20 GKED CN(C)Cc1cnc(/C=C/C(=O)c2ccc(-c3ccccc3Cl)s2)s1 794701981 YFGXTDYWNOSNIN-JXMROGBWSA-N 388.945 5.483 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)C[C@H]2CCC(F)(F)C2)c1 798213132 MVOAZFQDBRBAEQ-MRXNPFEDSA-N 388.845 5.570 30 20 GKED CC(C)(CCC#N)CNC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 805280901 OXYJNVMVBPFOES-PLNGDYQASA-N 392.343 5.184 30 20 GKED CC(C)(O)c1cccc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 806258634 XACCNNUMYMZTLE-UHFFFAOYSA-N 387.439 5.222 30 20 GKED C#CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 806426662 LCVNMLVXHILFBD-QGZVFWFLSA-N 389.524 5.025 30 20 GKED N#CCn1c(C(=O)OCC[C@@H](c2ccccc2)C(F)(F)F)cc2ccccc21 816473884 UDHRCLSQHMZFBE-KRWDZBQOSA-N 386.373 5.058 30 20 GKED N#Cc1cc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)cnc1C(F)(F)F 904548972 CSDHGHCUAAODOK-UHFFFAOYSA-N 392.340 5.356 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(-c2nccc3ccccc23)no1 904592896 GYASZLHQWPOZQF-UHFFFAOYSA-N 397.356 5.535 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(Cl)cc2)cc1 915124364 HLZUFXXDAIGDHT-FQEVSTJZSA-N 377.900 5.804 30 20 GKED COc1ccc2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)[nH]c2c1 915200256 WJNVIRJJGUTQIG-NRFANRHFSA-N 381.435 5.084 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1OC 917605481 VNBCNDFBVQMLSG-CLFYSBASSA-N 395.436 5.237 30 20 GKED CCO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 920324814 VDSRAGDTJNYRGB-WIYYLYMNSA-N 376.481 5.073 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1cc(C(=O)O)ccc1OC(C)C 1776033182 IPCCRARAQRVJLS-UHFFFAOYSA-N 380.366 5.027 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3ccc(Cl)cc3)cc2)oc1C(=O)O 1776115312 UOJZLKGMMYLDIT-WCIBSUBMSA-N 396.826 5.415 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1ccc(C(F)(F)F)cc1 1776179921 DKUDFLMTWHBNSM-QGZVFWFLSA-N 383.797 5.173 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)c1 1776341456 OSUBDNLACRSUFG-SOFGYWHQSA-N 382.456 5.833 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)cc1)c1ccccc1 1776469404 JMGTXIVGKWBLNA-FYXHJSOBSA-N 386.447 5.350 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776697584 IVPODHGSPYSQEU-BHEJFATLSA-N 384.475 6.461 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 1777316278 OPTDLPRZHHVDTC-JXMROGBWSA-N 382.799 5.203 30 20 GKED O=C(O)c1cc(Br)cc(/C=C2/Cc3cccc4cccc(c34)C2=O)c1 1777663515 FIAVDQSWMGACQH-CHHVJCJISA-N 393.236 5.123 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCOc4cc(F)ccc4C3=O)cc2)cc1 1777670925 BJEWFGIAUWRLDX-UYRXBGFRSA-N 388.394 5.240 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CCC2)cc1 1791587935 VZXZTJZCVQTVQE-BVYCBKJFSA-N 394.559 5.303 30 20 GKED N#Cc1c(NC(=O)c2cc(Br)ccc2Cl)sc2c1CCCC2 5943796 YVYBTQVEDKTSKE-UHFFFAOYSA-N 395.709 5.167 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(SC(F)F)cc3)n2)cc1 10390772 MZIGXKZWRZRANP-UHFFFAOYSA-N 387.436 5.249 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(Cl)cc3F)c2)c1 32289448 ZTZLDWKERNKODO-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H](c1ccccc1)n1c(SC[C@@H](C#N)CCC#N)nnc1-c1ccccc1 51423558 CQYZCBQTRKFTHG-QZTJIDSGSA-N 387.512 5.090 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCCc2nc3ccccc3[nH]2)cc1 65680390 GHZOSSMVMXQEQK-UHFFFAOYSA-N 396.450 5.188 30 20 GKED C=CCN(CCc1ccccc1)Cc1csc(-c2ccc(OC)cc2OC)n1 65959840 MTWFELXXSJGZAQ-UHFFFAOYSA-N 394.540 5.058 30 20 GKED N#Cc1ccc(CN(Cn2ccc(=S)c3ccccc32)CC(F)(F)F)cc1 68614304 XWUPJJIBCQCNFD-UHFFFAOYSA-N 387.430 5.264 30 20 GKED CCn1cc(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c2ccccc21 108237430 BFSGCGLCABVDSR-INIZCTEOSA-N 377.513 5.094 30 20 GKED CC(=O)Nc1cccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1C 121338614 JGEHANSNTDHCTJ-UHFFFAOYSA-N 385.467 5.016 30 20 GKED Cc1noc(C2CC2)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 152879677 SULBRPVSAHKQCQ-UHFFFAOYSA-N 393.830 5.430 30 20 GKED C=C[C@H](CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1)c1ccccc1 163861944 LHZGNEUUWJNEHA-CQSZACIVSA-N 386.879 5.960 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 186260106 UGBBDBORHPHRSK-AWEZNQCLSA-N 375.428 5.088 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)c2c1 190886125 INLOOCOXLZROKP-IBGZPJMESA-N 392.462 5.162 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(O)(c2ccccc2)CC1 191496597 OWPGRNNOLQJXDD-UHFFFAOYSA-N 378.516 5.054 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 237500666 SPJGJBQSQJYBRW-XDHUDOTRSA-N 392.449 5.329 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc2ccccc2n1)c1nc2cc(Cl)ccc2s1 255550189 ZRVBSPSDAOHYRW-QWGSZXSUSA-N 389.867 5.388 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1cccc(C)c1 303292225 MPGZSYAHKIUOBF-UHFFFAOYSA-N 394.525 5.448 30 20 GKED O/C(=N/[C@@H]1CCOC2(CCC2)C1)Nc1ccc(Br)c2ccccc12 329191851 SPFXJXDKGWDZNE-CYBMUJFWSA-N 389.293 5.030 30 20 GKED OC1=Nc2ccc(/C(O)=N/[C@H]3CC4(CCCC4)Oc4ccccc43)cc2SC1 329506727 IXWJBWYRSFZNHV-KRWDZBQOSA-N 394.496 5.522 30 20 GKED CCC[C@@H]1CCc2nc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)sc2C1 330027264 MULBLWZRIXYCQN-IUDNXUCKSA-N 389.565 5.561 30 20 GKED CC(C)(C)C(=O)Nc1ccc(F)c(/C(O)=N/[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 330929577 YURFCFQQWVONDG-NWDGAFQWSA-N 388.405 5.236 30 20 GKED CCCN(Cc1ccc(C#N)cc1)[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 411170344 WTCPXZQURZEUPB-OAHLLOKOSA-N 380.879 5.235 30 20 GKED N#Cc1ccc(CN2CCC[C@H]2c2nc3ccccc3s2)c(OC(F)F)c1 433947912 BNWCTZKEMMESIT-INIZCTEOSA-N 385.439 5.106 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1Cl 437901066 JFBGJDYZWHXBQA-AZUAARDMSA-N 397.906 5.431 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1 439077449 ITWSZLSDPNUQCX-UHFFFAOYSA-N 396.834 5.073 30 20 GKED O=C(Nc1c(F)cc(F)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 443922702 XEOIQSJMODSMKA-UHFFFAOYSA-N 387.201 5.394 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(COCCOC(C)C)c2)CCCC1(C)C 445240082 CNDQVOQIMWXRHE-NRFANRHFSA-N 388.552 5.227 30 20 GKED C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458797225 GBOJHROPKNVDFR-WTIAFYNJSA-N 375.516 5.084 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccccc1C1CC1 466470601 NZKGPUJTPSGMBU-INIZCTEOSA-N 396.581 5.688 30 20 GKED CO[C@H]1CCOc2c(NC(=O)c3cccc(Nc4ccc(C#N)cc4)c3)cccc21 468682611 XDJRVFPQKUGPFH-QFIPXVFZSA-N 399.450 5.024 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1nc2ccccc2[nH]1)C(C)C 471492540 SLFZEMGEBLKCRL-NRFANRHFSA-N 376.504 5.048 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 473681035 XTGPZEZTPJRWTN-DLBZAZTESA-N 399.585 5.692 30 20 GKED N#CC[C@H](CC(=O)NCc1cccc(COCc2ccccc2)c1)c1ccccc1 474891995 HABJVDLPGUQKPW-RUZDIDTESA-N 398.506 5.107 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(-c2ccccc2)ns1 475795319 QSDRGRLJLZCFNJ-ICSRJNTNSA-N 388.496 5.114 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H](c2ccccc2)C1 477340422 KEBWMAUTMXQHDW-NRFANRHFSA-N 397.478 5.680 30 20 GKED C=C(C)[C@@H](NCc1cccc(C(=O)Nc2ccccc2)c1)c1ccc(F)c(F)c1 481593633 MDXPCHSDDGRZOP-HSZRJFAPSA-N 392.449 5.624 30 20 GKED Cc1ccc(C[C@H](C)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 483849579 UXCHMPIILQWGOJ-SFHVURJKSA-N 385.467 5.180 30 20 GKED N#Cc1cccc(CNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1 487296116 HHBIXONAZWHVRR-UHFFFAOYSA-N 380.369 5.174 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1ccc(SC)cc1 503918135 ACCFSMQCVYJFNX-QGZVFWFLSA-N 386.565 5.035 30 20 GKED Cc1cc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c(Br)s1 505830717 DMYQGQOKPNVRDX-HNNXBMFYSA-N 391.334 5.111 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)CC1 506658683 DDRQBQCSEXNWRH-UHFFFAOYSA-N 383.879 5.077 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CC1 506881142 GEBRVHFDUOTXBB-UHFFFAOYSA-N 385.920 5.649 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(-c2cccnc2)cc1 507614907 XJOPGRKGHUZEQS-WOEOTAOXSA-N 381.523 5.803 30 20 GKED C[C@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccc(C#N)cc1 517548978 UANSXDDKOSZRBM-KRWDZBQOSA-N 386.455 5.085 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc(-c4ccccc4)nc3)n2)cc1 522231421 SCASJUHPVKCHGW-IBGZPJMESA-N 396.475 5.066 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccccc3OCC3CC3)n2)cc1 522487573 BTVSJIZTKLEFAY-IBGZPJMESA-N 388.492 5.397 30 20 GKED CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(C#N)cn1 523306640 AEODJJZRXFJJCM-QFIPXVFZSA-N 391.421 5.025 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 524662553 ROLRUWUOCZJDCQ-UHFFFAOYSA-N 391.943 5.175 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 533372367 IOMFEHJLLOWBBN-JOCHJYFZSA-N 396.487 5.532 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F)OCC 533764176 SFNYKJLPKQGXQO-DYVFJYSZSA-N 389.483 5.906 30 20 GKED C[C@@H](NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)cc1 537295392 JOSFPHSVTJAZBK-OAHLLOKOSA-N 388.342 5.180 30 20 GKED CCCC[C@H](CC)COCc1cccc(NC(=O)N2CCC(CC#N)CC2)c1 542902963 WVOUIESLOHKIQU-IBGZPJMESA-N 385.552 5.577 30 20 GKED N#CCCCOc1cccnc1NCc1cnc(-c2ccc(Cl)cc2)s1 551437836 ZHAMGAABGPFYAM-UHFFFAOYSA-N 384.892 5.153 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1C1CC1 560295017 OUYNGWWIPBQAQL-LDQXTDLNSA-N 391.519 5.035 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)c1OC 564115434 YYCDJPKIMSWOJO-SFHVURJKSA-N 386.495 5.402 30 20 GKED N#Cc1cccc(CCNC(=O)c2sc3cc(Cl)ccc3c2Cl)c1 575077608 HPOOSGIFZVHOIX-UHFFFAOYSA-N 375.280 5.052 30 20 GKED C[C@@](C#N)(NC(=O)c1sc2ccccc2c1Br)C1CCCCC1 579557937 YCSBJDSQCHZZBR-SFHVURJKSA-N 391.334 5.256 30 20 GKED COc1ccc(C[S@@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1C#N 584041458 HIULPCBWKHWCOI-WXVAWEFUSA-N 395.911 5.259 30 20 GKED C=C(C)COc1cccc(NC(=O)NCc2nc3cc(Cl)ccc3s2)c1 589740191 MJICTWQSSAZUOE-UHFFFAOYSA-N 387.892 5.226 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 592975501 HKQHSJYNJOBQJD-KRWDZBQOSA-N 397.365 5.121 30 20 GKED N#Cc1ccc(N(C(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)C2CCC2)cc1 598886892 YALZXZQOAUAJFL-UHFFFAOYSA-N 394.343 5.412 30 20 GKED Cc1sc(NC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)c(C#N)c1C 603444804 APLPEZXEUCABOT-UHFFFAOYSA-N 392.509 5.198 30 20 GKED O=C(NCc1coc(-c2ccccc2)n1)Nc1cccc(C#Cc2cccs2)c1 608273029 CHQHJYQYBWCIIP-UHFFFAOYSA-N 399.475 5.125 30 20 GKED Cc1cccc(Oc2ccccc2CNC(=O)N(C)Cc2ccc(C#N)cc2)c1 609294709 ZNGAUPDFRPOPRB-UHFFFAOYSA-N 385.467 5.001 30 20 GKED CCC[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccn1 609434000 VMVCZMIWIGLOEO-JOCHJYFZSA-N 386.455 5.408 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccccc2Cl)s1)c1ccc(Cl)cc1 609589423 FZQVSESGLHDKAI-OAHLLOKOSA-N 388.279 5.112 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(CCc1ccc(F)cc1)C1CC1 609744503 KTMKSXYWBMMQPM-MRXNPFEDSA-N 397.519 5.316 30 20 GKED N#Cc1cc([N+](=O)[O-])cnc1S[C@H](c1ccccc1)c1ccc(Cl)cc1 610304722 ZAIRQKPKIIIWDV-GOSISDBHSA-N 381.844 5.397 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCc2ccc(F)cc2)c1)c1cccc(C#N)c1 610318757 YAHGTJWZBGKQJF-INIZCTEOSA-N 389.430 5.159 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1cccc(C#N)c1 610322819 KYHNBTDGFQPHEN-AWEZNQCLSA-N 392.846 5.282 30 20 GKED CC(C)c1ccc(C[C@H](C)NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 611238398 VHBJDNPIFQGOSR-ZDUSSCGKSA-N 375.299 5.349 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCCc2nc(-c3ccccc3F)sc21 618805530 HITAGMJLBPPGMU-WOJBJXKFSA-N 389.499 5.475 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 619726853 UYRARAIHJMUVNJ-JLLWLGSASA-N 391.302 5.412 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 661118125 WVMOHAOOHBITGC-FPOVZHCZSA-N 397.588 5.669 30 20 GKED CCn1c(NN=C(C)c2cc3c(ccc4ccccc43)o2)nc2ccccc2c1=O 725843707 YANIBRCGIQIDTQ-UHFFFAOYSA-N 396.450 5.152 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 726475347 IQYWOFRQCNTAMP-AWEZNQCLSA-N 391.367 6.145 30 20 GKED C=CCc1cc(CNCc2ccccc2OC2CCCC2)cc(OC)c1OC 729683184 CJTCVGNPMNUDPU-UHFFFAOYSA-N 381.516 5.044 30 20 GKED Cc1nc(-c2ccccc2Br)sc1C(=O)/C=C\c1cccnc1 730148660 JDPRPFPOBODPOC-HJWRWDBZSA-N 385.286 5.172 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc2ccccc2c(Cl)n1 730989165 HZJIMLUHXBFEES-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(-c2ccc(O)cc2)n1 733886710 QKVWUUYAFXLGCC-UHFFFAOYSA-N 390.917 5.059 30 20 GKED N#CCOc1ccc(CNC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)cc1 735385577 UEAUVUUKTPLLLI-NRFANRHFSA-N 397.906 5.069 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3occc3-c3ccccc3)c2)s1 739751590 PPJPMKOYAAKJAO-UHFFFAOYSA-N 384.460 5.477 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(Oc3ccccc3F)c(F)c2)cc1 742377935 KYSNTPQTKXTEMQ-MRXNPFEDSA-N 394.421 5.338 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)NCc1ccc(OCC#N)cc1 743185692 SELBMJFNQXXCQH-UHFFFAOYSA-N 389.908 5.065 30 20 GKED CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)c1sccc1C#N 748053771 WSKXSMMDJYBNCM-UHFFFAOYSA-N 396.493 5.086 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 756505397 RCKIEFRKLPWYAN-MOJYJUKOSA-N 376.843 5.125 30 20 GKED CN(C(=S)Nc1ccccc1C#N)[C@H](c1ccc(Cl)cc1)C(F)(F)F 758445434 ARUUQOORFLPUIW-OAHLLOKOSA-N 383.826 5.144 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(CC3CCOCC3)no2)cc1Cl 761990194 QJNPVHBZQMJSEN-UHFFFAOYSA-N 395.846 5.023 30 20 GKED COc1ccccc1SCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 763547242 DBRYFCNRYCUJOM-HXUWFJFHSA-N 388.492 5.081 30 20 GKED N#C[C@@H](C(=O)CCc1cncc2ccccc12)c1nc(-c2ccccc2)cs1 765591752 ZTESSORRJMMZHB-FQEVSTJZSA-N 383.476 5.167 30 20 GKED CN1C(=O)CCc2cc(/C=C3/CCSc4ccc(Cl)cc4C3=O)ccc21 774129275 DQQQBZAMZTUYIY-PTNGSMBKSA-N 383.900 5.011 30 20 GKED C#CCOc1ccccc1NC(=O)N(Cc1cccs1)Cc1cccs1 776098938 MRBAOMIPUFPDMO-UHFFFAOYSA-N 382.510 5.056 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2cc3ccccc3o2)C(C)C)ccc1OC 776309680 LOYMBDXGXDXHSE-CYFREDJKSA-N 392.499 5.609 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@@H](C)c1nc2ccccc2o1 777871929 NISWPGONSAOYFY-KRWDZBQOSA-N 383.451 5.760 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1sc2cccc(Cl)c2c1Cl 780158199 ABAFXGILOLLQKS-SNVBAGLBSA-N 391.279 5.751 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1csc(Cl)c1 786447465 KZDDWXVXEZTXMS-OAHLLOKOSA-N 396.855 5.155 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ncc(-c2ccc(Cl)cc2)o1 795984235 WJUKSNWIFXMMLD-QAPCUYQASA-N 394.858 5.687 30 20 GKED C#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2C[C@@H]3CC[C@H](C2)N3C)cc1 809663283 NCEKHIYWEMEFKM-DNRMFDCTSA-N 378.947 5.025 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Br)s1)c1nc(C2CC2)cs1 842941125 ODRCRVQGBXWMRN-GFCCVEGCSA-N 395.347 5.044 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@]34CCCC[C@@H]3C4(F)F)n2)cc1 850762260 HLTHCZJOQXTXLA-MOXGXCLJSA-N 386.467 5.510 30 20 GKED N#C[C@@H](C(=O)Cc1cccc2ccccc12)c1nc2cc(Cl)ccc2s1 917044416 RSYGQEAWIZBMRL-KRWDZBQOSA-N 376.868 5.522 30 20 GKED COc1ccc(F)cc1-c1cncc(CN[C@H](CCCC#N)c2ccccc2)c1 930567625 NFGKIQRAFGKXAI-HSZRJFAPSA-N 389.474 5.421 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)c(C)s1 1776133153 ORUFMMASJSGXLC-MDZDMXLPSA-N 392.476 5.538 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cs1 1776280433 KMXOXKBFMYLFID-CSKARUKUSA-N 397.521 5.763 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)CO2 1776374617 HGZTXKMNBSUJPB-MOSHPQCFSA-N 398.458 5.834 30 20 GKED CC(C)c1cccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)c1 1776375497 TUDFIXKLZLAEJT-JXMROGBWSA-N 376.408 5.370 30 20 GKED C[C@@H]1C/C(=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1776589587 OILZWZADHAPWDM-OJSPLJLUSA-N 398.458 5.737 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776805947 HDSZATNISAVFDD-FYWRMAATSA-N 390.504 6.352 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777566890 RYVHNDLTGSJSNH-LPYMAVHISA-N 379.415 5.136 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(C)ccc2C)nnc1-c1ccccc1 4285690 HNQHPOQYQBFQMN-KRWDZBQOSA-N 377.513 5.111 30 20 GKED C=CCN(C(=O)c1cc2ccccc2nc1C)c1nc(-c2ccccc2)cs1 11213555 QQNUISSYKRWASJ-UHFFFAOYSA-N 385.492 5.500 30 20 GKED CC(C)n1c(SC[C@H](C#N)CCC#N)nnc1-c1ccc(Cl)cc1Cl 15244616 GIIRPYRRPVTXOB-LBPRGKRZSA-N 394.331 5.368 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 47159466 OTXMUBQMBHKENV-QFIPXVFZSA-N 389.886 5.143 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cn(Cc2ccccc2)nc1-c1cccs1 63961120 VVIZICUTTNOYCV-UHFFFAOYSA-N 398.491 5.092 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(OCc2cscn2)c1 107377750 CTEKPOCNYISDHE-UHFFFAOYSA-N 397.475 5.081 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Oc2cccnc2)nc1 133249129 RJFDBTBTGCVEOG-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#C[C@H](C(=O)CC1CCSCC1)c1nc(-c2ccc(Cl)cc2)cs1 134978922 YCYWVTMCCPVDSS-OAHLLOKOSA-N 376.934 5.173 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 152800135 JTEXVSCBCVDVFH-NRFANRHFSA-N 386.455 5.361 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(-c4ccncc4)s3)cc2)c1 172840828 IEKCZJPWEMBGSH-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 178584759 JHNNKZKFTCKHSD-UHFFFAOYSA-N 394.862 5.073 30 20 GKED C=CCC1(C(=O)Nc2ccc(Cl)c(C(=O)NCc3cccs3)c2)CCC1 189150750 IQQWMCZZZJQEMJ-UHFFFAOYSA-N 388.920 5.016 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc3ccccc3c2)c(-c2ccccc2)n1 211729900 GUHBFQCSGSITMU-YPKPFQOOSA-N 377.447 5.513 30 20 GKED CC(C)c1ncsc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 410458114 NEJKLSQJFMHPHA-UHFFFAOYSA-N 399.463 5.543 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ncc(C(F)(F)F)s1 425363131 AXXZOMVVIDWLAB-JTQLQIEISA-N 393.356 5.095 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)Nc1ccc(F)c(C#N)c1 430532679 YUWMMIMPSJNDRM-UHFFFAOYSA-N 390.201 5.220 30 20 GKED CCCOc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 432908415 WFOGHERBRKBZMR-IBGZPJMESA-N 385.895 5.685 30 20 GKED COc1cc(C)c(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1C 436387341 KIGCEKXIMUVQPQ-UHFFFAOYSA-N 388.492 5.587 30 20 GKED C=C[C@](C)(CCOC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 437624578 KBOPRHTZTGXAOP-SIKLNZKXSA-N 382.891 5.163 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@@H]1Cc1ccccc1Cl)c1ccccc1 438850975 WORPATCOAHDCMG-TZIWHRDSSA-N 381.907 5.102 30 20 GKED CCCc1c(NC(=O)c2cc(C)c(F)cc2Cl)cnn1-c1cccc(C#N)c1 440083952 ZAXFUOQKSLZOFF-UHFFFAOYSA-N 396.853 5.050 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1scnc1C)c1ccc(C(F)(F)F)cc1 441539614 ZBBVZZIKGFIWMB-MRXNPFEDSA-N 397.466 5.319 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CC(C)(C)CC(=O)c2ccccc2)cc1 442750501 JAFVTQLZMHFQSV-UHFFFAOYSA-N 392.499 5.021 30 20 GKED CN(Cc1c(F)cccc1Cl)C(=O)c1cn(CCCC#N)c2ccccc12 443914045 CUPBCTOXMIJJQD-UHFFFAOYSA-N 383.854 5.010 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)c2c(F)cc(C#N)cc2F)cc1 445677834 CYOFEFZRJGMIGB-UHFFFAOYSA-N 394.377 5.280 30 20 GKED CCN(C(=O)Nc1cccc(CC#N)c1)[C@@H](C)Cc1ccccc1C(F)(F)F 455905173 LFZPOLQMKSFOBU-HNNXBMFYSA-N 389.421 5.256 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 458540367 WIOYHDNMTZPMNG-SZMVWBNQSA-N 381.442 5.089 30 20 GKED C=CC[C@H](CC)NC(=O)c1cc2ccccc2cc1OCc1c(C)noc1C 467687977 KAGXXYJWSUAFRZ-IBGZPJMESA-N 378.472 5.108 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(CCOCc2ccccc2)CC1 471823661 FCBRZQBLYJXWMR-GOSISDBHSA-N 394.540 5.264 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(c2ccccc2C)CCC1 472778720 ZMHAYSJPKBPSFF-UHFFFAOYSA-N 397.478 5.423 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 474911866 KEPKGTNAGDGZIJ-QGZVFWFLSA-N 375.403 5.039 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 475652306 FWEHRSNHILKDFZ-DENIHFKCSA-N 394.540 5.291 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(N2CCCCCC2)nc1 476118068 ANIGWPCDMVNQEF-UHFFFAOYSA-N 377.532 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C[C@H](C)c1ccccc1)[C@@H](C)CO 482076044 MPCLVTKNDAOLLR-PMACEKPBSA-N 394.559 5.557 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(OC(F)F)cc3)c2)cc1 482298958 CJQXFXMPPTYJAA-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1sc2c(c1C#N)CCCC2 483076217 RERQTSMUDNTEDB-UHFFFAOYSA-N 397.887 5.368 30 20 GKED CCCC1CCC(N(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC1 483087054 RXWGTYBOMLHLGM-UHFFFAOYSA-N 377.488 5.176 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)Cn1ccc2ccccc21 483381727 QRUOWSRKBXWRKO-UHFFFAOYSA-N 397.453 5.194 30 20 GKED CCc1c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cnn1C(CC)CC 485174185 BUMTXNBXEDPQNK-DENIHFKCSA-N 393.535 5.110 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2cc(Cl)sc2[nH]1 486227729 OOCYFMZIOCSDNN-JTQLQIEISA-N 375.906 5.529 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)no1 486327855 NBEVCHHZPCRBLU-UHFFFAOYSA-N 395.846 5.154 30 20 GKED C=CCC[C@H](C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)c1ccccc1 488991432 ZNJHSCCVHNDHQK-RDPSFJRHSA-N 376.544 5.078 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-c2ccco2)cc1F 490514061 NZUCMCQGOZCELQ-UHFFFAOYSA-N 395.390 5.214 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N(CCC#N)Cc2ccco2)c1C 494037233 IXPAOUHXNYFUQK-UHFFFAOYSA-N 383.492 5.241 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccc(Cl)c4cccnc34)n2)c1 501139189 AAHJTGFERYEXDX-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=CCC[C@H](NCc1ncc(CN(C)C)s1)c1ccc(C(F)(F)F)cc1 512055693 ZBNCBUAFTNPTTH-KRWDZBQOSA-N 383.483 5.021 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(Cl)c1Cl 516670551 QMOVYAJLYCENTC-UHFFFAOYSA-N 397.261 6.218 30 20 GKED CCCCS[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 518668809 NHCQSZCMZOPDON-LBPRGKRZSA-N 390.496 5.571 30 20 GKED C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccccc1SCCC#N 521717070 SUZYNCBWHUQRGI-GFCCVEGCSA-N 395.311 5.405 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCCCC#N)c2)sc1-c1ccc(F)cc1 523273735 YLCQJGIXBPNROO-UHFFFAOYSA-N 394.471 5.798 30 20 GKED N#Cc1ccsc1C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F 524850453 ORYVSFLNIWUTCT-UHFFFAOYSA-N 376.812 5.180 30 20 GKED Cc1c(CNC2(c3ccc(C#N)cc3)CCOCC2)sc2c(Cl)cccc12 527810743 NSOHGNMPYRPFTM-UHFFFAOYSA-N 396.943 5.530 30 20 GKED C[C@@H]1CC(F)(F)CCN1C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 530018416 UMNDUPYJBYSBAD-CYBMUJFWSA-N 390.817 5.264 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1)OCC 534473973 UYHUUGHHHIQSOG-IBGZPJMESA-N 383.879 5.193 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2cccs2)CCCCC1 534598165 UAEFBYIVSUVPDP-UHFFFAOYSA-N 396.537 5.743 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccn(-c2ccc(Cl)cc2)n1 535294057 SAXFHNKOTVOIRZ-CQSZACIVSA-N 396.903 5.030 30 20 GKED CCCN1C(=O)CCc2cc(NC3CCC(C#N)(c4ccccc4)CC3)ccc21 537508207 CWUMFXQWYAYCPH-UHFFFAOYSA-N 387.527 5.192 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 538073972 QMFXVAOBNYIZQE-SFHVURJKSA-N 390.405 5.015 30 20 GKED C[C@](NC(=O)c1ccc(F)cc1C(F)(F)F)(c1ccc(F)cc1)C(F)(F)F 542868958 VPUMLMWDFTZNMD-HNNXBMFYSA-N 397.265 5.191 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 543944108 GOWMKJPSLYHSFA-QZTJIDSGSA-N 394.478 5.218 30 20 GKED CC(C)(C)[C@@H]1OCC[C@H]1c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 571194826 TUJSYMIQAVVWTC-JTFJPCCOSA-N 390.487 5.027 30 20 GKED C=C(C)COc1cccc(NC(=O)c2sc3cccc(F)c3c2COC)c1 589382656 WFVYOKLTUMZWRI-UHFFFAOYSA-N 385.460 5.394 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccc(F)cc2[C@@H](C)C1 593160883 ZWHBNDBNKDXQCJ-CVEARBPZSA-N 397.519 5.271 30 20 GKED N#Cc1cccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)c1 603457479 KYCUUNRKLFYUBX-VKAVYKQESA-N 391.430 5.439 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCCCOc2ccc(Cl)cc2)cc1 603656275 FNYSZBNGNHROFN-UHFFFAOYSA-N 385.895 5.122 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3ccccc3F)cc2Cl)c1 609063027 RETXTCKMQQPZIF-UHFFFAOYSA-N 394.833 5.111 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609437142 SERPNKLSEGEMPY-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1CN(C)C1CCCCC1)c1cccc(C#N)c1 610319043 FYBPODOWYCJZKY-GOSISDBHSA-N 390.531 5.205 30 20 GKED N#Cc1ccc(Oc2ccc(Sc3ccnc4cc(Cl)ccc34)cc2)nn1 611241829 YKVGGEVOVLFXAK-UHFFFAOYSA-N 390.855 5.493 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(-c4ccccc4)cc3F)CC2)cc1 611245448 VSIXWPZQVGEIKF-UHFFFAOYSA-N 397.453 5.686 30 20 GKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 669727160 MPXDLIUMDLXAFI-KBPBESRZSA-N 394.359 5.400 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(F)c(F)c(F)c1 675739624 ZGSLPXSSNIKCRT-HGNGGELXSA-N 393.293 5.664 30 20 GKED C=CCC[C@H](NC(=O)C[C@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 676731469 ZVRWOVMCBWLMII-KXBFYZLASA-N 376.422 5.418 30 20 GKED N#Cc1ccc(NC(=S)NC(c2ccccc2)c2ccccc2)cc1Cl 726438063 KNCUAQYMPFXWKG-UHFFFAOYSA-N 377.900 5.288 30 20 GKED COc1cc(C(C)=NNc2ccc(OCC(F)(F)F)cc2)ccc1SC 727257993 NRCRGMYBCHKTEA-UHFFFAOYSA-N 384.423 5.194 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN(C)C[C@H](C)c2ccccc2)c1=S 727427355 HXLFHXUINHHRAV-KRWDZBQOSA-N 396.535 5.099 30 20 GKED N#CCn1c(C(=O)O[C@@H](c2cccc(Cl)c2)C(F)(F)F)cc2ccccc21 730420495 HNNGFIRUIPOTLR-KRWDZBQOSA-N 392.764 5.279 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)cc1OC 732713937 OEYXGFKERHSUCL-RMKNXTFCSA-N 375.424 5.096 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Nc1ccc(OC2CCCC2)cc1 732915922 CLGWRBHWXKXIRN-KRWDZBQOSA-N 384.545 5.085 30 20 GKED C=CC[C@H](NC(=O)NCc1ccccc1Oc1cccc(C)c1)c1ccncc1 734669870 VSPFVAPHZVLQBR-QFIPXVFZSA-N 387.483 5.299 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)c(C)c1 735791486 ZROGDJFIDGRELT-GOSISDBHSA-N 387.483 5.026 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2cc(Cl)ccn2)cc1 735886801 VITGTFGVOXXBCL-UHFFFAOYSA-N 394.883 5.256 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)cc1 741537821 HTNFNCWIMHXBJV-PWRODBHTSA-N 388.417 5.362 30 20 GKED C/C(=C\C(=O)Nc1nc(C)c(SCC#N)s1)c1ccccc1C(F)(F)F 741901705 BTPRNGZAEZHDEH-MDZDMXLPSA-N 397.447 5.128 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2c1 747116108 ARMFNEPTPPHTPF-MRXNPFEDSA-N 377.444 5.034 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2C[C@H]2c2sccc2C)cc1 748835200 UNFIIRRAJFUVCR-NOENWEJRSA-N 380.513 5.021 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ccc(Cl)nc2)cc1OCC 760433423 QALJJBCHFXWZJL-UHFFFAOYSA-N 383.275 5.127 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCc1cccc(C(F)(F)F)c1 766838233 WEXRPQUSZDTPDF-QGZVFWFLSA-N 398.384 5.020 30 20 GKED COc1ccc(CNc2ccc(OC3CCCC3)cc2)cc1OCCCC#N 770488463 FNMSJDRVTQSXHO-UHFFFAOYSA-N 380.488 5.311 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3cccc(F)c3F)c2)cc1 776268078 LQUYCKXTGNXFKJ-MDWZMJQESA-N 393.389 5.122 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1 793829374 IBYGZVAYZRHBRE-KRWDZBQOSA-N 386.417 5.136 30 20 GKED Fc1ccc([C@@H](CC(F)(F)F)NC(=S)NCCCCC(F)(F)F)cc1 794981653 DKZFHCPOTWEZIP-GFCCVEGCSA-N 390.368 5.016 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570808 JZUPICDNSBYTNO-FWLQQBITSA-N 392.446 5.739 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C/c2ccccc2OC(F)(F)F)s1 797571079 NIUOELCHQBRSJY-XEHSLEBBSA-N 394.418 5.229 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2coc(C3CCCCC3)n2)cc1 802041958 JTJOYCBGYOCYRZ-BEFAXECRSA-N 393.487 5.197 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccc(Cl)c(SC(=O)N(C)C)c1 805439359 VCCUPQRAJZKCOZ-HNNXBMFYSA-N 399.944 5.023 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cc(C(F)(F)F)ccc1Br 810152123 UCAFYKGILQWNSP-LLVKDONJSA-N 399.210 5.371 30 20 GKED Cc1ccc(-c2cc(C(=O)N3CCC[C@H](CC#N)C3)c3ccccc3n2)c(C)c1 855260295 VUJVCHDVXUULDB-LJQANCHMSA-N 383.495 5.285 30 20 GKED Cc1cccc(Cl)c1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 864353017 CDVBNQDTDJXFCM-DZGCQCFKSA-N 387.936 5.339 30 20 GKED Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@H](C)Nc1ccc(CCC#N)cc1 903297346 FKMAXXIEAHMTDZ-INIZCTEOSA-N 394.519 5.044 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(C(C)C)cc1Br 907677741 RQNSQCSYSUONRM-UHFFFAOYSA-N 390.325 5.331 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(C#N)cc1 915350539 XTXUBVRNRSWMNB-GAJHUEQPSA-N 380.451 5.096 30 20 GKED C[C@H]1CCC[C@@H](CCN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)C1 1307546020 KUOSDWLWGGENTR-ROUUACIJSA-N 388.515 5.363 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2F)cc1 1776125373 GWPOSYVVWSBTHX-VMEIHUARSA-N 398.474 6.015 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776339827 FDKWVJJQPCIUTQ-APSNUPSMSA-N 384.475 6.146 30 20 GKED CCCCCCOc1cccc(/C=C\C(=O)c2cccc(OCC(=O)O)c2)c1 1776790222 AVDLEGSCGMYZCN-SEYXRHQNSA-N 382.456 5.005 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776801701 JJNVBHCQQLFLGT-UXBLZVDNSA-N 380.465 5.675 30 20 GKED COc1cc(OC)c(C(=O)O)cc1/C=C/C(=O)c1ccc(C2CCCCC2)cc1 1777326072 OMIAFLCAFNPIAB-OUKQBFOZSA-N 394.467 5.346 30 20 GKED CSc1ccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)cc1Cl 1777403383 GHOHVQONSQPVFH-WMZJFQQLSA-N 390.888 5.202 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc2cccnc12 1777420914 NNNKOMZDMCISAD-RUDMXATFSA-N 383.403 5.398 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)n(C2CCCC2)n1 1777420930 QFOPDASKZLBLJQ-KHPPLWFESA-N 390.439 5.161 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2cccc(Cl)c2)[n+]2ccccc2)cc1F 14872432 JGOXAMZHUKRWRW-UHFFFAOYSA-O 399.898 5.126 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 25887705 LZQAVTBLSFPJRU-PKNBQFBNSA-N 392.436 5.178 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(OCc3cccs3)c2)cc1 30847786 YYVZXFBNMRMZKM-UHFFFAOYSA-N 376.481 5.381 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 41538452 HJPCLXACIMREOY-GFCCVEGCSA-N 377.252 5.508 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)cs1 45615804 IEKIWEJKEIYLID-BUHFOSPRSA-N 376.481 5.079 30 20 GKED Cn1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c2ccccc21 51656654 JCDRDPCTFYSHQY-CYBMUJFWSA-N 399.397 5.297 30 20 GKED N#C[C@H](C(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1nc2ccccc2o1 54734732 KKHPTJMTGWGDIC-OQHXTRMZSA-N 390.748 5.390 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 61748158 PSXQOPSXXAJNTB-JOCHJYFZSA-N 391.421 5.136 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)cc1 65277447 SQIPKBMYVVYUAI-NRFANRHFSA-N 377.285 5.200 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 103674266 FFOANPMUTHPJBX-FXAWDEMLSA-N 385.492 5.442 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Sc3nc4c(cc3C#N)CCCC4)o2)cc1 121903702 YBWHIAQMIDATQL-CQSZACIVSA-N 376.485 5.044 30 20 GKED N#C[C@@H](C(=O)c1sc2ccccc2c1Cl)c1nc(-c2ccncc2)cs1 128836599 YQRDHTQXHZGEIX-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(C#N)c(Cl)c1 155186843 ZBGBAZJAADKZPV-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(Br)cc1 176336943 UBGVJLRIJGVXDU-UHFFFAOYSA-N 389.318 5.026 30 20 GKED CCc1ccc(N(C(C)=O)c2nc(CSc3cccc(C#N)c3)cs2)cc1 177099778 WQGCUHIMTJORKZ-UHFFFAOYSA-N 393.537 5.554 30 20 GKED COC(=O)[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 190528301 ASKHFKDESXKZQI-GOSISDBHSA-N 393.270 5.002 30 20 GKED C[C@H](SCCC(=O)Nc1ccccc1C(F)(F)F)c1cccc(C#N)c1 190890285 PCGJREFWKCDIPF-ZDUSSCGKSA-N 378.419 5.400 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nnc(-c2ccccc2)s1 191516904 IRRVUNVWVSZYTI-UHFFFAOYSA-N 392.528 5.379 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(O)ccc3C(F)(F)F)c2)cc1 193163103 IFOKXVYATJEASY-UHFFFAOYSA-N 398.340 5.327 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)cc1 213644207 NGLDERJJQNGOCM-LUAWRHEFSA-N 386.432 5.355 30 20 GKED COc1ccc(F)cc1[C@H](C)NCc1cccc(OCc2ccccc2C#N)c1 237185146 GKRABFXEGMPPON-KRWDZBQOSA-N 390.458 5.136 30 20 GKED Cc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c(Cl)c1 301197679 MRONGDUFPUWIIO-UHFFFAOYSA-N 392.911 6.065 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 303313784 GKSBFWCQMDGKKY-UHFFFAOYSA-N 386.451 5.319 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)cc1 303888541 PGWDTTIFTOOZJP-DLBZAZTESA-N 388.389 5.129 30 20 GKED COc1cc(NC(=O)c2sc3ccc(C#N)cc3c2C)c(OC)cc1Cl 429934761 WHDYVZSSXPZHRW-UHFFFAOYSA-N 386.860 5.004 30 20 GKED COc1ccc(CCN(CC(C)(C)C)C(=O)c2cccc(SCC#N)c2)cc1 430695920 AYWSWEQGNAGHMW-UHFFFAOYSA-N 396.556 5.042 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccc(Br)cc2)o1 436135051 FJPIKAQGAUBZEA-UHFFFAOYSA-N 380.311 5.311 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ncc(-c2ccccc2)s1 436150684 KMFZZMDNWIGVHA-OALUTQOASA-N 388.496 5.114 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)CCCOCc1ccccc1 439502517 PTANMTMQXPRUDQ-GOSISDBHSA-N 397.544 5.009 30 20 GKED C=CCN(Cc1csc(CC(=O)Nc2ccc(C)cc2)n1)CC1CCCCC1 444086951 PVEXPJBHYVWVTI-UHFFFAOYSA-N 397.588 5.201 30 20 GKED C=CCN(Cc1cccs1)C(=O)C(C)(C)c1ccc(OCC)c(OCC)c1 448135035 QDRKFSWPFRHOOU-UHFFFAOYSA-N 387.545 5.038 30 20 GKED CC[C@@H](CC(F)F)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457750611 MGBJVEODXFVHAB-JOYOIKCWSA-N 391.302 5.497 30 20 GKED CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@H](CCCC#N)c2ccccc2)s1 458808244 YRQYWXWGFVEFIZ-FUHWJXTLSA-N 384.549 5.152 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1cccnc1 460340008 RGXFPVGHWKNYFN-KRWDZBQOSA-N 389.886 5.334 30 20 GKED N#CCCCC(=O)NCc1ccc(Oc2ccc(F)c(F)c2)cc1C(F)(F)F 462038861 MRCISYNPVMBZDI-UHFFFAOYSA-N 398.331 5.086 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NCc1ccc(C#N)cc1 463704774 HPIGDRWFQNLNPQ-UHFFFAOYSA-N 375.859 5.385 30 20 GKED N#CCCN(CCC#N)C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 465069191 APMMZVGUCLIZPK-UHFFFAOYSA-N 388.254 5.055 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)cc1 467096216 YCGBOKPFXWTBSS-SFHVURJKSA-N 389.524 5.454 30 20 GKED C=CCOc1ccc(CN(C(=O)c2ccc(C3(C#N)CC3)cc2)C(C)(C)C)cc1 467896001 URHJMVFMTIZBSW-UHFFFAOYSA-N 388.511 5.247 30 20 GKED CCCOc1ccccc1[C@H](CC(C)C)NC(=O)N(C)Cc1cccc(C#N)c1 470029712 GGWSQUYFUWAXMD-QFIPXVFZSA-N 393.531 5.276 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)c1cccc(C(F)(F)F)c1F 473251890 AZUQZUCGCYRXCH-UHFFFAOYSA-N 398.253 5.210 30 20 GKED N#C[C@H](C(=O)c1cccc(NC(=O)c2cccs2)c1)c1nccc2ccccc12 483241079 VNNJBMALXSDKLZ-IBGZPJMESA-N 397.459 5.039 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 484345624 AQJHHIVITAOBKY-HNNXBMFYSA-N 396.487 5.486 30 20 GKED CCc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c2c(C(C)C)noc2n1 487189072 UYJCSNFENXGENT-LJQANCHMSA-N 390.487 5.074 30 20 GKED O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccc(F)cc1C(F)(F)F 487315922 HDACUHMKFCYBPU-WFASDCNBSA-N 391.286 5.149 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1ccccc1Cl 507790999 YQOLSNFGDNWLLI-LJQANCHMSA-N 383.879 5.368 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc3cc(F)ccc3s2)cc1 508156654 BDGSCJBLZKAFLU-UHFFFAOYSA-N 394.471 5.107 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3cccc(F)c3)no2)sc2c1CCCCCC2 515675083 UWBNXZJRTUPAQZ-UHFFFAOYSA-N 395.459 5.325 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 518867526 KYSRPBWOTJDOQK-MSOLQXFVSA-N 385.467 5.137 30 20 GKED C[C@H](S[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)c1ccc(Cl)cc1 521021527 ZEIAFVLUGKPDLH-LSDHHAIUSA-N 390.911 5.609 30 20 GKED C=CCc1cc(C(=O)Nc2sc(C)nc2-c2ccccc2)cc(OC)c1OC 522875871 YLSFAOGNIQRNAN-UHFFFAOYSA-N 394.496 5.117 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cc2ccccc2s1 527201188 YPRSQXLMUSICFL-OAHLLOKOSA-N 399.475 5.451 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(Cl)cc2cccnc12 530980889 DJXDDUOSSLQOOD-QUCCMNQESA-N 390.874 5.192 30 20 GKED COc1ccc2c(c1)[C@@H](N(Cc1ccccc1)CC(C)(C)CCC#N)CCO2 536661088 XNWJJKVZQPOFPJ-QFIPXVFZSA-N 378.516 5.351 30 20 GKED CC(C)c1ccc(NC(=O)C[C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 537424432 AESVADXWTBTLLN-GOSISDBHSA-N 379.504 5.322 30 20 GKED CCOc1ccc([C@H](NCc2ccc(C#N)s2)c2cccc(Cl)c2)cc1 538426372 FPSIZSGZBAZCPV-NRFANRHFSA-N 382.916 5.551 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 539049440 JEJYLGAQFIXPJU-VQIMIIECSA-N 391.496 6.019 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccccc2C(C)(C)C#N)cc1 539359692 ZZCFFLHBDMEQTL-LJQANCHMSA-N 384.523 6.014 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(-c2nc3cc(F)ccc3[nH]2)cc1 540598815 OEKWWDHIQUFDSC-UHFFFAOYSA-N 381.451 5.071 30 20 GKED CCCc1c(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cnn1C1CCCC1 543123311 BRDYDIQYUMFPPC-UHFFFAOYSA-N 390.409 5.093 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c(F)c1 543860803 MFIPEOJJAWMNLB-NSHDSACASA-N 382.382 5.144 30 20 GKED C[C@@H](NCc1cc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543874449 WCQUTOVUZRGYTH-GOSISDBHSA-N 379.463 5.731 30 20 GKED CC(C)[C@@H](c1ccc(Cl)cc1)c1noc([C@H](C#N)Cc2ccc(C#N)cc2)n1 558388517 NIFYNKIIOXWAIT-ICSRJNTNSA-N 390.874 5.232 30 20 GKED Cc1c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cnn1C1CCCC1 565813310 LQFOJUDQOAAMRS-UHFFFAOYSA-N 385.471 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(F)c1Br 574344024 XVJJTRKZWJYCDT-LLVKDONJSA-N 393.281 5.235 30 20 GKED N#CCCCn1cc(-c2nc(-c3cnc4ccccc4c3)no2)c2ccccc21 580376644 QZTFFESBJICJLG-UHFFFAOYSA-N 379.423 5.210 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cccc(Cl)c2C)cc1C 608877028 LDBPRRDDDDJCPH-UHFFFAOYSA-N 392.890 5.295 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609031075 AEIYTAHCBDHXND-QZTJIDSGSA-N 385.294 5.183 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 609652329 OPXBKLWPDJOLJS-MSOLQXFVSA-N 386.451 5.104 30 20 GKED COc1cc([C@@H](C)Nc2nc(C(F)(F)F)ccc2C#N)ccc1OCC(C)C 609669386 WWJXJASVZPTYNR-CYBMUJFWSA-N 393.409 5.189 30 20 GKED N#CC1(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)CCCCC1 609789390 QRYJVCWORKSQPY-UHFFFAOYSA-N 379.407 5.241 30 20 GKED C[C@@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1cccc(C#N)c1 610829734 HCSRIVHZTVKGDB-RTBURBONSA-N 396.494 5.197 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3oc4ccc(F)cc4c3C)n2)cc1 613315263 JGQFCCXTTQLUJO-QGZVFWFLSA-N 390.439 5.802 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 614929944 CVMAKLOFJDPGRI-UHFFFAOYSA-N 377.366 5.203 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC(=O)OC)c1cccs1 616123390 DLPXAQROUCFZIT-QGZVFWFLSA-N 386.517 5.026 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 618805789 LAGNDRANDZZQKT-VQTJNVASSA-N 389.499 5.475 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccsc1 619762434 FLCSADITSYPWLI-CVEARBPZSA-N 375.497 5.408 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)CCCC1 661852338 RILPMTJBVPVGGU-UHFFFAOYSA-N 383.561 5.423 30 20 GKED Cc1nc(CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)oc1-c1ccccc1 730394807 MTGAQRQCFFLZPS-LJQANCHMSA-N 381.435 5.007 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 731410347 ICYAWXNVTGMREP-BLLLJJGKSA-N 384.863 5.583 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 732495868 IZNRFFJNJVGXKX-SWLSCSKDSA-N 386.929 5.554 30 20 GKED COc1ccc(/C=C2\CCOc3ccc(Cl)cc3C2=O)c(Cl)c1OC 733749566 ZWZKJCHMTUOEBP-FMIVXFBMSA-N 379.239 5.059 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccncc1 734661501 KOLLRVHTOSTAKP-FGZHOGPDSA-N 391.902 5.441 30 20 GKED N#C[C@@H](C(=O)CCc1cc(Cl)cs1)c1nc2cc(Cl)ccc2s1 737323886 XXRBRFGEUOIJQE-LBPRGKRZSA-N 381.309 5.474 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)C(=O)Nc3ccccc3Cl)o2)cc1 744029539 VABRFLYKHRGYRB-MRXNPFEDSA-N 392.842 5.124 30 20 GKED COc1cc(C(=O)/C=C/c2coc(-c3ccc(C)cc3)n2)ccc1OC(F)F 748442283 ZFTMWCYRKVBTQQ-CMDGGOBGSA-N 385.366 5.156 30 20 GKED N#C[C@H](Sc1nn(-c2ccccc2)c(=S)s1)c1ccc(Cl)cc1 752909493 ONPJLLDUNQQNML-AWEZNQCLSA-N 375.931 5.674 30 20 GKED C#CC[C@@H](NC(=O)N1CC=C(c2c(C)[nH]c3ccccc23)CC1)c1ccccc1 757765070 ZDCUQENXHDGPBI-JOCHJYFZSA-N 383.495 5.040 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NCc1nnc(-c2cccc(C#N)c2)o1 760456977 WWFOSWDHPZGVHJ-UHFFFAOYSA-N 396.450 5.108 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2cnc(-c3cccnc3)s2)cc1 761606293 MZNOOEPDKCGRPI-UHFFFAOYSA-N 397.459 5.101 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccc2ccsc12 767957603 CSUAJQDFJOOXAI-CYBMUJFWSA-N 389.263 5.169 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc(O)ccc3Br)c2)s1 769927923 JHBFDFKKUVFRAE-UHFFFAOYSA-N 399.313 5.045 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)ccc2c1 770872500 UJAQFQSMFXTJSA-MGPUTAFESA-N 383.451 5.013 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)OC[C@H](C)C#N)cc1 770929536 PQZIIRVXNLDJJS-MRXNPFEDSA-N 376.481 5.031 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@H]32)cc1 772421701 GEPNUFWNSKSQDQ-ZYQDXHPFSA-N 393.490 5.192 30 20 GKED C=CCOc1cccnc1C(=O)O[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 775112668 MGFOJRFHIHYUFC-CQSZACIVSA-N 398.846 5.181 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)c(F)c1 781108133 NNOFHCFGQDHDSU-RMKNXTFCSA-N 378.384 5.230 30 20 GKED Cc1csc(SCc2c(C(=O)OCC(C)(C)C#N)oc3ccccc23)n1 781470579 QRYYTELVUMPAIE-UHFFFAOYSA-N 386.498 5.197 30 20 GKED C[C@H](Cc1ccccc1)NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1 786059016 XFOWMQMIRYDMIO-WZONZLPQSA-N 385.536 5.260 30 20 GKED N#Cc1cccc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c1F 796472605 YHIVYXFXKASCCS-KRWDZBQOSA-N 396.680 5.380 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C2c3ccccc3Oc3ccccc32)s1 797571136 MCGQHKHUQOHQSF-INIZCTEOSA-N 388.492 5.555 30 20 GKED COc1ccc2cc(NC(=O)Nc3cccc(OCCCC#N)c3)ccc2c1 806619138 ZEQPGJSBADPYHX-UHFFFAOYSA-N 375.428 5.175 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2csc(-c3ccccc3F)n2)cc1 812245122 PXIQPEIRCPUVJF-ZHZWZMEUSA-N 378.428 5.136 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c(C)n1Cc1ccccc1 813210950 BQDDVUDOPZUXQW-LJQANCHMSA-N 397.400 5.057 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C(F)=C\C3CCCCC3)n2)cc1 815921938 XVMTVEKWSBIDQD-HJSBDDGSSA-N 379.460 5.292 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C(F)=C/C3CCCCC3)n2)cc1 815921940 XVMTVEKWSBIDQD-RMFUMNGISA-N 379.460 5.292 30 20 GKED C=C(C)[C@H](NCc1ccc(OC(=O)CC)c(OCC)c1)c1ccc(F)c(F)c1 840938806 RRTUHCSPHMVSSQ-QFIPXVFZSA-N 389.442 5.086 30 20 GKED Cc1ccc(CO[C@H](C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 860479067 IPCHZCUQSAKTMA-CJNGLKHVSA-N 384.888 5.040 30 20 GKED C(=NNCc1cccc2cccnc12)c1ccc(-c2nc3ccccc3s2)o1 915959310 LXAIXAIECHKBIA-UHFFFAOYSA-N 384.464 5.228 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc1C(C)C 916847627 NEHKHGMBQLFDGK-MAUKXSAKSA-N 378.497 5.372 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccccc2Cl)cc1 916947451 KPPZGBCKJMUBGK-KXBFYZLASA-N 382.891 5.134 30 20 GKED Cc1cc(Cl)ccc1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917042350 AEYQKPDVTVNBEP-CYBMUJFWSA-N 391.279 5.167 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1O 917605251 QXPRJBZTMKIMAH-CSKARUKUSA-N 395.436 5.324 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 919909999 FYDWLCXBWYCDCH-MRXNPFEDSA-N 391.496 5.912 30 20 GKED CCCCCCOc1ccc(CC(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 920116016 WLQKQUUNDYNSTK-LJQANCHMSA-N 376.456 5.206 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3o2)c(C2CC2)c1 933845388 CZLPUXUCORRWPR-HXUWFJFHSA-N 386.455 5.336 30 20 GKED O=C(/C=C/c1ccc(-n2cnc(C(=O)O)c2)cc1)c1ccc(-c2ccccc2)cc1 1776131409 QCICKHHKMAZCBZ-OVCLIPMQSA-N 394.430 5.134 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c2ccccc12 1776132642 AHSZWIWMQCRBGX-JLHYYAGUSA-N 398.414 5.703 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1cc(F)ccc1Oc1ccc(Cl)cc1C 1776148458 KZPRKAXDIYCALL-KRWDZBQOSA-N 377.843 5.089 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1c(Cl)oc2ccccc12 1776354477 CXZAOHSDMXVHIC-HJWRWDBZSA-N 384.815 5.468 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cccc3cc(Cl)ccc23)c1)C(=O)O 1776471323 OHDKMBACXDXSSX-MSKHEQNASA-N 380.827 5.241 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(SC(F)(F)F)c1 1776783673 BLZUAMVZVQGNNG-OAHLLOKOSA-N 377.472 5.592 30 20 GKED O=C(/C=C/c1cc2cc(Cl)cnc2o1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569480 ZBHWWCGBZQQGLJ-AATRIKPKSA-N 393.782 5.336 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CC4(CC4)c4ccccc4C3=O)cc2)cc1 1777670926 BVMALWRPNCGDCB-QNGOZBTKSA-N 380.443 5.753 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2c2cccs2)cc1 32042406 DROIMEWQRIKOQY-NRFANRHFSA-N 388.492 5.176 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)cc1 44759237 HZVHXYGBBVXSDP-UHFFFAOYSA-N 386.451 5.064 30 20 GKED COc1ccc(-c2nc(CN(Cc3ccc(C#N)cc3)C(C)C)cs2)cc1 58397011 RKDDGWDGEVAUGQ-UHFFFAOYSA-N 377.513 5.101 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)ccc1OC 60949507 AGVXROKVJYTCHO-VWLOTQADSA-N 391.486 5.668 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 66024669 LLYSJZRTKZVDBU-UHFFFAOYSA-N 376.481 5.255 30 20 GKED CCc1ccc(-c2noc(CNc3ccccc3SC[C@@H](C)C#N)n2)cc1 108354450 AJYSZPDIFAFBTR-HNNXBMFYSA-N 378.501 5.163 30 20 GKED Cc1cc(F)c(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1F 122921228 RRWPESZWQYGCND-UHFFFAOYSA-N 392.405 5.171 30 20 GKED C=CCOc1cccc(NC(=O)N(C)CCCc2cc(-c3ccccc3)no2)c1 123400627 AWKCGQKUCAHFSH-UHFFFAOYSA-N 391.471 5.003 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)cc2)C2CCCC2)cc1OCCCC#N 147227629 PHBHQUHUTIYVDJ-XMMPIXPASA-N 396.506 5.538 30 20 GKED COc1ccc(CNc2cccc(CC(F)(F)F)c2)cc1OCCCC#N 151802738 PEAFZMXTSOKMSB-UHFFFAOYSA-N 378.394 5.095 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 171698898 CGXFCCPSYAZHTD-GOSISDBHSA-N 376.456 5.017 30 20 GKED Cc1nc(Cl)sc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 177545767 XDLXNZSEGKYDEZ-UHFFFAOYSA-N 397.887 5.002 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 182144006 JGHBRWDSCQJTRP-KGLIPLIRSA-N 376.378 5.129 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@@H](C)c3nc4ccccc4o3)o2)cc1 182380060 KSKXYNHGPIIVET-ZDUSSCGKSA-N 379.441 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O 188069358 DIJPZXVZUISKFZ-HXUWFJFHSA-N 396.918 5.184 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C2SCCS2)c1 192842824 ALZZEOWXSPHFSC-UHFFFAOYSA-N 376.572 5.447 30 20 GKED CN(CCC#N)c1ccc(CN[C@H](Cc2ccccc2)c2ccccc2F)cc1 237210021 LCQYPDOOXJKGGE-RUZDIDTESA-N 387.502 5.249 30 20 GKED N#CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccccc2)CC3)CC1 255007288 ULXVAQZSERVZQI-CAPFRKAQSA-N 393.490 5.097 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1 303028693 WSKSSDNCKNQFTR-UHFFFAOYSA-N 387.421 5.177 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)CC1CCCCC1 303537857 IZCOCQQEBZHZGK-KRWDZBQOSA-N 377.488 5.599 30 20 GKED CC(C)n1nccc1[C@H]1OCC[C@@H]1/N=C(/O)C1CCC(c2ccccc2)CC1 329070442 YNEKQBZOZSUCCD-IRIHCNEDSA-N 381.520 5.225 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@H](C)CC3)c1C1CC1 410980682 GIGPOXGXJXOUOK-OLZOCXBDSA-N 382.533 5.213 30 20 GKED Cc1ccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)c(OCC2CC2)c1 431301773 WUXJOMWWZCTHGA-QFIPXVFZSA-N 391.515 5.018 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccc(F)cc2)C1 432095266 PUTCNCDUSXIJFA-DOTOQJQBSA-N 383.492 5.099 30 20 GKED C[C@H](NC(=O)C1(c2ccc(C#N)cc2)CC1)c1cccc(OCc2ccccc2)c1 433728358 BGNPDCQFBMQEMA-IBGZPJMESA-N 396.490 5.046 30 20 GKED N#Cc1ccc(CN2CCC[C@@H]2c2nc3ccccc3s2)c(OC(F)F)c1 433947915 BNWCTZKEMMESIT-MRXNPFEDSA-N 385.439 5.106 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 438660749 NPPKVTVXFNZROK-DOTOQJQBSA-N 399.491 5.285 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccccc1 440245457 QBKGKAGRSOQXQC-QFIPXVFZSA-N 397.469 5.464 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1 441663211 OCMXXLFUWDJPGD-VIQWUECVSA-N 393.556 5.991 30 20 GKED CC[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 458396468 NYYJWBFFDWHZKL-HOTGVXAUSA-N 375.925 5.587 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCCc2c(F)cc(F)cc21)c1ccccc1 458835179 JVZOPCSPFYNCSZ-SFTDATJTSA-N 383.442 5.077 30 20 GKED N#CCCN(C(=O)c1csc(-c2ccccc2)n1)C12CC3CC(CC(C3)C1)C2 460462000 RTQSCDSMEOKCLI-UHFFFAOYSA-N 391.540 5.135 30 20 GKED Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Sc1nc(C(F)(F)F)ccc1C#N 461727407 ONACCNHMTLSYLR-SNVBAGLBSA-N 399.825 5.053 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 463769886 KVAYODNKRZPMCF-CQSZACIVSA-N 393.468 5.157 30 20 GKED CO[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 466172752 DKRALPPYFBVSOX-HMXCVIKNSA-N 397.906 5.075 30 20 GKED CC#CCCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 466428548 OHKAYBPBPYTGAF-UHFFFAOYSA-N 380.341 5.164 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc2ccccc2s1 469212726 JMVUBFYGVQUWME-MRXNPFEDSA-N 389.524 5.657 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cc(F)ccc3Oc3ccccc3)o2)c1 471635527 OEPWNXOSBOBOSD-UHFFFAOYSA-N 386.386 5.152 30 20 GKED O=C(CCC(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474258287 IERZQNQAUMLEJI-JTQLQIEISA-N 381.238 5.158 30 20 GKED N#CC[C@@H](CC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1)c1ccccc1 475115194 VNTPKQXRUHYMOX-FQEVSTJZSA-N 390.433 5.258 30 20 GKED CCOc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c(C(F)(F)F)c1 475183192 PFKNEQWJJDCCDP-UHFFFAOYSA-N 376.378 5.158 30 20 GKED CCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1ccc(Cl)cc1 477027292 UWGHJEURPPHSKO-UHFFFAOYSA-N 392.890 5.142 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(NCCc3ccccc3)cc2)cc1 479400445 RICFQLIRSSDIGI-UHFFFAOYSA-N 383.495 5.395 30 20 GKED COc1ccccc1SCC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 479774832 BXVDJGZFKQKPGN-UHFFFAOYSA-N 390.464 5.090 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483234771 MVNFUYWDYUYPQX-IBGZPJMESA-N 383.476 5.081 30 20 GKED C=CCSc1ccccc1C(=O)NCCc1csc(-c2ccccc2)n1 485460528 AGBMCQHVKUQNTB-UHFFFAOYSA-N 380.538 5.061 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](C)c1ccc2ncsc2c1)c1ccc(F)c(F)c1 486255719 KRBVXXHXRQUASU-CWTRNNRKSA-N 387.455 5.252 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 488846511 TXPIRYBFEVUFKZ-QGZVFWFLSA-N 391.446 5.087 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3ccc(C#N)cc3Cl)c12 494607315 DRQXDZSEUNGBDA-UHFFFAOYSA-N 380.835 5.001 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(-c3ccc(Cl)cc3)c[nH]2)c1 495075559 SJGIPMZWLWAAMC-UHFFFAOYSA-N 379.847 5.270 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cccc(Oc2ccncc2)c1 496426852 BYBCRTTWMQHPJS-UHFFFAOYSA-N 385.467 5.044 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Oc3nncc4ccccc34)cc2)cc1 498601134 FZXNNYCWZHIXRW-UHFFFAOYSA-N 397.434 5.239 30 20 GKED CC(C)(CNCc1cn(CCC#N)nc1-c1ccccc1)c1ccc(Cl)cc1 500142821 JSNOOGDHZWDXLV-UHFFFAOYSA-N 392.934 5.185 30 20 GKED Cc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1Br 502357705 BMNWXQDKWNQRET-UHFFFAOYSA-N 388.265 5.084 30 20 GKED CCC[C@H]1C[C@H](C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 502799522 RZULCDBMUSBWTH-IRLDBZIGSA-N 394.490 5.134 30 20 GKED C=CCn1c(SCCOc2ccc(C(C)C)c(C)c2)nnc1-c1cccnc1 503748853 PDILFCCTPZFRIY-UHFFFAOYSA-N 394.544 5.129 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ccc(OC)cc1)C1CC1 504003284 RCNCXWCIMFYYBR-LJQANCHMSA-N 390.936 5.259 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3csc(C)n3)n2)o1 504562663 DRDPEDFHVWQTQZ-UHFFFAOYSA-N 395.431 5.598 30 20 GKED Cc1cc(C)c(C#N)c(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)n1 505605114 DBPLFLHULXQQBR-UHFFFAOYSA-N 393.494 5.094 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](C)C1CCCCC1 508927240 LUZXPHOMCDJORD-INIZCTEOSA-N 377.488 5.599 30 20 GKED CC(C)(C)[C@@H]1CCc2sc(-c3nnc(SCCCCC#N)o3)cc2C1 509956156 GPCPLDLRUYDKNZ-CQSZACIVSA-N 375.563 5.735 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H](C)CC[C@H]2C)cc1 510094263 SPAOLYDSBFIZER-HZPDHXFCSA-N 379.460 5.011 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 511258594 OBBJENRYDAOZOT-INIZCTEOSA-N 389.430 5.567 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)Sc1nc2c(cc1C#N)CCCC2 515179636 ZNNKXVDZSQMLQW-OAHLLOKOSA-N 393.556 5.076 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 517491698 BYKPQHSMNDVMNO-GFCCVEGCSA-N 382.316 5.051 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@@H](C)c1ccccc1OC(C)C 517629295 JUPHIRYUOWHADI-INIZCTEOSA-N 381.476 5.015 30 20 GKED C[C@H](N[C@H](C)c1ccccc1-n1ccnn1)c1ccc(-c2cccc(C#N)c2)cc1 517765784 IEURJNALZAKFSM-RBUKOAKNSA-N 393.494 5.218 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-c4cnco4)cc3)n2)cc1 518174481 BWMBAHNOFMSSPP-SFHVURJKSA-N 385.448 5.264 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 519424094 RYEBPWBXGIWUOQ-GFCCVEGCSA-N 376.934 5.566 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 520170822 QISHKPHDJOMWMX-NSHDSACASA-N 381.785 5.455 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c(C)n1 523957048 MKIYDGVZEONVIC-UHFFFAOYSA-N 391.858 5.577 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)cc12 525284175 DMGWTRFLYVGJSC-LLVKDONJSA-N 398.557 5.068 30 20 GKED CC(C)(C)[C@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C(F)(F)F 525288884 BKNUTAOBDKLBAL-SFHVURJKSA-N 394.368 5.196 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(C2CCOCC2)c1 529267363 ZKWMUENEKXPSIS-UHFFFAOYSA-N 390.936 5.516 30 20 GKED Cc1cc(C(=O)NC[C@H](C)C#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 530642779 HFICTBZWBBMLDF-OCCSQVGLSA-N 390.314 5.364 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@H]1COc2ccccc21 533170793 WHXGNNDHZDYWCU-KSFYIVLOSA-N 399.450 5.037 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1Cl 535405503 SWRXFLOZKLZUFQ-HNNXBMFYSA-N 382.872 5.271 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC/C=C\c2ccccc2)cc1 539786235 CSEUVFRAXKDWOU-TWGQIWQCSA-N 397.478 5.167 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CCCC2CCOCC2)c1 542184872 HIXRYYDLTXYWOR-UHFFFAOYSA-N 396.918 5.342 30 20 GKED C[C@H]1CN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)c2ccccc21 549816926 CIVMQBIRIZKXPA-KRWDZBQOSA-N 384.504 5.614 30 20 GKED C[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1ccc(-c2cccc(C#N)c2)cc1 569839809 LDYIDIXQOUOUTL-GOSISDBHSA-N 386.499 5.012 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N1CCC(CCC#N)CC1 570282131 DTBACEQNQWTKTC-UHFFFAOYSA-N 397.522 5.295 30 20 GKED N#CCCN(C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)c1ccc(F)cc1 582278240 DRXHRLBQUCDBIW-UHFFFAOYSA-N 397.453 5.389 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@H](NCc1cccc(F)c1C#N)c1ccc(Cl)cc1)C2 589994039 FWFLILXPBRUQFE-SXWKCWPCSA-N 397.925 5.054 30 20 GKED O=C(NCc1ccccc1C(F)(F)F)Nc1cc(C(F)(F)F)ccc1F 590325544 RGFGBOLWZINSCF-UHFFFAOYSA-N 380.263 5.185 30 20 GKED O=C(NCc1ccccc1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 590335950 XPUWRMVYSXGANF-UHFFFAOYSA-N 380.263 5.185 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1coc(C(F)F)c1 599391393 ZKRQCPVYWCHVLS-UHFFFAOYSA-N 390.333 5.494 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(N2CCCCCC2)c1 607219732 XZOFZPIRYRJMCL-UHFFFAOYSA-N 393.531 5.296 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)oc2c1ccc1ccccc12 609068006 DJEWFQXEAZUKJK-UHFFFAOYSA-N 392.361 5.620 30 20 GKED Cc1ccc2[nH]c(C(=O)N[C@@H](C#N)c3ccc(OCc4ccccc4)cc3)cc2c1 609173656 VSCOAHXOHXKJJB-DEOSSOPVSA-N 395.462 5.050 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccc(F)cc1 609600651 QYQIBBCLWHJZKU-HNNXBMFYSA-N 393.468 5.159 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCCSc4ccccc43)c2)cc1 609986228 ALYMVWDYTXWFTI-UHFFFAOYSA-N 385.492 5.444 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(Oc2ccccc2)cc1 610809770 YFLGCPWDNXTCFZ-IBGZPJMESA-N 398.510 5.065 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1OCC 613291225 WOABKNIYZYRPGA-IBGZPJMESA-N 388.467 5.302 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)c2C(C)C)cc1 616871047 ZPFYMIPFCAXVTM-KRWDZBQOSA-N 387.487 5.059 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1cn(Cc2ccccc2)c2ccccc12 618741553 GAWWSXDYKNHQRE-RUZDIDTESA-N 377.491 5.338 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(OC(F)F)cc1OC(F)F 618803765 IPKYIMYKFOHXMC-PIGZYNQJSA-N 394.368 5.099 30 20 GKED CCc1ccc([C@H](NCc2ccc(C#N)c(Cl)c2)c2ccc([N+](=O)[O-])cc2)o1 619755876 XCDBKFBIRABOHX-OAQYLSRUSA-N 395.846 5.154 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccc2ccccc2n1 683806048 BKGAPPIWXQZCDM-INIZCTEOSA-N 393.368 5.242 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)c(C)c1 727980064 CZUGSIWXUONJFX-UHFFFAOYSA-N 387.508 5.563 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1 728698417 JXUDEQSFUFXCLQ-HOFZKYPUSA-N 387.410 5.805 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc2ccccc2c1 733080875 DZTICZRIXMQEKV-KHPPLWFESA-N 386.432 5.768 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nc(-c2ccccc2)ccc1C#N 735233966 GSMIQKWMMZKBKT-UHFFFAOYSA-N 391.883 5.468 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3c[nH]nc3-c3cccs3)c2)s1 740011103 JARYPCNXLJMGGY-UHFFFAOYSA-N 376.510 5.028 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc(Cl)c1O 744866410 UVWMCKRTCFHVPD-ARJAWSKDSA-N 377.676 5.709 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(-c3cccc(C)c3)o2)nc2ccccc21 746159674 JKVFMBRYIIPSFG-HNNXBMFYSA-N 376.485 5.434 30 20 GKED CC(C)(C)n1cc(C#N)c(NC(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)n1 746438934 HJBRQKOJZFQWAU-LUAWRHEFSA-N 394.475 5.029 30 20 GKED CC(C)CN(CCC#N)C(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 751382154 NQOCGZFBRARGSE-PLNGDYQASA-N 392.343 5.136 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)CCC(=O)N3C)o1 754689512 HWEHYCAKRCCPQM-DHZHZOJOSA-N 389.426 5.199 30 20 GKED C[C@@H](CSc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 756242769 OKOUPKVALIMDID-KBXCAEBGSA-N 396.512 5.554 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(-c3cc4ccccc4n3CC#N)n2)nc1 762391926 WVDYCWIJVQAKJJ-UHFFFAOYSA-N 389.484 5.167 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccc(OC(F)F)cc1OC(F)F 767807855 WSWZMFPTDXEMDE-UHFFFAOYSA-N 382.357 5.303 30 20 GKED CCCCN(C)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 770109001 BZGZRQZTYXVEJM-QGZVFWFLSA-N 396.441 5.158 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1noc(C2CCCCC2)n1 772920079 ZUGMGDINMFDLAC-UHFFFAOYSA-N 377.897 5.106 30 20 GKED C=C(C)CN(C)Cn1nc(-c2cccnc2)n(-c2ccccc2C(C)C)c1=S 777961202 VKVZRHJMFVUQOK-UHFFFAOYSA-N 393.560 5.054 30 20 GKED Cc1cc(Br)cc([C@H](C)Nc2cccc(OCCCC#N)c2)c1O 779040625 NQGMMNOFCLIKEG-AWEZNQCLSA-N 389.293 5.319 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CC=C(c3ccc(F)cc3)CC2)ccc1OC 779407846 DADUBGHDCXFNRK-FCHUYYIVSA-N 394.490 5.241 30 20 GKED C#CCCCCCC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 780540811 OACLHIFAKCEDHT-HXUWFJFHSA-N 378.516 5.712 30 20 GKED O=C1/C(=C/c2ccc3cnccc3c2)CCOc2c(Br)cccc21 782329117 YECNIMNUIDWZCC-RVDMUPIBSA-N 380.241 5.046 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc2ccccc12)c1nccc2ccccc12 792097443 WKXGFAOBZJQWLT-QFIPXVFZSA-N 380.447 5.423 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566992 WZRGSDLSCPNWME-RDJZCZTQSA-N 384.545 5.516 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 800829743 UXWNGXCPYABOKI-UHFFFAOYSA-N 392.915 5.315 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 800843612 ACWSCGPLEDFCAA-FQEVSTJZSA-N 387.483 5.199 30 20 GKED N#Cc1cccc([C@@H]2CN(c3cc(C(F)F)nc4ccc(Cl)cc34)CCO2)c1 808009433 GHQJJLJTYIPOEY-FQEVSTJZSA-N 399.828 5.275 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](c3ccccc3)C2)cc1 814576872 IJPZXXPCHFDDSI-ILBGXUMGSA-N 395.506 5.754 30 20 GKED OCCC[C@H]1CCCCC1=NNc1ncnc2scc(-c3ccc(F)cc3)c12 814765692 PSWMATWEWVOHFH-OAHLLOKOSA-N 398.507 5.228 30 20 GKED C[C@@H](NCc1ccnc(Br)c1)c1ccc(-c2cccc(C#N)c2)cc1 815092305 YTIOZDVGGSNMLJ-OAHLLOKOSA-N 392.300 5.234 30 20 GKED COc1ccccc1[C@@H]1C[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 842288872 LSBSSZPMRDOMIT-IPMKNSEASA-N 388.492 5.107 30 20 GKED O=C(O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1CC2(C1)CC2(F)F 850870426 PPPZHCBCENERCL-UHLWVNKISA-N 388.254 5.287 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1cc2c(Cl)cccc2s1 916909310 LVCWXSSDVMYWQJ-NSHDSACASA-N 389.263 5.169 30 20 GKED CN(C(=O)Cc1ccc(N=Cc2cc(Cl)ccc2O)cc1)c1ccccc1 917557971 YCRBPJTVKGFQEN-UHFFFAOYSA-N 378.859 5.002 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccccc2OC2CCCC2)S1 920064564 GJWHGJCKXLHKIH-XSFVSMFZSA-N 392.524 5.516 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cc(F)ccc3F)n2)cc1 920109152 DOZYRNCRQYDMDG-QGZVFWFLSA-N 382.435 5.206 30 20 GKED O=C(O)c1cc2c(C=NNc3ccc(C(F)(F)F)cc3)c(F)ccc2s1 1776052216 QVZDDDVZDRCPLF-UHFFFAOYSA-N 382.338 5.203 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2nc3c(s2)C(C)(C)CC(C)(C)C3)CC1 1776169666 RPFBKIOOFOEVLB-UHFFFAOYSA-N 390.593 5.026 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)Cc1csc(-c2ccc(C(=O)O)cc2)n1 1776180572 QKFIBOGJSPJFGD-UHFFFAOYSA-N 398.915 5.350 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776700110 ZIOUIOMRNQDRKP-FROQITRMSA-N 382.456 6.148 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3cc(C(=O)O)ccc3O)ccc21 1777002789 HABORLRPUPEMPT-FLIBITNWSA-N 385.419 5.114 30 20 GKED CCCCCCCCc1cc(Br)sc1-c1ccc(C=O)s1 1988187937 SSESQANQVPGCOA-UHFFFAOYSA-N 385.392 6.955 30 20 GKED CCOc1ccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c(C)c1 65648945 ICIFTVNIKUEGGK-UHFFFAOYSA-N 386.451 5.097 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(OC(F)F)cc2)nc2ccccc2c1=O 72031355 MGAHVDNMTKTNBW-CYBMUJFWSA-N 388.439 5.037 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Oc2cccnc2)cc1 108200975 OJWMUHZCNDLFTD-UHFFFAOYSA-N 375.453 5.132 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nc(-c2ccc(Cl)cc2)no1 108355369 SXYQIVCAHCRKFX-ZDUSSCGKSA-N 384.892 5.254 30 20 GKED CC(C)c1ncc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)s1 123269000 NCOTWSWVMSDROX-SNVBAGLBSA-N 389.452 5.158 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CCO[C@H](c3ccccc3)C2)c1 157312148 VKLQHBZNPYPUGH-RSXGOPAZSA-N 398.506 5.147 30 20 GKED CCOCCC1(CNC(=O)c2ccccc2Sc2ccccc2C#N)CCC1 160456626 UZLGKNCIZDXMSS-UHFFFAOYSA-N 394.540 5.036 30 20 GKED CC[C@@H](Cc1cccc(Br)c1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 172019801 FUWIVJGPWMJBDL-GOEBONIOSA-N 397.272 5.035 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C1CC1)[C@H](C)C1CC1 176050877 QTAUNPYSMHOLCE-QGZVFWFLSA-N 389.499 5.241 30 20 GKED CC[C@H](Cc1ccccc1Br)C(=O)[C@@H](C#N)c1nc2ccccc2o1 177137098 ZVEKWUOEGGIDFR-UKRRQHHQSA-N 397.272 5.035 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cc(F)ccc1SCC(F)F 184032905 WVKQURSOOQZTEY-LLVKDONJSA-N 395.406 5.118 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1)c1ccccc1 188068360 PHUZGOQGPBPTQD-NEKDWFFYSA-N 395.568 5.566 30 20 GKED Cc1c(Cl)cccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 193824486 HDTAPCMTBMCXHQ-MRXNPFEDSA-N 377.856 5.134 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 247169245 JJZDLCHWPJQVEU-AOIWGVFYSA-N 379.529 5.348 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)CC1 272578285 SZPPIPNUXOOAGZ-UHFFFAOYSA-N 376.485 5.121 30 20 GKED C=CCN(C(=O)c1cc(C)nc2cc(Br)ccc12)c1ccccc1 302977279 PFACZWJEGFPZSG-UHFFFAOYSA-N 381.273 5.139 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303386892 XKAYGCUKMNWHJD-UHFFFAOYSA-N 391.858 5.668 30 20 GKED N#CCOc1ccc(CC(=O)N(Cc2cccc3ccccc23)C2CCCC2)cc1 303415151 BAQWBULZEVRCHB-UHFFFAOYSA-N 398.506 5.256 30 20 GKED C[C@@H](/N=C(/O)C1CCCC1)C(O)=Nc1ccc(N2CCCCC2)c2ncccc12 328821316 RDBPACOVTDXXDM-MRXNPFEDSA-N 394.519 5.348 30 20 GKED CC(C)n1c([C@H](C)/N=C(/O)[C@@H]2C[C@]23CCOc2ccccc23)nc2ccccc21 329692484 GVXAOBAAEVVNBK-KEWLPNKHSA-N 389.499 5.375 30 20 GKED CCc1ccccc1C/C(O)=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1 329825406 IGHCKOOVKCZGHW-IBGZPJMESA-N 397.519 5.232 30 20 GKED C[C@@H]1C(=O)CC[C@H](C(O)=Nc2nnc([C@@H]3CCCc4ccccc43)s2)C1(C)C 330319399 DEUVRIPVHVEKIC-KBRIMQKVSA-N 397.544 5.236 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCCC2(C#N)CCOCC2)C1 410413320 KHFIUNXGWKPEEC-APWZRJJASA-N 380.454 5.189 30 20 GKED C=CCC[C@@H](C(=O)Nc1cnn(-c2cc(C)ccn2)c1CCC)c1ccccc1 427927079 YJCSFVCGOIPOSL-HXUWFJFHSA-N 388.515 5.217 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc4nc(C5CC5)oc4c3)o2)cc1 430526303 RMXSMJHIGHBRIX-UHFFFAOYSA-N 399.406 5.001 30 20 GKED CN(c1ccccc1)c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cn1 430641229 LQFHARALNXIPTG-KRWDZBQOSA-N 390.512 5.094 30 20 GKED C=C(C)COCCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 430821758 MYGCRBYWGVYLGT-UHFFFAOYSA-N 397.302 5.094 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccc(F)cc12 436349948 FESMQTHOLDPWST-QPPBQGQZSA-N 399.469 5.163 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2csc(C)n2)cc1 440877590 FDSRAPPQAXFGBN-UHFFFAOYSA-N 376.525 6.223 30 20 GKED CO[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)[C@@H](C)C1 440911562 ATMJVVWVEQFDRA-KBXCAEBGSA-N 399.878 5.035 30 20 GKED CC[C@@H](N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 447540422 JDBXCCBXCQVMTJ-ISKFKSNPSA-N 398.485 5.529 30 20 GKED C=CCC[C@H](NC(=O)N1CC[C@H](OCC)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 454706463 KAXSTBTWQVFEAT-SNRMKQJTSA-N 398.469 5.169 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)c1 455906862 OIGNOYQWUZVPEB-IBGZPJMESA-N 387.405 5.531 30 20 GKED COc1ccc(-c2ccc(NC(=O)[C@H](C)c3cccc(C#N)c3)nc2)cc1Cl 462334707 RTQIFJOMQHZOBX-CQSZACIVSA-N 391.858 5.024 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1csc(-c2ccccc2F)n1 462813469 MHUHXWXEZSSBBP-HNNXBMFYSA-N 381.476 5.805 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2cccc(F)c2F)CC1 475553513 KUDWVMHXKAJZAM-UHFFFAOYSA-N 399.485 5.171 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ncc(C(F)(F)F)s3)c2)cc1 475855179 ROBAISUJDUSQSC-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(F)cc(Br)cc1F 476158690 PFCMIXNKGUHIGY-UHFFFAOYSA-N 394.259 5.832 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1-c1c(F)cccc1F)c1ccccc1 476874563 YPWWWSVSWTZMKE-KRWDZBQOSA-N 376.406 5.658 30 20 GKED C=CCC1(C(=O)NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)CCC1 478837066 JNRDAZZVPSORDH-UHFFFAOYSA-N 377.488 5.002 30 20 GKED C=CCC1(C(=O)Nc2cccc(CNC(=O)Nc3ccccc3Cl)c2)CCC1 479857570 CXFGSPPUUDJAPO-UHFFFAOYSA-N 397.906 5.347 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN[C@@H](C)c2cccc(C#N)c2)on1 481266946 FBZSMAVHVOMXJV-INIZCTEOSA-N 383.451 5.226 30 20 GKED N#CC[C@@H](CC(=O)Nc1nc(-c2ccc(F)c(F)c2)cs1)c1ccccc1 483094221 XXVIXDJPRHDHQC-AWEZNQCLSA-N 383.423 5.114 30 20 GKED N#CCCC[C@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccccc1 487601562 IOYZYBNFYOCMFZ-QFIPXVFZSA-N 390.458 5.570 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](COC)c1ccc(Cl)cc1 489090452 VQRDPQRWCFECOU-FQEVSTJZSA-N 386.923 5.701 30 20 GKED CC[C@@H](Nc1ccccc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 498251846 FFCZKCMLZWQTTR-HSZRJFAPSA-N 399.494 5.275 30 20 GKED CC(C)c1ccccc1OCCC(=O)Nc1ccccc1SC[C@H](C)C#N 502050031 LYJRUQIPFARIIC-QGZVFWFLSA-N 382.529 5.469 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3ccccc3o2)cc1 505620294 NHLZXSBTVWZINJ-UHFFFAOYSA-N 384.391 5.358 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(C#N)cc1 510371271 GIEQCNQAKYFTFK-UHFFFAOYSA-N 385.398 5.028 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2nccc3ccccc23)cc1 510602742 QPUGICSUTLTDQK-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@H](C)c2cc(C)sc2C)cc1 510723286 ZEODYOFKTDJAAZ-MRXNPFEDSA-N 397.544 5.062 30 20 GKED COc1cc(-n2cccc2)c(Cl)cc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 510780518 KGMSZUCANNFSMT-UHFFFAOYSA-N 393.874 5.193 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 511992881 DQVPRQAFQPYROV-BDJLRTHQSA-N 391.324 5.159 30 20 GKED O=C(c1cc(F)cc(C(F)(F)F)c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513520428 VBCAJZKUQVQLKE-ZDUSSCGKSA-N 383.307 5.039 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(C(F)(F)F)cc1 513522572 ZMRLWOGZXUJRAE-UHFFFAOYSA-N 380.414 5.093 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1 518039093 DPEOMCPDAJMTBM-UHFFFAOYSA-N 388.370 5.438 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1csc(-c2ccc(Cl)cc2)n1 518650273 GHUCBRGYPOQGNB-UHFFFAOYSA-N 384.892 5.144 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1C(F)(F)F 520196241 HLIHTDITIWZQDP-UHFFFAOYSA-N 388.842 5.318 30 20 GKED C[C@H](Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)C(=O)Nc1cccc(C#N)c1 521726444 NLXVOILEHJFCKD-STSQHVNTSA-N 391.515 5.093 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)S[C@H](C)c1ccc(C#N)cc1 522842288 OQPGBWCQZSZNMW-KGLIPLIRSA-N 388.920 5.350 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)c1nc(-c2cccc(C(F)(F)F)c2)no1 524986842 NOFBHMDDSFSFIJ-SNVBAGLBSA-N 393.365 5.619 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(F)cc(C)cc1Cl 529251596 ACSRMWKMCWASNR-UHFFFAOYSA-N 378.879 5.175 30 20 GKED COc1ccccc1[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccccc1Cl 538396551 OOWTYNNWFJWBRE-MWTRTKDXSA-N 376.887 5.660 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)Nc1cccc(OCCCC#N)c1 538526341 CVRWEBXBSFEGLL-HNNXBMFYSA-N 395.503 6.113 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 540632189 FWVNIIOFEHHQMT-HOTGVXAUSA-N 378.419 5.047 30 20 GKED C[C@H](NC(=O)N[C@@H]1CCCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 542076823 QLWAERAWLKJVNL-MGPUTAFESA-N 383.442 5.163 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nc(-c2ccccc2)no1 543861457 RFWMTUIAYNMCPE-MSOLQXFVSA-N 394.478 5.687 30 20 GKED C[C@@H](NCc1cnc2ccc(C#N)cn12)c1ccc(-c2ccc(Cl)cc2)s1 556599050 WWRKQDOXXYBKCN-CQSZACIVSA-N 392.915 5.439 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(-c2ccc(Br)cc2)s1 557998345 WBALEVCOLWGVMX-UHFFFAOYSA-N 391.334 5.237 30 20 GKED CC[C@@](C)(C#N)c1nc(-c2ccc(Oc3cccc(Cl)c3Cl)nc2)no1 561903316 NLPBIWHJZDYYTD-SFHVURJKSA-N 389.242 5.422 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c2C#N)[C@@H](C)C1 562699419 WYVYLEFGHWHASP-HEHGZKQESA-N 378.497 5.004 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1cnc2ccccc2c1 571824515 NIFMSMSCOOZFFN-UHFFFAOYSA-N 391.474 5.272 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@@H]1C1CC1 579221503 TUNPUZGOEFAWPQ-TZIWHRDSSA-N 393.918 5.648 30 20 GKED CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)CCCCCC#N 588255749 UPAKNZZAVNRTIJ-UHFFFAOYSA-N 392.528 5.033 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(Oc2cccnc2)cc1 589002571 JTLNVQRKWZHEFT-AWEZNQCLSA-N 392.846 5.282 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1Cl 590880747 QXPCKNVZZGGGNC-GFCCVEGCSA-N 394.805 5.767 30 20 GKED CC(C)n1c([C@H]2CCCN2C(=O)CC2(C#N)CCCCC2)nc2ccccc21 597330332 SAOXYYNOIJQNAL-HXUWFJFHSA-N 378.520 5.145 30 20 GKED N#C[C@H](C(=O)c1ccc2nc(C(F)F)[nH]c2c1)c1nc(-c2ccccc2)cs1 601432883 PZQGCZHUMHPXBL-CYBMUJFWSA-N 394.406 5.114 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nnc(-c2ccsc2)s1 604118755 HHCQVSMDHUJAIQ-UHFFFAOYSA-N 388.477 5.058 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)ccc1NC(=O)CC(C)C 608552730 ALJYXTGAVFQXCA-IBGZPJMESA-N 385.467 5.018 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(C#N)cc1F 609254348 KLIZEJDUGNTJLR-UHFFFAOYSA-N 394.277 5.124 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)Cc1ccc(Cl)cc1 609378364 GRLHCHINZAQPSV-UHFFFAOYSA-N 398.837 5.546 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccc(F)cc2)CCC1 609436742 SJJVIKOOEWWGAQ-INIZCTEOSA-N 397.519 5.463 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)cc1C#N 610231507 MTOSRSQQFKOOGQ-UHFFFAOYSA-N 395.390 5.012 30 20 GKED CC(C)[C@H](CNC(=O)c1c(Cl)cc(C#N)cc1Cl)Cc1ccccc1 615889482 KAWMAUUGWUOUDY-INIZCTEOSA-N 375.299 5.110 30 20 GKED O=C(c1cc2ccc(F)cc2s1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618300931 HRHZMQGGVCATTN-NXEZZACHSA-N 399.331 5.243 30 20 GKED Cc1sc(Br)c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c1C 669600139 OGVVZUMPSAKOOY-ZDUSSCGKSA-N 385.286 5.166 30 20 GKED C=CC[C@H](C(=O)N(C)CCCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 681658631 HSBQGOIEIMEMEQ-QFIPXVFZSA-N 392.474 5.232 30 20 GKED N#C[C@@H](C(=O)c1ncsc1-c1ccccc1)c1nc2cc(F)ccc2s1 682126880 KLAOWZIDJMEPFB-ZDUSSCGKSA-N 379.441 5.049 30 20 GKED N#CCCCOc1cccc(/C=C2/COc3c(ccc(Cl)c3Cl)C2=O)c1 726743444 HQMPSXVFRKPNQD-UVTDQMKNSA-N 388.250 5.335 30 20 GKED CCCOc1ccc(C=NOCc2nc(-c3ccsc3)oc2C)cc1OC 726787871 UOXUGXLKWYNSDF-UHFFFAOYSA-N 386.473 5.060 30 20 GKED CCC[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc(C(F)(F)F)c1 726797667 OULPKKSVBCQAAR-NRFANRHFSA-N 389.465 5.686 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cccc(OC)c2)CC3)cc1 727780665 RRKMDGLGNCDESC-FOWTUZBSSA-N 377.465 5.040 30 20 GKED CCc1oc2ccccc2c1C=Nn1cnnc1SCc1ccc(Cl)cc1 730553142 USSYKQZXAANXAE-UHFFFAOYSA-N 396.903 5.415 30 20 GKED C=CCCO[C@H](C)C(=O)O[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 734731111 XLMFLRJVIWAWNW-UONOGXRCSA-N 379.909 5.357 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 737477290 FUVPNTPJHGSMSC-CYBMUJFWSA-N 377.362 5.075 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCc2c[nH]c3ccc(C)cc23)c1 746246090 YBGLVNJXAHTSIW-UHFFFAOYSA-N 382.463 5.217 30 20 GKED C=C(C)COc1cc(/C=C/C(=O)c2sccc2Br)ccc1OC 747064005 SIYSMHMMWHICAB-GQCTYLIASA-N 393.302 5.370 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2)nc1 748606991 OBWBURMNJJIOAJ-NRFANRHFSA-N 386.455 5.349 30 20 GKED Cc1ccc(Sc2ccc(/C=C/C(=O)c3ccnc(O)c3)cc2[N+](=O)[O-])cc1 752877049 MCBMEWKYTKIFEJ-XBXARRHUSA-N 392.436 5.051 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 763547941 IGKTUJRWVINQDQ-BEFAXECRSA-N 376.406 5.362 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(-c2ccco2)s1 766258231 XPZNWHFZBVCOJA-MRXNPFEDSA-N 392.480 5.094 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc(Cl)nc3)n2)cc1 772642460 XLFGERLQVYHIAU-LWAXHKBTSA-N 379.872 5.057 30 20 GKED Cc1cc(C)c(N2CC[C@H](Nc3ccccc3S[C@H](C)CC#N)C2=O)c(C)c1 788796540 FVKPCAJHTBPCTE-QUCCMNQESA-N 393.556 5.224 30 20 GKED N#C[C@@H](C(=O)c1nc(Cl)cs1)c1nc(-c2ccc(Cl)cc2)cs1 789405783 MOLSEPWJZHPQIX-JTQLQIEISA-N 380.281 5.063 30 20 GKED COc1ccccc1-c1ncc(/C=C2\Cc3cc(Cl)cc(Cl)c3C2=O)cn1 792885598 HPGNFNWHCLMLFG-MKMNVTDBSA-N 397.261 5.281 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 798432942 RBGIZBDJGWORKP-UONOGXRCSA-N 392.446 5.699 30 20 GKED CC(C)c1ccc([C@H](NC(=O)COc2cccc(C#N)c2)c2cccs2)cc1 800690481 XXISNUQKCLUWGP-QHCPKHFHSA-N 390.508 5.028 30 20 GKED CCOC1CC(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 805857105 NLXNRRZACCTASM-OVGLSYRBSA-N 395.311 5.108 30 20 GKED C#CC[C@H](Cc1ccccc1)NC(=O)Nc1cccc(COC(C)(C)C)c1C 806328676 JITKTVRTICTKID-OAQYLSRUSA-N 378.516 5.066 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 813057340 JYXQZKAMTULGFZ-HNAYVOBHSA-N 384.888 5.230 30 20 GKED N#C[C@@H](C(=O)CC(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813218198 SWYJSOXKXSTSPS-HXUWFJFHSA-N 394.396 5.499 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)cc1 836269793 JBNUABJFRRGNNW-KHFRZORUSA-N 383.495 5.018 30 20 GKED O=C(c1cccc(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)c1)C(F)(F)F 839537803 ACEHJSXGAJBHOM-HNNXBMFYSA-N 393.302 5.354 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CC(C1CCC1)C1CCC1 860470920 XIZMGPWENHNLLG-OAQYLSRUSA-N 380.532 5.065 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2)CC1)c1nc2cc(C(F)(F)F)ccc2s1 917043804 OVWICPARQKRXPL-AWEZNQCLSA-N 386.398 5.223 30 20 GKED CCC/C(C)=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 920324806 VADQXOUJIPCIPP-SMJHDNPOSA-N 379.312 6.040 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805616 DQRFFGDENSBMAO-NRMKIYEFSA-N 380.419 5.368 30 20 GKED CC(=NNc1ccc(C(=O)O)nc1)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776072655 HRKKFBLPNKDLDA-UHFFFAOYSA-N 379.504 5.137 30 20 GKED O=C(/C=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccc(F)cc1F 1776125483 JUTFNQRUIFXBDY-RUCTVCJSSA-N 394.373 5.066 30 20 GKED C=CCC[C@H]1CCCN1Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)O 1776170872 XFGLSNNHBWTKDL-IBGZPJMESA-N 386.495 5.531 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O 1776200109 UFLSWAFCVXOSAR-JQNIQIFBSA-N 384.378 5.073 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776388579 IVCJALPJCLOVOV-BNCCVWRVSA-N 386.447 5.735 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2ncc(C(=O)O)c(C(C)C)n2)cc1 1776785432 AAETYSPJBNMENM-QINSGFPZSA-N 396.531 6.208 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CC4(CC4)c4ccccc4C3=O)o2)cc1O 1777670983 MLZPEQZMWZUPQJ-RVDMUPIBSA-N 386.403 5.052 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CSc4c(F)cccc4C3=O)s2)c1 1777684367 WHJHXXAZDGDETR-UVTDQMKNSA-N 396.464 5.624 30 20 GKED C=CCc1cc(CN2CCC[C@H](c3nc4ccccc4s3)C2)c(O)c(OC)c1 38390201 KRGKFJQYWGOYNL-KRWDZBQOSA-N 394.540 5.119 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 46507693 FJFRMHMVWVVTGJ-OAQYLSRUSA-N 398.462 5.035 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 55569421 IOULIPGEBRVAKY-UHFFFAOYSA-N 381.435 5.160 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1c(F)cccc1F 66903741 OLOGLCULYYWLLN-AWEZNQCLSA-N 393.393 5.068 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3sccc3C3CC3)c2)cc1 67203072 AIKDNNQIPZROEO-UHFFFAOYSA-N 388.492 5.523 30 20 GKED C=CCn1c(S[C@H](C)c2nc(CCCC)no2)nnc1-c1cccc(C)c1 97120455 YNZOVDJDKYUPJA-OAHLLOKOSA-N 383.521 5.018 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc(F)c(F)c(F)c2)cc1 102996019 PKWBKNNYXJPDST-UHFFFAOYSA-N 396.368 5.001 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC(C)(C)c1nccs1 116491997 LFSGKVBAAGOACP-UHFFFAOYSA-N 392.484 5.172 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccc(C#N)cc1 122720610 HSGFGQIZMNLXED-CQSZACIVSA-N 387.405 5.012 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1 176517940 LIPPRWCXEHRODR-GOSISDBHSA-N 394.459 5.076 30 20 GKED COC(=O)Nc1cc(NCc2ccc(-c3ccccc3C#N)cc2)ccc1F 178363951 DYTFHNIAJISKMR-UHFFFAOYSA-N 375.403 5.155 30 20 GKED Cc1cc2c(F)c(OCC(=O)Nc3ccccc3S[C@H](C)CC#N)ccc2[nH]1 184960310 XHPFQDDHOIRCPZ-CQSZACIVSA-N 397.475 5.027 30 20 GKED N#C[C@H](NC(=O)c1scnc1C1CCCC1)c1cccc(Cl)c1Cl 185280018 KBKYHNSJPLGGJD-ZDUSSCGKSA-N 380.300 5.102 30 20 GKED COc1cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)ccc1F 187622524 BEMGBAZGNLCWBV-UHFFFAOYSA-N 392.455 5.251 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/Cc1oc2ccc(F)cc2c1C 328882842 MAEWCUIRFKWXRY-ZDUSSCGKSA-N 388.464 5.044 30 20 GKED OC(=Nc1cccc(F)c1)C1CCN(/C(O)=N/[C@@H]2CC[C@@H]3CCC[C@@H]3C2)CC1 329823286 ZLCOWTZHDWFJER-XAUMDUMWSA-N 387.499 5.009 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(C(F)(F)F)cc1 329966357 RUHMAKIALVIVMT-VWDMACCTSA-N 382.426 5.648 30 20 GKED N#CC1(CCCN[C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)CCOCC1 367532188 YGJFFYOJOWYQPY-RBUKOAKNSA-N 380.454 5.032 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 409672724 JTWDPKGHEZFIPB-UHFFFAOYSA-N 378.428 5.464 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1CCCC(F)(F)C1 426119952 MHOOGAYJCYPZFN-SFHVURJKSA-N 399.441 5.145 30 20 GKED Cc1c(C(=O)Nc2ccc(Br)cc2F)sc2ccc(C#N)cc12 431256803 AXODQUXGXXHCPF-UHFFFAOYSA-N 389.249 5.235 30 20 GKED CN(Cc1cccc(C#N)c1)Cc1csc(-c2ccc(Br)cc2)n1 431389203 XHIVBCKORMJBAV-UHFFFAOYSA-N 398.329 5.076 30 20 GKED N#Cc1cnc(C(=O)Nc2ccccc2Oc2ccccc2Cl)c(Cl)c1 431585647 FZFQBIOXFHHAAN-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)c2)o1 432976655 JGUXXSBETWJBKS-UHFFFAOYSA-N 385.467 5.632 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC2CCC3(CC2)CC3)cc1 434296530 BSNSHDJRGDODNE-UHFFFAOYSA-N 376.525 5.303 30 20 GKED Cc1cccc(N(Cc2ccccc2)Cc2nnc(-c3cccc(C#N)c3)o2)c1 434483769 WDHVDPXJLWZKPM-UHFFFAOYSA-N 380.451 5.124 30 20 GKED CC1=C(C(=O)Nc2ncc(Cc3ccc(C#N)cc3C(F)(F)F)s2)CCC1 437290345 RIGQNAMHOARPKM-UHFFFAOYSA-N 391.418 5.063 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(C#N)cc2Cl)cc1 439426270 ASSGSEATSMJOIL-INIZCTEOSA-N 376.887 5.738 30 20 GKED COc1ccc2cc(CNC(=O)c3cn(CCCC#N)c4ccccc34)ccc2c1 443909383 RIJSKZYSWQXNMA-UHFFFAOYSA-N 397.478 5.037 30 20 GKED N#CCSc1ccccc1NC(=O)CSC1CCC(C(F)(F)F)CC1 451035886 JKHQSBDMBJMCBF-UHFFFAOYSA-N 388.480 5.095 30 20 GKED C=CCC1(NC(=O)Nc2ccc(F)c(NC(=O)c3ccoc3C)c2)CCCCC1 454428071 KLHJEVGZQBLYOI-UHFFFAOYSA-N 399.466 5.380 30 20 GKED CC[C@@H](CC(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 457469950 YCJDVJGEGKJACR-GUYCJALGSA-N 376.834 5.615 30 20 GKED N#Cc1cccc(CNC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)c1 463320099 YGSFZMBNZKADMJ-UHFFFAOYSA-N 397.261 5.587 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1Br)c1cccc(C#N)c1 464488909 CNAPTMBTEYPTFD-JTQLQIEISA-N 397.194 5.082 30 20 GKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467690468 FWEZNMBEZFEMTO-HNAYVOBHSA-N 397.906 5.443 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(F)(F)F)c1C 473824729 OTSNFEPQKNUJOM-UHFFFAOYSA-N 375.394 5.330 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)cc1 476667270 KCPSSXRYAUVUHI-FBRRREGBSA-N 378.541 5.647 30 20 GKED C=C(C)[C@@H](NC(=O)c1ccc(OC)c(-c2ccccn2)c1)c1ccc(F)c(F)c1 478920225 FMZLDFOFSAAUGG-JOCHJYFZSA-N 394.421 5.083 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1C 482781174 RSHRUNMPRWNJQT-HNNXBMFYSA-N 390.512 5.438 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2)cn1 483208064 YAXLJPXOIPSTOI-QHCPKHFHSA-N 393.446 5.007 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 487487887 SWMCJTRRRJIDCH-DEOSSOPVSA-N 398.506 5.917 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccccc1 487531884 FFRXRLMOTOIXDI-HXUWFJFHSA-N 393.874 5.089 30 20 GKED C=CC[C@H](C(=O)Nc1nc(-c2ccc(NC(C)=O)cc2)cs1)c1ccccc1 487600170 WVZILNBKNZHESF-IBGZPJMESA-N 391.496 5.067 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccnc(SCC(F)(F)F)c1 496394791 NBUYXGMUAKKDEJ-UHFFFAOYSA-N 398.303 5.146 30 20 GKED Cc1cc2cc(N[C@@H](C)C(=O)Nc3sc4c(c3C#N)CCCCC4)ccc2[nH]1 500262333 GUOQNVNEHZKFLI-AWEZNQCLSA-N 392.528 5.118 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1ccc2[nH]ccc2c1 508232195 KHALPLIVKCBOGV-UHFFFAOYSA-N 397.503 5.163 30 20 GKED CC(C)c1ccc(N(C(=O)CSCC#N)c2nc3ccccc3s2)cc1 508325069 LONLLUJNZDXAIZ-UHFFFAOYSA-N 381.526 5.341 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H](C)CC[C@H]1C 510103235 IIEMDXHSYGEPQD-FUHWJXTLSA-N 377.488 5.098 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)Nc1cc(C#N)cn1C(C)(C)C 510290762 OAVRQMVOYXSKRN-UHFFFAOYSA-N 387.487 5.053 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 511258596 OBBJENRYDAOZOT-MRXNPFEDSA-N 389.430 5.567 30 20 GKED Cc1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c(OCc2ccccc2)c1 511500102 VWWFMVIRXFLKIV-SFHVURJKSA-N 385.467 5.328 30 20 GKED C[C@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)cc1F 512661042 PSBHQKBGRDZGFC-AOMKIAJQSA-N 378.422 5.307 30 20 GKED COc1ccc(-c2ccc(C)c(NC(=O)C[C@H](CC#N)c3ccccc3)c2)cn1 512990676 FTHJPSNMHZHEDX-FQEVSTJZSA-N 385.467 5.092 30 20 GKED C[C@H](NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(F)cncc1F 513090883 WXWHDBYFVUITAG-QMMMGPOBSA-N 384.270 5.248 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CCc1ccccc1)c1ccccc1 515901482 TYBAZXLYZBPMGA-DEOSSOPVSA-N 383.495 5.074 30 20 GKED C[C@H](S[C@@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccccc1C#N 519948473 CEYFIVLXNVYUJX-STQMWFEESA-N 394.418 5.278 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2cnc(C3CCCC3)s2)CC1 532009983 MHGKSTJXAJAAAP-UHFFFAOYSA-N 381.545 5.152 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)c1 536767893 KXECAVJPZFKYQO-LJQANCHMSA-N 381.435 5.119 30 20 GKED CSc1ccc(C)c(NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1 539438682 LEZRYNYSNDSAHA-UHFFFAOYSA-N 394.525 5.280 30 20 GKED CCO[C@H](C)c1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 543873895 PDEPYWLEUNWSPC-DLBZAZTESA-N 391.540 5.630 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cccc4cnccc34)no2)c2ccccc21 545696524 UDFXFAIIFQEITI-MDZDMXLPSA-N 391.434 5.324 30 20 GKED C=CCC[C@H](NC(=O)C[C@H]1C[C@@H](C(C)=O)C1(C)C)c1ccc(C(F)(F)F)cc1 546122966 FXHRWQMQDHUMEU-QYZOEREBSA-N 395.465 5.470 30 20 GKED C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555005099 GYYLRUCVJMKZKP-UZUQRXQVSA-N 398.466 5.155 30 20 GKED CCN(C(=O)Cc1ccc(NC2CCC(C)(C#N)CC2)cc1)c1ccccc1 568714266 PRLPIYVYJBXSHN-UHFFFAOYSA-N 375.516 5.167 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@H](Cc1ccccc1)C(F)(F)F 570135233 KFVDVIWZHSECMG-INIZCTEOSA-N 379.447 5.116 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2cccc(Cl)c2)CC1 570252469 NWPUGRYBVNBZPF-CQSZACIVSA-N 385.920 5.545 30 20 GKED CC(=O)c1cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)ccc1C 570637824 XWAWFVTYCUUFAR-UHFFFAOYSA-N 398.462 5.095 30 20 GKED N#CCCn1cc(CNc2ccc(Oc3ccccc3)cc2)c(-c2ccncc2)n1 588924940 BLEOWDMSAAESCW-UHFFFAOYSA-N 395.466 5.263 30 20 GKED N#CCCCCCC(=O)Nc1ccnc(Oc2ccccc2Br)c1 588929712 AYMGKHTYIWBJHA-UHFFFAOYSA-N 388.265 5.049 30 20 GKED CC(C)(c1ccc(C(=O)N(CC#N)c2ccc(Cl)cc2)cc1)C(F)(F)F 592650966 DBYMMZSEBMFPLK-UHFFFAOYSA-N 380.797 5.350 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)c(C(F)(F)F)c1 596710730 FCQFRAGCFSFISW-UONOGXRCSA-N 399.482 5.754 30 20 GKED CCOc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603673271 VHWGLVIWRRCSCH-HXUWFJFHSA-N 390.870 5.646 30 20 GKED Cc1ccc(CC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1C 603814543 WHVBWRVBIPBPRF-UHFFFAOYSA-N 384.479 5.130 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 608553033 LBGPKJXBABCPSZ-QGZVFWFLSA-N 380.444 5.270 30 20 GKED COc1cccc([C@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609209989 ZOZSVJHYYCYITK-INIZCTEOSA-N 387.439 5.242 30 20 GKED N#CCn1c(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)cc2ccccc21 609228570 YVTHYIVVQUMOOK-UHFFFAOYSA-N 393.315 5.071 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 609377331 TUACAHKMGTWXEK-SJORKVTESA-N 382.529 5.469 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1N[C@@H](C#N)Cc1ccccc1 609387073 JGWQQTALHKYCCO-MRXNPFEDSA-N 375.419 5.258 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)C[C@H](c2ccccc2)C(F)(F)F)cc1 609413550 XJTYNIJPXSQFKM-LJQANCHMSA-N 390.405 5.068 30 20 GKED CCCCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@@H](C)CCC 609502034 PQTNPSSBAJXXQR-SFHVURJKSA-N 379.504 5.567 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(OC3CCCCC3)cc2)c1 609711823 VQIBRDLHUFTFRW-UHFFFAOYSA-N 393.487 5.725 30 20 GKED CC(C)(C)c1ccc(OCCCn2cc(C#N)c(=O)c3cc(Cl)ccc32)cc1 609962229 LRLSJIVHDBNHSY-UHFFFAOYSA-N 394.902 5.293 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610352642 VGWXZTKQBITUKV-ROUUACIJSA-N 399.494 5.355 30 20 GKED Fc1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1F 657300918 WHOTWXLGJUARBK-RKDXNWHRSA-N 379.266 5.103 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCC3)cc1 669961313 WXAZOJNVAKSNLV-CQSZACIVSA-N 380.513 5.079 30 20 GKED Fc1cc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 678296302 ALNMHFGWAXADJV-GHMZBOCLSA-N 383.229 5.017 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728390046 DZXGMALOZKAXAO-JOCHJYFZSA-N 379.504 5.011 30 20 GKED N#CCN(C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)C1CC1 729263222 OYIINRAXVJIKTH-UHFFFAOYSA-N 380.447 5.061 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2cc(F)ccc2s1 730418042 WWLSPZGXCVWDKA-NSHDSACASA-N 379.243 5.161 30 20 GKED Cc1cc(C(=O)N[C@@](C)(C#N)C2CCCCC2)c(C)n1[C@H](C)c1ccccc1 734238776 PSKINIMKWLZXBW-KOSHJBKYSA-N 377.532 5.307 30 20 GKED CC[C@H](NC(=S)Nc1ccccc1S[C@H](C)CC#N)c1cccs1 734379196 DYEIFGDQWRXXDE-KGLIPLIRSA-N 375.588 5.580 30 20 GKED C=CC[C@@H](NCc1sc(Sc2ccccc2)nc1Cl)c1ccncc1 734510833 ZWNDWYUIXMWPRE-MRXNPFEDSA-N 387.961 5.750 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](CCC)c1ccc(Cl)c(Cl)c1)c1ccncc1 734664412 VPOWMEHZHYMSGZ-RTBURBONSA-N 392.330 5.846 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1)c1ccncc1 734684365 VFXZSKHXEJRDLT-HYBUGGRVSA-N 385.511 5.672 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCSc3ccccc3)c2)s1 739594874 SHAUDRJFKHODGI-UHFFFAOYSA-N 378.522 5.085 30 20 GKED C=CCN(Cc1ccccc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740484584 PYIRWMXPQCWTIB-UHFFFAOYSA-N 387.508 5.185 30 20 GKED CC(C)[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 740531431 UBTZXENPQSFRES-DLBZAZTESA-N 382.916 5.641 30 20 GKED Cc1c(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cccc1[N+](=O)[O-] 742262202 WTKFHADFXWUZOK-UHFFFAOYSA-N 391.402 5.105 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2SCCc3ccccc32)cc1 742537634 MVEWUHHIPUJXDR-PKTZIBPZSA-N 384.504 5.311 30 20 GKED Cc1ccc(O[C@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 743093909 ZKLLOCQBTBENLY-NTKDMRAZSA-N 399.494 5.240 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)cc1 743294207 DOYSMCKMEMQNDN-ZLNRFVROSA-N 385.442 5.159 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 746523549 RYLLMDIBDAADTC-BBRMVZONSA-N 391.298 5.094 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)CCC(=O)N3C)o1 754689518 HWEHYCAKRCCPQM-FLIBITNWSA-N 389.426 5.199 30 20 GKED Cc1ccc(NC(=O)c2nnc(/C(Cl)=C/c3ccc(C#N)c(C)c3)s2)cc1 766488706 BFPBSDUCDDKCHO-YVLHZVERSA-N 394.887 5.016 30 20 GKED O=C(/C=C/c1cncc(Br)c1)c1ccc(SCC(F)F)cc1 767359450 GJWUGLOGTFZKGU-LZCJLJQNSA-N 384.245 5.097 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2ccc(C#N)cc2Cl)c1 769729341 HMPAUGXEPCXQHE-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCCc2nc(-c3ccncc3)cs2)cc1 773003908 IBIRUZIWTMGBAR-INIZCTEOSA-N 399.947 5.230 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](CC2CCC2)c2ccccc2)ccc1OC 776165404 QDEYFABXURPDCD-VXKWHMMOSA-N 378.516 5.397 30 20 GKED CC(C)(C#N)CCCOC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 783543888 UJXDJVRVWDMSAP-UHFFFAOYSA-N 384.423 5.121 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCCCC(C)(C)C#N 784042037 WPHFEBANAKENHK-CYBMUJFWSA-N 376.909 5.242 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1c[nH]c2ccccc12 786354851 KDYVANFATMDHDJ-WMLDXEAASA-N 386.480 5.056 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)C1 788097400 VPJYQHJYCHLKHF-JOYOIKCWSA-N 384.502 5.381 30 20 GKED N#C[C@H](C(=O)Cc1cc(Cl)ccc1Br)c1ccc2ccccc2n1 790768251 UKHPYTDIVXDBOU-HNNXBMFYSA-N 399.675 5.070 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cnc3ccccc3c2)cc1 796630242 OTTMIOAKQUREBI-VGOFRKELSA-N 399.494 5.028 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2cccc(Br)c2)s1 797567388 HLNXVOWUFYYTBM-AWEZNQCLSA-N 391.334 5.012 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3sc4c(c3C#N)CCCCC4)cc2c1 809738184 SQCHUEUXQAICEH-UHFFFAOYSA-N 391.496 5.006 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1sc(-c2ccccc2F)nc1C 814710848 XPSOYDADMPPMBO-UHFFFAOYSA-N 394.397 5.508 30 20 GKED Cc1nc(SC2CCCC2)sc1CC(=O)N(C)[C@H](C)c1cccc(C#N)c1 819736373 FJEWGKRTSLJUQY-OAHLLOKOSA-N 399.585 5.120 30 20 GKED Cc1nc(C)c(/C=C2\CC(c3ccccc3)C/C(=C\c3oc(C)nc3C)C2=O)o1 821028610 USTRFRNULGVLPC-ZIOPAAQOSA-N 388.467 5.510 30 20 GKED N#C[C@H](C(=O)C1(C(F)(F)F)CCCCC1)c1nc2ccccc2n1C(F)F 850770089 XGAWQBAQQKJHIG-LLVKDONJSA-N 385.336 5.120 30 20 GKED CC(C)Oc1ccccc1C=NOCc1ccc(C(=O)Nc2ccccc2)cc1 852289183 KQXXKQDLFPDQJM-UHFFFAOYSA-N 388.467 5.277 30 20 GKED C=C(C)CN(CC)C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 890930523 RNXVJTOMYBCAME-UHFFFAOYSA-N 387.508 5.550 30 20 GKED N#CCCCCOC(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 915032861 ZKAXVIVEZQFAQD-UHFFFAOYSA-N 391.254 5.096 30 20 GKED Cc1cc(C)c(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 915087983 GAQYSOYODRKMBE-HSZRJFAPSA-N 384.479 5.285 30 20 GKED O=[N+]([O-])c1cc(Cl)ccc1NN=Cc1c(-c2ccccc2)nc2sccn12 915976246 QQUGPHGHCYEDDL-UHFFFAOYSA-N 397.847 5.070 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3ccc(F)cc3s2)cc1 916914621 OXAIDCWDVPOFTB-SFHVURJKSA-N 394.471 5.344 30 20 GKED Cc1ccc2c(C)cc(NN=C3CCC4(CC3)C(=O)Nc3ccccc34)nc2c1C 917542904 XPSOCUJGSZRLQP-UHFFFAOYSA-N 398.510 5.392 30 20 GKED CCCCCCOc1ccc(CC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 920106352 OOFBWRFNXDUYOQ-JOCHJYFZSA-N 386.495 5.613 30 20 GKED N#C[C@H](C(=O)Cn1ccc2ccc(Cl)cc21)c1nc(-c2ccccc2)cs1 920113234 CLYGKLZUEVXFGZ-QGZVFWFLSA-N 391.883 5.295 30 20 GKED C=CCN(C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1)C(C)C 920920778 KINZNSWKAQMKLH-LJQANCHMSA-N 387.321 5.145 30 20 GKED O=C(O)C(=O)/C(=C\c1cccc(-c2ccccc2)c1)c1ccc2ccccc2n1 1776116473 SUZKVWWPJGTRJL-PGMHBOJBSA-N 379.415 5.096 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccsc3)cc2)c1)C(=O)O 1776470737 FUJSYFPYVKFUJL-YYRKOSNBSA-N 378.449 5.163 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2ccccc21 1776526451 CJXZTFOOGOSUJO-LGMDPLHJSA-N 388.488 6.061 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)ccc1Br 1776782873 IMKWIBUXNSCSAG-OAHLLOKOSA-N 390.749 5.396 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(OCC)c1OCCC 1776784046 UUQXQFXPHXPALN-LJQANCHMSA-N 379.541 5.168 30 20 GKED CCCCCCCOc1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776785930 SPLBYZQNCMOGAU-SDXDJHTJSA-N 396.483 5.848 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)[C@H]2CCc3ccccc32)c1 1776788209 YSTRARGQMUGCLV-ZEQRLZLVSA-N 395.543 5.309 30 20 GKED CCCCCCCOc1cccc(/C=C\c2ccc3cc(C(=O)O)ccc3n2)c1 1776788963 FSCSWEAMLALKQH-RAXLEYEMSA-N 389.495 6.453 30 20 GKED Cc1c(/C=C2\CSc3c(Cl)cccc3C2=O)nc2ccccc2c1C(=O)O 1777414213 NHCXXOLKTRPBAT-FMIVXFBMSA-N 395.867 5.267 30 20 GKED O=C(/C=C\c1cc2cc(Br)ccc2s1)c1csc(C(=O)O)c1 1777569347 GTFKEQJAUIFMIB-IHWYPQMZSA-N 393.283 5.320 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc(OC3CCCC3)c1)C2=O 1777683108 QYPGZPKAHCGJOU-AQTBWJFISA-N 376.452 5.309 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)CCc3ncc(-c4ccccc4)o3)cc2)cc1 11328867 PMIZRAGTGYZOQW-UHFFFAOYSA-N 394.430 5.418 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC(C)C)c1ccccc1 63400539 SROHTUGDGGCGJO-OAQYLSRUSA-N 381.476 5.080 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@H]1c1cccc2ccccc12 180078439 ASRUMUCZLWYYEW-JTSKRJEESA-N 385.467 5.500 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 184578369 SFNJNEXNNMDBQU-HTAPYJJXSA-N 398.466 5.361 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCCc1cccs1 187567343 HYUZDJGGXYIOEA-CQSZACIVSA-N 376.572 5.057 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)[C@H]2C[C@H]2C)c1 189899552 FNDRHMVYHRANMR-IERDGZPVSA-N 376.500 5.385 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 303017100 QCAZEAICKIIJSP-OAHLLOKOSA-N 377.444 5.317 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 303058388 XKIWMJCLVFKNFI-UHFFFAOYSA-N 393.556 5.955 30 20 GKED O=C(c1ccc(Cl)c2ncccc12)N1CCC(/N=C(/O)C2CCCCC2)CC1 328789910 LDKDIMDTZLAKGJ-UHFFFAOYSA-N 399.922 5.030 30 20 GKED C/N=C(/O)c1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1Br 329494913 DILZXECSIJVERG-MELADBBJSA-N 393.325 5.578 30 20 GKED C[C@H](/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cc2ccccc2o1 329498843 JVYQGFQUCMAYST-HNAYVOBHSA-N 377.488 5.882 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(Cl)c1Cl 330021705 YHANFEOXFFSPAK-XGNXJENSSA-N 383.319 5.936 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCO2)N1CCCC[C@H]1c1ccc(F)cc1 330099295 CXQVKKVLXVOIQE-KRWDZBQOSA-N 390.842 5.023 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccncc3)cc2)c1 363365456 LSMQBMULZOSIQI-JOCHJYFZSA-N 384.439 5.115 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 409509442 WRVXIUSJXCUWKO-UHFFFAOYSA-N 378.428 5.464 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 410974325 XRIVUCOSWHMNQU-JKSUJKDBSA-N 378.781 5.167 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cc(F)ccc1Oc1ccccc1 426059520 FIZHXKFIPKACHC-UHFFFAOYSA-N 379.391 5.159 30 20 GKED N#Cc1c(F)ccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1Cl 431581619 BXKMFKUQBXSBCM-GZTJUZNOSA-N 379.778 5.243 30 20 GKED Cc1oc(C#N)cc1C(=O)N(C)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 436196242 UUPBYOOZXNSFQI-FQEVSTJZSA-N 382.822 5.114 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(-c2nccs2)cc1 437563366 XEWGIBOQHBUGTR-VQTJNVASSA-N 388.496 5.114 30 20 GKED C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438641590 MSNQYJCYQAYPIT-SNVBAGLBSA-N 383.320 5.080 30 20 GKED CC[C@@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1nc(C)cs1 444678649 XNZZKHRKKNUVPX-OAQYLSRUSA-N 375.541 5.392 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)N(C)CC(C)(C)C#N 458340816 CBZSZKMPBLVQKQ-ZDUSSCGKSA-N 390.940 5.024 30 20 GKED C[C@@H](C(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)c1cccc(C#N)c1 461799365 WCAOKICEIPRVLW-CYBMUJFWSA-N 381.888 5.001 30 20 GKED Cc1csc(C(C)(C)NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)n1 464960061 CRQIBZMCNQRWEY-UHFFFAOYSA-N 391.496 5.089 30 20 GKED CO[C@]1(C)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 471204545 YVUGNIGWKOFNAO-DENIHFKCSA-N 397.906 5.028 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 471280460 UKVZGQGCWDFJBX-AYBZRNKSSA-N 397.519 5.678 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2SCc2cccs2)n1 474445741 NFLUHZLPQUXKSM-MRXNPFEDSA-N 398.578 6.110 30 20 GKED CC[C@@H](CC#N)NC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 475002016 QFWWJFCUAJTEQY-JTQLQIEISA-N 399.360 5.174 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(NC(=O)NCCC)cc1 476785826 LOMNULIOSAFENG-UHFFFAOYSA-N 393.531 5.251 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1 485655836 ICQILTNAOJPQPN-UHFFFAOYSA-N 394.446 5.375 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(SCc2cccnc2)cc1 485758249 WEVMAUJJCLKOPU-UHFFFAOYSA-N 392.549 5.904 30 20 GKED Cc1ccc(C)n1C1CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 486068731 KQBVMCNUOPDLQG-UHFFFAOYSA-N 399.494 5.246 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl)c1c[nH]c2ccccc12 486436355 SXDDPTJFAFMPQY-KZULUSFZSA-N 386.282 5.349 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)F)ccc1Cl 497394252 UTKDSWFCWFPCJG-UHFFFAOYSA-N 377.822 5.593 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 497771423 LYCPMPJRWGLANF-XMMPIXPASA-N 383.495 5.342 30 20 GKED CCSc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 504185196 PNQCEZQIPAMSSY-UHFFFAOYSA-N 378.453 5.095 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(C)(C)c2ccccc2Cl)cc1 504319342 ZRBCFQYFKRPOAH-UHFFFAOYSA-N 396.918 5.071 30 20 GKED N#C[C@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccccc1Cl 505627584 AGVVDQANTFFZMI-ORBWHLTESA-N 396.840 5.170 30 20 GKED CCN(C(=O)COc1ccccc1-c1ccccc1)[C@H](C)c1ccc(C#N)cc1 509607609 IALUCERFTLNYCM-LJQANCHMSA-N 384.479 5.214 30 20 GKED N#Cc1ccsc1C(=O)N(Cc1ccccc1C(F)(F)F)C1CCCC1 511874589 NBHSTQRQPNEUGD-UHFFFAOYSA-N 378.419 5.224 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 516307048 IVACTIJWLVSECN-IAGOWNOFSA-N 389.524 5.750 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2ccc(OCC3CCCCC3)cc2)nc2ccccc21 517795776 UILYWXKWJGSZHT-FQEVSTJZSA-N 387.483 5.022 30 20 GKED C=CC[C@H](C)NC(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 523968246 HHAUXXSNMIPARH-ZDUSSCGKSA-N 382.533 5.052 30 20 GKED CCCCn1c(S[C@H](C#N)C2CCCCC2)nnc1-c1ccc(OC)cc1 524533811 OZNIBZLPINOFMF-LJQANCHMSA-N 384.549 5.318 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2cccc(F)c2)CC1 529077316 BAXZLOYIJSVHSK-UHFFFAOYSA-N 396.506 5.753 30 20 GKED COc1cc(CSCc2nc(C)cs2)ccc1OCc1cccc(C#N)c1 531515827 SJCVSNLKYBZARW-UHFFFAOYSA-N 396.537 5.344 30 20 GKED N#CCc1ccc(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)cc1 536108382 LYTUGEMMLXKZGA-UHFFFAOYSA-N 391.471 5.069 30 20 GKED N#CCC[C@H](NC(=O)NC1(c2ccc(F)cc2F)CCCC1)c1ccccc1 536317659 ZICHTEZXIJELPE-FQEVSTJZSA-N 383.442 5.078 30 20 GKED Cc1cnc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541121186 ZOULNQMCMQQQDL-JKSUJKDBSA-N 390.512 5.112 30 20 GKED COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)Nc2ccc(C#N)cc2)c1 542192133 JMSSQLHOPRFJIA-ZEQRLZLVSA-N 397.478 5.330 30 20 GKED N#CCC1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CC1 542910253 ZYPXRGMAANEIFD-UHFFFAOYSA-N 389.474 5.059 30 20 GKED COc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@H](CCCC#N)c1ccccc1 551206066 PDVTVAIYWGDZHC-VQIMIIECSA-N 399.922 5.090 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(Oc2ccc(Cl)cc2)CC1 551575824 OJBPWEYHWFGIDZ-CQSZACIVSA-N 386.904 5.142 30 20 GKED C=CCn1c(S[C@H](c2ccc(Cl)cc2)C2CCOCC2)nnc1C1CC1 559189250 HPJPJLNPVMQBAR-GOSISDBHSA-N 389.952 5.255 30 20 GKED Cn1ccnc1[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(Cl)cc1 571852930 VLGAIYIEGRLXSM-FCHUYYIVSA-N 390.918 5.092 30 20 GKED C[C@@H](NCc1ncc(-c2ccccc2)[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 581766014 NHZACRUVEQLMDR-GOSISDBHSA-N 378.479 5.466 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C)c(OC)cc1Cl 582988754 PZBHCDYMCJGLOE-UHFFFAOYSA-N 390.915 5.045 30 20 GKED N#CCCC1CCN(C(=O)c2ccccc2OCc2ccccc2Cl)CC1 584471705 PGTDQGDRZGPTAF-UHFFFAOYSA-N 382.891 5.075 30 20 GKED C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)CCCCCC#N 588940026 WNARZPJVPFIDGU-CYBMUJFWSA-N 379.291 5.212 30 20 GKED CC1(C)C[C@@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)c2cc(F)ccc2O1 593407714 UUKOICYNPULUGM-VQTJNVASSA-N 395.478 5.162 30 20 GKED Cc1ccc(C)c(Sc2ccc(NC(=O)CC3(C#N)CCOCC3)cc2)c1 596652631 WBDCNLKBLJREIL-UHFFFAOYSA-N 380.513 5.104 30 20 GKED C=CCn1c(SCc2ccc(SC)c(OC)c2)nnc1-c1ccccc1 597490662 CUJOYGACLOEXTL-UHFFFAOYSA-N 383.542 5.154 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)Nc2sc3c(c2C#N)CCCC3)s1 600841086 JJGAUZMLTSOEMB-UHFFFAOYSA-N 399.566 5.173 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(-c4ccc(F)cc4)o3)cn2)c1 603623389 ITCJOCUCNPUSQK-UHFFFAOYSA-N 399.381 5.397 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2)n1 603968557 BBYITCVNZZEQLS-UHFFFAOYSA-N 384.464 5.033 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc(COCC)c1 606776843 ZOADTRAALTYBFM-UHFFFAOYSA-N 379.378 5.059 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C(C)(C)c2ccc3ccccc3c2)cc1 607885128 XYLAAHXHKBKXJO-UHFFFAOYSA-N 387.483 5.064 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 608825740 RYCNZSDZGCNMCR-VIFPVBQESA-N 375.708 5.530 30 20 GKED Cc1ccc(COc2ccc(C[C@H](C)NC(=O)c3cccc(CC#N)c3)cc2)cc1 608901503 YCLPENMBVVEBIM-FQEVSTJZSA-N 398.506 5.001 30 20 GKED CCCN(C(=O)c1ccc(F)cc1Br)c1cc(Cl)ccc1C#N 609286266 QTFUCOMGBJEZOJ-UHFFFAOYSA-N 395.659 5.170 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3Cc3ccccc3)cc2)cc1 609514133 BVNHQPSDQBIIBG-QHCPKHFHSA-N 396.490 5.392 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(NC4CCCC4)c3)cc2)nc1 609806108 LFQAWWWYYYAEIB-UHFFFAOYSA-N 398.466 5.352 30 20 GKED C[C@H](NC(=O)NCC1(Sc2ccccc2)CCCC1)c1cccc(C#N)c1 610355436 QNOSLBWNZGWMJC-KRWDZBQOSA-N 379.529 5.024 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 611303307 OCTALQMJNKKIRE-HNNXBMFYSA-N 390.418 5.076 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)ccc1OCCC(C)C 613290352 DEUUCJZUANZBKY-IBGZPJMESA-N 388.467 5.158 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 613407336 QVLQKDNYRZRHET-NSHDSACASA-N 399.884 5.465 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(CSc3ccc(Cl)cc3)no2)cc1 615131304 JBAMDFLGNURYNV-SFHVURJKSA-N 396.903 5.228 30 20 GKED Cc1cc(F)ccc1NC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 642422354 JRRLREQRHBHQJY-NXEZZACHSA-N 386.311 5.165 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 660940989 RLJNSZORWRGFCD-IUODEOHRSA-N 383.439 5.230 30 20 GKED C=CC[C@@H](C(=O)N(C)CCCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 681658630 HSBQGOIEIMEMEQ-JOCHJYFZSA-N 392.474 5.232 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 727784215 BYDNHHLHTNPVQQ-VXGBXAGGSA-N 396.657 5.236 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 727955660 MIXVRWQZWFOFID-QRWLVFNGSA-N 390.508 5.361 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 727957132 MAHVNDJDRCWRFP-CJNGLKHVSA-N 396.462 5.631 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1-n1cccc1 731332537 NWSXJFQXLPFVTJ-KRWDZBQOSA-N 375.497 5.432 30 20 GKED C[C@H](SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1 731939475 MCXLKSHRYBJAFU-KBXCAEBGSA-N 396.512 5.620 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 732878953 ULFYQWKSTAVGKK-HSZRJFAPSA-N 384.483 5.180 30 20 GKED FC(F)(F)c1cccc(NN=Cc2sc(Oc3ccccc3)nc2Cl)n1 739421082 CLRPPIAGCNMUKH-UHFFFAOYSA-N 398.797 5.449 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(C)c(NC(=O)OC(C)(C)C)c2)C(C)C)c1 742673389 RPYSOPMCGHUUDP-UHFFFAOYSA-N 392.499 5.379 30 20 GKED COc1cc(/C=C\C(=O)c2oc3ccccc3c2C)cc(Br)c1O 747138501 FLJKJFRGGSNTCD-FPLPWBNLSA-N 387.229 5.114 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)ON=Cc1ccccc1C(F)(F)F 749351218 BSJOUANBHCACHY-AWEZNQCLSA-N 378.394 5.207 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(Br)c(Br)c2)s1 762437957 JBUITIXEZIEAFW-GORDUTHDSA-N 397.091 5.041 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC2CC(c3cccc(Br)c3)C2)c1 762612418 LHWBVDHHBIXWAB-LYBXBRPPSA-N 399.332 5.166 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cncc(Br)c1 767363281 YLQFJNNYULZLNO-BQYQJAHWSA-N 385.286 5.172 30 20 GKED N#Cc1cc(/C=C(/Cl)c2nc(O)c3ccc(C(F)(F)F)cc3n2)ccc1F 770565807 JSNHZCJJKCLQLU-AWNIVKPZSA-N 393.727 5.102 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)c4cccc(CC#N)c4)cc3C2)cc1 772499181 ZIBITISUOBRVPU-UHFFFAOYSA-N 395.506 5.649 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc(C)c2)c1 772644371 HIAQSSUXSKBQDW-JOCHJYFZSA-N 398.462 5.022 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3c(Cl)cc(C)cc32)c1 772982286 BPWIBVOZHWAVPJ-LAUBAEHRSA-N 384.907 5.333 30 20 GKED N#C[C@@H](C(=O)C1CCC(C(F)(F)F)CC1)c1nc2cc(Cl)ccc2s1 774056441 SJBATKLTSNPWFN-CBINBANVSA-N 386.826 5.495 30 20 GKED Cc1cc(/C=C/C(=O)c2ccnc(Cl)c2)cc(C)c1OCc1ccccn1 779460685 RTIJAZOWHKUGSW-VOTSOKGWSA-N 378.859 5.222 30 20 GKED CCN(Cc1ccccc1)c1ccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780149746 RCXMRWHGYIFTJG-IBGZPJMESA-N 399.494 5.256 30 20 GKED CC(C)Cn1ccc2cc(NC(=O)Nc3ccccc3O[C@@H](C)C#N)ccc21 780542831 VTFPHEXVRWJLNV-INIZCTEOSA-N 376.460 5.232 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1nccc2ccccc12 792104936 SJCXBMHHYAMDBO-SQNIBIBYSA-N 381.262 5.522 30 20 GKED COc1ccc(N(CCC(C)C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 795016384 FATCSTPWPJUYSH-UHFFFAOYSA-N 387.936 5.470 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3[C@H](C)[C@H]3c3ccccc3)n2)cc1 797551302 NBWVHVPTKFRXMV-MLCUKSTJSA-N 388.492 5.045 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2csc3ccccc23)cc1 812442700 HPOGXSUNPQGNAH-UHFFFAOYSA-N 384.917 5.321 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](Oc2ccc(Cl)cc2)C(C)C)n1 813072954 QHDCUQRWPUBXIT-QAPCUYQASA-N 376.909 5.200 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(Cl)s1 839392734 PWEGLSIVEZSFCJ-UHFFFAOYSA-N 385.901 5.031 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)c1nc2cc(Cl)ccc2s1 850771697 WMNXALOFVQTSNC-IJLUTSLNSA-N 386.826 5.495 30 20 GKED CCCCOc1ccc(C=NOCc2cc(F)cc3cccnc23)cc1OC 914683394 GZPLRWUIURUHFE-UHFFFAOYSA-N 382.435 5.112 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)cc2Cl)cc1 915086439 KYDHOOHAUPMFRN-HXUWFJFHSA-N 395.289 5.830 30 20 GKED CCCCCCCCCC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 915708956 MLHQJQXVUDLUSJ-UHFFFAOYSA-N 379.491 5.527 30 20 GKED O=C(/C=C/c1cc(Br)ccc1OC(F)F)c1ccc(F)cc1F 916128057 IWPAVHGFDWIOSN-ORCRQEGFSA-N 389.142 5.225 30 20 GKED O=C(/C=C/c1ccc(N2CCOCC2)cc1)c1cc2c(ccc3ccccc32)o1 916131724 LWBCYNUTKWZHNH-YRNVUSSQSA-N 383.447 5.319 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SC(F)(F)F)c1nc2ccccc2s1 916847330 CJBYBBGMFHOGHX-NSHDSACASA-N 378.400 5.398 30 20 GKED Cc1cc(C)n([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 916975251 AZXAWMASYJTVBI-PBHICJAKSA-N 398.919 5.104 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026854 PVXJVSQRWLKLLV-HOCLYGCPSA-N 396.899 5.416 30 20 GKED CCOC(=O)Nc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043465 IURGBXLNDWQXFY-CQSZACIVSA-N 399.859 5.008 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3sccc3s2)cc1 918486111 CTOBGFTXEDITPA-DOMZBBRYSA-N 382.510 5.437 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccccc3C(F)(F)F)s2)cc1 1776033229 QISCUVRSZHYIJZ-UHFFFAOYSA-N 390.386 5.578 30 20 GKED CCCCCCCOc1cccc(/C=C/C(=O)c2ccc(C(=O)O)cc2O)c1 1776788951 DNJUHFPEZAFEBR-JLHYYAGUSA-N 382.456 5.336 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(F)cc2)=C(/S)Nc2ccc(C)cc2)cc1 10173110 RNWOMNRXYNBQCJ-UHFFFAOYSA-O 393.507 5.035 30 20 GKED N#Cc1ccc(Oc2ccc3c(-c4ccccc4)cc(=O)oc3c2)c([N+](=O)[O-])c1 18056050 ZFLFSNIRBQMWGQ-UHFFFAOYSA-N 384.347 5.032 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3)o2)nnc1-c1cccc(C)c1 22582127 ZDJPOWOINFNVOE-UHFFFAOYSA-N 388.496 5.387 30 20 GKED Cc1nn(CC(C)C)c(C)c1CCC(=O)Nc1ccccc1S[C@@H](C)CC#N 66802026 CSHDBJQBSUGHEW-INIZCTEOSA-N 398.576 5.122 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 120787073 PHSSOHVIYAKYCW-WMZOPIPTSA-N 378.501 5.247 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2nc(-c3ccncc3)cs2)ccc1OC 124113564 LQWXWDCCOARLBV-MRXNPFEDSA-N 395.528 5.019 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 128084813 XRMVMOHDDGKIFD-UHFFFAOYSA-N 390.251 5.366 30 20 GKED N#CCC[C@@H](NC(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccccc1 153539884 IRAXIQIDWGECLK-LJQANCHMSA-N 395.915 5.167 30 20 GKED COc1ccc2cccc(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)c2c1 153801023 HADLUAVAKCCNDV-INIZCTEOSA-N 390.508 5.424 30 20 GKED CCCCc1ccc(NC(=O)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 159335747 OKDAWBCFXFODLU-MRXNPFEDSA-N 395.528 5.001 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1F 178710313 JLTPKYGQMQHCPQ-FZMZJTMJSA-N 389.352 5.080 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)n1 187234169 UNDWNGDFJYJJKZ-GFCCVEGCSA-N 392.358 5.100 30 20 GKED C=CCc1cc(CNCc2cnc(-c3ccc(C)cc3)s2)cc(OC)c1OC 237295533 SXKGBNYIJYUNIO-UHFFFAOYSA-N 394.540 5.154 30 20 GKED C[C@H]1C[C@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 245739599 GAFMCFXHAFINGN-DOHHPOSVSA-N 382.891 5.138 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC[C@H]1c1ccccc1 246766052 QYSUQUJGTOGCCV-QWFCFKBJSA-N 393.556 5.738 30 20 GKED Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 247210613 RUGFNVDYWHRUGR-WIYYLYMNSA-N 393.556 5.165 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc(Cl)s3)n2)cc1 255010072 XCCVCZLMKNCGGC-ZQMJAJRESA-N 395.896 5.286 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)cc1 255714181 SZSAAHWDRSDULR-UHFFFAOYSA-N 384.357 5.004 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@H](c3c(Cl)cccc3Cl)C3CC3)o2)cc1 289749348 KYPSBTROTGCARS-IBGZPJMESA-N 399.281 5.156 30 20 GKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 301075712 DFSHUMBAQJZWJT-CQSZACIVSA-N 377.394 5.262 30 20 GKED CC(=O)c1ccc(C#N)c(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c1 302094654 IMLYQXJSQZPEDK-UHFFFAOYSA-N 395.915 5.408 30 20 GKED CC[C@H](CC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 303214270 PUKZSKJWKUCFQD-GOSISDBHSA-N 375.497 5.128 30 20 GKED CC(C)Cc1noc(-c2cc(Cl)ccc2N=C(O)[C@H]2CCC(=O)[C@H](C)C2)n1 329368883 JIAHQEOLRSVXJB-OLZOCXBDSA-N 389.883 5.182 30 20 GKED O/C(=N/[C@H]1CCCCC12CCCC2)C1CCN(c2nc3ccccc3o2)CC1 329751391 VPHSEONATQNRAU-FQEVSTJZSA-N 381.520 5.504 30 20 GKED OC(=Nc1ccccc1SC1CCCC1)C1CCC(/N=C(/O)C2CC2)CC1 329988136 GTWKVWQEQDEKBC-UHFFFAOYSA-N 386.561 6.235 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)C1 430096146 DKAKOIOQJLOTKV-SUMWQHHRSA-N 384.892 5.024 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(Br)ccc1F)c1ccccc1 433157226 LMAHZXRXLWHBGV-MRXNPFEDSA-N 390.256 5.145 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cnc(-c3ccccc3)s2)cc1 437245902 LGYUFYRMJCQDNB-UHFFFAOYSA-N 389.524 5.236 30 20 GKED CC(C)N(Cc1ccco1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438646065 FNEZFVPSWKKMJJ-UHFFFAOYSA-N 393.418 5.525 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)CCCC1(C)C 444838963 OMSWQDSLWKIRTR-SFHVURJKSA-N 389.927 5.065 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(Br)c2COC)CCCC1(C)C 445243481 OCZWWTNYIOMRLU-QGZVFWFLSA-N 395.341 5.194 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3CCCC[C@H]3c3cc4ccccc4[nH]3)on2)c1 447458513 HTWOZAYHPWCTSC-QFIPXVFZSA-N 396.450 5.062 30 20 GKED Fc1cc(-c2ccncc2)ccc1CN(CCC(F)(F)F)CC(F)(F)F 448363658 ROXIREOWLKWKFM-UHFFFAOYSA-N 380.307 5.204 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CCCC2)[C@H]1c1ccccc1)c1ccccc1 458810640 BCIPYRXFWWPUKB-DHIUTWEWSA-N 387.527 5.748 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1CC[C@@H](C(F)(F)F)C2(CCOCC2)C1 459642952 CFULTOVANSAPBR-OAHLLOKOSA-N 399.350 5.026 30 20 GKED Cc1ccc(CC[C@H](C)NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)o1 460534745 SQJJESDBJXUTIT-HNNXBMFYSA-N 392.430 5.142 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)c(F)c1 464705083 HMFKVAKDGOHWLO-QGZVFWFLSA-N 381.209 5.024 30 20 GKED C=C(C)CN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccccc1 470919296 PMBKVSYGZMLCNT-IBGZPJMESA-N 393.556 5.098 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)n1 474448568 SHGNMRWQJBRLPN-LJQANCHMSA-N 386.480 5.372 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1ccccc1 475386892 DQYMPMBEOAUFCM-JOCHJYFZSA-N 386.470 5.442 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCOc2c(F)cccc21 475544312 AUMVBQZWDZKZJV-HXUWFJFHSA-N 382.479 5.713 30 20 GKED CN(Cc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1 477153630 VZBLSXIFNMHGRR-NRFANRHFSA-N 383.495 5.349 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 481791327 CRZPFIXJIPTJIK-QGZVFWFLSA-N 382.529 5.353 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc2cc(C(F)(F)F)ccc21 483240290 GZGZXNFKVHQBHQ-KRWDZBQOSA-N 393.368 5.235 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)[C@H]1C 483644111 DQLCCXLBHLQWIT-GJZGRUSLSA-N 383.879 5.053 30 20 GKED CC(=O)N(c1nc(CSc2ccc(C#N)cn2)cs1)c1cccc(C)c1C 498163091 PHKNIRUMTAMCEU-UHFFFAOYSA-N 394.525 5.004 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCCC[C@H]2C(F)F)c1 500567108 LRQQKTBAUTYDND-KRWDZBQOSA-N 390.817 5.264 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 502725038 HRQFHZVPKWJRCI-UHFFFAOYSA-N 397.450 5.011 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(-c4nccs4)cc3)CC2)cc1 503630695 TXJWUWOZVXGLRO-UHFFFAOYSA-N 386.480 5.003 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCCc3csc4ccccc34)CC2)cc1 503894722 TXLXBVYNSBDSTM-UHFFFAOYSA-N 386.520 5.412 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1ccc(OCc2ccccn2)cc1 505010112 BPSOMBYMSDIDIZ-UHFFFAOYSA-N 387.483 5.101 30 20 GKED N#C[C@H](NC(=O)c1sccc1-c1ccccc1)c1cccc(C(F)(F)F)c1 505972199 VNPZZTVGNZOOAU-KRWDZBQOSA-N 386.398 5.429 30 20 GKED Cc1ccc(-c2csc(CNc3ccccc3S[C@@H](C)CC#N)n2)cc1 506248315 WUUVVURUODZWTR-INIZCTEOSA-N 379.554 6.125 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1cccc(Cl)c1 507765699 GBGPXPOMYROEHT-IBGZPJMESA-N 383.879 5.368 30 20 GKED N#Cc1c(NC(=O)c2ccc(Cl)cc2F)sc2c1-c1ccccc1CC2 511074905 KWKYVZBCRUTIFH-UHFFFAOYSA-N 382.847 5.430 30 20 GKED COc1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc2ccccc12 512943361 ODUFTFZAPSZHOD-SFHVURJKSA-N 399.475 5.165 30 20 GKED CC(C)(CCC#N)CNC(=O)N1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1 513130726 XUGOJURNNGQBDF-NRFANRHFSA-N 395.934 5.479 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)on1 517905420 BZQCIEKRXSQXMR-HXUWFJFHSA-N 388.427 5.016 30 20 GKED C[C@@]12CCN(C(=O)Nc3ccc(Sc4ccccc4C#N)cc3)C[C@H]1C2(F)F 518106596 WZSFHBUWJNURAY-UYAOXDASSA-N 399.466 5.218 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc(C)c1OC(F)F 518140025 NTMQVJHIPRHALT-GFCCVEGCSA-N 390.455 5.409 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(Cl)cc1)C1CC1 518255440 DGTRAPHTIJXSJL-OAHLLOKOSA-N 399.947 5.931 30 20 GKED CCc1c(C)sc(NC(=O)c2sc(Cc3ccc(F)cc3)nc2C)c1C#N 524331118 VWQNKJGDFQJCRU-UHFFFAOYSA-N 399.516 5.238 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1 524859451 NCBIWZVPXFFOML-GDLVEWKHSA-N 397.664 5.270 30 20 GKED N#CCCn1cc(CNc2cccc(C3CCCCC3)c2)c(-c2ccncc2)n1 527746279 RXIAOFGOCUKPRK-UHFFFAOYSA-N 385.515 5.519 30 20 GKED COCCn1ccc2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc21 539963359 IBTYJOANDJPNDZ-UHFFFAOYSA-N 395.462 5.079 30 20 GKED N#CCc1ccc(CNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)cc1 541306857 GPKISEKHZDJAOE-UHFFFAOYSA-N 383.373 5.571 30 20 GKED C[C@@H]1C[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2cccc(Br)c21 550827080 JRIBLIHRQYETMM-UIAACRFSSA-N 383.333 6.022 30 20 GKED COc1ccc(C[C@@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc2)cc1OC 554997889 QSCCJNDUAWGTAX-BJKOFHAPSA-N 398.506 5.136 30 20 GKED CCSc1cccc(Br)c1NC(=O)NCC1CCC(C#N)CC1 555009506 QFHVFWJXLREHLU-UHFFFAOYSA-N 396.354 5.013 30 20 GKED N#CCCC[C@@H](NC1CC(c2ccc(Br)cc2)C1)c1ccccc1 559862394 BMBXKAKHZSMOIO-DQVLVPHSSA-N 383.333 5.720 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C1CC1)C(F)(F)F 568796259 SBMFEOYBRCUAQO-GOSISDBHSA-N 389.377 5.121 30 20 GKED CC[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C#N)cc1 570514380 FQBZKIYNTOLRFV-SBUREZEXSA-N 384.483 5.007 30 20 GKED N#CCc1ccccc1NC(=O)COc1ccc(-c2ccccc2)cc1Cl 584860994 LYTSZYCOJHWGKD-UHFFFAOYSA-N 376.843 5.091 30 20 GKED C[C@H](CSc1ccccc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 593406655 KFAGOGLTUCPOKD-WIYYLYMNSA-N 381.545 5.244 30 20 GKED C=CC1CCN(C(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CC1 599677008 IGOJYTOCZGAMQE-UHFFFAOYSA-N 381.328 5.084 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCCC1CCCCC1 603739798 DVMCRTRDZMRCIM-UHFFFAOYSA-N 377.488 5.743 30 20 GKED N#CCCCOc1cccc(NCc2ccc(OCc3cccc(F)c3)cc2)c1 603835276 FPRJMVIQCXJJSE-UHFFFAOYSA-N 390.458 5.699 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1 603982677 PLCVWAKYXXUQMN-NRFANRHFSA-N 394.503 5.433 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 604004266 YUHFIUUACLETLJ-UHFFFAOYSA-N 398.506 5.881 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2)n1 607009970 TUIYCYJFVZUNMA-OAHLLOKOSA-N 393.468 5.357 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)ccc1F)c1ccc(OCc2ccccc2)cc1 609027637 AEZYZRJJZDRLHU-OAQYLSRUSA-N 394.833 5.053 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc2c(c1)CCC2 609378501 LCBYQXCNPACYCW-UHFFFAOYSA-N 390.430 5.452 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1c(F)cccc1Cl 609403113 UEJHABRCNLLGHD-CYBMUJFWSA-N 391.899 5.395 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)o1 609427358 GZXLOONWNJEISN-UHFFFAOYSA-N 389.455 5.038 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N[C@H](C)c3cccc(C#N)c3)ccc2C)c1 610330708 XINMMQLPSFSYOA-QGZVFWFLSA-N 386.455 5.245 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 611299709 DXSBXDQRJWLVIS-HNNXBMFYSA-N 391.858 5.198 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1nc2ccccc2s1 613289560 NUFSDKDEVQDXRU-KRWDZBQOSA-N 385.492 5.537 30 20 GKED N#C[C@@H](Sc1nnc(C2CC2)n1Cc1ccccc1)c1ccc(Cl)cc1 619863938 KCGAHNLPAJQLKG-GOSISDBHSA-N 380.904 5.214 30 20 GKED C=C(C)COc1cc(CNCCc2csc(-c3ccccc3)n2)ccc1OC 622266321 NGJKXYOXHLHHHN-UHFFFAOYSA-N 394.540 5.106 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1c(C(F)(F)F)nn(CC)c1C(F)F 676225319 SIJZLUOCFNBAEC-UHFFFAOYSA-N 393.400 5.068 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCS[C@@H](c2ccccc2)C1 682778040 XBODZDDHGFCRCR-OAQYLSRUSA-N 380.557 5.861 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3/CCc4sccc4C3=O)c2)cc1 726894343 YDZXITFIKLMOSD-LGMDPLHJSA-N 389.476 5.222 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1Cl 727629050 QPUFAQTUXKHUEV-ZHZWZMEUSA-N 387.291 5.883 30 20 GKED Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1C=NNC1CCCC1 727652762 YHMBSOULRHZFAZ-UHFFFAOYSA-N 385.726 5.066 30 20 GKED CCn1cc(C(=O)/C=C\c2cn(C(C)(C)C)nc2-c2ccccc2Cl)cn1 731158781 IUYOYSFBMSQIHP-KHPPLWFESA-N 382.895 5.071 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3nccn3Cc3ccccc3)s2)cc1 734095754 SCYLOAXWUMMYJA-OUKQBFOZSA-N 399.519 5.568 30 20 GKED Cc1ccc(NC(=O)c2ccccc2OCC#N)cc1OCC1CCCCC1 741203581 ZNRXRZRISZQOBB-UHFFFAOYSA-N 378.472 5.109 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc1 741845398 VLKVDVNCYIEPEG-FLIBITNWSA-N 394.883 5.621 30 20 GKED O=C(/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1c(Cl)nc2sccn12 741849507 WHSLJJNEEFVOEK-XQRVVYSFSA-N 399.815 5.114 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)C1CCCCCCC1 744029739 UQUBBMPITREQPF-FQEVSTJZSA-N 390.483 5.487 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1)c1nc2ccccc2o1 750687928 CEWXAJGWPJCOBJ-CYBMUJFWSA-N 385.250 5.433 30 20 GKED C[C@]1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCc2ccccc21 751084494 OQPMWAZOUGEOOS-OZXSUGGESA-N 380.491 5.575 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Cc2cc3c(ccc4ccccc43)o2)c1 753154154 VOIFLEGPJWVQGE-IBGZPJMESA-N 398.462 5.126 30 20 GKED N#CCSc1ccccc1C(=O)Nc1nc(-c2cccc(Cl)c2)cs1 763082178 ZWIJJRBSOAVJHG-UHFFFAOYSA-N 385.901 5.331 30 20 GKED C=CC[C@@H](N[C@H]1CCCc2nc(-c3ccc(C)cc3)sc21)c1ccncc1 766018885 JLDXETMKRQHZHZ-UXHICEINSA-N 375.541 5.798 30 20 GKED Cc1c(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1CC(C)C 766335330 BMRHJFJOSGGEAR-NRFANRHFSA-N 387.487 5.147 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)c1 772983476 KJZAUONOXHQDPR-TZMCWYRMSA-N 381.278 5.664 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 774575508 LJOKGKZIFZRSCF-JKSUJKDBSA-N 383.410 5.003 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccccc1-c1nc2ccccc2[nH]1 781088231 UYZDTNQVJILLHS-FQEVSTJZSA-N 378.476 5.140 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C(C)C)[C@H](O)c1ccccc1 788682593 SPBYCILCKTVHJY-FYYLOGMGSA-N 380.532 5.418 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1sc2ccc(C#N)cc2c1C 796712158 AEROODIGHHQEKU-QGZVFWFLSA-N 397.459 5.077 30 20 GKED C[C@H](Cn1ccc2ccccc21)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 796811814 QUSKCIOBMIOBDL-APWZRJJASA-N 385.492 5.277 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2nc(C(F)F)sc2c1 806698576 QVHASBBHKGVROS-SNVBAGLBSA-N 388.399 5.169 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 810532229 PLNDYFGZJSSIDO-MRXNPFEDSA-N 386.929 5.643 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)nc2)nnc1N1CCc2sccc2[C@H]1CC 812188001 HZNNUXJQIGITHL-MRXNPFEDSA-N 399.951 5.145 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC(=O)N(C)C)sc2ccc(C#N)cc12 815322821 FWWMCEODXYOXKY-UHFFFAOYSA-N 395.509 5.107 30 20 GKED C=CCC(C)(C)c1noc(CC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 815709345 ZXPVNTOXFUGFLB-QGZVFWFLSA-N 385.508 5.122 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2sccc2Br)cc1 915863001 RCTUHNYBIZJVGZ-INIZCTEOSA-N 397.297 5.418 30 20 GKED CCc1cccc(NC(=S)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 916000112 AWEHJFPFIAZNLB-UHFFFAOYSA-N 387.508 5.509 30 20 GKED Fc1ccc(-c2csc3ncnc(NN=Cc4c(F)cccc4F)c23)cc1 916367241 WVPXIFXEDWNYKO-UHFFFAOYSA-N 384.386 5.222 30 20 GKED Sc1nnc(SCc2ccccc2)n1N=Cc1c(Cl)cccc1Cl 916368603 JNGOVVVLVIEIAP-UHFFFAOYSA-N 395.340 5.048 30 20 GKED N#C[C@H](C(=O)CSc1ccccc1Cl)c1nc2cc(Cl)ccc2s1 917045439 ZWOHOPVWUGQCNX-LLVKDONJSA-N 393.320 5.572 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(N2CCCCCC2)cc1 1776033173 HZFTZDJMMHZDJR-UHFFFAOYSA-N 385.895 5.255 30 20 GKED CC(C)C(CCc1ccc(Cl)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033523 VMTXKNTWFMCOPI-UHFFFAOYSA-N 379.287 5.748 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(C[C@@H](CC)C(=O)O)cc2)cc1 1776789206 VENBAUALQBDDAO-JOCHJYFZSA-N 397.559 6.301 30 20 GKED CCCCCCCOc1ccc(CNc2cc3c(c(C(=O)O)c2)OCCO3)cc1 1776789212 VVINLSOOWQGUOZ-UHFFFAOYSA-N 399.487 5.117 30 20 GKED Cc1cc2c(s1)C/C(=C/c1ccc(OCc3cc(C)c(C(=O)O)o3)cc1)C2=O 1777428076 MGTDGEUYGYPXTA-DHDCSXOGSA-N 394.448 5.058 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C/c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777455998 VZQVMWFAUFLERM-NQRZERFFSA-N 398.458 5.656 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2)n1)c1nc(-c2ccccc2)cs1 41534067 UDHJCPALRNPXPA-INIZCTEOSA-N 387.489 5.424 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c(Cl)c2ccccc21 51534616 AFWWPFORQAQCBV-OAHLLOKOSA-N 391.883 5.445 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3sc(C(C)C)nc3C)n2)cc1 66543566 REJBMNDSRYSJEA-OAHLLOKOSA-N 397.525 5.197 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 67800477 UGFQZQHWPXSJKG-LJQANCHMSA-N 385.492 5.226 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cs2)cc1 91865705 WAKMEXRBKWAMMD-OAHLLOKOSA-N 381.526 5.112 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC[C@@H]3C3CCC3)c2)cc1 102953259 PDYCZIFYIHHVMJ-HSZRJFAPSA-N 389.499 5.128 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cccc(OCc2cccs2)c1 106132880 RXEUHNMTHWXVEF-UHFFFAOYSA-N 390.508 5.251 30 20 GKED CC(C)c1noc([C@@H](C)Nc2cc(C(F)(F)F)ccc2SCCC#N)n1 108408575 XFCSPUCQYGAKCW-LLVKDONJSA-N 384.427 5.391 30 20 GKED CCCO[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 108509852 NOWGTYVVQFKWJQ-HXUWFJFHSA-N 393.487 5.164 30 20 GKED Cc1cccc(C(NCc2nnc(-c3ccc(C#N)cc3)o2)c2cccc(C)c2)c1 134096017 FVKIQRUALWERGK-UHFFFAOYSA-N 394.478 5.104 30 20 GKED C=C[C@@H](CC(=O)N1CC=C(c2c[nH]c3ccc(OC)cc23)CC1)c1ccccc1 153407020 KSIKAAWWMKAKAZ-SFHVURJKSA-N 386.495 5.152 30 20 GKED CCN(C(=O)CNc1ccccc1SC[C@H](C)C#N)[C@H](C)c1ccc(F)cc1 153930845 YNFWELNSTHUMRX-IAGOWNOFSA-N 399.535 5.099 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(-c2cccc(Cl)c2)n1-c1ccccc1 163307688 UOZMBSOPRGLYLS-HNNXBMFYSA-N 393.903 5.123 30 20 GKED C[C@@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(OCC#N)cc1 171768592 VGYABJVWDQYOCJ-GOSISDBHSA-N 390.458 5.158 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccc(F)cc2)cc1 181621749 AQSRCMUNGXRZMZ-BXKMTCNYSA-N 390.458 5.177 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccccc1C(F)(F)F 182144029 JGHBRWDSCQJTRP-UONOGXRCSA-N 376.378 5.129 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccc1)c1cccc(N2CCOC2=O)c1 207667428 LTIPBGSLPPOIBJ-YPKPFQOOSA-N 399.446 5.118 30 20 GKED N#CC1(CCCSCc2cccc(C(=O)Nc3ccccc3)c2)CCOCC1 281845180 LVPNDHKVYJYIRQ-UHFFFAOYSA-N 394.540 5.273 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](C)c2ccc(OC(F)F)cc2)c1 303183168 LDLZDAJDEHDNBZ-AWEZNQCLSA-N 376.403 5.126 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc1OCC 303854996 FITWAIGEPSKYFG-FNORWQNLSA-N 390.892 5.133 30 20 GKED Cc1cccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c1Br 323156527 PJYQTKSOZMLNDU-JTQLQIEISA-N 389.318 5.068 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1cccc(N2CCCCCC2)c1 328825382 HKJLHYYFXSBEQH-KRWDZBQOSA-N 399.560 5.362 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN([C@H]2C=CCCCCC2)C1)c1ccccc1 328853928 SRDXJYRUUCDOJZ-PMACEKPBSA-N 378.520 5.114 30 20 GKED Cc1cc(CN2CCC[C@H](c3n[nH]cc3N=C(O)C3CCCC3)C2)c(C)s1 329375217 KSJAKGFSHKKXRD-KRWDZBQOSA-N 386.565 5.246 30 20 GKED C[C@H]1C[C@@H](C(O)=Nc2nc(-c3cc(Cl)sc3Cl)cs2)CCC1=O 329384068 OWLGGCFNPNSTOB-YUMQZZPRSA-N 389.329 5.772 30 20 GKED O/C(CC1CCOCC1)=N/[C@H]1CCCc2c1[nH]c1ccc(Br)cc21 329671341 UCFHOIPKDUHLKQ-KRWDZBQOSA-N 391.309 5.081 30 20 GKED C=CCCOCCCCC(=O)Nc1c(Cl)cc(C(F)(F)F)cc1Cl 411117447 ZRFZAJZFORPKBN-UHFFFAOYSA-N 384.225 5.714 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC[C@H]2CCCCC)cc1 426105545 JLBOJUOJMAWPFU-OAQYLSRUSA-N 383.536 5.077 30 20 GKED Cc1ccc(-c2csc(/C=C\c3cn(CCC#N)nc3-c3ccncc3)n2)cc1 432705985 TYXGZBMAKVDPBO-FPLPWBNLSA-N 397.507 5.461 30 20 GKED C=CCC[C@@H](NC(=O)CCc1ncc(-c2ccc(OC)cc2)o1)c1ccccc1 435275152 PIFOGGRQTPLWFF-OAQYLSRUSA-N 390.483 5.107 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 435700722 KGLCISLJTHDDHL-CYBMUJFWSA-N 379.847 5.539 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C1 437107350 PHUZDFOUGVHTBD-SJLPKXTDSA-N 398.503 5.236 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(C(=O)NCCC)c(Cl)c2)CCCC1(C)C 445237186 HBNDPTGOHVPCEA-GOSISDBHSA-N 391.943 5.078 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)Nc2ccc(CC#N)cc2Cl)cc1 455706784 QRJBSRFXJADBOK-RXVVDRJESA-N 397.906 5.004 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 460438366 SFLMJYQAQHIBLN-QFIPXVFZSA-N 399.494 5.147 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1 466859225 NNDISCUIDRZRIZ-GFCCVEGCSA-N 392.286 5.182 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1)c1cnccn1 466994103 YHUXKOUDSRKUGL-ZDUSSCGKSA-N 384.361 5.332 30 20 GKED C[C@@H](NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1ccc(C#N)c(F)c1 468028814 JBOJWMQTXNZLNM-QAPCUYQASA-N 391.515 5.277 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)c2ccccc21 473663381 SCGWWMNKCVWUAX-ICSRJNTNSA-N 389.474 5.150 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 475664431 YNYLQULZOSFMKU-HOTGVXAUSA-N 383.923 5.797 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(-c2ccc(OC)cc2)c1 476152849 PJNKBGKQYNKPJU-UHFFFAOYSA-N 386.495 5.861 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1n[nH]c2ccc(Br)cc12 476809200 ZHJAVXKWDAAYMH-UHFFFAOYSA-N 398.304 5.430 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(-c2csnn2)cc1 480824371 BRPQIAJWSWJZOU-UHFFFAOYSA-N 390.921 5.140 30 20 GKED COc1ccc2ccccc2c1-c1cc(CSCCCC(C)(C)C#N)on1 481902538 UAGXXALNXLSQLX-UHFFFAOYSA-N 380.513 6.067 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c(F)cc1F 482569292 NBINPEKPGLPFMO-UHFFFAOYSA-N 380.419 5.224 30 20 GKED N#C[C@@H](C(=O)c1ccc(NC(=O)c2cccs2)cc1)c1nccc2ccccc12 483216062 SVQHCIUQKBFLRC-LJQANCHMSA-N 397.459 5.039 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(C(=O)C2CCC2)cc1 483509932 ZSUKCSRKZRTMQW-UHFFFAOYSA-N 394.519 5.057 30 20 GKED C=CCN(C(=O)c1coc(C2CCCCC2)n1)c1nc(-c2ccccc2)cs1 485755843 ZJUZNQNZHMVOLX-UHFFFAOYSA-N 393.512 5.679 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1cc(-c2cc(C)oc2C)nc2c1cnn2C(C)C 488840873 POOZQWMKSHPVOH-QGZVFWFLSA-N 392.503 5.070 30 20 GKED C/C(=C\c1ccccc1)CN(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 494261096 BZYCPSQXROUXSL-DGDHUYAWSA-N 393.556 5.055 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12 494917748 BZWGTQXSNDEXGB-YZUZCNPQSA-N 396.515 5.025 30 20 GKED C=CCOc1ccc(C(=O)N(Cc2cccc(C)c2)Cc2ccco2)cc1OC 497435968 DTGVNUWLWHRXPN-UHFFFAOYSA-N 391.467 5.004 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 498446726 ODOZHZNUYJYLNW-RBUKOAKNSA-N 386.417 5.119 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCc4c(F)ccc(F)c43)cc2)cc1 498922593 FMWMLFKRQZOHMR-UHFFFAOYSA-N 390.389 5.026 30 20 GKED COc1ccc([C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 499002940 HWMFJHZDHXSSIE-INIZCTEOSA-N 388.492 5.209 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(C#N)cc1 505317573 JNHJNFAZMJHXLD-OSPHWJPCSA-N 395.462 5.454 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC(c3ccccc3)CC2)cc1 510644509 BCLVHQJIVYBNIT-UHFFFAOYSA-N 397.478 5.762 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)CCc1ccccc1 510901013 FUKXJWGYIHGDJV-UHFFFAOYSA-N 385.467 5.365 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2s1 513673023 WVTJAQPELLGCJF-CQSZACIVSA-N 378.453 5.654 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c(C)c1 513954308 BKMSXTXHDHFYEO-UHFFFAOYSA-N 387.458 5.549 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 515771450 RGKLAVQMYSPNHP-UHFFFAOYSA-N 384.785 5.301 30 20 GKED C[C@@H](NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1)c1cccc2ccccc12 517104989 ZNEFEIQGTPHWBT-GOSISDBHSA-N 399.494 5.025 30 20 GKED COc1ccc2c(CC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)coc2c1 518731973 UFJIBQOCVOHNBZ-UHFFFAOYSA-N 398.418 5.287 30 20 GKED Cc1cc([C@H](C)NCc2cccc(OCc3ccccc3C#N)c2)c(C)s1 520951838 OWJAWGLNFMKIQF-KRWDZBQOSA-N 376.525 5.666 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C(C)C)cc1 521260900 KAQNUJLLZOPWCU-HRAATJIYSA-N 397.544 5.466 30 20 GKED C=CCCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 523227011 RAZJGFMWLFMQID-MAUKXSAKSA-N 378.903 5.823 30 20 GKED CCC(=O)c1ccc(OCCCCC(=O)Nc2sc(C)c(CC)c2C#N)cc1 524330795 DCWCDAOKHKIRJE-UHFFFAOYSA-N 398.528 5.271 30 20 GKED N#C[C@H](C(=O)c1cccc([C@H]2CCCOC2)c1)c1nc2cc(Cl)ccc2s1 536587746 ZSWJQQFVNKGRPN-DOTOQJQBSA-N 396.899 5.334 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)N[C@H](CCC#N)c1ccccc1 536840592 RLRPNDBWMXBLQW-LAUBAEHRSA-N 375.541 5.738 30 20 GKED N#C[C@H](C(=O)c1cccnc1Nc1ccc(Cl)c(Cl)c1)c1ccccn1 538365650 SASPRUMMKPIIBB-AWEZNQCLSA-N 383.238 5.017 30 20 GKED Cc1nc(-c2cc([C@H](C)Nc3cccc(OCCCC#N)c3)cs2)cs1 538526509 LIDGOBCQOJVFIA-AWEZNQCLSA-N 383.542 6.036 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 538538325 XPPRAROWXGXICR-UHFFFAOYSA-N 397.500 5.540 30 20 GKED COc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)c(Br)c1 539628100 ZCYHBUYGAYTOFI-CQSZACIVSA-N 389.293 5.313 30 20 GKED C[C@@H](C#N)CN(C(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1)C1CC1 540120344 HVBYBPIEPOGOCV-LBPRGKRZSA-N 394.418 5.078 30 20 GKED COc1cc([C@@H](C)NCc2cccc(C#N)c2F)ccc1OCc1ccccc1 540353825 FAPYOKKFXMGKGN-QGZVFWFLSA-N 390.458 5.136 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 541158415 APHUJJZNKIXVCT-QZTJIDSGSA-N 384.483 5.084 30 20 GKED C[C@H](NCc1csc(-c2ccoc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542017034 CLSTWIAARXKMJO-INIZCTEOSA-N 385.492 5.793 30 20 GKED CC(=O)Nc1ccc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 543034857 VVCZAEUYBPBKFF-ZWKOTPCHSA-N 383.495 5.595 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 544527613 ABLGAHUMIXBYBZ-NHCUHLMSSA-N 391.408 5.048 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)CCCc1ccc(Cl)c(Cl)c1 553430102 ILPRNNJQELNWNN-UHFFFAOYSA-N 396.314 5.006 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 568669599 MSXAPADFGZHEOR-CVDCTZTESA-N 392.547 5.646 30 20 GKED CCC1CCC(N(C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 574286206 YEZDXKBJPVMTCP-UHFFFAOYSA-N 378.476 5.178 30 20 GKED CC(C)c1ccccc1N(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 577796273 ODDCQARJRNTZBW-QGZVFWFLSA-N 381.545 5.279 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cccc(-c4cccc(Cl)c4)c3)o2)cc1 579383019 BTBFTYSHBVZHMY-UHFFFAOYSA-N 386.842 5.541 30 20 GKED N#C[C@@H](C(=O)c1occc1COc1ccccc1)c1nc2cc(F)ccc2s1 592974406 RUVMOUKIPDCKQX-INIZCTEOSA-N 392.411 5.097 30 20 GKED COc1cc2ccc([C@H](C)N[C@H](CCCC#N)c3ccccc3)cc2cc1OC 595040304 XKTXZNNCFMROLD-FDDCHVKYSA-N 388.511 5.943 30 20 GKED CCc1c(C)sc(NC(=O)c2occc2CSc2ccccc2)c1C#N 609032575 PQVIHIPIJAEWHE-UHFFFAOYSA-N 382.510 5.628 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(F)c1 609221964 LWSAWEVOZUEJNO-INIZCTEOSA-N 389.430 5.237 30 20 GKED N#CCCSc1ccccc1NC(=O)Nc1ncc(-c2ccccc2)s1 609393111 YHBFXMFVGWIDDG-UHFFFAOYSA-N 380.498 5.460 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N(Cc3ccccc3)c3ccccc3C#N)c2c1 610431501 VYKCXNAXZJJPMQ-UHFFFAOYSA-N 393.490 5.514 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1coc(C(F)F)c1 626370031 YWANHVCYNNJFKE-LLVKDONJSA-N 387.226 5.269 30 20 GKED Cc1cc(C(F)F)oc1C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 628113155 PIEHHQAPPCBURB-UHFFFAOYSA-N 381.263 5.309 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1ccc2ccccc2n1 674407765 FIWNXHCYZUBVOR-LJQANCHMSA-N 397.865 5.804 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)c(Cl)c1)c1ccc2ccccc2n1 675644203 XSQXWIIUOLEUKX-ZDUSSCGKSA-N 385.648 5.141 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COCc1nc2ccccc2s1 682803773 PIKBDOAEPDVTAF-UHFFFAOYSA-N 380.513 5.304 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)c1 726458967 HVBKKZLIRYIYQT-CQSZACIVSA-N 377.538 5.147 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccn2)c2ccc(Cl)cc2)c1 726474696 YVNCJQUTBIJYHC-UHFFFAOYSA-N 377.900 5.120 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(C#N)cc3F)cc2Cl)c1 728051791 KBSYIQQSOZSRKU-UHFFFAOYSA-N 391.833 5.414 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2CC(c3ccccc3)C2)cc1 728390965 PNWCEJBMSJDHKC-HQNXYIODSA-N 381.479 5.410 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc1 728698802 PDSCLHAFONQJJF-KCPLEYNQSA-N 377.509 5.908 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 735366173 MJKLVTJZVPMLCS-PWRODBHTSA-N 379.529 5.138 30 20 GKED Cc1cc(/C=C\C(=O)c2c(Cl)nc3ccccn23)ccc1Oc1cccnc1 737446008 KYOMMDJRNGXBCM-CLFYSBASSA-N 389.842 5.380 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc(Br)ccc3O)c2)s1 740011853 UMOSHJKDOKOGET-UHFFFAOYSA-N 399.313 5.045 30 20 GKED COc1ccccc1-c1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)cc1 741467055 DVOOTERYQUIJJM-LGMDPLHJSA-N 388.419 5.174 30 20 GKED CC[C@@H](C)Oc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)ccc1OC 741844037 MQTVJINDSGMRTG-SMYYYNMVSA-N 390.892 5.131 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1cccc(Cl)c1 744033656 UIHGLCKBXNAJGK-MGPLVRAMSA-N 395.673 5.098 30 20 GKED C[C@@H](ON=Cc1cccc(Cl)c1Cl)c1nnc(-c2cccc(Cl)c2)o1 747829046 VWNYXJCPILORMS-SNVBAGLBSA-N 396.661 5.809 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 760789619 JHAAXXMEWBBPHF-YFHOEESVSA-N 396.418 5.248 30 20 GKED N#C[C@@H](NC(=O)c1c(Cl)cc(F)cc1Cl)c1cccc(Cl)c1Cl 763195605 LSRVZAZAUZEKBJ-GFCCVEGCSA-N 392.044 5.434 30 20 GKED CC(C)(C)[C@@H](C#N)OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 765627843 KGFZGHXTOVPTBX-CQSZACIVSA-N 383.300 5.141 30 20 GKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NCc1ccc(O[C@H](C)C#N)cc1 766484903 BWXZBBHZLWCZJO-BZUAXINKSA-N 376.422 5.278 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 772417497 LTLQIIGJAPLKFY-NHCUHLMSSA-N 379.529 5.091 30 20 GKED C=CCc1cc(CN[C@@H](C)c2sc(C(C)(C)C)nc2C)cc(OC)c1OC 772944898 DLCIYMPUVWFJOW-AWEZNQCLSA-N 388.577 5.346 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)[C@@H](C)c2nc3ccccc3s2)c1 772983794 LGHZVYGSDNJJNB-JFIYKMOQSA-N 379.529 5.259 30 20 GKED Cc1ccc(C(=O)O[C@H](C#N)C2CCCCC2)cc1NC(=O)c1ccccc1F 776374507 MYOJBKADICVZES-OAQYLSRUSA-N 394.446 5.016 30 20 GKED CC(C)(C)OC(=O)C[C@@](C)(C#N)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 779713193 QQGXOXNFPKJGFR-QFIPXVFZSA-N 392.459 5.302 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1 780169500 PUYFIBYGLOYCFP-GOSISDBHSA-N 384.479 5.561 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)C(c1ccccc1)c1ccccc1 780670108 JRHQAJQCGGPHEA-MOPGFXCFSA-N 399.494 5.320 30 20 GKED C[C@H](NCc1ccc(C#N)cn1)c1ccc(Oc2ccc(F)cc2)cc1Cl 783293399 GUHPKAVTMFQXJC-AWEZNQCLSA-N 381.838 5.389 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2c(Cl)ccc(Cl)c2Cl)cc1 792926899 YVZAOSRLNBVPKL-YFHOEESVSA-N 382.674 5.245 30 20 GKED COc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[nH]c2ccccc12 795203510 COOYHGUIRUESQY-FQEVSTJZSA-N 381.435 5.084 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)c1 797087768 JAWFVAKHXJRWBK-QFIPXVFZSA-N 390.870 5.130 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797568846 WZABGZJBFWMVHE-LDCOFTPGSA-N 392.446 5.739 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)COc2ccc(-c3ccccc3)cc2)s1 797573305 QNVJBWSCDCAWLF-LJQANCHMSA-N 390.508 5.363 30 20 GKED N#C[C@@H](C(=O)/C=C/Sc1cc(F)ccc1F)c1nc2cc(F)ccc2s1 797947207 ACGHTWSHGVTYFR-FYJFLYSWSA-N 390.411 5.196 30 20 GKED Cc1cc(F)cc2c1CN(C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 800519512 QOXOKZGBFJKPSS-HSZRJFAPSA-N 399.469 5.380 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1csc(-c2ccccc2F)n1 812221722 GNOSGPZYKFSOJL-UHFFFAOYSA-N 380.370 5.199 30 20 GKED N#CCCC[C@@H](NC(=O)/C=C/c1ccccc1OC(F)(F)F)c1ccccc1 817319828 SHTYMBIVINYVCL-KAUXGEHWSA-N 388.389 5.150 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2Nc1nc(Cl)c(C#N)s1 853850106 HBPJBQXAHDWMFJ-ZDUSSCGKSA-N 390.896 5.115 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(F)c1Br 864005596 CKISYHZOTHMSDJ-LBPRGKRZSA-N 379.298 5.452 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2ccc(Cl)nn2)cc1)C(F)(F)F 877605020 UIYSMOZCXGPXIL-UHFFFAOYSA-N 387.686 5.032 30 20 GKED Cc1ccc(OCCN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915353535 VBVGZICUILXXNB-XMMPIXPASA-N 399.494 5.193 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2)n1 915644802 SMAFGQXOIJKRMU-XMMPIXPASA-N 392.462 5.089 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Cl 917026197 AKVSTVYSWSYKKB-PBHICJAKSA-N 396.899 5.416 30 20 GKED N#C[C@@H](C(=O)CCc1ccccc1Cl)c1nc2cc(Cl)ccc2s1 917043569 JSIWPRSBVVWVFL-ZDUSSCGKSA-N 375.280 5.412 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)CC2 1776374571 ALTMPRNGNJHQFL-BUVRLJJBSA-N 396.486 6.388 30 20 GKED CCCCCCCOc1ccc(/C=C\c2nc3c(s2)CCC[C@H]3C(=O)O)cc1 1776788283 XBPQMWXJGOQRNR-LJQBUTKESA-N 399.556 6.167 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1C(=O)O 1777360842 VZNVTHUQQHNDIY-KRXBUXKQSA-N 382.412 5.157 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2-c2ccccc2C#N)c(C)c1 8176458 NHZUSCRDXROXRP-GOSISDBHSA-N 398.462 5.026 30 20 GKED CCC(CC)c1nnc(/N=C(\O)c2c[nH]c(=S)n2-c2ccc(F)cc2)s1 26563798 NCUIFIIBUZJCRP-UHFFFAOYSA-N 391.497 5.065 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 47159467 OTXMUBQMBHKENV-JOCHJYFZSA-N 389.886 5.143 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 63641414 CUKSRGDGIBRBQX-MRXNPFEDSA-N 376.460 5.558 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)C[C@H](c1ccccc1)C(F)(F)F 103329389 NKDSBXOWBXXCOO-IAGOWNOFSA-N 398.384 5.104 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(F)cc1C(F)(F)F 107618768 OTEYFBDNAJBTBW-UHFFFAOYSA-N 398.359 5.313 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cc(N(C)C)cc1C 120041577 BAXYBIQEHZNWAW-UHFFFAOYSA-N 377.941 5.304 30 20 GKED CC[C@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 151788649 LUSRPJWUEMDAFP-OAQYLSRUSA-N 382.847 5.087 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1nc(Cc2ccccc2)no1 173777266 YYDDJPUKFGGKCQ-CVEARBPZSA-N 378.501 5.085 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 175695144 IIPIKHYAHXQCFX-UHFFFAOYSA-N 385.448 5.219 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2c1 176188779 SJCXDJYIKXBSKP-KRWDZBQOSA-N 375.497 5.491 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1[N+](=O)[O-] 176989801 GUXULERBJBYNML-ZFWWWQNUSA-N 398.488 5.038 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2NC(=O)c2ccccc2)n1 177772274 KIRIGBYGTRCZCC-QGZVFWFLSA-N 389.480 5.009 30 20 GKED C[C@@H](Oc1ccc(C(=O)Nc2ccc(F)cc2OCC#N)cc1)c1ccccc1 191194567 HJJBADQIDZMDAN-MRXNPFEDSA-N 390.414 5.120 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1 288672443 CFKIIXCZVHSSDS-SOUVJXGZSA-N 399.482 5.523 30 20 GKED Cc1cccc(CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 303199427 NYJKHRLDVYJMAH-UHFFFAOYSA-N 384.479 5.325 30 20 GKED Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2N=C(O)[C@H]2CCC(=O)[C@H](C)C2)n1 328929033 YHAAYECVPMUUAY-RISCZKNCSA-N 393.409 5.101 30 20 GKED Cc1c(C(O)=Nc2cc([C@@H]3CCCOC3)nn2C)oc2c1ccc1ccccc12 329867168 VPIQLVWQJUMDMD-MRXNPFEDSA-N 389.455 5.158 30 20 GKED O/C(=N\C1(Cc2ccccc2)CCCCC1)C1CCC(/N=C(/O)C2CC2)CC1 330021153 XJANNIXOCKTBBJ-UHFFFAOYSA-N 382.548 5.814 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@H](C)CC3)n1 410988898 TUSAGZPHFSBDOI-MNOVXSKESA-N 388.924 5.125 30 20 GKED C[C@@H]1Cc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c2[C@H](C)C1 410995170 CEFLMUCMYKPUSQ-NWDGAFQWSA-N 397.525 5.203 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 429068337 LTCRRGZJVWOUDS-UHFFFAOYSA-N 394.475 5.260 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccccc1 431816236 UZTYOPBZUDICBU-GOSISDBHSA-N 393.384 5.079 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 432587139 IKWNHRPRPIAHPV-DEOSSOPVSA-N 380.507 5.873 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)o2)cc1 436364611 OKKRQSUTMFTWGJ-FGZHOGPDSA-N 398.462 5.061 30 20 GKED COc1ccc([C@H](C)CCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 438080852 QNQXGNAOPCRUAI-IAGOWNOFSA-N 397.544 5.262 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1)c1ccccc1 438838179 RYDGWGQABXSWHL-XZOQPEGZSA-N 387.458 5.259 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 439677477 ZDAOSAAOKMEMBT-INIZCTEOSA-N 389.430 5.237 30 20 GKED N#CC(CCN1CCC(OC2CCCC2)CC1)(c1ccccc1)c1ccccc1 444622931 XDYQFDFZIHZWSP-UHFFFAOYSA-N 388.555 5.310 30 20 GKED CC(C)Cn1ccc2c(C(=O)Nc3ccccc3SCCC#N)cccc21 446053090 NULCBXLYBMSWCH-UHFFFAOYSA-N 377.513 5.555 30 20 GKED COc1ccc([C@H](N[C@H]2CCC[C@H](C#N)C2)c2ccccc2Cl)c(OC)c1 463241804 FEOZMECIBDUCQN-PONJGIIJSA-N 384.907 5.119 30 20 GKED CCCOc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464416439 BVKYZIKFSRHMIE-AWEZNQCLSA-N 382.769 5.033 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccccc3S[C@@H](C)CC#N)c[nH]c2c1 465131082 XBYISWQCIYYVMA-INIZCTEOSA-N 377.513 5.442 30 20 GKED C=CC[C@H](C)NC(=O)N[C@H](c1cccc(SC)c1)c1cc(F)ccc1F 466240420 FKNBGIPLFWVQSQ-ORAYPTAESA-N 376.472 5.040 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1csc(-c2cccc3ccccc23)n1 471163147 SNNJUXYISGUCMN-UHFFFAOYSA-N 377.513 5.508 30 20 GKED C=CCN(C(=O)c1cc(C)oc1C(F)(F)F)c1nc(-c2ccccc2)cs1 471348886 SJECRGIVGHBLST-UHFFFAOYSA-N 392.402 5.563 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1cc2cccc(F)c2o1 473875084 JUZILPQIZSTBFT-QKYXUNIQSA-N 391.446 5.114 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(NC(=O)C[C@H](CC#N)c2ccccc2)s1 475756146 CKRIGBOPKGVMEM-OALUTQOASA-N 390.512 5.106 30 20 GKED CCN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](c1ccc(C)cc1)c1cccnc1 475909376 ZERZDQGOZBEBEL-BVAGGSTKSA-N 397.522 5.416 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1ccc(F)cc1Cl 476085314 SFIJUFMHYOEZAJ-UHFFFAOYSA-N 375.871 5.739 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2cc(C#N)ccc2OC(F)F)s1 476378440 NUMGXQDCUKDTQJ-UHFFFAOYSA-N 399.422 5.152 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 476525199 PBDVHBNPBJTJOO-MRXNPFEDSA-N 383.879 5.105 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3N3CCCC3)c2)cc1 481952079 LRVREKCSQOBHMG-UHFFFAOYSA-N 383.451 5.203 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482413937 KQFRSUMJXHSPAF-UHFFFAOYSA-N 395.462 5.273 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(Br)cc1C(F)(F)F 488368219 QAUJFNBLCUGKKN-NSHDSACASA-N 377.204 5.040 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](C)c1ccccc1C(F)(F)F 495550005 YMHYKEXOLHSDTP-GJZGRUSLSA-N 396.478 5.021 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1c(F)cccc1F 496847752 VRMYWRRALJCRLM-CQSZACIVSA-N 394.446 5.479 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@@H]1CCCC[C@H]1C 497803790 IXINPCATBZNGAK-UZUQRXQVSA-N 394.490 5.134 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1coc2ccccc12 499583329 GFMMMNGCFPSQFZ-UHFFFAOYSA-N 382.419 5.444 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C(C)(C)c1ccc(OCC(C)C)cc1 503344070 IOCPAFBIZFQTLE-UHFFFAOYSA-N 390.527 5.085 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 507917926 MIUXTBQUZWKAHP-UHFFFAOYSA-N 397.228 5.267 30 20 GKED C[C@@H](Cn1ccc2ccccc21)C(=O)Nc1ccccc1S[C@H](C)CC#N 511695596 OKVFNCHOQAAJIG-DLBZAZTESA-N 377.513 5.310 30 20 GKED C=CCOc1ccccc1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 518981385 ZFNVSTOXSSSSQQ-UHFFFAOYSA-N 380.469 5.178 30 20 GKED N#CCCCOc1cccc(NC(=O)c2[nH]c3ccc(Cl)cc3c2Cl)c1 520547984 BCLZUFXHQFVOMG-UHFFFAOYSA-N 388.254 5.410 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 523142562 OWLPQCNWOCMOOE-INIZCTEOSA-N 390.508 5.276 30 20 GKED C=CCC[C@H](N[C@@H](C)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 536841735 YXLPGDBOYBQPJF-BTYIYWSLSA-N 390.449 6.022 30 20 GKED Cc1ccc(-c2ccc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)s2)o1 541035920 HRVUKORLBHAAEX-ZWKOTPCHSA-N 376.481 5.229 30 20 GKED C[C@@H](NC(=O)Nc1c(F)cc(F)cc1F)c1ccc(-c2cccc(C#N)c2)cc1 542027275 VHBPLWUMBOFXTD-CYBMUJFWSA-N 395.384 5.525 30 20 GKED COCC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)c(Cl)c1 551818047 SMNVTVBOPKCMRR-BUXKBTBVSA-N 381.278 5.433 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c2nccc(C)c2c1 559570876 NKXQKECZZXVZFC-OAHLLOKOSA-N 375.497 5.356 30 20 GKED C=CCOc1ccc(/C=C/c2nc(-c3cccc4cnccc34)no2)cc1OC 579819137 JWJACOHHQAIHGU-CSKARUKUSA-N 385.423 5.029 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1occ2c1CCC2 586776460 SSBQIBCPIXEARL-UHFFFAOYSA-N 380.391 5.045 30 20 GKED COc1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(C2CC2)cc1Cl 594205348 APUABWODSPISIC-SFHVURJKSA-N 383.879 5.393 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2CSc2nc3ccccc3o2)cc1 603468512 DHJTWQLPHZIFLO-UHFFFAOYSA-N 385.448 5.244 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4cc(F)ccc4[nH]3)c2)cc1 603921111 OKYLVTXYYRTOEP-UHFFFAOYSA-N 399.425 5.204 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604461925 UTGVZIHPJCYOHV-OAHLLOKOSA-N 389.480 5.563 30 20 GKED C[C@H](c1cccs1)N(CCC(=O)Nc1sccc1C#N)Cc1ccccc1 604493087 YUYOWBAQOCUTAU-MRXNPFEDSA-N 395.553 5.273 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCc2ccccc21 609398592 CEYGJKSFTFPXJC-SJLPKXTDSA-N 379.529 5.180 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H]3CCCOc4ccccc43)cc2)c1 609433709 CQBYFQJEVIKQJA-QFIPXVFZSA-N 399.450 5.386 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc(-c2ccccc2)cs1 613392091 IQGKDEITRDOEMJ-HXUWFJFHSA-N 388.492 5.622 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(C(=O)N3CCc4ccccc43)cc2)cc1 614056229 JUQUDLFRLJBDNL-UHFFFAOYSA-N 395.506 5.303 30 20 GKED N#Cc1cc2c(nc1NC(=O)c1sc3cc(F)ccc3c1Cl)CCCC2 614297944 SBYXLZPPNMOMAS-UHFFFAOYSA-N 385.851 5.092 30 20 GKED C[C@@H](C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccco1 648494388 NBEZVRVWQANZQR-SECBINFHSA-N 383.263 5.311 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2cc(C3CC3)no2)cc1)C(F)(F)F 656655137 CQOGGZNJOJMVNQ-UHFFFAOYSA-N 382.279 5.454 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)s1)c1nc(-c2ccccc2)cs1 671751501 VLUXFFPJRVYZBQ-LLVKDONJSA-N 378.400 5.380 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccccc1OCc1ccccn1 685443594 PLYIGCDNKGAXRD-UHFFFAOYSA-N 390.531 5.016 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)C1CCCCC1 726324724 DSZCILHUMRIUIM-KXBFYZLASA-N 377.513 5.465 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC3(CCCCC3)CC2)cc1 726695371 DJDSJZHSLCRKDQ-QHCPKHFHSA-N 387.527 5.920 30 20 GKED Cc1cccc(N2C(=O)/C(=C/c3cccc(OCCCC#N)c3)SC2=S)c1 726802276 ZMNHEDGYJJXDCG-RGEXLXHISA-N 394.521 5.083 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1nc2ccccc2s1 727952690 QJRMBYWAJRGJJX-HSNDNRACSA-N 388.492 5.507 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1Cl 728117069 INRNJUCAPDTMTE-KRWDZBQOSA-N 393.796 5.599 30 20 GKED C=CCc1cc(CNCc2ccc(Cl)c(C(F)(F)F)c2)cc(OC)c1OC 729683242 IXCNZRSPTORKDO-UHFFFAOYSA-N 399.840 5.394 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1cccc(OCC#N)c1 730150888 YOJWNLFBYDAXDK-MDZDMXLPSA-N 378.428 5.056 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1nc2ccccc2s1 730688076 ZAEGHNPUQOHQNF-HZSPNIEDSA-N 387.291 5.583 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 732417822 KPRUEGLPSDTFKK-DNVCBOLYSA-N 390.512 5.244 30 20 GKED CC[C@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(OC)cc1 732505048 NYBXCQDRPBXOMZ-NRFANRHFSA-N 388.423 5.062 30 20 GKED Cc1ccc(Oc2ccc(N=Cc3cc(Cl)cc([N+](=O)[O-])c3O)cc2)nc1 733205130 LJAKZHFUBSAOQH-UHFFFAOYSA-N 383.791 5.200 30 20 GKED C=CCOc1ccccc1CN(C(=O)CC1CCOCC1)c1ccc(C)c(C)c1 735245172 QJDRYGFXIPZIEW-UHFFFAOYSA-N 393.527 5.218 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)/C=C\c3cccc(OC4CCCC4)c3)[nH]c12 735788013 BDFLFQIEWVJESE-CBUFDYBVSA-N 385.467 5.082 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 739143023 NKTRICAPVLQGQL-SWLSCSKDSA-N 388.414 5.370 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3SCCc4ccccc43)n2)cc1 744031557 MQGPLJWZEBEZLQ-WIYYLYMNSA-N 390.533 5.325 30 20 GKED CC(C)(C)c1ncsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746827065 BSUBHTGIOONEFU-SFHVURJKSA-N 375.497 5.348 30 20 GKED COc1cc(C(=O)/C=C\c2ccccc2OCc2ccccn2)ccc1SC 747614573 IJNVCJAGIXHMDC-BENRWUELSA-N 391.492 5.287 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)/C=C/c1ccccc1C#N 750823399 ZWGQXQMLGOLWDO-FOCLMDBBSA-N 399.494 5.098 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759181183 AOCLGLBXBHXGKW-HGZMWJMZSA-N 376.843 5.125 30 20 GKED CC(C)c1ccc(-c2ncc(CON=C3CCC4(CC3)OCCO4)s2)cc1 759758330 AFMUORRTSIRMNQ-UHFFFAOYSA-N 386.517 5.123 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3cccnc3)s2)cc1 761312567 ZGMRZVQEWNVJAL-FQEVSTJZSA-N 396.475 5.113 30 20 GKED CCC[C@]1(COC)CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772230015 KTSQBLOGGXUWFA-ISKFKSNPSA-N 391.515 5.155 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCc3c2sc2ccccc32)c1 772983402 HMEDITOEXGDGRZ-DYESRHJHSA-N 376.525 5.749 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(c2nnc3ccccn23)CC1 775144117 SFDYEWORZVLZNE-LJQANCHMSA-N 384.568 5.212 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCc2c(Cl)cccc21)c1nc(-c2ccccc2)cs1 776081558 PDXKRIDWFCLURL-IAGOWNOFSA-N 378.884 5.370 30 20 GKED CC(C)(C#N)CCOC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 776383062 HKRFJVWOSWDRPQ-UHFFFAOYSA-N 393.418 5.003 30 20 GKED C(=NNc1ncnc2sc(-c3ccccc3)cc12)c1scnc1C1CC1 782133500 YGIQZRYVBWYORE-UHFFFAOYSA-N 377.498 5.138 30 20 GKED N#C[C@@H](C(=O)[C@H]1CC(=O)c2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 789349459 YRYKWFNTMVLNGE-IRXDYDNUSA-N 392.867 5.010 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(SC(F)F)cc1 794994242 DSPRNJHAVKFSPP-UHFFFAOYSA-N 378.513 5.776 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 804559719 FNBCEQHFYWJRBW-GOSISDBHSA-N 397.416 5.098 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2c[nH]c3ccc(Br)cc23)cc1 811699316 ZPMNVXPGHOMVJE-VVOKDJNJSA-N 395.256 5.117 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 813057636 OBPJMNIVPCAKPU-PGRDOPGGSA-N 378.859 5.168 30 20 GKED Fc1cccc(F)c1C(F)(F)c1nc(-c2cccc(C(F)(F)F)c2)no1 904314676 NPOCSZCUCMQWLM-UHFFFAOYSA-N 376.231 5.174 30 20 GKED C=CCOc1ccc(Cc2nc(-c3cccnc3Oc3ccccc3)no2)cc1 904454569 SNWPEPPOCBZHLU-UHFFFAOYSA-N 385.423 5.080 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cccc(COc2cccc(F)c2)c1 915999450 HHENHGSMHFSURV-UHFFFAOYSA-N 377.444 5.085 30 20 GKED CSc1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)cc1 916333990 YYJBPYMDMPJOBT-UHFFFAOYSA-N 395.340 5.145 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2cccc(F)c2)cs1 920383957 LKZBCYZINLTTLY-UHFFFAOYSA-N 388.855 5.066 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc2cc(OC)ccc2c1 1776033115 ACKBQQCNPJDUEM-UHFFFAOYSA-N 382.847 5.426 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(C(F)(F)F)cc3)s2)cc1 1776052241 SSJOLAWUROSFGR-UHFFFAOYSA-N 390.386 5.578 30 20 GKED Cc1ccc(-c2cccc(/C=C3/CCCc4cc(C(=O)O)ccc4C3=O)c2)cc1 1777429764 SWWOZAMJULRDLW-JCMHNJIXSA-N 382.459 5.963 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3occc3C)cc2)CCC1 1788691302 PIFOPFNNTIEZKJ-FQEVSTJZSA-N 392.499 5.104 30 20 GKED C=CCn1c(SCc2ccc(OC)c(F)c2)nnc1-c1ccc(Cl)cc1 6071396 QDFZLTBJAVBBQT-UHFFFAOYSA-N 389.883 5.225 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 46861716 TXSVIPRFTJJTCF-LJQANCHMSA-N 391.814 5.156 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 56410868 DTCBILAZGYPQMX-OAHLLOKOSA-N 395.553 5.210 30 20 GKED CC(C)(C)c1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3ccccn3)cc2)cc1 60477059 CPFUFZOCBPBJHB-QFIPXVFZSA-N 384.479 5.448 30 20 GKED COc1ccc2c(c1)CCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C2 66955948 BETCAQUXUGJCIU-INIZCTEOSA-N 395.528 5.070 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CC(c2ccccc2)c2ccccc2)cc1 104796952 WVHYAKLRJMYUDH-UHFFFAOYSA-N 398.506 5.554 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 108325060 XSVTXUJVPNRSHN-INIZCTEOSA-N 392.524 5.029 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(Cl)c1 109028932 HLBBBECAZROROV-KXBFYZLASA-N 399.947 6.103 30 20 GKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Br 118445156 UYRDYGHARTVJCJ-CHWSQXEVSA-N 389.318 5.142 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 120519092 AYZOXVACSFRCIY-CYBMUJFWSA-N 377.366 5.264 30 20 GKED Cc1ccc(Oc2ccccc2)c(NC(=O)N(CCC#N)Cc2ccccn2)c1 135162305 CHCWUBJOYKTLNH-UHFFFAOYSA-N 386.455 5.130 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/SCc3ccco3)n2)cc1 151136044 GESIHBGYBHUMBF-SYJIQKIWSA-N 396.493 5.035 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccncc3)s2)sc2c1CCCCCC2 172786153 ZJQCUXFOZTXOND-UHFFFAOYSA-N 394.525 5.050 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H](C)Sc1ccccc1 173115226 VQZRLTWWSCJVOI-HOTGVXAUSA-N 385.558 5.241 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccccc1OC 177197495 RKLRTBXXTPLIQF-AWEZNQCLSA-N 398.532 5.279 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(Cl)c3Oc3cccnc3)cc2)CC1 179811937 GNUYGPSRSLAJLB-UHFFFAOYSA-N 389.842 5.335 30 20 GKED N#C[C@H](C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)c1ccccn1 181410461 SJSGLHSUJRKNMC-AWEZNQCLSA-N 384.222 5.066 30 20 GKED N#CCC[C@H](N[C@H]1CCSc2ccc(Br)cc21)c1ccccc1 181576742 FEYSBYPZNDHEHH-ROUUACIJSA-N 387.346 5.621 30 20 GKED COc1cc(C=NO[C@@H](C)c2ncc(-c3ccccc3)o2)ccc1OC(C)C 255920829 IASPVFAMOGNYHJ-INIZCTEOSA-N 380.444 5.249 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCc3ccsc3)cc2Cl)c1 303220141 UQWXSTZPUKODIJ-UHFFFAOYSA-N 396.899 5.423 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3Cc3ccccc3)cc2)c1 303400767 ZZIBJWZFJZMYBO-JOCHJYFZSA-N 397.478 5.590 30 20 GKED CCN1C(=O)CC[C@H](/C(O)=N/C2CCC3(CCCCC3)CC2)[C@H]1c1ccncc1 329097086 LLJGPEZLYURJHY-RBBKRZOGSA-N 397.563 5.231 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2cccc(-c3cccs3)c2)no1 329319849 DTXHAOMADMTAGG-KRWDZBQOSA-N 382.489 5.269 30 20 GKED Cc1cccnc1[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)C(C)C 329482169 RMPLXKSSPGPISQ-TZIWHRDSSA-N 394.563 5.550 30 20 GKED O/C(=N\C1(c2cccc(Cl)c2)CCCC1)C1CCC(/N=C(/O)C2CC2)CC1 330019943 VVTBAXJYEAHCFB-UHFFFAOYSA-N 388.939 5.991 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccccc1OCc1csc(C)n1 410352842 KWNVSEOAXGCRMZ-UHFFFAOYSA-N 378.497 5.401 30 20 GKED C=CCn1c(S[C@@H](C)CCSc2ccccc2)nnc1-c1ccccn1 431216164 MFCTUUMVMFCGHB-INIZCTEOSA-N 382.558 5.189 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2cccc(C#N)c2C)ccc1Br 432315181 YEQJPEDNKFGGRN-IBGZPJMESA-N 398.304 5.307 30 20 GKED CCCc1c(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)cnn1-c1cccc(C#N)c1 432578482 KUVDAVAGWGKEQH-VXKWHMMOSA-N 397.482 5.120 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 433136322 XKXRXUFLYWTHGI-HSZRJFAPSA-N 399.494 5.919 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 435595971 DQAVIGAPJZTPNF-MJGOQNOKSA-N 379.529 5.767 30 20 GKED N#CCC[C@@H](NC(=O)N1CCc2cc(-c3ccccc3)oc2C1)c1ccccc1 438846281 JCKIJKHBMUANCI-OAQYLSRUSA-N 385.467 5.059 30 20 GKED N#CCC[C@@H](NC(=O)NCc1ccc(OCc2ccccc2)cc1)c1ccccc1 438854466 WTMQUKCADPPJOD-XMMPIXPASA-N 399.494 5.110 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(C#N)cc1Cl 439455142 TWQBXGWTXNWXNX-LBPRGKRZSA-N 385.895 5.634 30 20 GKED N#Cc1c(NC(=O)[C@@H]2SCCc3ccccc32)sc2c1CCCCCC2 443873697 DSKCJDVSWUNTJL-LJQANCHMSA-N 382.554 5.248 30 20 GKED Cc1nc([C@H]2CCCN2CCC(C#N)(c2ccccc2)c2ccccc2)cs1 444682009 YDHHKPOWIAGOPC-HSZRJFAPSA-N 387.552 5.488 30 20 GKED Fc1ccccc1-c1nc(CN(CCC(F)(F)F)CC(F)(F)F)cs1 447850968 XQTDLEWVQRDNPW-UHFFFAOYSA-N 386.336 5.266 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 458371853 UBPSFWIWOFZOSK-VQIMIIECSA-N 377.513 5.697 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1c1ccccc1Cl)c1ccccc1 458798385 HZUYFYAAJQQDQR-RTWAWAEBSA-N 381.907 5.622 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)S[C@H](C)c1ccccc1OC 463196585 DKNQUJREHVSSAU-CVEARBPZSA-N 375.559 5.154 30 20 GKED CCN(C(=O)c1c(F)cc(C(F)(F)F)cc1F)[C@@H](C)c1ccc(C#N)cc1 463303994 BLTORKMIDRYBQD-NSHDSACASA-N 382.332 5.079 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)F)CC1 470188393 PFIGOOGBOBYFQO-IIFCYOTJSA-N 390.474 5.006 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(N2CCCCC2)cc1 471906120 PAMNJIZJAWGMHS-KRWDZBQOSA-N 379.529 5.323 30 20 GKED CC(C)(C#N)CCCN[C@@H](Cc1ccccn1)c1ccc(Br)cc1 475727893 QIGBLSJCCYGLKV-IBGZPJMESA-N 386.337 5.047 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(NC(=O)C[C@@H](CC#N)c2ccccc2)s1 475756137 CKRIGBOPKGVMEM-MOPGFXCFSA-N 390.512 5.106 30 20 GKED COc1ccc(C)cc1-c1csc(NC(=O)C[C@H](CC#N)c2ccccc2)n1 475759275 ADECJJYJKZDXCF-KRWDZBQOSA-N 391.496 5.153 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)c3ccnc(C#N)c3)c2)cc1 476328592 SACHTXLEBJKATK-SFHVURJKSA-N 399.494 5.241 30 20 GKED N#CC[C@H](CC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1 476662937 OBQCSRWZPIQOOQ-LJQANCHMSA-N 399.321 5.697 30 20 GKED C=C(C)CN(C)C(=O)C/C(=C/c1cccc(OC)c1)c1nc2ccccc2s1 479212651 IAWHXMJRIILLMX-PDGQHHTCSA-N 392.524 5.270 30 20 GKED C[C@@H](NCc1nccn1-c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 480300661 KUVCNTIGIRIZAK-LJQANCHMSA-N 378.479 5.262 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 485763377 MUAZLUOEMQSIFC-UHFFFAOYSA-N 397.481 5.249 30 20 GKED N#Cc1cccc(CNC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)c1 487409503 VYUYASGHLFZLGP-UHFFFAOYSA-N 397.453 5.095 30 20 GKED C[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487546724 WPLDWTXORFEDQY-UZLBHIALSA-N 399.332 5.494 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)oc2c1C(=O)CCC2 493953901 XRXNWPFQUNCRPW-UHFFFAOYSA-N 386.407 5.023 30 20 GKED CC(C)Oc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1Cl 502251569 HAAVPYIBEBJOLY-UHFFFAOYSA-N 387.867 5.454 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)c(C)cc1Br 507420431 ALPXKGFULIVESN-UHFFFAOYSA-N 389.318 5.324 30 20 GKED CCN(C(=O)c1cc2c(s1)-c1ccccc1OC2)[C@H](C)c1ccc(C#N)cc1 509580977 VSHLVKXWRCLXGV-OAHLLOKOSA-N 388.492 5.402 30 20 GKED N#C[C@@H](C(=O)c1ccc(-n2cccc2)c(F)c1)c1nc(-c2ccccc2)cs1 511727327 ABSFMJLOQXXZHB-KRWDZBQOSA-N 387.439 5.230 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1csc(Cc2ccccc2)n1 512301159 INBBTLNIQPFCEQ-UHFFFAOYSA-N 399.475 5.046 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(C#N)cc1F 512622568 BEUDKAFBZMPYST-GOSISDBHSA-N 387.502 5.277 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cccc(Cl)c2Cl)c1 516700204 CSMGAGXSSKDLPR-UHFFFAOYSA-N 397.261 5.696 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N 517456255 HNRYGWCYADAIDW-SJLPKXTDSA-N 396.556 5.776 30 20 GKED CSc1ccccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 518551599 ORXKRQPHAOGJCI-UHFFFAOYSA-N 378.428 5.464 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cn1ccc2ccc(Cl)cc21 518739268 VTBBTYUQKKSQSB-CQSZACIVSA-N 383.904 5.328 30 20 GKED C=CCCO[C@H](C)C(=O)N(Cc1cccs1)c1ccc(Br)cc1 519080425 CPGLQQLAEPATAJ-CQSZACIVSA-N 394.334 5.025 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccc1OC 520325281 GXCLXVVTYNUZDK-UHFFFAOYSA-N 386.451 5.220 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600706 LKWHYKRFCBESGS-UHFFFAOYSA-N 393.393 5.293 30 20 GKED CCCN(CC(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523944334 DIASZDAHTIBNKQ-UHFFFAOYSA-N 378.806 5.121 30 20 GKED CCn1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1C 524706646 BTYGLWQRRZVMTR-LJQANCHMSA-N 392.890 5.081 30 20 GKED C=C[C@H](CC(=O)N(Cc1csc(C)n1)c1ccc(F)cc1)c1ccccc1 534000376 KMWZNFDZUZCAGH-QGZVFWFLSA-N 380.488 5.484 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 536935416 ZOEYENJBCCBGLZ-UHFFFAOYSA-N 387.405 5.297 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccc(F)cc1 537558156 XEPCPOXBHKJQPZ-CYBMUJFWSA-N 380.448 5.265 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(CCN2CCCC2)c1 537696859 COBKXSSJJLHHRD-UHFFFAOYSA-N 395.506 5.116 30 20 GKED COc1cc(CNCc2ccc(-c3ccccc3C#N)cc2)cc(Cl)c1OC 540201993 CHFVYPOWCCRPAH-UHFFFAOYSA-N 392.886 5.186 30 20 GKED C[C@H](NCc1ccc(-n2cccn2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 541063684 UMJKQETYGFWKJD-IBGZPJMESA-N 378.479 5.262 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)c2)cc1 554987876 NCEMGEUAPLQLPQ-GOTSBHOMSA-N 381.435 5.774 30 20 GKED COCCC[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 560708742 NEMRVZLKPUFMQR-IBGZPJMESA-N 398.934 5.081 30 20 GKED COc1ccc([C@H](CCC#N)NC[C@H](Cc2ccccc2)C(F)(F)F)cc1 563654498 DXDVSIGAVVTCPD-ICSRJNTNSA-N 376.422 5.051 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN1CCCC[C@H]1c1ccccc1 571013604 WGOWCGZKSMHRCV-NQIIRXRSSA-N 393.556 5.104 30 20 GKED CC(C)C1(C)CCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 577150112 QMVXVYUAYUKEAS-UHFFFAOYSA-N 378.476 5.036 30 20 GKED CC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCC(=O)CC1 582527465 QOWHDOPSRHNQPE-LJQANCHMSA-N 380.875 5.083 30 20 GKED C=CCOc1ccccc1CNC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1 600897098 WIPRSDDOGLNTTN-KRWDZBQOSA-N 378.472 5.290 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCCCOCCc2ccccc2)n1 603748238 HBGWHMXDNWOREQ-UHFFFAOYSA-N 380.435 5.022 30 20 GKED CN(C)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 603759007 REOJCVSFWNRZFD-OAQYLSRUSA-N 389.886 5.314 30 20 GKED Cc1nc(NC(=O)c2ccc3[nH]c4c(c3c2)CCCCC4)sc1SCC#N 603908784 XLJWHABYZJNSGB-UHFFFAOYSA-N 396.541 5.070 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccc(C)c(Oc2ccncc2)c1 604224005 KCGJGLPOZBKWRC-UHFFFAOYSA-N 376.431 5.150 30 20 GKED Cc1cccnc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 609206975 ZOMKZCQJOSNIFE-LJQANCHMSA-N 390.874 5.021 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209078 QRJBDGWQIDUGAJ-UHFFFAOYSA-N 375.403 5.154 30 20 GKED N#CCCN(C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1ccc(F)cc1 609522227 MOPYMPFDQIFBTE-UHFFFAOYSA-N 384.863 5.768 30 20 GKED CC(C)Cn1c(S[C@H](C)c2ccc(C#N)cc2)nnc1-c1ccccc1F 609813666 ZFKLIQZETIHXCQ-OAHLLOKOSA-N 380.492 5.465 30 20 GKED CCN(C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 609967725 ASFGIZFGLAACFI-HZPDHXFCSA-N 388.433 5.365 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N(CC#N)C3CCCC3)c2)c1 610175922 YZXNDVUXQYADLN-UHFFFAOYSA-N 378.541 5.504 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCc4cc(C#N)ccc43)cc2)cc1 618751360 HIFUOJGJEOUOEH-HSZRJFAPSA-N 394.434 5.031 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC(C)C)c(C(C)=O)c1 656397978 QCZDKYSMKGVJOT-UHFFFAOYSA-N 379.500 5.781 30 20 GKED C=C(C)Cn1c(-c2ccccc2)nnc1N1CCC[C@H](c2nc3ccccc3o2)C1 670198871 ONRYXNJWLJLPHM-IBGZPJMESA-N 399.498 5.046 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(F)c3)c(F)c2)c1 728449822 NVGXIWSYDXBEEY-UHFFFAOYSA-N 394.446 5.334 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)s1 729937045 LACFLKLESBUPNC-RMKNXTFCSA-N 382.437 5.131 30 20 GKED O=C(/C=C\c1csc(-c2cccc(Br)c2)n1)c1cncc(F)c1 737444815 UBDKHECSDOOVOA-PLNGDYQASA-N 389.249 5.003 30 20 GKED N#C[C@@H](C(=O)CC/C=C/c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 739155930 LHICBJDRBKQLMK-AMGQUURNSA-N 392.911 6.133 30 20 GKED C#CCOc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1OCC 741473526 RVFODBKBDBYAFL-CSKARUKUSA-N 383.447 5.055 30 20 GKED C[C@H](ON=Cc1ccccc1OC(F)F)c1nnc(-c2cccc(Cl)c2)o1 741753053 QOAUXJBKJOSGQN-NSHDSACASA-N 393.777 5.103 30 20 GKED C/C(=C/C(=O)Nc1ccccc1SCCC#N)c1cccc(C(F)(F)F)c1 742648844 DPJMUJRUAABQQL-OWBHPGMISA-N 390.430 5.753 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1c(C)cccc1F 743124539 OMJQQNLIJRFUEW-UHFFFAOYSA-N 389.430 5.428 30 20 GKED C[C@H](NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 743776779 HAVMNGJRKSCKTG-HYTQYMIGSA-N 376.456 5.177 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@]34CCc3ccccc34)n2)cc1 744034344 GSEJQKHDWRNRSN-LJFZDNNRSA-N 384.504 5.199 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3CCSc4ccccc43)n2)cc1 744036122 YADLWKRVUGDUDM-ROUUACIJSA-N 390.533 5.574 30 20 GKED N#Cc1cccc(C2(NCc3sc(Sc4ccccc4)nc3Cl)CC2)c1 747923826 NIRSGFRZYRAZGY-UHFFFAOYSA-N 397.956 5.598 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(C)nc3ccccc23)cc1 760182822 IIEPRQXAHWHQDU-VFNWGFHPSA-N 385.467 5.018 30 20 GKED Cc1nc(Cl)ccc1CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 764455455 CHKCYBUOPMFGKV-UHFFFAOYSA-N 395.821 5.028 30 20 GKED N#CCc1ccccc1CC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 769504760 WEGFKQFGWQVMSE-FQEVSTJZSA-N 386.417 5.068 30 20 GKED CC(C)(C)OC(=O)N1CCc2c(NCc3ccc(C(C)(C)C#N)cc3)cccc21 774304525 NGXYPASXYUSBLD-UHFFFAOYSA-N 391.515 5.397 30 20 GKED C=C(C)[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 775319643 WPYAFSQKJRYXIS-KRWDZBQOSA-N 397.219 5.043 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(COc2ccccc2)cc1 780636059 HVSMAOBUQLEZLO-QGZVFWFLSA-N 387.439 5.200 30 20 GKED Oc1ccc(Cl)c(F)c1CNC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 790949610 NWMYKIRUOCUOPN-HTQZYQBOSA-N 393.730 5.184 30 20 GKED CCSc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3OC)nc2)cc1 792883829 BAZSQFIKCJNDGT-MDWZMJQESA-N 376.481 5.160 30 20 GKED N#CC[C@@H](CC(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 796608496 ASIAMGBACWQQQZ-KRWDZBQOSA-N 397.862 5.079 30 20 GKED CCc1ccc2occ(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)c2c1 796796928 FXFHWJPDOMZAHR-IBGZPJMESA-N 382.419 5.110 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1Cl)c1nc2ccccc2n1C(F)F 810537549 WRMCYSPZAAYZBJ-CQSZACIVSA-N 387.817 5.284 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1csc(-c2ccccc2F)n1 812224102 AGEAITKSBGERNU-UHFFFAOYSA-N 380.370 5.199 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)sc21 916848106 BIALOXGYCXBIFQ-QGZVFWFLSA-N 381.460 5.431 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)CC(c2ccccc2)c2ccccc2)cc1 916908893 GDYVMRYTRNDIGA-XMMPIXPASA-N 396.490 5.119 30 20 GKED CC(F)(F)CCC(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917032674 OHRYFKIKKYQNTQ-XACAWQSSSA-N 378.488 5.223 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 1776170673 AXAPBDHPDBEEQZ-GOSISDBHSA-N 391.870 5.479 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cnc(C2CCCCC2)s1 1776355237 XQYUTZGUQPUYPB-KTKRTIGZSA-N 399.512 5.572 30 20 GKED C[C@@H]1Oc2ccc(/C=C\C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)cc2[C@@H]1C 1776669731 SJQJHKZIEXDORF-NWSIVLSWSA-N 388.419 5.425 30 20 GKED CCCCCCCSc1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1 1776787523 LZGWWIKEDOIYQP-UHFFFAOYSA-N 385.529 5.377 30 20 GKED Cc1cccc2c1C/C(=C\c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777456054 DOUYVWJZTMFZSV-MFGYPMPUSA-N 384.431 5.022 30 20 GKED Cc1ccc2c(CC(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)coc2c1C 14496918 UMLUEATZYKFVBQ-UHFFFAOYSA-N 387.464 5.226 30 20 GKED CC(C)(Oc1ccc(Cl)cc1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 14497572 LXXLMPHNAHBFFS-UHFFFAOYSA-N 397.887 5.131 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)on2)nnc1-c1cccc(C)c1 18972646 SNDAWNCZSNPGTQ-UHFFFAOYSA-N 388.496 5.387 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2cccc(C)c2)cs1 54897116 GWAJRIFWBWJLSB-FLIBITNWSA-N 396.899 5.686 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 60034114 XUFSBCRRUYWPIT-UHFFFAOYSA-N 399.475 5.232 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccc2ccccc2c1 78714238 GQSCEOUQFLRUNU-MRXNPFEDSA-N 376.481 5.252 30 20 GKED N#Cc1c(NC(=O)c2sccc2SC(F)F)sc2c1CCCCC2 107102134 LWSBLOGGVVBAFR-UHFFFAOYSA-N 384.498 5.517 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1sc2cccc(F)c2c1COC 109329862 ZUNBVKBXGFYUOG-UHFFFAOYSA-N 383.488 5.058 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H](C)c1ccsc1 119526113 AHKZFJMKLDLDCA-INIZCTEOSA-N 376.481 5.249 30 20 GKED CC1CCN(c2cccc(NC(=O)N[C@H](CCC#N)c3ccccc3)c2)CC1 121000999 NIHGMCQJDUWLPG-JOCHJYFZSA-N 376.504 5.089 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1C 128803410 XPULJAWCIZPXJR-SFHVURJKSA-N 393.537 5.181 30 20 GKED CC[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1c(C)noc1C 160591935 DDCSBCRKKFXUTK-GOSISDBHSA-N 391.496 5.195 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)NC[C@H](C)C#N 176476418 XMVOVFHTJUMHON-CQSZACIVSA-N 393.466 5.013 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C3SCCCS3)cc2)n1 177742853 VLXLWYQEPABJKF-HNNXBMFYSA-N 388.583 5.625 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1 182125666 DAUCFFSCTNXIRA-ZDUSSCGKSA-N 396.368 5.314 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2cc(F)ccc2s1 193453108 IQXDGDAIYFZWEA-KRWDZBQOSA-N 388.423 5.155 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)cs1 255374810 ZCWSCHROFNGYKI-SEYXRHQNSA-N 376.481 5.079 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2c(C#N)cnc3ccc(Cl)cc23)c1 301406399 UZURESZILAJLRH-QGZVFWFLSA-N 376.847 5.053 30 20 GKED Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccccc2S[C@H](C)CC#N)c1C 303310696 FNWIMUAYCITQDZ-OAHLLOKOSA-N 388.558 5.115 30 20 GKED CC(C)n1nccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 303642595 IKXOWJANXIVUKL-UHFFFAOYSA-N 380.835 5.034 30 20 GKED CC(C)Cc1noc(-c2cc(Cl)ccc2N=C(O)[C@@H]2CCC(=O)[C@@H](C)C2)n1 329368884 JIAHQEOLRSVXJB-QWHCGFSZSA-N 389.883 5.182 30 20 GKED CC[C@H]1C[C@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329406402 CUPSUEPKKAPCIH-VDHUAGMBSA-N 395.547 5.800 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccc(F)cc1OCCC(F)(F)F 409854262 JAPDIGLGZONKTK-UHFFFAOYSA-N 380.385 5.570 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1Cl 410022164 PQVPIKUWPLTKKI-KRWDZBQOSA-N 394.689 5.887 30 20 GKED CC1(C)CN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)[C@H]1C1CC1 427597144 REQQGIIKINPOQL-NRFANRHFSA-N 376.525 5.111 30 20 GKED Fc1ccc(CN[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c(C(F)(F)F)c1 427617512 HRTCQVXYOGBDNW-OAHLLOKOSA-N 392.318 5.426 30 20 GKED C=CC[C@@H](C(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644376 IAVNKRYFHXISCR-IEBWSBKVSA-N 378.447 5.033 30 20 GKED Cc1sc(NC(=O)c2sc(C3CC3)nc2-c2ccccc2)c(C#N)c1C 428373565 NVZQQNIBTAVFEV-UHFFFAOYSA-N 379.510 5.490 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@@H](Sc3cccc(Cl)c3)C2)cc1 432697151 GAGNQBQNUWNFMT-LJQANCHMSA-N 399.947 5.540 30 20 GKED CC(C)(c1ccc(C(=O)Nc2ccc(F)cc2C(F)(F)F)cc1)C(F)(F)F 434242995 NFRPLKSELZCPPW-UHFFFAOYSA-N 393.302 5.937 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CCC(=O)c1ccc2ccccc2c1 436364946 QPQLQWCOHRJKGP-BJKOFHAPSA-N 396.490 5.101 30 20 GKED N#Cc1csc(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)c1 437698842 XCUHPNAQUWSVMV-UHFFFAOYSA-N 376.812 5.180 30 20 GKED N#Cc1ccc(CSCc2coc(-c3cccs3)n2)c(OC(F)F)c1 439541776 NIWQIYNJKADCSU-UHFFFAOYSA-N 378.425 5.310 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(CCCC#N)c2ccccc12 444413747 VINYHEMFRFHDAI-UHFFFAOYSA-N 385.511 6.049 30 20 GKED C=C(C)CN1CCC(NC(=O)N(C2CC2)[C@H](C)c2ccc3ccccc3c2)CC1 444697903 QYYXYFCLBZEVOO-LJQANCHMSA-N 391.559 5.115 30 20 GKED CC(C)[C@H](C#N)NC(=O)c1c(Cl)cccc1Oc1ccc(F)c(Cl)c1 445956072 FPFVGSNRGTZGBD-HNNXBMFYSA-N 381.234 5.203 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1ccc(Cl)cc1 453470108 ZHBYEOWBQAVUOW-RTBURBONSA-N 386.927 5.091 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)c1 455913433 ZCCMQUYOIBAZFZ-IBGZPJMESA-N 393.878 5.041 30 20 GKED CCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 463950537 NTVKNSQHUXWETK-ZDUSSCGKSA-N 398.919 5.054 30 20 GKED O=C(Cc1cccc(F)c1)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474261007 WMPLVAPQTSUCLP-OAHLLOKOSA-N 393.302 5.197 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2csc(-c3ccc(Cl)s3)n2)n1 474434941 AICVETXRVKACMR-VIFPVBQESA-N 393.946 5.595 30 20 GKED Cc1nc(CC2CC2)oc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 475022836 LHWXJZPMRGMNSG-OAHLLOKOSA-N 397.887 5.203 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1ccccc1 475167788 DDJGUWJMFUWZDY-PGRDOPGGSA-N 394.927 5.695 30 20 GKED COCCCC[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccccc1 475348292 KTFRZRBLSZZWIO-BQCMWAFGSA-N 376.544 5.538 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)cc1 476047925 FUGWZPNZLLLTSF-UHFFFAOYSA-N 396.796 5.335 30 20 GKED C=C(C)[C@H](NC(=O)N(C)Cc1ccc(OC(F)F)cc1)c1ccc(F)c(F)c1 477746395 NUOGADVRPWJZLY-SFHVURJKSA-N 396.384 5.025 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cc2)cc1 477825470 WKYVTFDLDBVEMZ-HXUWFJFHSA-N 393.402 5.176 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)N(C)c3cc(Cl)ccc3C#N)c2c1 479564121 DQQLBOLWTVOPMN-UHFFFAOYSA-N 375.859 5.222 30 20 GKED CC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1nc(C(F)(F)F)cs1 481665125 ZNYFFHADTIDVRV-JKSUJKDBSA-N 379.451 5.542 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)CSCc3ccc(C#N)cc3)cc2s1 484666231 WODJWELSIUCNQA-UHFFFAOYSA-N 387.917 5.002 30 20 GKED CC(C)c1csc(NC(=O)c2ccccc2Sc2ccccc2C#N)n1 486956561 SMWIBJCMXUQBGF-UHFFFAOYSA-N 379.510 5.542 30 20 GKED C=CCC[C@H](C(=O)Nc1ccccc1OC[C@@H]1CCCCO1)c1ccccc1 488688635 JBQDRVHRCUIBOH-SFTDATJTSA-N 379.500 5.323 30 20 GKED N#CCC[C@H](NCc1cnn(Cc2ccc(C(F)(F)F)cc2)c1)c1ccccc1 494567057 RNKCBCLIJNMXOL-NRFANRHFSA-N 398.432 5.085 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)F)ccc1Cl 497427277 MSRAJOZAKQKLMF-UHFFFAOYSA-N 391.849 5.839 30 20 GKED N#C[C@H](NC(=O)Cc1csc2ccccc12)c1c(Cl)cccc1Cl 499839628 QEEGHENHMOVSSK-HNNXBMFYSA-N 375.280 5.132 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(F)c(Cl)cc3Cl)n2)c1 501155927 WZVFMQWCNCYKFX-UHFFFAOYSA-N 392.242 5.380 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2ccc(OC3CCCCC3)cc2)cc1 506309839 VPCPFMGEOKVARZ-UHFFFAOYSA-N 391.515 5.521 30 20 GKED Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc(C#N)ccc1Cl 507157116 AWEWSCOOBWESCR-UHFFFAOYSA-N 389.842 5.025 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)NCC1CCC(C#N)CC1 508347967 HALXZJKZAKGXQL-UHFFFAOYSA-N 392.286 5.017 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 514868985 FVLBFODSUOJDSS-APWZRJJASA-N 397.544 5.562 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc3sccc3s2)cc1 517404390 OZSTWPUVCKDKKE-UHFFFAOYSA-N 380.416 5.039 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)on1 518745423 AWIKHNMNXDRTGB-CYBMUJFWSA-N 397.887 5.642 30 20 GKED N#CCCC1CCN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CC1 522060774 MKPMSGKYKVITLY-UHFFFAOYSA-N 393.874 5.160 30 20 GKED CC[C@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccncc1 525563963 XNECYYRVCQSLRO-FQEVSTJZSA-N 391.858 5.280 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(C[C@@H](C)C#N)C3CC3)cc2)cc1 533138911 ASHAZWVUMBVLJV-HNNXBMFYSA-N 381.501 5.002 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1F)c1ccc(OCc2ccc(F)cc2)cc1 533309509 CDDWIOKAMKOXES-MRXNPFEDSA-N 378.422 5.266 30 20 GKED N#Cc1c(NC(=O)c2ccc(C3(C#N)CC3)cc2)sc2c1CCCCCC2 540730860 ZFKILKQJIVHANA-UHFFFAOYSA-N 375.497 5.086 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(SC3CC3)cc2)cc1 541217794 IJYOLOFHZAAKBL-UHFFFAOYSA-N 392.524 5.008 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)CC1 542899447 VIJRGTUASIXDKF-UHFFFAOYSA-N 399.441 5.036 30 20 GKED N#Cc1ccc(Cc2nc(-c3cccc(Oc4ccc(Cl)cc4)n3)no2)cc1 547263298 UMUKRTWAWXLADP-UHFFFAOYSA-N 388.814 5.040 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 552241459 QLWAPNSRUITCRN-GFCCVEGCSA-N 394.327 5.854 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1cc(C#N)ccc1Cl 556929553 DQFYGZNPAWTVFQ-CQSZACIVSA-N 395.915 5.477 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCc1sccc1C 560164403 XJOODYZJILXJPF-UHFFFAOYSA-N 391.496 5.137 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccc(F)cc1 561918785 VTSJHEKMVLKEMJ-HZPDHXFCSA-N 377.246 5.183 30 20 GKED CC(C)c1scnc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 567649179 HFWRMKBTEIFAAS-UHFFFAOYSA-N 379.510 5.542 30 20 GKED C[C@@H](c1ccccc1)[C@@H](C)NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 569534392 KEXZCWLMFLTPCA-IAGOWNOFSA-N 386.455 5.059 30 20 GKED Cn1ccc2c(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)cccc21 609503696 JCBCHLIPQTYJCC-UHFFFAOYSA-N 381.435 5.289 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3ccc4ccccc4n3)cc2)c1 609639234 ZHHRSTROJFFMSN-UHFFFAOYSA-N 394.434 5.220 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 609642878 CQNBKRJJPUDSCX-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1cc(C#N)ccc1C(=O)N1CCC(c2nc(-c3ccccc3)cs2)CC1 610970277 SNLVDKUGDYGYHB-UHFFFAOYSA-N 387.508 5.010 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccnc3Oc3ccccc3)CC2)cc1 611245643 VPWCDQZMSBECMF-UHFFFAOYSA-N 396.450 5.067 30 20 GKED C[C@]1(C#N)CCCN(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 612377683 RXDHXCJKMOQRSY-SJLPKXTDSA-N 399.844 5.145 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4ccc5ccccc5n4)cc3c2C1 613291229 WTGXVMAKXYAOCQ-QRWLVFNGSA-N 379.463 5.331 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 613402021 ZXKGXOKWBMXZCK-QGZVFWFLSA-N 397.425 5.346 30 20 GKED O=C(Nc1ccc(F)cc1Cl)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618538811 AOJIPXGMWXAQBJ-OCAPTIKFSA-N 392.702 5.074 30 20 GKED C=CC[C@H]1CCN(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)C1 626291104 UQTDKRWGBUFLLH-KRWDZBQOSA-N 378.476 5.069 30 20 GKED Cc1ccccc1N1C(=O)/C(=C\c2cccc(OCCCC#N)c2)SC1=S 726802196 WIILSOSJJKIHIT-XMHGGMMESA-N 394.521 5.083 30 20 GKED CCCCCN(Cc1ccc(Cl)cc1)C(=O)NCc1ccc(OCC#N)cc1 727942644 VWLWIBPMMVDBLJ-UHFFFAOYSA-N 399.922 5.144 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(CC(C)C)nc2C)cc1 727954899 VUHPWJXQDXSOIP-KDOFPFPSSA-N 397.544 5.125 30 20 GKED N#CCCCCOC(=O)[C@@H](Oc1cccc(Cl)c1Cl)c1ccccc1 730333842 OGFFAONWOKABFB-SFHVURJKSA-N 378.255 5.351 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 731293465 ZSPUSVTZDBAOAF-GUDVDZBRSA-N 386.451 5.569 30 20 GKED CCn1c2ccccc2c2cc(NC(=O)Nc3cccc(OCC#N)c3)ccc21 733622380 MKWWJOZULOPINM-UHFFFAOYSA-N 384.439 5.361 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](CCC)c1cccc(C(F)(F)F)c1)c1ccncc1 734667302 XKBRUOIAKDMAGO-RTBURBONSA-N 391.437 5.558 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(Cc2cc(Cl)ccc2OCC#N)CC1 735308788 SKNJLSWSJCAZIU-UHFFFAOYSA-N 393.918 5.412 30 20 GKED Cc1ccc(NC(=O)CSCc2cc(Cl)ccc2OCC#N)cc1Cl 735320082 KJBBTCSTDONFIJ-UHFFFAOYSA-N 395.311 5.076 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(N2CCCCC2)cc1 742476176 ZRQMIMWNFWSNEX-UHFFFAOYSA-N 395.506 5.146 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC3(CCCC3)C2)cc1Cl 743104926 KHWZHYCTEPWXBZ-FQEVSTJZSA-N 393.918 5.793 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc(-c2ccncc2)cc1 745989964 IGMIFVWENFVLBN-OUKQBFOZSA-N 392.458 5.619 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(OC)cc2F)ccc1OCC(F)(F)F 750893067 NZVBLJPRAFGCBR-YWEYNIOJSA-N 398.352 5.070 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C=NOc1ccccc1C(F)(F)F 754708667 AIMKXWNLXFWOCR-UHFFFAOYSA-N 379.769 5.266 30 20 GKED N#C[C@H](C(=O)C1CCC(F)(F)CC1)c1nc2cc(C(F)(F)F)ccc2s1 759223466 UZNFNNALZJTVDH-LLVKDONJSA-N 388.361 5.317 30 20 GKED COc1ccc(/C=C2\CCc3ccc(Cl)cc3C2=O)cc1OCCCC#N 761206132 OFIHGZKXSQCJDM-SFQUDFHCSA-N 381.859 5.244 30 20 GKED Cc1cc(Cl)ccc1C=Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O 767362173 POYWRQSDENWTIW-UHFFFAOYSA-N 393.899 5.277 30 20 GKED Cn1c([C@@H](C#N)C(=O)C2(c3c(Cl)cccc3Cl)CCC2)nc2ccccc21 774033782 FDOCRYUOJYCNPB-ZDUSSCGKSA-N 398.293 5.178 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@H](C#N)c1nccc2ccccc12 774269325 LBZXTFIKNQNPKH-GOSISDBHSA-N 387.439 5.072 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1cc(Br)ncc1F)c1ccc(F)c(F)c1 775559143 WBKJNLJFUOCZLN-BTDLBPIBSA-N 385.227 5.229 30 20 GKED CCCCN(Cc1ccccc1Cl)C(=O)Nc1ccccc1O[C@H](C)C#N 780670182 ICWCUGAHTLZFJT-MRXNPFEDSA-N 385.895 5.465 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1ccc(C#N)cc1F 781108659 SCMWFQGJWPPWPG-MDZDMXLPSA-N 379.822 5.049 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792093544 XPBVBELNFQPGFR-RXXLQFRUSA-N 380.369 5.533 30 20 GKED O=C(/C=C/c1ccc(Cl)cc1-n1cncn1)c1cc(Cl)sc1Cl 794937767 JBPGQRMQISGOGY-DUXPYHPUSA-N 384.675 5.185 30 20 GKED CC(C)Cc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)c1 796892399 YHEYWFHVERUNHL-OXJNMPFZSA-N 389.524 5.384 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)OCCCC1(C#N)CCOCC1 800141412 BUNFBCCXJKVDAJ-UHFFFAOYSA-N 399.512 5.071 30 20 GKED C[C@H](OC(=O)CCCCCC#N)C(=O)N1c2ccccc2Sc2ccccc21 805698139 STPWSWUKNCHTMB-INIZCTEOSA-N 394.496 5.222 30 20 GKED O=C(/C=C/c1ccc(Oc2cccc(Br)c2)cc1)c1ccnc(O)c1 806556734 YUVQGMCHUANWLZ-RMKNXTFCSA-N 396.240 5.238 30 20 GKED N#C[C@H](C(=O)CCCc1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813217831 JPXRWJLKMFFVHU-IBGZPJMESA-N 382.385 5.453 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc(C)nc1C 814926701 FWKWQRWYMYBYDZ-UHFFFAOYSA-N 385.393 5.010 30 20 GKED C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)N[C@@H](CCCC#N)c1ccccc1 816627285 KEIFQDJFRRKOJQ-GIVPXCGWSA-N 385.552 5.189 30 20 GKED N#C[C@H](C(=O)c1sc2ccccc2c1Cl)c1nc(-c2ccccc2)cs1 917026064 WABFEUVYBVYQDE-CQSZACIVSA-N 394.908 6.168 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCc1ccc(-c2ccccc2)o1 920101527 CNPIBOUSTSLXHD-FQEVSTJZSA-N 396.446 5.261 30 20 GKED COc1cc2ccc(C(C)=NNc3ccc(Cl)c(C(=O)O)c3)cc2cc1OC 1776033945 AUVVZGOOSNCGPJ-UHFFFAOYSA-N 398.846 5.045 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NOC/C=C/Cl 1776080747 ZDFOYNAXOBABRD-UOVXECNQSA-N 387.863 5.041 30 20 GKED O=C(O)c1ccc(Br)c(/C=C\C(=O)c2ccc3ccccc3c2)c1 1776131440 RCIXRVXJAVLBLM-NTMALXAHSA-N 381.225 5.197 30 20 GKED CC(=C\c1ccccc1C(F)(F)F)/C=C1\CCc2occ(C(=O)O)c2C1=O 1776199793 AKOUVOXVHQDBCP-BLTLMDCKSA-N 376.330 5.155 30 20 GKED COc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1C(C)(C)C 1777359881 AXRPPQGMTFHACO-SFQUDFHCSA-N 378.468 5.294 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(F)ccc2Oc2ccc(Cl)cc2)c1 1777685039 YWRLHYMUPDNJCS-ONNFQVAWSA-N 396.801 5.866 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1ccccc1Cl 28173983 BCUDOWWEFFYZIE-UHFFFAOYSA-N 389.883 5.128 30 20 GKED COc1cccc2sc(NC(=O)c3ccccc3-c3ccccc3C#N)nc12 28715107 RCYJUBHOHPOOGC-UHFFFAOYSA-N 385.448 5.096 30 20 GKED O/C(=N\c1nnc(-c2ccco2)s1)c1cnc(-c2ccccc2Cl)s1 50295476 JCEPOUOVLLFBLS-UHFFFAOYSA-N 388.861 5.211 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccccc1Br 66802228 APHSNXDPTIKSOL-ZDUSSCGKSA-N 389.318 5.025 30 20 GKED CC(C#CC(O)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1 98178409 HDJRSRHDONLMCI-UHFFFAOYSA-N 388.510 5.932 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCOc1ccc(F)cc1Cl 108237384 FGZMSQNNTOSDMI-CYBMUJFWSA-N 392.883 5.138 30 20 GKED C[C@@H](Nc1ccc(Cl)c(C#N)n1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 111218037 FPFIJGNGQFBRQH-CYBMUJFWSA-N 394.837 5.171 30 20 GKED CC[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1nccs1 131016434 VHIUKGGDRKWNGV-INIZCTEOSA-N 379.510 5.047 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 137446997 OTRIIXKZGJEDSL-LAUBAEHRSA-N 393.556 5.924 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccccc1OCC1CC1 154120984 YSZVBXATLWBUEA-UHFFFAOYSA-N 399.450 5.095 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](c2ccccc2)c2nccs2)c1 171401362 GJNCLQLKBJURBV-IBGZPJMESA-N 379.485 5.009 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(Cl)nc2)cs1 255344704 KRFZHARHRABVED-TWGQIWQCSA-N 397.887 5.081 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@H]2CCCCS2)c1)[C@@H]1CCCCS1 329355423 YYCLODQXTBZRRP-SJORKVTESA-N 378.563 5.303 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@H]1CCCC(F)(F)C1 409961948 GGKGRQQSBDZSQI-JOYOIKCWSA-N 389.286 5.251 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H]1CC[C@H](C#N)C1 424963630 DPQLEXDYOJZNGD-NWDGAFQWSA-N 392.286 5.023 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ccc(C(F)(F)F)cn1 425535270 NDPDYYOGZAWHOC-GFCCVEGCSA-N 387.327 5.033 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2C(=O)c2cccs2)s1 430612238 QUNSKHFOXNGINV-OAHLLOKOSA-N 394.521 5.223 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3ccccc3SCCC#N)cc2)cs1 440460265 KVGUSOGQQFRRFB-UHFFFAOYSA-N 379.510 5.377 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 443876994 IGAWUGWRUXRHNC-UHFFFAOYSA-N 386.499 5.106 30 20 GKED CCc1nc([C@H](C)NCCC(C#N)(c2ccccc2)c2ccccc2)cs1 444682581 ATXBZQLVCJZYGM-SFHVURJKSA-N 375.541 5.256 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)CCCCC1 449572455 JMNGVAFUIRMIFX-UHFFFAOYSA-N 383.561 5.505 30 20 GKED N#CCCCc1nc(-c2ccc(Oc3ccc(F)c(Cl)c3)c(F)c2)no1 463056941 NZEGSOJAYSJILE-UHFFFAOYSA-N 375.762 5.307 30 20 GKED CC[C@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C1CCC(C)CC1 469955103 ACIOFYVKUYQOJK-NGICGMGXSA-N 395.547 5.061 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc3ncccc3c2)cc1F 470523038 KIRKHHFWHKTDTA-UHFFFAOYSA-N 383.382 5.290 30 20 GKED C[C@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 471342509 PVIDSMHQFZLTDS-ZDUSSCGKSA-N 377.271 5.418 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H]1c1cccc(OC)c1 475557292 XRJQQIPNHOWBLR-JPYJTQIMSA-N 392.543 6.162 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(OC(F)F)cc1 475571103 UNOXKYCVOGBXRU-OAHLLOKOSA-N 388.458 6.023 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 475652308 FWEHRSNHILKDFZ-SIKLNZKXSA-N 394.540 5.291 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)NCC(C)(C)CCC#N)cc1 477108806 OGYCLQGMKSYHJM-KRWDZBQOSA-N 381.545 5.991 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(C#N)cc1Br 481049805 FIUXEDXHWKKFFG-LBPRGKRZSA-N 386.318 5.123 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCCCc4cc(C#N)ccc43)ccc21 481998719 LSBOOOWKIMLQCK-HSZRJFAPSA-N 398.510 5.021 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1 486210856 CMXVXIQKWWPDJG-OAHLLOKOSA-N 380.538 5.579 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2cc(C#N)ccc2F)c1)c1ccccc1 487347925 WGZMIUYIKGJIAO-UHFFFAOYSA-N 393.849 5.239 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487393130 TYBIOXKFHHLELM-UZLBHIALSA-N 399.332 5.179 30 20 GKED N#CCC[C@@H](NC(=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1)c1ccccc1 489755132 JNEVZVZQCWPJRW-WOJBJXKFSA-N 399.947 5.261 30 20 GKED CC[C@@H](c1ccccc1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 494720107 HTEMTDHLHSDSJX-QHCPKHFHSA-N 375.493 5.291 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)CCCC1(C)C 504848511 HFOUFYOCCYHALQ-SFHVURJKSA-N 395.469 5.163 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1nc2ccccc2s1 505312037 OCYHOOKUVIOADW-NSHDSACASA-N 397.431 5.188 30 20 GKED CCCC[C@@H](CC)COCc1cccc(NC(=O)N2CCC(C)(C#N)CC2)c1 506952240 OALVMOGWBVNJEL-LJQANCHMSA-N 385.552 5.577 30 20 GKED Cc1cc(OC(F)F)c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)s1 512980780 KFGLTBYTDSDBPU-VIFPVBQESA-N 398.843 5.411 30 20 GKED CC[C@@H](NC(=O)c1cccc(COc2ccccc2C#N)c1)c1cccs1 513239343 XHUMCXUUQYTCPQ-LJQANCHMSA-N 376.481 5.080 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cccc(-c4ncco4)c3)c2)c1 513964716 MXUOODLLMRESFV-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@@H]3c3cccs3)s2)cc1 514502961 OSGRWNKNZLKQAM-QGZVFWFLSA-N 394.525 5.036 30 20 GKED Cc1ccccc1N(C(=O)c1cccc(CC#N)c1)c1nc2ccccc2s1 516469747 MBXOSGRPBRTXRH-UHFFFAOYSA-N 383.476 5.649 30 20 GKED Cc1ccc(CSCCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 517473392 DUECPHYHVSBBGX-KRWDZBQOSA-N 399.585 5.302 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(Oc2ccccc2)cc1 517779481 IUNDNGOYTFJNDY-UHFFFAOYSA-N 399.494 5.471 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 518120110 SOIXDKIJWFIHQO-LSDHHAIUSA-N 391.323 5.741 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 518162811 KEMJNYMUVXPDPA-OAQYLSRUSA-N 388.471 5.197 30 20 GKED C[C@H](Nc1ccc(F)c(C(F)(F)F)c1)C(=O)Nc1ccccc1C(F)(F)F 520060174 PGNYUNJJPKTOME-VIFPVBQESA-N 394.290 5.302 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 531456540 GDXOEKMOUNTSAO-UNMCSNQZSA-N 377.488 5.086 30 20 GKED Cc1ccc(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c(Br)c1 535870408 KVWWKNTXDOMILQ-UHFFFAOYSA-N 398.285 5.005 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C1CCC(F)(F)CC1 536195087 AXYLWRBLXCWKHC-UHFFFAOYSA-N 386.417 5.365 30 20 GKED CCOc1cc(NC(=O)c2ccccc2Oc2ccccc2C#N)ccc1OC 540879126 XRKPYEFKHQPFAL-UHFFFAOYSA-N 388.423 5.010 30 20 GKED CSC[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 541915352 IZBDCQXPCAKPQN-LJQANCHMSA-N 394.462 5.904 30 20 GKED C=C(C)[C@H](Cc1nc(-c2ccnc(Oc3ccc(C)c(C)c3)c2)no1)OCC 547115200 WOBOQBCFFLYTML-IBGZPJMESA-N 379.460 5.064 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1ccc(Br)cc1C#N 553907757 OJYPRYKBCYSKHV-QGZVFWFLSA-N 397.238 5.413 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1nccc2ccccc12 554313494 ZEHRGFRJOYGZEL-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccc(OC)cc2C2(CC2)C1 558496130 IDYNKTGHNVXSND-UHFFFAOYSA-N 390.527 5.626 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)n(-c4ccccc4)n3)n2)cc1 558731695 HNSPHMFBUCADOA-LJQANCHMSA-N 398.491 5.103 30 20 GKED Cc1cccc(O[C@H](C)c2nnc(N3CCC(CCC#N)CC3)n2C(C)C)c1C 571164996 MFQBUKMTWIOLAJ-LJQANCHMSA-N 395.551 5.136 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc(C(F)(F)F)n3)n2)cc1 576257639 SDNVTQIFOFDENK-NSHDSACASA-N 393.415 5.084 30 20 GKED Fc1cc(-c2noc(-c3csc(C(F)(F)F)n3)n2)ccc1C(F)(F)F 584554840 BCSZPLUPISRXRV-UHFFFAOYSA-N 383.248 5.037 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1Cl 589646726 KFICEUWWBDQBBG-NHCUHLMSSA-N 375.871 5.054 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603693029 SZJDLAHAVCTKDR-HNNXBMFYSA-N 390.418 5.110 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F 609080500 ZKTDKTURMRMITM-UHFFFAOYSA-N 393.384 5.406 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2cccc(C#N)c2)c(-c2ccccc2Cl)n1 609372072 UOAKGTNRCFHNAH-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CC(C)(C)[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 609499878 PIERFIXYISBSLD-JOCHJYFZSA-N 385.467 5.263 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1 609643837 VEKBOXPLNXSQJB-QGZVFWFLSA-N 386.451 5.097 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccnc1Oc1ccccc1 610629292 AKXVVKJNKKJGLH-UNMCSNQZSA-N 398.466 5.178 30 20 GKED C[C@H](NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1 611278996 XLLNJPBLRKQXGC-ORAYPTAESA-N 387.405 5.089 30 20 GKED Cc1cc(C)c(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1CO 615894288 QYBZUCVZWVXIQG-UHFFFAOYSA-N 388.492 5.071 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(Br)cc1 618247935 OMOAKIHDDTYFPT-SECBINFHSA-N 398.087 5.119 30 20 GKED C=CCN(C(=O)c1nccs1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 683731968 VTWJONJXKKUKML-UHFFFAOYSA-N 396.324 5.406 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(F)c(Br)c2)c1 726744294 ZTNIPUOTMHNSQK-TWGQIWQCSA-N 388.236 5.167 30 20 GKED CCOc1cccc(C=Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)c1O 729149731 OIWFSPVUHLUKKV-UHFFFAOYSA-N 396.487 5.229 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)/N=C/c1ccc(O)c(O)c1O 730148015 XXAUXQHPNCPXHD-LUKZVCJISA-N 388.876 5.069 30 20 GKED C#CCOc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)c1 731109401 RCLALJBORPCVMQ-ZDUSSCGKSA-N 377.271 5.230 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c2)cc1 732436980 ASMGOHIOFQIHKU-UHFFFAOYSA-N 385.467 5.110 30 20 GKED C=CC[C@@H](NC(=O)NCC(C)(C)c1ccc(OCC(C)C)cc1)c1ccncc1 734669898 WJBVXBDVCGMUFS-JOCHJYFZSA-N 395.547 5.011 30 20 GKED C=CCc1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc(OC)c1O 734982127 XIBKWWNTEUCBNB-YHYXMXQVSA-N 376.424 5.340 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 737479776 XIHYBQCNPZGZCU-LLVKDONJSA-N 397.780 5.338 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@]34CCc3ccccc34)n2)cc1 744034345 GSEJQKHDWRNRSN-WWEVIYMKSA-N 384.504 5.199 30 20 GKED CN(C(=S)Nc1ccccc1C#N)[C@H](c1ccncc1)c1ccc(Cl)cc1 749014023 SRONHYFHYKNONY-FQEVSTJZSA-N 392.915 5.025 30 20 GKED C=CC[C@H](NC(=O)CCSc1ccnc2cc(Cl)ccc12)c1ccncc1 751276058 SVHJKDUUOGLJFH-SFHVURJKSA-N 397.931 5.199 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1F 752635936 IYZWVHNPEXQZQY-VFNWGFHPSA-N 391.421 5.503 30 20 GKED O=C(/C(=C\c1ccc(O)c(F)c1)c1nc2ccccc2s1)c1ccccc1 755570325 HHPFLSHEZHQCQT-FOWTUZBSSA-N 375.424 5.565 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(-c3ccoc3)c2)cc1 760969051 MCNFJONGRSIARQ-KSFYIVLOSA-N 386.451 5.421 30 20 GKED Clc1nc(Oc2ccccc2)sc1C=NNc1ncnc2ccsc12 764835628 OJPKIHCDPULDBT-UHFFFAOYSA-N 387.877 5.040 30 20 GKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccc2cc(OC)ccc2c1 772982721 FLDMEEVNKYHXQP-RDGATRHJSA-N 388.511 5.770 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 779397223 SEORGKJLBMSRSJ-KSFYIVLOSA-N 385.471 5.154 30 20 GKED C#CCCCCCC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 779913711 JZPKZZWEYQRPQD-UHFFFAOYSA-N 398.425 5.575 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1Oc1ccncc1 782428378 WSPVQDIFSUMWAM-UHFFFAOYSA-N 394.887 5.516 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(C(F)(F)F)cc1 792095780 YEEOLXUNPMQHRO-KUHUBIRLSA-N 382.385 5.624 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2cc(Br)ccc21 794956965 LAYDNJMPXPWSDN-TWGQIWQCSA-N 388.208 5.137 30 20 GKED COc1cc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)ccc1C#N 799494706 JKZSKBFEIZSSTJ-PXNMLYILSA-N 399.219 5.254 30 20 GKED CON(Cc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@H](C)C#N 810183709 DARLWMZFPMXHPB-CQSZACIVSA-N 389.908 5.187 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 814630180 RJUFICYMLRVGHE-NRFANRHFSA-N 395.572 6.442 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCc2cc(SC(F)F)ccc21)c1ccccc1 815635362 BBYPLHXJVWFBTC-NHCUHLMSSA-N 386.511 6.403 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H]1CCCc2ccccc21 915352403 HXFLCTSKDJRUJU-DQEYMECFSA-N 395.506 5.883 30 20 GKED CCCCCCCCCC(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 918672864 UTXKVJBDESOVTJ-KBPBESRZSA-N 375.397 5.716 30 20 GKED CC(=NNc1c(Cl)cccc1Cl)c1cccc(OCCCC(=O)O)c1 1776048796 AFGQOXCPAPGYBG-UHFFFAOYSA-N 381.259 5.073 30 20 GKED CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NN=Cc1ccc(-c3cccc(CC(=O)O)c3)cc1)C2 1776057220 OWRRMRVOOBEEGL-HWBMXIPRSA-N 390.527 5.119 30 20 GKED Cc1c(NN=C/C=C\c2ccc(OCc3ccccc3)cc2)cccc1C(=O)O 1776088375 IGYCIKLQJMBWCI-ANSNBNRYSA-N 386.451 5.383 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)cc1OCCC 1776125811 SYFKMMXSARZXND-USTLKGCXSA-N 394.467 5.258 30 20 GKED O=C(O)c1ccc2[nH]cc(/C=C/C(=O)c3ccccc3OCc3ccccc3)c2c1 1776126706 UYKFUZDZMVUXLN-ACCUITESSA-N 397.430 5.341 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776472196 YPQLWGMVAHAXEQ-MFNCVGGLSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)ccc1OCC1CC1 1776782779 AGYHQXQRFXAKFN-LJQANCHMSA-N 381.944 5.422 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)cc1 1777472335 YTSCBUQDNRFZIJ-VUTUTYQISA-N 398.458 5.568 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C)C#N)nnc1-c1ccc(Cl)cc1Cl 5355746 PYJIFIUGJSYCEO-LBPRGKRZSA-N 389.311 5.554 30 20 GKED N#Cc1ccc(CSc2nc3ccccc3c(=O)n2C2CCCCC2)c(F)c1 10143666 IFWOCAZXUNFMBU-UHFFFAOYSA-N 393.487 5.205 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1OCC 41546768 HXWGKRSKSRMPNV-AWEZNQCLSA-N 398.846 5.159 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc4ccccc4s3)s2)o1 48824600 JHLQTWWIUMLJGE-LBPRGKRZSA-N 379.466 5.120 30 20 GKED N#CCCN(Cc1ccco1)C(=O)CSc1cccc2cccc(Cl)c12 60625880 SBMJMARQTSTVDX-UHFFFAOYSA-N 384.888 5.121 30 20 GKED CC(C)(C)n1cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cn1 65923528 CMEZENHPGFZHAO-UHFFFAOYSA-N 390.512 5.054 30 20 GKED C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)Nc1ccccc1SCCC#N 78668585 PISIFUDHEURXME-CYBMUJFWSA-N 394.418 5.117 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1cc(Br)cs1 108201832 WQIJGIDFPAOLRS-UHFFFAOYSA-N 395.347 5.088 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC1=Nc2ccccc2C1 119253022 RZORSVNWRYUKFK-AWEZNQCLSA-N 381.526 5.039 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4nc(C)ccc4c3)n2)cc1 120022104 MCOZOFUZLQJVRN-LJQANCHMSA-N 399.475 5.165 30 20 GKED Cc1sc(NC(=O)c2cccc(SCC#N)c2)nc1-c1ccc(F)cc1 175525641 HYBMFMNQVKQKEK-UHFFFAOYSA-N 383.473 5.126 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 186025985 RZGSPRHMHUZDPK-INIZCTEOSA-N 376.422 5.232 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 237797687 KECJYHDKCDDGHV-QFIPXVFZSA-N 396.943 5.963 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)CCCCOc1cccc(C#N)c1)C1CC1 303524187 VLSOFMPDPBKREG-KRWDZBQOSA-N 396.918 5.513 30 20 GKED Cc1c(/C(O)=N/[C@H]2c3ccccc3CC23CCOCC3)cnn1C1CCCCC1 329606920 MRARLNRZIZXRFI-QFIPXVFZSA-N 393.531 5.096 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410688653 OEBCUMLOBBSIGU-LDYMZIIASA-N 395.265 5.356 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425755679 KDRYZTRYTROCGW-KXBFYZLASA-N 389.421 5.263 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N[C@H](CCCC#N)c1ccccc1 431877362 HBARVPHBVVYQBB-LEWJYISDSA-N 379.504 5.271 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 431947449 ZSRJMPVSEVYCQU-CZAAIQMYSA-N 399.922 5.150 30 20 GKED N#CCCC[C@H](NCC(=O)Nc1cccc(Oc2ccccc2)c1)c1ccccc1 433013380 XJKXGWVDAHIKJE-DEOSSOPVSA-N 399.494 5.442 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1c(C)noc1C 437472144 XXKBZYJGMQOZKB-KRWDZBQOSA-N 393.418 5.227 30 20 GKED CCCOc1cc(C)ccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 437807397 SBHPBQWOZBGJMJ-PZJWPPBQSA-N 377.488 5.088 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C)CCC[C@@H]1C 437835605 GUSLZQFONDCYPM-WMZOPIPTSA-N 377.488 5.701 30 20 GKED CCCOc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c(C)c1 437890084 ORYLOCOWXQLLPW-IFMALSPDSA-N 377.488 5.088 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCC1CCC(C#N)CC1 441000183 AONKPQGTGVRWMA-HDYDNRTBSA-N 375.516 5.386 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc3c2CN(c2ccccn2)C3)CCCC1(C)C 444926564 XRCJYCBCEMAAIO-OAQYLSRUSA-N 390.531 5.200 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H](CC(F)(F)F)c1ccccc1)c1ccccc1 457897714 HPZIGDXXRPUGQW-RTBURBONSA-N 389.421 5.414 30 20 GKED COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458857480 ZSMHGHHZVBXUFN-DHIUTWEWSA-N 391.515 5.149 30 20 GKED Cc1ccc(C(C)(C)CN(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 460537607 OPOMJLZJAMAZDT-UHFFFAOYSA-N 399.494 5.104 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 463879892 QRFVBFWSVKJQAW-CQSZACIVSA-N 393.468 5.157 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1 469275382 RPBRVEKXPIDZIN-FQEVSTJZSA-N 381.907 5.486 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)c2cn(CCCC#N)c3ccccc23)cc1 469380428 BXLWOZKDEKPTQO-OAQYLSRUSA-N 385.511 5.101 30 20 GKED C=CCCOCCCCC(=O)N1CCCCC[C@H]1c1ccc(C(F)(F)F)cc1 471335265 HGIRSSLFNRXICJ-FQEVSTJZSA-N 397.481 5.912 30 20 GKED CC(C)Sc1ccccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 472560063 MBEKBMBGHHGMRZ-UHFFFAOYSA-N 392.480 5.483 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@H]1CCCC[C@@H]1C(F)(F)F 473254854 KKJKOOYJDYFWPM-STQMWFEESA-N 386.311 5.107 30 20 GKED Cc1cc(Br)cc2c(C(=O)[C@H](C#N)c3nc4ccccc4o3)coc12 473490906 PJRTWLWJLQARNJ-ZDUSSCGKSA-N 395.212 5.135 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 473681049 XTGPZEZTPJRWTN-SJORKVTESA-N 399.585 5.692 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)o2)cc1 474429500 FZOWTADWMVNQGW-MRXNPFEDSA-N 378.453 5.219 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474701618 GQCCSPFAGACWTJ-GDBMZVCRSA-N 375.299 5.600 30 20 GKED N#CC[C@@H](CC(=O)Nc1nc(-c2ccccc2Cl)cs1)c1ccccc1 475770612 MXMBWXURQGNILI-HNNXBMFYSA-N 381.888 5.490 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481567218 BFMRDTLCSRLBHN-LJQANCHMSA-N 381.451 5.073 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1sc2c(c1C#N)CCCCCC2 483444712 XCXCUWDQASPUMB-HNNXBMFYSA-N 382.529 5.420 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCCC[C@@H]2c2ccc(F)cc2)c1 483639072 OAUBTKWERBKYOY-QGZVFWFLSA-N 389.377 5.058 30 20 GKED CC(C)c1ccc([C@H]2CCCN2C(=O)c2cnc(C(F)(F)F)c(C#N)c2)cc1 491313112 SMQNTNITKYQIMH-GOSISDBHSA-N 387.405 5.073 30 20 GKED N#CCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1Cl)CCC2 503656886 ZPYZFYGTRBZHCX-PEZBUJJGSA-N 387.870 5.018 30 20 GKED CC(C)c1ccc(Sc2ccc(NC(=O)N3CCC(C)(C#N)CC3)cc2)cc1 506919463 WIRHZQDBCPQJPY-UHFFFAOYSA-N 393.556 6.119 30 20 GKED C[C@@H]1CCC[C@H](CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 508248139 OBVSNCAAUYRMLU-XLIONFOSSA-N 378.541 5.407 30 20 GKED C[C@H]1C[C@@H](C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 510023642 NXWWKCBTQULAQZ-YRNRMSPPSA-N 381.907 5.505 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1C[C@H]1C[C@H]2CC[C@H]1C2 517473470 OAFUPALVWLTXQE-CXQPBAHBSA-N 397.588 5.761 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)cc1 517604629 IRRLIFAFGPENID-DEOSSOPVSA-N 381.479 5.148 30 20 GKED N#C[C@H](NC(=O)Cc1ccc(-c2ccccc2)cc1)c1cccc(C(F)(F)F)c1 518320422 KRARFWOTYTYZFD-NRFANRHFSA-N 394.396 5.296 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 518754607 TVTZOOROFKONQO-QVKFZJNVSA-N 397.519 5.883 30 20 GKED Cc1ccc(SCCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 518848066 WOBSEPWEXGLGMI-KRWDZBQOSA-N 379.312 5.165 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)ccc1F 519593122 ZNMPOVOLUVVPQC-UHFFFAOYSA-N 391.402 5.365 30 20 GKED CCCc1ccc(C(=O)CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520188716 OKKPMGDHQMBWNX-KRWDZBQOSA-N 394.540 5.635 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccccc1OC(C)C 521571557 NCUIEOQTIRRSMM-UHFFFAOYSA-N 387.439 5.094 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC1 522517304 VIYWOMVSWAABEQ-IBGZPJMESA-N 377.488 5.034 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCCc3cccnc3)n2)o1 522964475 WNHWFTDIGZIARF-UHFFFAOYSA-N 389.402 5.270 30 20 GKED N#CCc1cccc(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)c1 525367911 GLQDIHDJYJJFHI-UHFFFAOYSA-N 384.810 5.313 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2CCC(F)(F)F)c1 533907002 PBFPRJXHMNMTGR-UHFFFAOYSA-N 376.378 5.116 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Br)c2ccccc12 540226091 PULKOYURJHGVSH-UHFFFAOYSA-N 394.272 5.138 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)C1CCCCC1 541602196 HVADHMHEJVGDNC-KURKYZTESA-N 387.593 5.071 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 543944110 GOWMKJPSLYHSFA-ZWKOTPCHSA-N 394.478 5.218 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 552172615 JUWYVAXBJBNKAE-UHFFFAOYSA-N 379.419 5.460 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3[nH]ncc23)cc1Cl 552415822 RWSXAAZIIAKIFY-SFHVURJKSA-N 386.842 5.124 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)[C@@H]2CCCOCC2)cc1 556691187 ORMBMGYTXICCPB-CQSZACIVSA-N 386.904 5.118 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)[C@H](C#N)CCc1ccccc1 563706588 HAYKSZYLGIUAJF-NRFANRHFSA-N 375.516 5.087 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F)C(F)(F)F 567949908 WFKFEIXXSRNEEX-VIFPVBQESA-N 395.274 5.426 30 20 GKED C[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1cccc(OCc2ccccc2)c1 568387914 VZPGOLLYXXNMQH-LJQANCHMSA-N 391.515 5.052 30 20 GKED C=CCN(C(=O)c1occc1C(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 577130448 YAOGTPOOCOERSE-UHFFFAOYSA-N 397.456 5.268 30 20 GKED COc1cc(C#N)ccc1OC[C@@H]1CCCO[C@H]1c1ccc(C(F)(F)F)cc1 580689326 GGHREOGOWCUPQI-JXFKEZNVSA-N 391.389 5.132 30 20 GKED Cn1ncc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1-c1ccccc1 588192435 PLLTVTMRVOMDFW-UHFFFAOYSA-N 394.434 5.003 30 20 GKED N#CCCCCCC(=O)N[C@H](c1ccccc1)c1cc(Cl)ccc1Cl 588676896 ZQTDLQFSCITCFK-HXUWFJFHSA-N 375.299 5.673 30 20 GKED N#Cc1ccc(N2CCC(c3nc(-c4ccccc4)no3)CC2)c(C(F)(F)F)c1 589571909 IJQARBCQIULYOD-UHFFFAOYSA-N 398.388 5.011 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCc3cccnc32)cc1Cl 589830565 XCLCVZPQNBXKBM-UXHICEINSA-N 387.870 5.059 30 20 GKED N#CC1(CC(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)CCCCC1 596697029 JVCLKNXZBRVUJY-UHFFFAOYSA-N 376.460 5.133 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc2c(c1)CCCO2 596736163 UIMHOWDGAXVVHH-JKSUJKDBSA-N 395.528 5.289 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)[C@H](C)CC#N 597289930 QLKPSFFCHWYQJQ-CQSZACIVSA-N 378.451 5.220 30 20 GKED C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H](CCCC#N)c1ccccc1 599048697 PQDWCBSJUZFGIH-RDTXWAMCSA-N 395.856 5.710 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N(Cc2ccc3[nH]ccc3c2)Cc2cccs2)C1 602318182 CJGMOAOIHHJXGK-LPHOPBHVSA-N 392.528 5.024 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@H]1c1ccccc1 604364104 NVZJSLYMYQKKTC-QHCPKHFHSA-N 397.478 5.966 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)Cc3csc(-c4cccs4)n3)c2C#N)C1 604480827 PJYMCJCMDRCBGB-LLVKDONJSA-N 399.566 5.111 30 20 GKED CCCN(C(=O)c1csc(-c2ccc(C)cc2)n1)c1cc(Cl)ccc1C#N 609285813 FZCLAWBBGPEQOD-UHFFFAOYSA-N 395.915 5.700 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(F)c(Cl)c1 609370715 QXOWPCUDBADDOW-GFCCVEGCSA-N 394.924 5.604 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1ccc(F)cc1F 609432518 VXUXVNOXRSQDFU-AWEZNQCLSA-N 393.393 5.068 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccccc1 609435509 SRWJKSHFOUIHPI-OXQOHEQNSA-N 379.529 5.696 30 20 GKED N#C[C@@H](NC(=O)c1ccc(OC2CCCC2)cc1)c1cccc(C(F)(F)F)c1 609460374 DKZWAZMZNIOPAY-LJQANCHMSA-N 388.389 5.021 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2csc(-c3cccs3)n2)CC1 609544876 SCMAFHHQAYDWCZ-UHFFFAOYSA-N 395.553 5.223 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1cccs1 609643915 HTCHSYCFNMSSFJ-UHFFFAOYSA-N 394.471 5.254 30 20 GKED C[C@H](Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1ccc(C#N)cc1 610341245 DWQPXTYELRLKNU-IBGZPJMESA-N 395.506 5.253 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 610387558 LAERNMHJLGMPMS-NSHDSACASA-N 385.558 5.419 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N(C)c1ccc(C#N)cc1F 610550824 YPUYYTQQVWSPIC-LBPRGKRZSA-N 399.878 5.043 30 20 GKED CCCCc1noc([C@H](C)SCc2ccc(C#N)cc2Br)n1 611496579 MVMJZRNAOXRFIW-NSHDSACASA-N 380.311 5.041 30 20 GKED C=CCOc1c(Cl)cc(CNC2(c3nc(C)cs3)CCCC2)cc1OC 623417261 YAYNOPUBCNXOON-UHFFFAOYSA-N 392.952 5.237 30 20 GKED CCCOc1ccc(C(C)=NNc2ncnc3sccc23)cc1OCCC 725819323 PNKHEXAOTMUIMP-UHFFFAOYSA-N 384.505 5.105 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(CO[C@H]3CCC[C@@H](C)C3)c2)c1 726484886 KBGKELKHEAYECP-VGSWGCGISA-N 378.541 5.572 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1-n1cccc1 730996326 XVBWRBZEMIOMIO-MRXNPFEDSA-N 375.497 5.290 30 20 GKED N#CCOc1ccc(COC(=O)c2ccccc2SCc2cccs2)cc1 733400413 RJRJCOVMBXRIQZ-UHFFFAOYSA-N 395.505 5.300 30 20 GKED C=CC[C@@H](NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1ccncc1 734235624 KZTAKGJICOESDM-BBOMDTFKSA-N 380.797 5.201 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3sccc3Br)s2)cc1 734305921 HXKBVGGSKRYTQO-SREVYHEPSA-N 390.327 5.839 30 20 GKED C=CC[C@H](NCc1ccc(-c2cccc(Br)c2)o1)c1ccncc1 734509163 HYGWODHPAPICIA-IBGZPJMESA-N 383.289 5.511 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 734654185 QSLJOMVDIDFLNV-APPDUMDISA-N 382.266 5.205 30 20 GKED C[C@@H](C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1)c1cccs1 738788256 AFSPUYWKGNRDBW-GOSISDBHSA-N 375.493 5.295 30 20 GKED CC(CCC1CCCC1)=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1 740763068 WEVIBIWOLSWDFT-UHFFFAOYSA-N 377.414 5.316 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1 742891125 GPPMVJAMOCQRNV-INIZCTEOSA-N 396.487 5.089 30 20 GKED C#CCCCNC(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 743209484 ZZMQYJZCFRGWJE-UHFFFAOYSA-N 392.478 5.267 30 20 GKED C[C@H]1CN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)[C@@H]1c1ccccc1 743626607 YBAKEJSYPQKGKL-AOMKIAJQSA-N 387.508 5.189 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccc(CC)cc3)o2)cc1 744028699 NVNJDZDZQPINKE-FQEVSTJZSA-N 386.451 5.033 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3cccc(Cl)c3)n2)cc1 744035393 RIGGTFKBTZLWFI-KBXCAEBGSA-N 380.900 5.752 30 20 GKED C=C(Cl)CNC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 746281108 BOUMLRZSVDNLHG-UHFFFAOYSA-N 375.855 5.416 30 20 GKED Cc1nc2ccc(/C=C3/SC(=Nc4c(C)cccc4C)NC3=O)cc2s1 754827040 KNGMNUSNTXHDPT-LICLKQGHSA-N 379.510 5.113 30 20 GKED C=CC[C@H](NC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@H]1C)c1ccncc1 756041617 YIVUSGAIGANYHK-YJYMSZOUSA-N 390.314 5.335 30 20 GKED C[C@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(OCC#N)cc1 776855911 QRKXWFCTACWYOC-AWEZNQCLSA-N 396.384 5.179 30 20 GKED N#Cc1cccc(OCC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c1 786595948 SSRHCQZXWMYSTC-UHFFFAOYSA-N 378.815 5.021 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(SC(C)C)cc2)cn1 792884794 RVCMKDKFCVGIQO-MDWZMJQESA-N 390.508 5.549 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OCCCC2(C#N)CCOCC2)c(Cl)c1 799176198 INNCOZYPZBDVOK-UHFFFAOYSA-N 394.899 5.166 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 800385615 CLXQFIGLXHENRO-WDEREUQCSA-N 382.382 5.090 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2cscc2C(F)(F)F)SC1=S 811624430 DVHVSOKWKUIJLY-WLRTZDKTSA-N 396.440 5.044 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 813057342 JYXQZKAMTULGFZ-KXBFYZLASA-N 384.888 5.230 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1cc(C(F)(F)F)ccn1 813215796 BTUQQJYLIPHOQE-QYZOEREBSA-N 380.369 5.234 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2ccccc2)C(F)F)cc1 814576485 DOJALMIFCJQLEQ-LEWJYISDSA-N 391.421 5.470 30 20 GKED Cc1cc(Cl)cc(C=Nn2cnnc2SCc2ccc(Cl)cc2)c1 814769304 MKQUCTZNNNFKNN-UHFFFAOYSA-N 377.300 5.068 30 20 GKED N#CCCOCCOC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 815239159 KNQHMZJQWXPDLY-UHFFFAOYSA-N 399.446 5.020 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2sc3cc(Br)ccc3c2Cl)C1 855254664 OQUSPYQJSUVLRD-JTQLQIEISA-N 397.725 5.083 30 20 GKED COc1cc(NCc2cc(C#N)ccc2Br)cc(OC)c1C(C)C 864022603 RUWBMCVLAKKNCD-UHFFFAOYSA-N 389.293 5.073 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1cc(N2CCCC2=O)ccc1F 918546413 JMVWEXMXYZWTRL-UHFFFAOYSA-N 377.504 5.167 30 20 GKED Fc1c(Cl)cccc1NN=Cc1cn(-c2ccccc2)nc1-c1ccncc1 921137993 YHJSQJZEGHLFOG-UHFFFAOYSA-N 391.837 5.173 30 20 GKED Cc1cc(Oc2cc(Cl)ccc2C=NNc2ccccc2C(=O)O)ccc1F 1776030938 DYBWHURUSLVOBL-UHFFFAOYSA-N 398.821 5.724 30 20 GKED O=C(O)c1cc(NN=C(CCc2ccccc2)c2ccccc2)ccc1Cl 1776033546 XWPMZBJEDWQTNI-UHFFFAOYSA-N 378.859 5.487 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3cc(F)ccc3F)cc2)c1 1776113515 MJUSKXGDFPQXMM-WDZFZDKYSA-N 378.374 5.155 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)o2)cc1 1776125260 BMZMGYPRPWXBJC-GZKZCVOOSA-N 384.472 5.778 30 20 GKED COc1ccc(C(=O)O)cc1/C=C/C(=O)c1sc2c(C)cc(C)cc2c1C 1777354854 YIXFUHMNLJCWTB-FNORWQNLSA-N 380.465 5.429 30 20 GKED Cc1cc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)ccc1C(F)(F)F 1777420925 PDLFRIQIQZPPPB-YVMONPNESA-N 392.373 5.395 30 20 GKED CCn1c(S[C@H](C)C#N)nnc1-c1cc(-c2ccccc2)nc2ccccc12 9840756 RZPADKUUQHYWSK-OAHLLOKOSA-N 385.496 5.184 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)Sc2ccc3ccccc3n2)c1 22451222 JCVITAIWZSPXTH-GOSISDBHSA-N 389.524 5.279 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)cc2)cc1 62411954 IMFLLNUJTBIWKL-FUUYNRHESA-N 387.483 5.393 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 66856336 PABNBOSUOXTDQN-MRXNPFEDSA-N 392.524 5.171 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc2[nH]c(C(F)F)nc2c1 68317610 MPQBNVOYNQNEIZ-UHFFFAOYSA-N 381.835 5.044 30 20 GKED C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)c1ccc(C#N)cc1 118170675 ZDVIRVDGLHMIOP-NSHDSACASA-N 386.274 5.224 30 20 GKED Cc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1NC(=O)C(C)(C)C 120857250 KEOMOSUBJIPXBZ-IBGZPJMESA-N 392.503 5.146 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1C1CC1 160249518 QKMNDVXQEHVGHN-UHFFFAOYSA-N 382.533 5.186 30 20 GKED CC(C)Oc1cncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 179983168 LCFWSWANSKQAAH-KRWDZBQOSA-N 397.887 5.136 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 185482406 LTEZTIGEQHESBA-SJKOYZFVSA-N 379.476 5.058 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C(=O)NCCCCC)CC1 191455603 WYCBJTOZMKDDBZ-UHFFFAOYSA-N 399.579 5.089 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)c(F)c2)ccc1OCc1ccccc1 192151107 FVNHLHGTPNHPKI-KRWDZBQOSA-N 390.458 5.136 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1csc2ccccc12 193466007 SJACISUGCKCFAC-GFCCVEGCSA-N 389.263 5.169 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1 195721710 KGGSAUHWNWJFFA-UHFFFAOYSA-N 394.858 5.131 30 20 GKED Cc1ccc(Cn2nccc2NC(=O)c2ccccc2-c2ccccc2C#N)cc1 216139219 IJRMVFOFDYLPRA-UHFFFAOYSA-N 392.462 5.031 30 20 GKED C=CCCSc1nnc(-c2cccnc2)n1-c1ccc(Cl)c(Cl)c1 303807653 MVCRFNNBMKEULE-UHFFFAOYSA-N 377.300 5.304 30 20 GKED Cc1cc(N2CCCCCC2)ccc1N/C(O)=N/[C@@H]1CCO[C@@H](C(C)(C)C)C1 329253892 WNIYUWKDDBTXPU-WIYYLYMNSA-N 387.568 5.295 30 20 GKED C[C@@H](N[C@@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1ccccc1Cl 329776499 JZALTMAHZRUFLD-FOIQADDNSA-N 384.907 5.000 30 20 GKED OC(=Nc1ccccc1O)C1CCN(/C(O)=N/[C@@H]2CCCCC23CCCC3)CC1 329797387 HGMCGKVNDCKFHJ-HXUWFJFHSA-N 399.535 5.109 30 20 GKED C[C@H](CC(=O)N1CCCC[C@@H]1c1nc2ccccc2o1)/N=C(/O)C1CCCCC1 330022887 HTYSRNLXJDENPK-VQIMIIECSA-N 397.519 5.197 30 20 GKED CC(C)c1nc([C@@H]2CCCN2/C(O)=N/[C@H]2CCCc3sc(Cl)cc32)no1 330253998 JEIAJAFRVMZLAD-STQMWFEESA-N 394.928 5.036 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C(F)(F)F)c(C#N)s1 410622195 VQOCKVCPGOVFFJ-UHFFFAOYSA-N 397.378 5.097 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)Cc3csc(-c4ccoc4)n3)c2C#N)[C@@H](C)C1 410983314 PQEMCYONEICRGB-RYUDHWBXSA-N 397.525 5.203 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc2nc(C3CC3)sc2c1 425640766 QUIBGETYSDMSTF-ZDUSSCGKSA-N 376.485 5.270 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 429643220 DATWRHKTMCEOIG-CYBMUJFWSA-N 377.366 5.264 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1cccc(SCC#N)c1 430598310 CITAGTFALCJWLI-UHFFFAOYSA-N 387.508 5.027 30 20 GKED Cc1noc(C)c1C(C)(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 430675177 LZCGGWLCYRFIKB-UHFFFAOYSA-N 393.418 5.011 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 432000321 GRDGEIZMZQFGHI-UHFFFAOYSA-N 391.496 5.237 30 20 GKED COc1c(Cl)cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1Cl 432857316 DLNBNUFOOPFINS-QGZVFWFLSA-N 392.286 5.559 30 20 GKED FC(F)n1ccnc1CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 436412175 OQLYBQAXJHEVQQ-LLVKDONJSA-N 387.274 5.080 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2ccc(C#N)cc2C)cc1 438829111 JGRWIMYFZWDVSW-GOSISDBHSA-N 384.479 5.376 30 20 GKED C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1ccccc1Oc1ccccc1C#N 456116598 JBDFUJYQZFZLNT-GOEBONIOSA-N 388.389 5.154 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@](F)(c2cccc(Cl)c2)C1)c1ccccc1 458826625 CVLBITZFUATJKV-IFMALSPDSA-N 399.897 5.355 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1cc(C(F)(F)F)ccn1 464400709 ABZUMEKRCHITIO-JTQLQIEISA-N 392.686 5.263 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)oc2c1ccc1ccccc12 464429991 XISZWIMJJMKNIP-QGZVFWFLSA-N 394.352 5.798 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 464949994 FZVUXWWGNNVRFV-BQJUDKOJSA-N 398.428 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccc(F)cc1Cl 476121495 NTMZKIBKOXVJMW-AWEZNQCLSA-N 375.871 5.737 30 20 GKED Cc1cc(Cl)ccc1C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 480509703 NIHBGPRKUGRDCO-UHFFFAOYSA-N 389.842 5.025 30 20 GKED CCSc1ccc([C@@H](C)NCc2ccc(C#N)cc2Br)cc1 481272449 WEEAGXUUNBHEEY-CYBMUJFWSA-N 375.335 5.284 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C 484605970 NAIIKEAPISBWPN-BXUZGUMPSA-N 395.343 5.073 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccccc1 488655570 ZWDICDNPWZMYPX-SFHVURJKSA-N 395.396 5.402 30 20 GKED CC[C@@H](c1ccc(F)cc1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 494721132 RQOJTHWBCBIAIF-QHCPKHFHSA-N 393.483 5.430 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1 505324757 JOYLZQBCERVQGX-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CN(Cc1cn(CCC#N)nc1-c1ccccc1)Cc1cccc2ccccc12 506449762 APQAFVVXVYOVIM-UHFFFAOYSA-N 380.495 5.249 30 20 GKED Cn1c(-c2cccc(NC(=O)c3cc(C#N)ccc3Cl)c2)nc2ccccc21 506768173 SDNXUCBNLMLVOZ-UHFFFAOYSA-N 386.842 5.018 30 20 GKED Cc1ccc(NC(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)c(Cl)c1 509530618 SSCAELLPOLRCNR-UHFFFAOYSA-N 392.890 5.295 30 20 GKED C[C@H]1C[C@@H](C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 510023639 NXWWKCBTQULAQZ-GQIGUUNPSA-N 381.907 5.505 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2Cc2ccccc2)cc1 510679075 GQPLYAZRVFHOEB-JOCHJYFZSA-N 397.478 5.590 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)c1ncc(-c2ccc(Cl)cc2Cl)o1 512746186 CWRXOMHLQRDFSU-JTQLQIEISA-N 376.268 5.768 30 20 GKED COc1cccc(C2CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)c1 513393468 GIASDFVQMBPQNU-UHFFFAOYSA-N 396.490 5.254 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 518168812 LHCRXPUAISKYHL-HZPDHXFCSA-N 393.512 5.909 30 20 GKED Cc1ccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 518681651 DILWQFVRKHJYTR-KRWDZBQOSA-N 381.545 5.346 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519996652 UZLAZXHPTAXHSN-LJQANCHMSA-N 399.494 5.118 30 20 GKED CCc1cc(C#N)c(NC(=O)CCCOc2cccc(Cl)c2Cl)s1 520653749 XELFJLIXZROTSK-UHFFFAOYSA-N 383.300 5.287 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 521260019 TWUORLHGFNKVCI-HKUYNNGSSA-N 381.545 5.500 30 20 GKED N#Cc1ccc(C2(NCc3cc(C(F)(F)F)ccc3Cl)CCOCC2)cc1 527813801 XMHZRKPCKNTINF-UHFFFAOYSA-N 394.824 5.026 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CC1CCSCC1 532393057 HOVWKTAAQSMKRU-UHFFFAOYSA-N 382.504 5.072 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3scnc3C3CC3)cc2)cc1 536490607 JHWNRHBBHHBWTA-UHFFFAOYSA-N 375.453 5.131 30 20 GKED CC(C)C[C@@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 537041317 BTGBBVOZGGFSAC-WIYYLYMNSA-N 395.572 5.254 30 20 GKED Cc1sc(NC(=O)CN[C@@H](C)c2ccc(SC(C)C)cc2)c(C#N)c1C 537100122 FCQZYUCGQZWKRF-AWEZNQCLSA-N 387.574 5.026 30 20 GKED C=CCCOCCCCC(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21 537194189 ZBRIKZSOVXEVST-QFIPXVFZSA-N 379.500 5.056 30 20 GKED COc1ccc([C@H](NCCC(C)(C)C#N)c2ccc(C(F)(F)F)cc2)cc1 540915729 IJSIXXLNINXWHC-LJQANCHMSA-N 376.422 5.333 30 20 GKED Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(Cl)c(C#N)c1 541612073 WGJRXIOSIVUKHC-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#Cc1cc(C(=O)Nc2cccc(Cl)c2Oc2cccnc2)ccc1Cl 543467965 HVUMJYSDWNAEGS-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COCC[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Cl)c(Cl)c1 556516048 YLHIADYGVVVKOB-HXUWFJFHSA-N 391.342 5.662 30 20 GKED N#CCC[C@@H](C#N)CNc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 566579345 DUAHVCHKMMNJES-ZDUSSCGKSA-N 377.341 5.492 30 20 GKED CC[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C#N)cc1 570514382 FQBZKIYNTOLRFV-UZUQRXQVSA-N 384.483 5.007 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCC(=O)[C@H](C)C1(C)C 573686980 ZWGCTVSBCFNEEG-OXJNMPFZSA-N 390.483 5.239 30 20 GKED N#Cc1ccc(CSc2ncnc3cc(-c4ccc(F)cc4)sc23)nc1 577014146 QEAAGXZVJNWYMO-UHFFFAOYSA-N 378.457 5.056 30 20 GKED Cc1ccc(-c2c(C)sc3nc(CSCCC(C)(C)C#N)nc(O)c23)cc1 582808402 MHCQPAULUITVQQ-UHFFFAOYSA-N 397.569 5.854 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 588819703 SZGNDOILBGZEQO-LBPRGKRZSA-N 382.938 5.176 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H](c4ccccc4)C3)cn2)c1 590106673 IWFYPUHIONXCMQ-FQEVSTJZSA-N 398.466 5.157 30 20 GKED C[C@@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ncccc1F 590539272 ZYSXMNHNCACNNO-CYBMUJFWSA-N 395.821 5.029 30 20 GKED CC(C)(C)C(=O)N1CCC(CSCc2ccc(C#N)cc2C(F)(F)F)CC1 596365588 UDYCMDDCUDYDAG-UHFFFAOYSA-N 398.494 5.095 30 20 GKED Cc1cc(NC(CCC(F)(F)F)CCC(F)(F)F)cc(C#N)c1[N+](=O)[O-] 596496023 LZKGOEVQWLQXDI-UHFFFAOYSA-N 383.292 5.240 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 608851523 XZSBKBUGAMTWJZ-HXUWFJFHSA-N 386.417 5.263 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCCc3sccc3C2)cc1 609332440 REDUWFVINLQYOU-UHFFFAOYSA-N 392.455 5.140 30 20 GKED Cc1ccc(-c2nc(C(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)cs2)o1 609463682 PUGAUHGMYHIDIY-CYBMUJFWSA-N 392.267 5.013 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ccc(C(F)F)nc1 653736543 OVQYCQAHOQEORO-LBPRGKRZSA-N 398.253 5.071 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)C1CCCCC1 726320325 WUVBZFFTTPRSMV-CXAGYDPISA-N 394.487 5.255 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726489386 NMOHWFQSJZSDBO-UHFFFAOYSA-N 389.977 6.220 30 20 GKED C=CCOc1ccccc1/C=C1\SC(=S)N([C@H](C)c2cccs2)C1=O 726630832 XSWHIUDZEKYHMR-KAECEXQPSA-N 387.551 5.275 30 20 GKED N#C[C@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1ccc2ccccc2n1 727952058 ACSSZSDVNNQRJT-QFIPXVFZSA-N 384.479 5.365 30 20 GKED Cc1cccc(COc2ccc(N[C@H](C)C(=O)Nc3ccccc3C#N)c(C)c2)c1 729855745 TXSASLACBGQWQY-LJQANCHMSA-N 399.494 5.193 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@@H](C)c1ccccc1 733808055 YMZZACIJEDTQLN-UGKGYDQZSA-N 393.531 5.440 30 20 GKED CCN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccc(C)cc1C 734317755 SVYXSTMMEYAWMG-UHFFFAOYSA-N 384.479 5.421 30 20 GKED CSCC[C@@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 736963022 RHZRHXFBWKOVPR-CYBMUJFWSA-N 389.908 5.267 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)Oc2cc(Cl)cc(Cl)c21 742437676 VUNIFBAOSNDZOX-VGOFMYFVSA-N 375.236 5.128 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)c2cccc(Cl)c2)cc1 744034010 XYBNNOFRNJYQQT-MDOVXXIYSA-N 382.891 5.305 30 20 GKED COc1cc(C(C)=NNc2cc([N+](=O)[O-])ccc2C)ccc1SC(F)F 747060272 NTHVPTBLWGTUCR-UHFFFAOYSA-N 381.404 5.063 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(c3cccc4ccccc34)C2=O)s1 749017465 UKIMOPWPGBGKIT-LICLKQGHSA-N 378.503 5.179 30 20 GKED C=C(C)[C@H](CC(=O)O[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)OCC 756468578 BUVCMXCTQBDCBM-ABAIWWIYSA-N 399.274 5.019 30 20 GKED O=C1/C(=C/c2coc(-c3ccccc3)n2)Cc2c(F)ccc(Br)c21 759092000 RXILCIHMDUNYGW-XYOKQWHBSA-N 384.204 5.066 30 20 GKED COc1cccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1F 771524319 QUJQKFXLPBZZSL-UHFFFAOYSA-N 392.455 5.251 30 20 GKED C#CC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccccc1 773113276 CVKNTAKEGPARTP-NHCUHLMSSA-N 388.536 5.550 30 20 GKED C=CCn1c(SCc2ccc3c(c2)COC3)nnc1-c1ccc(Cl)cc1 777902208 PBJOMGRPKWFAQV-UHFFFAOYSA-N 383.904 5.107 30 20 GKED CC(C)c1ccc(-c2nc(CNc3ccccc3O[C@H](C)C#N)cs2)cc1 779740413 HINDQDRTQMFKIW-MRXNPFEDSA-N 377.513 5.836 30 20 GKED CC(C)n1ccc(C[C@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)n1 783586442 BPJSPAMQRZQZQV-KRWDZBQOSA-N 392.478 5.097 30 20 GKED C=CCn1c(SCc2oc(C)nc2C)nnc1-c1ccc(C(C)(C)C)cc1 788100620 VJYLBMJCVMRFLJ-UHFFFAOYSA-N 382.533 5.326 30 20 GKED FC(F)(F)c1cccc(-c2ccc(NN=C3CCCNc4ccccc43)nn2)c1 794981835 RVWOAIQGCRHFPM-UHFFFAOYSA-N 397.404 5.184 30 20 GKED C=CCOc1ccc(CN[C@@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)cc1 797008951 ZQERAYJJNNPPOJ-JOCHJYFZSA-N 394.515 5.376 30 20 GKED CC(C)(CC(=O)c1ccccc1)CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 799629699 CTLJEPOASWAVAC-MRXNPFEDSA-N 382.529 5.306 30 20 GKED COc1cc(/C=C\C(=O)c2c(F)cccc2Cl)ccc1OCC(F)(F)F 809159783 WSIBVBBTDBEVNB-ALCCZGGFSA-N 388.744 5.325 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)OCC(C)(C)CCC#N)cs1 810825752 QKWFBPOHIPYTRA-UHFFFAOYSA-N 388.508 5.408 30 20 GKED C[C@@]1(C(F)(F)F)CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 878217588 AWGXXWQMWFULNJ-AZUAARDMSA-N 387.405 5.148 30 20 GKED N#Cc1c[nH]c2cc(-c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)ccc12 904506828 ORMACFRSBVGUQK-UHFFFAOYSA-N 397.369 5.083 30 20 GKED Cc1nc(C)c2c(C)c(C=NNCc3ccc(Cl)cc3Cl)sc2n1 914696254 ABDUYTAJYHQNBK-UHFFFAOYSA-N 379.316 5.047 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915350432 VMLIXUOOWPRHNS-XMMPIXPASA-N 381.479 5.562 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915352885 KJEBEFAKUWPWGU-KOSHJBKYSA-N 399.494 5.623 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2)CCCC1)c1nc2cc(Cl)ccc2s1 917047245 UTEFOXGMVMLDTE-MRXNPFEDSA-N 380.900 5.638 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1cc(C(=O)O)ccc1OC(C)C 1776022497 RJWHODSXLCMASS-UHFFFAOYSA-N 395.484 5.132 30 20 GKED Cc1ccc(-c2cccc(/C=C(/C(=O)C(=O)O)c3ccc4ccccc4n3)c2)cc1 1776116154 LBPWYEUBGPVHSB-CJLVFECKSA-N 393.442 5.405 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c1)C(=O)O 1776126349 JRYZVMWHRWQTJY-IUYQLWOBSA-N 388.419 5.227 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cnc(-c2cccs2)s1 1776354931 LOESVWCSXKAGLY-VOTSOKGWSA-N 399.493 5.253 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCCc4ccc(Cl)cc4C3=O)o2)cc1 1777671054 XJNLMUNWMKVYJE-ATVHPVEESA-N 392.838 5.901 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc3ccccc3c2)c(-c2ccccc2)n1 7740920 GUHBFQCSGSITMU-BUHFOSPRSA-N 377.447 5.513 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)OCc3cccc(C#N)c3)cs2)cc1 24156802 OZWIEHYDUNOFGX-UHFFFAOYSA-N 376.481 5.091 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(Cl)c2)cc1)C(=O)Nc1ccccc1C#N 60926337 QBVNYKRDCQYXCP-OAHLLOKOSA-N 391.858 5.443 30 20 GKED COc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 103330740 NSFUMFZQSFEPKJ-IUODEOHRSA-N 384.888 5.328 30 20 GKED C=CCN(C(=O)c1cc(C)no1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 104955431 UHNRMSBAMUFMBC-UHFFFAOYSA-N 394.283 5.246 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1cc(Cl)ccc1F 108408086 LPEROWJNIRBREZ-QWHCGFSZSA-N 391.899 5.170 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(-c2cccs2)no1 109226597 RZGWXTLMQDSGSA-CQSZACIVSA-N 388.452 5.635 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(CC#N)cc1 110994529 QUCLELQTZNAJEJ-UHFFFAOYSA-N 376.287 5.502 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1nc2cc(Cl)ccc2s1 116593403 VGYAUVNNHQCQSC-IJLUTSLNSA-N 388.826 5.208 30 20 GKED Cc1cccc(CN(Cc2ccccn2)C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 125713190 MTNYKDZYMXZUOG-UHFFFAOYSA-N 398.510 5.426 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC/C=C/c1ccccc1 151978019 VGCXZYTVHJQBOI-BJMVGYQFSA-N 383.451 5.486 30 20 GKED C#CCCOc1ccc(CNc2cccc(NC(=O)c3cccs3)c2)cc1 155905526 WAAUVDKCCZSVAX-UHFFFAOYSA-N 376.481 5.015 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(CCC(F)(F)F)cc1 159194772 RKUUFWKGIIGXTI-VQTJNVASSA-N 386.417 5.093 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCC(F)(F)F)cc2Cl)c1 173040207 CTIQPVONHVCJNK-UHFFFAOYSA-N 382.769 5.072 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc2ccccc2c1 175956501 ZYBWTYOFQUYXDG-QRWLVFNGSA-N 383.476 5.338 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1ccccc1 188036679 ZFASPPVVGBEEFP-NEKDWFFYSA-N 389.520 5.293 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)c1ccncc1 191486065 WTPPMAVCAMIMCF-QHCPKHFHSA-N 385.511 5.845 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1csc(-c2ccccn2)n1 194635306 MIXDZCAYUAWBTJ-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl 195618259 HWMQCSWCMGYVGT-NSHDSACASA-N 387.307 5.653 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)s1 255569139 DGLLNTQISQHBIG-NTMALXAHSA-N 392.867 5.422 30 20 GKED O=C(Nc1ccc(F)c(N=C(O)C2CCCCC2)c1)c1noc2c1CCCC2 328940298 SKQOPMBDLGPGKQ-UHFFFAOYSA-N 385.439 5.113 30 20 GKED CC1(C)CCc2ccccc2[C@H](/N=C(/O)c2ccc3c(c2)N=C(O)CN=C3O)C1 329172828 LCZJPJYUANRILO-LJQANCHMSA-N 391.471 5.001 30 20 GKED CC(C)c1csc(C/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)n1 329255712 ARBQHSFBPANWQD-INIZCTEOSA-N 386.565 5.230 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329481005 DFQDCEWLSQMLFU-FQEVSTJZSA-N 392.503 5.061 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc(F)c2)cc1Cl 410168672 MDYLRCUDBTYRKC-HXUWFJFHSA-N 393.849 5.456 30 20 GKED C=CCCCCCN(C)C(=O)c1c[nH]c2ccc(Oc3ccccc3)cc2c1=O 430663046 JGDNORDHHIYZEE-UHFFFAOYSA-N 390.483 5.139 30 20 GKED CCSc1ccc([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431931218 NTAYORIVYPTHAT-LAUBAEHRSA-N 381.545 5.594 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 437914407 YRMLPMJHKFKYAQ-FCHUYYIVSA-N 375.516 5.596 30 20 GKED C[C@H](Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1ccc(C#N)cc1 439561681 OYRFVJOFRRZNKA-ZDUSSCGKSA-N 384.266 6.225 30 20 GKED COc1cc(OC)c(NC(=O)Nc2ccccc2SCCC#N)cc1Cl 440577843 CMVBCQDCVQQXON-UHFFFAOYSA-N 391.880 5.007 30 20 GKED Cc1csc(N(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C2CC2)n1 460367862 CKOSVPVBMIHEGX-UHFFFAOYSA-N 389.480 5.119 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2cccc(F)c2C#N)nc1-c1ccccc1 462112949 QDKFKPGGVDWBLF-HXUWFJFHSA-N 375.447 5.817 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCS2)cc1Cl 465156751 PXARVABDNXHDCC-FUHWJXTLSA-N 385.920 5.013 30 20 GKED N#CCCn1cc(CN[C@H]2CC[C@H](c3ccc(F)cc3)C2)c(-c2ccccc2)n1 475346138 MRAASTARRCKUBK-REWPJTCUSA-N 388.490 5.029 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)C[C@@H](CC#N)c1ccccc1 475366051 GFFMWWKZSYRXKW-SIKLNZKXSA-N 388.536 5.925 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCCCc1nc(-c2ccncc2)cs1 481658303 NXHZFQMIKGELGI-NRFANRHFSA-N 388.540 5.067 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1nccc2ccccc12 483188940 BUGNDOXXRDEAIZ-FQEVSTJZSA-N 389.414 5.533 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)ccc1NC(=O)CC(C)C 483192860 HPTHQYYFENJXIX-HXUWFJFHSA-N 385.467 5.018 30 20 GKED Cc1ccc([C@@H](NC(=O)N2C[C@@H](C#N)[C@H](c3ccccc3)C2)c2ccccc2)cc1 487523917 WTNVUFJPRZCSRM-DSITVLBTSA-N 395.506 5.033 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc(C)c1F 490717602 GZISSMUYNACKND-CYBMUJFWSA-N 386.398 5.334 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2cc(C#N)ccn2)C(C)C)s1 493275731 BKLKNGIJWOJZQW-UHFFFAOYSA-N 375.497 5.041 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccccc1C)C(C)C 496248374 VVINFLXCXSIZEU-JOCHJYFZSA-N 382.552 5.257 30 20 GKED CCCc1c(NC(=O)c2ccc(C(C)(F)F)cc2)cnn1-c1cccc(C#N)c1 504812644 GSSBSGWGIBJAQF-UHFFFAOYSA-N 394.425 5.060 30 20 GKED CN(Cc1cc(C#N)ccc1F)[C@@H]1CCSc2ccc(Br)cc21 518251965 IQDKUBFXECRJBL-QGZVFWFLSA-N 391.309 5.129 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3Cc3ccccc3)cc2)cc1 520596514 NVXOEIXBJSBGGT-JOCHJYFZSA-N 397.478 5.590 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](Sc2ccc(C#N)cc2F)c2ccccc2)c1 524986738 HCRWYYIRJAXORP-QFIPXVFZSA-N 390.483 5.786 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(Br)cc2Cl)c(C#N)s1 539173240 OHVCZQMPEIMBGD-UHFFFAOYSA-N 397.725 5.585 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(Cl)c(F)cc1Cl 556432979 DVSCBTZDIJJUAP-KDOFPFPSSA-N 377.246 5.044 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1nc2ccccc2o1 556886539 LTUUWVGBPTXBSX-HXUWFJFHSA-N 389.414 5.533 30 20 GKED CN(C(=O)Nc1ccc(F)c(C(F)(F)F)c1)[C@H]1CC[C@@H](C(F)(F)F)CC1 569617360 CFXRHYMYRDWSDD-JGZJWPJOSA-N 386.311 5.429 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CSc2ccccc21 573062502 XWHDHPPBIDQAAE-HUUCEWRRSA-N 383.542 5.092 30 20 GKED CC1(C)CC(=O)c2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2O1 574506680 SJCISXVALLCMFS-UHFFFAOYSA-N 396.446 5.221 30 20 GKED N#CCCCCCc1nc(-c2cc(Br)cc(C(F)(F)F)c2)no1 589138308 RQZGXHHXIBHGBQ-UHFFFAOYSA-N 388.187 5.144 30 20 GKED C=CCOCC(=O)Nc1cc(C(F)(F)F)ccc1Oc1ccc(OCC)cc1 591666521 CNQROPJIEJSFBU-UHFFFAOYSA-N 395.377 5.038 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NCC2(C#N)CCCC2)cc1 593428024 WPAHUSCAXRENJW-SFHVURJKSA-N 391.515 5.149 30 20 GKED CCN(CCCC1(C#N)CCOCC1)[C@H](C)Cc1ccc(C(F)(F)F)cc1 595866933 NCQQHBSXVZMCMG-QGZVFWFLSA-N 382.470 5.059 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@H]1CCCCC1(F)F 596396726 TZUBAIUFWDGCJM-LSDHHAIUSA-N 398.544 5.578 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cc(F)ccc2Cl)cc1 609065762 SVBFPHLWURPUHR-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1ccc(C)c(N(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)C(C)C)c1 609100724 WOOUOZGRWXLGMX-UHFFFAOYSA-N 388.467 5.402 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl 610106903 KUEJXBVXOGQVTI-IRXDYDNUSA-N 394.833 5.281 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1cccc(C#N)c1 610361085 PMKGBFAFBDPUEA-CYBMUJFWSA-N 389.505 5.387 30 20 GKED C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1cccc(C#N)c1 610361086 PMKGBFAFBDPUEA-ZDUSSCGKSA-N 389.505 5.387 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(C3CC3)cc2)cc1C 611307303 GRRQYEPTUYZOMN-UHFFFAOYSA-N 384.483 5.210 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 612235775 HBPFTHKXJXAGFS-OAQYLSRUSA-N 396.537 5.552 30 20 GKED N#C[C@H](C(=O)c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 613346479 KOVKISKZKWUJJI-CQSZACIVSA-N 391.254 5.746 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1C[C@@H]2CCC[C@H]2C1 646439052 QNHSFJFIWWGSRN-QWRGUYRKSA-N 398.322 5.240 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(O[C@@H](C)C#N)cc3)cc2)cs1 728713175 RMOQGILEMXEUMV-JKSUJKDBSA-N 377.513 5.260 30 20 GKED C[C@H](CC#N)OC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 733709126 BKXPSBQTAMGREC-MRXNPFEDSA-N 380.875 5.121 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)cc1 735787991 AZDOYIKFRJRTBV-LJQANCHMSA-N 387.483 5.053 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C[C@H](C)c1ccccc1C(F)(F)F 741520490 JVBMSVDROSWHJI-ZDUSSCGKSA-N 377.362 5.075 30 20 GKED FC(F)(F)COc1ccc(CON=Cc2ccccc2C(F)(F)F)cc1 742351836 FSPRRMBSXYZSQG-UHFFFAOYSA-N 377.284 5.197 30 20 GKED N#CCOc1ccc(COC(=O)C[C@H](Cc2ccccc2)c2ccccc2)cc1 745352005 LWTYRYKKQFZRDR-QHCPKHFHSA-N 385.463 5.049 30 20 GKED CC(C)(C)O[C@@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1 754535519 ZXGVEYLTBFTVKW-DNVCBOLYSA-N 382.460 5.168 30 20 GKED CC(C)Oc1cc(O)ccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 762698032 RSLSHPFJGSMQJC-UHFFFAOYSA-N 387.439 5.047 30 20 GKED Cc1oc2ccccc2c1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 767956381 ODUUVCLJRLEPOM-HNNXBMFYSA-N 380.856 5.423 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3cccnc3)CC2)cc1 768867843 JRGSBHCQSLLSES-DEOSSOPVSA-N 396.494 5.149 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(N3CCCCCC3)cc2)c1 772984854 RIWALHICIHWCDZ-GBXCKJPGSA-N 391.559 5.599 30 20 GKED CC(C)c1nccnc1NN=C1CCCc2nc(-c3ccc(F)cc3)sc21 773087216 ZMGPRNLVFGYRTG-UHFFFAOYSA-N 381.480 5.015 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C[C@H]2CCOC2)c2ccccc2)cc1 773100955 HHXMGMMHFQQZMS-YCRNBWNJSA-N 385.935 5.636 30 20 GKED CC(C)Oc1ccc(-c2nc(C(=O)OCc3ccc(CC#N)cc3)cs2)cc1 776114414 WFNHULOKPAPNGF-UHFFFAOYSA-N 392.480 5.020 30 20 GKED CC(C)(C#N)CCOC(=O)c1cc(SCCC(C)(C)C#N)ccc1Cl 776390975 BADYDZSZRRQALK-UHFFFAOYSA-N 378.925 5.469 30 20 GKED CC(C)(C)C[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccccc1 777114854 MUMWPMBXBJNQEJ-QFIPXVFZSA-N 377.532 5.109 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc([N+](=O)[O-])cc1Cl 782190252 HPJLALKWNQWOGE-DAFODLJHSA-N 376.846 5.329 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792093537 XPBVBELNFQPGFR-FFWXCITRSA-N 380.369 5.533 30 20 GKED N#C[C@H](C(=O)CCSCc1ccccc1)c1nc2cc(Cl)ccc2s1 796653022 XBJOVOWAZXBLOX-OAHLLOKOSA-N 386.929 5.449 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 802708920 XUHVTBKSCQBQBY-WAFIBAPDSA-N 395.505 5.188 30 20 GKED C[C@H]1C[C@@H](C=NOc2ccccc2C(F)(F)F)CCN1C(=O)OC(C)(C)C 807981285 GKTMKGOUDMPWDK-KBPBESRZSA-N 386.414 5.106 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)(F)F 815911458 BYVNVDRDVNDYAX-KWQFWETISA-N 389.254 5.584 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(COC3CCCC3)cc2)c1 864013581 XGAFYRCFDWQODD-UHFFFAOYSA-N 385.305 5.392 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)[C@H](O)c1ccccc1 878676272 PBRRPIQPINMNOT-LZJOCLMNSA-N 397.544 5.057 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc1 904454794 RXPIQTUTHXUPGI-UHFFFAOYSA-N 382.423 5.392 30 20 GKED CCOc1cc(/C=C/C(=O)c2cc3cccc(OC)c3o2)ccc1OC(F)F 916130219 LCUUXODOPUQGQO-VQHVLOKHSA-N 388.366 5.338 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)COc2ccccc2C(C)C)cc1 916948461 VSWWJAUSVXONGH-LAUBAEHRSA-N 392.499 5.050 30 20 GKED CCCCS[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 918488971 IMKAJFKWAXVLAJ-DOMZBBRYSA-N 378.950 5.562 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2csc(C(=O)O)c2)cc1 1776125736 RLSMTQWYJDJSKJ-NYUWMOHMSA-N 386.513 5.938 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)cc1)C(=O)O 1776469892 ZGRFIXBIDQFGPE-VHEJECIDSA-N 378.468 5.482 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC(F)F)c(Cl)c1 1776783928 LYHMVNPGOHKWLV-AWEZNQCLSA-N 377.859 5.235 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c(C)c1 1777353312 XUNAMNHWKXGYFD-FLIBITNWSA-N 378.449 5.326 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3cccs3)CCC2)cc1 1789453040 GZGKLBZUUGUZOC-IBGZPJMESA-N 394.540 5.264 30 20 GKED COc1ccc(/C=C2\C[C@@H](C)Cc3c2nc2ccccc2c3C(=O)OCC#N)cc1 4550206 WTLGAGKHMBBTKC-YWJBVVMDSA-N 398.462 5.047 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cc(C)cc(C)c2)cc1 10172510 ZBFVBQBTAGFEEM-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1 48096872 JOCRYZWVAVBGSG-UHFFFAOYSA-N 399.494 5.183 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCCC(=O)c1c(C)cc(C)cc1C 63251233 GIGPFWRUWCRCFF-UHFFFAOYSA-N 388.511 5.051 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108324456 SOUHRIHHPCOHQX-MRXNPFEDSA-N 380.513 5.157 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1ccccc1-c1ccccc1 108352140 BXZDWKQCGVHJHP-UHFFFAOYSA-N 387.508 5.410 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C34CC5CC(CC(C5)C3)C4)n2)cc1 108977983 XFXZQUILZCAOGT-VYBOSXCSSA-N 392.524 5.211 30 20 GKED CCCCCCCCC(=O)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 110349987 XHMROPCUXHGPIG-GOSISDBHSA-N 387.499 5.332 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 117461334 VVVJEJCOKMYJOT-UHFFFAOYSA-N 385.467 5.110 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 120116771 ZBAIKJLDMYINQK-OCCSQVGLSA-N 395.311 5.252 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122020869 SGWNBOVYHLRILS-UZLBHIALSA-N 389.524 5.699 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccc(O[C@@H](C)C#N)cc1 124716319 VAEJCJJMERCFBG-AVRDEDQJSA-N 376.525 5.421 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)F)cc1)c1nc(-c2ccncc2)cs1 128824354 MYUBSSMIBLZTDD-CQSZACIVSA-N 387.436 5.010 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](Nc2ccccc2)C1 151043612 RLDZYAYKYJCELG-MJGOQNOKSA-N 394.544 5.047 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1c(F)cc(C#N)cc1F)c1ccccc1 151802565 WGLDMPUODXOUCB-CQSZACIVSA-N 378.378 5.229 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3cccc4ccccc34)n2)cc1 155642304 PDHSPWWTAKEMIW-IBGZPJMESA-N 399.475 5.218 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCSc2ccccc21 171839133 PUNLHNDQGBDOSU-GDBMZVCRSA-N 383.542 5.439 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1[N+](=O)[O-] 176992891 IMRBJBMXXQKFAK-LSDHHAIUSA-N 398.488 5.180 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)c2)cc1 180399501 LUNHXSWULQIZQS-UHFFFAOYSA-N 379.419 5.158 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nnc(-c2ccc(OC(F)F)cc2)o1 186413426 AOZUUZSVIKKTIA-UHFFFAOYSA-N 393.802 5.155 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(/C=C/C)cc1OC 189867771 JHZKLRSHJCAZRF-RMKNXTFCSA-N 379.500 5.598 30 20 GKED Cc1csc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1Br 191463710 IPIFGIMJBLVWFA-UHFFFAOYSA-N 383.336 5.302 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NCc1cccc(C#N)c1 216759567 GAWQMQPBXQHVSJ-GOSISDBHSA-N 385.467 5.328 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CN2CCCC[C@H]2C)C1 249058997 JDWOAFFBXQDJQK-NHCUHLMSSA-N 397.607 5.657 30 20 GKED O=[S@](Cc1cccc(N=Cc2cc3ccccc3nc2O)c1)C1CCCCC1 255718866 OHWVRKVWXZWCLS-MUUNZHRXSA-N 392.524 5.272 30 20 GKED O/C(=N/[C@@H]1CCCC12CCOCC2)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1 328689989 BMYQLYKMGFYQEG-QZTJIDSGSA-N 396.453 5.009 30 20 GKED O/C(CC1CCCC1)=N/C1CCC(/C(O)=N\[C@@H]2CCOC3(CCC3)C2)CC1 330202726 ZRAROGJARJNRNF-CTWPCTMYSA-N 376.541 5.140 30 20 GKED Cc1ccc(C2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)CC2)cn1 378640347 VMVYHLAZUSJMAA-KRWDZBQOSA-N 394.544 5.196 30 20 GKED N#Cc1nc(N[C@H](c2cccc(Cl)c2)c2ccccn2)ccc1C(F)(F)F 409715190 ZVWHDGUDAMOMQG-GOSISDBHSA-N 388.780 5.222 30 20 GKED Cc1oc(-c2cccs2)nc1CC(=O)Nc1scc(C(C)(C)C)c1C#N 410932267 XOYXHEFUILIORO-UHFFFAOYSA-N 385.514 5.123 30 20 GKED C=CCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 424594539 QORGKNVBIRBFJT-HXUWFJFHSA-N 394.902 5.307 30 20 GKED N#CCCCOc1cccc(N[C@@H](Cc2cccnc2)c2cccc(Cl)c2)c1 426065528 ZQSWAFWQBJRNSA-QHCPKHFHSA-N 391.902 5.813 30 20 GKED Cc1cnc([C@@H](C)NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 427081541 SMVQUJVDTHUSQI-CYBMUJFWSA-N 397.887 5.260 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2CCC(F)(F)F)s1 430591165 NHLFELSPZHAOON-CQSZACIVSA-N 380.435 5.426 30 20 GKED N#CCCC[C@@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 433021609 RMLXGPKUTPXUJF-IQGLISFBSA-N 395.355 5.126 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(C)(F)F)cc1 433117886 PZFCGJQUTVXXPC-CQSZACIVSA-N 389.471 5.372 30 20 GKED Cc1ccccc1-c1nnc(SCC#Cc2ccc(OC(F)(F)F)cc2)o1 433404273 VYABEJSCYUQOTH-UHFFFAOYSA-N 390.386 5.087 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1ccc(F)cc1C#N 435162202 IRCGKQODWSOYSE-CYBMUJFWSA-N 380.448 5.012 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@H]1c1cccc2ccccc12)c1ccccc1 438869519 SFYDZRQNFJUEIJ-RPWUZVMVSA-N 383.495 5.731 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3ccccc3Cl)C3CCCC3)o2)c1 441516419 UDPIMUQAGXTQIE-UHFFFAOYSA-N 392.890 5.206 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CS[C@@H](C)c1cccc(C#N)c1 443158592 ZIGXWMQPULAYHV-KRWDZBQOSA-N 380.557 6.238 30 20 GKED CCCOc1ccc(CCC(=O)N(Cc2ccco2)c2ccccc2C#N)cc1 443830905 BBWUMKHCIOZQTP-UHFFFAOYSA-N 388.467 5.106 30 20 GKED C[C@H]1CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC[C@@H]1c1ccccc1 460644774 XVHCMOAMFOVAHR-MBSDFSHPSA-N 397.478 5.011 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@H](C)c3cccc(C#N)c3)cc2)n1 462245524 OEDZAPSHJODKHD-CQSZACIVSA-N 379.510 5.217 30 20 GKED CCCN(C(=O)NCCc1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 466808112 WXTCHPBIYAJUJU-QGZVFWFLSA-N 375.472 5.030 30 20 GKED COc1cccc(N(CC(C)C)C(=O)c2cn(CCCC#N)c3ccccc23)c1 469073729 SKVGKSKUHQHZNT-UHFFFAOYSA-N 389.499 5.256 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 472188650 IHGZSYRFQMHWFA-QFIPXVFZSA-N 392.547 5.164 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCc2ccncc2)cc1 476800936 YNDQGZRRBLDHBI-UHFFFAOYSA-N 386.495 5.765 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1cc(F)ccc1F 481170126 OJEBKIRMOWZIDP-UHFFFAOYSA-N 380.419 5.264 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(COCC(F)(F)F)cc1 481920337 UXYAEGHFGWQOSQ-NRFANRHFSA-N 388.433 5.194 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 490282244 GAWAPKACJFQPRS-CYBMUJFWSA-N 387.361 5.054 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccccc1C)C1CC1 497463059 DXOXLMNSNNLDKB-QFIPXVFZSA-N 380.536 5.011 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCC(C)(C)C2)cc1 497774503 CWSZEEROHYMDHQ-UHFFFAOYSA-N 379.460 5.013 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1ccc(-c2ccc(Cl)cc2)s1 499628668 YOYWCNJIJGHLBC-INIZCTEOSA-N 388.964 5.820 30 20 GKED N#Cc1cc(F)cc(C2(c3nc(-c4cccnc4Oc4ccccc4)no3)CC2)c1 508053303 IHZYFZRFVVMECU-UHFFFAOYSA-N 398.397 5.015 30 20 GKED CCN(Cc1ccc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cc1)C(C)C 509017553 SHPCYOLLIQWRHV-UHFFFAOYSA-N 377.532 5.091 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c1 509745717 KOAUGOXJSOFHQT-KRWDZBQOSA-N 382.357 5.206 30 20 GKED C[C@H]1CCC[C@H](N(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 509920360 RMPOZJPQEYEZPC-AVRDEDQJSA-N 391.515 5.374 30 20 GKED CC(C)COCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510006026 QQYKJHZPQQRMNH-HXUWFJFHSA-N 399.922 5.180 30 20 GKED N#C[C@@H](C(=O)c1cccc2c1CCC2)c1nc(-c2ccc(Cl)cc2)cs1 512487942 BNCMCCDRMTUGPL-SFHVURJKSA-N 378.884 5.442 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c(F)c1 513957962 JAAPFKCVCQACNI-UHFFFAOYSA-N 391.421 5.379 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N(C)c2cccc(C#N)c2)cc1OCC 516824062 RCHIUKVYNUSBBI-UHFFFAOYSA-N 386.879 5.066 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 520195642 GEAVTJCLOUSZRH-XLIONFOSSA-N 381.545 5.990 30 20 GKED N#Cc1cc(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)nc2ccccc12 521108474 IZWLGKRGIAOAIC-UHFFFAOYSA-N 384.826 5.074 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(OC2CCCC2)c1 521205080 MPUNTTKFZUNEHE-UHFFFAOYSA-N 391.515 5.570 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc(-c3ccccc3)cn2)c1 521284570 UPMBJVICHKLIAZ-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(Cl)c1Cl 521293332 MAZXVOJNPLFNJO-ZDUSSCGKSA-N 379.630 5.388 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3csc(Br)c3)c2)cc1 521494019 ZVJIUIFFPDMVTM-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)c1C#N 524106077 WIXQDUALDQUMNK-CABCVRRESA-N 378.419 5.252 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(Sc3ccccn3)cc2)c1C#N 524330350 HIFMZWWZGUDEGS-UHFFFAOYSA-N 379.510 5.289 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)c(OCC2CCOCC2)c1 525507682 RJGHFRFNKWRIAG-UHFFFAOYSA-N 394.515 5.021 30 20 GKED COc1cccc(COc2cccc(NC(=O)c3ccc(C#N)cc3C)c2C)c1 535215599 QVKJFKIOSVNPSF-UHFFFAOYSA-N 386.451 5.015 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1Br 535293272 PLJJMQFTQNVAPN-LBPRGKRZSA-N 389.318 5.262 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cccc1-c1ccccn1 535871473 JMZXIAVHTQQKPY-IBGZPJMESA-N 396.475 5.066 30 20 GKED C=CCC[C@H](NCc1nc(C2CCCC2)no1)c1ccc(C(F)(F)F)cc1 537129052 DKDAIFQHQVBXJK-KRWDZBQOSA-N 379.426 5.543 30 20 GKED N#CCC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 538426437 KGJMVHYGRRBQIN-HXUWFJFHSA-N 377.469 5.458 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)C[C@@H]1CC=CCC1 544250083 WDQHCVPYWSAOLL-LJQANCHMSA-N 389.499 5.266 30 20 GKED CCOC(=O)c1oc2c(c1C)[C@H](N[C@H](CCCC#N)c1ccccc1)CCC2 556202364 MOWMTTHNRNECHS-RTBURBONSA-N 380.488 5.167 30 20 GKED CC(C)(C#N)CCCN[C@@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 558895998 JZKASQSQZBRYQA-MOPGFXCFSA-N 379.951 5.313 30 20 GKED C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1cccc(NC(=O)c2ccccc2)c1 564432501 SRZXPQWYWFIAEQ-MZNJEOGPSA-N 381.479 5.149 30 20 GKED Cc1nnc(SCc2ccc(C#N)cc2OC(F)F)n1[C@H]1CCC[C@H](C)C1 569110819 ONDZXWAQLHUZKQ-LRDDRELGSA-N 392.475 5.103 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(C#N)cc1OC(F)F 577146028 SKKXFIMNHWUYNK-ZDUSSCGKSA-N 399.466 5.442 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)[C@@H]1C1CC1 579221502 TUNPUZGOEFAWPQ-PZJWPPBQSA-N 393.918 5.648 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(Oc2cccnc2)cc1 589002575 JTLNVQRKWZHEFT-CQSZACIVSA-N 392.846 5.282 30 20 GKED N#CCCCCCC(=O)N1CCCCC[C@@H]1C1CCN(Cc2ccccc2)CC1 590892009 PRFMIAWFVOHTQO-XMMPIXPASA-N 395.591 5.144 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1ccc(O[C@H](C)c2ccccc2)cc1 595683638 XBPMIZHPHPWHKH-LEWJYISDSA-N 392.543 5.578 30 20 GKED C[C@H]1CC(F)(F)CCN1C(=O)Nc1ccc(Sc2ccccc2C#N)cc1 599793314 GBURTRROJVJZLH-AWEZNQCLSA-N 387.455 5.361 30 20 GKED Cc1ccc(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 603673420 UYFKBZQKCGPZOP-NRFANRHFSA-N 390.870 5.321 30 20 GKED C=CCCC(=O)N[C@H](C)c1sc(-c2ccc(Br)cc2)nc1C 606807106 RJFLCHSNGQVXSJ-LLVKDONJSA-N 379.323 5.024 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)F)cc2)cc1Cl 608805382 VDVVRGCSUIRKQG-LJQANCHMSA-N 396.824 6.185 30 20 GKED CCC(CC)CN(CCC#N)C(=O)CCc1ncc(-c2ccccc2Cl)o1 609188386 RVGNOGZEVXAVEP-UHFFFAOYSA-N 387.911 5.106 30 20 GKED Cc1cccc2sc(C(=O)Nc3ccccc3SCCC#N)c(Cl)c12 609375386 NGRIHSXBMJTLQQ-UHFFFAOYSA-N 386.929 6.121 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(OC(C)(C)C)cc1 609401943 LWVNDMWFXVAWPU-INIZCTEOSA-N 397.544 5.437 30 20 GKED CCCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)c1ccc(C)o1 609436627 BVLLRNKKLFNGDC-QZTJIDSGSA-N 399.560 6.378 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H](c2ccco2)C1 609553227 UCOZVRFEZDHILI-SFHVURJKSA-N 387.439 5.273 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1cccc(Br)c1)c1ccc(C#N)cc1 609825869 XZWRBSXDJZAPKO-QWHCGFSZSA-N 389.318 5.142 30 20 GKED N#Cc1c(NC(=O)c2coc(-c3ccccc3)n2)sc2c1CCCCCC2 609968924 BOJYHBGTWFJWAP-UHFFFAOYSA-N 377.469 5.186 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](c3ccco3)C2)cc1F 610335089 QDRYZQGJAFAIAQ-MRXNPFEDSA-N 391.402 5.104 30 20 GKED C[C@@H](N[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1cccc(C#N)c1 610343997 YDWPOFZQOROGSA-CHWSQXEVSA-N 386.377 5.039 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3c(-c4ccccc4)noc3C)n2)cc1 612894659 FFQLUXRZXKJNLW-GOSISDBHSA-N 399.475 5.572 30 20 GKED FC(F)(F)Oc1cccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 678207838 FPRILTDLFKKABI-GHMZBOCLSA-N 395.265 5.148 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)C(F)(F)F 682554215 KLTMUKPHJKPSRB-JTQLQIEISA-N 378.263 5.049 30 20 GKED FC(F)(F)c1cscc1CN1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 685834854 PVFZOHGAODYVNU-DTORHVGOSA-N 385.295 5.330 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)c1 726472852 ALCYLJBJDSRNGO-UHFFFAOYSA-N 375.324 5.336 30 20 GKED C#Cc1cccc(N(C(=O)c2sc(Cc3ccc(F)cc3)nc2C)C(C)C)c1 728247911 UZHVHOJEDLOZCN-UHFFFAOYSA-N 392.499 5.218 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730417299 OUXQGCNAUOHKOI-PBHICJAKSA-N 396.487 5.511 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C\c1cn(Cc3ccccc3)nc1-c1cccnc1)C2 730948478 GPXXRJXZQVPEQS-HMAPJEAMSA-N 391.474 5.124 30 20 GKED C#CCOc1cccc(NC(=O)c2ccccc2SCc2cccs2)c1 730977679 MDIKJPRYRXADDR-UHFFFAOYSA-N 379.506 5.305 30 20 GKED C#CCOc1ccc(NC(=O)c2ccccc2SCc2cccs2)cc1 730980165 DSQUZPFAJIJCAX-UHFFFAOYSA-N 379.506 5.305 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 733328136 INFGLIYNKONPRQ-INIZCTEOSA-N 394.515 5.511 30 20 GKED N#CCSc1ccccc1C(=O)Nc1nc(/C=C/c2ccccc2)cs1 735290477 RGBXSQCLKXVDKA-ZHACJKMWSA-N 377.494 5.181 30 20 GKED Cc1cc(-c2csc(NC(=O)[C@H](C)C#N)n2)c(C)n1Cc1ccccc1Cl 736667239 NXCVMFBLKNSMFE-GFCCVEGCSA-N 398.919 5.028 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 739144438 XSVCZYPBMLYDCR-KBXCAEBGSA-N 382.385 5.309 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)c1 741559530 XWJKRPZLWDYFAM-UHFFFAOYSA-N 397.261 5.439 30 20 GKED COc1cc(C(C)=NNc2nc3cc(F)c(F)cc3[nH]2)ccc1SC(F)F 746489524 CBDYFARUOSLPJF-UHFFFAOYSA-N 398.385 5.001 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)Nc1cccc(OCC#N)c1 746662988 LYPSQPGMYKMCOP-IBGZPJMESA-N 385.467 5.384 30 20 GKED CC(=NNc1ccc(Cl)nn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750918104 PVRFDCSBSXFJNX-UHFFFAOYSA-N 382.695 5.004 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(OCC(F)(F)F)cc1 753143310 TVWOFGJUDQEJKJ-HJWRWDBZSA-N 390.386 5.042 30 20 GKED C=C(C)C[C@@H](C)C(=O)O[C@@H](C)C(=O)N1c2ccccc2Sc2ccccc21 767697850 WRJYGFYWRRRXNO-CVEARBPZSA-N 381.497 5.350 30 20 GKED Cc1nc(COc2ccc(F)cc2)sc1C(=O)OCCCCC(C)(C)C#N 768460068 UPVVWJVUKFMSLX-UHFFFAOYSA-N 390.480 5.047 30 20 GKED CC(=NOCc1nnc(C(C)C)o1)c1ccc(OCc2ccccc2C)cc1 768517710 RWMUGGLWROANEN-UHFFFAOYSA-N 379.460 5.021 30 20 GKED O[C@@H](CN[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 775191985 NQYQBEHEGWUKHI-CVEARBPZSA-N 395.318 5.161 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCc2c(Cl)cccc21)c1nc(-c2ccccc2)cs1 776081566 PDXKRIDWFCLURL-SJORKVTESA-N 378.884 5.370 30 20 GKED C#CCCCCCC(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1 779976452 HJLQXSRCULJGKX-UHFFFAOYSA-N 385.895 5.570 30 20 GKED O=C(/C=C/c1cnn(Cc2ccc(F)cc2)c1)c1ccc(-c2ccncc2)cc1 780186230 FKSSCPJHSLFHJJ-XCVCLJGOSA-N 383.426 5.029 30 20 GKED O=C(/C=C\c1cnc(-c2ccc(Br)cc2)s1)c1ccnc(F)c1 794720248 FKADFTQCAWIJRG-WAYWQWQTSA-N 389.249 5.003 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1c2c(nc3ccccc13)CCCCC2 801690067 VVVBFGIIPBTXIL-INIZCTEOSA-N 385.467 5.047 30 20 GKED N#CCCC[C@@H](NCc1ccc(OCc2ccccc2)cc1O)c1ccccc1 816627071 DOKZHOGYTQLTOQ-XMMPIXPASA-N 386.495 5.496 30 20 GKED N#CCSc1ccccc1C(=O)N[C@@H]1CCC[C@H](c2ccc(Cl)cc2)C1 837099540 GPUJHSFPAXJRPQ-FUHWJXTLSA-N 384.932 5.412 30 20 GKED N#Cc1ccc2c(c1)CCCN2C(=O)c1ccc(C2SCCCS2)cc1 839395543 CIIFLSOFKAJUHX-UHFFFAOYSA-N 380.538 5.020 30 20 GKED C[C@H](NC(=O)N1CCC[C@]2(C1)CC2(F)F)c1ccc(-c2cccc(C#N)c2)cc1 845103348 SFFAHMYUHJMETD-KSFYIVLOSA-N 395.453 5.117 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC[C@]3(C2)CC3(F)F)cc1 846574160 WEEAWMBGIUUMPJ-OAQYLSRUSA-N 398.478 5.112 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2c[nH]c3ccccc23)cc1 915086550 LOYDQZWPWBUFMB-QHCPKHFHSA-N 379.463 5.395 30 20 GKED C[C@@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)NC2CC2)cc1 915978979 KYUDFDRJOZNQES-FEJWEZRGSA-N 392.286 5.163 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916707934 BZAPENXBYVACND-LOSJGSFVSA-N 395.506 6.020 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)c2sccc2Br)cc1 916870297 FQHPLWSDJWFFEA-CYBMUJFWSA-N 390.302 5.013 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 919811390 RUODCMNPGLLIIZ-UHFFFAOYSA-N 378.815 5.287 30 20 GKED Fc1ccc(C(NCc2c(F)c(F)c(F)c(F)c2F)c2ccc(F)cc2)cc1 920402224 CPPKWVDZJOJJNB-UHFFFAOYSA-N 399.309 5.540 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776125296 CRVYTMPXEHWQEQ-KTKRTIGZSA-N 378.877 5.565 30 20 GKED CC(C)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1F 1776355935 BQQQTRLEKYUBFE-OQFOIZHKSA-N 394.398 5.467 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc4[nH]c(C(=O)O)cc4o3)s2)cc1 1777430597 OONLQSDZQKUYOT-BQYQJAHWSA-N 392.436 5.096 30 20 GKED N#CCC[C@H](C#N)CSc1nc2cc(Cl)ccc2n1Cc1ccccc1 7034444 MOOIYTSFCNIGHZ-MRXNPFEDSA-N 380.904 5.274 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)cc1 28605918 HBEMMOLUDFCXSJ-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)cc1 29150371 XHGNUBFEFUNWES-UHFFFAOYSA-N 397.689 5.465 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1ccccc1 31606323 JHIIEBRNQKOREL-UHFFFAOYSA-N 376.460 5.111 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(OC(C)C)cc1 46667849 PFOUBRMGHOIZRL-UHFFFAOYSA-N 387.439 5.094 30 20 GKED N#C[C@H](C(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccn1 49457112 CTCYCVHNFKVQRA-NNTXTVRGSA-N 384.279 5.009 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccc(C)s2)cs1 54897660 TWONWDUASLTICM-RMKNXTFCSA-N 386.473 5.233 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 103012454 MQJDWBFHYDAWRE-GFCCVEGCSA-N 379.275 5.519 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 114984876 ZUWRICLSIAWCOX-GFCCVEGCSA-N 393.537 5.429 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2SCC)cc1 121768733 YXARGGGRFKBEPN-UHFFFAOYSA-N 389.908 5.012 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccc(Cl)cc2C1 123776619 JTNZZIMWZFAJND-CQSZACIVSA-N 385.920 5.182 30 20 GKED Cc1ccc(CO)cc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 132055753 MOMPUXITVXPLNR-UHFFFAOYSA-N 392.842 5.057 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(c3ccccn3)C3CCCC3)c2)cc1 154689044 YVGGUABTJJZXFI-UHFFFAOYSA-N 383.451 5.335 30 20 GKED CC(C)[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1CCC(F)(F)F 155337486 OZUSKIYXDKCNSA-LJQANCHMSA-N 390.405 5.095 30 20 GKED C[C@@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)c1cccc(C#N)c1 189860087 BJFOSBHUPZDMBE-MRXNPFEDSA-N 389.528 5.570 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Oc2ccc(C(C)=O)cc2)cc1 189904303 SYIYJBXROUWSFD-UHFFFAOYSA-N 378.472 5.226 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Br)cc2Cl)cc1 194129795 WTVNWSWAGBNYLC-UHFFFAOYSA-N 377.669 5.156 30 20 GKED N/C(=N/Cc1coc(-c2cccs2)n1)Nc1cccc(Oc2ccccc2)c1 304516390 ZFWAVJQMRCBLAT-UHFFFAOYSA-N 390.468 5.122 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccnc1SCc1cc(C)on1 410343320 CGCPLXOUNAUMRE-UHFFFAOYSA-N 379.485 5.041 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3cccc(SCC#N)c3)c2)C1 429854506 PVVFCHVROPBQFZ-DYESRHJHSA-N 394.540 5.650 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)C1 430152719 XGVIBCYAQCZLAV-IAGOWNOFSA-N 394.931 5.431 30 20 GKED CC(C)(C)Cc1nc2cc(NC(=O)c3cccc(SCC#N)c3)ccc2o1 430735117 PCAWHZXZZJHKAG-UHFFFAOYSA-N 379.485 5.284 30 20 GKED N#Cc1cc(NC(=O)C2CC(F)(F)C2)ccc1Oc1ccc(C(F)(F)F)cc1 440565990 SXTHZAHCHHHMGM-UHFFFAOYSA-N 396.315 5.353 30 20 GKED COc1cc(Oc2ccccc2)ccc1NCc1nnc(-c2cccc(C#N)c2)o1 446902115 ISVZZCOBFCJPDC-UHFFFAOYSA-N 398.422 5.021 30 20 GKED O=C(N[C@H](c1cc(F)ccc1F)C(F)F)c1ccccc1CCC(F)(F)F 448462228 RNNLPCBZEJBRPM-OAHLLOKOSA-N 393.302 5.196 30 20 GKED N#CCCC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)c1ccccc1 458809394 AIQAMDUPEKTNNX-UARRHKHWSA-N 387.527 5.399 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)CC1 460769541 OTDBNBXMRBZPAU-KJBLDROHSA-N 380.319 5.074 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c(Cl)cccc1Oc1ccccc1Cl 463120842 AFVMTCPCEWYGAF-CYBMUJFWSA-N 377.271 5.407 30 20 GKED CSc1cccc([C@H](NC(=O)c2ccc(C#N)cc2)c2ccc(F)c(F)c2)c1 464125179 CRHFNZQIUXXJQP-NRFANRHFSA-N 394.446 5.078 30 20 GKED N#C[C@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1cc(C(F)(F)F)ccn1 464467986 OOQUZIMFQAWIHX-INIZCTEOSA-N 399.397 5.137 30 20 GKED CCCCn1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(C)n1 472549768 IVQPYDBEFISQLQ-UHFFFAOYSA-N 388.471 5.216 30 20 GKED CC(C)c1cccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)n1 474884941 CEKOATSLRWCXCN-GFCCVEGCSA-N 383.423 5.097 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2NC(=O)C[C@H]2C=CCC2)cc1 475750266 AHFAKLDPLUBVQH-KRWDZBQOSA-N 387.483 5.035 30 20 GKED C=C(C)[C@H](NCc1cc(OC)c(OC)cc1SC)c1ccc(F)c(F)c1 479404620 DLEVJVNZGIRABU-FQEVSTJZSA-N 379.472 5.111 30 20 GKED Cn1cc(CNCc2ccc(Oc3cccc(Cl)c3Cl)cc2)cc1C#N 480364111 REBYFSWHJNILLL-UHFFFAOYSA-N 386.282 5.286 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@@H](C)[C@H]1C 482925965 YCLXFMSQUAYVKR-CVEARBPZSA-N 381.501 5.017 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1 483200686 OGUZSPQUWZBUNT-QHCPKHFHSA-N 392.458 5.791 30 20 GKED N#C[C@H](C(=O)c1coc2cc(F)ccc12)c1nc(-c2c(F)cccc2F)cs1 483524251 MKBDIZXBVOGKPT-GFCCVEGCSA-N 398.365 5.464 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2ccco2)cc1F 490520312 KCFXOTPCILYZHW-UHFFFAOYSA-N 377.419 5.400 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1c[nH]nc1-c1ccccc1 492177424 FWRCLBPXINWCCG-AWEZNQCLSA-N 377.473 5.115 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1c(F)cccc1F 496847751 VRMYWRRALJCRLM-AWEZNQCLSA-N 394.446 5.479 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc1Cl 501349551 INYXHGHOEALJTD-HNNXBMFYSA-N 384.932 5.879 30 20 GKED N#C[C@H](NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1)c1ccccc1F 505917163 NMUDDZIAMZHJFO-LEWJYISDSA-N 394.446 5.179 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)oc2ccc(F)cc12 505948716 QBADZVONAVFAML-OAHLLOKOSA-N 377.202 5.182 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)CC1 506602424 ITDVHENTNKCUFR-UHFFFAOYSA-N 379.529 5.278 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 509563234 DVCLRJBYNOMVHX-VOBQZIQPSA-N 386.417 5.290 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 514898805 JRUILMGTKKNYFV-LBPRGKRZSA-N 393.537 5.429 30 20 GKED C[C@@H](c1ccc(Br)cc1)c1noc(C[C@H](CC#N)c2ccccc2)n1 515182337 VDCGPSKKNKHYJL-YOEHRIQHSA-N 396.288 5.224 30 20 GKED N#Cc1cc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)nc2ccccc12 516681413 LAKPMGKBOLYVRG-ZXPDZVFASA-N 399.416 5.194 30 20 GKED CCc1ccc(CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C2CC2)cc1 518907184 PDTCANWQFMNBTC-UHFFFAOYSA-N 397.478 5.113 30 20 GKED Cc1ccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520195931 RCSIPOVXGJZJIM-QGZVFWFLSA-N 381.545 5.489 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 521810955 LZUHCZSNIMMCHA-INIZCTEOSA-N 375.428 5.086 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)N[C@@H](C)CCC(C)(C)C)cc1C 522913416 HFXUZJCIHDNUFN-SFHVURJKSA-N 380.536 5.025 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(OCC2CCCCC2)CC1 524685664 LRDGPDRAPLMYGD-UHFFFAOYSA-N 383.923 5.326 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl 524822823 PKLMGECPJDASEK-WIYYLYMNSA-N 390.845 5.304 30 20 GKED CC(C)(C)c1ccc(-c2cc(NC(=O)c3c(F)cc(C#N)cc3F)on2)cc1 531280418 CYMALYQAFJUWQC-UHFFFAOYSA-N 381.382 5.041 30 20 GKED N#CCC[C@H](NCc1cc(Br)cc(C(F)(F)F)c1)c1ccccc1 533920687 DEPQEXAXTPGDTQ-KRWDZBQOSA-N 397.238 5.603 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)C(c1ccccc1)c1ccccc1 537434355 NBSMWJVJRDHRPW-UHFFFAOYSA-N 380.491 5.493 30 20 GKED N#CC1(c2ccc(C(=O)N(c3ccccc3)C3Cc4ccccc4C3)cc2)CC1 538555610 QELLADWSCBOHAN-UHFFFAOYSA-N 378.475 5.056 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Sc3ccc(C#N)c(C(F)(F)F)c3)o2)cc1 541074333 TUEBJUJAJCNZTM-LBPRGKRZSA-N 389.402 5.789 30 20 GKED N#Cc1cc(C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)ccc1Cl 542522721 XUMLRBKNUNKJEJ-UHFFFAOYSA-N 392.808 5.250 30 20 GKED COc1ccc2oc([C@H](C)NCc3ccc(C#N)cc3OC(F)F)c(C)c2c1 542581548 CIXJZILQJNNMIG-ZDUSSCGKSA-N 386.398 5.074 30 20 GKED C[C@H](NC(=O)Cc1cccc2cccnc12)c1ccc(-c2cccc(C#N)c2)cc1 543915350 IDGJGYYAWXQKQX-SFHVURJKSA-N 391.474 5.193 30 20 GKED Cc1ccc(CN(C(=O)NCc2cccc(C#N)c2)[C@H]2CCc3ccccc32)cc1 549141166 ILROVTSRGCSZGJ-VWLOTQADSA-N 395.506 5.266 30 20 GKED Cc1cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)sc1Br 551211487 ITVZKRXXIRMEIE-HOCLYGCPSA-N 377.351 5.905 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(F)ccc1Cl 551667334 MWSAMMIRHQZKEI-UHFFFAOYSA-N 382.847 5.754 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CC1CCC(C(F)(F)F)CC1 565140954 BUDNLBAWYKOGNS-UHFFFAOYSA-N 385.474 5.128 30 20 GKED CCCc1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)o1 565340051 POEIIXXJONABIQ-AWEZNQCLSA-N 385.876 5.203 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C 580374776 CZTLXNROKOUCKB-UHFFFAOYSA-N 398.869 5.193 30 20 GKED C[C@@H](N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccc(C#N)cc1 584861781 KYLCEVHFQKVTEI-ZUOKHONESA-N 394.316 5.530 30 20 GKED N#CCCCCCC(=O)N(c1cccc(N2CCCC2)c1)C1CCCCCC1 588930315 LGHNNNHJSAYXAP-UHFFFAOYSA-N 381.564 5.817 30 20 GKED N#CCCC[C@@H](NCc1ncc(Br)cc1Cl)c1ccccc1 595503340 RUEDBJSGZRMRJE-MRXNPFEDSA-N 378.701 5.022 30 20 GKED COc1ccc(CCCCCC(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 608940680 VGJZQHGAGGRVDL-UHFFFAOYSA-N 380.488 5.096 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 609213577 XTDPRVMBUBHUGM-QFIPXVFZSA-N 393.918 5.451 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1 609296934 KSMOLURYVBFGTF-QFIPXVFZSA-N 390.870 5.473 30 20 GKED CCCCSCCC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 610040704 KVGRERMCWPZSCI-UHFFFAOYSA-N 384.520 5.150 30 20 GKED C[C@H](NC(=O)N[C@H](Cc1ccccc1)c1ccccc1F)c1cccc(C#N)c1 610356649 XFOAGGZVAGNXGU-GAJHUEQPSA-N 387.458 5.042 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CC(CC(F)(F)F)C2)cc1Cl 611187409 RSOLKAFFXNNDGE-UHFFFAOYSA-N 394.780 5.028 30 20 GKED C=CCCOCC(=O)N(CC=C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 620327064 MSSGWJOMMDFVLP-UHFFFAOYSA-N 397.327 5.229 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)[C@H]1CCC(F)(F)C1 648494588 ZPFARNOOFNIAEC-QMMMGPOBSA-N 393.249 5.350 30 20 GKED CC(C)c1[nH]ccc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 653036016 PVLJILYUQJRLBG-UHFFFAOYSA-N 396.306 5.680 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 727629176 PBCPXNIJFMRTMN-JXFKEZNVSA-N 380.538 5.431 30 20 GKED CC(C)CCN1Cc2cccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2C1 727979413 XWUDBFBHISCQNJ-UHFFFAOYSA-N 398.963 5.382 30 20 GKED O=C(O)C(=O)/C(=C/c1cc(-c2ccccc2)cs1)c1ccc2ccccc2n1 728156469 IPVBNQYBCYGLPQ-CPNJWEJPSA-N 385.444 5.158 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Nc3ccc(F)cc3)c3ccncc23)cc1 732103299 CKDTYMCCFINCFO-UHFFFAOYSA-N 396.425 5.170 30 20 GKED Cc1ccc(N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 733311296 PUJLQIZAVOCPKB-OAHLLOKOSA-N 387.936 5.118 30 20 GKED CC(C)c1ccc(Nc2nn(CN(CC#N)C3CCCC3)c(=S)s2)cc1 738256072 GQTJCRCFOPEZBN-UHFFFAOYSA-N 387.578 5.267 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(O)c4ccccc34)c2)cc1 738507009 GEDZDEOHGIFRRT-UHFFFAOYSA-N 379.419 5.413 30 20 GKED CC1(C)C(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)[C@H]2CCCO[C@@H]21 743429572 SRFWMYCOMFJZFF-KDOFPFPSSA-N 396.491 5.100 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1)C(=O)c1cc2c(s1)CCCC2 743467655 FLTZQEBENRTNEY-AWEZNQCLSA-N 378.280 5.139 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1C(F)(F)F 747197951 PGQAQALLMONOQK-ICDLMJIXSA-N 378.419 5.565 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)n1 751870192 LOYDEEFDPIMJED-YOSAPJRCSA-N 396.478 5.592 30 20 GKED CN(C)C(=O)Sc1cccc(CSCCCOc2ccc(C#N)cc2)c1 753127246 QOJXOVNQDUTJRO-UHFFFAOYSA-N 386.542 5.034 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1ccc(-c2nc3ccccc3s2)o1 754710459 TXHHORKXUURBMC-UHFFFAOYSA-N 388.370 5.988 30 20 GKED C=C[C@@H](CC(=O)N(Cc1ccccc1)C[C@H](O)c1cccs1)c1ccccc1 759334166 TWIRCLMLLCRMOV-UNMCSNQZSA-N 391.536 5.170 30 20 GKED CC(=NOCc1nc(-c2ccccc2)cs1)c1nc2ccccc2n1C(F)F 766693209 ROLZAXLNBJCQCJ-UHFFFAOYSA-N 398.438 5.496 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 767585805 MEXDIKDDVKROJD-DQEYMECFSA-N 395.506 5.711 30 20 GKED Cc1ccccc1-c1nc(C(=O)OCc2ccccc2C(C)(C)C#N)cs1 768017006 HTBMLDSTEZGSAX-UHFFFAOYSA-N 376.481 5.277 30 20 GKED CN(CCC#N)c1ccc(CN(Cc2cccs2)Cc2cccs2)cc1 768197015 HMOVKPMCUNFYKT-UHFFFAOYSA-N 381.570 5.362 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCCCc3ccc(Cl)cc32)ccc1OC 772984929 GPOOLGMKTCULIN-FPOVZHCZSA-N 398.934 5.587 30 20 GKED O=C1/C(=C\c2csc(-c3ccsc3)n2)CCc2ncc(C(F)(F)F)cc21 777469388 DDMKGZQLPLXYLI-YHYXMXQVSA-N 392.427 5.498 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)c1 779105080 SAEGJDQEFUDJNZ-JOCHJYFZSA-N 392.449 5.525 30 20 GKED C=CC[C@H](NC(=O)N1CCC(C)(c2cccc(Cl)c2)CC1)c1ccncc1 793030361 UNLHEWPKRRXSKW-FQEVSTJZSA-N 383.923 5.116 30 20 GKED COc1ccc(OCc2nc(/C=C3/C(=O)c4ccccc4[C@H]3C)cs2)cc1 809159320 NJGVUJDYFVTPGY-XLTHYULKSA-N 377.465 5.114 30 20 GKED CCOc1cc(Br)c(F)cc1N[C@@H](C)c1ccc(OCC#N)cc1 810259525 KZNDDWWRSOHIST-LBPRGKRZSA-N 393.256 5.062 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NCc1ccccc1)c1cc(C(F)(F)F)ccn1 813217069 BGMRQDWOKWIHEM-GOSISDBHSA-N 395.384 5.203 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@H]1c1ccncc1 814576637 FTWPETWQDJMOOA-PKTZIBPZSA-N 396.494 5.352 30 20 GKED OCCC[C@H]1CCCCC1=NNc1ncnc2sc(-c3ccccc3)cc12 814726685 GWSVMBWTFTWKEK-OAHLLOKOSA-N 380.517 5.089 30 20 GKED COC1CCN(c2ccc(NC3CCC(C)(C#N)CC3)cc2C(F)(F)F)CC1 823544073 OMUSKOYNDOTGCX-UHFFFAOYSA-N 395.469 5.205 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)[C@@H](C#N)c1nc(-c3ccccc3)cs1)CCC2 847625096 BXJNTCWFILNWHN-UYAOXDASSA-N 388.492 5.115 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(OC(F)F)c2)cc1 915086768 MRNRMAFGVDNWCI-FQEVSTJZSA-N 378.378 5.196 30 20 GKED C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915087998 YJGCWQJPXPTNDH-KSFYIVLOSA-N 390.870 5.401 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1cc2ccccc2c(Cl)n1 915142337 XDNUGTBYWLBKPC-UHFFFAOYSA-N 387.222 5.031 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916679329 OMHCKZJHAMJVMZ-XMMPIXPASA-N 399.494 5.405 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)c1 916847940 XCQBQNBVZAQXGC-KRWDZBQOSA-N 390.508 5.451 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 917026880 RLFQITAIUFRBAA-RBSFLKMASA-N 378.419 5.355 30 20 GKED N#C[C@H](C(=O)CCSc1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 917043612 KSMSWYLTRRUJIX-CQSZACIVSA-N 390.892 5.447 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccc(O)c3ccccc23)c1 919811417 TVFLDPMXXJYAEV-UHFFFAOYSA-N 394.430 5.248 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2C(=O)O)c1)c1ccc(Cl)cc1 1776115376 WUMLIJCSKPAXRD-JYRVWZFOSA-N 392.838 5.513 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)cc1 1776125488 JVTXXDBVNCFYCB-SKTWIKFTSA-N 394.511 5.805 30 20 GKED CCCCCCCOc1ccc(CNc2ccccc2CCCC(=O)O)cc1 1776789211 VTSVZPNUKQWKEN-UHFFFAOYSA-N 383.532 6.055 30 20 GKED COc1cc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc2ccccc12 1777263975 UJDDTDDRXAWMTO-VURMDHGXSA-N 388.444 5.657 30 20 GKED Cc1ccccc1C(=O)/C(=C/c1csc2ccc(C(=O)O)cc12)c1ncc[nH]1 1777465125 KELMMOQSMQUSGC-WQRHYEAKSA-N 388.448 5.055 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2ccc(O)c(C(=O)O)c2)o1 1777559864 OQORBJCNDOCERJ-JXMROGBWSA-N 388.375 5.301 30 20 GKED C[C@H](N[C@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccccc1C#N 12667568 GPNABHVLBWBPNN-GBXCKJPGSA-N 397.522 5.239 30 20 GKED N#Cc1ccc(C(=O)COC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1 18225094 HANQMKGQZDEXIP-UHFFFAOYSA-N 390.247 5.119 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)[C@H]3CCCc4ccccc43)c2)c1 46744434 BIYXIJDGBTUSFW-DEOSSOPVSA-N 382.463 5.196 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccc(O)cc2)cs1 54895032 BZVSSMQYFQKMSY-WDZFZDKYSA-N 398.871 5.083 30 20 GKED Cc1cc(CSc2ccccc2C(=O)Nc2ccc(C#N)c(Cl)c2)on1 70809731 FJBMCRKXOIFPLN-UHFFFAOYSA-N 383.860 5.053 30 20 GKED COc1ccc(CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1Cl 108238577 JNINVESEQAUGHL-AWEZNQCLSA-N 388.920 5.172 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1coc(-c2ccc(F)cc2)n1 113053333 IRRVRGMLUKBUJH-AWEZNQCLSA-N 395.459 5.056 30 20 GKED N#C[C@H](Sc1nnc(-c2cccc(Br)c2)o1)C1CCCCC1 115186208 AAIQPLFKWCMKDL-AWEZNQCLSA-N 378.295 5.064 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1Br 119738399 UHXIYVBOLSTSEN-CYBMUJFWSA-N 389.318 5.404 30 20 GKED N#Cc1cccc(OCCCCC(=O)NC(c2cccs2)c2cccs2)c1 122598938 DCBNPKFQIJJQIQ-UHFFFAOYSA-N 396.537 5.136 30 20 GKED CCCSCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 125669300 CJCOMRHXFBQFMJ-LBPRGKRZSA-N 385.341 5.436 30 20 GKED Cc1coc(-c2cccc(NCc3cn(CCC#N)nc3-c3ccccc3)c2)n1 152065131 NERYIDHCLLDRIG-UHFFFAOYSA-N 383.455 5.039 30 20 GKED N#C[C@H](C(=O)NC1CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 155688274 SCJBECGHBPTWDW-CQSZACIVSA-N 394.327 5.173 30 20 GKED CC[C@H](SC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156556815 CTCQKXCTZLIRIY-FZMZJTMJSA-N 385.341 5.435 30 20 GKED N#C[C@@H](NC(=O)c1occc1CSc1ccccc1)c1ccccc1Cl 179554520 SWWQUDNNOAZNIM-GOSISDBHSA-N 382.872 5.220 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)nc4ccccc34)n2)cc1 185264097 XNTOJIVGLSZRAJ-LJQANCHMSA-N 399.475 5.165 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 248633614 IYULZJVWTYPSGL-XBFCOCLRSA-N 390.430 5.240 30 20 GKED CC(O)=Nc1cccc(N=C(O)[C@H](C)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 328727214 DBPXLMJYSZSJHL-GUYCJALGSA-N 397.441 5.326 30 20 GKED CC(=O)N1CC[C@H](/N=C(/O)Cc2coc3cc(C)c(C)cc23)c2ccccc21 328776047 CNQSQPAHLACBLB-FQEVSTJZSA-N 376.456 5.047 30 20 GKED C[C@H]1C[C@H](C(O)=Nc2nc(-c3cc(Cl)sc3Cl)cs2)CCC1=O 329384066 OWLGGCFNPNSTOB-JGVFFNPUSA-N 389.329 5.772 30 20 GKED Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1N=C(O)c1cccnc1C1CC1 329608054 BMBVQZGLDZMGAX-HZPDHXFCSA-N 391.515 5.022 30 20 GKED C=CC[C@H](C(=O)NCCCCc1nc(-c2cccnc2)cs1)c1ccccc1 427097122 OROHIKNPKVULBI-FQEVSTJZSA-N 391.540 5.004 30 20 GKED C=CCC[C@H](C(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644190 GPZSTPXNCIAAEC-ICSRJNTNSA-N 392.474 5.423 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N(CC(F)(F)F)C2CCC2)cc1 427928816 MQCLZZAAUSQLFJ-UHFFFAOYSA-N 390.430 5.266 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 433778190 UXTHGOHKUNMGNN-AWEZNQCLSA-N 381.423 5.401 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 440058880 CTYSPDWCDKXKFB-UHFFFAOYSA-N 386.842 5.316 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)Cc1ccncc1)c1ccc(C(F)(F)F)cc1 440858569 WZTXLJCUJGIESF-KXBFYZLASA-N 391.437 5.038 30 20 GKED C[C@@H](CNC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 443190331 MWPXAPZIWMNOFZ-HNAYVOBHSA-N 389.421 5.153 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H](C)c2ccc(Br)s2)c1C#N 443910345 UIJXUBGJPMQERC-QMMMGPOBSA-N 383.336 5.057 30 20 GKED C[C@H]1CN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C[C@H](c2ccc(F)cc2)O1 462874747 DRPDTKVFJUVGRC-KPZWWZAWSA-N 399.828 5.004 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)C1CCC(c2ccccc2)CC1 463342248 ALEQSDRZCDZBJM-UHFFFAOYSA-N 385.429 5.147 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 464477226 ZYKMRRPINVFBIU-KRWDZBQOSA-N 376.378 5.015 30 20 GKED C=CCC(CC=C)C(=O)N1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl 467838070 FHSHSLNZRFSRPM-SFHVURJKSA-N 395.330 5.081 30 20 GKED COc1ccc2c(c1)CN(C(=O)Nc1cccc(C#N)c1C)[C@H](c1ccccc1)C2 470425767 UGRBJVUBGXZGTI-DEOSSOPVSA-N 397.478 5.207 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(N2CCCC2=O)ccc1Cl 471181616 GXYWIIZMXNEYDU-UHFFFAOYSA-N 397.906 5.077 30 20 GKED N#CC[C@@H](CC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 474394548 ZCAXQKYGDFCCFT-HTAPYJJXSA-N 392.549 5.371 30 20 GKED Cc1c(F)ccc(Cl)c1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 474899940 KXPLORSPAJTMIE-UHFFFAOYSA-N 394.833 5.491 30 20 GKED COC(=O)[C@H](Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)c(Cl)c1 479457103 QLOBACDISQHITH-QGZVFWFLSA-N 377.271 5.121 30 20 GKED COCCSc1ccc([C@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)cc1 481642364 HXATUZTWIWAOOS-SBUREZEXSA-N 380.557 5.415 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc2c(c1)CCC2 486197172 PPPZQKXRQDIXBZ-MRXNPFEDSA-N 396.581 5.441 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N[C@H](CCCC#N)c1ccccc1 487209550 LJQNYHZFEUSFBV-LJQANCHMSA-N 375.497 5.284 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@H](C)c1c(F)cccc1F 489676269 GXXPJGQWXZKFLM-CQSZACIVSA-N 387.455 5.175 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccccc1 490176386 NTZKKJFOTRRVNB-QFIPXVFZSA-N 388.511 5.064 30 20 GKED C=CCN1CCC(N[C@@H](c2cccc(SC)c2)c2cc(F)ccc2F)CC1 491033533 FDOYKHVKTPGNHS-QFIPXVFZSA-N 388.527 5.016 30 20 GKED C=CCOc1cccc(CNc2ccc(F)c(NC(=O)Cc3ccccc3)c2)c1 501001937 RTCBLVOODUZKPC-UHFFFAOYSA-N 390.458 5.184 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2)cc1 503579577 PADXHFRSKVDUTC-IBGZPJMESA-N 395.443 5.450 30 20 GKED CC(C)n1nc(-c2ccccc2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 506899066 RUIANWNFXRVIAI-UHFFFAOYSA-N 399.498 5.199 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(C)cc1)CCC2 509230036 NHOWEZSZOIJPLK-LVZFUZTISA-N 395.506 5.406 30 20 GKED Cc1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)nn1-c1ccccc1 511158296 VOZCVUFAXYJIGO-UHFFFAOYSA-N 384.464 5.033 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 512549247 OBBMKNGDDDLSCU-UHFFFAOYSA-N 379.382 5.323 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cnn1C1CCCCC1 512736227 UBBFMWOINSHBJH-HNNXBMFYSA-N 398.919 5.450 30 20 GKED C[C@@H]1CCN(C(=O)NCC(C)(C)CCC#N)[C@H]1c1ccc(C(F)(F)F)cc1 513118408 KKENNLYEZGRXSQ-RHSMWYFYSA-N 381.442 5.128 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1nc(C2CC2)oc1C 516986017 YKLWMWPZAREPDX-UHFFFAOYSA-N 389.430 5.027 30 20 GKED CCN(CCc1cccs1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517127899 GQBUHDZDBOJTDN-UHFFFAOYSA-N 391.496 5.509 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H]1CCc2ccccc21 517533572 WSNPFMPFOFJNOJ-DYESRHJHSA-N 393.556 6.012 30 20 GKED CCN(C(=O)Nc1ncc(-c2ccccc2)s1)[C@@H](C)c1ccc(C#N)cc1 518958034 JYBFLRYHGQLAPN-HNNXBMFYSA-N 376.485 5.297 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3nc4ccccc4s3)cc2)cc1 521955566 NRDVAOCJFIOHJX-UHFFFAOYSA-N 385.448 5.407 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C3CCc4ccccc4CC3)n2)cc1 528931553 FVVOOYHFKWAAJZ-OAQYLSRUSA-N 397.503 5.053 30 20 GKED CC[C@@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 533256243 JHWGTOIUQZHKMJ-RXVVDRJESA-N 395.572 5.493 30 20 GKED CCN(C(=O)Cc1csc(-c2cccc(F)c2)n1)c1ccc(C#N)c(Cl)c1 535874563 GEZFAUBPYCDGMG-UHFFFAOYSA-N 399.878 5.070 30 20 GKED N#CC1(CCCSc2nccn2-c2ccc(C(F)(F)F)cc2)CCOCC1 538608673 CHYUTHIOGCXDAP-UHFFFAOYSA-N 395.450 5.084 30 20 GKED C[C@H](N[C@@H]1c2cc(Br)ccc2SC[C@@H]1C)c1cccc(C#N)c1 540593759 KZJGJIYLRPQKFJ-JMERFSKESA-N 387.346 5.454 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccs2)o1)c1nc2ccccc2n1C(F)F 542130709 KYVKFFUWHHRWDS-NSHDSACASA-N 383.379 5.243 30 20 GKED C[C@H](NCc1cc(-c2cccs2)on1)c1ccc(-c2cccc(C#N)c2)cc1 542945570 UHVUVEUHRHYHLN-INIZCTEOSA-N 385.492 5.793 30 20 GKED N#Cc1cccc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)c1F 543164285 MIHWRUJEXLEERS-UHFFFAOYSA-N 397.812 5.354 30 20 GKED N#CCCN(Cc1cccnc1)Cc1ccc(-c2cccc(C(F)(F)F)c2)o1 543783520 FUFZBJOFTVMDKQ-UHFFFAOYSA-N 385.389 5.276 30 20 GKED COC(=O)c1ccc(-c2ccc(CN[C@H](CCCC#N)c3ccccc3)o2)cc1 556906842 BMQIOURERSMMGQ-JOCHJYFZSA-N 388.467 5.258 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OC)c(OC)c2C)cc1Cl 558117957 HPQMEHTYVKQRQD-HNNXBMFYSA-N 375.896 5.081 30 20 GKED N#CCC[C@@H](NCc1cc(C(F)(F)F)ccc1Br)c1ccccc1 572651826 UOPKPVCKACTIDT-QGZVFWFLSA-N 397.238 5.603 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@H]1c1ccccc1 581343384 PNQFLBVTHCQHIE-XLIONFOSSA-N 379.529 5.840 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@H](C)Cc1ccc(C#N)cc1 593967264 PHYKCYNBZPHZHR-CVEARBPZSA-N 389.524 5.046 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CC2(C#N)CCCCC2)cc1 596865241 MDEFXFCFKDPJRB-UHFFFAOYSA-N 387.483 5.134 30 20 GKED N#C[C@@H](C(=O)c1ccc2nc(C(F)F)[nH]c2c1)c1nc(-c2ccccc2)cs1 601432884 PZQGCZHUMHPXBL-ZDUSSCGKSA-N 394.406 5.114 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)Cc1c[nH]c2ccccc12 603532456 IOXMTTKQCJYXOR-UHFFFAOYSA-N 397.453 5.263 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(Cl)c3Cl)cn2)c1 603622750 XWJKPOYIOVTFRW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@H]2C2CCCCC2)ccc1OCC(F)(F)F 603827939 DYTZGYJMPUCVGA-KRWDZBQOSA-N 395.425 5.076 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C)c12 606816641 HRZWMHXBMBVVQG-UHFFFAOYSA-N 381.451 5.156 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCc3c(Br)cccc32)cc1 609047439 YKZAQCFVYDOILF-GOSISDBHSA-N 398.304 5.059 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)C1 609079170 NORGGFXVAQFUHQ-SFHVURJKSA-N 377.488 5.100 30 20 GKED Cn1cc(CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c2ccccc21 609176579 RNCWCRGDZIOCBD-UHFFFAOYSA-N 381.435 5.023 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2SCCC#N)c1 609375540 MWKPPDAULNDZJS-QGZVFWFLSA-N 382.529 5.530 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609553072 UZGGPJYOFLWIFD-CQSZACIVSA-N 389.421 5.259 30 20 GKED CCO[C@H](C)c1nc(CSCc2ccc(-c3ccccc3C#N)cc2)cs1 609917977 FQWWCIGAKFFNKH-MRXNPFEDSA-N 394.565 6.213 30 20 GKED CSCCCCNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 609928337 YKYZLYRRMSOJBE-UHFFFAOYSA-N 389.908 5.269 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](C)c1cccc(C#N)c1 610406517 CKVIOLSVJXDPKP-OAHLLOKOSA-N 389.421 5.258 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1sc(-c2ccccc2)nc1C(F)F 611185302 NMSOCKAQAQIWNA-UHFFFAOYSA-N 377.460 5.150 30 20 GKED Cc1ccc(-n2ncc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2C)cc1 613392204 MEQWXUQZGYCWAU-LJQANCHMSA-N 398.491 5.103 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 728067907 FFYBZHSTYPEGEI-IFXJQAMLSA-N 387.405 5.185 30 20 GKED COc1ccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 729160256 LWUFRZRKLFXZKF-UHFFFAOYSA-N 375.453 5.168 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)NC(=S)Nc1ccc(C#N)c(Cl)c1 731955293 QGYIHQUUBBRIOE-LLVKDONJSA-N 397.853 5.148 30 20 GKED C=CC[C@@H](NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734665372 NLTCXCZBJBISNO-QGZVFWFLSA-N 378.303 5.240 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1ccc2c(c1)COC2 742437650 WECHBCRSYIEDBT-MDZDMXLPSA-N 392.886 5.128 30 20 GKED O=C(COc1ccc(F)cc1)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746438564 WWEJZQKOPAWWPW-OAHLLOKOSA-N 396.258 5.070 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1ccc(Cl)nc1Cl 747631821 JAHYACHPCXFDCO-UHFFFAOYSA-N 382.250 5.107 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Cc2cc3c(ccc4ccccc43)o2)c1 753154160 VOIFLEGPJWVQGE-LJQANCHMSA-N 398.462 5.126 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(C)(C)C#N 753606460 KGDCTNBVZVWXLQ-JTQLQIEISA-N 383.300 5.141 30 20 GKED Cn1c(CC(=NOCc2ccc(F)cc2F)c2ccccc2)nc2ccccc21 753974692 ONCKJRLYLREPGQ-UHFFFAOYSA-N 391.421 5.015 30 20 GKED Cc1csc([C@@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 755755742 IZGLKPUVYLJERR-YWZLYKJASA-N 390.512 5.032 30 20 GKED CC(C)CSCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 756303629 XBSIZJFNFUKBIM-NRFANRHFSA-N 381.545 5.243 30 20 GKED C[C@@H](ON=Cc1cccc(F)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 760417035 QIUXVMDTRIMXQB-SNVBAGLBSA-N 380.206 5.294 30 20 GKED COc1ccc2cc(/C=C\C(=O)c3cc(Br)ncc3F)ccc2c1 762427525 VGPZFNCSJIQWRG-CLTKARDFSA-N 386.220 5.041 30 20 GKED CCOCCC1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCC1 765907947 JLGLKUZYLPGUDJ-QFIPXVFZSA-N 391.515 5.060 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@H](C)c2cc(F)ccc2F)c1C(F)F 768151562 USETVZXABAYOAV-SSDOTTSWSA-N 398.278 5.056 30 20 GKED CC(=O)N1C/C(=C\c2sc3ccccc3c2Cl)C(=O)c2ccccc2C1 778520331 UNUMGMAWGDOKQY-XNTDXEJSSA-N 381.884 5.183 30 20 GKED N#CCOc1cccc(NCc2cn(Cc3ccccc3)nc2-c2ccccc2)c1 779587564 BRMQTLSGMYNSTB-UHFFFAOYSA-N 394.478 5.113 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(OCc2ccccc2F)cc1 779989741 YXPSBIYFEFSHAA-QGZVFWFLSA-N 376.431 5.308 30 20 GKED Cc1cc(CNCc2ccc(C#N)cn2)cc(C)c1OCc1ccccc1Cl 780557799 DLIRCGTXWVQMOY-UHFFFAOYSA-N 391.902 5.092 30 20 GKED N#Cc1cc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)ccc1Cl 787093197 IDVFMUPDCLAFJY-UHFFFAOYSA-N 384.826 5.074 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC[C@@H]2SCCS[C@H]21 789460299 SDSUWFNRTVAIHG-AOIWGVFYSA-N 376.591 5.040 30 20 GKED Cc1ccc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(Cl)c1 790773916 QLTAGQDXOQBZEY-ZDUSSCGKSA-N 375.280 5.331 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CCC)[C@@H](O)c1ccccc1 791875000 KYAIHDGQSCCRKL-GGAORHGYSA-N 380.532 5.562 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 796688327 AHOHANMTTNNVTO-LPHOPBHVSA-N 376.481 5.502 30 20 GKED N#CC1(CCCOC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)CCOCC1 800081734 BWTZPCSWTBVTBL-CYVLTUHYSA-N 399.487 5.072 30 20 GKED CC(C)CN(C(=O)NCc1ccc(OCC#N)cc1)[C@@H](C)c1ccccc1Cl 806715396 GUGQRKTYEHGYJU-KRWDZBQOSA-N 399.922 5.171 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3ccc(Br)nc3)s2)cc1 811695498 HPKSGTFZBDSZOF-FPLPWBNLSA-N 385.286 5.172 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C(F)(F)c1ccccc1NC(C)=O 830897782 QMLAYQHQNLUBGZ-UHFFFAOYSA-N 386.442 5.227 30 20 GKED CSc1ccc(NN=Cc2cn(C3CCCC3)nc2-c2ccccn2)cc1 841640756 INKHZINSVGNPEQ-UHFFFAOYSA-N 377.517 5.228 30 20 GKED CC1CCN(c2cccc(NCc3cc(C#N)ccc3Br)c2)CC1 864012513 SSKWDSMXEADJER-UHFFFAOYSA-N 384.321 5.169 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 915085982 GQLGTRIDXOTKEH-IBGZPJMESA-N 391.814 5.156 30 20 GKED CCCCCCCCCCC(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 915700259 NGIIGWYGAGFHBA-HXUWFJFHSA-N 378.601 5.014 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C/c1ccc(Br)o1 917713151 HBNTYCBZCVZQJI-VQHVLOKHSA-N 399.269 5.294 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=C/C=C\c1ccco1 920362747 JWTDHUJVKWHZNI-LGZHLECZSA-N 395.871 5.227 30 20 GKED O=C(O)c1ccc(NN=Cc2ccccc2Oc2ccc(F)cc2Cl)cc1 1776013443 WWVDWOZUZKUMDD-UHFFFAOYSA-N 384.794 5.416 30 20 GKED O=C(O)c1ccc(NN=C2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1F 1776074080 GVACRIKKNRAHRK-OAHLLOKOSA-N 394.368 5.668 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(OC)c(C(=O)O)c2)cc1 1776125894 VYRVEKKPBGQLGU-ZSOIEALJSA-N 396.483 5.639 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)cc1)C(=O)O 1776469889 ZGRFIXBIDQFGPE-JDZKTDJGSA-N 378.468 5.482 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3cc(F)cc(F)c3)cc2)oc1C(=O)O 1777423199 CXVISZXICYZXEK-QPJJXVBHSA-N 398.361 5.040 30 20 GKED N#CCCn1cc(C(=O)CSc2ccc(Br)cc2)c2ccccc21 5620866 BOUJFOPQFNBKRL-UHFFFAOYSA-N 399.313 5.292 30 20 GKED N#Cc1ccccc1CSc1nc2ccccc2c(=O)n1C1CCCCC1 7329845 MGWFBROWQBRYLJ-UHFFFAOYSA-N 375.497 5.066 30 20 GKED Cc1ccccc1SCC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccccc1 59928991 ZZAYESIBOVWEND-UHFFFAOYSA-N 389.524 5.064 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnn(-c2ccccc2Cl)c1 66802198 DJEZTSNVEUYPRK-AWEZNQCLSA-N 396.903 5.172 30 20 GKED N#Cc1c(NC(=O)CSc2ccnc3ccccc23)sc2c1CCCCC2 110651387 IHEKLYYPVYMCHK-UHFFFAOYSA-N 393.537 5.168 30 20 GKED C[C@@H](c1ccncc1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116635115 MOJICYYYKYCOCQ-HNNXBMFYSA-N 391.858 5.232 30 20 GKED C[C@H](Sc1ccccn1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 134978805 WGJMNODIGDFRTK-WFASDCNBSA-N 399.928 5.216 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 150975444 LBGXZLHYGKNNDQ-AEFFLSMTSA-N 397.519 5.316 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 173474764 JMSKSZBJYFAUPL-LBPRGKRZSA-N 387.270 5.108 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 181425086 WECCFGPMLFNARZ-QGZVFWFLSA-N 385.448 5.264 30 20 GKED Fc1ccc2oc(CN[C@H](c3ccccc3C(F)(F)F)C(F)(F)F)nc2c1 183334464 WVGONKFROQMPRU-OAHLLOKOSA-N 392.274 5.379 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CS[C@H](C)c1nc2ccccc2[nH]1 189903053 NJEORXBHZYQKIE-MRXNPFEDSA-N 393.556 5.848 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(-c3ccc4c(c3)CCCO4)cc2)cc1 237509627 WDKUMRVEUFIJQY-IBGZPJMESA-N 398.506 5.259 30 20 GKED CC(C)OCc1cc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1O 290577895 XCFLJSYLCPWPMA-OAHLLOKOSA-N 399.516 5.355 30 20 GKED N#Cc1cc(NC(c2cccs2)c2cccs2)nc2ccc([N+](=O)[O-])cc12 302633760 GXPXANSTCYQOPT-UHFFFAOYSA-N 392.465 5.339 30 20 GKED OC1=Nc2ccc(/C(O)=N/[C@@H]3CC4(CCCC4)Oc4ccccc43)cc2SC1 329506732 IXWJBWYRSFZNHV-QGZVFWFLSA-N 394.496 5.522 30 20 GKED O/C(=N/[C@@H]1CCCCC12CCCC2)C1CCN(c2nc3ccccc3o2)CC1 329751393 VPHSEONATQNRAU-HXUWFJFHSA-N 381.520 5.504 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CCC[C@H](CC(F)(F)F)C1 421975910 WZDBPDQKROFNAX-OAHLLOKOSA-N 388.389 5.155 30 20 GKED CC1(C)CN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)[C@@H]1C1CC1 427597145 REQQGIIKINPOQL-OAQYLSRUSA-N 376.525 5.111 30 20 GKED N#CCSc1cccc(C(=O)NC[C@@H](Cc2ccccc2)c2ccccc2)c1 430646585 WPMYJBQNUGFWIR-JOCHJYFZSA-N 386.520 5.059 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1ccc(F)cc1 431721194 GBEYUADVOWRYEJ-MRXNPFEDSA-N 388.320 5.099 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](CC(F)(F)F)C1 433743984 FEMXBMPVVLAFCU-MRVPVSSYSA-N 393.249 5.139 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1CN(C)c1ccccc1 433765105 JEQWCASEUIUOKR-UHFFFAOYSA-N 389.499 5.179 30 20 GKED COc1ccc(-c2nc(CSCCCCC(C)(C)C#N)cs2)c(OC)c1 435884057 DHBAOTOPVNJLEX-UHFFFAOYSA-N 390.574 5.781 30 20 GKED Cc1cccc([C@@H](C)SCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 437457287 ZZZXTFRWRKEOGG-IAGOWNOFSA-N 384.570 5.822 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCC(=O)c2ccccc2)cc1F 437486508 PNXPGPMGXQZXQB-UHFFFAOYSA-N 388.398 5.091 30 20 GKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 437535880 MBQGVHIKXWDQHB-HNAYVOBHSA-N 382.533 5.038 30 20 GKED C=CCC[C@@H](NC(=O)N(CC)Cc1ccccn1)c1ccc(C(F)(F)F)cc1 441546731 VEQMIMVTQUQQPY-LJQANCHMSA-N 391.437 5.339 30 20 GKED C=CCC[C@H](NC(=O)NCCCc1ccccn1)c1ccc(C(F)(F)F)cc1 442234568 GKZJOUNEWCQGAX-IBGZPJMESA-N 391.437 5.040 30 20 GKED C[C@H]1COCC[C@H]1c1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 442691864 YSCRLWSUEWBVLC-XJKSGUPXSA-N 395.846 5.194 30 20 GKED COc1ccc(CC(C)(C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 446145426 PUUFIGLCDKQGCD-MRXNPFEDSA-N 397.544 5.232 30 20 GKED C[C@@H](CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)c1ccc(F)cc1 456563553 AVCWZGLGQWJPQP-VZJVUDMVSA-N 385.323 5.051 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(F)(c2ccccc2)CC1)c1ccccc1 458838931 MCIMQIZEQQALHP-NRFANRHFSA-N 379.479 5.092 30 20 GKED COCCC[C@@H](c1ccc(Cl)cc1)c1noc([C@H](C)c2cccc(C#N)c2)n1 463053664 JEEMVNNBKRJELQ-QRWLVFNGSA-N 395.890 5.305 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H](c3cccs3)C3CCCC3)ccc21 469276469 VCHNHIWUWRYXNW-HSZRJFAPSA-N 393.556 5.674 30 20 GKED FC(F)(F)CCN1CCO[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 469457692 VCQPEWPCOAIDTN-LBPRGKRZSA-N 395.265 5.050 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474274814 TZFLLDFOCOGCOC-OAHLLOKOSA-N 379.344 5.584 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(Cc2ccccc2C)CC1 475559080 BUQZLPAAHVAWSB-UHFFFAOYSA-N 391.559 5.197 30 20 GKED N#Cc1csc(/C=C(\CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c1 480333559 WKPASYFQMQSAQO-ONNFQVAWSA-N 394.399 5.264 30 20 GKED Cc1ccc(C)n1C1CCN(c2c(C#N)cnc3c(F)ccc(Cl)c23)CC1 480485499 UGMHYKSDQLWMTL-UHFFFAOYSA-N 382.870 5.159 30 20 GKED CCCN(C(=O)CSc1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 483475221 ZAEDLJSILHAPPG-INIZCTEOSA-N 378.497 5.396 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccc(CC)cc2)C1 484654923 PEGKDVHKXWUZEC-HSZRJFAPSA-N 392.543 5.706 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 485755556 ISJIUNXPVMDQGD-UHFFFAOYSA-N 391.521 5.136 30 20 GKED CSc1cc(O)ccc1NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 486120482 XGFJABOJVDNGPF-UHFFFAOYSA-N 391.452 5.422 30 20 GKED N#CCCN(C(=O)c1ccc(F)cc1C(F)(F)F)C12CC3CC(CC(C3)C1)C2 486549487 OBXDZOGEEQAFFX-UHFFFAOYSA-N 394.412 5.169 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487575138 OLOZUXBHIVUDDL-OXJNMPFZSA-N 388.433 5.435 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CCC2 492075809 MCZRKTLVSDOFME-HTXNQAPBSA-N 381.479 5.097 30 20 GKED N#Cc1ccccc1CSCCN[C@@H](c1cccnc1)c1cc2ccccc2o1 497518204 LAUGLBBIIBGEAX-DEOSSOPVSA-N 399.519 5.312 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1cccc(C(F)(F)F)c1 500197133 ICNCJKAXFNCIIZ-UHFFFAOYSA-N 395.274 5.428 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nnc1-c1ccccc1 505852148 RVQVKRQBMPATQZ-UHFFFAOYSA-N 392.915 5.625 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1 511696039 SZLHRUQVJWSZDR-HSZRJFAPSA-N 390.487 5.088 30 20 GKED C[C@@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1F 517518867 XJRITBKOVKGBLH-CYBMUJFWSA-N 376.456 5.267 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](C)c1ccc(C#N)cc1 518009514 WVDUOSGLCXCFHV-CYBMUJFWSA-N 376.287 5.158 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1cccc(Cl)c1Cl 518684918 RBLCJTBCGSLMEI-LBPRGKRZSA-N 394.327 5.567 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3ccsc3)c2)cc1 522322626 OKXWYXXHHWEIHE-JOCHJYFZSA-N 388.492 5.176 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)C[C@H]3CCOc4ccccc43)c2)c1 522739713 LYYJLRCMDPIREC-HXUWFJFHSA-N 398.462 5.032 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)NC(=O)N(C)Cc1cccc(C#N)c1 523452389 LSZSIDXBPDAYGR-FQEVSTJZSA-N 399.922 5.149 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 537238143 UQVUPUGHNXNNKV-QGZVFWFLSA-N 380.492 5.505 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3c(F)cccc3F)C3CCCC3)cc2)CC1 537423636 SBTCFYUUMAWGLB-UHFFFAOYSA-N 380.438 5.105 30 20 GKED N#Cc1cccc(CC(=O)Nc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 537614415 IKPHHRIKBYFOAE-UHFFFAOYSA-N 379.419 5.061 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)c2ccccc2Oc2ccccc2C#N)C1 538663313 ZTWUDBHROGKLIL-QZTJIDSGSA-N 380.513 5.097 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1ccc(C#N)cc1Cl 538808883 XSLNETCOOFMVPE-UHFFFAOYSA-N 395.915 5.555 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C#N)s1 540273906 TYDIPQAJKILHMS-UHFFFAOYSA-N 397.378 5.097 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1ccc[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543017793 WSNCUDLHEMXFGG-SBUREZEXSA-N 384.483 5.161 30 20 GKED N#Cc1ccc2ncc(CN[C@@H](CCCc3ccccc3)c3ccccc3)n2c1 551546962 DEEUMFGNVQMGAB-DEOSSOPVSA-N 380.495 5.060 30 20 GKED Cc1c(C(=O)NCc2ccc(-c3cccnc3)cc2)sc2ccc(C#N)cc12 551598716 CIQBEJVIRIRQTI-UHFFFAOYSA-N 383.476 5.073 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCOC[C@@H]1c1nc2ccccc2s1 554578986 HLBXPEMELBARNG-LJQANCHMSA-N 393.512 5.020 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cc(SC)ccc1Cl 557612091 WCLWIEKBABVTBT-UHFFFAOYSA-N 377.941 5.058 30 20 GKED CCN(C(=O)c1ncc(C#N)cc1C)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 559755103 FAWGSCRVINEQJY-DEOSSOPVSA-N 398.510 5.032 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=O)C(C)(C)c2cc(F)cc(C#N)c2)cc1F 560623062 UJMAGMKOKGAZGA-UHFFFAOYSA-N 390.405 5.069 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 579986303 YHPOOSIWRPUFFQ-UHFFFAOYSA-N 398.919 5.383 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc(-c2ccccc2)cs1 581197024 OZFIEWZZHMFPPJ-INIZCTEOSA-N 389.867 5.502 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccccc1 581343382 PNQFLBVTHCQHIE-FXAWDEMLSA-N 379.529 5.840 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCC(F)(F)C2)cc1Cl 593143275 IAHQURQBDIPCRE-QGZVFWFLSA-N 389.833 5.258 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184889 VSBHNHYLLMXJEA-KRWDZBQOSA-N 389.886 5.360 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)cn2)cc1 603764806 NCANYQQXZJWNER-CABCVRRESA-N 389.377 5.053 30 20 GKED C=CCOc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 603992210 JXLLXEJLMJSKKT-UHFFFAOYSA-N 386.476 5.202 30 20 GKED Cc1sc(NC(=O)CCCOc2cccc(Cl)c2Cl)c(C#N)c1C 604462495 ZSARZDJEJFPUMU-UHFFFAOYSA-N 383.300 5.341 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1 604511369 HWUQDFFETOZMOB-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(F)c3F)cc2Cl)cc1 608805560 NPPZYQRNESNRQC-UHFFFAOYSA-N 384.769 5.534 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)C1CCCCC1 609078865 RLQVJQHBXMRLKT-UHFFFAOYSA-N 377.488 5.242 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c1 609177760 KTBIMIOGNQUMCF-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC(C)COc1cccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609436621 QBUSUJCCDAUOCJ-KRWDZBQOSA-N 397.544 5.437 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3ccc(C#N)cc3)s2)cc1 610050883 OKXPBMFXVPOWBJ-INIZCTEOSA-N 375.497 5.132 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CC1CC1)c1ccccc1 610324155 AWXMBVCKIUUDFZ-OXJNMPFZSA-N 379.529 5.744 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 611245789 GDGHBBPGYATOEV-UHFFFAOYSA-N 389.499 5.195 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1cc2cccc(OCC)c2o1 615629591 XTCOEYCXJKSLLT-MRXNPFEDSA-N 396.462 5.429 30 20 GKED N#CCCn1cc(-c2csc(Nc3ccc(Cl)nc3)n2)c2ccccc21 726977120 NJQGXFFDGDSVNH-UHFFFAOYSA-N 379.876 5.470 30 20 GKED C#Cc1cccc(NC(=O)c2ccccc2-c2nc(-c3cccc(Cl)c3)no2)c1 727707732 VOXXMAAIFCKZQT-UHFFFAOYSA-N 399.837 5.291 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2CC(c3ccccc3)C2)cc1 728390964 PNWCEJBMSJDHKC-FOJYNEPKSA-N 381.479 5.410 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2ccccc2OCc2ccccc2)cc1 728711429 DOPAKSFWYFHTKN-VQTJNVASSA-N 386.495 5.407 30 20 GKED C[C@@H](CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccc(F)cc1 739591251 VDHXGCHYSRXZNZ-HNNXBMFYSA-N 378.472 5.236 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741842353 KCKRKFQIFFRGRX-WCIBSUBMSA-N 379.403 5.196 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CC[C@H]3c3cccc(F)c3)c2)s1 743626661 ZRMAHQZOELNURQ-FQEVSTJZSA-N 391.471 5.082 30 20 GKED O=C(C1=COCCC1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 744011191 WJQZQGYSHHVSHO-UHFFFAOYSA-N 392.505 5.301 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)s1 744352328 ZCXXUKAKZLNHPM-CMDGGOBGSA-N 394.525 5.088 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C\C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 747003249 FTRKYPSHWAWXJP-NTMALXAHSA-N 399.809 5.086 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1cccs1)C(=O)c1ccccc1 747150550 QATLJSQTCRUJTM-PGMHBOJBSA-N 389.520 5.778 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 747667933 RHRNWFHICOLWLN-CHWSQXEVSA-N 392.355 5.686 30 20 GKED Cc1cc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)cc(C)c1Br 755501931 VLPOIZQXBUJZHX-ZDUSSCGKSA-N 388.265 5.001 30 20 GKED CCCNc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 765235476 UXEHUPZYZYMSBZ-DEOSSOPVSA-N 398.510 5.486 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1Br)c1nc2ccccc2s1 766238101 PJOYXWYIWIOCCN-AWEZNQCLSA-N 399.313 5.258 30 20 GKED CC(=NNc1ccc(Br)cc1C)c1nc(C(F)(F)F)cs1 767377958 NFCPFGWIXNIVAU-UHFFFAOYSA-N 378.217 5.069 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)cc1 769791572 YBQJLSRDJQEWSV-KDOFPFPSSA-N 393.284 5.367 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccccc2N2CCCCC2)cc1 775180395 WYQLWJDDZSCATO-UHFFFAOYSA-N 389.543 5.103 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)Cc1ccccc1CC#N 777031357 AEJOTSZNFVDJPB-UHFFFAOYSA-N 393.284 5.158 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2ccc(C#N)c(Cl)c2)cc1 778630635 PSGPOZLKXOAGMY-UHFFFAOYSA-N 396.855 5.053 30 20 GKED CC(C)c1ccc(Nc2nn(CN3CCC(C)(C#N)CC3)c(=S)s2)cc1 779878312 GDNVQMVAHGFOHY-UHFFFAOYSA-N 387.578 5.124 30 20 GKED Cc1ccc(CCC2CCN(C(=O)Nc3ccccc3O[C@H](C)C#N)CC2)cc1 780671857 YLOIKOGLCGNHET-LJQANCHMSA-N 391.515 5.163 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccccc2)C2CCOCC2)cc1 782775388 SYBGWWACLFTSAE-AREMUKBSSA-N 382.507 5.483 30 20 GKED CC(C)CN(C(=S)Nc1ccc(Br)cc1)c1ccc(C#N)cc1 783730944 RPZUJNAYBJYNCK-UHFFFAOYSA-N 388.334 5.180 30 20 GKED C=CCn1c(SCc2cc3ccccc3c(Cl)n2)nc2sccc2c1=O 787488665 TZRLMRLCMYFKMT-UHFFFAOYSA-N 399.928 5.138 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570113 DGBHIAKGHAVQIM-IUODEOHRSA-N 376.522 5.184 30 20 GKED N#CCSc1ccccc1C(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1 799037825 SUYHXWRBUAIZMM-UHFFFAOYSA-N 388.895 5.057 30 20 GKED Cc1nn(-c2ccccn2)c(C)c1/C=C\C(=O)c1cc2cc(Cl)ccc2o1 802704712 VGQGNOZASDSBPV-FPLPWBNLSA-N 377.831 5.180 30 20 GKED C=C(CNC(=O)c1ccccc1CSc1nc(C)cs1)c1ccccc1 807797540 HHTZBYATTAYHDK-UHFFFAOYSA-N 380.538 5.187 30 20 GKED CCOc1ccc(NN=Cc2c(C(C)C)nn(-c3ccccc3)c2Cl)cc1 814983055 APBISORGZBICOL-UHFFFAOYSA-N 382.895 5.494 30 20 GKED C=CCC1(C(=O)N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)CCCCC1 825786645 VZEJCEUOQPRVFL-FQEVSTJZSA-N 375.940 5.139 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 887767692 TYFINJKCBOXFNB-DEYYWGMASA-N 397.466 5.277 30 20 GKED N#C[C@@H](C(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1nc(-c2ccc(Cl)cc2Cl)cs1 915103255 RAXJDNNIHFKXFS-GVARAGBVSA-N 391.323 5.729 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1sc2c(Cl)cccc2c1C 1776050845 HEBANOWOHSKZCQ-UHFFFAOYSA-N 388.876 5.406 30 20 GKED CCC(CCc1ccc(Br)cc1)=NNc1ccc(C(=O)O)c(F)c1 1776073616 DDFXRMJDMLIOKB-UHFFFAOYSA-N 393.256 5.097 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2cccc(F)c2)cc1 1776788299 ZCSXVCGGOFLZFA-JOCHJYFZSA-N 387.495 5.481 30 20 GKED C[C@@H]1/C(=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1777408055 VLXNODCGVLIGAU-ZGWJWYQGSA-N 384.431 5.347 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)C3CCCC3)cc2)CCC1 1787611669 STTGMFOCQDSBIW-NRFANRHFSA-N 380.532 5.079 30 20 GKED N#CCOc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1 11297302 NKMSBDSTBWIELP-PKNBQFBNSA-N 390.420 5.122 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)C(=O)Nc2c(C)cccc2C)n1 21621902 LOMZIOFZUIAKBP-CYBMUJFWSA-N 393.434 5.017 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccc(-c3ccccc3Cl)o2)cc1 29202776 LRXLMJGWEXFCTF-UHFFFAOYSA-N 395.846 5.160 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 32034340 KFWTUJPSCUAWMR-UHFFFAOYSA-N 376.843 5.351 30 20 GKED COc1ccccc1C(C)(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 58698250 DWPHSGZEXGAWBK-UHFFFAOYSA-N 386.451 5.275 30 20 GKED Cc1nc(-c2ccccc2)ncc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 121320287 VQYQEPVHQMBUHH-HNNXBMFYSA-N 388.496 5.099 30 20 GKED CCC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 126545021 TVTRCXUIIJIAKI-SFHVURJKSA-N 375.497 5.383 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(F)cc1OCC#N 135307211 ZHFFERXUZALYEO-KBPBESRZSA-N 389.858 5.037 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Nc1cc(C#N)ccc1OC(C)C 141923391 UVCIHYDDMODEAX-QGZVFWFLSA-N 379.504 5.216 30 20 GKED CC(C)N(C(=O)c1cccc(SCC#N)c1)c1cccc(C(F)(F)F)c1 159286362 NWJICXWGHIHUEP-UHFFFAOYSA-N 378.419 5.376 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1cccc(CC(F)(F)F)c1 173115336 ISJWEWLQAHDBOZ-ZDUSSCGKSA-N 393.434 5.687 30 20 GKED C[C@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(OCC#N)cc1 174044927 WAXOGDVUUNYNLV-RBUKOAKNSA-N 399.494 5.253 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1Br 176792232 DNPBOQGKEBQPEH-UHFFFAOYSA-N 375.291 5.016 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)Cc1cccc(OCC#N)c1)C1CC1 179430219 UTCPEEXKQCIIBN-GOSISDBHSA-N 384.479 5.037 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2)ccc1OC 180815391 SPZJGUSVPXNDCF-KDOFPFPSSA-N 392.421 5.246 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)OC2(CCCC2)C1 189967024 QDZVJZPQKHTNQD-MRXNPFEDSA-N 387.549 5.036 30 20 GKED CC(C)c1c(NC(=O)N[C@H](CCC#N)c2ccccc2)cnn1-c1ccccc1 192329833 XXOOVDLDENWCAT-HXUWFJFHSA-N 387.487 5.162 30 20 GKED COc1cc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)ccc1OCC#N 211279820 WQXTZVMHOPHVNB-TWGQIWQCSA-N 383.403 5.393 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(OC2CCCC2)c1 303382264 MVCLAYMUOLIJNI-MRXNPFEDSA-N 380.513 5.512 30 20 GKED OC(=Nc1ccc2oc(C3CC3)nc2c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 328754916 SNRIHGBYWFKOPM-MRXNPFEDSA-N 393.409 5.305 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@@H]3C[C@]34CCOc3ccccc34)n2)s1 328771229 CUVAAHIVZVWQDA-XOBRGWDASA-N 397.525 5.212 30 20 GKED OC(=Nc1ccccc1N1CCCC1)N1CCC(c2c[nH]c3ccccc23)CC1 329294709 JUQJZGRJJOUROR-UHFFFAOYSA-N 388.515 5.193 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1ccccc1 431312222 KAADULXEWRIZRN-ATZDWAIDSA-N 385.870 5.069 30 20 GKED C=CCC[C@H](NC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccccc1 435295898 DYPZWVGPTHQFDN-FQEVSTJZSA-N 394.902 5.751 30 20 GKED N#Cc1ccc(NC(=O)c2cc(F)c(Cl)cc2Cl)cc1C(F)(F)F 443880523 FWCFYEGUTDEJPC-UHFFFAOYSA-N 377.124 5.275 30 20 GKED C=C[C@@H]1OCC[C@H]1C(=O)N(c1ccc(CC)cc1)c1nc2ccccc2s1 459845585 SCGHQLUMGVAFEL-MJGOQNOKSA-N 378.497 5.115 30 20 GKED N#CCCN(C(=O)CCc1ccc(Cl)s1)C12CC3CC(CC(C3)C1)C2 460461537 QIRMAXFPPKSCMA-UHFFFAOYSA-N 376.953 5.045 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(OC4CCC4)cc3)c2)c1 463391319 LVLFLFNEXUUTPN-UHFFFAOYSA-N 398.462 5.321 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 466392577 NQKPIAVGXWDKHZ-DLBZAZTESA-N 399.560 5.062 30 20 GKED CSc1ccc(F)cc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 467703732 FDGNJTSOFQZQRB-ZDUSSCGKSA-N 389.521 5.121 30 20 GKED C=C[C@@](C)(CC)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 467972194 XKOJBRREJKUOCV-NRFANRHFSA-N 381.863 5.616 30 20 GKED CCOc1ccccc1NC(=O)[C@H](Sc1cccc(C#N)c1)c1ccccc1 468640156 VIRJFRHOVRBHQR-JOCHJYFZSA-N 388.492 5.429 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469226087 FBRFEXTWUMZKBE-CABCVRRESA-N 393.874 5.131 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(Cc2ccccc2)CCC1 473823379 LLSGUMLZQYKYME-QGZVFWFLSA-N 379.529 5.368 30 20 GKED C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)C[C@H](CC#N)c1ccccc1 476307872 UGTBVPAOZHVQPO-HOCLYGCPSA-N 387.310 5.527 30 20 GKED N#CCCCCSCCOc1c(Br)cccc1Br 479624788 FTBJUFNQRPBSFM-UHFFFAOYSA-N 393.144 5.017 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cccc(NC(=O)CCC)c1)c1ccc(F)c(F)c1 480370795 NGLRKLSLBGSAGJ-FQEVSTJZSA-N 387.430 5.142 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)c(F)c1 481606081 QFBWDYXEQAOMGS-SGTLLEGYSA-N 389.833 5.636 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)c1ccc(F)cc1 483419363 VPBSAVGDROLXIJ-UHFFFAOYSA-N 388.442 5.714 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Cl)cc3C)n2)cc1 484110866 YPNDXVJYOQHQDQ-QGZVFWFLSA-N 382.872 5.271 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(OCC(F)(F)F)c1C 486242480 WJBCTAKCXKPUHD-UHFFFAOYSA-N 381.419 5.467 30 20 GKED N#C[C@@H](NC(=O)Cc1csc2ccccc12)c1c(Cl)cccc1Cl 499839629 QEEGHENHMOVSSK-OAHLLOKOSA-N 375.280 5.132 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2ccccc2Cl)n1)c1ccccc1Cl 499944123 DIZJNYUVRMUOIQ-HNNXBMFYSA-N 388.279 5.112 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccccc1OCc1ccccc1 502879889 FEAPWUKWBWOXQU-GOSISDBHSA-N 385.467 5.214 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ncc(-c4ccccc4)s3)CC2)cc1 504657433 FJTRQTHCRSFFQP-UHFFFAOYSA-N 386.480 5.003 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)on1 504756407 NHZIZACCOHMUTE-QGZVFWFLSA-N 379.847 5.359 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCc2ccc(F)cc2)c1)c1ccc(C#N)cc1 505311665 RZKWWTGUYGLFGR-INIZCTEOSA-N 389.430 5.159 30 20 GKED Cc1ccccc1C1(CNC2CCC(C#N)(c3ccccc3)CC2)CCOCC1 507653996 PMAFXHHWTFERRE-UHFFFAOYSA-N 388.555 5.037 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@@H](C)c2ccccc2Cl)cc1 510349836 DJNWCTXBFAYWOD-INIZCTEOSA-N 397.906 5.037 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)c(C(F)(F)F)c1 514697976 WRVYRYVVEWYDET-NRFANRHFSA-N 384.376 5.595 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCc1ccccc1OC1CCCC1 515910872 JHDPQRAEOGYOEQ-UHFFFAOYSA-N 391.515 5.001 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 517530547 WSCIETCPNWTKEU-GOSISDBHSA-N 381.545 5.833 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2ccc(F)cc21 520197077 SHLIQNFCFBBTAU-RHSMWYFYSA-N 399.491 5.255 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 521791905 AEMZDPMNNKWXLI-UHFFFAOYSA-N 394.883 5.978 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccoc1C 525110641 ADIFTHWBTDEZCZ-INIZCTEOSA-N 395.528 5.519 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)N[C@H](C)c1ccc2ccccc2c1 525116296 SZLJGFIVSPOLQT-HUUCEWRRSA-N 378.472 5.209 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)oc1C 532013796 VPDIKIXYPXTIPE-ZDUSSCGKSA-N 391.279 5.817 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)c1ccccc1 534647680 SGFMAUFKXRYJNW-PKOBYXMFSA-N 376.525 5.362 30 20 GKED N#CCc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)cc1 534735696 HWKUKEAKXJZIRD-UHFFFAOYSA-N 395.465 5.126 30 20 GKED N#Cc1cc([N+](=O)[O-])cnc1N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 538006101 INELQOQIPPJLRS-HNNXBMFYSA-N 396.756 5.097 30 20 GKED CCOCc1cccc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1 538027475 NKDFCJKFSDVGSZ-UHFFFAOYSA-N 385.467 5.083 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CC1 540296485 SHKZYUCAWQDNTL-IKNBJCKTSA-N 398.909 5.303 30 20 GKED C=CCn1c(SCc2cnc3ccccc3c2)nnc1-c1ccc(F)cc1 540812577 VZPMPFKIOLJLHK-UHFFFAOYSA-N 376.460 5.111 30 20 GKED C[C@@H](N[C@H](C)c1cnc2ccsc2c1)c1ccc(-c2cccc(C#N)c2)cc1 541175791 DWEGHWODKIMVFA-IAGOWNOFSA-N 383.520 6.247 30 20 GKED N#CCC1CCN(C(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)CC1 542908718 PLPBOWNPLXGLFG-HXUWFJFHSA-N 384.932 5.326 30 20 GKED CCC1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 543037338 PSTHKHUXSXAAAZ-IBGZPJMESA-N 397.906 5.076 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cncnc3-c3ccccc3)cc2)cc1 544021037 GYPFYTFEEYPXEU-UHFFFAOYSA-N 392.418 5.060 30 20 GKED Fc1cccc([C@H](NCc2ccc(OCC(F)(F)F)cc2)C(F)(F)F)c1F 544124110 RYPGEVPDTAAGRT-HNNXBMFYSA-N 399.281 5.299 30 20 GKED COc1cccc(NC2CCN(Cc3ccc(-c4ccccc4C#N)cc3)CC2)c1 554176326 LKLFINRGFNMIJI-UHFFFAOYSA-N 397.522 5.310 30 20 GKED N#CCCC[C@H](N[C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 556205772 MQUSHLLVLYNHCL-ILWGZMRPSA-N 377.488 5.331 30 20 GKED C=CCOc1ccc(CN[C@H](Cc2cccnc2)c2ccc(Cl)cc2)cc1 556914084 YHXCEEVADLHXNW-HSZRJFAPSA-N 378.903 5.373 30 20 GKED FC(F)(F)c1cc(N[C@@H]2CCO[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 558113096 DZHUZIDBPJQONB-MWLCHTKSSA-N 381.238 5.246 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 559861122 WDODBKOEKBWQKR-IIBYNOLFSA-N 393.531 6.343 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ncc(-c4ccccn4)s3)c2)cc1 561023670 QXXZUKZQPPHAPN-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(NC(=O)CCCCOc2cccc(C#N)c2)ccc1-c1ccncc1 561088869 CIXOQWRGKNLWCI-UHFFFAOYSA-N 385.467 5.117 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(s1)CCCCC2)c1cccc(C(F)(F)F)c1 573311663 OOIYPZWEUVPZCP-OAHLLOKOSA-N 378.419 5.030 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 573573853 QPEXDEUKRVSEIA-ZVZYQTTQSA-N 383.492 5.145 30 20 GKED C=CCC[C@H](Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2)c1ccco1 583219788 HGYSSNRDRWBNNT-AWEZNQCLSA-N 378.444 5.103 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1OC(F)F)c1ccc(Oc2cccnc2)cc1 584787783 VIUFOPKIGHGMDI-OAHLLOKOSA-N 395.409 5.198 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)CCCCCC#N)nc1-c1ccccc1 588377069 PVOBIOLWZIGXNR-LJQANCHMSA-N 379.504 5.603 30 20 GKED CC[C@@H](C#N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 593487493 QBBIPIIILDCGHX-HNNXBMFYSA-N 378.451 5.220 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 609171788 BZRAGNFKAXPLIP-YADARESESA-N 384.479 5.140 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609428431 GTXFOPYHTBCHNF-DLBZAZTESA-N 382.529 5.610 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 609434414 HEDUQFVIDPXLRT-XMMPIXPASA-N 397.478 6.028 30 20 GKED CC(C)Oc1ccccc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609600934 FBFSXFCVSQSWDV-UHFFFAOYSA-N 388.427 5.177 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609641292 IEIRJPJRCWVLOC-KRWDZBQOSA-N 388.442 5.110 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1C 610199292 NFSVLFSXVSBYTA-HSZRJFAPSA-N 397.478 5.340 30 20 GKED COc1cc(CN[C@@H](C)c2cccc(C#N)c2)ccc1OCc1cccs1 610345058 RBOSNQUNNZZIIZ-INIZCTEOSA-N 378.497 5.058 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)C1 612306373 BPSFKSNOWXQWRA-NRFANRHFSA-N 394.475 5.260 30 20 GKED C=CCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 613319690 LIEBOHOMFFBBEE-GOSISDBHSA-N 394.883 5.518 30 20 GKED CCCCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@@H](C)c1ccc(C)o1 619067905 BKBXWCWNBKGISE-IBGZPJMESA-N 391.519 5.124 30 20 GKED C[C@H](c1ccc(C(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)cc1)C(F)(F)F 622566706 WATRRGYQHXDSFE-PSLIRLAXSA-N 393.302 5.367 30 20 GKED C=CCN1C(=O)c2ccccc2N[C@H]1c1csc(-c2ccc(Cl)cc2)n1 624173110 GOWGLCUJBLZTQS-GOSISDBHSA-N 381.888 5.216 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1coc2ccc(F)cc12 648239707 WQLFQZTYSPRBII-IUCAKERBSA-N 397.290 5.211 30 20 GKED C=CCc1cc(CN[C@H](c2ccccc2)c2ccc(OC)cc2)cc(OC)c1O 678858716 OYZXSHDXBABSBR-XMMPIXPASA-N 389.495 5.017 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(-c2ccccc2)cc1)c1nc2cc(F)ccc2s1 730417719 QEVIJCCRDMMNMM-IBGZPJMESA-N 386.451 5.521 30 20 GKED N#C[C@H](C(=O)c1sccc1SC(F)F)c1nc2ccccc2n1C(F)F 730689628 IBVQDWUFJJINMD-MRVPVSSYSA-N 399.394 5.298 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(Cl)cc2)o1)c1ccc(C(F)(F)F)nc1O 731564970 WSHNDPOEILUOJN-VMPITWQZSA-N 393.748 5.616 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2N2CCCCC2)cc1 733216966 CDZWVKRFSHYVJA-XMMPIXPASA-N 395.506 5.585 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(Cl)c3)s2)c1 733801384 YXUQTXOHOVYUTB-IBGZPJMESA-N 396.943 6.039 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccccc2C)cc1 734964558 CPCFEZZQANDARM-AQOAWAETSA-N 376.500 5.350 30 20 GKED C=CCOc1ccc(OC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc1 742863645 AGPBPOTVZQJPPL-UHFFFAOYSA-N 383.831 5.098 30 20 GKED C#Cc1cccc(NC(=O)N(C)[C@@H](C)c2ccc(-c3ccccc3OC)cc2)c1 743084942 SJDNHEOFUYXELD-SFHVURJKSA-N 384.479 5.568 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCOc2cccc(Cl)c2Cl)n1 747193702 NNMZJXWCZAZSOC-LBPRGKRZSA-N 397.327 5.609 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(SC)c(Cl)c2)c1 747572884 FAARRWKNXYUZBN-HNNXBMFYSA-N 389.908 5.065 30 20 GKED N#Cc1ccc(NC(=S)Nc2cc(CCc3ccccc3)ccn2)cc1Cl 751919996 IGLNNSTVICWUMW-UHFFFAOYSA-N 392.915 5.201 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(OC)cc1 752495994 PINGQDXZQLXSIW-DYVFJYSZSA-N 382.460 5.204 30 20 GKED N#Cc1ccccc1COc1cccc(C=NOc2ccccc2C(F)(F)F)c1 754710872 YAGJJXPGNSOZRD-UHFFFAOYSA-N 396.368 5.569 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 756277012 VLCUKYDWZBYNNI-ABAIWWIYSA-N 388.464 5.179 30 20 GKED CC(C)(C)OC(=O)N1CCc2cccc(/C=C/C(=O)c3ccc(F)cc3F)c21 757530630 WPRBSEJDBWDDKQ-JXMROGBWSA-N 385.410 5.159 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)c1ccc(Cl)c2ccccc12 765255318 UZHNDVAAMSBEGX-HUUCEWRRSA-N 393.874 5.667 30 20 GKED COc1cc(COC(=O)c2cn(CCCC#N)c3ccccc23)ccc1SC 769545153 SMZKJOCXBYWPHG-UHFFFAOYSA-N 394.496 5.033 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 774446613 CRMYSBXYZBFSOO-FPOVZHCZSA-N 388.433 5.627 30 20 GKED CC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cc(F)cc(Br)c1 776163258 GUNOPHDSKXHFPZ-BFUOFWGJSA-N 391.284 5.292 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3ccc(F)cc3C)o2)C(=O)c2ccccc2C1 778520388 VRUDAEGXWZVTPO-LDADJPATSA-N 389.426 5.023 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2ccccc2)c2ccc(OC)cc2)c1 779103974 GMFRXHZDOTVWSY-RDGATRHJSA-N 386.495 5.255 30 20 GKED CN(C)c1ccc(CNc2cccc(OCCCC#N)c2)c(C(F)(F)F)c1 792848212 IRCMPGPMRAPCJG-UHFFFAOYSA-N 377.410 5.066 30 20 GKED C[C@@H](NC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 797006980 ZBBGZPAUZOODLR-ZHRRBRCNSA-N 384.907 5.061 30 20 GKED CN(C(=O)Cc1ccc(OCC#N)cc1)[C@H](c1ccc(Cl)cc1)C1CCCC1 798542707 DXENAOYOOMIZAY-QHCPKHFHSA-N 396.918 5.175 30 20 GKED Cc1cc(C)c(CNc2ccccc2O[C@H](C)C#N)c(OCc2ccccc2)n1 809190695 QMIJZDYLINAJPZ-LJQANCHMSA-N 387.483 5.180 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccncc1 812047560 HXEOJKBMGYVORF-HKUYNNGSSA-N 390.314 5.456 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813218584 XVLBDCMKCPCSRO-MAUKXSAKSA-N 396.796 5.034 30 20 GKED C=CCC(C)(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 814218869 IEAVMQXFACZTBW-NRFANRHFSA-N 389.543 5.084 30 20 GKED N#CCSc1ccccc1C(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1 899895066 GLKJKYBYARWRIQ-UHFFFAOYSA-N 391.521 5.167 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccsc1 914520449 KTBPXVPAOFITOE-VMPITWQZSA-N 376.456 5.314 30 20 GKED Cc1ccc(OCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 915085804 ONWYAJQSFSLMEY-XMMPIXPASA-N 384.479 5.367 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2ccccc2Cl)cc1 915088436 RNRHYWZUEJJHRM-IBGZPJMESA-N 392.911 5.726 30 20 GKED CCCCCCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)cc1 916627475 XFKMGJDJPQQPSZ-IBGZPJMESA-N 375.472 5.022 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3ccc(-n4cccc4)cc3)n2)cc1 916974007 CSALSLZSKCHTQB-NRFANRHFSA-N 397.503 5.328 30 20 GKED N#C[C@H](C(=O)Cn1ccc2ccccc21)c1nc2cc(C(F)(F)F)ccc2s1 918491803 INXVEXGSCYKDGO-CQSZACIVSA-N 399.397 5.146 30 20 GKED COc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 920109993 ITWWVENSRAUPKO-HNAYVOBHSA-N 376.481 5.107 30 20 GKED Cc1c(NN=C2CCCc3cc(SC(F)F)ccc32)cccc1C(=O)O 1776086861 SPBZZNDPKJLCEO-UHFFFAOYSA-N 376.428 5.160 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1csc(-c2ccc(F)cc2)n1 1776784528 ZDALBPIEEDJNLF-QGZVFWFLSA-N 378.513 5.243 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@@H](CC(=O)O)c2cccc(F)c2)cc1 1776785910 QPWXTBLDWORAKR-QFIPXVFZSA-N 399.506 5.675 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)cc1F 1777673189 DVHWZULUMZFNDE-KPKJPENVSA-N 378.371 5.051 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(Br)cc(C(F)(F)F)c2)c1 1777684963 PKLFPBDHLXWJMC-SNAWJCMRSA-N 399.162 5.062 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(-c3cccs3)n2)n1 10399219 FGCZFEDBHYUJJB-UHFFFAOYSA-N 397.472 5.758 30 20 GKED C=CCOc1ccc(/C=C(\Cl)c2nc3sc4c(c3c(=O)[nH]2)CCCC4)cc1 16440179 SICOMFVIYKIQNT-VBKFSLOCSA-N 398.915 5.165 30 20 GKED COc1cccc(NC(=O)[C@H](Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)c1 28373755 USUWBBZQOYSTCQ-HSZRJFAPSA-N 399.494 5.288 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2s1 41502576 GXCIGIUWFHMZSF-AWEZNQCLSA-N 375.478 5.218 30 20 GKED CCn1c(C)cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1C 51677663 ZKHRDCVMGRILAS-CQSZACIVSA-N 391.418 5.243 30 20 GKED N#CCC[C@H](NCc1ccc(OC(F)F)c(Br)c1)c1ccccc1 92568142 ZBNKGVXQTWFXHF-INIZCTEOSA-N 395.247 5.185 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)c3ccc(F)cc3)n2)cc1 103336574 DZLQOUWSEAFANE-GOSISDBHSA-N 394.471 5.112 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)cnn1-c1cccc(Cl)c1 108200092 FQALKGURSZUBIC-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)on1 136979975 JBLNAJSVMMOESK-ZDUSSCGKSA-N 381.432 5.127 30 20 GKED C=CCn1c(SCc2sccc2Br)nnc1-c1ccoc1C 139686928 DBSYADFESKTBNL-UHFFFAOYSA-N 396.335 5.149 30 20 GKED COc1ccc2cccc(CC(=O)Nc3ccccc3SCCC#N)c2c1 153636933 BKUPNEUMUHGZCS-UHFFFAOYSA-N 376.481 5.035 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cc12 173137295 ZHJYKCFZNWBQRS-ZDUSSCGKSA-N 398.557 5.262 30 20 GKED CCS[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 176993236 ZNPFBCDJCKBMAM-ZMSDIMECSA-N 377.579 5.267 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)Nc2ccccc2O[C@H](C)C#N)cc1 180075552 JCUYBJKIRKLHES-HZPDHXFCSA-N 383.517 5.361 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccn(-c2c(F)cccc2F)n1 180589903 JFULSFLQWHZAPC-CQSZACIVSA-N 384.455 5.157 30 20 GKED Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccccc1S[C@H](C)CC#N)CC2 187132460 CZJCCVBXEVCDPS-QGZVFWFLSA-N 379.529 5.288 30 20 GKED COc1ccc(-n2c(SCCCCC#N)nnc2-c2ccc(Cl)cc2)cc1 195561480 PPRAQIXUGSZMKL-UHFFFAOYSA-N 398.919 5.382 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1ccc(F)cc1F 211156312 NCMGGUYBTOOFLY-KTKRTIGZSA-N 386.829 5.376 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(-c3ccccc3)cc2)ccc1OC 236896567 UBLUTQWVQCPJST-HSZRJFAPSA-N 386.495 5.333 30 20 GKED N#Cc1ccc2nc(NCc3cccc(NC(=O)c4ccc(F)cc4)c3)ccc2c1 301974942 LFWMCFMGPMGGOR-UHFFFAOYSA-N 396.425 5.110 30 20 GKED CN1CCC(O)=Nc2cc(/C(O)=N/C3CC(c4cccc(Cl)c4)C3)ccc21 328695460 GKFLLHWVOXRXFD-UHFFFAOYSA-N 383.879 5.019 30 20 GKED CC(C)(C)c1nc2cc(N=C(O)N3CCC(Cc4cccnc4)CC3)ccc2o1 329128822 VOZZSFZLAZTUCK-UHFFFAOYSA-N 392.503 5.021 30 20 GKED CC(C)Cc1noc(-c2cc(Cl)ccc2N=C(O)[C@H]2CCC(=O)[C@@H](C)C2)n1 329368885 JIAHQEOLRSVXJB-STQMWFEESA-N 389.883 5.182 30 20 GKED Cc1csc(Sc2c(Cl)cccc2N=C(O)[C@@H]2C[C@]23CCOC3)n1 329659372 NTFSVUPEROPUFM-GTNSWQLSSA-N 380.922 5.271 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c2[C@@H](C)C1 411010955 LIFHXCMIAYUSKE-UWVGGRQHSA-N 389.864 5.119 30 20 GKED C=CCC1(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CCOCC1 424863848 JSCHYYOMONSYMP-UHFFFAOYSA-N 378.497 5.021 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)CCCCc1nc2ccccc2s1 425121331 BWZZPDNORPAFQT-INIZCTEOSA-N 377.513 5.100 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc(F)ccc3Cl)c2)cc1 431697721 JHNNTFQCKPBHLQ-UHFFFAOYSA-N 394.833 5.376 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 432007475 NIINZAFFYGMIFM-SFHVURJKSA-N 393.874 5.497 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4nc(C)sc4c3)n2)cc1 433108071 FLFBAHJXRBXEQF-INIZCTEOSA-N 389.505 5.527 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1ccc(SCc2cccnc2)cc1 433222834 XOJVETQWTJWRMX-HXUWFJFHSA-N 387.508 5.085 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 433359765 CCGWMPZFDKKYCZ-KRWDZBQOSA-N 391.858 5.238 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(C#N)cs3)cc2Cl)cc1 437573570 BFQDSFFPXSAQTJ-UHFFFAOYSA-N 379.828 5.189 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1Cl 437901072 JFBGJDYZWHXBQA-UYAOXDASSA-N 397.906 5.431 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)[C@@H]1Oc2ccccc2[C@H]1C 438645287 XMSHWPKEQKGQGT-WSOZGMELSA-N 395.528 5.156 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)cc2)cs1 442037237 XAIOTEKJOAEQCC-OAHLLOKOSA-N 387.386 5.022 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc4ccccc4o3)o2)cc1 442671150 FYQZQOIMCKOCBP-KRWDZBQOSA-N 384.435 5.875 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)N[C@H](c1cc(F)ccc1F)C(F)F 447720857 SXYUCUISWCJAQJ-XJKSGUPXSA-N 393.302 5.123 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)cc1 454336884 AGWZVNUSNBPZEF-LJQANCHMSA-N 393.878 5.041 30 20 GKED Cc1c(Br)cccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 463743135 AKZQSNULEICHIB-AWEZNQCLSA-N 398.087 5.059 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1Cl 470569220 HQXHRQVFPALNJD-UHFFFAOYSA-N 381.690 6.192 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(CCc2ccccc2F)C2CCCC2)cc1 475376994 NOCUPMCSCVLDQM-UHFFFAOYSA-N 378.491 5.254 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccco1)N(CC)CC 475554486 NIXYPQGXUKUMKA-HXUWFJFHSA-N 383.536 5.336 30 20 GKED Cc1cc(Br)cc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 486356044 UADVTADSZGJLIM-OALUTQOASA-N 398.304 5.061 30 20 GKED N#CCCC[C@H](NC(=O)Cc1csc(-c2cccc(F)c2)n1)c1ccccc1 487519578 ZVOFXLMWQDMZJS-FQEVSTJZSA-N 393.487 5.043 30 20 GKED N#CCCC[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccccc1 487543630 PPHWZWGNWRAIIW-HXUWFJFHSA-N 386.948 5.764 30 20 GKED CC(C)CCn1ncc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1C(C)C 487599320 ASKRBIPFTSRVMF-UHFFFAOYSA-N 393.535 5.121 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 487600850 HAJXBNYADAIFMA-QKLQHJQFSA-N 387.310 5.648 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)c1cc(F)ccc1F 489654977 CQAVVTBJQBEYAO-AWEZNQCLSA-N 387.455 5.175 30 20 GKED N#Cc1csc(CN[C@H](CC2CC2)c2cc(F)cc(Br)c2)c1 495169458 DTXJWWNXFFKPJO-QGZVFWFLSA-N 379.298 5.152 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cccc(-c4cscn4)c3)n2)c1 501167279 DLJSLEKTQDOQOA-UHFFFAOYSA-N 388.477 5.058 30 20 GKED CC[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 501455148 ZTOYPEHKMIJFDP-DEOSSOPVSA-N 384.479 5.464 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cc(C(F)F)ccc3Cl)CC2)cc1 502640471 AYBZTGVLAVWXHL-UHFFFAOYSA-N 387.817 5.470 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCC(=O)c3cccc(F)c3)c2)cc1 502819640 KDKKUXBASYTFEH-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 503138516 KGTIYSSVTMHTPU-VQIMIIECSA-N 380.513 5.085 30 20 GKED Cc1ccccc1[C@]1(F)CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 505340688 ZBJKKOLMDYFFPX-JTSKRJEESA-N 397.519 5.492 30 20 GKED CC1(C#N)CCN(C(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)CC1 507828937 UXODGJPKYSTSPV-IBGZPJMESA-N 384.932 5.326 30 20 GKED Cc1ccc(Cl)cc1NC(=O)C[C@H](C)Nc1cccc(OCCCC#N)c1 513207361 XYTFOGVPKSBMPG-INIZCTEOSA-N 385.895 5.160 30 20 GKED C=CCN(C(=O)c1cncc(C(F)(F)F)c1)c1nc(-c2ccccc2)cs1 515473974 GVWLHYDBEKITEJ-UHFFFAOYSA-N 389.402 5.057 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ncsc3-c3ccccc3)cc2)ccn1 517448209 FLEVQWUHSREUEX-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cnn1C(C)(C)C 519507075 NDQJAAFXZALHAF-UHFFFAOYSA-N 388.471 5.117 30 20 GKED C=CCOCC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 521525844 VRNKGQIDQYGKAS-UHFFFAOYSA-N 393.295 5.470 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccc(C#N)cc1F)c1ccc2ccccc2c1 525116297 SZLJGFIVSPOLQT-LSDHHAIUSA-N 378.472 5.209 30 20 GKED N#Cc1ccc(NC(=O)c2oc3ccccc3c2COc2ccccc2)cc1C#N 525349927 CMAJURLAPIHWCI-UHFFFAOYSA-N 393.402 5.007 30 20 GKED C[C@H](NCc1ccc(Oc2ccccc2C(F)(F)F)nc1)c1ccc(C#N)cc1 540593848 UEMNGPDPUVKZFK-HNNXBMFYSA-N 397.400 5.615 30 20 GKED C[C@@H](NC(=O)N[C@@H]1CCCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 542076822 QLWAERAWLKJVNL-FOIQADDNSA-N 383.442 5.163 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1F 543320601 MUPQMUFEXVUPLX-YLJYHZDGSA-N 399.441 5.056 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCc2c(ccc(Cl)c2Cl)C1 549251304 HOLYMAWUHYBDOJ-UHFFFAOYSA-N 391.302 5.012 30 20 GKED FC(F)(F)c1cc(N[C@H]2CCO[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 558113093 DZHUZIDBPJQONB-GXSJLCMTSA-N 381.238 5.246 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 564517381 MXWQXLLYIJNZMA-MRXNPFEDSA-N 389.480 5.006 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)NCC(C)(C)CCC#N)cc2)cc1 569034228 HQMFUDVIAUCQHP-UHFFFAOYSA-N 381.476 5.329 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CSc3ccccc3Cl)cc2)ccn1 571376510 AQSNGXLMRASBNT-UHFFFAOYSA-N 395.871 5.130 30 20 GKED N#CCCC[C@@H](NCc1cc(Cl)ccc1Br)c1ccccc1 583950661 NGZCZXVFZVSYLD-GOSISDBHSA-N 377.713 5.627 30 20 GKED N#C[C@H](C(=O)c1cnc(C2CC2)s1)c1nc2cc(C(F)(F)F)ccc2s1 591862576 WOJSAWLDXATEAZ-SNVBAGLBSA-N 393.415 5.139 30 20 GKED Cc1cccc(-c2nc3ccc(F)cc3n2C(C)C)c1NC(=O)[C@@H](C)CC#N 598815361 QBCUDKLQDCISHF-HNNXBMFYSA-N 378.451 5.220 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc(Br)ccc1Cl 603525468 GLRYBVDMTGLCAC-UHFFFAOYSA-N 391.696 5.025 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)c1C 604044552 WQSOCUUPEZYNIP-IBGZPJMESA-N 399.494 5.193 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nc2ccccc2c1=O 605364577 XMISONLLZMZEMR-OAHLLOKOSA-N 389.480 5.091 30 20 GKED CCCn1ccc2cc(NC(=O)c3occc3COc3cccc(C#N)c3)ccc21 608807026 GGHNVIPRXJMQOB-UHFFFAOYSA-N 399.450 5.347 30 20 GKED CC[C@](C)(C#N)NC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 609071931 VLRBZLFYRPFYJG-HSZRJFAPSA-N 393.918 5.084 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccccc1SC[C@@H](C)C#N 609377317 TUACAHKMGTWXEK-DLBZAZTESA-N 382.529 5.469 30 20 GKED COc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 609436608 BMJSNKJTKCQZAS-INIZCTEOSA-N 397.544 5.189 30 20 GKED CC[C@H]1c2ccccc2CCN1CC(=O)Nc1ccccc1S[C@H](C)CC#N 609625728 UKNXWQQZTJYTNG-UTKZUKDTSA-N 393.556 5.029 30 20 GKED Cc1cc(F)cc2c(N(C)C[C@@H]3CCCO[C@@H]3c3ccccc3)c(C#N)cnc12 610275069 ZKQGOJGNIVOTBD-MHECFPHRSA-N 389.474 5.158 30 20 GKED CCn1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc21 613403805 VDBCWIWDHRTQTD-CQSZACIVSA-N 379.872 5.414 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc2ccccc21 617898143 MPIABFFRFCDLLI-CYBMUJFWSA-N 399.397 5.297 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622847631 APSRBOFZRGEEHW-JOYOIKCWSA-N 389.286 5.144 30 20 GKED Cc1cc(C)cc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 727980458 MEZJXTNVGUAEKX-UHFFFAOYSA-N 387.508 5.563 30 20 GKED CCCO[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 731108229 INUJUORBAUQTJU-GOTSBHOMSA-N 391.515 5.155 30 20 GKED C#CCOc1ccc(NC(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)cc1 731112348 IJOAJYBCGQSNDM-MRXNPFEDSA-N 391.496 5.013 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@](C)(C#N)C3CCCCC3)cs2)cc1 734240863 VVTCREWUFGBMAP-HSZRJFAPSA-N 395.572 5.455 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccncc1 734460934 SVNNYYJUKSEPBM-HXUWFJFHSA-N 380.394 5.199 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 735457953 LXWMJDHOOIIUQD-NSHDSACASA-N 388.254 5.048 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\C[C@H](O)c1cc(Cl)cc(Cl)c1 735618857 GOLNYHRJYHVIKG-DUCFUJNISA-N 379.070 5.158 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccccc2OCc2ccccn2)cc1F 741847917 SPUJNTWJTMCHMY-LUAWRHEFSA-N 379.456 5.418 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@@H](C#N)C(=O)NC3CCCCC3)o2)cc1 744027578 YXBUROKOMNVCDT-LJQANCHMSA-N 392.499 5.015 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(-c4cnn(C)c4)c3)n2)cc1 744035007 MCOIXBHINNUQEK-FQEVSTJZSA-N 398.491 5.009 30 20 GKED C=CCOCCCC(=O)O[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 744149617 IDGDLBXDBMHLHJ-AWEZNQCLSA-N 379.909 5.359 30 20 GKED C[C@H](ON=Cc1cccc(F)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 744445489 PYLGWGDKISLAPB-NSHDSACASA-N 379.313 5.006 30 20 GKED COc1ccc(CNC(=O)Nc2ccc(SC(C)(C)C)cc2C)cc1C#N 747274487 HQSQNORFJAHMBM-UHFFFAOYSA-N 383.517 5.088 30 20 GKED CC(=NNc1cccc(Br)c1)c1sc(-c2cccnc2)nc1C 747611423 MEAGZXVQALJLEF-UHFFFAOYSA-N 387.306 5.112 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(CC#N)c3ccccc3)c2c1 747653187 WEWHTECQRCDPQV-UHFFFAOYSA-N 377.447 5.381 30 20 GKED CC[C@H](NC(=S)N(Cc1ccccc1C#N)C1CCCC1)c1cccs1 747706914 SPCXDHKFQXUXQY-IBGZPJMESA-N 383.586 5.390 30 20 GKED CC(C)C[C@@H](C)OCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 756241803 LITVYMSIEANACD-TZMCWYRMSA-N 398.450 5.333 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C 757936713 LUIDBGJZINXEBE-NRFANRHFSA-N 395.503 5.157 30 20 GKED COc1cc(C(=O)/C=C\c2cccc(-c3cccnc3)c2)ccc1OC(F)F 768497390 UYYJVSWNAIKQBF-CLFYSBASSA-N 381.378 5.255 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(OCc3cccc(F)c3)c2)cc1 770497037 PFTKRSLSSOXGHS-QGZVFWFLSA-N 376.431 5.308 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C[C@H](Cc1ccccc1)c1ccccc1 780165010 PCSKJGOMVWGILQ-KNQAVFIVSA-N 384.479 5.333 30 20 GKED O=C(O)c1csc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c1 782199085 DGVWSGIIJIENKU-LFIBNONCSA-N 391.473 5.480 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)NCCCCC(F)(F)F)cc1 794972690 QJZUIIUUPDKWMJ-UHFFFAOYSA-N 393.434 5.370 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2cc(C#N)ccc2Cl)cc1 796150972 NXYWUNDMENMYRS-UHFFFAOYSA-N 396.855 5.053 30 20 GKED N#C[C@H](C(=O)C(Cc1ccccc1)Cc1ccccc1)c1nc2ccccc2o1 798818083 LZKOZXYFSLSZIA-OAQYLSRUSA-N 380.447 5.106 30 20 GKED N#C[C@@H](C(=O)C1(C(F)F)CCCC1)c1nc(-c2c(F)cccc2F)cs1 808981988 ZWFBEKMNOAHKDX-JTQLQIEISA-N 382.382 5.090 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2cccc3cccnc23)cc1OCC 809842885 IHPOMIQDEDKKMV-UHFFFAOYSA-N 398.890 5.626 30 20 GKED COc1ccc2c(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)coc2c1 915087076 PJCPWSNLKLMAES-HSZRJFAPSA-N 396.446 5.278 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)cc1Cl)c1nc2ccccc2s1 915098566 XWVKIZVCKLDZAU-CYBMUJFWSA-N 375.280 5.412 30 20 GKED COc1cc(C=NN(Cc2ccccc2)Cc2ccccc2)cc(Cl)c1O 916367661 JXBWWYTVKWRWBB-UHFFFAOYSA-N 380.875 5.091 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)Nc3cccc(OCC#N)c3)cs2)cc1 916409507 GJBSILRBHDZOCI-UHFFFAOYSA-N 377.469 5.088 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(SC)ccc2C)cc1 916955478 RBGLIIBEWYBAEI-XOBRGWDASA-N 380.513 5.192 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@H](C)Sc1ccc(Cl)cc1 920102352 SFCTYONETFVXHI-GUYCJALGSA-N 396.899 5.202 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3ccc(F)cc3)n2)cc1 921136832 PESKDDDHAZXYNL-LIRRHRJNSA-N 394.471 5.013 30 20 GKED Cc1sc2ncn(N=Cc3ccc(Cl)c(F)c3)c(=O)c2c1-c1ccccc1 921256194 JNGPRQOUZINCBO-UHFFFAOYSA-N 397.862 5.108 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033490 PXLSUXBVXTZYAG-UHFFFAOYSA-N 394.858 5.550 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Oc2ccccc2)c(F)c1 1776073636 FKHULPNYBKTAQB-UHFFFAOYSA-N 382.366 5.291 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NOCC1CCC1 1776093332 KYLLYKDTSJXFJM-UHFFFAOYSA-N 381.472 5.089 30 20 GKED C=CCOc1ccc(CN[C@@]2(C(=O)O)CCC(C)(C)c3ccccc32)cc1Cl 1776185598 ATHIVUFTOWKWHN-QHCPKHFHSA-N 399.918 5.046 30 20 GKED C/C(=C\c1ccc(-c2cccc(C(=O)O)c2)s1)c1nc2ccccc2n1CC#N 1776197306 ZHAGMWUJIANJIT-FYWRMAATSA-N 399.475 5.547 30 20 GKED CC(C)(C#N)c1ncc(/C=C\c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)s1 1776230597 QWUAAPYWOSXHRI-FPLPWBNLSA-N 399.472 5.075 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2)c1)C(=O)O 1776470794 IQQTVOWKRJWEMT-LMRWQKIVSA-N 378.449 5.163 30 20 GKED CCCCCCCOc1cccc(CNC[C@]2(C(=O)O)CC3CCC2CC3)c1 1776788654 GWQKWRMHDXQWOB-NFDBJIOVSA-N 387.564 5.407 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1Oc1cccc(F)c1 1777436280 DFNOJIIXCFFVIQ-VAWYXSNFSA-N 376.383 5.521 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 21372665 CIOQSLGOCVUTLO-GOSISDBHSA-N 398.506 5.756 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)c1ccccc1-c1ccccc1C#N 25722468 KCNAYTFHROOQRQ-UHFFFAOYSA-N 376.843 5.448 30 20 GKED C[C@H](c1ccccc1)n1c(SC[C@H](C#N)CCC#N)nnc1-c1ccccc1 51423556 CQYZCBQTRKFTHG-MSOLQXFVSA-N 387.512 5.090 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCCc2cccs2)cc1 55823527 VUXXWVLGMMELID-UHFFFAOYSA-N 390.508 5.355 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCC(c2cccc3ccccc23)CC1 64742344 CYXOKGDKYFDFBP-UHFFFAOYSA-N 385.467 5.132 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc2sc(N(CC)CC)nc2s1 64786939 MRCOBVNHNOJPAG-UHFFFAOYSA-N 391.587 5.094 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(C(F)(F)F)cc1 108353763 WMBMPNJRFGJLMK-ZDUSSCGKSA-N 393.434 5.008 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Sc2ccccn2)cc1 112572255 AOACIQGWRBIFJR-UHFFFAOYSA-N 391.521 5.491 30 20 GKED Cc1cscc1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 119359357 YHDCKVMDGHUMLP-UHFFFAOYSA-N 377.469 5.346 30 20 GKED C[C@@H](SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1cccs1 133964474 LBSFETLEEDADBG-HIFRSBDPSA-N 384.551 5.542 30 20 GKED CCC(CC)c1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)on1 150962448 JNDZONWPPPBCHN-UHFFFAOYSA-N 390.443 5.198 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 153552859 PWFHZRUUMKZDRA-QFIPXVFZSA-N 398.466 5.105 30 20 GKED CSc1cc(C(=O)Nc2ccccc2SCCC#N)c(Cl)cc1Cl 154218647 KJELWHCSXPUMGF-UHFFFAOYSA-N 397.352 5.973 30 20 GKED CC(C)Oc1ccccc1CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 155487242 IYBUECSLCKBNDV-SFHVURJKSA-N 376.481 5.016 30 20 GKED Cc1ccc([N+](=O)[O-])c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 173988350 DYOUURWWINSEOO-OAHLLOKOSA-N 397.843 5.170 30 20 GKED CCN(Cc1ccccn1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 177660490 TYLHORJAKATFCU-UHFFFAOYSA-N 391.858 5.061 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C3SCCCS3)cc2)n1 177742865 VLXLWYQEPABJKF-OAHLLOKOSA-N 388.583 5.625 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4[nH]3)cc2)cc1 182842859 GJRULWUURSCBFE-HXUWFJFHSA-N 395.418 5.048 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1)c1ccccc1 187956493 FBNQMPFPBOXNFD-OAQYLSRUSA-N 399.556 5.088 30 20 GKED CCN(C(=O)Nc1ncccc1OCCCC#N)[C@@H](C)c1cc2ccccc2o1 188778599 RDXPHHJLBPJFJV-INIZCTEOSA-N 392.459 5.125 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2cccs2)n1 189875141 NJLZDZJIHRWHES-UHFFFAOYSA-N 382.554 5.905 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](Oc2cccc(F)c2)C1 191435508 HAWVAJNMPQFQBS-HXUWFJFHSA-N 382.479 5.363 30 20 GKED CCOc1cc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)ccc1O 209656164 HEDZDYYOBKGIFX-VBKFSLOCSA-N 377.465 5.127 30 20 GKED Cc1ccc([C@@H](C)N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 247199359 QWFFCCLFEUZUSY-QZTJIDSGSA-N 381.545 5.021 30 20 GKED CC(C)(C)n1ncc2c(Oc3ccc(Oc4ccc(C#N)cc4)cc3)ncnc21 301885699 MCUPPWAUGXTDOZ-UHFFFAOYSA-N 385.427 5.038 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cccc(C#N)c2)cc1Cl)c1ccccc1 303031673 NZHAPGTWMMNBEP-OAHLLOKOSA-N 375.859 5.637 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1cccc(C(F)(F)F)c1 303569871 IXACDTIEFOZYKV-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/C1CCC(c2ccccc2)CC1 330308106 MCPDJCYDRUPEDR-JLAWEPINSA-N 384.545 5.377 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccccc1OC1CCCC1 330346182 GDYCUZHQNUYGHP-HNNXBMFYSA-N 386.517 5.303 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 409916828 ZEOHWLOFIUGCBJ-OALUTQOASA-N 387.310 5.406 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(CCC#N)CCC(C)C 429031430 UGRBGZPFJTXXHN-UHFFFAOYSA-N 390.487 5.453 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccc3)c2)cs1 429276871 XNYDFLVRBCUWNR-JOCHJYFZSA-N 387.508 5.220 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F)c1ccccc1 431379891 ZOOSFAQNJMMIBI-KURKYZTESA-N 381.442 5.089 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(F)cc1Br)c1ccccc1 432656952 JFYZTRFDQNHQSJ-INIZCTEOSA-N 390.256 5.145 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1oc2ccccc2c1COc1ccccc1 433974847 QOBZMAGPPOVEMI-UHFFFAOYSA-N 386.382 5.275 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1 437108945 PMMXMFMFVZMABG-LEWJYISDSA-N 379.529 5.048 30 20 GKED O=C(Nc1cncc(F)c1)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 439629911 WTCBHMFDBIYWNG-CYBMUJFWSA-N 395.278 5.055 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@@]12CCCc1ccccc12 440634947 JIEPHZTVISNHHI-BVZALQNUSA-N 376.525 5.171 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@H](COCC)C1)c1ccc(C(F)(F)F)cc1 441532847 LNRZRTDSSDJINQ-VQIMIIECSA-N 398.469 5.171 30 20 GKED C=CCOCCCC(=O)N(Cc1ccsc1)c1ccc(Br)cc1 443881652 SJBYAZQVUFLZME-UHFFFAOYSA-N 394.334 5.027 30 20 GKED COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)Nc2ccc(CC#N)cc2Cl)c1 455725143 CXYICYAZHZCEHZ-VLIAUNLRSA-N 383.879 5.030 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)cc2)cc1 460845539 KDFZWSCFWNEOJA-UHFFFAOYSA-N 397.409 5.737 30 20 GKED CC(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 464303576 MRERWAVUWAJVOZ-SFHVURJKSA-N 382.460 5.142 30 20 GKED COc1ccc(-c2nnc(S[C@@H](C)CCC#N)n2-c2ccc(C)cc2)cc1 470447304 ZGKMMHVYCJZGPJ-INIZCTEOSA-N 378.501 5.036 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cn(-c2ccccc2)nn1 471667284 JKSHZJPBARZZDD-QGZVFWFLSA-N 381.439 5.104 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)C[C@H](CC#N)c2ccccc2)c1 476342893 VWOVTZPFTOHGNX-FQEVSTJZSA-N 386.499 5.376 30 20 GKED N#C[C@H](C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1nccc2ccccc12 483240258 GTRJOAYSOPNPJD-NRFANRHFSA-N 383.838 5.440 30 20 GKED CCCCn1ncc(NC(=O)Nc2cccc(OCCCC#N)c2)c1C(C)C 484175233 CWSPMKVUNAPXPL-UHFFFAOYSA-N 383.496 5.133 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1)c1ccccc1 487241657 NSWKTPHNRDSQRR-AQNXPRMDSA-N 397.316 5.104 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 489437682 ZBFWTEMVUHGHEE-SFHVURJKSA-N 376.504 5.130 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)COc1ccc(Cl)cc1 500739573 PTRDGOOLTUPLHK-UHFFFAOYSA-N 392.842 5.330 30 20 GKED Cc1c(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cccc1C(F)(F)F 502653053 HZLBOPYOVMZNPF-UHFFFAOYSA-N 385.389 5.207 30 20 GKED CCCCOc1ccccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503610315 MENPZYSXCKBDAS-UHFFFAOYSA-N 375.472 5.058 30 20 GKED N#CCCSc1ccccc1NS(=O)(=O)c1cccc(-c2ccccc2)c1 506599950 DFJNGLLYHKYUJT-UHFFFAOYSA-N 394.521 5.160 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H]2CCCC[C@H]2C)cc1 508278317 KVFRIGLIMCCFGH-UZLBHIALSA-N 393.487 5.402 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)c1 511161718 YKMDHKGXYLAZLB-UHFFFAOYSA-N 385.225 5.923 30 20 GKED C[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(C#N)cc1F 512276879 ADNRHYXIVHOYRQ-INIZCTEOSA-N 380.467 5.278 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](CC)c1ccc(Cl)s1 513080015 CJVFXSKJICFEFS-INIZCTEOSA-N 378.925 5.259 30 20 GKED N#CCCCOc1cccc(NC(=O)CCCSc2ccc(Cl)cc2)c1 515443263 UYWAIPOWUSMZSC-UHFFFAOYSA-N 388.920 5.534 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 518653632 UOFJEGYECONNLZ-UHFFFAOYSA-N 378.516 5.161 30 20 GKED C=CCC[C@@H](C(=O)Nc1cncc(Cl)c1Br)c1ccccc1 519717864 APPKISUJVORBEG-CYBMUJFWSA-N 379.685 5.186 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1csc(-c2cccc(Cl)c2)n1 520323515 HSVMJKIVPZHRCN-UHFFFAOYSA-N 384.892 5.144 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCc2ccccc2)cc1 520598190 BJDPXKLXRKPFLB-UHFFFAOYSA-N 378.497 5.547 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccccc12 530725782 ZRFORXNSJPLIGS-URXFXBBRSA-N 381.479 5.024 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)Nc2cccc(N3CCCC3)c2)cc1 538026115 XOCMRXWKGDCTOW-UHFFFAOYSA-N 396.494 5.147 30 20 GKED CCN(C(=O)c1cnn(-c2cccc(Cl)c2)c1C)c1ccc(C#N)c(Cl)c1 540274265 MGZMWAWNXKOCBA-UHFFFAOYSA-N 399.281 5.026 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1F 551205306 JDGSSGABTDDAQE-LIRRHRJNSA-N 375.285 5.674 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1Cl 554349641 YCUVCRALPPOUCZ-MRXNPFEDSA-N 392.768 5.118 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CC3(C(F)(F)F)CC3)c2)cc1 572266915 JLHSZMACZJDKIJ-UHFFFAOYSA-N 388.389 5.003 30 20 GKED COc1cc(F)c(F)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 581163808 XCAHHXMTGDTOEP-UHFFFAOYSA-N 394.377 5.084 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CNCc1ccc(C(F)(F)F)s1 584016870 TWCLIIVQZMBSBU-UHFFFAOYSA-N 375.284 5.354 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1 589679836 SKHZATZYRSPHFL-UHFFFAOYSA-N 394.462 5.196 30 20 GKED N#Cc1c(NC(=O)c2c(F)ccc(SCC3CC3)c2F)sc2c1CCC2 590974122 IKBUYJROHOOKKB-UHFFFAOYSA-N 390.480 5.141 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C(F)(F)F)o1 594072590 UNHLWKFFXDBUCF-MLGOLLRUSA-N 397.422 5.407 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1[C@H]2c3cccc(Cl)c3C[C@H]21 599390674 OOPVXDIYDNKNCI-HHLQROKJSA-N 382.916 5.116 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)on2)cc1 609376631 GXPOVLVPWDEDSR-OAHLLOKOSA-N 377.469 5.154 30 20 GKED Cc1cc(Br)ccc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 609460928 PNAAONAJTHGWMB-OAHLLOKOSA-N 398.087 5.059 30 20 GKED N#CC1(NC(=O)c2cccc(CSc3cc(Cl)cc(Cl)c3)c2)CC1 610198207 DFFJZSYAICNASB-UHFFFAOYSA-N 377.296 5.072 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc(C3CC3)s2)cc1F 610313471 RZKOWLOWTCYTBR-UHFFFAOYSA-N 379.416 5.076 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CN[C@H](C)c1cccc(C#N)c1 610344638 BSTAXMJLMHOSLM-HXUWFJFHSA-N 392.506 5.570 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccnc1Oc1ccccc1 610629290 AKXVVKJNKKJGLH-IRLDBZIGSA-N 398.466 5.178 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)CC1 611255130 VGMZAXCSAOAVAV-HRRASNIPSA-N 393.962 5.160 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(-c3c(Cl)cccc3Cl)no2)cc1 614970129 XGYMYRQNAGXYRN-INIZCTEOSA-N 385.254 5.257 30 20 GKED Cc1cc(-n2cccn2)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 616106027 OKCIOAVJLUKUES-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(SCC(F)(F)F)cc1 618802279 HVTFICRUYKRLCD-BFUOFWGJSA-N 376.447 5.551 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)ccn1C(C)C 645955568 MIZMYSBXZPQFJX-CQSZACIVSA-N 391.418 5.496 30 20 GKED Fc1ccc(-c2csc(N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)n2)cc1 674931571 QYVSPLMFFSNGHG-PHIMTYICSA-N 398.347 5.516 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc2c(cnn2C(F)F)c1)c1ccc(F)c(F)c1 681412618 PLERWYLCKSFGEC-QGZVFWFLSA-N 392.356 5.149 30 20 GKED COc1ccc2c(-c3ccccc3)cc(=S)n(CN(C)[C@@H](C)CC#N)c2c1 728902407 OXUDYTOLMFCDRF-INIZCTEOSA-N 377.513 5.238 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1ccc(OC(F)F)cc1 730952980 HKWGTRTVKGBHNB-UHFFFAOYSA-N 379.457 5.103 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)n1C 731332704 QBVHJWQZZHOCCX-HNNXBMFYSA-N 393.487 5.478 30 20 GKED CCc1cccc2c(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c12 731767795 KXHPBJNHZMIECJ-INIZCTEOSA-N 393.899 5.412 30 20 GKED C=CC[C@@H](NC(=O)NC[C@H](C)c1c(Cl)cccc1Cl)c1ccncc1 734666758 JTAVOIDFLQJLFC-SUMWQHHRSA-N 378.303 5.109 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)C[C@@H](C)c1ccc(C(C)C)cc1 737530271 TWTZCIPYCBDXAR-LJQANCHMSA-N 385.511 5.439 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccccc3OC(F)F)c2)s1 740427639 ARUSYBGIWYADQB-UHFFFAOYSA-N 399.422 5.210 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1 742891126 GPPMVJAMOCQRNV-MRXNPFEDSA-N 396.487 5.089 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)n1 747198675 JUKFGZCTTMQSEY-MELADBBJSA-N 379.312 5.553 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)CCC(=O)N3C)o1 754689909 NJCBDSBWBUUDBL-UXBLZVDNSA-N 389.426 5.199 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)c1 764151128 VQCCSCQXAJBMFN-KRWDZBQOSA-N 383.448 5.065 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1ccc(F)cn1 770596964 RNWPJYDZXACYEK-UHFFFAOYSA-N 377.448 5.037 30 20 GKED C[C@@H](NCC/C=C\c1ccc(Br)cc1)c1ccc(OCC#N)cc1 775336632 OHAYSHWUUMIRBB-ZENLRNHISA-N 385.305 5.106 30 20 GKED C=CC[C@@H](N[C@@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccncc1 775392623 HVBUGAZZMABDQA-WMZHIEFXSA-N 379.548 5.044 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 780672706 IELJWZLTYIULNV-VLIAUNLRSA-N 383.879 5.294 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)c(C)n1-c1ccc(Cl)cc1 781034155 HURLHIUJZNKUQA-OAHLLOKOSA-N 393.874 5.291 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(C#N)cc3Cl)cs2)cc1 788360076 GPYAZIXWLIWYGA-WEVVVXLNSA-N 380.856 5.240 30 20 GKED COc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 793378440 YTGRCOXAFSFCFI-RBZQAINGSA-N 397.478 5.028 30 20 GKED O=C1/C(=C\c2ccc(C(F)F)cc2)COC/C1=C/c1ccc(C(F)F)cc1 794943383 YFYQFIPHFAQUDE-XFQWXJFMSA-N 376.349 5.628 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568933 YCYPZNDRGVCHQY-SMDDNHRTSA-N 378.950 5.451 30 20 GKED N#Cc1sc(N[C@@H](c2cc(F)cc(Br)c2)C2CC2)nc1Cl 804623658 RPUTZPYJCPMXNZ-GFCCVEGCSA-N 386.677 5.133 30 20 GKED CC(/C=C\C(=O)c1ccc(C(F)(F)F)nc1O)=C\c1ccccc1OC(F)F 811686789 AJLNCALDPSFWOR-FEVLKHHISA-N 399.315 5.250 30 20 GKED CSc1nc2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2s1 814489410 AIJGDLJDOQOLPT-MRXNPFEDSA-N 396.541 5.575 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CC3(C2)CC3(F)F)cc1Cl 822144202 CLMOIYBLAXZVLS-WSGJVKOYSA-N 386.829 5.369 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2cccc(CC#N)c2)c(Cl)c1 837072241 SUZASZGFDHPOGU-UHFFFAOYSA-N 385.851 5.005 30 20 GKED CCN(C(=O)/C=C/c1ccc2cc(OC)ccc2c1)[C@H](C)c1ccc(C#N)cc1 914509472 MRIHJNQXXDNLDT-ODHXBGJQSA-N 384.479 5.343 30 20 GKED Cc1cc(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1Cl 915086938 NXWNNCMDJKWCOK-NRFANRHFSA-N 390.870 5.321 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccccc2)C2CC2)cc1 915353182 LVVJGSGSOHXDRC-DEOSSOPVSA-N 381.479 5.539 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccsc2)cc1 915359649 WBKJAJRBKUCDDW-FGZHOGPDSA-N 387.508 5.773 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1 917145122 RSFQBNOOIOPDNY-LCYFTJDESA-N 375.399 5.473 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NN[C@H](C)c1ccccc1 920385681 FYKMOIISCPGNKL-CQSZACIVSA-N 387.314 5.231 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(SC(F)F)cc1 1776354639 UTBSOPDPQYBKMP-UITAMQMPSA-N 392.423 5.383 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCC(C)C)c(OCC)c1 1776783897 IUOGERZNCCVZRO-FQEVSTJZSA-N 393.568 5.414 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cccc(CC(=O)O)c1 1777487735 MBEHQXCFMNBFTI-YHYXMXQVSA-N 397.883 5.295 30 20 GKED CCC(CC)n1c(COc2ccccc2Cl)nnc1SCCCC#N 58110463 UDNPIBISYINYPF-UHFFFAOYSA-N 378.929 5.267 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)Cc1csc(-c2ccc(F)cc2)n1 63381203 JZNZTIBDBAKSOR-UHFFFAOYSA-N 383.448 5.046 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 66801827 ALFXQMNQFDXDLG-GFCCVEGCSA-N 397.481 5.456 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(F)cc1F 108242021 YVELILFMWCXCFO-UHFFFAOYSA-N 386.345 5.242 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@@H](C)c1cccnc1 115762445 GBINXLBIBFKUPS-KRWDZBQOSA-N 386.455 5.361 30 20 GKED C[C@@H](c1cccnc1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116635163 YUVFKTSPZWCNHU-HNNXBMFYSA-N 391.858 5.232 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3sccc3C)n2)cc1 129593443 CHZNARZHIVFHFV-IXDOHACOSA-N 394.521 5.169 30 20 GKED C=CCN(C(=O)c1coc(-c2ccccc2)n1)c1nc(-c2ccccc2)cs1 151166918 WDQYHXJSXAOERQ-UHFFFAOYSA-N 387.464 5.298 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1 159480795 CWFGTPNRROCCFA-MHZLTWQESA-N 384.545 5.205 30 20 GKED Cc1sc([C@H](C)NCc2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 162778096 POEAUBQLKKCFFY-LBPRGKRZSA-N 385.895 5.634 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1ccc(F)cc1C(F)(F)F 178408513 JUDVXFQMEKCRNM-UHFFFAOYSA-N 381.247 5.038 30 20 GKED N#CCC[C@H](N[C@@H]1CCSc2ccc(Br)cc21)c1ccccc1 181576706 FEYSBYPZNDHEHH-ZWKOTPCHSA-N 387.346 5.621 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](c1ccccc1)c1nccs1)c1ccc(F)c(F)c1 185460383 WYSYQKNMZCUBJZ-OALUTQOASA-N 399.466 5.127 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1cc(F)cc(F)c1 187539585 WWTVYZQVVURAFX-ZDUSSCGKSA-N 392.496 5.088 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@H]2NCc1cc(C#N)cs1 189913250 DQSMKMFCHDJGEU-LJQANCHMSA-N 383.517 5.134 30 20 GKED CCCNc1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 192415699 XORYWVGDMLKORC-INIZCTEOSA-N 382.533 5.082 30 20 GKED CCCNc1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 192415702 XORYWVGDMLKORC-MRXNPFEDSA-N 382.533 5.082 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)ccc1OC 237343941 KJWKSMBACUBPSM-LJQANCHMSA-N 388.511 5.563 30 20 GKED CC(C)(C#N)CCCCS(=O)(=O)Cc1nc(-c2ccccc2Cl)cs1 277785008 GUWITZNNJSEQSU-UHFFFAOYSA-N 396.965 5.098 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccc(CC(F)(F)F)cc2)cc1OC 303906977 QRXCGJSCPBHZFZ-YRNVUSSQSA-N 391.389 5.017 30 20 GKED CC(O)=Nc1cc(F)c(F)cc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 329996321 OQJZSNPHVBLTRG-UHFFFAOYSA-N 379.407 5.086 30 20 GKED COc1ccc2c(c1N=C(O)CC/N=C(/O)C13CC4CC(CC(C4)C1)C3)CCC2 330092834 ZBUUPMFCNCWXDI-UHFFFAOYSA-N 396.531 5.335 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(F)ccc1Cl 431935562 FSWLGNGZMVQPLE-UHFFFAOYSA-N 381.794 5.099 30 20 GKED COc1cccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)c1 433017460 CGVDANNEACNLIU-NRFANRHFSA-N 377.513 5.343 30 20 GKED CC(C)(C)c1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)n(C(C)(C)C)n1 439390920 ZEUNDENNHFRXGR-QGZVFWFLSA-N 381.524 5.102 30 20 GKED C[C@H]1c2cc(F)cc(F)c2CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458808010 YQGOTSKJVRTENM-BTYIYWSLSA-N 383.442 5.029 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccc(Cl)c1 460174133 NUROWYPPEIPRAF-MRXNPFEDSA-N 390.870 5.533 30 20 GKED COc1ccc(-n2c(SCCC(C)(C)C#N)nnc2-c2cccc(C)c2)cc1 463039583 AKRHMLLZRHJFOF-UHFFFAOYSA-N 392.528 5.283 30 20 GKED CSc1cccc([C@@H](NC(=O)c2cccc(C#N)c2)c2cc(F)ccc2F)c1 464113814 IPYHITQCWHOGCZ-OAQYLSRUSA-N 394.446 5.078 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ncccc1OCCCC#N 466610613 MTBSQLBREQFPGQ-GOSISDBHSA-N 392.503 5.159 30 20 GKED CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 469701174 DNHDZNYFEMFXIS-AZUAARDMSA-N 395.572 5.813 30 20 GKED N#C[C@H](NC(=O)c1cc(F)ccc1-c1ccoc1)c1ccc(Cl)c(Cl)c1 471089395 SODNQOAGNHJOEG-SFHVURJKSA-N 389.213 5.387 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2(C(F)F)CC2)cc1Cl 471203924 NIFLYCWDDRAGSI-INIZCTEOSA-N 389.833 5.162 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 473558069 XOULGLPMIGVFJI-UHFFFAOYSA-N 394.393 5.247 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1OCC(F)F 481012615 KJZPOTXYTGUBTG-UHFFFAOYSA-N 386.851 5.266 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1CCC(F)(F)C1 481069775 KTLNJNZVOPRLQT-ZYHUDNBSSA-N 389.286 5.251 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ncc(-c2ccccc2)cn1 484697472 AGBIMRTWXFGZRF-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H]3Cc3ccccc3)c2)cc1 484915997 IXSCAOZJJXRKRR-JOCHJYFZSA-N 382.463 5.198 30 20 GKED C=CCN(C(=O)c1cnc(-c2ccsc2)s1)c1nc2c(s1)CCCC2 486921459 WZWZCVKEMACVHF-UHFFFAOYSA-N 387.555 5.040 30 20 GKED Cc1cc(NC(=O)c2ccc(F)cc2C(F)(F)F)ccc1OCC(F)(F)F 488201437 MDKKXRFLXAUWDN-UHFFFAOYSA-N 395.274 5.346 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC(c4ccc(O)cc4)CC3)c2)cc1 490160579 BPTXKAAGVHRGMV-UHFFFAOYSA-N 398.462 5.076 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)s1 490480242 NHYOJVXWNXZNQP-CQSZACIVSA-N 393.468 5.157 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(-c3ccco3)cc2F)cc1 490495513 IWXANKARJBIZAH-UHFFFAOYSA-N 394.406 5.037 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(Cl)c3C)n2)cc1 490727187 ABULLYOXYBRVHQ-INIZCTEOSA-N 382.872 5.271 30 20 GKED COc1ccc(/C=C\c2nc3cc(Cl)ccc3s2)cc1OCCCC#N 494082075 ASAGVUNCHYXAIY-UITAMQMPSA-N 384.888 5.811 30 20 GKED N#CC1(CCCN2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 499522928 NIBQJJNNEWGRCG-IBGZPJMESA-N 380.454 5.333 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cccc(OCc2ccc(Cl)cc2)c1 504318422 MKPMTQWPRJREAN-UHFFFAOYSA-N 383.797 5.110 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc3cc[nH]c3c2)cc1 505621715 NDPAAYAQTSDZTE-UHFFFAOYSA-N 383.407 5.093 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1sccc1Cl 506383267 SWGOMLOQBGRPMB-UHFFFAOYSA-N 377.922 5.050 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2cccc(OCC(F)(F)F)c2)CC1 507661032 RYBWNVBIKRBKGU-UHFFFAOYSA-N 388.433 5.121 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510661303 XJOYWZVWEJEJOT-INIZCTEOSA-N 389.430 5.715 30 20 GKED C[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511373536 PNJHOOVOBKFNAP-MBSDFSHPSA-N 391.515 5.374 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1CN1CCc2ccccc21 511612696 CJTMNCVRVCSXSI-UHFFFAOYSA-N 397.522 5.469 30 20 GKED CC(C)(C)Cc1nc2cc(NC(=O)CSCc3ccc(C#N)cc3)ccc2o1 518202418 LWGXDTBNLKHCIV-UHFFFAOYSA-N 393.512 5.160 30 20 GKED CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(C)Cc1ccc(C#N)cc1 519495910 QOMPXKNFQUDGET-GOSISDBHSA-N 390.314 5.028 30 20 GKED COc1ccc2[nH]cc(CC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)c2c1 521324931 LPFCHAXPFCZILN-UHFFFAOYSA-N 397.434 5.022 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCCC2)c1)c1nc2ccccc2s1 523458713 VXJUNEKVEBFCPC-SFHVURJKSA-N 376.481 5.498 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3cccs3)cc2Cl)c1 524390103 SAXCRQMXQCUWNT-UHFFFAOYSA-N 382.872 5.033 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC(F)(F)C[C@@H]1C 528962878 IERRRCLGMQCHKB-INIZCTEOSA-N 399.441 5.097 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(-c2ccccc2)cnc1C 535540399 YIVUEZPCTZCPQC-UHFFFAOYSA-N 387.483 5.286 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 536889709 KZRXPPZHADBARP-FQEVSTJZSA-N 395.506 5.093 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(-c2cccc(C#N)c2)cc1 541084444 KMIQMKKSBDSDEE-LJQANCHMSA-N 379.507 5.877 30 20 GKED CN(C(=O)CCCC(F)(F)F)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 542180820 IPIZGQUFBCNSSC-GFCCVEGCSA-N 395.265 5.500 30 20 GKED CCCC[C@@H](CC)COCc1cccc(NC(=O)N2CCC(CC#N)CC2)c1 542902966 WVOUIESLOHKIQU-LJQANCHMSA-N 385.552 5.577 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N(C)C[C@H](C)C#N 543318580 UOPHCSWCEAYDCF-GFCCVEGCSA-N 382.464 5.034 30 20 GKED C=CCN(CCC#N)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 552754796 ATZFXIHLNYBKQY-UHFFFAOYSA-N 376.353 5.053 30 20 GKED COc1cc(CSc2ccncc2C)ccc1OCc1cccc(C#N)c1 555083247 FWNHCLCVSWJCJK-UHFFFAOYSA-N 376.481 5.142 30 20 GKED N#Cc1cccc(C2(N[C@@H]3CCSc4ccc(Br)cc43)CC2)c1 560269307 UOPDRPQGBHEBKR-QGZVFWFLSA-N 385.330 5.137 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2CCCC2)cc1)c1nc2ccccc2n1C(F)F 562163795 NKIGSXKXHXIAFH-KRWDZBQOSA-N 379.410 5.579 30 20 GKED Cc1nc(-c2cc([C@@H](C)N[C@@H](CCCC#N)c3ccccc3)cs2)cs1 567296267 HQJURPRSWKBFEF-BEFAXECRSA-N 381.570 6.266 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(O)c(COC(C)C)c1 575839668 SZQKPZPZACUFMS-UHFFFAOYSA-N 382.504 5.813 30 20 GKED N#Cc1ccnc(N2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)c1Cl 580655848 TVGCBYAJGRVLHM-UHFFFAOYSA-N 396.705 5.099 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC4(CCCCC4)CC3)cc2)ccn1 589364516 COLPUPUOMIKJDS-UHFFFAOYSA-N 390.487 5.324 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)C2)c1 589365578 QRAYYIFQWCCKMR-LJQANCHMSA-N 398.466 5.075 30 20 GKED CC(C)C[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596241670 VWWZKWRMHFYXBJ-MAUKXSAKSA-N 381.442 5.128 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603765483 ZWIVZXRDWUIWMQ-UHFFFAOYSA-N 389.480 5.498 30 20 GKED N#Cc1ccc(CN(C(=O)c2cnc(-c3ccccc3Cl)s2)C2CC2)cc1 604517393 KNCBFWASTXLSEL-UHFFFAOYSA-N 393.899 5.140 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(Oc4ccc(F)cc4)cc3)[nH]c12 605363560 JTYWRWSUIIQWAI-LJQANCHMSA-N 385.398 5.293 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609031140 BJRAUKUISSXOMQ-HUUCEWRRSA-N 389.282 5.394 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)Nc3ccc(F)c(C#N)c3)cs2)cc1 609103326 NHVQTMHADFTKGJ-UHFFFAOYSA-N 379.460 5.125 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CC1 609403071 QHYCCQLDMZIYMJ-INIZCTEOSA-N 379.529 5.443 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 609552210 CPMNWPHKTKNVLE-UHFFFAOYSA-N 391.515 5.502 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4cc(F)ccc4o3)cc2)c1 609785069 BFWUTYJPDIFRER-UHFFFAOYSA-N 386.382 5.275 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCc1cccnc1)c1cccc(C#N)c1 611387233 IGHDGBRLDKWDIQ-MRXNPFEDSA-N 377.875 5.036 30 20 GKED CN1CC[C@H](CN[C@@H]2CCCc3cc(C#N)ccc32)[C@@H]1c1ccc(Cl)c(F)c1 611395226 VGPBRBKAISWPHC-YSZBQJHXSA-N 397.925 5.011 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@H]1CCCCO1 611480915 TVVDBLCFDJQEMD-PAXLWEDBSA-N 397.906 5.075 30 20 GKED CC(C)(C#N)CNC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 611621361 ZJHXZQKNOQZRQS-UHFFFAOYSA-N 399.360 5.031 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc2cc(Cl)ccc2s1 613402486 BTFNOJPDYURIGQ-CYBMUJFWSA-N 396.830 5.839 30 20 GKED CC[C@@]1(C)Oc2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cc2O1 615486591 CZBKABZHCOCCSH-SFHVURJKSA-N 377.227 5.015 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)C1 616111766 PZVUWSQQLVJCGO-LJQANCHMSA-N 389.286 5.213 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1cc(C(F)(F)F)ccc1Cl 618741785 MDEMXXHRSAOSJY-HNNXBMFYSA-N 379.769 5.039 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)N(Cc1ccccc1)Cc1ccccc1F 618850362 XENXDDXZBPMIEG-XMMPIXPASA-N 399.469 5.097 30 20 GKED C=CCN(C(=O)[C@H](C)OCC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 642360975 DEZDKWRTNXXOBU-NSHDSACASA-N 385.316 5.061 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(OCc2ccccn2)c1 669727510 RDGDYOJRXDHRKC-UHFFFAOYSA-N 387.483 5.101 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\CCc3sccc3C2=O)cs1 726891339 ISTRGDRRWBFVMJ-RVDMUPIBSA-N 394.521 5.410 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1c(Cl)nc(Cl)n1C 728439892 GRWGNMRGZBTUNO-FPLPWBNLSA-N 396.274 5.194 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1csc(-c2cccs2)n1 728440788 VBYOCJSQTAZSQD-GNESMGCMSA-N 394.477 5.610 30 20 GKED CCc1ccccc1O[C@H](C(=O)[C@H](C#N)c1nc2ccccc2o1)c1ccccc1 730690268 QZZIZPSJBSUWKT-CYFREDJKSA-N 396.446 5.387 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@H](C#N)c3ccc(C(C)(C)C)cc3)c2c1 731197975 BMSUEEXTNAPWRQ-LJQANCHMSA-N 376.456 5.042 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c[nH]c12 741537044 ALNXDXYMNARLBL-DEOSSOPVSA-N 393.490 5.703 30 20 GKED Cc1cc(/C=C2\CCc3cc(C#N)ccc3C2=O)cc(C)c1OCc1ccccn1 742438436 XFLBNWSEWFQXPT-HYARGMPZSA-N 394.474 5.362 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(-c4ccncc4)cc3)cs2)c1 745990844 ZGHKDBZWJZGWAF-KTKRTIGZSA-N 398.487 5.777 30 20 GKED C#CCSc1nnc(CNc2cccc(C(F)(F)F)c2)n1C1CCCCC1 746170714 ZTNGRHLOMXCGJF-UHFFFAOYSA-N 394.466 5.140 30 20 GKED COc1ccc(CNC(=O)N(C)[C@H](C)c2ccc(-c3ccccc3)cc2)cc1C#N 746775714 OZYIHEBHJRRRMK-GOSISDBHSA-N 399.494 5.136 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SC)c(OC)c2)cc(Cl)c1O 747615354 VWYYHLGXCTUECZ-FNORWQNLSA-N 378.877 5.071 30 20 GKED Cc1c(C(=O)/C=C\c2cccc(-c3ccccn3)c2)cnn1-c1ccc(C#N)cc1 747692653 JBWZNZYWWXUBCM-RAXLEYEMSA-N 390.446 5.011 30 20 GKED N#Cc1ccc(Oc2ccc(OCc3nnc(-c4cccc(F)c4)o3)cc2)cc1 748444975 WOTVCUTWPUZGAN-UHFFFAOYSA-N 387.370 5.119 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)Nc1ccc(F)cc1 749101611 DSTUHOHTQHKLDT-UHFFFAOYSA-N 397.288 5.112 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2snc(Cl)c2C#N)nc1-c1ccccc1 749283741 PAOVOPCGMJSARF-HNNXBMFYSA-N 398.919 5.788 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/CCc3sc(Br)cc3C2=O)cc1 754687784 NAFKWZMWHOEHFZ-JYVXZMADSA-N 388.286 5.014 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759181172 AOCLGLBXBHXGKW-ADYSOMBNSA-N 376.843 5.125 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2c(Cl)oc3ccccc23)S1 761177701 UIEKLUKPXSJVFB-YBEGLDIGSA-N 382.872 5.595 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2s1 761533304 KMBJLGZWOVQICD-FQEVSTJZSA-N 383.476 5.513 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)CCc2ccc(Br)cc21 769616094 FAGLJRFEGOTZGN-LCYFTJDESA-N 397.297 5.180 30 20 GKED O=C(/C=C/c1nc2ccc(Br)cc2s1)c1cccc(F)c1F 773144127 YLRCOWRQMKLEGI-VOTSOKGWSA-N 380.213 5.233 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 774039432 WYACRVSBMHFJMI-QGZVFWFLSA-N 387.439 5.072 30 20 GKED C=CCOc1cccnc1C(=O)O[C@H](C)c1sc(-c2ccccc2F)nc1C 775245065 MVDVTDDDQFDWPJ-CQSZACIVSA-N 398.459 5.135 30 20 GKED C#CCCCCCC(=O)N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 778024250 TYLBJNUQTWGYON-HXUWFJFHSA-N 384.520 5.111 30 20 GKED CC(=NNc1c(Cl)cc(F)cc1Cl)c1cc2c(s1)SCC(=O)N2 778544318 VOVHJBMBGVTYJK-UHFFFAOYSA-N 390.292 5.074 30 20 GKED C[C@@H](C#N)Oc1ccc(CNC2(c3ccc(C(F)(F)F)cc3)CCCC2)cc1 779984395 GDHCGIRMQIDPII-INIZCTEOSA-N 388.433 5.555 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 780154728 ZIHRVSTXAZSWKO-AWEZNQCLSA-N 393.830 5.070 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCc1ccc(C#N)cn1 782034203 RBDBFGHPBBAZEM-UHFFFAOYSA-N 380.517 5.008 30 20 GKED COCCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CC[C@@H](C)C1 792230711 XJYRTKORHYBJNG-YFXJRYMSSA-N 391.515 5.011 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](OC(C)C)c3ccccc3)n2)cc1 796766712 ZMVAESXTCICHFP-SIKLNZKXSA-N 390.508 5.461 30 20 GKED COc1ccccc1-c1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)cc1 806561007 QMVXCCOXUBNANR-RRXSNJIPSA-N 384.431 5.200 30 20 GKED C#CC[C@@H](NC(=O)c1sc2ccccc2c1Br)c1ccccc1 810751626 CFVDDEXFIVIJGW-OAHLLOKOSA-N 384.298 5.158 30 20 GKED CCOc1cc(/C=C\C(=O)c2cnn(-c3ccccc3)c2C)cc(Cl)c1OC 818253339 SLCPUOXYAVYFBO-KHPPLWFESA-N 396.874 5.138 30 20 GKED CC(C)c1c(Cl)ncnc1NN=C(CCC(F)(F)F)CCC(F)(F)F 853343054 UMHQDJJOPTVBKS-UHFFFAOYSA-N 390.759 5.706 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(Br)c2)cc1 915085270 JSWUUNXNWVGFEO-KRWDZBQOSA-N 397.297 5.418 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccc3ccccc3n2)cc1 915181333 YXUBTUXTVLNWDT-GQRCBVMOSA-N 389.458 5.542 30 20 GKED CCCN(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352433 KTUSIVZRSDTONJ-XMMPIXPASA-N 383.495 5.786 30 20 GKED N#C[C@H](C(=O)Nc1ccc(F)c(Cl)c1)C(=O)c1ccc(-c2ccccc2)cc1 916936692 SXCAGSVQOCUGCQ-SFHVURJKSA-N 392.817 5.107 30 20 GKED Cc1c(Cl)cccc1S(=O)(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 917738180 UFKYVAQXGNHNHB-IBGZPJMESA-N 396.899 5.105 30 20 GKED C=CCc1cc(C)c(OCCCN(Cc2ccc(C(=O)O)cc2)C2CC2)cc1C 1776188950 PAFZYNYNGZFRNI-UHFFFAOYSA-N 393.527 5.164 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cccc(Oc3ccccc3)c2)c1)C(=O)O 1776471056 FBRLQFKDAQNMMW-NJWFCXLTSA-N 388.419 5.227 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc2ccccc2c1OC(F)F 1777268464 OHPXPBLXRWQXBL-PKNBQFBNSA-N 398.361 5.044 30 20 GKED N#Cc1ccc(F)c(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c1 11627021 MEDIFOULYNMQFE-UHFFFAOYSA-N 394.016 5.063 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(C)cc3)n2)nnc1-c1ccoc1C 25354324 DTLXQLRAORUUFW-UHFFFAOYSA-N 392.484 5.288 30 20 GKED CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C#Cc3cccs3)c2)c1 25753035 FFPGIASNCDGFLS-UHFFFAOYSA-N 394.477 5.030 30 20 GKED Cc1nc(C)c(C#N)c(SCc2csc(-c3ccc(C(C)C)cc3)n2)n1 25961019 XZKCGVFNHQKJBN-UHFFFAOYSA-N 380.542 5.504 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cccc3ccccc23)cc1 27077457 QLKIPWYNIISRBY-UHFFFAOYSA-O 397.523 5.487 30 20 GKED N#C[C@@H](C(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccccn1 41493696 YUEGHLQXLBAWGX-KNQAVFIVSA-N 392.911 5.434 30 20 GKED CN(CCC#N)C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 60617779 OEVGGGMECXNKRO-UHFFFAOYSA-N 384.888 5.364 30 20 GKED C=CCN(C(=O)CCCc1ccc(OC)cc1)c1nc(-c2ccccc2)cs1 61113419 FQBNIIHCWKQDPZ-UHFFFAOYSA-N 392.524 5.361 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)cc1OCCCC#N 64367234 BBDMJNNPJZSERB-VQHVLOKHSA-N 389.373 5.293 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)c(F)c1 66955211 GUABBSPWANEIPT-CYBMUJFWSA-N 375.444 5.023 30 20 GKED C=CCn1c(S[C@H](c2ccccc2)c2ccccc2C)nnc1-c1ccncc1 97130694 UJPGCDMPUDIOFR-JOCHJYFZSA-N 398.535 5.716 30 20 GKED CC(=O)Nc1cccc(-c2nc(-c3cn(CCC#N)c4ccccc34)cs2)c1 101582995 XGXQJEFIKQWKEH-UHFFFAOYSA-N 386.480 5.304 30 20 GKED N#C[C@@H](C(=O)[C@@H](Oc1cccc(Cl)c1Cl)c1ccccc1)c1ccccn1 106983733 NNVGZNYAFHOBPC-VFNWGFHPSA-N 397.261 5.385 30 20 GKED C=CCn1c(S[C@H](C)c2cnccn2)nnc1-c1ccc(C(C)(C)C)cc1 185198498 MLZKGRVLAYJQNY-OAHLLOKOSA-N 379.533 5.072 30 20 GKED CCN(C(=O)Nc1ncccc1OCCCC#N)[C@H](C)c1cc2ccccc2o1 188778619 RDXPHHJLBPJFJV-MRXNPFEDSA-N 392.459 5.125 30 20 GKED CCS[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1SC[C@H](C)C#N 246755443 XSKXWIYMMVFMEQ-BFYDXBDKSA-N 377.579 5.124 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C)C[C@H]1c1ccco1 248569814 QILVJKZGZUNCPZ-NUJGCVRESA-N 383.517 5.536 30 20 GKED Cc1c([C@@H](NC(=O)CSc2ccc(C#N)cc2)C(C)C)oc2ccccc12 303493549 WMRBXWMDNIRHKO-NRFANRHFSA-N 378.497 5.219 30 20 GKED O/C(=N/[C@H]1CC2(CCCC2)Oc2ccccc21)c1ncsc1C(F)(F)F 328751654 RBIFSJAHRRTRBM-LBPRGKRZSA-N 382.407 5.303 30 20 GKED C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)[C@H]1c1ccc(C(F)(F)F)cc1 412208223 WMGNJJPOQKMQPQ-RZTDZLQYSA-N 398.428 5.290 30 20 GKED Cc1cnc([C@H](C)NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 427081542 SMVQUJVDTHUSQI-ZDUSSCGKSA-N 397.887 5.260 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)c1 429827049 QEEHZGROVALVSC-UHFFFAOYSA-N 391.323 5.414 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432961453 SAGCSDRUVYGJOJ-GOSISDBHSA-N 385.895 5.684 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 433489477 RQZUHHIJLCJZOA-OXQOHEQNSA-N 393.918 5.792 30 20 GKED Cc1oc(C#N)cc1C(=O)N(CCSc1ccc(F)cc1)c1ccccc1 435455330 UQYYMCFXEGADQL-UHFFFAOYSA-N 380.444 5.038 30 20 GKED N#CCC[C@H](NC(=O)NCc1ccc(OCc2ccccc2)cc1)c1ccccc1 438854465 WTMQUKCADPPJOD-DEOSSOPVSA-N 399.494 5.110 30 20 GKED C=CCNC(=O)Nc1ccc(N[C@H](C)c2ccc3cc(OC)ccc3c2)cc1 439554284 WAWLHDGYSLTCGN-MRXNPFEDSA-N 375.472 5.329 30 20 GKED CCN(C(=O)c1ccc(-c2csc(C)n2)cc1)[C@H](C)c1ccc(C#N)cc1 440766027 XKUNOTVIOYFAOM-OAHLLOKOSA-N 375.497 5.214 30 20 GKED N#CCCCn1cc(C(=O)N2CC3(CCC3)c3c(F)cccc32)c2ccccc21 444147365 RLBNCNAGUGVGCM-UHFFFAOYSA-N 387.458 5.166 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)c3cc(-c4cccc(C#N)c4)no3)cc2)o1 447514353 DJQLAPGFUPUYCK-UHFFFAOYSA-N 398.422 5.244 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 454737014 ZVLNFKFTUHFLAX-UHFFFAOYSA-N 389.377 5.157 30 20 GKED N#Cc1ccsc1C(=O)N[C@H](c1cc(F)ccc1F)c1ccccc1Cl 460558574 ZUNIIMUPQCOIRJ-KRWDZBQOSA-N 388.826 5.071 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(COCC3CC3)c2)c2ccccc21 468813267 CQBJBQBYGKOUGP-UHFFFAOYSA-N 387.483 5.124 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 469665168 MEJXBFCRJMYVLL-MJGOQNOKSA-N 383.879 5.042 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)ccc1OCCC(C)C 474430320 HKVJUIJCKDFPJZ-INIZCTEOSA-N 386.517 5.190 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F)c1ccccc1 476622935 GGQOLVDTMPFWIA-XMSQKQJNSA-N 396.412 5.647 30 20 GKED CN(C(=O)c1ccccc1NCc1ccc(Cl)cc1C#N)C1CCCCC1 478365921 WAAHEXMQNRGLLB-UHFFFAOYSA-N 381.907 5.228 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 481298273 AZGPRCOPHSCICQ-HXUWFJFHSA-N 388.433 5.240 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1 483628322 YTFAHTKDZKBCJS-OXQOHEQNSA-N 397.519 5.979 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N[C@@H](CCCC#N)c1ccccc1 487209549 LJQNYHZFEUSFBV-IBGZPJMESA-N 375.497 5.284 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@@H]2CCCC(F)(F)C2)cc1 503138227 GFNJRCTXYSXHLY-QGZVFWFLSA-N 384.426 5.096 30 20 GKED Cc1cc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c(Br)s1 505830718 DMYQGQOKPNVRDX-OAHLLOKOSA-N 391.334 5.111 30 20 GKED Cc1cc(C)nc(Sc2ccc(NC(=O)c3cc(C#N)ccc3Cl)cc2)n1 505954114 LQVAVUCVOQMGBZ-UHFFFAOYSA-N 394.887 5.022 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1coc2ccccc12 510449894 ACKCVFOOLNCOCV-UHFFFAOYSA-N 384.460 5.386 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(Cl)c(Br)c1 510618334 YDIFDVBVBIAZNX-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C[C@H]1CCC[C@@H](N(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 511391530 POYORTDTHNAAFG-GHTZIAJQSA-N 391.515 5.374 30 20 GKED C[C@@H](c1ccccc1)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 512270103 NOLZUQNKWDZMME-MSOLQXFVSA-N 393.556 5.245 30 20 GKED Cc1ccc(-c2noc([C@H](C#N)Cc3ccc(C#N)cc3)n2)c(OC2CCCC2)c1 516995845 HUMPMOIDENTLNG-IBGZPJMESA-N 398.466 5.088 30 20 GKED CCN(C[C@H](C)C#N)C(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 517351652 VPKWUKGXSCVGAS-AUUYWEPGSA-N 390.911 5.321 30 20 GKED C=CCOc1cccc(NC(=O)NCc2ccc(-c3csc(C)n3)s2)c1 517730308 NPYABKXEIQBOGR-UHFFFAOYSA-N 385.514 5.067 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)[C@@H](Sc1ccccc1F)c1ccccc1 518494230 GHGZKFJUHSSUTH-QFIPXVFZSA-N 390.483 5.189 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)sc2ccc(C#N)cc12 519843861 TXKDMIFWDWDPFQ-ZDUSSCGKSA-N 391.521 5.728 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 520195641 GEAVTJCLOUSZRH-PXNSSMCTSA-N 381.545 5.990 30 20 GKED COc1cccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 520596711 WOMHJWHMOFHXQY-UHFFFAOYSA-N 387.439 5.023 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)c3ccc(C#N)cn3)nc2c1C 522678998 VVYHETHUNJUMEU-UHFFFAOYSA-N 398.491 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(F)cc1OCC1CC1 524897543 QPVVMJQIDPBGHJ-CQSZACIVSA-N 399.491 5.653 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Oc3ccccc3Cl)nc2)n1 531331289 NSZVORCDVJEESM-AWEZNQCLSA-N 397.887 5.597 30 20 GKED CC(C)Sc1ccc([C@H](C)NCC(=O)Nc2cc(Cl)ccc2C#N)cc1 537099055 GRSRCZAUTURIHB-AWEZNQCLSA-N 387.936 5.001 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(C(=O)N3CCCCC3)c2)CC1 537731826 YXTWLXDKLIBKCN-UHFFFAOYSA-N 387.527 5.129 30 20 GKED C[C@H](NCC#Cc1ccc(Cl)cc1)c1ccc(OCc2cccnc2)cc1 538123432 PGTDTGDEWZFEAN-SFHVURJKSA-N 376.887 5.016 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 540873396 GAXMIISVYBJJHB-UHFFFAOYSA-N 397.434 5.285 30 20 GKED COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)Nc2cccc(C#N)c2)c1 541260935 AFGHTAZYPJWPPA-ZEQRLZLVSA-N 397.478 5.330 30 20 GKED C[C@@H](NC(=O)N(Cc1cccnc1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543942586 TUADQDWCHMSOOT-GOSISDBHSA-N 396.494 5.055 30 20 GKED C=CC[C@@H](C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1)c1ccccc1 548288825 VVAAEZXTHGQXCW-HSZRJFAPSA-N 375.512 5.085 30 20 GKED CN(C(=O)c1ccc(NCc2cc(C#N)cs2)cc1Cl)C1CCCCC1 551451342 JPQIAFJXJXDPBG-UHFFFAOYSA-N 387.936 5.290 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCC(=O)c2ccccc21 555792192 NVWDACZGUBKVQT-QFIPXVFZSA-N 396.446 5.358 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c21 579445959 MWJTWTJXGICOLO-KGLIPLIRSA-N 388.496 5.015 30 20 GKED COc1ccc([C@@H](Nc2cc(C#N)ccn2)c2ccc(C(F)(F)F)cc2)cc1 588013466 QOYUOGDRUXYWRW-FQEVSTJZSA-N 383.373 5.182 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1coc(-c2ccccc2C(F)(F)F)n1 600935040 WZPBPIGTGILYNP-MHZLTWQESA-N 398.450 5.329 30 20 GKED CC(C)Sc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603960214 ILFWMANZRBTMCB-UHFFFAOYSA-N 389.480 5.498 30 20 GKED Cc1cccc2c(N3CCC(C(=O)c4ccc(Cl)cc4)CC3)c(C#N)cnc12 608080392 UCRMGEPOVRVCEC-UHFFFAOYSA-N 389.886 5.168 30 20 GKED Cc1cc(F)cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 608552903 QFNMJGBIRIOEDE-CYBMUJFWSA-N 378.350 5.253 30 20 GKED COc1cc2nc(/C=C/c3cccc(OCCCC#N)c3)sc2cc1OC 608845852 JJJFGRNDDPTCKJ-CMDGGOBGSA-N 380.469 5.166 30 20 GKED CCC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccn1 609206834 HABJFQHIMKQMCA-OAQYLSRUSA-N 386.455 5.408 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cc(C#N)ccc1OC(C)C 609261883 HXBYYLZDJWXDFA-HXUWFJFHSA-N 380.488 5.265 30 20 GKED COc1ccc(C2(NC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)CC2)cc1 609469543 RYYVCAJHGBFDGX-UHFFFAOYSA-N 399.450 5.170 30 20 GKED Cc1ccc(N(C(=O)c2ccc(C#N)nc2)c2nc3ccccc3s2)c(C)c1 609643306 SFZYDEDRCGTIMR-UHFFFAOYSA-N 384.464 5.158 30 20 GKED CCN(C(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccc(C#N)cc1 611186186 FSRPMLRFJQRISM-UHFFFAOYSA-N 383.423 5.286 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(C(C)(C)C#N)cc3)cc2)cs1 614180117 XILCACLIFXKUFY-MRXNPFEDSA-N 375.541 5.771 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 727233119 GFDNLYJBRXLCOE-KXBFYZLASA-N 399.466 5.425 30 20 GKED C=CCOc1ccc(/C=C(/Cl)c2nc(O)c3cccc(C)c3n2)cc1Cl 727264893 ZIUFGOQFJMKQDO-LFIBNONCSA-N 387.266 5.599 30 20 GKED C=CCOc1ccc(/C=C(\Cl)c2nc(O)c3cccc(C)c3n2)cc1Cl 727264894 ZIUFGOQFJMKQDO-WJDWOHSUSA-N 387.266 5.599 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3csc(-c4ccccn4)n3)c2)cc1 729375305 DJXKKWLXWNQWEA-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C/c1nc2ccccc2s1 730988890 DOYCXCNOSATQTF-VNDWYCCKSA-N 379.510 5.200 30 20 GKED C[C@@H](CC#N)OC(=O)c1ccccc1SCc1ccc(Br)cc1 733709153 FAXLWASKVAHZOM-ZDUSSCGKSA-N 390.302 5.200 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2ccc(OC)cc2F)cc1F)c1ccncc1 734459839 LIFALBFTXPBZNL-QFIPXVFZSA-N 394.421 5.083 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc(Cl)cc(Cl)c3O)c2)s1 740013561 FXKKHMGHTYRWQK-UHFFFAOYSA-N 389.307 5.589 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)NCc1cccs1 745724374 PQONXTMSFKALLR-UHFFFAOYSA-N 395.528 5.149 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\Cc1ccc(COC2CCOCC2)cc1 751522099 DUAWFFRISRTXKM-FMCGGJTJSA-N 394.298 5.014 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H]2Cc2ccccc2)cc1 752186738 SXVJHFWXJKJTRH-ZEQRLZLVSA-N 381.479 5.191 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc2ccccc2c1 753400297 MANYTTMXWBDBEP-IERDGZPVSA-N 382.488 5.943 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2cccc(OC(F)(F)F)c2)cc1OC 754047337 RTSFDPRQUCDOBZ-CQSZACIVSA-N 381.394 5.009 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cccc(Cl)c1Cl 754425222 AKGRMKCJSLVFAQ-QMMMGPOBSA-N 388.081 5.663 30 20 GKED Cc1sc([C@H](C)/N=C\c2ccc(O)c(O)c2O)nc1-c1ccc(Cl)cc1 755032576 XYIOPCHQFLQVPZ-UQXWMBKDSA-N 388.876 5.069 30 20 GKED N#CCOc1cccc(CC(=O)N[C@H](CCCc2ccccc2)c2ccccc2)c1 760262010 IPJZEJZVIQZTOL-RUZDIDTESA-N 398.506 5.012 30 20 GKED O=C(/C=C\c1ccc(Cl)c(Cl)c1)c1cc(Br)ncc1F 762424500 RZXTUNUGVMIRGJ-RQOWECAXSA-N 375.024 5.186 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cncc(C)c1 767368626 STSZHJYWDQOJKQ-UHFFFAOYSA-N 377.448 5.037 30 20 GKED Cc1csc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 774054751 LWDIRFRBLUMAOV-CQSZACIVSA-N 387.917 5.038 30 20 GKED C=C(C)[C@H](NCc1cc(C)cc(Br)c1O)c1ccc(F)c(F)c1 775318063 DVWOZOAEZQYDAK-KRWDZBQOSA-N 382.248 5.148 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)c(F)c1 776743551 PCZYEXQAAVJUAE-GKVSMKOHSA-N 386.470 5.463 30 20 GKED COc1cc2c(cc1NC(=O)c1ccc(C#N)c(Cl)c1)oc1ccccc12 777408285 OMNZSXLLKKBTDJ-UHFFFAOYSA-N 376.799 5.372 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ncc(C(F)(F)F)s1 788353604 AURMIDMQUVHSLM-SREVYHEPSA-N 398.406 5.629 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cn1 792883375 DHOKYSQNVZWUBK-KTKRTIGZSA-N 393.446 5.110 30 20 GKED C[C@H](Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccc(OCC#N)cc1 794836550 UBFWBBNOTDDMBI-NSHDSACASA-N 386.320 5.382 30 20 GKED C[C@@H](OC(=O)C1(c2cc(F)cc(C#N)c2)CC1)c1nc(-c2ccccc2)cs1 796992901 CNAVSPHOKIABGG-CQSZACIVSA-N 392.455 5.157 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 800578118 MJKAKDXOLABMCD-QFIPXVFZSA-N 398.934 5.436 30 20 GKED N#Cc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c(C(F)(F)F)c1 811690418 AOFXRKXLIOWIBD-FPLPWBNLSA-N 378.353 5.535 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(Cl)cc2)CCCC1)c1cc(C(F)(F)F)ccn1 813214494 YPALIYSFYAJRGP-INIZCTEOSA-N 392.808 5.442 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CC3(CCOCC3)C2)c1 814621964 HTPAOWMBKCUCQH-UHFFFAOYSA-N 388.552 5.208 30 20 GKED CC(C)c1ccc(-c2noc([C@H](CCCC#N)NC(=O)OC(C)(C)C)n2)cc1 818376559 RQHTYUWAKZODJI-KRWDZBQOSA-N 384.480 5.120 30 20 GKED N#C[C@@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1nc(C2CC2)cs1 842938898 MHOCBMXEATZUPJ-ZDUSSCGKSA-N 382.432 5.008 30 20 GKED CC(=NNc1ccc(-c2ccc(Cl)s2)nn1)c1c(C)nn(C(C)C)c1C 848415085 RODPEXXRGJOPSI-UHFFFAOYSA-N 388.928 5.089 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sc3ccccc3c2Cl)cc1 861176449 XSVKGQCBRSLVHG-UHFFFAOYSA-N 385.876 5.115 30 20 GKED COc1cc(N=Cc2cc(Cl)ccc2O)ccc1NC(=O)OC(C)(C)C 915983118 QJDHALMMMWFGGC-UHFFFAOYSA-N 376.840 5.152 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C(F)(F)c3ccccc3)c2)cc1 916452018 QFRGPIWYXTZGKN-UHFFFAOYSA-N 392.405 5.062 30 20 GKED CCOc1cc(/C=C2\CCOc3c(ccc(Cl)c3Cl)C2=O)ccc1O 921138470 MZMMPHWQLZQKAY-FMIVXFBMSA-N 379.239 5.147 30 20 GKED CC1(C)CCC(CN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)CC1 1459699827 IGDQYLJJPYUGIV-UHFFFAOYSA-N 388.515 5.363 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1ccccc1Oc1cccc(Cl)c1 1776030995 HLVUWAGEZACRIT-UHFFFAOYSA-N 380.831 5.667 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2cnc(-c3ccc(C(C)C)cc3)s2)CC1 1776169441 VSODWFFDIPQESF-UHFFFAOYSA-N 398.572 5.567 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Br)c(F)c1F 1776782796 KSNSNXSZPHADDG-CYBMUJFWSA-N 392.284 5.021 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Br)cc(F)c1F 1776783728 GGEDJXVVTIWFST-AWEZNQCLSA-N 392.284 5.021 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(F)c1OC(F)(F)F 1776784099 XBHPWXWLWQVJCC-CQSZACIVSA-N 379.394 5.018 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC)c(O[C@H](C)CC)c1 1776784262 ZGSVUWKDHOJSOP-IEBWSBKVSA-N 379.541 5.166 30 20 GKED CCCCCCCOc1ccc(/C=C\C(=O)c2ccc(CC(=O)O)cc2)cc1 1776785890 INIZUFHPVGWWDM-WJDWOHSUSA-N 380.484 5.559 30 20 GKED COc1ccc(C(=O)O)cc1/C=C/C(=O)c1sc(-c2ccc(C)cc2)nc1C 1777354597 BLKPUSCIXFXHSK-CSKARUKUSA-N 393.464 5.030 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ccc(/C=C\C(=O)O)cc1 1777488367 WNAYYDAJYDCNGP-MIMPSMLTSA-N 393.439 5.252 30 20 GKED O=C1/C(=C\c2cccc(Oc3ccc(F)cc3)c2)C[C@H](C(=O)O)c2ccccc21 1777698317 DVBYRNAPHODGDQ-FPIZWNAKSA-N 388.394 5.456 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2cccc(C)c2)cc1 10173233 OUKADEMDSJQDDG-UHFFFAOYSA-O 389.544 5.259 30 20 GKED COc1ccc(Cl)cc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 32288257 NESLGIYMQSNKKI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1nn(-c2ccccc2)c2sc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cc12 41545406 MUMOURKMDVLMHQ-MRXNPFEDSA-N 398.447 5.027 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(C)cc2C)cs1 54897275 CFZVEHMRLNXQPS-XYOKQWHBSA-N 390.508 5.649 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(Oc4cccnc4)cc3)n2)cc1 63262780 XYNYQRCKUFQTSX-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc(C(C)C)nc2c1cnn2C(C)C 65774985 BSFPPNWSRQDZOS-UHFFFAOYSA-N 390.531 5.007 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccccc1 127576853 GLHUMWAFNBILKJ-AWEZNQCLSA-N 377.419 5.052 30 20 GKED COc1ccc(CNc2cccc(SC(F)F)c2)cc1OCCCC#N 129223934 DRVZUUYWWYCCLQ-UHFFFAOYSA-N 378.444 5.305 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 152077540 OTAWGERVEQJBQV-CYBMUJFWSA-N 377.753 5.034 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)N[C@@H](CCC#N)c1ccccc1 160679208 CRMYXHYDSXEHAW-DEOSSOPVSA-N 398.510 5.147 30 20 GKED COc1ccc(-c2nc(CSCCCC(C)(C)C#N)cs2)c(OC)c1 161296179 FSBCKICRLRWDFX-UHFFFAOYSA-N 376.547 5.390 30 20 GKED COc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 175120118 PQFQOGMQZCJZEO-BLLLJJGKSA-N 384.888 5.328 30 20 GKED CN(Cc1ccccc1NC(=O)c1cccc(SCC#N)c1)C1CCCCC1 175556332 QDTUMAMABQYSIV-UHFFFAOYSA-N 393.556 5.319 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 188367710 XOJXOLRSEBDECF-UHFFFAOYSA-N 393.446 5.201 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cn(C)nc2-c2ccncc2)cc1 255638765 NLGXIGZQYFXAKL-QXMHVHEDSA-N 395.462 5.054 30 20 GKED CN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303382009 WDOMIANJBZJZBL-UHFFFAOYSA-N 375.403 5.154 30 20 GKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)c3coc(C4CCOCC4)n3)c3cccc1c32 328836336 XLSSWOCAMTWTLS-QAPCUYQASA-N 380.488 5.173 30 20 GKED C/N=C(/O)c1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1Br 329494912 DILZXECSIJVERG-BFHYXJOUSA-N 393.325 5.578 30 20 GKED CC[C@H](/C(O)=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1)c1ccccc1 329690545 DAHBXGGHMTYLDL-OALUTQOASA-N 397.519 5.621 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCC1CCC(F)(F)CC1 419602488 KVJIXWLMZNQXGI-CQSZACIVSA-N 398.544 5.578 30 20 GKED COc1ccc(-c2nnc(S[C@H]3CC[C@H](C#N)C3)n2-c2ccc(C)cc2)cc1 430091676 YNZSFBMAIROAHN-JXFKEZNVSA-N 390.512 5.036 30 20 GKED N#CCCC[C@@H](NC(=O)NCCCCc1ccc(Cl)s1)c1ccccc1 431298042 AAAYLIWIYBKOGX-GOSISDBHSA-N 389.952 5.459 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C[C@@H]1c1ccccc1 434082228 IWHIKUBXUZKXPW-JOCHJYFZSA-N 397.478 5.011 30 20 GKED C=CCNC(=O)Nc1ccc(N[C@@H](C)c2ccc3cc(OC)ccc3c2)cc1 439554283 WAWLHDGYSLTCGN-INIZCTEOSA-N 375.472 5.329 30 20 GKED N#Cc1cc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)ccc1F 444739571 UQGRRQUACYPUJE-MRXNPFEDSA-N 390.302 5.499 30 20 GKED C[C@H](O)CCCN[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 450722257 ZZFISSZKPCOSDZ-UFBFGSQYSA-N 397.281 5.078 30 20 GKED N#Cc1cc(N[C@@H](c2ccccc2)c2ccc(F)cc2)nc2ccc([N+](=O)[O-])cc12 462375874 GJKCSNCVIBLSEE-QHCPKHFHSA-N 398.397 5.355 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(F)c2Cl)cc1Cl 463391024 JVRJVWSIUANGCC-KRWDZBQOSA-N 399.252 6.040 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 464007209 QQBUKXYXIDUDAT-UHFFFAOYSA-N 389.858 5.161 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1COCCC 475544295 AQKMUPDNHNJKLB-UHFFFAOYSA-N 380.532 5.787 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1nc2ccccc2s1 475573034 RFWIYFNSXPOIGT-UHFFFAOYSA-N 379.529 5.512 30 20 GKED Cc1cccc(CN(Cc2ccccn2)C(=O)C[C@@H](CC#N)c2ccccc2)c1 475602719 ANHQTKXFXTZQRH-HSZRJFAPSA-N 383.495 5.006 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 476119370 QLELFYCCLGBMAZ-UXHICEINSA-N 387.445 6.300 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 476172570 ZAJHPRJNLNYTRX-HSZRJFAPSA-N 384.479 5.429 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC(C)(C)[C@@H]2c2ccncc2)cc1 476206218 HREQPUAILCEXFK-QHCPKHFHSA-N 397.478 5.277 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1ccc(C#N)cc1 485713787 DCVXPBMXMKGOSY-CQSZACIVSA-N 378.378 5.120 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 488632484 UXRSAUVSXCGRQG-QFIPXVFZSA-N 397.478 5.743 30 20 GKED CCCc1ccc([C@H](NC(=O)NCc2cccc(C#N)c2)c2cccs2)cc1 500225286 HYSXQKATRMSJSF-QFIPXVFZSA-N 389.524 5.161 30 20 GKED C[C@@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(C(F)(F)F)cc1 500458042 BTZQXVFSCLCQDQ-LLVKDONJSA-N 398.837 5.663 30 20 GKED N#C[C@@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccccc1Cl 505627589 AGVVDQANTFFZMI-UEWUEVEISA-N 396.840 5.170 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 510664895 QHHHLOIQAQOMRV-QHCPKHFHSA-N 397.478 6.028 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@@H](C)c1cc2ccccc2o1 510694432 XUIHGUMBEIIRLC-INIZCTEOSA-N 391.471 5.707 30 20 GKED CC[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(Cl)s1 510743741 APEIFDOLWYDMNA-INIZCTEOSA-N 376.909 5.090 30 20 GKED Cc1ccc(CSCCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 517473393 DUECPHYHVSBBGX-QGZVFWFLSA-N 399.585 5.302 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@H]1CCC[C@@H](C)C1 522150965 ILHPDYWSFXIZEI-UZLBHIALSA-N 378.472 5.193 30 20 GKED CC[C@H](NCC(=O)N(CCC#N)c1cccc(Cl)c1)c1ccc(Cl)s1 541628280 ADBMNVXLYRTGAY-HNNXBMFYSA-N 396.343 5.042 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1ccc(CC#N)cc1 541660795 RNSSHFPUSSLKOH-AWEZNQCLSA-N 381.932 5.689 30 20 GKED CC(=O)c1c(C)oc2ncnc(N[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)c12 542019197 SCOHILXZFJWQDS-AWEZNQCLSA-N 396.450 5.446 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)nc1)c1nc2cc(Cl)ccc2s1 542876736 GAVYSHKCZGAALX-HNNXBMFYSA-N 397.887 5.156 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 543618756 VUNHFOHAVOYKJU-SPXLFKILSA-N 378.491 5.040 30 20 GKED C[C@H](N[C@H](C)c1nc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543861460 RFWMTUIAYNMCPE-ZWKOTPCHSA-N 394.478 5.687 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c1C 543862626 DPFZEIWZMXGRGN-CYBMUJFWSA-N 378.419 5.313 30 20 GKED Cc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cnn1-c1ccc(F)cc1 550827911 SDBGPBCXPAUIBA-SBUREZEXSA-N 376.479 5.406 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCOc1cccc2ccccc12 554870802 HSXZTOQDWOEECK-UHFFFAOYSA-N 388.854 5.067 30 20 GKED C[C@@](C#N)(NC(=O)Cc1csc(-c2ccc(Cl)s2)n1)C1CCCCC1 559596129 KXCMAQWTYRSHJT-SFHVURJKSA-N 393.965 5.046 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1ccccc1SC 560149511 RGMFCZIRIMFCAT-ZDUSSCGKSA-N 380.966 5.139 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F 566887935 VPNNRSNJAQNJSQ-TZIWHRDSSA-N 388.417 5.173 30 20 GKED N#CCCCn1cc(C(=O)N2CC3(CCCC3)[C@H]2c2ccco2)c2ccccc21 598041305 SOFJSZYUPIKTBV-JOCHJYFZSA-N 387.483 5.296 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 608822538 KICKSLPZDBCZQZ-KRWDZBQOSA-N 383.561 5.234 30 20 GKED CCc1c(C)sc(NC(=O)c2cnn(-c3ccc(C)cc3)c2C(C)C)c1C#N 609032615 UREMTHLMJCQOIB-UHFFFAOYSA-N 392.528 5.360 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C2CC2)cc1Cl 609137794 ASMAVHRSOJMLDL-PZJWPPBQSA-N 379.891 5.402 30 20 GKED CCN(C(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 609221976 MHRNAIIYLJIBCG-GOSISDBHSA-N 385.467 5.204 30 20 GKED CCCN(C(=O)c1oc2ccccc2c1COC)c1cc(Cl)ccc1C#N 609286035 JRJCGGXYHCOLIK-UHFFFAOYSA-N 382.847 5.161 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 614406049 PKHCRDVHBNAOJH-AWEZNQCLSA-N 381.932 5.803 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N[C@H]2CCc3cc(C#N)ccc32)c1 618761524 GHVJEXFWWSUNBI-QFIPXVFZSA-N 399.498 5.031 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2OC)cc1 642467812 FCTRQLLESNCSQM-UHFFFAOYSA-N 388.467 5.708 30 20 GKED CC(C)n1ccnc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647634039 LMRCWKRJZOJBGY-UHFFFAOYSA-N 383.311 5.366 30 20 GKED C=CCC[C@H](NC(=O)NCc1cc(C(C)C)no1)c1ccc(C(F)(F)F)cc1 676725063 LGGXQXJUYATAQL-KRWDZBQOSA-N 395.425 5.324 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c[nH]c4cccc(C)c34)n2)cc1 729069808 HYXIGQSTALWUSU-SFHVURJKSA-N 385.492 5.327 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)/C=C\c1ccccc1Cl 731340866 UVORAAHNMMWSCG-FZDNWWAKSA-N 392.933 5.147 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3ccc(F)cc3)CCCCC2)c1 733770691 JYTWFFGLXIRAEE-NRFANRHFSA-N 394.490 5.025 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1cccc(OCc2ccccc2)c1 734094352 CJRBMLUTOPUHED-PFONDFGASA-N 394.474 5.407 30 20 GKED COC(=O)[C@H](Nc1cccc(CSC2CCCC2)c1)c1ccc(C#N)cc1 740898366 OWENXWXBWDFKPK-OAQYLSRUSA-N 380.513 5.060 30 20 GKED COCc1nc(CON=C(C)c2ccc(OCc3ccc(C)cc3)cc2)cs1 742356341 MJQPWBHDRALSIC-UHFFFAOYSA-N 396.512 5.118 30 20 GKED FC(F)(F)c1ccc(NN=C2CCCc3nc(-c4ccccc4)sc32)nc1 747042501 ORBDEHGOXKLGJA-UHFFFAOYSA-N 388.418 5.376 30 20 GKED CCn1nc(C)c(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1C 750912503 GGKZXIFOBNYIIY-RMKNXTFCSA-N 399.834 5.238 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)N(CC)[C@H](CC)c2ccccc2)cc1C#N 752302879 MOGOCUJFKOESJD-HXUWFJFHSA-N 394.475 5.132 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)C2)cc1 752484993 KMBOESHJGNRJIY-UKILVPOCSA-N 395.506 5.672 30 20 GKED CCCCCCCCNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1 755147594 QKSPOXPSJLXKJY-UHFFFAOYSA-N 394.559 5.169 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)c1 760002304 XIJDYGQECUFQPB-RDGATRHJSA-N 388.486 5.580 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)c1 762604219 MYPTTZZZGZPCAS-YVMONPNESA-N 382.366 5.075 30 20 GKED C=CC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccncc1 766019875 NOWFMWLHWJJCQV-RTBURBONSA-N 379.504 5.629 30 20 GKED COc1cc(C2SCCS2)ccc1OCc1ccccc1C(C)(C)C#N 767825810 SLLDXUAEZGPFTL-UHFFFAOYSA-N 385.554 5.554 30 20 GKED O=C(Nc1ccccc1SC(F)(F)F)c1ccc(F)cc1C(F)(F)F 769665320 UOVUJJPPWSJMAK-UHFFFAOYSA-N 383.288 5.709 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 774089050 HXLYCYGOJRPVPI-SUMWQHHRSA-N 390.439 5.232 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@@H]1c1ccccc1 775489777 XVEHDEDLQZAHAC-DKLXNKCPSA-N 381.479 5.567 30 20 GKED C[C@@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCOC1 781447183 DICWVAXEWPJLTL-SCLBCKFNSA-N 395.311 5.110 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCO1 781616555 KDHFMLHREBLKKU-YSZBQJHXSA-N 376.500 5.122 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)N(C2CC2)C2(C#N)CCC2)cc1 791003776 UMTARULALKHWDT-UHFFFAOYSA-N 387.487 5.219 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccn(C3CCCCC3)n2)cc1 791508351 DKGQETUFECKVBZ-QFIPXVFZSA-N 384.483 5.296 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)c(C)cc1Cl 796637364 VOODATOASOTLLY-ZDUSSCGKSA-N 395.673 5.225 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)c2c1 805856513 XCZPHMNYDCRBTO-HXUWFJFHSA-N 396.446 5.671 30 20 GKED N#CC1(CSc2nnc(COc3ccccc3Cl)n2C2CC2)CCCC1 806581890 DEQIGNKJDVYACI-UHFFFAOYSA-N 388.924 5.021 30 20 GKED C#C[C@H](NCc1csc(COc2ccc(C)cc2)n1)c1ccc(Cl)cc1 811517151 JNFZYYHUWSBEAH-FQEVSTJZSA-N 382.916 5.148 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/C(C)=C\c2ccccc2COC)C(=O)c2ccccc21 814191647 RWMFZWZXXHTAEW-KACTVDLOSA-N 390.479 5.096 30 20 GKED CC(C)[C@@H](CCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 815913636 XJSIGQAIJZXIDM-QZTJIDSGSA-N 395.453 5.513 30 20 GKED CC(C)Oc1ccc(-c2nc(C(=O)O[C@H]3CC[C@@](C)(C#N)CC3)cs2)cc1 836159369 VBJQPAQGVWIVDU-UEDWGHLCSA-N 384.501 5.227 30 20 GKED CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 838604712 WHTPHFFDKALXSQ-HSZRJFAPSA-N 392.547 5.108 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@@H]1CC[C@@H](c2ccccc2)C1 860469783 KTWNVDZTTNXHCQ-VSKRKVRLSA-N 388.511 5.043 30 20 GKED C=CCCC[C@H](C(=O)N(C)C1CCN(CCC(F)(F)F)CC1)c1ccccc1 883986524 WBZQKCZXRNZVHL-FQEVSTJZSA-N 396.497 5.002 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C)[C@H](C)c2ccccc2Cl)cc1OC 914490832 KYKLPJZRMDRAJH-DVFVSVACSA-N 385.891 5.146 30 20 GKED C=CCN(C(=O)c1cc(-c2ccccc2C)nc2c1cnn2C(C)C)C(C)C 915153453 LXZKYQWJRLOYJN-UHFFFAOYSA-N 376.504 5.024 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)no1 915354258 YKADFRQLFCNQFB-UNMCSNQZSA-N 386.455 5.008 30 20 GKED CC(C)(C)c1ccc(OCCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 916848437 BNQPDXDPBGPLJL-NRFANRHFSA-N 386.495 5.568 30 20 GKED CC(C)Cc1ccc(C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 916944703 LFBAXLNJZAGFCP-SFHVURJKSA-N 389.282 5.153 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3c(F)cccc3s2)cc1 916955691 SXCPJIGGLDXAQA-SUMWQHHRSA-N 394.471 5.515 30 20 GKED Cc1cccc(CCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 917042345 DYKXOOJWFRCGEY-OAHLLOKOSA-N 388.414 5.433 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccs1)c1nc2cc(C(F)(F)F)ccc2s1 917045659 ZHPVSMVESFAIQX-RXNFCKPNSA-N 378.400 5.266 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1cccc(OCCCC(=O)O)c1 1776032697 KKWGZQSSYRVOGE-UHFFFAOYSA-N 381.259 5.073 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2cccc(C)c2)cc1 1776788222 ROXGASAYEBDANW-QHCPKHFHSA-N 383.532 5.650 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccco3)CCC2)cc1 1785840835 KJIVMRKPGSJRGO-UHFFFAOYSA-N 380.488 5.020 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(Cl)cc2)cc1 10831822 NRBADNKYZBRPDF-UHFFFAOYSA-O 395.935 5.241 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCCCC2CCCC2)cc1 29180054 GXXWIANUYYEPFD-UHFFFAOYSA-N 378.541 5.551 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 41558490 QTVKCYCYNKNOIH-MRXNPFEDSA-N 383.398 5.100 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c1 51656065 IOYPGFWWOWLTRQ-PBHICJAKSA-N 397.425 5.199 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccccc2C)cs1 54897266 DKVPNALMIWMDBP-XFXZXTDPSA-N 380.444 5.171 30 20 GKED C[C@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccc(C#N)cc1 113380824 FDBMYMBXJOCYIR-HNNXBMFYSA-N 381.526 5.154 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3ccccc3)n2)cc1 121855398 BRFXMWDVIMAJMK-BEFAXECRSA-N 376.481 5.189 30 20 GKED COc1ccc(CNc2ccc(-c3nc(C)cs3)cc2)cc1OCCCC#N 125054474 VBJQUXADDFMOIS-UHFFFAOYSA-N 393.512 5.422 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccccc3OC)cc2)ccc1OCC#N 125545497 NTCFHPBJUWYIFN-NTUHNPAUSA-N 399.446 5.169 30 20 GKED N#Cc1ccccc1NC(=O)CCCC(=O)Nc1ccc(Nc2ccccc2)cc1 134135301 KQGUBJFTKWNODT-UHFFFAOYSA-N 398.466 5.049 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N(c3ccccn3)C3CCCC3)c2)cc1 154692240 NSYRYKPIWQLGHG-UHFFFAOYSA-N 397.478 5.122 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 185323918 BASYIMCOWPGEET-LPHOPBHVSA-N 379.529 5.450 30 20 GKED Cc1ncsc1/C=C/C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 186474656 BKAPTHCPVYCTCH-AATRIKPKSA-N 397.447 5.128 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(F)c1 303359357 POPCHDFXBQGNIA-MRXNPFEDSA-N 389.430 5.237 30 20 GKED COc1ccc2sc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c(C)c2c1 304067302 TUARJNOLYBOTAM-CYBMUJFWSA-N 396.537 5.865 30 20 GKED C[C@]1(/C(O)=N/CC2(c3cc(C(F)(F)F)ccc3Cl)CC2)CCC(O)=NC1 328785755 KNMWZSBXCCERLC-INIZCTEOSA-N 388.817 5.104 30 20 GKED O/C(CC1CCCCC1)=N/C/C(O)=N\[C@@H]1CCCc2cn(C3CCCC3)nc21 329497790 JLZDLUIABBMCNT-LJQANCHMSA-N 386.540 5.259 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nn(C)c1Sc1ccccc1 410343590 DRVDAYFFLMTGCP-UHFFFAOYSA-N 377.513 5.251 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@H]1CCC[C@@H](F)C1 424799375 JNJFUOABPATARQ-IACUBPJLSA-N 385.323 5.343 30 20 GKED C=CC[C@@H](C)NC(=O)C/C(=C\c1cccc(OC)c1)c1nc2ccccc2s1 426875209 MZCYCPAKAASRGH-APVMCDBPSA-N 392.524 5.316 30 20 GKED CCOc1ccc2nc(-c3ccc(NC(=O)N(CC)CCC#N)cc3)sc2c1 429223122 VJEYVLTZMCSCES-UHFFFAOYSA-N 394.500 5.129 30 20 GKED CCN(C(=O)Nc1cccc(C#N)c1C)[C@@H](C)c1cccc(C(F)(F)F)c1 431712447 SBCYQEATMXRKCO-AWEZNQCLSA-N 375.394 5.501 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)[C@@H](C#N)CCc1ccccc1 433301808 GNWXQKMNXLIVMW-OXQOHEQNSA-N 389.524 5.068 30 20 GKED Cc1ccc(-c2csc3nc(CSc4cccc(C#N)c4)nc(O)c23)s1 435041320 PHFKQPRWMNITBL-UHFFFAOYSA-N 395.534 5.598 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)N[C@@H](CCC#N)c1ccccc1 440244140 RHKADPGXIFQZMQ-DEOSSOPVSA-N 398.510 5.325 30 20 GKED C[C@H](Sc1nnc(-c2ccccn2)n1-c1ccccc1)c1cccc(C#N)c1 442905378 ZOPPDYRYXQJUNX-INIZCTEOSA-N 383.480 5.054 30 20 GKED N#CCCCn1cc(C(=O)N2CCCCC[C@H]2c2ccncc2)c2ccccc21 444038587 ZBZRRWJDIPPFRD-QFIPXVFZSA-N 386.499 5.098 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458826662 CWTFJPPSFKYZBT-NHCUHLMSSA-N 379.504 5.223 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1 463575807 FVNRWBGIWLWDSC-UHFFFAOYSA-N 390.439 5.045 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 463879891 QRFVBFWSVKJQAW-AWEZNQCLSA-N 393.468 5.157 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1F 469349946 YVXPTCNTALDBAR-LJQANCHMSA-N 399.897 5.625 30 20 GKED CC[C@@H](Cc1ccccc1)N(CC)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 469466523 KPPQRELKSGIWIF-QFIPXVFZSA-N 399.494 5.229 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2c(ccc(OC)c2OC)C1 475548526 BQMTUUSBDMIERE-UHFFFAOYSA-N 394.515 5.146 30 20 GKED N#CC[C@H](CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 476652942 BNJQCIXTVHAGGV-MOPGFXCFSA-N 386.417 5.109 30 20 GKED CC(C)(NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 477001896 KPRHUMZBVNCEPE-MRXNPFEDSA-N 390.405 5.024 30 20 GKED CN1CCC[C@H](CN[C@H]2CCCCc3cc(C#N)ccc32)[C@H]1c1cccs1 481667829 KNBAYLRKYHKQBD-NWSQWKLXSA-N 379.573 5.060 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3coc4cc(F)ccc34)n2)cc1 483513251 MRQMMGGSMBZYEY-INIZCTEOSA-N 392.411 5.194 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1cc2ccccc2o1 486766596 WDHRKKWYMTZIJO-OAHLLOKOSA-N 396.537 5.556 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1 489086049 BCGXWTVLJGIPLD-GFCCVEGCSA-N 397.466 5.897 30 20 GKED COc1ccc2ccc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1 496356895 MLDDWRYBBORJTB-KRWDZBQOSA-N 391.377 5.083 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2sccc2C#N)cc1F 497984483 YDGYCPJKNXFFFS-UHFFFAOYSA-N 382.416 5.121 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)o2)c(C)c1 499836406 INIFZVZBXMALIL-IBGZPJMESA-N 394.858 5.124 30 20 GKED C=CCn1c(SCC(F)(F)F)nc2scc(-c3cccs3)c2c1=O 501580673 MSQREVJTCLXKKY-UHFFFAOYSA-N 388.461 5.027 30 20 GKED N#CCSc1cccc(C(=O)N2CCCC[C@@H]2CCCc2ccccc2)c1 502395046 VAIXBVJYKAYBCX-OAQYLSRUSA-N 378.541 5.320 30 20 GKED N#CC1(CCCSCc2cc(Br)ccc2Cl)CCOCC1 507693763 IIHRVGLPTFXBKA-UHFFFAOYSA-N 388.758 5.436 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C 510856626 HLDFEUGRULYLPE-ZHRRBRCNSA-N 377.488 5.701 30 20 GKED N#C[C@H](C(=O)c1cccc(C(F)F)c1)c1nc(-c2c(F)cccc2F)cs1 511748916 WOCUUNHUAGBNJY-GFCCVEGCSA-N 390.361 5.516 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cnn1C1CCCCC1 512719925 HATWNYHJTNULHE-GOSISDBHSA-N 390.512 5.310 30 20 GKED Cc1ccc(F)cc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 513960327 FTFYVIPQBJVPAB-UHFFFAOYSA-N 391.421 5.379 30 20 GKED COc1cc(Cl)ccc1-c1noc(-c2cn(CCCC#N)c3ccccc23)n1 515360036 RXUVEWFWCXOZHA-UHFFFAOYSA-N 392.846 5.324 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Cl)c3cccnc23)c2ccccc21 515975121 XGAXSLUVZTVYCY-UHFFFAOYSA-N 388.858 5.399 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1cccc(OCc2cccs2)c1 518123270 GDLBNHQPUHUHHI-UHFFFAOYSA-N 379.485 5.008 30 20 GKED CCCCN(CCOC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 518838297 BKDZQJZMKPQNAT-FQEVSTJZSA-N 399.922 5.276 30 20 GKED COc1ccc([C@H](NCc2cccc(OCc3ccccc3C#N)c2)C2CC2)cc1 520933554 CXWVJMYYVZRWQV-AREMUKBSSA-N 398.506 5.387 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1)c1ccc(C#N)cc1 521768473 RLRIRJQPRLYLEU-ROUUACIJSA-N 389.524 5.654 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)s2)c2cc(F)ccc2F)c1 537327062 HDVHSBMMNJISFW-HXUWFJFHSA-N 386.492 5.499 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1coc(-c2ccccc2Cl)n1 538441024 YFFFAGVGEMXLKS-CYBMUJFWSA-N 397.887 5.499 30 20 GKED C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(C#N)cc1 540597695 SOPSOVMNLRTXRN-LJQANCHMSA-N 378.479 5.262 30 20 GKED CCO[C@@H](C)c1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 543873897 PDEPYWLEUNWSPC-IRXDYDNUSA-N 391.540 5.630 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@H]1CC[C@H](C#N)C1 549933762 AIBQKLVFYCAZBZ-RBOXIYTFSA-N 390.350 5.224 30 20 GKED Cc1cccc([C@H](NCc2ccc(Br)cc2C#N)C(F)(F)F)c1 553879612 VSZONSAVZBHNOP-INIZCTEOSA-N 383.211 5.022 30 20 GKED Cc1c(C(=O)N2CCC[C@@H]2CC(=O)c2cccs2)sc2ccc(C#N)cc12 572065297 KKUVQVRNHVESJI-OAHLLOKOSA-N 394.521 5.021 30 20 GKED N#CCCCCc1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 594529745 LCBAJIBDEHBHFX-UHFFFAOYSA-N 388.349 5.179 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCc4cc(F)c(Cl)cc43)ccc21 599045055 TZTDSESWRDFGLH-HXUWFJFHSA-N 397.881 5.161 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C(F)F)o1 599390630 NPOXZDOOKPXMKE-UHFFFAOYSA-N 390.333 5.494 30 20 GKED Cc1cnc([C@H](NC(=O)Nc2cccc(C#Cc3cccs3)c2)C2CC2)s1 608273012 AQMDDPBMLVQRRV-LJQANCHMSA-N 393.537 5.186 30 20 GKED C[C@H](N[C@@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1)c1cccc(C#N)c1 608381768 MYJPYWSAJSSSKH-BXKMTCNYSA-N 379.463 5.314 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCc4sccc4C3)cc2)cc1 609339099 BIKUCNQHNMWALS-UHFFFAOYSA-N 389.480 5.392 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c(Cl)c1 609640815 XEICJMVCFRMUAH-UHFFFAOYSA-N 390.870 5.660 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 609693744 FRDMJVYSHRIKGY-HXUWFJFHSA-N 398.506 5.772 30 20 GKED Cc1ccc(-c2ncc(C(=O)N[C@@H](CCC#N)c3ccccc3)s2)c(C)c1 610976342 NEXOXPPQTCQPPY-IBGZPJMESA-N 375.497 5.202 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc4c(Cl)cccc4s3)CC2)cc1 611247188 MWNHLSNGNOMVLE-UHFFFAOYSA-N 378.884 5.356 30 20 GKED N#CC[C@@H](CC(=O)Nc1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 619516314 OOWGAIWYAUDAFC-ZDUSSCGKSA-N 389.402 5.341 30 20 GKED Cc1cc(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c(C)[nH]1 648494221 DYJSHLOVTHTPBQ-UHFFFAOYSA-N 382.279 5.173 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1Br)c1ccccc1 677564707 CGLCZUMYEOSHEV-JXFKEZNVSA-N 384.317 5.473 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)ccc1O 728232072 SDHLGMFZAOFFTA-LUAWRHEFSA-N 391.854 5.502 30 20 GKED CN(CCC#N)c1ccc(CNCc2ccccc2Sc2ccccc2)cc1 730579160 XZWXJHQBRRWJLM-UHFFFAOYSA-N 387.552 5.477 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(Oc2ccc(Cl)nn2)cc1 733205020 HVHLEXOSBIHONL-UHFFFAOYSA-N 394.645 5.685 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccccc2Nc2ccccc2)c1 733789684 QUCWQFBVMSTTRV-HXUWFJFHSA-N 385.467 5.041 30 20 GKED C#CCOc1ccc(CN[C@@H](C)c2sc(-c3ccccc3F)nc2C)cc1 736641907 OSMMFXSUZAYAGX-HNNXBMFYSA-N 380.488 5.120 30 20 GKED CC(=NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)s1)c1cnccn1 745208334 GITLWGNZMLVNRP-UHFFFAOYSA-N 375.284 5.355 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)cc(OC)c1OC 747188310 LYVCDJZQFBZEBQ-KTKRTIGZSA-N 380.465 5.337 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2)c1)c1ccc(N2CCOC2=O)cc1 748583088 ASXRLNSZXSSFAC-NTEUORMPSA-N 399.446 5.118 30 20 GKED N#C[C@H](NC(=O)c1cc2cccc(Cl)c2o1)c1cccc(C(F)(F)F)c1 753298888 LDOUOMGMQKDHGS-AWEZNQCLSA-N 378.737 5.100 30 20 GKED CCCC(=O)Nc1ccc(O)c(C(C)=NNc2cc(C(F)(F)F)ccc2F)c1 753946943 MLNAZDRVHYFQQH-UHFFFAOYSA-N 397.372 5.125 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2\CCc3sc(Br)cc3C2=O)cc1 754687792 NAFKWZMWHOEHFZ-ZWSXMNCCSA-N 388.286 5.014 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cc(Br)cc(Cl)c1O 756628862 YLQMIZZDQHDPEZ-MNOVXSKESA-N 379.685 5.092 30 20 GKED O=C(/C=C/c1ccc(F)cc1C(F)(F)F)c1cc(Br)ncc1F 762428139 VVZJXQCNDSBAGB-DUXPYHPUSA-N 392.121 5.037 30 20 GKED N#CC(CCOC(=O)CCCC(F)(F)F)(c1ccccc1)c1ccccc1 771124696 HNBRDSMRWOMIPC-UHFFFAOYSA-N 375.390 5.162 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)cc1Cl 777612894 NLDSZRFHTLKEIR-UHFFFAOYSA-N 393.899 5.088 30 20 GKED C[C@@H](Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1ccc(C#N)c(F)c1 777667629 RLJNFZCSIXIOHW-QGZVFWFLSA-N 399.469 5.002 30 20 GKED N#CCOc1cccc(NCc2sc(Sc3ccccc3)nc2Cl)c1 779588343 KUQRTBNAAONIKR-UHFFFAOYSA-N 387.917 5.462 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 780359411 VSWHQECIWMYZDM-KRWDZBQOSA-N 396.487 5.513 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)s2)o1 781756179 WSWIGUMHHZMBSC-HNNXBMFYSA-N 388.448 5.312 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(N2CCCC2)cc1 789458058 XQSFXZSSPDDMJC-UHFFFAOYSA-N 377.532 5.460 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571459 OYTNLFQFJPPFJC-CYBMUJFWSA-N 383.448 5.033 30 20 GKED Cn1cc(/C=C/C(=O)c2cnn(C3CCCC3)c2)c(-c2cc3ccccc3o2)n1 799897041 KCGRIDLRSSOYSU-ZHACJKMWSA-N 386.455 5.041 30 20 GKED C=CC[C@H](NCc1cc(C(F)(F)F)ccc1Br)c1ccncc1 810145354 AAHRBRZZAKEBRQ-INIZCTEOSA-N 385.227 5.270 30 20 GKED N#Cc1ccc2c(c1)C(=O)/C(=C\c1cccc(NC(=O)c3ccccc3Cl)c1)C2 811693224 GKUGRJLHJPQKME-ZDLGFXPLSA-N 398.849 5.286 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1cnccc1C#N)CC(C)(C)O2 811862749 JSEVXMNYOJHKJC-KRWDZBQOSA-N 394.475 5.015 30 20 GKED CC(C)N(CC(=O)[C@H](C#N)c1nc2ccccc2s1)[C@H](C)c1ccsc1 817287153 KUEGFEWGAYWEJO-ZBFHGGJFSA-N 383.542 5.006 30 20 GKED C#CC[C@@H](NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1)c1ccccc1 825980339 ZDXUJCYDIJOCNQ-HXUWFJFHSA-N 393.487 5.228 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)[C@@H]1CCCC2(CC2)C1 850759129 GKTYGMOETTXBGG-MJGOQNOKSA-N 388.467 5.097 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)SC1=Nc2ccccc2CS1 857759098 WACFLNSSTFTAOX-AWEZNQCLSA-N 388.583 5.319 30 20 GKED COc1cc(/C=C/C(=O)c2sccc2Br)cc(Cl)c1OC 915113861 XFPHKIHYPZLJOO-ONEGZZNKSA-N 387.682 5.077 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc3ccccc3c2Cl)cc1 916908929 GMXVVTLWTZHRDV-HNNXBMFYSA-N 382.872 5.078 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3c(s2)CCCC3)cc1 916948502 WDOFVOBWFDGCHN-RDTXWAMCSA-N 380.513 5.102 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 917045879 BWXBAEPZTWTBNK-INIZCTEOSA-N 396.899 5.406 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)[C@H](C#N)c1nc2ccccc2o1 917509826 BAQZVCMHWTVVLB-JKGDOXCYSA-N 384.435 5.806 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(C=NNc2ccc(Cl)cc2)cs1 917530324 DPAZHFPALYCXHW-UHFFFAOYSA-N 388.855 5.066 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 920026079 RSQIGYFVFFVEKQ-RUZDIDTESA-N 398.506 5.838 30 20 GKED C=CCn1c(C)nn(CN(C2CC2)[C@@H](C)c2ccc3ccccc3c2)c1=S 920306234 VEZHHZMQTVKGOO-INIZCTEOSA-N 378.545 5.245 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(OCc3ccc(Cl)cc3)cc2)c1 1776036800 VSNONCGWKSRCDY-UHFFFAOYSA-N 380.831 5.063 30 20 GKED Cc1cc(Br)cc(C(CC(C)C)=NNc2cccc(C(=O)O)c2)c1 1776038280 AZZDXKVHLRTKLN-UHFFFAOYSA-N 389.293 5.318 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776700108 ZIOUIOMRNQDRKP-AORWBKJGSA-N 382.456 6.148 30 20 GKED CCCCCCCOc1cccc(CNCc2ccc(CCC(=O)O)cc2)c1 1776787693 SLWKAZARSBJTOP-UHFFFAOYSA-N 383.532 5.343 30 20 GKED CCCCCCCOc1cccc(CN[C@@](C)(CCC(C)(C)C)C(=O)O)c1 1776788080 PRGMIBSCRSROQA-QHCPKHFHSA-N 377.569 5.795 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)c1cccc(O[C@@H](C)C(=O)O)c1 1776807985 OHRIELQWYKPCDK-FIPLFPIMSA-N 392.451 5.523 30 20 GKED CN(CCC#N)c1ccc(CNCCCCCCCCCCCC(=O)O)cc1 1777054623 VHXKIVPPJXEHLH-UHFFFAOYSA-N 387.568 5.112 30 20 GKED N#CCCCSc1nc2cc(Cl)ccc2c(=O)n1-c1ccc(Cl)cc1 6093882 LRLIVHRUWIAJPR-UHFFFAOYSA-N 390.295 5.088 30 20 GKED Cc1ccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2S[C@H](C)C#N)cc1 6841268 JQKFEGYITFLGMZ-VYVDHXHBSA-N 389.524 5.507 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccccc3)c(-c3ccccc3)n2)c(F)c1 11235837 SGVGBJNNLPSRDY-UHFFFAOYSA-N 398.466 5.509 30 20 GKED C=CCN(C(=O)CCCc1c[nH]c2ccccc12)c1nc2c(s1)CCCC2 23650977 GMWCVIHXYSCDSA-UHFFFAOYSA-N 379.529 5.045 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc4ccccc4s3)s2)o1 48824598 JHLQTWWIUMLJGE-GFCCVEGCSA-N 379.466 5.120 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1nc2ccccc2[nH]1 56469926 OOQURVIOUVQYTN-UHFFFAOYSA-N 396.450 5.107 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1CC2)c1nc2ccccc2s1 60488248 IKTPCJCBJPISFF-MRXNPFEDSA-N 386.501 5.613 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)C(c1ccccc1)c1ccccc1 62067032 QCPDJACWPLYEAN-MOPGFXCFSA-N 383.495 5.139 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3ccc(N(C)CCC#N)cc3)oc12 66236783 RPZKMRIQDYWPAJ-KRWDZBQOSA-N 377.488 5.032 30 20 GKED C=CCCO[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67798823 PKKCZBBWPFDSKI-SMDDNHRTSA-N 395.311 5.274 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1 78665475 HJVDSGOKCQNUKB-LBPRGKRZSA-N 395.311 5.405 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2nc(-c3ccccc3)cs2)cc1OC 107321546 XKCRVHMIRPPCBD-MRXNPFEDSA-N 380.513 5.234 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 110308241 FFLDOTWXLIZEIR-HZPDHXFCSA-N 390.430 5.453 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccccc2OCc2ccccc2)cc1 110964380 DNMPYDCRKMCXBV-NRMGUKERSA-N 383.447 5.453 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 111783178 HJBFUVDBPGDJJV-UHFFFAOYSA-N 393.531 5.242 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(Oc2ccncc2)c1 112637586 ABIYJYLVNKNGOI-MRXNPFEDSA-N 389.480 5.378 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 117317923 XTKUBDAGDDYJDV-OALUTQOASA-N 396.581 5.255 30 20 GKED N#C[C@@H](C(=O)[C@H]1CSc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 118600142 KSUKEJZFCHUOKP-STQMWFEESA-N 398.459 5.154 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3ccccc3)n2)cc1 121855023 BRFXMWDVIMAJMK-HNAYVOBHSA-N 376.481 5.189 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1c(Cl)nc2sccn12 132800001 WILRBMHVUZYZDD-OWOJBTEDSA-N 377.903 5.130 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nnc(-c2cccc(Cl)c2)o1 133850692 SELVMMBAMCDRFY-ZDUSSCGKSA-N 384.892 5.396 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 137446932 OTRIIXKZGJEDSL-UWJYYQICSA-N 393.556 5.924 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccccc1Oc1cccc(F)c1 156116642 UYVIBGGPEXMPRM-UHFFFAOYSA-N 379.391 5.159 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Nc3cc(Cl)ccc3C)n2)cc1 160125463 HWDZJTYCFZQKJD-MRXNPFEDSA-N 397.887 5.026 30 20 GKED COc1ccc([C@H](Cc2ccccc2C)NCc2cc(C#N)cs2)cc1OC 177692594 HHGHZNFNMIVEMI-NRFANRHFSA-N 392.524 5.019 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1 185433615 YBURINNEAIGZBT-VHSXEESVSA-N 377.259 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1nnc(-c2ccccc2)o1 189881252 SCVBDYOTBZSPLO-UHFFFAOYSA-N 375.472 5.160 30 20 GKED O=C(Nc1cccc(/C=C2\Cc3c(O)cccc3C2=O)c1)c1ccc(Cl)cc1 205589587 HDKASTVYMOWRCS-LFIBNONCSA-N 389.838 5.120 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\Sc3ccccc3)n2)cc1 255381930 SKNQSYXBKSRFHD-RXQFDZFGSA-N 387.489 5.164 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 281544417 XFGOWURSVSYFPJ-WMZOPIPTSA-N 397.548 5.056 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 303324715 VQEYAMZFZYFMCZ-GOSISDBHSA-N 385.467 5.407 30 20 GKED C=CCc1cc(C(=O)NC(c2cccs2)c2cccs2)cc(OC)c1OC 303730801 DRLIJLPHCSCKPZ-UHFFFAOYSA-N 399.537 5.075 30 20 GKED OC(=Nc1cccc2c1OCCC2)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329418866 DUUNUFDGANUOPZ-GOSISDBHSA-N 379.504 5.106 30 20 GKED CSCc1ccccc1N=C(O)N[C@H]1CCCc2cn(C3CCCC3)nc21 329518606 NRIWHSQCTWJHOO-IBGZPJMESA-N 384.549 5.074 30 20 GKED Cc1ccccc1/C(O)=N/C1CCN(/C(O)=N/[C@@H]2CCCCC23CCCC3)CC1 329820104 PIBIFORTXDYOQC-OAQYLSRUSA-N 397.563 5.181 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C2CC2)cc1F 433129233 YUGHYLBDSZBEEX-AWEZNQCLSA-N 383.492 5.277 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1ccc(SC)c(OC)c1)c1ccccc1 435109715 DUVCDHREBJQGLS-LJQANCHMSA-N 384.545 5.266 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438636693 ZHYPHGQARIFIRP-GOSISDBHSA-N 375.394 5.438 30 20 GKED COc1cc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)ccc1C#N 440637087 LJEBFMBLSNFXHJ-LJQANCHMSA-N 394.824 5.480 30 20 GKED CCc1nc2c(s1)[C@@H](N(C)C(=O)N[C@H](CCCC#N)c1ccccc1)CCC2 458794590 BHRHXBSCKOCIHF-MJGOQNOKSA-N 396.560 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)c1ccccc1C(C)(C)C 460828549 JRLWPRIEKVPPLW-HNNXBMFYSA-N 388.558 5.179 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](c2c(F)cccc2F)C1 469798423 FCBOUGXBCALXLX-QGZVFWFLSA-N 388.417 5.133 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Sc2ccccc2C#N)cc1 471164493 GBTRIVMKINTWCY-UHFFFAOYSA-N 377.513 5.254 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(-c2ccoc2)nn1-c1ccccc1)c1ccccc1 475531255 MIIZFZOXQHTJBV-IBGZPJMESA-N 396.450 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H](OC)c1ccc(F)cc1 475576368 SZRXHJWKJWQBCU-OPAMFIHVSA-N 384.495 5.575 30 20 GKED C[C@H](NC(=O)NCCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 478629157 GCPYKPIMMJJGCU-ZDUSSCGKSA-N 395.450 5.488 30 20 GKED C=C(C)[C@H](NCc1ccc(OCc2ccccn2)cc1)c1ccc(F)c(F)c1 479414191 UVJGSQQIULPNSR-QHCPKHFHSA-N 380.438 5.346 30 20 GKED CCOc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1F 483465881 PEJRLVVWIWTUIQ-UHFFFAOYSA-N 376.387 5.141 30 20 GKED COc1ccc(NC(=O)c2ccc(NCc3ccccc3C(C)(C)C#N)cc2)cc1 486439023 WTZAGMBIHDVIIP-UHFFFAOYSA-N 399.494 5.361 30 20 GKED Cc1c(C(=O)N[C@H](CCCC#N)c2ccccc2)oc2c1ccc1ccccc12 487599101 CLDUBCNCRFQHOK-JOCHJYFZSA-N 382.463 6.059 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C)c1ccccc1 488885819 FPXSWJQDSLJSLA-HXUWFJFHSA-N 378.516 5.668 30 20 GKED CCC(C)(C)OCc1cccc(N[C@H](C)C(=O)Nc2ccccc2C#N)c1C 494917938 AHYZUQJVWNWGPO-QGZVFWFLSA-N 379.504 5.011 30 20 GKED COCc1cccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c1 499151477 RHYQJUSFEPOMHX-MRXNPFEDSA-N 382.529 5.169 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3c[nH]cc3-c3ccc(Cl)s3)CC2)cc1 503889561 GOSTXLUUBOLMTN-UHFFFAOYSA-N 393.899 5.198 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1 510553028 WHAKMHCWQKORJP-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCn1c([C@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@H]1c1cccs1 516895970 VLEGMJZZDIVRHT-YJBOKZPZSA-N 398.507 5.146 30 20 GKED N#CCCSc1ccccc1NCC(=O)N(c1ccccc1)C1CCCCC1 519424909 KCQFORRWLWJCLL-UHFFFAOYSA-N 393.556 5.470 30 20 GKED COc1ccc([C@@H](NCc2cccc(OCc3ccccc3C#N)c2)C2CC2)cc1 520933557 CXWVJMYYVZRWQV-SANMLTNESA-N 398.506 5.387 30 20 GKED CCC1CCC(N(C)C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)CC1 521206330 ACECMCSZPNOACA-UHFFFAOYSA-N 382.533 5.038 30 20 GKED Cc1ccc(SCCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 521768834 JKQBMKYNCIMFIM-INIZCTEOSA-N 379.312 5.165 30 20 GKED C=CCOc1cccc(CN[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 521828655 OHOMAUCVBOAQPK-HNNXBMFYSA-N 382.504 5.673 30 20 GKED N#Cc1c(NC(=O)CCc2ccnc3ccccc23)sc2c1CCCCCC2 522966927 JVRYIBKLIHYURF-UHFFFAOYSA-N 389.524 5.398 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC)c1ccccc1OCC 523644186 WZLGGEUJZAWHEO-OAQYLSRUSA-N 379.504 5.030 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524138337 KUNSULFMUZSZLA-GOSISDBHSA-N 388.467 5.171 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(C#N)cc1 524598157 JYQQJKXWQQHLIZ-FQEVSTJZSA-N 383.495 5.340 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C1CC1 534224963 VVIAYVQJQBAYGN-LLVKDONJSA-N 391.397 5.266 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C3CC3)C2)cc1Cl 535001702 ZGQCRQCKOWYYFE-XLIONFOSSA-N 379.891 5.259 30 20 GKED C=C[C@@H](CC(=O)N(CCc1ccccn1)Cc1ccc(F)cc1)c1ccccc1 535345685 RGNMNNSDTZFJPB-NRFANRHFSA-N 388.486 5.152 30 20 GKED CC(C)c1oc([C@@H]2CCCN2Cc2cc(C#N)cs2)nc1-c1ccccc1 538719523 QTBGGRVSPHPRKO-IBGZPJMESA-N 377.513 5.735 30 20 GKED C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(OCc2ccccn2)c1 540704833 AXEZBJOYDIXCQN-IRXDYDNUSA-N 375.447 5.083 30 20 GKED CSc1cccc([C@@H](NCc2cccc(C#N)c2F)c2cc(F)ccc2F)c1 541293773 ZRPZGQZXVNRXOU-JOCHJYFZSA-N 398.453 5.577 30 20 GKED COC[C@H](C#N)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 542189272 HTTUPRPQNIDOPB-GMAHTHKFSA-N 395.506 5.095 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CC3CCC(C(F)(F)F)CC3)n2)cc1 543041255 MZZRWNXYPQSHDS-UHFFFAOYSA-N 393.434 5.379 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1ccc(Cl)c(C#N)c1 544675699 SFEPVSGVBDEYPB-AWEZNQCLSA-N 395.915 5.477 30 20 GKED CC[C@H](CC#N)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 546585880 VERFSIKEDVPYLN-YARYAAFXSA-N 387.508 5.205 30 20 GKED C[C@@H](Nc1nc(-c2cccnc2)nc2sc3c(c12)CCC3)c1ccc(C#N)cc1 552479006 DWFRFJAYMOLRPR-CQSZACIVSA-N 397.507 5.287 30 20 GKED Cc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 553404295 WGFPIGVBFKXBHM-INIZCTEOSA-N 381.545 5.390 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(Cc2ccc(Cl)cc2)CC1 553447734 CCMBRMJNYHNCDB-UHFFFAOYSA-N 385.939 5.045 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc(Cl)c1Br 560221091 GYQBKPOJCBINEC-HNNXBMFYSA-N 399.675 5.449 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCSC4(CCC4)CC3)c2)cc1 566667485 BIRWEIWEHGFPMR-UHFFFAOYSA-N 393.512 5.244 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cnc(-c4cccnc4)s3)c(C#N)c2[C@@H](C)C1 569567360 ZAULMMJNJKKMLO-RYUDHWBXSA-N 394.525 5.076 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1cc(Cl)cc(Cl)c1OC(F)F)CC2 573371381 XDYFCISXSXVVEF-MRXNPFEDSA-N 383.225 5.244 30 20 GKED CC(C)(C)[C@@H](NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 580508999 HMCSPAHAOPGHNC-VXGBXAGGSA-N 388.327 5.095 30 20 GKED N#CCn1c(C(=O)Nc2cc(Cl)ccc2C(F)(F)F)cc2ccccc21 589022388 RDTMBOIJTGVNQD-UHFFFAOYSA-N 377.753 5.089 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC2(CCSCC2)CC1 602840172 JTXUSAOKMNFDLI-INIZCTEOSA-N 389.590 5.079 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Cl)sc3Cl)cn2)c1 603623145 FMIGUOZNAXXYFU-UHFFFAOYSA-N 390.251 5.366 30 20 GKED N#Cc1ccc(/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)nc1 603894483 XUXDVZLWVXAPCT-HYXAFXHYSA-N 396.200 5.054 30 20 GKED C=CCn1c(SCc2csc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1 603938361 KDQJZUTVNFKTTQ-UHFFFAOYSA-N 392.893 5.047 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(Cl)s2)cc1 604003507 GZVHWYHELMUAGB-UHFFFAOYSA-N 382.872 5.299 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccsc3[nH]2)cc1Cl 609164522 PWEHQYZXRFWXPG-KRWDZBQOSA-N 391.883 5.791 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1c(Cl)cccc1Cl 609377039 NABWCCDTQJMFDY-CHWSQXEVSA-N 393.339 5.987 30 20 GKED COc1ccc2[nH]cc(C3CCN(c4c(C#N)cnc5c(C)cccc45)CC3)c2c1 610274194 YJTIEAWBNASTEF-UHFFFAOYSA-N 396.494 5.289 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2c(O)cccc2F)c1 610339906 ZZOZXIOXGRQLQT-UHFFFAOYSA-N 382.778 5.101 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)N[C@H](C)c1cccc(C#N)c1 610349138 ZSFICBJEQYBUCI-ZBFHGGJFSA-N 390.512 5.112 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccccc3OC)n2)CCCCC1 625937314 VGCVYHKZKJPLRV-UHFFFAOYSA-N 399.560 5.205 30 20 GKED N#C[C@@H](C(=O)c1cc[nH]c1C1CCC1)c1nc2cc(C(F)(F)F)ccc2s1 651266425 PQYOLKLHVBTDJO-ZDUSSCGKSA-N 389.402 5.401 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(OCc2ccccc2F)CC1 669727499 NSMIQLPJZSDGCJ-UHFFFAOYSA-N 382.479 5.157 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(O)c(F)c1 728439308 ZJBHFRCSJXZVEE-VURMDHGXSA-N 393.361 5.570 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)c2c1 730092710 QBTPXMFPCHBKKI-HNNXBMFYSA-N 389.238 5.051 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 730895259 FSNLRAZDJIKDTD-ILBGXUMGSA-N 383.495 5.789 30 20 GKED C[C@@H]1CCCC[C@@H]1OCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679245 DSWOKLKHABCRPB-AZOIQLNYSA-N 388.920 5.235 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3sccc3C)cc2)oc1C(=O)O 733749081 QVYCUFQMHJIJQT-YVMONPNESA-N 382.437 5.131 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)C)c1ccncc1 734666882 NMUMGEMSISNMGZ-OALUTQOASA-N 391.437 5.414 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3c(F)cccc3F)n2)cc1 734964861 DOZMYGPCWRTTDB-OWCLPIDISA-N 394.446 5.377 30 20 GKED Cc1ccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c(C)c1 739438410 WMIIPFDZKKYXNH-UHFFFAOYSA-N 377.538 5.390 30 20 GKED O=C(/C=C\c1cccc(OCC(F)(F)F)c1)c1cccc(-c2ccncc2)c1 741474312 XEAXWJXMZFWAML-FPLPWBNLSA-N 383.369 5.586 30 20 GKED CC(C)(C)C[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)cc1 743103468 UVACQUDANPAPKY-IBGZPJMESA-N 385.895 5.541 30 20 GKED O=C1/C(=C\c2nc(Cl)cs2)CC[C@H](C2CC2)/C1=C\c1nc(Cl)cs1 759083220 IJWVBGGNNZEJRF-BOFJPMMHSA-N 397.352 5.763 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ccc(Oc2ccccc2)nn1 765566920 YZPAIOFVLYUGKN-UHFFFAOYSA-N 397.887 5.258 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 768358320 XWJYLRUPUILLRJ-UHFFFAOYSA-N 384.090 5.572 30 20 GKED C#CCCCCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 773761954 WZMQNXVJGQYHEX-UHFFFAOYSA-N 390.533 5.801 30 20 GKED Cc1nc([C@H](C)OC(=O)c2cccc(F)c2C#N)oc1-c1ccc(Cl)cc1 778370931 IWLHGNYCRFOZHR-LBPRGKRZSA-N 384.794 5.232 30 20 GKED COc1cc(C)c(CNc2ccc(OCc3cccc(C#N)c3)cc2)cc1OC 779595101 VPZXXNVDIJMWOV-UHFFFAOYSA-N 388.467 5.075 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(C4CC4)s3)cc2Cl)c1 779595332 HXEQBHVURYSNAX-UHFFFAOYSA-N 395.915 5.737 30 20 GKED C#CCCCCCC(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 780595070 HUYLJZDXENCFOT-UHFFFAOYSA-N 380.435 5.029 30 20 GKED CCOc1ccccc1[C@@H](CC(C)C)NC(=O)Nc1ccccc1O[C@@H](C)C#N 780682729 XJOSFFXRMACVPI-FXAWDEMLSA-N 395.503 5.285 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 785677340 KPHGNDOKYTYNIY-BJKOFHAPSA-N 392.462 5.023 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2cc(Br)c(Cl)s2)c1 790209467 RSDZLNVCWUKVPW-WAYWQWQTSA-N 384.682 5.019 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cscc2Br)S1 794684452 BRAAAOJUUVFGQM-AWNIVKPZSA-N 393.331 5.019 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(OC)c(OC)c3C)cs2)c1 794737152 BHEJNMAAQPCJNO-NTMALXAHSA-N 395.480 5.040 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)c(Cl)c1 797570704 JCLLQTJLCKBXBZ-PWSUYJOCSA-N 381.328 5.727 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C/Sc1cc(F)ccc1F 797867714 RXMQMAHGENBUJC-STRFDMGBSA-N 390.480 5.604 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 800385612 CLXQFIGLXHENRO-GHMZBOCLSA-N 382.382 5.090 30 20 GKED N#C[C@H](C(=O)C1(C(F)F)CCCC1)c1nc2cc(C(F)(F)F)ccc2s1 808978390 JCRLITPFNRODOK-SNVBAGLBSA-N 388.361 5.317 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)c(C)n1[C@@H](C)c1ccccc1 842936987 BCGAHAWVFOQRIB-YWZLYKJASA-N 389.524 5.538 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942867 DZFCNGAHTTUZRO-CZUORRHYSA-N 392.446 5.484 30 20 GKED C[C@@H](OC(=O)CC1(C#N)CCCCC1)C(=O)Nc1ccccc1-c1ccccc1 849904392 IECAUJGOVAXUDM-GOSISDBHSA-N 390.483 5.088 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 862831674 NMTKKQJOQGZEOC-GOSISDBHSA-N 393.487 5.084 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(C(F)(F)F)cc2)S1 915848377 NMJQTBQFWIGTBU-GDNBJRDFSA-N 376.403 5.214 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1ccc(N2CCCCC2)cc1 916308002 XPJYJQZSIQPYPX-UHFFFAOYSA-N 379.533 5.135 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)CC(C)(C)C 916887128 LBNHYNBWNHDFJG-IUODEOHRSA-N 382.476 5.111 30 20 GKED CCCCc1ccc(CC(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 916911233 ZVLFRZOSYWMMNI-JOCHJYFZSA-N 390.527 5.044 30 20 GKED N#CCCc1ccc(NC(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)cc1 932581525 PCKQCZCSMQKQMG-QGZVFWFLSA-N 390.512 5.164 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)s2)cc1 1776125762 RWYPDYXGFRHUIG-SICOMBFOSA-N 386.513 5.938 30 20 GKED C=CCc1cc(/C=C\c2nc(C(=O)O)c(-c3ccccc3)s2)cc(OC)c1O 1776186382 YSJCCNWURZVFBM-KHPPLWFESA-N 393.464 5.121 30 20 GKED C=CCn1cc(/C=C\c2nc3ccccc3c(-c3ccccc3)c2CC(=O)O)cn1 1776189810 YUHTUVKBQGXJNF-SEYXRHQNSA-N 395.462 5.082 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](Cc2ccccc2)C(=O)O)cc1 1776786457 WGUZXOYKKXCOFE-QFIPXVFZSA-N 383.532 5.069 30 20 GKED CCCCCCOc1cccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)c1 1776790296 LDJWNZAFJGGIOU-RRXSNJIPSA-N 378.468 5.484 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C/c1ccc(OCc3occc3C(=O)O)cc1)C2=O 1777455889 KFEDXECVXYGHMN-GEYIUBJWSA-N 388.419 5.249 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)[C@H]3CC=CCC3)cc2)CCC1 1790467333 KEKUDPDWDQZFMO-SIKLNZKXSA-N 392.543 5.245 30 20 GKED Cc1occc1-c1nnc(SCc2ccc(C#N)cc2F)n1-c1ccccc1 29845053 CJWPNAMSQZWGIQ-UHFFFAOYSA-N 390.443 5.139 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 65878361 XXEXULRPXGYXKY-UHFFFAOYSA-N 386.476 5.527 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)c1 78719955 VJDCLOURJQDRKC-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nnc1-c1ccccn1 124837854 MRPSRUZNDDFQTJ-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CN(C(=O)NCCCCC#N)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 176132838 QNRLIAVUHJIARD-UHFFFAOYSA-N 390.314 5.418 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/Sc3ccccc3)n2)cc1 193665129 SKNQSYXBKSRFHD-ZGKFYVQTSA-N 387.489 5.164 30 20 GKED CC1CCC(/N=C(/O)[C@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)CC1 328678429 BEBRRIJDSFMOKP-RLARUBQMSA-N 383.536 5.008 30 20 GKED CC(C)(C)c1nc2ccc(N=C(O)N3CCC[C@H]3C3CCOCC3)cc2s1 329415314 CYKQUCFXAWMVSG-KRWDZBQOSA-N 387.549 5.030 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1scc(C(C)(C)C)c1C#N 410924950 FSBZBKIEYZWDOX-UHFFFAOYSA-N 377.853 5.040 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)CCC(=O)c1cc(Cl)sc1Cl 425129704 MKVSOMSDUIDFBS-LLVKDONJSA-N 395.311 5.109 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2C[C@H]3CCCC[C@@H]3C2)cc1 427138676 ZZBVGVMLDXHZDD-WOJBJXKFSA-N 376.525 5.113 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2c[nH]nc2-c2ccc(Cl)s2)s1 430633235 ZJIGDIUONKZZAW-VIFPVBQESA-N 390.921 5.036 30 20 GKED N#CCCC[C@H](NCCc1cc(Cl)c2c(c1)OCCCO2)c1ccccc1 433028134 NROWWBZGIVWURC-FQEVSTJZSA-N 384.907 5.069 30 20 GKED CN(C)c1cccc([C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458796401 DXRNUZLELYJPGG-XZOQPEGZSA-N 390.531 5.034 30 20 GKED C=CCC1(C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2C)CCCC1 460017448 LJAOZSJEYNONGK-UHFFFAOYSA-N 378.520 5.055 30 20 GKED COc1ccc(F)c(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1 464744964 QGBRTWUQWIWEBW-UHFFFAOYSA-N 376.387 5.059 30 20 GKED Cc1c(F)cccc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 467346605 PRRIYAIANMVPSO-UHFFFAOYSA-N 391.421 5.379 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@H](C)c1cccc(OC)c1 468761121 AQZOMLNZKSPQJW-GOSISDBHSA-N 389.499 5.177 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 475570798 LKIRONJKIBPVQK-GGAORHGYSA-N 378.516 5.580 30 20 GKED Cc1sc([C@@H](C)NC(=O)C2(C#N)CCCCC2)nc1-c1ccc(Cl)cc1 479213427 UOVIPIXKBITDIT-CYBMUJFWSA-N 387.936 5.423 30 20 GKED C[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nc2ccccc2[nH]1 479513671 UWVNSNBJBNJTLZ-HNNXBMFYSA-N 398.491 5.077 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 481372080 LNJUSAMHPAUYTH-UHFFFAOYSA-N 379.869 5.147 30 20 GKED CC(=O)c1cccc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)c1 482149055 IDZLAZCWJYWUGY-UHFFFAOYSA-N 386.426 5.055 30 20 GKED O=C(NCc1ccc(C(F)F)cc1)N[C@@H](c1cccc(F)c1F)C(F)(F)F 482415595 AYFYCNWGVKORSK-AWEZNQCLSA-N 394.290 5.005 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1nc2ccccc2[nH]1 483284493 PVLGQNGVDQENNU-INIZCTEOSA-N 389.361 5.123 30 20 GKED C=CCN(C(=O)c1cc(Cl)sc1Cl)c1nc(-c2ccccc2)cs1 483345295 CHIYQUIKRBWUJF-UHFFFAOYSA-N 395.336 6.011 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 484909417 SMXCXZHQKXWTAX-KRWDZBQOSA-N 375.925 5.120 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC(C)(C)c1ccccc1 485492813 PZVWSNPPKBZIBR-INIZCTEOSA-N 384.570 5.545 30 20 GKED N#CCSc1cccc(C(=O)N2CC3(CCCC3)c3cccc(Cl)c32)c1 486394904 NKQAZZLFKCPLLF-UHFFFAOYSA-N 382.916 5.428 30 20 GKED C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 486955053 JTQYVNQYGWUWQS-VIFPVBQESA-N 379.275 5.354 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)c1cccc(C#N)c1 487222994 SJLHFNNXIKJHAW-MRXNPFEDSA-N 394.434 5.036 30 20 GKED CCSc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)c1 490720598 PSFKGVZRXURIAA-SFHVURJKSA-N 394.521 5.421 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)F)c(F)c1)c1nc2cc(Cl)ccc2s1 496406397 FYEITJGRILRKAA-JTQLQIEISA-N 396.777 5.180 30 20 GKED Cc1ccc2c(Cl)cc(Cl)c(OCCCC3(C#N)CCOCC3)c2n1 499906630 NHGUXWSBWULCIT-UHFFFAOYSA-N 379.287 5.329 30 20 GKED COc1ccccc1C1(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 501884434 DRBAPBVOZBOQIT-UHFFFAOYSA-N 384.435 5.029 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@H]3CCc4ccccc43)c2)cc1 505962782 RERQHPKADFQXCN-DEOSSOPVSA-N 397.478 5.141 30 20 GKED N#CC1(CCCSCC/C=C/c2ccc(Br)cc2)CCOCC1 507697287 ICVASFNOWKCTGX-DAFODLJHSA-N 394.378 5.686 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1 513967076 DHWHEOHLLRNZRA-UHFFFAOYSA-N 390.270 5.094 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)Cc1cccc(OCCCC#N)c1 514972484 IJSVMELFVQZYOY-UHFFFAOYSA-N 385.511 5.275 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)NC[C@H](C)c1ccccc1 521012611 OWQZNARDGUSEJI-RBUKOAKNSA-N 399.494 5.071 30 20 GKED CC(C)CCO[C@@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 521734841 UALZPZOHAOTQQW-ZDUSSCGKSA-N 388.455 5.101 30 20 GKED CC(C)C[C@@H](NC(=O)NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 522994399 YFGRLSGYUBNCID-LJQANCHMSA-N 389.421 5.164 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cccc(-c4cscn4)c3)n2)cc1 524767433 FDRHKIYSJIDNKI-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C[C@@H](N[C@H](C)c1cc2ccccc2s1)C(=O)Nc1sc2c(c1C#N)CCC2 526944634 IELVUWLQUXVDCH-CHWSQXEVSA-N 395.553 5.001 30 20 GKED COc1ccc(Sc2ccc(NC(=O)c3c(F)cc(C#N)cc3F)cc2)cc1 531028263 RTMUSDCZTLMFLQ-UHFFFAOYSA-N 396.418 5.249 30 20 GKED N#CCc1ccnc(NC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)c1 531670260 ZKZVUICHOINMRY-FQEVSTJZSA-N 393.899 5.273 30 20 GKED COc1ccccc1[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccco1 536854141 UXIZORLLHHGPAL-SILAFFCESA-N 386.495 5.371 30 20 GKED N#CCCCOc1cccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c1 539863664 NAUJKMKPHLJVCK-OAQYLSRUSA-N 375.472 5.238 30 20 GKED CC[C@H](C)[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 540386452 SULHVWNKPBNABT-VBKZILBWSA-N 380.879 5.139 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cccc(C(F)F)c2Cl)C2CC2)cc1 542724220 OZTGDKXLDZGPPE-UHFFFAOYSA-N 375.806 5.346 30 20 GKED C[C@H](N[C@H](C)c1nc2ccccc2n1C)c1ccc(-c2cccc(C#N)c2)cc1 543033541 FPMOGCQROYOKKV-ZWKOTPCHSA-N 380.495 5.524 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC=C(c2ccco2)C1 562125791 YFSSWHKMPCULFW-UHFFFAOYSA-N 399.450 5.573 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)C[C@H]2C[C@H]3CC[C@H]2O3)cc1 562954151 NHSKWMXBYLZKCC-OMWUSAIZSA-N 398.915 5.259 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H]3CCC[C@@H](C3)C2)cc1 567535391 ITRRMLVWJPJDLA-ROUUACIJSA-N 391.471 5.013 30 20 GKED Cc1csc(NC(=O)Cc2csc3ccc(Br)cc23)c1C#N 568496331 KUPVSXLOYJHJSB-UHFFFAOYSA-N 391.315 5.087 30 20 GKED COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)CCCCCC#N)c1 588676321 CEQSDWCNTMWOHB-UPVQGACJSA-N 376.500 5.226 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCCC[C@@H]3c3ccccc3)cc2)ccn1 589363735 HSTYTIBQDNEEFN-HSZRJFAPSA-N 398.466 5.505 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(Sc2ccccc2C#N)cc1 590856131 ACRARZLCZWPQBI-UHFFFAOYSA-N 393.434 5.516 30 20 GKED CCCc1ccc([C@H](NC(=O)N2CCC[C@H](CC#N)C2)c2cccs2)cc1 596108116 VDVHKVCXKKENCE-NQIIRXRSSA-N 381.545 5.125 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)CC2(C#N)CCOCC2)c2cccs2)cc1 596712136 WQZPBUAGDCPYLP-JTSKRJEESA-N 396.556 5.178 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)o1 609416388 NMUKFOJGCSBKRR-DIOULYMOSA-N 377.271 5.023 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccccc1S[C@H](C)CC#N 609427781 LBUFPHDCUWJEQP-AEFFLSMTSA-N 394.540 5.538 30 20 GKED C[C@@H](N[C@@H]1CCc2c(Cl)cc(Br)cc21)c1cccc(C#N)c1 611166864 PHDSDBCAFKEJGX-ADLMAVQZSA-N 375.697 5.312 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1N[C@@H](C#N)Cc1ccccc1 613450665 AJWUVXHNUNPCCS-OAQYLSRUSA-N 389.886 5.448 30 20 GKED CC(C)(C#N)CC[S@@](=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 616181938 UDJROZCFLCNRGC-XMMPIXPASA-N 380.340 5.771 30 20 GKED CSC[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(C(F)(F)F)cc1 619755269 VGEWJJIPZRWXEE-KRWDZBQOSA-N 384.854 5.424 30 20 GKED Fc1cc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 678207833 FMLVMCQRQUGLJM-QWRGUYRKSA-N 397.256 5.407 30 20 GKED C=CCC[C@H](C(=O)N(C)C[C@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 681719462 CHMHYMHLOOIWLJ-SGNDLWITSA-N 377.528 5.363 30 20 GKED CC(C)Cn1ncc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c1-c1ccccc1 683221349 MVBLVARPQIHPJN-FQEVSTJZSA-N 394.478 5.244 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2csc(-c3ccc(C(C)C)cc3)n2)cc1 726940803 SROFQDJFHHEWPK-UHFFFAOYSA-N 389.524 5.802 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1ccc(Cl)c(Cl)c1 731643165 CXMODDRUCLHGCQ-SNVBAGLBSA-N 380.083 5.356 30 20 GKED CCc1cccc2c(CC(=O)[C@@H](C#N)c3nc(-c4ccc(C)cc4)cs3)c[nH]c12 731767711 GBPAYAZDWZDTAG-HXUWFJFHSA-N 399.519 5.581 30 20 GKED N#Cc1ccc(CSCC(=O)O[C@H](c2cncc(F)c2)C2CCCCC2)cc1 731774181 HKFOVCBBDIBFAA-QFIPXVFZSA-N 398.503 5.190 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2c[nH]cc2-c2ccc(Cl)s2)c1 733787953 ZMWRHHDFQDWXIW-CQSZACIVSA-N 399.903 5.008 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1cccc(-c2ccncc2)c1 741451422 HMAXJCLEXLPZEF-UHFFFAOYSA-N 390.796 5.652 30 20 GKED CSc1ccc(C(=O)/C=C\c2csc(-c3ccc4c(c3)OCO4)n2)cc1F 741848296 XVYNAJFWNQPRIX-PLNGDYQASA-N 399.468 5.296 30 20 GKED COCCN(CCC#N)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 750591825 NVXOEBQCNZXYEM-UHFFFAOYSA-N 392.286 5.054 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)/C=C/SCc3ccco3)c2)c1 753980448 LPYQVOIFIQYXRK-PKNBQFBNSA-N 390.464 5.116 30 20 GKED C=CC[C@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccncc1 761704293 KTXZUYXDMVUVJQ-HNNXBMFYSA-N 385.439 5.190 30 20 GKED Cc1nc(-c2ccc([C@@H](C)N[C@H](C)c3ccc(OCC#N)cc3)cc2)cs1 776153659 CAGKOTGUQBWTBK-HZPDHXFCSA-N 377.513 5.433 30 20 GKED N#CCc1ccc(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)cc1 776213919 IBWBZLDLTLVKKD-UHFFFAOYSA-N 390.053 5.118 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 782771986 DUAPPUABWCBDDO-SFHVURJKSA-N 395.528 5.623 30 20 GKED CC(C)(C#N)CC(=O)O[C@H](c1c(F)cncc1Br)C1CCCCC1 786418506 LBRKXFYEIZVVTM-KRWDZBQOSA-N 397.288 5.088 30 20 GKED Cc1ccccc1C1(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)CCC1 788348637 JQIPCOBWLYSWPE-OAHLLOKOSA-N 379.410 5.038 30 20 GKED N#C[C@@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nccc2ccccc12 792102679 IZOKSWDHSMDVNI-FQEVSTJZSA-N 387.870 5.500 30 20 GKED CC1(C)C[C@@]1(C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 813300580 HHQYZDKFZKNWJX-NRFANRHFSA-N 393.537 5.011 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@H]1c1cccnc1 814577511 PIUQBXPURKAWTE-PKTZIBPZSA-N 396.494 5.352 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@H]2NCc1ccc(C#N)c(F)c1 817409550 AYDNZKXOJANWGN-OAQYLSRUSA-N 395.478 5.212 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ccc(Cl)nc3Cl)c(C#N)c2[C@@H]1C 839389984 BRYQXDJQFPYQQR-DTWKUNHWSA-N 380.300 5.260 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842942209 WRQGQKMCLGLDEK-FZMZJTMJSA-N 378.419 5.409 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cscc1C(F)F 888129261 AKRYBGFSMZBLCC-RNFRBKRXSA-N 395.315 5.325 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(CSC)cc2)cc1 916947223 HARNCCUKJJJVKC-YWZLYKJASA-N 380.513 5.024 30 20 GKED O=C(/C=C/c1cccc(OC2CCCC2)c1)c1ccc(N2CCCC2=O)cc1 917519475 PTMRANLQDYQBRG-XNTDXEJSSA-N 375.468 5.031 30 20 GKED Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919904647 QTMFNXJADCDSIM-ZEQRLZLVSA-N 381.479 5.460 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cccc3cc(Cl)ccc23)c1)C(=O)O 1776471321 OHDKMBACXDXSSX-KOTGUFOOSA-N 380.827 5.241 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776698009 ZHSPKYCSXNJIAN-QHVUTBCBSA-N 398.502 6.390 30 20 GKED CCCCCCC[C@H](CC(=O)O)NC[C@@H](C)Cc1ccc(C(C)(C)C)cc1 1776782343 KASSSDOMPRWUND-SIKLNZKXSA-N 375.597 5.956 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2ncc(/C=C/C(=O)O)s2)cc1 1776785561 LKTANOOLRHOBQZ-IPIYPREKSA-N 385.529 6.151 30 20 GKED O=C(/C=C/c1ccc(Cl)nc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570022 CEZOAASUIPAYHO-FNORWQNLSA-N 388.206 5.243 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Br)cs3)c2c1 1777685659 SNQAXNGNOYUYHW-HNQUOIGGSA-N 393.283 5.320 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2ccc(C)c(F)c2)c1 22732181 QCQVGQDUZNETRE-UHFFFAOYSA-O 399.536 5.151 30 20 GKED CC1C/C(=C/c2csc([N+](=O)[O-])c2)C(=O)/C(=C/c2csc([N+](=O)[O-])c2)C1 59404694 YEKCSYZVSMYJEU-YCKHSYMTSA-N 390.442 5.092 30 20 GKED Cc1cc(C#N)ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 129457907 FVIAAQMAIRFHRV-KRWDZBQOSA-N 377.856 5.134 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CCO[C@H](c3ccccc3)C2)c1 157312450 VKLQHBZNPYPUGH-AHWVRZQESA-N 398.506 5.147 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2cccc3[nH]ccc23)cc1 171393075 HDQOTEPAQYQELD-UHFFFAOYSA-N 398.441 5.413 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1 175131996 FTEXQYOUBCWCBU-UHFFFAOYSA-N 397.475 5.081 30 20 GKED COCc1ccsc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 181422614 DJKAIFXPXJVCLV-AWEZNQCLSA-N 388.901 5.161 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(C(C)C)nc2c1c(C)nn2C(C)(C)C 189901436 JMVCJWHKRNCNKO-UHFFFAOYSA-N 397.567 5.163 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1ccc([S@@](C)=O)cc1 191477817 UPVFHRPSEQKBEG-YMGMXPECSA-N 398.572 5.501 30 20 GKED C[C@@H]1CSCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 192203240 QKKDKMXFCMZZJO-KXBFYZLASA-N 399.947 5.212 30 20 GKED Cc1cc(Br)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1Cl 323980705 YHOBOMPOQQRBBI-UHFFFAOYSA-N 391.696 5.464 30 20 GKED OC(=Nc1cccc(N=C(O)C2CC2)c1)NC1[C@H]2CC[C@H]1Cc1ccccc1C2 329491785 VRXFMWKVZPNTSS-OALUTQOASA-N 389.499 5.013 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)N1CC(C)(C)OC2(CCCC2)C1 330338543 VNBDDRQMYUUOPM-UHFFFAOYSA-N 379.504 5.026 30 20 GKED CC[C@@H]1C[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 421044506 IBZYIZSNKPFCHF-NSHGMRRFSA-N 397.906 5.075 30 20 GKED C[C@H](NC(=O)c1cnn(CCC#N)c1-c1ccccc1)c1cccc2ccccc12 428333466 WPQLJZMDPHHDSH-SFHVURJKSA-N 394.478 5.108 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(N2CCCC2)c1 431282887 MUZVKOCQVIJQLM-AUSIDOKSSA-N 390.531 5.082 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 434982095 NIXNSXQAHYTKEC-DOTOQJQBSA-N 398.457 5.499 30 20 GKED CCOc1ccc(CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 437478538 CDPUOPFRAAPWNT-UHFFFAOYSA-N 390.414 5.070 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CSc2ccccc2)cc1F 437482630 DHCJYTFFSXEXNS-UHFFFAOYSA-N 378.428 5.220 30 20 GKED N#Cc1cc(N(C#N)Cc2ccc(Oc3ccccc3F)c(F)c2)ccc1F 439720974 RPCXPOMQGHVQKC-UHFFFAOYSA-N 379.341 5.256 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)c1ccccn1 442658853 UYYXMXUUJKKDQL-HNNXBMFYSA-N 383.234 5.671 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 442674266 VQGHWZLJPBQLRU-HXUWFJFHSA-N 388.492 5.645 30 20 GKED N#CCCCn1cc(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)c2ccccc21 444043111 FDYXTIJZABAQKP-DEOSSOPVSA-N 383.495 5.237 30 20 GKED Cc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 444902293 WJQDBTTVWNYVPR-AEFFLSMTSA-N 381.545 5.342 30 20 GKED CC(C)(c1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1)C(F)(F)F 447632967 RRCSFSMRAOUPCY-SFHVURJKSA-N 382.385 5.565 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)o1 458794223 AOOKVLJYOQEVIZ-NHCUHLMSSA-N 379.504 5.650 30 20 GKED C[C@@H](NCc1cncc(C(F)(F)F)c1)c1ccc(-c2cccc(C#N)c2)cc1 463155366 NDFGEGMBKYPITL-OAHLLOKOSA-N 381.401 5.490 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1ccccc1COC(C)(C)CC 464170420 RNPRSHDMGQZEFH-UHFFFAOYSA-N 383.488 5.218 30 20 GKED CCSc1cc(Cl)ccc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464466042 HSOGUJFCDWVMDU-ZDUSSCGKSA-N 384.810 5.356 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 464564681 FJJVHKMTBHCSOO-MRXNPFEDSA-N 380.513 5.962 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)cc2Cl)o1 466733825 XHEJQCMMYDGWDI-VIFPVBQESA-N 394.258 5.907 30 20 GKED CCCc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 468888305 GUSDSLFMWPENOD-GOSISDBHSA-N 375.516 5.395 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H](c3ccc(Cl)cc3)C3CC3)ccc21 469008417 NMWLUOLWYUQAQP-QHCPKHFHSA-N 393.918 5.486 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3sc(-c4ccccc4)cc3C#N)c2c1 470833546 DFWBWYNQTZTFGA-UHFFFAOYSA-N 385.492 5.648 30 20 GKED COc1ccc2nc(CNCc3ccc(-c4ccccc4C#N)cc3)sc2c1 474019030 GWTRZSJKPWCIGS-UHFFFAOYSA-N 385.492 5.133 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1 474407026 DCKIGHWGVHCJKJ-IBGZPJMESA-N 386.451 5.514 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1c1cccc(Br)c1)c1ccccc1 475031690 ODZGPMAQCRXASP-PXNSSMCTSA-N 397.316 5.200 30 20 GKED C[C@@H](NC(=O)C1(C#N)CCC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 482131967 YWCZCVBNONDRKS-GFCCVEGCSA-N 378.419 5.305 30 20 GKED Cc1c([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccccc12 484155764 FFMXFXWLGXFWFZ-GOEBONIOSA-N 393.512 5.876 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 484453229 AERDDADVDVHOQC-UHFFFAOYSA-N 380.332 5.269 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@@H](C)c3cc([N+](=O)[O-])ccc3C)o2)cc1 484604176 ZLECEMPESZCVOQ-AWEZNQCLSA-N 397.456 5.371 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccccc1 487474330 NYHPGLFMFDYORX-SFHVURJKSA-N 399.416 5.369 30 20 GKED Cc1ccc(OCCCC(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 487569800 TVYBZAMUHDYDPE-HXUWFJFHSA-N 384.907 5.359 30 20 GKED CCCCOc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 487602451 KSSVHNLOJKBZDU-OAQYLSRUSA-N 384.907 5.684 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 487783046 KHGACDGTIJBBHW-HXUWFJFHSA-N 390.508 5.689 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccccc1Cl 499933550 VTLNVOFAPMPSJJ-LJQANCHMSA-N 382.822 5.053 30 20 GKED CC(C)CN(C(=O)CCc1cc(Br)cs1)c1ccc(C#N)cc1 499947793 ABOKPTYBYPQIBN-UHFFFAOYSA-N 391.334 5.004 30 20 GKED O=C(Nc1cccc(NCC(F)(F)F)c1)c1cc(F)cc(C(F)(F)F)c1 505791300 UELYMTLHCAKCME-UHFFFAOYSA-N 380.263 5.071 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1cc(F)ccc1F 510188722 DEXGZHVNOAFLAO-ZDUSSCGKSA-N 395.434 5.018 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)ccc1OC1CCCC1 512662173 VYZYRKWIPINQFY-CVEARBPZSA-N 382.479 5.439 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1occc1COc1ccccc1 518668917 TYKZMJNWFGKIGR-INIZCTEOSA-N 392.480 5.363 30 20 GKED CCCC[C@@H](COC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 524079138 HYOPLBGMCIUPLG-AZUAARDMSA-N 399.922 5.322 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1csc(-c2ccc(F)cc2)n1 530970913 UEAIPAXPBPIAQW-LEWJYISDSA-N 377.488 5.221 30 20 GKED C=CC1CCN(Cc2nc(O)c3c(-c4ccccc4Cl)csc3n2)CC1 533287248 OQZBMKHCVHDDMJ-UHFFFAOYSA-N 385.920 5.115 30 20 GKED C=CCC[C@@H](N[C@H]1CC(=O)N(C)c2ccccc21)c1ccc(C(F)(F)F)cc1 537950410 WCZVTEQGOIXTKV-MOPGFXCFSA-N 388.433 5.410 30 20 GKED Cc1ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)cc1-c1ncco1 539764064 AHNVGBQRVVCTAS-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#CCc1ccc(CSc2nnc(-c3cccs3)n2Cc2ccco2)cc1 542213602 GNKMADZRAOBPPT-UHFFFAOYSA-N 392.509 5.006 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc2c(c1)nc(CC)n2C1CC1 549019876 YDJDIGREJULZDR-UHFFFAOYSA-N 391.540 5.142 30 20 GKED CC(C)c1ccc([C@@H](NCc2cnc3ccc(C#N)cn23)c2cccs2)cc1 560244389 WOQUYDNYABCSFI-HSZRJFAPSA-N 386.524 5.270 30 20 GKED Cc1ccc(S[C@H](C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 564517134 KKQKUDBGMNKQGH-MRXNPFEDSA-N 389.480 5.173 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1nc(-c2ccccc2)cs1 571215996 APCQSDXICFPRHF-CYBMUJFWSA-N 387.430 5.551 30 20 GKED N#Cc1cc(C(=O)N2CCCCC[C@H]2/C=C\c2ccccc2)cnc1C(F)(F)F 578032545 FYCLDPOQVGWCMA-GDWUOILNSA-N 399.416 5.070 30 20 GKED C=CCN(CCC#N)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 579625096 OAOIILSINNQHKD-UHFFFAOYSA-N 394.471 5.406 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603829140 JWRIVROCJCRIDJ-OAHLLOKOSA-N 390.418 5.110 30 20 GKED O=C(Cc1ccccc1OC(F)F)Nc1ccc(C(F)(F)C(F)(F)F)cc1 605272163 MLYTUMUJQDSFBZ-UHFFFAOYSA-N 395.274 5.123 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)C1(C#N)CCCCC1 609062195 FDWYCTBGQWKQKM-UHFFFAOYSA-N 382.891 5.640 30 20 GKED CCCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)c1ccc(C)o1 609401949 MLUVXMUQOPXCSQ-AEFFLSMTSA-N 399.560 6.235 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)cn2)cc1 609626646 PJSPYIIOEDWIDS-HSZRJFAPSA-N 388.471 5.100 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N(C)c2ccc(C#N)cc2F)cc1F 609754861 KNILRXWOGIASQM-UHFFFAOYSA-N 380.369 5.228 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)Nc1cccc(C#N)c1 610010694 GHUXWOMQMCMDCH-UHFFFAOYSA-N 399.429 5.204 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1C 610199293 NFSVLFSXVSBYTA-QHCPKHFHSA-N 397.478 5.340 30 20 GKED C[C@@H](NC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1cccc(C#N)c1 610363199 ULKPBUBJYUDRCM-QGZVFWFLSA-N 396.446 5.374 30 20 GKED Cc1c(C#N)c(NC(=O)CSC2CCCCC2)n(Cc2ccccc2)c1C 611142439 GCFPYJOEOHZASZ-UHFFFAOYSA-N 381.545 5.029 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-n4cc(C)cn4)cc3)n2)cc1 613319157 SDCNFEUEACQHHP-FQEVSTJZSA-N 398.491 5.103 30 20 GKED C=C(C)[C@H](N[C@@H]1CC[C@H](C(=O)OCC)c2ccccc21)c1ccc(F)c(F)c1 619822808 PNENDQWRBLTUQY-BWAGFHJFSA-N 385.454 5.353 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 622511726 MLVPMTPXVOCLGA-SNVBAGLBSA-N 381.238 5.185 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1sc(-c2ccccc2)nc1C(F)F 677757378 BNDZXBQLPIMCLG-UHFFFAOYSA-N 398.478 5.619 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2)[C@H](C)c2cccs2)c1 726484201 HDVDPJLEKKYVIX-QGZVFWFLSA-N 376.550 5.690 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3ccccc3F)n2)cc1 726857864 BAKFLHZUQHWKQQ-MAUKXSAKSA-N 378.472 5.628 30 20 GKED CC(C)(C)CCCC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 729070752 XPLFXMWIQXQIPA-GOSISDBHSA-N 378.472 5.343 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2coc(-c3cccs3)n2)cc1 729946459 CMSLUADNJJPSOX-FQEVSTJZSA-N 399.475 5.240 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1ccc(SC(F)F)cc1 730953155 QKJRXHLAKJUBFX-UHFFFAOYSA-N 395.525 5.816 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)CSc2ccc(C(C)(C)C)cc2)c1 733774404 NTCXXPXWDYYALE-LJQANCHMSA-N 396.556 5.074 30 20 GKED N#C[C@H](C(=O)/C=C/C1CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 735593492 MVKJRYNCENBLLC-IZPAUZPXSA-N 378.419 5.628 30 20 GKED CC(C)c1ccccc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740428362 QGIHVKQGVYZBSU-UHFFFAOYSA-N 375.497 5.732 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1nc(-c2ccccc2)cs1 743055638 HRGQYLGUQDCQJR-FLIBITNWSA-N 385.448 5.289 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 744015133 GXGPCQUEPKOWKW-RMHQSFGDSA-N 380.369 5.533 30 20 GKED O=C(COc1ccc(C(=O)/C=C/C=C\c2ccccc2)cc1)Nc1ccccc1 746683778 GBPSZVRXWJZOOY-WIFBXHMDSA-N 383.447 5.156 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)ccc1OCC#N 747187444 CKUROPJYTXEXAH-CLFYSBASSA-N 375.449 5.222 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Cc2ccc(Cl)cc2Cl)n1 747197392 YVGOYTHCSFLJQZ-FZMZJTMJSA-N 381.328 5.628 30 20 GKED CCOc1cc(/C=C\C(=O)c2c[nH]c3cc(F)ccc23)ccc1OC(F)F 749452307 KXHNDKUUKALTFF-CLTKARDFSA-N 375.346 5.203 30 20 GKED N#C[C@@H](C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc2ccccc2n1 751825910 MVGRZJGCTXHYTQ-KSNFBPKASA-N 398.428 5.560 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cncc3ccccc23)cc1 764997231 DYZZUPMRAVFPFH-VWLOTQADSA-N 391.474 5.462 30 20 GKED N#CC1(COC(=O)c2cccc(Oc3ccc(Cl)c(Cl)c3)n2)CCC1 768090808 IGZRTUGOGNOYIL-UHFFFAOYSA-N 377.227 5.031 30 20 GKED C#CCCCCCC(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 780265355 ZMNXFDGSQHSEND-QGZVFWFLSA-N 393.508 5.331 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1F)C(C)C)c1ccncc1 781941942 WABASOZIZVRLEW-MOPGFXCFSA-N 375.875 5.188 30 20 GKED Cc1ccc(-c2ncccc2NC(=O)Nc2ccccc2O[C@@H](C)C#N)s1 782913100 QAHRRACQNZYRCW-ZDUSSCGKSA-N 378.457 5.053 30 20 GKED Fc1cccc([C@H](NCc2c(F)c(F)c(F)c(F)c2F)C(F)(F)F)c1F 784315275 WPCWCWBNGVBXKN-AWEZNQCLSA-N 391.208 5.054 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)n2)cc1 786307788 DNMGHFWZBJTYLU-RBSFLKMASA-N 398.940 5.813 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccncc2)cc1 788351205 VLBYNFHQXHPCFP-YFHOEESVSA-N 384.483 5.052 30 20 GKED COc1ccc2[nH]c3c(c2c1)C(=O)/C(=C\c1cnc(-c2ccco2)s1)CC3 789147577 ITDVHEFQBFZBLF-XFXZXTDPSA-N 376.437 5.106 30 20 GKED FC(F)(F)CCN(Cc1ccc(Cl)nc1C(F)(F)F)CC(F)(F)F 790429733 FLDJCSCHYKRTHQ-UHFFFAOYSA-N 388.661 5.071 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792097951 ZGEBJWHLHRHAEC-UGSOOPFHSA-N 383.278 5.597 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 793384190 SHUIQPMZFYKXIC-UHFFFAOYSA-N 379.460 5.087 30 20 GKED C[C@H](C#N)OCCOC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 801863141 WFINQSXETLPOLO-MRXNPFEDSA-N 399.446 5.019 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 802706946 BOSIQGUEDKKXMH-QFSNBGPKSA-N 395.505 5.188 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 805947262 LDQNXRANNXRFHG-KDOFPFPSSA-N 377.513 5.044 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CCC(F)(F)CC1 806201286 WCPLSKLPEOCZSW-HXUWFJFHSA-N 383.442 5.384 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)CCSc2ccnc3cc(Cl)ccc23)CC1 809088954 KCSASWPBXICPCX-GASCZTMLSA-N 388.920 5.244 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 824646021 UZYXASGEVXMRAF-UHFFFAOYSA-N 399.878 5.048 30 20 GKED Cc1ccccc1CO[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 860478584 CMPSVGPACYOULO-BBRMVZONSA-N 384.888 5.040 30 20 GKED COC1(c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCCC1 904835391 JCQPMVBFJNRLAZ-UHFFFAOYSA-N 395.846 5.470 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(COc2ccccc2)c1 918053577 FUIMRDLPQVSMBN-UHFFFAOYSA-N 378.497 5.547 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cc1)c1oc2cc(C)ccc2c1CC(=O)O 1776052162 LXPANDMEKYXNBI-UHFFFAOYSA-N 390.361 5.223 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C/C(=O)c2cc(C(=O)O)ccc2O)cc1Cl 1776353705 WTNNXPKAKJXNIG-HWKANZROSA-N 395.238 5.081 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1csc(-c2cccs2)n1 1776355254 YROWQGZKSMPPSP-SREVYHEPSA-N 399.493 5.253 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1csc(-c2ccc(Cl)cc2)n1 1776784463 QLPZEPMMSBXMDN-KRWDZBQOSA-N 394.968 5.757 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@@H](C(=O)O)CC[C@@H]2C)cc1 1776787565 XWRWOUVTFMPKKN-WMZOPIPTSA-N 377.550 5.074 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(C[C@@H](C)C(=O)O)cc2)c1 1776787627 XPFYDRUTDRQTMJ-LJQANCHMSA-N 383.532 5.911 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1OC 1776801311 KNQRUUDKVUPTJE-SREVYHEPSA-N 394.876 5.183 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)oc2ccccc12 1776956092 BHQTWFSIFQYKAV-SXGWCWSVSA-N 396.442 6.257 30 20 GKED N#CCOc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(Cl)cc2)cc1 7360174 AZZLWIMJIAVXKL-NRFANRHFSA-N 389.842 5.013 30 20 GKED C=CCSc1ccccc1NC(=O)CN(C)[C@H](C)c1nc2ccccc2s1 7923041 YHMJUNURESDAKL-OAHLLOKOSA-N 397.569 5.206 30 20 GKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1ccc([N+](=O)[O-])cc1 38199615 VGIXTKGPIAIARG-PKNBQFBNSA-N 376.393 5.361 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1C(F)(F)F 65718342 PQLNJDREOQCNSX-HNNXBMFYSA-N 394.396 5.735 30 20 GKED COc1ccc(CCCN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66953767 DTXFKWQTMQGMNE-KRWDZBQOSA-N 397.544 5.186 30 20 GKED CCN(C(=O)c1csc(-c2ccc(F)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 97174680 QKBRKSLWMKFAJD-AWEZNQCLSA-N 379.460 5.044 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 110972606 LJIIYIYWQIMDQH-XPMGFOTESA-N 377.440 5.741 30 20 GKED C=CC[C@H](C)NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 117006514 QSTXVJFYUPYHFI-NSHDSACASA-N 387.402 5.139 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(F)c(F)c1)c1nc(-c2ccc(Cl)cc2)cs1 120111768 WZSZYRWACGKENZ-AWEZNQCLSA-N 388.826 5.161 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 120275115 PDMVTJFTXWGCBF-QFIPXVFZSA-N 398.466 5.105 30 20 GKED Cc1cc2cc(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)oc2cc1C 122862648 QYZOVRCENRQHOO-IBGZPJMESA-N 382.419 5.164 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C3CCC(F)(F)CC3)cc2F)c1 128743857 NPMYMPBVASERDH-UHFFFAOYSA-N 388.389 5.040 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2cnco2)cc1 133265580 PVOWCJUMTMJGQJ-UHFFFAOYSA-N 397.459 5.617 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1cccs1 134005854 WQXKINODQLBYJJ-UONOGXRCSA-N 376.572 5.575 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)Nc1ccc(F)cc1OCC#N)C1CC1 135293789 ZBDVOUPIELMDQH-CYBMUJFWSA-N 387.842 5.139 30 20 GKED CC(C)CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H]1CCCc2cccnc21 154944606 XYWCSJHFRVLHHH-NRFANRHFSA-N 390.531 5.450 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](OC(C)(C)C)c1ccccc1 156695250 FLXCTXGYQLEBTO-UZLBHIALSA-N 382.529 5.433 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C/c1cnc(C(C)(C)C)s1 173137454 CNYLDLOSVOJPGI-HBWSCVEGSA-N 385.558 5.344 30 20 GKED CCO[C@H](C)c1nc(CN(C)Cc2ccc(-c3ccccc3C#N)cc2)cs1 173662126 FPJRIMAUMHPHHS-QGZVFWFLSA-N 391.540 5.411 30 20 GKED CCc1cccc(C)c1NC(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 180385656 ODVOWQLCODMNPQ-UHFFFAOYSA-N 378.419 5.179 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccccc1 180881252 IBXZWJCFVIRAOE-GOSISDBHSA-N 382.463 5.634 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 182338375 IZNIVCCYZANFEP-WMLDXEAASA-N 399.491 5.113 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCOc1cccc(C(C)=O)c1 189882652 UCFVYOLJTKAZQG-UHFFFAOYSA-N 379.500 5.539 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)OC(C)(C)C)c1 189892553 PHPFWNXKSHCYAQ-UHFFFAOYSA-N 394.515 6.138 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccnc(C#N)c2)cc1Cl)c1ccccc1 193130972 QFWQZCYGZCJCAI-CQSZACIVSA-N 376.847 5.032 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccccc2Oc2ccccc2Cl)CC1 303345372 PUDDIMBVFRALMJ-UHFFFAOYSA-N 399.922 5.294 30 20 GKED OC1=Nc2cc(/C(O)=N/C3CC(c4cccc(Cl)c4)C3)ccc2SCC1 328652025 BSSUBSIPLLRQMH-UHFFFAOYSA-N 386.904 5.675 30 20 GKED C[C@@H]1C(=O)CC[C@@H](C(O)=Nc2nnc([C@@H]3CCCc4ccccc43)s2)C1(C)C 330319401 DEUVRIPVHVEKIC-XYPHTWIQSA-N 397.544 5.236 30 20 GKED COc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)ccc1OC1CCCC1 410316264 ZEEKXTWWAKIHFK-UHFFFAOYSA-N 378.472 5.070 30 20 GKED CCC(CC)n1c(COc2ccccc2Cl)nnc1S[C@H](C)CCC#N 412984208 OWRHEHLLPYSEAU-CQSZACIVSA-N 392.956 5.656 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432666896 HCKYJXJKHITBQE-FQEVSTJZSA-N 392.503 5.146 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cc2sc(C)nc2cc1Cl 435186807 GDBVVPRSDUCSHF-UHFFFAOYSA-N 375.881 5.114 30 20 GKED N#Cc1ccc(CSCc2csc(-c3ccoc3)n2)c(OC(F)F)c1 439548800 MEVYVYCCHDPCRQ-UHFFFAOYSA-N 378.425 5.310 30 20 GKED Cc1c(C(=O)N[C@@H](CCC#N)c2ccccc2)oc2ccc(Br)cc12 439672272 KAGLWUZYPOWVJU-KRWDZBQOSA-N 397.272 5.279 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2-c2cccs2)c2ccccc21 443909001 PQEWPGPKPVSZAI-UHFFFAOYSA-N 385.492 5.926 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)CCCC1(C)C 444893347 DYUMBYBKQOCROB-IBGZPJMESA-N 385.552 5.578 30 20 GKED C=CCC[C@H](N[C@@H](C)c1cc(C(=O)OC)co1)c1ccc(C(F)(F)F)cc1 447588363 UVVVKMKTSAHBAE-GUYCJALGSA-N 381.394 5.443 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCn2cccc2[C@@H]1c1ccccc1)c1ccccc1 458806344 VZKVNIBVMMHNNR-VWNXMTODSA-N 398.510 5.038 30 20 GKED N#CCCCC(=O)Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1 462039387 IQPFAMUPRBXFCH-UHFFFAOYSA-N 377.469 5.021 30 20 GKED CCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccccc1S[C@@H](C)CC#N 462059351 NMNBPLPCBSBDBB-ZDUSSCGKSA-N 398.919 5.197 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCC(F)(F)F)cc1Cl 466455495 ZELYFBZRZSFACM-OAHLLOKOSA-N 381.785 5.069 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc3ccoc3c2)cc1C 467898848 LGDXHONYWDFHJP-UHFFFAOYSA-N 384.439 5.079 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 467989079 CAOHZAVTLADAMP-AWEZNQCLSA-N 377.831 5.141 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2Cl)c[nH]1 470580231 ABNSHCNALWFGCN-UHFFFAOYSA-N 390.657 5.766 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc(C(C)(C)c2ccccc2)nc1C 471166728 ZCKXATQPYWTHEQ-UHFFFAOYSA-N 383.561 5.322 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1 474416162 VAZIEHWHZIDRCH-UHFFFAOYSA-N 376.456 5.172 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)C[C@@H](CC#N)c1ccccc1 475124010 ZBUIMCSWUDYSIY-HSZRJFAPSA-N 383.495 5.006 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 475542923 BAUUJWHTVZXVBM-INIZCTEOSA-N 381.476 5.638 30 20 GKED N#Cc1cc(NC(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)ccc1F 478654549 UVNDAGVSRJDURF-UHFFFAOYSA-N 389.352 5.037 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(Cl)ccc1Br)c1ccccc1 487393148 TZBNIJUZBGZIPN-KRWDZBQOSA-N 391.696 5.267 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(CN(C[C@@H]2CCCCO2)C(C)C)cc1 488562981 SWYRZEDYHOGBML-PKTZIBPZSA-N 399.579 5.039 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(CN2CCSCC2)cc1C)c1ccccc1 488705154 UHWOYUSLQCAVHL-JOCHJYFZSA-N 394.584 5.232 30 20 GKED CCc1c(C)sc(NC(=O)c2cnn(C(C)C)c2-c2ccccc2)c1C#N 489923562 LFGQZBZBKIAWDQ-UHFFFAOYSA-N 378.501 5.187 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3cc(C#N)ccc3Br)oc12 491834152 XJVJRWKSARJVMS-ZDUSSCGKSA-N 399.288 5.316 30 20 GKED C=CCC(C)(C)C(=O)NC[C@@]1(C)C[C@H](NC(=O)C(C)(C)CC=C)CC(C)(C)C1 493954659 KEMQZSJPVNRVHY-KOSHJBKYSA-N 390.612 5.008 30 20 GKED N#Cc1cc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)ccc1Cl 494724202 VVKYLXAIZIWAAC-UHFFFAOYSA-N 388.279 5.170 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3cccc(Cl)c3)no2)sc2c1CCCCC2 499327293 HXXKAUVVGLLYEU-UHFFFAOYSA-N 397.887 5.449 30 20 GKED CC(C)c1ccc(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 502623540 REMNJWYAQWWOOB-UHFFFAOYSA-N 399.494 6.099 30 20 GKED COc1ccc([C@H]2C[C@H](NC3CCC(C#N)(c4ccccc4)CC3)C2)cc1F 503852883 ASQFSNFONFXMHF-SUFHFGBBSA-N 378.491 5.074 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1c[nH]c2cccc(C)c12 504324144 HHUHXBOMEBYNNC-UHFFFAOYSA-N 396.450 5.025 30 20 GKED CCN(Cc1ccc(Cl)cc1)Cc1cn(CCC#N)nc1-c1ccccc1 507174056 PSBOOEPSQMZFOL-UHFFFAOYSA-N 378.907 5.139 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccccc1C(F)(F)F 513471007 JNGBMWDBLBXKLI-UHFFFAOYSA-N 380.369 5.174 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N(C[C@@H](C)C#N)C1CC1 513692424 NJNMAJMUXJYTKB-INIZCTEOSA-N 395.528 5.143 30 20 GKED C=CCCC1(c2nc(CC(=O)Nc3ccccc3Oc3ccccc3)no2)CC1 520286194 QIAUTKKZLXNBGW-UHFFFAOYSA-N 389.455 5.041 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCc1ccc(Cl)cc1 520940371 PHNCDXMEAKXNDE-OAHLLOKOSA-N 387.936 5.489 30 20 GKED N#Cc1c(Cl)cccc1SCc1csc(CC(=O)Nc2ccccc2)n1 536724217 AQNHICCGOMXUAO-UHFFFAOYSA-N 399.928 5.142 30 20 GKED C=CCN(C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1)C1CC1 536822043 PWADLXIRKIFLLO-UHFFFAOYSA-N 380.538 5.258 30 20 GKED COc1ccccc1[C@H](NCCCC1(C#N)CCOCC1)c1ccccc1Cl 539711086 AEJNZTVUOPSUDW-JOCHJYFZSA-N 398.934 5.128 30 20 GKED C[C@H](N[C@@H](C)c1nc2ccccc2n1C)c1ccc(-c2cccc(C#N)c2)cc1 543033540 FPMOGCQROYOKKV-ROUUACIJSA-N 380.495 5.524 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)CC1 543824815 BCBNUQLLAXCPSJ-DEOSSOPVSA-N 383.495 5.264 30 20 GKED C=C(C)COc1cccc(NC(=O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)c1 544232229 SDOPUVFBTRGFNJ-LJQANCHMSA-N 393.531 5.087 30 20 GKED COc1cc2c(cc1F)CC[C@@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 549204400 KDDHGCUOMLIAKE-GUYCJALGSA-N 399.491 5.038 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1F 550835050 GFIAVJANLDBLSZ-LIRRHRJNSA-N 375.285 5.674 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)CC1 565831866 HAYMOPMIDNXDOZ-UHFFFAOYSA-N 390.512 5.511 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cccc1-c1ccccn1 572793200 MGSYTLILBKKQTD-KRWDZBQOSA-N 375.497 5.301 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CC2(C(F)(F)F)CC2)cc1 575365983 CDDNWHMDRQJIGO-UHFFFAOYSA-N 388.389 5.003 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)[C@@H]1c1cccs1 575948122 JQQDYWYMMGMBQP-HXUWFJFHSA-N 389.480 5.030 30 20 GKED CC1(C)C[C@@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccc(F)cc2O1 583534385 MXXPGLCKNRLATG-QGZVFWFLSA-N 378.369 5.108 30 20 GKED C[C@@H](NC(=O)N1CCC2(CC1)CC2(F)F)c1ccc(-c2cccc(C#N)c2)cc1 593391963 RFZDAVKKFUPQFI-MRXNPFEDSA-N 395.453 5.117 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@H](CC#N)C1 596723669 LTNWGPMPYDAOPN-RTBURBONSA-N 377.488 5.293 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)sc2c1CCC2 609033386 KSZAPXVZHPCZAS-RYUDHWBXSA-N 377.296 5.157 30 20 GKED CCc1nc2cc(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)ccc2o1 609516173 KXYTVSKSXPJSIF-UHFFFAOYSA-N 397.434 5.501 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609732023 XFDXAWYULXBTRB-UHFFFAOYSA-N 395.890 5.406 30 20 GKED CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610015734 RAEDFIPPXOIYRG-OXJNMPFZSA-N 378.476 5.178 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)C1 612371122 YVDLIEXJDJRDLE-YGMDYZATSA-N 397.478 5.080 30 20 GKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 613392487 ULARGSLFGMZRRS-GOSISDBHSA-N 378.522 5.801 30 20 GKED CC[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1 618562087 VCRBVAWHWBDWPM-JJXSEGSLSA-N 378.360 5.508 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)nc(-c2ccc(Cl)cc2)n1 677557861 UCTWRDKBYWFPSX-SFHVURJKSA-N 398.853 5.144 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)cc1Br 678173227 VXBKOFSHEWJEDH-MRXNPFEDSA-N 379.257 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C)nc1N1CCCC1 682777239 IVBOWZMONKKZJH-UHFFFAOYSA-N 392.547 5.164 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@]3(C)CCCc4ccccc43)n2)cc1 726322375 SMHHDGCXKAPILQ-NTKDMRAZSA-N 386.520 5.589 30 20 GKED COc1cc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)cc(Cl)c1O 727781014 ZTPXEXBSBQPPAR-HJWRWDBZSA-N 385.872 5.382 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cccnc1Cl 728699909 XSRPAXOONMYLFG-TWGQIWQCSA-N 375.280 5.716 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CCC1)c1nc2cc(F)ccc2s1 730416092 AIQBPSQNOIYCGZ-OAHLLOKOSA-N 384.863 5.387 30 20 GKED Cc1ccc(N(CC(=O)Nc2ccccc2S[C@H](C)CC#N)C(C)C)cc1 731030153 LKSGWWGDHUKYJA-GOSISDBHSA-N 381.545 5.243 30 20 GKED N#C[C@H](NC(=O)c1ccc(SC(F)F)cc1)c1cccc(Cl)c1Cl 731195923 QMCQBHTUXSZFJD-ZDUSSCGKSA-N 387.238 5.303 30 20 GKED CC(=NNc1ccc(OC(F)F)cc1)c1cnn(-c2cccc(Cl)c2)c1C 731558249 OGAOIQCHEDHLEF-UHFFFAOYSA-N 390.821 5.272 30 20 GKED CC[C@@H](OC(=O)CCc1c(C)nc(O)c(C#N)c1C)c1ccc(C(C)(C)C)cc1 731778672 QUZNYGNAGZUJNO-OAQYLSRUSA-N 394.515 5.200 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2oc3ccc(Cl)cc3c2C)c1 733771970 UOKAYGWDFJCSGV-MRXNPFEDSA-N 382.847 5.006 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccc(F)cc2)C(C)(C)C)c1 733849417 XAEHYNCJMDIDFJ-FPOVZHCZSA-N 397.494 5.093 30 20 GKED C[C@@H](OC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1ccc(C#N)cc1 735676245 UEAZUCVWDBNAIS-MRXNPFEDSA-N 379.419 5.086 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 743447719 RVFREFSYAFDFKL-SFHVURJKSA-N 394.927 6.008 30 20 GKED CC(=NN=C(C)c1ccc(-c2ccccc2Br)s1)c1cnccn1 745201352 HGKGWZVKNIFYBB-UHFFFAOYSA-N 399.317 5.201 30 20 GKED COc1ccc(OCc2nc(/C=C/C(=O)c3coc4ccccc34)cs2)cc1 747705252 MBXJJCDNBSCNQW-IZZDOVSWSA-N 391.448 5.373 30 20 GKED CCC[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 749048302 MAYCDUVIBHUUNB-FZMZJTMJSA-N 381.328 6.119 30 20 GKED N#Cc1ccc(C(=O)O[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)s1 750205888 OAEGZVYFLDSACP-GFCCVEGCSA-N 379.281 5.099 30 20 GKED CC(C)C[C@@H](C)N(C(=O)Cc1cccc(OCC#N)c1)c1ccc2[nH]ccc2c1 760441960 SZAYCUQDYPGQDH-GOSISDBHSA-N 389.499 5.081 30 20 GKED C=CCOc1ccc(CN(Cc2nnc(-c3cccc(F)c3)o2)C(C)(C)C)cc1 761915039 KAIJWCKYRJQSLQ-UHFFFAOYSA-N 395.478 5.241 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 767420697 LDRQAPQGTPEDQY-HXOBKFHXSA-N 391.902 5.099 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 769772887 DUCRFHDUTFGGGA-WFASDCNBSA-N 399.313 5.429 30 20 GKED Cc1cnc([C@@H](C)OC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)o1 770985518 VBTISCUSJSPTIU-CYBMUJFWSA-N 382.803 5.218 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1Oc1ccccc1Cl 776752909 LKIHLTHXKOGUOQ-UHFFFAOYSA-N 376.843 5.380 30 20 GKED C#CCCCCCC(=O)O[C@@H](C)C(=O)N1c2ccccc2Sc2ccccc21 780265354 ZMNXFDGSQHSEND-KRWDZBQOSA-N 393.508 5.331 30 20 GKED Cc1cccc(C(=O)OCC2(C#N)CCCCC2)c1NC(=O)c1ccccc1F 780485327 JCQCBTFADRKILR-UHFFFAOYSA-N 394.446 5.017 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)cc1F 781423544 RQYRFCWNYCZNFJ-GKVSMKOHSA-N 386.470 5.463 30 20 GKED Cc1cc(-c2ncccc2NC(=O)Nc2ccccc2O[C@@H](C)C#N)cs1 782897340 JMVMPABOFYAINC-ZDUSSCGKSA-N 378.457 5.053 30 20 GKED Sc1nnc([C@@H]2CCCCO2)n1N=Cc1ccc(-c2ccc(Cl)cc2)cc1 789020924 PQIOCWJWQDVVGM-SFHVURJKSA-N 398.919 5.011 30 20 GKED CCC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](O)c1ccccc1 791816913 CIXBVNPSXLDDNH-LKUPVBHCSA-N 397.544 5.105 30 20 GKED COc1cc(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 797614907 GLNKLDCAQFBERG-KRWDZBQOSA-N 396.899 5.200 30 20 GKED COc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1F 797615068 ONNBCIYKSUAYTG-KRWDZBQOSA-N 394.471 5.075 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(-c4c(F)cccc4F)cc3)cc12 811697335 JSHCEZNLYQLDCO-IZZDOVSWSA-N 389.405 5.118 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1ccc(C#N)cn1)CC(C)(C)O2 811862009 AOJIFXXHXQCKOL-QGZVFWFLSA-N 394.475 5.015 30 20 GKED CC1CCN(CCC[C@@H](NCc2cc(C#N)ccc2F)c2ccc(F)cc2)CC1 812724630 IILYJHMXLZIXDW-XMMPIXPASA-N 397.513 5.179 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(F)=C\C3CCCCC3)n2)cc1 815921502 ITSRVKDAYKUVFK-SZLZGVTBSA-N 384.476 5.429 30 20 GKED C=CC[C@@H](C(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817870535 RUXGYJGUEFBCMB-SWLSCSKDSA-N 382.813 5.291 30 20 GKED COc1ccc(Cl)cc1C(=O)/C=C\c1ccccc1OCc1ccccn1 819840849 IYHMKVFDPLCTTN-LUAWRHEFSA-N 379.843 5.219 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1NC(=O)OC(C)(C)C 842942425 YORXECUCELUPRC-OAHLLOKOSA-N 397.500 5.166 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)nc1Cl 856777486 CEXADLYPWXDYIV-GFCCVEGCSA-N 381.829 5.406 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccco1 860477127 AVGSLYIRGRRYMV-CMPLNLGQSA-N 378.375 5.278 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1nc2cc(C(F)(F)F)ccc2s1 860478304 VCMZULOFHUTWLP-IHETXDGRSA-N 398.409 5.077 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@@H](C#N)c3ccc4ccccc4n3)cs2)c1 916848377 JZSUBHNUAXVLMJ-IBGZPJMESA-N 383.476 5.086 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)c3ccccc3OCC#N)cc2)cc1 919811087 DXXBNRLWKDPQKL-UHFFFAOYSA-N 388.423 5.032 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3ccc(F)cc3)n2)cc1 921133793 YINKRAZLIUOBAS-DNVCBOLYSA-N 378.472 5.313 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1COC(C)(C)C 932537602 RRBLPKZJCRLALJ-UHFFFAOYSA-N 398.551 5.389 30 20 GKED CC[C@@H](NN=C(CC1CCCC1)c1ccc(Oc2ccccc2)cc1)C(=O)O 1776065945 QUMUGVSXRMYMPV-OAQYLSRUSA-N 380.488 5.216 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(Oc2ccc(F)cc2)cc1 1776089588 ZDQOXOUAQFVVNP-UHFFFAOYSA-N 378.403 5.461 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1[N+](=O)[O-] 1776116210 UBXZCERTTJZNCI-NTMALXAHSA-N 393.420 5.226 30 20 GKED O=C(/C=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccc(F)c(F)c1 1776125336 FIKDHBYTMWVXKX-FQTAANOTSA-N 394.373 5.066 30 20 GKED CCCCCCCOc1cccc(CNc2cc3c(c(C(=O)O)c2)OCCO3)c1 1776787431 KBDRNKAJSAZGPC-UHFFFAOYSA-N 399.487 5.117 30 20 GKED COc1ccc(/C=C\C(=O)c2coc3c(C)cccc23)c2cc(C(=O)O)oc12 1777361566 PJBGHXBIUNJUJT-VURMDHGXSA-N 376.364 5.090 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cc(C(=O)O)cs1 1777487707 HLMOHZJFOHCDKL-VOTSOKGWSA-N 389.885 5.428 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3cnc(C(F)F)s3)cc2)c1 1777686075 GJJRWRKMVWYPMK-RMKNXTFCSA-N 385.391 5.342 30 20 GKED O=C(O)c1cncc(C(=O)/C=C/c2ccccc2Oc2ccc(F)c(Cl)c2)c1 1777694971 MQYMMXPVGARBSG-VMPITWQZSA-N 397.789 5.261 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cscc3C)cc2)CCC1 1788748112 ZHOHZQGZEHKDCN-OAHLLOKOSA-N 382.529 5.016 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2Cl)cc1)C(=O)Nc1ccccc1C#N 22016849 LFEOJUKFIWGULG-OAHLLOKOSA-N 391.858 5.443 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2ccc(CC#N)cc2)cs1 23694932 DKBTYGYLQRXWCA-UHFFFAOYSA-N 379.510 5.062 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 41516669 ZVGNMWZGKFOYOD-GOSISDBHSA-N 389.505 5.106 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2ccccc2n1C(F)F 41558370 IYTATAQJQMGFPM-AWEZNQCLSA-N 395.340 5.321 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cnn1C(C)(C)C 51156691 DZWVKDNUYMVTOC-HNNXBMFYSA-N 398.919 5.214 30 20 GKED Cn1cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c2ccccc21 58426019 RJJLMQGUPMVMEM-UHFFFAOYSA-N 395.462 5.076 30 20 GKED COc1ccc(CNCCc2cccc(Cl)c2Cl)cc1OCCCC#N 64614507 XHWWEXOIJDGNAL-UHFFFAOYSA-N 393.314 5.017 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2cccnc2)cc1 66801576 KFHRJBFFCHAKBM-INIZCTEOSA-N 389.480 5.520 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(Cl)s1 66955532 SFCXFQHABRBWJU-GFCCVEGCSA-N 379.938 5.460 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3F)o2)cc1 105738494 VLZZGNKKLWOZDM-UHFFFAOYSA-N 383.382 5.272 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3cc4cnn(C(C)C)c4nc3Cl)c2c1 114992440 SSWQRBNQDNINHC-QPJJXVBHSA-N 394.862 5.052 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117400099 CDBWGKYQOFJQKY-UHFFFAOYSA-N 394.237 5.054 30 20 GKED CCCCCCCC(=O)Nc1nc(C)c(-c2n[nH]c(=S)n2C2CC2)s1 120100234 AUZIRRPDTGUEJD-UHFFFAOYSA-N 379.555 5.007 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2sccc2C#N)c(C(F)(F)F)c1 124537319 MJNJEWWRTKESQG-JTQLQIEISA-N 384.448 5.781 30 20 GKED CCOc1ccc(-c2nc(C(=O)N(C)c3cc(Cl)ccc3C#N)cs2)cc1 156963422 NLHXHELJZXCTOR-UHFFFAOYSA-N 397.887 5.010 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1 163900226 DFDUOMKTKGFNJG-GTNSWQLSSA-N 395.311 5.060 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccco2)s1)c1nc2cc(Cl)ccc2s1 171482177 ZAUYGUBLBFSWOJ-JTQLQIEISA-N 385.857 5.156 30 20 GKED CC[C@H](C)CN(CC)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 175240686 XHGFAIBJQAQQQY-SFHVURJKSA-N 379.504 5.232 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(SCc4cccnc4)cc3)cc2)CC1 182587146 JEEPLONMHHMPND-UHFFFAOYSA-N 385.492 5.181 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(Sc2ncccn2)cc1C)c1ccccc1 187393078 SJWSIJCKKDNTGB-LJQANCHMSA-N 375.497 5.235 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1ccccc1F 218264144 VGTCDBUSNVLEJS-UHFFFAOYSA-N 398.488 5.279 30 20 GKED Cc1ccc([C@H](C)N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 247199347 QWFFCCLFEUZUSY-MSOLQXFVSA-N 381.545 5.021 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 255006915 LYHSPNFYWNLAKT-KUGGDMIFSA-N 385.801 5.365 30 20 GKED O/C(=N/C1(c2ccc(F)cc2F)CCCCC1)c1coc(C2CCOCC2)n1 328780557 GZKNIEKKXNJDQQ-UHFFFAOYSA-N 390.430 5.011 30 20 GKED CC(C)Cn1ncc(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1C1CC1 329315688 HHROKVNBDFZIAY-HXUWFJFHSA-N 395.551 5.110 30 20 GKED O/C(=N/CC1(c2cccc(F)c2F)CCCC1)c1cnc([C@@H]2CCCO2)s1 330258464 MLBKCYVLBBECHG-HNNXBMFYSA-N 392.471 5.089 30 20 GKED C=CCn1c(SCc2ccc(OCc3ccccc3)cc2)nnc1C1CC1 409896465 JYPNKVJFNPCVEX-UHFFFAOYSA-N 377.513 5.213 30 20 GKED N#CCCSc1ccccc1NCc1c(F)ccc(Br)c1F 410323465 NASHHOAFJSODTD-UHFFFAOYSA-N 383.261 5.345 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425663027 PGOXKIUOFHJMOW-MOPGFXCFSA-N 390.531 5.470 30 20 GKED Cc1nc(CCCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cs1 426689737 WYLINKSBKZGIDB-UHFFFAOYSA-N 377.469 5.077 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(C(F)(F)F)ccc1F 437946460 ILOOXSDVYYCPKQ-QAPCUYQASA-N 391.368 5.148 30 20 GKED C=CCCCN(C)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 438398639 WQKVQPGDZAYXMR-UHFFFAOYSA-N 382.398 5.493 30 20 GKED C=CCN(C(=O)[C@H]1CCCS1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 443850344 GDRDMFSBBPLBAM-OAHLLOKOSA-N 399.368 5.532 30 20 GKED C=CCC[C@H](N[C@H](C)c1cc(C(=O)OC)co1)c1ccc(C(F)(F)F)cc1 447588361 UVVVKMKTSAHBAE-DYVFJYSZSA-N 381.394 5.443 30 20 GKED C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)N[C@H](CCCC#N)c1ccccc1 458797051 FSXVSXPHFKKGRV-NQSCKRDGSA-N 379.479 5.148 30 20 GKED Cc1cc(Br)c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)s1 459347808 LIIQZPDONVEICG-VIFPVBQESA-N 383.336 5.063 30 20 GKED C[C@H](C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1)c1cccc(C#N)c1 462452400 QFMRKDLBHTUIDM-HNAYVOBHSA-N 386.417 5.087 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](c1cccc(SC)c1)c1cc(F)ccc1F 466238204 CNLHTQKLGDBTHC-FQEVSTJZSA-N 390.499 5.384 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1ccccc1)c1nccs1 471811945 PQLQJBBEKXSYAK-HXUWFJFHSA-N 377.513 5.020 30 20 GKED CC(C)(C#N)CCCN1CCc2c(cccc2NC(=O)Nc2ccccc2F)C1 472244636 WDXQQTCNWHNVEI-UHFFFAOYSA-N 394.494 5.158 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)n1 473937381 QBJIZZMMSLQJHA-OAHLLOKOSA-N 386.835 5.526 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1 475567197 CHRQZCXIOIUNCF-GMAHTHKFSA-N 377.532 5.105 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc2ccc(Cl)cc2n1C)c1ccc(F)c(F)c1 480692016 FDACYZIDYAAQJQ-HXPMCKFVSA-N 375.850 5.473 30 20 GKED N#CC[C@@H](CC(=O)Nc1sc2c(c1C#N)CCCCCC2)c1ccccc1 483339993 JVNSUBGMRQFUJM-KRWDZBQOSA-N 377.513 5.305 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccccc1 488668547 CNMZLUBKNAWKAY-JOCHJYFZSA-N 376.500 5.001 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1C)c1ccccc1 488683298 FAXKVMGNLYTPQY-QFIPXVFZSA-N 390.527 5.356 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 490632849 YYSRFEDJPVFXMR-UHFFFAOYSA-N 394.858 5.068 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccccc3)c3ccccc23)cc1 494138958 RDEXXBROLYDBEK-FQEVSTJZSA-N 381.504 5.832 30 20 GKED N#C[C@@H](NC(=O)c1cccc(-c2cscn2)c1)c1c(Cl)cccc1Cl 505500673 KWLLQAYTFXEZQA-OAHLLOKOSA-N 388.279 5.112 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1cccc(C(F)(F)F)c1 505917181 NVPDDUOQKGAUPX-CQSZACIVSA-N 391.151 5.146 30 20 GKED CC(C)c1ccccc1OCCC(=O)Nc1ccccc1S[C@H](C)CC#N 507691638 DYUOTQLGIHVLJQ-QGZVFWFLSA-N 382.529 5.612 30 20 GKED CC1(C#N)CCN(C(=O)c2cc(Cl)ccc2Oc2cccc(Cl)c2)CC1 507815573 WYRSZSDUVKXKDD-UHFFFAOYSA-N 389.282 5.552 30 20 GKED C[C@@H]1CCC[C@@H](CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 508248141 OBVSNCAAUYRMLU-YLJYHZDGSA-N 378.541 5.407 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCC(=O)c1ccc2ccccc2c1 509586936 UQIGELWRKMLATL-UHFFFAOYSA-N 386.451 5.100 30 20 GKED COc1cc(C(=O)Nc2ccccc2SCCC#N)cc(OC)c1C(C)C 511013466 WJJNXSKZFCCROL-UHFFFAOYSA-N 384.501 5.085 30 20 GKED N#CCCCOc1cccc(NCc2c(OC(F)F)ccc3ccccc23)c1 513180810 ISFATOCGBVVOOI-UHFFFAOYSA-N 382.410 5.736 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)c1cccc(COc2ccccc2C#N)c1 513427414 SIOAKNVXZRIFTC-UHFFFAOYSA-N 390.870 5.063 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517125131 HBIBDNQPUDJUSY-HNNXBMFYSA-N 377.469 5.637 30 20 GKED C=CCN(C(=O)[C@H]1CCOC1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 519069584 JTLGISLWNUXSFM-FQEVSTJZSA-N 390.508 5.033 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 522070783 JOXDCVQSNJVFOY-OAQYLSRUSA-N 387.508 5.084 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(-c2csc(C)n2)cc1 522092371 UHTGWYFKFNCHCS-UHFFFAOYSA-N 379.485 5.005 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)c1ccc(F)c(F)c1 525140347 LSBZYJHNUZJPDL-OAHLLOKOSA-N 392.405 5.679 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@@H]21)c1nc2cc(Cl)ccc2s1 528925017 QWKMBTGVFXRQDK-RUZGCFLTSA-N 399.302 5.365 30 20 GKED CC(C)CN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)Cc1ccccc1 532497991 YQDHDVPWMXMNQF-IBGZPJMESA-N 395.572 5.035 30 20 GKED C=CCC[C@@H](NCc1ccc(-n2cncn2)cc1)c1ccc(C(F)(F)F)cc1 533391889 NGECGOHWSZVSEB-HXUWFJFHSA-N 386.421 5.083 30 20 GKED Cc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c(Br)c1 533671127 QUPLXYWROKBVCI-UHFFFAOYSA-N 397.297 5.610 30 20 GKED Cc1c(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cccc1-c1ccccn1 535876000 MNHNGDRNPHMQGY-UHFFFAOYSA-N 381.357 5.200 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 538001170 YXLLJQKHKRHDKE-MJGOQNOKSA-N 386.417 5.210 30 20 GKED N#CCC[C@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccccc1 539050591 NJFROMGDNJGGBQ-PMACEKPBSA-N 391.515 5.961 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(-c2cccc(C#N)c2)cc1 541084430 KMIQMKKSBDSDEE-IBGZPJMESA-N 379.507 5.877 30 20 GKED C[C@H](C#N)CNC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 548085859 FVZNTTGVOMDRRL-LLVKDONJSA-N 386.864 5.023 30 20 GKED N#CCCN(C(=O)CCc1cccc(OC2CCCC2)c1)c1ccc(F)cc1 554282872 FVCOOGTWUAGVJF-UHFFFAOYSA-N 380.463 5.027 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1Cl 554349640 YCUVCRALPPOUCZ-INIZCTEOSA-N 392.768 5.118 30 20 GKED N#CCc1ccccc1NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 559252262 XISMOQIMXAGIJF-UHFFFAOYSA-N 395.698 6.180 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OC(C)(C)C)cc1 562206188 DXFOFWHDQFLSJQ-UHFFFAOYSA-N 384.524 5.252 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C)c(Cl)cc1OC 563557981 YDBFSCJILPBBBH-UHFFFAOYSA-N 390.915 5.045 30 20 GKED N#CCCC1CCN(C(=O)Nc2cc(Cl)ccc2OCC2CCC2)CC1 564928095 AAEXGZXCSNKXGH-UHFFFAOYSA-N 375.900 5.067 30 20 GKED N#Cc1csc(CNc2ccnc(Oc3ccccc3Br)c2)c1 565866122 QMYIRCNKSZSLPL-UHFFFAOYSA-N 386.274 5.182 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)N1CCC(CCC#N)CC1 576705099 JYAVZSSXXLFWHG-UHFFFAOYSA-N 378.472 5.034 30 20 GKED N#Cc1ccc2c(c1)[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CC2 589337253 VERLXPWMCJSZQO-HEHGZKQESA-N 376.344 5.045 30 20 GKED C=CC1CCN(C(=O)Nc2cc3c(cc2Sc2ccccc2)OCCO3)CC1 601153100 RCOSOXRYBXJNMS-UHFFFAOYSA-N 396.512 5.039 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC1CCC1)c1nc2cc(Cl)ccc2s1 605362876 XIZCSOHFZDZRDV-OAHLLOKOSA-N 382.872 5.371 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(F)c(F)cc3Cl)cc2)c1 609063943 FWHYIPNMCGPXKT-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2c(F)cccc2[nH]1 609072213 FGNLUWBZWGVOBW-UHFFFAOYSA-N 399.425 5.318 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c[nH]c2ccc(F)cc12 609643114 PYWOCLZHFMLPHB-UHFFFAOYSA-N 399.425 5.461 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC2CCCCC2)cc1 609786413 IDNJGUZGWWYSQN-KRWDZBQOSA-N 394.540 5.902 30 20 GKED C[C@H](CC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)n1cccc1 610207701 CCAVSOOBCSBSTQ-QGZVFWFLSA-N 377.875 5.198 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cccc(Cl)c1 610223720 GGHZJIFYFANJHK-AWEZNQCLSA-N 377.831 5.141 30 20 GKED C[C@H](NC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)c1cccc(C#N)c1 610359414 IYTUHFHDAYZCDV-KSFYIVLOSA-N 390.870 5.209 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)C1 661382173 TZMFRTWSIXCVFK-LJQANCHMSA-N 383.561 5.233 30 20 GKED Fc1ccc([C@@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C2CC2)cc1 678685328 STVAFHRTMMBSAA-XNISGKROSA-N 383.351 5.776 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCS[C@H](c2ccccc2)C1 682778039 XBODZDDHGFCRCR-NRFANRHFSA-N 380.557 5.861 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)s3)SC2=S)cc1Cl 726626285 CTQMILWUSFMSEW-SDQBBNPISA-N 397.333 5.332 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1 727980002 AOJWWUHTPKZUGN-KKSFZXQISA-N 379.529 5.002 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccc4c(c3)CCC4)cc2)c1 727980281 ISORHGZQCMNAMJ-UHFFFAOYSA-N 399.519 5.435 30 20 GKED C=CCOc1ccccc1CNC(=O)N(CC)Cc1ccc(C(F)(F)F)cc1 732250931 ASKBUEUDYIANFW-UHFFFAOYSA-N 392.421 5.002 30 20 GKED Cc1c([C@H](NCc2ccc(N(C)CCC#N)cc2)C(C)C)oc2ccccc12 732672179 AKEZPRAUWVHRTQ-HSZRJFAPSA-N 375.516 5.578 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1 732697401 XYYKKLWHGOMPFQ-UHFFFAOYSA-N 389.927 5.067 30 20 GKED CCN(C(=O)[C@H](C)SCc1cc(Cl)ccc1OCC#N)C1CCCCC1 735320323 QWZXGZPZNFXPAE-HNNXBMFYSA-N 394.968 5.045 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 739180025 GWFPOPKBRWZCDT-RDTXWAMCSA-N 380.488 5.929 30 20 GKED O=C(/C=C/c1cnc2ccc(Br)cn12)c1ccccc1C(F)(F)F 740763637 FDRNMZJYBUETHG-VOTSOKGWSA-N 395.178 5.012 30 20 GKED N#C[C@@H](C(=O)CCC(F)(F)F)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 744036768 IEGQXODZJFQDQO-RZYZSWTKSA-N 382.451 5.130 30 20 GKED CC(=O)Nc1cc(NCc2ccc(-c3ccccc3C#N)cc2)c(F)cc1F 749268448 IZXCQSCOEOVIHJ-UHFFFAOYSA-N 377.394 5.074 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2cccnc2)c2ccc(F)c(C)c2)c1 753678029 FCJQEHKQUOPRGV-URXFXBBRSA-N 389.474 5.089 30 20 GKED CC(C)(C)O[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 753968681 OIFPXRKRPIQIEF-DNQXCXABSA-N 398.506 5.837 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc3ccccc3c2O)cc(OC)c1OC 756686680 JKOMNPHGGUARQS-MRXNPFEDSA-N 377.484 5.142 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2c(C)oc3ccccc23)cc1 767958463 FWJJDEFUFGXZJN-BTYIYWSLSA-N 388.467 5.145 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)CNc2ccccc2O[C@@H](C)C#N)C(C)C)cc1 773369261 SPPRCJGSXIOUJK-UUOWRZLLSA-N 393.531 5.026 30 20 GKED Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)O[C@@H](C#N)C1CCCCC1 776397536 ADFNSRUNUBUDHI-INIZCTEOSA-N 391.393 5.033 30 20 GKED COc1ccc2ccccc2c1-c1cc(CON=Cc2ccc(F)cc2)on1 778019483 LTPHSIXVUSLNJS-UHFFFAOYSA-N 376.387 5.193 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C1(c2ccc(Cl)cc2)CCCCC1 780153485 JKWUARYSPWMZOW-MRXNPFEDSA-N 382.891 5.471 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2sc3cc(Br)ccc3c2Cl)C1 784749951 ZIRNWDIWTYCGRH-MRXNPFEDSA-N 397.725 5.083 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792092394 QENJZOFIRHCXJQ-SQNIBIBYSA-N 396.368 5.113 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1ccc(Cl)c(Cl)c1 795140613 UJZJRJIDLPGNLP-UHFFFAOYSA-N 397.375 5.546 30 20 GKED C[C@H](Oc1ccccc1C(F)(F)F)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571800 QJEHDAITIQDOME-NWDGAFQWSA-N 396.434 5.103 30 20 GKED C=C[C@H](CC(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817861019 BGCSGLITNKUZPS-CHWSQXEVSA-N 382.813 5.291 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Oc3ccccc3)cn2)c1 834650115 GMZYELBBFSIICS-ICSRJNTNSA-N 387.483 5.406 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 860844270 HRPJMBJGQODIOE-CABCVRRESA-N 389.318 5.153 30 20 GKED N#Cc1ccc(-c2nc(-c3ccccc3OCc3ccccc3)no2)cc1Cl 904466018 YCVBDQGHPXEBLP-UHFFFAOYSA-N 387.826 5.508 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)cc1)c1nc2cc(Cl)ccc2s1 917046503 DVUGKPKPUVDDKA-OAHLLOKOSA-N 389.307 5.802 30 20 GKED CCCCCCCCCC(=O)N1CCC(NC(=O)Nc2ccc(F)cc2)CC1 917147569 GPRJMQLOIQVLOC-UHFFFAOYSA-N 391.531 5.079 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@H]2c2ccccn2)s1 919898085 WBRMNWVDAOCETM-KRWDZBQOSA-N 387.553 5.205 30 20 GKED C=CCCc1ccccc1NC(=O)N1CC2(CCOCC2)[C@H]1c1ccccc1 931290220 JLSCOMGEJFKUFQ-JOCHJYFZSA-N 376.500 5.191 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc2c(c1)Nc1ccccc1S2 1776061800 OODGXARTGKEZPZ-UHFFFAOYSA-N 393.443 5.568 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2C(=O)O)c1)c1ccccc1Cl 1776115094 MGGFALRREAWGKT-OUKQBFOZSA-N 392.838 5.513 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)cc1 1776125837 UCWFFVXWTVTMHR-ZSOIEALJSA-N 384.447 5.769 30 20 GKED C=C(C)COc1cc(CN[C@@H](CC(=O)O)c2ccc(C(C)C)cc2)ccc1OC 1776140279 JTACJLKGKXQQTR-NRFANRHFSA-N 397.515 5.079 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C\C(=O)c2cccc(C(=O)O)c2)cc1Cl 1776353656 SGXSOMQCQBJSJX-SREVYHEPSA-N 379.239 5.375 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccccc2OC2CCCCC2)c1)C(=O)O 1776471051 DPSCHADFMPRIDK-NHRMXYMRSA-N 394.467 5.146 30 20 GKED CC1(C)/C(=C\c2ccc(/C=C\C(=O)O)cc2)C(=O)c2cc(Br)ccc21 1776515255 SQIOWIRZRKZNHB-XLHPHSJOSA-N 397.268 5.104 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C\c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777455892 KKMPNWWBYUVYNM-PRUNSDMDSA-N 398.458 5.583 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2cc(C)sc2C)[n+]2ccccc2)c1 10174855 QZDBICBOSPZMDA-UHFFFAOYSA-O 395.573 5.266 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)C(=O)Nc2c(C)cccc2C)n1 21621906 LOMZIOFZUIAKBP-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)c(C)c1 22729542 ARODYPZELVJNIG-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)oc2c1C(=O)CCC2 66789158 HCPSXNQHCCJPSZ-UHFFFAOYSA-N 386.407 5.023 30 20 GKED Cc1cc(C)c(NC(=O)CNc2ccccc2S[C@H](C)CC#N)c(Cl)c1 109002866 MCJPKPAGHDHCND-OAHLLOKOSA-N 387.936 5.402 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 110308247 FFLDOTWXLIZEIR-JKSUJKDBSA-N 390.430 5.453 30 20 GKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Br 118445151 UYRDYGHARTVJCJ-OLZOCXBDSA-N 389.318 5.142 30 20 GKED CCN(C(=O)Nc1ccc(OC(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 118789385 OKAJNZTXDSPTTN-CYBMUJFWSA-N 377.366 5.072 30 20 GKED COc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1-c1ccccn1 118968314 FDKSZITXSIQIPK-UHFFFAOYSA-N 389.480 5.015 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1)c1ccccc1 134723803 GXRVDUJIOKUTOB-HNNXBMFYSA-N 379.847 5.221 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)cc2C(F)(F)F)sc2c1CCCCC2 159899976 CLZSHEHNBPEGCJ-UHFFFAOYSA-N 382.382 5.299 30 20 GKED C=CCN(C(=O)c1sc([C@@H](C)OC)nc1C)c1nc(-c2ccccc2)cs1 175278923 NJJFOGCTNBPQHM-CQSZACIVSA-N 399.541 5.115 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(NC(=O)C4CCCCC4)c3)cc2)CC1 181623303 WRYQYUORMPBEGB-UHFFFAOYSA-N 387.483 5.013 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cs1 188918294 XXBMXVJICGFQSV-SUMWQHHRSA-N 386.546 5.215 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2ccc(C)o2)n1 189869852 FWWNDAGGEQVQPD-UHFFFAOYSA-N 380.513 5.745 30 20 GKED C[C@H](C#N)Oc1ccc(CNCC[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 237464623 HNGSADOEAXTBCA-HZPDHXFCSA-N 376.422 5.280 30 20 GKED Cc1cc(Br)c2ccccc2c1N=C(O)C[C@H]1CCCC(O)=N1 329659211 NZKXWGMTGYLMGY-GFCCVEGCSA-N 375.266 5.398 30 20 GKED COc1cccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)c1 433017462 CGVDANNEACNLIU-OAQYLSRUSA-N 377.513 5.343 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCC1CC(OC(C)(C)C)C1 433482105 XVYVNLAXLZPEDD-UHFFFAOYSA-N 384.973 5.083 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)CC2)c1 435147594 FKISIBPOVSEMIY-UHFFFAOYSA-N 379.419 5.037 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)c1cn(CCCC#N)c2ccccc12 436412411 QWVZIXIIVDKQEA-UHFFFAOYSA-N 379.891 5.261 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 437838290 JIDYUQCQZBAIIM-KRWDZBQOSA-N 397.544 5.654 30 20 GKED C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458797053 FSXVSXPHFKKGRV-ZNLUXHQJSA-N 379.479 5.148 30 20 GKED C=C(C)CCNC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 458990314 BOSDVLGWCWXPAO-UHFFFAOYSA-N 378.303 5.066 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccc(F)c(F)c1 460179077 XGBZUPPXSKFSBM-OAHLLOKOSA-N 392.405 5.158 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)CCc2cccs2)cc1 464789256 AKLWDOBNRLWOAQ-UHFFFAOYSA-N 376.481 5.035 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 466324210 GWMYUNKCPBDRST-QGZVFWFLSA-N 385.895 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(CN2CCCC2)cc1 475566780 ARAZFDATTSKKOO-UHFFFAOYSA-N 391.559 5.456 30 20 GKED N#CC[C@@H](CC(=O)N1CCCCC[C@H]1CC(=O)c1ccccc1)c1ccccc1 476240414 UPVBRTHWZGRZCN-GOTSBHOMSA-N 388.511 5.118 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(CC(F)(F)F)cc1 479113751 FZQVNJUSRFBMAE-UHFFFAOYSA-N 397.462 5.444 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1ccc(C#N)cc1 480322312 VBLTYQKBZIEYRC-CQSZACIVSA-N 392.846 5.282 30 20 GKED COc1cc(OC2CC2)ccc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 485594424 PFOCOXLEVJSLFF-UHFFFAOYSA-N 390.464 5.089 30 20 GKED N#CCCN(C(=O)c1scnc1C1CCCC1)C12CC3CC(CC(C3)C1)C2 486594627 HCVDYOUTMXPUHM-UHFFFAOYSA-N 383.561 5.125 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)o2)c2ccc(C(F)(F)F)cc2)cc1 486804166 ZMYMENQITQSFHN-HXUWFJFHSA-N 386.373 5.058 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@H](CCCC#N)c2ccccc2)c1 487239525 JHMTYOREMPMMLN-SIKLNZKXSA-N 378.516 5.437 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cc(Cl)ccc1OC[C@H]1CCOC1 488204032 VADIXCBEVHEKGT-INIZCTEOSA-N 384.907 5.169 30 20 GKED CC(C)(C#N)CC(=O)NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1 493735035 JTSMOVIYFONAMH-UHFFFAOYSA-N 376.378 5.054 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1 498249440 DQIWSFJHDMSGQI-FYYLOGMGSA-N 389.474 5.317 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1csc(-c2ccccc2)n1 501022426 ZAPATFRYAXTZJC-UHFFFAOYSA-N 399.475 5.051 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2OC2CCCC2)c1 502289761 ZSNWEKKJMKPLEB-UHFFFAOYSA-N 379.460 5.335 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCC(C)(C)c1ccc(F)cc1Cl 502883021 KDTLMMGCCFVXHZ-UHFFFAOYSA-N 399.897 5.026 30 20 GKED N#Cc1ccc(N2CCC(N[C@H]3CCSc4ccc(Cl)cc43)CC2)cc1 513690185 HXJURGLATQUXTI-FQEVSTJZSA-N 383.948 5.007 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3cccnc23)cc1 513734201 WAYLWKQHWAEISJ-UHFFFAOYSA-N 395.418 5.160 30 20 GKED C=CCn1c([C@@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@H]1c1cccs1 516895969 VLEGMJZZDIVRHT-QAPCUYQASA-N 398.507 5.146 30 20 GKED Cc1ccc(SCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c(C)c1 518709074 ISSKICFRQAAGDH-OAHLLOKOSA-N 379.312 5.083 30 20 GKED C=CCc1cc(C(=O)N(c2ccc(C)cn2)C2CCCCC2)cc(OC)c1OC 520806721 LJHDQFIRFNKBSR-UHFFFAOYSA-N 394.515 5.115 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(-c2ccccc2)cc1 521327092 QDSYQJIBKMQJGX-SFHVURJKSA-N 386.520 5.929 30 20 GKED CCN(CC#N)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 521602192 SUCUINQLNYTVQO-UHFFFAOYSA-N 379.312 5.271 30 20 GKED CC(C)Cc1ccc([C@@H](NC(=O)N(C)Cc2cccc(C#N)c2)C2CC2)cc1 523940339 HWCRDZWMCVURFT-HSZRJFAPSA-N 375.516 5.049 30 20 GKED CCc1ccccc1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 524895938 YXBMCQOEHSZKFT-UHFFFAOYSA-N 399.494 5.216 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F 525041482 FVYDJCWEYXXMAY-MRXNPFEDSA-N 388.433 5.509 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)CC1 530389224 RYCTXQRLLCDYTO-UHFFFAOYSA-N 389.286 5.213 30 20 GKED Cc1ccc(Br)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 534164829 YNDPCHIZRPBYFP-UHFFFAOYSA-N 391.268 5.549 30 20 GKED C=C[C@@H](CC(=O)N(C)Cc1ccc(OC(F)F)c(OCC)c1)c1ccccc1 534652649 IUAMJYYCYKKNOA-KRWDZBQOSA-N 389.442 5.005 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C1CCC(F)(F)CC1 534685301 JNIWIOIPDGCIKN-UHFFFAOYSA-N 386.417 5.365 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(CN3CCCCC3=O)c2)CC1 537734372 KJONCKYSXUZYCC-UHFFFAOYSA-N 387.527 5.015 30 20 GKED Cc1sc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 539496126 IILQJFLXXXODOQ-KBPBESRZSA-N 381.932 6.055 30 20 GKED C[C@@H](NCc1nccn1Cc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 541995270 MBHHLQAMOZNRDX-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C[C@@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542012277 RNGGBQNGZOMELV-GOSISDBHSA-N 379.463 5.731 30 20 GKED Cc1c(C(=O)N2CCCCC[C@@H]2[C@H]2CCCCC2=O)sc2ccc(C#N)cc12 551798422 VVPFBYRPYGZWOM-IEBWSBKVSA-N 394.540 5.226 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 552245758 PSKQGTAUGHDZLU-UHFFFAOYSA-N 378.435 5.067 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1CC(C)(c2ccccc2)C1 561409133 WSZGMFOZCSSECC-FVYSKSNYSA-N 379.529 5.323 30 20 GKED Cc1sc([C@H](C)N[C@@H]2CCc3ccc(C#N)cc32)nc1-c1ccc(Cl)cc1 569861765 ZEYZCLBUWMCGSV-RNODOKPDSA-N 393.943 5.982 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NC1(c3cc(C(F)(F)F)ccc3Cl)CC1)CC2 577787403 OLOSZYGUCZVTTH-SFHVURJKSA-N 376.809 5.497 30 20 GKED CC[C@H](OCCNC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 593158633 BZXPATHVHCHECC-PXNSSMCTSA-N 397.544 5.228 30 20 GKED C[C@@]1(C#N)CCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)C1 596927806 JBTNRNUBEBVKEA-FQEVSTJZSA-N 396.903 5.130 30 20 GKED C[C@H](Cc1ccco1)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 597178756 FWRAISIDDRNNJV-GFCCVEGCSA-N 382.407 5.121 30 20 GKED C[C@H](Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1)c1cccc(C#N)c1 600848532 ULHZNAIYPYKWNR-CVEARBPZSA-N 381.907 5.399 30 20 GKED Cc1cc(N2CCC[C@H]2c2ccc(F)c(C(F)(F)F)c2)cc(C#N)c1[N+](=O)[O-] 600851755 HCLLPSDFWPWYBD-KRWDZBQOSA-N 393.340 5.274 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)N(CC(C)C)c2ccc(C#N)cc2)s1 603529010 NHBWUFLIITVDOW-UHFFFAOYSA-N 395.553 5.283 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)cn2)cc1 603763518 CWVUGPSZJBSELW-RTBURBONSA-N 389.842 5.141 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 604561827 HUWIIBYMTLUHLY-LJQANCHMSA-N 398.466 5.075 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)oc2c(F)cccc12 609416362 JRGUOANTGKLVFF-AWEZNQCLSA-N 377.202 5.182 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609641684 FFDNQQVDWWFIGN-KRWDZBQOSA-N 388.442 5.110 30 20 GKED C[C@H](NC(=O)Nc1ccc(OC2CCCC2)c(Cl)c1)c1cccc(C#N)c1 610322191 SEKLAVDRJAKMJY-AWEZNQCLSA-N 383.879 5.416 30 20 GKED N#Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccncc2)cc1C(F)(F)F 610331069 LOJPMBPAXZLPJX-GOSISDBHSA-N 388.393 5.121 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 610355455 REGSCSGJFVLVMF-OALUTQOASA-N 383.495 5.689 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1OCCC 613290735 KQCJWAPYNNQFMC-LJQANCHMSA-N 388.467 5.302 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2cc(Cl)ccc2s1 613403795 UPEWPLXOHBITCC-CQSZACIVSA-N 396.830 5.839 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619770464 VVVGQYHVRAIYOG-LBPRGKRZSA-N 395.812 5.133 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)c1Br 682991328 GXPICZNKCJUSQJ-ZDUSSCGKSA-N 377.307 5.136 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)C3CCCCC3)n2)cc1 726324456 AFPMVYQZZJWIOE-KXBFYZLASA-N 382.529 5.601 30 20 GKED Cc1cccc(C)c1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1 727980859 SIMJDYLXMIMUBR-UHFFFAOYSA-N 387.508 5.563 30 20 GKED N#C[C@@H](NC(=O)Cc1cc(Cl)ccc1Cl)c1cccc(Cl)c1Cl 731196041 VEUSJIHVQJQZSO-CQSZACIVSA-N 388.081 5.224 30 20 GKED CCc1ccc(NC(=O)[C@@H](C)SCc2cc(Cl)ccc2OCC#N)cc1 735320283 PEYAVNQLDSCOTA-CQSZACIVSA-N 388.920 5.065 30 20 GKED N#Cc1csc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)c1 748440924 SRPJSTHLFSKZOD-NSIKDUERSA-N 375.222 5.307 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCc3ccccc3C2)cc1 749423099 PLHUCWCHZYDFFR-ZEQRLZLVSA-N 381.479 5.021 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 750688670 VFQYFRCQNPHBQV-ILCZHQDMSA-N 376.456 5.537 30 20 GKED CCOc1c(OC)cc(/C=C2/CCc3cc(SC)ccc3C2=O)cc1OC 750907865 BOGBKYLEOLHMGI-YBEGLDIGSA-N 384.497 5.037 30 20 GKED Cc1sc2ncn(N=Cc3cc(Cl)ccc3F)c(=O)c2c1-c1ccccc1 753690481 WTWFPPQBBJJNJT-UHFFFAOYSA-N 397.862 5.108 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3c[nH]c4cccc(F)c34)c2)cc1 761342273 HWKPSPXSLMWOEX-UHFFFAOYSA-N 399.425 5.204 30 20 GKED Cc1c(C(=O)/C=C\c2ncc(-c3ccccc3)s2)cnn1-c1ccc(C#N)cc1 770572750 RVRIKKWNKGIRCG-QXMHVHEDSA-N 396.475 5.072 30 20 GKED Cc1nc(NC(=O)c2ccccc2SCC#N)sc1Cc1ccccc1F 772122564 NXVQCURZLYXYTK-UHFFFAOYSA-N 397.500 5.049 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)c1 772985060 QAZCAJIEJWIIHX-ZJSXRUAMSA-N 390.527 5.250 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)c(F)c1 776743554 PCZYEXQAAVJUAE-NSYGIPOTSA-N 386.470 5.463 30 20 GKED C#CCCCCCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 779768255 JZQCZAWCWJCIOG-UHFFFAOYSA-N 392.377 5.073 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1sc2cccc(Cl)c2c1Cl 780158175 ABAFXGILOLLQKS-JTQLQIEISA-N 391.279 5.751 30 20 GKED C=C(C)COc1cccc(NC(=S)Nc2ccc(Br)cc2)c1 783734746 PZYAQVNLGZVORD-UHFFFAOYSA-N 377.307 5.213 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC2CC(c3ccc(Br)cc3)C2)c1 786858386 XWWUBROPOJVPTC-UUKMXZOPSA-N 399.332 5.166 30 20 GKED FC(F)Oc1ccc(NCc2nc(C(F)(F)F)cs2)cc1C(F)(F)F 795049997 WJXGZHIIIOXMJJ-UHFFFAOYSA-N 392.271 5.394 30 20 GKED C=CC[C@@H](OC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 797552635 GNFZBEAQYCMMMJ-YLJYHZDGSA-N 399.277 5.408 30 20 GKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1O 815635589 GDXHXAKJKGWGQI-QZTJIDSGSA-N 377.315 6.175 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1)c1nc2ccccc2o1 847628996 QDZLVHSPYAJDMG-OAHLLOKOSA-N 384.357 5.145 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccsc1)c1nc2cc(C(F)(F)F)ccc2s1 860477783 LSGOLCFHZUGVMU-YNEHKIRRSA-N 392.427 5.357 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354233 XUOYWCMWEIMCBX-JXFKEZNVSA-N 375.497 5.628 30 20 GKED COc1cc([C@@H](C)NC(=S)Nc2ccccc2C#N)ccc1OCCC(C)C 916025732 MGGVFMMPBFKPHI-MRXNPFEDSA-N 397.544 5.039 30 20 GKED COc1ccc(C(=O)/C=C/c2cc3cccc(OC)c3o2)cc1Br 916134324 GPPSWCAYQLLBBC-BQYQJAHWSA-N 387.229 5.109 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)c(-c2ccccc2)n1 916137446 UHPSETOMRTXJLA-KHPPLWFESA-N 395.384 5.379 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NN[C@@H](C)c1ccccc1 920385888 JVZYMPYUGCIUBU-AWEZNQCLSA-N 387.314 5.231 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ccc(Cl)cc3Cl)s2)c1 1776029837 YNNCKTAWEXLPGV-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)/C=C\c1ccc(/C=C\C(=O)c2ccccc2OCc2ccccc2)cc1 1776126660 SOWLHOPAHGTVNY-RYOQUFEFSA-N 384.431 5.260 30 20 GKED CC(=C\c1ccccc1C(F)(F)F)/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1776200191 ZATPSPPPYUXXCP-ZTXQZFCBSA-N 386.369 5.490 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)s1 1776339874 IQWXOJGZPUWRGF-YWEYNIOJSA-N 396.464 5.507 30 20 GKED CC(C)c1cccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776375376 LAHLORZNFLKMHG-PKNBQFBNSA-N 376.477 6.133 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1COC1CCCCC1 1776786981 GGWCXOBFIIMAGQ-JOCHJYFZSA-N 389.580 5.829 30 20 GKED CCCCCCCOc1ccc(CNc2ccc([C@@H]3C[C@H]3C(=O)O)cc2)cc1 1776789213 WXXSPFFWOAWULZ-XZOQPEGZSA-N 381.516 5.836 30 20 GKED COc1ccc(C(=O)O)cc1/C=C/C(=O)c1sc2c(Cl)cccc2c1C 1777354595 BKZMIEAOOAZNHQ-SOFGYWHQSA-N 386.856 5.466 30 20 GKED Cc1cc2c(s1)C/C(=C/c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777428066 JZHBCCOFOKMGCX-CJBPROBKSA-N 390.460 5.084 30 20 GKED CCc1ccc(OCc2nnc(S[C@H](C)C#N)n2[C@@H](C)c2ccccc2)cc1 7196527 YITISRVZZDUSAF-SJORKVTESA-N 392.528 5.033 30 20 GKED C[C@@H](SC1=Nc2ccccc2CS1)C(=O)Nc1ccc(C#N)c(Cl)c1 22022538 TZXXDTJYQDAAIV-LLVKDONJSA-N 387.917 5.206 30 20 GKED C=CCn1c(SCc2cc(-c3ccc(F)cc3)no2)nnc1-c1ccccc1 32316056 XFAAFAUOUWKZIN-UHFFFAOYSA-N 392.459 5.218 30 20 GKED Cc1nc(NC(=O)c2oc3c(ccc4ccccc43)c2C)sc1SCC#N 44788938 BRVJLIOPTNVEQZ-UHFFFAOYSA-N 393.493 5.527 30 20 GKED C=CCN(Cc1ccccc1)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 45934242 HCSYMZQIOUOHTQ-UHFFFAOYSA-N 380.875 5.142 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1 46670281 YHUOUYRGRAIIOL-MRXNPFEDSA-N 388.533 5.003 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)cc1 61017280 APSBFGZUYJARPA-GOSISDBHSA-N 381.516 5.432 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)c1cccc(C#N)c1 65744721 FPRHMJJYYZYBCN-UHFFFAOYSA-N 388.279 5.265 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(F)(F)F)cc2)cc1 66037272 UUBVAYMQLOSLMC-OALUTQOASA-N 388.389 5.658 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)(F)F)cc3)n2)cc1 66545020 DUGRDYRJHFCXQM-MRXNPFEDSA-N 397.381 5.191 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccnc2ccccc12 68054039 VUXNGADSHSURFU-HNNXBMFYSA-N 393.537 5.217 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 103674268 FFOANPMUTHPJBX-YLJYHZDGSA-N 385.492 5.442 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 117001023 OXMKDADORBZIBH-CYBMUJFWSA-N 391.393 5.044 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)n1 123835918 QHVWCDLWBVBJCW-GOSISDBHSA-N 399.475 5.114 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(CCC(F)(F)F)cc1 129338138 MOENIGFEMLSPTM-AWEZNQCLSA-N 392.446 5.828 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)C1(C#N)CCC1 130275887 JRYGFRFZKYBYIE-UHFFFAOYSA-N 390.462 5.364 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(COC3CCCC3)cc2)C2CC2)cc1 172462594 HPMMHHBZGHPEKH-UHFFFAOYSA-N 389.499 5.214 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ncoc1-c1ccccc1Cl 172997528 IFJPIGQWQBTOIO-CYBMUJFWSA-N 397.887 5.499 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C/c2ccccc2OC(F)(F)F)n1 177744895 ZPXKMPYEXSODMC-SBDDDAINSA-N 380.391 5.055 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(NC(=O)OC(C)(C)C)c2)n1 177776184 PKWWCOIZDUDYFI-HNNXBMFYSA-N 385.489 5.104 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1 182125687 DAUCFFSCTNXIRA-CYBMUJFWSA-N 396.368 5.314 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)Cc1ccccc1-c1ccccc1 184333578 DACHWLWMCZHWLR-SFHVURJKSA-N 385.467 5.308 30 20 GKED Cc1sc([C@H](C)NCc2ccc(F)c(C#N)c2)nc1-c1ccc(Cl)cc1 184953585 CJUGDEUAXPKLQL-LBPRGKRZSA-N 385.895 5.634 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1cccnc1)Cc1ccco1 191454311 TYOHNNLONYIMEL-UHFFFAOYSA-N 389.499 5.761 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)c(F)c1 192630721 IXAVYYVFTXMXIK-NRFANRHFSA-N 382.385 5.178 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2cnn(C(C)C)c2)cc1OCC 208118750 SYDDKLCRXNMKBI-FPLPWBNLSA-N 376.884 5.201 30 20 GKED CCc1ccc(C(=O)/C=C\c2csc(N(C(C)=O)c3ccc(F)cc3)n2)o1 255541394 QKVKJSHNFWVMHS-POHAHGRESA-N 384.432 5.018 30 20 GKED CC(C)c1cc(Br)ccc1N/C(O)=N/[C@H]1CCOC2(CCC2)C1 328835577 MLGFBKSMGZWVRG-AWEZNQCLSA-N 381.314 5.000 30 20 GKED CC1(C)CCC(c2noc([C@H]3CCCN(C(O)=Nc4ccccc4)C3)n2)CC1 329370986 AVYRQKQCFUOCRI-KRWDZBQOSA-N 382.508 5.179 30 20 GKED C[C@@H]1C[C@H](C(O)=Nc2nc(-c3ccc(Br)s3)cs2)CCC1=O 329399180 VKHHLLDQRDRORI-RKDXNWHRSA-N 399.335 5.227 30 20 GKED C[C@@H]1C[C@@H](C(O)=Nc2sc3c(c2C(=O)c2ccccc2)CCC3)CCC1=O 329403845 WVDFGCREOXOJEG-HIFRSBDPSA-N 381.497 5.061 30 20 GKED CN(C)C(O)=Nc1ccc(/C(O)=N/[C@@H]2CCCCC23CCCC3)c(Cl)c1 329638367 WBUREGZFZUBGJE-QGZVFWFLSA-N 377.916 5.255 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(F)c2)cc1)c1ccc(C#N)cc1 409571820 SMBSVJGZHWPTBG-OAHLLOKOSA-N 375.403 5.372 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 409866012 IDWBXZHDACRXKH-GJZGRUSLSA-N 375.255 5.006 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cnn1C1CCCC1 430594936 WPSDZYRIVQEMHG-OAHLLOKOSA-N 384.549 5.195 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 431810505 NLEBQPLHQMPHDZ-GCJKJVERSA-N 379.504 5.269 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@H]1c1cccnc1 432800036 JSVRMISXHQPZFO-QFIPXVFZSA-N 398.466 5.361 30 20 GKED N#CCCC[C@@H](NCC(=O)Nc1ccccc1Cc1ccccc1)c1ccccc1 433010587 CPYGCLQNKHJBNZ-XMMPIXPASA-N 397.522 5.241 30 20 GKED C=CCn1c(SCc2ccn(C(CC)CC)n2)nnc1-c1ccccc1F 433374314 URMRSOXRFVRWQZ-UHFFFAOYSA-N 385.512 5.120 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC2(CCC2)C[C@H]1C 433496764 GYIQXPLTHPUXFP-QGZVFWFLSA-N 375.472 5.455 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 436136604 WUKJOFOFFUUBEH-UHFFFAOYSA-N 394.818 5.009 30 20 GKED Cn1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c2ccccc21 437477528 SOFSXIIBFXHRER-UHFFFAOYSA-N 385.398 5.234 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(C2CC2)[C@@H](C)c2ccccc2Cl)cc1 437873795 RATHZUHIZIAAFX-HNNXBMFYSA-N 397.906 5.013 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 438465547 KSXDQDJOTRKNQF-RDJZCZTQSA-N 386.417 5.324 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(C)c1O 439288318 TXZHBDBGCVYXSC-UHFFFAOYSA-N 376.387 5.064 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)CSc2ccccc2C#N)cc1 439718293 WUWJFXYGJBBJPL-HXUWFJFHSA-N 378.541 5.312 30 20 GKED Cc1cc2c(Br)ccc(C(=O)[C@H](C#N)c3nc4ccccc4o3)c2o1 443517306 DEFBNGMTYYAZRA-ZDUSSCGKSA-N 395.212 5.135 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CCCC1(C)C 444837032 NQOQUJWUOPPVTP-IBGZPJMESA-N 397.544 5.599 30 20 GKED CCO[C@@H](c1ccccc1)c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 445803396 SNZJNLWGUTWXOP-DSTYWPJMSA-N 398.466 5.234 30 20 GKED CC[C@@H](NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc(C#N)cc1 447538831 DLBSXHYOJXASAK-HSZRJFAPSA-N 387.458 5.191 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(CF)CC2)cc1Cl 454489026 QRLWINYBYTZNNK-IBGZPJMESA-N 385.870 5.209 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C2CC2)o1 458809105 ZVYIQMZPOLTUIM-ZPMCFJSWSA-N 391.515 5.512 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Cl)cc1OC(F)F 460238007 LVGCAIMLVLHNHW-UHFFFAOYSA-N 391.805 5.033 30 20 GKED COc1ccccc1CN(C(=O)CCCC#N)c1cc(Cl)cc(Cl)c1 463583631 SHJIIMSLNDCHNW-UHFFFAOYSA-N 377.271 5.229 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc2nc(-c3cccc(Cl)c3)sc2c1 470591809 UQUILRMJGJIZLA-LBPRGKRZSA-N 384.892 5.383 30 20 GKED COc1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)ccc1F 474282589 JMQBLBVEFNQJPR-UHFFFAOYSA-N 378.428 5.109 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1)c1ccccc1 476331739 CIDDWVRKHPWBGA-QGZVFWFLSA-N 392.405 5.783 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(SCc2ccccc2)cn1)c1ccccc1 476471247 LQGPFXAYOSTIMX-FQEVSTJZSA-N 387.508 5.400 30 20 GKED CC(C)(NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 477001895 KPRHUMZBVNCEPE-INIZCTEOSA-N 390.405 5.024 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)Cc1cccs1 480252035 MCQSQVOIHXBRLV-INIZCTEOSA-N 391.496 5.473 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCC[C@H](C)C2)cc1 480644751 JAABTYZUQFFRER-INIZCTEOSA-N 379.460 5.013 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccc(F)c(F)c1 481063674 XOKMPPGHTRHLIC-SFHVURJKSA-N 398.375 5.899 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2c1 483228617 JTGHEHFPZKTQQP-OAQYLSRUSA-N 393.446 5.159 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 484144351 YXQCCHNKRGPFDX-OAHLLOKOSA-N 389.459 5.471 30 20 GKED C=CCC[C@@H](NC(=O)CCc1cncc(C)c1)c1ccc(C(F)(F)F)cc1 486779597 NRORVVOVRPKYMW-LJQANCHMSA-N 376.422 5.165 30 20 GKED C=CCC(C)(C)C(=O)NC[C@]1(C)C[C@@H](NC(=O)C(C)(C)CC=C)CC(C)(C)C1 493954660 KEMQZSJPVNRVHY-MHECFPHRSA-N 390.612 5.008 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@H]1CCCC[C@@H]1C 497803789 IXINPCATBZNGAK-SBUREZEXSA-N 394.490 5.134 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)CCCc1ccc(Cl)c(Cl)c1 500550072 BKTJSWIBAOCKRS-UHFFFAOYSA-N 377.271 5.225 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 505942868 KLCLYQPOHCVQAO-MRXNPFEDSA-N 378.419 5.201 30 20 GKED CCN(C(=O)c1sc(-c2ccccc2)nc1C)[C@H](C)c1ccc(C#N)cc1 509569056 FUSCXXGYODVRFZ-MRXNPFEDSA-N 375.497 5.214 30 20 GKED C=CCn1c(SCc2csc(CCCC)n2)nnc1-c1ccc(F)cc1 510589209 MILHYDMGAGRZJH-UHFFFAOYSA-N 388.537 5.362 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cccc2ccccc12 518168496 JFMJUAXMMPXFMN-DLBZAZTESA-N 389.524 5.974 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1)C1(C#N)CCC1 519108848 IAPNEEOGJHKJJQ-UHFFFAOYSA-N 399.450 5.184 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Oc2ccc(Cl)cc2)c2ccccc2)cc1 520096983 FQNPLFKORSIVBD-NRFANRHFSA-N 376.843 5.165 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cccc(F)c2F)c1 522640643 RSXAKINRMVORHE-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)nc1 522761921 FAHBNOAQXSFKLR-UHFFFAOYSA-N 375.431 5.540 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(COC2CCCC2)cc1 524798999 XJDVHOOXWIHFRD-UHFFFAOYSA-N 382.479 5.505 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 533509442 XZFXYESTEKCUEK-QFIPXVFZSA-N 396.874 5.333 30 20 GKED C[C@H](N[C@@H](C)c1ccc2ccccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 541175238 CNMQGTPGDCDPID-OALUTQOASA-N 377.491 6.185 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 544834787 NTJXAJZJCKEUIM-MRXNPFEDSA-N 376.378 5.006 30 20 GKED C=C[C@H](Cc1nc(Cc2ccc(OCc3ccccn3)cc2)no1)c1ccccc1 546984456 ZRMVAJMTBJSGTO-HXUWFJFHSA-N 397.478 5.147 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1cn(-c3ccccc3)nc1-c1ccccc1)CC2 554997680 PWLHGFGGCRCNDK-VWLOTQADSA-N 390.490 5.188 30 20 GKED Cc1ccc(NC(=O)C[C@@H](C)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 559860719 YFFAYHGVHBJSQE-XLIONFOSSA-N 383.923 5.390 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2cccc(C)c2s1 569028382 ATYHLPDHJAFQTR-UHFFFAOYSA-N 399.475 5.829 30 20 GKED N#CC1(c2nc(-c3ccc4nc(C(F)(F)F)sc4c3)no2)CCCCC1 570163284 HPANCGCSLCSIPZ-UHFFFAOYSA-N 378.379 5.091 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)CC1 573114235 TZPYSVMEVJYJJT-HSZRJFAPSA-N 387.483 5.248 30 20 GKED CSC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 573271380 JAABTPSWAUHDQR-UXHICEINSA-N 392.490 6.134 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)s3)cn2)c1 586123247 LEMIUTQFEVZLLY-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC[C@@H]1CCc2ccccc2N1 593758370 SXGGFRXGLCIWRL-AEFFLSMTSA-N 394.544 5.019 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CN1CCC[C@H](CC#N)C1 595622798 DHZUVCXKIPOGCW-CQSZACIVSA-N 379.451 5.263 30 20 GKED N#CC1(C[C@H](O)CNc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)CC1 600739237 QQWHXGFBNXTQPA-AWEZNQCLSA-N 399.903 5.209 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cc2ccccc2o1 603693586 ZOIIPCZCMMXUQF-HNNXBMFYSA-N 398.422 5.374 30 20 GKED C=CC[C@H](C)NC(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 604902551 JTZVUNCNDQROCF-LBPRGKRZSA-N 383.542 5.154 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccnc1Oc1ccccc1 608914874 DWNBURQMVDDPKK-UHFFFAOYSA-N 386.455 5.188 30 20 GKED CC(C)(C)[C@H](NC(=O)NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608918791 TUCNFZBJDARZIV-GOSISDBHSA-N 389.421 5.164 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320179 UMEFDJVDDPURRI-MRXNPFEDSA-N 391.883 5.743 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 614396067 YIDOUQQNIHJGTG-UHFFFAOYSA-N 387.464 5.276 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3CCC(C(F)(F)F)CC3)cn2)cc1 618082621 DAIBTBMGLSCFES-UHFFFAOYSA-N 389.377 5.053 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 643123895 XIKCPZGSFXCGKN-QGZVFWFLSA-N 378.497 5.112 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 657529405 VMXHMQWAINNTGE-OXQOHEQNSA-N 387.524 5.191 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 679337079 KFWBZRNUHDIFAD-UHFFFAOYSA-N 388.336 5.196 30 20 GKED CC(C)COc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1Cl 726457282 MPLPIHURGLPJHK-UHFFFAOYSA-N 394.327 5.709 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)c1 726458965 HVBKKZLIRYIYQT-AWEZNQCLSA-N 377.538 5.147 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1c(Cl)cccc1Cl 730416659 HAVTXXDQANRHOI-ONGXEEELSA-N 393.270 5.722 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 730689256 CLJNKPMKBLEXCC-CJNGLKHVSA-N 398.915 5.403 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1nc(-c2ccccc2)cs1 730922011 IYCUPYOSMODIQR-BHDDXSALSA-N 394.499 5.943 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)s1 732729552 YRSJPLLDMMCPJR-STMXVASLSA-N 385.558 5.188 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccc(-c3ccccc3Cl)o2)c1 733771600 XSKAQVZGQZBUIC-MRXNPFEDSA-N 394.858 5.211 30 20 GKED CCOc1cc(/C=C\C(=O)c2c[nH]c3ccc(OC)cc23)cc(Cl)c1OC 734306153 AYKUSTSAWPVEJP-YVMONPNESA-N 385.847 5.133 30 20 GKED C=CC[C@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1ccncc1 734360993 QDHDTUUYCXBOEQ-SFHVURJKSA-N 382.916 5.414 30 20 GKED C=CC[C@@H](NCc1ccc(-c2ccc(Br)cc2)s1)c1ccncc1 734510586 XPXDUMCUDQEIGI-LJQANCHMSA-N 399.357 5.980 30 20 GKED COc1cc(CSc2nc(C)cs2)ccc1OCc1cccc(C#N)c1 734981340 PYMYVXBGPMTPQF-UHFFFAOYSA-N 382.510 5.203 30 20 GKED Brc1ccoc1C=NNc1ncnc2sc(-c3ccccc3)cc12 735227480 DLJNUTYMGPYKJJ-UHFFFAOYSA-N 399.273 5.160 30 20 GKED Cc1cc(C)c(NC(=O)CSCc2cc(Cl)ccc2OCC#N)c(C)c1 735320490 UZJCQEBNNADWKV-UHFFFAOYSA-N 388.920 5.040 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)C[C@H](CC)c1ccc(C)cc1 739153304 AIVHQCJSZFZEQL-UNMCSNQZSA-N 390.527 5.351 30 20 GKED COc1cc(C=NOCc2cc(Cl)ccc2Cl)ccc1OC(F)F 742350621 ATYFXLJEFHJIJW-UHFFFAOYSA-N 376.186 5.154 30 20 GKED COc1ccc([C@@H](NCc2ccc(N(C)CCC#N)cc2)c2ccc(C)cc2)cc1 742725563 WGBMFCFCECMLGY-SANMLTNESA-N 399.538 5.233 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)Cc1cccs1 743092971 IZDNYHUBSRKKDB-HTAPYJJXSA-N 389.524 5.404 30 20 GKED Cc1cc(O)ccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 743477679 NLSLFBQGAAIQRI-UHFFFAOYSA-N 378.815 5.270 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1SC(F)(F)F)c1ccccc1 748570073 ALTBELRKROMBNI-AWEZNQCLSA-N 379.407 5.465 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cccc4cccnc34)cc2F)c1 749271722 DJLIYFHQTMYSQO-UHFFFAOYSA-N 383.426 5.437 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nccs1 752485698 PRRIBHAOFDXMBH-OXJNMPFZSA-N 390.512 5.066 30 20 GKED C[C@H](OC(=O)c1ccc(C(F)(F)F)cn1)c1ccc(F)c(C(F)(F)F)c1 754371180 JSQHCENCOSGAQN-QMMMGPOBSA-N 381.247 5.176 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 755219981 NEAQYJYZXXOAKA-RKYDEWFRSA-N 395.506 5.909 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCO[C@@H](c2cccc(C#N)c2)C1 761756426 HTWXCMULEJGSQP-YCRPNKLZSA-N 393.874 5.001 30 20 GKED C#C[C@@H](C)N(C)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 770512234 JNMHIWNUULRBRE-MRXNPFEDSA-N 392.478 5.217 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(N(C)C)cc1 775488600 PHOBLWQZGFEODH-MHECFPHRSA-N 398.510 5.291 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1 777704579 WJYDORWHMMMNOZ-CYBMUJFWSA-N 399.878 5.050 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3ccc(C)cc3)n2)cc1 779195172 SAQIMZYOQHNLLZ-JXFKEZNVSA-N 390.508 5.182 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ncsc2C(F)(F)F)s1 788135287 XUJDIXRGYZFGAD-UHFFFAOYSA-N 392.472 5.169 30 20 GKED C#CCC1(C(=O)Nc2ccc(Cl)c(SC(=O)N(C)C)c2)CCCCC1 805439152 NCADIAGPAZZFNI-UHFFFAOYSA-N 378.925 5.026 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCN(C(=O)Oc2ccccc2)CC1)c1ccccc1 815636018 NRIFZVZKNVNSNR-FYYLOGMGSA-N 391.515 5.065 30 20 GKED CCOc1c(Cl)cc(C=NOCc2ccc(Br)cc2)cc1OC 826534609 IAQNQISBFNOJGL-UHFFFAOYSA-N 398.684 5.061 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)[C@H]1CCCC2(CC2)C1 850759126 GKTYGMOETTXBGG-HKUYNNGSSA-N 388.467 5.097 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2ccc(C(F)(F)F)nc2Cl)cc1 862380355 UXIOLKOPYJLQKC-CYBMUJFWSA-N 382.813 5.007 30 20 GKED O=C(Nc1cncc(C(F)F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 880906245 LULWYPBKIHLONQ-UHFFFAOYSA-N 393.278 5.194 30 20 GKED N#CC(CCOc1cc(F)ccc1[N+](=O)[O-])(c1ccccc1)c1ccccc1 915659229 WYXGATIMEVIWHC-UHFFFAOYSA-N 376.387 5.013 30 20 GKED CC(C)(C)c1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 920221769 OSXMZQWASOBRMH-SFHVURJKSA-N 375.497 5.348 30 20 GKED O=C(/C=C\c1c(F)ccc2sc(C(=O)O)cc12)c1ccc2ccccc2c1 1776131400 PZNXYGMCWBKJOA-CLFYSBASSA-N 376.408 5.788 30 20 GKED O=C(O)COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)cc1Cl 1776131512 SUILDZMKZZKELF-WUXMJOGZSA-N 392.838 5.367 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776697890 XEMURNQOAWJMAO-BYIUCRAPSA-N 390.504 6.523 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)ccc(Br)c1F 1776783150 GODNUDZLRSFTNS-AWEZNQCLSA-N 388.321 5.190 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)on2)nnc1-c1ccc(F)cc1 7941691 FBCDGJUAUDTGFG-UHFFFAOYSA-N 392.459 5.218 30 20 GKED CC(C)Cn1c(SCc2cc(C#N)ccc2F)nnc1-c1ccccc1F 11019595 IUYUEGVGXPUECB-UHFFFAOYSA-N 384.455 5.043 30 20 GKED COc1cc(C#N)ccc1OC(=O)CSc1cccc2cccc(Cl)c12 22368451 NDMHLXSWMXNABY-UHFFFAOYSA-N 383.856 5.071 30 20 GKED C[C@@H](CCc1ccccc1)NC(=O)c1ccccc1Sc1ccccc1C#N 24587019 FZIXTYPOMGXVSZ-SFHVURJKSA-N 386.520 5.461 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2coc(-c3ccccc3)n2)n1 36774898 KGQLRHXEXJLMGZ-UHFFFAOYSA-N 375.375 5.228 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1nc(C2CC2)no1 56215350 SGHWMAMYYLSNPA-LBPRGKRZSA-N 380.835 5.437 30 20 GKED Cc1nc2cc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)ccc2o1 57462843 SKOWOVUHZDKHFY-UHFFFAOYSA-N 399.475 5.553 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 60127418 PYAGFIBILLWBCP-SFHVURJKSA-N 385.467 5.407 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccc(F)cc1F)c1ccccc1)c1ccccn1 106353753 LHIUDRKQZBOWQE-HRAATJIYSA-N 380.419 5.070 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1nc(-c2ccncc2)cs1 114619043 YULLEXLOTQBIJB-PCCBWWKXSA-N 395.487 5.338 30 20 GKED N#C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)C1CCCCC1 115185554 AFKOGMYHKIPVCC-IBGZPJMESA-N 378.501 5.151 30 20 GKED CC(C)c1ccc(-c2nc(C[S@](=O)Cc3ccc(C#N)cc3)cs2)cc1 125603966 KSJUCZVIORLISE-SANMLTNESA-N 380.538 5.254 30 20 GKED C=CCn1c(SCc2cc(Cl)nc3ccccc23)nnc1-c1ccccn1 126323873 MDDWFDAPTBNDGE-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CC[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nccs1 175730493 ZEZSIMOPBRSPTQ-KRWDZBQOSA-N 379.510 5.047 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc(Oc3cnccn3)cc2)cc1 180335729 XFOOKMJWORMJES-UHFFFAOYSA-N 392.462 5.097 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)c3ccc(C4(C#N)CC4)cc3)CC2)n1 180379641 GYHWTDVOPIYISN-UHFFFAOYSA-N 393.556 5.016 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(OCC#N)cc1 181942351 MHMMDQGRIXFFOH-NIYFSFCBSA-N 398.506 5.354 30 20 GKED COc1ccc(CN[C@@H](C)c2cc(Cl)ccc2Cl)cc1OCCCC#N 189469969 YRNJJSPOVDBBBI-AWEZNQCLSA-N 393.314 5.535 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ncc(-c2ccc(C)cc2)o1 189904540 FJWQTBCEIBMPMQ-UHFFFAOYSA-N 388.511 6.073 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)nc2ccccc21 255926955 XJWAHQIPINAQDK-KRWDZBQOSA-N 393.556 5.773 30 20 GKED CCc1nc([C@H](C)/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)cs1 329388702 UDLHVEREKUSHLF-GOEBONIOSA-N 386.565 5.230 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2OCc2cccs2)c1 409836739 OQZUWUAPWHDBOA-UHFFFAOYSA-N 392.480 5.262 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3cccc(F)c3C#N)C2)nc2ccccc21 428375705 POMWBNAQCWPAPV-SFHVURJKSA-N 376.479 5.008 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(Cc2ccccc2)CC1)c1ccccc1 431643622 OTKVPXDWOAPVPE-HSZRJFAPSA-N 375.516 5.086 30 20 GKED CC1(C)Cc2ccc(Cl)c(NC(=O)N[C@H](CCC#N)c3ccccc3)c2O1 435326774 JXDSZPAERXASIJ-QGZVFWFLSA-N 383.879 5.220 30 20 GKED CC(C)c1oc([C@@H]2CCCN2CCCCC(C)(C)C#N)nc1-c1ccccc1 444664679 ROMSTTVWZCBOLC-FQEVSTJZSA-N 379.548 6.322 30 20 GKED N#Cc1c(F)ccc(CNc2ccc(C(=O)Nc3ccccc3)cc2)c1Cl 446883190 FLEGCTNISQIKDQ-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(F)cc1F)c1ccccc1 458840578 NTYXIPUJCCMIOO-NHCUHLMSSA-N 383.442 5.246 30 20 GKED C[C@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 462541755 HLCCZFSRGPGPKQ-MSOLQXFVSA-N 379.463 5.078 30 20 GKED CCN(C(=O)c1cc(C2CC2)nc2ccc(F)cc12)[C@@H](C)c1ccc(C#N)cc1 463136062 BVQBZTOPAKGPNM-HNNXBMFYSA-N 387.458 5.346 30 20 GKED CN(C(=O)c1c(F)cc(C(F)(F)F)cc1F)[C@H]1CC[C@@H](C(F)(F)F)CC1 464571072 PORMSKXJCVPPEE-WAAGHKOSSA-N 389.286 5.177 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc3cnccc23)cc1 465025071 GZGJITKDFWJJEM-UHFFFAOYSA-N 395.437 5.088 30 20 GKED Cc1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c(C(F)(F)F)o1 471759194 VZJOBJFIFLADHK-UHFFFAOYSA-N 376.359 5.459 30 20 GKED N#CC[C@@H](CC(=O)Nc1nc(-c2c(F)cccc2F)cs1)c1ccccc1 479719061 NEXRERMBKSMEBF-AWEZNQCLSA-N 383.423 5.114 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@@H](CCC#N)c2ccccc2)s1 480007666 ULJYLQZUGKRUCW-IBGZPJMESA-N 375.497 5.202 30 20 GKED N#Cc1c(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)sc2c1CCCCC2 482245908 PNRDDSVTRRXOOW-INIZCTEOSA-N 392.446 5.563 30 20 GKED CCOc1ccc(N(CC)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 482462627 HNQWJLNTQZWOSU-UHFFFAOYSA-N 386.451 5.416 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccccc1COCc1ccccc1 485748758 KGQRFBKVGHOYLJ-UHFFFAOYSA-N 389.520 5.934 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)N[C@H](C#N)c3ccc(Br)cc3)oc12 499392955 QCLXCDXXBRHAEV-MRXNPFEDSA-N 397.272 5.115 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccc(Cl)cc1 499814103 QGNXAXVCOWUYLQ-YCPHGPKFSA-N 379.674 5.131 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 504117633 XUGAAVDVEHPJKH-QGZVFWFLSA-N 391.540 5.577 30 20 GKED CC(C)c1ccc(CN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 517528120 QDIKFBILJWLTBO-KRWDZBQOSA-N 381.545 5.868 30 20 GKED C=C(C)COc1cc(CNCc2ccc(-c3csc(C)n3)cc2)ccc1OC 520218012 VWZHTCNJTRGZCI-UHFFFAOYSA-N 394.540 5.372 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(-c2ccccc2OC)c1 522073623 SSERLPCHDCRAER-UHFFFAOYSA-N 390.458 5.721 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 523510624 RYBHLGLUEOFRME-UHFFFAOYSA-N 393.556 5.445 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(Br)cc1C(F)(F)F 537298684 NRARBUMOHOXHLW-UHFFFAOYSA-N 394.231 5.169 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(NC(=O)c3ccoc3)c2)CC1 537732009 FZGLUPJYQHWYRZ-UHFFFAOYSA-N 385.467 5.348 30 20 GKED CCN(C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)[C@@H](C)c1cccnc1 541159323 VTAJUZFUJWLZCY-MOPGFXCFSA-N 398.510 5.474 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)c1ccccc1Sc1ccccc1C#N 546875999 VVOFZEYQDXTHRT-CQSZACIVSA-N 378.419 5.170 30 20 GKED CN1CC[C@H](NCc2ccc(-c3ccccc3C#N)cc2)C[C@@H]1c1ccccc1 551087213 NDPQEJHVBQMAJH-AZGAKELHSA-N 381.523 5.150 30 20 GKED N#CCCC[C@@H](NCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccccc1 552312024 MLPUNRXUVGLGGH-LJQANCHMSA-N 391.496 5.064 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cc2ccccc2s1 553319870 GQEWMRPOAJSGSY-AWEZNQCLSA-N 381.526 5.617 30 20 GKED CSC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 573271381 JAABTPSWAUHDQR-VQTJNVASSA-N 392.490 6.134 30 20 GKED Cc1cc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c2nccc(C)c2c1 575076061 AQZDAIARVQATEK-UHFFFAOYSA-N 398.491 5.023 30 20 GKED CSCc1c(C(=O)Nc2cccc(C#Cc3ccccn3)c2)oc2ccccc12 603130103 DFUGHPXAEUSPMP-UHFFFAOYSA-N 398.487 5.343 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(-c4ccccc4Cl)o3)[nH]c12 605362349 CHPMUNGRTGMBKY-AWEZNQCLSA-N 375.815 5.275 30 20 GKED Fc1ccccc1-c1cnc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)o1 607727584 XFYUJCJOCFCQKF-GHMZBOCLSA-N 396.306 5.043 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1 609058586 DVDRUEVJRCVQOG-INIZCTEOSA-N 390.439 5.160 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCc2ccccn2)cc1Cl 609152294 UJLGGTUORKVDPI-OAQYLSRUSA-N 389.886 5.352 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1 609384703 JMYRDVCVUVHECQ-INIZCTEOSA-N 381.545 5.286 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)CCCCOc1cccc(C#N)c1)C1CC1 609500103 OFHCGGKVJLFPKQ-QGZVFWFLSA-N 396.918 5.513 30 20 GKED CC[C@H](CC(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccc(C)cc1 609970897 POXCWXNLSGQZTD-YUVSOPLDSA-N 390.527 5.257 30 20 GKED CCCCSCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 610043464 YPOOPFGHVUWTIQ-UHFFFAOYSA-N 384.501 5.221 30 20 GKED N#Cc1ccccc1-c1ccc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1 610614535 YILAUOKAMHLOMD-QZTJIDSGSA-N 398.350 5.398 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COC(C)(C)C)cc1 610634717 GHCNUQYLZJLLJL-UHFFFAOYSA-N 379.504 5.317 30 20 GKED COc1cc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)ccc1OCC(C)C 611392612 YTGYKHBIVUQIOB-VGSWGCGISA-N 378.516 5.330 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@H](CC1CC1)c1ccccc1 611395596 JJIFEVVANWQQDH-LAUBAEHRSA-N 393.556 5.008 30 20 GKED C=CCC[C@@H](NC(=O)CCCc1ccccn1)c1ccc(C(F)(F)F)cc1 676731383 XFJFMQSWHDPMJN-LJQANCHMSA-N 376.422 5.247 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1[nH]c(-c2ccccc2)nc1C 727262852 ZZKSDFINVRLVFW-UHFFFAOYSA-N 388.393 5.162 30 20 GKED Cn1c(-c2ccc(NC(=O)c3ccccc3SCC#N)cc2)nc2ccccc21 729366564 CAJBIKWPRYTXNH-UHFFFAOYSA-N 398.491 5.108 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)CCCc2ccc(C(C)(C)C)cc2)c1 733774582 IASTUODQMRRFFH-QFIPXVFZSA-N 392.543 5.304 30 20 GKED CS[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 740536360 RZMPBMYNMVAHSZ-APWZRJJASA-N 398.940 5.744 30 20 GKED C[C@H]1/C(=C\c2c[nH]c(-c3ccccc3)n2)C(=O)c2cccc(Br)c21 742434353 GBYLPGRVRFEXGX-SEJMYLSOSA-N 379.257 5.223 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCc2c[nH]c3cc(C)ccc23)c1 744514068 ZJLFAFYNICBETB-UHFFFAOYSA-N 382.463 5.217 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2cc(Cl)sc2Cl)n1 756299261 FOZXZUMTJHMWGA-NSHDSACASA-N 387.357 5.834 30 20 GKED CC(C)CSCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 756303630 XBSIZJFNFUKBIM-OAQYLSRUSA-N 381.545 5.243 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1c(F)c(F)c(F)c(F)c1F 769989592 IFPFQWJDPSWODT-NSHDSACASA-N 383.282 5.474 30 20 GKED CCN(Cc1ccccc1NCc1ccc(C#N)cc1F)C(=O)OC(C)(C)C 772926281 CPXNUUMDHCAONW-UHFFFAOYSA-N 383.467 5.066 30 20 GKED CCSc1ccc([C@@H](C)NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)cc1 772984961 HIJLFKCBMZTULB-VQIMIIECSA-N 384.545 5.339 30 20 GKED CC(C)(c1ccc(C(=O)OC[C@@H](C#N)Cc2cccs2)cc1)C(F)(F)F 774170106 QGIJYNSBBQBBDK-CYBMUJFWSA-N 381.419 5.127 30 20 GKED CC(C)c1ccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776154024 LGXNZBWHFVZXCT-HOYKHHGWSA-N 390.552 6.214 30 20 GKED Cc1cc(C)c(NC(=O)Nc2ccccc2O[C@H](C)C#N)c(Br)c1 780600680 QXTSHLJIQDBSAX-CYBMUJFWSA-N 388.265 5.001 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCC1(c2cccs2)CCCCC1 780668040 QFLOOMITJQOGBA-MRXNPFEDSA-N 383.517 5.063 30 20 GKED CCCC[C@@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(OC)cc1 780669506 LFASPBJSFCFCDS-VQIMIIECSA-N 381.476 5.039 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(-c4ccco4)s3)cc2)c1 787268550 SYJZWMSUPCDRPT-UHFFFAOYSA-N 387.464 5.466 30 20 GKED N#C[C@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1nccc2ccccc12 792097602 XWTAWUPSBHYICW-URBQWANRSA-N 398.462 5.852 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(Br)o3)cc2)c1 792174677 YTONFOGNGILOBF-UHFFFAOYSA-N 383.245 5.105 30 20 GKED C[C@H](NCc1ccc(Cl)nc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 801539794 PZCHGEPGMIBSSJ-AWEZNQCLSA-N 382.294 5.778 30 20 GKED N#CCCC[C@H](NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccccc1 817320146 YMHGNKGCDPCFCI-HJBMFWNLSA-N 389.886 5.453 30 20 GKED C[C@@]1(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1(Cl)Cl 835068620 SHMLHSDUQMJMEC-MLGOLLRUSA-N 399.730 5.614 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)O[C@H]1CCC[C@H](C#N)C1 839050384 IVZXNKQNVAGPEU-AAEUAGOBSA-N 379.243 5.196 30 20 GKED N#C[C@H](C(=O)c1ccc(C2SCCCS2)cc1)c1nc(C2CC2)cs1 842939976 ZKPSCDNVHLQRSJ-OAHLLOKOSA-N 386.567 5.379 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccccc1C(F)(F)F 845841860 QUIJOMXQEDKJNS-OJSRQPNCSA-N 397.396 5.118 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@H]2N[C@@H]1CCc2ccc(C#N)cc21 850539023 PTWFAEUEAQKMAR-FGZHOGPDSA-N 389.499 5.170 30 20 GKED CCCCCCCC[C@H](C)C(=O)Nc1cccc(C(=O)NC)c1Br 857621169 YSRBVQRMBDFOTC-AWEZNQCLSA-N 397.357 5.134 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCc2c[nH]c3ccccc23)cc1 915088080 ZWRNDKBXUJRZJV-DEOSSOPVSA-N 393.490 5.785 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(Br)c2)cc(Cl)c1O 916134283 HZBOTZRMIXGAHL-SREVYHEPSA-N 381.653 5.103 30 20 GKED N#C[C@@H](C(=O)COc1ccccc1Cc1ccccc1)c1nc2ccccc2s1 916627480 XRGVGWHEOOQKFU-IBGZPJMESA-N 398.487 5.142 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)nc(C)n1 916880750 WRCQOEPUFBEFFS-JOCHJYFZSA-N 386.499 5.114 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2oc3ccc(F)cc3c2C)cc1 916913532 HHNAAGDIXAJSJS-IBGZPJMESA-N 392.430 5.184 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2csc3c2CCCC3)cc1 916947613 ORJAVQDMDKLAAH-KSSFIOAISA-N 380.513 5.102 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2oc3ccc(F)cc3c2C)cc1 916954621 JMAGGFOXQXPMDS-ORAYPTAESA-N 392.430 5.355 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCOc3ccc(C)c(C)c3)n2)cc1 916974387 JWQHUTHTYXIPCG-HXUWFJFHSA-N 390.508 5.381 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4cc(C)cc(C)c4)CC3)n2)cc1 916977711 XDJQNXZUFXPZMO-FQEVSTJZSA-N 386.520 5.643 30 20 GKED CCCCOc1ccc(/C=C2\SC(=S)N(c3ccccc3C#N)C2=O)cc1 917645050 SBFHDCGRWLVMEK-UYRXBGFRSA-N 394.521 5.143 30 20 GKED C/C(=C\C(=O)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 921279318 SMQAGGDSZIPGPN-KXGXAOLJSA-N 397.334 5.255 30 20 GKED CC(C)c1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)c1 1776375481 RLGYNUMAFUWYEN-YFHOEESVSA-N 376.408 5.370 30 20 GKED CCCCCCCOc1ccc(/C=C/c2nc3cc(C(=O)O)ccc3o2)cc1 1776787869 CGIYHVZTOQVYSQ-NTEUORMPSA-N 379.456 6.046 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C/c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777455893 KKMPNWWBYUVYNM-PZXKZONTSA-N 398.458 5.583 30 20 GKED C=CCn1c(SCc2ccc(SC)cc2)nnc1-c1ccccc1OC 6077445 NRGGYPDFCBPVEA-UHFFFAOYSA-N 383.542 5.154 30 20 GKED C=C(C)CN(CC)C(=O)c1cc(-c2ccc(C)cc2)nc2c1cnn2C(C)C 22140143 KSRPRLUTQWOYAW-UHFFFAOYSA-N 376.504 5.026 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@H](C)Sc1ccc2ccccc2c1 22249812 QVSCICYVZCXRRQ-KRWDZBQOSA-N 390.508 5.276 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCCOc1cccc2ccccc12 62905845 YTTCEWARBHNMIX-UHFFFAOYSA-N 384.479 5.085 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OCC(F)(F)F)cc1 66802002 FNVSJSUIMXKPIT-ZDUSSCGKSA-N 394.418 5.274 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1Cl 103336591 WWHVALCWKFANLV-INIZCTEOSA-N 377.856 5.134 30 20 GKED N#C[C@@H](C(=O)[C@@H](Oc1cc(Cl)ccc1Cl)c1ccccc1)c1ccccn1 106983649 ZHFUOWCDRGMTRL-IERDGZPVSA-N 397.261 5.385 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2ccccc2Cl)cc1 111183637 DITQRZMCKWDDPG-OAHLLOKOSA-N 388.920 5.166 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 116594586 BOIQDQJOBLAVEB-KUHUBIRLSA-N 389.455 5.191 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nnc(-c2cccc(Cl)c2)o1 133850890 SELVMMBAMCDRFY-CYBMUJFWSA-N 384.892 5.396 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@H]1c1nc2ccccc2s1)c1ccccc1 160626179 CMNAMAQYZWQMOW-MJGOQNOKSA-N 390.512 5.188 30 20 GKED Cc1c(F)cccc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 175324379 SVBXNWSGAYTVDK-UHFFFAOYSA-N 376.456 5.550 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 185481779 SYGMZPADSQTZJV-SCLBCKFNSA-N 393.503 5.312 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)c2ccccc2)cc1 189893090 QULBJPGLBYZFBE-UHFFFAOYSA-N 398.506 6.043 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 208271807 LJIIYIYWQIMDQH-WQTJRACASA-N 377.440 5.741 30 20 GKED O=C1/C(=C/c2ccc3ncccc3c2)CSC/C1=C\c1ccc2ncccc2c1 212895606 XPHDECRJKHNVCO-JFMUQQRKSA-N 394.499 5.566 30 20 GKED CC(C)(CCC#N)CNCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1 236819001 RQMXCKPEGDUKDQ-UHFFFAOYSA-N 376.479 5.098 30 20 GKED CC[C@H](Nc1cccc(OCCCC#N)c1)c1cc(Br)ccc1O 324155917 AEUJMKZFYSYGAF-SFHVURJKSA-N 389.293 5.400 30 20 GKED C[C@@H]1C(=O)CC[C@H](C(O)=Nc2nc3c(Br)cccc3s2)C1(C)C 329296237 STGIYEDACXNDJS-NXEZZACHSA-N 395.322 5.288 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2/N=C(/O)c2ccc3c(c2)N=C(O)CCS3)cc1 329972243 XZKRELFEDVYVKO-UWJYYQICSA-N 396.512 5.304 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl 409612291 LTIMLQFTCVQEQS-UHFFFAOYSA-N 392.890 5.391 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)N[C@H](C)CCC#N 411545365 XAXZONAFJOIYQI-VXGBXAGGSA-N 378.339 5.224 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc(OC)c1C(C)C 430598318 CKTMETNFAHNIIJ-CQSZACIVSA-N 386.517 5.071 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431811180 QMCHQHDASLNZKT-XMSQKQJNSA-N 379.504 5.269 30 20 GKED CC1=C[C@@H](C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 431904640 UNKPYDAQJZBSRH-QRWLVFNGSA-N 379.891 5.425 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC[C@H]2CCC(F)(F)C2)cc1F 432245377 HXHNRUFCIWQMCI-ZDUSSCGKSA-N 389.377 5.047 30 20 GKED Cc1nc2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2s1 433120247 JFGCXGALVUSHGD-OAHLLOKOSA-N 375.478 5.218 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc(SCc2nc(C)no2)cc1)c1ccccc1 435282899 XHQJGCSKWQAOLA-HXUWFJFHSA-N 393.512 5.108 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(OC(F)F)cc1 438645658 YFCQFIVVMFDDBJ-SNVBAGLBSA-N 399.319 5.061 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)N[C@@H](CCC#N)c1ccccc1 438840131 MVHHQMCHRPCUNR-DEOSSOPVSA-N 383.495 5.540 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)c(Cl)c1 439445202 WFVVKYNDTUMBGA-HNNXBMFYSA-N 392.730 5.624 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnn(CCC(C)C)c3C)n2)cc1 442049484 MGNGEOFDQSGMPI-SFHVURJKSA-N 392.528 5.160 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 444823233 DIHNNAYQJIJJBV-HXUWFJFHSA-N 391.515 5.232 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455708712 UUTOGIPAAXZZND-GFCCVEGCSA-N 395.812 5.650 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cccs1)Cc1cccs1)c1ccccc1 474791117 HSRXGVYRWVHSEZ-SFHVURJKSA-N 380.538 5.426 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)c1ccc(Cl)cc1F 475506163 GMBYLYACGDWZGH-CYBMUJFWSA-N 390.911 5.647 30 20 GKED CC(C)(C)c1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1O 480069332 LVDXVYOYJFKZBV-UHFFFAOYSA-N 387.439 5.001 30 20 GKED COc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)c12 487148618 UTVZYXDOGBEKBE-UHFFFAOYSA-N 397.434 5.022 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(Cl)cc2[nH]1)c1c(Cl)cccc1Cl 499800559 MVKIWKJBHJOXRT-HNNXBMFYSA-N 378.646 5.123 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccnc(-c2ccccc2)c1 504151425 ORXLFXWFGIXIRB-JTHBVZDNSA-N 382.467 5.052 30 20 GKED N#C[C@H](C(=O)c1occc1-c1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 504561620 UJIJRRWRADAERQ-OAHLLOKOSA-N 396.830 5.839 30 20 GKED Cc1c(C(=O)N(Cc2ccco2)c2ccccc2C#N)cnn1C1CCCCC1 510362287 MLXWJHZSKRITKN-UHFFFAOYSA-N 388.471 5.008 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccnc2ccccc12 511548149 WYPOKWDNFBGNOB-UHFFFAOYSA-N 379.419 5.460 30 20 GKED CCN(C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 512796742 JBQKIQXAYNWIHS-HOTGVXAUSA-N 388.433 5.680 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(-c2cccs2)c1 513971508 KWMJZNCPDYNRMA-UHFFFAOYSA-N 378.497 5.644 30 20 GKED CCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 515431291 YIAYWPILWZJXQB-QGZVFWFLSA-N 382.872 5.352 30 20 GKED N#CCCSc1ccccc1NC(=O)CSCc1cccc(Cl)c1 518647734 DHMYQUOXVGXJMC-UHFFFAOYSA-N 376.934 5.218 30 20 GKED C=CC1CCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CC1 521094685 CMGOOUOXIWDIQY-UHFFFAOYSA-N 376.475 5.331 30 20 GKED CCCOc1ccccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 521600252 HONDCQLBXIMNEH-UHFFFAOYSA-N 390.414 5.531 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 521801353 ZQQRUNZRDUHHTC-MAODMQOUSA-N 386.520 5.976 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@@H](CCc3ccccc3)c3ccccc3)o2)c1 540376703 RMBFQEVRIDGBJF-QHCPKHFHSA-N 394.478 5.072 30 20 GKED C=C(C)COc1cc(CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)ccc1OC 542709908 LIHYPDBVFAEGDV-FYYLOGMGSA-N 399.506 5.141 30 20 GKED N#CCC1CCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)CC1 542903945 ZNSAGTRJIUDUHE-UHFFFAOYSA-N 383.879 5.077 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cnn(C)c1-c1ccccc1 554445304 HPBKTJFHJBVSBE-OAHLLOKOSA-N 391.500 5.125 30 20 GKED Cc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)nnn1-c1cccc(Cl)c1 556201130 PXKWSIMSOZAOEZ-IIBYNOLFSA-N 393.922 5.315 30 20 GKED CCc1c(C)sc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)c1C#N 560002044 NSRHHKSLCGXXCW-UHFFFAOYSA-N 389.402 5.310 30 20 GKED CCNc1ccc(C#N)cc1NC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 560588176 OKSJYQCHNQQGRT-UHFFFAOYSA-N 375.394 5.082 30 20 GKED C[C@H](N[C@@H](C)c1noc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 585753905 MKKLHYCIPDQDLB-ROUUACIJSA-N 394.478 5.687 30 20 GKED N#CCC[C@@H](NC(=O)NC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1 593382484 NCKUMRAWZYXXIA-GOSISDBHSA-N 387.405 5.039 30 20 GKED CCCCOc1ccc([C@@H](C)NCc2ccc(C3(C#N)CC3)cc2)cc1OC 594920827 AUQWSBFRVAXJJF-GOSISDBHSA-N 378.516 5.280 30 20 GKED N#Cc1cccc(C2(NCc3ccc(-c4ccc(Cl)cc4)o3)CCOCC2)c1 594985059 UNSVANBRXMHTRE-UHFFFAOYSA-N 392.886 5.267 30 20 GKED COc1ccc(SCCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603969011 UTZGKZULPSBJKV-UHFFFAOYSA-N 394.521 5.416 30 20 GKED N#Cc1c(NC(=O)CCc2ccc(-c3ccccc3F)o2)sc2c1CCC2 609577578 WELMCOSBFLAOJW-UHFFFAOYSA-N 380.444 5.079 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@H]1C 610019096 BJQNCBISMJFUTO-LSDHHAIUSA-N 383.492 5.371 30 20 GKED CC(C)(C#N)c1ccccc1CN1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 610859211 REGGRGFBTYTQHJ-KBPBESRZSA-N 378.360 5.050 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2ccccc2Oc2cccnc2)cc1 611252022 PFSLSWVEKXMLIU-OAQYLSRUSA-N 385.467 5.166 30 20 GKED C[C@H]1CCc2sc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2C1 613392015 BEDHYCNWPQTZQM-BBRMVZONSA-N 378.522 5.486 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 614897508 LUPKKELDNMEOCQ-UHFFFAOYSA-N 376.378 5.006 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(CCC(F)(F)F)cc2)cc1Cl 619789708 OIOBPVYVVAYUEQ-UHFFFAOYSA-N 381.785 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(Cl)cc1OC 682719548 IOHCLZZQNBZJBN-UHFFFAOYSA-N 379.909 5.001 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccc(Cl)nc1 727083037 GDPGJPOULHMRKO-UHFFFAOYSA-N 378.888 5.010 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc1 728698803 PDSCLHAFONQJJF-XYMPBJBSSA-N 377.509 5.908 30 20 GKED N#C[C@H](C(=O)CSCc1ccc(Cl)cc1)c1nc2cc(F)ccc2s1 730419942 FPHZLRKGAXAPIA-CQSZACIVSA-N 390.892 5.198 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)Cc1ccc(OCC#N)cc1 731982649 YSLOXFFYYYAVMA-UHFFFAOYSA-N 394.540 5.503 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 732732108 JEOUVSZNQHKVTA-QIBOZCLASA-N 393.899 5.412 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)sc21 733258801 LUSUQGKPHBYSCB-INIZCTEOSA-N 379.872 5.041 30 20 GKED O=[S@](Cc1ccccc1)Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1 734752920 LKAILQYPCIVVMN-GDLZYMKVSA-N 399.515 5.745 30 20 GKED N#CCOc1ccc(Cl)cc1COc1ccccc1C(=O)Nc1ccccc1 735231507 WANYZRNBXPJNJI-UHFFFAOYSA-N 392.842 5.074 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@H](CC)c1ccc(C)cc1 739153301 AIVHQCJSZFZEQL-RBBKRZOGSA-N 390.527 5.351 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1sc2cc(F)ccc2c1Cl 741641054 BLTQEWBIGPPMMI-UHFFFAOYSA-N 377.799 5.097 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCSc3ccccc32)cc1 741901358 HLBIUSWUHCZIRC-VXKWHMMOSA-N 384.504 5.560 30 20 GKED Cc1ccc(-c2nnc(CSCc3cc(Cl)ccc3OCC#N)o2)cc1 742972133 YHHYGSNHYPPTIW-UHFFFAOYSA-N 385.876 5.034 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2ccc(Cl)c(F)c2)cs1 747635281 JEJNHWYIVWLENR-UHFFFAOYSA-N 388.855 5.066 30 20 GKED C/C(=C/C(=O)Nc1nc(C)c(SCC#N)s1)c1ccc(C(F)(F)F)cc1 748181472 OJCJRJDKORXEPG-KTKRTIGZSA-N 397.447 5.128 30 20 GKED CCCCCCC[S@](=O)Cc1ccnc(-c2ccc(Br)cc2)n1 749710277 SHSCQZIMKQTCTK-QHCPKHFHSA-N 395.366 5.125 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(OC)cc1 752476387 POZSNPMXRLVEJL-OXJNMPFZSA-N 390.508 5.579 30 20 GKED CC(=NOCc1nc(C(C)(C)C)cs1)c1nc2ccccc2n1C(F)F 755943116 CYTVJOWEZLTCOG-UHFFFAOYSA-N 378.448 5.126 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](CO)c2ccc(C(F)(F)F)cc2)cc1 773120220 RQLCVJFETHAZFM-IFXJQAMLSA-N 399.840 5.221 30 20 GKED C[C@@H](NCc1ccc(CN2CCc3ccccc32)cc1)c1ccc(OCC#N)cc1 776154866 WQSQQESSNRHCJH-HXUWFJFHSA-N 397.522 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccn(-c2ccccc2)n1 789450317 NSWZKCWFIAVQMM-UHFFFAOYSA-N 388.515 5.388 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)cc1 792925440 JZOKVINTGCXWBQ-ACCUITESSA-N 379.456 5.152 30 20 GKED N#C[C@H](C(=O)CCSCc1ccccc1)c1nc(-c2ccccc2)cs1 796642753 HOKRFHMCAAWTAL-GOSISDBHSA-N 378.522 5.310 30 20 GKED N#Cc1sc(Sc2nnc(-c3ccco3)n2C2CCCCC2)nc1Cl 804338160 VURGWINMAKXZDI-UHFFFAOYSA-N 391.909 5.176 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3cccnc3)CCCC2)cc1 808238611 ABTJTOPKJVVKEM-QHCPKHFHSA-N 381.479 5.188 30 20 GKED CC(C)(C)OC(=O)Nc1ncc(CN[C@@H](CCCC#N)c2ccccc2)s1 814304282 JNPYVOHZXSCVBR-KRWDZBQOSA-N 386.521 5.015 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2nsc3ccc(C)cc23)cc1 815909968 MFTOTXBSBCANOM-KDOFPFPSSA-N 391.496 5.079 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2csc(-c3ccccc3)n2)c1 840730155 TZRBANOAFLKCEY-LPHOPBHVSA-N 377.513 5.342 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)C1 855258701 BWTGLRXYWGNTDG-CQSZACIVSA-N 395.915 5.383 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=S)Nc1ccccc1C#N 863212828 ONUKSMSCMZYLIE-UHFFFAOYSA-N 382.489 5.023 30 20 GKED CCCCCCCCC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914744644 YEGNJJFCFTYPPE-WDNDVIMCSA-N 375.397 5.763 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2c(Cl)nc3sccn23)cc1OC 915990777 XGJALLIZNBOWRS-VOTSOKGWSA-N 390.892 5.133 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)n1Cc1ccccc1 916846487 WSHICHXJRMAHQV-LJQANCHMSA-N 385.492 5.253 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCCc1ccc(Cl)cc1 916910997 YZBMKHQEGDPBLY-FQEVSTJZSA-N 396.918 5.135 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)sc1C 916945839 ZRPWXYFPCQOIHS-HNNXBMFYSA-N 395.311 5.277 30 20 GKED Cc1ccc(C)c(C(=O)/C=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)c1 1776133502 YLDZVIUXTOTQAD-QXMHVHEDSA-N 386.447 5.477 30 20 GKED C[C@@H](Oc1cccc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)c1)C(=O)O 1776472015 UCMKNDJREHMADZ-MXFUOJGSSA-N 397.279 5.119 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)CC2 1777371190 WSIQKKOGDNNYFI-LPYMAVHISA-N 398.458 5.202 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(CC(=O)O)cc1 1777487800 VLBKDGRLWMTUBL-WDZFZDKYSA-N 397.883 5.295 30 20 GKED N#Cc1c(NC(=O)CSCc2ccc(Cl)cc2)sc2c1CCCC2 7483431 JYRSDPMJKKIQNN-UHFFFAOYSA-N 376.934 5.024 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cc(F)cc2cccnc12 32785263 LBHBGUINLDSCSJ-UHFFFAOYSA-N 390.487 5.035 30 20 GKED Cc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1[N+](=O)[O-] 46444699 SXTJQRPUTCFALR-HNNXBMFYSA-N 397.843 5.170 30 20 GKED C=CCN(Cc1cccs1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 54683110 JMLPWBBNZRECKH-UHFFFAOYSA-N 386.904 5.204 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(Cl)cc2)cs1 54895058 KSUCJBQALQONHR-XFXZXTDPSA-N 396.899 5.686 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H]1CCCc2ccccc21 58986471 OHUQDLGXIGAPGX-FQEVSTJZSA-N 395.503 5.352 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CC=C(c2cccc3ccccc23)CC1 64742342 CFRWYQFWBAMNMD-UHFFFAOYSA-N 383.451 5.041 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)c1ccc2ccccc2c1 66814209 SRDFNDVCMUNXGN-HNNXBMFYSA-N 382.510 5.035 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1ccoc1C 78665712 VCTUVRXAFAKAML-UHFFFAOYSA-N 384.486 5.041 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)N2CCC(C#N)CC2)c2cccs2)cc1 105092993 HFRIRBPAJNHRPS-IIBYNOLFSA-N 381.545 5.296 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 108407554 CETNJMPGFMMWDP-ZFWWWQNUSA-N 387.936 5.339 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)[C@@H](C)C2CC2)cc1 108920902 MBSADWPBGZJSGH-KRWDZBQOSA-N 391.515 5.329 30 20 GKED N#CCC[C@H](NC(=O)CCC(=O)c1cc(Cl)sc1Cl)c1ccccc1 153580728 FARVLMBAUCHBIY-AWEZNQCLSA-N 395.311 5.179 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](SC)c3ccccc3)n2)cc1 172546327 QHZAJMLBYJGUOA-PXNSSMCTSA-N 394.521 5.099 30 20 GKED CCCN(Cc1nnc(-c2ccc(C#N)cc2)o1)[C@@H](C)c1cc2ccccc2o1 173562815 XTUJSBGMEYQAAL-INIZCTEOSA-N 386.455 5.328 30 20 GKED CC(C)CC[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 180026415 VZXBAFMLLSKYQI-HXUWFJFHSA-N 394.906 5.529 30 20 GKED C=C(C)[C@H](N[C@H](C)c1sc(-c2cccnc2)nc1C)c1ccc(F)c(F)c1 186452106 XYTAPNFYOGXTFO-YJYMSZOUSA-N 385.483 5.760 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@@H](c2ccccc2)C1 191516618 WJOUUYWBSNBEDX-PGRDOPGGSA-N 378.516 5.532 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(-c3nc4ccccc4s3)o2)cc1 237611088 OXGIRBWAOWCTTA-OAHLLOKOSA-N 389.480 5.137 30 20 GKED CC[C@@H](Nc1ccc(C#N)cc1Br)c1nc(C(F)(F)F)cs1 301871285 PMITYZDMHWPKGL-SNVBAGLBSA-N 390.228 5.359 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/[C@@H](C)c1oc2ccccc2c1C 328982520 FFAUESQYOLTEDI-ZFWWWQNUSA-N 384.501 5.466 30 20 GKED O/C(=N\C1(C/N=C(/O)C2CCC(F)(F)CC2)CCC1)C1CCC(F)(F)CC1 329115893 NBAMUHJSNZXFSG-UHFFFAOYSA-N 392.437 5.473 30 20 GKED COc1ccccc1C(C)(C)/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329472401 OHHIEJUIENOVMP-SFHVURJKSA-N 395.547 5.394 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(CN2CCCCC2)c1 413751327 UOBYDRGFDHJEMF-UHFFFAOYSA-N 376.544 5.777 30 20 GKED C=CC[C@H](Cc1ccccc1)NC(=O)Nc1cccc(NC(=O)CCC)c1C 416772032 IRABFACTMYZVDR-LJQANCHMSA-N 379.504 5.043 30 20 GKED CC[C@H](Nc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437493056 JZUPBTILACRFBZ-FQEVSTJZSA-N 389.430 5.319 30 20 GKED CCSCC[C@@H](C)NC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 437979842 YYQHGXLFLUCCNV-QGZVFWFLSA-N 397.544 5.099 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@H](Cc4ccccc4)C3)c2)cc1 438037692 SRRSXIBQGLEMGH-OAQYLSRUSA-N 397.478 5.447 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)cc1Br)c1ccccc1 439484393 OLVRBQPKTSFXEA-OAHLLOKOSA-N 392.684 5.269 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N(Cc1ccco1)c1ccccc1C#N 443834444 IKNZJHCKHBZOFB-QGZVFWFLSA-N 376.431 5.092 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CCSc3c(F)cccc32)c2ccccc21 443924358 DYRYPGCUOFQTOZ-LJQANCHMSA-N 393.487 5.051 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(CC#N)cc2Cl)cc1 455755921 RWRZEUNMGUMYHD-NRFANRHFSA-N 397.906 5.564 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl)Cc1cccc(F)c1 468974264 LHWQYKPAWCNWKE-SJKOYZFVSA-N 379.262 5.082 30 20 GKED C=C[C@](C)(CC)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 470396496 FKUBKJSYTPTQKL-KSFYIVLOSA-N 384.545 5.127 30 20 GKED Cc1ccc([C@H]2C[C@H](C)N(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 470581355 FGXPSKBUUQHIBQ-FPOVZHCZSA-N 385.511 5.272 30 20 GKED N#Cc1ccc(C[C@@H](C#N)C(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)cc1 470733898 VCUSYJLWWCIKKU-NRFANRHFSA-N 391.430 5.292 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1c1ccccc1 480553644 LDPJCOUIGHKNNK-HXOBKFHXSA-N 383.451 5.575 30 20 GKED Cc1cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c(F)cc1F 482105785 QXRHLNUEDZYKBZ-UHFFFAOYSA-N 392.405 5.171 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc2cc(Cl)ccc2s1 484571336 MEUONHOMNQTYBT-AWEZNQCLSA-N 394.839 5.825 30 20 GKED Cn1c(-c2cccc(NC(=O)c3cccc(SCC#N)c3)c2)nc2ccccc21 485174431 QLCKTBAHBCIYNC-UHFFFAOYSA-N 398.491 5.108 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1)[C@@H](C)c1ccccc1C(F)(F)F 499238394 ZOIASJUHCVUDBX-KGLIPLIRSA-N 375.394 5.085 30 20 GKED N#C[C@@H](C(=O)c1csc(CCc2ccccc2)n1)c1nc2ccccc2s1 499581620 HYISUXGTVDQLPW-HNNXBMFYSA-N 389.505 5.028 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1sc(-c2ccccc2)cc1C#N 499785548 ZGQACAFVBBQFEL-UHFFFAOYSA-N 376.481 5.255 30 20 GKED C=CCOc1ccc(C(=O)Nc2c(F)cccc2Oc2ccccc2)cc1OC 500937085 LDDPNKPAOAKVEM-UHFFFAOYSA-N 393.414 5.444 30 20 GKED CC[C@H](C)n1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccccc1 504319771 AWQPCOGYKQNOAJ-FXAWDEMLSA-N 376.529 5.452 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)C2CCC(C)CC2)cc1 508237724 ACYBHOCJHCODJJ-UHFFFAOYSA-N 393.487 5.402 30 20 GKED CCCN(Cc1ccc(F)cc1)Cc1cn(CCC#N)nc1-c1ccccc1 508591137 ZNKNHNILDTXRTD-UHFFFAOYSA-N 376.479 5.015 30 20 GKED CC(C)(CCC#N)CNC(=O)N(Cc1cccc2ccccc12)C1CCCC1 513117995 HOQMYRQCSWHGGK-UHFFFAOYSA-N 377.532 5.624 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC(OC2CCCCC2)CC1 513416379 YVUWKKDTRSJILY-UHFFFAOYSA-N 388.511 5.179 30 20 GKED N#C[C@@H](NC(=O)c1cc(C2CC2)nc2ccccc12)c1ccc(Cl)c(Cl)c1 518321566 SWNJUQQEUVWTIM-HXUWFJFHSA-N 396.277 5.414 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)cc2)CC1 520567264 VRWKOETZHFPWPQ-UHFFFAOYSA-N 396.450 5.189 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1cccnc1 523716226 MDIAKRFKGWFYIR-QGZVFWFLSA-N 387.458 5.128 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1 524248918 JLHLIRLEQZFBJE-AWEZNQCLSA-N 390.405 5.182 30 20 GKED C[C@H]1[C@@H](C)O[C@H](C)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 525841981 ANGQERBQDSNAKS-UIVXKWKOSA-N 397.906 5.025 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2nc(-c3ccccc3)cs2)cc1 537508893 CWDJARDXUZXCID-UHFFFAOYSA-N 381.504 5.639 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)c1ccccc1Sc1ccccc1C#N 537996449 YFQGBPVPIKURSI-INIZCTEOSA-N 387.508 5.158 30 20 GKED COc1cc([C@@H](C)NCc2ccc(F)cc2C#N)ccc1OCc1ccccc1 538153789 ZEBZKVADUOGHKP-QGZVFWFLSA-N 390.458 5.136 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1 540374344 FSMGEJCQPWJDGS-OAHLLOKOSA-N 378.501 5.174 30 20 GKED C[C@@H](NCc1ccc(Oc2ccccc2C(F)(F)F)nc1)c1ccc(C#N)cc1 540593849 UEMNGPDPUVKZFK-OAHLLOKOSA-N 397.400 5.615 30 20 GKED N#C[C@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1ccc(Cl)c(Cl)c1 542150611 ZFIVEMCDHYACOZ-QHAMSDLMSA-N 393.236 5.433 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)N2CCC(CC#N)CC2)c1 545451408 HMNNMYIRMLWKAI-UHFFFAOYSA-N 384.932 5.566 30 20 GKED N#CCCN(C(=O)CCOc1ccccc1-c1ccccc1)c1ccc(F)cc1 553943335 HGEHWOBNABHROW-UHFFFAOYSA-N 388.442 5.208 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3cc(C#N)ccc3Cl)c2C(C)C)cc1 557012863 VASZEIOIZKVSNU-UHFFFAOYSA-N 378.863 5.082 30 20 GKED N#Cc1ccc(-c2nnc(CN3CC4(CCCCC4)[C@@H]3c3ccccc3)o2)cc1 560599166 YRWXMBRMMSAVGP-QFIPXVFZSA-N 384.483 5.116 30 20 GKED C[C@H]1CC(=O)CC[C@@H]1C(=O)Nc1ccc(Sc2ccc(Cl)cc2C#N)cc1 562954296 ZKZTZTHGHCTWNC-DJJJIMSYSA-N 398.915 5.307 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 563784647 JETQTWFEAIWQJF-UHFFFAOYSA-N 390.468 5.027 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC3(CCCC3)CC2)cc1 564312343 CMWOTXXXLJIQMX-UHFFFAOYSA-N 390.552 5.647 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccc(F)c2ccccc12 565414109 BEICIFHFBSJFRM-QGZVFWFLSA-N 387.458 5.309 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNC2CCC(C)(C#N)CC2)on1 582102745 PCCQFWSPCKXFGF-UHFFFAOYSA-N 375.472 5.065 30 20 GKED N#CCCCCCC(=O)Nc1nc(-c2cc(Br)cs2)cs1 588364267 VTETXNLQYWHWIW-UHFFFAOYSA-N 384.324 5.047 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(O[C@H]2CC2(F)F)cc1)c1ccccc1 597115723 CAYDRCWTQGFFIC-OALUTQOASA-N 385.414 5.030 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1 603900324 CALMSFOJPXOJMX-HRAATJIYSA-N 386.948 5.171 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(CSc4ccccc4)cc3)[nH]c12 605362982 BVYNQWSHKFHDOO-HXUWFJFHSA-N 397.503 5.654 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3csc(-c4ccc(Cl)cc4)n3)[nH]c12 605363159 LYOALENBZHOJRD-AWEZNQCLSA-N 392.871 5.138 30 20 GKED Cc1cc(C)c(C#N)c(SCc2nnc(-c3c(Cl)cccc3Cl)o2)n1 608800986 WWXBLPJMQIXSSZ-UHFFFAOYSA-N 391.283 5.219 30 20 GKED N#CCn1c(C(=O)N(Cc2ccco2)c2cccc(Cl)c2)cc2ccccc21 609215597 FQRGDALHWHMNSU-UHFFFAOYSA-N 389.842 5.258 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1C 609502303 WRJXJCDECUZSIJ-HSZRJFAPSA-N 397.478 5.340 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3Cc3ccccc3)cc2)cc1 609514132 BVNHQPSDQBIIBG-HSZRJFAPSA-N 396.490 5.392 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2)c1 610343548 LAGZWFNJLFSXTP-NTKDMRAZSA-N 383.495 5.206 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)C1CC1 610663640 ZHHFJYAGXJERBR-OAHLLOKOSA-N 388.427 5.096 30 20 GKED CC(C)c1ccc(C[C@@H](C)NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 611238397 VHBJDNPIFQGOSR-CYBMUJFWSA-N 375.299 5.349 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(Br)cc1)c1ccc(C#N)cc1 612574840 KEQBMYMLTWDSBQ-SJCJKPOMSA-N 397.238 5.665 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nc2cc(Cl)ccc2s1 613403429 PMAXBDJDEHRZSP-SNVBAGLBSA-N 381.671 5.747 30 20 GKED C=CCOc1c(Cl)cc(CNc2cccc(NC(=O)C(C)C)c2)cc1OC 623365931 JNUJONIMHRZBKZ-UHFFFAOYSA-N 388.895 5.120 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1C=NNc1ccc(OC(F)F)cc1 726430367 YOASKPFVBYNQON-UHFFFAOYSA-N 394.784 5.021 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3cccc(OCCCC#N)c3)oc12 726741922 JRXSFTBTPQPAJI-VAWYXSNFSA-N 375.424 5.410 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)C(C)C)c1 728247234 VTGSMJXYGYZNIJ-UHFFFAOYSA-N 396.490 5.284 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1[N+](=O)[O-] 730150903 YUVMLLQEDNMAIS-YCRREMRBSA-N 398.415 5.071 30 20 GKED O=C(O)c1ccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)s1 730588987 DUYVOHSAJDVYDT-FNORWQNLSA-N 381.434 5.212 30 20 GKED C[C@@H](Nc1ccc(Nc2ncc([N+](=O)[O-])cc2C#N)cc1Cl)c1ccccc1 731026514 FWYZHCMRVJHYDJ-CYBMUJFWSA-N 393.834 5.432 30 20 GKED N#C[C@@H](NC(=O)c1sc2ccccc2c1Cl)c1ccc(Cl)c(Cl)c1 731644491 RYJJSAZAASKDSJ-CYBMUJFWSA-N 395.698 5.856 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 733635711 DFRIDBNMLIBBRX-UHFFFAOYSA-N 398.466 5.274 30 20 GKED O=C1/C(=C\c2ccc(OCc3ccncc3)cc2)CCOc2c(Cl)cccc21 733749215 SOJIYQBRAYNYLL-JXAWBTAJSA-N 391.854 5.363 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(-c2ccccc2Cl)o1 735233262 OLOKFIWCVQQBBE-UHFFFAOYSA-N 392.267 5.238 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735570140 QHDZPDHBSDCGTD-UHFFFAOYSA-N 394.906 5.032 30 20 GKED COc1cc(/C=C2\C(=O)c3cccc(Br)c3[C@H]2C)cc(Cl)c1O 742434946 OGXBYDFGWSJVRA-TXEUWIOXSA-N 393.664 5.200 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)[C@H]2SCCc3sccc32)cc1 745639219 XOWZWWDRIGKUTA-NRFANRHFSA-N 391.517 5.361 30 20 GKED CC(=NN(Cc1ccccc1)c1ccccc1)c1cnn(-c2ccccn2)c1C 748245848 FDOHUTAFWJBDDD-UHFFFAOYSA-N 381.483 5.007 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)c1 753876660 OMGSXIUJZJITJV-DZFTYQQFSA-N 375.472 5.079 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\SCc3ccco3)cc2)cc1 754223843 LKTLHBVPBLQOPM-QBFSEMIESA-N 376.437 5.329 30 20 GKED CCC(=O)c1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)ccc1F 756974392 QUXYWGYBLPVKMD-UHFFFAOYSA-N 388.398 5.335 30 20 GKED C[C@@H](NC(=S)Nc1ccc(F)cc1OCC#N)c1ccc(Cl)cc1Cl 760282577 PHOLOUFGRJQXRZ-SNVBAGLBSA-N 398.290 5.082 30 20 GKED CC(C)(C)[C@H](C#N)OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 765627842 KGFZGHXTOVPTBX-AWEZNQCLSA-N 383.300 5.141 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(Cl)c1 766385314 VLESBRJWOOVTHD-CQSZACIVSA-N 376.909 5.264 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cnc(C4CCCC4)s3)c2)s1 767919808 CQKQWYNJLKWYMQ-UHFFFAOYSA-N 379.554 5.691 30 20 GKED Cc1cc(Cl)ccc1CS(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 768764951 RJJLNCZQYSKCMP-UHFFFAOYSA-N 395.911 5.302 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1c(C(F)(F)F)nn(C)c1Cl 771762237 XMDRIOXJVHHMSF-JTQLQIEISA-N 388.846 5.099 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](Cc2ccccc2)c2sccc2C)c1 772982677 FCDIYUYAFIACPR-JTHBVZDNSA-N 390.552 5.811 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C\c1scnc1C 776772929 SZNSKHWDHBRFJJ-KTKRTIGZSA-N 391.471 5.017 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 780672910 AAKMTKMOSKGFNQ-CHWSQXEVSA-N 392.286 5.509 30 20 GKED CC(C)COc1ccc(C2(C(=O)[C@@H](C#N)c3nccc4ccccc34)CCC2)cc1 792104477 XPYXZDLZXGRHLV-QHCPKHFHSA-N 398.506 5.568 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1 793390286 NQFQIRQWARKFHB-YLJYHZDGSA-N 386.417 5.456 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(OC(F)(F)F)cc2)c1 796817035 OHGIQWZSEILLIX-YLJYHZDGSA-N 392.421 5.507 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 797944614 JSBGTCMYLAKVJG-GHMZBOCLSA-N 382.382 5.090 30 20 GKED N#C[C@@H](C(=O)[C@@H](Oc1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813213388 ITARJBVCRRWXGR-NQIIRXRSSA-N 396.368 5.097 30 20 GKED N#C[C@@H](C(=O)CC1CCC(c2ccccc2)CC1)c1cc(C(F)(F)F)ccn1 813214100 PDIRTPXQVPMALI-GXOAENINSA-N 386.417 5.641 30 20 GKED N#C[C@@H](C(=O)CCCSc1ccc(Cl)cc1)c1cc(C(F)(F)F)ccn1 813218135 SLCKSEKOAWHUGL-OAHLLOKOSA-N 398.837 5.503 30 20 GKED CCC(CC)(COCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 842694735 ZDWFTMHJJGQFAD-GOSISDBHSA-N 376.456 5.027 30 20 GKED Cc1nc(SCC(C)C)sc1CC(=O)[C@@H](C#N)c1ccc2ccccc2n1 850741833 QJWVBUXKNCHJMR-INIZCTEOSA-N 395.553 5.167 30 20 GKED C=CCC[C@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 901689672 HFYSWTLLAGLZAL-SFHVURJKSA-N 377.843 5.089 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCc1ccc(F)c(F)c1 915975682 VTJYWMQUZZKVAX-UHFFFAOYSA-N 388.849 5.051 30 20 GKED CCCCCCNC(=O)[C@@H](C#N)C(=O)c1sc2cccc(Cl)c2c1Cl 916874377 CHSQFLIRHQLDKX-NSHDSACASA-N 397.327 5.227 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(Sc3ccccc3)cc2C)cc1 919895778 NJSCSBAUEIIGCG-UHFFFAOYSA-N 376.481 5.379 30 20 GKED Cc1cc(NN=Cc2ccc(-c3cccc(CC(=O)O)c3)cc2)ccc1Cl 1776105154 QFQFCXKQIMSDJQ-UHFFFAOYSA-N 378.859 5.389 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(F)cc(C(F)(F)F)c1 1776354428 HEWMPAIXPZXYQL-HYXAFXHYSA-N 396.336 5.226 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(F)c1C(F)(F)F 1776355352 BCBPUNMIAVQRNN-VURMDHGXSA-N 396.336 5.226 30 20 GKED CCc1cccc2c(/C=C/C(=O)c3cc(C(=O)O)ccc3OC(C)C)c[nH]c12 1776977346 CYFPWCNMPSROBP-CSKARUKUSA-N 377.440 5.112 30 20 GKED COc1cc(Cl)cc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1777315327 JYRGXHTYURQFJX-UQCOIBPSSA-N 382.799 5.203 30 20 GKED O=C(/C=C/c1cc2ccncc2s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569397 OEWFDHRJCJTYQT-AATRIKPKSA-N 375.405 5.151 30 20 GKED C=CCn1c(SCc2csc(-c3ccsc3)n2)nc2ccccc2c1=O 7645249 WWXCYDJDBGYZOL-UHFFFAOYSA-N 397.550 5.060 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1ccc(F)cc1Cl 7664157 GQAUVQDUWGNQTM-LLVKDONJSA-N 387.307 5.209 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2ccc(Cl)c(Cl)c2)c1C#N 27028575 YPSJIHYBVLTDLC-UHFFFAOYSA-N 378.284 5.112 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC(C)C)c(Cl)c1 63390859 CSFRIEKRTVSSJS-UHFFFAOYSA-N 383.879 5.219 30 20 GKED COc1ccc(C#N)cc1NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 64720007 FAXXDPJARBCPOZ-IBGZPJMESA-N 397.887 5.193 30 20 GKED Cc1ccc(NC(=O)CSc2ccc(C#N)cc2)c(-c2nc3ccccc3[nH]2)c1 110243479 ZVFGFWLLCDQXSO-UHFFFAOYSA-N 398.491 5.141 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cn1 122157192 OFIAYFKJAOBIIB-ZDUSSCGKSA-N 383.423 5.097 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 176543232 DFTLOZVBECENIJ-GOSISDBHSA-N 395.443 5.341 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc(F)c(F)c3F)c2)cc1 177167864 OINXWIXDSYDPHF-UHFFFAOYSA-N 396.368 5.001 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2nc(C3CC3)sc2c1 183875195 BHUUZMJFVQDWFA-LBPRGKRZSA-N 378.457 5.109 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccn(-c2ccc(F)cc2F)n1 192199988 HGENBKJWZUBDGE-AWEZNQCLSA-N 384.455 5.014 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)sc2c1CCCC2 253614372 ONIURCYEEAXGTE-LSDHHAIUSA-N 390.430 5.260 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccc(C#N)cc1 301218151 LOUVABJUPSKURP-UHFFFAOYSA-N 377.447 5.263 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N2CCCCC[C@@H]2c2ccco2)cc1OC 303854825 NZXBNPVMJVNNIN-XSSIKURBSA-N 381.472 5.010 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2ccccc2c(Cl)n1 324797113 OWVIQZYFOPJXCZ-UHFFFAOYSA-N 377.296 5.432 30 20 GKED C[C@@]12CC3CC(/C(O)=N/[C@@H]4CCN(C(O)=Nc5ccccc5)C4)(C1)C[C@](C)(C3)C2 328668862 DVWSLWLCUQMAJC-HDJREOJZSA-N 395.547 5.260 30 20 GKED Cc1noc(CSc2ccccc2/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)n1 329011646 IIBRGEOMBMPHBX-GVDBMIGSSA-N 385.533 5.334 30 20 GKED CC(=O)Nc1ccc(N=C(O)N(C)[C@@H](C)C2CCCCC2)c(C(F)(F)F)c1 330450977 YCZWLCYPQSABGP-LBPRGKRZSA-N 385.430 5.110 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 410314144 DWWQOTGBMYBLSQ-GFCCVEGCSA-N 377.271 5.201 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c2[C@@H](C)C1 410994426 BABHRARUWUBALE-YUMQZZPRSA-N 385.436 5.033 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c2[C@H](C)C1 411008560 IKSZBABNLGMIRL-NWDGAFQWSA-N 394.525 5.076 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)c1ccccc1C(F)(F)F 425420374 SAGVBBRNLFOTHK-KBPBESRZSA-N 375.394 5.041 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 428862092 MPZYMQLAOOUTCY-SFTDATJTSA-N 389.499 5.219 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1CN1CCSCC1)c1ccccc1 435602746 WUDCEJSQLKXGCJ-NRFANRHFSA-N 395.572 5.064 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 441995376 BAJQVLVWHJKZIR-UHFFFAOYSA-N 386.238 5.121 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 446852183 MVXKTMMWKOVZTD-JTSKRJEESA-N 379.529 5.134 30 20 GKED CCN(C(=O)NCc1ccc(C#N)c(F)c1)[C@H](C)c1cccc(C(F)(F)F)c1 455537243 IZQVKISPBAWMRU-CYBMUJFWSA-N 393.384 5.009 30 20 GKED C[C@@H](C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1)c1cccc(C#N)c1 461796107 NJZQWBGEHBFRIO-MRXNPFEDSA-N 397.503 5.501 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1F 461920169 HSFPEHWSBIPBBQ-HNNXBMFYSA-N 390.414 5.240 30 20 GKED C[C@H](C(=O)N[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462553026 PPEZWEQZKHCBFM-GKCIPKSASA-N 386.417 5.133 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1cccc(C(F)(F)F)c1 463711768 LVJBFNNWZYEAPD-CQSZACIVSA-N 392.446 5.528 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 464163199 HUALIKDTKBXLKC-NRFANRHFSA-N 381.863 5.062 30 20 GKED Cc1cc(C)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(OC2CCC2)n1 470887592 FPXGLMYUBVQYED-CQSZACIVSA-N 395.528 5.134 30 20 GKED N#C[C@]1(NC(=O)c2cc(-c3ccccc3)ccc2Cl)CCc2ccccc2C1 472262567 XTBJINRTZPNNBX-DEOSSOPVSA-N 386.882 5.188 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)nc(C)n1 473941771 PDGQWEUWEQOBOV-KRWDZBQOSA-N 395.821 5.168 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C[C@H](CC#N)c1ccccc1 474897630 CWMHWPQZGLJMMW-FQEVSTJZSA-N 397.478 5.273 30 20 GKED Cc1cccc(Oc2cc(CNC(=O)C[C@H](CC#N)c3ccccc3)ccn2)c1C 476194154 KBHFDWCHYJCEIN-QFIPXVFZSA-N 399.494 5.195 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCC2)c(F)c1 483502667 NUFYLUCZYAOVIJ-UHFFFAOYSA-N 381.451 5.073 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(F)c4ccccc4c3)n2)cc1 497367985 WNVACTQTPKRPDT-LJQANCHMSA-N 397.434 5.464 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1Br 499181454 WMCYWQLTVSORDM-VIFPVBQESA-N 397.363 5.317 30 20 GKED C=C[C@H](CC(=O)Nc1nc(-c2c[nH]c3ncccc23)c(C)s1)c1ccccc1 503906263 ALHYENAUCHGHLL-OAHLLOKOSA-N 388.496 5.293 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nc2ccccc2c1=O 505849869 COASWQDAKLRZAZ-UHFFFAOYSA-N 393.899 5.076 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@H](CC(F)(F)F)c1ccccc1 506343844 YUAQRRRJYYVQHL-QGZVFWFLSA-N 391.393 5.161 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CC=C(c2ccccc2Cl)CC1 507578794 HXLPZJNZDGKDQO-UHFFFAOYSA-N 382.895 5.089 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 509639948 NOSSTSZKHZCHNT-KRWDZBQOSA-N 388.492 5.257 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1ccc(OCc2ccccc2C#N)cc1)C1CC1 509826236 HJCFHLBMTCUZHQ-QGZVFWFLSA-N 386.451 5.096 30 20 GKED FC(F)Oc1ccc([C@@H](NCc2cccc(OC(F)F)c2)C(F)(F)F)cc1 510459302 IYYQFKFXBPWPCT-CQSZACIVSA-N 397.290 5.283 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 510586049 YTZVXWLQNZYFDY-UHFFFAOYSA-N 376.287 5.458 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2ccc(CSc3ccccc3)cc2)nc2ccccc21 513672403 RGKYEPMCYJXVQA-FQEVSTJZSA-N 397.503 5.356 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cnc(-c4ccccc4)s3)n2)cc1 514424048 IAKJVXMNMGYWSB-UHFFFAOYSA-N 388.477 5.058 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)Nc2cccc(OCCCC#N)c2)c(C)c1 516007660 GEUKRKZLJKGHDS-UHFFFAOYSA-N 392.499 5.286 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518376401 WJWOFVPUXURAQX-UHFFFAOYSA-N 397.434 5.068 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccccc2F)n1 519516221 CYHFSVJPAIBNAT-CYBMUJFWSA-N 397.500 5.596 30 20 GKED C[C@H](NC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)c1ccc(C#N)cc1 520100603 AIOAAKHTNRPLQQ-AOMKIAJQSA-N 390.870 5.209 30 20 GKED N#CCCN(C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1ccc(F)cc1 520683406 HTYHVTQYYQQPFX-UHFFFAOYSA-N 395.821 5.227 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 533362662 ZCMIIVAOSPRDBC-MRXNPFEDSA-N 385.508 5.073 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2SC(C)C)cc1C#N 537122139 CZUVKRGMKXCNRT-UHFFFAOYSA-N 399.472 5.006 30 20 GKED CCc1ccc(C(C)(C)NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 538256916 FJNYNCUDDSKICQ-KRWDZBQOSA-N 395.572 5.107 30 20 GKED C=CCCOCCCCC(=O)N1CC[C@@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 538282719 LRVOFRJQFUUGNI-OXQOHEQNSA-N 383.454 5.378 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 546004229 PWVSNFMMPLEPFQ-UHFFFAOYSA-N 377.252 5.341 30 20 GKED C=CCC[C@@H](NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccco1 552250031 SSFPKKFJQICRCP-OAQYLSRUSA-N 378.447 5.468 30 20 GKED CCC[C@@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccn1 555549702 MXWNMWIMHIUSSH-JOCHJYFZSA-N 385.467 5.055 30 20 GKED C[C@](C#N)(NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)C1CCCCC1 555904258 LUJRZBUUTFSIDB-OAQYLSRUSA-N 383.879 5.120 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1ccc(CC#N)cc1 562183570 ASZVFKNHZVWUDR-KRWDZBQOSA-N 375.497 5.609 30 20 GKED C=CCC(C)(C)CN[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 562837270 DTBRKSXTUKVKSY-FQEVSTJZSA-N 391.964 5.025 30 20 GKED COc1cc(C#N)ccc1OCCSCc1c(C)cc(C)c(C(C)=O)c1C 568453469 UFGBXOTVUOPFIT-UHFFFAOYSA-N 383.513 5.007 30 20 GKED Cc1ccc(NC(=O)N2CCC(CCC#N)CC2)c(OCc2ccccc2)c1 576872211 MNVPOLKZUVYGHP-UHFFFAOYSA-N 377.488 5.122 30 20 GKED N#CC[C@@H](Cc1nc(CCc2c(Cl)cccc2Cl)no1)c1ccccc1 577102593 OQYANODKRXNXCA-HNNXBMFYSA-N 386.282 5.402 30 20 GKED CCCC[C@@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 584202042 YTCRNZZVBDQNRP-GOSISDBHSA-N 379.504 5.488 30 20 GKED CC(C)(C#N)Cc1nc(C2(c3cccc(C(F)(F)F)c3)CCCCC2)no1 589149745 MQNUKIJDOCSQRT-UHFFFAOYSA-N 377.410 5.431 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OC(C)C)c(OC)c2)cc1Cl 589639966 PWAGYZZXUCIJIT-INIZCTEOSA-N 389.923 5.551 30 20 GKED COc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1C(F)(F)F 597179145 GPRBIYOOIQILQI-GFCCVEGCSA-N 394.418 5.218 30 20 GKED CN(C(=O)c1ccc(SCc2ccccc2)cc1)c1ccc(C#N)cc1F 609217183 YNLSNLWBVJOKIG-UHFFFAOYSA-N 376.456 5.266 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(NC(=O)N2CCCCCC2)cc1 611476046 HMBDFUYDIOGRMJ-QHCPKHFHSA-N 388.515 5.456 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OC(C)C)cc3)n2)cc1 612894632 CSLKYXXLJOAJBC-IBGZPJMESA-N 376.481 5.396 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)oc2c1ccc1ccccc12 613290786 LANHBPGYUDCETO-HXUWFJFHSA-N 376.415 5.933 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)C1 661379032 RAQMVQSQEWUCQI-MRXNPFEDSA-N 389.952 5.269 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1c(C)cccc1C 669321956 ZNLXBILETRAGJP-PMACEKPBSA-N 380.536 5.054 30 20 GKED N#C[C@H](C(=O)c1sc(-c2ccccc2)nc1C(F)F)c1nc2ccccc2[nH]1 677793362 TVDUMNJIFQBORB-GFCCVEGCSA-N 394.406 5.114 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 679239001 SZUOVDGJRDQRDD-FQEVSTJZSA-N 389.414 5.389 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cccc(Oc3nccs3)c2)s1 684676037 SOBGLACMZILNDB-CQSZACIVSA-N 383.498 5.179 30 20 GKED CCOc1ccccc1CCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727934397 GNUGDFFLAYSLAS-QHCPKHFHSA-N 399.494 5.105 30 20 GKED CN(Cc1ccccc1)c1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1 729327533 GDNDPDCNAXFYIS-UHFFFAOYSA-N 394.478 5.054 30 20 GKED N#CCn1c(C(=O)OCc2ccc(-c3ccccc3C#N)cc2)cc2ccccc21 729768101 BSSMBRONWLWATL-UHFFFAOYSA-N 391.430 5.061 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccc(F)cc3)cc2F)cc1 729968137 KUPVDAGZQCBBLS-UHFFFAOYSA-N 376.406 5.501 30 20 GKED Cc1nc(-c2ccccc2Br)sc1C(=O)/C=C/c1cccnc1 730148659 JDPRPFPOBODPOC-CMDGGOBGSA-N 385.286 5.172 30 20 GKED C[C@H](NN=Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl)c1ccccc1 731150683 DFFUYNNCKIBRAF-INIZCTEOSA-N 380.923 5.643 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCCCCc1cccs1 731546455 OXZTULJZNGTPHC-SFHVURJKSA-N 378.497 5.233 30 20 GKED COc1ccc(/C=C\C(=O)c2cnn(-c3ccc(C#N)cc3)c2C)c2ccccc12 741845407 VOQXGFBNAUALPX-LCYFTJDESA-N 393.446 5.110 30 20 GKED N#C[C@H](C(=O)Nc1ccc(F)c(Cl)c1)C(=O)C1CCC(c2ccccc2)CC1 744032939 PEZIXXQNFHZCGN-HTWSVDAQSA-N 398.865 5.100 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 744073809 GDASXGZJPYJZOA-BXUZGUMPSA-N 386.398 5.207 30 20 GKED Cc1cccc(-c2nn(CN(CC#N)C3CC3)c(=S)n2[C@H]2CCCC[C@H]2C)c1 747789458 YHFBEJWGZGDWOC-XLIONFOSSA-N 395.576 5.086 30 20 GKED CCC(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)ccc1F 756949894 OXYUZXBUAWOAPG-UHFFFAOYSA-N 388.398 5.335 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(C#N)c(Cl)c1 779051659 XKNYTCGMUNHUTH-INIZCTEOSA-N 390.870 5.321 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCc1ccccc1Oc1ccccc1 780670272 IWHCXBQVBKUUSV-QGZVFWFLSA-N 387.439 5.091 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc(-c2ccccc2)o1 784828728 JDYPVNDSDKEERX-INIZCTEOSA-N 399.233 5.215 30 20 GKED CCCCCCCCC(=O)N1CCC(c2noc(-c3ccccc3OC)n2)CC1 791051108 PBUPNZRSFAPBIY-UHFFFAOYSA-N 399.535 5.202 30 20 GKED CCc1c(C(=O)/C=C/c2cnc(-c3ccccc3OC)nc2)oc2ccccc12 792870550 ROAMLRBJBGQRSG-OUKQBFOZSA-N 384.435 5.357 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)c1cn(CCCC#N)c2ccccc12 801548499 HZVCDCDJZUHETI-UHFFFAOYSA-N 389.499 5.093 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)OCc2ccccc2C(C)(C)C#N)cc1 801904937 AHEFCVDYLBZRIO-QGZVFWFLSA-N 377.484 5.173 30 20 GKED O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 801985476 WGMWNUMQSBQLCN-ZIAGYGMSSA-N 397.334 5.297 30 20 GKED N#C[C@H](C(=O)[C@@H](Oc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 802040979 VLQKTACKYWFMTQ-RXVVDRJESA-N 397.261 5.385 30 20 GKED C=CCC(C)(C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 814218873 IEAVMQXFACZTBW-OAQYLSRUSA-N 389.543 5.084 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2Cl)CCC1)c1cc(C(F)(F)F)ccn1 845574822 OPGGRJWHJAEIEK-CYBMUJFWSA-N 378.781 5.052 30 20 GKED CC(C)c1nn(C)c(Cl)c1C=NNc1c(Cl)cccc1Br 848415896 ZOOMCLRZCIKTAC-UHFFFAOYSA-N 390.112 5.059 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@@H]2C[C@@H]2C1)c1nc(-c2ccc(Cl)cc2Cl)cs1 850764115 KPGOTTRFYOONDD-OXIWPEFWSA-N 377.296 5.339 30 20 GKED CC(=NOCC(=O)Nc1ccc(SC(F)F)cc1)c1cc2ccccc2o1 852747684 SWCCRHJLMIAEBL-UHFFFAOYSA-N 390.411 5.127 30 20 GKED C=CC(C)(C)CC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 887864490 UWZCYNMWYDVEEK-UHFFFAOYSA-N 380.366 5.092 30 20 GKED C[C@@H](NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1ccc(C#N)cc1 914485875 YDOMLEWYEQKYEA-CTFRJJSNSA-N 376.456 5.177 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2Cc2ccccc2)cc1 915352381 HCKQWCDJRCFZAU-LOSJGSFVSA-N 395.506 5.581 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccc(C)cc3)n2)cc1 920140946 DEGBQLHJSHEFEV-FQEVSTJZSA-N 390.508 5.326 30 20 GKED N#C[C@H](C(=O)/C=C\Sc1ccccc1)c1nc(-c2c(F)cccc2F)cs1 920803817 DOSSGFHQXRWEAB-CFYYFVFUSA-N 398.459 5.571 30 20 GKED CCn1c2ccccc2c2cc(C=NNc3ccc(F)c(C(=O)O)c3)ccc21 1776061976 XYOFXQZFPOBFKH-UHFFFAOYSA-N 375.403 5.098 30 20 GKED Cc1cc(COc2ccc(C=NNc3cccc(C)c3Cl)cc2)oc1C(=O)O 1776106801 WEMFOVGPNZCTRA-UHFFFAOYSA-N 398.846 5.273 30 20 GKED CCOc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776128378 YPHSTYDZFONLJQ-NVNXTCNLSA-N 386.447 5.276 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)cc1Cl 1776388578 INWKSCHKGMWWDK-FNORWQNLSA-N 379.239 5.375 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](CC(=O)O)C2CCCCC2)c1 1776788636 CPZRXTASQQSRMC-QFIPXVFZSA-N 389.580 5.797 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)c3ccc(C(C)C)cc3)cc2)CCC1 1790314160 SXQQNFLUJMXPJA-UHFFFAOYSA-N 376.500 5.134 30 20 GKED N#Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)sc2c1CCCCCC2 6330156 BKWLVEOBMSMLDL-UHFFFAOYSA-N 389.864 5.093 30 20 GKED C[C@@H](Sc1ccc2ccccc2c1)C(=O)N(CCC#N)c1ccc(F)cc1 22249802 XFBKPWNTJZHZRH-MRXNPFEDSA-N 378.472 5.406 30 20 GKED N#C[C@@H](C(=O)c1csc(Br)c1)c1nc(-c2ccccc2)cs1 41522177 LNYHJWANMFUACK-LBPRGKRZSA-N 389.299 5.124 30 20 GKED CCCOc1cccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 44518964 LCHNMPRGGIHVDS-UHFFFAOYSA-N 387.439 5.095 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NC3CCCCCC3)c2)cc1 71922747 BIYRQYSLAISDRI-UHFFFAOYSA-N 377.488 5.176 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1ccc(Cl)cc1Cl 108352593 PEZUZFHEBMMVKW-UHFFFAOYSA-N 380.300 5.050 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2nccc3ccccc23)cc1 110366137 VRAYGISGRYRQNI-UHFFFAOYSA-N 395.437 5.088 30 20 GKED N#Cc1c(Cl)nsc1NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 111220406 ZKJAMQJZIAWFBP-MRXNPFEDSA-N 378.888 5.393 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Br)c2)cc1)c1ccccn1 112483817 AEPDBXXWTWGKHR-SFHVURJKSA-N 393.240 5.126 30 20 GKED C[C@H](Nc1ncccc1C#N)c1nc(-c2ccc(Br)cc2)cs1 155354967 WZVARXJPIKDXCY-NSHDSACASA-N 385.290 5.012 30 20 GKED COc1ccc(/C=C2/C(=O)c3ccsc3S[C@H]2C)cc1OCCCC#N 172819428 KYCVXVFJAGIKEQ-XDUBLRSXSA-N 385.510 5.200 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3sccc3C2)cc1F 174493719 AFCIIUCNZWMSFY-UHFFFAOYSA-N 393.443 5.141 30 20 GKED Cc1nc(CN(C(=O)c2cccc(SCC#N)c2)c2ccc(F)cc2)cs1 175622150 GTCFWYXTSJKIFM-UHFFFAOYSA-N 397.500 5.053 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CS[C@@H](C)c1nc2ccccc2[nH]1 189903035 NJEORXBHZYQKIE-INIZCTEOSA-N 393.556 5.848 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccccc1OC 191418572 DYIDFIGMPONFCE-OAQYLSRUSA-N 378.516 5.916 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1ccccc1F 192622495 SKQLTEOFFLUZRQ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED N#Cc1ccc(CNC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)o1 237645126 GCCJRKNFSDHZIK-LJQANCHMSA-N 375.859 5.208 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cc2ccccc2n1Cc1ccccc1F 303265821 QFQWGZJDFGUYFP-UHFFFAOYSA-N 391.490 5.231 30 20 GKED N#C[C@H](NC(=O)c1sc2ccccc2c1Cl)c1cccc(Cl)c1Cl 303416893 WVSSHQDNBLLTFT-LBPRGKRZSA-N 395.698 5.856 30 20 GKED CCOc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(C(F)(F)F)c1 425648104 UKVPCPFXWFLFMP-ZDUSSCGKSA-N 391.393 5.201 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1c1cccnc1 433133311 NVZXMFGJDJZJHV-JOCHJYFZSA-N 398.466 5.361 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F 436336866 NVVJZSZENRYCPV-PBFPGSCMSA-N 387.455 5.037 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(F)(F)F)c1 438561799 MKWQPRHPDMSNFA-MOPGFXCFSA-N 387.405 5.095 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)c1C1CC1 455761978 ASTKYAKEDBTGEN-CQSZACIVSA-N 395.507 5.424 30 20 GKED O=C(c1cccc(C(F)(F)F)c1)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F 456575609 MRRJZZFPSHXSPV-MNOVXSKESA-N 393.249 5.051 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2ccccc2)c(C)c1 460249406 DZDBBPVAJWOMPH-UHFFFAOYSA-N 399.494 5.214 30 20 GKED CC(C)(C#N)CCSc1nc2scc(C3CC3)c2c(=O)n1-c1ccccc1 463041584 GUFKKKDBHLMZON-UHFFFAOYSA-N 395.553 5.357 30 20 GKED Cc1cc(Br)c(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1Cl 464353860 RJNHCDLCUCOZTC-LLVKDONJSA-N 377.669 5.025 30 20 GKED CC(C)CO[C@H](C)c1noc(CSc2nc(-c3ccccc3)ccc2C#N)n1 466662658 ZJUUTMPDNYDSBO-OAHLLOKOSA-N 394.500 5.029 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 467750401 YMCBHTZUQQFLPX-KWQFWETISA-N 386.336 5.645 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 468748674 URBGEDHDBUZBOA-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(Oc3ccncc3)c2)c2ccccc21 469406558 UNPGLYMLLJBHGB-UHFFFAOYSA-N 396.450 5.385 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 472010409 DVLUIXICFWCIEL-HXUWFJFHSA-N 385.511 5.598 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1 472052775 MZPASHOVMRJKSY-HXUWFJFHSA-N 377.532 5.136 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(F)cccc2Cl)cc1F 473618043 FMBUUFQYCUAJEP-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc2c(cc1OC)C[C@@H](C)O2 475564355 AKRMHTHNWFHURA-MRXNPFEDSA-N 394.515 5.192 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCN(Cc2ccccc2)C1 476162929 RLAZJBKZBMAKDE-QFIPXVFZSA-N 376.544 5.389 30 20 GKED Cc1coc(-c2cc(NC(=O)c3sc4ccc(C#N)cc4c3C)ccc2C)n1 477777568 QVUMFYSJBZOWKI-UHFFFAOYSA-N 387.464 5.606 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(CC(C)C)c1C(C)C 480933395 JDVLMLBSVARECM-UHFFFAOYSA-N 394.972 5.598 30 20 GKED Cc1ccc(-c2ccc(C(=O)N(CCC#N)CC(F)(F)F)c(F)c2)cc1C 482650711 KAIYUZXJRDXUKG-UHFFFAOYSA-N 378.369 5.028 30 20 GKED N#CC[C@@H](CC(=O)N1CCSc2ccc(C(F)(F)F)cc21)c1ccccc1 483835727 CYWQGNMXEWHDJQ-HNNXBMFYSA-N 390.430 5.232 30 20 GKED C=CCC[C@@H](NCc1nc2ccc(Br)cc2n1C)c1ccccc1 485817843 GYEJRONZZCTFOE-QGZVFWFLSA-N 384.321 5.133 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C)c1ccccc1 488653535 ISBUJUFYQDYSEE-JOCHJYFZSA-N 399.494 5.937 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(-c3noc(C(F)F)n3)cc2)CCCC1(C)C 490419486 TWEYHTYTACTQGN-HNNXBMFYSA-N 390.434 5.273 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc3ccccc3n2CC(F)(F)F)cc1 494172952 ODCRYCPDIRKZCO-UHFFFAOYSA-N 385.389 5.257 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 496354474 DPQAUUOYFHQVSQ-AWEZNQCLSA-N 382.414 5.002 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(C)(C)C)cc2)nnc1-c1cccnc1 499336796 AHSSGVUQORUJDF-INIZCTEOSA-N 378.545 5.677 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)F)cc1 505834606 UQZCMJILGSCSKT-QYZOEREBSA-N 398.453 5.070 30 20 GKED COc1cccc(COc2cccc(NC(=O)c3cccc(C#N)c3C)c2C)c1 509301804 COCGFAOMBITNEM-UHFFFAOYSA-N 386.451 5.015 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1ccc(F)c(F)c1 510204731 AIJLEKRBTIHAJU-CYBMUJFWSA-N 395.434 5.018 30 20 GKED CCCN(CC#N)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 510774999 ALARCZBJVHMCEK-UHFFFAOYSA-N 393.339 5.661 30 20 GKED CC(C)(C)CCOc1cnccc1CNC(=O)Nc1ccc(C(C)(C)C#N)cc1 513623650 GIJPRRDOYQXWOA-UHFFFAOYSA-N 394.519 5.019 30 20 GKED N#CCc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1 515703836 BZXQODWWCRKQGK-GOTSBHOMSA-N 382.463 5.074 30 20 GKED CCCCS[C@H](C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 515905052 NLQTWTNEMWDBLU-QGZVFWFLSA-N 382.529 5.192 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 518653538 JYTRIUUMVWTICN-OAHLLOKOSA-N 392.842 5.410 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCCOc1ccccc1-c1ccccc1 519973685 UYDHZOZMAWYEQU-UHFFFAOYSA-N 392.524 5.192 30 20 GKED CCN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 522574801 GZFLRNDGNHMCJJ-UHFFFAOYSA-N 382.769 5.028 30 20 GKED COc1ccc(CNCc2cc(Cl)sc2Cl)cc1OCCCC#N 537779190 RPLSYJAXLPHZCL-UHFFFAOYSA-N 385.316 5.036 30 20 GKED CCN(C(=O)c1ccc(OC)c(OC2CCCC2)c1)c1ccc(C#N)c(Cl)c1 543159388 BEPGRIJMBOBLFN-UHFFFAOYSA-N 398.890 5.208 30 20 GKED C[C@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 543944109 GOWMKJPSLYHSFA-ROUUACIJSA-N 394.478 5.218 30 20 GKED C[C@H](NC(=O)[C@H]1CCC(=O)[C@H](C)C1(C)C)c1ccc(-c2cccc(C#N)c2)cc1 548374516 JMCKOLDYAGOKIZ-PNLZDCPESA-N 388.511 5.044 30 20 GKED CCn1c2ccccc2c2cc(CN3CCC(C#N)(c4ccccn4)CC3)ccc21 548792544 DKSQTVWYIRHYOY-UHFFFAOYSA-N 394.522 5.267 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC(CCC#N)CC3)cc2)cc1 563086057 SVEXVYPXFDDEAL-UHFFFAOYSA-N 393.487 5.425 30 20 GKED N#Cc1cnc2c(Br)cccc2c1NCc1ccc2ccccc2n1 563658816 WKVXRVUUXRXTAC-UHFFFAOYSA-N 389.256 5.029 30 20 GKED C=CCC[C@H](N[C@H]1CCO[C@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 572020915 MJUKHYLAWMJZMS-JYJNAYRXSA-N 381.360 5.412 30 20 GKED C=CCC[C@H](N[C@@H]1CCO[C@@H](C(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 572020916 MJUKHYLAWMJZMS-OWCLPIDISA-N 381.360 5.412 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 577895390 HHZNCMPOYFHWKB-ZUOKHONESA-N 398.293 5.101 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(C(C)C)nn1-c1ccccc1 578179008 AXQRWEQQFQAJEB-UHFFFAOYSA-N 399.498 5.087 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc2cc(Br)cnc12)c1ccccc1 586874730 LMCGRQGMWHDCIA-HNNXBMFYSA-N 394.272 5.023 30 20 GKED N#Cc1ccc(F)c(CSc2nnc(-c3ccc(F)cc3)c3ccccc23)c1 588925496 QVURFUDUIKECQD-UHFFFAOYSA-N 389.430 5.739 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1SCC(F)(F)F 591860609 AQQDPDYIJUAMNB-CYBMUJFWSA-N 393.434 5.438 30 20 GKED C=CCN(C(=O)c1ccc(OC)cc1Cl)c1nc(-c2ccccc2)cs1 594432260 PYFJBSOQKNDRSL-UHFFFAOYSA-N 384.888 5.305 30 20 GKED Cc1cc(C)cc(Oc2cccc(Cl)c2NC(=O)CC2(C#N)CCOCC2)c1 598845424 PTMFSKUOGADKJV-UHFFFAOYSA-N 398.890 5.398 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cnc(-c4ccccc4Cl)s3)[nH]c12 605362961 BAOPBHVNCIQETR-CYBMUJFWSA-N 392.871 5.138 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@H]3CCCOc4ccccc43)cc2)cc1 609502813 DSQOCNWBCZXKCS-QHCPKHFHSA-N 398.462 5.189 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)ccc2C)c1 610330707 XINMMQLPSFSYOA-KRWDZBQOSA-N 386.455 5.245 30 20 GKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1ccccc1 610343740 RFUHXWVHKUBLRR-QZTJIDSGSA-N 385.467 5.028 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2cccc(-c3ccncc3)c2)CC1 610346602 YHSNBDNWZSFEIE-UHFFFAOYSA-N 383.495 5.100 30 20 GKED C[C@@H](NCc1csc(-c2ccc(Br)cc2)n1)c1cccc(C#N)c1 611388936 URJUBVZWUXHGEW-CYBMUJFWSA-N 398.329 5.295 30 20 GKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(SCC(F)(F)F)cc1 618802287 HVTFICRUYKRLCD-ORAYPTAESA-N 376.447 5.551 30 20 GKED N#C[C@H](Sc1nnc(Cc2cccs2)n1C1CC1)c1ccc(Cl)cc1 619863720 LDENYADOICYRRQ-INIZCTEOSA-N 386.933 5.276 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(F)cc(F)c1 675739278 WZXGHEIEIKVILI-LSJOCFKGSA-N 375.303 5.525 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1sc(C)nc1-c1cccs1 684235255 VLOSKFAAMLLQGF-UHFFFAOYSA-N 382.554 5.327 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1 728118378 WNYRXMXLMFIHSQ-LJQANCHMSA-N 390.405 5.639 30 20 GKED Cc1cccc2c1C/C(=C/c1cn(-c3ccccc3)nc1-c1cccnc1)C2=O 729151385 SAPXZRGDWFDKND-UYRXBGFRSA-N 377.447 5.065 30 20 GKED C[C@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1csc2ccccc12 730065466 OOAQLJCDBRPCHK-NSHDSACASA-N 387.411 5.257 30 20 GKED Cc1ccc(-c2ccc(/C=C/C(=O)c3ccc(N4CCC(O)CC4)cc3)o2)cc1 734235752 WCKAMMKQFUKJOF-ZRDIBKRKSA-N 387.479 5.112 30 20 GKED C=CC[C@H](NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1ccncc1 734455231 CCABHVGRWOIQGG-NRFANRHFSA-N 380.394 5.199 30 20 GKED C=CC[C@H](NCc1cccc(OCc2ccccc2Cl)c1)c1ccncc1 734509657 NYLSZMLHURRGAK-QHCPKHFHSA-N 378.903 5.721 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735570883 UCIDQDYMZCHZPY-UHFFFAOYSA-N 383.923 5.203 30 20 GKED CS[C@H](C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 739597650 BBIQSEXODMTCLH-FQEVSTJZSA-N 378.522 5.007 30 20 GKED CS[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 740535273 LUKZVNQIICNWKJ-FXAWDEMLSA-N 378.522 5.399 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1cc(C)n([C@H](C)c2ccccc2)c1C 741726036 RFBZXMSJEPETCX-QGZVFWFLSA-N 390.458 5.118 30 20 GKED N#CCC1(COC(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 744277437 KYMNIIPPNXKFNH-FQEVSTJZSA-N 385.916 5.400 30 20 GKED C[C@H](OC(=O)/C=C/c1ccccc1C#N)c1ncc(-c2ccc(Cl)cc2)o1 751656641 CPXFMDWHJBJNDE-ZHZWZMEUSA-N 378.815 5.184 30 20 GKED COc1cccc(/C(C)=C/C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 751829827 HIHORDRVFSIPCK-RCLKMUNOSA-N 382.872 5.238 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc(Cl)cs2)cc1 758101730 RHOIPYJSPYATGX-UHFFFAOYSA-N 382.872 5.299 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)OC(=O)Cc1ccccc1CC#N 761107735 PBUHWTWMFFOTMD-HNNXBMFYSA-N 394.471 5.171 30 20 GKED C=CCC[C@@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)c1ccccc1 772626235 QPBIZNQHTMMIOD-JOCHJYFZSA-N 390.483 5.405 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c[nH]nc3-c3ccc(F)cc3)cc2)c1 779594070 CJBVETCFOLHITD-UHFFFAOYSA-N 398.441 5.279 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(C)(C)NC(=O)OC(C)(C)C 789719375 OOPXTKAFIUNLQR-UHFFFAOYSA-N 388.552 5.561 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1nc(Br)ccc1F 794973718 XXYMADOBTZPFLO-SOFGYWHQSA-N 389.249 5.003 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2sccc2-c2ccc(F)cc2)s1 797567949 DEDPWEYAUWQSMU-OAHLLOKOSA-N 384.501 5.798 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)s1)c1nc(-c2c(F)cccc2F)cs1 802058684 LOIFOXFMLYFQFQ-SNVBAGLBSA-N 394.855 5.222 30 20 GKED N#Cc1ccc(SCC(=O)c2ccc(C(F)(F)F)nc2Cl)c(Cl)c1 809959141 BZWBNUCSLOMRIH-UHFFFAOYSA-N 391.201 5.254 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)no1 915354255 YKADFRQLFCNQFB-IFMALSPDSA-N 386.455 5.008 30 20 GKED O=[N+]([O-])c1cc(C(F)(F)F)ccc1NN=Cc1ccccc1C(F)(F)F 916285978 TVOMOCIVIATQNB-UHFFFAOYSA-N 377.244 5.078 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C2CCCCC2)cc1 916681654 VTFCIMZVZZEQLU-DNQXCXABSA-N 387.527 5.919 30 20 GKED Cc1ccccc1N(C(=O)c1ccccc1OCC#N)c1nc2ccccc2s1 919977455 YDDJSGKMXAXCDE-UHFFFAOYSA-N 399.475 5.486 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NNc1c(Cl)cccc1Cl 1776048969 PXGINYLYJKCDLM-UHFFFAOYSA-N 395.286 5.268 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccc(Cl)cc2)s1 1776061562 CFKAHWCSCZEQOG-UHFFFAOYSA-N 388.851 5.742 30 20 GKED O=C(/C=C\c1cccc(C(=O)O)c1Cl)c1ccc(Oc2ccccc2)cc1 1776126301 IRCNKAMGKAVKEM-KAMYIIQDSA-N 378.811 5.727 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c(C)s1 1776133470 XQQPTBRXALYFEM-SSSWZJSRSA-N 392.476 5.466 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1csc(Cl)c1Cl 1776355048 BZVAQYHKSMKZRO-HWKANZROSA-N 385.268 5.436 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc2cc(Cl)ccc12 1776355549 ZZYGCZUYDPASDP-POHAHGRESA-N 394.854 5.875 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2csc(C(=O)O)c2)cc1)c1ccccc1 1776469522 VGJDGBAQDGUBOE-BLMSOEDDSA-N 378.449 5.482 30 20 GKED CCCCCCCOc1ccc(CNCC[C@H](CC(=O)O)C(F)(F)F)cc1 1776786221 CDRDOYXSFNRQLQ-QGZVFWFLSA-N 389.458 5.169 30 20 GKED COc1cc2ccc(C(=O)/C=C/c3cccc(C(=O)O)c3Cl)cc2cc1OC 1777343288 KMCZGZMSWROHNO-CMDGGOBGSA-N 396.826 5.105 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(-c3ccc(F)cc3)o2)n1 10399564 KCKVUTJVLFISTE-UHFFFAOYSA-N 393.365 5.367 30 20 GKED C=CCn1c(SCc2cc(=O)oc3cc(C)c(C(C)C)cc23)nnc1C1CC1 21243337 HTVLXSKORGSIDW-UHFFFAOYSA-N 395.528 5.172 30 20 GKED C=CCN(C(=O)c1cc(C)sc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 60951432 OTXRFFACAVJMPT-UHFFFAOYSA-N 399.497 5.229 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(F)F)cc1 66157228 GICRFBPATIVLIB-UHFFFAOYSA-N 375.444 5.315 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 66953891 YMWJSLBEJOZXHX-QZTJIDSGSA-N 379.529 5.411 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1 96749539 MTYWVUVCXGODKW-UHFFFAOYSA-N 385.703 5.390 30 20 GKED Cc1c(C(=O)N(CCC#N)CC(C)(C)C)sc2nc(C(F)(F)F)ccc12 104627179 ZLHJZJVWEMPGQC-UHFFFAOYSA-N 383.439 5.026 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nc(-c2cccc(Cl)c2)no1 109002346 OJRCJPYSIHJVCA-ZDUSSCGKSA-N 384.892 5.396 30 20 GKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Br 118445148 UYRDYGHARTVJCJ-STQMWFEESA-N 389.318 5.142 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NCc1nnc(-c2ccc(C#N)cc2)o1 133696287 FEPMROZQFHRGQZ-UHFFFAOYSA-N 378.501 5.419 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 173122376 UTUIILGRALMZGK-HKUYNNGSSA-N 381.545 5.566 30 20 GKED COCCc1nc(C)c([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)s1 180220298 ACFTUPMXGKQDJV-MRXNPFEDSA-N 391.540 5.030 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(OCC#N)cc1 180538013 ZWIKXGUXUPZVNY-GJZGRUSLSA-N 395.503 5.572 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H](c3ccccc3)c3ccco3)c2)c1 237855422 ZGVHGTQVSCEMSM-AREMUKBSSA-N 394.474 5.609 30 20 GKED C[C@@H](Nc1ccc2cc(C#N)ccc2n1)c1ccc(OCc2cccnc2)cc1 301974017 KMUDIWIUMUUPEL-QGZVFWFLSA-N 380.451 5.254 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1ccc(F)c(F)c1 303286625 NJVCXDOIOPGCDM-AWEZNQCLSA-N 393.393 5.068 30 20 GKED N#C[C@H](NC(=O)CCCOc1ccccc1Cl)c1cccc(Cl)c1Cl 303371907 KHHGBYJYRMLUKW-HNNXBMFYSA-N 397.689 5.187 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1cccc(Cl)c1Cl 303850575 OIAAMGVGTPGMKF-PGUXBMHVSA-N 397.664 5.270 30 20 GKED Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2N=C(O)[C@@H]2CCC(=O)[C@H](C)C2)n1 328929031 YHAAYECVPMUUAY-BXUZGUMPSA-N 393.409 5.101 30 20 GKED C[C@@H]1Sc2ccc(/C(O)=N/[C@@H]3CC[C@@H](c4ccc(F)cc4)C3)cc2N=C1O 329930079 ZIDZPBPFDOLVLL-DXCKQFNASA-N 384.476 5.549 30 20 GKED C[C@@H](c1ccccc1Br)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426131695 RMYJOUAGQFMZFZ-NSHDSACASA-N 392.684 5.199 30 20 GKED CC1(C)C[C@@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)c2ccc(F)cc2O1 431289557 GSTHUNIBRZGIOR-VQTJNVASSA-N 395.478 5.162 30 20 GKED CC1=C[C@H](C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 431904641 UNKPYDAQJZBSRH-YWZLYKJASA-N 379.891 5.425 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)c2)o1 432991043 IJFPNMNPMUFNIE-GGAORHGYSA-N 399.494 5.867 30 20 GKED C[C@@H](SCC(=O)N(Cc1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1 437276026 MLUULYYSKMJAMH-MRXNPFEDSA-N 384.520 5.319 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC[C@@H]1c1ccccc1 438639301 VSLXUBGIZCLHDJ-KSSFIOAISA-N 387.405 5.235 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ncc(-c2ccccc2)o1 439571748 MMHQSPNZBDVIIO-QGZVFWFLSA-N 381.435 6.179 30 20 GKED C=CCN(Cc1cccs1)C(=O)C(C)(C)c1csc(-c2cccs2)n1 443458164 ALZNGXPEGXVCRL-UHFFFAOYSA-N 388.583 5.426 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458807151 XEIFTLXZEKLAQD-XZOQPEGZSA-N 391.515 5.367 30 20 GKED CC[C@H]1CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c2ccccc2O1 460635591 SRXOVIBNXQZQQL-FQEVSTJZSA-N 398.462 5.363 30 20 GKED CN1CCC[C@@H](CNc2ccc(C#N)c(C(F)(F)F)c2)[C@@H]1c1cccs1 462884667 RBBQVSCNJBTWCA-KBXCAEBGSA-N 379.451 5.134 30 20 GKED C[C@@H](S[C@H](C)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1C#N 463207711 BXKHWLDYFOIZJQ-VXGBXAGGSA-N 379.312 5.686 30 20 GKED C[C@@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccc(C#N)cc1 463574647 AKFIPGVPUXFGSG-OAHLLOKOSA-N 376.456 5.340 30 20 GKED CCO[C@H](CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)C1=CCCC1 466990836 ALETWTPBKOQYEG-LJQANCHMSA-N 392.524 5.229 30 20 GKED C=CCn1c(SCc2ccc(F)c(C#N)c2)nnc1-c1ccc(Cl)cc1 468645844 SUVAVFRZRXYYEK-UHFFFAOYSA-N 384.867 5.088 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)F)CC1 470188392 PFIGOOGBOBYFQO-HQSZINLESA-N 390.474 5.006 30 20 GKED Cc1cc(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)c(C(F)(F)F)o1 472384865 SPPCLJUSCRXYMV-UHFFFAOYSA-N 384.357 5.076 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(C[S@](=O)CCCC(C)(C)C#N)cc1 476888441 UKWNECPXXIMEHR-AREMUKBSSA-N 389.948 6.019 30 20 GKED CC(C)(CC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C(F)(F)F 479385220 SLBMNDYGMLDUML-UHFFFAOYSA-N 394.368 5.193 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1)c1ccccc1 483216015 JWHHPBRVBHUIRA-KOSHJBKYSA-N 392.458 5.865 30 20 GKED Cc1ccc2c(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)csc2c1 483490231 MJYUBDUDNVBTHE-ZDUSSCGKSA-N 381.407 5.445 30 20 GKED CC(C)(C)[C@H]1C[C@@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 485707213 NRBPJHRWVUHNRB-LAUBAEHRSA-N 394.540 5.033 30 20 GKED C=CCC(C)(C)CNC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 489985316 AQQXSPADEFRRQQ-UHFFFAOYSA-N 381.303 5.300 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccc(Cl)cc1 499814098 QGNXAXVCOWUYLQ-FMKPAKJESA-N 379.674 5.131 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 500239917 YEURIRCGMHPPKR-AWEZNQCLSA-N 381.369 5.455 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4c(c3)CCC4)c2)cc1 501440258 ZGGSTFFPYRWMEY-UHFFFAOYSA-N 382.463 5.073 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1cccc2[nH]ccc12 502499028 PZUUDUHKRBSSIF-UHFFFAOYSA-N 396.450 5.571 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)N[C@@H](CC(F)(F)F)c3ccccc3)CC2)cc1 504081221 XSVAPTIHCXAXAJ-FQEVSTJZSA-N 399.416 5.051 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccn(C)n1 505034153 AXNXJRGCLNTFIZ-NRFANRHFSA-N 394.906 5.103 30 20 GKED Cc1ccc(F)c(NC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 505750528 LWJMGLOAUPEBAR-AWEZNQCLSA-N 385.851 5.157 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cnn(-c3ccccc3)c2C2CC2)cc1 505831424 HRTMXZXTQMWALP-QFIPXVFZSA-N 398.510 5.042 30 20 GKED N#CCCN(Cc1ccc(Oc2cc(F)cc(F)c2)cc1)Cc1cccnc1 505911691 DYLKNQFZDXFTND-UHFFFAOYSA-N 379.410 5.068 30 20 GKED N#CCCCOc1cccc(CNc2cc(F)c(Br)c(F)c2)c1 508459128 RPPWKXIEBRLPSH-UHFFFAOYSA-N 381.220 5.022 30 20 GKED CCN(C(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)[C@@H](C)c1ccc(C#N)cc1 509574518 JKUBZNCUHOMFHE-LBPRGKRZSA-N 386.282 5.570 30 20 GKED C[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509906425 YRLCDLVODRQJFZ-MBSDFSHPSA-N 391.515 5.374 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1C(F)(F)F 513522215 XMIXCXJHWYHLAJ-UHFFFAOYSA-N 380.414 5.093 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 521016080 FVICEPNWDOECQP-BZNIZROVSA-N 398.837 5.220 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ncsc3C(F)(F)F)c2)cc1 526854199 XEAANSGCLUWVAD-UHFFFAOYSA-N 389.358 5.078 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)N2[C@H]3CC[C@H]2c2ccccc23)cc1C 530308246 NNBGPHJHZUQYCA-GOTSBHOMSA-N 396.494 5.113 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 537192583 NTOXSEJICJZOIK-IBGZPJMESA-N 383.454 5.522 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCOc2c(Cl)cccc21 538371293 DKLFYIRLLCJBSS-HXUWFJFHSA-N 397.906 5.046 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(Cl)cccc1Cl 538654514 KLEDOSXYWUJWEG-UHFFFAOYSA-N 397.261 6.218 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(C#N)c(F)c2)c2ccccc2OC)cc1 540706462 JWAYDQRKYUQKRZ-FYSMJZIKSA-N 390.458 5.155 30 20 GKED CSCc1ccccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 545352150 OUNZZGCFYVFQQF-UHFFFAOYSA-N 388.492 5.253 30 20 GKED CC(C)(C(=O)Nc1ccc2nc(C(F)F)sc2c1)c1cc(F)cc(C#N)c1 553656312 OUJVUEPLNUKYIQ-UHFFFAOYSA-N 389.402 5.161 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC=C(c3ccco3)C2)cc1 560723023 QPERRHLCMFOWEU-UHFFFAOYSA-N 386.476 5.232 30 20 GKED Cn1ccnc1[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(Cl)cc1 571852932 VLGAIYIEGRLXSM-VXKWHMMOSA-N 390.918 5.092 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)CC2 573048841 WZNIOJCIPKOZKG-QZTJIDSGSA-N 398.350 5.848 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H]3CCc4ccc(C#N)cc43)s2)cc1 580680086 FGGDTUUIGZYXLG-QKKBWIMNSA-N 389.524 5.337 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CC[C@H](c2ccccc2)O1 584805243 YUWVDKLQRPZKKA-ILZDJORESA-N 395.528 5.123 30 20 GKED N#CCCN(C(=O)c1cc(Br)c2ccccc2c1)c1ccc(F)cc1 590229477 UPPQRZJSMXBPRL-UHFFFAOYSA-N 397.247 5.302 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)Cc3c(Cl)cccc3Cl)n2)cc1 602750864 GELMDXSUKLZQLZ-UHFFFAOYSA-N 388.279 5.170 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609500446 JQJGXBFCUKGLTP-INIZCTEOSA-N 389.480 5.112 30 20 GKED C[C@H](Nc1cccc(CSC2CCCCC2)c1)C(=O)Nc1ccccc1C#N 609741059 YEBSGIZCFXFHMJ-KRWDZBQOSA-N 393.556 5.563 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NC3(c4ccccc4F)CC3)cc2)cc1 609865167 DSAANTZQFLCTIB-UHFFFAOYSA-N 386.426 5.103 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 609909323 CNCAAIMFHLTBTG-IBGZPJMESA-N 384.454 5.069 30 20 GKED CC[C@@H]1CCCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 610093966 ZVFGZODFTUPECG-OAQYLSRUSA-N 391.515 5.518 30 20 GKED Cc1cc(C(=O)N[C@@H](C)CC#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 610165562 RXQZRLPOEAWKHE-UONOGXRCSA-N 390.314 5.507 30 20 GKED N#CCN1CCC(N[C@@H](c2ccccc2Cl)c2cccc3ccccc23)CC1 611519353 ZAFMIGIJJPDJOB-XMMPIXPASA-N 389.930 5.160 30 20 GKED CCC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 611802977 DMFJUYZVHTYFKB-HOYKHHGWSA-N 398.510 5.522 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361800 BTLYZMNOBHDYND-PKOBYXMFSA-N 381.442 5.128 30 20 GKED CCSc1ccc(-c2noc([C@H]3CCCN3c3ccc(C#N)cc3)n2)cc1 618432502 ULHHBKHTDVODSY-LJQANCHMSA-N 376.485 5.062 30 20 GKED N#Cc1ccc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1Cl 619748946 UEHCDQLMDIEUDC-UHFFFAOYSA-N 383.860 5.138 30 20 GKED C=CCc1ccc(OCc2nc(-c3cccc(C(F)(F)F)c3)no2)c(OC)c1 653645031 JFYOAZSZPQEUAL-UHFFFAOYSA-N 390.361 5.072 30 20 GKED Fc1ccc2c(c1)[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CCCO2 675737612 IJROCXKFEJKXGB-UEKVPHQBSA-N 399.350 5.539 30 20 GKED COc1ccccc1/C(C)=C\C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 727627243 DHLNBJOUTWJKQQ-HMVFGEFZSA-N 382.872 5.238 30 20 GKED C[C@@H](Nc1snc(Cl)c1C#N)c1ccc(OCc2ccc(F)cc2)cc1 728569109 KWBWEBUNXUTWBC-GFCCVEGCSA-N 387.867 5.559 30 20 GKED C#Cc1cccc(NC(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c1 729552064 AVSZGAFYMCBPLL-LJQANCHMSA-N 391.471 5.130 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C(/C)c3cccc(F)c3)n2)cc1 732497147 LKKQQSIVSVDRBD-CPPNXCSESA-N 392.455 5.238 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)[nH]c12 735793797 ZABXMZZTUQFLEU-QLFBSQMISA-N 384.266 5.158 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C[C@@H](C)c2ccc(C(C)C)cc2)c1 737565236 FNTUQKKOBOKPJG-GCJKJVERSA-N 378.516 5.301 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)NCc1ccc(N(C)CCC#N)cc1 738440698 XEDBHYZZULBZFL-QFIPXVFZSA-N 399.966 5.575 30 20 GKED CCOc1ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1F 740443166 DAFDCDSCRLCFJP-UHFFFAOYSA-N 395.459 5.146 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)cc1 741470551 RPKAMECBVAOJCN-QJKHOBJASA-N 383.447 5.549 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1 741474850 ZWWBYYLSBTUOIH-JXMROGBWSA-N 381.435 5.043 30 20 GKED N#Cc1ccc(CN[C@@H](Cc2ccc(Cl)cc2Cl)c2ccc(F)cc2)o1 742369906 IWGPAOSYMYWLCO-FQEVSTJZSA-N 389.257 5.671 30 20 GKED Cc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)c(OC(F)F)cc1C 742435025 PGXONAIOGIXSPO-ONEGZZNKSA-N 382.819 5.164 30 20 GKED N#CCC1(COC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)CC1 744279431 OZSUZOPBNXALIF-UHFFFAOYSA-N 376.431 5.144 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1cnn(-c2ccccc2)c1 746347447 KJFWIMTYUPBKQY-KHPPLWFESA-N 375.428 5.031 30 20 GKED Cc1cc(C(=O)N[C@H](CCC#N)c2ccccc2)c(C)n1[C@@H](C)c1ccccc1 749045943 QUTMFVQXYPIBSU-YADARESESA-N 385.511 5.489 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(N2CCCCCC2)cc1 753140459 BDYYCIQYNQBMGE-MDZDMXLPSA-N 389.524 5.482 30 20 GKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1c[nH]c2ncccc12 761811091 CJAQEQNSQKJZBT-QPJJXVBHSA-N 393.786 5.281 30 20 GKED Cc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 770176491 COJMCMLYKLSGJO-NBGIEHNGSA-N 397.522 5.745 30 20 GKED C#CC[C@@H](N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccccc1 773115215 NBCZFLDETZGDLO-NBGIEHNGSA-N 395.506 5.329 30 20 GKED C#CCCCCC(=O)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 773623984 KLBUHRHPXGCBBD-UHFFFAOYSA-N 399.899 5.206 30 20 GKED CC(C)c1ccc(Nc2nn(CN3CCC(CC#N)CC3)c(=S)s2)cc1 781571350 FNGJPCZHJNTEFX-UHFFFAOYSA-N 387.578 5.124 30 20 GKED O=C1/C(=C\c2ccc3cnccc3c2)CCOc2cc(Br)ccc21 782323840 SMNDXCQTTXSSLM-GDNBJRDFSA-N 380.241 5.046 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)ccc1Cl 789903213 PORJNMRFDWMERO-JOCHJYFZSA-N 390.870 5.130 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCc3cc(Br)ccc32)c1 794811908 UQUHBJWVLUGCCR-RXVVDRJESA-N 399.332 5.297 30 20 GKED C#CC(=O)N(CCC)[C@@H](CCc1cccs1)c1ccc(Br)cc1 797771027 XUHMVSRENIGAIR-SFHVURJKSA-N 390.346 5.056 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ccc(Cl)nc2Cl)n1 799876444 ZCVYEXWCOXPGCF-UHFFFAOYSA-N 378.206 5.275 30 20 GKED C#CCC(CC#C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 807224431 VZYQAPRCZNTLAK-UHFFFAOYSA-N 376.456 5.012 30 20 GKED O=C(OCc1ccc(C(F)(F)C(F)(F)F)cc1)C12CC(C(F)(F)F)(C1)C2 810698605 FWVMVNTWDUPTLX-UHFFFAOYSA-N 388.254 5.117 30 20 GKED N#Cc1ccc(CN[C@@H](CCc2ccccc2)c2ccccc2O)cc1Cl 815624005 MXDGALXWMZVGGO-QFIPXVFZSA-N 376.887 5.381 30 20 GKED C[C@H](CC(C)(C)C#N)OC(=O)c1csc(-c2ccc(Br)s2)n1 851208649 ADZUZANBOHUOQH-SECBINFHSA-N 399.335 5.119 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1nc(Cl)ccc1Cl 915055272 FDBVHJXCRFTOTD-UHFFFAOYSA-N 399.237 5.008 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 915353828 YCAPQEQZAKNXJL-DNQXCXABSA-N 383.495 5.861 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCc1ccc2ccccc2c1 920104274 OZYGLEPVUDEULW-NRFANRHFSA-N 380.447 5.154 30 20 GKED CCCCCCOCc1cccc(NC(=O)N(C)Cc2cccc(C#N)c2)c1 920874182 CRFQEQWVXYSOKE-UHFFFAOYSA-N 379.504 5.319 30 20 GKED CC(Cc1ccc(-c2ccccc2)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033180 IGWLSGQFPNKNSL-UHFFFAOYSA-N 378.859 5.736 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1ccc(-c2ccc(Cl)cc2F)s1 1776037053 OQRRMDGQCYHXOI-UHFFFAOYSA-N 388.851 5.742 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1sc2c(C)cc(C)cc2c1C 1776050849 HKQLHPUEJYUWSW-UHFFFAOYSA-N 382.485 5.369 30 20 GKED CC(=NNc1c(F)cccc1Cl)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776055647 DZWBBUXUULXEDW-UHFFFAOYSA-N 398.821 5.806 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(Oc2ccc(Cl)cc2)cc1 1776063745 GJLWBFJEGOLCAQ-UHFFFAOYSA-N 398.821 5.806 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1)C(=O)O 1776469777 JZAPTIORBUIVIP-NJHLSQGMSA-N 398.764 5.107 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)C(=O)c2ccccc21 1776526574 RKMBNPGZPVPHSJ-PTNGSMBKSA-N 388.419 5.298 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nc3ccccc3c(=O)n2C2CCCC2)cc1 7427827 HACDNUDTYXKOIH-IBGZPJMESA-N 389.524 5.047 30 20 GKED Cc1cc(CNC(=O)c2ccccc2Sc2ccccc2C#N)ccc1F 26662661 ISXUTGIIOWTLNZ-UHFFFAOYSA-N 376.456 5.087 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)SC2=Nc3ccccc3CS2)cc1 42512958 YOHNXWJDUJGODG-MRXNPFEDSA-N 395.553 5.298 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 63400550 SFGYWNKIXHYAAJ-HXUWFJFHSA-N 399.878 5.097 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Sc2nc3c(cc2C#N)CCCC3)c(Cl)c1 97061380 IPSOCVUYPLTLSU-AWEZNQCLSA-N 399.947 5.222 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(Cc2ccccc2)CC1 108532736 UVVJHXOOKIZCJJ-SFHVURJKSA-N 393.556 5.425 30 20 GKED CC1=NN(c2ccc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc2)CC1 120056892 AFZUFYCGHVHCNB-INIZCTEOSA-N 394.887 5.026 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cccc(F)c4o3)n2)cc1 123559246 RXTFNUYXBHQNTE-HNNXBMFYSA-N 392.411 5.194 30 20 GKED Cc1nc(C(C)(C)NCc2cccc(OCc3ccccc3C#N)c2)sc1C 124751032 GUYGOCNEMOTZJL-UHFFFAOYSA-N 391.540 5.236 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2cc(C)cc(C)c2)cc1 127591954 BROBJAZXXVITQR-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2cccc(O)c2F)cc1Cl 128331438 AZYLDLVGMJGIOK-UHFFFAOYSA-N 382.778 5.101 30 20 GKED O=C(Nc1ccc(CCC(F)(F)F)cc1)c1ccc(F)cc1C(F)(F)F 132108504 NGXCJZBCKVUBJZ-UHFFFAOYSA-N 379.275 5.592 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)c1c(F)cccc1F 153984466 NEERMNYXLKNZBO-AWEZNQCLSA-N 393.393 5.074 30 20 GKED C=CCN/C(S)=C(\C(=O)c1ccc(F)c(C)c1)[n+]1ccc(C(CC)CC)cc1 175377607 ZQZZYGMZPGGYTI-UHFFFAOYSA-O 399.555 5.040 30 20 GKED C[C@@H](CN(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nccs1 184951115 OGFHULMJTJVFHT-HNNXBMFYSA-N 393.537 5.042 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)[C@@H]1c1cccc(F)c1 245410117 PMCZBTLGKGIUCZ-XFQAVAEZSA-N 397.519 5.692 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ccc([N+](=O)[O-])c(C#N)c3)s2)cc1 302199473 QVVVVVYVGVORMF-LBPRGKRZSA-N 394.456 5.080 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(OC)c(OC)c3)s2)cc1 303235734 ZFZMLCMXQFZKLW-VZUCSPMQSA-N 395.480 5.040 30 20 GKED COc1cccc([C@H]2C[C@@H]2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 303384958 WZEYQFMMCARBJN-PKTZIBPZSA-N 384.435 5.101 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cccc(COc2cccc(C#N)c2)c1 303658212 VVDNHWHVEUXHKX-UHFFFAOYSA-N 396.490 5.008 30 20 GKED N=C(O)C1CCN(Cc2cccc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)c2)CC1 328978982 CRNHPQQLBVBNGX-YUXAGFNASA-N 397.563 5.628 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 410974323 XRIVUCOSWHMNQU-HOTGVXAUSA-N 378.781 5.167 30 20 GKED N#CC1(CCCSCc2cc(-c3ccccc3Cl)on2)CCOCC1 419651219 SJIRPHXKAKQNKM-UHFFFAOYSA-N 376.909 5.329 30 20 GKED N#Cc1ccc(-c2nc(-c3ccc(Oc4ccccc4C(F)(F)F)nc3)no2)o1 426420724 OTFNJAKTLOTTTL-UHFFFAOYSA-N 398.300 5.074 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)c1 429870386 SASANQZXIKPZKQ-OAQYLSRUSA-N 392.911 5.475 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(CC(F)(F)F)cc1)c1ccccc1 432950642 TVCGIKABJBDSEQ-GOSISDBHSA-N 375.394 5.348 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@H](CCCC#N)c1ccccc1 433000266 OKEJQERYTSTXJF-QGZVFWFLSA-N 375.394 5.571 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC(C)(C)CC1 437834444 FDPAKGYXLQOGSE-UHFFFAOYSA-N 377.488 5.703 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1ccc(C(F)(F)F)c(F)c1 439142931 QSVMYBJELNCGAG-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc(Cc2ccccc2)no1 439604842 UGMMLAJKAQITMF-KRWDZBQOSA-N 396.450 5.497 30 20 GKED COC[C@@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 454477899 DROCDKBDOANBST-AZUAARDMSA-N 397.906 5.028 30 20 GKED Cc1ccc(Br)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 455042637 YXVFDAXTILNXIA-QGZVFWFLSA-N 386.293 5.314 30 20 GKED N#CCc1ccc(NC(=O)N2CC[C@@H](CSc3ccccc3)C2)c(Cl)c1 455699691 HQECRECDHBDPBX-MRXNPFEDSA-N 385.920 5.052 30 20 GKED Cc1ccccc1C1CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC1 458802952 QEPJAYFMOQUERW-HSZRJFAPSA-N 375.516 5.319 30 20 GKED CCOc1ccc(-n2c(SCCC(C)(C)C#N)nnc2-c2ccccc2)cc1 463042167 IMDVNMNTNJAUFG-UHFFFAOYSA-N 392.528 5.365 30 20 GKED C[C@H](SCC(=O)Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 463197142 OYMNGQPKWGOHCP-LBPRGKRZSA-N 379.312 5.492 30 20 GKED CC(C)(C#N)CC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 469471687 AZDHPWLBFRPLKH-UHFFFAOYSA-N 384.345 5.238 30 20 GKED COCCC1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCCC1 471334469 CYSYOXBBFDYBHF-UHFFFAOYSA-N 378.472 5.194 30 20 GKED C[C@H]1c2cc(Cl)c(Cl)cc2CCN1C(=O)C[C@H](CC#N)c1ccccc1 476342208 NMNXESPYUCGDND-HOCLYGCPSA-N 387.310 5.527 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 476343942 ZQHATLSVBKZSSL-FPOVZHCZSA-N 375.516 5.400 30 20 GKED CC(C)c1csc(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 478673307 PTYWRTIVBDWJMG-UHFFFAOYSA-N 392.484 5.252 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)c(F)c2)c2cc(F)ccc2F)c1 479483356 WGDYWXSDBZTPIM-QFIPXVFZSA-N 398.453 5.577 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1)c1ccc(F)c(F)c1 481598086 YJUMZRWSFLOLPZ-ORAYPTAESA-N 387.405 5.430 30 20 GKED CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)[C@@H](c1ccccc1)C(F)(F)F 485456289 VYRJBYKXWMCYIO-AWEZNQCLSA-N 379.275 5.220 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc2nc(-c3ccccn3)[nH]c2c1 485499740 XAOLSNMCGDIKQA-UHFFFAOYSA-N 386.480 5.155 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@H](C)Sc1nc(C(F)(F)F)ccc1C#N 488798946 QNKWAHGQPLPLSR-JTQLQIEISA-N 399.825 5.053 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC=C(c2ccccc2)C1 497329892 RZZNTFKMNAATJS-KRWDZBQOSA-N 377.513 5.402 30 20 GKED CC(C)(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 501429409 YNZJNZGQRBPZJJ-UHFFFAOYSA-N 384.479 5.248 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(OCCCC#N)c1 504079030 XVVOLEANKWXIGJ-UHFFFAOYSA-N 399.472 5.032 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CC(C)(C)Cc2oc(C)cc21 504421269 FUEOFPPAVYEKHZ-FQEVSTJZSA-N 379.504 5.095 30 20 GKED N#CCCN(Cc1ccco1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 505779112 YCEXSQCUYKLIAO-UHFFFAOYSA-N 385.807 5.017 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1)c1ccccc1 510005012 ACYJKYSIUVXZQU-HNNXBMFYSA-N 375.859 5.637 30 20 GKED Cc1ccc(CN(Cc2cn(CCC#N)nc2-c2ccccc2)C(C)C)s1 511880310 UULDZJWDPMPFDO-UHFFFAOYSA-N 378.545 5.244 30 20 GKED C[C@H](Oc1ccccc1C#N)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 511980942 JBCLIJCASLVJMM-MEDUHNTESA-N 391.324 5.159 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)CCCCC1 516706296 NIPPKKZYTOPQMY-UHFFFAOYSA-N 390.270 5.593 30 20 GKED CC(C)(C)c1ncc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)s1 517907027 XYUVBUVOZKXCMS-UHFFFAOYSA-N 393.537 5.392 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 518139985 KHYURWVTHMNGKS-MRXNPFEDSA-N 382.529 5.388 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)cc1 520136602 IPGIRHPTRFVPQO-JOCHJYFZSA-N 389.886 5.512 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c1 524018653 LFKARQZICLYQMR-QGZVFWFLSA-N 386.451 5.097 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC=C(C(F)(F)F)CC3)cc2)c1 533856255 INJHMCRTEKTNHH-UHFFFAOYSA-N 387.361 5.077 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NC2CCC(F)(F)CC2)cc1Cl 534163354 JROLWQIUPIUVPW-UHFFFAOYSA-N 390.817 5.312 30 20 GKED COc1ccccc1[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccco1 536854131 UXIZORLLHHGPAL-FMGHMSBISA-N 386.495 5.371 30 20 GKED C[C@@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1cc(F)c(F)c(F)c1 539626726 DVCJPJZWPBXPSY-SNVBAGLBSA-N 395.318 5.694 30 20 GKED C[C@H](N[C@@H]1c2cc(Br)ccc2SC[C@H]1C)c1cccc(C#N)c1 540593760 KZJGJIYLRPQKFJ-NQCMUKECSA-N 387.346 5.454 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 565766277 AMUDSKITCWLVAR-UHFFFAOYSA-N 379.419 5.460 30 20 GKED CCSc1cccc(F)c1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 566650628 VHZSVNBZXZKACU-WMZOPIPTSA-N 383.492 5.241 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)cc1 572076991 PODKZQALQQHYJL-FQEVSTJZSA-N 391.858 5.084 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)s2)c(C)c1 605362861 WMICGJBULJICDO-INIZCTEOSA-N 386.480 5.102 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)N(C)c3ccc(C#N)cc3F)cs2)cc1 608798544 WKZGIEHXWNRRLI-UHFFFAOYSA-N 379.460 5.221 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cc1nnc(-c2c(Cl)cccc2Cl)o1 608832679 IYOXJZLBYGFQEV-UHFFFAOYSA-N 399.281 5.103 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)Nc3cccc(C#N)c3)s2)cc1 610089026 ACDUWIQVUCCTCE-MRXNPFEDSA-N 390.512 5.524 30 20 GKED COc1ccc(-c2nc(CSc3ccc(C#N)cc3F)cs2)c(OC)c1 610164645 LTPYVIYUCLSQAJ-UHFFFAOYSA-N 386.473 5.130 30 20 GKED CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610321161 JFKOPXVBHZLPIZ-UZLBHIALSA-N 378.476 5.178 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1ccc2ccccc2n1 613290539 FAQXPOJRYRKGHF-OAQYLSRUSA-N 382.394 5.656 30 20 GKED Fc1cccc2ncnc(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c12 614305661 KKEYDHMXBVZFNS-MYJAWHEDSA-N 381.295 5.090 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1C[C@@]1(F)c1ccccc1 619130090 XPECDNAKJLCIJM-DZGCQCFKSA-N 385.323 5.041 30 20 GKED Fc1cc(-c2noc([C@@H](C[C@H]3CCCO3)C(F)(F)F)n2)cc(C(F)(F)F)c1 650625783 NVPHCDVWGYPEJH-VXGBXAGGSA-N 398.278 5.110 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 681101487 HFHUFOQBSPWDKA-INIZCTEOSA-N 398.459 5.113 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccccc1Oc1ccccc1 726074715 XVHRJWJGQXLPQV-KRWDZBQOSA-N 387.439 5.264 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2F)CCCC1)c1nc2cc(F)ccc2s1 730418348 UTZVNFDYNZPYRL-AWEZNQCLSA-N 382.435 5.263 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H]3CCCc4ccccc43)n2)cc1 731135651 FZXLFAVVQOFNHM-FPOVZHCZSA-N 386.520 5.805 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)cnn1-c1cccc(Cl)c1 731565560 UEGPGVMDLMGGHH-KUCQQTCKSA-N 391.858 5.021 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\C[C@@H](O)c1ccc(Cl)cc1Cl 731938069 QWZYUMKMSILLSI-VPNRLQGLSA-N 379.070 5.158 30 20 GKED C[C@H]1C[C@@H]1c1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)o1 732763789 HUMJWNJHQKWLOK-CABZTGNLSA-N 393.299 5.139 30 20 GKED COc1ccc(/C=C2/CCOc3c(Cl)cccc3C2=O)c(Cl)c1OC 733748825 KOTHEYQDYLGWBQ-BENRWUELSA-N 379.239 5.059 30 20 GKED O=[S@](Cc1cccc(N=Cc2cc(Cl)ccc2O)c1)C1CCCCC1 734979649 SNFOIVVPQUUCMD-RUZDIDTESA-N 375.921 5.378 30 20 GKED Cc1ccc(Cl)cc1NC(=O)CSCc1cc(Cl)ccc1OCC#N 735320083 KKBYWBDBVWOACG-UHFFFAOYSA-N 395.311 5.076 30 20 GKED CCOc1ccccc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740432348 ZBNFCNIHUCFAGC-UHFFFAOYSA-N 377.469 5.007 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741471557 BJIQBGKEVKFYKL-VAWYXSNFSA-N 393.490 5.506 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c(OC(F)F)c1 741473490 QTNPRLBXXSYXTI-SOFGYWHQSA-N 381.378 5.255 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)N[C@@H]2CCOc3ccccc32)cc1 741483743 NBBBVLPQFACPKV-FCHUYYIVSA-N 399.519 5.152 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](Sc2ccccc2)c2ccccc2)n1 747197304 DFGXTAVWTIFNHL-NQIIRXRSSA-N 392.549 5.976 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)OCc2ccc(-c3ccccc3C#N)cc2)s1 750438907 GRFRQARJSURBGJ-HNNXBMFYSA-N 392.480 5.055 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN[C@@H](C)c2csc3ccccc23)c1C 754732903 CAFHYRMOJAGIAI-SFHVURJKSA-N 391.540 5.116 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(-c3ccc4c(c3)C[C@@H](C)O4)cc2)cc1 756991785 WLJXBYDYUTYTHR-MOPGFXCFSA-N 398.506 5.258 30 20 GKED CC(C)c1ccc(CC2CCN(C(=O)Nc3cccc(OCC#N)c3)CC2)cc1 765143585 WWRJEXFSOQKDGS-UHFFFAOYSA-N 391.515 5.199 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)OC(=O)Cc1ccccc1CC#N 776938294 GJCHKJCPKLMJGM-HNNXBMFYSA-N 394.471 5.171 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3ccc(Cl)cc3)o2)C(=O)c2ccccc2C1 778520297 SFZJCVYGCGBHAM-PDGQHHTCSA-N 391.854 5.228 30 20 GKED CCc1cccnc1C(C)=NNc1ncnc2scc(-c3ccc(F)cc3)c12 779761485 QAWIETSOIFJEEG-UHFFFAOYSA-N 391.475 5.291 30 20 GKED Cc1ccc(C(=O)OCC2(C#N)CCCCC2)cc1NC(=O)c1ccccc1F 780488420 NDYZARXXOZOWIS-UHFFFAOYSA-N 394.446 5.017 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1SC(F)(F)F 780505180 HPYVCUDOUSQIBB-NSHDSACASA-N 381.379 5.233 30 20 GKED CC(C)n1cc(/C=C/C(=O)c2ccc(Br)cc2C(F)(F)F)cn1 790233169 QDNIXULSRVBYBU-ZZXKWVIFSA-N 387.199 5.141 30 20 GKED COc1cccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1F 796801111 XWPIXQUNNULOOM-KRWDZBQOSA-N 394.471 5.075 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C[C@H]1CCC(F)(F)C1 797856832 NJTVSHPTKNTJDF-MRXNPFEDSA-N 384.426 5.210 30 20 GKED CCOc1cc(/C=C\C(=O)c2coc(C(C)C)n2)ccc1OCC(F)(F)F 806560031 IGDGWHPNLLQJLR-ALCCZGGFSA-N 383.366 5.034 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2n[nH]c3nc4ccccc4n23)cc1 817995973 LQONTDGMHBRHOB-UHFFFAOYSA-N 381.464 5.042 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(-c3cccs3)cc2)ccc1OC 850136210 WHRHPWHMXUAWSR-FQEVSTJZSA-N 392.524 5.394 30 20 GKED N#C[C@@H](C(=O)C1C[C@@H]2CC[C@H](C1)S2)c1nc(-c2ccc(Cl)cc2)cs1 892506810 HMWNBAXJXDQURK-WDVRLDOZSA-N 388.945 5.314 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccc(C(F)(F)F)nc2)s1 893345884 DFIHHDFIJINSMG-UHFFFAOYSA-N 386.443 5.107 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(F)ccc3s2)cc1 916954680 JWOZIXWVNKSJRH-SCLBCKFNSA-N 394.471 5.515 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cn(CC)c3ccccc23)cc1 916955806 VDGPKKZQOZTYHH-JXFKEZNVSA-N 387.483 5.136 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)/C=C/c1ccc(OCc2ccncc2)cc1 917144623 AWVFNDHKYDSMJP-FMIVXFBMSA-N 395.462 5.255 30 20 GKED CC(C)Oc1ccc([C@H]2CCCC2=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033597 FKYQFOPOONNQNA-QGZVFWFLSA-N 386.879 5.561 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)cc1 1776125834 UASRDBSRHWJMLJ-QHIITQONSA-N 398.474 6.015 30 20 GKED C=CCc1ccccc1/C=C/c1cc(C(=O)O)nc(-c2ccc(Cl)cc2)n1 1776189057 FMFBLRFTMYKVNX-JLHYYAGUSA-N 376.843 5.394 30 20 GKED CC(C)(C#N)c1ccc(CNCc2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776230647 SCBSFZLERFNILO-UHFFFAOYSA-N 384.479 5.143 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776806020 SXTPZSBSMMUDCP-AQTBWJFISA-N 384.475 6.291 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2csc(C(=O)O)c2)cc1OCC 1776815306 LMUGMJRTOCZCAY-WAYWQWQTSA-N 394.876 5.183 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc4c(Cl)nccc4o3)c2c1 1777685810 ZTWLEZDHYODPCL-HNQUOIGGSA-N 383.812 5.290 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cc3ccccc3[nH]2)cc1 59333072 MDPLSDPVYVAUEY-UHFFFAOYSA-N 383.426 5.021 30 20 GKED CCc1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)sc1C 64714590 TUBYKNCCVZIWGC-LBPRGKRZSA-N 388.464 5.511 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cccc(-c3cnco3)c2)cc1 65158880 HSMIINXMPBGXIZ-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CSCc1ccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)cc1 72091583 POFYYONBBUCDBJ-UHFFFAOYSA-N 388.492 5.253 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2cccc(/C=C/C(=O)c3cccc(C#N)c3)c2)c1 96130146 BATGPFFYYHXOHJ-PJABCKPXSA-N 388.426 5.222 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCC(=O)c1ccc(Cl)cc1 104789878 RYIYRXGUOSYQGC-UHFFFAOYSA-N 382.312 5.233 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(COCc2ccco2)c1)c1ccccc1 119015428 GWJVZUXTYNZFTH-JOCHJYFZSA-N 389.455 5.163 30 20 GKED CC(C)n1ccnc1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 124372238 RDBJXWVLAMXDSC-UHFFFAOYSA-N 380.879 5.180 30 20 GKED CC(C)(C)[S@](=O)Cc1cccc(NCc2cccc(OCCCC#N)c2)c1 133589798 RYOISLFXLLLVJG-MHZLTWQESA-N 384.545 5.028 30 20 GKED CCN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@@H](C)c1cc2ccccc2o1 151314779 YSZFXAJHNMBKAC-PXNSSMCTSA-N 375.472 5.570 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)C(=O)Nc1ncc(Cl)cc1Cl 154179851 NPGCGBVBJUZTHF-QMMMGPOBSA-N 386.691 5.033 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1c(F)cccc1F)C1CCCC1 180071634 DVVNLSQWKIMNMH-HNNXBMFYSA-N 399.441 5.232 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 181044347 LRHUMEVTWVNZKV-AWEZNQCLSA-N 386.908 5.306 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)cc1F 182142680 YZMCSXPQYYEIHB-OAHLLOKOSA-N 392.405 5.483 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)c1cc(OC(F)F)cc(OC(F)F)c1 182229878 RVYYFZLMHLBLKC-UHFFFAOYSA-N 397.246 5.161 30 20 GKED CCN(C(=O)c1cnc(Cc2ccccc2F)s1)c1ccc(C#N)c(Cl)c1 186967989 JENLIFKZJKFONY-UHFFFAOYSA-N 399.878 5.065 30 20 GKED COc1ccc(CN[C@H](c2ccccc2F)C2CCCC2)cc1OCCCC#N 237302117 CMHNZRQGUSVPPN-DEOSSOPVSA-N 396.506 5.538 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(NC(=O)CC(C)C)c(F)c2)c1 304033676 NAGQEPOMTSNOBO-UHFFFAOYSA-N 384.451 5.018 30 20 GKED CC(C)c1ccccc1N=C(O)[C@H](C)N1CCC[C@H](c2ncc3n2CCCC3)C1 328665571 ZGLGXCYQBBIAFV-OALUTQOASA-N 394.563 5.199 30 20 GKED CCCS(=O)(=O)Nc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1C 329015772 QGEOXXPGGKLVNY-OKZBNKHCSA-N 392.565 5.341 30 20 GKED O/C(COc1ccc(F)cc1Cl)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329259939 AMAPWOGZOHIQIM-KRWDZBQOSA-N 391.874 5.204 30 20 GKED O=C1CCC(/C(O)=N/[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)CC1 329753836 KIXQPFVLDOURLH-QGZVFWFLSA-N 389.293 5.024 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2CCc3c2ccc(Cl)c3Cl)CC1)C1CC1 330011312 ITUFASOUAJVGRD-QWQCLYJRSA-N 395.330 5.863 30 20 GKED CC[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1OC(F)F 426130864 LZJFJIVKJQDRIY-AWEZNQCLSA-N 379.794 5.086 30 20 GKED C[C@H]1c2c(Cl)cc(Cl)cc2CCN1Cc1nnc(-c2cccc(C#N)c2)o1 434899697 AJKXRBXSYSXHEQ-LBPRGKRZSA-N 399.281 5.034 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1-c1nncn1C(C)C)c1ccccc1 435613828 CBXBRAGYTNPXDJ-HXUWFJFHSA-N 389.503 5.355 30 20 GKED CC(C)c1ccc(-c2ncc(C[S@](=O)CCCCC(C)(C)C#N)s2)cc1 436109553 VIFZEMOOGSKESR-AREMUKBSSA-N 388.602 5.902 30 20 GKED O=C(NC[C@H]1CCC[C@H](C(F)(F)F)C1)Nc1ccc(F)cc1C(F)(F)F 438583476 MUJHIZJJWWSNNC-UWVGGRQHSA-N 386.311 5.335 30 20 GKED CSc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 439494085 DLJPZMCOUXMNSN-LSDHHAIUSA-N 385.558 5.543 30 20 GKED C=CCC[C@@H](NC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)c1ccc(C(F)(F)F)cc1 441839195 ARTMPBPJZPJVMG-SUTQANCOSA-N 393.449 5.224 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)NCC1CCC(C#N)CC1 442736288 IMLHPRUSYYLHOA-UHFFFAOYSA-N 382.335 5.243 30 20 GKED C[C@H]1CSc2ccc(Br)cc2[C@@H]1NCC1CCC(C#N)CC1 442876339 QXPVNMXQLMQDJG-SEBUGHOLSA-N 379.367 5.152 30 20 GKED N#CCCCn1cc(C(=O)N2CCc3c2cccc3C(F)(F)F)c2ccccc21 444266416 OLJKCIHMXTVPOT-UHFFFAOYSA-N 397.400 5.167 30 20 GKED CCCOc1cc(F)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444306542 KKRZUEQEVHZJHA-UHFFFAOYSA-N 379.435 5.125 30 20 GKED Cc1ccccc1[C@]1(F)CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458855129 XWYJPMPOVIZFRL-GGAORHGYSA-N 379.479 5.010 30 20 GKED CC(C)c1cnc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)s1 460555871 UDWUZGGBNXWZJN-UHFFFAOYSA-N 381.432 5.322 30 20 GKED CCN(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H](c1ccccc1)c1ccc(F)cc1 463952035 QQZLADLXDHWDFS-HOYKHHGWSA-N 386.470 5.439 30 20 GKED CC(C)[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)C(F)(F)F 470784927 SEPHNULJXCDGCQ-SFHVURJKSA-N 392.446 5.167 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 470890220 HZSNUTVFASPJLK-SJORKVTESA-N 390.508 5.640 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 473850106 MTCSCNDSKYZLKT-AZUAARDMSA-N 379.529 5.491 30 20 GKED N#Cc1ccc(CN2CCCC[C@H]2c2nc3ccccc3o2)c(OC(F)F)c1 474211614 DQIFUWQDJHGPPT-KRWDZBQOSA-N 383.398 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(Cc2ccc(F)c(F)c2)C1 475547976 PXDLZRAKGHVGEA-UHFFFAOYSA-N 384.470 5.523 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1cccc(F)c1)N(C)C 475565940 RKPXPJRIULDOED-OAQYLSRUSA-N 383.511 5.102 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(OC)ccc1OCC 480554214 LINXWKINITWMEB-UHFFFAOYSA-N 380.897 5.029 30 20 GKED C=CCn1c(S[C@H]2CCc3ccc(F)cc32)nnc1-c1ccccc1OC 481027262 VJJDJOKQKHDSGV-IBGZPJMESA-N 381.476 5.058 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 481932465 QIJAFJJHUOEKHL-UHFFFAOYSA-N 382.872 5.338 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1nccc2ccccc12 483203775 WDODWHHEZPFKLJ-OAHLLOKOSA-N 391.402 5.127 30 20 GKED N#Cc1ccc(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)c(Cl)c1 484530638 MNXQUHCEXWABMA-UHFFFAOYSA-N 381.785 5.198 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 487571628 XUGZZNTXROLLJD-KRWDZBQOSA-N 380.797 5.524 30 20 GKED C=CCN(C(=O)c1cccs1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 502935532 TZEZGFUVSYIEDY-UHFFFAOYSA-N 395.336 6.011 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503964777 IFWMNMZPHDVMLQ-HNNXBMFYSA-N 382.916 5.008 30 20 GKED CCn1c(C)cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)c1C 505702873 HJXYJEYLTKAQFU-UHFFFAOYSA-N 389.455 5.050 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 505921717 AOVZWOXEROYXKZ-GYSYKLTISA-N 379.209 5.043 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 509911496 MKFJODJDMNOZGY-LJQANCHMSA-N 399.494 5.523 30 20 GKED Cc1sc(CNC(=O)Nc2ccc(CC#N)cc2)nc1-c1ccc(Cl)cc1 510464069 YDIDIZLGYFOAOI-UHFFFAOYSA-N 396.903 5.160 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510659607 CYPORIMOAQMLCB-UHFFFAOYSA-N 391.858 5.668 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccccc2OC2CC2)cc1 514965773 LNAFTQRUCAZTJS-UHFFFAOYSA-N 398.462 5.125 30 20 GKED CC[C@H](c1ccccc1)N(CC)CC(=O)N(CCC#N)c1cccc(C)c1C 519909694 MXLFTRIGFULSSD-JOCHJYFZSA-N 377.532 5.023 30 20 GKED CCc1ccc(CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1 520941636 VKVJBHBGYMQLHP-KRWDZBQOSA-N 393.556 5.840 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)Nc2ccc(F)c(C#N)c2)cc1C 524455146 HXJWKGNIJIOXFH-UHFFFAOYSA-N 377.444 5.113 30 20 GKED N#Cc1ccc(C2(NCc3ccc(-c4ccccc4Cl)o3)CCOCC2)cc1 527812271 QIFHNRORJNPOOB-UHFFFAOYSA-N 392.886 5.267 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3[C@H]4CC[C@H]3CC3(C4)CC3(F)F)c2)cc1 529652567 GXQRWKOJZFCOOI-ROUUACIJSA-N 394.421 5.143 30 20 GKED CCC(CC)N(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CC1 530945953 RFIGGIFXVJJAPW-UHFFFAOYSA-N 391.515 5.517 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc2cccnc12 530980887 DJXDDUOSSLQOOD-AZUAARDMSA-N 390.874 5.192 30 20 GKED Cc1nc(-c2ccc(CNC(=O)N[C@@H](CCC#N)c3ccccc3)s2)cs1 533349609 UCKOBJYDLARKSK-KRWDZBQOSA-N 396.541 5.024 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(Cl)c1Oc1cccnc1)c1ccccc1 536243759 KINPLPNKMGZGQY-INIZCTEOSA-N 378.859 5.826 30 20 GKED CC[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(F)cc(Br)c1 540607107 OCJKCQFIJNQXRO-RBUKOAKNSA-N 375.285 5.674 30 20 GKED C[C@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 541086611 YLVLYHWRBIRROU-KRWDZBQOSA-N 397.453 5.870 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 541157845 OMNAYDZRLOPONK-QGZVFWFLSA-N 387.458 5.267 30 20 GKED C[C@H](NC(=O)N1CCc2ccsc2C1)c1ccc(-c2cccc(C#N)c2)cc1 541159129 SUFMHKFQUAPECY-INIZCTEOSA-N 387.508 5.116 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N[C@H](C)c1ccc(C#N)cc1 542934156 HFHATGDEGPMHIW-GFCCVEGCSA-N 399.372 5.032 30 20 GKED C[C@H](NCc1cn2cc(Cl)ccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 543874283 NIMCNBDZXDTIBW-INIZCTEOSA-N 386.886 5.377 30 20 GKED C=CCOc1ccccc1CN[C@H](Cc1cccnc1)c1ccc(Cl)cc1 546166694 PYQKUZBJHKWCGY-JOCHJYFZSA-N 378.903 5.373 30 20 GKED N#CCC[C@@H](NC(=O)NCCCCc1ccc(Cl)s1)c1ccccc1 551292536 YQIXMQBEMHQKEV-QGZVFWFLSA-N 375.925 5.068 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C(F)(F)F)ccc1C 554224618 PDOBAPSMZNAKTP-UHFFFAOYSA-N 394.441 5.401 30 20 GKED Cc1nc(-c2cccnc2)sc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 556198723 WLMHVSMIJRXOSK-JXFKEZNVSA-N 376.529 5.599 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(-c2ccc(OC)c(OC)c2)n1 560670962 ZBBDQRLGJXDUSC-UHFFFAOYSA-N 380.513 5.016 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@@H](C)C3)c1C1CC1 569553161 BCVMPNGZJQYZCQ-CHWSQXEVSA-N 382.533 5.042 30 20 GKED N#CCC1CN(C(=O)c2ccc(CSc3cc(Cl)ccc3Cl)cc2)C1 598042431 RMAVJUGCCGNDTN-UHFFFAOYSA-N 391.323 5.271 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 604508965 JXYFINPNDGGTGI-UHFFFAOYSA-N 392.484 5.060 30 20 GKED CCCN(C(=O)c1ccccc1Br)c1cc(Cl)ccc1C#N 609286550 RPFWLORLXHHEFG-UHFFFAOYSA-N 377.669 5.031 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609378806 SCKACXQPWFRRMY-UONOGXRCSA-N 391.323 5.741 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](C)c2ccccc2F)cc1 609426369 VCIWBSPRRAWZRS-HNNXBMFYSA-N 390.414 5.240 30 20 GKED N#Cc1ccccc1COc1cccc(CNC2(c3ccc(F)cc3)CCC2)c1 609433376 WPJDNQDDRAIIJD-UHFFFAOYSA-N 386.470 5.445 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 609816334 HTDGTHDBTVYTRS-CQSZACIVSA-N 390.314 5.546 30 20 GKED C[C@H](NC(=O)NCc1ccc(C#N)cc1)c1ccccc1-c1ccc(Cl)cc1 610090298 ZBXIWWDLNJEQKU-INIZCTEOSA-N 389.886 5.439 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c(Cl)c1 610877391 KRLNEZLOLRKPPF-MRXNPFEDSA-N 378.863 5.104 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611851662 DDHLMACOXZKJPB-QZTJIDSGSA-N 384.483 5.050 30 20 GKED N#Cc1cc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1C(F)(F)F 613272381 QATUCMBUYRVSLA-NXEZZACHSA-N 390.249 5.144 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1Cc1ccccc1 615471932 KYQHHHXEDGQMML-UHFFFAOYSA-N 386.495 5.506 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)s1)c1nc(-c2ccccc2)cs1 671751502 VLUXFFPJRVYZBQ-NSHDSACASA-N 378.400 5.380 30 20 GKED CC(C)c1ncc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 676498560 VRYYYMQAWNWBEZ-JTQLQIEISA-N 395.431 5.385 30 20 GKED Fc1cc(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)cc(F)c1C(F)(F)F 685404697 PNUSRLCMSSPHKX-UHFFFAOYSA-N 395.209 5.114 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c[nH]c2c1 726141650 HWPFACMYKNHFCS-HSZRJFAPSA-N 379.463 5.313 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2)Cc2ccc(OC)cc2)c1 726481319 BCODWQLFTLKOCO-UHFFFAOYSA-N 386.520 5.076 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(CC(C)C)nc2C)cc1 727954898 VUHPWJXQDXSOIP-KBXCAEBGSA-N 397.544 5.125 30 20 GKED C#Cc1cccc(N(C(=S)Nc2ccc(OC(F)(F)F)cc2)C(C)C)c1 728227112 VZLZVAKMXODFFB-UHFFFAOYSA-N 378.419 5.178 30 20 GKED Cc1ccc(N(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)C(C)C)cc1 731030159 LKSGWWGDHUKYJA-SFHVURJKSA-N 381.545 5.243 30 20 GKED C[C@@H](NC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 731320116 TZHPDMXVRJHFFX-CQSZACIVSA-N 379.510 5.460 30 20 GKED COc1ccc(/C=C2/CSc3c(Cl)cccc3C2=O)cc1OCCCC#N 731939951 YQYKFXBCIYKGRJ-PTNGSMBKSA-N 399.899 5.403 30 20 GKED CCCCc1ccc(NC(=O)NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)cc1 733616384 ROMUFVXIRALCCO-HXUWFJFHSA-N 395.503 5.040 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)cc2F)cc1C#N 741942898 IPEXASPLGUBQEN-UHFFFAOYSA-N 375.790 5.142 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 743199016 QHUOKYOCCKFFEA-CYBMUJFWSA-N 394.368 5.081 30 20 GKED COc1cc(/C=C\C(=O)c2c(C)nn(-c3ccccc3)c2C)ccc1SC 746346252 NOUILFMAWRAFCN-BENRWUELSA-N 378.497 5.116 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2nc(C)c(C)s2)cc1OCC 755940094 NALRJHMWLMJMDE-UHFFFAOYSA-N 382.913 5.152 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(\Cl)c2nc3cc(C(F)(F)F)ccc3o2)cc1 764434755 ZBHDTAHMTBMZPX-SHLUWWQESA-N 392.764 5.874 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc4[nH]ccc4c3)n2)cc1 765938611 ZABPQRQOHIKKFY-VZJZHNIPSA-N 399.475 5.190 30 20 GKED C#CC[C@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 773117246 USZDIZSOAQCIEZ-DYVFJYSZSA-N 381.369 5.305 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2cc(OC)c(OC)cc2OC)cc1 777701424 FSIVQNPCTLHVCQ-CQSZACIVSA-N 377.868 5.017 30 20 GKED C#CCCCCCC(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 780322345 LVUDMSQQIZKXFT-JOCHJYFZSA-N 388.511 5.008 30 20 GKED N#CCCCCOC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 792302708 GWKWTYCUVVLILM-UHFFFAOYSA-N 382.410 5.283 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc(C#N)c(F)c1 794982287 VJGYEBJAJVRAER-UHFFFAOYSA-N 399.351 5.009 30 20 GKED COc1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)cc1C 797614103 SUOYUZBNJGMDBR-OAQYLSRUSA-N 385.467 5.612 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCCc3c2[nH]c2ccccc32)ccc1OC 808705863 UXMFJOCZIGRRJI-UWJYYQICSA-N 389.499 5.025 30 20 GKED N#C[C@@H](C(=O)C1(c2cccnc2)CCCC1)c1nc2cc(Cl)ccc2s1 808978176 FPHHGBGTTAMHSF-HNNXBMFYSA-N 381.888 5.033 30 20 GKED N#C[C@@H](C(=O)C1(C(F)(F)F)CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 842287812 BPTCIDJYWGTUJE-ZDUSSCGKSA-N 398.837 5.762 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC[C@@]3(C2)CC3(F)F)cc1 846574154 WEEAWMBGIUUMPJ-NRFANRHFSA-N 398.478 5.112 30 20 GKED COc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1OCc1ccncc1 848528087 KDNPUPUTKJFNKG-UHFFFAOYSA-N 387.483 5.082 30 20 GKED CC(C)CN(Cc1cccc(C(F)(F)F)c1)C(=S)Nc1ccccc1C#N 863207307 UTLPJMKDAQLNFX-UHFFFAOYSA-N 391.462 5.432 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(N2CCCCC2)cc1 915985695 YIFNNWWYZGPSQY-XFXZXTDPSA-N 375.497 5.092 30 20 GKED CCCC(=O)Nc1ccc(O)c(C(C)=NNc2ccc(Cl)c(Cl)c2)c1 916249682 GAJIHKSPXUWLAG-UHFFFAOYSA-N 380.275 5.274 30 20 GKED Cc1cccc(C=Nn2c(C)nc3scc(-c4ccc(Cl)cc4)c3c2=O)c1 916272896 NFEDYUUZTIKBRA-UHFFFAOYSA-N 393.899 5.277 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 916847991 ZXZCWRISSYLPGK-DOTOQJQBSA-N 378.497 5.372 30 20 GKED Cc1c(O)ccc2c(CNc3ccc(Oc4ccccc4C#N)cc3)cc(=O)oc12 920061943 MZIMTVFTAJULDN-UHFFFAOYSA-N 398.418 5.083 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3c[nH]c4cc(Cl)ccc34)c(Cl)nc21 920068209 LMTXNAVOOYJIQV-UTCJRWHESA-N 399.281 5.696 30 20 GKED Brc1ccccc1C=NOCc1csc(-c2cccs2)n1 920398747 AKXQZZVHKWVOLD-UHFFFAOYSA-N 379.304 5.185 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NN=C(c1ccccc1)c1ccccc1 1776012750 MQGJKHSIBDHLEL-UHFFFAOYSA-N 382.463 5.353 30 20 GKED O=C(O)c1cc(NN=Cc2cc(C(F)(F)F)ccc2Cl)ccc1Cl 1776033693 SJYFYBCWLOIPHU-UHFFFAOYSA-N 377.149 5.156 30 20 GKED O=C(O)Cc1ccc(NN=C(CCCc2ccccc2)c2ccc(F)cc2)cc1 1776085154 QIQUXIJQMRZMAG-UHFFFAOYSA-N 390.458 5.292 30 20 GKED N#Cc1ccc(C(=O)O)nc1/C=C\c1sc(Sc2ccccc2)nc1Cl 1777566609 VSCAFPOLDSIJFK-HJWRWDBZSA-N 399.884 5.083 30 20 GKED C=CCn1c(SCC(=O)c2ccc(C(C)C)cc2)nnc1-c1ccoc1C 21277388 PEDVLPNZEZFIJQ-UHFFFAOYSA-N 381.501 5.131 30 20 GKED Cc1c(C#N)c(S[C@@H](C(=O)Nc2ccccc2Cl)C(C)C)nc2c1CCC2 32328295 AWMUDIHTXLMNSN-LJQANCHMSA-N 399.947 5.159 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)Nc3sc4c(c3C#N)CCCC4)o2)cc1 41020331 UPMQWQJUCDZNHK-UHFFFAOYSA-N 391.496 5.033 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCCCC2)c1nc2ccccc2n1C(F)F 41558503 AANOYOVRXNCCMI-CYBMUJFWSA-N 385.439 5.252 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 102796667 MSXLKSLZYCFGEB-UHFFFAOYSA-N 389.455 5.093 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2cccc(-c3ccccc3)c2)cs1)C1CC1 114991641 HYCLTWGVQKUWSQ-JLHYYAGUSA-N 388.492 5.222 30 20 GKED C=C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 120017969 WFBSRSHVJUPFNI-JXFKEZNVSA-N 388.492 5.355 30 20 GKED N#C[C@@H](C(=O)C1CCC(F)(F)CC1)c1nc(-c2c(F)cccc2F)cs1 120908345 VQKPEUHRPKIRFI-NSHDSACASA-N 382.382 5.090 30 20 GKED Cc1n[nH]c(C)c1[C@@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 131372397 JUQPUKXGKGGMFA-GFCCVEGCSA-N 394.862 5.086 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C(F)F)c3)n2)cc1 171569544 OCQWTVQRKGKONN-INIZCTEOSA-N 379.391 5.109 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 171698901 CGXFCCPSYAZHTD-SFHVURJKSA-N 376.456 5.017 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl)c1ccccc1 187390932 FRLHKGDUGXVFCY-IBGZPJMESA-N 398.934 5.509 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 189891720 GSSHSDBDZKJPMT-OAHLLOKOSA-N 384.501 5.566 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 303362744 QGMVRSPVUDKMAI-SJORKVTESA-N 396.556 5.784 30 20 GKED CC(C)=CCOc1cccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 304030865 MTBBMPSFVUHSQR-KRWDZBQOSA-N 380.513 5.536 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCCC(=O)c1ccc(F)cc1 426996259 YVFDHDJKQMTRBL-INIZCTEOSA-N 398.503 5.602 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 430589473 IBLLSEBWXGIGHN-AWEZNQCLSA-N 381.526 5.363 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 430611481 OTUFLISKCZBXJL-HNNXBMFYSA-N 395.553 5.286 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)NCc3cc(C#N)ccc3F)c2)C1 438093098 CAZCBKHKNQICDX-KKSFZXQISA-N 395.478 5.114 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cc(Cl)c(Cl)cc3F)CC2)cc1 439964769 ZLEMSPHRRMUJPH-UHFFFAOYSA-N 390.245 5.325 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(CCC(F)(F)F)cc2)cc1OC 439989407 MODRTUQHEFCETB-UHFFFAOYSA-N 379.378 5.007 30 20 GKED CCc1c(C)sc(NC(=O)c2c(Br)sc(C)c2C)c1C#N 440475542 FTDZKLRPOGENKQ-UHFFFAOYSA-N 383.336 5.184 30 20 GKED Cc1cc(NC(=O)c2cccnc2)ccc1OCc1ccccc1C(C)(C)C#N 442121720 DVWZFCPJQWXPCP-UHFFFAOYSA-N 385.467 5.023 30 20 GKED COc1ccc(C#N)cc1CNC(C)(C)c1nc(-c2ccccc2F)c(C)s1 451163099 BXCLAOIXNJBLHO-UHFFFAOYSA-N 395.503 5.163 30 20 GKED Cc1sc([C@@H](C)NC(=O)NCC(C)(C)CC#N)nc1-c1ccc(Cl)cc1 458532825 UKSOEPPTDAULOG-GFCCVEGCSA-N 390.940 5.072 30 20 GKED CCCN(C(=O)c1ccc(C#N)cc1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 461536522 NHAIAILSEBCBAG-QHCPKHFHSA-N 387.458 5.043 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)[C@H](C)c2cccc(C#N)c2)c1 463940219 CMYDABSEDGWRMR-CYBMUJFWSA-N 378.419 5.263 30 20 GKED C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccccc2)cs1 475753434 HCCLJKATRQQHHL-OAHLLOKOSA-N 375.497 5.102 30 20 GKED COc1cc(CSc2ccccc2O)ccc1OCc1cccc(C#N)c1 476481427 LYFISJIYCPUADB-UHFFFAOYSA-N 377.465 5.144 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1C)[C@H](C)c1cccc(C(F)(F)F)c1 476845901 JOZFBQZIEFCFNZ-CQSZACIVSA-N 375.394 5.501 30 20 GKED Cc1c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)csc1Br 484126586 GKCJWANMWHGDKY-UHFFFAOYSA-N 383.336 5.302 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)c3cc(-c4cccc(C#N)c4)no3)cc2s1 484704127 QOYKNFYHSDKZLF-UHFFFAOYSA-N 394.843 5.037 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2ccc(Cl)c(C#N)n2)nc1-c1ccccc1 486931018 SMTYALMBBMARHX-GOSISDBHSA-N 392.890 5.727 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cnn(CCC(C)C)c1C(C)C 487633475 LHGMBDVDNMMMRE-UHFFFAOYSA-N 386.515 5.412 30 20 GKED CCc1cc(C)c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)o1 494832084 IZFQWTKHIWVETD-UHFFFAOYSA-N 382.407 5.427 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)o1 505354175 UYRMVEFPFSLQQP-BIGNBACZSA-N 398.462 5.048 30 20 GKED O=[N+]([O-])c1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)c(F)c1 505901108 MSRUAAKGUKRHOS-AWEZNQCLSA-N 396.262 5.146 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)CSc2ccccc2)cc1 512327724 HLBIVLRTZDTINO-UHFFFAOYSA-N 390.483 5.018 30 20 GKED C=CCN(C(=O)C12CC3CC(CC(C3)C1)C2)c1nc(-c2ccccc2)cs1 515327685 TYAWUOFSFFDXDY-UHFFFAOYSA-N 378.541 5.546 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517655902 DNNQOCFRINEDML-UHFFFAOYSA-N 392.842 5.459 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc(-c2ccncc2)cs1 517891571 RMEZYQVHDOCUKP-FQEVSTJZSA-N 387.508 5.743 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2)c1 518728356 KGSSBDABPRBIKJ-UHFFFAOYSA-N 399.362 5.257 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Cl)cc1Cl 519516602 SQLMFPWQJHXEFJ-LBPRGKRZSA-N 379.312 5.569 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1F 520923429 MPETWNXFPFRUED-YWZLYKJASA-N 392.861 5.877 30 20 GKED N#Cc1cccc(OCCCCC(=O)NC2c3ccccc3Oc3ccccc32)c1 521969375 NTKQOTPKHTUFRY-UHFFFAOYSA-N 398.462 5.119 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccccc1F 522572261 MICHZKJOMDINEM-UHFFFAOYSA-N 394.833 5.810 30 20 GKED COc1ccc(CCCN(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 523158171 PCMVPGIHHUGULH-UHFFFAOYSA-N 399.494 5.015 30 20 GKED CN(C(=O)c1ccc(CC#N)cc1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 534039015 GRWQBUBHAFGWMT-QFIPXVFZSA-N 392.861 5.407 30 20 GKED Cn1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(-c2ccccc2)n1 538965300 XEKZWHBSBOKJBK-UHFFFAOYSA-N 394.434 5.003 30 20 GKED N#CC1(c2ccc(C(=O)Nc3nc(-c4ccc(Cl)cc4)cs3)cc2)CC1 539594383 PZWRQCCDHWKATR-UHFFFAOYSA-N 379.872 5.271 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)C23C[C@H]4C[C@@H](CC(F)(C4)C2)C3)cc1 540200881 OWEQYRRDVYTVBN-WWVRUBFXSA-N 388.486 5.150 30 20 GKED N#Cc1ccc(CN(C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2Cl)C2CC2)cc1 541384453 UGOGHQPXLMNQFR-ZWKOTPCHSA-N 385.294 5.160 30 20 GKED COc1ccc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543034541 OBMLEPSBRGNFDK-MSOLQXFVSA-N 386.495 5.654 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)CC1 543821651 PPDOHNYLRYVOMY-QHCPKHFHSA-N 375.516 5.086 30 20 GKED Cn1ccc([C@@H](Nc2ccc(C(F)(F)F)cc2C#N)c2ccc(Cl)cc2)n1 545163129 CAAPSNWUDXHOFP-SFHVURJKSA-N 390.796 5.165 30 20 GKED C[C@@H]1CC(CCNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C[C@@H](C)O1 548974214 LNURUHCGCYZPBS-IAGOWNOFSA-N 393.487 5.066 30 20 GKED C=CCC[C@H](NC(=O)[C@@H]1CCCc2cccnc21)c1ccc(C(F)(F)F)cc1 551611220 XBVPIUCUJJOTFQ-MOPGFXCFSA-N 388.433 5.344 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 563029857 VVFUJEMULIKFNJ-IFMALSPDSA-N 398.934 5.532 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 564579563 BRAUJRLUZGNVNH-UHFFFAOYSA-N 382.479 5.237 30 20 GKED N#CCCC1CCN(C(=O)[C@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)CC1 567947904 ZIHGVLASRIFKJZ-SXWKCWPCSA-N 384.951 5.231 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@](C)(C#N)C3CCCCC3)o2)c(C)c1 572554240 QJVJWTHSYLCYNO-HSZRJFAPSA-N 380.488 5.068 30 20 GKED CC(C)c1ccc(NC(=O)N(C)CCOCc2ccc(C#N)cc2)c(C(C)C)c1 573955623 GZAORWDPPIAOPE-UHFFFAOYSA-N 393.531 5.486 30 20 GKED COc1ccc(CN(C(=O)CCCCCC#N)[C@H]2CCCC[C@@H]2C)cc1OC 588953911 OOABNQXFTJDTFI-ICSRJNTNSA-N 386.536 5.085 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN1Cc2cccc(C#N)c2C1 593127340 NTQWHTHFQQIIGW-UHFFFAOYSA-N 395.934 5.071 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N1CCC[C@@H](CC#N)C1 596724495 YUTWQMFSBSJNPL-KRWDZBQOSA-N 397.906 5.385 30 20 GKED Cc1cccc(N[C@@H](C)c2cccc(C#N)c2)c1C(=O)NCCc1ccccc1 600849504 OJSWAOPISGRTDW-IBGZPJMESA-N 383.495 5.012 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3csc(-c4ccccc4)n3)cn2)cc1 603763880 AKXOCNXLGOZZDL-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1csc(C(C)C)n1 609060744 LWRDIFCOXMYYCK-UHFFFAOYSA-N 391.496 5.278 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c(F)c1 609252612 CRHAKJXLWROGFX-IBGZPJMESA-N 399.878 5.001 30 20 GKED CCN(CC#N)C(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 609298945 VFTMDSWYYTXJEK-KRWDZBQOSA-N 379.312 5.199 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)sc2ccc(F)cc12 609460315 WFBGHDNYJDUZHQ-OAHLLOKOSA-N 392.377 5.362 30 20 GKED Cc1nc2ccc(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)cc2o1 609498331 AQPAZBKDRHZZDO-UHFFFAOYSA-N 383.407 5.247 30 20 GKED N#CCn1c(C(=O)Nc2nc(/C=C\c3ccccc3)cs2)cc2ccccc21 609757352 XHVVHOUGLRMLQG-KHPPLWFESA-N 384.464 5.044 30 20 GKED Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)CSCc2ccc(C#N)cc2)cc1 609979867 ZUBWBAAYHJOUOO-FDDCHVKYSA-N 378.541 5.100 30 20 GKED Cc1cc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)ccc1NC(=O)CC(C)C 610226950 WHXLUUHKXXOIAU-UHFFFAOYSA-N 391.515 5.154 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)c1cc2ccccc2n1CC#N 610472011 RNAWGVMQUBFFBJ-UHFFFAOYSA-N 375.472 5.041 30 20 GKED COc1ccc2[nH]c(NC(=O)c3ccccc3Sc3ccccc3C#N)cc2c1 617862636 DRLCAWVLKFPZMC-UHFFFAOYSA-N 399.475 5.452 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2c(Cl)ccc(Cl)c2Cl)CC1 619726162 KJONBPUKDDUURV-UHFFFAOYSA-N 380.706 5.099 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)cc1Cl 619767183 CHZHLJIBIIHWTH-LJQANCHMSA-N 399.878 5.001 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@@]1(c1c[nH]c2ccccc12)C(F)(F)F 622981042 QYTUALSURDKVNI-HXUWFJFHSA-N 376.422 5.316 30 20 GKED CCCOc1ccc(Cl)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726468179 CUEJCPLMXARVIG-UHFFFAOYSA-N 380.300 5.463 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2ccc(OCCC(C)C)c(OC)c2)c1 726469788 RWPBSWVBVNAMSW-KRWDZBQOSA-N 396.556 5.149 30 20 GKED COc1ccc(CCCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 727628536 KKFKMEKWSQCSRT-SFHVURJKSA-N 378.497 5.284 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1ccc2ccccc2n1 727952842 TUOJHGKHHHNACY-OOZJCBPQSA-N 382.463 5.446 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCCCOc1ccccc1 729147435 BFDFQSCFQMPRPY-UHFFFAOYSA-N 396.922 5.042 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417790 SOXMRIBQLLSAPL-JXFKEZNVSA-N 398.528 5.570 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN2CCCc3sccc3C2)c1=S 730455503 UKNXFNWCHMEZND-UHFFFAOYSA-N 396.585 5.043 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@H](C)c2c(Cl)cccc2Cl)c1 733775160 RFPBVAMSNSHBDU-HIFRSBDPSA-N 391.298 5.094 30 20 GKED O=C(/C=C/c1nccc2ccccc12)c1ccc(-c2ccccc2[N+](=O)[O-])s1 740764968 LQYVCDIPXGEOIB-MDZDMXLPSA-N 386.432 5.768 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2nccn2Cc2ccccc2)cc1 741470771 VGXATXMHVZYLOX-FOCLMDBBSA-N 394.474 5.503 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)CCOc3ccccc3)n2)cc1 745948375 YXSSKPRYCUQFQV-XLIONFOSSA-N 390.508 5.400 30 20 GKED O=C(/C=C/c1ccc(O)c(Br)c1)c1ccc(-c2ccncc2)cc1 745989850 CQFKJWSTYGISBV-LREOWRDNSA-N 380.241 5.113 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)O[C@H](c3ccccn3)C(F)(F)F)c2)cc1 747353288 DBRRCZTVVNUOKV-LJQANCHMSA-N 398.340 5.206 30 20 GKED C[C@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccc(C#N)cc1 761762091 IPMQNWBZBGZPBZ-LBPRGKRZSA-N 384.407 5.537 30 20 GKED C#CCOc1ccc([C@H](C)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 764775399 VOUFGVQSUXKGNS-NWANDNLSSA-N 393.371 5.259 30 20 GKED COc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1F 771241600 AULIAFGYFCBCHE-HNNXBMFYSA-N 389.430 5.256 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2C[C@@H](C)c3c(Br)cccc32)c1 772986498 XSLCSKVWUVGQNQ-AKCHCHLHSA-N 399.332 5.468 30 20 GKED CC(C)(C#N)CCOC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 776378770 HXEZSSNZLDRSBV-UHFFFAOYSA-N 379.243 5.277 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cnc1N1CCCC[C@@H]1C 779726094 UECKBHISEFOCSE-AWEZNQCLSA-N 399.951 5.103 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1ccc(C#N)cc1F 781108804 SWVKPISQBLTXRD-KTKRTIGZSA-N 393.849 5.109 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC=C(c4ccccc4)C3)cc2)c1 782572928 JSFWYYKHPDIVEI-UHFFFAOYSA-N 381.435 5.282 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O 788694913 XLKSAHMEZICGBX-BONVTDFDSA-N 395.318 5.894 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(COC(=O)C[C@H](CC#N)c2ccccc2)c1 795987157 UBJDBUULDZYMBL-IBGZPJMESA-N 394.471 5.164 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CSCc2ccc(Cl)cc2)s1 797569126 NKKYWFYFHVVFEC-AWEZNQCLSA-N 378.950 5.204 30 20 GKED C=C(CNC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 806280472 FKJMHTYXWAKYDC-UHFFFAOYSA-N 385.439 5.008 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1csc2ccccc12 814298217 FVEZHNHKEKXFJG-OXQOHEQNSA-N 377.513 5.697 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 814577836 TUBOPLHTFHVNCZ-XMMPIXPASA-N 383.495 5.623 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC(F)F)c(F)c2)cc1 815010603 LYCHTMXTZGAWNU-GOSISDBHSA-N 396.368 5.335 30 20 GKED O=C1/C(=C\c2csc(-c3ccccc3)n2)CC/C1=C\c1cccc([N+](=O)[O-])c1 818246334 SRHHCMDSYXVPEW-JAFZKPNWSA-N 388.448 5.548 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1ccc(F)c(F)c1 916127564 JSCHODFTJVAOKN-PKNBQFBNSA-N 387.389 5.109 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1ccc(Cl)cc1 916333082 CIBMYQVEEAJEKB-UHFFFAOYSA-N 383.691 5.076 30 20 GKED N#C[C@H](C(=O)COc1ccc(Cl)c2ccccc12)c1nc2ccccc2s1 916846396 SMFWHGNTLFOGKV-OAHLLOKOSA-N 392.867 5.358 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2)cc1 917119610 OMQVDRROPBAESB-JOCHJYFZSA-N 377.447 5.589 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1cc(Cl)nc(Cl)c1 918584148 HIDZPZZNGFZLPO-UHFFFAOYSA-N 382.250 5.107 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1c[nH]c2ccccc12 918712333 JQDITMZRMOGHPC-YFHOEESVSA-N 394.883 5.753 30 20 GKED O=C(/C=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccccc1Cl 1776115390 XFCVEUNCFIHPMH-DGXIYAMASA-N 392.838 5.441 30 20 GKED CCc1cccc2cc(/C=C\C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)oc12 1776977829 OCBRKCUNXYEPOL-KHPPLWFESA-N 386.403 5.850 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc(OC3CCCC3)c1)C2=O 1777683109 QYPGZPKAHCGJOU-QGOAFFKASA-N 376.452 5.309 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1OC(F)F 25300867 WGEQKMTZPMLVRU-OAHLLOKOSA-N 392.405 5.318 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1nc2ccccc2o1 51899921 ZIZJCJHTDWUIDR-LBPRGKRZSA-N 379.828 5.095 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1cccc(OCCCC#N)c1 55569522 QALBFPBNIYDIHZ-UHFFFAOYSA-N 395.459 5.193 30 20 GKED CN(C(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccc(F)cc1 64300417 VMIQAKZAXHKBHT-UHFFFAOYSA-N 376.456 5.266 30 20 GKED CC(=O)c1csc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 106632156 DWYQBNOVXWOCQE-UHFFFAOYSA-N 376.437 5.175 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)Nc2ccc(C(C)(C)C#N)cc2)s1 113539783 ZZXWOWUNHVGKTG-UHFFFAOYSA-N 393.512 5.685 30 20 GKED Cc1ccsc1[C@@H]1C[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 129595416 SQQWGSOLUNTMQL-BRWVUGGUSA-N 389.505 5.032 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)c(F)c1 158274840 CFMGCFWTAHIAEV-UHFFFAOYSA-N 397.812 5.354 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2csc(-c3c(F)cccc3F)n2)n1 177760605 INMZDPRSBXUPAQ-JTQLQIEISA-N 389.452 5.158 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1C[C@H]2CCC(=O)c3cccc1c32 184390891 XVQCSPAEBQVHMZ-QGZVFWFLSA-N 394.430 5.071 30 20 GKED Cc1ccc(NC2=NC(=O)/C(=C\c3cccc(OCCCC#N)c3)S2)c(C)c1 207613612 ZPQDTJRIQCTPMB-XSFVSMFZSA-N 391.496 5.068 30 20 GKED Sc1nnc(-c2ccccc2)n1N=Cc1ccc(-c2ccc(Cl)cc2)o1 254853983 KMHBRMILGHYRBX-UHFFFAOYSA-N 380.860 5.029 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC(C)(C#N)CC1 272449436 AQAPBUGMPDEIPO-GOSISDBHSA-N 377.488 5.293 30 20 GKED OC1=Nc2cc(/C(O)=N/C[C@H]3SCCc4ccccc43)ccc2SCC1 330194335 ZAKWFKBOFKOPCG-GOSISDBHSA-N 384.526 5.106 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1 431722378 LYLVVKZLTHKOEC-KRWDZBQOSA-N 377.366 5.142 30 20 GKED C[C@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N(C)CC(C)(C)C#N 433327412 SPXJUUCITOWPPQ-MRXNPFEDSA-N 380.923 5.281 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1nc2ccccc2s1)c1ccccc1 435109741 FCDILWQBGOUOOM-AEFFLSMTSA-N 379.529 5.706 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3ccc(Oc4ccc(Cl)cn4)cc3)CC2)c1 435358618 QWNFDVSDMRKICT-UHFFFAOYSA-N 389.842 5.069 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 435610995 OPZMOBZZGRXOCW-FQEVSTJZSA-N 381.501 5.100 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(ccc3ccccc32)[nH]1 436336406 VQTFLVNELVHHRB-QPPBQGQZSA-N 379.463 5.233 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Br)c(Cl)c1)c1ccccc1 439486398 LRQPXFLBWMKXEA-INIZCTEOSA-N 392.684 5.269 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 448521098 PUUVBDMJICAHFK-UHFFFAOYSA-N 380.806 5.704 30 20 GKED CC[C@@H](CNc1ccccc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 454747941 ALMZMMXMHYXQMQ-IRXDYDNUSA-N 382.533 5.093 30 20 GKED COc1cccc([C@@H]2C[C@H](C)CN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458799703 JTSYJDDNHILJAL-TZYHBYERSA-N 391.515 5.223 30 20 GKED N#Cc1cc(N[C@H](c2ccccc2)c2ccc(F)cc2)nc2ccc([N+](=O)[O-])cc12 462375873 GJKCSNCVIBLSEE-HSZRJFAPSA-N 398.397 5.355 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1-c1ccccc1 464416043 DZKKVBVYVLLOLI-MRXNPFEDSA-N 398.388 5.035 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC[C@H]2c2cccnc2)cc1 464858584 VBRRYKMRQDFRJQ-QFIPXVFZSA-N 383.451 5.031 30 20 GKED Cc1ccc2c(CCC(=O)N(Cc3ccco3)c3ccccc3C#N)c[nH]c2c1 466993218 JVRSOQUQMZQAKZ-UHFFFAOYSA-N 383.451 5.107 30 20 GKED CC[C@@]1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)C1 467859442 SDRJPMIRDACNHX-QFIPXVFZSA-N 379.460 5.013 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 469665169 MEJXBFCRJMYVLL-PKOBYXMFSA-N 383.879 5.042 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1 475567195 CHRQZCXIOIUNCF-FYYLOGMGSA-N 377.532 5.105 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCOC)[C@@H](C)c1ccccc1 475576257 VMCAPVKZCLGOTQ-IBGZPJMESA-N 380.532 5.780 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 476318122 HGGPXWOGIMJVET-WZONZLPQSA-N 389.886 5.028 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 477712755 SUJUNSHCJFZROW-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CC(C)(C#N)CCCSCc1csc(COc2ccc(Cl)cc2)n1 480366913 VMTFDEGURGQFSX-UHFFFAOYSA-N 380.966 5.939 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(F)cc1OC(C)C 480712672 CGRRDNXNQQNIJT-UHFFFAOYSA-N 388.487 5.001 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@H](C)Sc1ccc(C(C)C)cc1 481492487 HHALNFYIMXZKMI-KRWDZBQOSA-N 382.529 5.246 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](c1ccccc1)C(C)C 482815984 HFSQPNZZTIMOLT-JOCHJYFZSA-N 399.494 5.822 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 487866298 CAVYAVKSIBHMLQ-QGZVFWFLSA-N 395.465 5.001 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccccc1 488655568 ZWDICDNPWZMYPX-GOSISDBHSA-N 395.396 5.402 30 20 GKED N#Cc1ccc(NCc2nnc(-c3c(Cl)cccc3Cl)o2)c(Cl)c1 489742856 UPYSDVVNWKSRPI-UHFFFAOYSA-N 379.634 5.181 30 20 GKED N#C[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccc1Cl 499951800 OQNAAGWPYNNEAJ-ZDUSSCGKSA-N 395.698 5.856 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccc(F)cc2)cc1C 511288368 ULAXWHPQFHIWDA-UHFFFAOYSA-N 377.463 5.424 30 20 GKED C[C@@H](Cn1ccc2ccccc21)C(=O)Nc1ccccc1SC[C@H](C)C#N 511878288 XPNIQPHSDJMCMU-SJORKVTESA-N 377.513 5.168 30 20 GKED CC(C)[C@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 513709645 JMCRJRSCGGCNTR-XMSQKQJNSA-N 378.472 5.130 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(CSc2ccc(C#N)cc2)cs1 515605442 AYCLSJFVOZEMDW-UHFFFAOYSA-N 399.928 5.645 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 517483344 ZADAGIOGWWFPHO-ZEQRLZLVSA-N 392.458 5.641 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3[nH]ccc3c2)cc1Cl 518590700 WJNOMYRRLQQNDA-FQEVSTJZSA-N 385.854 5.729 30 20 GKED COc1ccc2nc(C)cc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2c1 538767887 ICLNIVXYXGZZCK-LJQANCHMSA-N 399.475 5.165 30 20 GKED N#Cc1ccc(CNCc2ccc(OCCOc3ccc(Cl)cc3)cc2)s1 539494638 XNOWVQJYUSDWHB-UHFFFAOYSA-N 398.915 5.021 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(=O)OC(C)(C)C)cc1 539940505 KCWPNQXYUCPTBF-OAHLLOKOSA-N 396.512 5.288 30 20 GKED CC[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1c(C)noc1C 541071979 DZGMLRMVJZVXHE-NYHFZMIOSA-N 387.483 5.201 30 20 GKED CC(C)N(Cc1ccco1)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543016277 HCQLFJYDSQNYBQ-GOSISDBHSA-N 387.483 5.499 30 20 GKED C[C@H](Nc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C#N)cc1)c1ccccc1 554679629 UHKNGIXQVOIJCJ-ZWKOTPCHSA-N 385.467 5.137 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 560728939 ZLCFIZUENQBHPI-UHFFFAOYSA-N 390.430 5.394 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 561240216 JUICMGRYALHNQF-LJQANCHMSA-N 395.547 5.011 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@H](NCc1ccc(C#N)c(F)c1)c1ccc(Cl)cc1)C2 574416215 KPJKXVNSHITPEJ-QNWVGRARSA-N 397.925 5.054 30 20 GKED N#Cc1ccc(NC(=O)c2cc(F)c(Cl)cc2Cl)cc1Br 580857654 XFQRVMCGMSARCI-UHFFFAOYSA-N 388.023 5.019 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(F)ccc1N1CCCCC1 588950345 NDXAPQKKWADPCI-UHFFFAOYSA-N 385.458 5.175 30 20 GKED Cc1cc(Br)cc(C)c1N(CC(F)F)C(=O)CCCCCC#N 588957879 CHIDFPZJLRLXCT-UHFFFAOYSA-N 387.268 5.138 30 20 GKED Cc1ccc(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 603673421 UYFKBZQKCGPZOP-OAQYLSRUSA-N 390.870 5.321 30 20 GKED COc1ccc(F)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603673431 XDUQIZQMCXDILE-IBGZPJMESA-N 394.833 5.395 30 20 GKED N#Cc1cc(NC(=O)c2cccnc2SCc2ccc(F)cc2)ccc1Cl 603733018 ONCLSLMFMWSITK-UHFFFAOYSA-N 397.862 5.290 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1 605938837 JRDOTNQEHSQWDO-UHFFFAOYSA-N 384.320 5.076 30 20 GKED CC(C)CCC[C@H](C)n1c(SC[C@H](C#N)CCC#N)nc2ccccc2c1=O 608864467 JGGIJFFVHADKOV-ROUUACIJSA-N 396.560 5.319 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccsc3[nH]2)cc1Cl 609164526 PWEHQYZXRFWXPG-QGZVFWFLSA-N 391.883 5.791 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H]3CCc4ccc(F)cc43)cc2)c1 609433975 UFHGOJJLPNXAFF-QFIPXVFZSA-N 387.414 5.299 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@H]2c2cccc(Cl)c2)c1 609515944 UZRXNELTVRZJNH-NRFANRHFSA-N 382.891 5.124 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccc4ccccc4n3)cc2)cc1 609639142 UKDVKNBSGBJGKW-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@@H]1C 610019094 BJQNCBISMJFUTO-GJZGRUSLSA-N 383.492 5.371 30 20 GKED CC(C)CN(C(=O)c1cc(NC(=O)C(C)C)ccc1Cl)c1ccc(C#N)cc1 610171086 IKYMXJUSJRJPKD-UHFFFAOYSA-N 397.906 5.109 30 20 GKED CC(C)c1c(C(=O)N[C@H](C)c2cccc(C#N)c2)cnn1-c1ccc(Cl)cc1 610364830 YHEXAWCEWWZQRZ-OAHLLOKOSA-N 392.890 5.012 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)C1 612310210 KZTQROFFXYLHOU-OAHLLOKOSA-N 391.846 5.152 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc2cc(Cl)ccc2s1 613407448 TWSMWOBUPGBHPU-GFCCVEGCSA-N 387.247 5.839 30 20 GKED Cc1noc(C)c1NC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646439099 ZEJCUEFEYDCKAC-UHFFFAOYSA-N 399.266 5.225 30 20 GKED Fc1ccc(-c2noc([C@H](C[C@H]3CCCO3)C(F)(F)F)n2)c(C(F)(F)F)c1 650219310 AAMBFFGRJMTUFX-SKDRFNHKSA-N 398.278 5.110 30 20 GKED C=CCC[C@H](NC(=O)Nc1c(C)cnn1CC)c1ccc(C(F)(F)F)cc1 667812443 MSXWKQDBAHALFO-INIZCTEOSA-N 380.414 5.059 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 676591507 MEVUQOMOFNFBBN-SNVBAGLBSA-N 398.768 5.598 30 20 GKED CC(=O)c1ccc(C#N)c(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 680372115 VADUROIMWUIUQH-CHWSQXEVSA-N 378.316 5.082 30 20 GKED CCCCOc1ccc(OC)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726457952 SOUVVKFIUHZDJG-UHFFFAOYSA-N 389.908 5.208 30 20 GKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](C)c1cc2ccccc2o1 726474348 CRTUZTFTFOUBCC-ZDUSSCGKSA-N 383.904 5.738 30 20 GKED CC[C@@H](Cc1ccccc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727935243 SAWJXRPZMCGJCV-LADGPHEKSA-N 383.495 5.485 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(C3SCCCS3)cc2)C(C)C)c1 728247431 DGDXVSHILMRTRJ-UHFFFAOYSA-N 381.566 5.592 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(/CCCC(=O)O)c2nc3ccccc3s2)cc1 728699695 IMSFRCOMTDPZDN-SUCHYCSPSA-N 392.480 5.383 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2CCc3ccccc3C2)cc1 732536216 FGIQQIGXADFKLV-KBMIEXCESA-N 380.491 5.476 30 20 GKED Cc1c([C@@H](NC(=O)Nc2cccc(OCC#N)c2)C(C)C)oc2ccccc12 732696450 IIFGXWSKVFXEDT-FQEVSTJZSA-N 377.444 5.162 30 20 GKED C=CC[C@@H](NC(=O)NCC1(Sc2ccccc2)CCCC1)c1ccncc1 734669282 RXWSXMYNVKPVMG-HXUWFJFHSA-N 381.545 5.103 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)nc1)c1ccc(SCC(F)F)cc1 741843131 NPYOJRKNKUAALX-IZZDOVSWSA-N 382.435 5.397 30 20 GKED FC(F)(F)c1ccc(CON=Cc2ccc(OCc3ccncc3)cc2)cc1 746576397 NCASTJASWPQRKF-UHFFFAOYSA-N 386.373 5.230 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC[C@H](C)c3ccccc3)n2)cc1 750328130 JDWHYYRTBXUTSP-OXJNMPFZSA-N 390.508 5.579 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1Br)c1nc2ccccc2s1 766238105 PJOYXWYIWIOCCN-CQSZACIVSA-N 399.313 5.258 30 20 GKED Fc1ccc(CC=Nn2cnnc2SCc2ccc(Cl)cc2)c(Cl)c1 766429780 DVBXVUGKXLXAEU-UHFFFAOYSA-N 395.290 5.093 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCCc3sccc32)cc1 767582729 CVWMJWQQIRZNDD-LEWJYISDSA-N 387.508 5.603 30 20 GKED Oc1cc(OCc2ccccc2)ccc1C=NOc1ccccc1C(F)(F)F 783861241 COPKDRBRGRCHSW-UHFFFAOYSA-N 387.357 5.403 30 20 GKED N#C[C@@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1nccc2ccccc12 792094773 GQYJFYUXZUXWLH-INIZCTEOSA-N 391.883 5.307 30 20 GKED Cc1ccc(-c2nnc([C@H](C)OC(=O)C[C@H](CC#N)c3ccccc3)o2)cc1C 795982893 JBVBJWWDOUEHOE-HKUYNNGSSA-N 389.455 5.045 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2cccc(C)c2s1 808980234 XGZDKDMSXNFBSW-GOSISDBHSA-N 390.508 5.296 30 20 GKED CO[C@@H]1CC[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 850765149 UFJGPKUMTPTZEK-QKCSRTOESA-N 395.311 5.108 30 20 GKED Cc1ccc(CN[C@@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)cc1C#N 859309462 PGQHIWSUASFMLM-QFIPXVFZSA-N 393.531 5.003 30 20 GKED N#C[C@@]1(c2nc(-c3ccccc3OCc3ccccc3)no2)CC2CCC1CC2 904465687 MLMYDQAQQNQUQB-FJDUUPPCSA-N 385.467 5.287 30 20 GKED C[C@@H](Nc1ccc(CCC#N)cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 905854190 KGBRQMZDHUVQGP-GFCCVEGCSA-N 395.812 5.254 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2ncc(Cl)cc2Cl)cc1 914771791 GDTMPXHXTFURKM-UHFFFAOYSA-N 394.306 5.098 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3nc4ccccc4n3C)c2cc1C(C)C 916650337 FFNRKQXRLCQZFX-LJQANCHMSA-N 385.467 5.170 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917043994 NQZSCWQRAYEYTL-INIZCTEOSA-N 398.915 5.637 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917430148 FHBFCSJSQIHSAM-RZXPCSSPSA-N 386.398 5.595 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)nn(-c2ccccc2)c1Cl 1776783347 SGBLDHYNRKVYNT-KRWDZBQOSA-N 391.943 5.128 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCCC[C@H]2CC(=O)O)cc1 1776787552 WEFJKRUDRDGGGQ-SFHVURJKSA-N 377.550 5.219 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1OC 1776801322 KNQRUUDKVUPTJE-VOTSOKGWSA-N 394.876 5.183 30 20 GKED Cc1ccc(-c2ncc(/C=C3\CCCc4cc(C(=O)O)ccc4C3=O)s2)o1 1777431438 KFHBWACYYFBGTD-GXDHUFHOSA-N 379.437 5.012 30 20 GKED Cc1cccc2c1C/C(=C\c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777456097 KCJULKBSEALILU-XDHOZWIPSA-N 384.431 5.095 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)N(c1ccccc1)c1nc2ccccc2s1 21907837 RFMXJWHEKMCTMT-INIZCTEOSA-N 399.475 5.300 30 20 GKED N#Cc1ccc(C(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)cc1 25458981 JHOXUXJHUOECTL-UHFFFAOYSA-N 388.370 5.058 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3sc4c(c3C#N)CCC4)ccc2c1 60526421 PWBXFXLSIKZOIH-ZDUSSCGKSA-N 376.481 5.012 30 20 GKED CC(C)c1ccsc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 64882712 VBVPYYMHYAELLH-UHFFFAOYSA-N 376.481 5.574 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Br)c1 66801498 DFUATBABDFSIEQ-LBPRGKRZSA-N 375.291 5.096 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(NC3CCCCC3)cc2)cc1 109894924 QOZIRSGYDYWEGV-UHFFFAOYSA-N 379.529 5.175 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(F)c(Cl)c2)ccc1OC 113308852 OXEXBCNIUAMRGI-CZUORRHYSA-N 376.859 5.019 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(N3CCc4sccc4C3)cc2)cc1 127594662 NXLMFJMLBZNDML-QGZVFWFLSA-N 389.524 5.214 30 20 GKED C[C@H]1C[C@@H](C)CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 161413101 HODDFJCEDGLULT-OALUTQOASA-N 391.515 5.232 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 173731848 VOBXCRLAZDHLFD-LBPRGKRZSA-N 389.468 5.072 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3ccc(OCC#N)cc3)s2)cc1 180539183 ADWDYGRHTVEQHI-SJORKVTESA-N 391.540 5.741 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)n1 183379818 CNMJEXXPHKMJMQ-CQSZACIVSA-N 394.500 5.294 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)C[C@H](O)c1ccc(F)cc1 191517161 FETZLRMJZNMFHB-IERDGZPVSA-N 384.495 5.311 30 20 GKED CCOc1ccc(-c2nc(C[S@@](=O)CCCCC(C)(C)C#N)cs2)cc1 277818298 JBSYOZFMOQDCPZ-SANMLTNESA-N 390.574 5.178 30 20 GKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1OCC(F)F 303100278 BUKSKFIVKYAFPX-UHFFFAOYSA-N 392.405 5.430 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)cc1 410142150 XCIZWCCLVVZKHL-ZDUSSCGKSA-N 375.394 5.389 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cccc(C(=O)OC(C)(C)C)c1 410322113 GPNGLDOWSMSQCP-MRXNPFEDSA-N 382.529 5.506 30 20 GKED N#CC1(CCCN(Cc2ccccc2C(F)(F)F)C2CCCC2)CCOCC1 410347862 FHXXDAAIWLIORX-UHFFFAOYSA-N 394.481 5.551 30 20 GKED C[C@H]1Cc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c2[C@H](C)C1 411019489 UXPVVVJQUIBJLL-OKZRHMCRSA-N 382.476 5.042 30 20 GKED C=C(C)Cn1c([C@H]2CCCS2)nnc1N1CCC[C@H]1c1ccc(F)cc1F 424258830 XERAOHKPQSVZHP-ZWKOTPCHSA-N 390.503 5.042 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c1C 428759272 KTQYWEXGXHZXBT-QGZVFWFLSA-N 379.504 5.455 30 20 GKED C[C@@H](NC(=O)c1cccc(SCC#N)c1)c1c(Cl)ccc(F)c1Cl 429850504 VSSICTDBEDIRSU-SNVBAGLBSA-N 383.275 5.239 30 20 GKED CCCN(CC(=O)Nc1ccccc1SCC#N)[C@H](CC)c1ccccc1 434744329 HVMGJOAYTLIKPH-HXUWFJFHSA-N 381.545 5.104 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 436119746 DXKHXVPCCILQLD-UHFFFAOYSA-N 377.787 5.029 30 20 GKED C[C@H]1c2cc(Cl)cc(Cl)c2CCN1Cc1nnc(-c2ccc(C#N)cc2)o1 446738220 GMTZMSNTQGZCSD-LBPRGKRZSA-N 399.281 5.034 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@H]2CCCCC2(F)F)cc1 448749477 FUIKWWYVTKTEMG-LJQANCHMSA-N 384.426 5.096 30 20 GKED C/C=C\COc1cccc(CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 448936376 FZVAULRSUGTFGD-CWIOURORSA-N 380.513 5.074 30 20 GKED CC[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 458396469 NYYJWBFFDWHZKL-HZPDHXFCSA-N 375.925 5.587 30 20 GKED CCc1nc(CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)cs1 460333962 XCGIUBTXOSDBRK-UHFFFAOYSA-N 395.915 5.006 30 20 GKED C[C@H](C(=O)N[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462553029 PPEZWEQZKHCBFM-VHKYSDTDSA-N 386.417 5.133 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CCC)c1ccc(F)cc1F 468517116 QXVYZQMBCINTJG-NRFANRHFSA-N 383.442 5.075 30 20 GKED C[C@H]1CCc2ccccc2N1CCC(=O)Nc1ccccc1SC[C@H](C)C#N 469317668 OLLLOOKHNUCGET-MSOLQXFVSA-N 393.556 5.108 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 475022336 HTNOQPIZCUVOPT-HNNXBMFYSA-N 399.903 5.449 30 20 GKED CCN(C(=O)C[C@H](CC#N)c1ccccc1)[C@H](c1ccc(C)cc1)c1cccnc1 475909377 ZERZDQGOZBEBEL-JYFHCDHNSA-N 397.522 5.416 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccc(C)cc1)C1CC1 477881979 TWJHAUGQERVPAQ-QFIPXVFZSA-N 380.536 5.011 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccnc(-c2ccccc2)c1 479111906 MHKXSSOVHHEXJZ-UHFFFAOYSA-N 389.503 5.136 30 20 GKED C=C(C)COc1cccc(NC(=O)N(CCC)[C@H]2CCCc3cccnc32)c1 480638518 JHJNOGPEFSPIBL-NRFANRHFSA-N 379.504 5.358 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCCCc1nc(-c2ccncc2)cs1 481658306 NXHZFQMIKGELGI-OAQYLSRUSA-N 388.540 5.067 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1ccc(F)cc1)c1ccccc1Cl 484836948 MQNZRLWHZUHYSR-LJQANCHMSA-N 387.886 5.198 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)CCCC1(C)C 489603335 HUZFAUYFPUPDMG-FQEVSTJZSA-N 385.552 5.074 30 20 GKED COc1ccc2ccc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc2c1 496408256 UITDTPSYMATNJC-QGZVFWFLSA-N 392.867 5.602 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CCCCC1 510024145 SKBCZIFIRZPPHS-FQEVSTJZSA-N 381.907 5.792 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCCOc2ccc(F)cc21 516583525 ALPCMSJTTMAICO-INIZCTEOSA-N 394.899 5.152 30 20 GKED COc1ccc2oc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c(C)c2c1 519425987 BPMBZFSQCBPXMM-ZDUSSCGKSA-N 380.469 5.254 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 520324313 OCZFBXHDQFNPNL-UHFFFAOYSA-N 396.899 5.532 30 20 GKED C=CC1CCN(C(=O)c2ccccc2-c2ncc(-c3ccccc3F)o2)CC1 520326976 YUCOSCLAZBLKFZ-UHFFFAOYSA-N 376.431 5.186 30 20 GKED N#C[C@H](NC(=O)c1cccc(OC2CCCC2)c1)c1cccc(C(F)(F)F)c1 521351738 BWLOGVBKEBEGDV-IBGZPJMESA-N 388.389 5.021 30 20 GKED C[C@@H](CC#N)N(C)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525054679 DOIDVJWRGSBGEJ-ZDUSSCGKSA-N 393.339 5.660 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccccc3OCC3CC3)cc2)cc1 525367078 JRGXKJJLKHTGEY-UHFFFAOYSA-N 398.462 5.586 30 20 GKED COc1ccc(CNc2cccc(Br)c2C)cc1OCCCC#N 533209296 PHMYHSACGNAALB-UHFFFAOYSA-N 389.293 5.061 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccccc3CCC(F)(F)F)c2C#N)C1 533970622 PGHZZKHXCJGQHQ-LBPRGKRZSA-N 392.446 5.492 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc([C@H]2CCCOC2)c1 535037277 SIIKEQOYLPJTJH-APWZRJJASA-N 380.513 5.227 30 20 GKED C=CCN(C(=O)c1cc(C)n([C@H](C)C2CC2)n1)c1nc(-c2ccccc2)cs1 538492286 CWHLFFYEHGFZKX-MRXNPFEDSA-N 392.528 5.119 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@@H]3/C=C\c3cccs3)o2)cc1 542131263 AMXFFQVYALGMJV-YAINUAMHSA-N 390.512 5.128 30 20 GKED N#Cc1cc(C(=O)N2CCC(c3ccccc3C(F)(F)F)CC2)ccc1Cl 542762120 DYAQNBQBKJERMZ-UHFFFAOYSA-N 392.808 5.250 30 20 GKED N#C[C@H](C(=O)c1oc2ccccc2c1CSC1CCCCC1)c1ccncn1 545445714 IBQBDIJORNJMQK-KRWDZBQOSA-N 391.496 5.279 30 20 GKED C[C@@H](Oc1ccccc1)c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 545733647 MJBOAVHOUVZZJB-MUSGIIIZSA-N 384.439 5.248 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc2ncsc2c1 547943522 NKTFOWHJQWAWDD-UONOGXRCSA-N 396.541 5.573 30 20 GKED Cc1sc(C2(NCc3cccc(C#N)c3F)CCC2)nc1-c1ccccc1F 550528311 ZFCOIEFEBRAUAC-UHFFFAOYSA-N 395.478 5.437 30 20 GKED CC(C)c1ccoc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 551558929 UNNUNMSGJPTVMD-UHFFFAOYSA-N 382.407 5.680 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1c(F)cccc1F 568427757 MDMLJUZCDVHNIF-ZIAGYGMSSA-N 389.471 5.441 30 20 GKED C=CCn1cccc1-c1nc(-c2ncoc2-c2cccc(C(F)(F)F)c2)no1 574557009 KKQCQQFIOVIVHR-UHFFFAOYSA-N 386.333 5.065 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3nc4ccccc4cc3Cl)n2)c1 578807212 FJTZUBUXLTUGMB-UHFFFAOYSA-N 390.855 5.136 30 20 GKED CC(C)(C)c1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 582989282 MWUACYYNVNWCKT-HNNXBMFYSA-N 396.903 5.041 30 20 GKED COc1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)c(C2CC2)cc1Cl 594205344 APUABWODSPISIC-GOSISDBHSA-N 383.879 5.393 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)C1 598407164 HODBFACFINSBFC-SEPOPDPSSA-N 397.478 5.080 30 20 GKED N#Cc1cc2c(nc1SCc1csc(Cc3ccccc3)n1)CCCC2 603635308 FKIDLMALWDJLLW-UHFFFAOYSA-N 377.538 5.172 30 20 GKED C=CCN(C(=O)c1cc2cc(F)ccc2o1)c1nc(-c2ccccc2)cs1 605078693 DHLIEXDCQGMHRY-UHFFFAOYSA-N 378.428 5.528 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCc1ccc(Cl)o1 609078813 PUWARRQVFBJKQZ-UHFFFAOYSA-N 395.846 5.014 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(F)c(F)c1 609370794 XVGAYFVWWOXHCH-LBPRGKRZSA-N 378.469 5.090 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3ccccc3SC[C@H](C)C#N)cc2c1 609376468 AMSLKKHGODJJQU-OAHLLOKOSA-N 375.497 5.356 30 20 GKED CCN(CCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1C 609437127 QWHIIQAPIRBSNY-SFHVURJKSA-N 396.560 5.037 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 609640583 GTVHHRWPFRQJTK-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1cccnc1[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C(C)C 609645728 POMCHJSUTRSVEO-QFIPXVFZSA-N 385.467 5.181 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610583967 ORLLOWGMPJNTTG-VGSWGCGISA-N 398.466 5.155 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 612307358 AIPFNZNZUVIRGT-OAQYLSRUSA-N 383.879 5.077 30 20 GKED N#C[C@@H](C(=O)c1occc1CSc1ccccc1)c1ccc2ccccc2n1 613292443 KDZIPDMVYMGXSF-LJQANCHMSA-N 384.460 5.610 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3oc4c(F)cccc4c3C)n2)cc1 613315257 IPTDYRSCORSWBE-MRXNPFEDSA-N 390.439 5.802 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)cc1 613346475 KNVWDRXOQCCPSX-HNNXBMFYSA-N 387.291 5.915 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3coc(C4CCCCC4)n3)cn2)c1 614396059 QVXAGXQTHLVHSL-UHFFFAOYSA-N 388.427 5.034 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc2cccc(F)c2o1 619124921 HSLRDNSLZORLPC-UHFFFAOYSA-N 385.279 5.355 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)c2c(Cl)cccc2Cl)cc1 625110979 YIBPRKSDWKFPBX-GFCCVEGCSA-N 392.286 5.043 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)o2)cc1 642061053 VWTCPEINKUYIMK-UHFFFAOYSA-N 386.451 5.072 30 20 GKED C=CCn1c(S[C@H](C(=O)C2CC2)c2ccccc2)nnc1-c1ccccc1C 647118858 QDXIQNJTXDNFJM-NRFANRHFSA-N 389.524 5.252 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1sccc1SC(F)F 730471805 YNDUBBDPEXBHEE-UHFFFAOYSA-N 390.436 5.374 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)c2)cc1 732434729 DIPGJZQWAYEHIP-SFHVURJKSA-N 385.467 5.328 30 20 GKED CCC(CC)[C@@H](NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1cccs1 733848021 KDSFBSOMFUPNCS-WIYYLYMNSA-N 399.560 5.406 30 20 GKED C[C@H](COc1cccc(C#N)c1)OC(=O)c1ccc(C2SCCCS2)cc1 733860845 HZBFQUBKRUMNED-OAHLLOKOSA-N 399.537 5.051 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@H]1c1ccc(C(C)(C)C)cc1 739835918 FVHXOVNSGQLSAZ-QHCPKHFHSA-N 399.542 5.217 30 20 GKED O=C(Nc1cccc(/C=C2/Oc3ccccc3C2=O)c1)c1ccccc1Cl 742436483 LOOBBKMSCBGFJN-DEDYPNTBSA-N 375.811 5.209 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@@]23CCc2ccccc23)cc1 743312729 UPVXVBXFWIXWTA-QIGHUWCUSA-N 378.475 5.185 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(COC(C)(C)C)cc2)c1 752717497 VTEUDKBGGIMIKU-HXUWFJFHSA-N 395.503 5.004 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(F)c1O 756380410 UGHJUFKVNHOJES-REIXXSIJSA-N 391.302 5.231 30 20 GKED COc1cc(C=NOCc2cc3ccccc3nc2Cl)ccc1OC(F)F 760420927 NKUIIVLGMOKRGV-UHFFFAOYSA-N 392.789 5.049 30 20 GKED CCCCCCC[S@](=O)Cc1coc(-c2ccc(Br)cc2)n1 764454200 KGESLXCLPKQUJC-QFIPXVFZSA-N 384.339 5.323 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N(CCC#N)Cc3ccco3)c2)cc1 768991534 SPGVPZWUJRCERD-UHFFFAOYSA-N 389.455 5.115 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cscc1Cl 771871887 RKDROYOSLNNCKH-UHFFFAOYSA-N 385.901 5.031 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CN[C@@H](C)c1cccc(C#N)c1 776219297 MIFJWRMEPNXCQD-KRWDZBQOSA-N 392.934 5.431 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3ccc(C)cc3)n2)cc1 779195175 SAQIMZYOQHNLLZ-OXQOHEQNSA-N 390.508 5.182 30 20 GKED C[C@H]1C[C@H]1[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)cc1 780667866 NTYZARWEGNFYBC-AADOQKPJSA-N 383.879 5.150 30 20 GKED CC(C)c1ccc(C2(O)CCC(Nc3ccccc3O[C@H](C)C#N)CC2)cc1 781916927 WVSGWDCWRHWQOM-ZGYBWILLSA-N 378.516 5.343 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cccc(CN(CC)C(=O)OC(C)(C)C)c1 785818064 DISJFXXFFCQHIE-LJQANCHMSA-N 387.524 5.016 30 20 GKED Cc1cc(C(=O)/C=C\c2csc(-c3ccccn3)n2)sc1Br 794733826 UCHJOKGSQLOTCE-WAYWQWQTSA-N 391.315 5.234 30 20 GKED N#CC1(CCCOC(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)CCOCC1 800106263 DKZHAYBGVHWNSL-VQHVLOKHSA-N 399.487 5.211 30 20 GKED COc1cc(/C=C2\C(=O)c3cccc(C)c3[C@H]2C)cc(OC)c1OCC(F)F 809157278 JEUNECNBRUQQMH-TUTDSIAXSA-N 388.410 5.040 30 20 GKED N#CCCC[C@H](NC(=S)NCc1cccc(C(F)(F)F)c1)c1ccccc1 814210480 PHUDPDGUXDZHNV-SFHVURJKSA-N 391.462 5.105 30 20 GKED COCc1nc(Cl)cc(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)n1 814979509 QVJKGZMUOKDAKO-ZDUSSCGKSA-N 398.816 5.031 30 20 GKED C=CCC1(C(=O)O[C@H](C)c2sc(Cc3ccccc3)nc2C)CCOCC1 820098833 VNSOTQDFEVYKHE-QGZVFWFLSA-N 385.529 5.019 30 20 GKED Cc1c(C#N)cccc1NC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 830628691 UVEACTSJBQBXQU-UHFFFAOYSA-N 399.878 5.048 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(C(C)C)c1Br 867727415 WIKMNYMZQDRITK-UHFFFAOYSA-N 390.325 5.331 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc([C@H]2CCC(=O)N(CC3CCC3)C2)no1 904838579 YYXZBEBRNRWJGE-SFTDATJTSA-N 393.531 5.064 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc2c3ccccc3n(C)c2s1 914482174 MJFXINIOSZSVOZ-UHFFFAOYSA-N 387.508 5.317 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccccc2C(F)(F)F)S1 915848573 ZSLUDGBCYPHEHI-GDNBJRDFSA-N 376.403 5.214 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)cc(OC)c1OC 916137841 FVJJOMJAJSKIGI-CSKARUKUSA-N 398.842 5.522 30 20 GKED Cc1ccc(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(Br)c1 916846118 IABIGUQRQZXKIS-QIAWRQBBSA-N 397.297 5.257 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccc(Cl)s2)cc1 916948868 KEKVSSARUVTZMX-VOXOTFGZSA-N 386.904 5.276 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1nc(-c2ccccc2)cs1 917024861 BFETUHSUIIDPGE-FQEVSTJZSA-N 398.487 5.879 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917043755 OLHDIEGFGUWOHP-DOMZBBRYSA-N 388.414 5.685 30 20 GKED COc1ccc(OCc2nc(/C=C3\Cc4c(Cl)cccc4C3=O)cs2)cc1 921263936 LJALMKUAXLZKDJ-UKTHLTGXSA-N 397.883 5.207 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)cc1 1776011937 BYPCBAUYUSSWOF-UHFFFAOYSA-N 375.211 5.398 30 20 GKED O=C(O)C(=O)/C(=C\c1ccc(-c2ccccc2)s1)c1ccc2ccccc2n1 1776116512 WLUABQDJZIDUEW-JXAWBTAJSA-N 385.444 5.158 30 20 GKED CCCCCCCCCCCN(C)Cc1nc2cc(C(=O)O)ccc2n1CC 1776787772 SYPLESKHEORYQO-UHFFFAOYSA-N 387.568 5.717 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)CC2CCCCC2)cc1 1776788435 FTWABMHMCHBRMP-QFIPXVFZSA-N 389.580 5.939 30 20 GKED CCCCCCCOc1cccc(/C=C/C(=O)c2cc(C(=O)O)ccc2O)c1 1776789097 PTTNXQDSKYTLIL-ZRDIBKRKSA-N 382.456 5.336 30 20 GKED O=C(/C=C/c1cc2c(O)cccc2s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569393 NMDKKJLYMKPARH-CMDGGOBGSA-N 390.416 5.461 30 20 GKED C=CCn1c(SCc2ccccc2Br)nnc1-c1ccoc1C 21242551 QYOHKNXDEOORTR-UHFFFAOYSA-N 390.306 5.087 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccccc3Cl)s2)sc2c1CCC2 64868364 ZROZCBBYGYDUKQ-UHFFFAOYSA-N 385.901 5.138 30 20 GKED CC(C)(CNC(=O)Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 65366737 SWMSALHXEOYPAU-UHFFFAOYSA-N 376.287 5.159 30 20 GKED CC(C)(C)C(=O)/C=C1/SCC(=O)N1Cc1sc2ccccc2c1Cl 96926366 SHLPDEFLFBTQMG-LZYBPNLTSA-N 379.934 5.087 30 20 GKED C=C[C@H](CC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1)c1ccccc1 126756137 SIZKHDDQBCBDQG-NQIIRXRSSA-N 387.483 5.150 30 20 GKED CC(=O)N(c1nc(COc2ccc(C#N)cc2F)cs1)c1ccc(C)cc1C 127492868 DHJXILDFAQXTMX-UHFFFAOYSA-N 395.459 5.034 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3nccnc3c2)cc1Cl 129772136 VRJPXKUDVIEGCC-LJQANCHMSA-N 398.853 5.191 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 153996068 XRKGIKHMECFBGD-ZWKOTPCHSA-N 381.545 5.484 30 20 GKED COc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c(C)c1 171421799 QSJRCYJCAYASNX-UHFFFAOYSA-N 388.492 5.420 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1nc2ccccc2s1 191426330 MDSMSGNOGAFROV-INIZCTEOSA-N 393.556 6.373 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCC(C)(C)CCC#N 195046929 FKAMXYXABRMXSZ-UHFFFAOYSA-N 381.259 5.444 30 20 GKED C[C@H]1CCCC[C@H]1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 195667239 CBLQSILQLUOULW-PXNSSMCTSA-N 378.541 5.407 30 20 GKED CCC(CC)c1cc(CNCc2cccc(OCc3cccc(C#N)c3)c2)on1 236730502 NRTNPGCBRUKRSF-UHFFFAOYSA-N 389.499 5.319 30 20 GKED C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246744309 OOXTYVKBPVKAGB-JXXFODFXSA-N 397.519 5.835 30 20 GKED Cc1csc(C2(NC(=O)Nc3ccccc3S[C@H](C)CC#N)CCC2)n1 267621230 UTMIDCIIXAUTMJ-CQSZACIVSA-N 386.546 5.047 30 20 GKED C=C1CCN(Cc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)CC1 270275779 XMTCCNFYYPRCNV-UHFFFAOYSA-N 389.952 5.250 30 20 GKED CC1(C)[C@H](/N=C(/O)[C@@H]2CC=CC[C@@H]2c2nc3ccccc3s2)[C@@H]2CCCO[C@H]21 329741456 VYYNWHSYXQNJBV-OPOMMLRYSA-N 396.556 5.506 30 20 GKED CSc1cccc(F)c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 409652960 RGXWGRNROUSETJ-UHFFFAOYSA-N 378.428 5.464 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1Cl 410013364 FIVDLAZRALWNON-UHFFFAOYSA-N 393.796 5.427 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)Cc2csc(-c3cccs3)n2)s1 411008420 SGRQBFVIOGIYRI-UHFFFAOYSA-N 387.555 5.283 30 20 GKED CC1(C)[C@@H](c2ccccc2)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 422209311 UJRKFHCTCGYPKT-FGZHOGPDSA-N 375.516 5.399 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1ccccc1Sc1ccccc1C#N 427760764 PJSAJMRIAQAWSQ-AWEZNQCLSA-N 392.446 5.560 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)NCC1(CC#N)CC1 432069119 JWFVYNXDVOEJQU-UHFFFAOYSA-N 383.879 5.043 30 20 GKED Cc1ccccc1CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438667705 CRFUTPVHAMPMRA-UHFFFAOYSA-N 389.430 5.462 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)N[C@H](CCC#N)c2ccccc2)c(C)c1 439678802 QZIXBHFFFOZOSB-OAQYLSRUSA-N 376.500 5.126 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c1 460171850 MKLJQQBCTHGTAF-ZIAGYGMSSA-N 397.208 5.209 30 20 GKED C=C(C)Cn1c(COc2cccc(C)c2)nnc1N1CCC[C@H]1c1cccs1 460958618 LCQSEDRDOBLYDG-IBGZPJMESA-N 394.544 5.145 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H](C)c1cccc(C#N)c1 462028769 GAWRVKMSGCWFHY-GOSISDBHSA-N 395.462 5.060 30 20 GKED Cc1ccc(-c2nc(Cc3noc([C@H](C)c4cccc(C#N)c4)n3)cs2)cc1 462829685 KIFIFDFBOKNRIH-OAHLLOKOSA-N 386.480 5.116 30 20 GKED COCCC[C@@H](c1ccc(Cl)cc1)c1noc([C@@H](C)c2cccc(C#N)c2)n1 463053666 JEEMVNNBKRJELQ-YWZLYKJASA-N 395.890 5.305 30 20 GKED Cc1cc2cc(C(=O)NC3CCC(Oc4ccccc4C#N)CC3)oc2cc1C 463838682 ZROLCYJVHGFVNC-UHFFFAOYSA-N 388.467 5.041 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cncc(-c2ccccc2)c1 466426876 YGXCIHZBKNTQIU-UHFFFAOYSA-N 379.419 5.060 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Cl)ccc1O[C@@H](C)COC 470530935 RWMIXJKCVWIJMX-AWEZNQCLSA-N 394.924 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)[C@@H](C)C(=O)OC 475570658 JSJLBFSYYUJMNX-UTKZUKDTSA-N 394.515 5.210 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1CN1CCCC1 475572557 PVQRMXQEYXKQBL-UHFFFAOYSA-N 391.559 5.456 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(=O)N(c2cccc(C)c2C)C1 476082137 WWLUGBFQDHJKOW-FQEVSTJZSA-N 390.527 5.147 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](c1ccccc1)c1ccccn1)c1ccc(F)c(F)c1 477726280 SSGAJHUDQWKHTB-FCHUYYIVSA-N 393.437 5.066 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COC(C)C)c1 477760210 MQJIDLPSNJGPNP-UHFFFAOYSA-N 379.504 5.173 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)ccc1OC(F)F 482527588 FBIDYTHCWPAYBK-NSHDSACASA-N 396.846 5.588 30 20 GKED Cc1nc(NC(=O)[C@@H](c2cccc(Cl)c2)C(C)C)sc1SCC#N 486036404 FOWJKZOUITWBQE-CQSZACIVSA-N 379.938 5.099 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2ccc(C(=O)N3CCCC3)cc2)cc1 486522255 ZFYGPXWKHTYULG-UHFFFAOYSA-N 381.479 5.073 30 20 GKED CSc1ccc(N(C)C(=O)c2ccccc2Sc2ccccc2C#N)cc1 495126559 HZYTZOZUIPHDOZ-UHFFFAOYSA-N 390.533 5.708 30 20 GKED Cc1ccc2snc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 496406778 JDUUUJJBFMIBDY-GFCCVEGCSA-N 383.885 5.358 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 497388484 MLCHMZKIJGOVNI-UHFFFAOYSA-N 377.271 5.407 30 20 GKED COc1ccc(CCCCC(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)cc1 499796867 IBHKBJRUIMLZPW-GOSISDBHSA-N 391.298 5.096 30 20 GKED COc1ccc(NC(=O)c2sc3ccc(C#N)cc3c2C)cc1OC(C)C 499801539 UPXQDDNKUWNICO-UHFFFAOYSA-N 380.469 5.130 30 20 GKED CSc1ccc(Cl)cc1NC(=O)Nc1cccc(OCCCC#N)c1 502631578 CFIQMRLFUMCIKZ-UHFFFAOYSA-N 375.881 5.388 30 20 GKED Cc1coc(-c2cc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)ccc2C)n1 502638442 OKXGBOJLNXOABP-UHFFFAOYSA-N 398.466 5.151 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2C2CCCC2)cc1 510694681 ZKKTYWOHTLUVNA-NRFANRHFSA-N 375.472 5.537 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)cc2)cc1 517044548 BXNVLMATTPRYIQ-JOCHJYFZSA-N 382.419 5.049 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Br)cc1F 518140228 UGUMDFXLCPCSOS-LLVKDONJSA-N 393.281 5.092 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 518259416 KTFXFEOWNBRGMP-ROUUACIJSA-N 381.545 5.923 30 20 GKED Cc1ccc(C)c(N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C(C)C)c1 520328997 UWTPKOAPUSDKSG-UHFFFAOYSA-N 385.467 5.418 30 20 GKED CCSc1ccc(Cl)cc1NCC(=O)Nc1cc(Cl)ccc1C#N 520635387 RPJBJHNVNNGTFJ-UHFFFAOYSA-N 380.300 5.028 30 20 GKED C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccccc1SCCC#N 521717071 SUZYNCBWHUQRGI-LBPRGKRZSA-N 395.311 5.405 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N(C)C[C@@H](C)C#N)cc2)c1 523446114 LAPSGPFHJBFENI-SFHVURJKSA-N 379.504 5.321 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)Nc1ccc(C#N)cc1 525491585 SSOOAFMXLKEFFX-UHFFFAOYSA-N 399.429 5.204 30 20 GKED Cc1sc(NC(=O)c2cccc(-c3noc(CC(C)(C)C)n3)c2)c(C#N)c1C 525518756 QBHKXIMTYILBHQ-UHFFFAOYSA-N 394.500 5.128 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1cc(C(C)(C)C)on1 525665889 UZZHZXZTNPBSJE-UHFFFAOYSA-N 391.446 5.138 30 20 GKED Cc1cc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)ccc1F 534732816 LIVQAPWCVJCMIX-QVKFZJNVSA-N 397.519 5.801 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 535535898 VPISNVNQYFKBJF-UPVQGACJSA-N 396.494 5.361 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](CCC#N)c3ccccc3)s2)cc1 536835487 ZGRAPVWKIWWYIS-UWJYYQICSA-N 375.541 6.123 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)ccc1OC1CCCC1 537406057 BCNXUOYRKPNRQR-JKSUJKDBSA-N 382.479 5.439 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)c(F)c1 538509217 HJCMBOBLWVMUKL-HJPURHCSSA-N 384.458 5.024 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3COCc3ccccc3)cc2)CC1 538534276 FASVUQDHFLMZKG-UHFFFAOYSA-N 382.463 5.211 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(OCc3cccnc3)c2)CC1 539922084 MIWZJMOQPMSUCJ-UHFFFAOYSA-N 383.495 5.477 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N(Cc1ccc(F)cc1)CC(F)(F)F 541220844 ZWZCNCUQNQWEOE-UHFFFAOYSA-N 399.350 5.475 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cccc(C(F)(F)F)c1 542297054 OIDDFPKFNANCIZ-HNNXBMFYSA-N 386.417 5.262 30 20 GKED N#CCCn1cc(/C=C\c2nc(CSCc3ccco3)no2)c2ccccc21 546949422 AWEKZTAVCZKQIL-HJWRWDBZSA-N 390.468 5.135 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl)c1ccc(Cl)c(Cl)c1 553962570 XKPGOHBPHAQTPQ-AHIWAGSCSA-N 379.674 5.131 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(-c2ncc(C)o2)c1 554210942 DBNNRAQTBPGETJ-UHFFFAOYSA-N 393.491 5.038 30 20 GKED Cc1oc2ccccc2c1CNC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 557539121 JCDYUESDCMODIE-UHFFFAOYSA-N 398.422 5.122 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1ccccc1SCC=C(C)C 561211744 DRIMJLMBTCEQBH-UHFFFAOYSA-N 385.529 5.049 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 565659931 IFIDIVRDHSXSOK-UWJYYQICSA-N 375.541 6.204 30 20 GKED O=C(CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1c(F)cccc1F 566751898 SIDUZTVPTPUUGP-UHFFFAOYSA-N 398.253 5.053 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1c[nH]c2cccc(Cl)c12 571292759 UQVVVJBZLDUCRF-CYBMUJFWSA-N 383.904 5.254 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CC2(C(F)(F)F)CC2)c1 575191889 PEILMFPABCTHBH-UHFFFAOYSA-N 392.808 5.477 30 20 GKED CC[C@H](C)c1ccc(C(=O)Cn2cc(C#N)c(=O)c3cc(C)cc(Cl)c32)cc1 580845826 JDMSPIKJXOOHNV-HNNXBMFYSA-N 392.886 5.231 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CNCC2(C#N)CCCCC2)cs1 602718203 QUTIVTONUMNBCW-UHFFFAOYSA-N 396.560 5.008 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](Oc2ccc(F)cc2Cl)c2ccccc2)cc1 609323994 PXDNPMVXCSWXQS-FQEVSTJZSA-N 380.806 5.110 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609436360 JUHJJNJUASEGCV-DLBZAZTESA-N 397.544 5.751 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(c2cccc(Cl)c2)CC1 610095221 JXTKNZQBFRSLOR-OAHLLOKOSA-N 399.947 5.445 30 20 GKED CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610321348 RHZPEPCIOCKHKZ-JXFKEZNVSA-N 378.476 5.178 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2oc3c(ccc4ccccc43)c2C)cc1 615000000 SCERFPQQBPCXFK-UHFFFAOYSA-N 384.435 5.063 30 20 GKED C[C@@H](CC(=O)NCc1ccc(C#N)c(Cl)c1)c1ccc(C(F)(F)F)cc1 619767254 GIYFAEINLIZMCG-LBPRGKRZSA-N 380.797 5.040 30 20 GKED C=CCSc1ccccc1NC(=O)COc1ccc(Cl)c2cccnc12 620676177 NRNJHNPKDPZCKI-UHFFFAOYSA-N 384.888 5.184 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccccc2OC(F)F)ccc1OC 622266303 GKZZNFPHQLFGKA-HNNXBMFYSA-N 377.431 5.102 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)C1 665822909 ULAKGNUWGYECIW-CQSZACIVSA-N 387.867 5.005 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1 665887668 JMKFPQLMRCIYEE-HDICACEKSA-N 383.879 5.029 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cc1Cl 727264841 YEKIKGJYTLBWGM-HJWRWDBZSA-N 385.872 5.377 30 20 GKED C#Cc1ccc(C(=O)N(c2ccc(OCC)cc2)c2nc3ccccc3s2)cn1 728797037 AIRZBKFIYAHGAB-UHFFFAOYSA-N 399.475 5.050 30 20 GKED N#Cc1cccc(OC2CCN(Cc3cc4oc5ccccc5c4cc3O)CC2)c1 729467074 KFLSWNBKQKZHIB-UHFFFAOYSA-N 398.462 5.207 30 20 GKED CCCCCCCCc1nnc(NC(=O)Nc2ccc(NC(C)=O)cc2)s1 733618029 RKCKKLVVMXGLCQ-UHFFFAOYSA-N 389.525 5.044 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 734706408 GWPLGKPXNUPIFR-LLVKDONJSA-N 394.443 5.531 30 20 GKED Cc1ccc(C)c(-n2ncc(C(=O)/C=C/c3cnc(-c4ccccc4)nc3)c2C)c1 741841145 DBMHQABLFUPSIO-VAWYXSNFSA-N 394.478 5.151 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3SCCc4ccccc43)n2)cc1 744031554 MQGPLJWZEBEZLQ-GHTZIAJQSA-N 390.533 5.325 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)[C@@H](C)c2cccnc2)s1 744746691 DSWLNLJQGISQGA-HNNXBMFYSA-N 375.542 5.061 30 20 GKED CC(=NNc1ccc(Br)cc1)c1sc(-c2cccnc2)nc1C 747611031 MSXCBOLQFBOUKO-UHFFFAOYSA-N 387.306 5.112 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccc(C(F)(F)F)cc1)C(C)C)c1ccncc1 749201999 LARMVVMKTMDJBL-MOPGFXCFSA-N 391.437 5.414 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C23C[C@H]4C[C@@H](CC(F)(C4)C2)C3)cc1 764838280 BLJPPXLSJWXQAO-LXYVVVQHSA-N 388.486 5.589 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2c(C(C)C)cccc2C(C)C)cc1C#N 771836842 GBUREFZPTGQHOJ-UHFFFAOYSA-N 395.572 6.401 30 20 GKED Cc1csc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 774054739 LWDIRFRBLUMAOV-AWEZNQCLSA-N 387.917 5.038 30 20 GKED C[C@@H](NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)c1ccc(OCC#N)cc1 776155871 JDNPHJABYIDCHX-LJQANCHMSA-N 398.506 5.432 30 20 GKED C[C@@H](N[C@@H](COCc1ccccc1)c1ccccc1)c1ccc(OCC#N)cc1 776164451 TXMUVZUSHFGVHV-NLFFAJNJSA-N 386.495 5.198 30 20 GKED N#Cc1ccc(C2(C(=O)OCc3nc(-c4ccccc4Cl)cs3)CC2)cc1 781394578 LWZWEZMXJZKQRK-UHFFFAOYSA-N 394.883 5.110 30 20 GKED CCCn1c(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc2ccccc21 786929580 LMKBPNZNQOZHQJ-HXUWFJFHSA-N 395.462 5.166 30 20 GKED N#CCc1ccc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)cc1 796468468 DPAXCRXMPZIGJC-GOSISDBHSA-N 392.717 5.435 30 20 GKED N#C[C@H](C(=O)C(F)(F)Cc1ccccc1)c1nc2cc(Cl)ccc2s1 796651105 PCPLGZJJPADEAV-CYBMUJFWSA-N 376.815 5.004 30 20 GKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccnc1 797944252 AXBHIULQBUVZEV-RDTXWAMCSA-N 397.450 5.099 30 20 GKED C[C@H](N[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 810264256 ZQYMWIRWNLGFQQ-PGRDOPGGSA-N 393.531 5.255 30 20 GKED Cc1ccc(Cl)c(NC(=S)N[C@H](CCCC#N)c2ccccc2)c1Cl 814210211 MOSPSABTJPLHBV-MRXNPFEDSA-N 392.355 6.023 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 835069235 YJVONJNIKYEKLT-GXFFZTMASA-N 386.826 5.618 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@H]3CC[C@@](C)(C#N)CC3)c12 836158834 ZBIJQLXYYNXCRN-PAVFIEEWSA-N 394.519 5.001 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H]2CCSc3ccccc32)cc1 842289585 RKUCZMVFLXYYRG-BEVDRBHNSA-N 392.524 5.127 30 20 GKED Cc1cc(CNCc2ccc(C3(C#N)CC3)cc2)cc(NC(=O)OC(C)(C)C)c1 850315200 RBIPTNBJDCOYFP-UHFFFAOYSA-N 391.515 5.187 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917041243 ROSKDZQOKSGGSB-QFSNBGPKSA-N 393.437 5.619 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccccn2)nc2ccccc12 918382215 BIZILNUQPVZGTB-UHFFFAOYSA-N 397.453 5.264 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3ccc(F)cc3)n2)cc1 921136831 PESKDDDHAZXYNL-KUHUBIRLSA-N 394.471 5.013 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1sc2ccccc2c1C(=O)O 1776029653 KMMUOZSRFSKRDM-UHFFFAOYSA-N 379.268 5.742 30 20 GKED CCCCCCC[C@H](CC(=O)O)NC[C@H](C)Cc1ccc(C(C)(C)C)cc1 1776782341 KASSSDOMPRWUND-DENIHFKCSA-N 375.597 5.956 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)[C@@H]2CCc3ccccc32)c1 1776788206 YSTRARGQMUGCLV-DNQXCXABSA-N 395.543 5.309 30 20 GKED CCCCOc1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)cc1OCC 1776801316 KANHZRDVEITFFH-MBGNVJMVSA-N 394.467 5.102 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(-c2ccc(F)cc2)s1 1777268158 LDTVRRNYOMGQNU-RMKNXTFCSA-N 382.412 5.157 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1cccc(C(F)(F)F)c1 27765362 NFFYSNLRYMVMBD-UHFFFAOYSA-N 380.369 5.174 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccc(C)cc2)cs1 54894967 DXFPZYHLJGEDGR-XFXZXTDPSA-N 380.444 5.171 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 66953890 YMWJSLBEJOZXHX-ROUUACIJSA-N 379.529 5.411 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1Cl 66954767 GBWAHNFKXIYYRR-DNVCBOLYSA-N 399.947 6.103 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C 67500263 MQCPOFQDXYPSBX-UHFFFAOYSA-N 397.478 5.525 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)[C@H](C)c2cc3ccccc3o2)c1 113980286 QNGGXTKHMTYTKD-APWZRJJASA-N 391.471 5.016 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)cc1 116483757 FALNYSAPLOARTI-IBGZPJMESA-N 399.947 5.463 30 20 GKED N#C[C@H](C(=O)C1CCC(F)(F)CC1)c1nc(-c2c(F)cccc2F)cs1 120908519 VQKPEUHRPKIRFI-LLVKDONJSA-N 382.382 5.090 30 20 GKED C=CCn1c(SCc2nc3ccc(F)cc3o2)nnc1-c1ccccc1C 124096795 QTDGIBLKFJBVEW-UHFFFAOYSA-N 380.448 5.012 30 20 GKED COc1ccc(CN(C(=O)N[C@@H](CCC#N)c2ccccc2)[C@@H](C)C2CC2)cc1 160619442 JXGCVVXSMMVELQ-MBSDFSHPSA-N 391.515 5.050 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1C[C@@H]1c1sccc1C 161423074 MMNLMNWVAVKMRL-ZWKOTPCHSA-N 389.480 5.166 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(SC(=O)N(C)C)cc1 176880734 DXGUOMAYOPDVMT-HNNXBMFYSA-N 385.558 5.324 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2C(=O)c2ccc(F)cc2)n1 177759298 QJOITMRFQYUNFD-GOSISDBHSA-N 392.455 5.127 30 20 GKED CC[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(C)cc1 181683026 KDWAJDBOSXAJIN-PKOBYXMFSA-N 381.545 5.069 30 20 GKED COc1ccc(CSc2nnc(S[C@@H](C)c3cccc(C#N)c3)s2)cc1 189800895 SFCOYVRXKOEGMK-ZDUSSCGKSA-N 399.566 5.564 30 20 GKED N#Cc1cc(Cl)ccc1NCc1cn(-c2ccccc2)nc1-c1ccncc1 301174859 GANYTUBXSVQASG-UHFFFAOYSA-N 385.858 5.071 30 20 GKED CC(C)(C)c1nc2cc(N=C(O)N3CCC(c4nccs4)CC3)ccc2o1 329590195 YIIVFNICZYKVER-UHFFFAOYSA-N 384.505 5.007 30 20 GKED CC(C)c1nc([C@@H]2CCCCN2CC(O)=Nc2cccc(Cl)c2Cl)n[nH]1 329829381 JJPMTRAMXMIVHJ-AWEZNQCLSA-N 396.322 5.050 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccccc1Br 329969481 UOQWJRWRMCCGOJ-GRTSSRMGSA-N 393.325 5.392 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(-c2c(Cl)cccc2OC)noc1C 410355336 ZWGINPXCMWJPGB-UHFFFAOYSA-N 396.874 5.683 30 20 GKED N#CCCC[C@H](NC(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1)c1ccccc1 413573517 JEIPECWQJGEEBC-PKTZIBPZSA-N 387.527 5.401 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(F)ccc3Cl)c2)c1 431440143 GKIHPBPHDDQBLO-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC1(C)CC(C)(C)c2cc(NCc3cn(CCC#N)nc3-c3ccncc3)ccc21 433330032 AQKJTIIGPBUSIR-UHFFFAOYSA-N 399.542 5.430 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)Nc1ccc(CC#N)cc1 436079603 FZJNQJKVVBNYOF-UHFFFAOYSA-N 386.238 5.275 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1C 438647469 ODNUGNCRAOGUHX-LJQANCHMSA-N 387.405 5.563 30 20 GKED CN(CCc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438673630 UWPLULSVVZFTSP-UHFFFAOYSA-N 395.459 5.258 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)N[C@@H](CCC#N)c3ccccc3)ccc2o1 439390887 YUPDSAOJMGCZPL-KRWDZBQOSA-N 376.460 5.292 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1F 440746664 KAXCHRFAJODOFG-UHFFFAOYSA-N 392.346 5.042 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443588151 AMZDSMPVDQMMBK-UHFFFAOYSA-N 386.377 5.112 30 20 GKED CC[C@H](C)n1c(C(F)(F)F)nc2cc(NC(=O)N(C)CC(C)(C)C#N)ccc21 455803268 VUNLWFYZTUETOP-LBPRGKRZSA-N 395.429 5.040 30 20 GKED Fc1ccc(CN2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)c(C(F)(F)F)c1 459646971 JDTBFJYBJJKTDQ-OAHLLOKOSA-N 399.350 5.026 30 20 GKED C=CC[C@H]1N(c2nnc(-c3cccnc3)n2Cc2cccs2)CCCC1(C)C 461329158 FPZTYSLPGRHOJM-LJQANCHMSA-N 393.560 5.021 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(Cl)c2ccccc12 463258691 RFPQCCICDVPMQN-OAHLLOKOSA-N 377.875 5.267 30 20 GKED CC(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 464293138 HHUXUJYWLBMZPY-IBGZPJMESA-N 378.497 5.144 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1cc(C(F)(F)F)ccn1 464426592 NSAPHBHGKLSCPA-CYBMUJFWSA-N 390.748 5.504 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccncc3Cl)cc2Cl)cc1 465076277 CSLHWORRYYEHPO-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCC(CC=C)C(=O)N(CCC)[C@H](c1cccnc1)c1ccc(F)cc1F 467528640 HIDUWOVRXZTXDE-JOCHJYFZSA-N 384.470 5.456 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 469554408 OMXFUNUHWNIXOT-UHFFFAOYSA-N 387.483 5.426 30 20 GKED COc1ccc(/C=C\c2ccc3cc([N+](=O)[O-])ccc3n2)cc1OCCCC#N 471466413 GDSNVWCXXTXTMB-DAXSKMNVSA-N 389.411 5.005 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 473676964 PLCBLJPUNRTGMA-DLBZAZTESA-N 399.585 5.549 30 20 GKED CC(C)(C)c1ncsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 473714482 BNMSRICWTRMYJN-UHFFFAOYSA-N 391.496 5.144 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 476107106 DCNZZYSOALMFQR-YJBOKZPZSA-N 380.797 5.147 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Cl)cc2-c2cccc3ccccc23)ccn1 477133424 DSIZVUULECJZDS-UHFFFAOYSA-N 383.838 5.679 30 20 GKED CN(Cc1ccco1)Cc1ccccc1CN[C@@H]1CCCCc2cc(C#N)ccc21 481665272 ZUPPBHKLHOGYBJ-AREMUKBSSA-N 399.538 5.341 30 20 GKED CCN(C(=O)Cc1nc(-c2ccc(F)cc2)cs1)c1ccc(C#N)c(Cl)c1 484109345 IFVHVHHGRHJHED-UHFFFAOYSA-N 399.878 5.070 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487322362 GNICWOFIYKYBRJ-UZLBHIALSA-N 388.433 5.435 30 20 GKED CCN(C(=O)c1cccc(CC#N)c1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496496762 PRSVOKMOOHXOQX-RUZDIDTESA-N 397.522 5.523 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)sc2C)cc1 499797523 ICFCFAFXOLUZHF-LJQANCHMSA-N 396.899 5.380 30 20 GKED CC(C)OCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)oc2ccccc12 499998064 GOUQZQLKJNIMKS-UHFFFAOYSA-N 376.456 5.411 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)NCc2cccc(C#N)c2)c2cccs2)cc1 500232230 OIWJNQQLCPNROV-JOCHJYFZSA-N 389.524 5.332 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2cccc(C#Cc3ccccn3)c2)c1 503236710 VCMSMCXHEQTINK-UHFFFAOYSA-N 385.467 5.050 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1 503362880 IPSBLMBZNWAMOU-UHFFFAOYSA-N 382.489 5.142 30 20 GKED N#CC1(CCCSCc2csc(-c3ccccc3F)n2)CCOCC1 507701575 GVHULCNUAYOREW-UHFFFAOYSA-N 376.522 5.283 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCc3ccccc32)cc1Cl 510023282 LSMSZAAPXOVGCG-HXUWFJFHSA-N 387.870 5.590 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC(c3ccccc3)CC2)c1 513124942 YMHIMQZVIRFFPU-UHFFFAOYSA-N 396.490 5.157 30 20 GKED C[C@H](Nc1ccc(NC(=O)[C@@H](C)Oc2ccccc2C#N)cc1)c1ccccc1 518867529 KYSRPBWOTJDOQK-ZWKOTPCHSA-N 385.467 5.137 30 20 GKED C=CCOCC(=O)N(c1ccc(CCCC)cc1)c1nc2ccccc2s1 519212730 HPBQAXKYWFAYKU-UHFFFAOYSA-N 380.513 5.506 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC)c1cccc(Cl)c1 519879621 AACVLVMOZRSWDT-LJQANCHMSA-N 387.867 5.097 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCc2sc(Cl)cc21 521947885 LDFRCXQHXWRGOZ-KRWDZBQOSA-N 387.936 5.128 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CCCC4)c2)n1 523512773 RFOYUCJPDRCRKL-UHFFFAOYSA-N 379.510 5.183 30 20 GKED C[C@@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1cccc(Cl)c1 525648878 ASXDBQRKBRVPMJ-CYBMUJFWSA-N 381.888 5.001 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCc2cc(OC)ccc2C1 530394510 VFUPKBJDVJJRBR-UHFFFAOYSA-N 378.516 5.527 30 20 GKED CN(Cc1ccccc1NCc1cccc(C#N)c1)C(=O)c1cc2ccccc2o1 530675120 SDNZSUPGZOFTFC-UHFFFAOYSA-N 395.462 5.189 30 20 GKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)c1ccc(C2(C#N)CC2)cc1 540741350 FWABJUAZPHMAOZ-HUUCEWRRSA-N 386.417 5.183 30 20 GKED C[C@@H](NC(=O)c1ccn(C2CCCC2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542040215 YLQFHIPGBXLTKV-QGZVFWFLSA-N 384.483 5.028 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(C(F)F)c1Cl 543506899 KJLGZZGXJNVKHR-UHFFFAOYSA-N 382.797 6.069 30 20 GKED C=CCN(C(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C)c1ccccc1 543864284 JBNGWQLZIXDBQK-UHFFFAOYSA-N 386.373 5.502 30 20 GKED C=CCN(C(=O)c1cc(C)cc2c(C)ccnc12)c1nc2c(s1)CCCC2 555853288 NGIMHHBLNHNCIQ-UHFFFAOYSA-N 377.513 5.020 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3sccc3F)cc2Cl)c1 559521378 ODLSYACAPUGJDL-UHFFFAOYSA-N 386.835 5.244 30 20 GKED Cc1ccc(NC(=O)C[C@H](C)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 559860704 YFFAYHGVHBJSQE-FXAWDEMLSA-N 383.923 5.390 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC(CC(F)F)C2)cc1Cl 564887065 RWELLIMKSPHNHI-KRWDZBQOSA-N 389.833 5.114 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2cccs2)n1)c1ccc(Cl)c(Cl)c1 565307461 KVLGLRWCMBXZJE-GFCCVEGCSA-N 394.308 5.173 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ncc(-c4ccccc4)s3)cc2)ccn1 569681545 OGLZOSASJKPQDA-UHFFFAOYSA-N 384.464 5.481 30 20 GKED COc1ccccc1[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 571607870 NGRNPVJUTHGMGU-JOCHJYFZSA-N 396.412 5.465 30 20 GKED Cc1ccccc1[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 578266733 BCTLRMXAWSKHPH-UAPYVXQJSA-N 398.466 5.122 30 20 GKED N#CCc1ccc(CN[C@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)cc1 580369552 SPKSRUDRDNVLGO-QFIPXVFZSA-N 398.403 5.790 30 20 GKED CC(C)(C)[C@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 580508998 HMCSPAHAOPGHNC-RYUDHWBXSA-N 388.327 5.095 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603690757 PNYPEIZDMFLRFN-UHFFFAOYSA-N 398.875 5.124 30 20 GKED CCN(C(=O)c1ccc(-n2cnc3ccccc32)cc1)[C@H](C)c1ccc(C#N)cc1 604343371 YUCJSZNQVAAZMZ-GOSISDBHSA-N 394.478 5.120 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2)cc1 607274722 OLXJYRHINHBPKR-QFIPXVFZSA-N 388.430 5.340 30 20 GKED CCC[C@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608860875 MQHOJIVYEXDJQY-KUHUBIRLSA-N 389.421 5.479 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3ccccc3SCCC#N)sc2c1 609375925 NANUACIXFLBGSU-UHFFFAOYSA-N 386.929 6.121 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccccc1 609399176 DLEGFGHHOPKALO-UZLBHIALSA-N 379.529 5.553 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)cn2)c1 609626611 MMCKCKJRFUJJIR-HSZRJFAPSA-N 388.471 5.100 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 611169838 TYTQKWQLLCMCOG-CYBMUJFWSA-N 386.293 5.327 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cnc2c(F)cccc2c1 619129242 PJUKOTSIKCTKJZ-UHFFFAOYSA-N 396.306 5.157 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccc(OC)c(F)c2)C1 626534671 YIMSPGYXFPBAIR-IBGZPJMESA-N 396.506 5.708 30 20 GKED Cc1cc(F)cc(C)c1C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 666254016 SCTQVPPHLLPOAS-PJXYFTJBSA-N 385.323 5.082 30 20 GKED CCC[C@@H](C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 726532633 NHLFNNRCMWOVRS-INIZCTEOSA-N 381.526 5.011 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1nc(C(C)(C)C)no1 728299190 OOUCDZHJASRSGH-CQSZACIVSA-N 394.450 5.130 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)COC1CCCCC1 729244930 KDYMNNBKXVWWKR-UHFFFAOYSA-N 382.891 5.094 30 20 GKED CCCCCCOCc1cccc(NC(=O)NCc2ccc(C#N)cc2F)c1 729877303 ARDYJZRTPWHFBC-UHFFFAOYSA-N 383.467 5.116 30 20 GKED CCCCCCOc1cccc(/C=C/C(=O)c2ccc(C(F)(F)F)nc2O)c1 731564777 SYGRXWPJVYJNPJ-PKNBQFBNSA-N 393.405 5.661 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(OCCC(C)C)c2)c1 733843884 COUQNNSGGSSMRN-HXUWFJFHSA-N 395.503 5.114 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1nc2ccccc2s1 734175852 VPKYMHACEKBBAS-MRXNPFEDSA-N 392.528 5.097 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)cs1)C1CC1 734306410 OEZAHFKSEHORCO-YFHOEESVSA-N 394.521 5.283 30 20 GKED C=CC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccncc1 734685332 ZMOMZKAMCVXDEB-MOPGFXCFSA-N 390.314 5.552 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1OC 734981737 SQQFDLBMKMNIHW-YHYXMXQVSA-N 394.439 5.313 30 20 GKED Cc1cccc([C@@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 741396745 RWJCDEBSTOYFOV-YADARESESA-N 383.495 5.576 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)[C@@H]2SCCc3sccc32)cc1 745639220 XOWZWWDRIGKUTA-OAQYLSRUSA-N 391.517 5.361 30 20 GKED C=CC[C@H](NC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1)c1ccncc1 745827413 JXWWWIWOFIJOGA-ZEQRLZLVSA-N 383.495 5.208 30 20 GKED COc1ccc(/C=C\C(=O)c2oc3ccccc3c2C)cc1OCCCC#N 747361614 RODMIGRVLOMYRY-LUAWRHEFSA-N 375.424 5.329 30 20 GKED Cn1c([C@@H](C#N)C(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)nc2ccccc21 750677255 FGVWWLQLILMVDP-AWEZNQCLSA-N 398.293 5.178 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)/C=C/SCc3ccco3)cc2)c1 754232646 AFSQBQKCFWLCOA-ZRDIBKRKSA-N 390.464 5.116 30 20 GKED CSc1cc(O)ccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 754486820 XJCVJLDBVYGMJE-UHFFFAOYSA-N 392.505 5.389 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3nc(C)ccc3c2)cc1 759207542 CYDDWZMGIZVDFN-QVKFZJNVSA-N 385.467 5.018 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1csc(Cl)c1Cl 761478650 UWLJYOIRUJTSQU-WAYWQWQTSA-N 375.248 5.115 30 20 GKED COc1ccc(Cl)cc1[C@H](CC(C)C)N[C@H](C)c1ccc(OCC#N)cc1 776165227 ZARLZGHVFFUULH-IERDGZPVSA-N 386.923 5.689 30 20 GKED C#CCCCCCC(=O)N(CCC)[C@@H](c1cccnc1)c1ccc(F)cc1F 779953110 AHHICFFYTBWSRH-QHCPKHFHSA-N 384.470 5.272 30 20 GKED FC(F)(F)[C@@H]1CC(N[C@H]2CCC[C@@H](C(F)(F)F)C2)C[C@@H](C(F)(F)F)C1 782526253 MCSNMEVANMVMFY-RCWTZXSCSA-N 385.314 5.607 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@](C)(O)c1ccccc1Cl 789459252 PGDKVFYDODLOAT-JOCHJYFZSA-N 386.923 5.221 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)CCC1 791560118 FSROHIJOIRJUOJ-UHFFFAOYSA-N 398.528 5.234 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 793043129 KYJWIYJYWJJPND-HSZRJFAPSA-N 379.463 5.396 30 20 GKED COc1cc(C2(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)CCC2)ccc1C 797567120 DGAVGSJGYRLVLW-MRXNPFEDSA-N 382.529 5.056 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)n2)cc1 842296164 REJJREPDXBKZHF-YYDVJCTNSA-N 388.492 5.189 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915085797 CFXMTAYDWUFICT-XMMPIXPASA-N 384.479 5.519 30 20 GKED Cc1sc2ncn(N=Cc3ccc(C(C)C)cc3)c(=O)c2c1-c1ccccc1 916283513 FGJDYRTZQFKMHD-UHFFFAOYSA-N 387.508 5.439 30 20 GKED CS(=O)(=O)c1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc1 918156094 KXNWUOAHRQTBOF-OVCLIPMQSA-N 386.538 5.021 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776125302 CULDCVMQOKVEJO-VZUCSPMQSA-N 378.424 5.596 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1nc2ccccc2s1 54537861 BFNWYBLXOCMEFH-AWEZNQCLSA-N 394.500 5.180 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 66005034 FIXYYPVCAKWAEW-AWEZNQCLSA-N 382.769 5.031 30 20 GKED CCOc1ccccc1CNC(=O)c1ccccc1Sc1ccccc1C#N 72017212 NDAOUAILZKBSIG-UHFFFAOYSA-N 388.492 5.038 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 112796570 BEOJEMSXYQKOEJ-HSZRJFAPSA-N 392.499 5.008 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCO[C@H](c4ccccc4)C3)c2)c1 157261811 IXXQWALOTACEIS-AHWVRZQESA-N 398.506 5.147 30 20 GKED COc1ccc(CNc2ccc(N3CCC(C)CC3)cc2)cc1OCCCC#N 158265295 BYCNHIHZCGUWGZ-UHFFFAOYSA-N 393.531 5.226 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 158773166 MNKGGJVZGLDRJZ-KSSFIOAISA-N 394.521 5.176 30 20 GKED CCc1cnc(CN(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 175700404 BKHSNUIJPBVJGG-UHFFFAOYSA-N 392.484 5.033 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(OCC#N)cc1 180537992 ZWIKXGUXUPZVNY-LSDHHAIUSA-N 395.503 5.572 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 181428313 VHSBSERVDDANDM-AWEZNQCLSA-N 393.855 5.403 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 184333810 WYJADPIOOYWXEZ-QGZVFWFLSA-N 383.451 5.192 30 20 GKED C=C(C)[C@@H](NC(=O)CCc1nc(C)c(-c2ccccc2)o1)c1ccc(F)c(F)c1 186060021 SAWSBZXJRRBQEG-JOCHJYFZSA-N 396.437 5.294 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](COC)c1ccc(F)c(F)c1 191518244 AYEVCOBHWNUDQZ-FQEVSTJZSA-N 388.458 5.326 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)cc2F)nnc1-c1ccccc1F 195593713 OJHDFKCRBYJHLK-GFCCVEGCSA-N 375.419 5.402 30 20 GKED Cc1sc(C/N=C(/O)[C@@H]2CCC(=O)[C@@H](C)C2)nc1-c1ccc(Cl)cc1 328923889 NHZAVBIWUVVZOK-SMDDNHRTSA-N 376.909 5.234 30 20 GKED CC(C)(C)c1nc2ccc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)cc2s1 330019496 VDSMRTGIHMRZJL-UHFFFAOYSA-N 399.560 6.107 30 20 GKED CC(C)C1(c2ccccc2)CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 413573664 JTERLGFUFDFQQG-JOCHJYFZSA-N 375.516 5.041 30 20 GKED N#CC1(CC[S@](=O)Cc2csc(CCc3ccccc3)n2)CCCCC1 417151395 RHKLRGJJOIQTEA-SANMLTNESA-N 386.586 5.041 30 20 GKED CCCOc1cc(O)ccc1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 429738446 ORGXSMFWNWTVPS-AWEZNQCLSA-N 385.489 5.077 30 20 GKED C=CCn1c(S[C@H]2CC[C@@H](C#N)C2)nc2scc(-c3cccs3)c2c1=O 430090245 PVPPIJYFZBDESN-OLZOCXBDSA-N 399.566 5.157 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)C2(c3cccc(C#N)c3)CC2)cc1 435156709 YTOKFHBVHTUNTH-UHFFFAOYSA-N 384.435 5.029 30 20 GKED N#Cc1ccc(SCc2noc(-c3ccc(F)cc3F)n2)cc1C(F)(F)F 436048391 GYVIVXGOXXPBRO-UHFFFAOYSA-N 397.328 5.198 30 20 GKED CC(C)(C#N)CCCCn1cnc2scc(-c3ccc(Cl)cc3)c2c1=O 436132812 NPFQYFHYYCHPPU-UHFFFAOYSA-N 385.920 5.498 30 20 GKED Cc1cc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)ccc1OC(C)C 438405643 WYJBKUAWLBMBSB-RTWAWAEBSA-N 377.488 5.086 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(Cc1nnc(-c2cccc(C#N)c2)o1)C1CC1 438813050 KHNXAZHPRWDMJA-KRWDZBQOSA-N 394.478 5.487 30 20 GKED N#CCCCOc1cccc(N[C@H](c2ccc(Br)s2)C2CC2)c1 439133083 KYGPECLIXGHBBW-SFHVURJKSA-N 391.334 5.756 30 20 GKED N#CCC[C@@H](NC(=O)N1CCSC[C@H]1c1ccc(Cl)cc1)c1ccccc1 440245547 QTYHZMQAXZIXEF-UXHICEINSA-N 399.947 5.185 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)s1 443885788 ZMBSHCFZPSBDJO-LBPRGKRZSA-N 389.546 5.085 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(Oc3ncccn3)cc2C)CCCC1(C)C 445240640 UYCSGRRSAUGBQC-IBGZPJMESA-N 380.492 5.176 30 20 GKED C=CCn1c(SCc2nccs2)nc2cc(-c3ccccc3)sc2c1=O 446957937 CFVNCUXOPXSLIC-UHFFFAOYSA-N 397.550 5.060 30 20 GKED COc1cc(CNC(C)(C)c2nc(-c3ccccc3F)c(C)s2)ccc1C#N 449379347 HPLIRNQHPWICDL-UHFFFAOYSA-N 395.503 5.163 30 20 GKED C[C@@]1(F)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 454486914 OUAHQHYHTOMGJB-WIYYLYMNSA-N 385.870 5.351 30 20 GKED Cc1nc(Nc2cccc(C[S@@](=O)Cc3ccccc3)c2)c(Cl)cc1C#N 461955795 IPQHRVMSNQIZGN-MHZLTWQESA-N 395.915 5.108 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1cccc(Br)c1 462050986 CKWXQZXMMNFQHO-ZDUSSCGKSA-N 389.318 5.197 30 20 GKED C[C@H](NCCC(=O)Nc1sccc1C#N)c1ccc(Cl)c2ccccc12 462473574 KVLZUFZLGUSQRL-ZDUSSCGKSA-N 383.904 5.106 30 20 GKED CC(C)(C#N)CCSc1nc2ccccc2c(=O)n1-c1cccc(Cl)c1 463020475 MLEAXSXEGHSKLY-UHFFFAOYSA-N 383.904 5.071 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(F)c1Cl 463140239 KGTJYTOJUJZHMW-UHFFFAOYSA-N 380.806 5.704 30 20 GKED C[C@H](C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1cccc(C#N)c1 463943772 IDUGRLPKADJRRO-AWEZNQCLSA-N 378.834 5.760 30 20 GKED C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cn(CCCC#N)c2ccccc12 469455923 AKKHBTYJHURNDA-HKUYNNGSSA-N 389.474 5.102 30 20 GKED CCCOc1ccccc1[C@H](CC(C)C)NC(=O)N(C)Cc1ccc(C#N)cc1 470031891 KRPVAWDVZSXBJE-QFIPXVFZSA-N 393.531 5.276 30 20 GKED CCc1oc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1C 471272305 HKMCFHHZOQHFPA-UHFFFAOYSA-N 382.407 5.427 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1-c1nc2ccccc2s1)c1ccccc1 474430468 IFSUSWXPZZUAOG-SFHVURJKSA-N 397.503 5.989 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@H]1c1ccccc1 480553643 LDPJCOUIGHKNNK-GAJHUEQPSA-N 383.451 5.575 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)[C@@H]1c1ccccc1 480821133 GWMVCVONEXDZJQ-MHECFPHRSA-N 397.478 5.884 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](CC(F)(F)F)c1ccc(F)cc1 481655412 KUCBUZAZFRHFPO-PMACEKPBSA-N 376.397 5.748 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1 483124937 XGGNMLJFMKFSBK-UHFFFAOYSA-N 398.491 5.412 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1 486801734 LUBMFMIGJUCISA-HXUWFJFHSA-N 388.433 5.080 30 20 GKED N#CCC[C@H](NC(=O)Nc1ncc(Cc2ccc(F)cc2)s1)c1ccccc1 497147532 OOSOPWXTDSNLEK-IBGZPJMESA-N 394.475 5.040 30 20 GKED C[C@H](N(Cc1ccccc1)C(=O)c1cnc(C(F)(F)F)c(C#N)c1)C(C)(C)C 500588979 YQTPHUYRNDJVRR-AWEZNQCLSA-N 389.421 5.049 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1sccc1F 504179576 CLPXJTGHQAMDGX-LLVKDONJSA-N 385.304 5.330 30 20 GKED N#C[C@H](C(=O)c1ccc(OCC2CC2)cc1)c1nc2cc(Cl)ccc2s1 516713872 LKXUTLYWZWRFBK-MRXNPFEDSA-N 382.872 5.229 30 20 GKED N#C[C@@H](NC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1)C1CC1 525570516 IDDVLHRLBTTWMK-QGZVFWFLSA-N 391.323 5.318 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(-n2cccn2)cc1 537012026 AWFCVAKQWUUUSO-LJQANCHMSA-N 378.479 5.262 30 20 GKED CCN(C(=O)c1nn(-c2ccccc2Cl)cc1C)c1ccc(C#N)c(Cl)c1 539174461 UIXSTIOCGQWCSH-UHFFFAOYSA-N 399.281 5.026 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(-c4nc5ccccc5[nH]4)c3)cc2)CC1 539593020 FFWRQYYMFGCCEJ-UHFFFAOYSA-N 378.435 5.037 30 20 GKED CCn1c(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2ccccc21 541066647 MFJDHBWCPCMVPV-GOSISDBHSA-N 380.495 5.446 30 20 GKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1CCC(F)(F)CC1 554212586 YOCDHSWSMSUGKY-UHFFFAOYSA-N 385.414 5.392 30 20 GKED N#C[C@@H](C(=O)c1ccc(CN2CCCC2)cc1)c1nc2cc(Cl)ccc2s1 556182008 OTLMXVFHSKRMGU-KRWDZBQOSA-N 395.915 5.036 30 20 GKED C=CCC[C@H](NCC(=O)Nc1c(F)cccc1F)c1ccc(C(F)(F)F)cc1 557571295 BMCOPYYQDSSDFH-KRWDZBQOSA-N 398.375 5.219 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1 557653374 QTTCLPUOESLYLB-LJQANCHMSA-N 391.490 5.014 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(c2ccc(F)cc2)CCCC1 561238024 LAKXWDDKBDYUDH-UHFFFAOYSA-N 383.511 5.020 30 20 GKED Cc1csc(NC(=O)c2sc(-c3ccc(Cl)s3)nc2C)c1C#N 573909221 HOXPCTYVXOSAEV-UHFFFAOYSA-N 379.919 5.327 30 20 GKED C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@@H](CCCC#N)c1ccccc1 577881470 AMZLOHKHQDVUFO-GCJKJVERSA-N 397.950 5.102 30 20 GKED C=CCCCN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 605644601 QWGOKYWDXFBCNQ-MSUUIHNZSA-N 388.536 5.821 30 20 GKED Cc1cccc(C)c1OCCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N 609437004 JIXWIUBGUGPWCT-SFHVURJKSA-N 397.544 5.288 30 20 GKED CCc1nc([C@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cs1 609508287 BSTRKWUPUVFYDX-HNNXBMFYSA-N 391.496 5.055 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)c2ccc(C#N)nc2)c2cccs2)cc1 609641394 XDCMQCIVHAWQFX-QVKFZJNVSA-N 375.497 5.048 30 20 GKED C[C@@H](Cc1ccccc1F)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 609968129 HQJUPNLJLCCRNR-KRWDZBQOSA-N 388.442 5.094 30 20 GKED Cc1cccc(C)c1CSCC(=O)Nc1ccccc1SC[C@H](C)C#N 610007472 BAYQHLAHHGDRTA-OAHLLOKOSA-N 384.570 5.427 30 20 GKED COc1ccc(-c2nc(CSc3ccc(C#N)cc3F)cs2)cc1OC 610165739 KYNRRKAAWRTLNC-UHFFFAOYSA-N 386.473 5.130 30 20 GKED N#CCCCOc1cccnc1NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1 610227931 XLODSDLXSWEKEU-JOCHJYFZSA-N 399.494 5.119 30 20 GKED C[C@@H](CNC(=O)N[C@H](C)c1cccc(C#N)c1)c1c(Cl)cccc1Cl 610355446 QVSGTYGEIZVELB-QWHCGFSZSA-N 376.287 5.029 30 20 GKED CCC[C@@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610356015 HGFDGEKGFHDZPV-AUUYWEPGSA-N 389.421 5.479 30 20 GKED CC[C@H](CNC(=O)c1c(Cl)cc(C#N)cc1Cl)Oc1ccccc1Cl 611094883 DEKVEUBMNPKRFZ-GFCCVEGCSA-N 397.689 5.106 30 20 GKED Fc1ccc(-c2nc(CN3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)co2)cc1 618455148 YOXWRLXKCGHBGP-RYUDHWBXSA-N 396.306 5.043 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 618759111 UAJFPXNKAHTZLR-SBUREZEXSA-N 388.515 5.055 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Br)cc2F)C2CC2)cc1Cl 619755518 JYVGYVWFCVKTRS-SFHVURJKSA-N 393.687 5.354 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC[C@@H]2CCC[C@@H]21 646439166 NSOOETGEYDHYRI-GWCFXTLKSA-N 398.322 5.382 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 662082408 UMGJMXMWDDRIIN-BGYRXZFFSA-N 381.545 5.128 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C=C(\C)c1ccccc1Cl 727626935 JFWTWIJROVUQKK-LLLGYDHXSA-N 394.902 5.216 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(CC[C@H](O)c3ccccc3)c2)cc1 727763991 SLYIYBYHOIPAHS-DEOSSOPVSA-N 387.479 5.170 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)c(Cl)[nH]3)cc2)c1 728032511 MFXVYXQBDLHSLC-UHFFFAOYSA-N 386.238 5.024 30 20 GKED N#CCCCCOC(=O)[C@@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1 730646689 YAWBUOJRLJYQIQ-SFHVURJKSA-N 378.255 5.351 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)sc1Cl)c1ccc(Cl)c(Cl)c1 731643164 CXMODDRUCLHGCQ-JTQLQIEISA-N 380.083 5.356 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 732495869 IZNRFFJNJVGXKX-WFASDCNBSA-N 386.929 5.554 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2ccnc3c(Br)cccc23)c1 733793363 XLWVNKYMSRELMZ-HNNXBMFYSA-N 396.288 5.290 30 20 GKED C=CC[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccncc1 734361703 WRUVTKQVJWPBOF-JOCHJYFZSA-N 379.463 5.344 30 20 GKED C=CC[C@@H](NCc1ccc(OCc2cccs2)c(OC)c1)c1ccncc1 734510506 WIFNCVGRCUFIMA-HXUWFJFHSA-N 380.513 5.138 30 20 GKED Cc1ccc(-c2noc(CSCc3cc(Cl)ccc3OCC#N)n2)cc1 735318012 HXICVGZOIPOBIG-UHFFFAOYSA-N 385.876 5.034 30 20 GKED N#CCOc1ccccc1C(=O)OCc1ccc(Oc2ccccc2F)c(F)c1 736794686 CCIKPXQJAIVJDP-UHFFFAOYSA-N 395.361 5.016 30 20 GKED C[C@H](Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)c1ccc(C#N)cc1 743477823 QKGULOATXQNISD-INIZCTEOSA-N 377.488 5.025 30 20 GKED C=CC[C@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccncc1 745826356 UTEMVTCXCYJOHE-NRFANRHFSA-N 385.458 5.131 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc(OC)c3ccccc23)cc1OC 750900692 ABZQFEWPVVANSC-BENRWUELSA-N 392.451 5.160 30 20 GKED COc1cc2c(cc1NCc1nnc(-c3cccc(C#N)c3)o1)oc1ccccc12 760448781 ZEMHSZYWSCIOJH-UHFFFAOYSA-N 396.406 5.128 30 20 GKED CC(C)(C#N)c1ccccc1CN(Cc1ccccc1)C[C@H](O)c1ccsc1 767902469 PVIUQSFJLNXVSQ-QHCPKHFHSA-N 390.552 5.285 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1CCC(c2nnc3n2CCCC3)CC1 772962831 GRFGYELVDKXXKZ-IBGZPJMESA-N 388.600 5.097 30 20 GKED C=CCC[C@H](NC(=O)N1CC=C(c2ccc(Cl)nc2)CC1)c1ccccc1 773641574 ROZTYVIMBNWEFV-FQEVSTJZSA-N 381.907 5.241 30 20 GKED C[C@H](NCc1ccc(-c2ccc3c(c2)CCCO3)cc1)c1ccc(OCC#N)cc1 776155870 JDNPHJABYIDCHX-IBGZPJMESA-N 398.506 5.432 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@@H](C#N)C3CCCCC3)c12 776374804 UDSVKYYQYDSPGT-IBGZPJMESA-N 394.519 5.001 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2cccnc2)c2cc3ccccc3o2)c1 779411733 HIXQYOQEZSKVSU-OFVILXPXSA-N 397.478 5.388 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(-c4ccccn4)s3)cc2)c1 779594052 BVXCXWBODLRACU-UHFFFAOYSA-N 398.491 5.268 30 20 GKED CCOC(=O)Nc1ccc(NCc2ccc(SC(F)F)cc2)cc1C#N 781921093 RYDXWURHKSQPBL-UHFFFAOYSA-N 377.416 5.053 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc([N+](=O)[O-])cc1Cl 782188986 MPMLYGXWQLEGNQ-ZZXKWVIFSA-N 376.846 5.329 30 20 GKED N#Cc1ccc(-n2ccc(NCc3ccc(CSC(F)F)o3)n2)c(Cl)c1 782388150 XSJFSUQHGFBBJW-UHFFFAOYSA-N 394.834 5.058 30 20 GKED C[C@@H](SCC(=O)Nc1ccc(SC(F)F)cc1)c1cccc(C#N)c1 785537572 QWYATYMOSRFKBY-GFCCVEGCSA-N 378.469 5.306 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 792230231 VMLWTQYVMZHMPH-IERDGZPVSA-N 387.487 5.462 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC(F)(F)C1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 796648508 CDSYDKULEYIHSB-SYIJETQGSA-N 390.499 5.223 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797572668 FOOPUNZCPZZHID-KRWDZBQOSA-N 396.556 5.615 30 20 GKED O=C1/C(=C\c2ccc(Cl)c(C(F)(F)F)c2)C[C@@H](C(=O)O)c2ccccc21 806560913 PXVHEGDEAJGPPP-SMJHDNPOSA-N 380.749 5.197 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)o1 806561372 UWKNRNMWJROTEH-FIIODCPWSA-N 376.383 5.232 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cc(Cl)ccc1C(F)(F)F 806667994 DRTWMXABYJVTNS-SNVBAGLBSA-N 383.757 5.294 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CCC1)c1cc(C(F)(F)F)ccn1 813211920 SYYMUXSTADWDMA-HNNXBMFYSA-N 378.781 5.052 30 20 GKED N#C[C@H](C(=O)CC(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813218197 SWYJSOXKXSTSPS-FQEVSTJZSA-N 394.396 5.499 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(-c3ccccc3)cc2F)cc1 915857283 QWFKJPOQBGQNOL-UHFFFAOYSA-N 376.456 5.236 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 916849504 WULNHPNENUEYLH-OFVILXPXSA-N 394.499 5.945 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 916948467 GUZAAIKYDJDIKD-OWIUFQIYSA-N 394.437 5.216 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCn2cnc3ccccc32)cc1 917119564 MPGBCIWQPVJQAD-QFIPXVFZSA-N 394.478 5.111 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2o1 917509832 BNEPICOXLQSQEQ-FPISAVPCSA-N 388.423 5.585 30 20 GKED C[C@@H]1CCC[C@@H](CCN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)C1 1307546016 KUOSDWLWGGENTR-MSOLQXFVSA-N 388.515 5.363 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C)c2nc(C(=O)O)cs2)cc1 1776788219 RLXSDFICXTWZRD-OAHLLOKOSA-N 376.522 5.041 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc(OCc3ccccc3)c1)C2=O 1777682935 HBQKKJGVDDLTSZ-STZFKDTASA-N 398.458 5.566 30 20 GKED N#Cc1ccc(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)c([N+](=O)[O-])c1 14318837 KLTYRBOSUXTJHH-UHFFFAOYSA-N 384.347 5.032 30 20 GKED Cc1ccc(Cl)cc1NC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 14738862 QJRKYNCTMDRDDH-UHFFFAOYSA-N 376.843 5.205 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1Oc1ccccc1Cl 29780393 PQEAFNDTOPUJLD-HNNXBMFYSA-N 392.842 5.410 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-n2ccnc2)c1 47514601 AMKUAQQCTXOQEB-UHFFFAOYSA-N 396.475 5.147 30 20 GKED COc1ccc(-c2nc(-c3cn(CCC#N)c4ccccc34)cs2)cc1OC 57943047 YKOGYRSXDSHSEL-UHFFFAOYSA-N 389.480 5.363 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1c(C(C)C)cccc1C(C)C 58412360 LYLIXKUUGZWIDS-UHFFFAOYSA-N 393.531 5.486 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl 64743579 FPCFUZQZVFSEQY-LLVKDONJSA-N 378.259 5.099 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 66953470 SLDDYEHIZSHODP-UHFFFAOYSA-N 377.366 5.157 30 20 GKED C=CCn1c(S[C@H](C)c2ccncc2)nc2sc3c(c2c1=O)CC[C@H](C)C3 72033792 ABFJURVEOZOMAK-UONOGXRCSA-N 397.569 5.017 30 20 GKED O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc(F)cc1F 102153021 KVHXEPJIWDUJAT-UHFFFAOYSA-N 399.237 5.020 30 20 GKED CCCCCCCC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 105747153 WTJBGVCBHARCKQ-UHFFFAOYSA-N 396.409 5.850 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)C(=O)Nc1ccc(F)cc1Cl 108408211 ITPWXRYKDFRGOP-STQMWFEESA-N 391.899 5.170 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nc(-c2cccc(Cl)c2)no1 109002349 OJRCJPYSIHJVCA-CYBMUJFWSA-N 384.892 5.396 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(CCC(=O)Nc1ccccc1C#N)C1CC1 110985553 ADZJSIFBCKLXIG-GOSISDBHSA-N 383.495 5.266 30 20 GKED N#Cc1ccsc1C(=O)N(CCc1ccccc1)c1nc2ccccc2s1 127984885 QGMZVWCNNOJLGZ-UHFFFAOYSA-N 389.505 5.119 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 128589158 MLGROLYEMYZGCG-NRFANRHFSA-N 389.430 5.108 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nnc(-c2cccc(Cl)c2)o1 133836453 XTZKTLRUVNOQRK-ZDUSSCGKSA-N 384.892 5.254 30 20 GKED CN(C(=O)c1cccc(SCC#N)c1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 163255467 UOJKKAOPLPORLL-INIZCTEOSA-N 398.837 5.331 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1cccc(Cl)c1 175134037 QAPOYJOFDYUQHL-JZUUQJBKSA-N 379.872 5.138 30 20 GKED C[C@@H]1CCC[C@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)[C@@H]1C 215992122 WQQVRIFZUMFFID-LZJOCLMNSA-N 378.541 5.405 30 20 GKED CC(C)(C#N)c1ccc(Nc2cc(C(F)(F)F)nc(-c3cccnc3)n2)cc1 301325046 YDSWMBNHNUBUGI-UHFFFAOYSA-N 383.377 5.102 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 303487153 PJQNCGKULHNSLC-JSNMRZPZSA-N 386.417 5.290 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl 303834714 PFZMJJVKBCUZHS-RDBSUJKOSA-N 388.895 5.473 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(/C(O)=N/[C@@H]3CCOC4(CCC4)C3)c12 330196475 QHMABCHBZJYJAX-MRXNPFEDSA-N 398.551 5.024 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)c(F)cc1N1CCCCC1 425688712 ZXECKUGUCHYGEW-HNNXBMFYSA-N 398.457 5.052 30 20 GKED N#Cc1c(F)cccc1CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 428504494 UXSFHGDMIPSFRR-MRXNPFEDSA-N 390.302 5.499 30 20 GKED N#CC1CCN(C(=O)Nc2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 429658384 ORJSZDHXVDRVGI-UHFFFAOYSA-N 389.377 5.265 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12 432830385 FSYQQZXLKHEPOC-UHFFFAOYSA-N 386.411 5.039 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1CN(C)c1ccccc1)c1ccc(C#N)cc1 433768275 ZDKIOKRIIFRKRI-GOSISDBHSA-N 384.483 5.077 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1(c2cccc(C#N)c2)CC1 435361470 LIZKCFCSOABIIW-LJQANCHMSA-N 396.490 5.677 30 20 GKED C[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1cccc(C(F)(F)F)c1 437109040 GSYLOSGGABWYPB-YCMKEVRSSA-N 389.421 5.013 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2C)c(C(F)(F)F)c1 440059760 GAPNMWGQFOKWKK-ZDUSSCGKSA-N 392.446 6.028 30 20 GKED C[C@@H](c1ccc(C(=O)Nc2cccc(OCCCC#N)c2)cc1)C(F)(F)F 454864904 RCQXMUAHFDUNNR-AWEZNQCLSA-N 376.378 5.287 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 460438365 SFLMJYQAQHIBLN-JOCHJYFZSA-N 399.494 5.147 30 20 GKED N#CCCSc1ccccc1NCc1cc(Br)ccc1Cl 462228457 VTZOFEPYFILKPY-UHFFFAOYSA-N 381.726 5.720 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 464160143 VNUMJWCTKZVEDK-SFHVURJKSA-N 396.343 5.104 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1cccc(C(F)(F)F)c1 464413693 DNBSJIWMGKFUQG-CQSZACIVSA-N 392.446 5.671 30 20 GKED Cc1cccc([C@@H]2CCCCN2CC(=O)Nc2ccccc2SCC#N)c1C 464782516 XMUXCARBRSPNSE-NRFANRHFSA-N 393.556 5.085 30 20 GKED CN(CC(F)F)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 465237273 XAAHECZXTJLKFO-UHFFFAOYSA-N 399.319 5.098 30 20 GKED N#CCSCCCN(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 466713992 SOULHEZHFAMNKX-UHFFFAOYSA-N 394.462 5.577 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cc2cccc(F)c2o1 474710513 QBUSEAIXGHMLNJ-UONOGXRCSA-N 397.475 5.706 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 474780833 SKGXBAOYWUMZEP-UHFFFAOYSA-N 396.450 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1 475565684 FTYZRVHDHQATHH-HSZRJFAPSA-N 392.543 6.306 30 20 GKED C=CC[C@@H](C)NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 477451304 IZWSTPDPMOEHIX-RNEBZRLMSA-N 397.403 5.190 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@H]1c1cccc(OC)c1)c1ccc(F)c(F)c1 477736464 ANAJJTYGIGDQAP-SFTDATJTSA-N 386.442 5.137 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 477755316 PCTINKZCBBQXDN-HXPMCKFVSA-N 380.385 5.263 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)c(Cl)c1)c1nc2ccccc2s1 477864907 QVLBVVSYXAYKIY-JTQLQIEISA-N 391.677 5.202 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)c(F)c2)c2ccccc2Cl)cc1 479456286 SJTMGAXWQZSZIX-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CCc1c(NC(=O)Nc2cc(C#N)ccc2OC(C)C)cnn1C(CC)CC 483850817 KPMQUTMEWFDKQJ-UHFFFAOYSA-N 383.496 5.109 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1 485762310 IANSSRLZKCIYKR-UHFFFAOYSA-N 389.524 5.417 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1)c1ccccc1 487512353 HOOYNJCBXUYXCI-FQEVSTJZSA-N 377.875 5.500 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 490282245 GAWAPKACJFQPRS-ZDUSSCGKSA-N 387.361 5.054 30 20 GKED COc1cccc([C@H](NC(=O)NCC(C)(C)CCC#N)c2ccccc2Cl)c1 498034889 ADOSBSUYLLARNU-FQEVSTJZSA-N 399.922 5.067 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(c2ccc(Br)cc2)CC1 503544163 XUNFOYZCOLQACV-UHFFFAOYSA-N 398.304 5.041 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1F 504131555 OFTDSYDKKURABR-UHFFFAOYSA-N 387.817 5.120 30 20 GKED CC[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(Cl)s1 510743744 APEIFDOLWYDMNA-MRXNPFEDSA-N 376.909 5.090 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(OC)c1C(C)C 511027994 MAVRKCKWPHYFDI-HNNXBMFYSA-N 398.528 5.474 30 20 GKED N#CCSc1cccc(-c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)c1 512029645 BPYPTJJLLOSHTJ-HNNXBMFYSA-N 393.365 5.430 30 20 GKED COc1ccc(-c2ccc(C)c(NC(=O)C[C@@H](CC#N)c3ccccc3)c2)cn1 512990677 FTHJPSNMHZHEDX-HXUWFJFHSA-N 385.467 5.092 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@H](C)C(=O)Nc1ccccc1-c1ccccc1 518013257 QKMNUNNLCAFLBU-GOSISDBHSA-N 399.494 5.452 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 520294743 PFUKNOXXXZUCBK-JXAWBTAJSA-N 398.466 5.313 30 20 GKED COc1cccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 520597861 HXLRQDVKSCXFQS-MRXNPFEDSA-N 387.439 5.242 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(F)c(F)cc3Cl)cc2)c1 520913760 SLSKCIOKDVPFQJ-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 521209014 NGXSQUUQJGXSFV-SFHVURJKSA-N 379.504 5.426 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccccc3F)cc2Cl)c1 524248966 ORKBBURBSBPCBD-UHFFFAOYSA-N 395.821 5.574 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2ccccc2c1 524389741 ZQCDYJMKFXOMCA-UHFFFAOYSA-N 392.458 5.851 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cccc(Cl)c2Cl)c1 524429418 ZCYHUQYRJWGDSI-UHFFFAOYSA-N 397.261 5.696 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2s1 527497258 FEQJHDRZKYHJET-HUUCEWRRSA-N 395.553 6.178 30 20 GKED Cc1cc(C(=O)NC[C@@H](C)C#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 530642778 HFICTBZWBBMLDF-JSGCOSHPSA-N 390.314 5.364 30 20 GKED Cc1cc(C(=O)Nc2ccc(C#N)c(Cl)c2)ccc1NC(=O)c1cccs1 535419043 KXPHGFOOLSASJS-UHFFFAOYSA-N 395.871 5.086 30 20 GKED C[C@H](Nc1cccc(C#N)n1)c1nc(-c2ccc(Br)cc2)cs1 535888031 JQRURPQXUQMHNF-NSHDSACASA-N 385.290 5.012 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(C(=O)OC(C)(C)C)c1 539843791 HOCYEOCMZPWGHW-OAHLLOKOSA-N 396.512 5.288 30 20 GKED C=CCC(CC=C)c1nc(-c2cccc(NC(=O)c3ccccc3F)c2)no1 546978175 SZKNPQQZYRTWOF-UHFFFAOYSA-N 377.419 5.364 30 20 GKED N#CCCN(C(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccc(F)cc1 554164178 KWUNHLRPPAHDGN-UHFFFAOYSA-N 397.453 5.389 30 20 GKED C[C@H](C1CCCCC1)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555005005 DAZULWFKMULNLM-MRXNPFEDSA-N 378.476 5.178 30 20 GKED COCC[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)c(Cl)c1 562100621 UIBQEIWISBIOCY-PMACEKPBSA-N 375.299 5.220 30 20 GKED CC(C)C[C@@](C)(NC(=O)CCCCCC#N)c1cccc(Br)c1 588982929 ULXKADFMBCXCMB-LJQANCHMSA-N 379.342 5.301 30 20 GKED COc1cc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)ccc1C#N 589473393 RLAMJSRXAMOUSY-UHFFFAOYSA-N 391.279 5.018 30 20 GKED N#Cc1cccc(C(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)n1 589740624 CXGAFIVTOSZUSC-UHFFFAOYSA-N 390.855 5.195 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N(C)Cc5ccc(C#N)cc5)(C4)C2)C3)cc1 603514138 QSCALLFLVRPCLL-XWYWGPMTSA-N 398.550 5.363 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 609286873 FSVDWLXCBRRHKY-LJQANCHMSA-N 398.293 5.082 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(C)c(Oc2ccncc2)c1 609641941 LXTZVDZTNDFPJA-UHFFFAOYSA-N 385.467 5.106 30 20 GKED CC(C)n1c(S[C@@H](C#N)C2CCCCC2)nc2cc(Cl)ccc2c1=O 609648758 XFYDWBYXFLCHBM-KRWDZBQOSA-N 375.925 5.195 30 20 GKED C[C@@H]1c2cccn2CCN1C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609730973 HBBCCAZGDMICBE-OAHLLOKOSA-N 391.858 5.022 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 609967829 JXEIMARDUBGZBV-INIZCTEOSA-N 388.433 5.508 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H](C)c1cccs1 609968004 YCZKIBVFRIJQIZ-INIZCTEOSA-N 378.472 5.404 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)C1 612302731 VMGQEIZLAIQLAR-OAQYLSRUSA-N 383.879 5.077 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)C1 612371118 YVDLIEXJDJRDLE-SEPOPDPSSA-N 397.478 5.080 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1nc2ccccc2s1 613289561 NUFSDKDEVQDXRU-QGZVFWFLSA-N 385.492 5.537 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccccc1COCc1ccccc1 618751195 UGGRHMJWHPHJHS-XMMPIXPASA-N 397.478 5.084 30 20 GKED Cc1ncncc1[C@H](C)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 655779594 OKNJHFTZFICHGQ-JTQLQIEISA-N 381.295 5.248 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(C#N)cc1 725837366 FDHQHNKBXVPXOB-UHFFFAOYSA-N 387.443 5.205 30 20 GKED Cc1ccc(Br)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726470409 WBKWOKKGMZQPTM-UHFFFAOYSA-N 380.698 5.092 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1sc(C)nc1C 726737173 KVDDADPMIHPKCX-UHFFFAOYSA-N 393.541 5.576 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1 727654347 LLQFHXYHPSVJQC-XGICHPGQSA-N 396.899 5.626 30 20 GKED N#CCCCCOC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 728112205 JHAKMRGGZKJPKC-UHFFFAOYSA-N 394.902 5.513 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1sc2cc(Br)ccc2c1Cl 729842785 NDQLPWQHVVENRR-INIZCTEOSA-N 399.741 5.375 30 20 GKED Cc1nc(SCC(=O)N[C@@H](C)c2csc3ccccc23)c(C#N)c(C)c1C 729959903 LHLZLKPAVGXMOT-HNNXBMFYSA-N 395.553 5.063 30 20 GKED CC(C)COc1ccc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 730399289 XODGUTCGSCVMQY-QGZVFWFLSA-N 398.915 5.403 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(C3SCCS3)c2)c1 731964266 XTPNGJGBLAQRHR-UHFFFAOYSA-N 398.553 5.225 30 20 GKED C=CC[C@@H](NCc1ccc(-c2cccc(Br)c2)o1)c1ccncc1 734509166 HYGWODHPAPICIA-LJQANCHMSA-N 383.289 5.511 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2cccc(F)c2)cc1 734964672 YVGIPSTXPMRBOK-IERDGZPVSA-N 380.463 5.009 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740060764 XCWNBIIQKMPQLR-UHFFFAOYSA-N 395.915 5.282 30 20 GKED COc1ccc(/C=C2/COc3ccc(C(C)C)cc3C2=O)cc1OCCCC#N 747361360 LIMOFWUDCPOSLF-UNOMPAQXSA-N 391.467 5.160 30 20 GKED COc1cc(C(=O)/C=C/c2ccccc2OCc2ccccn2)ccc1SC 747614574 IJNVCJAGIXHMDC-ZRDIBKRKSA-N 391.492 5.287 30 20 GKED COC(=O)c1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)o1 749454216 ZGDSDILRDCJAJW-SSZFMOIBSA-N 389.432 5.099 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(CCC(F)(F)F)c2)cc1Cl 753966970 YEZCRAXGZRJVNU-UHFFFAOYSA-N 383.826 5.515 30 20 GKED Cc1ccc(Cn2nc(C)c(C=NOc3ccccc3C(F)(F)F)c2C)cc1 754712757 SFIQMGAJFJUFDI-UHFFFAOYSA-N 387.405 5.288 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 756505395 RCKIEFRKLPWYAN-MLFXKNMZSA-N 376.843 5.125 30 20 GKED C[C@H](OC(=O)c1ccccc1SCc1cscn1)c1cccc(C#N)c1 764613182 LMZZOXWGYAFSQN-AWEZNQCLSA-N 380.494 5.225 30 20 GKED Cc1cc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c(C)c(C)c1O 774839847 INAAAAGOSWHYDT-UHFFFAOYSA-N 386.451 5.020 30 20 GKED C#CCOc1ccccc1NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12 775942805 NUSREPJBSNWQSH-CQSZACIVSA-N 396.899 5.020 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc3c(ccc4ccccc43)o2)c1 776165687 UUFMGBZHHNONOM-PXNSSMCTSA-N 384.479 6.118 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCCC1 780668674 DTIJXSYJAXZZRX-VFNWGFHPSA-N 381.451 5.170 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccccc1CC(F)(F)F 782779444 JBDVLIOEBKRWPI-UHFFFAOYSA-N 378.394 5.333 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c1 796472495 XHLFZUNCAXRMIF-QGZVFWFLSA-N 396.680 5.380 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccncc1 796480872 AKHBSJITAFMYSX-HSZRJFAPSA-N 379.463 5.344 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801913293 BXIVRLNFUVFGHI-QYZOEREBSA-N 390.380 5.014 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(Cl)c(Cl)c1 813211461 KTTALXCCLFFLLG-CABZTGNLSA-N 387.188 5.387 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1cc(C(F)(F)F)ccn1 813212180 ZCNBFTBGWUAGAK-AWEZNQCLSA-N 394.343 5.067 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813213078 IOMKFONUFVQFNK-AWEZNQCLSA-N 389.402 5.060 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)ccc2c1 813216886 HLSPVSBKUVXXID-JFLVJKQUSA-N 396.368 5.152 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1ccccc1 817318937 IZSOQQUMOFGDMW-ROUUACIJSA-N 378.369 5.267 30 20 GKED CCc1oc2ccccc2c1C=NOCC(=O)Nc1c(C)cc(C)cc1Cl 836821867 DEQMRUODAAATTI-UHFFFAOYSA-N 384.863 5.255 30 20 GKED Fc1ccc(-c2ccc(C=Nn3c(S)nnc3-c3cccs3)s2)cc1 839395951 PEPJVIGCPOSRPT-UHFFFAOYSA-N 386.502 5.045 30 20 GKED C[C@]1(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C[C@@]1(F)Cl 844501329 BIGIBPLJWPTYIR-JBACZVJFSA-N 385.870 5.168 30 20 GKED CC[C@@H](c1ccccc1)N(CC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)C(C)C 852690969 UYEOYKWXUGXUNK-IRLDBZIGSA-N 398.510 5.085 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc4sccc4nc3Cl)c2C#N)C1 857567639 BWONWGZUOCVBPM-SECBINFHSA-N 387.917 5.260 30 20 GKED COc1cccc(-c2nc(/C=C3\CCOc4ccc(F)cc4C3=O)cs2)c1 861416204 LEIHIFVGEFJLEJ-UKTHLTGXSA-N 381.428 5.007 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2coc(-c3ccc(Cl)cc3)n2)CCC1 899386902 SLFYSOUTFVVJCD-RUZDIDTESA-N 376.909 5.108 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 915088061 YXOUKIZJHOXMIC-XMMPIXPASA-N 396.490 5.561 30 20 GKED Clc1nc(Nc2ccccc2)sc1C=NNCc1cccc2cccnc12 915961708 BPYFQZHOUVLACF-UHFFFAOYSA-N 393.903 5.212 30 20 GKED COc1cc([C@H](C)/N=C\c2cc(Cl)ccc2O)ccc1OCc1ccncc1 915981407 RTBDOZAXHALXNL-UXIIITNFSA-N 396.874 5.208 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)cc1 916948007 QVZVPUHYOFSURP-MLGOLLRUSA-N 389.282 5.468 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917024913 CJOXTVMGENEIIT-DYVFJYSZSA-N 398.940 5.821 30 20 GKED N#CCOc1cccc([C@@H]2Nc3ccccc3C(=O)N2c2cccc(Cl)c2)c1 917502509 YXIGQVMZPUMPIX-OAQYLSRUSA-N 389.842 5.013 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)oc2c(C)cccc12 919713819 IGVSMNLPICALID-JOCHJYFZSA-N 380.447 5.957 30 20 GKED CCOc1ccccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919773630 VHIVCPKCDCCNFS-JOCHJYFZSA-N 385.467 5.062 30 20 GKED C=CCn1c(Cc2ccccc2)nn(CN(Cc2cccs2)C(C)C)c1=S 919954033 HFZOFJKQRDXQSN-UHFFFAOYSA-N 398.601 5.120 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccc(N2CCOC2=O)cc1 920749756 NXPYWAIGWQSTNF-LUAWRHEFSA-N 393.439 5.407 30 20 GKED CCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776112843 MMGVFPGKTOYGHH-FMIVXFBMSA-N 376.408 5.199 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cs1 1776280459 PTMBPPZFJUHJEF-CSKARUKUSA-N 381.453 5.295 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc(CC(=O)O)c(F)c2)cc1 1776786616 JTEOBONGBAOSLP-UHFFFAOYSA-N 385.479 5.608 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777316325 XKDLYWCNKXWJQL-PQMHYQBVSA-N 392.838 5.610 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2ccccc2C(=O)O)cc1 1777545295 APCJSIURFROPJX-KAMYIIQDSA-N 388.467 5.342 30 20 GKED CC(=O)c1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 41548759 MEHOZTZTYGKERT-JTQLQIEISA-N 394.399 5.069 30 20 GKED Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4cc(C#N)ccc4C)cc3)o2)c1 63961808 VZYVTGXIVMJMEP-UHFFFAOYSA-N 394.434 5.144 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(F)cc1 66956318 WKFOTVLQAHHDSL-DNVCBOLYSA-N 383.492 5.589 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)CC1 108528350 CJYCBVAMIWLUJD-ICSRJNTNSA-N 393.556 5.740 30 20 GKED Cc1csc(-c2ccc(NCc3cn(CCC#N)nc3-c3ccccc3)cc2)n1 125052035 MZWBDYTXCKXUBN-UHFFFAOYSA-N 399.523 5.508 30 20 GKED Cc1cccc(OCc2nnc(SCc3ccccc3C(C)(C)C#N)o2)c1 130095636 ZBZJERGXKKEEQR-UHFFFAOYSA-N 379.485 5.051 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ccc(F)cc2OCC#N)c1 135294359 GMZINQUPQCOYCV-FQEVSTJZSA-N 381.451 5.186 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(NC(=O)c2ccoc2)c1)c1ccccc1 155488481 ZECYLMXHEYLXOR-NRFANRHFSA-N 389.455 5.361 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(CCC(F)(F)F)CC3CC3)c2)cc1 175364103 NWBMORCAGLGLQT-UHFFFAOYSA-N 388.389 5.155 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1c1ccncc1 191503443 OWVDAJLDHQZJDN-JOCHJYFZSA-N 377.532 6.083 30 20 GKED CC(C)(C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1cccc(Cl)c1 303747233 GLCLDCZWYMJKCG-UHFFFAOYSA-N 395.915 5.175 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1/C(O)=N/[C@H]1CCOC2(CCC2)C1 329716006 VVNJWLSDAGVUAH-ZDUSSCGKSA-N 395.286 5.363 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)c1 409923621 QFRGZPGPSOPYOC-OLZOCXBDSA-N 397.208 5.209 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425670847 GPKOKKGDEQVOIA-IBGZPJMESA-N 390.531 5.472 30 20 GKED COc1cccc(Oc2ccc(NC(=O)c3cccc(SCC#N)c3)cc2)c1 429873813 SHTHOISYDFWJGY-UHFFFAOYSA-N 390.464 5.355 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(c3ccccn3)C3CCCC3)cc2)cc1 430271898 YXJXZIHIABIDNS-UHFFFAOYSA-N 397.478 5.529 30 20 GKED N#CCSc1cccc(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)c1 430699105 GKVGAFMULPWJDU-INIZCTEOSA-N 377.296 5.026 30 20 GKED CCSc1cccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 433120708 OTVJZKNCHXDLTC-HNNXBMFYSA-N 385.558 5.372 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 438062535 WSGMNAUKHXTOSH-XUTJKUGGSA-N 381.907 5.079 30 20 GKED N#Cc1ccc(CSCCC(=O)Nc2ccccc2Cl)c(OC(F)F)c1 439539895 HJMMQPMMIUHKOL-UHFFFAOYSA-N 396.846 5.075 30 20 GKED CCCCc1ccc([C@@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 441232752 LWXFVXPJECBEHL-QHCPKHFHSA-N 388.515 5.438 30 20 GKED C[C@H](C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1cccc(C#N)c1 462198829 JJSMFHPRLNNSTQ-INIZCTEOSA-N 381.435 5.032 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](OC)c1ccc(Cl)cc1 475552511 ZLDIBQLBCRRDLA-HXUWFJFHSA-N 386.923 5.701 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C(=O)OCC)c1ccccc1 475553318 OIAMJRMLIYOLHZ-NRFANRHFSA-N 394.515 5.007 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@]2(C1)OCc1ccccc12 475564303 ACNRYJHSEPVQNO-RUZDIDTESA-N 390.527 5.592 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc2cc(Cl)ccc2s1 475572342 XUFIZPPSXZQGDH-UHFFFAOYSA-N 399.947 6.123 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1cccc(COC(C)(C)C)c1C 475962590 RDHJQLWHDVUFDR-UHFFFAOYSA-N 382.504 5.197 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F)c1ccccc1 476622934 GGQOLVDTMPFWIA-PGRDOPGGSA-N 396.412 5.647 30 20 GKED C=CCCCC(=O)Nc1nc(C)c(-c2nc3ccccc3n2C(F)F)s1 479525044 JHQYOKUZODCHBR-UHFFFAOYSA-N 376.432 5.158 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc2ncsc2c1 485641868 XBJGHCOXHGKVTH-HNNXBMFYSA-N 383.476 5.326 30 20 GKED N#CCCN(C(=O)CCc1cc(Cl)cs1)C12CC3CC(CC(C3)C1)C2 486561232 NXFGXYNXWROSEJ-UHFFFAOYSA-N 376.953 5.045 30 20 GKED C=CCC[C@@H](C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 487762771 QXJKCOJDOCOVRX-DOTOQJQBSA-N 383.442 5.359 30 20 GKED CCCC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(OC)cc1 491922196 SWDULXKYSSXORK-NRFANRHFSA-N 379.504 5.549 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(OCCC(C)C)cc2)cc1 497831871 PGKWBWFMPJFTFX-UHFFFAOYSA-N 380.488 5.071 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3ccncc3)n2)o1 504488696 NBJGLZBMMQWNDA-UHFFFAOYSA-N 375.375 5.228 30 20 GKED CCc1cccnc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 506014142 FAODPWQLUTYLPW-UHFFFAOYSA-N 377.831 5.214 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1/C=C/c1ccccc1 506641500 FKUFEBMLCUYDHZ-UJEKTLITSA-N 391.540 5.791 30 20 GKED CCN(Cc1csc(-c2ccc(OC)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 507705349 WORWVIPMQCJWQZ-INIZCTEOSA-N 377.513 5.273 30 20 GKED C=CCN(Cc1nnc(-c2cc(C)c(CC)s2)o1)Cc1ccc(Cl)s1 508797766 XUYTYXPRYOAWGF-UHFFFAOYSA-N 393.965 5.572 30 20 GKED CCN(C(=O)Cc1c(F)cccc1C#N)[C@H](c1ccccc1)c1ccc(F)cc1 510662573 CWGXYGOPRVLYAO-XMMPIXPASA-N 390.433 5.017 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2ccc(C#Cc3ccccc3)cc2)c1C 516340278 QISAWTYQPGHVNX-UHFFFAOYSA-N 396.490 5.386 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1c(F)cc(F)cc1F 517447263 FDDRYDXPXCBJQS-NSHDSACASA-N 396.459 5.229 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 517659190 XPMQWHMZGOTAFM-QFIPXVFZSA-N 396.490 5.483 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1[N+](=O)[O-] 521089746 WZAFEQXKUZTFQZ-UHFFFAOYSA-N 387.395 5.014 30 20 GKED C[C@H](NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1ccc(C#N)cc1 521606136 GKHGGQLZEYYOPB-AOMKIAJQSA-N 390.483 5.408 30 20 GKED CCCc1ccccc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 522091344 XJJGZZYZBQYRTC-UHFFFAOYSA-N 377.488 5.022 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 522127045 MDMGFCRBDLCQEA-IBGZPJMESA-N 385.467 5.261 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)c1occc1COc1cccc(C#N)c1 523947130 YRADRJOSYMJMJO-UHFFFAOYSA-N 394.858 5.046 30 20 GKED C=CCn1c(SCc2nc(-c3ccsc3)oc2C)nnc1-c1ccoc1C 524008001 VHQBHZGHFRQHDX-UHFFFAOYSA-N 398.513 5.350 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccn(Cc2ccccc2)c1=O 530560797 JVBDDXVTCZANEJ-UHFFFAOYSA-N 386.495 5.001 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(CC1CCCCC1)C1CC1 532921865 RITBCCWHFGTPJI-QGZVFWFLSA-N 385.577 5.064 30 20 GKED Cc1c(Br)cccc1NCc1cn(CCC#N)nc1-c1ccccc1 538823681 UKHGXPKFNJORCM-UHFFFAOYSA-N 395.304 5.147 30 20 GKED N#CCC[C@@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccccc1 539050599 NJFROMGDNJGGBQ-WOJBJXKFSA-N 391.515 5.961 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccnc(Oc4ccccc4Cl)c3)cc2)CC1 539621181 MHURVYVOVVPBMQ-UHFFFAOYSA-N 389.842 5.335 30 20 GKED COc1ccc2c(c1)c(C(=O)N1CCC(CC#N)CC1)c(C)n2C1CCCCC1 541049252 JECONKFQAGDFIZ-UHFFFAOYSA-N 393.531 5.229 30 20 GKED C[C@@H](CCNC(=O)c1cc(C#N)ccc1Cl)c1cccc(C(F)(F)F)c1 552299936 RFMDFKSPILAIBA-LBPRGKRZSA-N 380.797 5.154 30 20 GKED C=CCOc1ccc(CNC(=O)c2occc2CSc2ccccc2)cc1 552717603 USPKGWREGMBBER-UHFFFAOYSA-N 379.481 5.067 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N(CCC#N)c2ccc(F)cc2)cc1 558049770 ZJLNVTLKTDNQID-UHFFFAOYSA-N 393.487 5.055 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(Cc3cccnc3)no2)c1 559969039 ROVYLDRMIYXXOQ-UHFFFAOYSA-N 388.814 5.040 30 20 GKED Cc1ccc(-c2c(C)sc3nc(CSCC4(C#N)CCC4)nc(O)c23)cc1 580883340 SGQQIXPMSSACJM-UHFFFAOYSA-N 395.553 5.608 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)C2)c1 589365573 QRAYYIFQWCCKMR-IBGZPJMESA-N 398.466 5.075 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1cn(C)nc1C1CCCCC1 590815364 IVOGYHKNCAGUNW-OAHLLOKOSA-N 397.548 5.364 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2Cl)on1)c1nc2cc(F)ccc2s1 592973809 IASNFRDIWFOMTB-GFCCVEGCSA-N 397.818 5.234 30 20 GKED COc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C3(C#N)CC3)cc2)cc1 602757248 GRVHLXXXYJLOPH-QHCPKHFHSA-N 395.462 5.021 30 20 GKED COc1cc(C(=O)Nc2sc3c(c2C#N)CCCC3)ccc1OC1CCCC1 603806925 ADQZGOAFHFDQMW-UHFFFAOYSA-N 396.512 5.081 30 20 GKED N#CCCCOc1cccc(NC(=O)CCc2ccc(-c3ccccc3F)o2)c1 603972404 CDYBKLJGCLSJJG-UHFFFAOYSA-N 392.430 5.340 30 20 GKED Cc1occc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 604316400 ISDRMXHGLGPMJL-LJQANCHMSA-N 379.847 5.219 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](Cc2ccc(C)cc2)c2ccccn2)c1 604666090 SCCSJAIBGYNMJY-HSZRJFAPSA-N 387.483 5.060 30 20 GKED N#C[C@@H](C(=O)c1cc2occc2s1)c1nc(-c2ccc(Cl)cc2)cs1 606146193 LOIPTZUTJSQKMU-LBPRGKRZSA-N 384.869 5.761 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2ccc(NC[C@H]3CCCO3)c(F)c2)c1 606943751 JSKWIUFIBGPZEG-LJQANCHMSA-N 399.466 5.016 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 610097774 QXSSCGMRYICJLS-CYBMUJFWSA-N 377.366 5.121 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)c[nH]c12 610156946 JHJCXMLBHWSPKL-UHFFFAOYSA-N 381.435 5.322 30 20 GKED N#CCn1c(C(=O)N2CCc3cc(-c4cccc(F)c4)ccc32)cc2ccccc21 610309607 OLJZUPJNYLWZBX-UHFFFAOYSA-N 395.437 5.174 30 20 GKED CCCN(Cc1ccccc1F)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 610331097 SEKOYPSHVWJNNM-UHFFFAOYSA-N 379.357 5.160 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccnc1Oc1ccccc1 615506648 ZGFUDYPVMDSNTQ-UHFFFAOYSA-N 389.455 5.103 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c1C 637024072 PETFTDJJRGYNEP-AWEZNQCLSA-N 397.544 5.171 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(F)ccc2s1)c1nc(-c2ccccc2)cs1 642281917 YODDCMFHPZIJFM-HNNXBMFYSA-N 378.453 5.654 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)O 659802078 ORTXYOGDMDGMMQ-KDURUIRLSA-N 384.479 5.283 30 20 GKED O=C(Nc1cc(F)ccc1F)NC(CCC(F)(F)F)CCC(F)(F)F 664404187 ASZDMZKWSLCNIG-UHFFFAOYSA-N 378.263 5.140 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1c(C)c(C(C)(C)C)nn1-c1ccccc1 666085977 RGCAEQDSWCDDAR-KDURUIRLSA-N 378.520 5.193 30 20 GKED C=C(CNC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1)c1ccccc1 672482623 CYSTZWBKVSGIPD-UHFFFAOYSA-N 385.467 5.082 30 20 GKED O=C(Nc1cccc(F)c1Cl)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 672847138 BUNAFWDSVORHKG-OCAPTIKFSA-N 392.702 5.074 30 20 GKED N#Cc1cccc(NC(=O)c2sc3cc(Br)ccc3c2Cl)c1 729824278 OBZKDPZFDMTENV-UHFFFAOYSA-N 391.677 5.441 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730421462 KNPMFGPMEGMTQG-KXBFYZLASA-N 384.501 5.429 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730422095 TYMFEFALBWGTKT-NVQRDWNXSA-N 388.508 5.089 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)cc1 731958757 AULITOORPUYQNV-UHFFFAOYSA-N 382.419 5.183 30 20 GKED CC[C@H](NC(=S)Nc1ccccc1SC[C@H](C)C#N)c1cccs1 734378421 AKWDVOICXXWHFX-KGLIPLIRSA-N 375.588 5.438 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccccc1Oc1cccc(C)c1)c1ccncc1 734669869 VSPFVAPHZVLQBR-JOCHJYFZSA-N 387.483 5.299 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1cncc(F)c1 737426817 DKNHYSLGVPBECU-UHFFFAOYSA-N 377.448 5.037 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 741865662 ZEKLESZSIFDBBE-UHFFFAOYSA-N 389.977 5.971 30 20 GKED Cc1ccccc1O[C@@H](C)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743095518 LASLDZWKELZODK-CVDCTZTESA-N 399.494 5.240 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3cc(F)ccc3F)n2)cc1 744034369 HGJFRQNTGHJAGP-BPQIPLTHSA-N 394.446 5.377 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)cc1F 746439205 JBTBLLOXTBFODH-CYBMUJFWSA-N 384.222 5.444 30 20 GKED Cc1nn(C)c(Cl)c1/C=C/C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750915262 CUIZHXBXSUBSEQ-ONEGZZNKSA-N 396.718 5.316 30 20 GKED COc1cc(F)c(C(=O)/C=C\c2ccc(-c3ccccc3OC)cc2)cc1OC 760271138 ZHDVSCHIAULMGT-RAXLEYEMSA-N 392.426 5.415 30 20 GKED CC(C)c1ccc(NC(=O)N2CCO[C@H](c3cccc(C#N)c3)C2)c(C(C)C)c1 761825535 SLTXYMQLSPYXDF-QHCPKHFHSA-N 391.515 5.410 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCC[C@H]2c2ccccc2)cc1 762819103 RDNAZKQGQHFUJS-RPBOFIJWSA-N 395.506 6.101 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1cc(Br)ccc1F 763122434 QHHVJEQLHFYMPX-ALCCZGGFSA-N 389.249 5.003 30 20 GKED C#Cc1cccc(NC(=O)N2CCSC[C@@H]2c2cccc(C(F)(F)F)c2)c1 776296153 CMJHZJFBQNJUSN-GOSISDBHSA-N 390.430 5.009 30 20 GKED CC(C)(C)SCCSCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 783564657 IDSKIGWCNCTICY-OAHLLOKOSA-N 390.599 5.251 30 20 GKED CCCc1c(NC(=S)Nc2ccccc2Cl)cnn1-c1cccc(C#N)c1 783951683 FNCUSZFEXLDENU-UHFFFAOYSA-N 395.919 5.159 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc(Cl)cc2Cl)c(-c2ccncc2)n1 788346192 RLTCJFMHHJKROX-DJWKRKHSSA-N 397.265 5.062 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1nccc2ccccc12 792104925 SJCXBMHHYAMDBO-BZSNNMDCSA-N 381.262 5.522 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)cc1 810184462 REGFZHXCVXOYGK-YOEHRIQHSA-N 383.904 5.088 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c(C)n1Cc1ccccc1 813210946 BQDDVUDOPZUXQW-IBGZPJMESA-N 397.400 5.057 30 20 GKED Cc1ccc(C(=O)O[C@H]2CC[C@@](C)(C#N)CC2)cc1NC(=O)c1ccccc1F 836160982 WIPKDHGWZZCKHD-LBEPJEHYSA-N 394.446 5.016 30 20 GKED CC(=NOCc1ncc(-c2ccccc2)o1)c1nc2ccccc2n1C(F)F 836976854 HCPCAJSMEGOCAP-UHFFFAOYSA-N 382.370 5.027 30 20 GKED CCCCCCOCc1cccc(NC(=O)N2Cc3cccc(C#N)c3C2)c1 844522417 YZZAIAZYQPYGAN-UHFFFAOYSA-N 377.488 5.203 30 20 GKED CC(C)c1csc(SCC(=O)Nc2ccccc2SC[C@H](C)C#N)n1 845329932 HCRATLREQPOVAU-CYBMUJFWSA-N 391.587 5.249 30 20 GKED COc1cccc(-c2nc(/C=C3/CCOc4ccc(F)cc4C3=O)cs2)c1 861416203 LEIHIFVGEFJLEJ-LCYFTJDESA-N 381.428 5.007 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(COc2ccccc2F)no1 904728417 ITCRAIJMNLFNCY-UHFFFAOYSA-N 394.324 5.038 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3cccc(Cl)c3)CC2)cc1 915085390 LIQAJOLXCRVZQW-QFIPXVFZSA-N 386.882 5.666 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354235 XUOYWCMWEIMCBX-OXQOHEQNSA-N 375.497 5.628 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\Sc2ccccc2)cc1 916953544 DAYCKIQANMVCPC-ODYGUOKUSA-N 378.497 5.153 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)sc2ccc(F)cc12 920112941 NOEOJKQCFPZXSR-CYBMUJFWSA-N 399.397 5.584 30 20 GKED CCC[C@H](NCc1ccc(OC)c(O[C@@H](C#N)CC)c1)c1ncccc1Cl 925397486 PJDUZRRXWDUYIO-AEFFLSMTSA-N 387.911 5.056 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776032328 ZAUNFFZHKUTPCX-UHFFFAOYSA-N 378.516 5.742 30 20 GKED CC(=NNc1ccc(C(=O)O)nc1)c1ccc(Oc2ccc(F)cc2)cc1Cl 1776071017 WSRVBEPGOKZBJK-UHFFFAOYSA-N 399.809 5.201 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cccc(CC(=O)O)c2)cc1 1776125661 PKOUUDWZEPUPNW-GDNBJRDFSA-N 380.484 5.559 30 20 GKED O=C(O)/C=C/c1ccc(/C=C\C(=O)c2ccccc2OCc2ccccc2)cc1 1776126659 SOWLHOPAHGTVNY-QUDUTFMFSA-N 384.431 5.260 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1Cl 1776354490 FNLATMWGJLNRAB-UTCJRWHESA-N 384.815 5.468 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Oc3ccc(F)cc3)cc2)cc1C(=O)O 1777361050 SJYJYPLCWCYMFU-OIXVIMQBSA-N 392.382 5.221 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1OCc1ccccc1F 1777436400 RJZTXDNVTKPRDN-SEYXRHQNSA-N 390.410 5.307 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@H]3CCC5)o2)cc1O 1777670952 FZRWOTHLHGGFQZ-QUYZQLMHSA-N 386.403 5.050 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c2ccccc2n1 32291695 XNEBJDZSXBFGRV-UHFFFAOYSA-N 393.446 5.246 30 20 GKED C=CCn1c(SCc2ccncc2)nc2scc(-c3cccs3)c2c1=O 60708634 BZZMBRYTRADGNC-UHFFFAOYSA-N 397.550 5.060 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(F)c1 66955207 CXRYVJJTGAVIMJ-BEFAXECRSA-N 383.492 5.589 30 20 GKED C=CCCO[C@@H](C)C(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 69315819 DPYAFZCXFRGFCN-INIZCTEOSA-N 396.512 5.341 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(OCC(F)(F)F)c1C 69688285 ADXIWXCAUIAHER-UHFFFAOYSA-N 384.423 5.218 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2cc(Cl)ccc2Cl)c1 102210998 KLRQFOHDPVLROV-UHFFFAOYSA-N 387.222 5.289 30 20 GKED N#CCOC(=O)c1c2c(nc3ccccc13)/C(=C\c1c(F)cccc1Cl)CC2 104378945 UPJYFNVTKIMRAH-SEYXRHQNSA-N 392.817 5.194 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)c2)n1 123845048 FMBMMTQRTLTTHK-OAHLLOKOSA-N 387.386 5.022 30 20 GKED Cc1ccc(Cl)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 126543480 GQSNIYSZUKDFAT-KRWDZBQOSA-N 377.856 5.134 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H](C)c1c(C)noc1C 132942470 RKMIZRZMFRMLCT-OAHLLOKOSA-N 389.455 5.396 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 151788568 LUSRPJWUEMDAFP-NRFANRHFSA-N 382.847 5.087 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)C(=O)Nc1ccccc1C(F)(F)F 154159138 MRSKHGZGEACZAX-SNVBAGLBSA-N 384.810 5.350 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3)o2)nnc1-c1cccs1 155813206 AJONXLDUDIVUQR-UHFFFAOYSA-N 380.498 5.140 30 20 GKED Cc1nc(NC(=O)C(C)(C)c2cccc(C(F)(F)F)c2)sc1SCC#N 171274310 PPOSITSAZZXFDZ-UHFFFAOYSA-N 399.463 5.002 30 20 GKED CCN(C(=O)c1csc(Cc2ccc(F)cc2)n1)c1ccc(C#N)c(Cl)c1 179521307 IAIDQLGFFUYKCG-UHFFFAOYSA-N 399.878 5.065 30 20 GKED Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccccc1SC[C@H](C)C#N)CC2 187131073 RAMHRGHITNFKCB-MRXNPFEDSA-N 379.529 5.145 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc(N)c2c(C)c(C)sc2n1)c1ccc(F)c(F)c1 187795542 DEMJWYRDWJDZJW-GTNSWQLSSA-N 388.487 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C[C@@H](C)O)c1ccccc1 191478745 XTSVJPKDZCXQLV-NQIIRXRSSA-N 380.532 5.215 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1 298482710 PYYILQDKUNEYSD-WFXMLNOXSA-N 391.515 5.147 30 20 GKED CC(C)[C@@H](NC(=O)CSc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 303204880 PJRYJHJBIGIBKV-LJQANCHMSA-N 392.446 5.183 30 20 GKED CC(C)c1nc2c(n1C)CCN(C(O)=Nc1ccc3c(c1)oc1ccccc13)C2 329657618 GWFWWAWTYXVHKY-UHFFFAOYSA-N 388.471 5.047 30 20 GKED Cc1cscc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 429373188 QMZZUKMTTPUZIC-LBPRGKRZSA-N 393.320 5.977 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc1NC(=O)CC(C)C 430587100 YGRSRSWMMWCRSN-MRXNPFEDSA-N 397.544 5.224 30 20 GKED CCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 432675038 HOAXIPQSAVBMIH-GOSISDBHSA-N 398.894 5.245 30 20 GKED CCN(C(=O)CN[C@@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 433009372 HHMCINSEYIHMMU-QHCPKHFHSA-N 385.511 5.217 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)[C@H]1CC[C@H](SCC)C1 437104251 OATPLAQSWNTAJZ-GJZGRUSLSA-N 387.467 5.016 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c[nH]cc2-c2ccccc2)cc1F 437475680 MIJVCLAJSSOSFP-UHFFFAOYSA-N 397.409 5.737 30 20 GKED C[C@H]1CCC[C@@H](C)N(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 437984136 GLZFVOGDEOPGKL-DLBZAZTESA-N 395.478 5.319 30 20 GKED Cc1cc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)ccc1OC(C)C 438444457 JJCLGMKLBCSDOW-UHFFFAOYSA-N 379.504 5.344 30 20 GKED O=C(Nc1ccccc1F)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444026338 TWZWTERVANLTOT-CQSZACIVSA-N 394.290 5.660 30 20 GKED C/C(=C/c1nc(COCC(F)(F)C(F)F)no1)c1cccc(C(F)(F)F)c1 445757785 HYBKXICPGRJBNJ-UITAMQMPSA-N 398.278 5.066 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458808292 YWHXVTXNZQOFER-RTWAWAEBSA-N 393.535 5.088 30 20 GKED Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)CCCCOc2cccc(C#N)c2)cc1 464049866 LVURLLNQMQRIRF-RPWUZVMVSA-N 390.527 5.211 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(CC(F)(F)F)c3)c2)cc1 464431903 WSSWIRRAGXHTQA-UHFFFAOYSA-N 396.368 5.708 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@H](C)c1ccc(F)cc1F 466429147 VQBABJWLFMYUJN-LBPRGKRZSA-N 384.879 5.181 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)c2c(F)cc(C#N)cc2F)c1 466621130 YAAUIXQVAOJYJW-UHFFFAOYSA-N 397.812 5.040 30 20 GKED C[C@H](C#N)C(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 468182400 HTVSGAFGBYKPFJ-CKEIUWERSA-N 377.875 5.016 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469078217 PNGRCQRIRSSJCH-NRFANRHFSA-N 375.516 5.011 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)c1 469713602 VRSOBHJSOYENMK-UHFFFAOYSA-N 396.372 5.162 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 471992497 PAIUJVJJJXYCTL-HNNXBMFYSA-N 397.466 5.401 30 20 GKED Cc1c(C(=O)N[C@@]2(C#N)CCc3ccccc3C2)oc2c1ccc1ccccc12 472282744 XXBSHNNPHSIUIW-VWLOTQADSA-N 380.447 5.076 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)Nc3cc(C#N)ccc3C)cc2)cs1 476886677 YHCVGTWPZFVKBZ-AWEZNQCLSA-N 376.485 5.181 30 20 GKED N#CCCCCN[C@H](Cc1ccccc1F)c1ccccc1Br 482441235 SGVOVXCIIKJDHG-LJQANCHMSA-N 375.285 5.155 30 20 GKED C[C@@H]1SCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@@H]1C 483049685 JDCCFNOBWXZBFN-ZRGWGRIASA-N 399.947 5.353 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc4ccccc4c3C)n2)cc1 484560553 VOWZNHVCYNRHRV-SFHVURJKSA-N 399.475 5.165 30 20 GKED CC(C)Oc1ccc(Cn2cc(C#N)c(=O)c3cc(Cl)ccc32)cc1Cl 488762762 IRVXYVVUGPKFGW-UHFFFAOYSA-N 387.266 5.015 30 20 GKED C=CCn1c(S[C@H](CC)c2ccccc2)nnc1[C@H]1COc2ccccc2O1 494119289 KFIVVGCZDVWDAR-WOJBJXKFSA-N 393.512 5.220 30 20 GKED CC[C@@H](C)Sc1ccc(NCC(=O)Nc2cc(Cl)ccc2C#N)c(C)c1 498644321 FSVKJROYDUMELF-CQSZACIVSA-N 387.936 5.461 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 499454772 QLTKHKFHGHYNPN-UHFFFAOYSA-N 386.451 5.319 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H]1CCOc2c(Br)cccc21 503889214 WBUIJRUTGPZNSU-PMACEKPBSA-N 397.316 5.202 30 20 GKED CCSc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 504176601 QPWPBNIUKMWVGJ-UHFFFAOYSA-N 378.453 5.095 30 20 GKED C=CCCc1ccccc1NC(=O)N1CC[C@H](OCCCc2ccccc2)C1 505001458 UBOCFBVXCYFIOM-QFIPXVFZSA-N 378.516 5.061 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(NC(=O)C2CCCC2)c1 505023136 JUGFFRJRCNNTOJ-UHFFFAOYSA-N 391.515 5.256 30 20 GKED CCOc1ccc([C@H](NC(=O)c2cc(C#N)ccc2Cl)c2ccccc2)cc1 505320013 IWGMLDHQTXIARH-JOCHJYFZSA-N 390.870 5.130 30 20 GKED N#C[C@@H](NC(=O)c1sccc1-c1ccccc1)c1cccc(Br)c1 506522847 DVEFTHDSPXPLEE-QGZVFWFLSA-N 397.297 5.172 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1ccc(C#N)cc1F 506871149 DTCGRQZUVZKNGK-UHFFFAOYSA-N 377.419 5.286 30 20 GKED C[C@H](CC#N)NC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 512012029 XFLXTQUNPPUOMI-GFCCVEGCSA-N 379.312 5.318 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cccc(COc2ccccc2C#N)c1 513117657 FCMIYZQZWAAHJD-UHFFFAOYSA-N 388.492 5.027 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1c(Cl)cccc1Cl 514643520 NIFYTFXFAYFFNN-UHFFFAOYSA-N 385.703 5.390 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 517658336 GZTUNRZMMQRNNO-STQMWFEESA-N 391.286 5.606 30 20 GKED CNc1snc(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 517820849 MRNMGMATSHPBGI-INIZCTEOSA-N 396.903 5.054 30 20 GKED CCN(Cc1cccc(F)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 519199024 JSSZIJSBQKANLK-UHFFFAOYSA-N 389.430 5.544 30 20 GKED CN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccc2ccccc12 524383900 AWAVVOHRMNWNJS-UHFFFAOYSA-N 382.419 5.160 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(F)(F)C[C@@H]1C 528945433 SFVOSIBLFYYTRN-HNNXBMFYSA-N 385.414 5.311 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1cccc(OCCCC#N)c1 538527503 MGPSKZLHHZQKPL-OAHLLOKOSA-N 395.503 6.113 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(NC(=O)c3ccco3)cc2)CC1 539923169 PCGCEYMGHXFBKB-UHFFFAOYSA-N 385.467 5.348 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@@H]2CC23CCCCC3)cc1 540043119 ZVDXLGIOJPWKSX-JOCHJYFZSA-N 389.499 5.176 30 20 GKED C[C@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccc(-c2cccc(C#N)c2)cc1 542106418 MQCCJJGBYWJQGI-ZWKOTPCHSA-N 395.506 5.522 30 20 GKED CCN(C(=O)Nc1ccc(C#N)cc1OC)[C@@H](C)c1cccc(C(F)(F)F)c1 546708626 GNFKXWBFHSWKFT-ZDUSSCGKSA-N 391.393 5.201 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N1CCC(CCC#N)CC1 564655180 OAGQZTAEEUYRIR-UHFFFAOYSA-N 377.488 5.122 30 20 GKED C=CCn1c([C@H]2CCO[C@@H]2C(C)(C)C)nnc1N1CCCC[C@H]1c1ccccc1 567314077 XKFXNXFUXGMAEE-ACRUOGEOSA-N 394.563 5.114 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567653905 LQWFRCVSIGKUJS-UHFFFAOYSA-N 386.455 5.188 30 20 GKED N#Cc1ccc(/C=C(\CC(=O)O)c2nc3ccccc3s2)c(C(F)(F)F)c1 583844662 VEWIYNFLCLHAFI-MDWZMJQESA-N 388.370 5.202 30 20 GKED N#Cc1ccsc1NC(=O)CS[C@H](c1ccccc1)c1ccc(F)cc1 584851489 ZGFZRDHDKDIDMT-LJQANCHMSA-N 382.485 5.220 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCc2sccc2[C@@H]1c1cccs1 593953677 IBFZJTZLTJBTIC-YCRPNKLZSA-N 392.549 5.034 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cnn1-c1ccccc1 603996620 YMKWQBPSGWZOAE-UHFFFAOYSA-N 390.512 5.025 30 20 GKED N#Cc1cc(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)ccc1F 609103281 JIGJKEOFHVEDRV-UHFFFAOYSA-N 386.382 5.275 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 610055173 IOLGBYKMQYBMSA-HSZRJFAPSA-N 385.467 5.359 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)c[nH]c12 610153621 BKFMFBYJWGEAGR-UHFFFAOYSA-N 395.462 5.108 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1cccc(C#N)c1 610362129 BMWYLQRGULPNSJ-QGZVFWFLSA-N 397.503 5.213 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(Br)c3ccccc3c2)n1 645964127 YBEDCPSHGJGORA-HNNXBMFYSA-N 399.313 5.672 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1F 675737559 HTGDCNUDSSCCNR-SVDPJWKOSA-N 375.303 5.525 30 20 GKED C[C@@H](NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 726460436 BPIDXBKPZOLYOH-DNVCBOLYSA-N 377.538 5.451 30 20 GKED CCCCCNC(=O)[C@H](C#N)C(=O)c1cc(C)c(-c2cccc(Cl)c2)s1 726732977 NTJUGPZFJZHLHE-MRXNPFEDSA-N 388.920 5.006 30 20 GKED Cc1c(NC(=S)Nc2ccc(C#N)c(Cl)c2)cccc1OCC(F)(F)F 727705788 ZDFOJVUQPWBZRY-UHFFFAOYSA-N 399.825 5.270 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C\c1ccccc1C#N 728005585 ADKKALZRDGEBJS-XFXZXTDPSA-N 386.426 5.237 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC(C)C)cc2)c([N+](=O)[O-])cc1OC 728442005 SRZRNWXWPAONJK-JXMROGBWSA-N 387.457 5.009 30 20 GKED Cc1cccc2c1C/C(=C\c1cn(Cc3ccccc3)nc1-c1cccnc1)C2=O 729151949 YZTCGVURSVFLKR-FYJGNVAPSA-N 391.474 5.124 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1sc2cc(Br)ccc2c1Cl 729842786 NDQLPWQHVVENRR-MRXNPFEDSA-N 399.741 5.375 30 20 GKED N#CCOc1ccccc1C(=O)O[C@H]1CCc2c(OCc3ccccc3)cccc21 730426620 ASXKREJPQDANQK-DEOSSOPVSA-N 399.446 5.012 30 20 GKED Cc1cc(C)cc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 730664611 NFCZFASERAFZFZ-DVECYGJZSA-N 383.495 5.842 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1nc2cc(F)ccc2s1 730924407 YWMNAUJEZMQXPM-CEXWTWQISA-N 386.451 5.569 30 20 GKED CN1CCCc2cc(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)ccc21 731980385 YDKYNUIVRDICCV-UHFFFAOYSA-N 397.478 5.180 30 20 GKED C=CC[C@@H](NCc1ccc(-c2ccccc2Br)s1)c1ccncc1 734510474 VVIRLMLXNQSTMT-LJQANCHMSA-N 399.357 5.980 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2c(Cl)nc(Cl)n2C)cc1 741468396 FHQCBOXPSSQHAT-VAWYXSNFSA-N 387.266 5.299 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 742960325 CVUFYZNEKTXABI-XFXZXTDPSA-N 383.382 5.013 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(C#N)c1 743095485 KOVUMUUBHVSHBP-GAJHUEQPSA-N 380.451 5.096 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@@H](C)C[C@@H]2c2ccccc2F)c1=S 743374226 PGXSQLOKTIWBPF-MAUKXSAKSA-N 398.507 5.040 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 747108142 MFJBKPCJXNYSIY-PWSUYJOCSA-N 395.673 5.098 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc1OCCCC#N 747361488 PTTQTDJCPXMMEW-XQRVVYSFSA-N 396.295 5.642 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CNc1ccccc1SC[C@H](C)C#N 749272787 XERGNQHENWQNSV-OAHLLOKOSA-N 396.947 5.698 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCSc2ccc(Cl)cc21 753143314 DGEQRMLVLQVFGI-UKTHLTGXSA-N 384.913 5.621 30 20 GKED N#Cc1cc(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)c(Cl)c([N+](=O)[O-])c1 764307823 VPYXTCKMNSPPKD-DLBZAZTESA-N 391.814 5.015 30 20 GKED C=CCOc1ccccc1CN[C@H](C)c1ccc(SC(F)F)c(OC)c1 765908462 NJVJWCUGHKFWRQ-CQSZACIVSA-N 379.472 5.426 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1csc(-c2c(F)cccc2F)n1 768017164 PGTXYAGGLBPUDP-UHFFFAOYSA-N 398.434 5.246 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1sc(-c2ccccc2)nc1C(F)F 768819259 ZXXAFHGFKGGUDA-UHFFFAOYSA-N 378.444 5.625 30 20 GKED Cc1cn(-c2ccccc2)nc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 769861568 DQCNWKUYZJUMRN-QHCPKHFHSA-N 392.462 5.089 30 20 GKED COc1cccc2[nH]cc(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c12 778597120 NFBFPDOKHFOVIA-OAQYLSRUSA-N 395.462 5.013 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnn4ccccc34)cc2Cl)c1 779596119 SGYYSORDLBMXIH-UHFFFAOYSA-N 388.858 5.050 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC1(c2cccc(Cl)c2)CCCC1 780677321 FTVLPVMJFXTMTB-HNNXBMFYSA-N 383.879 5.222 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC2CC(c3cccc(Cl)c3)C2)ccc1OC 783569533 UJOAORWKPPEEMQ-UUKMXZOPSA-N 384.907 5.065 30 20 GKED CC[C@@H](C)c1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 787351941 IOXFORPPHGELAO-QGZVFWFLSA-N 389.499 5.035 30 20 GKED N#Cc1ccc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c(F)c1 796469854 KEOQBTPMJFMQNM-QGZVFWFLSA-N 396.680 5.380 30 20 GKED O=C(Nc1cc(F)ccc1OC(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801682392 RAABGJLSZJCHFC-ZDUSSCGKSA-N 381.247 5.095 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)OC(=O)CCCCCC#N 805884965 XVXBLBUPJZMVTL-CQSZACIVSA-N 376.909 5.850 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 808235694 BTMODXBAEJIJPK-UHFFFAOYSA-N 399.237 5.008 30 20 GKED COc1c(O)cccc1/C=C(\C(=O)c1ccccc1)c1nc2ccccc2s1 810195737 BYBLYKKFDRIGMJ-SAPNQHFASA-N 387.460 5.434 30 20 GKED Cc1cc(C#N)cnc1C(=O)O[C@@H](c1cccc(F)c1)c1cccc(Cl)c1 815980527 ONAJTRDCRYNSHL-HXUWFJFHSA-N 380.806 5.001 30 20 GKED C=CCN(CCC#N)C(=O)c1cc(-c2ccc(Cl)s2)nc2ccccc12 816802874 BLTZWZLNDZQVQL-UHFFFAOYSA-N 381.888 5.159 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(CCC(F)(F)F)no2)c1 904868455 AJWDPBSJHUVHCI-UHFFFAOYSA-N 393.752 5.549 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 915087994 YIJAVDVEKBILSR-SFHVURJKSA-N 381.262 5.901 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351566 FHRGOISFYRSCOF-QFIPXVFZSA-N 389.886 5.659 30 20 GKED CC[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 915352369 KMNXXJUUMOVKPB-NTKDMRAZSA-N 383.495 5.657 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1cc2ccccc2o1 916907248 XHSNTGPZNOZTMT-GOSISDBHSA-N 396.402 5.186 30 20 GKED Cc1ccc(SCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 917047526 ZIGMXOXAAKMREV-AWEZNQCLSA-N 386.929 5.535 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cccc(COc3ccccc3)c2)cc1 917856853 ZIMNDVOISAQBTE-UHFFFAOYSA-N 388.492 5.009 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc3scc(-c4cccs4)c3c(=O)[nH]2)cc1 6509859 KYWLNSAHDNVCQW-ZSOIEALJSA-N 395.896 5.322 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(OCC#N)cc2)ccc1OCc1ccccc1 15352541 FZWPGYUSZIZPKW-NTUHNPAUSA-N 399.446 5.073 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2cccc(C)c2C)c1 22729412 ORVSOAWTKVGQSA-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 24618700 GFISXEAVISVPLJ-UHFFFAOYSA-N 375.497 5.096 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(CCC(=O)Nc1sccc1C#N)C1CC1 63576962 QDQOPRZNBUZNQE-MRXNPFEDSA-N 389.524 5.327 30 20 GKED C=CCOc1cccc(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)c1 65878422 AUDIXIJIKFZXIX-UHFFFAOYSA-N 378.497 5.173 30 20 GKED C=CCn1c(SCc2ccc(OC(F)(F)F)cc2)nnc1-c1ccoc1C 71842344 OHEURMCKWNGPFS-UHFFFAOYSA-N 395.406 5.223 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3c(s2)CCC3)cc1 97699580 NVTOKYQKQYRQRI-UHFFFAOYSA-N 388.492 5.134 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(CCc2ccccc2)Cc2ccncc2)cc1 106940352 MMVHXIVWZMXIQM-UHFFFAOYSA-N 398.510 5.160 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1F 109039536 WGWVVICXZLMEDQ-AAEUAGOBSA-N 386.398 5.207 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)N(CCC#N)Cc2ccco2)c1C 122496030 YKINDWOURSBERY-UHFFFAOYSA-N 390.443 5.032 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(OCc3ccccn3)c(Cl)c2)cc1 124037047 CTFSXXAFEOPLHS-MRXNPFEDSA-N 393.874 5.217 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(NC(=O)c2cccs2)c(C)c1 128690776 RHWLTKNTVMITGL-UHFFFAOYSA-N 396.537 5.199 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)N[C@H](CCC#N)c3ccccc3)c(C)c2c1 132807595 GPVNHXRYIPEHIX-OXQOHEQNSA-N 391.471 5.155 30 20 GKED Cc1cccc([C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccn2)c1 152962901 JHIWBSIUCPINHI-QFIPXVFZSA-N 384.483 5.102 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NCc2cccc(OCCCC#N)c2)cc1 159420174 ZXFWBFZPNXPVFF-UHFFFAOYSA-N 381.476 5.328 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 176607304 KCUMRLPKTCPFJT-IBGZPJMESA-N 396.494 5.079 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2)cn1 177755858 KHIVFSITLKHETM-IBGZPJMESA-N 391.496 5.039 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCS1 192225267 CUMVAQSDISIZEK-DNVCBOLYSA-N 399.947 5.355 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)o1 193050339 ZBVRCGWWCVAOEH-YWZLYKJASA-N 377.488 5.401 30 20 GKED Cc1ccccc1[C@@H]1CCCN1CC(=O)Nc1ccccc1SC[C@H](C)C#N 247056392 GOEYIMSOWBIDCL-UTKZUKDTSA-N 393.556 5.022 30 20 GKED Cc1cc(N[C@H](C)c2ncc(-c3ccc(Cl)cc3Cl)o2)nn1CCC#N 271040235 RMSSGNFAFBSECK-GFCCVEGCSA-N 390.274 5.240 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(Sc3ccccc3)cc2C)CC1 303272129 COCSQRPLGFQEIW-UHFFFAOYSA-N 395.572 5.308 30 20 GKED C=CCN(C(=O)c1cc(Cl)nc(Cl)c1)c1nc(-c2ccccc2)cs1 392197191 MDMXSNYPQAKHJJ-UHFFFAOYSA-N 390.295 5.345 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1Cc1cc(F)ccc1F)c1ccccc1 419519878 GVWUOUXNOBAZPJ-IRLDBZIGSA-N 397.469 5.116 30 20 GKED C=C(C)[C@@H](NC(=O)CCCCC(=O)c1ccc(F)cc1)c1ccc(F)c(F)c1 427815280 FJHIQHLDIBFCCX-JOCHJYFZSA-N 389.417 5.281 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 431313752 QESGJTXPLQUUBE-JBACZVJFSA-N 381.907 5.320 30 20 GKED CSC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 432768046 JPDPYSTZUOPAAC-SFHVURJKSA-N 395.528 5.266 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 437352465 DRKCPJJYLUOYHC-UHFFFAOYSA-N 384.810 5.617 30 20 GKED N#Cc1cccc(NC(=O)CS[C@H](c2ccccc2)c2ccc(F)cc2)c1 437454023 OQYLBNFYHWGROX-JOCHJYFZSA-N 376.456 5.159 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3cc(C#N)cs3)s2)cc1 437691545 JOOVRJXEGGQXLK-CQSZACIVSA-N 381.526 5.193 30 20 GKED CC[C@@H](C)n1c(C(F)(F)F)nc2cc(NC(=O)N(C)CC(C)(C)C#N)ccc21 455803265 VUNLWFYZTUETOP-GFCCVEGCSA-N 395.429 5.040 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2c(F)cccc2Sc2ccccc2)cc1 463596690 OTHUMQKVVQMDIJ-UHFFFAOYSA-N 390.483 6.030 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 470139884 GHZSHQHUYXAGRN-UHFFFAOYSA-N 398.413 5.284 30 20 GKED C=CCCCCNC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 472126311 NZJYRCZZMQEAKN-UHFFFAOYSA-N 395.381 5.029 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cc3[nH]ccc3s2)cc1 474957539 WZBRHEMBZOVCDB-UHFFFAOYSA-N 389.455 5.083 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc2c(cc1OCC)OCCO2 475577748 HIVJLUNOUPMEKL-UHFFFAOYSA-N 396.487 5.352 30 20 GKED Cc1cccc(CN(Cc2ccccn2)C(=O)C[C@H](CC#N)c2ccccc2)c1 475602721 ANHQTKXFXTZQRH-QHCPKHFHSA-N 383.495 5.006 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 476800254 CVUAPLHLTHQMPU-UHFFFAOYSA-N 396.490 5.786 30 20 GKED C[C@@H]1C[C@H]1[C@@H](NCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccc(Cl)cc1 478388685 UGSOYHDMQXJXIQ-AECOYVPUSA-N 390.918 5.099 30 20 GKED Cc1cccc(CCCSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 481958324 BULINYRGFWZTGH-GOSISDBHSA-N 398.597 5.551 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCCCC[C@H]3c3ccncc3)c2)cc1 482963306 NEEYDRQHNZAPQE-DEOSSOPVSA-N 397.478 5.503 30 20 GKED N#C[C@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1nccc2ccccc12 483189845 CWAPAZQFAPTANV-FQEVSTJZSA-N 381.460 5.271 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3nccc4ccccc34)o2)cc1 483246051 ZKBWLJBRQAMRPX-HXUWFJFHSA-N 380.403 5.187 30 20 GKED N#Cc1ccc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)s1 487212146 SLIYPHWLYZHGGD-UHFFFAOYSA-N 386.310 5.364 30 20 GKED N#Cc1cc(F)c(C(=O)N(c2ccc(F)c(Cl)c2)c2nccs2)c(F)c1 489041438 WCEXZPCGXNGZSR-UHFFFAOYSA-N 393.777 5.064 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccccc1NCc1ccccc1Cl)CC2 497096640 ZMDSFLLPWWPSRU-UHFFFAOYSA-N 387.870 5.027 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC=C(c2ccccc2F)C1 501566581 KFCBLNIGINCGNG-UHFFFAOYSA-N 384.410 5.029 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccccc1CC 502677356 DEIHSWRJDSMDGE-UHFFFAOYSA-N 391.284 5.371 30 20 GKED N#C[C@H](NC(=O)c1ccc(C(F)F)cc1)c1ccc(OCc2ccccc2)cc1 505320585 MAFJFDRAUJFQLG-NRFANRHFSA-N 392.405 5.198 30 20 GKED C=C(C)CCc1noc(CSc2nnc(-c3ccco3)n2C2CCCCC2)n1 508687571 SFELWKBDZDMWDV-UHFFFAOYSA-N 399.520 5.227 30 20 GKED N#Cc1c(NC(=O)c2ccc(OC(F)F)cc2)sc2c1-c1ccccc1CC2 511083746 WBHUPSHFXCRZPI-UHFFFAOYSA-N 396.418 5.239 30 20 GKED N#Cc1cnc(N[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)c(Cl)c1 514083257 KWPFLTZWRFNUCL-OAQYLSRUSA-N 375.859 5.133 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3cc(C#N)ccc3OC(F)F)c(F)c2)cc1 518020105 KTONXDORUOEMTK-UHFFFAOYSA-N 396.368 5.527 30 20 GKED N#Cc1cccc(CC(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)c1 530913944 WSXIGVOUILLXQB-UHFFFAOYSA-N 386.417 5.091 30 20 GKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 537926726 HFTFQLIFJREMDL-HNAYVOBHSA-N 381.451 5.071 30 20 GKED N#C[C@@H](C(=O)c1oc2ccccc2c1CSCc1ccccc1)c1ccncn1 546153263 MNXOJUCFZFZEKP-GOSISDBHSA-N 399.475 5.146 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c(Cl)cncc3Cl)c2)cc1 550707329 IUVRUZGWVGTYJA-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 551222832 MUWFVUFNLWTZPW-UZLBHIALSA-N 392.490 6.427 30 20 GKED N#CC1(N(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)C2CC2)CCC1 556437730 OWQJEIBCKXZIBQ-UHFFFAOYSA-N 386.451 5.063 30 20 GKED COC(=O)c1ccccc1-c1ccc(CN[C@@H](CCCC#N)c2ccccc2)o1 556907031 FMDJWFDQKGESAY-QFIPXVFZSA-N 388.467 5.258 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1cccc(CSc2ccc(C)cc2C)c1 564171014 TUBDALASUVWMMX-JOCHJYFZSA-N 398.597 5.361 30 20 GKED C[C@H](N[C@H](C)c1ccc(Br)cc1F)c1ccc(C#N)cc1Cl 571084469 TUKPOVSHIWGNBQ-WDEREUQCSA-N 381.676 5.525 30 20 GKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc2c1 575100089 REFOBWJRYRACJF-QGZVFWFLSA-N 399.500 5.695 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](C)c2ccccc2OC(F)F)c1 589740531 XLZBIPOFBNETDB-CQSZACIVSA-N 376.403 5.126 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(F)ccc1N1CCCCC1)c1ccccc1 590114922 LJSKBRGPLLBIEF-HXUWFJFHSA-N 394.494 5.373 30 20 GKED N#CC1(CC(=O)Nc2ccc(Oc3cccc(F)c3)c(Br)c2)CC1 590362758 UUMUWYXPTYHMIO-UHFFFAOYSA-N 389.224 5.013 30 20 GKED COc1cccc(C(NCc2ccc(C3(C#N)CC3)cc2)c2cccc(OC)c2)c1 594933802 BSJAAJHNTIXRLW-UHFFFAOYSA-N 398.506 5.138 30 20 GKED CCCN(C(=O)Cc1nc(-c2ccsc2)oc1C)c1cc(Cl)ccc1C#N 598810910 ILSQTNKNAIUKDM-UHFFFAOYSA-N 399.903 5.222 30 20 GKED Cc1cc(-c2noc([C@H](C)Sc3nc4c(cc3C#N)CCCC4)n2)ccc1F 603724304 OVOUZVXJGFGANF-ZDUSSCGKSA-N 394.475 5.183 30 20 GKED Cc1ccc(OCc2nc(CSCc3ccc(C#N)cc3F)cs2)cc1 604056064 NCZPOXBNYSUWMQ-UHFFFAOYSA-N 384.501 5.475 30 20 GKED C=CCCCCCN(C)C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C 606816786 KKZINQUGIASGJZ-UHFFFAOYSA-N 379.426 5.018 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC[C@H]2c2ccc(Cl)cc2)c1 609080399 ICOKHWBSIIUBHM-INIZCTEOSA-N 391.805 5.182 30 20 GKED Cc1cc(Cl)ccc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 609552390 UQCDNOYUMYRRKJ-UHFFFAOYSA-N 383.879 5.032 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(C)(C)c2cccs2)cc1 609647868 VYGYHWUQEVLEQF-UHFFFAOYSA-N 392.480 5.337 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)CSc2nc(C)c(C)c(C)c2C#N)o1 609984381 AAYSOFGBWIJPAH-LJQANCHMSA-N 397.544 5.016 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 610226964 XWIBZOFQNIHWFR-VQTJNVASSA-N 387.310 5.406 30 20 GKED C=CCN(C(=O)c1ccc(-n2cccc2)cc1)c1nc(-c2ccccc2)cs1 641527318 HKQCAIYBKFQUAI-UHFFFAOYSA-N 385.492 5.434 30 20 GKED O=C(Nc1cc(F)cc(F)c1F)NC(CCC(F)(F)F)CCC(F)(F)F 667136674 BZPPTXKHYHVQHC-UHFFFAOYSA-N 396.253 5.279 30 20 GKED C=CCn1c(Sc2nc(C)nc3sc(C)c(C)c23)nnc1-c1ccoc1C 669673288 NQJPGISIHPGBTK-UHFFFAOYSA-N 397.529 5.114 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cnn1C1CCCC1 680167885 JSSWSCQQAWNCMM-OAHLLOKOSA-N 396.491 5.190 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccc2ccccc2n1 683806052 BKGAPPIWXQZCDM-MRXNPFEDSA-N 393.368 5.242 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 727955121 YSFYKGKOOIIFKZ-KZULUSFZSA-N 389.282 5.007 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 729082563 UOBCOGYPOLJXTI-JXFKEZNVSA-N 390.508 5.579 30 20 GKED COc1ccc(C=NNc2ccnc3cc(Cl)ccc23)c(Cl)c1OC 730431523 ZTBUUGORUAELED-UHFFFAOYSA-N 376.243 5.005 30 20 GKED CCN(CC)c1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 731114249 LMWRBIACKTVWQD-QGZVFWFLSA-N 396.560 5.106 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1 737477255 DMMZCJNOOWPNDL-NSHDSACASA-N 397.780 5.023 30 20 GKED CCCN(Cc1ccccc1O)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 738525979 FCBXPBODEFCDJZ-UHFFFAOYSA-N 385.467 5.060 30 20 GKED O=C(/C=C\c1c(Cl)nc(Cl)n1-c1ccccc1)c1ccc2c(c1)COC2 742436950 OXUGFTGCKJPTGZ-HJWRWDBZSA-N 385.250 5.105 30 20 GKED C[C@@H](OC(=O)c1c(F)cc(C#N)cc1F)c1ncc(-c2ccc(Cl)cc2)o1 751745224 LXIIPEZEOXUHCD-SNVBAGLBSA-N 388.757 5.063 30 20 GKED Cc1cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cnc1Cl 754339459 OANJLUVVRFQCOA-UHFFFAOYSA-N 393.899 5.460 30 20 GKED COc1cc(C=NOCc2nc(C3CCCCC3)cs2)cc(Cl)c1OC 766683491 DQSBBTHEDVCVPA-UHFFFAOYSA-N 394.924 5.412 30 20 GKED CCc1nc2ccccc2n1N=Cc1ccc(OCc2cccs2)c(OC)c1 767373711 NLOVKNNSELXIGL-UHFFFAOYSA-N 391.496 5.130 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 772985617 SZPBKSZYKHWGCA-YLJYHZDGSA-N 384.907 5.350 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CNc1cccc(OCC#N)c1 779586052 LZRJKNZNPOQWII-UHFFFAOYSA-N 394.906 5.223 30 20 GKED Fc1ccc([C@@H](NCc2ccc(Cl)nc2C(F)(F)F)C(F)(F)F)cc1 792461562 ZUVUROBVIRXYSL-GFCCVEGCSA-N 386.698 5.286 30 20 GKED CC[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1O 796683272 MPXIULBRBYSBMD-BHDSKKPTSA-N 387.339 5.482 30 20 GKED C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571802 QJEHDAITIQDOME-VXGBXAGGSA-N 396.434 5.103 30 20 GKED C[C@@H](OC(=O)CCCCCC#N)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 805695045 GPNVPMSJYHTERU-LLVKDONJSA-N 382.247 5.122 30 20 GKED N#CCCCCCC(=O)NCCCN1c2ccccc2Sc2ccccc21 806443852 UZBRUMYKUQXVNP-UHFFFAOYSA-N 379.529 5.270 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1cccc(C(F)(F)F)c1 810197145 LMRIEXYZWKWJEF-FPLPWBNLSA-N 387.279 5.102 30 20 GKED C#C[C@@H](NC(=O)c1ccccc1SCc1cccs1)c1ccc(F)cc1 812751400 UFBVKAOVVLAIOM-LJQANCHMSA-N 381.497 5.284 30 20 GKED N#C[C@H](C(=O)CC1(CSc2ccccc2)CC1)c1cc(C(F)(F)F)ccn1 813218708 RZZGNZAFQHDWOC-INIZCTEOSA-N 390.430 5.239 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2ccccc2)C(F)F)cc1 814576486 DOJALMIFCJQLEQ-NHCUHLMSSA-N 391.421 5.470 30 20 GKED C=CCC[C@H](NC(=O)c1conc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 830889592 IXTDGGXAQXZPPP-ZDUSSCGKSA-N 392.299 5.150 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3Cc4ccccc4S3)n2)cc1 915099843 CYSHBBDUHHOHHT-LPHOPBHVSA-N 376.506 5.012 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2csc(C(=O)O)c2)cc1 1776125735 RLSMTQWYJDJSKJ-MZTACXPWSA-N 386.513 5.938 30 20 GKED CCOc1c(Cl)cccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776910332 DYUVCIXOZIBEHB-ZHACJKMWSA-N 396.826 5.593 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Cl)nc4ccccc34)c2c1 1777685506 JOCOKYLYLASUOX-ALCCZGGFSA-N 393.851 5.697 30 20 GKED N#CCCCSc1nc2cc(C(F)(F)F)ccc2n1Cc1ccccc1 4292756 KHRMVBOTMATUPZ-UHFFFAOYSA-N 375.419 5.499 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1Cl 44551964 XJQXVHITIFYCRU-INIZCTEOSA-N 397.843 5.217 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 55823508 HXCSYTDLEHXPLY-IBGZPJMESA-N 384.479 5.464 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccccc1C(F)(F)F 108355053 APPZEKUTLLMCHY-ZDUSSCGKSA-N 393.434 5.008 30 20 GKED CCN(C(=O)c1sccc1C#N)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 112640651 LDKCRGNSSMMLSE-OAQYLSRUSA-N 389.524 5.390 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 113521609 WOQMVSIASCXEOG-UHFFFAOYSA-N 394.519 5.885 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1 125512552 YTNWDKBLQLPGBE-UHFFFAOYSA-N 396.834 5.068 30 20 GKED C=C[C@H](CC(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1ccccc1 132742919 YLGQDAAQNCEFSR-QGZVFWFLSA-N 396.918 5.265 30 20 GKED Cc1coc(-c2cc(NCc3cn(CCC#N)nc3-c3ccccc3)ccc2C)n1 152641291 VTHOYEARMHXFRW-UHFFFAOYSA-N 397.482 5.348 30 20 GKED CCCN(C(=O)Nc1ccn(CCC#N)n1)[C@@H](C)c1ccc(Cl)c(Cl)c1 160573532 CSNBPEZWTMECOR-ZDUSSCGKSA-N 394.306 5.109 30 20 GKED C=CCN(C(=O)c1sc([C@H](C)OC)nc1C)c1nc(-c2ccccc2)cs1 175278944 NJJFOGCTNBPQHM-AWEZNQCLSA-N 399.541 5.115 30 20 GKED Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1cccc(SCC#N)c1 175746957 WPGWEPVMKLPKKT-UHFFFAOYSA-N 392.484 5.036 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ncc(C(C)(C)C)o1 177445187 KKWMXZPYTJTALY-MRXNPFEDSA-N 375.472 5.596 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cccc(Cl)c2Cl)ccc1OC 180815718 USOMLSDADXSDGT-ZFWWWQNUSA-N 393.314 5.534 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1cccc(Cl)c1 181411898 AJWMLXBHJGMLST-HUUCEWRRSA-N 387.936 5.024 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cccc(NC(=O)CCC)c1C 187867396 FPWMHQKURXNLBY-UHFFFAOYSA-N 395.503 5.275 30 20 GKED C=CCn1c(S[C@H](C)c2cc(F)ccc2F)nnc1-c1ccccc1F 195542463 KAHCZONZMLMILV-GFCCVEGCSA-N 375.419 5.402 30 20 GKED N#Cc1cccc(C#N)c1N1CCC(c2nc3cc(Cl)ccc3s2)CC1 302862093 VVEOVVUKOGYIOP-UHFFFAOYSA-N 378.888 5.077 30 20 GKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)C(O)=N2 329014219 FQSULSLCQAXISR-KFWWJZLASA-N 382.426 5.650 30 20 GKED OC(=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)[C@H]1C[C@]12CCOC2 329633860 WUUFKMHJSCYHAK-PEBXRYMYSA-N 393.512 5.185 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2cccc(C#N)c2)C1 364537123 NSTHOQIRZVFKRW-QFIPXVFZSA-N 389.499 5.016 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@@H](C)CC3)s1 410990032 VNSHMIHYXOHIBR-HOSYDEDBSA-N 389.546 5.030 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1CCC[C@@H](F)C1 424799392 JNJFUOABPATARQ-MRVWCRGKSA-N 385.323 5.343 30 20 GKED C[C@H](NCc1nc2ccc(F)cc2s1)c1ccc(-c2cccc(C#N)c2)cc1 428870633 GFMVZKMKQUXCLG-HNNXBMFYSA-N 387.483 5.825 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 429673496 ILZRHJMZZMUQDR-UHFFFAOYSA-N 375.394 5.062 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)c1 429796105 UVRCJHJEZDJJHD-UHFFFAOYSA-N 396.874 6.014 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(Cl)c1 430363812 ACHOHBQXOIQNGM-UHFFFAOYSA-N 391.789 5.267 30 20 GKED N#CCCn1cc(CN2CCC[C@H]2CCC2CCCCC2)c(-c2ccncc2)n1 435124030 KZBJBFTUOCSOLA-QHCPKHFHSA-N 391.563 5.184 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccccc1 438842413 POTNFIWVVQCVCD-QFIPXVFZSA-N 377.463 5.060 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)cc2)cs1 442027591 INLSVMLTMZBFPX-HNNXBMFYSA-N 375.478 5.218 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2cnc3ccccc3n2)c1 460338356 HOPMZESUURIDSK-UHFFFAOYSA-N 398.853 5.002 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464419043 UAWQVSDZINUCNM-NSHDSACASA-N 393.415 5.084 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1cccc(C(=O)Nc2ccccc2)c1 464824848 WJLPHBLXGGSQEU-JWQCQUIFSA-N 395.506 5.211 30 20 GKED C[C@@H](NC(=O)N1CCc2cc(-c3cccc(F)c3)ccc21)c1ccc(C#N)cc1 465663187 RWYSLJHGYIKUOH-MRXNPFEDSA-N 385.442 5.198 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1 472898584 XIGXXRJDAWCOJF-UHFFFAOYSA-N 398.463 5.035 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)Nc3ccccc3SCCC#N)c2c1 473685450 GLXLKPNLHLNMJO-UHFFFAOYSA-N 387.508 5.679 30 20 GKED CCc1cnc(CN(C)C(=O)c2ccccc2Sc2ccccc2C#N)s1 474473903 ZRCCRIRBLQXLAB-UHFFFAOYSA-N 393.537 5.001 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccccc1 477612271 ULJSJGBJDFPXTC-ZDUSSCGKSA-N 398.331 5.333 30 20 GKED CN(C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1cc(Cl)ccc1C#N 479570352 YBFUDKVRZXWKCK-UHFFFAOYSA-N 396.277 5.567 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(Oc2cccc(F)c2)nc1 481922136 MPCLXBDHGSPUBK-QHCPKHFHSA-N 387.458 5.442 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nccc2ccccc12 483232853 HWOIOQNQJAZJLN-GOSISDBHSA-N 391.452 5.135 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 483715155 WGTVKZSOEYBNTH-CQSZACIVSA-N 385.876 5.373 30 20 GKED N#Cc1ccc(/C=C(/c2nc3ccccc3[nH]2)c2nc3ccccc3s2)s1 484423133 FGFDLPJUTJVDSE-PTNGSMBKSA-N 384.489 5.695 30 20 GKED N#Cc1ccc(Sc2ccc3nnc(-c4cc(Cl)cc(Cl)c4)n3n2)cc1 487996820 ZKPUAUNTIZLKML-UHFFFAOYSA-N 398.278 5.121 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 489046027 UILVZGXKQQUBPT-HSZRJFAPSA-N 395.568 5.787 30 20 GKED CCN(C(=O)CSc1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 509584329 NFHWDIQDEHKFQZ-CQSZACIVSA-N 392.446 5.279 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(OCc2ccccc2)cc1 509587799 MOEQYJNGPXRTTL-UHFFFAOYSA-N 386.451 5.177 30 20 GKED CN(C(=O)c1ccc(NCc2ccc(C#N)cc2F)cc1Cl)C1CCCCC1 511114093 GPRDKVRDYJSEEB-UHFFFAOYSA-N 399.897 5.368 30 20 GKED CC[C@@H]1C[C@H](CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 513654561 WWSJWPKNSKWBCQ-BSIFCXSSSA-N 396.918 5.529 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1 513978564 OKDCCXZYADGDGM-UHFFFAOYSA-N 395.286 5.231 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3sc4c(c3C#N)CCCC4)o2)cc1 515317873 DDXZHGYUVVZFFF-UHFFFAOYSA-N 390.464 5.213 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCC(=O)c3ccc(F)cc3)cc2)cc1 519030119 BGRACNSSLPTLED-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Cl)cc1Cl 519516601 SQLMFPWQJHXEFJ-GFCCVEGCSA-N 379.312 5.569 30 20 GKED C[C@H](CSc1ccccc1)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 521141000 FPJAGXNBBPWOOH-SJKOYZFVSA-N 379.312 5.103 30 20 GKED CC(C)CN(C)c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 521800530 OUESIGBMBYUDNY-QGZVFWFLSA-N 381.545 5.425 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 521811583 MLXPTINWYUQKAS-QGZVFWFLSA-N 399.535 5.910 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1csc(-c2c(F)cccc2F)n1 523154402 JDWRRGBTKCYXHN-UHFFFAOYSA-N 388.414 5.056 30 20 GKED CC(C)(C)c1ccc(SCC(=O)Nc2ccccc2SCCC#N)cc1 524673859 KWYCOIUYHMVWNC-UHFFFAOYSA-N 384.570 5.721 30 20 GKED Cc1cccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1Cl 535116889 OAQYFFNRXPOPIZ-UHFFFAOYSA-N 378.884 5.600 30 20 GKED C=C[C@H](CC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 535370057 KBILPRIXHSMWBA-OPAMFIHVSA-N 379.550 5.644 30 20 GKED C[C@@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)c1ccc(CC#N)cc1 535501600 NJIUPWYEWJCLHG-ZDUSSCGKSA-N 399.281 5.118 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 540272728 LCKIYXQPOFNCRU-UHFFFAOYSA-N 381.526 5.602 30 20 GKED CC[C@H]1C[C@@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 541002238 FQANBMHJOJDJTK-RXVVDRJESA-N 396.918 5.340 30 20 GKED Cc1cccc(-c2nn(Cc3ccccc3)cc2CN2CCC(CC#N)CC2)c1 542850447 ONUKCGNYGBOCHH-UHFFFAOYSA-N 384.527 5.033 30 20 GKED C[C@@H]1COc2ccccc2CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 542952922 JKHNRDCKSILJGS-QGZVFWFLSA-N 399.450 5.166 30 20 GKED N#Cc1ccc(CSCc2nc(COc3ccc4ccccc4c3)no2)cc1 547054812 DCGITTAIORTATF-UHFFFAOYSA-N 387.464 5.107 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)C2CC2)cc1 550761192 QKDATDSFLQGSMW-DEOSSOPVSA-N 399.469 5.161 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCC(c3ccccc3C(F)(F)F)CC2)c1 552093911 CGTMXYADDUHJIN-UHFFFAOYSA-N 392.808 5.250 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@H]1c1cccnc1 557375873 DBXOVFNJFQFEEQ-QHCPKHFHSA-N 397.478 5.163 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)N3CCC(CCC#N)CC3)s2)cc1 563035321 ADPAHQXZYKLMLY-KRWDZBQOSA-N 396.560 5.213 30 20 GKED COc1ccccc1[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccccn1 564809758 WJHZVEXCYLHYEQ-RDGATRHJSA-N 383.495 5.109 30 20 GKED CC(C)(C(=O)Nc1ccccc1CCC(F)(F)F)c1cc(F)cc(C#N)c1 578574398 IXOAHIFLZJLVGS-UHFFFAOYSA-N 378.369 5.109 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)CC2)cc1 583700585 NBAVJMBIYYOUEF-UXHICEINSA-N 398.428 5.061 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C\c1cccc(Cl)c1 588482893 ZUCWATOXAKYJPI-CMUBDUJZSA-N 392.933 5.004 30 20 GKED N#CCCCCCC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 588903401 ANAUHDKKEACZDB-UHFFFAOYSA-N 390.314 5.391 30 20 GKED N#C[C@H](C(=O)c1oc2ccccc2c1CSC1CCCCC1)c1ccccn1 603835761 XSYULSWOBFQYJJ-SFHVURJKSA-N 390.508 5.884 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(-c3ccccc3Cl)o2)c1 603971108 QORSLQNPUFTOKU-UHFFFAOYSA-N 380.831 5.535 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1csc(-c2ccoc2)n1 609371135 FADIHGITXVBABA-UHFFFAOYSA-N 377.450 5.256 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccccc2F)n1 609377794 MZBVMUNRLXBJKO-CYBMUJFWSA-N 397.500 5.453 30 20 GKED N#CCc1cccc(C(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)c1 609647173 YSJNNFUUAVIDPC-UHFFFAOYSA-N 379.419 5.345 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccs1 609968363 YUICQYYZQFRFMD-KDOFPFPSSA-N 380.900 5.799 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CC(CC(F)(F)F)C2)c1 610745253 APNYSEQIFFJQFK-UHFFFAOYSA-N 394.780 5.028 30 20 GKED CC(C)(C)[C@@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361877 JHFPTFJIKWVOCA-QFBILLFUSA-N 381.442 5.128 30 20 GKED Cc1c(C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)oc2c(F)cccc12 618297412 HYCKQFMCMFZNGN-NXEZZACHSA-N 397.290 5.083 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)CSc2ccc(C(C)(C)C)cc2)cc1 626590976 PCYIKDXWWYECMB-UHFFFAOYSA-N 397.544 5.022 30 20 GKED CCN(C(=O)Cc1c(C(C)=O)oc2cc(C)ccc12)c1ccc(C#N)c(Cl)c1 675494577 IKCFEJKTCYMBAL-UHFFFAOYSA-N 394.858 5.065 30 20 GKED CC(C)CC(=O)Nc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726455851 RCKFKEWUHPNSML-UHFFFAOYSA-N 386.908 5.005 30 20 GKED CC(C)C[C@H](C)CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 727953361 GMTAEZAWTOJLPN-PKOBYXMFSA-N 378.472 5.199 30 20 GKED Cc1cc(C(=O)N2CCC[C@@H]2c2cccs2)c(C)n1-c1ccc(C#N)cc1 728264261 AHRQTPUCXKFREV-HXUWFJFHSA-N 375.497 5.005 30 20 GKED Cc1ccccc1-c1cccc(/C=C(\C(=O)C(=O)O)c2ccc3ccccc3n2)c1 729641795 XYGWXNVRLJSQBW-JWGURIENSA-N 393.442 5.405 30 20 GKED N#C[C@@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)c1c(Cl)cccc1Cl 730092388 HGXGUYCBXIPZIX-CQSZACIVSA-N 388.081 5.224 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2cc(-c3ccccc3)cs2)ccc1OC 733330284 RGQMCVFMEPRVFB-HXUWFJFHSA-N 392.524 5.394 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cccc(Oc2ccnc3ccccc23)c1 734311365 NWVYBECOFVCYLZ-UHFFFAOYSA-N 396.475 5.708 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccccc2C)cc1 734964561 CPCFEZZQANDARM-ZJBJCVSYSA-N 376.500 5.350 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3csc(-c4cccs4)n3)c2)s1 740014872 XKPCQNDGDSECFV-UHFFFAOYSA-N 393.562 5.762 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740059482 JOCMCWJCYYSUTM-HNNXBMFYSA-N 393.487 5.328 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2c(Cl)nc(Cl)n2C)cc1 741468394 FHQCBOXPSSQHAT-QXMHVHEDSA-N 387.266 5.299 30 20 GKED Cc1c(C(=O)/C=C/c2cc(C(F)(F)F)ccc2F)cnn1-c1ccc(C#N)cc1 741853221 YUUNJOOVSGNHEK-RUDMXATFSA-N 399.347 5.106 30 20 GKED C=C(Cl)C[S@](=O)Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 742440548 QZEARXTXQLZTDH-QFIPXVFZSA-N 375.704 5.787 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 744017139 ZFAURAGBGGYAOV-HMVFGEFZSA-N 386.398 5.595 30 20 GKED C#CC[C@H](NC(=O)Nc1cccc(CSc2ccccn2)c1)c1ccccc1 757877834 ARSHLMRCSVIWGK-NRFANRHFSA-N 387.508 5.260 30 20 GKED C#CCCCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 757915499 KHPBZUWOHBAOKC-QFBILLFUSA-N 390.914 5.660 30 20 GKED CC[C@H](CC#N)NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 762720110 WQTBVCDQPMPOFU-LJQANCHMSA-N 382.463 5.355 30 20 GKED CCn1c(NC(=O)c2sc3ccccc3c2Cl)nc2cc(C#N)ccc21 764514554 QCONILGOEBEOAR-UHFFFAOYSA-N 380.860 5.048 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CN[C@H](C)c1ccc(C#N)cc1 775914038 RCJARVQSSVUSQI-QGZVFWFLSA-N 392.934 5.431 30 20 GKED C#CCOc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 776094999 NYHVZXMJRJZEAS-SFHVURJKSA-N 388.389 5.086 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccc(C)cc2)cc1 776161397 VTNNFXMWSTXREP-KBMIEXCESA-N 386.495 5.346 30 20 GKED Cc1nc(F)ccc1/C=C\c1nc(C)c(C(=O)/C=C/c2ccc(F)nc2C)s1 782331281 VRKUHHJONVTWGX-HYPVGTFXSA-N 397.450 5.203 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CC[C@@H](O)C(C)(C)C2)c1 784431795 WKRXPAFPSRURGH-OAQYLSRUSA-N 390.568 5.188 30 20 GKED Cc1nc2ccc(Cl)cn2c1NC(=O)c1ccccc1-c1ccccc1C#N 786653652 OBXCTJURBNUTMW-UHFFFAOYSA-N 386.842 5.087 30 20 GKED N#C[C@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1nccc2ccccc12 792106439 QRMILFNXAQFCAP-HNNXBMFYSA-N 381.262 5.450 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CSCc2cccc(Cl)c2)s1 797567928 CPSGYYFYAALVDX-AWEZNQCLSA-N 378.950 5.204 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCC(=O)c2ccc3c(c2)CCCC3)s1 797573428 SGDFKRRPMGPYSM-GOSISDBHSA-N 394.540 5.159 30 20 GKED CC(C)(C(=O)OC[C@@H](C#N)Cc1ccccc1)c1csc(-c2cccs2)n1 800396887 LUABBNJKKAJDTQ-MRXNPFEDSA-N 396.537 5.075 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)C(=O)Nc3ccccc3Cl)c2c1 805856553 XRLXDOFYEXPCDA-OAHLLOKOSA-N 380.831 5.171 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CCOC(C)(C)C1 809872630 JIGKCQLQDWSXQR-FCHUYYIVSA-N 391.515 5.153 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCCC2)cc1 815635469 DFDRFGCLLYENCP-BWKNWUBXSA-N 375.560 6.153 30 20 GKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1O 815636244 RPNLBWGFCKOCSZ-MOPGFXCFSA-N 377.315 6.175 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1sccc1C(F)F 824579053 AFGDFPSYVVHOGS-UHFFFAOYSA-N 383.304 5.469 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790597 IOJBNLUSQWVSFB-IONNQARKSA-N 380.313 5.080 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)c(C)n1[C@H](C)c1ccccc1 842936985 BCGAHAWVFOQRIB-QRWLVFNGSA-N 389.524 5.538 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942361 XSDBKMNPASCRMS-CRAIPNDOSA-N 375.497 5.116 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)nc1 846902119 QZOAAMCSXMZVJN-LBPRGKRZSA-N 399.237 5.498 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)CCc2[nH]c3ccc(F)cc3c21 915987073 QRENZHGTDSHZTI-FMIVXFBMSA-N 375.428 5.038 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 916976956 YFOYOWMLXHHYPP-OKZBNKHCSA-N 396.874 5.583 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccc(F)cc2)cc1 918486694 KSGFCTJZPDSZDS-MRUHUIDDSA-N 380.463 5.180 30 20 GKED CCC(=NNc1ccc(C(=O)O)cc1)c1ccc(Br)cc1Cl 1776012507 BDHKZLCLZSCDAN-UHFFFAOYSA-N 381.657 5.027 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NNc1cc(Cl)cc(Cl)c1 1776058624 XYOTZOZLWOFHTC-ZDUSSCGKSA-N 395.286 5.266 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2csc(C(=O)O)c2)cc1)c1ccccc1 1776469524 VGJDGBAQDGUBOE-WASHYIJTSA-N 378.449 5.482 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777566891 RYVHNDLTGSJSNH-XKZIYDEJSA-N 379.415 5.136 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)cc1F 1777673187 DVHWZULUMZFNDE-GHXNOFRVSA-N 378.371 5.051 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/C=C\c2ccc(OCc3ccccc3)cc2)c1 1777684948 RWOJAAKQBXMKGW-FKBQNAHWSA-N 384.431 5.416 30 20 GKED Cc1sc2nc(SCc3ccc(C#N)cc3)n(C3CCCC3)c(=O)c2c1C 11385301 GQGNJCPXBKIXSG-UHFFFAOYSA-N 395.553 5.354 30 20 GKED C=CCn1c(SCC(=O)c2ccc(Cl)s2)nnc1-c1cccc(C)c1 22010821 VOVINJFEZBPALP-UHFFFAOYSA-N 389.933 5.129 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161444 WHLJPMHOTRODON-UWJYYQICSA-N 377.488 5.032 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COCCc2ccccc2)c1)c1ccc(C#N)cc1 65477931 ZEQMLXXZYFMKLH-LJQANCHMSA-N 399.494 5.200 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(\S)Nc1cc(C)ccc1F 65940504 IHTPQHXNNHXSNF-UHFFFAOYSA-O 393.507 5.035 30 20 GKED Cc1cc(C)n(-c2ccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2)n1 66800696 FXPYIUFDRLIZTQ-KRWDZBQOSA-N 390.512 5.136 30 20 GKED Cc1ccccc1OCCCN(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954313 KTVJKJVNMZNAAQ-SFHVURJKSA-N 397.544 5.322 30 20 GKED CC(C)Oc1cccc(CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 69285599 TZVAPIFHGPCHTC-IBGZPJMESA-N 376.481 5.016 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(/C=C/C(=O)c3ccc(C#N)cc3)c2)cc1 96766304 ZETCIVGEOMYJRF-DJJIWSAGSA-N 388.426 5.222 30 20 GKED Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 97553826 LKKGZDUCILTILU-UHFFFAOYSA-N 375.497 5.352 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccc(F)cc1F)c1ccccc1)c1ccccn1 106353758 LHIUDRKQZBOWQE-IIBYNOLFSA-N 380.419 5.070 30 20 GKED Cc1cc(C)c(NC(=O)CNc2ccccc2SC[C@H](C)C#N)c(Cl)c1 108354408 ARLLLHUOCXRDLX-CQSZACIVSA-N 387.936 5.259 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)c1cccc(O)c1 112421101 AVNABNBKRZTWCD-INIZCTEOSA-N 387.439 5.247 30 20 GKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 114619445 PKQPKVBPAOYFNH-LJQANCHMSA-N 375.497 5.103 30 20 GKED C[C@@H](Sc1nc2ccccc2s1)C(=O)Nc1ccccc1SCCC#N 134981398 UXMXRVZZZIZSEJ-CYBMUJFWSA-N 399.566 5.421 30 20 GKED C=CCC[C@@H](NC(=O)Nc1c(C)cccc1C(=O)N1CCCC1)c1ccccc1 155051985 FEJATTGZTJDCCO-OAQYLSRUSA-N 391.515 5.060 30 20 GKED Cn1cc(CNc2ccc(CCC(F)(F)F)cc2)c(-c2ccc(C#N)cc2)n1 180284236 IKVHLUUDUUHARG-UHFFFAOYSA-N 384.405 5.066 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(SCC(F)(F)F)cc1 180551809 SKFQDZFDYPCXOC-CQSZACIVSA-N 380.435 5.094 30 20 GKED O/C(=N/[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F)c1ccnc(O)c1 329147845 PHBHAHJCTWLXRV-DOTOQJQBSA-N 378.394 5.227 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCC[C@@H]1c1cccs1 330242740 JMBDNAABYMCRNK-LJQANCHMSA-N 392.528 5.331 30 20 GKED CCS[C@@H]1CCC[C@H](/N=C(/O)c2ccc(C)c(N=C(O)NC(C)(C)C)c2)C1 331120517 OMGCSTOTTIYOBA-DLBZAZTESA-N 391.581 5.298 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c(Br)c1 391344988 PWXQUCPKGMFSBO-LLVKDONJSA-N 389.318 5.068 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1ccc(NC(=O)CC(C)(C)C)cc1 410365746 MCJKQWUERGDHRY-UHFFFAOYSA-N 378.516 5.361 30 20 GKED C[C@@H]1Cc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c2[C@H](C)C1 411019491 UXPVVVJQUIBJLL-ZFDZMSFRSA-N 382.476 5.042 30 20 GKED C[C@@H]1Cc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c2[C@@H](C)C1 411019493 UXPVVVJQUIBJLL-ZSVAQUKISA-N 382.476 5.042 30 20 GKED C[C@@H](c1ccc(Oc2ccccc2)cc1)[S@](=O)CCCC1(C#N)CCOCC1 417194218 MKZSTEUKISTAPO-HMILPKGGSA-N 397.540 5.389 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)c1cnn(CCC#N)c1-c1ccccc1 428639274 RPMASXKHHFBVRS-UHFFFAOYSA-N 398.388 5.043 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc2cccc(F)c2o1 431920887 HTOUWJJFTQQKSD-BEFAXECRSA-N 379.435 5.367 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)C2 431989161 ZFFXSEODYFMIKO-UHFFFAOYSA-N 383.451 5.515 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(C(C)(F)F)cc1 432580823 AFLYABSHGKFZGC-UHFFFAOYSA-N 385.458 5.038 30 20 GKED Cc1nc2ccc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc2s1 433121932 PCIVJACSVPOGPT-LBPRGKRZSA-N 383.885 5.358 30 20 GKED Cc1cccc([C@H](C)SCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 437437225 DIRNKFUWRMSTPM-IRXDYDNUSA-N 384.570 5.680 30 20 GKED CCSCc1ccccc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 448343998 CZEVSAJMZCQSJH-MRXNPFEDSA-N 379.312 5.241 30 20 GKED Fc1cc(CN2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)cc(C(F)(F)F)c1 459643744 CVMTWSHKORHQOP-OAHLLOKOSA-N 399.350 5.026 30 20 GKED C[C@H](C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)c1cccc(C#N)c1 461802273 JLQWWOCZYNPWCQ-MBSDFSHPSA-N 393.490 5.091 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 463748575 WDSQSUASMSMFTP-KPZWWZAWSA-N 379.262 5.082 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 464951201 RLXWCOVLIAPFAY-VQTJNVASSA-N 387.508 5.031 30 20 GKED C=CCC(CC=C)C(=O)N(c1ccccc1)c1nc(C)c(C(=O)OCC)s1 468678571 BSLVZRRIYIMHDZ-UHFFFAOYSA-N 384.501 5.061 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469226188 FBRFEXTWUMZKBE-HUUCEWRRSA-N 393.874 5.131 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(OCCF)c3)cc2)cc1 470135723 YYPZXYOWSSATNW-UHFFFAOYSA-N 390.414 5.146 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 471904473 DHYXZTUQTOOWON-QWHCGFSZSA-N 393.339 5.987 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1Cl 473685820 KCPGFNAPAVJEKI-IBGZPJMESA-N 397.265 5.171 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCOc2cc(N(C)C)ccc21 475546899 JOSAKIAVMKTGOB-UHFFFAOYSA-N 379.504 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccc(C(C)=O)cc2CC1 475549208 FAFUDNDOYKFUOP-UHFFFAOYSA-N 390.527 5.374 30 20 GKED CCCc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cnn1-c1cccc(C)c1 477097355 FUAJJSZMPCTQQR-HXUWFJFHSA-N 386.499 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1c(F)cccc1Cl 477778340 ZTICDRBAWFONDO-STQMWFEESA-N 391.899 5.756 30 20 GKED Cc1nc(NC(=O)c2cc3c(Cl)cc(Cl)cc3[nH]2)sc1SCC#N 480030825 SGEFBNYAIALFGL-UHFFFAOYSA-N 397.312 5.108 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ncccc2Cl)c1 480795721 YQLRPKIHBKCJBE-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccc3ccccc23)n1)c1nc2ccccc2o1 480943384 UKXXJSJEJPNQBO-QGZVFWFLSA-N 395.443 5.595 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1-c1ccc(F)cc1 483214002 NFBRNERAAKCWML-HXUWFJFHSA-N 386.451 5.901 30 20 GKED Cc1sc(C(=O)Nc2nc3c(cc2C#N)CCCC3)cc1-c1ccc(F)cc1 484168473 YXHXNKALEQDUKA-UHFFFAOYSA-N 391.471 5.260 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(CCCC)c1C(C)C 484653529 MVQKGCWECJONMW-UHFFFAOYSA-N 382.552 6.303 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)[S@@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488802645 HIIDZSCXMWXKNH-SRENCEJNSA-N 384.316 5.272 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2Cc2nnc(-c3cccc(C#N)c3)o2)cc1 490630854 XGIGMQHYLFSIPY-QFIPXVFZSA-N 386.499 5.459 30 20 GKED CCSc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)c1 490720594 PSFKGVZRXURIAA-GOSISDBHSA-N 394.521 5.421 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1ccccc1Oc1cccc(F)c1 497593588 FMKZSUFZYDZXPH-UHFFFAOYSA-N 395.821 5.194 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)Nc2cccc(OCCCC#N)c2)cc1 503152448 OKDLYFMPMWEKNV-UHFFFAOYSA-N 394.515 5.320 30 20 GKED Cc1cccc2c1N(C(=O)c1cccc(COc3ccccc3C#N)c1)CCC2 513476819 PBZOQAQWIQEVOS-UHFFFAOYSA-N 382.463 5.039 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)cc(Cl)c1 513524537 JGHDNUYXGQIKGW-UHFFFAOYSA-N 381.307 5.381 30 20 GKED Cc1nc(NC(=O)C2(c3ccc(Cl)cc3)CCCC2)sc1SCC#N 515580459 PWBRKNQTXBUEAB-UHFFFAOYSA-N 391.949 5.171 30 20 GKED CC(C(=O)Nc1cccc(OCCCC#N)c1)(c1ccccc1)c1ccccc1 517163962 RJYUSGABJBFONT-UHFFFAOYSA-N 384.479 5.314 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(F)cc1 518164423 BGJZSLOPKYNDFZ-DNVCBOLYSA-N 383.492 5.446 30 20 GKED CCc1ncc(C(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)s1 518907623 ZCDABCMJLMCLRA-MJOKBVDLSA-N 397.569 5.120 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1 520705855 DBXYQSCLWQTVSZ-GIOYIUAESA-N 390.458 5.140 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)c1 525029206 ZNMBVVSKXMGWIN-UHFFFAOYSA-N 394.515 5.197 30 20 GKED C=CCC[C@H](NCc1ccc(-n2cncn2)cc1)c1ccc(C(F)(F)F)cc1 533391888 NGECGOHWSZVSEB-FQEVSTJZSA-N 386.421 5.083 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nc2cc(Cl)ccc2c1=O 539758511 SFKNEVYAEPYPQO-LBPRGKRZSA-N 397.887 5.230 30 20 GKED C[C@@H]1CCCC[C@@H]1OCc1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 544336501 POQQLMXSNPNTQW-JLVNLFQDSA-N 390.487 5.204 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2cccc(Oc3ccc(C#N)cc3)c2)s1 546755323 KMZQMHGJGBKANG-UHFFFAOYSA-N 389.402 5.746 30 20 GKED N#CC[C@H](CC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1)c1ccccc1 552271338 CNATZJADEVZSQA-AUSIDOKSSA-N 382.454 5.162 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(COCC2CC2)c1 554417287 GAFMSGOJVWELNF-UHFFFAOYSA-N 396.535 5.001 30 20 GKED C=C(C)[C@H](NC(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(F)c(F)c1 554961259 GGTTZDGKRCLNKY-VFNWGFHPSA-N 385.454 5.341 30 20 GKED Cc1nc(-c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)co1 558387467 KGZNTBHFEKQVDN-UHFFFAOYSA-N 378.775 5.017 30 20 GKED C[C@@H](NCc1ccccc1CN[C@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1 558742893 OWXIABKJDGLPII-WOJBJXKFSA-N 394.522 5.132 30 20 GKED CN(C(=O)c1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1)C1CCCCC1 594735413 NZSCSLMENSGSMP-UHFFFAOYSA-N 387.527 5.259 30 20 GKED C=CCCC(C)(C)NC(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 596749624 OOEBXRBAWBTYGN-MHZLTWQESA-N 384.545 5.002 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc(OCCCC#N)c1 603972294 IBTVHLZBOFJKFS-ZDUSSCGKSA-N 393.270 5.082 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)sc1-c1ccc(F)cc1 605363163 MJLWEHCBGOOOIG-INIZCTEOSA-N 389.455 5.537 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc2ccccc2c2cccnc12 609377351 SPOFTBHUXGTWSM-MRXNPFEDSA-N 397.503 5.892 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 609402858 DXJGTOXZYNTIAI-GHTZIAJQSA-N 393.556 6.088 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 609403063 PXYILGROFPANTC-VLIAUNLRSA-N 399.947 5.865 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CNc1cccc(C(F)(F)F)c1 609582828 CITKOECLRUCPHO-ZDUSSCGKSA-N 393.434 5.008 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609647241 BWZPNTUDLPSAQE-NTKDMRAZSA-N 396.490 5.155 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3occc3s2)cc1Cl 609856793 LTYPNPZFQDBYLV-INIZCTEOSA-N 392.867 6.055 30 20 GKED CC[C@H]1CCC[C@@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 610141255 NTXOGOVKDQKIAF-GHTZIAJQSA-N 391.515 5.422 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1cccc(C#N)c1 610406723 JVBGTQBRAKJPSN-AWEZNQCLSA-N 387.405 5.012 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 610893518 YNVDTOZBNBRKAA-UHFFFAOYSA-N 398.331 5.008 30 20 GKED CC(C)COc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 613392538 SFUGKYIUDYDKHK-LJQANCHMSA-N 376.481 5.335 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2SCC(F)(F)F)cc1Cl 619786868 XDPMAKIRGBVKCZ-UHFFFAOYSA-N 399.825 5.188 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2ccc(OC)c(NC(=O)C3CCCCC3)c2)C1 666083654 FOAWMOOJAWHJTL-KRWDZBQOSA-N 399.535 5.034 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2)cc1 675130365 NJQIGNYFJSNBJB-SFHVURJKSA-N 387.439 5.296 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)C[C@H](c1ccccc1)C(C)C 728766665 FLAXDBWTOODIMQ-VXKWHMMOSA-N 390.527 5.289 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)cnn1-c1cccc(Cl)c1 731565561 UEGPGVMDLMGGHH-MEODZPNASA-N 391.858 5.021 30 20 GKED C[C@H](CSc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 732495867 IZNRFFJNJVGXKX-IUODEOHRSA-N 386.929 5.554 30 20 GKED COc1cccc(C=Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1O 733903648 NSCANLFVNDVZLS-UHFFFAOYSA-N 388.345 5.358 30 20 GKED COc1ccc([C@H](Nc2snc(Cl)c2C#N)c2ccccc2Cl)cc1 739898730 CPUAQHPBIBBMDV-INIZCTEOSA-N 390.295 5.532 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Nc2ccccc2OCC2CC2)cc1 741058549 DTFMTTOOGIZNSO-QFIPXVFZSA-N 397.478 5.775 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1c(Cl)nc2sccn12 741843948 JWIRMVXXHYSZPW-ALCCZGGFSA-N 399.815 5.114 30 20 GKED CCOc1cccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)cc2)c1 742990819 RACIUCVRQZELAQ-UHFFFAOYSA-N 389.480 5.558 30 20 GKED Cc1cccc2c(CCC(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c[nH]c12 744118201 HNWYGQHQTVTZEJ-MRXNPFEDSA-N 377.444 5.034 30 20 GKED CC(C)CCOc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 744450249 XCBGRMCFPJZUBO-UHFFFAOYSA-N 388.515 5.501 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1OCCCC#N 745989944 HLFXSCMZEGNIDQ-ONNFQVAWSA-N 398.462 5.336 30 20 GKED COc1cc(OC)cc(Oc2ccc(/C=C\C(=O)c3cnn(C(C)C)c3)cc2)c1 746686444 DGGDWZQXFJMVRX-YFHOEESVSA-N 392.455 5.170 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)c1 747198936 OMYUSZWKHAVIBI-KRWDZBQOSA-N 382.529 5.421 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)s1 750741719 JXOJCGNMORVLDC-CQSZACIVSA-N 394.452 5.042 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@H](C)c1ccc2ccccc2c1 753396980 WWYGNXLUBBRRMB-HXOBKFHXSA-N 398.506 5.416 30 20 GKED COc1cc(Cl)cc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1O 761216868 SJASISWGDXBCIN-HNNXBMFYSA-N 392.886 5.444 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1nc(Cl)sc1C 762865839 SZYODAAUTUADTQ-UHFFFAOYSA-N 397.887 5.116 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc3[nH]ccc3c2)cc1 775657543 CSMREELRYCZXAS-QHCPKHFHSA-N 379.463 5.395 30 20 GKED C=CC[C@H](C(=O)OCCCC(=O)Nc1c(C)cc(C)cc1C)c1ccccc1 778426904 JKVMUKBPUZGOSX-NRFANRHFSA-N 379.500 5.234 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCC(C)(C#N)CC2)c1 780525903 KJFXUTSEKWCJGL-UHFFFAOYSA-N 385.552 5.721 30 20 GKED C[C@@H]1CC(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C[C@@H](C)O1 801663449 SXXZXQLTONOEQM-PNCHPQGNSA-N 391.515 5.057 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1cccnc1C#N)CC(C)(C)O2 811863788 ZNLSSGQJDDZJLZ-QGZVFWFLSA-N 394.475 5.015 30 20 GKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)nc1Cl 817867027 RAJQHUJHPUMREN-TZMCWYRMSA-N 395.812 5.019 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1 831617772 JSYFNFWNBFONAL-LEWJYISDSA-N 390.612 5.014 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086960 YTHAKRWKVLTYAM-IBGZPJMESA-N 399.475 5.619 30 20 GKED Cc1cc(OCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Cl 915102385 RPYZYSYHSGDULE-MRXNPFEDSA-N 382.872 5.027 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)c(C)n1[C@H](C)c1ccccc1 916845216 QVGNBMIUAGKZAN-UTKZUKDTSA-N 396.494 5.091 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2F)o1)c1ccc2ccccc2n1 916848840 JBIQTJKFSVQTCF-LJQANCHMSA-N 384.410 5.443 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(C(F)(F)F)c2)cc1 916913803 SGQALKBIYFBMOP-SFHVURJKSA-N 388.389 5.009 30 20 GKED O=C(O)c1ccc(NN=C(CCc2ccccc2)CCc2ccccc2)cc1F 1776074698 OMCCLLHIFJOCSD-UHFFFAOYSA-N 390.458 5.557 30 20 GKED COc1ccc2c(c1)CC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1776127458 UATQDUXWMVIBGE-LGMDPLHJSA-N 390.460 5.334 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C(=O)O)c1ccccc1C(F)(F)F 1776180232 HNJZQHUROHCKGC-OAHLLOKOSA-N 389.826 5.234 30 20 GKED C=CCc1cc(C)c(OCCCN2CC[C@@H]3C[C@@H](CC(=O)O)CC[C@@H]3C2)cc1C 1776186201 PKZYIWGYAJGCKA-MDNUFGMLSA-N 399.575 5.014 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C3\CCc4occ(C(=O)O)c4C3=O)o2)cc1 1776271527 YONQSONPCRJRDX-NTCAYCPXSA-N 390.435 5.748 30 20 GKED CCCCCCCOc1ccc(/C=C/c2ncc(C(=O)O)s2)cc1OCC 1776788195 PTVMTSKOXXXETB-ZRDIBKRKSA-N 389.517 5.760 30 20 GKED CCOc1cc(F)cc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776920210 VLFZWLZRLVWTAP-FPYGCLRLSA-N 380.371 5.079 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3cc(Cl)ccc3o2)c2cc(C(=O)O)oc12 1777360803 QJPDJMQXUOBNLV-GORDUTHDSA-N 396.782 5.435 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)s1 1777462984 YZUQNIGMTOQRJV-MIMPSMLTSA-N 375.449 5.112 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1c(F)ccc2sc(C(=O)O)cc12 1777545324 INSMSOHMHYHFTR-ALCCZGGFSA-N 386.448 5.029 30 20 GKED C=CCn1c(SCC(=O)c2cc(C)c(C)c(C)c2C)nnc1-c1ccoc1C 36849956 KIHBBOURXCXZTB-UHFFFAOYSA-N 395.528 5.241 30 20 GKED N#C[C@H](C(=O)c1ccc2c3c(cccc13)CC2)c1nc2ccccc2n1C(F)F 41557390 AHICEVUGXRKIQD-QGZVFWFLSA-N 387.389 5.173 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1sc(-c2ccccc2)cc1OCc1ccccc1 63747019 LHKPQKHWUMZIPO-KRWDZBQOSA-N 390.508 5.226 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 66954286 RXRSZKUSXBHZDR-MRXNPFEDSA-N 383.517 5.062 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1 116685932 ADEWFSWBFKGYBM-MUUNZHRXSA-N 397.540 5.085 30 20 GKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1-c1ncco1 128531793 UBOLUKDRVTZSHH-UHFFFAOYSA-N 379.419 5.441 30 20 GKED Cc1cc(Cl)ncc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 135974248 BUXRWEUXUQIQNZ-UHFFFAOYSA-N 393.899 5.460 30 20 GKED Cc1ccccc1COc1cccc(CC(=O)[C@H](C#N)c2nc3ccccc3o2)c1 171627186 WGWHQEMIRKMCLF-NRFANRHFSA-N 396.446 5.134 30 20 GKED C[C@@H](c1ccc([S@](C)=O)cc1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 177731103 WPARLZWWGKQOJC-JMQGSBJISA-N 388.536 5.156 30 20 GKED C=C[C@H](CC(=O)N[C@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 178960295 NJXVUOBLMBNDRC-RTBURBONSA-N 393.531 5.097 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(Br)c1 179063162 ULYTWNRPTKTMJX-CYBMUJFWSA-N 389.318 5.262 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C1CCCC1)C(F)(F)F 184011914 BQHMYPCGLIOBKN-MLGOLLRUSA-N 385.455 5.323 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)Nc1ncccc1OCCCC#N)C1CC1 188710851 AJCAQWQJYBBHNE-OAHLLOKOSA-N 398.894 5.175 30 20 GKED Cc1oc(-c2ccsc2)nc1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 264577140 VYTQBVSXKYSTDL-ZDUSSCGKSA-N 397.525 5.145 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)C[C@@H](c2ccccc2)C(F)(F)F)c1 303226354 XAKYHKXWSXFTKG-NRFANRHFSA-N 397.396 5.530 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1Br 322803335 RATMNKLLPRQLDN-CYBMUJFWSA-N 377.257 5.444 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](C)c1cc2ccccc2s1 328812472 NBVMNZATKDFQDE-SWLSCSKDSA-N 386.542 5.626 30 20 GKED CC[C@@H]1C[C@@H](/C(O)=N/CC2(c3ccc(Br)s3)CCC2)CC(O)=N1 329270798 HGXWFAXUHSRULH-VXGBXAGGSA-N 399.354 5.034 30 20 GKED Cc1nc2c(s1)[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC2 371618634 JSHYJCFGJXSKNO-LRDDRELGSA-N 386.546 5.045 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 409803981 ZWYVAYVMLIQEOW-FASAQXTFSA-N 387.310 5.578 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccccc1SCc1nc(C)no1 410363043 HZTKGQNDGLGUIQ-UHFFFAOYSA-N 379.485 5.041 30 20 GKED C[C@H]1CCc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c2[C@H]1C 410976021 ALMJHGMAPVYRNA-ZSVAQUKISA-N 382.476 5.042 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(Cc2ccccc2)CC1)c1ccccc1 431643624 OTKVPXDWOAPVPE-QHCPKHFHSA-N 375.516 5.086 30 20 GKED N#CCCC[C@H](NC(=O)NCCCSc1ccc(F)cc1)c1ccccc1 431728543 XQXMNSFJFDLOPK-FQEVSTJZSA-N 385.508 5.042 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 432859483 OLANATPNRTYXRT-JPYJTQIMSA-N 393.556 5.442 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc2cc(Cl)ccc2s1 437377796 YHPRVYLPZVJLSO-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccc(Cl)s3)o2)c(OC(F)F)c1 439540925 KVPAMCGJPFARHE-UHFFFAOYSA-N 399.831 5.217 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1C 446915298 USFGQIHSWKQQMK-IBGZPJMESA-N 376.422 5.386 30 20 GKED N#CCc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)c(Cl)c1 452643360 JGEAXIDQGLFVTF-KGLIPLIRSA-N 394.780 5.047 30 20 GKED CC(C)Cn1ncc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C(F)F 455021543 IJDROGSEWKWJEH-INIZCTEOSA-N 389.450 5.033 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2)c1ccccc1 455337229 ZUPWUIBAIBHFDJ-SESVDKBCSA-N 388.515 5.232 30 20 GKED C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)N[C@H](CCCC#N)c1ccccc1 458797052 FSXVSXPHFKKGRV-PIPMEXSNSA-N 379.479 5.148 30 20 GKED C[C@@H](C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1)c1cccc(C#N)c1 462145134 VFUWNXJIFWJKLD-OAHLLOKOSA-N 392.405 5.049 30 20 GKED CCN(C(=O)c1cccc(-c2csc(C)n2)c1)[C@@H](C)c1ccc(C#N)cc1 463147385 VIYDASXGBAGTEA-HNNXBMFYSA-N 375.497 5.214 30 20 GKED C=CCCCCCN(C)C(=O)CCc1nc2cc(Br)ccc2s1 464084809 ZINCVMIBZURUQB-UHFFFAOYSA-N 395.366 5.196 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N[C@@](C)(C#N)C(C)(C)C 464162054 KIRZBRWYUCCYFP-SFHVURJKSA-N 380.275 5.015 30 20 GKED C=C[C@](C)(CC)C(=O)N(C)c1cc(N(C)C(=O)[C@@](C)(C=C)CC)ccc1Cl 467971650 WZZPNUONWHYLDZ-FCHUYYIVSA-N 390.955 5.470 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cn(CCCC#N)c2ccccc12 469263414 PZVMOELYPWYFFX-UHFFFAOYSA-N 398.510 5.115 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 473354055 IRPLHBVNJQLCRI-AWEZNQCLSA-N 387.405 5.643 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(-c3ccco3)nc3ccccc23)n1 474428621 RVYMZGDAAWFIDG-INIZCTEOSA-N 387.464 5.565 30 20 GKED C[C@@H](CCNC(=O)C[C@H](CC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 476207730 OGPPNHQKGRSXEL-LPHOPBHVSA-N 388.433 5.403 30 20 GKED C=C(C)[C@H](NCc1cccc(OCc2ccccn2)c1)c1ccc(F)c(F)c1 479402220 MJDHHXXUWQXHDX-QHCPKHFHSA-N 380.438 5.346 30 20 GKED Cc1ccccc1[C@@H](C)SCC(=O)Nc1ccccc1SC[C@H](C)C#N 480369027 FSOKGWGTIYKKAF-NVXWUHKLSA-N 384.570 5.680 30 20 GKED CC(C)c1nn(C)cc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 482905159 RUGBVHHJSYGTKU-UHFFFAOYSA-N 394.862 5.113 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(F)c(C(F)(F)F)cc1F)c1ccccc1 487406338 PXNJWENDKBSTJU-QGZVFWFLSA-N 382.332 5.149 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 488649429 WTLBJGYMJOVEJW-JOCHJYFZSA-N 384.479 5.546 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccccc2F)n1Cc1ccco1)C1CCCCC1 489650970 PEBHYHDTANUFGJ-LJQANCHMSA-N 396.491 5.290 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccccc3OC(F)F)o2)cc1 489761793 LDIVCUGTQLFYKQ-UHFFFAOYSA-N 390.411 5.195 30 20 GKED N#Cc1ccc(Br)c(CNc2ccccc2CCC(F)(F)F)c1 492647215 CXVVEUGIYIOHGG-UHFFFAOYSA-N 383.211 5.428 30 20 GKED CCN(CC(=O)Nc1c(C(C)C)cccc1C(C)C)[C@H](C)c1ccc(C#N)cc1 497593411 BJRSVRTUIUUEDC-LJQANCHMSA-N 391.559 5.827 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)CSc1cccc2cccc(Cl)c12 498486081 GFKWEARFPYDJLJ-UHFFFAOYSA-N 380.900 5.116 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1coc2ccccc12 499583784 HSANODGLEBWHSG-UHFFFAOYSA-N 390.386 5.710 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2N2CCCCCC2)c1 502341118 SVISNHNLKJGRFC-UHFFFAOYSA-N 392.503 5.394 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCc1ccc(F)cc1Cl 503228244 ZAAWFAYFAXIMMX-CYBMUJFWSA-N 391.899 5.095 30 20 GKED Cc1noc(C)c1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 509717785 DEAXWOPHTZEBAW-KRWDZBQOSA-N 380.835 5.244 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 509926010 HFXXQGWHCKHTMS-NSHDSACASA-N 396.249 5.548 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1ncc(-c2cccs2)o1 510218603 SMJPUIPOTXGEBB-UHFFFAOYSA-N 375.478 5.629 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])c2)cc1 517843166 LCNLMMCBCQHCFO-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C=C(C)CN1CCC(NCc2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 520976016 VLRYJFQZKTWKKV-UHFFFAOYSA-N 378.438 5.096 30 20 GKED CCOc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523877335 UAHSBEYLMRAQKL-UHFFFAOYSA-N 392.842 5.655 30 20 GKED COc1ccccc1[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 539497660 PBLMMMMSDSNCRO-WAIKUNEKSA-N 376.887 5.660 30 20 GKED CSc1cccc([C@H](NCc2cccc(C#N)c2F)c2ccc(F)c(F)c2)c1 541293281 GZMLTBYKFHIKNM-QFIPXVFZSA-N 398.453 5.577 30 20 GKED COc1ncc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1Cl 542018058 INJJYSRAPTZFPA-OAHLLOKOSA-N 377.875 5.133 30 20 GKED CN(Cc1ccccc1)Cc1cccc(C(=O)Nc2ccc(C#N)cc2Cl)c1 543154849 AMBQQHRHZQUTNA-UHFFFAOYSA-N 389.886 5.096 30 20 GKED C[C@H](NC(=O)CSc1ccc(C#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543859623 OCXHRSIBBHVUKP-KRWDZBQOSA-N 397.503 5.066 30 20 GKED C[C@H](c1ccncc1)c1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1 546510638 ZIBZGKUWGHRDIF-OAHLLOKOSA-N 384.464 5.306 30 20 GKED CCc1oc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1C(=O)OC 555320327 HAARVXWROPBOIG-MRXNPFEDSA-N 388.467 5.018 30 20 GKED N#Cc1ccc(CCC(=O)N2CCC(c3ccc(Cl)cc3Cl)CC2)cc1 557295827 MRTSCTKAEIJOMK-UHFFFAOYSA-N 387.310 5.204 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(C#N)c(Cl)c1 562750402 PLBGDZQQERYPCH-OAHLLOKOSA-N 382.891 5.207 30 20 GKED COc1ccc([C@H](C)N[C@H](C#N)c2ccc(Cl)cc2)cc1Br 585718987 GPAQPXFMQLTHDG-MEDUHNTESA-N 379.685 5.027 30 20 GKED CC(C)N(Cc1ccc(NCc2cccc(F)c2C#N)cc1)C[C@@H]1CCCCO1 600853088 VCEBAJYEMVJLJB-QFIPXVFZSA-N 395.522 5.089 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NCc5cccc(C#N)c5)(C4)C2)C3)cc1 603509528 FVIBMXIYSQLPAU-URFUVCHWSA-N 384.523 5.021 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3(c4ccc(Cl)cc4)CC3)cn2)c1 603622759 YGHSDYNYZIDYAW-UHFFFAOYSA-N 389.842 5.069 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(CSc2ccc(C#N)cc2)cs1 603947749 XDTAVTSYSRXDIF-UHFFFAOYSA-N 379.510 5.300 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cc4sc5ccccc5c4s3)[nH]c12 605363047 FDGQQOBZJOVSFU-CYBMUJFWSA-N 387.489 5.791 30 20 GKED N#C[C@@H](C(=O)c1cc2occc2s1)c1nc(-c2c(F)cccc2F)cs1 606145719 JPICFCOBEUCXJP-VIFPVBQESA-N 386.404 5.386 30 20 GKED CN(C(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccc(C#N)cc1F 608798622 ZWHRWRAUFPSWAU-UHFFFAOYSA-N 394.833 5.060 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)F)cc2)cc1Cl 608805381 VDVVRGCSUIRKQG-IBGZPJMESA-N 396.824 6.185 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CCCSc2ccc(Cl)cc2)c1 609068374 PONZRJLKSCULOV-UHFFFAOYSA-N 396.846 5.324 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c1 609105358 JVFVBMZEUYYVRK-UHFFFAOYSA-N 383.382 5.290 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1csc(-c2ccc(Cl)cc2)n1 609188378 QOLZVVCDFFXDCP-UHFFFAOYSA-N 375.925 5.256 30 20 GKED Cc1cc(C)c(C)c(OCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609427618 RZRPFQDQKSWGSI-QGZVFWFLSA-N 382.529 5.414 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)Nc1cccc(OCCCC#N)c1 609826670 PHMOKHWWMYGOQZ-UHFFFAOYSA-N 387.867 5.454 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)o1 610018474 NXQZTNICCFKEBH-MRXNPFEDSA-N 389.402 5.210 30 20 GKED O=C(CSCCC(F)(F)F)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 610137275 PIFHYASVEOOGRL-UHFFFAOYSA-N 399.278 5.348 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1N1CCc2ccccc21)c1cccc(C#N)c1 610318842 DXQGVLYPSCUSII-QGZVFWFLSA-N 382.467 5.135 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(Cl)c2ncccc12 610628359 DUGUTJJBTIYLDU-FXAWDEMLSA-N 390.874 5.192 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2NCc2ccnc(C#N)c2)cc1 610956172 WQOMFDWTZILAMW-UHFFFAOYSA-N 384.483 5.115 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 612300498 JIIAKVZFXYCSOJ-SIKLNZKXSA-N 392.890 5.153 30 20 GKED C=CCC1(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCCC1 663678207 IKARFZCKOMFOJK-ITGUQSILSA-N 386.380 5.084 30 20 GKED CC(C)(C)c1noc(-c2ccccc2C(=O)[C@H](C#N)c2ccc3ccccc3n2)n1 679536139 AKTYOFPFNHDJFP-GOSISDBHSA-N 396.450 5.072 30 20 GKED C#Cc1cccc(NC(=S)N(CCc2ccccc2)Cc2ccc(C)s2)c1 726448765 TVXPIBHODRIPHM-UHFFFAOYSA-N 390.577 5.480 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1oc2c(C)ccc(C)c2c1C 726755781 IBNZHJYFTIIFMJ-UHFFFAOYSA-N 383.451 5.107 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2nc(-c3ccccc3)n3c2CCCCC3)cc1 726940846 VUJQYCCQBWXMRF-UHFFFAOYSA-N 398.510 5.145 30 20 GKED CC(C)N(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Cl)cc1 728927649 WMKGSNGQLLZBOI-MRXNPFEDSA-N 383.904 5.041 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1 734966005 SOLKGKPISFGCHE-ACJLOTCBSA-N 389.282 5.143 30 20 GKED CC[C@@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc(OC)c1 741132658 GKRTUSAKMJLSHC-OAQYLSRUSA-N 388.423 5.062 30 20 GKED O=C(/C=C/C=C\c1ccccc1[N+](=O)[O-])c1ccc(-c2ccc(C(=O)O)o2)cc1 750903950 UVXFKMUJRBNUBP-VKDZAETISA-N 389.363 5.005 30 20 GKED CCN(CC)[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 755610393 NJOZSAUIGMMJLA-LPHOPBHVSA-N 397.931 5.209 30 20 GKED COc1c(Br)cc(Cl)cc1NCc1ccc(O[C@@H](C)C#N)cc1 770511994 IUXOGXGADPZBMC-NSHDSACASA-N 395.684 5.014 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2sc(-c3cccnc3)nc2C)c1 772984259 PGERKHFJEPNLKO-DNVCBOLYSA-N 392.528 5.045 30 20 GKED CS[C@H](C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773771989 USVWSLKYOSODNJ-MFKMUULPSA-N 399.368 5.825 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)Cc1ccccc1CC#N 776890627 RYTAAYRTPURBIZ-LJQANCHMSA-N 384.479 5.382 30 20 GKED COc1ccc(COCc2cccc(N[C@@H](C)c3ccc(C#N)c(F)c3)c2)cc1 777217410 YRLVUDGSWLCHCU-KRWDZBQOSA-N 390.458 5.596 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1O[C@@H](C)C#N 790927219 RUHLJLWFSKKBCY-GOEBONIOSA-N 390.405 5.204 30 20 GKED C[C@H]1C[C@@H](C)O[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 800386811 NVCWPYJGDMSVFT-ACKFJWLVSA-N 395.311 5.107 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)cc1Cl 810529253 CGGHGDIFYWXNTA-CYBMUJFWSA-N 389.282 5.252 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)sc2cc(F)ccc12 813210300 LYYIXFSHURSWSB-CYBMUJFWSA-N 378.350 5.253 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813214793 DONKNTNBTDUZQN-GWCFXTLKSA-N 386.295 5.099 30 20 GKED CC(C)c1ccc(Nc2nn(CN3CCC[C@H](CC#N)C3)c(=S)s2)cc1 853526625 VBTIGAGRTOLCJK-OAHLLOKOSA-N 387.578 5.124 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnn(C(C)C)c3Cl)n2)cc1 860475350 ZHDYXLNIHNJWFZ-CQSZACIVSA-N 384.892 5.039 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2nc3ccccc3o2)cc1 915085588 CRFXFNDOBSEOEJ-FQEVSTJZSA-N 381.435 5.055 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(F)cc2Cl)cc1 915087659 WKYCMKJJEVDLMD-IBGZPJMESA-N 394.833 5.152 30 20 GKED CCOCc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915353639 PUNDTFADRGIACL-XMMPIXPASA-N 399.494 5.200 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2cccc(Cl)c2)cc1 915353892 ZENYYTUVTDHTCQ-JOCHJYFZSA-N 389.886 5.360 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](c1ccccc1)c1cccc(Cl)c1 916025607 FXRKFVINMRVKNA-FQEVSTJZSA-N 377.900 5.288 30 20 GKED CSc1cc(C)ccc1Cn1c(C2CC2)nnc1N(CCC#N)CCC(C)C 1771418882 LPXOTSVXCJXXHM-UHFFFAOYSA-N 397.592 5.000 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3ccc(Cl)cc3)cc2)c1 1776115482 ZSQFHUBCVZXJER-AWNIVKPZSA-N 376.839 5.530 30 20 GKED O=C(O)/C=C/c1ccc(/C=C/C(=O)c2ccccc2OCc2ccccc2)cc1 1776126661 SOWLHOPAHGTVNY-YXLFCKQPSA-N 384.431 5.260 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2C(=O)O)cc1)c1ccc2ccccc2c1 1776131146 IXPUEYBVHAKEMT-WJDWOHSUSA-N 378.427 6.101 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)c2c(c1)C(C)(C)CC2 1776269185 AMTKJDWNZSWPNL-KHPPLWFESA-N 390.523 5.731 30 20 GKED CCCCCCCSc1ccc(C(=O)NCc2ccc(CC(=O)O)cc2)cc1 1776787529 PISINPDQJICIBN-UHFFFAOYSA-N 399.556 5.306 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)ccc1SC 1777263372 KOQKJGVTWKNMNA-NTMALXAHSA-N 394.448 5.271 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1sc(-c2ccc(C)cc2)nc1C 1777269626 VMIMEYOBEVDAKZ-KHPPLWFESA-N 393.464 5.030 30 20 GKED N#Cc1cccc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)c1 6217036 UWBZRCNVJUHBEE-UHFFFAOYSA-N 383.476 5.057 30 20 GKED C[C@H](Sc1ncccc1Cl)C(=O)Nc1sc2c(c1C#N)CCCCC2 11251322 RTESZCMQMWUBDY-NSHDSACASA-N 391.949 5.056 30 20 GKED Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1ccc(CC#N)cc1 16235009 RJVBKGZVJJHXHR-UHFFFAOYSA-N 397.887 5.002 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(/S)Nc2cccc(C)c2)cc1 22729163 YAFJPUIJLMRXRO-UHFFFAOYSA-O 395.573 5.266 30 20 GKED OC1=Nc2c(Cl)cc(Cl)cc2/C1=N\Nc1ncc(Cl)cc1Cl 24038148 ZPZOKQZQEGJQAY-UHFFFAOYSA-N 376.030 5.113 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3ccc4ccccc4c3)n2)cc1 66545388 HSNUAVDKKUOCMK-NRFANRHFSA-N 393.471 5.254 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(F)cc1 66956320 WKFOTVLQAHHDSL-BEFAXECRSA-N 383.492 5.589 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@H](c1ccccc1)C1CCC1 108372887 AVSFOSBEAIQJSG-GAJHUEQPSA-N 393.556 5.008 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2coc3ccccc23)cc1 113033375 ZQFTXOKYAVRJJU-UHFFFAOYSA-N 382.419 5.330 30 20 GKED CCN(C(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 118789383 OKAJNZTXDSPTTN-ZDUSSCGKSA-N 377.366 5.072 30 20 GKED CC(C)(C#N)CCSc1nnc(Cc2cccs2)n1CCc1ccccc1 123613830 ZPMHDMSOKLBOBE-UHFFFAOYSA-N 396.585 5.205 30 20 GKED Cc1nnc(-c2ccccc2NCc2cccc(OCc3ccccc3C#N)c2)o1 127891108 GSVKORRXMAJSIA-UHFFFAOYSA-N 396.450 5.108 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@@H]1CCC[C@@H](C(F)(F)F)C1 128964768 VSWAGLDUYHMXSU-NXEZZACHSA-N 387.295 5.074 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)n1 158624519 KVGVYSQGBHDSRB-GOSISDBHSA-N 387.439 5.296 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1cn(C)nc1-c1ccc(C#N)cc1 180240693 PEROOBQZCAETDC-MRXNPFEDSA-N 393.560 5.040 30 20 GKED CCc1c([C@@H](C)NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)oc2ccccc12 181956255 SMBMWKHTZBROFI-SJLPKXTDSA-N 392.499 5.536 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1sc(-c2cccnc2)nc1C)c1ccc(F)c(F)c1 186452071 XYTAPNFYOGXTFO-BFUOFWGJSA-N 385.483 5.760 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(C(F)(F)F)cc1 195632085 IXXUPLVALKOKHI-UHFFFAOYSA-N 388.842 5.318 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C\C(=O)c1cnn(C(C)C)c1 214920130 SEEXXOWIRNTFJW-FPLPWBNLSA-N 389.286 5.161 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc(Cl)c2)cc1 255942221 FJKWRJMUGORSQA-UHFFFAOYSA-N 378.884 5.756 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 429661134 WAVJBTWPFHYBLJ-CYBMUJFWSA-N 377.366 5.121 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2-c2ccccc2C#N)s1 430589771 BIEPSGPMIDZDDG-IBGZPJMESA-N 385.492 5.469 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 432100944 WHPMWPRHTPNOPS-ZHRRBRCNSA-N 397.519 5.273 30 20 GKED Cc1csc(-c2cccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2)n1 432860334 SATBKDSAAATGPI-HXUWFJFHSA-N 390.512 5.675 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)[C@H](C)c2cccc(O)c2)cc1 433927000 OXDUZKNUANGNCM-QGZVFWFLSA-N 386.451 5.198 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ncc(-c2ccccc2)s1 436150679 KMFZZMDNWIGVHA-MOPGFXCFSA-N 388.496 5.114 30 20 GKED C=CCn1c(SCc2ccc(-c3ccsc3)cc2)nnc1-c1cccnc1 436200169 WBJGYOAZUSHRLV-UHFFFAOYSA-N 390.537 5.547 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC2(c3ccccc3)CC2)cc1F 438659747 HCNLKMBAETVKSY-UHFFFAOYSA-N 387.414 5.300 30 20 GKED N#CCC[C@H](NC(=O)N1CCc2c(Cl)cc(Cl)cc2C1)c1ccccc1 438848101 AMCDSVXIKKQWQX-IBGZPJMESA-N 388.298 5.106 30 20 GKED CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N[C@H](CCC#N)c2ccccc2)c1 439391777 FRSGSVYVFCPZHL-GOSISDBHSA-N 399.878 5.072 30 20 GKED C[C@@H](CC#N)NC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 444938806 ZCEZERNBECLAQS-NSHDSACASA-N 386.864 5.166 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(Sc3ncccn3)cc2C)CCCC1(C)C 445243232 NFFBPLYLFUXLRS-LJQANCHMSA-N 396.560 5.535 30 20 GKED C=CCC1(CNC(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)CCCC1 454590426 AFDHCFFMBMWYLY-UHFFFAOYSA-N 381.476 5.098 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC(C)(C)CC#N 458042624 PDKXAGDBPSJREG-UHFFFAOYSA-N 394.302 5.441 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458809141 ZXVXOZIXGBTOQW-PXNSSMCTSA-N 375.472 5.570 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)CCCc2ccccc2Cl)cc1 463583415 QNNIJQJIPRTMHY-UHFFFAOYSA-N 394.824 5.125 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464470647 WPYHECODWKUYAC-AWEZNQCLSA-N 382.769 5.031 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 468316311 MWVAXXHWLQHPEF-MSOLQXFVSA-N 376.504 5.128 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-c2cn3ccsc3n2)cc1)c1ccccc1 474411266 HKDJTDBAJHFJSE-SFHVURJKSA-N 386.480 5.089 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1c[nH]c2ccccc12 475568078 CROQBJLXFLCKIJ-UHFFFAOYSA-N 375.516 5.774 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccccc1F 475806568 BYDOFHZQODFYNW-MRXNPFEDSA-N 388.320 5.099 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(Br)c1 479770929 UCWVDSJRMDFTRY-ZIAGYGMSSA-N 375.335 5.874 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc2ccccc2n1C(F)F)c1ccc(F)c(F)c1 480702922 XENSMQWIWKCOHZ-KZULUSFZSA-N 377.385 5.678 30 20 GKED C=CCCO[C@@H](C)C(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 481063085 VAICXOZTXPLYCU-HTAPYJJXSA-N 394.540 5.215 30 20 GKED CCOCCC1(CNC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCC1 481640972 UAQVJLUPBIMNJL-UHFFFAOYSA-N 394.540 5.036 30 20 GKED N#Cc1ccc(SCC(=O)Nc2nc(-c3ccc(Cl)s3)cs2)cc1 482168418 ZGBLMXYFLUGSKS-UHFFFAOYSA-N 391.930 5.127 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1nccc2ccccc12 483218890 QRSZWDMAOMNOIU-OAHLLOKOSA-N 391.402 5.127 30 20 GKED N#Cc1ccc(NC(=O)c2cc(F)c(Br)cc2Cl)c(Cl)c1 483866573 JCTDIYHCGIAIRB-UHFFFAOYSA-N 388.023 5.019 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc(Oc2cccc(F)c2)nc1 486243150 JIBRIIZIGWQGEH-UHFFFAOYSA-N 394.471 5.221 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 488280194 QLVWBXDQDZEISP-FQEVSTJZSA-N 375.472 5.018 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(CN2CCSCC2)ccc1C)c1ccccc1 488703570 PDBYDNPLTKDIIB-JOCHJYFZSA-N 394.584 5.232 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1ccc(Br)cc1 489140586 QQMVBPINKLELLZ-UONOGXRCSA-N 375.335 5.874 30 20 GKED CCCC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(OC)cc1 491922197 SWDULXKYSSXORK-OAQYLSRUSA-N 379.504 5.549 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 494754359 XCMRTENMLUWMCL-UHFFFAOYSA-N 396.450 5.496 30 20 GKED N#Cc1ccc(CCC(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 502406478 OLUCMWPANFHQDA-HSZRJFAPSA-N 392.861 5.189 30 20 GKED CCCN(C(=O)c1cccc(CC#N)c1)[C@@H](C)c1ccc(Cl)c(Cl)c1 502786578 AENNOTCGFSGURM-AWEZNQCLSA-N 375.299 5.673 30 20 GKED CCc1ccc2occ(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)c2c1 505314471 NYZUBWCSNFTTQK-UHFFFAOYSA-N 397.434 5.615 30 20 GKED N#C[C@H](C(=O)c1ccc([C@H]2CCCOC2)cc1)c1nc(-c2ccccc2)cs1 505435268 UHJZVNFXOIZWLL-VQTJNVASSA-N 388.492 5.194 30 20 GKED CCOc1ccc([C@H](NC(=O)Nc2ccc(CC#N)cc2)c2ccccc2)cc1 505535698 HLSVDEHGYKIPQC-HSZRJFAPSA-N 385.467 5.062 30 20 GKED N#Cc1ccc(SCc2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1 512042033 RYDYNBKVOWNGRR-INIZCTEOSA-N 393.365 5.311 30 20 GKED C=C(C)CN(Cc1ccc(OCc2cccnc2)cc1)Cc1cnn(C(C)C)c1 512561205 IZNADPAFCDPWAI-UHFFFAOYSA-N 390.531 5.016 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 521793665 YKHNCMSMPGYDTA-GOSISDBHSA-N 385.467 5.407 30 20 GKED N#CCc1ccnc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1 531924532 GRXZMHGATPGUNW-UHFFFAOYSA-N 381.357 5.086 30 20 GKED CC(C)N(CC(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 533184373 DIYWICSGSLHFTB-UHFFFAOYSA-N 378.806 5.120 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@@H]1COc2ccccc21 533630245 GVDLZZNHZDVKGQ-AOMKIAJQSA-N 399.450 5.037 30 20 GKED C=C[C@@H](CC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 535409481 AQMRTOQTWOQIMK-FQEVSTJZSA-N 399.494 5.307 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2scnc2C2CC2)cc1 536477266 ZFTSVWPSQUSWPP-UHFFFAOYSA-N 379.416 5.076 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccc(F)cc1)c1ccc(-c2cccc(C#N)c2)cc1 541157945 ZBNYBQPJMDBMRD-KRWDZBQOSA-N 387.458 5.267 30 20 GKED N#Cc1ccc(CSCc2nc(-c3ccccc3C(F)(F)F)no2)cc1 546945278 PISYVYAOPALOOH-UHFFFAOYSA-N 375.375 5.060 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(OC)c(OC)c2C)cc1Cl 558117958 HPQMEHTYVKQRQD-OAHLLOKOSA-N 375.896 5.081 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 566703338 SEEOZYMDMFPAFD-UHFFFAOYSA-N 398.249 5.499 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)CC1 571281759 RBCMGNGISRZRKN-UHFFFAOYSA-N 399.441 5.091 30 20 GKED N#CC(CCN1CCC=C(c2ccccn2)C1)(c1ccccc1)c1ccccc1 579073519 FWYBQEPLTRLQJZ-UHFFFAOYSA-N 379.507 5.071 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CC1(C(F)(F)F)CC1 583285691 KJKLVUHFXARIHW-UHFFFAOYSA-N 392.808 5.477 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 592974649 WIIOBOSHPLNIJG-AWEZNQCLSA-N 393.468 5.357 30 20 GKED N#CC1(c2ccc(CNc3cccc(C[S@](=O)C4CCCCC4)c3)cc2)CC1 594933427 FNBMQKBPJMCXEE-NDEPHWFRSA-N 392.568 5.435 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(CCc3ccccc3)CC2)cc1 603656284 GJZHBATZTWPDMK-UHFFFAOYSA-N 375.516 5.364 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)CNc1ccc(C#N)cc1 604525816 QKWHJEQCNHYVJK-UHFFFAOYSA-N 379.529 5.342 30 20 GKED CCc1ncc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 609062639 WUWFVFHIFXAZEM-UHFFFAOYSA-N 397.887 5.062 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1SC[C@H](C)C#N 609376770 JAQIBFDRWOUNOV-XLIONFOSSA-N 396.556 5.858 30 20 GKED N#C[C@@H](NC(=O)c1cc(C2CC2)nc2ccccc12)c1cccc(C(F)(F)F)c1 609460634 INGLZDRQWOBGOD-HXUWFJFHSA-N 395.384 5.126 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@H](c3ccccc3)C3CCC3)cc2)nc1 609504776 FRIFLFZALRUDCR-HSZRJFAPSA-N 383.451 5.017 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1S[C@H](C#N)C1CCCCC1 609648777 ZXMXEBKFSWDXNW-HXUWFJFHSA-N 398.576 5.468 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)Cc1ccccc1 609772465 CPDUOCKZSVJWKU-KRWDZBQOSA-N 381.545 5.471 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H](Cc1ccccc1)C1CC1 609911932 IOOWTECXCHFOGN-QFIPXVFZSA-N 398.531 5.461 30 20 GKED N#CCc1cccc(C(=O)N(Cc2cccs2)C23CC4CC(CC(C4)C2)C3)c1 610108020 COOVEFUBSJKRMS-UHFFFAOYSA-N 390.552 5.425 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)C1 612308030 NLAQUUDPUAHZDX-QFIPXVFZSA-N 379.529 5.278 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N[C@H]2CCc3cc(C#N)ccc32)cc1 618810730 FGMZPOVEKBVEQP-VFNWGFHPSA-N 379.529 5.106 30 20 GKED O=C(CC1CCC(F)(F)CC1)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 623982671 CZSRZOJAISGHHV-GDNZZTSVSA-N 395.334 5.228 30 20 GKED O=C(CCC(F)(F)F)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494292 IGBBDKVSVZPYMT-UHFFFAOYSA-N 385.201 5.257 30 20 GKED CCCCCCCCC(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1 728254100 OFPHGUYVTIKYML-UHFFFAOYSA-N 377.548 5.045 30 20 GKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 728770163 OLTCBMKGUISXGW-RTWAWAEBSA-N 399.519 5.688 30 20 GKED CC(=NNc1ccc(Cl)nn1)c1c(F)cccc1O[C@H](C)c1ccccc1 730143965 GFUYTPVHHSWJJT-CQSZACIVSA-N 384.842 5.245 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416130 AUBXNARPJRFMFI-CQSZACIVSA-N 395.484 5.395 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SC(F)(F)F)c1nc2cc(F)ccc2s1 730417804 QZBILPAVZNDZJW-NSHDSACASA-N 396.390 5.537 30 20 GKED CCCOc1ccccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 733622049 OWTTYJWOSANLSR-NRFANRHFSA-N 385.467 5.775 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)NCc1cccc(O[C@@H](C#N)CC)c1 733806198 IDNKBGKLWRPUEL-IRLDBZIGSA-N 379.504 5.050 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cccc4cccnc34)c2)s1 740022084 BMFPFTJSKKHETR-UHFFFAOYSA-N 384.464 5.157 30 20 GKED O=C(/C=C\c1nccc2ccccc12)c1c[nH]c2cc(Br)ccc12 740765597 IUXIQNLAIISPAM-FPLPWBNLSA-N 377.241 5.375 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)ccc2c1 747193045 CUDSGVJLHAZRFJ-NTPDMAOXSA-N 376.481 5.318 30 20 GKED Cc1ccc(/C=C\C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(Br)c1 747198505 XZCPCZXGVGEFPR-LMVHVUTASA-N 389.318 5.227 30 20 GKED C=CCn1c(SCCSc2ccc(Cl)cc2)nnc1-c1cccnc1 748345926 HDZHSJOCWILYRK-UHFFFAOYSA-N 388.949 5.064 30 20 GKED CSc1cc(O)ccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 754484641 YYEFHEDCHQNWBE-UHFFFAOYSA-N 390.464 5.225 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)Cc1cccc(OCC#N)c1 760387615 VMKSQXINGGNJGB-UHFFFAOYSA-N 390.870 5.399 30 20 GKED CSc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1F 766355881 OPFUBNLHGOZMOG-IBGZPJMESA-N 376.456 5.455 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ncccc2C(F)(F)F)s1 770683938 HREHVGCFQRCFNM-UHFFFAOYSA-N 386.443 5.107 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2C[C@@H](C)c3c(Br)cccc32)c1 772986499 XSLCSKVWUVGQNQ-KKVAFCGZSA-N 399.332 5.468 30 20 GKED CC[C@@H](C)n1nc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 775489692 XQLGBIMEFKLMLH-IIBYNOLFSA-N 387.487 5.462 30 20 GKED N#C[C@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1nccc2ccccc12 792094775 GQYJFYUXZUXWLH-MRXNPFEDSA-N 391.883 5.307 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(C(F)(F)F)cc1 792095777 YEEOLXUNPMQHRO-AUUYWEPGSA-N 382.385 5.624 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567321 GNUZJEONCOJKFT-YJBOKZPZSA-N 382.529 5.136 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571006 MUFZHGJFFNUPJZ-TZMCWYRMSA-N 376.909 5.128 30 20 GKED N#CC(CCOC(=O)c1cc(F)ccc1F)(c1ccccc1)c1ccccc1 914886007 FJRLAQZYXSIWDE-UHFFFAOYSA-N 377.390 5.022 30 20 GKED Cc1cc(C)cc(OCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915085523 NBKRKNXEYRYGQI-DEOSSOPVSA-N 384.479 5.367 30 20 GKED CCOC(=O)Nc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915086285 ISUKFSFHPOBMFJ-QFIPXVFZSA-N 399.450 5.163 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccc(Cl)cc2)cc1 916948219 FDUOHLHYWFQYRT-MGPUTAFESA-N 382.891 5.134 30 20 GKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)c2ccccc2OCC#N)c1 919980110 NMILNXMKDSZFEU-UHFFFAOYSA-N 392.842 5.595 30 20 GKED O=C(/C=C\c1ccc(OCc2ccccc2)cc1)c1ccc(N2CCOC2=O)cc1 920749531 JRQBCCZWNMCLKT-NVNXTCNLSA-N 399.446 5.118 30 20 GKED Cc1cc(Oc2ccc(C=NNc3ccccc3C(=O)O)c(Cl)c2)ccc1F 1776031020 IOSQUYRMAHCHBT-UHFFFAOYSA-N 398.821 5.724 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(C(=O)O)cc2)c2c(c1)C(C)(C)CC2 1776269270 YSWHVYOBWJINAC-DHZHZOJOSA-N 376.496 5.802 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776388556 DTFITQLSBJASLX-FLIBITNWSA-N 392.407 5.034 30 20 GKED CC(/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C)=C/c1cc(F)cc(F)c1 1776398729 FUZOINADDWBLAL-AWYLKBENSA-N 386.394 5.293 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2ccc(O)c(C(=O)O)c2)cc1)c1ccccc1 1776469417 KWXNAIPMJLBBER-ROCHPLJESA-N 388.419 5.127 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1 1776785638 YNYZKCGJZCEICY-RAXLEYEMSA-N 386.513 6.082 30 20 GKED CCCCCCCOc1ccc(CN[C@@](C)(CCc2ccccc2)C(=O)O)cc1 1776787842 BCZQVTVJBOLXFV-VWLOTQADSA-N 397.559 5.602 30 20 GKED CCOc1ccc(Cl)cc1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776931349 DFGXVSUVBMQIBL-YVMONPNESA-N 388.847 5.120 30 20 GKED CSCc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1777401447 BWJUKRWIDINITB-IZZDOVSWSA-N 378.449 5.404 30 20 GKED Cc1occc1-c1nnc(SCc2cccc(C#N)c2)n1Cc1ccccc1 26121448 JUXLCTDNYBAHCF-UHFFFAOYSA-N 386.480 5.059 30 20 GKED COCc1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)oc2ccccc12 41536974 YUAXMHFHSNDHSR-INIZCTEOSA-N 388.448 5.193 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 78877003 GJSFAGISNKJMJW-ZWKOTPCHSA-N 385.294 5.183 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccccc2F)n1Cc1ccccc1 97599219 RVOPCZZMFAWHBN-UHFFFAOYSA-N 380.492 5.164 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Br)cs1 108239452 QNOFUQLEHGNLHG-SNVBAGLBSA-N 381.320 5.015 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)[C@@H](C)c2cc3ccccc3o2)c1 113980280 QNGGXTKHMTYTKD-LPHOPBHVSA-N 391.471 5.016 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 120820286 LTLCNGOOOJFGJQ-UHFFFAOYSA-N 389.480 5.134 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 122002970 CDMMBIYUNBAFHJ-UHFFFAOYSA-N 399.406 5.088 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2)=C(/S)N[C@@H](C)CC)cc1 154521209 KXUYKRZWWILZHU-KRWDZBQOSA-O 383.581 5.205 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(OCC(F)(F)F)cc1 172907418 HPRQMNMHTXYVNQ-AWEZNQCLSA-N 380.435 5.634 30 20 GKED Cc1cccc2c(CCC(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c[nH]c12 174001402 LYWZVTNKZYHPIV-MRXNPFEDSA-N 392.409 5.030 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](CCC#N)c3ccccc3)s2)cc1 181576911 KHOSLBGTCFHYDR-IIBYNOLFSA-N 391.540 5.823 30 20 GKED COc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1Br 195656662 WVJBUZIVXDQRDA-CQSZACIVSA-N 389.293 5.313 30 20 GKED C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303168995 QXTPYUXQQXWNTR-LBPRGKRZSA-N 377.271 5.201 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)C[C@H](c2ccccc2)C(F)(F)F)c1 303226355 XAKYHKXWSXFTKG-OAQYLSRUSA-N 397.396 5.530 30 20 GKED OC(=Nc1cccc(N2CCCC2)c1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329478986 QICKQWIIKDVMOC-LJQANCHMSA-N 392.547 5.382 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@H]3C[C@]34CCOc3ccccc34)n2)s1 329642431 CUVAAHIVZVWQDA-VLIAUNLRSA-N 397.525 5.212 30 20 GKED Cc1nc2cc(Cl)c(N=C(O)c3cnc([C@H]4CCCO4)s3)cc2s1 330141623 XVBBGZRZNWSNAV-GFCCVEGCSA-N 379.894 5.202 30 20 GKED C=CCCc1ccccc1NC(=O)c1cn(-c2ccccc2)nc1-c1cccnc1 410352274 ZONRQNBFCGOSIZ-UHFFFAOYSA-N 394.478 5.305 30 20 GKED C=CCC(C)(C)C(=O)NCc1ccc(Cl)c(NC(=O)C(C)(C)CC=C)c1 410610607 SWQPSNDPKPOOSW-UHFFFAOYSA-N 376.928 5.099 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 431719005 MURJINJUZOBVTD-OAQYLSRUSA-N 387.487 5.046 30 20 GKED Cc1ccc(Br)cc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432675090 ICEOXVDLBMVYRN-QGZVFWFLSA-N 386.293 5.314 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(CO)CC(c2ccccc2)C1 433854010 MOTLPQIFSVNHOW-UHFFFAOYSA-N 392.543 5.216 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C(C)(C)C1 434211987 PSVQMPISAKOQNQ-IEBWSBKVSA-N 393.556 5.738 30 20 GKED C[C@H](c1ccccc1)N(Cc1cn(CCC#N)nc1-c1ccncc1)CC1CCC1 435126983 SYVSSWFQTAUHAE-HXUWFJFHSA-N 399.542 5.222 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(NCc3ccc(C#N)o3)cc2Cl)n1 436416888 ZHRXWQPLYJLPFR-UHFFFAOYSA-N 388.880 5.358 30 20 GKED CCCCOc1ccc(OC)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439306717 UDOFXLSKVZUABS-IBGZPJMESA-N 381.476 5.041 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc(-c2cscn2)c1 443861927 YCJVASZCAWRRLE-UHFFFAOYSA-N 387.489 5.663 30 20 GKED C=CC1CCN(C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CC1 444031573 MGCOXYYRXVDJLV-OAHLLOKOSA-N 394.359 5.307 30 20 GKED CC(C)(C)c1cccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1O 444372312 PQYHQFVMIUTVLD-UHFFFAOYSA-N 375.472 5.200 30 20 GKED C[C@H](NCCCCC(C)(C)C#N)c1cccc(NC(=O)Cc2ccccc2F)c1 444691418 YRHPMRZPSXHFAM-SFHVURJKSA-N 395.522 5.378 30 20 GKED Cc1nc(-c2cccc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)c2)cs1 464944927 ZAZVPWJOKYCOHU-UNMCSNQZSA-N 387.508 5.031 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@H](OC)c1cccc(Cl)c1 466345541 ZGFYXTWBLDYURJ-INIZCTEOSA-N 399.343 5.140 30 20 GKED N#Cc1cn(C/C=C/c2ccc(Cl)cc2)c2ccc(Br)cc2c1=O 468468010 OJMUSJINNGBWQV-OWOJBTEDSA-N 399.675 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)[C@@H]1Cc2ccccc2O1 475564468 BEYGCGOZHDCYRV-VGSWGCGISA-N 378.516 5.394 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 475716649 TWZWQCMRYUQZGE-XUTJKUGGSA-N 381.907 5.078 30 20 GKED N#CC[C@@H](CC(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 476055383 VUUNMGIIIXTSQP-AZUAARDMSA-N 384.932 5.044 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)[C@@H](C)C(F)(F)F 477967315 PVHABWAXQFNDMY-LBPRGKRZSA-N 396.796 5.417 30 20 GKED C=C(C)[C@H](NC(=O)Nc1c(F)ccc(OCC)c1F)c1ccc(F)c(F)c1 480932140 UPQNFWSTFDMACA-KRWDZBQOSA-N 382.357 5.081 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)Nc1cc(C#N)ccc1OC 482526029 DTKKGBHZZXMOML-UHFFFAOYSA-N 388.423 5.010 30 20 GKED CC(C)(C)[C@H]1C[C@@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 482928202 CXJFACSHVSLYBK-GHTZIAJQSA-N 393.487 5.066 30 20 GKED Cc1c([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccccc12 484148555 UOSBHPJDSQRISI-HOCLYGCPSA-N 393.512 6.018 30 20 GKED N#CCCC[C@@H](NC(=O)COc1ccc(-c2ccccc2)cc1)c1ccccc1 487588570 BHSQMOWHZLPJMP-XMMPIXPASA-N 384.479 5.284 30 20 GKED C=CCn1c(SCc2nc3ccc(F)cc3o2)nnc1-c1ccc(C)cc1 489664152 VVCUXQOGIHLXGJ-UHFFFAOYSA-N 380.448 5.012 30 20 GKED N#Cc1ccc(Br)c(CN[C@@H](CC(F)(F)F)c2ccccc2)c1 492606638 KNWLUAUTCUAZNU-INIZCTEOSA-N 383.211 5.104 30 20 GKED CC(C)C[C@@H](NCCCC1(C#N)CCOCC1)c1cccc(C(F)(F)F)c1 499602144 JYWAYZNBYONPFT-LJQANCHMSA-N 382.470 5.483 30 20 GKED COCCN(CC(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510042036 GEALKJMSKOCRLE-HXUWFJFHSA-N 399.922 5.132 30 20 GKED N#Cc1ccc(/C=C/c2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)nc1 510316675 UQZAKGIKUVRVGT-QPJJXVBHSA-N 394.261 5.683 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 511372650 SEUSCGZBINOFRZ-UHFFFAOYSA-N 399.237 5.008 30 20 GKED N#C[C@H](C(=O)c1ccc(-n2cccc2)c(F)c1)c1nc(-c2ccccc2)cs1 511727328 ABSFMJLOQXXZHB-QGZVFWFLSA-N 387.439 5.230 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCc1cccs1 516641154 SULWWMGSRNOAJK-UHFFFAOYSA-N 377.469 5.085 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccccc3N3CCCC3)cc2)cc1 518905144 GQBLWOBMBHWPNT-UHFFFAOYSA-N 397.478 5.397 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 518916605 JCDLBXNCTGDVOT-JOCHJYFZSA-N 383.451 5.031 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccc(Cl)cc1 519413226 IXDMNAKCINVAJO-CYBMUJFWSA-N 376.934 5.323 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 520170801 PIDHVEZBNYXXGV-LLVKDONJSA-N 381.785 5.455 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N3CCC(CCC#N)CC3)oc2c1 522061449 VKZRUDHDDRGJSD-UHFFFAOYSA-N 388.467 5.264 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)c1ccccc1F 524819312 GMXOGFBBRARAHY-UHFFFAOYSA-N 397.315 5.751 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CSCc1ccccc1 533443644 IBTJGJGQDNMSFY-SJORKVTESA-N 384.570 5.446 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)cc1OC(F)F 536838880 MXLPDIVTEBZFMJ-BMIGLBTASA-N 395.318 5.911 30 20 GKED C=CCC[C@H](NCc1noc(-c2ccccc2)n1)c1ccc(C(F)(F)F)cc1 537130245 BTMOURGRVRHFDQ-SFHVURJKSA-N 387.405 5.553 30 20 GKED CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 540821028 KJIBQSMCTOTOLG-UHFFFAOYSA-N 384.483 5.014 30 20 GKED Cc1cnc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541121183 ZOULNQMCMQQQDL-CVEARBPZSA-N 390.512 5.112 30 20 GKED N#CCCCNC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 541603546 WURIUFNELSRLHD-UHFFFAOYSA-N 382.382 5.029 30 20 GKED COC(=O)c1cc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)s1 542942855 WUMHWPNJSOFBAQ-HNNXBMFYSA-N 390.508 5.233 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)C2CC2)cc1 544230839 GYSPNCXYEMAYIG-UHFFFAOYSA-N 393.796 5.427 30 20 GKED CC[C@H](CC#N)NC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 547275969 MRGIIYGQPXLFIV-HXUWFJFHSA-N 393.918 5.084 30 20 GKED C[C@@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn12)c1ccc(C#N)cc1 548935968 FEJRQZUGQDRORJ-CQSZACIVSA-N 392.915 5.439 30 20 GKED CC(C)Nc1ccc(Br)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 554308232 QUBZXOQMGMNVEN-UHFFFAOYSA-N 398.304 5.077 30 20 GKED CN(C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)[C@H]1CC[C@@H](C(F)(F)F)CC1 573041679 XINQBVOXNJXNOV-BJHJDKERSA-N 393.331 5.162 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)[C@H]1c1cccs1 575948121 JQQDYWYMMGMBQP-FQEVSTJZSA-N 389.480 5.030 30 20 GKED CC1CCN(CCC[C@H](NCc2ccc(C#N)cc2F)c2ccc(F)cc2)CC1 585726018 ORZCEFRWBLYUPM-DEOSSOPVSA-N 397.513 5.179 30 20 GKED CC(C)(C#N)C[C@@H](O)CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1 598704154 MDEWDNQBTSNENC-GFCCVEGCSA-N 389.571 5.260 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 609171787 BZRAGNFKAXPLIP-NTKDMRAZSA-N 384.479 5.140 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCO[C@@H](c2ccccc2)C1 609435039 MRIPFXLDRYROAU-FXAWDEMLSA-N 395.528 5.076 30 20 GKED C[C@@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccc(C#N)cc1 610222895 PPZDHNJXNCXKPO-CQSZACIVSA-N 397.906 5.077 30 20 GKED C[C@H](NC(=O)NCc1ccccc1-c1ccc(Cl)cc1)c1cccc(C#N)c1 610350004 KHSFGHPDJNVOMD-INIZCTEOSA-N 389.886 5.439 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1)c1cccc(C#N)c1 610407238 SHCIPWLZLRBRRW-KRWDZBQOSA-N 379.479 5.303 30 20 GKED COCCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C1CCCC1 610558431 KXQNKWQLACOOSQ-UHFFFAOYSA-N 393.487 5.082 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)N[C@H](C)c1cccc(C#N)c1)C1CC1 610664083 OWOIVQABDCEBAC-MSOLQXFVSA-N 383.495 5.708 30 20 GKED CC(C)c1n[nH]cc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 649227874 REQBMJCWVCOOAV-UHFFFAOYSA-N 397.294 5.075 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2csc([N+](=O)[O-])c2)CC3)cc1 727780904 WIWPZRPSRNRRIL-MDWZMJQESA-N 398.465 5.001 30 20 GKED C/C(=C/C(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(C(F)(F)F)cc1 728012640 JNESQEYPBCKAAL-FLIBITNWSA-N 396.315 5.220 30 20 GKED O=C1/C(=C\c2nccn2Cc2ccccc2)CCc2nc(-c3ccccc3)sc21 734095159 LQXZLNUUQIPZCA-CYVLTUHYSA-N 397.503 5.267 30 20 GKED C=CCCOC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 740205390 VLKMDHHXLNFHIO-DTQAZKPQSA-N 394.452 5.255 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)c2cccc(-c3cscn3)c2)c1 742659092 HIBVEESMKVJZKC-UHFFFAOYSA-N 384.460 5.231 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 743030046 ZMVAERGZDUFLAP-IBGZPJMESA-N 389.927 5.247 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)(C)C 744029295 SLUDBAJXRYNGTN-QRURKXGXSA-N 376.456 5.119 30 20 GKED C[C@@H](OC(=O)CCc1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 751655711 GSCKHWFFFAZHNM-CQSZACIVSA-N 380.831 5.104 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 754690373 SOUINRCRXXLYHL-TWLAMCEISA-N 379.765 5.546 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C\C(=O)c1cccc(N2CCOC2=O)c1 756785603 CRYLWXFLSMYEFY-BENRWUELSA-N 399.446 5.215 30 20 GKED CC(C)C(=O)N1CCC(=NOCc2cnc(-c3ccc(C(C)C)cc3)s2)CC1 759760238 ATDPFOMDQDYLAE-UHFFFAOYSA-N 399.560 5.085 30 20 GKED CC(C)Oc1ccc2ccccc2c1CNCc1ccc(N(C)CCC#N)cc1 766479747 WHBJEGSBHWDTFV-UHFFFAOYSA-N 387.527 5.267 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 780162659 KBFBZOARYCYLSY-HFBDAHEESA-N 392.455 5.497 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2Cl)c2cccc3ccccc23)nc1 783294709 UEIMMKALBPSRQG-DEOSSOPVSA-N 383.882 5.639 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 783521903 JVKZLNFYGHAAKN-KKSFZXQISA-N 399.332 5.297 30 20 GKED CC(=NNc1cc(Cl)cc(Cl)c1)c1sc(-c2cccnc2)nc1C 790201605 HMCSGGVJMLTRPA-UHFFFAOYSA-N 377.300 5.656 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568093 FFXFJQMWAYRLOU-SWLSCSKDSA-N 394.462 5.514 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1csc2ccccc12 806745598 UNLPXRINIYTCNP-QGZVFWFLSA-N 396.560 5.528 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)CCCCCC#N)c(C(F)(F)F)c1 808370710 CBDJBRMPKPFUJS-UHFFFAOYSA-N 399.413 5.465 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)c2cccc(Br)c2)n1 813072087 HYJWYKSOKKEIMK-FZMZJTMJSA-N 377.307 5.009 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Br)c1 813096420 LTBLXOXENPFHLM-BXUZGUMPSA-N 391.334 5.183 30 20 GKED COCc1nc(Cl)cc(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)n1 814977841 DTTGSBAAOPOCNC-ZDUSSCGKSA-N 398.816 5.031 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2cn(C3CCCC3)nc2-c2ccccn2)co1 844552868 NICAKPCWWJCUOH-KHPPLWFESA-N 376.460 5.068 30 20 GKED CC1CCN(Cc2ccc(NCc3cc(C#N)ccc3Br)cc2)CC1 864034922 AYTDFEHHBXIREJ-UHFFFAOYSA-N 398.348 5.165 30 20 GKED Sc1nnc(-c2ccco2)n1N=Cc1ccc(-c2ccccc2Cl)s1 874066555 GRKLQQVJXZKSMZ-UHFFFAOYSA-N 386.889 5.091 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(F)(F)F)O[C@@H](C)C1 879352576 WNENJFQTZIKKLS-YOEHRIQHSA-N 384.442 5.112 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)CCCOc1cccc2ccccc12 915825108 XXKBXCHVUGBOME-UHFFFAOYSA-N 395.842 5.138 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C/C(=O)c1cccc(OC(F)F)c1 916128833 FLXGTYMVZBHYRM-VAWYXSNFSA-N 382.410 5.046 30 20 GKED CC(CCc1ccc(F)cc1)=NNc1nc(C(F)(F)F)nc2ccccc12 917542635 JICYXSGORCIBDA-UHFFFAOYSA-N 376.357 5.208 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1csc3ccc(C(=O)O)cc13)CO2 1776374851 YTVHKJUEQWQIFB-CHHVJCJISA-N 378.449 5.382 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776473567 QXBWAUHCUGSAAV-MJSCBBHESA-N 378.468 5.482 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccc(Cl)cc1Cl 1776785124 DOPAJYMLYABBSS-IBGZPJMESA-N 388.379 6.582 30 20 GKED CCc1c(C(=O)/C=C/c2cccc(O[C@H](C)C(=O)O)c2)oc2ccc(C)cc12 1776956203 KNNGUXVYVLEVQX-BOLDSZDNSA-N 378.424 5.052 30 20 GKED Cc1c(/C=C2/CSc3ccc(Cl)cc3C2=O)nc2ccccc2c1C(=O)O 1777414275 WETIGHCOKNDEAP-WQLSENKSSA-N 395.867 5.267 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cc(C(=O)O)ccc3C)s2)cc1C 1777431470 PVEZZMSHTXEZFR-HJWRWDBZSA-N 377.465 5.330 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2c(C)cc(C)cc2C)nc2ccccc21 12046252 FLCVIINWOHZQSA-KRWDZBQOSA-N 379.529 5.267 30 20 GKED Cc1cc(Cl)ccc1NC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 14738885 GFOOOJPZXYVVLP-UHFFFAOYSA-N 376.843 5.205 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)cc1 16235026 VPEBDQFIKDLGFR-UHFFFAOYSA-N 397.356 5.211 30 20 GKED C=CCn1c(SCC(=O)c2cc(C)sc2C)nnc1-c1cccc(C)c1 20067898 ZOKGSKMLWILVCZ-UHFFFAOYSA-N 383.542 5.093 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1coc(-c2cccs2)n1 32787053 FFLYUIXTUBFXPC-UHFFFAOYSA-N 394.525 5.064 30 20 GKED CC(C)CN(CC(C)C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161995 WLDWFPPZCZNNKG-UHFFFAOYSA-N 393.531 5.478 30 20 GKED C=CCn1c(S[C@@H](c2ccccc2)c2ccccc2C)nnc1-c1ccncc1 97130695 UJPGCDMPUDIOFR-QFIPXVFZSA-N 398.535 5.716 30 20 GKED Cn1cc(CNc2cccc(OCCCC#N)c2)c(-c2cc3ccccc3o2)n1 98171694 FHIJXZHRPQWTBU-UHFFFAOYSA-N 386.455 5.128 30 20 GKED COc1ccc(CC[C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108528683 NFEOJDQOSSICMK-DLBZAZTESA-N 397.544 5.090 30 20 GKED COc1cccc2cc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)oc12 120032958 AYSDPOPXCIKEDY-GFCCVEGCSA-N 382.828 5.195 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1ccccc1S[C@H](C)CC#N 120230535 MCXZQXLBHKZUAF-CYBMUJFWSA-N 395.459 5.436 30 20 GKED C=C(C)Cn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccncc1 123345528 JBEZLPOVHSBKDG-AWEZNQCLSA-N 383.521 5.055 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2cccnc2)n1-c1ccc(Cl)cc1 124431747 FIJJJGUXANNYJY-UHFFFAOYSA-N 383.908 5.015 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(-c3ccncc3)nc3ccccc23)n1 131156085 IXZOHDUEEQRGPR-GOSISDBHSA-N 398.491 5.367 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)c1c(C)noc1C 131837009 YZAKWKIFRDRBBD-CQSZACIVSA-N 375.428 5.006 30 20 GKED CC(C)CO[C@H](C)c1noc(CNc2cccc(Oc3ccc(C#N)cc3)c2)n1 174309366 BCNOBSHGAGNMKZ-MRXNPFEDSA-N 392.459 5.079 30 20 GKED N#CCCn1cc(CNc2ccccc2CC(F)(F)F)c(-c2ccccc2)n1 180885364 WBFDDIOYLVEXGQ-UHFFFAOYSA-N 384.405 5.181 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2cccs2)n1Cc1ccco1 186293900 IQYOBRXROUECAF-UHFFFAOYSA-N 392.509 5.120 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 247573419 XAUKESHGPCRIHK-RBSFLKMASA-N 380.419 5.068 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(F)c(F)c(F)c1 303160610 HAQHNLYRPPGFNC-UHFFFAOYSA-N 382.341 5.329 30 20 GKED C[C@@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cc(Cl)ccc1Cl 330016568 PTHZNCKCPFMQOE-NUYPLMSZSA-N 383.319 5.936 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@H](C)CC3)c(C(F)(F)F)o1 410990386 WJEQYJSPWZLQSE-SCZZXKLOSA-N 382.407 5.478 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)c1cccc(SCC#N)c1 429867059 LZAIADQEMOXSKX-UHFFFAOYSA-N 390.533 6.014 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OCC(F)(F)F)cc1)c1ccccc1 432692223 HBHWMULGNQGEIY-SFHVURJKSA-N 391.393 5.184 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc(-c2ccccc2)cs1 437389992 JWHRQXRRQJSKCU-MRXNPFEDSA-N 387.489 5.424 30 20 GKED COc1ccc(-c2nc(CNc3cccc(Oc4ccc(C#N)cc4)c3)no2)cc1 439553497 VWXPJZVOMQWZAK-UHFFFAOYSA-N 398.422 5.021 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccccc1 440245318 UTQZWPNDJCDMKZ-JOCHJYFZSA-N 397.469 5.464 30 20 GKED C=CCC[C@@H](NC(=O)Cc1nc(C)sc1C)c1ccc(C(F)(F)F)cc1 441592857 RUHZHJMKVGFGNR-MRXNPFEDSA-N 382.451 5.145 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2cscn2)c1)c1nc(-c2ccccc2)cs1 442673579 SVCIEQUJRKXTKO-QGZVFWFLSA-N 387.489 5.424 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C 445830019 OSJCFLAAPMUXKX-HNNXBMFYSA-N 390.508 6.068 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(c3ccc(C#N)cc3F)C2)n1 447693742 NYYFLRMEUWWYLD-MRXNPFEDSA-N 393.487 5.213 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2cccc(CC#N)c2)C1 455910949 UZNCINXWDYPUNQ-LIRRHRJNSA-N 387.405 5.386 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1ccc(Cl)cc1 459784191 ASLAFMLHASRFRD-HUUCEWRRSA-N 387.936 5.024 30 20 GKED C=C(C)Cn1c(-c2cccc(C#N)c2)nnc1N1CCC[C@H]1c1ccc(C)s1 460567224 VUOQRPLLJGRMHV-IBGZPJMESA-N 389.528 5.104 30 20 GKED Cc1ccc(CCC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)s1 463460533 HRBRETJEMWPRKO-UHFFFAOYSA-N 390.508 5.273 30 20 GKED N#C[C@H](NC(=O)C1CCC(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 463766906 KIIXJRXRDFZVSR-UHYCVJNDSA-N 386.417 5.360 30 20 GKED N#Cc1cc(NC(=O)C2(C#N)CCCC2)ccc1Oc1ccc(C(F)(F)F)cc1 464307545 XVIVJCJANUXMTM-UHFFFAOYSA-N 399.372 5.392 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 464419136 CRXNQKZAEJXYQX-SFHVURJKSA-N 382.341 5.383 30 20 GKED CCSc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464467701 NVHXGABRRZAYCC-ZDUSSCGKSA-N 384.810 5.356 30 20 GKED CCCn1ccc2ccc(NC(=O)c3occc3COc3cccc(C#N)c3)cc21 465158241 WRYALLIRCDCVES-UHFFFAOYSA-N 399.450 5.347 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl)Cc1cccc(F)c1 469298857 WACGSQNMWVORAQ-YVEFUNNKSA-N 379.262 5.082 30 20 GKED CCn1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c2ccccc21 472042774 FUYMIPRVKZTBAU-GOSISDBHSA-N 380.495 5.446 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CC3(CSc4ccccc4)CC3)CC2)cc1 472380047 IQISYAYEBIKORP-UHFFFAOYSA-N 388.536 5.137 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)oc2c1ccc1ccccc12 483196707 DKNYPBDXVOSYBI-NRFANRHFSA-N 376.415 5.933 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@]1(c1ccccc1)C(F)(F)F)c1ccccc1 484143196 MBQVZACUNCRIND-GHTZIAJQSA-N 386.417 5.154 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1ccc(F)cc1)c1ccccc1Cl 484836947 MQNZRLWHZUHYSR-IBGZPJMESA-N 387.886 5.198 30 20 GKED CCc1c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cnn1C(CC)CC 485169839 YDGGIIBKRVZLDZ-UHFFFAOYSA-N 381.524 5.121 30 20 GKED C=CCC[C@@H](C(=O)N(C)Cc1cc(OC)c(OC)cc1SC)c1ccccc1 488986173 QRTZNHMGZMUKLR-LJQANCHMSA-N 399.556 5.134 30 20 GKED C=C[C@H]1CCCCN1Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 489501593 UQYARTZREVUAAN-KRWDZBQOSA-N 375.925 5.022 30 20 GKED N#Cc1ccc(Br)c(CN[C@H](c2ccccc2)c2cccc(F)c2)c1 492651070 JIOOWXNZPHURGG-OAQYLSRUSA-N 395.275 5.339 30 20 GKED COc1ccc2ccc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2c1 496199246 YJNXGWOMMXMTKV-FQEVSTJZSA-N 384.460 5.462 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CSc1ccc(F)cc1 500733652 PXKBJURQIZOLNQ-UHFFFAOYSA-N 392.455 5.529 30 20 GKED COc1cc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccc1C 500735905 AHKNVCMYFYFBGX-UHFFFAOYSA-N 386.451 5.157 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)C(c1ccccc1)c1ccccc1 501016084 DDEUTNYSDQTCJI-UHFFFAOYSA-N 392.458 5.517 30 20 GKED CC(C)Sc1ccc(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)cc1 505939389 VPIIJXBTTDCMOC-QGZVFWFLSA-N 378.419 5.201 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1 509497671 BSZKXXXLJDEUEB-QGZVFWFLSA-N 393.556 5.494 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(SCC)cc1 509544247 QMFXKWJIWGVJJX-MRXNPFEDSA-N 399.516 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1nc(-c2ccccc2)cs1 513448413 MMJXUYMKLAQYSH-AWEZNQCLSA-N 379.510 5.457 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4nc5ccccc5s4)cc3c2C1 513682821 YWKBIBCYBYGUSR-CXAGYDPISA-N 385.492 5.392 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C(=O)c1ccccc1)C(C)C 514563156 FYKNXXZZULMPNJ-QFIPXVFZSA-N 391.540 5.055 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 515868288 DFKFDQYFPUVPGQ-UHFFFAOYSA-N 393.458 5.230 30 20 GKED N#CCCSc1ccccc1NC(=O)CC1CCC(c2ccccc2)CC1 517441335 USQIJOIDCSPOGG-UHFFFAOYSA-N 378.541 5.995 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@@H]1Cc1ccccc1 518166110 VMFKMLJUWJGVJB-UYAOXDASSA-N 393.556 5.567 30 20 GKED C[C@@H](SCCC(=O)Nc1ccccc1C#N)c1ccc(OC(F)(F)F)cc1 518914555 NCJZLNCDMNHSSY-CYBMUJFWSA-N 394.418 5.280 30 20 GKED CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)NCC(C)(C)CCC#N)nc1 520453951 MRGTWQNQUGNHOP-JOCHJYFZSA-N 383.967 5.371 30 20 GKED CCCN(CC)Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520929406 YUNLXKVHPSXCMO-SFHVURJKSA-N 395.572 5.565 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@@H](c3cccs3)C3CC3)cc2)cc1 521951243 VKAJJSKDMWWQLY-JOCHJYFZSA-N 388.492 5.488 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccccc2C#N)c1 524512586 ZNTNOJYEFNFKPD-DVECYGJZSA-N 396.490 5.155 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)CSCc1ccc(C#N)cc1 524844601 OFRGTINCXZOMQM-SFHVURJKSA-N 378.541 5.181 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 535489885 XNWSVKBLNKRJSI-QFIPXVFZSA-N 375.516 5.980 30 20 GKED COc1ccc(OC(F)F)c(CNCc2ccc(-c3ccccc3C#N)cc2)c1 536888881 GDQAOJRREVERMU-UHFFFAOYSA-N 394.421 5.125 30 20 GKED Cc1sc([C@H](C)N[C@H](C)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 537293603 XXXZJHQEARGSCX-KGLIPLIRSA-N 381.932 6.055 30 20 GKED COc1ccccc1[C@@H](N[C@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 539497658 PBLMMMMSDSNCRO-MWTRTKDXSA-N 376.887 5.660 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2cc(C(C)=O)ccc2C#N)on1 542506959 NRKITIJPEMTXIM-UHFFFAOYSA-N 397.434 5.190 30 20 GKED N#CCC[C@@H](Nc1cncc(N[C@H](CCC#N)c2ccccc2)n1)c1ccccc1 553161221 FDDSSKDSFJMYNZ-FGZHOGPDSA-N 396.498 5.391 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3Cc4cccc(Cl)c4C3)c2)cc1 558340955 GOEPODDRGOWTEP-UHFFFAOYSA-N 389.842 5.552 30 20 GKED CCSCc1ccccc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 562228957 YQNGGOUXZBMLDL-UHFFFAOYSA-N 389.480 5.251 30 20 GKED N#Cc1csc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)n1 584522544 PDOCBUHFINFZDY-SFHVURJKSA-N 379.451 5.445 30 20 GKED C[C@@H](NC(=O)c1sc2ccccc2c1Br)c1cccc(C#N)c1 589437697 AXARVWKAAYTRJZ-LLVKDONJSA-N 385.286 5.026 30 20 GKED CCCCSc1ccc(C(=O)N(C)c2ccc(C#N)nc2)cc1C(F)(F)F 593277729 YMNJEZRBDZCINQ-UHFFFAOYSA-N 393.434 5.141 30 20 GKED C[C@@H](N[C@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)cc1F 595075971 DZJPMYLWDPNCIP-ZMZPIMSZSA-N 391.309 5.099 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H](c3cccs3)C3CC3)cn2)c1 603691514 OFBPMPCVWBLUHB-FQEVSTJZSA-N 390.468 5.080 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1Cl 603827906 PJDUEESFEKPNAO-MRXNPFEDSA-N 378.863 5.104 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cnc(-c2ccccc2Cl)s1 604517686 QGXHELIPXDHPMM-UHFFFAOYSA-N 393.899 5.164 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3coc(-c4ccccc4)n3)n2)cc1 606754555 WQBNYCDCWVEZFA-QGZVFWFLSA-N 385.448 5.264 30 20 GKED CC(C)C[C@H](C#N)NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 608820266 BHBCBASJPLLVDH-GOSISDBHSA-N 395.453 5.100 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c(C)s1 609062959 MFSXHKXDJDSOEF-UHFFFAOYSA-N 396.899 5.721 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1 609378223 WHYHCUVMEOJYFK-QGZVFWFLSA-N 388.492 5.983 30 20 GKED COc1c(C)ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1C 609499383 CRCCYHLIZABOGU-UHFFFAOYSA-N 386.451 5.423 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(CSC2CCCC2)c1 610147880 QQQYHXKSMIARKM-UHFFFAOYSA-N 379.529 5.398 30 20 GKED CCOc1ccc([C@@H](NC(=O)N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 610355471 RSXYAGZPTPUDAA-UUOWRZLLSA-N 399.494 5.107 30 20 GKED C=CCN(C(=O)[C@@H](C)C1CCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610550027 JNCCBILMPNWACD-AWEZNQCLSA-N 385.489 5.064 30 20 GKED N#Cc1cc(CSc2nnc(-c3ccccc3Cl)n2C2CCCC2)ccn1 610955333 SVGPOQYEUDTVGT-UHFFFAOYSA-N 395.919 5.273 30 20 GKED N#C[C@H](Sc1nnc(COc2ccc(Cl)cc2)o1)c1ccc(Cl)cc1 619864142 UCSLNOLZRLMEQO-HNNXBMFYSA-N 392.267 5.312 30 20 GKED Cc1cccc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1F 622485590 RSHCVVXNRKYQEE-CQSZACIVSA-N 379.275 5.186 30 20 GKED Fc1ccccc1-c1ncc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)s1 648381410 YUWBAWRBQVFKIQ-RYUDHWBXSA-N 398.347 5.122 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)CCCC1 657703357 XMDMHEVXCMDBSM-UHFFFAOYSA-N 389.952 5.460 30 20 GKED C=CCC[C@@H](NC(=O)[C@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676730111 ALEXZCYNADTKIJ-SJKOYZFVSA-N 380.410 5.237 30 20 GKED Fc1cc(F)c2c(c1)[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC2 677129552 MRFXWVIXIYSOEF-KEMUVXCRSA-N 387.314 5.451 30 20 GKED C/C(=C/C(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccccc1Cl 727303317 DYQRISVGXXPMHE-UVTDQMKNSA-N 392.808 5.206 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCCO[C@@H](C)C2)c1 727590498 GBBGDZSOJHVRBQ-IBGZPJMESA-N 376.541 5.206 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)N[C@@H](C)c2cccs2)c1 728227866 WSSCQQOVMMYFGL-KRWDZBQOSA-N 376.550 5.372 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccccc3Cl)c2)cc1 729159732 FBBBGSDTJIROJU-UHFFFAOYSA-N 379.872 5.813 30 20 GKED CC(=NNc1ccc(Br)cc1C(F)(F)F)c1nc(C)sc1C 731487429 UTXPQSYDLCTPOZ-UHFFFAOYSA-N 392.244 5.377 30 20 GKED Cn1c(CC(=NOCc2ccccc2Cl)c2ccccc2)nc2ccccc21 731664218 DCDOBILYQRQWNE-UHFFFAOYSA-N 389.886 5.390 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733031122 NJTYEFDCXYYUTC-RPBOFIJWSA-N 397.522 6.203 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)CCC(=O)N3)o1 734304191 FXFOWCMTBZGMFT-YFHOEESVSA-N 375.399 5.175 30 20 GKED CCN(C(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccc(C#N)cc1 742223023 GFBCVWHFHMZWIX-UHFFFAOYSA-N 383.476 5.502 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(Cl)s1 747004135 ZDHHWUJUNQOIPK-VOTSOKGWSA-N 391.883 5.545 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3ccnc4ccccc34)cc2)cc1 748728501 HTHBSFWCQJHXET-UHFFFAOYSA-N 393.446 5.023 30 20 GKED Cc1ccc(-c2nc(/C=C3/SC(=Nc4c(C)cccc4C)NC3=O)co2)cc1 749886924 RGZNIEVJJLDSDB-WOJGMQOQSA-N 389.480 5.158 30 20 GKED C=C[C@H](CC(=O)Oc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 759350871 DBXRXCJUALPMTB-MRXNPFEDSA-N 377.465 5.266 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CCC[C@@H]2c2cccs2)c1=S 764860363 QWEWBKDSASTZJV-CQSZACIVSA-N 388.587 5.185 30 20 GKED CC(=NNc1cc(C#N)cc(Cl)n1)c1ccc2c(c1)Nc1ccccc1S2 768373481 DKBWLCAMCSWAQF-UHFFFAOYSA-N 391.887 5.651 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccc(C)cc2)cc1 776161391 VTNNFXMWSTXREP-CLOONOSVSA-N 386.495 5.346 30 20 GKED C=CCC[C@H](NCc1cc(OC)c(OC)cc1O)c1ccc(C(F)(F)F)cc1 776253839 VFDWPAPOOBLGJW-KRWDZBQOSA-N 395.421 5.225 30 20 GKED C=CCSc1ccccc1C(=O)OCc1nnc(-c2ccccc2Cl)o1 776829977 WJHPRSLUHOZKBB-UHFFFAOYSA-N 386.860 5.025 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(OC)c(NC(=O)OC(C)(C)C)c1)c1ccccc1 777517645 VJKXQEMEZKTZRA-GOSISDBHSA-N 396.487 5.341 30 20 GKED C[C@H](NC(=S)Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)cc1Cl 779729254 YSDKMOMLHHZUSR-NEPJUHHUSA-N 394.327 5.332 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(C(F)F)c3)n2)cc1 790766722 DQMZUZVKWNHPNB-QGZVFWFLSA-N 382.435 5.475 30 20 GKED Cc1cc(F)ccc1CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 792733337 UXBLPZAFLIZCQS-QHCPKHFHSA-N 387.458 5.454 30 20 GKED N#CC1(CCCOC(=O)c2ccc(CSc3ccccc3)cc2)CCOCC1 800079765 IPYUGWZVQJJOBU-UHFFFAOYSA-N 395.524 5.236 30 20 GKED C=CCCc1ccccc1NC(=O)COc1ccc(C2SCCCS2)cc1 800156590 RHVOCYIFWNQCSY-UHFFFAOYSA-N 399.581 5.691 30 20 GKED N#C[C@@H](C(=O)[C@H](Oc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 802040981 VLQKTACKYWFMTQ-WIYYLYMNSA-N 397.261 5.385 30 20 GKED C=CC[C@@H](OC(=O)Cc1ccc([S@](C)=O)cc1)c1ccc(Cl)c(Cl)c1 805947403 NGVLZQAQCKBHPX-CJAUYULYSA-N 397.323 5.134 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2csc(-c3ccccc3F)n2)c1 812724884 OVEGAOLKTZGCKI-NVXWUHKLSA-N 395.503 5.481 30 20 GKED N#CCCC[C@@H](NC(=O)CCSc1nc2ccccc2s1)c1ccccc1 817319232 MENGGZRZKVYVAJ-QGZVFWFLSA-N 395.553 5.330 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2cccnc2)C2CCCCC2)ccc1OC 846151099 VKFOQKISBFJKGT-XUZZJYLKSA-N 393.531 5.182 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C/c2csc(C(F)(F)F)c2)s1 860732825 OSAIXTPDSNQHSB-ZWNMCFTASA-N 384.448 5.411 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3)o2)cc1 917518084 UCMHCLNJZPKIOR-ACCUITESSA-N 384.435 5.155 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccnc3Cl)cc2Cl)cc1 917875860 DFRWSXLHLGPPIR-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccccc3)CCC2)cc1 920059971 BMVTVELLBRTCBL-QHCPKHFHSA-N 381.479 5.543 30 20 GKED Cc1cccc(C2(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)CC2)c1 920805550 MTLVJVKXMHYXMT-OAHLLOKOSA-N 394.446 5.305 30 20 GKED CCN(c1ccccc1)c1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033436 HCBZFDSATPMVNB-UHFFFAOYSA-N 393.874 5.642 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2c(O)c(C(=O)O)cc3ccccc23)cc1 1776105890 IHVLOUARACHZCV-OAHLLOKOSA-N 376.456 5.052 30 20 GKED C=CCCC1(C(=O)O)CCN(CCCCc2ccc(Cl)c(Cl)c2)CC1 1776169711 FPFCYVLBAUDNHG-UHFFFAOYSA-N 384.347 5.449 30 20 GKED CC(C)(C)c1cncc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776278122 INRXHNBGXUPAOX-RUDMXATFSA-N 375.424 5.233 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](CC(=O)O)C2CCCCC2)cc1 1776786311 OPAVKQOBEFNAIH-JOCHJYFZSA-N 389.580 5.797 30 20 GKED CCOc1ccc(Cl)cc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776931563 YCRWKPAMJVQVNU-CLFYSBASSA-N 396.826 5.593 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc(OCc3ccccc3)c1)C2=O 1777682934 HBQKKJGVDDLTSZ-KGENOOAVSA-N 398.458 5.566 30 20 GKED Cn1c(SCc2cc(C#N)ccc2F)nnc1-c1ccc(C(C)(C)C)cc1 10408080 AQNBXBCENBAFMG-UHFFFAOYSA-N 380.492 5.083 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1 25438639 BHDNCXIPWOTZBQ-UHFFFAOYSA-N 398.466 5.384 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C)(C)c1ccccc1C 58682533 ISSPVXLOQATFCO-UHFFFAOYSA-N 385.467 5.279 30 20 GKED CC1CCC(CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1 65693607 VBVIQEBHUYTAPR-UHFFFAOYSA-N 378.541 5.407 30 20 GKED C[C@H](NC(=O)/C=C\c1cn(CCC#N)c2ccccc12)c1cccc2ccccc12 97985758 XBSBGPKCLRCGSM-AVCMKVNGSA-N 393.490 5.599 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3coc(-c4cccs4)n3)o2)cc1 126311569 HVEWAHCDBODFCP-UHFFFAOYSA-N 397.481 5.310 30 20 GKED N#CCSc1cccc(C(=O)Nc2c(O)c(Cl)cc(Cl)c2Cl)c1 127625359 WWEBFVJAAFQRLB-UHFFFAOYSA-N 387.675 5.220 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 131197563 FALUPMWRVSRKJA-RDPSFJRHSA-N 398.462 5.001 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(F)c1F 161576606 NZSKPLLHNNYMEO-OLZOCXBDSA-N 375.444 5.242 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(Oc3ccccc3Cl)CC2)cc1 161967056 DWNHPYREGGVZPD-UHFFFAOYSA-N 397.906 5.216 30 20 GKED N#CCCCCNC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 171402269 OBPYHBLWQXKVTO-UHFFFAOYSA-N 391.393 5.100 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 179363313 NDBWDSJHEDNZMN-MJGOQNOKSA-N 380.557 5.088 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccc(-c4cccc(F)c4)c(F)c3)o2)cc1 181945372 PCESPDAKSTWGQP-UHFFFAOYSA-N 388.377 5.166 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1 184357675 ZOFSCLCUHYKQGA-ZHRRBRCNSA-N 389.430 5.028 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 184488472 LOOOMFMMNUIUTH-ZDUSSCGKSA-N 378.457 5.053 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2F)cc1 237707127 UMVRRFLQNOIMFH-NRFANRHFSA-N 395.275 5.339 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(C(=O)N(CCC)CCC)c1 410360512 AMKPQYXNKAYPEK-UHFFFAOYSA-N 378.516 5.320 30 20 GKED Cc1ccccc1NCCC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437481565 NBGNEGOUNJGVFS-UHFFFAOYSA-N 389.430 5.239 30 20 GKED N#Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)cc1C(F)(F)F 438631742 JKIFRJXIURSXBH-MRXNPFEDSA-N 377.366 5.319 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438638115 QPZZMCLUPFACSP-XIKOKIGWSA-N 391.368 5.331 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1ncc(C)s1)c1ccc(C(F)(F)F)cc1 440849386 XWCFDYYOOJLXOL-BBRMVZONSA-N 397.466 5.538 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)[C@H](C)c1cccc(C#N)c1 462022866 HOONRIWKCXRING-ZIAGYGMSSA-N 393.487 5.110 30 20 GKED CCc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)ccn1C 463588218 HVSJPWJSKJHECH-IBGZPJMESA-N 377.875 5.149 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1 475550033 MTZQXLCIEMTHBW-UGKGYDQZSA-N 391.559 5.496 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)[C@H](C)C(=O)OC 475570661 JSJLBFSYYUJMNX-UWJYYQICSA-N 394.515 5.210 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccccc1F 475806564 BYDOFHZQODFYNW-INIZCTEOSA-N 388.320 5.099 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(-c3cccc(F)c3)o2)n1 476488224 ZEPXDZDCDRGQKM-UHFFFAOYSA-N 393.365 5.367 30 20 GKED CN(C(=O)c1cccc(NCc2ccc(Cl)cc2C#N)c1)c1ccccc1 478356730 SMOJPWNRZSYCOK-UHFFFAOYSA-N 375.859 5.100 30 20 GKED CCCCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C1CC1 481627402 OVCLFDZRNMKONH-UHFFFAOYSA-N 381.451 5.073 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC(n2c(C)ccc2C)CC1)c1ccc(F)c(F)c1 483309219 OFKIARCEMGULEA-NRFANRHFSA-N 387.474 5.047 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 483436833 ILQAXOJJDVUUEB-INIZCTEOSA-N 376.378 5.020 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1cc(F)cc(Br)c1 484786637 HQVICBSIAJIAGX-UHFFFAOYSA-N 398.235 5.259 30 20 GKED COc1cccc([C@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 484962162 UVMWXBUJFOQZKB-XMMPIXPASA-N 398.462 5.336 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(Cl)cc(Br)c1)c1ccccc1 487351419 GIGAAKRDSUAIGL-QGZVFWFLSA-N 391.696 5.267 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)c1ccc(F)cc1C(F)(F)F 487768869 SHZKSCPFTUEWOQ-JTQLQIEISA-N 393.302 5.224 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1CN(C)C1CCCCC1 491271269 NHGLXGLSYYWDQU-UHFFFAOYSA-N 395.547 5.307 30 20 GKED N#Cc1ccc(CSCc2ccc(Oc3ccccc3)nn2)c(OC(F)F)c1 498383706 RHGQDANAWZQLQG-UHFFFAOYSA-N 399.422 5.175 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1c(Cl)cccc1Cl 499811091 KAFCCUWNBZSGGC-OAHLLOKOSA-N 389.213 5.387 30 20 GKED O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)[C@@H]1CCC[C@H](C(F)(F)F)C1 505445605 KHMMMJKGUOEZOQ-VYUIOLGVSA-N 389.286 5.053 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 509667189 SRAMEDJVKSNHQS-SECBINFHSA-N 385.703 5.638 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 510584303 LRQSWTMEMFHITF-JOCHJYFZSA-N 389.543 6.154 30 20 GKED CC(C)Oc1ccc(-c2csc(NC(=O)c3cc(C#N)ccc3Cl)n2)cc1 511735602 SWRHTFXSJRGVAS-UHFFFAOYSA-N 397.887 5.375 30 20 GKED CC1(C#N)CCC2(CC1)Nc1ccccc1C(=O)N2c1ccc(F)cc1Cl 514846190 WLYCUSSNEOHTPT-UHFFFAOYSA-N 383.854 5.352 30 20 GKED COCc1ccc([C@H]2CCCN2c2c(Br)cc(Cl)cc2C#N)o1 519776802 MNKLEPVECOJQMU-OAHLLOKOSA-N 395.684 5.055 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 522768831 NQZRMCQAUGXVGB-CQSZACIVSA-N 388.298 5.324 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc4ccsc4c3)n2)cc1 525796189 ANKBHJKBPOHVFT-OAHLLOKOSA-N 375.478 5.218 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc([C@@H]2CCCOC2)c1 535037289 SIIKEQOYLPJTJH-QFBILLFUSA-N 380.513 5.227 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1coc(-c2ccccc2Cl)n1 539541619 JFMSCWKBAFKFDY-ZDUSSCGKSA-N 397.887 5.642 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)N[C@H](CCC#N)c2ccccc2)cc1 546123001 HRXXHHBREKYPIV-OAQYLSRUSA-N 376.500 5.145 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)ccn1 551507715 VXHKYZMAJKBMSI-AWEZNQCLSA-N 388.279 5.310 30 20 GKED Cc1ccccc1C1CC(N(C(=O)c2cc(-c3cccc(C#N)c3)no2)C2CC2)C1 555299040 KYXGRPFYXZMQCK-UHFFFAOYSA-N 397.478 5.073 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1oc2c(ccc3ccccc32)c1C 557587332 BSTAVDVWJZOQHG-UHFFFAOYSA-N 389.451 5.198 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1 571636433 IPALKCURAAZAOJ-FXAWDEMLSA-N 392.524 5.086 30 20 GKED COc1ccc([C@@H](CCC#N)NC[C@@H](c2ccccc2Cl)N2CCCC2)cc1 575207153 NPDLNBADVUMNLT-PKTZIBPZSA-N 397.950 5.120 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)s2)cc1 579889279 OXMMDOSMTOSYGK-PMACEKPBSA-N 386.480 5.029 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc2sccc2c1 581338438 BLKMDXKUONMBER-AWEZNQCLSA-N 381.526 5.617 30 20 GKED Cc1sc(NC(=O)CCCCCC#N)nc1-c1ccc(Br)cc1 588819145 TYGHMMRMQLQSHU-UHFFFAOYSA-N 392.322 5.294 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C)C(F)(F)[C@H](C)C1 599729397 XNUSUISWFFQOQT-HZPDHXFCSA-N 399.441 5.414 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)Cc3csc4ccccc34)n2)cc1 603749834 ARCGLEOKQGWJLW-UHFFFAOYSA-N 375.478 5.078 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603831251 YNMAYALVXCOJCM-JOCHJYFZSA-N 398.466 5.423 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c2ccccc2n1 603991640 FLEASXYXVMOTLA-UHFFFAOYSA-N 395.487 5.494 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3csc(-c4ccoc4)n3)cc2)c1 609426801 DKSDUJZPGFSBCA-UHFFFAOYSA-N 387.420 5.319 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1cccc(Cl)c1 610019625 YKZMKQWKTYRNOC-CQSZACIVSA-N 387.936 5.791 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)[C@H]1CCCN1c1ccc(C#N)cc1 610234282 JRQXESBYYCYBSV-JOCHJYFZSA-N 393.556 5.116 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)c(C(F)(F)F)c1 611095053 PDUWLMQKKFWOJJ-QWHCGFSZSA-N 399.482 5.752 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2ccc(-c3cccc(OC(F)(F)F)c3)s2)C1 612233173 NDJDSBGNPUBQDE-GOSISDBHSA-N 394.418 5.080 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cc(F)ccc4s3)n2)cc1 613315639 VTPZHDROJDHRHP-INIZCTEOSA-N 392.480 5.962 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C#N)c(Cl)c3)s2)cc1 619754507 BQMWKYUKWOEHTK-AWEZNQCLSA-N 381.932 5.803 30 20 GKED CC(C)(C)SCC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 728000168 YZDBLELDFGMHNO-UHFFFAOYSA-N 388.920 5.261 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)cc1 728037493 IZAHCYOFRQGSDX-SFHVURJKSA-N 388.467 5.368 30 20 GKED CC(=NNc1ccc(Br)cn1)c1csc(-c2csc(C)n2)c1 729145457 QCKJJMHDVQKKCW-UHFFFAOYSA-N 393.335 5.174 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3ccc(F)cc3F)cc2)oc1C(=O)O 729937476 SWVRSSPNJXDWHH-WTKPLQERSA-N 398.361 5.040 30 20 GKED Brc1ccccc1-c1nc2c(s1)C(=NNc1ccccn1)CCC2 730431984 ZNLJGPQEEUKUSL-UHFFFAOYSA-N 399.317 5.120 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3SCCC#N)c2cc1C(C)C 731028619 NLJXPZBKYRTYIC-UHFFFAOYSA-N 392.524 5.843 30 20 GKED CCS(=O)(=O)Nc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc1 731565747 ZZDCJQOVBWEPNH-SEYXRHQNSA-N 397.521 5.073 30 20 GKED Cc1nc(CCC(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)cs1 733089498 IWBVWSGPNDIBGL-CYBMUJFWSA-N 387.574 5.107 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2csc(-c3ccc(C)cc3)n2)c1 733800880 LQEVEJVEMDHIDC-HXUWFJFHSA-N 377.513 5.089 30 20 GKED N#Cc1ccc(-c2cccc(CNc3ccc([N+](=O)[O-])c4cnccc34)c2)s1 739890499 PHMJXVODJLMMIH-UHFFFAOYSA-N 386.436 5.355 30 20 GKED CCOCc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)ccc1OC 740010728 GFDUKOMHHCQASY-UHFFFAOYSA-N 392.524 5.122 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(N=Cc2cc3ccccc3nc2O)cc1 743044991 VVCJEJCBAOSRGT-HNNXBMFYSA-N 391.471 5.277 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1ccc([N+](=O)[O-])cc1 743445077 COGCKLHQJCWHBO-UHFFFAOYSA-N 380.351 5.059 30 20 GKED CON=Cc1ccc(C(=O)Nc2cccc(CO[C@H]3CCC[C@H](C)C3)c2)cc1 745136063 RECBTGMAPGSMGE-JTSKRJEESA-N 380.488 5.015 30 20 GKED Cc1ccc(-c2cc(C(=O)N(C)c3snc(C)c3C#N)c3ccccc3n2)cc1 748233680 HZERECPOTTUJAK-UHFFFAOYSA-N 398.491 5.123 30 20 GKED C[C@H](OC(=O)COc1ccc(C2SCCCS2)cc1)c1ccc(C#N)cc1 748680442 QFFILMNUJIGDGB-HNNXBMFYSA-N 399.537 5.110 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1sc2cccc(F)c2c1C 749360871 JJMXNRUXRQFSFR-UHFFFAOYSA-N 389.455 5.098 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2cccnc2Cl)cc1 750634869 XSVKPGKVYFTHJO-UHFFFAOYSA-N 394.883 5.256 30 20 GKED C[C@H](NC(=O)c1ccccc1SCC#N)c1ccc(Oc2ccccc2)cc1 750810324 CUPFBDMISKMOBW-KRWDZBQOSA-N 388.492 5.586 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(-c4ccccc4Cl)s3)cc12 750906118 PWWOBSCFDCLWBA-FPLPWBNLSA-N 393.899 5.555 30 20 GKED C[C@@H](Cc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 756518059 SRNHITHJPKQJKR-KBXCAEBGSA-N 380.900 5.519 30 20 GKED C#CC[C@H](NC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1)c1ccccc1 757618505 UOYXVIJBPUQHJE-QFIPXVFZSA-N 397.478 5.133 30 20 GKED C#CCCCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 757915498 KHPBZUWOHBAOKC-LPHOPBHVSA-N 390.914 5.660 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 768396086 ZAQMMUCMHIBMFM-NRFANRHFSA-N 391.467 5.018 30 20 GKED C[C@@H](N[C@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1ccc(OCC#N)cc1 772958926 ISHLZQIZQMWZGE-QZTJIDSGSA-N 390.458 5.932 30 20 GKED CCS(=O)(=O)c1c(Cl)cccc1/C=C\C(=O)c1oc2ccccc2c1C 774115074 MZEIAPRKMZWDJA-QXMHVHEDSA-N 388.872 5.084 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 774269848 LBZXTFIKNQNPKH-SFHVURJKSA-N 387.439 5.072 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(C)c(N3CCOC3=O)c2)cc1 777580951 JKXMVSRZVITURE-INIZCTEOSA-N 386.879 5.256 30 20 GKED C#CCCCCCC(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 779933984 OSJSXHPPADDYFK-DEOSSOPVSA-N 390.552 5.818 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1F)C1CCCCC1 780672265 ACRIMAPJIZGVSQ-QGZVFWFLSA-N 395.478 5.483 30 20 GKED C=CC[C@H](C(=O)O[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784832178 JVUSXJAWTUUGOG-KSSFIOAISA-N 382.847 5.354 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(CC)cc2)n1 785762094 PWEYFNLDHTWCKS-NRFANRHFSA-N 386.517 5.036 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21 796790654 UFQCCECDUNFXAA-XRXFAXGQSA-N 380.532 5.065 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c(C)n1Cc1ccccc1 797571109 NWHMZRKMVGAAAB-IBGZPJMESA-N 391.540 5.397 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1\S/C(=N/C2CCCC2)NC1=O 799890388 KLAHYLYDYJKKMX-LXLJVHJPSA-N 380.435 5.154 30 20 GKED COCCn1nc(C)c(C(=O)/C=C/C(C)=C\c2ccccc2C(F)(F)F)c1C 799891196 ASSDUMPPOSWGDO-OMRPVRGDSA-N 392.421 5.008 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)s1 802250310 QNXLCEUWCGTYII-JSGCOSHPSA-N 384.398 5.346 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/C(=O)c3ccccc3[C@@H]2C)cs1 809159629 STZTUEURYHKSNJ-HSWQHBDASA-N 392.455 5.350 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(N2CCCCC2)cc1 819842198 KIEXQBDXDYHMIF-SSZFMOIBSA-N 398.506 5.547 30 20 GKED CC(C)(C)C(=O)CCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 835068195 OFAOZHMVKKHMQB-HNNXBMFYSA-N 388.920 5.425 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)c(F)c1)c1ccc(-c2ccc(F)cc2)s1 844255770 FHDAUNSGKZPMQQ-WAPJZHGLSA-N 393.418 5.170 30 20 GKED N#C[C@H](C(=O)CCCSc1ccc(Cl)cc1)c1nc2ccccc2s1 916627278 KCKZWFBCDJTVOL-OAHLLOKOSA-N 386.929 5.698 30 20 GKED CCOc1c(Br)cc(/C=C/C(=O)c2ccc(C)s2)cc1OC 917043376 HXLUWLWDDZZRAE-VOTSOKGWSA-N 381.291 5.122 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](Cc2nc(C)cs2)C1 931063279 WUAQQYLQHXJRPK-KRWDZBQOSA-N 383.561 5.400 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc(CCC(F)(F)F)s1 932305677 FPVHSMXASJPHNV-NSHDSACASA-N 399.463 5.142 30 20 GKED CC1(C)C(=NNc2cccc(C(=O)O)c2)C[C@H]1c1ccc(Br)cc1 1776038265 AKONUVQGQLWMNE-INIZCTEOSA-N 387.277 5.129 30 20 GKED CC(C)(C)c1cc(C=NNc2ccc(CC(=O)O)cc2)c(O)c(C(C)(C)C)c1 1776083476 JBLIGTQFJOAWRP-UHFFFAOYSA-N 382.504 5.060 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C/C(=O)c3cc(F)ccc3F)c2)c1 1776113648 QQXOYKRCDBBDKY-JXMROGBWSA-N 394.373 5.138 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(OCC(=O)O)cc2)cc1 1776125540 LHJHDQSMUAJSDW-SXGWCWSVSA-N 396.483 5.395 30 20 GKED C=CCCC[C@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 1776171439 ZZEUQXQMHGRVND-FQEVSTJZSA-N 391.870 5.479 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776339958 VSLGOMGNAMMOFW-QBFSEMIESA-N 390.504 6.208 30 20 GKED CC1(C)/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776515131 CWVABKAMLYKDOZ-HAHDFKILSA-N 382.459 5.538 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc(F)cc2C)o1 1776783059 WLKLWAJWFPILCK-SFHVURJKSA-N 375.484 5.688 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2O)cc1 1776785629 XRFXPBMCOTXEKP-GXDHUFHOSA-N 396.483 5.726 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C[C@@H](C)c2ccccc2)C(=O)O)c1 1776787930 GMFYLCYMZBUJMN-YKSBVNFPSA-N 397.559 5.772 30 20 GKED O=C1/C(=C/c2ccccc2Oc2cccc(F)c2)C[C@@H](C(=O)O)c2ccccc21 1777698066 BNQDTPLFOGMEDK-CZIOWHBQSA-N 388.394 5.456 30 20 GKED N#Cc1ccc(OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)cc1 11327151 CPZNSPCJTXPPRB-UHFFFAOYSA-N 387.222 5.058 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2cnn(C(C)C)c2)cc1OCC 60212578 SYDDKLCRXNMKBI-BQYQJAHWSA-N 376.884 5.201 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccc(C)cc2)nc1 63391796 LXOPGNZYFSLYAZ-UHFFFAOYSA-N 398.466 5.274 30 20 GKED C=CCOc1cccc(NC(=O)c2cccnc2SCc2ccc(F)cc2)c1 65878454 FYCJGNZANMJSHU-UHFFFAOYSA-N 394.471 5.330 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)o2)c(C)c1 66516498 GZAVQCGYUPNFMI-QGZVFWFLSA-N 386.407 5.107 30 20 GKED Cc1csc(Sc2ccc(NC(=O)C3(C#N)CCCC3)cc2Cl)n1 72086926 XSUROAVACDIMJP-UHFFFAOYSA-N 377.922 5.279 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)ccc1SC(F)F 103250750 FAGWQLSIRBHCOJ-OMDQHUAHSA-N 389.423 5.197 30 20 GKED CCc1ccc(C(=O)CCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108324926 PKQSZQBMKVXXTB-MRXNPFEDSA-N 380.513 5.102 30 20 GKED N#CCCn1ccc(NC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)n1 117712882 CDCRQUMKZFXQDG-UHFFFAOYSA-N 391.283 5.084 30 20 GKED Cc1nc(C(C)(C)NCc2cccc(OCc3cccc(C#N)c3)c2)sc1C 124739188 UKWIOWKYGBGWAS-UHFFFAOYSA-N 391.540 5.236 30 20 GKED CCCc1sc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1CC 128857451 RBJSYLQKZVSYBM-OAHLLOKOSA-N 381.526 5.272 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2Cl)o1 152806139 VOTHXRLHPQODCG-OLZOCXBDSA-N 386.282 5.932 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N3CCC(C#N)CC3)cc2)c1 154535072 FZVMLSLLMADQMR-UHFFFAOYSA-N 391.515 5.465 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(-c2ccco2)s1 171455212 HVMILFUOBOUATD-UHFFFAOYSA-N 377.450 5.256 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H](C)Sc1ccccc1 173122341 JUMYOBIQFGBJHT-JKSUJKDBSA-N 385.558 5.383 30 20 GKED C=CCCCC(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 175647356 VCKAJMFMQHSWKH-UHFFFAOYSA-N 394.368 5.392 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1 180067960 CNGZFSOQAHLZFJ-OAHLLOKOSA-N 399.441 5.232 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1scc(C)c1Br 191488661 WPKZDUHBFGBKHN-UHFFFAOYSA-N 378.335 5.923 30 20 GKED C[C@H]1C[C@H]1c1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)o1 193050370 ZBVRCGWWCVAOEH-MGPUTAFESA-N 377.488 5.401 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 206978922 QILQPZQQXCYQRD-GHXNOFRVSA-N 386.838 5.360 30 20 GKED Cc1cncc(/C=C\C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 255334525 AUGXEFMHVXXLIV-UTCJRWHESA-N 391.418 5.067 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 261452828 PNLVVNSBEKVENT-SECBINFHSA-N 377.275 5.166 30 20 GKED CO[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@@H](C)C1 282662973 JWMNHTQIMKFLEQ-QKYXUNIQSA-N 397.906 5.027 30 20 GKED N#CCc1ccc(NC(=O)CCCSc2ccc(Br)cc2)cc1 303245197 AOTRZHVIADBOHA-UHFFFAOYSA-N 389.318 5.026 30 20 GKED CC(O)=Nc1ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cc1Cl 329938372 AGFJWPVREUWVCI-UHFFFAOYSA-N 377.872 5.461 30 20 GKED CC(C)n1c([C@H](C)/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)nc2ccccc21 330020359 WKNSZVYTHBPMNN-ZLPCBKJTSA-N 396.535 5.560 30 20 GKED C[C@@H]1CCCC[C@H]1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 409796084 RQVWAFLECXJALJ-QUCCMNQESA-N 391.515 5.279 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccccc1SCc1csc(C)n1 410372438 VXOGEQIXSZEMES-UHFFFAOYSA-N 394.565 6.115 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N(CCC#N)CCC(C)C)ccc2C)c1 428868446 QIEGEQXBLPESMJ-UHFFFAOYSA-N 380.492 5.284 30 20 GKED CC1(C)CN(C(=O)Nc2ccccc2C#Cc2ccccc2)[C@@H]1c1ccncc1 433003766 AXZVEIDFOZFBDP-HSZRJFAPSA-N 381.479 5.096 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)[C@@H](C#N)CCc1ccccc1 433354223 MTLRFIMXDSJSKV-JOCHJYFZSA-N 384.479 5.285 30 20 GKED C[C@H](Nc1ccc(NC(=O)[C@H](C#N)CCc2ccccc2)cc1)c1ccccc1 433357400 XIXDZMWZXOVNKA-UGKGYDQZSA-N 383.495 5.571 30 20 GKED CC(C)Oc1cc(O)ccc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 433521091 RVZOUIWGUYPEFN-CQSZACIVSA-N 385.489 5.218 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 436345279 YLMIHADMPSWCOH-RPVQJOFSSA-N 385.920 5.412 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1Cc2ccccc2C[C@@H]1C 437823240 QXKJHXWAUNDACU-SFHVURJKSA-N 397.478 5.638 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 438484595 RLBDOURDEFRBBJ-ICSRJNTNSA-N 377.488 5.168 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438845881 FTYSMECMRBARFE-DNVCBOLYSA-N 389.421 5.453 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)NCC3CCC(C#N)CC3)oc2c1 441147373 XQHGAOZOIANPBW-UHFFFAOYSA-N 388.467 5.168 30 20 GKED Cc1c(Br)ccc(C(=O)Nc2ccccc2SCCC#N)c1F 447472171 OFNTZROMESGFEW-UHFFFAOYSA-N 393.281 5.155 30 20 GKED C[C@@H]1CC[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2sccc21 453208096 BARGIMNLGVKPGS-DNVCBOLYSA-N 379.529 5.382 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1cccc(-c2cccnc2)c1 463661333 AUVJULIOVALPFY-UHFFFAOYSA-N 389.458 5.217 30 20 GKED N#CCCCOc1cccc(NC(=O)CCCc2cccc(C(F)(F)F)c2)c1 471745858 RAKXXWNZXDESFR-UHFFFAOYSA-N 390.405 5.349 30 20 GKED N#Cc1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1 474262049 AFVOSMJOJQPTAP-OAHLLOKOSA-N 386.295 5.001 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1cc2cccc(F)c2o1 474717966 VVUNCKVDKVOTBP-KBPBESRZSA-N 397.475 5.849 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1csc(-c2ccccc2)n1 475548985 RLLOLGDRSOISOI-UHFFFAOYSA-N 391.540 5.984 30 20 GKED C=CCOc1cccc(NC(=O)N(CC(C)C)[C@@H]2CCCc3cccnc32)c1 480809330 CHFFBASCXHKVQY-OAQYLSRUSA-N 379.504 5.214 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@H](C#N)c1nccc2ccccc12 483223393 BMOLSPUQFDKIIF-JOCHJYFZSA-N 377.447 5.493 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2nc3ccccc3s2)o1)c1nccc2ccccc12 483233112 KPVYVJSRZYADRZ-INIZCTEOSA-N 395.443 5.595 30 20 GKED N#Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)s1 484435049 QTNHLHIPJWJCGQ-GOSISDBHSA-N 383.835 5.183 30 20 GKED Cc1ccnc2sc(C(=O)N(CCC#N)C34CC5CC(CC(C5)C3)C4)c(C)c12 486557342 IOBZHLXGYWMCNQ-UHFFFAOYSA-N 393.556 5.238 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(C(F)(F)F)cc1Br 488896956 HEUAVZXQTAVPBR-NSHDSACASA-N 377.204 5.040 30 20 GKED CCN(C(=O)Cc1ccc(C#N)cc1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496557905 ZCSWNMFKDDVADP-AREMUKBSSA-N 397.522 5.257 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(N(C)C)cc1F 501605694 LJNOMSUTKYPVQZ-UHFFFAOYSA-N 389.430 5.116 30 20 GKED C=CCC(CC=C)C(=O)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1 501790853 RVGKFDMQDMZKSP-LJQANCHMSA-N 383.467 5.088 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 511364472 PBDONCXIPACRGV-LJQANCHMSA-N 399.494 5.523 30 20 GKED CN(C(=O)NCC(C)(C)C#N)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 512802878 PKDPINWCOUVGGR-UHFFFAOYSA-N 390.314 5.274 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1nc(-c2ccccc2)cs1 513454302 GMTNXLWWRXTUDA-CQSZACIVSA-N 379.510 5.314 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)CCO1 513690400 XXGFLYCOYSGJHJ-BEFAXECRSA-N 394.540 5.165 30 20 GKED CN(CCC#N)C(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 517338427 FKDOGDUDQJCRHO-KRWDZBQOSA-N 379.312 5.199 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC[C@@H]2c2ccsc2)cc1 518548830 OTZCZPDPTGXGMY-HXUWFJFHSA-N 392.455 5.528 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccc(Cl)cc3F)c2)cc1 523728471 ZCBWQFIENOJMAI-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(C(F)F)c2F)cc1 528920960 WAAIUASRYCFUMP-YVEFUNNKSA-N 388.389 5.238 30 20 GKED N#Cc1ccc(NC(=O)CCc2nc3cc(Cl)ccc3s2)c(Cl)c1 532699278 XSFQMIIYPHZXRX-UHFFFAOYSA-N 376.268 5.046 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H](c2cccc(F)c2)c2ccccn2)CC1 536830383 DIJLBPASFJRKLH-KWKWTDQQSA-N 385.486 5.304 30 20 GKED C/C(=C/c1cccc(OCc2ccccc2C#N)c1)c1nc(O)c2ccsc2n1 537652052 LQTBTDPBGQGYNI-PTNGSMBKSA-N 399.475 5.408 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2sc(C(C)(C)c3ccccc3)nc2C)n1 537667144 YAXAFPMJXOSYES-HNNXBMFYSA-N 381.526 5.032 30 20 GKED C=CCC[C@@H](CC)Nc1ccc(NC(=O)[C@H](C)n2nc(C)cc2C)c(Cl)c1 538634550 IONDCMKAUJLDTR-DLBZAZTESA-N 388.943 5.510 30 20 GKED COc1cc(C#N)ccc1CN[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1 539302195 FNAOKVWRIJHOTB-QGZVFWFLSA-N 390.458 5.136 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)c1ccc(Cl)c(C#N)c1 539368546 CKNKTCKRHBKOEF-UHFFFAOYSA-N 396.899 5.124 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl 540470748 GPSMELWQDGCAAN-AEFFLSMTSA-N 392.808 5.271 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 540614310 HXSMRVHWLKSYFH-UHFFFAOYSA-N 381.501 5.060 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1ccc(Sc2ccc(Cl)cc2)o1 541573849 YQVNTGZVEXJNGF-UHFFFAOYSA-N 397.887 5.035 30 20 GKED CC(C)Oc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1Cl 542360386 NSKRJTQUWDYXML-UHFFFAOYSA-N 383.879 5.195 30 20 GKED C[C@H](NC(=O)N[C@@H](c1cccnc1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543004365 PPVMZRBSJYDHBM-BXKMTCNYSA-N 396.494 5.132 30 20 GKED N#Cc1cc(C(=O)Nc2cc(Cl)ccc2-c2nc(C3CC3)no2)ccc1Cl 543486438 OIGNFCSQZXMXCP-UHFFFAOYSA-N 399.237 5.045 30 20 GKED CC[C@@H](CC(F)(F)F)N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F 544832010 HNWHKJYUQMJPQL-BDAKNGLRSA-N 377.300 5.271 30 20 GKED C[C@H](NC(=O)[C@@H]1CCC(=O)[C@H](C)C1(C)C)c1ccc(-c2cccc(C#N)c2)cc1 548374513 JMCKOLDYAGOKIZ-HOIFWPIMSA-N 388.511 5.044 30 20 GKED N#C[C@@H](C(=O)c1coc(C2CCCC2)n1)c1nc(-c2c(F)cccc2F)cs1 549079875 JTAFHCZNPFKQRX-LBPRGKRZSA-N 399.422 5.224 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OCc2nccn2C)cc1 551211184 NMRJTGMIXUIBSC-WMZHIEFXSA-N 388.515 5.085 30 20 GKED N#C[C@H](C(=O)c1cccc2cccc(Br)c12)c1nc2ccccc2o1 552071179 TURHMKFUEHULJQ-CQSZACIVSA-N 391.224 5.234 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 555538418 ZALMFMUMAKHEJM-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1)c1ccccc1 557488059 FQFFJVYHDJYTMJ-PDIWNELESA-N 376.500 5.136 30 20 GKED N#Cc1ccc(NC(=O)N2CCC([C@H](F)c3ccccc3F)CC2)cc1Cl 558226850 BUGKSSOUYMDRMX-IBGZPJMESA-N 389.833 5.305 30 20 GKED CC(C)(C#N)CCCCN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 560179804 VXUAKUWFNHFCDV-IBGZPJMESA-N 382.470 5.483 30 20 GKED Cc1cc2cc(CNC(=O)Nc3ccccc3SC[C@H](C)C#N)ccc2[nH]1 562166746 WOHIVPQMKVSIEY-CQSZACIVSA-N 378.501 5.050 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1nc2c(cc1C#N)CCCC2 585688508 QHWHJAKQJIPLBL-HZPDHXFCSA-N 393.556 5.465 30 20 GKED COc1cccc(C(=O)/C(=C\c2csc(-c3cccs3)n2)c2ncc[nH]2)c1 588514600 OFLIDBUFAVAMTN-LFIBNONCSA-N 393.493 5.027 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1CCC2(CC1)CC2(F)F 596734076 NSLGJRNWENHFLP-WRSVWVKZSA-N 379.476 5.028 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC1(C#N)CCCCC1 598302742 NUUWQNDBKAAVOM-UHFFFAOYSA-N 392.286 5.161 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1cccc(C#N)c1 609062274 KEJMNCQBZQCEEU-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#CC1(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)CCCC1 609066712 UKIBXDCKOOIFFZ-UHFFFAOYSA-N 388.389 5.307 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)[C@@H](C)C(C)C 609079092 ZVAHDUWIFVVRKZ-SFHVURJKSA-N 379.504 5.344 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H]2CCc3ccc(F)cc32)cc1 609296832 YONPSIRBLUJODH-NRFANRHFSA-N 387.414 5.299 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@]4(CC=CCC4)C3)cn2)cc1 609626647 PJSPYIIOEDWIDS-QHCPKHFHSA-N 388.471 5.100 30 20 GKED CCn1c(S[C@@H](C)c2ccc(C#N)cc2)nc2cc3ccccc3cc2c1=O 609813848 YTDDDFHVVVUXDH-HNNXBMFYSA-N 385.492 5.295 30 20 GKED N#Cc1cccc(CNC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)c1 610023679 PMXNUCQGZZGSLH-IBGZPJMESA-N 387.405 5.014 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610322735 MRRKMSOCGGLRJB-KRWDZBQOSA-N 396.450 5.413 30 20 GKED N#Cc1cc(CSc2nc(-c3cccs3)c(-c3cccs3)[nH]2)ccn1 610955592 AWGUOWKCUUKESN-UHFFFAOYSA-N 380.523 5.426 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)C1 612371113 YVDLIEXJDJRDLE-KKFJTVDOSA-N 397.478 5.080 30 20 GKED C=CCn1c(SCC(=O)c2ccc(CC(C)C)cc2)nnc1-c1ccoc1C 613908786 ZYWZPNNFBQEUAY-UHFFFAOYSA-N 395.528 5.206 30 20 GKED Cc1ccc(-n2c(SCc3ccc(C#N)cc3C)nnc2-c2ccncc2)cc1 614402051 IYUQSOUKJCSPSA-UHFFFAOYSA-N 397.507 5.110 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)C1 616111763 PZVUWSQQLVJCGO-IBGZPJMESA-N 389.286 5.213 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2coc(C3CCC3)n2)cc1Cl 618081820 SLNSNFSAXZDLLE-GOSISDBHSA-N 391.858 5.503 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(C(F)(F)F)ccc2s1)c1nc(C2CC2)cs1 659116218 RIJVBVGTJGUPQY-LBPRGKRZSA-N 392.427 5.744 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)Cc1ccc(OC)cc1 682776978 CBPYLVVFMUDPST-UHFFFAOYSA-N 380.532 5.991 30 20 GKED N#CCCCOc1cccc(/C=C2/CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)c1 726743658 NSIXHXNEPRCJPU-JXTQQTEDSA-N 388.423 5.107 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1nc(-c2ccccc2)cs1 730922014 IYCUPYOSMODIQR-YPAWHYETSA-N 394.499 5.943 30 20 GKED CN(CCc1ccccc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731753001 STRGPVQFTVEIBB-QFIPXVFZSA-N 387.458 5.188 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1)c1ccncc1 734684372 VFXZSKHXEJRDLT-YKSBVNFPSA-N 385.511 5.672 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735570851 STAKXFGDHYGHSH-UHFFFAOYSA-N 375.925 5.222 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(CCCc2ccccc2)o1 742460477 MPILZRQZHYHJJK-UHFFFAOYSA-N 399.903 5.093 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCCCc1ccc(C)cc1 746417249 UNGVYXWIIXGZQD-QFIPXVFZSA-N 390.527 5.180 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1coc2ccccc12 746557102 PFBBRGNWOOASGI-UHFFFAOYSA-N 385.448 5.062 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1/C=C\C(=O)c1cnn(C(C)C)c1 746686807 MNUWIVVXDVXNOK-KHPPLWFESA-N 382.895 5.323 30 20 GKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1ccc(N2CCOC2=O)cc1 748585102 ZNVBZUDIPADWHR-KHPPLWFESA-N 375.449 5.268 30 20 GKED Cn1ncc2c1CC/C(=C\c1nc(-c3cc(Cl)ccc3Cl)cs1)C2=O 753900292 MQTGGLIVSLPTDK-UXBLZVDNSA-N 390.295 5.063 30 20 GKED C=CC[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)c1ccncc1 754061140 RPVICAKMONLJQU-QGZVFWFLSA-N 390.339 5.919 30 20 GKED C[C@@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccc(C#N)cc1 761762090 IPMQNWBZBGZPBZ-GFCCVEGCSA-N 384.407 5.537 30 20 GKED CC[C@H](C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccc(F)cc1 764791427 PFSKFHCKCSIKJH-JTQLQIEISA-N 396.249 5.034 30 20 GKED C#CCOc1ccccc1NC(=O)Nc1ccccc1COCc1ccccc1 775511578 DBHYZIIJULHMPG-UHFFFAOYSA-N 386.451 5.059 30 20 GKED N#C[C@H](C(=O)C1c2ccccc2Oc2ccccc21)c1ccc2ccccc2n1 781755260 RLAFTVAYXLSGHY-IBGZPJMESA-N 376.415 5.349 30 20 GKED Cc1cc2cc(C(=O)/C=C\c3cn(CCC#N)nc3-c3ccncc3)oc2cc1C 788355710 PHGNRGTZFDXHQT-PLNGDYQASA-N 396.450 5.118 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567718 ASCQJSFEACFVKO-WMLDXEAASA-N 378.497 5.238 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ccccc2OC(F)(F)F)s1 797568494 SCTLUDWIMYIEDS-ZDUSSCGKSA-N 396.434 5.148 30 20 GKED C[C@H](NCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1)c1ccc(OCC#N)cc1 800494290 VTVHWYORQCVZON-MSOLQXFVSA-N 397.950 5.329 30 20 GKED CCN(C(=O)c1cc(F)c(C(F)(F)F)cc1F)[C@@H](C)c1ccc(C#N)cc1 804289617 DXSXXSZFURKGHB-NSHDSACASA-N 382.332 5.079 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2SCCS2)cc1)c1cc(C(F)(F)F)ccn1 813218730 YVJWAYOEKPYROT-CQSZACIVSA-N 394.443 5.069 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCCC12CCC2 831921543 OXIKQWZWURHEOC-UHFFFAOYSA-N 398.322 5.526 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3cccc(CN4CCCCC4)c3)no2)cc1 904434133 OITFOZJPDWDOKV-UHFFFAOYSA-N 386.499 5.191 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C\c1cccs1 914521130 WCLDQRXBPZZGPE-LUAWRHEFSA-N 376.456 5.314 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCc2c[nH]c3ccccc23)cc1 915088085 ZWRNDKBXUJRZJV-XMMPIXPASA-N 393.490 5.785 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)coc2c1 915179473 FVCSIYXZBZNEAA-QHCPKHFHSA-N 380.447 5.578 30 20 GKED N#C[C@@H](C(=O)CCSc1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 917043611 KSMSWYLTRRUJIX-AWEZNQCLSA-N 390.892 5.447 30 20 GKED N#CCc1ccc(NC(=O)c2cc3ccc(OCc4ccccc4)cc3[nH]2)cc1 919882780 CBFNLAPYBBVYGI-UHFFFAOYSA-N 381.435 5.065 30 20 GKED C[C@@H](Sc1cccnc1C#N)c1nc(O)c2c(-c3ccccc3)csc2n1 1651983869 JENPQPOHKCGOMT-GFCCVEGCSA-N 390.493 5.184 30 20 GKED Cc1ccccc1COc1c(C)cc(C=NNc2cccc(C(=O)O)c2)cc1C 1776036918 TWIRWADYWAATDA-UHFFFAOYSA-N 388.467 5.335 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1c(Cl)cccc1Oc1ccccc1 1776050163 KFUMTBDOYYRULM-UHFFFAOYSA-N 396.830 5.285 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2ccccc21 1776308689 KNALKDSRUHQQCO-VLOXRPPESA-N 388.488 6.133 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776697650 LULIPAPXHHZLGX-WLIXUPRESA-N 384.475 6.461 30 20 GKED CCCCC(=O)Nc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776765922 BENBAIWUQNIXFF-JXAWBTAJSA-N 391.467 5.116 30 20 GKED CCCCCCCOc1cccc(/C=C/c2cc(C(=O)O)c3cnn(C)c3n2)c1 1776789239 XREUJFGNFCTXOG-VAWYXSNFSA-N 393.487 5.186 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cc(C(=O)O)c(Cl)s1 1777488174 PGKBQWIDBMLPIV-BQYQJAHWSA-N 389.885 5.428 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)/C=C/C4CCCCC4)cc3)CCC2)C1 1790516759 JKACVLGMDVCDCC-MDWZMJQESA-N 392.543 5.223 30 20 GKED CCN(C(=O)c1ccc(C2SCCCS2)cc1)[C@H](C)c1ccc(C#N)cc1 45500017 RVHRQXWWALUSOU-MRXNPFEDSA-N 396.581 5.650 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)NC(C)(C)C)cc1 55014032 HPBQZWBGFLYHPQ-UHFFFAOYSA-O 397.608 5.513 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2csc(COc3ccc(Cl)cc3)n2)cn1 58465269 NTXXTJATIDENNG-VMPITWQZSA-N 387.892 5.049 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)CSc2nc3cc(Cl)ccc3o2)c1 60382836 IDGTWQLJFNCKAL-UHFFFAOYSA-N 399.903 5.137 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1c(C)cc(Br)cc1C 62394015 KCJFRQWUBVGVGG-UHFFFAOYSA-N 387.321 5.329 30 20 GKED N#Cc1ccc(NC(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1 65029157 KTVMSTRMGVZQSI-UHFFFAOYSA-N 390.830 5.108 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3ccc(Cl)c(C#N)c3)c12 97366237 SAGLSOGFAXUEEW-UHFFFAOYSA-N 380.835 5.001 30 20 GKED CCCCc1ccc([C@@H](NC(=O)N2CCC(C#N)CC2)c2cccs2)cc1 105092422 XUGQMLZMIHHBGB-OAQYLSRUSA-N 381.545 5.125 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1nc(-c2ccccc2)cs1 107321848 IPOVIHDFLAIJEA-QGZVFWFLSA-N 376.529 5.011 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)CCCCc1ccccc1 108530140 RMBXCDAGMYLJOJ-SFHVURJKSA-N 381.545 5.425 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(Cl)c1 108531404 LAQASMNPBXAOSA-BEFAXECRSA-N 399.947 5.961 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3nc(C(F)(F)F)cs3)o2)cc1 120256356 JRVZGHSSPMLCFA-UHFFFAOYSA-N 399.419 5.069 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cccc(F)c4o3)n2)cc1 123562615 BIQCKTIUWCBVAM-HNNXBMFYSA-N 387.395 5.057 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc(Cl)c2F)cc1 133768628 ARHREDXHLWTGHU-UHFFFAOYSA-N 394.833 5.376 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)Cc1ccccc1F 151978188 UHMXAUHKQFWBFF-MRXNPFEDSA-N 389.430 5.010 30 20 GKED C[C@H]1CCN(C(=O)CCc2ccc(C#N)cc2)[C@H]1c1ccc(C(F)(F)F)cc1 155044564 LIMOKOQDWQVCTP-YCRPNKLZSA-N 386.417 5.119 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H](C)C1(C)CC1 175982644 RFLGQWMLLHSWHW-QGZVFWFLSA-N 377.488 5.098 30 20 GKED CC(C)(C)Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 176022356 WFWOZINEYVFCLV-HNNXBMFYSA-N 383.398 5.099 30 20 GKED C[C@@H](NCc1ccccc1CN(C)C1CCCCC1)c1ccc(OCC#N)cc1 181548239 YCMQSFGGUMIUGQ-HXUWFJFHSA-N 391.559 5.204 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)cc2)CC1 182262976 RUVWEKVXZLFYJM-UHFFFAOYSA-N 378.435 5.037 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 186388660 SKHQJEQTFPUHEL-LJQANCHMSA-N 376.481 5.299 30 20 GKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 189994720 MPDHRXDHXUUXAG-IAGOWNOFSA-N 387.458 5.361 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@@H](c2ccccc2)O1 246239656 IWPOPUFMXTYWPT-HLIPFELVSA-N 395.528 5.075 30 20 GKED C[C@@H](Nc1cc(C#N)nc2ccccc12)c1ccc(OCc2cccnc2)cc1 301366816 NXOMLUGLOPJDGX-QGZVFWFLSA-N 380.451 5.254 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2)cc1)C(=O)N(CCC#N)c1ccccc1 302807066 BBEFUGAXVZUJLC-IBGZPJMESA-N 385.467 5.226 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303310919 QZBWUEXMNOCMKD-DLBZAZTESA-N 382.529 5.468 30 20 GKED C=CCN(CC1CCCCC1)C(=O)C1CCN(c2nc3ccccc3s2)CC1 303453073 LGSCKIAREYTPQO-UHFFFAOYSA-N 397.588 5.108 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 321085323 MMKDODYMZSDSFI-JTQLQIEISA-N 389.318 5.068 30 20 GKED COc1ccc2c(c1)[C@H](/N=C(/O)C1CCCCC1)CCN2C(=O)C1CCCCC1 329540350 WNLAZNQOCRCYJL-OAQYLSRUSA-N 398.547 5.590 30 20 GKED CC(C)COc1ncc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1Cl 430597919 RHEMGGFFDYIBMY-CYBMUJFWSA-N 391.924 5.014 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)C(c1ccc(F)cc1)c1ccc(F)cc1 436105601 RXDMUJNMJKYERX-AREMUKBSSA-N 375.484 5.523 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c1 437325751 GYNAEZCXIMBJCB-UHFFFAOYSA-N 375.478 5.073 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1F 438052279 IJMKHDYVMSLDDQ-ZIAGYGMSSA-N 389.471 5.284 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2ccccc2)c2ccco2)cc1C(F)(F)F 438642701 RPSNLNYJXYIMMS-GOSISDBHSA-N 385.345 5.081 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 438836106 FBGFRESRRJFPSJ-UTKZUKDTSA-N 381.545 5.592 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 442296846 NQUZCNZFMPHTRC-KDOFPFPSSA-N 377.410 5.168 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc(C)c2)nnc1[C@H]1COc2ccccc2O1 463036300 QRQLQBSOVOSTMQ-OXJNMPFZSA-N 393.512 5.138 30 20 GKED C[C@H]1CCc2c(sc3nc([C@@H](C)Sc4cccc(C#N)c4)nc(O)c23)C1 468628028 PDCSEDDUDPCASZ-NWDGAFQWSA-N 381.526 5.247 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 468686217 CUBAZVQLSZPBEL-UHFFFAOYSA-N 377.271 5.888 30 20 GKED COCCCC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1 472464059 NLPHEMFDVMUXHE-QHCPKHFHSA-N 393.531 5.036 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)ccc1Cl 472532541 JGUDBALDEHXSCP-MRXNPFEDSA-N 381.888 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H](OC)c1ccc(F)cc1 475576369 SZRXHJWKJWQBCU-ZHRRBRCNSA-N 384.495 5.575 30 20 GKED Cn1cc(CNc2ccc(-c3cnc(C4CC4)o3)cc2)c(-c2ccc(C#N)cc2)n1 478214244 XDMYKYONWBHCTP-UHFFFAOYSA-N 395.466 5.103 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 482056147 YEOCGDLQFKKKDH-QFIPXVFZSA-N 392.911 5.210 30 20 GKED N#CCCC[C@@H](NC(=O)c1cccc(Br)c1Cl)c1ccccc1 487236858 DAAHIYPDJBMNBU-MRXNPFEDSA-N 391.696 5.267 30 20 GKED Cc1ccc(OCCCC(=O)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 487569799 TVYBZAMUHDYDPE-FQEVSTJZSA-N 384.907 5.359 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3c[nH]nc3-c3ccccc3)cc2)cc1 492729053 RWEQWHKTQWHTTN-UHFFFAOYSA-N 394.434 5.187 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc4c(s3)-c3ccccc3OC4)CC2)cc1 503977936 DONLMMRSPXCRLR-UHFFFAOYSA-N 398.487 5.109 30 20 GKED N#Cc1cccc(OCCSCc2cccc(C(=O)Nc3ccccc3)c2)c1 504440735 FGUKQSIOKPDFLV-UHFFFAOYSA-N 388.492 5.123 30 20 GKED Cc1ccn2cc(-c3ccc(NC(=O)c4cc(C#N)ccc4Cl)cc3)nc2c1 505990719 ILODOHURXONFIY-UHFFFAOYSA-N 386.842 5.087 30 20 GKED CCN(C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc(C#N)cc1 510370954 AVKXXTCVIMRDKP-BANKROOTSA-N 376.422 5.060 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)c3ccc4c(c3)oc3ccccc34)CC2)cc1 511150980 CTHPVNSJTJCEKS-UHFFFAOYSA-N 396.446 5.141 30 20 GKED CCC(CC)N(C(=O)C[C@H](CC#N)c1ccccc1)[C@H]1CCCc2cccnc21 511281065 KLZLAEDKSUTXDL-GMAHTHKFSA-N 389.543 5.564 30 20 GKED CCC(CC)CN(CC)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511443279 ZPFZKBAILUFCES-UHFFFAOYSA-N 393.531 5.622 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)NCC(C)(C)CCC#N)s2)cc1 513134632 ANWBHDMLKQANSQ-KRWDZBQOSA-N 398.576 5.459 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(COCC2CC2)c1 513627700 XMSQUHZYOYHZOX-UHFFFAOYSA-N 382.463 5.404 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](Cn1cnc3ccccc31)c1ccc(F)cc1)CC2 515925368 SXUBJCOTINJHHH-UPVQGACJSA-N 396.469 5.065 30 20 GKED CCOc1cc(CNC2(c3cccc(C#N)c3)CC2)ccc1OCc1ccccc1 516266100 KSSLNDUBJBGFFD-UHFFFAOYSA-N 398.506 5.315 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 517265379 BMEDMFGKGMVLES-UHFFFAOYSA-N 398.466 5.008 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(Cl)cc2[nH]1)c1ccc(Cl)c(Cl)c1 517605338 SURKUUWTGVYRCJ-INIZCTEOSA-N 378.646 5.123 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 518659311 AUNISNXYCYSFFE-SFHVURJKSA-N 396.556 5.743 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 520865598 KOQVZFMEGGEYDT-MAODMQOUSA-N 386.520 5.834 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Oc2cccnc2)cc1 521663021 GVIRMCGPRQBPQS-RXVVDRJESA-N 385.467 5.139 30 20 GKED COc1ccc(-c2nc(CS[C@@H](C)c3ccc(C#N)cc3)cs2)c(OC)c1 522840427 KJNAZCQIUNLVJX-AWEZNQCLSA-N 396.537 5.693 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)N[C@H](C)c1cccc2ccccc12 525116909 WCWMTTQZHTVEQS-CABCVRRESA-N 378.472 5.209 30 20 GKED C=C(C)CN(CC)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C 525506969 RGLJMMZUWNQLLY-UHFFFAOYSA-N 380.467 5.118 30 20 GKED C[C@H](N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccc(C#N)cc1 532207022 IXRPFUJTHBWWSZ-OALUTQOASA-N 396.494 5.197 30 20 GKED C[C@@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)c(F)c1 539610516 ZBWBWZNDHNKAOK-MRXNPFEDSA-N 379.479 5.067 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(c4cccc5ccccc45)CC3)cc2)CC1 539633710 KNXATLQJPYIBIJ-UHFFFAOYSA-N 380.491 5.415 30 20 GKED C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1ccc(C#N)cc1 540596615 RREMNRSHZOWDEV-SFHVURJKSA-N 396.469 5.401 30 20 GKED C[C@@H]1CC(CCNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C[C@@H](C)O1 549232066 YTLCNHVRPZNBPN-IAGOWNOFSA-N 393.487 5.066 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCc2nc(-c3ccccc3)sc21)c1ccccc1 551207642 BHIGIQXUEUISCG-NHCUHLMSSA-N 387.552 6.212 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCc2ccccc21 553665135 LPZISJAUHDLIIP-FUHWJXTLSA-N 379.529 5.322 30 20 GKED Cc1cccc([C@@H](NCc2ccc(Br)cc2C#N)C(F)(F)F)c1 553879615 VSZONSAVZBHNOP-MRXNPFEDSA-N 383.211 5.022 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1 554943358 RYLXPTCKFJNECJ-UHFFFAOYSA-N 393.512 5.314 30 20 GKED C=C(C)Cn1c(SCc2ccc(C(C)C)nc2C)nnc1-c1ccncc1 555038611 JJNPCRLKCLRLSV-UHFFFAOYSA-N 379.533 5.035 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccc(F)cc3F)no2)c2ccccc21 556353580 RJRXYCRADUYBEU-TWGQIWQCSA-N 376.366 5.054 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ocnc3-c3ccccc3)c2C#N)[C@@H](C)C1 562700017 XIMBJNPZGDACEV-STQMWFEESA-N 377.469 5.213 30 20 GKED C=C(C)[C@@H](Cc1nc(-c2ccnc(Oc3cccc(CC)c3)c2)no1)OCC 579417695 NIVIYIHASSGMTH-LJQANCHMSA-N 379.460 5.010 30 20 GKED CC(C)c1ccc(O[C@H](C)CNC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 588167444 WZMKUBKEHYWLJS-CYBMUJFWSA-N 391.298 5.186 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 588952538 RPRZRUZQYQBEFD-SBUREZEXSA-N 385.511 5.092 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Nc3ccc4oc(CO)cc4c3)cc2)c1 590607022 HGDNPHQTHJDQOF-UHFFFAOYSA-N 399.406 5.233 30 20 GKED N#CC1(Cc2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)CCCCC1 594732610 SLUGUDPINJLFQU-UHFFFAOYSA-N 378.407 5.080 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 595453578 QFVJMHGNXXNJLY-LLVKDONJSA-N 394.347 5.173 30 20 GKED CCCCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1 609079743 HPLROLRCSHDYPI-UHFFFAOYSA-N 397.906 5.587 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H]1CCc2ccccc21 609398019 BKNGMLWDEAATHB-UTKZUKDTSA-N 393.556 5.870 30 20 GKED CC(C)COc1ccccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609436765 FFKWNJHALAKPSU-QGZVFWFLSA-N 397.544 5.437 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609437106 PJKFZLYPDIBAPU-XMMPIXPASA-N 397.478 6.028 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(C)(C)C)cc1 609438213 FZZCJAXKUMHUPA-MRXNPFEDSA-N 381.545 5.700 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c2c1 610174941 OFVMLQMHCSRTNO-CQSZACIVSA-N 391.496 5.056 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 614182457 SDJKQVLPOQIDCB-LJQANCHMSA-N 379.507 5.877 30 20 GKED O=C(NCc1ccc(C(F)F)cc1)Nc1ccc(C(F)(F)C(F)(F)F)cc1 680906341 RUAGWQCMPBEYNK-UHFFFAOYSA-N 394.290 5.600 30 20 GKED C#CCN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)[C@@H]1CCc2ccccc21 726596172 CEUSCCYDOMLSMJ-GOSISDBHSA-N 398.293 5.166 30 20 GKED O=C(/C=C\c1ccccc1-n1cncn1)c1ccc(Oc2ccccc2)c(F)c1 726743429 GYIULVUNBAOLHF-BENRWUELSA-N 385.398 5.095 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccccc2F)cc1 726858506 NNAXGGMSFNWTSW-JXFKEZNVSA-N 380.463 5.009 30 20 GKED COCCOc1cccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)c1 727266722 DGTNMEAYEYPFCC-NBVRZTHBSA-N 391.492 5.048 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2csc([N+](=O)[O-])c2)CC3)cc1 727780903 WIWPZRPSRNRRIL-JYRVWZFOSA-N 398.465 5.001 30 20 GKED N#CCOc1ccc(COc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 729241131 MPUOMKLNDUKRBR-UHFFFAOYSA-N 375.268 5.206 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(-c3nc4c(F)cccc4[nH]3)cc2)c1 730738108 XYNDZTAVWFBXGJ-UHFFFAOYSA-N 386.455 5.159 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(CC2CC2)C2CCCCC2)cc1 732419208 ZGRWHTIEIIIICN-DEOSSOPVSA-N 387.527 5.919 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCCc3nc4ccccc4s3)[nH]c12 735791666 BAQDOCYZRHALBA-HNNXBMFYSA-N 388.496 5.070 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2csc(-c3ccoc3)n2)cc1 737502894 JVMFACWNCPGHQT-OAQYLSRUSA-N 399.475 5.240 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC[C@@H](c2nc3ccccc3s2)C1 738297715 AAQHNKWGZGUONA-OAHLLOKOSA-N 397.931 5.232 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)c3ccc(OC4CCOCC4)cc3)cc2)cc1 741881702 XNOYBOUQQJOZSR-UHFFFAOYSA-N 399.446 5.002 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)cc1C#N 742370464 VTIPHYAIBHQHLV-LJQANCHMSA-N 386.495 5.305 30 20 GKED C[C@H](ON=Cc1cccc(Cl)c1Cl)c1nnc(-c2cccc(Cl)c2)o1 747829033 VWNYXJCPILORMS-JTQLQIEISA-N 396.661 5.809 30 20 GKED N#Cc1ccc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)s1 748998148 LEMSTDMABKYJQI-VGOFMYFVSA-N 375.222 5.307 30 20 GKED COc1ccc([C@@H](C)CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 749910516 FOVYZGIYZMAJTH-UUOWRZLLSA-N 384.479 5.483 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccccc2)c2ccccn2)cc1 764568442 JKZXCEGIFXZFLJ-MBSDFSHPSA-N 378.903 5.653 30 20 GKED C=CC[C@@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccncc1 766019872 NOWFMWLHWJJCQV-MOPGFXCFSA-N 379.504 5.629 30 20 GKED O=C(OCCCF)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 767374643 MYIXNIRIOZADST-GNVUBMPBSA-N 390.339 5.012 30 20 GKED Cc1cccn2cc(-c3ccc(NCc4ccc(O[C@H](C)C#N)cc4)cc3)nc12 770529261 SNQROCGVZUPAOQ-GOSISDBHSA-N 382.467 5.213 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCc3ccc(Br)cc32)c1 772981746 ADYUIVPOEPIAPD-WIYYLYMNSA-N 399.332 5.297 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccccc2OC(F)(F)F)c1 772985722 XPUBXHHYJCQCAJ-ZBFHGGJFSA-N 378.394 5.117 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(-n4ccnc4)cc3)cc2F)c1 779595919 PWXAJFAJWIMCKZ-UHFFFAOYSA-N 398.441 5.074 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(C(F)(F)F)cnc1Cl 779768509 MWLLDVDCJRHAKN-JTQLQIEISA-N 399.825 5.258 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 779989748 ZFLLYTXJIAOOQM-LLVKDONJSA-N 388.311 5.627 30 20 GKED CC1(C)[C@H](c2ccccc2)C[C@H]1Nc1ccc2c(c1)CCC(=O)N2CCCC#N 786961126 SFBYOSCFSSRYLL-JTHBVZDNSA-N 387.527 5.264 30 20 GKED CC(=Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O)c1csc(Cl)c1 787153148 AZKHXYHXTONYGH-UHFFFAOYSA-N 399.928 5.421 30 20 GKED Cc1cc(C)c(N2CC[C@@H](Nc3ccccc3SC[C@H](C)C#N)C2=O)c(C)c1 788689873 DYELORKDZQEZIQ-OXQOHEQNSA-N 393.556 5.081 30 20 GKED Cc1nn(C(C)C)cc1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 798952244 YRIWBXOYVUKPPD-UHFFFAOYSA-N 394.906 5.489 30 20 GKED Cc1cc(C(=O)OCCCC2(C#N)CCOCC2)sc1-c1ccc(F)cc1 800159559 QWCGZVCXDOIKOU-UHFFFAOYSA-N 387.476 5.120 30 20 GKED C[C@H](Oc1ccc(C(=O)OCCCC2(C#N)CCOCC2)cc1)c1ccccc1 800213788 ZTYXUICWBKWZGU-IBGZPJMESA-N 393.483 5.084 30 20 GKED N#CCCCn1cc(C(=O)OCc2ccc(Cl)nc2Cl)c2ccccc21 800216355 UFAWEWBRHITUOU-UHFFFAOYSA-N 388.254 5.004 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2cccc(-c3ccccn3)c2)C(=O)c2ccccc21 802709508 QRDQELLJGZQBTA-JIKIWWBOSA-N 383.447 5.065 30 20 GKED N#C[C@@H](C(=O)C1(C(F)F)CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 808980192 WDNDOMMVXDYBMB-ZDUSSCGKSA-N 380.847 5.465 30 20 GKED N#C[C@H](C(=O)Nc1ccc(F)c(Cl)c1)C(=O)c1ccc(C2=CCCC2)cc1 810531073 JOTDKRXHAMJURB-KRWDZBQOSA-N 382.822 5.008 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cc(OC)c1O 914773686 QWWDQERITMUEQQ-BQYQJAHWSA-N 384.428 5.173 30 20 GKED COc1cc(C(C)=NNc2nc(-c3ccccc3)cs2)ccc1OC(F)F 916545721 VOKINWDVKUDRLM-UHFFFAOYSA-N 389.427 5.256 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1ccc(Oc2ccc(Cl)cc2)cc1 1776030901 BWHJWABPKFVYBQ-UHFFFAOYSA-N 380.831 5.667 30 20 GKED CCC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(Oc2ccccc2)cc1 1776073725 KLJQOLAQDKTTSK-UHFFFAOYSA-N 378.403 5.542 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776105738 CONSZDYAXYEYAG-INIZCTEOSA-N 392.524 5.921 30 20 GKED CC(=C\c1ccccc1OC(F)F)/C=C1\CCc2oc(C(=O)O)c(C)c2C1=O 1776199934 AYDLFYSTQNRSDQ-LRGIMLIUSA-N 388.366 5.046 30 20 GKED C[C@@H]1C/C(=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776589757 WFLHKILMDDXWBP-KQDBDJGHSA-N 398.458 5.665 30 20 GKED CCCCCCCSc1ccc(C(=O)N[C@@H](CC(=O)O)C2CCCC2)cc1 1776787532 QWSLYTRTTCYKPQ-FQEVSTJZSA-N 391.577 5.512 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2ccccc2F)cc1 1776788011 KRGFPEXYFCBSQS-QFIPXVFZSA-N 387.495 5.481 30 20 GKED CCc1c(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)oc2ccccc12 1776956172 GDNNPXDORMXKNN-CSKARUKUSA-N 399.240 5.352 30 20 GKED COc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1OCC(C)C 1777359892 DJPGRGUMDZQRTQ-WOJGMQOQSA-N 394.467 5.031 30 20 GKED N#Cc1ccc(CSCc2ccc(C(=O)Nc3ccccc3)cc2)c(F)c1 9852606 KBSKALYUYUQPIW-UHFFFAOYSA-N 376.456 5.383 30 20 GKED COc1c(Cl)cccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 65863847 WSYZRNZYUBLUIF-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C(C)C)s1 108529397 NEDNSABPBJBLIW-HNNXBMFYSA-N 387.574 5.751 30 20 GKED N#C[C@H](C(=O)CC/C=C/c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl 121743046 YRZAGJDUZRIYAE-KZJSRBBCSA-N 387.266 5.134 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(C)c(NC(=O)c2ccccc2F)c1 156749624 RPQFVMLAHXIUBU-UHFFFAOYSA-N 382.479 5.205 30 20 GKED N#C[C@H](NC(=O)c1occc1CSc1ccccc1)c1ccc(Cl)cc1 159410350 USDZLKNXSDYFJK-SFHVURJKSA-N 382.872 5.220 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 173040604 VKWJZSADHSHMCZ-UHFFFAOYSA-N 396.218 5.024 30 20 GKED Cc1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c(F)cc1F 176130286 UQCJTFGUAVXWFO-UHFFFAOYSA-N 392.405 5.171 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)Nc1sccc1C#N 180506671 MZLNWZGMYSHUCS-UHFFFAOYSA-N 378.240 5.142 30 20 GKED Cc1c([C@H](C)N[C@H](CCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 181571766 ARNIBTVAEHUOTD-KSFYIVLOSA-N 378.907 5.530 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2c(-c3ccccc3)oc(C)c2C)cc1 187485557 DJUKXBKMZIADSG-UHFFFAOYSA-N 389.455 5.123 30 20 GKED COc1ccc(Br)cc1/C=C\C(=O)c1ccc(SC)c(OC)c1 207746945 ALUPRYNBIGLGQU-DAXSKMNVSA-N 393.302 5.084 30 20 GKED C[C@@H](CC(=O)c1ccccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 266358843 PJXFUOHYULWQKM-LSDHHAIUSA-N 384.476 5.068 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/Cc5ncoc5C)(C4)C2)C3)cc1C 329038926 SCSAOCDTNPRRIT-UOYQGRGCSA-N 378.516 5.595 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 409755943 SMRJQRGYUOUOSC-RTBURBONSA-N 385.294 5.183 30 20 GKED Cc1ccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c(OCC(F)(F)F)c1 425644301 LVFGPLJWHYZGTG-CQSZACIVSA-N 391.393 5.033 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425659825 WGJXLOGRURNHQJ-HZPDHXFCSA-N 378.501 5.177 30 20 GKED C[C@H](NC(=O)NC[C@@H]1CCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 430897199 KHNLKOFLVCWQFX-DOTOQJQBSA-N 383.442 5.021 30 20 GKED COc1cc2nc(C)sc2cc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432837105 QOTCKWYZHCPCEW-MRXNPFEDSA-N 394.500 5.170 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(Oc2ccccn2)cc1)c1ccccc1 433140482 HOIJXISWLDLZCC-NRFANRHFSA-N 386.455 5.431 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC1CC(OC(C)(C)C)C1 433517649 CVTTXNDSICKBGR-GTPINHCMSA-N 389.565 5.186 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)cc1C(F)(F)F 438635300 UDEFBPKHFNDPLC-AWEZNQCLSA-N 393.796 5.252 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccccc2Cl)cc1C(F)(F)F 438644084 VSVUVFQGFAODNM-KRWDZBQOSA-N 393.796 5.599 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CC(C)(C)CC(=O)c1ccccc1 442750900 JVXGDAYNXQTZNK-QGZVFWFLSA-N 394.540 5.566 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)c1cn(CCCC#N)c2ccccc12 443895552 CQXBWPDJCSOADE-UHFFFAOYSA-N 385.920 5.322 30 20 GKED C=CCC1(C(=O)N2CCC(c3nc(C(F)(F)F)cs3)CC2)CCCCC1 452533968 WGGVETNIWAIJKI-UHFFFAOYSA-N 386.483 5.395 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(Br)ccn1 455241239 FKUDGYLKSUIBTO-UHFFFAOYSA-N 388.309 5.018 30 20 GKED COC1CCC(N(C)C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CC1 455950989 YYSYQMTVKCTPTI-UHFFFAOYSA-N 395.528 5.131 30 20 GKED CCSc1cc(Cl)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 461014221 JGTGFJIDFDCZTE-CYBMUJFWSA-N 390.961 5.956 30 20 GKED N#Cc1ccc(NCc2ccc(C(=O)Nc3ccccc3)cc2)cc1C(F)(F)F 462175202 JCZDTQOFLOUVEM-UHFFFAOYSA-N 395.384 5.441 30 20 GKED N#Cc1cnc(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c(Cl)c1 463064921 MWHRZDOEEPZIKS-UHFFFAOYSA-N 394.809 5.361 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 463747527 UYYKUFHTGGPZID-PXAZEXFGSA-N 379.262 5.082 30 20 GKED C=CCn1c(SC[C@@H]2CCC3(CCCCC3)O2)nnc1-c1ccccc1OC 466423053 PUSDBPDWAGREEX-KRWDZBQOSA-N 399.560 5.114 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(COCCc2ccccc2)c1)c1ccccc1 475175833 SCMJQVZWQGPBMT-XMMPIXPASA-N 398.506 5.472 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(OCCC)c(OC)c1 475546866 GDUUTXVFLLHPME-UHFFFAOYSA-N 396.531 5.658 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1NC(=O)C[C@H]1C=CCC1)c1ccccc1 475760658 ORJATPITXOGVMZ-ICSRJNTNSA-N 387.483 5.007 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nc(-c2sc(C)nc2C)cs1 485734007 BNKGSJLRFXMJNR-UHFFFAOYSA-N 387.555 5.414 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OCc2ccncc2)cc1 486210725 CQVPWIBKKSTKEP-UHFFFAOYSA-N 376.481 5.191 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21 505002034 ZRHNYFWEUQFKPV-NRFANRHFSA-N 378.520 5.316 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccsc2)s1)c1c(Cl)cccc1Cl 505508237 WGOJYABMQOZDJW-GFCCVEGCSA-N 394.308 5.173 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 505986124 FTRNASSYKNJQJW-OAHLLOKOSA-N 393.434 5.123 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(C(F)(F)F)cn2)cc1 507890083 PTSBRYWYPSSXSU-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@@H]1CCC[C@H](N(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 511391531 POYORTDTHNAAFG-NQIIRXRSSA-N 391.515 5.374 30 20 GKED Cc1ccnc2ccc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc12 513661156 NCUAPFWOFQKJTM-OAHLLOKOSA-N 377.856 5.296 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1 518710266 UWXDVZOFBAMDOC-NHYWBVRUSA-N 397.689 5.104 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc(-c2ccc(OC)cc2)c(C)s1 519156421 JOIKVRDTPGUNFD-UHFFFAOYSA-N 384.545 5.524 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCSc2c(F)cccc21 519894336 PISHQHMQKODKJF-FQEVSTJZSA-N 397.519 5.102 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCCc2ccccc21 520194381 RLNHSWJVIFOCAG-OXJNMPFZSA-N 379.529 5.622 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)cc1 521752605 BIAIYOHRKLDDMF-RPWUZVMVSA-N 384.479 5.289 30 20 GKED CC(C)N(Cc1cccc(F)c1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 522075509 MDKSDEGNBZSVLQ-UHFFFAOYSA-N 387.458 5.063 30 20 GKED C=CCN(C(=O)c1csc(C(C)(C)C)n1)c1nc(-c2ccccc2)cs1 523956137 AAIVRJSANQJHGN-UHFFFAOYSA-N 383.542 5.397 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)sc1SCC#N 524105116 QZEFEPOQZZHMAK-GHMZBOCLSA-N 398.340 5.116 30 20 GKED CC(C)=CCSc1ccccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 525477994 QWGAWQBOFNXDLA-QGZVFWFLSA-N 396.581 6.249 30 20 GKED Cc1sc([C@@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 540708179 NHMIJDVIRRSTJN-CHWSQXEVSA-N 399.922 6.195 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1ccc(Cl)c(C#N)c1 544675701 SFEPVSGVBDEYPB-CQSZACIVSA-N 395.915 5.477 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1Cl 547953916 KLUTZOYPSYIHSF-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC(C)c1ccc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c(C(C)C)c1 555297464 CVEZRVKODCLEQI-UHFFFAOYSA-N 375.394 5.471 30 20 GKED Cc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 556202228 KMORMGVMBRQSPE-XLIONFOSSA-N 383.923 5.390 30 20 GKED N#Cc1c(NC(=O)C2CCC(OC(F)F)CC2)sc2c1CCCCCC2 571716093 WCWLWIKRCWTIIO-UHFFFAOYSA-N 382.476 5.015 30 20 GKED COc1ccccc1[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 571724744 ARPXBJAUNPVJAL-ISKFKSNPSA-N 388.898 5.587 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 581276050 YQSWHUPYWDBZRV-LJQANCHMSA-N 392.883 5.037 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)C3CC(c4cccc(F)c4)C3)cc2)ccn1 582153413 RYLIWLYSHLFQRP-UHFFFAOYSA-N 387.414 5.017 30 20 GKED C=CCC[C@@H](Nc1ccc2c(c1)N(CC(F)F)C(=O)CS2)c1ccco1 583219791 HGYSSNRDRWBNNT-CQSZACIVSA-N 378.444 5.103 30 20 GKED Cc1cccc(-c2nc3cc(F)ccc3n2C(C)C)c1NC(=O)CC1(C#N)CC1 590984929 BQJAHWBAURLIAA-UHFFFAOYSA-N 390.462 5.364 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2CC1(c1ccccc1)C2 596733997 MTTOHICPCJVXTH-YPHUNTSASA-N 377.513 5.091 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)C1 597912813 WMPRLFVDTHDFJH-CQSZACIVSA-N 389.282 5.552 30 20 GKED CC(C)CCO[C@H]1CC[C@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)CC1 599171446 HOVUMWLKJHPNBM-YPAWHYETSA-N 385.552 5.095 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)N(C)Cc1ccc(C#N)cc1 603646949 SVOOTTWZCNCYBJ-UHFFFAOYSA-N 391.393 5.030 30 20 GKED CCCN(Cc1ccccc1)C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 603649931 JHYNVBHMXHAPEK-UHFFFAOYSA-N 390.512 5.050 30 20 GKED Cc1cccc2sc(C(=O)Nc3ncccc3OCCCC#N)c(Cl)c12 608883062 SQAUMYQRXZONHK-UHFFFAOYSA-N 385.876 5.193 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc(OCCCC#N)c1 609262001 FDTQKNURHJGPNN-NRFANRHFSA-N 380.488 5.289 30 20 GKED COc1ccccc1[C@H]1CCCCN1C(=O)Nc1cc(C#N)ccc1OC(C)C 609281603 HGHLCLJRJOYGOJ-HXUWFJFHSA-N 393.487 5.113 30 20 GKED Cc1ccc(CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C2CC2)o1 609500847 HWKYDLWZAXOGIQ-UHFFFAOYSA-N 386.451 5.251 30 20 GKED CC(C)(NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 609744063 CKKPZVBLSIBQOE-UHFFFAOYSA-N 377.469 5.469 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 609825900 ZXQOTZBYZYSONU-QGZVFWFLSA-N 380.557 6.238 30 20 GKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 611391178 YQYOOLDDASGDMP-AVRWGWEMSA-N 383.495 5.260 30 20 GKED CC(C)c1c(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cnn1-c1ccccc1 617166879 JYBIAVCCLXBSQO-UHFFFAOYSA-N 399.281 5.426 30 20 GKED O=C(Nc1ccc(F)c(Cl)c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618539012 GDIQNABKDANXPO-HTQZYQBOSA-N 392.702 5.074 30 20 GKED C=CCN1C(=O)c2ccccc2N[C@H]1c1cnc(-c2ccc(Cl)cc2)s1 639402707 AWPZETOBQVZIFK-GOSISDBHSA-N 381.888 5.216 30 20 GKED CN(Cc1ccccc1F)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 661901382 FESCCJROAUCZLA-UHFFFAOYSA-N 388.327 5.021 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1nc2ccccc2s1 725832607 KNFVLLNYYOISGM-UHFFFAOYSA-N 387.390 5.094 30 20 GKED C#Cc1cccc(NC(=S)N2CCc3sccc3[C@H]2c2cccs2)c1 726449291 NWZWHTBHYLKRSX-IBGZPJMESA-N 380.563 5.135 30 20 GKED Cc1c(C(=O)/C=C/c2ccccc2C(F)(F)F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727267888 VTRBEZHUZVEBEB-BQYQJAHWSA-N 394.305 5.035 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(SC(F)F)c1 727596837 QJQUHVGZRVALLF-UHFFFAOYSA-N 389.471 5.563 30 20 GKED N#Cc1cccc(COc2ccc(NC[C@@H]3CC3(Cl)Cl)cc2Cl)c1 728053172 QXNIKGLHIGKWGL-AWEZNQCLSA-N 381.690 5.396 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)c1 730180804 KTKUAQGQAXTGPH-XZOQPEGZSA-N 387.504 5.075 30 20 GKED C=CCN1CCC(NC(=O)Nc2ccc(-c3cccc(Cl)c3)cc2C)CC1 730383291 INQFQQNJRDNQKU-UHFFFAOYSA-N 383.923 5.087 30 20 GKED CC[C@](C)(NC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 730818515 MWJSSYXVMHYYJF-QFIPXVFZSA-N 390.512 5.052 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H]2Cc2ccccc2)cc1 743096040 OAIFXDYWYBLJMA-JRFVFWCSSA-N 381.479 5.095 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccc(F)cc1 743462074 FAPWRGYAQHVPJE-LMRWQKIVSA-N 398.409 5.507 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1)c1ccncc1 745829193 YSXUKXIOCNKTMQ-JOCHJYFZSA-N 381.495 5.382 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc(Cl)c1OC 745990243 PDPLSJZYUONONE-WTKPLQERSA-N 393.870 5.705 30 20 GKED C[C@@H](OC(=O)c1ccccc1SCc1cscn1)c1ccc(C#N)cc1 748679962 MNCYOZKCZMYRBZ-CQSZACIVSA-N 380.494 5.225 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1)OCC 756475571 CRYOXZTVCUSBCS-WMLDXEAASA-N 377.868 5.279 30 20 GKED C#Cc1cccc(NC(=S)N(C)[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 759126497 FZTUUWXVFPMCTA-INIZCTEOSA-N 391.565 5.490 30 20 GKED C=CC[C@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1ccncc1 762220024 FPQKIYLYZQFXNA-MOKGIYGOSA-N 380.797 5.114 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(Br)cc2F)c(Cl)c1OC 767736483 LXTCJWZSPNIGNF-XVNBXDOJSA-N 399.643 5.155 30 20 GKED C/C(=C\C(C)(C)C)C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 773980265 PRAJVTKOTBBCSC-ZWFBASDOSA-N 376.456 5.119 30 20 GKED C=CC[C@H](C(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1)c1ccccc1 777734710 DUZOHIOTELJWFY-NRFANRHFSA-N 394.515 5.052 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780167124 WCVGBJUWMVEFGS-KRWDZBQOSA-N 388.492 5.689 30 20 GKED COc1ccc(N[C@@H](C)c2ccc(C#N)cc2F)cc1NC(=O)C1CCCCC1 781420267 AXUGJUXURLYDIL-HNNXBMFYSA-N 395.478 5.398 30 20 GKED C[C@@H](NC(=S)NCc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 782204848 LXYXTSSJHIJYRF-OAHLLOKOSA-N 377.538 5.012 30 20 GKED CC(C)(C#N)CCCOC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 782636132 IIKPHKJJJPDJEE-UHFFFAOYSA-N 396.434 5.245 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCCS1)c1nc(-c2ccc(Cl)cc2Cl)cs1 783354708 GHBVDNZMGWOTKC-IUODEOHRSA-N 397.352 5.579 30 20 GKED N#C[C@H](C(=O)CCCCC(=O)c1ccccc1)c1nc2cc(F)ccc2s1 783376494 BXWZTXUOCIVTAS-MRXNPFEDSA-N 380.444 5.055 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(O[C@H](C#N)CC)c1 789450629 FIIIQVQXLFQIID-FQEVSTJZSA-N 391.515 5.541 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(C)n1[C@H](C)c1ccccc1 792102718 JCYGEEBEJHNPKZ-HOYKHHGWSA-N 393.490 5.753 30 20 GKED C[C@H](OC(=O)c1cccc(C(F)(F)F)c1F)c1ccc(C(F)(F)F)cn1 798667476 RWSALTAXTJOKDS-QMMMGPOBSA-N 381.247 5.176 30 20 GKED C[C@H]1C[C@H](C=NOc2ccccc2C(F)(F)F)CCN1C(=O)OC(C)(C)C 807981292 GKTMKGOUDMPWDK-UONOGXRCSA-N 386.414 5.106 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CCC1)c1cc(C(F)(F)F)ccn1 813211921 SYYMUXSTADWDMA-OAHLLOKOSA-N 378.781 5.052 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1sc(-c2ccc(F)cc2)nc1C 814711546 NAPWFEMNLCRFSN-UHFFFAOYSA-N 394.397 5.508 30 20 GKED Cc1ncoc1-c1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 820902665 DYSBIZBIFJQALA-UHFFFAOYSA-N 378.775 5.017 30 20 GKED CSCCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 860502936 PXEBMPFZUDSFKY-QGZVFWFLSA-N 383.542 5.172 30 20 GKED CC(C)(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(C#N)cc1 862209452 RGSSVWQNADFSJS-UHFFFAOYSA-N 394.359 5.006 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCOc2ccc(Cl)cc2)cc1 915598614 XAFSDHOWYZNWBS-QFIPXVFZSA-N 390.870 5.403 30 20 GKED CCOc1cc(/C=C2\CCC/C(=C\c3ccc(O)c(OCC)c3)C2=O)ccc1O 916137232 QCQZRDXCECWIMK-KLCVKJMQSA-N 394.467 5.115 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H](C)Oc1cc(C)ccc1C(C)C 916373497 GITXIBFQBVYLMP-CQSZACIVSA-N 387.863 5.025 30 20 GKED COc1cc(C=NNc2c(C)cc(C)cc2C)ccc1OCc1c(C)noc1C 916541967 AJJPQLZGVITJPO-UHFFFAOYSA-N 393.487 5.250 30 20 GKED N#C[C@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1ccc2ccccc2n1 916849615 WAIKPZVUPWSWLY-STIKNRRDSA-N 398.462 5.852 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)cc1 916948006 QVZVPUHYOFSURP-LRDDRELGSA-N 389.282 5.468 30 20 GKED N#C[C@@H](C(=O)CCSc1ccccc1F)c1nc2cc(Cl)ccc2s1 917046126 FXSPHZHEGXOCMJ-LBPRGKRZSA-N 390.892 5.447 30 20 GKED Cc1ccc(Sc2ccc(C(=O)N(CCC#N)CC(C)C)cc2[N+](=O)[O-])cc1 917363887 GABLRLPPLHKIIR-UHFFFAOYSA-N 397.500 5.066 30 20 GKED C[C@@H](NC(=O)c1ccccc1OCC#N)c1ccc(Oc2ccccc2)c(F)c1 919819446 RMOVQGOQFLHSKO-MRXNPFEDSA-N 390.414 5.011 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCc1ccc(-c2ccccc2)o1 920101528 CNPIBOUSTSLXHD-HXUWFJFHSA-N 396.446 5.261 30 20 GKED CCC[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920806982 VEQPRKFVNSCGDB-HOTGVXAUSA-N 396.462 5.848 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(O[C@@H](C)c2ccccc2)cc1 1776089031 XSRCISZHIWFNMJ-SFHVURJKSA-N 388.467 5.669 30 20 GKED C=CCOc1ccc(/C=C\c2nc3c(s2)CCC[C@@H]3C(=O)O)cc1Cl 1776184141 KSBKTSZKHDICHO-JWJUJFCLSA-N 375.877 5.036 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)c2c(c1)C(C)(C)CC2 1776269186 AMTKJDWNZSWPNL-ZHACJKMWSA-N 390.523 5.731 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(CC2CCC2)cc1 1776354293 BIBROHFFURXPLF-BENRWUELSA-N 378.468 5.411 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1ccc(F)cc1 6094858 GZCXMZDTEWCNBQ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(Nc2ccc(SC(F)F)cc2)s1 45458279 WQCUDKLJIBQTFN-JTQLQIEISA-N 397.501 5.132 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1 46507691 FJFRMHMVWVVTGJ-NRFANRHFSA-N 398.462 5.035 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Br)ccc2o1)c1ccc2ccccc2n1 48856911 WTHHEXKTPXTSMB-OAHLLOKOSA-N 391.224 5.234 30 20 GKED COCc1c(C(=O)Nc2cc(C#N)ccc2OC(C)C)sc2cccc(F)c12 56212747 BETSKFLHWYESBX-UHFFFAOYSA-N 398.459 5.098 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1)C1CC1 66800290 KJAFGQFCCXSVLU-KRWDZBQOSA-N 393.556 5.317 30 20 GKED CC(=O)Nc1ccc(S[C@H](C)C(=O)/C=C2\N(C)c3ccccc3C2(C)C)cc1 98002166 UQLJZOYIIFJPSV-YZLQOSHFSA-N 394.540 5.006 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)cnn1-c1ccccc1Cl 112177179 HXPYCUDHWVGSAB-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C=CCN(C(=O)c1ccc(NC(=O)c2cccs2)c(C)c1)c1ccccc1 121406051 DFRLILDGQYTYKL-UHFFFAOYSA-N 376.481 5.142 30 20 GKED COc1ccccc1[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccco1 121608689 BWBBJOSKSBGTMC-OAQYLSRUSA-N 389.455 5.000 30 20 GKED N#C[C@H](C(=O)c1sc2ccccc2c1Cl)c1nc(-c2ccncc2)cs1 128836389 YQRDHTQXHZGEIX-CYBMUJFWSA-N 395.896 5.563 30 20 GKED CS[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156374765 YMHMZEHYIJUQCT-BXKDBHETSA-N 385.341 5.435 30 20 GKED CCc1c(C)sc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)c1C#N 165786256 XRIPSNWDSVXGQY-UHFFFAOYSA-N 381.888 5.458 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H]3CCCc4ccccc43)n2)cc1 171777561 FJGNXEVPHGYFJK-FPOVZHCZSA-N 397.503 5.368 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cnn(-c2ccccc2)c1C(C)C 192333156 TWIIGQHXUZFPMA-UHFFFAOYSA-N 399.498 5.087 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(COCc2ccco2)c1 193619582 GCNLDQLBOZTECR-UHFFFAOYSA-N 382.485 5.278 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccccc2OC(F)F)c1 237845131 QEVYMAGOQPGMNE-UHFFFAOYSA-N 394.421 5.028 30 20 GKED N#Cc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 237930377 YWRKYWXEIWUPEB-UHFFFAOYSA-N 393.830 5.202 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1 245407820 DAFJTRIOLXMZTN-ZOCZFRKYSA-N 397.519 5.835 30 20 GKED N#Cc1ccc(Cl)cc1NCc1cn(-c2ccccc2)nc1-c1ccncc1 301256777 DRFCXYRHVQKUBR-UHFFFAOYSA-N 385.858 5.071 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C)Sc2nc(N)c(C#N)cc2C#N)c(C(C)C)c1 303231441 XYYAETUMMXXIAI-CQSZACIVSA-N 392.528 5.017 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C[C@@H]3CCOc4ccccc43)cc2)cc1 303731694 ZKMWRSAOEFBCGO-SFHVURJKSA-N 384.435 5.245 30 20 GKED C[C@@H]1C[C@@H](/C(O)=N/CC2(c3ccc(Cl)cc3Cl)CCOCC2)CCC1=O 328919542 LMNAFMRTESTYHR-KGLIPLIRSA-N 398.330 5.003 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCO[C@H](c2ccsc2)C1 329881760 OYCDDYKIUKTRGW-FQEVSTJZSA-N 398.528 5.130 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410688650 OEBCUMLOBBSIGU-GZMMTYOYSA-N 395.265 5.356 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1 429979872 LQLRGGBMWAOAEX-UHFFFAOYSA-N 386.499 5.107 30 20 GKED C[C@H]1[C@H](c2ccccc2)[C@@H]1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 430418785 YGLDFUCPJVWIFG-PISWEHOVSA-N 396.490 5.320 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Br)c(Cl)c2)s1 430598009 NFIYURNFSPCMNT-JTQLQIEISA-N 397.725 5.347 30 20 GKED CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)N[C@H](CCCC#N)c1ccccc1 431279735 HDUMXHFIIVTHRL-DENIHFKCSA-N 393.531 5.407 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1 431927888 VUNWJOIWSQSAOV-NNWRFLSQSA-N 379.479 5.196 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(F)c(Cl)cc1Cl 436341813 PCGINNDVXGYTLR-RDTXWAMCSA-N 377.246 5.044 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCS1 437784951 ZNVLTLLBCXCYHE-PKOBYXMFSA-N 399.947 5.355 30 20 GKED N#Cc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)c(Cl)c1 439453069 NRXXUKWCSZGLNV-NRFANRHFSA-N 382.294 5.334 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@H](CCC#N)c3ccccc3)o2)c(C)c1 439653555 JZZAWOWGNMQKEZ-OAQYLSRUSA-N 388.467 5.250 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)s1 443571520 SPQKQVXXRSAVQK-LLVKDONJSA-N 392.322 5.194 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cc(Cl)c(Cl)cn2)c1 443972933 YHVUNBVZOQLFGO-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc3ccc(OC)cc3c2C)cc1 460880613 KSGWFCYZKGDJGA-UHFFFAOYSA-N 394.496 5.178 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)[C@H](C)c2cccc(C#N)c2)cc1 463092326 HCHJICMVTOULGK-QGZVFWFLSA-N 386.451 5.491 30 20 GKED CO[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(C)(C)C 467610407 JNKGBPMVQUFCOG-UYAOXDASSA-N 399.922 5.178 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3cccc(C(F)F)c3)c2)cc1 468289816 YZSFMJVVZWPWKR-UHFFFAOYSA-N 378.378 5.469 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1cnc2ccccc2c1 470888447 MNTFUVQXTVUTQU-INIZCTEOSA-N 375.497 5.058 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Br)c2cc(C)oc12 471156862 NDDITKPPOZGSHV-UHFFFAOYSA-N 377.282 5.048 30 20 GKED Cc1c([C@H](C)NC(=O)CCCCOc2cccc(C#N)c2)oc2ccccc12 481721425 XESVDCDPNPZDKE-KRWDZBQOSA-N 376.456 5.039 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@H](C#N)c3nccc4ccccc34)o2)c(C)c1 483228314 MYNNAYSULWKCEL-OAQYLSRUSA-N 396.446 5.514 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2sc(C3CC3)nc2-c2ccccc2)n1 483840515 LXUZAXQVLYOQJL-OAHLLOKOSA-N 393.537 5.757 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2 486562791 QBKVTJUPXGHFNG-UHFFFAOYSA-N 385.577 5.074 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1cc(-c2cc(C)sc2C)nc2onc(C)c12 488843544 USBKPOBZNIXJCH-OAHLLOKOSA-N 381.501 5.057 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 500449731 HJMZZAVGLXJWKM-ROUUACIJSA-N 390.508 5.177 30 20 GKED C[C@@H](c1nc2ccccc2n1C(F)F)N1CC=C(c2ccc(C#N)cc2)CC1 502523512 QXIIVQKCSBVXHU-HNNXBMFYSA-N 378.426 5.153 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 505212659 BQCSRMUSIWBAJD-UHFFFAOYSA-N 395.450 5.231 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc2cc(Br)ccc2o1 509203407 PTNZTIPWMRCBCL-UHFFFAOYSA-N 397.272 5.119 30 20 GKED Cc1ccc(NC(=O)CSc2nc(-c3ccccc3)ccc2C#N)c(Cl)c1 510188702 DBDXRZLMBULETC-UHFFFAOYSA-N 393.899 5.313 30 20 GKED CCOc1ccc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 512320201 AMOKYTIDVCFEEQ-UHFFFAOYSA-N 376.481 5.257 30 20 GKED CC(C)c1cc(C(=O)N(Cc2ccco2)c2ccccc2C#N)nn1C(C)(C)C 514568919 IPLLIFGEEMSYEB-UHFFFAOYSA-N 390.487 5.073 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2cccs2)n1)c1c(Cl)cccc1Cl 517343076 BTPLHTVWUMXSCR-NSHDSACASA-N 394.308 5.173 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H]1CCCc2ccccc21 518127709 IGPAOLJGEXQZOU-UZLBHIALSA-N 396.581 5.830 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3cccc4cccnc34)cc2)cc1 518907954 IMCAYNDBNMGGKW-UHFFFAOYSA-N 393.446 5.023 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 524567646 UWEQMLDHZJKWKS-FGZHOGPDSA-N 393.408 5.130 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OCC(F)(F)F)c(C)c1 524599140 CQURPNZXASQOHK-UHFFFAOYSA-N 378.394 5.156 30 20 GKED N#Cc1ccc(CNCc2ccc(Oc3ccccc3C(F)(F)F)nc2)cc1 525181729 KZDKQDVLAWJHTB-UHFFFAOYSA-N 383.373 5.054 30 20 GKED N#CCC1CCN(C(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)CC1 543824816 BCBNUQLLAXCPSJ-XMMPIXPASA-N 383.495 5.264 30 20 GKED N#CCC[C@H](Nc1cncc(N[C@@H](CCC#N)c2ccccc2)n1)c1ccccc1 553161223 FDDSSKDSFJMYNZ-VXKWHMMOSA-N 396.498 5.391 30 20 GKED Cc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 556198703 WBOICCOKSSRPSB-SBUREZEXSA-N 392.934 5.920 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Cl)cc1OCC(F)F)c1ccccc1 557933778 RKEZZZRPYRSNSG-AWEZNQCLSA-N 378.806 5.010 30 20 GKED C/C(=C\c1ccccc1C(F)(F)F)CN1CCC(C#N)(c2ccccn2)CC1 558622024 SHVWQALBZIWNKB-SAPNQHFASA-N 385.433 5.061 30 20 GKED CN(Cc1cn(CCC#N)nc1-c1ccncc1)c1ccc(-c2ccccc2)cc1 562427431 BMIBATBICRRYPJ-UHFFFAOYSA-N 393.494 5.162 30 20 GKED N#Cc1cc(NC(=O)c2cc3cc(Cl)ccc3o2)ccc1OCC(F)(F)F 603897415 GHBLCXMJKGZPPL-UHFFFAOYSA-N 394.736 5.151 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cncc3ccccc23)cc1Cl 603962368 ROUMQOMHLILYIF-NRFANRHFSA-N 397.865 5.796 30 20 GKED CCOC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 604230883 OTQDDVFBUOPRBJ-UHFFFAOYSA-N 399.878 5.037 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc2cc(C(F)(F)F)ccc21 608552779 LSDVIOQTFHOWBB-MRXNPFEDSA-N 393.368 5.235 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)Nc1cc(C#N)ccc1OC(F)F 609080666 LLNGTUDJDZOWMG-UHFFFAOYSA-N 391.393 5.133 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2F)c2ccccc2F)cc1 609228521 JBVRTURHRBSXDC-UHFFFAOYSA-N 394.446 5.162 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 610070424 LADJNAHBYBJZEK-HSZRJFAPSA-N 384.483 5.310 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)ccc1OC(C)C 610186490 STBZHBRHFMIIQQ-UHFFFAOYSA-N 387.439 5.094 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccc(C(F)(F)F)cc1 642252190 WFIOQWXZKBBYJL-UHFFFAOYSA-N 389.446 5.366 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 681718968 IJEPSCBURLTHNA-LBPRGKRZSA-N 398.768 5.598 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2)Cc2ccco2)cc1Cl 726439918 BGMYTDDFUYFYNP-UHFFFAOYSA-N 381.888 5.204 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(-c3ccccc3C)c2)cc1NC(C)=O 729644063 OTIPDLHDZIQYLR-ACCUITESSA-N 385.463 5.525 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 731322211 WRHKWKYOSYVLSQ-LBPRGKRZSA-N 386.933 5.415 30 20 GKED C[C@H](CSc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 732495866 IZNRFFJNJVGXKX-DOMZBBRYSA-N 386.929 5.554 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc(-c2ccncc2)cs1 734084203 YMYHNOYASSEDBH-OAQYLSRUSA-N 393.471 5.266 30 20 GKED C=CC[C@H](NC(=O)c1sc(-c2ccc(Cl)s2)nc1C)c1ccncc1 734235217 YZMUNLVEJXVVQG-ZDUSSCGKSA-N 389.933 5.276 30 20 GKED C=CC[C@H](NC(=O)N(CCc1ccc(Cl)cc1)CC1CC1)c1ccncc1 735189592 DEFOYVOUFVGRDM-NRFANRHFSA-N 383.923 5.017 30 20 GKED C[C@H](NC(=O)c1ccccc1OCC#N)c1ccccc1-c1ccc(Cl)cc1 739629600 FDOLFLYIMQEVQN-INIZCTEOSA-N 390.870 5.400 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 740435551 PVFSWQSVIQHLEF-ZEQRLZLVSA-N 398.510 5.742 30 20 GKED CC(C)(C)c1nc2ccc(NC(=O)c3ccccc3SCC#N)cc2s1 742774027 AUXKVEHOFHVEBT-UHFFFAOYSA-N 381.526 5.462 30 20 GKED CCCN(Cc1ccccc1O)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743093871 ZBTUMEVBSMGDOV-HSZRJFAPSA-N 399.494 5.492 30 20 GKED N#CCOc1ccc(COC(=O)C[C@@H](Cc2ccccc2)c2ccccc2)cc1 745352004 LWTYRYKKQFZRDR-HSZRJFAPSA-N 385.463 5.049 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccccc2)cc(Br)c1OC(F)F 750898930 ANKMSRRXDSUXOV-HJWRWDBZSA-N 397.215 5.345 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(Br)c1)c1nc2ccccc2s1 761000959 GAJORTQZWWBMGG-OAHLLOKOSA-N 399.313 5.258 30 20 GKED CC[C@H](CC#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 762719782 UBHJNXZERVNATC-MRXNPFEDSA-N 381.526 5.011 30 20 GKED Cc1cc(NC(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)nn1CCC#N 768048292 UZGDKCSJEZFNNF-CSKARUKUSA-N 396.903 5.139 30 20 GKED Cc1cncc(/C=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 772062302 UOAPBNGQLYFMTF-PWYGHMFVSA-N 387.870 5.351 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1 772069986 GREWCWNYXLMYLN-UHFFFAOYSA-N 382.460 5.159 30 20 GKED N#C[C@H](COC(=O)c1cnc(-c2ccccc2Cl)s1)Cc1cccs1 772738010 ZIPYSJPQMXWFRZ-GFCCVEGCSA-N 388.901 5.064 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CC3(CCCCC3)Oc3ccccc32)c1 772982165 GAPJTWQBJAFNEH-NFBKMPQASA-N 390.527 5.684 30 20 GKED N#Cc1ccc(CCC(=O)OCc2nc(-c3ccccc3Cl)cs2)cc1 774959509 ZMYGEPXQOBKVCG-UHFFFAOYSA-N 382.872 5.011 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cc(C#N)cs3)cc2Cl)c1 779595798 NUGFBJPKMGRNQU-UHFFFAOYSA-N 379.872 5.336 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1nn(C2CCCCC2)cc1C 782802671 ICRONGFOACASLT-UHFFFAOYSA-N 382.508 5.239 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C 793118688 VIXIOPRBURMKRD-DOTOQJQBSA-N 399.416 5.037 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1 793384778 WRQHBELTPYASSO-QGZVFWFLSA-N 379.460 5.060 30 20 GKED C[C@H](OC(=O)c1ccnc(F)c1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 795668167 NDJKEMGCADBGHL-ZETCQYMHSA-N 399.237 5.315 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCCOC(C)(C)C 796356655 OIDZMFCUHGCXHY-UHFFFAOYSA-N 382.479 5.134 30 20 GKED C[C@H](CC#N)OC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 797014684 CKRHACUQOAHYET-SNVBAGLBSA-N 383.300 5.240 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(Cl)c2ncccc12 802043172 SFNSEKZZMYULQQ-GOSISDBHSA-N 399.837 5.003 30 20 GKED COc1ccc2cc(NC(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)ccc2c1 803454675 CBQNLRXEKRKEPY-UHFFFAOYSA-N 395.418 5.160 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccccc3N3CCCCC3)cc2)ccn1 810166844 PRYCORNREYIGKG-UHFFFAOYSA-N 384.483 5.348 30 20 GKED CC(C)(C)OC(=O)N1CCC[C@H](CCN[C@@H](CCCC#N)c2ccccc2)C1 814661109 VPUIFPFNSXXLQI-CTNGQTDRSA-N 385.552 5.048 30 20 GKED CC(C)(C)OC(=O)N1CCC[C@H](CCN[C@H](CCCC#N)c2ccccc2)C1 814661112 VPUIFPFNSXXLQI-TZIWHRDSSA-N 385.552 5.048 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 821444937 SAKFTUOTHOYUQI-UHFFFAOYSA-N 386.517 5.090 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc2c(c1)OCCCO2 916318117 MOXOZQMIFGAZCB-UHFFFAOYSA-N 386.666 5.039 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccc(F)cc2)cc1 918486689 KSGFCTJZPDSZDS-CKJXQJPGSA-N 380.463 5.180 30 20 GKED O=C(O)c1ccc(NN=C(CC23CC4CC(CC(C4)C2)C3)c2ccccc2)cn1 1776069197 WCEUBXSRFJQTJN-UHFFFAOYSA-N 389.499 5.203 30 20 GKED O=C(O)c1cc(C=NNc2ccc(Cl)c(C(F)(F)F)c2)sc1Cl 1776091096 UALZPPPSJCXCNO-UHFFFAOYSA-N 383.178 5.218 30 20 GKED C=C(Cl)C[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 1776142343 TWXFXWCYKMFLBR-MRXNPFEDSA-N 398.261 5.265 30 20 GKED C=CCCC[C@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 1776171108 OWLNMDYWGVBMAY-IBGZPJMESA-N 391.870 5.479 30 20 GKED CC(C)(C)Oc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776265490 KEQVFRASDLZQCK-CSKARUKUSA-N 398.455 5.812 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)cc1)c1ccccc1 1776469399 GPQUOWGJFGWYOL-UEXSTULGSA-N 398.458 5.821 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776697210 AHKYRSHICXPASI-SAAWKEMMSA-N 390.435 5.760 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)nn(-c2ccccc2C)c1C 1776783338 RBGBRKODCLHBLK-HXUWFJFHSA-N 385.552 5.091 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)C(=O)Nc2ccc(Cl)cc2)n1 21514954 IOFINVBGMLHJBX-SNVBAGLBSA-N 399.825 5.053 30 20 GKED CN(CCOc1ccccc1Cl)C(=O)c1ccccc1-c1ccccc1C#N 24391159 IEZXANUJBIIACH-UHFFFAOYSA-N 390.870 5.030 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccccc1C(C)(C)C 66861271 CBOWXNLHTXUNPK-INIZCTEOSA-N 381.545 5.429 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(OC(F)F)cc1 108238026 QSHHXEARCJEJBV-CQSZACIVSA-N 390.455 5.111 30 20 GKED C[C@@H](c1cc(F)ccc1F)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 108529434 MCJHBEIIZILQFS-KGLIPLIRSA-N 389.471 5.441 30 20 GKED N#C[C@@H](C(=O)c1coc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 113656863 NRINWORPUYDKNN-LBPRGKRZSA-N 380.375 5.325 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)Cc1cccc(OCC#N)c1 119899174 GVJKVPLSCGRQGC-UHFFFAOYSA-N 388.492 5.230 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12 119914551 SNSCWRSGXHSIMB-UHFFFAOYSA-N 397.409 5.196 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1c[nH]c2ccc(Cl)cc12 151831480 TVZUPDNORDCPEC-CYBMUJFWSA-N 383.904 5.254 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2/CCCC(C)(C)C2=O)cs1 159020705 LETPHIYUOQKLPU-KAMYIIQDSA-N 388.920 5.644 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 159299166 BFHWCOVPQWLEOU-LPHOPBHVSA-N 382.533 5.481 30 20 GKED N#CCC[C@H](NC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1)c1ccccc1 160560533 BQGZDFCUPQWCAE-REWPJTCUSA-N 386.499 5.450 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1 163900125 DFDUOMKTKGFNJG-PIGZYNQJSA-N 395.311 5.060 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(CCC(F)(F)F)cc1 176277789 XSZZGPQDUIBFJR-UHFFFAOYSA-N 389.421 5.496 30 20 GKED COc1cc([C@H](C)NCc2cc(C#N)cs2)ccc1OCc1ccccc1 177687356 YOPODVDZXIORRN-INIZCTEOSA-N 378.497 5.058 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c(F)c1 177861038 LZAGRTNHEBDEEM-GOSISDBHSA-N 381.451 5.127 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1occc1CSc1ccccc1 195711120 ANTITWVNZWGGKZ-UHFFFAOYSA-N 393.508 5.409 30 20 GKED N#Cc1cnc2ccc(OC(F)F)cc2c1N[C@@H]1CCO[C@@H](c2ccccc2)C1 302155022 DMXYPSIRTZILFU-OXQOHEQNSA-N 395.409 5.040 30 20 GKED C=CCCc1ccccc1NC(=O)CCSc1ccc2c(c1)OCCCO2 410369373 YLCUXOUHNJVYQM-UHFFFAOYSA-N 383.513 5.087 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c2[C@@H]1C 410978182 CMSLOSOOKURJJI-VXGBXAGGSA-N 394.525 5.076 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCc2cc(C#N)ccc21 416823068 XVZGDEBQOSPKLR-KXBFYZLASA-N 390.512 5.152 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(CSc2ccc(F)cc2)cc1)C1CC1 417466375 KCUZBNZVRRGKSM-HNNXBMFYSA-N 383.492 5.274 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(Cl)c1OCC(F)F 425669170 BDLOWDMPYLWZQR-LBPRGKRZSA-N 393.821 5.080 30 20 GKED CC(C)O[C@H](CSCC(=O)Nc1cc(Cl)ccc1C#N)c1ccccc1 427711604 AKLZPXIAKGXQKS-LJQANCHMSA-N 388.920 5.050 30 20 GKED Cc1nc(NC(=O)c2cccc(SCC#N)c2)sc1Cc1ccc(F)cc1 429878947 VOLFBQRYLHMCEF-UHFFFAOYSA-N 397.500 5.049 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)N[C@H](CCCC#N)c1ccccc1 431877363 HBARVPHBVVYQBB-NHCUHLMSSA-N 379.504 5.271 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](CC(F)(F)F)C3)cc2)c1 434148223 NZLLMFYJDSEQNB-HNNXBMFYSA-N 389.377 5.157 30 20 GKED C=CCc1cc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)cc(OC)c1O 436938890 LHCJVVCOASWZDG-FOWTUZBSSA-N 395.480 5.144 30 20 GKED COc1ccc([C@@H](C)CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 438048637 KCQOWLKKAWPMQA-DLBZAZTESA-N 397.544 5.405 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 439064200 KTHIPJQAESLQBC-OAQYLSRUSA-N 385.854 5.428 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)NCC2CCC(C#N)CC2)cc1 441001331 SMGVNZIXIKCRRR-LMDPOFIKSA-N 391.515 5.052 30 20 GKED C=CCN(Cc1ncc(-c2cccc(Br)c2)o1)Cc1cccs1 441247762 SXEHIKIHBOAQCZ-UHFFFAOYSA-N 389.318 5.354 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)c2ccccc21 444144089 SMYUQHXUXPAGRJ-UHFFFAOYSA-N 397.482 5.341 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)Cc1ccc(C(F)F)cc1 451014432 LPAPYEIEGMZLGH-UHFFFAOYSA-N 379.472 5.418 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC(c4ccccc4F)C3)c2)cc1 463754097 NRACGNXNOGSKOH-UHFFFAOYSA-N 387.414 5.121 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)C[C@H](c1ccccc1)C(F)(F)F 464957471 ZBYWILRFKZQHGZ-AQNXPRMDSA-N 386.417 5.021 30 20 GKED C=CCOCCCN[C@@H](C)c1sc(-c2ccccc2Br)nc1C 470765550 MJENQWWOWVVSMS-ZDUSSCGKSA-N 395.366 5.124 30 20 GKED C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)C[C@@H](CC#N)c1ccccc1 476307870 UGTBVPAOZHVQPO-GDBMZVCRSA-N 387.310 5.527 30 20 GKED CO[C@]1(C)CCCN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CC1 477863218 NIWZVAUMZQEDMW-JOCHJYFZSA-N 398.890 5.035 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]1C1CCC1 480256834 RXQFOTHLKRJFPV-JOCHJYFZSA-N 375.472 5.455 30 20 GKED CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1 480481827 OOCAJXCXNSAVEZ-OXQOHEQNSA-N 379.504 5.648 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nccc4ccccc34)cs2)c(C)c1 483205372 SUZZWYDKHAXRAP-LJQANCHMSA-N 383.476 5.465 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)no1 488583008 AEOGCVQGDUEFLN-KRWDZBQOSA-N 379.847 5.359 30 20 GKED N#CC1(CCCNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)CCOCC1 499737043 YNDJBPCMHDFEHT-UHFFFAOYSA-N 386.845 5.038 30 20 GKED Cc1cccc(OCCCCC(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c1 499807418 ASHMHNFZPDVAOF-SFHVURJKSA-N 391.298 5.232 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N[C@H](C#N)c2ccc(Cl)cc2)C1 501208865 LIBBNWKLZOOTGK-LSTHTHJFSA-N 376.928 5.177 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 503353387 OGMXMBFMGWSEHV-MAUKXSAKSA-N 382.435 5.023 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ccccn1)c1ccccc1OC 505011072 PPYZKWRVUSWZAG-HSZRJFAPSA-N 387.483 5.120 30 20 GKED CC(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)s1 512183056 TYCGFEZSRXBRBF-GFCCVEGCSA-N 386.542 5.287 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 515651163 UAZSNXLLOBXEEP-UHFFFAOYSA-N 384.479 5.707 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c2[C@H]1C 515795589 ITWFIEMNBGYYQH-KBPBESRZSA-N 388.496 5.015 30 20 GKED C[C@H](NC(=O)NCCSCc1cccc2ccccc12)c1ccc(C#N)cc1 516369832 RGKSKFMQEMHXQJ-KRWDZBQOSA-N 389.524 5.005 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)on1 517455329 BQGQKXVTMSVQEY-ZDUSSCGKSA-N 397.887 5.499 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)Nc1cccc(C#N)c1 518016789 SJLLLZVWXDXBCV-CYBMUJFWSA-N 396.903 5.526 30 20 GKED CC(C)[C@H](CC(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 518392124 BMTSNCBXGJOTGV-VNXZQDSDSA-N 390.527 5.194 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 518667694 IXAOOEAIHINADE-UTKZUKDTSA-N 398.597 5.835 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COC(C)C)cc1 520178592 QUIKDFUSRIWSNI-UHFFFAOYSA-N 379.504 5.173 30 20 GKED CC(C)c1ccc(CN(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 520332625 OETBLWNMVZOIQZ-UHFFFAOYSA-N 385.467 5.141 30 20 GKED CCOCc1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 521631853 WNFZRQKWPLNZPV-UHFFFAOYSA-N 390.414 5.278 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1cccc(Cl)c1Cl 521768314 CGTWNRJVLKTKSU-CYBMUJFWSA-N 396.636 5.262 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523586856 AOCHBBNLFGGXNL-FQEVSTJZSA-N 395.506 5.314 30 20 GKED Cc1cc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)ccc1OC(C)C 525076166 DAACVFVHHDTDRO-UHFFFAOYSA-N 390.439 5.078 30 20 GKED C[C@H](c1cccs1)N(CCC(=O)Nc1ccccc1C#N)Cc1ccccc1 532496227 SXRMNNVIBJCKEA-GOSISDBHSA-N 389.524 5.212 30 20 GKED CSc1cc(Br)ccc1CN[C@H](CCC#N)c1ccccc1 533037757 CABXTYANNADVMI-QGZVFWFLSA-N 375.335 5.306 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)cc1 533894524 BAEBUPVSKJCNPY-UHFFFAOYSA-N 397.356 5.211 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 536840594 RLRPNDBWMXBLQW-UTKZUKDTSA-N 375.541 5.738 30 20 GKED CCN(C(=O)c1cncc(-c2cccc(C)c2)c1)c1ccc(C#N)c(Cl)c1 538072810 RMKVNFWRKTWSAR-UHFFFAOYSA-N 375.859 5.249 30 20 GKED N#CCC1CCN(C(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 543834750 FAIWHZHHTLMRIL-JOCHJYFZSA-N 398.959 5.315 30 20 GKED COc1cc(C#N)ccc1NC(=O)[C@@H](Sc1ccccc1F)c1ccccc1 546709629 MDKHWUFUVXPIAX-NRFANRHFSA-N 392.455 5.178 30 20 GKED CC1(C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCC(=O)CC1 572816236 HXGWYRZTUCWJBS-UHFFFAOYSA-N 398.915 5.451 30 20 GKED N#C[C@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nc2ccccc2n1C(F)F 582936811 NBEGMPNDQZMRGK-QGZVFWFLSA-N 377.394 5.489 30 20 GKED N#CCCCCCC(=O)N(CCc1ccccc1)c1nc2ccccc2s1 588815936 ATODNWCOSWLSBM-UHFFFAOYSA-N 377.513 5.346 30 20 GKED C[C@@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)CCCCCC#N 588822642 VWALNHUERHELEY-KRWDZBQOSA-N 388.964 5.835 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)c1 589383669 CROKWLISIJKAAW-UHFFFAOYSA-N 396.487 5.009 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)C1 597923085 RHBLNNRTMIFRSB-INIZCTEOSA-N 384.932 5.398 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccccc2)cc1Cl 603673242 QKMTUBWSORIMFY-FQEVSTJZSA-N 376.843 5.013 30 20 GKED N#Cc1c(NC(=O)CCc2ccccc2F)sc2c1-c1ccccc1CC2 603992353 RYYDEYGBTMHFIC-UHFFFAOYSA-N 376.456 5.096 30 20 GKED Cc1ccc2oc(C(=O)Nc3cccc(C(=O)Nc4cccc(C#N)c4)c3)cc2c1 604181987 NOAAFNDAEAHNJY-UHFFFAOYSA-N 395.418 5.118 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 604352973 KVCVCAKMRBCXNW-HNNXBMFYSA-N 395.453 5.054 30 20 GKED CN(C(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1cccc(C#N)c1 604433529 CBOZTVCLSXAEPW-UHFFFAOYSA-N 376.843 5.067 30 20 GKED COc1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1Cc1ccccc1 609161945 YFQIBQFGBFGHAJ-UHFFFAOYSA-N 395.462 5.017 30 20 GKED N#CCn1c(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc2ccccc21 609215329 CHSPBTHLDWABNN-UHFFFAOYSA-N 377.753 5.089 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(F)cc2s1)c1ccc(Cl)c(Cl)c1 609463752 YMVFNPNBZQQLGW-CQSZACIVSA-N 379.243 5.342 30 20 GKED COc1cc(CSc2ccc(C)cn2)ccc1OCc1cccc(C#N)c1 609722027 WJWNBRRYCJOMLT-UHFFFAOYSA-N 376.481 5.142 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(CCc1ccc(F)cc1)C1CC1 609744561 QXSWHHQZOOOOPJ-INIZCTEOSA-N 397.519 5.459 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccnc2ccccc12 609907557 IWDBNZUOODYACC-MRXNPFEDSA-N 375.497 5.200 30 20 GKED Cc1ccccc1C1CC(N(C(=O)CSCc2ccc(C#N)cc2)C2CC2)C1 610193291 BTRDIXDPUDCJPJ-UHFFFAOYSA-N 390.552 5.037 30 20 GKED C[C@H](N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1cccc(C#N)c1 610830095 CYHFHUFHXCOANX-RYUDHWBXSA-N 382.357 5.173 30 20 GKED Cc1c[nH]cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 613344717 NTDCPZGVWRZOOV-GFCCVEGCSA-N 376.268 5.244 30 20 GKED Fc1cccc(-c2nc(CN3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)co2)c1 618453430 UPLNRFZDALXIJI-RYUDHWBXSA-N 396.306 5.043 30 20 GKED CC(C)c1ccsc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 619753836 UJHIHMMHLRNTTM-LBPRGKRZSA-N 394.443 5.990 30 20 GKED Cc1ccc(C)c(-n2ncc([C@@H](C)NCc3ccc(C#N)c(Cl)c3)c2C)c1 619755298 WDWXUWSOZCOFNM-MRXNPFEDSA-N 378.907 5.173 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1C[C@H]2CC[C@@H](C2)C1 667281891 XIRNLCOEEAQBOP-QWRGUYRKSA-N 398.322 5.240 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 728032390 JQINTYZQYHRUNI-UHFFFAOYSA-N 399.475 5.005 30 20 GKED O=C(/C=C/c1cccnc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 728697200 KFHJQHZONAONMX-ONEGZZNKSA-N 379.687 5.669 30 20 GKED C=CCN(C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C(C)C 730138588 GQVNRQULURNQNO-AWEZNQCLSA-N 377.941 5.439 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)/C=C\c2ccccc2C#N)cc1 732963616 PDLIZPAOWAMUMW-JUXNATCKSA-N 395.506 5.167 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccncc1 734654763 YESCWNVWYUHJNA-FGZHOGPDSA-N 391.902 5.441 30 20 GKED CCN(Cc1ccc(C)cc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740064011 IPDLXLXAFOIZQO-UHFFFAOYSA-N 389.524 5.327 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1cccc(-c2ccncc2)c1 741468124 CKFAGTCGLLFZQE-CMDGGOBGSA-N 386.451 5.907 30 20 GKED CC[C@@H](NCc1c(F)c(F)c(F)c(F)c1F)c1nc(C(F)(F)F)cs1 754500634 YNELKOURDQKPRY-ZCFIWIBFSA-N 390.299 5.098 30 20 GKED CCc1nc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cs1 754857566 PXWJEDUDMTVDPC-UHFFFAOYSA-N 383.904 5.422 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(F)c(C(F)(F)F)c2)S1 755403867 GSWAODDBRUOORF-OQLLNIDSSA-N 394.393 5.353 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3ccccc3o2)c(OCc2cccnc2)c1 766484081 KKWWKBSOLFBETE-LUAWRHEFSA-N 385.419 5.312 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)O[C@@H](C)c1nc2ccccc2n1C(F)F 767738068 DMZSSEZKODXYFY-BBRMVZONSA-N 381.423 5.007 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C[C@@H](O)c3ccc(Cl)cc3)cc2)c1 772667399 TYBRTAKZDBLLRO-OAQYLSRUSA-N 392.842 5.066 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cc(F)cc(C(F)(F)F)c2)S1 772808589 WNXRFHGWUFVLFT-NVNXTCNLSA-N 394.393 5.353 30 20 GKED C[C@H](NCC[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(OCC#N)cc1 776163209 QIEZEJAAMARHOH-CVEARBPZSA-N 376.422 5.452 30 20 GKED C=CC[C@@H](C(=O)OCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 778428044 PQYGPBLYNMMNIH-JOCHJYFZSA-N 385.463 5.195 30 20 GKED Cn1ncc(Cl)c1/C=C\C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 780187976 WSZVJGAUKLEADG-IHWYPQMZSA-N 382.691 5.007 30 20 GKED N#C[C@@H](C(=O)CCOc1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 780327516 BVTZBBLTLOCPFY-FQEVSTJZSA-N 399.475 5.004 30 20 GKED Cc1ccc(Cl)c(NC(=S)N[C@@H]2CCc3cc(C#N)ccc32)c1Cl 782449529 BPSLYIWTSLPLDC-OAHLLOKOSA-N 376.312 5.147 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2ncsc2-c2ccccc2)cc1 782620801 JODPXCOFRWLVEE-UHFFFAOYSA-N 392.480 5.072 30 20 GKED COc1ccc2nc(CNCc3cccc(-c4ccc(C#N)s4)c3)sc2c1 788964840 RSWCLODEPBFZPQ-UHFFFAOYSA-N 391.521 5.195 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(C(F)(F)F)cc2)cn1 792871185 GZQVEUHRPFWGKB-IZZDOVSWSA-N 384.357 5.067 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=C4CCCC45CCOCC5)c23)cc1 799873770 XHPIXQWXAUEPCC-UHFFFAOYSA-N 392.528 5.415 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1nc2ccccc2s1 802036114 PZPVESBLEMLDIZ-WFASDCNBSA-N 378.350 5.202 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 805877570 LDAQXFWJPHWSDJ-UGSOOPFHSA-N 389.455 5.039 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC=C(c3ccco3)C2)cc1 806201077 SYRSJDNYDHTBQO-JOCHJYFZSA-N 383.451 5.256 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCCC2(F)F)cc1 836270571 UQQBGPAIJGWXIZ-ICSRJNTNSA-N 383.442 5.289 30 20 GKED N#C[C@H](C(=O)COc1ccc(Cl)c2ccccc12)c1nc(C2CC2)cs1 842937048 BIDSTDQKFKKMAO-OAHLLOKOSA-N 382.872 5.082 30 20 GKED C[C@H](C#N)N(C(=O)c1ccc(CSc2nc3ccccc3s2)cc1)C1CC1 855583642 GCDYKZARPFVYAT-CQSZACIVSA-N 393.537 5.105 30 20 GKED CC(C)CN(C(=O)c1cccc(NC(=O)OC(C)(C)C)c1)c1ccc(C#N)cc1 914510609 PESLUBPKTDAWNQ-UHFFFAOYSA-N 393.487 5.208 30 20 GKED Oc1nc2ccccc2cc1/C=N\C1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914702726 KGCUDVAEADFBKW-SHKJOOTMSA-N 390.327 5.269 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCCSc1ccccc1F 915056972 AWLAPGJTUIFANE-UHFFFAOYSA-N 385.533 5.078 30 20 GKED O=C1/C(=C\c2cn(-c3ccccc3)nc2-c2cccnc2)CCc2ccccc21 916135685 HQLAWHFGRVMJKY-CYVLTUHYSA-N 377.447 5.147 30 20 GKED Cc1ccc(C=Nn2c(C)nc3scc(-c4ccc(Cl)cc4)c3c2=O)s1 916273359 YXDSLTVDLBEHHY-UHFFFAOYSA-N 399.928 5.339 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 917042180 DCOHCSXEVBCYIW-KXQLTZBTSA-N 390.361 5.344 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C\c1nc2ccccc2s1 917715199 WAQMUPNHPWWZJX-KHPPLWFESA-N 387.489 5.548 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CSC(F)(F)F)cc2Cl)cc1 917876781 QXLOCEMFVUZHLI-UHFFFAOYSA-N 386.782 5.195 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(-c2ccccc2)cc1 920105373 DHQDCTDAPRRSMA-OAQYLSRUSA-N 378.431 5.349 30 20 GKED CC(C)=C[C@@H]1[C@H](C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)C1(C)C 920804400 QEAHJUOHUYBLOK-VEVIJQCQSA-N 386.467 5.503 30 20 GKED CC(C)Oc1ccc([C@@H]2CCCC2=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033596 FKYQFOPOONNQNA-KRWDZBQOSA-N 386.879 5.561 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c(OC)c1 1776114162 HUKAABOGMKVCTK-YFHOEESVSA-N 394.448 5.027 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1F 1777353287 PKNSRATWLZLFGN-CLFYSBASSA-N 382.412 5.157 30 20 GKED COc1ccccc1Oc1ccc(/C=C\C(=O)c2ccc(CC(=O)O)cc2)cc1 1777388409 FWXAVPXRYBMKJP-GDNBJRDFSA-N 388.419 5.011 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-n2cccn2)cc1 32240224 UFHMVZCFVAOHSZ-UHFFFAOYSA-N 396.475 5.147 30 20 GKED Cc1ccccc1C(=O)/C(=C(/S)Nc1cccc2ccccc12)[n+]1ccccc1 55011415 XOCBLFIQYRLJFH-UHFFFAOYSA-O 397.523 5.487 30 20 GKED C=CCN(C(=O)COCCC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 65538482 NHHZGBALWHOSCX-UHFFFAOYSA-N 385.316 5.063 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(N2CCCCCC2)nc1 66800150 NWFNPZKNFUXQCO-KRWDZBQOSA-N 394.544 5.109 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1F 66955183 VPVNYBXSSCGVKO-ZIAGYGMSSA-N 387.480 5.111 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2[nH]c3ccccc3c2C1 66955466 GIWJEUKBJSKVNI-OAHLLOKOSA-N 390.512 5.152 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3sccc3C2)cc1 98028689 SHSJQZGMQWELHQ-UHFFFAOYSA-N 375.453 5.002 30 20 GKED C=C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)CC1 111194253 WXGMYUQIGXDOCX-ICFOKQHNSA-N 386.520 5.575 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 116503586 LYHVCZARLXEGHU-AREMUKBSSA-N 390.574 5.015 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1 120759515 RGDNLWOMCAQUPU-IBGZPJMESA-N 382.895 5.107 30 20 GKED Cc1coc(-c2ccc(C)c(NCc3cn(CCC#N)nc3-c3ccccc3)c2)n1 180887348 FUWOTJDEAPBZQV-UHFFFAOYSA-N 397.482 5.348 30 20 GKED COc1ccc(-c2csc(CN[C@@H](C)c3ccc(OCC#N)cc3)c2)cc1 181850188 RFZRTFGOWOGROL-INIZCTEOSA-N 378.497 5.177 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)Nc2ccccc2O[C@H](C)C#N)c1 182076064 RVYVVDRWVUTLPV-MRXNPFEDSA-N 380.513 5.573 30 20 GKED CCOc1c(Cl)cccc1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 191482352 OJJKOMHOKRAHFP-AWEZNQCLSA-N 388.920 5.172 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2cccc(-c3nccs3)c2)cc1OC 207851747 KBXDGXTYZZYMJW-NTMALXAHSA-N 392.480 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc([S@](C)=O)cc1 276396813 JRRJAWIQECUUOY-JWIGPWBQSA-N 384.545 5.159 30 20 GKED Cc1ccc(Cl)cc1N=C(O)[C@H](C)N[C@@H]1c2ccccc2CC12CCOCC2 329539590 WDCGXMIYODJXMO-HRAATJIYSA-N 398.934 5.309 30 20 GKED Cc1ccc(Cl)cc1N=C(O)[C@@H](C)N[C@@H]1c2ccccc2CC12CCOCC2 329539597 WDCGXMIYODJXMO-IIBYNOLFSA-N 398.934 5.309 30 20 GKED CC(=O)CC(C)(C)CC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 409520763 KVAALQVOBMUFCB-UHFFFAOYSA-N 398.890 5.125 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c2[C@H](C)C1 410994421 BABHRARUWUBALE-JGVFFNPUSA-N 385.436 5.033 30 20 GKED CC(C)(c1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1)C(F)(F)F 429695138 OCNCOMQAXUJQPF-GOSISDBHSA-N 389.421 5.693 30 20 GKED CCOc1ccc(-n2c(S[C@H]3CC[C@@H](C#N)C3)nnc2-c2ccccc2)cc1 430138980 ZXAURQMNMVAFHA-UZLBHIALSA-N 390.512 5.117 30 20 GKED COc1cc(C)ccc1-c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 432557851 MXLBFBOEJGZZNN-PKNBQFBNSA-N 384.439 5.092 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(-c2cccnc2)ccc1C 432788513 YKCDIHSBEAVEDL-UHFFFAOYSA-N 375.447 5.416 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(C)(F)F)cc1 433117884 PZFCGJQUTVXXPC-AWEZNQCLSA-N 389.471 5.372 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@H](CC(F)(F)F)C2)cc1 433743104 VNDYESQHWJRMIY-CQSZACIVSA-N 390.430 5.124 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 438860255 RYHOGMBLGLVZBD-CXAGYDPISA-N 376.287 5.399 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2Cc2nnc(-c3ccc(C#N)cc3)o2)cc1 441220503 AOKYJDOVCHKVGY-OAQYLSRUSA-N 386.499 5.243 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CCCCC4)c2)cs1 443815125 JDNVVOWZTWYIOK-UHFFFAOYSA-N 393.537 5.573 30 20 GKED N#CC(CCN1CCO[C@@H](c2cccs2)C1)(c1ccccc1)c1ccccc1 444655108 RCJSZKRREOCDLA-JOCHJYFZSA-N 388.536 5.021 30 20 GKED Cc1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)n([C@H]2C[C@H]3CC[C@H]2C3)n1 455068859 VLDKYBKAVBBELL-WJMWBRGCSA-N 391.519 5.109 30 20 GKED CC(C)n1nc(-c2ccco2)cc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 455339102 IWBOKTUMFDXWHV-SFHVURJKSA-N 391.475 5.281 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)o1 458794225 AOOKVLJYOQEVIZ-SFTDATJTSA-N 379.504 5.650 30 20 GKED C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458794662 BNZAVOHRPZJWSZ-ZPMCFJSWSA-N 379.479 5.353 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cccc(Cl)c2C1 459404766 RYORZUUSTUSGIG-CQSZACIVSA-N 385.920 5.324 30 20 GKED N#CC[C@H](CC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 474394559 ZCAXQKYGDFCCFT-VGOFRKELSA-N 392.549 5.371 30 20 GKED C=CCc1cc(C(=O)Nc2cc(-c3cccnc3)ccc2C)cc(OC)c1OC 477519396 AUIAONRLRJKUMS-UHFFFAOYSA-N 388.467 5.055 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 477755315 PCTINKZCBBQXDN-CWTRNNRKSA-N 380.385 5.263 30 20 GKED Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2SCC(C)C)c(C#N)c1C 484558308 AFLUIBRUIVILKO-UHFFFAOYSA-N 389.502 5.145 30 20 GKED C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487518893 YFQLJZOFIGSTHV-KUHUBIRLSA-N 391.298 5.312 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(F)c(C(F)(F)F)c1 498737632 RMTTVIVLCZFSNP-CQSZACIVSA-N 379.275 5.268 30 20 GKED C[C@H]1CCC[C@H](OCCCCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)C1 503956117 ROQVEBQGAQKPNL-RDPSFJRHSA-N 394.559 5.330 30 20 GKED COc1cc(C)sc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 504933835 YEHILVWGMIVWSQ-UHFFFAOYSA-N 392.480 5.077 30 20 GKED C[C@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccc(C#N)cc1 505311281 QDEVXBVGBNTDKG-SFHVURJKSA-N 385.467 5.158 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCC[C@H]3/C=C/c3ccccc3)o2)cc1 505359951 OTULENATGXMDLC-MAIVGLDJSA-N 398.462 5.048 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N[C@H](C#N)c2ccccc2Cl)cc1 505658377 HHLBYQRKGJVYIB-GOSISDBHSA-N 395.915 5.004 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F 510452059 OBBLNUIWXHDYAB-QGZVFWFLSA-N 398.375 5.482 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1cccc2cccnc12 518130741 XTZMDBMTQMQDLH-OAHLLOKOSA-N 393.537 5.360 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Br)ccc1F 518140095 OXDRAWCRZRLOFX-NSHDSACASA-N 393.281 5.092 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1cccc(Cl)c1Cl 518207911 ZHVVVOQVMIPHSG-LJQANCHMSA-N 398.293 5.302 30 20 GKED CCCn1c(S[C@@H](C)c2ccc(C#N)cc2)nc2cc(Cl)ccc2c1=O 522822557 DJHYFKFXEDWIBE-ZDUSSCGKSA-N 383.904 5.185 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1 525756675 ONHKFMMSOWUTTC-UONOGXRCSA-N 381.932 6.055 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)c1 537884085 IOYCEIGWNHFUSQ-IBGZPJMESA-N 382.419 5.384 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 543304915 SHDBEEUNZKXRSA-RBUKOAKNSA-N 393.556 5.719 30 20 GKED CCN(C(=O)CCCCC(=O)c1ccc(C)cc1)[C@H](C)c1ccc(C#N)cc1 545381253 SUJKSDFDUARKHL-LJQANCHMSA-N 376.500 5.220 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)c3ccc(C#N)c(Cl)c3)CC2)cc1 548281820 RJHSOKFNWSOMGM-UHFFFAOYSA-N 382.891 5.019 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc2n[nH]cc2c1 554193705 DXKBPXALUXPTKG-OAHLLOKOSA-N 397.438 5.110 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)[C@H](C)c1ccc(C#N)cc1 558764302 CYNLDSQFSGRFGC-QZTJIDSGSA-N 376.500 5.110 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCc2c(Br)cccc21)c1ccccc1 559861611 APGTYIZWZYNBNK-LEWJYISDSA-N 383.333 5.851 30 20 GKED C[C@@H](NCc1nc(C#N)cs1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 564413914 ARVVEMBWKSYLJS-LLVKDONJSA-N 393.459 5.613 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 572589868 ZMLOMZMKJFUGPS-QKLQHJQFSA-N 379.529 5.553 30 20 GKED CC(=O)c1ccc(C#N)cc1N1CCc2nc(-c3ccccc3Cl)sc2C1 577892194 HYMNSBSVPDJCCC-UHFFFAOYSA-N 393.899 5.100 30 20 GKED Cc1csc(Oc2ccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2F)n1 584508328 SBIZFOCZQJNBIS-UHFFFAOYSA-N 393.443 5.190 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)c1 589740944 LPYCRUDMAONQMH-IBGZPJMESA-N 393.512 5.620 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 590252685 INYOBUJGTSEKOW-OLZOCXBDSA-N 391.286 5.606 30 20 GKED CN(Cc1nc2ccccc2s1)c1c(C#N)cnc2c(F)ccc(Cl)c12 603842975 MRVWGTUJPODTFO-UHFFFAOYSA-N 382.851 5.145 30 20 GKED COc1ccc2nc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)ccc2c1 603968955 OSRGKNCSIFOGDV-UHFFFAOYSA-N 385.448 5.096 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 604913336 HKLOUWWSFVJFKT-QGZVFWFLSA-N 388.433 5.067 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3OC3CCC3)n2)cc1 605362542 JXNDGDBWBVSJHG-LJQANCHMSA-N 388.492 5.540 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cc3c(Cl)cccc3s2)c1 609068064 IMMZHFGLXGZOSJ-UHFFFAOYSA-N 378.787 5.280 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609377179 QKWMTMAWDUNZDA-OXJNMPFZSA-N 384.570 5.694 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc3[nH]ccc3c2)c1 609729452 BHJKWPVXOIIOAX-UHFFFAOYSA-N 387.826 5.738 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccco1 609929603 GEJXTXIUJVYGCS-FUHWJXTLSA-N 383.517 5.681 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)Nc1ccccc1S[C@H](C)CC#N 611205309 SVGWEHDOBZAUAB-GFCCVEGCSA-N 383.904 5.776 30 20 GKED COc1cc(CNCc2ccc(C#N)c(Cl)c2)ccc1OCc1cccs1 619749040 XYSBZIDPTVHUDG-UHFFFAOYSA-N 398.915 5.151 30 20 GKED N#C[C@@H](C(=O)c1cc2ccsc2[nH]1)c1nc(-c2c(F)cccc2F)cs1 620304229 JYYKTSJYKWQFJC-JTQLQIEISA-N 385.420 5.121 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)nn1-c1ccccc1 676458995 PQFBHDMMMWZRPD-IBGZPJMESA-N 380.451 5.034 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1sc(-c2ccccc2)nc1C(F)F 679326047 MBHCNUMQTGLEFD-UHFFFAOYSA-N 388.439 5.212 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1SCC(F)(F)F 679333307 UOODTNIBDARZGT-UHFFFAOYSA-N 384.423 5.197 30 20 GKED CC(C)(C)c1noc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)n1 728051891 PRSAEZCMPZBAOG-UHFFFAOYSA-N 396.878 5.083 30 20 GKED C/C(=C\C(=O)Nc1ccccc1SCCC#N)c1ccc(C(F)(F)F)cc1 730982544 SYXXBMDPKWONEL-BUHFOSPRSA-N 390.430 5.753 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1ccccc1SC[C@H](C)C#N 730995045 OEAXFLHHMXJPFU-GFCCVEGCSA-N 383.498 5.216 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(SC(F)F)cc1 730996219 WLYWRNBCIWRUOM-GFCCVEGCSA-N 378.469 5.505 30 20 GKED O=C(/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1c(Cl)nc2ccccn12 737448417 GPKUUZBCBCONRP-CLFYSBASSA-N 393.786 5.052 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(F)c(Br)c1 743058407 YOXOSCYBWNNOAG-BAQGIRSFSA-N 399.219 5.067 30 20 GKED CCOc1cccc(C=NOc2ccccc2C(F)(F)F)c1OC(F)F 754713062 YOTNFROPQCFVSY-UHFFFAOYSA-N 375.293 5.118 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 755754898 BXDUYNBOHIRGPU-DQMJNTIXSA-N 396.494 5.352 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2cccc(Br)c2)n1 761242104 YIFNXMPZHMKBNA-OAHLLOKOSA-N 391.334 5.228 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CCC[C@@H]2c2ccccc2)c1=S 764868746 ITJMMPDXIWYZAF-QGZVFWFLSA-N 382.558 5.123 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cn(C)c2ccccc12 772161770 MECQMJSYKKYOMX-MBSDFSHPSA-N 393.490 5.576 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 775148420 ZIWRWXNOBMCNLM-NRFANRHFSA-N 392.628 5.260 30 20 GKED C[C@H](Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1ccc(C#N)c(F)c1 777667620 RLJNFZCSIXIOHW-KRWDZBQOSA-N 399.469 5.002 30 20 GKED CCOc1ccc(NCc2cccc(OCCCC#N)c2)cc1Br 778187753 LZVKILBIXUKVFB-UHFFFAOYSA-N 389.293 5.142 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Br)cs2)cc1OC(F)F 782369654 NCMORFHUWWKIBC-RQOWECAXSA-N 389.217 5.017 30 20 GKED N#CCC1(COC(=O)c2ccccc2C(=O)c2ccc(Cl)c(Cl)c2)CC1 783391424 ZRRDLOXNWDZDGK-UHFFFAOYSA-N 388.250 5.075 30 20 GKED COc1cc(C(=O)Nc2ccc(Cl)c(C#N)c2)ccc1OCc1ccccc1 787092398 BREPIZFNHBEQBQ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21 789450687 FUQCIEAJDVEPEH-NRFANRHFSA-N 390.527 6.107 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792093296 WIJSWRZWBMMGKD-LJQANCHMSA-N 396.412 5.699 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CNc2ccc(-c3ccncc3)c(C)c2)cc1C 793892637 UQNQSGVQPLIIGF-UHFFFAOYSA-N 398.510 5.033 30 20 GKED Cc1c(C(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)sc2ccc(C#N)cc12 794452607 DKNWBZBKPBEPQO-LPHOPBHVSA-N 387.508 5.322 30 20 GKED CCN(C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 801657694 OSQXVPDTXVDLCL-UGSOOPFHSA-N 378.369 5.197 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 802708917 XUHVTBKSCQBQBY-GIIHOQTISA-N 395.505 5.188 30 20 GKED N#Cc1ccc(N(C(=O)c2ccc(C3SCCCS3)cc2)C2CCC2)cc1 857676690 HGEKHMJLKCNDHC-UHFFFAOYSA-N 394.565 5.626 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(F)c1Br 864006555 VOFFFYXLOSFFBX-LBPRGKRZSA-N 379.298 5.595 30 20 GKED C=C(Cl)CSCc1nc(O)c2c(-c3ccc(C)cc3)c(C)sc2n1 913396339 ZMNWZKGZFQVTBZ-UHFFFAOYSA-N 376.934 5.666 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1OC 915352029 FHRNAQPFRXNAFF-PKTZIBPZSA-N 399.494 5.623 30 20 GKED N#C[C@H](C(=O)CCC1CCCCC1)C(=O)Nc1ccc(SC(F)F)cc1 916883467 KVZNKSYNOWFDKX-MRXNPFEDSA-N 380.460 5.009 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCOc3cccc(C)c3C)n2)cc1 916974745 PDYABVGWHIGFMJ-IBGZPJMESA-N 390.508 5.381 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3ccc(F)cc3)n2)cc1 918489785 NPMRHMYKDMCGTK-KXBFYZLASA-N 378.472 5.628 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3ccc4ccccc4c3)n2)cc1 920141676 GXTCESAFAJHJJF-NRFANRHFSA-N 398.487 5.391 30 20 GKED O=C1/C(=C/c2ccc(OCc3ccc(Cl)cc3)cc2)CCc2nc(O)ccc21 1341569535 QSGAEVCDRNZVCE-GHRIWEEISA-N 391.854 5.232 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2ccc(O[C@H](C)C(=O)O)cc2)cc1 1776125995 ZBVJTQJDGSIWHJ-XYMPBJBSSA-N 382.456 5.004 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776473568 QXBWAUHCUGSAAV-OBHPCNEJSA-N 378.468 5.482 30 20 GKED CCOc1cccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)c1 1776937453 SOZROZBVNYDKGJ-KAMYIIQDSA-N 386.447 5.276 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cccc(Cl)c2F)cc1 32046489 IZCUHVQAIPZLMB-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N(C)Cc1ccc(C#N)cc1 42042418 QKOCRXXORRSPRC-UHFFFAOYSA-N 391.540 5.175 30 20 GKED Cc1ncc(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)o1 44844703 MKVDCPWTMJHLHE-UHFFFAOYSA-N 379.419 5.441 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 57683897 FSZLUMADVAUBHS-UHFFFAOYSA-N 388.492 5.009 30 20 GKED Cc1ccc(-c2ncc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)s2)c(C)c1 61139726 LUFOTCPPYSSAIW-UHFFFAOYSA-N 389.524 5.349 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC(C)(C)O1 65465885 CBKNOCSRDDZCKI-CQSZACIVSA-N 399.878 5.035 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]c4ncccc34)cc2Cl)cc1 65811896 ICHXGSVNBSBVLP-UHFFFAOYSA-N 388.814 5.133 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 66801916 JXTUGBXTDRQHAH-IRXDYDNUSA-N 382.529 5.297 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CC1 66954838 GFHDCEMCEHANBC-OAHLLOKOSA-N 383.492 5.416 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(F)c(F)c1 108242313 XUIUPDNFYYFRSX-UHFFFAOYSA-N 386.345 5.242 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 135760761 JFHOSTQKINNUEH-ARFHVFGLSA-N 377.579 5.076 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(Oc3ccccc3)o2)ccc1OC 180946112 GNOUSHMDGVPOJN-SFHVURJKSA-N 392.455 5.051 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@H]2NCc1ccc(C#N)s1 189908178 PVRGWQORKMNAOS-LJQANCHMSA-N 383.517 5.134 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccncc2C(F)(F)F)cc1 193065063 RZRKFTPXAGKOAX-UHFFFAOYSA-N 383.329 5.017 30 20 GKED COc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 193614725 RNMKYLRWUPFTKV-SCLBCKFNSA-N 396.899 5.452 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)c(C)n1[C@@H](C)c1ccccc1 195659014 KLCFEHBDCKBLBV-JXFKEZNVSA-N 382.467 5.081 30 20 GKED C=CCn1c(SCCCCC#N)nc2cc(-c3ccccc3)sc2c1=O 216518745 ADDAYQVQGSEKQP-UHFFFAOYSA-N 381.526 5.097 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3SCCC#N)c2cc1C(C)C 303283304 KSIDSLSHIWTVPB-UHFFFAOYSA-N 392.524 6.052 30 20 GKED N#CC1(/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CCN(Cc2ccccc2)CC1 329126289 YKPZUDZRTHBURT-BHDDXSALSA-N 379.548 5.108 30 20 GKED Cc1noc(C)c1C(C)(C)/N=C(/O)Cn1c(C2CCCCC2)nc2ccccc21 329297207 TXNCNBXSZKLJJM-UHFFFAOYSA-N 394.519 5.581 30 20 GKED COc1ccc2c(c1)[C@@H](/N=C(/O)C1CCCCC1)CCN2C(=O)C1CCCCC1 329540349 WNLAZNQOCRCYJL-NRFANRHFSA-N 398.547 5.590 30 20 GKED N#Cc1ccc(SCC(=O)Nc2c(F)cccc2Oc2ccccc2)cc1 410049124 MYJZYJUZDJXLEZ-UHFFFAOYSA-N 378.428 5.220 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cc(Cl)ccc2Oc2cccc(F)c2)CC1 421168110 WYRXWNUJRQUWFE-UHFFFAOYSA-N 387.842 5.429 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)Nc1ccc(C#N)cc1Cl 426151363 XBVNVMVWRSLMCK-UHFFFAOYSA-N 390.874 5.328 30 20 GKED CCCc1nc(C)c(CN(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)o1 428369818 LDGJNNLLXJUYSI-UHFFFAOYSA-N 377.463 5.149 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(OCc2cccc(Cl)c2)cc1C 432853527 PJIIDOPBTVJZTA-UHFFFAOYSA-N 383.879 5.161 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1 432962138 QMFCFTTZVCOIGJ-GOSISDBHSA-N 386.377 5.134 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 435358217 YOEFRSCTHAOCQI-UHFFFAOYSA-N 377.469 5.030 30 20 GKED COc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1F 436397904 BDCLWQDYDATJHA-HNNXBMFYSA-N 395.318 5.636 30 20 GKED N#CCC[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 439662105 PIUDPHGTDKHGLY-HSZRJFAPSA-N 381.435 5.125 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2C)c(C(F)(F)F)c1 440059759 GAPNMWGQFOKWKK-CYBMUJFWSA-N 392.446 6.028 30 20 GKED C[C@H]1CCC[C@@](C#N)(NC(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)C1 444021873 JEPOVDPAFUKTBJ-ORAYPTAESA-N 392.377 5.047 30 20 GKED CC(C)n1cc2cc(NC(=O)c3cn(CCCC#N)c4ccccc34)ccc2n1 444238942 BLCZCGONMYJKLZ-UHFFFAOYSA-N 385.471 5.128 30 20 GKED COCCN(C(=O)c1cc(-c2ccc(F)cc2)c(C)s1)c1ccc(C#N)cc1 446028818 NVJMUMPBHYERPS-UHFFFAOYSA-N 394.471 5.028 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(CC#N)cc1Cl 455725907 DNIDKIBAHDAPAG-QRWLVFNGSA-N 397.906 5.420 30 20 GKED CC[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 458396467 NYYJWBFFDWHZKL-CVEARBPZSA-N 375.925 5.587 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1 458806400 WDNAZERVNWHGDE-TZIWHRDSSA-N 381.907 5.274 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC=C(c2c(F)cccc2F)CC1)c1ccccc1 458856955 ZDAXYODBDQXWSJ-OAQYLSRUSA-N 395.453 5.199 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ncsc1C(C)C 463574177 ARWLUKOTGPHHIV-UHFFFAOYSA-N 377.469 5.491 30 20 GKED CCCN(C(=O)Nc1ncccc1OCCCC#N)[C@@H](CC)c1ccccc1 466594076 WVVWFBGEJAICGN-IBGZPJMESA-N 380.492 5.159 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 467758166 NGWYJIAYQUXCNC-OAHLLOKOSA-N 385.895 5.203 30 20 GKED CC(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 470357838 UQKVYTMNJUBRAK-QGZVFWFLSA-N 382.460 5.142 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1sccc1Br 475567345 WNCIRNPBBTXASD-UHFFFAOYSA-N 393.350 5.684 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(Br)cc1 476088041 DYSGNFSSFSPATL-OAHLLOKOSA-N 386.333 6.043 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3coc4cc(F)ccc34)n2)cc1 483451717 BNVDOQBUAFTHAW-MRXNPFEDSA-N 376.412 5.494 30 20 GKED N#Cc1ccc(SCC(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1 486130843 CQVMTUJJGOPSQB-UHFFFAOYSA-N 384.504 5.119 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 486242389 NZXRQVGXTMCPLX-UHFFFAOYSA-N 382.529 5.510 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3cc(C#N)ccc3Br)oc12 491834151 XJVJRWKSARJVMS-CYBMUJFWSA-N 399.288 5.316 30 20 GKED CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)Cc1ccc(C#N)cc1 501723606 DSSDVGLEVQPFRZ-UHFFFAOYSA-N 392.499 5.406 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)Nc2cccc(OCCCC#N)c2)c1 501849946 LFQWKBSNBFYYTC-UHFFFAOYSA-N 380.488 5.209 30 20 GKED CC(C)CN(C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc(C#N)cc1 502749904 PYFSMSIIMYTDAN-UHFFFAOYSA-N 397.450 5.263 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccnc(-c2ccccc2)c1 504151423 ORXLFXWFGIXIRB-GMAHTHKFSA-N 382.467 5.052 30 20 GKED C=CCCO[C@@H](C)c1nc([C@@H](Oc2ccc(Br)cc2)C(C)C)no1 508682038 VOJQORBOSGRDQR-BBRMVZONSA-N 395.297 5.262 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CCCCC1 510024147 SKBCZIFIRZPPHS-HXUWFJFHSA-N 381.907 5.792 30 20 GKED COc1ccc(C[C@H](Nc2ncc(C#N)cc2Cl)c2ccccc2)cc1OC 513630272 MTVRDUFTVQVNPD-IBGZPJMESA-N 393.874 5.020 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)o2)cc1 513654266 KIERCUNODRVDNT-MRXNPFEDSA-N 386.432 5.249 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)oc2c1ccc1ccccc12 513672755 UXKXVLDVFMOMLU-GOSISDBHSA-N 379.419 5.271 30 20 GKED CCN(c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1)C(C)C 517518048 PHUIUKJRJCZYPJ-QGZVFWFLSA-N 381.545 5.568 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H]2C[C@@H]2c2cccc3ccccc23)cc1 519456280 FUFCOCAWZGXTEI-RPWUZVMVSA-N 384.479 5.289 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600796 ONYZHOGSESLMRA-UHFFFAOYSA-N 393.393 5.293 30 20 GKED N#CCN(C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)c1ccccc1 522100532 LTIVLILHLGORBV-UHFFFAOYSA-N 394.805 5.744 30 20 GKED C=CCOc1ccc(CN[C@@H](Cc2ccc(C)cc2)c2ccccn2)cc1Cl 523736621 MTXNQWVHQUVSOR-QHCPKHFHSA-N 392.930 5.682 30 20 GKED Cc1cccnc1[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(C)C 524513901 DXJDMYUBRTVPNZ-HSZRJFAPSA-N 399.494 5.376 30 20 GKED N#CCCCOc1cccc(CNc2cccc(CSc3ccccn3)c2)c1 532888985 WEMBBCJOFPTIJX-UHFFFAOYSA-N 389.524 5.669 30 20 GKED N#CC1(CCCN[C@H](c2ccccc2)c2ccc3ccccc3c2)CCOCC1 540809711 UXGQFPVLFNGYIB-RUZDIDTESA-N 384.523 5.619 30 20 GKED N#Cc1ccc(CN(C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)C2CC2)cc1 543224556 CAJOYSLWGAZOOJ-QZTJIDSGSA-N 385.294 5.160 30 20 GKED CSCc1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 554213501 XOWNVOPYZNJYIV-OAHLLOKOSA-N 385.558 5.123 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC1CC1)c1nc(-c2ccc(Cl)cc2)cs1 554319517 FMLROIQQZKTDQL-KRWDZBQOSA-N 394.883 5.495 30 20 GKED C=CCC(C)(C)c1noc(C2CCN(c3noc4ccc(Cl)cc34)CC2)n1 556361204 GPEUYKNAMXTBTH-UHFFFAOYSA-N 386.883 5.102 30 20 GKED COc1cc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)ccc1SC 572924403 OWYWLUBLPYNJPD-UHFFFAOYSA-N 377.469 5.088 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)cn1)c1nc(-c2ccccc2)cs1 574119619 QPGSHXAWCYRMOK-LJQANCHMSA-N 397.459 5.487 30 20 GKED N#CC[C@H](Cc1nc(CCCOc2cccc3ccccc23)no1)c1ccccc1 589120961 NTSFZERLNFEEJT-OAQYLSRUSA-N 397.478 5.474 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589363611 KQWUAVDSLSEUOF-QHCPKHFHSA-N 398.466 5.287 30 20 GKED COc1cccc(C2(NC(=O)Nc3ccccc3SC[C@@H](C)C#N)CCC2)c1 596733447 GZKPQECAHCMLIL-INIZCTEOSA-N 395.528 5.148 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@H]21 599409101 GSUMEPSHWHDQHH-OXUBRWNRSA-N 382.916 5.259 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1cccc(OCCCC#N)c1 603972315 LRHCRQPRSNBSKY-SFHVURJKSA-N 380.488 5.207 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1csc(-c2ccccc2Cl)n1 608940744 DQNLQMFAGLBZSU-UHFFFAOYSA-N 397.887 5.375 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3cccc(Cl)c3)c2)cc1 609011154 DCGPLIOIKLQGHY-UHFFFAOYSA-N 390.870 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(Br)ccc1F 609431107 ROFVLLUGRALQCJ-LBPRGKRZSA-N 379.298 5.595 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 609636233 GZCNHCMYTPIJMD-FXAWDEMLSA-N 393.556 5.486 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(F)c2)cc1)c1cccc(C#N)c1 610321902 PJTYVUHCSUHHOP-OAHLLOKOSA-N 375.403 5.372 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(Br)cc2)s1 612593518 NIUQRVUIJYSLEW-AWEZNQCLSA-N 389.240 5.166 30 20 GKED CC(C)(C#N)c1ccc(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)cc1 614182256 JSWZBDPQBPKDJR-HXUWFJFHSA-N 388.433 5.080 30 20 GKED N#Cc1ccc(CNC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1Cl 619828230 PHUVWWKJMVAJKZ-UHFFFAOYSA-N 389.886 5.124 30 20 GKED FC(F)(F)c1cccc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 623585030 XQQKIOZRNMBNTI-HTQZYQBOSA-N 380.254 5.422 30 20 GKED Cc1ccc2nc(C)c(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2c1 642281365 CXWGSKSEEHFXMG-LJQANCHMSA-N 383.476 5.465 30 20 GKED Cc1c(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)sc2cccc(F)c12 674447906 ZNDOOUBKQICLHD-IUCAKERBSA-N 399.331 5.162 30 20 GKED C#CCOc1ccccc1[C@H](C)OC(=O)Cc1sc(C)nc1-c1cccs1 730424330 XJYXGZREKRRHHN-AWEZNQCLSA-N 397.521 5.039 30 20 GKED N#C[C@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)c1cccc(Cl)c1Cl 731195731 NJFBOEIIMXXMSU-AWEZNQCLSA-N 388.081 5.224 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2ccc(C(F)(F)F)nc2O)c1 731564396 CVNWSHNAKAFDBW-PKNBQFBNSA-N 383.369 5.678 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(C(C)(C)C)cc1 731978101 BSOBHRGQDZQGBY-UHFFFAOYSA-N 385.467 5.320 30 20 GKED Cc1ccc(Nc2nn(CN(CC#N)C3CCCC3)c(=S)s2)cc1Cl 738255885 CYCGGMJJWHSZGJ-UHFFFAOYSA-N 393.969 5.105 30 20 GKED CN1CCC[C@H](C/N=C\c2cc(Cl)cc(Cl)c2O)[C@@H]1c1cccs1 741464990 RWXGLYJGGYQAAO-FUDFMWBKSA-N 383.344 5.263 30 20 GKED Cc1ccc([C@H](C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 742630443 JMTJPBZOZKTCSV-HNNXBMFYSA-N 394.858 5.434 30 20 GKED CCCOc1ccc(C=NO[C@@H](C)c2ncc(-c3ccccc3)o2)cc1OC 748097966 URAYMQMQFSJOTB-INIZCTEOSA-N 380.444 5.251 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(N2CCCC2)cc1O 748245247 YRUKATOVDYMMNH-UHFFFAOYSA-N 399.709 5.184 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c(Cl)c1 752755710 XKCCAQIDEQKDNA-AWEZNQCLSA-N 393.796 5.252 30 20 GKED C#CC[C@@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1ccccc1 756777562 ZTMMYVSCDDHPKW-SJKOYZFVSA-N 378.697 5.223 30 20 GKED C[C@@H](ON=Cc1cccc(F)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 757616252 UMZACMUYBPEYOY-SNVBAGLBSA-N 380.206 5.294 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(CC3CCOCC3)no2)c1 761988831 FTOIIIMHOUNKFJ-UHFFFAOYSA-N 395.846 5.023 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cc(Br)ccc1F 763122241 OXYRSRVAZDOOEN-DUXPYHPUSA-N 394.290 5.669 30 20 GKED CC(=NOCc1nc(Cl)ccc1Cl)c1nc2ccccc2n1C(F)F 764935624 PGKQSZSCNXPCAA-UHFFFAOYSA-N 385.201 5.074 30 20 GKED CCOc1c(Cl)cc(NC(=O)Nc2ccccc2O[C@H](C)C#N)cc1Cl 768086843 RDDPUVDDXHLFKL-LLVKDONJSA-N 394.258 5.327 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl 768719972 KQYOKHFLTILQRZ-UHFFFAOYSA-N 393.915 5.137 30 20 GKED COc1cc(C(=O)/C=C\c2ncc(-c3ccccc3)s2)ccc1OC(F)F 770567449 TXAXZILZXXYNSD-NTMALXAHSA-N 387.407 5.316 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1nc2ccccc2n1C(F)F 771262794 YCAQNBRZUSYQEP-OAHLLOKOSA-N 399.828 5.284 30 20 GKED Cc1ccsc1CCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 774022985 LKBGCBOBMMHUEU-FQEVSTJZSA-N 375.497 5.076 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C2CCC(C(F)(F)F)CC2)cc1 774051021 HKUKSTJNEMUQHD-DVUZTRGUSA-N 394.437 5.216 30 20 GKED N#CCc1ccccc1CC(=O)Nc1cc(Cl)ccc1NCc1ccccc1 777417300 UOYZSJOMOJPTFL-UHFFFAOYSA-N 389.886 5.199 30 20 GKED COCc1ccc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 779596625 ZEFNEHQLYQGUAV-UHFFFAOYSA-N 382.847 5.142 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(SC2CCCC2)cc1 780479326 IZMRHCRCXKRNFU-HNNXBMFYSA-N 381.501 5.656 30 20 GKED Cc1csc(SCc2ccccc2C(=O)Nc2ccc(Cl)c(C#N)c2)n1 787109922 SIOWSPKTGQZALN-UHFFFAOYSA-N 399.928 5.521 30 20 GKED C=CCOc1ccc(CN[C@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)cc1 797008963 ZQERAYJJNNPPOJ-QFIPXVFZSA-N 394.515 5.376 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C\c2ccc3ccc(Cl)cc3n2)s1 797571475 RYCQLPMUOCDIHQ-QWGSZXSUSA-N 395.915 5.532 30 20 GKED COc1cc([C@H](C)Nc2nc(Cl)c(C#N)s2)ccc1OCc1ccccc1 804361188 IPFXIKJERPKZLZ-ZDUSSCGKSA-N 399.903 5.429 30 20 GKED COc1ccc([C@@H](Cc2ccccc2)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 810255063 VHKKELSHPXZAFV-UQBPGWFLSA-N 386.495 5.232 30 20 GKED CC(=NNc1nc2ccccc2cc1C)c1oc2cc(C)ccc2c1CC(=O)O 814896481 ZINUUILJHNDIRM-UHFFFAOYSA-N 387.439 5.061 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(C2SCCS2)c1 824017307 JTLYLEAVDBAAKK-CQSZACIVSA-N 383.542 5.262 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2cccc(Cl)c2)cc1 915180052 KPXICMLRJMMZIO-NRFANRHFSA-N 376.843 5.013 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917044435 RYDHIABNDRDHGY-OAHLLOKOSA-N 386.929 5.617 30 20 GKED COc1cc(Cl)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 921281253 OGVTZVZEZMTRKF-HXUWFJFHSA-N 376.843 5.256 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)c1 1776036804 WDSUIJKBIGTNKV-UHFFFAOYSA-N 375.211 5.398 30 20 GKED CC(C)(C#N)c1ccc(/C=C(\CCCC(=O)O)c2nc3ccccc3s2)cc1 1776230885 OMCTYHJGFDMQHV-SAPNQHFASA-N 390.508 5.893 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)c1)C(=O)O 1776470701 CVKGEHHWGLUIFS-UIJKISKDSA-N 398.764 5.107 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)s1 1777462958 TYDWUOZIRVBCRI-SREVYHEPSA-N 389.885 5.428 30 20 GKED O=C(O)/C=C/c1ccc(/C=C/C(=O)c2ccc(N3CCCCCC3)cc2)cc1 1777624133 QDWWZCSFKCUNIM-KAVGSWPWSA-N 375.468 5.061 30 20 GKED Cc1ccc(-c2nnc(SC[C@H](C#N)CCC#N)n2-c2ccc(C)cc2)cc1 7112246 OUSUJLNCPZYMJY-SFHVURJKSA-N 387.512 5.087 30 20 GKED Cc1occc1CN(C)C(=O)c1ccccc1SCc1ccc(C#N)cc1 55473734 DUYRKOVGDGHVPZ-UHFFFAOYSA-N 376.481 5.024 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccccc2)cs1)c1ccc(F)cc1F 96924443 SGSUIENACJEFBY-NTMALXAHSA-N 384.407 5.002 30 20 GKED CSc1cc(C(=O)Nc2cccc(OCCCC#N)c2)c(Cl)cc1Cl 124521589 XTYYYKFVMUEELX-UHFFFAOYSA-N 395.311 5.650 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2cccs2)CCCC1 127505761 URVKVYXKNMRFGR-UHFFFAOYSA-N 382.510 5.353 30 20 GKED C#CCOCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 164785584 YSGWHIJAQMZYMV-UHFFFAOYSA-N 378.497 5.124 30 20 GKED Cc1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(C(C)C)n1 172105698 LJAJRSAANACGDS-UHFFFAOYSA-N 386.455 5.133 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 176543137 NQHPITXGAQFYAB-QGZVFWFLSA-N 398.418 5.509 30 20 GKED N#Cc1cc(F)ccc1NC(=O)CCSc1ccnc2cc(Cl)ccc12 177584366 SWTFITMKRPLPET-UHFFFAOYSA-N 385.851 5.020 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(OCC#N)cc2)CCC3)cc1 180556868 QEURSBANRATOBM-HXUWFJFHSA-N 389.524 5.188 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H](CCC#N)c3ccccc3)s2)cc1 181576935 KHOSLBGTCFHYDR-HRAATJIYSA-N 391.540 5.823 30 20 GKED Cc1cc(Br)c2oc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cc2c1 187578152 DELYFJDWTAKTDC-GFCCVEGCSA-N 395.212 5.135 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)c1ccccn1 194345917 LJLLDKLKEAFFMH-GOSISDBHSA-N 383.838 5.440 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)[C@H](C)c1ccc(F)cc1 216752028 POGGYLXVYGWJBW-MRXNPFEDSA-N 392.430 5.093 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2F)cc1 237707776 UMVRRFLQNOIMFH-OAQYLSRUSA-N 395.275 5.339 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C1(C)C 276373269 NXFTWQJEKYARCX-IUODEOHRSA-N 385.455 5.133 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)CSc3ccc(C#N)cc3)ccc2C)c1 303951662 IMZPBJHUZGAVLG-UHFFFAOYSA-N 389.480 5.093 30 20 GKED O/C(=N/C1CCC(F)(F)CC1)C1CCN(c2noc3ccc(Cl)cc23)CC1 328932525 IIGYSJPMFRQXDJ-UHFFFAOYSA-N 397.853 5.232 30 20 GKED O/C(=N/C1CCC2(CC1)CC2)C1CCN(c2noc3ccc(Cl)cc23)CC1 329023665 UNSVWQWBDNHONX-UHFFFAOYSA-N 387.911 5.377 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@@H]3C[C@@]34CCOc3ccccc34)n2)s1 329642430 CUVAAHIVZVWQDA-VBKZILBWSA-N 397.525 5.212 30 20 GKED CSc1ccccc1[C@@H](C)NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 410083860 BNQVKFWFDTZFAQ-QGZVFWFLSA-N 381.545 5.209 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(C(=O)OC(C)(C)C)c1 410322112 GPNGLDOWSMSQCP-INIZCTEOSA-N 382.529 5.506 30 20 GKED CC[C@@H](CC(F)F)C(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410691471 VQCUXRNGKVSPLI-ZANVPECISA-N 391.302 5.449 30 20 GKED C[C@H](c1ccccc1)N(C(=O)c1cnc(C(F)(F)F)c(C#N)c1)C1CCCC1 425580355 JFPBERLGTHFXIY-CQSZACIVSA-N 387.405 5.118 30 20 GKED C=CCC[C@@H](Nc1cccc(NS(=O)(=O)Cc2ccccc2)c1)c1ccco1 426314919 RZAAZJCOROZXHY-OAQYLSRUSA-N 396.512 5.341 30 20 GKED C[C@@H]1[C@@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@@H]1c1ccccc1 430418787 YGLDFUCPJVWIFG-RIEVBORMSA-N 396.490 5.320 30 20 GKED CC(C)(c1ccc(C(=O)N[C@](C)(C#N)CCc2ccccc2)cc1)C(F)(F)F 433842447 ICZXKUYDJOABNM-NRFANRHFSA-N 388.433 5.171 30 20 GKED Fc1cc(F)cc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436400352 NNUWVFUXXKGDDI-OAHLLOKOSA-N 383.282 5.767 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C1CC1 437946702 KHJPSSVIMHNMCE-OAHLLOKOSA-N 393.462 5.071 30 20 GKED N#CC1CCC(CNC(=O)NCc2ccccc2-c2ccc(Cl)cc2)CC1 440986831 OETOCHNDVAWDIN-UHFFFAOYSA-N 381.907 5.136 30 20 GKED COc1ccc2c(c1)c(C(=O)NCC1CCC(C#N)CC1)c(C)n2C1CCCC1 441148851 UPHURXOGPPDSGW-UHFFFAOYSA-N 393.531 5.133 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)[C@@H](c2ccco2)C1 442054213 JFQGXSYTJXVZID-SWLSCSKDSA-N 393.365 5.055 30 20 GKED CCc1ccc([C@@H]2CCCCCN2CC(=O)Nc2ccccc2SCC#N)o1 444226341 SUFGHQDKKCEYML-IBGZPJMESA-N 397.544 5.013 30 20 GKED N#CCC[C@H](NC(=O)N1C[C@@H](c2ccccc2)c2ccccc21)c1ccccc1 445216123 NQXFOYYYGHHLRT-GOTSBHOMSA-N 381.479 5.393 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H]1CC12CCSCC2 448948910 GGVMEVPKIUASBI-FQEVSTJZSA-N 394.515 5.072 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(C#N)c1 463592931 SNZPBMZDNZCHSY-ZHRRBRCNSA-N 399.881 5.609 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@@]4(CCCCO4)[C@H]3C#N)o2)c1 468143515 HYSGFDQAYLFABQ-VWNXMTODSA-N 392.499 5.137 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 470414655 LKTBRVZXUSISLX-IRXDYDNUSA-N 384.545 5.127 30 20 GKED N#CC[C@H](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 474191957 JNCIPFQLIRTTOB-LJQANCHMSA-N 389.524 5.090 30 20 GKED C=CCN(C(=O)[C@@H]1CCSC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 475428441 KNLRJNLRTIFQEO-GFCCVEGCSA-N 399.368 5.389 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 476121305 GHOBVZOYTFCTHP-MOPGFXCFSA-N 387.445 6.300 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2cccc(F)c2F)nc1)c1ccccc1 477119191 HIUYNEQNQDROCL-MRXNPFEDSA-N 393.393 5.178 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Br)cc1CC 477973028 XHNTXJHWZOKFED-UHFFFAOYSA-N 398.304 5.103 30 20 GKED C=C(C)CN(C)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 479219873 RDXVPAWMNRSWML-AUPQCFOMSA-N 397.403 5.143 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccccn1 481366343 AHZQKPUSSKCPGG-CYBMUJFWSA-N 390.434 5.398 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](c1cccc(Cl)c1)c1ccccn1 481654470 VKFCNDSATOFPJD-LADGPHEKSA-N 387.914 5.753 30 20 GKED C[C@@H](NC(=O)CC1CC(OC(C)(C)C)C1)c1ccc(-c2cccc(C#N)c2)cc1 485951607 MJEKSFZQQXMRCG-IMHYJWESSA-N 390.527 5.386 30 20 GKED Cc1ccc(-c2nc(NC(=O)CSCc3ccc(C#N)cc3)sc2C)cc1 487704007 XLCHVYFPXSCKBR-UHFFFAOYSA-N 393.537 5.171 30 20 GKED COc1ccc(/C=C\c2ccc3ccc(Cl)cc3n2)cc1OCCCC#N 494111248 GQCBLPZRCKFSAZ-WTKPLQERSA-N 378.859 5.750 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c1 500236328 FYXGXSZSFUCPJP-UHFFFAOYSA-N 398.491 5.080 30 20 GKED N#CCCn1cc(CNCC2(c3ccccc3)CCCC2)c(-c2ccccc2)n1 500289565 RCKDKGZURPKPNS-UHFFFAOYSA-N 384.527 5.065 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2cc(Cl)ccc2F)nc2ccccc21 501409878 FCILSWOXTIYVJH-GFCCVEGCSA-N 389.883 5.134 30 20 GKED CCC[C@H]1C[C@@H](C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 503053658 AGDLFMTVOHBJBW-RXVVDRJESA-N 396.918 5.340 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(-c2ccc(F)cc2)n1 512566032 UKTQYBRBPVCGKE-UHFFFAOYSA-N 384.524 5.305 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)n1 513695401 DNCYMICAJYIEFR-GOSISDBHSA-N 398.940 5.887 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1Cl 515102610 CACPDLIKXSVWEY-UHFFFAOYSA-N 391.858 5.668 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1ccc(Cl)c(Cl)c1 518319968 FCCIGSRCULNXFE-ZQIUZPCESA-N 379.674 5.131 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)Nc3ccc([N+](=O)[O-])cc3C#N)s2)cc1 518594202 SKJSFZQPLHDPDV-ZDUSSCGKSA-N 378.457 5.380 30 20 GKED CCCC[C@@H](COC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 524079139 HYOPLBGMCIUPLG-ICSRJNTNSA-N 399.922 5.322 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 525631438 GLAGBIIBETXCBS-UHFFFAOYSA-N 398.285 5.005 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnn(C)c3-c3ccccc3)n2)cc1 537076074 QCMUURDKBGXVQU-SFHVURJKSA-N 398.491 5.009 30 20 GKED CCc1cccc(C)c1NC(=O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541087602 XQRZCQQEUOCLCB-IBGZPJMESA-N 397.522 5.385 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3ccccc3F)s2)CC1 548791461 KAQZSVQZIOOUHB-UHFFFAOYSA-N 377.488 5.007 30 20 GKED O=C(c1ccc(C#Cc2ccccc2)cc1)N1CCC(OC2CCCCC2)CC1 558506645 ADUSFMYJVULYGB-UHFFFAOYSA-N 387.523 5.040 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc2c1OCC[C@H]2OC 560038635 VKEFKQZPBQFGPN-MRXNPFEDSA-N 392.908 5.092 30 20 GKED C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1cccc(NC(=O)c2ccccc2)c1 564432503 SRZXPQWYWFIAEQ-XDHUDOTRSA-N 381.479 5.149 30 20 GKED N#CCc1cccc(-c2nc(C(F)(F)c3ccc(Cl)c(Cl)c3)no2)c1 573827234 CDZGBSSBQGSWPR-UHFFFAOYSA-N 380.181 5.250 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@H](C)[C@H](C)CC4)ccc12 574286687 ABFLQRDYWAXHEK-DGCLKSJQSA-N 391.496 5.120 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 583395766 MBEMPNXZIVDIQI-UHFFFAOYSA-N 395.487 5.494 30 20 GKED CSc1cccc([C@H](NC(=O)CCCCCC#N)c2ccc(F)c(F)c2)c1 588621175 LYUADLYODDYTMT-NRFANRHFSA-N 388.483 5.366 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(F)ccc1N1CCCCC1)c1ccccc1 590114921 LJSKBRGPLLBIEF-FQEVSTJZSA-N 394.494 5.373 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)Nc3ccc(C#N)c(Cl)c3)CC2)cc1 603827914 RBWFYHYRIFGSNH-UHFFFAOYSA-N 397.906 5.410 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cc4c(s3)-c3ccccc3CC4)[nH]c12 605363351 VMBCEUYROUOONN-KRWDZBQOSA-N 383.476 5.189 30 20 GKED Cn1ccc2c(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)cccc21 608877675 QERYSOYNFQMAPG-UHFFFAOYSA-N 395.462 5.076 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(F)c(F)c3)cc2Cl)c1 609062579 CFKXXJGOPJKAHY-UHFFFAOYSA-N 398.796 5.321 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609063796 LEMMCOLPFLZORV-QGZVFWFLSA-N 388.442 5.094 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 609094650 HQNHNBXYLKPWLU-QGZVFWFLSA-N 394.689 5.126 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc4ncccc34)cc2F)c1 609104077 NHLVPXFTXSTCEH-UHFFFAOYSA-N 397.409 5.077 30 20 GKED CSc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 609296927 JPUCDULDOVLBHW-UHFFFAOYSA-N 378.428 5.464 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(Cl)c(Cl)c1 609463530 CICXKXSPHMCKQT-MRXNPFEDSA-N 378.646 5.123 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1cccc(C#N)c1 610406875 GTKJEISVMUDIDO-SFHVURJKSA-N 387.458 5.170 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(-c2ccncc2)cc1 611095150 XLUUQWFGKAGNBQ-ZDUSSCGKSA-N 396.277 5.418 30 20 GKED Cc1ccc2nc(C)c(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc2c1 613403292 NELHGXSHOJTOHS-INIZCTEOSA-N 391.883 5.605 30 20 GKED CN(Cc1ccccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1 619020919 DJVDTDPELNOIPG-DEOSSOPVSA-N 396.494 5.004 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccc(C(F)F)cc1 622572136 YKCMSTZEPLJCAT-UHFFFAOYSA-N 381.247 5.497 30 20 GKED CCOc1ccc(OCC)c(NC(=S)N(CC(C)C)c2ccc(C#N)cc2)c1 726905345 PHVYSPJSBALVOF-UHFFFAOYSA-N 397.544 5.215 30 20 GKED C=CCOc1ccc([C@@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)cc1Cl 727463277 HFMOTTFZTAMODK-QGZVFWFLSA-N 396.796 5.034 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 728766683 GCDXPSCLDMWVBT-LPHOPBHVSA-N 390.508 5.497 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](Oc2ccc(Cl)cc2C)c2ccccc2)n1 730395792 XZAOFQVXXVIMMO-PXNSSMCTSA-N 396.899 5.410 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)c3ccccc3SCC#N)cc2)nc1 733279870 MAOWCNAFFHKICP-UHFFFAOYSA-N 375.453 5.050 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ncc(C(F)(F)F)cc2Cl)ccc1OC 733302432 UJHUTADXZOVRNC-CYBMUJFWSA-N 399.800 5.055 30 20 GKED CCC(CC)[C@@H](NC(=O)NCc1cccc(O[C@H](C#N)CC)c1)c1cccs1 733848013 KDSFBSOMFUPNCS-GHTZIAJQSA-N 399.560 5.406 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1ccccc1Oc1ccccc1)c1ccncc1 734665981 VOXLBJWSYKYHSI-XMSQKQJNSA-N 387.483 5.552 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N(Cc3cccs3)C3CC3)c2)s1 740483115 MUDHUMSPECTGEN-UHFFFAOYSA-N 393.537 5.222 30 20 GKED Cc1ccc([C@H](C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 742542057 CGUIQMXMGYYJCD-KXBFYZLASA-N 378.859 5.639 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)cc1 743056409 GKJAOVLYMGRNDK-WCIBSUBMSA-N 392.842 5.296 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@]34CCc3ccccc34)n2)cc1 744034343 GSEJQKHDWRNRSN-FPGHNAPASA-N 384.504 5.199 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1C(F)(F)F 744117892 DNQSAVOIIKCBFS-GWCFXTLKSA-N 392.377 5.434 30 20 GKED C[C@H](CCNC(=S)Nc1ccccc1C#N)c1cccc(C(F)(F)F)c1 746393091 JJIHXDUUMRRHSJ-CYBMUJFWSA-N 377.435 5.057 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3cc(F)ccc3F)cc2)oc1C(=O)O 757475308 RLPMITKHNTTYLT-RUDMXATFSA-N 398.361 5.040 30 20 GKED COc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1Cl 758408594 DROYCZSWUKVFHR-IBGZPJMESA-N 376.843 5.256 30 20 GKED Cc1coc(-c2cccc(NC(=O)c3cc(C)n(-c4ccc(C#N)cc4)c3C)c2)n1 758889481 TWNBMOOSBMCQMU-UHFFFAOYSA-N 396.450 5.182 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCC[C@H]1c1cccc(Cl)c1 770588353 KMGWBUFVTADLRL-SFHVURJKSA-N 387.842 5.141 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Cl)ccc2OC(F)F)c1 772983768 LRPCUJYFNXBIHV-CJNGLKHVSA-N 394.849 5.473 30 20 GKED Cc1ccc(F)c(NC(=S)NCc2ccc(-c3ccccc3C#N)cc2)c1 773159556 GIQNKSSDYJOZMA-UHFFFAOYSA-N 375.472 5.159 30 20 GKED N#C[C@@H](C(=O)C1(F)CCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 773983620 ZSQDUOWHUOSNPZ-LBPRGKRZSA-N 383.275 5.575 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(F)c2F)cc(Br)c1OC 776268926 WZTFLUYLTVXSJB-FPLPWBNLSA-N 397.215 5.031 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2nc(-c3ccccc3)cs2)cc1 776389251 JBAGUCBZTQICOS-UHFFFAOYSA-N 392.480 5.072 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)Nc3ccccc3O[C@@H](C)C#N)cn2)cc1 780495574 KLXDLNCMNZUSNH-INIZCTEOSA-N 388.427 5.117 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@H](C#N)c2nc3ccccc3s2)c1 789400003 QFEJTIZVRXEVIR-YJBOKZPZSA-N 378.497 5.455 30 20 GKED CC[C@H](C)[C@@H](OC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 796644687 XXRYCFDFOCHVQD-SIMVJXQJSA-N 397.327 5.354 30 20 GKED C=CC[C@H](OC(=O)C1CCN(C(=O)C(C)C)CC1)c1ccc(Cl)c(Cl)c1 797554827 YWJHSUSSIONXNN-SFHVURJKSA-N 398.330 5.048 30 20 GKED CC[C@@H](CC#N)OC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 802799871 MJTVCCIJRJFDQQ-NSHDSACASA-N 397.327 5.630 30 20 GKED CC(C)(O)c1cccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 806200522 GDENOQANBGOSHJ-QFIPXVFZSA-N 385.467 5.213 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)CC[C@@H]2c2ccccc2)c1 806806243 AGKBBLJJQNNTIK-JMUQELJHSA-N 391.515 5.050 30 20 GKED N#C[C@H](C(=O)COc1ccccc1-c1ccccc1)c1cc(C(F)(F)F)ccn1 813211749 PMMQROSLUHMHHT-SFHVURJKSA-N 396.368 5.023 30 20 GKED N#C[C@H](C(=O)CSc1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813218154 MLFNTZZXMVOGIZ-KRWDZBQOSA-N 386.398 5.222 30 20 GKED N#Cc1cccc(/C=C(/Cl)c2nc(O)c3cc(-c4ccccc4)sc3n2)c1 834779647 POYYOEDEJPUFMK-LICLKQGHSA-N 389.867 5.672 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)Nc1cccc(C2SCCS2)c1 841596608 PAQIOYNQTFHJFX-LJQANCHMSA-N 395.553 5.236 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1NC(=O)OC(C)(C)C 842942423 YORXECUCELUPRC-HNNXBMFYSA-N 397.500 5.166 30 20 GKED Cc1c(CN(C)C(=O)Nc2ccccc2O[C@H](C)C#N)oc2c(C)cccc12 844612056 PCJNCYWIULNITC-OAHLLOKOSA-N 377.444 5.004 30 20 GKED Cc1cc(CNc2cc(C(=O)N(C)c3ccccc3)ccc2Cl)ccc1C#N 864006293 HBRBAPHFGNVCRP-UHFFFAOYSA-N 389.886 5.409 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC1CCC(F)(F)CC1 901737041 KEOYNTHRIWLNTI-CYBMUJFWSA-N 384.517 5.330 30 20 GKED N#Cc1ccccc1NC(=S)N[C@H](c1ccc(F)cc1)c1ccccc1Cl 916029349 BICNUSRNJRJJKY-HXUWFJFHSA-N 395.890 5.427 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2cc(F)ccc2s1 916903700 QQRNMSPMGILPJZ-QGZVFWFLSA-N 394.471 5.126 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2)CCCC1)c1nc2cc(Cl)ccc2s1 917047244 UTEFOXGMVMLDTE-INIZCTEOSA-N 380.900 5.638 30 20 GKED O=C1/C(=C\c2csc(-c3ccc(C(F)(F)F)cc3)n2)Cc2c(O)cccc21 918714322 ZVDIXLGUXHGACK-WQLSENKSSA-N 387.382 5.357 30 20 GKED Cn1cc(C=NNc2ccc(Br)cc2)c(-c2cc3ccccc3o2)n1 920375235 ISKNMOZROKJTGL-UHFFFAOYSA-N 395.260 5.042 30 20 GKED CCc1c(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)oc2ccc(C)cc12 1776956383 YPQBYRZFPORWTL-KHPPLWFESA-N 399.446 5.755 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3occc3C)CCC2)cc1 1789453673 FDFVMIYYKUFQMW-FQEVSTJZSA-N 392.499 5.104 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2ccccc2SC)nc2ccccc21 12046032 YGNMQUYUMWSZMH-CQSZACIVSA-N 383.542 5.064 30 20 GKED CC(C)c1ccc([C@H](NCC(=O)Nc2cccc(C#N)c2)c2cccs2)cc1 15362172 HBLYDFSYFDTEAT-QHCPKHFHSA-N 389.524 5.061 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@@H]2CCCC[C@H]2C)cc1 27490297 UWPDYYMUDLRZIR-WIYYLYMNSA-O 395.592 5.006 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)cs2)cc1 41554339 WICPYWKWEMZHMV-CQSZACIVSA-N 387.386 5.022 30 20 GKED N#CC1(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)CCCCC1 72029782 SZJWIOPYFOJMEH-UHFFFAOYSA-N 380.300 5.529 30 20 GKED COc1ccc(CNC2(c3ccc(F)cc3)CCCC2)cc1OCCCC#N 102426778 ANWZCLSBKGWEDK-UHFFFAOYSA-N 382.479 5.076 30 20 GKED Cc1cc(C(=O)CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)s1 108324330 ZPTMDPUNIUQUMN-ZDUSSCGKSA-N 386.542 5.218 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2csc(-c3ccc(OC(C)C)cc3)n2)c1 112531598 DXGTVNPRWNXJRN-UHFFFAOYSA-N 390.508 5.245 30 20 GKED CN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1nc2ccccc2s1 114635502 ZYLLKLCYXBYETA-UHFFFAOYSA-N 399.475 5.024 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 120038740 BQUIHQWZXOLFGO-HNNXBMFYSA-N 397.887 5.034 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)N(CCC#N)Cc1ccco1)c1ccccc1 124988164 ZXYXBDVQWPPOBB-GOSISDBHSA-N 389.455 5.367 30 20 GKED C=CCOc1ccccc1CNc1cccc(C[S@@](=O)Cc2ccccc2)c1 133114275 JBADWKWULOWULS-MUUNZHRXSA-N 391.536 5.312 30 20 GKED CC[C@@H](C)N/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1ccc(C)cc1 154484026 JPJBUSUZFJPZOH-OAHLLOKOSA-O 397.589 5.133 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1 174508505 DKGWECUBBHAGIL-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1ccc(CCCC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)s1 176026225 UFZLBQJRRYABRO-SFHVURJKSA-N 391.521 5.251 30 20 GKED C[C@H](NCc1ccc(CO)c(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 178561161 KKUUDANJZYVPFH-JTQLQIEISA-N 395.318 5.206 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)c1 180090790 ZWACDJNOCBLCBW-GHTZIAJQSA-N 377.488 5.435 30 20 GKED N#CCC[C@@H](NC(=O)N(CCC(F)(F)F)Cc1ccccc1)c1ccccc1 189638433 ANDXOVAGMFVCCB-LJQANCHMSA-N 389.421 5.196 30 20 GKED CCCCOc1ccc(C=NO[C@H](C)c2nnc(-c3ccccc3)o2)cc1OC 255362864 TVLHFOIPSOYNSF-MRXNPFEDSA-N 395.459 5.036 30 20 GKED CC(C)n1ncc2ccc(N=C(O)N3CC[C@@H](C(F)(F)F)C4(CCC4)C3)cc21 328705865 YUXVPPTZAGONJG-QGZVFWFLSA-N 394.441 5.217 30 20 GKED OC1=N[C@H](/C(O)=N/C2(c3noc(C4CCCC4)n3)CCCCCC2)CCCC1 329875497 GQRZNUBOVYZVIE-INIZCTEOSA-N 388.512 5.132 30 20 GKED OC(=Nc1ccccc1)N1CCC(/C(O)=N/C2CCC3(CCCCC3)CC2)CC1 329894116 BDOPNZDTVHBMGF-UHFFFAOYSA-N 397.563 5.794 30 20 GKED CCN(C(=O)c1cccc(SCC#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 429958414 OLQCXQLOYWFVMA-CQSZACIVSA-N 392.446 5.544 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)c(Cl)c1 430363907 AKXKQUWQGUGDGT-UHFFFAOYSA-N 388.279 5.170 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430626992 LOHOULGDDIZJIN-OAHLLOKOSA-N 379.485 5.203 30 20 GKED Cc1csc(Nc2ccc(NC(=O)c3cccc(SCC#N)c3)cc2)n1 431023876 NMFFNAPCDGXYJO-UHFFFAOYSA-N 380.498 5.063 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H]1c1ccc(Br)c(C)c1 431130318 UMMGSAJMVGZXDH-LJQANCHMSA-N 394.353 5.184 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 438226029 OPXNBNNFXKKJOZ-INIZCTEOSA-N 383.517 5.346 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)NCc1cc(C#N)ccc1F 438259903 NQSGGOGUTUHWFF-UHFFFAOYSA-N 377.872 5.173 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cc(Cl)c(Cl)cc2F)C2CC2)cc1 439965479 PXWNHHOPSDLBRK-UHFFFAOYSA-N 378.234 5.201 30 20 GKED Cc1ccc(NCC#Cc2ccc(C(F)(F)F)cc2)cc1NC(=O)C(C)(C)C 443540410 LAKUYISKWOZOHR-UHFFFAOYSA-N 388.433 5.462 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 443918777 LWFQAXQRBXALJJ-UHFFFAOYSA-N 381.863 5.168 30 20 GKED C[C@H](C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1)c1cccc(C#N)c1 461796103 NJZQWBGEHBFRIO-INIZCTEOSA-N 397.503 5.501 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@]1(C)CCc2ccccc2C1 463102718 FQGQYCFCNMKTGP-VWLOTQADSA-N 397.478 5.188 30 20 GKED CCN(C(=O)c1c(F)cc(C(F)(F)F)cc1F)[C@H](C)c1ccc(C#N)cc1 463303992 BLTORKMIDRYBQD-LLVKDONJSA-N 382.332 5.079 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(-c2ccccc2Cl)o1 464944233 WQGOAHRYGBFDAF-AZUAARDMSA-N 390.870 5.512 30 20 GKED N#CCCn1cc(CN[C@@H]2CC[C@@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 475575270 ZOCUHTSZTLCMIW-NFBKMPQASA-N 388.490 5.029 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)N2CCC[C@H]2/C=C\c2ccccc2)c1 475808222 JBTHMKQNRCFWBW-GJCOWUBNSA-N 398.462 5.048 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cnn(CC(C)C)c1C(C)C)c1ccc(F)c(F)c1 480951079 IFYUVVDEUNPXSH-IBGZPJMESA-N 390.478 5.380 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(Oc2ccc(F)cc2)nc1 481917305 FJJYGABWLNMJBG-HSZRJFAPSA-N 387.458 5.442 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N[C@H](CCCC#N)c1ccccc1 487565686 LTRXDEARJHLDTA-QGZVFWFLSA-N 397.544 5.206 30 20 GKED C=CC[C@H](C(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 487654633 KTDXBDLJLIEWLD-IBGZPJMESA-N 376.525 5.362 30 20 GKED CC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1OC(F)F 502644797 SYOPQACQICXFDS-KRWDZBQOSA-N 387.430 5.362 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 502798127 ZBXCKDHEYDJCOU-UHFFFAOYSA-N 383.473 5.150 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(SCc2csc(C)n2)cc1 503108475 SJICEKSGGYXHGA-UHFFFAOYSA-N 394.565 5.572 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)sc2ccc(F)cc12 504012395 DKDQOXMUYJEHRN-UHFFFAOYSA-N 376.456 5.150 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CC=C(c3ccccc3Cl)CC2)c1 509812655 CVCFHDVFTHOEDR-UHFFFAOYSA-N 394.902 5.077 30 20 GKED O=C(Nc1cc(F)c(F)c(F)c1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 510049251 LFIVTIIEPUYVES-ZDUSSCGKSA-N 380.263 5.058 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 513200720 KPYHDPLEWKZNRU-KRWDZBQOSA-N 385.467 5.352 30 20 GKED CC[C@@H]1C[C@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 514121124 RZDPXGOXGABJET-IFMALSPDSA-N 394.490 5.134 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccc(F)c(F)c1 514193590 RHIZSVUJSGHGJK-KZULUSFZSA-N 389.446 5.590 30 20 GKED Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)ccc1F 517461060 NAGDOCKEAKGLBD-UHFFFAOYSA-N 382.382 5.411 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 518259326 ITFSGLYRMRBBQO-LPHOPBHVSA-N 397.519 5.459 30 20 GKED C=C1CCN(C(=O)c2oc3ccccc3c2COc2ccccc2Cl)CC1 518658950 KGIFJGPHSIEDLN-UHFFFAOYSA-N 381.859 5.457 30 20 GKED Cc1csc(CCCCNCc2cccc(OCc3ccccc3C#N)c2)n1 518784302 GGSYAKNYTNVPHK-UHFFFAOYSA-N 391.540 5.015 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1OC(F)F 522290110 KSUARGUEFSVBRN-LBPRGKRZSA-N 391.443 5.492 30 20 GKED C[C@@H](C#N)CNC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 525059755 LZBNZOMWZIAASC-LBPRGKRZSA-N 379.312 5.175 30 20 GKED Cc1c(Cl)cccc1-n1c(SCCC(C)(C)C#N)nnc1-c1ccncc1 525503960 QOGHMNNQTWDYJP-UHFFFAOYSA-N 397.935 5.323 30 20 GKED Cc1cc(CN(C(=O)c2cc(C#N)cs2)C2CCCC2)c2ccccc2n1 530979915 VDRPVNHUBYGESV-UHFFFAOYSA-N 375.497 5.061 30 20 GKED CN(C(=O)c1sccc1C#N)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 538438206 SEADSDYVVXPLQQ-HZPDHXFCSA-N 378.419 5.047 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccc(Br)s1)c1ccccc1 541367147 HSKONZXZGCDPGP-GDBMZVCRSA-N 390.346 5.534 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)c3ccc(Cl)c(C#N)c3)CC2)cc1 541611096 SCCYFXSHRWXNPI-UHFFFAOYSA-N 382.891 5.019 30 20 GKED Cc1ccccc1-c1nc(CSc2ccc(C#N)c(C(F)(F)F)c2)no1 542003991 XMYQMZSSFJDJRZ-UHFFFAOYSA-N 375.375 5.228 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCc1cccc(Cl)c1 553404012 KMIQJDGSRUJMKZ-OAHLLOKOSA-N 387.936 5.346 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCn3c(cc4ccccc43)C2)c1 554188167 MCIZKBKHHRGZTO-UHFFFAOYSA-N 375.472 5.034 30 20 GKED Cc1cnc([C@H](C)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)o1 560769110 VSZQNBLUIZCRNH-ZDUSSCGKSA-N 387.361 5.839 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)ccc1OC1CCCC1 570619056 JZEXPMOTCYBKEF-FQEVSTJZSA-N 386.451 5.055 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cc(C(F)F)ccc2Cl)c(OC)c1 581394452 KVYLAGPDZIQVIG-UHFFFAOYSA-N 381.806 5.032 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)c2sc3cccc(F)c3c2COC)cc1 584814940 CJOXFIVBHGOFSN-SFHVURJKSA-N 396.487 5.086 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1F 595689907 FOWFMBXVJRTJMD-KSFYIVLOSA-N 399.535 5.003 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3CC(F)(F)C4)cc2)c1 599736164 BSONNZVSFUSXFJ-IRXDYDNUSA-N 383.398 5.145 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NCc5ccc(C#N)cc5)(C4)C2)C3)cc1 603510408 SAMYVXRVAYLLNT-URFUVCHWSA-N 384.523 5.021 30 20 GKED CCOc1ccc([C@@H](NC(=O)Nc2ccc(CC#N)cc2)C(C)C)cc1OCC 603650707 BHBNHVPKSWBSQF-QFIPXVFZSA-N 395.503 5.069 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)Nc3sc(CC)cc3C#N)s2)cc1 604028857 WHFFTYGLAXHGRW-UHFFFAOYSA-N 397.525 5.265 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)oc2c(C)cccc12 604335998 ZLRKBGZHFIGCQF-UHFFFAOYSA-N 383.407 5.361 30 20 GKED CC1(c2ccccc2)C/C(=C\c2cncs2)C(=O)/C(=C/c2cncs2)C1 606442418 HPJGEXVGRSDPLK-BGPOSVGRSA-N 378.522 5.387 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 608918840 YXAMSCKUVWJXMM-NRFANRHFSA-N 381.495 5.405 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)cc2)n1 609177388 RTFDJAMQOZNYDV-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)on1 609427860 XTJLIRWZRJJCBC-ZDUSSCGKSA-N 397.887 5.642 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609497243 VURUEXOPHFGUHQ-UHFFFAOYSA-N 384.479 6.229 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@@H]1C 610019310 LWKLLRJLCSDVNE-GJZGRUSLSA-N 383.492 5.229 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 610355282 NBZAHYVRFMNIBD-VLIAUNLRSA-N 395.915 5.423 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 610357345 KZNPIVOTLXPQRQ-ZHRRBRCNSA-N 389.886 5.361 30 20 GKED Cc1cc(C)c(NC(=O)CCCN2CCC[C@H]2[C@@H](C#N)c2ccccc2)c(C)c1 610844138 BTEBTLSIAUYOKH-GOTSBHOMSA-N 389.543 5.102 30 20 GKED Cc1ccc(Oc2cc(-c3noc(CNc4ccc(C#N)cc4)n3)ccn2)cc1C 612906020 QEDCKPDLJODYPM-UHFFFAOYSA-N 397.438 5.025 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H]3CCCc4sccc43)cn2)c1 613460852 IKIJQFDPWDWMSS-SFHVURJKSA-N 390.468 5.006 30 20 GKED C=CC[C@H]1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)C1 617782890 OKETYZIHQIGDRH-ZDUSSCGKSA-N 392.286 5.004 30 20 GKED Cc1ccc(C)c(-n2ncc([C@H](C)NCc3ccc(C#N)c(Cl)c3)c2C)c1 619755297 WDWXUWSOZCOFNM-INIZCTEOSA-N 378.907 5.173 30 20 GKED CC(C)OCCCC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494463 RWQZEZHWMYPNKD-UHFFFAOYSA-N 389.311 5.120 30 20 GKED Fc1ccc(-c2noc([C@@H](C[C@@H]3CCCO3)C(F)(F)F)n2)c(C(F)(F)F)c1 650219309 AAMBFFGRJMTUFX-JOYOIKCWSA-N 398.278 5.110 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](COC)c1cccc(OC)c1 666866019 GFRBHVBBVKYHHA-NRFANRHFSA-N 382.504 5.056 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1)c1ccccc1 674869410 GIHJPCZUKJWSCM-UHFFFAOYSA-N 397.931 5.674 30 20 GKED C=CCOc1ccc(/C=C/C(=O)O[C@@H](C)c2cnc3ccccc3c2)cc1OC 726333467 YFPBFSRDDVONEF-JICACKBISA-N 389.451 5.126 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@@H]1CCCN1c1ccc(C#N)cc1 728168712 ZGYUXCDMRFKNOV-NRFANRHFSA-N 393.556 5.365 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccncc1 734657736 LERKSAUBLRUPGC-MGPUTAFESA-N 392.528 5.191 30 20 GKED CC(C)CN(CCC#N)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 735039001 IRXYYCHCGQLYOG-UHFFFAOYSA-N 381.863 5.016 30 20 GKED C[C@@H](C#N)Oc1ccc(C=NNc2nc3cc(C(F)(F)F)ccc3s2)cc1 743444422 MRVWFUOYQVCSKI-NSHDSACASA-N 390.390 5.052 30 20 GKED Cc1cccc2c(CCC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c12 744034551 BEDVWCDTDQNYMA-MRXNPFEDSA-N 393.899 5.549 30 20 GKED C=CCCC(=O)O[C@@H](C)c1sc(-c2ccccc2Br)nc1C 744320053 NICWTCRAIDYOTA-LBPRGKRZSA-N 380.307 5.451 30 20 GKED CCO[C@H](C)c1ncc(C(=O)OCc2ccc(-c3ccccc3C#N)cc2)s1 745445895 CEMXLTVPLGYRFK-OAHLLOKOSA-N 392.480 5.136 30 20 GKED COc1cc(C(C)=NNc2ncc(Cl)cc2Cl)ccc1SC(F)F 746485606 MSOMWYOHXSWGKF-UHFFFAOYSA-N 392.258 5.548 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(CC)Cc1ccc(C(F)(F)F)cc1 746670661 GLIIOEZXODJRJM-UHFFFAOYSA-N 391.393 5.030 30 20 GKED N#C[C@H](C(=O)CCn1ccc2cc(Cl)ccc21)c1nc2cc(F)ccc2s1 759329953 SJVWUCOOTKGWGH-OAHLLOKOSA-N 397.862 5.310 30 20 GKED Cc1cc(CSc2ccccc2C(=O)O[C@H](C)c2cccc(C#N)c2)on1 764616145 ZNQNWIVVTCOMGR-OAHLLOKOSA-N 378.453 5.065 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2c(C)oc3ccccc23)cc1 767958467 FWJJDEFUFGXZJN-VFNWGFHPSA-N 388.467 5.145 30 20 GKED C=CC[C@@H](NCc1cn(-c2ccccc2Cl)nc1C(C)(C)C)c1ccncc1 776185302 GWBKIGZKNMCFFX-HXUWFJFHSA-N 394.950 5.625 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccccc2Br)cc1 779018494 LVFRYEDTVCGRBQ-OAQYLSRUSA-N 377.285 5.200 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cccc(OCc2ccccc2C#N)c1 779989427 SDRUJYGHVJYDNG-SFHVURJKSA-N 383.451 5.040 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2cccc(OC(C)C)c2)C(F)F)c1 788645281 OPQMTGAHTCUUHE-GHTZIAJQSA-N 388.458 5.251 30 20 GKED CN(C)Cc1cnc(/C=C\C(=O)c2ccc(-c3ccccc3Cl)s2)s1 794701985 YFGXTDYWNOSNIN-YFHOEESVSA-N 388.945 5.483 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=S)Nc1c(Cl)ccc(C)c1Cl 795131472 LCVQODBUQPRAJY-UHFFFAOYSA-N 399.343 5.162 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1Cl)CC1CC1 806402282 ZFPSIARQINDGHA-HNNXBMFYSA-N 383.879 5.075 30 20 GKED C#C[C@@H](NC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccc(Cl)cc1 810170055 DSPLBQZUJLBQLM-LJQANCHMSA-N 379.847 5.108 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccc(F)cc1 812922175 CEAMYXZEWLJBQH-JOCHJYFZSA-N 388.442 5.039 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1 813218393 VKUCQJARDKRZFW-OCOPJHETSA-N 398.306 5.399 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)ncc1F 815636233 RFQXPIKMVDKCRJ-CXAGYDPISA-N 376.273 5.069 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccccc1 817318803 HMKHGMHGIRNESP-FQEVSTJZSA-N 396.581 5.720 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc(N2CCCCC2)cc1 819842195 KIEXQBDXDYHMIF-DTQAZKPQSA-N 398.506 5.547 30 20 GKED N#C[C@H](C(=O)CC1(C#N)CCCCC1)c1nc(-c2c(F)cccc2F)cs1 850795317 CHAFPBMJROMBIR-CYBMUJFWSA-N 385.439 5.129 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCC[C@H]1CC1(Cl)Cl 857690281 ZILZKWCQCKSUQY-AWEZNQCLSA-N 391.323 5.023 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 915088075 ZVWQMMAGDYRYRR-LJQANCHMSA-N 381.262 5.901 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3ccccc3)CCC2)cc1 915352765 KAYIGWYJBCVAGW-XMMPIXPASA-N 395.506 5.585 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)/C=C/c2ccccc2F)cc1 917803660 JAKJTKPILBXBIH-SDNWHVSQSA-N 386.426 5.123 30 20 GKED Cc1cc2ccccc2nc1NN=Cc1c(F)ccc2sc(C(=O)O)cc12 1776052866 ZCOGYYVNCPEJAG-UHFFFAOYSA-N 379.416 5.041 30 20 GKED CCc1ccccc1Oc1ccc(Cl)cc1C=NNc1ccc(C(=O)O)nc1 1776071468 AWCQSNOEOBMZNQ-UHFFFAOYSA-N 395.846 5.234 30 20 GKED Cc1cc(C)c(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)cc1C 1776132896 IVAFUCMDADCVHC-RMKNXTFCSA-N 390.435 5.378 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c(C)s1 1776133468 XQQPTBRXALYFEM-GJCOWUBNSA-N 392.476 5.466 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1 1776148384 FUWKVDUZCGDQQZ-AWEZNQCLSA-N 398.261 5.434 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C(F)(F)F)cc1 1776354631 PTTLAOOZPCGYRJ-UITAMQMPSA-N 378.346 5.087 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1c(Cl)cccc1Cl 1776785241 JSBCAGWXKHSEKH-IBGZPJMESA-N 388.379 6.582 30 20 GKED N#Cc1ccc(/C=C\c2nc3ccccc3c(-c3ccccc3)c2CC(=O)O)s1 1777566502 QZUTWWXMHWENPB-SEYXRHQNSA-N 396.471 5.632 30 20 GKED C=CCN(C(=O)c1cc([N+](=O)[O-])ccc1Cl)c1nc(-c2ccccc2)cs1 14723853 QTPFFKCSYWZCPT-UHFFFAOYSA-N 399.859 5.205 30 20 GKED Cc1cc(C)c(C(=O)/C(=C(\S)N[C@H]2CCCC[C@H]2C)[n+]2ccccc2)cc1C 27489576 BOGXOFBSUMPMIU-IERDGZPVSA-O 395.592 5.006 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)F)cc1)c1nc2ccccc2n1C(F)F 41557247 YJCQZYXVCPJMRH-LBPRGKRZSA-N 393.365 5.236 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)cc2)CC1 65680393 NZSBGGUAAPFYJV-UHFFFAOYSA-N 396.450 5.189 30 20 GKED CCCCCOc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 78671270 PKENSKIOEGBIEB-QGZVFWFLSA-N 382.529 5.760 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2cccc(/C=C\C(=O)c3cccc(C#N)c3)c2)c1 96130145 BATGPFFYYHXOHJ-MIMPSMLTSA-N 388.426 5.222 30 20 GKED C#CCOc1ccc(NC(=O)c2ccccc2SCc2csc(C)n2)cc1 108185884 RAHUSUFFAYHBMH-UHFFFAOYSA-N 394.521 5.008 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccccc3SC[C@@H](C)C#N)o2)cc1 108408478 XDKRVESTFSUKDY-HOTGVXAUSA-N 378.501 5.470 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC/C=C/c1ccccc1 108409006 JHLBCTHJJATREK-PYUISTEWSA-N 382.554 5.466 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc3[nH]c4c(c3c2)CCCC4)cc1 111020117 XMHLVTUPZOVZQD-UHFFFAOYSA-N 387.483 5.006 30 20 GKED CN(C(=O)c1ccc(C2SCCCS2)cc1)c1cc(Cl)ccc1C#N 156885413 VEOPKQVLWDTEJJ-UHFFFAOYSA-N 388.945 5.357 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1cccc(-c2ccncc2)c1 174192155 KBXSMWFGHMLDMN-RMKNXTFCSA-N 379.419 5.227 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(CSc3ccccn3)c2)c1 175703773 PZTOEPYSBYWLHM-UHFFFAOYSA-N 391.521 5.242 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@H]1CCCc2ccccc21 180015067 KRVATYCKYASRIT-IERDGZPVSA-N 375.472 5.051 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 181120232 QLCSYNZBKXARFQ-CQSZACIVSA-N 379.441 5.226 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(Oc4ccc(Cl)cn4)cc3)cc2)CC1 181392832 FYXBBHFRKWKJJN-UHFFFAOYSA-N 389.842 5.335 30 20 GKED COc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1 181734402 WLTSAXHCWNSJFT-GOSISDBHSA-N 388.467 5.241 30 20 GKED Cc1cnc([C@H](C)CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 184634104 ITHBJHGOFKATOE-CQSZACIVSA-N 392.484 5.041 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCSc3cc(C)c(C)cc32)ccc1OC 187338211 OPQZSLKXKOGTDX-UYAOXDASSA-N 396.556 5.320 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1nc(-c2cccs2)oc1C 189903185 LNDQANKUAUXDDP-UHFFFAOYSA-N 380.513 5.745 30 20 GKED CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccccc2O[C@H](C)C#N)o1 248574987 SSAVYPXJIXCZJU-FCEWJHQRSA-N 381.476 5.138 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@]4(CC=CCC4)C3)c2)cc1 303677435 JEWNWRNKHWRLGK-VWLOTQADSA-N 386.495 5.100 30 20 GKED CC1(C)C[C@H](/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)c2ccc(F)cc2O1 328949795 WTBPQEVRCOWBGK-KRWDZBQOSA-N 382.435 5.312 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2ccc(F)cc2Br)s1 411003717 ASTUIHZGTFFQCE-UHFFFAOYSA-N 381.270 5.071 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(c2ccccn2)C2CCCC2)cc1 430276765 KVGLMWXDYBQBJJ-UHFFFAOYSA-N 397.478 5.643 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)csc1Br 430622303 KUQIRFDIJXBCGM-VIFPVBQESA-N 383.336 5.063 30 20 GKED N#CCC1(CN[C@H](c2ccc(Br)cc2C(F)(F)F)C2CC2)CC1 430750024 AQDHVZQXOGWBHY-HNNXBMFYSA-N 387.243 5.202 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1cccc(CSc2ccccn2)c1 433346617 GLIJUFFMHGTNAU-HXUWFJFHSA-N 387.508 5.085 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1nc2ccccc2s1)c1ccccc1 435109748 FCDILWQBGOUOOM-WMZOPIPTSA-N 379.529 5.706 30 20 GKED CCO[C@H](C)c1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 442683612 WDIBCPZIDISRGV-HIFRSBDPSA-N 397.525 5.163 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(C(F)(F)F)c(F)c2C)cc1 442952987 MNXQQDXZQXYVCU-UHFFFAOYSA-N 394.368 5.112 30 20 GKED C=CCC1(c2nc(CC(=O)Nc3c(CC)cccc3CC)no2)CCCCC1 453165628 GMFWORJMOGXLPY-UHFFFAOYSA-N 381.520 5.154 30 20 GKED CC(C)Cn1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C(F)F)n1 455049396 JXILJZQRLIUNNZ-MRXNPFEDSA-N 389.450 5.033 30 20 GKED N#CCCC[C@H](NC(=O)N1CC=C(c2ccccc2Cl)CC1)c1ccccc1 458794290 AXGJQBZQTAPWJL-QFIPXVFZSA-N 393.918 5.574 30 20 GKED CCC(CC)c1cc(CNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)on1 460343166 LLTXYXXXSBXLLI-UHFFFAOYSA-N 389.455 5.172 30 20 GKED C=C(C)Cn1c(-c2ccc(C#N)cc2)nnc1N1CCC[C@@H]1c1ccc(C)s1 460372269 DTCZPRPCGUSYKP-LJQANCHMSA-N 389.528 5.104 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2ncc(C#N)cc2Cl)nc1-c1ccccc1 462102804 DHHWILGDLICWRT-SFHVURJKSA-N 392.890 5.727 30 20 GKED C[C@@H](C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)c1cccc(C#N)c1 462124476 VDZPPAAKIYITAO-OAHLLOKOSA-N 387.395 5.001 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 467869958 XLPMWLULLDHRLW-CTNGQTDRSA-N 385.511 5.353 30 20 GKED N#Cc1cc(CSc2nnc(-c3ccco3)n2C2CCCCC2)ccc1F 469153897 WUYPPNJIHGJOJQ-UHFFFAOYSA-N 382.464 5.346 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 469247143 PWZQSNOYDAXEMI-ROUUACIJSA-N 396.556 5.859 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCC[C@H]3c3ccc(F)cc3)ccc21 469304539 HUVLSYTWILMWCH-FCHUYYIVSA-N 391.490 5.157 30 20 GKED C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 469525850 UBWXFICTUHENFE-PZJWPPBQSA-N 385.511 5.038 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cc(OCC)ccc2C1 475582698 NNTFHRVHOYYVJT-UHFFFAOYSA-N 378.516 5.527 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2cccc(Oc3ccc(Cl)cc3)c2)nc(C)n1 481032903 JCRKIYFXIYCQFV-LJQANCHMSA-N 377.831 5.029 30 20 GKED N#CCCn1cc(CN[C@@H]2CCC[C@H](c3ccccc3)C2)c(-c2ccccc2)n1 486853993 AOECWNHRRAWZEB-LADGPHEKSA-N 384.527 5.280 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(-c2ccccc2)no1 489726826 FNWJQYGZPJGKPM-MRXNPFEDSA-N 382.423 5.574 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(C)cc1)CC2 492076249 VGDVCZIGLKHEHD-KNTRCKAVSA-N 381.479 5.016 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1OC)[C@H](C)c1cccc(C(F)(F)F)c1 495421053 NLUVOKVFROYQJR-CYBMUJFWSA-N 391.393 5.201 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccn3C3CCCC3)n2)cc1 496576388 ZBAACAXVAJKGCG-GOSISDBHSA-N 375.497 5.525 30 20 GKED Cc1ccc(NC(=O)[C@H](Sc2ccc(C#N)cn2)c2ccccc2)cc1Cl 498163800 SAIHRHJWOIXWEU-HXUWFJFHSA-N 393.899 5.387 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccnc(-c4ccccc4)c3)cc2)nc1 500428406 SRZFSJHWUFFGAR-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#CC1(CCCSCc2ccc(C(=O)Nc3ccccc3)cc2)CCOCC1 507520558 RJHPLGKYOCXFFO-UHFFFAOYSA-N 394.540 5.273 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(OC(F)F)cc2)cc1 507919652 INWXMWCIBUCEGL-UHFFFAOYSA-N 380.350 5.204 30 20 GKED CCN(C(=O)c1cc(-c2ccc(Cl)s2)on1)[C@H](C)c1ccc(C#N)cc1 509563985 KDPIQAZUFRCHQS-GFCCVEGCSA-N 385.876 5.151 30 20 GKED CCCCN(CCCC)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 511478485 XNAOZIQVSSKJKW-UHFFFAOYSA-N 392.503 5.245 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3ccc(C#N)cc3)o2)cc1 511837957 KMMRCNCIYHUUFB-UHFFFAOYSA-N 379.419 5.441 30 20 GKED C=CCn1c(Sc2ccnc(-c3ccccc3)n2)nnc1-c1cccc(C)c1 511975040 USBWJNNEUAVLFC-UHFFFAOYSA-N 385.496 5.048 30 20 GKED COc1cc(CN(C)[C@H](C)CC#N)ccc1OCc1cccc(C(F)(F)F)c1 513730359 YZEFJWLFWWNLJY-OAHLLOKOSA-N 392.421 5.027 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 517441498 ZPXHJEBNQSOVCV-UHFFFAOYSA-N 398.940 6.327 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc2ccccc12 517533702 YJTYJDIWAUIWLH-MRXNPFEDSA-N 375.497 5.556 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1 518019287 FIZQQRDDCPCDCW-UHFFFAOYSA-N 382.407 5.078 30 20 GKED C=CCOc1ccc(C(=O)N(Cc2ccco2)Cc2ccc(C)s2)cc1OC 519993310 CZZFHNQPSNFTFW-UHFFFAOYSA-N 397.496 5.066 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(-c2ccccn2)cc1 521320300 NXKKPHILBVWLHB-GMAHTHKFSA-N 382.467 5.052 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cccc(C#Cc2ccccn2)c1 522360121 NYOQCQUXOHTVCU-UHFFFAOYSA-N 395.487 5.166 30 20 GKED COC1CCC(N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 522431474 FQVOACBENABFNA-UHFFFAOYSA-N 393.487 5.080 30 20 GKED CCN(C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 523113496 WVZBHFSUAWPNHQ-CVEARBPZSA-N 388.433 5.365 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 524390151 WDRNXYWHGHKECO-OAHLLOKOSA-N 393.405 5.204 30 20 GKED Cc1c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)oc2ccccc12 524390873 HUOIXRYEBMSRJT-UHFFFAOYSA-N 382.419 5.444 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N(C[C@H](C)C#N)C1CC1 533139499 DYYCKLIQRZGRFS-OAHLLOKOSA-N 397.906 5.383 30 20 GKED CCN(C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1)c1ccc(C#N)c(Cl)c1 533673828 HHOLENNREFYKSQ-UHFFFAOYSA-N 392.842 5.341 30 20 GKED FC(F)(F)c1ccc(C#CCNc2cccc3c2CN(c2nccs2)C3)cc1 533953656 JXPRTAPJWHIUSU-UHFFFAOYSA-N 399.441 5.146 30 20 GKED Cc1ccc(Nc2nnc(SCCCC3(C#N)CCOCC3)s2)cc1C 538570401 RGVHNXUCUXCLFM-UHFFFAOYSA-N 388.562 5.091 30 20 GKED C=CCC[C@H](CC)Nc1ccc(NC(=O)[C@@H](C)n2nc(C)cc2C)c(Cl)c1 538634557 IONDCMKAUJLDTR-SJORKVTESA-N 388.943 5.510 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](c1cncc(Br)c1)C1CC1 551811530 DXKXZHONELRUDS-NHCUHLMSSA-N 396.332 5.224 30 20 GKED CC(C)n1c(-c2sc3ccccc3c2Cl)nnc1N1CCC(C)(C#N)CC1 556464092 AIWFKORQMTXMNB-UHFFFAOYSA-N 399.951 5.524 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(-c2ccc(Br)cc2)s1 572678933 JBRNOBJVJCVEAY-UHFFFAOYSA-N 397.297 5.496 30 20 GKED C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)c1ccc(C#N)cc1 583530328 VCLNNLDKAVJGAU-KRWDZBQOSA-N 397.503 5.170 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 584150394 MPQUXZMVKGZCRJ-ZVZYQTTQSA-N 383.492 5.145 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 597186564 JSLAEGIBLCQXBV-AYBZRNKSSA-N 380.513 5.222 30 20 GKED N#Cc1c(NC(=O)Cc2c(F)cccc2Cl)sc2c1-c1ccccc1CC2 603992318 QTCWZJWZSQPLLR-UHFFFAOYSA-N 396.874 5.359 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1sccc1C(C)C 609060696 KNELITYKQWBCFT-UHFFFAOYSA-N 390.508 5.883 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCC[C@@H]1c1ccccc1 609555574 UBAUZBUQFPUWRY-QRQLOZEOSA-N 379.529 5.396 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3ccncc3)n2)o1 609782838 BQNAWAMXMFDYRF-GFCCVEGCSA-N 389.402 5.789 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F 610171125 GUFZBOMZQDQBNX-DOTOQJQBSA-N 380.419 5.307 30 20 GKED C[C@H](C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1ccccc1C(F)(F)F 610598291 CDVHXTLHYMWVQV-ZAAXVRCTSA-N 386.417 5.107 30 20 GKED COc1cc(CNCc2ccc(C#N)c(Cl)c2)ccc1OCc1ccccc1 619748461 LVZLJFIGRAXQFK-UHFFFAOYSA-N 392.886 5.089 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 620310803 SPYMSNDVOJDJNG-CALCHBBNSA-N 392.446 5.081 30 20 GKED C[C@H](N[C@@H](C)c1ccc(F)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 623973175 IZHIAHHQAIAGSL-YUMQZZPRSA-N 386.336 5.732 30 20 GKED C[C@H]1CCCc2ncc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)n21 651265203 JDLGKNYOBIWGMP-WFASDCNBSA-N 396.903 5.047 30 20 GKED CC(C)c1nc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2s1 726482701 KVEZZFZEHBIAKT-UHFFFAOYSA-N 386.933 5.754 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc(OC)cc(OC)c3)s2)cc1 727975734 VPZXZEOUJMVAOO-BJMVGYQFSA-N 395.480 5.040 30 20 GKED CCCCCCCCc1nnc(NC(=O)Nc2cccc(NC(C)=O)c2)s1 733618189 UTBHTIIBXNAXQS-UHFFFAOYSA-N 389.525 5.044 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2nccn2Cc2ccccc2)cc1OC 734094335 CCBYKIBATOCSML-QBFSEMIESA-N 390.483 5.015 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc(Cl)ccc3[N+](=O)[O-])c2)s1 740010408 CJDPGFZYYQKINU-UHFFFAOYSA-N 383.860 5.138 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1c(Cl)nc2sccn12 741836629 DKWSEQGDFBESSF-UHFFFAOYSA-N 376.272 5.087 30 20 GKED Oc1ccc(Br)cc1C=Nc1cccc(C2SCCS2)c1 743334093 LPBGJQSQZLJZMT-UHFFFAOYSA-N 380.332 5.384 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)c1 744017222 ZUUTVPURPFGQBM-FQEVSTJZSA-N 386.451 5.027 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(-c3cccc(C)c3)o2)nc2ccccc21 746159683 JKVFMBRYIIPSFG-OAHLLOKOSA-N 376.485 5.434 30 20 GKED CC(=NNc1cccc(Br)c1)c1c(C)nn(-c2ccccc2)c1C 746488363 HQROWIPYASESIU-UHFFFAOYSA-N 383.293 5.088 30 20 GKED CCC[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)c(Cl)c1 746663438 QXIPEQLPYONJOH-GOSISDBHSA-N 392.286 5.559 30 20 GKED CC(C)CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CCCC1 754889154 IKTWUTOZWOXMNP-QHCPKHFHSA-N 375.516 5.775 30 20 GKED C=C[C@H](CC(=O)N(Cc1ccccc1)C[C@H](O)c1cccs1)c1ccccc1 759334163 TWIRCLMLLCRMOV-IRLDBZIGSA-N 391.536 5.170 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)OC(=O)Cc1ccccc1CC#N 761107743 PBUHWTWMFFOTMD-OAHLLOKOSA-N 394.471 5.171 30 20 GKED CN(CCC#N)c1ccc(CNc2cccc(CC[C@@H](O)c3ccccc3)c2)cc1 770558702 IUTRCXHWSHTZEP-AREMUKBSSA-N 399.538 5.315 30 20 GKED CC(=NN[C@@H]1CCOC(C)(C)C1)c1sc(-c2ccc(Cl)cc2)nc1C 780241330 NXSIAESQVVRHHS-MRXNPFEDSA-N 377.941 5.043 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCc1ccc(C#N)cc1 781722023 SNIQINQFYDNFRB-UHFFFAOYSA-N 387.222 5.186 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCSc3ccc(OC)cc32)c1 783252755 UZMWZVVYBKYALH-UWJYYQICSA-N 382.529 5.093 30 20 GKED N#C[C@@H](C(=O)CO[C@@H]1CCCc2ccccc21)c1nc(-c2ccccc2)cs1 797549398 IHRSMWITJWWUOV-SIKLNZKXSA-N 388.492 5.081 30 20 GKED C=CCc1cc(CN[C@@H](CC)c2cccc(Cl)c2O)cc(OC)c1OC 806146116 RLUNHAUEMDZECG-SFHVURJKSA-N 375.896 5.032 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)cc1 810184404 QCUDYIXVLCTHED-WMLDXEAASA-N 383.904 5.230 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1cccc(OC(F)(F)F)c1)c1ccccc1 814209480 BBMIZWSXMKZOHU-QGZVFWFLSA-N 393.434 5.307 30 20 GKED COCC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 834891503 IRHHXHVUHKZDKN-FOIQADDNSA-N 392.421 5.036 30 20 GKED N#C[C@H](C(=O)CSC1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 835068374 GSLWOOBGBLVJQN-GFCCVEGCSA-N 383.325 5.189 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1sccc1C(F)F 873985473 NHDIZUYYFFYACP-JIGDXULJSA-N 395.315 5.325 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)/C=C\c3nc4ccccc4s3)c2C#N)C1 877880247 HKIXJBDFSRYRIX-LAUAKBEESA-N 379.510 5.006 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC([C@H](O)c3ccccc3)CC2)cc1 914787997 JBSNYWPPUAVUGL-AREMUKBSSA-N 382.507 5.171 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccc(Cl)s2)cc1 915180558 OVCYWHFHZKEJNJ-NJBZPOFQSA-N 378.884 5.709 30 20 GKED N#Cc1ccccc1NC(=S)N[C@H](c1ccccc1)c1cccc(Cl)c1 916025608 FXRKFVINMRVKNA-HXUWFJFHSA-N 377.900 5.288 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)c3ccc(Cl)cc3)n2)cc1 917428200 PRIHWMGSDOKERF-GOSISDBHSA-N 394.927 5.926 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3sccc3Br)cs2)cc1 918713676 SZCCVTGXMQPMFQ-SREVYHEPSA-N 390.327 5.839 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)Cc1ccco1 919906304 WAPPBMSKLHXIEY-INIZCTEOSA-N 375.428 5.005 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 920009509 GWTDLRAGKBYKOY-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CC(CCCCCCC(=O)O)=NNc1ccc(Br)cc1Cl 1776080034 BEFCFLAPBZFTIZ-UHFFFAOYSA-N 375.694 5.316 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(-c2ccc(Cl)cc2)s1 1776086222 IILMJSQCOAOHCO-UHFFFAOYSA-N 384.888 5.911 30 20 GKED C=CCOc1ccc(CN[C@](CC(C)C)(C(=O)O)c2ccccc2)cc1Cl 1776183624 CMKUXOOEONZPJL-QFIPXVFZSA-N 387.907 5.021 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@@H]2Cc3ccc(C(=O)O)cc3C2)cc1 1776785983 VNDPZHIUGXGPAW-HSZRJFAPSA-N 393.527 5.185 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C3CC(=C)C3)CCC2)cc1 1785843796 XZJNPMWZRITIRA-UHFFFAOYSA-N 380.532 5.079 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)c(F)c1 7712446 CFOPNJICAOAYFG-DHZHZOJOSA-N 397.808 5.767 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)cc1 7748190 DHDIVCZOTYMFDF-MDWZMJQESA-N 381.378 5.296 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 7796934 LDFFDLBYDSVSEK-UHFFFAOYSA-N 384.913 5.818 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)[C@H](C#N)c1ccccn1 41482317 SDPHOHLIELEAPO-CQSZACIVSA-N 387.386 5.022 30 20 GKED CCCCc1noc([C@@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)n1 56153438 TWFNLHYPDSHQLB-MRXNPFEDSA-N 376.460 5.036 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 60477675 ZNQXDQVQBIEFKF-SFHVURJKSA-N 396.899 5.499 30 20 GKED CC(C)N(CCC(=O)Nc1ccccc1C#N)Cc1ccc(Cl)c(Cl)c1 63524126 JJYQWAMZNGVICB-UHFFFAOYSA-N 390.314 5.104 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)cc1 66802113 HTWFFUYPOOGYPY-GFCCVEGCSA-N 375.291 5.096 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nnc(-c2ccccc2)o1 66903750 HQPHOYGYVDKASK-INIZCTEOSA-N 382.423 5.574 30 20 GKED Cc1csc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 69656947 BZCKEWIJBCRNTH-OAHLLOKOSA-N 392.484 5.307 30 20 GKED CC(C)OC1CCC(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 123149116 NVGBQJBCQCKNNZ-UHFFFAOYSA-N 393.487 5.208 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc(C#N)c(Cl)c1 155076802 IHEUHQVTMOKETP-UHFFFAOYSA-N 384.060 5.188 30 20 GKED CC1CCN(c2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2)CC1 159982118 XQGHAMBNOWNUQE-JOCHJYFZSA-N 376.504 5.089 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1Oc1ccncc1 177765018 UPGIYLPWDWPJNL-KRWDZBQOSA-N 377.469 5.252 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ncccc1C(F)(F)F 180011389 RXIPIUHHPMZYSX-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)cc1)c1ccccc1 190883191 IUXGABOTZZDJKX-UWJYYQICSA-N 393.446 5.260 30 20 GKED Cc1cc(C(=O)CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c(C)s1 193273553 XFFLABRYDHWVDJ-QGZVFWFLSA-N 394.521 5.328 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c(C)n(C2CCCCC2)c2ccc(OC)cc12 195740064 OKYLQBFMUXOXDW-INIZCTEOSA-N 381.520 5.085 30 20 GKED COc1ccc(CNc2cccc(Cl)c2OC(C)C)cc1OCCCC#N 237198649 MVLRHKCFNIOICH-UHFFFAOYSA-N 388.895 5.430 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C1(C)C 276373277 NXFTWQJEKYARCX-WFASDCNBSA-N 385.455 5.133 30 20 GKED N#CC1(CCCSCc2coc(-c3ccc(Cl)cc3)n2)CCOCC1 281157568 BFVFHFDHDGMKSO-UHFFFAOYSA-N 376.909 5.329 30 20 GKED CS(=O)(=O)c1ccc(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1C(F)F 329280490 MXZZOCZLYYNIKX-BFHYXJOUSA-N 385.476 5.222 30 20 GKED C[C@H](/N=C(/O)Nc1ccc2c(c1)CC(C)(C)O2)c1ccc2c(c1)CCC(O)=N2 329967263 VLRIMVCYQYIYNI-ZDUSSCGKSA-N 379.460 5.021 30 20 GKED N#CCCC[C@@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccccc1 410958795 XZDOEVFKIASSCH-MRXNPFEDSA-N 382.332 5.149 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430608394 FFLJGIWLGNQRBV-CQSZACIVSA-N 399.903 5.548 30 20 GKED CC(C)[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431289041 VTIOASUJTNOMQN-SFTDATJTSA-N 385.458 5.396 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccccc1 431773037 NOTGVUAJGBUSED-NHCUHLMSSA-N 381.907 5.525 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 432004499 AMVZBPYRUDQRSR-KRWDZBQOSA-N 379.847 5.107 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H](C)CCC[C@@H]1C 437965672 UFNHVBRQHLJKKT-HKUYNNGSSA-N 391.515 5.488 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC2(CCCCCC2)C1 438039731 GWFOHUZYZWXEAL-SFHVURJKSA-N 385.577 6.049 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438659060 YAVXGPFRXVQCCN-UHFFFAOYSA-N 379.357 5.159 30 20 GKED N#Cc1c(NC(=O)[C@H]2SCCc3sccc32)sc2c1CCCCCC2 443873067 CFOAKQNJRGRVOB-KRWDZBQOSA-N 388.583 5.309 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 457349416 CCMXUEJOEYKDLU-IBGZPJMESA-N 389.927 5.033 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 458371841 UBPSFWIWOFZOSK-LPHOPBHVSA-N 377.513 5.697 30 20 GKED CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccccc1S[C@@H](C)CC#N 462226654 AUSMZQQQVCKHPT-HNNXBMFYSA-N 385.489 5.388 30 20 GKED COCCC[C@H](c1ccc(Cl)cc1)c1noc([C@@H](C)c2cccc(C#N)c2)n1 463053663 JEEMVNNBKRJELQ-MGPUTAFESA-N 395.890 5.305 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cc2cccc(F)c2o1 474710514 QBUSEAIXGHMLNJ-ZIAGYGMSSA-N 397.475 5.706 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccccc1)N1CCCC1 475546759 FHUMAOZPVCPCML-QHCPKHFHSA-N 391.559 5.497 30 20 GKED CC(C)CN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 476828250 WOWFRBSJBHBTGQ-FGZHOGPDSA-N 375.516 5.031 30 20 GKED Cn1ncc(C(=O)Nc2ccc(Cl)cc2-c2cccc3ccccc23)c1C#N 477137245 LSCOHOYFLWTKEP-UHFFFAOYSA-N 386.842 5.018 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 477727649 SCXHMZVSKKNKIU-CWTRNNRKSA-N 380.385 5.263 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cn1 478101237 LAXAHQLRMHJLPF-OAHLLOKOSA-N 398.919 5.071 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1cccc(OC(F)(F)F)c1 492764316 BYRBRPLNCVJTGM-LLVKDONJSA-N 399.210 5.070 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cc(Cl)ccc2F)cc1C(F)(F)F 499473704 SJOUKUWLZMUYAO-UHFFFAOYSA-N 388.773 5.100 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 499750615 PGVJIGZPHQROCG-UHFFFAOYSA-N 386.451 5.319 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1 499838046 NCNFETXCAKDWKC-KEYYUXOJSA-N 379.674 5.131 30 20 GKED CCCc1ccc([C@@H](NC(=O)NCc2ccc(C#N)cc2)c2cccs2)cc1 500420893 LWTKYXMGBPKGCG-JOCHJYFZSA-N 389.524 5.161 30 20 GKED Fc1cccc(F)c1[C@H](NCc1ccc(OCC(F)(F)F)cc1)C(F)(F)F 506277528 PQPMVVFBSAJBEA-HNNXBMFYSA-N 399.281 5.299 30 20 GKED Cc1ccc2oc(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)cc2n1 511778254 QHQYVQVDDLXRQT-UHFFFAOYSA-N 397.434 5.034 30 20 GKED Cc1ccc(NC(=O)Nc2cccc3c2CCN(Cc2ccc(C#N)cc2)C3)cc1 517570962 ZLPNNEQHDXICGC-UHFFFAOYSA-N 396.494 5.069 30 20 GKED CCSc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 518516686 SEIFDMVKYCANJJ-KRWDZBQOSA-N 394.521 5.421 30 20 GKED C=CC1CCN(C(=O)c2cc3c(C)nn(Cc4ccccc4Cl)c3s2)CC1 520326768 KIUCXEBCWJLBKV-UHFFFAOYSA-N 399.947 5.146 30 20 GKED N#C[C@H](NC(=O)c1cc2c(ccc3ccccc32)[nH]1)c1cccc(C(F)(F)F)c1 521016247 UXOKMJJVRYDYBX-FQEVSTJZSA-N 393.368 5.335 30 20 GKED C[C@@H](CNC(=O)CSCc1ccc(C#N)cc1)c1c(Cl)cccc1Cl 523575625 WJQABIRVBKEHCY-ZDUSSCGKSA-N 393.339 5.018 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)NC[C@@H](C)C#N 532056822 AFBLJBWJCYCRAG-AWEZNQCLSA-N 393.466 5.013 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N[C@H](CCC#N)c3ccccc3)cc2)cc1 534824167 YVMKQTDMMDQBLD-XMMPIXPASA-N 398.462 5.456 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccn2)ccc1Cl 535855682 NITVDFSNCFHFFE-UHFFFAOYSA-N 390.874 5.348 30 20 GKED COc1ccc(C[C@@H](C)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 536244711 OIHXDKRBJNPGTC-IAGOWNOFSA-N 397.544 5.090 30 20 GKED C[C@@H](NC(=O)N(C)CCc1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 541158541 GUEOFXDGMPWMDC-QGZVFWFLSA-N 389.524 5.232 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(F)F)c1Cl 542723224 HMOBGYHKODWNIW-UHFFFAOYSA-N 377.822 5.592 30 20 GKED Cc1c(C(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)sc2cc(F)ccc12 553607864 ZPYGZMOSMASPJE-UHFFFAOYSA-N 399.331 5.306 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 553945088 STJGHUXOLBKUMO-HOTGVXAUSA-N 377.246 5.183 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)cc1 556134796 ZYYYHMGOTRWWJS-UHFFFAOYSA-N 389.421 5.563 30 20 GKED N#Cc1ccnc(SC[C@@H]2CCCO[C@H]2c2ccc(C(F)(F)F)cc2)c1 562440121 SKLOWZWUSBQYCB-YJBOKZPZSA-N 378.419 5.232 30 20 GKED CC1(C)CN(C(=O)c2ccc(COc3ccccc3C#N)o2)[C@@H]1c1cccs1 563910968 UMIQBNJQLOVKDD-HXUWFJFHSA-N 392.480 5.015 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ocnc2C2CC2)cc1Cl 569013624 KBVXEZGARYXPBV-QGZVFWFLSA-N 377.831 5.113 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC=C(c2ccncc2)C1 570953275 XVHNFTFVLKXJFY-UHFFFAOYSA-N 397.503 5.034 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cccc(F)c2Cl)c1 572560192 JXIBBMITLYQWSS-UHFFFAOYSA-N 380.806 5.182 30 20 GKED COc1ccc([C@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccc(F)cc2)cc1 580943866 YQEJIVSNTCRODU-LOSJGSFVSA-N 386.470 5.463 30 20 GKED N#CCCCCCC(=O)Nc1nc(-c2ccc(Br)s2)cs1 588831404 QGXNBBQFXYJJCE-UHFFFAOYSA-N 384.324 5.047 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)CC1(C#N)CC1 590176809 CFWMGZDJSPBPBB-UHFFFAOYSA-N 376.378 5.008 30 20 GKED O=C(NCc1ccc(C(F)(F)F)cc1)Nc1ccc(F)cc1C(F)(F)F 590334590 FNBYYSFJBSCKCX-UHFFFAOYSA-N 380.263 5.185 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)CC1 592024479 JXNRYYGOAIIWKD-SFHVURJKSA-N 380.319 5.170 30 20 GKED C[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(-c2ccccc2)cn1 593620889 QSZVXXLJOZVDFK-WDGBRCNXSA-N 398.510 5.056 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)NC(C)(C)c1cccc(C#N)c1 596782490 IRBBAEOMIWUGBD-UHFFFAOYSA-N 379.504 5.239 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 609403062 PXYILGROFPANTC-VBKZILBWSA-N 399.947 5.865 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(Cc2ccccc2)Cc2ccccc2)c1 609496114 UZDZWZORZGYHTE-UHFFFAOYSA-N 398.506 5.336 30 20 GKED C[C@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)c1cccc(C#N)c1 610317994 UKUNUEMTZJDZJX-ZDUSSCGKSA-N 396.903 5.142 30 20 GKED C[C@@H](NC(=O)NCc1ccccc1-c1ccc(Cl)cc1)c1cccc(C#N)c1 610350006 KHSFGHPDJNVOMD-MRXNPFEDSA-N 389.886 5.439 30 20 GKED COc1ccc(CNc2cccc(OC3CCCC3)c2)cc1OCCCC#N 610909731 ULPHEHCVHDUQLJ-UHFFFAOYSA-N 380.488 5.311 30 20 GKED CC(C)(C)OC(=O)C[C@@](C)(C#N)C(=O)Nc1cccc(Sc2ccccc2)c1 611540492 JOPNIPIHHHUFEG-QFIPXVFZSA-N 396.512 5.038 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3[nH]c(-c4ccccc4)nc3C)n2)cc1 613319079 NBGLDGBRRJUZQU-SFHVURJKSA-N 398.491 5.307 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccccc1SCC(F)(F)F 618745498 URZGONRJSKEYLX-HNNXBMFYSA-N 391.418 5.022 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 661115694 DLJPTXPDOVIMKR-TZIWHRDSSA-N 397.588 5.669 30 20 GKED O=C(Nc1ccccc1C(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 667275373 HOHHOXZNZVGFET-UHFFFAOYSA-N 392.290 5.799 30 20 GKED N#CCOc1cccc(/C=C/C(=O)c2ccc(OCc3ccc(F)cc3)cc2)c1 730151006 ZWAQCZOCLPJUGF-AWNIVKPZSA-N 387.410 5.203 30 20 GKED N#Cc1cccc(C(=O)O[C@@H](CC(F)(F)F)c2ccc(Br)cc2)c1 731993160 CJXVMIFOBYZKAW-HNNXBMFYSA-N 398.178 5.171 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 732596143 LGQHKGSDYDIYNL-RXVVDRJESA-N 398.462 5.005 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2c(C)nc3sc(C)cn23)cc1 741470072 QAEOUNOGZPPMPP-OUKQBFOZSA-N 388.492 5.584 30 20 GKED CC(=NNc1ccc(Br)cn1)c1ccc(SCC(F)F)cc1 741764493 MEFZGQSRYCNWGX-UHFFFAOYSA-N 386.265 5.037 30 20 GKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1c(Cl)nc2sccn12 741844926 SVSIFOOHWOPMCL-DUXPYHPUSA-N 391.201 5.618 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccc(Cl)cc2)cc1F 743035774 JSAVYYKRQBEKEK-UHFFFAOYSA-N 397.862 5.952 30 20 GKED CC(C)[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 744073928 IRICFSOXSVACDL-KXBFYZLASA-N 396.462 5.704 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1C(F)(F)F 744117893 DNQSAVOIIKCBFS-GXFFZTMASA-N 392.377 5.434 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc(-c2ccncc2)cc1 745990754 XOCGQKFVUNYZST-VAWYXSNFSA-N 392.458 5.619 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CC(OCc3ccccc3)C2)cc1 746827558 GKCHICSIMLKAHT-PUOLSWATSA-N 396.490 5.276 30 20 GKED CSc1ccc2c(c1)CC/C(=C\c1cccc(NC(=O)C(F)(F)F)c1)C2=O 748148748 XEJXETAKZHXHCQ-NTEUORMPSA-N 391.414 5.122 30 20 GKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 753935889 BHIFPYZDLBNNSN-AYBZRNKSSA-N 387.508 5.371 30 20 GKED COc1cc(/C=C2/CCc3c(sc4ccccc34)C2=O)ccc1OCC#N 763101832 RLMLMSZQOYDNIX-QINSGFPZSA-N 375.449 5.025 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2noc(-c3ccccc3)n2)cc1 766602116 SIEIHASHCYMKIY-JKSUJKDBSA-N 383.879 5.280 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ncoc2-c2ccc(F)cc2)cc1 769863767 WPTVUBQUBLXSIK-OAQYLSRUSA-N 397.409 5.388 30 20 GKED CCOc1ccc(C(=O)/C=C/c2ncc(-c3ccccc3)s2)cc1[N+](=O)[O-] 770576505 YKUPIFXPWBEVHZ-PKNBQFBNSA-N 380.425 5.013 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(Cl)c2SCC(F)F)cc1 770585121 IAYGVEIXPSPBFW-GFCCVEGCSA-N 382.863 5.600 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2cc(C)c(C)cc2o1 783076383 JIVMSIADIJEUNX-LJQANCHMSA-N 388.467 5.136 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(C(F)F)c3)n2)cc1 790766525 CAVZIJYPCLZSDA-KRWDZBQOSA-N 393.418 5.038 30 20 GKED C=CCC[C@H](NC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccco1 796743208 JHBKBTPDWXQVNF-IBGZPJMESA-N 376.447 5.147 30 20 GKED CCc1ccc2occ(C(=O)[C@H](C#N)C(=O)Nc3c(CC)cccc3CC)c2c1 796788172 IIFUNQKKHQFAOC-IBGZPJMESA-N 388.467 5.081 30 20 GKED C[C@@H](Cn1ccc2ccccc21)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 796811816 QUSKCIOBMIOBDL-QFBILLFUSA-N 385.492 5.277 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)c(Cl)c1 797570705 JCLLQTJLCKBXBZ-ZYHUDNBSSA-N 381.328 5.727 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570801 KPYWTOUAHZNYNV-ATOWBYMVSA-N 382.529 5.508 30 20 GKED Cc1ccc(C(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)cc1C#N 799326833 HKJCBWFXUOKROC-UHFFFAOYSA-N 387.483 5.007 30 20 GKED CCOc1cc(/C=C/C(=O)c2coc(C(C)C)n2)ccc1OCC(F)(F)F 806560032 IGDGWHPNLLQJLR-FNORWQNLSA-N 383.366 5.034 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)s1 810555024 AGJWQUNLBBLLRS-ZDUSSCGKSA-N 388.464 5.267 30 20 GKED CC(=NNc1nncc2ccccc12)c1sc(-c2ccccc2F)nc1C 814702894 ALKWWHVNLOKMFR-UHFFFAOYSA-N 377.448 5.037 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(Cl)c(F)c2)cc1 815010278 ISGSLDRUKPRLKA-LJQANCHMSA-N 394.833 5.152 30 20 GKED O=C(/C=C\c1ccc(N2CCOCC2)cc1)c1ccc(-c2cccs2)cc1 818260026 OAYNBCPVZJCIQD-XGICHPGQSA-N 375.493 5.148 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)sc2Cl)cc1 915087229 QWVZLQSNMAYTRV-INIZCTEOSA-N 387.291 5.963 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 916051840 UOMDVCLTNXEKRE-QWFCFKBJSA-N 386.417 5.649 30 20 GKED N#C[C@H](C(=O)CC(c1ccccc1)c1ccccc1)c1ccc2ccccc2n1 916849492 SNMRUQSLSPSYER-QHCPKHFHSA-N 376.459 5.633 30 20 GKED CC(C)c1ccc([C@H](C)NN=C2CCC3(CC2)C(=O)Nc2ccccc23)cc1 917553060 WVQTYYDJQKHWJG-KEJDIYNNSA-N 375.516 5.281 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccc(F)cc3)CCC2)cc1 920342389 SBSGXTRNSKITSJ-HSZRJFAPSA-N 399.469 5.682 30 20 GKED O=C1/C(=C\c2ccc(OCc3ccc(Cl)cc3)cc2)CCc2nc(O)ccc21 1341569560 QSGAEVCDRNZVCE-LGMDPLHJSA-N 391.854 5.232 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(C(F)(F)F)c(Cl)c2Cl)cc1 1776014024 YWAVPDGYZCDTNX-UHFFFAOYSA-N 377.149 5.156 30 20 GKED C=CCCCc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(C(=O)O)c2)cc1 1776174498 FDACFTGUGWRRDA-UHFFFAOYSA-N 392.499 5.136 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)cc1)c1ccccc1 1776469473 YUNZDOZAPUKOJD-HFQYIWAZSA-N 390.410 5.560 30 20 GKED CC1(C)C/C(=C\c2cc(C(=O)O)ccc2Br)C(=O)c2ccccc21 1776526615 CEMKIGDNLGXLNS-GXDHUFHOSA-N 385.257 5.095 30 20 GKED C[C@H]1C/C(=C\c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1776589795 YGBWTHXGTBAWDH-TYSUYXETSA-N 398.458 5.737 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2ncc([N+](=O)[O-])cc2C(=O)O)cc1 1776785547 LCHWLVTUGCBODY-RAXLEYEMSA-N 398.459 5.598 30 20 GKED CCCCCCCCc1ccc(C(=O)NCc2ccc(OC)c(C(=O)O)c2)cc1 1776786647 QMLMOQZTFCMUCK-UHFFFAOYSA-N 397.515 5.226 30 20 GKED CCCCCCCOc1cccc(CN[C@@](C)(Cc2ccccc2)C(=O)O)c1 1776787967 KMYJSTOUNGZFIZ-DEOSSOPVSA-N 383.532 5.211 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(OCC(=O)O)c(Cl)c2)oc2ccc(C)cc12 1776956361 VEMFFZXNHQSCDH-ALCCZGGFSA-N 398.842 5.317 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)cc1 24618714 GVBMLLSFZYFHGK-UHFFFAOYSA-N 389.499 5.259 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(\S)N[C@@H]2CCCC[C@@H]2C)[n+]2cccc(C)c2)c1 27486890 DJFFBRJQHACWQG-PZJWPPBQSA-O 395.592 5.006 30 20 GKED CC(C)c1ccsc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 64715442 BGAIQRJGZIRMCA-LBPRGKRZSA-N 388.464 5.763 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1OC(C)C 66856265 DADKOJQRKXMZKT-HNNXBMFYSA-N 384.501 5.129 30 20 GKED C[C@@H](OCC1CC1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 68336633 MQYHCHASXFDBJA-YGRLFVJLSA-N 395.311 5.108 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1 108502173 MGLVSVIOGQIQRS-JOCHJYFZSA-N 386.499 5.728 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cn(C)c3ccccc23)cc1 116525223 JMZPIANTYUFOLM-UHFFFAOYSA-N 397.434 5.103 30 20 GKED N#CCC[C@H](NC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1)c1ccccc1 160560267 BQGZDFCUPQWCAE-NZQKXSOJSA-N 386.499 5.450 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@H]1c1nc2ccccc2s1)c1ccccc1 160626279 CMNAMAQYZWQMOW-HKUYNNGSSA-N 390.512 5.188 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCCc1sccc1C 161422436 OKXJECFOGUMWOG-UHFFFAOYSA-N 391.496 5.385 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 171740741 JBAADFXKPQGYSR-BEFAXECRSA-N 399.947 5.961 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C/c1cnc(C(C)(C)C)s1 173137445 CNYLDLOSVOJPGI-ATWMFIQVSA-N 385.558 5.344 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(CCC#N)CC3CC3)cc2)cc1 176972272 CXKJQAVSQIOZJR-UHFFFAOYSA-N 381.501 5.004 30 20 GKED CCS[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 176990152 XSKXWIYMMVFMEQ-ZMSDIMECSA-N 377.579 5.124 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 177776623 RYZXBPUTDVARII-CYBMUJFWSA-N 385.876 5.373 30 20 GKED CCN(C(=O)c1cnc(-c2ccccc2F)s1)c1ccc(C#N)c(Cl)c1 179531696 NNNCWFDLLLWGTO-UHFFFAOYSA-N 385.851 5.141 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1coc(-c2ccc(C(F)(F)F)cc2)n1 182550524 JKMLDTYQVMGCMK-CYBMUJFWSA-N 387.361 5.263 30 20 GKED Fc1cccc([C@H](NCc2nc3ccccc3n2C(F)F)C(F)(F)F)c1F 182576217 BSJDPZGOEJLLCH-HNNXBMFYSA-N 391.290 5.103 30 20 GKED CC(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329159795 DYXCPDJRVYSRKF-YSIASYRMSA-N 377.550 5.204 30 20 GKED O/C(CCc1nc2ccccc2s1)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329484387 FPERZDMWTVOGLE-GOSISDBHSA-N 394.544 5.575 30 20 GKED COc1ccc(N=C(O)N2CCC[C@H](C3CC3)C2)cc1N=C(O)C1CCCCC1 329580754 UWAPICSUYGNIJH-SFHVURJKSA-N 399.535 5.531 30 20 GKED CCC1(C(=O)N2CC[C@H](/N=C(/O)C3(CC)CCC3)c3cc(OC)ccc32)CCC1 329598127 WIFWQBNBHATDHE-IBGZPJMESA-N 398.547 5.590 30 20 GKED OC(=Nc1ccc(Cl)c(/C(O)=N/C2CCCCC2)c1)[C@H]1CCCN1C1CC1 330271629 WEVSEAYHRXQYJK-LJQANCHMSA-N 389.927 5.192 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 410351508 FRZVDSDJKBNLTN-UHFFFAOYSA-N 384.479 5.618 30 20 GKED C=CC[C@H](C(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1)c1ccccc1 427134955 GLEYBSRNAQGIJI-IBGZPJMESA-N 380.875 5.280 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ncccc3C(F)(F)F)o2)cc1 428071832 QWQTUMYJGTWIRU-UHFFFAOYSA-N 393.390 5.008 30 20 GKED COC(=O)c1cc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)oc1C 431120542 NNCXPEIBNDSGKH-HZPDHXFCSA-N 388.467 5.325 30 20 GKED N#CCCC[C@@H](NC(=O)NC1CC(c2ccc(F)c(Cl)c2)C1)c1ccccc1 431304829 JGDOLNLKZBBROX-WIXQSORDSA-N 399.897 5.459 30 20 GKED CCCCN(CC(=O)Nc1ccccc1SCC#N)[C@H](C)c1ccccc1 434895435 KJEPRKYRRPDUHL-GOSISDBHSA-N 381.545 5.104 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 438042284 QDQSORAPGQUZBC-UHFFFAOYSA-N 377.366 5.099 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1 445791866 ALUUXZUPMWLTEE-LLVKDONJSA-N 382.382 5.491 30 20 GKED CC(C)N(C(=O)CCCCOc1cccc(C#N)c1)c1cnc2ccccc2c1 448457590 BCZCKAFZAVLVDA-UHFFFAOYSA-N 387.483 5.097 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458832402 HTHXHXCVORYACT-UEVCKROQSA-N 375.516 5.399 30 20 GKED C=CCOc1ccc(OCc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1 462654306 FERRJWCHGGXMPL-UHFFFAOYSA-N 377.227 5.187 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3SCCc4ccccc43)cc2)cc1 463655668 NBBZUSSCLOUTAM-JOCHJYFZSA-N 386.476 5.320 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1cc(C(F)(F)F)ccn1 464463154 BMMNAHKZNULVDF-INIZCTEOSA-N 399.347 5.155 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3cnccc23)cc1 465071240 FZVWEPUVXLEYLY-UHFFFAOYSA-N 393.446 5.132 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 467989080 CAOHZAVTLADAMP-CQSZACIVSA-N 377.831 5.141 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccccc1 469151965 XBSKZEAYAFHDBM-UHFFFAOYSA-N 381.479 5.130 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cccc(CCCc4ccccc4)c3)o2)c1 471640970 CSBPRZGEFIVZRG-UHFFFAOYSA-N 394.478 5.396 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N(CCC#N)Cc2ccccn2)c1C 473827455 HZIQITKAAAGAKB-UHFFFAOYSA-N 394.519 5.043 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2nc(C(F)(F)F)cn2c1 476127435 BBYBHORYNXGKOM-UHFFFAOYSA-N 387.405 5.457 30 20 GKED C=CC[C@H](C(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)c1ccccc1 489022407 MTBPRLHVZVODRF-NRFANRHFSA-N 381.903 5.121 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)c2c1 505331963 UAVZIRVGHKTEGL-SFHVURJKSA-N 386.282 5.097 30 20 GKED COc1ccc(SCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 507907891 IQXJEYUTSJUMKX-UHFFFAOYSA-N 390.464 5.090 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCCC2)c1ccc(C(F)(F)F)cn1 513187258 WZEHEFMRVCQEBB-CQSZACIVSA-N 378.419 5.311 30 20 GKED C[C@@H](Cc1ccccc1F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518903610 KUGPMYNUYHRAQV-KRWDZBQOSA-N 388.442 5.045 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](Nc2cccc(F)c2C#N)CCC3)cc1 520271534 VQFLUGWJSJPSKN-SFHVURJKSA-N 379.460 5.319 30 20 GKED C[C@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)c1ccc(C#N)cc1 520381762 GEMZWVZCKYBHAL-ZDUSSCGKSA-N 396.903 5.142 30 20 GKED Cc1cccc(C)c1OC[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 521261110 MHXKMJVWMLMXLN-CRAIPNDOSA-N 397.544 5.144 30 20 GKED CCSc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521748147 MYELQRGKXPIYHB-HOTGVXAUSA-N 399.585 5.933 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3oc4ccccc4c3c2)c1 522218710 KRDZLYWJPKHTQZ-UHFFFAOYSA-N 385.423 5.913 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](Cc1ccccc1)c1cccs1 522683989 IVZRJCZBLPEMNG-OAQYLSRUSA-N 376.525 5.430 30 20 GKED CC(C)c1cnc(S[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)n1C(C)C 523497566 QLSMFLMPXDFQKV-CYBMUJFWSA-N 390.940 5.232 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 523585171 UBNJZZZWGYRMEP-GFCCVEGCSA-N 393.537 5.429 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CC[C@H]2c2ccccc2)c1 523949000 GOCVKEYNJLDGIK-NRFANRHFSA-N 388.854 5.591 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](CC(C)C)c2ccccc2)cc1 525337313 RUIMNBLHPINMAZ-HSZRJFAPSA-N 390.527 5.269 30 20 GKED CCSCc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 525547791 NEMTUBUZRUSHGM-UHFFFAOYSA-N 392.480 5.236 30 20 GKED C=C(C)[C@H](CC(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1)OCC 541446235 MDKAAUXPEJLYGF-CUYJMHBOSA-N 393.527 5.124 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3[nH]ncc23)cc1Cl 552415816 RWSXAAZIIAKIFY-GOSISDBHSA-N 386.842 5.124 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@@H]1c1cccs1 572107556 PCTGMABWTLIFDB-OAQYLSRUSA-N 387.508 5.158 30 20 GKED CC[C@H](NCc1cccc(Cn2cnc3ccccc32)c1)c1ccc(C#N)cc1 575310640 DILGOCRYDUEYIB-QHCPKHFHSA-N 380.495 5.197 30 20 GKED N#CCCC1CCN(C(=O)[C@@H]2CCCO[C@H]2c2ccc(Cl)cc2Cl)CC1 579477285 DIUXCIWZVHBOLN-MJGOQNOKSA-N 395.330 5.003 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCc1ccc(Cl)cc1Cl 584164721 UUTBADZCBXTYRU-UHFFFAOYSA-N 395.334 5.059 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSCc2ccccc2)CCCC1 585705348 VMCKVTVPGSEHLY-UHFFFAOYSA-N 390.508 5.432 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)c1 591191113 AAICXWZKAKQVSP-UHFFFAOYSA-N 382.847 5.131 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccc(F)cc2[C@H](C)C1 593158407 VKTXRWPFNYVWBW-CVEARBPZSA-N 397.519 5.414 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Cc2cc3ccccc3o2)cc1 604568902 WAPUBRARGGFJHY-UHFFFAOYSA-N 398.418 5.287 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1ccc(C#N)c(C)n1 609062341 MKAFWUCWPZWTCM-UHFFFAOYSA-N 391.858 5.055 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)NCc3ccccc3)cc2Cl)c1 609075980 XHFWCTIQCOCIEN-UHFFFAOYSA-N 391.858 5.112 30 20 GKED N#CCn1c(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)cc2ccccc21 609161673 XKLKRULHAIMGTR-UHFFFAOYSA-N 392.890 5.061 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1csc(-c2ccc(Cl)s2)n1 609359351 VIHZNAGXQIUMQV-UHFFFAOYSA-N 390.921 5.205 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCCc3c[nH]c4ccccc34)cc2)c1 609434200 DCUYTECRHNLSBN-UHFFFAOYSA-N 396.450 5.196 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 609805650 MSUSTHFZPKVMAJ-AWEZNQCLSA-N 390.314 5.548 30 20 GKED N#C[C@@H](C(=O)c1cc2sc3ccccc3c2s1)c1ccc2ccccc2n1 613290733 KNJQDQONEOBRPX-OAHLLOKOSA-N 384.485 6.154 30 20 GKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 618801355 AGXLFPMNMDAWIT-IFXJQAMLSA-N 389.480 5.533 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1 618841687 AETZMZRYWWUGJR-DEOSSOPVSA-N 399.469 5.097 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(OCc2ccc(F)cc2)CC1 669727662 XCQOWXJKADMTEU-UHFFFAOYSA-N 382.479 5.157 30 20 GKED FC(F)(F)c1ccnc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 674244854 XWQRKVALTQTAOM-RKDXNWHRSA-N 380.254 5.422 30 20 GKED Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1C 727980937 VZIIBLHUVSYDPQ-UHFFFAOYSA-N 387.508 5.563 30 20 GKED O=C(/C=C/c1ncc(-c2cccc(Br)c2)[nH]1)c1ccc(F)c(F)c1 731936588 BKKULHNNSUWOGU-VOTSOKGWSA-N 389.199 5.014 30 20 GKED CC(C)n1cc(/C=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 732714486 UMVPJBXVMBSQTH-ARJAWSKDSA-N 376.300 5.398 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)c(F)c2)cc1 733259060 PWZNPEMRNIMFTM-NRFANRHFSA-N 394.833 5.149 30 20 GKED COc1cccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)c1OC(F)F 734980734 LBEBAQKJLUNKRG-YFHOEESVSA-N 386.366 5.507 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 739141804 CTOCCRVJZQFAKB-SWLSCSKDSA-N 388.414 5.370 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744017074 YAOCTZPESLFURE-BHEFUSTPSA-N 380.369 5.533 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(Cl)c2)CCCC1)c1nc2ccccc2o1 744039956 UIQAYAMSQWITOJ-QGZVFWFLSA-N 378.859 5.461 30 20 GKED Cc1cnc(C(C)(C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 750989632 JKWIMOCQUHULTR-LJQANCHMSA-N 390.512 5.164 30 20 GKED N#CCOc1cccc(CC(=O)N(c2ccccc2)c2nc3ccccc3s2)c1 760370343 XDEHXRNZGXLHOV-UHFFFAOYSA-N 399.475 5.106 30 20 GKED C[C@@H](NCCCOc1ccc(Cl)cc1Cl)c1ccc(OCC#N)cc1 776157388 ANTLOKSFNFOAAG-CQSZACIVSA-N 379.287 5.015 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCO1 777566395 RWVDAFNXPPHIDO-ZRBLBEILSA-N 391.515 5.057 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 780542042 KJWGUVVJBLRPIB-HNNXBMFYSA-N 383.517 5.821 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCSc3ccc(OC)cc32)c1 783252753 UZMWZVVYBKYALH-UTKZUKDTSA-N 382.529 5.093 30 20 GKED COc1cc(C(=O)/C=C/c2nccn2-c2ccccc2)ccc1SC(F)F 790216781 TUGSWRMFSGVMLZ-CSKARUKUSA-N 386.423 5.092 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(F)F 796644472 WTQKKJGGDHNZDI-JTQLQIEISA-N 389.254 5.584 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)sc2ccc(C#N)cc12 797219687 KNJGZLWUVQGRMD-CQSZACIVSA-N 379.510 5.325 30 20 GKED CC(C)Cn1ncc(NC(=O)c2cc(F)c(C(F)(F)F)cc2F)c1C(F)F 804519752 VBXJBODYKPQEQL-UHFFFAOYSA-N 397.294 5.026 30 20 GKED C=CCOc1c(Br)cc(/C=C/C(=O)c2ccc(F)cc2)cc1OC 810196170 KAIYBOUQKOKSGV-RUDMXATFSA-N 391.236 5.058 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC(NC(=O)c2cc(C)oc2C)CC1 825633786 FCBDVSUQAPRQKA-KRWDZBQOSA-N 390.568 5.004 30 20 GKED N#C[C@H](CCc1ccccc1)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904446754 BIRRHEDOUZQCLA-SFHVURJKSA-N 382.423 5.164 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(-c2noc(/C=C\c3ccccc3C#N)n2)c1 904631298 GPDDBTOMBPVSQN-QXMHVHEDSA-N 388.427 5.126 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C/c1cccs1 914519996 FOPPEUKHWLJOMZ-CSKARUKUSA-N 376.456 5.314 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2SC(F)F)cc1 915087174 RCFDKYDRYMQMNC-GOSISDBHSA-N 395.434 5.304 30 20 GKED COc1cc2c(cc1NC(=O)N[C@H](C)c1ccc(C#N)cc1)oc1ccccc12 915306699 RJTYOXJJLPIPCA-CQSZACIVSA-N 385.423 5.349 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1cc(F)ccc1F 916134369 HAZOIQSYXQSXQA-CSKARUKUSA-N 386.829 5.376 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(N(C)c2ccccc2)cc1 916341422 BZPIPUGYALGRIO-UHFFFAOYSA-N 399.523 5.192 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc2ccccc12)c1nc2ccccc2s1 916847827 RBZFCOJFMKWQNH-SFHVURJKSA-N 386.476 5.485 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2cc(Cl)cc(Cl)c2)SC1=S 917644156 AJJDQBKNFXABHQ-CHHVJCJISA-N 391.304 5.271 30 20 GKED N#CCCC[C@@H](N[C@H]1CCCc2ncc(Br)cc21)c1ccccc1 926479811 MSEBEBQTMHCJQW-QUCCMNQESA-N 384.321 5.246 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccccc2)cc1 1776354340 AZJOCVBLQJXWIL-UVTDQMKNSA-N 386.447 5.735 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C2CCCCC2)cc1 1776354632 UKOZFOGDIJMZSJ-UVTDQMKNSA-N 392.495 6.116 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3)s2)c1)C(=O)O 1776470925 NOIOJNFAPRFEBV-QSYFUGGGSA-N 396.439 5.302 30 20 GKED COc1ccc(/C=C2\CCc3c(Cl)cccc3C2=O)c2cc(C(=O)O)oc12 1777360218 FULXPCRUALDTMU-FMIVXFBMSA-N 382.799 5.006 30 20 GKED Cc1cccc(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2ccccc2)c1 10167600 VTSBSRSKTGJTCI-UHFFFAOYSA-O 381.546 5.012 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2SCc2cscn2)cc1 25440178 MKODNWRXEKCZNQ-UHFFFAOYSA-N 393.537 5.489 30 20 GKED C[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(C#N)cc1 31436053 YVALLYFKDFBALA-JTQLQIEISA-N 375.280 5.571 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 58883456 XMLSTXIYTRNQKK-UHFFFAOYSA-N 383.451 5.715 30 20 GKED Cc1cccc2[nH]cc(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c12 103640369 QHJRAMRLOMLECB-CQSZACIVSA-N 379.872 5.158 30 20 GKED N#Cc1cccc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1 107649621 FOVGZBRDCWDBEY-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@H](C(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(C(=O)c2ccccc2)c1 120269551 QDIRIZIJTKZFRT-CYFREDJKSA-N 396.490 5.182 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccc(F)cc2)o1 128725092 DYKCXQKZKBQDAG-LJQANCHMSA-N 398.393 5.200 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1csc(-c2ccco2)n1 151063050 RXUGFKUZCKRDST-CYBMUJFWSA-N 398.513 5.119 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccccc2F)cs1 156581425 LLNAOKBDNWMEQR-DHZHZOJOSA-N 384.407 5.002 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/Cc3cc(F)ccc3C2=O)cs1 172044823 OWSOHRUDYIEFMX-WJDWOHSUSA-N 392.455 5.098 30 20 GKED CCCOc1ccccc1Oc1ncccc1CN[C@H](C)c1ccc(C#N)cc1 173958444 YOBFRPSYKWULBM-GOSISDBHSA-N 387.483 5.385 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2nnc(-c3ccccc3)s2)cc1 181310010 YVKAUQPIYROXFM-OAHLLOKOSA-N 385.920 5.187 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3O[C@@H](C)C#N)c2cc1C(C)C 182098277 HKZQMEGJSBOLNF-INIZCTEOSA-N 376.456 5.337 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1nccc2ccccc12 188064823 VYLCALSEZXDKMD-UHFFFAOYSA-N 376.525 5.818 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(-n2ccnc2)c(F)c1 191514458 VTRKZZAMLDESGP-UHFFFAOYSA-N 392.478 5.185 30 20 GKED COc1cc(/C=C\C(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 212534869 ULVWGSWRVIJXTI-QPEQYQDCSA-N 389.407 5.079 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1CCC(C#N)CC1 280456641 FHUMDOSTHDTOGB-UHFFFAOYSA-N 392.286 5.148 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/C1(c2ccc(F)cc2F)CCC1 328970564 UVHVQWYOZGGOCS-CYBMUJFWSA-N 392.471 5.008 30 20 GKED N=C(O)c1ccc(N=C(O)c2csc3c2CCCC3)cc1N1CCCCC1 329283550 NMDUYIQMMWHFAH-UHFFFAOYSA-N 383.517 5.137 30 20 GKED O/C(Cc1cccc(O)c1)=N/C1(c2noc(C3CCCC3)n2)CCCCCC1 329363118 ZHTZLYSALLQQCS-UHFFFAOYSA-N 383.492 5.182 30 20 GKED Cc1cccc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1Br 391497400 TVBGUTIGEMVMKA-UHFFFAOYSA-N 389.318 5.212 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1 410364662 JGVISXJFBGDHQL-UHFFFAOYSA-N 388.442 5.449 30 20 GKED O=C(c1ccccc1C(F)(F)F)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F 411060431 XMBCJEUXVDHXJD-MNOVXSKESA-N 393.249 5.051 30 20 GKED N#CCCCOc1cccc(CNCc2cccc(Br)c2Cl)c1 414484192 PIIDDBFFTBGERP-UHFFFAOYSA-N 393.712 5.075 30 20 GKED C=CCN(C(=O)c1ncsc1C(F)(F)F)c1nc(-c2ccccc2)cs1 431025634 ZTHCYFJKNDJNIU-UHFFFAOYSA-N 395.431 5.118 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)c4cccc(SCC#N)c4)CC3)c[nH]c2c1 431162960 LLBKOOJAHGCQPS-UHFFFAOYSA-N 387.508 5.022 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)c(Br)c1)c1ccccc1 432978888 UZVHNNSKVBLNQM-QGZVFWFLSA-N 390.256 5.145 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 438643063 SNXLUDSROLKDSB-QLFBSQMISA-N 399.482 5.571 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)CC2 442589234 VLTQYWYEOYZFIN-UHFFFAOYSA-N 382.250 5.063 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 448516057 UTROMAZNWVEQNF-UHFFFAOYSA-N 394.833 5.491 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458807148 XEIFTLXZEKLAQD-PKTZIBPZSA-N 391.515 5.367 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(Cc1ccc2ccccc2c1)C1CC1 460566796 TYQODPPUNJJTKT-QFIPXVFZSA-N 388.515 5.028 30 20 GKED N#Cc1ccc(F)c(CNC(=O)c2sc3cc(Cl)ccc3c2Cl)c1 464050760 NLRUBPPEHDOVHE-UHFFFAOYSA-N 379.243 5.149 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1ccc(C(=O)Nc2ccccc2)cc1 464815811 USCCGVKQVBSSCZ-DQEYMECFSA-N 395.506 5.211 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(-c2ccccc2Cl)o1 464944235 WQGOAHRYGBFDAF-QUCCMNQESA-N 390.870 5.512 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3c[nH]nc3-c3ccccc3F)c2)cc1 468036795 GXUIYQVFZCLHKZ-UHFFFAOYSA-N 398.397 5.132 30 20 GKED FC(F)c1cccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 470859830 MGWJSSLXFVAAEA-OAHLLOKOSA-N 397.309 6.426 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1ccc(C(C)(C)C#N)cc1 476128411 CBJOXHFCVHCDGY-UHFFFAOYSA-N 383.495 5.212 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CC3(CCCC3)Oc3ccccc32)cc1 483028311 WGCCNRSMPAXMRG-FQEVSTJZSA-N 389.499 5.446 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 483190099 AJFKXRUYZJQOCX-YJYMSZOUSA-N 387.405 5.501 30 20 GKED CC(C)c1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)nn1-c1ccccc1 487622897 ZXQIOXMKKRVNKB-OAQYLSRUSA-N 386.499 5.161 30 20 GKED C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccc(F)c2ccccc12 489936788 RTVAVXWWFLTYSK-SFHVURJKSA-N 387.502 5.166 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc([C@H]2CCCOC2)c1 499140623 FJDKYWCSNYKDBR-KRWDZBQOSA-N 375.921 5.124 30 20 GKED CC[C@@H](CN(C)CCCC1(C#N)CCOCC1)Oc1ccc(Cl)c(Cl)c1 499705391 JLSOPPIFVYWGKT-INIZCTEOSA-N 399.362 5.183 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@@H](C#N)c3ccccc3Cl)sc2C)cc1 499946087 AEJJAMSXQJSVET-IBGZPJMESA-N 396.899 5.380 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)c2c1 505954354 NSPXRANLMPUBCU-IBGZPJMESA-N 386.282 5.097 30 20 GKED CCOc1cccc(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 510694468 YBZFPISCVPGGDK-UHFFFAOYSA-N 387.439 5.071 30 20 GKED CCCCCOc1ccc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cc1 513206332 KBYNUHWAXVESOB-KRWDZBQOSA-N 376.378 5.159 30 20 GKED C[C@@H](NCC(C)(C)CCC#N)c1ccc(Br)cc1Br 517606011 HPAGOMDGXNADMS-LLVKDONJSA-N 388.147 5.192 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCc1nc2cc(Cl)ccc2s1 519930167 AMORBHFHXYEZGK-UHFFFAOYSA-N 397.931 5.191 30 20 GKED Cc1ccc(-c2ccc(CN(C(=O)c3ccc(C#N)cn3)C(C)C)s2)cc1 523311717 SHQRUNLHNFSIID-UHFFFAOYSA-N 375.497 5.041 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 524558141 GZLRPZIWVPYFQZ-JOCHJYFZSA-N 375.516 5.945 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(C(F)F)c2F)cc1 528921792 VSGYOASISIBCMC-KRWDZBQOSA-N 388.389 5.067 30 20 GKED N#CCc1ccc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)cc1 533963836 NUAHXXVNVFIJRE-UHFFFAOYSA-N 397.503 5.252 30 20 GKED N#Cc1ccsc1C(=O)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 535681253 NKHMSUPADOHVQH-UHFFFAOYSA-N 395.189 5.120 30 20 GKED COc1ccc(C[C@@H](C)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 536244717 OIHXDKRBJNPGTC-SJORKVTESA-N 397.544 5.090 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nc2ccccc2o1 537478462 QYTJKAHWTXNTAN-HNNXBMFYSA-N 395.440 5.118 30 20 GKED C=CCC[C@@H](NCc1ccc(OC)c(OC)c1Br)c1ccccc1 540456857 PDLLKFBQNMDWFX-QGZVFWFLSA-N 390.321 5.263 30 20 GKED N#CC1(c2ccc(C(=O)Nc3c(C(=O)c4ccco4)oc4ccccc34)cc2)CC1 540694429 ZSTFNEFONFAJCG-UHFFFAOYSA-N 396.402 5.064 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1csc(-c2ccccn2)n1 542199463 PUKWGMFEFZSRST-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(CC#N)CC2)cc1 542901886 MGLRFJDZNMYXNZ-QGZVFWFLSA-N 379.529 5.697 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccncc1OCc1ccccc1 552089320 GUFQUKHXBWJNEJ-XMMPIXPASA-N 383.495 5.090 30 20 GKED CSc1cccc(F)c1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 554212518 XWPMGLLZTKZHIL-ZDUSSCGKSA-N 389.521 5.264 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1cccs1 562174234 IWRGNPKWWFYJMW-KSSFIOAISA-N 385.558 5.757 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](F)(c2ccccc2)C1 563861372 GIFLLXORZXEUEB-KKSFZXQISA-N 383.492 5.041 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)SCCCOc2cccc(C#N)c2)c(Cl)c1 568339310 KAYCIUPDHKTBIW-OAHLLOKOSA-N 388.920 5.049 30 20 GKED COCC(C)(C)CCCNC(=O)c1ccccc1SCc1ccc(C#N)cc1 581017293 GLFBVIYYVYROIA-UHFFFAOYSA-N 396.556 5.033 30 20 GKED C=CCC1(c2nc([C@@H](OCC)c3ccc(F)cc3C(F)(F)F)no2)CCC1 584258407 QOMVJZSKLMNNAK-HNNXBMFYSA-N 384.373 5.351 30 20 GKED N#Cc1csc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c1 592372201 NXUOFEIILKJAIA-UHFFFAOYSA-N 382.304 5.521 30 20 GKED C[C@H](C[C@@H]1CCCO1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 608841362 NXFYCDJMLNRXKL-BPAFIMBUSA-N 397.906 5.075 30 20 GKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1cccc(Br)c1 609825870 XZWRBSXDJZAPKO-STQMWFEESA-N 389.318 5.142 30 20 GKED CC[C@H]1CCCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 610093965 ZVFGZODFTUPECG-NRFANRHFSA-N 391.515 5.518 30 20 GKED CC(C)n1cc2ccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)cc2n1 610113838 JSHAROUHEKDJPV-UHFFFAOYSA-N 396.450 5.533 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nc2cc(Cl)ccc2s1 613403424 PMAXBDJDEHRZSP-JTQLQIEISA-N 381.671 5.747 30 20 GKED Cc1nc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)sc1C 618390239 NBOZQJRWLDDUCP-UHFFFAOYSA-N 385.436 5.037 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618848356 UQWPBOBQEKNFDU-PDSXEYIOSA-N 381.907 5.033 30 20 GKED CC(=O)c1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 679979289 NMDOUXRENPXHCM-AWEZNQCLSA-N 388.370 5.008 30 20 GKED Cc1cccc2c1C/C(=C/c1cn(Cc3ccccc3)nc1-c1cccnc1)C2=O 729151948 YZTCGVURSVFLKR-BKUYFWCQSA-N 391.474 5.124 30 20 GKED Cc1ccc2c(CC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)c[nH]c2c1 729375601 MSYLAFQKVOGAHM-UHFFFAOYSA-N 381.435 5.322 30 20 GKED CCN(CC)[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 729521352 XJEYSGRPIMHNSK-RPBOFIJWSA-N 397.522 5.364 30 20 GKED Cc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 729553423 PNTVMVLYRTXMKW-ZEQRLZLVSA-N 381.479 5.460 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@H](C#N)c1nc2ccccc2s1 729891060 XBAWZNIIWPZYCT-GSTOJPGVSA-N 376.481 5.363 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416533 FLGCSYXSJYECKA-WMLDXEAASA-N 396.487 5.511 30 20 GKED Cc1c(C(=O)/C=C/c2cn3cc(Cl)ccc3n2)cnn1-c1cccc(Cl)c1 731565190 HPPYSRKPOJYECT-VOTSOKGWSA-N 397.265 5.031 30 20 GKED CC(C)C(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C1CCCCC1 733903881 SHJQCWSSVJJRPC-UHFFFAOYSA-N 391.441 5.562 30 20 GKED C=CC[C@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccncc1 734679507 HWTUYHGQTLCKCI-FXAWDEMLSA-N 395.553 5.179 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3cc4cc(F)ccc4o3)cc2c1C 741849023 SKJZLNBBEZDBMK-SNAWJCMRSA-N 395.411 5.173 30 20 GKED Cc1cc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)ccc1-n1cncn1 742432186 UHZUDQAGYAXCFC-YFHOEESVSA-N 379.419 5.371 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1cccc(C#N)c1 743774546 BCVXNRHTYBQFHR-CYBMUJFWSA-N 380.369 5.134 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c(Cl)c1OC 745990217 NZRDIZOMIQVWTC-VQHVLOKHSA-N 379.843 5.315 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1 747111405 JIKJVTYPXQGMDG-CXAGYDPISA-N 397.544 5.224 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(-c3ccccc3)s2)c1 756708728 HSZOEPAYDWTECA-XLIONFOSSA-N 376.525 5.947 30 20 GKED C=CCC(CC=C)C(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 759010840 MIEYUGWRGOWKKH-NSHDSACASA-N 381.259 5.416 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1ccc(Cl)c2ccccc12)c1ccncc1 765887213 ZSNSOTJHZQMFCP-VFNWGFHPSA-N 379.891 5.566 30 20 GKED CC(C)(C#N)CCCCOC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 768696139 FDLABSZVTUAWGX-UHFFFAOYSA-N 398.450 5.511 30 20 GKED Cc1c(C(=O)/C=C/c2ncc(-c3ccccc3)s2)cnn1-c1ccc(C#N)cc1 770572753 RVRIKKWNKGIRCG-VAWYXSNFSA-N 396.475 5.072 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Cl)ccc2OC(F)F)c1 772983769 LRPCUJYFNXBIHV-CZUORRHYSA-N 394.849 5.473 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCOc3c(C)cc(Cl)cc32)c1 772984548 OJGOJHFDOBWSAJ-NQIIRXRSSA-N 384.907 5.333 30 20 GKED CC[C@@H](NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)c1ccc(C#N)cc1 774366159 AHYXZWQMAZFDNQ-JOCHJYFZSA-N 391.515 5.050 30 20 GKED CCCc1ccc([C@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776153643 BRQGSWURKBKYKN-UUOWRZLLSA-N 390.552 6.043 30 20 GKED Cc1ccc(Cc2cnc(NC(=O)c3ccccc3SCC#N)s2)cc1F 777358179 MSPUORCEAMCTBL-UHFFFAOYSA-N 397.500 5.049 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(OCc3noc(C)n3)cc2)cc1 777686315 PUHZFVZUYIGHRF-HNNXBMFYSA-N 399.878 5.261 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl 780169559 LUPYFFZQYXEHJL-UVMWJGKXSA-N 394.780 5.302 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1 780675300 PLCDLHMHPIXXNI-WOJBJXKFSA-N 399.494 5.773 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3c[nH]c4ccccc34)n2)cc1 786306656 ABKGAAYSQXHHLX-APWZRJJASA-N 399.519 5.970 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)C1 788097401 VPJYQHJYCHLKHF-SKDRFNHKSA-N 384.502 5.381 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(-c3ccccc3C(F)(F)F)o2)c1 788748858 LLPGGEFVFLQMTH-UHFFFAOYSA-N 386.329 5.120 30 20 GKED Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 793012522 NAVMURCECBDHNE-UHFFFAOYSA-N 397.478 5.301 30 20 GKED CC[C@](C)(C#N)C(=O)Oc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 794846894 KQIBCTQTGYJTIM-HSZRJFAPSA-N 378.472 5.082 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567178 ZGMJBAZDPMLCOY-VXGBXAGGSA-N 378.950 5.451 30 20 GKED Cc1csc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c1C#N 809002777 GDAJXLHMVZEWOR-UHFFFAOYSA-N 381.071 5.189 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1csc2ccccc12 814298208 FVEZHNHKEKXFJG-JXFKEZNVSA-N 377.513 5.697 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1sc(-c2ccccc2F)nc1C 814821688 FYQCUIHIOXUIEY-UHFFFAOYSA-N 397.479 5.251 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 835069238 YJVONJNIKYEKLT-MFKMUULPSA-N 386.826 5.618 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2-c2ccccc2C#N)c1C 863939811 NNYWTFOGNRTWQL-GOSISDBHSA-N 398.462 5.026 30 20 GKED CCN(Cc1ccccc1C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353953 RRLJNSCOQPVGTA-DEOSSOPVSA-N 383.495 5.705 30 20 GKED COc1ccc(/C=C2\SC(=Nc3c(C)cccc3C)NC2=O)c2ccccc12 915983591 OWWXQHDWTVDZHP-MOSHPQCFSA-N 388.492 5.357 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C=C\C(=O)c1cc(F)ccc1F 916134721 PUXNVFFGNZKLDT-CLFYSBASSA-N 390.792 5.207 30 20 GKED O=C1/C(=C\c2csc(COc3ccc(Cl)cc3)n2)COc2ccccc21 918714223 XMRHLJKRGWGGSH-LCYFTJDESA-N 383.856 5.034 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 920804621 XCIYYDGQKOIRQN-CVEARBPZSA-N 394.446 5.385 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1c(Cl)cccc1Cl 1776179968 SPARAHQGKXSKHT-KRWDZBQOSA-N 384.690 5.461 30 20 GKED C[C@@H]1Oc2ccc(/C=C/C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)cc2[C@H]1C 1776669730 SJQJHKZIEXDORF-DOFWOEKGSA-N 388.419 5.425 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccc(Cl)cc3)s2)cc1C(=O)O 1777360752 JTCQVUXYEXRWFQ-KRXBUXKQSA-N 398.867 5.671 30 20 GKED Cc1cc2c(c(C)c1Cl)C(=O)/C(=C/c1ccc3oc(C(=O)O)cc3c1)CO2 1777427900 SVKXGZOGGNQARW-VGOFMYFVSA-N 382.799 5.060 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(CSC)cc3)n2)cc1 66543815 BNIITRVACDECCK-GOSISDBHSA-N 394.521 5.172 30 20 GKED Cc1cc(-c2noc([C@@H](C)Nc3ccccc3SC[C@H](C)C#N)n2)ccc1F 108408194 VOHNVJJGRWPRLN-UKRRQHHQSA-N 396.491 5.609 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2[nH]1 124747808 HXQCDXNSQWLLPC-SNVBAGLBSA-N 398.900 5.200 30 20 GKED CC[C@@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 183841203 NYWXFMOEZZLVRV-HNNXBMFYSA-N 382.460 5.286 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1 187132483 MISFTCPVWXKCFX-HNNXBMFYSA-N 385.558 5.554 30 20 GKED C=C(C)[C@H](NCc1nnc(-c2ccccc2Cl)o1)c1ccc(F)c(F)c1 187770078 BCIXRZAKLPPRJK-SFHVURJKSA-N 375.806 5.075 30 20 GKED CC(C)[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc(C(F)(F)F)c1 236788318 CCEVGVVKJHWERY-NRFANRHFSA-N 389.465 5.542 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1nc(C(F)(F)F)ccc1C#N 301306242 UVGXJQCBJRRNII-LLVKDONJSA-N 388.418 5.577 30 20 GKED C=CCN(Cc1nnc(-c2ccccc2Cl)o1)Cc1ccc(Cl)s1 302748601 STPLLYIMCWBMBM-UHFFFAOYSA-N 380.300 5.293 30 20 GKED N#CCOc1ccc(CC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1 303420092 CLCYSAABNGKLRC-UHFFFAOYSA-N 392.842 5.216 30 20 GKED O/C(=N/CCc1c[nH]c2ccccc12)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329434927 JJXRIKIPBIBBAU-GOSISDBHSA-N 390.531 5.174 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)no1 377183454 RJPMBIAXNDFKMY-OAQYLSRUSA-N 388.427 5.016 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1nc(C2CC2)c(Cc2ccccc2Cl)s1 435701607 SBAYLHIQZOFVML-UHFFFAOYSA-N 397.887 5.290 30 20 GKED CC[C@H](C#N)Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1Cc1ccco1 436041775 DXIGUPPMGFHJOB-GOSISDBHSA-N 380.517 5.278 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@@H](C(C)C)C1 437839137 LYJMETUWHRWTNU-OAQYLSRUSA-N 395.528 5.264 30 20 GKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 438013398 PQKNHRPFLAQWDF-IBGZPJMESA-N 394.393 5.060 30 20 GKED C=CCN1CCC(NC(=O)Nc2ccc([C@H](C)Sc3ccccc3)cc2)CC1 438873949 LSEGROOSMNVFRQ-SFHVURJKSA-N 395.572 5.312 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccccc1 439295826 LWHFVGUZZAKBQO-QHCPKHFHSA-N 399.494 5.570 30 20 GKED C[C@H](Nc1cccc(CCC(F)(F)F)c1)C(=O)Nc1ccc(C#N)c(Cl)c1 441736991 MAYWYDIDSBXWPJ-LBPRGKRZSA-N 395.812 5.146 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)cc1OC(F)F)c1ccccc1 460245897 YAZRAJNQTUONGU-CQSZACIVSA-N 379.794 5.108 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 463744234 IIIVSASDXAXJJJ-PXAZEXFGSA-N 379.262 5.082 30 20 GKED Cc1ccc(-c2nc(CNC(=O)c3ccccc3-c3ccccc3C#N)co2)cc1 465180582 AXPMFGWQZIMPSB-UHFFFAOYSA-N 393.446 5.119 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 467927693 QMYRSPZUKOMKFD-UHFFFAOYSA-N 375.472 5.569 30 20 GKED Cc1nc(NC(=O)C2(c3c(Cl)cccc3Cl)CC2)sc1SCC#N 469048267 VOTICUGBDIMTLM-UHFFFAOYSA-N 398.340 5.044 30 20 GKED O=C(c1cc(C(F)(F)F)ccc1F)N(Cc1cccs1)CC(F)(F)F 472004122 XLBNXDPBQLSXJM-UHFFFAOYSA-N 385.304 5.111 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 476059131 FNUQIMQRDAGYPU-GOSISDBHSA-N 384.479 5.880 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 482339396 UWHGJLYWUDCGRY-DLBZAZTESA-N 395.812 5.288 30 20 GKED N#C[C@H](C(=O)c1cnc(Nc2ccc(Cl)cc2)c(Cl)c1)c1ccccn1 482598368 SDEYGDJXUJOVJD-HNNXBMFYSA-N 383.238 5.017 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 483971079 CQYYPUNFIQHFPK-HXUWFJFHSA-N 387.483 5.251 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2ccc(Cl)c(C#N)n2)nc1-c1ccccc1 486931031 SMTYALMBBMARHX-SFHVURJKSA-N 392.890 5.727 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc(Cl)cc(Cl)c3)s2)cc1 487441113 FLYQTCFVNOVMOB-UHFFFAOYSA-N 388.279 5.165 30 20 GKED N#Cc1cc(F)ccc1CSCC(=O)Nc1ccccc1Cc1ccccc1 488571935 USCGCDLVIXHNLV-UHFFFAOYSA-N 390.483 5.160 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1ccc(Cl)c(C#N)c1 494948593 VQLBGUSSLJQQOI-UHFFFAOYSA-N 388.279 5.549 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(Cl)c(F)c2)cc1C 498521515 SJUKRPHUZPZCOB-UHFFFAOYSA-N 396.853 5.125 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)N[C@H](C)c1ccc(F)cc1 499489208 ZZWKNXLRKIBCON-NEPJUHHUSA-N 396.409 5.074 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(Cl)c(C(F)(F)F)c3)CC2)cc1 503859862 RBMXVVFXLOPFNT-UHFFFAOYSA-N 390.792 5.160 30 20 GKED CC[C@@H](C)n1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccccc1 504319774 AWQPCOGYKQNOAJ-YLJYHZDGSA-N 376.529 5.452 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCCC[C@H]1C(F)(F)F)c1ccc(Cl)c(Cl)c1 505923538 VQTYOPODMRMXFQ-WDMOLILDSA-N 379.209 5.043 30 20 GKED COc1ccc([C@H]2CCCN2c2c(C#N)cnc3ccc(OC(F)F)cc23)cc1 507116318 OPBZSKKFOCAOMT-HXUWFJFHSA-N 395.409 5.058 30 20 GKED CC[C@@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(Cl)s1 512528500 HLQXBDXPEBQPPL-SNVBAGLBSA-N 385.823 5.147 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(COc2ccccc2C#N)o1 515646873 BVCNGPGPCFSQSU-NRFANRHFSA-N 388.467 5.344 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCC1 517532128 KVXJMPDZFKAWPI-IIBYNOLFSA-N 379.529 5.744 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1cc2c(s1)CCCC2 518169181 OBKXKQBRIDFAJW-CQSZACIVSA-N 385.558 5.200 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1c(Cl)cccc1Cl 520855385 LCIPEUDHCVWWPK-GFCCVEGCSA-N 394.327 5.567 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCC[C@@H](c2ccccc2)CC1 522071734 BLRLKMWIDWAWIF-HSZRJFAPSA-N 395.506 5.283 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@H](C)S[C@H]1CCCc2ccccc21 523227495 WUFBBGXDFXFXSS-JTSKRJEESA-N 394.540 5.141 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccc(C#N)cc2)c2ccccc2Cl)cc1 523567907 KNXOFVIFYMLBAN-OAQYLSRUSA-N 391.858 5.131 30 20 GKED N#CCCCCNC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525049914 MJEIRXZWITUHRA-UHFFFAOYSA-N 393.339 5.709 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc([C@H]4CCOC4)c3)cc2)cc1 535589074 RFGXLGRFDYNAGJ-FQEVSTJZSA-N 384.435 5.107 30 20 GKED CC[C@@H](C)Oc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccn1 539679785 MEOVUPAVVCWIEE-QAPCUYQASA-N 391.496 5.181 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C)o2)nnc1-c1ccc(C(C)(C)C)cc1 540001113 DCUSLLGGWMPHEX-HNNXBMFYSA-N 382.533 5.578 30 20 GKED CN(C(=O)c1oc2ccccc2c1CSC1CCCCC1)C1(C#N)CCC1 541965003 URVRDLVHRVUULD-UHFFFAOYSA-N 382.529 5.517 30 20 GKED N#C[C@@H](C(=O)c1coc(C2CCCCC2)n1)c1nc(-c2ccccc2)cs1 549080144 OTURJXOTUFVKKM-INIZCTEOSA-N 377.469 5.336 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c[nH]c(C(F)(F)F)c1 550225636 YTKSMBNUDDEOOG-UHFFFAOYSA-N 399.372 5.045 30 20 GKED N#CCCC[C@@H](N[C@H]1CCCc2ccc(Br)cc21)c1ccccc1 551210666 IBEOXSYYZGZAFO-RTWAWAEBSA-N 383.333 5.851 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 552492291 AVJDVJOPOBMROD-LJQANCHMSA-N 385.876 5.620 30 20 GKED CN(Cc1nc(C(F)(F)F)cs1)Cc1cc(F)c(C(F)(F)F)cc1F 558094750 BHIZBQDYQDSEQE-UHFFFAOYSA-N 390.299 5.091 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1 558670845 HTAFEMAHQCJCPM-UHFFFAOYSA-N 396.368 5.505 30 20 GKED CC[C@H](CSC)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 560964916 FTGJWYHTWXEGHL-MRXNPFEDSA-N 387.480 5.095 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)cc1 565852139 XXCUFUJILMFKQQ-KRWDZBQOSA-N 387.405 5.183 30 20 GKED N#CCCn1ncc(C(=O)Nc2cccc(Cl)c2Cl)c1-c1ccccc1 575856781 UHNVNGXFOQCIQL-UHFFFAOYSA-N 385.254 5.023 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 588961792 ADPSIKFYZHVIFX-UHFFFAOYSA-N 379.419 5.034 30 20 GKED CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1cccc(C#N)n1 589755396 BDTMZIZWLBRCPA-QFIPXVFZSA-N 391.421 5.025 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)cc1OCc1cccc(Cl)c1 596853633 SNAWSNHPRPMXOV-QGZVFWFLSA-N 397.906 5.385 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606173806 AARHHMUSIUMMET-RAIGVLPGSA-N 399.350 5.030 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc2scnc2c1 606773100 GTYGIDAWZNZYLT-UHFFFAOYSA-N 378.375 5.132 30 20 GKED C=CCCCCCN(C)C(=O)c1cnn(-c2ccccc2C)c1C(F)(F)F 606814222 IDYUBFYOURKMDB-UHFFFAOYSA-N 379.426 5.018 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1N(C)Cc1ccccc1)c1ccc(C#N)cc1 609046395 DHGMHHQAJOZBJF-GOSISDBHSA-N 384.483 5.077 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)CCCC1 609105961 RLLGOZZHWLVMSB-UHFFFAOYSA-N 375.403 5.189 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccccc1Cl 609370914 JBHOYPTVMOCLQH-CYBMUJFWSA-N 376.934 5.465 30 20 GKED CC(C)CN(CCc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609435487 QPLHCPWEJOCIJI-IBGZPJMESA-N 395.572 5.813 30 20 GKED Cc1ncc(-c2ccc(NC(=O)c3cccc(Nc4ccc(C#N)cc4)c3)cc2)o1 609990796 XCPUXYOLAVETEN-UHFFFAOYSA-N 394.434 5.518 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 611210614 SRVAETRFIRARKF-ICSRJNTNSA-N 377.875 5.042 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)c1cnccc1C 611301526 BIPSRDXJESMGMS-QGZVFWFLSA-N 386.455 5.245 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)cc1F 612305113 UHYYVSQTYODGMR-JOCHJYFZSA-N 397.450 5.093 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 612894566 ABHILHISYOAIMD-FQEVSTJZSA-N 398.487 5.770 30 20 GKED COc1cc(Br)ccc1[C@@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 615761925 GJSLVBHMDKSMLK-BFUOFWGJSA-N 385.305 5.058 30 20 GKED O=C(c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCC12CCCC2 616514556 PVPMUFSJVMWITR-UHFFFAOYSA-N 383.307 5.135 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)C1 661379196 VSBNHLIMXXDLID-LJQANCHMSA-N 383.561 5.233 30 20 GKED Cc1cc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)c(OC(F)F)cc1C 678297122 KEIXVNRCRGATHQ-VXGBXAGGSA-N 391.302 5.077 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccc(Cl)cc2)c2ccccc2)c1 726477769 WFPLVMMNHBQLCJ-UHFFFAOYSA-N 376.912 5.725 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2SC(F)(F)F)cc1OC 726535429 ZGUKFTKLFMCSQZ-UHFFFAOYSA-N 383.391 5.124 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1ccccc1Cl 727628115 HRKJBVGTHUKUIV-MLFXKNMZSA-N 376.843 5.125 30 20 GKED O=C(/C=C\c1cnn2ccccc12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 729643919 LDGLQDSUXAVJCU-PLNGDYQASA-N 384.279 5.268 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3ccc(F)c(F)c3)cc2)oc1C(=O)O 729937577 WJPIGUKOMBYVDX-WTKPLQERSA-N 398.361 5.040 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 730895261 FSNLRAZDJIKDTD-UKILVPOCSA-N 383.495 5.789 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccc(Oc3ccccc3)cc2)c1 733771690 RHRPRCSXHSCBSX-FQEVSTJZSA-N 386.451 5.090 30 20 GKED Cc1cccc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 734644578 RXTPSRRURBNXDG-YADARESESA-N 383.495 5.842 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](Cc1ccccc1)c1cccs1)c1ccncc1 735189449 AACHFKXFAWHPEY-PMACEKPBSA-N 377.513 5.044 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCC2(C(F)(F)F)CC2)cc1 739341657 STGQVNSTGSHGCD-UHFFFAOYSA-N 391.414 5.350 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1 741469211 KQBRBCDTFNXQMF-BUHFOSPRSA-N 398.487 5.777 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1C(F)(F)F 744015073 FTVMAYTXEXIFNC-RHSMWYFYSA-N 382.385 5.624 30 20 GKED N#C[C@H](C(=O)[C@H]1CCSc2ccccc21)c1nc2cc(Cl)ccc2s1 744035812 RYWVHTHVIJONRT-UONOGXRCSA-N 384.913 5.406 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1/C=C\C(=O)c1cnn(C(C)C)c1 746686670 INWNENDRTQOFCC-HJWRWDBZSA-N 389.286 5.161 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(COCC(F)(F)C(F)F)c2)cc1 747099531 XVWORSKHEXIPOQ-CQSZACIVSA-N 396.384 5.007 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SC)c(OC)c2)cc(Cl)c1OC 747615401 WXLRJCPSNRRREP-VURMDHGXSA-N 392.904 5.374 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccc(C#N)cc1 748681629 MCOBSYRXSNGNBL-ZDUSSCGKSA-N 382.872 5.182 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCCOc3ccccc32)cc1 750304022 UUHNPCFPEPWYRQ-GOTSBHOMSA-N 397.478 5.377 30 20 GKED C[C@H](Sc1cccc(C#N)c1)C(=O)N1c2ccccc2Sc2ccccc21 759056409 TXIWAHSIDPQWKC-HNNXBMFYSA-N 388.517 5.868 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1sccc1O 769776897 FJIYPOLBLMLKOF-UHFFFAOYSA-N 384.461 5.101 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)Cc4cccc(C#N)c4)cc3C2)cc1 771804325 GZVWHWCUFSAYKD-UHFFFAOYSA-N 395.506 5.383 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccnc(SC(C)(C)C)c1 778720749 XVILKXHHAWMAMI-CQSZACIVSA-N 385.558 5.476 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@H](Cc1ccc(F)cc1)C(C)C 780670314 KTIIFKTYBPJFHI-DYESRHJHSA-N 397.494 5.238 30 20 GKED O=C(/C=C/c1cc(-n2ccnc2)cs1)c1ccc(SCC(F)F)cc1 783710706 MGBMBHKXAZEHNS-AATRIKPKSA-N 376.453 5.187 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)C[C@H](C)c1c[nH]c2ccccc12 786277608 SNIMYOWXESFVEU-KSSFIOAISA-N 383.451 5.043 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(Br)s1 792103502 SCLMEXJKVRIKMS-BXUZGUMPSA-N 385.286 5.039 30 20 GKED N#C[C@H](C(=O)c1ccccc1NCc1ccccc1)c1nccc2ccccc12 792104868 YOYQEEBQAXTWTO-QFIPXVFZSA-N 377.447 5.337 30 20 GKED N#CCOc1cccc(/C=C(/Cl)c2nc3cc(Br)ccc3o2)c1 794738173 ISDZWWUQLDZMHJ-NTEUORMPSA-N 389.636 5.230 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2SC(F)(F)F)s1 797567267 FKPQFXSHQXTLST-NSHDSACASA-N 384.448 5.543 30 20 GKED Cc1sc2ncnc(NN=C3CCC(N(C)Cc4ccccc4)CC3)c2c1C 797785427 DROVEERIYVREIM-UHFFFAOYSA-N 393.560 5.151 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Br)c1 813096421 LTBLXOXENPFHLM-FZMZJTMJSA-N 391.334 5.183 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 814577835 TUBOPLHTFHVNCZ-DEOSSOPVSA-N 383.495 5.623 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1cc(Cl)sc1Cl)c1nc(C2CC2)cs1 842941266 PDHXXALGAORZSU-JTQLQIEISA-N 399.324 5.228 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@]23CCCC[C@H]2C3(F)F)cc1 850762166 VXOCPSPUUVROMT-XHDPDMNISA-N 388.458 5.063 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 850766964 YTHDJSBQGSJIGN-IHPCNDPISA-N 388.492 5.189 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(NC(=O)OC(C)(C)C)cc1 863471303 QDBPPYHNYBEPEH-SFHVURJKSA-N 393.487 5.084 30 20 GKED Cc1cccc(Cl)c1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 864353024 CDVBNQDTDJXFCM-UKRRQHHQSA-N 387.936 5.339 30 20 GKED CCOc1ccc([C@H](NC(=S)Nc2ccccc2C#N)c2ccccc2)cc1 915999051 AZWDXXOVSZTBFZ-JOCHJYFZSA-N 387.508 5.033 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccc2ccccc2n1 916849621 WBZRLSZHSRELIO-KTZABMDBSA-N 398.462 5.992 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccc(Cl)cc2)cc1 916947635 PBAAJTIAFKZAGJ-ALGVHLHISA-N 380.875 5.214 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)CCCCOc1cccc(C)c1 920018444 OKSXHMIZDJCAEU-UHFFFAOYSA-N 387.863 5.074 30 20 GKED CC(=NOc1ccccc1C(F)(F)F)c1sc2ccccc2c1C(=O)O 1776051935 REPSQQSXSZSRJL-UHFFFAOYSA-N 379.359 5.421 30 20 GKED COc1ccc(C[C@H](C)C=NNc2ccc(C(=O)O)c(F)c2)cc1C(C)(C)C 1776075785 DPJQFFWVWSMNAK-AWEZNQCLSA-N 386.467 5.107 30 20 GKED CC1(C)Sc2ccccc2C(=O)/C1=C\c1c(F)ccc2sc(C(=O)O)cc12 1776573054 NAVLMPHKDQSWSA-NTEUORMPSA-N 398.480 5.889 30 20 GKED CCc1cccc2c(/C=C\C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)c[nH]c12 1776977372 NEQFBEYLKMOVJM-KHPPLWFESA-N 385.419 5.585 30 20 GKED C=CCn1c(SCC(=O)Nc2c(Cl)cccc2Cl)nc2ccccc21 4485694 FHWMYQCBXKKWOJ-UHFFFAOYSA-N 392.311 5.260 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)cc1F 7712562 NUKHKUYFJPEFKS-DHZHZOJOSA-N 397.808 5.767 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N[C@@H](C)c1ccc(C#N)cc1 26123117 PAMNAEYZMQFDIP-LBPRGKRZSA-N 381.888 5.135 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)N(C)Cc3ccc(C#N)cc3)cs2)cc1 32618314 JWMWBJPFIHFWDB-UHFFFAOYSA-N 375.497 5.077 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc(Br)cc1 59269300 ZIIBRGTUQLONJR-FMIVXFBMSA-N 394.268 5.319 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N(C)c3cccc(C#N)c3)c2)c(C)c1 63325447 FSYREIXEEPPTDE-UHFFFAOYSA-N 386.520 5.744 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc(Cl)cc2)cc1 108013479 RSXBROVSQLSXKS-UHFFFAOYSA-N 378.834 5.193 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1COc1ccccc1 113570629 QXWICJHUAAHLJB-ROUUACIJSA-N 395.528 5.156 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cc(Cl)nc(Cl)c3)o2)cc1 126345693 ZBWIIJULRSGSHZ-UHFFFAOYSA-N 394.283 5.296 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)c1 127458826 ZRDATGWRCOOSGW-DVECYGJZSA-N 383.495 5.206 30 20 GKED Cc1nc(C)c(C#N)c(S[C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)n1 129598926 DXXKGOGZXVOMKB-LBPRGKRZSA-N 384.892 5.435 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 129676565 RYBZJIUPNWRVNG-CYBMUJFWSA-N 391.899 5.537 30 20 GKED CC(C)(C)SCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 155263540 OPOWPRZWNNRZNH-MRXNPFEDSA-N 383.542 5.170 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccccc2O)cs1 156595802 HDWOLYAFNZNUKF-DHZHZOJOSA-N 398.871 5.083 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@H](C)c2cccc(OCc3ccccn3)c2)cc1 165806207 HXYFBUBMOCIPME-WOJBJXKFSA-N 386.495 5.084 30 20 GKED CC(C)c1csc([C@@H]2CCCN(C(=O)Nc3cc(C#N)cn3C(C)(C)C)C2)n1 173220935 XBILGYSQZIGQRH-MRXNPFEDSA-N 399.564 5.106 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(-c2ccncc2)cc1 173589401 BXQPCEBIINWUSQ-IBGZPJMESA-N 399.494 5.047 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCCc2csc(-c3ccc(Cl)cc3)n2)cc1 179049055 UAABOFPWSINWNM-HNNXBMFYSA-N 397.931 5.087 30 20 GKED C=CCOc1ccccc1C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 195606933 AIWWYIQZXJVXGV-OAHLLOKOSA-N 378.497 5.174 30 20 GKED N#CC1(c2ccccc2)C/C(=C/c2ccsc2)C(=O)/C(=C/c2ccsc2)C1 213186883 BFNAXOJGNSTFOI-DIEJBQTFSA-N 387.529 6.101 30 20 GKED Cc1oc2ccc(N=C(O)N3CCC[C@@H](c4ncc5n4CCCC5)C3)cc2c1C 328649900 IWOGJOJULBSZSH-QGZVFWFLSA-N 392.503 5.008 30 20 GKED CC(C)(C)n1nc(C(O)=Nc2ccccc2N2C[C@H]3CC[C@H]2C3)cc1C1CC1 329838417 IRSPPSGDMSZJPJ-RDJZCZTQSA-N 378.520 5.141 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2nccc(C)n2)CC1 365125122 MBGKXBUELARGON-UHFFFAOYSA-N 378.520 5.048 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3ccc(C(C)(F)F)nc3)c2C#N)[C@H](C)C1 410977232 KPUVQECYPOWNBY-GHMZBOCLSA-N 375.444 5.065 30 20 GKED CC1(C)CCCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 437740622 AXNHXYIRGFFOQT-UHFFFAOYSA-N 391.515 5.376 30 20 GKED C[C@H]1CC[C@H](CCC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)O1 443893429 DIHWSHNMCMURAW-OXJNMPFZSA-N 382.891 5.093 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)O1 443893430 DIHWSHNMCMURAW-OXQOHEQNSA-N 382.891 5.093 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CCc3c(Cl)cccc32)c2ccccc21 444018803 ILCUTJSTIHHQJU-FQEVSTJZSA-N 377.875 5.016 30 20 GKED CC(C)[C@H]1C[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc21 447597070 FCCPOIJHWCJJRF-DHIUTWEWSA-N 387.527 5.566 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccc(F)cc1F)C1CC1)c1ccccc1 458805636 UYFADWIQMPUVCM-OAQYLSRUSA-N 383.442 5.074 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)cc2Cl)o1 466733824 XHEJQCMMYDGWDI-SECBINFHSA-N 394.258 5.907 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)C[C@H](CC#N)c2ccccc2)cc1 474413969 NRQZYKWJVPMZEW-GMAHTHKFSA-N 376.500 5.226 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(Br)ccc2o1 476076538 BCZRXZSLUVOKKT-UHFFFAOYSA-N 398.300 6.300 30 20 GKED CC[C@H](C)c1ncc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 478304852 AUGQNFBEBPZEGL-HNNXBMFYSA-N 388.496 5.265 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@@H](C)C#N 482537734 SYWJHWJDIWKETJ-WMLDXEAASA-N 388.920 5.388 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@H](C#N)c1nc2ccccc2s1 483440718 NGFAQGPRBARAGF-AWEZNQCLSA-N 393.855 5.403 30 20 GKED COc1ccc([C@H](NCc2ccccc2C(C)(C)C#N)c2ccc(F)cc2)cc1 486460666 OVSMMYQBYWFBKX-XMMPIXPASA-N 388.486 5.515 30 20 GKED N#CCCC[C@H](NC(=O)c1c[nH]c2ccc(Br)cc12)c1ccccc1 487247843 AXIHZLOIILNBOU-SFHVURJKSA-N 396.288 5.095 30 20 GKED C[C@H](Nc1ccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1)c1ccccc1 502387620 NMIYZGOZXBEFDO-SFHVURJKSA-N 398.510 6.305 30 20 GKED C[C@@H](SC(c1ccccc1)c1ccccc1)C(=O)NC1(C#N)CCCCC1 502531537 SPTMDUFEBBOBEU-GOSISDBHSA-N 378.541 5.240 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2cccc3cccnc23)cc1 504812757 HKDDDUMYDSBVHK-UHFFFAOYSA-N 377.447 5.046 30 20 GKED COc1cc(CSCc2csc(C)n2)ccc1OCc1cccc(C#N)c1 505169841 VHCXZAWJJYHRRZ-UHFFFAOYSA-N 396.537 5.344 30 20 GKED CN(Cc1ccc2ccccc2c1)Cc1cn(CCC#N)nc1-c1ccccc1 506113225 LVFDYBMTXDZYMB-UHFFFAOYSA-N 380.495 5.249 30 20 GKED CC1(C#N)CCN(C(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 507841729 SBHDJDVLANVVTG-UHFFFAOYSA-N 388.389 5.264 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCc1ccc(F)cc1 510353336 WSZVSDXFDRVYNI-UHFFFAOYSA-N 389.430 5.162 30 20 GKED CC(C)CCc1nc(CSCC(=O)Nc2cc(Cl)ccc2C#N)cs1 517973722 XPKUXHUFCOSJOD-UHFFFAOYSA-N 393.965 5.129 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1cc(Cl)ccc1Cl 518143608 OHXBUIXXSFOCMX-LBPRGKRZSA-N 379.312 5.426 30 20 GKED CC(C)n1cc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cn1 522132852 WQQSOUCNYPXLRC-INIZCTEOSA-N 389.459 5.011 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1SCCC#N)c1ccccc1C(F)(F)F 525048671 BJVCSRMFMFKYNX-AWEZNQCLSA-N 392.446 5.843 30 20 GKED Cc1cccc2c(CCC(=O)Nc3sc4c(c3C#N)CCCCC4)c[nH]c12 525520114 MSVMRLHQHNHEKG-UHFFFAOYSA-N 377.513 5.250 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC3(c4ccccc4)CC3)n2)cc1 528932402 GYDWVTCAYXPSBM-IBGZPJMESA-N 388.492 5.117 30 20 GKED C[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)c1ccc(C#N)cc1 533564687 XOZOCTOZQWKEME-CYBMUJFWSA-N 398.329 5.295 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1ccc(CC#N)cc1 536248071 HRSUVUHASCNFCJ-UHFFFAOYSA-N 390.870 5.546 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 538295329 GKTZYIYMSOXXAX-UHFFFAOYSA-N 398.503 5.804 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC=C(c4ccccc4F)C3)c2)cc1 543883509 PGSFKUFZSVVUKZ-UHFFFAOYSA-N 399.425 5.421 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](F)(c2ccccc2)C1 563861371 GIFLLXORZXEUEB-IIBYNOLFSA-N 383.492 5.041 30 20 GKED CCO[C@@H](C)c1nc(CSCc2ccc(Br)cc2C#N)cs1 579051166 UMOCCZCDZKBSSB-NSHDSACASA-N 397.363 5.308 30 20 GKED FC(F)(F)c1cccc(C2(NCC#Cc3cccc(Cl)c3)CCOCC2)c1 584878548 GPWGGFAKYJAZIQ-UHFFFAOYSA-N 393.836 5.006 30 20 GKED N#CC1(c2ccc(CNc3ccc(C(=O)N4CCCCC4)c(Cl)c3)cc2)CC1 594734515 FGSXHXHXDSKHMJ-UHFFFAOYSA-N 393.918 5.133 30 20 GKED CCc1nc(C#N)cc(N2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)n1 596139370 RZFBBYDZPIVALG-SFHVURJKSA-N 387.487 5.031 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2sccc2C#N)cc1OCC 603450369 ULIKRLPPEUCQDS-UHFFFAOYSA-N 378.881 5.103 30 20 GKED COCc1c(C(=O)N(Cc2ccc(C#N)cc2)C(C)C)sc2cccc(F)c12 603527097 BTCBNNYSXKERSM-UHFFFAOYSA-N 396.487 5.109 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3sc4cccc(C)c4c3Cl)[nH]c12 605363384 WZPGVOVTNQSMQN-LBPRGKRZSA-N 379.872 5.538 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(F)ccc2SCC(F)F)cc1OC 606379894 CZBVGMXRBHKCLY-UHFFFAOYSA-N 397.418 5.009 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccc(F)cc12 609438989 RHKNWXCESSODJH-ZDUSSCGKSA-N 397.475 5.596 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2ccc3ccccc3n2)cc1 609639258 UYAYMXKECRMSBX-UHFFFAOYSA-N 394.434 5.220 30 20 GKED Cc1sc(NC(=O)CSc2nc(-c3ccccc3)ccc2C#N)c(C)c1C 610218517 CBEXJMNBVUBNIO-UHFFFAOYSA-N 393.537 5.338 30 20 GKED CC(C)=CCOc1cccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 610228176 QKNPSBIYTLHPHU-KRWDZBQOSA-N 380.513 5.678 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc2ccccc2n1C(F)F 642282450 SGENWBJACOOLKE-IBGZPJMESA-N 399.400 5.493 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)sc2cc(F)ccc12 672460261 AFYLJCCFAYFQAJ-GHMZBOCLSA-N 399.331 5.162 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cn1 676459382 YNGVDABPDJMHCK-ZDUSSCGKSA-N 389.402 5.324 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc(C(F)(F)F)c1F 682400709 JJBSXUDDDRBVPN-NSHDSACASA-N 396.340 5.392 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1c(Cl)cccc1Cl 726319135 ZBHXGXCPPREERP-QWRGUYRKSA-N 375.280 5.583 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1Cl 727627497 NQXWSXVPSYUFEM-OCKXMSAZSA-N 388.854 5.244 30 20 GKED C#CCOc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 731012576 QGLBDIKSMYTGDQ-UHFFFAOYSA-N 398.487 5.115 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1 731967377 DFEDVVDFGSZYIE-UHFFFAOYSA-N 377.831 5.066 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 732496391 UCYAIXRQYOOZPF-HOCLYGCPSA-N 386.929 5.697 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](CCC)c1ccc(Cl)c(Cl)c1)c1ccncc1 734664406 VPOWMEHZHYMSGZ-MOPGFXCFSA-N 392.330 5.846 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3c(Cl)nc4sccn34)cs2)cc1 741843953 JWSOYVOTQWKXPC-SREVYHEPSA-N 385.901 5.377 30 20 GKED CC(=NNc1cccc(C#N)c1)c1cnn(-c2ccc(Cl)cc2Cl)c1C 743434676 XWNVLMFKSGEMTF-UHFFFAOYSA-N 384.270 5.195 30 20 GKED C=CCOc1cccc(NC(=O)N(CC)Cc2ccc(C(F)(F)F)cc2)c1 746667174 MPGCSCHMQNKEMJ-UHFFFAOYSA-N 378.394 5.324 30 20 GKED CC(C)Oc1ccccc1C=NO[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 747828002 SZSLVXIRSVYKDK-CQSZACIVSA-N 385.851 5.289 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1cc(Cl)ccc1OC(F)F 753143599 GWCOEPRPMCJYCT-WAYWQWQTSA-N 392.814 5.356 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)cc1 753678727 PAHLOXOGQKTZBD-RUZDIDTESA-N 397.453 5.155 30 20 GKED C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)Nc1cccc(OCC#N)c1 755782793 JGJWFPKBPKXJRE-LBPRGKRZSA-N 390.270 5.047 30 20 GKED CC(C)(C)OC(=O)N1CCc2cccc(/C=C\C(=O)c3ccc(F)cc3F)c21 757530632 WPRBSEJDBWDDKQ-YFHOEESVSA-N 385.410 5.159 30 20 GKED C#CC[C@@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccccc1 757764077 XHERTXFXKNSKGY-JOCHJYFZSA-N 376.500 5.001 30 20 GKED C#CC[C@H](NC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 757901521 VFKYJVFAUIVHAV-IBGZPJMESA-N 393.487 5.228 30 20 GKED C=C[C@@H](CC(=O)O[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 758907470 JRBJPTRWSCETGN-MSOLQXFVSA-N 376.456 5.318 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)cc1 760365172 MKCGVWVDZYEETD-IBGZPJMESA-N 398.359 5.752 30 20 GKED N#C[C@H](C(=O)C1Cc2ccccc2C1)c1nc(-c2ccc(Cl)cc2)cs1 763944108 NFMBAGHNSFWJSK-GOSISDBHSA-N 378.884 5.055 30 20 GKED C=CCCCN(C)C(=O)N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 779705221 GDGNGAPWTRCKAR-LJQANCHMSA-N 387.524 5.019 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1c[nH]c2ccccc12 786401096 IKIUTVRWMWVTDN-SWLSCSKDSA-N 377.444 5.287 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)cc1 788571010 ISTSUJXTFMTMMQ-RJGXRXQPSA-N 385.442 5.159 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@H](C#N)c2nc3ccccc3s2)c1 789400002 QFEJTIZVRXEVIR-QAPCUYQASA-N 378.497 5.455 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)cc3)o2)cc1 792926084 VLLORFABOKUMPR-QBFSEMIESA-N 379.843 5.198 30 20 GKED N#Cc1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)cc1F 796471369 PLSYHBYIVFADJL-KRWDZBQOSA-N 396.680 5.380 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2cc(OC)ccc2c1 806611140 MWJGSMYICAHDAH-UHFFFAOYSA-N 376.456 5.077 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(Cl)c(Cl)c1 813211460 KTTALXCCLFFLLG-BXKDBHETSA-N 387.188 5.387 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1ccc(N2CCCOC2=O)cc1 836599508 LVFBMSKEUVBZHN-KRWDZBQOSA-N 393.487 5.035 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccc(Br)nc1 853306851 BKVBXXRHRGDLFW-UHFFFAOYSA-N 392.141 5.297 30 20 GKED C=CC[C@@H](c1ccccc1)c1nc(C(C)(C)NC(=O)c2cccc(Cl)c2)no1 904599561 GPDQXIWXXYPHFK-SFHVURJKSA-N 395.890 5.096 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 915087993 YIJAVDVEKBILSR-GOSISDBHSA-N 381.262 5.901 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)(F)F)cc1)c1nc2ccccc2s1 915099271 OZDSPOFDYUCUFO-LBPRGKRZSA-N 378.400 5.398 30 20 GKED COc1ccc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)cc1OC(F)F 920067780 AXFCNSKLTFCRIO-KXFIGUGUSA-N 377.774 5.327 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C3C4CC5CC(C4)CC3C5)n2)cc1 920144223 YWEKCTHRUDTJJJ-ONGVQUFZSA-N 392.524 5.067 30 20 GKED Cc1ccc2c(c1)C/C(=C/c1cn(Cc3ccccc3)nc1-c1cccnc1)C2=O 921264772 ZAMIARGFCUBCLB-HMAPJEAMSA-N 391.474 5.124 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(OC(F)F)cc3)cc2)c1 1776040643 FSXLTRQKTNACRC-UHFFFAOYSA-N 396.393 5.028 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2cc(C(=O)O)cs2)c2c(c1)C(C)(C)CC2 1776269176 ABIMBMSWSOIFSS-VOTSOKGWSA-N 382.525 5.864 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc3oc(C(=O)O)cc3c1)CCO2 1776374833 WJXLWJDVKPBGEW-CXUHLZMHSA-N 376.408 5.303 30 20 GKED CCCCCCCOc1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)cc1 1776785926 SPLBYZQNCMOGAU-OBGWFSINSA-N 396.483 5.848 30 20 GKED CCCCOc1ccccc1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776803771 PZMPVQRHJBHEJN-ZRDIBKRKSA-N 382.456 5.247 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)c(C)c1 1776819258 VYBIIZHIJPXMOQ-JXMROGBWSA-N 382.456 5.165 30 20 GKED O=C(/C=C\c1ccc(C(=O)O)s1)c1ccc(OCc2ccc(F)cc2)cc1 1777569673 CWBAJUSKPTYDKP-LUAWRHEFSA-N 382.412 5.061 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2cc(Cl)cc(Cl)c2)cc1 1777639374 OQJXTWXAYGGXSV-FPYGCLRLSA-N 379.239 5.133 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ncc(Cc2ccccc2)s1 14632822 FDMHDZYAJMUHPN-UHFFFAOYSA-N 395.487 5.525 30 20 GKED Cc1ccc(CN(CCc2ccccc2)C(=O)Nc2cccc(C#N)c2)s1 58852620 UBGSJTSBPCWQQN-UHFFFAOYSA-N 375.497 5.205 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2csc(-c3ccccc3Cl)n2)cc1 66641261 PRTCBHRILFPPEF-UHFFFAOYSA-N 381.888 5.332 30 20 GKED C=CCN(C(=O)c1cc(Cl)c2c(c1)OCO2)c1nc(-c2ccccc2)cs1 69572321 GXLHLVNHCJXZTR-UHFFFAOYSA-N 398.871 5.025 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)N2CCC(C#N)CC2)c2cccs2)cc1 105092996 HFRIRBPAJNHRPS-HRAATJIYSA-N 381.545 5.296 30 20 GKED CCN(C(=O)c1ccc(SC(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 105907806 PQFGNBFDSHIVSL-CYBMUJFWSA-N 378.419 5.393 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3S[C@@H](C)CC#N)c2cc1C 109323625 KWJBOQOIRCIXPK-INIZCTEOSA-N 378.497 5.416 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)CC1 111735230 HCQZSXDSWNKTGT-UHFFFAOYSA-N 383.879 5.022 30 20 GKED Cc1ccc(N2CCCC2)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 116641752 WRIYIDQMPAFHFM-QGZVFWFLSA-N 379.529 5.099 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)n1 123836189 QHVWCDLWBVBJCW-SFHVURJKSA-N 399.475 5.114 30 20 GKED COc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 125425632 CHJRRVLJQYXWMI-ZDUSSCGKSA-N 389.908 5.065 30 20 GKED COc1ccccc1-c1nc(CNc2cc(C#N)ccc2OC(C)C)cs1 149409110 GWFIWZLGNWVNRV-UHFFFAOYSA-N 379.485 5.090 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)o1 153997723 NOYYAMCSWHGFTC-MJGOQNOKSA-N 397.544 6.132 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(-c3ccncc3)noc2C)s1 160040777 SWTWUWMZEGWZOC-UHFFFAOYSA-N 399.520 5.052 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1SC[C@H](C)C#N 173137330 KJEKJATXDYWGLE-CYBMUJFWSA-N 385.558 5.613 30 20 GKED CC1(C)CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 175374089 NJDDPAVDRALENY-UHFFFAOYSA-N 391.515 5.376 30 20 GKED CN(C(=O)c1oc2ccccc2c1CSc1cccs1)C1(C#N)CCC1 181597647 MXXPWZCLOILKOG-UHFFFAOYSA-N 382.510 5.305 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(-c2cccc(F)c2)c(F)c1 184669215 GQBCWDHNNQNZIO-UHFFFAOYSA-N 381.382 5.173 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc3cc[nH]c3c2)cc1 194285140 VDZOEPLFFXMSQL-UHFFFAOYSA-N 398.441 5.413 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 210120043 LZQAVTBLSFPJRU-LUAWRHEFSA-N 392.436 5.178 30 20 GKED O/C(=N\C1CCC(/C(O)=N\CC2(c3ccncc3)CCCC2)CC1)C1CCCC1 328999534 HGWYWXHAKUFACR-UHFFFAOYSA-N 397.563 5.555 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CC1)C1CC1 329992228 KHLLRHPDURPFGD-WOVHFWOGSA-N 394.437 5.443 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/C1CCC(c2ccccc2)CC1 330308107 MCPDJCYDRUPEDR-XBMUEBEBSA-N 384.545 5.377 30 20 GKED O=C1CCCc2cc(N/C(O)=N/[C@@H]3CCCc4sc(Cl)cc43)ccc2N1 330319532 DIAATIFRDHOAKU-OAHLLOKOSA-N 389.908 5.080 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O 331983501 VVUUKGGNOPRDIX-GUGJDKNPSA-N 384.564 5.332 30 20 GKED N#Cc1cn(CCc2cccc(Cl)c2Cl)c2ccc(Cl)cc2c1=O 432556627 KNKQAIVXZODNER-UHFFFAOYSA-N 377.658 5.076 30 20 GKED Cc1cc(C)n(-c2ccccc2NC(=O)N[C@H](CCCC#N)c2ccccc2)n1 432698665 KVHUNWACOQZEEL-HXUWFJFHSA-N 387.487 5.046 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1C[C@H](c2cc(F)cc(F)c2)C1 437508545 PVHYBAAUSUUOOD-IRJFHVNHSA-N 388.417 5.179 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439394415 ICFVQPJZNNALLX-DEOSSOPVSA-N 399.494 5.741 30 20 GKED N#CC(CCN1CC[C@@]2(C1)OCc1ccccc12)(c1ccccc1)c1ccccc1 444689727 OQQIWFUNLAFHSW-MHZLTWQESA-N 394.518 5.018 30 20 GKED O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccc(Cl)cc1C(F)(F)F 448462621 VOOAZCWWDDDEFA-ZDUSSCGKSA-N 399.693 5.373 30 20 GKED C[C@]1(Cc2ccccc2)CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458796630 FBBQTLSEKBPNSF-LADGPHEKSA-N 375.516 5.228 30 20 GKED CCO[C@@H](CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1=CCCC1 465125619 GFYRVNIHYBWLRO-QFIPXVFZSA-N 376.456 5.195 30 20 GKED Cc1ccc(-c2cnc(CNc3ccccc3Oc3ncccc3C#N)o2)cc1 467272189 ZBJSTQJFCCKNGC-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=CCCN(C)C(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 468190670 BZYAXPAGLLZMCV-UHFFFAOYSA-N 383.542 5.107 30 20 GKED COc1c(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccccc12 474710221 KCPFGMKOARERPR-CQSZACIVSA-N 395.484 5.157 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(OCC)c(OC)c1 475553188 FGMSMFHZIXNHPY-KRWDZBQOSA-N 396.531 5.829 30 20 GKED CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(CC#N)c1 478255179 SLMFDGWLZDMOOO-JOCHJYFZSA-N 387.527 5.115 30 20 GKED CC(C)c1ccc2c(c1)[C@@H](NCc1cn(C)nc1-c1ccc(C#N)cc1)CCC2 478272133 FSTMZHNBWULCBT-DEOSSOPVSA-N 384.527 5.249 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cccnc1)c1ccc(Cl)cc1)c1ccccc1 483318316 YHJLITYOEFMSJP-HXUWFJFHSA-N 389.886 5.356 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](C)c1ccc(C(F)(F)F)cc1 495627082 VVMWIKPDAWKPDZ-CABCVRRESA-N 396.478 5.021 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 505138439 CMAUNTUCZTUJDU-UHFFFAOYSA-N 399.494 5.072 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)Cc2c(F)cccc2C#N)cc1 505155688 XSZOFASTSQXVSS-UHFFFAOYSA-N 390.414 5.070 30 20 GKED N#C[C@H](NC(=O)c1ccccc1Oc1ccncc1)c1ccc(Cl)c(Cl)c1 509272887 XQNBRVQVZDWEIK-SFHVURJKSA-N 398.249 5.175 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 511352714 WVDRBQACCPUTPD-HSZRJFAPSA-N 393.506 5.406 30 20 GKED CC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccc(Cl)s1 513074692 IZBNIUHRTHPVBZ-QGZVFWFLSA-N 389.952 5.592 30 20 GKED C=CCN(C(=O)c1cc2cc(C)ccc2nc1C)c1nc2c(s1)CCCC2 514879443 RHLOUDQFASHBDY-UHFFFAOYSA-N 377.513 5.020 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)Nc1ccccc1S[C@@H](C)CC#N 517517742 IPXFOVCFVLZWBW-IRXDYDNUSA-N 382.529 5.612 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1Cl 517821499 QXEMIRCLQYYOQV-SFHVURJKSA-N 386.842 5.124 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCSc1ccc(Cl)cc1 518240086 SNNJTTNUPYVTTM-CQSZACIVSA-N 390.961 5.855 30 20 GKED CCc1ncc(C(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)s1 518907622 ZCDABCMJLMCLRA-BPQCLDNESA-N 397.569 5.120 30 20 GKED COc1cc(CN[C@H](C)c2ccc(C#N)cc2)ccc1OCc1cccs1 520960707 KTQWTSQXOPNLSE-MRXNPFEDSA-N 378.497 5.058 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 521152183 YCYQPRXEVGIGIO-OLZOCXBDSA-N 376.287 5.329 30 20 GKED CCC1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 522090208 WZPZNBCPLHPUMQ-HXUWFJFHSA-N 381.907 5.649 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)cc1 526980336 XMQPCXCNCIQSSM-FQEVSTJZSA-N 378.472 5.208 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(C)(C)C)cc2)nnc1-c1cnccn1 531761389 IKJYDRBWYBNSNJ-OAHLLOKOSA-N 379.533 5.072 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C3CC3)C2)cc1Cl 535001703 ZGQCRQCKOWYYFE-YLJYHZDGSA-N 379.891 5.259 30 20 GKED Cc1cc([C@@H](C)NCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCC2)c(C)s1 543440371 ZMHRQBZHEOGTRP-OAHLLOKOSA-N 398.576 5.059 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(SC3CCCC3)cc2)cnc1C(F)(F)F 549284668 ATCBJEJLNBYDLM-UHFFFAOYSA-N 391.418 5.259 30 20 GKED C=CCOc1ccc(CNC(=O)N(C)[C@H](C)c2sc(C(C)C)nc2C)cc1 558103399 ABRXLGPHTBUVTO-MRXNPFEDSA-N 387.549 5.042 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cc(C(F)F)ccc2Cl)c1 570967147 VXUZVUFGDXKNRS-UHFFFAOYSA-N 378.806 5.337 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1Cc1ccccc1 573296125 UXBZEXSEKWNMEO-INIZCTEOSA-N 390.483 5.407 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3ccc(C#N)cc3C(F)(F)F)oc12 583784089 MWDSQGMMXIGCOJ-CYBMUJFWSA-N 388.389 5.573 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1nsc2ccccc12 596735577 OPUKIELRTZTVTF-CQSZACIVSA-N 396.541 5.055 30 20 GKED N#CC[C@H]1CCCN(C(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 597918494 PRBTVSVPMULIFQ-VGOFRKELSA-N 398.959 5.315 30 20 GKED C[C@@H](Nc1ccc(-c2ccccc2)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 598772473 BGTSUUHCQBOFBV-OAHLLOKOSA-N 387.508 5.215 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 599737601 NBUODMMOHYUTBR-ILXRZTDVSA-N 391.487 5.122 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(OC4CCCC4)cc3)n2)cc1 603564336 DTWWQINDEMNBHG-UHFFFAOYSA-N 389.480 5.255 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](CCCc1ccccc1)c1ccccc1 603800895 VYEXEFGJFRHCGX-RUZDIDTESA-N 397.522 5.464 30 20 GKED Cc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)oc2c(F)cccc12 603968979 RLIHFZZJFTUWRA-UHFFFAOYSA-N 376.412 5.733 30 20 GKED CCc1ccc([C@@H](C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 609020417 TUARJBHEOURIGI-LJQANCHMSA-N 398.506 5.636 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610719386 DLZAJIZPJOJSEJ-MSOLQXFVSA-N 376.504 5.128 30 20 GKED CC(C)c1ccc(CN(C)C(=O)NCC#Cc2cccc(C(F)(F)F)c2)cc1 612309952 LZSHHXZNNSNTKF-UHFFFAOYSA-N 388.433 5.022 30 20 GKED CC(C)(C#N)c1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 614160720 YAIUVBYZYCASSS-GJZGRUSLSA-N 378.360 5.050 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccnc1Oc1ccccc1 615505429 GJOHYZKTHJGAII-UHFFFAOYSA-N 377.419 5.233 30 20 GKED Cc1ccc(C(=O)Nc2cccc(OCCCC#N)c2)c(C)c1Br 616237835 QVWORCYRVXFGPP-UHFFFAOYSA-N 387.277 5.001 30 20 GKED C=C(CNCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 620756524 IASVJYCCRHRYOH-UHFFFAOYSA-N 376.887 5.395 30 20 GKED N#C[C@H](C(=O)c1coc(C2CCC2)n1)c1nc2cc(C(F)(F)F)ccc2s1 683689685 IARGOWTWJSSBAV-LLVKDONJSA-N 391.374 5.061 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(CN(C)Cc3ccccc3)c2)cc1 726940173 MCHZKCPFDNPPNI-UHFFFAOYSA-N 397.522 5.188 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(SC(F)F)c1 727597781 BPZCSTCQZWERDY-UHFFFAOYSA-N 375.444 5.317 30 20 GKED CCN(C(=O)/C=C/c1ccccc1C#N)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 729254533 FDEBGAAVFWNFFE-CVJKAFSHSA-N 399.469 5.052 30 20 GKED N#CC1(NC(=O)c2sc3cc(Br)ccc3c2Cl)CCCCC1 729842475 FHGXYRVOICTKLJ-UHFFFAOYSA-N 397.725 5.273 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC(C)C)c2cccs2)c1 733804217 ADRCPNKLGKTOHE-HKUYNNGSSA-N 385.533 5.016 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 734711367 VOKDUVYPHRHILN-HOCLYGCPSA-N 394.446 5.385 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCc3ccc(-c4ccccc4F)o3)[nH]c12 735789640 PHHJQEYMDBLZIF-KRWDZBQOSA-N 387.414 5.080 30 20 GKED CC(C)(C)c1ncsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746827063 BSUBHTGIOONEFU-GOSISDBHSA-N 375.497 5.348 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(F)c(CSC)c2)cc1 747109314 OZGCUCJMGGWGIG-AUUYWEPGSA-N 398.503 5.163 30 20 GKED CC(=NNc1ncc(Cl)cc1Cl)c1sc(-c2cccnc2)nc1C 747611709 YULHOGBJCTYIMN-UHFFFAOYSA-N 378.288 5.051 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(F)cc2OC(F)F)c1 748440638 PISLINWQKBQBSQ-RMKNXTFCSA-N 375.346 5.006 30 20 GKED COc1cccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)c1OC 750915967 JOXWTSLAMLUCOH-JLHYYAGUSA-N 376.424 5.231 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1OC 753143707 JXLGMWMDMHSALV-KTKRTIGZSA-N 394.496 5.289 30 20 GKED COc1cccc([C@@H](C)CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 753199001 QRDOSWXXUOQBIR-MHECFPHRSA-N 384.479 5.483 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2cc(C)ccc2C)c1 762041054 CUCDKMZQPLWRQS-NFBKMPQASA-N 391.515 5.031 30 20 GKED Cc1cc(/C=C(\Cl)c2nc(O)c3c4c(sc3n2)CCCC4)ccc1C#N 766482477 AZGZQMSFBNBYNJ-DHDCSXOGSA-N 381.888 5.193 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C2CCC(C(F)(F)F)CC2)cc1 774054999 URVMCFLNQMELNS-LEOMRAHMSA-N 394.437 5.045 30 20 GKED Cn1c(/C(Cl)=C\c2cc(C#N)cs2)nc2ccc(Br)cc21 776723663 JYWBSPYQQSFBDX-WUXMJOGZSA-N 378.682 5.006 30 20 GKED O=C1/C(=C\c2csc(-c3ccccc3)n2)CCc2ncc(C(F)(F)F)cc21 777467725 MVHAKOICMRIZMM-JYRVWZFOSA-N 386.398 5.436 30 20 GKED CC(C)Oc1c(F)cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1F 783758529 YRCDJWOIIKYMGM-UHFFFAOYSA-N 381.835 5.086 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1\S/C(=N/C2CCCC2)NC1=O 787476930 WHYJCSGLNAXYEP-YBEGLDIGSA-N 380.966 5.343 30 20 GKED C=CCn1c(SCSCc2ccc(Cl)cc2)nnc1-c1ccncc1 787487213 CUKLDKXSSLDISU-UHFFFAOYSA-N 388.949 5.163 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Br)s1)c1nccc2ccccc12 792092172 PEVLMKQTNWPAAS-INIZCTEOSA-N 399.313 5.258 30 20 GKED N#CC[C@@H](CC(=O)OCc1csc(-c2ccccc2F)n1)c1ccccc1 795985711 MJDMHFDSZLOTQW-INIZCTEOSA-N 380.444 5.080 30 20 GKED CCCCc1nc(-c2cccc(OC(=O)C[C@@H](CC#N)c3ccccc3)c2)no1 796595261 GVGSWHPJMCPOFN-GOSISDBHSA-N 389.455 5.072 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 796790653 UFQCCECDUNFXAA-UWHLTILDSA-N 380.532 5.065 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ccc(Cl)c(Cl)c2)s1 797567080 YIFHKBOTCMVCRR-GFCCVEGCSA-N 381.328 5.556 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(C3(c4cc(F)cc(C#N)c4)CC3)n2)cn1 809439847 IAFUMVIWXICKBU-UHFFFAOYSA-N 394.475 5.113 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 814630181 RJUFICYMLRVGHE-OAQYLSRUSA-N 395.572 6.442 30 20 GKED CN(CCCN1c2ccccc2Sc2ccccc21)C(=O)NCCCCC#N 858189499 LZYGTDPNOVGUIZ-UHFFFAOYSA-N 394.544 5.015 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)[C@H](C#N)CCc1ccccc1 862719037 RHIPURSNNJZOSY-SFHVURJKSA-N 393.487 5.053 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc3c(Cl)nccc3o2)ccc1OC 866297365 VBVLLZCGFVRIBT-UKRRQHHQSA-N 399.878 5.022 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc3c(F)cccc3s2)cc1 915902419 DYADINCTCYJLOT-UHFFFAOYSA-N 392.377 5.117 30 20 GKED O=C(Nc1cccc(/C=C/C(=O)c2ccc(F)cc2F)c1)c1ccc(Cl)cc1 916127987 BKJHZJYOHKETKZ-NYYWCZLTSA-N 397.808 5.767 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 916976955 YFOYOWMLXHHYPP-KZNAEPCWSA-N 396.874 5.583 30 20 GKED N#Cc1cc(NCc2cc3ccc(F)cc3nc2O)ccc1Oc1ccccc1 1620963277 PHNGLCAMIPVHNV-UHFFFAOYSA-N 385.398 5.356 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)cc1 1776215414 BOUVUCDRCXMJFL-KPVYPLCOSA-N 394.427 5.109 30 20 GKED CCc1c(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)oc2ccccc12 1776956181 GDNNPXDORMXKNN-NTMALXAHSA-N 399.240 5.352 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777372599 MSSJWZGIFPMPFJ-HUSFYUSLSA-N 398.458 5.519 30 20 GKED COc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)ccc1OC(F)F 26764790 FNZFVFUBFRXCQX-DUXPYHPUSA-N 379.211 5.561 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OC(F)F)cc3)n2)cc1 46443320 UVXBITOMGKCRDE-MRXNPFEDSA-N 384.407 5.210 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)c(C(F)(F)F)c2)sc2c1CCCCC2 64621590 JZHMCERGMYMDAM-UHFFFAOYSA-N 382.382 5.299 30 20 GKED C=CC1CCN(C(=O)c2cc3ccccc3cc2OCc2c(C)noc2C)CC1 110969745 FIKSMFXREBEJFX-UHFFFAOYSA-N 390.483 5.062 30 20 GKED O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117400005 HGBCOYBLSKUODA-UHFFFAOYSA-N 394.237 5.054 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 128407657 PTHJVRVJUNUYGB-SJLPKXTDSA-N 384.549 5.322 30 20 GKED N#CCCn1cc(CNc2cccc(CN3CCCCC3)c2)c(-c2ccccc2)n1 156492267 WLUZRCNRGDETRN-UHFFFAOYSA-N 399.542 5.062 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)C(=O)N1CCC[C@@H]1c1cccs1 163310401 SZZHQTLPRHSEKB-IUODEOHRSA-N 376.934 5.117 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 173788667 NZQCZLAZPYLWQY-CQSZACIVSA-N 393.874 5.153 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCc2[nH]nc(C(F)(F)F)c2C1 188062559 ICFGUOOAAIQWPU-CQSZACIVSA-N 391.437 5.024 30 20 GKED N#C[C@@H](C(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2[nH]1 255615593 COVKIBRDMKHODW-FYQHACEVSA-N 389.764 5.038 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](c1ccccc1)c1ncc[nH]1 297961800 XYWLXJLAZLMILK-QFIPXVFZSA-N 388.515 5.515 30 20 GKED Cc1ccc2[nH]cc(CC/C(O)=N/[C@@H]3CCCc4cn(C5CCCC5)nc43)c2c1 329479423 CPTFMTFRPUCZLH-JOCHJYFZSA-N 390.531 5.755 30 20 GKED CC(O)=Nc1cc(Cl)ccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330032746 VBYPENUNZWGFDM-UHFFFAOYSA-N 377.872 5.461 30 20 GKED CC[C@H](/N=C(/O)Nc1ccc(Br)cc1C(C)C)C1CCOCC1 330500311 OAXBBOLTRLTPKF-INIZCTEOSA-N 383.330 5.104 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC3(CCC3)C[C@@H]2C)cc1 433509449 JSTPPDKNAWITMV-INIZCTEOSA-N 391.471 5.156 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccccc2Cl)C2CCCC2)cc1 437916484 IVZQRQPZHBLBEQ-UHFFFAOYSA-N 395.934 6.118 30 20 GKED CC(C)=CCN(Cc1ccc(Cl)cc1)Cc1nnc(-c2cccc(C#N)c2)o1 439485241 IOEIHJRRUDWLKT-UHFFFAOYSA-N 392.890 5.230 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(Cc2ccccc2)no1 439577248 VRXSRCDBHZCZGI-QGZVFWFLSA-N 396.450 5.497 30 20 GKED N#CCCC[C@H](NC(=O)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2)c1ccccc1 458848944 SPSMHWWEHLSRRU-SMIHKQSGSA-N 385.511 5.451 30 20 GKED C[C@@H](CCCc1cccnc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 459408602 WZWVSCOZCFDSTA-DLBZAZTESA-N 382.533 5.009 30 20 GKED C[C@@H](C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1)c1cccc(C#N)c1 462076986 TYYNYFKEUFRSKC-QGZVFWFLSA-N 393.446 5.641 30 20 GKED CCN(C(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(C#N)c(Cl)c1 464187015 BYAIBDBQBDSDCO-UHFFFAOYSA-N 388.723 5.175 30 20 GKED Cc1cccc(Br)c1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 464406855 QTWMVOKMPPOHCJ-AWEZNQCLSA-N 398.087 5.059 30 20 GKED COCCc1ccccc1NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 466932847 DLWKQBCATFYBNO-GOSISDBHSA-N 399.494 5.297 30 20 GKED N#Cc1cccc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)c1 469873913 OJSFKHSMDCVURQ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cnc(C2CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)s1 470072090 NHZMNEZYWFJMRU-UHFFFAOYSA-N 387.508 5.010 30 20 GKED CSc1ccccc1CN(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 471277034 LEKSJEYZMRIKDJ-HNNXBMFYSA-N 385.558 5.324 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C[C@H]1CCCO1 475542912 AWVIZXFYLHAZEX-JOCHJYFZSA-N 392.543 5.752 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cc(OC)ccc1OC 475557074 WJDNRDHADHBDJP-INIZCTEOSA-N 382.504 5.438 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)[C@H](Oc1ccccc1C#N)C(C)C 475919504 MGJATMXAWPFONE-VQIMIIECSA-N 399.560 5.070 30 20 GKED COc1ccc(-c2csc(CNC(=O)c3ccc(C(C)(C)C#N)cc3)c2)cc1 476249546 SPISBJBGKSJDHU-UHFFFAOYSA-N 390.508 5.155 30 20 GKED C[C@H](NC(=O)NCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 479362328 OOPVPVDNSGHQER-LBPRGKRZSA-N 381.423 5.098 30 20 GKED CCOc1cc(CN[C@@H]2CCCCc3cc(C#N)ccc32)ccc1OC(F)F 481917094 PAZQFVPYIVHTJC-LJQANCHMSA-N 386.442 5.116 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)cc1Cl 483514444 AUQLHMVLOQNMGE-QGZVFWFLSA-N 391.883 5.442 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 485383290 LDMCHYNJTVDCIW-IIBYNOLFSA-N 381.545 5.766 30 20 GKED N#CCCCOc1cccc(N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)c1 494957003 VBWLBJSPRWSJPO-HSZRJFAPSA-N 387.439 5.479 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ncc(Cc2ccc(F)cc2)s1)c1ccccc1 497147539 OOSOPWXTDSNLEK-LJQANCHMSA-N 394.475 5.040 30 20 GKED CCOc1ccc([C@@H](NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 505319356 QNJVAJRQLGVVMS-UUOWRZLLSA-N 399.494 5.107 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 509246801 LGHOXGPFBPHCBB-ZDUSSCGKSA-N 377.366 5.121 30 20 GKED C[C@H](NC(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21)c1ccc(C#N)cc1 509904786 KZLIVWQPIIRDFU-SBUREZEXSA-N 397.478 5.109 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2c2cccs2)cc1 510648619 WBMBNGSJJTXQPC-LJQANCHMSA-N 389.480 5.781 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 511894573 SPXCYVQRPALACZ-UHFFFAOYSA-N 397.422 5.383 30 20 GKED C[C@H]1CCc2c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)csc2C1 515540915 GMLWZHAFVJGWJG-WCQYABFASA-N 385.439 5.108 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](C)c2ccc(OCC(F)(F)F)cc2)c1 516319446 SVARZBSVZORFFV-AWEZNQCLSA-N 394.393 5.075 30 20 GKED N#Cc1ccc(CNc2ccc(-c3cn4c(n3)CCCC4)cc2)c(C(F)(F)F)c1 519787874 FCTSAROTZRLPOP-UHFFFAOYSA-N 396.416 5.389 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520603396 FZDDTRGIJMYAKP-UHFFFAOYSA-N 385.467 5.447 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 520855262 GKMZRCPQIFCACH-YWZLYKJASA-N 399.535 5.986 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1-c1nccs1 520929359 WNSRVMAOIPBSRZ-CQSZACIVSA-N 396.541 5.197 30 20 GKED COc1ccccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 523877159 KWFGSRWHHDEWDP-UHFFFAOYSA-N 378.815 5.265 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@@H](Cc4ccccc4)C3)c2)cc1 525033311 GKCAPKJPMYOTLE-NRFANRHFSA-N 382.463 5.055 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC(F)(F)C[C@H]1C 528962884 IERRRCLGMQCHKB-MRXNPFEDSA-N 399.441 5.097 30 20 GKED CCN(C(=O)Nc1ccc(COC)c(C#N)c1)[C@@H](C)c1cc2ccccc2o1 529211958 QUSRWZXMZQKRCT-HNNXBMFYSA-N 377.444 5.066 30 20 GKED C=C[C@H](CC(=O)N(CC)[C@H](c1ccc(C)cc1)c1cccnc1)c1ccccc1 535399048 UVBXYGCRTXFQBI-QFQXNSOFSA-N 384.523 5.688 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)cc1 538339487 DLNHBCOSSPHPPR-GOSISDBHSA-N 383.879 5.177 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 541445119 JPVRNUBPNAAYBX-UHFFFAOYSA-N 383.879 5.195 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccc(C)o3)s2)cc1 542888152 RTIYXGOZJZCWHL-UHFFFAOYSA-N 380.469 5.276 30 20 GKED Cc1cc(C#N)ccc1-c1nc(-c2ccc(NC(=O)Nc3ccccc3)cc2)no1 547042336 RJJLHWKPHNATOU-UHFFFAOYSA-N 395.422 5.228 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2)Cc2ccco2)c(Cl)c1 556337152 XSIBRVPHZDNCEM-UHFFFAOYSA-N 396.899 5.126 30 20 GKED COCC[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)c(Cl)c1 562100623 UIBQEIWISBIOCY-VQTJNVASSA-N 375.299 5.220 30 20 GKED C[C@H](SCC1(C#N)CCC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 565647763 NEWLZIRIFZQEON-JTQLQIEISA-N 376.831 5.113 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)N(C)CCOCc1ccc(C#N)cc1 574552333 SRIUCALKQYMIOM-UHFFFAOYSA-N 399.922 5.017 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)nc(C)n1 588737123 ITZYDORSHRMIMD-KRWDZBQOSA-N 387.508 5.146 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cc(Cl)ccc2F)cc1 603637476 NDANBTJUJZFQND-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)s2)cc1Cl 603673172 DGAXOGAEWHGGEI-OAHLLOKOSA-N 387.291 5.963 30 20 GKED CCSCc1ccc(C(=O)N(Cc2ccco2)c2ccccc2C#N)cc1 603956596 VHORALLDIIWQLA-UHFFFAOYSA-N 376.481 5.251 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c(C)s1 609104149 QVYFJOQGDJMENK-UHFFFAOYSA-N 380.444 5.207 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCc2ccccc21 609398589 CEYGJKSFTFPXJC-AEFFLSMTSA-N 379.529 5.180 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccc(Cl)cc1 609428633 YDBUQFNAIILZNK-OAHLLOKOSA-N 388.920 5.532 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609503656 HHSLHOSYLLUYPO-QGZVFWFLSA-N 386.451 5.505 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1C[C@@H]1Cc1ccccc1 610187210 ZMZPUYQZIGRRTH-FPOVZHCZSA-N 384.504 5.070 30 20 GKED CCC[C@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610356017 HGFDGEKGFHDZPV-KUHUBIRLSA-N 389.421 5.479 30 20 GKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(NC(=O)c2ccccc2)c1 611390654 MZLXJYMWGYPJHK-AVRWGWEMSA-N 395.506 5.539 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cccc(C#N)c1 617598566 RZCLGZPOANGHDV-CYBMUJFWSA-N 375.394 5.281 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1Cl 619828227 PHOJSURAQPKTMM-NRFANRHFSA-N 392.890 5.130 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)c2c1 731195577 LRFNAECCGBHXFI-HNNXBMFYSA-N 389.238 5.051 30 20 GKED N#Cc1ccccc1COc1cccc(/C=C/C(=O)c2ccc(F)cc2F)c1 731319870 RWLFYMIPLYPEJS-DHZHZOJOSA-N 375.374 5.312 30 20 GKED C=CCN(C(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1)C(C)C 731754940 MYSXBXVKZZBZEO-QFIPXVFZSA-N 391.515 5.092 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1ccc(OC)cc1)CC(C)(C)C)c1ccncc1 734684109 STUIAUOSOFUYMN-JOCHJYFZSA-N 395.547 5.008 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 742509815 GKXHZVBRRCQCPN-UHFFFAOYSA-N 386.517 5.232 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)cc1 743056406 GKJAOVLYMGRNDK-NYYWCZLTSA-N 392.842 5.296 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccc(C#N)cc1 743475705 WWXOJNGRQJHDDL-MRXNPFEDSA-N 387.870 5.835 30 20 GKED CC/C(=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)cc1 746892089 PHATZHUEGQDBQG-SCDSTIRESA-N 380.513 5.522 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2Cl)o1)c1ccc(N2CCOC2=O)cc1 748584622 SXLXHFBIBNLITE-LUAWRHEFSA-N 393.826 5.453 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)COc2c(Cl)ccc(Cl)c21 753145104 VHPAXTDNNRRKAI-YRNVUSSQSA-N 389.263 5.171 30 20 GKED Cc1ccc(Oc2ccccc2)c(NC(=O)NCc2ccc(OCC#N)cc2)c1 753893956 QLEGFRZUUZDICA-UHFFFAOYSA-N 387.439 5.011 30 20 GKED C=CCN(C(=O)c1oc2ccccc2c1CSc1nc(C)cs1)C1CC1 754415349 FRKDCCLFXGIAMR-UHFFFAOYSA-N 384.526 5.281 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NOc1ccccc1C(F)(F)F 754712914 XFMFTSUTAYHFFA-UHFFFAOYSA-N 393.796 5.574 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCn2ccc3cc(Cl)ccc32)n1 760992998 FOUPXTMBISWIOB-INIZCTEOSA-N 385.920 5.531 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 764192475 MCYQDCNKEPPKPJ-GOSISDBHSA-N 391.814 5.156 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1ccc(Oc2cccc(F)c2)cc1 766491348 NVKVERZHEMVRHH-UNOMPAQXSA-N 382.460 5.121 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 770095837 FEXXMPJGXZBOGN-BEFAXECRSA-N 384.888 5.230 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1 770561541 XMTMQZWOSXQEFV-AREMUKBSSA-N 399.538 5.315 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(Cl)cc2)C(C)C)ccc1OC 774449644 PPBVBFCGZSGRNK-KNQAVFIVSA-N 386.923 5.516 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)Nc1ccccc1O[C@H](C)C#N 775722175 FRVFLQXRAYWRJN-MOPGFXCFSA-N 399.494 5.869 30 20 GKED O=C(Nc1cccc(C(F)(F)F)n1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 775734129 ROXOAZWMYVOQED-LLVKDONJSA-N 395.278 5.055 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)OC(=O)Cc1ccccc1CC#N 776938296 GJCHKJCPKLMJGM-OAHLLOKOSA-N 394.471 5.171 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CCCc3ccsc3)c2)cc1 783037828 XQJRIILVCCZLIB-UHFFFAOYSA-N 390.508 5.355 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@@H]2/C=C/c2cccs2)c1 783044738 URYYOAXNVLRMJC-DOJUMQAQSA-N 381.501 5.140 30 20 GKED C=C[C@](C)(CCOC)COC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 784635401 WQNQAEOBQIOTSC-GSHUGGBRSA-N 385.529 5.118 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](CCOC)c2ccc(Cl)c(Cl)c2)c1 789356856 MJDJPGRKIZGHPG-GOSISDBHSA-N 393.339 5.039 30 20 GKED N#C[C@@H](C(=O)CCn1c2ccccc2c2ccccc21)c1nccc2ccccc12 792101705 BZTZIKQJQJGSHJ-QFIPXVFZSA-N 389.458 5.609 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)(F)F)s2)cc1 796791048 BOCSZZSHWCZYRV-RISCZKNCSA-N 394.418 5.242 30 20 GKED O=C(Nc1cccc(C(F)F)c1Cl)c1cc(F)c(C(F)(F)F)cc1F 804557722 UOYASJCEPQCEIM-UHFFFAOYSA-N 385.666 5.827 30 20 GKED Cn1cc(/C=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C(F)F)n1 812241164 DUBPSLBUJUSZKU-IHWYPQMZSA-N 398.253 5.291 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2F)o1)c1nc(C2CC2)cs1 842939358 PHBWVEXVRYLMGB-MRXNPFEDSA-N 380.444 5.229 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1 860626528 VZXMLXXLMHRDBU-FRYIKTPZSA-N 391.540 5.206 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(Cl)nc2ccccc12 917715145 UDHIRRVWIFOIJV-UHFFFAOYSA-N 389.867 5.741 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cc2sccc2s1 918486669 KDTZCXSGMXFZAZ-NSHDSACASA-N 395.292 5.231 30 20 GKED COc1ccccc1C=NOCc1csc(-c2ccc(C(F)(F)F)cc2)n1 920257232 XNGFJGHCGFSRAS-UHFFFAOYSA-N 392.402 5.388 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2C(=O)O)c1)c1cc(F)ccc1F 1776113213 BNWGVWBLLXPDGU-DHZHZOJOSA-N 394.373 5.138 30 20 GKED Cc1cc(C(=O)/C=C\c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c(C)s1 1776133191 PIOQPTHZTWCCRB-TWGQIWQCSA-N 396.464 5.440 30 20 GKED C=CCOc1cccc(CN[C@@H](CCC(=O)O)c2ccc(Cl)c(Cl)c2)c1 1776184841 CSSYKTOZUQZUOZ-IBGZPJMESA-N 394.298 5.254 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C\C(=O)c2ccc(CC(=O)O)cc2)cc1Cl 1776353749 ZDAHKZWISKLNHH-FPLPWBNLSA-N 393.266 5.304 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C(C)C)c([N+](=O)[O-])c1 1776354431 HQXKMMCARARPCY-RMKNXTFCSA-N 397.427 5.100 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2cccc(OC)c2)c1 1776787950 JQMOVMRBAMBWND-HSZRJFAPSA-N 399.531 5.350 30 20 GKED COc1cc2ccccc2cc1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1777339065 BHNJNYIBYLIJTC-CSKARUKUSA-N 390.435 5.230 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791254569 TYBUITANKAUNHN-YRPNKDGESA-N 394.559 5.159 30 20 GKED Cc1cc(C(=O)/C(=C(/S)Nc2ccc(C)c(F)c2)[n+]2ccccc2)c(C)s1 11083286 LRCWMKHXOAESIF-UHFFFAOYSA-O 399.536 5.151 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2Oc2ccccc2)cc1OC 25455608 LXSNRXHVSATFDC-UHFFFAOYSA-N 375.424 5.305 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)CC(c2ccccc2)c2ccccc2)cc1 29202410 BNAXNYPDDNTCPC-UHFFFAOYSA-N 399.494 5.155 30 20 GKED N#CCCCOc1cccc(NC(=O)c2c[nH]cc2-c2ccc(Cl)s2)c1 64026757 BWXSVOGFYLARQZ-UHFFFAOYSA-N 385.876 5.331 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N[C@@H](C)c3ccc(C#N)cc3)oc2c1 65636094 BTSJXOKEVJGVMB-INIZCTEOSA-N 396.446 5.471 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1nc2ccccc2s1 66802000 UJXDDXNWYLNFNG-AWEZNQCLSA-N 381.526 5.262 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1 96749533 AXRQDWIMNTWUPW-UHFFFAOYSA-N 384.810 5.102 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccc(Oc4cccc(C#N)c4)cc3)o2)cc1 109014020 TWUNQQQGFWMGCD-QGZVFWFLSA-N 396.450 5.882 30 20 GKED N#C[C@@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc2cc(Cl)ccc2s1 119971322 RYTLPOHPBONCAY-INIZCTEOSA-N 393.899 5.630 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3ccccc3F)n2)cc1 122013066 VPDCSUSPJLPLHJ-KSSFIOAISA-N 394.471 5.013 30 20 GKED Cc1ccc(C(=O)N(CCC#N)CCC(C)C)cc1NC(=O)Nc1ccccc1 132886598 FEQHONAJCDVYNM-UHFFFAOYSA-N 392.503 5.041 30 20 GKED Cc1nc(-c2cccc(NCc3cn(CCC#N)nc3-c3ccccc3)c2)cs1 155739655 UOYJAQSWGUFGBH-UHFFFAOYSA-N 399.523 5.508 30 20 GKED C=C(C)Cn1c(SCc2csc(CCCC)n2)nnc1-c1ccncc1 156214783 BFZKCZAUZNESOQ-UHFFFAOYSA-N 385.562 5.008 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1nc(C)c(C)s1 175618436 LLRQGUXAGXHMFQ-UHFFFAOYSA-N 392.484 5.054 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 177088721 IPLYJADTOBWUPB-CYBMUJFWSA-N 389.471 5.273 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 179028621 WAZHAGLYGFGLGH-RTGRKSDTSA-N 379.872 5.138 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)cc1)c1ccccc1 190883205 IUXGABOTZZDJKX-UTKZUKDTSA-N 393.446 5.260 30 20 GKED CCN(c1ccccc1)c1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc1 237064485 OHBQBUVVLOLSSX-FQEVSTJZSA-N 385.511 5.425 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3ccccc3OC)cc2)cc1 237345023 YCZNNYYFEWZJKQ-UHFFFAOYSA-N 387.483 5.282 30 20 GKED CC(C)c1cccc(N(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303349521 DUZUHRCLNOLTCC-QGZVFWFLSA-N 381.545 5.137 30 20 GKED C/C(O)=N/[C@H](C/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1)c1c(F)cccc1F 328816990 OUIIHEWYVLJYNW-WFXMFSGNSA-N 378.463 5.688 30 20 GKED CC[C@@H](C)n1ncc(N=C(O)N2CCSC3(CCCCC3)C2)c1C1CC1 328933172 PNDMXLMKBAGVNK-OAHLLOKOSA-N 376.570 5.029 30 20 GKED O/C(=N/[C@@H]1CCOC2(CCCCC2)C1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329414919 CTRGKDGHHYWCTF-VQTJNVASSA-N 399.579 5.332 30 20 GKED CC(C)(C)c1nc(C/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)cs1 329474254 AWSGWCJZMQXBJS-KRWDZBQOSA-N 386.565 5.329 30 20 GKED C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1cccc(Cl)c1 329802876 ZHTAFXSJLVRABM-QRWLVFNGSA-N 384.907 5.000 30 20 GKED N#CCCn1ncc(C(=O)Nc2ccc(Cl)c(Cl)c2)c1-c1ccccc1 428308721 JDAXHYYXLRGFQK-UHFFFAOYSA-N 385.254 5.023 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 428953316 OLOSCONAURPTEP-IAGOWNOFSA-N 385.467 5.052 30 20 GKED O=C(Nc1cccc(OCC(F)(F)F)c1)c1cccc(C(F)(F)F)c1F 429870853 SMPUJKFCBUEMSX-UHFFFAOYSA-N 381.247 5.038 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c(OC2CCCC2)c1 430582234 JXMDUMFXPBHBND-QGZVFWFLSA-N 398.528 5.261 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1N1CCCCCC1)c1ccccc1 432690351 PNHLXVDLZGVECD-OAQYLSRUSA-N 390.531 5.624 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1 433019561 OGWVYTSUXANJSE-IBGZPJMESA-N 389.421 5.738 30 20 GKED Cc1noc(C(C)C)c1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437473950 NBPILPNSASSUAL-UHFFFAOYSA-N 379.391 5.162 30 20 GKED CCc1ccc([C@@H](NC(=O)CSc2ccccc2C#N)c2cccs2)cc1 439707522 XNVYZKVZGHZRDI-JOCHJYFZSA-N 392.549 5.180 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1)c1ccccc1 440234614 AUMZOSPUWQETFH-DEOSSOPVSA-N 383.495 5.443 30 20 GKED Fc1cc(C(F)(F)F)cc(C2(CNCc3cnc(C(F)(F)F)s3)CC2)c1 443997785 RNGNXVKMPUYEIF-UHFFFAOYSA-N 398.347 5.141 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1cn(CCCC#N)c2ccccc12 444139389 KGQGNPBYOHRKQS-UHFFFAOYSA-N 383.398 5.107 30 20 GKED N#Cc1cc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)ccc1F 444739568 UQGRRQUACYPUJE-INIZCTEOSA-N 390.302 5.499 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 458806431 WFPXEKJLBQUONL-HSZRJFAPSA-N 388.515 5.161 30 20 GKED Cc1nc(Oc2cccc(CNC(=O)Nc3ccccc3)c2)c(Cl)cc1C#N 461933444 GTWVXMYLWLUVFJ-UHFFFAOYSA-N 392.846 5.029 30 20 GKED N#Cc1ccc(Oc2cccc(-c3nc(-c4ncsc4Cl)no3)c2)cc1 463171930 RHYLEJBWSVIEBU-UHFFFAOYSA-N 380.816 5.177 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)c2ccc(C3=CCCC3)cc2)c1C 464052592 XYPAZZMELZNMFR-UHFFFAOYSA-N 382.467 5.180 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 471666375 WOYAYKYPLJUNFR-LBPRGKRZSA-N 392.286 5.043 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](c1ccc(C)cc1)c1ccccn1 472485476 YZAMWAJIRVELRJ-HSZRJFAPSA-N 389.474 5.016 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@H](c2ccccc2)C1 477340425 KEBWMAUTMXQHDW-OAQYLSRUSA-N 397.478 5.680 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1c(C)cc(Cl)c2ccccc12 480050369 XWNDSBWDKPNIPE-UHFFFAOYSA-N 398.890 5.497 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C 480548281 BXAYLTOAYVVAHD-IAGOWNOFSA-N 386.499 5.192 30 20 GKED CC[C@@H](C)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 480939334 IQRHOFNYYBBLFO-WBMJQRKESA-N 398.919 5.430 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](C(=O)Nc1ccccc1)c1ccccc1 481649407 DYXDYMZMPHMPSR-LOSJGSFVSA-N 395.506 5.295 30 20 GKED Cc1cccn2c(NC(=O)c3ccc(C(C)(C)C#N)cc3)c(-c3ccccc3)nc12 483129648 TUQXOTICQAYEOD-UHFFFAOYSA-N 394.478 5.363 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1nccc2ccccc12 490974823 PFBPQWAKQVPYSK-KRWDZBQOSA-N 393.368 5.242 30 20 GKED C=C(C)[C@H](NCc1cc(C#N)ccc1Br)c1ccc(F)c(F)c1 492819636 SWXUXJZLFQUQJI-SFHVURJKSA-N 377.232 5.006 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 498834938 GURQCQAEORHYJN-SFHVURJKSA-N 393.556 5.977 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(CCC(F)(F)F)cc3)CC2)cc1 502663210 CDTPOGWURMLTCQ-UHFFFAOYSA-N 399.416 5.374 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1c[nH]c2cccc(C)c12 503797342 OZQCVAALPXGQAH-UHFFFAOYSA-N 387.936 5.132 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)c1 505912549 MZMUGDRBBWZMIS-OAHLLOKOSA-N 384.810 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(OC[C@@H]2CCCO2)CC1 506045404 DOGQIJKBXDYSJO-CBNMVNINSA-N 385.548 5.231 30 20 GKED Cc1c(C(=O)Nc2cnn(CCC(C)C)c2C(C)C)sc2ccc(C#N)cc12 506995691 WCPBXHLSKTUWHU-UHFFFAOYSA-N 394.544 5.700 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1cccc(Cl)c1Sc1nc(C)cs1 509215589 NGSWAMOQHPDCQH-GFCCVEGCSA-N 382.938 5.176 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN(C1CC1)[C@H](C)c1ccccc1 512291241 GLVWAQPADFUMQR-QZTJIDSGSA-N 393.556 5.102 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCCCCC2)c1ccc(C(F)(F)F)cn1 513187257 WZEHEFMRVCQEBB-AWEZNQCLSA-N 378.419 5.311 30 20 GKED COc1c(C)ccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1C 524491124 WNPNSDQTOIPLAD-UHFFFAOYSA-N 386.451 5.015 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)Nc1ccccc1SC[C@H](C)C#N 524565786 IVGOPPCOPOKKJY-RDTXWAMCSA-N 397.544 5.675 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c1 531152290 SUWFMJIVZJCQQX-UHFFFAOYSA-N 375.859 5.005 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2C#Cc2ccccc2)n1 531968385 HZPRUOOKZRPYKB-DEOSSOPVSA-N 381.479 5.159 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(COCc3ccccc3)cc2)ccc1Cl 541626835 QHOCAFXPDHVXQF-UHFFFAOYSA-N 376.843 5.181 30 20 GKED C[C@H](NC(=O)Nc1c(F)cccc1F)c1ccc(-c2cccc(C#N)c2)cc1 543917007 RGFISPJFRKEVJP-AWEZNQCLSA-N 377.394 5.386 30 20 GKED CC(C)Cn1c(SCc2ccc(CC#N)cc2)nnc1-c1ccccc1F 544051437 ZKPGFHNRDNXZMP-UHFFFAOYSA-N 380.492 5.099 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)c1ccc(C#N)c(Cl)c1 547951224 MMXGCCUNIPCAMO-UHFFFAOYSA-N 396.899 5.124 30 20 GKED CC(C)CN(C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(C#N)cc1 549213814 NSSOCAFOGZKEEB-SFHVURJKSA-N 376.500 5.190 30 20 GKED C=C(C)Cn1c(-c2cc3ccccc3o2)nnc1N1CCC(OC(C)(C)C)CC1 549691515 IJTHSNRUOACFBG-UHFFFAOYSA-N 394.519 5.051 30 20 GKED C[C@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(OC(F)F)cc1 565564873 BJMQQZXEIYNPHH-QMMMGPOBSA-N 395.274 5.076 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCc2sc(Cl)cc21 566647692 JAFLGUYMAFTXRW-WCQYABFASA-N 391.949 5.605 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCSc1cccnc1C#N 566690149 ZFFXQIHGZOYKKV-UHFFFAOYSA-N 387.936 5.242 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 591589262 BETFTMFDCVPDHB-UHFFFAOYSA-N 399.928 5.521 30 20 GKED C[C@H](Nc1ccc(Cl)cc1C(=O)N1[C@H](C)CCC[C@H]1C)c1cccc(C#N)c1 600849351 OSEWCUBBBBOYTF-ZACQAIPSSA-N 395.934 5.788 30 20 GKED Cc1cccc(-c2noc(CNc3cccc(OCc4cccc(C#N)c4)c3)n2)c1 604007151 QPUWYIZCBUCFPF-UHFFFAOYSA-N 396.450 5.108 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609126597 MNHYBQRYHOBZAK-UHFFFAOYSA-N 386.451 5.699 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1c(Cl)cccc1Cl 609580183 DTEASGBNGGKYHB-GFCCVEGCSA-N 379.312 5.741 30 20 GKED Cc1csc([C@@H](C)NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 609724114 IYGPLHKWXWTXCT-CYBMUJFWSA-N 397.887 5.260 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1OCC1CC1 610142655 GWELPXGSNYQKPJ-HNNXBMFYSA-N 381.501 5.514 30 20 GKED CN(CCC#N)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 610196005 FDKQAJKJQMWPCV-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1SCC(F)(F)F)c1cccc(C#N)c1 610318316 NTZFNMXOYFSATJ-GFCCVEGCSA-N 379.407 5.095 30 20 GKED C[C@@H](CCNC(=O)N[C@@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610431968 KJRXEHKAJIJHAH-GJZGRUSLSA-N 389.421 5.131 30 20 GKED CC(C)[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 610792621 DEMPGIBYOQVYKE-VGSWGCGISA-N 393.556 5.726 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)C2)c1 612298525 AFXFFQRHOCCIEB-HXUWFJFHSA-N 398.466 5.075 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc2cc(F)ccc2s1 676591839 USHHIQXPCUYPRX-ZDUSSCGKSA-N 379.441 5.049 30 20 GKED CNC(=O)c1ccc(/C=C/C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1 727654102 HMHUEDUABDCOEG-LFYBBSHMSA-N 396.899 5.028 30 20 GKED C#Cc1cccc(N(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)C(C)C)c1 728246889 NMKMNEHBWGKEEE-UHFFFAOYSA-N 392.886 5.351 30 20 GKED N#C[C@@H](C(=O)c1sc2ccccc2c1Cl)c1nc2cc(F)ccc2s1 730421770 PCUJTZQFSXWOTH-NSHDSACASA-N 386.860 5.794 30 20 GKED CCOc1cc(/C=C/C(=O)c2cncc(F)c2)ccc1OCc1ccccc1 737442519 BQIVSVOJWMZINJ-CSKARUKUSA-N 377.415 5.095 30 20 GKED CSc1ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740429477 FEXUDEWGDSHKPI-UHFFFAOYSA-N 379.510 5.330 30 20 GKED CCOc1c(Cl)cc(C=NOCc2cc(C)nc3ccccc23)cc1OC 742350585 BNTGMOWWSLJOOH-UHFFFAOYSA-N 384.863 5.155 30 20 GKED Cc1nc(-c2cccc(C(=O)OCc3cc(Cl)ccc3OCC#N)c2)cs1 745672037 FXESIUVZLHMUOH-UHFFFAOYSA-N 398.871 5.031 30 20 GKED O=C(/C=C\c1cncc(F)c1)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750207437 SPCMQVZVBLOYQT-FOSCPCJNSA-N 393.258 5.100 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCc4c(F)cccc4C3)c2)cc1 757882091 LRMKIZAIFBAFFM-UHFFFAOYSA-N 387.414 5.080 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 758909427 BYOLAFGZPLZTJI-OALUTQOASA-N 379.500 5.349 30 20 GKED Cc1c([C@@H](C)NCc2ccc(C#N)cc2)cnn1-c1ccc(Cl)cc1Cl 765014969 ZBSBPUDKEAWKFZ-CYBMUJFWSA-N 385.298 5.210 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(F)c(C)c2)C2CC2)ccc1OC 774451518 YPIHUZZLIAJGFP-AUSIDOKSSA-N 382.479 5.065 30 20 GKED C=CCC[C@@H](C(=O)OCC(=O)Nc1c(Cl)cccc1Cl)c1ccccc1 778553559 WZLYCVUEJALLNA-OAHLLOKOSA-N 392.282 5.225 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl 780678943 ZIDUSOIJNQDLMU-OLZOCXBDSA-N 392.286 5.037 30 20 GKED O=C(/C=C/c1scnc1C1CC1)c1ccc(OC(F)F)cc1OC(F)F 782306361 RNUJYSHXVJTSPP-AATRIKPKSA-N 387.354 5.119 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 785677347 KPHGNDOKYTYNIY-DNQXCXABSA-N 392.462 5.023 30 20 GKED Cc1sccc1CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 786935039 LNBIFBAEWFBLKN-LBPRGKRZSA-N 380.416 5.104 30 20 GKED COc1cccc(C(=O)/C(=C\c2c(Cl)oc3ccccc23)c2ncc[nH]2)c1 787167254 BXXFHJBFCXDYKW-SFQUDFHCSA-N 378.815 5.241 30 20 GKED N#C[C@H](C(=O)CCCc1ncc(-c2ccccc2)o1)c1nccc2ccccc12 792092070 ORKZFGJKJXKEGG-HXUWFJFHSA-N 381.435 5.089 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 793279812 ALUHVSOLVTWKJW-OXQOHEQNSA-N 396.412 5.699 30 20 GKED O=C(/C=C/c1csc(-c2cccc(Br)c2)n1)c1ccnc(F)c1 794722887 YMGNQKDHJLMECT-SNAWJCMRSA-N 389.249 5.003 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1 795391545 XGWQPGDFEHHUMG-XZOQPEGZSA-N 382.463 5.074 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566456 KGDJRSMVVWRSHB-STQMWFEESA-N 376.909 5.046 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1nc2cc(F)ccc2s1 802077340 RCSZBOJWKNPAON-WFASDCNBSA-N 396.340 5.341 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 805857419 UMQAHKRONSBJAS-IIBYNOLFSA-N 397.503 5.413 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1ccncc1 806822134 WVHMHAATIDVASU-HXUWFJFHSA-N 387.886 5.113 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(N(C)C(=O)OC(C)(C)C)s1 810390288 DZDRKDBZHQJMHD-UHFFFAOYSA-N 392.565 5.328 30 20 GKED COc1ccc2oc(C(C)=NNc3nnc(-c4ccccc4)s3)c(C)c2c1 814946808 PUGOBRKOCRPSDY-UHFFFAOYSA-N 378.457 5.104 30 20 GKED Oc1c(F)cc(Cl)cc1CNC(CCC(F)(F)F)CCC(F)(F)F 827371751 ZGLNBBWHZCKLMI-UHFFFAOYSA-N 381.719 5.328 30 20 GKED CC1(C#N)CCC(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CC1 834933205 CDPCXSZRLRVUEA-UHFFFAOYSA-N 379.464 5.369 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)ON=Cc2ccccc2C(F)(F)F)c(Cl)c1 851982140 FBVYVDCBZBPDER-CYBMUJFWSA-N 398.812 5.353 30 20 GKED Cc1sc(NC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)c(C#N)c1C 876049229 VJYNRTHCMNSJAM-MHWRWJLKSA-N 382.485 5.617 30 20 GKED COc1cc([C@H](C)NC(=S)Nc2ccccc2C#N)ccc1OCCC(C)C 916025731 MGGVFMMPBFKPHI-INIZCTEOSA-N 397.544 5.039 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2sc3ccccc3c2Cl)cc1 916908932 GMXVVTLWTZHRDV-OAHLLOKOSA-N 382.872 5.078 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)SCc2ccccc2)cc1 916948401 GJFOKMBMKYMMAR-XGHQBKJUSA-N 394.540 5.169 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCSc2ccccc2)cc1 916953730 DMBBNDNTPMCZTD-OXQOHEQNSA-N 380.513 5.030 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H](C)Sc1ccccc1Cl 920104714 XNLDPWREVVSLMK-DZGCQCFKSA-N 396.899 5.202 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C)c(Br)c1C 1776784348 YDHFWUXMHRQMRB-QGZVFWFLSA-N 384.358 5.359 30 20 GKED COc1cc(Cl)cc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1777315326 JYRGXHTYURQFJX-FARCUNLSSA-N 382.799 5.203 30 20 GKED C=CCn1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 7442052 UKNXDNBIUQULQW-IBGZPJMESA-N 394.931 5.320 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cccc(C)c2C)cc1 10167797 MTZJTEKBBKQDRC-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2nc3ccccc3n2C(F)F)n1 39549000 LAEGWEJIEDWKIS-UHFFFAOYSA-N 398.360 5.318 30 20 GKED C=C(C)COc1cc(/C=C(/C#N)c2nc(-c3ccccc3)cs2)ccc1OC 60790402 SASIPPATRWVCBA-ODLFYWEKSA-N 388.492 5.838 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)n1C(C)C 66544799 WQPADQWTPSQSFN-LJQANCHMSA-N 388.496 5.171 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 66801603 IDOJMMCQKBNZTM-GDBMZVCRSA-N 392.446 5.756 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)cc1 108529709 FYTCPUPFBCGLNR-MAUKXSAKSA-N 383.517 5.220 30 20 GKED CCN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@H](C)c1cccnc1 115768589 UUDQZSGDWZTXKQ-QGZVFWFLSA-N 386.455 5.361 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1c(C(F)(F)F)ccnc1Cl 123749294 DCKPOZHBGMJPAC-UHFFFAOYSA-N 386.654 5.164 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H](C)c1ccncc1 129055662 ADWBZASJODZYGX-QGZVFWFLSA-N 386.455 5.279 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N(CCC#N)CC3CC3)c(C)c2)c1 176985500 MZSRHEAWBULEHS-UHFFFAOYSA-N 377.488 5.040 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(F)F)cc1 183843611 CMPKKCHNAKXNEP-CYBMUJFWSA-N 375.444 5.198 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 185012011 NVPXAODJKMIHOO-AWEZNQCLSA-N 392.484 5.041 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nnc(Cc2cccs2)n1C1CC1 186461739 GRDJPCGOBJVYEQ-UHFFFAOYSA-N 386.933 5.083 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ncc(Br)cc1F)c1ccc(F)c(F)c1 187567685 QIWDINDTRVBIKC-QLJPJBMISA-N 385.227 5.229 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C[C@@H](O)CC 191494198 UTQBTFCGGWYDRG-NRFANRHFSA-N 380.532 5.344 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc(C(F)(F)F)cc2)cc1OC 206862964 NDNVABDKJLPPAJ-YHYXMXQVSA-N 380.362 5.017 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(-c3ccccc3)cc2)ccc1OC 237021327 UBLUTQWVQCPJST-QHCPKHFHSA-N 386.495 5.333 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c1 303581609 DTYYXRUSOUKYTD-QGZVFWFLSA-N 386.451 5.097 30 20 GKED Cc1csc(Sc2c(Cl)cccc2N=C(O)[C@@H]2C[C@@]23CCOC3)n1 329659368 NTFSVUPEROPUFM-APPDUMDISA-N 380.922 5.271 30 20 GKED N#Cc1cscc1C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 410792363 OKBDVWDGZSQWMK-CYBMUJFWSA-N 392.324 5.062 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H]2CCCC[C@@H]2C1 429030960 SQPPWISQDZHBDK-RTBURBONSA-N 375.472 5.313 30 20 GKED C=CCC[C@H](NC(=O)NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 429085544 ZTAPMGNLHPQMCO-VJBWXMMDSA-N 378.516 5.161 30 20 GKED CC(C)c1ccc(CSc2nnc(S[C@@H]3CC[C@@H](C#N)C3)s2)cc1 430141052 PUUBLDCSVPHWGV-GDBMZVCRSA-N 375.588 5.738 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCc2ccc(F)cc21 432101185 YOUYRLAWEFUEGK-RDTXWAMCSA-N 383.492 5.277 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 439116833 HZHGXKDHHSEOFZ-UHFFFAOYSA-N 396.368 5.930 30 20 GKED Cc1c(C(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)ccc(C(F)(F)F)c1F 442934654 JAPBENXTWBDHRJ-WMZOPIPTSA-N 390.380 5.065 30 20 GKED CC(C)(C#N)CCCCN[C@H](CC(F)(F)F)c1ccc(Br)cc1 444688722 KOEYGCJZXIGPJL-OAHLLOKOSA-N 391.275 5.752 30 20 GKED COc1cc(SC)ccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 446977928 TUZDCBLTYCPZAC-UHFFFAOYSA-N 389.480 5.285 30 20 GKED CN(C)c1cccc([C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458796399 DXRNUZLELYJPGG-GOTSBHOMSA-N 390.531 5.034 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3nc(C)c(SCC#N)s3)o2)cc1 463599165 RTDGEMFYUQLJAV-UHFFFAOYSA-N 383.498 5.142 30 20 GKED Cc1nc(C)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 465394837 MZKWNASULYVKBW-UHFFFAOYSA-N 379.510 5.176 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SC[C@H]1CCC2(CCCCC2)O1 466429312 XGOVDCWWRAIMTB-LJQANCHMSA-N 399.560 5.017 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(OCC2CC2)c(F)c1 469414061 MWHNYHSREBVWSN-OAHLLOKOSA-N 388.508 5.135 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 474423989 BAXHLGRXFQMKMY-CQSZACIVSA-N 382.510 5.494 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)C[C@@H](CC#N)c2ccccc2)cc1 475118694 KAGJMMYBUNMYED-XMMPIXPASA-N 398.506 5.312 30 20 GKED CC[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nc(C)cs1 479693550 XDZHHZDYSKDBGT-GOSISDBHSA-N 393.537 5.356 30 20 GKED CCc1c(C)nn(-c2cccc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2)c1C 483210726 YYYONKOEBAZVEM-HSZRJFAPSA-N 394.478 5.090 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCO[C@H](c2cccc(C(F)(F)F)c2)C1 486801732 LUBMFMIGJUCISA-FQEVSTJZSA-N 388.433 5.080 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Br)cc1Cl)c1ccccc1 487486625 PHINUEYBNLKMSC-QGZVFWFLSA-N 391.696 5.267 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 488678335 UMPFTAMEJPCWRE-HSZRJFAPSA-N 398.506 5.936 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1coc(-c2cccc(F)c2)n1 488740336 YUOJDNSHLGDDRU-UHFFFAOYSA-N 379.338 5.058 30 20 GKED COc1ccc([C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 499002946 HWMFJHZDHXSSIE-MRXNPFEDSA-N 388.492 5.209 30 20 GKED N#CC1(CCCN2CCCC[C@H]2c2cccc(C(F)(F)F)c2)CCOCC1 499634708 WFKNERMTABQCEO-IBGZPJMESA-N 380.454 5.333 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCOC2CCCC2)cc1Cl 510005312 KPKWKLVGSNFXQM-FQEVSTJZSA-N 397.906 5.076 30 20 GKED C=CCOc1cccc(NC(=O)N(C)Cc2ccc3cc(OC)ccc3c2)c1 510986115 ORDBWCASJLSXQA-UHFFFAOYSA-N 376.456 5.077 30 20 GKED C[C@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1F 512295606 MHJIBAGZKYEAHI-AWEZNQCLSA-N 383.442 5.528 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4ccc(Cl)s4)nc3)cc2)CC1 512915340 RUJZAFMCIZDZNK-UHFFFAOYSA-N 379.872 5.271 30 20 GKED N#Cc1ccc(CC(=O)Nc2nc(-c3ccccc3)c(-c3ccccc3)o2)cc1 513166215 KWKBUGIJBMZCQF-UHFFFAOYSA-N 379.419 5.061 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C)c1nc(C(C)(C)C)no1 516379150 IOZYSIIWOFSFPO-HNNXBMFYSA-N 376.460 5.513 30 20 GKED CC(C)[C@@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 518885679 NNSMJPQYRFTZHN-CTNGQTDRSA-N 381.907 5.648 30 20 GKED N#C[C@H](C(=O)c1cc(-c2cccs2)nc2ccccc12)c1nc2ccccc2o1 519248819 IXHOTHVICUHOOW-MRXNPFEDSA-N 395.443 5.595 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C 519450824 KIUQYPVVLZRXRA-OXQOHEQNSA-N 381.545 5.847 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 519503874 PBMWXDUXCYOBDQ-UHFFFAOYSA-N 386.499 5.012 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 520835181 AHXBKVOYAHVEKJ-AWEZNQCLSA-N 388.920 5.631 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1CCSc2ccccc21 521377505 KAJRGPKJYTZAHE-OAQYLSRUSA-N 384.504 5.371 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(Br)cc1Cl 521413232 NUIVXKFAVHQYOV-UHFFFAOYSA-N 399.741 5.062 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 521494788 AOBFGRSVZWYEBE-UHFFFAOYSA-N 384.435 5.261 30 20 GKED C[C@H](CCc1ccco1)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522573073 FERBIGHEXDPKGQ-OAHLLOKOSA-N 394.858 5.348 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc4ncccc4c3)cc2F)c1 524455424 VIZQTTYAKQTKJX-UHFFFAOYSA-N 397.409 5.077 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccc(F)c(C#N)c1 524460379 JXNFKMAZSBCMGF-UHFFFAOYSA-N 395.437 5.402 30 20 GKED C[C@@H](CCc1ccccc1)SCC(=O)Nc1ccccc1SC[C@H](C)C#N 524613841 JSYGXCKCFRLLOP-MSOLQXFVSA-N 398.597 5.631 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cc(F)ccc1F 525417169 VPKGHMXVVDJOOK-SUMWQHHRSA-N 389.471 5.632 30 20 GKED C=CCC[C@@H](NC(=O)Nc1c(CC)noc1C)c1ccc(C(F)(F)F)cc1 533659978 IKEJVBHFIGDPDR-MRXNPFEDSA-N 381.398 5.393 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC=C(C(F)(F)F)CC3)cc2)cc1 534568753 AWAIYULYYLEZTO-UHFFFAOYSA-N 387.361 5.077 30 20 GKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 537926724 HFTFQLIFJREMDL-BEFAXECRSA-N 381.451 5.071 30 20 GKED C=CCC[C@H](NCc1ncc(-c2ccccc2Br)o1)c1ccccc1 538257328 WLJCPDCSOFAEKV-IBGZPJMESA-N 397.316 5.901 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cnc(-c3cccs3)s2)cc1 539104303 PHRNFGNMPALTBU-UHFFFAOYSA-N 387.533 5.700 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CC1CCC(C(F)(F)F)CC1 543101935 NVKNASQBAZWFBX-SOTJZCEJSA-N 378.438 5.044 30 20 GKED C=CCN(C(=O)CC1CCC(C(F)(F)F)CC1)c1nc2c(s1)CCCC2 544030087 YJOUZSJSHLLLDO-UHFFFAOYSA-N 386.483 5.300 30 20 GKED C[C@@H](C#N)CNC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 548085860 FVZNTTGVOMDRRL-NSHDSACASA-N 386.864 5.023 30 20 GKED C=CCC(C)(C)c1noc(-c2c(-c3cccc(Br)c3)noc2C)n1 551135964 HCTQNGDIKLNSDS-UHFFFAOYSA-N 388.265 5.316 30 20 GKED CCNc1ccc(C#N)cc1NC(=O)c1cc(SC)c(Cl)cc1Cl 552106120 YDTTWCZKVOCLJE-UHFFFAOYSA-N 380.300 5.271 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C#N)cn1C(C)(C)C 555406955 HEEZZQYGGAUAOD-UHFFFAOYSA-N 376.913 5.050 30 20 GKED C[C@@](C#N)(NC(=O)c1ccc(-c2nc3ccccc3s2)o1)C1CCCCC1 557898736 DUBVESLQMUEOIX-NRFANRHFSA-N 379.485 5.149 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@@H](C)N[C@H](CCCC#N)c1ccccc1 559856973 APIYGOZBORYKFD-DENIHFKCSA-N 377.532 5.552 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1cccc(CSc2ccc(C)cc2C)c1 564171022 TUBDALASUVWMMX-QFIPXVFZSA-N 398.597 5.361 30 20 GKED COc1cc(C2(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CCC2)ccc1C 570233541 OBMDJKVVJDKKHQ-INIZCTEOSA-N 394.540 5.316 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3OC(F)F)c2)cc1 572080251 IURSXKGRVPLXJO-UHFFFAOYSA-N 379.366 5.156 30 20 GKED CCC[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 573171081 ZYFKRFMTGMQVMW-JOCHJYFZSA-N 378.476 5.180 30 20 GKED CCOC1(C)CCN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CC1 573670906 JSOWVJYWBLLSLE-UHFFFAOYSA-N 398.890 5.035 30 20 GKED Cc1noc(-c2ccc(C)c(NC(=O)c3sc4ccc(C#N)cc4c3C)c2)n1 576573687 WKCJATCYGOWFOC-UHFFFAOYSA-N 388.452 5.001 30 20 GKED C=CCn1c(-c2ccc3ccccc3n2)nnc1N1CCC[C@@H]1c1ccsc1 579894436 VHGNCEQGNKHNCT-HXUWFJFHSA-N 387.512 5.082 30 20 GKED CC(C)n1c(Cc2c[nH]c3ccccc23)nnc1N(C)[C@@H](C)c1cccc(C#N)c1 580063206 OVYDIFCLIJUMSD-KRWDZBQOSA-N 398.514 5.000 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2cccc(Br)c2)c1 589740254 OKYATVCZNPYNJZ-UHFFFAOYSA-N 389.293 5.068 30 20 GKED CC[C@@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 594093000 LGJDPFAJDPQKOO-ZQHZRZASSA-N 385.467 5.079 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(CCC(F)(F)F)CCC(F)(F)F 595088353 AVGGXLFGEPTNRI-MRXNPFEDSA-N 378.360 5.579 30 20 GKED COCc1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 603673314 DBANKUKKAFVAPB-NRFANRHFSA-N 390.870 5.394 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(c4cccc(Cl)c4)CC3)cn2)cc1 603763504 CRLLKGFAJSIQKS-UHFFFAOYSA-N 389.842 5.069 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 604480862 ZIMPOOSQQZKTLH-JTQLQIEISA-N 399.566 5.490 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606173817 AARHHMUSIUMMET-ZZVYKPCYSA-N 399.350 5.030 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609188609 JZOXOYGOOUKCDW-UHFFFAOYSA-N 375.472 5.143 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3c[nH]c4cc(F)ccc34)cc2)c1 609427434 SSZMZQLNARCDPI-UHFFFAOYSA-N 385.398 5.152 30 20 GKED CCN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1cc(C)ccc1C 609642035 SWFKOVOVBPQCQV-UHFFFAOYSA-N 384.479 5.421 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2cccc(CC#N)c2)cc1 610191632 RPZDKXRUSWBYEK-SFHVURJKSA-N 384.479 5.261 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 610361736 JPAJKSFUTRCCRN-HNNXBMFYSA-N 394.396 5.735 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1Cc2cccc(F)c2C1 622692552 GCNOEAMAQNJLJO-UHFFFAOYSA-N 377.259 5.019 30 20 GKED Fc1ccccc1-c1nc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)co1 625102369 ZIIJXGZDAORUCG-PHIMTYICSA-N 396.306 5.043 30 20 GKED Fc1ccc(-c2nc(CN3CC4CC3(C(F)(F)F)C4)co2)cc1C(F)(F)F 625468085 FVYWIMGPJWWMPH-UHFFFAOYSA-N 394.290 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1ccc2c(c1)OCCCO2 626633943 QRKIHMXETKLDLY-UHFFFAOYSA-N 393.527 5.661 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Cc1csc(-c2ccc(CC)cc2)n1 642112953 GKMCIZCMUBLRCS-UHFFFAOYSA-N 376.525 5.130 30 20 GKED C=CCn1c(SCc2csc(C(C)(C)C)n2)nnc1-c1ccc(F)cc1 642252590 DNGYEQVPGYDNOY-UHFFFAOYSA-N 388.537 5.317 30 20 GKED FC(F)(F)C(F)(c1ccc(-c2nnc(C3CC3)n2C2CC2)cc1)C(F)(F)F 665207530 PILZCBYHUXAKKL-UHFFFAOYSA-N 393.306 5.447 30 20 GKED C=C[C@](C)(CCOC)c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 685236089 YUNPTPRQMQEIDK-OAHLLOKOSA-N 394.315 5.254 30 20 GKED O=C(NC[C@@H]1CCCC[C@@H]1C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 685772859 GUSSBQXHXFXJRU-WPRPVWTQSA-N 389.286 5.082 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccs2)Cc2ccccc2OC)c1 726441752 NSSBNFASWFQQCO-UHFFFAOYSA-N 392.549 5.137 30 20 GKED C#Cc1ccc(C(=O)N(Cc2cccc(F)c2)[C@@H](CC)c2ccc(F)cc2)cn1 728815523 HIABKNADCLVWPW-QHCPKHFHSA-N 390.433 5.135 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730422094 TYMFEFALBWGTKT-JNNRSPCRSA-N 388.508 5.089 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1nc2ccccc2s1 730688078 ZAEGHNPUQOHQNF-MGPQQGTHSA-N 387.291 5.583 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@H](C#N)C(=O)NC3CCCC3)sc2c1 732708142 MAQLWKUXJNPZJS-HNNXBMFYSA-N 388.920 5.059 30 20 GKED C=CC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccncc1 734510810 ZPSUZWNTJLWEAP-IBGZPJMESA-N 383.835 5.310 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2cccc(F)c2)cc1 734964671 YVGIPSTXPMRBOK-HRAATJIYSA-N 380.463 5.009 30 20 GKED COCCOc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3OC)cc2)cc1 741470769 VFZGBEQSNGHYDW-SXGWCWSVSA-N 388.463 5.284 30 20 GKED COCc1nc(CON=C(C)c2ccc(OCc3ccccc3C)cc2)cs1 742356664 UMVWUOWSNXMDDI-UHFFFAOYSA-N 396.512 5.118 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)cc1 743055584 GGZHFLBIKDBJAP-LFYBBSHMSA-N 376.481 5.666 30 20 GKED N#CC(CCOC(=O)c1c(F)cc(F)cc1F)(c1ccccc1)c1ccccc1 745151868 UAVCIRAOMXEQDK-UHFFFAOYSA-N 395.380 5.161 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)CCOc3ccccc3)n2)cc1 745948377 YXSSKPRYCUQFQV-YLJYHZDGSA-N 390.508 5.400 30 20 GKED COc1ccc(CNC(=O)c2sc3cccc(Cl)c3c2Cl)cc1C#N 746877168 JFFWRPJJNJUVFQ-UHFFFAOYSA-N 391.279 5.018 30 20 GKED Cc1ccc(-c2ccc(/C=C/C(=O)c3ccc(N4CCOC4=O)cc3)s2)cc1 748584413 QBCQCEKIPICVCG-ZRDIBKRKSA-N 389.476 5.576 30 20 GKED C[C@H]1/C(=C/c2cnc(-c3ccccn3)s2)C(=O)c2cccc(Br)c21 753143829 IQSIMZUTTCIBBN-HOXUKUGESA-N 397.297 5.351 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc2ccccc2c1 753400300 MANYTTMXWBDBEP-KKSFZXQISA-N 382.488 5.943 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cncc3ccccc23)cc1 765591411 SSSIDDMRVNSQKH-HXOBKFHXSA-N 399.494 5.028 30 20 GKED CCOc1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc1[N+](=O)[O-] 765616213 MIVDIFLUAZQMTQ-SNAWJCMRSA-N 386.454 5.075 30 20 GKED N#CCCCn1cc(C(=O)OCc2ncc(-c3cccs3)o2)c2ccccc21 769547658 WIOZNXMGEDBBJK-UHFFFAOYSA-N 391.452 5.019 30 20 GKED COc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1F 770054248 OWFWXOBMIIDEMJ-UHFFFAOYSA-N 378.428 5.109 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1ccccc1O[C@H](C)C#N 770652844 MDCQKGQVAYBFKH-RHSMWYFYSA-N 391.393 5.101 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2C[C@H](C(C)C)c3ccccc32)ccc1OC 774235509 FWZSRCUZIJTIIE-STZQEDGTSA-N 378.516 5.350 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(CC[C@H](O)c4ccccc4)cc3)cc2)CC1 777409863 PFUSGHGFIYOCRO-DEOSSOPVSA-N 396.490 5.160 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1c(O)c(Cl)cc(Cl)c1Cl 780979619 BVFDRCNDSJSNHM-LLVKDONJSA-N 381.687 5.262 30 20 GKED C#CCCCCCC(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 783536590 OHVBFQHRQKFTBF-MRXNPFEDSA-N 379.344 5.351 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)n2)cc1 796890250 SYJRGAHGMZGDFB-VBSBHUPXSA-N 389.524 5.465 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)COc2c(Cl)cccc2Cl)s1 797571705 VBRTZXKPMQHPPX-JTQLQIEISA-N 383.300 5.003 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc2ccccc2c1OC(F)F 814820540 HKGYILMTIMJIEM-UHFFFAOYSA-N 384.386 5.260 30 20 GKED CC(=NNc1nnc(-c2ccccc2)s1)c1nc(-c2ccccc2)cs1 814947856 MZYJRFQUSKEOSY-UHFFFAOYSA-N 377.498 5.165 30 20 GKED CCC(=NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(C)nn(C)c1C 814949131 UQCBTZGFZMRHHU-UHFFFAOYSA-N 392.347 5.301 30 20 GKED CSc1ccccc1NC(=O)[C@H](C)ON=Cc1cccc(Cl)c1Cl 818618613 UUPYMYGHCZFFAG-NSHDSACASA-N 383.300 5.093 30 20 GKED C[C@H](NCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1 820802931 CZPJFWKOBRBITG-KRWDZBQOSA-N 391.515 5.097 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(Cl)n2)cc1Cl 821671898 POMJTOLSJWMARD-AWEZNQCLSA-N 388.279 5.358 30 20 GKED O=C(O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ccc(C(F)F)nc1 846909974 LYGIXXDJJYHFMQ-GFCCVEGCSA-N 399.237 5.498 30 20 GKED C[C@@H](Oc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047472 YBNSKJVIMCONOX-PWSUYJOCSA-N 391.279 5.247 30 20 GKED CC(=NNc1ccc(Cl)cn1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776094339 NPQXYNOIIMZKEG-UHFFFAOYSA-N 381.819 5.062 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)o2)cc1 1776125263 BMZMGYPRPWXBJC-UJGDBWEASA-N 384.472 5.778 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(Oc2ccccc2)cc1 1776126834 YTZMNUZPFCHTJH-QINSGFPZSA-N 388.419 5.229 30 20 GKED O=C(/C=C\c1cc(F)c(C(=O)O)c(F)c1)c1ccc(OCc2ccccc2)cc1 1776127329 PTCTYXOFPPBSFX-WDZFZDKYSA-N 394.373 5.138 30 20 GKED CC1(C)/C(=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776515380 ZFOBRKILCLXZRT-KZVLXBEFSA-N 398.458 5.449 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2cccc(C)c2C)c1 1776787646 DYKIZBJAPUTPLZ-DEOSSOPVSA-N 397.559 5.958 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C)c2ncc(C(=O)O)s2)cc1 1776788267 VIRANNBQPJCJJY-HNNXBMFYSA-N 376.522 5.041 30 20 GKED O=C(O)COc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 6471890 ANLPBKAGFIBTAU-FPYGCLRLSA-N 385.630 5.006 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(CC)cc2)[n+]2ccccc2)cc1 28605917 HBJPODYOUZFVMH-UHFFFAOYSA-O 389.544 5.150 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc(-c2ccsc2)s1 112246779 ACGGEOPWWGOURJ-LBPRGKRZSA-N 385.539 5.518 30 20 GKED N#CC1(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CCCCC1 115114285 IFOLUDYXXYHLJM-UHFFFAOYSA-N 381.863 5.005 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2c(C)oc(-n3cccc3)c2C#N)c(C)c1 116272553 IGAQXTFYZNCMLD-OAHLLOKOSA-N 393.512 5.702 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 118444515 BLWHPDIGNFQMDR-HZPDHXFCSA-N 395.553 5.243 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1ccc(C(F)(F)F)cn1 123742009 PJBPPWOKVGVKLH-GFCCVEGCSA-N 392.686 5.263 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 128589394 MLGROLYEMYZGCG-OAQYLSRUSA-N 389.430 5.108 30 20 GKED C=CCOc1cccc(CNc2cccc(CS(=O)(=O)C3CCCCC3)c2)c1 132515131 JEBJIWQJFLVVCA-UHFFFAOYSA-N 399.556 5.111 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 155673381 WROIPLMQPVJSGN-CYBMUJFWSA-N 388.279 5.363 30 20 GKED CCOc1cccc2[nH]cc(CC(=O)Nc3ccccc3S[C@H](C)CC#N)c12 188640027 GZVIOACXYGDZSF-OAHLLOKOSA-N 393.512 5.142 30 20 GKED C=CCOc1cc2ccccc2cc1C(=O)Nc1cc(Cl)c(OC)cc1OC 301582208 QNHCKGVHDHYJDY-UHFFFAOYSA-N 397.858 5.328 30 20 GKED CC(C)COc1ccc(CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 303379202 VKKCMXBFGYJSSK-QGZVFWFLSA-N 382.529 5.297 30 20 GKED C[C@@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1ccc(C#N)cc1 303670139 GDMHKQNXDGSROM-SECBINFHSA-N 382.798 5.126 30 20 GKED C[C@H](Oc1ccccc1Cl)/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329489730 HPWUNHIIMBCLDJ-KSSFIOAISA-N 387.911 5.453 30 20 GKED OC(=Nc1cc(N=C(O)[C@H]2C[C@H]3C=C[C@H]2C3)c(F)cc1F)[C@H]1C[C@H]2C=C[C@H]1C2 329907458 KYEKFRVSJWLEJU-QNILMXGZSA-N 384.426 5.565 30 20 GKED CC1=C[C@@H](C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 431904638 UNKPYDAQJZBSRH-FOIQADDNSA-N 379.891 5.425 30 20 GKED Cc1cc2sc(NC(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)nc2cc1F 434530037 LNBGORUMZFKBFF-YJBOKZPZSA-N 394.475 5.048 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)o1 438636543 LCYJSZVEGMPJPN-KRWDZBQOSA-N 391.393 5.628 30 20 GKED Cc1oc(C#N)cc1C(=O)N(c1cccc(N2CCCC2)c1)C1CCC(C)CC1 439084013 FMUSBVKTYRZPMH-UHFFFAOYSA-N 391.515 5.285 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1cccnc1C 439232136 GDPKJLIWQXBFFC-UHFFFAOYSA-N 391.858 5.374 30 20 GKED C[C@@H]1CCC[C@@](C#N)(NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)C1 442710029 BBJWEASHNGMSRA-CWTRNNRKSA-N 376.287 5.191 30 20 GKED CC(C)Oc1cc(F)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444356753 LOEHKSWUBQNAAU-UHFFFAOYSA-N 379.435 5.124 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1c(F)cc(C#N)cc1F 446083108 ZZRBLGQCMWLXCK-CQSZACIVSA-N 382.435 5.302 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)cc2)nnc1N1CCC[C@@H]1c1csc(C)n1 460547690 XJXSROHTQICZOQ-GOSISDBHSA-N 399.951 5.281 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)nc(C)n1 473941774 PDGQWEUWEQOBOV-QGZVFWFLSA-N 395.821 5.168 30 20 GKED COc1ccc(-c2ccc(CNC(=O)C[C@H](CC#N)c3ccccc3)cc2)cc1 476181015 XJPLVHJYGLDORF-QHCPKHFHSA-N 384.479 5.066 30 20 GKED Cc1cc(Br)cc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 486356048 UADVTADSZGJLIM-RTBURBONSA-N 398.304 5.061 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 487799702 OZHAYLCLLLIYIP-QFIPXVFZSA-N 385.467 5.629 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cc(C)nc4ccccc34)o2)cc1 489769825 BHVPGFHYAXGIAY-UHFFFAOYSA-N 389.480 5.450 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1cc2ccccc2s1 495440498 SZOUZHLDKISUBR-KRWDZBQOSA-N 396.560 5.528 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)[C@@H]3CCCc4ccccc43)c2)cc1 501447235 IZFMLCLCFMNAQH-RUZDIDTESA-N 396.490 5.390 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2cccc(OCc3ccccc3C#N)c2)C1 504930733 QBYKNYMBBQBLEP-QFIPXVFZSA-N 396.490 5.075 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1 518710265 UWXDVZOFBAMDOC-IAQYHMDHSA-N 397.689 5.104 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1ccc(F)c(C(F)(F)F)c1 519092252 UHWNBJDNRDMRLY-UHFFFAOYSA-N 388.320 5.156 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519988126 GDZCNPXOAGFPAX-UHFFFAOYSA-N 389.480 5.632 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC[C@H](c2ccncc2)C1 521671886 AZCBHAMLLGPNBR-FQEVSTJZSA-N 399.519 5.124 30 20 GKED CC(C)(C)Cc1nc2cc(NC(=O)CSc3ccc(C#N)cc3)ccc2o1 521770989 ZZAKJQDHBPIXGG-UHFFFAOYSA-N 379.485 5.019 30 20 GKED C[C@@H](CC(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2)c1cccnc1 522887783 KJYDBKDIFLWDCU-GOEBONIOSA-N 381.545 5.298 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(-c4cnco4)cc3)c2)cc1 523156434 WGKGQLSBRGDEPR-UHFFFAOYSA-N 380.407 5.209 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC3(c4ccccc4)CC3)n2)cc1 528932417 GYDWVTCAYXPSBM-LJQANCHMSA-N 388.492 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2ccccc2)CCOCC1 530553118 KUYPVOUCMPLXLM-UHFFFAOYSA-N 378.516 5.366 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1ccc(C#N)cc1OC(F)F 534476464 SZEAUTIQIUDGMV-ZDUSSCGKSA-N 379.476 5.241 30 20 GKED C[C@@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)c(F)c1 540707517 GRRPQVAZOWLGME-ZHRRBRCNSA-N 378.422 5.307 30 20 GKED Cc1ccc(CCCSCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 543151736 YOPAMMVPUKKOLO-GOSISDBHSA-N 398.597 5.551 30 20 GKED COC(=O)c1cccc(CN[C@@H](C)c2ccc(Cl)c3ccccc23)c1C#N 547316139 NWNRLPCKWFWNRC-AWEZNQCLSA-N 378.859 5.002 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Cl)cc(F)c2Br)cc1 550254737 PZLVMDPQGQJYBV-UHFFFAOYSA-N 395.659 5.295 30 20 GKED N#C[C@@H](C(=O)c1cnc(C2CC2)s1)c1nc(-c2ccc(Cl)cc2)cs1 552498058 NSMDKAVQKSLLRP-ZDUSSCGKSA-N 385.901 5.287 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cccc(-c2cccs2)c1 554421951 FBICIGNNSXBXCF-UHFFFAOYSA-N 382.485 5.111 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCCc2nc(-c3ccccc3)sc21 561130813 IDXQFMJRRLJLIV-LEWJYISDSA-N 385.536 5.726 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 571709218 WUQYBMROVOXILB-HNNXBMFYSA-N 394.346 5.479 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 573397398 XOSDXIAWBZDDMH-SFHVURJKSA-N 389.499 5.128 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccc(C(F)(F)C(F)(F)F)cc3)CC2)cc1 586793450 CCKJXJYOLOLQSJ-UHFFFAOYSA-N 395.375 5.293 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@H](C)c2nc3ccccc3s2)c1 589741188 VIDGLEBTJAAHOJ-OAHLLOKOSA-N 381.501 5.476 30 20 GKED CCCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H](C)c1ccc(C)o1 590942333 KUHPPBSPLHPNNA-CTNGQTDRSA-N 381.520 5.896 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(F)cc3F)cc2Cl)cc1 604027134 IDSCGLJFQDHBBB-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C[C@@H](NC(=O)NCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 604097435 LPFNYAUEMJAALP-MRXNPFEDSA-N 389.430 5.050 30 20 GKED C=CCCO[C@H](C)C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 607040549 XACNNAOPWBIYQW-IEBWSBKVSA-N 382.504 5.110 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CCCc2ccccc21 609399231 JDHUIJMCCMLQPW-JXFKEZNVSA-N 379.529 5.480 30 20 GKED C[C@@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cccc(C#N)c1 610344914 MCCDSQVCHJMQBN-MRXNPFEDSA-N 389.886 5.315 30 20 GKED CC(C)[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 610792619 DEMPGIBYOQVYKE-JTSKRJEESA-N 393.556 5.726 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2c(F)cccc2Cl)c1 612391502 HOMMSALCRYVOPO-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 619783837 DLNKTQMTZMAIHO-UHFFFAOYSA-N 396.277 5.412 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 651380646 AIGSEAJXELUTGN-CYBMUJFWSA-N 383.473 5.082 30 20 GKED Fc1ccc([C@H](NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)C2CC2)cc1 678685326 STVAFHRTMMBSAA-HEHGZKQESA-N 383.351 5.776 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)s1 681351603 DKVQVXWFVUYIEZ-GOSISDBHSA-N 383.476 5.465 30 20 GKED CC(C)C[C@@H](C)CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 727953359 GMTAEZAWTOJLPN-IEBWSBKVSA-N 378.472 5.199 30 20 GKED N#CC(CCOC(=O)c1cnc(C2CC2)s1)(c1ccccc1)c1ccccc1 729773670 UABBMPSFNVACPF-UHFFFAOYSA-N 388.492 5.077 30 20 GKED CC(=NNc1ccc(Br)cc1C(F)(F)F)c1cnn(C(C)C)c1 731487412 SRKHMAXVDRDQLQ-UHFFFAOYSA-N 389.219 5.081 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2CC2CCCCC2)c1 733805323 QUANZHOKVMCGPC-NHCUHLMSSA-N 383.536 5.012 30 20 GKED COc1ccc(CN[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1C#N 742366696 POKOQWUZAGBVPN-DEOSSOPVSA-N 388.536 5.386 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743092811 DQCKZNQZFDCIES-UTKZUKDTSA-N 381.545 5.337 30 20 GKED C#CC[C@@H](NC(=O)N(CC)Cc1cccc(-c2ccncc2)c1)c1ccccc1 757775411 YOQMJPJHISPPAE-XMMPIXPASA-N 383.495 5.045 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc3c(s2)CCCC3)ccc1OC 772984295 CSNVTCIPALOEIV-YJBOKZPZSA-N 384.545 5.167 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2SC(F)(F)F)s1 797567266 FKPQFXSHQXTLST-LLVKDONJSA-N 384.448 5.543 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C\c2ccccc2OC(F)(F)F)s1 797571080 NIUOELCHQBRSJY-YXVBKTCISA-N 394.418 5.229 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 814311673 IGFXBTIRLSTMCR-LEWJYISDSA-N 389.499 5.167 30 20 GKED CCc1oc2ccccc2c1C=NO[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C 818618320 TYSFZMSZVYICMA-KRWDZBQOSA-N 378.472 5.298 30 20 GKED O=C(CCCC(F)(F)F)OCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1 859621642 NGPFZUMSIHUDSX-UHFFFAOYSA-N 399.262 5.275 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccncc2)cc1 863197635 VHRIHNDSILKTPW-HJCTWCACSA-N 384.483 5.268 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 917046491 KKHFGHRVVHTISW-HNNXBMFYSA-N 388.851 5.124 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1Br 1776033519 VEEMUBVBQUCQIH-UHFFFAOYSA-N 381.657 5.027 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(Oc2ccc(F)cc2)cc1 1776085854 NUMCEGRBEQRIBB-UHFFFAOYSA-N 378.403 5.081 30 20 GKED CC(C)(C#N)c1ccc(CNCc2ccccc2-c2cccc(C(=O)O)c2)cc1 1776230552 CQOLFAHUDLYNQV-UHFFFAOYSA-N 384.479 5.143 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cs1 1776280397 DVTNKEBLITWMGK-YVMONPNESA-N 397.452 5.001 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(Cl)c(Cl)c1 1776354412 LLOAOXZLBBNMNJ-DAXSKMNVSA-N 379.239 5.375 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc2cc(Br)ccc2o1 1776783044 WGNNHDIPSPIUSV-INIZCTEOSA-N 396.325 5.489 30 20 GKED CCCCCCCCCCCN(C)CCOc1ccc(/C=C\C(=O)O)cc1 1776784568 HMVJDPDNSLUCFW-VKAVYKQESA-N 375.553 5.626 30 20 GKED CCCCCCCSc1ccc(C(=O)N(CC(=O)O)c2ccccc2)cc1 1776787846 QCJAGLFKIDHLFR-UHFFFAOYSA-N 385.529 5.481 30 20 GKED COc1ccc2ccnc(C(=O)/C=C\c3ccc(-c4ccc(C(=O)O)cc4)o3)c2c1 1777374416 USFHPDZXJHGOBS-NTMALXAHSA-N 399.402 5.098 30 20 GKED N#C[C@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1nc2ccccc2[nH]1 46706400 CACDUDHUGAZGBV-LJQANCHMSA-N 383.476 5.345 30 20 GKED C[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 48161845 QGFBCHOMDHCNOG-XLIONFOSSA-N 377.488 5.032 30 20 GKED Cn1c(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc2ccccc21 55824003 HBUDFGOAXHYYII-UHFFFAOYSA-N 395.462 5.076 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(Cl)s1 66955531 SFCXFQHABRBWJU-LBPRGKRZSA-N 379.938 5.460 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1 91859525 GELDOYWABYDDJA-HNNXBMFYSA-N 395.890 5.152 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(Cl)cc2Cl)cc1 107830233 SMFXEICABDOORS-UHFFFAOYSA-N 387.188 5.070 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC[C@@H]3CCC[C@H]32)cc1 120156608 SFGBCUFQFVEWPD-WMZHIEFXSA-N 389.499 5.128 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC)c(F)c2)cc1OCCCC#N 132721823 FBHGDIKTASVBTD-VMPITWQZSA-N 385.460 5.135 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(Cl)cc(Br)c2)n1 158142651 NXLQVKWJNUYFFH-LBPRGKRZSA-N 383.698 5.172 30 20 GKED C[C@H](Sc1cccc(C#N)c1)c1nc2scc(-c3cccs3)c2c(=O)[nH]1 158764968 ZWCAFWIPWNLEHK-NSHDSACASA-N 395.534 5.438 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/Cc3ccc(C)cc3C2=O)cs1 170985762 NZNVSMMVSHQWNX-WJDWOHSUSA-N 392.455 5.098 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 173122384 UTUIILGRALMZGK-PKOBYXMFSA-N 381.545 5.566 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 176805599 COLJKHXZOZJWDL-UHFFFAOYSA-N 390.512 5.045 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 182071932 GCWIMCYPKYRHQH-UHFFFAOYSA-N 399.297 5.089 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CCC(=O)OCC)C1 191517483 YRIRDVZDSMEQME-SFHVURJKSA-N 386.536 5.126 30 20 GKED N#Cc1ccc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)cc1F 191732011 HNRRRLLOJLWVGY-UHFFFAOYSA-N 389.459 5.064 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(c2ccccc2)CCCC1 195611417 XNWOODJTZZRGNE-UHFFFAOYSA-N 397.478 5.505 30 20 GKED CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)CCO1 245565409 ZNWHIQPREYCSLQ-AYBZRNKSSA-N 389.565 5.186 30 20 GKED Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1NC(=O)C(C)(C)C 280624933 WQMPEZSJIKQTDB-UHFFFAOYSA-N 377.488 5.033 30 20 GKED COc1ccccc1[C@H](Nc1cc(C#N)ccc1C(F)(F)F)c1ccccn1 302378213 HOAHOOLPWDCYRS-FQEVSTJZSA-N 383.373 5.182 30 20 GKED Cc1cccc2c(CCC(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)c[nH]c12 303887887 JZDPCBWBKRLEJP-QGZVFWFLSA-N 386.282 5.097 30 20 GKED COc1cc([C@@H](C)NCCC2(C#N)CCCCC2)ccc1OCc1ccncc1 411450301 NEPSXTSENFYTOT-LJQANCHMSA-N 393.531 5.184 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1C[C@H]1c1cccc2ccccc12)c1ccccc1 431319829 VIUPZNBNUWCICD-RBZQAINGSA-N 383.495 5.430 30 20 GKED CCc1sc(-c2nnc(CN[C@@H](CCCC#N)c3ccccc3)o2)cc1C 433018786 GGNOHTRPHOMXMI-KRWDZBQOSA-N 380.517 5.194 30 20 GKED N#CCCC[C@H](NC[C@@H](O)Cn1c2ccccc2c2ccccc21)c1ccccc1 433019106 LPGQKFXWDFYDEF-QPPBQGQZSA-N 397.522 5.180 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Br)c1)c1nc2ccccc2s1 437550778 SFKWTIXVOLYRLV-GFCCVEGCSA-N 391.677 5.202 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 438863604 ZYLPOIFSFBXDJU-UXHICEINSA-N 399.441 5.010 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccccc1 439302445 BPVUPLHISAQCSE-QHCPKHFHSA-N 385.467 5.432 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ncccc2Oc2ccccc2)s1 442546021 NSLWLRMOLFHYSY-OAHLLOKOSA-N 377.469 5.118 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1conc1CC)c1ccc(C(F)(F)F)cc1 454717526 XXGJUMIKHCSPGQ-SFHVURJKSA-N 395.425 5.105 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)C1 454858012 QCNATLTVRVPRSS-JQWIXIFHSA-N 391.846 5.198 30 20 GKED C[C@H](C(=O)N1CC[C@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462230252 HXYROSPSUUDZKS-AUSJPIAWSA-N 386.417 5.290 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1csc(-c2ccccc2F)n1 464822000 JWLVHJLWCIUFJE-CTNGQTDRSA-N 377.488 5.221 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Cl)c(C)c3)n2)cc1 469559646 AHCYUVOCBGOJQI-MRXNPFEDSA-N 382.872 5.271 30 20 GKED Cc1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(C(F)(F)F)o1 471822596 ODWGQSPGJBTZPZ-UHFFFAOYSA-N 386.329 5.523 30 20 GKED N#CC[C@H](CC(=O)N[C@H](COc1ccccc1)c1ccccc1)c1ccccc1 475757182 QQYQXYFENDTWAP-ISKFKSNPSA-N 384.479 5.010 30 20 GKED C=C(C)[C@H](NC(=O)N1CCCCC[C@H]1c1ccncc1)c1ccc(F)c(F)c1 483312209 GZXCBOMGZMVBRE-SFTDATJTSA-N 385.458 5.304 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Cl)cc1Br)c1ccccc1 483871574 MDNQUJWQFFEKBL-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED N#Cc1ccc(OCc2cccc(-c3nc([C@@H]4CCC(F)(F)C4)no3)c2)cc1 484550613 HTPGBJXYMRXAFI-QGZVFWFLSA-N 381.382 5.090 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 485400387 ILJNXOLPXUCNDY-UHFFFAOYSA-N 390.434 5.274 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc2oc(C(F)(F)F)nc12 486419158 PAHZVILDMPSAIX-UHFFFAOYSA-N 378.375 5.377 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(-c2c(F)cccc2F)n1)c1ccccc1 487294027 CBLXYDPHRZYMKM-QGZVFWFLSA-N 397.450 5.253 30 20 GKED N#Cc1ccc(CN(C(=O)c2csc(-c3ccc(Cl)s3)n2)C2CC2)cc1 499325034 CEAWXAXJPCLQRV-UHFFFAOYSA-N 399.928 5.201 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CC(C)(C)Cc2oc(C)cc21 504421270 FUEOFPPAVYEKHZ-HXUWFJFHSA-N 379.504 5.095 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3cnc(C)s3)n2)o1 504564564 WGFPBJRBGCPFMX-UHFFFAOYSA-N 395.431 5.598 30 20 GKED C=CCCc1ccccc1NC(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1 505035210 LECWWVRRGIOQBI-GHTZIAJQSA-N 383.561 5.071 30 20 GKED N#C[C@@H](C(=O)Nc1cccc(Cl)c1)c1nc(-c2ccc(Cl)cc2)cs1 505450146 YQSLKMSABYXABT-HNNXBMFYSA-N 388.279 5.363 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCCCC2CCCC2)cc1 511322082 QKIQIKMUVHIDPF-UHFFFAOYSA-N 391.515 5.424 30 20 GKED C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@@H](COC(F)F)C1 512850906 MBTUGTDQZQLQOJ-VHSXEESVSA-N 391.302 5.346 30 20 GKED CC(C)(CCC#N)CNC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 516501751 UZCLNJSZIQOHQZ-UHFFFAOYSA-N 396.343 5.106 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3c3ccccn3)c2)cc1 519198871 APZVTSVPPPIIKE-JOCHJYFZSA-N 384.439 5.115 30 20 GKED C=CCN(C(=O)CC1=CCCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 519321304 JHINSJLUPHZKLH-UHFFFAOYSA-N 383.473 5.128 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C1CCC(C(C)(C)C)CC1 520325289 HJFWOTJYXBJMCZ-UHFFFAOYSA-N 391.515 5.422 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1)c1ccc(C#N)cc1 521768475 RLRIRJQPRLYLEU-ZWKOTPCHSA-N 389.524 5.654 30 20 GKED Cc1ccc(CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C(C)C)s1 521954600 VGVQQFMJKMESEF-UHFFFAOYSA-N 391.496 5.166 30 20 GKED CC(C)N(CCC#N)C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 522583012 DJJGTNVXTJTUHP-UHFFFAOYSA-N 375.708 5.626 30 20 GKED N#CC1(NC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CCSCC1 533750825 FIRZTOPGFWDXFF-UHFFFAOYSA-N 397.352 5.241 30 20 GKED C[C@@H](NCc1cccc(-n2cccn2)c1)c1ccc(-c2cccc(C#N)c2)cc1 543875918 KQJLODHGFYDSMR-LJQANCHMSA-N 378.479 5.262 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)c(F)cc1Cl 555994461 RWAVRZCPQFXVGB-SNVBAGLBSA-N 383.275 5.779 30 20 GKED CC[C@H](NCc1ccc(Br)cc1C#N)c1ccccc1OC(F)F 561855005 GDWUTRRHIKTFFJ-INIZCTEOSA-N 395.247 5.163 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 567466467 KETUVXJLLWPVTE-NRFANRHFSA-N 381.907 5.155 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(F)c1 578407258 ZXVVXJPYUVNVQY-HNNXBMFYSA-N 375.403 5.017 30 20 GKED CC(C)c1ccccc1N(C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 582145543 LLLZDTRGCDHEIL-QGZVFWFLSA-N 381.545 5.137 30 20 GKED COc1ccc(C[S@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1C#N 584041456 HIULPCBWKHWCOI-AMGIVPHBSA-N 395.911 5.259 30 20 GKED Cc1cc(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1F 590827932 XWKBNONTTWQRDF-NXEZZACHSA-N 386.311 5.165 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(OC2CC2)c1F 596733877 AFWQIGKGKJAERC-CQSZACIVSA-N 399.491 5.083 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609926784 FIRHAYOVTZHGAR-KUHUBIRLSA-N 385.895 5.039 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1Cl)C1CCCC1)c1cccc(C#N)c1 610406938 LNDHHDQPYBQIAU-MRXNPFEDSA-N 381.907 5.427 30 20 GKED C=CC[C@H]1CCCN(C(=O)c2ccsc2NC(=O)c2ccccc2Cl)C1 617784626 VRPMCAMZVFNQMK-AWEZNQCLSA-N 388.920 5.082 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)cc1F 622485351 LOPIIFPUIOBOFN-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED CCCCCCCCC(=O)N1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1 727855281 HCKDSCPURYUSBX-HXUWFJFHSA-N 387.568 5.106 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1csc(-c2cccs2)n1 728440790 VBYOCJSQTAZSQD-YFVJMOTDSA-N 394.477 5.610 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)[C@H](C#N)c1nc2ccccc2s1 732811713 WEKBQDZDOOYIER-PGRDOPGGSA-N 391.540 5.110 30 20 GKED Cc1csc(SCc2ccc(C(=O)N[C@](C)(C#N)C3CCCCC3)cc2)n1 734239361 AYAAENZJOKKJQG-OAQYLSRUSA-N 399.585 5.336 30 20 GKED C[C@@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1nc(-c2cccc(F)c2)no1 743045476 MACHVVMLGJXWOD-AIQNYSBSSA-N 380.206 5.068 30 20 GKED COc1cc(C(C)=NNc2nc3ccccc3s2)ccc1SC(F)F 746485067 RDASOVQHWGWTKL-UHFFFAOYSA-N 379.457 5.456 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1sc(-c2cccnc2)nc1C 747601381 AJVCNZIXKRBHFA-UHFFFAOYSA-N 377.300 5.656 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccc(C)s3)n2)cc1 751154260 ZXCWLBHATNGYKZ-SFHVURJKSA-N 380.538 5.688 30 20 GKED Cc1ncc(CO)c(C=Nc2ccc([C@H](C)Sc3ccccc3)cc2)c1O 752152239 FRBFCPOWLPTMHX-INIZCTEOSA-N 378.497 5.192 30 20 GKED CC1(C)CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 752483320 MLDPEZUQNMKBAQ-QZTJIDSGSA-N 377.513 5.465 30 20 GKED CCCCCCCCCN(C)C(=O)c1cn(CC)c2ccc(Cl)cc2c1=O 757877444 VBQDWLQUYAOOSS-UHFFFAOYSA-N 390.955 5.497 30 20 GKED C#CCCCCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 758496865 IWBDSPKFQDTLSF-UHFFFAOYSA-N 375.299 5.139 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(N3CCCCCC3)cc2)c1 772984857 RIWALHICIHWCDZ-YKSBVNFPSA-N 391.559 5.599 30 20 GKED N#CCCCCN[C@@H](c1ccc2c(c1)CCO2)c1cc(Cl)ccc1Cl 779046996 CVUATGYHAGQQHT-FQEVSTJZSA-N 375.299 5.301 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl 780169558 LUPYFFZQYXEHJL-PWWFUAJNSA-N 394.780 5.302 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)OCC3(C#N)CCCCC3)c12 780487828 ONCZGVFVIOQZEO-UHFFFAOYSA-N 394.519 5.003 30 20 GKED CN(C)C(=O)Sc1cccc(CSc2ccc(C#N)c(C(F)(F)F)c2)c1 782240027 GZAXVKIBXXPGOM-UHFFFAOYSA-N 396.459 5.643 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792093546 XPBVBELNFQPGFR-SZEUEKNRSA-N 380.369 5.533 30 20 GKED COc1ccc(-c2nc(/C=C3/CSc4c(F)cccc4C3=O)cs2)cc1 797227646 GZDITAAKJPGNDI-LCYFTJDESA-N 383.469 5.330 30 20 GKED C=CC[C@@H](NC(=O)N(CC(C)C)[C@H](C)c1ccccc1Cl)c1ccncc1 806820199 UMXSADCGZUZJPR-DYESRHJHSA-N 385.939 5.781 30 20 GKED C#C[C@@H](NCc1csc(-c2ccc(OC)cc2)n1)c1ccc(Cl)cc1F 809698811 JGJGMMHMUUHZGJ-LJQANCHMSA-N 386.879 5.075 30 20 GKED CC(C)(C)OC(=O)NCC1CCC(N[C@@H](CCCC#N)c2ccccc2)CC1 814304211 IGHOHTSDAKJEPF-MNLRITNHSA-N 385.552 5.095 30 20 GKED Oc1cc(F)c(Cl)cc1CN[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 816532607 OFKVKXOFOHEOBO-MYJAWHEDSA-N 393.730 5.184 30 20 GKED N#C[C@@H](C(=O)CSc1cc(Cl)ccc1Cl)c1nc(C2CC2)cs1 842938252 JFBLNVMEFORNFK-NSHDSACASA-N 383.325 5.296 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942864 DZFCNGAHTTUZRO-CJNGLKHVSA-N 392.446 5.484 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)[C@H]1CCCC2(CC2)C1 850759131 GKTYGMOETTXBGG-PKOBYXMFSA-N 388.467 5.097 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)Cc2ccc(OCc3ccccc3)cc2)n1 850873644 NMAUZFNKFPQYDZ-HXUWFJFHSA-N 390.508 5.264 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NCCn2ccnc2)cc1 907674718 AVWQCQCZUSKXQL-UHFFFAOYSA-N 388.515 5.099 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C\c1ccsc1 914520248 JPWQYAZUBOSFRZ-TWGQIWQCSA-N 376.456 5.314 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1ccc2ccccc2n1 914554425 KFCIVXCFYUIEMQ-UHFFFAOYSA-N 389.890 5.643 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCSc2ccc(F)cc2)cc1 915179206 BFCBCWKCZBWBGS-JOCHJYFZSA-N 390.483 5.602 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccccc3)CCOCC2)cc1 915179222 BKRCCZWBMLYSOT-DEOSSOPVSA-N 396.490 5.029 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 916846615 ZWGSTNUEWLGWPD-RHSMWYFYSA-N 378.497 5.238 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 917046492 KKHFGHRVVHTISW-OAHLLOKOSA-N 388.851 5.124 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc(OC)c1O 917144824 PBZRQTWBPGFRAZ-NTMALXAHSA-N 394.398 5.237 30 20 GKED O=C(O)COc1ccc(C=NNc2ccccc2Oc2ccccc2)cc1Cl 1776090927 JIBLYGGRXOROMF-UHFFFAOYSA-N 396.830 5.042 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc(-c4ccccc4)cc3)o2)cc1 1776131368 PHPKKWHLXURSSB-JQIJEIRASA-N 394.426 6.208 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(C)o3)CCC2)cc1 1789449047 KCRIWAZKMIZGKF-HXUWFJFHSA-N 392.499 5.104 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(C)c(F)c2)cc1 11082840 YPTCNXKQFLUJPC-UHFFFAOYSA-O 393.507 5.035 30 20 GKED N#C[C@H](C(=O)CSc1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 26111359 SWTAJYQWYNKTFH-CQSZACIVSA-N 386.448 5.057 30 20 GKED C[C@H]1CCc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cc2C1 41559389 DPDDJLGDRDIXDP-WCQYABFASA-N 385.439 5.108 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)Nc2cc(C#N)ccc2OC(C)C)c1 65473868 AYBWAMKMHRIOEV-INIZCTEOSA-N 381.476 5.015 30 20 GKED C=C(C)COc1cccc(NC(=O)c2sc(NC(=O)c3ccco3)cc2C)c1 66463356 BTSZCWGFYAVPPH-UHFFFAOYSA-N 396.468 5.109 30 20 GKED Cc1nc(/C=C\c2cccc(C#N)c2)sc1C(=O)/C=C\c1cccc(C#N)c1 96402176 WFJGFTZVNVGONM-WGEIWTTOSA-N 381.460 5.261 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1ccccc1 108145568 PVKRXKBPJYMUDH-UHFFFAOYSA-N 380.498 5.140 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccccc1C 124123120 WZSQCXZXAMXDEM-OAHLLOKOSA-N 382.533 5.578 30 20 GKED CN(Cc1cscn1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 146770761 BRSJZQBPVZSEKV-GOSISDBHSA-N 396.903 5.116 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cccc(OCc3cccc(Cl)c3)c2)n1 147471271 FKGMIFLZWDMXGF-GOSISDBHSA-N 382.872 5.174 30 20 GKED COc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 175116916 DDRUZVAZMYFPKR-DNVCBOLYSA-N 376.481 5.189 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ncccc2-c2ccccc2)o1 179571520 UWNVYQWGGBOPMP-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccccc2)c2ccccn2)cc1 181055658 VCUWLCCVETUTDH-AREMUKBSSA-N 375.475 5.499 30 20 GKED CC[C@@H]1C[C@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 183137959 SAWMXVGWXIHSOJ-POAQFYNOSA-N 382.891 5.139 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1cccc2ccccc12 303353391 FSGDJWORDPINIA-INIZCTEOSA-N 375.497 5.413 30 20 GKED OC(=Nc1cc(F)ccc1Oc1ccccc1)N1CCCC2(CCOCC2)C1 330202067 YVHGLEWSUWIQGL-UHFFFAOYSA-N 384.451 5.056 30 20 GKED N#CC1(CC[S@](=O)Cc2cccc(C(=O)Nc3ccccc3)c2)CCCCC1 417150575 KJNDQMJGKHVLCD-NDEPHWFRSA-N 394.540 5.052 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nc3ccccc3c(=O)n2CCC2=CCCCC2)C1 430103856 HHNYTLMWKPQSPG-ZWKOTPCHSA-N 379.529 5.071 30 20 GKED Cc1cc(Br)ccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430645714 VHXHOSBOXKZKBI-CYBMUJFWSA-N 377.307 5.002 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(F)c(C#N)c2)c(C(F)(F)F)c1 430691517 MHLBKFLVAMUAQP-NSHDSACASA-N 396.409 5.859 30 20 GKED COCCCOc1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 431214049 QVLNRIIWOSGVFT-MRXNPFEDSA-N 399.516 5.140 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1cc(C#N)cn1C(C)(C)C 433835408 GXRFPUXWUVLXSQ-INIZCTEOSA-N 392.425 5.238 30 20 GKED C=CCC[C@@H](NC(=O)N(Cc1cccs1)C[C@H]1CCCO1)c1ccccc1 435759531 KXKNPDZQRFUVCS-TZIWHRDSSA-N 384.545 5.146 30 20 GKED CC1(C)[C@@H]2CN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)c(Cl)c3)C[C@H]21 437740029 YGGZQCDURVOPQH-IPMKNSEASA-N 379.891 5.115 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC3(CCCCC3)C2)cc1 437848038 ZZPLYTGIYLGEPN-UHFFFAOYSA-N 375.472 5.539 30 20 GKED CC[C@@]1(C)CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)C1 437976434 OZYLPKPTXNLCHF-DEOSSOPVSA-N 391.515 5.490 30 20 GKED Cc1ccc(Br)cc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 442668453 DLCCORGAOPDXGM-MRXNPFEDSA-N 397.297 5.371 30 20 GKED O=C(CC1CC(F)(F)C1)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 450970745 NGZGWYTVJPWZCU-LBPRGKRZSA-N 389.286 5.251 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 454748863 AZCRHEDUWULLOJ-UHFFFAOYSA-N 389.377 5.157 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458804117 SBXVKLGFXLCUSK-GOTSBHOMSA-N 375.516 5.147 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1sc(-c2ccc(F)cc2)nc1C 461707517 VQYHMLDXCKWBCK-UHFFFAOYSA-N 394.475 5.204 30 20 GKED Cc1ccc(-c2ccnn2C)cc1NC(=O)c1ccccc1-c1ccccc1C#N 466554861 JUVOSRMBWWJYEW-UHFFFAOYSA-N 392.462 5.187 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)C1CCC(C(F)(F)F)CC1 469729129 PKJQUYAWNXFGOQ-YIZWMMSDSA-N 385.323 5.304 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1c(F)cccc1Cl 477271848 MSCFKQRYWCTYMX-CYBMUJFWSA-N 395.821 5.029 30 20 GKED N#Cc1cc(Cl)ccc1CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 481072180 KXDRSYXFAQVHHX-NRFANRHFSA-N 382.294 5.334 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(COCc2ccco2)c1 485454117 MGHUMTBPKCFPHU-UHFFFAOYSA-N 379.481 5.527 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1cc2ccccc2o1 486766583 WDHRKKWYMTZIJO-HNNXBMFYSA-N 396.537 5.556 30 20 GKED C=CCC[C@H](C(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 490200723 IWDJCDXCEXKYDL-VJBWXMMDSA-N 381.491 5.254 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 490315626 VHEOUHRKIFGFBN-QVKFZJNVSA-N 379.529 5.520 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C 499063942 FTRFYRQQFGUZKO-INIZCTEOSA-N 376.953 5.342 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 499338834 XUIGIEMZZCUFSV-UHFFFAOYSA-N 381.888 5.020 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cc(Cl)sc1Cl 501021688 WGLYSRNOYLSXRK-UHFFFAOYSA-N 377.252 5.367 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)N1CC=C(c2ccc(C#N)cc2)CC1 502548562 MHLTZXBUUSBVLL-IBGZPJMESA-N 387.527 5.106 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 503799484 XKKIGLRPNRZTMH-OAQYLSRUSA-N 381.907 5.285 30 20 GKED CC(C)Cn1ccc2cc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)ccc21 509916115 POBVNWMAXNOROB-UHFFFAOYSA-N 388.515 5.611 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(-c3cncc(F)c3)ccc2C)cc1OC 513354002 OTGGQQLNPYXUIQ-UHFFFAOYSA-N 392.430 5.022 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)cc1F 513712460 CSQDGMWTPUDOQP-OCCSQVGLSA-N 392.352 5.407 30 20 GKED N#CCCCOc1cccc(NC(=O)CCC(=O)c2ccc3ccccc3c2)c1 517099889 DXQDKBXTZLOVSK-UHFFFAOYSA-N 386.451 5.124 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(Cl)cc1Cl 518653126 SGNUJXKMABBHND-LBPRGKRZSA-N 395.311 5.405 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1ccc(Cl)cc1Cl 519413123 CKRJOXMWRUVMPO-GFCCVEGCSA-N 395.311 5.263 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CC[C@@H](c2ccccc2F)C1 521943616 HTDHZUFVBGLFDD-CQSZACIVSA-N 393.380 5.039 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2sccc2C#N)C(C)C)cc1 525591083 PCQNFPQULCVJRT-UHFFFAOYSA-N 390.508 5.346 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Oc3ccccc3Cl)nc2)n1 531331290 NSZVORCDVJEESM-CQSZACIVSA-N 397.887 5.597 30 20 GKED CC(C)c1ccc([C@H]2CCCN2CC(=O)Nc2ccccc2SCC#N)cc1 536236899 CKEVWQVZHYANRW-OAQYLSRUSA-N 393.556 5.201 30 20 GKED N#CC1(c2ccc(C(=O)NC3(c4cccc(C(F)(F)F)c4)CCC3)cc2)CC1 540754642 WWCUEMOJAMEYSL-UHFFFAOYSA-N 384.401 5.070 30 20 GKED C[C@H](NCc1nc(-c2cccs2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541084069 CTNBIVRBZUUXNU-HNNXBMFYSA-N 386.480 5.188 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1cscc1Br 550520063 VNOWXTJRMOPNLQ-LLVKDONJSA-N 395.347 5.086 30 20 GKED CC(C)Oc1ncccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 551507818 WQEMLRPQQKMBJY-MRXNPFEDSA-N 397.887 5.136 30 20 GKED N#CCc1ccc(OC[C@H](O)CSC(c2ccccc2)c2ccccc2)cc1 551958231 NQOORRYNLQJDSN-QFIPXVFZSA-N 389.520 5.015 30 20 GKED CCCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c(C)c1 554465651 BXXFDIKZLMDFOT-UHFFFAOYSA-N 379.504 5.346 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(F)ccc2Cl)cc1 555684750 KWIKXWDWILVABR-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc2nc(-c3ccc(F)cc3)oc2c1 558342892 UXXNVUIDAIUDMF-UHFFFAOYSA-N 380.423 5.085 30 20 GKED C[C@H]1C[C@H](CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@@H](C)O1 558812651 LZUIEBAAPIAAOW-BCDXTJNWSA-N 394.540 5.033 30 20 GKED CC(C)(CCC#N)CNC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 565447618 MFVHSEWLTSYNDX-UHFFFAOYSA-N 390.911 5.690 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cscc3C(F)(F)F)cc2)ccn1 571845439 QQNFDZRZUSSFAC-UHFFFAOYSA-N 375.375 5.438 30 20 GKED COc1ccc2c(c1)c(C(=O)N1CCC(CCC#N)CC1)c(C)n2C1CCCC1 578993368 ZVKOOIGACJJHFD-UHFFFAOYSA-N 393.531 5.229 30 20 GKED C=CCOCC(=O)N(CCC)c1nc(-c2ccc(Cl)cc2Cl)cs1 591666409 CDBVOEQWPYNAAO-UHFFFAOYSA-N 385.316 5.063 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1ccc(O[C@@H](C)c2ccccc2)cc1 595683641 XBPMIZHPHPWHKH-SFTDATJTSA-N 392.543 5.578 30 20 GKED C[C@]12CCCC[C@H]1CN2C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 599732232 LLKQXNYKLJIYAJ-RDPSFJRHSA-N 389.499 5.128 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)cc1 603918518 XRRQWXFRXMOONM-JOCHJYFZSA-N 392.911 5.210 30 20 GKED CCc1nc2cc(NC(=O)c3ccc(OCc4ccccc4C#N)cc3)ccc2o1 604176430 UABIVXMLYNJVRT-UHFFFAOYSA-N 397.434 5.093 30 20 GKED Cn1ccc2c(C(=O)[C@@H](C#N)c3nc4cc(C(F)(F)F)ccc4s3)cccc21 607274660 MKHJYTDECOXJIJ-CQSZACIVSA-N 399.397 5.297 30 20 GKED N#Cc1cnc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c(Cl)c1 608885021 CRNOPIPIXHPSGM-UHFFFAOYSA-N 389.311 5.254 30 20 GKED Cc1ccc2c(c1)[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)CC2 609303662 BZXOVWSFUSDYNR-OAQYLSRUSA-N 384.504 5.435 30 20 GKED Cc1cc(NC(=O)CS[C@@H](C)c2ccc(C#N)cc2)ccc1Br 609825800 ULBPHVZZCJNWDB-ZDUSSCGKSA-N 389.318 5.062 30 20 GKED CN1CCCN(C(=O)c2ccccc2Sc2ccccc2C#N)c2ccccc21 609974090 CXXBMTYWOMEFKT-UHFFFAOYSA-N 399.519 5.196 30 20 GKED Cc1csc(-c2cccc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)n1 610038964 PIDZEZJVOPJMCJ-UHFFFAOYSA-N 375.497 5.041 30 20 GKED Cc1sc2nc([C@@H](C)Sc3ccc(Cl)cc3C#N)nc(O)c2c1C 610655188 UBVMEBCVLDVUSG-SNVBAGLBSA-N 375.906 5.392 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1cccc(COCC(F)(F)C(F)F)c1 611468599 MNMSNWNIZCFXBZ-LJQANCHMSA-N 392.396 5.465 30 20 GKED C=CCCOCC(=O)N(Cc1ccccc1)c1nc2c(C)cc(C)cc2s1 620326329 HLCKEGAKTSPBRI-UHFFFAOYSA-N 380.513 5.039 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 620457146 WSZKKRJDMASJQL-WXHSDQCUSA-N 399.350 5.030 30 20 GKED CC(C)(C)c1noc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 647634434 YIOALFYFUMQBKN-UHFFFAOYSA-N 399.310 5.269 30 20 GKED Fc1ccc(F)c2c1CC[C@@H]2NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 677129536 MPRVFKMVZOKKQR-FZNYLWTLSA-N 387.314 5.451 30 20 GKED N#Cc1ccc(NC(=S)N[C@H](c2ccccc2)c2ccc(F)cc2)cc1Cl 726462222 DXIGJPWPCQROCU-HXUWFJFHSA-N 395.890 5.427 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2ccc(OCCC(C)C)c(OC)c2)c1 726469789 RWPBSWVBVNAMSW-QGZVFWFLSA-N 396.556 5.149 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)O[C@@H](C)c2cccc(C#N)c2)cc1 727639879 UFWVLQSGRBFBKE-HNNXBMFYSA-N 376.481 5.146 30 20 GKED CC(=NNc1ncnc2sccc12)c1sc(-c2ccc(C)cc2)nc1C 727648485 HBFYFULURHLOAS-UHFFFAOYSA-N 379.514 5.268 30 20 GKED C#Cc1ccc(C(=O)N(Cc2ccc(Cl)cc2)[C@H](C)Cc2cccs2)cn1 728804057 SZBKRLSGMLXVLQ-MRXNPFEDSA-N 394.927 5.051 30 20 GKED N#CCOc1cccc(NC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)c1 730171795 APIONGGKGHGTDO-OAQYLSRUSA-N 392.455 5.200 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC(C)C)c2cccs2)c1 733804221 ADRCPNKLGKTOHE-PKOBYXMFSA-N 385.533 5.016 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 734206410 ZNSAAVMYUWBMNN-WMZHIEFXSA-N 375.516 5.632 30 20 GKED C=CC[C@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccncc1 734682379 CDFLIMDUENKPBT-IBGZPJMESA-N 383.542 5.234 30 20 GKED Cc1ccc(-c2ocnc2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 741901234 FZXCUCWATAJURR-JOCHJYFZSA-N 393.446 5.558 30 20 GKED C[C@]1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCc2ccccc2C1 742536623 BHFQUMGJXCVOOP-AHWVRZQESA-N 380.491 5.476 30 20 GKED CCC(CC)(CNC(=O)c1ccccc1Sc1ccccc1C#N)SC 742845105 NOIDTUJBYKUDEC-UHFFFAOYSA-N 384.570 5.361 30 20 GKED Cc1ccccc1O[C@H](C)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743095517 LASLDZWKELZODK-AUSIDOKSSA-N 399.494 5.240 30 20 GKED C[C@H](NC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1cccc(C#N)c1 743776557 BPWKINNCEBDDBC-KRWDZBQOSA-N 395.462 5.110 30 20 GKED C=CCn1c(-c2ccncc2)nn(CN2CCC[C@H]2CC2CCCCC2)c1=S 747076050 JVDLHBMQBIBHKA-FQEVSTJZSA-N 397.592 5.054 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(OC)cc1 752476389 POZSNPMXRLVEJL-OXQOHEQNSA-N 390.508 5.579 30 20 GKED O=C(/C=C/c1ccc(Cl)c(Cl)c1)c1cc(Br)ncc1F 762424498 RZXTUNUGVMIRGJ-DUXPYHPUSA-N 375.024 5.186 30 20 GKED Cc1cc(/C=C(/Cl)c2nc(O)c3c4c(sc3n2)CCCC4)ccc1C#N 766482489 AZGZQMSFBNBYNJ-OQLLNIDSSA-N 381.888 5.193 30 20 GKED CC(C)n1c([C@H]2CCCN2Cc2ccc(O[C@H](C)C#N)cc2)nc2ccccc21 769403209 FPFKYIUOPUFQEI-WZONZLPQSA-N 388.515 5.245 30 20 GKED N#Cc1cc(/C=C(\Cl)c2nc(O)c3ccc(C(F)(F)F)cc3n2)ccc1F 770565814 JSNHZCJJKCLQLU-MLPAPPSSSA-N 393.727 5.102 30 20 GKED N#Cc1c(Cl)nsc1N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 771258973 OLOQREIOHNHZOX-OAHLLOKOSA-N 375.284 5.112 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(-c3cccs3)cc2)c1 772985588 SXPWTLXCUWFNBT-DYESRHJHSA-N 376.525 5.947 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccccc2F)C2CCCC2)ccc1OC 774449709 QLHMNIQBEZMBGF-YADARESESA-N 396.506 5.536 30 20 GKED O=C(Nc1cccc(/C=C/C(=O)c2cccc(F)c2F)c1)c1ccccc1Cl 776268023 JOILYMLWVWUBDN-VAWYXSNFSA-N 397.808 5.767 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cccc(F)c1Sc1ccccc1 781164879 AYMCEFLELUBXIH-UHFFFAOYSA-N 396.418 5.271 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792099730 IWQVCXLCGDJIOB-IUODEOHRSA-N 385.250 5.185 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(C)[C@H](C1)C2(Cl)Cl 794331546 VDQZYWYGXHBMCA-LPHOPBHVSA-N 381.347 5.586 30 20 GKED CCCNc1ccc(C#N)cc1NCc1nc(C)c(-c2ccc(Cl)cc2)o1 795267141 VAWJDZDJWZSTDI-UHFFFAOYSA-N 380.879 5.609 30 20 GKED Cc1nn(-c2ccccn2)c(C)c1/C=C/C(=O)c1cc2cc(Cl)ccc2o1 802704709 VGQGNOZASDSBPV-BQYQJAHWSA-N 377.831 5.180 30 20 GKED Cc1ccc2sc(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)cc2c1 810530535 DORZYCUVCIGSAK-GOSISDBHSA-N 384.460 5.324 30 20 GKED CC(=NNc1nc(C(F)(F)F)cs1)c1csc(-c2ccccc2F)n1 812226729 SVKFTJOYNNNDBA-UHFFFAOYSA-N 386.399 5.261 30 20 GKED N#CCCC[C@H](NCc1cnn(Cc2ccccc2)c1Cl)c1ccccc1 814304793 RGKQYDIDRJJXOO-NRFANRHFSA-N 378.907 5.110 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C1CC1 836497741 VHOKYQNWVUDABH-BLVKFPJESA-N 387.842 5.043 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cnc(-c3ccc(C)c(C)c3)s2)c1 848536480 PRMGWJNVQZOKTF-HXUWFJFHSA-N 391.540 5.398 30 20 GKED Cc1cc(Cl)ccc1C1=CCN(C(=O)Nc2ccccc2O[C@H](C)C#N)CC1 860897035 JOAHZCIZQWTFGD-MRXNPFEDSA-N 395.890 5.261 30 20 GKED C=CC(C)(C)CC(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 884651881 BUESFQQSPDYFGG-UHFFFAOYSA-N 392.908 5.127 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@H]2c2cc(C)on2)s1 915311365 GAYZYTPYXFVBKX-INIZCTEOSA-N 391.541 5.107 30 20 GKED FC(F)(F)Oc1ccc(NN=Cc2ccccc2OCc2cccnc2)cc1 915959352 CFCXDPAPMIGFPR-UHFFFAOYSA-N 387.361 5.005 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=Cc1cccc(F)c1 916273338 XUUAYXQCUHQHKC-UHFFFAOYSA-N 397.862 5.108 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@H](C#N)C(=O)CCCC1CCCCC1 916903110 NYDWBPUQFSTKAZ-MRXNPFEDSA-N 390.911 5.055 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12 919895441 HESBWTBPKYSULB-UHFFFAOYSA-N 393.446 5.424 30 20 GKED O=C(O)c1ccc(NN=Cc2ccccc2OCc2ccc(Cl)cc2)cc1 1776014216 MMIIEGZVWZWFEG-UHFFFAOYSA-N 380.831 5.063 30 20 GKED O=C(O)/C=C\c1ccc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)cc1 1776127046 GJDGWJHNSFZNPP-VUTUTYQISA-N 384.431 5.260 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@@H](C)CC[C@H]2C(=O)O)cc1 1776787554 WMIDFFPORGVXNA-LPHOPBHVSA-N 377.550 5.074 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776817321 WNERDGMGXXDKDN-SXGWCWSVSA-N 386.447 5.737 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C1\C[C@@H](C(=O)O)c2ccccc2C1=O 1777341305 FKIRTTPCZOSYDS-PGPKDTDWSA-N 384.431 5.200 30 20 GKED Cc1ccccc1-n1c(S[C@H](C)C#N)nnc1-c1ccc(Cl)cc1Cl 5355750 PYJIFIUGJSYCEO-GFCCVEGCSA-N 389.311 5.554 30 20 GKED C[C@H](NC(=O)C1(c2cccc(Br)c2)CCCC1)c1ccc(C#N)cc1 26130018 DFYGHOYTEFHZKL-HNNXBMFYSA-N 397.316 5.010 30 20 GKED O=C(Nc1ccccc1SCC(F)(F)F)c1cc(F)c(F)c(F)c1F 36660918 XTPVJTKFZPHCPT-UHFFFAOYSA-N 383.288 5.150 30 20 GKED Cc1cc(/C=C\C(=O)c2cccc([N+](=O)[O-])c2)cc(C)c1OCc1ccccn1 97053812 QMGVMIHZELWEPE-KTKRTIGZSA-N 388.423 5.082 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 108981830 OZICEYQFTKNDBV-CYBMUJFWSA-N 379.460 5.329 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(NC(=O)C3CCCCC3)c2)c1 176544779 MAAFJLGQXMLGLB-UHFFFAOYSA-N 393.512 5.073 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(-c2nc3ccccc3s2)o1 181133779 AHDPESIBYSEUGC-CQSZACIVSA-N 375.453 5.459 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C 181256025 WLEMEIIKBZTZKI-UHFFFAOYSA-N 385.345 5.101 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nccs1 183543863 WBNSPNAPDRMGLX-HNNXBMFYSA-N 392.484 5.074 30 20 GKED C=CCn1c(S[C@@H](C)c2cnccn2)nnc1-c1ccc(C(C)(C)C)cc1 185198482 MLZKGRVLAYJQNY-HNNXBMFYSA-N 379.533 5.072 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2ccc(F)cc2)n1 189913490 RDIPOSCKIFIEJD-UHFFFAOYSA-N 377.463 5.424 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1ccc(Cl)cc1-c1ccccc1 190729808 CBTVEVDBPVUHLT-UHFFFAOYSA-N 390.874 5.350 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(N(C)c2ccccc2)CC1 191430277 ZVMCHXLWPLNGFD-UHFFFAOYSA-N 391.559 5.671 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2C/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)cc1 328891539 SKZGGGQJXQCWIA-RXVVDRJESA-N 392.499 5.347 30 20 GKED OC(=Nc1ccc2nc(C(F)F)sc2c1)N[C@@H]1CCOC2(CCCCC2)C1 329467435 WOOMGOFNTYJVBX-CYBMUJFWSA-N 395.475 5.251 30 20 GKED CSc1ccc(C)c(N/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1 329476337 BLGCEYUEOJIRQP-SFHVURJKSA-N 384.549 5.432 30 20 GKED CC[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1c(C)noc1C 329491621 VPOOYBMSMRUYNX-MJGOQNOKSA-N 384.524 5.206 30 20 GKED CC(O)=Nc1ccc(Cl)cc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330028108 NZHYQASQGSHUKA-UHFFFAOYSA-N 377.872 5.461 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1csc(-c2cccc(F)c2)n1 377579489 FPJAJUBSHXVFPL-UHFFFAOYSA-N 397.500 5.136 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 409866014 IDWBXZHDACRXKH-LSDHHAIUSA-N 375.255 5.006 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@H](C)C3)n1 411011731 MFTMWWCNVQTQGK-QWRGUYRKSA-N 388.924 5.125 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1CCC[C@@H]1c1ccc(F)cc1F 424258804 XERAOHKPQSVZHP-MSOLQXFVSA-N 390.503 5.042 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1ccc(Cl)cc1 430597746 MVQSJXCNOZMOLU-HNNXBMFYSA-N 398.919 5.078 30 20 GKED Cc1ccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)c(OC(C)(C)C)c1 431291535 FKYOYXLGUNLWNM-NRFANRHFSA-N 393.531 5.407 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(SCc2cn3ccccc3n2)cc1 431855841 CCLZZQVNMWYLFV-UHFFFAOYSA-N 398.491 5.059 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(Oc2ccccn2)cc1)c1ccccc1 433140483 HOIJXISWLDLZCC-OAQYLSRUSA-N 386.455 5.431 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 433306255 RVAAAMXYNSBBBR-RXVVDRJESA-N 394.927 5.380 30 20 GKED N#CCCCOc1cccc(CN[C@H]2C[C@H](c3cccc(C(F)(F)F)c3)C2)c1 435747604 JYNQLLZIFYGNJU-KESTWPANSA-N 388.433 5.424 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)ccc2C)c1 438673340 TVLWBEWBKBQJGI-KRWDZBQOSA-N 386.455 5.245 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1Cl 439125052 SWPXRKDGUPHEDG-CQSZACIVSA-N 380.797 5.409 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1cccc(-c2ccccn2)c1 439674281 WUSKLGDUCVWOOL-UHFFFAOYSA-N 389.458 5.217 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N(C)[C@@H](C)CC#N)cc2)c1 444395455 GZFNNNXSIKUUFM-SFHVURJKSA-N 379.504 5.463 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(Cc3ccccc3C#N)C2)n1 447065977 IUOOXGRRDPJSQS-IBGZPJMESA-N 389.524 5.070 30 20 GKED CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@@H](C)c1cc2ccccc2o1 458798662 IHWLIFXHLIBMCY-RXVVDRJESA-N 389.499 5.960 30 20 GKED Cc1cc(F)cc([C@@]2(F)CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c1 458853738 XBBLLNDNRVAPSW-FYYLOGMGSA-N 397.469 5.149 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@@H]3CCC[C@@H]32)c1 460395889 WBOBQYAMEOCURR-YWZLYKJASA-N 380.875 5.409 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc1 461413169 AHZIDISWLAWUMX-PWRODBHTSA-N 390.552 5.549 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(Oc2ccc(F)cc2F)CC1 462380492 LWNURGJCNIQJSA-UHFFFAOYSA-N 399.828 5.086 30 20 GKED COc1ccccc1[C@@H](C)S[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1 463201072 ICPVSRZFBVMHTK-MOPGFXCFSA-N 396.556 5.442 30 20 GKED C[C@H](C(=O)Nc1cccc(Cl)c1Oc1cccnc1)c1cccc(C#N)c1 463571831 WIUWPRNYIISNCT-AWEZNQCLSA-N 377.831 5.141 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)c1 466340566 ANFOYIIWVRXXIP-UHFFFAOYSA-N 399.784 5.127 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl)Cc1cccc(F)c1 468974560 LHWQYKPAWCNWKE-YVEFUNNKSA-N 379.262 5.082 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCN1c2ccccc2CC[C@H]1C 469317670 OLLLOOKHNUCGET-QZTJIDSGSA-N 393.556 5.108 30 20 GKED Cc1ccc2sc(C(=O)N3CCC(Oc4cccc(C#N)c4)CC3)c(C)c2c1 469366867 GCNAFHDFFJNPQY-UHFFFAOYSA-N 390.508 5.073 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 469450192 LZVLRRMMJLWLFN-UHFFFAOYSA-N 375.472 5.375 30 20 GKED COc1ccc2c(c1)CN(C(=O)Nc1cc(C#N)ccc1C)[C@@H](c1ccccc1)C2 470340142 IKEIERLBWNDUAK-XMMPIXPASA-N 397.478 5.207 30 20 GKED N#Cc1cnc(N2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)c(Cl)c1 471732510 XGBYQQUCRKKKIE-UHFFFAOYSA-N 396.705 5.099 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cc(OC)c(OC)cc1C 475560598 JBXNCOHIKTXVLO-KRWDZBQOSA-N 396.531 5.747 30 20 GKED N#Cc1ccc(C(=O)N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)s1 478108762 PSDWZVWFFJOSCM-UHFFFAOYSA-N 377.296 5.246 30 20 GKED C[C@@H](CC#N)NC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 480939643 STZRGKGHAVXGGA-ZDUSSCGKSA-N 380.835 5.104 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2ccccc2C(F)(F)F)cc1 481737560 PGOMOVNZAFWEHL-UHFFFAOYSA-N 398.409 5.981 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 484909420 SMXCXZHQKXWTAX-QGZVFWFLSA-N 375.925 5.120 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccccc2Cl)o1)c1nc2c(s1)CCCC2 487090488 XFUONLZZYITVPQ-UHFFFAOYSA-N 398.915 5.768 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N[C@@H](CCCC#N)c1ccccc1 487327549 RZTQXYZHVHHKCQ-FQEVSTJZSA-N 375.497 5.284 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 498431309 UYLCUXAJCNTZRA-MRXNPFEDSA-N 388.433 5.509 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)cc1 499232110 GNPOXCCYHBMCRV-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c(C)c1 499483663 JDWZHCFTOWVXTC-CYBMUJFWSA-N 378.419 5.313 30 20 GKED C=CCCc1ccccc1NC(=O)c1cn(CC)c2ccc(Cl)cc2c1=O 504269705 CDRKVMVBBPVJEE-UHFFFAOYSA-N 380.875 5.046 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCC2(C3CC3)CCC2)cc1 506079903 NKJMINWLGBYLSO-UHFFFAOYSA-N 389.499 5.033 30 20 GKED CCN(C(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccc(C#N)cc1 510355221 NJAQOGFVJMAFIC-UHFFFAOYSA-N 396.446 5.550 30 20 GKED N#C[C@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1nc2ccccc2s1 513676502 GGMFWASRCHDOKA-LJQANCHMSA-N 384.460 5.365 30 20 GKED CCSc1cccc(Br)c1NCCCC1(C#N)CCOCC1 516824423 WEEHIJUTZCXRMK-UHFFFAOYSA-N 383.355 5.074 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(OC3CCCC3)cc2)c1 518374421 ITPSZVFJEOCCAK-UHFFFAOYSA-N 378.472 5.067 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCn1ccc2ccccc21 518754404 KCIHGOZMTANGDF-KRWDZBQOSA-N 392.528 5.247 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(F)cccc1F 519988097 DVTVSQPDHPSROV-CQSZACIVSA-N 393.393 5.511 30 20 GKED C=CCOc1ccc(CNCc2ccc(-c3nc4ccccc4s3)o2)cc1 520948009 MBADHAJAKSHNJO-UHFFFAOYSA-N 376.481 5.411 30 20 GKED Cc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c2[nH]ncc12 521144840 MUIVTWDQCMAUSM-UHFFFAOYSA-N 398.491 5.288 30 20 GKED N#CCc1cccc(-c2nc(-c3ccc(COc4ccccc4F)cc3)no2)c1 521910176 MYWGUMVHWMHDIR-UHFFFAOYSA-N 385.398 5.188 30 20 GKED CCCN(C(=O)NCc1ccc(C#N)cc1)[C@@H](C)c1ccc(Cl)c(Cl)c1 523005405 UHHSRAQOXUNHQU-AWEZNQCLSA-N 390.314 5.548 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1c(F)cccc1F 524565323 PODCDNBAQNYBQA-OLZOCXBDSA-N 375.444 5.099 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C)OCC 534392307 CZIBJOVUVFSFNO-KRWDZBQOSA-N 376.547 5.221 30 20 GKED N#CC1(c2ccc(C(=O)N3Cc4ccccc4[C@@H](c4ccccc4)C3)cc2)CC1 538586506 FLFYCRJHOSMGPE-XMMPIXPASA-N 378.475 5.030 30 20 GKED C[C@H]1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)c2cc(Cl)ccc2S1 539628530 FTDNSMVTTYZICP-AWEZNQCLSA-N 382.916 5.426 30 20 GKED C[C@H]1COc2ccccc2CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 542953221 CEECWCGKEUVLKU-KRWDZBQOSA-N 399.450 5.166 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 549299371 CWVFZTVEFXRXEL-DLBZAZTESA-N 394.540 5.519 30 20 GKED Cc1ccc(Cl)cc1N(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 550002555 UBJYRMQFMQKJMV-OAHLLOKOSA-N 387.936 5.118 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1N[C@@H](C)c1ccccc1 554679628 UHKNGIXQVOIJCJ-ROUUACIJSA-N 385.467 5.137 30 20 GKED N#CC[C@H](Cc1nc(-c2ccccc2OCC2CCCC2)no1)c1ccccc1 558362567 QCSKZWOAMXPIBM-HXUWFJFHSA-N 387.483 5.546 30 20 GKED Cc1c(C(=O)Nc2ccc3nc(C(F)F)sc3c2)sc2ccc(C#N)cc12 560607453 WUYPXVGPKCZIAJ-UHFFFAOYSA-N 399.447 5.881 30 20 GKED C[C@H](NCc1cc(F)c(C(F)(F)F)cc1F)c1nc(C(F)(F)F)cs1 566991296 YMPCSCIQEPWYLG-LURJTMIESA-N 390.299 5.310 30 20 GKED Cc1c(C(=O)Nc2cn(C)nc2C2CCCCC2)sc2ccc(C#N)cc12 583006285 YUXINYUEBRILNC-UHFFFAOYSA-N 378.501 5.115 30 20 GKED Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)CCCCCC#N)nc2c1 588822324 FDNLYPWQUDINNT-UHFFFAOYSA-N 391.540 5.920 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 592974695 XFMJOXKDOQLCSA-KRWDZBQOSA-N 382.460 5.350 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)C1 596730996 KLQVXAYAAAVSJE-CQSZACIVSA-N 394.475 5.260 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCCc1ccc(Cl)cc1Cl 603745889 XYJSAXAQXPWGMG-UHFFFAOYSA-N 390.314 5.029 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCOc1cccc(F)c1 604358234 HQHUWHXSOCIGKZ-UHFFFAOYSA-N 390.414 5.206 30 20 GKED CCO[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 604428883 MOSWRTAVOWERGR-SFHVURJKSA-N 399.878 5.037 30 20 GKED COc1ccc(CN[C@@H](c2ccc(Cl)cc2)C(C)C)cc1OCCCC#N 604512452 SXFCVLNJQVZPFC-JOCHJYFZSA-N 386.923 5.518 30 20 GKED CCc1c(C)sc(NC(=O)c2sc(-c3ccc(F)cc3)nc2C)c1C#N 609032810 GWYSPCGJYARLLH-UHFFFAOYSA-N 385.489 5.314 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c2ccccc2n1 609377595 AZGSOZXZHQIVLK-MRXNPFEDSA-N 389.524 5.862 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609398767 PJKZBGVCZYKSPC-FXAWDEMLSA-N 381.545 5.943 30 20 GKED N#CCCn1cc(CNCc2cccc(Cl)c2Cl)c(-c2ccccc2)n1 609598699 UEVYZESEAORAGN-UHFFFAOYSA-N 385.298 5.060 30 20 GKED Cc1cccc2c1CCCN2C(=O)c1cccc(COc2ccccc2C#N)c1 609627787 HZFNNQYAMOEUNZ-UHFFFAOYSA-N 382.463 5.039 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C[C@@H]3CCc4ccccc43)c2)cc1 609652064 UQEBNWNOKKWECW-QFIPXVFZSA-N 396.490 5.390 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccc(F)c(F)c1 609725191 MMKDYFQUXOPVGL-UHFFFAOYSA-N 398.796 5.559 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N[C@@H]2CSc3ccccc32)cc1 609791997 YKJRIZKQQQUEHR-LJQANCHMSA-N 390.439 5.066 30 20 GKED N#Cc1nnc2ccccc2c1NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 610128254 LIGXPNMXJIDFCM-HXUWFJFHSA-N 389.462 5.227 30 20 GKED C[C@@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1cccc(C#N)c1 610359633 MFYBZSXEQWWZFP-GOSISDBHSA-N 379.463 5.052 30 20 GKED C[C@@H](NC(=O)N(Cc1c(Cl)cccc1Cl)C1CC1)c1cccc(C#N)c1 610406791 LQTMQUNJXDPPTD-CYBMUJFWSA-N 388.298 5.300 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1)c1cccc(C#N)c1 610407239 SHCIPWLZLRBRRW-QGZVFWFLSA-N 379.479 5.303 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1nccc2ccccc12 682995155 PAFDRRFVNRKMSD-GOSISDBHSA-N 399.837 5.566 30 20 GKED CCC(CC)(C(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)c(Cl)c1 728815167 QVFZYMSTSOEEBN-UHFFFAOYSA-N 391.298 5.592 30 20 GKED C#Cc1ccc(C(=O)N(CC)Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)cn1 728862019 YYSQEVGIPBJHNR-UHFFFAOYSA-N 398.384 5.004 30 20 GKED N#Cc1ccc(SCC(=O)O[C@H](Cc2ccc(Cl)cc2)C(F)(F)F)cc1 733948741 YCGRKMIZAKUDQD-MRXNPFEDSA-N 399.821 5.021 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2ccccc2C(F)(F)F)c1Cl 734744865 ZJGIFBWRIPLJMV-UHFFFAOYSA-N 378.785 5.205 30 20 GKED N#Cc1ccc(CN(Cc2ccc(Cl)cc2)c2ccc3nc(O)[nH]c3c2)cc1 735873414 NGXKGMKRHPSNLB-UHFFFAOYSA-N 388.858 5.000 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2ccc(S(C)(=O)=O)c(F)c2)c1 741848086 VHGJCGRKCJDHEU-ZRDIBKRKSA-N 394.467 5.101 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)(C)C 744029296 SLUDBAJXRYNGTN-ZWFBASDOSA-N 376.456 5.119 30 20 GKED Cc1ccsc1[C@H]1C[C@H]1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 747904670 NAVTZYBQEUBWPB-ZWKOTPCHSA-N 378.522 5.077 30 20 GKED COC(=O)c1ccc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)o1 749450933 CXIMSGUUXNVLQG-DTQAZKPQSA-N 389.432 5.099 30 20 GKED Cc1cc(-c2csc(NC(=O)c3ccccc3SCC#N)n2)ccc1F 763075407 CDOIHHXKHSLFFI-UHFFFAOYSA-N 383.473 5.126 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 766408368 DLRMAWPRXGYWHF-QHCPKHFHSA-N 398.462 5.168 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(CC[C@@H](O)c3ccccc3)c2)cc1 770557564 CYIRPCHVNZGEMA-UQBPGWFLSA-N 386.495 5.256 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1C#N 772108079 YPMJJPIIQISWJH-UHFFFAOYSA-N 399.516 5.398 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2ccc(F)cc2C#N)cc1 772164018 NWDUKEIGMIYDFX-UHFFFAOYSA-N 387.418 5.431 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 775871462 TVHVFUINMLZJCA-JTQLQIEISA-N 383.757 5.294 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(C(F)(F)F)cnc1Cl 779768434 KYXDTWUBNBHXCG-UHFFFAOYSA-N 385.798 5.012 30 20 GKED Fc1ccc(CON=Cc2cccn2Cc2cccs2)c(Br)c1 780290752 ZANNAZBDOOZKJT-UHFFFAOYSA-N 393.281 5.050 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C/c1csc(-c3ccccn3)n1)C2 782369852 PIDXCTXLWHMURF-UKTHLTGXSA-N 397.297 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C 789720230 VNFDEMAKXPZCES-VQIMIIECSA-N 386.536 5.123 30 20 GKED COc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cc1OCc1cccnc1 795810768 KABICJOCVQDENU-QHCPKHFHSA-N 399.494 5.420 30 20 GKED N#CC1(CCCOC(=O)c2cccc(F)c2Sc2ccccc2)CCOCC1 800198549 VNYOOCHNTSGPCE-UHFFFAOYSA-N 399.487 5.234 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCSc2cccc(Cl)c2)s1 809006713 INCGPTCCKYZWEQ-AWEZNQCLSA-N 378.950 5.453 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\C(=O)c3ccccc3[C@@H]2C)cs1 809159628 STZTUEURYHKSNJ-GHOUAXAESA-N 392.455 5.350 30 20 GKED N#CCC1(OC(=O)c2cccc(Oc3ccc(Cl)c(Cl)c3)n2)CCC1 810856592 WCCIEVZIMMZWBF-UHFFFAOYSA-N 377.227 5.174 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1cccc(C#N)n1)CC(C)(C)O2 811863069 OSDBERWVZCOWQI-QGZVFWFLSA-N 394.475 5.015 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2CCC3(CC2)CC3(F)F)cc1 854302266 BGFBUGWDOPAHJD-FUHYEJFZSA-N 395.453 5.432 30 20 GKED CC1(C)CN(C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)CC[C@H]1C(F)(F)F 857493559 DXFINESXDODIFI-CHWSQXEVSA-N 385.323 5.153 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 862721292 CQFBUCBRPIDRRV-UHFFFAOYSA-N 382.460 5.159 30 20 GKED O=C1/C(=C\c2ccc(C(F)F)nc2)CCC/C1=C\c1ccc(C(F)F)nc1 865214233 POJSJHWCIMNQNK-DJJIWSAGSA-N 376.353 5.572 30 20 GKED O=C(Nc1ccc(F)c(C(F)F)c1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 880686418 HFDHRICBMITVSB-UHFFFAOYSA-N 394.237 5.112 30 20 GKED COc1ccc2[nH]cc(CC(=O)OCc3ccc(-c4ccccc4C#N)cc3)c2c1 915517133 IITMBBXFYPXNFU-UHFFFAOYSA-N 396.446 5.001 30 20 GKED Cc1cccc(C)c1OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 916977665 VYCPUPLCJKQTDU-QGZVFWFLSA-N 396.899 5.336 30 20 GKED Cc1ccc(Cl)c(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917042998 FPBDTKXVEPYYDE-GFCCVEGCSA-N 391.279 5.167 30 20 GKED CCCCCCCOc1ccc(/C=C\c2nc3c(C(=O)O)cccc3o2)cc1 1776788045 OUYVLWPBXNPEIB-QINSGFPZSA-N 379.456 6.046 30 20 GKED COc1ccccc1Oc1ccc(/C=C\C(=O)c2csc(C(=O)O)c2)cc1 1777388522 ROSOUZCYWSNICC-FLIBITNWSA-N 380.421 5.143 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CCCc3c[nH]c4ccccc34)n2)cc1 7737611 PQGOXQXUVYVDLN-UHFFFAOYSA-N 386.480 5.124 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)CCc1ccc(OC(C)C)cc1 59849300 FHNWUJQGVDKIPR-GOSISDBHSA-N 386.561 5.254 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)c1cccc(C#N)c1 69359851 UPZZULCFQJZCMB-UHFFFAOYSA-N 388.279 5.265 30 20 GKED N#C[C@H](C(=O)Cc1c[nH]c2cc(Cl)ccc12)c1nc(-c2ccccc2)cs1 70033698 IFWYMVNBNWBNKZ-QGZVFWFLSA-N 391.883 5.364 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 124197986 GYFBTAYZYCWUHD-UHFFFAOYSA-N 392.846 5.063 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)ccc1OC 180175172 WZGVIOHLSCFMFU-SIKLNZKXSA-N 384.907 5.270 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccc(C(F)F)cc3)c2)c1 185170121 ZKHBWLNTZAXCIO-UHFFFAOYSA-N 378.422 5.365 30 20 GKED CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 247325996 LXOKCIWQJBLTLR-OWCLPIDISA-N 377.579 5.267 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@]2(C)[C@H](C1)C2(F)F 292720399 UMUVBRPQCRSCJP-PZJWPPBQSA-N 397.425 5.168 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2nnc(-c3ccccc3Cl)s2)c1 302180648 ZFQVBZWVZYQDDM-AWEZNQCLSA-N 384.892 5.152 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccccc1-c1nc(C(C)(C)C)no1 303177612 KDVOUZARLMILRP-UHFFFAOYSA-N 393.462 5.002 30 20 GKED CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 303383226 WMBPSFOKAVJOIR-JKSUJKDBSA-N 388.558 5.395 30 20 GKED O/C(=N/CCc1c[nH]c2ccccc12)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329434933 JJXRIKIPBIBBAU-SFHVURJKSA-N 390.531 5.174 30 20 GKED C[C@H](/N=C(/O)[C@H]1CC12CCCC2)c1nc(-c2ccc(Br)cc2)no1 329974162 ZZFPEKMWVWUQTE-SMDDNHRTSA-N 390.281 5.097 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccc2oc(C(C)(C)C)nc2c1 330261940 UPJUPZOYPCBKMK-ZDUSSCGKSA-N 399.516 5.421 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)C(C)(C)Cc1ccc(C#N)cc1 410628196 WPDSWJOOKKOBKG-INIZCTEOSA-N 383.561 5.235 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccc(O)c1 429762696 DFZJQKCMIUEXKL-CQSZACIVSA-N 391.402 5.078 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)NCC1(CC#N)CC1 430760860 KDASSUSZPVLFOR-LBPRGKRZSA-N 390.350 5.226 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 433157649 NFOQWDNMMNBTPU-QFIPXVFZSA-N 386.455 5.431 30 20 GKED N#CC1(c2ccc(C(=O)N[C@H](c3ccc(F)c(Cl)c3)C(F)(F)F)cc2)CC1 436467330 BJEGPKJFLQHIHN-MRXNPFEDSA-N 396.771 5.068 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1C(F)(F)F 437989129 CIAGCUBGMZNWBN-QAPCUYQASA-N 391.368 5.148 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 438624543 GQOWISBZIDGGAE-HNNXBMFYSA-N 379.407 5.316 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 439106763 KCXSSEUVFVYYRO-UHFFFAOYSA-N 388.210 5.206 30 20 GKED Cc1cc(CN[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)ccc1C#N 443987206 KHPPBVPLJSFWQA-IBGZPJMESA-N 377.488 5.297 30 20 GKED C=C(C)COc1cc(CN[C@H](CC(F)(F)F)c2ccccc2C)ccc1OC 444019820 YOCXKNOPLBPRPJ-LJQANCHMSA-N 393.449 5.742 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2noc(-c3ccccc3)n2)n1 446063373 QMTHFTNKQPYEEI-LLVKDONJSA-N 390.390 5.184 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457740157 GQSNNOLWIRLTHG-KWQFWETISA-N 395.265 5.404 30 20 GKED CCCCc1nc(CNc2cccc(OCc3cccc(C#N)c3)c2)cs1 462215587 XJLAVLBPMCQPJH-UHFFFAOYSA-N 377.513 5.548 30 20 GKED COc1cccc(OC)c1Oc1ccc(CNc2c(Cl)cccc2C#N)cn1 462780283 QPTGVRZLYOCBLL-UHFFFAOYSA-N 395.846 5.028 30 20 GKED CN1CCC[C@H](CNc2ccc(C#N)cc2C(F)(F)F)[C@H]1c1cccs1 462870149 JJUIELNINPZYRT-KDOFPFPSSA-N 379.451 5.134 30 20 GKED CSc1cccc([C@@H](NC(=O)c2ccc(C#N)cc2)c2cc(F)ccc2F)c1 464113540 KNXSWWCCZFWECE-OAQYLSRUSA-N 394.446 5.078 30 20 GKED CC(C)OCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464292359 DLCKUDSQTTUURU-UHFFFAOYSA-N 392.377 5.123 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1ncc(-c2cccc(Cl)c2)o1 464821732 JORUSVHSOSQAPS-VQTJNVASSA-N 377.875 5.267 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 470581357 FGXPSKBUUQHIBQ-TZIWHRDSSA-N 385.511 5.272 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 471279059 XDKYCALYMJSRJI-SFHVURJKSA-N 379.529 5.549 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)s2)c(C)c1 474449163 UFILJLHRHCKTSQ-INIZCTEOSA-N 395.553 5.805 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccccc1 474895571 MZMCCFZJUDXFSV-PGRDOPGGSA-N 394.927 5.695 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCCc2cc(OC)ccc21 476174828 YBUUYRTZQQWXTA-FQEVSTJZSA-N 377.528 5.996 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(C)cc3)n2)nnc1-c1cccs1 481369018 GYLBZXXJRQTYIH-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC[C@H](CN(CC)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 482250934 AUDAGTNCBSCKCE-HXUWFJFHSA-N 399.494 5.401 30 20 GKED C[C@](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)(C1CC1)C(F)(F)F 482655213 BUXDMMZDUGVQOA-FQEVSTJZSA-N 388.389 5.006 30 20 GKED Cc1nc(CN(C(=O)c2ccc(C(C)(C)C#N)cc2)c2ccc(F)cc2)cs1 483304024 CHYLKXKTFOSQOC-UHFFFAOYSA-N 393.487 5.239 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1 483628320 YTFAHTKDZKBCJS-JXFKEZNVSA-N 397.519 5.979 30 20 GKED Cc1ccc2oc(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)cc2c1 485945887 RXNGSCVDRLNZNA-UHFFFAOYSA-N 396.446 5.639 30 20 GKED C[C@H](CC(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2)c1c[nH]c2ccccc12 486116922 OAIDGKSDMMIHEH-KNEUKCCGSA-N 389.543 5.373 30 20 GKED N#Cc1cc(F)ccc1CN1CCC(c2nc3cc(Cl)ccc3s2)CC1 489566138 KVZCMQMAHJDVCO-UHFFFAOYSA-N 385.895 5.340 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)ccc1C(F)(F)F 489673901 DQTIAMIJVPGVPT-UHFFFAOYSA-N 393.796 5.451 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 493302835 OQRCTRLKDGVBBI-UHFFFAOYSA-N 388.945 5.282 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(C)c(Br)cc1F 497451537 LGXPLYKGFWRBBI-UHFFFAOYSA-N 383.286 5.178 30 20 GKED CCCOc1ccc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cc1OCC 499322497 GCWPOHSFXZSACO-UHFFFAOYSA-N 380.488 5.049 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CCc3ccc(F)cc3)c2)cc1 501482155 SOPCBYZGNWETCK-UHFFFAOYSA-N 388.442 5.042 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@@H]3CCC[C@H]3c3ccccc3C(F)(F)F)CC2)c1 509992878 QRODNVUKXPSKFC-AZUAARDMSA-N 398.428 5.061 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCc1ccsc1 510828468 YFSDKPLWWMMIOM-UHFFFAOYSA-N 377.469 5.085 30 20 GKED N#CC1(C(=O)Nc2nc(-c3sccc3Br)cs2)CCCCC1 512944561 FCZUKDMTPNFRFC-UHFFFAOYSA-N 396.335 5.047 30 20 GKED CCN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1cc(C)ccc1C 513461907 AIBOEICTHJXTEK-UHFFFAOYSA-N 384.479 5.421 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OCC4CC4)cc3)n2)cc1 516710850 XHZSQPDRVOKOGI-FQEVSTJZSA-N 388.492 5.397 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 518661255 WAGLYDQKXSCUDJ-ZDUSSCGKSA-N 396.903 5.234 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 523534189 TVTHKLVCFVUKAM-DEOSSOPVSA-N 399.494 5.553 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 523628429 NCNYTIIANFMLBH-XFQXTVEOSA-N 397.906 5.027 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1F 524565324 PODCDNBAQNYBQA-QWHCGFSZSA-N 375.444 5.099 30 20 GKED CCOc1ccc(-c2nc(CSc3ccccc3C#N)cs2)cc1OC 525084252 DRJOGFZSHGZKMC-UHFFFAOYSA-N 382.510 5.381 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1 525756674 ONHKFMMSOWUTTC-KGLIPLIRSA-N 381.932 6.055 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C1CC1 534229828 OPQCVJRNBBMPOB-HUUCEWRRSA-N 397.548 5.770 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C1CC1 535712534 QMIRFGXXOGVWMV-MRXNPFEDSA-N 384.483 5.522 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(C(=O)OC(C)(C)C)c1 536690273 QSMHNXMKVFIBDB-HNNXBMFYSA-N 396.512 5.146 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(C#N)c2)CC1)c1ccccc1OCc1ccccc1 538034710 OQHSFCVQEOFSSV-LJQANCHMSA-N 396.490 5.046 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c1C 543862627 DPFZEIWZMXGRGN-ZDUSSCGKSA-N 378.419 5.313 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccc4cc[nH]c4c3)no2)c2ccccc21 544218785 NOXHACWRCZCELX-HJWRWDBZSA-N 379.423 5.257 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc[nH]c2C2CC2)cc1Cl 550597816 NWBSHDAXOSSUQF-LJQANCHMSA-N 375.859 5.453 30 20 GKED CCOC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCCC1 551562026 TYSBSIKFRVWEAH-LJQANCHMSA-N 382.891 5.283 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2C[C@H]3CCC[C@@H](C3)C2)cc1 557516407 SPCGDDHOEDWVSO-PMACEKPBSA-N 376.525 5.113 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc2n[nH]cc2c1 558345834 ZKUJVTJMNAISAM-OAHLLOKOSA-N 397.438 5.110 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CC1 580890381 LOQQEXAPUZBVNW-UHFFFAOYSA-N 392.434 5.037 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cs1 589830058 FEYJFWHJBFPMPB-AWEZNQCLSA-N 387.386 5.022 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Cl)ccc3Cl)cn2)c1 603622407 UVUKEPBWFRONPZ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603828911 DCNZOJPWPRSZCM-HNNXBMFYSA-N 390.418 5.110 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccc(OC(F)F)cc1 603967992 FEHVLIWQCCKRFY-UHFFFAOYSA-N 384.407 5.069 30 20 GKED CCc1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)sc1C 604004079 RLHQLWKFWKXRRB-UHFFFAOYSA-N 390.508 5.516 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 609164762 VBCJOFHCNWMJKE-HXUWFJFHSA-N 399.881 6.038 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)c2)cc1 609177118 KCBUPTCCAXFKQF-JKSUJKDBSA-N 388.389 5.658 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Sc2ccccc2F)c2ccccc2)cc1 609261077 LDROFOBTTREQBU-OAQYLSRUSA-N 376.456 5.364 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609428433 GTXFOPYHTBCHNF-IRXDYDNUSA-N 382.529 5.610 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2)o1)c1cccc(C(F)(F)F)c1 609460368 CCNQRIMBKVGQKS-LJQANCHMSA-N 398.384 5.279 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C[C@@H]3CCOc4ccccc43)cc2)c1 609786436 JZNAQDAUOBBVEW-SFHVURJKSA-N 384.435 5.245 30 20 GKED C[C@H](NCc1ccccc1CN[C@@H](C)c1cccc(C#N)c1)c1cccc(C#N)c1 611387319 KIKJFMFLOYZGTB-PMACEKPBSA-N 394.522 5.132 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 612302550 CUXBZITYNJTSBQ-NRFANRHFSA-N 394.862 5.162 30 20 GKED C[C@@H](C1CC1)N(C)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646437358 PYZSIXZCNUHLQE-VIFPVBQESA-N 386.311 5.238 30 20 GKED C[C@@H]1C[C@H](Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c2nccn21 647323531 WDXPQXPVKKGTOG-SKDRFNHKSA-N 381.295 5.290 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1coc(C2CC2)n1 648494580 ZIVIDUVEEARKPF-UHFFFAOYSA-N 396.262 5.094 30 20 GKED C=C(C)Cn1c(C2CCCC2)nnc1N1CCC[C@H](c2nc3ccccc3o2)C1 670194710 DWODTASIWRNPJR-SFHVURJKSA-N 391.519 5.037 30 20 GKED Cc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 728769683 UQDYEKWOMIGAKB-HNNXBMFYSA-N 396.462 5.551 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1nc2ccccc2s1 733083023 BFOQKUCXUDXNLO-CMDGGOBGSA-N 393.449 5.224 30 20 GKED C=CC[C@@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 734458027 RZKVRWNADJBAGY-JOCHJYFZSA-N 393.918 5.119 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N[C@@H](c3cccs3)C3CC3)c2)s1 740466851 HJZFISHKZFZZRU-HXUWFJFHSA-N 393.537 5.299 30 20 GKED C=C(C)COc1cc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OC 747063303 GPRSHVMGINERCT-NVNXTCNLSA-N 399.834 5.172 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2ccc(Cl)c(Cl)c2)n1 747197942 OZYTXAXFADYART-ZDUSSCGKSA-N 381.328 5.772 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1cc(Cl)ccc1OC(F)F 748442190 PYQXJAWYNHMQKR-CLFYSBASSA-N 388.801 5.082 30 20 GKED CC1CC(C#N)(C(=O)Oc2ccc(NC(=O)c3ccc(C(C)(C)C)cc3)cc2)C1 758156437 VDCYBNBUZVIXRP-UHFFFAOYSA-N 390.483 5.082 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\c3ccc(Cl)nc3)cc2)c1 759044479 OVAOJKBCEOMDLN-WZUFQYTHSA-N 375.815 5.051 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 761535489 UFZVSYCOSDFDAX-UPVQGACJSA-N 382.463 5.019 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1cc(Br)ccc1F 763122435 QHHVJEQLHFYMPX-FNORWQNLSA-N 389.249 5.003 30 20 GKED Cc1cc(Cl)ccc1C=Nn1cnnc1SCc1ccc(Cl)cc1 767358992 FEZYUHDLKWWAAV-UHFFFAOYSA-N 377.300 5.068 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(N2CCCC2=O)cc1 774479951 STQVUBVQNNMMLC-IBGZPJMESA-N 395.506 5.203 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2)c1 780151165 NNFNCUDQRDGJKW-HNNXBMFYSA-N 392.842 5.675 30 20 GKED COc1ccc(-c2nc(/C=C3\CSc4c(F)cccc4C3=O)cs2)cc1 797227647 GZDITAAKJPGNDI-UKTHLTGXSA-N 383.469 5.330 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2cccc(-c3ccccn3)c2)C(=O)c2ccccc21 802709514 QRDQELLJGZQBTA-ZHFOUCBBSA-N 383.447 5.065 30 20 GKED CCN(C(=O)c1cc(F)c(C(F)(F)F)cc1F)[C@H](C)c1ccc(C#N)cc1 804289615 DXSXXSZFURKGHB-LLVKDONJSA-N 382.332 5.079 30 20 GKED CCCOc1ccc(-c2nc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)cs2)cc1 809092954 VKFMIODGSBHCJE-IYBDPMFKSA-N 384.501 5.086 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccoc2C(F)(F)F)s1 810053027 CXXKONPPLLRXCK-UHFFFAOYSA-N 375.416 5.305 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2cscc2C(F)(F)F)SC1=S 811624429 DVHVSOKWKUIJLY-ACAGNQJTSA-N 396.440 5.044 30 20 GKED Cc1cc(C(F)(F)F)cc(C)c1NC(=O)Cn1nc(C(F)F)cc1C(F)F 828951459 CEPUHHPDKSCXFT-UHFFFAOYSA-N 397.294 5.033 30 20 GKED CC(=O)[C@@](C#N)(CCN(C)[C@@H](C)c1sc(C(C)C)nc1C)c1ccccc1 878301798 CEYOYNNKAWOIFZ-JTSKRJEESA-N 383.561 5.008 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Br)c2)cc1 915086392 JQNNMVIBASHCGO-HXUWFJFHSA-N 391.268 5.357 30 20 GKED N#Cc1cccc(COc2cccc(NC(=S)Nc3ccc(F)cc3)c2)c1 916000814 UTTJVZOWVGWXEE-UHFFFAOYSA-N 377.444 5.085 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1 916844629 RGPGUNAGMVCSQG-LJQANCHMSA-N 387.483 5.135 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 916849503 WULNHPNENUEYLH-BWKNWUBXSA-N 394.499 5.945 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc(Cl)cc(Cl)c1 916900560 QEHPZSPJFCPSBH-QGZVFWFLSA-N 389.282 5.079 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3[nH]c(C)c(C)c3c2)cc1 916947009 CSFPDTNDJVVIAJ-SZNDQCEHSA-N 387.483 5.259 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3cccnc3)cc2Cl)cc1 917876642 OVDXPRZREUEXBG-BJMVGYQFSA-N 375.815 5.051 30 20 GKED C[C@@H](C1CC1)N(C(=O)c1ccccc1OCC#N)c1cccc(C(F)(F)F)c1 920004988 BAZKOKMTCAHKBE-AWEZNQCLSA-N 388.389 5.053 30 20 GKED CC[C@@H](C)c1nnc(N2CCC[C@@](C)(C#N)C2)n1Cc1ccc(C)cc1SC 1752750823 MKNQQQQUQGJUKO-VGSWGCGISA-N 397.592 5.000 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NNc1c(Cl)cccc1Cl 1776049053 YRVMFVMBBZNHRW-CYBMUJFWSA-N 395.286 5.266 30 20 GKED COc1cc(/C=C/C(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1 6339130 DXENPCPDGJUBEK-ZRDIBKRKSA-N 389.407 5.079 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1ccc(C#N)cc1 22475111 RZQTYVUSPMPFER-UHFFFAOYSA-N 387.386 5.261 30 20 GKED CC(C)Cn1cc(C(=O)Nc2cccc(OCCCC#N)c2)c2ccccc21 58535053 OIZACBDGNMBPFY-UHFFFAOYSA-N 375.472 5.232 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCOc1ccc(Cl)cc1Cl 63661893 OVWXDUVHVNSGSV-UHFFFAOYSA-N 391.298 5.071 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1oc2ccccc2c1COc1ccccc1 63960819 UCLUSTHYUCOQSB-UHFFFAOYSA-N 382.419 5.444 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2c(C(C)C)cccc2C(C)C)c1 113998779 YSWRGUXHESJYLH-IBGZPJMESA-N 393.531 5.936 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1 119930150 XOUPMHNSFQBQCS-CYBMUJFWSA-N 388.265 5.007 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(Cc2cccs2)n1C1CC1 151286637 JWCWLQBTVREJLO-UHFFFAOYSA-N 394.569 5.359 30 20 GKED C[C@H](Nc1ccc(C#N)cn1)c1nc(-c2ccc(Br)cc2)cs1 155352116 IPLZBJSAWIZZGP-NSHDSACASA-N 385.290 5.012 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(OC)cc1 178710031 QCOJGKKDQHYNST-WMLDXEAASA-N 397.425 5.200 30 20 GKED Cc1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 183498434 WVBBICZYPOOEAP-GFCCVEGCSA-N 392.267 5.212 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(COc2ccc(C#N)c(Cl)c2)cs1 190260549 BHYOACOFACTRSW-UHFFFAOYSA-N 397.887 5.240 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)cc1NC(C)=O 254930845 YELRDLIWZPVPKD-DAXSKMNVSA-N 397.780 5.222 30 20 GKED COc1ccc(C[S@@](=O)CCCCC(C)(C)C#N)cc1SC(F)(F)F 277505772 BPIZFAXMXMYFNO-VWLOTQADSA-N 393.496 5.276 30 20 GKED CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 303383224 WMBPSFOKAVJOIR-HOTGVXAUSA-N 388.558 5.395 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/CC1(c2cccc(Cl)c2)CC1 328813784 BXBGSBKNCIFXHZ-AWEZNQCLSA-N 390.936 5.035 30 20 GKED Cc1nc(N=C(O)[C@@H]2CCC(=O)[C@@H](C)C2)sc1Cc1ccccc1Cl 328893226 ACWFMCWJCQHEDK-SMDDNHRTSA-N 376.909 5.289 30 20 GKED N=C(O)[C@@H]1CCCN1Cc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 328975059 BFEZBCSMZBBGTL-KCLUMXDGSA-N 383.536 5.381 30 20 GKED N#Cc1cccc(Cl)c1N1CCC[C@H](c2n[nH]cc2N=C(O)C2CCCC2)C1 330048026 JUDJXEUGVLSKGC-INIZCTEOSA-N 397.910 5.097 30 20 GKED N=C(O)N1CCCc2ccc(N=C(O)C3(c4ccc(F)cc4)CCCCC3)cc21 330321074 RZFCJFFNJMRVFR-UHFFFAOYSA-N 395.478 5.561 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1C(O)=Nc1ncc(C2CCCCC2)s1 330332682 PCPPRAYTQRFECI-INIZCTEOSA-N 387.553 5.180 30 20 GKED Cc1c(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)sc2ccc(C#N)cc12 426622270 DRGGBMAIAZHPDK-UHFFFAOYSA-N 386.358 5.212 30 20 GKED N#CCC1(CNC(=O)c2oc3ccccc3c2COc2ccccc2Cl)CC1 431160163 AOJCIWKSRBYKGV-UHFFFAOYSA-N 394.858 5.089 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 432834803 LBXROKAKLONBSI-UHFFFAOYSA-N 399.237 5.008 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)F 433145339 PVJAGVFWUJAPTE-CXAGYDPISA-N 375.444 5.209 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)[C@@H](C)c2cccc(O)c2)cc1 433926999 OXDUZKNUANGNCM-KRWDZBQOSA-N 386.451 5.198 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 436126666 MCSUXEWGDJLBOH-UHFFFAOYSA-N 378.428 5.464 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Cl)c1cccc(OCc2ccccn2)c1 439427101 AJIALMVXBQCYAH-INIZCTEOSA-N 377.875 5.036 30 20 GKED C=C[C@@H](CC(=O)N(Cc1ncc[nH]1)c1cc(C)ccc1Cl)c1ccccc1 440881117 OIESNXKYYKBEIW-KRWDZBQOSA-N 379.891 5.265 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(-c2ccco2)cc1F 448249886 QYTNOUKSGMOLHF-UHFFFAOYSA-N 391.446 5.078 30 20 GKED C[C@H](c1ccc(C(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1)C(F)(F)F 455825549 PBRFRFFGJYQWDS-XPGWFJOJSA-N 386.417 5.264 30 20 GKED Cc1cc(F)cc2c(N3CCC(OC4CCC(C)CC4)CC3)c(C#N)cnc12 462830683 DKSGPMHRBNWGGQ-UHFFFAOYSA-N 381.495 5.118 30 20 GKED CCO[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1=CCCC1 465172829 YATLSHJRCBBCBJ-QFIPXVFZSA-N 376.456 5.195 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)c1cn(CCCC#N)c2ccccc12 469028912 SEASDXDWYQUSOW-UHFFFAOYSA-N 377.463 5.135 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 469959698 NZJFHSNFJBZGPJ-INIZCTEOSA-N 398.528 5.521 30 20 GKED C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 472757312 VYYBXYNHRNHSFM-HBFSDRIKSA-N 393.556 5.566 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCCC3(CCC3)C2)cc1 473327225 DHVMJIMFLBRPRY-UHFFFAOYSA-N 376.525 5.257 30 20 GKED CC(C)Oc1ccc2ccccc2c1CNC(=O)C[C@H](CC#N)c1ccccc1 476692524 QULNSOSCYSRSNC-NRFANRHFSA-N 386.495 5.331 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)C1 483488054 HCHRDCSMQZVONV-GHTZIAJQSA-N 396.918 5.340 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CC1 490315628 VHEOUHRKIFGFBN-YCRPNKLZSA-N 379.529 5.520 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)o2)n1 495206716 PTRQOUJLFOBPID-ZDUSSCGKSA-N 376.359 5.220 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(Cl)c(C#N)c2)cnn1-c1cccc(Cl)c1 498436198 OCSTZPGGOOVHAN-UHFFFAOYSA-N 399.281 5.426 30 20 GKED N#C[C@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccc(Cl)cc1 499837002 KQTGEHFYVRXIPC-KRWDZBQOSA-N 379.312 5.247 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CSc3ccccc3)c2)cc1 501451095 NLVAYNRVXHDQSS-UHFFFAOYSA-N 388.492 5.062 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ncccc3-c3ccccc3)o2)cc1 504546753 KXEXQIMTXOODRL-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 505024766 WNGDCNVHLQDITQ-GOSISDBHSA-N 395.572 5.552 30 20 GKED C=C[C@H](CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 507278117 DNLQDEGMFRWGBK-AUSIDOKSSA-N 385.511 5.490 30 20 GKED CN(C(=O)c1oc2ccccc2c1COc1ccccc1)c1ccccc1C#N 508093536 IULVPBJPHYUORX-UHFFFAOYSA-N 382.419 5.160 30 20 GKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 512616353 AKLFFZNYCWKWQX-IAGOWNOFSA-N 387.458 5.361 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cnc(C4CCCCC4)s3)cc2)ccn1 515021343 WVSAIWYYKFHFAE-UHFFFAOYSA-N 390.512 5.862 30 20 GKED Cn1c(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc2ccccc21 515679744 SEIBTZXNEAMFCN-UHFFFAOYSA-N 395.462 5.076 30 20 GKED C=CC1CCN(C(=O)[C@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)CC1 518438060 RELBGNGXFLKMJV-AWEZNQCLSA-N 390.936 5.041 30 20 GKED CCN(C[C@H](C)C#N)C(=O)[C@H](Oc1cccc(Cl)c1Cl)c1ccccc1 518545805 GCGULSHRJHKYAD-AUUYWEPGSA-N 391.298 5.122 30 20 GKED C[C@H](NC(=O)Nc1ccccc1CN1CCc2ccccc21)c1ccc(C#N)cc1 518883669 RSMGRCHVONNUOZ-SFHVURJKSA-N 396.494 5.004 30 20 GKED C[C@H](S[C@@H](C)c1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 520117757 INGZHKXYWSQMHR-RYUDHWBXSA-N 390.961 5.583 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cc3c(OC(F)F)cccc3[nH]2)cc1 520889335 FBSMWRDHLDRKHW-SFHVURJKSA-N 397.425 5.061 30 20 GKED N#C[C@@H](NC(=O)CCSc1ccccc1Cl)c1cccc(C(F)(F)F)c1 521886407 VVQNQFGBTWIMKK-OAHLLOKOSA-N 398.837 5.222 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](Sc2ccc(C#N)cc2F)c2ccccc2)c1 524986737 HCRWYYIRJAXORP-JOCHJYFZSA-N 390.483 5.786 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2Oc2ccccc2)c(F)c1 525502821 WCWCNBSSDCJSET-UHFFFAOYSA-N 378.428 5.220 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)C1 527244464 LUQMHACKSXWAJO-RBBKRZOGSA-N 394.490 5.134 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CC23CCCCC3)cc1 536523591 CSZLUOCPSDRRPE-OAQYLSRUSA-N 376.525 5.303 30 20 GKED Cc1sc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 537293602 XXXZJHQEARGSCX-KBPBESRZSA-N 381.932 6.055 30 20 GKED C=CCCC[C@H](C)NC(=O)c1ccccc1SCc1cn2ccccc2n1 538333049 SBHUTQMCHLTOIW-KRWDZBQOSA-N 379.529 5.101 30 20 GKED CCC[C@H](C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 538827241 PPUZCARZPZSKGG-QGZVFWFLSA-N 378.497 5.288 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(C#N)c(F)c2)cn1 539608496 OEDRJRHBKJZDSI-INIZCTEOSA-N 391.446 5.134 30 20 GKED Cc1ccc(S[C@H](C(=O)N2CCC(CC#N)CC2)c2ccccc2)c(C)c1 541048562 WXRNOXVEPOXVTA-QFIPXVFZSA-N 378.541 5.289 30 20 GKED C[C@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542991428 DUMPSFXMRHUHTQ-SFHVURJKSA-N 391.474 5.271 30 20 GKED C=C(C)Cn1c(SCc2nc([C@H]3CCC[C@H](C)C3)no2)nnc1-c1ccco1 545640160 JSPRWDYWXKDAPW-GJZGRUSLSA-N 399.520 5.083 30 20 GKED CC(C)CN(C(=O)Nc1ccc(C#N)cc1Cl)[C@H]1CCCc2cccnc21 547830771 VWPFZORSESZTHH-IBGZPJMESA-N 382.895 5.174 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)C[C@@H](CC#N)c1ccccc1 553219799 MRYLQPJXPQMTBI-DWLFOUALSA-N 376.500 5.082 30 20 GKED CCN(C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(C#N)cc1 563649783 JRZMDPFJJRBDEI-UHFFFAOYSA-N 377.447 5.440 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)CC1 567813430 BRGVEMPJLTWSKC-UHFFFAOYSA-N 397.906 5.467 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C1(C(F)F)CCCC1 572318611 PXPQKGFRDRUYMK-UHFFFAOYSA-N 384.426 5.210 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc(-c3ccccn3)cc2)o1 576913581 DQIXGHJLLKMFGS-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(C3CCC3)cn2)cc1 580734391 BFSYZMZPIXCRRN-UHFFFAOYSA-N 399.519 5.765 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2csc(-c3cccc(C)c3)n2)c1 589381940 CTJGQYBEDFNNIM-UHFFFAOYSA-N 378.497 5.255 30 20 GKED O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc(C(F)(F)F)ccc1F 590327955 MFRDXADZTNZDQB-UHFFFAOYSA-N 380.263 5.185 30 20 GKED Cc1nc(-c2cccc(NC(=O)NC3(c4ccc(C#N)cc4)CCC3)c2)oc1C 594066386 QHOPOOFKXCGNTM-UHFFFAOYSA-N 386.455 5.031 30 20 GKED C[C@H](Cc1ccccc1)N(CCCC1(C#N)CCOCC1)Cc1ccccc1 595864869 FHPCTYWOMBWOBM-JOCHJYFZSA-N 376.544 5.220 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(OCCCC#N)c1 603972472 UVWPMQXJTBCDAM-KRWDZBQOSA-N 380.488 5.073 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cccc(OCc4cccs4)c3)[nH]c12 605363010 CPUWHXQLSHIFFQ-SFHVURJKSA-N 387.464 5.002 30 20 GKED N#CCn1c(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)cc2ccccc21 609165694 YYAPQKAAKQAKQP-UHFFFAOYSA-N 399.425 5.135 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)c1cc2ccccc2n1CC#N 609170026 KGKWXUXYKPXJOO-UHFFFAOYSA-N 393.490 5.316 30 20 GKED CC(C)CCc1ccc(NC(=O)N2CCC(Oc3cccc(C#N)c3)CC2)cc1 609207683 DVUJCJFZCCARNI-UHFFFAOYSA-N 391.515 5.222 30 20 GKED C[C@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(OC(F)F)cc1 609390983 AWWNWWMLKVBQLQ-NSHDSACASA-N 396.846 5.246 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 609403064 PXYILGROFPANTC-XOBRGWDASA-N 399.947 5.865 30 20 GKED CC(C)C[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccs1 609501128 QXMYGXHKJHXYDT-LJQANCHMSA-N 391.496 5.324 30 20 GKED CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610015736 RAEDFIPPXOIYRG-UZLBHIALSA-N 378.476 5.178 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)c1cc2ccccc2n1CC#N 610176112 TVNXTJULTYOUJA-UHFFFAOYSA-N 383.904 5.571 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 610357343 KZNPIVOTLXPQRQ-KSFYIVLOSA-N 389.886 5.361 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCSc2ccc(F)cc21 612228581 FHBGGXQPAWXBOX-OAHLLOKOSA-N 396.940 5.475 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3ccc(C#N)cc3Br)oc12 612494699 MOEGHGALPXJZEO-ZDUSSCGKSA-N 399.288 5.316 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1C 613403049 BPJONRWREQYPBH-LLVKDONJSA-N 394.443 5.738 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)CCCc1cc(Cl)sc1Cl 618738446 HNVATACCNVXYAM-OAHLLOKOSA-N 379.312 5.053 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1CC[C@H](C(F)(F)F)C1 619125466 BAQZGABNYJPYDE-IUCAKERBSA-N 387.286 5.135 30 20 GKED Fc1ccc(-n2cc(CNC(CCC(F)(F)F)CCC(F)(F)F)cn2)cc1 657706000 JFKLCRGYHYPFMR-UHFFFAOYSA-N 397.338 5.155 30 20 GKED Fc1ccc2c(c1)OCCC[C@@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 679768806 TZQRBNGSETVKBW-MDHDOXDCSA-N 399.350 5.539 30 20 GKED C=CC[C@H](C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 681649281 OWWALXZCSNRVNA-FMKPAKJESA-N 393.371 5.372 30 20 GKED CCOc1ccc(-c2nc(C(=O)N(CCC#N)c3ccc(C)cc3)cs2)cc1 726940675 ONHNZFHFLLZEMQ-UHFFFAOYSA-N 391.496 5.078 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)OCc1c(F)c(F)c(F)c(F)c1F 728653717 KSPIQJUBZHCDBO-SNVBAGLBSA-N 398.249 5.162 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CNc2cccc(Cl)c2)cc1 733951317 DETRHAYEJQPVBX-OAQYLSRUSA-N 375.859 5.046 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3C)o2)cc1NC(C)=O 734304843 YDEUYXUUTZONBW-CSKARUKUSA-N 393.414 5.257 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C[C@H](C)c2ccc(C(C)C)cc2)c1 737565233 FNTUQKKOBOKPJG-AVRDEDQJSA-N 378.516 5.301 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C[C@H](C)c2ccc(C(C)C)cc2)c1 737565242 FNTUQKKOBOKPJG-PGRDOPGGSA-N 378.516 5.301 30 20 GKED CCCCOc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)ccc1OC 741844937 SYWXUBAKTKJVEQ-ALCCZGGFSA-N 390.892 5.133 30 20 GKED C[C@@H](NC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 743776781 HAVMNGJRKSCKTG-OOWUWCJESA-N 376.456 5.177 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2Oc2ccccc2)c(Cl)c([N+](=O)[O-])c1 746486656 RROIECCBLHINOM-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(Cl)c(Cl)c1 747117437 QHUOBTXKSLZJHX-SKDRFNHKSA-N 393.270 5.722 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](Cn2cccn2)c2ccccc2)cc1 766135964 GLMJENRSTFVONR-AVRDEDQJSA-N 381.907 5.107 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3ccccc3o2)c(OCc2cccnc2)c1 766484085 KKWWKBSOLFBETE-PKNBQFBNSA-N 385.419 5.312 30 20 GKED C[C@H]1C(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C[C@H]1c1ccccc1 767783097 TZHNNJKYCOLIOO-CZUORRHYSA-N 397.404 5.149 30 20 GKED CCCCC[C@H]1NC(=O)N(c2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1=O 771819495 PSMQQUJAEGMRHR-AZUAARDMSA-N 395.890 5.001 30 20 GKED C=C[C@H](CC(=O)OCc1nnc(-c2cc(C)c(CC)s2)o1)c1ccccc1 784402592 LNRCCPHPVNEVBY-OAHLLOKOSA-N 382.485 5.072 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1 789450657 ONQRQYYLUDOUEM-NRFANRHFSA-N 384.470 6.186 30 20 GKED CN(c1ccccc1)c1ccc(/C=C/C(=O)c2c(Cl)nc3sccn23)cn1 797788841 VXIZMTTWRCDOOR-VQHVLOKHSA-N 394.887 5.108 30 20 GKED C=C(C)[C@@H](NCc1cnc(NC(=O)OC(C)(C)C)s1)c1ccc(F)c(F)c1 800263949 IRDLGUKUUHTJQI-MRXNPFEDSA-N 395.475 5.175 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)[C@@H](F)c1ccc(C(F)(F)F)cc1 801701038 YFMFJCRXMWCFGE-JEYLPNPQSA-N 397.334 5.488 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ncc1Br 813220453 HZLCZDVMEOCQHD-UHFFFAOYSA-N 393.712 5.602 30 20 GKED COc1ccc2cc(/C=C/C(=O)N[C@H](CCCC#N)c3ccccc3)ccc2c1 817314124 OXXQFWOKUFOXNU-CJLLUPFQSA-N 384.479 5.413 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3cccc(F)c3)no2)cc1 915180929 SOVZZSVLHVROJK-OAQYLSRUSA-N 397.409 5.388 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)c(C)n1[C@@H](C)c1ccccc1 916845217 QVGNBMIUAGKZAN-UWJYYQICSA-N 396.494 5.091 30 20 GKED C(=NNc1nc2ccccc2s1)c1c(-c2ccccc2)nc2sccn12 917022634 OVFCNJGXKRJRKY-UHFFFAOYSA-N 375.482 5.119 30 20 GKED Cc1ccc2c(CNc3cccc(OCc4cccc(C#N)c4)c3)cc(=O)oc2c1 917932161 XPHXUUUJLGKYAJ-UHFFFAOYSA-N 396.446 5.164 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140844 CJWDWQSSNVJZPI-MOPGFXCFSA-N 376.481 5.189 30 20 GKED CC(C)(C)N(N=Cc1cnc2ccccc2n1)C(=S)Nc1cccc(Cl)c1 920385001 JCGXTAISTOPUTJ-UHFFFAOYSA-N 397.935 5.115 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=NNc2ccc(Cl)c(Cl)c2)C1 1776032576 AGSSULQWIRKFKZ-UHFFFAOYSA-N 383.662 5.231 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1cc(F)ccc1Oc1ccc(Cl)cc1 1776038203 XGHXKWLOESKQTR-UHFFFAOYSA-N 398.821 5.806 30 20 GKED CCCc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776112763 JZZOPGNYBOFICI-LFIBNONCSA-N 384.475 5.829 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2ccc(OC)c(CC(=O)O)c2)cc1 1776131841 OWMBAHDGKDBBEB-UKTHLTGXSA-N 396.483 5.178 30 20 GKED C=C(Cl)C[C@H](NCc1cc(Cl)ccc1Oc1ccccc1CC)C(=O)O 1776142316 LWJMYSHSKQEFHO-KRWDZBQOSA-N 394.298 5.380 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccc(Cl)cc1Cl 1776785141 DOPAJYMLYABBSS-LJQANCHMSA-N 388.379 6.582 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C)c2nc(C(=O)O)c(C)s2)c1 1776787868 AJBNVKMGUZBNIO-OAHLLOKOSA-N 390.549 5.350 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(OC)c3oc(C(=O)O)cc23)oc2ccccc12 1776956351 TYLRIJNHPUPBLI-CSKARUKUSA-N 390.391 5.344 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3ccoc3C)cc2)CCC1 1787364042 CSTJOTXNCRMNEZ-HXUWFJFHSA-N 392.499 5.104 30 20 GKED O=C(Nc1ccc(OC(F)F)cc1OC(F)F)c1cccc(C(F)(F)F)c1 47252171 YNNPKZNLGFUIOO-UHFFFAOYSA-N 397.246 5.161 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc(OCCCC#N)c1 55570328 JSBFSQOCJMFFCG-ZDUSSCGKSA-N 393.270 5.082 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(C#Cc2cccs2)c1 63390439 ROMFWKLOKUEMKK-UHFFFAOYSA-N 397.503 5.240 30 20 GKED C=C(C)CN(CC)C(=O)c1cc2sc(Nc3ccccc3OC)nc2s1 63683205 GXOBIJQGDDVAHV-UHFFFAOYSA-N 387.530 5.148 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1sc(Cc2ccc(F)cc2)nc1C 65776526 HAHGSCIPQQBQHN-UHFFFAOYSA-N 394.515 5.052 30 20 GKED Cc1ccc2c(CNc3ccccc3S[C@H](C)CC#N)cc(=O)oc2c1C 66861058 AJDPBZOPRNJXJX-OAHLLOKOSA-N 378.497 5.416 30 20 GKED N#C[C@@H](C(=O)Cc1c[nH]c2cc(Cl)ccc12)c1nc(-c2ccccc2)cs1 70033697 IFWYMVNBNWBNKZ-KRWDZBQOSA-N 391.883 5.364 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2nc(C)cs2)cc1 101754038 RKTQLIQDJLLRPO-UHFFFAOYSA-N 388.496 5.210 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(F)c(F)c1 108409220 TYIMSGLWIQCEPC-CYBMUJFWSA-N 392.496 5.088 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3cccc(F)c3)n2)cc1 116594553 AEZXYLIPBSNPHU-KUHUBIRLSA-N 394.471 5.328 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc(Cl)n1 123872332 CNZKJEAJCULGLA-AWEZNQCLSA-N 388.279 5.310 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 153556247 PASFCBNQRQSLLR-UHFFFAOYSA-N 390.439 5.120 30 20 GKED CCN(C(=O)CNc1ccccc1S[C@H](C)CC#N)[C@@H](C)c1ccc(F)cc1 153953520 PYQVRPKDSQHXGW-SJORKVTESA-N 399.535 5.242 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)s1 170974498 LFNGWUJDCGMJAK-AWEZNQCLSA-N 393.537 5.623 30 20 GKED Cc1nc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)cc2)cs1 171248816 LDVFERGDXDOBHU-UHFFFAOYSA-N 388.496 5.187 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(OC3CCC3)c(F)c2)c1 175479670 CBWCQSQMYSPLAW-UHFFFAOYSA-N 383.423 5.084 30 20 GKED COCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)sc2cccc(F)c12 177759137 JNYIZKFANTUCLO-NSHDSACASA-N 388.489 5.257 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1nc2ccccc2o1 179457998 BDADBNOKXNRZMO-HNNXBMFYSA-N 378.334 5.072 30 20 GKED N#CCCCS(=O)(=O)Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 190927729 OEKHMNKBYKNWIP-UHFFFAOYSA-N 384.284 5.004 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 193054340 VSGZPMZORFDKJG-OAQYLSRUSA-N 377.488 5.255 30 20 GKED CC(C)(COc1cc(Cl)cc(Cl)c1)/C(O)=N/[C@H]1CCC(O)=NC12CCC2 328729367 FKDSSIOEMZTNMG-HNNXBMFYSA-N 399.318 5.397 30 20 GKED Cc1ccc(Cl)cc1N=C(O)[C@H](C)N[C@H]1c2ccccc2CC12CCOCC2 329539598 WDCGXMIYODJXMO-KKSFZXQISA-N 398.934 5.309 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)c(C)c2c1 425471115 GOANAJIQDUAEBP-CVEARBPZSA-N 391.471 5.085 30 20 GKED CN(C)c1ccc(C(F)(F)F)cc1NC(=O)c1ccc(F)cc1C(F)(F)F 428338355 YALYAEIDIUWHCN-UHFFFAOYSA-N 394.290 5.182 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc(-c4cnco4)cc3)c2)c1 432665937 DFCNAYKDCLPBFD-UHFFFAOYSA-N 381.435 5.404 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 437736934 XSELAUYCABQOGB-BTYIYWSLSA-N 393.918 5.790 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccccc1S[C@@H](C)CC#N 439120919 WUIVFJRULIIUEG-LBPRGKRZSA-N 389.864 5.203 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1F 439966336 JHXRZSTWMYLKCC-UHFFFAOYSA-N 380.250 5.447 30 20 GKED C[C@H](NC(=O)NCC1CCC(C#N)CC1)c1ccc(-c2ccc(F)cc2)cc1 440987376 HQFLWMQZNFWODW-AOCRQIFASA-N 379.479 5.183 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]3CCC[C@H]32)cc1F 444392776 CJUCPRAJSKJATA-HNAYVOBHSA-N 379.435 5.286 30 20 GKED COc1cc2c(cc1OC)[C@@H](c1cccs1)N(CCCCC(C)(C)C#N)CC2 444601101 VGCYXIITYWQOPU-QFIPXVFZSA-N 398.572 5.433 30 20 GKED C[C@@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)c1c[nH]c2ccccc12 447356551 FTQBRNYOFPAMGZ-KRWDZBQOSA-N 383.451 5.360 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1cc(C)ccc1C 453462798 IPYKWGRISHAQCK-NHCUHLMSSA-N 380.536 5.054 30 20 GKED C[C@H](C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 461916918 AOMFYUZXMZYDTE-VBKZILBWSA-N 380.900 5.282 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)NCc3ccc(C(F)F)cc3)c2)c1 462907221 RVAHXLKQBCJDQY-UHFFFAOYSA-N 392.405 5.005 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 464881530 UDOURALUBWXWPM-WIYYLYMNSA-N 380.513 5.097 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cccc(F)c1F 474258920 KZKRWRZHUZRJLP-ZDUSSCGKSA-N 397.265 5.407 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 475580492 YVFJEBKSDQMFHS-WBVHZDCISA-N 382.470 6.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1nnc2ccccn12)C(C)C 475584410 YRIINRWCHNWPKT-HXUWFJFHSA-N 391.519 5.100 30 20 GKED C=CCn1c(SCc2cccc(C(F)F)c2)nnc1-c1cccc(OC)c1 475884268 NJKPIUGWUILMGS-UHFFFAOYSA-N 387.455 5.370 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@@](C)(C#N)CCc2ccccc2)s1 481893545 NGLUOIYJHGKXFW-HSZRJFAPSA-N 389.524 5.072 30 20 GKED CC(C)[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccncc1 483722129 MMWGWTUXMGQFOR-DEOSSOPVSA-N 399.494 5.105 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCCCCC(=O)C2)cc1Cl 485707558 GMYITCWGGKSEFY-DYESRHJHSA-N 394.902 5.473 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2cc(Cl)sc2[nH]1 486227730 OOCYFMZIOCSDNN-SNVBAGLBSA-N 375.906 5.529 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(-c2ccccc2)no1 489726825 FNWJQYGZPJGKPM-INIZCTEOSA-N 382.423 5.574 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C#N)cc3Cl)s2)cc1 494584602 WDJMUAXTEMQSKR-UHFFFAOYSA-N 397.887 5.295 30 20 GKED COc1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1F 505812900 QFNFECXYCOYWKL-OAHLLOKOSA-N 381.291 5.246 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 507920951 VTZOYOZIPHLSTN-UHFFFAOYSA-N 399.362 5.257 30 20 GKED CCN(Cc1nc2cc(Br)ccc2o1)[C@@H](C)c1ccc(C#N)cc1 509264819 RZCFZUSXRFEBKT-ZDUSSCGKSA-N 384.277 5.045 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 509668413 TXVJPQHSOILJKG-HOCLYGCPSA-N 388.389 5.658 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccc(C(F)(F)F)cn2)n1 511997524 ADASEYFTAABQTI-LBPRGKRZSA-N 391.246 5.228 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 513654562 WWSJWPKNSKWBCQ-LDQXTDLNSA-N 396.918 5.529 30 20 GKED COc1cc(CN(C)[C@@H](C)CC#N)ccc1OCc1cccc(C(F)(F)F)c1 513730358 YZEFJWLFWWNLJY-HNNXBMFYSA-N 392.421 5.027 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2cc(C#N)ccc2OC(C)C)c1C1CC1 534231619 QLMOESZKQMXUET-CQSZACIVSA-N 381.480 5.034 30 20 GKED CCCN(C(=O)c1ccc(CC#N)cc1)[C@@H](C)c1ccccc1Br 536243065 IITHTTGVEMWALT-HNNXBMFYSA-N 385.305 5.129 30 20 GKED CC(C)Oc1ccc(CN[C@@H](C)c2ccc(C#N)c(F)c2)c(C(F)(F)F)c1 537406629 GPSAKQDXGHENKI-ZDUSSCGKSA-N 380.385 5.354 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c(F)c1 538005533 WYCHODNSWYOSEN-SFHVURJKSA-N 382.788 5.610 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 538434612 QELOIBGDQPMLNV-HOTGVXAUSA-N 378.419 5.047 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)Nc1ccc(C#N)cc1Cl 548948109 AIVOXBVCLIGLNN-UHFFFAOYSA-N 376.847 5.150 30 20 GKED CCN(Cc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1)C(C)C 554310892 JWGZNIFWULIWFD-GOSISDBHSA-N 377.513 5.017 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 558784705 WWSCNCIQGSYMFA-UHFFFAOYSA-N 384.483 5.329 30 20 GKED Cc1csc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1C#N 577098105 OJBZMXWDXXLISC-UHFFFAOYSA-N 375.478 5.203 30 20 GKED N#CCc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)cc1 580369551 SPKSRUDRDNVLGO-JOCHJYFZSA-N 398.403 5.790 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1ccc2oc3ccccc3c2c1 603821832 MHBOQCQPAYUKIG-UHFFFAOYSA-N 375.815 5.162 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CC(CC(F)(F)F)C2)c1 610744619 AAWJTGXKGPCNKF-UHFFFAOYSA-N 394.780 5.028 30 20 GKED C=CCn1c(S[C@H](C(=O)C2CC2)c2ccccc2)nnc1-c1cccs1 647118578 IEWJGJSWTPNLCC-SFHVURJKSA-N 381.526 5.005 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)N[C@@H](c1c[nH]c2cccc(F)c12)C(F)(F)F 648583020 QDOOTLLQAZECPN-OQPBUACISA-N 384.295 5.005 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(F)c1 675739273 WZXGHEIEIKVILI-HJUHTLPRSA-N 375.303 5.525 30 20 GKED CC(F)(F)c1cccc(NC(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1 682055333 JGWSCNNJEWPRIZ-QWRGUYRKSA-N 390.274 5.003 30 20 GKED N#C[C@@H](C(=O)c1csc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 682436982 SPGURJKKXTYZTF-VIFPVBQESA-N 386.807 5.520 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccc(OCC)c(OCC)c2)C(C)C)c1 726452289 USKVJVLSRFIJLL-QFIPXVFZSA-N 396.556 5.149 30 20 GKED N#Cc1ccc(NC(=S)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1Cl 726489297 IYPVHEQBQBHFKI-CJNGLKHVSA-N 395.837 5.073 30 20 GKED COC(=O)c1occc1/C=C\C(=O)c1sc(-c2ccc(Cl)cc2)nc1C 727655586 YOKLMKGTHKWDOI-YVMONPNESA-N 387.844 5.048 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1nc2ccccc2s1 727952691 QJRMBYWAJRGJJX-HYSAVQALSA-N 388.492 5.507 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc1C(C)C 730417187 LPUFFEZJUOGFQZ-RDTXWAMCSA-N 396.487 5.511 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420377 CUBXKWIYVJNHRR-CMPLNLGQSA-N 390.892 5.446 30 20 GKED CCc1ccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)s1 730949055 QKDCKQSGDKBBIX-UITAMQMPSA-N 382.437 5.077 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 731199025 SGXUELVYOVBOQH-INIZCTEOSA-N 379.485 5.004 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3ccccc3)[nH]2)cc1 731973256 UIUKCZDOXHGLHI-JOCHJYFZSA-N 377.447 5.589 30 20 GKED C=CC[C@H](NC(=O)c1sc2nc(C(F)(F)F)ccc2c1C)c1ccncc1 734235230 ZGWXNTROERRVGE-AWEZNQCLSA-N 391.418 5.066 30 20 GKED CC[C@H](NC(=S)Nc1ccccc1Oc1ncccc1C#N)c1cccs1 734375228 SXZNFWSIUUPXBU-HNNXBMFYSA-N 394.525 5.245 30 20 GKED Cc1cc(C)cc(NC(=O)[C@@H](C)SCc2cc(Cl)ccc2OCC#N)c1 735320002 IAERSHFOMJUGMZ-OAHLLOKOSA-N 388.920 5.120 30 20 GKED CCC(CC)(NCn1c(C)nnc1-c1cccc(C#N)c1)c1ccc(Cl)cc1 739854263 SXQUCUYERUVBDS-UHFFFAOYSA-N 393.922 5.041 30 20 GKED N#Cc1csc(/C=C2\SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)c1 748660327 FGDSJKSKCDJURR-MLPAPPSSSA-N 396.440 5.044 30 20 GKED O=C(/C=C/c1csc(-c2cccc(Br)c2)n1)c1ccsc1 749101856 MJDQAROXBJQNQH-SNAWJCMRSA-N 376.300 5.530 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cccc(Cl)c1Cl 754425221 AKGRMKCJSLVFAQ-MRVPVSSYSA-N 388.081 5.663 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ncc(Br)s1 756847424 SDWWCZRQZHWXGV-WAYWQWQTSA-N 395.278 5.064 30 20 GKED C#CC[C@@H](NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1ccccc1 757599395 VIUOIAYQFXECJO-LJQANCHMSA-N 398.890 5.181 30 20 GKED Cc1c(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)n[nH]c1C1CC1 761660529 PJXVQIQRVVGOTL-UHFFFAOYSA-N 392.846 5.165 30 20 GKED C#CCOc1ccccc1-c1noc(-c2ccc(C3SCCCS3)cc2)n1 761996918 UQUWWAHHTUQQSL-UHFFFAOYSA-N 394.521 5.284 30 20 GKED Cc1cncc(C(=O)/C=C\c2cnc(-c3ccc(Br)cc3)s2)c1 767366433 GLSMENNPRXGBSQ-SREVYHEPSA-N 385.286 5.172 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc(Cl)nc3)n2)cc1 772642458 XLFGERLQVYHIAU-FAOGRTBUSA-N 379.872 5.057 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(OCc2cccc(F)c2)cc1 779989191 QWGXSAGPIHDMJP-QGZVFWFLSA-N 376.431 5.308 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@@H](CCCc2ccccc2)C1 780673045 NDLRCXKHRBSMPX-TZIWHRDSSA-N 391.515 5.244 30 20 GKED C[C@@H](OC(=O)c1ncc(F)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 784969479 YYZQSYNBPVYPGI-SSDOTTSWSA-N 399.237 5.315 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)n1[C@@H](C)c1ccccc1 792102732 JCYGEEBEJHNPKZ-UUOWRZLLSA-N 393.490 5.753 30 20 GKED COc1cc(C=NO[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)cc(OC)c1 794726994 GINHTYQEPVBBHQ-ZDUSSCGKSA-N 386.835 5.124 30 20 GKED N#CCC1(CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 797768643 QCELGWFDEUGFLK-UHFFFAOYSA-N 394.474 5.357 30 20 GKED N#CC1(CCCOC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)CCOCC1 800081735 BWTZPCSWTBVTBL-XDJHFCHBSA-N 399.487 5.072 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)C1CCC2(CC1)CC2 850758811 DUSFAQCRHLLZQX-LJQANCHMSA-N 388.467 5.097 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc(Cl)s2)cc1 916051606 RUSCCGOMSIJRMF-LJQANCHMSA-N 380.900 5.628 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1 916684319 XSVHFZZPKZTWNJ-UHFFFAOYSA-N 394.494 5.130 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3cccc(F)c3)n2)cc1 921132355 PYUHSOKOJDJCDS-DNVCBOLYSA-N 378.472 5.313 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2cccc(O[C@@H](C)C(=O)O)c2)cc1 1776125784 SIVZBKHVKADJFD-ZGUWOUCSSA-N 382.456 5.004 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(c2ccnc3ccc(Oc4ccccc4)cc23)C1 1776156698 AYINZRYARJESEB-XMMPIXPASA-N 388.467 5.274 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2cccc(CC(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269257 UNRYLSUVAJNZJF-MDZDMXLPSA-N 390.523 5.731 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2OC)cc1 1776782742 DKGVVXYXCPECBW-NRFANRHFSA-N 383.532 5.656 30 20 GKED CCCCCCCCOCCCNc1nc(C)nc2sc(C(=O)O)c(C)c12 1776785622 UMHGHRMVDJJSEI-UHFFFAOYSA-N 393.553 5.185 30 20 GKED CCCCCCCC[C@H](C)C(=O)Nc1ccc(N2CCCCC2)c(C(=O)O)c1 1776786117 MPKBZSAFYZHDCP-SFHVURJKSA-N 388.552 5.700 30 20 GKED C[C@@H]1/C(=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1777407758 BOGPYIZYUXDSCL-MCBDKKBHSA-N 384.431 5.275 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4cc(Cl)ncc4C3=O)s2)c1 1777684311 LXXZWMPXNRHBHJ-NTEUORMPSA-N 395.867 5.374 30 20 GKED C=CCc1cc(C(=O)Nc2c(C(C)C)cccc2C(C)C)cc(OC)c1OC 18185600 MARRDAGUDYJMCN-UHFFFAOYSA-N 381.516 5.931 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc(O)c2)cc1Cl 56628658 CWQRBYNZICQCFG-FQEVSTJZSA-N 391.858 5.023 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1ccccc1Cl 60036222 XSXOBRCCGTYRGF-OAHLLOKOSA-N 391.858 5.443 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 63747797 KNJWUMPMSQWLFE-AWEZNQCLSA-N 398.915 5.610 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc4ccccc4[nH]3)s2)c(C)c1 64100057 LJDBSLKCWFQOSF-MRXNPFEDSA-N 386.480 5.102 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(-c2ccccc2)on1 72025295 PXCVWLQBVHUGHY-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1CCc1ccccc1 108530427 RPFCAUWXVGCAME-AZUAARDMSA-N 393.556 5.567 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1c[nH]c2cc(F)ccc12 109029666 LKERWKHHMQQIQR-AWEZNQCLSA-N 396.491 5.065 30 20 GKED CC[C@@H](N/C(S)=C(/C(=O)c1ccccc1)[n+]1cccc(C)c1)c1cccs1 115511089 XFKUMQFJLGAVDX-GOSISDBHSA-O 395.573 5.024 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CCCc3occc32)cc1 119368722 AGZKZLBFGVFVDJ-HXUWFJFHSA-N 388.492 5.251 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 160042916 BFSBXJKBRNBODK-IEZWGBDMSA-N 397.544 5.987 30 20 GKED CCc1ccccc1N(C(C)=O)c1nc(CSc2ccccc2C#N)cs1 172680362 TVMHNCZFCFIHBF-UHFFFAOYSA-N 393.537 5.554 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c(C)n1[C@H](C)c1ccccc1 183110517 PRQJYKVTEBYMNY-ZWKOTPCHSA-N 387.483 5.257 30 20 GKED Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)CC2 187131050 RAMHRGHITNFKCB-INIZCTEOSA-N 379.529 5.145 30 20 GKED C=C[C@H](CC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1)c1ccccc1 188821003 AGPPSGXOXJBEPP-DLBZAZTESA-N 385.891 5.054 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cs1 188913286 YMMIOCILLIFOCZ-SUMWQHHRSA-N 386.546 5.072 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCS1 192225263 CUMVAQSDISIZEK-KXBFYZLASA-N 399.947 5.355 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2nc(C3CCCCC3)no2)cc1Cl 237477705 ZCPGBIHJYRQBMV-AWEZNQCLSA-N 375.900 5.186 30 20 GKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)CSc3nnc4ccccn34)c3cccc1c32 329431965 HUYAVGMOUPCMCN-PBHICJAKSA-N 392.528 5.078 30 20 GKED CC(C)C[C@@H]1C[C@@H](/N=C(/O)Nc2cccc(Cl)c2Br)CCO1 331166108 YDGMTYGITAGHQJ-NWDGAFQWSA-N 389.721 5.022 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)Nc1ccccc1C(F)(F)F 410150005 YVZRUXVRKGAPCI-UHFFFAOYSA-N 380.263 5.185 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H]4CCC[C@@H]43)cc2Cl)cc1 429356262 UWHITGWMDZRVFY-KXBFYZLASA-N 381.863 5.410 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1 432073522 WYWQSWOWADLYAZ-ZACQAIPSSA-N 397.519 5.678 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(OCc2ccccc2)c1 434230676 ZVQDDTNNWJWEQY-SFHVURJKSA-N 385.467 5.214 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC=C(c3ccc(Cl)cc3)CC2)cc1 435143278 ODPFCRRDLZIBDE-UHFFFAOYSA-N 379.891 5.462 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 438444563 IFCCOAUYNVJMHQ-UHFFFAOYSA-N 395.572 5.951 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(CSC(C)C)c1C 438470205 YQEKQWXSJDHONY-UHFFFAOYSA-N 386.536 5.996 30 20 GKED N#CCC[C@H](NC(=O)CCc1cccc(OC2CCCC2)c1)c1ccccc1 439656647 UBGQFBPGXQXPSN-QHCPKHFHSA-N 376.500 5.102 30 20 GKED CCOc1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)C(C)C)cc1 455710021 WJIDMVCWMVPSDQ-UHFFFAOYSA-N 385.895 5.247 30 20 GKED C[C@H](c1ccc(C(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1)C(F)(F)F 455825547 PBRFRFFGJYQWDS-CDHQVMDDSA-N 386.417 5.264 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCN(C)C)Cc1ccsc1 459516739 CLWATLKJCLBBPQ-UHFFFAOYSA-N 385.577 5.196 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@@H]3Cc4ccccc43)cc2Cl)c1 460154117 IEHVTOTWHQRPGD-HXUWFJFHSA-N 388.854 5.069 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccccc1C#N)c1ccc(Cl)c2ccccc12 462354822 WFLJLMYQQGYGRC-LSDHHAIUSA-N 377.875 5.043 30 20 GKED C[C@@H](SCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)c(Cl)c1 463195079 VORWMLOHZFFEIC-LLVKDONJSA-N 390.295 5.909 30 20 GKED CCCOc1ccc(CCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 463749738 WHBQNZVOGQLHSZ-SFHVURJKSA-N 391.298 5.096 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)F)c1c(F)cc(C(F)(F)F)cc1F 464290339 KACGTFGFQTWYRT-UHFFFAOYSA-N 399.237 5.019 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F)c1ccc(F)c(F)c1 464332200 JYFLUULEOGJUCW-XOKHGSTOSA-N 390.396 5.345 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 464419135 CRXNQKZAEJXYQX-GOSISDBHSA-N 382.341 5.383 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc2ccccc2c1 469321048 YXNYXDRFRJYMHL-GOSISDBHSA-N 383.495 5.596 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H]2/C=C\c2ccccc2)c2ccccc21 469779015 HAVKOEDNAUTKJF-NALLFNBYSA-N 383.495 5.263 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 476446321 IHGZWNUEEDZALV-SFHVURJKSA-N 389.474 5.347 30 20 GKED Cc1ccc(-c2cccc(CNCc3cn(C)nc3-c3ccc(C#N)cc3)c2)cc1 478302150 ZLZHAXAVAXFLQF-UHFFFAOYSA-N 392.506 5.224 30 20 GKED C=C(C)Cn1c(SCc2cccc(C(F)(F)F)c2)nnc1-c1ccncc1 481345900 VUZJLIHOKNXGOR-UHFFFAOYSA-N 390.434 5.227 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C(C)C 484162461 OXHQXNROOVGVGD-MRXNPFEDSA-N 399.564 5.702 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccc(-n2nc(C)cc2C)cc1 486348964 XTKYCSZQUDKHGT-SFHVURJKSA-N 391.540 5.258 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4ccco4)cc3F)cc2)nc1 487560502 NZSGRFQJLKGLEI-UHFFFAOYSA-N 399.381 5.397 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cccc(C(F)(F)F)c1 495580057 HVUPQVUYWFAQKB-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C[C@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cccc(C(F)(F)F)c1 504005478 OMVSOMPVHXNUFF-MRXNPFEDSA-N 398.428 5.387 30 20 GKED Cc1nc(-c2cccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)c2)cs1 505187579 PZXQUQTXTRGBKI-UHFFFAOYSA-N 379.460 5.046 30 20 GKED N#C[C@H](NC(=O)c1cccc(Oc2ccncc2)c1)c1c(Cl)cccc1Cl 505505685 IHROKYMYCLGPPE-SFHVURJKSA-N 398.249 5.175 30 20 GKED CCN(C(=O)c1cc2cc(Br)ccc2o1)[C@@H](C)c1ccc(C#N)cc1 509572135 BCLRHCCPGSAENS-ZDUSSCGKSA-N 397.272 5.290 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c(F)c1 510192308 UBDRFBIOIPEPSU-HNNXBMFYSA-N 391.471 5.187 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2 510258930 OUBOOTISTMQTFA-ACDBMABISA-N 376.504 5.057 30 20 GKED C[C@H](NCc1cc(Cl)cc(Cl)c1OC(F)F)c1ccc(C#N)cc1F 512629651 JSRMZKDQBPWQEO-VIFPVBQESA-N 389.204 5.456 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(C#N)cc2F)c2ccc(F)cc2)cc1 512644192 ZZADYIXHGHTEGN-IQMFZBJNSA-N 378.422 5.285 30 20 GKED CC(C)COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 515542497 QAKBNXYBSWHAKJ-LJQANCHMSA-N 376.481 5.335 30 20 GKED CCCCOc1ccc(NC(=O)NCCSCc2ccccc2C#N)c(C)c1 516470863 RYBVHWQOOICLFZ-UHFFFAOYSA-N 397.544 5.101 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCn1ccc2ccccc21 518754405 KCIHGOZMTANGDF-QGZVFWFLSA-N 392.528 5.247 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@@H]1CCc2ccccc21 519051553 IZNTYJORGQBBQW-HSZRJFAPSA-N 383.451 5.502 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)cc2cccnc12 520481188 OHKLRRCULMNXAY-UHFFFAOYSA-N 378.863 5.202 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2cccnc2)CCCC1 522029344 RUZYSWJEJDSVER-UHFFFAOYSA-N 397.478 5.505 30 20 GKED CCSc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cn1 524377474 FRILXYGRJYKHNL-INIZCTEOSA-N 379.510 5.116 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 524390150 WDRNXYWHGHKECO-HNNXBMFYSA-N 393.405 5.204 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC[C@@H](c2ccc(F)cc2)C1 526032090 NRDIIYHKNGGZTF-LJQANCHMSA-N 386.426 5.119 30 20 GKED COc1cccc([C@@H]2CN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2(C)C)c1 528900247 MKKIDLKKEDCWLS-NRFANRHFSA-N 391.515 5.154 30 20 GKED Cc1sc(NC(=O)c2ccc(Oc3ccccc3Cl)nc2)c(C#N)c1C 530594770 HMKPXEDGACHWKH-UHFFFAOYSA-N 383.860 5.330 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2ccc(C#N)c(F)c2)ccc1OC1CCCC1 537406031 BCNXUOYRKPNRQR-CVEARBPZSA-N 382.479 5.439 30 20 GKED C=C(C)[C@@H](CC(=O)N(CCC)[C@@H](c1cccnc1)c1ccc(F)c(C)c1)OCC 538554690 CPPYXQBWWFAQPJ-ISKFKSNPSA-N 398.522 5.228 30 20 GKED C=CCCOCCCCC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 539389447 IRFWNPBUGQDQPJ-UHFFFAOYSA-N 381.438 5.084 30 20 GKED N#Cc1ccc(CN(C(=O)[C@H]2C[C@H]2c2cccc(Cl)c2Cl)C2CC2)cc1 541384450 UGOGHQPXLMNQFR-ROUUACIJSA-N 385.294 5.160 30 20 GKED C[C@@H](NC(=O)c1cccc([C@H]2CCOC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 542929079 QGZIVQHHZSMUIS-CJAUYULYSA-N 396.490 5.220 30 20 GKED C[C@@H]1C[C@H](N[C@H](CCCC#N)c2ccccc2)c2cccc(Br)c21 550827082 JRIBLIHRQYETMM-YSGRDPCXSA-N 383.333 6.022 30 20 GKED Cc1cccc(NC(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)c1C 553043469 VQVORORJTHHOLD-UHFFFAOYSA-N 381.907 5.074 30 20 GKED CCCn1c(CNc2ccc(Oc3ccnc(C#N)c3)cc2)nc2ccccc21 558493831 VTERTZVPZTUKHV-UHFFFAOYSA-N 383.455 5.117 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@@](F)(c3cccc(Cl)c3)C2)cc1 558747388 GKIMPEHKDWZTAW-NRFANRHFSA-N 385.870 5.244 30 20 GKED N#CCCC[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccccc1 560564705 MNAFTVPWWZFSAY-LJQANCHMSA-N 387.508 6.081 30 20 GKED Cc1sc([C@H](C)NC(=O)[C@@]2(C#N)CC23CCCC3)nc1-c1ccc(Cl)cc1 562684102 HJKKWOJFWIKGTH-ZSEKCTLFSA-N 399.947 5.423 30 20 GKED Cc1cc(Br)c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)s1 563121104 HEXRGIUCPYXKAH-MRVPVSSYSA-N 395.347 5.129 30 20 GKED CC(C)Cn1ncc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C1CC1 570357455 PWHSFRTVGWIARL-UHFFFAOYSA-N 384.483 5.207 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(F)ccc3Cl)cc2)c1 572736136 WBLDCTGLBXVDIF-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C=CCn1c([C@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@@H]1c1ccsc1 580008373 HUKFDFJOOLCOIE-HNAYVOBHSA-N 398.507 5.146 30 20 GKED Cc1csc(NC(=O)c2cc(C(C)C)nc3c2c(C)nn3C(C)(C)C)c1C#N 584805595 VPYQLXBVRGQKCB-UHFFFAOYSA-N 395.532 5.112 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 588819702 SZGNDOILBGZEQO-GFCCVEGCSA-N 382.938 5.176 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1 592214910 AGKPFHAQYNMCEX-UHFFFAOYSA-N 383.879 5.680 30 20 GKED Cc1ccc(CN(CC2CC2)C(=O)Nc2ccccc2SC[C@H](C)C#N)cn1 592229392 SDKZXLPALVKEGV-MRXNPFEDSA-N 394.544 5.086 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c(C)s1 595471230 LCNCAWZYCUYYOP-OAHLLOKOSA-N 395.311 5.016 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c(Cl)c1 603637279 XHBOYTJCQPJUKB-UHFFFAOYSA-N 390.870 5.660 30 20 GKED C[C@H](SCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603763940 CRLSGLWXNYKDAM-INIZCTEOSA-N 389.480 5.006 30 20 GKED C=CCN(C(=O)[C@@H](C)Cc1ccccc1F)c1nc(-c2ccccc2)cs1 606159107 FBLMLEHMEUEVLJ-INIZCTEOSA-N 380.488 5.347 30 20 GKED CC(C)[C@@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608837320 BYAQWLOUEOXMRF-AUUYWEPGSA-N 389.421 5.335 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@@H]1CCCc2ccccc21 609371786 XPYPOLLQBKQQCM-OXQOHEQNSA-N 396.581 5.688 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2SCCC#N)c1 609375539 MWKPPDAULNDZJS-KRWDZBQOSA-N 382.529 5.530 30 20 GKED Cc1c(Cl)cccc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 609552215 CYCFQJXNFSMHRE-UHFFFAOYSA-N 383.879 5.032 30 20 GKED Cc1occc1-c1nnc(S[C@H](C#N)C2CCCCC2)n1-c1ccccc1 609648666 NCEHVWZCUOQCGM-LJQANCHMSA-N 378.501 5.400 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C[C@@H](c2ccccc2)C(C)C)c1C 610054531 QQQDEPMMHVPQJC-JOCHJYFZSA-N 386.499 5.129 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1CC(OCc2ccccc2)C1 610466568 WTWDWUPZKKCZBD-IPJUCJBFSA-N 380.513 5.015 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2ccc(COC(C)(C)C)cc2)c1C#N 610628586 YWFNOZFTLMYHNQ-UHFFFAOYSA-N 395.528 5.120 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCC(F)(F)C2)cc1Cl 610793229 RYZSAJNIRHLTSO-RDJZCZTQSA-N 389.833 5.305 30 20 GKED COc1ccc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)cc1Br 614180079 VYOMHSNHOLLOBU-AWEZNQCLSA-N 387.321 5.110 30 20 GKED O=C(CCc1ccccc1F)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 622485735 WUVBAVLFWSKHTB-INIZCTEOSA-N 393.302 5.197 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)C1 665562206 LCESMQDTPQPYDC-SFHVURJKSA-N 377.488 5.067 30 20 GKED CC1CCN(c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2)CC1 727223589 WZCLUGGUHBBYQH-UHFFFAOYSA-N 390.531 5.237 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc3cc(C)ccc3c2Cl)cc1 729188848 QOFQAGQJWVXDDU-INIZCTEOSA-N 396.899 5.387 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679441 HZMOOVCDLBATNZ-FUHWJXTLSA-N 388.920 5.378 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(CSC2CCCCC2)c1 735064387 KEXSELLGGHGJMB-UHFFFAOYSA-N 396.581 6.120 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)c2)s1 739590761 PENUOQYLCGOFAK-JKSUJKDBSA-N 392.446 5.272 30 20 GKED CC(C)(C)c1ncc(/C=C2/COc3c(F)cc(Br)cc3C2=O)s1 741471336 ZFJKXLSYJSBKOO-WTKPLQERSA-N 396.281 5.001 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3c[nH]c4c(C)cccc34)n2)cc1 744034161 BIBIRUCKUZJAEU-HXUWFJFHSA-N 399.519 5.717 30 20 GKED CCCOc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 744035507 NCDMSUDBPQVKAN-KRWDZBQOSA-N 398.915 5.548 30 20 GKED C=CC[C@@H](NC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1)c1ccncc1 745827408 JXWWWIWOFIJOGA-DNQXCXABSA-N 383.495 5.208 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3c(C)noc3C)n2)cc1 754531323 JRBGOLCZCKTFPP-CXAGYDPISA-N 379.485 5.093 30 20 GKED Cc1nn(-c2ccc(F)cc2F)c(C)c1C=NOc1ccccc1C(F)(F)F 754712342 NCCFAJKBXFAQPX-UHFFFAOYSA-N 395.331 5.199 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 756242590 HBOVBDMIGNGYRU-QRWLVFNGSA-N 385.492 5.685 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2nc(-c3ccccc3)cs2)ccc1OC 756964694 DGRFLNARPDKNMB-QGZVFWFLSA-N 379.485 5.112 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 765909471 OCHIQBGYXGILKP-ISKFKSNPSA-N 396.494 5.415 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c[nH]nc3-c3ccccc3F)cc2)c1 779594361 IEMLPXRYLXTIJP-UHFFFAOYSA-N 398.441 5.279 30 20 GKED CC[C@@](C)(C#N)C(=O)O[C@@H](C)c1cnc(-c2ccc(Br)cc2)s1 797172350 RWFYSEMDVIBFBL-GTNSWQLSSA-N 393.306 5.117 30 20 GKED N#CC1(CCCOC(=O)CCCCc2ccc(Cl)c(Cl)c2)CCOCC1 800188438 FCBPCHWZEDLZSI-UHFFFAOYSA-N 398.330 5.350 30 20 GKED CC(C)(C)CCCCC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 805844789 MYRRYWDVRPTJAR-AWEZNQCLSA-N 385.533 5.058 30 20 GKED N#Cc1c(F)cccc1SCC(=O)N1c2ccccc2Sc2ccccc21 821044651 UZANJKRUQQXTJF-UHFFFAOYSA-N 392.480 5.619 30 20 GKED O=C(/C=C/c1cn(C2CCCC2)nc1-c1ccccn1)c1ccc(C(F)F)nc1 853009310 IRZGYBQGMZHONE-PKNBQFBNSA-N 394.425 5.289 30 20 GKED C=C[C@@H](CC)CC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 902650259 YWXBWGJKHYVALI-LBPRGKRZSA-N 380.366 5.092 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cc2ccccc2c(Cl)n1 915150328 CLPLDTCBUWPEQX-UHFFFAOYSA-N 387.826 5.200 30 20 GKED CC(C)c1ccc(N2C(=O)/C(=C/c3cccc(OCC#N)c3)SC2=S)cc1 915636613 WYEYMNCPTIHAGB-UYRXBGFRSA-N 394.521 5.118 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1cccnc1 916137061 KSSOKYJAPWCNHE-TWGQIWQCSA-N 397.261 5.537 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc(Cl)c1OC 916137312 RYCOEUDSEKOMOM-DAXSKMNVSA-N 396.226 5.205 30 20 GKED N#C[C@@H](C(=O)CSc1cc(Cl)ccc1Cl)c1ccc2ccccc2n1 916849569 UVQDBMXOCDZNCN-CQSZACIVSA-N 387.291 5.510 30 20 GKED Cc1ccc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976937 XUMHUNUMGPWJQE-LJQANCHMSA-N 394.927 5.971 30 20 GKED Cn1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(Cl)c2ccccc21 918127067 HZQKQPHSRUUVOX-HXUWFJFHSA-N 399.881 5.739 30 20 GKED N#Cc1ccccc1COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921223528 KOWGXPGCSLDGBC-UHFFFAOYSA-N 389.263 5.346 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(Cl)c(Cl)c3)cc2)c1 1776032836 YAYRLTNHTMPRAO-UHFFFAOYSA-N 399.277 5.734 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)cc1 1776699917 GRGPWFWDSALRCA-PRUHKGEBSA-N 387.273 5.557 30 20 GKED CCc1ccc(-c2ccc(/C=C3/CCCc4cc(C(=O)O)ccc4C3=O)o2)cc1 1776964089 JJEXQDJLQQWZKD-CYVLTUHYSA-N 386.447 5.810 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)[C@H]4CC[C@H](CC)CC4)CCC3)cc2)C1 1785810631 XKXJHAZFYLYNEW-WGSAOQKQSA-N 394.559 5.303 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1ccc(C#N)c(Cl)c1 8331497 OAQLVFFVDGGSPG-UHFFFAOYSA-N 388.279 5.549 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N(CCC#N)c1ccccc1 12807373 UMBUVEVKLTZRSA-ZDUSSCGKSA-N 379.312 5.421 30 20 GKED O=c1[nH]c2ccccc2cc1/C(O)=N/c1nc(-c2ccc3ccccc3c2)cs1 25081359 OGVUOFJEIBQUMQ-UHFFFAOYSA-N 397.459 5.441 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1 66801399 VFKGPSNNKXNPCL-CQSZACIVSA-N 396.903 5.172 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)s2)o1 66802288 BSRNGTROCOKFKA-ZDUSSCGKSA-N 397.525 5.667 30 20 GKED CCC[C@@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 66861216 RBDBOPDCRPJOKH-IEBWSBKVSA-N 381.545 5.150 30 20 GKED Cc1ccccc1N(C(=O)c1ccc(C#N)c(C)n1)c1nc2ccccc2s1 105968861 YNPPQIDKLAPIBG-UHFFFAOYSA-N 384.464 5.158 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 117081871 HDBBCYRTZOATBH-MRXNPFEDSA-N 393.855 5.259 30 20 GKED COc1ccc(Cl)cc1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 119992947 MRZJCMQLRMMLOR-CYBMUJFWSA-N 391.279 5.031 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(-c2ccncc2)cc1 173589414 BXQPCEBIINWUSQ-LJQANCHMSA-N 399.494 5.047 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccc(OC)cc1 177197938 FXNFEDPRONSPEY-CQSZACIVSA-N 398.532 5.279 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 184040498 XFUJASGNBBGBJD-OAHLLOKOSA-N 383.517 5.572 30 20 GKED CC(C)=CCOc1cccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 304030868 MTBBMPSFVUHSQR-QGZVFWFLSA-N 380.513 5.536 30 20 GKED N#Cc1ccc(N2CCC[C@H](c3n[nH]cc3N=C(O)C3CCCC3)C2)cc1Cl 330051774 OALUVRLDSSROPF-INIZCTEOSA-N 397.910 5.097 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 431958042 YXAVMOXHIGIZDQ-KSSFIOAISA-N 390.314 5.789 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)cc1Br)c1ccccc1 432656954 JFYZTRFDQNHQSJ-MRXNPFEDSA-N 390.256 5.145 30 20 GKED CCC(=O)c1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 434317759 MJYSYHMVLSWVMN-UHFFFAOYSA-N 386.476 5.554 30 20 GKED C[C@H](S[C@H](C)c1nc(Cc2ccc(Cl)cc2)no1)c1ccc(C#N)cc1 437274480 ICLJKZYGLDQBEZ-UONOGXRCSA-N 383.904 5.741 30 20 GKED CCCOc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c(C)c1 437890085 ORYLOCOWXQLLPW-IRLDBZIGSA-N 377.488 5.088 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cc1C(F)(F)F 438639915 YWTMPJVNFRTGHV-KRWDZBQOSA-N 377.341 5.085 30 20 GKED Cc1occc1CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438657519 WDDRWLCIHNECRD-UHFFFAOYSA-N 379.391 5.055 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 438670164 VPVKHFTWYYBUOO-KFWWJZLASA-N 399.482 5.429 30 20 GKED CCN(C(=O)CC(C)(C)C#N)[C@H](c1cccnc1)c1csc2ccccc12 447334508 LNTHBQGTQZFDSQ-OAQYLSRUSA-N 377.513 5.174 30 20 GKED C=CCC1(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2C)CCCCC1 448749698 PCLCOFOSJCIFND-UHFFFAOYSA-N 376.500 5.712 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)c1ccc(Cl)cc1 459784189 ASLAFMLHASRFRD-GJZGRUSLSA-N 387.936 5.024 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)o2)cc1 464418351 KMRJMQFQYGIPRY-MRXNPFEDSA-N 384.357 5.413 30 20 GKED CCCCOC1CCN(C(=O)c2ccccc2Sc2ccccc2C#N)CC1 465092802 VNWWNISDNNFWOJ-UHFFFAOYSA-N 394.540 5.131 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1ccc(F)cc1C#N 469675689 SXHGMKQJFGXUQM-AWEZNQCLSA-N 394.475 5.354 30 20 GKED C=CCCC1(C(=O)NC[C@@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)CC1 474439493 ZIIPZEVTGFXPBZ-NRFANRHFSA-N 388.511 5.171 30 20 GKED COc1cccc(COc2cccc(NC(=O)NCC(C)(C)CCC#N)c2C)c1 478923306 IRXIFGYWLGSYQR-UHFFFAOYSA-N 395.503 5.034 30 20 GKED Cc1c([C@H](C)NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)oc2ccccc12 479359882 LXEDWTCZPHZHAY-KRWDZBQOSA-N 385.467 5.173 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F 482677798 YGOFLUZNPILLIW-UHFFFAOYSA-N 384.760 5.064 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cnn1-c1ccccc1Cl 482858875 MDPRPXAGOMOTQV-ZDUSSCGKSA-N 398.919 5.158 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 483498749 KUTBCWDRUOAGRL-OAQYLSRUSA-N 382.463 5.289 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1F 484102084 YOEPUZUNYQXVJJ-GOSISDBHSA-N 382.788 5.610 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1nc2ccccc2s1 489855491 JCZTZIGRURKIFF-CYBMUJFWSA-N 399.397 5.303 30 20 GKED N#CCN(C(=O)c1oc2ccccc2c1CSc1ccccc1Cl)C1CC1 495500375 YDSIPRJWBXEWTM-UHFFFAOYSA-N 396.899 5.507 30 20 GKED CCN(Cc1csc(COc2ccc(F)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 497620630 PBPSZRWJZQMSDU-INIZCTEOSA-N 395.503 5.316 30 20 GKED C=CCN(Cc1cccs1)[C@@H](C)c1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 499055904 YNNMVERGZUHZIW-KGLIPLIRSA-N 399.585 5.332 30 20 GKED CC(C)c1nc2ccc(NC(=O)Nc3cccc(OCCCC#N)c3)cc2s1 502602318 JMFKDKFSKBFRBD-UHFFFAOYSA-N 394.500 5.746 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)c1nc2ccccc2n1C(F)F 506253291 HYSFJAODKWMPDI-GFCCVEGCSA-N 381.879 5.896 30 20 GKED Cc1cc(C(=O)Nc2ccccc2Nc2ccccc2)nn1-c1cccc(C#N)c1 509162366 BUZROBMKIKHSOP-UHFFFAOYSA-N 393.450 5.048 30 20 GKED CCCCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 510055449 LCISHNWCZAPDLP-FQEVSTJZSA-N 381.907 5.792 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)cc1Cl 512792101 HNVJNNNYVSPZFE-NRFANRHFSA-N 375.859 5.734 30 20 GKED N#CCCN(Cc1ccc(Oc2ccccc2F)c(F)c1)Cc1ccccn1 513736860 NILXCGQTPSGTOU-UHFFFAOYSA-N 379.410 5.068 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N(C)[C@H](C)c1cc2ccccc2o1 517012014 UOLBMOMNTKVUBV-APWZRJJASA-N 380.492 5.039 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N(C)[C@@H](C)c1cc2ccccc2o1 517012015 UOLBMOMNTKVUBV-LPHOPBHVSA-N 380.492 5.039 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(Cl)c(Cl)c1 517532708 KXMXHIFLOKHIIY-GFCCVEGCSA-N 394.327 5.438 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517906534 UUICVJZLOKFJII-UHFFFAOYSA-N 383.451 5.571 30 20 GKED C=CCN(Cc1cccs1)C(=O)CCc1nc2cc(Cl)ccc2s1 520203706 JIBSNPHIFSSCEZ-UHFFFAOYSA-N 376.934 5.159 30 20 GKED C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520533555 XKCGRYJPPYNSSI-CQSZACIVSA-N 394.377 5.035 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 521748489 FYYPJXADQCGLSE-HNNXBMFYSA-N 387.936 5.646 30 20 GKED CC[C@@H](C)[C@H](C)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CC1 524487447 JNPRWEBNMWUSTM-MSOLQXFVSA-N 376.500 5.176 30 20 GKED CCCOc1ccc(C(=O)N(CC)c2ccc(C#N)c(Cl)c2)cc1OCC 533674351 PGMCHJPDGMQKDK-UHFFFAOYSA-N 386.879 5.066 30 20 GKED Cc1nc(CNC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)sc1C 534886032 AFRAQHANYLIYJK-UHFFFAOYSA-N 397.887 5.007 30 20 GKED COc1ccc([C@@H](NCc2ccc(CC#N)cc2)c2ccccc2Cl)cc1 541295194 VIOPORSSOXNIIF-HSZRJFAPSA-N 376.887 5.294 30 20 GKED COc1ccc(C#N)cc1CN[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 541661306 WCRSHHDVPCIKSN-HNNXBMFYSA-N 377.513 5.158 30 20 GKED C[C@H](NC(=O)Nc1ccc2c(c1)COC2)c1ccc(-c2cccc(C#N)c2)cc1 543889015 NJLVTATWWLQIGU-INIZCTEOSA-N 383.451 5.138 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 546089823 DAIFCERRHYHOEX-DHIUTWEWSA-N 388.511 5.037 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 549374838 TULCTOWXNOEKGH-UHFFFAOYSA-N 398.510 5.295 30 20 GKED C[C@@H]1CN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CCC1(F)F 564502908 FFKSTDAGBKIRGF-CYBMUJFWSA-N 390.817 5.121 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)c[nH]c12 564518547 YRURUDNIYQGNCT-UHFFFAOYSA-N 396.450 5.107 30 20 GKED CCC[C@H](C#N)NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 569654234 TXZHRPORWIDEOY-LLVKDONJSA-N 380.275 5.194 30 20 GKED Cc1cc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c(Cl)cc1F 571084583 QVENFAPGOJQAML-UHFFFAOYSA-N 384.794 5.084 30 20 GKED CC(C)[C@@H](CNC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 572537561 XEHKLQHZLIBSKY-AZUAARDMSA-N 395.572 5.049 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)s1 573991935 KNXOUURJZNCLCQ-CQSZACIVSA-N 381.526 5.363 30 20 GKED Cc1c(Br)cccc1-c1noc(C[C@H](CC#N)c2ccccc2)n1 576216183 ZVTOGGGRGXPACD-HNNXBMFYSA-N 382.261 5.048 30 20 GKED CC(C)c1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)n(-c2ccccc2)n1 580803524 KLPITNJOXIZTPT-FQEVSTJZSA-N 387.487 5.162 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc([C@H]4CCOC4)cc3)cc2)cc1 581270273 QWXHEBAMNLGFLP-NRFANRHFSA-N 398.462 5.301 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Nc3ccc(-c4ncon4)cc3)c2)cc1 583837191 ZVDXVHTZBHBBOD-UHFFFAOYSA-N 397.394 5.045 30 20 GKED Cc1c(C(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)sc2ccc(C#N)cc12 589985254 MVPBYRXJCWLEBO-ZIAGYGMSSA-N 380.435 5.180 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1nc2cc(F)ccc2s1 592974550 TTWKZRSLNGPJMG-ZDUSSCGKSA-N 396.830 5.839 30 20 GKED CCn1c(COc2ccc(C)cc2)nnc1S[C@@H](C#N)c1ccc(Cl)cc1 594893035 NBXBFNGOTKLMQK-SFHVURJKSA-N 398.919 5.196 30 20 GKED C=CCOc1ccc(CNc2cccc(COCc3ccco3)c2)cc1Cl 604065636 LIHSSRIIHIUZFU-UHFFFAOYSA-N 383.875 5.827 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCc1cccc(OC2CCCC2)c1 609016593 QBZYWDKDEQOULE-UHFFFAOYSA-N 390.527 5.249 30 20 GKED CCC[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccn1 609434002 VMVCZMIWIGLOEO-QFIPXVFZSA-N 386.455 5.408 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(OCc3ccccc3)cc2)c(F)c1 610218827 ADVMKZZCXYIYEN-UHFFFAOYSA-N 392.455 5.007 30 20 GKED COc1ccc2sc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)c(C)c2c1 610226935 UFRVLFJXUOQNDB-UHFFFAOYSA-N 378.497 5.141 30 20 GKED CC(C)OC1CCC(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)CC1 611051910 OKXVQVNTHGKBAA-UHFFFAOYSA-N 392.499 5.011 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(COc3ccccc3)cc2)c(Cl)c1 611357506 UGXXPSXKEROTMJ-UHFFFAOYSA-N 397.261 5.696 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OCc1ccc(F)cc1)c1ccc2ccccc2n1 613291243 WZSADLSNBVZMAM-OAQYLSRUSA-N 396.421 5.443 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1CNCc1ccc(C#N)c(Cl)c1 619748777 OJKLUZSHGXWTPC-UHFFFAOYSA-N 399.325 5.017 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)c(F)c1 622485309 KECZSDDKDUARRD-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)c1 727981593 OUBZKXRCUSVABZ-GOSISDBHSA-N 386.520 5.925 30 20 GKED Cc1ccc(N(Cc2cccs2)C(=O)c2cc3ccccc3n2CC#N)cc1 729650374 CIRSSEMVEALZQP-UHFFFAOYSA-N 385.492 5.382 30 20 GKED C#CCCOc1ccc(CNCc2ccccc2-c2ccc(CN(C)C)cc2)cc1 733324217 OIOMEGVZLRLUPP-UHFFFAOYSA-N 398.550 5.107 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)s1 736432863 IIJSSGKGONGFAJ-HJWRWDBZSA-N 381.453 5.295 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 739155777 VQGPBTIVIYTXFJ-VGSWGCGISA-N 384.479 5.243 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 741678334 OVWXXJWLLWJIFH-UHFFFAOYSA-N 392.286 5.193 30 20 GKED C=CC[C@@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccncc1 742075926 KJKPRARRBJPROL-LJQANCHMSA-N 399.922 5.157 30 20 GKED CC(C)(C(=O)Nc1ccc(F)cc1OCC#N)c1ccc(-c2ccccc2)cc1 752819787 PFAFDNSFQFXBTD-UHFFFAOYSA-N 388.442 5.311 30 20 GKED COc1cccc([C@H](C)CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 753198971 QRDOSWXXUOQBIR-HOYKHHGWSA-N 384.479 5.483 30 20 GKED CC(C)c1cnc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)s1 753569183 FQTWBMFDFCDGJA-UHFFFAOYSA-N 381.476 5.468 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cs1)c1nc(-c2c(F)cccc2F)cs1 759453847 DSKDCQAKVXBDGO-VIFPVBQESA-N 380.828 5.293 30 20 GKED C[C@@]1(c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCCO1 763331679 GYWODYICWRCSRR-FQEVSTJZSA-N 381.819 5.080 30 20 GKED CC(C)(C)[C@H](C#N)OC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 765631019 IDYQQAYWHXMWJF-HNNXBMFYSA-N 379.243 5.276 30 20 GKED Cc1ccc(NC(=O)c2cc(C)n(-c3ccc(C#N)cc3)c2C)cc1-c1ncco1 766061168 MXUNERSCOOSPCO-UHFFFAOYSA-N 396.450 5.182 30 20 GKED CC(=NOCc1nnc(C(C)C)o1)c1ccc(OCc2ccc(C)cc2)cc1 768517963 WNHYRGATQYNJQT-UHFFFAOYSA-N 379.460 5.021 30 20 GKED Cc1noc2nc(-c3ccccc3)cc(C(=O)OCCCCC(C)(C)C#N)c12 768542529 IXQKFFRLWJQCKO-UHFFFAOYSA-N 377.444 5.075 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cccc(N2CCCC2)c1 777946213 FGWBIMRBARHURX-UHFFFAOYSA-N 383.451 5.203 30 20 GKED CC1=C[C@H](C)C[C@H](C=Nn2c(S)nnc2Cc2cccc3ccccc23)C1 789641434 YDYUSGADFJEGTI-RDJZCZTQSA-N 376.529 5.137 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)c1nccc2ccccc12 792094391 NYBBCELDHWELIU-SFHVURJKSA-N 380.369 5.162 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1cnc2ccccc2n1 793283362 ZSIMQMQAJONXEN-NVXWUHKLSA-N 397.400 5.094 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)c(C)cc1Cl 796638016 YJJSHTQFCLPZQR-GOSISDBHSA-N 376.843 5.071 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)cc1 797571888 WQRJNKPZGZDTRT-SMDDNHRTSA-N 391.334 5.183 30 20 GKED CC(=NOCCCC1(C#N)CCOCC1)c1ccc(-c2ccc(F)cc2)s1 799174374 FVBCCFOGMCOBKZ-UHFFFAOYSA-N 386.492 5.395 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1Cc2ccc(Cl)cc2C1 800537742 HXIQCFOMABALEX-GUYCJALGSA-N 385.920 5.023 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)c12 809087217 TUEVOIJLIOSROZ-CALCHBBNSA-N 396.535 5.105 30 20 GKED CC(/C=C\C(=O)c1cccc(N2CCOC2=O)c1)=C\c1ccccc1OC(F)F 811689404 CNGOGXKYTLQZBY-JZZUDSPYSA-N 399.393 5.087 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1 813218394 VKUCQJARDKRZFW-QARUFBMTSA-N 398.306 5.399 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2ccccc2)C(F)F)cc1 814576487 DOJALMIFCJQLEQ-RTWAWAEBSA-N 391.421 5.470 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccc(C(F)(F)F)cc1 819439488 GLTGPBPBWKOPQZ-CXAGYDPISA-N 380.435 5.245 30 20 GKED Cc1ccc(C2(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)CCC2)cc1 842689504 HYVIXIKKNVBPOS-INIZCTEOSA-N 379.410 5.038 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 847433389 BSJAZOGOWCJLNN-FOIQADDNSA-N 386.417 5.119 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CC(O)(c2cccc(Cl)c2)C1 861269423 UZSVHIYVFLFYQF-UHFFFAOYSA-N 383.919 5.428 30 20 GKED N#C[C@H](C(=O)c1cc2c(F)cccc2s1)c1nc(-c2ccccc2)cs1 915102585 YSBKHRADKLLVPG-CQSZACIVSA-N 378.453 5.654 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C2CCCCC2)cc1 916681656 VTFCIMZVZZEQLU-RPWUZVMVSA-N 387.527 5.919 30 20 GKED Cc1ccc(NN=Cc2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1Cl 1776034906 KDAWCGIJKIJXOB-UHFFFAOYSA-N 378.859 5.389 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(OCc2ccccc2C)cc1 1776084318 IBGRSSZGVNZOIR-UHFFFAOYSA-N 388.467 5.037 30 20 GKED Cc1ccc(-c2ncc(/C=C3/CCc4oc(C(=O)O)c(C)c4C3=O)s2)cc1C 1777431433 JMRBQVGVQCTVJF-ZROIWOOFSA-N 393.464 5.239 30 20 GKED CC(C)(C)CCCCCC(=O)NC1(c2ccc(NC(=O)CC#N)cc2)CCC1 1787650108 HXEROVPEHYVSMT-UHFFFAOYSA-N 383.536 5.031 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)c3cc4sccc4s3)cc2)CCC1 1789257257 PJEDQLKYIZVRBL-UHFFFAOYSA-N 396.537 5.287 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H](C)CC)CC1 1829068130 GOVIYLXFVLSZAQ-FPOVZHCZSA-N 390.612 5.035 30 20 GKED N#CC1(c2ccccc2)C/C(=C\c2ccsc2)C(=O)/C(=C/c2ccsc2)C1 6432865 BFNAXOJGNSTFOI-ROUMAOROSA-N 387.529 6.101 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(-c3ccccc3)o2)nnc1-c1ccccc1 7833174 PUZUBYYKMPSYMS-OAHLLOKOSA-N 389.484 5.034 30 20 GKED CN(Cc1ccco1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 47565565 JNVDZQVHKRXIIR-IBGZPJMESA-N 379.847 5.252 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3sc(C(C)(C)C)nc3C)n2)cc1 61068618 SRAOPJCQPNVNMC-HNNXBMFYSA-N 395.553 5.671 30 20 GKED C=CCc1cc(CNC(=O)c2sccc2-c2ccccc2)cc(OC)c1OC 65175265 UGKUOOYTXQFSOZ-UHFFFAOYSA-N 393.508 5.091 30 20 GKED CC[C@@H](NC(=O)c1cccc(OCc2ccccc2C#N)c1)c1cccs1 65650662 DVROASAIOAFYTK-HXUWFJFHSA-N 376.481 5.080 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66800987 YXEKTPXDPFUUBV-GFCCVEGCSA-N 399.566 5.827 30 20 GKED CSc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66954150 SAJPBCURWRCYQM-HUUCEWRRSA-N 385.558 5.685 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 104545668 JQTXJFKSBKWPBA-UHFFFAOYSA-N 391.515 5.039 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3cccc(F)c3)n2)cc1 116594550 AEZXYLIPBSNPHU-LIRRHRJNSA-N 394.471 5.328 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 186646501 LWFNSNNJIVMVRK-OPAMFIHVSA-N 399.897 5.131 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1F 237453394 MLBIVLAMHMQFCW-MRXNPFEDSA-N 378.422 5.266 30 20 GKED C[C@H](C#N)Oc1ccc(CNC2CCN(c3ccc(C(C)(C)C)cc3)CC2)cc1 237591446 KETHJVXSRAOTHH-LJQANCHMSA-N 391.559 5.034 30 20 GKED C[C@H]1C[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 245559260 BLSUWNJTXLNJFY-BAAGSCJXSA-N 397.906 5.073 30 20 GKED O=C1/C(=C\c2ccc([N+](=O)[O-])cc2)CCc2nc(-c3ccc(F)cc3)sc21 303137898 DCSXMUATMKXFIL-KAMYIIQDSA-N 380.400 5.070 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)C1(C#N)CCCCC1 303300266 MQMPQLVQQHZFPK-AWEZNQCLSA-N 387.936 5.423 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)N(Cc2ccccc2Cl)C2CCCC2)CC1 328694042 JVHUCFOQBRTUCV-GOSISDBHSA-N 389.927 5.040 30 20 GKED CC(C)c1ccc([C@H](C)/N=C(/O)N2CCn3c(C4CCCC4)nnc3[C@@H]2C)cc1 329427134 HFXZOSBDHQBILQ-IRXDYDNUSA-N 395.551 5.111 30 20 GKED CC(C)(C)n1nc(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)cc1C1CC1 329520182 QGAGIMLYJKZVGG-SFHVURJKSA-N 395.551 5.209 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 410964568 HRYOZZUQAYDCGR-JKSUJKDBSA-N 378.781 5.167 30 20 GKED N#CC1(CC[S@](=O)Cc2csc(-c3ccc(Cl)cc3)n2)CCCCC1 417159511 ORERZXFWQWWXAM-VWLOTQADSA-N 392.977 5.576 30 20 GKED CCc1occc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 430558639 WEKLOWKUCLABOT-UHFFFAOYSA-N 380.831 5.198 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2C(=O)c2ccccc2)s1 430610576 LBUXUORGRAUHHC-SFHVURJKSA-N 388.492 5.162 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CCCOc2cc(Cl)ccc21)c1ccccc1 431454932 CMPXTYBLDASIGS-WOJBJXKFSA-N 397.906 5.288 30 20 GKED C[C@@H](NC(=O)CN[C@@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 433017284 YCTYGQNJPRYLMZ-DVECYGJZSA-N 385.511 5.042 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 438642580 ARLCIVVTCSXCCU-UHFFFAOYSA-N 393.462 5.239 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1[N+](=O)[O-] 439118888 PNQZTGXEKYTLSJ-AWEZNQCLSA-N 383.473 5.365 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)SCc2ccc(C#N)cc2OC(F)F)c1 439541562 NFRUOGIEXDYABP-CQSZACIVSA-N 390.455 5.037 30 20 GKED Cc1c(C(=O)N[C@H](CCC#N)c2ccccc2)oc2ccc(Br)cc12 439672274 KAGLWUZYPOWVJU-QGZVFWFLSA-N 397.272 5.279 30 20 GKED CC[C@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(C#N)cc1 447528674 JLGYOYVOFYIQSW-SANMLTNESA-N 383.539 5.528 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CC1CC(F)(F)C1 451560567 WKVDHWWFISCBPN-UHFFFAOYSA-N 389.286 5.118 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccc(CC#N)cc2Cl)c(Cl)c1 452656264 UAQNQXIMGUCKJR-UHFFFAOYSA-N 377.271 5.491 30 20 GKED COc1ccccc1[C@H](C)SCC(=O)N(CCC#N)c1cccc(C)c1C 463214890 VHMBJLJNLKOLCU-SFHVURJKSA-N 382.529 5.053 30 20 GKED Cc1cccc(Br)c1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 464399870 SIORGTAEPQCWML-ZDUSSCGKSA-N 398.087 5.059 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(CC)nc2ccc(Cl)cn12 464477686 FAOIRMLURJRNRW-UHFFFAOYSA-N 381.907 5.654 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 464764737 XQJKOEXFVCVBIC-SFHVURJKSA-N 394.478 5.468 30 20 GKED N#Cc1cccc(SCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 468629618 IUEGRUAHLRVOTG-SFHVURJKSA-N 391.323 5.321 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(F)cc(F)cc1Br 470256953 WQWSWXAINGILHE-UHFFFAOYSA-N 395.247 5.338 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@@H]3CCC[C@H]3c3ccccc3C(F)(F)F)CC2)cc1 474144930 FLGUGMYDBWEUHR-AZUAARDMSA-N 398.428 5.061 30 20 GKED Cc1nc(COc2ccccc2C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cs1 474429661 GYJASDJXTGGCLM-MRXNPFEDSA-N 397.525 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(-c2ccccc2)no1 475578318 OLXYEVMADDHKJO-UHFFFAOYSA-N 375.472 5.515 30 20 GKED C=CCC[C@H](NCc1nc2ccc(Br)cc2n1C)c1ccccc1 485817842 GYEJRONZZCTFOE-KRWDZBQOSA-N 384.321 5.133 30 20 GKED Cc1cc(C)c(Br)c(C(=O)N[C@H](CCCC#N)c2ccccc2)c1 487571770 YIIMVFRFFZKWSU-GOSISDBHSA-N 385.305 5.231 30 20 GKED N#CCCC[C@H](NC(=O)Cc1cc2c(ccc3ccccc32)o1)c1ccccc1 487592780 JVOALCLNWCPQIZ-QHCPKHFHSA-N 382.463 5.680 30 20 GKED C=CCn1c(SCC(=O)C23CC4CC(CC(C4)C2)C3)nnc1-c1cccs1 489456622 ABDCGKXWQAAMOI-UHFFFAOYSA-N 399.585 5.070 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(OC(F)F)cc3)o2)cc1 489811533 RTRIJVRJCHBBEC-UHFFFAOYSA-N 390.411 5.195 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2ccc(-c3ncco3)cc2)cc1 500386432 KWEZGPFTYQFZLD-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2ccc(F)cc2C(F)(F)F)cc1 505797048 RZIGYUNAPBYHEP-KRWDZBQOSA-N 378.369 5.137 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@H](CCC)c2ccccc2)cc1 510534451 PSWJDYJAJMLDNS-JOCHJYFZSA-N 391.515 5.164 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc(-c4ccco4)s3)n2)cc1 510588032 ATXGWSLSBPDADX-AWEZNQCLSA-N 391.477 5.325 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510647840 KLWUKIJXQQOHNZ-UHFFFAOYSA-N 393.393 5.293 30 20 GKED Cc1ccc(-n2c(SCc3ccc(C#N)cc3)nnc2-c2ccccn2)c(C)c1 515563460 MPWQUGFHDKFNQE-UHFFFAOYSA-N 397.507 5.110 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)cc3F)cc2F)c1 524455196 KDORXKSYXZLRQW-UHFFFAOYSA-N 398.796 5.321 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccccc2SCC=C(C)C)cc1 525471304 FWUFVRBCIDBSLF-UHFFFAOYSA-N 395.528 5.305 30 20 GKED N#C[C@H](C(=O)c1cccc2ncccc12)c1nc(-c2c(F)cccc2F)cs1 537261796 DATMFJTXDCBNEG-CQSZACIVSA-N 391.402 5.127 30 20 GKED N#Cc1ccccc1OC1CCC(NC2CCC(C#N)(c3ccccc3)CC2)CC1 537980385 SEBXFTLGWPCYKY-UHFFFAOYSA-N 399.538 5.242 30 20 GKED C[C@@H](Cc1noc(-c2ccc(Oc3ccc(C#N)cn3)cc2)n1)c1ccccc1 547175104 IPELHTMOWLDHSJ-INIZCTEOSA-N 382.423 5.142 30 20 GKED N#CCCC[C@@H](NC1CCN(Cc2c(F)cccc2Cl)CC1)c1ccccc1 550832542 KWWHJFZVDHNKNB-HSZRJFAPSA-N 399.941 5.468 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCc2cc(Br)ccc21)c1ccccc1 556203381 MBDMBDGGQHSVQH-LEWJYISDSA-N 383.333 5.851 30 20 GKED C[C@H](NCC(C)(C)CCC#N)c1ccc(Br)cc1C(F)(F)F 558237080 GAYMYCFRYLYTKQ-NSHDSACASA-N 377.248 5.448 30 20 GKED CC(C)(C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cc(F)cc(C#N)c1 560678603 JNQMHTLNYUBLBD-UHFFFAOYSA-N 392.396 5.454 30 20 GKED C[C@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 572589869 ZMLOMZMKJFUGPS-SQGPQFPESA-N 379.529 5.553 30 20 GKED C/C(=C\c1cccc(C(F)(F)F)c1)CN1CCC(C#N)(c2ccccn2)CC1 576432390 DEVTUYJXJNPLHM-GHRIWEEISA-N 385.433 5.061 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)C(C)(C)c1cc(F)cc(C#N)c1 581847548 OLXNFHRBUJKRQL-AWEZNQCLSA-N 387.524 5.083 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)NCc1ccc(C#N)c(Cl)c1 588316084 KQVFUMLMLMSMGT-UHFFFAOYSA-N 396.922 5.222 30 20 GKED Cc1cccnc1/C=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 588456805 CSQPNFORHBRVPH-QWGSZXSUSA-N 379.872 5.057 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Br)cc1C#N 593140429 PJRWOTOEDVODCG-UHFFFAOYSA-N 399.332 5.578 30 20 GKED CSCc1c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)oc2ccccc12 602756568 VLDCFQKAMMXFQU-GFCCVEGCSA-N 396.537 5.606 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1ccc2ccccc2c1 603600869 IIQQJLKRUQZWDR-UHFFFAOYSA-N 393.446 5.388 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)Nc2ccc(CC#N)cc2)c2cccs2)cc1 603650757 QTOUSJBBYRWYRY-JOCHJYFZSA-N 389.524 5.849 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1ccc(CC(C)C)cc1 603738936 KABDKABOKGKSAK-UHFFFAOYSA-N 399.494 5.434 30 20 GKED CCc1cc(C#N)c(NC(=O)c2nc(-c3ccccc3)n3c2CCCCC3)s1 604028869 XHWXIPQGRGDIMI-UHFFFAOYSA-N 390.512 5.024 30 20 GKED CSCc1c(C(=O)Nc2cc(C#N)ccc2OC(C)C)oc2ccccc12 604342910 DJDLDNWIBAQCPQ-UHFFFAOYSA-N 380.469 5.207 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1sccc1C1CC1 609072712 XRROUSXIGFYOBM-UHFFFAOYSA-N 388.492 5.637 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H]3c3ccc(O)cc3)c2)cc1 609136004 ZXZTYBXTTYNSOL-HSZRJFAPSA-N 384.435 5.033 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)c(F)c1 609778512 KSHUHETWLOIXQS-HXUWFJFHSA-N 385.870 5.178 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](C)c2cccc(C#N)c2)cc1 610344676 DXRVPDIHNHUSFV-HXUWFJFHSA-N 392.506 5.570 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 611169839 TYTQKWQLLCMCOG-ZDUSSCGKSA-N 386.293 5.327 30 20 GKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 611391181 YQYOOLDDASGDMP-IQGLISFBSA-N 383.495 5.260 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(C(C)(C)C#N)cc3)cc2)cs1 614180109 XILCACLIFXKUFY-INIZCTEOSA-N 375.541 5.771 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCC(F)(F)CC1 622284116 PHSGGEKOOPWHPS-UHFFFAOYSA-N 375.259 5.488 30 20 GKED C=CCC1(C(=O)N2CCC(Cc3nc(C4CCCCC4)no3)CC2)CCCC1 628413556 DBSCDJTZTFEJPQ-UHFFFAOYSA-N 385.552 5.035 30 20 GKED CCc1nc(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c(C)o1 648494497 ULIXOKCGUHZQJQ-UHFFFAOYSA-N 398.278 5.087 30 20 GKED Fc1ccc(-c2csc(N3C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C3)n2)cc1 674932528 IRSUULCQVQFRJK-QWRGUYRKSA-N 384.320 5.126 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 678642339 MYJVHKGSKPMXGC-INIZCTEOSA-N 382.460 5.241 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C\c1cccc(NC(=O)c3ccccc3Cl)c1)C2 730949585 XTYUHMAVDZRTPO-PDGQHHTCSA-N 387.866 5.723 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 730955008 RTMMMEQLFULRSQ-LBPRGKRZSA-N 386.933 5.272 30 20 GKED Cc1cc(C)c2c(c1)c(C)cc1nnc(SCc3ccc(OCC#N)cc3)n12 731156396 ROPIAJRUDLYACP-UHFFFAOYSA-N 388.496 5.002 30 20 GKED N#Cc1cccc(COc2ccc(NCc3noc4c3CCCC4)cc2Cl)c1 731210758 KYYANTHITOHSBW-UHFFFAOYSA-N 393.874 5.270 30 20 GKED CCC(Cc1cccs1)=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1 733079684 IJJXEWGIGVEOBL-UHFFFAOYSA-N 391.422 5.040 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)c1 733805253 PJDSJTHVYFYPOQ-JTHBVZDNSA-N 391.515 5.031 30 20 GKED CCCOc1c(/C=C/C(=O)c2c(Cl)nc3ccccn23)cccc1OCC 737448189 DPJUIKAONXDKBS-VAWYXSNFSA-N 384.863 5.071 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@@H](c3ccccc3C)C[C@@H]2C)c1=S 738054315 NMCXKOPVXSCVAS-ROUUACIJSA-N 394.544 5.004 30 20 GKED COC(=O)[C@H](Nc1cccc(CSC2CCCCC2)c1)c1ccc(C#N)cc1 740000812 QSBXJXSSOGELSW-JOCHJYFZSA-N 394.540 5.450 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c[nH]c12 741537046 ALNXDXYMNARLBL-XMMPIXPASA-N 393.490 5.703 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)/C=C/c2ccccc2C#N)cc1 741645892 MLQYQFJCQMJUCD-BMINWGARSA-N 396.490 5.467 30 20 GKED COc1cc(C(=O)/C=C\c2ccccc2OCC(F)(F)F)ccc1SC 741842717 GWIOVIHJHRIOMD-CLFYSBASSA-N 382.403 5.254 30 20 GKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743097372 VAEOAQCKPQXKIA-OFAXGOBFSA-N 375.516 5.775 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1ccc(Oc2cnccn2)cc1 743429319 JZXQAINCROEGNG-UHFFFAOYSA-N 394.478 5.305 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 746871834 OETOSHJDYGVSHB-JOCHJYFZSA-N 387.483 5.029 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(Cl)s1 749910934 IRUWNICRHPSZOR-KBXCAEBGSA-N 380.900 5.799 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(SCc3ccccc3)cn2)cc1 754074712 DDOCAKXWQPXMPE-KRWDZBQOSA-N 375.497 5.277 30 20 GKED N#Cc1ccc(Cl)cc1OCC(=O)Nc1c(Cl)cc(Cl)cc1Cl 761852042 FUSJKLGFFGFSFW-UHFFFAOYSA-N 390.053 5.189 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3nc(C)sc3c2)cc1 763944018 LUIDKOZFQDRBBU-UGSOOPFHSA-N 391.496 5.079 30 20 GKED C[C@@H](C#N)Oc1ccc(CN(C)[C@@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 770323270 FZWGJDCNWVROII-UGSOOPFHSA-N 382.813 5.366 30 20 GKED COc1ccc(NCc2ccc(Cl)cc2C#N)cc1NC(=O)OC(C)(C)C 774282475 VSBZWZCODORZSB-UHFFFAOYSA-N 387.867 5.179 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(N2CCCC2)cc1 777887927 LXDSZZCSBSLUEU-UHFFFAOYSA-N 383.451 5.203 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3O[C@H](C)C#N)c3ccccc3n2)o1 780161258 MFEHEKYHCNRLBO-MRXNPFEDSA-N 397.434 5.346 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1Cl 789156602 CNHKDKIDSIJNNK-FPLPWBNLSA-N 384.888 5.542 30 20 GKED CCCCCCCCS(=O)(=O)[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1 790146398 VYLGAJRKLKXQSZ-AWEZNQCLSA-N 384.929 5.226 30 20 GKED C=CCCCCCCCNC(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 811927084 HZBHATXWVYAWHU-OKILXGFUSA-N 388.396 5.285 30 20 GKED N#CCOc1cccc(/C=C(/Cl)c2nc3ccc(Br)cc3o2)c1 812248655 QIEQQWBSKXAKMQ-NTEUORMPSA-N 389.636 5.230 30 20 GKED COc1ccc2cc(/C=C\C(=O)N[C@H](CCCC#N)c3ccccc3)ccc2c1 817314133 OXXQFWOKUFOXNU-GEKQYNKISA-N 384.479 5.413 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N(CCC#N)Cc2ccco2)cc1F 836721720 OWWBQFGIBHQULP-UHFFFAOYSA-N 375.469 5.257 30 20 GKED N#CC1(CCCC[S@](=O)Cc2coc(-c3ccc(Cl)cc3)n2)CCC1 899386904 SLFYSOUTFVVJCD-VWLOTQADSA-N 376.909 5.108 30 20 GKED Cc1[nH]c2c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cccc2c1C 915085191 IGERLSNWMOUKGL-QHCPKHFHSA-N 379.463 5.693 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccccc3)CCOCC2)cc1 915179224 BKRCCZWBMLYSOT-XMMPIXPASA-N 396.490 5.029 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@H]2c2cccn2C)s1 915311584 NNPLPFJEUQPCLP-KRWDZBQOSA-N 389.569 5.149 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c(Cl)n1 916039486 NAMRUGXPPVBCMO-LBPRGKRZSA-N 387.936 5.380 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 916849510 WULNHPNENUEYLH-SQJMNOBHSA-N 394.499 5.945 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCc1ccc(Cl)cc1Cl 920105288 ACPSVMMOYJRZCK-MRXNPFEDSA-N 399.277 5.308 30 20 GKED CC(C)c1sc(NC(=O)CSc2ccccc2C#N)nc1-c1ccccc1 1472989891 JIRCXSCSBPPZRW-UHFFFAOYSA-N 393.537 5.536 30 20 GKED CCC(=NNc1ccc(C#N)c(Cl)c1)c1ccc(OCCCCC(=O)O)cc1 1776054322 AUROWLWPEUDKRO-UHFFFAOYSA-N 399.878 5.072 30 20 GKED Cc1c(NN=Cc2c(-c3ccccc3)n(C)c3ccccc23)cccc1C(=O)O 1776086472 WHUMEOYPIZAZMK-UHFFFAOYSA-N 383.451 5.298 30 20 GKED Cc1c(NN=C(CC(C)C)c2cccc(C(F)(F)F)c2)cccc1C(=O)O 1776086576 CDBROBNLGHOCAL-UHFFFAOYSA-N 378.394 5.574 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc4c(c3)CCCC4)cc2)cc1 1776113995 YFSRAZDCLLFVCP-FRKPEAEDSA-N 382.459 5.827 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776119662 IFNGHZQATUVJPZ-FMIVXFBMSA-N 390.435 5.544 30 20 GKED C=CCOc1ccc(/C=C/c2nc3c(s2)CCC[C@H]3C(=O)O)cc1Cl 1776184139 KSBKTSZKHDICHO-BUUCAEBMSA-N 375.877 5.036 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cccc(Cl)c2C(F)(F)F)c1)C(=O)O 1776471345 LRCUTDBKJXYABS-IQQGHNRFSA-N 398.764 5.107 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]([C@@]23CC[C@@H](C2)[C@H]3C(=O)O)C1 1776786822 PULFDPIZXDKJRG-GZMKSWLHSA-N 377.569 5.113 30 20 GKED C=CCCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC(C)(C)C)CC1 1823750649 RHPNZQYWXBQUSB-FQEVSTJZSA-N 390.612 5.035 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccc(Cl)cc2)nn1-c1ccccc1)c1ccccn1 41493741 HIACDBNVPWPRPR-LJQANCHMSA-N 398.853 5.078 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3c(s2)-c2ccccc2CC3)c1 59770172 AMARECRTURMWRM-UHFFFAOYSA-N 388.492 5.449 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C)Cc3ccc(C#N)cc3)cc2)n1 63162986 VMQNQXKYSWFJPZ-UHFFFAOYSA-N 394.525 5.138 30 20 GKED N#Cc1ccccc1CSCc1coc(-c2ccc(Br)cc2)n1 63650926 ORCIKBWBQBNKDY-UHFFFAOYSA-N 385.286 5.409 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(F)c(Cl)c1 66956186 CHVVWLQCDAMXBJ-GFCCVEGCSA-N 377.872 5.195 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)[C@H](C#N)c3nc(C)cs3)o2)cc1 69832068 BFLRLVZJOSNMKO-IBGZPJMESA-N 399.475 5.572 30 20 GKED N#Cc1cc(F)ccc1CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 102971946 QODCCEZJUPHIPS-UHFFFAOYSA-N 389.459 5.064 30 20 GKED CC(C)c1ccc(-c2noc(CNc3ccccc3SCCC#N)n2)cc1 108352989 XGMGATNBHJUTBZ-UHFFFAOYSA-N 378.501 5.478 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H](C)Oc1ccc(-c2ccccc2)cc1 108900429 ZZJIBNYWPACPIN-QGZVFWFLSA-N 386.451 5.030 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)N(CCC#N)Cc1ccco1 122957658 MMYXDPXWRQCRLQ-UHFFFAOYSA-N 391.496 5.687 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cnoc1-c1ccc(Cl)s1 135575936 KJDRICVTASYVOH-LBPRGKRZSA-N 389.933 6.063 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3c(F)cccc3F)n2)cc1 154389316 DLXREJCBGYJOCO-DOMZBBRYSA-N 398.434 5.077 30 20 GKED Cc1cc(C#N)ccc1C(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 160189558 LAXFMDYFRIAYHJ-UHFFFAOYSA-N 395.915 5.150 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(Cl)cc2Cl)ccc1OC 174091827 HOKKKDVXXIXEQM-BBRMVZONSA-N 393.314 5.534 30 20 GKED CC(C)CCOC1CCN(C(=O)c2ccccc2Oc2ccccc2C#N)CC1 182510397 AGTMUWPPHONZTL-UHFFFAOYSA-N 392.499 5.018 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3cnc4ccccc4n3)sc2C)cc1 190909064 FNSPSAFFWMIUPE-GOSISDBHSA-N 399.475 5.165 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)cc1OC 216730327 ZAVCTMVEISAQKB-GFCCVEGCSA-N 384.278 5.557 30 20 GKED C=CCn1c(SCc2nc(-c3ccccc3)oc2C)nnc1-c1ccoc1C 248012152 JICOTYGDYMCMIV-UHFFFAOYSA-N 392.484 5.288 30 20 GKED Cc1cc(F)cc2c(N3CCC[C@@H](c4nc5ccccc5o4)C3)c(C#N)cnc12 301556097 WPQDNMTTZXCHTA-OAHLLOKOSA-N 386.430 5.079 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c(C)c2)c1 303342757 ZGSPAKQOYRDHSM-UHFFFAOYSA-N 399.494 5.418 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2CCC(F)(F)F)s1 430591163 NHLFELSPZHAOON-AWEZNQCLSA-N 380.435 5.426 30 20 GKED COc1ccc(-c2nc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 430599912 QUAKYCGKTFTNJW-CQSZACIVSA-N 397.525 5.063 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1C(=O)Nc1cccc(C#Cc2ccccc2)c1 431610777 ZMMAQIRZBKCLJQ-QHCPKHFHSA-N 398.510 5.062 30 20 GKED N#CCCC[C@H](NC(=O)NCCc1ccc(Cl)cc1Cl)c1ccccc1 431741068 BCSPTBDVKCLLAW-IBGZPJMESA-N 390.314 5.270 30 20 GKED N#CCCC[C@H](NCc1c(-c2ccccc2)nc2ccccn12)c1ccccc1 433021497 XOKCSWSFMTWAHV-QFIPXVFZSA-N 380.495 5.526 30 20 GKED CC(C)N(Cc1cccc(F)c1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438645269 XKHHJDSKTFIPCY-UHFFFAOYSA-N 379.357 5.159 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 439353433 PXMGRFZLHMCZDM-ICSRJNTNSA-N 397.906 5.028 30 20 GKED C=CCC[C@@H](NC(=O)Cc1noc2ccccc12)c1ccc(C(F)(F)F)cc1 441590121 MUVRPHXVSKDJPX-QGZVFWFLSA-N 388.389 5.213 30 20 GKED N#Cc1ccsc1C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444433890 JMDVGTNRHKSMKV-GFCCVEGCSA-N 392.324 5.062 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2noc(C3CCCCC3)n2)n1 448101814 QXAXHJWZCQGNLF-UHFFFAOYSA-N 382.411 5.004 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457713910 RYCJGHNUJYGWBW-XCBNKYQSSA-N 381.238 5.014 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1cncc2ccccc12 462439571 YKWMWSVPOUUEBP-UHFFFAOYSA-N 383.476 5.406 30 20 GKED C[C@H](C(=O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 462543561 AKYDUZXGMCADSG-ADLFWFRXSA-N 386.417 5.133 30 20 GKED COc1ccc([C@@H](NCc2cccc(C#N)c2)c2ccccc2Cl)c(C)c1 462746027 ODVGJXJGUZMXFN-HSZRJFAPSA-N 376.887 5.408 30 20 GKED COc1cc(F)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1F 468361394 ZGYDPCBWBCTAIR-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)c1nc(O)c2c(-c3ccccc3)csc2n1 468638024 MBWMMLZFBOTOCG-CYBMUJFWSA-N 389.505 5.789 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1nc(-c2ccc(Cl)c(Cl)c2)oc1C 471177536 QEQVZJUGXAPRAB-UHFFFAOYSA-N 394.302 5.501 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCN(c2ccc(F)cc2)C1 475548085 ALEQFSPISLCOKY-GOSISDBHSA-N 395.522 5.326 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1coc(-c2ccccc2Cl)n1 476090355 KTBQGNWPCMXKCH-UHFFFAOYSA-N 380.875 6.099 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@H](c1ccccc1)C(CC)CC 480570329 ULYKXAZEOFKOKJ-QFIPXVFZSA-N 384.520 5.037 30 20 GKED C=CCn1c(SCc2cccc(OC(F)F)c2)nnc1-c1cccs1 481393356 YBKUARXVZYCKCZ-UHFFFAOYSA-N 379.457 5.086 30 20 GKED CC(C)c1c(NC(=O)NCC(C)(C)CCC#N)cnn1-c1ccc(Cl)cc1 482162161 YSNWQEUFFSTFNZ-UHFFFAOYSA-N 387.915 5.101 30 20 GKED C[C@@H](c1c(F)cccc1F)N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482629785 ALWVABYTCLXLNV-HNNXBMFYSA-N 392.405 5.462 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2)cn1 483208062 YAXLJPXOIPSTOI-HSZRJFAPSA-N 393.446 5.007 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)ccc1OC(F)F)c1nc2ccccc2s1 484550822 YOQUPNSSCLGUJT-NSHDSACASA-N 378.787 5.041 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 500256583 ZBIMYCOTMLGEKR-MRXNPFEDSA-N 381.369 5.455 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 500748293 USCFESAGRDEBJT-UHFFFAOYSA-N 391.496 5.629 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1OC)C[C@@H]1CCCO1 505056188 ARYDEEMXKLWDLO-NRFANRHFSA-N 394.515 5.027 30 20 GKED CC[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 507613385 QZEDLHXCJCTGDA-KOHRHEQBSA-N 393.478 5.607 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 509529570 VSRWICKCOXAHLT-MRXNPFEDSA-N 381.545 5.871 30 20 GKED C=CCOc1ccc(CN[C@H](CC)c2ccc(OC)c(OC)c2)cc1Cl 512885227 MOXDIDVSJFTWRQ-GOSISDBHSA-N 375.896 5.163 30 20 GKED Cc1c(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)ccc(C(F)(F)F)c1F 513524979 IVYZXKKXDBLDPG-ZDUSSCGKSA-N 397.334 5.348 30 20 GKED N#C[C@H](C(=O)c1occc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 515539580 ZLYGRRBXQRIXFQ-OAHLLOKOSA-N 378.840 5.700 30 20 GKED N#CCCCn1cc(C(=O)N2CCC(c3ccccc3F)CC2)c2ccccc21 516172975 MXDAMMZZEIGVDW-UHFFFAOYSA-N 389.474 5.104 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 517530442 QJNOWRAPWHKUSW-UHFFFAOYSA-N 375.403 5.154 30 20 GKED CC[C@@H](C)C(=O)Nc1cccc(CNc2ccc(C#N)c(C(F)(F)F)c2)c1 518814751 NHIXZTQGCJADLL-CYBMUJFWSA-N 375.394 5.174 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C(C)(C)C#N)cc3)s2)c(C)c1 519397066 MZHMEMDUSKBSCZ-UHFFFAOYSA-N 389.524 5.789 30 20 GKED C=CCc1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C(C)C)cc(OC)c1O 520694509 VTDISEQFUGDZPV-FQEVSTJZSA-N 393.449 5.635 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C1CC1 521598878 JQEZMIABTMGNDL-OAHLLOKOSA-N 390.414 5.448 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 524461435 ZCRBIZAUDZTAKQ-OAHLLOKOSA-N 380.419 5.086 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 535436873 MVBIQVPUSVRWJM-AEFFLSMTSA-N 378.447 5.033 30 20 GKED CSc1ccc(C)c(NC(=O)c2occc2COc2cccc(C#N)c2)c1 537315797 WEDXQJWZUBFKDE-UHFFFAOYSA-N 378.453 5.013 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)c(F)c1 538509838 VTTDETHCQCUBTH-CHWSQXEVSA-N 399.922 6.195 30 20 GKED C=CCC[C@@H](NC(=O)c1cnn(C(C)C)c1C)c1ccc(C(F)(F)F)cc1 538866484 QDMRKQQTMMFOSL-GOSISDBHSA-N 379.426 5.229 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)cc1 539100184 RRHOWFVLHZCJTN-UXHICEINSA-N 386.417 5.210 30 20 GKED C[C@@H](NC(=O)Cc1cccc2cccnc12)c1ccc(-c2cccc(C#N)c2)cc1 543915349 IDGJGYYAWXQKQX-GOSISDBHSA-N 391.474 5.193 30 20 GKED C[C@@H](Nc1ccc(Br)cc1C#N)c1nc2ccccc2n1C(F)F 543959372 SOMUCTKTJGHGJI-SNVBAGLBSA-N 391.219 5.239 30 20 GKED C[C@@H]1CSc2ccc(Cl)cc2N(C(=O)c2ccc(C3(C#N)CC3)cc2)C1 544218879 JSPPBZZJTSSMHI-AWEZNQCLSA-N 382.916 5.284 30 20 GKED Cc1nc(C(F)(F)F)ccc1-c1nc(-c2ccc(C(F)(F)F)c(F)c2)no1 545698945 MAJMSCBTCWWZEG-UHFFFAOYSA-N 391.246 5.284 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccc(-c2nc3ccccc3s2)s1 546004832 UFDBIOYBUZCUTH-UHFFFAOYSA-N 391.477 5.157 30 20 GKED O=C(NCc1cc(F)c(C(F)(F)F)cc1F)Nc1cccc(C(F)F)c1 554175546 UEQDIEOONGGPIS-UHFFFAOYSA-N 380.263 5.243 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(Cl)c(F)cc1Cl 556432981 DVSCBTZDIJJUAP-KSSFIOAISA-N 377.246 5.044 30 20 GKED Cc1nc(-c2cccc(-c3noc(C[C@@H](CC#N)c4ccccc4)n3)c2)cs1 558326565 ZFQWZKGORGKTFJ-QGZVFWFLSA-N 386.480 5.409 30 20 GKED CCc1ccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 567307704 RBECGQGBWYVVLU-INIZCTEOSA-N 384.570 5.515 30 20 GKED Cc1ccc(-c2nc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)cs2)o1 568339411 PHDVLKKEGCTHQP-UHFFFAOYSA-N 388.452 5.383 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C1CC1 582102064 QXTHXHJRYJRVPI-LJQANCHMSA-N 388.492 5.495 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc2c(c1)CCCC2 603601114 PIIDHGQFFZDWFT-UHFFFAOYSA-N 383.451 5.185 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603763941 CRLSGLWXNYKDAM-MRXNPFEDSA-N 389.480 5.006 30 20 GKED Cc1ccccc1-c1noc(CNc2cccc(OCc3cccc(C#N)c3)c2)n1 604006922 AFTYESVCBPYFPN-UHFFFAOYSA-N 396.450 5.108 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)Nc1ncc(C#N)cc1Cl 609289065 QFWPKKJSYFHZAD-JTQLQIEISA-N 389.311 5.865 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1SCCC#N 609375902 JRAJJBJGZOAVJZ-INIZCTEOSA-N 382.529 5.396 30 20 GKED Cc1noc([C@@H](C)Sc2nc(-c3ccc(C)o3)cc(C(F)(F)F)c2C#N)n1 609604421 QHRDLSDEOOILJV-SECBINFHSA-N 394.378 5.085 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 610400453 QGADUJSRCXGSTF-OSPHWJPCSA-N 395.462 5.454 30 20 GKED Cc1ccc(C)c(NC(=O)CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 611807127 KINHSVMNCGKFJK-IBGZPJMESA-N 383.495 5.131 30 20 GKED Cn1c(SCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)nnc1C(F)F 629173181 PNNUQKVZUHQMTB-UHFFFAOYSA-N 391.287 5.083 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(N3CCCCCC3)cc2)cc1Cl 726447143 MOBYMCFTEKJDEO-UHFFFAOYSA-N 384.936 5.401 30 20 GKED N#Cc1ccc(CN(Cc2c(-c3ccccc3)nc3sccn23)C2CC2)cc1 727474219 OTLULADYUILMBY-UHFFFAOYSA-N 384.508 5.099 30 20 GKED N#C[C@H](C(=O)Cc1cccc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 727953988 KASFSFOUJFEEHB-CYBMUJFWSA-N 394.805 5.387 30 20 GKED Cc1ccccc1C(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)C1CC1 733079508 FKHHIQNGWWPDLZ-UHFFFAOYSA-N 397.404 5.092 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccc(CC(C)C)cc1)C1CC1)c1ccncc1 734666620 ZRCYDBLFZJQLCY-GOTSBHOMSA-N 377.532 5.348 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(CSCc3ccccc3)c2)cc1 734935062 KWBDQESXVKKTKS-UHFFFAOYSA-N 387.508 5.313 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)OC(=O)c1cccc(CC#N)c1 739301071 FUTWEKMKLWCPHJ-CQSZACIVSA-N 380.444 5.242 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)Cc2ccc(OCC#N)cc2)cc1 741804772 LEOMAWDANCDTMN-LJQANCHMSA-N 386.495 5.458 30 20 GKED CS[C@H]1CC[C@H](NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 742743248 VIXYYWJHZVDRQS-WMZOPIPTSA-N 386.904 5.018 30 20 GKED C=CCOc1ccc(OC(=O)c2ccccc2SCc2cscn2)cc1 742862084 PWZLIZFKZQXHIR-UHFFFAOYSA-N 383.494 5.219 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccc(F)cc2F)cc1F 743035691 IJASMRGWADAYRJ-UHFFFAOYSA-N 399.397 5.577 30 20 GKED Cc1ccccc1O[C@H](C)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743095520 LASLDZWKELZODK-XXBNENTESA-N 399.494 5.240 30 20 GKED N#Cc1ccc(OCCCNc2ccc(Cl)cc2[C@@H](O)c2ccccc2)cc1 746051038 GHDWFVAJYSFVHT-QHCPKHFHSA-N 392.886 5.174 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2c1 746126058 RPCJRZCNTKGEOT-XMMPIXPASA-N 393.490 5.703 30 20 GKED O=C(/C=C/c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(-c2ccc(C(=O)O)o2)cc1 747122504 PAUCCTXDKIOAQC-KRXBUXKQSA-N 397.770 5.103 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H]2Cc2ccccc2)cc1 752186727 SXVJHFWXJKJTRH-BJKOFHAPSA-N 381.479 5.191 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H]2Cc2ccccc2)cc1 752186737 SXVJHFWXJKJTRH-RPWUZVMVSA-N 381.479 5.191 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCCc1cc(C)sc1C 753392871 FMLSYCPSUDEWNY-FQEVSTJZSA-N 396.556 5.160 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)OCC 756468588 BUVCMXCTQBDCBM-XHDPSFHLSA-N 399.274 5.019 30 20 GKED CCCn1nc(C)c(/C=C/C(=O)c2ccc(SC(F)F)c(OC)c2)c1C 759653678 UVDWQEIZGXBDOY-BQYQJAHWSA-N 380.460 5.129 30 20 GKED COc1cc(F)c(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)cc1OC 760270695 UCMZNHGQTBIJKJ-BQYQJAHWSA-N 387.407 5.002 30 20 GKED CC(C)n1ncc2cc(/C=C3\C(=O)c4cccc5c4[C@H]3CCC5)c(Cl)nc21 763287643 CLQAVBDYKGLTKV-PMFHANACSA-N 377.875 5.365 30 20 GKED Cc1ccc(C2=CCN(C(=O)c3cn(CCCC#N)c4ccccc34)CC2)cc1 767492266 SCOUPSKHBSOGEH-UHFFFAOYSA-N 383.495 5.183 30 20 GKED CCO[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 770180536 TYVIQDYQIDZEFH-DNQXCXABSA-N 399.494 5.241 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(Cl)cn1 774342915 OTOFMWMKVBOCJO-UHFFFAOYSA-N 397.866 5.382 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccc(F)c(F)c1 775558222 MGLKKKFFAMNFBV-WAIKUNEKSA-N 397.469 5.186 30 20 GKED C[C@H](Nc1cccc(OCc2cccc(F)c2)c1)c1ccc(OCC#N)cc1 776856103 KBISPKMHQNLIRO-KRWDZBQOSA-N 376.431 5.480 30 20 GKED N#CCCN(C(=O)c1sccc1SC(F)F)C12CC3CC(CC(C3)C1)C2 776911062 XUFBRBAVVRRHHU-UHFFFAOYSA-N 396.528 5.387 30 20 GKED N#CC1(c2ccc(C(=O)O[C@H](c3ccc(Cl)cc3)c3cccnc3)cc2)CC1 777318114 LBPZJUNMKHGYLG-OAQYLSRUSA-N 388.854 5.237 30 20 GKED O=C1/C(=C\c2ccc(OC(F)F)c(F)c2)CCc2ncc(C(F)(F)F)cc21 777470512 SZOPBYPTOXFINC-YHYXMXQVSA-N 387.279 5.053 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nc4c(s3)CCCC4)cc2)c1 779594675 NZTDJJKFIDCDRQ-UHFFFAOYSA-N 375.497 5.085 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)cc1F 781911745 NUUVXWWOKDJXTK-BFUOFWGJSA-N 389.858 5.289 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccccc2)C2CCOCC2)cc1 782775417 SYBGWWACLFTSAE-SANMLTNESA-N 382.507 5.483 30 20 GKED C=CC[C@@H](NC(=O)NC(C)(C)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 785873608 UJFJHNSQPPNHCX-GOSISDBHSA-N 391.437 5.038 30 20 GKED COc1ccc(C(=O)/C=C\c2ccnc(Cl)c2Cl)cc1Br 791434216 IRLNQCWNRHKMHV-RQOWECAXSA-N 387.060 5.056 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(N3CCCCC3)c3ncccc23)cc1 793248780 IVVOMJFOWUNZCT-GOSISDBHSA-N 386.499 5.128 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801913284 BXIVRLNFUVFGHI-CEXWTWQISA-N 390.380 5.014 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)c1 809873263 CWZPREFTKKQNSN-SFHVURJKSA-N 390.270 5.169 30 20 GKED N#Cc1cc(/C=C(/Cl)c2nc3ccc(Br)cc3o2)ccc1F 812248534 OMHNYKSQZHYPHL-WUXMJOGZSA-N 377.600 5.338 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)Cc1ccc(Cl)cc1 813211082 CXWTWMRLDPUQLL-MLGOLLRUSA-N 380.797 5.199 30 20 GKED C[C@H](N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(-c2cccc(C#N)c2)cc1 815615376 OPJXJOYCWPSZQB-HOTGVXAUSA-N 386.455 5.127 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)C(=O)N1c2ccccc2Sc2ccccc21 913615448 YSIWGJSLMDIFMN-AWEZNQCLSA-N 389.505 5.263 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3c(s2)CCCC3)cc1 916948500 WDOFVOBWFDGCHN-KSSFIOAISA-N 380.513 5.102 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cn(CC)c3ccccc23)cc1 916955827 VDGPKKZQOZTYHH-OXQOHEQNSA-N 387.483 5.136 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 917119370 ASJWXGAXTGZEJK-OAQYLSRUSA-N 386.499 5.163 30 20 GKED CCCC(=NNc1ccc(CC(=O)O)cc1)c1ccc(Oc2ccccc2)cc1 1776084983 BSCAGSAWYKCPGL-UHFFFAOYSA-N 388.467 5.722 30 20 GKED Cc1ccc(-c2cccc(/C=C\C(=O)c3cccc(O[C@H](C)C(=O)O)c3)c2)cc1 1777429695 INVIEPOUGJEQNK-DEQJRXDXSA-N 386.447 5.410 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1ccccc1Oc1ccccc1 15320228 RZKMQNRDCULOIC-UHFFFAOYSA-N 389.480 5.145 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)cc1)=C(/S)Nc1ccccc1F 22696089 TUWJVPDOIGHZNU-UHFFFAOYSA-O 393.507 5.035 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)Nc1ccc(C(C)C)cc1C(C)C 27138236 UNPAVAVYWIOGHA-UHFFFAOYSA-N 380.536 5.232 30 20 GKED Cc1ccc[n+](/C(C(=O)c2cc(C)c(C)cc2C)=C(/S)NC2CCCCC2)c1 27461848 KHPRQGRLLKZPLI-UHFFFAOYSA-O 395.592 5.069 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1C 41541299 URJZKCBQZGCWCV-FQEVSTJZSA-N 394.430 5.166 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2ccccc2n1C(F)F 41558372 IYTATAQJQMGFPM-CQSZACIVSA-N 395.340 5.321 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 47375919 WZTLPKQXKLNDES-HNNXBMFYSA-N 391.496 5.079 30 20 GKED N#Cc1ccc(NC(=O)c2cccnc2SCc2ccc(F)cc2)cc1Cl 59250156 LBSRWAGKJSXFME-UHFFFAOYSA-N 397.862 5.290 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 69572852 INOVSOTVOZCUEK-KRWDZBQOSA-N 389.455 5.150 30 20 GKED CCN(C(=O)Nc1ccc(F)cc1OCC#N)[C@H](C)c1cc2ccccc2o1 135301092 WJGQBCYYCQKCES-CQSZACIVSA-N 381.407 5.089 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cc2)n1 156117968 LVMPNCMYYSVGDA-UHFFFAOYSA-N 398.513 5.144 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cccc(-c3csc(C)n3)c2)cc1 173051641 KTEPYVRTXIYYAL-UHFFFAOYSA-N 391.496 5.078 30 20 GKED CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C1 247309274 JPVGIJGXUXXFNV-BZUAXINKSA-N 377.579 5.124 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC(C)(C#N)CC1 272449438 AQAPBUGMPDEIPO-SFHVURJKSA-N 377.488 5.293 30 20 GKED N#Cc1ccc(N[C@@H](c2cccc(F)c2)c2ccccn2)c(Br)c1 301880296 JVKPDZFJUIGUGJ-IBGZPJMESA-N 382.236 5.056 30 20 GKED OC(=Nc1ccccc1OC[C@@H]1CCCCO1)N1[C@H]2CC[C@H]1c1ccccc12 329792354 VCCQZGWANWHZSM-NDXORKPFSA-N 378.472 5.072 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Nc2nc(C)cs2)CC1 373699523 ISXRPTCEFWYLLT-UHFFFAOYSA-N 398.576 5.412 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1CCC[C@H](F)C1 424799384 JNJFUOABPATARQ-KWCYVHTRSA-N 385.323 5.343 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(-c2nc(C3CC3)no2)cc1 433528710 FJITXOKXMUDMFE-UHFFFAOYSA-N 399.903 5.157 30 20 GKED C=CCN(CC=C)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 438376785 SWURYGIYWHDUHH-UHFFFAOYSA-N 380.382 5.269 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 443651807 JUTRURBJIGNHSD-QGZVFWFLSA-N 377.463 5.148 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1[C@H](NCCCCC(C)(C)C#N)C(F)(F)F 444686267 CMAVCSDYKFGRQX-IBGZPJMESA-N 392.469 5.402 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c(F)c1 445794470 JZVGVKKHUZHVEZ-UHFFFAOYSA-N 397.812 5.354 30 20 GKED COc1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc(OC)c1C(C)C 455112883 SCPVJWUNLSJMAV-LJQANCHMSA-N 395.503 5.384 30 20 GKED Cc1ccc(CC[C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)o1 460520571 NUDZQRAVJSSRSP-MRXNPFEDSA-N 390.508 5.362 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCc3c(F)cccc32)cc1 461744346 DJJUTKLBBDAEKV-UHFFFAOYSA-N 388.467 5.193 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1CCC(F)(F)F 464836058 JFVSEHRNSROAOC-UHFFFAOYSA-N 394.462 5.510 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)c1cn(CCCC#N)c2ccccc12 468884613 IKGZJILCMRPMAZ-UHFFFAOYSA-N 377.463 5.135 30 20 GKED C=CCN(C(=O)c1cc(C)c(CC)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 471081372 OSRIEKQFWNYLGS-UHFFFAOYSA-N 397.456 5.015 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 471663715 QZVDOKKFBHIZES-IBGZPJMESA-N 376.422 5.468 30 20 GKED COCCCC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1 472464058 NLPHEMFDVMUXHE-HSZRJFAPSA-N 393.531 5.036 30 20 GKED Cc1sc(NC(=O)C[C@H](CC#N)c2ccccc2)nc1-c1ccc(F)cc1 475104003 OJTQLAXKVFXTMH-KRWDZBQOSA-N 379.460 5.284 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(C(F)(F)F)cc1 476171095 YZABQXPCXBNICM-UHFFFAOYSA-N 377.406 5.575 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccc(F)cc2)o1)c1nccc2ccccc12 483203191 QJSLVEWBIXECRY-FQEVSTJZSA-N 386.382 5.036 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@]2(c2ccccc2)C(F)(F)F)cc1 484142127 KZKPBFFQUDUQIF-OAQYLSRUSA-N 386.417 5.182 30 20 GKED C[C@H](NC(=O)C1(C#N)CCCCC1)c1ccc(OCc2ccc(F)cc2)cc1 485559100 CWCMZPOBCMDUDF-KRWDZBQOSA-N 380.463 5.056 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1ccc(F)cc1C(F)(F)F 488434685 JUTPCJZSPBQVGM-UHFFFAOYSA-N 383.307 5.230 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@H]2c2ccsc2)c1 498346854 YBQYGYAMVLBSLP-QFIPXVFZSA-N 388.492 5.176 30 20 GKED CC[C@@H](CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC)cc1 502052457 YCHWFXDRENQYKH-SJORKVTESA-N 382.529 5.469 30 20 GKED C=CCC[C@H](NC(=O)[C@H]1CCO[C@H](CCC)C1)c1ccc(C(F)(F)F)cc1 503630242 QVNJTZYPTITRSB-UHOSZYNNSA-N 383.454 5.424 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)c1 506046293 UGOGRVUFAZYGDG-GOSISDBHSA-N 384.913 5.123 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC[C@@H]2CCCCO2)cc1Cl 506365834 XSUYVGSNROSRSL-ICSRJNTNSA-N 397.906 5.076 30 20 GKED N#CC1CCC(CNC(=O)[C@@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)CC1 508367383 KNAVNUJHXMXFER-WRTAMHFCSA-N 384.951 5.135 30 20 GKED C=C(C)CCc1noc(Cc2ccc(NC(=O)c3cc4ccccc4o3)cc2)n1 508625207 JRPQUWZPGDWNAX-UHFFFAOYSA-N 387.439 5.168 30 20 GKED CCOc1ccc2nc(-c3ccc(NC(=O)NCCCCC#N)cc3)sc2c1 510019390 NHRQNKIUBJTURN-UHFFFAOYSA-N 394.500 5.177 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc4ccccc34)n2)cc1 512488502 JBKCVERUVQSTDW-FQEVSTJZSA-N 384.460 5.462 30 20 GKED CCc1csc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 513230203 MITNRXVWIPPNLX-UHFFFAOYSA-N 397.887 5.204 30 20 GKED Cc1cc(-c2csc(NC(=O)CCCCOc3cccc(C#N)c3)n2)c(C)o1 517653641 YIWCXWXNTCMQQH-UHFFFAOYSA-N 395.484 5.079 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1cccc(Cl)c1 518685111 ZVZVGUXJSNLWRM-GJZGRUSLSA-N 387.936 5.817 30 20 GKED N#CC1(NC(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)CCCC1 519111348 QAKFQMNMFGKRFL-UHFFFAOYSA-N 381.545 5.132 30 20 GKED CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 520940962 AVWZSRHCWXOVPR-QAPCUYQASA-N 395.528 5.289 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 521185895 VZBVCXSUMINNPD-UHFFFAOYSA-N 389.373 5.202 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)NCc1cc(C)cc2c(C)c(C)[nH]c12 522805654 JWELONZGGQUQQT-UHFFFAOYSA-N 379.479 5.130 30 20 GKED CC(C)(C#N)C(=O)Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1 523175055 DNYZZJHZSXXOFP-UHFFFAOYSA-N 393.434 5.118 30 20 GKED CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(C#N)cn1 523306639 AEODJJZRXFJJCM-JOCHJYFZSA-N 391.421 5.025 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523878171 DGWCDJRYNBJUSX-AWEZNQCLSA-N 380.831 5.430 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3c(cccc3C(F)(F)F)C2)cc1 528903818 XYHATDCFFZAWCY-UHFFFAOYSA-N 387.405 5.097 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccccc12 530725787 ZRFORXNSJPLIGS-ZJSXRUAMSA-N 381.479 5.024 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nc2ccccc2n1C 543033538 FPMOGCQROYOKKV-MSOLQXFVSA-N 380.495 5.524 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3OC(F)(F)F)c2)cc1 554873640 OKAJUHXENZAIJK-UHFFFAOYSA-N 397.356 5.453 30 20 GKED N#CCCC[C@H](NC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 559861214 YXLHWRFUMUFQCX-QHCPKHFHSA-N 381.951 5.329 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)c2cccc(-c3csc(C)n3)c2)cc1 562322989 GDBHETYKJYQKRE-OAQYLSRUSA-N 375.497 5.018 30 20 GKED Cc1cc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)ccc1Br 566880652 WEERCUHWHHKUEB-HNNXBMFYSA-N 382.261 5.048 30 20 GKED CCc1ccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 567307705 RBECGQGBWYVVLU-MRXNPFEDSA-N 384.570 5.515 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 568928793 FKNCKKWTKHXJMN-UHFFFAOYSA-N 391.421 5.123 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC(C4CCC4)C3)cc2Cl)cc1 578310415 VTRIMRZSATYJID-UHFFFAOYSA-N 381.863 5.268 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)C1CCC(O)CC1 578872111 MJVYKWSNGGLWEY-UHFFFAOYSA-N 392.499 5.175 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccc(Oc3cccnc3)cc2)no1)c1ccccc1 582451914 ILFLREZQZZKCHJ-IBGZPJMESA-N 382.423 5.164 30 20 GKED Cc1cccnc1/C=C\C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 588452840 BLAIVIPGFACGIJ-VURMDHGXSA-N 391.418 5.067 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)CCCCCC#N)cc1 588879705 FHXSUKZGPFLQHW-UHFFFAOYSA-N 391.515 5.649 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(C(F)(F)C(F)(F)F)cc3)CC2)c1 588924721 SADYSCNGTFELQH-UHFFFAOYSA-N 398.306 5.022 30 20 GKED CO[C@@]1(C)CCCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CC1 590856111 QWUBDJQXZBVSTJ-QFIPXVFZSA-N 395.528 5.132 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N1Cc2cccc(C#N)c2C1 593890972 KOICJATTWFQBCB-UHFFFAOYSA-N 389.524 5.059 30 20 GKED CC(C)(C)c1cc(CCC(=O)N2CCC[C@@H](CC#N)C2)cc(C(C)(C)C)c1O 597919219 XJUQEXOWGBLZHU-KRWDZBQOSA-N 384.564 5.072 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3c(F)ccc4ccncc34)c2C#N)[C@H](C)C1 598840739 ZDGICWBINPEJOZ-VXGBXAGGSA-N 379.460 5.245 30 20 GKED N#CC1(c2ccc([C@@H]3Nc4ccccc4C(=O)N3Cc3ccccc3)cc2)CC1 602759589 MZKRJZVRIVPOSO-HSZRJFAPSA-N 379.463 5.008 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3coc(-c4ccccc4)n3)n2)cc1 606754553 WQBNYCDCWVEZFA-KRWDZBQOSA-N 385.448 5.264 30 20 GKED C=CCCCCCN(C)C(=O)c1cnn(-c2cccc(C)c2)c1C(F)(F)F 606817261 VSHLAGSKFXXXLS-UHFFFAOYSA-N 379.426 5.018 30 20 GKED CCc1c(C)sc(NC(=O)C(C)(C)c2ccc(Br)cc2)c1C#N 609032466 JGXLQMGHNVZNJC-UHFFFAOYSA-N 391.334 5.169 30 20 GKED CC(C)C[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccs1 609501127 QXMYGXHKJHXYDT-IBGZPJMESA-N 391.496 5.324 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cccc(Oc3nccs3)c2)cc1 609911824 ZEHUGBBSDDTHTN-LJQANCHMSA-N 391.496 5.228 30 20 GKED C[C@H](NC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F)c1cccc(C#N)c1 610324633 OCHNJFYJXLPVFA-NSHDSACASA-N 397.784 5.035 30 20 GKED CCCN(CC(F)(F)F)C(=O)c1ccc(Sc2ccccc2C#N)cc1 610497662 CAZLMTVXDKKTSF-UHFFFAOYSA-N 378.419 5.124 30 20 GKED CN(C)Cc1ccc(-c2ccccc2CN[C@@H]2CCCc3cc(C#N)ccc32)cc1 611390955 XFGQVRJRGQRSTA-HHHXNRCGSA-N 395.550 5.454 30 20 GKED Cc1cccc2sc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c(Cl)c12 613292706 PUQZYNPHVGMTJZ-AWEZNQCLSA-N 376.868 5.901 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)CCC2)c1nc2cc(C(F)(F)F)ccc2s1 613403290 FJYCWIDAFKBIHS-HNNXBMFYSA-N 386.398 5.294 30 20 GKED C=CCN(CC=C)C(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 614212142 KYCGUSUWNQDYIQ-UHFFFAOYSA-N 395.553 5.274 30 20 GKED O=C(Nc1cc(Cl)ccc1F)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618538316 IZCRCOVAFAMOIC-HTQZYQBOSA-N 392.702 5.074 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](Cc2ccccc2)c2cccs2)cc1Cl 619770246 NDFFVTNPCIGEDV-LJQANCHMSA-N 395.915 5.056 30 20 GKED Fc1cc(-c2noc([C@H](C[C@@H]3CCCO3)C(F)(F)F)n2)ccc1C(F)(F)F 650533139 MJTHYCYXZZOFNO-ONGXEEELSA-N 398.278 5.110 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 726876357 OYRITOUNPBPMMF-PLNGDYQASA-N 384.477 5.583 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccccc3)cc2Cl)c1 727978774 PMUSVJQTPWOSLV-UHFFFAOYSA-N 393.899 5.600 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)COC3CCCCC3)cc2Cl)c1 727998796 DAQCXGDEJBAMGU-UHFFFAOYSA-N 398.890 5.078 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1sccc1Br 728440120 JFFLQRWTTJOSJG-ARJAWSKDSA-N 382.329 5.592 30 20 GKED N#C[C@@H](C(=O)c1sccc1SC(F)F)c1nc2ccccc2n1C(F)F 730689629 IBVQDWUFJJINMD-QMMMGPOBSA-N 399.394 5.298 30 20 GKED CCn1cc(/C=C/C(=O)c2ccc(-c3ccccc3Br)s2)cn1 732531357 YCCGZDCUESWMEI-BQYQJAHWSA-N 387.302 5.290 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2sc3cc(C)ccc3c2Cl)c1 733775445 VKQPRJBSGLYWBM-OAHLLOKOSA-N 398.915 5.474 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@]3(CC=CCC3)C2)cc1 734059582 BBIFFROZIIJBSX-ILBGXUMGSA-N 385.511 5.696 30 20 GKED CCOC(=O)Cc1ccc(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)cc1 734305483 ALXIOBCFVHROSH-OUKQBFOZSA-N 391.492 5.120 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 738896320 OCBOJWCOCNWBOJ-CJFMBICVSA-N 397.522 5.745 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1cnn(-c2cccc(Cl)c2)c1C 739422048 RMHNMMYQDNVIIN-UHFFFAOYSA-N 393.800 5.084 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)s1 742656224 DDHOEVIYKZEPLM-ZQMJAJRESA-N 394.327 5.142 30 20 GKED N#C[C@@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 744010947 UAQDIKXKRXMETE-RTWAWAEBSA-N 379.463 5.156 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 744036918 KARZFBFBDRHGBQ-CRAIPNDOSA-N 378.472 5.394 30 20 GKED N#C[C@H](C(=O)CCCOCc1ccccc1)c1nc2cc(Cl)ccc2s1 748009334 FYNBPFYDPWDHAU-MRXNPFEDSA-N 384.888 5.123 30 20 GKED CCOc1c(OC)cc(C=NN(c2ccccc2)c2ccccc2)cc1OC 750912905 SEVIRBXEZLFACB-UHFFFAOYSA-N 376.456 5.275 30 20 GKED O=C(/C=C/c1cccc(Cl)c1Cl)c1cc(Br)ncc1F 762425318 VTXMTEHFCYKXOE-SNAWJCMRSA-N 375.024 5.186 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1 765041118 WYOCSQTWXUTOSD-JKSUJKDBSA-N 384.907 5.114 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 776033485 JEPPFCMDAHDMQL-IBGZPJMESA-N 394.824 5.502 30 20 GKED C#CCCCCCC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 779887700 NKCZLDNOEQKRPH-UHFFFAOYSA-N 389.326 5.501 30 20 GKED CCOCOc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782969822 YAYUTDUIGMQVQI-IBGZPJMESA-N 386.495 5.449 30 20 GKED C/C=C/C(=O)N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 783557732 HXHGGOUXBHFVBZ-VUDBWIFFSA-N 379.222 5.020 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C/c1ncc(C(F)(F)F)s1)C2 788355990 SSCXOSNASYIHET-WEVVVXLNSA-N 388.208 5.055 30 20 GKED O=c1[nH]ccc2cc(NN=Cc3c(Cl)cccc3Oc3ccccc3)ccc12 789073103 BDZFDMDQIJAQMN-UHFFFAOYSA-N 389.842 5.420 30 20 GKED CCOc1cc(O)ccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 792229218 PGJUHHFPJUCLLY-HXUWFJFHSA-N 387.439 5.090 30 20 GKED CC(C)n1nccc1/C=C1/CC[C@H](C2CC2)/C(=C/c2ccnn2C(C)C)C1=O 794942602 PIKUOWLEMLXSPB-WABRHVHDSA-N 378.520 5.098 30 20 GKED C[C@@H](OC(=O)c1ccc(C(C)(C)C#N)cc1)c1nnc(-c2cccc(Cl)c2)o1 796038199 AQUWYMQXGRRHAW-CYBMUJFWSA-N 395.846 5.109 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797570161 DKZWXVRAHBJWIL-OAHLLOKOSA-N 399.516 5.278 30 20 GKED COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(O[C@@H](C)C#N)cc2)cc1 810170901 CIWVFVCVEQOREN-UQBPGWFLSA-N 386.495 5.060 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1c(F)cc(C(F)(F)F)cc1F 811418792 OZFKNJLWWLBPNX-UHFFFAOYSA-N 383.316 5.142 30 20 GKED C#Cc1cccc(NC(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)c1 819395200 HEPIPMRKAASMII-UHFFFAOYSA-N 376.459 5.373 30 20 GKED Cc1nc(SC2CCCC2)sc1CC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 819736370 FJEWGKRTSLJUQY-HNNXBMFYSA-N 399.585 5.120 30 20 GKED CC(C)(Cc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 838965568 YIWABRZRVURLHJ-OAHLLOKOSA-N 380.797 5.199 30 20 GKED N#C[C@H](C(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1nc(C2CC2)cs1 842941826 SXDPMLYCLJNBJW-PFLCFFIHSA-N 396.821 5.496 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@@H]1Cc1ccccc1)c1nc(-c2ccncc2)cs1 850791577 VZKGZAHEGBTFIC-HSALFYBXSA-N 387.508 5.040 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 854461182 UQECPAZNWBQTFB-MJGOQNOKSA-N 375.557 5.777 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc3c(Cl)nccc3o2)ccc1OC 866297364 VBVLLZCGFVRIBT-HIFRSBDPSA-N 399.878 5.022 30 20 GKED Oc1nc2ccccc2cc1/C=N\C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914702725 KGCUDVAEADFBKW-KSBCRRNFSA-N 390.327 5.269 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(-n3cccc3)c2)cc1 915085698 AKJCUGSVQYJVDM-DEOSSOPVSA-N 377.447 5.385 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)cc1OC 916137729 PHBWIKNXKSEPRO-CSKARUKUSA-N 391.448 5.470 30 20 GKED O=C(/C=C\c1cn2cc(Cl)ccc2n1)c1ccc(N2CCCCC2)c(F)c1 920754311 BLTVCEFKHOCHRN-VURMDHGXSA-N 383.854 5.013 30 20 GKED O=C(O)c1ccc(NN=C2CCCCC[C@H]2c2ccccc2C(F)(F)F)cc1 1776013459 XTAZDPFIRPQXMA-KRWDZBQOSA-N 390.405 5.919 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1sc2ccccc2c1C(=O)O 1776021142 CMRXTXWNNSFPEP-UHFFFAOYSA-N 396.497 5.057 30 20 GKED Cc1ccc(NN=Cc2cccc(OCc3ccccc3C(=O)O)c2)c(Cl)c1 1776060716 KLGSUYUYKNPFEO-UHFFFAOYSA-N 394.858 5.372 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)ccc1F 1776062166 HRVFUWFAPKCZEU-AWEZNQCLSA-N 380.341 5.278 30 20 GKED CC(=NN[C@H](C)c1ccc(C(C)C)cc1)c1oc2cc(C)ccc2c1CC(=O)O 1776105716 CBRDEMHFWYZPTH-MRXNPFEDSA-N 392.499 5.567 30 20 GKED O=C(O)c1cc2c(/C=C/C(=O)c3cccc4ccccc34)c(F)ccc2s1 1776114753 ZUKKMCAMIIEKRP-CSKARUKUSA-N 376.408 5.788 30 20 GKED C=CCOc1ccc(/C=C/c2nc3ccccc3c(C(=O)O)c2C)cc1Cl 1776184155 NGZVAOGLUWOBFM-CSKARUKUSA-N 379.843 5.630 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1Cl 1776354491 FNLATMWGJLNRAB-ZZXKWVIFSA-N 384.815 5.468 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(OCc2ccccc2)c1 1776784052 VCLLVQRXEUAUPB-JOCHJYFZSA-N 383.532 5.559 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)oc2ccccc12 1776956091 BHQTWFSIFQYKAV-CXUHLZMHSA-N 396.442 6.257 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)cc1C(C)(C)C 1777360998 GQBDDEAXMKBZCF-NTUHNPAUSA-N 396.483 5.132 30 20 GKED Cc1ccc(-c2ncc(/C=C3/CCCc4cc(C(=O)O)ccc4C3=O)s2)o1 1777431439 KFHBWACYYFBGTD-UVTDQMKNSA-N 379.437 5.012 30 20 GKED C[C@H](C#N)Sc1nnc(-c2ccc(Br)cc2)n1C1CCCCC1 6455478 BFLTVXNVHKXJDR-GFCCVEGCSA-N 391.338 5.217 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2ccccc2)c(C)c1 10168993 NYCOVEVGFXNNJZ-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(F)c(Cl)c2)c1 10756039 DGYUAPPYUMDQLG-UHFFFAOYSA-O 399.898 5.126 30 20 GKED C[C@@H](N[C@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccccc1C#N 12667580 GPNABHVLBWBPNN-HYBUGGRVSA-N 397.522 5.239 30 20 GKED Cc1csc(SCc2ccc(C(=O)Nc3ccc(CC#N)cc3)cc2)n1 17641943 QQZVZXVBDBBSFU-UHFFFAOYSA-N 379.510 5.062 30 20 GKED CCC(=O)Nc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 56470406 JWPWMSDNQKUMPI-UHFFFAOYSA-N 399.450 5.260 30 20 GKED C=C(C)COc1cc(/C=C(/C#N)C(=O)c2c[nH]c3cc(C)ccc23)ccc1OC 60790650 XXLKCXCZWRGILI-ZDLGFXPLSA-N 386.451 5.230 30 20 GKED CCN(Cc1csc(-c2ccc(OC)cc2)n1)[C@H](C)c1ccc(C#N)cc1 65432893 WORWVIPMQCJWQZ-MRXNPFEDSA-N 377.513 5.273 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2[nH]c3ccccc3c2Cl)cc1 65852660 OIEQSJSOOCYYIR-UHFFFAOYSA-N 387.826 5.738 30 20 GKED CCc1c(C)sc(NC(=O)c2cccc(NC(=O)c3cccs3)c2)c1C#N 68677835 JGEDIYJNKWSQEP-UHFFFAOYSA-N 395.509 5.057 30 20 GKED COc1ccc(CC[C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108528680 NFEOJDQOSSICMK-IRXDYDNUSA-N 397.544 5.090 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108531343 LKIPQARYKXPTEN-KRWDZBQOSA-N 390.512 5.030 30 20 GKED CC1=NN(c2ccc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc2)CC1 120056736 AFZUFYCGHVHCNB-MRXNPFEDSA-N 394.887 5.026 30 20 GKED CC[C@@H](SC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156556931 CTCQKXCTZLIRIY-SMDDNHRTSA-N 385.341 5.435 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(Cl)s1 175109487 IDVJEYOPXUYEAE-SWLSCSKDSA-N 382.872 5.006 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C/C=C/c1cccc(F)c1 175967964 QQBLDPILRGNBTN-ZZXKWVIFSA-N 387.414 5.235 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(CCC(F)(F)F)CC1CC1 175997037 JEIQWTFOHYZJNN-ZDUSSCGKSA-N 385.455 5.135 30 20 GKED C[C@H](C#N)Oc1ccc(CNCCc2csc(-c3ccc(Cl)cc3)n2)cc1 179049064 UAABOFPWSINWNM-OAHLLOKOSA-N 397.931 5.087 30 20 GKED COc1ccc(/C=C(\C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1F 183871401 ZBPLGDNHCWTNJP-OKFGHLOFSA-N 384.476 5.271 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Br)c1Cl 189908011 WSWWBNYECGEBPG-UHFFFAOYSA-N 392.724 6.207 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)CCc1ccccc1 216758435 GVZUAGAZNCYSTM-UHFFFAOYSA-N 399.494 5.152 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3F)s2)c1 237023215 NLVYNHPXUDIUIG-KRWDZBQOSA-N 380.488 5.525 30 20 GKED C[C@H]1C[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 245559264 BLSUWNJTXLNJFY-ZDUSMZPESA-N 397.906 5.073 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCSc1ccccc1Cl 303395542 PNMJQIMIZSYNDF-CQSZACIVSA-N 390.961 5.713 30 20 GKED Cc1ccccc1N=C(O)[C@H](C)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 329227549 ADAUSTWNXCSBNW-PKOBYXMFSA-N 395.551 5.017 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 429370424 HCGBPUXVNQUTSX-ZFWWWQNUSA-N 397.525 5.081 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)C1 430152718 XGVIBCYAQCZLAV-DLBZAZTESA-N 394.931 5.431 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc2nc(C3CC3)oc2c1 431154668 ZYIGJRYVZJYQDH-ICSRJNTNSA-N 386.455 5.009 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCc2ccc(F)cc21 432079052 QZRXKVXMFKAQRT-KSSFIOAISA-N 383.492 5.419 30 20 GKED CC(C)(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 432238731 ULNYHPRGVBCVHG-GOSISDBHSA-N 376.481 5.477 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H](c1ccccc1)C1CC1 433157293 LWVAVISAPHRFDU-APWZRJJASA-N 379.529 5.396 30 20 GKED Cc1ccc(Cl)c(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1C 434016866 PBYADUQCBSHEMT-UHFFFAOYSA-N 380.831 5.253 30 20 GKED CCS[C@H]1CC[C@H](N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1 437108951 PMMXMFMFVZMABG-SFTDATJTSA-N 379.529 5.048 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2nc(C(C)(C)C)sc2c1 438632300 LBCUVNCAVWWXAY-UHFFFAOYSA-N 378.501 5.129 30 20 GKED CCSCC[C@H](C)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 440615794 CNGMVKWYJBKBEY-HNNXBMFYSA-N 386.492 5.093 30 20 GKED N#CC1CCC(CNC(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CC1 440992376 SOTIYKSEMCCYJS-UHFFFAOYSA-N 392.330 5.122 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)S[C@@H](C)c1cccc(C#N)c1 443158785 PTMZFEKJCXZXKI-KBPBESRZSA-N 388.920 5.350 30 20 GKED CC[C@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 447596774 DGBUBDYVQFYUSZ-NRFANRHFSA-N 379.479 5.779 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2cccc(CC#N)c2)ccc1Br 455907706 PNLNJWRNDCFBJN-IBGZPJMESA-N 398.304 5.193 30 20 GKED C=CCn1c(S[C@@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1ccccc1F 463030822 ATNJHUICYWGUQC-ZDUSSCGKSA-N 384.436 5.032 30 20 GKED N#C[C@@H]1N(C(=O)c2cc(-c3ccccc3)ccc2Cl)CCC[C@]12CCCCO2 468119978 JTTDXOWEROKNHA-JTHBVZDNSA-N 394.902 5.074 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)[C@@H](Oc1ccccc1C#N)C(C)C 475919502 MGJATMXAWPFONE-LPHOPBHVSA-N 399.560 5.070 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 476492532 RIIWDEJYQXYDCG-UHFFFAOYSA-N 397.935 5.405 30 20 GKED CCc1nc2c(s1)[C@H](N(C)C(=O)c1sc3ccc(C#N)cc3c1C)CCC2 477651437 ZUMCAWBFTTWBFX-MRXNPFEDSA-N 395.553 5.250 30 20 GKED C=CCn1c(SCc2ncc(Cl)s2)nnc1-c1cccc(Cl)c1 478855156 ZOZFPNFDZXMOJP-UHFFFAOYSA-N 383.329 5.187 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1OCCCOC 480838487 NEFBKRSSKADQIR-UHFFFAOYSA-N 394.924 5.037 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3F)o2)nnc1-c1cccs1 481391003 NGEUYKLZUZKECJ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED N#C[C@@H](C(=O)c1cnc2ccccc2c1C(F)(F)F)c1nccc2ccccc12 483234661 VTUXWRKXXJGDSP-MRXNPFEDSA-N 391.352 5.292 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)c(F)c2)nnc1-c1ccc(F)cc1 497688131 ZXSLXAGRBZGNHA-GFCCVEGCSA-N 375.419 5.402 30 20 GKED CN(CCCC1(C#N)CCOCC1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 499619837 OCAQBEUCAMJFOF-PMACEKPBSA-N 394.481 5.374 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)C[C@@H](C)C2 509230234 REJNGZKQGGTYNY-FBKQIBBUSA-N 395.506 5.343 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 510059125 XMHRFJSNBLVRFL-JXFKEZNVSA-N 381.907 5.649 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](CC)c2ccccc2OC(F)F)c1 510735090 MDKVDUXIWRQPQK-KRWDZBQOSA-N 376.403 5.126 30 20 GKED CC[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 513657135 BWSQMHPPGSSBAI-RTBURBONSA-N 378.472 5.193 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(C(F)(F)F)cc1 518243172 QTRBUOBKTIFUGG-CYBMUJFWSA-N 394.418 5.117 30 20 GKED N#CC1(NC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)CCCCC1 522886047 OWUGCHTUSJXVLH-UHFFFAOYSA-N 380.300 5.073 30 20 GKED CC(C)(C#N)CCSc1nc2ccccc2c(=O)n1CCC1=CCCCC1 525503624 KQQIHRORDMGWNV-UHFFFAOYSA-N 381.545 5.319 30 20 GKED C[C@@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 525544894 ZWZHCADLBATXIV-JTQLQIEISA-N 393.302 5.996 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)N2CCC(Oc3ccc(C#N)cc3)CC2)cc1 525944848 VOKVVRRTIVVRKV-IBGZPJMESA-N 390.527 5.245 30 20 GKED C=C[C@@H](CC(=O)N(Cc1csc(C)n1)c1ccc(F)cc1)c1ccccc1 534000369 KMWZNFDZUZCAGH-KRWDZBQOSA-N 380.488 5.484 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cnc(-c3ccccc3)s2)cc1 536892246 CVVVJCUJYOGXMU-UHFFFAOYSA-N 381.504 5.639 30 20 GKED C[C@](NC(=O)c1ccccc1C(F)(F)F)(c1ccc(F)cc1)C(F)(F)F 541009669 FBODAXCCPQTCNS-HNNXBMFYSA-N 379.275 5.052 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 554735845 YDYNODNZDMSGJI-YJYMSZOUSA-N 398.293 5.101 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Br)c(Cl)c1Cl 558405487 UQGYPLLDLGKWAV-UHFFFAOYSA-N 384.060 5.188 30 20 GKED N#Cc1ccc(CNc2cccc(NC(=O)c3ccoc3)c2)c(C(F)(F)F)c1 569630522 QWTFXHJLYWWGKL-UHFFFAOYSA-N 385.345 5.034 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1SCCc2sccc21 570908719 KTGLMKOPAWZLCO-NRFANRHFSA-N 390.533 5.184 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@@H]1c1cccs1 574945207 WXIXUNZXLNDKPI-GOSISDBHSA-N 387.512 5.082 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 578413732 JXANJYWMOGNGCS-OAQYLSRUSA-N 386.451 5.048 30 20 GKED COc1ccc([C@@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)cc1 578638039 NKSVNYDEPHORLT-DNQXCXABSA-N 388.898 5.587 30 20 GKED CSCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 603836611 NEIFVZDVSXZHMH-QGZVFWFLSA-N 398.940 5.817 30 20 GKED CC(C)CN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccccc1 609388425 CATSYQIREBSZBK-IBGZPJMESA-N 395.572 5.178 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCc2ccccc2C1 609773128 YFPJEECRFKCCFV-IRXDYDNUSA-N 379.529 5.007 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3scnc3-c3ccccc3)c2)cc1 609988170 OIHMBODZHSQUHH-UHFFFAOYSA-N 396.475 5.678 30 20 GKED Cc1n[nH]c(C)c1[C@@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 612280461 MHMKCJVOXYTREW-YJYMSZOUSA-N 392.890 5.078 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)C1 612370317 QVYLRWOIOOENJR-HSZRJFAPSA-N 387.508 5.243 30 20 GKED COc1cc(Br)ccc1[C@H](C)NCc1ccc(C(C)(C)C#N)cc1 615811487 NZXLKNXIYZEZCG-AWEZNQCLSA-N 387.321 5.110 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 620304226 JGMBQUKZXBQOSM-OAHLLOKOSA-N 382.435 5.702 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)C1 661379194 VSBNHLIMXXDLID-IBGZPJMESA-N 383.561 5.233 30 20 GKED O=C(Nc1cc(C(F)F)ccc1Cl)c1cc(F)c(C(F)(F)F)c(F)c1 683209877 NEAQMLWUQAKEGQ-UHFFFAOYSA-N 385.666 5.827 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1sc(C)nc1C 726736822 VGMQFLYZYIALEF-UHFFFAOYSA-N 393.541 5.576 30 20 GKED CCCCOc1ccc(C=NOCc2ncc(-c3ccc(F)cc3)o2)cc1OC 727436728 HWIYQKZHEKRVQI-UHFFFAOYSA-N 398.434 5.219 30 20 GKED Cc1csc(SCc2ccc(C(=O)N(CCC#N)CCC(C)C)cc2)n1 728871112 IKWIUUWXTYNVQY-UHFFFAOYSA-N 387.574 5.146 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(OCC(C)C)cc2)S1 730151300 JWNWOPKCBBZRDM-XDHOZWIPSA-N 380.513 5.230 30 20 GKED CC(C)(C)Cc1nc2cc(NC(=S)Nc3ccc(C#N)c(Cl)c3)ccc2o1 731160001 KGMZOFYRFDIPSD-UHFFFAOYSA-N 398.919 5.750 30 20 GKED O=[S@](Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1)c1ccccc1 734366099 FEQDNMOVQDUPKI-MUUNZHRXSA-N 385.488 5.604 30 20 GKED C=CC[C@H](NC(=O)N[C@H](Cc1ccccc1)c1sccc1C)c1ccncc1 737048537 VYGYPONBLXWDKM-LEWJYISDSA-N 391.540 5.352 30 20 GKED N#Cc1c(NC(=O)c2sccc2-c2ccc(F)cc2)sc2c1CCCC2 748605675 UEUQRSLCKMWRRV-UHFFFAOYSA-N 382.485 5.618 30 20 GKED CC(C)c1ccc(-c2ncc(COC(=O)Cc3ccc(C#N)cc3)s2)cc1 750247302 PHSPMOQZDOLGAL-UHFFFAOYSA-N 376.481 5.091 30 20 GKED C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1csc2ccccc12 776158186 VGSLKWYVXFLXJJ-KRWDZBQOSA-N 375.541 5.088 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 776743399 HGNUZSKHGKYGKC-UHFFFAOYSA-N 397.503 5.134 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@H](Cc1ccccc1)c1ccccc1 780669621 HKGMCKUGGFYMAG-KNQAVFIVSA-N 399.494 5.125 30 20 GKED O=C(O)c1csc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c1 782199089 DGVWSGIIJIENKU-WJDWOHSUSA-N 391.473 5.480 30 20 GKED CSCCCCCCNC(=O)c1ccccc1Sc1ccccc1C#N 784148340 WRQXBHZZGAHBIF-UHFFFAOYSA-N 384.570 5.363 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3c[nH]c4ccccc34)n2)cc1 786306672 ABKGAAYSQXHHLX-VQIMIIECSA-N 399.519 5.970 30 20 GKED N#C[C@@H](C(=O)COc1ccc(Oc2ccccc2)cc1)c1nccc2ccccc12 792092189 AEXSKHXZBPRGAC-QHCPKHFHSA-N 394.430 5.282 30 20 GKED N#C[C@@H](C(=O)CCc1cnc2ccccc2c1)c1nc2cc(Cl)ccc2s1 796653201 YEQJABAACNKMLE-INIZCTEOSA-N 391.883 5.307 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 796745211 LJTFWCBXNFGJCV-HNNXBMFYSA-N 397.208 5.066 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCCOc2ccccc2Cl)s1 797571774 PUVFPDUEYQVZKB-CYBMUJFWSA-N 376.909 5.129 30 20 GKED CSc1ccc2cc(CN[C@@H](CCCC#N)c3ccccc3)c(Cl)nc2c1 814661179 XDBGCTYQYFGLOJ-FQEVSTJZSA-N 395.959 6.135 30 20 GKED CCOCCCCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 870158184 DMEMLKSFQUEGRG-CYBMUJFWSA-N 384.423 5.088 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 878218040 IQQYXBLMKCJBME-MJGOQNOKSA-N 387.405 5.148 30 20 GKED O=C(/C=C\c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccncc1 916136465 OMYYPNOLDXQLGU-ALCCZGGFSA-N 380.787 5.332 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc3c(c2)CCC3)cc1 919716745 UGMWVJNHYREQMP-QHCPKHFHSA-N 383.520 5.640 30 20 GKED O=C(O)[C@@H](Oc1cccc(C=NNc2ccc(F)c(Cl)c2)c1)c1ccccc1 1776097779 BKUCMIDXLUZKGV-FQEVSTJZSA-N 398.821 5.130 30 20 GKED C=CCOc1cccc(/C=C(/CCCC(=O)O)c2nc3ccccc3s2)c1 1776184822 ZPURRHUVQUUSER-VKAVYKQESA-N 379.481 5.657 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C1/CCCc2cc(C(=O)O)ccc2C1=O 1776200008 JGYSCXWUTFGUDZ-AMHNRXTASA-N 398.405 5.535 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)s1 1776339837 FPXJLIHVGBSBLO-QPJJXVBHSA-N 393.302 5.303 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)C(=O)c2ccccc21 1776526575 RKMBNPGZPVPHSJ-RVDMUPIBSA-N 388.419 5.298 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)CCc3ccc(C#N)cc3)n2)c(C)c1 10441933 GNDDJXVYTDKMTD-UHFFFAOYSA-N 375.497 5.178 30 20 GKED N#Cc1ccc(OCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)c(Cl)c1 18963344 KXNYIMXDAGXSLF-UHFFFAOYSA-N 390.053 5.189 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(COCc2ccco2)c1 47603565 MWBUEPOLVFVKPH-UHFFFAOYSA-N 376.456 5.217 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc(-c2ccccc2)s1 66800307 QYVASICYSBOAKC-CQSZACIVSA-N 379.510 5.457 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3sccc3SC)n2)cc1 107410951 NJTDLGNQYKMRGR-ZDUSSCGKSA-N 386.523 5.092 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CCC(F)(F)F)c1 124387843 WFHPJMAYJGDNQX-UHFFFAOYSA-N 389.421 5.496 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 150968498 CNVXHCOBAOAVDZ-FUHWJXTLSA-N 397.519 5.174 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1 159800100 ACJVQHOEUJOAPM-HNNXBMFYSA-N 379.794 5.108 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1c(F)cccc1F 171759148 KZKUBVTZEUUGQA-CQSZACIVSA-N 393.393 5.068 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ncccc3C(F)(F)F)cc2)c1 180096840 GFQTZXZLYVHVFI-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=C(C)[C@H](NC(=O)N(Cc1ccco1)Cc1ccco1)c1ccc(F)c(F)c1 185481541 TYXOVCBMBXUESH-FQEVSTJZSA-N 386.398 5.180 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cc(Cl)ccc3OC3CCCC3)o2)cc1 187398058 UJEVYGGRTOVMPO-UHFFFAOYSA-N 394.862 5.195 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 194102970 OQDSYESYSJXGJW-UHFFFAOYSA-N 383.816 5.101 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 212104114 ITVNLQPSSYTSTN-VURMDHGXSA-N 388.807 5.407 30 20 GKED C[C@@](Cc1cccc(Br)c1)(NCc1ccc(C#N)o1)c1ccccc1 237360242 BKXOQKLOTQIDTD-NRFANRHFSA-N 395.300 5.161 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(Cl)nc1 255003396 KANDBXHPYPTVSH-NTMALXAHSA-N 397.261 5.537 30 20 GKED CC(C)(C)S(=O)(=O)Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1 255057937 MATTWCKIEGROKN-UHFFFAOYSA-N 381.497 5.009 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1)[C@H]1CCCO1 328979310 CUXDAIQYHYTVBG-MJUUVYJYSA-N 384.520 5.517 30 20 GKED Cc1cccc(CN(Cc2ccccn2)C(=O)Nc2ccc(C#N)cc2Cl)c1 426136571 CRHFPNWVCDEPFC-UHFFFAOYSA-N 390.874 5.149 30 20 GKED COc1ccc([C@@H](NCc2cccc(F)c2C#N)c2ccccc2Cl)cc1 427428577 POOJMEUGKBNLNK-JOCHJYFZSA-N 380.850 5.239 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc3ccccc3n2C2CCCC2)c1 430619016 YOSCNLPKPVFEBI-UHFFFAOYSA-N 376.485 5.019 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cc(F)c(Cl)cc1F 432868795 XVEXWUMRKKAYSQ-NSHDSACASA-N 395.862 5.334 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1ccc(Br)s1 443719726 CQWCFQBHWNQHDB-GFCCVEGCSA-N 397.313 5.109 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N[C@@H](c1cc(F)ccc1F)C(F)F 447711628 ZDPJMUMAIMYOPN-HEEBCNDISA-N 385.323 5.146 30 20 GKED C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 452649478 KCOZFDYDFXOGEY-PBHICJAKSA-N 388.389 5.154 30 20 GKED CN(Cc1csc2ccccc12)C(=O)N[C@H](CCCC#N)c1ccccc1 458796858 FJSNGFPOFUAPJD-HXUWFJFHSA-N 377.513 5.478 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1 472233859 ODGMZKZICXQNIJ-ZDUSSCGKSA-N 383.439 5.011 30 20 GKED CC(C)(C#N)CCCN1CCCC[C@@H]1C(=O)Nc1ccc(Cl)cc1Cl 472236467 DXKDVWGYJLLKJH-QGZVFWFLSA-N 382.335 5.116 30 20 GKED CC(C)(C#N)CCCN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 472260845 RLLBZRIMJYLDLB-UHFFFAOYSA-N 394.494 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1 476779447 ZTEZDRJLFITWNL-NRFANRHFSA-N 394.534 5.528 30 20 GKED COc1cc(F)ccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 479528640 PYSKKSWODYFMNE-UHFFFAOYSA-N 378.428 5.109 30 20 GKED C[C@H](CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C(F)(F)F 480278579 NVEOPXLPBAHDDN-LLVKDONJSA-N 397.784 5.324 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1OCC 483218260 GPOOXEIMIMUSRB-FQEVSTJZSA-N 388.467 5.302 30 20 GKED CC[C@@H](C)CN(CC)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 483624440 NSLFDONRQWAQOI-QGZVFWFLSA-N 379.504 5.346 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cccc2c1C[C@H](C)N(C(=O)[C@@H](C)CC(=C)C)C2 486110650 NUKILSSINGZKPH-FHWLQOOXSA-N 382.548 5.103 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 486426548 GFJQRZYAHAWXLE-HNNXBMFYSA-N 377.296 5.266 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)c(C)n2)c(C(F)(F)F)c1 499561522 NNMRIAJDZFDXRJ-LLVKDONJSA-N 393.434 5.423 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 504034297 HQRQFYGUMWLLPV-IERDGZPVSA-N 389.886 5.878 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 505169114 HXNJDBQIROHLGS-UHFFFAOYSA-N 384.932 5.398 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc2c(c1)CCCO2 505968028 NPBPDBGRACBDAS-UHFFFAOYSA-N 386.476 5.287 30 20 GKED N#CC1(CCCSCc2csc(-c3ccc(F)cc3)n2)CCOCC1 507728134 YHFDVDUJNHQUSP-UHFFFAOYSA-N 376.522 5.283 30 20 GKED C[C@@H]1CCC[C@H](N(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 509920361 RMPOZJPQEYEZPC-GCJKJVERSA-N 391.515 5.374 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 510886207 BCZMSWQOANLQKC-UHFFFAOYSA-N 377.469 5.351 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 518000748 VNUVNLODOORLHO-UHFFFAOYSA-N 392.911 5.951 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2coc3ccccc23)cc1 520552811 WGJVSQUUPDXPRU-UHFFFAOYSA-N 396.446 5.259 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c2)C1 521081702 MHPGLBJKMMUQFS-FDDCHVKYSA-N 391.515 5.317 30 20 GKED CC(C)n1cc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cn1 522132853 WQQSOUCNYPXLRC-MRXNPFEDSA-N 389.459 5.011 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(Cl)cc1C(C)C 529246610 WDVSWSSOGLDPEB-UHFFFAOYSA-N 376.884 5.159 30 20 GKED COc1ccc(CNCc2cccc(OCc3cccc(C#N)c3)c2)cc1Cl 531954795 YEBSPPHIRSCMHX-UHFFFAOYSA-N 392.886 5.089 30 20 GKED CSCC[C@@H](C)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 535597768 IEOLMQSKDLKSJT-CQSZACIVSA-N 388.920 5.218 30 20 GKED N#CC1(CCCNc2cc(Cl)ccc2SCC(F)(F)F)CCOCC1 537507652 NQDVOFBFUUPNRP-UHFFFAOYSA-N 392.874 5.507 30 20 GKED CSc1ccc(C)c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 539444954 PKFXXKFBONSIAU-UHFFFAOYSA-N 375.453 5.028 30 20 GKED COc1ccc(CNc2ccc(Br)cc2C)cc1OCCCC#N 539589512 PYHOFCPALFOKRB-UHFFFAOYSA-N 389.293 5.061 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)sc2ccc(C#N)cc12 550847193 QMMGCRFQXJWNPL-CYBMUJFWSA-N 391.521 5.585 30 20 GKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)c1cc(C#N)ccc1Cl 571509232 HFOJNVLXTVXCGX-VXGBXAGGSA-N 380.797 5.152 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)NCc1ccc(C#N)s1)C1CC1 583137566 QPLFJWLXRYORKF-OAHLLOKOSA-N 375.497 5.208 30 20 GKED CC[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 583433699 VJLPWFKLLLMISU-KKSFZXQISA-N 378.476 5.178 30 20 GKED C[C@H](Nc1ncc(C#N)cc1Cl)c1cccc(NC(=O)c2ccccc2)c1 608886099 VJHQITZLRIVGQE-AWEZNQCLSA-N 376.847 5.032 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)Cc1ccc(C#N)cc1 609305194 BQXCMALTQDWYMH-ZDUSSCGKSA-N 395.915 5.064 30 20 GKED Cc1ccc([C@H](NC(=O)c2cccc(CC#N)c2)c2ccc(F)cc2Cl)cc1 609374446 XNBDSIVPBAJKGX-QFIPXVFZSA-N 392.861 5.373 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 610362757 GZEBAEHTAPVPHU-QGZVFWFLSA-N 393.446 5.371 30 20 GKED COc1ccc([C@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccccc2OC)cc1 611394725 ZCFHJVBMHKXWHR-AHWVRZQESA-N 398.506 5.332 30 20 GKED CC(C)(C#N)CCN1CCC([C@@H]2CCCCCN2C(=O)Nc2ccccc2)CC1 611462585 QGJFBXAONAIFTM-QFIPXVFZSA-N 396.579 5.115 30 20 GKED CC(=O)Nc1c(C)ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1C 611492623 XUTZMWCYMFREKZ-UHFFFAOYSA-N 399.450 5.178 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(NCc3ccnc(C#N)c3)cc2Cl)n1 614794140 MRIDAQNSNQQUSB-UHFFFAOYSA-N 399.907 5.160 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(Br)c(F)cc2Cl)cc1 619518619 SISVOSUSFKDGTL-UHFFFAOYSA-N 395.659 5.295 30 20 GKED N#Cc1ccc(CNCc2cc3ccccc3nc2N2CCCCC2)cc1Cl 619748379 JTCYPFKQAAKOEV-UHFFFAOYSA-N 390.918 5.040 30 20 GKED C=CCN(C(=O)Cc1ccc(Cl)cc1Cl)c1nc2c(s1)CCCC2 623331813 SIKQVBUMYKKDPL-UHFFFAOYSA-N 381.328 5.090 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 678759169 OGVSMOFWCLCPQB-KRWDZBQOSA-N 375.497 5.538 30 20 GKED CCOc1ccc(C=NOCc2csc(Cc3ccc(Cl)cc3)n2)cc1 725792445 ZEYQXVGCXWMYCW-UHFFFAOYSA-N 386.904 5.337 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccc(OCC)c(OCC)c2)C(C)C)c1 726452280 USKVJVLSRFIJLL-JOCHJYFZSA-N 396.556 5.149 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)cc1 726945459 SABJYLXXDZDPBC-UHFFFAOYSA-N 397.525 5.144 30 20 GKED CCCCCCCCC/C=C\C(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 727756169 RKACQHLDCZSEMY-YXAHYSCSSA-N 390.612 5.180 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2c(Cl)nc(Cl)n2C)cc1OCCC 728440248 VMHYUWUIWHCAQN-BQYQJAHWSA-N 397.302 5.201 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2sc3cc(C)ccc3c2Cl)cc1 729188849 QOFQAGQJWVXDDU-MRXNPFEDSA-N 396.899 5.387 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](c3cccc(F)c3)C2)cc1 729553760 UHSIXGDDQWRWJJ-URXFXBBRSA-N 399.469 5.503 30 20 GKED C#Cc1cccc(NC(=O)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 730897977 SVYQAKVAXYATLP-MRXNPFEDSA-N 375.497 5.291 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1ccc(Cl)cc1 733081163 PSPCKDLGRVTNOD-UHFFFAOYSA-N 391.784 5.047 30 20 GKED C#CC[C@H](OC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1ccccn1 733692222 BPRBYLLCYGBIDE-JEJOPICUSA-N 379.765 5.075 30 20 GKED CCCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@@H](CC)c1ccccc1 733805054 MZLYNWSLOFDADA-GGAORHGYSA-N 393.531 5.440 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 734644726 UBPDVEUGCJMWJZ-VPHKFGTKSA-N 395.506 5.752 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)cc1 741470558 RPKAMECBVAOJCN-WBNHJWIASA-N 383.447 5.549 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 741640023 VKNVJBVEJRCJDC-UHFFFAOYSA-N 379.818 5.410 30 20 GKED COc1ccc(CN[C@@H](c2ccc(C)cc2)c2ccccc2Cl)cc1C#N 742372941 YITDJPYAMGANJU-QHCPKHFHSA-N 376.887 5.408 30 20 GKED C[C@]1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCc2ccccc2C1 742536626 BHFQUMGJXCVOOP-RSXGOPAZSA-N 380.491 5.476 30 20 GKED CC(C)Cc1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 745765563 FWJFNTGLZDGLKF-IBGZPJMESA-N 375.497 5.249 30 20 GKED C=CCCCC(=O)N1CCC([C@H]2CCCCCN2C(=O)Nc2ccccc2)CC1 748311873 DOVKZPXXIUCKTN-JOCHJYFZSA-N 397.563 5.058 30 20 GKED N#Cc1ccc(NC(=S)Nc2cnccc2-c2cccc(F)c2)cc1Cl 753154685 ABOBPNMAFQESLO-UHFFFAOYSA-N 382.851 5.222 30 20 GKED Cc1nc(/C=C/c2ccccc2C#N)sc1C(=O)/C=C/c1ccccc1C#N 755586178 IISVFICQCJEFTL-DCIPZJNNSA-N 381.460 5.261 30 20 GKED C[C@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 759439675 AJZYJPZEMILDBR-IINYFYTJSA-N 391.279 5.247 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(Br)c(F)c2)c1 767736204 PNXLLJMZWWXBFP-RMKNXTFCSA-N 388.236 5.167 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 770095348 BVTVYCXPQHZEFJ-AVRDEDQJSA-N 378.859 5.168 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)N(CC#N)c2ccccc2)cc1 772085874 LAPVKLBIENPROF-UHFFFAOYSA-N 383.455 5.338 30 20 GKED CCS(=O)(=O)c1c(Cl)cccc1/C=C/C(=O)c1oc2ccccc2c1C 774115080 MZEIAPRKMZWDJA-VAWYXSNFSA-N 388.872 5.084 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ncc(Cl)s2)cc1OCC 774723095 DDWARQOFWMCLMG-UHFFFAOYSA-N 389.304 5.188 30 20 GKED C[C@@H](NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccc(OCC#N)cc1 776154568 UPPXSRQEIUIPJO-QGZVFWFLSA-N 376.431 5.371 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(COC2CCCCC2)c1 780529938 HDTHLHFDCIPQCT-QGZVFWFLSA-N 393.487 5.471 30 20 GKED C=CCCN(OCc1ccccc1)[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F 782665642 YVFHTLJADQLZNH-INIZCTEOSA-N 392.421 5.042 30 20 GKED COc1cc(C2SCCS2)ccc1OC(=O)c1ccc(C(C)(C)C#N)cc1 796537971 AIWZYSPHOQNGAW-UHFFFAOYSA-N 399.537 5.194 30 20 GKED N#CC1CCC(CN[C@@H](Cc2ccccn2)c2ccc(Br)cc2)CC1 799726302 MZIQEBJLAGTMGJ-BPZDKFOGSA-N 398.348 5.047 30 20 GKED CC(C)Oc1cccc([C@H](OC(=O)C[C@@H](CC#N)c2ccccc2)C(F)F)c1 810804480 COOWRUJVWJOQBI-UTKZUKDTSA-N 387.426 5.411 30 20 GKED CC[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433939 WHAABHMZWUZVKT-BEFAXECRSA-N 389.421 5.442 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccccc1C(F)(F)F 845841850 QUIJOMXQEDKJNS-DUVHGLKDSA-N 397.396 5.118 30 20 GKED N#CCCC[C@H](NC(=O)OCc1ccc(Br)cc1)c1ccccc1 859169120 VYDQSVKVQJDROH-SFHVURJKSA-N 387.277 5.110 30 20 GKED Cc1ccc(CO[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 860479069 IPCHZCUQSAKTMA-XJKSGUPXSA-N 384.888 5.040 30 20 GKED C=C[C@H](CC)CC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 901783510 LKWWYOQWCJHWOZ-GFCCVEGCSA-N 380.366 5.092 30 20 GKED COc1ccc2[nH]cc(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2c1 915282776 WRJOTWNDUSJYAK-HSZRJFAPSA-N 395.462 5.013 30 20 GKED N#CCOc1cccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)c1 916410038 SSXLAXZASBDKGE-UHFFFAOYSA-N 397.409 5.196 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C#N)C(=O)CCCC1CCCCC1 916903108 NYDWBPUQFSTKAZ-INIZCTEOSA-N 390.911 5.055 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(O)c(C(=O)O)c2)o1)c1ccc2ccccc2c1 1776131221 LMRPFAMHYZOQKY-DHZHZOJOSA-N 384.387 5.400 30 20 GKED CC(C)c1cccc2c1OC/C(=C/c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1776377867 RCJCCPKLBGVISK-WQLSENKSSA-N 396.439 5.521 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2cccc(C(=O)O)c2)cc1 1776785598 QIADXHZGVNEHCI-DTQAZKPQSA-N 380.484 6.020 30 20 GKED C=CCn1c(SCC(=O)Nc2ccc(Cl)cc2Cl)nc2ccccc21 4492901 LMENRSPBYAWLOH-UHFFFAOYSA-N 392.311 5.260 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Br)cc3)n2)cc1 60477238 FJQDKYZYLGOAEX-MRXNPFEDSA-N 397.297 5.371 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 64714189 JGMBQUKZXBQOSM-HNNXBMFYSA-N 382.435 5.702 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1F 108533497 NDWOEKURAIIPGB-OLZOCXBDSA-N 375.444 5.099 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-c2ncco2)c1 155184214 KYYRGCAOZGKRNZ-UHFFFAOYSA-N 397.459 5.617 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cn2)cc1C 156092664 CHMJSUPDSVRCFL-UHFFFAOYSA-N 390.443 5.032 30 20 GKED CC(C)[C@@H](Sc1cccc(C#N)c1)C(=O)Nc1ccccc1C(F)(F)F 158685274 MNXQNWNWBUTIDD-QGZVFWFLSA-N 378.419 5.332 30 20 GKED Cc1cc(CS(=O)(=O)Cc2ccc(-c3ccccc3C#N)cc2)c(C)s1 178699127 IHHRVBKFHVOHSY-UHFFFAOYSA-N 381.522 5.019 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 180201386 AEIOSOKYAIFRDW-UHFFFAOYSA-N 384.810 5.617 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c1 248981579 FSPLZXKPVIYDKW-UWJYYQICSA-N 390.487 5.002 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1cccc(N2CCCCCC2)c1 328825384 HKJLHYYFXSBEQH-QGZVFWFLSA-N 399.560 5.362 30 20 GKED CCc1nc2cc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)ccc2o1 329422544 FTQBZIKCTURGJS-MRXNPFEDSA-N 392.503 5.485 30 20 GKED CSCc1ccccc1N=C(O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 329518607 NRIWHSQCTWJHOO-LJQANCHMSA-N 384.549 5.074 30 20 GKED Cc1ccc(Br)cc1C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330013709 AEOZSNHVOZLNNZ-UHFFFAOYSA-N 393.325 5.139 30 20 GKED Cc1ccc(/C(O)=N/CC(F)(F)F)cc1N=C(O)N(C)[C@H](C)C1CCCCC1 330450437 XTCPONZCGVIMFO-CQSZACIVSA-N 399.457 5.308 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@H]2C 410973984 IOFUIHYOIPDHOL-HTQZYQBOSA-N 399.463 5.342 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 431958043 YXAVMOXHIGIZDQ-RDTXWAMCSA-N 390.314 5.789 30 20 GKED CC(C)[C@H]1N(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1(C)C 432674098 ZYLUUKHPQNECFC-JOCHJYFZSA-N 391.515 5.230 30 20 GKED C=CCN(C(=O)[C@H]1CCc2ccc(OC)cc21)c1nc(-c2ccccc2)cs1 432713295 IIYMMFWDPFDGOJ-IBGZPJMESA-N 390.508 5.068 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1 433931024 MACWXBKPRWPHOW-MRXNPFEDSA-N 388.492 5.248 30 20 GKED CC(C)[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccnc1 436124307 NDMLTGZJHIQTJV-DEOSSOPVSA-N 399.494 5.105 30 20 GKED Fc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1F 436399966 GWARQLNAEHLGKT-HNNXBMFYSA-N 383.282 5.767 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(COCc2ccccc2)cc1 438362556 DNRRFFJVYSLHRX-UHFFFAOYSA-N 386.495 5.624 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 445795783 RDNQWTLVTXLFDY-HUUCEWRRSA-N 388.533 5.444 30 20 GKED CC(C)n1nc(-c2ccco2)cc1NC(=O)N[C@H](CCCC#N)c1ccccc1 455339101 IWBOKTUMFDXWHV-GOSISDBHSA-N 391.475 5.281 30 20 GKED C[C@@H]1CN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC[C@@H]1c1ccccc1 458799938 KMULUVSDEQAKCT-WTIAFYNJSA-N 375.516 5.257 30 20 GKED CCN(Cc1nnc(-c2cc3c(s2)CCCC3)o1)[C@H](C)c1ccc(C#N)cc1 461394716 ODMGLMQMGHHMDV-OAHLLOKOSA-N 392.528 5.132 30 20 GKED Cc1ccc(-c2cc(CNc3cccc(OCc4cccc(C#N)c4)c3)on2)cc1 462222017 KVWWTXSESQLGLX-UHFFFAOYSA-N 395.462 5.713 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)c2c1 468755264 ACMWMRIQXFQAQB-SFHVURJKSA-N 386.282 5.097 30 20 GKED C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cn(CCCC#N)c2ccccc12 469455924 AKKHBTYJHURNDA-IEBWSBKVSA-N 389.474 5.102 30 20 GKED Cc1ccccc1Cc1nnc(CSc2nc(-c3ccccc3)ccc2C#N)o1 471248325 ATVYRGAAKDFZEP-UHFFFAOYSA-N 398.491 5.195 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)c1ccc(Cl)cc1F 475506164 GMBYLYACGDWZGH-ZDUSSCGKSA-N 390.911 5.647 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 475581724 QNMKOXPERPGKSB-IBGZPJMESA-N 382.935 6.213 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)NCc2nccc3ccccc23)cc1 479515493 RXKYFDIBPCHPFO-UHFFFAOYSA-N 395.487 5.188 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)cc1 479679562 YSHHDLAWCYNJNV-ZWKOTPCHSA-N 388.389 5.129 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)cc1 481914600 AUUMXYLBOHFRDS-UHFFFAOYSA-N 382.423 5.392 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCCCc4cc(C#N)ccc43)ccc21 481998720 LSBOOOWKIMLQCK-QHCPKHFHSA-N 398.510 5.021 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)ccc1OCCC(C)C 483193208 HFGXPIGPLMHOLV-HXUWFJFHSA-N 388.467 5.158 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 486210851 CMXVXIQKWWPDJG-HNNXBMFYSA-N 380.538 5.579 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)N[C@H](CCCC#N)c1ccccc1 487537907 OBGVUPYOSISZDY-NFBKMPQASA-N 376.500 5.057 30 20 GKED C=CCC[C@H](NC(=O)NCC1CC(F)(F)C1)c1ccc(C(F)(F)F)cc1 489774497 TUIIQWSTMXZGRU-HNNXBMFYSA-N 376.369 5.057 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2n1CC(F)(F)F)c1nc2ccccc2s1 489855496 JCZTZIGRURKIFF-ZDUSSCGKSA-N 399.397 5.303 30 20 GKED Cc1ccc(-c2c[nH]cc2C(=O)Nc2cccc(C#Cc3ccccn3)c2)s1 494894210 PXZSBNJUEPLTBJ-UHFFFAOYSA-N 383.476 5.099 30 20 GKED CCN(C(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1)[C@@H](C)c1ccc(C#N)cc1 499288933 WWODUEHKOQVERY-ZRCGQRJVSA-N 384.564 5.623 30 20 GKED CCN(C(=O)CSCc1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 500999019 VIEJVFHNCFXBDW-MRXNPFEDSA-N 378.497 5.147 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)c1 504835050 ILGBTLZGKFNONM-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1sc(Br)c(C(=O)Nc2ccc(OC(C)C)c(C#N)c2)c1C 507458042 WGSSZZLSRYYLLK-UHFFFAOYSA-N 393.306 5.039 30 20 GKED Cn1cc(CNc2cc(Cl)c(F)c(Cl)c2)c(-c2ccc(C#N)cc2)n1 508515497 BWEZKNZWSPTXSK-UHFFFAOYSA-N 375.234 5.017 30 20 GKED CCN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@H](C)c1ccc(F)cc1 510463759 XKKADTXIEXUTIY-GOSISDBHSA-N 376.479 5.186 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510652709 XJXKNEZRULFRGI-UHFFFAOYSA-N 383.451 5.571 30 20 GKED CC(C)[C@H]1C[C@@H](CC(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)CCO1 513690402 XXGFLYCOYSGJHJ-HNAYVOBHSA-N 394.540 5.165 30 20 GKED CSCc1ccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 515195576 LSQAICNBSOXFPF-UHFFFAOYSA-N 389.480 5.169 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 517532865 PWDSCHKLPMLSLI-KRWDZBQOSA-N 379.529 5.586 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCC[C@@H]1c1ccccc1 519062660 VEPOZPSDNZRKLQ-PKTZIBPZSA-N 375.516 5.205 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc(-c2ccccc2)nc2onc(C)c12 520096553 BCSCRGWILPSONL-UHFFFAOYSA-N 397.478 5.069 30 20 GKED COc1ccc(C[C@@H](N[C@@H](C#N)C2CCCCC2)c2ccccc2)cc1OC 522380941 URIGOTSZXBNVCC-YADHBBJMSA-N 378.516 5.050 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccccc2F)CCCC1 534595874 VJHLHVXNVLVZEI-UHFFFAOYSA-N 394.471 5.430 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 535206922 PAUNXSFMDQFJEP-UHFFFAOYSA-N 399.604 5.931 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)c2ccccc2Oc2ccccc2C#N)C1 538663315 ZTWUDBHROGKLIL-ZWKOTPCHSA-N 380.513 5.097 30 20 GKED CC(C)C(=O)N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 542172089 RXWIMDUTZQAVCD-SNVBAGLBSA-N 381.238 5.100 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)c1F 543160666 ORAMMSJLDOMBKO-NRFANRHFSA-N 395.275 5.339 30 20 GKED CN(C(=O)c1ccc(C#N)c(Cl)c1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 547960603 OIUSWJZHLSFICQ-OAHLLOKOSA-N 387.188 5.241 30 20 GKED C=CCCc1ccccc1NC(=O)c1oc2ccc(CCC(C)=O)cc2c1C 548772025 HUCALWGCKRLEMR-UHFFFAOYSA-N 375.468 5.634 30 20 GKED CC[C@@H](C)n1nc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1C 554244920 LUGLQEFUMOFIOW-CYBMUJFWSA-N 390.512 5.114 30 20 GKED C[C@H](CCC#N)Sc1nnc(COc2ccccc2Cl)n1-c1ccccc1 559976473 ASOATPUTMOCPAL-OAHLLOKOSA-N 398.919 5.284 30 20 GKED N#Cc1cccc(C2(NCc3csc(COc4ccc(Cl)cc4)n3)CC2)c1 560072389 UXDRMQQWUZTTSY-UHFFFAOYSA-N 395.915 5.026 30 20 GKED Cc1ncc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(Cl)c1Cl 573052248 XFWWPJFDCROYGA-UHFFFAOYSA-N 399.237 5.008 30 20 GKED C[C@@](C#N)(NC(=O)c1sc2cc(Cl)ccc2c1Cl)C1CCCCC1 577976501 POSFDBGZDKLTDE-SFHVURJKSA-N 381.328 5.800 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 588952534 RPRZRUZQYQBEFD-GAJHUEQPSA-N 385.511 5.092 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1cc(C(F)(F)F)ccc1Br 589317496 PCCLGSDFSULRSQ-KRWDZBQOSA-N 395.222 5.117 30 20 GKED Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)CC3(C#N)CC3)nc2c1 590974972 JWNYNLXOACAJTB-UHFFFAOYSA-N 375.497 5.140 30 20 GKED C[C@H](C#N)N(C(=O)c1oc2ccccc2c1CSc1cccs1)C1CC1 598872210 WLQQCVGFOOGGCZ-CYBMUJFWSA-N 382.510 5.303 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCCC4(CC3)CC4)c2)cc1 599733176 RXKKBHZQQKZWRW-UHFFFAOYSA-N 389.499 5.130 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184619 JBXVKGYFKMYMBH-UHFFFAOYSA-N 389.886 5.189 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 602754910 BDRWOYRTPWHLBW-ZDUSSCGKSA-N 389.524 5.091 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603691684 SVAPBFOGNLWZOG-UHFFFAOYSA-N 392.846 5.063 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)cnn1C(C)(C)C 603751204 OVMGAJMDWMYGBH-AWEZNQCLSA-N 398.576 5.283 30 20 GKED N#Cc1c(NC(=O)c2cccc(Cl)c2Cl)sc2c1CCCCCC2 603996375 LQZBVALCFGAYKA-UHFFFAOYSA-N 379.312 5.838 30 20 GKED COc1ccc(C(C)(C)C)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 608915091 IOTJKXIQJMOARM-UHFFFAOYSA-N 379.504 5.307 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)o1 609461067 XXVBZIYUKJJOJI-HYSWKAIVSA-N 377.271 5.023 30 20 GKED CC(C)(C#N)CCSc1nnc(COc2ccccc2F)n1-c1ccccc1 610165640 QQGROMLTQWISRZ-UHFFFAOYSA-N 396.491 5.017 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)CSc1ccc(C#N)cc1 610175852 IYCNJCFVAHWGTJ-UHFFFAOYSA-N 376.934 5.443 30 20 GKED C[C@@H](CC#N)NC(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196927 PHQQHKOMFXLGGU-LBPRGKRZSA-N 379.312 5.318 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)c1ccc(F)c(F)c1 610223829 MTSUKLLSJANFBO-AWEZNQCLSA-N 393.393 5.074 30 20 GKED N#C[C@H](NC(=O)C1CCC(c2ccccc2)CC1)c1ccccc1Br 610293839 KORRSPHHRPYKLG-UHYCVJNDSA-N 397.316 5.104 30 20 GKED CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610321350 RHZPEPCIOCKHKZ-OXQOHEQNSA-N 378.476 5.178 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(NC(=O)c2cccc(F)c2)c1 611391124 UIQDTQMGHOGMPN-DEOSSOPVSA-N 399.469 5.117 30 20 GKED Cn1c(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)nc2c(F)cccc21 684888138 FVVDCZIGPVGKQV-IUCAKERBSA-N 383.311 5.034 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 726074341 PRWHFNBQJQJSKJ-QFIPXVFZSA-N 389.524 5.846 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cnc(-c2ccccc2)nc1 727781934 ZVQNYMVKKAQNHM-OUKQBFOZSA-N 383.476 5.472 30 20 GKED O=C(/C(=C\c1cccnc1Cl)c1nc2ccccc2s1)c1ccccc1 728695431 WXMZLQIYBQMFGO-DTQAZKPQSA-N 376.868 5.768 30 20 GKED CC(=NNc1ccc([N+](=O)[O-])cn1)c1c(F)cccc1O[C@H](C)c1ccccc1 730145930 WXWZXQXSZLIYEU-OAHLLOKOSA-N 394.406 5.105 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccncc1 734237729 UCGVVJMVVPWVEP-OAHLLOKOSA-N 391.521 5.467 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1)c1ccncc1 734683214 JQXDASMXUAFNCM-RXVVDRJESA-N 391.540 5.733 30 20 GKED O=C(/C=C/c1cccc2c1OCCCO2)c1ccc(SCC(F)F)cc1 741841901 IJDRPSKKIFTJSW-JXMROGBWSA-N 376.424 5.101 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2C[C@@H]2c2sccc2C)cc1 748835202 UNFIIRRAJFUVCR-NUDXDXSLSA-N 380.513 5.021 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1nc2ccccc2s1 760963671 LLSUKGBYDPQSGO-AWEZNQCLSA-N 382.435 5.263 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCO[C@@H](c2cccc(C#N)c2)C1 761756424 HTWXCMULEJGSQP-QVKFZJNVSA-N 393.874 5.001 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(C3SCCS3)c2)CCCC1(C)C 770112730 BNQCTFKOLHXAKJ-QGZVFWFLSA-N 376.591 5.764 30 20 GKED CN1C(=O)CCc2cc(/C=C3/CCc4cc(SC(F)F)ccc4C3=O)ccc21 774138006 HTFUBSLMMMLGIY-WJDWOHSUSA-N 399.462 5.123 30 20 GKED C[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccc(-c2ccccc2)cc1 777114696 LURTYZJQPLOPEC-IBGZPJMESA-N 397.522 5.359 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 786321757 IONQIVSEWBDCSB-MXWKQRLJSA-N 393.320 5.645 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1c[nH]c2ccccc12 786354850 KDYVANFATMDHDJ-RHSMWYFYSA-N 386.480 5.056 30 20 GKED C=C(C)[C@@H](NCc1ccc(Cl)nc1C(F)(F)F)c1ccc(F)c(F)c1 787301434 BDTNHVBPAUEBNJ-OAHLLOKOSA-N 376.756 5.439 30 20 GKED C[C@@H](CSCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 794441377 OTLZJYPCGIRMAS-LPHOPBHVSA-N 392.549 5.523 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3ccc(C(F)F)cc3)cc2c1C 794936928 HEUCYLVSUFPWFV-YVMONPNESA-N 387.407 5.225 30 20 GKED C[C@H](c1ccccc1)N(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 806200728 LWFJUCSCGKPYDH-CLOONOSVSA-N 395.506 6.100 30 20 GKED CC(=NOCc1ccc(Br)cc1)c1nc2ccccc2n1C(F)F 813875195 IJACWESVRDOXGW-UHFFFAOYSA-N 394.219 5.135 30 20 GKED CC(C)(C#N)CCCCOC(=O)C(C)(C)c1csc(-c2ccccc2F)n1 814594174 YBZQCKYZUXDHBM-UHFFFAOYSA-N 388.508 5.490 30 20 GKED CC1(C#N)CCC(N[C@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)CC1 824423661 TZCSMHBRBAORKS-LRZVDXDASA-N 385.552 5.095 30 20 GKED C=CCCC[C@@H](C(=O)Nc1cccc(NC(=O)N(C)C)c1C)c1ccccc1 890324077 RGUCDHSMUSOKOF-LJQANCHMSA-N 379.504 5.167 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1cccc2ncccc12 915964647 HLDZZJVJDAEDPR-UHFFFAOYSA-N 393.853 5.027 30 20 GKED COCCOc1ccc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)cc1 915991717 NWZPMSKFDLTGBW-DHZHZOJOSA-N 399.899 5.385 30 20 GKED O=C(/C=C\c1csc(-c2cccc(Br)c2)n1)c1ccc(O)cc1 916134940 ZCOIKBRDETUQNE-TWGQIWQCSA-N 386.270 5.174 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)cc(OC)c1OC 916137842 FVJJOMJAJSKIGI-NTMALXAHSA-N 398.842 5.522 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1csc2ccccc12 916945286 VDUXWZOZTQQXNH-AWEZNQCLSA-N 389.263 5.169 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Oc3ccccc3Cl)n2)cc1 916974828 RTPALUUNYZLPRD-HOCLYGCPSA-N 396.899 5.416 30 20 GKED C[C@@H]1C(=NNc2c(Cl)cc(Cl)cc2Cl)CC[C@H](C(=O)O)C1(C)C 1776014721 TWYNTSUGBCLQKQ-PSASIEDQSA-N 377.699 5.572 30 20 GKED CCCCCCCOc1cccc(CN[C@](C)(CCC(C)(C)C)C(=O)O)c1 1776788079 PRGMIBSCRSROQA-HSZRJFAPSA-N 377.569 5.795 30 20 GKED C[C@H](OC(=O)c1c2ccccc2cc2ccccc12)C(=O)Nc1ccccc1C#N 6643793 VSLDQOBAYFRVEA-INIZCTEOSA-N 394.430 5.049 30 20 GKED N#Cc1ccc(OCC(=O)Nc2ccccc2Oc2ccccc2)c(Cl)c1 7855972 POZVCRFJESNGSK-UHFFFAOYSA-N 378.815 5.021 30 20 GKED C=CCn1c(SCc2cccc(Br)c2)nnc1-c1ccoc1C 14063949 QXCVLRNJULKKFP-UHFFFAOYSA-N 390.306 5.087 30 20 GKED C=CCN/C(S)=C(\C(=O)c1ccc(C(C)C)cc1)[n+]1ccc(C(C)(C)C)cc1 22687788 FQWIDWLPXCBECR-UHFFFAOYSA-O 395.592 5.109 30 20 GKED CCCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 64715228 KFWONKDFZBLVQM-HNNXBMFYSA-N 398.434 5.367 30 20 GKED C=CCn1c(S[C@@H](C)c2ccncc2)nc2sc3c(c2c1=O)CC[C@H](C)C3 72033790 ABFJURVEOZOMAK-KBPBESRZSA-N 397.569 5.017 30 20 GKED N#CCCCOc1cccc(NCC(=O)Nc2ccccc2Cc2ccccc2)c1 98128020 GBNFAQRTFLFOIW-UHFFFAOYSA-N 399.494 5.011 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3cccc(OCCCC#N)c3)s2)c(C)c1 116174634 ZKYDVAHSEKFZBT-UHFFFAOYSA-N 391.496 5.362 30 20 GKED Cc1csc(C(C)(C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 116500532 IMJAYJBAKSQWDH-UHFFFAOYSA-N 392.484 5.172 30 20 GKED Cc1ccc2cccc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)c2n1 125008294 LXICNFUTXMSYRJ-UHFFFAOYSA-N 394.434 5.163 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cn(C)nc2-c2ccncc2)cc1 125545976 NLGXIGZQYFXAKL-VAWYXSNFSA-N 395.462 5.054 30 20 GKED N#C[C@@H](NC(=O)c1cccc(C(F)F)c1)c1ccc(OCc2ccccc2)cc1 171501314 BJPXQHZBCNIFGZ-OAQYLSRUSA-N 392.405 5.198 30 20 GKED C[C@@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(C#N)cc1 172113140 VJNLGILBNSLDMV-CYBMUJFWSA-N 387.430 5.551 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(-c3ccccc3C#N)cc2)c1 180333740 DPRUEHXRWPXPNM-UHFFFAOYSA-N 381.479 5.198 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1nc(-c2ccc(Cl)c(Cl)c2)oc1C 180906166 YCLUZGIMLNKBDI-UHFFFAOYSA-N 393.192 5.147 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2ccccc2n1C(F)F 190662659 JBQRGWGDJDZTPK-JTQLQIEISA-N 397.278 5.079 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1 303707640 CAOIIRAVAVYSKL-UHFFFAOYSA-N 384.320 5.076 30 20 GKED COc1ccccc1[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1noc(C)n1 329161334 FNIHVWLNCKDMCI-XLSPSMHOSA-N 383.492 5.039 30 20 GKED O/C(CCc1nnc(-c2ccc(Cl)cc2)o1)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329877885 JXNAVSXHMHONKI-YXJHDRRASA-N 387.911 5.638 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H]1CCCC(F)(F)C1 409996751 HBAFUIWWWJQPTI-ZYHUDNBSSA-N 389.286 5.251 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1cn(CCCC#N)c2ccccc12 426954936 GWCATWSDJREEKT-WOIUINJBSA-N 385.511 5.352 30 20 GKED Cc1nccc(-c2cccc(NC(=O)c3sc4ccc(C#N)cc4c3C)c2)n1 428176285 ODXPZMOYZIFHCB-UHFFFAOYSA-N 384.464 5.099 30 20 GKED N#CCCC[C@@H](NC(=O)NCC1(c2ccc(F)cc2Cl)CC1)c1ccccc1 431469633 IAWJRJBYLNQIRG-HXUWFJFHSA-N 399.897 5.245 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(F)cc1C(F)(F)F 437989123 CIAGCUBGMZNWBN-CRAIPNDOSA-N 391.368 5.148 30 20 GKED CSc1ccccc1[C@H](C)NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 440996247 BNQVKFWFDTZFAQ-KRWDZBQOSA-N 381.545 5.209 30 20 GKED CCCN(Cc1nnc(-c2cccc(C#N)c2)o1)[C@@H](C)c1cc2ccccc2o1 441217614 OCAPXVOKPLCSIA-INIZCTEOSA-N 386.455 5.328 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc(C(F)(F)F)c1F 443528055 CJCZVNKSSUTCSI-LLVKDONJSA-N 378.350 5.253 30 20 GKED C=CC[C@H]1N(C(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)CCCC1(C)C 443857227 HXJHUNNJUXTUQL-JOCHJYFZSA-N 390.527 5.170 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 444459198 XIGSQROIVSHVGF-UHFFFAOYSA-N 381.435 5.179 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1 445793395 COPVKVPWFYZODZ-NSHDSACASA-N 382.382 5.349 30 20 GKED Cc1cc2sc(C(=O)Nc3ncccc3OCCCC#N)c(C)c2cc1C 446094068 GOVBHKNJJYJUHB-UHFFFAOYSA-N 379.485 5.156 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@](F)(c2cccc(Cl)c2)C1)c1ccccc1 458826627 CVLBITZFUATJKV-RBBKRZOGSA-N 399.897 5.355 30 20 GKED C=C[C@H](C)NC(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 465160968 WKHVYPJGRBBOTD-LBPRGKRZSA-N 392.381 5.045 30 20 GKED Cc1cccnc1[C@@H]1CCC[C@@H](NC2CCC(Oc3ccccc3C#N)CC2)C1 467342763 LBYQVEUUIGPBDJ-JYUKWDKTSA-N 389.543 5.268 30 20 GKED CO[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(C)(C)C 467610404 JNKGBPMVQUFCOG-AZUAARDMSA-N 399.922 5.178 30 20 GKED C=CCC(CC=C)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 468542850 PHCLKSKPQWRRGY-UHFFFAOYSA-N 384.911 5.032 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccc2ncsc2c1 469817747 GCSJJCFZQKEYPJ-OAHLLOKOSA-N 388.496 5.046 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2c2cccc(Br)c2)cc1 475028383 GWFRQBVEGJQPJR-LJQANCHMSA-N 397.316 5.228 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1csc(-c2ccccn2)n1 481138576 LPDYRBSTYUWQEI-UHFFFAOYSA-N 390.921 5.140 30 20 GKED C=CCN(C(=O)c1cc(Cl)ccc1OC(F)F)c1nc2c(s1)CCCC2 482557205 JKYBTFYIKNIMBP-UHFFFAOYSA-N 398.862 5.110 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(c2ccccc2)C2Cc3ccccc3C2)cc1 483727976 OJDAGWOPNHGNRM-UHFFFAOYSA-N 380.491 5.302 30 20 GKED Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 485946817 LYSHFQJFZCKEJP-IBGZPJMESA-N 389.480 5.174 30 20 GKED Cc1ccc(OCc2cccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)c2)cn1 487208941 KGMACLGTXPEFJE-DEOSSOPVSA-N 399.494 5.134 30 20 GKED C=CCCc1ccccc1NC(=O)N1CC[C@@H](OCCCc2ccccc2)C1 505001457 UBOCFBVXCYFIOM-JOCHJYFZSA-N 378.516 5.061 30 20 GKED Cc1cc(N[C@H](c2ccccc2)c2nccs2)n2c(nc3ccccc32)c1C#N 505559105 HYBGJCPJVJCWJX-OAQYLSRUSA-N 395.491 5.326 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)Cc2csc(-c3ccccc3)n2)cc1 505815320 LLKOXYYHCHGYLO-FQEVSTJZSA-N 389.524 5.031 30 20 GKED O=[N+]([O-])c1cccc(F)c1CN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 505834629 USVAWJANJNJWRK-CQSZACIVSA-N 396.262 5.146 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccc(Oc3ccccc3)nc2)CC1 507660538 NRNGQMGHEMZVKS-UHFFFAOYSA-N 383.495 5.368 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 509224375 DTTCNUMZBFBBPY-UHFFFAOYSA-N 377.366 5.313 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)C1CC1 513770614 BRRGJNQVEHUOPX-AWEZNQCLSA-N 376.485 5.119 30 20 GKED CC[C@@H]1C[C@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 514108848 GJFWCKSEQYTSTP-XMSQKQJNSA-N 394.490 5.134 30 20 GKED N#Cc1c(NC(=O)Cc2coc(-c3ccccc3)n2)sc2c1CCCCCC2 515448629 AASCEEVGHFKLKF-UHFFFAOYSA-N 391.496 5.115 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1 520596914 JRJJZADXPBHYQP-UHFFFAOYSA-N 397.478 5.233 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1c(Cl)cccc1Cl 520923697 ZSSQUFYWVNNNMM-LBPRGKRZSA-N 379.312 5.569 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)[nH]1 524674446 HZFYRPNIFAHZLE-UHFFFAOYSA-N 375.497 5.259 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(F)cc3)o2)nnc1-c1cccs1 532635438 QDQZAUODWUWRMJ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED CC(C)n1nccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534875842 DAVWZOIVFZAPNP-UHFFFAOYSA-N 380.835 5.034 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C)c1ccccc1 535366681 CADXKVNTYSNCCZ-ICSRJNTNSA-N 390.527 5.166 30 20 GKED N#CCc1ccc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1 535416441 MQNWUEBJDDMEFJ-UHFFFAOYSA-N 387.386 5.147 30 20 GKED C=C(C)[C@H](CC(=O)N(CCC)[C@@H](c1cccnc1)c1ccc(F)c(C)c1)OCC 538554693 CPPYXQBWWFAQPJ-LADGPHEKSA-N 398.522 5.228 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1nc(-c2ccccc2)cs1 561894657 RJSNXQOMCPKCCY-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccccc1 562167195 IMBFFUNYBKOVBF-IAGOWNOFSA-N 379.529 5.696 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1Cc1cccc(SCc2ccccc2)c1 571072377 QJSWDGWKYZJLJO-UHFFFAOYSA-N 396.519 5.466 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)C[C@H]1CCOc2ccccc21 572757486 UBNCCOXMDFATST-HXUWFJFHSA-N 382.463 5.048 30 20 GKED Cc1cc(N2CCSCC2)ccc1NCc1ccc(C#N)cc1C(F)(F)F 574682928 ZSIDYANAFIJCKI-UHFFFAOYSA-N 391.462 5.051 30 20 GKED CC(C)(C)C1CCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 580804136 JMDZTAUPBQVRBY-UHFFFAOYSA-N 378.476 5.036 30 20 GKED CCOc1ccc([C@@H](NC(=O)CCCCCC#N)c2cccc(Cl)c2)cc1 588655106 OQXNGSRFNAGDEG-JOCHJYFZSA-N 384.907 5.418 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c(C)s1 603690191 YQZHAEYHEIKAOC-AWEZNQCLSA-N 392.484 5.307 30 20 GKED CCOc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1F 604013490 PDNKGNAXSHOLTJ-UHFFFAOYSA-N 392.455 5.500 30 20 GKED N#C[C@H](C(=O)c1cccc2cnccc12)c1nc2cc(C(F)(F)F)ccc2s1 608752415 GSSLGDXLHAHOAT-OAHLLOKOSA-N 397.381 5.353 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cnc(-c2ccccc2F)s1 609376008 VCXMMUKCDGIRNP-UHFFFAOYSA-N 383.473 5.207 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)NCc1ccc(C#N)cc1F)c1ccccc1 609683708 ITMPUVHDWNXGEV-MRXNPFEDSA-N 389.430 5.159 30 20 GKED Cc1ccc(-c2csc3nc(CSc4ccccc4C#N)nc(O)c23)s1 610206604 RINIGWWOQMHPDZ-UHFFFAOYSA-N 395.534 5.598 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1)C1CC1 611095318 PTOMBSWQRBBRKK-HNNXBMFYSA-N 383.879 5.075 30 20 GKED N#CC1(c2nc(Cc3nc4cc(C(F)(F)F)ccc4s3)no2)CCCCC1 612881815 KPCIPFNVVNWNPO-UHFFFAOYSA-N 392.406 5.014 30 20 GKED Cc1cccc(-n2ncc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2C)c1 613392581 ZYSFPMHXRFGDII-IBGZPJMESA-N 398.491 5.103 30 20 GKED Cc1cc(C(F)(F)F)nc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 680372127 VIEVTOXKMZUGKN-BRPSZJMVSA-N 395.269 5.125 30 20 GKED C[C@@H](NC(=S)N(Cc1ccccc1)c1ccccc1C#N)c1cccs1 726484997 IDTPAGHKYAMVDE-MRXNPFEDSA-N 377.538 5.262 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3csc(C(C)(C)C)n3)n2)cc1 726858708 SRPVDJFZUPHDJA-MRXNPFEDSA-N 395.553 5.292 30 20 GKED COc1cc(/C=C2\CCc3nc(-c4ccc(C)cc4)sc3C2=O)ccc1O 727654251 JOEAWMRFQJKCDJ-LFIBNONCSA-N 377.465 5.045 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1c(Cl)nc(Cl)n1C 728440482 OGKFSVHUNROCMW-HJWRWDBZSA-N 378.284 5.055 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)/C=C/c1ccccc1C#N 730505168 ZRNDAZFKFWQQAE-CCEZHUSRSA-N 384.483 5.002 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2C)c(F)c1)c1ccncc1 735272944 NYUPZHMCLYBLRR-JOCHJYFZSA-N 378.422 5.382 30 20 GKED O=C1/C(=C\c2ccc(F)cc2)CC(O)(C(F)(F)F)C/C1=C\c1ccc(F)cc1 735792324 BSNZPVUWBPXVCY-CKOAPEAFSA-N 394.339 5.088 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2csc(-c3cccc(Cl)c3)n2)cc1 745400316 XRHGCEPIEQSQQD-UHFFFAOYSA-N 381.888 5.332 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2nc(Cl)cs2)CC3)cc1 759085282 UUQYHWQUWNRFOR-FLIBITNWSA-N 388.901 5.141 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 761047734 OULHRFVKPNGRGO-ZBFHGGJFSA-N 376.909 5.254 30 20 GKED CC(C)c1ccc(CN(C(=O)Nc2ccc(F)cc2OCC#N)C2CC2)cc1 761670347 QXUFTFAOKOVSRK-UHFFFAOYSA-N 381.451 5.048 30 20 GKED CC(C)(C)c1csc(COC(=O)c2cn(CCCC#N)c3ccccc23)n1 769541730 DEPIRKXUKAXSBI-UHFFFAOYSA-N 381.501 5.056 30 20 GKED C[C@@H](N[C@H](C)c1ccccc1-c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 776162170 CLLYVSSQFWYFAY-QZTJIDSGSA-N 390.914 6.321 30 20 GKED CC(C)Cc1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 781928260 WFEQYRYWHILZPP-JOCHJYFZSA-N 395.572 5.371 30 20 GKED N#C[C@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1nccc2ccccc12 792093072 UOGUSGDGGHXRIH-HSZRJFAPSA-N 384.479 5.365 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCc2cc(Br)ccc21 794956985 MHASGTKDYBEOEI-GXDHUFHOSA-N 397.297 5.180 30 20 GKED N#CC[C@H](CC(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 796608497 ASIAMGBACWQQQZ-QGZVFWFLSA-N 397.862 5.079 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(Cl)ccc2OCC2CC2)c1 797467151 YHCVVOBRSHARFW-FQEVSTJZSA-N 384.907 5.100 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2cc(Br)cs2)s1 797570240 FKCFHDDOTZGENU-GFCCVEGCSA-N 397.363 5.074 30 20 GKED N#CC1(CCCNc2ccc(OCc3cccc(F)c3)c(F)c2)CCOCC1 798387195 CDNIGERTMFVSLY-UHFFFAOYSA-N 386.442 5.056 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)OCCCC3(C#N)CCOCC3)o2)c1 800194897 LEXZRVASJWWCJS-UHFFFAOYSA-N 381.472 5.327 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 800843613 ACWSCGPLEDFCAA-HXUWFJFHSA-N 387.483 5.199 30 20 GKED C[C@H]1C[C@H](CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C[C@@H](C)O1 801663447 SXXZXQLTONOEQM-ISJRUSPKSA-N 391.515 5.057 30 20 GKED C#Cc1ccccc1CC(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 812992683 NIQYSHBCJYBMOY-UHFFFAOYSA-N 385.854 5.046 30 20 GKED C=CCC(C)(C)c1noc([C@H](C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 815706462 KBQPMHKQCPROFI-NVXWUHKLSA-N 385.508 5.293 30 20 GKED CSCCCCCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 860507358 SXBJBSSJECDNGV-CYBMUJFWSA-N 394.512 5.578 30 20 GKED O=C(c1cc2ccccc2cc1F)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 883978729 UBJKECVLIBTXTL-BETUJISGSA-N 393.302 5.182 30 20 GKED N#CC1(CCCC[S@](=O)Cc2csc(-c3ccc(F)cc3)n2)CCC1 899385627 UQZWXLOKRUVWTH-VWLOTQADSA-N 376.522 5.062 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(OC(F)F)c2)cc1 915086769 MRNRMAFGVDNWCI-HXUWFJFHSA-N 378.378 5.196 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)cc1 915352854 KGMSFZLLOFGNLG-RPWUZVMVSA-N 399.469 5.850 30 20 GKED C[C@H](NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 916000810 TYHUOZZVWXJCHA-KRWDZBQOSA-N 387.508 5.185 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@H](C#N)c3ccc4ccccc4n3)ccc2c1 916849132 PNEYHOSUZDFSID-ZCQBWMKESA-N 378.431 5.286 30 20 GKED C=CCn1c(-c2cccnc2)nn(CN(C2CCC(CC)CC2)C2CC2)c1=S 917440029 LMIIEVDBMDRGNA-UHFFFAOYSA-N 397.592 5.053 30 20 GKED CC(C)CC(Cc1ccc(Cl)cc1Cl)=NNc1ccc(CC(=O)O)cc1 1776084483 SCPOKGFNRRIYSZ-UHFFFAOYSA-N 393.314 5.677 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(OCC(C)(C)C)c1 1776355415 KZPVKOPTLLGKGR-LUAWRHEFSA-N 396.483 5.493 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cn(C(C)(C)C)nc1C(C)(C)C 1776787038 KYRRAOOBFIZQIU-GOSISDBHSA-N 379.589 5.229 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@@H](C(=O)O)CC[C@H]2C)cc1 1776787562 XWRWOUVTFMPKKN-AEFFLSMTSA-N 377.550 5.074 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1 1776869258 QUQZUSTWGSRVHE-FOWTUZBSSA-N 399.490 5.616 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2ccc(Cl)cc2Cl)S1 7165035 KACJPBZHWRSJRO-OVCLIPMQSA-N 377.296 5.502 30 20 GKED Cc1cc(-c2cc(C(=O)Nc3cccc(C#N)c3)c3cnn(C(C)C)c3n2)c(C)o1 14282554 ZQMWBGYWJTUFRO-UHFFFAOYSA-N 399.454 5.013 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2cccc(O)c2)cs1 54897250 JXIBSCPVBDSPRN-JXMROGBWSA-N 398.871 5.083 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 60043769 RSUPCBDSSKLQFJ-OAHLLOKOSA-N 377.494 5.104 30 20 GKED N#Cc1ccccc1OCCSc1nnc(-c2ccco2)n1C1CCCCC1 60422901 XREOPEAQRPFIHK-UHFFFAOYSA-N 394.500 5.086 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nc(-c2cccc(Cl)c2)no1 108354724 VSJNNAAPHCUYOZ-ZDUSSCGKSA-N 384.892 5.254 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C(/C)c3ccc(F)cc3)n2)cc1 109323140 GOQVEIVGDZOXJO-KWRJMZDGSA-N 392.455 5.238 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1csc(-c2ccc(OCC)cc2)n1 109329554 OBKPFSGPNUWPRA-UHFFFAOYSA-N 392.524 5.080 30 20 GKED C=CCOc1ccc(-c2nnc(SCCCC(=O)c3ccccc3)o2)cc1 126292444 AFWANEBYRCMLJW-UHFFFAOYSA-N 380.469 5.057 30 20 GKED CCn1c(NC(=O)c2c(Cl)ccc(Cl)c2Cl)nc2cc(C#N)ccc21 131731097 BYQQGHQDQJZPMP-UHFFFAOYSA-N 393.661 5.140 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccncc1 136725911 JESFFGDDZZKQED-DYVFJYSZSA-N 381.888 5.229 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2cccc(C)c2o1 149286460 BPRUUTJTAPITBP-UHFFFAOYSA-N 383.407 5.361 30 20 GKED CSc1ccccc1NC(=O)c1cn(CCC#N)nc1-c1ccc(C)c(C)c1 151773619 RJRLBFYOCRUCLQ-UHFFFAOYSA-N 390.512 5.055 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cccc(C(F)(F)F)c1 171292753 JSWQHGYVVNSWOM-AWEZNQCLSA-N 387.405 5.012 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccccc1F 177183898 SFTDAKOAJBDQDS-ZDUSSCGKSA-N 386.496 5.409 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCC3(CC3)C2)cc1Cl 184141364 NBFXCHZAQKQIQP-LJQANCHMSA-N 379.891 5.403 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)c1ccccc1 188405779 WUYRWZWGGADDLD-UHFFFAOYSA-N 386.329 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CCC(F)(F)F)cc1 189890424 CMGOXQSTCFVJAE-UHFFFAOYSA-N 375.434 6.286 30 20 GKED Cc1ccc(-c2n[nH]c(NC(=O)c3ccccc3-c3ccccc3C#N)c2C)o1 192471853 JSEAZQUEJWUKCR-UHFFFAOYSA-N 382.423 5.078 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2ccc(Cl)cc2Cl)cc1 207054344 LGNABKGBTUICKN-UITAMQMPSA-N 387.266 5.202 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)c1)C(=O)O 208116682 PWVKOAMOVBBBLF-DAGBOUIGSA-N 399.657 5.395 30 20 GKED COc1ccc([C@H](C)NCc2cccc(OCc3ccccc3C#N)c2)cc1F 237320347 KPXKLPWXCYDFEQ-KRWDZBQOSA-N 390.458 5.136 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1c1cccc(Br)c1 301296739 PLOWPQKVPQRMNQ-CQSZACIVSA-N 396.210 5.076 30 20 GKED N#Cc1cc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)ccc1[N+](=O)[O-] 302161071 HEGBQRZRBBHYFI-UHFFFAOYSA-N 398.875 5.114 30 20 GKED O/C(=N/[C@H]1CCOC2(CCSCC2)C1)Nc1cccc(C(F)F)c1Cl 329837404 MDISIOXZGOJXCD-NSHDSACASA-N 390.883 5.048 30 20 GKED CC(C)N(CCC1(C#N)CCCCC1)Cc1nnc(-c2ccccc2Cl)o1 411419501 GSKKVMMDBUYVIN-UHFFFAOYSA-N 386.927 5.465 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CC(C)(C)Oc2ccccc21 412092094 QJFQFBDXTBGZGG-RDJZCZTQSA-N 380.513 5.364 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433955864 RKOVUNVGAMJDJX-UHFFFAOYSA-N 378.259 5.283 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(OCc2ccccc2)CC1)c1ccccc1 435103425 ZMHBIUSVEYGEIE-HSZRJFAPSA-N 378.516 5.085 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1csc([C@@H](C)OCC)n1)c1ccccc1 435104163 DPSGHOIACCUDOE-VQIMIIECSA-N 387.549 5.090 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 437039811 NTBPXALJTBBRGM-SJKOYZFVSA-N 386.339 5.921 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@@H](C)c3cccc(C#N)c3)o2)cc1 442905337 SFTNTEFXOWXBQX-HNNXBMFYSA-N 378.501 5.308 30 20 GKED C=C(C)COc1cc(CN[C@H]2COc3c2ccc(Cl)c3Cl)ccc1OC 462744732 ZXVVLLDXJGWFPS-INIZCTEOSA-N 394.298 5.180 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1cccc2cccnc12 466374172 PZWCCDZBGCYGFR-UHFFFAOYSA-N 395.487 5.534 30 20 GKED C=CCCN(C)C(=O)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 467084964 LVIZURDKFSOWMF-IBGZPJMESA-N 392.421 5.021 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@H]1CCCC[C@H]1C(F)(F)F 473254852 KKJKOOYJDYFWPM-QWHCGFSZSA-N 386.311 5.107 30 20 GKED Cc1cccc(Oc2cc(CNC(=O)C[C@@H](CC#N)c3ccccc3)ccn2)c1C 476194152 KBHFDWCHYJCEIN-JOCHJYFZSA-N 399.494 5.195 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCc2ccccc2C(C)(C)C#N)cc1Cl 486448757 HKNMKFYPVVRETL-UHFFFAOYSA-N 397.950 5.672 30 20 GKED C[C@H](C(=O)Nc1ccccc1NCc1ccc(Cl)cc1)c1cccc(C#N)c1 487165357 QTVVIAUVPWGLDF-INIZCTEOSA-N 389.886 5.566 30 20 GKED Cc1ccc(CCC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1 488015697 SHCFPBZZWBBIJI-UHFFFAOYSA-N 386.470 5.167 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(C(=O)N(C)C)cc1 494928265 DEJHQCGWXMZHLT-RTBURBONSA-N 397.522 5.339 30 20 GKED Cc1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)c(F)cc1Br 497445139 WGLHBGKWMPVYJU-MRXNPFEDSA-N 390.256 5.063 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(Cc1cccs1)Cc1cccs1 502651042 HMCJYOYZTBKOHT-UHFFFAOYSA-N 397.525 5.314 30 20 GKED CCSc1ccc(Cl)cc1C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 505969948 DWHXZCDCYKCZBP-HNNXBMFYSA-N 398.837 5.465 30 20 GKED CC[C@@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)c1ccc(OC)cc1 507578757 RGFLTALVTZLYCM-SFHVURJKSA-N 388.467 5.277 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SC[C@@H](OC)c1ccc(Cl)cc1 509101814 AOHLSRCIJHBFPH-LJQANCHMSA-N 399.947 5.188 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2ccc(OCC(F)(F)F)c(C#N)c2)cc1C 510171531 ADAAVWNORAQOIE-UHFFFAOYSA-N 382.769 5.022 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1coc2ccccc12 512525224 ZWCXDZVPLGNZKY-UHFFFAOYSA-N 397.434 5.727 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)NC[C@H](C)c1ccccc1 513209646 KNLPNWRPAHUPSA-RBUKOAKNSA-N 399.494 5.071 30 20 GKED CCCn1c(Sc2ncc(C#N)cc2Cl)nnc1-c1ccc(Cl)cc1 513635825 RWCUKCOKCXFSOA-UHFFFAOYSA-N 390.299 5.080 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(C#N)cc1 514536720 BELRKOLIOLVZPM-UHFFFAOYSA-N 397.453 5.043 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N[C@H](c2cccs2)C2CC2)cc1 515216286 KCNCTUSHIKRYAJ-QFIPXVFZSA-N 388.492 5.080 30 20 GKED C[C@H](NC(C)(C)CNC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1 517808116 FEASAFPYGCYBFP-IBGZPJMESA-N 397.522 5.084 30 20 GKED C[C@H](C1CC1)N(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521092135 JRFGNOQKLDSJPB-GOSISDBHSA-N 397.478 5.186 30 20 GKED CCCN(CC(C)C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 521208356 PDHJAGRHCQMVDT-UHFFFAOYSA-N 379.504 5.232 30 20 GKED COCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)c1ccccc1 521259841 SCZYHMYLEVYHHO-MSOLQXFVSA-N 397.544 5.180 30 20 GKED CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)Nc1ccc(CC#N)cc1 521331316 AVSYAXVETCAIKX-MRXNPFEDSA-N 376.287 5.202 30 20 GKED COc1cc(CSc2ccc(C#N)cc2)ccc1OCc1cccc(C#N)c1 522623604 AFOHGJHLFURVST-UHFFFAOYSA-N 386.476 5.310 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccccc2C#N)c1 524512585 ZNTNOJYEFNFKPD-CYFREDJKSA-N 396.490 5.155 30 20 GKED N#Cc1ccc(CN2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)cc1 532127429 VXKDNHUOWIGQRS-UHFFFAOYSA-N 375.299 5.046 30 20 GKED Cc1nc(-c2cccc(NCc3cccc(OCc4cccc(C#N)c4)c3)c2)no1 533210205 WZXPUEZDRMVUQV-UHFFFAOYSA-N 396.450 5.108 30 20 GKED Cc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c2c(C(C)C)noc2n1 538073756 LDOYOTMFXPLYEE-UHFFFAOYSA-N 382.489 5.138 30 20 GKED CCCn1c(SCCCC2(C#N)CCOCC2)nc2cc(Cl)ccc21 538570254 OUNHENOIWNNXJH-UHFFFAOYSA-N 377.941 5.292 30 20 GKED Cc1ccsc1CCNC(=O)c1ccccc1Sc1ccccc1C#N 539102169 GAWASSWGNDSMHS-UHFFFAOYSA-N 378.522 5.052 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2nc(C3CC3)cs2)cc1 542211983 AMNMPVPMENQNTA-UHFFFAOYSA-N 377.488 5.234 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC1CCN(Cc2ccc(C#N)cc2)CC1 542832347 DIFRQVLCWREIMP-UHFFFAOYSA-N 391.559 5.258 30 20 GKED C[C@H](NCc1cccc(CN[C@H](C)c2ccc(C#N)cc2)c1)c1ccc(C#N)cc1 548933407 SWUQVOSQNNMVIE-BGYRXZFFSA-N 394.522 5.132 30 20 GKED C=CCn1c(SCc2sccc2Cl)nnc1-c1ccccc1OC 549628370 MVTFCRFDOLHSME-UHFFFAOYSA-N 377.922 5.147 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 559865639 SDVNOJIKYPMLPK-NLFFAJNJSA-N 384.523 6.448 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@@](C)(C#N)C3CCCCC3)sc2C)cc1 583712709 UGRHZCRONJNSBI-QFIPXVFZSA-N 382.529 5.325 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC1(C(F)F)CCCC1 588997691 RYLGOEWZUGQHAQ-UHFFFAOYSA-N 399.441 5.145 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc2cc(F)ccc2s1 592974730 YEDUQQQZADWBMR-QGZVFWFLSA-N 380.444 5.247 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](C)(c2cccc(F)c2)C1 593157435 ITENVSGLNXSKHH-OPAMFIHVSA-N 397.519 5.415 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1[C@@H]2c3ccc(Cl)cc3C[C@H]21 599736373 FKJRFASOKXRFTF-DJGFWBNSSA-N 397.931 5.194 30 20 GKED C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1)c1cccc(C#N)c1 600847938 ZXDIHDIRPPLYJL-DFBJGRDBSA-N 395.506 5.709 30 20 GKED C=CCN(C(=O)c1cc(C)c(C)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603459394 WYBFTTCYPRVRPM-UHFFFAOYSA-N 399.497 5.229 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(Cl)cccc2s1)c1cccc(C(F)(F)F)c1 609462430 ITSFIYIMRPOPQM-CQSZACIVSA-N 394.805 5.568 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1ccc(C(F)(F)F)cc1 610555555 UWZZUTDABXZEKK-UHFFFAOYSA-N 384.810 5.102 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1coc(C2CCC2)n1 618080403 IDHMONJJQVPQSR-UHFFFAOYSA-N 389.430 5.108 30 20 GKED COc1ccc([C@@H](C)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 625285589 GTIPAPKNNFIWTQ-SNVBAGLBSA-N 395.318 5.723 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=S)Nc3ccc(C#N)c(Cl)c3)oc12 726448726 JNKMQHWDALRXRK-LBPRGKRZSA-N 399.903 5.404 30 20 GKED C#Cc1cccc(N(C)C(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)c1 728481821 OLFVTMMMSWNPGG-UHFFFAOYSA-N 386.398 5.087 30 20 GKED N#C[C@H](C(=O)Cc1c(Cl)cccc1Cl)c1nc2cc(F)ccc2s1 730416651 GUSWNZYIIQCLPG-LLVKDONJSA-N 379.243 5.161 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(Cl)cc1Cl 730954683 HLJRSPUWDSZJOX-NSHDSACASA-N 396.368 6.054 30 20 GKED CC[C@H](OC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733680824 IZLKYHGYHACETO-HIFRSBDPSA-N 396.434 5.229 30 20 GKED C=CC[C@@H](NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccncc1 734684599 WEHBYXJOMPGNOB-MOPGFXCFSA-N 389.421 5.264 30 20 GKED COc1cc(C(=O)/C=C\c2cnc3ccc(Cl)cn23)ccc1SC(F)F 737445149 WUZTUODAONBKSA-PLNGDYQASA-N 394.830 5.207 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc(Cl)c1O 741474656 XYMQDSLYQDWRQB-SREVYHEPSA-N 379.843 5.402 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc(SCC(F)(F)F)cc1 741762818 UJCVUTXPOVZVRU-UHFFFAOYSA-N 382.411 5.160 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(F)F)cc1 746662300 ZPCKNQFGVOHELA-UHFFFAOYSA-N 389.471 5.563 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cc3ccccc3[nH]2)cc1 746763460 OZUMJESFYFLFCU-QFIPXVFZSA-N 380.451 5.145 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnc2ccccc12 748698480 HQGKEERGTITYBR-QFIPXVFZSA-N 377.447 5.451 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)Nc1ccc(C)cc1 749101579 DCRIVEMIGBRWAK-UHFFFAOYSA-N 393.325 5.282 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)N1CCCSC1=Nc1ccccc1C(C)C 749784682 BTIDOADMFWBBDY-CQSZACIVSA-N 385.533 5.172 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1c(C)oc(-n2cccc2)c1C#N 751257282 OZYLXGHVIUZILE-UHFFFAOYSA-N 393.512 5.702 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc([C@H](C)CC)cc1 756233167 IHTFTOHLOXHUKT-IIBYNOLFSA-N 376.500 5.286 30 20 GKED C#CC[C@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccccc1 758003587 OVSJLAVMZGMDAB-FHSBBHSISA-N 375.434 5.016 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c(C)c1 766350684 OKHIPPSONDSALL-MRXNPFEDSA-N 382.460 5.088 30 20 GKED C#CCCCCCC(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 772824757 WBAGXOVAIWFPQQ-GOSISDBHSA-N 396.556 5.108 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3c(C)cc(Cl)cc32)c1 772984546 OJGOJHFDOBWSAJ-GHTZIAJQSA-N 384.907 5.333 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2C[C@@H](C(C)C)c3ccccc32)ccc1OC 774235507 FWZSRCUZIJTIIE-COPCDDAFSA-N 378.516 5.350 30 20 GKED Nc1c(Cl)cc(C(=O)/C=C\c2c(C3CC3)nc3sccn23)cc1Cl 774554812 FLPUEBVBGYJTJF-ARJAWSKDSA-N 378.284 5.058 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(OCC#N)cc1 776155103 YCKXYDXNCBLHRJ-RZFFKMDDSA-N 394.359 5.149 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 780468579 PMIVVIQKAOAJIB-HNNXBMFYSA-N 393.443 5.053 30 20 GKED O=c1[nH]ccc2cc(NN=C3CCC[C@H]3c3ccc(C(F)(F)F)cc3)ccc12 789073626 ONKLQGBJCFIWHY-KRWDZBQOSA-N 385.389 5.283 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792096277 ZWSZHSSVNFCIAP-FQEVSTJZSA-N 397.503 5.394 30 20 GKED C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797573766 WIMNEORQKXGAJQ-FZMZJTMJSA-N 396.434 5.103 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)OCC(C)(C)CCC#N 798879207 GTGBVQBAUMIBNZ-UHFFFAOYSA-N 394.302 5.033 30 20 GKED Cc1cccc(Oc2ccccc2C(=O)Nc2ccc(F)cc2OCC#N)c1 799350673 VXNRLKDUCLJREZ-UHFFFAOYSA-N 376.387 5.081 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccc3[nH]ccc3c2)cc1 799386679 IEOALCNEDKCTKX-HSZRJFAPSA-N 394.478 5.188 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1ccc(Cl)c(Cl)c1)c1ccccc1 814210441 OTQPHGTZYQCHKT-QGZVFWFLSA-N 378.328 5.715 30 20 GKED C[C@H](c1cccs1)N1C(=O)/C(=C\c2ccc(C3(C#N)CC3)cc2)SC1=S 849173059 BNQZSSWDJGMCAO-VVBXCHJUSA-N 396.562 5.266 30 20 GKED Oc1ccc2ccccc2c1/C=N/C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914703232 RSGPFNJTPCPAIM-QATXJQJASA-N 389.339 5.874 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(-c3ccccc3)n2)cc1 915086012 FCJWTLSHIZWBMJ-OAQYLSRUSA-N 395.487 5.718 30 20 GKED O=C(/C=C\c1csc(-c2cccc(Br)c2)n1)c1cccc(O)c1 916155675 SDEGSPFDGOVECE-FPLPWBNLSA-N 386.270 5.174 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C=C/c1cc(C)c(C)cc1C 916906631 IIKJYUDEDAHZSD-LEQVUBRHSA-N 388.511 5.097 30 20 GKED N#C[C@@H](C(=O)CC12CC3CC(CC(C3)C1)C2)c1nc2ccccc2n1C(F)F 917039835 FEDGOZSNDAVYQB-IGMNZBQBSA-N 383.442 5.214 30 20 GKED CC(C)c1ccc(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917045256 XLYBRKXHRSQQMM-INIZCTEOSA-N 384.888 5.328 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCSc1ccc(Cl)cc1 920102541 URQSXAFUMLFVGD-QGZVFWFLSA-N 396.899 5.204 30 20 GKED O=C(O)Cc1ccc(NN=Cc2cc(F)ccc2Oc2cccc(Cl)c2)cc1 1776085989 VWQDHDAFEIRISJ-UHFFFAOYSA-N 398.821 5.345 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3ccc4c(c3)CCCC4)cc2)c1 1776113296 FIOOBVZPNFMFMA-XNTDXEJSSA-N 396.486 5.756 30 20 GKED C=CCOc1ccc(CN[C@@](CC(C)C)(C(=O)O)c2ccccc2)cc1Cl 1776183623 CMKUXOOEONZPJL-JOCHJYFZSA-N 387.907 5.021 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc4[nH]c(C(=O)O)cc4o3)s2)cc1 1777430598 OONLQSDZQKUYOT-FPLPWBNLSA-N 392.436 5.096 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1cc2c(ccc3ccccc32)o1 1777640927 DKSHKLBRDGEWCM-PKNBQFBNSA-N 386.403 5.336 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)C(=O)Nc2ccccc2-c2ccccc2)n1 5642614 ZEZZGXAKDVSZQY-QGZVFWFLSA-N 387.508 5.356 30 20 GKED Cc1occc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538194 ITHJRNSZNNLBHH-ZDUSSCGKSA-N 377.252 5.508 30 20 GKED Cc1nc(NC(=O)Cc2coc3ccc4ccccc4c23)sc1SCC#N 44789012 RQZHFCRTHMUSCF-UHFFFAOYSA-N 393.493 5.148 30 20 GKED CCCCOc1ccc(C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1OCC 65839338 OUVNZAVHLQRXCX-UHFFFAOYSA-N 396.487 5.175 30 20 GKED N#CC1(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)CCCCC1 72030102 OIUAJPSIIRQBIA-UHFFFAOYSA-N 379.407 5.241 30 20 GKED Cc1nc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)ccc1C#N 109572195 KICNDUMPLVXGNO-AWEZNQCLSA-N 390.874 5.341 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CC1)c1nc(-c2c(F)cccc2F)cs1 115910005 UHAGYBSWJFTUJM-AWEZNQCLSA-N 398.409 5.135 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 121203660 LJKOVWBXOOPHHV-UHFFFAOYSA-N 386.411 5.036 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1cccc(OC)c1 124229903 JYMXABZIJPNHEP-AWEZNQCLSA-N 398.532 5.279 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cccc(-c2ccoc2)c1 127855657 ISTLFLCLYNVDPD-OAQYLSRUSA-N 380.403 5.061 30 20 GKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 131379141 OUXRWVWNUJXWCZ-HXUWFJFHSA-N 381.451 5.220 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccc(Cl)cn1 133375328 PHGLJSXCGXLOQM-UHFFFAOYSA-N 398.249 5.329 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@H]2c2ccc(Cl)cc2)c1 171836265 ZALAMPHLMLNCNN-NRFANRHFSA-N 382.891 5.124 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)CCc1ccc(Cl)cc1 172226175 WZOQYSYEBORKFF-OAHLLOKOSA-N 387.936 5.298 30 20 GKED COc1csc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 176793358 IEWXDRKZUUTZFN-UHFFFAOYSA-N 386.420 5.034 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(SC)c(F)c2)ccc1OC 180813716 SIWCALJZPMOFTO-PBHICJAKSA-N 388.508 5.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(Cc2ccc(OC)cc2)c1 189900767 LVOAKUGEYBURGB-UHFFFAOYSA-N 389.499 5.044 30 20 GKED N#C[C@@H](C(=O)c1occc1CSc1ccccc1)c1cnc2ccccc2n1 190937669 QTKZAVXACWDWTI-QGZVFWFLSA-N 385.448 5.005 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 191455539 CKMFRCPMIJJWBV-UHFFFAOYSA-N 375.516 5.853 30 20 GKED N#Cc1cc(N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c2ccccc2n1 301977082 FEGJHSVQJIOXNO-UHFFFAOYSA-N 388.858 5.285 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 303145038 UXIULZNNRUDQQM-UHFFFAOYSA-N 385.467 5.159 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccccc3OCC3CC3)c2)c1 303946618 ZGXZJDIDSHRYIG-UHFFFAOYSA-N 398.462 5.178 30 20 GKED Cc1ccc(N=C(O)[C@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c(C)c1 328712087 RPPZTIAUPDUKOC-HTAPYJJXSA-N 391.515 5.377 30 20 GKED O/C(=N/C1CCC(F)(F)CC1)[C@H]1CCC[C@H]1/C(O)=N\C1CCC(F)(F)CC1 329029834 PGLDXDNVNMXQHD-GASCZTMLSA-N 392.437 5.472 30 20 GKED Cc1cc(N2CCCCCC2)ccc1N/C(O)=N/[C@@H]1CCOC2(CCCC2)C1 329435026 LJIORBYCVKZKCI-LJQANCHMSA-N 385.552 5.193 30 20 GKED CC1(C)Oc2ccc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)cc2O1 329501822 YSZIAAGXKNDOPX-INIZCTEOSA-N 395.503 5.289 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(/C(O)=N/[C@H]3CCOC4(CCC4)C3)c12 330196474 QHMABCHBZJYJAX-INIZCTEOSA-N 398.551 5.024 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1sccc1Cl 419590065 JVZGMQORTPCDEY-GFCCVEGCSA-N 396.990 5.525 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cc(C(F)(F)F)ccc1N1CCCC1 429213427 CMWKLPBHDKFNTA-UHFFFAOYSA-N 396.457 5.099 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1cccc(SCC#N)c1 429962167 MIDLAPSIBUEVNB-GFCCVEGCSA-N 379.312 5.442 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C)CC(C)(C)C#N)cc1 432745547 VBHGMJRAPXVCFD-UHFFFAOYSA-N 387.867 5.154 30 20 GKED N#Cc1cccc(C#N)c1Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 432929734 YUBRIDPSKLAZQM-UHFFFAOYSA-N 382.210 5.063 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c1C 439491308 CNWGVKMQRSILCQ-JOCHJYFZSA-N 393.531 5.867 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443944620 FJBIUKVDWAVVBE-MRXNPFEDSA-N 379.891 5.432 30 20 GKED CC(C)c1ncc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)s1 448141602 GAUFMOBDZDKPKF-UHFFFAOYSA-N 395.459 5.109 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 448518600 FHXXGWXKUBPDDY-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 463744237 IIIVSASDXAXJJJ-YVEFUNNKSA-N 379.262 5.082 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 471283738 UOSYUOCSUXPSIV-SUMDDJOVSA-N 397.519 5.535 30 20 GKED COCCC1(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCCC1 473662722 BPRPVIJLYCFBCG-UHFFFAOYSA-N 393.487 5.069 30 20 GKED CCCc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cnn1-c1ccccc1C 477130304 YGVZXRCUYCSRPZ-HXUWFJFHSA-N 386.499 5.159 30 20 GKED CC1(c2cccc(Cl)c2)CCN(C(=O)c2cccc(SCC#N)c2)CC1 478453429 OYTZQJHZXGGDDB-UHFFFAOYSA-N 384.932 5.150 30 20 GKED N#C[C@@H](C(=O)c1cc2[nH]ccc2s1)c1nc(-c2c(F)cccc2F)cs1 483527359 UDVUIMLYRWJONV-VIFPVBQESA-N 385.420 5.121 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cnn(-c2ccc(C)cc2)c1C(C)C 484813398 VMCBEYOWDRHLBO-UHFFFAOYSA-N 392.503 5.160 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 490338353 DFEGBUKRHFTZGG-LJQANCHMSA-N 387.430 5.329 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@H]1CCCC[C@H]1C 497803788 IXINPCATBZNGAK-HXOBKFHXSA-N 394.490 5.134 30 20 GKED CC(C)[C@H](Sc1ccc(C#N)cn1)C(=O)Nc1ccc(Cl)c(Cl)c1 498141605 JOROZFVGYWDADO-INIZCTEOSA-N 380.300 5.015 30 20 GKED CC[C@@H](C)n1c(SCc2ccc(C#N)cc2OC)nnc1-c1ccccc1 499312938 ZACGLLYCRNAIIT-OAHLLOKOSA-N 378.501 5.089 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)cc1 499849965 WTZUEAPVHJWWKM-LRDDRELGSA-N 379.312 5.164 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Nc3ccccc3C(C)C)n2)cc1 505777295 OJWMMVFWDQMGHO-GOSISDBHSA-N 375.497 5.488 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2cc(Cl)ccc12)c1ccc(Cl)c(Cl)c1 505922513 IDNBIQVTYIPVKA-KRWDZBQOSA-N 392.673 5.052 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1 509564211 PIOKJPSYCHVFRT-NHCUHLMSSA-N 386.948 5.217 30 20 GKED C=C(C)CN(CC)C(=O)[C@H](C)SCc1coc(-c2cccc(Cl)c2)n1 511013716 KTWTWOUXBZQZRS-AWEZNQCLSA-N 378.925 5.041 30 20 GKED C=CCOc1ccc(CNc2ccc3nc(C(F)F)sc3c2)cc1OC 513030878 AWZMWEOMXCHTJS-UHFFFAOYSA-N 376.428 5.419 30 20 GKED N#Cc1c(NC(=O)Cc2csc(-c3ccccc3)n2)sc2c1CCCCC2 514471940 WOWCAOWVRYLMJU-UHFFFAOYSA-N 393.537 5.193 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1sc2c(c1C#N)CCCC2 514499690 GHZJVTRDTWAVMY-SNVBAGLBSA-N 395.311 5.211 30 20 GKED C[C@@H]1CCc2c(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)csc2C1 515540916 GMLWZHAFVJGWJG-YPMHNXCESA-N 385.439 5.108 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(S[C@H](C)CC)cc2C)CC1 518514875 CQOHMQRHWSUMNT-QGZVFWFLSA-N 375.582 5.048 30 20 GKED C[C@H](CNC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 520268113 WKZVSQHKXQQLFL-RTBURBONSA-N 399.494 5.071 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1 521816997 LZVDFEUNSMVLMX-UHFFFAOYSA-N 391.393 5.147 30 20 GKED CCC(C#N)(CC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 528925262 UKQKBQIEPPZFJC-ZDUSSCGKSA-N 392.311 5.623 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)[C@@H](C)C#N)cc2Cl)c(Br)c1 530815595 MFZFFRMLGNULEZ-NSHDSACASA-N 393.668 5.301 30 20 GKED CCc1ccc(N(C(=O)Cc2cccc(C#N)c2)c2nc3ccccc3s2)cc1 531393250 VIJMMRNOGUKFRC-UHFFFAOYSA-N 397.503 5.638 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)cc1 538406510 ILJBETXBBASJOV-WAIKUNEKSA-N 376.887 5.660 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)nn1[C@H](C)C1CC1 538530981 FXRGUDMFZIGCOL-MRXNPFEDSA-N 386.455 5.079 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CC2CCC(C(F)(F)F)CC2)cc1 542162530 KCFRBOBOLBRVAX-UHFFFAOYSA-N 382.426 5.091 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1F 543320592 MUPQMUFEXVUPLX-FXAWDEMLSA-N 399.441 5.056 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(Cc3ccccn3)no2)c1 544922508 RMLOOHKQFFZDEP-UHFFFAOYSA-N 388.814 5.040 30 20 GKED C=C(C)[C@H](Cc1nc(-c2cccc(Oc3ccc(Cl)cc3)n2)no1)OCC 547266699 DETSWUSUFXEPES-KRWDZBQOSA-N 385.851 5.101 30 20 GKED C[C@H](Nc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccccc1 549712900 IHXCBHBKLIYNBQ-SFHVURJKSA-N 381.479 5.667 30 20 GKED C[C@H]1CN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CCC1(F)F 557542601 JLNVTDDITGFEAP-ZDUSSCGKSA-N 390.817 5.121 30 20 GKED Cc1oc(C2CC2)nc1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 568772074 NSXBGVXVYDDCBK-UHFFFAOYSA-N 391.858 5.233 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)C(C)(C)C)cc1 572075294 NKZBGJXLMNWUGK-SJORKVTESA-N 383.454 5.357 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c2[C@@H](C)C1 576005635 QXYTYLRASDDSFV-STQMWFEESA-N 377.469 5.213 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 581376542 LABBFMGAXGOYBJ-OAQYLSRUSA-N 389.499 5.177 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCCC4(CCCCC4)C3)cc2)ccn1 589364294 XIIXOXISXCQWNJ-UHFFFAOYSA-N 390.487 5.324 30 20 GKED N#CCN(C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc(Cl)cc1 592650714 NPXRMKAOZXXMOC-BAUKFBFWSA-N 396.840 5.345 30 20 GKED N#CCc1cccc2c1CCN(C(=O)Nc1ccc(C(F)(F)F)cc1Cl)C2 599737490 KHRGUQFFBNWDBF-UHFFFAOYSA-N 393.796 5.015 30 20 GKED CCCN(CC(=O)Nc1ccccc1-c1ccccc1)Cc1ccc(C#N)cc1 603880813 MQGHOXQTVJFKIC-UHFFFAOYSA-N 383.495 5.076 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)Cc3cc4ccccc4o3)c2)c1 604286507 WQWIFSDYOUITJK-UHFFFAOYSA-N 382.419 5.065 30 20 GKED CSc1ccc(Cl)cc1NC(=O)c1occc1COc1cccc(C#N)c1 608806760 YQGLFRQGGZDWNI-UHFFFAOYSA-N 398.871 5.358 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc2ccccc2n1CC#N 609162566 NPFQZGWNCIBRBB-AWEZNQCLSA-N 385.389 5.017 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)NCc2ccc(C#N)cc2F)cc1 609254393 MFEAWBZEVZPCGP-OAQYLSRUSA-N 379.479 5.042 30 20 GKED CCN(C(=O)[C@H](C)c1c(Cl)cccc1Cl)[C@H](C)c1ccc(C#N)cc1 609581115 JHDAKMQAWXUMLU-ZIAGYGMSSA-N 375.299 5.578 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccsc1 609968256 RMWVYVYPSXMWIF-KUHUBIRLSA-N 380.900 5.799 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl 610106865 ISERJRZPLYWFOT-QZTJIDSGSA-N 384.882 5.139 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 611855946 ILGCBVSMUUSTBP-MRXNPFEDSA-N 375.497 5.189 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(c2ccc(F)cc2)CCC1 619126486 VXJKMHGZRXIPFP-UHFFFAOYSA-N 399.350 5.417 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1coc(C(F)F)c1 626404513 GNGGQLNAOZIPJV-NSHDSACASA-N 387.226 5.269 30 20 GKED O=C(Cc1ccc(F)c(Cl)c1)NC(CCC(F)(F)F)CCC(F)(F)F 628112849 AYNGJYVOWOQJJW-UHFFFAOYSA-N 393.730 5.191 30 20 GKED Cc1ccc(N(Cc2cccs2)C(=O)CSc2ccc(C#N)cc2)cc1 728465776 ZDBDSXDYOMBGNY-UHFFFAOYSA-N 378.522 5.254 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)C[C@@H](CC)c1ccccc1 729069987 OROOYDUQTCUXEZ-CTNGQTDRSA-N 376.500 5.043 30 20 GKED Cc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 729553421 PNTVMVLYRTXMKW-RPWUZVMVSA-N 381.479 5.460 30 20 GKED CC[C@H](NC(=S)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 734376395 HTLRASAXRYCTNB-IBGZPJMESA-N 393.537 5.850 30 20 GKED CC(C)[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccn1 736507872 QLXBUQGZZKZWCV-HSZRJFAPSA-N 385.467 5.067 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1ccc(Oc2cnccn2)cc1 743056069 BTAJWIPILGWFFX-LOEKEGPCSA-N 399.406 5.007 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 743573074 SIVVNYWCHCBPLY-LJQANCHMSA-N 375.472 5.599 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1sc(-c2cccnc2)nc1C 747611383 LSLSXMFLHBZHQW-UHFFFAOYSA-N 391.525 5.473 30 20 GKED N#Cc1ccccc1CN(C(=S)Nc1ccc2c(c1)CCC2)C1CCCC1 747707179 UURMUVZJIAXEPP-UHFFFAOYSA-N 375.541 5.189 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3c[nH]c4cc(F)ccc34)cs2)c1 749453761 VHOYXSGPOCOVAS-SOFGYWHQSA-N 378.428 5.335 30 20 GKED N#C[C@@H](COC(=O)c1ccc(C2SCCCS2)cc1)Cc1ccccc1 750790431 WMOOMXHRQUFITC-KRWDZBQOSA-N 383.538 5.095 30 20 GKED CC(C)(C)OC1CC(CC(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)C1 753992198 ZKMNRDHTEKKIFU-UHFFFAOYSA-N 379.456 5.240 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1nc(Cl)sc1C 762869025 KKTLTHDTYBQKTL-UHFFFAOYSA-N 383.860 5.330 30 20 GKED CCSc1cccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)c1 764567280 KSUIAHWJEDMMOS-MRXNPFEDSA-N 393.295 5.067 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCSc3ccc(Cl)cc32)c1 772983830 MHLYTMISQURENS-FXAWDEMLSA-N 386.948 5.738 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCCc2nc(-c3ccccn3)cs2)cc1 773005204 QBRAZDGEIOYFCM-INIZCTEOSA-N 399.947 5.230 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 773100958 HHXMGMMHFQQZMS-YDHSSHFGSA-N 385.935 5.636 30 20 GKED C[C@@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(OCC#N)cc1 776171902 QWFKJZOFILXVKL-HXOBKFHXSA-N 391.902 5.272 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2cccc(N3CCOC3=O)c2C)cc1 777700469 KNERFFYSUNMERK-MRXNPFEDSA-N 386.879 5.256 30 20 GKED Cc1ccc([C@@H](Nc2ccc(N3CCC(O)CC3)c(C#N)c2)C2CCCC2)cc1 783275846 MIFGNDYIUDGREA-VWLOTQADSA-N 389.543 5.171 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2cc(Cl)cc(Cl)c2)c(-c2ccncc2)n1 788354012 DVVUADJTFMLFFI-NSCUHMNNSA-N 397.265 5.062 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nccc3ccccc23)c(Br)c1 792096693 PYFXKTVMAFGUGC-SFHVURJKSA-N 393.284 5.115 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1OC(F)F 792102561 QFUIVYQQHARUFL-SZEUEKNRSA-N 378.378 5.116 30 20 GKED COc1cccc(C2(C(=O)[C@H](C#N)c3nc(-c4ccc(C)cc4)cs3)CC2)c1 796799293 STKMCOSTXYXBIT-IBGZPJMESA-N 388.492 5.035 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1/S/C(=N/C2CCCC2)NC1=O 799890389 KLAHYLYDYJKKMX-NWLDUTIYSA-N 380.435 5.154 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)c1ccccc1SCC#N 804344967 DKHDCPZXHYSSLC-UHFFFAOYSA-N 379.529 5.243 30 20 GKED COc1ccc2ccccc2c1-c1cc(COC(=O)CCCCCC#N)on1 805696475 GZISTULOXKRHJW-UHFFFAOYSA-N 378.428 5.021 30 20 GKED Cc1cc([C@H](OC(=O)CCCCCC#N)C(F)(F)F)ccc1Br 805929768 PZMIXRIGMUBMSX-HNNXBMFYSA-N 392.215 5.378 30 20 GKED N#C[C@H](C(=O)CC1CCC(c2ccccc2)CC1)c1cc(C(F)(F)F)ccn1 813214104 PDIRTPXQVPMALI-KVWWFHCMSA-N 386.417 5.641 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(N2CCCOC2=O)cc1)c1ccc(F)c(F)c1 815617579 QEKPZBXBPNEBCE-VFNWGFHPSA-N 386.442 5.280 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1 824266067 VFYRRNGLEJJBFN-HNNXBMFYSA-N 398.457 5.052 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2cn(C3CCCC3)nc2-c2ccccn2)co1 844552870 NICAKPCWWJCUOH-ZHACJKMWSA-N 376.460 5.068 30 20 GKED C[C@@H](CC(C)(C)C#N)OC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 851214353 PSMCBCBNHNVCGU-LBPRGKRZSA-N 390.892 5.139 30 20 GKED CC1(C)C[C@H](C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C(C)(C)O1 860478271 UHCGKBNKXJVDME-NWDGAFQWSA-N 396.434 5.085 30 20 GKED C=C(C)C[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 904034120 ZCVBBUBQFPURLM-KRWDZBQOSA-N 377.843 5.089 30 20 GKED Oc1ccc2ccccc2c1/C=N\C1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914703234 RSGPFNJTPCPAIM-ZGEWEMBDSA-N 389.339 5.874 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cccc2ccccc12 916309346 FWUJULKOIYXFDU-UHFFFAOYSA-N 395.487 5.469 30 20 GKED Cc1csc([C@@H](C#N)C(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)n1 916844136 WDPXPTPHFYJVGK-UDKWZTAFSA-N 396.874 5.661 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccco1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917029846 CEGMTTLGFUIERJ-KVWXJIHZSA-N 378.497 5.094 30 20 GKED CC(=NOCc1csc(-c2cccs2)n1)c1ccc(NC(=O)C2CC2)cc1 920400803 SIHWYEJOGGCOTF-UHFFFAOYSA-N 397.525 5.161 30 20 GKED CC[C@H](C)c1nnc(N(CCC#N)CC2CC2)n1Cc1ccc(C)cc1SC 1613194604 YCESNEUTDQMOEJ-KRWDZBQOSA-N 397.592 5.000 30 20 GKED O=C(O)c1ccc(NN=Cc2c3ccccc3c(Cl)c3ccccc23)cn1 1776068668 QRENCGOLYMFGDJ-UHFFFAOYSA-N 375.815 5.186 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C/C(=O)c3ccc(C(=O)O)s3)o2)cc1 1776271490 UFASPZZYNIZLIT-CSKARUKUSA-N 380.465 5.900 30 20 GKED CCCCCCCOc1cccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)c1 1776789123 TUBKJIYLWJJUQN-NBVRZTHBSA-N 396.483 5.848 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3csc4ccc(C(=O)O)cc34)oc12 1776940553 MZDYHASZFWAFCO-SOFGYWHQSA-N 392.432 5.641 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4ccc(C(=O)O)c(O)c4)o3)coc12 1777449011 CPRDHPYPZGDDDT-RMKNXTFCSA-N 388.375 5.301 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)cc1 1777472274 AFFTYJRTJVVFEF-XNTDXEJSSA-N 386.447 5.097 30 20 GKED Cc1ccccc1-n1c(SCC#N)nnc1-c1ccc(Cl)cc1Cl 5355756 ZYAZJVNICHZJJV-UHFFFAOYSA-N 375.284 5.165 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1 7033622 ONLWQCSXGPAJNR-OAHLLOKOSA-N 393.903 5.123 30 20 GKED CC(C)NC(=O)Nc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 30995996 LBKXZITVHXHQSG-UHFFFAOYSA-N 398.466 5.007 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1ccc(F)cc1 31616474 FBJIMEAVNJDGBA-UHFFFAOYSA-N 394.450 5.250 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(-c2ccccc2)cc1 63388640 YQXGWUOASKFGNE-UHFFFAOYSA-N 387.439 5.482 30 20 GKED CN(C(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccc(F)c(F)c1 64311847 DRPYGFDVXXNESL-UHFFFAOYSA-N 394.446 5.405 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnn(-c2ccccc2Cl)c1 66802199 DJEZTSNVEUYPRK-CQSZACIVSA-N 396.903 5.172 30 20 GKED COc1ccc(C)cc1[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 66954204 YTJKXBZLBCSOJZ-CVEARBPZSA-N 383.517 5.281 30 20 GKED O=C(Nc1ccc(F)c(F)c1F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 91916613 UBLQRMLXFUITDB-GFCCVEGCSA-N 380.263 5.058 30 20 GKED CCN(C(=O)COC(c1ccccc1)c1ccccc1)[C@H](C)c1ccc(C#N)cc1 105906848 LFULHBAVXFHHSJ-HXUWFJFHSA-N 398.506 5.274 30 20 GKED Cc1c(C(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)sc2ccc(F)cc12 117206052 AYHMYABWMIGEAF-UHFFFAOYSA-N 399.331 5.306 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2)o1 120922330 RYRLNCSWWSOGRH-HXUWFJFHSA-N 388.471 5.632 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=O)N[C@H](CCC#N)c1ccccc1 151323919 KXQJMTCTSNBZBG-QGZVFWFLSA-N 376.287 5.180 30 20 GKED CCN(C(=O)CCc1nc(C)c(-c2ccccc2)o1)[C@@H](C)c1ccc(C#N)cc1 170943547 FKMABRKYEJCMNS-SFHVURJKSA-N 387.483 5.064 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(CSc2ccccc2C#N)cs1 173709637 VNOQXJSVUGMGDJ-UHFFFAOYSA-N 399.928 5.645 30 20 GKED CC[C@@](C)(NCc1cccc(OCc2cccc(C#N)c2)c1)c1nc(C)cs1 174498549 AKFDQRMLBIGKJC-HSZRJFAPSA-N 391.540 5.317 30 20 GKED CCSc1ccccc1[C@@H](C)NCc1ccc(OC)c(O[C@@H](C#N)CC)c1 180810119 PIOSWOSSPLUOTL-SJLPKXTDSA-N 384.545 5.339 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@]2(CCc3ccccc32)C1 191517660 QSVADESXOVNPEH-VWLOTQADSA-N 390.527 5.244 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@@H](C)CC1 192239984 FIBGLJPFVVBYFB-INIZCTEOSA-N 381.501 5.018 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](C)c1nc(C(C)(C)C)cs1 328799527 HHWFKIQAZQDURS-QWHCGFSZSA-N 393.578 5.165 30 20 GKED CCc1onc(C)c1N=C(O)N1Cc2cc(OC)ccc2C[C@H]1C1CCCCC1 329936757 DIKLRJWLOCWVTK-FQEVSTJZSA-N 397.519 5.107 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@H](C)[C@H](C)CC2 410976500 ATRUJAOMVBQJPE-HTQZYQBOSA-N 399.463 5.342 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)CCc2ncc(-c3ccccc3)o2)s1 411009048 VZNRCJLLBARBNL-UHFFFAOYSA-N 379.485 5.144 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)C[C@H](C)c2c[nH]c3ccccc23)cc1 426464107 ZZZUKUUEGYRTJD-KRWDZBQOSA-N 375.472 5.007 30 20 GKED C[C@@H](NCc1c(F)cc(F)c(F)c1F)c1ccc(OCC(F)(F)F)cc1 430756017 RTSKTIFGBDPWGP-SECBINFHSA-N 381.291 5.035 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc2c3c(cccc13)CC2 437614704 MRJQFEUKVVWCIK-GGAORHGYSA-N 381.479 5.242 30 20 GKED COC(=O)[C@H](Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1Cl 439545000 UQPHLDPIRQUWIU-QGZVFWFLSA-N 377.271 5.121 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)N[C@@H](CCC#N)c2ccccc2)c(C)c1 439678801 QZIXBHFFFOZOSB-NRFANRHFSA-N 376.500 5.126 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4ccc(Cl)s4)cn3)cc2)CC1 448510268 NOOHPLALXAYCTH-UHFFFAOYSA-N 379.872 5.271 30 20 GKED CCC(CC)Oc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 453619653 CQJVSVZOOATMIU-IBGZPJMESA-N 391.496 5.263 30 20 GKED COc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c(C)c1 460162866 KOMZJOGRCVBVCP-UHFFFAOYSA-N 386.451 5.015 30 20 GKED C=CCc1cc(CNC2(c3cccc(C(F)(F)F)c3)CCC2)cc(OC)c1O 462734720 OJSPNHPKCJKFFZ-UHFFFAOYSA-N 391.433 5.317 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2cc(Cl)ccc2OC(F)F)cc1 466777754 UFDWTXVGZNFKNT-UHFFFAOYSA-N 393.821 5.064 30 20 GKED CSc1ccc(F)cc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 467704718 LRRLPKWFZPBTMR-CYBMUJFWSA-N 389.521 5.264 30 20 GKED C[C@@H](Nc1ccc(C(F)(F)F)cc1C#N)c1nc2ccccc2n1C(F)F 467745586 FXZRWFDNAHTWMP-SNVBAGLBSA-N 380.320 5.495 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(N2CCCCC2)cc1 471904417 CVZNSLNAWONRGS-KRWDZBQOSA-N 379.529 5.181 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)CC(=O)c1cn(CCC#N)c2ccccc12 472437185 XWVKMFPEWKCRCG-MRXNPFEDSA-N 379.891 5.084 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4sccc4c3)n2)cc1 473152329 PAKFIMDVXRRGJF-KRWDZBQOSA-N 385.473 5.387 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccccc1OC(F)(F)F 473776267 MNLRFADCSAAQRJ-UHFFFAOYSA-N 399.434 5.238 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccccc1F 474278414 VWRQIPHFFWXXPH-CQSZACIVSA-N 379.275 5.268 30 20 GKED Cc1ccccc1CN(Cc1ccccn1)C(=O)C[C@H](CC#N)c1ccccc1 475596519 RDVARLRQIVYTFF-QFIPXVFZSA-N 383.495 5.006 30 20 GKED CC[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1nc(C(F)(F)F)cs1 481665119 ZNYFFHADTIDVRV-CVEARBPZSA-N 379.451 5.542 30 20 GKED N#Cc1cccc(COc2cccc(CNC3(c4ccc(Cl)cc4)CC3)c2)c1 482019042 LUPKKRFCIDTSCO-UHFFFAOYSA-N 388.898 5.570 30 20 GKED CCOc1ccc(CN(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 482358559 QKHCXVSQCQLAHA-UHFFFAOYSA-N 386.451 5.021 30 20 GKED CC1(C)C[C@@]1(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 484909237 MZWGOOANHFAHSC-QFIPXVFZSA-N 394.471 5.286 30 20 GKED C=CCC1(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)CCC1 485589362 MZTGGNMVJQQXEU-UHFFFAOYSA-N 382.891 5.302 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(Cl)ccc1Br)c1ccccc1 487393152 TZBNIJUZBGZIPN-QGZVFWFLSA-N 391.696 5.267 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 498073916 PNLTZMOTXLVZSK-JOCHJYFZSA-N 378.472 5.335 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)N[C@H](CCC#N)c1ccccc1 500117921 BTGVDPUVYRNCMO-QIJUGHKUSA-N 391.515 5.223 30 20 GKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 502401359 URMVTWPJGSZCEZ-FQEVSTJZSA-N 383.923 6.002 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)c3ccc(Oc4ccccc4)cc3)CC2)cc1 504712763 SECCWZDBFGCFEY-UHFFFAOYSA-N 398.462 5.034 30 20 GKED CCCN(CC)Cc1ccc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cc1 509907850 CZZFSSLFUXBARG-UHFFFAOYSA-N 377.532 5.093 30 20 GKED C[C@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1F 512655665 WEOAWSRANTVTEI-NYHFZMIOSA-N 379.866 5.380 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 518175960 LPCNUUBAMWAJRE-LJQANCHMSA-N 392.549 5.862 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 518256155 NWSLNXCMGZDBTP-VBKZILBWSA-N 399.947 6.007 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)CCCCOc2cccc(C#N)c2)cc1 518362764 XKAFODOCUCJBIZ-QGZVFWFLSA-N 382.529 5.097 30 20 GKED N#Cc1ccc(NC(=O)CNc2cccc(COC3CCCCC3)c2)cc1Cl 519169427 DJXUYSSJGSVRDS-UHFFFAOYSA-N 397.906 5.112 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 519204998 NUVRDUVMDPINSX-NRFANRHFSA-N 381.907 5.285 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C(C)C)cc1 521260909 KAQNUJLLZOPWCU-KKSFZXQISA-N 397.544 5.466 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 521327062 OSYJGRPRLQCMBC-MAODMQOUSA-N 386.520 5.976 30 20 GKED C[C@H]1CCC[C@@](C#N)(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 523970622 SMBISSGMKLNPGI-OYHNWAKOSA-N 393.874 5.206 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(OCC3CCCCC3)CC2)cc1 525735566 UUKOBMZEBSPMOA-UHFFFAOYSA-N 383.536 5.081 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1)c1ccccc1 526979722 ZYIARGFTKASYSX-FQEVSTJZSA-N 380.451 5.027 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc(OCC(F)F)cc2)cc1 538002675 QBZKHWRRBNOTKE-UHFFFAOYSA-N 378.422 5.159 30 20 GKED N#Cc1cc([N+](=O)[O-])cnc1N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 538006102 INELQOQIPPJLRS-OAHLLOKOSA-N 396.756 5.097 30 20 GKED CCN(C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1ccc(C#N)c(Cl)c1 540274008 WSNTUBICUQQILQ-MRXNPFEDSA-N 380.797 5.301 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccoc1)C1CCCCC1 541973213 NJQRIWFOWJKIKI-KRWDZBQOSA-N 397.544 5.898 30 20 GKED Cc1ccc(-c2nnc(CN[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)o2)cc1 542018503 YPKUKDNCDUROTK-SFHVURJKSA-N 394.478 5.435 30 20 GKED CC[C@H](CC(F)(F)F)N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F 544832013 HNWHKJYUQMJPQL-RKDXNWHRSA-N 377.300 5.271 30 20 GKED N#Cc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c(C(F)(F)F)c1 554981218 BKBKYHLJSUFSQB-UHFFFAOYSA-N 394.356 5.248 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCc2cc(F)c(OC)cc21 558800128 CHZNJKKJHWETQH-HXUWFJFHSA-N 382.479 5.495 30 20 GKED Cc1sc(C2(NCc3ccc(CC#N)cc3)CCC2)nc1-c1ccccc1F 559480475 WVXCCBIUKWRJNV-UHFFFAOYSA-N 391.515 5.493 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc2c(F)ccc(F)c2c1 559650897 KDBJKTOJOIADLP-LBPRGKRZSA-N 383.423 5.017 30 20 GKED N#CCCC1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 569002664 CJUOOPBLLDMACZ-UHFFFAOYSA-N 390.350 5.088 30 20 GKED COc1cc(CN[C@@H]2CCCc3nc(-c4ccc(C)cc4)sc32)ccc1C#N 569534632 MMKUMRWOJKVCFM-LJQANCHMSA-N 389.524 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCC2(CCCCC2)O1 577562380 LWNIAWYLEMTLFV-IRXDYDNUSA-N 387.549 5.084 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCCOc1cccc(C#N)c1 579051591 WGENCYFXGZJCNN-QGZVFWFLSA-N 382.529 5.129 30 20 GKED COc1cc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c(C2CC2)cc1Cl 594205110 UQJFZOLDQQIJBN-CYBMUJFWSA-N 383.879 5.323 30 20 GKED N#Cc1cccc(C2(NCc3ccc(-c4ccc(F)cc4)s3)CCOCC2)c1 594984142 NFMQMPJKIVCAFA-UHFFFAOYSA-N 392.499 5.221 30 20 GKED N#CC1(Cc2nc(-c3cc(Cl)ccc3OCC(F)(F)F)no2)CCCCC1 596589960 HJBLJHUTCMUMHX-UHFFFAOYSA-N 399.800 5.348 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H](CCF)C2)cc1F 596778754 NJEWBFCFSWQYKO-HNNXBMFYSA-N 385.414 5.093 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc([C@H](C)OC)c1 606777271 VWHFWWUOUIBREF-ZDUSSCGKSA-N 379.378 5.230 30 20 GKED COc1ccc(CCCCCC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 608935391 SBDBNVBVLKUZBI-UHFFFAOYSA-N 378.516 5.107 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)c1 609063787 BPMIVCLUHMUMTL-UHFFFAOYSA-N 397.261 5.696 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(C)c1 609378309 CDNRPFGIYMTBRD-UHFFFAOYSA-N 378.419 5.580 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCC2(CCCCC2)CC1 609388504 RGJUPPCDNVOOPI-SFHVURJKSA-N 385.577 5.066 30 20 GKED N#CCc1cccc(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)c1 609507067 MPMPMCASSNDPIL-UHFFFAOYSA-N 376.843 5.237 30 20 GKED Cc1csc([C@H](C)NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 609724115 IYGPLHKWXWTXCT-ZDUSSCGKSA-N 397.887 5.260 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c1 610793158 COXVRHPBJYDGRS-KRWDZBQOSA-N 387.487 5.105 30 20 GKED CC(C)(C#N)c1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 614182578 UYUQZJOTFQTQRE-HSZRJFAPSA-N 389.930 5.610 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)oc2ccc(F)cc12 642281801 REZXYQSIMWUCIC-MRXNPFEDSA-N 376.412 5.494 30 20 GKED CC(C)(c1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1)C(F)(F)F 683688585 BUNAVYVKWKJMAT-QGZVFWFLSA-N 382.385 5.565 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3)s2)cc1NC(C)=O 726427218 GYFDXOXLXPJKEP-CLFYSBASSA-N 395.455 5.417 30 20 GKED CSc1nc2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2s1 727222908 KLCSOZYPLUNZDR-UHFFFAOYSA-N 396.541 5.332 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(N(C)C)c(F)c2)ccc1SC(F)F 727653892 BFRGATBTLMVRDB-VMPITWQZSA-N 381.419 5.111 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)/C=C\c2ccc3ccccc3n2)c1 728184980 BYFQZKAAYRGCTQ-PFONDFGASA-N 378.431 5.056 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cc3cc(Br)ccc3o2)cc1 728700949 YPQULFAFLMKBOA-IBSXUBTNSA-N 396.240 5.382 30 20 GKED CCCCCCOCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 730920515 MUKMLMZQEKSNCY-MRXNPFEDSA-N 376.909 5.237 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccc(C(F)(F)F)nc1O 731564473 GIJNRTKXIVAOSK-VMPITWQZSA-N 393.361 5.570 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 733909756 DEVAKKIBCPOHBE-UHFFFAOYSA-N 394.814 5.017 30 20 GKED O=C(Nc1cccc(/C=C2\Cc3cc(F)ccc3C2=O)c1)c1ccccc1Cl 734307594 PJVGGFZTUPRVNH-MHWRWJLKSA-N 391.829 5.554 30 20 GKED CC[C@@H](NC(=S)Nc1ccccc1SC[C@H](C)C#N)c1cccs1 734378424 AKWDVOICXXWHFX-ZIAGYGMSSA-N 375.588 5.438 30 20 GKED C=CC[C@H](NC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1ccncc1 734684838 WTTBDBRCQCEHOA-ZEQRLZLVSA-N 383.495 5.056 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 734965272 IICUPUMTPSFDGX-KXBFYZLASA-N 394.927 6.142 30 20 GKED CCn1c2ccccc2c2cc(N[C@@H](C(=O)OC)c3ccc(C#N)cc3)ccc21 739991987 VCDNYWPGRAYPBX-HSZRJFAPSA-N 383.451 5.012 30 20 GKED Cc1ccc(OC[C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 743294464 KDFOKPNZELTMHX-CYFREDJKSA-N 399.494 5.240 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(-c2ccncc2)cc1 745989965 IGMIFVWENFVLBN-SEYXRHQNSA-N 392.458 5.619 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C(C)=C\c2ccc(F)cc2)cc1 750685958 AAWQMPDACVTPTJ-CXNOYPDYSA-N 378.447 5.090 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 752159467 HIHOFLBNAHKCLW-QZTJIDSGSA-N 382.385 5.624 30 20 GKED Cn1ncc2c1CC/C(=C/c1nc(-c3cc(Cl)ccc3Cl)cs1)C2=O 753900291 MQTGGLIVSLPTDK-POHAHGRESA-N 390.295 5.063 30 20 GKED C=CC[C@H](N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccncc1 766020034 OGXFRUPTLSNADH-QRWLVFNGSA-N 379.529 5.490 30 20 GKED C[C@@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1ncc(-c2ccccc2)o1 769541722 CWOKPDQVHVQJNY-QGZVFWFLSA-N 399.450 5.518 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCc2ccc(Br)cc21 769616052 VJQALOVQKDHOBU-ZROIWOOFSA-N 397.297 5.180 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 776890355 LHZSPLKWLUNZKE-UHFFFAOYSA-N 378.834 5.393 30 20 GKED C[C@H](Nc1ccc(OCc2cn3ccccc3n2)cc1)c1ccc(C#N)cc1F 781423440 VNSHORTZVLLQAT-INIZCTEOSA-N 386.430 5.097 30 20 GKED N#CCC[C@H](NC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccccc1 790900783 HRMYKLVFONLLQP-NRFANRHFSA-N 392.462 5.072 30 20 GKED CC[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1O 796683274 MPXIULBRBYSBMD-RULNRJAQSA-N 387.339 5.482 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C(Cc2ccccc2)Cc2ccccc2)n1 798839199 WROYWBBAALUQLP-NRFANRHFSA-N 388.536 5.544 30 20 GKED Cc1cccc2sc(C(=O)OCCCC3(C#N)CCOCC3)c(Cl)c12 800127288 KYUPCZFSBQZXTI-UHFFFAOYSA-N 377.893 5.121 30 20 GKED C=CCc1cc(CN[C@@H]2CCCc3c2[nH]c2ccccc32)cc(OC)c1OC 808705206 BFMSDOOJWHQMII-OAQYLSRUSA-N 376.500 5.081 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@@H](C#N)C1)CC(C)(C)O2 810258233 SLTCQLXTNPDKJP-GPMSIDNRSA-N 399.535 5.308 30 20 GKED CCN(CC)c1ccc(CN(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 838603920 MWBWFEHHSKWTLT-QHCPKHFHSA-N 392.547 5.109 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1ccc(Cl)s1 916904337 AORLWJUHBPKREZ-AWEZNQCLSA-N 396.855 5.155 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1cc2c(s1)CCCCCC2 916905573 LTAOFPDHKNSWHO-AWEZNQCLSA-N 386.904 5.022 30 20 GKED N#C[C@H](C(=O)Cc1cccc2ccccc12)c1nc2cc(Cl)ccc2s1 917044420 RSYGQEAWIZBMRL-QGZVFWFLSA-N 376.868 5.522 30 20 GKED CCc1ccccc1Oc1ccc(C=NNc2ccccc2C(=O)O)c(Cl)c1 1776030982 GTWKEPLQFURFGO-UHFFFAOYSA-N 394.858 5.839 30 20 GKED Cc1c(NN=C(Cc2ccccc2F)Cc2ccccc2F)cccc1C(=O)O 1776087168 LSKPDIZRDGECQJ-UHFFFAOYSA-N 394.421 5.225 30 20 GKED Cc1c(NN=C(Cc2c(F)cccc2Cl)c2ccoc2)cccc1C(=O)O 1776088394 JDVWGRQBUQBFRZ-UHFFFAOYSA-N 386.810 5.138 30 20 GKED C=C(Cl)C[C@@H](NCc1ccc(Oc2ccccc2CC)cc1Cl)C(=O)O 1776143320 UCWLULAXOSRXOR-GOSISDBHSA-N 394.298 5.380 30 20 GKED C=CCOc1cccc(/C=C\c2cc(C(=O)O)nc(-c3ccc(Cl)cc3)n2)c1 1776184744 JATFYFJFVZFNCB-WDZFZDKYSA-N 392.842 5.230 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cnc(-c2ccsc2)s1 1776354926 LGKSMPSBNYPZTJ-PLNGDYQASA-N 399.493 5.253 30 20 GKED CC(/C=C/C(=O)c1ccc(OCCCC(=O)O)cc1)=C\c1cc(F)cc(F)c1 1776398803 IDDGJOGJYKSXCP-UWRFIAHRSA-N 386.394 5.051 30 20 GKED C[C@H]1C/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2sccc21 1776589561 MOLYTQRFESYMPX-CMHHUMAZSA-N 380.490 5.948 30 20 GKED C[C@@H]1C/C(=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1776589591 OILZWZADHAPWDM-VYVDHXHBSA-N 398.458 5.737 30 20 GKED CC[C@@H](C)Oc1cc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)ccc1OC 1776694868 JDWOZLUIEASYSN-GYZOOYGHSA-N 394.467 5.173 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3ccc(C)o3)cc2)CCC1 1786491905 JMXNATQIQSTZPD-FQEVSTJZSA-N 392.499 5.104 30 20 GKED CCOc1c(Br)cc(Cl)cc1NCc1ccc(C#N)cc1F 10945248 VNKWIIVFLIBFQC-UHFFFAOYSA-N 383.648 5.124 30 20 GKED CCCn1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 24705549 DPSOZIVPQXGTKM-LJQANCHMSA-N 396.947 5.544 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 32291574 YGASNMIBUJFEEI-UHFFFAOYSA-N 391.496 5.278 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3c(C)nn(C(C)(C)C)c3C)n2)cc1 51154355 GJWIWSMWWNNMQN-QGZVFWFLSA-N 392.528 5.177 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N 66800418 LRVYUZIOTYYHGS-IWLLYFRBSA-N 380.513 5.217 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCc1nc2ccccc2s1 66802349 SXRFLFSYPNMSAV-OAHLLOKOSA-N 395.553 5.652 30 20 GKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ncc(C(C)(C)C)o1 177425314 YKBNAKZXQYJOFD-MRXNPFEDSA-N 375.472 5.596 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)c1 178996169 GAVOCIMJVBEBRS-UHFFFAOYSA-N 385.901 5.309 30 20 GKED C[C@H](N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(OCC#N)cc1 181901446 RCXHTBQSBSTMIE-AOMKIAJQSA-N 377.875 5.078 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2ccccc2)n1Cc1ccco1 186213940 TWVDXRNVQMFKRF-UHFFFAOYSA-N 386.480 5.059 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C)c1ccccc1 186975881 BDMRYJQYLBAIEW-JOCHJYFZSA-N 398.506 5.936 30 20 GKED CCCCCCCCc1ccc(-c2oc3ccccc3c2Br)cc1 222675738 MMPNFSSDMFYTGK-UHFFFAOYSA-N 385.345 7.765 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(F)ccc3F)cc2Cl)c1 303227046 WPOJMBOCDJPYIU-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1ccc(C)c(N=C(O)[C@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c1 328682073 CVOMWQADQXVECB-HTAPYJJXSA-N 391.515 5.377 30 20 GKED OC1=Nc2ccccc2[C@H]1C1CCN(C/C(O)=N/CCC2CCCCC2)CC1 328701797 NMOTURLLZZHAKH-JOCHJYFZSA-N 383.536 5.011 30 20 GKED CC(C)(C)CC(O)=Nc1ccc(Cl)c(C(=O)N2CCC[C@@H]3COCC[C@H]32)c1 328857910 KTUUIGMVBLHOII-RDTXWAMCSA-N 392.927 5.005 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@H]3C[C@@]34CCOc3ccccc34)n2)s1 329642429 CUVAAHIVZVWQDA-JLTOFOAXSA-N 397.525 5.212 30 20 GKED CC(C)(C)c1csc(NC(=O)c2ccc(F)cc2Br)c1C#N 410928218 LTEQKUCMKAWXNE-UHFFFAOYSA-N 381.270 5.071 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1nc(C(F)(F)F)cs1 425542042 XSVYLSZIJLNLQD-SNVBAGLBSA-N 393.356 5.095 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccccc1)c1cccc(C(F)(F)F)c1F 429821661 OQASFPWKSBDKKK-ZDUSSCGKSA-N 379.275 5.268 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2coc(-c3ccccc3Cl)n2)s1 430613376 WDJPVOAHXVBJBA-GFCCVEGCSA-N 385.876 5.239 30 20 GKED N#CCCC[C@H](NCC(=O)N(Cc1ccccc1)c1ccccc1)c1ccccc1 433028120 YDIDGPOAHZPGSI-VWLOTQADSA-N 397.522 5.245 30 20 GKED CCSc1cccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 433145150 PAPUPDQVTMVCDX-HNNXBMFYSA-N 385.558 5.515 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 433314266 YUJOEFPZHKFINI-WIYYLYMNSA-N 394.927 5.380 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Sc1nc(-c2ccccc2)co1 436259460 KRXFROWILOGNBB-HNNXBMFYSA-N 384.526 5.099 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 438643060 SNXLUDSROLKDSB-KFWWJZLASA-N 399.482 5.571 30 20 GKED CC(C)c1c(NC(=O)NCC2CCC(C#N)CC2)cnn1-c1ccccc1Cl 441745991 YRQAJDPQLYEAOC-UHFFFAOYSA-N 399.926 5.101 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N(c3ccsc3)C3CCCCC3)on2)c1 448385074 KRSBWWJKPWEHLQ-UHFFFAOYSA-N 377.469 5.254 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(Cl)cc2)c(Cl)c1 455730795 KYEBYTMFHDELLR-LJQANCHMSA-N 388.298 5.819 30 20 GKED CC1(c2ccccc2)CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC1 458803048 QODWBFSJLUXHTE-QFIPXVFZSA-N 375.516 5.185 30 20 GKED Cc1cccc(NC2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)CC2)c1 458803869 RSALMBILBWIBBF-QHCPKHFHSA-N 390.531 5.016 30 20 GKED C[C@@H](C(=O)N(C)[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 464272736 PQJPXBHJQRBQBX-PXAZEXFGSA-N 380.797 5.077 30 20 GKED COc1ccc([C@H](NC(=O)c2sccc2C#N)c2ccccc2Cl)c(C)c1 464636270 KRIPJDWTQXJILF-IBGZPJMESA-N 396.899 5.110 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2c(Cl)cccc2Cl)C2CC2)c(F)c1 464705082 HMFKVAKDGOHWLO-KRWDZBQOSA-N 381.209 5.024 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 464954024 SNUIAYDDUOPKQJ-VPBXCIAMSA-N 380.491 5.242 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(OC(F)F)c1 469276389 UYZCEEVGKHJRBM-HNNXBMFYSA-N 399.441 5.044 30 20 GKED COCCC1(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCCC1 473793572 FWBRJARIJXSWLO-UHFFFAOYSA-N 393.487 5.069 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F)c1ccccc1 476050200 LITZOYTWZOXAIX-AWEZNQCLSA-N 396.796 5.307 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1)c1ccccc1 476209237 QHVHBSKGPYNADG-NRFANRHFSA-N 399.450 5.216 30 20 GKED CC(C)C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1cccs1 481513033 CWQZDHNQJMULOF-HXUWFJFHSA-N 383.561 5.575 30 20 GKED CC(C)OCc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 483440814 QQSOUWZDAPLKSO-UHFFFAOYSA-N 386.451 5.528 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)n2)c1 486306175 VJBLHAIEXNBKBV-CHWSQXEVSA-N 385.901 5.139 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cnn(-c2ccccc2)c1C(C)C 486986141 JFICBCCYYGFEAX-UHFFFAOYSA-N 380.517 5.277 30 20 GKED CCS[C@@H](C)c1noc(CNc2ccc(Oc3ccccc3)c(C#N)c2)n1 488204046 VBUIOIJNOLUXTB-AWEZNQCLSA-N 380.473 5.160 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 488361079 BYSHRXBPHCMNDT-IBGZPJMESA-N 383.879 5.165 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc([C@@H]2CCCOC2)c1 499617096 MQAPYHSLMDLQRP-LJQANCHMSA-N 388.492 5.433 30 20 GKED Cc1cccc(-c2ccc(CNCc3cn(C)nc3-c3ccc(C#N)cc3)cc2)c1 500734561 UVOCLSOKZVDMFW-UHFFFAOYSA-N 392.506 5.224 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 502557350 CIVRBCLYFXCAPX-OPAMFIHVSA-N 399.535 5.003 30 20 GKED CCC[C@@H]1C[C@H](C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 502799516 RZULCDBMUSBWTH-IFMALSPDSA-N 394.490 5.134 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1cccc(OCc2ccccc2C#N)c1 505146055 PUNPAWWPRVVTSA-UHFFFAOYSA-N 399.494 5.072 30 20 GKED Cc1ccc(-c2csc(CNc3ccccc3SC[C@H](C)C#N)n2)cc1 506300345 ZYBASWDOXCLMKX-MRXNPFEDSA-N 379.554 5.982 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1/C=C/c1ccccc1 506683891 UFFDSWWBRHXFEK-JQBOOCOKSA-N 391.540 5.648 30 20 GKED Cc1c(C(=O)N2CCC(c3ncccc3Cl)CC2)sc2ccc(C#N)cc12 507288514 FFTVNLVOJFCWOD-UHFFFAOYSA-N 395.915 5.150 30 20 GKED CSc1ccccc1[C@H](C)NC(=O)c1cn(CCCC#N)c2ccccc12 508288660 NOWYLFHIJGHPGB-INIZCTEOSA-N 377.513 5.158 30 20 GKED Cc1ccc(Cl)cc1C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 510583486 IXSVOOMIHPMHSI-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@@H]1c1ccc(Cl)cc1 511544719 DLFDOYIPTMEJOL-DNVCBOLYSA-N 399.947 5.120 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3ccc(C#N)cc3F)s2)cc1 512648454 NEKRZJKFWWNQAY-ZIAGYGMSSA-N 395.503 5.550 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)c1cccc(COc2ccccc2C#N)c1 513500390 RBJYUKBSQXHQPL-UHFFFAOYSA-N 384.479 5.821 30 20 GKED C[C@@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccc(C#N)cc1 517548979 UANSXDDKOSZRBM-QGZVFWFLSA-N 386.455 5.085 30 20 GKED N#Cc1cccc(/C=C\c2nc(-c3ccccc3OCc3ccccc3)no2)c1 517630113 CGBNIKNUWLONIJ-YPKPFQOOSA-N 379.419 5.358 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(Cl)c1Cl 518755317 FDZGJBLJFRMFOG-LBPRGKRZSA-N 394.327 5.709 30 20 GKED N#CCCC[C@H](NC1CC(c2cccc(Br)c2)C1)c1ccccc1 520851041 RKSQJKIRDGWVTE-MNLRITNHSA-N 383.333 5.720 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(C3CCOCC3)c2)c2ccccc21 529937075 ROPBQDDBMXYTGH-UHFFFAOYSA-N 387.483 5.091 30 20 GKED COc1cc(NC(C)=O)ccc1[C@@H](C)NCc1ccc(-c2ccccc2C#N)cc1 539214394 JOFPYVZWRSIBPJ-QGZVFWFLSA-N 399.494 5.043 30 20 GKED CC[C@H](C)Oc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccn1 540777395 PSUSOVKVUCHDLE-SMDDNHRTSA-N 385.876 5.012 30 20 GKED O=C(N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F)C1CCC1 542159393 CXBZSHMPODAHFR-NSHDSACASA-N 393.249 5.244 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccccc1F)c1ccc(-c2cccc(C#N)c2)cc1 543943085 DFHGFJZBOUTEKY-QGZVFWFLSA-N 387.458 5.267 30 20 GKED N#CCc1ccc(CSCc2nc(-c3cccc(C(F)(F)F)c3)no2)cc1 544082359 FSACYDMFMMRRPM-UHFFFAOYSA-N 389.402 5.255 30 20 GKED C=CCCc1nc(-c2cccnc2Oc2ccc(C)cc2Br)no1 547252277 LDHIBEMRPIYQQW-UHFFFAOYSA-N 386.249 5.113 30 20 GKED COc1ccc2oc(C(=O)N(CCC#N)C34CC5CC(CC(C5)C3)C4)c(C)c2c1 547946207 JLOYUBKJJCYZTG-UHFFFAOYSA-N 392.499 5.075 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1)c1ccccc1 557488061 FQFFJVYHDJYTMJ-VSDWSMLSSA-N 376.500 5.136 30 20 GKED N#Cc1ccc(NC(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)cc1Cl 558226855 BUGKSSOUYMDRMX-LJQANCHMSA-N 389.833 5.305 30 20 GKED N#CCc1ccc(C[S@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 559231946 SHCYHQPPMRFOLY-GJZUVCINSA-N 379.912 5.444 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)NCC(C)(C)CCC#N 572141692 UZBFZLTVZJQSNA-UHFFFAOYSA-N 383.467 5.165 30 20 GKED CC1CCN(CCC[C@@H](NCc2ccc(C#N)cc2F)c2ccc(F)cc2)CC1 585726019 ORZCEFRWBLYUPM-XMMPIXPASA-N 397.513 5.179 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)c1 588840968 XQLLFQMSESEIBG-UHFFFAOYSA-N 381.766 5.092 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(OCC(F)(F)F)c1C 590144526 DKGWWKBRXDVXGD-UHFFFAOYSA-N 396.384 5.295 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)oc2ccc(Cl)cc12 592975812 TVZFOZZAHCAOBW-CYBMUJFWSA-N 384.819 5.634 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(C2(C#N)CC2)cc1 594919240 GKRQPYKFAMXPAK-OAHLLOKOSA-N 391.515 5.664 30 20 GKED Cc1c(CNC2(c3cccc(C#N)c3)CCOCC2)sc2c(Cl)cccc12 594980581 PVFXLQKEWDOMJP-UHFFFAOYSA-N 396.943 5.530 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3sccc3-c3ccccc3)cn2)c1 603626522 AAFPRCGLBNOXBA-UHFFFAOYSA-N 397.459 5.726 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)cn2)cc1 603764811 NCANYQQXZJWNER-HUUCEWRRSA-N 389.377 5.053 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(Cl)cc1Cl 609431369 MAYJJQBRWKEART-ZDUSSCGKSA-N 393.339 5.959 30 20 GKED C[C@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccc(C#N)cc1 610222894 PPZDHNJXNCXKPO-AWEZNQCLSA-N 397.906 5.077 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610352637 VGWXZTKQBITUKV-MSOLQXFVSA-N 399.494 5.355 30 20 GKED CN(Cc1ccc(Cl)cc1Cl)C(=O)N[C@@H](CCC#N)c1ccccc1 610972568 IDVSNQVYTZWPCE-SFHVURJKSA-N 376.287 5.180 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)(F)F)cn3)n2)cc1 613314299 JWMQOSAXZYLONX-CQSZACIVSA-N 387.386 5.022 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccccc1SCc1cccs1 618783131 RFTQOHMKLFKZOX-HXUWFJFHSA-N 390.533 5.329 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)n1cc(Br)cn1 648368506 URQVTCYRKHLPQV-CQSZACIVSA-N 390.325 5.087 30 20 GKED C[C@@H](CC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1cccc(C(F)(F)F)c1 650352302 OZEFYVJRSDVJFR-NSHDSACASA-N 397.334 5.092 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(CC(=O)Nc2cc(C)ccc2C)n1 661115235 AWZFWALUEPKWRY-AZUAARDMSA-N 397.588 5.166 30 20 GKED Cc1cc(C(F)(F)F)nc(NC(CCC(F)(F)F)CCC(F)(F)F)n1 664470348 XUHMXPLEMCTCLK-UHFFFAOYSA-N 383.258 5.269 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)C1 665908038 NCXPCMOWWUNQIA-SFHVURJKSA-N 377.488 5.067 30 20 GKED C[C@H](NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 726460437 BPIDXBKPZOLYOH-HNAYVOBHSA-N 377.538 5.451 30 20 GKED C=CCOc1ccccc1/C=C1/SC(=S)N([C@H](C)c2cccs2)C1=O 726630834 XSWHIUDZEKYHMR-LVLBFHFTSA-N 387.551 5.275 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3\CCc4sccc4C3=O)c2)cc1 726894341 YDZXITFIKLMOSD-GHRIWEEISA-N 389.476 5.222 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3ccc(OC)c(OC(F)F)c3)c(C)c2c1 729150532 KXHSGGYJCQBRRZ-DAXSKMNVSA-N 388.366 5.256 30 20 GKED CC(C)C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 741111776 YLZOAABOEXNCCS-IAGOWNOFSA-N 381.426 5.438 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1C#N 741847400 GFQGATVYZVSUKO-VURMDHGXSA-N 390.420 5.100 30 20 GKED C[C@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccs1 743037064 QOTPSIQUUQTVPA-ZDUSSCGKSA-N 397.500 5.599 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)NCc3cccc(-c4ccc(C#N)s4)c3)c2c1 746289683 QLQHDJONTFCRTA-UHFFFAOYSA-N 399.519 5.326 30 20 GKED O=C(/C=C\c1sc2ccccc2c1Cl)c1ccc(N2CCOC2=O)cc1 748583596 HKIURWDRYKFTNJ-KTKRTIGZSA-N 383.856 5.407 30 20 GKED N#CCSc1ccccc1C(=O)N1CCC[C@H](CCCc2ccccc2)C1 749051563 ZZVZQLYAOGUZSC-FQEVSTJZSA-N 378.541 5.177 30 20 GKED CN(C(=S)Nc1ccccc1C#N)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 758445420 ARUUQOORFLPUIW-HNNXBMFYSA-N 383.826 5.144 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cncc3ccccc23)cc1 764997211 DYZZUPMRAVFPFH-RUZDIDTESA-N 391.474 5.462 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(OCc3cccnc3)cc2)CCCC1(C)C 770419514 OIHNHQXLZUFGQB-OAQYLSRUSA-N 379.504 5.259 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780679011 ZXIVVISNTIJSGJ-XMSQKQJNSA-N 391.515 5.860 30 20 GKED Cc1nc(F)ccc1/C=C\C(=O)c1sc(/C=C\c2ccc(F)nc2C)nc1C 782331280 VRKUHHJONVTWGX-DAOKFOGXSA-N 397.450 5.203 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3ccsc3Cl)SC2=S)cc1Cl 790108491 RVRJROUBVPOTQR-LFYBBSHMSA-N 397.333 5.332 30 20 GKED CC(C)[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccnc1 797944250 AXBHIULQBUVZEV-KDOFPFPSSA-N 397.450 5.099 30 20 GKED N#C[C@H](C(=O)/C=C/Sc1cc(F)ccc1F)c1nc2cc(F)ccc2s1 797947204 ACGHTWSHGVTYFR-BTDICHCPSA-N 390.411 5.196 30 20 GKED C[C@H](N[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 810264254 ZQYMWIRWNLGFQQ-AVRDEDQJSA-N 393.531 5.255 30 20 GKED CC(C)(C(=O)OCC1(CC#N)CC1)c1csc(-c2c(F)cccc2Cl)n1 810599021 LFXCTOUECXYFOG-UHFFFAOYSA-N 392.883 5.117 30 20 GKED C[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCOC2=O)cc1 815634234 GQMLTSCZJGJACH-UZUQRXQVSA-N 389.499 5.023 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCOCC2)cc1Cl 815636159 QKKHSJYJUONAIW-JPYJTQIMSA-N 397.950 5.262 30 20 GKED Cc1cc(NC(=O)N[C@H](C)c2cccc(C#N)c2)ccc1NC(=O)OC(C)(C)C 825967580 INTABBAQBNNWBI-OAHLLOKOSA-N 394.475 5.096 30 20 GKED Cc1cc(CN[C@H](C)c2ccc(C#N)c(F)c2)cc(NC(=O)OC(C)(C)C)c1 834893854 HJQSHGZZHOVDME-OAHLLOKOSA-N 383.467 5.204 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2coc(-c3cccc(Cl)c3)n2)CCC1 899387725 SFSXLXAMPXDORH-RUZDIDTESA-N 376.909 5.108 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915200086 UPWVSFKZSWBECQ-OAQYLSRUSA-N 383.476 5.210 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccccc3OC(F)F)cs2)c1 916140350 NZRCCBFMSFVVOL-KTKRTIGZSA-N 387.407 5.316 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 917428181 ORRDCULJYAHLAE-RMHQSFGDSA-N 378.884 5.743 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cc1 918035981 SDKZOBCWJZNZSP-RPWUZVMVSA-N 399.469 5.850 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1776113612 PKODZMXUZMCKJF-DEDYPNTBSA-N 388.419 5.559 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1 1776125660 PFPMMAPPJMDDPT-XYOKQWHBSA-N 377.440 5.331 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2cccc(SCc3ccccc3)c2)CC1 1776171565 FZEGOSRICZURBL-UHFFFAOYSA-N 395.568 5.612 30 20 GKED CCc1oc2ccccc2c1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776999517 VMUNUPIIGCLYIO-ZHACJKMWSA-N 378.424 5.377 30 20 GKED Cc1cccc2c1OC/C(=C/c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1777459751 KFUBVZDGDMGMHW-WJDWOHSUSA-N 376.433 5.080 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2ccccc2)c(C)c1 10168766 MRTUQAZXRSPAFQ-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1ccc(Cl)c(C(F)(F)F)c1 15294716 UBCSJYMNPVTOIY-UHFFFAOYSA-N 399.825 5.025 30 20 GKED CCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 41537180 MLPDBKKSNPMQCW-LJQANCHMSA-N 388.492 5.212 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 41554385 AOBFXRUPDGQXRH-AWEZNQCLSA-N 387.386 5.022 30 20 GKED C[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 47570349 DDPMSHXUWSATDH-IBGZPJMESA-N 399.494 5.557 30 20 GKED Cc1cc(CNC(=O)C(C)(C)C#N)ccc1Oc1ccc(Cl)cc1Cl 62928377 LUFVDLYXBZNFMY-UHFFFAOYSA-N 377.271 5.260 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)CCCc1ccc2c(c1)-c1ccccc1C2 64388634 IIQGBRBYMUMWKV-UHFFFAOYSA-N 380.491 5.111 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1nc2ccccc2s1 66955231 ROOKPDNEKNFGQM-CYBMUJFWSA-N 382.514 5.012 30 20 GKED Cc1csc(N(C)C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 131082946 YIHPTOHFLHHXIY-UHFFFAOYSA-N 383.860 5.046 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 131097468 CQACPKZCHNZWMO-UHFFFAOYSA-N 395.846 5.215 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(C[S@@](=O)c2ccccc2)c1)c1ccccc1 134932746 ZXKKZBRMTKAYJV-NGOKVRLYSA-N 389.520 5.293 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@H](CSc3ccccc3)C2)cc1 174909201 WGSQVPGJVYVQRZ-KRWDZBQOSA-N 379.529 5.134 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 185219491 MTFVZHYOGDEZCL-SBUREZEXSA-N 398.466 5.361 30 20 GKED COc1cccc(C(=O)/C(=C/c2cnc(-c3cccs3)s2)c2ncc[nH]2)c1 188752047 LSTGJCDFJXCPPJ-WJDWOHSUSA-N 393.493 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2cccc(OCC)c12 189896751 VOFBYTVQQHWIBK-UHFFFAOYSA-N 376.500 5.600 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N[C@@H](C)c2ccccc2)cc1 303184712 YXRFZYMSUJKWSO-INIZCTEOSA-N 387.439 5.242 30 20 GKED C[C@H](c1ccccc1)N1CCC(/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)CC1 328879892 KGVIBAQRFITFGD-MRXNPFEDSA-N 391.515 5.096 30 20 GKED O/C(=N/[C@H]1CCCc2c[nH]nc21)C1(c2ccc(Br)cc2)CCCC1 330128244 NKISGTLRGJDENR-INIZCTEOSA-N 388.309 5.018 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1/C(O)=N/[C@H](c1ccc(F)cc1)C1CCC1 330280560 SOZZMVYRGTYUSE-PMACEKPBSA-N 384.499 5.025 30 20 GKED CC(C)c1cc(Br)ccc1N=C(O)N1CCC(CCC(=N)O)CC1 330723593 YRHDEIVFPDWSQY-UHFFFAOYSA-N 396.329 5.145 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(-c2cccnc2)cc1 426143718 PLJGQAGQRTZAFA-CQSZACIVSA-N 376.847 5.156 30 20 GKED Cc1c(C(=O)Nc2ccccc2NCC(F)(F)F)sc2ccc(C#N)cc12 433109695 LRROMBOOIBOLRQ-UHFFFAOYSA-N 389.402 5.308 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)cc(Br)c2F)c(Cl)c1 435911621 NVSLXNPNPUTWIR-UHFFFAOYSA-N 388.023 5.019 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CC[C@@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 437793912 BZSMZMZYYBNFDH-YJYMSZOUSA-N 387.405 5.501 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(F)(F)F)c(C)c1 438540767 LMRCGBGOTHTVAI-UHFFFAOYSA-N 375.394 5.330 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCC[C@H]3c3ccc(Cl)c(Cl)c3)o2)c1 441210827 UPXHIHGBDOVASW-SFHVURJKSA-N 399.281 5.252 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CC1 441645984 QMGKBNCBCZGCIU-UHFFFAOYSA-N 387.405 5.222 30 20 GKED N#C[C@H](C(=O)c1ncoc1-c1ccccc1Cl)c1nc2ccccc2s1 442601830 HAHFYRCOGSKENE-GFCCVEGCSA-N 379.828 5.095 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1cccc(COc2ccccc2C#N)c1 448512451 AFYQAXRPKAIZKV-UHFFFAOYSA-N 394.833 5.491 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 451423382 RJQQMHNLXSPLDE-LBPRGKRZSA-N 399.350 5.471 30 20 GKED C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 452649484 KCOZFDYDFXOGEY-WMLDXEAASA-N 388.389 5.154 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CCC(C)(C#N)CC3)c(F)c2)cc1 455515779 PLNUJFFZJFNISY-UHFFFAOYSA-N 395.478 5.437 30 20 GKED CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H](C)c1cc2ccccc2o1 458798654 IHWLIFXHLIBMCY-GHTZIAJQSA-N 389.499 5.960 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)c1cccc(C#N)c1 464237055 QVDKSHNKMPUBIY-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1coc(-c2ccc(Cl)cc2)n1 464835231 UOQMIWWLKZXUNA-NHCUHLMSSA-N 377.875 5.267 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3cnccc23)cc1Cl 465031837 LOLMVZMAEVRKEE-QFIPXVFZSA-N 397.865 5.796 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466278811 RCPLUJSFHWBAQI-FQEVSTJZSA-N 388.483 5.160 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(OCc2cscn2)c1 471278344 OQDUPYPZXUUVQO-UHFFFAOYSA-N 393.512 5.332 30 20 GKED CO[C@@H](C)c1nc(CN(Cc2cccc(C#N)c2)c2ccc(F)cc2C)cs1 476829032 MBWOMVQEVNLICE-INIZCTEOSA-N 395.503 5.377 30 20 GKED Cc1oc2ccc(NC(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)cc2c1C 477938633 CVHLCJMJFGMOLU-UHFFFAOYSA-N 383.407 5.361 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1)c1ccccc1 488711663 IHIJQKNFXKGPHQ-OAQYLSRUSA-N 385.467 5.022 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4cc(C)ccc4n3)n2)cc1 497364397 OJIMZNCGTVNOBV-GOSISDBHSA-N 399.475 5.165 30 20 GKED CCN(C(=O)c1cc(F)c(F)c(F)c1F)[C@@H](C)c1cccc(C(F)(F)F)c1 499119912 WSTGMHMHNJOGPZ-VIFPVBQESA-N 393.302 5.485 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)o1 504187773 SQUXJQBRFREBJQ-UHFFFAOYSA-N 395.827 5.459 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H]1c2ccccc2CC[C@@H]1n1ccnc1 505036364 WBHZZMTUJXSDJC-XZOQPEGZSA-N 386.499 5.052 30 20 GKED C=CCC[C@@H](NC(=O)N1CCCCC[C@@H]1c1c(C)n[nH]c1C)c1ccccc1 510630654 TXZXGUNTQQFTAM-NHCUHLMSSA-N 380.536 5.361 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 515598813 CDOBCDPGWNUEFR-SNVBAGLBSA-N 389.318 5.068 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)c1 517099401 ZUSMRMQEQYOJDD-QZTJIDSGSA-N 388.389 5.130 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)ccc1SC 517254240 RGHSMMFXPPFEMH-UHFFFAOYSA-N 392.956 5.450 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 517384914 DWZDFHYGZFHKLD-ZDUSSCGKSA-N 398.322 5.431 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4ncc[nH]4)cc3)cc2)cc1 517668971 NMHDTXUTWXJHLY-UHFFFAOYSA-N 394.434 5.187 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc4c3CCCC4)n2)cc1 518516487 GWOLQWODCJCLCH-INIZCTEOSA-N 394.521 5.249 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1ccccc1C(C)(C)C 519423944 LIKFMELHJSPWBC-MRXNPFEDSA-N 382.529 5.253 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2ccccc2Cl)o1 520148219 SRIZHPWMGLGXDL-UHFFFAOYSA-N 378.859 5.522 30 20 GKED C[C@H]1CC(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C[C@H](C)C1 523542967 RDVJQGGCQBLZNV-IAGOWNOFSA-N 378.541 5.405 30 20 GKED CC[C@H](C)N(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)Cc1ccccc1 532909355 LLPWEOZOVCUXKZ-OALUTQOASA-N 395.572 5.178 30 20 GKED C=CCC[C@@H](NCc1nccn1Cc1ccccc1)c1ccc(C(F)(F)F)cc1 533069280 MGTYNHAKELILNK-OAQYLSRUSA-N 399.460 5.747 30 20 GKED Cc1nc(-c2ccc(CNC(=O)N[C@H](CCC#N)c3ccccc3)s2)cs1 533349610 UCKOBJYDLARKSK-QGZVFWFLSA-N 396.541 5.024 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(C#N)c(F)c2)c2ccccc2OC)cc1 540706465 JWAYDQRKYUQKRZ-UPCLLVRISA-N 390.458 5.155 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)o1)c1nc2ccccc2n1C(F)F 542282148 OCOJRDMDZVXMFZ-CQSZACIVSA-N 377.350 5.181 30 20 GKED N#C[C@H](C(=O)c1cc(F)ccc1Sc1ccc(Cl)cc1)c1ccccn1 544817980 OWMKSJSBNLFVIN-KRWDZBQOSA-N 382.847 5.515 30 20 GKED N#C[C@H](NC(=O)c1scnc1C1CCCC1)c1c(Cl)cccc1Cl 546048655 NDRRWAXSSYFTHS-ZDUSSCGKSA-N 380.300 5.102 30 20 GKED CC1CCN(CCC[C@H](NCc2cccc(C#N)c2)c2ccc(F)cc2)CC1 551271002 IVZINAKVTANAGJ-DEOSSOPVSA-N 379.523 5.040 30 20 GKED CC[C@H](c1ccccc1)N(CC(C)C)C(=O)c1cnc(C(F)(F)F)c(C#N)c1 565112518 MIPJEGXANLSYEX-GOSISDBHSA-N 389.421 5.222 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1c(C(C)C)cccc1C(C)C 568310863 WXPNYHJUQSFTMO-UHFFFAOYSA-N 384.520 5.629 30 20 GKED Cc1c(-c2nc(C(F)(F)c3ccc(F)cc3)no2)sc2ccc(C#N)cc12 577929132 QSJNXHGLINKDAG-UHFFFAOYSA-N 385.370 5.411 30 20 GKED N#CCCC[C@H](NC(=O)NCCc1c[nH]c2cc(Cl)ccc12)c1ccccc1 590918728 SBPZIUIQFJTIPO-FQEVSTJZSA-N 394.906 5.098 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)cc1 598299242 HBZQWPWWWQERIT-UHFFFAOYSA-N 394.359 5.271 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSCc2cccc3cccnc23)c1C 600593577 YFFQXISGCDCENA-UHFFFAOYSA-N 389.524 5.032 30 20 GKED N#Cc1ccc(CSCc2nc(-c3cccc(C(F)(F)F)c3)no2)cc1 603502800 GYTPTDVZWNEVKC-UHFFFAOYSA-N 375.375 5.060 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3cccs3)cc2Cl)cc1 603960710 OQTPPLFOQZXFDO-UHFFFAOYSA-N 383.860 5.387 30 20 GKED C[C@H](S[C@@H]1CCCc2ccccc21)C(=O)N(CCC#N)c1ccc(F)cc1 608801737 MIKFFMRPKSCBTK-HRAATJIYSA-N 382.504 5.272 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 609377181 QKWMTMAWDUNZDA-OXQOHEQNSA-N 384.570 5.694 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(Cc3ccccc3)CC3CCC3)cc2)nc1 609502013 NMVOTDQDWABFRO-UHFFFAOYSA-N 397.478 5.188 30 20 GKED Cc1ccc(CCCCC(=O)NC2CCC(Oc3ccccc3C#N)CC2)cc1 609509209 SNTURPIBKARCLP-UHFFFAOYSA-N 390.527 5.086 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2coc(C3CCC3)n2)cc1Cl 618081821 SLNSNFSAXZDLLE-SFHVURJKSA-N 391.858 5.503 30 20 GKED O=C(Nc1ccc(Cl)cc1F)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618539929 YMWKAHQRKPTKIO-YUMQZZPRSA-N 392.702 5.074 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccccc4F)sc32)cc1Cl 619754459 ABPCJDRRBGUVKF-SFHVURJKSA-N 397.906 5.641 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1ccc(Br)s1 727263964 LLRBVMZZOAUNKN-VOTSOKGWSA-N 376.300 5.530 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1 727709037 SLQKTISTDDIIMH-JOCHJYFZSA-N 399.881 5.658 30 20 GKED Cc1ncccc1/C=C1/CC(c2ccccc2)C/C(=C\c2cccnc2C)C1=O 728785657 MYLYNVRMAHRLSW-WJVNUPORSA-N 380.491 5.707 30 20 GKED CC(C)(C)n1cc(C=NNc2ccc(C(=O)O)cc2)c(-c2ccccc2Cl)n1 731149881 AOXFMWSMZGLIDR-UHFFFAOYSA-N 396.878 5.103 30 20 GKED N#Cc1cccc(OCCCCC(=O)OCc2cc3ccccc3nc2Cl)c1 732397616 ULFFKJIFOSGNKE-UHFFFAOYSA-N 394.858 5.052 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)CCCc2ccc(C(C)(C)C)cc2)c1 733774581 IASTUODQMRRFFH-JOCHJYFZSA-N 392.543 5.304 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)Cc2ccc(C(C)(C)C)cc2)c1 733804623 GJILFPCQUVCUFO-OAQYLSRUSA-N 393.531 5.007 30 20 GKED N#C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C1CCCCC1 734368640 VYOWKGNJSFWFPR-QGZVFWFLSA-N 379.451 5.677 30 20 GKED C=CC[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccncc1 734510713 YUXKXJRQOFDKJY-HXUWFJFHSA-N 393.418 5.328 30 20 GKED Cc1ccc(Cn2nc(C)c(/C=C\C(=O)c3ccc4c(c3)COC4)c2Cl)cc1 742437076 RFYSGSOOSLMBAO-KTKRTIGZSA-N 392.886 5.128 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(Cl)n1 742961673 MKADTDKNKJJOJC-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(Cl)c1 744061349 KDZFAEZNVVDVQL-SCLBCKFNSA-N 391.883 5.315 30 20 GKED COc1cc(C(=O)/C=C\c2coc(-c3ccc(C)cc3)n2)ccc1OC(F)F 748442287 ZFTMWCYRKVBTQQ-HJWRWDBZSA-N 385.366 5.156 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 750691479 RINGRHDBJDGAQT-RCZVLFRGSA-N 395.506 5.672 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1c[nH]c2cccc(Br)c12 754712254 IDKQAFLTUKPHSC-UHFFFAOYSA-N 383.167 5.362 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1ccncc1 756941902 GUDCPZYWQIIGEZ-JOCHJYFZSA-N 383.451 5.101 30 20 GKED N#CCOc1ccc(CNc2nc(-c3ccccc3C(F)(F)F)cs2)cc1 756962760 HKHWTKZWUTVUIA-UHFFFAOYSA-N 389.402 5.343 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)/C=C/c3ccc4ccc(Cl)cc4n3)CC2)cc1 767976844 AEUUIVKAVWMNIU-MDZDMXLPSA-N 399.881 5.089 30 20 GKED Cc1c(C(=O)/C=C\c2cccc(-c3cccnc3)c2)cnn1-c1ccc(C#N)cc1 768489883 ITUIVOVAHHKKQX-XFXZXTDPSA-N 390.446 5.011 30 20 GKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)CCc2ncc(C(F)(F)F)cc21 777467281 JEPYTGFRLAENQT-JYRVWZFOSA-N 386.398 5.436 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C\c1csc(-c3ccccn3)n1)C2 782369851 PIDXCTXLWHMURF-LCYFTJDESA-N 397.297 5.098 30 20 GKED O=C(/C=C\c1cccc2cnccc12)c1ccc(OC(F)F)cc1OC(F)F 782879468 GASYHCUEYGQDFM-DAXSKMNVSA-N 391.320 5.334 30 20 GKED C=CC[C@@H](C(=O)O[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784832612 UXWCDRSYJOCRMC-GOEBONIOSA-N 382.460 5.308 30 20 GKED C=CC[C@H](NC(=O)NC(C)(C)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 785873609 UJFJHNSQPPNHCX-SFHVURJKSA-N 391.437 5.038 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(C(F)(F)F)cc1 792095914 YEEOLXUNPMQHRO-LIRRHRJNSA-N 382.385 5.624 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)cnc2Cl)cc1 793044816 TXDFFGZVVLJIRW-OAQYLSRUSA-N 387.870 5.520 30 20 GKED N#CC[C@@H](CC(=O)OCc1nc2ccccc2c2ccccc12)c1ccccc1 795983114 KDRKNEOJTGHVET-IBGZPJMESA-N 380.447 5.519 30 20 GKED COc1ccc2nc(C(=O)Oc3ccc(-c4ccc(C#N)cc4)cc3)ccc2c1 811880002 ZFNDCKHWYYHITO-UHFFFAOYSA-N 380.403 5.001 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942915 RKVWMANHPIGNAD-YGRLFVJLSA-N 379.312 5.382 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 847433393 BSJAZOGOWCJLNN-MGPUTAFESA-N 386.417 5.119 30 20 GKED Cc1cc(NC(=O)C[C@H](CC#N)c2ccccc2)ccc1NC(=O)OC(C)(C)C 856372235 JFWGZMKSFCKTPT-SFHVURJKSA-N 393.487 5.368 30 20 GKED CC(C)(CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC(F)F 878202428 ODRWLQIZGSWPPB-MYJAWHEDSA-N 383.323 5.084 30 20 GKED CC(=O)Nc1ccc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)cc1 916133587 AYFKHDMFPJJOAY-HKWRFOASSA-N 398.487 5.678 30 20 GKED N#C[C@@H](C(=O)/C=C\Sc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 916977277 OXCXMBAWMJOQHZ-MQNTZWLQSA-N 396.924 5.946 30 20 GKED O=C(O)c1cc(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)ccc1Cl 1776033691 RZFRJXVUISPLQH-LBPRGKRZSA-N 396.796 5.793 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776120230 YTKSSDVYTBKWMV-FMQZQXMHSA-N 384.475 6.245 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cc1)C(=O)O 1776126767 WLULMXCRESLLJP-STKCSNAVSA-N 388.419 5.227 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C(=O)O)c1cccc(Cl)c1Cl 1776180255 KLCJLZRZGKTPIQ-OAHLLOKOSA-N 390.719 5.522 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2cc(C)cc(C(=O)O)c2)cc1 1776787541 SKAMJUBWVJKVMP-UHFFFAOYSA-N 385.529 6.008 30 20 GKED CCSc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)cc1 1776950955 WVOUTBVHRUQANE-POHAHGRESA-N 391.286 5.155 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(-c2ccc(F)cc2)s1 1777268159 LDTVRRNYOMGQNU-TWGQIWQCSA-N 382.412 5.157 30 20 GKED COc1ccc(/C=C2\CC(C)(C)c3ccccc3C2=O)c2cc(C(=O)O)oc12 1777360056 WYRDBBHSSDCOKS-GXDHUFHOSA-N 376.408 5.087 30 20 GKED O=C(/C=C\c1cc2c(O)cccc2s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569394 NMDKKJLYMKPARH-HJWRWDBZSA-N 390.416 5.461 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCc4c(Cl)cccc4C3=O)cc2)cc1 1777671003 QBYKKYWJOSBXDY-XMHGGMMESA-N 388.850 5.918 30 20 GKED CCOC(=O)/C=C/c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 18239897 ZXFJFKAIZKCRRT-DTQAZKPQSA-N 396.446 5.054 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 41502453 XGJILDANQRQQJG-CQSZACIVSA-N 393.468 5.357 30 20 GKED Cc1cccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 47565671 SKGKZONZMMGGHI-FQEVSTJZSA-N 390.874 5.021 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)/C(O)=N/c1nnc(-c2ccsc2)s1 52496264 LYFYNUIIFOJICL-JTQLQIEISA-N 378.910 5.159 30 20 GKED Cc1cc(C)c(NC(=O)CCCSCCOc2cccc(C#N)c2)c(C)c1 56262988 QAAUZUXUZJFWSD-UHFFFAOYSA-N 382.529 5.014 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)cc1 57821098 MRYHZTUHCZRLJZ-UHFFFAOYSA-N 398.491 5.174 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)n2)cc1 66544423 QYWSMYORVKXDTN-KRWDZBQOSA-N 387.464 5.099 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC[C@H]3C3CCC3)c2)cc1 102953261 PDYCZIFYIHHVMJ-QHCPKHFHSA-N 389.499 5.128 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(SC(F)F)cc2)c1 113518993 QPIIBSQMTIEEBC-UHFFFAOYSA-N 377.416 5.328 30 20 GKED COc1ccc(-c2cncc(C(=O)Nc3ccccc3SCCC#N)c2)cc1 129407053 LPHBZAKDLVJVQM-UHFFFAOYSA-N 389.480 5.015 30 20 GKED C[C@H](Sc1ccccn1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 134978767 WGJMNODIGDFRTK-SWLSCSKDSA-N 399.928 5.216 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 137457319 ONSNEKRVFVJPKQ-WIYYLYMNSA-N 393.556 6.067 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 153035766 HMOWKFQIXDXLDO-QFIPXVFZSA-N 386.455 5.361 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCc1ccc(Cl)s1 171740840 CDROQCKMALPPRJ-GFCCVEGCSA-N 379.938 5.017 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)c1ccc(Cl)s1 175465495 QZKANZAZFGSZHQ-CYBMUJFWSA-N 397.887 5.511 30 20 GKED CCn1nc(C)c(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 175617444 XXUNDDBSYVJRFF-UHFFFAOYSA-N 389.459 5.136 30 20 GKED CCCOc1cc(OC)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 188787117 DTMOXGKCHNMTTI-OAHLLOKOSA-N 384.501 5.131 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc(OCC#N)c(OC)c1 189897135 ZTDFUQQPCSHTCO-ACCUITESSA-N 390.483 5.101 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H](C)c1cccc(C#N)c1 190891133 UQHRHNOEBYVHKF-HOTGVXAUSA-N 395.553 5.385 30 20 GKED N=C(O)C1CCN(Cc2cccc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)c2)CC1 328978977 CRNHPQQLBVBNGX-BVYCBKJFSA-N 397.563 5.628 30 20 GKED CCN(/C(O)=N/[C@@H]1CC2(CCCC2)Oc2ccccc21)[C@@H]1CCOC(C)(C)C1 329653911 LLEUGNLGRXPIAU-IEBWSBKVSA-N 386.536 5.017 30 20 GKED COc1ccc2c(c1N=C(O)[C@H]1CCn3c(cnc3C3CCCCC3)C1)CCC2 330084954 CLMHSUCIWZWGAZ-SFHVURJKSA-N 393.531 5.279 30 20 GKED N#CC1(CCSCc2csc(-c3ccc(C(N)=O)cc3)n2)CCCCC1 419402452 QJEVHUWEQCBVMR-UHFFFAOYSA-N 385.558 5.006 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1Cc1cc(F)ccc1F)c1ccccc1 419519880 GVWUOUXNOBAZPJ-UNMCSNQZSA-N 397.469 5.116 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2oc3ccccc3c2CSc2cccs2)C1 424977423 MYBQUNQMGYREHP-UONOGXRCSA-N 382.510 5.209 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H]1CCCc2sc(Cl)cc21 426058879 MSEYZYQIEOQTDD-KRWDZBQOSA-N 385.920 5.048 30 20 GKED CC[C@](C)(C#N)c1nc(C2(c3ccc(Br)c(Cl)c3)CCC2)no1 426593986 BUCOELMKDUSKRT-MRXNPFEDSA-N 394.700 5.147 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1SCCc2ccccc21 428886764 KZFBUVAUVPFCFL-QRWLVFNGSA-N 397.569 5.233 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 430611482 OTUFLISKCZBXJL-OAHLLOKOSA-N 395.553 5.286 30 20 GKED N#Cc1cc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)ccc1Cl 433506601 OLFAZMSIWCPYPN-CCHVVGMOSA-N 382.813 5.299 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCS[C@H]4CCCC[C@@H]43)cc2)cc1 438045131 RAGSPPHCMWDEAH-VXKWHMMOSA-N 392.524 5.045 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1OC(F)F 438640150 FSSMRWMDEAQNFA-JTQLQIEISA-N 399.319 5.061 30 20 GKED CC[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1cc(F)ccc1F 444240299 CYGIOXHNUUAIAG-FQEVSTJZSA-N 381.426 5.104 30 20 GKED CC(C)(C#N)CCCCN1CCC(Oc2cccc(Br)c2)CC1 444678968 YNEZDXMMDXSPCC-UHFFFAOYSA-N 379.342 5.012 30 20 GKED C=CCC1(CNCc2csc(N(C(C)=O)c3ccc(F)cc3)n2)CCCC1 449607866 ZMMRDTXGPJFQDD-UHFFFAOYSA-N 387.524 5.193 30 20 GKED C=CCn1c(COc2ccc(C)cc2)nnc1SCc1oc(C(C)C)nc1C 450876789 PNUQCAMNDJTNSD-UHFFFAOYSA-N 398.532 5.064 30 20 GKED COc1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)ccc1OC(C)C 455165330 UJIPAWDWOCIDFL-IBGZPJMESA-N 381.476 5.039 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccc(-c3ccc(CC)cc3)o2)cc1 463359539 QVMHOVXHIKANLL-UHFFFAOYSA-N 389.455 5.069 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 464273727 HHYFMFFYXSBYHH-NSHDSACASA-N 382.769 5.075 30 20 GKED COc1ccc([C@@H](NCc2ccc(F)c(C#N)c2)c2ccccc2Cl)cc1 467758639 JRSSRARDBPOAOG-JOCHJYFZSA-N 380.850 5.239 30 20 GKED N#C[C@@H]1N(C(=O)c2cc(-c3ccccc3)ccc2Cl)CCC[C@@]12CCCCO2 468119976 JTTDXOWEROKNHA-GMAHTHKFSA-N 394.902 5.074 30 20 GKED CCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1[N+](=O)[O-] 473928597 PFTINCOGNAFHSC-QGZVFWFLSA-N 391.452 5.079 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 476172573 ZAJHPRJNLNYTRX-QHCPKHFHSA-N 384.479 5.429 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1 476790446 HKVFVXIIJUYFKR-LJQANCHMSA-N 391.433 5.099 30 20 GKED CC(C)(C)[C@H]1C[C@@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 480944875 IFFBESCCJJUQGT-GHTZIAJQSA-N 394.540 5.033 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 482023424 ZVMRINXPUSWNAY-LIRRHRJNSA-N 387.405 5.105 30 20 GKED C=C(C)[C@@H](NC(=O)N(CCC)[C@H]1CCCc2cccnc21)c1ccc(F)c(F)c1 483311210 SGBXDBXKBCNLSY-LEWJYISDSA-N 399.485 5.476 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)[C@H]1CCC(F)(F)C1 483652192 SICRLUAMSDZAIY-QMMMGPOBSA-N 389.336 5.437 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(Cc2cccc(F)c2)CCC1 484056678 YCNSBYZGWDMTCF-INIZCTEOSA-N 382.504 5.429 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 487322357 GNICWOFIYKYBRJ-OXJNMPFZSA-N 388.433 5.435 30 20 GKED CSc1cccc([C@H](NCc2cc(C#N)ccc2F)c2ccc(F)c(F)c2)c1 494021766 ZROMLLWWTGZUQP-QFIPXVFZSA-N 398.453 5.577 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1nc2ccccc2s1 494875840 VEJWBZZVEAIPNS-GFCCVEGCSA-N 380.778 5.459 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccc(Cl)cc1 499814225 INXCKKFFOJZMPF-HXUWFJFHSA-N 381.262 5.655 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C)o1 499914599 UWHZATUKASHBQZ-LRGNLBRXSA-N 376.500 5.063 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1cccc(OC(C)C)c1 502590374 DHPLYEYSUIJRBB-OAHLLOKOSA-N 392.952 5.648 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1c(Cl)cccc1Cl 505481346 RJKAHIONQFGHBV-BREBYQMCSA-N 379.209 5.043 30 20 GKED N#CC1CCC(CNC(=O)c2ccc(-c3ccccc3C(F)(F)F)o2)CC1 508358434 ACKZLBRJRDQYNE-UHFFFAOYSA-N 376.378 5.025 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H](C)[C@@H]2C)cc1 510094310 UBLSMCLDVAUEGB-HOTGVXAUSA-N 379.460 5.011 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](Sc2cc(F)ccc2F)c2ccccc2)cc1 517355712 QGTKVMJTRVESON-FQEVSTJZSA-N 380.419 5.309 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCSc1ccc(Cl)cc1 517441149 OSWWZWGUWLFLDI-UHFFFAOYSA-N 390.961 5.857 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 517456750 QCSPUWQMKKKNIB-HNNXBMFYSA-N 384.570 5.676 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccccc1Cl 522182138 WOJHHNBQYBATHW-UHFFFAOYSA-N 397.675 5.462 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 524329362 FVMLAHTYYYJNIY-ROUUACIJSA-N 387.310 5.406 30 20 GKED C[C@H](N[C@H](C)c1cc2ccccc2s1)C(=O)N(CCC#N)c1ccc(F)cc1 527485530 LGTGQAJFWRMEGT-CVEARBPZSA-N 395.503 5.026 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCCc1cccs1 537702590 WGRUYLRPJKWKMZ-UHFFFAOYSA-N 378.522 5.134 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cnc4ccccc4c3)o2)cc1 539710601 UZUPPPWWLILAIZ-UHFFFAOYSA-N 375.453 5.142 30 20 GKED CC[C@@H](C)n1nc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1C 539757521 ZGBVOQUIHCTJRE-MRXNPFEDSA-N 388.471 5.387 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)cc1)c1ccccc1 539785150 FWDHSBOKQKFNSO-OAHLLOKOSA-N 375.859 5.637 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2c(F)cc(Cl)cc2F)c1 540448852 LRAHUUNNYDHKRL-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 541447411 YIUKUUVVDPXPJF-MJGOQNOKSA-N 379.529 5.268 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)c1c(F)cc(F)cc1F 542004339 FLALEIQCJZSYCM-QMMMGPOBSA-N 389.320 5.358 30 20 GKED CC(C)(C)[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 542365289 VZRUNKAWSHIYDH-HXUWFJFHSA-N 391.515 5.232 30 20 GKED CN(C(=O)Cc1ccc(F)cc1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 543106744 ADWVMWWVIYDPLG-INIZCTEOSA-N 393.302 5.149 30 20 GKED CC(C)(CCC#N)CN[C@H](c1ccc(F)cc1)c1ccc(Br)o1 550818657 FHANYYTYVXTJIT-QGZVFWFLSA-N 379.273 5.190 30 20 GKED Cc1nc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)ccc1-c1ccccc1 580803437 KCZLRKNQGZQVMB-XZOQPEGZSA-N 396.494 5.361 30 20 GKED CC(C)(C)n1cc(CNCc2ccc(CC#N)cc2)c(-c2ccccc2Cl)n1 583263517 WWBGXJHRHSOMLV-UHFFFAOYSA-N 392.934 5.314 30 20 GKED CSc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)n1 584137722 BALSONCMHCCMAG-UHFFFAOYSA-N 377.494 5.079 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cn(-c4ccccc4)nc3C)n2)cc1 588349095 VCNIKTKIPQTHSS-IBGZPJMESA-N 398.491 5.103 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(F)ccc1N1CCCCC1 588951822 XZZKLQRDCPBNRJ-UHFFFAOYSA-N 397.494 5.045 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)o1 589541924 VNHYZTNRGZCUNQ-QVKFZJNVSA-N 387.439 5.033 30 20 GKED N#Cc1ccc(N2CCC(c3nc(-c4ccccc4)no3)CC2)cc1C(F)(F)F 589571868 AHKFOSCJLCDTGK-UHFFFAOYSA-N 398.388 5.011 30 20 GKED N#CCCCCC(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 593968035 IQXLSPALHBOXDM-UHFFFAOYSA-N 390.405 5.540 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Oc3ccc(CCOC)cc3)cc2)CC1 601179247 BMXWYJVTGOUGRU-UHFFFAOYSA-N 380.488 5.098 30 20 GKED N#C[C@H](C(=O)c1cc2occc2s1)c1nc(-c2ccc(Cl)cc2)cs1 606146188 LOIPTZUTJSQKMU-GFCCVEGCSA-N 384.869 5.761 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)Nc2ccc(F)c(C#N)c2)c(C)c1 609103387 SRHFICOQOJNDSC-UHFFFAOYSA-N 377.444 5.113 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1 609376546 BYQRIXLKBSVXJT-CQSZACIVSA-N 396.903 5.030 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccccc1S[C@H](C)CC#N 609427783 LBUFPHDCUWJEQP-SJLPKXTDSA-N 394.540 5.538 30 20 GKED Cc1sc2nc(S[C@H](C#N)C3CCCCC3)n(C(C)C)c(=O)c2c1C 609648567 IVYGCFIBVPITOW-OAHLLOKOSA-N 375.563 5.220 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)c1 609731156 OHZDTUJDLCAJSF-HXUWFJFHSA-N 391.858 5.309 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)c1cccc(C#N)c1 610173011 PJVQOJWATZABSO-UHFFFAOYSA-N 397.261 5.934 30 20 GKED CCOc1ccc([C@H](NC(=O)N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 610355470 RSXYAGZPTPUDAA-MHECFPHRSA-N 399.494 5.107 30 20 GKED C=CC[C@@H]1CCCN(C(=O)c2ccsc2NC(=O)c2ccccc2Cl)C1 617784627 VRPMCAMZVFNQMK-CQSZACIVSA-N 388.920 5.082 30 20 GKED CCCCN(C(=O)c1cc(-c2cccc(C#N)c2)no1)[C@H](C)c1ccc(C)o1 619110653 SCJUQNARCIAGGH-MRXNPFEDSA-N 377.444 5.118 30 20 GKED C[C@H](CC(=O)NCc1cc(F)c(C(F)(F)F)cc1F)c1ccc(F)cc1F 622601259 VYVYXCGKZURCAS-SECBINFHSA-N 393.302 5.072 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)nc(-c2ccc(Cl)cc2)n1 677557860 UCTWRDKBYWFPSX-GOSISDBHSA-N 398.853 5.144 30 20 GKED C=CCN(Cc1cccs1)[C@H](C(=O)Nc1ccc(OC)cc1)c1ccccc1 680898292 CMUHUFGWEGGUQV-QFIPXVFZSA-N 392.524 5.125 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2Oc2cccnc2)s1 684676661 YUBASGPOUIAXGH-INIZCTEOSA-N 377.469 5.118 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3csc(-c4ccccn4)n3)c(C)c2c1 729151923 YGCVATUXYDYIJQ-VURMDHGXSA-N 376.437 5.164 30 20 GKED C=C(Br)CNC(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1 729968682 XXWUCYLVLSAOLR-INIZCTEOSA-N 396.737 5.198 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Cl)C12CC3CC(CC(C3)C1)C2 733678701 GNPUFBZUBPJTIL-IXYFNBNHSA-N 396.918 5.150 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@]3(CC=CCC3)C2)cc1 734059585 BBIFFROZIIJBSX-UKILVPOCSA-N 385.511 5.696 30 20 GKED C#CCN(Cc1ccc(F)cc1)C(=O)N[C@H](Cc1ccccc1)c1cccs1 735188992 OPMRKNNJVKAKEQ-OAQYLSRUSA-N 392.499 5.016 30 20 GKED CC(C)(C)c1ncc(/C=C2/Cc3c(F)cc(Br)cc3C2=O)s1 736433430 FMEMXZRUFJAGST-WTKPLQERSA-N 380.282 5.165 30 20 GKED Cc1ccc2c(CCC(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c[nH]c2c1 745952941 OEPMADRBZKERSN-MRXNPFEDSA-N 377.444 5.034 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c(Cl)c1OC 745990216 NZRDIZOMIQVWTC-CLFYSBASSA-N 379.843 5.315 30 20 GKED COC(=O)c1ccc(-c2ccc(/C=C\C(=O)c3c(C)nn(C(C)C)c3C)o2)cc1 746346972 VZTLWRISSRWOSH-BENRWUELSA-N 392.455 5.024 30 20 GKED Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 747904667 NAVTZYBQEUBWPB-MSOLQXFVSA-N 378.522 5.077 30 20 GKED C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 754110267 UGUVTYGPZMESGT-CZTSOZTGSA-N 397.434 5.292 30 20 GKED N#Cc1ccc([C@H](O)Cn2c(-c3c(F)cccc3Cl)nc3ccccc32)cc1 763242195 SRPCAQLFZLFEDZ-HXUWFJFHSA-N 391.833 5.101 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccc(F)c(F)c1 775558221 MGLKKKFFAMNFBV-QMHKHESXSA-N 397.469 5.186 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)Nc2ccccc2O[C@H](C)C#N)c1 780671004 OHPGGBBYHIDGFL-GOSISDBHSA-N 389.455 5.113 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CC=C(c2cccc3ccccc23)CC1 780675263 OTEOQZIYDNHGQT-GOSISDBHSA-N 397.478 5.452 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)cc1Cl 786446581 AGUXNTPRTIOYQS-AWEZNQCLSA-N 375.255 5.078 30 20 GKED CCOC(=O)/C(=C\c1cc(C#N)cs1)c1nc(-c2ccc(C)cc2)cs1 797406613 VSIWMMCWXJDXNN-MFOYZWKCSA-N 380.494 5.155 30 20 GKED O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 801985474 WGMWNUMQSBQLCN-KGLIPLIRSA-N 397.334 5.297 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3ccsc3)C2=O)c(C(F)(F)F)c1 811624800 RJCJDWVKKZITNM-MLPAPPSSSA-N 396.440 5.044 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)cc1 815267766 UYXWFNYNBIGLJE-UHFFFAOYSA-N 379.407 5.115 30 20 GKED Cc1cc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n(C)n1 842892486 FIGLMUFDFZSMHP-JTQLQIEISA-N 383.311 5.191 30 20 GKED c1ccc(N/C(=N/C[C@@H]2CCCO[C@H]2c2ccccc2)N2CCCCC2)cc1 849067845 KGNYPVLAHZUHJX-GMAHTHKFSA-N 377.532 5.108 30 20 GKED CC(C)(NC(=O)c1ccc(C2SCCCS2)cc1)c1cccc(C#N)c1 855363188 XEXCIRUVXDXQSH-UHFFFAOYSA-N 382.554 5.092 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)n2)cc1 860501562 CKLNVKLGOXBBGQ-NJYVYQBISA-N 397.503 5.442 30 20 GKED COc1cc(C=NOCc2cc(Cl)cc3cccnc23)ccc1OC(F)F 914786555 HMSZXFFPCOKARL-UHFFFAOYSA-N 392.789 5.049 30 20 GKED Cc1cc2ccccc2n1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086232 IICFBPWIJYNMGX-HSZRJFAPSA-N 379.463 5.244 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 915103675 BIBJSAUXWCWGJE-HUUCEWRRSA-N 388.414 5.685 30 20 GKED COc1ccc2nc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)ccc2c1 915179265 BSVQECXMGJKYCD-QFIPXVFZSA-N 393.446 5.151 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1cc(F)ccc1Oc1cccc(F)c1 1776012242 KZAPMDZSWXYPNC-UHFFFAOYSA-N 382.366 5.291 30 20 GKED CC(C)(C)C1CCN(N=Cc2cccc(OCc3cccc(C(=O)O)c3)c2)CC1 1776057939 RMRCYKTZIIDCLB-UHFFFAOYSA-N 394.515 5.056 30 20 GKED O=C(O)C(=O)/C(=C/c1ccc(C2CCCCC2)cc1)c1ccc2ccccc2n1 1776117298 SQMWKVOWPUCXJK-LTGZKZEYSA-N 385.463 5.477 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1 1776144195 AYJXTQKEVKGVDJ-JXMROGBWSA-N 377.223 5.066 30 20 GKED CC(C)c1cccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776375375 LAHLORZNFLKMHG-LUAWRHEFSA-N 376.477 6.133 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@@H](CC(=O)O)c2ccccc2)cc1 1776785812 CBDLSDGCFRYHJD-QFIPXVFZSA-N 381.516 5.535 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2cccc(O[C@H](C)C(=O)O)c2)cc1 1776788937 JBNIPVIEMUSTCQ-WTQUMQLASA-N 396.483 5.394 30 20 GKED O=C(/C=C\c1ccc(C(=O)O)s1)c1ccc(Oc2ccc(Cl)cc2)cc1 1777569682 DBYUZISGIIDJBP-LUAWRHEFSA-N 384.840 5.788 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2ccccc2)cc1 10173537 HGMIFLMWQFYAAX-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 15336654 UXLQLGBBGRSHMR-QGZVFWFLSA-N 386.451 5.030 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)Nc1ccc(SC2CCCC2)cc1 30182208 YDYSOXZKDZSHEP-UHFFFAOYSA-N 396.560 5.020 30 20 GKED Cc1ccc(-n2c(SCC#N)nnc2-c2ccc(Cl)cc2)cc1Cl 36184172 BCJGUMNOEVGRSA-UHFFFAOYSA-N 375.284 5.165 30 20 GKED N#C[C@H](C(=O)c1cccc(OCc2cccs2)c1)c1nc2ccccc2s1 41497993 NWWWUBWRPGOHCZ-QGZVFWFLSA-N 390.489 5.427 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1sc2cc(F)ccc2c1Cl 56213106 NPPVHAGENPPBHN-UHFFFAOYSA-N 388.851 5.605 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCSCc3ccccn3)cc2)cc1 66037243 UFTLXQIBMKWBCG-UHFFFAOYSA-N 389.480 5.008 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1F)C1CC1 66955807 OHZCYTMVCOHELE-OAHLLOKOSA-N 383.492 5.416 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1sccc1-c1ccccc1 108239171 HQKHRQKIWLMUJP-OAHLLOKOSA-N 378.522 5.919 30 20 GKED COc1ccc2[nH]cc(C3=CCN(c4c(C#N)cnc5c(C)cccc45)CC3)c2c1 112691930 MVXDEAKZBNDNLB-UHFFFAOYSA-N 394.478 5.199 30 20 GKED CC[C@H](N/C(S)=C(/C(=O)c1ccccc1C)[n+]1ccccc1)c1cccs1 115511117 KBRYAZKHZFIPEI-SFHVURJKSA-O 395.573 5.024 30 20 GKED Cc1ccc(-n2c(SCCCC(C)(C)C#N)nnc2-c2ccccn2)cc1 122683786 KERYTFDIYSCNQA-UHFFFAOYSA-N 377.517 5.060 30 20 GKED CCC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 126544735 TVTRCXUIIJIAKI-GOSISDBHSA-N 375.497 5.383 30 20 GKED CCOCCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC1 132672901 SLLYHYZJLQIEDD-MRXNPFEDSA-N 388.920 5.237 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(CCC(F)(F)F)cc1 159194380 RKUUFWKGIIGXTI-UXHICEINSA-N 386.417 5.093 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 174104396 FIEVGTDAIPBKIY-OAHLLOKOSA-N 394.525 5.118 30 20 GKED CC[C@@H](C)c1ccc([C@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 175502562 GVSJBUZPLWTFIN-UZUQRXQVSA-N 388.515 5.609 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc(C2(C#N)CC2)cc1 179823615 MAQXBJDFQFKRKI-OAHLLOKOSA-N 387.508 5.165 30 20 GKED Cc1ccc(F)cc1CSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 187535046 TVHNWKPRFVIGNM-HNNXBMFYSA-N 388.533 5.400 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(=O)c1ccc(OC)cc1 188069266 BADYOLJAAONGBE-UHFFFAOYSA-N 379.500 5.539 30 20 GKED C=C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)CC1 208847609 WXGMYUQIGXDOCX-BMRADRMJSA-N 386.520 5.575 30 20 GKED N#CCc1ccc(NCc2cccc(NC(=O)c3ccc(Cl)cc3)c2)cc1 237872587 XZNZEAADKOAODF-UHFFFAOYSA-N 375.859 5.270 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H](C)c1cccc(F)c1 304106181 YRFMWNMDCGFGKL-KRWDZBQOSA-N 388.442 5.327 30 20 GKED Cc1csc(C(C)(C)/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)n1 329442373 LECCBNOWKHVDHP-INIZCTEOSA-N 386.565 5.150 30 20 GKED O/C(=N/[C@@H]1CCCOc2ccccc21)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329484178 SFCAJCZIDHPUHB-WIYYLYMNSA-N 393.531 5.364 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 432463138 MJQHUGKMXRGLJQ-INIZCTEOSA-N 395.812 5.915 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCC(F)(F)F)cn1 433891175 BVBAVIXOCXGAIS-UHFFFAOYSA-N 378.394 5.127 30 20 GKED CCCN(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 438511644 HBLFGYWBRGMPJB-UHFFFAOYSA-N 377.366 5.243 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 444401443 YGYIRIHVSILFJQ-NSHDSACASA-N 396.249 5.691 30 20 GKED CC(C)[C@@H]1CCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 446223763 BDOZKHKQDDUCCS-QHCPKHFHSA-N 391.515 5.374 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc(C2CC2)nc2ccc(F)cc12 463528959 ZIXYIDJPIGKWDV-UHFFFAOYSA-N 387.458 5.174 30 20 GKED C[C@@H](C(=O)Nc1ccccc1OCc1cccc(Cl)c1)c1cccc(C#N)c1 463943302 DTIVDPRTNZNUQF-MRXNPFEDSA-N 390.870 5.533 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2OC3)n1 474435915 CGJJXPOFCAOHRU-CQSZACIVSA-N 380.494 5.377 30 20 GKED CC(C)c1cccc2c1CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C2 474706059 GOOYBUNZYXPYSQ-KRWDZBQOSA-N 393.556 5.652 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1 479606312 ZANRIJUHGAUPRL-NRFANRHFSA-N 387.508 5.328 30 20 GKED C=C(C)[C@@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccc(F)c(F)c1 481592574 CZPHOCFSIQWXSP-HSZRJFAPSA-N 392.449 5.624 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](CCc2ccccc2)C(F)(F)F)cc1 481614919 SDSKMBLWRSZJAP-SFHVURJKSA-N 389.421 5.173 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1OCCC 483207429 ZVLFJNLKOXEDTN-HXUWFJFHSA-N 388.467 5.302 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1nc2cc(C(F)(F)F)ccc2o1 483223771 WQUNNEVZRWPHEM-FUHWJXTLSA-N 385.389 5.118 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1 483628321 YTFAHTKDZKBCJS-OXJNMPFZSA-N 397.519 5.979 30 20 GKED CCc1c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cnn1C(CC)CC 485641246 GKROHSRWBPUBPX-MRXNPFEDSA-N 393.318 5.108 30 20 GKED Cc1cc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)ccc1C#N 488983307 MOVDPNFWEPXNMC-KRWDZBQOSA-N 386.339 5.669 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1 502682837 XGQRIERXBBLHPT-UHFFFAOYSA-N 397.784 5.685 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)cc1 505328257 DRPIATRQPYQXNX-UHFFFAOYSA-N 385.769 5.098 30 20 GKED COc1ccc(-c2cnc(CSc3nc(-c4ccccc4)ccc3C#N)o2)cc1 510200036 QYXMWUOPEHGKPE-UHFFFAOYSA-N 399.475 5.576 30 20 GKED CCN(C(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccc(C#N)cc1 510430623 UCGJFRRCFOSJBI-AWEZNQCLSA-N 395.915 5.294 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c(F)c1 513200394 IYOCPUPRYYHYDX-MRXNPFEDSA-N 389.430 5.237 30 20 GKED C=CCn1c(SCCC(=O)Nc2ccccc2SC)nc2ccccc21 515340995 MQLAABNSAOAKFF-UHFFFAOYSA-N 383.542 5.065 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Sc2ccc(F)c(F)c2)c2ccccc2)cc1 517301132 MFQUSHAXNFHSLG-NRFANRHFSA-N 394.446 5.503 30 20 GKED CC(C)Oc1ccccc1CNCc1cccc(OCc2ccccc2C#N)c1 517537028 BUFHYUBNNUUBIQ-UHFFFAOYSA-N 386.495 5.214 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1ccc(C#N)cc1 518042323 HTMYIERFWYCBML-GFCCVEGCSA-N 381.888 5.135 30 20 GKED N#CCCSc1ccccc1NS(=O)(=O)c1ccccc1-c1ccccc1 518111962 CUFGHRIUOWYXML-UHFFFAOYSA-N 394.521 5.160 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCCOc1cccc(C#N)c1 520315120 DMVONDFDZJSKGR-QGZVFWFLSA-N 393.512 5.140 30 20 GKED CC[C@@](C)(C#N)c1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 520656312 LOBAPSIJXPWLKS-SFHVURJKSA-N 388.349 5.134 30 20 GKED COc1ccccc1[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccccc1 522408825 UXXFFMBZPRRKBD-LJQANCHMSA-N 383.373 5.182 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCc1ccc(Oc2ccccc2)cc1 522460976 CLFXUSBILKETRO-UHFFFAOYSA-N 397.478 5.248 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1occc1COc1cccc(C#N)c1 523272093 DTPKICJKKAKVQL-UHFFFAOYSA-N 390.439 5.078 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3cccc(F)c3C)o2)cc1 523738679 FVDCFMFNENIHNT-UHFFFAOYSA-N 379.435 5.314 30 20 GKED N#Cc1cccc(-c2nnc(CSc3ccc(Cl)c(C(F)(F)F)c3)o2)c1 525624167 PBDUXFIDWQHBTL-UHFFFAOYSA-N 395.793 5.573 30 20 GKED CC[C@@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1SC[C@H](C)C#N 533256204 DTLRLAPMDWDFTM-NQIIRXRSSA-N 395.572 5.350 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](CCC#N)c3ccccc3)s2)cc1 536835486 ZGRAPVWKIWWYIS-UTKZUKDTSA-N 375.541 6.123 30 20 GKED CC(C)Oc1cc(Br)cc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c1 537456562 ZSSFGUCEMODOTP-UHFFFAOYSA-N 399.288 5.044 30 20 GKED C=CCN(C(=O)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1)C1CC1 537878433 JGLATJZIPXPTFF-UHFFFAOYSA-N 383.197 5.117 30 20 GKED CN(C(=O)c1ccc(Cl)c(C#N)c1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 538266639 DCIJICSQKMWAOJ-HNNXBMFYSA-N 387.188 5.241 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 539049438 JEJYLGAQFIXPJU-LPHOPBHVSA-N 391.496 6.019 30 20 GKED N#Cc1ccc(SCc2ccc(Oc3ccccc3)nn2)cc1C(F)(F)F 542937395 HPCQMIVQMYRDKZ-UHFFFAOYSA-N 387.386 5.452 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 549053999 WYAPIVVBJFTLRP-JOCHJYFZSA-N 384.483 5.147 30 20 GKED CCCOc1c(Cl)cc(CNC2(c3cccc(C#N)c3)CC2)cc1OCC 551229982 FRGNJVFXAOLYCV-UHFFFAOYSA-N 384.907 5.178 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC=C(c3ccncc3)C2)cc1 552413288 URJXXLDJFGLBDY-UHFFFAOYSA-N 397.503 5.034 30 20 GKED CC1=C(c2ccco2)CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 554875999 BJEIXAZXHDXMLO-HNNXBMFYSA-N 381.501 5.243 30 20 GKED C=C[C@](C)(CCOC)c1nc(-c2ccnc(Oc3ccccc3Cl)c2)no1 564248889 KMJRPPJSDMOPKG-HXUWFJFHSA-N 385.851 5.058 30 20 GKED N#CCc1ccc(CN2CCc3nc(-c4ccccc4Cl)sc3C2)cc1 567142774 ZYJIUPYTOMPRNH-UHFFFAOYSA-N 379.916 5.088 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Br)c(Cl)c2Cl)ccc1F 568892356 GMVLQFRAILVPTD-UHFFFAOYSA-N 388.023 5.019 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1-c1ccccn1 571381647 XMJWGGYVGOQDGM-INIZCTEOSA-N 391.496 5.001 30 20 GKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(Oc2cccnc2)cc1 575354040 MTTDZJHJZLQNOW-ZDUSSCGKSA-N 384.361 5.332 30 20 GKED C/C(=C/c1ccc(C)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 588401969 JXMQNBNLUPJLFV-VZEGMYIASA-N 383.476 5.270 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1nc(-c2ccsc2)oc1C 588786692 PIITURXSNCWGFP-UHFFFAOYSA-N 392.933 5.184 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589363609 KQWUAVDSLSEUOF-HSZRJFAPSA-N 398.466 5.287 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 590077433 NGGYXTDLZWDJOE-UHFFFAOYSA-N 375.472 5.221 30 20 GKED CC(C)Oc1ccc(CC#N)cc1-c1cc(F)ccc1OCC1CCOCC1 592982777 BOIHOGOELZOQKQ-UHFFFAOYSA-N 383.463 5.151 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc(C)c1OC(F)F 594362868 BPARCBKTMLBTBP-CYBMUJFWSA-N 390.386 5.144 30 20 GKED C[C@H](CC#N)C(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 596714504 ROGNTXKMVWHUTF-IIDMSEBBSA-N 391.902 5.406 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ncccc1Cl 600640233 IJEOHNMYYIFXEW-CYBMUJFWSA-N 391.949 5.001 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1ccc2ccccc2n1 603532836 XZFJFOXPXQVVLQ-UHFFFAOYSA-N 395.437 5.401 30 20 GKED N#Cc1cccc(COc2cccc(CNC3(c4ccc(F)cc4)CCC3)c2)c1 608837297 ZYRURYDBAJFTSU-UHFFFAOYSA-N 386.470 5.445 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1ccccc1SCc1ccc(C#N)cc1 608879288 HUJDCKWEJJZANX-UHFFFAOYSA-N 392.446 5.265 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2ncsc2c1 609061941 LKWMIMBPPBJLFX-UHFFFAOYSA-N 399.475 5.308 30 20 GKED CC(C)(C#N)C(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 609066025 AFQWDZYLZBMGLM-UHFFFAOYSA-N 383.810 5.308 30 20 GKED CCc1ccc(N(C(=O)c2ccc(C#N)cn2)c2nc3ccccc3s2)cc1 609342640 NLXRZHLJMINPBE-UHFFFAOYSA-N 384.464 5.104 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)c1 609427197 UDBNIXUMYYOFSZ-HZPDHXFCSA-N 388.389 5.658 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609504415 QFQKHFZDFMIJGA-UHFFFAOYSA-N 398.466 5.225 30 20 GKED COc1ccc(COc2cccc(F)c2)cc1N[C@H](C)c1ccc(C#N)cc1 609825239 MADVJMJSCDBURA-MRXNPFEDSA-N 376.431 5.458 30 20 GKED C[C@H](NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)c1cccc(C#N)c1 610317802 CEJGYAPHPMBHPK-HNNXBMFYSA-N 398.491 5.718 30 20 GKED CC(C)C(NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(C)C 610900857 NHJXLIVWJDFNRW-UHFFFAOYSA-N 379.504 5.134 30 20 GKED Cc1cc(-c2nnco2)ccc1NCc1cccc(OCc2ccccc2C#N)c1 610910140 GHUVPAYPHYVKAO-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C[C@](C#N)(NC(=O)c1sc(-c2ccccc2)nc1C(F)F)C1CCCCC1 611186274 IAAJBXBJYWDDJA-HXUWFJFHSA-N 389.471 5.340 30 20 GKED CC(C)(C)[C@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361878 JHFPTFJIKWVOCA-VQIMIIECSA-N 381.442 5.128 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SCc1ccco1)c1nc2ccccc2s1 613289628 XUDRQZNDPQQCPM-INIZCTEOSA-N 390.489 5.672 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2)n1)c1nc2cc(Cl)ccc2s1 613403563 QJGWRLMYOKGXDX-ZDUSSCGKSA-N 395.896 5.563 30 20 GKED CSc1ccc(-c2noc([C@@H]3CCCN3c3ccc(C#N)cc3)n2)c(Cl)c1 615133197 OZYXDJWVKJEHQM-SFHVURJKSA-N 396.903 5.325 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2CCC(F)(F)F)cc1Cl 619789618 KKBNXHPYUVVRKG-UHFFFAOYSA-N 381.785 5.028 30 20 GKED Cc1cc(N(CCC#N)C(=O)CSc2cccc3cccnc23)ccc1Cl 619849751 FNSATRVUXYODPJ-UHFFFAOYSA-N 395.915 5.236 30 20 GKED Cc1cccc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C)c(Cl)c12 642280923 KEIZUYZYLHFCIW-GFCCVEGCSA-N 379.872 5.240 30 20 GKED CCCCc1nc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)no1 647633984 JKXRGPAGGSBVIW-UHFFFAOYSA-N 399.310 5.314 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCC(=O)c3ccccc32)cc1 670776243 IGHKMKSDGANYRJ-OAQYLSRUSA-N 382.419 5.049 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(-c3nc4ccccc4s3)cc2)c1 726441648 QALKGQQBLPAKNI-UHFFFAOYSA-N 385.517 5.754 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)[C@H](C)c2ccc(Cl)c(Cl)c2)c1 726475350 IQYWOFRQCNTAMP-CQSZACIVSA-N 391.367 6.145 30 20 GKED C[C@@H]1C[C@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC(C)(C)C1 727631427 DYAVNCLYEYIIEA-SZVBFZGTSA-N 391.540 5.711 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc1Cl 730417363 MZGODMPFQYXMQV-RISCZKNCSA-N 388.851 5.041 30 20 GKED N#C[C@@H](C(=O)CC[C@H]1CCCCO1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 732496213 QFMGSZDJXNLWIU-MYDUQWEHSA-N 398.572 5.136 30 20 GKED C[C@@H]1CCC[C@H](OCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 733053250 ZQRUQGOVKILUMF-KWCYVHTRSA-N 396.434 5.087 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccncc1 734654762 YESCWNVWYUHJNA-FCHUYYIVSA-N 391.902 5.441 30 20 GKED C=CC[C@H](NC(=O)N(Cc1c(Cl)cccc1Cl)C1CC1)c1ccncc1 734682197 AZLMUGUYKUWJIN-IBGZPJMESA-N 390.314 5.380 30 20 GKED CC(C)[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccn1 736507874 QLXBUQGZZKZWCV-QHCPKHFHSA-N 385.467 5.067 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1[N+](=O)[O-] 741842728 MQJKVTGAZZHAGW-WAPJZHGLSA-N 397.374 5.154 30 20 GKED CCCCC/C(C=Nn1c(S)nnc1[C@H]1CCCCO1)=C/c1ccccc1 743451369 FCBQRZXTTCCTGL-BTEMFIKYSA-N 384.549 5.306 30 20 GKED C#CCN(C(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1)C1CCCCC1 744001496 PZXXUHZFZKHBGX-UHFFFAOYSA-N 399.494 5.120 30 20 GKED COc1ccc(CCC(C)=NOCc2ncc(-c3cccc(Cl)c3)o2)cc1 744179462 VRULDKKNSUNQOM-UHFFFAOYSA-N 384.863 5.529 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccc2ccccc2c1 745724836 YWZSPEIVIPYNSZ-UHFFFAOYSA-N 393.515 6.115 30 20 GKED C=CCN(C(=O)N[C@@H](c1ccc(OC)cc1C)c1ccccc1Cl)C(C)C 745912637 VFPSMUWUWSVZFX-NRFANRHFSA-N 386.923 5.352 30 20 GKED CCc1cnc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 747536967 HBGVPNJBPCLPCX-FQEVSTJZSA-N 390.512 5.025 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 749488170 UBVOWFBNOBVIQO-FQEVSTJZSA-N 397.434 5.080 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C(C)=C/c2ccc(F)cc2)cc1 750685960 AAWQMPDACVTPTJ-RCAIIDNGSA-N 378.447 5.090 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cc1OC 750896511 QQOHNBLKBCWXGB-YVMONPNESA-N 381.255 5.305 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(C)c3ccccc3C#N)cs2)cc1 752819566 NTRVRQIBSYFBJQ-UHFFFAOYSA-N 375.497 5.011 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)CCSc2ccc(Cl)cc21 753145212 XDGQTFBGGNYNQK-FMIVXFBMSA-N 384.913 5.621 30 20 GKED CC(C)c1ncc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)s1 758363961 FGIDVNIIFJHWEN-UHFFFAOYSA-N 398.344 5.003 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(N3CCCC3=O)c(Cl)c2)CC1 770408046 GRGIXUWNDSDCDD-UHFFFAOYSA-N 393.918 5.283 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3COc4cc(C)c(C)cc43)n2)cc1 770848145 SGIVWYJLBQBZGR-OALUTQOASA-N 388.492 5.088 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 774450229 SFXDHXIGIAZOTA-UWJYYQICSA-N 389.326 5.915 30 20 GKED N#C[C@H](C(=O)Cc1cccc(F)c1F)c1nc2cc(C(F)(F)F)ccc2s1 775226538 FULALQVPFHAWQI-LLVKDONJSA-N 396.340 5.012 30 20 GKED Cc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1C(=O)N(C)C(C)C 775234451 RSDYOXHFNVPVKM-UHFFFAOYSA-N 379.287 5.238 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)Nc3ccc(F)cc3OCC#N)o2)c1 776335264 UNCWCJAMCSTMHJ-UHFFFAOYSA-N 378.403 5.364 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)OCc3cccc(C(F)F)c3)cc2)nc1 791754917 HHCMIHNCHXYGIG-UHFFFAOYSA-N 380.350 5.040 30 20 GKED N#CCOc1ccc(CC(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 791973999 LAJFJOKWEJJGCB-UHFFFAOYSA-N 376.843 5.091 30 20 GKED O=C1/C(=C/c2ccc(C(F)F)cc2)COC/C1=C\c1ccc(C(F)F)cc1 794943377 YFYQFIPHFAQUDE-BEQMOXJMSA-N 376.349 5.628 30 20 GKED C[C@@H]1[C@H](C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)[C@H]1c1ccccc1 797551648 MXEJVLRAWLMKCY-BXOLDHOESA-N 394.446 5.314 30 20 GKED N#C[C@H](C(=O)CCCC1CCOCC1)c1nc2cc(C(F)(F)F)ccc2s1 798815889 CBYLVCNOSCYGOV-CQSZACIVSA-N 396.434 5.088 30 20 GKED O=C1/C(=C\c2ccc(SC(F)(F)F)cc2)C[C@H](C(=O)O)c2ccccc21 806561209 SHCDJOBSUPACSJ-CKDIWJPDSA-N 378.371 5.137 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)ccc2c1 813215205 UDQHYTTVZKNOSJ-ORAYPTAESA-N 398.384 5.242 30 20 GKED Cc1cccc(C)c1-c1cccc(OC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c1 813306489 XILWYIODCZVDAL-QFIPXVFZSA-N 380.447 5.130 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1sc(Cc2ccccc2)nc1C 814822358 XNPDQHQPYUBRNX-UHFFFAOYSA-N 393.516 5.036 30 20 GKED CC(C)(C)OC(=O)N[C@H](C=NOc1ccccc1C(F)(F)F)CC1CCC1 814888346 WBZQASMLJDHJJH-AWEZNQCLSA-N 386.414 5.154 30 20 GKED N#CC[C@H](CC(=O)OCC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 816477399 YEAAKBXNTFITRL-MOPGFXCFSA-N 375.390 5.353 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 821444057 AULTVODBISLMOY-UHFFFAOYSA-N 386.517 5.036 30 20 GKED C[C@@H](c1cccs1)N1C(=O)/C(=C/c2ccc(C3(C#N)CC3)cc2)SC1=S 849173058 BNQZSSWDJGMCAO-MFVBVHDHSA-N 396.562 5.266 30 20 GKED CC(C)c1cccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(SC(F)F)cc2)c1 850755790 IQNPYTUNJHJTQT-KRWDZBQOSA-N 388.439 5.086 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@]23CCCC[C@H]2C3(F)F)cc1 850762158 VXOCPSPUUVROMT-IBRSFNOQSA-N 388.458 5.063 30 20 GKED CC(C)(CC(F)(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 850770087 XBIAKNHOKPVQPM-VIFPVBQESA-N 394.340 5.470 30 20 GKED Cc1cc(C(=O)N(O)Cc2cccc3ccccc23)ccc1NC(=O)CC(C)C 901371168 OCOIEPSGJZIWBF-UHFFFAOYSA-N 390.483 5.164 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=C[C@H]1CC=CCC1 916272848 LETLSCHLJFQXKG-AWEZNQCLSA-N 383.904 5.277 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2ccc(F)cc2s1 916904219 YOGJPHWUIXLMJO-KRWDZBQOSA-N 394.471 5.126 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNc1ncccc1Cl 917549558 SYOYEROPPZRMTK-UHFFFAOYSA-N 394.693 5.041 30 20 GKED Cc1cc(C)cc(OCCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 919904816 UJTDQTQBAIARHQ-XMMPIXPASA-N 399.494 5.159 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc2ccccc2c1F 1776355533 YHMXPASQIHYFPL-LUAWRHEFSA-N 378.399 5.360 30 20 GKED CCCCCCCSc1ccc(C(=O)N[C@H](CC(=O)O)C2CCCC2)cc1 1776787533 QWSLYTRTTCYKPQ-HXUWFJFHSA-N 391.577 5.512 30 20 GKED COc1cc2ccccc2cc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777339131 PCQSYWFFHTZBID-KHPPLWFESA-N 398.414 5.703 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)o1 1777424590 VSNOKURCEWBIBY-ACQXMXPUSA-N 376.383 5.232 30 20 GKED Cc1ccc(S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 6315276 QKOWPRWYXYUIRW-FQEVSTJZSA-N 396.899 5.105 30 20 GKED C=CCOc1cccc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)c1 55723623 JXZWCEYOUDJXPE-UHFFFAOYSA-N 382.847 5.131 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C2(c3cccc(C)c3)CC2)cc1 60351451 DKCWOHXKGVCILO-UHFFFAOYSA-N 398.462 5.338 30 20 GKED COc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 103330743 NSFUMFZQSFEPKJ-DOMZBBRYSA-N 384.888 5.328 30 20 GKED Cc1cc(-c2noc([C@H](C)Nc3ccccc3SC[C@H](C)C#N)n2)ccc1F 108408197 VOHNVJJGRWPRLN-HIFRSBDPSA-N 396.491 5.609 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 108408462 ZGPQWKGDYOFPBG-WMZOPIPTSA-N 395.572 5.809 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1CCc1ccccc1 108530424 RPFCAUWXVGCAME-UYAOXDASSA-N 393.556 5.567 30 20 GKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1 114620445 YRPZLUGPZCPAGF-OALUTQOASA-N 375.497 5.211 30 20 GKED CCN(Cc1cc2cnn(C(C)C)c2nc1Cl)[C@@H](C)c1ccc(C#N)cc1 119852263 IWIVYOUYEBEFQH-HNNXBMFYSA-N 381.911 5.120 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3coc(-c4ccccc4)n3)o2)cc1 126342702 XVXNHZSPOLBLMX-UHFFFAOYSA-N 391.452 5.249 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C(C)=C/c1ccc(Cl)cc1 136601888 BKQUKNLCMLAFNX-UPTIQUDWSA-N 394.902 5.216 30 20 GKED Cc1cc(Cl)ccc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 170991744 LYQDXENKLXYXMH-DZGCQCFKSA-N 387.936 5.339 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCOc2c(F)cccc21 181712411 KDCILQUBDKDSKZ-WMLDXEAASA-N 399.491 5.113 30 20 GKED Cc1cccc2c1OCC[C@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 189661996 HOPIAJREAIYXQM-DOTOQJQBSA-N 381.501 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1nc2c(s1)CCCC2 191421991 HIBONGCSRIJGAL-UHFFFAOYSA-N 383.561 5.238 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N1CCC(C)(C#N)CC1 272509810 JXDJHTJUAFTKJP-UHFFFAOYSA-N 386.293 5.068 30 20 GKED C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 296857965 ZDIJRSIKNZFLPM-RDBSUJKOSA-N 385.455 5.133 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ncsc3C(F)(F)F)c2C#N)[C@H](C)C1 297901748 QZVUTMUQJSJOKJ-JGVFFNPUSA-N 385.436 5.033 30 20 GKED CCCOc1c(/C=C/C(=O)c2c(Cl)nc3sccn23)cccc1OCC 303917747 OAGAPIINNGGLAE-CMDGGOBGSA-N 390.892 5.133 30 20 GKED C[C@@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Br)cc1 330076094 GRTMDAAZTAIDJZ-OLJMKKDRSA-N 393.325 5.392 30 20 GKED CC(C)[C@@H](/N=C(/O)C12CC3CC(CC(C3)C1)C2)C(O)=Nc1cccc2ocnc12 330088036 NSFOBVYKGWTTFS-VYBOSXCSSA-N 395.503 5.613 30 20 GKED C=CCC1(C(=O)N2CCC[C@H](Cc3nc(C4CCCCCC4)no3)C2)CCC1 330116031 UTIDXOJIAQGJDG-GOSISDBHSA-N 385.552 5.035 30 20 GKED CC[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1cn(CCC#N)nc1-c1ccncc1 435122614 BKQXVHBLYKPEHQ-ZEQRLZLVSA-N 399.542 5.017 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)cc2s1 435179631 WTEGDZPSIYZIJF-UHFFFAOYSA-N 396.903 5.326 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1)c1ccccc1 438838177 RYDGWGQABXSWHL-PKTZIBPZSA-N 387.458 5.259 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)s1 440783355 QDTQGGQOSSXOGI-UHFFFAOYSA-N 379.460 5.302 30 20 GKED Cc1c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cnn1CCC(C)C 441547413 ZVBNLXYBSTWUGJ-UHFFFAOYSA-N 388.471 5.154 30 20 GKED CC[C@H](C)[C@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 446281385 MIPATUABHAFFCZ-XDTLVQLUSA-N 388.327 5.095 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 448368257 UFAFTTTWKRIDSX-UHFFFAOYSA-N 385.920 5.309 30 20 GKED CC(C)N(Cc1cccc(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 458805095 TXQCIVKXPOTYRQ-OAQYLSRUSA-N 383.923 5.695 30 20 GKED CCN(Cc1nnc(-c2cc3c(s2)CCCC3)o1)[C@@H](C)c1ccc(C#N)cc1 461394715 ODMGLMQMGHHMDV-HNNXBMFYSA-N 392.528 5.132 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(C)c1cccc2c1CCCN2C(=O)[C@H](C)CC(=C)C 466273907 NYEPDDLUMXLJMF-RTBURBONSA-N 382.548 5.133 30 20 GKED C=CCCN(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 466565821 IWQKWJXOHLEUDN-UHFFFAOYSA-N 383.345 5.072 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 467283009 SHZWSRRJHKAUER-UHFFFAOYSA-N 385.895 5.331 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl)Cc1cccc(F)c1 468973997 LHWQYKPAWCNWKE-SJCJKPOMSA-N 379.262 5.082 30 20 GKED CCCCOc1ccc(C(=O)Nc2cc(C#N)ccc2OC(F)F)c(Cl)c1 471818054 XMSUTJHTEDJPQC-UHFFFAOYSA-N 394.805 5.244 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 474903167 YVGRTFHXHPVSOM-LDQXTDLNSA-N 396.918 5.529 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1ccccc1 475167790 DDJGUWJMFUWZDY-XMSQKQJNSA-N 394.927 5.695 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F 477524401 CHOFPLGTIKNNET-DOMZBBRYSA-N 387.471 5.569 30 20 GKED N#Cc1cc(Cl)ccc1CN[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F 481018874 FOIXJEACCLSMKR-HNNXBMFYSA-N 390.739 5.206 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(CCC(C)C)c1C 481022426 UEXNGDJJVRVWQL-UHFFFAOYSA-N 380.945 5.173 30 20 GKED CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 482506088 PKHIKFNJFQKZHM-UHFFFAOYSA-N 397.500 5.396 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2)c1 483639071 OAUBTKWERBKYOY-KRWDZBQOSA-N 389.377 5.058 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC(C)(C)c1ccccc1 485495230 BPNFEGCGMNGQFL-MRXNPFEDSA-N 384.570 5.688 30 20 GKED N#CCCC[C@H](NC(=O)CCOc1ccc(Cl)c(Cl)c1)c1ccccc1 487251744 OKFBWMHQTAUXIW-IBGZPJMESA-N 391.298 5.314 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(-c4c(F)cccc4F)cs3)oc12 488181529 NRPJOQXNGMWCBD-ZDUSSCGKSA-N 394.402 5.633 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 488348116 BVDDZZTWUGHBSJ-LJQANCHMSA-N 378.476 5.211 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C)c1ccccc1 488695917 AVKAJSWMZSGAPG-SIKLNZKXSA-N 390.527 5.308 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccc(C)cc1 489662516 ALVNVXAFBNCWIS-HNNXBMFYSA-N 382.533 5.578 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@H]2CCCOC2)cc1 503138514 KGTIYSSVTMHTPU-LPHOPBHVSA-N 380.513 5.085 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl 504277614 WLAYMWKSKJARPM-UHFFFAOYSA-N 399.922 5.631 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)Cc1cc(Br)cs1 505016151 CFRSGHOTJZVPGT-UHFFFAOYSA-N 379.323 5.293 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CSCc3ccccn3)c2C#N)C1 506004753 HJLCIDGVXOODIX-CQSZACIVSA-N 399.585 5.038 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccnc(OCc3ccccc3)c2)CC1 507652141 HWHYRFIKXCRGEM-UHFFFAOYSA-N 397.522 5.154 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccc(Br)s2)CC1 507655094 ZPPKTJODKIHOPK-UHFFFAOYSA-N 375.335 5.004 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2ccccc2Oc2ccncc2)cc1 509297675 DHHAZCHYTZJXTC-OAQYLSRUSA-N 385.467 5.166 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1)c1ccccc1 510268290 FSPVVZDPALZDGA-OIBXWCBGSA-N 378.516 5.161 30 20 GKED C=CCC[C@@H](NC(=O)N(C)CCc1nccs1)c1ccc(C(F)(F)F)cc1 510270292 MFGILHMEWIQIFM-MRXNPFEDSA-N 397.466 5.053 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510658499 AMFVFDZVQCAWSV-UHFFFAOYSA-N 375.403 5.154 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nc2ccccc2s1 513687284 PKMBVTZGHORXKN-CYBMUJFWSA-N 395.896 5.563 30 20 GKED C=CCn1c(SCc2csc(C(C)C)n2)nnc1-c1ccc(Cl)cc1 513958032 JVEBLIHVFBGFTC-UHFFFAOYSA-N 390.965 5.657 30 20 GKED C=CCn1c(S[C@H](C(C)=O)c2ccccc2)nnc1-c1ccc(Cl)cc1 514197535 OXOZCDNKYZNREC-GOSISDBHSA-N 383.904 5.207 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(-c4ccccc4)o3)cc2)ccn1 516442546 VVRDVLLEUNFHTC-UHFFFAOYSA-N 381.391 5.258 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 517578574 PSQIGPOPXWMYCP-GOSISDBHSA-N 391.540 5.577 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1CC1CCCCC1 518255954 KVXZCGALDAWSLZ-IEBWSBKVSA-N 385.577 6.048 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1OC 518780095 FLNQASZHNRGNNN-JOCHJYFZSA-N 399.943 5.854 30 20 GKED N#CCCSc1ccccc1NC(=O)CCSc1ccc(Cl)cc1 520805441 CSZFKOKTCQKSHG-UHFFFAOYSA-N 376.934 5.467 30 20 GKED CC1CC(C#N)(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)C1 531558854 RMFZCWVCOMUTLU-UHFFFAOYSA-N 376.243 5.059 30 20 GKED CCCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cnn1-c1cccc(F)c1 543152244 LGCCCBJAHMPPPU-UHFFFAOYSA-N 390.462 5.017 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(Cc3ccccn3)no2)cc1Cl 545543835 NDADSSDQUPMXBN-UHFFFAOYSA-N 388.814 5.040 30 20 GKED Cc1c(C(=O)Nc2cccc(Oc3ccncc3)c2)sc2ccc(C#N)cc12 551035391 ZZXLOQRZIJEDJQ-UHFFFAOYSA-N 385.448 5.521 30 20 GKED Cc1cc(Br)cc2c1[C@@H](N[C@H](CCCC#N)c1ccccc1)CC2 551214491 FOAYJWUTKMAROK-UXHICEINSA-N 383.333 5.770 30 20 GKED C=CCOc1ccc(CN[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)cc1 556914092 YHXCEEVADLHXNW-QHCPKHFHSA-N 378.903 5.373 30 20 GKED CC(C)(C(=O)Nc1ccc(CC#N)cc1)c1csc(-c2cc(F)ccc2F)n1 568816272 FBKJUBALGMOEQC-UHFFFAOYSA-N 397.450 5.071 30 20 GKED Cc1ccsc1CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 571544865 CSQWQQNNWKUDNE-UHFFFAOYSA-N 377.469 5.384 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CC=C(c3c[nH]c4ncccc34)CC2)cc1 580483503 IGAQBDZDCKOCNI-UHFFFAOYSA-N 390.490 5.391 30 20 GKED Cc1cccc2c(CCNC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)c[nH]c12 583116463 NKNBJQRCOMNYCQ-UHFFFAOYSA-N 395.462 5.113 30 20 GKED N#CCCCCC(=O)N(CCc1ccccc1)c1nc(-c2ccccc2)cs1 593954681 REFFOUZNGBCYPT-UHFFFAOYSA-N 389.524 5.470 30 20 GKED CC[C@@H](C#N)N(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 594090554 FPWQOWXTMFWYPO-NSHDSACASA-N 396.343 5.155 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)CC2(C#N)CCOCC2)c2cccs2)cc1 596712137 WQZPBUAGDCPYLP-VGOFRKELSA-N 396.556 5.178 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)CC2(C#N)CCOCC2)c2cccs2)cc1 596712138 WQZPBUAGDCPYLP-VGSWGCGISA-N 396.556 5.178 30 20 GKED CC(C)(C#N)c1ccc([C@H]2Nc3ccc(Cl)cc3C(=O)N2CC2CC2)cc1 602756393 KSIUTZBZTJTEGV-FQEVSTJZSA-N 379.891 5.118 30 20 GKED N#Cc1c(NC(=O)c2cccc3ncccc23)sc2c1-c1ccccc1CC2 603992374 TUVGPVFQORXDGG-UHFFFAOYSA-N 381.460 5.186 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(C)c(NC(=O)NC(C)(C)C)c2)c1 607113032 VCXVKFLQZZHASZ-UHFFFAOYSA-N 395.503 5.122 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)Nc3ccc(CC#N)cc3)cc2)c1 609047393 WUTNYBWMZMCQAB-IBGZPJMESA-N 399.494 5.523 30 20 GKED N#CCn1c(C(=O)N(Cc2ccccc2)Cc2ccc(F)cc2)cc2ccccc21 609169483 COWBPDWLNRCEPW-UHFFFAOYSA-N 397.453 5.147 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(Br)cs3)c2)cc1 609176272 DYSMAKNFYKYMOT-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CCCN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@H](C)C#N 609398842 WWHKPSZSINTJKP-MRXNPFEDSA-N 385.508 5.522 30 20 GKED CCCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 609507560 ZVJJWHIYUSYSGU-UHFFFAOYSA-N 394.858 5.440 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@H]2c2ccc[nH]2)c1 609731153 OHZDTUJDLCAJSF-FQEVSTJZSA-N 391.858 5.309 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@H]2CCCc3cc(C#N)ccc32)cn1 611391046 NRAJLYLPODIDSI-QFIPXVFZSA-N 399.494 5.311 30 20 GKED Cc1ccccc1-c1noc(CSc2ccc(C#N)c(C(F)(F)F)c2)n1 611728420 HWXVARHVTQTCRB-UHFFFAOYSA-N 375.375 5.228 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 612795118 YVTQMWOUHJTXOF-UHFFFAOYSA-N 390.936 5.022 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1SCC(F)(F)F)c1ccccc1 619425956 QSEIQYPJWSKFAV-OAHLLOKOSA-N 378.419 5.367 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H]1CCC(F)(F)C1)c1ccc(C(F)(F)F)cc1 676725868 QYGANGCTQWHZEX-CABCVRRESA-N 376.369 5.200 30 20 GKED Cc1cc(C(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C)c1F 677856663 SZYNYJOLMPSALQ-VXGBXAGGSA-N 385.323 5.082 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 678296726 IGZCGORPHYLXOU-UWVGGRQHSA-N 383.229 5.017 30 20 GKED CC1CCN(c2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2)CC1 726447418 BQKUKNHVHCJCJN-UHFFFAOYSA-N 384.936 5.257 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1OC 731400378 OBCOUGMKLKFVBS-DOTOQJQBSA-N 383.517 5.362 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)Cc1ccc(OCC#N)cc1 731985021 MSHAEFCZWFLDQK-UHFFFAOYSA-N 390.870 5.399 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1csc2ccccc12 731990600 NTABKWRUFONMQQ-OAHLLOKOSA-N 399.475 5.451 30 20 GKED CC(C)(C)OC(=O)N1CCCc2cc(Nc3ncc(C#N)cc3Cl)ccc21 734141519 OHHRALLIEYGZJN-UHFFFAOYSA-N 384.867 5.038 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 734666484 YNUFYSRAYVYZBY-MBSDFSHPSA-N 387.483 5.552 30 20 GKED CC(C)(Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 735592683 CQQMMAGAXPIXJM-SFHVURJKSA-N 394.927 5.909 30 20 GKED CSc1ccc(C(=O)/C=C\c2cc3cnn(C(C)C)c3nc2Cl)cc1F 741846606 HPORFQYJBFNLFU-XQRVVYSFSA-N 389.883 5.423 30 20 GKED CCOc1ccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)cc1 745723722 FOAIPRKNKMHLIN-UHFFFAOYSA-N 387.508 5.361 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745989943 HHBRHEXRNJZYJH-SEYXRHQNSA-N 379.463 5.447 30 20 GKED N#CCSc1ccccc1C(=O)OCc1ccc(OCc2cccs2)cc1 746472950 VEAWNVOAMMVPCX-UHFFFAOYSA-N 395.505 5.300 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1F 752635932 IYZWVHNPEXQZQY-QVKFZJNVSA-N 391.421 5.503 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCCc3c(Cl)cccc32)ccc1OC 756705166 KJHBCJWHGLBTPF-UZLBHIALSA-N 384.907 5.197 30 20 GKED C#Cc1cccc(NC(=O)N(C)[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 759504351 XBYXTFJPNDNJSX-INIZCTEOSA-N 375.497 5.325 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCC[C@H]2c2ccccc2)cc1 762819092 RDNAZKQGQHFUJS-DQEYMECFSA-N 395.506 6.101 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2C[C@H](c3ccccc3)C2(C)C)ccc1OC 766329632 MYJMGJIZBKZJGK-TXTKFYIRSA-N 378.516 5.048 30 20 GKED Cc1cncc(C(=O)/C=C\c2csc(-c3cccc(Br)c3)n2)c1 767365682 FNKRBYYTOGMNFG-WAYWQWQTSA-N 385.286 5.172 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2C[C@H](C)c3c(Br)cccc32)c1 772986501 XSLCSKVWUVGQNQ-YYFZDKIDSA-N 399.332 5.468 30 20 GKED COc1ccc2ccccc2c1-c1cc(CON=Cc2cccc(F)c2)on1 778024678 RSSCRDWKWCDGPL-UHFFFAOYSA-N 376.387 5.193 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c[nH]nc3-c3ccccc3)cc2F)c1 779595306 HDFUSKVCXMYZOI-UHFFFAOYSA-N 398.441 5.279 30 20 GKED C#CCCCCCC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 779913655 JHFSYHQIIZFTEI-INIZCTEOSA-N 380.351 5.028 30 20 GKED C[C@H](OC(=O)Cc1cccc(OCC#N)c1)c1ccc(SC(F)(F)F)cc1 784108829 VDVQGBRVWIZPNS-ZDUSSCGKSA-N 395.402 5.048 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc2ccccc2c1O 786960780 VZADANRIGNBNAW-QGZVFWFLSA-N 399.494 5.301 30 20 GKED CC(C)(C(=O)OCCCC#N)c1csc(-c2c(Cl)cccc2Cl)n1 797209044 SFQVMMXMCIZNCZ-UHFFFAOYSA-N 383.300 5.241 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ccccc2Br)s1 797572521 BAZCFMIRAHFHHO-CYBMUJFWSA-N 391.334 5.012 30 20 GKED C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797573768 WIMNEORQKXGAJQ-SMDDNHRTSA-N 396.434 5.103 30 20 GKED C=CCC[C@H](NCc1ncc(C2OCCO2)s1)c1ccc(C(F)(F)F)cc1 809627833 HUPMRSWKWDRMEV-HNNXBMFYSA-N 398.450 5.004 30 20 GKED N#C[C@@H](C(=O)C1(C(F)(F)F)CCC1)c1nc(-c2ccc(Cl)cc2)cs1 835067189 AFIYUGXJPHHUKK-LBPRGKRZSA-N 384.810 5.372 30 20 GKED C=C(C)C[C@@H](NCc1cc(C)c(OCc2ccccc2Cl)c(C)c1)C(=O)O 864530381 XCXQVRDAQGAMCO-HXUWFJFHSA-N 387.907 5.045 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cccc(O)c1 916155787 ZZYPBGQVTKNHSV-KPKJPENVSA-N 377.827 5.194 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccc(Cl)cc2)cc1 916948221 FDUOHLHYWFQYRT-YWZLYKJASA-N 382.891 5.134 30 20 GKED Cc1cccc(OC[C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 919773605 TYDFQSCUJNTUFO-DVECYGJZSA-N 399.494 5.240 30 20 GKED CC(C)CC(Cc1ccc(Cl)cc1Cl)=NNc1ccc(C(=O)O)c(F)c1 1776074365 WKACHWAKFXJPHF-UHFFFAOYSA-N 397.277 5.887 30 20 GKED C=C(C)COc1cc(/C=C\c2cc(C(=O)O)c3ccccc3n2)ccc1OC 1776140063 KMONDSGVHFQECB-NTMALXAHSA-N 375.424 5.067 30 20 GKED C=CCOc1ccc(CNC2(C(=O)O)CCC(c3ccccc3)CC2)cc1Cl 1776185643 GFPSZZJCRYNMFS-UHFFFAOYSA-N 399.918 5.176 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1\CCc2oc(C(=O)O)c(C)c2C1=O 1776200015 RKCMLJHNJWTCBZ-JIYPUEFQSA-N 390.357 5.464 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccccc2SC(F)(F)F)c1)C(=O)O 1776473366 AFYVIWOHIGASIK-PRDAAYKISA-N 396.386 5.047 30 20 GKED CCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776676228 JDKXDICUZYBSOO-CXUHLZMHSA-N 399.446 5.296 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)cc(Br)cc1C 1776783017 CZAWCNUURUXMLA-KRWDZBQOSA-N 384.358 5.359 30 20 GKED COc1cc(C)ccc1Oc1ccccc1/C=C/C(=O)c1ccc(C(=O)O)s1 1777281640 LUMOXQPRUPIXRF-CMDGGOBGSA-N 394.448 5.452 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)CC2 1777371191 WSIQKKOGDNNYFI-XKZIYDEJSA-N 398.458 5.202 30 20 GKED C=CCn1c(SCc2nc3ccccc3c(C)c2Cl)nnc1-c1ccco1 29991289 WGHPAQULPAMJGM-UHFFFAOYSA-N 396.903 5.526 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2c2cccs2)cc1 32042403 DROIMEWQRIKOQY-OAQYLSRUSA-N 388.492 5.176 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c[nH]c2ccccc12 56469652 DSVUUXSPLMNXCA-UHFFFAOYSA-N 381.435 5.322 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(C)c(F)c2)cc1 60347599 JNDSWZXACSAUHS-UHFFFAOYSA-N 376.387 5.059 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1 63462369 KOKYBSADUTWWBW-UHFFFAOYSA-N 385.345 5.034 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 66347871 RSTULXDPYKNPDY-FQEVSTJZSA-N 395.915 5.204 30 20 GKED O=C(/C=C/c1sc2ccccc2c1Cl)c1ccc(N2CCC(O)CC2)cc1 97572470 WDVICIRREJAMTK-MDZDMXLPSA-N 397.927 5.412 30 20 GKED CC(C)n1c(C(F)(F)F)nc2cc(C(=O)N(CCC#N)CC(C)(C)C)ccc21 115371795 LBBBBNIBHWTUBS-UHFFFAOYSA-N 394.441 5.038 30 20 GKED C=C(C)COc1cc(CNCc2csc(-c3ccccc3)n2)ccc1OC 127288918 RENXHSOEUFGKTJ-UHFFFAOYSA-N 380.513 5.063 30 20 GKED Cc1ccc(NCc2cccc(OCCCC#N)c2)cc1NC(=O)C(C)(C)C 131974130 KROLOMRYSMZSLG-UHFFFAOYSA-N 379.504 5.274 30 20 GKED C=CCNC(=O)Nc1ccc(N[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)cc1 154548155 FOBQKOWNXLQTJK-CQSZACIVSA-N 396.878 5.476 30 20 GKED COc1ccc([C@@H](NCc2cc(C#N)cs2)c2ccccc2Cl)c(C)c1 237265299 BLNMYDSLQDYBKQ-OAQYLSRUSA-N 382.916 5.469 30 20 GKED Cc1ccc(NC(=O)C[C@H](C)Nc2cccc(OCCCC#N)c2)cc1Cl 237575720 KGTFCBZJUKSUEX-INIZCTEOSA-N 385.895 5.160 30 20 GKED O/C(CC1CCCCC1)=N/C1CCC(c2nc([C@H]3CCCCS3)no2)CC1 329736875 STKHGGMYFKRGCB-DAWZGUTISA-N 391.581 5.981 30 20 GKED OC(=Nc1cc(Br)ccc1F)C1CCC(/N=C(/O)C2CC2)CC1 330026590 LRCAVFQDSRBMIE-UHFFFAOYSA-N 383.261 5.102 30 20 GKED COc1ccccc1NC(=O)c1cc2ccccc2cc1OCC1(C#N)CCC1 418799977 BVVMGZOOLYIHGM-UHFFFAOYSA-N 386.451 5.173 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 428862085 MPZYMQLAOOUTCY-NHCUHLMSSA-N 389.499 5.219 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl 432832366 OGOSLNQCTWMNBS-UHFFFAOYSA-N 392.890 5.391 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2)n1 433255831 JAQQNWPICJUDHT-HXUWFJFHSA-N 388.471 5.515 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)C1(c2cccc(C#N)c2)CC1 435367428 WBFIVCGFKRSKLH-UHFFFAOYSA-N 382.463 5.116 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 437030095 IUSMWCLKJLAABR-SJKOYZFVSA-N 386.339 5.921 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1 438480033 DKHUDKAHMOHPMN-UHFFFAOYSA-N 389.455 5.103 30 20 GKED C=CCC[C@H](NCc1cncn1Cc1ccccc1)c1ccc(C(F)(F)F)cc1 445811329 REHOBTQFYYFAOK-QFIPXVFZSA-N 399.460 5.747 30 20 GKED N#Cc1cccc(CN[C@H](c2ccc(Br)cc2Cl)C2CC2)c1 446747046 YYLKOCHQWWZFLD-SFHVURJKSA-N 375.697 5.215 30 20 GKED CCC1(CC)CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 446826065 HDUDPRGOLSXNJQ-UHFFFAOYSA-N 391.515 5.376 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CCC2)c2c(F)cccc21)c1ccccc1 458804353 SJOYLEUOSPZEIY-LJQANCHMSA-N 377.463 5.212 30 20 GKED C[C@@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1cccc(OCc2ccccc2)c1 462346490 NFQDRTJHKTZCTM-RTBURBONSA-N 384.479 5.118 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccccc2C#N)cc1 462640212 KNSVHGYORNYLSC-UHFFFAOYSA-N 376.843 5.067 30 20 GKED C=CCOCCCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 463296441 UONDKJAABWSMST-FQEVSTJZSA-N 378.299 5.182 30 20 GKED C=C(C)C[C@H](C)C(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 464564680 FJJVHKMTBHCSOO-INIZCTEOSA-N 380.513 5.962 30 20 GKED C=C(C)C[C@@H](C)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 466668215 QQVVVEABTXPFJV-GOSISDBHSA-N 391.515 5.126 30 20 GKED CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 470095489 BEFUWQPNJWKLJF-SFHVURJKSA-N 387.405 5.105 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)CCc1ncc(-c2ccc(F)cc2F)o1 470648993 OTGWNWHHLXIFPE-UHFFFAOYSA-N 396.437 5.157 30 20 GKED C=C(C)Cn1c(SCC[C@H](C)OCc2ccccc2)nnc1-c1ccncc1 473402394 RNQFHSXGZUGATG-SFHVURJKSA-N 394.544 5.004 30 20 GKED CCO[C@H](CCNC(=O)Nc1ccccc1SC[C@@H](C)C#N)C1CCCC1 473631783 ZLOIPLYVZSPSOD-QFBILLFUSA-N 389.565 5.045 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccccc1Br 473761965 DUDZCFCWGMAQCA-UHFFFAOYSA-N 394.334 5.102 30 20 GKED CC[C@H](C)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 480939328 IQRHOFNYYBBLFO-BLLLJJGKSA-N 398.919 5.430 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccc(C#N)cc1 482298707 CCDQRMXTZAAVKE-CQSZACIVSA-N 378.378 5.120 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483228527 NDRRRJHHZJABCW-AVRDEDQJSA-N 379.463 5.330 30 20 GKED Clc1ccc(C#CCSc2nnc(Cc3cccs3)n2C2CC2)cc1 485284374 HBGYRVGEQDJHBT-UHFFFAOYSA-N 385.945 5.063 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2c(Br)cccc2[nH]1)c1ccccc1 487599038 BKLGIXUMJKGVLD-QGZVFWFLSA-N 396.288 5.095 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c1 499488367 WRPWJPDDGRSZKI-ZDUSSCGKSA-N 378.419 5.313 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2OC)c2ccccc2Cl)cc1 500839092 CZLXUSLKTCZZKX-QHCPKHFHSA-N 392.886 5.108 30 20 GKED CCCN(C(=O)c1ccc(C#N)c(C)n1)[C@H](C)c1ccc(Cl)c(Cl)c1 502788640 IAQHVUKOKJHREA-CYBMUJFWSA-N 376.287 5.182 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ccnn2CCC)CC1 504795576 UWGVZXPHEOXYRB-UHFFFAOYSA-N 394.563 5.557 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)c1ccccc1C#N 508099394 SEOXFAJIHWRUNO-UHFFFAOYSA-N 388.279 5.265 30 20 GKED CCc1cc(C(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)c2c(C(C)C)noc2n1 509084532 QXIRMWDNAQUZSB-HNNXBMFYSA-N 390.487 5.004 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 512766332 HTOPLKWGGXMGPR-UHFFFAOYSA-N 392.430 5.022 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 513195857 IQCIKQLPHKBVTL-IBGZPJMESA-N 399.494 5.118 30 20 GKED CSc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1Cl 533209561 FBRPILKZXXTBHE-UHFFFAOYSA-N 382.920 5.451 30 20 GKED N#Cc1ccccc1COc1cccc(-c2nc([C@H]3CCCCS3)no2)c1 547223105 YMWFQEOEJYURBN-LJQANCHMSA-N 377.469 5.145 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(Sc3ccccc3)cc2)CC1 548793888 RNGPBHWQMJZMEK-UHFFFAOYSA-N 385.536 5.290 30 20 GKED C/C(=C/c1ccccc1C(F)(F)F)CN1CCC(C#N)(c2ccccn2)CC1 558622026 SHVWQALBZIWNKB-VKAVYKQESA-N 385.433 5.061 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4nccc(C)c4c3)n2)cc1 560553259 QQHVJGBKWRIXAR-LJQANCHMSA-N 399.475 5.165 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 572535885 XHMODPFURUKPCT-MNOVXSKESA-N 397.302 5.362 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)CCCCC2=O)c1nc2cc(Cl)ccc2s1 583255913 INVHWLMQECWIMP-MRXNPFEDSA-N 394.883 5.349 30 20 GKED N#Cc1cc(Oc2ccc(NCc3csc(-c4cccs4)n3)cc2)ccn1 584868968 PLXKZGQIONGRLN-UHFFFAOYSA-N 390.493 5.543 30 20 GKED N#CCCCCCC(=O)Nc1nc(-c2sccc2Br)cs1 588297631 DWJMXOHECXARQZ-UHFFFAOYSA-N 384.324 5.047 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cc(Br)ccc2Cl)c1 589384743 KOLYKVXNOUZXRF-UHFFFAOYSA-N 380.669 5.310 30 20 GKED COc1ccc2[nH]cc(C3=CCN(c4cccc(C(F)F)c4C#N)CC3)c2c1 590574894 QZYYZKHJMAHABV-UHFFFAOYSA-N 379.410 5.279 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccs2)n1)c1nc2cc(F)ccc2s1 592973635 CYMNENFWOMOOEW-SNVBAGLBSA-N 385.470 5.110 30 20 GKED COc1ccc(COCc2cccc(NCc3ccc(C4(C#N)CC4)cc3)c2)cc1 594934906 QDZLTUQUIDZSBU-UHFFFAOYSA-N 398.506 5.579 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21 599410149 YWKDOIMAIGWXNO-ALIQFICWSA-N 382.916 5.259 30 20 GKED Cc1ccc(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 603817313 WGMRBXZXMANBHD-HXUWFJFHSA-N 393.874 5.261 30 20 GKED Cc1occc1-c1nnc(S[C@H](C#N)Cc2ccccc2)n1-c1ccccc1 604041751 SWRNBUMJRWKDPW-IBGZPJMESA-N 386.480 5.063 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@H](C)c1c(Cl)cccc1Cl 604567783 BMXARGQSNOWVSC-CYBMUJFWSA-N 393.270 5.220 30 20 GKED CCc1c(C)sc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2CC)c1C#N 609032590 QXAPBRANLAIUSW-UHFFFAOYSA-N 398.919 5.144 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1cccc(Cl)c1 609371472 LFRKKOVWNBMAQK-CQSZACIVSA-N 390.961 5.464 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1cccc(OCc2ccccc2C#N)c1 610055796 NALSCIWOQWUQLZ-DEOSSOPVSA-N 399.494 5.146 30 20 GKED C[C@]1(c2ccccc2)C[C@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 610205627 ROSUKYVBKCCBJO-ILBGXUMGSA-N 398.531 5.311 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2C(F)(F)C1 610922711 HWBRWKPBTCXJKC-AWEZNQCLSA-N 387.455 5.078 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 613291275 YUIOYZZMILRKHJ-QFIPXVFZSA-N 392.458 5.612 30 20 GKED N#C[C@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1nc2ccccc2o1 642281484 KOXNGNZUHFTPQU-SECBINFHSA-N 387.247 5.839 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc2c(cnn2C(F)F)c1 682777868 UTALBYWXQFHRJJ-UHFFFAOYSA-N 384.430 5.927 30 20 GKED CC(C)c1nc(C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)cs1 726690389 VAMKKAJMKCJOBD-UHFFFAOYSA-N 390.508 5.323 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(NC(=O)C3CCCCC3)c2)cc1 726940260 BVHNGNMAZLAIQJ-UHFFFAOYSA-N 389.499 5.074 30 20 GKED CCCn1c(SCc2ccc(OCC#N)cc2)nnc1-c1ccc(Cl)cc1 731158853 KGUHDUPFCGFDMY-UHFFFAOYSA-N 398.919 5.203 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(C2CCCCC2)CC1 731400905 XNTIIJGTULFIHI-KRWDZBQOSA-N 385.577 5.905 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cc(F)c(F)cc1F 734301843 RTXCCJRLOWRSIK-UHFFFAOYSA-N 392.812 5.512 30 20 GKED C=CC[C@H](NC(=O)N(CCC)[C@@H](C)c1cc2ccccc2o1)c1ccncc1 734678821 IUNIQGZPTAZYHP-PXNSSMCTSA-N 377.488 5.628 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3cccc(Nc4ccc(C#N)cc4)c3)cc2)co1 737778678 ZSYHWUWHWAEKQT-UHFFFAOYSA-N 394.434 5.518 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)CCc2[nH]c3ccc(F)cc3c21 743057552 UIJZHJMPOTUHMT-RVDMUPIBSA-N 385.398 5.102 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Nc2ccc(OC3CCCC3)cc2)cc1 743465223 GWLWFDHOMUSAST-LJQANCHMSA-N 391.515 5.064 30 20 GKED O=C(/C(=C/c1ccc(Cl)nc1)c1nc2ccccc2s1)c1ccccc1 748994114 GIQBEKSJWZKNPI-VBKFSLOCSA-N 376.868 5.768 30 20 GKED CCOC(=O)/C(=C/c1cccc(OCCCC#N)c1)c1nc(C(C)C)c(C)s1 763292524 PFMZWCIRJLSVJX-XMHGGMMESA-N 398.528 5.361 30 20 GKED Cc1cc(CSc2ccccc2C(=O)Nc2ccc(C#N)cc2Cl)on1 769728166 DQHFBDWHPQUTDS-UHFFFAOYSA-N 383.860 5.053 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(N2CCCC2)c(F)c1 775536050 IFOKLSLKFGJDIV-UHFFFAOYSA-N 393.915 5.361 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 780300711 CJEIUOUBRAXTFF-QGZVFWFLSA-N 378.497 5.374 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1CCCc1ccccc1 780671743 UDOBBCKWFGQVAW-TZIWHRDSSA-N 391.515 5.387 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cn(Cc2ccccc2)nc1C(C)(C)C 780781361 NIUZCKOIQAIAMX-SFHVURJKSA-N 388.515 5.132 30 20 GKED Cc1ccnc2sc(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)c(C)c12 786306015 JMEKDDQKSNEWJE-KRWDZBQOSA-N 399.475 5.028 30 20 GKED COc1ccc2nc(/C=C\C(=O)c3sccc3Br)sc2c1 788733014 MDCOYMUVMYCJGA-PLNGDYQASA-N 380.288 5.025 30 20 GKED O=C1/C(=C\c2cnc(-c3ccco3)s2)CC/C1=C\c1cccc([N+](=O)[O-])c1 789126960 GNHQOOTZARULJI-PVMFERMNSA-N 378.409 5.141 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792092391 QENJZOFIRHCXJQ-KURKYZTESA-N 396.368 5.113 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(Br)s1 792103504 SCLMEXJKVRIKMS-FZMZJTMJSA-N 385.286 5.039 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 796475214 ZGTBXELEDRXFKD-UHFFFAOYSA-N 392.908 5.127 30 20 GKED C=CCC[C@H](NC(=O)N1CCC([C@@H](O)c2ccccc2C)CC1)c1ccccc1 805223268 HMCMOANVCUNEFG-BJKOFHAPSA-N 392.543 5.158 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810530995 DWITXKMYDYLRQV-GXFFZTMASA-N 397.352 5.436 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813216841 GDQPTCRDKPFRAC-BMGYJQCNSA-N 398.306 5.399 30 20 GKED CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](N[C@H](CCCC#N)c3ccccc3)CC[C@H]2C1 842874613 DUMZWZXOIUGMBQ-LNRXMEIDSA-N 397.563 5.047 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)ON=C(C)c1cc2ccccc2o1 852016647 HPTZFPGLBKXQCH-INIZCTEOSA-N 378.472 5.325 30 20 GKED Clc1cccc(-c2nc(CON=Cc3ccccc3Br)co2)c1 914571889 PLGMKWAONRLZQX-UHFFFAOYSA-N 391.652 5.308 30 20 GKED C=C(Br)CNC(=O)Nc1ccccc1SCc1ccccc1 921112982 KNEVYKGPIQNWFF-UHFFFAOYSA-N 377.307 5.009 30 20 GKED O=C(O)c1cc(NN=C2CCCSc3ccc(Cl)cc32)ccc1Cl 1776033513 SPBYJPFYYXRTIA-UHFFFAOYSA-N 381.284 5.394 30 20 GKED CCCCCCCOc1cccc(CNc2cc(CCC(=O)O)ccc2OC)c1 1776787475 YKGMKZHXSCJIIY-UHFFFAOYSA-N 399.531 5.674 30 20 GKED CCCCCCCOc1cccc(/C=C\C(=O)c2cccc(OCC(=O)O)c2)c1 1776788991 HZHNPNAZDLNXKI-YPKPFQOOSA-N 396.483 5.395 30 20 GKED COc1cc(OC)c(C(=O)O)cc1/C=C\C(=O)c1ccc(C2CCCCC2)cc1 1777326077 OMIAFLCAFNPIAB-SEYXRHQNSA-N 394.467 5.346 30 20 GKED COc1ccc(OC)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1777368108 NFVKAHVYLRBURJ-NTMALXAHSA-N 394.448 5.027 30 20 GKED COc1cc(/C=C/C(=O)c2oc3ccccc3c2C)cc(Br)c1O 26763396 FLJKJFRGGSNTCD-BQYQJAHWSA-N 387.229 5.114 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1OC 29151995 UJGZQZINALSLQQ-UHFFFAOYSA-N 386.879 5.191 30 20 GKED CCCCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 48161843 FFNDWFFWTKGERL-UHFFFAOYSA-N 377.488 5.128 30 20 GKED CC(C)Cn1cc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c2ccccc21 48829808 PJAVNXDLLFROIW-INIZCTEOSA-N 385.389 5.201 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)/C(O)=N/c1nnc(-c2ccsc2)s1 52496491 ZVCUCEFKVIHONY-LLVKDONJSA-N 384.486 5.251 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)NC(C)(C)C)[n+]2ccc(C(C)(C)C)cc2)cc1 55015213 YHALTLXRZRKMTA-UHFFFAOYSA-O 397.608 5.161 30 20 GKED CN(CCC#N)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 57814241 ZRADXBJJHQYKCZ-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N[C@@H](C)c1ccccc1Cl 66861319 YTPVAKFDUVAXSD-GJZGRUSLSA-N 387.936 5.024 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(N2CCCC2)cc1 66955509 JQUNWVGNVABVGR-KRWDZBQOSA-N 394.544 5.003 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 91707849 HGBJWPKRADAIEB-ZWKOTPCHSA-N 393.384 5.163 30 20 GKED C=CCOc1ccc(CN(C)Cc2csc([C@H](C)OCC)n2)cc1Cl 93737199 WUWHSZHWJRKGFM-AWEZNQCLSA-N 380.941 5.091 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1)c1ccccn1 106353748 CFEVEPGLLZKHJV-IERDGZPVSA-N 380.419 5.070 30 20 GKED CCCO[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 108508171 CGWNUHGVWMSIAR-HXUWFJFHSA-N 393.487 5.164 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)CCOc1ccccc1-c1ccccc1 108903502 JCEROQYFMNTZQW-UHFFFAOYSA-N 386.451 5.032 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 123771802 XFDBFFCPXPZXMS-UHFFFAOYSA-N 386.908 5.272 30 20 GKED CC(C)Cn1ncc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C(F)F 125060877 PNLYNUYVCSYXDX-ZDUSSCGKSA-N 392.475 5.123 30 20 GKED C=CCn1c(SCc2csc(C3CCCCC3)n2)nnc1-c1cccnc1 125481371 CAEWKDVZYJSPBB-UHFFFAOYSA-N 397.573 5.323 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccncc1 175617372 MKVRXHBGOFIPPG-NRFANRHFSA-N 386.455 5.327 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@@H](C)c1cc2ccccc2o1 184359200 APFPNZCFVHYOOO-CVEARBPZSA-N 377.444 5.339 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc3ccccc3s2)ccc1OC 188195847 SPDIHPVNGJCUHT-CRAIPNDOSA-N 380.513 5.442 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 194065858 FNWPNIBKINCUQD-KRWDZBQOSA-N 376.431 5.371 30 20 GKED N#CCc1ccc(NCc2csc(-c3cccc(Br)c3)n2)cc1 236582596 CPUAFIKAZABZGY-UHFFFAOYSA-N 384.302 5.251 30 20 GKED CSc1ccc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 303225502 WCYPLVBBGIBKPE-UHFFFAOYSA-N 388.492 5.420 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](c1ccc(F)cc1F)C(C)C 328954605 YLLPHHXAVIEJDK-CXAGYDPISA-N 394.487 5.326 30 20 GKED COc1ccc(Cl)c(N/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1 329512697 NNBSDMXDSBFZPL-KRWDZBQOSA-N 388.899 5.064 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)s1 430593293 IPQNFXKZTBNLKL-CQSZACIVSA-N 394.462 5.771 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(Cc2ccccc2)CC1 435595308 BISJZMYOCJXJBV-KRWDZBQOSA-N 379.529 5.083 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 435603844 ANJQIZNAFGSNAR-FQEVSTJZSA-N 381.501 5.100 30 20 GKED CSc1c(F)cccc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 435707746 YKZOZZCWBWBVKT-UHFFFAOYSA-N 378.428 5.464 30 20 GKED CC[C@]1(C)CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)C1 437976435 OZYLPKPTXNLCHF-XMMPIXPASA-N 391.515 5.490 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 438643065 SNXLUDSROLKDSB-RBSFLKMASA-N 399.482 5.571 30 20 GKED N#C[C@@H](C(=O)c1noc2c1CCCCC2)c1nc(-c2ccc(Cl)cc2)cs1 444456948 HKPWNMIVJAIJOC-HNNXBMFYSA-N 397.887 5.210 30 20 GKED C[C@@H](C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)c1ccsc1 460152771 VFJDIRMIPUVOAI-OAHLLOKOSA-N 380.900 5.610 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1cncc2ccccc12 462484678 SWJSZRYCLBWEBS-MRXNPFEDSA-N 375.497 5.200 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1 464157983 MSHGOVVCRNGRNH-HSZRJFAPSA-N 376.456 5.070 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 471177233 OTIOCWWNGFLKBS-UHFFFAOYSA-N 395.450 5.373 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(COc2ccccc2)CC1 475550574 OQPGEAQVIIODDG-UHFFFAOYSA-N 392.543 5.861 30 20 GKED Cc1ccc(-n2c(SCCCC(C)(C)C#N)nnc2-c2ccncc2)cc1C 475940390 MRQUXMOULMFACM-UHFFFAOYSA-N 391.544 5.368 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)c1cccc(CC#N)c1 478105684 BIHLJXUBQNJSIN-UHFFFAOYSA-N 379.257 5.229 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(Cl)cc1C#N 481064872 WGXRTGUCYMOGAG-LBPRGKRZSA-N 385.895 5.634 30 20 GKED N#Cc1cc(NC(=O)c2occc2-c2ccccc2)ccc1OCC(F)(F)F 481830615 PBWCIPFOAMSSIU-UHFFFAOYSA-N 386.329 5.012 30 20 GKED N#Cc1cc(F)ccc1CSCc1ccc(C(=O)Nc2ccccc2)cc1 488461246 RYPUDZAGNJZSFO-UHFFFAOYSA-N 376.456 5.383 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)cc1 498925875 CVWOXTWEWIVJPR-UHFFFAOYSA-N 388.511 5.081 30 20 GKED C=CCN(C(=O)c1cc(-c2cccc(Cl)c2)no1)c1nc2c(s1)CCCC2 499318147 SWMXBWLHRVMCEA-UHFFFAOYSA-N 399.903 5.163 30 20 GKED CC(C)[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(F)cc1F 502157786 DSTYNOBHSCGDHO-QFIPXVFZSA-N 395.453 5.032 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c(C)[nH]c2ccccc12 502746395 FHDOBOHVYJRKJJ-UHFFFAOYSA-N 395.462 5.630 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2 504793407 KXAZFBKJPSIXPA-DHIUTWEWSA-N 386.539 6.391 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(OCc2ccccc2OC)CC1 505057961 NTKOCJYEARDWCA-UHFFFAOYSA-N 394.515 5.027 30 20 GKED CC1(C#N)CCN(C(=O)c2ccccc2Nc2cccc(C(F)(F)F)c2)CC1 507839583 WNZFWDHTZZRQPV-UHFFFAOYSA-N 387.405 5.215 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510022095 BLRSCPDAHBPPQY-AZUAARDMSA-N 381.907 5.792 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nnc(-c2ccccc2)o1 510185486 MOILSTXCADUVSM-OAHLLOKOSA-N 384.464 5.524 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1noc(-c2cccs2)n1 510191854 ROHAXKBVMBNGRM-UHFFFAOYSA-N 376.466 5.024 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)c1 510480193 JZTWDKPNWJMDNY-UHFFFAOYSA-N 380.831 5.344 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 513135174 HLILGAPLZTXUOG-QGZVFWFLSA-N 381.442 5.272 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C[C@H](C)C#N)C2CC2)cc1 513670926 DKRDLMMMFOJHSS-CQSZACIVSA-N 399.878 5.297 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H](C)c1ccccc1F 517512784 CJILOJPHFNLBNJ-KRWDZBQOSA-N 388.442 5.327 30 20 GKED Cc1ccc2nc(C)c(C(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)cc2c1 518709092 JOBCZJHLHFZGJB-GOSISDBHSA-N 384.266 5.153 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)c1cc(OC)c(OC)c(OC)c1 518790914 QXLSFIKACSUUGU-UHFFFAOYSA-N 398.503 5.233 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 520596891 IKNHOTPAWQQYHE-UHFFFAOYSA-N 399.494 5.580 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(F)c1 520627177 IKUHTXWAZYFEEX-MRXNPFEDSA-N 389.430 5.237 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCc3nc4ccccc4o3)c2)cc1 521495200 OZEDWJLEGCYJCD-UHFFFAOYSA-N 383.407 5.063 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 521801357 ZQQRUNZRDUHHTC-TYCQWZJGSA-N 386.520 5.976 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(Sc2ccccc2)CC1 524634572 NAPOWIMOQVPFOV-INIZCTEOSA-N 397.569 5.385 30 20 GKED CC(C)(C)CN(CCC#N)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 525329344 XRCKNYXCWYTEBA-UHFFFAOYSA-N 381.467 5.591 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)cc1 526967192 QZQOUHRUJIFMIP-QGZVFWFLSA-N 389.524 5.117 30 20 GKED CC[C@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 532285485 HMHMMWPZIJKFCW-HNNXBMFYSA-N 383.879 5.054 30 20 GKED C[C@H](C#N)CN(C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)C1CC1 532820866 RHDGJUUCMKAENP-OAHLLOKOSA-N 384.932 5.397 30 20 GKED N#C[C@H](C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1nc2ccccc2s1 536178867 KCNFWDHYAPRIFZ-GOSISDBHSA-N 397.459 5.039 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1nc2ccccc2n1C(C)C)c1ccccc1 536205850 YMSUQRVHGINERZ-CVDCTZTESA-N 387.527 5.641 30 20 GKED COc1cccc(C(N[C@@H](C)c2ccc(C#N)c(F)c2)c2cccc(OC)c2)c1 538508030 RNXBWJSCNDGYQO-INIZCTEOSA-N 390.458 5.155 30 20 GKED CCN(C(=O)c1csc(Cc2ccc(C)cc2)n1)c1ccc(C#N)c(Cl)c1 539175487 SKSRBZXSYMGKCR-UHFFFAOYSA-N 395.915 5.234 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 540556211 YCRAGFQZQGYXER-HNNXBMFYSA-N 385.895 5.459 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(Oc2nncc3ccccc23)cc1 541241654 LAKVDQWOKPCRTA-UHFFFAOYSA-N 397.434 5.239 30 20 GKED N#Cc1ccc(C[S@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1F 549681302 HQDQAANFEDRFKD-RLWLMLJZSA-N 383.875 5.389 30 20 GKED COc1ccc2ccc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cc2c1 550846271 HNYOVUSAOQVQRD-HNNXBMFYSA-N 376.481 5.352 30 20 GKED C=CCn1c(SCc2ccncc2Cl)nnc1-c1cccc(Cl)c1 551446307 LFSGGLQJASLRSE-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C[C@H](Nc1nc(-c2cccnc2)nc2sc3c(c12)CCC3)c1ccc(C#N)cc1 552479005 DWFRFJAYMOLRPR-AWEZNQCLSA-N 397.507 5.287 30 20 GKED CC(C)(C#N)CCCN[C@H]1CCN(C(C)(C)C)[C@H]1c1ccc(Cl)c(F)c1 558896006 JZKASQSQZBRYQA-OALUTQOASA-N 379.951 5.313 30 20 GKED C[C@H](N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1Cl 560584784 JQXNKHUJZJIGGH-VOJFVSQTSA-N 383.706 5.293 30 20 GKED CCSCc1ccccc1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 563345882 XFOPWSXDJJWNIV-UHFFFAOYSA-N 393.537 5.111 30 20 GKED Cc1ccccc1C1(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCC1 575376324 KJIDNOQCSYKQMH-UHFFFAOYSA-N 383.451 5.114 30 20 GKED N#C[C@@H](C(=O)c1cscc1-c1ccccc1)c1nc2ccccc2n1C(F)F 575737810 NKACNQHADORJNU-AWEZNQCLSA-N 393.418 5.650 30 20 GKED COc1ccc2c(c1)c(C(=O)NCC(C)(C)CCC#N)c(C)n2C1CCCC1 579874887 YBZANHJMRYJSLP-UHFFFAOYSA-N 381.520 5.133 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)CC2)c1 587110548 VXTKMHXLKAVYIX-PMACEKPBSA-N 398.428 5.061 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CCC(F)(F)CC1 594069614 FSGKRTWWSNQSHO-KGLIPLIRSA-N 381.492 5.274 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1csc2ccccc12 603756052 GUDZOIIEYMOAEE-UHFFFAOYSA-N 399.475 5.450 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 604016281 XNKCFIFJVRRDCQ-UHFFFAOYSA-N 389.480 5.144 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609082176 CHILTZIZARARSB-LLVKDONJSA-N 379.794 5.038 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c2ccccc21 609163809 AFLILFLMYVSYOB-HXUWFJFHSA-N 399.881 5.739 30 20 GKED N#CCn1c(C(=O)N2CC=C(c3cccc4ccccc34)CC2)cc2ccccc21 609170399 RQDFGJDEACMTRT-UHFFFAOYSA-N 391.474 5.248 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)cc2)CC1 609427132 QQEZMACNOQRAAY-UHFFFAOYSA-N 396.450 5.189 30 20 GKED Cc1c(CNCc2cccc(OCc3ccccc3C#N)c2)oc2ccccc12 609677686 XCPVMHNRORQGHT-UHFFFAOYSA-N 382.463 5.482 30 20 GKED C=CCN1CCC(NC(=O)Nc2cccc(CSC3CCCCC3)c2)CC1 609751094 XFSIPQIPNKJOAX-UHFFFAOYSA-N 387.593 5.024 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)CSCc2ccc(C#N)cc2)c1 609791900 TUCDOAJYKITSFP-JOCHJYFZSA-N 378.541 5.244 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2C[C@@H]2Cc2ccccc2)cc1 610203922 VLYVCWGHAWPOTN-JTHBVZDNSA-N 398.531 5.212 30 20 GKED CCC[C@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610356018 HGFDGEKGFHDZPV-LIRRHRJNSA-N 389.421 5.479 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1)c1cccc(C#N)c1 610356273 NELRVXJNYOGUKF-QZTJIDSGSA-N 389.524 5.654 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CC[C@@H](CSc3ccccc3)C2)c(Cl)c1 611094865 BEICOIQAOXBXSJ-CYBMUJFWSA-N 391.323 5.119 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc(-c2ccccc2)cs1 613392122 KWLSBLKXFHOTOW-JOCHJYFZSA-N 392.483 5.871 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 614405963 KWIRLBLYYHQIGX-AWEZNQCLSA-N 381.932 5.803 30 20 GKED O=C(C[C@@]12CCCC[C@H]1C2(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 619129973 VMOKSLXNKMQXNA-YPMHNXCESA-N 395.334 5.372 30 20 GKED C=CCCOCCCCC(=O)Nc1ccccc1-c1nc2ccc(Cl)cc2[nH]1 650183901 PMNRHMQTEAYQMM-UHFFFAOYSA-N 397.906 5.585 30 20 GKED CC(F)(F)c1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 653567013 VVNNTRWAYSNAHO-NXEZZACHSA-N 390.274 5.003 30 20 GKED CC(=O)C(C)(C)CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 676521801 YYXKDDUUZVDCHQ-IBGZPJMESA-N 382.891 5.329 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H]1CCC(F)(F)C1)c1ccc(C(F)(F)F)cc1 676725871 QYGANGCTQWHZEX-LSDHHAIUSA-N 376.369 5.200 30 20 GKED N#C[C@@H](C(=O)c1sc(-c2ccccc2)nc1C(F)F)c1nc2ccccc2o1 677791000 JMOWPURKULJSTD-LBPRGKRZSA-N 395.390 5.379 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H]1C[C@H]1c1cccc2ccccc12 730749362 KVZNLZJYSYIJAE-GOTSBHOMSA-N 391.474 5.079 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2ccc(C(F)(F)F)nc2O)c1 731564395 CVNWSHNAKAFDBW-LUAWRHEFSA-N 383.369 5.678 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2sccc2-c2ccc(C)cc2)c1 733773258 WZHPNRSSZXCQAK-IBGZPJMESA-N 390.508 5.335 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)c2cc3ccccc3s2)c1 733848589 ZCNWEHHAOADFAK-CRAIPNDOSA-N 393.512 5.143 30 20 GKED C=CC[C@@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccncc1 734510654 YJZGOMLBESHJHC-JOCHJYFZSA-N 391.902 5.394 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(Cl)c1 736465889 TWNIOCOPCYJSPT-JOCHJYFZSA-N 388.898 5.912 30 20 GKED COc1cccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 753397335 ZGQZJECAGOKXPV-OXQOHEQNSA-N 390.508 5.497 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](Cc1ccccc1)c1cccs1 754366624 JUKMPOYLIUBBSP-LJQANCHMSA-N 382.916 5.377 30 20 GKED COC1CCC(CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CC1 759889487 MHWBJKZFXOOOEM-UHFFFAOYSA-N 396.918 5.340 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)c1 762604196 MYPTTZZZGZPCAS-VMPITWQZSA-N 382.366 5.075 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2n1C 766836963 GJQKHGYKPQIKJA-HCYCVZQXSA-N 384.266 5.160 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 768670878 OLYVUSRBLQOGAF-UHFFFAOYSA-N 396.434 5.706 30 20 GKED CCOC(=O)c1ccc(-c2ccc(CNc3ccccc3O[C@@H](C)C#N)o2)cc1 775974161 XFESFBWUWBFFRW-INIZCTEOSA-N 390.439 5.026 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)Cc3ccccc3CC#N)c2)C1 776860826 LIHCBELGVHICCG-MBSDFSHPSA-N 376.500 5.029 30 20 GKED O=C1/C(=C\c2cccc(Br)n2)CCc2nc(-c3ccccc3)sc21 777916877 RXAUJJALOWJXGQ-QBFSEMIESA-N 397.297 5.180 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@H]2CCO[C@H](C(C)C)C2)c1 781646116 OMJXFPVYEWXONT-UGKGYDQZSA-N 381.541 5.104 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1cccc(Cl)c1Cl 782245080 ITAFFQBUPFIYFK-UHFFFAOYSA-N 395.340 5.048 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(C(C)C)c(Cl)c1 786446973 GNQFFPOICWAMAG-IBGZPJMESA-N 396.918 5.549 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1cccc(C#N)c1 800570196 HBSOSBMHDRRQNA-LLVKDONJSA-N 397.784 5.035 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2cccc(C)c2)c2cccc(F)c2)c1 800973827 AHXHSMWFXHNCPO-NOZRDPDXSA-N 388.486 5.694 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2cccc(-c3ccccn3)c2)C(=O)c2ccccc21 802709512 QRDQELLJGZQBTA-SIWPHUPXSA-N 383.447 5.065 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc2nc(C(F)F)sc2c1 804720056 DBKBZPGXXNLPJC-UHFFFAOYSA-N 398.394 5.050 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2cc(Cl)c(O)cc2F)cc1 805260174 OBJNAVTVZARDHO-UHFFFAOYSA-N 398.846 5.460 30 20 GKED O=C(CSC(F)(F)F)O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809128401 UTBZMTWLOXAPFM-VIFPVBQESA-N 386.235 5.105 30 20 GKED Cc1nc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)sc1-c1ccccc1 814309467 GCDITVAXTOVPSP-IBGZPJMESA-N 390.512 5.675 30 20 GKED CC(C)Sc1cc(Br)ccc1C=NN[C@@H](C)c1ccncc1 819815692 CFDFHHMWICBWNQ-ZDUSSCGKSA-N 378.339 5.029 30 20 GKED CCCc1ccc(CCCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 842699086 HSVJUFDPTLOCIZ-FQEVSTJZSA-N 389.524 5.357 30 20 GKED C[C@@H](CC(C)(C)C#N)OC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 851209861 PVNRCCPPAAOAPK-NSHDSACASA-N 394.258 5.061 30 20 GKED N#C[C@H](C(=O)[C@H]1[C@H]2c3ccc(Cl)cc3C[C@H]21)c1nc2cc(Cl)ccc2s1 860479482 QJBMVJFWKIWKLK-KJWYOANISA-N 399.302 5.365 30 20 GKED C[C@@H](Oc1ccccc1NCc1cc(C#N)ccc1Br)C(F)(F)F 864028290 MRUXRZNZCIMVTF-LLVKDONJSA-N 399.210 5.262 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915354067 UMXCKHZYKNXFNV-MHECFPHRSA-N 399.494 5.576 30 20 GKED C(=NNc1nccc2sccc12)c1c(-c2ccccc2)nc2sccn12 915980348 OXFLSJSNTMCTDE-UHFFFAOYSA-N 375.482 5.119 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3c(C)nn(Cc4ccccc4)c3C)oc12 916130643 ZRFFEZGCTBHABC-SEYXRHQNSA-N 386.451 5.199 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccc(O)cc1 916134914 WUHVEGPFVJYIGM-YIXHJXPBSA-N 377.827 5.194 30 20 GKED CC(=NOCc1c(Cl)ccc2cccnc12)c1ccc(NC(=O)C2CC2)cc1 917398229 RPDVFQPJQROGMO-UHFFFAOYSA-N 393.874 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(C1)CC(F)(F)C2(F)F 931063297 XCOYPXWVIIUEBN-SFHVURJKSA-N 384.417 5.437 30 20 GKED CCCCCCCOc1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)cc1 1776785950 ZOJFUFMATFYOCY-BBIZSYTBSA-N 392.495 5.874 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cnccc3C(F)(F)F)cc2)cc1 1777671127 GJAPFLWGWWYWHA-XCVCLJGOSA-N 397.352 5.362 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)C3(F)CCCCC3)cc2)CCC1 1789161621 AGAVGCQAHTZGDY-KRWDZBQOSA-N 386.511 5.005 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CCC2)cc1 1791587938 VZXZTJZCVQTVQE-YUXAGFNASA-N 394.559 5.303 30 20 GKED C=CC(=O)Nc1cccc(C(=O)N(CCCCCCCC)Cc2ccccc2)c1 2088604657 ULLGHBUQQDWZTJ-UHFFFAOYSA-N 392.543 5.814 30 20 GKED C[C@H]1CCc2sc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cc2C1 41559393 DPDDJLGDRDIXDP-AAEUAGOBSA-N 385.439 5.108 30 20 GKED Cc1noc(C)c1CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 47227191 UJGYYDXVHFCLEC-HXUWFJFHSA-N 393.874 5.172 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2cc3cccc(OCC)c3o2)ccc1OC 60927270 VOKMGIIXTCOQOT-KRWDZBQOSA-N 395.499 5.646 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C/c2csc(-c3ccsc3)n2)S1 63276383 NYFPSOYRTNCWJY-NVNXTCNLSA-N 397.550 5.380 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)cc1 66954238 JTKNVGMUKRRMBE-CRAIPNDOSA-N 383.517 5.362 30 20 GKED CCOc1ccccc1CN(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954903 JGIJSKNGLYCNQN-INIZCTEOSA-N 383.517 5.143 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 103330550 PWQWDQJQTLPSIN-MAUKXSAKSA-N 376.481 5.189 30 20 GKED CCc1cccc2c(CC(=O)Nc3ccccc3S[C@H](C)CC#N)c[nH]c12 109212060 SZWUSNCMHZFOKV-OAHLLOKOSA-N 377.513 5.306 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCOC2(CCCCC2)C1 124698992 DYHCSNXZRNBPDS-IRXDYDNUSA-N 387.549 5.084 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@H]1CCC[C@H](C(F)(F)F)C1 128964532 VSWAGLDUYHMXSU-UWVGGRQHSA-N 387.295 5.074 30 20 GKED N#C[C@H](C(=O)CCCc1ccccn1)c1nc(-c2ccc(Cl)cc2)cs1 136726556 NDXILVLMUHHRAS-QGZVFWFLSA-N 381.888 5.058 30 20 GKED Cc1cccc(Cl)c1NC(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1 155395794 GEHWUHYISYBMDA-UHFFFAOYSA-N 391.858 5.363 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)c1cccc2ccccc12 176675805 VUXCNUUYDSJHLR-HNNXBMFYSA-N 382.510 5.035 30 20 GKED CC(C)Oc1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)c(C(F)(F)F)c1 181658135 HBJUZLMSXIQDDS-HNNXBMFYSA-N 392.421 5.246 30 20 GKED COc1cccc([C@H](N[C@@H](C)c2ccc(C#N)cc2)c2cc(F)ccc2OC)c1 181847601 OYKBSOKHHMOWHQ-FYSMJZIKSA-N 390.458 5.155 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cnn(C(C)C)c2nc1C 189898832 UNKHZIUMFITYSI-UHFFFAOYSA-N 376.504 5.425 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2ccccc2nc1C 192598709 HWHOKCKYKJLPPW-UHFFFAOYSA-N 394.434 5.163 30 20 GKED CC[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc(C(F)(F)F)cs1 301415315 DWMNBQVQZAVXNZ-NSHDSACASA-N 379.329 5.616 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OC(C)C)c(OC)c1 301747963 GNGNCXLGPDILLK-UHFFFAOYSA-N 379.909 5.026 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 303429282 FJNNXHQZGKYDPY-UXHICEINSA-N 386.417 5.119 30 20 GKED CCO[C@@H](C)c1nc(CN(Cc2cccc(C(F)(F)F)c2)[C@H](C)C#N)cs1 425541840 XKADDFUQJXOHNC-KGLIPLIRSA-N 397.466 5.174 30 20 GKED Cc1ccc(-c2ncccc2NC(=O)c2sc3ccc(C#N)cc3c2C)s1 429874890 BWOWROXDUSUPOA-UHFFFAOYSA-N 389.505 5.766 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H]1c1ccc(Br)c(C)c1 431130317 UMMGSAJMVGZXDH-IBGZPJMESA-N 394.353 5.184 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc2ncsc2c1 431916459 MNGHYFHHBAVEFR-CRAIPNDOSA-N 378.501 5.092 30 20 GKED CC(C)C1CCC(N(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC1 432563987 YEIMOXVFXAJOGV-UHFFFAOYSA-N 377.488 5.032 30 20 GKED C[C@@H](Nc1ccc(NC(=O)[C@H](C#N)CCc2ccccc2)cc1)c1ccccc1 433357398 XIXDZMWZXOVNKA-KNQAVFIVSA-N 383.495 5.571 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC1CC(OC(C)(C)C)C1 433517650 CVTTXNDSICKBGR-KLAILNCOSA-N 389.565 5.186 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H]1CCCc2nc(CC)sc21)c1ccccc1 435758454 DRJFWJYZAZUDDV-PKOBYXMFSA-N 383.561 5.432 30 20 GKED CCc1ccccc1CSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 438302274 HUGMQGBJKNCIMS-INIZCTEOSA-N 384.570 5.515 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)[C@H](c2ccco2)C1 442054214 JFQGXSYTJXVZID-WFASDCNBSA-N 393.365 5.055 30 20 GKED Clc1ccc(OCc2nnc(SCC#Cc3cccc(Cl)c3)o2)cc1 448110433 SCUFMEUXDWYSPF-UHFFFAOYSA-N 391.279 5.099 30 20 GKED C[C@@]1(F)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 454486902 OUAHQHYHTOMGJB-GHTZIAJQSA-N 385.870 5.351 30 20 GKED CC(C)CN(C(=O)[C@@H](C)c1ccc(Br)s1)c1ccc(C#N)cc1 463591752 QNZRHPQEVHKMPF-ZDUSSCGKSA-N 391.334 5.175 30 20 GKED N#Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1F 464648667 ROYTUWPMVOHKPY-UHFFFAOYSA-N 393.399 5.009 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)N(CCC(F)(F)F)CC(F)(F)F 468518899 YLSLDQRNSHERTJ-NSHDSACASA-N 395.265 5.066 30 20 GKED CN(Cc1ccn(C(F)F)n1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 468544878 UURVLTMWBGQAOE-GFCCVEGCSA-N 387.274 5.032 30 20 GKED N#Cc1cccc(SCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 468629617 IUEGRUAHLRVOTG-GOSISDBHSA-N 391.323 5.321 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 473392469 WAMXPJUMBWVRCC-UHFFFAOYSA-N 384.357 5.109 30 20 GKED C=C(C)[C@@H](CC(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)OCC 474271236 IQZRSCWQQPPOPN-HUUCEWRRSA-N 397.359 5.186 30 20 GKED C=C(C)[C@@H](CC(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)OCC 474271237 IQZRSCWQQPPOPN-LSDHHAIUSA-N 397.359 5.186 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 476121308 GHOBVZOYTFCTHP-RTBURBONSA-N 387.445 6.300 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccc2ccccc2n1 486240989 SGCZFDVDTGCCLA-INIZCTEOSA-N 375.497 5.058 30 20 GKED Cc1csc(Nc2ccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)n1 487239565 JKNANNYLGVWLTH-FQEVSTJZSA-N 390.512 5.360 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 488352769 WRZWTQGIJMRFBZ-LLVKDONJSA-N 389.933 5.502 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(-c2nc(O)cc(CC)n2)c1)c1ccccc1 488641690 ANNBYDDBJFTTET-OAQYLSRUSA-N 387.483 5.100 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1 507007888 QPNYVGGDGFMXDO-UHFFFAOYSA-N 396.821 5.170 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 508276142 SAPBJWDHLJFJAS-FQEVSTJZSA-N 397.478 5.680 30 20 GKED C=CCN(C(=O)c1ccc(CN(CC)C(C)C)cc1)c1nc2c(s1)CCCC2 508769256 OBFSOIXNENMJRM-UHFFFAOYSA-N 397.588 5.085 30 20 GKED C=CCn1c([C@@H](C)CC)nnc1N1CCC(c2nc3cc(Cl)ccc3o2)CC1 508813599 POXZWLWYYVOJHF-AWEZNQCLSA-N 399.926 5.156 30 20 GKED C=CCOc1ccc(CNCc2ccc(-c3csc(C)n3)cc2)cc1Cl 518782388 WJNSVKMPPMENGR-UHFFFAOYSA-N 384.932 5.627 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N(Cc3ccccc3)C3CC3)cc2)cc1 519053842 VUIYNXDJGAKDJM-UHFFFAOYSA-N 383.451 5.547 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccc(Cl)cc1 519304822 SZDBLCVKEKIUBN-AWEZNQCLSA-N 378.646 5.123 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCC[C@@H]1c1ccccc1 520939020 JOLFQACIIARENQ-RLLQIKCJSA-N 393.556 5.929 30 20 GKED COc1cccc([C@@H](NCc2ccc(C#N)c(OC)c2)c2ccccc2Cl)c1 521122187 BHRJDNKYFLLMGJ-HSZRJFAPSA-N 392.886 5.108 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 521244840 BGVDCHYLLHIURL-UHFFFAOYSA-N 390.414 5.449 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Cl)s1 521733203 AXPMPUPXSINNSY-UHFFFAOYSA-N 390.839 5.678 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2[nH]c3ccc(F)cc3c2Cl)cc1 521770030 YEOJPHSLLAWTIL-QGZVFWFLSA-N 383.854 5.253 30 20 GKED Cn1cc(CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c2ccccc21 525224195 PKNTZCIMQHTSDF-UHFFFAOYSA-N 399.425 5.163 30 20 GKED CCCc1c(NC(=O)c2ccccc2SCC)cnn1-c1cccc(C#N)c1 525894266 KYHQUJYFAIHLHK-UHFFFAOYSA-N 390.512 5.061 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 536542193 WHJAUQPVXUJNBY-FOCLMDBBSA-N 387.508 5.159 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3ccc(C#N)c(F)c3)s2)cc1 538509238 JAFDNBYIESGXJS-CABCVRRESA-N 379.504 5.850 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(C#N)cc3OC(F)F)cc2)cs1 539281304 SWDJGJVSBFCCIV-ZDUSSCGKSA-N 399.466 5.442 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 541007220 IOUJVILJYPZOAQ-PGRDOPGGSA-N 396.918 5.340 30 20 GKED CCc1nc(C)c([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542996272 XKHQMYPAPAROQP-HZPDHXFCSA-N 375.541 5.964 30 20 GKED N#CCCC[C@H](N[C@H]1CCCc2nc(-c3ccccc3)sc21)c1ccccc1 551207644 BHIGIQXUEUISCG-SFTDATJTSA-N 387.552 6.212 30 20 GKED CC(C)(NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1 551694186 HGFPPEOBVZPOKV-UHFFFAOYSA-N 391.858 5.064 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 554442687 OGCZDNZFLWBHKN-HLIPFELVSA-N 379.529 5.696 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc([N+](=O)[O-])c1 555721055 DFPDXQSTBSIPHS-OAHLLOKOSA-N 387.395 5.001 30 20 GKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1ccc(C#N)cc1 558872899 QTGJMXBMIIDIRE-XYJBZRSYSA-N 393.962 5.476 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCOCCC#N)n2C2CCCC2)cc1 570422435 CIZFHIDOTHFMBM-UHFFFAOYSA-N 398.576 5.380 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 570706879 ZOENYMLGHIMUNW-RPWUZVMVSA-N 387.527 5.326 30 20 GKED CC(F)(F)c1ccc(-c2noc([C@@H]3CCCN3c3ccc(C#N)cc3)n2)cc1 589373581 YBYMXBHKBRPYGU-SFHVURJKSA-N 380.398 5.061 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c1 589741185 VIDGLEBTJAAHOJ-HNNXBMFYSA-N 381.501 5.476 30 20 GKED Cc1ccc(-c2ccsc2C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 592974203 POHIPMUUKKSQFO-MRXNPFEDSA-N 392.480 5.962 30 20 GKED N#CCCCCC(=O)Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1 593973736 FAIOEAZRAXLFBH-UHFFFAOYSA-N 390.487 5.232 30 20 GKED N#CCCCOc1cccc(CNC2(c3cccc(OC(F)(F)F)c3)CC2)c1 594521917 VYLIZUSLBJQPLS-UHFFFAOYSA-N 390.405 5.047 30 20 GKED CCN(C(=O)CC1(C#N)CCCCC1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 597216088 CKIWZQFBJCQLQD-JOCHJYFZSA-N 397.469 5.162 30 20 GKED C[C@H](Nc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@H]1C)c1cccc(C#N)c1 600849347 OSEWCUBBBBOYTF-BBWFWOEESA-N 395.934 5.788 30 20 GKED Cc1nc(-c2ccc(CNC(=O)Nc3ccc(C(C)(C)C#N)cc3)s2)cs1 603658241 UXKMREJXAHDGRP-UHFFFAOYSA-N 396.541 5.303 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 608860908 OKQJXZHPCUTDLK-UHFFFAOYSA-N 389.886 5.220 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C4CC4)c23)cc1 609018614 HQPMBABSHHEWPB-UHFFFAOYSA-N 398.397 5.030 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)Nc1ccc(F)c(C#N)c1 609207610 ILOLMLQHDJIZJQ-GFCCVEGCSA-N 398.438 5.151 30 20 GKED CC[C@H](C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccccc1 609384856 KCCSECXQICYMHJ-RBUKOAKNSA-N 395.572 5.320 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1coc2cc3c(cc12)CCC3 609427740 HGRFODMUYGMYHW-OAHLLOKOSA-N 390.508 5.497 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 609501853 GHTGPMUKUSSRDS-IRXDYDNUSA-N 388.389 5.106 30 20 GKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1cccc(Br)c1 609825867 XZWRBSXDJZAPKO-CHWSQXEVSA-N 389.318 5.142 30 20 GKED CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610015351 FZEJMIBZFRKAOE-UZLBHIALSA-N 378.476 5.178 30 20 GKED Cc1ccc2c(Cl)c(C(=O)N[C@@]3(C#N)CCc4ccccc4C3)sc2c1 613677732 WACNIUQEMFNWCP-NRFANRHFSA-N 380.900 5.044 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCOc2ccc(Cl)cc2Cl)cc1 726940429 SSYDLQDNRIURES-UHFFFAOYSA-N 377.271 5.018 30 20 GKED COc1c(O)cccc1/C=C1/CCc2nc(-c3ccc(C)cc3)sc2C1=O 727654601 OCOVUQFQPAASGG-QINSGFPZSA-N 377.465 5.045 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(F)cc1 727849608 GLPFDXRGAYHPRR-QHCPKHFHSA-N 381.410 5.036 30 20 GKED Cc1ccc(C)c(CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 728147807 NITDZQJZZDACTQ-HNNXBMFYSA-N 388.414 5.351 30 20 GKED C#Cc1cccc(N(C(=O)c2csc(-c3ccccc3Cl)n2)C(C)C)c1 728246769 YGTOMQMUZFWRMD-UHFFFAOYSA-N 380.900 5.500 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCCCc1ccccc1 729145963 IOECGPWMMZHQBF-UHFFFAOYSA-N 380.923 5.205 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2csc(-c3ccc(C)cc3)n2)cc1OC 731320804 ZCHCOHNFCHTGHN-MDZDMXLPSA-N 379.481 5.340 30 20 GKED CCC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C1CCCCC1 733080125 FRHGGHNYTIIDST-UHFFFAOYSA-N 377.414 5.316 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3OC)cc2)c1 742370987 CWWYZBZXBASSPX-JOCHJYFZSA-N 386.495 5.333 30 20 GKED CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743097375 VAEOAQCKPQXKIA-YFXJRYMSSA-N 375.516 5.775 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)cc1 747377685 ZJEMSYVTEKYTJA-RJGXRXQPSA-N 386.882 5.738 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1cccc(Oc2ccccc2)c1 749360861 IXJJDGPMBWUFAB-UHFFFAOYSA-N 393.446 5.228 30 20 GKED Cc1c(C(=O)OCC2CCC(C#N)CC2)sc2nc(C(F)(F)F)ccc12 755963429 DBFLYTILXUWRMA-UHFFFAOYSA-N 382.407 5.110 30 20 GKED C#CCCCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 757915500 KHPBZUWOHBAOKC-VQIMIIECSA-N 390.914 5.660 30 20 GKED CC[C@@H](C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccc(F)cc1 764791431 PFSKFHCKCSIKJH-SNVBAGLBSA-N 396.249 5.034 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cncc3ccccc23)cc1 765591410 SSSIDDMRVNSQKH-GAJHUEQPSA-N 399.494 5.028 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Br)c(F)c2)c1 772985279 WADOJDAOIHKTKQ-CZUORRHYSA-N 391.284 5.120 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1C#N 773081605 FFEOCWZTKGJMLZ-AWEZNQCLSA-N 393.468 5.054 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)Nc1ccc(SC(F)F)cc1 782917654 AZUSOAHLHSFROV-UHFFFAOYSA-N 384.860 5.257 30 20 GKED N#C[C@H](C(=O)CC1CC(c2ccccc2)C1)c1nc2ccccc2n1C(F)F 798817036 ULSMDEXHHNUHDM-BDVYOWHSSA-N 379.410 5.192 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H](C)CC[C@H]2c2ccccc2)c1 806806246 AGKBBLJJQNNTIK-ZEYPLWLESA-N 391.515 5.050 30 20 GKED N#CC[C@@H](CC(=O)O[C@@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 816066204 WDXWRUPZBYPEGQ-KSSFIOAISA-N 388.345 5.062 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1nc(C2CC2)cs1 842942507 KIRRPEAOOQBFSI-YNEHKIRRSA-N 377.296 5.307 30 20 GKED CC(C)(c1ccc(C#N)cc1)c1nc(-c2cccnc2Oc2ccccc2)no1 904455789 MMUQCHLJMLPPLD-UHFFFAOYSA-N 382.423 5.121 30 20 GKED Sc1nnc(Cc2cccc3ccccc23)n1N=Cc1cccc2ccccc12 916278162 DCQAIGPUXVYFJI-UHFFFAOYSA-N 394.503 5.346 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC(F)(F)F 916699777 VRZBYIUEZDGFJB-UHFFFAOYSA-N 393.434 5.614 30 20 GKED N#C[C@@H](C(=O)Cc1csc2ccccc12)c1nc2cc(Cl)ccc2s1 917047184 SXPDGEWTWMWGKO-AWEZNQCLSA-N 382.897 5.583 30 20 GKED C[C@H](NC(=O)c1ccccc1OCC#N)c1ccc(Oc2ccccc2)c(F)c1 919819444 RMOVQGOQFLHSKO-INIZCTEOSA-N 390.414 5.011 30 20 GKED CCCCC1CCC(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC1 920141312 NJOQEHOZIBYFMV-RRWXTXHCSA-N 391.540 5.855 30 20 GKED COc1ccc(/C=C2/CCOc3c(ccc(Cl)c3Cl)C2=O)cc1OC 921138614 VCPGORMHLRVKQG-XFXZXTDPSA-N 379.239 5.059 30 20 GKED O=C(O)c1cccc(C=NNc2c(Cl)cc(Cl)cc2Cl)c1Cl 1776014472 IMEOPQJHMKSHSH-UHFFFAOYSA-N 378.042 5.444 30 20 GKED CC1(C)Cc2cccc(/C=C/C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)c2O1 1776569856 PUTDIHUSSPTAFB-ZHACJKMWSA-N 388.419 5.254 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](CC(=O)O)C2CCCC2)c1 1776788655 HGEWHEADNGKDJQ-NRFANRHFSA-N 375.553 5.407 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)cc1 1776794134 WIPWVBYWLFDEAZ-IFCKCIONSA-N 382.456 5.004 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1OC 1777353262 IELYCRPPHZGMPX-VQHVLOKHSA-N 394.448 5.027 30 20 GKED CC(C)c1ccc(C(=O)/C(=C(/S)N[C@@H]2CCCC[C@H]2C)[n+]2ccccc2)cc1 27486371 NLJONWMKLUHSLX-WIYYLYMNSA-O 395.592 5.205 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)N[C@@H]2CCCC[C@H]2C)cc1 27486992 CJDOVOIPSCARKS-TZIWHRDSSA-O 395.592 5.006 30 20 GKED Cc1ccc(C(=O)/C(=C(\S)Nc2ccc3ccccc3c2)[n+]2ccccc2)cc1 55013202 NUIWUNZSWAMHDN-UHFFFAOYSA-O 397.523 5.487 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1cc2ccccc2[nH]1 58903066 YDIVPPDOXUCBMN-UHFFFAOYSA-N 383.476 5.121 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc3cc(Cl)ccc3o2)cc1 65869989 GTJNPXHEOGYJDR-UHFFFAOYSA-N 394.858 5.153 30 20 GKED CC(C)c1ccc(CSc2nnc(SC[C@H](C#N)CCC#N)s2)cc1 66400235 KRMKRUZNMHRXSY-HNNXBMFYSA-N 388.587 5.489 30 20 GKED C=CCN(Cc1csc(-c2cccc(OC)c2OC)n1)Cc1cccs1 67444007 WBQXROAYELFMDN-UHFFFAOYSA-N 386.542 5.077 30 20 GKED O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cc(F)ccc1F 103868330 ICATWBAJNOPUAI-UHFFFAOYSA-N 399.237 5.020 30 20 GKED CCc1ccccc1O[C@H](C(=O)[C@H](C#N)c1nc(C)cs1)c1ccccc1 107407928 OLMSAZBYDHDEPI-RXVVDRJESA-N 376.481 5.011 30 20 GKED COc1ccc(CCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1Cl 108238574 JNINVESEQAUGHL-CQSZACIVSA-N 388.920 5.172 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1ccccc1Cl 108356553 YWIKKAAHZLMNRS-LSDHHAIUSA-N 387.936 5.024 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 120027370 XCSVONIGFPQERF-UHFFFAOYSA-N 391.805 5.033 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(CCC(F)(F)F)c2)c1 122990942 JXZHHXTVUJKJRJ-UHFFFAOYSA-N 391.393 5.508 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccco2)s1)c1nc2cc(Cl)ccc2s1 171482174 ZAUYGUBLBFSWOJ-SNVBAGLBSA-N 385.857 5.156 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 182070549 IEDCOGWHVHGTCU-CQSZACIVSA-N 378.378 5.175 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)sc1-c1ccc(F)cc1 190964517 HMOSYPHZQXHHCT-INIZCTEOSA-N 387.439 5.296 30 20 GKED CC(=NOCc1ncc(-c2cccs2)o1)c1nc2ccccc2n1C(F)F 255778668 WPLUABKOEQCPLJ-UHFFFAOYSA-N 388.399 5.089 30 20 GKED OC1=NC[C@H]([C@@H]2CCCCN2C(O)=Nc2cccc(-c3cccc(Cl)c3)c2)C1 329140353 SZGFQZADVATKBM-XLIONFOSSA-N 397.906 5.383 30 20 GKED CC(C)n1c([C@@H]2CCCN2C(=O)c2ccc(C3(C#N)CC3)cc2)nc2ccccc21 329355477 GSENGYJCCHMEMF-QFIPXVFZSA-N 398.510 5.150 30 20 GKED OC(=Nc1cc(N=C(O)[C@@H]2C[C@H]3C=C[C@H]2C3)c(F)cc1F)[C@@H]1C[C@H]2C=C[C@H]1C2 329907457 KYEKFRVSJWLEJU-OSLXHZNNSA-N 384.426 5.565 30 20 GKED O/C(=N/C1CCC(C(F)(F)F)CC1)c1c[nH]nc1-c1ccc(Cl)s1 330270419 UDVGACJWPAJESO-UHFFFAOYSA-N 377.819 5.217 30 20 GKED C=CCC[C@@H](NC(=O)c1c(C2CC2)noc1C)c1ccc(C(F)(F)F)cc1 410612402 YGAOLQUGTIFWLW-MRXNPFEDSA-N 378.394 5.317 30 20 GKED N#Cc1ccc(C(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)s1 429338534 MJGQBTYVRYTNFX-KQZSUJQPSA-N 393.537 5.034 30 20 GKED CCN(CC)Cc1cccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1 435370173 HKRADVTWELMJMH-UHFFFAOYSA-N 388.515 5.039 30 20 GKED CCN(CCC#N)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 435579904 NNBWKUUISXEMPT-UHFFFAOYSA-N 380.275 5.148 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(Cc2ccccc2Cl)CC1 439103888 XXMICAJQNRIKHB-HNNXBMFYSA-N 384.932 5.553 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(Cc2ccccc2)no1 439572689 NVSGKZJKFVEZFP-QGZVFWFLSA-N 396.450 5.497 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)c1 444271229 XQJSUSXQKYCKGJ-FQEVSTJZSA-N 385.511 5.192 30 20 GKED C[C@H]1CC[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2sccc21 453208099 BARGIMNLGVKPGS-KXBFYZLASA-N 379.529 5.382 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCc1ccc(-c2ccccc2)o1 464958679 GBAJWAKLLBCSAH-GOTSBHOMSA-N 384.479 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H]1c1cccc(OC)c1 475557293 XRJQQIPNHOWBLR-MBSDFSHPSA-N 392.543 6.162 30 20 GKED CC(C)(CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C(F)(F)F 480610346 ILMHUBKMUDDHMI-NSHDSACASA-N 395.265 5.404 30 20 GKED CC(C)OCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)oc2ccccc12 483194148 IGNAJGFDDHVLEA-LJQANCHMSA-N 384.435 5.396 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccccc1 487601561 IOYZYBNFYOCMFZ-JOCHJYFZSA-N 390.458 5.570 30 20 GKED CC(C)CCn1ncc(NC(=O)N[C@H](CCC#N)c2ccccc2)c1C(C)C 487617762 OESPLFYYMNTVOR-LJQANCHMSA-N 381.524 5.219 30 20 GKED CSc1ccc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1 487996836 ZONUIZWDKYKWTN-UHFFFAOYSA-N 390.483 5.262 30 20 GKED C=CC[C@H](C(=O)N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 488677225 RIQLPXJNBAGAHD-CYFREDJKSA-N 386.495 5.198 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N[C@@H]2CCCC(F)(F)C2)c1 488980257 NNHSDNOUMFHQSX-CQSZACIVSA-N 390.817 5.312 30 20 GKED Cc1cccc([C@@H](C)S(=O)(=O)Cc2ccc(-c3ccccc3C#N)cc2)c1 494729608 RCVPEHZRWJWHFD-GOSISDBHSA-N 375.493 5.210 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](C)c1ccccc1C(F)(F)F 495550004 YMHYKEXOLHSDTP-CABCVRRESA-N 396.478 5.021 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc2c(s1)-c1ccccc1OC2 499089024 PZKIVEQAVAPZBL-UHFFFAOYSA-N 388.492 5.232 30 20 GKED C=CCCc1ccccc1NCc1csc(N(C(C)=O)c2ccc(C)cc2)n1 500402678 LTVRPLYDKHXEOB-UHFFFAOYSA-N 391.540 5.867 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CSc1ccccc1Cl 501018304 LFPLDSMACIKRTL-UHFFFAOYSA-N 382.872 5.130 30 20 GKED CC(C)C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cccs1 504077812 LACHYKVUNHABDD-FQEVSTJZSA-N 379.529 5.206 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC(C)(C#N)CC2)c(C(F)(F)F)c1 506953992 RBMQSLVQMKGYIQ-ZDUSSCGKSA-N 399.482 5.754 30 20 GKED CC(C)CN(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccc(C#N)cc1 508560917 NMWFRZGGMKNWNR-UHFFFAOYSA-N 397.478 5.113 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H](C)CC[C@@H]1C 510103234 IIEMDXHSYGEPQD-AEFFLSMTSA-N 377.488 5.098 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2noc3c2CCCC3)cc1Cl 512199473 XILRYNMNADAUOL-GOSISDBHSA-N 391.858 5.115 30 20 GKED CC(C)(C)[C@H]1CCc2sc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cc2C1 515597257 DMTHKMLMRCHHES-GJZGRUSLSA-N 378.497 5.530 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](C)c2ccc(OCC(F)(F)F)cc2)c1 516319447 SVARZBSVZORFFV-CQSZACIVSA-N 394.393 5.075 30 20 GKED N#Cc1ccccc1OCC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 516780369 ZDZFWBFMRSZINV-UHFFFAOYSA-N 378.815 5.021 30 20 GKED Cc1c(C(=O)NCC(C)(C)CCC#N)sc2ccc(Br)cc12 516796524 JMIMCZAARUVUMW-UHFFFAOYSA-N 379.323 5.032 30 20 GKED N#Cc1cccc(C2(NCc3cc(C(F)(F)F)ccc3Br)CC2)c1 516896260 DYBMRRNCFQPRCW-UHFFFAOYSA-N 395.222 5.118 30 20 GKED COc1c(Cl)cccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518376402 WLHDPVYAWHDMAC-UHFFFAOYSA-N 392.842 5.459 30 20 GKED Cn1c(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c(Cl)c2ccccc21 518709443 XXGGXQCMEZQJKZ-QGZVFWFLSA-N 379.891 5.124 30 20 GKED Cc1ccc(-c2nc(C(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)cs2)o1 518709909 FBXURELHYWPASX-GFCCVEGCSA-N 392.267 5.013 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(Cl)c1Cl 518755316 FDZGJBLJFRMFOG-GFCCVEGCSA-N 394.327 5.709 30 20 GKED Cc1ccccc1N(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C(C)C 520706889 QGXAWSGWXUIVOK-UHFFFAOYSA-N 388.442 5.853 30 20 GKED CN(C(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1)C1(C#N)CCC1 520723961 FNGUWFCFKHAMKJ-UHFFFAOYSA-N 376.500 5.081 30 20 GKED Cc1cc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1C(C)C 521800987 VMADVWVBXJKDHV-QGZVFWFLSA-N 382.529 5.530 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)S[C@@H](C)c1ccc(C#N)cc1 522842287 OQPGBWCQZSZNMW-KBPBESRZSA-N 388.920 5.350 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](COCC(C)C)c1ccco1 523193006 TUSFNWVFFUGSGY-INIZCTEOSA-N 396.940 5.106 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H]1C(C)C 524438211 VGABBOQBXSVVJF-QFIPXVFZSA-N 377.488 5.098 30 20 GKED CC[C@@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 532285486 HMHMMWPZIJKFCW-OAHLLOKOSA-N 383.879 5.054 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(F)c1 537426653 HCNCUPGNMQCXJY-UHFFFAOYSA-N 388.398 5.253 30 20 GKED COC[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 537427372 HUPNMGZZDSLKFV-IBGZPJMESA-N 378.394 5.188 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CCOC3(CCCCC3)C2)c1 538427006 XCAGYTFOBNGCRG-QHCPKHFHSA-N 390.527 5.109 30 20 GKED COc1ccc(C[C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)cc1OC 540594629 CSFXIQHNMXGWAB-MBSDFSHPSA-N 386.495 5.210 30 20 GKED CC[C@@H](C)Oc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 561828356 QKOSSXAOBVSEAN-MRXNPFEDSA-N 387.439 5.175 30 20 GKED CC(C)(C#N)CCSCc1ccnc(-c2ccc(Br)cc2)n1 566032021 NHMXUJJDQNSBNW-UHFFFAOYSA-N 376.323 5.079 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)CC1 566188392 GYKKJPRAPRUTSU-UHFFFAOYSA-N 397.906 5.467 30 20 GKED N#CCc1ccccc1NC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 568226248 HDKDKTIJUHIFBP-UHFFFAOYSA-N 388.279 5.435 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](CCCC#N)c3ccccc3)s2)cc1 574298036 NTTCQTLNMFKOTR-AVRDEDQJSA-N 389.568 6.513 30 20 GKED Cc1ccc(CCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 579063527 JJHZSQLULVXYBO-UHFFFAOYSA-N 398.475 5.652 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3sccc3C3CC3)n2)cc1 591862708 ZVWQPMYLMDTJJP-MRXNPFEDSA-N 380.494 5.248 30 20 GKED Cc1c(NC(=O)CC2(C#N)CCCCC2)cccc1C(=O)Nc1ccccc1 597018076 AMQONMVPGNMSFP-UHFFFAOYSA-N 375.472 5.050 30 20 GKED C=CCCSCCNC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 597971603 VGZNKPGNSZTPPD-UHFFFAOYSA-N 399.343 5.007 30 20 GKED C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H](CCCC#N)c1ccccc1 599048696 PQDWCBSJUZFGIH-KSSFIOAISA-N 395.856 5.710 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(-c4ccccc4)s3)cn2)cc1 603764184 GQNKJLMXTPSTHZ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1F 605074807 CDJXCYZSBFCWSE-OAQYLSRUSA-N 398.412 5.979 30 20 GKED CCN(C(=O)[C@@H](C)c1c(Cl)cccc1Cl)[C@H](C)c1ccc(C#N)cc1 609581114 JHDAKMQAWXUMLU-UONOGXRCSA-N 375.299 5.578 30 20 GKED CN(C)Cc1ccc(-c2ccccc2CN[C@H]2CCCc3cc(C#N)ccc32)cc1 611390956 XFGQVRJRGQRSTA-MHZLTWQESA-N 395.550 5.454 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(Br)cc1C(F)(F)F 616354012 MZVLRIZWMIYJRZ-NEPJUHHUSA-N 397.238 5.751 30 20 GKED O=C(Nc1ccc(F)cc1Cl)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618538813 AOJIPXGMWXAQBJ-YUMQZZPRSA-N 392.702 5.074 30 20 GKED N#CC[C@@H](CC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccccc1 619429879 ZPGNGENZDLQNQW-INIZCTEOSA-N 397.450 5.038 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)c3c(Cl)cc(C#N)cc3Cl)c2)o1 619450787 UBCDZGCLJJXTEL-UHFFFAOYSA-N 385.250 5.994 30 20 GKED COc1ccc(F)cc1[C@@H](C)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 625288950 RJYCDFULEJFRPH-SNVBAGLBSA-N 395.318 5.723 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)[C@@H]1C[C@H]1C(F)(F)F 648494451 QPJICOBHPPVRHM-RKDXNWHRSA-N 397.212 5.113 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(c2ccc3cccnc3n2)CC1 654064478 YLYCHNAWSUEZGP-UHFFFAOYSA-N 386.499 5.160 30 20 GKED Fc1cc(Cl)ccc1CNC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 682085973 ZIYAQROORVOXFX-UWVGGRQHSA-N 377.731 5.478 30 20 GKED CN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1ccc(C#N)cc1F 726369380 VOHHMXIILVQPSD-UHFFFAOYSA-N 399.400 5.328 30 20 GKED Cc1ccccc1-c1cccc(/C=C(/C(=O)C(=O)O)c2ccc3ccccc3n2)c1 729641794 XYGWXNVRLJSQBW-CJLVFECKSA-N 393.442 5.405 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 730214789 NWRDRXGUCOORHW-UHFFFAOYSA-N 399.425 5.359 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc2cc(F)ccc2s1 730422406 XKGPOKCNIPIJGN-IBGZPJMESA-N 384.435 5.497 30 20 GKED C[C@@H](Cc1ccccc1Cl)NC(=O)Nc1ccccc1SC[C@H](C)C#N 731115313 DJGYMUWUNYFOEH-CABCVRRESA-N 387.936 5.344 30 20 GKED CC[C@@H](C)n1c(-c2ccccc2)nn(CN(C)Cc2cccc(C#N)c2)c1=S 749888465 PFUBFOSLRYMNKP-QGZVFWFLSA-N 391.544 5.013 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1ccc(-c2ccccc2)cc1 752479564 SVFHYDVALIFPBG-HXUWFJFHSA-N 380.447 5.649 30 20 GKED Cn1nc(-c2ccccc2)c(C=NOc2ccccc2C(F)(F)F)c1Cl 754710788 XUTKHFWSCKAIME-UHFFFAOYSA-N 379.769 5.172 30 20 GKED Cn1cc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2ccccc21 755167844 WRVPTJXOMSNQDH-DEOSSOPVSA-N 393.490 5.405 30 20 GKED COc1cc(F)c(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)cc1OC 760270696 UCMZNHGQTBIJKJ-FPLPWBNLSA-N 387.407 5.002 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 764873031 IDKJOVASFPUBPG-ZDUSSCGKSA-N 376.378 5.070 30 20 GKED N#Cc1cc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)ccc1F 770568195 BGOMVVRAWXHRTI-QGOAFFKASA-N 384.435 5.731 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(OC)cc1 776076922 KXBWEHHEIBBTJX-UXHICEINSA-N 390.508 5.497 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(Cl)c(Br)c2)c1 776186729 YDTPDYSIJSYMBB-HNNXBMFYSA-N 393.712 5.073 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)Nc3ccccc3O[C@H](C)C#N)sc2c1 780152303 SRTDKOXQBAZJQJ-CYBMUJFWSA-N 398.915 6.221 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@H](F)C(F)(F)F)c(C(F)(F)F)c1 788126216 GRDNAFLBYNXGNZ-CPCISQLKSA-N 377.325 5.435 30 20 GKED FC(F)c1ccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)cc1 794483141 MZLJOFPWHJOKTD-UHFFFAOYSA-N 378.835 5.044 30 20 GKED N#CC[C@H](CC(=O)O[C@H](C(=O)c1ccccc1)c1ccccc1)c1ccccc1 795988239 FXWYIJHRMADPGU-RDGATRHJSA-N 383.447 5.241 30 20 GKED C=CCC[C@H](NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)c1ccco1 796945773 BMFIXBKBXWMGFL-FQEVSTJZSA-N 382.504 5.327 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 798432940 RBGIZBDJGWORKP-KBPBESRZSA-N 392.446 5.699 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4ccccc4C#N)c23)cc1 814760995 DYPXIUCNEPZCAG-UHFFFAOYSA-N 399.479 5.075 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1sc(-c2ccccc2F)nc1C 814853225 HSLOESSMYOLMJB-UHFFFAOYSA-N 394.397 5.508 30 20 GKED N#C[C@H](C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1nc2ccccc2s1 819935398 ATRUIQOMXQKHDU-JVIWMGQHSA-N 378.419 5.087 30 20 GKED CC[C@H](CC(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790881 LJOFTNCVRZEXKQ-SCZZXKLOSA-N 376.350 5.173 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CNC2(c3ccc(C#N)cc3)CCC2)c1 847058288 LRIQRHDTHMQEJQ-UHFFFAOYSA-N 377.488 5.074 30 20 GKED N#Cc1c(NC(=O)/C=C\c2ccc3ccc(Cl)cc3n2)sc2c1CCCC2 912895784 QJERVBNRWHLZNP-KTKRTIGZSA-N 393.899 5.352 30 20 GKED CC[C@@H](NCc1c(F)c(F)c(F)c(F)c1F)c1ccccc1OC(F)F 915354424 RBWZHBBUINVJJI-SNVBAGLBSA-N 381.291 5.224 30 20 GKED N#Cc1ccc(OCCCSc2nn(-c3ccccc3)c(=S)s2)cc1 915791831 KLAHMBPNWBMPQL-UHFFFAOYSA-N 385.539 5.096 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 915862690 NZUQJAWIQJRTIX-HXUWFJFHSA-N 397.390 5.249 30 20 GKED FC(F)(F)c1ccc(NN=Cc2sc(Oc3ccccc3)nc2Cl)nc1 915936702 ARSLMOUTUPRNMQ-UHFFFAOYSA-N 398.797 5.449 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 916997035 RNCURXLOCMHTQU-APFBBLRHSA-N 377.296 5.649 30 20 GKED Cc1cc(Cl)ccc1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917042352 AEYQKPDVTVNBEP-ZDUSSCGKSA-N 391.279 5.167 30 20 GKED CC(C)(C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917042458 BGTMZPMWVZNAEU-CQSZACIVSA-N 398.915 5.502 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cc2sccc2s1 918486778 LIBYZVAOYPVSGJ-SECBINFHSA-N 395.292 5.231 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 920804623 XCIYYDGQKOIRQN-JKSUJKDBSA-N 394.446 5.385 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1cccc(C(=O)O)c1 1776038065 QFDFRCDMLDNIMG-UHFFFAOYSA-N 380.831 5.585 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3cc(Cl)ccc3[N+](=O)[O-])cc2)cc1 1776060603 DFJZOCUUSZKIHA-UHFFFAOYSA-N 395.802 5.059 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NN[C@@H](C)c1ccc(C(C)C)cc1 1776106180 TUWRBDUSZFFQLB-IBGZPJMESA-N 396.531 5.323 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ccc(Br)s3)c2c1 1776115309 UMLINMYZKVIHII-HNQUOIGGSA-N 393.283 5.320 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)CC2 1776374687 SKNZEUUSMULWFF-JCMHNJIXSA-N 396.486 6.388 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2ccccc2C)cc1 1776788197 QNTNIVWQLFJCOP-HSZRJFAPSA-N 383.532 5.650 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776950901 KFIILGKQRZSZJB-LCYFTJDESA-N 378.449 5.653 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)o1 1776966089 XRFTWHUDDYDXIK-LUAWRHEFSA-N 376.408 5.015 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1777372465 CFTUAEZQTLFYMP-HUSFYUSLSA-N 398.458 5.519 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3cccc(C)c3C)cc2)oc1C(=O)O 1777423218 JAPMYWXFQUTELI-FMIVXFBMSA-N 390.435 5.378 30 20 GKED O=C1/C(=C/c2cccc(Oc3ccc(F)cc3)c2)C[C@@H](C(=O)O)c2ccccc21 1777698316 DVBYRNAPHODGDQ-CNCHJIQNSA-N 388.394 5.456 30 20 GKED COc1cccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)c1 6340347 AMGKDLPDSKAIGU-OUKQBFOZSA-N 391.854 5.497 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(Cl)cc2)nnc1-c1ccoc1C 35767169 NNFNTXMMWOLNPL-ZDUSSCGKSA-N 387.892 5.049 30 20 GKED N#C[C@@H](C(=O)CCc1ncc(-c2ccccc2)o1)c1nc(-c2ccccc2)cs1 41522694 NCNXKNMNFQHWNT-SFHVURJKSA-N 399.475 5.274 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(Cl)cc2)cs1 54895061 KSUCJBQALQONHR-FMIVXFBMSA-N 396.899 5.686 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 56800328 LLWWFUVHTVANTK-UHFFFAOYSA-N 396.450 5.195 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCSc2c(F)cccc21 57666071 XXAXOJIIUMIWIZ-OAQYLSRUSA-N 388.467 5.331 30 20 GKED CC(=O)Nc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c(Cl)c1 68315109 ZGSCQMJQJWMBTM-UHFFFAOYSA-N 389.842 5.089 30 20 GKED Cc1cc(-c2noc([C@@H](C)Nc3cccc(OCCCC#N)c3)n2)ccc1F 120595915 WOKOLIIEFGPLPA-OAHLLOKOSA-N 380.423 5.040 30 20 GKED C[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccc(OCC#N)cc1 171768596 IFUDITGJBXBNCO-SFHVURJKSA-N 390.458 5.158 30 20 GKED N#CCOc1ccc(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 180547613 KNTMSLOLGKTBFB-IBGZPJMESA-N 393.487 5.019 30 20 GKED N#CCCCOc1cccc(NCc2ccc(Br)c3cccnc23)c1 181472329 HMAKEQLZFNKEPV-UHFFFAOYSA-N 396.288 5.292 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCCc2nc(CC)sc21 191478641 HUQGCUKTELYBDU-LJQANCHMSA-N 397.588 6.099 30 20 GKED C=CCn1c(SCc2ccc3ccccc3n2)nc2cc(Cl)ccc2c1=O 216110980 VBUFWSYMXINILT-UHFFFAOYSA-N 393.899 5.076 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)NC1(C#N)CCCCC1 217334390 IGFJAJMWYSUPCT-UHFFFAOYSA-N 383.495 5.095 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1ccccc1S[C@H](C)CC#N 255902275 LRVYUZIOTYYHGS-FUYCXPICSA-N 380.513 5.217 30 20 GKED CCC/N=C(/O)c1ccc(N=C(O)N(C)[C@H](C)C2CCCCC2)cc1Cl 330430047 HWOVXJDVVJQZPD-CQSZACIVSA-N 379.932 5.501 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)Nc1ccccc1CCC(F)(F)F 416905798 GTVXXWNLXBHNSH-IBGZPJMESA-N 387.405 5.252 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(C#N)s1 422216585 JNOVBPRKOALSPH-UHFFFAOYSA-N 382.316 5.047 30 20 GKED CC(C)(c1ccc(NC(=O)c2cc(F)c(F)c(F)c2F)cc1)C(F)(F)F 429218159 BZKACVMAQSVCHJ-UHFFFAOYSA-N 379.275 5.335 30 20 GKED CC(C)(c1ccc(NC(=O)c2c(F)c(F)cc(F)c2F)cc1)C(F)(F)F 429225870 IAZKQVLWHAOFQG-UHFFFAOYSA-N 379.275 5.335 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4sccc4[nH]3)c2)cc1 429593744 PFMKQGWATCFIPM-UHFFFAOYSA-N 387.464 5.127 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437482111 NULZDLJFSSBWQC-UHFFFAOYSA-N 399.425 5.461 30 20 GKED CN(Cc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Oc2ccccc2)cc1 438999824 BFQWVUBHZYJVDV-UHFFFAOYSA-N 382.423 5.037 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(OC(F)(F)F)c2)c2ccccc21 443904792 GPTSZFQVROSCMA-UHFFFAOYSA-N 387.361 5.096 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)[C@@]1(C#N)C[C@H]1C 450006904 WKATYPYGGWTOMQ-IQMFZBJNSA-N 390.462 5.220 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 460767015 ICMKOLOLIGLPRR-SFTDATJTSA-N 394.563 5.345 30 20 GKED CC#CCCCC(=O)Nc1c(C)cccc1-c1nc2cc(F)ccc2n1C(C)C 466872725 FQPKABJOWNCXEU-UHFFFAOYSA-N 391.490 5.864 30 20 GKED C[C@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)c(F)c1 468032094 YYXIWBZNKUQELD-DJJJIMSYSA-N 395.478 5.688 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1cc2cccc(F)c2o1 473875086 JUZILPQIZSTBFT-QSFXBCCZSA-N 391.446 5.114 30 20 GKED C[C@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)c(F)c1 480750413 RPRKWNFSKIPMAZ-JEOXALJRSA-N 391.259 5.401 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Cc1csc(Cc2ccc(F)cc2)n1 482911324 MQLFYNPHZDCSMJ-UHFFFAOYSA-N 386.536 5.010 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F 483651075 RLUUCXTYIZHLHZ-RBSFLKMASA-N 399.482 5.571 30 20 GKED CCCCn1ncc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1C(C)C 485191412 FUCGKCZMMZRESK-CTNGQTDRSA-N 393.535 5.110 30 20 GKED N#CCSc1cccc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)c1 485545811 OUXIQODTVDFDAH-BDTNDASRSA-N 376.525 5.101 30 20 GKED C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N[C@@H](CCCC#N)c1ccccc1 487214972 AKIRTKWGYPWJGC-YJBOKZPZSA-N 390.405 5.024 30 20 GKED CC(C)(C)Oc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)nc1 496408412 VVZLEVIQBMNGSL-ZDUSSCGKSA-N 385.876 5.012 30 20 GKED CC[C@H](Nc1ccccc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 498251849 FFCZKCMLZWQTTR-QHCPKHFHSA-N 399.494 5.275 30 20 GKED C=CCc1cc(CNCc2ccc(Oc3ccccc3)cc2)cc(OC)c1O 500154142 ZWTZFVUBPZQQRY-UHFFFAOYSA-N 375.468 5.211 30 20 GKED Cc1cc(C)n([C@@H](C)CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 500751239 CLMXFKKZKOOXLF-SFHVURJKSA-N 388.471 5.062 30 20 GKED CSc1ccccc1[C@@H](C)NCC(=O)Nc1ccccc1S[C@H](C)CC#N 501488405 CJOYZIJKEAJIKD-HZPDHXFCSA-N 399.585 5.092 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)Nc2ccc(C#N)c(Cl)c2)s1 502704113 XACRLFLLCOYAPJ-UHFFFAOYSA-N 385.876 5.409 30 20 GKED CCOc1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)cc1 503967775 WAAKSBTTXMTXMM-UHFFFAOYSA-N 388.492 5.038 30 20 GKED C=CCCc1ccccc1NC(=O)CCC(=O)c1cc(Cl)sc1Cl 504284515 QMOKHYMQYAYEBF-UHFFFAOYSA-N 382.312 5.775 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 505022116 AKWYQCZOUJIHHE-RBBKRZOGSA-N 382.479 5.328 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccc(Cl)cc1 505818577 BQADXUTYXDDHSV-SFHVURJKSA-N 398.249 5.175 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](C)C1CCCCC1 508927241 LUZXPHOMCDJORD-MRXNPFEDSA-N 377.488 5.599 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1cc(F)ccc1F 510188721 DEXGZHVNOAFLAO-CYBMUJFWSA-N 395.434 5.018 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)s1 512561789 YJBNNGQXPBTOMY-CHWSQXEVSA-N 393.965 6.069 30 20 GKED C[C@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1F 517518868 XJRITBKOVKGBLH-ZDUSSCGKSA-N 376.456 5.267 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCn1ccc2ccccc21 518168481 IDUXBIYNROPIHS-QGZVFWFLSA-N 392.528 5.105 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2ccc(F)c(F)c2)cc1 518176407 NNYGDOLRSWTZCB-UHFFFAOYSA-N 394.446 5.059 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)c1 518372932 GHLJEJYXIMBLGQ-SJORKVTESA-N 389.282 5.418 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](C)c2oc3ccc(OC)cc3c2C)c1 518580376 UZSVXEBZBWTBRZ-HNNXBMFYSA-N 380.444 5.197 30 20 GKED COc1cccc([C@@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)c1 525174576 LFDHBCIDPOBRJC-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc(C#N)c(Cl)c1 535119527 AZRKMBCQZPMLCJ-UHFFFAOYSA-N 398.821 5.189 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccn(-c2ccc(Cl)cc2)n1 535294053 SAXFHNKOTVOIRZ-AWEZNQCLSA-N 396.903 5.030 30 20 GKED C[C@@H](NCC(=O)Nc1sccc1C#N)c1ccccc1-c1ccc(Cl)cc1 537114763 GYMSCSWLGQZHLO-CQSZACIVSA-N 395.915 5.229 30 20 GKED C=CCC[C@@H](CC)Nc1ccc(NC(=O)[C@@H](C)n2nc(C)cc2C)c(Cl)c1 538634553 IONDCMKAUJLDTR-IAGOWNOFSA-N 388.943 5.510 30 20 GKED C=CCC[C@@H](NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccccc1 541464142 OCHZGCPWKWGBRH-FYYLOGMGSA-N 391.559 5.317 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N[C@@H](C)c1ccc(C#N)cc1 542934157 HFHATGDEGPMHIW-LBPRGKRZSA-N 399.372 5.032 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cn1 548903486 NKQDCBZHIGPBNI-INIZCTEOSA-N 389.480 5.378 30 20 GKED C[C@@H](Nc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccccc1 549712899 IHXCBHBKLIYNBQ-GOSISDBHSA-N 381.479 5.667 30 20 GKED CSc1cc(Br)ccc1CN[C@H](CCCC#N)c1ccccc1 552311956 JTUQJGYYJHHDTE-GOSISDBHSA-N 389.362 5.696 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1ccc(C#N)c(F)c1 582055545 SCRQZXLWLFSFBM-ZDUSSCGKSA-N 380.448 5.012 30 20 GKED N#CCCCCCC(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 588157302 CKNLGQDOTIKOHX-JOCHJYFZSA-N 389.499 5.076 30 20 GKED N#C[C@]1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)CC12CCCC2 590978092 MRCRCOVXBJPPDI-QFIPXVFZSA-N 393.874 5.005 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N1CCC(CCC#N)CC1 591965886 UKTYEBFSORMKPW-FQEVSTJZSA-N 381.545 5.066 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@H]1OCc2cc(Cl)ccc21 593975626 POJFVGIPZMUALF-FZKQIMNGSA-N 386.904 5.192 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 608847762 CZYPOYXWYQMQJF-UHFFFAOYSA-N 391.496 5.286 30 20 GKED C[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)c1c(Cl)cccc1Cl 609170557 PWXQVOMCMRENJX-ZDUSSCGKSA-N 386.282 5.005 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 609469630 VYSYWGYQJSIFAE-UHFFFAOYSA-N 387.430 5.158 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cccc(F)c1 609693873 HFUDTLNJXSWJCP-OAHLLOKOSA-N 375.403 5.017 30 20 GKED C[C@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1ccccc1C(F)(F)F 610197553 NYKQMEQLZYIWOL-CQSZACIVSA-N 378.369 5.285 30 20 GKED C[C@H](NC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1cccc(C#N)c1 610357575 PCZOICZKGBFIDR-SFHVURJKSA-N 381.479 5.271 30 20 GKED C[C@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1cccc(C#N)c1 610829733 HCSRIVHZTVKGDB-RBUKOAKNSA-N 396.494 5.197 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)NCc1ccc(C#N)c(Cl)c1 619770582 BOSKIVAKYCNIME-QGZVFWFLSA-N 395.812 5.013 30 20 GKED C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622879341 MDKIQXHUCXTETH-CABZTGNLSA-N 389.286 5.144 30 20 GKED C=CCn1c(SCc2nnc(CC)s2)nnc1-c1ccc(C(C)(C)C)cc1 680015795 FMAJYUVKDPSZFU-UHFFFAOYSA-N 399.589 5.135 30 20 GKED N#CCOc1ccc(CNC(=O)Nc2cccc(CCCc3ccccc3)c2)cc1 727936971 YBCFCENKXKQGOQ-UHFFFAOYSA-N 399.494 5.086 30 20 GKED CCCOc1nc2ccccc2cc1/C=C\C(=O)[C@@H](C#N)c1nc2ccccc2o1 731768039 YIHXXRKQSRGRIW-YUIUBULTSA-N 397.434 5.054 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 732496389 UCYAIXRQYOOZPF-GDBMZVCRSA-N 386.929 5.697 30 20 GKED Cc1cccc(O[C@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 743093050 KVYRDPXMFXRTQM-DVECYGJZSA-N 399.494 5.240 30 20 GKED C[C@@H]1CCC[C@H](CC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)C1 750667765 KUWAXBTWQCXFNT-WSTZPKSXSA-N 390.483 5.343 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc4ccccc4n3)n2)cc1 752165814 ZIKMTADDJHBUMK-GHYICZDASA-N 395.487 5.556 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccc(F)cc2)CC1 752677379 KQHSZTQCOMTADA-INIZCTEOSA-N 397.519 5.631 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(Cl)c(Cl)c1Cl 753133237 AVBVIMLOSAKRDL-RJRFIUFISA-N 395.698 6.061 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(F)(F)c2ccccc2F)cc1 765622381 AYMBXVOQIBGTEM-SFHVURJKSA-N 380.369 5.212 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(SC(F)F)cc2)S1 781546059 ANRHGGAUQIYUJA-GDNBJRDFSA-N 390.480 5.510 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1nc2ccccc2s1 789451203 VJKSFNHXPZGHKV-HNNXBMFYSA-N 379.529 6.031 30 20 GKED N#Cc1ccc(CN[C@@H](c2sccc2Br)C2CCCCC2)nc1 793558321 ROWLPSHYDQBWAD-QGZVFWFLSA-N 390.350 5.188 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(OC(F)(F)F)cc2)c1 796817017 OHGIQWZSEILLIX-FXAWDEMLSA-N 392.421 5.507 30 20 GKED CCc1cccc(C)c1NN=C(C)c1ccc(CNC(=O)OC(C)(C)C)nc1C 799493649 KIWBJCJESSYNQM-UHFFFAOYSA-N 396.535 5.122 30 20 GKED C#C[C@@H](NC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccc(Cl)cc1F 806373992 OJPMQSSLKDWBRV-YVEFUNNKSA-N 388.874 5.020 30 20 GKED O=C1/C(=C/c2cc(Cl)cc(C(F)(F)F)c2)C[C@H](C(=O)O)c2ccccc21 806560422 LPGFCWWTDLOYLL-WQRDJFRPSA-N 380.749 5.197 30 20 GKED C#C[C@@H](NC(=O)N(C)[C@H](C)c1nc2ccccc2s1)c1ccc(Cl)cc1 811959346 NOKKDYOZTFVPNI-CZUORRHYSA-N 383.904 5.027 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1sc(Cc2ccccc2)nc1C 814690028 QSSVDFBVZHELOE-UHFFFAOYSA-N 399.903 5.230 30 20 GKED FC(F)(F)c1cc(NN=C2CC[C@@H](c3ccccc3)C2)nc(-c2cccnc2)n1 814850189 CITPFJRQJKCNIO-OAHLLOKOSA-N 397.404 5.293 30 20 GKED CCCCCCCC[C@@H](C)C(=O)NC1CCN(C(=O)Nc2ccccc2)CC1 820200232 CXHHNABFTHBONT-LJQANCHMSA-N 387.568 5.186 30 20 GKED Cc1ccccc1-c1ccccc1CNc1ccc(N2CCC(O)CC2)c(C#N)c1 823518157 NJJAFELGXWKYRT-UHFFFAOYSA-N 397.522 5.107 30 20 GKED Clc1nc(Oc2ccccc2)sc1C=NNc1nccc2sccc12 915978295 CJYZOQGWLQBBHN-UHFFFAOYSA-N 386.889 5.645 30 20 GKED COc1ccc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)cc1O 916133939 VEGOSUIQRADQRR-GHRIWEEISA-N 387.460 5.434 30 20 GKED Cc1ccc(C(Cc2ccccc2)=NNc2ccc(F)c(C(=O)O)c2)cc1C 1776062043 BBLACQROPQQVEU-UHFFFAOYSA-N 376.431 5.200 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C)cc3)s2)cc1CC(=O)O 1776131747 DEPMHKQUORDKPY-NTMALXAHSA-N 392.476 5.255 30 20 GKED Cc1cc(C)c(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1C 1776132893 IQGAYSJNYDELLD-XFXZXTDPSA-N 384.475 5.802 30 20 GKED CCCCCCCCc1ccc(C(=O)NCc2cc(C(=O)O)sc2C)cc1 1776785823 FPQQEOKXUFOYIK-UHFFFAOYSA-N 387.545 5.588 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@H](C)CC[C@H]2C(=O)O)cc1 1776787553 WMIDFFPORGVXNA-APWZRJJASA-N 377.550 5.074 30 20 GKED CCc1oc2ccccc2c1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776999124 AWUYYCVLIVJPKF-VAWYXSNFSA-N 386.403 5.850 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1F 1777403202 OWDBMHFZYBSPMM-CLFYSBASSA-N 382.412 5.402 30 20 GKED C=CCN(C(=O)c1ccc(Oc2cccnc2)cc1)c1nc2c(s1)CCCC2 63266416 RZMZCPFXQSIIBF-UHFFFAOYSA-N 391.496 5.042 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 65438755 RTPFODIFPKEGEG-UHFFFAOYSA-N 379.357 5.160 30 20 GKED N#Cc1cccc(NC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)c1 65529379 KZBCNKLGCGCDLH-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#C[C@H](C(=O)CC1CCOCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 117532569 SRXWWEPFPMHPML-CQSZACIVSA-N 395.311 5.110 30 20 GKED C=CCN(Cc1ccccc1)C(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1 118982177 WDQJEYVRIMSOEY-UHFFFAOYSA-N 395.890 5.201 30 20 GKED Cc1cc(C)c(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)c1 134184777 UMSBZZZBZSTUKN-HXUWFJFHSA-N 385.492 5.026 30 20 GKED N#CCCCOc1cccc(CNc2cccc(CSC3CCOCC3)c2)c1 151026614 KHLQVHYFBIYUAO-UHFFFAOYSA-N 396.556 5.393 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1nc(C)cs1 153002925 WJVSBJSVQMKRCM-UHFFFAOYSA-N 397.887 5.436 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](c3ccccc3)C3CC3)n2)cc1 162080995 YMAHARLELYOHMU-FPOVZHCZSA-N 388.492 5.189 30 20 GKED COc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 173123761 NBFUQCRIWYRNQS-DLBZAZTESA-N 397.544 5.184 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(OCC#N)cc3)s2)cc1 180551427 PBUHZQBCBAPYOG-INIZCTEOSA-N 377.513 5.180 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2oc3ccccc3c2C)ccc1OC 180813607 XZIGNQUQJFUWFN-SJLPKXTDSA-N 378.472 5.282 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 185481818 SYGMZPADSQTZJV-UGSOOPFHSA-N 393.503 5.312 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccccc1 187027116 GPDXYJFDOLHRAT-QGZVFWFLSA-N 394.858 5.484 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)c1nccs1 191464765 JMTSOMDZUQWMBG-NRFANRHFSA-N 391.540 5.906 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C(C)(C)C)cc1)=C(\S)N[C@@H](C)CC 194973123 BPGIQEKQNUFPHK-KRWDZBQOSA-O 397.608 5.161 30 20 GKED C=CCn1c(SCCOCC(F)(F)F)nnc1-c1ccc(C(C)(C)C)cc1 195654869 PMJZQINLZAIEGP-UHFFFAOYSA-N 399.482 5.100 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1F 216103135 XCMMYZUKVJCJPB-ZDUSSCGKSA-N 384.436 5.032 30 20 GKED COc1ccc(CN[C@H](C)c2cc3ccccc3s2)cc1OCCCC#N 237341594 UEFAZHVQYWOSPR-MRXNPFEDSA-N 380.513 5.443 30 20 GKED O/C(=N/[C@@H]1CCOC2(CCCCC2)C1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329414920 CTRGKDGHHYWCTF-WOJBJXKFSA-N 399.579 5.332 30 20 GKED OC(=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)[C@@H]1C[C@]12CCOC2 329633858 WUUFKMHJSCYHAK-FPTDNZKUSA-N 393.512 5.185 30 20 GKED CC(C)C[C@@H]1C[C@H](/N=C(/O)Nc2cccc(Cl)c2Br)CCO1 331166109 YDGMTYGITAGHQJ-VXGBXAGGSA-N 389.721 5.022 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@@H](C)CC3)s1 410990423 WMMVSSHPTIPXRP-QJPTWQEYSA-N 389.546 5.112 30 20 GKED Cc1c(-c2nc(-c3cccc(C(F)(F)F)n3)no2)sc2ccc(C#N)cc12 426413908 ZCUFQRMRHRTFHU-UHFFFAOYSA-N 386.358 5.212 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 429073699 CVRAYSBZLYCPLL-UHFFFAOYSA-N 380.926 5.024 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)s1 430595386 XPDSUEWUEREBPD-OAHLLOKOSA-N 395.553 5.671 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430610694 LJSPVOCFANCUHG-KRWDZBQOSA-N 375.497 5.301 30 20 GKED CC[C@@H](CC#N)NC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 432319458 GHPUWTDITAJFIR-NSHDSACASA-N 380.275 5.194 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432631996 LFNAONVAEABHCH-QFIPXVFZSA-N 376.504 5.152 30 20 GKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)nc(-c2ccc(Cl)cc2)n1 433022254 JMOPTMUMSDOBPQ-JOCHJYFZSA-N 390.918 5.630 30 20 GKED C=CCn1c(SCc2nc(-c3ccccc3)cs2)nnc1-c1ccoc1C 435687208 ZWKWKWCEHQJGPY-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC[C@@H](C#N)Sc1nnc(-c2cc(-c3ccc(C)cc3)nc3ccccc23)o1 436050364 JZYCGGDXFANWFJ-INIZCTEOSA-N 386.480 5.655 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1 436207746 IPPJNYXOAFHWOU-UHFFFAOYSA-N 398.507 5.538 30 20 GKED Fc1cc(F)cc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436400351 NNUWVFUXXKGDDI-HNNXBMFYSA-N 383.282 5.767 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CC[C@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 437793911 BZSMZMZYYBNFDH-ORAYPTAESA-N 387.405 5.501 30 20 GKED N#Cc1ccc(CSc2nnc(-c3cccc4ccccc34)o2)c(Cl)c1 438890447 OBZJOKPOXAZLPW-UHFFFAOYSA-N 377.856 5.707 30 20 GKED CN(Cc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Oc2ccccc2)cc1 438998011 HWPLBUCZPDMOLY-UHFFFAOYSA-N 382.423 5.037 30 20 GKED O=C(Nc1ccc(F)cn1)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444938118 VSOPJYDWVQBAKD-LBPRGKRZSA-N 395.278 5.055 30 20 GKED C[C@@H](NC(=O)N1CCCc2occc2C1)c1ccc(-c2cccc(C#N)c2)cc1 460884488 PKXYNQQASJNUGD-QGZVFWFLSA-N 385.467 5.037 30 20 GKED C[C@H](C(=O)N1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462249985 XEBLJLAPZLLROY-SIFCLUCFSA-N 386.417 5.290 30 20 GKED Cc1oc2ccccc2c1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 467333248 BREBLBPYUSKEKS-CQSZACIVSA-N 379.485 5.457 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2ccc(F)c(C#N)c2)c1)c1ccccc1 467767659 JKXGATLIDIQRNI-UHFFFAOYSA-N 393.849 5.239 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)CCc1ncc(-c2ccccc2F)o1 470648300 JDFMSWDWFADFQV-UHFFFAOYSA-N 378.447 5.018 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)SCCCOc1cccc(C#N)c1 477346197 DPCYASVXFVNKPI-KRWDZBQOSA-N 396.556 5.212 30 20 GKED C=C(C)[C@@H](NC(=O)NCc1ccc(-c2ccncc2)cc1)c1ccc(F)c(F)c1 483085526 FWHMQBJQQYSVBV-JOCHJYFZSA-N 393.437 5.143 30 20 GKED CCN(C(=O)c1sc(-c2ccccc2C)nc1C)c1ccc(C#N)c(Cl)c1 484121695 ZFCHRABHCYEQAM-UHFFFAOYSA-N 395.915 5.619 30 20 GKED C=CCN(C(=O)CCc1ccccc1OCC)c1nc(-c2ccccc2)cs1 498728115 JJHLSZCJFKCHQP-UHFFFAOYSA-N 392.524 5.361 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)c(C)n2)c(C(F)(F)F)c1 499561528 NNMRIAJDZFDXRJ-NSHDSACASA-N 393.434 5.423 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1ccc(OCc2ccc(F)cc2)cc1 499601957 HJVGVBFNQNTPHH-IBGZPJMESA-N 396.506 5.156 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(C)c(OCc3cccnc3)c(C)c2)c1 501153483 BXAHNCWVAKDKQJ-UHFFFAOYSA-N 388.467 5.095 30 20 GKED C=CCN(C(=O)c1cc(C)c(OC(F)F)c(C)c1)c1nc2c(s1)CCCC2 503146488 CXKIVNVXCOMHCV-UHFFFAOYSA-N 392.471 5.073 30 20 GKED CC1(C#N)CCN(C(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC1 507842829 ZPWITXHYTHPIBF-UHFFFAOYSA-N 384.564 5.072 30 20 GKED CCN(Cc1cn(C)nc1-c1ccccc1Cl)[C@@H](C)c1ccc(C#N)cc1 508602396 DDDAXBSJQVQOGT-INIZCTEOSA-N 378.907 5.195 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCc1ccc(-c2ccccc2)[nH]1 512228393 NVGMDULHYPLWLW-UHFFFAOYSA-N 395.462 5.312 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1 512531582 HJQFAPDNEZGBMA-KRWDZBQOSA-N 397.498 5.101 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2)c1 513655666 SWUKKIYGNRBLQJ-FQEVSTJZSA-N 398.487 5.674 30 20 GKED Cc1nn(-c2ccccc2Cl)c2sc(C(=O)NC3(C#N)CCCCC3)cc12 514244646 LNPBSMCLTBHMQN-UHFFFAOYSA-N 398.919 5.005 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cc(C(F)F)ccc3Cl)cc2)nc1 514888289 UCCROUHUMCDVDI-UHFFFAOYSA-N 399.784 5.589 30 20 GKED C[C@H](c1ccccc1)n1c(SCc2cccc(C#N)c2)nnc1-c1ccccc1 515487616 LZHNABHLYHFSIF-GOSISDBHSA-N 396.519 5.718 30 20 GKED N#Cc1ccc(NC2CC2)c(NC(=O)c2ccc(C(F)(F)F)cc2Cl)c1 517106420 ZBOYTRXUCLFAEB-UHFFFAOYSA-N 379.769 5.057 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 517530514 VBSVYLKFQPANEU-UHFFFAOYSA-N 389.430 5.196 30 20 GKED COc1ccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 518683390 UIOUKZMQWLDXAW-MRXNPFEDSA-N 397.544 5.046 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1c(C(C)C)cccc1C(C)C 520170817 QCFMUHRCFSEFIL-UHFFFAOYSA-N 391.559 6.495 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1CCC(c2ccccc2)CC1 520195859 ONQJYHVTEUYPIE-QHGAOEGBSA-N 393.556 5.929 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1N1CCCCCC1 520480700 UEATZQTWTQHOPM-UHFFFAOYSA-N 390.531 5.381 30 20 GKED N#CC1(NC(=O)c2cccc(CSc3cc(Cl)cc(Cl)c3)c2)CCC1 525583093 IHQKQJKPFKVDRO-UHFFFAOYSA-N 391.323 5.462 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(-n2nc(C)cc2C)cc1 530560274 CBRAIRAPFRCVMQ-UHFFFAOYSA-N 387.527 5.522 30 20 GKED C=CC[C@H](C)[C@@H](C)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 532238999 KXTWQFDIRQLDPO-MRUHUIDDSA-N 391.964 5.023 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 534597375 SWMWMGCEGTVFQS-MRXNPFEDSA-N 388.842 5.632 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCn1ccc2cc(Cl)ccc21 534678015 FTZWVXHETFRQHL-OAHLLOKOSA-N 397.931 5.575 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 536939866 JWKIRERNUFFBGJ-INIZCTEOSA-N 386.455 5.191 30 20 GKED Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 540363006 RCDWRVZVLBULKJ-HXOBKFHXSA-N 395.572 5.172 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1ccc(F)c(C#N)c1)C1CC1 551521241 YBYQCHSJJGSPMF-GFCCVEGCSA-N 376.353 5.082 30 20 GKED Cc1cc(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)cc(C#N)n1 553413219 ZOPGGTNNMANZMN-UHFFFAOYSA-N 384.361 5.080 30 20 GKED N#CCc1ccc(C(=O)N2c3ccc(Br)cc3[C@@H]3CCCC[C@@H]32)cc1 561024478 WJPBMZMHIOIPGZ-HKUYNNGSSA-N 395.300 5.202 30 20 GKED Cc1nc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)sc1C(F)(F)F 562291868 DUJUPUJLGBZJGP-UHFFFAOYSA-N 390.255 5.020 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 584120987 XDPQOERICWUEAK-OAHLLOKOSA-N 394.540 5.470 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc2c1ccn2C(F)F 596981658 PIYKXTNJYMVZGX-YLJYHZDGSA-N 394.425 5.340 30 20 GKED C=CC1CCN(C(=O)c2cc(-c3ccc(C)s3)nc3c2cnn3C(C)C)CC1 599680748 GBSSECBQXZQBPA-UHFFFAOYSA-N 394.544 5.087 30 20 GKED N#Cc1ccc(OCCSCc2cccc(C(=O)Nc3ccccc3)c2)cc1 604069434 IVBBCSQXALFMHI-UHFFFAOYSA-N 388.492 5.123 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccc(F)cc1 604112887 NZPHUSCUHNYRHW-HNNXBMFYSA-N 375.403 5.017 30 20 GKED CC(C)(NCc1cccc(OCCCC#N)c1)c1ccc(Br)cc1 608860959 AWUDMQKFCMOSHW-UHFFFAOYSA-N 387.321 5.157 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609641307 JZSVAGNFDTZRAJ-QGZVFWFLSA-N 388.442 5.110 30 20 GKED CSc1cccc(N(C)C(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1 609643826 TUJJDFJJGHBGMC-UHFFFAOYSA-N 388.492 5.136 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1ccnc2ccccc12 609906771 PMZUGGHCHIMDLJ-UHFFFAOYSA-N 383.476 5.406 30 20 GKED C[C@@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1cccc(C#N)c1 610359628 NJAQJXTXCBIYKZ-CQSZACIVSA-N 397.906 5.077 30 20 GKED CCn1c(NC(=O)c2sc3cc(F)ccc3c2Cl)nc2cc(C#N)ccc21 611211687 GMWZSVQBQRSHFF-UHFFFAOYSA-N 398.850 5.187 30 20 GKED C=CCC(C)(C)CNCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 639206131 GDHDVOWVWUEGSN-UHFFFAOYSA-N 377.941 5.173 30 20 GKED C=CCCC(C)(C)NCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 639334901 KFDWGWCKRSSMAE-UHFFFAOYSA-N 377.941 5.316 30 20 GKED C[C@H](NCc1ccc(CN)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 650752996 DOERZQBFIFMCPO-JTQLQIEISA-N 394.334 5.173 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726489813 RBZXVWSZPZVBQV-UHFFFAOYSA-N 391.927 5.707 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1 727761842 DWWJIAGHDYPGGW-XMMPIXPASA-N 387.479 5.170 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420168 AOHDXOFPPQWRBL-QMTHXVAHSA-N 390.892 5.446 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)CC(c2ccccc2)c2ccccc2)c1 733773294 YHDFHCSKBSDOAJ-QHCPKHFHSA-N 398.506 5.206 30 20 GKED CCCn1ccc2cc(NC(=O)NCc3cccc(O[C@@H](C#N)CC)c3)ccc21 733845185 OQYVJOXKFXQKRH-HXUWFJFHSA-N 390.487 5.054 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCc3cccc(OC4CCCC4)c3)[nH]c12 735790883 ROBNQWAZGVHFHE-HXUWFJFHSA-N 387.483 5.002 30 20 GKED CSc1ccc(C)c(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 739751491 MCMPCFKQZFXDFT-UHFFFAOYSA-N 378.522 5.247 30 20 GKED Oc1nc2ccccc2cc1C=Nc1ccc(OCc2ccccn2)c(Cl)c1 743539156 VCEFAWMRZUSKST-UHFFFAOYSA-N 389.842 5.318 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)O[C@@H](C)c2ccc(C#N)cc2)cc1 748679446 GHVHRWMDBKOXID-HNNXBMFYSA-N 376.481 5.146 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3nc(Cl)ccc3Cl)cc2)cc1 748687749 GDJVZYBYAFVZLA-UHFFFAOYSA-N 385.206 5.272 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)c2ccc(Cl)s2)cc1 750686655 ILQOKLVGSOJSFP-HEHGZKQESA-N 388.920 5.366 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1OC(F)F 753390111 JPTLMWQORWVSQR-IEZBTEQYSA-N 384.407 5.177 30 20 GKED COc1ccc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)cc1NC(C)=O 753717150 IIADUBVHOITRPT-CLTKARDFSA-N 397.780 5.222 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Br)cc(Cl)c1O 756770410 VQBCHYQMRRHUJB-SJCJKPOMSA-N 393.712 5.504 30 20 GKED C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 760180589 FCBKWBGXPRWUEB-IUODEOHRSA-N 382.872 5.035 30 20 GKED C[C@H](OC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1cccc(C#N)c1 764614804 SRJGTWVFZKDUDT-INIZCTEOSA-N 379.419 5.086 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)c4ccc(CC#N)cc4)cc3C2)cc1 771804146 FRFXTFOYAOXIHM-UHFFFAOYSA-N 395.506 5.649 30 20 GKED C=CCc1cc(CN[C@H](C)c2sc(C(C)(C)C)nc2C)cc(OC)c1OC 772944899 DLCIYMPUVWFJOW-CQSZACIVSA-N 388.577 5.346 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc3[nH]ccc3c2)cc1 775657536 CSMREELRYCZXAS-HSZRJFAPSA-N 379.463 5.395 30 20 GKED N#C[C@H](C(=O)CCCc1ccc2ccccc2c1)C(=O)Nc1ccccc1Cl 776076288 DYLASSIQODWTGJ-LJQANCHMSA-N 390.870 5.163 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2c(-c3ccccc3)oc(C)c2C)c1 780707689 YSKIGCHKQFLNRB-FQEVSTJZSA-N 388.467 5.174 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 783074533 ILCPINPINSIRSR-TZMCWYRMSA-N 390.455 5.050 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)C1CCOCC1 789457492 UGDMWSWCMWEOBL-QHCPKHFHSA-N 392.543 5.828 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@H](C#N)c2nccc3ccccc23)s1 792095020 SGBOYRSVSXHXLH-INIZCTEOSA-N 389.505 5.147 30 20 GKED C[C@H](OC(=O)Cc1ccc(F)cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 795895173 VEANIAXQFIGEJF-VIFPVBQESA-N 395.274 5.105 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccs2)CCCCC1)c1cc(C(F)(F)F)ccn1 813213364 LBSQCNGNHIXPLH-MRXNPFEDSA-N 392.446 5.531 30 20 GKED O=C(Nc1ccc(C/N=C\c2cc(Cl)cc(Cl)c2O)cc1)c1ccco1 818212820 CGMKCYBZBLFLRN-JJFYIABZSA-N 389.238 5.163 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(-c3ccc(F)cn3)no2)cc1Cl 904937329 WLRPLYKMEQEVJY-UHFFFAOYSA-N 392.777 5.255 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc4ccccc34)n2)cc1 916627300 LSDKMWOKGSKYST-NRFANRHFSA-N 382.488 5.691 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c(C)s1 916904783 IRLCAMUMQFNMJC-GOSISDBHSA-N 390.464 5.118 30 20 GKED N#Cc1c(NC(=O)c2cnc(Cl)c(Cl)c2)sc2c1CCCCCC2 917784044 SZCORIXGLIPXFG-UHFFFAOYSA-N 380.300 5.233 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@H](C)Sc1ccccc1Cl 920104717 XNLDPWREVVSLMK-ZFWWWQNUSA-N 396.899 5.202 30 20 GKED Cc1ccc2c(c1)C/C(=C\c1cn(Cc3ccccc3)nc1-c1cccnc1)C2=O 921264773 ZAMIARGFCUBCLB-HYARGMPZSA-N 391.474 5.124 30 20 GKED N#Cc1ccc(CN(CCC2(C#N)CCCCC2)c2ccc3nc(O)[nH]c3c2)cc1 1307546512 POBIJQKZRIJHHJ-UHFFFAOYSA-N 399.498 5.011 30 20 GKED CC(=NNc1nc2ccccc2cc1C)c1sc2ccccc2c1C(=O)O 1776052756 OXWBVFHKTFVZJM-UHFFFAOYSA-N 375.453 5.292 30 20 GKED Cc1c(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)cccc1C(=O)O 1776088071 NUIHOXWBIOMYRI-INIZCTEOSA-N 376.378 5.448 30 20 GKED CCC(=NNc1ccc(F)cc1Cl)c1ccc(OCCCCC(=O)O)cc1 1776106385 CMYHQRQKOIPPDS-UHFFFAOYSA-N 392.858 5.339 30 20 GKED CC(CCc1ccc(OCC(=O)O)cc1)=Nn1c2ccccc2c2ccccc21 1776113140 YVPANGMANMLFEG-UHFFFAOYSA-N 386.451 5.115 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)cc1 1776125657 PAWOPMSRHFKBFI-QXSWTLKVSA-N 398.474 6.015 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1ccc2ccccc2c1 1776131506 SPHAALSKGINZQC-KPKJPENVSA-N 398.414 5.606 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccccc1Oc1ccc(Cl)c(Cl)c1 1776148935 RKOSKNKMKFZISE-CQSZACIVSA-N 380.271 5.295 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1csc(-c2ccc(Cl)cc2)n1 1776784464 QLPZEPMMSBXMDN-QGZVFWFLSA-N 394.968 5.757 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1OC 1777353263 ISTPHRJGHGUFHV-CSKARUKUSA-N 394.448 5.027 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)Cc3ccc(C(C)C)cc3)cc2)CCC1 1791394554 JURQMXUQVWFRRN-UHFFFAOYSA-N 390.527 5.063 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(Cl)c(N)c(Cl)c1 27995106 CGYCAGHPFRAOJX-UHFFFAOYSA-N 382.250 5.367 30 20 GKED COc1ccc(C#N)cc1NC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1 64456090 LHHLMVRFVYWMKF-UHFFFAOYSA-N 388.389 5.036 30 20 GKED N#Cc1ccccc1CN[C@@H](c1ccccc1)c1ccc(Br)cc1 65277441 HEUGKEBRLDXGAF-NRFANRHFSA-N 377.285 5.200 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 65680165 VRAMVBGOQKXBFG-UHFFFAOYSA-N 384.435 5.261 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c1 65749429 QBNNVXJULIKTMH-UHFFFAOYSA-N 396.446 5.826 30 20 GKED COc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66954011 YYFPQXKECCABIB-JXFKEZNVSA-N 395.528 5.458 30 20 GKED C[C@@H](CC#N)N(C)C(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 103441743 SVUWLNXDCYUWBT-KRWDZBQOSA-N 387.439 5.040 30 20 GKED N#C[C@@H](C(=O)CC1CCOCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 117532566 SRXWWEPFPMHPML-AWEZNQCLSA-N 395.311 5.110 30 20 GKED Cc1cc2cc(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)oc2cc1C 122862415 QYZOVRCENRQHOO-LJQANCHMSA-N 382.419 5.164 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(Cl)c(F)c1 123095955 PWAAHFTWJWLESV-UHFFFAOYSA-N 381.794 5.099 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1nc(C)cs1 173123974 LYTVSZDHEVGUGV-IFXJQAMLSA-N 388.562 5.293 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(C)[C@@H](c1ccncc1)c1ccc(Cl)cc1 175290869 BOJWXJZLFKNOSG-OAQYLSRUSA-N 390.874 5.168 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)c1 175656754 UTXNWCQLMZAZAL-UHFFFAOYSA-N 393.899 5.198 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)cc1C(F)(F)F 185731599 IIOALSHXLRDADP-NSHDSACASA-N 398.837 5.863 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccccc1 188065097 PJJWZLMOTHSGRU-HSZRJFAPSA-N 378.516 5.132 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1 214016906 BFWYINIVHZXWBM-YVMONPNESA-N 399.493 5.011 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 218972557 JXTZTMLWJOPXEW-UHFFFAOYSA-N 393.537 5.358 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 246693389 ISFGIVSLIGMGJC-JXXFODFXSA-N 397.519 5.692 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1cccc(-c2ccncc2)c1 255626902 KBXSMWFGHMLDMN-TWGQIWQCSA-N 379.419 5.227 30 20 GKED COc1cc([C@H](C)Nc2ccc(C#N)c(Cl)c2)ccc1OCc1ccncc1 301245672 NXNDRPNNPRDEAH-HNNXBMFYSA-N 393.874 5.367 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1 303727750 TYMXIJYPUPDBHW-GOSISDBHSA-N 385.467 5.362 30 20 GKED Cc1cc(N=C(O)C2CCC(/N=C(/O)CC3CCCC3)CC2)cc2n[nH]cc12 329055656 MCLLQBIKPBAURY-UHFFFAOYSA-N 382.508 5.555 30 20 GKED C[C@H](NCc1cc2ccccc2nc1O)c1ccc(-c2cccc(C#N)c2)cc1 374694622 PNKQERXEHLIZSQ-KRWDZBQOSA-N 379.463 5.330 30 20 GKED C[C@H](NCc1cnc([C@@H]2CCCO2)s1)c1ccc(-c2cccc(C#N)c2)cc1 374696865 ZAPDKCHSMMGKOZ-AOMKIAJQSA-N 389.524 5.384 30 20 GKED C[C@H](C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 409746280 AANMMLGSMALIKW-BEVDRBHNSA-N 386.417 5.107 30 20 GKED C=CCn1cc(CN[C@@H](C)c2ccc(-c3ccc(C(F)(F)F)cc3)s2)nn1 424292812 HMSHVMQBJSAMGM-ZDUSSCGKSA-N 392.450 5.062 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(C#N)cc1Cl 430353127 BNSFLGLRVGFSDO-UHFFFAOYSA-N 380.753 5.048 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 432059918 BYSQYTCVOLLQRJ-UHFFFAOYSA-N 375.478 5.073 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(F)(c2ccccc2)CC1 432866684 PBEVIFLRIWLPGO-QGZVFWFLSA-N 397.519 5.574 30 20 GKED CC(C)(c1ccc(C(=O)Nc2sc3c(c2C#N)CCC3)cc1)C(F)(F)F 433593497 XORXZLRTUFHKNR-UHFFFAOYSA-N 378.419 5.201 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433671060 UIMQEVYSTZPKGR-UHFFFAOYSA-N 381.263 5.006 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cncc3ccccc23)cc1F 437489441 HKYCPVFTRWYQQB-UHFFFAOYSA-N 383.382 5.290 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438069575 CIIQRAYEWBYLPJ-KOSHJBKYSA-N 399.469 5.236 30 20 GKED FC(F)C(F)(F)COCc1cccc(N[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 438109577 OVGIJAWCHHRMAK-OCCSQVGLSA-N 387.339 5.637 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438839518 FWSIGKJKVLOGFL-DNVCBOLYSA-N 389.421 5.453 30 20 GKED C=CCC[C@H](NC(=O)CSCc1cccnc1)c1ccc(C(F)(F)F)cc1 441547630 QNAMNDFYXZNKDU-SFHVURJKSA-N 394.462 5.157 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2-c2ccccc2)c2ccccc21 443923698 IYQHKYAZYRXFDC-UHFFFAOYSA-N 379.463 5.864 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(Cl)ccc1C(F)(F)F)c1ccccc1 455408742 KHAKKJYFPXOZPP-MRXNPFEDSA-N 395.812 5.915 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccco1)Cc1ccco1)c1ccccc1 458805876 VOQYNGVTCKJENF-OAQYLSRUSA-N 377.444 5.020 30 20 GKED Cc1cc(F)cc([C@]2(F)CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c1 458854161 XBBLLNDNRVAPSW-GGAORHGYSA-N 397.469 5.149 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 463744236 IIIVSASDXAXJJJ-SJKOYZFVSA-N 379.262 5.082 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 467342750 KXSBNZDJEPGFGT-INIZCTEOSA-N 380.463 5.024 30 20 GKED CCC[C@@H](Cc1ccccc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468988307 MRZOOMXWPMWLQY-NRFANRHFSA-N 375.516 5.093 30 20 GKED Cc1ccc(CN(CC(=O)c2cn(CCC#N)c3ccccc23)C(C)C)s1 472439068 JDALJNZOCUAQTJ-UHFFFAOYSA-N 379.529 5.018 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)C[C@@H](CC#N)c2ccccc2)CC1 475022440 JRJVIKILSFFWCI-OAQYLSRUSA-N 385.511 5.270 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)[C@H](C)c1ccc(Cl)cc1 475203003 KVTGCILRSWCGOM-IRXDYDNUSA-N 395.934 5.527 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H](OC)c1ccc(F)cc1 475576366 SZRXHJWKJWQBCU-AOMKIAJQSA-N 384.495 5.575 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC(c3cccc(Cl)c3)CC2)c1 478230672 POFSESQADGNBCP-UHFFFAOYSA-N 396.918 5.167 30 20 GKED Cn1cc(C=C(c2nc3ccccc3s2)c2nc3ccccc3s2)cc1C#N 478920754 HAFGSQOSOLZULW-UHFFFAOYSA-N 398.516 5.705 30 20 GKED Cc1cc(C(=O)N(CCC#N)CC(F)(F)F)sc1-c1cccc(Cl)c1 482644388 DHSXQTPSHLHFBX-UHFFFAOYSA-N 386.826 5.295 30 20 GKED CCCCn1ncc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C(C)C 482754228 OEYYAEURYJNCSZ-UHFFFAOYSA-N 386.499 5.598 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cccnc1)c1ccc(Cl)cc1)c1ccccc1 483318315 YHJLITYOEFMSJP-FQEVSTJZSA-N 389.886 5.356 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F 483616968 COGDDNMREODJJL-RBSFLKMASA-N 399.482 5.429 30 20 GKED CN(C(=O)c1c(F)cc(C(F)(F)F)cc1F)[C@H]1CCCC[C@H]1C(F)(F)F 485077244 NEYVDWSMCPXKQR-SKDRFNHKSA-N 389.286 5.177 30 20 GKED CCCCn1ncc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1C(C)C 485191415 FUCGKCZMMZRESK-FPOVZHCZSA-N 393.535 5.110 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2ccc(Br)cc2[nH]1)c1ccccc1 487174367 DIQUWMOLOKQHDP-KRWDZBQOSA-N 396.288 5.095 30 20 GKED Cc1cscc1CNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 488348888 DTFSFMZLFGYSCJ-UHFFFAOYSA-N 391.496 5.023 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1coc(-c2ccc(F)cc2)n1 488819348 RGOVJRDLGKTLMN-UHFFFAOYSA-N 379.338 5.058 30 20 GKED C=CCSc1ccccc1C(=O)NCC[C@H](c1ccccc1)C(F)(F)F 491024539 TUQPDQBOCNDARR-QGZVFWFLSA-N 379.447 5.431 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)o2)c(C)c1 499836410 INIFZVZBXMALIL-LJQANCHMSA-N 394.858 5.124 30 20 GKED C=CCOc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 503247120 RCWRWRMYPDUWGR-HSZRJFAPSA-N 378.903 5.373 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@@H]3CCc4ccccc43)c2)cc1 505962783 RERQHPKADFQXCN-XMMPIXPASA-N 397.478 5.141 30 20 GKED Cc1cc(C)c(C#N)c(SCc2cc(Br)cc3cccnc23)n1 507927600 LQRKIGQZCUDQJW-UHFFFAOYSA-N 384.302 5.173 30 20 GKED N#CC1CCC(CNC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)CC1 508357608 ACZABDRQRJTACF-BPZDKFOGSA-N 398.959 5.620 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)c1cccc(C(F)F)c1 511871577 DOTGUPQVJVKQSB-UHFFFAOYSA-N 398.222 5.354 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)oc1ccccc12)c1ccc(C(F)(F)F)cn1 513732201 CLTAMCRPILWSOM-MRXNPFEDSA-N 380.325 5.490 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccc(F)c(F)c1 514193591 RHIZSVUJSGHGJK-SGTLLEGYSA-N 389.446 5.590 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 515699147 NDOACYAAJGFULQ-UHFFFAOYSA-N 389.505 5.030 30 20 GKED CN(CCCOc1cccc(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 515775210 HWVWDGWARVZVCK-UHFFFAOYSA-N 385.895 5.074 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 517658335 GZTUNRZMMQRNNO-QWHCGFSZSA-N 391.286 5.606 30 20 GKED C=CCCCN(C)C(=O)[C@@](C)(Cc1nc2ccccc2s1)c1ccccc1 522945991 FLQKFMFGSYGDNT-QHCPKHFHSA-N 378.541 5.221 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)c1ccccc1C(F)(F)F 525575359 YAIYALLPKQQGOV-SJKOYZFVSA-N 380.797 5.233 30 20 GKED CCO[C@H](C)c1nc(CSc2nc(-c3ccccc3)ccc2C#N)cs1 525630898 JSGMTPNDTSMLPM-CQSZACIVSA-N 381.526 5.467 30 20 GKED CC1CC(C#N)(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)C1 532072468 WLRUISBKNUZTIL-MTTLDHAHSA-N 391.902 5.009 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc(C)c1Cl 535853418 CERMBHNCPOJQKV-UHFFFAOYSA-N 390.870 5.660 30 20 GKED C=CCC[C@@H](NCc1nnc(-c2ccccc2)o1)c1ccc(C(F)(F)F)cc1 540428843 FNMFALRQJDAIKB-GOSISDBHSA-N 387.405 5.553 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(C2CCC2)c1 540792778 AVUSBYMJVPLPRI-UHFFFAOYSA-N 383.451 5.574 30 20 GKED C[C@@H](NCc1nc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541085665 IAYJJKWTISUYAT-QGZVFWFLSA-N 380.451 5.126 30 20 GKED CC(C)(O)CCN[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 545194608 RZGVYGSUJWUCQF-LLVKDONJSA-N 397.281 5.078 30 20 GKED CC(=O)Nc1ccc(-c2noc(-c3cccc(Oc4ccc(C#N)cc4)c3)n2)cc1 547037297 SNGOCACRODXQKM-UHFFFAOYSA-N 396.406 5.026 30 20 GKED CC1=C(c2ccco2)CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 548955328 BYPRCWBRFDXSDL-MRXNPFEDSA-N 381.501 5.385 30 20 GKED C[C@H]1CCN(C(=O)c2ccc(F)c(C#N)c2)c2cc(C(F)(F)F)ccc2S1 551564983 YVHQBEULSVHYBN-NSHDSACASA-N 394.393 5.247 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCc2sc(Cl)cc21 564369684 KYHVGXSNOIIODS-WCQYABFASA-N 391.949 5.462 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 566327563 SHKGGXGTGKVWIU-QGZVFWFLSA-N 378.476 5.036 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC(F)(F)C(F)F)cc1Cl 582793062 VULWVYRKBSAFIA-AWEZNQCLSA-N 399.775 5.017 30 20 GKED CC(C)(C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 590663268 BPAARVONUNSMRS-IMRBUKKESA-N 399.350 5.129 30 20 GKED N#C[C@@H](C(=O)c1cnc2ccccc2c1C(F)(F)F)c1ccc2ccccc2n1 591862011 INRVKHQYLOREOK-OAHLLOKOSA-N 391.352 5.292 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 592974420 WPIPLDUNVLWBEK-LLVKDONJSA-N 399.497 5.419 30 20 GKED Cc1ccc([C@H](NC(=O)N2CCC[C@H](CC#N)C2)c2ccc(F)cc2Cl)cc1 596283402 VHPATYSIYISAFD-IERDGZPVSA-N 399.897 5.212 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 609298328 SRSILKSPCHIHHF-XZOQPEGZSA-N 398.462 5.410 30 20 GKED COc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1Cl 609497270 YZZSWQGPKXDMSI-UHFFFAOYSA-N 392.842 5.459 30 20 GKED Cc1ccc(-c2cc(NC(=O)c3ccc(C#N)nc3)nc(-c3ccccc3)c2)cc1 609641144 ZTFAMUGDFBVMQJ-UHFFFAOYSA-N 390.446 5.243 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 609919556 FTTAXKAEGHLRBP-LAUBAEHRSA-N 389.524 5.272 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610356562 VCZCGDBUUPZQPB-LAUBAEHRSA-N 389.524 5.272 30 20 GKED CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@H](C)c1cccc(C#N)c1 610432009 SOYJHWAKEVELAX-DYESRHJHSA-N 379.504 5.105 30 20 GKED C=CCN(Cc1cccc(C(=O)N2CCCCC2)c1)Cc1ccc(Cl)s1 614470156 CXCSUANUMWEMBE-UHFFFAOYSA-N 388.964 5.216 30 20 GKED C[C@H](CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1F 619125352 OBZSQBWBKWIFCU-LLVKDONJSA-N 387.339 5.489 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)c1 647378501 ASTHPZHEVVVZIS-LJQANCHMSA-N 388.492 5.576 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 680409104 ZNIKMXZMYBHXKL-OAHLLOKOSA-N 390.243 5.327 30 20 GKED N#C[C@H](C(=O)c1ncsc1-c1ccccc1)c1nc2cc(F)ccc2s1 682126878 KLAOWZIDJMEPFB-CYBMUJFWSA-N 379.441 5.049 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730417128 LBQRKBQCVDINHK-DKISHCGFSA-N 378.472 5.623 30 20 GKED COc1cc(C2(C(=O)[C@H](C#N)c3nc4ccccc4s3)CCCC2)ccc1C 731136612 VNDOVTUHDJRJLX-KRWDZBQOSA-N 390.508 5.302 30 20 GKED CC[C@@H](C)n1c(SCc2ccc(OCC#N)cc2)nnc1-c1ccccc1 731158839 VHPXAUHNRSDSBG-MRXNPFEDSA-N 378.501 5.111 30 20 GKED N#C[C@@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)c1cccc(Cl)c1Cl 731195732 NJFBOEIIMXXMSU-CQSZACIVSA-N 388.081 5.224 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)cnn1-c1cccc(Cl)c1 731565563 UEGPGVMDLMGGHH-SHQCLWGWSA-N 391.858 5.021 30 20 GKED COc1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc(OC)c1 733621767 OHSRHZOWVDQAOB-QFIPXVFZSA-N 387.439 5.003 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 733851944 NQZDXMSNPHPVNY-FYYLOGMGSA-N 391.515 5.194 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2c[nH]c3ccc(OC)cc23)cc1OC 734306632 HNPVBQRXPZALSE-YVMONPNESA-N 385.847 5.133 30 20 GKED CCOCc1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)ccc1OC 734980962 NIKHAKOSHWPQOB-ONNFQVAWSA-N 378.440 5.443 30 20 GKED C[C@H](Oc1ccccc1Cl)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739594939 ATXOUBIGQWNUQQ-AWEZNQCLSA-N 396.899 5.024 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)N[C@H]2CCc3ccccc3C2)cc1 742984830 NMSCHWSJYWDAAV-ZEQRLZLVSA-N 397.547 5.186 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 746517736 CUZMPSFFCMWKSQ-CQSZACIVSA-N 398.293 5.232 30 20 GKED C=CCC[C@H](NC(=O)NCCc1cnc(C)s1)c1ccc(C(F)(F)F)cc1 749849404 QGNHANAMGFOPGB-KRWDZBQOSA-N 397.466 5.020 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1cccc(Cl)c1 750682397 YJENLSJQPNYZPC-HGZMWJMZSA-N 376.843 5.125 30 20 GKED Fc1cc(-c2ccncc2)ccc1C=NNc1ccc(OCC(F)(F)F)cc1 752735258 VCDBDTGZAXSORF-UHFFFAOYSA-N 389.352 5.275 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12 756514530 DCQJQVLUIXYDEX-OCKXMSAZSA-N 388.854 5.244 30 20 GKED CCC(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)ccc1F 756947592 LJVWIVXCONRVKX-UHFFFAOYSA-N 388.398 5.335 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl 760797548 PZRWRKZGPOSZGH-BHQIHCQQSA-N 398.743 5.052 30 20 GKED C[C@H](OC(=O)C1(C#N)CCCCC1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 761115326 XXPYCBHQIQAMDC-NSHDSACASA-N 394.258 5.122 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3ccc(F)c(Cl)c3Cl)cc2N1 761486996 RZYNEJCPMATNES-RQOWECAXSA-N 388.272 5.134 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1)c1ccncc1 761704093 ZSBFIKUKYMXFLB-JWQCQUIFSA-N 397.522 5.251 30 20 GKED Cc1cc(N(CCC#N)C(=O)CNc2ccccc2NC(C)(C)C)ccc1Cl 766132345 LZVSXZXOBSXDMW-UHFFFAOYSA-N 398.938 5.218 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@H]2c2ccccc2Br)cc1 769534256 UJCHQYNFRXTQOD-YWZLYKJASA-N 385.305 5.077 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2ncc(-c3ccccc3)s2)cc1 770571683 VIHHRIFLXSOASK-SEYXRHQNSA-N 391.496 5.236 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCC(C)(C)Cc1cccc(Cl)c1 780673109 NWYGYOSHAHCGBJ-OAHLLOKOSA-N 385.895 5.021 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(Oc3cccc(F)c3F)nc2)cc1 784314292 VBNISZRTLIPGND-UHFFFAOYSA-N 394.425 5.114 30 20 GKED C=CCOc1ccc(/C=C(/C(=O)c2cccc(OC)c2)c2ncc[nH]2)cc1Cl 787169103 MAMLPNSJOBVCIV-PDGQHHTCSA-N 394.858 5.060 30 20 GKED C[C@H]1/C(=C/c2ncc(C(F)(F)F)s2)C(=O)c2cccc(Br)c21 788355840 PPHLBKGJCPQQRR-VYVBZAQUSA-N 388.208 5.308 30 20 GKED Cc1cc(C(=O)/C=C/c2nc(-c3cc(Cl)ccc3Cl)cs2)n(C)n1 789160845 YWBVXMNSMSRHBN-AATRIKPKSA-N 378.284 5.055 30 20 GKED Cc1cc(C(=O)/C=C/c2cnc(-c3ccccc3)nc2)sc1Br 794731345 ASNSOXVQSCBRDF-BQYQJAHWSA-N 385.286 5.172 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c(Cl)c1 797570764 KBBVCAKBDUYVSO-AWEZNQCLSA-N 390.936 5.438 30 20 GKED C[C@H](Oc1ccccc1C(F)(F)F)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571801 QJEHDAITIQDOME-RYUDHWBXSA-N 396.434 5.103 30 20 GKED CCCCCCOc1cccc(CN2CCC(C#N)(c3ccccn3)CC2)c1 800527718 BANWZOQRIHQLTB-UHFFFAOYSA-N 377.532 5.098 30 20 GKED CC(C)(C(=O)OCc1coc(-c2ccc(Cl)cc2)n1)c1cc(F)cc(C#N)c1 803925024 REHUTNYYGVBFAB-UHFFFAOYSA-N 398.821 5.027 30 20 GKED N#CCSc1ccccc1C(=O)N1CCC([C@H](F)c2ccccc2F)CC1 804195088 VGWVRUOSIQSCFL-FQEVSTJZSA-N 386.467 5.004 30 20 GKED Cc1cc(CN[C@H](C)c2ccc(OCC#N)cc2)cc(NC(=O)OC(C)(C)C)c1 834897202 YQDOMGFAWQJXCE-QGZVFWFLSA-N 395.503 5.095 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942870 DZFCNGAHTTUZRO-XJKSGUPXSA-N 392.446 5.484 30 20 GKED C=CCOc1cc(OC)ccc1-c1nc(-c2ccc(C(F)(F)F)s2)no1 904971346 UAWMNZHEWYAYFA-UHFFFAOYSA-N 382.363 5.057 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C/c1ccc(-c2cccc(Cl)c2)s1 914702368 CISGWGPJUSSBIB-GZTJUZNOSA-N 388.945 5.571 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915352861 OGAALYJTOPTSOD-GGAORHGYSA-N 384.483 5.050 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916679244 KQBBJWWBTZZECH-XMMPIXPASA-N 383.495 5.439 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCCCCC2)cc1Cl 916683643 BLQXVZSPLILZHA-FQEVSTJZSA-N 381.907 5.793 30 20 GKED N#C[C@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1ccc2ccccc2n1 916849613 WAIKPZVUPWSWLY-SSUIOBEFSA-N 398.462 5.852 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043651 LYUKIFRPOFVTSU-HNNXBMFYSA-N 382.872 5.098 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C\C(=O)c2sc(C(C)(C)C)nc2C)cc1 920069323 YHAYFAKYNOXJKX-FLIBITNWSA-N 381.501 5.044 30 20 GKED CCCOc1ccc(C=NOCc2csc(-c3cccs3)n2)cc1OC 920399528 UOLYMJZZCLUXCO-UHFFFAOYSA-N 388.514 5.220 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1cc(F)ccc1Oc1ccc(Cl)cc1 1776031377 CYOCHHCJKKPFHZ-UHFFFAOYSA-N 398.821 5.806 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)s1 1776339892 OXSIQAFIAIVWID-ACAGNQJTSA-N 390.504 6.208 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)c(OC)cc1Cl 1776783045 SQKBUSPUARKIRT-AWEZNQCLSA-N 376.324 5.295 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(Cl)cccc1Br 1776783172 GZQHUWADQWUPLM-ZDUSSCGKSA-N 390.749 5.396 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1C 1777275187 GZVSSBQXMLHNIL-XQRVVYSFSA-N 384.428 5.260 30 20 GKED N#Cc1cccc(CSc2nc3ccccc3c(=O)n2C2CCCCC2)c1 6532228 CZFOLJGCIHYUFU-UHFFFAOYSA-N 375.497 5.066 30 20 GKED N#C[C@@H](C(=O)CCCCc1nc2ccccc2s1)c1nc2ccccc2o1 41544323 DZHNJOUGACWNRP-AWEZNQCLSA-N 375.453 5.027 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccccc3Cl)s2)sc2c1CCCC2 64867652 KTOYEOCDZXAEIH-UHFFFAOYSA-N 399.928 5.528 30 20 GKED C=CCN(C(=O)c1cocn1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 105364022 LVPZYVDUYNKRDG-UHFFFAOYSA-N 387.464 5.298 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1cccc(Cl)c1Cl 108355040 CMYIPDDCGBQWIH-LBPRGKRZSA-N 394.327 5.296 30 20 GKED CCc1ccc(-c2noc(CNc3ccccc3S[C@H](C)CC#N)n2)cc1 109002891 BRBHRDRFMBQWJM-OAHLLOKOSA-N 378.501 5.305 30 20 GKED C[C@@H](NCc1cccc(C#N)c1)c1nc(-c2ccc(Br)cc2)cs1 126150398 SWOAUIRBXLPSQJ-CYBMUJFWSA-N 398.329 5.295 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(C(=O)N2CCCC2)c1C)c1ccccc1 155489987 XWCQWTUZMSZWHQ-QFIPXVFZSA-N 391.515 5.060 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)N(CCC#N)CCC(C)C 176870406 RXEDLFCNNJFSSP-UHFFFAOYSA-N 392.503 5.041 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Cl)ccc1OC(F)F 177599814 FHQAGTCFAUXVDE-UHFFFAOYSA-N 382.819 5.199 30 20 GKED N#Cc1cccc(CNc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)c1 178325001 OHPJMELORGXWOW-UHFFFAOYSA-N 385.345 5.034 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2sc(C(C)C)nc2C)ccc1OC 180813839 TVYIRQWFHTZEQA-YOEHRIQHSA-N 387.549 5.115 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSCC(=O)Nc1cccc(C)c1 189903011 RAXIIUQEWPRPRF-UHFFFAOYSA-N 396.556 5.157 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2 191489205 VJEAXQPDRCYBML-FQEVSTJZSA-N 392.499 5.636 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)ccc1C 193870299 HYIQWUAJFSTVOU-UHFFFAOYSA-N 398.462 5.095 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(C)cccc1[N+](=O)[O-] 194274171 NEWTZRKSFWEWAK-UHFFFAOYSA-N 387.395 5.128 30 20 GKED N#CCN(C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)c1ccccc1 195116212 YOACXBQCZUPJJD-UHFFFAOYSA-N 388.279 5.287 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1cccc(F)c1 205667412 NYLMKNIZLRTFJG-QXMHVHEDSA-N 379.818 5.628 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F 246683510 HLMUPWFHNKYUEK-QINHECLXSA-N 397.519 5.692 30 20 GKED CC(C)(CC(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 413182042 WVPAJQHQFIXWFZ-MRXNPFEDSA-N 376.834 5.615 30 20 GKED N#CC1(CSCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CCC1 419577623 HVNXKWQSESTCMD-INIZCTEOSA-N 383.344 5.084 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1CCC(F)(F)F 425664694 ULWVHIZEFCMOBH-AWEZNQCLSA-N 375.394 5.278 30 20 GKED Cc1ccc(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)cc1C(F)(F)F 428279364 WDAPYRNUCKGYSO-UHFFFAOYSA-N 398.388 5.043 30 20 GKED N#Cc1ccc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)c(Cl)c1 430348611 BFACFBYDWSEVJI-NLKGSNSHSA-N 382.813 5.299 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@H](CC(F)(F)F)C1 433992939 KOWKIYXBJYXVRH-CQSZACIVSA-N 390.430 5.124 30 20 GKED CCSCc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 434621911 YGZMUGCJBSTJDF-OAHLLOKOSA-N 386.929 5.693 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc2c3c(cccc13)CC2 437614708 MRJQFEUKVVWCIK-GMAHTHKFSA-N 381.479 5.242 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 439588618 SLASMEVICFBTHV-RTBURBONSA-N 395.469 5.095 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)CC1 441798272 CXVVHPIFTJQAGQ-ZOJXTTQQSA-N 389.421 5.072 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2cscn2)c1)c1nc2ccccc2n1C(F)F 442680957 REPDPNCGVQLXOP-AWEZNQCLSA-N 394.406 5.045 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455708716 UUTOGIPAAXZZND-LBPRGKRZSA-N 395.812 5.650 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(C1CC1)[C@@H](C)c1ccccc1Cl 460560844 DHSKTTVXBVXEOL-KXBFYZLASA-N 386.927 5.089 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1C[C@H]1c1ccccc1 461243259 JCNNYKXLNLNXIE-NEWSRXKRSA-N 396.581 5.556 30 20 GKED C=CCn1c(Sc2nc3cc(C(F)(F)F)ccc3s2)nnc1C1CC1 462930167 HEAATYCBOYSFTL-UHFFFAOYSA-N 382.436 5.121 30 20 GKED C=CCn1c(SCCC(=O)c2ccccc2)nnc1-c1ccc(Cl)cc1 463045025 VJUNFOWIYQOWSQ-UHFFFAOYSA-N 383.904 5.150 30 20 GKED Cc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)c(-c2nc3ccccc3[nH]2)c1 463574611 PEFCOQMRNMPJEW-MRXNPFEDSA-N 380.451 5.152 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1[N+](=O)[O-] 463920891 FAROGHXECNSUST-GFCCVEGCSA-N 395.406 5.792 30 20 GKED CSc1cccc([C@H](NC(=O)c2cccc(C#N)c2)c2ccc(F)c(F)c2)c1 464123702 VRESMMHRZCYYBF-NRFANRHFSA-N 394.446 5.078 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1cc(C(F)(F)F)ccn1 464410360 IWDPGARVABQARZ-IBGZPJMESA-N 378.353 5.162 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 464477227 ZYKMRRPINVFBIU-QGZVFWFLSA-N 376.378 5.015 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1ccc(C(=O)Nc2ccccc2)cc1 464815814 USCCGVKQVBSSCZ-JWQCQUIFSA-N 395.506 5.211 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(-c2nc(CC)no2)ccc1C 467942544 QATPIYFCGUWBBE-UHFFFAOYSA-N 390.487 5.218 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 469244901 QJBWQEYJEHXHOR-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CC(C)Sc1ccccc1NC(=O)c1cn(CCCC#N)c2ccccc12 469582717 LQXYCTMIXHSWNV-UHFFFAOYSA-N 377.513 5.698 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)Nc1ccccc1SCCC#N 469967381 PRVLCWRTVBNWPK-UHFFFAOYSA-N 384.501 5.132 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C(F)(F)F 470348888 AVZUHVMLACMBNQ-KRWDZBQOSA-N 377.366 5.121 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474701621 GQCCSPFAGACWTJ-ZBFHGGJFSA-N 375.299 5.600 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1ccc(C(C)(C)C#N)cc1 475660321 ICDNVBQNRYQPIS-UHFFFAOYSA-N 379.504 5.755 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 476080929 QWANPRQBJPPWDM-MRXNPFEDSA-N 392.446 5.676 30 20 GKED CO[C@H]1CCC[C@@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 476205692 QDISYRHREGWLDA-QAPCUYQASA-N 382.435 5.023 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)[C@@H](C)c1cccnc1 479624495 UCGJYQMIMQQCPT-KRWDZBQOSA-N 387.508 5.328 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)s1 482451617 XDIQJRQHSJJKFM-UHFFFAOYSA-N 384.407 5.505 30 20 GKED C=C(C)[C@@H](NC(=O)NCc1ccc(-c2cccnc2)cc1)c1ccc(F)c(F)c1 483117837 PJUJTTDEVYQMBF-JOCHJYFZSA-N 393.437 5.143 30 20 GKED Cc1nc(COc2cccc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2)cs1 483193465 ILWRFZSSURFPJB-OAQYLSRUSA-N 399.475 5.069 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 484157834 CPDVVSDQQZTQSF-CQSZACIVSA-N 394.862 5.304 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N[C@@H](CCCC#N)c1ccccc1 487271446 RRSOFYAPFAKMKA-PBHICJAKSA-N 391.298 5.312 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 494397225 QVCDRXDHJBMEJO-UHFFFAOYSA-N 396.343 5.519 30 20 GKED CCN(C(=O)c1cc(C)n(-c2cccc(C#N)c2)n1)[C@@H](C)c1cc2ccccc2o1 504077151 RRKGDJWIAWHPTI-KRWDZBQOSA-N 398.466 5.022 30 20 GKED C[C@H](NC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 505285633 QCPDJACWPLYEAN-OALUTQOASA-N 383.495 5.139 30 20 GKED CCC(CC)N(C(=O)c1cccc(SCC#N)c1)[C@H]1CCCc2cccnc21 511303369 GUQMOVRIXYTNSK-NRFANRHFSA-N 393.556 5.406 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC)c1ccc(Cl)s1 513082282 LFRAAENWOGJYGN-HNNXBMFYSA-N 393.896 5.159 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1nc(-c2ccccc2)cs1 513448418 MMJXUYMKLAQYSH-CQSZACIVSA-N 379.510 5.457 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCc2ccccc2CC1 515129959 UYVAYKOTQBSREP-KRWDZBQOSA-N 379.529 5.104 30 20 GKED C[C@@H](c1ccc(Br)cc1)c1noc(C[C@@H](CC#N)c2ccccc2)n1 515182336 VDCGPSKKNKHYJL-WMLDXEAASA-N 396.288 5.224 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(OCCCC)cc1C 516470964 XETKGLPKYPLHKS-UHFFFAOYSA-N 382.504 5.403 30 20 GKED C[C@@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(C#N)cc1 518277271 CCXTVIMHLKXGRB-MRXNPFEDSA-N 389.886 5.315 30 20 GKED CC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1C 534771868 JJPRHTNXHJCEID-UHFFFAOYSA-N 386.476 5.473 30 20 GKED Cc1cccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1Br 535326349 SDDOFSJUPBUAPF-UHFFFAOYSA-N 397.297 5.610 30 20 GKED CCN(C(=O)c1cc(C)n(-c2ccc(Cl)cc2Cl)n1)c1ccc(C#N)cc1 539559793 FBJNMCKEVKXIFZ-UHFFFAOYSA-N 399.281 5.026 30 20 GKED COC1(c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCC1 545100287 SKLRDVMQUQMICY-UHFFFAOYSA-N 381.819 5.080 30 20 GKED N#CCc1ccc(-c2nc(-c3ccc(NC(=O)Nc4ccccc4)cc3)no2)cc1 547042719 XHWPAHJRVUMZCA-UHFFFAOYSA-N 395.422 5.114 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@H]1CC[C@@H](C#N)C1 549933760 AIBQKLVFYCAZBZ-GHJWDPDVSA-N 390.350 5.224 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCC2(C(F)(F)F)CC2)c1 552695732 DMEQZIKSRJSMNS-UHFFFAOYSA-N 394.780 5.076 30 20 GKED Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 556198727 WLMHVSMIJRXOSK-UZLBHIALSA-N 376.529 5.599 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@](C)(c3ccccc3)CC2)cc1 558279637 XHWIZRVRMYRZAX-DEOSSOPVSA-N 375.516 5.463 30 20 GKED N#CCCC[C@H](NC1CC(c2ccc(Br)cc2)C1)c1ccccc1 559862396 BMBXKAKHZSMOIO-MNLRITNHSA-N 383.333 5.720 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCCc2nc(-c3ccccc3)sc21 561130827 IDXQFMJRRLJLIV-SFTDATJTSA-N 385.536 5.726 30 20 GKED CN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1CCC(F)(F)CC1 562170481 CIKOGQJMBXECES-UHFFFAOYSA-N 385.414 5.392 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(-c2ccncc2)cc1 564382924 YMNPZAMEGNRIIH-HNNXBMFYSA-N 381.401 5.490 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H]1c2ccccc2CC12CCOCC2)c1ccccc1 564581372 LKPJAJVGHPDALH-XZOQPEGZSA-N 390.527 5.087 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 567316173 XCTTYFRIZQSDSP-SFHVURJKSA-N 398.466 5.075 30 20 GKED CO[C@](C)(c1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1)C1CC1 579969122 KYVGYRROFCNHRR-NRFANRHFSA-N 377.469 5.031 30 20 GKED CCN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@H]1CCOC(C)(C)C1 583593275 SNXMMFZYEIHVDP-IBGZPJMESA-N 393.487 5.162 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cs1 589830059 FEYJFWHJBFPMPB-CQSZACIVSA-N 387.386 5.022 30 20 GKED N#CCCC[C@@H](NC(=O)[C@H]1CCc2cc(Br)ccc21)c1ccccc1 592635314 BJSJXNWOFKSSAF-VQTJNVASSA-N 397.316 5.030 30 20 GKED C=CCC1(NC(=O)Nc2cccc(C[S@@](=O)c3ccccc3)c2)CCCC1 596745822 HEZGOKLKHBGMPA-HHHXNRCGSA-N 382.529 5.005 30 20 GKED C[C@]12CCCC[C@H]1CN2C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 599724640 LDYJXAGYELUALX-RDPSFJRHSA-N 389.499 5.128 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CCCC(F)(F)CC2)cc1 599793833 KPUUSNGUOKYBEA-UHFFFAOYSA-N 387.455 5.363 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2cc3ccccc3o2)cc1 604383023 CSGLRBMETMNRDR-UHFFFAOYSA-N 396.446 5.259 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604461921 UTGVZIHPJCYOHV-HNNXBMFYSA-N 389.480 5.563 30 20 GKED CCOc1cccc(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609208818 HDJNLHDZSIEDPV-UHFFFAOYSA-N 387.439 5.071 30 20 GKED CCN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1cccc(C)c1C 609642003 QNABKHJZNCCEFI-UHFFFAOYSA-N 384.479 5.421 30 20 GKED C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)c1ccc(C#N)cc1 609813744 MTYXFKFZQISIAG-OAHLLOKOSA-N 376.529 5.505 30 20 GKED C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610583966 ORLLOWGMPJNTTG-VGOFRKELSA-N 398.466 5.155 30 20 GKED O=C(CCC(=O)c1ccc(F)cc1F)Nc1cccc(C#Cc2cccs2)c1 613378028 SUIMVYKWFONSFT-UHFFFAOYSA-N 395.430 5.028 30 20 GKED CC(C)c1ccsc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 619753835 UJHIHMMHLRNTTM-GFCCVEGCSA-N 394.443 5.990 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnc(C(F)(F)F)cc1C 685667005 MTGBXARCLKLYSM-UHFFFAOYSA-N 389.830 5.344 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2SCc2ccccc2)cc1 728459800 ILKVXIXTTKHSKA-UHFFFAOYSA-N 390.533 5.581 30 20 GKED CC(C)c1ccc2cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)[nH]c2c1 731025814 NYOZVCZDCURFBU-OAHLLOKOSA-N 377.513 5.795 30 20 GKED CCOc1c(Br)cc(/C=C\C(=O)c2sccc2C)cc1OC 733748758 IURAWYMYNIUMOE-WAYWQWQTSA-N 381.291 5.122 30 20 GKED CCCCSCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 740534055 BNOZIXJFMQDRKS-OAHLLOKOSA-N 378.950 5.563 30 20 GKED C=CCOc1ccc(OC(=O)c2ccccc2SCc2cc(C)no2)cc1 742862041 MZUCQALWOKSCNQ-UHFFFAOYSA-N 381.453 5.059 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)c[nH]c2c1 742962559 NMDSFLHMGVAHDI-UHFFFAOYSA-N 399.425 5.461 30 20 GKED CCOc1cccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 742984821 NKFCHCFZXWLWBT-JOCHJYFZSA-N 387.508 5.550 30 20 GKED O=C(/C=C\C1CC1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 744009981 BFUGWXBMCKPXGS-QXMHVHEDSA-N 376.506 5.573 30 20 GKED Cc1ccc(-c2nc(CON=Cc3ccc(Br)cc3)cs2)o1 744179738 DODOHDCFZZUWKR-UHFFFAOYSA-N 377.263 5.025 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccccc1Cl 745724396 QEPQSMUMCNWNAB-UHFFFAOYSA-N 377.900 5.615 30 20 GKED O=C(Nc1ccccn1)c1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 750949467 XDZVFEOAINDXJW-UHFFFAOYSA-N 386.238 5.097 30 20 GKED CC(=O)c1ccc(C#N)cc1NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 754009169 ZEXQUZULEOQZHX-VXGBXAGGSA-N 378.316 5.082 30 20 GKED C=C(C)COc1cc(CN[C@H]2CC3(CCC3)Oc3ccccc32)ccc1OC 757704700 INGIYBFCRIYJJZ-FQEVSTJZSA-N 379.500 5.186 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(NC(=O)C(C)C)cc2)cc1 764744020 QONIQNUTMHNTCK-KRWDZBQOSA-N 386.923 5.263 30 20 GKED COc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2)c(C#N)c1 777477789 XGUDOPSEVPWYGN-UHFFFAOYSA-N 375.453 5.168 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CC(Cc1ccccc1)Cc1ccccc1 780150128 TXSZSJTWSCZUCI-FQEVSTJZSA-N 398.506 5.408 30 20 GKED C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)c1cccc(C#N)c1 785442617 QYXGWUNYAHWRFD-NSHDSACASA-N 389.958 6.042 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3c[nH]c4ccccc34)n2)cc1 786306663 ABKGAAYSQXHHLX-LPHOPBHVSA-N 399.519 5.970 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 787832281 MNHQBGKSEWGYAX-NRFANRHFSA-N 395.553 5.257 30 20 GKED N#C[C@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1nccc2ccccc12 792097601 XWTAWUPSBHYICW-UKQGIEBLSA-N 398.462 5.852 30 20 GKED COc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 793378436 YTGRCOXAFSFCFI-KMDXXIMOSA-N 397.478 5.028 30 20 GKED C=CCC(C)(C)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 796455965 VYNWLLZYXJTSMK-SECBINFHSA-N 378.683 5.119 30 20 GKED C=CC[C@@H](NC(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1ccncc1 798414051 CONDGUYHPZFHNV-GPMSIDNRSA-N 390.314 5.251 30 20 GKED C[C@@H](N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(-c2cccc(C#N)c2)cc1 815615377 OPJXJOYCWPSZQB-HZPDHXFCSA-N 386.455 5.127 30 20 GKED CC[C@H](CC(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 838790877 LJOFTNCVRZEXKQ-PSASIEDQSA-N 376.350 5.173 30 20 GKED C#C[C@@](C)(CC)NCc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 852100822 JPDYFFUYDFWTGP-SFHVURJKSA-N 396.343 5.026 30 20 GKED CCCCCCCC(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 890439349 XOURYMITDWDTHW-UHFFFAOYSA-N 388.943 5.624 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccccc2Cl)cc1 915124775 VYNLGLKQDJDDFJ-SFHVURJKSA-N 377.900 5.804 30 20 GKED CC(C)c1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915351849 CMFKSFARWIEZIY-VWLOTQADSA-N 397.522 6.129 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2c(F)c(F)c(F)c(F)c2F)n1 917251979 PUAJXVVUJZPOOZ-UHFFFAOYSA-N 398.278 5.268 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccccc1OCC#N 919998280 DZVDKYIPUUTODS-KRWDZBQOSA-N 376.481 5.054 30 20 GKED CC[C@@H](C)c1nnc(N2CCC(CC#N)CC2)n1Cc1ccc(C)cc1SC 1291496226 GQXDBXKMNKKAKM-QGZVFWFLSA-N 397.592 5.000 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NN(c3ccccc3)c3ccccc3)s2)c1 1776032798 ULMYFRUROASMMP-UHFFFAOYSA-N 398.487 6.286 30 20 GKED C=CCCC[C@H](NCc1cc(Cl)ccc1Oc1ccccc1CC)C(=O)O 1776174253 JBBGTHIQBMKKFZ-IBGZPJMESA-N 387.907 5.594 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2ccccc21 1776308574 DMRYDURDGRJPCR-HKPSVDRMSA-N 382.459 6.071 30 20 GKED C[C@@H]1C/C(=C/c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2ccccc21 1776589822 ZOHQPPNFQDASNP-WIZMWCRPSA-N 388.419 5.330 30 20 GKED CCCCCCCOc1ccc(CNCc2cccc(CCC(=O)O)c2)cc1 1776787047 OIZKCRLMQDMSFD-UHFFFAOYSA-N 383.532 5.343 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)c2cc(C)cc(C)c2)cc1 1776787913 DOKQJCYRCZVWOY-HSZRJFAPSA-N 383.532 5.568 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C\C(=O)c1ccc(C(=O)O)s1 1777341950 IAPURDGXZSBDHF-CLFYSBASSA-N 378.449 5.326 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2Br)c1 1777684998 SFNJDESJTNGBNW-QPJJXVBHSA-N 399.162 5.062 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2OCc2ccc(Cl)cc2)n1 41519962 UQSKBAOFOWMJAG-KRWDZBQOSA-N 382.872 5.174 30 20 GKED COc1ccc([C@@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)cc1F 47698349 CRNALWLJKKFDSY-QGZVFWFLSA-N 390.458 5.136 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)Nc3cc(C#N)ccc3OC)oc2c1 64455324 BMGVCLOGBXBGSW-UHFFFAOYSA-N 398.418 5.241 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 64715079 GTLZDKZBIZRNDF-ZDUSSCGKSA-N 393.418 5.368 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2nccs2)c1 66160649 QLURNBIZWXUUPR-UHFFFAOYSA-N 376.485 5.124 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(OCc2nccn2C)cc1)c1ccccc1 90580882 VEUCOOCSXYLWCY-WMZHIEFXSA-N 375.516 5.357 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 111948031 AWWMWSMGWPDDGA-SZJVNEJHSA-N 387.439 5.101 30 20 GKED C[C@H](Oc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)cc2Cl)o1 134307941 YUIOEAZPOSQNSB-VIFPVBQESA-N 378.190 5.194 30 20 GKED N#C[C@@H](C(=O)c1cccc(C(F)F)c1)c1nc(-c2ccc(Cl)cc2)cs1 171567053 MNIVDTFZEZYQMR-HNNXBMFYSA-N 388.826 5.891 30 20 GKED COc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 173123766 NBFUQCRIWYRNQS-SJORKVTESA-N 397.544 5.184 30 20 GKED CC(=O)N(c1nc(CSc2cccc(C#N)c2)cs1)c1cccc(C)c1C 177112986 LQKDNDSMAOHRKT-UHFFFAOYSA-N 393.537 5.609 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccn3C3CCCC3)n2)cc1 181489404 NFAFJVIBGOQWBA-GOSISDBHSA-N 386.480 5.088 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(Sc4ccc(Cl)cc4)CC3)cc2)CC1 182165326 MJYNRWHKDLRFKW-UHFFFAOYSA-N 396.943 5.292 30 20 GKED Fc1cccc(F)c1[C@H](NCc1nc2ccccc2n1C(F)F)C(F)(F)F 183443517 JYAIWBVEOBDUJC-HNNXBMFYSA-N 391.290 5.103 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@@H](C)c1nccs1 184597618 VQUMJJAUDVEIEU-OAHLLOKOSA-N 392.484 5.041 30 20 GKED CC#CCCCC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 185692172 VKFWIALGXBYGLT-UHFFFAOYSA-N 384.398 5.185 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 189870943 BBSDSOWUDPVIKI-UHFFFAOYSA-N 397.431 5.224 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2F)s1)c1cccc(N2CCOC2=O)c1 208087384 YQRDRKHJMOVIIW-NTMALXAHSA-N 393.439 5.407 30 20 GKED Cc1ccsc1[C@@H]1C[C@@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 246923943 SQQWGSOLUNTMQL-BBWFWOEESA-N 389.505 5.032 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCc1ccc(OC(F)F)cc1 302927507 CKXCWPXXOAFHRM-UHFFFAOYSA-N 385.863 5.150 30 20 GKED COc1c(Br)cc(Cl)cc1N[C@@H](C)c1ccc(OCC#N)cc1 319737226 RVEKOZXNEPPNEF-NSHDSACASA-N 395.684 5.187 30 20 GKED O/C(CCc1nnc(-c2cc3ccccc3o2)o1)=N/C12CC3CC(CC(C3)C1)C2 328756584 UIPWEBWWWVPIGZ-UHFFFAOYSA-N 391.471 5.341 30 20 GKED O/C(=N/[C@@H]1CC[C@@H]2CCCC[C@H]2C1)C1CCN(c2nc3ccccc3o2)CC1 329214536 LGDAPWGOAMNFLK-YTQUADARSA-N 381.520 5.360 30 20 GKED Cc1cnc(C(C)(C)/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)s1 329436280 JURNIRHTMFQDPW-MRXNPFEDSA-N 386.565 5.150 30 20 GKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)C3CCC(/N=C(/O)C4CC4)CC3)c3cccc1c32 330018388 SRJOMTBAKMHTIU-HTZGDQIUSA-N 394.559 6.168 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)c(F)cc1N1CCCCC1 425688713 ZXECKUGUCHYGEW-OAHLLOKOSA-N 398.457 5.052 30 20 GKED CC(C)Cn1ncc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1-c1ccccc1 428233071 XIABUZFFTJVVRN-UHFFFAOYSA-N 386.499 5.260 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431463346 HAQWIRODRPZCIJ-NQIIRXRSSA-N 381.545 5.210 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c(Cl)cncc3Cl)cc2)cc1 432800434 NEHGPRVZNMDFNS-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(Cl)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 433273856 KYONNJZYFNMUFF-KRWDZBQOSA-N 376.287 5.859 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(CC(F)(F)F)cc1 438366821 XUGPUDBFNQZIJW-RTBURBONSA-N 387.405 5.095 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 440251028 ANAXTWWRMXKZRZ-FGZHOGPDSA-N 381.495 5.079 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1nccs1)c1ccc(C(F)(F)F)cc1 441528232 BURHKUWRIPXKPC-OAHLLOKOSA-N 383.439 5.011 30 20 GKED COc1cccc(-c2nc(CS[C@H](C)c3cccc(C#N)c3)cs2)c1OC 443128104 CXTYFRAMJCSBSK-CQSZACIVSA-N 396.537 5.693 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1cc(C#N)ccc1Br 444790853 KWVVLSWVZWEKQF-QGZVFWFLSA-N 397.238 5.413 30 20 GKED C=CCOc1cccc(CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)c1 446840338 FGLTUJIRDADVBW-UHFFFAOYSA-N 391.433 5.066 30 20 GKED CCN(C(=O)c1cc(Br)cc2ccccc12)c1ccc(C#N)cc1 463957070 BBAYVVPAIZRWES-UHFFFAOYSA-N 379.257 5.141 30 20 GKED C=CC1CCN(C(=O)N[C@H](c2cccc(OC)c2)c2ccccc2Cl)CC1 466051649 PTOOWPICFZXBPN-OAQYLSRUSA-N 384.907 5.046 30 20 GKED C[C@@H](CCC1CC1)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 469446153 LIHBIJBTODSHKI-KRWDZBQOSA-N 377.488 5.032 30 20 GKED Cc1ccc(-c2nnc(CNc3cccc(Oc4ccc(C#N)cc4)c3)o2)cc1 471669226 PEVIOFHRWWBRMF-UHFFFAOYSA-N 382.423 5.321 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cc(F)ccc1F 474260507 SHIRWGPZSNCWLD-CQSZACIVSA-N 397.265 5.407 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(SCc2cccnc2)cc1)c1ccccc1 474420337 FCNVRWRLKTZRIG-FQEVSTJZSA-N 387.508 5.400 30 20 GKED N#CCC[C@H](NC(=O)c1cc(F)c(Br)cc1Cl)c1ccccc1 476406589 DMWISCZETLITBQ-INIZCTEOSA-N 395.659 5.016 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)c1 477666998 NESVKZQTCXQMTL-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CCN(C(=O)Nc1ccc(F)c(C#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 481683956 IVHBPHQPMDWQBT-LBPRGKRZSA-N 379.357 5.331 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H](C)c1cccc(OC)c1 481751593 SXOGYNKGYBVWEN-HNNXBMFYSA-N 399.491 5.044 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cnn1-c1ccccc1Cl 482858874 MDPRPXAGOMOTQV-CYBMUJFWSA-N 398.919 5.158 30 20 GKED CC1(C)C[C@]1(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 484912264 SHZAHTBMHYPJKL-HXUWFJFHSA-N 382.510 5.209 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OCC2CCOCC2)cc1 485464148 KSCRQGSAXHHAAG-UHFFFAOYSA-N 383.513 5.022 30 20 GKED C[C@H](N=c1c(C#N)c[nH]c2ccc(Cl)cc12)c1nc2ccccc2n1C(F)F 486453091 SDHCPKODIBDKIA-NSHDSACASA-N 397.816 5.100 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 493236457 KBLNSXMFLPVYCI-ZDUSSCGKSA-N 393.896 5.077 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCC3(C#N)CC3)n2Cc2ccco2)cc1 500764228 SDPJUVWQMIBPFT-UHFFFAOYSA-N 392.528 5.280 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cncc(-c4ccc(Cl)cc4)c3)CC2)cc1 503910595 NNHTVCRNBXCCTG-UHFFFAOYSA-N 399.881 5.203 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 505775386 AWOYZQLNZTYKPB-KRWDZBQOSA-N 381.888 5.272 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 509457612 ZFKWIZQTUIFDRU-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C[C@@H](SCC(=O)c1cn(CCC#N)c2ccccc12)c1ccc(Cl)cc1 520117646 DUSFRPUYKKHGEA-OAHLLOKOSA-N 382.916 5.885 30 20 GKED CC(C)Sc1ccc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 520271734 GIVKHOWSTVZVJW-QGZVFWFLSA-N 379.312 5.489 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520533554 XKCGRYJPPYNSSI-AWEZNQCLSA-N 394.377 5.035 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1 520714284 LRSPGSPGRBZUCQ-QFIPXVFZSA-N 390.483 5.189 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1 522070841 MLNIIQUNOYSXBA-DEOSSOPVSA-N 381.479 5.159 30 20 GKED C[C@H]1C[C@@H](C)C[C@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 523542969 RDVJQGGCQBLZNV-YRWFTTLQSA-N 378.541 5.405 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)Nc3cc(C(C)(C)C)sc3C#N)o2)cc1 533807498 NMUBORKDYPHWRN-UHFFFAOYSA-N 393.512 5.452 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2cc(C#N)ccc2OC(C)C)c1C1CC1 534231618 QLMOESZKQMXUET-AWEZNQCLSA-N 381.480 5.034 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(OCc2cccnc2)cc1 537021641 GSWCNUDKRDPSRQ-IBGZPJMESA-N 385.511 5.313 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2Cl)cc1 537306348 UHFJGPPFACFYAO-WAIKUNEKSA-N 376.887 5.660 30 20 GKED COc1ccc(C)cc1NC(=O)[C@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 543860793 LJNINXWVLZUSRU-LBPRGKRZSA-N 394.418 5.013 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc(O)cc2)cc1Cl 546162254 CFLLGUCTIQECBJ-OAQYLSRUSA-N 390.870 5.272 30 20 GKED CCN(C(=O)[C@H](C)CC(=O)c1ccc(Cl)cc1)[C@@H](C)c1ccc(C#N)cc1 546794690 LXORKBXZWYVJBH-CVEARBPZSA-N 382.891 5.030 30 20 GKED CC(C)Cn1c(-c2ccc(Cl)cc2Cl)nnc1N1CCC(C)(C#N)CC1 549847057 HAOGWAVKBVIMBL-UHFFFAOYSA-N 392.334 5.038 30 20 GKED N#Cc1ccc2ncc(CN[C@H](CCCc3ccccc3)c3ccccc3)n2c1 551546963 DEEUMFGNVQMGAB-XMMPIXPASA-N 380.495 5.060 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(Cc2ccc(F)cc2)CC1 552787145 QIUFSUGDCGMWLD-INIZCTEOSA-N 397.519 5.364 30 20 GKED C=CCN(CCC#N)C(=O)c1oc2ccccc2c1CSc1cccs1 553101847 FNJNUSDTAGTMCO-UHFFFAOYSA-N 382.510 5.328 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 559867093 ZEIRRTQHCKJSRF-UZLBHIALSA-N 376.422 5.713 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1sc(C)nc1-c1ccccc1 561237543 GYDFICCJOIFPOP-UHFFFAOYSA-N 394.544 5.114 30 20 GKED Cc1cccc(Br)c1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 577795283 YRQWZPDADCEGBU-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)c1ccc(C#N)cc1 583530329 VCLNNLDKAVJGAU-QGZVFWFLSA-N 397.503 5.170 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OCc2ccccc2)cc1 590257317 JPYZEHGSTWOHHF-LVXARBLLSA-N 384.523 6.351 30 20 GKED CC[C@H](C)c1nc(C)c(CC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1 593976476 WRTBTJGUPZKOJU-LSDHHAIUSA-N 396.560 5.182 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(C2CC2)[nH]c1C1CC1 599054560 BTUJQCIYVPLDRB-UHFFFAOYSA-N 398.466 5.389 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(CSc3ccccc3)cc2)s1 604027541 BOMAYOJEFWIOOK-UHFFFAOYSA-N 378.522 5.727 30 20 GKED CCN(C(=O)c1cnc(-c2ccc(C)cc2C)s1)[C@@H](C)c1ccc(C#N)cc1 604508804 UJPUCKLNVPAYLZ-KRWDZBQOSA-N 389.524 5.522 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1sc2cccc(Cl)c2c1Cl 604530076 IZZMBCRJUQOXRP-UHFFFAOYSA-N 390.295 5.159 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc2c(Cl)cccc2s1 609377494 GURBDYFNQRSLOJ-LBPRGKRZSA-N 386.929 6.059 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609647242 BWZPNTUDLPSAQE-YADARESESA-N 396.490 5.155 30 20 GKED COc1ccc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)n2CC(C)C)cc1 609813573 LZVKLWPJEJNZTO-INIZCTEOSA-N 392.528 5.335 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 609967830 JXEIMARDUBGZBV-MRXNPFEDSA-N 388.433 5.508 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(C)cc(Br)cc1C 615508303 PATGJVLNAPHEDL-UHFFFAOYSA-N 391.284 5.425 30 20 GKED O=C(C[C@]12CCCC[C@@H]1C2(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 619129972 VMOKSLXNKMQXNA-WCQYABFASA-N 395.334 5.372 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N[C@H](c1ccccc1OC(F)F)C(F)(F)F 626391401 VTEZIQLLXAKJGI-GFCCVEGCSA-N 399.262 5.160 30 20 GKED C=CCN(C(=O)c1ccc(-c2cccs2)nc1C)c1nc2c(s1)CCCC2 648023010 FRWFUEKWRHGDGL-UHFFFAOYSA-N 395.553 5.287 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@H]1CC[C@H](C(F)(F)F)C1 671817375 HEQRHMPWBYSQBD-WPRPVWTQSA-N 375.259 5.258 30 20 GKED Fc1cc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 678207831 FMLVMCQRQUGLJM-GHMZBOCLSA-N 397.256 5.407 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)n1 728299992 WTVNXWYGOHSGED-OAHLLOKOSA-N 394.450 5.175 30 20 GKED N#CCOc1ccc(CSc2nc(-c3cccs3)nc3ccccc23)cc1 731158755 HZUNBRBSVAYUTC-UHFFFAOYSA-N 389.505 5.553 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cccc(OCc2ccccc2C#N)c1 731320845 ZUZMJGWKWYQTLF-SEYXRHQNSA-N 399.494 5.428 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1nccn1Cc1ccccc1 734094852 HXKNNUBOVASDFH-OUKQBFOZSA-N 385.492 5.259 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(Cl)c2Cl)cc1OCCCC#N 734979778 DPOVIYHPYRBIFJ-VQHVLOKHSA-N 390.266 5.581 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)CCC(=O)N3)cc1 741467355 KYKOSFRSSPMAAK-RIYZIHGNSA-N 383.447 5.143 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(C(C)(C)C)cc2)ccc1OC 743477178 PNFSSVSFMBGTII-UTKZUKDTSA-N 380.532 5.524 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1cccc2ccccc12)C1CCCC1)c1ccncc1 745828834 WEISCLHJYCQIAJ-RUZDIDTESA-N 399.538 6.006 30 20 GKED CC(C)CN(C(=O)c1ccc(-c2ccc(F)cc2)n1C)c1ccc(C#N)cc1 749219014 HDLZTLQKNFDKMM-UHFFFAOYSA-N 375.447 5.006 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1cc(SC)c(Cl)cc1Cl 760562417 JUEYKPJVJNGLDO-UHFFFAOYSA-N 384.259 5.119 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c(Cl)c1 769727441 AUAKLPCHFUBUKG-UHFFFAOYSA-N 384.826 5.074 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C=C2CCSCC2)cc1Cl 772232190 MZXNTVHRPBPXDJ-IBGZPJMESA-N 382.916 5.387 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CN(Cc2ccccc2)c2ccccc2)n1 772678683 ROSOVJYFVXRKKT-FQEVSTJZSA-N 389.524 5.150 30 20 GKED C=CCC[C@H](C(=O)O[C@H](C)c1nnc(-c2ccc(C)cc2)o1)c1ccccc1 778550926 FCBMCNJXVPAAHR-XLIONFOSSA-N 376.456 5.399 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccnc(SC(C)(C)C)c1 778721134 CJWTZECOMDRBQZ-CQSZACIVSA-N 385.558 5.619 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(C#N)s3)cc2Cl)c1 779594779 AAYREAVLLNLVJR-UHFFFAOYSA-N 379.872 5.336 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=S)Nc3ccsc3)c2)cc1 790305084 HXIDPHDNNKWCDG-UHFFFAOYSA-N 379.510 5.202 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(OC(=O)C[C@@H](CC#N)c2ccccc2)cc1 793579811 YNJYDAJOTFBLQW-GOSISDBHSA-N 394.471 5.051 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2CCC(F)(F)C2)cc1Cl 797831522 RZFHCAPZNMTVNR-KBXCAEBGSA-N 388.845 5.759 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(F)cc2OCCC(F)(F)F)cc1 800311264 FPWXIZQIJKOQIE-CYBMUJFWSA-N 382.357 5.060 30 20 GKED COc1ccc(CNc2ccc(OCc3cccc(C#N)c3)cc2)c(C)c1OC 809636230 SKNWHVMQVVBNQJ-UHFFFAOYSA-N 388.467 5.075 30 20 GKED CC(C)(C)OC(=O)NCC1CCC(N[C@H](CCCC#N)c2ccccc2)CC1 814304210 IGHOHTSDAKJEPF-DQVLVPHSSA-N 385.552 5.095 30 20 GKED N#CCCCOc1cccc(N[C@H](c2nc(Br)cs2)C2CC2)c1 817581697 WDCGGTOVGYYCKM-INIZCTEOSA-N 392.322 5.151 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)CCCC1 838280355 OZWXGSYKKHOIAR-UHFFFAOYSA-N 398.528 5.316 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(C2CCCCCC2)no1 848705295 OGXPMBXLQBBWAA-MRXNPFEDSA-N 376.501 5.157 30 20 GKED N#C[C@H](C(=O)CC[C@@H]1CC1(Cl)Cl)c1nc(-c2ccc(Cl)cc2)cs1 850763256 XMBYBDVGOGYMEK-DGCLKSJQSA-N 399.730 5.614 30 20 GKED N#C[C@H](C(=O)C[C@]12CCCC[C@H]1C2(F)F)c1nc2cc(Cl)ccc2s1 850771587 SVQBMPPRSRHZBH-RGYTYGDFSA-N 380.847 5.342 30 20 GKED CC(C)CN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 914510336 DDUIWJYKGFHJQP-UHFFFAOYSA-N 393.487 5.208 30 20 GKED CCCCCCCCCNC(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 919654887 NANCERMSFRXHLV-OKILXGFUSA-N 390.412 5.509 30 20 GKED O=C(O)c1cccc(C=NNc2ccc(OCc3ccccc3)cc2)c1Cl 1776093158 BHXMBXLAYIXBPO-UHFFFAOYSA-N 380.831 5.063 30 20 GKED Cc1cccc(NN=Cc2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c1Cl 1776106734 RVZIJUORJHDEMW-OAQYLSRUSA-N 394.858 5.299 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccccc1Oc1ccc(Cl)c(Cl)c1 1776148934 RKOSKNKMKFZISE-AWEZNQCLSA-N 380.271 5.295 30 20 GKED C=CCc1cc(C)c(OCCCN2[C@H](C(=O)O)CC[C@H]2c2ccccc2)cc1C 1776188994 TZPSXHNHURAIID-GOTSBHOMSA-N 393.527 5.091 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cs1 1776280385 CNKLGPHPXXLBIA-XQRVVYSFSA-N 389.473 5.389 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1Cl 1776353571 CBENEFOMSVOQHA-ONEGZZNKSA-N 385.268 5.436 30 20 GKED CC(C)Oc1ccc(F)cc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776358490 CNOYDICNPOUKNQ-VQHVLOKHSA-N 394.398 5.467 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)c2cccc(C)c2C)c1 1776788127 SXBXYKNBTJCODB-QHCPKHFHSA-N 383.532 5.568 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1777033443 ZHZYNOFDHZAQBI-BENRWUELSA-N 391.492 5.071 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1791243587 WGIRHIMNYVCCDU-HNNXBMFYSA-N 396.453 5.065 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)c3ccc(C(C)C)cc3)CCC2)cc1 1791588168 HZNDZZJZFMWFSC-UHFFFAOYSA-N 376.500 5.134 30 20 GKED COc1ccc(/C=C2\CCCc3c2nc2ccccc2c3C(=O)O[C@H](C)C#N)cc1 6034673 CJYSQSWORBYDJY-WDMNMGCXSA-N 398.462 5.189 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nc3sc(C)c(C)c3c(=O)n2C(C)C)cc1 7437112 CYHACDQFFJORFO-QGZVFWFLSA-N 397.569 5.191 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2ccccc2)cc1 10173335 WMFLUYZCUFENKT-UHFFFAOYSA-O 381.546 5.012 30 20 GKED N#Cc1ccc(CCC(=O)N(Cc2cccs2)c2ccc(F)cc2F)cc1 55751751 XBHQWBDAMQXVCI-UHFFFAOYSA-N 382.435 5.064 30 20 GKED N#CC1CCN(c2nc(-c3ccsc3)nc3sc4c(c23)CCCC4)CC1 60874503 HYYRNQAEKJXFSJ-UHFFFAOYSA-N 380.542 5.039 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(Cl)cc2F)cc1 98065725 AUISRTXOIXBVEH-UHFFFAOYSA-N 396.874 5.895 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(C#N)CC2)c(C(F)(F)F)c1 105027313 HOWKHOANOADUKQ-GFCCVEGCSA-N 385.455 5.363 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3S[C@H](C)CC#N)c2cc1C 109323627 KWJBOQOIRCIXPK-MRXNPFEDSA-N 378.497 5.416 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(C)n(C3CCCCC3)c2C)cc1 111184649 VMRFMIQEHRXHLW-UHFFFAOYSA-N 393.531 5.569 30 20 GKED N#C[C@H](C(=O)/C=C/c1nc2ccccc2s1)c1nc2cc(Cl)ccc2s1 119980687 JXBRWWBNOFRFRD-WAFBPQNNSA-N 395.896 5.449 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)s1 120019214 GERVHEOGRJKLMN-GFCCVEGCSA-N 388.901 5.159 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(N3CCc4sccc4C3)cc2)cc1 127594428 NXLMFJMLBZNDML-KRWDZBQOSA-N 389.524 5.214 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2[C@H]3CC[C@H]2CC(O)C3)c1 152986386 ALPWDIVGCFHCKI-SFTDATJTSA-N 388.552 5.083 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1 160480259 KSGSTFJHNDUXOP-CQSZACIVSA-N 394.359 5.220 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(COCc3ccccc3)cc2)c1 176008049 ULHJQHFIPWGKQY-UHFFFAOYSA-N 388.492 5.271 30 20 GKED Cc1cccc(-c2nn(Cc3ccccc3)cc2CNCc2cccc(C#N)c2)c1 237880985 TYWOMPQRKAIOJE-UHFFFAOYSA-N 392.506 5.068 30 20 GKED CCN(C(=O)Cc1csc(-c2ccc(C)cc2)n1)[C@H](C)c1ccc(C#N)cc1 248059735 CWJPSJVVRGZZIA-QGZVFWFLSA-N 389.524 5.142 30 20 GKED O/C(=N/Cc1nc2cc(Br)ccc2o1)C12CC3CC(CC(C3)C1)C2 329192795 SFLCNNQHNRIANO-UHFFFAOYSA-N 389.293 5.263 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN([C@H]2CCc3ccc(F)cc32)C1)C1CCCC1 329388141 RFSIRKSIFDUKTJ-UWJYYQICSA-N 396.510 5.194 30 20 GKED CCC1(C(=O)N2CC[C@@H](/N=C(/O)C3(CC)CCC3)c3cc(OC)ccc32)CCC1 329598130 WIFWQBNBHATDHE-LJQANCHMSA-N 398.547 5.590 30 20 GKED O/C(=N/[C@@H]1CCO[C@H](c2ccccc2)C1)NC1CC(c2cccc(Cl)c2)C1 329744020 QKYJAEPBUYKASN-WDQDQHCCSA-N 384.907 5.010 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1CCCc2c(O)cccc21 330012843 LFWIVWUBKIDOQG-WOJBJXKFSA-N 379.504 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21 372772296 JVYTXEIMWCPQRF-OAQYLSRUSA-N 391.515 5.158 30 20 GKED Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)SCCC#N)cc3)sc2c1 413017597 ZHIPBQJMVHIIAA-CQSZACIVSA-N 381.526 5.246 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)(F)F)cc3)n2)cc1 429680016 GPPQOOZHWBPCGA-KRWDZBQOSA-N 382.435 5.720 30 20 GKED CCOc1cc2c(cc1NC(=O)c1sc3ccc(C#N)cc3c1C)O[C@H](C)C2 429905658 VNLCXYXDQASDLV-GFCCVEGCSA-N 392.480 5.056 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(C#Cc2ccccn2)c1)c1ccccc1 433142476 DKIQSAYUOPXISL-XMMPIXPASA-N 394.478 5.038 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(Br)cc2Cl)cc1C#N 435356254 WMLAVISSDSIIBE-UHFFFAOYSA-N 393.668 5.014 30 20 GKED N#Cc1cc(F)ccc1CSCc1nnc(-c2ccc(Cl)cc2Cl)o1 437271242 UERAZLPLUHEOOH-UHFFFAOYSA-N 394.258 5.488 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 437919322 YSEVIGUTTVZHOZ-HNNXBMFYSA-N 381.907 5.899 30 20 GKED CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438662469 DRPAIQFDDLAOTP-UHFFFAOYSA-N 389.430 5.544 30 20 GKED COc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@H](CCC#N)c1ccccc1 438859591 PTBHCTAYNPEDKE-NHCUHLMSSA-N 379.504 5.127 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)NCC3CCC(C#N)CC3)c2)C1 440920321 HUMARKRWEXVRHK-OGALPTFVSA-N 383.536 5.233 30 20 GKED C[C@H](SC1CCC(C(F)(F)F)CC1)C(=O)N(CCC#N)c1ccccc1 451041576 JXFXHZCXUYOTRG-UQPPLGOBSA-N 384.467 5.176 30 20 GKED C[C@H](CCCc1cccnc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 459408603 WZWVSCOZCFDSTA-IAGOWNOFSA-N 382.533 5.009 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)CSCc1ccc(C#N)cc1 468163906 IVFPRXKHXIDIJU-GOSISDBHSA-N 393.556 5.117 30 20 GKED CC[C@H](Cc1ccccc1)N(CC)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 469466522 KPPQRELKSGIWIF-JOCHJYFZSA-N 399.494 5.229 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471429498 XXWKVOGAQAXVEA-UHFFFAOYSA-N 390.874 5.350 30 20 GKED Cc1ccccc1CN(Cc1ccccn1)C(=O)C[C@@H](CC#N)c1ccccc1 475596517 RDVARLRQIVYTFF-JOCHJYFZSA-N 383.495 5.006 30 20 GKED COc1ccccc1[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 475764234 ZCZNWYFHYIQJAI-QHCPKHFHSA-N 384.479 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1csc2ccccc12 476790448 HLELDNONNPURPR-UHFFFAOYSA-N 391.536 6.355 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2nn(C(C)C)cc2c1 481217690 IBUULFFNCCYWRN-UHFFFAOYSA-N 388.924 5.552 30 20 GKED Cc1cccc(CCCSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 481939927 DARMGVLWKKDAJN-SFHVURJKSA-N 398.597 5.694 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(CS(=O)(=O)C(C)(C)C)cc1)c1ccccc1 488697691 DPUHBUUJPNWWKW-NRFANRHFSA-N 399.556 5.088 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(-c4ccccc4)c3)CC2)cc1 495589054 CKILUWMDAZOWBD-UHFFFAOYSA-N 379.463 5.546 30 20 GKED COc1ccc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(OC)c1 503226160 OZCSUMKSYOCXBR-UHFFFAOYSA-N 389.411 5.012 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CN(C(=O)Nc2cc(C#N)cn2C(C)(C)C)C2CC2)o1 508053281 JRJAXJFKBDMRIK-KSSFIOAISA-N 380.492 5.028 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)cc1 510457240 KUGGKBSAIHQSHP-GOSISDBHSA-N 385.467 5.253 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1)C1CC1 513899709 IHLPVQMUYKIOJZ-HNNXBMFYSA-N 399.441 5.035 30 20 GKED N#C[C@@H](C(=O)c1cccn1Cc1cccs1)c1nc2cc(Cl)ccc2s1 517306537 QVYLDHVDTNFJJZ-AWEZNQCLSA-N 397.912 5.351 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3ccc(Cl)s3)c2)cc1 517906090 IRRKPFGBTBDOTI-UHFFFAOYSA-N 383.860 5.387 30 20 GKED O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cccc(F)c1F 519192007 MHBMPHQTTZIETM-UHFFFAOYSA-N 399.237 5.020 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(-c3ccoc3)n2)n1 521720643 VMDUBLXPWBNMDO-UHFFFAOYSA-N 381.404 5.289 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)NCc1ccc(-c2csc(C)n2)cc1 522174156 CXYLZXWSRMBSHD-UHFFFAOYSA-N 395.503 5.155 30 20 GKED Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)c3ccc(C#N)cn3)nc2c1 523307146 AYBWKWOOYJYTMD-UHFFFAOYSA-N 398.491 5.027 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2cccc(CC#N)c2)nc1-c1ccccc1 525334436 VOZNXJOVYJRNLI-OAQYLSRUSA-N 399.494 5.508 30 20 GKED C[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1cccc(-c2ccncc2)c1 525859227 QLINNRHUZGNOSC-WZFBRQLOSA-N 398.510 5.056 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](c1ccc(C)cc1)c1cccnc1 537422514 IJBWZLPLKGDXIZ-DEOSSOPVSA-N 395.506 5.197 30 20 GKED COc1ccc(C#N)cc1CN[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 538323144 HIPREBCBDDGOQT-IBGZPJMESA-N 394.824 5.480 30 20 GKED CC[C@H](CSC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 539303861 DZUOOWHCYLMYBS-QAPCUYQASA-N 387.936 5.259 30 20 GKED CCN(C(=O)c1cc(C)n(-c2ccc(Cl)c(Cl)c2)n1)c1ccc(C#N)cc1 539654768 NUIPMTLNFGWJTP-UHFFFAOYSA-N 399.281 5.026 30 20 GKED C=CCCOCCCCC(=O)Nc1nc(-c2c(F)cc(F)cc2F)c(C)s1 540492601 VBTMHAASFXYOEY-UHFFFAOYSA-N 398.450 5.237 30 20 GKED N#CCC1CCN(C(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)s2)CC1 541050491 PXBNQKGVXGTRIV-UHFFFAOYSA-N 394.418 5.080 30 20 GKED Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(CC#N)CC2)cc1 541919132 TTYPNTQKXULDMO-UHFFFAOYSA-N 384.527 5.033 30 20 GKED Cc1c(Cl)cnc(N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1C#N 542278924 XFRSKEGEHCBJFJ-UHFFFAOYSA-N 387.270 5.094 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)C(=O)N1CCC[C@@H]1c1cccs1 543960162 XPCLUPIOQXEROC-IUODEOHRSA-N 376.934 5.117 30 20 GKED N#C[C@H]1N(C(=O)c2cc3sc4ccccc4c3s2)CCC[C@]12CCCCO2 548399956 FJWCLNSQTBREMP-WIYYLYMNSA-N 396.537 5.183 30 20 GKED CCc1nc(C)c([C@H](C)N(C)C(=O)c2sc3ccc(C#N)cc3c2C)s1 551408796 IDBGSJATTUINIS-ZDUSSCGKSA-N 383.542 5.242 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3ccc(C#N)c(F)c3)s2)cc1 553790927 IELFRMSVXWPHCJ-UONOGXRCSA-N 395.503 5.550 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)Nc1ccc(Cl)c(C#N)c1 554178848 GUOSCYLRGIDIPL-UHFFFAOYSA-N 389.814 5.174 30 20 GKED Cc1sc(C2(NCc3ccc(C#N)cc3F)CCC2)nc1-c1ccccc1F 559361864 YMRZXXCDZKXHLN-UHFFFAOYSA-N 395.478 5.437 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)C1(c2cccc(C#N)c2)CC1 584431317 FEWIIRBHXUMNPF-UHFFFAOYSA-N 381.479 5.149 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1N(C)C1CCCC1 591865485 PTQWGMJNXROPEG-QGZVFWFLSA-N 376.504 5.162 30 20 GKED CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)N1CCC(CC#N)CC1 597054598 GFCNVTCXKQHHBA-UHFFFAOYSA-N 391.846 5.238 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C[C@@H](C)C1(F)F 599731684 PQPINGMBAKPVOO-GASCZTMLSA-N 385.414 5.106 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C(C)(C)c1cccc(C(F)(F)F)c1 608896236 RCPHKVWOAUDALX-UHFFFAOYSA-N 386.417 5.069 30 20 GKED N#CCn1c(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc2ccccc21 609215673 IDRSUDHVZXPQAY-UHFFFAOYSA-N 378.646 5.377 30 20 GKED C[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1F 609426059 GHSKUJNZPGAMOU-QGZVFWFLSA-N 388.442 5.213 30 20 GKED Cc1ccc(OCc2nc(CS[C@@H](C)c3ccc(C#N)cc3)cs2)cc1 609825295 PPNBLSOOEUUYIO-INIZCTEOSA-N 380.538 5.897 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)C1 612241913 GZZUJFWNXUJFPC-OAQYLSRUSA-N 384.932 5.398 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(F)c(Cl)c2)cc1 726073869 ITPCJEXPKWWVET-LJQANCHMSA-N 393.849 5.456 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3sccc3SC(F)F)c2C#N)C1 730468617 BZXGMXFAKQVEAD-MRVPVSSYSA-N 384.498 5.373 30 20 GKED N#CCOc1ccc(COC(=O)CSc2cccc3cccc(Cl)c23)cc1 733386892 XWUOEQFCZRZFSM-UHFFFAOYSA-N 397.883 5.231 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2c1C 735035537 FHMFKAONCUTOJD-JOCHJYFZSA-N 379.463 5.693 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cc(-c4ccccc4)on3)cc2)c1 736016199 YYVNHQYXMIAQPN-UHFFFAOYSA-N 395.418 5.187 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cc(F)c(F)cc3Cl)c2)s1 739595400 IERANOMXGYKOTN-UHFFFAOYSA-N 388.826 5.148 30 20 GKED COc1cccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)c1OC 741845336 ZLCUPWIVDGXRSV-FLIBITNWSA-N 382.403 5.254 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1cc2cc(Cl)ccc2o1 743056031 AWVYJEYNQHDPSI-XVNBXDOJSA-N 376.799 5.565 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 744015131 GXGPCQUEPKOWKW-DEQJRXDXSA-N 380.369 5.533 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)[C@@H](C)c2ccccn2)s1 744747019 QKFZHKHUEVTUJN-HNNXBMFYSA-N 375.542 5.061 30 20 GKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1ccc(-c2ccncc2)cc1 745990248 PHNPROZUTXRWJW-KMKOMSMNSA-N 383.369 5.586 30 20 GKED CCN(CC)c1ccc2cc(C(=O)/C=C\c3cnc(C(C)C)s3)c(=O)oc2c1 758431305 WYIFOYSJVIEKCV-KTKRTIGZSA-N 396.512 5.115 30 20 GKED C[C@@H](OC(=O)C1(C#N)CCCCC1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 761115324 XXPYCBHQIQAMDC-LLVKDONJSA-N 394.258 5.122 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc4[nH]ccc4c3)n2)cc1 765938609 ZABPQRQOHIKKFY-KFILLSGMSA-N 399.475 5.190 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2cc(OC)c(OC)cc2F)cc1 766000648 FOFQDWSVFLXAHR-HUUCEWRRSA-N 393.886 5.386 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cncc(Br)c1 767363285 YLQFJNNYULZLNO-FPLPWBNLSA-N 385.286 5.172 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(Br)cc2F)c1 767735769 IIPLDYBEYNGLAG-RMKNXTFCSA-N 388.236 5.167 30 20 GKED COc1cccc(-c2nc(/C=C3\CSc4c(F)cccc4C3=O)cs2)c1 767911457 LCOCGKLBAYKEDE-MDWZMJQESA-N 383.469 5.330 30 20 GKED N#CCCCOc1cccc(CN2CCCCC[C@H]2C[C@H](O)c2cccs2)c1 770291016 GMJZUTKMBPEGJF-UNMCSNQZSA-N 398.572 5.299 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1CCCc1ccccc1 780671728 UDOBBCKWFGQVAW-CTNGQTDRSA-N 391.515 5.387 30 20 GKED Cc1ccncc1/C=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 783906258 GWUGKVJCOJNVPX-CLNPQZTCSA-N 387.870 5.351 30 20 GKED C[C@@H]1CCc2ccc(Br)cc2[C@@H](NCc2ccc(OCC#N)cc2)C1 794809680 HORIWVREVLFFRI-VFNWGFHPSA-N 399.332 5.155 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3nccc(C)c3c2)cc1 796791197 DAJOOBPAEOARGN-VFNWGFHPSA-N 385.467 5.018 30 20 GKED N#CC1(CCCSc2nc3c(Br)cccc3s2)CCOCC1 798371145 IJVQJTMNGYKILB-UHFFFAOYSA-N 397.363 5.251 30 20 GKED COc1ccccc1-c1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 806561006 QMVXCCOXUBNANR-OVWUPXBPSA-N 384.431 5.200 30 20 GKED O=C(/C=C\c1cncc(F)c1)O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809127764 LAHNFCSFLQKNDT-GESSGCQNSA-N 393.258 5.100 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)cc1Cl)c1cc(C(F)(F)F)ccn1 813213070 INFMEWGLJRTTQJ-ZDUSSCGKSA-N 387.188 5.216 30 20 GKED N#CCCC[C@H](NC(=S)Nc1ccc(SC(F)F)cc1)c1ccccc1 814209520 BJWNZEJRVJEGEM-KRWDZBQOSA-N 391.512 5.723 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1)c1ccccc1 819475134 HBWKYCMAGIITEV-PZJWPPBQSA-N 387.527 5.122 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1c[nH]c2cccc(F)c12 855929723 GHMYDOLMISEHET-UHFFFAOYSA-N 384.295 5.090 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1[nH]c(-c2ccccc2)nc1C 915110439 VDLBDPUYGKOIQW-UHFFFAOYSA-N 393.800 5.288 30 20 GKED O=C1CCc2cc(C(=O)/C=C\c3csc(-c4ccc(Cl)cc4)n3)ccc2N1 915993657 VVEUHEGPSXJZLA-CLFYSBASSA-N 394.883 5.244 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 916905742 PDQRSWVSQMRWQR-OAQYLSRUSA-N 398.462 5.563 30 20 GKED C[C@H](NCc1sc(Sc2ccccc2)nc1Cl)c1ccc(C#N)cc1 917427829 MZAOOPPJQUUNFS-ZDUSSCGKSA-N 385.945 5.670 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 918034653 SXVXHAQJYUKBJU-JWQCQUIFSA-N 395.506 6.020 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCOc2cccc(F)c2)cc1 918322551 FNNYWRJQRVDTDS-HSZRJFAPSA-N 388.442 5.279 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccccc3)CCC2)cc1 920059970 BMVTVELLBRTCBL-HSZRJFAPSA-N 381.479 5.543 30 20 GKED CCOc1cccc(C=Nc2cccc(COCc3ccc(OC)cc3)c2)c1O 921138367 HEOUNSNHKSHBMJ-UHFFFAOYSA-N 391.467 5.267 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\Cc3cc(C)ccc3C2=O)cs1 921270844 ZXSGSBLFQQQIDZ-LFIBNONCSA-N 392.455 5.098 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)cc1F 1776073370 RKXDULJKLMQETL-UHFFFAOYSA-N 393.201 5.537 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1c(Cl)cccc1Cl 1776354798 YLSVJOCJKMWVBF-BQYQJAHWSA-N 379.239 5.375 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1csc(C(F)(F)F)c1 1776355258 ZDDVSMADSWYVOU-HYXAFXHYSA-N 384.375 5.148 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2cccc(F)c2)c1 1776788118 SEGBYIMQCQMRPD-QFIPXVFZSA-N 387.495 5.481 30 20 GKED COc1ccc(-n2c(SCc3cccc(C#N)c3)nnc2-c2ccccc2)cc1 11196941 YGQODIUIZPHMHM-UHFFFAOYSA-N 398.491 5.107 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc3scc(-c4ccccc4)c3c(=O)[nH]2)cc1 12808913 GWTUKVRPRDVHJL-YVLHZVERSA-N 389.867 5.260 30 20 GKED C=CCN(C(=O)c1cc(C)nc2ccccc12)c1nc(-c2ccccc2)cs1 14724027 OUTBKOVKHIPMMR-UHFFFAOYSA-N 385.492 5.500 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1 14905807 XVKOITXJNLQCBE-UHFFFAOYSA-N 380.403 5.408 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2c(CC)cccc2CC)nc2ccccc21 29575412 NLYMLZSIBSYTCN-INIZCTEOSA-N 393.556 5.466 30 20 GKED C=CCN(Cc1nnc(-c2ccc(Cl)cc2)o1)Cc1ccc(Cl)s1 60471721 PLOCOYJCWOZOFV-UHFFFAOYSA-N 380.300 5.293 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCOc1cccc(Cl)c1Cl 65839634 BZAUORFJQJQLSH-UHFFFAOYSA-N 393.270 5.060 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1)C1CC1 66800291 KJAFGQFCCXSVLU-QGZVFWFLSA-N 393.556 5.317 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1cc(F)ccc1F 66956082 CUDJUAVBOMDAKZ-KBPBESRZSA-N 389.471 5.584 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 108238396 KZXBSXIYKCDXBJ-GFCCVEGCSA-N 389.318 5.262 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCc1c[nH]c2ccccc12 108529833 IQCHZKNTXOQCJH-MRXNPFEDSA-N 392.528 5.174 30 20 GKED Cc1ccc(C[C@@H](NCc2cccc(OCCCC#N)c2)c2ccccn2)cc1 115627362 GWIHCVVOVIDHNH-RUZDIDTESA-N 385.511 5.146 30 20 GKED Cc1cc(Br)oc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 120060412 MZMICFJDLHGIIP-SECBINFHSA-N 395.665 5.104 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)c1ccc(F)cc1C(F)(F)F 134407138 WJPDAOGRIJGGFM-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2nc3ccccc3o2)cc1 152389770 PHWCGFHAANHACO-UHFFFAOYSA-N 383.407 5.077 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 160057067 KRNPJACFOCNIRS-UHFFFAOYSA-N 392.377 5.258 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc(C(F)F)c1 171560798 LGHWKJIEPRRQCZ-UHFFFAOYSA-N 392.405 5.636 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](C)Sc2ccnc3cc(Cl)ccc23)n1 175081260 BHHDQKCAMLMWNJ-FZMZJTMJSA-N 387.917 5.010 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F 175778676 LBNXJKIZZGFWTR-NSHDSACASA-N 382.382 5.349 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(OC)cc1 178710075 QCOJGKKDQHYNST-PBHICJAKSA-N 397.425 5.200 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1 180021665 SBUPDWRERWAXBA-PGRDOPGGSA-N 397.478 5.157 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(N2CCOC2=O)cc1 180220802 GXMCTPSQNWTJQX-GOSISDBHSA-N 397.478 5.033 30 20 GKED C=CCC[C@@H](CCC)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 186468745 YODPCLIDXWTUFC-MRXNPFEDSA-N 382.470 5.035 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)cc1)c1ccccc1 190883222 IUXGABOTZZDJKX-LAUBAEHRSA-N 393.446 5.260 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](COC)c1ccc(F)c(F)c1 191518253 AYEVCOBHWNUDQZ-HXUWFJFHSA-N 388.458 5.326 30 20 GKED COc1ccc(-n2c(SCCCCC#N)nnc2-c2ccccc2)cc1Cl 195534031 BBHRKPWRCGMMCT-UHFFFAOYSA-N 398.919 5.382 30 20 GKED C[C@H](c1ccc(OC(F)(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303724226 WWIBBGMXGONLAL-SECBINFHSA-N 395.265 5.463 30 20 GKED C=CCCCN(C)C(=O)c1ccccc1Sc1ccc(Br)cn1 303948030 ZUJBOXLSITUIBM-UHFFFAOYSA-N 391.334 5.034 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](C)c1cc2ccccc2s1 328812469 NBVMNZATKDFQDE-IUODEOHRSA-N 386.542 5.626 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1cccc(N2CCC(C)CC2)c1 328827436 IKJHLMAMSVQVOK-KRWDZBQOSA-N 399.560 5.218 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@@H](C)CC3)n1 410988901 TUSAGZPHFSBDOI-WDEREUQCSA-N 388.924 5.125 30 20 GKED CCc1sc(-c2nnc(CN[C@H](CCCC#N)c3ccccc3)o2)cc1C 433018787 GGNOHTRPHOMXMI-QGZVFWFLSA-N 380.517 5.194 30 20 GKED C[C@H]1CCC[C@@H](C)N(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 437745004 LQTUWEGTCUEYBK-RBUKOAKNSA-N 391.515 5.374 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@H](CCC#N)c3ccccc3)sc2C)cc1 439668650 BKYPCTULELIJAW-OAQYLSRUSA-N 390.508 5.507 30 20 GKED N#Cc1cccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1F 444736860 POQMIBAENFALDD-OAHLLOKOSA-N 390.302 5.499 30 20 GKED CC(C)n1c(S[C@@H]2CC[C@@H](C#N)C2)nnc1-c1ccc(Cl)cc1Cl 450592932 HYSQVUPAXMTXSK-DGCLKSJQSA-N 381.332 5.617 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](Sc2ccccc2F)c2ccccc2)cc1C#N 460104215 AGTCRAKQFYZXJQ-NRFANRHFSA-N 387.439 5.041 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1cncc2ccccc12 462484673 SWJSZRYCLBWEBS-INIZCTEOSA-N 375.497 5.200 30 20 GKED Cc1nc(C)c(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 465394333 JEPYUAGZVROZPA-UHFFFAOYSA-N 383.860 5.330 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1CCc2c(O)cccc21 466103568 WAFHUPLLKRTZHQ-JOCHJYFZSA-N 399.450 5.174 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 466684019 QMEKPZQCZWNTJY-HNNXBMFYSA-N 397.466 5.053 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2cnccc2-c2ccccc2)o1 468125531 GGZDFEYRVGPZAA-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C=CCCCCNC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 474099081 XKAPBTAYBNAGFI-IBGZPJMESA-N 381.520 5.668 30 20 GKED CC(C)(C#N)CC(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 478621848 GXEKPAUMJDGORD-KRWDZBQOSA-N 379.891 5.009 30 20 GKED COc1ccc(Oc2cc(CN[C@H]3CCCCc4cc(C#N)ccc43)ccn2)cc1 481913308 FGJBQJPGJXJRCT-DEOSSOPVSA-N 399.494 5.311 30 20 GKED C[C@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 487455071 LYDJTGOBIYEYTR-LIRRHRJNSA-N 375.299 5.648 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccccn1 488901216 LUDNPZXGZGCHFY-INIZCTEOSA-N 392.528 5.013 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2coc3ccccc23)cc1Cl 499425915 YSOFNRLDDRZRQZ-IBGZPJMESA-N 386.838 5.994 30 20 GKED COc1cc(C)sc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 504755719 KCEVOFPNBXMYJP-KRWDZBQOSA-N 396.899 5.626 30 20 GKED CSc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 505297553 ITXYQBNZNQMODE-LSDHHAIUSA-N 385.558 5.543 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sc(C)cc1OC(F)F 510196790 IDYRNKFKRQKFOX-UHFFFAOYSA-N 377.865 5.201 30 20 GKED Cc1occc1CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 510620682 YDMHYIDCMGQFTR-UHFFFAOYSA-N 395.846 5.569 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1c1ccccc1 510874229 JORGTLLPOUDYRI-DEOSSOPVSA-N 397.478 6.028 30 20 GKED Cc1nn(-c2ccccc2)cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 511652705 GWVNFAXFXZYWCX-UHFFFAOYSA-N 393.450 5.048 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1cccc(C(F)(F)F)c1 519413458 WVFGVLLWQIWQCT-CYBMUJFWSA-N 394.418 5.117 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N1CCC(C#N)CC1 519847033 MPHDJLVDBBEACM-UHFFFAOYSA-N 394.475 5.178 30 20 GKED N#CCCSc1ccccc1NC(=O)CSCc1ccc(Cl)cc1 520804622 WEIUHMGYPAPXKC-UHFFFAOYSA-N 376.934 5.218 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(Br)s3)c2)cc1 521493572 BKNCXMUUNQSXAT-UHFFFAOYSA-N 399.269 5.427 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](Cc1ccccc1)c1ccccc1 521696195 JFMAXMHSHNIOMD-RUZDIDTESA-N 395.506 5.240 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccccc3OCC3CC3)cc2)c1 524387508 IROCQQWZIKXAHE-UHFFFAOYSA-N 398.462 5.178 30 20 GKED Cc1cc([C@@H](NC(=O)c2cccc(CC#N)c2)c2ccccc2Cl)ccc1F 525076325 GKZFNBIXGWODCH-JOCHJYFZSA-N 392.861 5.373 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)cc2F)c2cc(F)ccc2F)c1 525689165 CRPGUVBSWRYKNE-QFIPXVFZSA-N 398.453 5.577 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 538434616 QELOIBGDQPMLNV-JKSUJKDBSA-N 378.419 5.047 30 20 GKED CCN(C(=O)CCCc1nc2ccccc2s1)c1ccc(C#N)c(Cl)c1 539175594 NTCQVNAIAWRKNP-UHFFFAOYSA-N 383.904 5.197 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C)o2)nnc1-c1ccc(C(C)(C)C)cc1 540001116 DCUSLLGGWMPHEX-OAHLLOKOSA-N 382.533 5.578 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H]1c1nc2ccccc2n1C(C)C 540499383 GNUFCRQXFFHMQY-OAQYLSRUSA-N 383.536 5.044 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cncnc3-c3ccccc3)cc2)c1 541218213 KAPHOPHHDVZLCZ-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#C[C@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1cccc(Cl)c1Cl 541221672 LKBOMKOPQGFZHH-MGULZYLOSA-N 393.236 5.433 30 20 GKED N#CCC1CCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)CC1 541973341 QICPYZBHSHZUBO-UHFFFAOYSA-N 383.879 5.077 30 20 GKED CCCc1c(C(=O)Nc2sc3c(c2C#N)CCCC3)cnn1C1CCCC1 542196717 QNQCKOAIEIECEZ-UHFFFAOYSA-N 382.533 5.015 30 20 GKED Cc1nc(Cc2noc(-c3ccc(Sc4ccccc4C#N)cc3)n2)cs1 545529670 IFCXGQPHPDHRIF-UHFFFAOYSA-N 390.493 5.115 30 20 GKED N#Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1Cl 547951616 SPNFVEUNUKLQFA-UHFFFAOYSA-N 390.830 5.108 30 20 GKED COc1ccc([C@H](CCC#N)Nc2cnn(Cc3ccc(Cl)cc3)c2)cc1 564314753 FIRXWDLCQYUNCZ-NRFANRHFSA-N 380.879 5.050 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCO[C@H](c2ccccc2C(F)(F)F)C1 566757398 GXJKQKGEGGKNTR-FQEVSTJZSA-N 388.433 5.080 30 20 GKED C=CCN(C(=O)c1coc2ccc(C(C)C)cc12)c1nc(C(=O)OCC)cs1 577675003 DKJIABJYDMHFEX-UHFFFAOYSA-N 398.484 5.022 30 20 GKED N#Cc1cccc(-c2cc(-c3nc(CSc4ccc(Cl)cc4)no3)on2)c1 577678880 LILPLAJJIYFHOG-UHFFFAOYSA-N 394.843 5.209 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)o1 589541923 VNHYZTNRGZCUNQ-BTYIYWSLSA-N 387.439 5.033 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)C1 597913564 MPKGEMQXFGGIOG-SNVBAGLBSA-N 386.826 5.339 30 20 GKED N#Cc1c(NC(=O)CSCc2cccc(Cl)c2)sc2c1CCCC2 600841054 HVTYHKWPGFCJFB-UHFFFAOYSA-N 376.934 5.024 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@H]1C 610019260 JYFUSXZQEIOBMA-LSDHHAIUSA-N 383.492 5.229 30 20 GKED CC[C@H]1CCCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 610093407 ITUVRSPOOBTEMI-QFIPXVFZSA-N 391.515 5.518 30 20 GKED CC(C)[C@H](Sc1ccc(C#N)cc1F)C(=O)Nc1cccc2ncccc12 610218705 KKIABYUYHPUVMI-FQEVSTJZSA-N 379.460 5.001 30 20 GKED N#Cc1ccc(C(F)(F)F)c(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 613873624 AJKZZUJRSLXVOF-NXEZZACHSA-N 390.249 5.144 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)NC(C)(C)CC(F)(F)F)cc1 614897271 CXTZIEKTOWCKMG-UHFFFAOYSA-N 376.378 5.120 30 20 GKED Cc1noc(C(F)F)c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 673812085 PHWGIAWRHMEMEZ-NSHDSACASA-N 393.802 5.188 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)C2CC2)o1 726457245 LASUOJNRTQJNBY-SJCJKPOMSA-N 385.920 5.289 30 20 GKED CC(C)COc1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 730398163 FYIHRSSRTAOBNG-FQEVSTJZSA-N 390.508 5.264 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2cccc(F)c2)cc1 734965978 RWKUEMUDBUYGJV-QYWGDWMGSA-N 380.463 5.180 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nc2ccccc2n1C(F)F 735230878 STYYRKLFTLALQH-UHFFFAOYSA-N 379.819 5.279 30 20 GKED CN(C)CC1CCN(c2ccc(N=Cc3c(O)ccc4ccccc34)cc2)CC1 737442992 FYOWOLKPHUPGFE-UHFFFAOYSA-N 387.527 5.074 30 20 GKED Cc1ccc(O[C@@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 743093905 ZKLLOCQBTBENLY-CYFREDJKSA-N 399.494 5.240 30 20 GKED Cn1c([C@@H](C#N)C(=O)C2(Cc3cccc(Cl)c3)CCCC2)nc2ccccc21 744010923 SYIRWUXXMBVIKO-SFHVURJKSA-N 391.902 5.206 30 20 GKED Cc1cc(-c2noc([C@H](C)ON=Cc3cccc(Cl)c3Cl)n2)ccc1F 744443297 KCKUGAGXWJEPGL-NSHDSACASA-N 394.233 5.603 30 20 GKED C[C@H](OC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1ccc(C#N)cc1 748680798 UFQVJYAHYUZZSU-AWEZNQCLSA-N 396.899 5.106 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C\SCc2ccco2)cc1 754223217 GPAKGQFVBMPNMR-QBFSEMIESA-N 376.437 5.329 30 20 GKED CCSc1cccc(C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)c1 764567279 KSUIAHWJEDMMOS-INIZCTEOSA-N 393.295 5.067 30 20 GKED CC(C)(C)OC(=O)C1CCC(=NNc2ncc(C(F)(F)F)cc2Cl)CC1 768357570 NYMHHGBKQHUPNZ-UHFFFAOYSA-N 391.821 5.054 30 20 GKED COc1cc(/C=C(/C(=O)OCCCCC(C)(C)C#N)c2ccccc2)ccc1O 768597453 KKOYUMGGUWNDIN-HMMYKYKNSA-N 393.483 5.205 30 20 GKED C[C@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 776083825 CILMSLOKIAVSPK-DYESRHJHSA-N 399.519 5.517 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)cc1F 776729962 XUMOVIPKBRVYCZ-YVMONPNESA-N 398.846 5.282 30 20 GKED N#CCOc1cccc(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 779586286 SLXLPNYNXKSHKM-UHFFFAOYSA-N 389.402 5.343 30 20 GKED CC(Cc1ccn(C(C)C)n1)=NNc1nc2cc(C(F)(F)F)ccc2s1 782907265 SQIDLSGYZNYVJM-UHFFFAOYSA-N 381.427 5.123 30 20 GKED C=CC[C@H](NC(=O)[C@@H](CC)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 786185351 MYMNTVRBMSWFQK-LPHOPBHVSA-N 376.422 5.103 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2cc(F)ccc2F)C(C)C)ccc1OC 794808799 CLICFVMSLATIJK-VGSWGCGISA-N 388.458 5.141 30 20 GKED O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)[C@@H](F)C(F)(F)F 815121302 JNWFLSCROAMLLV-CYBMUJFWSA-N 381.247 5.337 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1c(F)ccc(SCC2CC2)c1F 839321791 PHBHMPNSFLLBJN-GFCCVEGCSA-N 388.439 5.010 30 20 GKED CCO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 860475869 VUKGRHPPWKYFBD-CXAGYDPISA-N 395.311 5.108 30 20 GKED COc1ccc(COc2cccc(F)c2)cc1NCc1cccc(F)c1C#N 864009183 UWFKDUDKQGADNS-UHFFFAOYSA-N 380.394 5.036 30 20 GKED CCc1oc2ccccc2c1C=NOCc1coc(-c2ccc(OC)cc2)n1 874046710 IDASWHOUPDDIIU-UHFFFAOYSA-N 376.412 5.210 30 20 GKED O=C(c1nc(-c2ccccc2)cs1)N1CCCSC1=Nc1ccccc1 915807044 ZPSOMMJPKCAYBH-UHFFFAOYSA-N 379.510 5.077 30 20 GKED COc1cc(Br)c(/C=C\C(=O)c2ccc(SC)cc2)cc1OC 916133454 PWYQJCHQGISITC-TWGQIWQCSA-N 393.302 5.084 30 20 GKED Cc1c(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2)oc2ccc(Cl)cc12 916882755 JWRMVDPVJXAYQU-OAHLLOKOSA-N 387.222 5.009 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccnc2SC(F)F)cc1 919825567 NAPYKZAZUZTPIP-UHFFFAOYSA-N 397.406 5.313 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(Cl)c(Cl)c3)cc2)cc1 921010078 FJCHUHCPAHBWQA-UHFFFAOYSA-N 384.222 5.305 30 20 GKED O=C(O)c1cc(NN=Cc2ccccc2Oc2cccc(F)c2)ccc1Cl 1776034363 CDYXMSOSMYQWIA-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1cc(F)ccc1SC(C)(C)C 1776063060 YUKPRQOPWAALIO-UHFFFAOYSA-N 378.444 5.390 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776801343 LCMMHBLVNBIHAL-MLPAPPSSSA-N 390.435 5.720 30 20 GKED COc1ccc2ccnc(C(=O)/C=C\c3csc4ccc(C(=O)O)cc34)c2c1 1777374377 PTTFHQNHWGQBHZ-UTCJRWHESA-N 389.432 5.052 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cnn(-c4ccccc4)c3)cc2)cc1 1777671206 SVWMVEVMGZUFFM-NVNXTCNLSA-N 394.430 5.134 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2ccccc2SC)nc2ccccc21 12046033 YGNMQUYUMWSZMH-AWEZNQCLSA-N 383.542 5.064 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccc(Cl)cc3)c2)cc1 23776611 IIPVHTBWMVBLPO-AWNIVKPZSA-N 386.838 5.360 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc1 29153282 SMTAHTHLXKGOOY-UHFFFAOYSA-N 393.874 5.367 30 20 GKED N#C[C@H](C(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)c1nc(-c2ccc(Cl)cc2)cs1 41514452 JJOLIBVQVBFBHM-KJFZJZGVSA-N 398.915 5.035 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2oc3ccccc3c2COc2ccccc2)n1 41521261 JEUYZUFIKZAAPC-KRWDZBQOSA-N 388.448 5.267 30 20 GKED CCOc1ccccc1CCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 41534393 QPOAXTCPEMSYNC-SFHVURJKSA-N 376.481 5.018 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)cc1Cl)c1nc2ccccc2n1C(F)F 41558797 GOOLNLVXSKUBGM-GFCCVEGCSA-N 394.208 5.157 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCC2)c1nc(-c2ccc(Cl)cc2)cs1 60488324 HZTZSZFIQIORSJ-AWEZNQCLSA-N 384.913 5.504 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NCC(=O)Nc1ccc(CC#N)cc1 63472166 YTNOXOQGGWBWIM-UHFFFAOYSA-N 387.508 5.263 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ncc(-c2ccccc2)o1 66800959 FLSMKEXRKRZGPJ-MRXNPFEDSA-N 391.496 5.307 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1ccc(F)cc1F 72030854 HVWZWGDEHLXOLI-AWEZNQCLSA-N 393.393 5.068 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCc2ncc(-c3ccccc3)o2)c1 102858484 HLEZYZZTKLZXKG-UHFFFAOYSA-N 396.446 5.082 30 20 GKED CCN(CC(=O)Nc1ccccc1Cc1ccccc1)[C@H](C)c1ccc(C#N)cc1 108718673 JTCCASVXFYNSOW-HXUWFJFHSA-N 397.522 5.171 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 108981828 OZICEYQFTKNDBV-ZDUSSCGKSA-N 379.460 5.329 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 110972602 LJIIYIYWQIMDQH-GZOXUHRPSA-N 377.440 5.741 30 20 GKED Cc1csc(-c2cccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)c2)n1 120541977 DGKUYDRIVOJPLF-IBGZPJMESA-N 376.485 5.285 30 20 GKED C=CCC(CC=C)C(=O)N1CCc2cc(OC)c(OC)cc2[C@H]1c1cccs1 121875320 PFFOHFCJHFHZTA-QFIPXVFZSA-N 397.540 5.008 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 122012504 KJNFGJNQEQONDX-INIZCTEOSA-N 381.888 5.472 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 174339029 AVTYZIFSAVLGLO-IBGZPJMESA-N 398.510 5.303 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(SCc2ccccc2)cc1 182049404 VWKIKLBFAVFAQL-KRWDZBQOSA-N 388.492 5.522 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc2ccccc2o1 182627521 ZRVCBTRYQHLNCM-CVEARBPZSA-N 393.512 5.116 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cccc(OCc3ccccc3)c2)cc1 303149616 CJDGLWZSCSVHRS-QZEGLACASA-N 383.447 5.453 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CCCC1 303319014 SZMHUESBQSKNCB-INIZCTEOSA-N 398.959 6.042 30 20 GKED C[C@H](S[C@H]1CCO[C@H]1C)C(O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328870929 YDTPTXSRLPYIMQ-DEYYWGMASA-N 377.506 5.005 30 20 GKED Cc1ccnc2sc(C(=O)N3CCC[C@@H](C(O)=Nc4ccccc4)C3)c(C)c12 329348661 CVFSTKHWEKWMJD-MRXNPFEDSA-N 393.512 5.054 30 20 GKED N#CC1(CC[S@@](=O)Cc2coc(-c3cccc(Cl)c3)n2)CCCCC1 417148460 CAASWLNEKXGVPP-RUZDIDTESA-N 376.909 5.108 30 20 GKED O=C(c1ccc(F)cc1C(F)(F)F)N(Cc1cccs1)CC(F)(F)F 429603672 GWNJPZBJKMLJJK-UHFFFAOYSA-N 385.304 5.111 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 431873803 AVQRNUXOJXSVMP-KUHUBIRLSA-N 390.314 5.789 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cccc(OCC(F)(F)F)c1 432678864 NEGHQTVALWKFSI-UHFFFAOYSA-N 381.247 5.038 30 20 GKED CC(=O)N(c1nc(COc2ccc(C#N)c(C)c2)cs1)c1cccc(C)c1C 434648833 PGXAOFJJEZDKGP-UHFFFAOYSA-N 391.496 5.204 30 20 GKED Cc1csc(CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)n1 435818236 MAKIFQGZMBBNOX-UHFFFAOYSA-N 395.915 5.143 30 20 GKED CSc1c(F)cccc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 436074345 HGWQJMZMAWZETI-UHFFFAOYSA-N 392.455 5.251 30 20 GKED CCOc1ccc(-c2nc(CN3CCC[C@H]3[C@H](C#N)c3ccccc3)co2)cc1 437575730 AWMJKCUPLXDWAR-PKTZIBPZSA-N 387.483 5.012 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 438863605 ZYLPOIFSFBXDJU-VQTJNVASSA-N 399.441 5.010 30 20 GKED C[C@@H](CC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 439669744 DOFZIEQCWUEWGS-KXBFYZLASA-N 385.305 5.104 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1ncc(C)s1)c1ccc(C(F)(F)F)cc1 440849392 XWCFDYYOOJLXOL-CZUORRHYSA-N 397.466 5.538 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC=C(c2ccc(F)cc2)CC1)c1ccccc1 458806371 WAXHBBFNMZWCJL-JOCHJYFZSA-N 377.463 5.060 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCCC[C@H]1c1ccncc1)c1ccccc1 458807641 XUWNSVCZWJHWJV-VXKWHMMOSA-N 376.504 5.143 30 20 GKED Cc1c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)sc2c1CCCC2 465108706 GZQYMKXZNOOQIC-UHFFFAOYSA-N 389.480 5.247 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H](c3ccccc3)CC2)c2ccccc21 468807907 CENSSCXVUJNNHN-NRFANRHFSA-N 385.511 5.355 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 474948552 BOEOFTBEMCKNOM-UZLBHIALSA-N 387.310 5.744 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ncc(-c2cccc(F)c2)o1 475181757 YUALAYWOZWZSAL-UHFFFAOYSA-N 386.386 5.152 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1cc(OC)ccc1OC 475543311 CPLDQQUNYSLCCM-UHFFFAOYSA-N 396.531 5.310 30 20 GKED N#CC[C@H](CC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccccc1 475640348 QPWBDGJEPSEFBM-GOSISDBHSA-N 382.454 5.324 30 20 GKED Cc1nc(-c2ccccc2NC(=O)CCCCOc2cccc(C#N)c2)cs1 477692415 KOOSFEVGPJDRFC-UHFFFAOYSA-N 391.496 5.178 30 20 GKED C=C(C)COc1cccc(NC(=O)N(CCC)[C@@H]2CCCc3cccnc32)c1 480638519 JHJNOGPEFSPIBL-OAQYLSRUSA-N 379.504 5.358 30 20 GKED CCCCn1ncc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1C(C)C 485191419 FUCGKCZMMZRESK-TZIWHRDSSA-N 393.535 5.110 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2cccnc2)c(C)c1 486251795 IYJOQLAHWAPGPK-UHFFFAOYSA-N 376.481 5.713 30 20 GKED O=C(Nc1nc2c(C(F)(F)F)cccc2s1)c1cc(F)c(F)c(F)c1F 489386500 HZJAYPJGJMMJDG-UHFFFAOYSA-N 394.271 5.124 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1c[nH]c2ccccc12 495095171 VGDCNEJHTRWYKX-HNNXBMFYSA-N 399.416 5.124 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 504125654 OTTCSCVVFSNUSQ-OAQYLSRUSA-N 375.859 5.317 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccsc2)s1)c1ccc(Cl)c(Cl)c1 505955347 VRONHMKFGBQQDN-CYBMUJFWSA-N 394.308 5.173 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3nc(-c4ccccc4)cs3)n2)c1 507948797 JIQVYKVOIYFSDH-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C=CCn1c(SC[C@@H](OC)c2ccc(Cl)cc2)nnc1-c1ccoc1C 509098795 LMTZOGXPWRUOPE-QGZVFWFLSA-N 389.908 5.166 30 20 GKED N#Cc1c(NC(=O)COc2cccc(Cl)c2)sc2c1-c1ccccc1CC2 511082949 PWRPWVAQWLBXJD-UHFFFAOYSA-N 394.883 5.056 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)c1ccccc1C#N 511354245 WMPBQZJSOIDMBL-UHFFFAOYSA-N 398.249 5.329 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 513355768 XTPHYJJVSWWSTA-QHCPKHFHSA-N 392.478 5.610 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 514575161 AGQPOWJTGGOELT-JOCHJYFZSA-N 399.881 5.438 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCC1(Sc2ccccc2)CC1 517569749 YEQDDTJLCLXRDU-UHFFFAOYSA-N 384.504 5.280 30 20 GKED N#CC[C@H](Cc1nc(Cc2c[nH]c3cc(Cl)ccc23)no1)c1ccccc1 518436997 SSFCIOBPLLLQPY-OAHLLOKOSA-N 376.847 5.035 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C[C@@H]3CCOc4ccccc43)cc2)c1 522718196 HNONWWMKZOVXNJ-FQEVSTJZSA-N 398.462 5.032 30 20 GKED C=CCOc1ccccc1CNCc1c(C)nn(Cc2ccc(Cl)cc2)c1C 525403856 COKTWWAQSFETAL-UHFFFAOYSA-N 395.934 5.056 30 20 GKED C=C[C@H](CC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 534662122 GTJHUWDLTYQTSV-OAQYLSRUSA-N 382.507 5.600 30 20 GKED COc1ccc(CNc2ccc(C(F)(F)F)c(C)c2)cc1OCCCC#N 537509599 PLFLAWHIVQGJPG-UHFFFAOYSA-N 378.394 5.317 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCC2CCOCC2)cc1Cl 539738780 JEEPUTBSQJVMMI-OAQYLSRUSA-N 396.918 5.531 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)cc1)c1ccccc1 539785145 FWDHSBOKQKFNSO-HNNXBMFYSA-N 375.859 5.637 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 542090963 RMTOENYABGELIW-ROUUACIJSA-N 384.483 5.084 30 20 GKED C=CCn1c(SCc2nc(C3CC3)cs2)nnc1-c1cccc(Cl)c1 542212447 FVLMTXCBTLBGSG-UHFFFAOYSA-N 388.949 5.411 30 20 GKED Cc1cc(-c2nnc(CN[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)o2)c(C)o1 543876877 HVLHESQLDJOEOU-MRXNPFEDSA-N 398.466 5.336 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CNC1(c2cccc(C#N)c2)CC1 551713026 VWZUPOGKSQHCSJ-UHFFFAOYSA-N 375.516 5.022 30 20 GKED C=CCN(C(=O)c1cccc([C@@H]2CCOC2)c1)c1nc(-c2ccccc2)cs1 556485405 GDWNRAIWKVHTBI-HXUWFJFHSA-N 390.508 5.147 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(N3CCCCC3)c3ncccc23)c1 557033326 CZGDQWQCNMXASP-UHFFFAOYSA-N 390.874 5.002 30 20 GKED N#Cc1ccc(CS(=O)(=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1F 559191825 KOOPFQSLTALGQZ-OAQYLSRUSA-N 399.874 5.055 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 561325507 DINATVVCBLGQHE-UHFFFAOYSA-N 393.446 5.246 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)ccc1OC(C)C 562202334 VAVOMGIKPOTHOE-AWEZNQCLSA-N 392.421 5.224 30 20 GKED C=C(C)Cn1c(SCc2nc([C@@H]3CCCC[C@H]3C)no2)nnc1-c1ccco1 562214903 ZIGBPFKRIOTDOW-HUUCEWRRSA-N 399.520 5.083 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1cccc(Cl)c1Cl)c1ccccc1 566539444 DCJQBEFGBTXUCZ-QGZVFWFLSA-N 376.287 5.228 30 20 GKED N#Cc1ccc(NC(=O)c2cc(F)c(Br)c(Cl)c2)c(Cl)c1 584297674 UCEFUTZIZHRSBU-UHFFFAOYSA-N 388.023 5.019 30 20 GKED CC(C)(C)C1=CCN(C(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)CC1 587986658 KWKDPQAZECVVNS-UHFFFAOYSA-N 399.966 5.023 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2SCc2cccs2)ccc1Cl 590648975 MEQXIKANWUKKLU-UHFFFAOYSA-N 384.913 5.818 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)s1 592974643 WDKHQGPLDPQDDC-AWEZNQCLSA-N 393.468 5.357 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 592974650 WIIOBOSHPLNIJG-CQSZACIVSA-N 393.468 5.357 30 20 GKED CC[C@H](C#N)C(=O)Nc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1C 593487192 OKAJCFAUFMJJKO-OAHLLOKOSA-N 378.451 5.220 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CCC[C@H](CC#N)C3)c(F)c2)cc1 596917389 ZRSQJUJFLWLKLG-QGZVFWFLSA-N 395.478 5.437 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3c(F)ccc4ccncc34)c2C#N)[C@@H](C)C1 598840738 ZDGICWBINPEJOZ-RYUDHWBXSA-N 379.460 5.245 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccc2ccccc2n1 604005399 BUBHXUBUNZTQRB-GOSISDBHSA-N 399.837 5.566 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCC(C)(C)c2ccccc21 608920646 WYRLAZIPKIEGTH-QFIPXVFZSA-N 375.516 5.291 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)c1 608948004 PCMDUOBNFXYYME-UHFFFAOYSA-N 386.842 5.202 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)c2cc3ccccc3n2CC#N)cc1 609175696 WMPHKBWDOVULBT-INIZCTEOSA-N 377.513 5.156 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 609222171 VRJVCBNHLJSFNZ-INIZCTEOSA-N 389.430 5.237 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](C)c1ccccc1C 609693646 BNKXWBKJULEMNY-QGZVFWFLSA-N 385.467 5.495 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 613404930 WYQWHAPCCMLALL-OAHLLOKOSA-N 388.414 5.929 30 20 GKED N#Cc1cc(Cl)c(C(=O)NC2CC(F)(c3cccc(Cl)c3)C2)c(Cl)c1 619544908 VGBJZZCKPQAKPP-UHFFFAOYSA-N 397.664 5.276 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619770463 VVVGQYHVRAIYOG-GFCCVEGCSA-N 395.812 5.133 30 20 GKED O=C(Nc1cc(Cl)cc(C(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 622519928 VVHMDLLKNNXDAP-UHFFFAOYSA-N 385.666 5.769 30 20 GKED COc1cccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C)cc4)cs3)oc12 642281259 UAEXZSPCWMCXAR-MRXNPFEDSA-N 388.448 5.363 30 20 GKED COc1ccc2c(c1F)CC[C@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 675638008 DAUHULBNTPGNOL-YAMSLAJTSA-N 399.350 5.321 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)C1CCC(F)(F)CC1 682732926 OCQYTDRMJUDMJV-DLOVCJGASA-N 381.351 5.700 30 20 GKED N#CCSc1ccccc1C(=O)NCC1(c2ccccc2)CCCCCC1 727396854 MRIPYYTXMOMBII-UHFFFAOYSA-N 378.541 5.324 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NCc1ccc(C#N)cc1 728123166 CDIBLEAIBDBHMI-SFHVURJKSA-N 385.467 5.328 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2oc3ccc(OC)cc3c2C)cc1OC 729149379 DJMRAJSEOSZETG-VQHVLOKHSA-N 396.439 5.062 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccc(-c3c(F)cccc3F)o2)SC1=S 734556108 JXONITFMRPJWSO-NVNXTCNLSA-N 377.437 5.002 30 20 GKED Cc1ccc(CN(Cc2ccco2)Cc2cc(Cl)ccc2OCC#N)s1 735310167 RTQAKHJMDCZHBA-UHFFFAOYSA-N 386.904 5.408 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1coc(-c2cccc(F)c2)n1 735317979 HVFOXFAWLBVQJG-UHFFFAOYSA-N 388.851 5.470 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNc1ccc(Cl)nc1 743449868 GTCBBYMBFXYERO-UHFFFAOYSA-N 394.693 5.041 30 20 GKED CC(=Nn1c(C)nc2scc(-c3ccc(Cl)cc3)c2c1=O)c1ccsc1 749099476 OYZCPMMEQPZSOX-UHFFFAOYSA-N 399.928 5.421 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=S)Nc1ccccc1-c1ccccc1 751008638 ZPHWEWGAZJNTMT-UHFFFAOYSA-N 383.520 5.610 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)CCCc2cc(Cl)sc2Cl)c1 756233682 NQGSJMXYZWZGSH-AWEZNQCLSA-N 395.311 5.034 30 20 GKED C=CCn1c(SCc2cc(Cl)nc3ccccc23)nnc1-c1ccoc1C 771750078 KOZUVTFIPATVHA-UHFFFAOYSA-N 396.903 5.526 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(SC(F)F)cc2)c1 772983527 JIQTTXLAJOOYBC-YOEHRIQHSA-N 376.472 5.533 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc(Cl)n1 778608045 WBXBRRPHYDTYIM-LLVKDONJSA-N 395.793 5.162 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 779105058 RLLFIAWFXUIRRO-VWNXMTODSA-N 390.914 5.900 30 20 GKED N#C[C@H](C(=O)CCOc1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 780327525 BVTZBBLTLOCPFY-HXUWFJFHSA-N 399.475 5.004 30 20 GKED N#C[C@@H](C(=O)COC(c1ccccc1)c1ccccc1)c1nccc2ccccc12 792094041 MJEBYICHOUUCKI-QHCPKHFHSA-N 392.458 5.217 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cc(Cl)sc2Cl)cn1 792868508 FUTBPCJJUHZABM-SREVYHEPSA-N 391.279 5.417 30 20 GKED N#CC[C@H](CC(=O)OCc1cc(-c2ccc(Cl)cc2)no1)c1ccccc1 795989390 FZBGFGLJKRRIMC-QGZVFWFLSA-N 380.831 5.126 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797571937 SAKMFWFISBIHOV-YPMHNXCESA-N 380.435 5.439 30 20 GKED Cc1csc([C@@H](C#N)C(=O)CS[C@H](c2ccccc2)c2ccc(F)cc2)n1 801660868 JFAKYAYCOVPKJS-AZUAARDMSA-N 396.512 5.290 30 20 GKED O=C(Nc1cccnc1)/C(=C\c1csc2ccccc12)C(=O)c1ccccc1 810237180 RAFIBPKZFREMJD-MOSHPQCFSA-N 384.460 5.201 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2cscc2C(F)(F)F)C(=O)c2ccccc21 811691296 NHGANWWCQUXXME-XKOZXHHJSA-N 380.387 5.084 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CCCC1)c1cc(C(F)(F)F)ccn1 813213093 HRCJKAKHVBFPIG-MRXNPFEDSA-N 392.808 5.442 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(F)c(N2CCCC2)c(F)c1)c1ccccc1 814616238 OIDWLYOADABIIN-FQEVSTJZSA-N 398.457 5.122 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](OC2CCC2)CC1 878675243 DTJUXIYDYDFMTC-AEFFLSMTSA-N 387.549 5.036 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc(-c2cc(OC)c(OC)c(OC)c2)no1 904669011 IGOSGQWCOMNKTO-SFHVURJKSA-N 394.471 5.251 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1F)c1nc2cc(C(F)(F)F)ccc2s1 917045573 YDYHTAYUPDQKGB-VGVVRCBHSA-N 390.361 5.344 30 20 GKED Cc1ccc(/C=C/C(=O)Nc2cccc(OCCCC#N)c2)c(Br)c1 917728479 SJTJGNZWEFSIQG-MDZDMXLPSA-N 399.288 5.092 30 20 GKED C=CCN(C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(C)C 920025129 OPMGXULOVINGBF-AWEZNQCLSA-N 378.925 5.040 30 20 GKED O=C(O)c1ccc(NN=C2CCCC[C@H]2c2cc(F)c(F)c(F)c2)cc1F 1776076515 SGFIXMVVKZQFDA-LBPRGKRZSA-N 380.341 5.067 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cs1 1776280430 JLAWCLIIAUBLQS-MLPAPPSSSA-N 391.492 5.702 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776339911 PSKOVSQPOAYPCR-DHZHZOJOSA-N 390.435 5.445 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(-c2ccccc2)ccc1OC 1776783719 FDXBBZOKXIRADW-QFIPXVFZSA-N 383.532 5.656 30 20 GKED CCCCCCCCCCCN(C)c1c(C(=O)O)cnc2c(OC)cccc12 1776787746 JUXSWGKAQZFIHC-UHFFFAOYSA-N 386.536 5.909 30 20 GKED CCCCCCCOc1cccc(/C=C/c2nc3c(s2)CCC[C@H]3C(=O)O)c1 1776789197 UNRDMGOMNUMDDD-JKIKYLSZSA-N 399.556 6.167 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CSc4ccc(F)cc4C3=O)s2)c1 1777684344 TYJZTNNTRZMATP-ZROIWOOFSA-N 396.464 5.624 30 20 GKED C=CCn1c(SCc2coc(-c3ccccc3)n2)nnc1-c1ccc(F)cc1 24295013 UXTXFEQOBYPBCB-UHFFFAOYSA-N 392.459 5.218 30 20 GKED N#Cc1ccsc1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 61112407 SORPSMLZDIYXRZ-UHFFFAOYSA-N 394.308 5.231 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2cccnc2)c(C)c1 63164735 NLJIFKOHKYZXQC-UHFFFAOYSA-N 391.446 5.542 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Oc2ccc(Cl)cc2)c2ccccc2)cc1 65719855 FQNPLFKORSIVBD-OAQYLSRUSA-N 376.843 5.165 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccccc2Oc2cccc(F)c2)cc1 65807908 GARKLNAGQIGWTA-UHFFFAOYSA-N 392.455 5.362 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1c(C)noc1C 66788874 RCKFFBUHAXXJOP-HXUWFJFHSA-N 375.428 5.088 30 20 GKED CC(C)OCc1ccccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 66954309 IYIQNNRECIJUEO-KRWDZBQOSA-N 397.544 5.328 30 20 GKED N#CCCCOc1cccc(CNc2cccc(-c3cn4c(n3)CCCC4)c2)c1 122066073 ITLFZGPIHJJZEZ-UHFFFAOYSA-N 386.499 5.181 30 20 GKED C=C(C)Cn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccncc1 123388302 INGUBHLBJZEHSP-UHFFFAOYSA-N 389.528 5.010 30 20 GKED COc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1F 133315867 LRHPXECKUKJZSD-UHFFFAOYSA-N 398.381 5.111 30 20 GKED CCS(=O)(=O)c1ccccc1Oc1ccc(NCCCC(C)(C)C#N)cc1 154236175 DKCGVLJRKUQGCG-UHFFFAOYSA-N 386.517 5.014 30 20 GKED C#Cc1cccc(N(C)Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)c1 175637497 WNUMUHARGPYUIB-UHFFFAOYSA-N 395.915 5.099 30 20 GKED COc1cc(/C=C2/CCSc3ccc(Cl)cc3C2=O)ccc1OCC#N 176852228 OYPUFNRLZDKDNV-UVTDQMKNSA-N 385.872 5.013 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1O[C@H](C)C#N)c1cccc(C(F)(F)F)c1 182055250 DVAMXNSBNJUAKR-UONOGXRCSA-N 376.378 5.129 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)c(Sc2ccccc2)n1 182109427 XPHARNUTQMWWBP-MRXNPFEDSA-N 389.480 5.084 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(F)c(C)c2)=C(\S)NC2CC2)cc1 267497901 YFANBUXJXWUORU-UHFFFAOYSA-O 399.555 5.016 30 20 GKED C[C@H](OC1CCCCCC1)/C(O)=N/Cc1nc2cc(Br)ccc2o1 329204164 XLQQYNFNFKCFQR-LBPRGKRZSA-N 395.297 5.175 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ncoc1-c1ccccc1 371993720 HCATTWHLIFNUCC-OAHLLOKOSA-N 392.484 5.058 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(C2CC2)cc1 419341197 NYJDSJARVIKOMD-SJORKVTESA-N 393.556 5.105 30 20 GKED C=C(C)Cn1c([C@H]2CCCS2)nnc1N1CCC[C@@H]1c1ccc(OCC)cc1 424256427 VMNPNHLZLYCXQX-WOJBJXKFSA-N 398.576 5.163 30 20 GKED CCc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1CCC(C)C 427602460 PYQHJQPILUNGFR-MRXNPFEDSA-N 384.549 5.138 30 20 GKED CN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438653235 XFUBHAAJWLDXKY-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443911458 YDQBLOGQXLUYSE-OAHLLOKOSA-N 381.426 5.056 30 20 GKED CC(C)[C@@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)c2ccccc2N1 444807927 YFYYDUSOAQLRRF-NRFANRHFSA-N 386.499 5.042 30 20 GKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc(Sc2nc(C)cs2)cc1C 445614602 BJPPCUWUTHLUPV-IBGZPJMESA-N 376.547 5.078 30 20 GKED N#CC1(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)CCC1 450661095 COJSOBDAARZPCO-UHFFFAOYSA-N 384.892 5.026 30 20 GKED C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1C(=O)c1cn(CCCC#N)c2ccccc12 452234157 WQNXYWQJIMOVFQ-XHSDSOJGSA-N 391.437 5.137 30 20 GKED CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@@H](C)Cc1ccc(OC)cc1 458827368 DDFYXUUADPNWBS-CVDCTZTESA-N 393.531 5.093 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)COC2CCCCC2)c1 460341160 AGGGVIUGJBLAGL-UHFFFAOYSA-N 382.891 5.094 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 465669850 WZJWSHCIAFSNLA-RBUKOAKNSA-N 383.495 5.689 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 466390840 FBVRJONORFMDNS-RTBURBONSA-N 381.520 5.666 30 20 GKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 467609740 BNTGBTDNQADCSX-XFQXTVEOSA-N 381.907 5.648 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)on2)c1 468236275 XUUGIJOLBSYENY-UHFFFAOYSA-N 391.736 5.138 30 20 GKED CCc1ccc([C@@H](CC)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469265632 UBCXRQWNWRBYFL-JOCHJYFZSA-N 375.516 5.395 30 20 GKED CC(C)CCN1Cc2cccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2C1 475580028 CNGAIIKZAQKENL-UHFFFAOYSA-N 375.516 5.102 30 20 GKED Cc1nc2ccccc2n1C1CCN(c2ccc(C(F)(F)F)cc2C#N)CC1 480831380 WIMKGEXCOABWME-UHFFFAOYSA-N 384.405 5.077 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC[C@@H](C4CC4)C3)cc2Cl)c1 482963559 YHPAGHPLDPCDSA-GOSISDBHSA-N 395.890 5.054 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N(C)Cc2cccc(C#N)c2)c1 485268424 DHGYYRIWVCQYKW-UHFFFAOYSA-N 385.467 5.110 30 20 GKED N#CCCC[C@@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccccc1 487482724 GUWPHVFPDJKBOV-XMMPIXPASA-N 398.506 5.674 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)s1 487607956 MICUWRVNCJUOJV-UHFFFAOYSA-N 388.374 5.029 30 20 GKED CC(C)CO[C@@H](C)c1noc(CNc2ccc(Oc3ccccc3)c(C#N)c2)n1 488160445 SXKFVVYUBPJIES-INIZCTEOSA-N 392.459 5.079 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCO[C@@H](C(CC)CC)C1 498384459 JVLJQDIZACKCEA-DOTOQJQBSA-N 384.973 5.083 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N3CC=C(c4ccc(C#N)cc4)CC3)ccc2c1 503979172 AJERPBXNGJDBCP-SFHVURJKSA-N 396.490 5.139 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 505973485 KFYVXXYCPJWTJE-UHFFFAOYSA-N 392.446 5.095 30 20 GKED N#CC1CCC(CNC(=O)[C@@H](Sc2ccccc2F)c2ccccc2)CC1 508349232 OBANGWKMYJVEKB-BPZDKFOGSA-N 382.504 5.105 30 20 GKED CCN(C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1)[C@@H](C)c1ccc(C#N)cc1 516209418 KYXOYCYKZRTSHT-OALUTQOASA-N 399.494 5.317 30 20 GKED C=CCOc1ccc(CNCc2ccccc2CN2CCCCC2)cc1Cl 520209933 SSUBUDLLFGCDMC-UHFFFAOYSA-N 384.951 5.181 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1 521421151 SEQCTAHNEPSYEH-UHFFFAOYSA-N 385.467 5.793 30 20 GKED CC(C)(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccs1 524505002 JUPUOKQQECAXCP-UHFFFAOYSA-N 390.508 5.309 30 20 GKED Cc1cccc2c(CC(=O)Nc3sc4c(c3C#N)CCCCCC4)c[nH]c12 524969005 IDJOLBYFCMWCLD-UHFFFAOYSA-N 377.513 5.250 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cc(F)ccc1F 525417168 VPKGHMXVVDJOOK-GUYCJALGSA-N 389.471 5.632 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN(C)c1cccc2ccccc12 532926885 QPKYFVXWTZIWEZ-KRWDZBQOSA-N 389.524 5.166 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(Oc2ccccc2Cl)nc1)c1ccccc1 533507371 XTYQZUIFGMUXOV-IBGZPJMESA-N 391.858 5.302 30 20 GKED CCC[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 534775136 CSUZXJOLCBBHIJ-QUCCMNQESA-N 397.906 5.028 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2scnc2C2CC2)cc1 534983572 IJIWUUXDDAGTHG-UHFFFAOYSA-N 375.453 5.245 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2)c(C#N)s1 535254393 FLAOULNNUQHIGY-UHFFFAOYSA-N 384.892 5.009 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(-n2ccnc2)cc1 538112488 HMBSTALJJGXWEH-IBGZPJMESA-N 378.479 5.262 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 541973616 YUKDCBVEGCODIU-FQEVSTJZSA-N 392.890 5.153 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)[C@H](Oc1ccccc1C#N)C(C)C 544461390 KXULFJXIVHNTPY-JOCHJYFZSA-N 394.515 5.306 30 20 GKED C=C(C)Cn1c(SCc2nc([C@H]3CCC[C@@H](C)C3)no2)nnc1-c1ccco1 545640159 JSPRWDYWXKDAPW-CABCVRRESA-N 399.520 5.083 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1 548271239 NPCLPVPIVRIYAP-UHFFFAOYSA-N 393.552 5.317 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccccc3COCc3ccccc3)CC2)cc1 552064101 XQMGGUNZXDFCQF-UHFFFAOYSA-N 397.522 5.356 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cc(F)cc(F)c2F)cc1 554362191 ITICUHYFGHFABN-UHFFFAOYSA-N 386.304 5.159 30 20 GKED N#CC[C@@H](Cc1nc(Cc2c[nH]c3ccc(Cl)cc23)no1)c1ccccc1 554807756 QTQVYLNPXRZSID-HNNXBMFYSA-N 376.847 5.035 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@@H](C)c2ccccc21 557553359 CUCMQYYCGIOVGZ-SJORKVTESA-N 379.529 5.033 30 20 GKED CCOc1c(Cl)cc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)cc1OC 558276747 BQGPBDJGJYEYHY-OAHLLOKOSA-N 397.862 5.037 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@](F)(c2ccccc2F)C1 558797433 UJYJGENTTPRAAD-HSZRJFAPSA-N 384.470 5.780 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H](C#N)CCC 562389001 XIXSLHFWQCVNFD-LLVKDONJSA-N 380.275 5.023 30 20 GKED N#CCc1ccc(NC(=O)N2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)c(Cl)c1 562913604 KBJHGYTTZIEHBP-RTBURBONSA-N 377.875 5.258 30 20 GKED N#C[C@@H](C(=O)c1cc[nH]c1C1CCC1)c1nc(-c2c(F)cccc2F)cs1 568278169 DPORFRLQARTCGQ-ZDUSSCGKSA-N 383.423 5.174 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H]1c1ccccc1 577563479 RZPFTCDQODFUIQ-FXAWDEMLSA-N 392.478 5.085 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)cc1 579262797 XVWMHARSBPZHAC-UHFFFAOYSA-N 397.356 5.325 30 20 GKED CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)CCCCCC#N 588887002 GZMMXPKTUNRKGD-JOCHJYFZSA-N 384.470 5.919 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 590829316 CJSYHXPTMFPALH-QZTJIDSGSA-N 375.394 5.024 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCOc2ccccc2)cc1Cl 603758908 OINZOJGGRBBPEI-OAQYLSRUSA-N 390.870 5.403 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)NC2(c3ccccc3)CC2)cc1 608841612 WEKYHYFGOSMCHG-UHFFFAOYSA-N 399.450 5.170 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2c1ccn2C 609072480 NEMFPGHOTFMNGY-UHFFFAOYSA-N 395.462 5.190 30 20 GKED Cc1cc(Br)ccc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 609460927 PNAAONAJTHGWMB-HNNXBMFYSA-N 398.087 5.059 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2OCc2cccc(Cl)c2)cc1 609863318 KAKMITZRCVNENG-UHFFFAOYSA-N 390.870 5.362 30 20 GKED COCCN(C(=O)c1sc2cccc(C)c2c1Cl)c1ccc(C#N)cc1 610233768 LLBGYBHPJZRYQG-UHFFFAOYSA-N 384.888 5.028 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)c1cn(CCCC#N)c2ccccc12 618179070 VNRDFQNVTKQETB-UHFFFAOYSA-N 389.499 5.006 30 20 GKED Cc1[nH]nc(NC(=O)C[C@H](CC#N)c2ccccc2)c1-c1cccc(Cl)c1 619489530 NDIBYVMYLGIRPP-INIZCTEOSA-N 378.863 5.065 30 20 GKED N#C[C@@H](C(=O)c1cc2c(Cl)cccc2s1)c1cc(C(F)(F)F)ccn1 643777198 YSBHFPXRSYFDPF-LLVKDONJSA-N 380.778 5.459 30 20 GKED COc1cc2c(cc1F)CC[C@@H]2NC(CCC(F)(F)F)CCC(F)(F)F 658254725 OUWWJLISGYXUMU-AWEZNQCLSA-N 387.339 5.465 30 20 GKED O=C(C/C=C\c1ccc(F)cc1)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 673829619 AAVFNJSWZPIRFG-IOIPOEEFSA-N 397.334 5.255 30 20 GKED Cc1cc(F)cc(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 676327098 GUXOBHQFQWMKBN-UWVGGRQHSA-N 386.311 5.165 30 20 GKED Cc1cc2oc(=O)cc(CNc3cccc(Oc4ccc(C#N)cc4)c3)c2cc1C 729676359 IYYBQNYSTPYXME-UHFFFAOYSA-N 396.446 5.686 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2c[nH]c3cc(Br)ccc23)cc1 729937529 VEKVUUCNIPTIAO-FAFAAHBOSA-N 395.256 5.117 30 20 GKED N#CCOc1cccc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)c1 731938435 QEZZAMZTLDDLNE-NTCAYCPXSA-N 390.439 5.064 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cnc2ccc(Cl)cn12 737442530 BUABTOXAZFCUSR-HJWRWDBZSA-N 379.872 5.316 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)Cc1cccs1 743092974 IZDNYHUBSRKKDB-VGSWGCGISA-N 389.524 5.404 30 20 GKED CSC(C)(C)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 743103939 DJMUEOSMVIQIRA-QGZVFWFLSA-N 387.936 5.259 30 20 GKED Cc1nc2ccccc2c(=O)n1N=Cc1ccc(-c2ccc(C(C)(C)C)cc2)o1 743422617 CDWZVPZAXCXTIX-UHFFFAOYSA-N 385.467 5.145 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cc1OCCCC#N 747361864 ZMNNQYKFPRBQBM-DHDCSXOGSA-N 397.474 5.941 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(F)cc(F)c1O 756380401 UGHJUFKVNHOJES-CIUDSAMLSA-N 391.302 5.231 30 20 GKED Cc1sc(Cl)nc1C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1 763266235 BPVZVYPGRMQANV-UHFFFAOYSA-N 396.899 5.162 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc4[nH]ccc4c3)n2)cc1 765915019 IIWCOZNKPUMVCH-SQUITACLSA-N 383.476 5.490 30 20 GKED C/C(=C/C(C)(C)C)C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 773980262 PRAJVTKOTBBCSC-BROZXCPCSA-N 376.456 5.119 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 779697562 GTDSNOMUSYXDSX-IBGZPJMESA-N 387.524 5.019 30 20 GKED C#CCCCCCC(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 779869862 MSBDEQMWVVXDQG-UHFFFAOYSA-N 376.525 6.162 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cnn(CC(C)C)c1C(F)F 782795488 PVKQAICHPJXIGJ-UHFFFAOYSA-N 392.450 5.019 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C/c1csc(-c2cccs2)n1 787183091 HPHMMAXYYSJAON-FNORWQNLSA-N 389.885 5.208 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C\c1cnc(-c2cccs2)s1 787184925 WOPBDMBRQGQZKC-ALCCZGGFSA-N 389.885 5.208 30 20 GKED CC(=O)Nc1ccc(C(=O)/C=C\c2cnc(-c3ccc(Cl)cc3)s2)cc1 789147830 LAFFOUFOSONLFQ-KHPPLWFESA-N 382.872 5.318 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792099728 IWQVCXLCGDJIOB-DOMZBBRYSA-N 385.250 5.185 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571263 PBABWQKSCMOHMO-PWSUYJOCSA-N 397.327 5.391 30 20 GKED N#CC1(CCCOC(=O)C[C@H](Cc2ccccc2)c2ccccc2)CCOCC1 800172380 IUECYOSVLGXMOD-QHCPKHFHSA-N 391.511 5.047 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cc(F)c(C(F)(F)F)cc1F 808361792 CNGUSOMSEFVORF-UHFFFAOYSA-N 387.201 5.394 30 20 GKED CN(C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 809372105 JCPZXHNXODHWJE-MJBXVCDLSA-N 385.323 5.296 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2)CCCCC1)c1cc(C(F)(F)F)ccn1 813218352 OSDIHMINDHPTRP-KRWDZBQOSA-N 390.380 5.318 30 20 GKED C[C@H](N[C@@H]1c2cccc(Br)c2CC1(C)C)c1ccc(OCC#N)cc1 813885096 QCTPZTHHRHUPLP-VBKZILBWSA-N 399.332 5.326 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1 836497817 XFGFPLKKLSEWJY-DNVCBOLYSA-N 383.879 5.390 30 20 GKED FC(F)(F)c1cc(NN=Cc2cnc([C@@H]3CCCO3)s2)ccc1Cl 844606708 FXSBVEYMQUJAGJ-ZDUSSCGKSA-N 375.803 5.113 30 20 GKED Cc1cc(NCc2ccc(C3(C#N)CC3)cc2)ccc1NC(=O)OC(C)(C)C 850416759 BLOWXCNUJIQGJA-UHFFFAOYSA-N 377.488 5.509 30 20 GKED CO[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CCC1 850763465 APSFHAYLKRJPFF-DYVFJYSZSA-N 395.311 5.108 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)c1c(F)cccc1F 857478752 PDYKJSAXCKTDCZ-CYBMUJFWSA-N 397.265 5.006 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccn2Cc2ccccc2)cc1 915084949 BNGBAPLSIJVATG-DEOSSOPVSA-N 391.474 5.444 30 20 GKED CCn1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2ccccc21 915199434 BEBGVMSFVFHBLL-QFIPXVFZSA-N 379.463 5.569 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N(Cc1ccco1)c1ccccc1C#N 915851140 NXOXOKJGAKNBKX-UHFFFAOYSA-N 389.436 5.023 30 20 GKED O=c1c2c3c(sc2ncn1N=CC(c1ccccc1)c1ccccc1)CCCC3 916288844 YICKTQWFLLCKHA-UHFFFAOYSA-N 399.519 5.003 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2CCCCCCC2)cc1 916720112 GNYCYRHGSWBMCY-UHFFFAOYSA-N 391.515 5.566 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 917043817 OKVLGWFHRQVEAW-HNNXBMFYSA-N 388.414 5.433 30 20 GKED CCCCCCCCCNC(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 919654889 NANCERMSFRXHLV-ZIAGYGMSSA-N 390.412 5.509 30 20 GKED C=CCCc1ccccc1NC(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1 931290227 JLSCOMGEJFKUFQ-QFIPXVFZSA-N 376.500 5.191 30 20 GKED CC(CCCOc1ccc(Cl)c(C)c1)=NNc1ccc(Cl)c(C(=O)O)c1 1776033799 JEZRUDUNJTTYFQ-UHFFFAOYSA-N 395.286 5.647 30 20 GKED O=C(O)c1cc2c(C=NOc3ccccc3C(F)(F)F)c(F)ccc2s1 1776051853 KENMFZIVRJVCPP-UHFFFAOYSA-N 383.322 5.170 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c(OC)c1 1776114305 LLTUJKIVQUCHCY-DHZHZOJOSA-N 394.448 5.027 30 20 GKED O=C(/C=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccc(Cl)cc1 1776114795 BEXGIFXUIKWQFU-UNJYKCMZSA-N 392.838 5.441 30 20 GKED O=C(/C=C\c1cc(C(=O)O)c(Cl)s1)c1ccc(OCc2ccccc2)cc1 1776127635 YZQOFQQWPZRXQX-KHPPLWFESA-N 398.867 5.575 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2ccccc21 1776308571 DMRYDURDGRJPCR-GBQPJDALSA-N 382.459 6.071 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776308753 LJTFZUMYJXWCMN-LMSRTUJASA-N 396.486 6.000 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cnc(-c2cccc(Cl)c2)s1 1776785452 COSAHROFDPOHHN-QGZVFWFLSA-N 394.968 5.757 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@@H]3CCC5)o2)cc1O 1777670951 FZRWOTHLHGGFQZ-PUMYGXPMSA-N 386.403 5.050 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccn1 43181762 MLYDBENZAPBHQQ-BEFAXECRSA-N 390.874 5.273 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccn2)cc1Cl 107648061 NXQSOUTYLMVVBZ-KRWDZBQOSA-N 382.250 5.296 30 20 GKED COc1ccccc1CN(C(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 108533289 YKVCJCGVXYZXLF-MRXNPFEDSA-N 395.528 5.143 30 20 GKED N#Cc1ccc(NCc2cccc(OCc3ccccn3)c2)cc1C(F)(F)F 111217433 RGEOQXQULCYCRR-UHFFFAOYSA-N 383.373 5.163 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)CCc2ccc(C#N)cc2)C1 136069760 RSPNSUSXHJVIDD-FOIQADDNSA-N 386.417 5.119 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CCCC[C@H](C)C(C)=O)cc1 151400174 PXSAKOFVCDJLOB-INIZCTEOSA-N 394.471 5.083 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 158740456 UCHWIMDSPBZOSU-SNVBAGLBSA-N 376.268 5.768 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 173115264 SVKUCBYWKCMYMK-PKOBYXMFSA-N 381.545 5.423 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)ccc1OC1CCCC1 177777794 QHGGHFIGEMDFJL-MRXNPFEDSA-N 384.501 5.087 30 20 GKED N#C[C@@H](C(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)c1ccccn1 181410445 SJSGLHSUJRKNMC-CQSZACIVSA-N 384.222 5.066 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 185578270 IYULZJVWTYPSGL-BNOWGMLFSA-N 390.430 5.240 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 190934135 ZZTWHIWKWJIWGA-KRWDZBQOSA-N 382.470 5.981 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccc(OC)cc2)C1 191516808 MGPDCWMVSMUZHJ-FQEVSTJZSA-N 378.516 5.569 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 255547528 HXNKASMOPWTONE-KXQLTZBTSA-N 389.263 5.600 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(F)cc2)CCCC1 303319608 TUXPZQOIXILXSD-INIZCTEOSA-N 382.504 5.528 30 20 GKED CC(C)(/N=C(/O)c1ccc2c(c1)C(C)(C)C(O)=N2)/C(O)=N/CC1CCCCC1 329016195 QLADRZVQBIVVSX-UHFFFAOYSA-N 385.508 5.186 30 20 GKED OC(=Nc1ccccc1-c1ncc2n1CCCC2)[C@@H]1C[C@]12CCOc1ccccc12 329478125 UTTVQDSMMJGPBP-CPJSRVTESA-N 399.494 5.215 30 20 GKED N#CCCC[C@H](NCCC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 411756804 LDPBPJNKRHYAIK-SFHVURJKSA-N 390.314 5.347 30 20 GKED N#C[C@@H]1CCC[C@]2(C1)Nc1ccccc1C(=O)N2c1cccc(C(F)(F)F)c1 414170045 BMQQWUUDWUJGKH-VLIAUNLRSA-N 385.389 5.188 30 20 GKED CC1(C)[C@@H](c2ccccc2)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 422209317 UJRKFHCTCGYPKT-YADHBBJMSA-N 375.516 5.399 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1N1CCCCCC1 425606764 JPEZRURRYGDATO-SFHVURJKSA-N 376.504 5.164 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 425639986 OVDSAXDAVSEETB-ACJLOTCBSA-N 385.920 5.151 30 20 GKED Cc1ccc(C[C@H](NC(=O)Nc2ccc(C#N)cc2Cl)c2ccccn2)cc1 426158519 CBTXAYCQBTVPDE-NRFANRHFSA-N 390.874 5.021 30 20 GKED N#CCCC[C@H](NC(=O)NCC1(c2ccc(Cl)cc2)CC1)c1ccccc1 431892167 QDUSJHDZCTXTOV-FQEVSTJZSA-N 381.907 5.106 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1nc2ccccc2s1)c1ccccc1 435109744 FCDILWQBGOUOOM-FUHWJXTLSA-N 379.529 5.706 30 20 GKED C[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(C(F)(F)F)cc1 437074255 GSOZNESKCGWXIS-FTXHTYHOSA-N 389.421 5.013 30 20 GKED C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438629484 FWSNGOAOTKKVIK-SGTLLEGYSA-N 391.368 5.331 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639909 YUAFUKXOIDWHBG-KRWDZBQOSA-N 375.394 5.062 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@]3(CCCc4ccccc43)C2)cc1 440266626 NXUACJFRBXPRSI-RUZDIDTESA-N 387.527 5.390 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H]1CC12CCSCC2 448952331 RQJYFQYPMRHAOI-HXUWFJFHSA-N 394.515 5.072 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccc(F)cc1)CC1CC1)c1ccccc1 458806822 WNDAFKZVJUCGBB-QFIPXVFZSA-N 379.479 5.182 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)N[C@H]1CC[C@@H](CC#N)C1)C1CC1 459012077 OENUBPWESIRVIW-KEYYUXOJSA-N 379.426 5.023 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nnc(-c2cc(F)ccc2C)s1 469878308 FGDPOMNWQQBUJQ-UHFFFAOYSA-N 385.489 5.183 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(F)ccc1-c1ccoc1 470887517 FNRWBHRWURYNSA-CQSZACIVSA-N 380.444 5.590 30 20 GKED Cn1ccc2cccc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)c21 472934553 PBABRDXRIYLTPQ-UHFFFAOYSA-N 397.503 5.595 30 20 GKED C[C@H](NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1ccc(C#N)cc1F 477855256 XAGHOAPADIZSQN-NSHDSACASA-N 382.788 5.709 30 20 GKED CC(=O)c1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 480797134 RTIWKCZFUHJRHH-NRFANRHFSA-N 388.854 5.450 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@](C)(C#N)CCc2ccccc2)s1 481893549 NGLUOIYJHGKXFW-QHCPKHFHSA-N 389.524 5.072 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCSc3ccc(C(F)(F)F)cc32)cc1 483842532 QQVIZWTUARDZIP-UHFFFAOYSA-N 390.430 5.259 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)CC2CCCCC2)cc1 508272840 JNEPYESKWMZULJ-UHFFFAOYSA-N 393.487 5.403 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H](C)[C@H]1C 510104864 MNPABERNPIEXRN-SJLPKXTDSA-N 377.488 5.098 30 20 GKED CC[C@H](C)[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 515195494 YOEHKHXQGSUIGR-SBUREZEXSA-N 399.494 5.822 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 518256991 VURBVCXKZDZGLC-IEBWSBKVSA-N 381.545 5.642 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518918971 AALDIAHJFMCBHZ-INIZCTEOSA-N 376.481 5.440 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)ccc12 520646725 CDTQEWZVIKMQAJ-UHFFFAOYSA-N 395.418 5.165 30 20 GKED C[C@@H](c1cccs1)N(CCC(=O)Nc1ccccc1C#N)Cc1ccccc1 532496230 SXRMNNVIBJCKEA-SFHVURJKSA-N 389.524 5.212 30 20 GKED Cc1ccc([C@H]2CCCN2CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 532745364 WRFAHQLXYDEXMG-GHTZIAJQSA-N 393.556 5.165 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C(C)(C)C 533489460 XOEGAXLFZRPPGH-VGSWGCGISA-N 395.572 5.396 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCC(F)(F)F)c1ccc(C(F)(F)F)cn1 536183978 QHJIVMSJVHWLDF-CQSZACIVSA-N 386.295 5.085 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(COc2ccccc2)cc1)c1ccccc1 536925388 PBTUHTOISKVOKY-HSZRJFAPSA-N 385.467 5.432 30 20 GKED N#CCCCOc1cccc(CN(Cc2cccc(-c3cccnc3)c2)C2CC2)c1 539862741 OPBQVRGBEAPSJH-UHFFFAOYSA-N 397.522 5.596 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H]1c1nc2ccccc2n1C(C)C 540499365 GNUFCRQXFFHMQY-NRFANRHFSA-N 383.536 5.044 30 20 GKED CN(C[C@@H]1CC=CCC1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 543353464 JZTFQDGLKQPIQG-LJQANCHMSA-N 376.525 5.279 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 546919764 QRPKBCOPLQYCHE-AWEZNQCLSA-N 377.366 5.203 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccncc1F 559841995 DJFBDJJBQZZGGK-BONVTDFDSA-N 380.307 5.584 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2nc(C3CCCCC3)no2)sc2ccc(C#N)cc12 568071917 BVTYABJOLAQXCO-ZDUSSCGKSA-N 394.500 5.003 30 20 GKED O=C(Nc1cccc(C(F)F)c1Cl)c1c(F)cc(C(F)(F)F)cc1F 575225924 FRNDTMABBIEGGH-UHFFFAOYSA-N 385.666 5.827 30 20 GKED C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@@H](CCCC#N)c1ccccc1 577881469 AMZLOHKHQDVUFO-AVRDEDQJSA-N 397.950 5.102 30 20 GKED CCCN(C(=O)CCCCCC#N)[C@H](c1cccnc1)c1ccc(F)cc1F 588928798 XJEIECSCLNKOGJ-JOCHJYFZSA-N 385.458 5.162 30 20 GKED N#Cc1csc(-c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)c1 589155126 KTJGEZLGUBQDNP-UHFFFAOYSA-N 388.330 5.011 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccsc3)cc2)ccn1 589365105 QQTANFNVQNSHEJ-HXUWFJFHSA-N 390.468 5.176 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cccc(C#N)n2)c(C(F)(F)F)c1 589762222 IRFYHQUMDHSOQM-NSHDSACASA-N 379.407 5.115 30 20 GKED Cc1cc(Br)c(C[S@](=O)CCCCC(C)(C)C#N)cc1Cl 594678569 DCPUUQLZEXCEIJ-OAQYLSRUSA-N 390.774 5.380 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1F 596606940 ZXIMUVHSTRQNPM-NHCUHLMSSA-N 395.478 5.116 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1C(C)C 599884101 NFAXBMVXENYIPX-UHFFFAOYSA-N 385.895 5.016 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)C1CCCC1 608918163 GQBNJSZQIPNOHS-QHCPKHFHSA-N 375.516 5.410 30 20 GKED Cc1cc(Nc2ccc(OCc3cccc(C#N)c3)cc2)nc(-c2cccnc2)n1 609075181 QVUZOYLCPSWYAS-UHFFFAOYSA-N 393.450 5.041 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 610014575 BHZPBOCKQNQQHH-AVRDEDQJSA-N 375.516 5.801 30 20 GKED C[C@@H](c1ccccc1)c1ccc(OCc2nnc(-c3cccc(C#N)c3)o2)cc1 610270513 SDNBINMDGZPBMQ-KRWDZBQOSA-N 381.435 5.339 30 20 GKED C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1cccc(C#N)c1 610359787 OGSMPSOAVKNJFG-PISWEHOVSA-N 396.490 5.118 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)N[C@@H](C)c2cccc(C#N)c2)cc1C 610361703 FRYMQJRLNKKHSL-KRWDZBQOSA-N 387.508 5.212 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)C1 661382172 TZMFRTWSIXCVFK-IBGZPJMESA-N 383.561 5.233 30 20 GKED C=CCc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)cc(OC)c1OC 680423643 MISMBLUNIAZFBY-UHFFFAOYSA-N 399.796 5.357 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1coc2cc(F)ccc12 684388454 YYCSQOZECYJLKV-JZYVYDRUSA-N 397.290 5.211 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1 684696059 JPJYXOQPFJRQMJ-UHFFFAOYSA-N 394.262 5.159 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(O)cc1 725840100 WTZUVUYGKLRIJC-UHFFFAOYSA-N 378.432 5.039 30 20 GKED Clc1ccc(-c2ccc(C=Nn3cnnc3-c3ccccc3)o2)cc1Cl 725856121 LTMJUAJJGOFDTF-UHFFFAOYSA-N 383.238 5.394 30 20 GKED N#CC(CCOC(=O)c1cccc(F)c1F)(c1ccccc1)c1ccccc1 726681091 OVLQALHSJIMDMT-UHFFFAOYSA-N 377.390 5.022 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccccc2F)cc1 726858705 SRBQGYHWEUDZDM-YRNRMSPPSA-N 380.463 5.180 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCc1ccc(OCC#N)cc1 727844682 GYLIUINHFPJOJD-FQEVSTJZSA-N 399.494 5.062 30 20 GKED N#Cc1ccc(SCC(=O)OCc2nc3ccccc3c3ccccc23)cc1 728680613 TZZXTYCCJHKUHD-UHFFFAOYSA-N 384.460 5.095 30 20 GKED Cc1csc(SCc2ccc(C(=O)N(CCC#N)CC(C)(C)C)cc2)n1 729445900 IWXYNQRAZLSKIN-UHFFFAOYSA-N 387.574 5.146 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccccc1Cl)c1nc2cc(F)ccc2s1 730417494 NVXMSHZBPKQYOV-ZDUSSCGKSA-N 388.851 5.124 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)c(C)c1 730951255 MGRIORDFBGEOKC-POHAHGRESA-N 376.408 5.070 30 20 GKED CCOc1ccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 731320477 VPHMVPVMGXWLML-UHFFFAOYSA-N 389.480 5.558 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(C2CCCCC2)CC1 731400906 XNTIIJGTULFIHI-QGZVFWFLSA-N 385.577 5.905 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccccc2)n1C 741925314 NUSHJMAQVQDWGC-INIZCTEOSA-N 375.497 5.196 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N[C@@H](C)c2cccc3ccccc23)cc1 743462948 NFELFEYACXURQE-VQTJNVASSA-N 385.511 5.134 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)c1)C(=O)O 745021404 NTJQQNFLHLWIHK-AUECHBEKSA-N 378.449 5.163 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)O[C@H](C)c3ccc(C#N)cc3)c(C)c2c1 748679600 LRFPICAPJIJLKX-MRXNPFEDSA-N 375.424 5.053 30 20 GKED C[C@H](OC(=O)c1sccc1C#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 753353357 MFEXDXOZUCTAPH-VIFPVBQESA-N 393.251 5.500 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2ccc(Br)s2)cc1 753589535 IVKIXFPALXUBLZ-CZUORRHYSA-N 391.334 5.139 30 20 GKED C#CC[C@@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 757761032 MDPLHDKMHWQYSQ-RUZDIDTESA-N 395.506 5.187 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC2CC(c3cccc(Br)c3)C2)c1 762612423 LHWBVDHHBIXWAB-UUKMXZOPSA-N 399.332 5.166 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C#N)C(C)(C)C 765633029 HOSYVVVDSOJOLA-MLGOLLRUSA-N 392.908 5.098 30 20 GKED C#CCC(C)(C)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 767044742 BYHNKVOKYRQAFL-GOSISDBHSA-N 378.903 5.119 30 20 GKED C[C@H](N[C@@H](C)c1cccc(OCc2ccccc2)c1)c1ccc(OCC#N)cc1 774381285 AZBYAVAXFGTRKX-PMACEKPBSA-N 386.495 5.580 30 20 GKED COCc1cc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)ccc1OC 774477874 MEMFLVWKUQMWPC-GOSISDBHSA-N 386.495 5.231 30 20 GKED Cc1nc([C@H](C)OC(=O)Cc2ccccc2CC#N)oc1-c1ccc(Cl)cc1 777162462 FMYUBBCAESPKAS-HNNXBMFYSA-N 394.858 5.216 30 20 GKED N#Cc1ccc(CN[C@H](CCSc2ccccc2)c2ccc(F)cc2)nc1 783301321 VZOVOWNYVFFHJU-JOCHJYFZSA-N 377.488 5.106 30 20 GKED N#CCCN(C(=O)CSc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1 786597660 OVQZZBVTGLVSDH-UHFFFAOYSA-N 398.837 5.398 30 20 GKED COc1cc(/C=C/C(=O)c2cncs2)ccc1OCc1ccc(Cl)cc1 787170496 WUWITFISRJEAKP-XBXARRHUSA-N 385.872 5.280 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc(Cl)cc2Cl)c(-c2ccncc2)n1 788346193 RLTCJFMHHJKROX-GORDUTHDSA-N 397.265 5.062 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc2ccccc2n1CC 789449600 HVVCJMRDDOGVME-UHFFFAOYSA-N 376.504 5.230 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792100647 LXBQJMIGELOIKQ-AUUYWEPGSA-N 382.385 5.309 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792108855 ZKLHRYPQTOQEAO-KUHUBIRLSA-N 393.284 5.052 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(N3CCCCC3)c3ncccc23)cc1 793248781 IVVOMJFOWUNZCT-SFHVURJKSA-N 386.499 5.128 30 20 GKED Cc1ccc(OC(F)F)c(CON=Cc2cccc(OCc3ccncc3)c2)c1 793832561 LXVAHXKMVZGJCM-UHFFFAOYSA-N 398.409 5.121 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3cccc(OC(F)F)c3)cs2)cc1 797127575 MTFCJXWXQDWOTI-YFHOEESVSA-N 387.407 5.316 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2cnc(-c3ccccc3)s2)C(=O)c2ccccc21 802708081 RFFZJFWNMDHSTK-ZRNYNZGJSA-N 389.476 5.127 30 20 GKED CCOC(=O)[C@H]1C/C(=C/C(C)=C\c2ccccc2COC)C(=O)c2ccccc21 814191645 RWMFZWZXXHTAEW-DVMOHERUSA-N 390.479 5.096 30 20 GKED Cc1ccc([C@@H](C)c2noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)cc1 848607168 SLTAVWQNXOCKQF-SJLPKXTDSA-N 398.507 5.180 30 20 GKED O=C(Nc1ccccc1)c1ccc(CON=Cc2ccccc2OC(F)F)cc1 849614689 YVNIZMKGFWPMDG-UHFFFAOYSA-N 396.393 5.091 30 20 GKED CCN(C(=O)/C=C\c1ccc2cc(OC)ccc2c1)[C@@H](C)c1ccc(C#N)cc1 914509473 MRIHJNQXXDNLDT-PIJNTSGSSA-N 384.479 5.343 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1cc2c(ccc3ccccc32)o1 915985739 PHNHFMAXEDPLFJ-MDZDMXLPSA-N 382.444 6.001 30 20 GKED Cc1ccc(Cl)cc1NN=Cc1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1776106571 LOKMDYYRDJUMIK-NRFANRHFSA-N 394.858 5.299 30 20 GKED CCn1c2ccccc2c2cc(/C=C3\CCc4ncc(C(=O)O)cc4C3=O)ccc21 1777002757 CLCJAMKWMFSUSC-LFIBNONCSA-N 396.446 5.120 30 20 GKED COc1cc2ccccc2cc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777339132 PCQSYWFFHTZBID-ZHACJKMWSA-N 398.414 5.703 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3c(F)ccc(C(=O)O)c3F)s2)cc1 1777430617 SCOXJFKOIOJFCL-CSKARUKUSA-N 399.418 5.299 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc4c(Cl)nccc4o3)c2c1 1777685811 ZTWLEZDHYODPCL-IWQZZHSRSA-N 383.812 5.290 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCCC(F)(F)F)cc2)CCC1 1786621058 IUVHMBSBZCAWSF-OAHLLOKOSA-N 396.453 5.065 30 20 GKED N#CCOC(=O)c1c2c(nc3ccccc13)/C(=C/c1c(F)cccc1Cl)CC2 8282597 UPJYFNVTKIMRAH-OUKQBFOZSA-N 392.817 5.194 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CSc2ccc3ccccc3c2)cc1 10439918 BJMWJTNGIFVKJN-UHFFFAOYSA-N 390.508 5.277 30 20 GKED CCN(C(=O)c1ccc(C2SCCCS2)cc1)[C@@H](C)c1ccc(C#N)cc1 45500015 RVHRQXWWALUSOU-INIZCTEOSA-N 396.581 5.650 30 20 GKED C[C@H]1CCC[C@@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 48161850 QGFBCHOMDHCNOG-FXAWDEMLSA-N 377.488 5.032 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccccc2C(F)(F)F)ccc1OC 60949067 BDOWFJGKLGNCHW-HNNXBMFYSA-N 379.422 5.520 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccn(-c2cccc(Cl)c2)n1 66802160 WZMLOEZMRIEPJS-AWEZNQCLSA-N 396.903 5.172 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 69589094 GDAKJYCGEFHLLH-QGZVFWFLSA-N 389.455 5.150 30 20 GKED CCN(C(=O)c1cc(-c2ccco2)nc2ccccc12)[C@@H](C)c1ccc(C#N)cc1 105904007 VKUDBUTVMOAESS-KRWDZBQOSA-N 395.462 5.590 30 20 GKED Cc1cccc2[nH]cc(CCNC(=O)Nc3ccccc3SC[C@H](C)C#N)c12 108528391 FXDNNENANDGTPG-OAHLLOKOSA-N 392.528 5.092 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC=C(c2ccc(F)cc2)CC1 108530618 PGJJZUGGLCKMPL-MRXNPFEDSA-N 395.503 5.399 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 153552738 PWFHZRUUMKZDRA-JOCHJYFZSA-N 398.466 5.105 30 20 GKED N#CCOc1ccc(CNCc2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1 180933942 GXIKDTUSLRMISL-UHFFFAOYSA-N 386.373 5.158 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@H](C)c1ccccc1C(F)(F)F 182143987 JGHBRWDSCQJTRP-KBPBESRZSA-N 376.378 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 188064356 CWFSLPKSQDGRHB-KRWDZBQOSA-N 386.536 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@](C)(c2ccccc2)C1 191432650 AVVJHVVZAAGLDC-XMMPIXPASA-N 378.516 5.318 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 191453462 NMWDEOYESSFFIX-XUZZJYLKSA-N 392.543 5.828 30 20 GKED N#Cc1ccc(CNCc2ccc(-c3cccc(Br)c3)o2)c(F)c1 237711024 DSSDECKQBNBUNA-UHFFFAOYSA-N 385.236 5.010 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)c1 237828031 NCOSEWFDIILDBA-SANMLTNESA-N 396.490 5.995 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@H](CCC#N)c1ccccc1 245936632 LDXLOIRWOQWJNP-AUSIDOKSSA-N 390.531 5.540 30 20 GKED Cc1ccc(-c2nnc(Sc3cc(C)c(C#N)c4nc5ccccc5n34)o2)cc1 301077645 NVACPGSLBGDQGS-UHFFFAOYSA-N 397.463 5.177 30 20 GKED Cc1ccccc1-c1nnc(Sc2cccc(F)c2C#N)n1Cc1ccco1 301174592 YIYWHTJEBWRIAJ-UHFFFAOYSA-N 390.443 5.057 30 20 GKED N#Cc1ccc(SCC(=O)Nc2nc3c(ccc4ccccc43)s2)cc1 303212445 RXQNCDQZIHQSTH-UHFFFAOYSA-N 375.478 5.052 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 303236828 ZXXJDBVKOGVRPB-UHFFFAOYSA-N 382.872 5.413 30 20 GKED C[C@H](C(O)=Nc1ccccc1NC12CC3CC(CC(C3)C1)C2)c1ccccn1 328787706 PDCPONLFXITYFN-RNXZQOMOSA-N 375.516 5.854 30 20 GKED COc1cc(C)cc(N/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1C 330222552 RXKZTBDYEYTXIA-SFHVURJKSA-N 382.508 5.027 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1 368576915 SYRGEDXSBHYRQG-QVKFZJNVSA-N 399.441 5.071 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccccc1 432468067 FBNXZPXYFSXVIW-DEOSSOPVSA-N 399.494 5.822 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(F)ccc1Br)c1ccccc1 433259496 QOFPSHUCOMRGPH-MRXNPFEDSA-N 390.256 5.145 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(Oc2nccc(C)n2)cc1)c1ccccc1 435595185 UNWRIEHHBPMYGU-NRFANRHFSA-N 388.471 5.406 30 20 GKED Cc1cc(C)c(NC(=O)N[C@H](CCC#N)c2ccccc2)c(Br)c1 439478360 NYUZDIGBESWXAL-QGZVFWFLSA-N 386.293 5.233 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 439508655 CLADYSVCQSHNOX-NSHGMRRFSA-N 393.556 5.881 30 20 GKED C=C(C)Cn1c(-c2cccc(C#N)c2)nnc1N1CCC[C@@H]1c1ccc(C)s1 460567225 VUOQRPLLJGRMHV-LJQANCHMSA-N 389.528 5.104 30 20 GKED C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)CCCC#N 463254254 DWGARJYOHQQOTQ-MAUKXSAKSA-N 391.902 5.550 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 463557016 WNHKPQSWHVHBRW-UHFFFAOYSA-N 386.854 5.438 30 20 GKED CC(C)Cn1cc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c2ccccc21 464422119 PLLFUVISMFTAFR-MRXNPFEDSA-N 385.389 5.201 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2cccc(F)c2)C2CCCC2)cc1 465163950 IBFZUDXUIUJHGO-UHFFFAOYSA-N 379.479 5.604 30 20 GKED CN(CC[C@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 466410388 RCDRMOSFPATHOK-QGZVFWFLSA-N 399.878 5.037 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3cc4ccccc4s3)ccc21 469281647 RARWRNZRQXPJGE-UHFFFAOYSA-N 375.497 5.096 30 20 GKED C[C@@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)CC[C@H]1c1ccccc1 469454572 LQZWDIFJKXRWOT-TZIWHRDSSA-N 385.511 5.211 30 20 GKED Cc1nc(NC(=O)C[C@@H](CC#N)c2ccccc2)sc1Cc1ccccc1F 474970754 FODZTQSZGLSRIG-QGZVFWFLSA-N 393.487 5.208 30 20 GKED N#CC[C@@H](CC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1ccccc1 475380874 PAMCSCJDKNBWIP-QHCPKHFHSA-N 380.491 5.543 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Cn2cnc3ccccc32)cc1)c1ccccc1 475399340 ZRFBPWCUFDRJJZ-OAQYLSRUSA-N 394.478 5.111 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 475549899 QBXCQDXBCUYDEC-IFMALSPDSA-N 396.506 5.719 30 20 GKED C[C@H]1c2cc(Cl)c(Cl)cc2CCN1C(=O)C[C@@H](CC#N)c1ccccc1 476342207 NMNXESPYUCGDND-GOEBONIOSA-N 387.310 5.527 30 20 GKED CN(C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1cc(Cl)ccc1C#N 483771663 DPNVJVBJZCBGBR-UHFFFAOYSA-N 387.826 5.296 30 20 GKED Cc1c([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccccc12 484143595 UOSBHPJDSQRISI-GDBMZVCRSA-N 393.512 6.018 30 20 GKED N#Cc1ccc(Br)c(CN[C@@H](c2ccccc2)c2ccc(F)cc2)c1 492515450 QOLOFPNBEUUFSK-NRFANRHFSA-N 395.275 5.339 30 20 GKED C=CCc1cc(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)cc(OC)c1O 500266930 NMFZOYBARWMONT-NSHDSACASA-N 384.278 5.426 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCC(C)(C)c2ccc(F)cc2Cl)cc1 502398873 MOUUTOVIEYCNOZ-UHFFFAOYSA-N 387.886 5.380 30 20 GKED C[C@H]1CCC[C@@H](NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 505156950 PXNYGXOTETTZMT-FXAWDEMLSA-N 377.488 5.032 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2cc(Cl)ccc12)c1cccc(Cl)c1Cl 505307447 FMWHCDHFSRFCAA-MRXNPFEDSA-N 392.673 5.052 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)CCc1ccco1 510506958 CFUMZWSULSQUHD-QGZVFWFLSA-N 389.455 5.395 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3ccc(Cl)s3)c2)cc1 510512508 CMTBMQBPBZNTSH-UHFFFAOYSA-N 396.899 5.228 30 20 GKED CC(C)N(C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccc(F)cc1 513302189 SKDCVONGSIJDPG-UHFFFAOYSA-N 388.442 5.332 30 20 GKED C[C@@]1(Cc2cccc(F)c2)CCCN1C(=O)Nc1ccc(CC#N)cc1Cl 517564447 DULQSMAIDNVXJT-NRFANRHFSA-N 385.870 5.174 30 20 GKED CN(Cc1ccoc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 518183675 SAFYLLFGEKHRBE-IBGZPJMESA-N 379.847 5.252 30 20 GKED CC(C)c1ccc(-c2csc(NC(=O)C3(C#N)CCOCC3)n2)c(C(C)C)c1 518284221 ZKWSLHLTQDFTTG-UHFFFAOYSA-N 397.544 5.316 30 20 GKED C[C@@H](CC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)n1cccc1 519166384 FUMKLQPPQKEKDC-INIZCTEOSA-N 393.874 5.182 30 20 GKED CC(C)Oc1ccc(CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520941742 YYHVQYVTFVXMBU-QGZVFWFLSA-N 397.544 5.232 30 20 GKED N#Cc1cccc(OCCCCC(=O)NCC2(c3cccs3)CCCCC2)c1 523496427 WPBXLWRCAUKHFL-UHFFFAOYSA-N 396.556 5.187 30 20 GKED C[C@@H](CN(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccc1 524604536 SOTBWJDJLDPLGJ-KRWDZBQOSA-N 388.442 5.365 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)C[C@@H](CC#N)c3ccccc3)CC2)cc1 526983521 KVJYMRXBHQQSIW-JOCHJYFZSA-N 390.527 5.267 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 534243183 VSZWIFBPHJLRGX-UHFFFAOYSA-N 375.925 5.341 30 20 GKED COc1cc(CN[C@@H](c2ccccc2)C2CC2)ccc1OCc1cccc(C#N)c1 537291139 UUKOUDJDHRBGOE-SANMLTNESA-N 398.506 5.387 30 20 GKED C[C@H](SCC(=O)Nc1cc(C(C)(C)C)sc1C#N)c1nc2ccccc2[nH]1 538073711 JMVXMCBZOVQQKY-LBPRGKRZSA-N 398.557 5.226 30 20 GKED C=CCC(CC=C)C(=O)N1CC[C@H](c2ccccc2)[C@@H]1c1cccc(OC)c1 544254005 MHWBOENDGHWBNI-RPWUZVMVSA-N 375.512 5.521 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl)c1ccncn1 544816060 SYIBMBWEVQSNHY-MRVPVSSYSA-N 382.659 5.142 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1ccc(C#N)cc1 553799150 HYITUBNJFBXESH-CQSZACIVSA-N 385.870 5.034 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cc(F)ccc1-c1ccoc1 557609949 TVJGBJOKKYKPOI-UHFFFAOYSA-N 381.451 5.082 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CC1(C(F)(F)F)CC1 561588489 LPKTTZXATOCHLK-UHFFFAOYSA-N 388.389 5.117 30 20 GKED CC(C)Oc1ccc(Cl)cc1NCc1cn(C)nc1-c1ccc(C#N)cc1 564010018 AWDDKCBGFPCQLT-UHFFFAOYSA-N 380.879 5.011 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@@H](C)c3ccc(C#N)cc3)o2)cc1 565857597 GTUBYELQPGMWNT-HNNXBMFYSA-N 378.501 5.308 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3cnc(-c4cccnc4)s3)c(C#N)c21 569567358 ZAULMMJNJKKMLO-NEPJUHHUSA-N 394.525 5.076 30 20 GKED N#Cc1cc2c(nc1S[C@H](C(=O)Nc1ccccc1)c1ccccc1)CCCC2 585688861 UPJAMWCQQNUFFW-QFIPXVFZSA-N 399.519 5.304 30 20 GKED C[C@@]1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1(F)F 596692027 USLUTOXYBKIHBG-LPHOPBHVSA-N 389.833 5.162 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@]12CCCC[C@H]1C2(F)F 596790874 SJNJVRHSMPCPPM-NQIIRXRSSA-N 397.425 5.208 30 20 GKED N#CC[C@H]1CCCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)C1 597915926 JXMDTXXGQHYIKK-QGZVFWFLSA-N 389.474 5.059 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C[C@H](C)C1(F)F 599731686 PQPINGMBAKPVOO-GJZGRUSLSA-N 385.414 5.106 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2ccc(F)cc2Cl)cc1 603637705 QXVYSGLKNAUGEU-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603756319 NDEGGQLITYITMP-MRXNPFEDSA-N 389.480 5.006 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F 604368171 WYMZPBKGMOPKFR-HNNXBMFYSA-N 389.421 5.260 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCSc3ccccc3)cc2)c1 609064494 ZNMZTJIUPDABAA-UHFFFAOYSA-N 388.492 5.258 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CNc3ccccc3Cl)cc2)c1 609429541 KDQAEISNTHWCFD-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1cccc2ccccc12 609434777 PWXFLVXPBKMWBG-KRWDZBQOSA-N 389.524 5.598 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 609636268 KOZDJWYBELQRMH-UYAOXDASSA-N 393.556 5.628 30 20 GKED CC(C)c1ccccc1N(C(=O)c1ccc(C#N)nc1)c1nc2ccccc2s1 609640824 YFYCRZISXZCZAT-UHFFFAOYSA-N 398.491 5.665 30 20 GKED CCCN(CC(F)(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609727767 ZBVWLOCXMQIMES-UHFFFAOYSA-N 396.796 5.418 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCOC1CCCCCC1 609821798 ATMXWMAPSZYHRO-UHFFFAOYSA-N 394.540 5.179 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCc2cccc(F)c2)c1)c1cccc(C#N)c1 610321905 PTEBXDZSWGRADZ-INIZCTEOSA-N 389.430 5.159 30 20 GKED C[C@H](NCc1cccc(CN[C@H](C)c2cccc(C#N)c2)c1)c1cccc(C#N)c1 611389050 WTOSHJKZKZELCE-BGYRXZFFSA-N 394.522 5.132 30 20 GKED O=C(Nc1ccc(F)cc1Cl)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618538807 AOJIPXGMWXAQBJ-HTQZYQBOSA-N 392.702 5.074 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)(F)F)c(Cl)c1)c1nc(C2CC2)cs1 626466612 HRGTZQWQRXWHRT-SNVBAGLBSA-N 386.782 5.063 30 20 GKED CCCc1[nH]ccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 643369702 BITZPIMSSGLRAZ-LBPRGKRZSA-N 377.391 5.086 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCSc2nc3ccccc3s2)cc1 726941583 DWBBBTRGPOLZBM-UHFFFAOYSA-N 381.526 5.034 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)NCc3ccc(OCC#N)cc3)cc2)cc1 727934919 HFPRHFLSIFKUGC-UHFFFAOYSA-N 387.439 5.011 30 20 GKED O=C1/C(=C/c2cccnc2Cl)CCc2nc(-c3ccc(Cl)cc3)sc21 728697429 FSXWEFRRMKCZHS-ZRDIBKRKSA-N 387.291 5.724 30 20 GKED N#CCOc1cccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c1 730147168 LPXYAKDBTIJZSZ-SILNSSARSA-N 396.471 5.622 30 20 GKED C[C@H](Nc1ccc(Nc2ncc([N+](=O)[O-])cc2C#N)cc1Cl)c1ccccc1 731026515 FWYZHCMRVJHYDJ-ZDUSSCGKSA-N 393.834 5.432 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C(\C)c3cccc(F)c3)n2)cc1 732497152 LKKQQSIVSVDRBD-NRJHKNTJSA-N 392.455 5.238 30 20 GKED C#CCCOc1ccc(CN[C@H](c2ccc(F)cc2)c2ccc(OC)cc2)cc1 733326251 RNRCEPMUQHOQQV-RUZDIDTESA-N 389.470 5.116 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)nc2)cc1 741468791 HUMLKRCWBAHCBM-LFIBNONCSA-N 392.458 5.715 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)c1ccccc1SCC#N 746624682 LLHMDIYKYIRXKR-UHFFFAOYSA-N 388.492 5.442 30 20 GKED N#Cc1csc(/C=C2\SC(=S)N(c3ccc4ccccc4c3)C2=O)c1 748662181 QPQXGKBBMVVCFB-MFOYZWKCSA-N 378.503 5.179 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1cnc(-c2ccccn2)s1 753162632 PJYKHWHALFCOOS-UHFFFAOYSA-N 384.508 5.241 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1ccccc1SCC#N 758872627 BSONKLVIIYMBNA-KRWDZBQOSA-N 379.529 5.242 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3c[nH]c4cccc(F)c34)cc2)c1 761659476 ZUKSBKQQGDBHDY-UHFFFAOYSA-N 385.398 5.010 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1cccc(C(=O)c2ccccc2)c1 762040481 PWPPSEBSORZJGY-OXJNMPFZSA-N 394.430 5.039 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N(CCC#N)c2ccc(C)cc2)c1 772611999 JPPFDKLXYDHLLZ-UHFFFAOYSA-N 384.479 5.621 30 20 GKED N#CCc1ccc(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1 776113070 AOGQJYOKCKEXBB-UHFFFAOYSA-N 384.407 5.171 30 20 GKED C=CC[C@@H](C(=O)O[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 778427476 FSLIVWBLQZTMLB-FXAWDEMLSA-N 376.456 5.318 30 20 GKED O=c1[nH]ccc2cc(NN=Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)ccc12 789073496 LWDJVFYBFXBVCE-UHFFFAOYSA-N 399.294 5.012 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(C3SCCS3)c2)cc1Cl 801610418 YGHJYOIXOCIKTP-UHFFFAOYSA-N 389.933 5.012 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc2nc(C(F)F)sc2c1 804722105 SHWYRFICQXTYDZ-UHFFFAOYSA-N 375.425 5.102 30 20 GKED N#C[C@@H](C(=O)CCSc1cccc(Cl)c1)c1nc2cc(F)ccc2s1 808984636 ZANRVAIJWCAFHF-AWEZNQCLSA-N 390.892 5.447 30 20 GKED CC(=NNc1nc(-c2ccccc2)no1)c1sc(-c2ccccc2)nc1C 814829135 JSPOWEHAOXYXHW-UHFFFAOYSA-N 375.457 5.005 30 20 GKED CN(C)c1ccc(C2(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)cc1 815010083 HMAWWGXGWDRAON-XMMPIXPASA-N 395.506 5.078 30 20 GKED CSc1ccc(CCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 842690264 RCYMZMDKZFZQGL-INIZCTEOSA-N 399.466 5.352 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC[C@@H]1CC1(Cl)Cl 844533499 BLFPCRZUGXCQIA-QWHCGFSZSA-N 386.348 5.176 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)OC(=O)[C@@H](C)CC#N 850864999 HLDNMPISPUIKMC-CMPLNLGQSA-N 393.306 5.035 30 20 GKED N#CCCCCCC(=O)OCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1 859692611 YEINIZZXJPICCA-UHFFFAOYSA-N 384.329 5.017 30 20 GKED CSc1ccc(/C=C/C(=O)[C@@H](C#N)C(=O)c2cc3c(s2)CCCC3)s1 860853150 DWTRIXQOURHWOX-IZPAUZPXSA-N 387.551 5.015 30 20 GKED C[C@@H](Nc1ccc(C#N)cc1Cl)c1cccc(NC(=O)c2ccccc2)c1 864020047 ULUYUSHBPGIDCX-OAHLLOKOSA-N 375.859 5.637 30 20 GKED O=C(/C=C/c1csc(Br)c1)c1sccc1Br 915115086 WCIGHRMFABDMFM-OWOJBTEDSA-N 378.110 5.231 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1 921164276 PYSOJAMUZLOJEM-UHFFFAOYSA-N 382.451 5.053 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3cccc(Cl)c3)s2)ccc1Cl 1776033295 AFSAMTPPYUVNMQ-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)c1ccc(Br)c(/C=C/C(=O)c2ccc3ccccc3c2)c1 1776131439 RCIXRVXJAVLBLM-CSKARUKUSA-N 381.225 5.197 30 20 GKED C=CCOc1c(Cl)cc(/C=C/c2ccc3cc(C(=O)O)ccc3n2)cc1OC 1776183176 VZPUECRUZLKWEE-QPJJXVBHSA-N 395.842 5.330 30 20 GKED CC(C)c1nn(C(C)(C)C)cc1/C=C1\CCCc2cc(C(=O)O)ccc2C1=O 1776385490 ZKCPTNXMXYWRBE-FOWTUZBSSA-N 380.488 5.062 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2F)cc1)c1ccccc1 1776469375 BFAHDVLECDOPLZ-STTHAQSSSA-N 390.410 5.560 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)cc1 1776794093 QXIDZMHAAMMZMA-CXUHLZMHSA-N 396.483 5.395 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)cc1 1776806034 WQXJVABSYFKUOX-ZRDIBKRKSA-N 387.273 5.386 30 20 GKED COc1cc(Cl)ccc1C(=O)OC(=NC1CCCCC1)NC1CCCCC1 1857788164 QOZZHSMQSZKLDH-UHFFFAOYSA-N 392.927 5.116 30 20 GKED C[C@@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(C#N)cc1 31432899 TWDGLWXBFAHRMC-SNVBAGLBSA-N 375.280 5.571 30 20 GKED CC(C)OCc1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)oc2ccccc12 48853695 VJODCLOOOPQMEI-GOSISDBHSA-N 384.435 5.396 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cs2)o1 51534564 GDVAQLMAWYHHDF-AWEZNQCLSA-N 391.477 5.325 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1Cl 63388800 ZAGNFZMNTYBSGW-UHFFFAOYSA-N 380.231 5.122 30 20 GKED Cc1ccc2oc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc2c1 66544585 JHQACNNBRZHDIN-QGZVFWFLSA-N 383.432 5.226 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC(F)(F)F)cc1 66802087 LKPJKQGGMQDAIO-GFCCVEGCSA-N 380.391 5.232 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1Cc2ccccc2S1 72025334 CCNWERUSHWBPRO-JOCHJYFZSA-N 386.476 5.315 30 20 GKED C[C@H](N[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(C#N)cc1 114747469 GVKCSGKXMBOAIO-QWHCGFSZSA-N 386.377 5.039 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccccc1OCc1cccc(Cl)c1 123481396 NMCKJFKTENNWBK-UHFFFAOYSA-N 392.842 5.074 30 20 GKED Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)c2cccc(CC#N)c2)c1C 172096475 AWNKSAHTPLOEMA-UHFFFAOYSA-N 399.281 5.114 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)NCc1ccc(OCC#N)cc1)C1CC1 175790433 RQZSEQYSBJYIHN-GOSISDBHSA-N 399.494 5.177 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc2ccccc2c1 175947461 VRKBTBQFUDSPQQ-KDOFPFPSSA-N 389.405 5.565 30 20 GKED COc1ccc(CNc2ccccc2O[C@H](C)C#N)cc1OCc1ccccc1 181133171 AJIXJDPAZVRWLH-GOSISDBHSA-N 388.467 5.177 30 20 GKED Cc1sc([C@@H](C)NCc2ccc(F)c(C#N)c2)nc1-c1ccc(Cl)cc1 184953569 CJUGDEUAXPKLQL-GFCCVEGCSA-N 385.895 5.634 30 20 GKED Cc1csc([C@H](C)CNC(=O)c2ccccc2Sc2ccccc2C#N)n1 186044526 QNXLFABKEYTGGW-CQSZACIVSA-N 393.537 5.008 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1 245410118 PMCZBTLGKGIUCZ-ZOCZFRKYSA-N 397.519 5.692 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 246693411 ISFGIVSLIGMGJC-QINHECLXSA-N 397.519 5.692 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@]2(C)[C@H](C1)C2(Cl)Cl 284490656 BNQFLJAWGXPXDT-PVUWLOKVSA-N 398.359 5.128 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@H](c1cccc(Cl)c1)c1ccccn1 301664762 NVHWIFBWDHXWQM-QGZVFWFLSA-N 388.780 5.222 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)CCc3ccc(C#N)cc3)c2)C1 303013560 ROFVXJTYKGWZOO-FDDCHVKYSA-N 376.500 5.225 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H](C)c1cccc(F)c1 304106183 YRFMWNMDCGFGKL-QGZVFWFLSA-N 388.442 5.327 30 20 GKED C[C@@H]1[C@@H](/N=C(/O)[C@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)CCC[C@H]1C 328723813 YFEZJSIAZFDKFI-SKPVNDSZSA-N 397.563 5.254 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(N=C(O)[C@H]3CCCN(C(=O)C4CC4)C3)c2)C1 328950191 CFGZPDCFRWAVMP-PIPMEXSNSA-N 398.547 5.019 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(COc2cc(C)ccc2C(C)C)cc1 428907118 NEQUTCLMGFJITJ-UHFFFAOYSA-N 379.504 5.465 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)F 433116788 LXSYCJOZRWBWQE-GUYCJALGSA-N 375.444 5.066 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1Br 437670049 PWLBCOAQYUEDHJ-MJGOQNOKSA-N 398.304 5.061 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)N[C@H](C)c1ccc(C#N)cc1)C1CC1 437839606 VACDLCVETDHFEK-MSOLQXFVSA-N 383.495 5.708 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CSC(C)C)c1C 438482058 ZWWRCHKSUYZDTN-UHFFFAOYSA-N 395.572 5.952 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccccc3F)n2C2CC2)c(Cl)c1 438820041 NZWLGPSTOZPJQY-UHFFFAOYSA-N 384.867 5.236 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(N[C@@H]3CC[C@@H](C#N)C3)cc2Cl)n1 442862492 OKUZXZHBTIEVQU-VXGBXAGGSA-N 376.913 5.385 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 444385720 XDGVJKLUUIMHIC-GFCCVEGCSA-N 395.356 5.403 30 20 GKED C=CC[C@H]1N(C(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CCCC1(C)C 444639264 YYLOUJMRIQCFOP-PZJWPPBQSA-N 383.580 5.087 30 20 GKED Cc1cnc([C@H](NCCC(C#N)(c2ccccc2)c2ccccc2)C2CC2)s1 444690380 SGPFIWPSJOXHJU-JOCHJYFZSA-N 387.552 5.392 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(Oc3ncccn3)cc2C)CCCC1(C)C 445240641 UYCSGRRSAUGBQC-LJQANCHMSA-N 380.492 5.176 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)c3c(F)cc(C#N)cc3F)c2)C1 445960740 QHPOLMXAJWYFEH-KBXCAEBGSA-N 384.426 5.184 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cnc(C(C)C)s1 448154072 BEDBDNKIYCQJOE-UHFFFAOYSA-N 391.496 5.278 30 20 GKED CN1CCC[C@H](CNc2ccc(C#N)cc2C(F)(F)F)[C@@H]1c1cccs1 462870151 JJUIELNINPZYRT-RDTXWAMCSA-N 379.451 5.134 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1)c1cccc(C#N)c1 463604697 SYSFYSCVLPRMFJ-CQSZACIVSA-N 377.831 5.141 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(c2ccccc2OC)CC1 475573227 KZIIDOBONGGDRO-UHFFFAOYSA-N 378.516 5.400 30 20 GKED N#CCc1cccc(C(=O)N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)c1 478102157 OWEJUWFBCXMOSH-UHFFFAOYSA-N 385.294 5.379 30 20 GKED C=C(C)[C@H](NCc1ccc(OCc2ccncc2)cc1)c1ccc(F)c(F)c1 479411960 BOVVKTJAMJWPCT-QHCPKHFHSA-N 380.438 5.346 30 20 GKED N#Cc1ccc(CNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)cc1F 479466192 YRLFQFFJFSFGLV-UHFFFAOYSA-N 387.336 5.516 30 20 GKED C[C@@H](CC(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2)c1c[nH]c2ccccc12 486116929 OAIDGKSDMMIHEH-SELVFMLMSA-N 389.543 5.373 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1 486241995 VILFEKJXXCYLFH-UHFFFAOYSA-N 387.411 5.205 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1F 499638302 XIOSBQLTACZWKK-KRWDZBQOSA-N 396.824 5.834 30 20 GKED C=CCN(C(=O)c1cc(-c2ccccc2Cl)on1)c1nc2c(s1)CCCC2 506575978 IHKWEWLAGMBYGH-UHFFFAOYSA-N 399.903 5.163 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cccc(F)c1 510540287 UUYGHGAYHKYTQQ-UHFFFAOYSA-N 375.403 5.120 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(C1CC1)[C@H](C)c1ccccc1 512270107 NOLZUQNKWDZMME-QZTJIDSGSA-N 393.556 5.245 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 519340507 ATEVVNOHFBYJFQ-UHFFFAOYSA-N 375.350 5.067 30 20 GKED COc1cccc([C@H](NCc2ccc(C#N)c(OC)c2)c2ccccc2Cl)c1 521122188 BHRJDNKYFLLMGJ-QHCPKHFHSA-N 392.886 5.108 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cccc(OC3CCCCC3)c2)c1 523101359 DOYKTQXVZSFHDF-UHFFFAOYSA-N 378.472 5.333 30 20 GKED C[C@@H](C[C@@H]1CCCO1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 524200522 RNEWUKXNIJPEMP-KSSFIOAISA-N 399.878 5.083 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)CCc1ccccc1 524613843 JSYGXCKCFRLLOP-ROUUACIJSA-N 398.597 5.631 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1 524955427 NIPRWBAGDVEFRW-UHFFFAOYSA-N 399.494 5.467 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cccc(-c3ccoc3)c2)cc1 536326769 WUFNUGDWQIESFV-UHFFFAOYSA-N 384.357 5.023 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)ccc1OCc1ccccc1 538151201 PRMOAMYMNABCHY-MOPGFXCFSA-N 386.495 5.558 30 20 GKED COC1CCC(CCNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 542635005 UVWPTHINSXMPTJ-UHFFFAOYSA-N 393.487 5.067 30 20 GKED C=CCNC(=O)c1cccc(-c2noc([C@H](C)Sc3ccccc3Cl)n2)c1 547063345 VISGFUOWEFGMLJ-ZDUSSCGKSA-N 399.903 5.159 30 20 GKED Cc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cnn1-c1ccc(F)cc1 550827912 SDBGPBCXPAUIBA-UZUQRXQVSA-N 376.479 5.406 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 550828084 WPVQQATYYRFLJD-HTAPYJJXSA-N 376.504 5.056 30 20 GKED N#CCC[C@H](NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1)c1ccccc1 554024660 GNDMSWAVULXWBD-VXKWHMMOSA-N 397.469 5.303 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1)C(F)(F)F 573403624 VOBXKKMMUCAPKG-GDBMZVCRSA-N 391.393 5.183 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1 578685727 PUURMXDGVPIFJO-UHFFFAOYSA-N 395.846 5.673 30 20 GKED COc1ccc(N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 578784843 XFSLGKKNLANFKL-CYBMUJFWSA-N 389.908 5.411 30 20 GKED C=CCn1c([C@@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@H]1c1ccsc1 580008371 HUKFDFJOOLCOIE-BEFAXECRSA-N 398.507 5.146 30 20 GKED C=CCC(CC=C)c1nc([C@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 583110415 DOOQOOADBXJZOK-MRXNPFEDSA-N 384.373 5.589 30 20 GKED N#C[C@@H](C(=O)c1ccnc(Oc2ccccc2)c1)c1nc2cc(F)ccc2s1 592974305 SEOUFRVMACYSJQ-INIZCTEOSA-N 389.411 5.113 30 20 GKED COc1cc(-c2ccccc2)ccc1CNC1(c2cccc(C#N)c2)CCOCC1 594984660 PUWTVZYXWIUTJJ-UHFFFAOYSA-N 398.506 5.029 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CC1(C#N)CCCCC1 597119973 AEYHENBVCIAOOW-UHFFFAOYSA-N 387.483 5.248 30 20 GKED N#CC1(CC(=O)N(Cc2cccc3ccccc23)c2ccccc2)CCOCC1 597479749 OORGTMCYTFAGRX-UHFFFAOYSA-N 384.479 5.083 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N3CCC[C@@H](CC#N)C3)c2)c1 597909769 OYEMJCLUFGFKRM-IBGZPJMESA-N 378.541 5.362 30 20 GKED CC(C)c1cc(C(=O)Nc2sc3c(c2C#N)CCCCC3)nn1C(C)(C)C 603750081 APIGRQUBVLGVFB-UHFFFAOYSA-N 384.549 5.216 30 20 GKED CCN(C[C@H](C)C#N)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 604352974 KVCVCAKMRBCXNW-OAHLLOKOSA-N 395.453 5.054 30 20 GKED C=CCCCN(C)C(=O)c1ccc(COc2ccccc2Br)cc1 605645011 LGXHEQRMJRZGJP-UHFFFAOYSA-N 388.305 5.066 30 20 GKED Cn1cc(Cl)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 609163940 DEJPBIJXEJYMQD-KRWDZBQOSA-N 384.266 5.240 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1c(F)cccc1F 609387064 IZDIAMAHWORZCU-LLVKDONJSA-N 386.389 6.162 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)CC1 609636093 OKOOZKYWXCLXAS-SFHVURJKSA-N 378.476 5.036 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2cccc(O)c2)cs1 610115437 XQYXYCHANWFJFQ-UHFFFAOYSA-N 397.459 5.307 30 20 GKED C[C@@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 610205633 ROSUKYVBKCCBJO-ZCYQVOJMSA-N 398.531 5.311 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 610357948 WOGSWVJFNXFBBX-XOBRGWDASA-N 395.915 5.423 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1)c1ccccc1 610972592 KCFCSVXDOCLUFD-RTWAWAEBSA-N 386.499 5.102 30 20 GKED C=CCn1c(S[C@H](C)c2c(F)cccc2F)nnc1-c1ccc(F)cc1 613936555 ARRGMJRWDSUJBE-GFCCVEGCSA-N 375.419 5.402 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccco2)s1)c1nc(-c2ccncc2)cs1 675917771 DKTMWEWXLONEKF-CYBMUJFWSA-N 377.450 5.017 30 20 GKED FC(F)Oc1ccc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1Cl 678298870 ZFURCGLZBJQFCM-DTORHVGOSA-N 397.693 5.114 30 20 GKED C=CCc1cc(C(=O)Nc2nc(-c3ccccc3)c(C)s2)cc(OC)c1OC 680428343 ZSSGKXMQHMGMLR-UHFFFAOYSA-N 394.496 5.117 30 20 GKED C=CCC[C@@H](C(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 681653700 WFIXPPSNRALULG-OWCLPIDISA-N 393.371 5.326 30 20 GKED C#Cc1cccc(N(C(=O)c2csc(-c3ccc(Cl)s3)n2)C(C)C)c1 728246163 ODPYNODFQJUOKA-UHFFFAOYSA-N 386.929 5.562 30 20 GKED O=C1NC(=Nc2cccc(C(F)(F)F)c2)S/C1=C/c1ccnc2ccccc12 731835486 GADVPBXFNPXEAD-LICLKQGHSA-N 399.397 5.145 30 20 GKED CC1(C)/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)C(=O)c2ccccc21 733083374 IOWPWEOEKKUJBC-WQRHYEAKSA-N 376.437 5.276 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC(C)C)c2ccccc2C)c1 733807285 UCMISVRFSRNGLB-NZQKXSOJSA-N 393.531 5.263 30 20 GKED C=CC[C@H](NCc1ccc(-c2ccc(Br)cc2)o1)c1ccncc1 734510601 XYYAIFYWBRYOPG-IBGZPJMESA-N 383.289 5.511 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccncc1 734657015 UOAOKKIBZSGFIQ-ZJSXRUAMSA-N 397.478 5.534 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CSc4ccccc43)n2)cc1 735769216 HMRJAHVVHSUSQK-DLBZAZTESA-N 376.506 5.184 30 20 GKED Cc1nc(C)c(C=NN(C(=S)Nc2cccc(Cl)c2)C(C)(C)C)s1 736429930 JPIYDHBXFUWMJH-UHFFFAOYSA-N 380.970 5.245 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 737844052 KGXGSNBZESEEMZ-LJQANCHMSA-N 391.446 5.081 30 20 GKED CCOc1ccc(C(CC)=NNc2cccc(C(F)(F)F)n2)cc1OCC 739421592 LNQKKBITXVLOHU-UHFFFAOYSA-N 381.398 5.124 30 20 GKED C#CCCNC(=O)c1ccc(N[C@@H](C)c2cc(Cl)ccc2Cl)c(C)c1 741284194 IVHCSYPTLCLRPI-AWEZNQCLSA-N 375.299 5.228 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1ccc(SCC(F)F)cc1 741759573 BYLAVMVGUPZPOK-UHFFFAOYSA-N 375.366 5.294 30 20 GKED COCc1ccc(/C=C/C(=O)c2sc(-c3ccc(OC)cc3)nc2C)cc1 741841078 JUYAPFCJLDYHNC-MDWZMJQESA-N 379.481 5.170 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(F)c(Br)c1 743058408 YOXOSCYBWNNOAG-FPYGCLRLSA-N 399.219 5.067 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C=Nn3c(S)nnc3C(F)(F)F)o2)cc1 743424671 OCHYBLANRGUKIQ-UHFFFAOYSA-N 394.422 5.025 30 20 GKED Cc1ccc(N(Cc2ccco2)Cc2nnc(-c3cccc(C#N)c3)o2)cc1C 744394724 ITCGHDCXTRUBCE-UHFFFAOYSA-N 384.439 5.025 30 20 GKED C#CCN(C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1)C1CCCCC1 744844981 AWCAZPFSVUWBFL-INIZCTEOSA-N 381.545 5.157 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2C)cc1 754221341 WJBGHORIRGBSRM-UHFFFAOYSA-N 382.460 5.159 30 20 GKED C=CCN(C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)C(C)C 756213938 JKJXQKWOHVAJFW-CYBMUJFWSA-N 377.941 5.439 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)O[C@H](C)CC#N)cc1 757891462 RXDCXPCPSMNNQD-MRXNPFEDSA-N 376.481 5.173 30 20 GKED C=CC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)c1ccncc1 766019212 KQFZQAMUKQYLPR-RTBURBONSA-N 395.959 6.143 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](Cn2cccn2)c2ccccc2)cc1 766135966 GLMJENRSTFVONR-GCJKJVERSA-N 381.907 5.107 30 20 GKED Cc1cc(Cl)cc2c1OCC/C(=C\c1cnc(-c3ccncc3)s1)C2=O 768498317 HNPGHBBHCXIDBW-NTEUORMPSA-N 382.872 5.216 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccccc2CN(C)C2CCCCC2)cc1 770510838 KBFJVTIYTGGAPV-IBGZPJMESA-N 377.532 5.354 30 20 GKED CS[C@@H](C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773771974 USVWSLKYOSODNJ-GWCFXTLKSA-N 399.368 5.825 30 20 GKED CN1C(=O)CCc2cc(/C=C3\CCc4cc(SC(F)F)ccc4C3=O)ccc21 774138005 HTFUBSLMMMLGIY-LFIBNONCSA-N 399.462 5.123 30 20 GKED C[C@@H](N[C@H](c1ccc(Br)cc1)C1CCC1)c1ccc(OCC#N)cc1 776157603 COLMARFMEPWKLN-VFNWGFHPSA-N 399.332 5.543 30 20 GKED CCOc1cc(/C=C2/CCc3ncc(C(F)(F)F)cc3C2=O)cc(Cl)c1O 777468734 XELJYBOSEHBPIC-WZUFQYTHSA-N 397.780 5.071 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1 787017702 JEDZDDIHKNZDCW-RYUDHWBXSA-N 390.858 5.705 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc(Cl)c(F)c2)c(-c2ccccc2)n1 788352808 CVGAMSBLPVWAGC-NTMALXAHSA-N 379.822 5.152 30 20 GKED FC(F)(F)c1cnc(C=NN(Cc2ccccc2)Cc2ccccc2)s1 788421788 XNMOBZFRYGZIGW-UHFFFAOYSA-N 375.419 5.198 30 20 GKED C#CCC1(C(=O)Nc2ccc(Sc3nnc(C)s3)cc2C)CCCCC1 788443499 RVXLJRZJUZBFRW-UHFFFAOYSA-N 385.558 5.218 30 20 GKED N#C[C@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1cnc2ccccc2n1 792105072 TUJOAUKIGSYXJX-YADHBBJMSA-N 391.474 5.223 30 20 GKED Cc1cc(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)sc1Br 794733468 WUGUJGADOMHFMF-ZCRIDZFUSA-N 376.275 5.006 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C2(c3ccc(F)cc3F)CCCC2)s1 797568037 NYWKTPJQUURFBB-CQSZACIVSA-N 388.483 5.407 30 20 GKED CC(C)(C)c1nnc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 843300033 CKFGJQYWZNIBGV-UHFFFAOYSA-N 399.310 5.269 30 20 GKED N#CCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 847626738 RKGWLGSPFMTHIL-CYBMUJFWSA-N 378.284 5.377 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)(F)F)cc2)cc1 916948371 URFULDSNQBXPQI-SCLBCKFNSA-N 388.389 5.180 30 20 GKED N#C[C@@H](C(=O)CC1CCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916997537 WBCYYCMVOKYTRN-AWEZNQCLSA-N 379.312 5.873 30 20 GKED O=C(/C=C/c1cccc([N+](=O)[O-])c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605095 NUHUSCFKUDQQIY-CMDGGOBGSA-N 380.381 5.128 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 920019816 VDGRGIJJPOLIEI-CYBMUJFWSA-N 377.362 5.075 30 20 GKED CCc1cc(C(=O)O)c(C=NN(Cc2ccccc2)Cc2ccccc2)s1 1776023325 ZWUZKABBIXBODJ-UHFFFAOYSA-N 378.497 5.045 30 20 GKED C=C(Cl)C[C@H](NCc1ccc(Oc2ccccc2CC)cc1Cl)C(=O)O 1776143321 UCWLULAXOSRXOR-SFHVURJKSA-N 394.298 5.380 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cc1c(C(=O)O)sc2cccc(F)c12 1776180292 UMJZQDLBHUJMEI-UHFFFAOYSA-N 395.908 5.642 30 20 GKED CC(C)(C#N)c1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776231043 VPCWRRXRQRGLMQ-XGICHPGQSA-N 385.419 5.342 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccsc2)nc1 1776354583 NZBBGPBQPFIKHD-DAXSKMNVSA-N 393.464 5.192 30 20 GKED C=CCCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H](C)CC)CC1 1823751360 RZMCDSOKQMPRDN-FPOVZHCZSA-N 390.612 5.035 30 20 GKED C=CCn1c(SCC(=O)Nc2c(C(C)C)cccc2C(C)C)nnc1C1CC1 36799990 VGFVYWJRFCOAPF-UHFFFAOYSA-N 398.576 5.319 30 20 GKED C=CCNc1nnc(S[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)s1 59407674 WJAZIGKQHIBPTB-AWEZNQCLSA-N 396.541 5.242 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC(C)C)c1cccs1 63403194 BUIMHEQQCJOLRZ-GOSISDBHSA-N 387.505 5.141 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(Cl)ncc1Cl 129702012 VZJVEOGTJJYECA-UHFFFAOYSA-N 398.249 5.613 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1cc(C(F)(F)F)ccc1F 150974413 BRAPJOMRWPMCHP-UHFFFAOYSA-N 380.263 5.071 30 20 GKED C=CCn1c(-c2cccs2)nn(CN(CC)[C@H](CC)c2ccncc2)c1=S 161029921 AMNMUCLZYJMZQA-QGZVFWFLSA-N 399.589 5.154 30 20 GKED COc1ccc(Br)cc1CNc1ccccc1SCCC#N 178386317 NTYUKONMYIXFNJ-UHFFFAOYSA-N 377.307 5.076 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](CC)c2ccc(Cl)s2)ccc1OC 180812517 AEHVZZASDSLWIY-HUUCEWRRSA-N 378.925 5.332 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl)c1ccccc1 187390705 RPGLDCWCMIOWCK-GOSISDBHSA-N 384.907 5.119 30 20 GKED C[C@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1C(F)(F)F 190876309 AEUGIPRHMXFSBM-OLZOCXBDSA-N 378.419 5.398 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(Cn2ccnc2)cc1 191486671 HCWZXRWKUYZCPP-UHFFFAOYSA-N 388.515 5.105 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OCC#N)cc2)cc1OCc1ccccc1 213177826 QHCMZOYQKXEPDY-QPEQYQDCSA-N 399.446 5.073 30 20 GKED Cc1cc(C)cc(N=C(O)[C@@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c1 328717967 UVJUCZNJHZZCJB-VGOFRKELSA-N 391.515 5.377 30 20 GKED OC1=NC[C@H]([C@H]2CCCCN2C(O)=Nc2cccc(-c3cccc(Cl)c3)c2)C1 329140354 SZGFQZADVATKBM-YLJYHZDGSA-N 397.906 5.383 30 20 GKED Cc1c(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)cnn1C1CCCCC1 329713994 SHWGOQRNTDORSW-NRFANRHFSA-N 395.551 5.391 30 20 GKED OC(=Nc1cc(N=C(O)[C@H]2CC23CCCC3)c(F)cc1F)[C@H]1CC12CCCC2 329960483 RDNJXFVZKPIZNR-ZIAGYGMSSA-N 388.458 6.301 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)c1 412171134 TYVRQEFUXWGPOT-HBMCJLEFSA-N 398.428 5.434 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1nc(-c2ccccc2)cs1 435898041 NDUVPSDSGCEMHX-UHFFFAOYSA-N 384.464 5.481 30 20 GKED CCN(C(=O)CCCSc1ccc(OC)cc1)[C@@H](C)c1ccc(C#N)cc1 436141113 MRJGJLYQPOWQHR-KRWDZBQOSA-N 382.529 5.049 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(F)c(O)c(Cl)c3)cc2)cc1 436932237 BORURYNAMYWLBU-UHFFFAOYSA-N 382.778 5.101 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@@H]1Cc1ccccc1Cl)c1ccccc1 438850964 WORPATCOAHDCMG-CTNGQTDRSA-N 381.907 5.102 30 20 GKED N#CCC[C@H](NC(=O)CCCc1cc(Cl)sc1Cl)c1ccccc1 439671355 PIGZPXJBDFBFBA-HNNXBMFYSA-N 381.328 5.539 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2nc(C3CCCC3)no2)cc1 439695241 YCDXMVZPNFGWLR-UHFFFAOYSA-N 392.846 5.172 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 439965933 IKPKFOKUKZDDEN-IAGOWNOFSA-N 384.570 5.589 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(C(=O)N[C@@H](C)CC)cc2C)CCCC1(C)C 445241418 WTRCWGUNMDQQHN-PXNSSMCTSA-N 385.552 5.122 30 20 GKED CC(C)[C@H]1CCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 446223762 BDOZKHKQDDUCCS-HSZRJFAPSA-N 391.515 5.374 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 457700471 PNAIPQMUNMINEX-OIBJUYFYSA-N 381.238 5.014 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccccc1 458794236 AOZHHIMSTAZFCZ-OAQYLSRUSA-N 393.512 5.488 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)cc2o1 470876832 AGCKFQBRYAXBTN-UHFFFAOYSA-N 397.434 5.148 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)[C@H]1CCOC1 475575770 SNDBSJGIOWONHI-UNMCSNQZSA-N 378.516 5.438 30 20 GKED Cc1cc(C)c(NC(=O)COc2ccc(Oc3ccc(C#N)cc3)cc2)c(C)c1 480331741 SXYKNJZKLJROQJ-UHFFFAOYSA-N 386.451 5.293 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2c(F)cccc2F)c1)c1cnc2ccccc2n1 483220871 PUVPPVAKJHSDFH-MRXNPFEDSA-N 385.373 5.065 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NCc1ccccc1C(C)(C)C#N 486430354 AFMXEMCTYONLNM-UHFFFAOYSA-N 383.495 5.661 30 20 GKED C[C@@H](SCCC(=O)Nc1ccccc1C#N)c1cccc(Br)c1 487885816 ZRAGPBRIRJYQFM-CYBMUJFWSA-N 389.318 5.144 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1ccc(Cl)cc1Cl 501021287 VZSFZESNNQIBTM-UHFFFAOYSA-N 385.250 5.234 30 20 GKED CSc1ccccc1[C@@H](C)NCC(=O)Nc1ccccc1S[C@@H](C)CC#N 501488411 CJOYZIJKEAJIKD-JKSUJKDBSA-N 399.585 5.092 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]3c3cccc(Cl)c3Cl)CC2)cc1 503900070 HERBSYJDQQYSCA-OALUTQOASA-N 397.305 5.284 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 504156661 PPYLMSULGNODON-HNNXBMFYSA-N 397.569 5.639 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2)cc1Cl 510023073 JFTQMUHDVFWPJX-HXUWFJFHSA-N 375.859 5.317 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 510826575 BCJHJQNYNMCICF-IBGZPJMESA-N 376.378 5.163 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 518256992 VURBVCXKZDZGLC-MJGOQNOKSA-N 381.545 5.642 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2csc(-c3ccsc3)n2)CC1 521172135 AYBJAPVBVFLYMY-UHFFFAOYSA-N 395.553 5.223 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)oc2c(Cl)cccc12 521352752 NPDCFFHSXRUBPS-HNNXBMFYSA-N 392.764 5.408 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cnc(C2CC2)s1 521520062 NQLMWUBQRUYJQM-UHFFFAOYSA-N 389.480 5.032 30 20 GKED CC(C)N(CCC#N)C(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1 523281484 RVOOLDOMGBRCFA-NRFANRHFSA-N 386.948 5.313 30 20 GKED CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(Cl)c(C#N)c2)c1 525016422 LMPVTIKULNMOMG-UHFFFAOYSA-N 390.270 5.102 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F 525813915 CGGVYJAPPNLNMV-HNNXBMFYSA-N 389.421 5.258 30 20 GKED COc1cc(NC(C)=O)ccc1[C@H](C)NCc1ccc(-c2ccccc2C#N)cc1 539214393 JOFPYVZWRSIBPJ-KRWDZBQOSA-N 399.494 5.043 30 20 GKED C[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(NC(=O)c2ccccc2)c1 540705268 MLLVQQSLBQXURL-IRXDYDNUSA-N 387.458 5.361 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(-c2cnco2)cc1 540876597 KYOAYHUGGXGMJH-UHFFFAOYSA-N 381.391 5.258 30 20 GKED C[C@@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccc(-c2cccc(C#N)c2)cc1 542012297 DMNHUWJQNOMWIZ-QGZVFWFLSA-N 397.453 5.870 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(F)F)c1Cl 542725269 UDDUUUHJGLKRLX-UHFFFAOYSA-N 391.849 5.839 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(-c2ccccc2)o1 544084391 HDJPNVAFVJRVBR-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Nc2ccc(C(F)(F)F)cn2)cc1 588460505 UWBVSXCUNCNNEW-UHFFFAOYSA-N 376.382 5.257 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H](C3CC3)C2)cc1F 589000383 HVDASNJOPKCQRF-QGZVFWFLSA-N 379.435 5.144 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(Br)s3)cc2)ccn1 589324417 JIIJILITAHTRGS-UHFFFAOYSA-N 386.274 5.182 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2ccc(OCC)cc2)c1 589740869 GODUHUUUAFDSDK-QFIPXVFZSA-N 380.488 5.409 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(F)cc2)n1)c1nc2cc(F)ccc2s1 592975842 VAEPOOXTHRKNKG-ZDUSSCGKSA-N 397.431 5.188 30 20 GKED C=CCN(C(=O)Cc1c[nH]c2ccc(F)cc12)c1nc(-c2ccccc2)cs1 604211844 REIOKFIMKBIJLY-UHFFFAOYSA-N 391.471 5.192 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4ccccc4[nH]3)cc2F)c1 609103913 IKECOMXEPYWRBB-UHFFFAOYSA-N 385.398 5.010 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3ccccc3SCCC#N)s2)c(C)c1 609375613 XAXVKBSVYWUXDB-UHFFFAOYSA-N 393.537 5.685 30 20 GKED CC[C@@H](C)C(=O)Nc1cccc(CNc2ccc(C#N)cc2C(F)(F)F)c1 609961381 JBEFKALNYXIEMI-CYBMUJFWSA-N 375.394 5.174 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)c2cc3ccccc3n2CC#N)o1 610050735 YAEZXYIUJZWKSX-HXUWFJFHSA-N 375.472 5.078 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CCCOc3cc(Cl)ccc32)c(Cl)c1 611432680 MMRSKFMRTGESFL-HNNXBMFYSA-N 395.673 5.162 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 615081365 BDDGXJAJLZPRML-VQTJNVASSA-N 389.417 5.032 30 20 GKED Fc1ccc(-c2cnc(CN3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)o2)cc1 618453821 UYWWWNIVIKOVOT-RYUDHWBXSA-N 396.306 5.043 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccc(F)cc2C(F)(F)F)cc1OC 728006873 USHKDJDSTPGZEK-UITAMQMPSA-N 395.352 5.070 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1 728118377 WNYRXMXLMFIHSQ-IBGZPJMESA-N 390.405 5.639 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(-c2cccc(C)c2)n(CC)c1=S 729469651 DBNGDTABIBBIJF-UHFFFAOYSA-N 385.581 5.019 30 20 GKED Cc1ccc(NC(=S)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 730954801 LAGWNGHEVFHGIH-UHFFFAOYSA-N 395.475 5.829 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 730989645 MBRBRNRNGUVECB-ZDUSSCGKSA-N 395.459 5.293 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1F 731317360 DSHGSRLYNVLJEV-UHFFFAOYSA-N 393.443 5.307 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccccc3)[nH]2)cc1 732495918 KQAKBCKYNPMWPG-UZLBHIALSA-N 385.467 5.156 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)sc21 733258802 LUSUQGKPHBYSCB-MRXNPFEDSA-N 379.872 5.041 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2nccn2Cc2ccccc2)cc1OC 734094333 CCBYKIBATOCSML-ACCUITESSA-N 390.483 5.015 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)c3cccc(Oc4cnccn4)c3)cc2)cc1 736454754 MWSWYJXURDUJDH-UHFFFAOYSA-N 393.402 5.027 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)/C=C/c2ccccc2C#N)c1 736502173 XBTQLVPNABKTLJ-VQHVLOKHSA-N 376.403 5.173 30 20 GKED C[C@@H](NC(=S)N[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 743059192 BHYZBRMUHQCUMN-VXGBXAGGSA-N 378.328 5.151 30 20 GKED C[C@H](NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1cccc(C#N)c1 743778877 QBVZUYUMHFSPNC-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED Cc1ccc([C@@H](C)C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 744037629 ASNZTVHMQVBTPW-PWSUYJOCSA-N 378.375 5.197 30 20 GKED Fc1ccccc1-c1nnc(S)n1N=Cc1sc2ccccc2c1Cl 744738626 BRIDZEZPAWIEMY-UHFFFAOYSA-N 388.880 5.123 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Cl)s2)ccc1OCC(F)(F)F 750896087 MTDLYKSUGCXHRB-RQOWECAXSA-N 376.783 5.247 30 20 GKED N#Cc1ccc(/C=C2/CC3(CCOCC3)C/C(=C/c3ccc(C#N)cc3)C2=O)cc1 751517242 KDPPXGOZHQBTAE-GACBQCINSA-N 394.474 5.057 30 20 GKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 753920119 DRFOIUYQEFFJHU-VYDXJSESSA-N 393.437 5.597 30 20 GKED C#CCCCC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 757799723 HPVRSFVRHMXKMN-UHFFFAOYSA-N 389.307 6.071 30 20 GKED CC(C)c1ncc(/C=C2\CSC/C(=C\c3cnc(C(C)C)s3)C2=O)s1 758428213 BGDOTAWMSXNEFZ-ACFHMISVSA-N 390.599 5.629 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@@H](C)c2cc(F)ccc2F)c1C(F)F 768151564 USETVZXABAYOAV-ZETCQYMHSA-N 398.278 5.056 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2sccc2Br)c1 772985738 XSVRIBFGURBZOH-TZMCWYRMSA-N 379.323 5.042 30 20 GKED N#Cc1ccc(F)c(CN[C@@H]2CCCc3nc(-c4ccccc4F)sc32)c1 773030590 UIIOPRUIPMKBJM-GOSISDBHSA-N 381.451 5.127 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(C(F)F)c3)n2)cc1 790769740 XSCSPLMKHAGUMC-QGZVFWFLSA-N 398.434 5.175 30 20 GKED COc1ccc(Cl)cc1NC(=S)N(Cc1ccc(C#N)cc1)CC(C)C 792675865 AWHXRCIPIAVNOK-UHFFFAOYSA-N 387.936 5.075 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CSc3ccc(Cl)cc3C2=O)cn1 792870247 PKBIBFZYSAHCSC-ZSOIEALJSA-N 394.883 5.178 30 20 GKED CN(C)c1ccc(C=NOc2ccccc2C(F)(F)F)c(C(F)(F)F)c1 794524305 RIAPDMFOIJUNLI-UHFFFAOYSA-N 376.300 5.203 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ncc(-c3ccccc3F)o2)s1 797568395 RBXSPDLXPSFZPF-AWEZNQCLSA-N 397.475 5.044 30 20 GKED CC(C)(CCC#N)COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 798879294 KNBYHCZKXUSFPC-UHFFFAOYSA-N 383.300 5.604 30 20 GKED COC[C@H](C)[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 813060477 ASPOQYPTCVHNDP-MJVIPROJSA-N 397.327 5.212 30 20 GKED N#C[C@H](C(=O)COc1ccc(-c2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 813214271 QEIXVVCAJGWEMW-IBGZPJMESA-N 396.368 5.023 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2scnc2C(F)(F)F)s1 813395896 BRDYDLHVMHMRDD-UHFFFAOYSA-N 392.472 5.169 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1ccc(SC(F)F)cc1)c1ccccc1 814209521 BJWNZEJRVJEGEM-QGZVFWFLSA-N 391.512 5.723 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1[N+](=O)[O-] 814306294 ZNXGPCKCXMIGKP-FQEVSTJZSA-N 399.450 5.167 30 20 GKED Cc1ccc(C(=O)N(CC#N)c2ccc(Cl)cc2)cc1NC(=O)OC(C)(C)C 843611177 WXTGMKFQPZAYPZ-UHFFFAOYSA-N 399.878 5.166 30 20 GKED CCCCC/C(C=Nn1c(SC)nnc(C(C)(C)C)c1=O)=C\c1ccccc1 912828523 VXKIGFISPRKTLR-NNQSBTTHSA-N 398.576 5.156 30 20 GKED O=C(/C=C\c1ccc(OCc2ccccc2)c(Br)c1)c1cccnc1 916136961 AWHQVDJSODVKAB-NTMALXAHSA-N 394.268 5.319 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCOc3ccc(F)cc3)n2)cc1 916975411 ZCKNZSCNBVFIQX-LJQANCHMSA-N 394.471 5.293 30 20 GKED Cc1cc(NN=Cc2ccc3oc(C(=O)O)cc3c2)nc2ccc(Cl)cc12 1776021490 IBLJOGISUPXTFA-UHFFFAOYSA-N 379.803 5.087 30 20 GKED O=C(O)c1ccc(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)cc1F 1776074933 CJKHVTMNWULGHG-GFCCVEGCSA-N 380.341 5.278 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776119736 KFVCHUYKJKXSSP-QBFSEMIESA-N 390.504 6.307 30 20 GKED C#CCCOc1ccc(CN[C@@H](CC(=O)O)c2ccc(-c3ccccc3)cc2)cc1 1776134493 MYTAIKSXBNUESO-VWLOTQADSA-N 399.490 5.061 30 20 GKED C=CCCC1(C(=O)O)CCN([C@@H](CC)c2ccc(Br)cc2)CC1 1776168278 BTUFLXUOALNWIU-KRWDZBQOSA-N 380.326 5.033 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)s1 1776339922 QLMMEWSWMFMLNO-YFHOEESVSA-N 380.465 5.801 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CSCC=C(C)C)C(=O)O)cc1 1776788466 YBBJHPHIVAHYKG-NRFANRHFSA-N 393.593 5.278 30 20 GKED C=CCn1c(SCc2cc(C(C)=O)ccc2OCC)nnc1-c1ccccc1 3517973 PCUZCSNSACIMQJ-UHFFFAOYSA-N 393.512 5.025 30 20 GKED Cc1cccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)c1 23164386 OZJBPXBIKQJPPU-OUKQBFOZSA-N 375.855 5.797 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2ccc(Cl)cc2F)cc1 31814472 XRTVPVVRRULGSG-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#C[C@H](C(=O)c1ccccc1OCc1ccc(F)cc1)c1nc2ccccc2o1 41545624 YQERLHKOQQAPHR-GOSISDBHSA-N 386.382 5.036 30 20 GKED C=CCN(C(=O)CCCOc1ccccc1F)c1nc(-c2ccccc2)cs1 58041068 TZKFLDXECOBHBZ-UHFFFAOYSA-N 396.487 5.327 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)c1ccccc1Sc1ccccc1C#N 65802781 IQSPLACMODKMCS-HNNXBMFYSA-N 378.522 5.132 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 66390062 MTVXFFFRSPKRGK-GOSISDBHSA-N 385.467 5.407 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 108408313 SMCQIOVENIMFLI-YJBOKZPZSA-N 381.545 5.303 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2cccs2)Cc2cccs2)cc1 113539746 IKAXHQLZQAPNBC-UHFFFAOYSA-N 395.553 5.845 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)Nc3ccc(F)cc3OCC#N)c2c1 120159291 TYNJAALGHBDKFM-UHFFFAOYSA-N 389.430 5.023 30 20 GKED Cc1csc(-c2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2)n1 120519489 JPNZXJKQFMXKSE-LJQANCHMSA-N 376.485 5.285 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Nc1cccc(OCCCC#N)c1 120607678 ZJGWSSLLUVAOTA-QZTJIDSGSA-N 379.504 5.322 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(-c2nccs2)cc1 124416797 DBUBOJUGBDQXEZ-UHFFFAOYSA-N 379.485 5.039 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1c(Cl)nc2sccn12 132789963 VSWIHXYRZJQIKC-ONEGZZNKSA-N 377.903 5.130 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)cc1 179993741 BZXXSGYNVSCPPT-UHFFFAOYSA-N 379.419 5.158 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ncccc3C(F)(F)F)cc2)cc1 180022716 PNHOKFVJJYGGFD-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ncc(-c2ccccc2)o1 191516746 BIJAHIZIJKYDPU-QGZVFWFLSA-N 389.499 6.076 30 20 GKED CC(C)(C)c1nnc(SCCC(C#N)(c2ccccc2)c2ccccc2)o1 193067357 IZNYHLSCXUIKPV-UHFFFAOYSA-N 377.513 5.359 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2cccc(OCCCC#N)c2)s1 194135191 XTWMDNZYZOIQPG-UHFFFAOYSA-N 377.469 5.053 30 20 GKED N#CCCn1cc(C(=O)CSc2ccccc2Br)c2ccccc21 247704942 CTTWJRWBYCCHIG-UHFFFAOYSA-N 399.313 5.292 30 20 GKED N#Cc1ccccc1/C=C(\Cl)c1nc(O)c2c(-c3ccccc3)csc2n1 255315599 LZCAPHXIPLOZMQ-YVLHZVERSA-N 389.867 5.672 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC([C@@H](O)c2ccccc2)CC1 276437889 QUFBWVVPHYBLLY-DEOSSOPVSA-N 392.543 5.516 30 20 GKED OC(C[C@@H]1CCOC1)=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 329730702 DGJQPHWCYIKQMP-ZDUSSCGKSA-N 381.501 5.185 30 20 GKED C=CCCC1(C(=O)N2CCC(F)(c3ccccc3OC(F)(F)F)CC2)CC1 410170758 MXCNPXHUDVOFLL-UHFFFAOYSA-N 385.401 5.119 30 20 GKED COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c(Cl)c1 424284821 TUNKTZYGGQUFMP-OAHLLOKOSA-N 397.906 5.105 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)c(Cl)c1 426161288 LTCSAIOUFUHAOL-IBGZPJMESA-N 397.265 5.171 30 20 GKED CCCOc1cc(O)ccc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 429754632 CQDFGPVESZCFBY-CQSZACIVSA-N 385.489 5.219 30 20 GKED C=CCn1c(S[C@@H](C)CCSc2ccccc2)nnc1-c1cccnc1 431241982 INSHIYROBMKRJP-INIZCTEOSA-N 382.558 5.189 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccccc1 431873603 UQRQTLPKRWVONV-MRXNPFEDSA-N 398.919 5.184 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@H]1C 438667234 KBXAJKJCJXGAFU-PFKNGNAYSA-N 395.528 5.013 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 441059290 GNFKFRNNKCMDDW-OAHLLOKOSA-N 393.478 5.343 30 20 GKED C[C@@H](NCC1CCC(C#N)CC1)c1ccc(Br)cc1C(F)(F)F 442858265 RMSUIALEKDEALF-PNESKVBLSA-N 389.259 5.448 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC=C(c2cccc(Cl)c2)CC1)c1ccccc1 458827981 DQECLTZQVQPQDJ-JOCHJYFZSA-N 393.918 5.574 30 20 GKED COC[C@@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458835764 KHWOYHJYFJRIGS-RTWAWAEBSA-N 399.922 5.104 30 20 GKED CC(C)c1cnc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 460554888 DKDXSRGZCRHKQT-UHFFFAOYSA-N 377.469 5.377 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1)c1ccccc1 472507245 VDCXOGKVRBBOFG-OXJNMPFZSA-N 381.435 5.193 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 475549901 QBXCQDXBCUYDEC-RBBKRZOGSA-N 396.506 5.719 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)[C@@H]1c1cccc(F)c1 475550464 TWOMJSNFYWJEFD-GAJHUEQPSA-N 380.507 6.293 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 475738085 OFWHYADSALAIAX-UHFFFAOYSA-N 383.439 5.216 30 20 GKED CCN(C(=O)[C@H](C)Oc1cccc(Cl)c1Cl)[C@H](C)c1ccc(C#N)cc1 480045949 RZWAOFYJUYGRPX-KGLIPLIRSA-N 391.298 5.242 30 20 GKED CCN(C(=O)c1cc(Cl)ccc1OC(F)F)[C@H](C)c1ccc(C#N)cc1 482560600 QJDZKXGVXQXSIE-GFCCVEGCSA-N 378.806 5.036 30 20 GKED Cc1nc(CN(C(=O)C[C@@H](CC#N)c2ccccc2)c2ccc(F)cc2)cs1 483306226 JQTWUVSJYWWYIB-GOSISDBHSA-N 393.487 5.211 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)[C@@H]1C 483644117 DQLCCXLBHLQWIT-LSDHHAIUSA-N 383.879 5.053 30 20 GKED Cc1cccc(-c2nc(CC(=O)N[C@@H](CCCC#N)c3ccccc3)cs2)c1 487220291 OZDCDCUTTLWAPK-NRFANRHFSA-N 389.524 5.212 30 20 GKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)cc1Br 487422378 UWUABZVIZBGWKC-IBGZPJMESA-N 385.305 5.231 30 20 GKED N#CCCC[C@H](NC(=O)COc1ccc(-c2ccccc2)cc1)c1ccccc1 487588569 BHSQMOWHZLPJMP-DEOSSOPVSA-N 384.479 5.284 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccccc1 488009372 AMZCAMFQBOSCPJ-IBGZPJMESA-N 386.470 5.420 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)n1 488695886 AONAIAGFNKLJLB-MRXNPFEDSA-N 392.528 5.375 30 20 GKED C[C@H](N[C@H](C)c1ccc(C(=O)N(C)C)cc1)c1ccc(-c2cccc(C#N)c2)cc1 494928264 DEJHQCGWXMZHLT-RBUKOAKNSA-N 397.522 5.339 30 20 GKED Cc1c(Cl)cccc1C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 495095934 ZQNRQRYEFQWXHL-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CC=C(c3ccccc3)C2)cc1 501569798 SIGQQEAMEVFNDB-UHFFFAOYSA-N 384.410 5.029 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 503201695 PSKAWXVUKDDFFZ-ICSRJNTNSA-N 393.556 5.628 30 20 GKED CCC[C@@H]1C[C@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 504077474 SFHZUYDBSYYTCT-YFVAEKQCSA-N 396.918 5.529 30 20 GKED N#CCCN(Cc1cccnc1)Cc1cccc(OCc2ccccc2Cl)c1 505864742 QCMIDXWWWAXQSM-UHFFFAOYSA-N 391.902 5.230 30 20 GKED Cc1c(C(=O)N[C@H](C)c2nc(C(F)(F)F)cs2)sc2ccc(C#N)cc12 508914965 PJHRVOWMISEAFB-SECBINFHSA-N 395.431 5.048 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@H]3CCC[C@@H]3c3ccccc3C(F)(F)F)CC2)c1 509992880 QRODNVUKXPSKFC-QUCCMNQESA-N 398.428 5.061 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1 511940775 KFAOBKBMKMMNDV-UHFFFAOYSA-N 394.377 5.549 30 20 GKED C[C@H](Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1ccc(C#N)cc1F 512276459 DCUXKEXKUIZYNL-KRWDZBQOSA-N 399.469 5.002 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cccc(-c3ncco3)c2)cc1 513966609 UZUBPNBAPCVPCR-UHFFFAOYSA-N 395.418 5.045 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4c(s3)CCCC4)n2)cc1 518516436 BUQJIAWCWGABCY-INIZCTEOSA-N 394.521 5.249 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1 518709513 ZYJGSJZEJCNSLV-HXUWFJFHSA-N 379.891 5.042 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@@H]2CCc3ccccc32)cc1 520349250 YGWRHMFLAAGPKT-NRFANRHFSA-N 398.531 5.310 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3c[nH]c4ccccc34)cc2)cc1 521355777 CUDONIXSDGVMSX-UHFFFAOYSA-N 381.435 5.403 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1ccccc1COCc1ccccc1 523759541 ZQQVHECTVIYOEO-UHFFFAOYSA-N 397.400 5.301 30 20 GKED C=CCCC[C@H](C)NC(=O)N(CCC)Cc1nnc(-c2ccccc2Cl)o1 537265278 GKBCNXYKCCEMJG-HNNXBMFYSA-N 390.915 5.056 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541156559 JPHXKDALENVQEJ-HOYKHHGWSA-N 398.510 5.474 30 20 GKED C[C@H](NC(=O)N1CCC(CC#N)CC1)c1ccccc1-c1ccc(Cl)cc1 542849494 HFZWKHUIQSDIRZ-INIZCTEOSA-N 381.907 5.403 30 20 GKED CC(C)[C@H]1C[C@H](CC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542928925 XFLGPIWEVPTJPU-XLNZFTOWSA-N 390.527 5.244 30 20 GKED C[S@@](=O)Cc1cc(NC2CCC(C#N)(c3ccccc3)CC2)ccc1Cl 543114709 OTLZPCSVXHGWIY-GJEQZTTHSA-N 386.948 5.035 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC=C(c3ccco3)C2)cc1 552265491 BSHUJRLDUQVLNA-UHFFFAOYSA-N 388.398 5.012 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1c1ccccc1 554444905 UBAUZBUQFPUWRY-YTQUADARSA-N 379.529 5.396 30 20 GKED N#Cc1cccc(C2(N[C@H]3CCCc4nc(-c5ccc(F)cc5)sc43)CC2)c1 563800251 IDZFNPLOVAITRC-FQEVSTJZSA-N 389.499 5.477 30 20 GKED CCC(=O)c1ccc(OCCCCC(=O)Nc2sc(C)c(C)c2C#N)cc1 567151798 GTLOCAOCAXLCMJ-UHFFFAOYSA-N 384.501 5.017 30 20 GKED N#C[C@H](C(=O)c1cc[nH]c1C1CCC1)c1nc(-c2c(F)cccc2F)cs1 568278168 DPORFRLQARTCGQ-CYBMUJFWSA-N 383.423 5.174 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1cc(Cl)cs1 573761836 CGVQQWQYHXNCKG-UHFFFAOYSA-N 380.900 5.439 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](c1ccc(O)cc1)C1CC1 591059577 FGBIDQZIXFUUGE-KXBFYZLASA-N 380.513 5.309 30 20 GKED C[C@H](N[C@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)cc1F 595075970 DZJPMYLWDPNCIP-VOJFVSQTSA-N 391.309 5.099 30 20 GKED C=CC1CCN(C(=O)Cc2sc(-c3ccccc3)nc2-c2cccs2)CC1 599666356 WSHFLHCZUAOGDX-UHFFFAOYSA-N 394.565 5.506 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1[C@H]2CC[C@H]1CC(F)(F)C2 600205555 YOARVRSSNQPCDY-HOTGVXAUSA-N 384.451 5.112 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4cc(Cl)ccc4[nH]3)cn2)cc1 604241804 ONAQKFMBZRCCTB-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C=CC[C@@H](C)NC(=O)c1ccccc1SCc1ccc(Br)cc1 604879994 DOIUOKQFUXIRCX-CQSZACIVSA-N 390.346 5.436 30 20 GKED CCc1nc2ccc(C(=O)Nc3ccccc3SCCC#N)cc2nc1CC 609375512 IRBKYZFXMOLYTM-UHFFFAOYSA-N 390.512 5.013 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(OC(C)(C)C)cc1 609435258 AZLPXNBTYAQBLM-MRXNPFEDSA-N 397.544 5.580 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)c1 609504054 QMYXMUXUGAQQDB-VXGBXAGGSA-N 397.208 5.209 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 609909324 CNCAAIMFHLTBTG-LJQANCHMSA-N 384.454 5.069 30 20 GKED COc1c(Cl)cccc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609987237 NJJVVZCBBIJJLC-UHFFFAOYSA-N 377.831 5.216 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)n1 610322621 RFTGANQXMLVRGT-AWEZNQCLSA-N 394.525 5.357 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 610706277 IBOAJXBABBHKIW-NEPJUHHUSA-N 387.270 5.327 30 20 GKED N#CCCn1cc(CNc2cccc(-c3cccs3)c2)c(-c2ccccc2)n1 610910673 TZBYKFFIYCVQPA-UHFFFAOYSA-N 384.508 5.804 30 20 GKED N#C[C@@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1ccc2ccccc2n1 613291258 XIPJEAIHSYPWNV-JOCHJYFZSA-N 394.499 6.017 30 20 GKED CCCn1c(C)c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c2cc(OC)ccc21 613292485 LZNFOSYEYPODAK-HXUWFJFHSA-N 397.478 5.407 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CSc2ccc(Br)cc21 618807973 DLOMYRQDMSRTBK-MSOLQXFVSA-N 385.330 5.135 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(OC(C)(C)C)cc1 620322389 BCJFGSLENLINSU-UHFFFAOYSA-N 392.952 5.477 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(Cl)cc1)c1nc2cc(F)ccc2s1 730416293 AOUPDKQQGDJPQO-HNNXBMFYSA-N 388.851 5.124 30 20 GKED C[C@@]12CC3CC(C(=O)[C@@H](C#N)c4nc5cc(F)ccc5s4)(C1)C[C@](C)(C3)C2 730416821 IONAJTCFBAZOEM-WFVLTEDDSA-N 382.504 5.608 30 20 GKED CC(C)(C)n1cc(C=NNc2ccc(C#N)cc2)c(-c2ccccc2Cl)n1 731151879 RLNFXZMHOQZNJX-UHFFFAOYSA-N 377.879 5.276 30 20 GKED C[C@@H](SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1 731939487 MCXLKSHRYBJAFU-RDTXWAMCSA-N 396.512 5.620 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1cnc2ccsc2c1 739412799 HBVBZGHALKMQQP-UHFFFAOYSA-N 387.390 5.094 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(Cc1ccco1)Cc1ccc(C)s1 743203864 UNCXOIRZNDWQKJ-UHFFFAOYSA-N 398.459 5.035 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c(SC)cc1OC 745990553 UDNQOTHJVLELSB-CMDGGOBGSA-N 391.492 5.384 30 20 GKED CCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)[C@H](CC)c1ccccc1 746144524 APYTXYJYJABLGA-IFMALSPDSA-N 398.510 5.087 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 746346313 PDVZERIXEJMIAJ-NTMALXAHSA-N 379.416 5.145 30 20 GKED CCCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cccnc1 750128749 KBJRPPPDPUFOCL-UHFFFAOYSA-N 391.858 5.456 30 20 GKED CC(C)C[C@@H](C)N(C(=O)c1ccc(C#N)c(Cl)n1)c1ccc2[nH]ccc2c1 753012663 DWHYFMZJVOXVLE-CQSZACIVSA-N 380.879 5.169 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)CCC(=O)N3C)cc1 754686624 KFWWWEKMKBFKJK-DHDCSXOGSA-N 397.474 5.167 30 20 GKED CC1(C)CCC[C@@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1 756530275 UNEYEYKMLGRRBF-WMZOPIPTSA-N 377.513 5.465 30 20 GKED COc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 760221911 ZOPFXDPFNNNSDG-QGZVFWFLSA-N 398.528 5.141 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1 760352384 ZYBZQFZRDFKLGZ-DEOSSOPVSA-N 378.431 5.854 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 772982722 HLUFURZVZQRXDW-OXJNMPFZSA-N 391.540 5.650 30 20 GKED CN1C(=O)CCc2cc(/C=C3\CCc4c(Cl)sc(Cl)c4C3=O)ccc21 774137486 WOAZFXXALXCUBZ-FMIVXFBMSA-N 392.307 5.176 30 20 GKED C=CC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21)c1ccncc1 777242902 JVPYGVJAUKMORX-LUKWVAJMSA-N 375.516 5.067 30 20 GKED CC(C)COc1ccc(C2(C(=O)Nc3ccccc3O[C@H](C)C#N)CCC2)cc1 780166403 VUSLDUMGSZXEKA-GOSISDBHSA-N 392.499 5.073 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC[C@](C)(CC)C1OCCO1 789450314 NPNZFDSEERVNOR-QHCPKHFHSA-N 388.552 5.229 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C1CCOCC1 796635898 VHSDZMMBXNUGDK-INIZCTEOSA-N 388.920 5.093 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)[C@H](C)c1nc2ccccc2s1 796750993 KJNJWSMNAPXTAB-XYJFISCASA-N 378.497 5.419 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccccc1Br 798814354 KZPIWGPWDQTKGD-OAHLLOKOSA-N 393.284 5.151 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 805947258 LDQNXRANNXRFHG-KBXCAEBGSA-N 377.513 5.044 30 20 GKED C[C@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 806207267 MNXJERMBWGHZLI-HTAPYJJXSA-N 398.466 5.361 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N4CC[C@@](C)(C#N)C4)cc3C2)cc1 822333372 XTUZKPFGEQHVGU-DEOSSOPVSA-N 388.515 5.098 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3ccc(Cl)nc3Cl)c2C#N)CC[C@H]1C 839389981 BRYQXDJQFPYQQR-BDAKNGLRSA-N 380.300 5.260 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(Cl)cc2Cl)cc1 915087103 QGDUMROUWMEZFV-KRWDZBQOSA-N 399.252 6.040 30 20 GKED N#Cc1ccccc1NC(=S)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 915995192 JROSMZCLWHVWID-HXUWFJFHSA-N 396.519 5.158 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)cc1OC(F)F 916154256 FRFIGSJYAYTLPT-WZUFQYTHSA-N 387.426 5.183 30 20 GKED Cc1ccc(/C=C\C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(Br)c1 916849133 POSFGAHEUJEBQG-CCCPALQASA-N 391.268 5.195 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4ccc(F)cc4)CCC3)n2)cc1 916973951 ASPVPMYCTJNJHZ-LJQANCHMSA-N 390.483 5.556 30 20 GKED C=CCOc1ccccc1/C=C1\SC(=S)N([C@H](C)c2ccccc2)C1=O 917643609 HMNGBOOONJBIEP-ATPAHOSSSA-N 381.522 5.214 30 20 GKED CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1 917804665 QVMYATRWRTYZFI-NRFANRHFSA-N 379.504 5.029 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@H]1CCCC[C@H]1C 920078342 PTHFVYXKSFNIRD-QRWLVFNGSA-N 379.529 5.524 30 20 GKED Cc1cc(Br)ccc1NN=Cc1csc2ccc(C(=O)O)cc12 1776042470 RANJHEMYMAOFMF-UHFFFAOYSA-N 389.274 5.116 30 20 GKED O=C(O)c1ccc(NN=Cc2ccccc2Cc2ccc(Cl)cc2)cc1F 1776077067 TVAIYMOPHGOCMG-UHFFFAOYSA-N 382.822 5.214 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccsc2)cc1 1776354468 NDMGUPPHPQJUOY-UITAMQMPSA-N 392.476 5.797 30 20 GKED CC1(C)C/C(=C\c2c(F)ccc3sc(C(=O)O)cc23)C(=O)c2ccccc21 1776526656 MTLXXURHQGVLBX-FMIVXFBMSA-N 380.440 5.686 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776697589 IVPODHGSPYSQEU-LTXFRBGYSA-N 384.475 6.461 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cn(-c2ccccc2)nc1C(C)(C)C 1776786918 AZHJBLLVLZZDRE-FQEVSTJZSA-N 399.579 5.463 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C/c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1777372563 JVYWZZCDNXFSBX-PDICVPPASA-N 396.439 5.206 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CC=CCC3)CCC2)cc1 1789448807 ICNLSIMIDPANIJ-KNQAVFIVSA-N 392.543 5.245 30 20 GKED N#C[C@H](C(=O)Cc1c(Cl)cccc1Cl)c1nc2ccccc2n1C(F)F 41558711 WDRURVVWUBQCCP-LLVKDONJSA-N 394.208 5.157 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2ccccc2n1C(F)F 41558872 NYTTVVOMXIXYHS-LLVKDONJSA-N 394.208 5.157 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161620 HAUYTBLSEDBSDX-UHFFFAOYSA-N 391.496 5.057 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H](C)c1ccco1 69592944 WNGPMTJZRWGUAP-INIZCTEOSA-N 375.428 5.477 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1nc2c(cc1C#N)CCCC2 96994958 KHFDZFCYANMLDZ-MRXNPFEDSA-N 393.556 5.383 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)c1ccc(COc2ccccc2C#N)o1 117373660 QWDWOTOHZNNJCS-UHFFFAOYSA-N 396.446 5.156 30 20 GKED COc1ccccc1-c1nnc(SCCCCC#N)n1-c1ccc(Cl)cc1 120991828 NCDYYNBVQKQHQA-UHFFFAOYSA-N 398.919 5.382 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)ccc1Cl 151847147 PKLHYFCWTBQERL-MRXNPFEDSA-N 377.856 5.134 30 20 GKED N#CCCn1cc(CNc2cccc(N3CCCCC3)c2)c(-c2ccccc2)n1 157342096 BKHREFZTWNOQMQ-UHFFFAOYSA-N 385.515 5.066 30 20 GKED Cc1ncsc1CN(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 172236634 CHBUNIVQEQAZGY-UHFFFAOYSA-N 397.887 5.041 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 172681275 KOVKQPZYRFPUBK-SECBINFHSA-N 385.703 5.638 30 20 GKED CC[C@](C)(NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1nc(C)cs1 173123979 LYTVSZDHEVGUGV-KUHUBIRLSA-N 388.562 5.293 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)o1 176337890 JIDJYHNLZALUHD-OAHLLOKOSA-N 378.453 5.576 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cccc(Br)c1Cl 180320065 JEXYHDMIMCVGTH-UHFFFAOYSA-N 395.709 5.361 30 20 GKED COc1ccc(/C=C(\C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1F 183871382 ZBPLGDNHCWTNJP-ZQHYZAEZSA-N 384.476 5.271 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1 192668210 JGZQXOHVYMJGAN-UHFFFAOYSA-N 398.249 5.499 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(C)c([N+](=O)[O-])c2)ccc1SC(F)F 214933830 NYMXDUJTJLKTEC-ALCCZGGFSA-N 379.384 5.123 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 303450266 JJMORSNUIGCSGR-ROUUACIJSA-N 377.381 5.163 30 20 GKED CSc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 409927459 TZXKNEUCDMFEBS-UHFFFAOYSA-N 394.521 5.481 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@H](C)CC3)c(C(F)(F)F)o1 410990385 WJEQYJSPWZLQSE-PSASIEDQSA-N 382.407 5.478 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1nc(-c2ccccc2)cs1 426124126 RASIWDIDFVOBIS-GFCCVEGCSA-N 382.876 5.218 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)c1ccccc1 428853538 ATWIDKZJJFENSG-MOPGFXCFSA-N 395.572 5.348 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3cncs3)cc2Cl)cc1 432396482 UGWVLLLFELPRIW-UHFFFAOYSA-N 383.860 5.032 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccccc1 439295825 LWHFVGUZZAKBQO-HSZRJFAPSA-N 399.494 5.570 30 20 GKED CCCc1c(NC(=O)[C@H](c2ccccc2)C(C)C)cnn1-c1cccc(C#N)c1 440065669 AYOPJZFHMOTZPO-QHCPKHFHSA-N 386.499 5.075 30 20 GKED C[C@H](CCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 440791479 IPQRBPQNCUTVBO-HXUWFJFHSA-N 398.506 5.854 30 20 GKED CC[C@H](Nc1ccc(Cc2nnc3n2CCCCC3)cc1)c1ccc(C#N)cc1 447592815 NVYFJDRZNSRARW-QFIPXVFZSA-N 385.515 5.030 30 20 GKED C[C@H](Cc1coc2ccccc12)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 449272675 OAKRPUPILFPEQK-QGZVFWFLSA-N 387.483 5.059 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(Cc2ccccc2F)CC1)c1ccccc1 458799077 JDHRMILZXDRIQK-HSZRJFAPSA-N 393.506 5.225 30 20 GKED C[C@@H](Sc1ccc(Cl)c(Cl)c1)C(=O)N(CCC#N)c1ccc(F)cc1 463201063 ICHLMXHKACQYBD-GFCCVEGCSA-N 397.302 5.560 30 20 GKED COc1ccc2sc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)c(C)c2c1 464937697 FNEVEEMHTHMFRT-WOJBJXKFSA-N 390.508 5.130 30 20 GKED CCO[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C1=CCCC1 465151087 LYODGCNQBSRMGL-QFIPXVFZSA-N 394.446 5.334 30 20 GKED N#C[C@@H](C(=O)c1cccc2cnccc12)c1nc(-c2c(F)cccc2F)cs1 466985432 VUTLUWGSNQLTKN-HNNXBMFYSA-N 391.402 5.127 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(Br)cc(C(F)(F)F)c1 471171061 YCRSOEAAHVRSFE-UHFFFAOYSA-N 391.231 5.012 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@H]2Cc2ccccc2)cc1 472168817 GCCLEFUWZCIXSA-QFIPXVFZSA-N 398.531 5.308 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cccc(Br)c1)C1CC1)c1ccccc1 474692428 NPLSXAYGTSSCCZ-GOSISDBHSA-N 397.316 5.028 30 20 GKED FC(F)c1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1 475095687 SNHRQMNORKBIEY-OAHLLOKOSA-N 397.309 6.426 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(Br)c1 476124003 RKPJFKOCNPDNIQ-UHFFFAOYSA-N 388.305 5.562 30 20 GKED CC1(C)CN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)[C@@H]1c1ccncc1 476596816 MFOZBQNTXWAQNQ-JOCHJYFZSA-N 399.519 5.328 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)N2CCC(F)(C#N)CC2)c2cccs2)cc1 476839784 ATIQZQCSQOSKBH-OXJNMPFZSA-N 399.535 5.388 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccc(C(=O)N2CCc3ccccc32)cc1 478348666 NELBFBXPWVHPGG-UHFFFAOYSA-N 387.870 5.027 30 20 GKED CCSc1ccc([C@H](C)NCc2ccc(C#N)cc2Br)cc1 481272450 WEEAGXUUNBHEEY-ZDUSSCGKSA-N 375.335 5.284 30 20 GKED C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(OC(F)(F)F)cc1 482769900 HWLMZHLKPPQSJB-VIFPVBQESA-N 395.274 5.234 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(OC(F)F)c3)c2)cc1 482959810 QJRYZUVNDUWQIV-UHFFFAOYSA-N 380.350 5.204 30 20 GKED N#C[C@H](C(=O)c1ccccc1C(=O)c1cccs1)c1nccc2ccccc12 483206428 UVYFUKOJFLZBCI-IBGZPJMESA-N 382.444 5.017 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3coc4cc(F)ccc34)n2)cc1 483521503 YKKOBONRQPIDMD-MRXNPFEDSA-N 387.395 5.057 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1ccccc1OCc1ccccc1 499601864 GDCNSMKYXYGFER-HXUWFJFHSA-N 378.516 5.017 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)[C@H]3CCCc4ccccc43)c2)cc1 501447236 IZFMLCLCFMNAQH-VWLOTQADSA-N 396.490 5.390 30 20 GKED CC(C)c1cccnc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 502952123 KQYDGFLJBFQGJO-UHFFFAOYSA-N 375.403 5.260 30 20 GKED CSc1cc(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Cl 505824549 FSDALUHJCKARIK-AWEZNQCLSA-N 385.703 5.363 30 20 GKED Cc1c(CNC(=O)c2ccccc2-c2ccccc2C#N)oc2ccc(F)cc12 513613777 SSFGKTMQQDDXAT-UHFFFAOYSA-N 384.410 5.349 30 20 GKED C[C@H]1CCc2c(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)csc2C1 515540909 GMLWZHAFVJGWJG-AAEUAGOBSA-N 385.439 5.108 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4sccc4s3)n2)cc1 517305683 DSXLFWILLMSVLI-CYBMUJFWSA-N 380.519 5.885 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cs1 517455639 XFDSZSZWRYQQED-CQSZACIVSA-N 393.537 5.623 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(F)cc1)C1CCCC1 520475619 VZCDHYJEXTXLBU-QHCPKHFHSA-N 393.506 5.549 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(C(=O)OC(C)C)ccc1Cl 524044959 RFUSUQINWZCUIM-UHFFFAOYSA-N 392.908 5.187 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(COc2cccc(C#N)c2)c1 524512510 WXPDLHCNQRNNCY-CYFREDJKSA-N 396.490 5.155 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 527229203 DKZIAPMRJPCKIK-GCJKJVERSA-N 378.472 5.180 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2sc3ncccc3c2Cl)s1 529011200 WLGKCPVFGBVGOW-JTQLQIEISA-N 375.906 5.194 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 532654722 XPWNIESJFQRKBH-CTNGQTDRSA-N 393.487 5.321 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC1CCC(F)(F)CC1 534160078 SEKJDJVACJQWEQ-UHFFFAOYSA-N 399.441 5.145 30 20 GKED COc1ccc(CSCCCC(=O)Nc2c(C)cc(C)cc2C)cc1C#N 534685795 HZCOPLKCJMEBGT-UHFFFAOYSA-N 382.529 5.144 30 20 GKED C=C(C)[C@H](CC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)OCC 535154351 WEUVPROZYXSKRT-DYVFJYSZSA-N 392.952 5.320 30 20 GKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 536818484 XLEVQPOHFXIWTF-QAPCUYQASA-N 379.460 5.154 30 20 GKED C=CCCOCCCCC(=O)N1CC[C@@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 538282722 LRVOFRJQFUUGNI-UZLBHIALSA-N 383.454 5.378 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 538320279 KNQLPVSKBVVSTR-SFHVURJKSA-N 382.788 5.610 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)Nc1cc(C(C)(C)C)sc1C#N 540274352 KVPWVGXJLUZSGZ-UHFFFAOYSA-N 395.553 5.525 30 20 GKED C=C(C)COc1cc(CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1OC 542709910 LIHYPDBVFAEGDV-GMAHTHKFSA-N 399.506 5.141 30 20 GKED C[C@@H](NCc1ncc(Br)s1)c1ccc(-c2cccc(C#N)c2)cc1 542925470 VPIOCWGBJMUAEN-CYBMUJFWSA-N 398.329 5.295 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 544893178 XKWQONANUCWHHF-CYBMUJFWSA-N 395.356 5.342 30 20 GKED N#C[C@@H](NC(=O)c1scnc1C1CCCC1)c1c(Cl)cccc1Cl 546048652 NDRRWAXSSYFTHS-CYBMUJFWSA-N 380.300 5.102 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(SCc3ccccc3Cl)cn2)cc1 546921033 LCNLJRBSFMVRQW-UHFFFAOYSA-N 393.899 5.346 30 20 GKED C=CC[C@H](C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1)c1ccccc1 548288826 VVAAEZXTHGQXCW-QHCPKHFHSA-N 375.512 5.085 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 553119356 IMPGWFZQXKNCCD-ZEQRLZLVSA-N 387.527 5.326 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1cccc2ccccc12 557559881 XTPMHRUHWADZSI-DLBZAZTESA-N 389.524 5.531 30 20 GKED N#C[C@@H](NC(=O)CCCCCc1cccs1)c1cccc(Cl)c1Cl 557790396 OZZYLWWOHSLWJL-MRXNPFEDSA-N 381.328 5.539 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(CCC#N)c2ccc(F)cc2)cc1 561420210 HXICYYLJTVFPIL-UHFFFAOYSA-N 399.425 5.359 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CC1 571959070 JQNWABVKVRGSRL-UHFFFAOYSA-N 388.298 5.818 30 20 GKED N#Cc1cc(Br)ccc1CN[C@@H](CC(F)(F)F)c1ccccc1 581744507 YALDFNPUDIWWEI-INIZCTEOSA-N 383.211 5.104 30 20 GKED C=CCOc1ccc(CNCc2cc(Cl)c3c(c2)OCCCO3)cc1Cl 589645741 VXGOBHUWEZLEMW-UHFFFAOYSA-N 394.298 5.009 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1Cl 589646728 KFICEUWWBDQBBG-SFTDATJTSA-N 375.871 5.054 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@H](C2CCC2)C1 591337236 UCYPGZIKLMXQAI-NRFANRHFSA-N 389.499 5.100 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603690604 MVLPNRYTNMMLGO-UHFFFAOYSA-N 392.846 5.063 30 20 GKED Cc1sc(NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)c(C#N)c1C 603941405 OXPRRMOQHIZTID-UHFFFAOYSA-N 390.468 5.133 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 607434109 YJYWZKWXNMXERC-INIZCTEOSA-N 396.512 5.984 30 20 GKED Cc1ccccc1-c1noc(CNc2cccc(Oc3ccc(C#N)cc3)c2)n1 609221165 BMULIRCGJMHTFE-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1C 609452046 HZGKXSACWAEJPK-UHFFFAOYSA-N 397.478 5.879 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)oc2ccc(F)cc12 613403782 TYEIZAMEEGNWBB-ZDUSSCGKSA-N 384.819 5.634 30 20 GKED C=CCN(C(=O)[C@@H](C)OC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 614509572 MVHLWCRNRHSJMH-MRXNPFEDSA-N 378.497 5.031 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 618745512 VVBWIIRYZULHID-HXUWFJFHSA-N 394.434 5.175 30 20 GKED C[C@H](CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 619126343 OQFWKWYXKHVSPX-LLVKDONJSA-N 387.339 5.489 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)NCc1ccc(C#N)c(Cl)c1 619789816 SAXNUAROFVADPG-MRXNPFEDSA-N 396.922 5.221 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@H](C#N)c3nc4ccccc4o3)c2)c1 642281588 QERXUTMNESHSFQ-FQEVSTJZSA-N 382.419 5.205 30 20 GKED CCc1cc(C)c(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 676053651 ZQLOJCWCCLXRTC-LBPRGKRZSA-N 378.375 5.269 30 20 GKED N#C[C@@H](C(=O)c1coc(-c2ccccc2Cl)n1)c1nc2cc(F)ccc2s1 678969578 IJGNWBASFNOXRK-LBPRGKRZSA-N 397.818 5.234 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SCc1ccco1)c1nccc2ccccc12 682994900 KQUINFCWWLCQPD-HXUWFJFHSA-N 384.460 5.610 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2cccc(OC(F)(F)F)c2)cc1 727974527 MBDQXDGPDHWKGI-WDZFZDKYSA-N 392.377 5.011 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)c3sc4ccccc4c3Cl)CC2)cc1 728829753 BHSQZMLEXLRHMM-UHFFFAOYSA-N 396.899 5.110 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)c2)cc1 732434728 DIPGJZQWAYEHIP-GOSISDBHSA-N 385.467 5.328 30 20 GKED C=CC[C@H](NC(=O)NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccncc1 734655869 VIJXFKMQHFMCIQ-QFIPXVFZSA-N 391.446 5.130 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 735365921 IEMQBJNPXUKUJK-HXUWFJFHSA-N 383.879 5.392 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 739157434 WLDLKHLVNBKZCL-CXAGYDPISA-N 398.890 5.658 30 20 GKED CCOc1c(Cl)cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1OC 741472912 LUXDAPBUGNONRM-BQYQJAHWSA-N 393.870 5.705 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1cccc(-c2ccncc2)c1 741473851 SLXZRHVOSFWZEB-TWGQIWQCSA-N 392.458 5.619 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)c2cnc([C@H](C)OCC)s2)c1 744364398 YSSHIYOJMBWGFG-KRWDZBQOSA-N 390.508 5.069 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccncc1)c1cc2ccccc2o1 747004063 XQUHCCRCSDAOKL-ZHACJKMWSA-N 391.430 5.577 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)n1 747199115 PBTRNVVIIHNRGC-RJNRQISESA-N 398.837 5.828 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 750688671 VFQYFRCQNPHBQV-LSSBLYJVSA-N 376.456 5.537 30 20 GKED Clc1cc(Cl)c(NN=Cc2cnc(-c3ccccn3)s2)nc1Cl 753159999 BPFBRLQDZOYAPD-UHFFFAOYSA-N 384.679 5.006 30 20 GKED Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl 754573856 TYJQYQULLPNHNV-GXTWGEPZSA-N 383.835 5.048 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(N)cc1C 758098222 BSZVYROIZCESJC-UHFFFAOYSA-N 391.475 5.224 30 20 GKED C=C[C@@H](CC(=O)Nc1cnc(Cl)c(Br)c1C)c1ccccc1 759280767 CJZQIKAKOIJNDQ-LBPRGKRZSA-N 379.685 5.104 30 20 GKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C\c1csc(-c3ccccn3)n1)CCO2 767737753 PSAQWGZRIDQZFV-RAXLEYEMSA-N 382.872 5.216 30 20 GKED C#CCCCCC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 773317712 JIGMSNFGOFPXAC-UHFFFAOYSA-N 379.847 5.208 30 20 GKED COc1ccc(-c2cc(NCc3cccc(C#N)c3)ccc2OC(F)F)cc1 779556621 ZQIYHVOZXHPAOL-UHFFFAOYSA-N 380.394 5.447 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ncc2Cl)cc1 780347170 XHQRKYMRJWLTDA-QGZVFWFLSA-N 382.250 5.296 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCc1ccc(OC2CCCCC2)cc1 780676898 AATYCNJXFQTREL-KRWDZBQOSA-N 393.487 5.011 30 20 GKED Cc1cccc(-c2nnc(-c3ccc(C(=O)OCCCC(C)(C)C#N)cc3)o2)c1 782659473 HMDHAXZXHSSVST-UHFFFAOYSA-N 389.455 5.199 30 20 GKED C=CCCCCCOC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O 784161269 WAMXTJWVZYAMRA-UHFFFAOYSA-N 377.843 5.032 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1cn(CCC#N)nc1-c1ccncc1)CC2 788353862 JQSUVTFDSTYQCK-STZFKDTASA-N 396.494 5.195 30 20 GKED Cc1nc(C(C)C)oc1C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1 796181846 BKABBHGOMFYTMS-UHFFFAOYSA-N 388.467 5.163 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 796648714 DYHHTDMSVQEKGO-HRAATJIYSA-N 398.487 5.607 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1Br 798814800 WEXXZVVXBQJXHR-LBPRGKRZSA-N 399.313 5.213 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 800387883 WEUJRLANIIKGRU-GXSJLCMTSA-N 388.361 5.317 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1cc(-c2ccc(Cl)s2)nc2ccccc12 817617999 OJIPXFJFPRCUQV-UHFFFAOYSA-N 383.904 5.238 30 20 GKED N#C[C@H](C(=O)c1ccnc(Cl)c1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 915103158 PWZAJVZTNQHVKL-JISUQADQSA-N 397.931 5.149 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COc3cc(C)ccc3Cl)n2)cc1 916650404 LWPAYPNVJXKPMG-INIZCTEOSA-N 396.899 5.336 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2sc3cccc(C)c3c2Cl)cc1 916912045 FIOAQZWVTJBUSZ-OAHLLOKOSA-N 396.899 5.387 30 20 GKED CCC[C@@H](NCc1ccc(OC)c(O[C@@H](C#N)CC)c1)c1ncccc1Cl 925397488 PJDUZRRXWDUYIO-SJLPKXTDSA-N 387.911 5.056 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776105739 CONSZDYAXYEYAG-MRXNPFEDSA-N 392.524 5.921 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776125243 AZLFHDONFHXVNM-XFFZJAGNSA-N 394.492 6.065 30 20 GKED COc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c2ccccc12 1776132702 CCVAVNUUMSYPOU-RMKNXTFCSA-N 388.444 5.657 30 20 GKED C=CCOc1cccc(CN[C@H](CCC(=O)O)c2ccc(Cl)c(Cl)c2)c1 1776184842 CSSYKTOZUQZUOZ-LJQANCHMSA-N 394.298 5.254 30 20 GKED CC(=C\c1ccccc1OC(F)F)/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1776200114 UFLSWAFCVXOSAR-ZTXQZFCBSA-N 384.378 5.073 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)cc1Cl 1776388587 MNZZJHKLDFFWCT-DAXSKMNVSA-N 383.831 5.203 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2csc(C(=O)O)c2)cc1 1776869234 GMKGFAIAHOWTBT-JLHYYAGUSA-N 391.492 5.369 30 20 GKED Cc1cc(Cl)cc(C)c1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777423461 TUVNZXYRWHKZJS-BQYQJAHWSA-N 380.827 5.811 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C/c2cccs2)C(=O)c2ccccc2)c(Cl)c1 7913421 HKMYGECPQGQVPO-QGOAFFKASA-N 395.911 5.923 30 20 GKED C[C@H](NC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)c1ccc(C#N)cc1 26129751 UETZBKRQXYBVCV-HNNXBMFYSA-N 386.417 5.266 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1ccccc1Cl 60127416 NNRUZFGWJVCMIP-OAHLLOKOSA-N 391.858 5.443 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)N2CCC(C#N)CC2)c2cccs2)cc1 105092985 HFRIRBPAJNHRPS-IERDGZPVSA-N 381.545 5.296 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)/C=C/c2ccccc2F)cc1 108013464 AWAQCVSGEGLGAN-OUKQBFOZSA-N 388.417 5.079 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1cccc(Cl)c1Cl 108145944 LYJSRHBGSMIHHK-LBPRGKRZSA-N 395.311 5.263 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccccc3SC[C@H](C)C#N)c2c1 108238888 FOIGNTWJCAGDLV-CYBMUJFWSA-N 380.469 5.254 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc(-c2ccncc2)cs1 114620560 NGHYOSRTTUMRDR-CQSZACIVSA-N 379.828 5.095 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)c(Cl)c2)nnc1-c1cnccn1 124065704 LHBSVLVLCKGNFW-LLVKDONJSA-N 392.315 5.081 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1CCC(F)(F)F 125910380 PONKKJSNPXSEEY-UHFFFAOYSA-N 387.405 5.273 30 20 GKED Cc1ccc(Br)c(NC(=O)Nc2cccc(OCCCC#N)c2)c1 129680521 PXYXXFCKTIYFJT-UHFFFAOYSA-N 388.265 5.084 30 20 GKED CCOc1c(Cl)cccc1CC(=O)Nc1ccccc1SC[C@H](C)C#N 191482369 OJJKOMHOKRAHFP-CQSZACIVSA-N 388.920 5.172 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc3ccccc3o2)cc(Br)c1O 206100039 MFOCFOIXASXWGU-FPLPWBNLSA-N 387.229 5.196 30 20 GKED N#CCCCOc1cccc(CNCc2cccc(CN3CCCCCC3)c2)c1 237824603 FOAWCDPTTKESII-UHFFFAOYSA-N 391.559 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCN(C(C)=O)c2ccccc21 372772293 JVYTXEIMWCPQRF-NRFANRHFSA-N 391.515 5.158 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1C[C@@H](C)C[C@@H]1c1cccc(OC)c1 424237306 GFAYORCIAPGLRS-DBVUQKKJSA-N 398.576 5.018 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc(-c3ccc(F)cc3)n2)s1 430642240 OEYYVMGIBGUUGB-ZDUSSCGKSA-N 385.489 5.193 30 20 GKED Cc1ccc(Cl)c(S(=O)(=O)N[C@@H](CCCC#N)c2ccccc2)c1Cl 431613866 KAECHYOYUPIDOJ-INIZCTEOSA-N 397.327 5.015 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(O)c(F)c2)cc1Cl 436531325 HDFMRNDNTRLOGG-MRXNPFEDSA-N 398.796 5.232 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(F)c(F)cc1F 437216040 LYRILMQTECRKFU-UHFFFAOYSA-N 382.341 5.329 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc2cc(Cl)ccc2s1 437377790 YHPRVYLPZVJLSO-CYBMUJFWSA-N 395.896 5.563 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1nc2ccccc2s1 437551495 UWFYXBIFYPAFRK-JTQLQIEISA-N 380.778 5.459 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(OC(C)(C)C)cc1 438057206 AKXPVNSDALLWLJ-OAHLLOKOSA-N 383.517 5.760 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(OC)cc2)nc1 438429070 UGFFDKQDGXWWEK-UHFFFAOYSA-N 395.484 5.164 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1C(F)(F)F 438643843 VAFWTAMPNLVHSG-QGZVFWFLSA-N 377.341 5.085 30 20 GKED N#Cc1cnc2c(Br)cccc2c1NCc1ccc2ncccc2c1 440634739 BYHORCDSCPDSGD-UHFFFAOYSA-N 389.256 5.029 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)[C@@H](C#N)c2nc3c(C)ccnc3[nH]2)cc1 448327546 LCLKIUZJJJSKGO-GOSISDBHSA-N 398.491 5.216 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSC2CCC(C(F)(F)F)CC2)c1C 451038993 WWZSGTAIZXMDQO-UHFFFAOYSA-N 398.494 5.404 30 20 GKED C[C@@H](c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1)C(F)(F)F 455565952 AVTTVPMOSQESAY-KGLIPLIRSA-N 392.446 5.999 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)c(Cl)c1 455698124 FOPHHAKBYIHFJZ-MRXNPFEDSA-N 385.870 5.347 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3ccc(Cl)cc3)CC2)c(Cl)c1 455725119 CWSDATQEJBNSOJ-UHFFFAOYSA-N 388.298 5.471 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458857482 ZSMHGHHZVBXUFN-PKTZIBPZSA-N 391.515 5.149 30 20 GKED COc1ccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1SC 459405709 SUGNQWKRAFAARE-CYBMUJFWSA-N 387.530 5.313 30 20 GKED CCN(C(=O)c1csc(-c2ccc(C(C)C)cc2)n1)c1ccc(C#N)cc1 461521715 JEJCNXQCMOVQPX-UHFFFAOYSA-N 375.497 5.472 30 20 GKED CSc1cc(C)ccc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 465249393 CTKXCBYUOHVJLS-HNNXBMFYSA-N 385.558 5.290 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](c1cc(F)ccc1F)c1ccccc1Cl 466229963 LFBLWJQDTWYYGN-LJQANCHMSA-N 376.834 5.091 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCC[C@@H]3c3ccc(F)cc3)ccc21 469304540 HUVLSYTWILMWCH-FGZHOGPDSA-N 391.490 5.157 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)[C@@H](C)C(F)(F)F 477954710 IWZOGFOOTWAYAI-LBPRGKRZSA-N 396.796 5.417 30 20 GKED Cc1ccc(-c2nnc(S[C@@H](C#N)C3CCCCC3)n2Cc2ccco2)cc1 489445391 FCTLMFOKANWBHV-FQEVSTJZSA-N 392.528 5.459 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)cc2F)nnc1-c1ccccc1OC 497663372 MWJMNCBBZFWDSR-CYBMUJFWSA-N 387.455 5.271 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N(Cc3ccc(C#N)cc3)CC(C)C)s2)o1 500319038 WXYMPJDIJDXGNI-UHFFFAOYSA-N 393.512 5.190 30 20 GKED COc1ccc(C#N)cc1NC(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 502519727 SKHIWLFMDNKPDJ-MRXNPFEDSA-N 386.455 5.384 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 505007046 ZBHSDVHTENXHFL-ZDUSSCGKSA-N 383.439 5.553 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1Oc1ccncc1 509089808 MDTPHZWJHFKAJY-UHFFFAOYSA-N 385.467 5.044 30 20 GKED Cc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1C 511738798 QUMNAXURCFYMTA-UHFFFAOYSA-N 392.480 5.077 30 20 GKED N#CCc1cccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)c1 511891357 ICVDIDHAWXCYQO-UHFFFAOYSA-N 386.417 5.356 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3cccc(C#N)c3F)C2)nc2ccccc21 512455690 IGCCHRQAKDTKNF-LJQANCHMSA-N 376.479 5.008 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cncc4ccccc34)c2)cc1 515679741 RZXYIECISZPWMC-UHFFFAOYSA-N 393.446 5.132 30 20 GKED C=CCOc1ccc(CNCc2cc(Cl)c(OCC)c(OC)c2)cc1Cl 517534620 XTXVUGQQBBVBRG-UHFFFAOYSA-N 396.314 5.255 30 20 GKED CC(C)N(CCC#N)C(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1 523281485 RVOOLDOMGBRCFA-OAQYLSRUSA-N 386.948 5.313 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(Oc2ccccc2Cl)nc1)c1ccccc1 533507372 XTYQZUIFGMUXOV-LJQANCHMSA-N 391.858 5.302 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1 535326137 PZHBIJCATRYMHR-QHCPKHFHSA-N 376.456 5.070 30 20 GKED C[C@H](NCc1ccccc1CN(C)C1CCCCC1)c1ccc(C#N)c(F)c1 540707033 MHGDBCLAZGRACH-SFHVURJKSA-N 379.523 5.313 30 20 GKED N#CCC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)CC1 541985363 YGGOWPSSLHCJKN-VLGSPTGOSA-N 397.478 5.080 30 20 GKED COc1cc(C)ccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 548036327 JVRHSPCJNXZXSI-UHFFFAOYSA-N 386.451 5.015 30 20 GKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 550826445 FYILBAVAHRNWIV-UXHICEINSA-N 376.422 6.061 30 20 GKED C[C@@H](NC(=O)[C@H]1CCC(=O)c2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 560088495 MPKIPENNISUQOD-OSPHWJPCSA-N 394.474 5.163 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CN[C@@H](CC(F)(F)F)c1ccccc1 567499852 UJUJXBRYPNXKKB-HNNXBMFYSA-N 383.282 5.767 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)o2)CC1 568397251 KTPZFGRQOFLCSH-UHFFFAOYSA-N 376.378 5.121 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2CC#N)c1 581093820 JQXSXFWZPVHTCD-UHFFFAOYSA-N 383.879 5.033 30 20 GKED CC[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 583433698 VJLPWFKLLLMISU-IIBYNOLFSA-N 378.476 5.178 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2)c1 583908504 ODAYHYPLEGLAOK-GOSISDBHSA-N 375.497 5.301 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)NCC(C)(C)CCC#N)cc1 588229533 WSUBPEYSNFOPAP-UHFFFAOYSA-N 381.476 5.329 30 20 GKED Cc1nc(CC(C)C)sc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 590207656 BBYWJALAJXIBIQ-GFCCVEGCSA-N 389.933 5.403 30 20 GKED N#CC1(c2ccc(CNCc3ccc(COCc4ccccc4)cc3)cc2)CC1 594925520 NJEVAAXRXRHYFC-UHFFFAOYSA-N 382.507 5.248 30 20 GKED Cc1ccccc1N(C(=O)CC1(C#N)CCCCC1)c1nc2ccccc2s1 598800250 OOXACGMUNQTQOX-UHFFFAOYSA-N 389.524 6.134 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 603840677 RDMLNTRDQSYUOD-UHFFFAOYSA-N 395.812 5.673 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 606576422 IDOWBMDCVHNNOY-RBBKRZOGSA-N 395.506 5.200 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cnc(-c2ccccc2Cl)s1 609188730 VRDKWPRYFIVZFV-UHFFFAOYSA-N 375.925 5.256 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(COc2ccc(C)cc2C)o1 609189392 KSGLCDIVVPRMQH-UHFFFAOYSA-N 382.504 5.268 30 20 GKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1ccccc1 610343741 RFUHXWVHKUBLRR-ROUUACIJSA-N 385.467 5.028 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 611184782 CUKXYICNLVURKU-UHFFFAOYSA-N 396.796 5.418 30 20 GKED N#Cc1cc(CNc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)ccn1 614792823 JVXXCLBOBMIWLD-UHFFFAOYSA-N 392.871 5.621 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 615620342 GZVUCLTVWKORNU-AWEZNQCLSA-N 380.385 5.303 30 20 GKED COc1ccc([C@H](C)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1F 675737978 LCZMKUSGQCOCLQ-DLOVCJGASA-N 387.339 5.394 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(Br)c1)c1ccc2ccccc2n1 677083697 OQRYBCHVUPRGOW-ZDUSSCGKSA-N 385.648 5.141 30 20 GKED C=C(C)COc1cc(CN2CCCC[C@H]2c2nnc(C3CCC3)o2)ccc1OC 685450988 RMOIUGJURQAVON-IBGZPJMESA-N 397.519 5.028 30 20 GKED O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)CCc2nc(-c3ccc(F)cc3)sc21 727685205 DCSXMUATMKXFIL-SDNWHVSQSA-N 380.400 5.070 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 728067908 FFYBZHSTYPEGEI-KUHUBIRLSA-N 387.405 5.185 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730476007 YEQRJEPSCKIRPM-CYFREDJKSA-N 398.506 5.558 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 730936645 MAVWZTVSUGCODG-UHFFFAOYSA-N 379.410 5.312 30 20 GKED CCCCc1ccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)cc1 731322328 XEERRPANDWNWLS-INIZCTEOSA-N 383.586 6.232 30 20 GKED C=CCN(CC1CCCCC1)Cn1nc(-c2cccs2)c2ccccc2c1=O 732668230 CADKTDLRCNGVGI-UHFFFAOYSA-N 393.556 5.151 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(-c3ccccc3F)o2)ccc1OC 733329639 ILTRQCGQBZSBRK-QGZVFWFLSA-N 394.446 5.065 30 20 GKED C[C@H](/N=C/c1c(O)ccc2ccccc12)c1ccc(NC(=O)c2ccncc2)cc1 733750321 UBPXDDRXYQKBGO-DCMOEJRUSA-N 395.462 5.373 30 20 GKED CC[C@@H](NC(=S)Nc1ccccc1SC[C@@H](C)C#N)c1cccs1 734378422 AKWDVOICXXWHFX-UONOGXRCSA-N 375.588 5.438 30 20 GKED C=CC[C@H](NCc1ccc(-c2cccc(Br)c2)s1)c1ccncc1 734510401 UQIBDFZFNNYONS-IBGZPJMESA-N 399.357 5.980 30 20 GKED CC(=O)c1ccc(NCc2cccc(-c3ccc(C#N)s3)c2)c([N+](=O)[O-])c1 739889766 HDTOZCBDLRJLFG-UHFFFAOYSA-N 377.425 5.010 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1 746346312 PDVZERIXEJMIAJ-CSKARUKUSA-N 379.416 5.145 30 20 GKED COc1cc(C(=O)/C=C\c2c(C)nn(Cc3ccccc3)c2C)ccc1SC 747615304 UBWHRFOYJBKEJC-QXMHVHEDSA-N 392.524 5.175 30 20 GKED CCN(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc2ccccc2c1 747816941 DGEZMIPVLKNLQM-LJQANCHMSA-N 385.492 5.152 30 20 GKED CCN(c1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1)C(C)C 752620622 SHAIDFDOOZAMBS-XZOQPEGZSA-N 390.531 5.225 30 20 GKED C#CC[C@@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 757880831 ONAIECOBVRLYRW-XMMPIXPASA-N 384.479 5.290 30 20 GKED N#C[C@@H](C(=O)CC12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)c1nc(-c2ccncc2)cs1 759462301 LEWWAQIRIMFQQE-QRWBLDLWSA-N 395.503 5.080 30 20 GKED Cc1cc(C(=O)N(CCC#N)c2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C 772687735 IMWUFVGGRWXCTA-UHFFFAOYSA-N 397.450 5.042 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccc(N(C)C)cc1 775361751 FPWSFOBSPWVQSU-IBGZPJMESA-N 385.511 5.054 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(OCc2ccccc2)cc1 780445992 VVTHEZSULKWRTJ-QGZVFWFLSA-N 387.439 5.200 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@@H](Cc1ccc(F)cc1)C(C)C 780670317 KTIIFKTYBPJFHI-UWJYYQICSA-N 397.494 5.238 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CC=C(c2cccc3ccccc23)C1 782612025 HJNRYNPFYCTBFO-KRWDZBQOSA-N 383.451 5.062 30 20 GKED CCCOc1c(Cl)cc(/C=C2\CCc3cc(C#N)cnc3C2=O)cc1OCC 788354632 CNSQUXPIXGDBKB-CAOOACKPSA-N 396.874 5.007 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792095258 KDAVPYJAZMYBTE-RDTXWAMCSA-N 382.385 5.624 30 20 GKED Cc1cc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)sc1Br 794733617 QEQAPBKYZJBEKZ-WAYWQWQTSA-N 391.315 5.234 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570110 CTIUTVZNKFGESM-JSGCOSHPSA-N 394.462 5.829 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C#N)c1cccc(OC(F)(F)F)c1 805747991 JSLMTIILFRZCGK-LLVKDONJSA-N 399.210 5.070 30 20 GKED Cc1cc(Cl)cc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c1O 808716460 XHGPNMIAPOQCIM-HNNXBMFYSA-N 397.906 5.110 30 20 GKED C#C[C@@H](NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc(Cl)cc1 811949986 RMBRPCVCXFIEEV-GOSISDBHSA-N 399.277 5.072 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1csc(-c2ccccc2F)n1 812245376 SRGIJBRYRDJWHO-CMDGGOBGSA-N 393.468 5.364 30 20 GKED CC1CCN(c2ccc(NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)cc2)CC1 824017553 QAFNCYSMDWVWCF-SFHVURJKSA-N 376.504 5.019 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 824173956 UTJILCRZJKPAEX-OAHLLOKOSA-N 394.475 5.130 30 20 GKED CC(C)(C)OC(=O)N1CC[C@@H](NCC2CCC(C#N)CC2)C[C@@H]1c1ccccc1 824333746 ZUXCVSGDIDIHJI-SLMMIHQXSA-N 397.563 5.047 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ccc(Cl)nc3Cl)c(C#N)c2[C@H]1C 839389987 BRYQXDJQFPYQQR-IUCAKERBSA-N 380.300 5.260 30 20 GKED CC(C)(c1cc(F)cc(C#N)c1)c1nc(-c2ccsc2C(F)(F)F)no1 904921843 SLZROPMQGBKZKR-UHFFFAOYSA-N 381.354 5.154 30 20 GKED C[C@H](Oc1ccc2c(c1)CCC2)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915293364 KORGXPFOUDLRAY-AVRWGWEMSA-N 396.490 5.237 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cccc(Cl)c3)n2)cc1 916974001 CFMPZZFSSYBIGN-SFHVURJKSA-N 380.900 5.581 30 20 GKED O=C(O)c1cc(NN=CC(Cc2ccccc2)Cc2ccccc2)ccc1Cl 1776033587 DNGUMKBUIIJCKU-UHFFFAOYSA-N 392.886 5.538 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Cl)c(C(F)(F)F)c1 1776033617 JAHKAYTXLPZESB-UHFFFAOYSA-N 391.176 5.547 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1OC 1776801131 FIGSCNVIYSLDHH-VMPITWQZSA-N 394.423 5.215 30 20 GKED CCOc1cccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776937444 PZQHFNKUEWLNIC-PKNBQFBNSA-N 378.449 5.408 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc(C(=O)O)ccc3F)s2)cc1 1777430658 ZZRZZDDODKNBKR-NTMALXAHSA-N 381.428 5.160 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cc(C(=O)O)c(C)o1 1777487781 SQZHUYHFNNDOGO-BQYQJAHWSA-N 387.844 5.268 30 20 GKED O=C(/C=C/c1ccc(Cl)c(F)c1F)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570049 GPJAHBIYDGBASM-SOFGYWHQSA-N 388.753 5.473 30 20 GKED O=C(O)c1ccc2scc(/C=C3\Cc4c(ccc(Cl)c4Cl)C3=O)c2c1 1777685681 UFVZKARMTQSBPL-BJMVGYQFSA-N 389.259 5.729 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3cnc(C(F)F)s3)cc2)c1 1777686076 GJJRWRKMVWYPMK-TWGQIWQCSA-N 385.391 5.342 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 33242889 GJGIHBSQLDYYKK-XMMPIXPASA-N 382.463 5.115 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cn(-c3ccccc3)nc2-c2ccccc2C)n1 41521032 BAPFBJIKZATPJL-LJQANCHMSA-N 398.491 5.103 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)cc1)c1nc2cc(C(F)(F)F)ccc2s1 41549166 ONZRTPIHXFTZMG-LBPRGKRZSA-N 380.778 5.459 30 20 GKED N#C[C@H](C(=O)c1ccc(F)c(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 51656646 UXFKEIBGRQYRAP-SNVBAGLBSA-N 382.313 5.083 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(F)cc2)cc1Cl 60722043 KVROKPMSKKLEAZ-HXUWFJFHSA-N 378.834 5.316 30 20 GKED N#Cc1cccc(NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)c1 61110783 ZIYQALOPIOHZSN-UHFFFAOYSA-N 388.279 5.170 30 20 GKED N#C[C@H](C(=O)c1cccc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 64714915 GHDOZFUYFCKPKN-MRXNPFEDSA-N 390.414 5.732 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 69203080 MOALHUYHPFEPOC-QFIPXVFZSA-N 386.455 5.058 30 20 GKED CCN(C(=O)CCC(=O)c1ccc2ccccc2c1)[C@H](C)c1ccc(C#N)cc1 115763126 WQBWOICZQSURJS-GOSISDBHSA-N 384.479 5.284 30 20 GKED COc1ccc(C[C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1OC 118443297 MRRLKXSPPYVUGK-MBSDFSHPSA-N 386.495 5.210 30 20 GKED CC(C)c1csc(CNC(=O)c2ccccc2Sc2ccccc2C#N)n1 128626102 DKDYDGKDCFRZPW-UHFFFAOYSA-N 393.537 5.219 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2cc(Cl)ccc2o1 128792114 SGJVXBAFEWVJEX-KRWDZBQOSA-N 388.810 5.201 30 20 GKED C=CCn1c(SCc2cccc(NC(C)=O)c2)nnc1-c1ccc(Cl)cc1 131339302 RRRKRBWUJWQQMC-UHFFFAOYSA-N 398.919 5.035 30 20 GKED C#CCCOc1ccc(CN[C@H](c2cccc(Cl)c2)c2ccccn2)cc1 153345411 ZLXLQVXILBWZOO-HSZRJFAPSA-N 376.887 5.016 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 160110080 GZNCJJKGPFQBHY-QGZVFWFLSA-N 395.915 5.833 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(-c2cccnc2)cc1 176607505 XSARMYUUGCHFQI-GOSISDBHSA-N 396.494 5.055 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 178987601 LYHSPNFYWNLAKT-HBIYDYFMSA-N 385.801 5.365 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(-c3ccccc3)o2)ccc1OC 180810040 KCCIOAGQJXUAOJ-YLJYHZDGSA-N 390.483 5.487 30 20 GKED CN(C(=O)c1cccc(NCc2cccc(OCCCC#N)c2)c1)c1ccccc1 181395013 ZFIXIULFBDYLNQ-UHFFFAOYSA-N 399.494 5.258 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1nc(-c2ccsc2)oc1C 189877688 WDUNRSHSTCOFNZ-UHFFFAOYSA-N 380.513 5.745 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](O)c1cccc(OC(C)C)c1 191419919 JOIOXSZOTBTULN-QFIPXVFZSA-N 396.531 5.181 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cs1 255672574 LFOINHAHRXOMJG-KHPPLWFESA-N 382.510 5.141 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1coc(-c2ccc(C(F)(F)F)cc2)n1 277516444 CIIUQLUVXZQMGH-MHZLTWQESA-N 398.450 5.329 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 303153441 CYMIMMZJKSGHES-UHFFFAOYSA-N 390.483 5.414 30 20 GKED COc1ccc(C(=O)/C=C/c2cnc(C(C)(C)C)s2)cc1Br 303673058 DVMPYLOQLPWDGD-VOTSOKGWSA-N 380.307 5.108 30 20 GKED COc1cccc(F)c1[C@H](C)/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329490894 VFHXXHGQQQDRAJ-RDJZCZTQSA-N 399.510 5.359 30 20 GKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1 329989257 HVEZYQHBNLYWFE-UHFFFAOYSA-N 376.928 5.499 30 20 GKED CO[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 431987065 PFWKMSVZMXYNBJ-HSZRJFAPSA-N 393.487 5.082 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438654681 IURNUMCXFJXVQV-UHFFFAOYSA-N 393.393 5.293 30 20 GKED N#CC1CCC(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 440989754 OJUVUCCONATMGK-WTNGLUPJSA-N 380.319 5.170 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Cl)cc1-c1ccccc1 443533956 QSAMZJHVECOSJA-UHFFFAOYSA-N 379.847 5.548 30 20 GKED C/C=C/COc1cccc(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 448944768 TWOBWHXCTWSWQE-IDOMTICXSA-N 380.513 5.217 30 20 GKED C[C@@H](CCCc1cccnc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 459408604 WZWVSCOZCFDSTA-IRXDYDNUSA-N 382.533 5.009 30 20 GKED C[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Oc1ccccc1Cl 460438051 NXVJWRCPXMEJHG-MRXNPFEDSA-N 390.870 5.076 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N1CCC[C@@H]1c1ccc(C(C)C)cc1 460957694 ITAIKVGQWPWPNU-RTWAWAEBSA-N 380.536 5.171 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 463773157 BKOZCMTYNWHQIL-SJCJKPOMSA-N 379.262 5.082 30 20 GKED C[C@@H]1CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@H]1c1ccccc1 464540885 NQGXRVWMJMQUAF-HOYKHHGWSA-N 382.463 5.378 30 20 GKED C=C[C@](C)(CC)C(=O)NCc1ccc(Cl)c(NC(=O)[C@](C)(C=C)CC)c1 467972426 ZUBPXDUNBSLBQW-NHCUHLMSSA-N 376.928 5.099 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@@]4(CCCCO4)[C@@H]3C#N)o2)c1 468143514 HYSGFDQAYLFABQ-UPVQGACJSA-N 392.499 5.137 30 20 GKED C[C@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)[C@H](C)C#N 468182405 HTVSGAFGBYKPFJ-KEYYUXOJSA-N 377.875 5.016 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cnc2ccsc2c1 469280986 XEDYIMOHDVBNRO-OAHLLOKOSA-N 390.512 5.052 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(Br)s1 471283011 MPGZBOGBSNCTRX-JTQLQIEISA-N 395.347 5.466 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cnn1-c1cccc(Cl)c1 474427550 BKFPDSPGLUAWSV-HNNXBMFYSA-N 398.919 5.158 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(F)cc(Cl)cc1F 481129028 UXJUUPUROSIKIS-UHFFFAOYSA-N 377.243 5.553 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1 483620616 IMIQEJLTTXSVGQ-OXJNMPFZSA-N 397.519 5.837 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F 484045781 UJBPKMWPMJKYAP-RBUKOAKNSA-N 395.469 5.095 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC(C(F)F)CC2)c1 484764056 AVQWBIJIBVRKIP-UHFFFAOYSA-N 390.817 5.121 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H](c1ccccc1)C(F)(F)F 485595644 ADUDUODAXFVAOM-NRFANRHFSA-N 394.396 5.301 30 20 GKED Cc1c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)oc2ccc(F)cc12 487290684 OGRDFAKHKCSEDE-UHFFFAOYSA-N 391.427 5.052 30 20 GKED CC(C)C[C@@H](NC(=O)CNc1ccccc1SC[C@@H](C)C#N)c1ccccc1 487400081 ZDVTVOCHHAFPOC-GHTZIAJQSA-N 395.572 5.254 30 20 GKED Cc1ccc(NC(=O)[C@H](NCC(C)(C)CCC#N)c2ccccc2)cc1Cl 487838829 NPMJLDKRCUHMBE-HXUWFJFHSA-N 383.923 5.248 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3ccccc3n2CC(F)(F)F)n1 491211414 DCGCOHAIPNKBAG-CYBMUJFWSA-N 391.418 5.274 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@H]1CCCC[C@@H]1C 497798219 GTDSWSIXJBILHU-SBUREZEXSA-N 394.490 5.134 30 20 GKED CC[C@H](OC1CCCC1)C(=O)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 497804761 RGTFRLKMELOIDM-QHCPKHFHSA-N 394.490 5.277 30 20 GKED N#Cc1ccc(CN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)C2CC2)cc1 498320340 ACFHMHJTHZPIAA-UHFFFAOYSA-N 399.475 5.233 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccc(-c3ncco3)cc2)c1 500386913 NOQJSTBQCFNJNK-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C=CCCc1ccccc1NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1 505060441 FOAVBDFQPMLQDB-IBGZPJMESA-N 377.532 5.152 30 20 GKED N#Cc1c(NC(=O)Cc2ccc(Cl)cc2)sc2c1-c1ccccc1CC2 511096067 QJBZPSQTZBYBTE-UHFFFAOYSA-N 378.884 5.220 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N(C[C@H](C)C#N)C1CC1 513692425 NJNMAJMUXJYTKB-MRXNPFEDSA-N 395.528 5.143 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 514868987 FVLBFODSUOJDSS-QFBILLFUSA-N 397.544 5.562 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 517473474 OAFUPALVWLTXQE-JAZQRGJZSA-N 397.588 5.761 30 20 GKED C=CCN(C(=O)[C@@H](C)OCC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 518173061 RTXVVMWLNWDJGU-QGZVFWFLSA-N 392.524 5.421 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2cccc(OCCCC#N)c2)cs1 524292709 IOLLOEWMRLTPDH-UHFFFAOYSA-N 377.469 5.053 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)c1ccc(Sc2ccccc2C#N)cc1 531123478 LLYXSHRNKBFLGL-UHFFFAOYSA-N 387.508 5.155 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc([C@H]4CCOC4)c3)cc2)c1 536417117 GXJVJXRYTXLUJG-FQEVSTJZSA-N 384.435 5.107 30 20 GKED C=CCC[C@H](NCC(=O)Nc1c(C)cccc1C)c1ccc(C(F)(F)F)cc1 539334431 WRZYUBIHMUQWGC-IBGZPJMESA-N 390.449 5.558 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 543017935 QPTXLGGGXNRSOW-ROUUACIJSA-N 384.483 5.084 30 20 GKED C=CCNC(=O)c1cccc(-c2noc([C@H](C)Sc3ccc(Cl)cc3)n2)c1 544337037 VISUPHJFUWHFPR-ZDUSSCGKSA-N 399.903 5.159 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1 548879363 YSYFDHVNHRUAHZ-UHFFFAOYSA-N 390.527 5.549 30 20 GKED COc1ccc(F)c(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 549816658 SPINBWDUBZUFNI-MRXNPFEDSA-N 395.318 5.636 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c(Cl)cncc3Cl)cc2)c1 550504246 XODGXMVHXFPSAT-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc([C@@H]2CCCOC2)nc1C 552010978 MEAYSYWYVNRHMJ-QGZVFWFLSA-N 384.545 5.450 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC=C(c4ccncc4)C3)c2)cc1 554443160 LVENJSCFZYBHBO-UHFFFAOYSA-N 396.450 5.067 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(OC2CCCC2)c1 558266041 SRNKBXNSSWYVEV-UHFFFAOYSA-N 396.535 5.396 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 561402841 MIKLCGIBXAQBBN-HSZRJFAPSA-N 398.466 5.423 30 20 GKED CC(C)CC[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567117620 LRZOVZLICRHUAG-LJQANCHMSA-N 378.476 5.178 30 20 GKED CCC(CC)N(CC)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 577896702 RNUPMHOYVHFHMI-UHFFFAOYSA-N 379.504 5.488 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccc(CC(=O)Nc2ccccc2F)cc1 583599424 DJDQBPDZEXPSJI-UHFFFAOYSA-N 393.849 5.144 30 20 GKED C=CCN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)Cc1ccccc1F 588167890 QOOIPDISJUVFKG-UHFFFAOYSA-N 392.261 5.371 30 20 GKED Cc1nc(NC(=O)CCCCCC#N)sc1Cc1cccc(Cl)c1F 588723903 ORIZXYYNMMUYOS-UHFFFAOYSA-N 379.888 5.247 30 20 GKED N#Cc1cc(NC(=O)c2cnc(-c3ccccc3Cl)s2)nc2ccccc12 589042869 VRRQZEILGKPUSU-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1cccc(O)c1)CC1CC1 589327948 SBLPMLYOICCQBZ-INIZCTEOSA-N 395.528 5.088 30 20 GKED N#Cc1cccc2c1CN(C(=O)Nc1cccc(CSC3CCCC3)c1)C2 593161284 BOXYIIBROJASKA-UHFFFAOYSA-N 377.513 5.282 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)c1 603736501 NPCPSSUQNSALTK-UHFFFAOYSA-N 387.386 5.147 30 20 GKED CC(C)=C[C@H]1[C@@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1(C)C 604003414 ABKIPROAUYSJLC-GMAHTHKFSA-N 388.511 5.509 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 604547427 ZBLXUQVFBVOLPD-SMDDNHRTSA-N 385.533 5.118 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)cs1 608847037 CABPUYFRHKNXHH-UHFFFAOYSA-N 381.526 5.222 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCc1ccsc1 609061663 GSZSWSCMHXHLHS-UHFFFAOYSA-N 376.481 5.079 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)Cc1ccc(C#N)cc1 609062168 CCWDVELOLGCULZ-UHFFFAOYSA-N 390.870 5.280 30 20 GKED COc1cc(CNc2ccccc2SC[C@@H](C)C#N)ccc1OC(F)F 609384668 FXJNSCUJEJPXOB-ZDUSSCGKSA-N 378.444 5.160 30 20 GKED C[C@H](SCC(=O)Nc1cc(Cl)c(Cl)cc1Cl)c1ccc(C#N)cc1 609825761 SBENLNNCWZOXFT-JTQLQIEISA-N 399.730 5.951 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccccc3N3CCCC3)c2)cc1 609990529 PTDGADGJGXMDBY-UHFFFAOYSA-N 382.467 5.154 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2ccc(C#N)cc2)nc1-c1ccccc1 610112846 DVLWXWWRUZJVCJ-HXUWFJFHSA-N 385.467 5.314 30 20 GKED CC(C)COc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 613392537 SFUGKYIUDYDKHK-IBGZPJMESA-N 376.481 5.335 30 20 GKED Cc1cc(F)c(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)cc1F 619125098 JDAOVNFOQRRPQQ-UHFFFAOYSA-N 377.275 5.057 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 665838145 RNQPRNRTRYIPPR-BGYRXZFFSA-N 395.890 5.307 30 20 GKED C=CCC[C@H](NC(=O)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 676423444 VKSSDUSWOYWMCE-KMDXXIMOSA-N 392.543 5.503 30 20 GKED FC(F)(F)c1cnc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)s1 683929510 DDYAFCWZZPERQR-UHFFFAOYSA-N 376.272 5.428 30 20 GKED C=CCn1c(C)nn(CN2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)c1=S 726787128 NMYYGLCOMNHTNV-QGZVFWFLSA-N 396.482 5.112 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)c(C#N)c2n1CCC2 731937103 FQQPPJBELNTERO-HJWRWDBZSA-N 393.899 5.287 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 732495585 DNJDVSYFOXYRMX-QUCCMNQESA-N 392.549 5.866 30 20 GKED COc1cc(CSCc2cc(Cl)ccc2OCC#N)ccc1SC 735318932 RCWRUKRHSFBRSZ-UHFFFAOYSA-N 379.934 5.406 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cccc(Nc3ccccc3)c2)c1 735658318 BXAXCLRXEXMHJF-JOCHJYFZSA-N 385.467 5.041 30 20 GKED C=CCCCN(C)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 736526585 RVYYVBGROSMADE-UHFFFAOYSA-N 382.554 5.627 30 20 GKED Cc1c(Cl)cccc1N=C1SCCN1C(=O)c1coc(-c2ccccc2)n1 737472842 MUUGHSCFWAYGKF-UHFFFAOYSA-N 397.887 5.180 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)OC(=O)c1ccccc1OCC#N 739300938 JNWCXTGYHSDCEC-CQSZACIVSA-N 396.443 5.078 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)cc1 741540820 ZJUBCUJOQLTVEY-BAGYTPMASA-N 388.417 5.362 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C(/C)c2ccc(F)cc2)cc1 743447219 LGFNJPWDDIWHAF-CXNOYPDYSA-N 378.447 5.090 30 20 GKED C[C@]1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCc2ccccc2C1 744034517 ACWPXDZZNZJNKJ-IERDGZPVSA-N 380.900 5.321 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 747661414 UHAQQYPMUTXRRC-ZPHPHTNESA-N 382.463 5.572 30 20 GKED Cc1cc(CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)ccc1Br 751870872 RVDVREUFTJOBCQ-CQSZACIVSA-N 391.334 5.147 30 20 GKED C=C[C@H](CC(=O)OCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 758919118 DVMUCLYHUPXNRI-LJQANCHMSA-N 385.463 5.195 30 20 GKED C=CCC(CC=C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 759009124 SGULAIMBJVSOAN-UHFFFAOYSA-N 398.528 5.256 30 20 GKED C=CCN(C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F)C1CC1 772273776 DKLYDOJUQHEOGC-UHFFFAOYSA-N 399.413 5.235 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1c(C)nn(Cc2ccccc2Cl)c1Cl 775923174 KCNSKQJSARCRSQ-CYBMUJFWSA-N 380.319 5.021 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(C4CC4)s3)cc2F)c1 779595344 IBTQAGHPACLIOA-UHFFFAOYSA-N 379.460 5.222 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(Cl)ncc3Cl)c2)cc1 780601651 JQWPXKDIMYNIRY-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCOC1 781447184 DICWVAXEWPJLTL-UGSOOPFHSA-N 395.311 5.110 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C23CC(c4ccccc4)(C2)C3)cc1 790292444 JFCOPRYEGCTKFB-GMUMFXLYSA-N 378.475 5.402 30 20 GKED C#Cc1cncc(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)c1 798244748 LAYXLQZFGYNOCU-LBPRGKRZSA-N 378.419 5.225 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801670972 SYWARHCBQSCSHK-PXAZEXFGSA-N 396.409 5.606 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCCc1ccccc1Cl 810529163 AJASCCDQTNTERE-LJQANCHMSA-N 396.918 5.135 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1c(Cl)cccc1Cl 813216051 FKFBMQGXYQMJEX-ONGXEEELSA-N 387.188 5.387 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](c3ccccc3)C2)cc1 814576879 IJPZXXPCHFDDSI-NOZRDPDXSA-N 395.506 5.754 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942368 XSDBKMNPASCRMS-YJBOKZPZSA-N 375.497 5.116 30 20 GKED C=CCN(C(=O)/C=C/c1cccs1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 896595648 WGHLNBJQNUALKD-MDZDMXLPSA-N 397.481 5.012 30 20 GKED CCc1nnc(S)n1N=Cc1ccc(-c2ccc(Cl)c(Cl)c2)s1 914866532 LYWKTRKJXJSPPA-UHFFFAOYSA-N 383.329 5.047 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(N=Cc2cc(Br)ccc2O)cc1 915113169 PRIODPGNXHTFLH-FQEVSTJZSA-N 391.268 5.561 30 20 GKED CC(C)c1cccc(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915179821 JAOPTJKXIKKZPY-XMMPIXPASA-N 384.479 5.483 30 20 GKED Cc1cc(C)c(C=Nn2c(C)nc3scc(-c4ccccc4)c3c2=O)c(C)c1 916310298 XAJBUTWKEHQRQH-UHFFFAOYSA-N 387.508 5.241 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(OC2CCCC2)cc1 916918431 PBZXQFGKEGTKHY-JOCHJYFZSA-N 398.462 5.122 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047322 WVHKXKXMYBSFKQ-CZUORRHYSA-N 398.915 5.718 30 20 GKED O=C(/C(=C/c1csc([N+](=O)[O-])c1)c1nc2ccccc2s1)c1ccccc1 917143532 IMOPFFBKLFJFPX-GDNBJRDFSA-N 392.461 5.690 30 20 GKED O=C(Nc1cccc(C=NNCc2ccccc2Cl)c1)c1ccccc1Cl 918152347 DUULMQWFUAORSG-UHFFFAOYSA-N 398.293 5.369 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 920017850 NCFNXFVWVMDALZ-LLVKDONJSA-N 397.780 5.338 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2ccccc21 1776308881 ULUMZPWSDJJEMH-HKPSVDRMSA-N 382.459 6.071 30 20 GKED O=C(/C=C\c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccc(Cl)cc2)s1 1777570156 YZDPRRZTWFDNPG-WAPJZHGLSA-N 386.831 5.802 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@@H](c3ccccc3)C(C)C)cc2)CCC1 1786184543 ZZAWVHBFLWBAND-HSZRJFAPSA-N 390.527 5.136 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1OC 47376791 ZWWMVHDDHGARQR-MRXNPFEDSA-N 394.858 5.176 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc2ccccc12 58773066 HYTGAENGYCALSJ-UHFFFAOYSA-N 379.419 5.460 30 20 GKED COc1ccccc1C(C)(C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 66956138 SHLYWIKVQLVKRC-OAHLLOKOSA-N 383.517 5.146 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(Cc2ccccc2F)n1 117658125 RGMOMSMMZNRFDL-UHFFFAOYSA-N 397.500 5.131 30 20 GKED C=C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 120017693 WFBSRSHVJUPFNI-UZLBHIALSA-N 388.492 5.355 30 20 GKED Cc1nc(-c2cccc(NCc3cn(CCC#N)nc3-c3ccccc3)c2)oc1C 121504885 FTJAOBLHMVAESW-UHFFFAOYSA-N 397.482 5.348 30 20 GKED COc1ccc(F)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 126057789 XINBWGCAVXMIFX-UHFFFAOYSA-N 392.455 5.251 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)Cc1cccc(OCC#N)c1 126611778 BVLVROCUWSMPFQ-LJQANCHMSA-N 384.479 5.018 30 20 GKED Cc1c(NC(=O)c2ccccc2-c2ccccc2C#N)cnn1-c1ccccc1F 129916429 IXOWECMICKXTAJ-UHFFFAOYSA-N 396.425 5.111 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1)c1ccccc1 134932790 ZXKKZBRMTKAYJV-PIIWDFAUSA-N 389.520 5.293 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cccc(C)c4o3)n2)cc1 147306112 MEUDHVZXUPEZTE-KRWDZBQOSA-N 388.448 5.363 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccccc4F)sc32)c(F)c1 151148550 SCCCKDAWIZVTEA-SFHVURJKSA-N 381.451 5.127 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 179772351 RRWQIQWQSGEXMU-CYBMUJFWSA-N 376.909 5.128 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cccnc1)c1ccc(F)c(F)c1 185475122 PJUDPAXXVNQBMS-YADHBBJMSA-N 393.437 5.066 30 20 GKED C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 247052276 WSYPBXNGPJJRMF-LZLYRXPVSA-N 397.519 5.630 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(Cl)c(Cl)c3Cl)cc12 303011215 KBMLGSQCAKHIEI-ZZXKWVIFSA-N 380.662 5.133 30 20 GKED CC(C)(/C(O)=N/[C@@H]1CCC[C@@H]2OCC[C@H]21)c1csc(-c2cccs2)n1 328810994 MSNHNFYGKJSWDI-MJBXVCDLSA-N 376.547 5.063 30 20 GKED COc1ccc(C(=O)N2CCCC2)cc1N=C(O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 328983967 FWCZCAAEYYZYGU-YTQUADARSA-N 384.520 5.126 30 20 GKED Cn1ccc2ccc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)cc21 329417925 DPJYXQAAWVHPLY-SFHVURJKSA-N 376.504 5.273 30 20 GKED Cc1ccc2oc(N3CCC[C@@H](c4n[nH]cc4N=C(O)C4CCCC4)C3)nc2c1 329579744 WQYLCCUPDYBXDO-MRXNPFEDSA-N 393.491 5.022 30 20 GKED Cc1c(N=C(O)N(C)C)cccc1N/C(O)=N/C1CCC2(CCCCC2)CC1 329921731 STXHVSQTKGKYLG-UHFFFAOYSA-N 386.540 5.321 30 20 GKED Cc1cccc(C2(C/N=C(/O)C3CCC(/N=C(/O)C4CC4)CC3)CCCC2)c1 330022762 HOTQPBZQTUNJJN-UHFFFAOYSA-N 382.548 5.689 30 20 GKED COc1cc(C2(/C(O)=N/[C@H]3CCc4cnn(C(C)C)c4C3)CCCC2)ccc1C 330147536 LVWWJIZQQNYRGB-FQEVSTJZSA-N 395.547 5.107 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)C1 412198910 GHRANBPRTQYWLC-RZTDZLQYSA-N 398.428 5.290 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 431726337 GVZOXFBFZWKLCB-AUUYWEPGSA-N 390.314 5.789 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 433261085 UVGWKJBCFRCMLI-INIZCTEOSA-N 377.822 5.834 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](Cc1ccccc1)c1cccs1)c1ccccc1 438856256 KQVDALGHFIAVJL-NHCUHLMSSA-N 389.524 5.376 30 20 GKED C=CCC[C@@H](NC(=O)NCc1sc(C)nc1C)c1ccc(C(F)(F)F)cc1 440863855 VQQAVCQTYJQYOG-MRXNPFEDSA-N 397.466 5.285 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC1CCC(C#N)CC1 440937801 SLCMDZODTFQPPU-UHFFFAOYSA-N 388.471 5.110 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](C)(c2ccccc2)C1 446852182 MVXKTMMWKOVZTD-HTAPYJJXSA-N 379.529 5.134 30 20 GKED CC[C@H](CC(F)F)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457708077 MWMRBCUKIRICOX-PRHODGIISA-N 377.275 5.106 30 20 GKED Cc1cc(NC(=O)N2CCO[C@H](c3cccc(C#N)c3)C2)ccc1-c1ccccc1 460250182 GHODUXKOTGGMRQ-DEOSSOPVSA-N 397.478 5.139 30 20 GKED C[C@@H](C(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 463722624 BHCDVMGJMRCFOE-FOIQADDNSA-N 386.417 5.434 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F)c1ccc(F)c(F)c1 464332198 JYFLUULEOGJUCW-COXVUDFISA-N 390.396 5.345 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1ccc(C#N)c(F)c1 464644366 BAWWPJDYPNQIHO-UHFFFAOYSA-N 377.853 5.097 30 20 GKED N#CC[C@@H](CC(=O)NC1(c2ccc(Br)cc2)CCC1)c1ccccc1 475181572 CWNHIFJRTUNMFI-KRWDZBQOSA-N 397.316 5.032 30 20 GKED C=C(C)[C@H](NC(=O)NCc1coc(-c2ccc(C)cc2)n1)c1ccc(F)c(F)c1 477732185 RLVFGTXBHONEEC-FQEVSTJZSA-N 397.425 5.045 30 20 GKED N#Cc1ccc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c(Br)c1 481095380 SDCWIZMNPSOZDM-GOSISDBHSA-N 396.288 5.189 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Sc1ccccc1)c1cnc2ccccc2n1 483218343 ZFYXHVCBWCVKBO-GOSISDBHSA-N 381.460 5.271 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Cl)c1Br 485209678 PVJANPOGVBDAEF-UHFFFAOYSA-N 385.714 5.384 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C)c1ccccc1 488709298 BOOOXLVBNBWWDR-AVRDEDQJSA-N 390.527 5.166 30 20 GKED CCCCc1noc([C@@H](C)SCc2cc(C#N)ccc2Br)n1 492262972 YRTXXWUZGHOYGX-LLVKDONJSA-N 380.311 5.041 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)c1nc(O)c2c(-c3cccs3)csc2n1 498155771 KSADNHQCZDYRRQ-JTQLQIEISA-N 396.522 5.245 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cccc(OCc3ccc(Cl)cc3)c2)n1 510344517 CICWSGCGZJVEBF-SFHVURJKSA-N 382.872 5.174 30 20 GKED COc1c(Cl)cccc1NC(=O)c1ccccc1Sc1ccccc1C#N 511505913 MFQORULLWSNCKQ-UHFFFAOYSA-N 394.883 5.624 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1Cl 518739009 JTHLHSSZVUHSEN-ZIAGYGMSSA-N 390.961 5.854 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1csc2ccccc12 520195985 TVLNLUYVKMOMHS-OAHLLOKOSA-N 395.553 5.660 30 20 GKED CO[C@](C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 520715276 PGLSQLFGDFJACN-DEOSSOPVSA-N 386.451 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Sc1ccc(Cl)cc1 520924077 HYOUINZVLLJOHZ-KBPBESRZSA-N 390.961 5.854 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2cccc(Cl)c2Cl)c1 523228533 JSBPACWTEKMASK-UHFFFAOYSA-N 387.222 5.289 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1CCC(c2ccccc2)CC1 524565108 HROCKNUHRAJYHY-QHGAOEGBSA-N 393.556 5.786 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)cc1 526967186 QZQOUHRUJIFMIP-KRWDZBQOSA-N 389.524 5.117 30 20 GKED C=CCCOCCCCC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 538280912 HFVATVPKCCXWMO-UHFFFAOYSA-N 381.969 5.186 30 20 GKED C[C@@H](NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1cccc(C#N)c1 540596574 FTVHMVSJIOQOSL-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 542674598 HTPYJZCOIWPLMU-RBBKRZOGSA-N 398.478 5.165 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N(C)[C@@H](C)c1cccs1 554925029 PGORGZAHIARMQU-LSDHHAIUSA-N 386.496 5.002 30 20 GKED Cc1ccc([C@H](C)N(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 557418912 IBBACHSILRGFIY-HKUYNNGSSA-N 395.572 5.187 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(c2ccccc2F)CCCC1 557609641 YQJMIPPZFSGXTN-UHFFFAOYSA-N 383.511 5.020 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H]1CCc2ccc(C#N)cc21 558504733 XKYHZVLBCFFUJR-ZUOKHONESA-N 377.488 5.467 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)c(Cl)c1 574582793 XZMDVIAOJPEOLD-SFHVURJKSA-N 385.851 5.323 30 20 GKED N#CCCC1CCN(Cc2csc(-c3ccc(Br)cc3)n2)CC1 579708963 QETCRVUFYGKOIW-UHFFFAOYSA-N 390.350 5.088 30 20 GKED CC(C)n1c(-c2ccc(-c3ccc(F)cc3)s2)nnc1N1CCC(C#N)CC1 581590403 VOBJVYBFTMKBDW-UHFFFAOYSA-N 395.507 5.134 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(F)c3ccccc23)cc1OCCCC#N 581906470 AAWWEELPPFQKEV-KRWDZBQOSA-N 392.474 5.521 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2cccc(C#Cc3ccccc3)c2)s1 592897413 IOPUWIZDEMAVMF-KRWDZBQOSA-N 389.524 5.385 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 606191535 YGROENANOHNFEV-SNVBAGLBSA-N 393.302 5.681 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1oc2ccccc2c1C 609061949 MGLNKQOIQAIGQD-UHFFFAOYSA-N 396.446 5.753 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)c1sc2cc(C)ccc2c1Cl 609149218 HSNSMRVNPZWZKM-UHFFFAOYSA-N 398.915 5.024 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1c2c(nc3ccccc13)CCC2 609377311 BKCGZCBCLIDENO-OAHLLOKOSA-N 387.508 5.228 30 20 GKED Cc1ccc(SCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c(C)c1 609460491 BIYDQHKZLOKKCN-INIZCTEOSA-N 379.312 5.083 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609497659 UHZIESGRLKDADP-UHFFFAOYSA-N 388.492 5.435 30 20 GKED N#Cc1ccc(CNC(=O)N(Cc2ccccc2Cl)C2CCCC2)c(F)c1 610402324 HZMFLUSCHRJIRK-UHFFFAOYSA-N 385.870 5.005 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CCC(c3cccc(F)c3F)CC2)c(Cl)c1 613846094 QNNJVGSIPURFTA-UHFFFAOYSA-N 395.236 5.163 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)c1ccsc1 619787690 ZXSXALZWARJJQT-HNNXBMFYSA-N 377.469 5.603 30 20 GKED Cc1nc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cs1 647323537 WPLZQWGHLAWVEQ-QMMMGPOBSA-N 386.336 5.914 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C1CCSCC1 648494220 DWXOFVJWJYYPKG-UHFFFAOYSA-N 389.336 5.058 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](Cc1ccccc1)c1ncco1 654047435 PKOQTINYLPIPGX-OAQYLSRUSA-N 389.499 5.632 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN(c2ccc(F)cc2F)C1 682777359 NZIBTOAGQRCDAT-GOSISDBHSA-N 399.485 5.217 30 20 GKED CCCc1occc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 684948415 GKRRFSZLHNOCQI-LBPRGKRZSA-N 378.375 5.351 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@H](C)c1nc(C(C)(C)C)no1 728062922 REFNFUMZVCSCEJ-MRXNPFEDSA-N 390.487 5.299 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccc(OCC)cc2)c1 728227268 DYWADSNEFFJPDW-UHFFFAOYSA-N 386.520 5.470 30 20 GKED CC(C)COc1ccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 730170906 LUSALSHEOGPOFR-RUZDIDTESA-N 398.506 5.558 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)CSc3ccccc3)n2)cc1 732496484 WPYPRYCWHRGGNO-VQIMIIECSA-N 392.549 5.723 30 20 GKED CCCCc1ccc(NC(=O)NCc2ccc(OC)c(O[C@H](C#N)CC)c2)cc1 733616383 ROMUFVXIRALCCO-FQEVSTJZSA-N 395.503 5.040 30 20 GKED CC(C)(C)c1ncc(/C=C2\Cc3c(F)cc(Br)cc3C2=O)s1 736433428 FMEMXZRUFJAGST-RUDMXATFSA-N 380.282 5.165 30 20 GKED CC(=O)c1ccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)cc1 745724133 KKMKFNTXHBEQGN-UHFFFAOYSA-N 385.492 5.164 30 20 GKED CO[C@H](C)c1nc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cs1 749135094 KOFODSCYOSREJD-CQSZACIVSA-N 397.475 5.052 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)[nH]c1C 749582020 HEONLYGDRBCOQE-UHFFFAOYSA-N 392.462 5.485 30 20 GKED Fc1ccc(C(F)(F)F)cc1NN=Cc1sc(N2CCCC2)nc1Cl 753946994 NHCKBMUYHDYYEH-UHFFFAOYSA-N 392.809 5.001 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1cc(Br)cc(Cl)c1O 756770413 VQBCHYQMRRHUJB-YVEFUNNKSA-N 393.712 5.504 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 761047721 OULHRFVKPNGRGO-GDBMZVCRSA-N 376.909 5.254 30 20 GKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1cc(Br)ncc1F 762421560 JXBFNSUHRNTFPQ-VOTSOKGWSA-N 389.249 5.003 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 774446599 CRMYSBXYZBFSOO-CTNGQTDRSA-N 388.433 5.627 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccc(Cl)cc2)no1 775669623 FWEHCJLMCIRMJZ-AWEZNQCLSA-N 380.879 5.042 30 20 GKED CSc1ccc(C)c(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 775984604 KWUPSXZISLZMHD-NRFANRHFSA-N 387.508 6.016 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(CCc1ccccc1F)C1CCCC1 780666687 CBQNEYATQGIPMX-QGZVFWFLSA-N 395.478 5.136 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=S)Nc1cccc(OC(F)(F)F)c1 783732614 RZARZWANKYCCNZ-UHFFFAOYSA-N 395.406 5.053 30 20 GKED Cc1cnc(Cl)c(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1 787985498 QWCZOWXXTZROAP-UHFFFAOYSA-N 377.831 5.268 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792092853 SDDAXOQQHRCOLY-QFIPXVFZSA-N 384.479 5.417 30 20 GKED N#C[C@@H](C(=O)COc1ccc2oc3c(c2c1)CCCC3)c1nccc2ccccc12 792108790 ZDFMMVYGRIQBNQ-NRFANRHFSA-N 396.446 5.115 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 793279801 ALUHVSOLVTWKJW-JXFKEZNVSA-N 396.412 5.699 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 797943536 SHNHGXFNHXDPSP-KOLCDFICSA-N 388.361 5.317 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1 798008490 MCGAGVAXVRBXAG-OYDLWJJNSA-N 399.469 5.549 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1Br 798814350 KZPIWGPWDQTKGD-HNNXBMFYSA-N 393.284 5.151 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 808282086 WDCXCRXHQWWWTB-UHFFFAOYSA-N 388.279 5.549 30 20 GKED N#Cc1ccc(C=NNc2ncc(C(F)(F)F)cc2Cl)c(C(F)(F)F)c1 811629715 CPFRMYMGRBHGIX-UHFFFAOYSA-N 392.690 5.090 30 20 GKED N#Cc1csc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)n1 811689540 GJHGVWCMGCZTRB-YRNVUSSQSA-N 383.885 5.004 30 20 GKED COC[C@H](C)[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 813060476 ASPOQYPTCVHNDP-MISXGVKJSA-N 397.327 5.212 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2ccc(C(F)(F)F)cc2)S1 915848378 NMJQTBQFWIGTBU-XNTDXEJSSA-N 376.403 5.214 30 20 GKED Cc1sc(NC(=O)CSc2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 1651840560 UAKPLJAJBRUOKP-UHFFFAOYSA-N 399.928 5.374 30 20 GKED CC1(C)C(=NNc2ccccc2C(=O)O)C[C@H]1c1ccc(Br)cc1 1776032087 MNHMTKIBEWDREL-HNNXBMFYSA-N 387.277 5.129 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1cc(C(=O)O)ccc1OC(C)C 1776032775 RGIJUWGRJZPNMB-UHFFFAOYSA-N 381.259 5.315 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ccc(OC(F)F)cc3)s2)c1 1776040743 PRACQXIIVLRIMO-UHFFFAOYSA-N 388.395 5.161 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)s2)c1 1776051949 SHVMWCPZUNGFLJ-UHFFFAOYSA-N 391.370 5.545 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3ccc(Cl)cc3)cc2)oc1C(=O)O 1776115311 UOJZLKGMMYLDIT-NYYWCZLTSA-N 396.826 5.415 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](c2ccccc2)[C@@H](C)C(=O)O)c1 1776787303 ODIMZLOZQNFUAM-AUSIDOKSSA-N 383.532 5.587 30 20 GKED CCc1cccc2c(/C=C3\S/C(=N\c4c(C)cccc4C)NC3=O)c[nH]c12 7165093 TYMZWDACIZIYTO-WQRHYEAKSA-N 375.497 5.239 30 20 GKED Cc1cc(-c2cc(C(=O)Nc3ccc(C#N)cc3)c3cnn(C(C)C)c3n2)c(C)o1 11367289 WIVAVWMBJWDLQX-UHFFFAOYSA-N 399.454 5.013 30 20 GKED N#Cc1cccc(/C=C(\c2nc3ccccc3[nH]2)c2nc3ccccc3s2)c1 14177760 OYQVXDBXMWUSCS-GHRIWEEISA-N 378.460 5.633 30 20 GKED Cc1ccc(CNC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)s1 45678827 NQDLYVXMHLWYCS-UHFFFAOYSA-N 391.496 5.023 30 20 GKED COc1ccc(CNC2(c3ccc(Cl)cc3)CCC2)cc1OCCCC#N 51188686 ZXBLVTYDSAOBPF-UHFFFAOYSA-N 384.907 5.200 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(NC(=O)CC(C)C)cc1 56588472 URDROSBERZTGBU-UHFFFAOYSA-N 383.467 5.030 30 20 GKED CCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)sc1C 66544793 FEAKCFYTSDXZQR-MRXNPFEDSA-N 377.494 5.104 30 20 GKED CCN(CCC(=O)Nc1ccccc1-c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 110982851 VSVQRGRREWUJRJ-FQEVSTJZSA-N 397.522 5.637 30 20 GKED CC(=O)N(c1nc(COc2ccc(C#N)cc2F)cs1)c1cccc(C)c1C 127586306 YHANBKUGLQUTLZ-UHFFFAOYSA-N 395.459 5.034 30 20 GKED COc1ccc(CNc2ccc3oc(C4CC4)nc3c2)cc1OCCCC#N 156644586 AUNVYVAAAGLQGQ-UHFFFAOYSA-N 377.444 5.008 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 163108517 MXTNKDFDFUEQNZ-QUCCMNQESA-N 398.528 5.123 30 20 GKED C[C@H](Sc1ccccc1C#N)c1nnc(-c2ccc(Cl)cc2Cl)o1 176754842 NZGBOJNHUWZXND-JTQLQIEISA-N 376.268 5.768 30 20 GKED COCCc1nc(C)c([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)s1 180220443 ACFTUPMXGKQDJV-INIZCTEOSA-N 391.540 5.030 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2cccnc2)n1 189898417 JLJMNAKOGUYJIH-UHFFFAOYSA-N 377.513 5.238 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1S[C@@H](C)CC#N 189966466 APSWCOAHLXIWGO-INIZCTEOSA-N 392.528 5.616 30 20 GKED CCCNc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 192415771 ANJJRFWDLPWREL-MRXNPFEDSA-N 382.533 5.224 30 20 GKED CCCN(CCC)c1ccc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)cc1 302947157 CNXMZUIIBQXLJO-JLHYYAGUSA-N 392.499 5.166 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC(c4ccccc4)CC3)c2)c1 303578935 DERDPCUSGMFMQJ-UHFFFAOYSA-N 396.490 5.157 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN([C@@H]2C=CCCCCC2)C1)c1ccccc1 328853935 SRDXJYRUUCDOJZ-VQTJNVASSA-N 378.520 5.114 30 20 GKED CC(C)/C(O)=N/C1CCN(/C(O)=N/[C@@H]2CCCc3ccc(C(C)C)cc32)CC1 328913115 HVJJKUCHDLACTI-OAQYLSRUSA-N 385.552 5.178 30 20 GKED OC(=Nc1scnc1C1CC1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 328926226 ORVANHRIHRTESC-GFCCVEGCSA-N 398.315 5.026 30 20 GKED C[C@@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(Cl)cn1 329353449 UZKSJQQKBVUPNW-ZBFHGGJFSA-N 386.927 5.259 30 20 GKED OC(=Nc1ccc(F)cc1NC1CC1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329478391 QCONZMCIUIXJGU-INIZCTEOSA-N 396.510 5.495 30 20 GKED Cc1c(Cl)cccc1N=C(O)[C@@H](C)N[C@@H]1c2ccccc2CC12CCOCC2 329778795 LKHOUVAFNGPHPS-IIBYNOLFSA-N 398.934 5.309 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1csc(-c2ccc(Cl)s2)n1 410373205 KDFUGGMZYYTJEZ-UHFFFAOYSA-N 388.945 5.825 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)c1 429832600 OEJNOCJJLSONIN-UHFFFAOYSA-N 386.904 5.529 30 20 GKED Cc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c(OCC(F)(F)F)c1 439318387 QNNPNRHQHHBILX-MRXNPFEDSA-N 391.393 5.103 30 20 GKED CCCc1c(NC(=O)c2cc3cccc(C)c3o2)cnn1-c1cccc(C#N)c1 440084221 VWTICUAJBNFBLR-UHFFFAOYSA-N 384.439 5.003 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cccc(-c2ccccn2)c1 440238211 HWMSELJNPKWBEM-UHFFFAOYSA-N 397.931 5.361 30 20 GKED Cc1sc(CNC(=O)[C@H](C)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 461917087 JNGXLAOAHBRXOM-CYBMUJFWSA-N 395.915 5.064 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1csc(-c2ccccc2F)n1 464822002 JWLVHJLWCIUFJE-PZJWPPBQSA-N 377.488 5.221 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3C[C@H]4CCC[C@@H]4C3)cc2Cl)c1 465252668 PNDFCBOKGODRNC-QZTJIDSGSA-N 395.890 5.054 30 20 GKED C=CCCN(C)Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 467299963 OLUISXHOFVKCGX-UHFFFAOYSA-N 377.941 5.106 30 20 GKED C[C@H](NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1ccc(C#N)c(F)c1 468028815 JBOJWMQTXNZLNM-YJBOKZPZSA-N 391.515 5.277 30 20 GKED C=CCc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2C)cc(OC)c1OC 469994679 UKUXTDQSRPYMFV-UHFFFAOYSA-N 379.378 5.012 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 471911812 OSGPTQOTNOOQOA-XZOQPEGZSA-N 389.543 6.066 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCC4(CC4)C3)cc2Cl)cc1 473653435 GNKOASYICOCERR-UHFFFAOYSA-N 381.863 5.412 30 20 GKED C=CCCC1(C(=O)Nc2ccc(Cl)c(-c3nnc4n3CCCCC4)c2)CC1 474580217 TVEZXYQKRUBGAK-UHFFFAOYSA-N 384.911 5.010 30 20 GKED N#C[C@@H](C(=O)c1coc2cc(F)ccc12)c1nc(-c2c(F)cccc2F)cs1 483524254 MKBDIZXBVOGKPT-LBPRGKRZSA-N 398.365 5.464 30 20 GKED CN(C(=O)c1ccccc1NCc1ccccc1C(C)(C)C#N)C1CCCCC1 486436079 SHEULRQYORXSCT-UHFFFAOYSA-N 389.543 5.505 30 20 GKED Cc1csc(-c2cccc(C(=O)N[C@H](CCCC#N)c3ccccc3)c2)n1 487615441 FUNPUEPERVECPI-HXUWFJFHSA-N 375.497 5.284 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccc(Br)cc2)c2ccccc2F)c1 490137681 RWUAHOXCYKNWGQ-NRFANRHFSA-N 395.275 5.339 30 20 GKED CSc1ccc(N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 496247375 SJVRXNINKFRANN-UHFFFAOYSA-N 392.455 5.488 30 20 GKED C=CCN(C(=O)c1oc2ccc(Cl)cc2c1C)c1nc2c(s1)CCCC2 498724682 MNGYMSHSNZRUHJ-UHFFFAOYSA-N 386.904 5.563 30 20 GKED C[C@](NC(=O)c1ccc(F)cc1C(F)(F)F)(c1ccccc1)C(F)(F)F 504547609 NWJXJGCHIPIMGZ-HNNXBMFYSA-N 379.275 5.052 30 20 GKED C[C@@H]1C/C(=C\c2ccco2)c2nc3ccccc3c(C(=O)NCCCCC#N)c2C1 505501987 URRLQDTZEQSSED-GROYHEBESA-N 399.494 5.374 30 20 GKED N#C[C@@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1F 505982414 SGDBTXPMXDTHIV-OAQYLSRUSA-N 376.456 5.113 30 20 GKED C[C@@H]1CCC[C@H](CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 510610401 XNQCJJTYFAUKBE-QUCCMNQESA-N 391.515 5.279 30 20 GKED N#Cc1cccc(COc2cccc(NCc3cc(-c4ccccc4)no3)c2)c1 511726065 XJHDEBQAIWOEDN-UHFFFAOYSA-N 381.435 5.404 30 20 GKED N#Cc1ccccc1CSCCNCc1csc(-c2ccc(Cl)cc2)n1 520208910 WITSZNBGCFKRSL-UHFFFAOYSA-N 399.972 5.358 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(OC)cc1 520326284 XZFGHUADGMXTOL-UHFFFAOYSA-N 386.451 5.220 30 20 GKED N#CCCn1cc(CNCc2c(Cl)cccc2Cl)c(-c2ccccc2)n1 522197315 AXCFHCHGBRECEL-UHFFFAOYSA-N 385.298 5.060 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1 525000807 MEUKGGGXXOQMAD-UHFFFAOYSA-N 380.414 5.101 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(-c2nncs2)cc1 535841665 BVKJEIAVVNBPJH-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cccnc1[C@@H](NC(=O)NCc1ccc(-c2ccccc2C#N)cc1)C(C)C 540266109 RQYXZQRGAIWAQI-QHCPKHFHSA-N 398.510 5.125 30 20 GKED CN(C(=O)c1cccc(CC#N)c1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 540632655 KKODHFAIEDOCKK-WOJBJXKFSA-N 386.417 5.180 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158043 SVTZEBJQDKUYHK-IBGZPJMESA-N 398.510 5.301 30 20 GKED C=CCC[C@@H](C(=O)N(C)Cc1ccc(OC(F)F)c(OC)c1)c1ccccc1 547627138 RZVFMCPWFXREHV-GOSISDBHSA-N 389.442 5.005 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC4(CC4)c4ccccc43)cc2)cc1 547821120 PIUYOGKPRUQIMA-UHFFFAOYSA-N 380.447 5.237 30 20 GKED N#CC1(N(C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)C2CC2)CCC1 556439906 LFCNXRJHUNMTBX-UHFFFAOYSA-N 392.311 5.168 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCN(C)c2ccccc21 560400095 OKNHHTBVKKLNBW-SJLPKXTDSA-N 394.544 5.174 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)c(C)c1 570359739 JUFCEBWRAIMMOV-OAHLLOKOSA-N 382.504 5.567 30 20 GKED Cc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)c(OC[C@@H]2CCCO2)c1 571847043 MEBFGKXZRKOCPH-KRWDZBQOSA-N 390.405 5.055 30 20 GKED C=CCN(C(=O)[C@H]1CCC(=O)c2ccccc21)c1nc(-c2ccccc2)cs1 581681279 HZECNYLKNQTDRJ-IBGZPJMESA-N 388.492 5.089 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccccc2[C@@H](C)C1 593157969 PWBLBJIBFUYYJI-IRXDYDNUSA-N 379.529 5.275 30 20 GKED COc1ccccc1-c1csc(C2CCN([C@H](C#N)c3ccccc3)CC2)n1 595463085 ZIYDNXSEKFIBIN-OAQYLSRUSA-N 389.524 5.263 30 20 GKED CC(C)c1cc(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)nn1C(C)(C)C 603749928 KITGVGYLSMJFSF-UHFFFAOYSA-N 393.516 5.009 30 20 GKED CCCOc1nc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc2ccccc12 604134523 JPWLAOSCWZBXBT-MRXNPFEDSA-N 387.464 5.123 30 20 GKED CCOc1ccc(OC)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609182804 ZOCHBWXOFLDTTJ-UHFFFAOYSA-N 388.423 5.010 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ncc(-c4ccccc4)s3)cc2)nc1 609499590 GXOIFUOBEPQHDK-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1cccs1 609968339 ABDVEIYWCYBLHP-INIZCTEOSA-N 378.472 5.091 30 20 GKED CCOc1ccc([C@H](NC(=O)N[C@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 610355468 RSXYAGZPTPUDAA-HOYKHHGWSA-N 399.494 5.107 30 20 GKED Cc1c([C@@H](NC(=O)N[C@H](C)c2cccc(C#N)c2)C(C)C)oc2ccccc12 610403046 ZJVWACOJYQVFRN-IERDGZPVSA-N 375.472 5.370 30 20 GKED Fc1ccc(-c2csc(N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)n2)cc1 674931573 QYVSPLMFFSNGHG-QWRGUYRKSA-N 398.347 5.516 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(N2CCCC2=O)cc1 725779703 UNHIGFCCQQEFIQ-UHFFFAOYSA-N 397.693 5.005 30 20 GKED CC(C)C[C@@H](NC(=O)c1ccccc1OCC#N)c1cccc(C(F)(F)F)c1 726756630 DEMSRRKLIZNFEL-GOSISDBHSA-N 390.405 5.125 30 20 GKED Cc1oc(-c2ccsc2)nc1CON=Cc1ccc(Br)cc1 726786734 AEFHIBIFFKZTJV-UHFFFAOYSA-N 377.263 5.025 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)Nc3ccc(Cl)nc3)cc2)cc1 727083317 DENKQASVEMTYAI-UHFFFAOYSA-N 380.860 5.208 30 20 GKED COc1ccccc1/C(C)=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 727628668 VXAGNNUXGCRIMA-APEZIOSESA-N 388.492 5.407 30 20 GKED C=CCN(C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C(C)C 730138598 GQVNRQULURNQNO-CQSZACIVSA-N 377.941 5.439 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 733633919 LEHFEWCOFLRIQO-AWEZNQCLSA-N 398.488 5.293 30 20 GKED CCOc1cc(/C=C2\CCOc3ccc(Cl)cc3C2=O)cc(Cl)c1O 733749467 XJYDARLJGOOZNL-KPKJPENVSA-N 379.239 5.147 30 20 GKED O=C(/C=C/c1ccc(O)c(Br)c1)c1ccc(SC(F)F)cc1 734981794 UBZLBUGKKSKCNW-LREOWRDNSA-N 385.229 5.366 30 20 GKED COc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc(Cl)c1OC 740014869 XEBRNZQILHUXJE-UHFFFAOYSA-N 398.915 5.247 30 20 GKED CN1CCC[C@H](C/N=C/c2cc(Cl)cc(Cl)c2O)[C@H]1c1cccs1 741464992 RWXGLYJGGYQAAO-RONGGUFTSA-N 383.344 5.263 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1ccc(Oc2cnccn2)cc1 743056353 DYCLSEHRGJOBJR-JXMROGBWSA-N 379.485 5.227 30 20 GKED N#Cc1ccsc1C(=O)NCCCN1c2ccccc2Sc2ccccc21 748053241 WKALPHQGTZGXTF-UHFFFAOYSA-N 391.521 5.043 30 20 GKED C[C@H](Cc1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 754531797 MMLYWFVCPOPFGJ-PBHICJAKSA-N 380.900 5.519 30 20 GKED N#CCOc1cc(F)ccc1NC(=S)Nc1ccccc1-c1ccccc1 760283057 RQXKADZJAGISFA-UHFFFAOYSA-N 377.444 5.204 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccn(C4CCCC4)n3)cc2F)c1 763242994 AOCMESVBQLQODQ-UHFFFAOYSA-N 390.462 5.200 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(c1ccc(CNC(=O)OC(C)(C)C)cc1C)C1CC1 767093930 RTOMTQSZOHRQDM-QGZVFWFLSA-N 386.536 5.117 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 767700399 RLYGKCNGIWLOMP-INIZCTEOSA-N 386.517 5.090 30 20 GKED N#CCCn1cc(CN2CCC[C@H]2c2ccc(F)c(F)c2)c(-c2ccccc2)n1 769428788 UBYUYXVSPGPHCF-QFIPXVFZSA-N 392.453 5.079 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2cccnc2)c2cc3ccccc3o2)c1 779411735 HIXQYOQEZSKVSU-SQJMNOBHSA-N 397.478 5.388 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1 780532481 MFGWNAPTDUXMLK-HNNXBMFYSA-N 398.894 5.265 30 20 GKED N#CC1(COC(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)CCCC1 780540582 HDYRZQVJUVMTJF-UHFFFAOYSA-N 380.391 5.070 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCCCC(C)(C)C#N 784646119 KAHXNMJIQCLZMN-UHFFFAOYSA-N 380.366 5.156 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792092488 BZFYEKZCOHXIFJ-AUUYWEPGSA-N 382.385 5.309 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)[C@H](OC2CCCC2)c2ccccc2)s1 797568686 LINZISAGMFJTAP-FXAWDEMLSA-N 382.529 5.317 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCC(F)(F)C2)cc1 800519273 NCJHOUOEHYNOEF-OXQOHEQNSA-N 383.442 5.289 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 802250009 KUCPJAFFNHOGJX-PBHICJAKSA-N 382.529 5.259 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)CCCCC3=O)cc1 810115030 QJSLIKWDTDIAHW-XMMPIXPASA-N 394.474 5.503 30 20 GKED Cc1cc(C(C)(C)C(=O)[C@@H](C#N)c2nc3ccccc3o2)ccc1Br 810534850 BZHDMWZBZDWOCR-CQSZACIVSA-N 397.272 5.053 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] 813219668 BXNXFVGZZPBXSP-UHFFFAOYSA-N 393.270 6.006 30 20 GKED CC(C)c1csc(SCC(=O)Nc2ccccc2SC[C@@H](C)C#N)n1 845329933 HCRATLREQPOVAU-ZDUSSCGKSA-N 391.587 5.249 30 20 GKED N#CC1(CCCC[S@](=O)Cc2nc(-c3c(F)cccc3F)cs2)CCC1 899406122 JFUVBQCWOWOFNN-SANMLTNESA-N 394.512 5.201 30 20 GKED CC(C)c1cnc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 901869028 ODPZOTPOAVUHSG-AWEZNQCLSA-N 389.546 5.064 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSCc2ccc(F)cc2)cc1 915088427 QNYSWPQFZBFXDF-QFIPXVFZSA-N 390.483 5.353 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)/C=C/c3ccccc3F)c2)cc1 916449789 MYNXURNRJCGRKV-JLHYYAGUSA-N 386.426 5.123 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)SCc3ccccc3)n2)cc1 916974371 JHXOHJUTBXSLRT-QFBILLFUSA-N 392.549 5.617 30 20 GKED COc1ccc(Nc2nc(Cl)c(C=NNc3ncccc3Cl)s2)cc1 917546398 LLAGTHXCKZWWFV-UHFFFAOYSA-N 394.287 5.043 30 20 GKED Cc1c(NN=C2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cccc1C(=O)O 1776087427 BGMXDGVGOUWDNI-CQSZACIVSA-N 377.271 5.736 30 20 GKED O=C(O)[C@H](Oc1cccc(C=NNc2ccc(F)cc2Cl)c1)c1ccccc1 1776106328 AEKSESRPASZEJQ-HXUWFJFHSA-N 398.821 5.130 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)cc1 1776339904 PQINVQLOEZJWJO-VMPITWQZSA-N 387.273 5.242 30 20 GKED CC(C)c1cccc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)c1 1776375329 GKOHDGXJGVUPJI-DHZHZOJOSA-N 390.435 5.576 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3cc(C(=O)O)ccc3Br)coc12 1777449052 IRCTUZWKLODECK-VURMDHGXSA-N 385.213 5.098 30 20 GKED O=C(O)c1ccc(Br)c(/C=C2\CCc3c(Cl)cccc3C2=O)c1 1777672992 ZMXIDYGOKVZDBC-CSKARUKUSA-N 391.648 5.013 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1ccccc1)[n+]1ccccc1CC 10174266 XXNAAYWFNSICNZ-UHFFFAOYSA-O 389.544 5.150 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)cc1 29150911 FIYLRMPYBJWQFQ-UHFFFAOYSA-N 395.915 5.446 30 20 GKED COc1ccccc1-c1nc(CSc2nc3c(c(C)c2C#N)CCC3)cs1 60716001 DRXDMTPLMSLFKU-UHFFFAOYSA-N 393.537 5.175 30 20 GKED COc1ccc2c(CC(=O)Nc3ccccc3S[C@H](C)CC#N)coc2c1 66801563 MTBQBYFBCAAEEG-CQSZACIVSA-N 380.469 5.017 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 105042030 RNUCFRWXKCAENZ-UHFFFAOYSA-N 387.505 5.315 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1 113128265 VIWHUDLQTNJKAM-UHFFFAOYSA-N 395.418 5.182 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)s1)c1nc2cc(Cl)ccc2s1 120009411 ANSVMUDUMXVJRY-MRVPVSSYSA-N 397.706 5.264 30 20 GKED N#C[C@@H](C(=O)[C@H]1SCCc2ccccc21)c1nc2cc(Cl)ccc2s1 174002482 AQDKPRWKOUBMDP-KSSFIOAISA-N 384.913 5.157 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccccc1OC 177197512 RKLRTBXXTPLIQF-CQSZACIVSA-N 398.532 5.279 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1S[C@@H](C)CC#N 178392101 ZXCRAPLOLBGGMJ-INIZCTEOSA-N 397.569 5.410 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cncc(F)c2)cc1Cl 180781728 KFCBUHRRHXVQGE-FQEVSTJZSA-N 393.849 5.101 30 20 GKED N#CC1(c2ccc(C(=O)N3CCSc4ccc(C(F)(F)F)cc43)cc2)CC1 181804063 PYWBPPQUECTYMI-UHFFFAOYSA-N 388.414 5.013 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3O[C@H](C)C#N)c2cc1C(C)C 182098301 HKZQMEGJSBOLNF-MRXNPFEDSA-N 376.456 5.337 30 20 GKED N#C[C@H](NC(=O)c1scnc1C1CCCC1)c1ccc(Cl)c(Cl)c1 185280926 CMWCGZJWOOGNQK-AWEZNQCLSA-N 380.300 5.102 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](c2ccc(F)cc2)C[C@H]1C 247084362 ZPLMVHKFKAHUAZ-JFIYKMOQSA-N 397.519 5.487 30 20 GKED Cc1c(C)c(C)c(S(=O)(=O)Nc2ccccc2SCCC#N)c(C)c1C 303307416 PZQXWYAHWLQWQQ-UHFFFAOYSA-N 388.558 5.035 30 20 GKED Cc1cc([C@H](/N=C(/O)c2sc([C@H]3CCCOC3)nc2C)C2CC2)ccc1F 328971314 VAUHBFPYKOJZSS-FUHWJXTLSA-N 388.508 5.249 30 20 GKED COc1cc(C2(/C(O)=N/[C@@H]3CCCc4cn(C5CCCC5)nc43)CC2)ccc1C 329472362 AGNMLPHIDWMBAM-HXUWFJFHSA-N 393.531 5.381 30 20 GKED C[C@@H](/N=C(/O)N1CCC(OCC2CCCC2)CC1)c1cc2cccc(F)c2o1 329918511 GBIHZLHRBPKNIS-OAHLLOKOSA-N 388.483 5.218 30 20 GKED N#CC1(CCCN2Cc3cc(Cl)ccc3C[C@@H]2c2ccccc2)CCOCC1 410407805 MHOAFKNHEYPBGU-HSZRJFAPSA-N 394.946 5.540 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)oc12 425401886 QVMQJRXLKBWICQ-HZPDHXFCSA-N 391.471 5.167 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1SCCc2ccccc21 428877757 AATSWTLADICSPO-QRWLVFNGSA-N 397.569 5.090 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 429684484 KPORDMSCZPXKST-CYBMUJFWSA-N 376.815 5.551 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 433010769 LTWZUYWSXPUQLF-GOSISDBHSA-N 389.421 5.738 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(Br)cc1Cl 436111380 YQDJOVAHWHHTIY-FQEVSTJZSA-N 376.747 5.071 30 20 GKED CCN(CC)c1ccc(-c2nnc(SCCCCC(C)(C)C#N)n2C)cc1 436123718 LAGGTVZNWPLJKI-UHFFFAOYSA-N 385.581 5.140 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1OC1CCCC1 437765379 QYQADDHRWSWNDO-UNMCSNQZSA-N 389.499 5.312 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 438860257 RYHOGMBLGLVZBD-DYVFJYSZSA-N 376.287 5.399 30 20 GKED CCCc1c(NC(=O)c2cccc(-c3ccoc3)c2)cnn1-c1cccc(C#N)c1 440088323 NLJDKTPTCBBWFV-UHFFFAOYSA-N 396.450 5.209 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)cc1 442287155 VLDOJZNZBRQXIY-UHFFFAOYSA-N 398.293 6.042 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]3CCC[C@@H]32)cc1F 444392774 CJUCPRAJSKJATA-BEFAXECRSA-N 379.435 5.286 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)c(Cl)c1 452643365 JGEAXIDQGLFVTF-ZIAGYGMSSA-N 394.780 5.047 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc([C@H]2CCOC2)cc1 455669883 VURBLLLVRCUZFZ-HNNXBMFYSA-N 376.909 5.126 30 20 GKED C[C@@H](C(=O)Nc1ccnc(Oc2ccccc2Cl)c1)c1cccc(C#N)c1 463868297 WKVYYYBTFOZKJT-CQSZACIVSA-N 377.831 5.141 30 20 GKED COc1cccc(-c2nc(CN3CCC[C@@H]3[C@@H](C#N)c3ccccc3)cs2)c1 464823350 QCFJOCHETHSRSS-FCHUYYIVSA-N 389.524 5.090 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)Nc1ccc(C#N)nc1 466820301 ZKMKHIXNIHAFPP-LLVKDONJSA-N 399.317 5.321 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 470003636 MJZYBMRBVNTKBX-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 470486861 MFJCOEXVJYXVRW-SFHVURJKSA-N 389.474 5.347 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)cc2o1 470849183 XUUFNASJDGTNFP-UHFFFAOYSA-N 383.407 5.361 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 472130424 NTJACMMMDYWVNI-DEOSSOPVSA-N 385.511 5.267 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cccs1)Cc1cccs1)c1ccccc1 474791116 HSRXGVYRWVHSEZ-GOSISDBHSA-N 380.538 5.426 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C(=O)OCC)cc1 475573405 SJGHLMIIXWXZPW-UHFFFAOYSA-N 380.488 5.037 30 20 GKED CC[C@@H](C)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C 480922376 TXZSSDXXMYUMHL-RHSMWYFYSA-N 378.501 5.085 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2oc(C)c(C)c2c1 481428183 SQCCJCXCAWPRPJ-UHFFFAOYSA-N 380.492 5.437 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)cc1Cl 483514439 AUQLHMVLOQNMGE-KRWDZBQOSA-N 391.883 5.442 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(C#N)s2)cc1 487222676 LEZJHHIPAAUBFW-UHFFFAOYSA-N 384.844 5.326 30 20 GKED CCN(C(=O)CCCCCO[C@@H]1CCC[C@H](C)C1)[C@H](C)c1ccc(C#N)cc1 499288927 WWODUEHKOQVERY-MIZPHKNDSA-N 384.564 5.623 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 503225383 KIAMCESMGHBPSO-WZONZLPQSA-N 393.556 5.666 30 20 GKED CC(C)c1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508049468 GQMRMLTUKZDFJP-FQEVSTJZSA-N 381.545 5.296 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)c2ccc(C#N)cc2F)cc1 512617765 GQYOWZDOANVWMZ-GYCJOSAFSA-N 392.449 5.480 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)oc2c1ccc1ccccc12 513164541 IMRUBJLXAWYFQD-KRWDZBQOSA-N 394.352 5.798 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 513653863 GCWKLPUNKZDFSC-UHFFFAOYSA-N 379.391 5.162 30 20 GKED CC(C)(C#N)CCCS(=O)(=O)[C@H](c1ccccc1)c1ccc(Cl)cc1 514681464 XFHMDQZDTYPSHL-LJQANCHMSA-N 375.921 5.174 30 20 GKED CC(C)(C)c1ccc2cc(C(=O)Nc3cccc(OCCCC#N)c3)[nH]c2c1 517100008 GEOHMHFZAFASNO-UHFFFAOYSA-N 375.472 5.400 30 20 GKED Cc1nc(NC(=O)C2(c3ccc(F)cc3)CCCCC2)sc1SCC#N 517904802 WQXMHNXBZVNUEC-UHFFFAOYSA-N 389.521 5.047 30 20 GKED CC(C)[C@@H](CC(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 518392134 BMTSNCBXGJOTGV-XPPIMPSXSA-N 390.527 5.194 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)NCc1cccc(OCCCC#N)c1 520236614 KJPXEBROULIACN-MRXNPFEDSA-N 376.422 5.109 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccccc1C(F)(F)F 520814678 IIYJGLQEMNPOKF-ZDUSSCGKSA-N 394.418 5.117 30 20 GKED CSc1ccc(N(C)C(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1 522303036 IOXDKUKSCGDXRB-UHFFFAOYSA-N 388.492 5.136 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1sc2c(c1C#N)CCCCC2 523865099 OQSDXAPPRURAFQ-UHFFFAOYSA-N 393.537 5.573 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC[C@H]2c2cccc(Cl)c2)c1 524436736 ICQHLJWDMBZGRQ-INIZCTEOSA-N 391.805 5.182 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccn2[C@H](C)Cc2ccccc2)n1 536928001 CPAHKEMMIVBEHA-AEFFLSMTSA-N 377.513 5.362 30 20 GKED C=CCC[C@H](N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21)c1ccccc1 539396659 MCZUDVCFVVYIMF-GOTSBHOMSA-N 376.544 5.272 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(C)s2)nnc1-c1ccc(C(C)(C)C)cc1 542338536 AVVGGPRCPRAAQA-ZDUSSCGKSA-N 399.589 5.442 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 545516162 RFOKZFSISVAZTG-CQSZACIVSA-N 377.366 5.203 30 20 GKED CC(C)N(Cc1ccc(NCc2cc(C#N)cs2)cc1)C[C@@H]1CCCCO1 546256598 PUZLBDHTDJDWDI-NRFANRHFSA-N 383.561 5.011 30 20 GKED N#CCC[C@@H](C#N)CNCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 554552185 KLROIWPGHAJXGG-IBGZPJMESA-N 398.466 5.199 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1ccc(Sc2ccc(Cl)cc2)cc1 583269356 LOUNZQPWJDXUMN-LJQANCHMSA-N 390.961 5.256 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cn(C)nc1C1CCCCC1 588354750 OFCIMHDEYJXDRG-UHFFFAOYSA-N 377.941 5.011 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)NCc1sc(-c2ccccc2)nc1C 589790958 VSQWHRQKZTZFAV-UHFFFAOYSA-N 395.503 5.155 30 20 GKED N#CCCC[C@H](NCc1cc(Br)c(Cl)s1)c1ccccc1 590069294 PQRGJPMPFZCJTQ-HNNXBMFYSA-N 383.742 5.689 30 20 GKED N#C[C@H](NC(=O)C1CC(c2ccc(F)cc2)C1)c1ccc(Cl)c(Cl)c1 590235584 KQUNXHPUZOCBBF-JRSKDTKFSA-N 377.246 5.007 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 597074933 HEFYTTDCFMUQGT-QFBILLFUSA-N 387.405 5.318 30 20 GKED CCN(CCc1ccccc1)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297522 VQBHTDNTQVXLTP-UHFFFAOYSA-N 388.442 5.194 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609428566 UTMFDIFNRGMATR-HUUCEWRRSA-N 388.920 5.449 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609434964 HTYGQJIBRKJOPA-QZTJIDSGSA-N 381.545 5.923 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCC1 609436684 RXBCUKHQPKZSCR-OAHLLOKOSA-N 383.492 5.421 30 20 GKED CCc1ccc(N(C(=O)c2ccc(C#N)nc2)c2nc3ccccc3s2)cc1 609640803 WGEMUVJCGRDVIP-UHFFFAOYSA-N 384.464 5.104 30 20 GKED COc1ccc([C@H](NC(=O)Nc2cccc(C#N)c2)c2ccccc2Cl)cc1 610089818 TZYRTCQFUBRQIZ-NRFANRHFSA-N 391.858 5.131 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)c[nH]c12 610152986 GOQPBCZRCQXQIU-UHFFFAOYSA-N 381.435 5.322 30 20 GKED Cc1c(NC(=O)N[C@H](C)c2cccc(C#N)c2)cccc1C(=O)Nc1ccccc1 610323214 CRPFSQSOVGGCOX-QGZVFWFLSA-N 398.466 5.002 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)cc1 612313960 NKYMHJUGDKWMIA-JTSKRJEESA-N 379.529 5.697 30 20 GKED C[C@H](N[C@@H](C)c1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 616354014 MZVLRIZWMIYJRZ-RYUDHWBXSA-N 397.238 5.751 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CSc2ccc(Br)cc21 618807977 DLOMYRQDMSRTBK-QZTJIDSGSA-N 385.330 5.135 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3ccc(Cl)cc3)SC2=S)cc1Cl 726626241 BOZINFMRNXYBFN-VIZOYTHASA-N 391.304 5.271 30 20 GKED CCc1cccc(CC)c1NC(=O)CON=Cc1c(CC)oc2ccccc12 727491046 WMZHTWFDIDBMQS-UHFFFAOYSA-N 378.472 5.109 30 20 GKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1csc(C(=O)O)c1 730149363 WFCUSHQHFCNDTA-ALCCZGGFSA-N 381.434 5.212 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCc2ccccc2C1)c1nc2cc(Cl)ccc2s1 732595997 GQTQPAAHJRJOFZ-GUYCJALGSA-N 380.900 5.321 30 20 GKED CN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccc2ccccc2c1 734101287 FYWVZXMTJOKXCB-UHFFFAOYSA-N 392.458 5.567 30 20 GKED C[C@@H](SCC(=O)Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 735676476 YIRWPDDAYJSRMA-GFCCVEGCSA-N 378.469 5.306 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 739160111 QQKGYZYISFIKES-IIBYNOLFSA-N 399.519 5.614 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(COCC(F)(F)C(F)F)c2)cc1 747099525 XVWORSKHEXIPOQ-AWEZNQCLSA-N 396.384 5.007 30 20 GKED CC1(C)CCC(CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC1 752484354 SRUOLIQHUDMEEG-SFHVURJKSA-N 377.513 5.465 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(C3SCCS3)cc2)c(C#N)s1 756837055 BWOVHXSZDCOVJM-UHFFFAOYSA-N 388.583 5.648 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)cc3cccnc23)cc1 767251213 PQFNXNNHXJZNQT-QFIPXVFZSA-N 381.410 5.282 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cccc(-c3cccnc3)c2)S1 768466063 BBPFTRFSTCGPTH-DEDYPNTBSA-N 385.492 5.257 30 20 GKED N#Cc1cc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)ccc1F 770568194 BGOMVVRAWXHRTI-AQTBWJFISA-N 384.435 5.731 30 20 GKED CCOc1cccc(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 771465202 YSJGKWWSFKXRMI-DEOSSOPVSA-N 399.494 5.105 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)cc2Br)c1 772985238 UQBQQNZGGHYFAX-XJKSGUPXSA-N 391.284 5.120 30 20 GKED C=CC[C@H](C(=O)Nc1cnc(Cl)c(Br)c1C)c1ccccc1 777784746 OMZNIFNYNOVNCL-ZDUSSCGKSA-N 379.685 5.104 30 20 GKED C=CC[C@H](C(=O)O[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 778426593 GSEKCMXQEMJLRV-WMZOPIPTSA-N 385.891 5.187 30 20 GKED Cc1onc(CC(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)c1C#N 779500479 SPRBTYMFHTXRSE-UHFFFAOYSA-N 386.238 5.010 30 20 GKED CCCCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@H](CC)c1ccccc1 780676210 ZZPHXAWCMWTEIY-GHTZIAJQSA-N 379.504 5.763 30 20 GKED C[C@@H](NC(=O)c1ccc(Cl)nc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 782487999 PBLUOQRVCUZNTA-CYBMUJFWSA-N 396.277 5.418 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 785757185 HVSJXXWDAQQBLO-IBGZPJMESA-N 392.908 5.127 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1ccc(N2CCCCC2)c(F)c1 788351856 ZMPFKDLFDCIPAP-SREVYHEPSA-N 384.398 5.187 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1Cl 789156601 CNHKDKIDSIJNNK-BQYQJAHWSA-N 384.888 5.542 30 20 GKED N#CCOc1ccc(CC(=O)N[C@H]2CCCCC[C@H]2c2ccc(Cl)cc2)cc1 791234992 NHYBFALISNPAIR-VXKWHMMOSA-N 396.918 5.018 30 20 GKED C[C@@H](Nc1ccc(N2CCCCC2)c2ncccc12)c1ccc(OCC#N)cc1 794835193 ZMLNKTBYMUBSID-GOSISDBHSA-N 386.499 5.301 30 20 GKED CCOCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 799604255 XDALBWYUVVYPCC-CYBMUJFWSA-N 395.311 5.110 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C/c3ccc(N(C)c4ccccc4)nc3)cc12 806576857 IVQLNPMNFUOIJP-PKNBQFBNSA-N 388.496 5.002 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCCC(F)(F)C2)cc1 813761150 KRAYELZXTDXTNT-UWJYYQICSA-N 397.469 5.679 30 20 GKED N#CCCC[C@@H](NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)c1ccccc1 814305220 YDSINMHYPKYVER-OAQYLSRUSA-N 392.503 5.110 30 20 GKED Cc1ccnc2sc(C(=O)[C@@H](C#N)C(=O)c3cc4c(s3)CCCC4)c(C)c12 845833284 FGWHLHKXIHNAEB-AWEZNQCLSA-N 394.521 5.059 30 20 GKED C#Cc1cccc(NC(=S)NC(CCC(F)(F)F)CCC(F)(F)F)c1 849303202 ZIQPVMNPZBKIQT-UHFFFAOYSA-N 382.373 5.008 30 20 GKED C=CCc1cc(CNc2ccc(NC(=O)OC(C)(C)C)c(C)c2)cc(OC)c1O 850415967 AJSHYIKJKILLPI-UHFFFAOYSA-N 398.503 5.397 30 20 GKED N#C[C@H](C(=O)C[C@]12CCCC[C@@H]1C2(F)F)c1nc2cc(Cl)ccc2s1 850771588 SVQBMPPRSRHZBH-XQAQDONZSA-N 380.847 5.342 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)[nH]c2C2CC2)cc1 858457515 QXCDQQWUPYHHJV-JOCHJYFZSA-N 381.479 5.677 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 860844271 HRPJMBJGQODIOE-GJZGRUSLSA-N 389.318 5.153 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(Cl)c(Cl)c1Cl 915982446 CKKDFLQHZZNQQT-DAXSKMNVSA-N 395.698 6.061 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 916997038 RNCURXLOCMHTQU-XYYIANASSA-N 377.296 5.649 30 20 GKED N#C[C@@H](C(=O)CN1CCCCC[C@H]1c1ccccc1)c1nc2ccccc2s1 917155557 YZDPFOFLVLZJCA-ICSRJNTNSA-N 389.524 5.090 30 20 GKED N#C[C@H](C(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1nc2ccccc2o1 917509802 AEJIANBCPQLXKN-TXQCQQFXSA-N 388.423 5.445 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2sccc2s1 918486995 IADUWZZNRUAVJC-AWEZNQCLSA-N 382.510 5.049 30 20 GKED CC(CCCCCCC(=O)O)=NNc1c(Cl)cccc1Br 1776083743 XIEYMLSRZOWUQN-UHFFFAOYSA-N 375.694 5.316 30 20 GKED Cc1cc(Cl)ccc1NN=Cc1ccc(OCc2cc(C)c(C(=O)O)o2)cc1 1776104559 MZCVJEWGDJUNLT-UHFFFAOYSA-N 398.846 5.273 30 20 GKED Cc1cccc(NN=Cc2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c1Cl 1776106733 RVZIJUORJHDEMW-NRFANRHFSA-N 394.858 5.299 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C(=O)O)c1ccc(Cl)cc1Cl 1776180267 NVVTUNNGQNVCFR-OAHLLOKOSA-N 390.719 5.522 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2cc(C(=O)O)cs2)cc1)c1ccccc1 1776469462 YLSZMIMXIUWMPD-RUMSDORHSA-N 378.449 5.482 30 20 GKED C[C@@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2c(O)ccc(F)c21 1776586860 ZDPOYEFVTHTHSA-HGLKBHAMSA-N 394.423 5.341 30 20 GKED CCCCCCCSc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1 1776787559 WRRDCZHWNBMCIY-OAQYLSRUSA-N 399.556 5.175 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776801128 DXUFFUUHOQXCCH-WYMLVPIESA-N 390.435 5.720 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1OCC 1776801245 FMYNNLNAYIZJNG-DHZHZOJOSA-N 382.456 5.167 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(C(=O)O)cc3Cl)s2)cc1 1777430629 VDCXWAZULAQBFB-KTKRTIGZSA-N 397.883 5.675 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc4c(ccc5ccccc54)o3)c2c1 1777685667 STKQPOXIRAFVBG-VMPITWQZSA-N 398.439 6.395 30 20 GKED C[C@@H](Sc1cccc(C(F)(F)F)c1)C(=O)Nc1sc2c(c1C#N)CCC2 21957957 OIZOWCIHBNXRFX-SNVBAGLBSA-N 396.459 5.247 30 20 GKED C[C@@H](NC(=O)c1oc2ccccc2c1COc1ccccc1)c1ccc(C#N)cc1 26121519 BBKHZCJSZCPJOB-QGZVFWFLSA-N 396.446 5.374 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1 46670283 YHUOUYRGRAIIOL-INIZCTEOSA-N 388.533 5.003 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2cc3ccccc3[nH]2)cc1 58642387 OKAUPKLJVRAJSH-UHFFFAOYSA-N 382.423 5.154 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1csc(-c2cccc(Cl)c2)n1 63251253 CIDOMYOOIHCYTA-UHFFFAOYSA-N 393.899 5.164 30 20 GKED Cc1ncsc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 105004428 WGQVDMCCXZGLPK-KRWDZBQOSA-N 396.903 5.082 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)/C=C/c2ccsc2)cc1 108737119 KBYQCXNICJZCCR-CMDGGOBGSA-N 376.456 5.001 30 20 GKED C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)c1ccc(C#N)cc1 118172576 GGIUQCRFKQNQFP-MRXNPFEDSA-N 386.480 5.311 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC(F)F)c1nc2cc(Cl)ccc2s1 120013418 MYVHOYXXCZBWDJ-LLVKDONJSA-N 378.787 5.041 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2SCCC#N)nn1-c1ccccc1 127667996 PRHJMLRYNSIWNC-UHFFFAOYSA-N 390.512 5.254 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)c(C)c(C)c2C)=C(/S)N[C@H](C)CC)cc1 154488605 LEKCPJNMEDQPHX-MRXNPFEDSA-O 397.608 5.097 30 20 GKED CC(=O)Nc1cccc(NCc2cccc(OCc3ccccc3C#N)c2)c1C 155397253 FIESYAKFYHSZLK-UHFFFAOYSA-N 385.467 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(OCCOC)cc1C 191440609 RDRJJXMPVRYENX-UHFFFAOYSA-N 382.504 5.516 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccc(F)cc2)C1 191468838 HWOALCKQCKAFGV-NRFANRHFSA-N 382.479 5.283 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)CCCOc1ccc(C#N)cc1OC 191560931 XRZZFQVNSZRMTQ-UHFFFAOYSA-N 394.515 5.440 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 195562651 ZMIIHMNGOZUZSI-CQSZACIVSA-N 394.824 5.113 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)c1 303205447 PTYJTYCSJDOISF-UHFFFAOYSA-N 396.487 5.170 30 20 GKED CSc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 303425249 BSKVGVTYKGTEFF-INIZCTEOSA-N 382.872 5.563 30 20 GKED C=CC[C@@H](CC)NC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 410118621 AXSPQZZUTARPQS-XJKSGUPXSA-N 378.925 5.088 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)NCc1ccc(-c2ccccc2C#N)cc1 426080715 RQLHPSRZFWYPLU-OAHLLOKOSA-N 389.421 5.146 30 20 GKED N#CCCC[C@H](NC(=O)NCc1csc(-c2ccccc2)n1)c1ccccc1 431283818 ROROLIHFMGBCOB-FQEVSTJZSA-N 390.512 5.044 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1 435095415 QNAASMOQSNORCU-XLIONFOSSA-N 375.472 5.409 30 20 GKED CC[C@@H](c1ccccc1)[C@H]1CCCN1Cc1cn(CCC#N)nc1-c1ccncc1 435122611 BKQXVHBLYKPEHQ-BJKOFHAPSA-N 399.542 5.017 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1C(=O)Nc1ccc(CC#N)cc1 435666836 CODILDDWWQQQBO-CLOONOSVSA-N 395.506 5.363 30 20 GKED Cc1c(C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)cccc1-c1ccccn1 441525107 PXCHCICWEVRAIU-UHFFFAOYSA-N 397.356 5.080 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CCCC1(C)C 444837036 NQOQUJWUOPPVTP-LJQANCHMSA-N 397.544 5.599 30 20 GKED CSc1c(F)cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1F 455129309 WBDSPTVCJUQZJP-QGZVFWFLSA-N 375.444 5.243 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC=C(c2ccccc2Cl)CC1)c1ccccc1 458794289 AXGJQBZQTAPWJL-JOCHJYFZSA-N 393.918 5.574 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 458806397 WDNAZERVNWHGDE-FPOVZHCZSA-N 381.907 5.274 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C)c1ccccc1 467105798 XPGSLVKPCVHUHX-QFIPXVFZSA-N 390.527 5.166 30 20 GKED O=C(Nc1ccc(OCC(F)F)c(C(F)(F)F)c1)c1c(F)cc(F)cc1F 470210809 DGFYLFQXJFHARR-UHFFFAOYSA-N 399.237 5.019 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c(C)c1 471282351 LQQUACVQQMRYBP-PKOBYXMFSA-N 393.556 5.577 30 20 GKED N#CC[C@@H](CC(=O)NC1(c2cccc(Br)c2)CCC1)c1ccccc1 475185330 HYJLZVPPXQMHCJ-KRWDZBQOSA-N 397.316 5.032 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)cc1 476735233 YMEAARXRTQRPAE-UHFFFAOYSA-N 380.438 5.086 30 20 GKED Cc1oc2ccc(NC(=O)c3occc3COc3cccc(C#N)c3)cc2c1C 477929077 QMSCIEAWNNOIQW-UHFFFAOYSA-N 386.407 5.346 30 20 GKED CCc1nc([C@@H](C)NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cs1 479625206 HYTPLMFAAOUWKF-CQSZACIVSA-N 393.537 5.219 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C 484605972 NAIIKEAPISBWPN-RISCZKNCSA-N 395.343 5.073 30 20 GKED N#Cc1cccc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)c1 486426390 UYWOFCCOMLZMCQ-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@@H](c2ccc(F)cc2)CC1)c1ccccc1 487936554 SBEBKAWHRYQTAZ-GCJKJVERSA-N 379.479 5.150 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1C 493877630 BKUZTQWKALFKEL-IBGZPJMESA-N 381.520 5.229 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 497176990 CGEHPUIVKLBPLN-UHFFFAOYSA-N 378.369 5.133 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1c(Cl)cccc1Cl 499845118 MCFBALSGBKXMHX-ZENOOKHLSA-N 379.674 5.131 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4ccccc34)c2)cc1 501446010 GHLWBDMQJMNJIK-UHFFFAOYSA-N 392.458 5.737 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(-c3cccs3)c2)c1 502494824 BNFOWFLDMBXEFQ-UHFFFAOYSA-N 377.469 5.742 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 503974017 TYIPQFKECPJTGQ-SFTDATJTSA-N 397.305 5.284 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCO[C@H](c2ccc(F)cc2Cl)C1 505010071 BDWKZDWEJDLWQA-FQEVSTJZSA-N 388.870 5.203 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1 507581570 TVTSBBGEYCTKPV-XZZNXKJUSA-N 378.491 5.040 30 20 GKED Cc1cc(=NC(=O)Nc2ccccc2S[C@H](C)CC#N)[nH]n1C1CCCCC1 515493365 UOEWXBNUCLKMHJ-MRXNPFEDSA-N 397.548 5.157 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 517473774 UCLTVGHXWOHGGI-GOSISDBHSA-N 379.529 5.201 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 517789916 LKECKLQEDOAQNS-AZUAARDMSA-N 392.396 5.068 30 20 GKED CCn1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc2ccccc21 518175209 UUIBDCAZJVPDPZ-CQSZACIVSA-N 379.872 5.414 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 519156534 RBZMTMBHBKEMDE-GOSISDBHSA-N 379.504 5.014 30 20 GKED CC(C)c1nc2cc(NC(=O)CCCCOc3cccc(C#N)c3)ccc2o1 520336682 OMUHNEWWUYNVQS-UHFFFAOYSA-N 377.444 5.011 30 20 GKED COC(=O)c1sc2ccccc2c1CNc1ccccc1S[C@@H](C)CC#N 520943464 CAGLYDHLENWDJG-AWEZNQCLSA-N 396.537 5.694 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@H](c2ccccc2)N2CCc3ccccc32)cc1 521234801 PWSUYPMJJYJHSF-DEOSSOPVSA-N 395.506 5.230 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1SCCC#N 524674066 YMGJYBKXKNMALL-UHFFFAOYSA-N 379.510 5.377 30 20 GKED N#C[C@@H](C(=O)c1ncsc1-c1ccccc1)c1nc2ccccc2n1C(F)F 527100761 JZVOTAXUCYQXJB-ZDUSSCGKSA-N 394.406 5.045 30 20 GKED N#Cc1ccc(C2(NCc3ccc(-c4ccc(Cl)cc4)o3)CCOCC2)cc1 527813509 WWLCRKGLSOVISZ-UHFFFAOYSA-N 392.886 5.267 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1c1ccc(Br)cc1 531207586 WEEXXCDGMBNQIW-CQSZACIVSA-N 396.210 5.076 30 20 GKED C[C@H]1CCN(C(=O)c2ccc(CC#N)cc2)c2cc(C(F)(F)F)ccc2S1 535449593 FGFIAKVGWBLTIW-ZDUSSCGKSA-N 390.430 5.303 30 20 GKED N#Cc1ccc(CNCc2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)o1 537253687 LVOKZUGSVKYUSM-UHFFFAOYSA-N 397.434 5.421 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2nc(Cc3ccccc3)cs2)c1 541466514 ILKZPHUZLORZOZ-UHFFFAOYSA-N 392.484 5.060 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1Cl 548279158 BIFLUGNISQXSSP-UHFFFAOYSA-N 378.781 5.035 30 20 GKED N#CCCC[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 552082955 LBMUNMFVKFZSKY-FQEVSTJZSA-N 392.484 5.243 30 20 GKED N#Cc1cc(C(=O)Nc2ccc3oc4ccccc4c3c2)cnc1C(F)(F)F 558888571 BUCGFWMZXVOZLN-UHFFFAOYSA-N 381.313 5.124 30 20 GKED C=CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 561015302 NBQXHQFIMRSQFG-CZIZESTLSA-N 393.490 5.263 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCCC1(C)C 562098272 WOLYNQWZCUQKHM-OAQYLSRUSA-N 390.487 5.344 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CC1(C(F)(F)F)CC1 564066436 IDSDWLWZXGMZFF-UHFFFAOYSA-N 390.380 5.272 30 20 GKED CSC[C@@](C)(C#N)NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 565564465 VDXHQXPUTFUMIY-GOSISDBHSA-N 395.311 5.161 30 20 GKED C[C@H](NC(=O)NCC1(C#N)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 583120744 ZGPFUKIRRIYDMF-LBPRGKRZSA-N 393.434 5.098 30 20 GKED CC(C)c1ccc(N(C(=O)CC2(C#N)CC2)c2nc3ccccc3s2)cc1 590973994 SFGJLVBMEFUHQL-UHFFFAOYSA-N 375.497 5.778 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC4(CC3)CC4(F)F)cc2)c1 593157669 MTBAKWWUEJPEKG-UHFFFAOYSA-N 383.398 5.004 30 20 GKED COc1cc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(C2CC2)cc1Cl 594205111 UQJFZOLDQQIJBN-ZDUSSCGKSA-N 383.879 5.323 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1cc2ccccc2n1CC#N)C1CC1 609166990 RVCDGXNGQKXUMF-SFHVURJKSA-N 393.490 5.684 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 609376719 IDXWACBGNWCTKQ-HNNXBMFYSA-N 391.496 5.083 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1c(Cl)cccc1Cl 609580246 PLGULMHESLQUPO-CHWSQXEVSA-N 393.339 6.130 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(N2CCCCCC2)c1 610144053 RLZBWECZIMZOIY-UHFFFAOYSA-N 390.531 5.381 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N[C@H]2CCc3cc(C#N)ccc32)c1 618754376 ZRGNMVNSOWGFCJ-QFIPXVFZSA-N 383.451 5.043 30 20 GKED Cn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccc(Cl)cc1 619863449 LFODFHAUMKZTTN-HNNXBMFYSA-N 375.284 5.146 30 20 GKED CCCCc1noc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 647634152 PGIGJTLTPOELNH-UHFFFAOYSA-N 399.310 5.314 30 20 GKED C=CCC[C@H](NC(=O)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1)c1ccccc1 676422921 GKTWAYOYFUHZOH-ZNMIVQPWSA-N 394.359 5.076 30 20 GKED N#Cc1ccc(NC(=S)NN(Cc2ccccc2)c2ccccc2)cc1Cl 726435872 YEIIIGHCGFYOBQ-UHFFFAOYSA-N 392.915 5.120 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CCc2nc(-c3ccc(F)cc3)sc21 727685508 PPHHCMXMDGGSLW-UVTDQMKNSA-N 380.400 5.070 30 20 GKED Cc1ccc(Cl)c(NC(=S)N(Cc2ccc(C#N)cc2)C2CC2)c1Cl 728444758 KRWKCEJVLFNULN-UHFFFAOYSA-N 390.339 5.535 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1ccc(-c2ccccc2)cc1 731027866 AVNXBGTWBFJKHX-UHFFFAOYSA-N 387.508 5.410 30 20 GKED CCCCCN(Cc1ccc(Cl)cc1)C(=O)Cc1ccc(OCC#N)cc1 731961563 VODSRYBJEITXRM-UHFFFAOYSA-N 384.907 5.004 30 20 GKED Cc1nc(NC(=O)CCCCOc2cccc(C#N)c2)sc1-c1ccccc1 731969761 RXBPFTJFCSNOGV-UHFFFAOYSA-N 391.496 5.178 30 20 GKED CC(=NNc1ccc(Cl)nc1)c1sc(-c2ccc(Cl)cc2)nc1C 743450769 QAMWQQVIQAIUJY-UHFFFAOYSA-N 377.300 5.656 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc1OC(F)F 744866165 PUQCCEMSHBAKEP-RQOWECAXSA-N 379.211 5.561 30 20 GKED N#Cc1cc(NC(=O)c2sc3ccccc3c2Cl)c(Cl)c([N+](=O)[O-])c1 746480975 FVXONHAIVOCEMO-UHFFFAOYSA-N 392.223 5.240 30 20 GKED CCCC(=NNc1ccc(S(C)(=O)=O)cc1)c1ccc(Cl)c(Cl)c1 746679515 IZDYAYOWHMVENE-UHFFFAOYSA-N 385.316 5.013 30 20 GKED CC(=NNc1ccc(Br)nc1)[C@H](C)c1nc2ccccc2s1 748789015 XGVPIMNIOMWYDG-JTQLQIEISA-N 375.295 5.045 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H]2c2cccc(F)c2)cc1 752185125 NECIGQUKIWCIEG-DHIUTWEWSA-N 385.442 5.460 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3ccccn3)CC2)cc1 754404911 DHMNNFPEMFSNCR-HSZRJFAPSA-N 396.494 5.149 30 20 GKED N#C[C@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1nc2ccccc2s1 759529914 DYUHIHCVDXTZFB-LLVKDONJSA-N 387.291 5.511 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(F)c(Cl)c2Cl)ccc1OC 762443044 NMUOXRBUBNPFPA-CQSZACIVSA-N 397.277 5.112 30 20 GKED O=C(CC/C=C/c1ccccc1)OCC(F)(F)C(F)(F)C(F)(F)C(F)F 764751934 IXIHJJJHORLWBT-XBXARRHUSA-N 390.270 5.194 30 20 GKED N#C[C@H](C(=O)[C@H]1CCc2c(Cl)cccc21)c1nc2cc(Cl)ccc2s1 776080792 JGDBJWYSYNUJOK-UONOGXRCSA-N 387.291 5.509 30 20 GKED CCC(CC)n1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 776301222 REFGJUXZJITTCD-QFIPXVFZSA-N 386.499 5.460 30 20 GKED O=C1/C(=C/c2ncc(-c3ccccc3)s2)CCc2ncc(C(F)(F)F)cc21 777466742 FOGABOMJTIQVBX-MDWZMJQESA-N 386.398 5.436 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1 780677786 IXQPGEQRHZBHSE-OAHLLOKOSA-N 399.441 5.232 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCC1(Sc2ccccc2)CCCC1 780682836 YOCVSATYYDKFAT-KRWDZBQOSA-N 395.528 5.204 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc([N+](=O)[O-])cc1Cl 782187549 CHXCEJKJBDHCHA-FLIBITNWSA-N 394.814 5.118 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792099734 IWQVCXLCGDJIOB-SWLSCSKDSA-N 385.250 5.185 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)Cc2csc(-c3cccs3)n2)s1 797571863 WHHOLBHYQPOQCN-GFCCVEGCSA-N 387.555 5.045 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2coc(C3CCCCC3)n2)cc1 802041960 JTJOYCBGYOCYRZ-HNAYVOBHSA-N 393.487 5.197 30 20 GKED Cc1cc([C@@H](NCc2ccc(OCC#N)cc2)c2cccc(Cl)c2)c(C)s1 810224268 GRANNMFSSZOVPA-QFIPXVFZSA-N 396.943 5.800 30 20 GKED N#C[C@H](C(=O)[C@H](Oc1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813213382 ITARJBVCRRWXGR-GHTZIAJQSA-N 396.368 5.097 30 20 GKED COc1cccc2cc(/C=C3\CC/C(=C/c4cccc([N+](=O)[O-])c4)C3=O)oc12 818240183 IMVWDQWSIRYTAU-RWIOWDNPSA-N 375.380 5.180 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)[C@H](F)c1ccc(C(F)(F)F)cc1 857453430 MECBZHXSMYEQNM-CQSZACIVSA-N 379.275 5.460 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1 915087761 XHLZZRUCWVNCOG-LJQANCHMSA-N 395.289 5.830 30 20 GKED Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(Cl)n1 916057115 LNUHLHPNPZLDFE-GOSISDBHSA-N 396.277 5.605 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3c(s2)CCCC3)cc1 916948496 WDOFVOBWFDGCHN-KBXCAEBGSA-N 380.513 5.102 30 20 GKED CCSCc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 917669064 MVKXGSMKOVJHMZ-HSZRJFAPSA-N 386.520 5.847 30 20 GKED C[C@@H]1/C(=C/c2ccc3oc(C(=O)O)cc3c2)C(=O)c2cccc(Br)c21 1776586941 DQMSMMSJNGLNDI-DOQDJBIESA-N 397.224 5.277 30 20 GKED CCCCCCCOc1ccc(CN[C@]2(C(=O)O)CCCC(C)(C)C2)cc1 1776786408 FPFHHBXJMWLCPW-HSZRJFAPSA-N 375.553 5.549 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3ccc(C(=O)O)s3)ccc21 1777002767 CVXIXYPSHAFCJW-NTMALXAHSA-N 375.449 5.470 30 20 GKED C[C@H](Sc1ccc(Cl)c(C(F)(F)F)c1)C(=O)Nc1ccccc1C#N 9790847 MYEMQTGXKVIQDB-JTQLQIEISA-N 384.810 5.350 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)oc2c(Cl)cccc12 41556383 PTNMGCACJHNLSS-LBPRGKRZSA-N 378.737 5.299 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)oc2ccc(F)cc12 41558312 SKTMVVNQYBXARQ-ZDUSSCGKSA-N 383.329 5.115 30 20 GKED Cc1nc(NC(=O)C[C@H](C)c2ccc(C(F)(F)F)cc2)sc1SCC#N 57388897 UZRQBFBTTOAFPY-JTQLQIEISA-N 399.463 5.218 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Cl)c(Cl)c3)n2)cc1 66545035 CFFPFYWSMOBRKL-AWEZNQCLSA-N 398.274 5.479 30 20 GKED Cc1cc(C(=O)CCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)s1 66856050 ZSRBTZZPKDVUMP-CYBMUJFWSA-N 386.542 5.361 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)nc2ccccc21 104932819 CYZCAVGMIFDLHW-HNNXBMFYSA-N 376.485 5.434 30 20 GKED COc1ccc(C[C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1OC 118443304 MRRLKXSPPYVUGK-WZONZLPQSA-N 386.495 5.210 30 20 GKED CC(C)=CCSc1ccccc1C(=O)Nc1nc(C)c(SCC#N)s1 125201877 BBPBPKYWSFFPFI-UHFFFAOYSA-N 389.571 5.378 30 20 GKED C=CCN(C(=O)[C@@H](C)c1ccsc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 151167520 XEQPYEVSADVLIJ-ZDUSSCGKSA-N 399.497 5.103 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1nc(C)cs1 173123988 LYTVSZDHEVGUGV-AUUYWEPGSA-N 388.562 5.293 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H](C)c2ccccc2C(F)(F)F)n1 177765237 DZXSWCGPDQERDR-JSGCOSHPSA-N 380.435 5.655 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccccc1C 182377227 DCEQMVUEJRVREO-OAHLLOKOSA-N 376.485 5.434 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H]2[C@@H](CCCN2C2CC2)C1 191433599 MHFXQRWZWMYLLJ-UGKGYDQZSA-N 381.564 5.019 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 192917402 UFOGBFCVXIQOCZ-INIZCTEOSA-N 392.549 5.273 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)c1cccc(C#N)c1 195671966 HJLZUZOOWKXTRO-UHFFFAOYSA-N 391.474 5.287 30 20 GKED N#CCN(C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)c1ccccc1 215739301 BSWQORNYWAGWEZ-UHFFFAOYSA-N 396.368 5.668 30 20 GKED CC(C)C(=O)Nc1cccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 236578926 WZDVMOMVSDGFND-UHFFFAOYSA-N 399.494 5.344 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 246596765 PZFNUJCOAWLCKC-HRCADAONSA-N 380.419 5.068 30 20 GKED CC(C)n1c(Sc2cccc(C#N)n2)nnc1-c1ccc(Cl)cc1Cl 301850037 OXMBAPRRNRCKIX-UHFFFAOYSA-N 390.299 5.251 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 302220948 IGAYIXMYQWSQIZ-JOCHJYFZSA-N 377.875 5.223 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)[C@H](C)c1ccc(C#N)cc1 303545992 ZHXJCYJDUAHUAP-FSPWUOQZSA-N 387.310 5.578 30 20 GKED C=C1CCN(C(=O)c2cc(-c3cc(C)sc3C)nc3c2cnn3C(C)C)CC1 329166472 IBMRZAKSKOVRCS-UHFFFAOYSA-N 394.544 5.150 30 20 GKED CN1CCC(O)=Nc2cc(/C(O)=N/[C@H]3CC=C(c4ccc(F)cc4)CC3)ccc21 329248567 SNYNCTNDFMYHBX-IBGZPJMESA-N 393.462 5.194 30 20 GKED Cc1nc2c(c(C(F)(F)F)n1)C[C@H](/C(O)=N/[C@H](c1cccs1)C1CC1)CC2 329810426 BKUXECWUJGXGOY-WBMJQRKESA-N 395.450 5.078 30 20 GKED CC[C@H](C(=O)Nc1ccc(CC#N)cc1Cl)c1cccc(C(F)(F)F)c1 411018151 RCHFUDQJQIGCSY-HNNXBMFYSA-N 380.797 5.557 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)c1 413332885 IUZMYFYMTKVCBM-ZVDOUQERSA-N 398.428 5.434 30 20 GKED C=C[C@H](CCC(=O)O)NCc1c(Cl)cccc1OCc1ccccc1Cl 417604573 CCGXAJXVGUDZGD-OAHLLOKOSA-N 394.298 5.081 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](CC(F)(F)F)C1 421064770 OAHYWMKECPSSLB-KBPBESRZSA-N 385.455 5.135 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCC[C@@H](c2ccccc2)C(F)(F)F)cc1 432699342 NAWQFWKACGMDKY-SFHVURJKSA-N 389.421 5.345 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 438624544 GQOWISBZIDGGAE-OAHLLOKOSA-N 379.407 5.316 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=O)N[C@H](CCC#N)c1ccccc1 438838187 SACIRHFXBZETTC-GOSISDBHSA-N 376.287 5.180 30 20 GKED COc1ccc2occ(C(=O)[C@@H](C#N)c3nc(-c4ccc(C)cc4)cs3)c2c1 442511267 HMSSPMSUXFJHAU-QGZVFWFLSA-N 388.448 5.363 30 20 GKED C=C(C)[C@@H](NC(=O)N(CC)Cc1c[nH]c2ccccc12)c1ccc(F)c(F)c1 443160629 FNHCQVHPRKVYNX-OAQYLSRUSA-N 383.442 5.295 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(COCCOCC)c2C)CCCC1(C)C 444921088 MIWLEZXUWYFUEN-OAQYLSRUSA-N 388.552 5.147 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccccc1 458854211 XDKFBEDDGDDDLH-HXUWFJFHSA-N 396.922 5.059 30 20 GKED C=CCc1cc(C(=O)N(c2ccccc2F)C2CCCC2)cc(OC)c1OC 461538495 CZVKXZYROMMNOA-UHFFFAOYSA-N 383.463 5.161 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 463475672 ZWGBAGJMYXRPDN-UHFFFAOYSA-N 382.335 5.212 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 464951200 RLXWCOVLIAPFAY-UXHICEINSA-N 387.508 5.031 30 20 GKED Cc1nc2c(s1)CCC[C@@H]2C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 469129099 WTYKMIUHFWBVOR-IBGZPJMESA-N 389.480 5.174 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cn(-c2ccccc2)nn1 471666455 GVHQOXIPDMUTBC-QGZVFWFLSA-N 381.439 5.104 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(COc3cccc(F)c3)c2)n1 474430748 YNZYUNVXNCOLEW-IBGZPJMESA-N 394.471 5.475 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1nnc2ccccn12)C(C)C 475584408 YRIINRWCHNWPKT-FQEVSTJZSA-N 391.519 5.100 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(-c3ccccc3)ns2)c1 475813195 RCVRAWMINPAUBA-UHFFFAOYSA-N 378.457 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](CC)Cc1ccc([N+](=O)[O-])cc1 476080902 QLBFWTWXONEDPD-SFHVURJKSA-N 380.488 5.654 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(-c2ccnn2C)c1 476089282 FVXGHUVTGFVKAU-UHFFFAOYSA-N 389.499 5.200 30 20 GKED CCN(CCc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 477794554 QGELDZBXEWQQKN-UHFFFAOYSA-N 391.496 5.509 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1C 482782012 OGPJVAJJMRWBMD-CQSZACIVSA-N 392.434 5.218 30 20 GKED C=CCn1c(SCCCC(=O)c2ccccc2)nnc1-c1ccccc1C 488912118 NKOGLNGBNIYHDA-UHFFFAOYSA-N 377.513 5.195 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@H](C)c1ccc(C(F)(F)F)cc1 495627084 VVMWIKPDAWKPDZ-HUUCEWRRSA-N 396.478 5.021 30 20 GKED COc1cc(F)ccc1NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 499352273 XKZJVYOHZVAZES-UHFFFAOYSA-N 381.247 5.124 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1OC(F)F 502644798 SYOPQACQICXFDS-QGZVFWFLSA-N 387.430 5.362 30 20 GKED N#CC1(c2ccc(C(=O)N3CC=C(c4ccc(Cl)c(Cl)c4)CC3)cc2)CC1 510877587 GHJCDCORTGZEQP-UHFFFAOYSA-N 397.305 5.478 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1nc2ccccc2[nH]1 513696282 VWTYNJWAODDYGL-NSHDSACASA-N 386.263 5.574 30 20 GKED CCc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1 513963436 QXMXQJUWVRJNHO-UHFFFAOYSA-N 387.458 5.494 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(Oc2cccnc2)cc1 514184535 VPPOJHPODZNFQO-LJQANCHMSA-N 387.483 5.333 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CC[C@@H]3CCCCO3)cc2Cl)cc1 517654484 UAAPLVSNOUKUGE-KRWDZBQOSA-N 384.863 5.292 30 20 GKED CCOc1ccc(Oc2cc(CNc3ccc(C#N)c(Cl)c3)ccn2)cc1 518375529 KTIQWJWTILDCRF-UHFFFAOYSA-N 379.847 5.410 30 20 GKED C=CC1CCN(C(=O)[C@@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)CC1 518438061 RELBGNGXFLKMJV-CQSZACIVSA-N 390.936 5.041 30 20 GKED COc1ccc(S[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 520824882 GFIUJFFRCMEAPA-LSDHHAIUSA-N 386.542 5.066 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCc1cccc2ccccc12 521261504 RRWUEZDYDRDWFT-QGZVFWFLSA-N 389.524 5.456 30 20 GKED C[C@H](NCc1csc(-c2cccc(Br)c2)n1)c1ccc(C#N)cc1 522197670 YGHOSUAMOZDCNC-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C[C@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccc(Cl)c1 525145326 GWWVNMMZDKCAMH-INIZCTEOSA-N 390.870 5.533 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(OC[C@@H]3CCCO3)c2)CC1 537734473 QOHRWAWNBKLIMK-GWHCDVRWSA-N 376.500 5.060 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(-c2nc3c(F)cccc3[nH]2)cc1 538399952 BEDCAVOFFUDOPY-UHFFFAOYSA-N 381.451 5.071 30 20 GKED Cc1nc(C(F)(F)F)ccc1-c1nc(-c2cc(F)ccc2C(F)(F)F)no1 546989540 XKSJENQVVNEQJU-UHFFFAOYSA-N 391.246 5.284 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ncccc1Cl 550845822 BCCYGDABTPAQKL-UHFFFAOYSA-N 385.798 5.012 30 20 GKED CC(C)CC(=O)Nc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1 558490799 IBCISVQOWAUQCD-UHFFFAOYSA-N 375.394 5.174 30 20 GKED C=CCN(CCC(=O)N[C@H](c1ccccc1)c1cccs1)Cc1cccs1 561198921 AUSUCQFPOFBKKY-JOCHJYFZSA-N 396.581 5.094 30 20 GKED CCC[C@H](C#N)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 564144659 PQQDWCUJDXOKHY-LLVKDONJSA-N 396.343 5.203 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(F)cc2)c2cccs2)c(C(F)(F)F)c1 575794219 TXNQTQQYJFIAIQ-LJQANCHMSA-N 390.405 5.657 30 20 GKED C[C@@H](NC(=O)N(C)CC(C)(C)C#N)c1ccc(O[C@H](C)c2ccccc2)cc1 596749444 JRKVQEWNUUOOCW-QZTJIDSGSA-N 379.504 5.079 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@H](C)C(F)(F)F 599432014 YCARZFJUNVAYKY-AWEZNQCLSA-N 378.369 5.128 30 20 GKED CC(C)c1ncncc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604026444 IJDMRYALSKRAJD-UHFFFAOYSA-N 392.846 5.170 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@H](C)C#N 609403130 VJWUQNBSPASTAY-QGZVFWFLSA-N 399.535 5.912 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 609462408 DATZZVFEDMKRNC-IAQYHMDHSA-N 398.837 5.220 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ncoc2-c2ccccc2)cc1 609558486 DLRZHKBWNMSENI-UHFFFAOYSA-N 381.391 5.258 30 20 GKED COc1cc([C@H](C)Nc2nc(C(F)(F)F)ccc2C#N)ccc1OCC(C)C 609669387 WWJXJASVZPTYNR-ZDUSSCGKSA-N 393.409 5.189 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 609744590 RZQDPUIATSDCRZ-QZTJIDSGSA-N 381.545 5.771 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCS[C@@H](c2ccccc2)C1 609811030 ILLLLEMZKLTPHJ-OXJNMPFZSA-N 397.569 5.260 30 20 GKED Cc1cccc(C)c1CSCC(=O)Nc1ccccc1SC[C@@H](C)C#N 610007471 BAYQHLAHHGDRTA-HNNXBMFYSA-N 384.570 5.427 30 20 GKED COc1cc(C#N)ccc1OCCSc1nc(C)c(C)n1C1CCCCC1 610117098 GPAULFNFKNIREG-UHFFFAOYSA-N 385.533 5.057 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)Cc2ccc(C#N)cc2)nc1-c1ccccc1 610294510 LZUJABASUCUKRB-NRFANRHFSA-N 399.494 5.243 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1cccc(C#N)c1 610362749 GZEBAEHTAPVPHU-KRWDZBQOSA-N 393.446 5.371 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1cccc(C#N)c1 610406922 MVYLISNVWHCUAY-OAHLLOKOSA-N 383.442 5.052 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)c1C 610569864 DKZMOZLVMRUPRR-QGZVFWFLSA-N 379.504 5.455 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N1CCC[C@](C)(C#N)C1 612305284 XPOLVJOXRMUEAD-JOCHJYFZSA-N 397.906 5.385 30 20 GKED N#C[C@@H](C(=O)c1ccnc(Oc2ccccc2)c1)c1nc(-c2ccccc2)cs1 623759107 DGRHNEUNNCAFBW-IBGZPJMESA-N 397.459 5.487 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)s1)c1nc2cc(C(F)(F)F)ccc2s1 642282291 ZREKRKOJFNETGW-QMMMGPOBSA-N 386.807 5.520 30 20 GKED CCc1oc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1C 675513343 YEAJPTRZJPLBGZ-LLVKDONJSA-N 378.375 5.269 30 20 GKED Cc1nc(-c2ccccc2)sc1COC(=O)c1ccccc1SCC#N 729202818 ZPKAXQUCPQHPGE-UHFFFAOYSA-N 380.494 5.091 30 20 GKED C=CCN(C(=O)C(=O)C(C)(C)C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 733913311 HVJXMUYFGWSHKL-UHFFFAOYSA-N 397.327 5.251 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3cccc(F)c3C)o2)cc(OC)c1OC 734303276 JJCRKTGFBDMCFE-CSKARUKUSA-N 396.414 5.316 30 20 GKED CC[C@@H](NC(=S)Nc1ccccc1S[C@@H](C)CC#N)c1cccs1 734379197 DYEIFGDQWRXXDE-UONOGXRCSA-N 375.588 5.580 30 20 GKED C=CC[C@H](NC(=O)Nc1cc2oc3ccccc3c2cc1OC)c1ccncc1 734516487 XMGKBTIVFORWPP-SFHVURJKSA-N 387.439 5.429 30 20 GKED C=CC[C@H](NC(=O)NC[C@@H](C)c1c(Cl)cccc1Cl)c1ccncc1 734666756 JTAVOIDFLQJLFC-DYVFJYSZSA-N 378.303 5.109 30 20 GKED C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)c1ccc(C#N)cc1 735617017 RVPQBUURVKNUFF-NSHDSACASA-N 389.958 6.042 30 20 GKED COc1cc(/C=C/C(=O)c2sc(C(C)(C)C)nc2C)c(SC)cc1OC 741165423 MKGLEPBZDHSMBF-CMDGGOBGSA-N 391.558 5.384 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccc(CC(F)(F)F)cc2)cc1OC 741594053 QRXCGJSCPBHZFZ-XFFZJAGNSA-N 391.389 5.017 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2/Oc3ccccc3C2=O)cs1 742435446 BDNJJUXJVGJMQK-VCHYOVAHSA-N 396.855 5.097 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)O1 744037203 PONCUSJPDRZPQU-ADWUFQBZSA-N 398.572 5.135 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=O)c1ccccc1SCC#N 745844238 PKEBLSXUKIJTFD-UHFFFAOYSA-N 376.884 5.147 30 20 GKED COc1cc(C(=O)/C=C\c2cc(Br)c(OC)s2)ccc1SC 746520195 LSYFDOVVWRDCNY-WAYWQWQTSA-N 399.331 5.146 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@H](C#N)c2nc(C(C)C)cs2)s1 747198180 UJLZKOITRLFZCP-LBPRGKRZSA-N 387.555 5.179 30 20 GKED Fc1nc(F)c(F)c(NN=C2CCCc3cc(SC(F)F)ccc32)c1F 750921283 DEHWXLOFLWNBOD-UHFFFAOYSA-N 391.340 5.105 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2Cl)cc1C#N 752157031 USKLHOWVNVLAQF-UHFFFAOYSA-N 393.230 5.077 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)OCC3CCC(C#N)CC3)c12 755957766 TUEVOIJLIOSROZ-UHFFFAOYSA-N 396.535 5.105 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2noc(-c3ccccc3)n2)cc1 766602109 SIEIHASHCYMKIY-CVEARBPZSA-N 383.879 5.280 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2Cl)s1 772958876 MBDRXLBTHSZDES-HNNXBMFYSA-N 382.916 5.822 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 780542043 KJWGUVVJBLRPIB-OAHLLOKOSA-N 383.517 5.821 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1 782803592 ULTUHWXCHVFOFX-QGZVFWFLSA-N 382.508 5.273 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)c(-c2ccncc2)n1 788345418 NOTZVUCASNLEML-HWKANZROSA-N 397.265 5.062 30 20 GKED COCC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(Cl)c(Cl)c1 790614346 QJTSCZFPTTXMCS-JLTOFOAXSA-N 393.314 5.152 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cc(Cl)ccc2Cl)cn1 792857265 BOUKSAXYHMNCGY-RMKNXTFCSA-N 385.250 5.355 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3csc(-c4ccc(F)cc4)n3)oc12 797152739 VBJSCOYMUGSEQQ-KTKRTIGZSA-N 379.412 5.600 30 20 GKED N#CCCCCCC(=O)O[C@H](c1cc(Br)ccc1F)C(F)(F)F 805874560 HGMXWAPDEUKEAV-CQSZACIVSA-N 396.178 5.209 30 20 GKED N#CCc1ccc(NC(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1 806173444 YESIRRFFKUQRTH-QHCPKHFHSA-N 385.467 5.063 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cc2ccccc2cc1NC(=O)OC(C)(C)C 813705278 SCLUQUIWYDJMFD-UHFFFAOYSA-N 395.503 5.247 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)c(F)cc1O 815635933 MDWPGTZPFDDGJD-FZKQIMNGSA-N 391.284 5.380 30 20 GKED COc1cccc2c1[C@H](C(=O)[C@@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 815911113 RNTATHIEKUDRHA-QZTJIDSGSA-N 388.492 5.033 30 20 GKED CC(=NOCc1coc(-c2cccs2)n1)c1nc2ccccc2n1C(F)F 836977915 QARNPUGTNXPAAO-UHFFFAOYSA-N 388.399 5.089 30 20 GKED C[C@@H](N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cc(C#N)ccn1 902965483 SZALSGKWEJOSSU-QRWLVFNGSA-N 392.503 5.028 30 20 GKED COc1ccc(SCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915087389 TUMLXQTZXCFIHW-QFIPXVFZSA-N 388.492 5.081 30 20 GKED COc1cc(C=NNc2cccc3ncccc23)c(-c2ccccc2)cc1OC 915964982 YDSPYYJNQNAVRA-UHFFFAOYSA-N 383.451 5.365 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CSCc2cccc(C)c2)cc1 916955945 VYQUTZZLPMWAAA-LAUBAEHRSA-N 394.540 5.089 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4ccccc4)CCCC3)n2)cc1 916971649 CTSINZTXNVBOFY-HXUWFJFHSA-N 386.520 5.807 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NNc1ccc(Cl)cc1Cl 1776029665 LGJBPJBHQISNHQ-ZDUSSCGKSA-N 395.286 5.266 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(F)c1OCC(F)(F)F 1776783796 LXUJDHDBZNHOSR-HNNXBMFYSA-N 393.421 5.060 30 20 GKED CCc1cccc2c(/C=C\C(=O)c3cc(C(=O)O)ccc3OC(C)C)c[nH]c12 1776977347 CYFPWCNMPSROBP-NTMALXAHSA-N 377.440 5.112 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(Oc2ccccc2)c(F)c1 1777268422 KJOAWNIOCCQQCN-PKNBQFBNSA-N 392.382 5.221 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)o2)c2cc(C(=O)O)oc12 1777360740 HFEWXBPLXHBRFX-CLFYSBASSA-N 388.375 5.296 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3cc(Br)cc(C(=O)O)c3)coc12 1777449090 SFUSCKHYCSHBRN-WAYWQWQTSA-N 385.213 5.098 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 41557222 SEKKAXSFRKRQNM-HOCLYGCPSA-N 397.425 5.200 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCc2ccccc2F)cc1 64717224 NDQIHXCMOMNNGZ-UHFFFAOYSA-N 396.487 5.686 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2c2ccncc2)cc1 98028691 JGBKYUHYNBKCOF-OAQYLSRUSA-N 384.439 5.115 30 20 GKED COCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 126281178 GNYYBWQCHSXQCH-ZDUSSCGKSA-N 383.300 5.110 30 20 GKED Cc1cccc([C@@H](C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 150775598 FPWHHOWMTIHDGL-LJQANCHMSA-N 384.479 5.382 30 20 GKED C=C[C@H](CC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 153199196 OJEQBXDSVVWKOQ-TZIWHRDSSA-N 386.495 5.198 30 20 GKED CC1CCN(c2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2)CC1 159981981 XQGHAMBNOWNUQE-QFIPXVFZSA-N 376.504 5.089 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)c1nc2cc(Cl)ccc2s1 161420133 LQHNOTGOLXHSNH-OAHLLOKOSA-N 377.856 5.349 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C)c(-c2ncco2)c1 163348179 WHJSWHACLIPFDP-UHFFFAOYSA-N 387.892 5.585 30 20 GKED COc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)sc1Br 179550793 OJDQPRQEWWUVHG-UHFFFAOYSA-N 399.335 5.002 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc2ccccc12 180078419 ASRUMUCZLWYYEW-VGOFRKELSA-N 385.467 5.500 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@H](C)c1ccccc1 183333493 XSGBIKMZGLFCPE-DLBZAZTESA-N 384.570 5.556 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(=O)N([C@H](C)c2ccccc2)C1 189886260 YSECCLAIKNHFMI-WIYYLYMNSA-N 390.527 5.087 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1([C@@H](O)c2ccccc2)CC1 191448259 YCPVATQMVHFMMF-QFIPXVFZSA-N 378.516 5.174 30 20 GKED C[C@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 194659614 RLIHJYVMCPLFEA-CYBMUJFWSA-N 384.888 5.410 30 20 GKED CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 273298224 DYNPEOOLJWHDPA-NHCUHLMSSA-N 395.478 5.011 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@@H]3C)c(C(F)(F)F)o1 410981789 OJUMGYBGYZIKHJ-BDAKNGLRSA-N 382.407 5.478 30 20 GKED CCC(CC)n1c(COc2ccccc2Cl)nnc1S[C@@H](C)CCC#N 412984207 OWRHEHLLPYSEAU-AWEZNQCLSA-N 392.956 5.656 30 20 GKED C=CCN(C(=O)C[C@H](C)c1c[nH]c2ccccc12)c1nc2c(s1)CCCC2 426704722 LRHPHEITHVMZTI-HNNXBMFYSA-N 379.529 5.216 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cn1 429354639 DCQZUQAPJPOEKH-OAHLLOKOSA-N 387.443 5.162 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc(Cc3ccccc3F)n2)s1 430617650 OADUINWAZXLMSN-CYBMUJFWSA-N 399.516 5.117 30 20 GKED COc1ccc2ccccc2c1CNC(=O)N[C@H](CCCC#N)c1ccccc1 431769953 DNKOVUWQPMCPQG-JOCHJYFZSA-N 387.483 5.083 30 20 GKED CCCN(C(=O)c1ccccc1NCc1ccccc1C(C)(C)C#N)C(C)C 433509131 IZTWIGSTIKAGJX-UHFFFAOYSA-N 377.532 5.360 30 20 GKED Cn1c(SCCC(C#N)(c2ccccc2)c2ccccc2)nnc1C1CCC1 434648104 KEVVEAMSGDSYBW-UHFFFAOYSA-N 388.540 5.075 30 20 GKED FC(F)n1ccnc1CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 436412176 OQLYBQAXJHEVQQ-NSHDSACASA-N 387.274 5.080 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)N[C@@H](CCC#N)c2ccccc2)cc1 440251949 FFDROUXILSIVNC-XZOQPEGZSA-N 391.515 5.367 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1ncc(C)s1)c1ccc(C(F)(F)F)cc1 440849389 XWCFDYYOOJLXOL-CJNGLKHVSA-N 397.466 5.538 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443882597 KCEOBMMECPLQOX-KRWDZBQOSA-N 385.467 5.524 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)CCCC1(C)C 444895326 JRIZWRMYGMBTAP-IBGZPJMESA-N 385.552 5.578 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 458808233 YQLXNSZAWXOIEA-LJQANCHMSA-N 390.314 5.570 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)cc1 458850463 UMWCNUJZNRACOR-LADGPHEKSA-N 375.516 5.103 30 20 GKED C[C@H](C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462503066 PTGGOIWBXMDYFT-MGPUTAFESA-N 386.417 5.434 30 20 GKED N#Cc1cccc(Cl)c1NCc1cccc(NC(=O)c2cccc(F)c2)c1 462794086 SSVDSUWGBPAYAK-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)cc1 463564101 QZJYWOKARAOTNE-UHFFFAOYSA-N 388.298 5.471 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccc(Cl)cc1C(F)(F)F 471797543 IMQKDKFQBRZWRL-UHFFFAOYSA-N 385.666 5.769 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccccc2SCCC#N)c(Cl)c1 471849161 WAUPHNSVNOHSNB-UHFFFAOYSA-N 388.920 5.777 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1Br 473928267 NPGSGLKGUTUBOT-HNNXBMFYSA-N 397.297 5.371 30 20 GKED C[C@H](Nc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1)c1ccccc1 475469434 IWIXUYGAAXKTOZ-SIKLNZKXSA-N 383.495 5.886 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 475547434 LGDTYNSIWRINQI-NRFANRHFSA-N 382.935 6.561 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1 475549902 QBXCQDXBCUYDEC-UNMCSNQZSA-N 396.506 5.719 30 20 GKED C=CCOc1ccccc1CNC(=O)N(Cc1ccccc1)Cc1ccccc1 477592960 ZJNGJDSKHJUDBD-UHFFFAOYSA-N 386.495 5.163 30 20 GKED CN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480381389 SAWALMCXIAAGDX-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C=C(C)[C@H](NCc1cccc(C(=O)Nc2ccccc2)c1)c1ccc(F)c(F)c1 481593635 MDXPCHSDDGRZOP-QHCPKHFHSA-N 392.449 5.624 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccnc2-c2ccc(Cl)s2)cc1 484211015 UARJWWYGLNUQFH-UHFFFAOYSA-N 381.888 5.517 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1 485765312 DYCFXRJNNGQDKM-QGZVFWFLSA-N 394.540 5.232 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N[C@H](CCCC#N)c3ccccc3)o2)cc1 487266693 JHUWLASQLUVPDW-OAQYLSRUSA-N 386.451 5.314 30 20 GKED Cc1ccc(CCCC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 490633070 WLKKWFKBYDMUBD-UHFFFAOYSA-N 398.506 5.602 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(C)cc2)n1 498450275 OTTAUSSLTRDQFW-UHFFFAOYSA-N 375.497 5.043 30 20 GKED CC(C)[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(F)cc1 501628911 PVTZQWWUQFUMAE-JOCHJYFZSA-N 389.430 5.012 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H](C)c1ccccc1 504051480 HNOWMCKKBWLMOY-SFHVURJKSA-N 385.467 5.328 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC(C)(C#N)CC3)c(C)c2)c1 506665175 ULRKCOXZJCYNEC-UHFFFAOYSA-N 377.488 5.040 30 20 GKED C[C@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)c1ccc(F)cc1F 507577557 JOHQMGUCSNAYLX-OAHLLOKOSA-N 380.394 5.156 30 20 GKED N#Cc1ccc(OC2CCN(Cc3ccc(-c4ccccc4C#N)cc3)CC2)cc1 507850484 XHCVEUKNWFGPQV-UHFFFAOYSA-N 393.490 5.140 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1cc(C#N)ccc1Cl 510677194 CLXIFXRUFQIOPB-UHFFFAOYSA-N 392.890 5.256 30 20 GKED COc1cccc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 510681719 NADMBTORBVKBEY-INIZCTEOSA-N 387.439 5.242 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccnc(Oc2ccccc2)c1 517441345 VIYFWYJCRDGDNA-UHFFFAOYSA-N 375.453 5.132 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCCc4cccc(F)c43)cc2)cc1 518370127 FYRLUHYFHYOOGP-UHFFFAOYSA-N 386.426 5.277 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 521701050 RDBRWGOFYURWJM-NRFANRHFSA-N 379.891 5.061 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)C(=O)Nc1ccc(C(C)(C)C)cc1 521731246 OQYKGBHBLKKTHK-SJORKVTESA-N 395.572 5.675 30 20 GKED C[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccc(F)c1 525139998 CYMSYXOZECUZLO-QGZVFWFLSA-N 388.442 5.213 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 538044015 QSBBKBNVPJAOMV-INIZCTEOSA-N 398.915 5.755 30 20 GKED CC(C)(CNC(=O)c1ccccc1Sc1ccccc1C#N)C(F)(F)F 558697438 YKOOYPRHDJTRNL-UHFFFAOYSA-N 378.419 5.028 30 20 GKED C[C@H](N[C@@H](CO)c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 560912961 DXWVZSHCHUNZLK-QFYYESIMSA-N 395.318 5.248 30 20 GKED N#CCCN(C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc(F)cc1 574348137 RQWBSMCWDXWCBW-UHFFFAOYSA-N 397.837 5.014 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(C)C[C@@H]1c1ccccc1 577916726 IPAXCHCYUXATHE-JOCHJYFZSA-N 377.532 5.059 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Sc1nc2c(cc1C#N)CCCC2 585688506 QHWHJAKQJIPLBL-CVEARBPZSA-N 393.556 5.465 30 20 GKED CC[C@@H](OCCNC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 593158635 BZXPATHVHCHECC-YLJYHZDGSA-N 397.544 5.228 30 20 GKED N#Cc1cccc(C2(NCc3sc4ccccc4c3Cl)CCOCC2)c1 594983236 IVXTWBWCUYINCK-UHFFFAOYSA-N 382.916 5.222 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(OC2CCC2)cc1 596306569 GIJMMYNKKBGEGS-MRXNPFEDSA-N 396.512 5.030 30 20 GKED CC[C@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 600002803 XNPQQIYUUVDOMF-JKSUJKDBSA-N 395.528 5.172 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCc1ccccc1F 603532880 BZBNXSUJRZJZRM-UHFFFAOYSA-N 390.433 5.311 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1ccc(-c2ccccc2)cc1F 604005873 DKXCKURIXAHXOX-UHFFFAOYSA-N 379.822 5.068 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)cc1CNc1cccc(OCCCC#N)c1 610270728 YWGCMUWVZUVPED-UHFFFAOYSA-N 380.879 5.129 30 20 GKED C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1cccc(C#N)c1 610359789 OGSMPSOAVKNJFG-WDNCENIBSA-N 396.490 5.118 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1cccc(OCc2cn3ccccc3n2)c1 610829731 HCSRIVHZTVKGDB-MOPGFXCFSA-N 396.494 5.197 30 20 GKED COC1CCC(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 614808079 YKVCGOUSLQHXOE-OUNSHVDWSA-N 382.891 5.139 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 620310524 PEXRIHKAKQASNK-GASCZTMLSA-N 378.419 5.152 30 20 GKED CCOc1cc(/C=C\C(=O)c2sc(-c3ccc(OC)cc3)nc2C)ccc1O 727973951 CGWFHUGSDBRSLT-SDQBBNPISA-N 395.480 5.128 30 20 GKED Cc1ccc(C)c(CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 728147808 NITDZQJZZDACTQ-OAHLLOKOSA-N 388.414 5.351 30 20 GKED C#Cc1cccc(N(C(=O)Cc2csc(-c3ccccc3Cl)n2)C(C)C)c1 728247919 VERAJAPXHJBXSV-UHFFFAOYSA-N 394.927 5.429 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)n1 728299991 WTVNXWYGOHSGED-HNNXBMFYSA-N 394.450 5.175 30 20 GKED O=C(/C=C/c1csc(-c2ccc3c(c2)OCO3)n1)c1cc2ccccc2o1 728437675 GJMCHCDFKOPRGI-VOTSOKGWSA-N 375.405 5.181 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(C)c3ccc(C#N)cc3F)cs2)cc1 729653874 MQWVULAUFUUEBP-UHFFFAOYSA-N 393.487 5.150 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1csc2ccccc12 730067887 HOXUURUIXSFACP-OAHLLOKOSA-N 375.497 5.208 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)n1 730072303 TVINFWQLTGMOSC-HNAYVOBHSA-N 398.940 5.815 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(-c3ccoc3)n2)cc1 730962164 LQXDLDNWXSHUGD-IBGZPJMESA-N 385.448 5.311 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2csc(-c3ccc(Cl)cc3)n2)c1 733800551 ZCOJQARTTLOREM-IBGZPJMESA-N 397.931 5.434 30 20 GKED C=CC[C@H](NC(=O)c1cc2ccccc2n1Cc1ccccc1F)c1ccncc1 734234249 KFOGYRSRYQVZIS-QFIPXVFZSA-N 399.469 5.271 30 20 GKED CC1(C)C(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)[C@H]2CCCO[C@H]21 743429574 SRFWMYCOMFJZFF-RDTXWAMCSA-N 396.491 5.100 30 20 GKED C[C@H](NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1cccc(C#N)c1 744381927 MERWDZORNYQRLB-ZETCQYMHSA-N 389.069 5.058 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1cnn(-c2ccccc2)c1 746347448 KJFWIMTYUPBKQY-ZHACJKMWSA-N 375.428 5.031 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4cn[nH]c4)c3)cc2)cc1 761565124 GJVKRJZCCGUPRW-UHFFFAOYSA-N 394.434 5.187 30 20 GKED N#Cc1ccc(F)cc1COC(=O)c1sc(-c2ccccc2)nc1C(F)F 761625731 KUWWGIAPDCIIKB-UHFFFAOYSA-N 388.370 5.115 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccnc(N3CCCCC3)c2)cc1 765058430 GNJSMRZVKSZTNM-SFHVURJKSA-N 385.939 5.054 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccccc2C(C)(C)C#N)cc1 767806122 GMYGLNJPAYBRHP-KRWDZBQOSA-N 393.531 5.686 30 20 GKED N#C[C@H](C(=O)CN(Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 772636028 AHTPUNOSYLVCHR-QHCPKHFHSA-N 391.474 5.118 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(OCC(F)(F)F)cc2)c1 772982692 FITXWYLQKDYAKK-QAPCUYQASA-N 392.421 5.159 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)c1 772984186 MTILYYQIQINGJQ-UZLBHIALSA-N 390.405 5.043 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)Nc2ccc(F)cc2OCC#N)cc1 773071205 YAADKQGPQVRSKN-UHFFFAOYSA-N 392.455 5.440 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 775144502 WCKWFXURXXLRRC-LEWJYISDSA-N 392.628 5.260 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc3c(c2)N(C(=O)NCC)CC3)cc1 777697857 WZUJBOMGEWMLOS-INIZCTEOSA-N 399.922 5.083 30 20 GKED O=C(O[C@H](Cc1ccc(F)cc1)C(F)(F)F)[C@@H]1CCC[C@H](C(F)(F)F)C1 781752509 AJRFTHRCKQLZJQ-MBNYWOFBSA-N 386.307 5.211 30 20 GKED C[C@H](OC(=O)c1cccnc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 789009792 DJWDYISOICEBOR-QMMMGPOBSA-N 381.247 5.176 30 20 GKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1cc(Br)ccc1F 789144281 UVHXNUNTWWANKN-GQCTYLIASA-N 378.222 5.201 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3nc(C(F)F)sc3c2)cc1Cl 795153889 IAEQNBUOTSSXMP-UHFFFAOYSA-N 394.859 5.568 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 797944617 JSBGTCMYLAKVJG-WDEREUQCSA-N 382.382 5.090 30 20 GKED Cc1sc([C@@H](C)Nc2nc(Cl)c(C#N)s2)nc1-c1ccc(Cl)cc1 804543422 UWVCDHOPELAALO-MRVPVSSYSA-N 395.340 5.927 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](OC1CCCC1)c1ccccc1 804559191 SJTKNXVOXHMMDA-QHCPKHFHSA-N 395.547 5.069 30 20 GKED COCCn1nc(C)c(C(=O)/C=C/C(C)=C/c2cccc(C(F)(F)F)c2)c1C 806573551 MLXLNJYQNWAUNA-CHBKHGQFSA-N 392.421 5.008 30 20 GKED N#Cc1sc(NC(=O)[C@H](Sc2ccccc2)c2ccccc2)nc1Cl 813369615 CVTRMTDIKWAQGS-OAHLLOKOSA-N 385.901 5.140 30 20 GKED Cc1ccc2oc(-c3noc([C@H](CCCC#N)NC(=O)OC(C)(C)C)n3)cc2c1 818421555 FRZQYZVEBVHYCI-HNNXBMFYSA-N 396.447 5.051 30 20 GKED COCCc1nc(C)c(C(C)=NNc2ccc(Cl)c(C(F)(F)F)c2)s1 844607478 YWNKMOJUHRDIQL-UHFFFAOYSA-N 391.846 5.149 30 20 GKED CCN(Cc1ccccc1C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353954 RRLJNSCOQPVGTA-XMMPIXPASA-N 383.495 5.705 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3ccc(Cl)s3)c2)cc1 916135672 FWLHYKBMRMOBJK-BJMVGYQFSA-N 397.883 5.559 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCOCCc2ccccc2)cc1 917119559 MGXNXKKPHZCXQQ-VWLOTQADSA-N 398.506 5.320 30 20 GKED CC(C)=C[C@@H]1[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1(C)C 920140352 BYTQZVRCRJFPSX-SCTDSRPQSA-N 375.497 5.096 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2ccc(Cl)cc2F)c1 1776106589 MGPGIKFXVAJZOH-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2cccc(O[C@H](C)C(=O)O)c2)cc1 1776125781 SIVZBKHVKADJFD-CRPZLVSXSA-N 382.456 5.004 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C/C(=O)c3ccc(CC(=O)O)cc3)o2)cc1 1776271446 INIAHJWMXDNJCH-WYMLVPIESA-N 388.463 5.767 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(C(F)(F)F)c1F 1776355480 QUKZXMDPORIVJK-VURMDHGXSA-N 396.336 5.226 30 20 GKED CCCCCCCOc1ccc(CNCCCC[C@@H](CCC)C(=O)O)cc1 1776786989 IFTHZUOZNNHOQF-OAQYLSRUSA-N 377.569 5.797 30 20 GKED CCCCCCCOc1cccc(/C=C\c2nc3c(s2)CCC[C@@H]3C(=O)O)c1 1776789199 UNRDMGOMNUMDDD-QQBSYFJQSA-N 399.556 6.167 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776950906 LRDBSFFCBORZKE-SXGWCWSVSA-N 388.488 6.060 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1C 1777275251 UQZKXNRZAFVGLQ-NTMALXAHSA-N 392.476 5.635 30 20 GKED COc1ccc(/C=C2/CCc3ccc(C(C)C)cc3C2=O)c2cc(C(=O)O)oc12 1777360193 BDNWXTPRHICCEW-YVLHZVERSA-N 390.435 5.476 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)CC(F)(F)F)CCC2)cc1 1789625847 AKUVDWLJVRMVSL-UHFFFAOYSA-N 396.453 5.065 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(C#Cc2ccccc2)cc1 10541413 PHUINYKMTZXLST-UHFFFAOYSA-N 391.474 5.141 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2ccc(C#N)cc2)cc1 24649946 DKZIEYPWXJKPLS-UHFFFAOYSA-N 397.478 5.360 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)c2cccs2)c1 43979810 DULRUTHSAQNQNZ-UHFFFAOYSA-N 391.496 5.221 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 48161484 AJYZRMRAWAFWOL-UHFFFAOYSA-N 399.494 5.304 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2/Cc3ccccc3C2=O)cs1 54895685 HBNJLSKXXVPWCF-PTNGSMBKSA-N 394.883 5.304 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCc1nc2ccccc2s1 66802348 SXRFLFSYPNMSAV-HNNXBMFYSA-N 395.553 5.652 30 20 GKED Cc1ccccc1C1CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 66954630 YIDAALNOZSLJLL-SFHVURJKSA-N 393.556 5.801 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1cc2ccccc2o1 66955174 YPLXOAVKBFGELY-GJZGRUSLSA-N 379.485 5.710 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc1 72031004 BFWYINIVHZXWBM-VMPITWQZSA-N 399.493 5.011 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2c2ccncc2)cc1 98028692 JGBKYUHYNBKCOF-NRFANRHFSA-N 384.439 5.115 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCSc1ccccc1 104919554 VRSBEIRNRXEJAL-UHFFFAOYSA-N 390.533 5.232 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](C)c1cccc(F)c1 115992022 AXWGXYRKUDTDLY-HNNXBMFYSA-N 389.430 5.325 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3cc(C#N)ccc3OC(C)C)o2)cc1C 123548875 IPISKGLTNDEHJR-INIZCTEOSA-N 376.460 5.185 30 20 GKED C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccco1)c1ccc(C#N)cc1 157524615 WVQHPUQMOOKVEG-CQSZACIVSA-N 392.509 5.373 30 20 GKED N#CCCCCNC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 171509279 IYEKTBPEPOYWRG-UHFFFAOYSA-N 381.526 5.012 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(F)(F)F)cc1 171742442 RNJOWTOAJJUNMD-CYBMUJFWSA-N 393.434 5.279 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1nccs1 174494011 ADHNAAIOPYIRMU-MRXNPFEDSA-N 396.447 5.219 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 176148781 JEQZMWKMNWMDNS-AWEZNQCLSA-N 393.468 5.075 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2[nH]c(C(F)F)nc2c1 179829722 AYRDLHFCNVFPLZ-UHFFFAOYSA-N 388.377 5.291 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@H]1CCCc2ccccc21 180015053 KRVATYCKYASRIT-KKSFZXQISA-N 375.472 5.051 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)csc1Br 185674533 VIHGZJMKFHWKKE-UHFFFAOYSA-N 381.320 5.077 30 20 GKED C=C(C)[C@H](NCc1csc(-c2ccccc2OC)n1)c1ccc(F)c(F)c1 187781132 JIRBNGAROPJDJI-FQEVSTJZSA-N 386.467 5.504 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc(OC)c(F)c1 188071664 SJVIUIYYHACFOK-UHFFFAOYSA-N 383.463 5.288 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1 207597015 PIBAXBUUHYZCMR-GHXNOFRVSA-N 381.859 5.397 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301767147 WQESQFFJFCLVDO-MSOLQXFVSA-N 380.900 5.834 30 20 GKED Cc1nc2ccccc2nc1CSC/C(O)=N/C12CC3CC(CC(C3)C1)C2 328890866 SBKYZBOGQZPOGW-UHFFFAOYSA-N 381.545 5.097 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)C1 329055898 ICZGZRPCERVQKG-CWJKEVGVSA-N 397.563 5.628 30 20 GKED Cc1cc(N(C)C)cc(C)c1N/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329403917 YVSOLZALRGSJLU-HXUWFJFHSA-N 395.551 5.085 30 20 GKED CC[C@@H]1C[C@H](/C(O)=N/Cc2nc3c(s2)C[C@@H](c2ccccc2)CC3)CC(O)=N1 329796990 FGMMFELERZEOJZ-YESZJQIVSA-N 397.544 5.017 30 20 GKED Cc1nc2c(s1)[C@@H](N(C)C(O)=Nc1cc(-c3cccnc3)ccc1C)CCC2 330338465 VKYUCLOCGQVSSC-FQEVSTJZSA-N 392.528 5.377 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)c1 410036666 DJRDENDXXCODSH-UHFFFAOYSA-N 388.470 6.339 30 20 GKED CC(C)c1ccccc1-n1c(S[C@@H]2CC[C@@H](C#N)C2)nnc1-c1cccnc1 430100650 MAXIDDRSMJLRAU-SJLPKXTDSA-N 389.528 5.237 30 20 GKED C=CCC(C)(C)CNC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 433145744 RPRCQKDENAYJJN-UHFFFAOYSA-N 385.895 5.316 30 20 GKED C[C@H](C(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 463722627 BHCDVMGJMRCFOE-YWZLYKJASA-N 386.417 5.434 30 20 GKED C[C@@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)c(F)c1 468032096 YYXIWBZNKUQELD-YJYMSZOUSA-N 395.478 5.688 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CC(=O)OC)c1ccc(F)cc1 475553016 NTVHGFLEDAGSEA-HXUWFJFHSA-N 398.478 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)[C@H](C)Cc1ccc(OC)cc1 475564655 NHHVDJAJNWBSHW-LJQANCHMSA-N 394.559 6.032 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3Cc4ccccc4C4(CC4)C3)cc2)c1 480588987 OTXLJDXBEGHADQ-UHFFFAOYSA-N 395.462 5.430 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc(Cl)sc2Cl)cc1 487867833 CFULUZONIBFXCG-UHFFFAOYSA-N 393.217 5.131 30 20 GKED Cc1csc(C(=O)NC2(C#N)CCC(C(C)(C)C)CC2)c1Br 489799600 UNEZOEAIVWLGJD-UHFFFAOYSA-N 383.355 5.048 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)F)c(F)c1)c1nc2cc(Cl)ccc2s1 496406398 FYEITJGRILRKAA-SNVBAGLBSA-N 396.777 5.180 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@@H]1CCCc2ccc(C(C)C)cc21 501105658 NPZDXYAMUJKCEI-HSZRJFAPSA-N 396.531 5.061 30 20 GKED CC(C)(C)c1ccc(CCCCC(=O)N(CCC#N)Cc2ccccn2)cc1 505195825 DSYWCALRONQNTA-UHFFFAOYSA-N 377.532 5.034 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccsc2)s1)c1ccc(Cl)c(Cl)c1 505955348 VRONHMKFGBQQDN-ZDUSSCGKSA-N 394.308 5.173 30 20 GKED CCOc1ccc([C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1OC 507654921 YELVPOVRNUIBEB-SJDLUZLQSA-N 378.516 5.149 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cscc1Br 511878923 ZPNRJRPMYZYVTM-JTQLQIEISA-N 381.320 5.015 30 20 GKED Fc1cc(F)c(Cc2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1F 512014541 GURYTFCMRZJWSY-HNNXBMFYSA-N 390.258 5.155 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4ccc(C(F)(F)F)cn4)cc3c2C1 513158224 ADHCVRFFKFPOEN-YVEFUNNKSA-N 397.400 5.197 30 20 GKED O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513539356 PYYBHLJSBWDNEM-ZDUSSCGKSA-N 383.307 5.039 30 20 GKED N#Cc1cccc(/C=C(/CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c1 518602941 SXUNAMRFXGOZQN-QPEQYQDCSA-N 388.370 5.202 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 519422700 GGGZUOWXJZLYEF-ZIAGYGMSSA-N 390.961 5.711 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 519888979 PZYGUZMZCMMVLN-KGLIPLIRSA-N 375.394 5.041 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(OCC(F)(F)F)c1 520012733 BCNGTCNVSNBEIR-UHFFFAOYSA-N 396.368 5.419 30 20 GKED COCC[C@@H](NCc1ccc(C#N)cc1Cl)c1ccc(Cl)c(Cl)c1 520207479 VCJOBKYYYFDYFK-GOSISDBHSA-N 383.706 5.386 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1c(F)cccc1F 521811190 WVUZPRQTJVCSAX-CQSZACIVSA-N 393.393 5.511 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CC[C@H](c2ccccc2F)C1 521943615 HTDHZUFVBGLFDD-AWEZNQCLSA-N 393.380 5.039 30 20 GKED Cc1ccc(C(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1Oc1ccncc1 522304033 KMTCYVBOZQGKJU-UHFFFAOYSA-N 399.494 5.352 30 20 GKED C=CCOc1ccc(CN[C@H](Cc2ccccc2)c2cccs2)cc1OC 522630426 NJTZZTWADSIJST-HXUWFJFHSA-N 379.525 5.395 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)sc1SCC#N 524105117 QZEFEPOQZZHMAK-MNOVXSKESA-N 398.340 5.116 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H]1CCCC[C@H]1C(C)(C)C 533512425 LDVYQGADUVWWDN-KZNAEPCWSA-N 387.593 5.214 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1ccc(C#N)cc1Cl 534483881 IKTBVHUIYPVQDJ-GFCCVEGCSA-N 376.913 5.325 30 20 GKED CCN(C(=O)Cc1csc(-c2cccc(C)c2)n1)c1ccc(C#N)c(Cl)c1 535880997 ZVQYBLRXJAQIDV-UHFFFAOYSA-N 395.915 5.239 30 20 GKED COc1ccc(CN2CC[C@@H](c3ccc(Cl)cc3)C2)cc1OCCCC#N 537629154 WMUVEMBVBSQUGD-LJQANCHMSA-N 384.907 5.021 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c1C 538560366 YRNCIFFNCRNJRW-UHFFFAOYSA-N 376.500 5.508 30 20 GKED CCc1nc2ccccc2n1C1CCN(Cc2ccccc2C(C)(C)C#N)CC1 540056082 BPPRIEDNLMRUJG-UHFFFAOYSA-N 386.543 5.237 30 20 GKED CC(C)(C)C[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(F)cc1 540365276 JNXRSTZRTOHQFO-IBGZPJMESA-N 378.451 5.014 30 20 GKED C=C[C@@H](Cc1nc(Cc2ccc(OCc3ccccn3)cc2)no1)c1ccccc1 546984455 ZRMVAJMTBJSGTO-FQEVSTJZSA-N 397.478 5.147 30 20 GKED CSC[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(C(F)(F)F)cc1 551557406 FWFIMJYNOZYNFL-GOSISDBHSA-N 376.447 5.260 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H]1CCc2ccc(C#N)cc21 558504729 XKYHZVLBCFFUJR-RBZFPXEDSA-N 377.488 5.467 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2c3ccccc3CC23CCOCC3)CC1 558508108 AVNBQMSTCCWPPT-NEQFMPMPSA-N 386.539 5.074 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccccc2F)C1 563499946 ZJQXAIJRECAYPD-JYJNAYRXSA-N 383.492 5.145 30 20 GKED Cc1ccc(C)c(SCc2noc(C3(c4cc(F)cc(C#N)c4)CC3)n2)c1 567543861 LHLSURNIFAOGFQ-UHFFFAOYSA-N 379.460 5.069 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](CCCC#N)c3ccccc3)s2)cc1 574298039 NTTCQTLNMFKOTR-XMSQKQJNSA-N 389.568 6.513 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccccc1OCc1ccccc1 581146575 WAPKLWQTZIDXOD-PXDATVDWSA-N 384.523 6.351 30 20 GKED C=CCOc1ccc(CNCc2ccc(Oc3ccc(F)cc3)nc2)cc1Cl 589641701 ZYHXVAAVGRMNRB-UHFFFAOYSA-N 398.865 5.521 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)c(C(F)(F)F)c1 596710731 FCQFRAGCFSFISW-ZIAGYGMSSA-N 399.482 5.754 30 20 GKED CC(C)(CC(F)(F)F)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 596803328 OPTFIDSLJYWKOH-UHFFFAOYSA-N 376.378 5.054 30 20 GKED N#CC1(CCCN(Cc2ccc3[nH]ccc3c2)Cc2cccs2)CCOCC1 599673892 VJNBHVZOESBPBO-UHFFFAOYSA-N 393.556 5.332 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21 599736371 FKJRFASOKXRFTF-ALIQFICWSA-N 397.931 5.194 30 20 GKED CC(C)(C)n1nc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1C1CC1 603996253 GZDVSKFHVJKFPM-UHFFFAOYSA-N 396.560 5.360 30 20 GKED CC(C)CCOc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 608915756 ADUQZANUPYBLTH-UHFFFAOYSA-N 379.504 5.426 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)c2cc3ccccc3n2CC#N)cc1 609175697 WMPHKBWDOVULBT-MRXNPFEDSA-N 377.513 5.156 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1OCC 609376553 CIVBTRVATYFZNS-INIZCTEOSA-N 398.528 5.378 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609498564 NIZLNRLWRDFUNM-INIZCTEOSA-N 397.434 5.325 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609988224 BZSQSOCCLBPJJS-PXAZEXFGSA-N 380.797 5.233 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N[C@@H](C)c1cccc(C#N)c1 610361378 BJMQOYMUBQQYMO-INIZCTEOSA-N 391.540 5.394 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)c1c(Cl)cc(C#N)cc1Cl 611096104 MUNAOOWYGZROHR-HNNXBMFYSA-N 377.271 5.210 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccccc1SCc1ccco1 615081430 GJZZKLJOUFUWDD-UHFFFAOYSA-N 393.508 5.409 30 20 GKED C=CCN(C(=O)COc1cccc(Cl)c1)c1nc(-c2ccccc2)cs1 641902336 SPGPVDRFAUJECQ-UHFFFAOYSA-N 384.888 5.062 30 20 GKED N#C[C@H](C(=O)c1cc2[nH]ccc2s1)c1nc2cc(C(F)(F)F)ccc2s1 684631050 JXSIMYNXTSNPNC-SECBINFHSA-N 391.399 5.348 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 728061968 CKRNXTODZXJGCB-IBGZPJMESA-N 399.494 5.193 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 728116578 NAZYMOWXNJMIOZ-NRFANRHFSA-N 375.497 5.376 30 20 GKED Cc1ccccc1CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 729070656 SLERGXOLUWUKHT-SFHVURJKSA-N 380.900 5.581 30 20 GKED C[C@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cnc2ccccc2c1 732498065 IQRXLAZOPICAPE-INIZCTEOSA-N 395.418 5.212 30 20 GKED CCC(CC)[C@H](NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1ccccc1 733845598 GAUXEVIWHIKPAW-GGAORHGYSA-N 393.531 5.344 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 734662380 YTJQKEDQFPNFSD-APWZRJJASA-N 392.528 5.191 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1ccc(Oc2ccccc2)cc1)c1ccncc1 734666486 YNUFYSRAYVYZBY-WZONZLPQSA-N 387.483 5.552 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(C)C)c1ccncc1 734666881 NMUMGEMSISNMGZ-MOPGFXCFSA-N 391.437 5.414 30 20 GKED CC(C)Oc1ccccc1/C=C\C(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 741447444 LEPAQRNCYHYRCI-SSZFMOIBSA-N 398.524 5.086 30 20 GKED Cc1ccc(C)c(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743034737 BVYPWWCRFHBYST-UHFFFAOYSA-N 391.471 5.915 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(OC(F)(F)F)cc1 743056685 JNOHFYXKXYGTOK-KMKOMSMNSA-N 386.329 5.064 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3cccc(Cl)c3)n2)cc1 744061130 GWCMYHSPKAUWGJ-SCLBCKFNSA-N 396.899 5.452 30 20 GKED C[C@H](OC(=O)C1(C#N)CCCCC1)C(=O)c1ccc(Oc2ccccc2)cc1 744858465 LZCDALJMYUUFIU-KRWDZBQOSA-N 377.440 5.067 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990777 XZVRJXIKNGBIGI-DHZHZOJOSA-N 381.435 5.043 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)Nc1cccc(OCC#N)c1 746662991 LYPSQPGMYKMCOP-LJQANCHMSA-N 385.467 5.384 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)C2)cc1 752484949 KMBOESHJGNRJIY-ILBGXUMGSA-N 395.506 5.672 30 20 GKED C#CCOc1ccc([C@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 764775398 VOUFGVQSUXKGNS-ARLBYUKCSA-N 393.371 5.259 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)[C@@H](O)c1c(Cl)cccc1Cl 777177490 FENPADQGKDMUKH-KPZWWZAWSA-N 396.339 5.123 30 20 GKED C=C[C@](C)(CCOC)COC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 784635400 WQNQAEOBQIOTSC-DRSNIGMVSA-N 385.529 5.118 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCN(C(=O)OC(C)(C)C)C(C)C 789889247 LGFWYVVDPYUBHK-UHFFFAOYSA-N 388.552 5.513 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)Nc1ccc(C#N)cc1Cl 790955057 RKGPCDCNEDEGBS-UHFFFAOYSA-N 399.878 5.130 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(C(F)(F)F)n2)cc1 793044747 RZGZPXMLWPNBHQ-HNNXBMFYSA-N 387.386 5.070 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(Br)c1Cl 801946570 PLDUMQSLOOVKQX-SNVBAGLBSA-N 394.656 5.037 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2csc(-c3cccs3)n2)C(=O)c2ccccc21 802707122 FVAZVPOIESTFOY-OJNOIJSXSA-N 395.505 5.188 30 20 GKED COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)CCCCCC#N 808033826 GSFPDAPKQRXCCM-UHFFFAOYSA-N 390.892 5.268 30 20 GKED CC(=NNCc1cccc2cccnc12)c1sc(Cc2ccccc2)nc1C 814803732 LPTDATNHTKAHFY-UHFFFAOYSA-N 386.524 5.104 30 20 GKED C=CCc1cc(OCC)ccc1OC(=O)CCc1ncc(-c2ccccc2)o1 822043504 GONHSNKVOLKKOS-UHFFFAOYSA-N 377.440 5.007 30 20 GKED Oc1nc2ccccc2cc1C=Nc1ccc(-c2nnc3n2CCCCCC3)cc1 912780581 AHNDASBPOHODPT-UHFFFAOYSA-N 397.482 5.066 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1scnc1C 915111460 IVSFHZDKDRQVCW-UHFFFAOYSA-N 383.477 5.098 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccsc2)cc1 915359650 WBKJAJRBKUCDDW-VXKWHMMOSA-N 387.508 5.773 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(N2CCCCC2)c(F)c1 915985477 LOZRCWWHYZQVTE-NTMALXAHSA-N 393.487 5.231 30 20 GKED N#C[C@H](C(=O)/C=C\Sc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 916977278 OXCXMBAWMJOQHZ-QXPKXGMISA-N 396.924 5.946 30 20 GKED COc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1OC 917603968 DAWCESNUPAJAEZ-ZHACJKMWSA-N 395.436 5.237 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cs1 1776280426 IUFZJOCSGOAFLP-VMPITWQZSA-N 397.452 5.001 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1/CCc2occ(C(=O)O)c2C1=O 1776365079 VFSSVSWWWOHVGO-FLIBITNWSA-N 376.861 5.344 30 20 GKED CCCCCCCOc1ccc(CNC[C@@]2(CC(=O)O)CC[C@@H](C)C2)cc1 1776786382 TYUYBBMEYLXOQV-XXBNENTESA-N 375.553 5.407 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CCC(=O)O)c2ccccc2)cc1 1776786529 QPMILZHDKTYGDX-HSZRJFAPSA-N 383.532 5.732 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776805922 CPSLMEXJSQGMAU-BENRWUELSA-N 378.424 5.378 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776817317 UXRFMYQWCDQHRM-FLIBITNWSA-N 392.407 5.035 30 20 GKED CCN(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776855468 PLEXGECBGKYLTI-YVLHZVERSA-N 385.463 5.404 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1C 1777275214 NWXQWZBIYFHURW-CSKARUKUSA-N 376.408 5.166 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc1 1777639381 SBYRHMVHQMMDDX-SEYXRHQNSA-N 392.476 5.555 30 20 GKED N#Cc1c(NC(=O)CCSc2ccccc2Cl)sc2c1CCCC2 7434675 ZYJRZXHUQNFHRT-UHFFFAOYSA-N 376.934 5.273 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCCOC1CCCC1 61776902 AUFDMJHKJDTYLE-UHFFFAOYSA-N 393.487 5.130 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)CCCc2ccc(Cl)cc2)cc1 65870193 PZRIFMUHRZLUFF-UHFFFAOYSA-N 396.918 5.116 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2ccccc21 66953848 FWEQSNYFUPGQAG-WBVHZDCISA-N 381.501 5.116 30 20 GKED COc1cc(C(=O)/C=C/c2c(C)nn(-c3ccccc3)c2C)ccc1SC 72050209 SIFKFMODOXUUAU-VAWYXSNFSA-N 378.497 5.116 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@H](C)c1nc(C(C)C)no1 102778748 FCRKSMYGIPSURA-MRXNPFEDSA-N 376.460 5.125 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 108407674 VVXQCZLZXCYCAY-ZFWWWQNUSA-N 387.936 5.339 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)c1ccc(F)c(C(F)(F)F)c1 109155974 QWEYYATZLSVWLT-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccccc1 122703641 QYMKYSOWGUQGKJ-IBGZPJMESA-N 391.515 5.393 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nnc1-c1ccccn1 124914891 KNVYTYWNBXURMX-UHFFFAOYSA-N 393.903 5.020 30 20 GKED COc1ccc(CCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 127899720 KHOPXLQBXUIXOG-IBGZPJMESA-N 376.481 5.018 30 20 GKED N#Cc1cn(CCCOc2ccc3ccccc3c2)c2ccc(Cl)cc2c1=O 133525324 VKBUDFZXZSIBKF-UHFFFAOYSA-N 388.854 5.149 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/Cc3ccc(F)cc3C2=O)cs1 176410657 MLGGLCRHYAHUTH-YBEGLDIGSA-N 392.455 5.098 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C)c1ccccc1 186975861 BDMRYJQYLBAIEW-QFIPXVFZSA-N 398.506 5.936 30 20 GKED N#CCC[C@H](NC(=O)N(CCC(F)(F)F)Cc1ccccc1)c1ccccc1 189638416 ANDXOVAGMFVCCB-IBGZPJMESA-N 389.421 5.196 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(CC#N)c2)c(C(F)(F)F)c1 195301778 ZQSNCVGFWSGPPE-CYBMUJFWSA-N 392.446 5.914 30 20 GKED CC(C)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 236737787 LAHFOZJGAQIZIS-MGPUTAFESA-N 376.422 5.483 30 20 GKED C[C@@H](C(O)=Nc1ccccc1NC12CC3CC(CC(C3)C1)C2)c1ccccn1 328787704 PDCPONLFXITYFN-NXTQRVMMSA-N 375.516 5.854 30 20 GKED CC1(C)C[C@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)c2ccc(F)cc2O1 431289455 GSTHUNIBRZGIOR-PMACEKPBSA-N 395.478 5.162 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N(C)CC(C)(C)C#N 432851352 JPOCEAVZRHXINF-UHFFFAOYSA-N 385.895 5.241 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)N[C@@H](c1cc(F)ccc1F)C(F)F 433014868 HWAYQAFLHNFATQ-AWEZNQCLSA-N 394.290 5.198 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ncc(-c2ccccc2)s1 436150688 KMFZZMDNWIGVHA-RBUKOAKNSA-N 388.496 5.114 30 20 GKED CCCCOc1cccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 437851933 TXXRXPIGISYBNO-YADHBBJMSA-N 377.488 5.169 30 20 GKED Cc1cc(C)cc(C[C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 438038495 NMTOVXLQOHKTSZ-ROUUACIJSA-N 381.545 5.450 30 20 GKED C=CCN(C(=O)c1[nH]c2ccc(F)cc2c1Cl)c1nc2c(s1)CCCC2 444456215 WEFWPSDMSMWEJV-UHFFFAOYSA-N 389.883 5.129 30 20 GKED Cc1cc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)ccc1C#N 447289661 CTMXLXOOMFZWOH-UHFFFAOYSA-N 385.496 5.234 30 20 GKED C=CCC[C@H](NC(=O)N1CC[C@@H](OCC)[C@@H](C)C1)c1ccc(C(F)(F)F)cc1 454706464 KAXSTBTWQVFEAT-ZYSHUDEJSA-N 398.469 5.169 30 20 GKED C[C@H](c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1)C(F)(F)F 455507537 ALWYXCMYKGUSCT-CYBMUJFWSA-N 378.419 5.610 30 20 GKED CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H](C)c1cccc(OC)c1 458794261 ATBSYQHWTNQRAJ-XMSQKQJNSA-N 379.504 5.223 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccccc1)CC1CCC1)c1ccccc1 458801159 MTQSJUZUHHCYRX-QHCPKHFHSA-N 375.516 5.433 30 20 GKED N#Cc1ccsc1C(=O)N[C@@H](c1cc(F)ccc1F)c1ccccc1Cl 460558575 ZUNIIMUPQCOIRJ-QGZVFWFLSA-N 388.826 5.071 30 20 GKED CC[C@@H]1CCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 465158629 SBVKSBVLZMGRJJ-WIYYLYMNSA-N 377.488 5.032 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 467515990 CXJMNNAGWHOKDJ-FQEVSTJZSA-N 378.516 5.897 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1 476525198 PBDVHBNPBJTJOO-INIZCTEOSA-N 383.879 5.105 30 20 GKED C[C@H](N[C@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccc(C#N)cc1 479251148 JHAWRQKYKNQGTG-NWDGAFQWSA-N 397.238 5.751 30 20 GKED COc1ccccc1-c1cccc(NC(=O)C(C)(C)Oc2ccc(C#N)cc2)c1 482138446 OTPFUVIPHNAMLV-UHFFFAOYSA-N 386.451 5.030 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 482993359 MKSNQVWBWDPATM-UHFFFAOYSA-N 399.450 5.341 30 20 GKED N#CC[C@H](CC(=O)Nc1nc2c(C(F)(F)F)cccc2s1)c1ccccc1 483130689 PEEIGUZARGQTJV-CYBMUJFWSA-N 389.402 5.341 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cnc(-c2ccsc2)s1 486999104 SKJWTJRIFFRMRI-UHFFFAOYSA-N 380.947 5.415 30 20 GKED COc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)ccc1OC1CCCC1 487598035 XAFFJFCULFOVGX-NRFANRHFSA-N 392.499 5.182 30 20 GKED C=CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccc(F)cc1 488521106 UATNXYYFZHXXLK-UHFFFAOYSA-N 392.503 5.364 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N[C@@H](c1ccc(F)cc1)C(F)(F)F 489533057 WLSLIQSJOYMKTO-QHAMSDLMSA-N 385.323 5.304 30 20 GKED C=CCC[C@H](C(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1)c1ccccc1 489661535 CSSXLBZKJOLIQZ-QHCPKHFHSA-N 375.512 5.166 30 20 GKED Cc1nc(CNc2cccc(OCCCC#N)c2)oc1-c1ccc(Cl)cc1 489698762 PVJDTAJFAQGMKE-UHFFFAOYSA-N 381.863 5.598 30 20 GKED C=CCOc1ccc(C(=O)N(CC)[C@H](c2ccc(C)cc2)c2cccnc2)cc1 496447494 MDFFZBHTNKLOLS-XMMPIXPASA-N 386.495 5.207 30 20 GKED CC(C)CN(C(=O)CCCc1nc2ccccc2s1)c1ccc(C#N)cc1 499316994 BDZNKQZCYFYGSW-UHFFFAOYSA-N 377.513 5.180 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(C)(C)C)cc2)nnc1-c1cccnc1 499336797 AHSSGVUQORUJDF-MRXNPFEDSA-N 378.545 5.677 30 20 GKED CCCCn1c(SCCC#N)nc2scc(-c3ccc(F)cc3)c2c1=O 501326463 WDPDUCQYYLTMHF-UHFFFAOYSA-N 387.505 5.070 30 20 GKED Cc1cccc2sc(N(Cc3ccccc3)C(=O)Cc3ccc(C#N)cc3)nc12 504356526 XMJIXZWVPUWZSZ-UHFFFAOYSA-N 397.503 5.252 30 20 GKED Cc1ccc2c(CCC(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)c[nH]c2c1 505982031 PIKYLLLXWPABRP-LJQANCHMSA-N 386.282 5.097 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(C#N)cc2F)c2ccc(F)cc2)cc1 512644193 ZZADYIXHGHTEGN-NPMXOYFQSA-N 378.422 5.285 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc(Cl)cc2)cc1 513956267 XPKABJJYODEMGF-UHFFFAOYSA-N 393.849 5.585 30 20 GKED N#CCc1ccc(NC(=O)NCc2ccc(Oc3ccc(F)cc3)cc2)cc1 514504524 OTLLTKRCUCJYJC-UHFFFAOYSA-N 375.403 5.006 30 20 GKED C=CCC[C@H](NCc1cc(OC)c(O)c(OC)c1)c1ccc(C(F)(F)F)cc1 515093532 MFIULVPSHCSWKU-KRWDZBQOSA-N 395.421 5.225 30 20 GKED C=C(C)C[C@@H](C)c1nc(-c2ccc(C(F)(F)F)nc2OCC(F)(F)F)no1 516115734 ASHOAGAIZKUPTL-SECBINFHSA-N 395.303 5.161 30 20 GKED CCN(C[C@H](C)C#N)C(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 517351656 VPKWUKGXSCVGAS-KUHUBIRLSA-N 390.911 5.321 30 20 GKED C[C@H](NC(=O)Nc1ncc(Cc2ccccc2Cl)s1)c1ccc(C#N)cc1 520385968 FJSOUUVPAUDTTQ-ZDUSSCGKSA-N 396.903 5.142 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3coc(-c4ccccc4)n3)cc2)c1 523107702 KJEXEDQJMUMCES-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#C[C@@H](C(=O)c1cccc(Nc2ccccc2)c1)c1nc(-c2ccncc2)cs1 524931686 GLHOQZMMQRPEKK-FQEVSTJZSA-N 396.475 5.439 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(CC#N)cc2)cc1 534009140 NUNCANJXTKXJQK-UHFFFAOYSA-N 392.842 5.459 30 20 GKED C=CCN(C(=O)[C@@H]1CCO[C@H]1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 536123585 YBIVKODVHWZESR-WCQYABFASA-N 397.327 5.061 30 20 GKED N#Cc1ccc(CN2CCC(N[C@@H](c3ccccc3)c3ccc(F)cc3)CC2)cc1 538392912 HFTCMTVQPDYNIV-SANMLTNESA-N 399.513 5.041 30 20 GKED CN(C(=O)c1sccc1C#N)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 541252487 OXZJORSHOKLKPX-ZDUSSCGKSA-N 392.324 5.014 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1F 541467234 XHPXOTOFMYJNPD-UHFFFAOYSA-N 387.430 5.066 30 20 GKED N#Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1Cl 548631175 PAYZMOICNOEDIN-LBPRGKRZSA-N 399.809 5.103 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2nc(C(C)(C)C)cs2)sc2ccc(C#N)cc12 550380404 JPWLLHFIQIUULL-LBPRGKRZSA-N 383.542 5.326 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(Cc2ccccn2)ccc1C 555051312 FGDKUXMXQHANRN-UHFFFAOYSA-N 385.511 5.591 30 20 GKED N#CC1(CCCN[C@@H](c2ccc(F)cc2)c2ccccc2Cl)CCOCC1 558194877 KHEACVHWRXCONV-NRFANRHFSA-N 386.898 5.259 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)cc2)ccn1 564431621 GBFRYGXFGZEXRP-VXKWHMMOSA-N 382.423 5.169 30 20 GKED N#CCc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c(Cl)c1 576711063 SUBDPURQGMRSPJ-WAOWUJCRSA-N 379.891 5.206 30 20 GKED C=CCn1c([C@H]2CCO[C@@H]2C(C)(C)C)nnc1N1CCC[C@H]1c1ccc(C)cc1 576742856 HLNBJUQYMQIEEL-ACRUOGEOSA-N 394.563 5.033 30 20 GKED N#CCCCOc1cccc(NCc2cccc(Br)c2Cl)c1 600847683 NNVXNOJCXAJJFQ-UHFFFAOYSA-N 379.685 5.397 30 20 GKED Cc1nc2ccc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2nc1C 603968996 SXZDRNJHOZQFOH-UHFFFAOYSA-N 384.464 5.099 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC(F)F)[C@H]1CCc2ccccc21 609080960 QHSHRZLXTTVTEF-SFHVURJKSA-N 385.414 5.091 30 20 GKED CCCN(C(=O)CCCCOc1cccc(C#N)c1)[C@@H]1CCc2ccccc21 609499632 VYLBSOTWIVESBN-HSZRJFAPSA-N 376.500 5.033 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(C4CCCC4)CC3)cn2)c1 610321157 JEEFMZFLRBRUHA-UHFFFAOYSA-N 390.487 5.180 30 20 GKED CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(F)c(F)c1 619188266 GPKPQSDMXDRYML-UHFFFAOYSA-N 383.238 5.279 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)C1 665592599 WPQBPEHNAJVGGE-SFHVURJKSA-N 377.488 5.067 30 20 GKED Fc1ccc2c(c1)OCCC[C@@H]2NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 679768807 TZQRBNGSETVKBW-PGUXBMHVSA-N 399.350 5.539 30 20 GKED O=C(c1ccc(F)c2ccccc12)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 684566008 COYXCIXLFJGGQC-PHIMTYICSA-N 393.302 5.182 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccc(O)cc2)c2ccccc2)cc1Cl 726472193 KEXLIFOZKUJCTL-UHFFFAOYSA-N 393.899 5.321 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)n1 730684984 DUMXGGRTQONMAK-UNMCSNQZSA-N 390.508 5.572 30 20 GKED CCc1ccccc1O[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1ccccc1 730690269 QZZIZPSJBSUWKT-DVECYGJZSA-N 396.446 5.387 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3CCOc4ccccc43)n2)cc1 735594370 YDXYQNDEXVPTOD-MJGOQNOKSA-N 388.492 5.251 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1ccc(-c2ccccc2F)o1 741840895 GTJJCKJTYOHOGD-PKNBQFBNSA-N 384.378 5.146 30 20 GKED Cc1c(C(=O)/C=C\c2ccccc2OCC(F)(F)F)cnn1-c1ccccc1 741849696 ZOGDOEMYQQHAOI-QXMHVHEDSA-N 386.373 5.018 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 744035575 OGWDZFZMSWOEMG-INIZCTEOSA-N 397.931 5.593 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCc3ccc(F)cc3C2)cc1 771462710 LLLLFHAZARLTDT-HSZRJFAPSA-N 385.442 5.071 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2cc(OC)c(OC)c(OC)c2)cc1 776786544 YGEQQJLCWLXPNB-AWEZNQCLSA-N 377.868 5.017 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2)cc1Cl 786448792 XQYOCAFFBPUQGN-INIZCTEOSA-N 375.255 5.078 30 20 GKED CCCCn1ncc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1C(C)C 790351453 XQPOMINVMJRVLI-UHFFFAOYSA-N 375.929 5.141 30 20 GKED C=CCC(C)(C)C(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 796473985 NKIOZHHJIGDSNF-OAHLLOKOSA-N 381.497 5.350 30 20 GKED C[C@H](Cn1ccc2ccccc21)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 796809461 AJTDZBMYDUCAIE-CZUORRHYSA-N 393.899 5.417 30 20 GKED COc1cc(/C=C\C(=O)c2cccs2)c([N+](=O)[O-])cc1OCc1ccccc1 796974064 MVOVBMZJOBBXCU-KTKRTIGZSA-N 395.436 5.140 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566454 KGDJRSMVVWRSHB-OLZOCXBDSA-N 376.909 5.046 30 20 GKED C#CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 806426661 LCVNMLVXHILFBD-KRWDZBQOSA-N 389.524 5.025 30 20 GKED N#Cc1ccc2c(c1)C(=O)/C(=C/c1cccc(NC(=O)c3ccccc3Cl)c1)C2 811693222 GKUGRJLHJPQKME-VCHYOVAHSA-N 398.849 5.286 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)Nc3nc(Cl)c(C#N)s3)cs2)cc1 813370127 WDMYQRVHJFAMBY-UHFFFAOYSA-N 388.905 5.167 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc3c(F)ccc(F)c3c2)cc1 815010258 IKNLVOALCBGMDA-FQEVSTJZSA-N 399.400 5.421 30 20 GKED CC(C)(C)Sc1ccc(NCc2nnc(-c3ccc(C#N)cc3)o2)cc1F 834634243 UGOIUWKJQNQUND-UHFFFAOYSA-N 382.464 5.250 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC[C@]1(C)CC1(Cl)Cl 836387665 CKYIMSPEMQSVOJ-BLLLJJGKSA-N 386.348 5.176 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccccc2Cl)cc1 915086766 MNOSEBQDRQREEE-IBGZPJMESA-N 376.843 5.013 30 20 GKED CC(C)(C)c1ccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)cc1 916546388 OOVBZCSYUIRSRR-UHFFFAOYSA-N 384.936 5.404 30 20 GKED CC(CC1(C(=O)O)CCC1)=NNc1nc(C)nc2sc(-c3ccccc3)cc12 1776021331 SWTYXXHAXRFAHB-UHFFFAOYSA-N 394.500 5.100 30 20 GKED C=CCOc1c(Cl)cc(CNc2cc(C(=O)O)c3ccccc3c2)cc1OC 1776183397 FPVSYFLCRSPPEC-UHFFFAOYSA-N 397.858 5.377 30 20 GKED CCCCCCCOc1cccc(CNCc2c(F)cc(C(=O)O)cc2F)c1 1776787687 QUSNNUMGBAXHHA-UHFFFAOYSA-N 391.458 5.302 30 20 GKED COCc1ccccc1/C=C(C)/C=C1\CCCc2cc(C(=O)O)ccc2C1=O 1777237585 JCZCJELQQOIABT-BLAZZTHISA-N 376.452 5.080 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(C)c(C(=O)O)c2)cc1 1777472284 GMNWRIGTRGNYMD-ZROIWOOFSA-N 386.447 5.477 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2cccc(C)c2C)[n+]2ccccc2)c1 10168023 GSNDNBLNPFYSNO-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2cccc(CC)c2)cc1 10174502 MRVCCANLZWPWMA-UHFFFAOYSA-O 389.544 5.150 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1nc2ccccc2o1 54734250 WHSPWQHOVOCFCV-ZDUSSCGKSA-N 379.828 5.095 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1ccsc1 56800275 QTHWFJPQDNJEJW-UHFFFAOYSA-N 377.469 5.384 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccc(Br)cc2)ccc1OC 60926886 KCJAITRBVYINKG-HNNXBMFYSA-N 390.321 5.263 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1cccc(OCc2ccccc2C#N)c1 65621860 OQWOMOWMAAXESY-UHFFFAOYSA-N 396.899 5.124 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 66956272 MYVYKDZXIFLRKT-YLJYHZDGSA-N 379.529 5.758 30 20 GKED N#Cc1ccc(SCc2nc(-c3cccnc3Oc3ccccc3)no2)cc1 109572859 ZWGYUVOQEYIUCL-UHFFFAOYSA-N 386.436 5.088 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccccc2C(F)(F)F)c1 114634349 VCEMICRLNPGZCA-UHFFFAOYSA-N 396.368 5.408 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 120230369 MCXZQXLBHKZUAF-ZDUSSCGKSA-N 395.459 5.436 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nccs1 158612105 KESGWJPMWZAGIL-NRFANRHFSA-N 392.484 5.254 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 159280821 QCFWIPJMJMAZSS-VQIMIIECSA-N 382.533 5.338 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccccc1Cl 178861427 KGOBOMPSGRCYSL-LJQANCHMSA-N 382.250 5.050 30 20 GKED N#CCCCCSc1nnc(-c2ccccc2Cl)n1-c1ccccc1F 195533426 LPJMDBJEXFGMFE-UHFFFAOYSA-N 386.883 5.513 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1 246626999 AOBRUPKXFLWELY-HBFSDRIKSA-N 393.556 5.596 30 20 GKED CCCCCn1c(SCC(=O)Nc2ccc(CC#N)cc2)nc2ccccc21 302606785 UXQBTPZEEMRFEO-UHFFFAOYSA-N 392.528 5.023 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1cccc(Cl)c1Cl 303850574 OIAAMGVGTPGMKF-HFAKWTLXSA-N 397.664 5.270 30 20 GKED COc1ccc(/C(O)=N/[C@H]2CCOC3(CCCCC3)C2)cc1OC1CCCC1 329673030 UVLAYJXJTXBSQS-SFHVURJKSA-N 387.520 5.203 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@H]1CCCc2c(O)cccc21 330012842 LFWIVWUBKIDOQG-VQTJNVASSA-N 379.504 5.158 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)c1 412171135 TYVRQEFUXWGPOT-PWRODBHTSA-N 398.428 5.434 30 20 GKED CCCCn1c(SCCC2(C#N)CCCCC2)nnc1[C@@H](CC)N(C)C 412982990 LWYFVMIPGOSJGD-QGZVFWFLSA-N 377.602 5.047 30 20 GKED Cc1cnc(-c2ccccc2NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)[nH]1 427180517 ZBESDIPQVFVLBQ-UHFFFAOYSA-N 393.450 5.253 30 20 GKED N#CCCn1ncc(C(=O)Nc2cc(Cl)ccc2Cl)c1-c1ccccc1 428290863 XTUIXCBRJNNIGI-UHFFFAOYSA-N 385.254 5.023 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C)c1ccccc1 435601439 MNSYPBZFBGMLIH-HXUWFJFHSA-N 393.531 5.809 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443944617 FJBIUKVDWAVVBE-INIZCTEOSA-N 379.891 5.432 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@@H]4CCC[C@H]43)cc2F)c1 444389905 QYVDWUNLJAUCCM-GHTZIAJQSA-N 393.462 5.073 30 20 GKED C/C(=C/c1nc(COCC(F)(F)C(F)F)no1)c1ccccc1C(F)(F)F 445757853 IIBPIIUPMNJRBZ-TWGQIWQCSA-N 398.278 5.066 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cccc(CSC(C)C)c2C)c(OC)c1 460236066 ZNNMQIDDMLBWSB-UHFFFAOYSA-N 399.556 5.391 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 463748577 WDSQSUASMSMFTP-SGTLLEGYSA-N 379.262 5.082 30 20 GKED N#CCSc1cccc(C(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 467840092 PUHDSQVYWSQYEA-SHTZXODSSA-N 391.323 5.285 30 20 GKED CCC1(CC)Oc2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)cc2O1 470535640 GUEWNOUFUVOBFQ-UHFFFAOYSA-N 391.471 5.042 30 20 GKED N#CCSc1cccc(C(=O)NC2(c3c(Cl)cccc3Cl)CC2)c1 470750711 FOXXAZPVGHXPNV-UHFFFAOYSA-N 377.296 5.028 30 20 GKED Cc1ccc(-c2ncccc2NC(=O)CCCCOc2cccc(C#N)c2)s1 474522438 QUNHMDUBBDGJAV-UHFFFAOYSA-N 391.496 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)[C@H](COC)Cc1ccccc1 475576262 VNNJHUOMSOSYHW-QFIPXVFZSA-N 394.559 5.650 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476397025 KDBBPOAVXPEEOJ-LJQANCHMSA-N 386.451 5.514 30 20 GKED C=CCOc1ccccc1CNC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 477584320 CAURCFJJGYFQHA-QFIPXVFZSA-N 389.499 5.170 30 20 GKED C=CCCCC(=O)Nc1cc(NC(=O)c2cccc(C(F)(F)F)c2)ccc1C 479547020 UPSWSTZGAIWUND-UHFFFAOYSA-N 390.405 5.561 30 20 GKED CN(C(=O)c1sccc1C#N)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482785351 ZPRHNHSAZDFZIQ-SFHVURJKSA-N 384.863 5.274 30 20 GKED N#Cc1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)cc1Br 487837461 MGNKRWZNYARBQX-MRXNPFEDSA-N 388.265 5.063 30 20 GKED C=CCN1CCC(N[C@@H](c2cccc(SC)c2)c2ccc(F)c(F)c2)CC1 491034544 HIJJOYYMDRABQO-QFIPXVFZSA-N 388.527 5.016 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 498088561 KYLQUXQXLOURCM-HSZRJFAPSA-N 392.499 5.122 30 20 GKED N#Cc1c(NC(=O)Cc2ccc(OC(F)F)cc2)sc2c1CCCCCC2 515448922 CSFRNQZQXJZDIO-UHFFFAOYSA-N 390.455 5.061 30 20 GKED N#CCc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 515703835 BZXQODWWCRKQGK-DHIUTWEWSA-N 382.463 5.074 30 20 GKED CCC(C)(C)c1ccc(Oc2ccc(NC(=O)N3CCC(C#N)CC3)cc2)cc1 517898955 ZCEXVGQNFRVAAP-UHFFFAOYSA-N 391.515 5.934 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCc2cc(Cl)cc(Cl)c2)cc1 519990697 RFUDIQMEHBWAJN-UHFFFAOYSA-N 376.287 5.159 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 520924078 HYOUINZVLLJOHZ-KGLIPLIRSA-N 390.961 5.854 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1cc(F)c(Cl)cc1Cl 520931380 CGMHDGOPCRVZHS-CYBMUJFWSA-N 381.278 5.666 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccnc(Oc4ccccc4)c3)n2)cc1 523184428 BTNOYVJIQHAVKD-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1COc1ccccc1Cl 523283712 XVSCXQPYTJSZGE-HNNXBMFYSA-N 396.874 5.287 30 20 GKED C[C@@H]1CC(F)(F)CCN1C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 530013406 FHSDPDUYEVKWPI-CYBMUJFWSA-N 390.817 5.264 30 20 GKED Cc1cccc(-c2nc(C)c(C(=O)Nc3ccccc3S[C@H](C)CC#N)[nH]2)c1 533849548 CFGUXAAZYMGBSF-OAHLLOKOSA-N 390.512 5.340 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCC(F)(F)F)c1ccc(C(F)(F)F)cn1 536183977 QHJIVMSJVHWLDF-AWEZNQCLSA-N 386.295 5.085 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Br)c2ccccc12 538026272 FTBYQWVCECKJTI-UHFFFAOYSA-N 394.272 5.138 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c(C)c1 543862125 QLNRDMJKCFUMKD-CQSZACIVSA-N 392.446 5.622 30 20 GKED Cc1nc2cc(C(=O)N(CCC#N)c3ccc(F)cc3)ccc2n1-c1ccccc1 553821052 GNOBSIZRGWZVDC-UHFFFAOYSA-N 398.441 5.034 30 20 GKED Cc1sc(C2(NCc3ccc(F)cc3C#N)CCC2)nc1-c1ccccc1F 565728756 BFJDEFRNSNBDGH-UHFFFAOYSA-N 395.478 5.437 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)N1CCC(CCC#N)CC1 567815991 APPYWSVVLAOMSV-UHFFFAOYSA-N 393.535 5.026 30 20 GKED N#C[C@@]1(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)CC12CCCC2 571255212 YHYOXDSNCHFUPS-JOCHJYFZSA-N 379.891 5.365 30 20 GKED C[C@H](Oc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1)C(F)(F)F 579631861 APJQUAZDCCJJID-HOCLYGCPSA-N 376.378 5.042 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(-c2cccnc2)cc1 581758039 NAAPQNYELWFTAD-OAHLLOKOSA-N 381.401 5.490 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)N(Cc1ccccc1)c1ccccc1C#N 583039522 IQMRWBADXHAMMA-IBGZPJMESA-N 384.479 5.294 30 20 GKED COc1ccc(CN(C(=O)CCCCCC#N)[C@@H]2CCCC[C@@H]2C)cc1OC 588953906 OOABNQXFTJDTFI-AZUAARDMSA-N 386.536 5.085 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 590116387 CUJHHMQKMLSJJV-UTKZUKDTSA-N 391.540 5.840 30 20 GKED CC[C@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)[C@@H](C#N)c1ccccc1 595292414 XRMQWGFOOBQTGB-KXBFYZLASA-N 389.421 5.009 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1 604665561 NUPVLJIFIDKEBD-XMMPIXPASA-N 385.511 5.072 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 608891620 AEYFFRMVTCIZSU-LJQANCHMSA-N 381.907 5.649 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)o3)cc2Cl)c1 609063287 WLOFJBYBLQBIMF-UHFFFAOYSA-N 387.222 5.289 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)c(C(F)(F)F)c1 609377017 MTFPWNWPIBZKLH-NSHDSACASA-N 382.382 5.349 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434416 HGBUSDNGEYJJBH-HNNXBMFYSA-N 377.469 5.637 30 20 GKED CCSc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 609436264 HKFFWVVZIQDYKO-HOTGVXAUSA-N 399.585 6.076 30 20 GKED C=CC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 609506593 FHCFQGFRXQXTPA-UHFFFAOYSA-N 386.835 5.079 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CSc4ccccc43)cc2)cc1 609807705 KTUZLLBSNBGUMF-HXUWFJFHSA-N 387.464 5.319 30 20 GKED COc1ccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1Cc1ccccc1 610318117 MPKDHJAIKQZRHQ-KRWDZBQOSA-N 385.467 5.040 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(F)c2)cc1)c1cccc(C#N)c1 610321901 PJTYVUHCSUHHOP-HNNXBMFYSA-N 375.403 5.372 30 20 GKED N#Cc1ccc(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(F)c1 610930535 GFZILWVLVFNQKC-UHFFFAOYSA-N 376.275 5.025 30 20 GKED Cc1ccc(C)c(NC(=O)CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 611807136 KINHSVMNCGKFJK-LJQANCHMSA-N 383.495 5.131 30 20 GKED N#C[C@H](C(=O)c1ccccc1OCc1ccc(Cl)cc1Cl)c1ccccn1 612893516 SQKPQBISPGXUCZ-KRWDZBQOSA-N 397.261 5.457 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1ccc2ccccc2n1 613290288 BHFZTOQSPUXTPA-MRXNPFEDSA-N 389.867 5.502 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H]3CCc4cc(C#N)ccc43)s2)cc1 618806055 NIGFYEUBHJHXEG-LHSJRXKWSA-N 389.524 5.337 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)c(Cl)c1 619730733 FZPRZKGQCIJPIM-IAGOWNOFSA-N 383.278 5.326 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1Cl 642158426 UWZULGWTRSOKNR-MBTKJCJQSA-N 391.714 5.118 30 20 GKED Cc1ccccc1C1(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)CC1 727051261 WCCQNVNHCKKASW-CQSZACIVSA-N 394.446 5.305 30 20 GKED CCCCOc1ccc(C=NOCc2cc(-c3ccccc3)on2)cc1OC 727436486 BFLHCMCTLHFFNV-UHFFFAOYSA-N 380.444 5.080 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1nc2ccccc2s1 727952666 PANFBPYMAVPWCL-IBGZPJMESA-N 390.508 5.427 30 20 GKED COc1ccc(/C=C2\CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)c(Cl)c1OC 730433922 KFNZMYGAXCIFDD-RWIOWDNPSA-N 399.830 5.095 30 20 GKED N#C[C@H](C(=O)CC1CCC(c2ccccc2)CC1)c1nc2cc(F)ccc2s1 731138627 WSHUKXCWYMTJBW-GXOAENINSA-N 392.499 5.976 30 20 GKED O=C(/C=C/c1ncc(-c2ccc(Br)cc2)[nH]1)c1cc2ccccc2o1 732714404 ZIQURDQKXZHYSE-MDZDMXLPSA-N 393.240 5.482 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNc1ccc(OC(F)(F)F)cc1 732923585 FMDULDXIUHMSAH-UHFFFAOYSA-N 380.700 5.286 30 20 GKED C=CC[C@@H](NC(=O)Nc1cc2oc3ccccc3c2cc1OC)c1ccncc1 734516484 XMGKBTIVFORWPP-GOSISDBHSA-N 387.439 5.429 30 20 GKED CCOc1ccc(C(C)=O)cc1CSCc1cc(Cl)ccc1OCC#N 735318024 HZZHVQMHOBMUOJ-UHFFFAOYSA-N 389.904 5.277 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1)c1ccncc1 735386750 QACKBSCOJLDCAP-LEWJYISDSA-N 383.923 5.679 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(Br)c2)c(SC)cc1OC 741165090 GNPSKAMOMNXBSI-FPLPWBNLSA-N 393.302 5.084 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 744015132 GXGPCQUEPKOWKW-GPZRYRNASA-N 380.369 5.533 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)s1 748684047 UDDPTIIVALDLGY-CQSZACIVSA-N 394.452 5.124 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H](c2cccc(Cl)c2)C(C)C)c1 749389574 DZZNQWWGFHWFFZ-CTNGQTDRSA-N 384.907 5.077 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3c[nH]c4cc(F)ccc34)cs2)c1 749453765 VHOYXSGPOCOVAS-VURMDHGXSA-N 378.428 5.335 30 20 GKED CCCOc1ccc(-c2nc(C(=O)OCC3CCC(C#N)CC3)cs2)cc1 755970315 VKFMIODGSBHCJE-UHFFFAOYSA-N 384.501 5.086 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 758398901 XDZBCJXSCXWBKU-SFHVURJKSA-N 391.512 5.252 30 20 GKED C=CCC(CC=C)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 759012725 YJEOMEIWLXTCPD-SNVBAGLBSA-N 390.694 5.285 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)OC3CCCCCC3)n2)cc1 761048964 OMLAIUSZRDLPPV-VQIMIIECSA-N 382.529 5.423 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1Br)c1ccc2ccccc2n1 766236060 CGDSQGIJKSRPOD-QGZVFWFLSA-N 393.284 5.196 30 20 GKED Cc1sc2ncn(N=CCCCc3ccc(Cl)c(Cl)c3)c(=O)c2c1C 768768723 PUTKZDBNAWMXQD-UHFFFAOYSA-N 394.327 5.238 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccccc1 773076376 NCBBXRKANPYSJU-XXBNENTESA-N 375.516 5.298 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCO1 777566393 RWVDAFNXPPHIDO-YTFSRNRJSA-N 391.515 5.057 30 20 GKED C=CC[C@H](C(=O)Nc1cccc2c1CCN2C(=O)OC(C)(C)C)c1ccccc1 777731453 IKLCLTARVSLNLB-SFHVURJKSA-N 392.499 5.283 30 20 GKED N#CCOc1cccc(NCc2cccc(NC(=O)c3ccccc3Cl)c2)c1 779587610 DDTKIHTYZWRELX-UHFFFAOYSA-N 391.858 5.107 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)[C@H](C#N)c2nc3ccccc3s2)c1 780300709 CJEIUOUBRAXTFF-KRWDZBQOSA-N 378.497 5.374 30 20 GKED N#Cc1cccc([C@H](NCc2ccc(-c3ccccc3C#N)cc2)C(F)(F)F)c1 783670941 AGFKPNOTKDXUJH-QFIPXVFZSA-N 391.396 5.490 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cnn(Cc2ccccc2)c1Cl 789035009 VEYPTFRNEMTWIP-UHFFFAOYSA-N 379.769 5.017 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)c(Cl)cc2F)c1 799243429 ZYEMHVPEOWYBQE-GFCCVEGCSA-N 396.249 5.135 30 20 GKED N#CC1(CCCOC(=O)c2sc3cccc(Cl)c3c2Cl)CCOCC1 800127235 PIBMGNQPECJKIV-UHFFFAOYSA-N 398.311 5.465 30 20 GKED N#CC1(c2ccc(COC(=O)[C@@H](F)c3ccc(C(F)(F)F)cc3)cc2)CC1 801689494 MYSDJRKRFGQKRH-KRWDZBQOSA-N 377.337 5.015 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)[C@H](C)Cc2cncc3ccccc23)c1 808365288 PJXPGZHLIKBKLV-LJQANCHMSA-N 394.474 5.221 30 20 GKED COc1cc(/C=C2\C(=O)c3cccc(C)c3[C@@H]2C)cc(OC)c1OCC(F)F 809157270 JEUNECNBRUQQMH-KHAFMBKQSA-N 388.410 5.040 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](N[C@@H]1CCC[C@H](C#N)C1)CC(C)(C)O2 810258232 SLTCQLXTNPDKJP-FRQCXROJSA-N 399.535 5.308 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(Cl)cc1F 813212715 GEUQIBVEJJTAEJ-LBPRGKRZSA-N 384.760 5.047 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCCc3ccc(SC)cc32)ccc1OC 842852103 JRCQJUYBSMVXGA-RXVVDRJESA-N 396.556 5.265 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2nc(-c3ccccc3)cs2)cc1 915863163 UKMGOYUVZDRSHY-NRFANRHFSA-N 395.487 5.718 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=S)Nc1cccc(COc2ccc(CC#N)cc2)c1 916026316 XERBEZQJVLJOOV-VGOFRKELSA-N 393.556 5.197 30 20 GKED CC(C)(C)c1ccc(SCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 916847897 TVPXOUSYTNHHDU-MRXNPFEDSA-N 380.538 5.562 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 916906134 RHNPBFBSFMLWNS-WIYYLYMNSA-N 398.462 5.320 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026891 RTDUAJOECYAREX-JXFKEZNVSA-N 390.508 5.577 30 20 GKED CCCCS[C@H](C)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 918492986 YKEMFMFHJQHABZ-PWSUYJOCSA-N 386.464 5.413 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 919910060 KGQMJLXFRILNTF-OAHLLOKOSA-N 377.469 5.603 30 20 GKED C=CC(=O)Nc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 920017373 OFGBROJYOFIRCF-UHFFFAOYSA-N 397.434 5.036 30 20 GKED CCCCCOc1cc(C=NNc2ccc(Cl)c(C(=O)O)c2)ccc1OC 1776033378 VKMCZOIYIHWACT-UHFFFAOYSA-N 390.867 5.062 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2cccc(SCc3ccccc3)c2)C1 1776155726 RPBSDZSDCJDFPD-QHCPKHFHSA-N 381.541 5.222 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1/CCc2occ(C(=O)O)c2C1=O 1776199794 AKOUVOXVHQDBCP-PHRMNRNWSA-N 376.330 5.155 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1 1776785463 CPXAOUPDLDTCKJ-VBKFSLOCSA-N 394.511 6.329 30 20 GKED Cc1cc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)sc1Br 1777418491 NPETVMHRHZGZIB-SNAWJCMRSA-N 385.666 5.067 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1777566789 IQJPBIQIRXBYBY-PDGQHHTCSA-N 385.444 5.197 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3[nH]c4ccc(Cl)cc4c3C2=O)c(Cl)c1 1777673288 KMDCNTMFUIHFSN-XFFZJAGNSA-N 386.234 5.385 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C(C)C)cc2)=C(\S)NC2CCCCC2)c1 27329538 PJGUADOOLRFIGA-UHFFFAOYSA-O 395.592 5.267 30 20 GKED Cc1[nH]c2c(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cccc2c1C 41556907 CTQXPOLNQXVKHL-HNNXBMFYSA-N 378.382 5.020 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(OCC)c(OCC)c1 43118699 VZKJLSAZFPNOIA-INIZCTEOSA-N 388.533 5.004 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(Cl)cc1 54466131 XHESATHBZXTVDP-CQSZACIVSA-N 387.817 5.239 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1csc(-c2ccc(Cl)cc2)n1 62903494 SGASNHIQHKTIKA-UHFFFAOYSA-N 393.899 5.164 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccco1 108528604 ZBMYMVYKLDWMMT-KKSFZXQISA-N 391.496 5.442 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@H](CCC#N)c1ccccc1 121362986 LDXLOIRWOQWJNP-WMZHIEFXSA-N 390.531 5.540 30 20 GKED N#C[C@H](C(=O)CCOCc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 125660773 MUOIIQKBDSUSGV-GOSISDBHSA-N 396.899 5.247 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc(-c2ccncc2)cs1 128893813 OQCFWAWNZUSBTF-OAQYLSRUSA-N 393.471 5.266 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 129676349 RYBZJIUPNWRVNG-ZDUSSCGKSA-N 391.899 5.537 30 20 GKED CC[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1nccs1 131016613 VHIUKGGDRKWNGV-MRXNPFEDSA-N 379.510 5.047 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 151402679 UVEILNNPXDTBAJ-FDDCHVKYSA-N 384.483 5.154 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(CC#N)cc2)c1 172697441 GFDNCIHAJMOHTG-UHFFFAOYSA-N 383.879 5.033 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)Nc1ccccc1O[C@H](C)C#N 182084463 UPCPBZAGEJHSBE-GOSISDBHSA-N 386.451 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1(c2ccccc2)CCOCC1 191440320 OZYCPDRWWUEMOM-UHFFFAOYSA-N 392.543 5.408 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCS1 192225274 CUMVAQSDISIZEK-HNAYVOBHSA-N 399.947 5.355 30 20 GKED CC(C)N(C(=O)c1ccccc1OCC#N)c1ccc(Nc2ccccc2)cc1 193915563 VTINNBJCDZIGKF-UHFFFAOYSA-N 385.467 5.388 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3scnc3C(F)(F)F)c2C#N)[C@H](C)C1 297938900 UBRSZVRERVKWAQ-JGVFFNPUSA-N 385.436 5.033 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1 417625006 LFAGWVWEVVAOMR-INIZCTEOSA-N 379.378 5.007 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(-c2ccncc2)cc1 426157824 YKMWCRLFDVQGNQ-AWEZNQCLSA-N 376.847 5.156 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1ccccc1OC1CCCC1)c1ccccc1 431810198 HHFYKAQDCNKALG-JOCHJYFZSA-N 391.515 5.242 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 433422922 SQCWCGCXFQSMDH-JNKARSBBSA-N 392.421 5.044 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=O)N[C@@H](CCC#N)c1ccccc1 438834548 AAFKQEVILCNXQL-SFHVURJKSA-N 376.287 5.180 30 20 GKED C[C@H](c1cc(F)ccc1F)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443949183 OHUJWPLMZLXVJG-OAHLLOKOSA-N 381.426 5.056 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1 450883751 QNBDBTLVGKLDET-DYVFJYSZSA-N 384.892 5.024 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H](Cc2ccccc2)C1)c1ccccc1 458795352 CKYHTVBGGRJFCS-FYYLOGMGSA-N 375.516 5.086 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=O)N[C@H](CCCC#N)c1ccccc1 458797076 FXTCLCMJLITHOG-GOSISDBHSA-N 390.314 5.570 30 20 GKED C[C@@H](C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 461916919 AOMFYUZXMZYDTE-VLIAUNLRSA-N 380.900 5.282 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H]2CCc2ccccc2)c2ccccc21 469028263 SWXNNKHQDFGDGG-NRFANRHFSA-N 385.511 5.182 30 20 GKED C=CCN(C(=O)c1sc(CC2CC2)nc1C)c1nc(-c2ccccc2)cs1 475465887 CATMLOAKMLQZJP-UHFFFAOYSA-N 395.553 5.360 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2cccc(SCC#N)c2)o1 477928260 ROEKXGBYWSJYME-UHFFFAOYSA-N 382.872 5.776 30 20 GKED C=CCC1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CCC1 480446776 MBXYZHWUOJFZCN-UHFFFAOYSA-N 386.854 5.416 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)N[C@H](C#N)c1ccc(Cl)cc1 480813634 CZAARQUFMVHONT-CQSZACIVSA-N 398.087 5.059 30 20 GKED C=C(C)[C@@H](N[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)c(F)c1 481604917 MZKQEUNHZYCZDR-IFXJQAMLSA-N 392.877 5.469 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCCCC[C@H]1c1ccncc1)c1ccc(F)c(F)c1 483312206 GZXCBOMGZMVBRE-LEWJYISDSA-N 385.458 5.304 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C(C)C 484148575 URHREOLMOCTWCF-MRXNPFEDSA-N 399.564 5.845 30 20 GKED CCCCn1ncc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1C(C)C 485160643 PKEXUKJQVRNJMA-UHFFFAOYSA-N 395.551 5.368 30 20 GKED N#Cc1ccc(F)c(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)c1 486428711 ZTMPEZJDHRCAII-UHFFFAOYSA-N 397.812 5.354 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N(C)CC(C)(C)C#N 497362834 FLOHBPQDBHIUBQ-UHFFFAOYSA-N 394.302 5.394 30 20 GKED COc1ccc(C#N)cc1NCc1cccc(NC(=O)c2ccccc2Cl)c1 500979174 HEROGZHYVOLRCZ-UHFFFAOYSA-N 391.858 5.085 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 503631133 UENFYHDYZOZBBZ-KRWDZBQOSA-N 375.472 5.057 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1 505970020 FPEIQJSYDYBYEE-OAHLLOKOSA-N 385.703 5.363 30 20 GKED CC1(C#N)CCN(C(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 507824518 JMZPMXBATLJYAD-OAQYLSRUSA-N 398.959 5.315 30 20 GKED CCN(C(=O)c1cc2cc(Br)ccc2[nH]1)[C@@H](C)c1ccc(C#N)cc1 509573467 RPPZDWQBFMCWAJ-ZDUSSCGKSA-N 396.288 5.025 30 20 GKED Cc1ccc(-n2cc(C(=O)[C@H](C#N)c3nc(C)cs3)c(-c3ccccc3)n2)cc1 513681868 KXYZMMZOYRAUPH-IBGZPJMESA-N 398.491 5.103 30 20 GKED Cc1cnn(-c2ccc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2)c1 515691462 IEMRNUOHEBFUGN-UHFFFAOYSA-N 384.464 5.033 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 516307050 IVACTIJWLVSECN-SJORKVTESA-N 389.524 5.750 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3SC[C@H](C)C#N)c2cc1C 519424790 HLSSWLWXLNYIIA-CQSZACIVSA-N 378.497 5.483 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 520877419 ABFJEVKEWWXQNA-XZOQPEGZSA-N 386.451 5.066 30 20 GKED Cc1ccccc1Oc1ccccc1CNC(=O)N(C)Cc1cccc(C#N)c1 521609610 ZTZJNTFMZBPEQG-UHFFFAOYSA-N 385.467 5.001 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)Cc1ccc(C(=O)Nc2ccccc2)cc1 521821769 VCIGLNJWEWSAQV-UHFFFAOYSA-N 383.495 5.221 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 523534190 TVTHKLVCFVUKAM-XMMPIXPASA-N 399.494 5.553 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H](C)CC1 524441002 MTLUAASJSVAAQP-QGZVFWFLSA-N 377.488 5.100 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1c(C)noc1C 536033585 YPWZLHXNQKAGKP-OAQYLSRUSA-N 389.455 5.031 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 536935093 MQUQEOUKIGLIIZ-QAPCUYQASA-N 397.400 5.196 30 20 GKED C[C@H]1c2cc(Cl)c(Cl)cc2CCN1Cc1nnc(-c2cccc(C#N)c2)o1 540054572 XXZMCTCWMIBJTA-LBPRGKRZSA-N 399.281 5.034 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 541188866 RWYGJAIJKUGMAS-IBGZPJMESA-N 388.492 5.296 30 20 GKED CC(=O)c1ccc(F)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 541412223 YHTYELGWEUSVDT-UHFFFAOYSA-N 390.439 5.303 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)N3CCC(CC#N)CC3)cc2)c(C)c1 541973104 KOYPWVWFAHOYNH-UHFFFAOYSA-N 379.529 5.612 30 20 GKED CSCc1ccccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 545356025 AKBLPWDIJXQUJG-UHFFFAOYSA-N 388.492 5.253 30 20 GKED CCCCC[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 579695902 CNIMOPUMFIBPOV-IBGZPJMESA-N 378.476 5.322 30 20 GKED O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1cc(F)cc(C(F)(F)F)c1 581334148 KHRZOCPZPZMLAM-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)C(F)(F)F 584251982 OJFSBSGWLZUUPH-ZDUSSCGKSA-N 376.378 5.070 30 20 GKED C[C@H](N[C@H](C)c1nccc2ccccc12)c1ccc(-c2cccc(C#N)c2)cc1 589343925 ICGPMQUWYJRLNQ-RBUKOAKNSA-N 377.491 6.185 30 20 GKED Cc1ccc(-c2csc3ncnc(SC[C@@H](O)CC(C)(C)C#N)c23)cc1 598705134 ZEMMFEUFJYOSEG-HNNXBMFYSA-N 383.542 5.060 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601187258 JFIGSFKGTFNCSJ-UHFFFAOYSA-N 387.458 5.063 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCC1 609399442 XGAVAARHFWIGCC-OAHLLOKOSA-N 383.492 5.278 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H]2c2cccc(Cl)c2)c1 609515945 UZRXNELTVRZJNH-OAQYLSRUSA-N 382.891 5.124 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)c2cccc(COc3ccccc3C#N)c2)cc1 609982274 MQEGWAQHCQIJOM-HXUWFJFHSA-N 398.506 5.149 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](CC1CC1)c1ccccc1 611395731 RQUKUQZAUFIZJP-LAUBAEHRSA-N 393.556 5.150 30 20 GKED N#Cc1cc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)ccc1F 611434531 UGKJDVLUYZNDKW-GOSISDBHSA-N 382.788 5.610 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 614482578 KEFWAOORCLDZQW-UHFFFAOYSA-N 381.497 5.153 30 20 GKED CC(C)(CNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 622583840 HIOYFVQRIOXGMG-UHFFFAOYSA-N 381.238 5.043 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc(Cl)c1Br 647379710 GXOWIUFQVBVIGK-NSHDSACASA-N 395.709 5.235 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(-c2ccc(Cl)cc2)s1 728699295 FPLWIOYSKDFMLA-VMPITWQZSA-N 396.821 5.723 30 20 GKED O=C(Nc1cccc(C=NNCCCc2ccccc2)c1)c1ccccc1Cl 729148167 QBXYVDPBZVDUCA-UHFFFAOYSA-N 391.902 5.149 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 730071675 QHCYDNIPUDKCNH-AEFFLSMTSA-N 378.497 5.454 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cccc(OC2CCCC2)c1 731287826 KTBALFSIHIEYJP-HXUWFJFHSA-N 386.451 5.003 30 20 GKED N#CCOc1ccc(CC(=O)N(Cc2ccc(Cl)cc2)c2ccccc2)cc1 731979156 IZTAUMHQOBIORD-UHFFFAOYSA-N 390.870 5.018 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 734965171 IICUPUMTPSFDGX-HNAYVOBHSA-N 394.927 6.142 30 20 GKED N#C[C@H](C(=O)CC/C=C/c1ccccc1)C(=O)Nc1cc(Cl)cc(Cl)c1 739156420 WZOLSPPQVXXOJG-SBLNNXNXSA-N 387.266 5.134 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)NCc3cc4ccccc4o3)c2)s1 740030173 DURGHZFLIARNTM-UHFFFAOYSA-N 387.464 5.032 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cc(F)c(F)c(F)c3)c2)s1 741400806 JRSAJRXCRXODGF-UHFFFAOYSA-N 387.386 5.026 30 20 GKED N#CCC1(COC(=O)[C@H](Oc2cccc(Cl)c2Cl)c2ccccc2)CC1 744275378 DEOSHUJYUOYWJP-GOSISDBHSA-N 390.266 5.351 30 20 GKED FC(F)Sc1ccc2c(c1)CCCC2=NNc1ncnc2sccc12 750934483 FCLQDVQEEVAVAA-UHFFFAOYSA-N 376.457 5.159 30 20 GKED C#CC[C@H](OC(=O)CCSc1ccnc2cc(Cl)ccc12)c1ccccn1 751834343 BHGKEGVDVIHLAV-IBGZPJMESA-N 396.899 5.073 30 20 GKED CCc1cnc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 753568701 AGUASKVKEBCBJT-UHFFFAOYSA-N 383.904 5.422 30 20 GKED N#C[C@@H](C(=O)CCn1ccc2cc(Cl)ccc21)c1nc2ccccc2s1 759182065 DCJDNSIAWQSEBU-HNNXBMFYSA-N 379.872 5.171 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)Nc2cccc(OCC#N)c2)cc1 763926453 QHGGUOMIKRIACZ-JOCHJYFZSA-N 377.488 5.471 30 20 GKED C=C[C@@H](CC(=O)N(c1ccc(N(C)C)cc1)[C@H](C)c1ccccn1)c1ccccc1 766589577 ZGEIQLDDXFUINI-RTWAWAEBSA-N 399.538 5.602 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C/c1scnc1C 776772934 SZNSKHWDHBRFJJ-MDZDMXLPSA-N 391.471 5.017 30 20 GKED N#CCCCOc1cccc(CNc2cc(F)c(N3CCCCC3)c(F)c2)c1 778646863 LLCCCXLWPCNKOX-UHFFFAOYSA-N 385.458 5.250 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cc(Cl)cs1 782144113 VIHBJPMCPSJKRW-UHFFFAOYSA-N 385.901 5.031 30 20 GKED COc1cc(C2SCCS2)ccc1OCc1ccc(C#N)cc1Cl 783984741 QPJLMTDZNCQXJT-UHFFFAOYSA-N 377.918 5.278 30 20 GKED CSc1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccccc2)cc1F 788354676 GXORQRQKLBDCBM-CSKARUKUSA-N 391.471 5.221 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)c(F)c2)cc1 790544744 YYXQRGONXFAZGO-IBGZPJMESA-N 378.834 5.316 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ncsc2C(F)(F)F)cc1 792058363 UVOAKBQOSPBBSW-OAHLLOKOSA-N 387.386 5.070 30 20 GKED Cc1cc(C)c(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1C=O 793100911 GRURIVJLMJWLNS-UHFFFAOYSA-N 398.462 5.013 30 20 GKED N#CC[C@H](CC(=O)O[C@@H](Cc1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 796672743 AXSIKRGNTZFSLB-AEFFLSMTSA-N 395.808 5.444 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 796695015 ZHCMCLDANGHUAB-UGSOOPFHSA-N 390.439 5.232 30 20 GKED N#C[C@H](C(=O)[C@H]1CC[C@@H](C(F)(F)F)C1)c1nc(-c2ccc(Cl)cc2)cs1 796799390 TXMFGZNPWDFOBE-OUCADQQQSA-N 398.837 5.618 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567719 ASCQJSFEACFVKO-YOEHRIQHSA-N 378.497 5.238 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(Br)c1Cl 801946562 PLDUMQSLOOVKQX-JTQLQIEISA-N 394.656 5.037 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)ccc2c1 813216885 HLSPVSBKUVXXID-CZXUKVBWSA-N 396.368 5.152 30 20 GKED Cc1nc(C(C)C)oc1COC(=O)c1ccccc1Oc1ccccc1C#N 813227857 VWNINCHEAMLZRC-UHFFFAOYSA-N 376.412 5.127 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CON=Cc1cccc(Cl)c1Cl 821455760 WUIGVJZCYLWHIZ-UHFFFAOYSA-N 379.287 5.414 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842940498 BGWMYZVAIXDREE-MELADBBJSA-N 377.296 5.307 30 20 GKED Cc1ccc(-c2noc([C@H](N)CCCCC#N)n2)c(Sc2ccccc2)c1 848627301 XATKRDVUEUHBBJ-GOSISDBHSA-N 378.501 5.280 30 20 GKED COc1ccc(-c2nc(/C=C3\CCOc4ccc(F)cc4C3=O)cs2)cc1 861415473 CJSONGOSLBKJAI-GXDHUFHOSA-N 381.428 5.007 30 20 GKED C=CC(C)(C)CCCNCc1csc(N(C(C)=O)c2ccc(F)cc2F)n1 877804042 MPLWBEDAEHYGDE-UHFFFAOYSA-N 393.503 5.188 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3ccccc3F)o2)cc1 915087304 RQVGDZZINQHKEP-NRFANRHFSA-N 396.421 5.993 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccccc3)CCCC2)cc1 915179351 CJGJBJWJNWTUIO-XMMPIXPASA-N 380.491 5.793 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1cc2c(s1)CCCCCC2 916882941 MLRAJALORWPOKI-MRXNPFEDSA-N 386.904 5.022 30 20 GKED N#C[C@@H](C(=O)Cc1cccs1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917031029 OBHHXSJCWDYDOP-WRQGHLQJSA-N 382.554 5.091 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804237 MQTBBJKTAXTIAR-UKRRQHHQSA-N 382.435 5.458 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C=NNc3ccc(F)c(C(=O)O)c3)o2)cc1 1776062424 SZTJDFMOYANFIJ-UHFFFAOYSA-N 380.419 5.527 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776125303 CULDCVMQOKVEJO-WZUFQYTHSA-N 378.424 5.596 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)c1 1776341520 XDZWXHGEIDOVSB-YFHOEESVSA-N 390.435 5.445 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1)C(=O)O 1776469778 JZAPTIORBUIVIP-VCFDLTMXSA-N 398.764 5.107 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc2ccccc2n1C(F)F 51656215 KXSAEEZPEICJGW-ZDUSSCGKSA-N 394.406 5.045 30 20 GKED O/C(=N\c1nc(-c2ccc(Br)cc2)n[nH]1)c1ccc2ccccc2c1 63497491 PCRAWWJUMKBUBN-UHFFFAOYSA-N 393.244 5.024 30 20 GKED C=CCc1cc(C(=O)Nc2cc(Cl)ccc2OCCC)cc(OC)c1OC 108355483 XVEGHTBSXLYJMX-UHFFFAOYSA-N 389.879 5.127 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H](C)c2ccco2)cc1 123524389 PUXXIVUUMLDJIX-HNNXBMFYSA-N 391.427 5.177 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C/SCc1ccco1 132004025 AHAVFNPMYJVQRC-DHZHZOJOSA-N 391.452 5.033 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCc4ccsc4C3)cc2)c1 132174343 NYWLXIAJQJPDCX-UHFFFAOYSA-N 375.453 5.002 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 183836128 SGZQDRAEAQWVGR-MRXNPFEDSA-N 398.422 5.285 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(CC2CCCC2)CC1 191480749 WDBLQUSAIPAWDT-UHFFFAOYSA-N 383.580 5.315 30 20 GKED Cc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c(Cl)c1 191557462 JDXOSDPGXVRHIA-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C=CCn1c(SCc2ccc(OC(F)F)cc2)nnc1-c1ccccc1F 195593724 FITJFSPZPDPQEK-UHFFFAOYSA-N 391.418 5.164 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccccc2OCc2ccccc2)c1 237022112 FJBRMLBRZCOQJX-QHCPKHFHSA-N 386.495 5.236 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(C2SCCS2)c1 272530455 MRYFJKGTTLHFFA-ZDUSSCGKSA-N 385.514 5.100 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)c1ccc(F)cc1 303364335 IBKJRLHGKTVTKX-OAHLLOKOSA-N 385.508 5.177 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CSc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 303734784 WNLGSGYENXHTRH-JKSUJKDBSA-N 396.924 5.529 30 20 GKED C=CCCCN(C)C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1 303750353 FHBZJDJMDNNGPN-UHFFFAOYSA-N 381.307 5.226 30 20 GKED Cc1cc(N2CCCCCC2)ccc1N/C(O)=N/[C@@H]1CCO[C@H](C(C)(C)C)C1 329253891 WNIYUWKDDBTXPU-NQIIRXRSSA-N 387.568 5.295 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 360641794 LNKYWDFNQMSWGX-RQBCQMOYSA-N 392.421 5.065 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(COC2CCCC2)cc1 425646562 BWSQUYRYNYUSGZ-KRWDZBQOSA-N 377.488 5.242 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1)c1ccccc1 431330218 FZBFXYNFCJDDDV-HJNYFJLDSA-N 379.479 5.196 30 20 GKED Cc1ccc(Br)cc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432675089 ICEOXVDLBMVYRN-KRWDZBQOSA-N 386.293 5.314 30 20 GKED C[C@H](NC(=O)CCSc1ccnc2cc(Cl)ccc12)c1ccc(C#N)cc1 433862897 OQNQXVCBKPLLOX-AWEZNQCLSA-N 395.915 5.119 30 20 GKED COc1ccc2cc([C@H](C)SCC(=O)Nc3cccc(C#N)c3)ccc2c1 438798974 ZOMJNETZXJOANW-HNNXBMFYSA-N 376.481 5.153 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1[N+](=O)[O-] 439644823 ILJNNKYDALYTCV-CQSZACIVSA-N 399.859 5.471 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)c3ccccc3n2)cc1C(F)(F)F 448549536 BDTLXTPEZSEQRS-UHFFFAOYSA-N 375.737 5.031 30 20 GKED C[C@@H](O)CCCN[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 450722255 ZZFISSZKPCOSDZ-PRHODGIISA-N 397.281 5.078 30 20 GKED C[C@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCCC(C)(C)C#N)nnc1-c1ccco1 463035115 HAOZXWXIKFRKQA-LTIDMASMSA-N 384.549 5.567 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1)c1ccc(C#N)cc1 463406341 VHAKMIREMUSXQR-AWEZNQCLSA-N 393.849 5.776 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 464715486 YALFYHFISJHOJB-IBGZPJMESA-N 396.487 5.532 30 20 GKED C=CC[C@H](C)NC(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466250373 OWTVYTRSVSJVFS-ORAYPTAESA-N 376.472 5.040 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1cc(F)ccc1F)C(F)F 470121682 LAKSANLYGWZOGG-SFHVURJKSA-N 380.385 5.059 30 20 GKED C[C@H](CNc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1 470144008 USMGQEPRULCETF-MRXNPFEDSA-N 381.907 5.139 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCN1CCc2ccccc2C1 475553384 OUPVPYWPBBVDFU-UHFFFAOYSA-N 391.559 5.108 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 475664434 YNYLQULZOSFMKU-JKSUJKDBSA-N 383.923 5.797 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc2ccc(OC)cc2c1C 476136505 FYCHCCYYJWTFJT-UHFFFAOYSA-N 379.525 6.323 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1ccc(F)c(F)c1 477740734 CNTMYFUYKBCJLI-COPCDDAFSA-N 395.453 5.063 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1csc(-c2cccc3ccccc23)n1 480543990 UAYMJUUAZAAMCR-UHFFFAOYSA-N 387.464 5.112 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(-c2ncco2)ccc1C)c1ccc(F)c(F)c1 480929724 QCXVVSRRDAJJSI-IBGZPJMESA-N 383.398 5.367 30 20 GKED COc1cc([C@@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)ccc1OC(C)C 481913358 NCOAWVSSMYGOHQ-VGSWGCGISA-N 378.516 5.472 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F 484045779 UJBPKMWPMJKYAP-MOPGFXCFSA-N 395.469 5.095 30 20 GKED COc1ccc(C#N)cc1CNC1(c2cc(C(F)(F)F)ccc2Cl)CC1 484983524 BJCPOOFBQNUJST-UHFFFAOYSA-N 380.797 5.018 30 20 GKED CC(C)c1csc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 486975608 JKMJFSVYJLMCKL-UHFFFAOYSA-N 393.537 5.683 30 20 GKED C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)o1 499837943 JIXPAYCJBBSOEO-QCPCCJPKSA-N 389.282 5.194 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 500546806 CQCCTTGYEZMHIY-UHFFFAOYSA-N 391.279 5.731 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2cccnc2)cc1)c1c(Cl)cccc1Cl 505507030 PLYQJXIDMJMYCH-SFHVURJKSA-N 398.249 5.175 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N3CCC(C)(C#N)CC3)c2)c1 507840945 MMOIFNFILYVHFH-UHFFFAOYSA-N 378.541 5.362 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(F)cc2)cc1Cl 510004165 HJKIYFJXUXDGPK-FQEVSTJZSA-N 393.849 5.456 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Cl)c3ncccc23)cc1C(F)(F)F 510053682 FOPRXYUMUXBSQR-UHFFFAOYSA-N 375.737 5.031 30 20 GKED CN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510648499 VSHHHHOWIHDUSI-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C=CCN(C(=O)CCc1cc2ccccc2o1)c1nc(-c2ccccc2)cs1 516071281 DPQMYBRVUFLBBS-UHFFFAOYSA-N 388.492 5.708 30 20 GKED C[C@@H]1CCc2sc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c(C#N)c2[C@@H]1C 517316977 SQRFCGJXWGYKTF-XJKCOSOUSA-N 378.497 5.004 30 20 GKED Cc1cc(C)n([C@H](C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 517734684 BDTFSGIOVQPKPU-UZLBHIALSA-N 392.890 5.009 30 20 GKED CSC[C@@](C)(C#N)NC(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 518003071 YGOSWHMBYZRGTL-GOSISDBHSA-N 395.311 5.161 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc2c(ccc3ccccc32)[nH]1 520827445 CWNWHNOGWRQJOC-HNNXBMFYSA-N 385.492 5.825 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(OC)cc1 521244515 QBUINVBIDFZJGD-UHFFFAOYSA-N 390.414 5.165 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 521492621 YEFVQZDLKYQHDB-UHFFFAOYSA-N 397.228 5.267 30 20 GKED COc1c(Cl)cccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 522311834 NBROKXISXRCDAY-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#Cc1ccc(Cl)cc1NCc1cccc(NC(=O)c2ccc(F)cc2)c1 522935748 IYNOLSLUEKFCMG-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1cc([C@H](NC(=O)Cc2ccc(C#N)cc2)c2ccccc2Cl)ccc1F 525080782 RBEDUVRLGKCSIG-QHCPKHFHSA-N 392.861 5.108 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 535374042 LJQXBKGMPQNCRZ-PMACEKPBSA-N 398.506 5.476 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)Nc2cccc(OCCCC#N)c2)c1 540646876 TWWCFYKHSNWFAK-UHFFFAOYSA-N 394.540 5.965 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccccc2OC2CCCC2)C2CC2)cc1 541419105 GRHOBVAKRRRWFM-UHFFFAOYSA-N 375.472 5.076 30 20 GKED C[C@@H](NCc1cnc(-c2ccccn2)s1)c1ccc(-c2cccc(C#N)c2)cc1 542019819 NPWUCYBBTIOMNF-QGZVFWFLSA-N 396.519 5.595 30 20 GKED COc1cc(C#N)ccc1NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1 546711234 WFYWXMVXXUAPCS-NRFANRHFSA-N 392.455 5.178 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1ccc2ncsc2c1 548599956 KSJWGUHESJTQOW-KBPBESRZSA-N 396.541 5.431 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3ccc(Cl)cc3)o2)CC1 548858462 BAKSRBJKVONUDI-UHFFFAOYSA-N 377.875 5.052 30 20 GKED Cc1ccsc1-c1nnc(SCc2ccc(Br)cc2C#N)o1 561434800 LDQCHIWVMVCHKD-UHFFFAOYSA-N 392.303 5.033 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)CC1 573114239 TZPYSVMEVJYJJT-QHCPKHFHSA-N 387.483 5.248 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@H](C)[C@@H](C)CC4)ccc12 574286688 ABFLQRDYWAXHEK-WCQYABFASA-N 391.496 5.120 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](F)(c2ccccc2)C1 576532174 HTENKYRIJJXMFQ-KKSFZXQISA-N 383.492 5.183 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@@H]1c1ccccc1 580131008 VPQCXHFVUGDNQW-OAQYLSRUSA-N 381.483 5.021 30 20 GKED N#CCc1ccnc(NCc2ccc(-c3ccccc3Br)s2)c1 580926532 LJXZFXUDFSFFKD-UHFFFAOYSA-N 384.302 5.251 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(-c2nc3ccccc3s2)o1 583076072 PRILTRGUWCLKGT-LJQANCHMSA-N 385.492 5.595 30 20 GKED CCOc1ccc(C[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 591173684 AZONBEZPWOZQML-IAGOWNOFSA-N 382.529 5.154 30 20 GKED C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccc(O[C@H](C)c2ccccc2)cc1 595750569 COLPFQXWNQPDHB-XUVXKRRUSA-N 391.515 5.223 30 20 GKED N#CC[C@H]1CCCN(C(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 597918495 PRBTVSVPMULIFQ-VGSWGCGISA-N 398.959 5.315 30 20 GKED Cc1ccccc1Oc1cc(F)cc(F)c1NC(=O)N1CCC(CC#N)CC1 598658032 LJVJDKLSGIUXCL-UHFFFAOYSA-N 385.414 5.223 30 20 GKED Cc1ccc(C)c(CC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 609060839 OIOWKDLVFKUDSH-UHFFFAOYSA-N 384.479 5.244 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 609432435 OFXPABDKJKJOPH-MRXNPFEDSA-N 389.430 5.237 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2ccc(C#N)cc2)nc1-c1ccccc1 610112845 DVLWXWWRUZJVCJ-FQEVSTJZSA-N 385.467 5.314 30 20 GKED COc1ccc(NC(=O)c2ccc(NCc3ccc(C(C)(C)C#N)cc3)cc2)cc1 614052827 DNEIFOZGHPLCPN-UHFFFAOYSA-N 399.494 5.361 30 20 GKED C=CCC1(C(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCCCC1 648139065 CSIZTSQORMBGGX-WDNDVIMCSA-N 385.392 5.539 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=S)Nc1ccccc1C#N 729164757 NMUCBZRYJWNDCM-ZDUSSCGKSA-N 396.516 5.177 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1[N+](=O)[O-] 730150900 YUVMLLQEDNMAIS-OQFOIZHKSA-N 398.415 5.071 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN(C)c1ccc2ccccc2c1 731028019 FGPNRXSHYVPRHG-KRWDZBQOSA-N 389.524 5.166 30 20 GKED N#C[C@@H](C(=O)CCCCCc1cccs1)C(=O)Nc1cccc2ccccc12 731545809 FGSGPIFEPOOCAE-FQEVSTJZSA-N 390.508 5.352 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)NC/C=C/c2ccccc2)cc1 733044557 YDTMDLQCMLSRND-WEVVVXLNSA-N 399.469 5.123 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](CCC)c1ccc(Cl)c(Cl)c1)c1ccncc1 734664407 VPOWMEHZHYMSGZ-OALUTQOASA-N 392.330 5.846 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2ccnc3cc(Cl)ccc23)c1Cl 734744869 ZKPGJUACAJIKCW-UHFFFAOYSA-N 396.281 5.388 30 20 GKED CCN(C(=O)[C@@H](C)SCc1cc(Cl)ccc1OCC#N)C1CCCCC1 735320324 QWZXGZPZNFXPAE-OAHLLOKOSA-N 394.968 5.045 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)ccc1OC(F)F 741474749 ZDZDAZYNKRLXAD-FNORWQNLSA-N 381.378 5.255 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2c2ccc(C)cc2)c1 745820131 HTSXKRCBHHHWDH-FYYLOGMGSA-N 391.515 5.113 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(c3cccc(C(F)(F)F)c3)C2=O)s1 749017621 YJKDZOYXUWAZIN-NTUHNPAUSA-N 396.440 5.044 30 20 GKED C[C@@H](CCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 750330237 GFOCETKQJCSJAM-GOEBONIOSA-N 396.462 5.848 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc2sccc2c1 761035642 GRFBAPKACSDZBI-ZDUSSCGKSA-N 389.263 5.169 30 20 GKED C[C@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1cccc(C#N)c1 762058889 NOKVKPPPULAVRH-LBPRGKRZSA-N 384.407 5.537 30 20 GKED C[C@@H](C(=O)OCCCCC(C)(C)C#N)c1cccc(C(=O)c2ccccc2)c1 768819586 MUYUDCWJLGUDEI-GOSISDBHSA-N 377.484 5.284 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)s2)CCc2ncc(C(F)(F)F)cc21 777467723 MVGNNKPHDPZCDZ-MDWZMJQESA-N 386.398 5.436 30 20 GKED C[C@H](C#N)Oc1ccccc1NCC1=Cc2cc(Cl)cc(Cl)c2OC1 779993001 LEVPQVNKYLRKBK-GFCCVEGCSA-N 375.255 5.172 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc(F)cc1OCC#N)c1ccc(Cl)cc1F 781872237 IEARSPCOFJWPDY-SFHVURJKSA-N 393.821 5.039 30 20 GKED C=C[C@](C)(CC)C(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 785761098 HGZGKVWVXXLJOG-XXFAHNHDSA-N 378.683 5.119 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568094 FFXFJQMWAYRLOU-WFASDCNBSA-N 394.462 5.514 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1[C@@H](OC(=O)CCCCCC#N)C(F)(F)F 805890019 XUEVNYQCFZZVIN-LJQANCHMSA-N 393.409 5.110 30 20 GKED C#C[C@H](NC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccc(Cl)cc1 811946676 HOZYNBWHUVRGIP-SFHVURJKSA-N 399.277 5.072 30 20 GKED N#C[C@@H](C(=O)[C@H]1C[C@@H]1c1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 842293188 ZLENBKJWQWFYGF-ILXRZTDVSA-N 386.398 5.295 30 20 GKED C=CC[C@@H](c1ccccc1)c1nc(-c2ccc(OCc3cccnc3)cc2)no1 904469336 ZHQFUQXBMWOHPA-QFIPXVFZSA-N 383.451 5.419 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 915088060 YXOUKIZJHOXMIC-DEOSSOPVSA-N 396.490 5.561 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 915352559 MFAANNNOMUIJIB-ZEQRLZLVSA-N 399.494 5.623 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SC)cc2)cc(Br)c1O 916133354 IKKLABAGKHNXOA-WTKPLQERSA-N 393.302 5.171 30 20 GKED O=C1Nc2ccccc2C12CCC(=NN=C1c3ccccc3-c3ccccc31)CC2 917541413 YCTQYSRUGMTNES-UHFFFAOYSA-N 391.474 5.325 30 20 GKED CN(C(=O)Cc1ccc(N=Cc2c(O)ccc3ccccc23)cc1)c1ccccc1 917557193 AGZROADSVWNYQL-UHFFFAOYSA-N 394.474 5.502 30 20 GKED C=C(C)CNC(=S)/C(=C(/O)c1ccsc1)[n+]1ccc(C(CC)CC)cc1 1337621924 NBASKASGAAPPQO-UHFFFAOYSA-O 387.594 5.316 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)Cc1c(C(=O)O)sc2cccc(F)c12 1776180545 IXBLQIGFZWYZAG-UHFFFAOYSA-N 389.879 5.580 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)C(=O)c2ccccc21 1776308920 YSYHNXQDAQEDAB-BHSBJAHRSA-N 388.419 5.370 30 20 GKED CCCCCCCOc1ccc(/C=C\c2nc3c(s2)CCC[C@@H]3C(=O)O)cc1 1776788285 XBPQMWXJGOQRNR-RYBIEJRYSA-N 399.556 6.167 30 20 GKED CCc1c(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)oc2ccc(C)cc12 1776956384 YPQBYRZFPORWTL-ZHACJKMWSA-N 399.446 5.755 30 20 GKED CCc1cccc2c1OC/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776977753 COAGOEVYUXVZND-RGEXLXHISA-N 384.431 5.273 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(SC2CCCC2)cc1 1777268341 CUEUCVQOZFOXRY-JLHYYAGUSA-N 382.481 5.324 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccsc3)cc2)CCC1 1786944394 ZAMNYWRTMKZION-CEUCYRDJSA-N 394.540 5.108 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCC[C@@H]1c1ccsc1 45988241 FMOVQXAHLQZZNL-HXUWFJFHSA-N 378.522 5.578 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2Oc2cccc(F)c2)cc1OC 108688708 RZMUCLFENOWMTG-UHFFFAOYSA-N 393.414 5.444 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(F)cc1)CC1CC1 115769547 FVFRLZSEOLSEGR-INIZCTEOSA-N 397.519 5.522 30 20 GKED CCO[C@@H](C)c1noc(CSCc2ccc(-c3ccccc3C#N)cc2)n1 123077444 BPCYGVCFAIQNHZ-HNNXBMFYSA-N 379.485 5.139 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 124025576 LCNQDDOUJXUGME-GHTZIAJQSA-N 398.462 5.238 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(OC(F)F)cc1OC(F)F 154342441 HCXMYBQYXBKEQT-NEPJUHHUSA-N 382.357 5.173 30 20 GKED C[C@H]1CCN(C(=O)CCc2ccc(C#N)cc2)[C@@H]1c1ccc(C(F)(F)F)cc1 155044327 LIMOKOQDWQVCTP-BTYIYWSLSA-N 386.417 5.119 30 20 GKED COc1ccc(-c2csc(CNCc3ccc(O[C@H](C)C#N)cc3)c2)cc1 177583918 OHKSBYPORMDEOP-MRXNPFEDSA-N 378.497 5.004 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)csc1Br 185727982 GALVBDCSHREIKR-JTQLQIEISA-N 395.347 5.466 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)O[C@H](c2ccsc2)C1 191420998 CCPWBLIASSCGCK-UZLBHIALSA-N 384.545 5.594 30 20 GKED C=CCn1c(S[C@H](C)c2nc(Cc3ccccc3)no2)nc2ccccc21 303914832 SJAYFYUOGKKLCG-OAHLLOKOSA-N 376.485 5.049 30 20 GKED Cc1cccc(Cc2cnc(N=C(O)[C@@H]3CCC(=O)[C@H](C)C3)s2)c1Cl 328942349 UAXIVVFNMNYIPV-TZMCWYRMSA-N 376.909 5.289 30 20 GKED CCc1noc(C)c1N=C(O)N1Cc2cc(OC)ccc2C[C@H]1C1CCCCC1 329970717 XIPCAVBCQKCRHR-NRFANRHFSA-N 397.519 5.107 30 20 GKED CO[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 378623852 MDVKUOQXCPQWEM-QUCCMNQESA-N 397.906 5.028 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)C1CCC(OC(F)F)CC1)c2C#N 410991497 VHGULLMIYXIQJL-IALDZJHCSA-N 382.476 5.042 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1C[C@H]1c1cccc2ccccc12)c1ccccc1 431319828 VIUPZNBNUWCICD-KMDXXIMOSA-N 383.495 5.430 30 20 GKED Cc1c(CNC(=O)N[C@H](CCCC#N)c2ccccc2)oc2ccc(F)cc12 431874630 ZWXGOBGFQGNOHU-LJQANCHMSA-N 379.435 5.115 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 439506117 ZPSQSUFFLGNFKE-HBFSDRIKSA-N 393.556 5.738 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 441536927 YTCXUCMUHYGXNS-HNAYVOBHSA-N 391.437 5.510 30 20 GKED N#C[C@H](C(=O)c1ccccc1Sc1ccccc1)c1ccc(C(F)(F)F)cn1 442613677 DOFIMUSZWOJZKC-KRWDZBQOSA-N 398.409 5.742 30 20 GKED Cc1cc(F)ccc1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 454759406 LPGGJYGHZUEVRV-OXJNMPFZSA-N 397.519 5.897 30 20 GKED COc1cccc(C=C2CCN(C(=O)Nc3ccc(CC#N)cc3Cl)CC2)c1 455699473 HIFIKPPHPYRXPR-UHFFFAOYSA-N 395.890 5.126 30 20 GKED O=C([C@@H]1CCC[C@@H](C(F)(F)F)C1)N(Cc1ccc(F)cc1)CC(F)(F)F 460453967 YOEWXXIBJQGVNI-CHWSQXEVSA-N 385.323 5.085 30 20 GKED COc1ccc(/C=C\c2ccc(OCCCC3(C#N)CCOCC3)cc2)cc1 461072938 FVJWGAIBWRRLQN-ARJAWSKDSA-N 377.484 5.345 30 20 GKED Cc1cccc(F)c1NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 461923543 WWITZIRUGCYVMD-AWEZNQCLSA-N 394.290 5.578 30 20 GKED C[C@@H](C(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462503065 PTGGOIWBXMDYFT-FOIQADDNSA-N 386.417 5.434 30 20 GKED N#CC1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CCCCC1 463536651 HSROEIUSSVWIEA-UHFFFAOYSA-N 399.853 5.144 30 20 GKED CC(C)Oc1ccc(NC(=O)[C@@H](C)c2cccc(C#N)c2)c(C(F)(F)F)c1 463943385 GZQBLAJDKFFTTR-ZDUSSCGKSA-N 376.378 5.106 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCC4(CCCCCC4)C3)cc2)nc1 464676781 HZIXDXZRWPVSPY-UHFFFAOYSA-N 389.499 5.322 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)[C@H]1CCOC(C)(C)C1 464689072 IYUDAGNOLCLUKX-FQEVSTJZSA-N 392.499 5.079 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1 466385504 GIUQYUBNUAOMED-IBGZPJMESA-N 385.573 5.445 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccn(C2CCCCC2)n1 470823602 BVLORTYGTGAWCW-UHFFFAOYSA-N 376.485 5.241 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)CC(C)C)cc1 471181140 KKJWGPVKKFRSBK-UHFFFAOYSA-N 379.504 5.281 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc3c(c2)CCC(=O)N3CC2CC2)CC1 480686056 YVPNTMNNFZGOTG-UHFFFAOYSA-N 399.538 5.192 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)(C)C#N)cc3)n2)cc1 483450565 MPNILFJESIUYHG-IBGZPJMESA-N 385.492 5.410 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 487573544 JOFWHAZREGNZFX-HSZRJFAPSA-N 397.478 5.104 30 20 GKED Cc1csc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1Br 489568262 YGNOZNUWQNHUFI-UHFFFAOYSA-N 395.347 5.273 30 20 GKED N#CC1(CCCN[C@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CCOCC1 499611669 OXVPSDCEJGBFKT-JWQCQUIFSA-N 388.555 5.538 30 20 GKED N#CC1(CCCOc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCOCC1 499910760 ZLFMPSCJAGQESY-UHFFFAOYSA-N 381.316 5.204 30 20 GKED Cc1c(C(=O)NC[C@@H](c2ccccc2)C(F)(F)F)sc2ccc(C#N)cc12 501396228 IIAIQDDPAZOXPO-INIZCTEOSA-N 388.414 5.157 30 20 GKED CCN(C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)[C@H](C)c1ccc(C#N)cc1 502725083 HYEXSAVVPYZFEW-CYBMUJFWSA-N 397.450 5.183 30 20 GKED COc1ccc([C@@H](NC(=O)c2cc(C#N)ccc2Cl)c2ccc(C)cc2)cc1 506773508 FAGLOOVEWBJLJL-QFIPXVFZSA-N 390.870 5.048 30 20 GKED C[C@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)NCC(C)(C)C#N 512906703 HYHGFWVEKUMRRP-OAHLLOKOSA-N 389.952 5.094 30 20 GKED CC[C@H]1C[C@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 514108846 GJFWCKSEQYTSTP-GCJKJVERSA-N 394.490 5.134 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3Cl)cc2)ccn1 514636367 AYKIUZLSCRJTTL-UXHICEINSA-N 389.842 5.141 30 20 GKED C=CCN(C(=O)c1cc2sccc2s1)c1nc(-c2ccccc2)cs1 516072572 VIXBNRODVHZUHR-UHFFFAOYSA-N 382.535 5.919 30 20 GKED Cc1nc(C(C)C)oc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 516615742 NOBRYEHMYKSICL-AWEZNQCLSA-N 385.876 5.373 30 20 GKED Cc1ccccc1C1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 517533650 YJPROODEVRBBMW-QGZVFWFLSA-N 379.529 5.243 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1ccc2ccccc2c1 518753423 MZFHZFZFKYZDJU-QGZVFWFLSA-N 389.524 5.598 30 20 GKED CC(C)CN(CCc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521954911 IDIBBBZFRJTFDF-UHFFFAOYSA-N 399.494 5.086 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2oc(C(C)C)nc2c1 522783409 OGDIPBVJXHVSPE-UHFFFAOYSA-N 379.460 5.180 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1ccc(CC#N)cc1 533940867 YTVKNCCNKRBYMW-ZDUSSCGKSA-N 395.915 5.329 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2CC23CCCCC3)cc1 536523590 CSZLUOCPSDRRPE-NRFANRHFSA-N 376.525 5.303 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(C(F)F)c2Cl)cc(OC)c1OC 542579518 YJCPAVAGNCDHMW-UHFFFAOYSA-N 381.806 5.276 30 20 GKED CN(C[C@H]1CC=CCC1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 543353463 JZTFQDGLKQPIQG-IBGZPJMESA-N 376.525 5.279 30 20 GKED Cc1nc(SCC(=O)Nc2cccc(C(F)F)c2Cl)c(C#N)c(C)c1C 543507873 LYTKQODAIVIEPI-UHFFFAOYSA-N 395.862 5.200 30 20 GKED C=C[C@H](Cc1nc([C@H](OC)c2ccc(Br)cc2)no1)c1ccccc1 545103763 CRXOAESDYIJFSY-AUUYWEPGSA-N 399.288 5.080 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ncc(Cc2ccccc2)s1 549543668 VJKVOMWVXJWAEQ-UHFFFAOYSA-N 390.512 5.050 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 550828085 WPVQQATYYRFLJD-JTSKRJEESA-N 376.504 5.056 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccnc(Oc2ccccc2)c1 554864256 WBTRQBDSLVNIPP-UHFFFAOYSA-N 397.459 5.726 30 20 GKED Cc1cn(C2CCCCC2)[nH]c1=NC(=O)Nc1ccccc1SC[C@H](C)C#N 555814545 JNAPCNSPMBESBL-OAHLLOKOSA-N 397.548 5.014 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccccc1OCc1cccnc1 558417775 IJHALUPVWFKIIU-UHFFFAOYSA-N 390.531 5.016 30 20 GKED N#CCCN(C(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(F)cc1 560357498 PDNKXFUZCYKIKB-UHFFFAOYSA-N 393.270 5.908 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(-c3nc4ccccc4s3)s1)CC2 563826488 WTKYGCMYLIAKSF-UHFFFAOYSA-N 387.489 5.099 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 570845992 PNNBHENIDZEJFK-OAHLLOKOSA-N 398.491 5.047 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2sc(Cl)cc2C1 571557001 AFMFYZKHUKXHEA-GFCCVEGCSA-N 391.949 5.386 30 20 GKED Cc1c(NCc2cccc(OCCCC#N)c2)cnn1-c1ccc(Cl)cc1 573161814 KETAMRNNZLPKLX-UHFFFAOYSA-N 380.879 5.129 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC(C)(C)[C@H]1c1cccs1 580454029 PLKLDDLJNDNXMO-MGPUTAFESA-N 399.585 5.164 30 20 GKED C=C[C@](C)(CCOC)c1nc(CC2(SCc3ccccc3)CCCC2)no1 584555847 ZAXBMZCALLCJSU-OAQYLSRUSA-N 386.561 5.339 30 20 GKED COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)CCCCCC#N)c1 588676320 CEQSDWCNTMWOHB-LADGPHEKSA-N 376.500 5.226 30 20 GKED CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)CCCCCC#N)c1 588837431 GAVCRIIQSIGVFA-LJQANCHMSA-N 391.515 5.209 30 20 GKED C=C(C)COc1cccc(NC(=O)CCc2ncc(-c3ccc(C)cc3)o2)c1 589382681 XEKXJCWDWBWOTO-UHFFFAOYSA-N 376.456 5.176 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 598823405 GAAYDBPOYBJDCR-CQSZACIVSA-N 398.322 5.034 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(Cl)ccc1Cl 603600881 JLEATARWVGSVTE-UHFFFAOYSA-N 398.249 5.613 30 20 GKED N#Cc1c(NC(=O)CCN2CCC[C@@H]2c2ccsc2)sc2c1CCCCC2 603662311 SDAVZFITAVIOHG-GOSISDBHSA-N 399.585 5.116 30 20 GKED CC(C)(C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 605452856 JZWPXYIDUOTMJO-IMRBUKKESA-N 399.350 5.129 30 20 GKED N#C[C@H](C(=O)c1cc2occc2s1)c1nc2cc(C(F)(F)F)ccc2s1 606147518 YIKGLXXIUMHLLJ-SECBINFHSA-N 392.383 5.613 30 20 GKED N#Cc1ccc(OCc2nnc(-c3c(Cl)cccc3Cl)o2)c(Cl)c1 608801033 AJPQZDDVYRKNDT-UHFFFAOYSA-N 380.618 5.147 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209107 YFZXSKIWCYGTCB-UHFFFAOYSA-N 381.476 5.019 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)Nc3ccc(Cl)cc3)c2)cc1 609220751 PUOHAMAKZRJNTG-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1 609384704 JMYRDVCVUVHECQ-MRXNPFEDSA-N 381.545 5.286 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C12CC(c3ccccc3)(C1)C2 616228421 BBPKABAMOHMMQF-UHFFFAOYSA-N 395.462 5.114 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc2nc(O)oc2c1)c1ccc(C(F)(F)F)cc1 671753891 GYZWMOWLMKZHIB-GUYCJALGSA-N 390.405 5.910 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1ccc2ccccc2n1 677790788 DBHSYYZGSVYFBQ-GOSISDBHSA-N 388.373 5.479 30 20 GKED CC(C)N(C(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(Cl)c(Cl)c1 726489663 CCDKQVMUZQHCEN-UHFFFAOYSA-N 398.746 6.130 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1sc(-c2ccc(Cl)cc2)nc1C 727649510 ACRFDEFNZYOSSF-UHFFFAOYSA-N 385.876 5.306 30 20 GKED Cc1ccc(C)c(Oc2ccc(CNCc3ccc(O[C@@H](C)C#N)cc3)cn2)c1 728711629 LQMAKWOEBYIRCB-IBGZPJMESA-N 387.483 5.071 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cccc(OCC#N)c1 730149362 GXWKBRYQTZIRGG-BJMVGYQFSA-N 394.883 5.570 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1C 730416075 AAUISCBMCGRKDT-INIZCTEOSA-N 384.501 5.411 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730417129 LBQRKBQCVDINHK-IVEQORNPSA-N 378.472 5.623 30 20 GKED Cc1cc(C2=NNC(=Nc3cc(C(F)(F)F)ccc3Cl)SC2)c(C)[nH]1 730430928 UKQFKJMXPCNPOF-UHFFFAOYSA-N 386.830 5.032 30 20 GKED C#CCOc1ccc(NC(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)cc1 733634612 UBASHKFFCLESEB-GOSISDBHSA-N 385.467 5.516 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=S)Nc2ccc3ccccc3c2)c1 733753833 FNEVZYTZRFDYRF-FQEVSTJZSA-N 375.497 5.007 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](Cc1ccccc1)c1cccs1)c1ccncc1 735189452 AACHFKXFAWHPEY-WOJBJXKFSA-N 377.513 5.044 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1)C(=O)c1cc2c(s1)CCCC2 743467656 FLTZQEBENRTNEY-CQSZACIVSA-N 378.280 5.139 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)/C=C/c1ccc(-c2ccccc2Cl)s1 746006334 FYGNJEKMUUXAPV-VQHVLOKHSA-N 398.837 5.386 30 20 GKED C=CCC[C@@H](NCc1cc(OC)c(OC)cc1O)c1ccc(C(F)(F)F)cc1 776253859 VFDWPAPOOBLGJW-QGZVFWFLSA-N 395.421 5.225 30 20 GKED O=C1/C(=C/c2ccc(F)nc2)CC(c2ccccc2)C/C1=C\c1ccc(F)nc1 777463309 BIWMSXSZRKMBLY-CLVAPQHMSA-N 388.417 5.369 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(OCc2ccccc2F)cc1 779989740 YXPSBIYFEFSHAA-KRWDZBQOSA-N 376.431 5.308 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1)c1ccncc1 783230392 MCUJIFYEUSSSBJ-HZVYYCNASA-N 381.545 5.428 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1cnn(C(C)C)c1C 787150333 NSSDNKQMCIXSFA-UHFFFAOYSA-N 390.516 5.280 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(-c2ccc(F)cc2)s1 789074179 XHVHAYMQMJELBG-UHFFFAOYSA-N 377.444 5.232 30 20 GKED N#C[C@@H](C(=O)Cc1coc2ccc3ccccc3c12)c1nccc2ccccc12 792095919 YGERSZIIXHSJED-NRFANRHFSA-N 376.415 5.553 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OC(=O)C[C@H](CC#N)c2ccccc2)cc1 793562572 REIKMPFFKMYRFF-KRWDZBQOSA-N 380.444 5.027 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 796747711 QDDBOFBIHSIFJC-DZGCQCFKSA-N 377.362 5.119 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(OC(F)F)cc1 796990344 BJMAQHHIMMDGKL-YFHOEESVSA-N 375.371 5.447 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 806201290 WFHYFSAWKOUPFL-FQEVSTJZSA-N 388.471 5.004 30 20 GKED N#Cc1cc(Oc2ccc(NC(=S)Nc3ccc(F)c(Cl)c3)cc2)ccn1 811708269 VQUIPNCWLMAHGF-UHFFFAOYSA-N 398.850 5.347 30 20 GKED CC(C)(C)C(=O)CCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 835111278 QQUWODYEJYPYLN-GFCCVEGCSA-N 390.455 5.050 30 20 GKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842280259 AKBKZPLBHCSCCS-GDBMZVCRSA-N 397.544 5.058 30 20 GKED C=CCN(CC=C)C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 892654857 MNRNLKKUDQBHKI-UHFFFAOYSA-N 385.492 5.326 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@H]2c2cccnc2)s1 915311304 ATGACXCFOCDUMC-KRWDZBQOSA-N 387.553 5.205 30 20 GKED N#CCCn1cc(C=NN(c2ccccc2)c2ccccc2)c(-c2ccccc2)n1 916250222 XAMFEHKGIVOSCW-UHFFFAOYSA-N 391.478 5.636 30 20 GKED N#C[C@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1ccc2ccccc2n1 916849662 YLYNFXLQFDEYRA-INIZCTEOSA-N 386.398 5.222 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCOc2cccc(C)c2)cc1 916956009 WSLUROKUMJJCKC-GCJKJVERSA-N 392.499 5.015 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(F)(F)c2ccc(F)cc2)cc1 920843817 LLWXVBAUPBRZFY-FQEVSTJZSA-N 380.369 5.212 30 20 GKED CC(=NNc1ccc(Cl)cc1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776032800 UOCXTENCRKHGON-UHFFFAOYSA-N 380.831 5.667 30 20 GKED CCCCC(=NNc1ccc(CC(=O)O)cc1)c1ccc(Cl)cc1Cl 1776084610 CNAYOFZNZNGYPR-UHFFFAOYSA-N 379.287 5.627 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3ccc(F)c(Cl)c3)c2)c1 1776097856 GVODGHQDMYNWCE-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCC(F)(F)C[C@H]2C(=O)O)cc1 1776787539 SGQYARWVGUUJMU-KRWDZBQOSA-N 399.503 5.074 30 20 GKED Cc1ccsc1C(=O)/C=C\c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1777477297 YXLWBZPBEHTJHC-JPMGXVIASA-N 378.449 5.157 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)CCC2)C1 1790295055 UHGKCNFWQUCXKB-UHFFFAOYSA-N 394.902 5.054 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCCCc2ccccc2)cc1 23155596 HTKSOUDRSBXVPZ-UHFFFAOYSA-N 386.520 5.213 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1ccc(F)cc1 25353013 TYGDNVIAWNZBDE-UHFFFAOYSA-N 398.488 5.279 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(C)noc1C(C)C 57375766 JQJLCMWUIMPCNG-UHFFFAOYSA-N 375.428 5.331 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 60306222 JWICZKKNJRCBHM-CHWSQXEVSA-N 375.456 5.516 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3cc(C#N)ccc3OC(C)C)cs2)c(C)c1 63939851 LEBIYYQRXSRIDT-UHFFFAOYSA-N 391.496 5.338 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1ccc(F)c(C#N)c1 102855735 YMMFLIPBAZYFLR-UHFFFAOYSA-N 390.201 5.220 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)s1 103384265 MTQQFYPXHSFXMM-UHFFFAOYSA-N 390.468 5.078 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cnc(Cc2ccc(F)cc2)s1 108200219 LSWHMTNWQGTONV-UHFFFAOYSA-N 397.500 5.131 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc(-c2ccsc2)s1 112246654 DOULDMRUYWYAFN-LBPRGKRZSA-N 385.539 5.376 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCc2ncc(-c3ccccc3Cl)o2)cc1 116101347 CLQZZOYSALHPKK-UHFFFAOYSA-N 393.874 5.183 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc2ccccc2[nH]1 119836952 KFQACIJUMSNCEL-NSHDSACASA-N 378.284 5.130 30 20 GKED CCN(CCC#N)C(=O)c1oc2ccccc2c1COc1ccccc1Cl 133308398 OHQJLPWRGSAJEF-UHFFFAOYSA-N 382.847 5.041 30 20 GKED N#Cc1cccc(COc2ccc(NCc3csc(C4CC4)n3)cc2F)c1 134848670 PCSPXCDMMDQAJR-UHFFFAOYSA-N 379.460 5.222 30 20 GKED N#CCN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)C1CCCC1 156869713 OHHFCTMHIKFIAF-UHFFFAOYSA-N 390.270 5.089 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(NC(=O)c3cccs3)c(C)c2)c1 159385430 HNXZVIKLSWBEPJ-UHFFFAOYSA-N 392.480 5.126 30 20 GKED CC(C)CN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 164583099 HKOYOWWPVJRQBG-FGZHOGPDSA-N 390.531 5.172 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 174002922 SSRLIKLRXAAQAC-MRVWCRGKSA-N 388.826 5.208 30 20 GKED C=C(C)CN(C)Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 181253637 JLRKJTSOUGUZIX-UHFFFAOYSA-N 377.941 5.106 30 20 GKED C[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(OCC#N)cc1 182866874 CUDFIVVYYMHVEE-SFHVURJKSA-N 392.503 5.170 30 20 GKED C[C@H](CN(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nccs1 184951131 OGFHULMJTJVFHT-OAHLLOKOSA-N 393.537 5.042 30 20 GKED C=CCN(C(=O)Cc1cnc2ccccc2c1)c1nc(-c2ccccc2)cs1 191342702 FCVOSRHEWNQORP-UHFFFAOYSA-N 385.492 5.120 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@H]1c1c(C)n[nH]c1C 191434729 KCSCHGPKTYEQHE-NRFANRHFSA-N 394.563 6.028 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 255006916 LYHSPNFYWNLAKT-WQTVUKCASA-N 385.801 5.365 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](C)c2ccc(OC(F)F)cc2)c1 303183169 LDLZDAJDEHDNBZ-CQSZACIVSA-N 376.403 5.126 30 20 GKED C=CCN(C(=O)CSc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 410355729 VCETVIHQANDJDX-UHFFFAOYSA-N 384.501 5.261 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N(CCC#N)CCC(C)C 428903450 VZOUOEUNZVHGQT-UHFFFAOYSA-N 379.504 5.368 30 20 GKED N#Cc1cccc(-c2cc(-c3nc(-c4c(Cl)cccc4Cl)no3)on2)c1 432659967 QVXODRVNDSIEAY-UHFFFAOYSA-N 383.194 5.237 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 433134510 LBPYZNIQKPSHHL-HKUYNNGSSA-N 392.528 5.495 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2c(CC)cc(C)cc2CC)cc1 435197303 QXRCNTQTRRKBJN-UHFFFAOYSA-N 380.492 5.071 30 20 GKED Cc1ccccc1-n1c(SCCCCC(C)(C)C#N)nnc1-c1cccnc1 436134538 VANDFSIXQIWVAJ-UHFFFAOYSA-N 391.544 5.450 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 437736943 XSELAUYCABQOGB-YCRPNKLZSA-N 393.918 5.790 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CC1 437901478 VYQPIXBKYOUAKM-CQSZACIVSA-N 395.890 5.799 30 20 GKED C[C@H]1CCSCCN1C(=O)Nc1ccc(Sc2ccccc2C#N)cc1 455937201 DKYRASPNUFLTCV-HNNXBMFYSA-N 383.542 5.069 30 20 GKED CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2cccc(C#N)c2)no1 468958786 KQJSLHTWMUPDTO-IFMALSPDSA-N 385.467 5.012 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)C[C@H](CC#N)c3ccccc3)oc12 474293803 RXSXJRXZOKHNFC-WMZOPIPTSA-N 376.456 5.096 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C(=O)OCC)c1ccccc1 475553320 OIAMJRMLIYOLHZ-OAQYLSRUSA-N 394.515 5.007 30 20 GKED N#CC[C@@H](CC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1)c1ccccc1 476147329 LULXBUKPCXCAMT-ZCYQVOJMSA-N 380.491 5.400 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476343943 ZQHATLSVBKZSSL-PZJWPPBQSA-N 375.516 5.400 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476590856 BGPCNBKCBSOKCK-UHFFFAOYSA-N 383.495 5.661 30 20 GKED Cn1cc(CNc2ccc3nc(C4CC4)sc3c2)c(-c2ccc(C#N)cc2)n1 478327455 XSBQWGNOFLFHAM-UHFFFAOYSA-N 385.496 5.058 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)cc1F 479462990 HPYXNIWYEREEQY-UHFFFAOYSA-N 397.812 5.354 30 20 GKED Cc1ccc(C(C)(C)C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 483407638 HIYKUNKDGFAKIK-UHFFFAOYSA-N 397.478 5.035 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1 485762368 IIMZGLGRZOUEJA-UHFFFAOYSA-N 394.540 5.233 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)s2)cc1 487392141 ZHLRVIKXVYEQFS-QZTJIDSGSA-N 393.899 5.001 30 20 GKED Cc1ccc(-c2nc(CSc3nc(C(F)(F)F)ccc3C#N)cs2)o1 488768243 PNUKMHBKFXPSRN-UHFFFAOYSA-N 381.404 5.289 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)oc2ccc(F)cc12 499811964 LNOXOLGHEWOYKX-AWEZNQCLSA-N 377.202 5.182 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OCC2CC2)cc1 503190040 ITBQCZYPWVYHCN-UHFFFAOYSA-N 377.488 5.037 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 503491344 PYEXSLINNLYSTE-IRLDBZIGSA-N 398.526 5.027 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCc3cc(Cl)cc(Cl)c3)CC2)cc1 503892292 NTSXVXOPLUZTCS-UHFFFAOYSA-N 385.294 5.114 30 20 GKED CC[C@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 504275006 PMVQDTIGEOWSHS-OAQYLSRUSA-N 398.506 5.854 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1 508045231 NXOBKURPHVAPLD-HXUWFJFHSA-N 394.519 5.273 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)C2CCCCC2)cc1 508279957 OZZKKDUAHPOIPC-UHFFFAOYSA-N 379.460 5.156 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C3(c4cc(F)cc(C#N)c4)CC3)c2)cc1 511188682 LENLCZTUWUVNAP-UHFFFAOYSA-N 397.409 5.032 30 20 GKED C=CCN(C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2c(s1)CCCC2 514596565 AQFCXPNECVWBBM-UHFFFAOYSA-N 381.328 5.090 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)Nc1ccccc1S[C@H](C)CC#N 517517737 IPXFOVCFVLZWBW-DLBZAZTESA-N 382.529 5.612 30 20 GKED Cc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1C 518148367 SJWSFTORSOBMJZ-UHFFFAOYSA-N 392.446 5.509 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCCc1ccccc1 518150482 ARVQTNPFRLHQEQ-UHFFFAOYSA-N 392.446 5.673 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(-c2ccccc2F)n1 520803117 UNOVJHMBYOGFTL-UHFFFAOYSA-N 383.473 5.207 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](CC(C)C)c1ccccc1 525337880 JVFRZQGLUSRLIG-JOCHJYFZSA-N 399.494 5.822 30 20 GKED N#CCc1ccnc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c1 531671214 ZAJYQDGCNRSBEB-UHFFFAOYSA-N 395.793 5.287 30 20 GKED COCc1cc(CNCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 533253229 PLQHLLSZBIQXEC-UHFFFAOYSA-N 395.318 5.300 30 20 GKED C=CCCC[C@@H](C)NC(=O)N(CCC)Cc1nnc(-c2ccccc2Cl)o1 537265280 GKBCNXYKCCEMJG-OAHLLOKOSA-N 390.915 5.056 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC[C@H]3c3ccc(Cl)c(Cl)c3)cc2)CC1 538581855 VEFZNQFJDDEQGK-IBGZPJMESA-N 385.294 5.526 30 20 GKED C[C@@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 541017373 BQODJODSOGAIRX-CQSZACIVSA-N 387.936 5.465 30 20 GKED N#Cc1ccc(CN(CCC(=O)Nc2ccccc2-c2ccccc2)C2CC2)cc1 541317806 HFOGZPLKUZUVLV-UHFFFAOYSA-N 395.506 5.218 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc(F)ccc3-c3ccoc3)n2)cc1 548094150 YYTHQLVVJKVIIK-UHFFFAOYSA-N 389.411 5.333 30 20 GKED C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Oc2cccnc2)cc1 554643488 BMLYAYDVBOYGKX-KRWDZBQOSA-N 385.467 5.166 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(Br)c1Cl)c1ccccc1 555047005 WKOHUFOFKBNYJT-AWEZNQCLSA-N 392.684 5.269 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c2nccc(C)c2c1 559565995 DRQJVCBWMQBDBH-MRXNPFEDSA-N 375.497 5.498 30 20 GKED N#CCCCOc1cccc(CNCc2cc(Cl)ccc2Br)c1 569575537 OEYTUHUNLYJULX-UHFFFAOYSA-N 393.712 5.075 30 20 GKED Cc1sc([C@H](C)N[C@H]2CCc3ccc(C#N)cc32)nc1-c1ccc(Cl)cc1 569861747 ZEYZCLBUWMCGSV-RBZFPXEDSA-N 393.943 5.982 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1C[C@@H]1c1ccccc1 576366933 JICRRAJJOHJUHX-ISKFKSNPSA-N 397.478 5.123 30 20 GKED COc1ccc(CS[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1C#N 577243445 OQBNGTSPEVJXPR-MRXNPFEDSA-N 382.529 5.259 30 20 GKED CCCc1nc(C)c(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)o1 577845458 HETPQTRNCYRQOQ-UHFFFAOYSA-N 391.446 5.102 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 586783729 MNMUFJCMWBGJAY-NXEZZACHSA-N 390.274 5.219 30 20 GKED C[C@@H](NC(=O)Nc1ccc(F)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 590334870 GXWGZPTZPXVMRL-SECBINFHSA-N 394.290 5.746 30 20 GKED C[C@@H](Nc1cc(C(=O)N(C)c2ccccc2)ccc1Cl)c1cccc(C#N)c1 600851555 JFQHXTXEHHDBOC-MRXNPFEDSA-N 389.886 5.661 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1cc(F)ccc1F 609370550 CMSDOMFMCHOFEG-GFCCVEGCSA-N 378.469 5.090 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(c1ccccc1)c1ccccc1 609377259 RNCMANJRNOUXOB-GOSISDBHSA-N 386.520 5.709 30 20 GKED C[C@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1cccc(C#N)c1 610344996 PZZWQXBCLQPKBN-AWEZNQCLSA-N 383.904 5.098 30 20 GKED N#Cc1ccc(CNCc2ccc(-c3nc4ccccc4s3)o2)cc1Cl 619748724 RVOYJHQADCTQSM-UHFFFAOYSA-N 379.872 5.371 30 20 GKED O=C(CC1CC(F)(F)C1)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494305 IVFAGLMPAHZRRT-UHFFFAOYSA-N 393.249 5.350 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(Cl)c(F)c1 677956985 PTHPGTXOSZEXLG-MYJAWHEDSA-N 391.714 5.118 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 678296724 IGZCGORPHYLXOU-AOOOYVTPSA-N 383.229 5.017 30 20 GKED Cc1cccc(F)c1NC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 680877185 DQIVOXCMRJTEFN-URLYPYJESA-N 386.311 5.165 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CNc1cccc(C(F)(F)F)c1 682822463 NPZLOCUARMGEBL-UHFFFAOYSA-N 376.422 5.608 30 20 GKED COCCOc1cccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)c1 727781101 DRROHRXLVSQUAI-QXMHVHEDSA-N 379.481 5.040 30 20 GKED Cc1ccc(CN2C(=O)c3ccccc3N[C@H]2c2ccc(O[C@@H](C)C#N)cc2)cc1 731298549 KDOHDXJJZMPLQF-MHECFPHRSA-N 397.478 5.053 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2F)s1)c1ccc(C(F)(F)F)nc1O 731564921 UPUXTDHJBWAJDT-YVMONPNESA-N 393.361 5.570 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2cnc([C@H](C)OCC)s2)c1 742660040 SXFNUQUEABNXIX-HNNXBMFYSA-N 396.537 5.130 30 20 GKED C[C@H](NC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1)c1cccc(C#N)c1 743128843 SSEFRGQKAMSZAC-HNNXBMFYSA-N 382.895 5.085 30 20 GKED N#C[C@@H](C(=O)Cc1cc(F)ccc1F)c1nc2cc(C(F)(F)F)ccc2s1 744038126 MUXYTCJQCDJTTI-LBPRGKRZSA-N 396.340 5.012 30 20 GKED COc1cc(C(=O)/C=C/c2ccccc2OCc2cccnc2)ccc1SC 747614590 IZMXUAJPTPKIIR-PKNBQFBNSA-N 391.492 5.287 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 747667936 RHRNWFHICOLWLN-STQMWFEESA-N 392.355 5.686 30 20 GKED O=C(Nc1cccc(/C=C2\Cc3ccc(F)cc3C2=O)c1)c1ccccc1Cl 749005533 LFXHLHFGTYCZHE-MHWRWJLKSA-N 391.829 5.554 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC)cc2)ccc1OCC(F)(F)F 750901073 BWMTUUVZTAZPNK-YCRREMRBSA-N 382.403 5.254 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(F)cc2F)ccc1OCC(F)(F)F 750903785 RPRFIKWIULOXBC-CLTKARDFSA-N 386.316 5.201 30 20 GKED C=CCC[C@H](NC(=O)C(F)(F)c1nccs1)c1ccc(C(F)(F)F)cc1 756526302 FJZZKCGZNWUVOJ-ZDUSSCGKSA-N 390.377 5.077 30 20 GKED C[C@H](C#N)Oc1ccc(-c2nc3cc(Br)ccc3n2C2CC2)cc1 758454577 MMMHRWLETFLTJK-GFCCVEGCSA-N 382.261 5.092 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760915935 SMURAWYLIXCIBN-SJLPKXTDSA-N 375.394 5.195 30 20 GKED N#CCCCn1cc(C(=O)OCc2coc(-c3cccs3)n2)c2ccccc21 769542605 GKGZVCDDQOOYNF-UHFFFAOYSA-N 391.452 5.019 30 20 GKED C[C@@H](NCc1ccccc1Oc1cccc(F)c1)c1ccc(OCC#N)cc1 776159661 ZALBVTDINMNRNJ-QGZVFWFLSA-N 376.431 5.371 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 778678270 JZAFTAHWURBSQI-QGZVFWFLSA-N 384.451 5.471 30 20 GKED C#CCCCCCC(=O)Oc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 779961797 AGZIOPDEUGLZSJ-UHFFFAOYSA-N 383.875 5.106 30 20 GKED FC(F)(F)[C@@H]1C[C@@H](N[C@@H]2CCC[C@@H](C(F)(F)F)C2)C[C@H](C(F)(F)F)C1 782526254 MCSNMEVANMVMFY-ZIQFBCGOSA-N 385.314 5.607 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2Cl)c2cccc3ccccc23)nc1 783294710 UEIMMKALBPSRQG-XMMPIXPASA-N 383.882 5.639 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)nc1 788696507 SQSMYZAMIJXUML-UHFFFAOYSA-N 397.265 5.249 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CCc3ccc(Cl)cc3C2=O)cn1 792888187 XYFJDGWUWJHBNW-MHWRWJLKSA-N 376.843 5.018 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 796747728 QDDBOFBIHSIFJC-UKRRQHHQSA-N 377.362 5.119 30 20 GKED CC(C)(C(=O)OCCCCC#N)c1csc(-c2c(Cl)cccc2Cl)n1 797024812 GTCCPLLRDITSOT-UHFFFAOYSA-N 397.327 5.632 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2c[nH]c3ccc(Br)cc23)cc1 811699313 ZPMNVXPGHOMVJE-FAFAAHBOSA-N 395.256 5.117 30 20 GKED N#Cc1cc(/C=C(\Cl)c2nc3ccc(Br)cc3o2)ccc1F 812248532 OMHNYKSQZHYPHL-SDQBBNPISA-N 377.600 5.338 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 813057634 OBPJMNIVPCAKPU-AVRDEDQJSA-N 378.859 5.168 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)c(F)cc1O 815635934 MDWPGTZPFDDGJD-SCLBCKFNSA-N 391.284 5.380 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@]3(C2)CC3(F)F)cc1 844524728 ZYVSHUDSDVROER-FQEVSTJZSA-N 383.398 5.004 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCC=C(Cl)Cl 853782739 LIHVWHLDTIUAIT-LLVKDONJSA-N 375.346 5.072 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)C1CC2(C1)CC2(F)F 857584397 LCRGPPBZOLNBDT-UHFFFAOYSA-N 386.829 5.180 30 20 GKED C[C@H](Oc1ccccc1NCc1cc(C#N)ccc1Br)C(F)(F)F 864028291 MRUXRZNZCIMVTF-NSHDSACASA-N 399.210 5.262 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2ccsc2C(F)(F)F)no1 904922099 ZQECFLWMFSAYJS-SNVBAGLBSA-N 396.287 5.895 30 20 GKED Cc1ccccc1OCCCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 915102136 NLMOMNRXCKMRMF-SFHVURJKSA-N 376.481 5.154 30 20 GKED N#C[C@@H](C(=O)CCc1c[nH]c2ccccc12)c1nc2cc(Cl)ccc2s1 917044117 QBHOYFYGJCSKDG-HNNXBMFYSA-N 379.872 5.240 30 20 GKED N#CCOc1cccc([C@H]2Nc3ccccc3C(=O)N2c2cccc(Cl)c2)c1 917502502 YXIGQVMZPUMPIX-NRFANRHFSA-N 389.842 5.013 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@@H](C#N)C(=O)Nc3ccc(F)c(Cl)c3)oc12 920110060 MPVDDEVZJUWTNU-CQSZACIVSA-N 398.821 5.112 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2)CCC1)c1nc(-c2c(F)cccc2F)cs1 920805848 GINTVKZZFJHRTA-OAHLLOKOSA-N 394.446 5.386 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2ccccc2C(=O)O)cc1 1776030012 CQONSFHUUOGCCK-SFHVURJKSA-N 382.504 5.816 30 20 GKED CC(=NNCCCc1ccccc1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776042826 YLDRNAHALIIXJU-UHFFFAOYSA-N 388.467 5.124 30 20 GKED O=C(O)c1ccc(NN=Cc2ccccc2OCc2ccc(Cl)cc2)cc1F 1776077035 RKWKCNYXRMPOBO-UHFFFAOYSA-N 398.821 5.202 30 20 GKED O=C(O)c1cc2ccccc2c(C=NNc2ccccc2Cc2ccccc2)c1O 1776090884 HASQEFWJGFARHU-UHFFFAOYSA-N 396.446 5.280 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1C 1777275252 VDJFKJXMGNPIFR-JLHYYAGUSA-N 386.447 5.573 30 20 GKED CC(C)c1c(C(=O)N[C@@H](C)c2ccc(C#N)cc2)cnn1-c1cccc(Cl)c1 26133244 YOTUOJBPJGVGOQ-HNNXBMFYSA-N 392.890 5.012 30 20 GKED Cn1cc(CC(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c2ccccc21 65851809 RUTDCDWMZVSRSI-UHFFFAOYSA-N 397.503 5.058 30 20 GKED C=CCn1c(SCc2csc(CCC(C)C)n2)nnc1-c1ccoc1C 72039223 BSBIEKCIZRQVSA-UHFFFAOYSA-N 388.562 5.370 30 20 GKED C=CCn1c(SCc2csc(Nc3ccccc3C)n2)nnc1C1CC1 103974110 FWUGFBKZOPGVFD-UHFFFAOYSA-N 383.546 5.142 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 104260641 WTIQMFIMOCZYGD-LJQANCHMSA-N 392.890 5.199 30 20 GKED N#C[C@@H](C(=O)[C@H](Oc1cccc(Cl)c1Cl)c1ccccc1)c1ccccn1 106983734 NNVGZNYAFHOBPC-QVKFZJNVSA-N 397.261 5.385 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1=S 108349294 JJRJPHWHUPAQBF-HXUWFJFHSA-N 393.560 5.143 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)[C@@H](C)c1cccnc1 115230572 MBWAHYCPTKOFSQ-INIZCTEOSA-N 389.430 5.108 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3ncccc23)cc1 116552951 ONRQHYVRMSALLM-UHFFFAOYSA-N 395.418 5.160 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(-c3ccccc3)no2)nnc1-c1cccs1 123163724 ISGFCZBCHSHOCH-ZDUSSCGKSA-N 395.513 5.096 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)C1CCCCC1 124446142 HIQHQXXZIXXVBQ-LJQANCHMSA-N 381.549 5.410 30 20 GKED CCc1onc(C)c1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 157678617 MONIDQAMEFQHFS-UHFFFAOYSA-N 396.834 5.507 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 160045499 JFJSIWISKYCJCV-JXFKEZNVSA-N 379.529 5.622 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C3(c4ccccc4)CCOCC3)c2)cc1 171513737 FATWEPRWALDSOD-UHFFFAOYSA-N 398.462 5.037 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc(C(F)F)c3)c2)cc1 171543762 WCZCVKIVSASLOG-UHFFFAOYSA-N 392.405 5.522 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1ccc(Cl)s1 171840076 SQPILGHGGNOITC-GFCCVEGCSA-N 379.938 5.160 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(OCC(F)(F)F)cc1 172906133 BQANSYNPJSXWJN-CQSZACIVSA-N 380.435 5.492 30 20 GKED N#Cc1ccccc1NC(=O)CCCC(=O)Nc1ccccc1Nc1ccccc1 180799541 VBXZVXMLVSCJPC-UHFFFAOYSA-N 398.466 5.049 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(=O)N(c2ccccc2Cl)C1 189908947 VGKXWHXBAUWYFS-KRWDZBQOSA-N 396.918 5.184 30 20 GKED C=CCn1c(SCc2sc3ccccc3c2Cl)nnc1-c1cccnc1 302896173 HNOBPVCZJOFKHY-UHFFFAOYSA-N 398.944 5.687 30 20 GKED Cc1cc(Br)ccc1NC(=O)c1sc2ccc(C#N)cc2c1C 429926215 PRQSSWPJZQDJCA-UHFFFAOYSA-N 385.286 5.405 30 20 GKED N#CCCC[C@H](NS(=O)(=O)c1cccc(-c2ccccc2)c1)c1ccccc1 431639786 YTOZKLALELVGAM-QHCPKHFHSA-N 390.508 5.067 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccccc2CCN(C)C)cc1 438565606 CLMWBHPLCMUEFJ-UHFFFAOYSA-N 399.494 5.015 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccc(OC(F)F)cc3)o2)c(Cl)c1 438904801 VBHVWPDINMYWBZ-UHFFFAOYSA-N 393.802 5.155 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(F)cc1F 467319371 IVLLFGZVXXJZGQ-ZDUSSCGKSA-N 392.496 5.231 30 20 GKED Cc1ccc(-n2cccn2)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 475073245 WBDAQJWSBDWZEX-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC(C)C[C@@H](C)n1nccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482928535 GSYRZWOFOIGBHW-QGZVFWFLSA-N 388.471 5.406 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1OC 483195342 KCJATVZONMBJSQ-KRWDZBQOSA-N 394.858 5.176 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nccc2ccccc12 483205493 TWQFCVHFOYRPPQ-KRWDZBQOSA-N 389.867 5.502 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(COCc2ccco2)c1)c1ccccc1 488622760 DYEPAWUFEDCWJW-QHCPKHFHSA-N 375.468 5.685 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Oc2ccncc2)cc1 497322852 OROXKWHDNOWUCE-UHFFFAOYSA-N 391.430 5.665 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(F)c(C(F)(F)F)c2)c1 502490040 UDFUUQPLOKFMNX-UHFFFAOYSA-N 381.329 5.171 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccccc3-c3cccs3)CC2)cc1 503498730 ZPLXOHAVZRGCSA-UHFFFAOYSA-N 385.492 5.608 30 20 GKED COc1ccc(CN2CCC[C@@H]2/C=C\c2ccccc2)cc1OCCCC#N 507875244 MWRCMOPDBCEPQH-VZNHHXIYSA-N 376.500 5.056 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ncc(-c2ccccc2)s1 513530099 HLFHJFJBKPINPD-UHFFFAOYSA-N 395.532 5.198 30 20 GKED C=CCCC1(c2nc(CC(=O)Nc3ccc(Oc4ccccc4)cc3)no2)CC1 519817110 OMBTVVZXZVMNNM-UHFFFAOYSA-N 389.455 5.041 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)cc1 520855233 FMHWJTXNHJMGDT-RHSMWYFYSA-N 387.936 5.865 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520941363 LIGSZTLHGXRUHA-WMZOPIPTSA-N 397.544 5.752 30 20 GKED COc1ccc(-c2nc(C(=O)Nc3ccccc3SCCC#N)cs2)cc1 521716212 JHRMXDXISXFXAJ-UHFFFAOYSA-N 395.509 5.077 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ncc(-c2ccccc2)o1 521727744 ZVGDHDGHTLNZFY-MRXNPFEDSA-N 391.496 5.165 30 20 GKED N#Cc1cccc(CNCc2ccc(-c3ccc(Br)cc3)s2)c1 521819121 SDECVLHICZTVIL-UHFFFAOYSA-N 383.314 5.339 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1cccc(COc2ccccc2C#N)c1 523536161 HSDDQXURXSADBH-HSZRJFAPSA-N 399.494 5.146 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 523585172 UBNJZZZWGYRMEP-LBPRGKRZSA-N 393.537 5.429 30 20 GKED Oc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc2ccc(F)cc12 532613282 FTXZILDDHJGVNW-UHFFFAOYSA-N 376.231 5.179 30 20 GKED C[C@H](N[C@H](CO)c1cccc(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 536867401 DECOZUVAALGANX-MGPLVRAMSA-N 395.318 5.248 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1 543668037 LKEAABWJYWFWHL-RJGXRXQPSA-N 396.506 5.395 30 20 GKED Cc1ccc(C(=O)N2CCC(C)(C#N)CC2)c(Sc2ccc(Cl)cc2)c1 546132028 QRMNHPRNXCWKKM-UHFFFAOYSA-N 384.932 5.566 30 20 GKED N#Cc1ccc(C[S@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1F 549681300 HQDQAANFEDRFKD-LVXARBLLSA-N 383.875 5.389 30 20 GKED Cc1ccc(-n2cc(CNc3cc(CC#N)ccn3)c(-c3ccc(F)cc3)n2)cc1 551072861 SLGKFLWIRIGJNM-UHFFFAOYSA-N 397.457 5.060 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(C(F)(F)F)c1 553967801 CPPMNLCGYVRMBP-AWEZNQCLSA-N 378.350 5.054 30 20 GKED Cc1cc(Br)c(C(=O)N[C@](C)(C#N)C2CCCCC2)cc1Cl 557533878 PWQVHUDGTWKAGP-QGZVFWFLSA-N 383.717 5.003 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)N3CCC(CCC#N)CC3)c2)C1 573561312 CMXBYLMJWUEYII-PGRDOPGGSA-N 383.536 5.330 30 20 GKED CSc1cccc(NC(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)c1 574423008 WXCSOSONDZWOSV-UHFFFAOYSA-N 399.947 5.179 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)NCC3(C#N)CC3)c2)cc1 581287479 QTVNURVKLGGILR-GOSISDBHSA-N 391.515 5.147 30 20 GKED N#CCCC[C@H](NCc1cc(Cl)ccc1Br)c1ccccc1 583950662 NGZCZXVFZVSYLD-SFHVURJKSA-N 377.713 5.627 30 20 GKED C[C@@H]1CN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CCC1(F)F 589539223 UOSQZCLLFDUQDH-CYBMUJFWSA-N 390.817 5.121 30 20 GKED N#C[C@@H](NC(=O)C1CC(c2ccc(F)cc2)C1)c1cccc(Cl)c1Cl 590232517 TXYICYLOSMXAJR-QWQCLYJRSA-N 377.246 5.007 30 20 GKED CC[C@@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 594092998 LGJDPFAJDPQKOO-WAIALKQBSA-N 385.467 5.079 30 20 GKED Cc1sc(NC(=O)c2oc3ccc(Br)cc3c2C)c(C#N)c1C 603445423 MYSIUMQMRBRSJB-UHFFFAOYSA-N 389.274 5.306 30 20 GKED Cc1cc(O[C@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)ccc1Cl 603956602 WJUVCNGJVXMKBW-MRXNPFEDSA-N 394.858 5.114 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cc(Cl)ccc1OC 606756786 OGZHGDAETKBQSS-UHFFFAOYSA-N 385.769 5.185 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 608553125 UMYITFMUICTQDK-CYBMUJFWSA-N 385.489 5.348 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609306613 YEBADPXJRBCFMS-AWEZNQCLSA-N 380.444 5.384 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1OCC 609376554 CIVBTRVATYFZNS-MRXNPFEDSA-N 398.528 5.378 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cccc2ccccc12 609434676 INIIJDVGNLLMFV-IAGOWNOFSA-N 389.524 6.117 30 20 GKED C[C@@H]1CCc2sc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2C1 613392030 BEDHYCNWPQTZQM-CJNGLKHVSA-N 378.522 5.486 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)NCc1ncccc1C(F)(F)F 668625837 CWXWMNGVKGGGFW-UHFFFAOYSA-N 382.270 5.244 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(Oc2ccc(C)nn2)cc1)c1ccccc1 676445886 NUZBDTGEGWTEBS-NRFANRHFSA-N 388.471 5.406 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1sc(C)nc1C 726737332 OGZDMHVUEQGOQR-UHFFFAOYSA-N 397.504 5.407 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 727955123 YSFYKGKOOIIFKZ-XIKOKIGWSA-N 389.282 5.007 30 20 GKED CCN(CC)[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 729521351 XJEYSGRPIMHNSK-LOSJGSFVSA-N 397.522 5.364 30 20 GKED Cc1ccc(C2CC(=Nn3c(C)nc4sc5c(c4c3=O)CCCCC5)C2)cc1 729816634 MLZGDKPFZZDFLW-UHFFFAOYSA-N 391.540 5.125 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 731136689 UZSXAAXCPCCAJH-YOEHRIQHSA-N 380.900 5.636 30 20 GKED C/C(=C\C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1)c1ccccc1Cl 731645923 UPGUYNYDODDPAV-XLNAKTSKSA-N 378.781 5.143 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4ccccc4)cc3)cc2)nc1 731955610 PCBJZEIJSBRFLU-UHFFFAOYSA-N 391.430 5.665 30 20 GKED O=C1/C(=C/c2ncc(-c3ccc(Br)cc3)[nH]2)CCc2ccccc21 732714169 SMMSSICIXHCOKR-RVDMUPIBSA-N 379.257 5.052 30 20 GKED CC(C)(Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 733053739 MTDIODJDDYRFED-AWEZNQCLSA-N 388.851 5.123 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1ccncc1 734664779 RCHIYIBYYMZNPK-WOJBJXKFSA-N 397.931 5.503 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(SC(F)F)cc1 734981821 UNJNXJWLBAHXII-ZZXKWVIFSA-N 379.478 6.082 30 20 GKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccc2c(c1)COC2 742437369 UCPAUTFXOULVIO-VQHVLOKHSA-N 377.421 5.250 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@H](C)c1ccccc1[N+](=O)[O-] 742703875 KZXZLDMDTJBBGH-QGZVFWFLSA-N 387.439 5.527 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C=C(\C)c1cccc(Cl)c1 750684311 PVPXRMUPIGVHBC-IZLCOFNUSA-N 394.902 5.216 30 20 GKED O=C(Nc1cccc(C=NO[C@H]2CCCCO2)c1)c1ccc(Cl)cc1Cl 755823682 YVUFUYRZHNXVLW-SFHVURJKSA-N 393.270 5.123 30 20 GKED C#CC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 757761527 NALSHLXIYMOVOH-BJKOFHAPSA-N 379.463 5.228 30 20 GKED N#Cc1cnc(NC(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)s1 759625970 HJBOTANWULMPLU-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)Sc1nc2ccccc2s1 762508854 KTLXTTILSGQSSS-CYBMUJFWSA-N 397.525 5.074 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)c(N)c(Cl)c2)cc1 763800154 LJMGDBPQGOAKJF-KRWDZBQOSA-N 396.277 5.483 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(-c3ccncc3)cc2)cc(OC)c1OC 772953742 LYEFLGIJCZTZLN-GOSISDBHSA-N 388.511 5.345 30 20 GKED COc1ccc(/C=C2/CCOc3cc(Cl)ccc3C2=O)cc1OCCCC#N 774560861 WYWXDFYWHZHIHM-VBKFSLOCSA-N 397.858 5.080 30 20 GKED CCCN(C(=O)Cc1ccccc1CC#N)[C@H](C)c1ccccc1Br 776825179 UTRFTYINPISBOS-MRXNPFEDSA-N 399.332 5.057 30 20 GKED C[C@@H](NCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1ccc(OCC#N)cc1 785568984 ASUMFPNDFIFMBG-CQSZACIVSA-N 392.396 5.129 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCC(F)(F)F)c(Cl)c2)c1 799900552 MRYXIYZWNMGJKG-UHFFFAOYSA-N 384.810 5.071 30 20 GKED N#C[C@H](C(=O)C1(C(F)F)CCCC1)c1nc(-c2c(F)cccc2F)cs1 808981989 ZWFBEKMNOAHKDX-SNVBAGLBSA-N 382.382 5.090 30 20 GKED Cc1cc(C(C)(C)NCc2ccc(O[C@@H](C)C#N)cc2)ccc1Br 810181901 WLDVOHIDOLURMN-HNNXBMFYSA-N 387.321 5.073 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1 836497816 XFGFPLKKLSEWJY-BEFAXECRSA-N 383.879 5.390 30 20 GKED FC(F)(F)Oc1ccc(NN=Cc2ccccc2OCc2ccncc2)cc1 914695535 ZSHNJHZUFMZANS-UHFFFAOYSA-N 387.361 5.005 30 20 GKED CCc1ccccc1NN=Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 915051277 BMLFKXDOXHJDMZ-UHFFFAOYSA-N 398.919 5.490 30 20 GKED N#C[C@H](C(=O)CSCc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 915101734 HSWSEFMVLHXDGU-QGZVFWFLSA-N 382.485 5.059 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(C)cc1 915353531 VASLNONAULNBHW-RPWUZVMVSA-N 383.495 5.923 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917027236 ZJHZZKHBBDVORI-UKRRQHHQSA-N 398.940 5.821 30 20 GKED N#C[C@@H](C(=O)Cc1ccc2ccccc2c1)c1nc2cc(Cl)ccc2s1 917045845 BFVJVYDUKSGNDO-KRWDZBQOSA-N 376.868 5.522 30 20 GKED CCN(C(=O)/C=C\c1ccccc1OC(F)(F)F)[C@H](C)c1ccc(C#N)cc1 919862536 MDNAQJQTTVLGGR-WIDZWVOGSA-N 388.389 5.080 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccccc2OC2CCCCC2)c1)C(=O)O 1776471052 DPSCHADFMPRIDK-XUZQSEFNSA-N 394.467 5.146 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CC3(CCC3)CC[C@H]2C(=O)O)cc1 1776785848 JGPVMYULPUOYAY-NRFANRHFSA-N 385.548 5.449 30 20 GKED CCCCCCCOc1ccc(CNCC[C@@H](Cc2ccccc2)C(=O)O)cc1 1776786331 QQQFIRDWBNWGHD-QHCPKHFHSA-N 397.559 5.459 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)cc1 22730936 YGVPIMBWDXTCNQ-UHFFFAOYSA-O 381.546 5.012 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)nc2)cc1Cl 46861733 ZVBHQFAKUKHUCI-QGZVFWFLSA-N 382.250 5.296 30 20 GKED N#Cc1ccc(CNCc2ccccc2-c2ccc(CN3CCCC3)cc2)cc1 48711145 NUNYRWGROWDLKD-UHFFFAOYSA-N 381.523 5.111 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccccc2C)cs1 54897267 DKVPNALMIWMDBP-FMIVXFBMSA-N 380.444 5.171 30 20 GKED CCc1ccc2c(CNc3ccc(Oc4ccccc4C#N)cc3)cc(=O)oc2c1 72030873 JHCIJGJVNPILST-UHFFFAOYSA-N 396.446 5.631 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)s1 108529247 CERRWPSHFISOSY-JSGCOSHPSA-N 388.562 5.237 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 112128359 XKOMAJRKLPVYCV-JKSUJKDBSA-N 377.579 5.220 30 20 GKED CCN(C(=O)c1ccc(-c2ccccc2Cl)o1)[C@H](C)c1ccc(C#N)cc1 116840848 JDBJYZUAYKEKSJ-OAHLLOKOSA-N 378.859 5.695 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 129671815 RNLCBNPBIFQSHF-UHFFFAOYSA-N 390.251 5.366 30 20 GKED CC(C)c1cc(Br)ccc1NCc1nnc(-c2ccc(C#N)cc2)o1 133482365 BTIFLSSOMRFNAE-UHFFFAOYSA-N 397.276 5.106 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(C(=O)N2CCCC2)cc1C)c1ccccc1 155481693 AYCOYBXWCYMOKA-QFIPXVFZSA-N 391.515 5.060 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccccc1 155771005 MPYNFWKCTAWXCO-HSZRJFAPSA-N 393.531 5.273 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)c1nc2cc(Cl)ccc2s1 161420266 LQHNOTGOLXHSNH-HNNXBMFYSA-N 377.856 5.349 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(COCc4ccccc4)cc3)cc2)CC1 181102696 FWNKQYFLNJFZJM-UHFFFAOYSA-N 382.463 5.211 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cn2nc(C)cc2C)cc1 189893981 MHXQMRZHEVRVLN-UHFFFAOYSA-N 387.527 5.652 30 20 GKED CSc1ccccc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 193437892 AXCZLCSLDXLQHK-UHFFFAOYSA-N 388.492 5.306 30 20 GKED O=C(/C=C\c1cn(Cc2ccccc2)nc1-c1cccnc1)c1ccc(F)cc1 212552366 GBFHMIJOYWPDLM-RAXLEYEMSA-N 383.426 5.029 30 20 GKED Cc1ccccc1-c1csc(NC(=O)CCCCOc2cccc(C#N)c2)n1 303450983 JNTXYDKLYCLILE-UHFFFAOYSA-N 391.496 5.178 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(Br)ccc1F 303451774 FEAXCQBMKZJBFR-UHFFFAOYSA-N 395.231 5.379 30 20 GKED O/C(CC1(Cc2nc3ccccc3s2)CCCCC1)=N/[C@H]1CCCOCC1 329456150 MVGQQDJUDPBYOX-KRWDZBQOSA-N 386.561 5.705 30 20 GKED OC(=Nc1nc(C/C(O)=N/[C@@H]2CCCCC23CCCC3)cs1)c1ccccc1 329618639 LZJNJKDEZHADQG-GOSISDBHSA-N 397.544 5.781 30 20 GKED CC(C)(c1ccc(C(=O)Nc2ccc(Cl)cc2CC#N)cc1)C(F)(F)F 410971306 SITIEKONJHZIMS-UHFFFAOYSA-N 380.797 5.498 30 20 GKED C=CCOCCSCc1nc(O)c2c(-c3ccc(C)cc3)c(C)sc2n1 419350903 XMVQAGYFWJCDSK-UHFFFAOYSA-N 386.542 5.117 30 20 GKED C=CCn1c(SCc2ncccc2C(F)(F)F)nnc1-c1cccc(C)c1 428067498 ATQNWDXQLYROAW-UHFFFAOYSA-N 390.434 5.146 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCn1nc(C#N)c2ccccc21 432476605 KEMXCMJUJLYKMO-UHFFFAOYSA-N 394.906 5.105 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@@]12CCCc1ccccc12 440634960 JIEPHZTVISNHHI-ZDWFVDTJSA-N 376.525 5.171 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C(C)(C)c1csc(-c2cccs2)n1 443417211 PFTMSIACXKGVLE-UHFFFAOYSA-N 397.525 5.058 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccc(C#N)cc1 445232678 BRGVOSAYCCQYGC-QLJPJBMISA-N 399.775 5.015 30 20 GKED CC(C)c1ccccc1N(C(=O)CC(C)(C)C#N)c1nc2ccccc2s1 447179215 YHSHVHCFINOWCH-UHFFFAOYSA-N 377.513 6.024 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1cc(C)ccc1C 453462797 IPYKWGRISHAQCK-LEWJYISDSA-N 380.536 5.054 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CC(Oc2ccc(C#N)cc2)C1 461963807 HNAKDNHXVQYFCI-UHFFFAOYSA-N 377.488 5.100 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 465021810 AHZLQVNDHGZHKM-ZDUSSCGKSA-N 377.271 5.407 30 20 GKED COc1cccc([C@@H](NC(=O)Nc2ccc(C#N)cc2)c2ccccc2Cl)c1 466053786 VHCBBJODXGYTCO-OAQYLSRUSA-N 391.858 5.131 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nnnn1C1CCCCC1 468834323 DWTGAMQQQXVRKA-MRXNPFEDSA-N 388.475 5.015 30 20 GKED Cc1c([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)oc2ccccc12 468908337 IABCOUUJIOMJRV-KRWDZBQOSA-N 387.483 5.497 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3C[C@H](c4ccccc4)[C@H]4CCCC[C@@H]43)on2)c1 469335266 ORJHLGNWLKKRDB-XPNTWCBSSA-N 397.478 5.012 30 20 GKED C=CCN(C(=O)CCc1cnc2ccccc2c1)c1nc(-c2ccccc2)cs1 470735117 ZKWKDUTYBYLRGN-UHFFFAOYSA-N 399.519 5.510 30 20 GKED C=C[C@](C)(CC)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 473558088 XSZIKSBZHFPOOG-XMMPIXPASA-N 391.515 5.126 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccc(OC)cc1)C1CC1 475545553 FCGQTHOJNZEFAP-JOCHJYFZSA-N 378.516 5.820 30 20 GKED C[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nc2ccccc2[nH]1 479513681 UWVNSNBJBNJTLZ-OAHLLOKOSA-N 398.491 5.077 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc2ccccc2n1 480035582 NCKRSDAGZCAHIQ-UHFFFAOYSA-N 395.487 5.534 30 20 GKED Cc1csc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1Cl 480149689 PGXGISUONLQQKM-UHFFFAOYSA-N 382.872 5.413 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 483858300 KEHIKKIJEWNEEY-UHFFFAOYSA-N 395.846 5.215 30 20 GKED C=CCn1c(S[C@@H](C)c2cnc(C)cn2)nnc1-c1ccc(C(C)(C)C)cc1 488260892 WNDPYVZWVUOANO-INIZCTEOSA-N 393.560 5.380 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)c(Cl)c1 494589959 CBYCSCKQOXYJAZ-UHFFFAOYSA-N 388.279 5.170 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 495320144 YHZAKVOYBVVPGC-UHFFFAOYSA-N 398.503 5.056 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1sc2nc(C(F)(F)F)ccc2c1C 496691447 VCXBFXCQGJEKBA-UHFFFAOYSA-N 394.418 5.087 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)C2CC2)cc1 498356428 SLTXOMZXIKNFTG-JOCHJYFZSA-N 389.474 5.007 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4cccnc34)c2)cc1 501472316 DLJAEKRBZSWIDZ-UHFFFAOYSA-N 393.446 5.132 30 20 GKED Cc1ccc(Cc2nc(C(=O)Nc3ccccc3SCCC#N)cs2)cc1 507423740 MJIICHUSZKVFSC-UHFFFAOYSA-N 393.537 5.300 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2ccccc2Oc2ccncc2)cc1 509297674 DHHAZCHYTZJXTC-NRFANRHFSA-N 385.467 5.166 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)C(=O)Nc1c(C)cccc1C(C)C 512506704 OXRATCCYRREWHE-HXUWFJFHSA-N 396.579 5.301 30 20 GKED C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CCC(CCC#N)CC1 518526182 LUUJSEDZKUDKDG-GFCCVEGCSA-N 379.291 5.120 30 20 GKED N#CCCn1cc(/C=C\c2nc(CCCc3ccccc3)no2)c2ccccc21 518876777 CIQUUSILABRSRM-PFONDFGASA-N 382.467 5.284 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519065480 OSYBAXQADRJWIP-QGZVFWFLSA-N 385.467 5.352 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@H](c4ccccc4)C3)c2)cc1 520603686 WHNYPQUBUZEDHJ-FQEVSTJZSA-N 383.451 5.372 30 20 GKED CN(C(=O)CC1(Cc2nc3ccccc3s2)CCCCC1)C1(C#N)CCC1 520721822 ZRWMDYAITIHCQS-UHFFFAOYSA-N 381.545 5.084 30 20 GKED C[C@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 521810956 LZUHCZSNIMMCHA-MRXNPFEDSA-N 375.428 5.086 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(Cl)cc2[nH]1)c1cccc(Cl)c1Cl 524572695 NXODGDYLZFOCBZ-OAHLLOKOSA-N 378.646 5.123 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccccc1OCC1CC1 524896464 YHSWMOMCVZCIHK-OAHLLOKOSA-N 381.501 5.371 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1oc(CC2CC2)nc1C 530390910 FEARTZLUOQQWDO-UHFFFAOYSA-N 387.439 5.160 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC[C@H]2c2ccccn2)cc1 530882946 YPKCZORJHPLLHA-NRFANRHFSA-N 385.492 5.082 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cn(C)nc3-c3ccccc3)n2)cc1 536766345 FFNYMHBDHIIGFL-GOSISDBHSA-N 398.491 5.009 30 20 GKED CCC[C@H](NCCC(=O)Nc1sccc1C#N)c1cccc(C(F)(F)F)c1 539262928 PCEAZHLNGFEWGR-INIZCTEOSA-N 395.450 5.098 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl)c1ccncn1 544816061 SYIBMBWEVQSNHY-QMMMGPOBSA-N 382.659 5.142 30 20 GKED N#CC1(c2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)CCCCC1 545701326 RKNPHOUDRYSVEQ-UHFFFAOYSA-N 380.835 5.303 30 20 GKED C[C@H]1C(=O)CC[C@@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1(C)C 548366734 FDUZKIXVFUQNRV-YOEHRIQHSA-N 394.446 5.070 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3ccccc3Cl)s2)CC1 548857887 QKGUFQIWCUOCAA-UHFFFAOYSA-N 393.943 5.521 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cncc(-c2ccc(C)cc2)c1 553121452 WGZJUHCXPUBIBX-UHFFFAOYSA-N 388.515 5.053 30 20 GKED N#C[C@@H](C(=O)c1cccc(CN2CCCC2)c1)c1nc2cc(Cl)ccc2s1 554002071 WQJDTESNBSXRNX-KRWDZBQOSA-N 395.915 5.036 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc2n[nH]cc2c1 554193703 DXKBPXALUXPTKG-HNNXBMFYSA-N 397.438 5.110 30 20 GKED COCC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1ccc(Cl)c(Cl)c1 556610021 PQFNRZNBWOACLA-BUXKBTBVSA-N 381.278 5.433 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1csc(-c3cccc4ccccc34)n1)CC2 558319292 MVLIQIWXUYWIPW-UHFFFAOYSA-N 381.460 5.038 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H]1c2ccccc2CC12CCOCC2)c1ccccc1 564581371 LKPJAJVGHPDALH-PKTZIBPZSA-N 390.527 5.087 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(C(F)F)ccc1Cl 573333511 REXGEDLFBFOUQS-UHFFFAOYSA-N 382.797 6.069 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2nc(-c3ccccc3F)cs2)CC1 583116031 MIPCVJBCXNBBAF-UHFFFAOYSA-N 391.515 5.443 30 20 GKED N#Cc1ccc2c(c1)[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC2 589337261 VERLXPWMCJSZQO-XJKCOSOUSA-N 376.344 5.045 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(NC(=O)c3cccs3)cc2)c1 589382702 YJFWKGGBFKTLTI-UHFFFAOYSA-N 392.480 5.208 30 20 GKED C[C@H](Oc1ccc([C@@H](C)NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1)c1ccccc1 595640855 VOUZZFHVWKDYCL-GHDARCQNSA-N 391.515 5.269 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccccc1F)CC1CC1)c1ccccc1 596605429 CUCQZZDQVDLCAU-JOCHJYFZSA-N 379.479 5.182 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2C[C@@H]3CCCC[C@@H]32)cc1Cl 596692239 ZTSXNHQASVYWDJ-LRQRDZAKSA-N 379.891 5.402 30 20 GKED N#CCc1cccc2c1CCN(C(=O)C[C@H](Cc1ccccc1)c1ccccc1)C2 600784185 YWLVFZHAEFBUDX-VWLOTQADSA-N 394.518 5.054 30 20 GKED COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C(C)(C)C#N)cc2)cc1 602759506 LNFKPBISGJDKBP-HSZRJFAPSA-N 397.478 5.267 30 20 GKED C=CCN(C(=O)C[C@@H]1CCOC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 606762426 FISOJUMVFCIKRA-LBPRGKRZSA-N 397.327 5.063 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccccc2C)n1 608935719 FISLHCOSFOBMDC-UHFFFAOYSA-N 375.497 5.043 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCCCOC2CCCC2)c1 609724162 AJRKJQFECIBXQT-UHFFFAOYSA-N 398.890 5.083 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 613836955 SFLQAVAFEAPAJY-LBPRGKRZSA-N 379.312 5.084 30 20 GKED CCC1(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)CCC(F)(F)CC1 619129622 SSCJSHWVQHHKGC-UHFFFAOYSA-N 397.350 5.762 30 20 GKED Cc1nc(NC(=O)C[C@@H](CC#N)c2ccccc2)sc1Cc1ccccc1 619429932 YFDWBCGZTXELKQ-LJQANCHMSA-N 375.497 5.068 30 20 GKED COc1ccc(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)cc1F 665598592 JLAFDOLFWJUPEF-UHFFFAOYSA-N 390.299 5.009 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc2cc(F)ccc2s1 676591838 USHHIQXPCUYPRX-CYBMUJFWSA-N 379.441 5.049 30 20 GKED Cc1cccc(F)c1NC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 680877184 DQIVOXCMRJTEFN-NXEZZACHSA-N 386.311 5.165 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)N2CCC(C3CCCCC3)CC2)c1 726502653 DBYOXEISAZVIFB-UHFFFAOYSA-N 392.499 5.163 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(N4CCCC4)cc3)c2)cc1 728458214 AJBPUABRJZIIEO-UHFFFAOYSA-N 383.451 5.203 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CCC#N)CCC(C)C)c3ccccc3n2)o1 728870976 CPXWIDICMCDXNL-UHFFFAOYSA-N 375.472 5.205 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730417130 LBQRKBQCVDINHK-XBMZPMPPSA-N 378.472 5.623 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 733634259 FJEXCTGMUZNJNK-UHFFFAOYSA-N 379.485 5.464 30 20 GKED COCCOc1ccc(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)cc1 734304481 LACNOTZUOJZGQO-VAWYXSNFSA-N 379.481 5.040 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)o1 734304830 XOHDLEUSYQGYHI-NTMALXAHSA-N 391.398 5.247 30 20 GKED C[C@@H](OC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1cccnc1 735165279 FMKYAUKUEYCBEC-CQSZACIVSA-N 378.815 5.317 30 20 GKED CC(C)Oc1ccccc1/C=C/C(=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 741447442 LEPAQRNCYHYRCI-DTQAZKPQSA-N 398.524 5.086 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc3cccnc23)cc1 745267982 HFQHOYVBMLEMNN-QHCPKHFHSA-N 392.462 5.212 30 20 GKED O=C(/C=C/c1cnn(Cc2ccccc2Cl)c1)c1ccc(-c2ccncc2)cc1 745990574 VBCQNSGFCMSOLV-BJMVGYQFSA-N 399.881 5.543 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(F)c(Br)c2)ccc1SC 746342320 RLRLZHZNJUEOBF-CLTKARDFSA-N 381.266 5.215 30 20 GKED C[C@H](NC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccc(C#N)cc1 748990469 YHMLVTHJDJUKPR-HNNXBMFYSA-N 382.895 5.085 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1cccc(Cl)c1 750684274 OYTYVMVEZPEINZ-IURSYISVSA-N 388.854 5.244 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1sccc1Br 751512904 BHTJMIFFNASKJV-ONEGZZNKSA-N 382.329 5.592 30 20 GKED C=CCC[C@H](C(=O)O[C@@H](C)c1nnc(-c2cccc(C)c2)o1)c1ccccc1 753423419 RAMKCMUJUVDFIY-PXNSSMCTSA-N 376.456 5.399 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@H]2/C=C\c2ccccc2)c1 753876662 OMGSXIUJZJITJV-HJBMFWNLSA-N 375.472 5.079 30 20 GKED C#CC[C@@H](NCc1ccc(OCc2cccs2)c(OC)c1)c1ccccc1 756995341 GMTIERHILOYLAL-OAQYLSRUSA-N 377.509 5.190 30 20 GKED COc1ccc(C[C@H](C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 758409792 MQAUVSKUKJAGBV-MHECFPHRSA-N 384.479 5.168 30 20 GKED CCCn1c(-c2ccc(OCC#N)c(OC)c2)nc2cc(C(F)(F)F)ccc21 758481926 ZXPWCJUSBHSTFM-UHFFFAOYSA-N 389.377 5.043 30 20 GKED N#C[C@H](C(=O)CC12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)c1nc(-c2ccncc2)cs1 759462292 LEWWAQIRIMFQQE-PYHYNLKWSA-N 395.503 5.080 30 20 GKED CC(C)c1ccc(C2(C(=O)Nc3ccc(F)cc3OCC#N)CCCC2)cc1 760790642 ZCYDTMDVMFSABS-UHFFFAOYSA-N 380.463 5.302 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc3ccc(Br)cc3n2)c(F)c1 771521357 QRBFRORLEFOZRI-RMKNXTFCSA-N 386.220 5.041 30 20 GKED C=C[C@H](CC(=O)N(Cc1ccccn1)c1ccc(N(C)C)cc1)c1ccccc1 776393320 UTZVXLLKQGWULY-HXUWFJFHSA-N 385.511 5.041 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(N2CCCCC2)c(F)c1 776841826 QTQHOYZUFXRQAX-SFHVURJKSA-N 381.495 5.672 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Br)cc2)c2ccccc2F)cc1 779017646 JMXJWAUTQVOWST-OAQYLSRUSA-N 395.275 5.339 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1 780156072 CQVIYEGKSVCNJP-LUJRCDHRSA-N 392.455 5.357 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 780676821 FVNIVMLWNQNUJH-DYESRHJHSA-N 391.515 5.644 30 20 GKED Cc1ccc2c(C)cc(NN=Cc3c(C(F)(F)F)nn(C)c3Cl)nc2c1C 781585552 NPUZXIXKOYDSBB-UHFFFAOYSA-N 395.816 5.012 30 20 GKED C[C@H](OC(=O)c1cccc(F)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 784648265 YOHZJXAWCNCNGL-QMMMGPOBSA-N 381.247 5.176 30 20 GKED C#CCCCCCC(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 791235422 DNMXIIIDPYTSRT-UHFFFAOYSA-N 396.556 5.108 30 20 GKED Cc1csc([C@H](C#N)C(=O)CS[C@H](c2ccccc2)c2ccc(F)cc2)n1 801660871 JFAKYAYCOVPKJS-UYAOXDASSA-N 396.512 5.290 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2cc(C)ccc2s1 810529577 JTRAEJXWLFJADX-SFHVURJKSA-N 390.508 5.296 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2csc(-c3ccc(Cl)cc3)n2)SC1=S 814291970 ICPDNODNXCWJGG-AUWJEWJLSA-N 392.958 5.241 30 20 GKED CN(CCC#N)c1ccc(C=NN(Cc2ccccc2)Cc2ccccc2)cc1 916368146 XFQXJRAARZWZQU-UHFFFAOYSA-N 382.511 5.073 30 20 GKED CCCc1sc(C(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1CC 916898332 BEDOECLEQVTAGQ-GOSISDBHSA-N 396.556 5.349 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)sc1C 916915554 FLCHIHRXPHWJGX-GOSISDBHSA-N 376.481 5.123 30 20 GKED CC(C)(C)n1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C1CC1 917119367 AQQCRDVFWHMYBH-NRFANRHFSA-N 398.510 5.423 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(C)c2)cc(Br)c1OC(F)F 917144294 DPUFZKYLJKKMBD-VOTSOKGWSA-N 397.215 5.264 30 20 GKED C[C@@H](/N=C\c1cc2ccccc2nc1O)c1cccc(OCc2ccccn2)c1 917559582 PSZBKHQDGRKQGD-LNIIIOKPSA-N 383.451 5.095 30 20 GKED COc1cc(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)cc(OC)c1OC 918714207 WJFQHBZWMNITTE-KTKRTIGZSA-N 395.480 5.040 30 20 GKED Cc1c(NN=Cc2ccc(OCc3ccc(Cl)cc3)cc2)cccc1C(=O)O 1776086236 IYGVYWAJODSYRY-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2F)cc1 1776125325 DOMUVKLOCSPHRW-QINSGFPZSA-N 384.447 5.769 30 20 GKED O=C(O)c1cc(F)c(/C=C\C(=O)c2ccccc2OCc2ccccc2)c(F)c1 1776126069 BEHVRVKDDUAPNN-KHPPLWFESA-N 394.373 5.138 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776339885 MYJXGMVBZHCKKK-CLFYSBASSA-N 382.456 5.833 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1/C=C/C(=O)c1cccc(C(=O)O)c1 1776385229 LYSUQYLCSWILAD-VAWYXSNFSA-N 394.858 5.243 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2ccc(CC(=O)O)cc2)cc1OC 1776789330 UHXNBWMESTVHMZ-LCYFTJDESA-N 396.483 5.178 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776817312 UKIPQNROCZNBLX-BNCCVWRVSA-N 386.447 5.737 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(F)cc2)=C(/S)Nc2ccc(C)c(C)c2)cc1 27092458 ICVPKWKGWXCVCC-UHFFFAOYSA-O 393.507 5.089 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(Cl)ccc1F 33196183 SHIBEKJVSDORFY-HTQZYQBOSA-N 391.714 5.118 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl 63640953 YMWRHRCLZXLTCU-LBPRGKRZSA-N 392.286 5.091 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCCCN(C)c1ccccc1 65489279 OKIHWENYYWTVCR-UHFFFAOYSA-N 391.968 5.016 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108528557 KQOZOLJETDYFIK-PXNSSMCTSA-N 379.529 5.616 30 20 GKED O=C(/C=C/c1cc(-c2ccccc2)cs1)c1ccc(C(F)(F)F)[nH]c1=O 109195791 ZYOLWCXMEAOGTP-SOFGYWHQSA-N 375.371 5.018 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CCCc1ccccn1 133487733 CXDUKMNZRSWFJT-UHFFFAOYSA-N 389.886 5.163 30 20 GKED N#CC1CCN(C(=O)c2oc3ccccc3c2CSC2CCCCC2)CC1 147102866 FPSZFJXKZFYEMS-UHFFFAOYSA-N 382.529 5.374 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(CCC(F)(F)F)cc1 152075245 JEFBGLFRSOMDKU-KRWDZBQOSA-N 398.384 5.177 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1cccc2ccccc12 170974434 OBQFSUUTFKSEDV-INIZCTEOSA-N 376.481 5.109 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nc2ccccc2o1 175619683 PJLLFCKNVQXQRX-UHFFFAOYSA-N 385.448 5.127 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4[nH]ccc34)c2)cc1 176045150 OFPHOTOQDJQQFC-UHFFFAOYSA-N 381.435 5.065 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H](C)c2cccc(C(F)(F)F)c2)n1 177765083 CKANHGGQAGLZCO-IUODEOHRSA-N 380.435 5.655 30 20 GKED C=C[C@H](CC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1)c1ccccc1 180287593 XAZZNOHGAHLRHH-OAHLLOKOSA-N 393.468 5.041 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2oc3ccccc3c2C)ccc1OC 180813561 XZIGNQUQJFUWFN-WMZOPIPTSA-N 378.472 5.282 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1ccc(-c2cccnc2)cc1 181231207 ACBUODPJGHBOCA-OAHLLOKOSA-N 392.300 5.234 30 20 GKED O=C(/C=C\c1cnc2ccc(Br)cn12)c1ccc2ccccc2c1 210215825 BNGCZLOQPBVPAO-HJWRWDBZSA-N 377.241 5.146 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)s1 255639067 NVIAYCQVSHMDEK-YDZSZYSISA-N 393.537 5.454 30 20 GKED CN1CCCC[C@@H]1CCC(O)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329248458 SMQGESNWWVEQSV-GOSISDBHSA-N 389.515 5.847 30 20 GKED CC(C)(C)C(O)=Nc1nc(C/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cs1 329573196 AGQKODKJCVRFJV-SOUVJXGZSA-N 377.554 5.635 30 20 GKED O/C(CC/N=C(/O)C12CC3CC(CC(C3)C1)C2)=N/[C@@H]1CSc2ccccc21 329685091 ZUUHHWZGSRXANS-XCLLZBPDSA-N 384.545 5.353 30 20 GKED Cc1ccc(-c2cnc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)s2)c(C)c1 330030571 RWCMYBBRDMEAPH-UHFFFAOYSA-N 397.544 5.940 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1Cl 330588601 WXAPIXIUBRFSIJ-BREBYQMCSA-N 379.209 5.043 30 20 GKED CCS[C@@H]1CCC[C@@H](/N=C(/O)c2ccc(C)c(N=C(O)NC(C)(C)C)c2)C1 331120518 OMGCSTOTTIYOBA-IAGOWNOFSA-N 391.581 5.298 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cc(F)c(F)cc2Br)c1C#N 410931908 WCKSOTQKUZNJEK-UHFFFAOYSA-N 399.260 5.210 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)c(C)c2c1 425471121 GOANAJIQDUAEBP-HZPDHXFCSA-N 391.471 5.085 30 20 GKED C=CCC1(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)CCOCC1 425474095 YHHNENABRAANFD-UHFFFAOYSA-N 388.558 5.223 30 20 GKED CC(C)c1c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cnn1-c1ccccc1 425674308 BCBQILRBAQGLNL-KRWDZBQOSA-N 387.487 5.092 30 20 GKED COc1ccc(CNC23CCC(C(F)(F)F)(CC2)CC3)cc1OCCCC#N 425956792 FVTCWJIVGVJDOL-UHFFFAOYSA-N 396.453 5.123 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c(Cl)c1 431821827 GVCCIGRKEROYIV-GOSISDBHSA-N 375.806 5.249 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 431873802 AVQRNUXOJXSVMP-IFXJQAMLSA-N 390.314 5.789 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCS1 432868476 WNSFBZVEFSORMS-UHFFFAOYSA-N 381.501 5.100 30 20 GKED N#CCCC[C@H](NCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 433007933 BOXOHWDUTKZWLM-QHCPKHFHSA-N 383.495 5.317 30 20 GKED CN(Cc1cc(F)cc(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 434136371 FLAWFWWAQUMGJV-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1 435095413 QNAASMOQSNORCU-FXAWDEMLSA-N 375.472 5.409 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2C2CCC2)cc1F 438660953 OXNWBWQNRNDRQH-LJQANCHMSA-N 379.435 5.286 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)c1 438669623 BDRYDZPOIADGGU-UHFFFAOYSA-N 388.374 5.029 30 20 GKED COc1ccccc1[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 438864151 NXDPATYIDRLYJQ-ISKFKSNPSA-N 399.494 5.129 30 20 GKED N#CC1CCC(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 441379793 PRPQHKVEDUTIPD-UHFFFAOYSA-N 399.878 5.460 30 20 GKED CC[C@]1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 443572154 RZWLCQGKRKSPNH-SIKLNZKXSA-N 397.906 5.028 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCc1ccc(Cl)c(Cl)c1 464943305 LQPYVNVQGKPVKM-PXNSSMCTSA-N 387.310 5.224 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)Nc1ccccc1CCC(F)(F)F 465166057 NFJHICGWTSGIAM-UHFFFAOYSA-N 391.393 5.484 30 20 GKED CC(C)(C#N)CCCN1CCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl 472237624 ITQHSMAYDWPKCC-QGZVFWFLSA-N 382.335 5.116 30 20 GKED Cn1c(-c2cccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2)nc2ccccc21 475166972 YYBNRULRKCVZMQ-UHFFFAOYSA-N 394.478 5.294 30 20 GKED CC1(C)CN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)[C@H]1c1ccncc1 476596818 MFOZBQNTXWAQNQ-QFIPXVFZSA-N 399.519 5.328 30 20 GKED C[C@H](C1CC1)n1nccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 480863673 DLYCYNNMLCLFSU-OAHLLOKOSA-N 388.496 5.129 30 20 GKED C=CCN(C(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 483085994 PQWWQZBLQXFQCN-FQEVSTJZSA-N 387.508 5.417 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(F)cc(Br)c1 484747956 BKMRFLMFJSCQSF-GFCCVEGCSA-N 379.298 5.452 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccsc3)s2)sc2c1CCCCCC2 487022107 AQTOCCHPIYIOEG-UHFFFAOYSA-N 399.566 5.716 30 20 GKED CN(c1ccccc1)c1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cn1 487469918 HCJFPPQJMBFIHQ-JOCHJYFZSA-N 384.483 5.014 30 20 GKED CCN(C(=O)c1ccc(C#N)s1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 487641357 XSNXNWBSKCCGIR-JOCHJYFZSA-N 389.524 5.390 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N[C@H]2CCCC(F)(F)C2)c1 488980255 NNHSDNOUMFHQSX-AWEZNQCLSA-N 390.817 5.312 30 20 GKED N#CCCCOc1cccc(NCc2c(-c3ccccc3)nc3ccccn23)c1 495595709 XQIBNIJGKGASOK-UHFFFAOYSA-N 382.467 5.296 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N[C@H](c1cccc(F)c1)c1ccccn1 497548987 MLKBWJXUQRMOEY-OAQYLSRUSA-N 390.368 5.120 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)N[C@@H](CCC#N)c1ccccc1 500117920 BTGVDPUVYRNCMO-NYVOZVTQSA-N 391.515 5.223 30 20 GKED COc1ccc(F)cc1NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 508955120 ZZDGTDLPQMGHKQ-UHFFFAOYSA-N 381.247 5.124 30 20 GKED COCCCCN[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 509007449 RKTKREFDAHOKFZ-GFCCVEGCSA-N 397.281 5.344 30 20 GKED Cc1sc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 512630238 LWBRXWYHFDSYPL-QWHCGFSZSA-N 399.922 6.195 30 20 GKED CCCOc1ccccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513108655 QTLKOZHZIDNDFA-UHFFFAOYSA-N 386.451 5.178 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)NC2CCCCCC2)cc1 513885726 WOXSOBDUCAHIQF-UHFFFAOYSA-N 379.479 5.132 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)c1 517099400 ZUSMRMQEQYOJDD-MSOLQXFVSA-N 388.389 5.130 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cc2ccccc2o1 518168813 LHCRXPUAISKYHL-JKSUJKDBSA-N 393.512 5.909 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 518174478 BSKMWSYXJHCJRU-HNNXBMFYSA-N 386.929 5.693 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(C3CC3)[C@H]3CCc4ccccc43)cc2)nc1 521090289 FWHFFUUNCUJNQI-QHCPKHFHSA-N 395.462 5.038 30 20 GKED C=CCN(CCc1ccccc1)C(=O)NCc1ccc(-c2csc(C)n2)s1 521680067 USEPCSBRSWXTTL-UHFFFAOYSA-N 397.569 5.120 30 20 GKED COc1ccc(Sc2ccc(NC(=O)CCc3ccc(C#N)cc3)cc2)cc1 524458761 FVIVMNMDEJDCCN-UHFFFAOYSA-N 388.492 5.289 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)N(Cc1ccccc1)Cc1ccccc1 525081895 UZWAVEQKPYIDJE-LJQANCHMSA-N 386.520 5.268 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc2ccccc2c1 525234292 DBRAAZWKPSGKOK-MRXNPFEDSA-N 375.497 5.556 30 20 GKED N#Cc1ccc(C(=O)N2CCC(CCc3cccc(C(F)(F)F)c3)CC2)s1 530668724 QLSMDBDJNCKEBM-UHFFFAOYSA-N 392.446 5.124 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2ccc(CC#N)cc2)cc1 534671013 CGFANBCYRILIKP-GOSISDBHSA-N 384.479 5.261 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2c(-n3cccc3)sc3c2CCC3)n1 534715908 FZWABXWZKWUHFE-CQSZACIVSA-N 381.526 5.097 30 20 GKED Cc1ccc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c(Br)c1 535093637 DIJZEJNVAGJHNI-AWEZNQCLSA-N 398.087 5.059 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)NCCCC#N 542397194 LKWKPZSXYPDEEF-UHFFFAOYSA-N 393.466 5.157 30 20 GKED C=C[C@H](Cc1nc([C@@H](OC)c2ccc(Br)cc2)no1)c1ccccc1 545103765 CRXOAESDYIJFSY-KUHUBIRLSA-N 399.288 5.080 30 20 GKED CCN(Cc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1)C(C)C 554311122 JWGZNIFWULIWFD-SFHVURJKSA-N 377.513 5.017 30 20 GKED C[C@@H](Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2)c1ccc(C#N)cc1F 556243038 YVGIVNQJWZVECR-QGZVFWFLSA-N 399.469 5.002 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@@H](C)c2ccccc21 557553357 CUCMQYYCGIOVGZ-IAGOWNOFSA-N 379.529 5.033 30 20 GKED CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 558511517 PONWXFSFTARNQP-IIBYNOLFSA-N 378.476 5.178 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@H](C)N[C@H](CCCC#N)c1ccccc1 559856977 APIYGOZBORYKFD-SIKLNZKXSA-N 377.532 5.552 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(Br)c1Cl)c1ccccc1 578085134 JWACFKRRAKXUGO-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED C=C[C@@](C)(O)CC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 582094566 SJSRXWBPFOXGPR-LJQANCHMSA-N 388.876 5.008 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1 582910825 FUDNRBYZUGLWEZ-CALCHBBNSA-N 382.470 6.123 30 20 GKED CCCC[C@H](CC)COCc1cccc(NC(=O)N2CCC[C@@H](CC#N)C2)c1 596705123 VIUDNNNYKLPUJK-PMACEKPBSA-N 385.552 5.577 30 20 GKED N#Cc1cc2c(nc1N1CCC(c3nc4cc(Cl)ccc4s3)CC1)CCC2 603843488 CVSZBYSFSUCPMZ-UHFFFAOYSA-N 394.931 5.089 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(CNc3nc4c(cc3C#N)CCC4)c2)c1 603870621 KWOKPMCKWNHBTR-UHFFFAOYSA-N 397.482 5.007 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(COc2ccccc2C#N)o1 603872413 LZRZXZVHJORNEF-UHFFFAOYSA-N 394.858 5.046 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCC(C)(C)c1ccc(Cl)cc1 608917910 ATOFFBLJUKFSIA-UHFFFAOYSA-N 383.923 5.109 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 609171783 BZRAGNFKAXPLIP-CYFREDJKSA-N 384.479 5.140 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 609660145 NCJLXXDLDWSOEQ-KKSFZXQISA-N 389.886 5.523 30 20 GKED C[C@H]1CCC[C@@](C#N)(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)C1 609735240 DTOWJJPYLHLJPB-RNODOKPDSA-N 381.526 5.227 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(CCc1ccc(F)cc1)C1CC1 609744502 KTMKSXYWBMMQPM-INIZCTEOSA-N 397.519 5.316 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCc2ccccc2C1 609773126 YFPJEECRFKCCFV-DLBZAZTESA-N 379.529 5.007 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(-c4cncnc4)cc3)c2)cc1 609991778 RKAYZDIOAXXRNM-UHFFFAOYSA-N 391.434 5.011 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)c2c1 610422480 JVYMYUJMYXKNRK-UHFFFAOYSA-N 396.450 5.107 30 20 GKED CC(C)(C)OCc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 610613326 LNQGPSIQKBZZAJ-UHFFFAOYSA-N 388.515 5.391 30 20 GKED CC(C)c1cc(CNC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)on1 611185597 ZMCQMSDHVJAZFL-UHFFFAOYSA-N 395.846 5.045 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C(C)(C)C#N)cc3)s2)cc1 614184997 FVDHDEBAPXRUFY-QGZVFWFLSA-N 389.568 6.079 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1SCc1ccc(C#N)cc1C 614401849 KCCZXXMZXWBVSZ-UHFFFAOYSA-N 398.919 5.003 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cccc(C(F)F)c1 622485771 XWAPJEIGYVHEJA-CYBMUJFWSA-N 397.265 5.676 30 20 GKED Cc1cccc2sc(C(=O)[C@H](C#N)c3nc4ccccc4n3C)c(Cl)c12 642280924 KEIZUYZYLHFCIW-LBPRGKRZSA-N 379.872 5.240 30 20 GKED Cc1oc(C(C)C)nc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 671751414 MFOROEOWDTVSEI-NSHDSACASA-N 393.390 5.225 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(OCc2ccc(F)cc2)CC1)c1ccccc1 678165059 JPBCGIBEUJPGLJ-QHCPKHFHSA-N 396.506 5.224 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 678296725 IGZCGORPHYLXOU-NXEZZACHSA-N 383.229 5.017 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 726467821 LSEBTHJSRSFEMX-UHFFFAOYSA-N 383.826 5.059 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1ccc(Cl)c(Cl)c1O 727648679 PDDIMZSGGXCVTB-UHFFFAOYSA-N 387.226 5.225 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)/N=C/c1cc([N+](=O)[O-])ccc1O 729149702 NXMMTSNVBJUJRV-OHBSIKEHSA-N 385.420 5.052 30 20 GKED C#CCN(C(=O)N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C)C1CCCCC1 729616628 SMEOWJDAYUUHHG-INIZCTEOSA-N 399.535 5.296 30 20 GKED CC(=NNc1ccc([N+](=O)[O-])cn1)c1c(F)cccc1O[C@@H](C)c1ccccc1 730145929 WXWZXQXSZLIYEU-HNNXBMFYSA-N 394.406 5.105 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(Cl)s1 731040297 QLMNTWHPYMCWBW-GFCCVEGCSA-N 396.990 5.668 30 20 GKED CCOc1c(Br)cc(/C=C/C(=O)c2sccc2C)cc1OC 733748757 IURAWYMYNIUMOE-AATRIKPKSA-N 381.291 5.122 30 20 GKED COc1ccc(/C=C2\CCOc3c(Cl)cccc3C2=O)cc1OCCCC#N 733749202 SEWBSCCQRYHBRU-DTQAZKPQSA-N 397.858 5.080 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc3c(Cl)cccc3s2)c1 733773010 LJNZOMVMOPDFOS-AWEZNQCLSA-N 384.888 5.166 30 20 GKED Cc1ccc([C@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 738894479 FXMBRLXLPWOONM-DVECYGJZSA-N 383.495 5.576 30 20 GKED CC(C)c1nc(C#N)c(NN=Cc2c(C(C)C)nn(-c3ccccc3)c2Cl)o1 745611766 HUWZRUWCVSIMGW-UHFFFAOYSA-N 396.882 5.078 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(SC(F)F)c1 752665423 BQHKRSOMILWTHG-ROUUACIJSA-N 387.455 5.305 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cnc(-c2ccncc2)s1 753144679 QIAUWCBZXIRBCC-FPLPWBNLSA-N 389.505 5.533 30 20 GKED N#Cc1c(NC(=O)/C=C/c2ccnc(Cl)c2)sc2c1-c1ccccc1CC2 757934249 WSWPLPAAJYQJEE-VMPITWQZSA-N 391.883 5.086 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc3ccc(F)cc3c2)cc1 758409841 MZOFJCQNTASVPE-QFIPXVFZSA-N 381.410 5.282 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)c1 760416739 PFNXNJUWWPRBDH-UHFFFAOYSA-N 392.842 5.216 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)cc1 769791575 YBQJLSRDJQEWSV-KSSFIOAISA-N 393.284 5.367 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1c(C(F)(F)F)nn(C)c1Cl 771762238 XMDRIOXJVHHMSF-SNVBAGLBSA-N 388.846 5.099 30 20 GKED C#CCCCCC(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 773376812 SUFNAVZACLGNFC-HSZRJFAPSA-N 376.525 5.428 30 20 GKED CN1C(=O)CCc2cc(/C=C/C(=O)c3ccc(Cl)c(C(F)(F)F)c3)ccc21 774134143 IKOVFAIMWOXTOH-FPYGCLRLSA-N 393.792 5.164 30 20 GKED C=CC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 778619306 LNEDUNPNFCVGIN-HZPDHXFCSA-N 394.446 5.624 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc(C(F)(F)F)cnc3Cl)c2C#N)C1 790625945 MAACUGPWLZMFCZ-MRVPVSSYSA-N 399.825 5.064 30 20 GKED N#C[C@H](C(=O)[C@H](F)CC1CCCCC1)c1nc(-c2c(F)cccc2F)cs1 796668961 BTJMHDVRKLLUKW-CZUORRHYSA-N 392.446 5.573 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813218586 XVLBDCMKCPCSRO-QAPCUYQASA-N 396.796 5.034 30 20 GKED CCOc1ccc(OCC)c(NC(=S)N[C@H](CCCC#N)c2ccccc2)c1 814210516 QCXNKUPVJKUZIP-LJQANCHMSA-N 397.544 5.206 30 20 GKED Cc1nc(SC2CCCC2)sc1CC(=O)[C@H](C#N)c1nc2ccccc2o1 842293813 MKIDBEJUISNZLQ-AWEZNQCLSA-N 397.525 5.046 30 20 GKED Cc1nc(/C=C/c2cncn2C(C)C)sc1C(=O)/C=C/c1cncn1C(C)C 901457372 KHWSNNGJLJQLOQ-CDJQDVQCSA-N 395.532 5.073 30 20 GKED COc1ccc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1F 915087772 XLYHMBJQADSFNM-OAQYLSRUSA-N 388.442 5.061 30 20 GKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140621 ALPLBVXRHDVLDV-VQTJNVASSA-N 390.508 5.579 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804817 ZWLZJRZILUBFBM-CABCVRRESA-N 382.435 5.458 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C[C@@H](C)c2ccccc2)C(=O)O)c1 1776787927 GMFYLCYMZBUJMN-HYBUGGRVSA-N 397.559 5.772 30 20 GKED CCCn1nc(C)c(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1Cl 1776846364 KOVGFXYEJHEZJE-HJWRWDBZSA-N 398.846 5.109 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)o1 1776931578 ZUJLJPRIGQESOV-CSKARUKUSA-N 396.826 5.593 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C(C)(C)CC)CC1 1829070474 JDZYMUXCQIMHSF-FQEVSTJZSA-N 390.612 5.035 30 20 GKED Cc1ccc(NC(=O)[C@@H](Sc2nc(C)cc(C)c2C#N)c2ccccc2)cc1 10266904 BORUFOHKASLTNK-NRFANRHFSA-N 387.508 5.351 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C/c1nc2ccccc2s1 66801221 PTUCLIRODJNJFL-PLSXKVAHSA-N 379.510 5.342 30 20 GKED COc1cc(C(=O)/C=C/c2c(C)nc3sc(C)cn23)ccc1SC(F)F 72047594 NVEIDODIPCZTDB-AATRIKPKSA-N 394.468 5.232 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC[C@@H]4CCC[C@@H]43)c2)cc1 120114642 MJZMCAYSHSLMNT-REWPJTCUSA-N 389.499 5.128 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 123290701 SDZBIHOZMAHOLX-KRWDZBQOSA-N 376.525 5.362 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 137457123 ONSNEKRVFVJPKQ-RXVVDRJESA-N 393.556 6.067 30 20 GKED C=C(C)COc1cc(CN[C@H](c2cccc(F)c2)c2ccccn2)ccc1OC 154060437 HLUFBKJJUUGNQB-XMMPIXPASA-N 392.474 5.063 30 20 GKED C[C@H](SCCC(=O)Nc1ccccc1C(F)(F)F)c1ccc(C#N)cc1 161807794 HJBBINFIBRIMPV-ZDUSSCGKSA-N 378.419 5.400 30 20 GKED COCCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCCC1 162521323 HFAZSBWTGSJYRV-MRXNPFEDSA-N 388.920 5.237 30 20 GKED C[S@](=O)Cc1ccc(Cl)c(NCc2ccc(-c3ccccc3C#N)cc2)c1 174877028 CIWDJAUUNVLYFJ-MHZLTWQESA-N 394.927 5.369 30 20 GKED N#Cc1ccc(CNCc2ccccc2-c2ccc(CN3CCCC3)cc2)s1 176946113 QGCOLQKEDOZPLQ-UHFFFAOYSA-N 387.552 5.172 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 177089984 RDIJVNPTVOXWKC-CQSZACIVSA-N 398.488 5.046 30 20 GKED CCC[C@@H]1CCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 184477757 GJWIJGYZKDTHST-OAQYLSRUSA-N 391.515 5.518 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 189909899 DAFDXWBNLRFFIG-UHFFFAOYSA-N 398.459 5.106 30 20 GKED OC(=Nc1ccc(F)cc1-c1nc(C2CC2)no1)N1[C@H]2CC[C@H]1c1ccccc12 329950258 CDIORAGHRMZYEW-OALUTQOASA-N 390.418 5.190 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1CN(C(=O)[C@H](C)CC(=C)C)C(C)C 411086573 OVPMYEQWSGYRAJ-WOJBJXKFSA-N 384.564 5.567 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1csnc1-c1cccc(C(F)(F)F)c1)OCC 425608431 MLHXRSNNNZJYTR-OAHLLOKOSA-N 384.423 5.139 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H](c2ccccc2)c2ccco2)c2ccccc21 426886402 LSZMPEKIARZBKC-QHCPKHFHSA-N 383.451 5.057 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 429048170 RTGJIYBIUTVGQR-UHFFFAOYSA-N 376.460 5.144 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 431861035 KJCLWOWAIJRKRL-DNVCBOLYSA-N 389.421 5.501 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 431947492 AAQWAPZBUXMDHM-BFUOFWGJSA-N 387.405 5.501 30 20 GKED N#CCCC[C@@H](NCc1nn(-c2ccc(F)cc2)c2c1CCC2)c1ccccc1 433021790 YOITZIUSBORBFR-JOCHJYFZSA-N 388.490 5.025 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1nc2cc(Cl)ccc2s1 435800530 SNQPZIOGVXCULE-LBPRGKRZSA-N 396.686 5.502 30 20 GKED N#Cc1csc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436401970 SKHVOMZKHOWETJ-AWEZNQCLSA-N 378.341 5.422 30 20 GKED CCCc1c(NC(=O)N2CCCC23CCCCC3)cnn1-c1cccc(C#N)c1 439695062 PTXGJYHNZLIDJY-UHFFFAOYSA-N 391.519 5.027 30 20 GKED CC(C)(NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 440086548 HNVXNICROHCYJN-SFHVURJKSA-N 389.421 5.285 30 20 GKED CCCc1c(NC(=O)c2cccc(Cl)c2Cl)cnn1-c1cccc(C#N)c1 440089427 RJJIPFVWNNBHPT-UHFFFAOYSA-N 399.281 5.256 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1cc(C(F)(F)F)ccn1 455255811 ZSPFXQIDCUMVRZ-UHFFFAOYSA-N 391.437 5.317 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccc2)ns1)c1cccc(Cl)c1Cl 462003955 BRUWYBLQOUOKNH-OAHLLOKOSA-N 388.279 5.112 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3SCCc4sccc43)cc2)cc1 463657251 VAAROUCIJQDWIQ-FQEVSTJZSA-N 392.505 5.381 30 20 GKED N#CCc1ccc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)cc1 469896595 JFNQPMQQZSQEPK-UHFFFAOYSA-N 398.249 5.499 30 20 GKED Cc1nc2c(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)cccc2o1 470846740 ANLSKXWXUGHDNL-UHFFFAOYSA-N 397.434 5.034 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)C[C@H](CC#N)c1ccccc1 475458909 OMGNVSCGSBJPIS-HOCLYGCPSA-N 375.299 5.128 30 20 GKED C[C@H](NC(=O)Cc1cnc2ccccc2c1)c1ccc(-c2cccc(C#N)c2)cc1 475815938 KVMAQOGNEMHANU-SFHVURJKSA-N 391.474 5.193 30 20 GKED CC(C)c1ccc([C@H](NC(=O)NCC(C)(C)CCC#N)c2cccs2)cc1 476933127 YTICLFVKEUPTJI-FQEVSTJZSA-N 383.561 5.590 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c2ccccc21 478539281 DHDYSCBJDUEFJB-UAPYVXQJSA-N 391.902 5.274 30 20 GKED C=CCN(C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1nc2c(s1)CCCC2 482368741 VRJXTMZYRKYRDP-HNNXBMFYSA-N 394.462 5.277 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCCCCC(=O)C2)cc1Cl 485707559 GMYITCWGGKSEFY-LAUBAEHRSA-N 394.902 5.473 30 20 GKED N#CCCCOc1cccc(NC(=O)CCOc2cccc(Cl)c2Cl)c1 488432279 FCHVFGOFZRZMRA-UHFFFAOYSA-N 393.270 5.084 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccsc2)cc1Cl 500225312 IFYLZOFKOYJPIU-GOSISDBHSA-N 381.888 5.379 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Cl)c2cccnc12 502773055 IPGSIJCHLHMUDO-UHFFFAOYSA-N 377.296 5.432 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC 505062044 OWNDZFSRIBMCPB-NRFANRHFSA-N 380.488 5.191 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1nc2ccccc2s1 505313800 VWTWUXFOYSBQDL-LLVKDONJSA-N 397.431 5.188 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCCO[C@@H]2CCCc3ccccc32)cc1 506727385 YMDXVHYJOAJKIY-JOCHJYFZSA-N 391.515 5.094 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)n1 516836281 CUKSRGDGIBRBQX-INIZCTEOSA-N 376.460 5.558 30 20 GKED CC(C)n1cc([C@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cn1 522133432 BWLBDKOBZSBDNL-INIZCTEOSA-N 389.459 5.011 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)c1C#N 524106080 WIXQDUALDQUMNK-LSDHHAIUSA-N 378.419 5.252 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@H](C)c1cccc(F)c1 525155595 NVDRTDCSDKQVGR-CYBMUJFWSA-N 394.259 5.046 30 20 GKED Cc1ccccc1-c1cnc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)o1 533816566 WHGOSFASYBCYSM-UHFFFAOYSA-N 399.425 6.065 30 20 GKED CC(C)(CCC#N)CN1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 537630572 RTNOYVIPRATZQP-UHFFFAOYSA-N 394.494 5.158 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 542881758 LBVXEAFOMXNTLL-JTSKRJEESA-N 378.472 5.130 30 20 GKED C[C@H](NCCc1nc2ccccc2n1C)c1ccc(-c2cccc(C#N)c2)cc1 543872525 ANHGYUGWBCUWSF-SFHVURJKSA-N 380.495 5.005 30 20 GKED CCOC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCCC1 551562022 TYSBSIKFRVWEAH-IBGZPJMESA-N 382.891 5.283 30 20 GKED N#CCC[C@H](NC(=O)c1cc(F)c(Br)c(Cl)c1)c1ccccc1 552370054 QSCYUJBVZHUDAL-HNNXBMFYSA-N 395.659 5.016 30 20 GKED C=CCOc1ccc(CN2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1Cl 554877647 OMYRSZCFACOOND-SFHVURJKSA-N 387.911 5.283 30 20 GKED CC(C)c1c(NC(=O)c2ccc(C#N)c(Cl)c2)cnn1-c1ccccc1Cl 555422496 VAQZLSCQQUUXDO-UHFFFAOYSA-N 399.281 5.426 30 20 GKED N#C[C@H](C(=O)c1ccnc(Oc2ccccc2)c1)c1nc2cc(F)ccc2s1 592974306 SEOUFRVMACYSJQ-MRXNPFEDSA-N 389.411 5.113 30 20 GKED N#Cc1ccc(C2(NC(=O)Nc3ccccc3CCC(F)(F)F)CCC2)cc1 594075482 YURWXZMHHAGTRW-UHFFFAOYSA-N 387.405 5.254 30 20 GKED Cc1ccccc1-c1nc(C(=O)N(Cc2ccc(C#N)cc2)C(C)C)cs1 608934921 COBHCRSYINHRNW-UHFFFAOYSA-N 375.497 5.041 30 20 GKED CCc1c(C)sc(NC(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)c1C#N 609032490 JWLBTWRHENXMDT-UHFFFAOYSA-N 394.500 5.280 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCc1ccc(C#N)cc1F 609252340 JKDTUFWBZVQADS-UHFFFAOYSA-N 397.519 5.752 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(C2CC2)nc2ccccc12 609430364 STEZFLHXFLONMT-HNNXBMFYSA-N 387.508 5.759 30 20 GKED N#Cc1ccc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1C(F)(F)F 609448879 NUQCKMGEVJXXSV-UWVGGRQHSA-N 390.249 5.144 30 20 GKED CC(C)CN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CCCC1 609641925 KYNHXJZEUQTJEN-UHFFFAOYSA-N 376.500 5.178 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CC[C@@H](c3ccco3)C2)c1 609732256 KOASJEZZBLZTMO-MRXNPFEDSA-N 392.842 5.227 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3sc(C(C)C)nc3C)n2)cc1 613318758 CNQCJHYJLSQWGK-OAHLLOKOSA-N 381.526 5.497 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 613407303 PXRISSMKXXWMND-AWEZNQCLSA-N 392.871 5.138 30 20 GKED Cc1c(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)oc2c(F)cccc12 614424886 KQYQGARVJCKXQG-UHFFFAOYSA-N 380.463 5.205 30 20 GKED CCCCN(C(=O)c1cc(-c2cccc(C#N)c2)no1)[C@@H](C)c1ccc(C)o1 619110648 SCJUQNARCIAGGH-INIZCTEOSA-N 377.444 5.118 30 20 GKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(SCC(F)(F)F)cc1 619755854 WKKOTEDTSJTNGM-GFCCVEGCSA-N 384.854 5.717 30 20 GKED Fc1ccccc1-c1nc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)co1 625102372 ZIIJXGZDAORUCG-QWRGUYRKSA-N 396.306 5.043 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(CCC(F)(F)F)n1 632754095 ZJZDUYOYEWKBGI-UHFFFAOYSA-N 396.478 5.671 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@H](C)CC)cc2)nnc1-c1ccncc1 645071794 HEZVDDLWTYLOGX-MRXNPFEDSA-N 392.528 5.015 30 20 GKED N#C[C@@H](C(=O)c1ccc(CCC(F)(F)F)cc1)c1nc2cc(F)ccc2s1 676999241 SHCUXXDXXOXLBH-AWEZNQCLSA-N 392.377 5.420 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1ccc(C)cn1)c1ccc(C(F)(F)F)cc1 682714823 NCFXQRDFGHMSDH-IBGZPJMESA-N 391.437 5.258 30 20 GKED C[C@@H](NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccs1 726461197 WCGBZPBRCRTVGL-OAHLLOKOSA-N 393.537 5.246 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)c1 726463913 BSGJUWFUXOUTBG-MRXNPFEDSA-N 394.540 5.046 30 20 GKED CC(C)COc1ncccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728465965 MLDJMROGDRWTTH-QFIPXVFZSA-N 385.467 5.024 30 20 GKED N#CCOc1cccc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)c1 731938437 QEZZAMZTLDDLNE-QINSGFPZSA-N 390.439 5.064 30 20 GKED Cc1nc(CCC(=O)N2CCCSC2=Nc2ccccc2C(C)C)cs1 733086987 RGDPGCIWFCNHMN-UHFFFAOYSA-N 387.574 5.161 30 20 GKED C=CCOc1ccc(CNc2ccc(OCC3CCOCC3)cc2)cc1Cl 736647078 DSDKLBDQCIBHMK-UHFFFAOYSA-N 387.907 5.322 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)OC(=O)Cc3ccc(C#N)cc3)s2)cc1 739303523 RHGARJFVMQSSPT-INIZCTEOSA-N 376.481 5.146 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(-c2ccc(Cl)s2)o1 741472550 KBKDDJBOOKTYRV-UHFFFAOYSA-N 398.296 5.300 30 20 GKED CCCCCCOCc1cccc(NC(=O)NCc2cc(C#N)ccc2F)c1 743128443 XLJUTQFVVWTJOR-UHFFFAOYSA-N 383.467 5.116 30 20 GKED O=C(/C=C\c1csc(-c2cccc(Br)c2)n1)c1ccsc1 749101853 MJDQAROXBJQNQH-PLNGDYQASA-N 376.300 5.530 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C/c3ccnc(Cl)c3)c2)cc1 757938575 UVFREPFYLUOGGO-RMKNXTFCSA-N 375.815 5.051 30 20 GKED C#CC[C@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccccc1 761783291 PXMKIELDVKNOMO-INIZCTEOSA-N 382.435 5.242 30 20 GKED CC(C)c1ccc(C[C@@H]2CCN(C(=O)Nc3ccccc3O[C@@H](C)C#N)C2)cc1 764694901 SKTRKZRAIRDIAF-ICSRJNTNSA-N 391.515 5.197 30 20 GKED C#CCCN(CC(F)(F)F)C(=O)c1ccc(-c2nc3ccccc3s2)s1 767205988 PFGUWDFNNDKQHZ-UHFFFAOYSA-N 394.443 5.053 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(O)cccc1Cl 769753394 SKXCSBQHORJGHF-UHFFFAOYSA-N 392.842 5.057 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc(Cl)nc3)n2)cc1 772642459 XLFGERLQVYHIAU-KZJSRBBCSA-N 379.872 5.057 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccc([N+](=O)[O-])cc1Cl 782188641 LKGPDOPWHFHIQC-BAQGIRSFSA-N 394.814 5.118 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)OCCCC(C)(C)C#N 784929993 AYYCZCXOXHBQDH-UHFFFAOYSA-N 380.366 5.156 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(SCC(F)(F)F)cc1 789073463 LCMYUOFXRNPVMT-UHFFFAOYSA-N 391.418 5.019 30 20 GKED N#Cc1ccc([C@@H](O)C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)cc1 790089604 IMTKOZGKVAHJDE-HXUWFJFHSA-N 397.261 5.204 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792096056 ZGBKUVCXPBMUCM-HVJHFUJKSA-N 381.262 5.821 30 20 GKED COc1ccc(F)c2[nH]c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc12 793045249 YBIKJNUSYAGFAH-LJQANCHMSA-N 399.425 5.223 30 20 GKED N#CC[C@H](CC(=O)Oc1ccccc1-c1nc2ccccc2s1)c1ccccc1 796533947 VKJFHVSKGYAYFK-GOSISDBHSA-N 398.487 5.956 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(C(F)(F)F)cc1 798827440 HGEYCERSCMNBHN-YGRLFVJLSA-N 392.377 5.434 30 20 GKED Cc1c(C(=O)OCCCC2(C#N)CCOCC2)oc2c1ccc1ccccc12 800082447 OOFUUCZNCPSXDD-UHFFFAOYSA-N 377.440 5.152 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801694221 QYSCBDQLJQCVFI-SFHVURJKSA-N 379.397 6.207 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 802077169 KTHDLYSVWJOZLG-DYVFJYSZSA-N 394.471 5.254 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(F)c2)CCCCC1)c1nc2ccccc2o1 805862156 ZUXULJQGKHZKHJ-SFHVURJKSA-N 376.431 5.336 30 20 GKED C[C@@H](OC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(C(F)(F)F)nc1 813249503 ALJOGIIQVQGATG-SSDOTTSWSA-N 399.237 5.315 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c2C#N)[C@@H](C)C1 839389772 SRXXGOSWMKKGFP-UWVGGRQHSA-N 389.864 5.119 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 842941514 QOBBWUVDUGZOIS-XHDPSFHLSA-N 389.318 5.153 30 20 GKED C[C@@H](NC(=O)N1CCC[C@]2(C1)CC2(F)F)c1ccc(-c2cccc(C#N)c2)cc1 845103349 SFFAHMYUHJMETD-OPAMFIHVSA-N 395.453 5.117 30 20 GKED CC(=NO[C@H](C)C(=O)N[C@@H](C)c1ccc(Cl)cc1)c1cc2ccccc2o1 852017598 DZFUUOXWSAOQFK-DZGCQCFKSA-N 384.863 5.093 30 20 GKED COc1ccc(NC(=O)C2(c3ccc(C#N)cc3)CCCC2)c(C(F)(F)F)c1 858663135 NLAUQQGYVMHPQA-UHFFFAOYSA-N 388.389 5.036 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 860844273 HRPJMBJGQODIOE-LSDHHAIUSA-N 389.318 5.153 30 20 GKED CCOc1cccc(/C=N\C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1O 914703692 XFFMUELOZDDMSD-JZUIVORYSA-N 383.332 5.119 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccccc2F)C2CC2)cc1 915351494 DAKPAAKMQIBOII-HSZRJFAPSA-N 399.469 5.678 30 20 GKED CCOC(=O)Cc1ccc(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)cc1 918713178 PXLJDFKPTZXGPI-SEYXRHQNSA-N 391.492 5.120 30 20 GKED CCCOc1ccc(C=NOCc2csc(Cc3ccccc3)n2)cc1OC 918733281 NTXKSEKJZUNQDR-UHFFFAOYSA-N 396.512 5.082 30 20 GKED CC(C)=C[C@@H]1[C@@H](C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)C1(C)C 920804396 QEAHJUOHUYBLOK-JCGVRSQUSA-N 386.467 5.503 30 20 GKED C=CCOc1c(Cl)cc(/C=C(/CC(=O)O)c2nc3ccccc3o2)cc1OC 1776183087 HRDANRIEZFIGJA-ZROIWOOFSA-N 399.830 5.070 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](Cc2cc(C)cc(C)c2)C(=O)O)c1 1776787234 GBUHHDVRHKDTNE-DEOSSOPVSA-N 397.559 5.438 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2cc(C)cc(C)c2)c1 1776787667 LRRBWJPDUGEGNW-DEOSSOPVSA-N 397.559 5.958 30 20 GKED CN(Cc1cccs1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 45674564 CJFJJNSWJWMIKZ-UHFFFAOYSA-N 378.522 5.184 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nc2ccccc2s1 46706585 OPRPBCBHSKMFRI-AWEZNQCLSA-N 388.473 5.407 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2SCc2cc(C)no2)c1 66463343 JNWCUHCZTFTPEK-UHFFFAOYSA-N 394.496 5.483 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccc(F)c(F)c1)c1ccccc1)c1ccccn1 106353745 CFEVEPGLLZKHJV-KKSFZXQISA-N 380.419 5.070 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2ccc(OCc3nccn3C)cc2)cc1 108308951 OLPPTAGSZRZZNC-AUWJEWJLSA-N 390.483 5.074 30 20 GKED Cc1ccccc1C1CCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 108530526 WELJTQNDQAHEBX-KRWDZBQOSA-N 393.556 5.658 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 121919007 AHJVXINGEVEJKD-UHFFFAOYSA-N 399.406 5.088 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccs1 133952700 KKNYUQQFZAMRKR-KGLIPLIRSA-N 376.572 5.433 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](Nc2ccccc2)C1 151062000 QDLQYGJTYFWEKR-HKUYNNGSSA-N 394.544 5.189 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 167851257 QUUODEIENPDNQP-HSZRJFAPSA-N 398.466 5.423 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1scnc1C(C)(C)C 176545374 CAEYLFGBEMIVBW-UHFFFAOYSA-N 392.484 5.060 30 20 GKED O=C1CC[C@H](/C(O)=N/[C@@H]2CC3(CCCC3)Oc3ccccc32)c2ccccc21 328850711 ZGNBALOOYGNUOZ-AZUAARDMSA-N 375.468 5.540 30 20 GKED O/C(Cc1c[nH]c2cc(Cl)ccc12)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329524986 SKMYHABELHFZBY-IBGZPJMESA-N 396.922 5.710 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ncc(C(=O)OC)s1)c1ccc(C(F)(F)F)cc1 414101880 MIFRRXFDBMOWNO-IUODEOHRSA-N 398.450 5.307 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425755559 KDRYZTRYTROCGW-BEFAXECRSA-N 389.421 5.263 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3nc4ccccc4s3)CC2)c(Cl)c1 426152917 ISQDCIPWVJGCIT-UHFFFAOYSA-N 396.903 5.233 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 432678857 NCURVIKJIHEKEK-GOSISDBHSA-N 380.879 5.009 30 20 GKED CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 432868732 XDQPDUMXNUYREU-IERDGZPVSA-N 399.535 6.081 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 435695500 NNLDHKWUROZGFU-UHFFFAOYSA-N 387.370 5.192 30 20 GKED Fc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c(F)c1 436401568 WEFLAQNFSIMBBJ-OAHLLOKOSA-N 383.282 5.767 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2ccccc2)c2ccco2)cc1C(F)(F)F 438642702 RPSNLNYJXYIMMS-SFHVURJKSA-N 385.345 5.081 30 20 GKED C=CCn1c(S[C@H](C)c2ccc3cc(OC)ccc3c2)nnc1-c1ccco1 439280756 SNGODJUJAOQFFA-OAHLLOKOSA-N 391.496 5.739 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@H]1c1ccc[nH]1)c1ccc(C(F)(F)F)cc1 442289176 FQLWXZLEYQDOBX-MJGOQNOKSA-N 391.437 5.588 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccn(CCc2ccccc2)n1 453086868 MFJBBTOEUVFMAS-SFHVURJKSA-N 376.529 5.132 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 457111150 AKBCUSVYGQWFLL-UHFFFAOYSA-N 393.249 5.139 30 20 GKED C[C@H]1CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@@H]1c1ccccc1 464540888 NQGXRVWMJMQUAF-UUOWRZLLSA-N 382.463 5.378 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc2ccccc12 469042222 QMRIIPDUKMQKLT-SFHVURJKSA-N 383.495 5.596 30 20 GKED C=C(C)[C@@H](NC(=O)CCc1ncc(-c2ccc(C)cc2)o1)c1ccc(F)c(F)c1 475661500 MCKBPWWMBHTXOL-HSZRJFAPSA-N 396.437 5.294 30 20 GKED C=C(C)[C@H](NC(=O)CCc1ncc(-c2ccc(C)cc2)o1)c1ccc(F)c(F)c1 475661501 MCKBPWWMBHTXOL-QHCPKHFHSA-N 396.437 5.294 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1 476790444 HKVFVXIIJUYFKR-IBGZPJMESA-N 391.433 5.099 30 20 GKED CC[C@H](C)C(=O)Nc1cccc(CN[C@H]2CCCCc3cc(C#N)ccc32)c1 481663617 BUTILYYPBQVJDT-SBUREZEXSA-N 375.516 5.100 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487545554 TYJUXKGAGIWYIB-KUHUBIRLSA-N 391.298 5.312 30 20 GKED C=CC[C@@H](C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 489694288 HKQVVTNOZAYYFL-XLIONFOSSA-N 379.891 5.240 30 20 GKED Cn1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C1CCC1 496025997 AZJAAUKGBYWAQE-QGZVFWFLSA-N 395.915 5.560 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@@H]1CCCC[C@H]1C 497798221 GTDSWSIXJBILHU-UZUQRXQVSA-N 394.490 5.134 30 20 GKED CSc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1F 500458325 UOYBJUXHFXKKOZ-LLVKDONJSA-N 376.865 5.301 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCCOc1ccccc1 500749582 YHCMHHALXMXCIL-UHFFFAOYSA-N 386.451 5.457 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(CCC(F)(F)F)c3)CC2)cc1 502666059 HJCFKRXVNOANRZ-UHFFFAOYSA-N 399.416 5.374 30 20 GKED O=C(Nc1c(F)cccc1F)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 506286254 RDAHHYIVTCCEKU-CYBMUJFWSA-N 398.253 5.409 30 20 GKED Cc1ccc(Cc2sc(NC(=O)c3cc(C#N)ccc3Cl)nc2C)cc1 507168638 RMMPPTFGXAOMLR-UHFFFAOYSA-N 381.888 5.128 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1ccc(NC(=O)CC(F)(F)F)cc1 511004373 ZRDUVZBGBRZCKI-IBGZPJMESA-N 387.405 5.329 30 20 GKED N#C[C@H](NC(=O)c1cccc(COc2cccc(F)c2)c1)c1ccc(Cl)cc1 511150773 QSDYZGVXGLZKCE-NRFANRHFSA-N 394.833 5.053 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Br)s1 521726928 OYHJOJPUWOXTDI-JTQLQIEISA-N 381.320 5.015 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C[C@H]2CCOc3ccccc32)cc1 522744695 IOMCCBVATHFMDZ-QGZVFWFLSA-N 384.435 5.245 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccccc1OCc1ccncc1 523510305 AEOLAKCFGPMADT-UHFFFAOYSA-N 398.915 5.204 30 20 GKED COc1cc(CN[C@H](C)c2ccc(C)cc2)ccc1OCc1cccc(C#N)c1 537027536 BOAITTJIFOKROR-LJQANCHMSA-N 386.495 5.305 30 20 GKED O=C(CCCC(F)(F)F)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 537245829 MVHMXYHZMQSOIE-NSHDSACASA-N 381.238 5.158 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1ccc(C2(C#N)CC2)cc1)C1CC1 537429447 ZKYPADHFFRHVGK-OAHLLOKOSA-N 398.428 5.626 30 20 GKED CCCCOc1ccc([C@@H](C)NCc2ccccc2C(C)(C)C#N)cc1OC 539272208 MGDPCKFTRZETAW-GOSISDBHSA-N 380.532 5.526 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1)C1CC1 540126642 CFMLJXAKBPNTDU-UHFFFAOYSA-N 395.356 5.214 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CC1 541044397 OTNYMBMBVZMINS-UHFFFAOYSA-N 385.920 5.649 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 541188869 RWYGJAIJKUGMAS-LJQANCHMSA-N 388.492 5.296 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1ccc(F)cc1C#N 541661430 JEWUCRPAMSMUCV-GFCCVEGCSA-N 385.895 5.634 30 20 GKED CCN(C(=O)c1oc2c(Br)cccc2c1C)c1ccc(C#N)cc1 541999079 UQZFTOJACPQDCQ-UHFFFAOYSA-N 383.245 5.042 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 543513301 SUGMFLJOUGRXDS-KOSHJBKYSA-N 397.478 5.163 30 20 GKED Cc1c([C@H](C)NC2(c3cccc(C#N)c3)CC2)cnn1-c1cccc(Cl)c1 556611845 YMJJPJBXNPQBOP-HNNXBMFYSA-N 376.891 5.046 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@H](C)c2ccccc21 557553358 CUCMQYYCGIOVGZ-IRXDYDNUSA-N 379.529 5.033 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 558504506 JCIZILPPNPWHFH-FDDCHVKYSA-N 390.487 5.178 30 20 GKED C=CCn1c(S[C@@H](C)c2nccn2-c2ccccc2)nnc1-c1ccccc1 561441047 PGUZQDOTEVWXNS-KRWDZBQOSA-N 387.512 5.170 30 20 GKED Cc1ccc(C[C@@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)cc1 564533112 LMDIMYCVYVBYRX-JOCHJYFZSA-N 395.428 5.354 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3ccc(Cl)c(C#N)c3)cs2)cc1 585709694 ZNHYOOXCEHHFIG-UHFFFAOYSA-N 381.888 5.079 30 20 GKED N#C[C@@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)c1ccc(Cl)c(Cl)c1 598824947 VQTYOPODMRMXFQ-JTNHKYCSSA-N 379.209 5.043 30 20 GKED COc1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 603673167 CNARQQQLHJWSRB-FQEVSTJZSA-N 376.843 5.256 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)[C@H]1c1ccccc1 604362045 CVFHORLBDNDTBE-QFIPXVFZSA-N 398.466 5.361 30 20 GKED CSCCc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 609048518 PCXWAQKVHDVAMC-UHFFFAOYSA-N 381.545 5.154 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056435 NTBMMZXKFRPHSD-UHFFFAOYSA-N 394.858 5.046 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2cccnc12 609061463 CSPUGWYVRWIJRH-UHFFFAOYSA-N 393.446 5.246 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc4ccccc4n3)cc2)cc1 609497553 HVISWFLCBSNPEO-UHFFFAOYSA-N 379.419 5.345 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)cc1 610183966 CXZFDKALIISTHI-UHFFFAOYSA-N 390.439 5.160 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610290621 MIWKIZNGJAUZLP-INIZCTEOSA-N 389.430 5.092 30 20 GKED COc1ccc(CN2CCCC[C@@H]2c2ccccc2OC)cc1OCCCC#N 611268970 XIOCBORBCVPGBU-OAQYLSRUSA-N 394.515 5.114 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(C(C)(C)C#N)cc1 614184893 BNVLARMYMKADEK-OAHLLOKOSA-N 393.531 5.910 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c[nH]c2c1 726141651 HWPFACMYKNHFCS-QHCPKHFHSA-N 379.463 5.313 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(C(F)(F)F)n1 726148930 ZGNMFZOJWPPPRL-UHFFFAOYSA-N 399.397 5.376 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726448357 PBOWIBPSWIXDCV-LLVKDONJSA-N 386.933 5.211 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)sc2cccc(F)c12 730416957 JKXGZGXYJWWVNP-NSHDSACASA-N 384.432 5.588 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Cc2coc3ccc4ccccc4c23)c1 733773893 HNSPQTRETWVANE-HXUWFJFHSA-N 398.462 5.126 30 20 GKED C=C(CSc1nnc(SCc2ccc(C(C)C)cc2)s1)C(=O)OCC 733871747 RVXLMVRDTRRSJY-UHFFFAOYSA-N 394.587 5.165 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2ccc(N3CCC(O)CC3)cc2)c1 734234676 BDBNCDHAQZSYCI-ZROIWOOFSA-N 397.518 5.519 30 20 GKED CC(C)(C)C1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 734929696 OIHNZPFNLOPHFD-QFIPXVFZSA-N 375.516 5.632 30 20 GKED N#CCSc1ccccc1C(=O)N(CCc1ccc(Cl)cc1)CC1CC1 735064382 JTRRWXBLVCPOAP-UHFFFAOYSA-N 384.932 5.051 30 20 GKED Cc1cc(Cl)ccc1NC(=O)CSCc1cc(Cl)ccc1OCC#N 735319372 ZBAHTYRSFJZOOO-UHFFFAOYSA-N 395.311 5.076 30 20 GKED Cc1c(C(=O)/C=C\c2cc(C(F)(F)F)ccc2F)cnn1-c1ccc(C#N)cc1 741853223 YUUNJOOVSGNHEK-WTKPLQERSA-N 399.347 5.106 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)s1 742646344 LZAQOZJPLDQWGZ-WBTMPAOCSA-N 394.327 5.142 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1nc2ccccc2n1C 743444868 YDNMBQNVLPUTDI-UHFFFAOYSA-N 389.406 5.038 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Cl)c(Cl)c1 747105211 QOEDHQWXWAWSMO-ZYHUDNBSSA-N 375.280 5.583 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)CSc1ccc2ccccc2c1 749361115 RJPLVXPBTHKJJK-UHFFFAOYSA-N 397.503 5.067 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cnc(-c2ccncc2)s1 753144678 QIAUWCBZXIRBCC-BQYQJAHWSA-N 389.505 5.533 30 20 GKED C=CC[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)c1ccncc1 754061118 RPVICAKMONLJQU-KRWDZBQOSA-N 390.339 5.919 30 20 GKED N#Cc1ccc(CNc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)s1 762632173 VQMCVRHEVLTIDN-UHFFFAOYSA-N 381.206 5.480 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1ccc2ccccc2n1 770842850 KVSHUAJSNJWKMN-GOSISDBHSA-N 382.385 5.453 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)Cc1ccccc1CC#N 776834193 UBVONLULXIEMIN-UHFFFAOYSA-N 375.299 5.039 30 20 GKED CC(C)(C)OC(=O)N[C@@H]1C[C@@H](N[C@H](CCC#N)c2ccccc2)c2ccccc21 780730518 SXJCKBCSPCVQSX-YPAWHYETSA-N 391.515 5.332 30 20 GKED N#CCC1CCN(C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)CC1 781825847 OJSPUHPWFHRQEP-UHFFFAOYSA-N 388.298 5.818 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)C[C@@H](C)c1c[nH]c2ccccc12 781952358 VHJIYQVZANVTOQ-CYBMUJFWSA-N 382.847 5.191 30 20 GKED C[C@H](OC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 784059083 DOXYMDYGRFVYLH-LBPRGKRZSA-N 386.329 5.150 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1c[nH]c2ccccc12 786325850 WLOIDQGMAIDMEC-DZGCQCFKSA-N 392.409 5.283 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1nccc2ccccc12 792107640 WUUIQYHNUOIZGP-KRWDZBQOSA-N 399.277 5.577 30 20 GKED CC[C@H](C)CON=Cc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 793159167 LGYIKYFUMQBNIZ-LBPRGKRZSA-N 399.438 5.243 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)C[C@H](CC#N)c1ccccc1 795990131 JOJTTXLSNXHGAA-BJLQDIEVSA-N 392.499 5.158 30 20 GKED FC(F)Sc1ccc(NC(=S)NN=C2CCC(C(F)F)CC2)cc1 799469320 LWJCHJGUERQAFR-UHFFFAOYSA-N 379.448 5.099 30 20 GKED N#Cc1ccc(/C=C\C(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1 811694578 UOMJULRBTPSJJZ-UTCJRWHESA-N 380.709 5.035 30 20 GKED N#CCc1ccccc1CC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 812565605 PJIOJEUOBNIQIH-UHFFFAOYSA-N 387.310 5.008 30 20 GKED C=CCN(CCC#N)C(=O)c1oc2ccccc2c1CSc1nc(C)cs1 816802866 BEWSMHIMOOFWFB-UHFFFAOYSA-N 397.525 5.032 30 20 GKED N#Cc1c(C(F)F)cccc1N1CCC(O)(c2ccccc2C(F)(F)F)CC1 848692293 ZCETUDCZSYFECO-UHFFFAOYSA-N 396.359 5.003 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2sc3cc(Br)ccc3c2Cl)C1 855254665 OQUSPYQJSUVLRD-SNVBAGLBSA-N 397.725 5.083 30 20 GKED C[C@H](CC(F)(F)F)C(=O)OCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1 859717545 LDJQSNIOWODFHI-MRVPVSSYSA-N 399.262 5.131 30 20 GKED C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)c1nc(Cc2ccc(Cl)cc2)no1 904543750 FIRSIZDASQFFIW-CQSZACIVSA-N 398.290 5.022 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc(C2(NC(=O)OC(C)(C)C)CC2)no1 904986204 LCZMGRFEQNGEPT-KRWDZBQOSA-N 383.492 5.072 30 20 GKED CCCCCn1c(=S)n(CN(CCC#N)Cc2cccnc2)c2ccccc21 914565603 VLIRXIQSCNQKKI-UHFFFAOYSA-N 393.560 5.131 30 20 GKED Cc1ncsc1C(=O)/C=C/c1cccc(/C=C/C(=O)c2scnc2C)c1 915054122 JLHPEOMQIAFLAN-CDJQDVQCSA-N 380.494 5.009 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2cc1C 915179169 AUDNVDYRTHKIIQ-XMMPIXPASA-N 394.474 5.886 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1 917560588 RXQTUNYLRMONCQ-YFHOEESVSA-N 382.872 5.233 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)Cc1cc2sc(C(=O)O)cc2s1 1776180603 YLOWLVMCSNLTOH-UHFFFAOYSA-N 377.918 5.503 30 20 GKED CC(C)(C#N)c1ccc(CNCc2cccc(-c3cccc(C(=O)O)c3)c2)cc1 1776230622 NCXVXNVFZJWPAW-UHFFFAOYSA-N 384.479 5.143 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(CC(F)(F)F)cc1 1776354381 JVBKWGAIFWTCGH-VQHVLOKHSA-N 392.373 5.173 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(OCC)c1OCCC 1776784045 UUQXQFXPHXPALN-IBGZPJMESA-N 379.541 5.168 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2ccccc2F)cc1 1776788009 KRGFPEXYFCBSQS-JOCHJYFZSA-N 387.495 5.481 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1777372616 OBESNOWCLTWDLS-SFDYMUJDSA-N 388.419 5.112 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@H](c3ccccc3)C(C)C)CCC2)cc1 1791588636 QGQJGVGCJKZGSR-QHCPKHFHSA-N 390.527 5.136 30 20 GKED N#Cc1ccc(F)c(CSc2nnc(-c3cccs3)n2-c2ccccc2)c1 10089772 KQGJFCNAOLHOQR-UHFFFAOYSA-N 392.484 5.299 30 20 GKED CCCCn1c(SCc2ccc(C#N)cc2F)nnc1-c1ccc(OC)cc1 11488967 XZIUPSDQMNJROI-UHFFFAOYSA-N 396.491 5.057 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(F)c(F)c2)cc1 45829804 RPGVHUUISGKJJE-UHFFFAOYSA-N 380.419 5.381 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccccc1SCc1cc(C)no1 65774637 BJDVYSWBFLDFHL-UHFFFAOYSA-N 392.524 5.146 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc(C(C)(C)C)s3)n2)cc1 67893702 GLTVPUHIKJJSED-AWEZNQCLSA-N 397.525 5.063 30 20 GKED CCCN(C(=O)NCc1ccc(OCC#N)cc1)[C@H](C)c1cc2ccccc2o1 69316398 SSKXOVUAKYDGTJ-QGZVFWFLSA-N 391.471 5.018 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H](C)c1cccc(F)c1 108413166 JZZLJJVYZNWZQD-GJZGRUSLSA-N 388.533 5.653 30 20 GKED N#C[C@@H](Sc1nnc(S[C@@H](C#N)C2CCCCC2)s1)C1CCCCC1 115184863 FWSWHFVOHQGAAV-IYBDPMFKSA-N 392.619 5.667 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(NC(=O)c3cccs3)c(C)c2)s1 123347033 PEOFEJSMPCGQOV-UHFFFAOYSA-N 395.509 5.057 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(CSC2CCCC2)c1 125401275 WLGARDDGJJEPRM-UHFFFAOYSA-N 383.517 5.403 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc3ccccc3c2)cc1 127654887 OPROQVOUCZEROJ-UHFFFAOYSA-O 397.523 5.487 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(C#N)c(Cl)c1 154953883 YCFNAXXNUDYKTL-UHFFFAOYSA-N 389.842 5.025 30 20 GKED CCN(C(=O)c1csc(-c2ccc(F)cc2)n1)c1ccc(C#N)c(Cl)c1 156533685 HTIGZMLKGDUVSX-UHFFFAOYSA-N 385.851 5.141 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C2CCC(F)(F)CC2)cc1 156726274 WLNZNCSKGLIRBK-UHFFFAOYSA-N 384.426 5.096 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1C1CC1 157881389 PBBLNQQXAOEXSX-MEDUHNTESA-N 391.302 5.033 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1OC1CCCC1 181572555 SECBHEHNQBNNHB-MRXNPFEDSA-N 384.501 5.087 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2c(F)cccc21 181714815 PHOMMIVNNSQOSQ-RHSMWYFYSA-N 399.491 5.255 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc2n1 185257699 QTZQEZFPIXCMEF-HNNXBMFYSA-N 377.856 5.296 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccccc2NCc2ccc(Cl)cc2)cc1 185360945 ZGQKXDXEVJWVLO-UHFFFAOYSA-N 375.859 5.005 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(SC(F)(F)F)cc2)c1 236894760 MVDPAAVRQYCOET-MRXNPFEDSA-N 380.435 5.269 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)N[C@H](CCC#N)c2ccccc2)C2CC2)o1 246948332 ULWAYDCVVYMHHY-MAODMQOUSA-N 377.488 5.122 30 20 GKED N#Cc1ccc(-c2nnc(COc3ccc(-c4ccccc4)cc3Cl)o2)cc1 303927193 PXMJEGGLYGJHBE-UHFFFAOYSA-N 387.826 5.508 30 20 GKED CC(C)n1cc(/C(O)=N/C2(c3noc(C4CCCC4)n3)CCCCCC2)cn1 329874089 COURQOLLQQSCQL-UHFFFAOYSA-N 385.512 5.059 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1 330016120 PBHYLDXGFQTUCB-MOUZIVPDSA-N 398.547 5.345 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)C1CCC(C(F)(F)F)CC1 410388831 SKKLQENBLSMIFK-UHFFFAOYSA-N 387.295 5.074 30 20 GKED Cc1ccc(Cc2cnc(NC(=O)c3cccc(SCC#N)c3)s2)cc1F 429971404 ZTXXLKWUCKVGCI-UHFFFAOYSA-N 397.500 5.049 30 20 GKED N#CCC1(CNC(=O)c2c(Cl)cccc2Oc2ccc(F)c(Cl)c2)CC1 431168975 JXYAOSSEQOKDNJ-UHFFFAOYSA-N 393.245 5.348 30 20 GKED O=C(NCc1c(F)cc(F)c(F)c1F)Nc1cccc(CCC(F)(F)F)c1 432230975 FPPRROHRODNRKM-UHFFFAOYSA-N 394.290 5.060 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3ccc(Cl)cc3Cl)CC2)cc1 432635561 UWWYZTFTKQSLIO-UHFFFAOYSA-N 388.298 5.471 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2c(-c3ccc(Cl)c(Cl)c3)noc2C)n1 435775972 HARPZSSPDKOFJB-LLVKDONJSA-N 392.267 5.212 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 448748274 CDBLMSLPGFQQHP-MRXNPFEDSA-N 390.405 5.249 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCCc2c(F)cc(F)cc21)c1ccccc1 458835150 JVZOPCSPFYNCSZ-LEWJYISDSA-N 383.442 5.077 30 20 GKED C[C@@H](Cc1cccc(F)c1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 459399415 LUUPWMDAGXSIFR-CVEARBPZSA-N 385.508 5.172 30 20 GKED C[C@@H]1CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC[C@@H]1c1ccccc1 460644773 XVHCMOAMFOVAHR-JPYJTQIMSA-N 397.478 5.011 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)Nc2ccc(C#N)c(F)c2)cs1 464650177 LZOCXXQCMNCLOZ-UHFFFAOYSA-N 397.450 5.185 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 464945277 ZXDHYLSWWBJOCC-OALUTQOASA-N 379.529 5.021 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)C1 464948838 BEGIMACDRBMRAC-DEOSSOPVSA-N 392.547 5.123 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)n1 474448567 SHGNMRWQJBRLPN-IBGZPJMESA-N 386.480 5.372 30 20 GKED COc1cc(CSCCCC(C)(C)C#N)ccc1OCc1cccc(C#N)c1 480379915 WDVILNZEGNCSGQ-UHFFFAOYSA-N 394.540 5.709 30 20 GKED CCSc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 480938493 HEEKVHQTGFXSDC-GOSISDBHSA-N 389.505 5.284 30 20 GKED C=CCN(C(=O)C[C@@H](C)c1ccccc1OC)c1nc(-c2ccccc2)cs1 482275816 ZAIHHHOAQPOENH-QGZVFWFLSA-N 392.524 5.532 30 20 GKED Cc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1Cl 483418730 UGSAHRLOKGLBGZ-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#CCCN(C(=O)c1cc(F)cc(C(F)(F)F)c1)C12CC3CC(CC(C3)C1)C2 486566732 OVPGWGXKPBRORR-UHFFFAOYSA-N 394.412 5.169 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C2(c3ccccc3C)CCCCC2)cc1 503504814 LECIERSWTJAPTQ-UHFFFAOYSA-N 391.515 5.143 30 20 GKED O=C(CC(F)(F)F)Nc1ccc(NCc2cc(C(F)(F)F)ccc2F)cc1 509948032 HANGGELOPYFBBK-UHFFFAOYSA-N 394.290 5.348 30 20 GKED CCN(C(=O)c1cc(-c2ccc(OC)cc2)c(C)s1)c1ccc(C#N)cc1 510388783 JKCJSTBAXLTOLG-UHFFFAOYSA-N 376.481 5.271 30 20 GKED CC[C@@H](C)[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 515195493 YOEHKHXQGSUIGR-HXOBKFHXSA-N 399.494 5.822 30 20 GKED CC(C)C[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 517654047 HJWTVQIFRMTVAL-QFIPXVFZSA-N 385.467 5.263 30 20 GKED N#Cc1ccc(CNC[C@H](Cc2ccccc2)C(F)(F)F)c(C(F)(F)F)c1 521319627 DPMFULVQAAVYQG-INIZCTEOSA-N 386.339 5.088 30 20 GKED CSCc1ccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1 524501650 CGLJWDUOBAIPED-UHFFFAOYSA-N 388.492 5.253 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1 524859454 NCBIWZVPXFFOML-UVWXRNBGSA-N 397.664 5.270 30 20 GKED Cc1cccc(Cl)c1NC(=O)CSc1nc(-c2ccccc2)ccc1C#N 535255172 MXERMVLHJDUIFR-UHFFFAOYSA-N 393.899 5.313 30 20 GKED N#CCc1ccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)cc1 544099549 QSGHCUAPHJWORX-VWLOTQADSA-N 395.506 5.342 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)c1ccncn1 545446455 JZGXEFCCHNVSGS-CQSZACIVSA-N 384.222 5.066 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cs1 555320862 XBRJNYWQDNYLKC-GOSISDBHSA-N 394.883 5.512 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2cccc(C#Cc3ccccn3)c2)c(C)c1 568279405 BFOQBUGFDYTBEG-HXUWFJFHSA-N 383.495 5.323 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cnc(-c2ccc(Cl)cc2)s1 570053937 ZQINYFPICFXGHH-HXUWFJFHSA-N 379.916 5.502 30 20 GKED Cn1ccnc1[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(Cl)cc1 571852931 VLGAIYIEGRLXSM-FGZHOGPDSA-N 390.918 5.092 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)[C@@]3(C#N)CC34CCCC4)s2)cc1 581766358 NUMDJZFQHUXSRW-ZHRRBRCNSA-N 379.529 5.078 30 20 GKED C=C(C)COc1cccc(NC(=O)c2csc(-c3ccccc3OC)n2)c1 589382820 LYVCXTGJESGDIV-UHFFFAOYSA-N 380.469 5.026 30 20 GKED CC(F)(F)c1cccc(-c2noc([C@@H]3CCCN3c3ccc(C#N)cc3)n2)c1 590779345 OGICJEAMABAOQM-SFHVURJKSA-N 380.398 5.061 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@H]3CCCc4cc(C#N)ccc43)cc2)oc1C 591336742 DETRRAKXEKNBRV-NRFANRHFSA-N 386.455 5.029 30 20 GKED N#Cc1cccc(C2(NCc3ccc(F)c(-c4cccs4)c3)CCOCC2)c1 594985039 SVQCJFLIMJXWAA-UHFFFAOYSA-N 392.499 5.221 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)C1 596869699 XRUPRXRXVQUSMQ-CYBMUJFWSA-N 389.286 5.213 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)[C@@H](C)Oc3ccccc3C#N)n2)c(C)c1 603557690 WFRNYNAHDCEHCE-MRXNPFEDSA-N 391.496 5.013 30 20 GKED Cc1ccc(F)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603765891 BXBJEOXSGGKAKH-FQEVSTJZSA-N 378.834 5.695 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2NC(=O)N2CCC(C#N)CC2)c(C)c1 609204650 AEJZBBUNVYUDAX-UHFFFAOYSA-N 399.947 5.876 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 609436267 HKFFWVVZIQDYKO-JKSUJKDBSA-N 399.585 6.076 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCc1ccccc1)c1ccc2ccccc2n1 613290511 DWODSAOFAAYHMV-QHCPKHFHSA-N 376.459 5.510 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 613404929 WYQWHAPCCMLALL-HNNXBMFYSA-N 388.414 5.929 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 618745511 VVBWIIRYZULHID-FQEVSTJZSA-N 394.434 5.175 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCc2[nH]c3ccccc3c2C1 642480353 OGXWOJTXPUDBBG-UHFFFAOYSA-N 397.503 5.219 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(Oc3ccc(C)nn3)cc2)CCCC1(C)C 683552339 DYKRFJADQCEYKF-IBGZPJMESA-N 380.492 5.176 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(Br)c1 726729601 JHGCZAZEMFZXAT-AWEZNQCLSA-N 399.313 5.213 30 20 GKED COc1cc(C2(C(=O)[C@@H](C#N)c3nc4ccccc4s3)CCCC2)ccc1C 731136713 VNDOVTUHDJRJLX-QGZVFWFLSA-N 390.508 5.302 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)[C@H](C#N)c1nc2ccccc2s1 732811711 WEKBQDZDOOYIER-AVRDEDQJSA-N 391.540 5.110 30 20 GKED C/C(=C/C(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 733259099 RBWYKPLVJYAQRM-XSLBHYSZSA-N 378.781 5.143 30 20 GKED CCc1cccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743036229 LRJRPPAGNOBMOX-UHFFFAOYSA-N 391.471 5.861 30 20 GKED CC(=O)Nc1cccc(C(C)=NNc2nc3cc(C(F)(F)F)ccc3s2)c1 743445230 KUBCKBZWHDWYGM-UHFFFAOYSA-N 392.406 5.110 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(C(C)(C)C)cc2)ccc1OC 743477176 PNFSSVSFMBGTII-LAUBAEHRSA-N 380.532 5.524 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)n1[C@@H](C)c1ccccc1 747198498 XYFPKISPSGNDOQ-JXFKEZNVSA-N 391.540 5.784 30 20 GKED C=CCc1cc(OCC)cc(CN(C)C[C@H]2CCCO[C@@H]2c2ccccc2)c1O 747806082 PKZMIYBYBNCACT-PXDATVDWSA-N 395.543 5.119 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(Cl)sc1Cl)c1ccc2ccccc2n1 756225809 MHTJWDVPNFEDJZ-CQSZACIVSA-N 389.307 5.802 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1 760352390 ZYBZQFZRDFKLGZ-XMMPIXPASA-N 378.431 5.854 30 20 GKED N#Cc1ccccc1NC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 762258628 HFQRZKHOEVXCFC-WAYWQWQTSA-N 384.279 5.248 30 20 GKED CC[C@@H](CC#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 762719778 UBHJNXZERVNATC-INIZCTEOSA-N 381.526 5.011 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2CC[C@H]2c2cccc(F)c2)c1=S 765037271 HMZCDFBKXFGMOZ-FQEVSTJZSA-N 394.519 5.119 30 20 GKED C#CCCCCCC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 779942114 ZHPMUDKUJJMTRA-UHFFFAOYSA-N 393.874 5.598 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)NCc3ccc(C#N)cn3)cc2)c(C)c1 780651112 MEDKHNITHWRSQA-UHFFFAOYSA-N 388.496 5.043 30 20 GKED O=C1/C(=C\c2ccc3cnccc3c2)CSC/C1=C/c1ccc2cnccc2c1 782314220 QXJFRARSXWGFNI-CBSQCECLSA-N 394.499 5.566 30 20 GKED C=CC[C@@H](C(=O)O[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784832179 JVUSXJAWTUUGOG-RDTXWAMCSA-N 382.847 5.354 30 20 GKED N#CCOc1cccc(CC(=O)N[C@H]2CCCCC[C@H]2c2ccc(Cl)cc2)c1 791234487 KLRSZKHPMPJSOM-VXKWHMMOSA-N 396.918 5.018 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)cn1 792867475 WACLEORNLVMHQL-VURMDHGXSA-N 390.826 5.448 30 20 GKED C=CC[C@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccncc1 792989230 YHWQVMZBUCHZNW-INIZCTEOSA-N 385.227 5.270 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2[nH]1 793118553 SUVBBEPUIZMHAK-GOEBONIOSA-N 385.389 5.027 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)C[C@H](CC#N)c1ccccc1 795990147 JOJTTXLSNXHGAA-NSHGMRRFSA-N 392.499 5.158 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 810184402 QCUDYIXVLCTHED-RHSMWYFYSA-N 383.904 5.230 30 20 GKED Cc1cc(C(=O)Nc2nc(Cl)c(C#N)s2)sc1-c1ccc(F)cc1 813368729 AEYGMVKARLDYOO-UHFFFAOYSA-N 377.853 5.097 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1nc(C2CC2)cs1 842944677 MMAKIDFFRGRYGJ-HNNXBMFYSA-N 378.419 5.238 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C3[C@@H]4CCCCCC[C@@H]34)n2)cc1 850791569 VVAGVFMWCDHASE-KZNAEPCWSA-N 375.497 5.074 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C(F)(F)F)nc1Cl 856779323 WQMRDPBOEXENBB-GFCCVEGCSA-N 381.829 5.406 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(C#N)cc2)CCCC1 859286248 LMPXPPQIQIQEOZ-QGZVFWFLSA-N 389.524 5.261 30 20 GKED COc1ccccc1CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353628 PPDCWLZANLFUPS-QFIPXVFZSA-N 385.467 5.015 30 20 GKED CCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)s1 916906519 CUXVCWSSAGDMKK-KRWDZBQOSA-N 390.464 5.064 30 20 GKED CCc1cccc2c(/C=C\C(=O)c3ccc(NC(=O)NC(C)C)cc3)c[nH]c12 918156180 MOGSXIGFOQVURC-RAXLEYEMSA-N 375.472 5.156 30 20 GKED O=C1/C(=C\c2csc(COc3ccc(Cl)cc3)n2)Cc2c(F)cccc21 921264301 QJVUQELIWWMHCT-WQLSENKSSA-N 385.847 5.337 30 20 GKED O=C(O)c1ccc2scc(C=NN=C(c3ccccc3)c3ccccc3)c2c1 1776012804 OEQOWKCTSZLRQP-UHFFFAOYSA-N 384.460 5.471 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)cc2)c1 1776052007 XRUWRDMBUVSORK-UHFFFAOYSA-N 399.368 5.412 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc2ccccc2c1OC(F)F 1776063303 LCKSAKATHTUTOI-UHFFFAOYSA-N 388.345 5.115 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776801116 DLJCKPSFBFKVTN-CSKARUKUSA-N 398.455 5.814 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)c3cccc4ccccc34)CCC2)cc1 1791587864 RAQHAEXVKZEIJL-UHFFFAOYSA-N 384.479 5.164 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(F)cc1F 7911763 FQCUWEQYXOXQLG-RMKNXTFCSA-N 387.389 5.109 30 20 GKED Cc1cc(C)c(Nc2nnc(SC[C@H](C#N)CCC#N)s2)c(Cl)c1 25696457 FQEFITQNJHSYQL-LBPRGKRZSA-N 377.926 5.088 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl 46861719 TXSVIPRFTJJTCF-IBGZPJMESA-N 391.814 5.156 30 20 GKED C=CCn1c(S[C@H]2CCCc3ccccc32)nnc1-c1ccccc1OC 58986785 PSLYPHHKRNSZLD-FQEVSTJZSA-N 377.513 5.309 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(Br)s2)cc1 65852489 ILRPQSOUOYWZHD-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CCC(=O)Nc1ccc(C)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 102990180 DUDQRCMNVZJUFB-UHFFFAOYSA-N 399.450 5.260 30 20 GKED CCCO[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 108509855 NOWGTYVVQFKWJQ-FQEVSTJZSA-N 393.487 5.164 30 20 GKED Cc1cccnc1[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 115769762 TZZZKLACWYYJIA-LPHOPBHVSA-N 382.533 5.303 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(COC2CCCC2)cc1)c1ccccc1 121010682 UYSMKMLAWMMCHG-QFIPXVFZSA-N 377.488 5.312 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2cccnc2)n1-c1ccc(Cl)cc1 124441461 FMDSGQLOCWFREC-UHFFFAOYSA-N 397.935 5.405 30 20 GKED COc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1NC(=O)c1cccc(F)c1 173921892 PHHUSPBZGYODLB-OAHLLOKOSA-N 389.430 5.131 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 174339041 AVTYZIFSAVLGLO-LJQANCHMSA-N 398.510 5.303 30 20 GKED Cc1ccc2oc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cc2n1 179621492 YTQOSDLZTZTELH-CQSZACIVSA-N 393.855 5.403 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nnn(-c2ccccc2Cl)c1C 189911721 NHZKJGSOYVNUGC-UHFFFAOYSA-N 394.906 5.333 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 194178183 KEJLWNJXMDTKDQ-OAHLLOKOSA-N 385.439 5.175 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1nc2cc(Cl)ccc2s1 221719613 WZQTUEKJSTZMEF-HOSYDEDBSA-N 386.826 5.495 30 20 GKED COc1ccccc1[C@@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccccn1 301858933 CPFNSMYXYORKOF-HXUWFJFHSA-N 383.373 5.182 30 20 GKED OC1=Nc2cc(N=C(O)N3C[C@H](c4ccccc4)[C@H]4CCCC[C@@H]43)ccc2CC1 330147930 UJMFDJZSAYXHPO-SJBKTWHCSA-N 389.499 5.425 30 20 GKED CC1(C)C(O)=Nc2ccc(C(O)=Nc3cc4c(cc3Cl)OCCCO4)cc21 330271600 WDSJGHBLGDZANO-UHFFFAOYSA-N 386.835 5.017 30 20 GKED Cc1ccc(N=C(O)N2CC[C@@]3(C)[C@@H](C2)C3(F)F)cc1N=C(O)C(C)(C)C 330335859 RXULSNCPWGROCE-BEFAXECRSA-N 379.451 5.152 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)s1 421886574 SAXAIXDVFUUCCF-INIZCTEOSA-N 385.945 5.564 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)NCc1ccc(-c2ccccc2C#N)cc1 426080714 RQLHPSRZFWYPLU-HNNXBMFYSA-N 389.421 5.146 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)o1 432977621 NWNZEFHVLDLXGD-UHFFFAOYSA-N 387.483 5.878 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1 433157055 LBEYDUVMHYSGGV-NVXWUHKLSA-N 399.947 5.756 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(C)c1 439359554 PAYQZKLQGSSBMA-UTKZUKDTSA-N 381.545 6.052 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCC#Cc1ccc(C(F)(F)F)cc1 443545904 YDMILVJWCKZPBM-UHFFFAOYSA-N 393.368 5.228 30 20 GKED C/C=C/COc1cccc(CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 448936379 FZVAULRSUGTFGD-REMYHPOOSA-N 380.513 5.074 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(c2ccc(Cl)cc2)C1 454762258 XVSDVGIWXPNFCY-AWEZNQCLSA-N 385.920 5.223 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1cccc(C(F)(F)F)n1 455240356 DRIRQSIHDCTENZ-UHFFFAOYSA-N 391.437 5.317 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@@](F)(c2cccc(Cl)c2)C1)c1ccccc1 458826628 CVLBITZFUATJKV-UNMCSNQZSA-N 399.897 5.355 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@H]3CCC[C@@H]32)c1 460411756 ZVJNAJYBFMYYRK-QRWLVFNGSA-N 380.875 5.409 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)c1cc(C#N)cs1 464228418 CIUHNIIIWPTGRC-UHFFFAOYSA-N 395.871 5.086 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 464260404 XOGHTYFMRDCSFS-LLVKDONJSA-N 382.769 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(F)cc(C(F)(F)F)cc1F 464470718 KAZPHTWSRXRGQV-UHFFFAOYSA-N 383.360 6.088 30 20 GKED O=C(NCCC(F)(F)F)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 464913877 TUGKDNRGESYQQZ-UHFFFAOYSA-N 379.275 5.194 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(Cl)ccc3OCC3CCC3)cc2)CC1 467053527 JSHWVCXXVQMVJI-UHFFFAOYSA-N 380.875 5.326 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(CC(C)C)c1C(F)F 475544899 IWXLEMYHUBMQDG-UHFFFAOYSA-N 390.478 5.973 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC[C@@H]1c1cccc(OC)c1)c1ccc(F)c(F)c1 477736461 ANAJJTYGIGDQAP-NHCUHLMSSA-N 386.442 5.137 30 20 GKED Cc1oc(-c2ccsc2)nc1CSc1nc(C(F)(F)F)ccc1C#N 488805624 YDQADTBPXVMADY-UHFFFAOYSA-N 381.404 5.289 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2C#N)oc2c(C)cc(Br)cc12 489689352 IBVDIFNWYIXPRD-UHFFFAOYSA-N 387.208 5.075 30 20 GKED C=CCN(Cc1cccs1)[C@@H](C(=O)Nc1cccc(OC)c1)c1ccccc1 499056265 PWSVFCSIKNMDAK-JOCHJYFZSA-N 392.524 5.125 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c1 499488366 WRPWJPDDGRSZKI-CYBMUJFWSA-N 378.419 5.313 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(OC3CCCC3)cc2)c1 502290053 MDSBMYANERDEBO-UHFFFAOYSA-N 379.460 5.335 30 20 GKED N#CCCCCNC(=O)c1oc2ccccc2c1CSCc1ccccc1 505086745 IUUPTRDQIRDHMC-UHFFFAOYSA-N 378.497 5.290 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 507888346 MKVFKHCNQIDJKC-UHFFFAOYSA-N 395.418 5.566 30 20 GKED Cn1c(SCc2ccc(-c3ccccc3C#N)cc2)nnc1-c1ccccc1 514931302 CMHSDCUEKLCQEX-UHFFFAOYSA-N 382.492 5.313 30 20 GKED CCC1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)CC1 517107188 KIPHZFNJMHHEGC-UHFFFAOYSA-N 393.487 5.403 30 20 GKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 520294744 PFUKNOXXXZUCBK-NBVRZTHBSA-N 398.466 5.313 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccccc3F)o2)cc1 520863911 MXSWYMQSAKDJQH-UHFFFAOYSA-N 378.403 5.045 30 20 GKED CC[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccc(OC)cc1 521821031 UJPCFQDFJNHOII-VWLOTQADSA-N 386.495 5.387 30 20 GKED CN(CCC(F)(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522635049 WBAFXAZRHRXZEM-UHFFFAOYSA-N 382.769 5.028 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(F)c2F)cc1Cl 523272010 AELHLGDINRAYJU-KRWDZBQOSA-N 382.797 5.526 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1cccc(C#N)c1 523956828 GJEVLXKRDSKDOR-UHFFFAOYSA-N 387.826 5.152 30 20 GKED N#CCCCOc1cccnc1NC(=O)c1ccc(-c2ccc(Cl)cc2)s1 524275042 HMRICOYHXUWKDZ-UHFFFAOYSA-N 397.887 5.398 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 535333829 WNVGTVMLALTNCN-INIZCTEOSA-N 376.481 5.299 30 20 GKED N#C[C@@H](C(=O)c1cccc([C@H]2CCCOC2)c1)c1nc2cc(Cl)ccc2s1 536587748 ZSWJQQFVNKGRPN-RDJZCZTQSA-N 396.899 5.334 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nc2ccccc2s1 537062359 RGXHOLBRQRLITD-AWEZNQCLSA-N 397.481 5.195 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)c2ccccc2C(F)(F)F)cc1 537999316 ZFOFDPNXFHNPAM-UHFFFAOYSA-N 380.369 5.174 30 20 GKED C=CCC[C@@H](NCc1csc([C@@H](C)OC)n1)c1ccc(C(F)(F)F)cc1 539335575 HJDLXCVKUDDGDW-CXAGYDPISA-N 384.467 5.666 30 20 GKED Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 539492999 DIBUWDJDEZUAOK-UZUQRXQVSA-N 393.556 5.069 30 20 GKED CC(C)(C)c1nn(Cc2ccccc2)cc1CN[C@H](CCC#N)c1ccccc1 539527683 TVJLUPYAHMIBPA-HSZRJFAPSA-N 386.543 5.364 30 20 GKED C[C@@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)C(c1ccccc1)c1ccccc1 540736757 MUGKGQLKTDIMKD-LJQANCHMSA-N 380.491 5.192 30 20 GKED Cc1ccc([C@@H](C)N(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 557418915 IBBACHSILRGFIY-IEBWSBKVSA-N 395.572 5.187 30 20 GKED CC(C)(C(=O)Nc1cccc(Cl)c1Br)c1cc(F)cc(C#N)c1 568755196 SAAVMYFBQQTOHH-UHFFFAOYSA-N 395.659 5.030 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](NC2CCC(C)(C#N)CC2)CCC3)cc1 570640596 NNFDBCBWKNSBAG-OJCRERRGSA-N 381.545 5.258 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(CC(F)(F)F)cc1 580083103 FWLDPMZUXDJGKQ-UHFFFAOYSA-N 394.441 5.179 30 20 GKED C[C@H](NCc1cccc(COCc2ccco2)c1)c1ccc(C#N)cc1Cl 581644918 VLEAXZKECWXGKC-INIZCTEOSA-N 380.875 5.372 30 20 GKED COc1ccccc1[C@H](C)CC(=O)N(Cc1ccccc1)c1ccccc1C#N 583039528 IQMRWBADXHAMMA-LJQANCHMSA-N 384.479 5.294 30 20 GKED C[C@H](NC(=O)[C@H]1CC[C@@H](C(F)(F)F)C1)c1ccc(-c2cccc(C#N)c2)cc1 586806319 SXMDZCDAVZFECA-PNHOKKKMSA-N 386.417 5.381 30 20 GKED N#C[C@H](C(=O)c1ccccc1OCC1CC1)c1nc2cc(Cl)ccc2s1 587988853 ZIPJAZJKNYWQFE-OAHLLOKOSA-N 382.872 5.229 30 20 GKED N#CCCCOc1cccc(CN2CCC(c3noc4cc(F)ccc34)CC2)c1 589520575 XRFHZDHIDHBIGC-UHFFFAOYSA-N 393.462 5.029 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC(F)(F)CC1 599728022 PJGWCTABYHLZTM-UHFFFAOYSA-N 385.414 5.312 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)cn2)c1 603756026 CSMORURXHYBESH-LSDHHAIUSA-N 389.377 5.053 30 20 GKED C=CC[C@H](C)NC(=O)c1ccccc1SCc1ccc(Br)cc1 604879993 DOIUOKQFUXIRCX-AWEZNQCLSA-N 390.346 5.436 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Sc1ncc(C(C)C)n1C(C)C 606758257 QADXIDPIRLWEOV-INIZCTEOSA-N 391.606 5.344 30 20 GKED CC(C)[C@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608837322 BYAQWLOUEOXMRF-KUHUBIRLSA-N 389.421 5.335 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(-c3ccc(F)cc3)s2)c1 609068013 FDWLNXNHCKFZLF-UHFFFAOYSA-N 388.370 5.280 30 20 GKED N#CCn1c(C(=O)Nc2cccc(COc3cccc(F)c3)c2)cc2ccccc21 609164147 YPQFUWCPWPXSEH-UHFFFAOYSA-N 399.425 5.135 30 20 GKED CC(C)CN(C)c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609377936 RVTOPCOCHFDIBI-QGZVFWFLSA-N 381.545 5.283 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1C(C)C 609427553 JGJTUSHFWIHGNT-ROUUACIJSA-N 396.556 5.919 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)[C@@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2 609814187 LFRIPVLBGIDIDO-HFMPRLQTSA-N 392.930 5.219 30 20 GKED CC(=NNc1ncnc2sccc12)c1ccc2c(c1)Nc1ccccc1S2 725818430 LFIBYLPMIMGEPH-UHFFFAOYSA-N 389.509 5.736 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 727267152 OJOOGBSQLBMBBZ-BPOWMSRESA-N 398.764 5.107 30 20 GKED CCS[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 727627204 MARAQSNPZDRGHH-YOEHRIQHSA-N 378.950 5.417 30 20 GKED CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 727935245 SAWJXRPZMCGJCV-VWNXMTODSA-N 383.495 5.485 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1N[C@H](C)C(=O)Nc1ccccc1C#N 728066918 VWIFXAQWRPYMNG-RTBURBONSA-N 399.494 5.446 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(O)c(F)c2)cc1OCc1ccccc1 728438213 CEFJQDXRHJSAGZ-JXMROGBWSA-N 378.399 5.015 30 20 GKED Cc1nc(C)c(COC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 729206162 INEMRANHVCOYND-UHFFFAOYSA-N 394.521 5.281 30 20 GKED CC[C@@H](NC(=S)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1cccs1 734375026 RUZFMHXJWNYUGK-OAHLLOKOSA-N 397.491 5.010 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)c3ccccc3SCC#N)cn2)c1C 734462803 IRCLGWDFNQTHFT-UHFFFAOYSA-N 389.480 5.359 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccncc1 734681106 YFXPZRKDJWWQJY-IBGZPJMESA-N 389.421 5.092 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCOc3ccccc3Cl)c2)s1 739591050 PUFVSHNMFQYQAX-UHFFFAOYSA-N 396.899 5.025 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)Nc3ccc(C#N)c(C#N)c3)sc2c1 741942970 KXYPNCPTYLMRTB-UHFFFAOYSA-N 379.872 5.674 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccc3c(c2)COC3)cc1OCC 742436058 FRUDLQCEXVAHAS-VMPITWQZSA-N 386.875 5.454 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 745947711 KAOJQWSMCIEIPA-CJNGLKHVSA-N 384.888 5.231 30 20 GKED COc1cc(/C=C2/Cc3c(Cl)cccc3C2=O)ccc1OCC(F)(F)F 750909836 NWCDODAQYYPVJD-GHXNOFRVSA-N 382.765 5.112 30 20 GKED N#Cc1csc(C(=O)O[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)c1 752195695 MJGZIVPTWGCFMZ-LBPRGKRZSA-N 379.281 5.099 30 20 GKED O=C(CCCC(F)(F)F)OCc1c(F)c(F)c(C(F)(F)F)c(F)c1F 764898654 JNCOCEVIVIJIJE-UHFFFAOYSA-N 386.185 5.038 30 20 GKED CCN(c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1)C(C)C 770099949 MFGFLMCVPGLRLR-JOCHJYFZSA-N 399.494 5.036 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(OC)c(C3CC3)c2)cc1 774049571 BFHBNGQJKPNXML-QVKFZJNVSA-N 390.483 5.047 30 20 GKED C=C(C)[C@@H](NC(=O)c1sccc1SC(F)F)c1ccc(F)c(F)c1 776399359 PETKXVRGHFZHAB-CYBMUJFWSA-N 375.412 5.388 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@H]1/C=C/c1ccccc1 780678895 QOQQWCFFCMPIAO-RQVCNLKISA-N 389.499 5.467 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(Cc4ccccc4F)CC3)n2)cc1 785881281 VYUJHUXWXDKENG-SFHVURJKSA-N 390.483 5.457 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2)cc1Cl 786448793 XQYOCAFFBPUQGN-MRXNPFEDSA-N 375.255 5.078 30 20 GKED C[C@@H]1/C(=C\c2ncc(C(F)(F)F)s2)C(=O)c2cccc(Br)c21 788355824 PPHLBKGJCPQQRR-AJQDLKILSA-N 388.208 5.308 30 20 GKED C=CC[C@H](OC(=O)[C@@H]1CCC(=O)c2cccn21)c1ccc(Cl)c(Cl)c1 797555215 VYPDEPPVWVOFTG-WMZOPIPTSA-N 378.255 5.173 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 798813939 BLRHZUYTJNGHOD-SJKOYZFVSA-N 398.384 5.190 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(N(C)CCCC)cc1 806261830 PPFFQUAIVAVJLY-UHFFFAOYSA-N 397.567 5.311 30 20 GKED O=C1/C(=C\c2ccc(Cl)c(C(F)(F)F)c2)C[C@H](C(=O)O)c2ccccc21 806560909 PXVHEGDEAJGPPP-JOHMGYAOSA-N 380.749 5.197 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1F 813216759 YJMPBWCXRQBWGU-LLVKDONJSA-N 384.760 5.047 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=C4CCC(C)(C#N)CC4)c23)cc1 834934098 HRMRVORMKYHVPI-UHFFFAOYSA-N 375.501 5.539 30 20 GKED Fc1cc(CNC(CCC(F)(F)F)CCC(F)(F)F)ccc1-n1ccnc1 850388525 DRFRHYBNFRIZOL-UHFFFAOYSA-N 397.338 5.155 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354170 WMCFRVUOUJKXOA-HXUWFJFHSA-N 391.421 5.284 30 20 GKED CC(=NN(c1ccccc1)c1ccccc1)c1cnn(-c2ccc(F)cc2)c1C 920986427 GXGFBIIDUFIAMP-UHFFFAOYSA-N 384.458 5.882 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(OCc3ccc(Cl)cc3)cc2)cc1F 1776073828 QQLCSMGNTDCMST-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NOC/C=C\Cl 1776080746 ZDFOYNAXOBABRD-IXXWPGSFSA-N 387.863 5.041 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(-c2ccccc2Cl)s1 1776086829 QYVLVGPAQHGHKI-UHFFFAOYSA-N 384.888 5.911 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776341424 HGIXOWQLELQFET-PKNBQFBNSA-N 390.504 6.208 30 20 GKED N#CCc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 51157174 CMOOGWRBIDBGGG-KRWDZBQOSA-N 377.856 5.020 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1cc(C#N)ccc1OC(C)C 56213265 JJGBABKWOMUBKO-UHFFFAOYSA-N 377.469 5.030 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 58384015 CTEHMOSMCKEZEC-AWEZNQCLSA-N 376.378 5.119 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 65666996 RRHDFAXUQSBOSQ-UHFFFAOYSA-N 393.302 5.178 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OCC(F)(F)F)cc1 66802003 FNVSJSUIMXKPIT-CYBMUJFWSA-N 394.418 5.274 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)n1 102115481 FPYAUBPUBAFCNR-LBPRGKRZSA-N 393.415 5.084 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2N2CCCCC2)c1 113525590 DLPHMTCRTKXRLT-UHFFFAOYSA-N 378.476 5.003 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3c(F)cc(C#N)cc3F)s2)cc1 150866379 WDPLZISZGPMALE-LBPRGKRZSA-N 397.450 5.068 30 20 GKED O=C(N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(F)cc1C(F)(F)F 159898268 ACAHWGPZMVJABN-CYBMUJFWSA-N 383.238 5.017 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1F 170673845 VWCPWBUAFZSVAC-KSSFIOAISA-N 389.455 5.191 30 20 GKED C=CCN(C(=O)c1cc2nc(C)ccc2o1)c1nc(-c2ccccc2)cs1 171519402 JKLYTCUVCGUSIT-UHFFFAOYSA-N 375.453 5.093 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)c2cccc(SCC#N)c2)s1 175695063 SFNBQKZPJFCSSC-UHFFFAOYSA-N 382.510 5.108 30 20 GKED Cc1nc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)sc1C 176414742 CFLRDTGURFFIPO-GFCCVEGCSA-N 391.587 5.026 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1occc1CSc1ccccc1 182063441 MAYXVGZPAQCMQG-OAHLLOKOSA-N 378.453 5.115 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@H](C)c1cccc(NC(C)=O)c1 185110214 IHAKNQZCYFTHCS-RTBURBONSA-N 378.516 5.337 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)csc1Br 185351983 ZSRWTLVGTRWLOO-SNVBAGLBSA-N 395.347 5.323 30 20 GKED C=C(C)[C@H](NCc1ccc(OC)c(OCCCC#N)c1)c1ccc(F)c(F)c1 187371609 BTMXMVCEUCUUGF-QFIPXVFZSA-N 386.442 5.063 30 20 GKED C=CCn1c(SCc2coc(-c3ccccc3)n2)nnc1-c1ccccc1F 192622069 VPHMTAMNUSTUJV-UHFFFAOYSA-N 392.459 5.218 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1 194748939 RWCHUZAGIQLMFX-OAHLLOKOSA-N 391.323 5.025 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 303155021 FZMKKLAWVUUEGG-UHFFFAOYSA-N 378.815 5.265 30 20 GKED Cc1noc(C)c1C(C)(C)/N=C(/O)c1cc(Cl)cc(F)c1Br 330680314 YKKCSMKDKALPKQ-UHFFFAOYSA-N 389.652 5.086 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3c3cccnc3)c2)cc1 377182297 JJFBFECQBIMEGS-JOCHJYFZSA-N 384.439 5.115 30 20 GKED CCc1cccc2c(C3CCN(CCCC4(C#N)CCOCC4)CC3)c[nH]c12 410332353 JIWPDZKDFSBRGD-UHFFFAOYSA-N 379.548 5.010 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1CN(C(=O)[C@H](C)CC(=C)C)C(C)C 411086571 OVPMYEQWSGYRAJ-VQTJNVASSA-N 384.564 5.567 30 20 GKED Cc1cc(C#N)ccc1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 438835522 LADHZTOXZPGJOO-NRFANRHFSA-N 399.494 5.622 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)N[C@H](CCC#N)c1ccccc1 438837466 ITZBYRDBTXMQTL-HXUWFJFHSA-N 375.472 5.182 30 20 GKED N#CCCN(Cc1ccco1)C(=O)CC(Cc1ccccc1)Cc1ccccc1 439947723 FFMYKGZENXCRLM-UHFFFAOYSA-N 386.495 5.014 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)NCC3CCC(C#N)CC3)o2)cc1 441144774 GZRHNKBTGJEFIV-UHFFFAOYSA-N 399.494 5.377 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3cc(Cl)c(Cl)cc3Cl)on2)c1 448137316 MUOQLQQMASMTLS-UHFFFAOYSA-N 392.629 5.426 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1 455200564 KPMLTFDRDVMAFC-ZWKOTPCHSA-N 393.384 5.163 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccc(Cl)cc1)C1CC1)c1ccccc1 458794515 BCKAWGVBAZAIIQ-NRFANRHFSA-N 381.907 5.449 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)Cc1cccc(F)c1 459401454 NXGAGPIJTZTSKI-HOTGVXAUSA-N 385.508 5.315 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)c1 465488469 GJJZVUCYWNTLIJ-QHCPKHFHSA-N 399.425 5.032 30 20 GKED Cc1ccc(C)c2c1CCC[C@H]2Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469147436 WYPGZDSAAVRDPI-JOCHJYFZSA-N 387.527 5.376 30 20 GKED CC[C@@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C1CCC(C)CC1 469955104 ACIOFYVKUYQOJK-WIXQSORDSA-N 395.547 5.061 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)cc1)c1ccccc1 472501679 ODRGAKLCEUKLOG-UTKZUKDTSA-N 395.462 5.203 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 474903166 YVGRTFHXHPVSOM-BSIFCXSSSA-N 396.918 5.529 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CN(C)Cc1ccccc1 475583304 LWKXZQNWIIPIDZ-LJQANCHMSA-N 379.548 5.181 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc(Cl)c3F)c2)cc1 477464385 PVTOATRFUHKWSN-UHFFFAOYSA-N 394.833 5.376 30 20 GKED C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)Nc1ccc(C#N)cc1Cl 477947491 VRWZRZPYQQIDFV-GFCCVEGCSA-N 395.812 5.325 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3coc4cc(F)ccc34)n2)cc1 483521502 YKKOBONRQPIDMD-INIZCTEOSA-N 387.395 5.057 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc(Oc2ccccc2)nc1 486226488 AVHCGGFLQOZHBN-UHFFFAOYSA-N 376.481 5.082 30 20 GKED C[C@H](Nc1ccc(NC(=O)CSc2ccc(C#N)cc2)cc1)c1ccccc1 486554163 DHTPRDAMELDJHF-KRWDZBQOSA-N 387.508 5.462 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2ccccc2Cl)on1)c1ccccc1 487243825 UPTIGQGAGXUEIY-SFHVURJKSA-N 379.847 5.160 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1ccccc1 488327159 DTFNZXGXVRVOPN-MRXNPFEDSA-N 387.361 5.054 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccccc1)C1CCC1 494680531 NNWJDCRODPYJJS-JOCHJYFZSA-N 380.536 5.093 30 20 GKED Cc1cccc([C@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)c2ccccn2)c1 497522590 JQNSMSIWDOEPKF-QFIPXVFZSA-N 386.405 5.290 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N(C)Cc5cccc(C#N)c5)(C4)C2)C3)cc1 498492552 SUYRSDCNFIRJOY-XWYWGPMTSA-N 398.550 5.363 30 20 GKED C[C@H]1[C@H](c2ccccc2)c2ccccc2CCN1CCCC1(C#N)CCOCC1 499560380 FUXGYHOKSRYRDN-SQJMNOBHSA-N 388.555 5.166 30 20 GKED Cc1onc(CC(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)c1C#N 500000632 KEOAWJAQBCKBEF-UHFFFAOYSA-N 393.446 5.370 30 20 GKED N#Cc1ccc(C2=CCN(Cc3csc(-c4ccccc4F)n3)CC2)cc1 502495753 OVVARIWGYFFEOW-UHFFFAOYSA-N 375.472 5.110 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(OC4CCCC4)cc3)CC2)cc1 503628917 REPJUVWZMITPNX-UHFFFAOYSA-N 387.483 5.201 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1 505001213 QAPCZVYINZDGED-CQSZACIVSA-N 396.878 5.391 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)C[C@@H](C)C2 509230235 REJNGZKQGGTYNY-GMQRBVGNSA-N 395.506 5.343 30 20 GKED Cc1c(C(=O)Nc2cc(-c3ccco3)nn2C(C)C)sc2ccc(C#N)cc12 509446300 FMNRYEFVNRPNDF-UHFFFAOYSA-N 390.468 5.371 30 20 GKED CCN(C(=O)c1ccc(OCCC(C)C)c(OC)c1)[C@@H](C)c1ccc(C#N)cc1 509607505 HRWFSIRCIOMAMT-SFHVURJKSA-N 394.515 5.215 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nccn1Cc1ccccc1 510202927 DTLROECEGPOQKN-UHFFFAOYSA-N 382.492 5.157 30 20 GKED COc1ccc(CN(C)Cc2cccc(C(F)(F)F)c2)cc1OCCCC#N 510404400 PEHHMFJAWMFTRA-UHFFFAOYSA-N 392.421 5.029 30 20 GKED N#Cc1cccc(COc2cccc(CN3CCC(OC4CCCC4)CC3)c2)c1 512623392 RRKQBDZLZLEYAA-UHFFFAOYSA-N 390.527 5.061 30 20 GKED C[C@@H](NCc1ccccc1CN(C)C1CCCCC1)c1ccc(C#N)cc1F 512626898 XMJAEXVBHIZKSS-GOSISDBHSA-N 379.523 5.313 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ncc(-c2ccccc2)s1 518954733 GBQAHEMXMMQUQL-UHFFFAOYSA-N 379.485 5.039 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)C[C@H](C)C2 520113549 PFKXKEBMEBWDKB-YUKSBARRSA-N 399.494 5.182 30 20 GKED C=CCOc1ccc(CNCc2cc(F)cc(Br)c2)cc1Cl 520205342 NDBZTWJCIXLKIO-UHFFFAOYSA-N 384.676 5.096 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 521793666 YKHNCMSMPGYDTA-SFHVURJKSA-N 385.467 5.407 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)c1 525143782 CQDKBSUNNBSWQV-OAQYLSRUSA-N 390.870 5.565 30 20 GKED C=CCN(CCC(=O)Nc1c(Cl)cccc1Cl)CCc1ccccc1 532503219 QVVJVQJSLNEYIN-UHFFFAOYSA-N 377.315 5.053 30 20 GKED N#CCCCOc1cccc(CNc2ccc(CCN3CCCCC3)cc2)c1 532898149 NVGXQMHJUJGMRA-UHFFFAOYSA-N 377.532 5.010 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccnc(OC2CCCCC2)c1 536797728 UCKURUSZCHEZGP-UHFFFAOYSA-N 381.501 5.051 30 20 GKED N#Cc1ccsc1NC(=O)CCN[C@@H](c1ccc(Cl)cc1)C1CCCC1 537105858 CEOGPPCOMDYCKZ-LJQANCHMSA-N 387.936 5.123 30 20 GKED C=CCn1c(SCc2ccc(CC#N)cc2)nnc1-c1cccc(Cl)c1 541280803 BEZVVQSDPVATNQ-UHFFFAOYSA-N 380.904 5.143 30 20 GKED C[C@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(CC#N)CC1 541953662 PVCZLKNIOAXJFU-QGZVFWFLSA-N 392.934 5.425 30 20 GKED COc1cc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)ccc1SC 542014407 KWWRUYJABNGLJH-QGZVFWFLSA-N 388.536 5.807 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1COC(C)(C)CC 544626429 UDXXSTNVNHKHIE-UHFFFAOYSA-N 396.531 5.621 30 20 GKED C=CCC(F)(F)c1nc([C@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 551096790 DKCKSYICKPUXAW-GFCCVEGCSA-N 380.288 5.021 30 20 GKED CC(C)(C)CN(CCC#N)CCC(=O)Nc1ccccc1Oc1ccccc1 558029515 BTHBFAPOYRPNDP-UHFFFAOYSA-N 379.504 5.069 30 20 GKED Cc1ccc(-c2csc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)n2)cc1 565275079 HLFQPYXVRNYUFA-UHFFFAOYSA-N 398.491 5.790 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(CC#N)cc2)CCC3)cc1 571045882 NDYHAKVNEJFJML-FQEVSTJZSA-N 389.524 5.052 30 20 GKED C=C[C@H](CC(=O)N(C)c1ncc2c(n1)-c1ccccc1SC2)c1ccccc1 571798937 AEYHTRVMPQDXLB-MRXNPFEDSA-N 387.508 5.072 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCC(=O)[C@@H](C)C1(C)C 573686981 ZWGCTVSBCFNEEG-OXQOHEQNSA-N 390.483 5.239 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCN(C)c2ccccc21 581471337 MDWJTFIFLRAZJE-SJLPKXTDSA-N 394.544 5.031 30 20 GKED Cc1c(NCc2ccc(C3(C#N)CC3)cc2)cccc1-c1nnc2n1CCCCC2 594938227 YVFMCWSOZDEXMY-UHFFFAOYSA-N 397.526 5.147 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC[C@@]1(C)CC1(F)F 596703975 WNPRTZLUASMXFE-FQEVSTJZSA-N 385.414 5.216 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cc2ccccc2o1 603690494 KKQLJCAEDWRTHI-OAHLLOKOSA-N 398.422 5.374 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 609080494 IONRWABGMYXVFU-IBGZPJMESA-N 399.494 5.671 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 609652443 ZDZNNMQFBKCAKC-MSOLQXFVSA-N 386.451 5.104 30 20 GKED C[C@H](c1ccccc1)n1c(SCCC(C)(C)C#N)nnc1-c1ccccc1 610286034 LEROTXCTKMXLEJ-QGZVFWFLSA-N 376.529 5.586 30 20 GKED C[C@H](Nc1nc(-c2cccnc2)nc2sc3c(c12)CCC3)c1cccc(C#N)c1 610340417 UELRGCGVYIGYTO-AWEZNQCLSA-N 397.507 5.287 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 614932307 YZJATYRNFIVVEQ-UHFFFAOYSA-N 395.356 5.342 30 20 GKED FC(F)(F)Oc1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 618449958 IEOJBPZYOHAGHA-GHMZBOCLSA-N 395.265 5.148 30 20 GKED N#Cc1ccc(C[C@H](C#N)c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc1 619508063 GXDNOASWGWVFSZ-JOCHJYFZSA-N 376.419 5.125 30 20 GKED C=CCCC(C)(C)NC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 620861799 ZXYWHIAZPKVZJR-UHFFFAOYSA-N 390.936 5.437 30 20 GKED C=CCN(C(=O)c1cccnc1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891471 PCDAKEJLXPOXDN-UHFFFAOYSA-N 397.503 5.705 30 20 GKED C=C(C)Cn1c(CSc2ccc(Cl)cc2)nnc1N1CCC(F)(F)CC1 670203063 ACUDBAWNWJTWQN-UHFFFAOYSA-N 398.910 5.035 30 20 GKED FC(F)n1ccc(-c2nc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)no2)n1 680682250 NIHBGUYXFOHMKH-UHFFFAOYSA-N 398.213 5.033 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)cc1OC 728697979 APKYWNQRYYPDIB-UEOUDEGLSA-N 379.456 5.061 30 20 GKED COc1cc2c(cc1NC(=O)c1cc3ccccc3n1CC#N)oc1ccccc12 729305286 INXJUCXCVDEVKP-UHFFFAOYSA-N 395.418 5.325 30 20 GKED C=CCOc1ccccc1CNCc1c(C)nn(Cc2ccc(C)cc2)c1Cl 732230453 QYNFRDCZPGKVOV-UHFFFAOYSA-N 395.934 5.056 30 20 GKED CC(C)c1cnc(COC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 733495316 MNCMSIFCQHRDSD-UHFFFAOYSA-N 376.412 5.013 30 20 GKED C#CC[C@@H](OC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1ccccn1 733692225 BPRBYLLCYGBIDE-PYUISTEWSA-N 379.765 5.075 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2c(Cl)ccc(Cl)c2Cl)c1 733800530 YDNQDCQSJHFZKL-CYBMUJFWSA-N 383.706 5.618 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 740538701 IZPZKBLGXJXNEU-HIFRSBDPSA-N 382.435 5.377 30 20 GKED COc1cccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)c1OC 741845334 ZLCUPWIVDGXRSV-DHZHZOJOSA-N 382.403 5.254 30 20 GKED Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 743096269 PQILZUYBJCHEMT-GAJHUEQPSA-N 387.483 5.386 30 20 GKED CC(COc1ccc2cc(Br)ccc2c1)=NNc1ccc(F)cn1 743442271 USSMHCVCQAEIMQ-UHFFFAOYSA-N 388.240 5.003 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC(C)(C)c3ccccc3)n2)cc1 743458216 QEUNJYJNTKSANL-LJQANCHMSA-N 390.508 5.363 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(N2CCCCCC2)cc1 746498042 QSSFEHNFIHQANI-UHFFFAOYSA-N 379.508 5.060 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3ccccc3C(F)(F)F)C2=O)s1 749015870 AQEUHYONIIFSCD-QPEQYQDCSA-N 396.440 5.044 30 20 GKED Fc1ccc(C2OCCO2)c(Cl)c1C=NNc1ccc(Cl)cc1Cl 761770221 RKYPNTWEKWSCFS-UHFFFAOYSA-N 389.641 5.277 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 767870029 QPCMZKZIQAANMJ-UHFFFAOYSA-N 391.540 5.770 30 20 GKED C=CC[C@@H](OC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 778744986 LJXRVVNMGUFCID-GOSISDBHSA-N 382.847 5.183 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2cc(F)ccc2F)C(C)C)ccc1OC 794808796 CLICFVMSLATIJK-VGOFRKELSA-N 388.458 5.141 30 20 GKED CCOC(=O)c1scnc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 794931903 RMRHHYDPEVZRAZ-WAYWQWQTSA-N 390.675 5.176 30 20 GKED C=CCN(C(=O)c1cc(C2CC2)cnc1Cl)c1nc(-c2ccccc2)cs1 796524177 HSJROMPYXJFVCA-UHFFFAOYSA-N 395.915 5.569 30 20 GKED CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCC(C)(C)CCC#N)c12 798878090 BEXUGAXNIBAEHM-UHFFFAOYSA-N 383.492 5.176 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C\c3ccc(OC(F)F)c(Cl)c3)cc12 806576572 HNLWVMXCWQWGBF-HYXAFXHYSA-N 382.819 5.094 30 20 GKED CC(=NNc1cccc(Br)c1)c1nc2ccccc2n1C(F)F 812457900 QKZZJEYKRWATHC-UHFFFAOYSA-N 379.208 5.030 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1C 813218166 MNIAWZJUJXQLBP-INIZCTEOSA-N 378.419 5.076 30 20 GKED C[C@@]12CC[C@H]3[C@H](CC=C4C[C@@H](OC(=O)CC5(C#N)CC5)CC[C@@]43C)[C@@H]1CCC2=O 815965886 FSTKFRZRNYBVMM-RESQQWCNSA-N 395.543 5.124 30 20 GKED Cc1ccc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1NC(=O)OC(C)(C)C 819736699 NKLKWOOPIPZMAA-MRXNPFEDSA-N 393.487 5.047 30 20 GKED C#CCCCCCC(=O)N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1 837847597 VWMBRIWCIZUPQH-UHFFFAOYSA-N 398.547 5.323 30 20 GKED COCC(C)(C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 842289929 UANCMRYKXBFCBR-ZDUSSCGKSA-N 397.327 5.356 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1nc(C2CC2)cs1 842941020 GVMPYQUWWSHZPU-LBPRGKRZSA-N 395.311 5.363 30 20 GKED C[C@@H](CC(C)(C)C#N)OC(=O)c1csc(-c2cc(Br)cs2)n1 851210108 NZAHYSYWIPSYQH-VIFPVBQESA-N 399.335 5.119 30 20 GKED CN(C(=O)c1ccc(OCc2ccccc2C#N)cc1)c1nc2ccccc2s1 915283777 JNDCPESKRLZGPH-UHFFFAOYSA-N 399.475 5.024 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)cc1 916914487 ZLHSYISICUPVNG-MRXNPFEDSA-N 389.282 5.297 30 20 GKED O=C(/C=C/c1csc([N+](=O)[O-])c1)c1ccc2ccccc2c1OC(F)F 917144567 GULKONNYCQRNQU-VMPITWQZSA-N 375.352 5.307 30 20 GKED Cc1cc(C)n(N=Cc2c3ccccc3c(Cl)c3ccccc23)c(=O)c1C#N 917569776 USPWRFYUVQEXPJ-UHFFFAOYSA-N 385.854 5.179 30 20 GKED CC(C)c1ccc(-c2ncc(COC(=O)c3ccccc3OCC#N)s2)cc1 920633591 PVFKTPMPPSTPQL-UHFFFAOYSA-N 392.480 5.193 30 20 GKED C[C@H]1CC(=NNc2ccc(Cl)c(C(=O)O)c2)c2cccc(Br)c21 1776033539 XHSHPFWGMIWAGI-VIFPVBQESA-N 393.668 5.124 30 20 GKED CC(=NNc1cc(Cl)ccc1[N+](=O)[O-])c1ccc(-c2ccc(C(=O)O)o2)cc1 1776060890 UZNMQGXWGBPBKC-UHFFFAOYSA-N 399.790 5.043 30 20 GKED CC[C@H](NN=C1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21)C(=O)O 1776067575 DXSAKOWDOFHGKQ-UGSOOPFHSA-N 391.298 5.076 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(-c2ccc(Cl)cc2)s1 1776073919 WIBRAPUOAOXFEB-UHFFFAOYSA-N 388.851 5.742 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776339929 QWDHGGBDIOPXRZ-ZRDIBKRKSA-N 390.504 6.208 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1sc2c(C)cc(C)cc2c1C 1777269514 MBHHUGMEXHNWIY-FPLPWBNLSA-N 380.465 5.429 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3cc(Br)cc(C(=O)O)c3)coc12 1777449089 SFUSCKHYCSHBRN-AATRIKPKSA-N 385.213 5.098 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cscc3C)CCC2)cc1 1791248201 VERBNKNAOCJJDO-HNNXBMFYSA-N 382.529 5.016 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(-c3ccccc3)no2)n1 29878014 VBHIUKMINKSOFE-UHFFFAOYSA-N 375.375 5.228 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccc(C#N)cc1 31436144 FSUWJYCLARKTNS-CYBMUJFWSA-N 389.505 5.387 30 20 GKED Cc1ccc2nc(C)c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1 41557577 AJPQMIVEDNUCCD-MRXNPFEDSA-N 390.393 5.087 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2oc(C3CC3)nc2c1 46392731 XYOYHZWGAXRCNC-UHFFFAOYSA-N 379.419 5.496 30 20 GKED COc1ccc(CCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 61068882 PNJSOQGYOXVWON-MRXNPFEDSA-N 384.888 5.157 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccccc2c1)c1nc(-c2c(F)cccc2F)cs1 64714896 ZKHQPWCQAMTAFH-INIZCTEOSA-N 390.414 5.732 30 20 GKED O=C(Nc1c(F)cc(F)cc1F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 92057379 ZNDYXTHAMKDXSA-CYBMUJFWSA-N 380.263 5.058 30 20 GKED Cc1cc(C)c(NC(=O)CNc2ccccc2SC[C@@H](C)C#N)c(Cl)c1 108354404 ARLLLHUOCXRDLX-AWEZNQCLSA-N 387.936 5.259 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nc(-c2ccc(Cl)cc2)no1 108355366 SXYQIVCAHCRKFX-CYBMUJFWSA-N 384.892 5.254 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108528814 MUEHMLGHZWEUOY-KRWDZBQOSA-N 392.528 5.254 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1cccnc1SC(F)(F)F 112518817 MRIKBSZZASDHID-UHFFFAOYSA-N 384.276 5.104 30 20 GKED N#CCCCOc1cccc(CNc2ccc3oc(C(F)(F)F)nc3c2)c1 122965507 FBUGOOSUMUREKW-UHFFFAOYSA-N 375.350 5.141 30 20 GKED Cc1noc(C2CC2)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 152885161 DVRXMMSSNXACLE-UHFFFAOYSA-N 393.830 5.430 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2c1 154680951 MQKMWTZIIMFQCQ-QGZVFWFLSA-N 391.496 5.191 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(Br)s1)[C@H](C)c1ccc(C#N)cc1 173773184 FBIMQYAFAYWDNN-CHWSQXEVSA-N 391.334 5.095 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)[C@H](c2ccco2)C1 248556076 KRTKQHFDPJDBTR-NUJGCVRESA-N 383.517 5.679 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3ccccc3OC(F)F)o2)cc1C 254926941 CIJBQGARLUWWCU-CQSZACIVSA-N 387.386 5.067 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)N1CCSC1=Nc1cccc(Cl)c1C 255435081 NFNIQVQCIZQMIG-LLVKDONJSA-N 391.924 5.010 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(Br)c1C 303182637 USPUSHVOLKEHBE-UHFFFAOYSA-N 377.257 5.117 30 20 GKED Cc1cc(C)c(N=C(O)N2CCC[C@H](c3n[nH]c(C4CCCCC4)n3)C2)c(C)c1 329430853 IHPAJWKZVRGUFI-IBGZPJMESA-N 395.551 5.203 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)[C@@H]1C[C@@]12CCOc1ccccc12 329494732 IMOMASRKANIWLX-DCLXLUIPSA-N 391.515 5.073 30 20 GKED COc1ccc2c(c1)[C@H](/N=C(/O)[C@@H]1CC=CCC1)CCN2C(=O)[C@H]1CC=CCC1 329544737 YYTFKEJKXVPGIT-LVCYWYKZSA-N 394.515 5.142 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccncc1 361168878 PAYQCZVQMHOPMD-OAHLLOKOSA-N 389.484 5.034 30 20 GKED N#CC1(CCCN2CCC(c3ccc(Cl)cc3Cl)CC2)CCOCC1 428724913 OCXLFXOIVHIGPV-UHFFFAOYSA-N 381.347 5.273 30 20 GKED CCCCn1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1CC 429111842 GKFMNNYNEFEWBI-KRWDZBQOSA-N 392.528 5.168 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccc3)c2)[C@@H]1c1ccncc1 432685822 IDHCPGWZHXBKAC-HSZRJFAPSA-N 381.479 5.096 30 20 GKED CCCCn1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 435741836 QVIWLSHEJVABJB-INIZCTEOSA-N 398.919 5.259 30 20 GKED Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 438036351 GTNBKPVTQWYZES-GOSISDBHSA-N 395.572 5.831 30 20 GKED C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639744 YDBACPZCPOQCTK-IUODEOHRSA-N 391.368 5.126 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=O)N[C@H](CCC#N)c1ccccc1 438834546 AAFKQEVILCNXQL-GOSISDBHSA-N 376.287 5.180 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)C[C@H]1C 439506118 ZPSQSUFFLGNFKE-QWFCFKBJSA-N 393.556 5.738 30 20 GKED C[C@H]1CCc2c(sc3nc([C@@H](C)Sc4ccccc4C#N)nc(O)c23)C1 439698507 XOCSRHSUTAUIKG-NWDGAFQWSA-N 381.526 5.247 30 20 GKED C=CCc1cc(CN[C@@H](CC(F)(F)F)c2ccccc2C)cc(OC)c1O 444010317 OURLGJBYIKELQX-SFHVURJKSA-N 379.422 5.221 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(Cl)c1 457591577 WTBKRUKRNGCNGE-CQSZACIVSA-N 388.920 5.631 30 20 GKED C[C@@H]1C[C@@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCN1Cc1ccccc1 463255329 KXTOCTMPUWVLHQ-KNQAVFIVSA-N 398.510 5.211 30 20 GKED N#Cc1c(NC(=O)c2ccoc2C(F)(F)F)sc2c1-c1ccccc1CC2 463473263 ZYFDNZAARHAFCF-UHFFFAOYSA-N 388.370 5.249 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2c(F)cc(F)cc2F)cc1 465463335 UVBOMTVXRSKYSE-UHFFFAOYSA-N 382.341 5.329 30 20 GKED CO[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 466172750 DKRALPPYFBVSOX-HLAWJBBLSA-N 397.906 5.075 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)c1c[nH]c2ccccc12 469410666 VMGGSGYXJAUPCA-HZPDHXFCSA-N 377.513 5.552 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccc(C)cc1)c1ccccn1 470133946 OJARNILDKDLUQI-RUZDIDTESA-N 399.538 6.153 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc2cc[nH]c2c1 473549702 VFBDPPYWGOUGRV-UHFFFAOYSA-N 383.476 5.467 30 20 GKED C[C@H]1[C@H](C)C[C@@H](C)CN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 474505358 HBXSVHMPGDXIRL-QRVBRYPASA-N 391.515 5.230 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2Cc2c(F)cccc2Cl)cc1 474968834 IMCNYYRROMMRIP-KRWDZBQOSA-N 384.882 5.128 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(-c2nc(C)co2)c1 476653279 MIULZRQTCLQDHJ-UHFFFAOYSA-N 393.491 5.038 30 20 GKED N#Cc1cscc1C(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1 477209980 XBARHYBDPMBGKM-UHFFFAOYSA-N 379.388 5.014 30 20 GKED N#Cc1cc(NC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)ccc1F 481619674 DSJKDVWVRLSSKT-SFHVURJKSA-N 385.851 5.323 30 20 GKED C=CCN(C(=O)c1cnc2ccccc2c1C)c1nc(-c2ccccc2)cs1 482562073 SEZALYGEXCTHOF-UHFFFAOYSA-N 385.492 5.500 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1oc2ccccc2c1C 484763456 ODSMRRRGRKVEFU-SFHVURJKSA-N 394.519 5.368 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3csc(CCCC)n3)o2)cc1 489768848 AGPFGCDPDMJHKZ-UHFFFAOYSA-N 387.530 5.393 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)NCc3cccc(C#N)c3)cc2)cc1 500229567 GEAGFVWUMWCNIL-UHFFFAOYSA-N 387.439 5.071 30 20 GKED O=C(Cc1ccccc1C(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 509278253 XYJVRVOTKHXZLO-OAHLLOKOSA-N 393.302 5.197 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1cc(C#N)ccc1Cl 511398962 NYONQGSOJOTXKP-LLVKDONJSA-N 399.878 5.274 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccccc1S[C@H](C)CC#N 517517740 IPXFOVCFVLZWBW-IAGOWNOFSA-N 382.529 5.612 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1c(F)cccc1F 517533609 YGUZVBORUIHPDL-KBPBESRZSA-N 389.471 5.584 30 20 GKED C[C@@H](NC(C)(C)CNC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1 517808117 FEASAFPYGCYBFP-LJQANCHMSA-N 397.522 5.084 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)c2)cc1 517841307 KEFJVZBQZAXJDQ-RTBURBONSA-N 388.389 5.658 30 20 GKED N#C[C@@H](C(=O)c1cc(Br)cc2ccccc12)c1nc2ccccc2o1 519347447 BSKUOSYFOQGZOW-INIZCTEOSA-N 391.224 5.234 30 20 GKED CC(C)Cn1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c2ccccc21 520187310 HYKHANGMJULGHG-KRWDZBQOSA-N 391.540 5.944 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1cccc(OCC)c1 521091366 RABYFWMVRKPCRE-AWEZNQCLSA-N 378.925 5.259 30 20 GKED C[C@@H]1CC(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C[C@@H](C)C1 523542968 RDVJQGGCQBLZNV-IRXDYDNUSA-N 378.541 5.405 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@H]21)c1nc2cc(Cl)ccc2s1 528925015 QWKMBTGVFXRQDK-QIZIZJAASA-N 399.302 5.365 30 20 GKED C[C@@H](Nc1ccc(NC(=O)Cc2cccc(C#N)c2)cc1Cl)c1ccccc1 531388697 IHRGSHLOOBBVRV-MRXNPFEDSA-N 389.886 5.566 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CC1CCSCC1 532393034 BYNBGWXWMTVMHH-UHFFFAOYSA-N 382.504 5.072 30 20 GKED C=C(C)COc1cc(CNc2cc(NC(=O)C(C)C)ccc2C)ccc1OC 533212496 XMGOHARLLZAXLE-UHFFFAOYSA-N 382.504 5.165 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)cc1C#N 535093931 HWNDMFWHFITYRC-UHFFFAOYSA-N 391.858 5.313 30 20 GKED C=C(C)[C@@H](CC(=O)N(CCC)[C@H](c1cccnc1)c1ccc(F)c(C)c1)OCC 538554698 CPPYXQBWWFAQPJ-VWNXMTODSA-N 398.522 5.228 30 20 GKED C=CCC[C@H](NC1CCN(CC(F)F)CC1)c1ccc(C(F)(F)F)cc1 543090926 UHPOTQSYAQWHMN-KRWDZBQOSA-N 376.413 5.032 30 20 GKED N#CCCC[C@H](NCc1ccc(Cl)cc1Br)c1ccccc1 552083610 PAXXPALPVKKDPJ-SFHVURJKSA-N 377.713 5.627 30 20 GKED N#Cc1cc(C(=O)N(c2ccsc2)C2CCCCC2)cnc1C(F)(F)F 556801837 BCSHWEQVQHRRCG-UHFFFAOYSA-N 379.407 5.013 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(OCCCC)c1 558316501 OVEBESFOEVAVEB-UHFFFAOYSA-N 384.524 5.253 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4nccc(C)c4c3)n2)cc1 560553258 QQHVJGBKWRIXAR-IBGZPJMESA-N 399.475 5.165 30 20 GKED C[C@H]1CC[C@H](c2ccccc2)N(C(=O)CCCCOc2cccc(C#N)c2)C1 561276201 RRXRIKCDWRUXQR-WMZHIEFXSA-N 376.500 5.107 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3o2)c(Cl)c1 567562584 GVJQCRHLEROMTE-SFHVURJKSA-N 394.862 5.306 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cncc(C(F)(F)F)c3)n2)cc1 570759013 WPCXZDUEHLJXPW-OAHLLOKOSA-N 387.386 5.022 30 20 GKED N#CCc1ccccc1NC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 571837859 VARHERMRSFALCK-UHFFFAOYSA-N 387.386 5.147 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4ccccn4)cc3)cc2)nc1 582034900 YLYMPCXUMQYHOR-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#Cc1ccc(CNc2ccccc2C(=O)Nc2ccc(Cl)cc2)c(F)c1 589350886 YHBHTEMUEQBSQD-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CC=CC2)[C@@H]1c1ccccc1)c1ccccc1 592024896 GLEXHRPVGIZMPJ-GOTSBHOMSA-N 385.511 5.524 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cs1 592973303 CMDFNNXAKTXFKJ-AWEZNQCLSA-N 393.468 5.357 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CC1(C#N)CCCCC1 597180763 UWMWTIRGXMKWRE-UHFFFAOYSA-N 395.450 5.514 30 20 GKED N#Cc1ccc(N(C(=O)c2cc3ccccc3n2CC(F)(F)F)C2CCC2)cc1 598882884 OWPOFGNARGFKRY-UHFFFAOYSA-N 397.400 5.275 30 20 GKED Cc1cc(Br)ccc1[C@H]1CCCN1C(=O)Nc1ccc(CC#N)cc1 599706806 NJMNXLFUGMERAJ-LJQANCHMSA-N 398.304 5.193 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1sc2c(c1C#N)CCCCC2 603946801 AJTQHTRTMGBWHE-UHFFFAOYSA-N 389.318 5.212 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)[C@H]1c1ccccc1 604362118 JTXRQPCFXHEVEE-QFIPXVFZSA-N 398.466 5.361 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCCC2)c1)c1ccc(C(F)(F)F)cn1 606753852 NTETXIFJEDWQGR-SFHVURJKSA-N 388.389 5.302 30 20 GKED Fc1ccccc1-c1cnc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)o1 607727585 XFYUJCJOCFCQKF-PHIMTYICSA-N 396.306 5.043 30 20 GKED C[C@@H](C(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 607822939 RQXITKHGCYBULX-SECBINFHSA-N 379.275 5.606 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1cc2ccccc2n1CC#N 609183525 VPSNRIRFOAOIEE-UHFFFAOYSA-N 383.904 5.571 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2)c1 609429533 JRPBCQUWQCMZAD-UHFFFAOYSA-N 397.478 5.199 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC(C)(C)c1ccccc1 609435367 KDFTWRAWBTYPQD-KRWDZBQOSA-N 381.545 5.570 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N(Cc3ccco3)CC(F)(F)F)c2)cc1 609987978 YJEAYBYSZOGZNN-UHFFFAOYSA-N 399.372 5.100 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609988232 BZSQSOCCLBPJJS-SJKOYZFVSA-N 380.797 5.233 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc(C#N)c1 610325266 UIBFZKGQXAIPBN-INIZCTEOSA-N 382.423 5.105 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cnn1C(CC)CC 682990971 BDLIGNRNECZWAJ-AWEZNQCLSA-N 384.480 5.045 30 20 GKED C#CC[C@H](OC(=O)CSc1cccc2cccc(Cl)c12)c1ccccn1 727776209 VUWGVOBIINXHHV-SFHVURJKSA-N 381.884 5.288 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCc3ccccc3C2)cc1 730378940 AGEFLVDEKWGSAC-DEOSSOPVSA-N 381.479 5.322 30 20 GKED C[C@H](NC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 731320114 TZHPDMXVRJHFFX-AWEZNQCLSA-N 379.510 5.460 30 20 GKED N#C[C@@H](NC(=O)c1ccc2c(c1)-c1ccccc1C2)c1cccc(C(F)(F)F)c1 731646185 ZESRACXLNPITCH-OAQYLSRUSA-N 392.380 5.271 30 20 GKED CCCN(C(=O)/C=C/c1ccccc1C#N)[C@H](c1ccc(F)cc1)c1cccnc1 732085540 LJPMAGPLRPEQOD-IGQYLQMFSA-N 399.469 5.134 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cc2ccccc2o1 733080920 GOXDOSBIXMGENQ-CMDGGOBGSA-N 376.393 5.361 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)c(C)c(Cl)c2)c1 733844336 JFLHXQWZMWGQCH-HNNXBMFYSA-N 392.286 5.305 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C\c1ccnc2ccccc12 735434172 PWSABTNWQJIONE-KHPPLWFESA-N 381.460 5.487 30 20 GKED Cc1c(Cl)cccc1OCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 736003361 ZAUIFSRZTQSJIG-HXUWFJFHSA-N 390.870 5.321 30 20 GKED N#C[C@@H](C(=O)CC/C=C\c1ccccc1)c1nc(-c2c(F)cccc2F)cs1 739159597 HQEKQKMJTQWNQY-SGNXQUTQSA-N 394.446 5.758 30 20 GKED COc1ccc(Br)cc1SCc1cc(Cl)ccc1OCC#N 741477134 ZGPHTCBRYQYTGP-UHFFFAOYSA-N 398.709 5.306 30 20 GKED C[C@@H](ON=Cc1cccc(F)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 744445486 PYLGWGDKISLAPB-LLVKDONJSA-N 379.313 5.006 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1cccc(Cl)c1 745724134 KMNZSENFFANZMN-UHFFFAOYSA-N 377.900 5.615 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3c[nH]c4cc(F)ccc34)cs2)cc1 749454082 VRHAFCJSLNGSQU-WEVVVXLNSA-N 378.428 5.335 30 20 GKED N#Cc1csc(C(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 752588297 UFDANINFKRXHCM-UHFFFAOYSA-N 394.399 5.119 30 20 GKED Cc1nc(/C=C\c2ccccc2C#N)sc1C(=O)/C=C/c1ccccc1C#N 755586179 IISVFICQCJEFTL-FAEGWCMCSA-N 381.460 5.261 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CC[C@]3(CCOC3)C2)c1 757212507 YGKIARRHBDYNMJ-QHCPKHFHSA-N 388.552 5.208 30 20 GKED C=CC[C@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccncc1 766018076 FTQFMWFPNDDCGP-RBUKOAKNSA-N 379.504 5.629 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2cn(C(C)(C)C)nc2C)cc1 768279186 KYJXPNATMIIUNJ-HOTGVXAUSA-N 375.944 5.490 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775487500 IVOXQKNTMKGJCI-RPBOFIJWSA-N 395.506 5.883 30 20 GKED COc1ccc(N[C@@H]2CCCc3cc(C#N)ccc32)cc1OCc1ccncc1 776834540 JINHAJDFEHZTBR-JOCHJYFZSA-N 385.467 5.030 30 20 GKED O=C(/C=C/c1cnn(Cc2ccc(F)cc2)c1)c1cccc(-c2ccncc2)c1 780187524 SAKRUSWHESOULX-RMKNXTFCSA-N 383.426 5.029 30 20 GKED CC(=O)CCCCCCC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782829689 ZZTSKIYQVQTPKG-IBGZPJMESA-N 376.500 5.332 30 20 GKED C#CCC1(C(=O)N2CCC[C@H](c3nc4ccccc4n3C(C)C)C2)CCCCC1 788511654 CZHAMGNSSAHLCS-FQEVSTJZSA-N 391.559 5.297 30 20 GKED Cc1cc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)sc1Br 794732284 HVOKNIZXRWHEJZ-IHWYPQMZSA-N 391.315 5.234 30 20 GKED N#CC[C@H](CC(=O)O[C@H](Cc1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 796672746 AXSIKRGNTZFSLB-SJLPKXTDSA-N 395.808 5.444 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1 796777670 DGDSYRSMHKNLTG-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 802036549 ZVGDERJJURVVTD-RHSMWYFYSA-N 376.481 5.115 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)c1ccc(Cl)cc1F 806308150 MLFRFKQPNQRCLQ-OAHLLOKOSA-N 384.760 5.080 30 20 GKED COc1cc(Cl)c(NCc2cn(CCC#N)nc2-c2ccccc2)cc1C 808450073 XJBWFMKCDXYXML-UHFFFAOYSA-N 380.879 5.046 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3cc(Cl)cc(Cl)c3)C2=O)cc1 814297770 SHRKQZZBLDNVSN-WCSRMQSCSA-N 391.304 5.271 30 20 GKED CCOc1cc(/C=C2\CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1O 818242819 LZNXAXUCZKLRIN-BVXMOGEKSA-N 399.830 5.182 30 20 GKED N#Cc1ccc(N(C(=O)c2ccc(C3SCCS3)cc2)C2CCC2)cc1 857676706 HVSFTTJPJVFCSW-UHFFFAOYSA-N 380.538 5.236 30 20 GKED COc1ccc(-c2nc(CON=Cc3cccc(Cl)c3Cl)co2)cc1 873990831 FILMOXXTAYCNDG-UHFFFAOYSA-N 377.227 5.208 30 20 GKED C=CCc1ccc(OC(=O)Cc2sc(C)nc2-c2cccs2)c(OC)c1 875115785 XEKHSGITCDXCMK-UHFFFAOYSA-N 385.510 5.065 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2nc(-c3ccccc3Cl)cs2)CCC1 899407804 UVNPKHBITBSIOJ-RUZDIDTESA-N 392.977 5.576 30 20 GKED COc1cccc(/C=C/C(=O)c2sccc2Br)c1OC(C)C 915113957 YTBOROWCHUWXEF-BQYQJAHWSA-N 381.291 5.203 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)c3ccc(C#N)cc3)cc2)cc1 916135279 OMSDBIGZFWMZNH-CKOAPEAFSA-N 388.426 5.222 30 20 GKED Cc1cccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916977269 OTCZHDVAXBBFBD-KBXCAEBGSA-N 396.899 5.416 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C)cc2)cc(Br)c1OC(F)F 917143471 FRBLADYYPJSAPR-VMPITWQZSA-N 397.215 5.264 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ccc(Br)cc3)c2c1 1776114379 NYIQDIKHAQYRCK-CLTKARDFSA-N 387.254 5.258 30 20 GKED Cc1ccc(-c2cccc(/C=C(\C(=O)C(=O)O)c3ccc4ccccc4n3)c2)cc1 1776116158 LBPWYEUBGPVHSB-JWGURIENSA-N 393.442 5.405 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776473566 QXBWAUHCUGSAAV-IUYQLWOBSA-N 378.468 5.482 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2cc(C)c(C(=O)O)c(F)c2)cc1 1776786664 UYGYQESEIYJUBT-UHFFFAOYSA-N 385.479 5.988 30 20 GKED Cc1cc2c(s1)C/C(=C\c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777428065 JZHBCCOFOKMGCX-BVZCLVNKSA-N 390.460 5.084 30 20 GKED CC(C)c1ccc(C(=O)/C(=C(/S)N[C@@H]2CCCC[C@@H]2C)[n+]2ccccc2)cc1 27486367 NLJONWMKLUHSLX-GHTZIAJQSA-O 395.592 5.205 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)c1nc2ccccc2o1 54734087 MNIDWFCQCZBPOV-OWCLPIDISA-N 399.475 5.364 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1c1ccccn1 56800465 XFMANLUNXKXPDG-QHCPKHFHSA-N 398.466 5.423 30 20 GKED C=C(C)CN(CC)C(=O)c1cc(-c2ccc(C)s2)nc2c1cnn2C(C)C 58551991 SGOKGMVKJWWETE-UHFFFAOYSA-N 382.533 5.087 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC)[C@H](C)c1cc2ccccc2o1 64720068 GIKMPNZYGIPJLJ-OAHLLOKOSA-N 377.444 5.318 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1 64742555 KNNMWDQGSQMRQA-HXUWFJFHSA-N 377.488 5.233 30 20 GKED CCN(C(=O)CCCC(=O)c1c(C)cc(C)cc1C)[C@H](C)c1ccc(C#N)cc1 65839892 DHWYVKVTYFNPIZ-HXUWFJFHSA-N 390.527 5.446 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66801578 GLBBDHPMBWQKJY-AWEZNQCLSA-N 377.469 5.297 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccco1 66954673 RLEUQZVKCCIMLM-IERDGZPVSA-N 391.496 5.585 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H](C)c1ccc(F)cc1 72098921 OMWZDMMLKSVRDV-AWEZNQCLSA-N 387.455 5.175 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H](C)c1ccc(F)cc1 72098922 OMWZDMMLKSVRDV-CQSZACIVSA-N 387.455 5.175 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)c1occc1COc1cccc(C#N)c1 126694262 WKJGYEAAEHNZKV-UHFFFAOYSA-N 396.830 5.035 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(-c4ccoc4)c3)n2)cc1 127964828 RKWSNVLFWXVUNG-FQEVSTJZSA-N 395.443 5.432 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(-c3cccnc3)nc3ccccc23)n1 131174625 GOZXOQNUPOEDFV-GOSISDBHSA-N 398.491 5.367 30 20 GKED CCN(C(=O)CNc1ccccc1SC[C@H](C)C#N)[C@@H](C)c1ccc(F)cc1 153930745 YNFWELNSTHUMRX-SJORKVTESA-N 399.535 5.099 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCCCO[C@H]2CCC[C@@H](C)C2)n1 156452817 BAHOOMQIBXCTRS-FGTMMUONSA-N 376.566 5.598 30 20 GKED C[C@H]1CCN(C(=O)CNc2ccccc2SCCC#N)c2ccccc2S1 170982959 XDYPWMCTGRFBLP-INIZCTEOSA-N 397.569 5.022 30 20 GKED C[C@H](NCc1ccccc1C#N)c1nc(-c2ccc(Br)cc2)cs1 179095795 AMKNWPSVVAWNNA-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1nc2ccccc2s1 189897926 YYWXCBCQFIXHJQ-UHFFFAOYSA-N 378.541 6.110 30 20 GKED CC(C)C(=O)Nc1ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1 236846940 FQKAOVPACLXGNW-UHFFFAOYSA-N 399.494 5.344 30 20 GKED CN(CCC#N)c1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCC2)cc1 237201935 LLBYTQLQYILCIR-UHFFFAOYSA-N 387.449 5.224 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)cc1 303218013 QZNYQBPSAVNZPY-HVRVZBDQSA-N 383.447 5.453 30 20 GKED C[C@H](/N=C(/O)C1CCCCC1)C(O)=Nc1cccc2c1CN(CC(F)(F)F)C2 328641456 DHAXHXMCZSWZGC-ZDUSSCGKSA-N 397.441 5.078 30 20 GKED O/C(=N/[C@H]1CCCc2nc(O)ccc21)C1(Cc2cccc(Cl)c2)CCCC1 329687430 FXSAPRJBXWFOQL-IBGZPJMESA-N 384.907 5.578 30 20 GKED Cc1ccc(N=C(O)[C@@H]2CCC(F)(F)C2)cc1N=C(O)CN1CCCCC1 330039883 BYJJABUZELQUJR-OAHLLOKOSA-N 379.451 5.092 30 20 GKED C[C@H](C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 409746282 AANMMLGSMALIKW-RYGJVYDSSA-N 386.417 5.107 30 20 GKED COc1ccc(Cl)cc1C1(c2noc(C[C@@H](CC#N)c3ccccc3)n2)CC1 420513427 JYMTVXHNYWXMHS-MRXNPFEDSA-N 393.874 5.051 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 432771719 YQAGJBCUKJXTPJ-UHFFFAOYSA-N 382.851 5.017 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1ccc(OCc2ccc(F)cc2)cc1 436115046 MRJRJEUKVKPCLH-HHHXNRCGSA-N 387.520 5.373 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@H](COCC)C1)c1ccc(C(F)(F)F)cc1 441532845 LNRZRTDSSDJINQ-QFBILLFUSA-N 398.469 5.171 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(C)(C)O[C@@]2(C[C@@H]3CC[C@H]2C3)C1 441782953 BVJMEKDONVQHPR-AOUJKTHWSA-N 396.575 5.740 30 20 GKED C[C@H](SCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1cccc(C#N)c1 443163040 WYBDKHHDAFZNAG-HNNXBMFYSA-N 394.496 5.033 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2SCCc3ccccc32)cc1 463144704 LMXFMTHEVIKNMV-JOCHJYFZSA-N 386.476 5.320 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1cc(C(F)(F)F)ccn1 464476385 PIABPGNNAANVQV-CQSZACIVSA-N 390.361 5.458 30 20 GKED CO[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(C)(C)C 467610405 JNKGBPMVQUFCOG-ICSRJNTNSA-N 399.922 5.178 30 20 GKED CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 469689673 HUFPFKKUUISIBZ-UYAOXDASSA-N 395.572 5.956 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(CSc3ccccc3)cc2)n1 474436050 NOHSLEKKXZAYLE-LJQANCHMSA-N 392.549 6.049 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(N2CCCCC2)nc1 475549954 RRUGJFBMFLVESD-UHFFFAOYSA-N 392.547 5.246 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(OCc2ccccc2)cc1 476893886 TXRLONQILUVFTQ-UHFFFAOYSA-N 384.479 5.343 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21 478564716 ANWUITFLZUGPGL-YFNKSVMNSA-N 395.462 5.119 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)cc1F 479454565 QAVOIDLXWDHKPM-OAQYLSRUSA-N 395.275 5.339 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(NC(=O)NC(C)C)cc1)c1ccc(F)c(F)c1 480696851 XYMIGLLCZAWLQL-QVKFZJNVSA-N 387.474 5.463 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483232855 HWOIOQNQJAZJLN-SFHVURJKSA-N 391.452 5.135 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)CSc2ccc(C#N)cc2)c1C 483374813 LSIZHCPLQDKEQE-UHFFFAOYSA-N 389.480 5.093 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1F 483990096 CFIUXGGKQAAKQR-MRXNPFEDSA-N 390.302 5.499 30 20 GKED Cc1ccccc1-n1ncc(C(=O)Nc2sc(C)c(C)c2C#N)c1C(C)C 485626704 CCYJKLKKJNIXBT-UHFFFAOYSA-N 378.501 5.106 30 20 GKED Cc1cccc(-c2nc3cc(F)ccc3n2C(C)C)c1NC(=O)CC(C)(C)C#N 485895073 COPYQKAQPVYQKE-UHFFFAOYSA-N 392.478 5.610 30 20 GKED N#CCCC[C@@H](NC(=O)CCC(=O)c1ccc2c(c1)CCCC2)c1ccccc1 487190700 YNAQNAKIAWZLDN-HSZRJFAPSA-N 388.511 5.080 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 488348114 BVDDZZTWUGHBSJ-IBGZPJMESA-N 378.476 5.211 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3cc(F)ccc3[nH]2)cc1 490631977 TYGHWRAOJBVIDN-UHFFFAOYSA-N 399.425 5.204 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2cccnc2)cc1)c1ccc(Cl)c(Cl)c1 505934226 VYYIOLXYOFRPKS-LJQANCHMSA-N 398.249 5.175 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc(C#N)ccc1Cl 506343521 ZAOVSNNTUCQPGW-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#C[C@H](NC(=O)c1ccccc1Oc1ccncc1)c1cccc(Cl)c1Cl 509287122 NFHCZWSMXDUAQT-KRWDZBQOSA-N 398.249 5.175 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1cccc(OCc2ccccc2C#N)c1)C1CC1 509846023 KCLNRRKPUWWGSO-QGZVFWFLSA-N 386.451 5.096 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)c1cccc(C#N)c1C 509935216 SKLMBPDLASACDC-UHFFFAOYSA-N 398.441 5.120 30 20 GKED C=CCC[C@@H](NC(=O)Cc1nc(CC)cs1)c1ccc(C(F)(F)F)cc1 513810572 DBOBKDZENKDKPH-MRXNPFEDSA-N 382.451 5.091 30 20 GKED CCn1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc2ccccc21 517800896 NSLXQXBBEBJYRN-GOSISDBHSA-N 396.475 5.146 30 20 GKED C=C(C)COc1cc(CN[C@H]2CCSc3ccc(Cl)cc32)ccc1OC 518277929 DITRNQNROIBLJC-SFHVURJKSA-N 389.948 5.630 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccc2ccccc2c1 518652831 GADNHXNPUHPPCE-MRXNPFEDSA-N 392.549 5.822 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)c(C(F)(F)F)c1 520924175 MEQOGDADGJGIDM-LLVKDONJSA-N 382.382 5.491 30 20 GKED C=CCCCN(C)C(=O)c1cccc(Sc2cccc(Br)c2)n1 525503034 JNQQBMKQLMZSNF-UHFFFAOYSA-N 391.334 5.034 30 20 GKED CCOc1ccccc1N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 535127945 BUHZGVDHSVLBTB-UHFFFAOYSA-N 390.414 5.165 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCCC(F)(F)F 537740840 YQGNXOMMPRWAFN-UHFFFAOYSA-N 376.378 5.117 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1coc(-c2ccccc2Cl)n1 538441028 YFFFAGVGEMXLKS-ZDUSSCGKSA-N 397.887 5.499 30 20 GKED Cc1nc(C)c([C@H](C)N(C)Cc2cccc(OCc3cccc(C#N)c3)c2)s1 539836081 VRLUVSRLNGQTCG-KRWDZBQOSA-N 391.540 5.404 30 20 GKED N#Cc1ccc(CN(C(=O)c2csc(-c3cccc(Cl)c3)n2)C2CC2)cc1 541367174 IEGQERQCYKXDEB-UHFFFAOYSA-N 393.899 5.140 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CC1CCC(C(F)(F)F)CC1 543058164 PVSWYZMCBCNVQZ-UHFFFAOYSA-N 380.454 5.302 30 20 GKED Cc1c(Cl)cnc(N2CCC[C@@H]2c2nc3ccccc3n2C(C)C)c1C#N 543133763 IGVRFTZEQSHAEQ-LJQANCHMSA-N 379.895 5.187 30 20 GKED N#CCC1CCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)CC1 543827526 PPFLPLKCHSQMMF-UHFFFAOYSA-N 391.846 5.152 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c(C)c1 543862124 QLNRDMJKCFUMKD-AWEZNQCLSA-N 392.446 5.622 30 20 GKED Cc1c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)ccn1C(C)C 550249547 UGYRHJCRECMBHO-UHFFFAOYSA-N 391.446 5.220 30 20 GKED Cc1cc(CNC2(c3nc(-c4ccccc4F)c(C)s3)CCC2)ccc1C#N 555645919 DJLDVOLZTHLDDK-UHFFFAOYSA-N 391.515 5.607 30 20 GKED C=CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 557397546 JJGMHBLPIYWFIE-WUKNDPDISA-N 399.519 5.325 30 20 GKED N#CCCC[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccccc1 563693291 NDPWWVWOBQHOFA-AREMUKBSSA-N 395.506 5.662 30 20 GKED Cc1csc(NC(=O)N2CCC[C@@H]2c2ccc(Br)s2)c1C#N 565606067 DXEQKHVTXIATNN-LLVKDONJSA-N 396.335 5.121 30 20 GKED CC(C)N1CC[C@H](NCCCCC(C)(C)C#N)[C@H]1c1ccc(Cl)c(F)c1 578859360 VPHWOOYMQDILQS-VQTJNVASSA-N 379.951 5.313 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)Nc2cccc(C#N)c2)cs1 583469420 LVFNMHOGSCXINV-UHFFFAOYSA-N 379.460 5.046 30 20 GKED C[C@H]1[C@H](C)CCC[C@H]1N(Cc1ccc2c(c1)OCO2)C(=O)CCCCCC#N 588901225 XRZJOVUOXXTQQH-WSTZPKSXSA-N 384.520 5.043 30 20 GKED C=CCOCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 591123043 XYDCAYRHZXOGBT-MAUKXSAKSA-N 394.902 5.059 30 20 GKED C=CCN(C(=O)CCCCC#N)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 593952580 GPAWAMXCSOTSNI-UHFFFAOYSA-N 394.327 5.720 30 20 GKED C[C@H](SCc1ccccc1)C(=O)N(Cc1ccco1)c1ccccc1C#N 603755081 OOZIIWNWLZBKMU-KRWDZBQOSA-N 376.481 5.006 30 20 GKED Cc1noc(C(C)C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603758947 PXSVBXLCYPNDSU-GOSISDBHSA-N 393.874 5.668 30 20 GKED Cc1nc(C)c(C#N)c(S[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)n1 603910391 BHSHUZHNBKFXPB-HNNXBMFYSA-N 388.496 5.071 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CSc1ccc(C#N)cc1 603917077 RUZVFUMKRPPCOL-LBPRGKRZSA-N 379.312 5.177 30 20 GKED Cc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 604026575 BPRGRPQGMWWGDC-UHFFFAOYSA-N 383.860 5.330 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc2cccc(Cl)c2c1Cl 604359459 AWKRLVWWWIIKLW-UHFFFAOYSA-N 391.279 5.731 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C2(c3ccccc3C)CC2)cc1 608872349 MVBMAEOLBXIUMN-UHFFFAOYSA-N 398.462 5.338 30 20 GKED COc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c(Cl)c1 609372377 XXMCRJJBGRVQSI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)C(C1CC1)C1CC1 609724235 FFIZBVRXJVJCHI-UHFFFAOYSA-N 380.875 5.265 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)Nc3cccc(C#N)c3)s2)cc1 610089025 ACDUWIQVUCCTCE-INIZCTEOSA-N 390.512 5.524 30 20 GKED Cc1sc(NC(=O)c2cc(NC(=O)CC(C)C)ccc2Cl)c(C#N)c1C 610168001 JKDVEYJHSVXHSE-UHFFFAOYSA-N 389.908 5.127 30 20 GKED N#Cc1cccc(C2(NC(=O)c3sc(-c4ccccc4)nc3C(F)F)CC2)c1 611186824 ZZVGXRWQIRLRSD-UHFFFAOYSA-N 395.434 5.038 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 611300723 WPWKZLTXZOEFJY-HNNXBMFYSA-N 391.858 5.198 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2)oc1C 618192286 ASPCPKCQTQPHAQ-UHFFFAOYSA-N 398.466 5.469 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNCc1ccc(C#N)c(Cl)c1 619748626 KGHROPSWKCCLGY-UHFFFAOYSA-N 399.325 5.017 30 20 GKED O=C(NC1CCC(F)(F)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 622470090 GPMXRUCICIPIGX-UHFFFAOYSA-N 375.259 5.032 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c(C(F)(F)F)c1 678298857 ZCJKOIQMBSJKFL-PHIMTYICSA-N 383.229 5.017 30 20 GKED COc1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)[C@H](C)C2CC2)cc1 726477868 YYIIEHDGRQZCGP-CQSZACIVSA-N 399.947 5.218 30 20 GKED C=C(Br)CNC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 728127282 YDBMNMNPXSMFFD-OAHLLOKOSA-N 389.293 5.165 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1 728698416 JXUDEQSFUFXCLQ-GQPJMJRUSA-N 387.410 5.805 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)sc2ccc(F)cc12 730417726 QHQMQHXWUCNFNH-ZDUSSCGKSA-N 384.432 5.588 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730421459 KNPMFGPMEGMTQG-BEFAXECRSA-N 384.501 5.429 30 20 GKED CN(CCc1ccccc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731753000 STRGPVQFTVEIBB-JOCHJYFZSA-N 387.458 5.188 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)Nc3ccc(C#N)cn3)c2cc1C 731989285 UCJKUSFGTMUAEP-UHFFFAOYSA-N 378.435 5.038 30 20 GKED N#CCOc1ccc(CC(=O)O[C@@H](CCc2ccccc2)c2ccccc2)cc1 732499700 TVZGEBCCHIISET-DEOSSOPVSA-N 385.463 5.049 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 733633923 LEHFEWCOFLRIQO-CQSZACIVSA-N 398.488 5.293 30 20 GKED CCOc1ccc(N(C)C(=O)c2ccccc2Sc2ccccc2C#N)cc1 739626374 FACZBISROBLCAK-UHFFFAOYSA-N 388.492 5.385 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3cccc(-c4ccncc4)c3)cs2)c1 741473846 SKCGNNSIUJNFRF-CMDGGOBGSA-N 398.487 5.777 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 743004231 HQVGNGBLVPCVJB-AZUAARDMSA-N 383.948 5.485 30 20 GKED O=C(/C=C\c1cnc(-c2ccc(Br)cc2)s1)c1cncc(F)c1 751536556 VSRGLOJNSKNTHC-WAYWQWQTSA-N 389.249 5.003 30 20 GKED C=C(C)[C@H](CC(=O)O[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)OCC 756472258 VDHHLRBORJFRKG-ABAIWWIYSA-N 399.274 5.019 30 20 GKED C=CC[C@H](N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccncc1 766023640 VXZWOUBZUGKBRQ-CYFREDJKSA-N 398.510 5.276 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(COCCc3ccccc3)c2)cc1 770502609 AHEHLHHJUXSJDW-HXUWFJFHSA-N 386.495 5.349 30 20 GKED C=CCc1cc(CN[C@@H](C)c2sccc2Br)cc(OC)c1OC 772944895 DCUHKSWGARMKCA-LBPRGKRZSA-N 396.350 5.107 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3cc(C(C)(C)C)sc3C#N)cc2c1 774161570 DHGXWWDDAGMXQO-UHFFFAOYSA-N 379.485 5.035 30 20 GKED COc1ccc(CNc2ccc(OC(C)C)cc2Cl)cc1OCCCC#N 780583268 PTTSJZSEKRVJRL-UHFFFAOYSA-N 388.895 5.430 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)c(Cl)c2)CCC1)c1nccc2ccccc12 792101567 OETZRHOYFHIOSV-QGZVFWFLSA-N 395.289 5.840 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC(=O)c4ccccc43)n2)cc1 793125720 PPRMOCVZYSRRME-RTBURBONSA-N 386.476 5.055 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1 793892362 SNFLWAINXWMIGT-NHCUHLMSSA-N 396.535 5.102 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2sccc2-c2ccc(F)cc2)s1 797567948 DEDPWEYAUWQSMU-HNNXBMFYSA-N 384.501 5.798 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(C)c(C)o2)cs1 799897982 URCXJJNAMZDUPA-JXMROGBWSA-N 380.469 5.242 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(-c3ccccc3C(F)(F)F)on2)cc1 813428560 ZXJPUQUGHVWQTJ-UHFFFAOYSA-N 399.372 5.229 30 20 GKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1O 815636413 UUYPFKYVGCHVRN-RTBURBONSA-N 387.321 5.631 30 20 GKED N#CC[C@@H](CC(=O)OCC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 816477400 YEAAKBXNTFITRL-OALUTQOASA-N 375.390 5.353 30 20 GKED CC1(C)C[C@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c2ccccc2O1 842291764 NUMKVGCZLVJGHD-ROUUACIJSA-N 388.492 5.331 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)cc2C(F)(F)F)c1 858379083 VLUJDJVQFZTWAP-CZUORRHYSA-N 380.385 5.376 30 20 GKED COCc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)oc2ccccc12 915087508 UOFGYUPNZSAKKM-OAQYLSRUSA-N 396.446 5.487 30 20 GKED Cc1cccc(C)c1OCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915179205 BFBJXCLLVXSHNR-QHCPKHFHSA-N 384.479 5.367 30 20 GKED COc1cccc2cc(C(=O)/C=C/c3ccccc3OCc3cccnc3)oc12 915984664 BBWTZZXHGDICID-VAWYXSNFSA-N 385.419 5.312 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cc(OC)c1O 916141886 XGDPOJGIOFNAPA-JYRVWZFOSA-N 376.408 5.098 30 20 GKED N#CC1(c2ccccc2)CCC(=NNc2nc(Cl)c(Cl)cc2Cl)CC1 916588546 YXQBQDKFHUSRDM-UHFFFAOYSA-N 393.705 5.845 30 20 GKED Cc1csc(SCc2ccccc2C(=O)Nc2ccc(C#N)c(Cl)c2)n1 929083291 AXEHCCUSWYWACY-UHFFFAOYSA-N 399.928 5.521 30 20 GKED C=CCc1cc(C)c(OCCCN2CC[C@@H]3C[C@H](CC(=O)O)CC[C@@H]3C2)cc1C 1776186204 PKZYIWGYAJGCKA-YMPZKCBVSA-N 399.575 5.014 30 20 GKED C[C@@H]1/C(=C\c2ccc(C(=O)O)cc2Cl)C(=O)c2cccc(Br)c21 1776586508 ALWHINMIVUDBLH-MRACZJACSA-N 391.648 5.184 30 20 GKED Cc1ccccc1-n1nccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777464895 SULFFOFMTKLSJD-ZHACJKMWSA-N 398.418 5.035 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)cc1 1777472295 JYUZXJZOJSBMHW-NTUHNPAUSA-N 390.410 5.307 30 20 GKED C[C@H](Sc1c(Cl)cccc1Cl)C(=O)N(CCC#N)c1ccccc1 14789290 FBOOUTXNOKEGQW-ZDUSSCGKSA-N 379.312 5.421 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2nc3ccccc3s2)o1)c1nc2ccccc2o1 41546744 KHANDRRLJSSQCC-GFCCVEGCSA-N 385.404 5.188 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c1 51412274 FEBDAZBXJXVNNG-UHFFFAOYSA-N 375.859 5.270 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccccc1 66953992 PNDIEFCFLJPKSD-MJGOQNOKSA-N 379.529 5.320 30 20 GKED COc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 66955054 UTNYZLHPHXZKIM-SJLPKXTDSA-N 395.528 5.111 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 108528360 CJYCBVAMIWLUJD-AZUAARDMSA-N 393.556 5.740 30 20 GKED CSc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)o1 112244424 AYKPKEGFVJALHI-UHFFFAOYSA-N 378.453 5.013 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1cccs1 120187645 GNGHVSXGXBJVMJ-NSHDSACASA-N 384.448 5.515 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccccc3SC[C@H](C)C#N)c[nH]c12 155019016 GVNNAKXHXZPSGC-OAHLLOKOSA-N 377.513 5.299 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2ccc(CC#N)cc2)C1 157093469 DHOIDAIKKRRSMK-AUUYWEPGSA-N 387.405 5.386 30 20 GKED CSc1ccc(O[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 158773291 MNKGGJVZGLDRJZ-KDOFPFPSSA-N 394.521 5.176 30 20 GKED CC[C@H](CC#N)NC(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 162613352 LSLKBHLIBSKHAT-OAHLLOKOSA-N 382.464 5.225 30 20 GKED CC(C)(C)N(Cc1cccc(F)c1)C(=O)CNc1ccccc1SCCC#N 172905509 OYOSLBUJGITTAH-UHFFFAOYSA-N 399.535 5.071 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccccc3)o2)cc1 176293024 FZBGCJWRNUZGDK-UHFFFAOYSA-N 376.412 5.031 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)NCCCCC#N 178641814 XJQGYUNDVVBYGQ-GFCCVEGCSA-N 378.339 5.226 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(OCC)c(OC)c1 191456705 YTLOBOCURFEHKP-UHFFFAOYSA-N 382.504 5.268 30 20 GKED N#CCCCCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 195573024 WXTRQHQAYUQDFC-UHFFFAOYSA-N 382.920 5.433 30 20 GKED CC(C)(CCC#N)CNCc1ccccc1-c1ccc(CN2CCCC2)cc1 236818749 UIWSKDCTGGUSBS-UHFFFAOYSA-N 375.560 5.369 30 20 GKED CCN(CC)c1ccc(C=Nc2cccc(C[S@@](=O)C(C)(C)C)c2)c(O)c1 254953293 MIGMCSVAAYQEDR-HHHXNRCGSA-N 386.561 5.036 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1[nH]c2ccccc2c1Cl 329336610 LWGUHLFFSBAMRR-KRWDZBQOSA-N 382.895 5.515 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c21 411010959 LIFHXCMIAYUSKE-ZJUUUORDSA-N 389.864 5.119 30 20 GKED Cc1nnc(SCCC(C#N)(c2ccccc2)c2ccccc2)n1C(C)C 434650637 PEQOLDLOMSXYKD-UHFFFAOYSA-N 376.529 5.160 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(F)(F)F)c(F)c1 439118807 OSTRGXBOYKFXPZ-NSHDSACASA-N 382.382 5.491 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1nc(C(C)(C)C)no1 439664535 VIGYJAXFQBMAAX-CYBMUJFWSA-N 380.423 5.343 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)C1CC(F)(F)C1 440542064 ZDCYNPSMUBJXLM-UHFFFAOYSA-N 393.299 5.344 30 20 GKED C=C(C)Cn1c(SCc2nc(C3(CC)CCCC3)no2)nnc1-c1ccco1 445801760 IEOUXEMWWUFUQT-UHFFFAOYSA-N 399.520 5.011 30 20 GKED N#Cc1cc(F)ccc1NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 448362880 AHJPCZCETLAULT-UHFFFAOYSA-N 389.883 5.139 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3ccc(-c4ccc(Cl)s4)cn3)CC2)c1 448512256 YTTFZYMWDUFYMG-UHFFFAOYSA-N 379.872 5.005 30 20 GKED N#CC1CCN(c2nc(-c3ccccc3C(F)(F)F)nc3ccccc23)CC1 450290394 QTTUEHBYGBKZJK-UHFFFAOYSA-N 382.389 5.056 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 451504218 FNUFIXMQPGXUKG-NHYWBVRUSA-N 385.323 5.081 30 20 GKED C[C@H]1CC[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2sccc21 453208097 BARGIMNLGVKPGS-HNAYVOBHSA-N 379.529 5.382 30 20 GKED CC(C)CC(=O)Nc1ccc(NC(=O)Nc2ccc(CC#N)cc2Cl)cc1 455703780 MVPQYPKZFBRFQO-UHFFFAOYSA-N 384.867 5.035 30 20 GKED N#CCCC[C@H](NC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21)c1ccccc1 458798373 HYXDOGGPPCUWJX-BJKOFHAPSA-N 387.527 5.673 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)c1 466302355 FNGLONMGQLSGSW-UHFFFAOYSA-N 391.858 5.337 30 20 GKED CC(C)CCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 467341825 GKSLOJZXUPSVLQ-UHFFFAOYSA-N 379.504 5.426 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 472683012 LOCOVTNJUJZYHS-SFHVURJKSA-N 385.467 5.328 30 20 GKED COc1ccc([C@@H](NC(=O)C[C@@H](CC#N)c2ccccc2)c2ccc(C)cc2)cc1 475172396 HWBNRKVJOSSTEC-BVAGGSTKSA-N 398.506 5.297 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)[C@H]1CCOC1 475575769 SNDBSJGIOWONHI-RBBKRZOGSA-N 378.516 5.438 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(=O)N(c2ccccc2CC)C1 476121438 NJYOHLLJSHUXDN-FQEVSTJZSA-N 390.527 5.093 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 477745466 VNACRVFXXOOYQK-BLVKFPJESA-N 380.385 5.263 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1c1ccccc1 480803094 HLHAYTYANUMCIX-HXOBKFHXSA-N 383.451 5.575 30 20 GKED COc1ccc(Oc2cc(CN[C@@H]3CCCCc4cc(C#N)ccc43)ccn2)cc1 481913309 FGJBQJPGJXJRCT-XMMPIXPASA-N 399.494 5.311 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1cccc(C)c1)C(F)(F)F 482029206 BTXGNVRXRLSYRZ-LJQANCHMSA-N 389.421 5.092 30 20 GKED N#C[C@@H](C(=O)c1cccc(F)c1Sc1ccccc1)c1cnc2ccccc2n1 483235484 WZBVPMGSLOXDQF-QGZVFWFLSA-N 399.450 5.410 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)CSc2ccc(C#N)cc2)c1C 488874026 UIXMLJBMZVAVRD-UHFFFAOYSA-N 382.529 5.303 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@H](C)c1cccc2ccccc12 492662804 YEFHSNAOKPGXGL-QZTJIDSGSA-N 378.541 5.155 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)c2ccc(C#N)cc2)n1 499253723 RVBXVWNFKQLYAL-UHFFFAOYSA-N 385.901 5.380 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1 500404956 QORUMJXJKIHRGL-OAHLLOKOSA-N 392.952 5.648 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3csc(-c4ccccc4)n3)n2)c1 501113603 BITWDHIGEFCQAN-UHFFFAOYSA-N 388.477 5.058 30 20 GKED Cc1sc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c(C#N)c1C 506725390 HIPVRKZTKOWRNX-UHFFFAOYSA-N 399.475 5.811 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCCC(F)(F)F)c1 508257966 CSOMAAZHHWGANQ-UHFFFAOYSA-N 382.769 5.076 30 20 GKED C=C(C)CCc1noc(CSc2nnc(-c3ccc4ccccc4c3)o2)n1 508685116 FOQDROLHXPFEDV-UHFFFAOYSA-N 378.457 5.074 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cc1 513143005 KEAJBJJLLFSJJS-QGZVFWFLSA-N 376.378 5.015 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCc1ccccc1)c1ccc(C(F)(F)F)cn1 513157074 YCZHVTSIUMWAFA-HXUWFJFHSA-N 394.396 5.376 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(COc2ccccc2)cc1 513200824 BZDULPPVKDSHRV-UHFFFAOYSA-N 384.479 5.190 30 20 GKED CC[C@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 513657133 BWSQMHPPGSSBAI-OALUTQOASA-N 378.472 5.193 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)n1 513695402 DNCYMICAJYIEFR-SFHVURJKSA-N 398.940 5.887 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1C(C)C 517455430 IDKNCYUZXZVDSM-AEFFLSMTSA-N 396.556 5.776 30 20 GKED C[C@@H](c1c(F)cccc1F)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 517533612 YGUZVBORUIHPDL-KGLIPLIRSA-N 389.471 5.584 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(-c4ccccc4)nc3)cc2)cc1 520034649 SLLVEJWQVKVGRD-UHFFFAOYSA-N 392.418 5.060 30 20 GKED CC(=O)Nc1cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)ccc1C 520321844 LCOJVQIKSAWNRI-UHFFFAOYSA-N 399.450 5.064 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 520855393 LJRGZTDVXQVHON-MRXNPFEDSA-N 385.508 5.520 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 520877418 ABFJEVKEWWXQNA-PKTZIBPZSA-N 386.451 5.066 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(Cc2ccsc2)c2ccccc2)c1 521095537 DMNQYNIOGNNTFH-UHFFFAOYSA-N 390.508 5.402 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1 522070842 MLNIIQUNOYSXBA-XMMPIXPASA-N 381.479 5.159 30 20 GKED Cc1sc2nc(SCCC(C)(C)C#N)n(C3CCCC3)c(=O)c2c1C 524988550 PLYYDSXIZMBVFV-UHFFFAOYSA-N 375.563 5.222 30 20 GKED CSc1cc(Br)ccc1CNc1cccc(OCCCC#N)c1 531531927 DAPOGWBMQUXQSK-UHFFFAOYSA-N 391.334 5.466 30 20 GKED Cc1cc([C@@H](NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)C2CC2)ccc1F 534703147 YKDRLFZUHZDTES-QFIPXVFZSA-N 379.479 5.077 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)s2)c2cc(F)ccc2F)c1 537327058 HDVHSBMMNJISFW-FQEVSTJZSA-N 386.492 5.499 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](N[C@H](C)c2cccc(C#N)c2)CCC3)cc1 539495149 FSVZRJYAYIQCFF-QRWLVFNGSA-N 389.524 5.419 30 20 GKED C=CCCOCCCCC(=O)N1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1 539518910 OPSOKKUGYRIZFY-QHCPKHFHSA-N 397.946 5.729 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](CCC#N)c1ccccc1 540146776 LPUFVBOPEZQLSR-MGPUTAFESA-N 395.959 6.468 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 543820669 CZRAMMUHHDEJNF-VGSWGCGISA-N 395.572 5.686 30 20 GKED COc1ccc2cc(-c3nn(-c4ccccc4)cc3CNCCCC#N)ccc2c1 544179688 YKTDXUMECLXDKF-UHFFFAOYSA-N 396.494 5.094 30 20 GKED CSCc1ccccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 544709073 VMCUJDLXQSVFLE-UHFFFAOYSA-N 388.492 5.253 30 20 GKED CCN(Cc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1)C(C)C 558195897 JCEMIGVTLWSCLV-SFHVURJKSA-N 383.561 5.161 30 20 GKED N#CCc1cccc2c1CCN(C(=O)Nc1cc(C(F)(F)F)ccc1Cl)C2 599691089 AGULQDHBQQSORT-UHFFFAOYSA-N 393.796 5.015 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@H]21 599737590 MKZRPCLQHFAHFG-OXUBRWNRSA-N 397.931 5.194 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)Nc1sc(C)c(C)c1C#N 603445544 QLFZZGJHJQPOBE-UHFFFAOYSA-N 398.919 5.004 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CC(c1ccccc1)c1ccccc1 603525398 CFGBMZQNHQOQSP-UHFFFAOYSA-N 382.507 5.517 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1cc2ccccc2o1 603739125 SEHXOXVKZZOVPN-UHFFFAOYSA-N 397.434 5.372 30 20 GKED Cc1ccc2oc(C(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)cc2c1 604174588 KRWTWVIJQRDLKE-UHFFFAOYSA-N 382.419 5.444 30 20 GKED C[C@@H](NC(=O)NCc1ccccc1-c1ccc(Cl)cc1)c1ccc(C#N)cc1 608860886 NEYBRZUBQIAPAV-MRXNPFEDSA-N 389.886 5.439 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1ccc(F)cc1 609371381 IRUSJSSJEOCPFP-HUUCEWRRSA-N 388.533 5.653 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(c1ccccc1)c1ccccc1 609377263 RNCMANJRNOUXOB-SFHVURJKSA-N 386.520 5.709 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCCC1 609399152 BEXZHRIEUYYASX-VGSWGCGISA-N 393.556 5.991 30 20 GKED CC(C)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CCCCC1 609647893 YCJNSFJBXMLJPP-UHFFFAOYSA-N 376.500 5.321 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CC[C@H](c3ccco3)C2)c1 609732255 KOASJEZZBLZTMO-INIZCTEOSA-N 392.842 5.227 30 20 GKED CC(C)(NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 609744749 YZACIMAOJXGXQF-UHFFFAOYSA-N 377.469 5.469 30 20 GKED CC(C)n1ncc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc21 609763740 KJBYDQHMDQXOAE-UHFFFAOYSA-N 380.451 5.408 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 609809553 UKSKAAPCQWPESV-UHFFFAOYSA-N 390.487 5.439 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cc(C(C)(C)C)on1 610223419 DZOQKWYYIZRMPQ-UHFFFAOYSA-N 391.446 5.138 30 20 GKED COc1cccc([C@@H](CNc2ccc(C#N)cc2)c2c[nH]c3ccccc23)c1OC 619510907 KMYZOOHDLXHYFH-JOCHJYFZSA-N 397.478 5.301 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=O)NCc1ccc(C#N)c(Cl)c1 619807010 YYQAMQPJGXZDIN-UHFFFAOYSA-N 394.837 5.043 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCC[C@H]1c1cccs1 642480469 WSVZZDLSLHHHKR-IBGZPJMESA-N 378.522 5.578 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc2cc(F)ccc2s1 670118784 SURBOEHAQTXECX-CYBMUJFWSA-N 381.819 5.127 30 20 GKED C=CCC[C@@H](NC(=O)c1c(C)noc1C(F)F)c1ccc(C(F)(F)F)cc1 676731443 ZODMXIRHDREMII-CYBMUJFWSA-N 388.336 5.377 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)C1CCCCC1 726322288 UGAIZYXKUXJYCO-WFASDCNBSA-N 381.303 5.247 30 20 GKED C[C@H](NC(=S)N[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 726481082 WOZMEDUVXCBIJJ-RYUDHWBXSA-N 378.328 5.151 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(O)c(C)c2)cs1 728230218 BMCVMQLHYOUGQW-XFFZJAGNSA-N 392.480 5.046 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(-c2cccs2)n(C2CC2)c1=S 729469454 AHEMINXFFABENT-UHFFFAOYSA-N 389.594 5.087 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@H](C)c1c(Cl)cccc1Cl 733098687 DHJDCADNXLYVGI-CQSZACIVSA-N 398.293 5.232 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2F)cc1 733207290 XEQJGGWSOYLXFD-BJMVGYQFSA-N 394.368 5.271 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccc(CC(C)C)cc1)C1CC1)c1ccncc1 734666621 ZRCYDBLFZJQLCY-PKTZIBPZSA-N 377.532 5.348 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@@]3(C#N)CCC[C@H](C)C3)cs2)cc1 735056974 AOWRTXPAXCGMGC-AOMKIAJQSA-N 381.545 5.065 30 20 GKED CCC(CCc1ccc(Br)cc1)=NNc1oc(C(C)C)nc1C#N 745613920 QYQNXRFSAJWFIG-UHFFFAOYSA-N 389.297 5.243 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)Cc1ccccc1Cl 746214877 BXCTXVPIPBDOPD-QGZVFWFLSA-N 383.923 5.010 30 20 GKED C=C(C)COc1cc(/C=C\C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1OC 747061539 JQERZUOFYJWNMO-YWEYNIOJSA-N 387.819 5.108 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(SC(F)F)c1 752665421 BQHKRSOMILWTHG-QZTJIDSGSA-N 387.455 5.305 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc3ccccc3c2O)cc(OC)c1OC 756686652 JKOMNPHGGUARQS-INIZCTEOSA-N 377.484 5.142 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)COc2cc(Cl)cc(Cl)c21 758915527 ZDTZKJPPDXOEAB-YHYXMXQVSA-N 389.263 5.171 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759184022 OUIJRQKSONABQA-FWFZHJKVSA-N 376.843 5.125 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1cc(Cl)cs1 759432032 SFWQSKRVMIOGHT-OAHLLOKOSA-N 396.855 5.155 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)sc2ccc(F)cc12 764303587 YKLOXGTXXQOBQG-UHFFFAOYSA-N 389.795 5.034 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 767700346 QJPMHEBVTAYODK-OAHLLOKOSA-N 386.517 5.090 30 20 GKED C[C@@H]1C(=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C[C@H]1c1ccccc1 767782234 NDLCUVCSYQHDGU-DZGCQCFKSA-N 397.404 5.149 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccc(Cl)cc2)s1 772960658 VTCBKMHHKDLCCW-OAHLLOKOSA-N 382.916 5.822 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(C)o2)C2CCCC2)ccc1OC 775631705 KUWDISUXXZWWFC-CVDCTZTESA-N 382.504 5.299 30 20 GKED C[C@H](N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 777655662 HPPRIFLSXCDFBZ-KSFYIVLOSA-N 391.515 5.633 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 779105056 RLLFIAWFXUIRRO-LADGPHEKSA-N 390.914 5.900 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nc4c(s3)CCC4)cc2Cl)c1 779595219 FRTQXXQFVACFCI-UHFFFAOYSA-N 395.915 5.348 30 20 GKED CC(C)(C#N)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 786318218 WTEVSZGUCMDEBM-GFCCVEGCSA-N 378.284 5.233 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1csc(Cl)c1 787186965 UQYNRHVVIIOARO-SNAWJCMRSA-N 376.846 5.329 30 20 GKED Cc1cnc(Cl)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 787985218 NNPODEWFYIEORD-UHFFFAOYSA-N 377.831 5.154 30 20 GKED N#CC[C@H](CC(=O)OCc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 796672931 RJCVXUCWEXWAQS-JOCHJYFZSA-N 398.462 5.070 30 20 GKED CN(CCC#N)c1ccc(CN[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1 797876342 FRBFHRMMYJSBAJ-KESTWPANSA-N 387.449 5.091 30 20 GKED Cc1nc(Cl)ccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 802045254 JCYPWXXIQTXEHM-NSHDSACASA-N 395.793 5.162 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2cc(Cl)c(O)cc2F)cc1 805257874 FUIRTSRRQMQPPQ-UHFFFAOYSA-N 396.805 5.409 30 20 GKED Cc1ccc(C2(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)CCC2)cc1 842689505 HYVIXIKKNVBPOS-MRXNPFEDSA-N 379.410 5.038 30 20 GKED CC(C)(CC(F)(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 850770079 XBIAKNHOKPVQPM-SECBINFHSA-N 394.340 5.470 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)n2)cc1 860503080 TVRKNRHAERLKCA-XUVXKRRUSA-N 388.492 5.107 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2nc(Cl)ccc2Cl)cc1 915086073 RBVVLAWMFDTAJT-INIZCTEOSA-N 382.250 5.296 30 20 GKED C[C@H](Oc1ccc2c(c1)CCC2)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915293385 KORGXPFOUDLRAY-BVZFJXPGSA-N 396.490 5.237 30 20 GKED N#CCOc1cccc(NC(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)c1 916409860 QTNKOWIMACYAPK-LUAWRHEFSA-N 378.428 5.108 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Cl 917026200 AKVSTVYSWSYKKB-YOEHRIQHSA-N 396.899 5.416 30 20 GKED CCC[C@@H](NCc1ccc(OC)c(O[C@H](C#N)CC)c1)c1ncccc1Cl 925397487 PJDUZRRXWDUYIO-FUHWJXTLSA-N 387.911 5.056 30 20 GKED Cc1ccc(C(=O)/C=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c(C)c1 1776133406 WGZVMSZBSURWBT-JYAZYPBOSA-N 386.447 5.404 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(C2CCCC2)c1 1776355489 SRDVDZOARGEJAG-BENRWUELSA-N 378.468 5.726 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2cccc(Cl)c2)s1 1776782969 STIUJBPJHIRDPM-GOSISDBHSA-N 393.980 6.362 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC)c(O[C@@H](C)CC)c1 1776784261 ZGSVUWKDHOJSOP-HKUYNNGSSA-N 379.541 5.166 30 20 GKED Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(C#N)c(Cl)c1 15541722 DFWKABXRXNSCGA-UHFFFAOYSA-N 390.201 5.220 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(/S)Nc2ccccc2F)cc1 22726992 LOFSHUKCDLVJSN-UHFFFAOYSA-O 399.536 5.096 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)C(=O)Nc2cccc(C)c2C)n1 26142525 FKKLTIBEYBXPIX-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED COc1cc(/C=C\C(=O)Oc2ccc(Cl)c3ccccc23)ccc1OCC#N 33528056 CCLKGULFXMZSOL-XFFZJAGNSA-N 393.826 5.023 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1ccccc1)c1ccc(C(F)(F)F)cn1 41555300 RULWOKNMJJBLHL-QGZVFWFLSA-N 382.341 5.383 30 20 GKED N#Cc1cnc(NCc2cn(-c3ccccc3)nc2-c2ccccc2)c(Cl)c1 60372192 STAWPRUTPQHIKG-UHFFFAOYSA-N 385.858 5.071 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)ccc2F)cc1Cl 60722069 MTQPXXMURUZZIF-GOSISDBHSA-N 382.797 5.526 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc4ccccc4o3)s2)c(C)c1 69346295 KEPKCLXAQUOSET-INIZCTEOSA-N 387.464 5.367 30 20 GKED C=CCn1c(Sc2nc(C)nc3scc(CC(C)C)c23)nnc1C1CC1 108099471 GQHVXNVECGMUQM-UHFFFAOYSA-N 385.562 5.004 30 20 GKED Cn1c([C@H](C#N)C(=O)CCCc2cc(Cl)sc2Cl)nc2ccccc21 119829853 BIGNRKFPRCEHJL-GFCCVEGCSA-N 392.311 5.141 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 120689972 DXLYZBWJXOIDPG-IBGZPJMESA-N 394.475 5.200 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N(CCC#N)Cc1ccco1)c1ccccc1 124987975 ZXYXBDVQWPPOBB-SFHVURJKSA-N 389.455 5.367 30 20 GKED COc1ccc(Cl)cc1-c1nnc(SCc2ccccc2C(C)(C)C#N)[nH]1 128694577 YGXNDKKNLBMKRF-UHFFFAOYSA-N 398.919 5.227 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1nc(Cc2ccc(F)cc2)no1 133215993 APDQZYNYJQHWJP-GJZGRUSLSA-N 396.491 5.224 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC[C@@H]1c1nc2ccccc2s1 171136153 ZETMLQBMJQSIPC-MRXNPFEDSA-N 393.516 5.093 30 20 GKED Cc1ccc([N+](=O)[O-])c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 173988362 DYOUURWWINSEOO-HNNXBMFYSA-N 397.843 5.170 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(OCC#N)cc1 181463354 WXENJGWRRIORKD-FQEVSTJZSA-N 399.538 5.168 30 20 GKED CCCOc1ccccc1Oc1ncccc1CN[C@H](C)c1cccc(C#N)c1 181531749 BVFLYMYMFGBKNL-GOSISDBHSA-N 387.483 5.385 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1)c1ccccc1 187039336 ZIFLLIZSOZHTOC-HXUWFJFHSA-N 388.467 5.529 30 20 GKED C=C(C)[C@@H](N[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 187786302 YZLHUYKJJBUYOS-KZULUSFZSA-N 398.375 5.218 30 20 GKED COc1cc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc(OC)c1 207732312 HLTUEWHHPNXPSM-YBEGLDIGSA-N 377.465 5.040 30 20 GKED N#CC1(c2ccccc2)C/C(=C/c2cccs2)C(=O)/C(=C/c2cccs2)C1 213186517 KTZAIMPHPYLLNW-BQWARBPISA-N 387.529 6.101 30 20 GKED N#Cc1ccc(CSc2ncc(-c3ccccc3)n2CC(F)(F)F)c(F)c1 216057055 NIFLHWFRDXWVJT-UHFFFAOYSA-N 391.393 5.415 30 20 GKED N#Cc1csc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)c1 236742766 VVXJNFFEAFFDGG-IBGZPJMESA-N 383.314 5.261 30 20 GKED N#CCCCCNCc1cn(Cc2ccccc2)nc1-c1cc2ccccc2o1 237817951 HWQMHFGNGODVOS-UHFFFAOYSA-N 384.483 5.128 30 20 GKED O=[S@@](Cc1cccc(N=Cc2cc3ccccc3nc2O)c1)C1CCCCC1 255718877 OHWVRKVWXZWCLS-NDEPHWFRSA-N 392.524 5.272 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/C1(C#N)CCC(C(C)(C)C)CC1 329114450 HRIKEAYHAPNAIF-FQWCMUAHSA-N 389.565 5.149 30 20 GKED C[C@@H]1C[C@H](C(O)=Nc2ccc(Cl)c(/C(O)=N/C3CCCCC3)c2)CC(O)=N1 329350677 TUQVBVKHTMDGLZ-OLZOCXBDSA-N 391.899 5.320 30 20 GKED O/C(=N\C1CCC(/C(O)=N\Cc2cc(Cl)sc2Cl)CC1)C1CC1 330011636 JGJRYPXMVWNFQG-UHFFFAOYSA-N 375.321 5.437 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1/C(O)=N/[C@@H]1CCCc2sc(Cl)cc21 330200302 AEBQRZBLMZJQGA-CABCVRRESA-N 392.956 5.137 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NC[C@@H]3CCCC(F)(F)C3)cc2)cc1 410259905 JWCVSWVUOKARBO-QGZVFWFLSA-N 384.426 5.100 30 20 GKED N#CCCC[C@@H](NCc1c(-c2ccccc2)nc2ccccn12)c1ccccc1 433021496 XOKCSWSFMTWAHV-JOCHJYFZSA-N 380.495 5.526 30 20 GKED N#CCCCn1cc(C(=O)N(Cc2ccc(F)cc2F)C2CC2)c2ccccc21 443952784 YADGPXRJGJSMFK-UHFFFAOYSA-N 393.437 5.028 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444342613 XSXQMXZGBHKEDA-UHFFFAOYSA-N 375.472 5.335 30 20 GKED N#Cc1ccc(F)c(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 444733009 KSOUZUDWPJPESR-MRXNPFEDSA-N 390.302 5.499 30 20 GKED CC[C@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(C#N)cc1 447579159 JHAWSUCAIVIHIM-SFHVURJKSA-N 379.847 5.620 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccccc1 455338225 RIPLGKJGHBTXMJ-OAHLLOKOSA-N 395.356 5.123 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 462058114 LCHCFOGDLDQNGS-VIFPVBQESA-N 385.436 5.117 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)cc2)ccn1 464667951 KVUATOAXYVPPTM-QZTJIDSGSA-N 389.377 5.053 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1cccc(C(=O)Nc2ccccc2)c1 464824845 WJLPHBLXGGSQEU-DQEYMECFSA-N 395.506 5.211 30 20 GKED C[C@@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccc(C#N)cc1 465650576 APFONFAGZCSKKL-CQSZACIVSA-N 387.405 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1 475570907 DIYUJWAVYWNZEW-UNMCSNQZSA-N 398.934 5.844 30 20 GKED CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H](c1ccc(C)cc1)c1cccnc1 475908605 WTQRNWLFBNAIDL-XMMPIXPASA-N 397.522 5.443 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1C 476245544 GNVRUSQVHSDXFF-UHFFFAOYSA-N 378.516 5.754 30 20 GKED CCCN(CC(C)C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481688062 QSUBIKJGHFTZKS-UHFFFAOYSA-N 383.467 5.176 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cccc(C#Cc2ccccn2)c1 482099885 CSLFVCBRWDZHKM-OAQYLSRUSA-N 394.396 5.156 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC[C@@H](c3ccccc3F)C2)c2ccccc21 482868885 RLLGIOCXAMZOQM-MSOLQXFVSA-N 389.474 5.150 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1ccc(C#N)cc1 485713784 DCVXPBMXMKGOSY-AWEZNQCLSA-N 378.378 5.120 30 20 GKED C[C@@H](C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2)c1ccc(Cl)s1 486591135 QUYFLFMGFIJHPQ-XXWNAHEMSA-N 376.953 5.216 30 20 GKED C=CCC[C@H](NC(=O)CCc1cncc(C)c1)c1ccc(C(F)(F)F)cc1 486779595 NRORVVOVRPKYMW-IBGZPJMESA-N 376.422 5.165 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)NC(C)(C)CC)c(Cl)c1)c1ccccc1 488661815 VZZJUKJNBVQCGW-SFHVURJKSA-N 398.934 5.557 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1cccc(OCc2ccccc2C#N)c1 498600455 NOCMKPDXQBMZRJ-QGZVFWFLSA-N 388.442 5.110 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CSc2cccc(C(F)(F)F)c2)cc1 499432330 NZTHPDOHYXKDOB-UHFFFAOYSA-N 378.419 5.237 30 20 GKED N#CC1(CCCN2CCC[C@H](Cc3csc4ccccc34)C2)CCOCC1 499631130 NCDXEBPJKLBMTR-LJQANCHMSA-N 382.573 5.256 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 500792066 CTEHMOSMCKEZEC-CQSZACIVSA-N 376.378 5.119 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2ccc3ccccc3c2)C2CC2)cc1 500939784 QNWJOLUQZIYKDW-UHFFFAOYSA-N 386.520 5.136 30 20 GKED CCCn1ccc2cc(NC(=O)Nc3ccccc3S[C@@H](C)CC#N)ccc21 503226688 SRVKDWXMRJGUOH-INIZCTEOSA-N 392.528 6.090 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)c1nccn1C 505005355 KNFRJQBVERPDHD-HXUWFJFHSA-N 394.906 5.103 30 20 GKED N#CCCN(Cc1cccnc1)Cc1ccc(-c2ccc(Br)cc2)o1 505858599 HDPIGVJAWRXUPJ-UHFFFAOYSA-N 396.288 5.020 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1cccc(Br)c1Cl 506629175 XPXJEKHNKLZLPW-UHFFFAOYSA-N 392.684 5.048 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H]2C(C)C)cc1 508273979 LVJYVXKWGQPJKE-LJQANCHMSA-N 379.460 5.011 30 20 GKED C[C@H](NC(=O)c1ccc(COc2ccccc2C#N)o1)c1cccc2ccccc12 511800626 BXUCOMKCOKMPAR-KRWDZBQOSA-N 396.446 5.374 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(Cc2ccccc2)n1 512522796 ZEDGBIVWRXJLNU-UHFFFAOYSA-N 380.561 5.090 30 20 GKED C[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H](COC(F)F)C1 512850905 MBTUGTDQZQLQOJ-UWVGGRQHSA-N 391.302 5.346 30 20 GKED CN(Cc1ccoc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 516080051 CXGHFCGLROFWPV-UHFFFAOYSA-N 381.819 5.261 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N 518140225 UEXWPPRKMSAAHH-HIFRSBDPSA-N 388.920 5.306 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CS[C@@H]2CCCc3ccccc32)cc1 523953817 WPEOQEPTWNJGBB-JOCHJYFZSA-N 394.540 5.143 30 20 GKED Cc1ccc(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c(Br)c1 533647999 GMYFARRRJFVAJT-CQSZACIVSA-N 398.087 5.059 30 20 GKED Cc1c(C(=O)Nc2cccc(C#Cc3ccccn3)c2)cccc1-c1ccccn1 534353978 MXKMNITWEHJDGV-UHFFFAOYSA-N 389.458 5.104 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)cccc1-c1ccccn1 535845155 NUFULLBUDOTVIN-CQSZACIVSA-N 387.508 5.367 30 20 GKED C[C@@H](NCc1noc(-c2ccsc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541086830 RAWDSAXCTZEKKT-OAHLLOKOSA-N 386.480 5.188 30 20 GKED CCC(C)(C)OCc1ccccc1NC1CCN(Cc2ccc(C#N)cc2)CC1 541759028 HRHWUDUMUMACLF-UHFFFAOYSA-N 391.559 5.340 30 20 GKED CCS[C@H](C)c1noc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542017052 IKQRIRPAGGXMOC-JKSUJKDBSA-N 392.528 5.273 30 20 GKED Cc1ccc(-c2nc(Cc3noc(C4(c5cccc(C#N)c5)CC4)n3)cs2)cc1 546319939 DZKNCTCNRSGNGZ-UHFFFAOYSA-N 398.491 5.044 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc2c1CN(c1nccs1)C2)c1ccccc1 548614831 KMFRQCFTUVWYHI-IBGZPJMESA-N 389.524 5.352 30 20 GKED CCOc1ccc(CCC(=O)N(Cc2ccccc2)c2ccccc2C#N)cc1 552011636 JAUDRSICHDZVGO-UHFFFAOYSA-N 384.479 5.123 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Br)c(F)c1 553830866 BMTVOZMQCNISBR-CYBMUJFWSA-N 377.257 5.444 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 559356452 GCAGCPCETBDVJI-UHFFFAOYSA-N 388.345 5.114 30 20 GKED CC(C)[C@](C)(Cc1ccc(Cl)cc1)NCc1nnc(-c2ccc(C#N)cc2)o1 559385596 BPCFBHYPEOLYIU-QFIPXVFZSA-N 394.906 5.009 30 20 GKED C[C@H](NC(=O)[C@@H]1CCC(=O)c2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 560088493 MPKIPENNISUQOD-BXKMTCNYSA-N 394.474 5.163 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OCCCC)cc1C 565733231 FDDUSMJBBDASCW-UHFFFAOYSA-N 398.551 5.562 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cc2)ccn1 575224244 URWMSRRYULQBSR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(Cc2ccccn2)ccc1C 576167234 WQSHULIUJDKTHU-UHFFFAOYSA-N 385.511 5.243 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nccc(C(F)F)n1 583398221 GZQZZLUCDYSWPC-UHFFFAOYSA-N 385.258 5.088 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3CCc4c(Cl)cccc43)cc2)ccn1 589471444 JSHBABCKTNSMEJ-FQEVSTJZSA-N 389.842 5.067 30 20 GKED N#CC1(c2ccc(-c3cc(F)ccc3OC[C@@H]3CCCCO3)cc2)CCOCC1 592984369 PNHHHRIFXCIWHU-NRFANRHFSA-N 395.474 5.012 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](C)(c2cccc(F)c2)C1 593157433 ITENVSGLNXSKHH-AOMKIAJQSA-N 397.519 5.415 30 20 GKED C[C@H](N[C@@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)c(F)c1 595077266 QFCZPSZMKSNGKA-BBATYDOGSA-N 391.309 5.099 30 20 GKED N#CC1(c2ccc(CN3CCC[C@@H](c4nc(C(F)(F)F)cs4)C3)cc2)CC1 597018503 FPGSWAICRQSOBS-OAHLLOKOSA-N 391.462 5.097 30 20 GKED CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)N1CCC[C@H](CC#N)C1 597052594 UEYSMVBOHDWULJ-SNVBAGLBSA-N 391.846 5.238 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(C)c1 609499351 MJORBDCMLAANPS-GOSISDBHSA-N 385.467 5.196 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C)(C)Cc1ccccc1 609783606 BCDFLDGVROUUQC-UHFFFAOYSA-N 385.467 5.261 30 20 GKED N#Cc1ccc(CC(=O)N[C@H](c2ccc(Cl)cc2)c2ccccc2Cl)cc1 610117564 IQNQMSVIBBJKJN-JOCHJYFZSA-N 395.289 5.313 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)CSc2nc(C)c(C)c(C)c2C#N)cc1 610179515 MHCJWGRHZXOCEY-OAQYLSRUSA-N 393.556 5.033 30 20 GKED CC(C)COc1cccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 613403980 YCMAUMRTSADLPJ-INIZCTEOSA-N 384.888 5.475 30 20 GKED CN(CC(=O)c1cn(CCC#N)c2ccccc12)Cc1csc2ccccc12 613673573 HROJTORBGBVCQO-UHFFFAOYSA-N 387.508 5.084 30 20 GKED O=C(c1cc2cc(F)ccc2s1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618363757 NKDBPTZHVHZNPE-NXEZZACHSA-N 399.331 5.243 30 20 GKED C=CCC1(NC(=O)c2oc3ccccc3c2CSc2ncccn2)CCCC1 619104981 ZXONZGXPCTUBFO-UHFFFAOYSA-N 393.512 5.134 30 20 GKED CC1(C(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCC(F)(F)CC1 623983351 YYGUUBUCSTZWLJ-NXEZZACHSA-N 395.334 5.228 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccco2)s1)c1nc(-c2ccccc2)cs1 675908514 QMPNSZNFHWTVIG-AWEZNQCLSA-N 376.462 5.622 30 20 GKED CC(C)[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cn1 679387000 UTXJKYHOAOUQPD-PGUXBMHVSA-N 386.355 5.417 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 726757898 QKHFXXUPMNKKIW-KTZABMDBSA-N 384.401 5.344 30 20 GKED Cc1ncccc1/C=C/C(=O)c1sc(-c2ccccc2Br)nc1C 730148640 IRGPKDRGMBKPHM-MDZDMXLPSA-N 399.313 5.481 30 20 GKED N#C[C@H](NC(=O)Cc1cc(Cl)ccc1Cl)c1ccc(Cl)c(Cl)c1 731646027 WECOHHJVAIUATG-HNNXBMFYSA-N 388.081 5.224 30 20 GKED C#CCCOc1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 733324206 MXKJIWBSUOJXKM-ZSHCYNCHSA-N 393.371 5.088 30 20 GKED CCOc1cc(/C=C/C(=O)c2c[nH]c3ccc(OC)cc23)ccc1OC(F)F 734307874 VKKBARSDKBJNCS-XBXARRHUSA-N 387.382 5.073 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1OC 734981736 SQQFDLBMKMNIHW-BJMVGYQFSA-N 394.439 5.313 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(C)c(NC(=O)Nc3ccccc3)c2)c1 741186177 PORNPJCSNZTIPU-UHFFFAOYSA-N 397.478 5.287 30 20 GKED CC(=NNc1nc(-c2ccccn2)nc2c1CCC2)c1cccc(Cl)c1Cl 741808705 AOVSUDGUZKPBLC-UHFFFAOYSA-N 398.297 5.170 30 20 GKED C[C@@H](NC(=O)Nc1ccc(N(C)Cc2ccccc2)cc1)c1cccc(C#N)c1 743114639 GWGLUICTFJJCJO-GOSISDBHSA-N 384.483 5.077 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 744034754 LEIMNVJDFWVQNI-SJCJKPOMSA-N 384.863 5.583 30 20 GKED COCc1cccc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1 746653360 DLGHMMIYMBMDMQ-UHFFFAOYSA-N 376.431 5.035 30 20 GKED CC(=NNc1cc(Cl)ccc1Cl)c1sc(-c2cccnc2)nc1C 751895221 HORAMJSGQZZVDS-UHFFFAOYSA-N 377.300 5.656 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 755218815 AWCSDQKNRJZZMP-HNAYVOBHSA-N 389.421 5.585 30 20 GKED CC(=NNc1cnnc(O)c1Cl)c1ccc(-c2ccc(Cl)cc2F)s1 758101191 VXEANHHTEZNQCD-UHFFFAOYSA-N 397.262 5.193 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cccc(Cl)c1F 759647977 FKFXIVKETFIEFV-UHFFFAOYSA-N 397.862 5.108 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C1CC1 760350431 KIRZHWMQRUXRJI-HTAPYJJXSA-N 398.510 5.639 30 20 GKED C=CC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(C)cc3)sc21)c1ccncc1 766018891 JLDXETMKRQHZHZ-WOJBJXKFSA-N 375.541 5.798 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2C[C@H](C(C)C)c3ccccc32)ccc1OC 774235508 FWZSRCUZIJTIIE-QIJUGHKUSA-N 378.516 5.350 30 20 GKED C#CCC1(C(=O)OCc2nnc(-c3ccc(Cl)cc3Cl)o2)CCCCC1 788217652 ITGISPMNAUEGGY-UHFFFAOYSA-N 393.270 5.060 30 20 GKED CC(C)(C)OC(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)c(Cl)c2)c2ccccc21 800989397 CESHWXJBVYVFGH-VQTJNVASSA-N 397.906 5.012 30 20 GKED CSc1nc(C2CC2)cc(-c2nc(-c3cccc(C(F)F)c3)no2)c1C#N 809480270 FYPTZTOPWOXASL-UHFFFAOYSA-N 384.411 5.207 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(Cl)c3F)n2)cc1 810531843 MNWIKGGBWNMFTD-HNNXBMFYSA-N 384.863 5.330 30 20 GKED CN(C)Cc1cnc(/C=C/C(=O)c2ccc(-c3c(F)cccc3F)cc2)s1 811697722 MKFLOLFHRQMSIW-ZHACJKMWSA-N 384.451 5.046 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942910 RKVWMANHPIGNAD-HZMBPMFUSA-N 379.312 5.382 30 20 GKED C=C1C[C@@H]2CC[C@@H](C1)N2C(=O)CCCCCCCC(=O)N1[C@H]2CC[C@@H]1CC(=C)C2 856200448 QCGIQLILZNRYFL-CWBXHPNXSA-N 398.591 5.136 30 20 GKED CC1(C)CN(C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)CC[C@@H]1C(F)(F)F 857493561 DXFINESXDODIFI-QWHCGFSZSA-N 385.323 5.153 30 20 GKED CC(C)Cc1ccccc1-c1noc([C@H](CCCC#N)NC(=O)OC(C)(C)C)n1 858811462 AMEISZRRRIBMJN-SFHVURJKSA-N 398.507 5.195 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC2C[C@@H]3CC[C@H](C2)S3)cc1 888353015 OCXJVALNWOBODU-YQQQUEKLSA-N 394.565 5.007 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 916849167 SQEHGHSCNJWUDY-JOCHJYFZSA-N 398.506 5.807 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccc(F)cc2)cc1 918488199 XAPBBQFBZFCVFI-HRAATJIYSA-N 380.463 5.009 30 20 GKED COc1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)cc1 918713603 PIZVTADANBDXBN-WDZFZDKYSA-N 385.872 5.280 30 20 GKED C=CCn1c(SCc2cc(Cl)nc(Cl)c2)nnc1-c1ccccc1F 920069328 FIOQDUNGMYMOFS-UHFFFAOYSA-N 395.290 5.264 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2c(Cl)cccc2s1 920106002 QSCVKZUERWMUKY-CQSZACIVSA-N 392.867 5.550 30 20 GKED CC(C)=C[C@@H]1[C@H](C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)C1(C)C 920804398 QEAHJUOHUYBLOK-SNUQEOBHSA-N 386.467 5.503 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccc(Cl)cc3)o2)c1)C(=O)O 1776470992 XBIGJKILRYVHGQ-MARXPDLDSA-N 396.826 5.348 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cnc(-c3ccsc3)s1)C2=O 1777683018 LAXQSTKFBLEJSM-LCYFTJDESA-N 381.478 5.172 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC(C)(C)C)CC1 1829066226 WDVOZWHEYISXFB-FQEVSTJZSA-N 390.612 5.035 30 20 GKED Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)Nc1cccc(C#N)c1 7265533 SIEZMNSJPFXOJN-UHFFFAOYSA-N 397.434 5.148 30 20 GKED C=CCN(CC(=O)Nc1c(Cl)cccc1Cl)Cc1ccc(Cl)s1 18939520 MFFLBTMNPFPFCA-UHFFFAOYSA-N 389.735 5.335 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(Cl)cc1F 33196126 SVSLUAVFTMQJQF-HTQZYQBOSA-N 391.714 5.118 30 20 GKED N#C[C@@H](C(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccc2ccccc2n1 47375771 HSTJKSVGPISMOA-GOSISDBHSA-N 397.459 5.039 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 63400972 STYGOZBDXUTIRJ-IBGZPJMESA-N 397.931 5.146 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2F)C1 66953793 RMEBYVJOXOJXBL-JKSUJKDBSA-N 383.492 5.241 30 20 GKED CN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(F)cc1)CCC2 105664767 DYXYOWNIGKUAOM-VLGSPTGOSA-N 399.469 5.236 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccccc1OCc1ccccc1Cl 105862471 BVXDSMRANHEJQY-UHFFFAOYSA-N 390.870 5.063 30 20 GKED CC(=O)Nc1cc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 129474284 PQWNWFBTCLWANW-UHFFFAOYSA-N 394.290 5.434 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1cc2ccccc2o1 159294610 JMHOYETVDKPLAO-OAHLLOKOSA-N 379.485 5.191 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccccc2SC[C@H](C)C#N)c(Cl)c1 170991838 ZOQCIOHPOAGDCR-CABCVRRESA-N 387.936 5.339 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CCCc2ccccn2)c1 173788103 ZMTAURKFHFBTTR-UHFFFAOYSA-N 389.886 5.163 30 20 GKED Cc1oc2ccccc2c1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 185437782 ZXEZQWNGUDIMGA-UHFFFAOYSA-N 396.446 5.639 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1coc(-c2cccs2)n1 191464398 LRVNOBHZMJKZNV-UHFFFAOYSA-N 381.501 5.577 30 20 GKED C[C@H](C#N)OC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(Cl)cc1)CC2 210927576 AXUDSZCBQDNAIR-IZCBMXNHSA-N 388.854 5.444 30 20 GKED CN(CC1CCCCC1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 219769987 SDMNNDFPPNCFIL-UHFFFAOYSA-N 378.541 5.503 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 247430758 WHFSCYJISUGKSX-NZSAHSFTSA-N 393.556 5.657 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]nc(C2CC2)c1Br 276622910 OMWSPBGELSKFRC-UHFFFAOYSA-N 388.309 5.154 30 20 GKED Cc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1F 301242866 UXPPYZGMWJUXKR-UHFFFAOYSA-N 376.456 5.550 30 20 GKED C[C@@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 409475571 OJUIEEPOXLTYSX-CQSZACIVSA-N 376.378 5.130 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)c1 429970578 WJJGCNJNOLCWCP-UHFFFAOYSA-N 393.415 5.183 30 20 GKED CCC[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431290650 NHASPJPCTBTSJO-SFTDATJTSA-N 385.458 5.540 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3cccc(C#N)c3C)c2C2CC2)cc1Cl 432838576 FZOSZVWZZQAEQP-UHFFFAOYSA-N 390.874 5.144 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccccc2F)n1Cc1ccco1 436183565 BAJKNIGMBNSIEJ-UHFFFAOYSA-N 398.507 5.538 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 438644155 VZWXCWGDQHSMBK-UHFFFAOYSA-N 393.874 5.747 30 20 GKED CC[C@@H](NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccc(C#N)cc1 447586636 OOEPJDXRYDLPKY-HSZRJFAPSA-N 387.458 5.191 30 20 GKED Clc1cccc(C#CCSc2nnc(Cc3cccs3)n2C2CC2)c1 448102080 HWGJKXAMXXDDQS-UHFFFAOYSA-N 385.945 5.063 30 20 GKED N#CCCC[C@@H](N[C@H]1CCc2c1ccc(F)c2Br)c1ccccc1 449339456 KOLPQBBZFVTPDF-MOPGFXCFSA-N 387.296 5.600 30 20 GKED Cc1ccccc1[C@@]1(F)CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458855147 XWYJPMPOVIZFRL-JTHBVZDNSA-N 379.479 5.010 30 20 GKED N#CCCN(C(=O)c1cccc(C(F)(F)F)c1)C12CC3CC(CC(C3)C1)C2 460479584 ZNSSIBJRLNJHGH-UHFFFAOYSA-N 376.422 5.030 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC(c4ccccc4F)C3)cc2)c1 463735687 HCIDCNGWAQMNKA-UHFFFAOYSA-N 387.414 5.121 30 20 GKED COC1CCC(C)(CNC(=O)c2ccccc2Sc2ccccc2C#N)CC1 471261114 RKAQEPQFNCFACX-UHFFFAOYSA-N 394.540 5.035 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 472010406 DVLUIXICFWCIEL-FQEVSTJZSA-N 385.511 5.598 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2ccc(Cl)cc2)n1 476168048 UNARLVRNWXYLLQ-UHFFFAOYSA-N 379.891 5.630 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nc(-c4ccc[nH]4)cs3)c2)cc1 481994076 UIRXCCWNGGKXRJ-UHFFFAOYSA-N 386.436 5.054 30 20 GKED Cc1occc1-c1nnc(SCc2ccc(F)cc2C#N)n1-c1ccccc1 483100726 QMDUZPIVRYOQGY-UHFFFAOYSA-N 390.443 5.139 30 20 GKED N#CC1(F)CCN(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CC1 483936594 ARCKPGHVKAZLCA-UHFFFAOYSA-N 392.261 5.520 30 20 GKED CSc1cc(-c2csc(Nc3ccc(C#N)cc3)n2)ccc1NC(C)=O 500390332 PSLJYRAVFZQZTM-UHFFFAOYSA-N 380.498 5.106 30 20 GKED C=CCOc1ccc(CNCc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1OC 500897682 ZAOXWITVRJPMPX-UHFFFAOYSA-N 399.494 5.093 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1=Cc2ccccc2OC1 503962660 AGNDWHPGXCQYIL-UHFFFAOYSA-N 382.419 5.074 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 507570965 UWZMHTNLORPAPN-HNNXBMFYSA-N 396.388 5.069 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 509228570 SRSQKFXIPYTRDN-CYBMUJFWSA-N 377.366 5.121 30 20 GKED CCN(C(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccc(C#N)cc1 510430627 UCGJFRRCFOSJBI-CQSZACIVSA-N 395.915 5.294 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)CCc1ccc(Cl)c(Cl)c1 511968219 DBVIIXJRQMTLHM-UHFFFAOYSA-N 393.270 5.049 30 20 GKED CC(C)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518391045 VEIYRTXJSISXOV-UHFFFAOYSA-N 386.451 5.584 30 20 GKED CCc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[nH]c(C)c1C(C)=O 518733862 XZDAHMUXEUXTJQ-UHFFFAOYSA-N 387.439 5.004 30 20 GKED CCc1c(C)sc(NC(=O)c2ccccc2SCc2cccs2)c1C#N 524330766 BNNXYORJPRKOAM-UHFFFAOYSA-N 398.578 6.097 30 20 GKED CCSCc1cccc(NC(=O)c2cc(C3CC3)nc(SC)c2C#N)c1 524650153 HZNTVAMGWRIXMB-UHFFFAOYSA-N 383.542 5.058 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCn1ccc2cc(Cl)ccc21 534816134 YUHWEUSHJLOBDS-UHFFFAOYSA-N 397.931 5.719 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(C(F)(F)F)cc1 539051933 QCHXTNUWYSZEQR-VPDVJUPVSA-N 395.490 5.801 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 539124950 OCCGJKGDHZWDRY-INIZCTEOSA-N 386.455 5.191 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1ccc(F)cc1C#N 541661431 JEWUCRPAMSMUCV-LBPRGKRZSA-N 385.895 5.634 30 20 GKED C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@H](CCCC#N)c1ccccc1 551204194 AUJQHGYQYPIXGP-XMSQKQJNSA-N 397.950 5.102 30 20 GKED C[C@H](NCc1cc(F)c(F)cc1Br)c1ccc(C#N)cc1Cl 552338631 KKTBRHUZBMIWBB-VIFPVBQESA-N 385.639 5.103 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)nc1 555058194 CISKOAITEXAORA-ZDUSSCGKSA-N 383.423 5.097 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 556198856 YCTYTORKHHHQRW-HRAATJIYSA-N 393.531 6.343 30 20 GKED N#Cc1ccc2ncc(CN[C@H](c3ccccc3)[C@H]3CCCc4ccccc43)n2c1 560259629 ZIQWRJMBKWIATC-AZGAKELHSA-N 392.506 5.157 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1CC(C)(c2ccccc2)C1 561409134 WSZGMFOZCSSECC-GENZYMQKSA-N 379.529 5.323 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)N1CCC(CCC#N)CC1 564573233 WGQMHBFGSLFGJI-UHFFFAOYSA-N 398.510 5.004 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)n2)cc1 569792684 GKMSBJARJOFQCC-CHWSQXEVSA-N 385.901 5.139 30 20 GKED C=CCn1c(-c2sc3ccccc3c2Cl)nnc1N1CCC(C)(C#N)CC1 573186832 XEHNHOXXSUTHEY-UHFFFAOYSA-N 397.935 5.129 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC(C)(C)CCC#N 581241523 HXKJVEHPINQDMI-UHFFFAOYSA-N 376.460 5.110 30 20 GKED CCCOc1cc(C)ccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 603980018 SQFHIYGRHBTMIJ-UHFFFAOYSA-N 390.439 5.080 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609031141 BJRAUKUISSXOMQ-LSDHHAIUSA-N 389.282 5.394 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccc2ccccc12 609056718 GQSUNMMONZCIKW-UHFFFAOYSA-N 396.446 5.550 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc(Cl)c3Cl)c2)cc1 609175923 PGUVOMMINDGOHT-UHFFFAOYSA-N 383.234 5.910 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 609377812 NMGYTVDGMWMTTG-OAHLLOKOSA-N 376.481 5.352 30 20 GKED N#C[C@H](NC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1)C1CC1 609416178 HZDIBWSXAREEKI-KRWDZBQOSA-N 391.323 5.318 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609428432 GTXFOPYHTBCHNF-IAGOWNOFSA-N 382.529 5.610 30 20 GKED CCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@@H]1CCc2ccccc21 609499148 ABRZGOIKLLTSGH-HSZRJFAPSA-N 397.478 5.285 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)CCCCOc2cccc(C#N)c2)C2CC2)o1 609500307 ASIXYCAOPMGPPI-VGSWGCGISA-N 392.499 5.015 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)s1 609988439 JZJQMVAPKLAFKD-OAHLLOKOSA-N 390.512 5.208 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2C[C@H]2C2CCCCC2)cc1 610205621 RNXCSTKMEZTZPC-FCHUYYIVSA-N 390.552 5.549 30 20 GKED C[C@H](NC(=O)Nc1cccc(Cl)c1SCC(F)F)c1cccc(C#N)c1 610326275 HSSROYMIGYPHDO-NSHDSACASA-N 395.862 5.452 30 20 GKED COc1ccc(-c2csc3ncnc(N[C@@H](C)c4cccc(C#N)c4)c23)cc1 610340439 WOVVUPMVMYKFGL-AWEZNQCLSA-N 386.480 5.412 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCCO[C@@H](C)c1ccccc1 612203538 HIGHZSXNFLJRMW-INIZCTEOSA-N 392.952 5.267 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(-c2csc(C)n2)s1 612207321 HJGTVEJOGLAROB-UHFFFAOYSA-N 389.571 5.139 30 20 GKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 618801357 AGXLFPMNMDAWIT-LIRRHRJNSA-N 389.480 5.533 30 20 GKED O=C(N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F)[C@H]1CC[C@@H](C(F)(F)F)C1 648582630 CNQUUXBXDTYUKP-ATEUNZGCSA-N 396.306 5.005 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 666802820 LVTOVWHAWQCFDZ-UHFFFAOYSA-N 390.290 5.070 30 20 GKED Cc1cc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2cccc(F)c2n1 675790008 PRNLPCSKHRKPMC-PHIMTYICSA-N 380.307 5.249 30 20 GKED N#C[C@@H](C(=O)c1ccnc(C2CC2)c1)c1nc2cc(C(F)(F)F)ccc2s1 679980390 XOFYNTLJGSCAOI-ZDUSSCGKSA-N 387.386 5.078 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Nc3ccccc3)cc2)cc1Cl 726437269 BVDKTLPNZGKFNU-UHFFFAOYSA-N 378.888 5.764 30 20 GKED COc1ccccc1/C(C)=C/C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 727627246 DHLNBJOUTWJKQQ-SAAWKEMMSA-N 382.872 5.238 30 20 GKED Cc1csc(SCc2ccccc2C(=O)Nc2ccc(F)c(C#N)c2)n1 728180941 YDSFHKQTQXUDDY-UHFFFAOYSA-N 383.473 5.007 30 20 GKED Cc1cccc2c1C/C(=C\c1cn(-c3ccccc3)nc1-c1ccncc1)C2=O 729149276 CVIBNXDFFJJREN-XMHGGMMESA-N 377.447 5.065 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(C2CCCCC2)CC1 731114133 GOWJIIBOSCCVSZ-QGZVFWFLSA-N 385.577 5.763 30 20 GKED CCc1ccc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)s1 731151738 SZCWVVXQKROMTB-UHFFFAOYSA-N 383.329 5.047 30 20 GKED CCCC[C@@H]1CCCC1=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1 733079849 KZUUQPMQEGNVRW-CYBMUJFWSA-N 377.414 5.316 30 20 GKED C=CC[C@@H](NC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1)c1ccncc1 734460165 POIIQODJHCUAKI-HXUWFJFHSA-N 378.497 5.174 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)[nH]2)CC/C1=C/c1cnc(-c2ccccc2)[nH]1 742428966 APQMEVRGGQPGAL-AXPXABNXSA-N 392.462 5.297 30 20 GKED C[C@@H](NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 743777026 NEIRIUANAYTOEF-VVEJJEBESA-N 378.781 5.121 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=S)Nc3ccccc3C#N)c2)C1 745036302 YPTWPFGQFRQYNL-OXJNMPFZSA-N 379.529 5.462 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3ccc(Cl)s3)n2)cc1 750687028 JOVXKJJXKAHMMB-JSGCOSHPSA-N 386.929 5.813 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)OCC 756472261 VDHHLRBORJFRKG-XHDPSFHLSA-N 399.274 5.019 30 20 GKED CCOc1ccccc1C=NO[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 763169122 PQVOXLULYNGEPT-OAHLLOKOSA-N 384.863 5.814 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccc(Cl)cc2)CC1)c1nc2ccccc2n1C(F)F 771262790 YCAQNBRZUSYQEP-HNNXBMFYSA-N 399.828 5.284 30 20 GKED N#CCOc1cc(F)ccc1NCc1cccc(OCc2ccc(F)cc2)c1 779609609 PIKHPCRLOIJCAV-UHFFFAOYSA-N 380.394 5.058 30 20 GKED O=C(/C=C/c1cc(Cl)cc(C(F)(F)F)c1)c1ccc(N2CCOC2=O)cc1 780186976 ONWMXMZLKJJGTD-LZCJLJQNSA-N 395.764 5.212 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1c[nH]c2ccccc12 786401094 IKIUTVRWMWVTDN-DOMZBBRYSA-N 377.444 5.287 30 20 GKED C=CCC[C@@H](C)OC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 786968230 AGIXITSDSYHGKD-GFCCVEGCSA-N 383.275 5.264 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)cc2)CCCCC1)c1cnc2ccccc2n1 792111597 VXXQOIAXACBJPC-GOSISDBHSA-N 389.886 5.362 30 20 GKED C[C@H](NCc1cccc(Br)n1)c1ccc(-c2cccc(C#N)c2)cc1 794477144 HMROQUDQUVZXKC-HNNXBMFYSA-N 392.300 5.234 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 798864412 JJTKCJFHYJPIGP-FZMZJTMJSA-N 380.435 5.439 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(C)c(C)o2)cs1 799897983 URCXJJNAMZDUPA-YFHOEESVSA-N 380.469 5.242 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccc(Cl)c(SC(=O)N(C)C)c1 805439360 VCCUPQRAJZKCOZ-OAHLLOKOSA-N 399.944 5.023 30 20 GKED COCC1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCCC1 810158446 MWQDUUKWHDOTQI-QFIPXVFZSA-N 391.515 5.060 30 20 GKED C#C[C@H](NC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccc(Cl)cc1 810170051 DSPLBQZUJLBQLM-IBGZPJMESA-N 379.847 5.108 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1csc(-c2ccccc2)n1 818246337 SRHHCMDSYXVPEW-YIMYCEAYSA-N 388.448 5.548 30 20 GKED CC[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433941 WHAABHMZWUZVKT-HNAYVOBHSA-N 389.421 5.442 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915352892 KJEBEFAKUWPWGU-UUOWRZLLSA-N 399.494 5.623 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCSc2ccccc2)cc1 915353593 VQOWHNLQDYONMB-QFIPXVFZSA-N 387.508 5.256 30 20 GKED COc1cccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915353891 ZBVWBGRWHMSGEV-QHCPKHFHSA-N 385.467 5.015 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354236 XUOYWCMWEIMCBX-UZLBHIALSA-N 375.497 5.628 30 20 GKED CN(CCCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915359689 XLQOQODRCLPJQJ-DEOSSOPVSA-N 383.495 5.439 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COc3ccc(Cl)c(C)c3)n2)cc1 916628327 RMROMQZHKPXMJJ-KRWDZBQOSA-N 396.899 5.336 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3ccc(F)cc3)n2)cc1 918489782 NPMRHMYKDMCGTK-BEFAXECRSA-N 378.472 5.628 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(OCC(F)(F)F)cc1 920481185 XDCGZNQZYAEHDB-TWGQIWQCSA-N 390.386 5.042 30 20 GKED Cc1c(NN=C2CCC(c3cccc(C(F)(F)F)c3)CC2)cccc1C(=O)O 1776087780 WGGRNFKPELKZKQ-UHFFFAOYSA-N 390.405 5.838 30 20 GKED C=CCOc1ccc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)cc1Cl 1776123507 QCAXDDUHGISPMA-NTCAYCPXSA-N 399.899 5.920 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c(C)c1 1776132926 JQFVIBIZCIJPAM-XFFZJAGNSA-N 390.435 5.378 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)C(=O)c2ccccc21 1776308922 YSYHNXQDAQEDAB-LPRAYXGFSA-N 388.419 5.370 30 20 GKED CCCCCCCOc1cccc(CNc2ccccc2CCCC(=O)O)c1 1776787598 MLQAKCYEFSYPLM-UHFFFAOYSA-N 383.532 6.055 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2ccccc2C)cc1 1776788200 QNTNIVWQLFJCOP-QHCPKHFHSA-N 383.532 5.650 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)o2)c2cc(C(=O)O)oc12 1777360741 HFEWXBPLXHBRFX-VQHVLOKHSA-N 388.375 5.296 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(/C=C/C(=O)O)o1 1777487699 GLEGCRPDGCNXFC-GFULKKFKSA-N 399.855 5.359 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Cl)sc3Cl)c2c1 1777685487 IEKUUKNNSKBESU-IWQZZHSRSA-N 383.277 5.864 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccccc3SCC#N)cc2)cs1 29104033 HKGDTVMSCYYBGA-CQSZACIVSA-N 393.537 5.225 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(OCC)c(OCC)c1 43118696 VZKJLSAZFPNOIA-MRXNPFEDSA-N 388.533 5.004 30 20 GKED CCN(Cc1csc(COc2ccccc2)n1)[C@@H](C)c1ccc(C#N)cc1 60469277 XWHGMKALLWUECN-KRWDZBQOSA-N 377.513 5.177 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccccc2n1)c1nc(-c2ccc(Cl)cc2)cs1 60477509 HPTYKALDWCKLAY-INIZCTEOSA-N 389.867 5.502 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 65869933 LCVRMUFDCZVHDZ-UHFFFAOYSA-N 389.282 5.060 30 20 GKED COc1ccc(CC[C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66953928 AGPRAIBMUBSNRF-IAGOWNOFSA-N 397.544 5.232 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2C[C@@H]2c2ccccc2)cc1 67813095 UGPVNFQADKFIQC-FGZHOGPDSA-N 384.504 5.136 30 20 GKED CCN1CCc2ccc(NC(=O)c3ccccc3Sc3ccccc3C#N)cc21 110818684 AUTZUYUPWJGDCD-UHFFFAOYSA-N 399.519 5.344 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Oc2ccncc2)c1 112211604 AWXAPNGLANNOKF-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N(C)Cc2ccc(C#N)cc2)c1 151725034 TZTDXYCRPSZCTM-UHFFFAOYSA-N 393.434 5.185 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1ccc(OCC#N)cc1 180557950 UYXRWUQLRQSDLQ-CQSZACIVSA-N 397.931 5.525 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 193771345 YCABVQDGAVTCOV-HXUWFJFHSA-N 377.488 5.128 30 20 GKED C=CCSCCNC(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 195729837 UBPZQYULVOKFMA-LBPRGKRZSA-N 391.389 5.013 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(F)cc2)=C(\S)NC2CCC2)cc1 292371032 SHNIXRYROUUYAS-UHFFFAOYSA-O 399.555 5.098 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(C(F)(F)F)ccc1OCC 409820384 ZQTCSPXLLSBOPX-UHFFFAOYSA-N 384.423 5.386 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2cccc(F)c2C#N)c1)c1ccccc1 427423787 HGVXQYZEJRIKDP-UHFFFAOYSA-N 393.849 5.239 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1 437563266 ZZOGRUMYKQTBDB-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)NCc1cc(C#N)ccc1F 438020552 ZSLOESHZNCRJSA-UHFFFAOYSA-N 377.872 5.173 30 20 GKED CCc1cc(Br)ccc1NC(=O)N[C@H](CCC#N)c1ccccc1 439485651 KTAMDCHGVANSPA-QGZVFWFLSA-N 386.293 5.178 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(CCCC(C)(C)C#N)C2)n1 447397811 QKAFUMHEYQKECS-QGZVFWFLSA-N 383.561 5.328 30 20 GKED C[C@@]1(c2ccccc2)CCCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458804375 SLVMUASBJOFTJR-ISKFKSNPSA-N 375.516 5.185 30 20 GKED C[C@H](S[C@H](C)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1C#N 463207701 BXKHWLDYFOIZJQ-NEPJUHHUSA-N 379.312 5.686 30 20 GKED N#Cc1cccc(CNC(=O)N(Cc2cccc3ccccc23)C2CCCC2)c1 465531353 XCEDTPAEPFVVQP-UHFFFAOYSA-N 383.495 5.366 30 20 GKED N#CCCCn1cc(C(=O)N(Cc2c(F)cccc2F)C2CC2)c2ccccc21 469859873 CMUBKVNSJZHRPI-UHFFFAOYSA-N 393.437 5.028 30 20 GKED O=C(CCC(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474258288 IERZQNQAUMLEJI-SNVBAGLBSA-N 381.238 5.158 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2OC3)n1 474435913 CGJJXPOFCAOHRU-AWEZNQCLSA-N 380.494 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-n2nc(C)cc2C)c(F)c1 476123791 QAEJOXMOJTZDSB-UHFFFAOYSA-N 391.490 5.732 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)Cc1csc(-c2ccccc2F)n1 477602151 OMWAMPZLHFLSSI-UHFFFAOYSA-N 383.448 5.046 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 480517626 XFPHXYDIMSEEQX-DHIUTWEWSA-N 390.527 5.157 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Cl)ccc1Br)c1ccccc1 483866147 ZRJPAQWTPOQTPG-CYBMUJFWSA-N 377.669 5.129 30 20 GKED Cc1ccc(SCCC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1 487473889 NYEVELZGOZHDKU-UHFFFAOYSA-N 393.537 5.035 30 20 GKED N#CCCC[C@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 487537514 MYYUROVDACLJLI-VWLOTQADSA-N 382.507 5.760 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2ccc(C#N)s2)cc1 487597876 LZDDVGSANHTFGD-HNNXBMFYSA-N 376.481 5.129 30 20 GKED N#CCC[C@H](NC(=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1)c1ccccc1 489755128 JNEVZVZQCWPJRW-UXHICEINSA-N 399.947 5.261 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 490558911 AGIGAXHSKPMFQC-UHFFFAOYSA-N 387.439 5.206 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc2nc(C(F)F)sc2c1 493081600 RJBCDFNDJIKFCQ-UHFFFAOYSA-N 377.416 5.090 30 20 GKED C=CCN(Cc1cccs1)[C@H](C)c1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 499055908 YNNMVERGZUHZIW-ZIAGYGMSSA-N 399.585 5.332 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cccc(C(F)(F)F)c3F)n2)c1 502418580 UJJXCQPGBMHVLG-UHFFFAOYSA-N 391.349 5.092 30 20 GKED Cc1cc(C)cc(NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c1 502653875 UQEXNJBAKKKDRU-UHFFFAOYSA-N 384.439 5.071 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cnccc2Oc2ccccc2)s1 502755350 FUBXHJLXQPIWPE-HNNXBMFYSA-N 377.469 5.118 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N[C@@H](c2cccs2)C2CC2)c1 504007423 VOTYQGVJGIGIPQ-JOCHJYFZSA-N 388.492 5.080 30 20 GKED CCN(Cc1c(F)cccc1F)C(=O)c1ccccc1-c1ccccc1C#N 505926143 BREAXUUSJJELDK-UHFFFAOYSA-N 376.406 5.166 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCc4cc(F)ccc4C3)cc2)cc1 509732146 CGQYEHGAORWNMI-UHFFFAOYSA-N 387.414 5.080 30 20 GKED COc1ccc2cc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)[nH]c2c1 516230579 VLJKANWQUHXFET-UHFFFAOYSA-N 397.434 5.401 30 20 GKED C[C@@H](NC(=O)NCc1ccccc1Oc1cccc(F)c1)c1ccc(C#N)cc1 518658364 QLSSRWZEZQJFQI-MRXNPFEDSA-N 389.430 5.050 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@H]3C(F)(F)F)cc2)c1 519507446 YKKBBZPLKIMUKH-RBUKOAKNSA-N 388.389 5.658 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 522702648 WNUXGDXKKCZQPN-PXNSSMCTSA-N 381.501 5.146 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2cn(CC(C)C)nc2C(F)F)c1 534152006 WSCRGNNCSZAUHG-UHFFFAOYSA-N 378.423 5.076 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H](c2cccnc2)C2CC2)cc1 535489113 QFJXRWFHPNKPRR-QFIPXVFZSA-N 384.439 5.018 30 20 GKED CC(C)CC[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 538167113 KFYYEZYENOFGBW-HXUWFJFHSA-N 394.906 5.529 30 20 GKED N#CC1(c2ccc(C(=O)NCc3ccc(-c4nc5ccccc5s4)o3)cc2)CC1 538538340 ZBSPXSATXPXMGZ-UHFFFAOYSA-N 399.475 5.041 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)Cc2cccc(OCc3cccc(C#N)c3)c2)s1 539836082 VRLUVSRLNGQTCG-QGZVFWFLSA-N 391.540 5.404 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1F 542393956 OXESDXGWHXOXIB-UHFFFAOYSA-N 389.402 5.079 30 20 GKED C[C@H](N[C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543033649 JZHGXAIYYPANJR-RAALOAAWSA-N 388.536 5.374 30 20 GKED CC(C)(O)CCN[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 545194609 RZGVYGSUJWUCQF-NSHDSACASA-N 397.281 5.078 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 549299374 CWVFZTVEFXRXEL-SJORKVTESA-N 394.540 5.519 30 20 GKED CC(C)[C@@](C)(Cc1ccc(Cl)cc1)NCc1nnc(-c2cccc(C#N)c2)o1 550367907 HTCQEXCHFUPRJO-JOCHJYFZSA-N 394.906 5.009 30 20 GKED COc1ccc2ccc(C(=O)Nc3ccccc3SC[C@H](C)C#N)cc2c1 550846278 HNYOVUSAOQVQRD-OAHLLOKOSA-N 376.481 5.352 30 20 GKED N#CCCC[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccccc1 556908183 LCKPUHBFAXJROG-HXUWFJFHSA-N 398.432 5.416 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 562189830 LSQCRVALHURXLL-UHFFFAOYSA-N 395.871 5.373 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1C 574657578 BRFZYBSGYODRLG-SFHVURJKSA-N 385.414 5.146 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)n1 588739203 YOUAFTOITCAKOV-OAHLLOKOSA-N 378.522 5.504 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)C[C@H]1CCCO[C@@H]1c1ccccc1 589499689 ZISSXLYYBZOJKQ-TZIWHRDSSA-N 388.433 5.177 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1ccc(C#N)cc1 609062262 JWPGYJSFZNWPHF-UHFFFAOYSA-N 376.843 5.351 30 20 GKED COCc1cccc2sc(NC(=O)c3ccccc3-c3ccccc3C#N)nc12 609186790 QPUBMYRBLUTBKI-UHFFFAOYSA-N 399.475 5.234 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3SC[C@H](C)C#N)cs2)o1 609376429 ACYPBTIMWSBNCS-GFCCVEGCSA-N 383.498 5.216 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609378808 SCKACXQPWFRRMY-ZIAGYGMSSA-N 391.323 5.741 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609402889 GUVYQVJFNRNYCN-KRWDZBQOSA-N 399.535 5.768 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3scnc3-c3ccccc3)cc2)nc1 609502578 LISLQVHAHPKQDK-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)N(CCC#N)c2ccc3c(c2)OCCO3)cc1 609988315 SZRFXUDIMYEREU-SFHVURJKSA-N 392.499 5.022 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)NC(c1ccccc1)c1ccccc1 610164662 NJXRJKVHKULISC-MRXNPFEDSA-N 390.483 5.084 30 20 GKED CCc1noc(C)c1NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 612981342 AQAHKJZWXDCRJX-UHFFFAOYSA-N 398.278 5.087 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(OCC(F)(F)F)cc1 614178886 HKBCGXXUVAONHH-HNNXBMFYSA-N 376.422 5.280 30 20 GKED C=CCCOCC(=O)N(c1ccc(C(C)C)cc1)c1nc2ccccc2s1 620326307 FIVRYIZJGWLMKA-UHFFFAOYSA-N 380.513 5.677 30 20 GKED Fc1ccc([C@@H](CC(F)(F)F)NCc2cccc(F)c2OC(F)F)cc1 660188094 CBSHNGXIWCGBIZ-CQSZACIVSA-N 381.291 5.350 30 20 GKED N#C[C@@H](C(=O)[C@H](OC1CCCC1)c1ccccc1)c1nc2ccccc2s1 727039223 UWRMTORMSZHMFN-LAUBAEHRSA-N 376.481 5.173 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1O 727653844 AQCGEAMLPCWJHT-OQFOIZHKSA-N 385.872 5.382 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc3cc(OC)ccc3c2)c2ncc[nH]2)c1 729240465 NOOHSSFZKHWHPZ-XKZIYDEJSA-N 384.435 5.004 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(OC(F)F)cc1 730954951 PQLWLQQYXASTQL-LBPRGKRZSA-N 393.484 5.349 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C\c3cccc(OC)c3O)s2)cc1 733750440 ZFZMVJJDZXDHJS-QGNWGPJTSA-N 382.485 5.021 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccccc2OC(C)(C)C)cc1OC 734413237 YTTWZDLWCRWNFU-OWBHPGMISA-N 381.472 5.089 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccc(CC(C)C)cc1)C1CC1)c1ccncc1 734666617 ZRCYDBLFZJQLCY-DHIUTWEWSA-N 377.532 5.348 30 20 GKED C=CC[C@H](NC(=O)N(Cc1cccc(C)c1)Cc1ccco1)c1ccncc1 734680949 WTXKKNGNTCCYSV-QFIPXVFZSA-N 375.472 5.012 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 734966270 XCROHYMPEVBBPX-FZKQIMNGSA-N 398.890 5.973 30 20 GKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1sccc1Br 741844693 RUXOUVIZWIMICA-AATRIKPKSA-N 391.208 5.348 30 20 GKED CC(C)C(=O)Nc1ccc(-c2csc(NN=Cc3ccccc3Cl)n2)cc1 749260543 DOZMWGFNMXHDSM-UHFFFAOYSA-N 398.919 5.504 30 20 GKED CC[C@](C)(C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 749611889 GKUMSRIDPXCSDK-HXUWFJFHSA-N 381.526 5.011 30 20 GKED CC(C)N(C(=S)Nc1ccccc1Oc1ccccc1)c1cccc(C#N)c1 749766610 FUAVYMDLULOVEV-UHFFFAOYSA-N 387.508 5.962 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cc(Cl)c(O)cc2Cl)S1 759036324 VSYATCZVOMACMC-CHHVJCJISA-N 393.295 5.207 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3cccnc3)s2)cc1 761312570 ZGMRZVQEWNVJAL-HXUWFJFHSA-N 396.475 5.113 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)C1 766616433 HUHUMUJHFGRWTQ-KURKYZTESA-N 384.545 5.628 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(F)cc2OC(F)F)cc(OC)c1OC 772945368 FDQQLIBZMBFOCV-ZDUSSCGKSA-N 395.421 5.024 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2ccccc2OC)C2CCCC2)c1 774449244 NATUDGLPPSCDMM-HYBUGGRVSA-N 378.516 5.397 30 20 GKED C#CC[C@H](NCc1csc(-c2ccc(Br)cc2)n1)c1ccccc1 775398777 LTEKFGKECCQHGR-IBGZPJMESA-N 397.341 5.427 30 20 GKED N#Cc1cc(NCc2nnc(-c3cccc(F)c3)o2)ccc1Oc1ccccc1 777616966 MNAMXARTOZTUOR-UHFFFAOYSA-N 386.386 5.152 30 20 GKED C=CCn1c(SCc2cc3ccccc3c(Cl)n2)nnc1-c1ccoc1C 787488794 WKUCQLOWOIOJPD-UHFFFAOYSA-N 396.903 5.526 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccccc2C(F)(F)F)cn1 792857767 DXRWKTCKZGVXLA-KHPPLWFESA-N 384.357 5.067 30 20 GKED COc1ccc2cc(NCc3ccc(OC)c(OCCCC#N)c3)ccc2c1 796459033 PEHOWNALGVWUPW-UHFFFAOYSA-N 376.456 5.152 30 20 GKED O=C(c1cc(F)c(C(F)(F)F)cc1F)N(CC(F)F)c1ccc(F)cc1 808783832 JAMGHACVSDWZRZ-UHFFFAOYSA-N 383.238 5.035 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1cc(C(F)(F)F)ccn1 813215412 XZQOXJVGELDCFP-MCIONIFRSA-N 399.199 5.387 30 20 GKED CC(C)c1ccc(-c2noc([C@@H](CCCC#N)NC(=O)OC(C)(C)C)n2)cc1 818376560 RQHTYUWAKZODJI-QGZVFWFLSA-N 384.480 5.120 30 20 GKED Cc1[nH]c2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2c1C 915088422 QIXCNFAPJSQMIG-HSZRJFAPSA-N 379.463 5.693 30 20 GKED N#Cc1ccccc1NC(=S)N[C@H](c1ccccc1)c1ccc(Cl)cc1 915996937 CTOSMXSXWGCQFP-HXUWFJFHSA-N 377.900 5.288 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c2c1 916093751 XVRSOFJPDUQKEH-NSHDSACASA-N 380.469 5.060 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(-c2ccccc2)cc1 916900688 RKDOGWAMJVQSAK-QHCPKHFHSA-N 396.490 5.440 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)[C@@H](C#N)C(=O)Nc1ccccc1 916900846 XXQKUNQSXBTVIL-DAMWEWLOSA-N 386.451 5.136 30 20 GKED C[C@@]12CC3CC(C(=O)[C@H](C#N)c4nc5ccccc5n4C(F)F)(C1)C[C@](C)(C3)C2 917041474 SSTCBEWBSULUSM-RWPRUJMDSA-N 397.469 5.604 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(C(F)(F)F)c1)c1nc2cc(Cl)ccc2s1 917045411 ZFCXCNWEWOQBOC-ZDUSSCGKSA-N 394.805 5.387 30 20 GKED O=C(/C(=C\c1ccc(O)c(Cl)c1)c1nc2ccccc2s1)c1ccccc1 921262686 XHQGAURTWCBIBR-FOWTUZBSSA-N 391.879 6.079 30 20 GKED C=C(C)C[C@@H](NCc1c(Cl)cccc1Oc1c(C)ccc(C)c1C)C(=O)O 1776137504 DOLVZBJLTRZOHB-LJQANCHMSA-N 387.907 5.567 30 20 GKED C[C@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2c(O)ccc(F)c21 1776586678 MCXFOYRCOVOWLD-HTMJNSLASA-N 388.394 5.280 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)cc1 1776788939 JBNIPVIEMUSTCQ-XOVFHRFOSA-N 396.483 5.394 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1cn(-c2ccccc2)nc1C(C)(C)C 1777436393 QPUWFBDVAZUTFY-OUKQBFOZSA-N 388.467 5.073 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(F)ccc2Oc2cncc(Cl)c2)c1 1777685014 UFAWKNUYYWIERH-XQRVVYSFSA-N 397.789 5.261 30 20 GKED CC1(C)CCC(CC(=O)Nc2ccc(C3(NC(=O)CCC#N)CCC3)cc2)CC1 1790570600 VGWAJBYEWJQXAT-UHFFFAOYSA-N 395.547 5.031 30 20 GKED CCOc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 41549052 GOLZBISGJMSRJS-CYBMUJFWSA-N 390.386 5.204 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc3ccccc3n2Cc2ccccc2F)n1 48788946 ZPWPUNZCMLQSDM-KRWDZBQOSA-N 389.455 5.084 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\CCc3ccccc3C2=O)cs1 54895568 MRXBROPFSZWVMX-QGOAFFKASA-N 388.492 5.349 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2coc(-c3ccccc3)n2)cc1 55428862 LFCLQNXONCSILE-UHFFFAOYSA-N 395.418 5.187 30 20 GKED CCCCCCCCC(=O)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1 110148124 VAUZXMCZVHPRLA-UHFFFAOYSA-N 393.959 5.157 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 114619060 DBSHFJXELWGSQF-NJDAHSKKSA-N 395.487 5.338 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 159849428 OQMVSPXXFFXUGD-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CC[C@H](Cc1cccc(Br)c1)C(=O)[C@H](C#N)c1nc2ccccc2o1 172019814 FUWIVJGPWMJBDL-ZBFHGGJFSA-N 397.272 5.035 30 20 GKED CC[C@@H](C)N(CCCC(C)(C)C#N)CC(=O)Nc1ccccc1C(F)(F)F 175075678 IZFDLSUMKXMLAX-OAHLLOKOSA-N 383.458 5.074 30 20 GKED Cc1cc(CNc2ccccc2O[C@H](C)C#N)cc(C)c1OCc1ccccn1 181122340 DEZFBEBKRHVOFE-LJQANCHMSA-N 387.483 5.180 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 184019257 UZQLWBHDZLQGFR-MRXNPFEDSA-N 398.422 5.285 30 20 GKED Cc1cc2occ(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)c2cc1C 187492495 KEILVPNMYBMUGQ-SFHVURJKSA-N 397.459 5.535 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2cc(C)ccc2OC)n1 189882623 BXNDPHMHZDPIPO-UHFFFAOYSA-N 389.499 5.294 30 20 GKED C=C[C@](C)(CC)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 190427696 KYXLGJPTGBSHKZ-JOCHJYFZSA-N 384.545 5.127 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cs1 302912087 OESVRWPFIVGTNF-SDNWHVSQSA-N 392.480 5.204 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 303284785 JPEMOLJSNVOFLF-UHFFFAOYSA-N 398.434 5.160 30 20 GKED CC(C)N(C)C(=O)c1ccc(Cl)c(N=C(O)N2CCCC23CCCCC3)c1 328891956 SZNHEEVUTGJTES-UHFFFAOYSA-N 391.943 5.165 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)Nc2cccc(CSC(C)C)c2C)cc1 437887355 IGFLZEVXZCCYKQ-UHFFFAOYSA-N 397.544 5.196 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](CC(F)(F)F)c1ccccc1)c1ccccc1 438841140 OUTCFYBISRGQOY-QZTJIDSGSA-N 375.394 5.024 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1cccnc1C 439221139 BEDUFFMNCBWIMQ-UHFFFAOYSA-N 391.858 5.374 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)ccc1C(F)(F)F 440298948 SFADSTYAODDJOC-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)NCC3CCC(C#N)CC3)c2)C1 440920320 HUMARKRWEXVRHK-HXTDOEILSA-N 383.536 5.233 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)NCC2CCC(C#N)CC2)c1 441669267 MFLVVKQXKFNDDP-UHFFFAOYSA-N 385.455 5.101 30 20 GKED CC[C@H](N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccc(C#N)cc1 447581258 SPRAQKBCPLDKBQ-BTYIYWSLSA-N 391.540 5.801 30 20 GKED N#CCCC[C@H](NC(=O)N1CC=C(c2ccc(Cl)cc2)CC1)c1ccccc1 458797037 FQMZFKJENHGCPE-QFIPXVFZSA-N 393.918 5.574 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCCCCc3ccccc32)o1 460500852 DGXVUAZBYKASIJ-UHFFFAOYSA-N 386.451 5.103 30 20 GKED Cc1ccc(CC[C@@H](C)NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)o1 460534746 SQJJESDBJXUTIT-OAHLLOKOSA-N 392.430 5.142 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc3c(cn2)CCCC3)cc1 462984194 AWESQVDADVPMPS-UHFFFAOYSA-N 399.519 5.377 30 20 GKED Cc1ccc(-c2cnc(CNc3cccc(Oc4ccc(C#N)cc4)c3)o2)cc1 467267734 GUACGHUKKKITPO-UHFFFAOYSA-N 381.435 5.926 30 20 GKED C=CCC(CC=C)C(=O)N(Cc1cccnc1)c1ccc(Br)cc1 468684872 XDATXYHCENZJPS-UHFFFAOYSA-N 385.305 5.146 30 20 GKED C[C@H](Sc1ccccc1C#N)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471250024 KYVLHJTVTBRUKK-JTQLQIEISA-N 376.268 5.768 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 477755313 PCTINKZCBBQXDN-BLVKFPJESA-N 380.385 5.263 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCC[C@@H](C)C2)cc1 480644752 JAABTYZUQFFRER-MRXNPFEDSA-N 379.460 5.013 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1cccc(OCc2cscn2)c1 482000341 JTDQLJREKOALSM-QFIPXVFZSA-N 375.497 5.473 30 20 GKED O=[N+]([O-])c1cc(CNCc2cc(F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1 487182822 VCSGUQKNGHBACA-UHFFFAOYSA-N 396.262 5.061 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)c1C#N 487945792 AYHWKWAIJWBEPE-UHFFFAOYSA-N 393.512 5.034 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CCC)c1ccccc1 489653365 SNGLDENNLVOPKF-NRFANRHFSA-N 376.500 5.064 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ncccc3-c3ccccc3)cc2)nc1 504541318 ZKOAWIJVWYWBIV-UHFFFAOYSA-N 392.418 5.060 30 20 GKED Cc1ccc(O[C@H](C)C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 511065996 URTWXSORXBZIRU-OAHLLOKOSA-N 388.492 5.100 30 20 GKED CC(C)[C@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 513709644 JMCRJRSCGGCNTR-PGRDOPGGSA-N 378.472 5.130 30 20 GKED Cc1nc(-c2ccc(NC(=O)[C@@H](Oc3ccccc3C#N)C(C)C)cc2)cs1 516464988 ICGDUOAEBKUETQ-NRFANRHFSA-N 391.496 5.032 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-n4cccc4)cc3)n2)cc1 516714155 REZFCDBEKKDAHU-HXUWFJFHSA-N 399.475 5.099 30 20 GKED Cc1ccsc1CN(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 517196683 FKLGLCGXQNBIGZ-KRWDZBQOSA-N 389.524 5.498 30 20 GKED N#C[C@H](NC(=O)c1ccc(F)c(C(F)(F)F)c1)c1c(Cl)cccc1Cl 517343637 KIVJHPMGQQWVGY-ZDUSSCGKSA-N 391.151 5.146 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2cccc(F)c2F)CC1)c1ccccc1 519099610 HEHOLNKHIOFDLN-NRFANRHFSA-N 397.469 5.289 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 520941367 LMRQSEOYPPBPEK-QAPCUYQASA-N 397.544 5.818 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c[nH]cc3-c3ccccc3)c2)cc1 521490803 BNXXMBXJQFOSBE-UHFFFAOYSA-N 379.419 5.598 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(F)cc2)CCCCC1 521733283 DIUWPPNRUMXROM-KRWDZBQOSA-N 396.531 5.918 30 20 GKED N#Cc1c(NC(=O)C[C@H]2CCOc3ccccc32)sc2c1CCCCCC2 522748013 KJCKVQLYSSDEBA-OAHLLOKOSA-N 380.513 5.174 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3nc4c(s3)CCCC4)cc2)cc1 523483495 MKMJKJXAYAJWQL-UHFFFAOYSA-N 389.480 5.133 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3csc(-c4ccc(Cl)s4)n3)[nH]c12 524033342 RKBVWZKWFVQIKP-JTQLQIEISA-N 398.900 5.200 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524417282 UGNZABUVCSXDHF-QFIPXVFZSA-N 386.451 5.016 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)Nc1ccccc1SC[C@@H](C)C#N 524565783 IVGOPPCOPOKKJY-KBXCAEBGSA-N 397.544 5.675 30 20 GKED N#CC[C@H](CC(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccccc1 530421722 WPJSIDIEOPUFMS-XMMPIXPASA-N 382.507 5.044 30 20 GKED COc1ccc(CN[C@H](c2cccc(C)c2)C(C)(C)C)cc1OCCCC#N 530686694 NPZKJPZHWVJDRS-HSZRJFAPSA-N 380.532 5.563 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1nc2ccccc2n1C(C)C)c1ccccc1 536205851 YMSUQRVHGINERZ-WMZHIEFXSA-N 387.527 5.641 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 540233399 BKYMFLXGSITKOB-UHFFFAOYSA-N 376.378 5.144 30 20 GKED CC(C)n1ncc2cc(CN[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)cnc21 542948332 XJUYQTFMMMHMQK-GOSISDBHSA-N 395.510 5.402 30 20 GKED CSc1ccc(Cl)cc1NCc1cn(CCC#N)nc1-c1ccccc1 552554499 HIVLPUIKKLDJRK-UHFFFAOYSA-N 382.920 5.451 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@H](C)c1ccccc1)c1ccc(C#N)cc1 557490755 RGMYYCVKJZMJHT-ZWKOTPCHSA-N 385.467 5.581 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C(C)(C)c1cccc(Cl)c1F 557608907 KAQMEEWLDSPRDI-UHFFFAOYSA-N 391.918 5.139 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2ccn(CCC)c2c1 558371397 SHYIOQDOXYOSSP-UHFFFAOYSA-N 393.535 5.439 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cc2ccccc2o1 558504374 FWTBMQFROGDHCQ-OAHLLOKOSA-N 398.422 5.374 30 20 GKED C[C@H](CCOCc1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 569018742 OMCHCSOTPCPWLS-QZTJIDSGSA-N 397.544 5.198 30 20 GKED C=C(C)Cn1c(-c2cccc3ccccc23)nnc1N1CCC(OC(C)C)CC1 574774920 UFUDLDYMPFJLML-UHFFFAOYSA-N 390.531 5.068 30 20 GKED Cc1cc(-c2ncco2)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 580499952 TYSCCOLFZMTYTN-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccccc2)Cc2ccco2)c1 589740315 QGZSLACCPFVIFC-UHFFFAOYSA-N 376.456 5.469 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591842666 YTPIFYLSBTYYGY-UHFFFAOYSA-N 394.290 5.283 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2CC1(c1ccccc1)C2 596733996 MTTOHICPCJVXTH-CSZIGFGKSA-N 377.513 5.091 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCCc3c[nH]c4ccccc34)cn2)c1 603622221 OOGHYMMZFCSOFA-UHFFFAOYSA-N 396.450 5.188 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(N(C)c3ccccc3)cc2)cc1 604068334 FBQDGOBWQRXZID-UHFFFAOYSA-N 386.499 5.374 30 20 GKED CCCN(C(=O)c1ccc(Br)cc1)c1cc(Cl)ccc1C#N 609286224 OHXLEIOVALCNIM-UHFFFAOYSA-N 377.669 5.031 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 609422054 FRYYJZBEPNFTTQ-QGZVFWFLSA-N 377.488 5.178 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 609433712 CTTZKTUYUCQCBL-HXUWFJFHSA-N 397.478 5.680 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 609436612 PMXRGJCHBXOEDS-QGZVFWFLSA-N 397.544 5.534 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1OC(F)F 609636190 ATRZELWXJKVTFY-CYBMUJFWSA-N 391.443 5.635 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)c3ccc(C#N)nc3)nc2c1C 609640387 FVAGWYVWZCWOMT-UHFFFAOYSA-N 398.491 5.027 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3cccc(OC(F)F)c3)c2)cc1 609991194 JKFMLRORAJBPQT-UHFFFAOYSA-N 379.366 5.156 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)C1(C#N)CCCCC1 610155911 AJFSPQOHIXUBPB-UHFFFAOYSA-N 390.462 5.100 30 20 GKED N#Cc1ccc(S[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c(F)c1 610165672 AHYHLDXSFLXTLI-FQEVSTJZSA-N 380.419 5.309 30 20 GKED CCC(=O)Nc1ccc(C)c(NCc2cccc(OCc3ccccc3C#N)c2)c1 610909623 DAELZQHMYJZXDE-UHFFFAOYSA-N 399.494 5.406 30 20 GKED COc1cccc([C@@H](C)c2noc(/C=C/c3cn(CCC#N)c4ccccc34)n2)c1 612917852 QYZXUEDGLGQFOG-FMQWLBJXSA-N 398.466 5.269 30 20 GKED C=CCn1c(SCCOc2c(Cl)cccc2Cl)nnc1-c1ccco1 670476946 QPHLPODVSRJCQU-UHFFFAOYSA-N 396.299 5.202 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@H](C#N)c1ccc2ccccc2n1 684629882 JJPCFQFMMQHBNI-QGZVFWFLSA-N 387.826 5.342 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1C 726081112 JVFNIYCQCKIJFG-UHFFFAOYSA-N 398.572 6.114 30 20 GKED C#CCN(Cc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1)C1CCCCC1 726184311 ASDGGMGYWYYWTL-UHFFFAOYSA-N 395.572 5.212 30 20 GKED C=CCn1c(SCc2ccc(OC(C)C)cc2)nnc1-c1ccccc1OC 726430470 TVTIIFWYOMRZOX-UHFFFAOYSA-N 395.528 5.219 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c(OCC(F)(F)F)c1 726474734 HYGKUXKMUJZLIU-UHFFFAOYSA-N 399.825 5.270 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1 736005900 ISCVWWXDPBRDQG-UHFFFAOYSA-N 395.418 5.187 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(SC)c(F)c3)cs2)cc1 741846455 GGMXIMCNQFTTKT-TWGQIWQCSA-N 385.485 5.576 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=S)Nc1ccc(C#N)c(Cl)c1 741876645 QDQUWVDJKSVAHN-IBGZPJMESA-N 385.964 5.560 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Nc2ccc(OC3CCCC3)cc2)cc1 743465222 GWLWFDHOMUSAST-IBGZPJMESA-N 391.515 5.064 30 20 GKED N#CCC1(COC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CC1 744279569 RWLVJQNEHKBNRM-UHFFFAOYSA-N 376.431 5.144 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)n1 747197945 PDWNMBDJZPKVFT-QLFBSQMISA-N 379.312 5.553 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1cc(Cl)ccc1OC(F)F 753144697 QUETUNGUHCLIRM-NSCUHMNNSA-N 392.814 5.356 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 756242592 HBOVBDMIGNGYRU-YWZLYKJASA-N 385.492 5.685 30 20 GKED C=CCC[C@H](NCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)O 756379205 KYZJQPYWLDFOBR-IBGZPJMESA-N 394.298 5.081 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CN[C@@H](C)c1ccc(C#N)cc1 775914033 RCJARVQSSVUSQI-KRWDZBQOSA-N 392.934 5.431 30 20 GKED CCCn1nc(C)c(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1C 779595709 LVSFCCNNYQIKQK-UHFFFAOYSA-N 392.478 5.112 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 779989749 ZFLLYTXJIAOOQM-NSHDSACASA-N 388.311 5.627 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1 787647358 OCCHKEPZKHNVCU-UHFFFAOYSA-N 397.406 5.020 30 20 GKED CC(C)C[C@H](NCc1ccc(OCC#N)cc1)c1cccc(Br)c1 794811660 TWBGFIGKZOIZFU-FQEVSTJZSA-N 387.321 5.228 30 20 GKED CN1CCC[C@H](COC(=O)CCCCCC#N)[C@H]1c1ccc(C(F)(F)F)cc1 805886001 XLQVBVACDRBCCB-YLJYHZDGSA-N 396.453 5.106 30 20 GKED COCCOCc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc1 809153700 CBHGBTDEXWGRIJ-IZZDOVSWSA-N 378.440 5.060 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 812009878 DNKZLWOQMCSUHY-IEBWSBKVSA-N 390.572 5.570 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)OC(=O)CCCC#N 813071859 YOUNKSVVTBTNPJ-GFCCVEGCSA-N 393.306 5.179 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 915862689 NZUQJAWIQJRTIX-FQEVSTJZSA-N 397.390 5.249 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1sc2ccccc2c1Cl 916881091 NNXRKXBZZAVKGG-CYBMUJFWSA-N 389.263 5.169 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 917042398 BIWWDNQRXLIJIB-OAHLLOKOSA-N 388.414 5.514 30 20 GKED Cc1ccc(C(=O)/C=C\c2c(C)nn(-c3ccc(Br)cc3)c2C)o1 917144060 XSRFSAZXGVQCEH-KTKRTIGZSA-N 385.261 5.049 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCOc2cccc(F)c2)cc1 918322552 FNNYWRJQRVDTDS-QHCPKHFHSA-N 388.442 5.279 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(Cl)cc3)n2)cc1 920143608 SJOMFRCVYOAROE-GOSISDBHSA-N 396.899 5.281 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1nc(C(F)F)cc1C(F)F 935606801 UZIOOPNTUCJACA-UHFFFAOYSA-N 383.389 5.249 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(OCC(C)C)cc2)c2cc(C(=O)O)oc12 1776126448 MDXWBNOXUKAESZ-UXBLZVDNSA-N 394.423 5.071 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)cc1)c1ccccc1 1776469440 RJVMBOFEZFBFMK-VCHSTOLQSA-N 390.410 5.560 30 20 GKED C[C@H]1/C(=C\c2c[nH]c3ccc(C(=O)O)cc23)C(=O)c2cccc(Br)c21 1776586500 AADCPPDTSGIUHZ-CEITULEQSA-N 396.240 5.012 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cn(-c2ccc(Cl)cc2)nc1C 1776787159 XCYPLGIBZWOBAN-LJQANCHMSA-N 391.943 5.128 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCCC[C@@H]2CC(=O)O)cc1 1776787551 WEFJKRUDRDGGGQ-GOSISDBHSA-N 377.550 5.219 30 20 GKED CCSc1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)cc1 1776950944 URVQDMQQYDUTPD-BAQGIRSFSA-N 391.286 5.155 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3ccccc3s2)c2cc(C(=O)O)oc12 1777360768 MOMFUBWKWRVSMT-SOFGYWHQSA-N 378.405 5.250 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1 1777472283 GMNWRIGTRGNYMD-NTEUORMPSA-N 386.447 5.477 30 20 GKED CCCN/C(S)=C(/C(=O)c1ccc(C)cc1)[n+]1ccc(C(CC)CC)cc1 22804524 MZRALJARFZLXQT-UHFFFAOYSA-O 383.581 5.125 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cccc(F)c2)cs1 54895237 FJIWDZJLALPDKP-YFHOEESVSA-N 384.407 5.002 30 20 GKED C=C(C)COc1cc(/C=C(/C#N)C(=O)c2c(C)[nH]c3ccccc23)ccc1OC 60790229 YFIXNFHMVVWCIX-WQRHYEAKSA-N 386.451 5.230 30 20 GKED CN(CCCCCc1cc(-c2cccc(F)c2)no1)Cc1cccc(C#N)c1 63763718 LJGUPIVAROLQFR-UHFFFAOYSA-N 377.463 5.197 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccccc2)CC1 66954077 TXMWWVXRXDGFHL-KRWDZBQOSA-N 379.529 5.492 30 20 GKED N#Cc1ccc(CC(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)cc1 103235265 VGAVSSIVNGYRSO-UHFFFAOYSA-N 388.279 5.170 30 20 GKED COc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 103330551 PWQWDQJQTLPSIN-CRAIPNDOSA-N 376.481 5.189 30 20 GKED N#CC1CCN(C(=O)[C@@H](Sc2ccc(F)c(Cl)c2)c2ccccc2)CC1 106758595 LURHDXDCPXLERM-IBGZPJMESA-N 388.895 5.075 30 20 GKED COc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1OCC(C)C 108325077 PGVPVXPWVVNEKF-MRXNPFEDSA-N 398.528 5.234 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1Cl 108532515 WVXYWMOWGFLMIX-KXBFYZLASA-N 399.947 5.961 30 20 GKED CCc1nc2cc(NC(=O)c3cccc(OCc4ccccc4C#N)c3)ccc2o1 108826473 XCYSAYGLITXHCA-UHFFFAOYSA-N 397.434 5.093 30 20 GKED CC(C)N(CCC#N)C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 116663837 XGXMCGHLQXGZRR-UHFFFAOYSA-N 376.378 5.262 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(Cl)c1F 130710949 ABEWOXAOGVPYKL-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1 153193089 HVSMRMPMXXYQJK-HXUWFJFHSA-N 391.858 5.302 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(NC(=O)C(C)C)cc1 154168277 MTBILYCDAIVHBH-UHFFFAOYSA-N 391.924 5.216 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cccc(F)c1F 161576724 NZSKPLLHNNYMEO-QWHCGFSZSA-N 375.444 5.242 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)c1ncc(C(C)(C)C)o1 177249515 CAZYNVQTZABHDI-OAHLLOKOSA-N 382.533 5.194 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(OCc3cccc(C#N)c3)cc2)cc1 181430287 RHUFTARPEZNJDC-GOSISDBHSA-N 383.451 5.040 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1OC(F)F 181575287 BLKPCRXQZGIVRI-GUYCJALGSA-N 396.384 5.585 30 20 GKED C=C(C)[C@H](N[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 187786341 YZLHUYKJJBUYOS-XIKOKIGWSA-N 398.375 5.218 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1ccc(Cl)c([N+](=O)[O-])c1 206944835 LLVUFYYSOLBMGC-NTMALXAHSA-N 394.814 5.118 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1ccc2c(c1)Nc1ccccc1S2 253947087 MHGPTWIKWPWDAJ-UHFFFAOYSA-N 375.453 5.429 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2cnc(C3CCCC3)s2)SC1=S 254984399 RVVVXTYABCCCTF-CXUHLZMHSA-N 397.550 5.078 30 20 GKED OC(CN1CCC(/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1)=Nc1ccccc1 329009572 OEKHRUNIOARFTO-YUXAGFNASA-N 397.563 5.302 30 20 GKED CCO[C@H](C)c1ncc(/C(O)=N/[C@@H]2CC3(CCCC3)Oc3ccccc32)s1 330172542 XZPVYDRJVWITMF-GDBMZVCRSA-N 386.517 5.382 30 20 GKED N#Cc1ccc(NC(=O)N2CCc3cc(Cl)cc(Cl)c3C2)c(Cl)c1 426148225 HMRCKHWPAZJJGS-UHFFFAOYSA-N 380.662 5.109 30 20 GKED Cc1cnc([C@H](C)NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 427070161 RPZSEWARHSADDQ-ZDUSSCGKSA-N 397.887 5.260 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1)c1ccccc1 431773036 NOTGVUAJGBUSED-LEWJYISDSA-N 381.907 5.525 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432961454 SAGCSDRUVYGJOJ-SFHVURJKSA-N 385.895 5.684 30 20 GKED N#CC(CCSc1nncc2ccccc12)(c1ccccc1)c1ccccc1 434642646 KQBMTNUKNAOKMX-UHFFFAOYSA-N 381.504 5.622 30 20 GKED C=CC[C@H]1N(C(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)CCCC1(C)C 443868223 MYDSTBOULBATQA-HXUWFJFHSA-N 380.536 5.097 30 20 GKED Cc1cc(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)ccc1C#N 443993337 LEIXERNWVHAIJW-UHFFFAOYSA-N 387.430 5.299 30 20 GKED FC(F)Oc1ccc(-c2nnc(SCC#Cc3cccc(Cl)c3)o2)cc1 448106753 GNNYROWZYPITOR-UHFFFAOYSA-N 392.814 5.135 30 20 GKED C[C@@H](c1ccc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cc1)C(F)(F)F 453564362 GWIXDSDHVGJAFG-HZMBPMFUSA-N 386.295 5.256 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)CCCCOc2cccc(C#N)c2)cc1 464049868 LVURLLNQMQRIRF-ZEQRLZLVSA-N 390.527 5.211 30 20 GKED Cc1cccc([C@H]2CCCCN2C(=O)CSCc2ccc(C#N)cc2)c1C 464586398 IUJJWXYTQKCTRC-JOCHJYFZSA-N 378.541 5.162 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)cc1F 469120104 WDOOCVWHMWZTRY-FQEVSTJZSA-N 383.442 5.111 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCN1c2ccccc2CC[C@@H]1C 469317673 OLLLOOKHNUCGET-ROUUACIJSA-N 393.556 5.108 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1ccccc1)c1nccs1 471811944 PQLQJBBEKXSYAK-FQEVSTJZSA-N 377.513 5.020 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccccc1 474410759 IKTOWIQMLHFMGD-GOSISDBHSA-N 376.456 5.144 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(COC(C)(C)C)c1C 475972722 FDRGWSBFFBTTFW-UHFFFAOYSA-N 380.532 5.573 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)nc2c1cnn2[C@H](C)CC 476082620 YVVGCCWQBNYBDK-QGZVFWFLSA-N 390.531 5.815 30 20 GKED Cc1cc(F)ccc1N(Cc1ccco1)C(=O)C[C@@H](CC#N)c1ccccc1 483287253 RSJODEZOKWALIP-LJQANCHMSA-N 376.431 5.348 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(COc2cc(Cl)cc(C#N)c2)cs1 487364680 YXPMBZNVVBJRIU-UHFFFAOYSA-N 397.887 5.240 30 20 GKED C[C@@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 487455065 LYDJTGOBIYEYTR-AUUYWEPGSA-N 375.299 5.648 30 20 GKED CCN(Cc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1)C(C)C 487469163 FVXHNKZOBWWIOY-QHCPKHFHSA-N 377.532 5.082 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1cc2c(ccc3ccccc32)o1)c1ccccc1 487592779 JVOALCLNWCPQIZ-HSZRJFAPSA-N 382.463 5.680 30 20 GKED C=CCC[C@H](C(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 490200722 IWDJCDXCEXKYDL-VABKMULXSA-N 381.491 5.254 30 20 GKED CCN(C(=O)c1ccc(C#N)c(C)n1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496535515 NDFZBMVWVCDKFW-XMMPIXPASA-N 398.510 5.032 30 20 GKED COc1ccccc1[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccccc1Cl 498155685 DMHPERNQZURPGL-FQEVSTJZSA-N 399.922 5.067 30 20 GKED N#C[C@H](NC(=O)CCCOc1cccc(Cl)c1Cl)c1ccccc1Cl 499973618 PBBXFHVSHIIDJD-HNNXBMFYSA-N 397.689 5.187 30 20 GKED N#Cc1cc(F)c(NCC2(c3cccc(C(F)(F)F)c3)CCOCC2)c(F)c1 500551447 GREXISZSWWVKCP-UHFFFAOYSA-N 396.359 5.016 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(C)n(C2CC2)c1C 500732563 LEOYAKRNDUVWNT-UHFFFAOYSA-N 385.467 5.665 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 501814205 RQRUQHLGCAJYDH-LBPRGKRZSA-N 381.259 5.100 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)cc1 503874326 NQDPZZLQUSDLPW-OALUTQOASA-N 397.305 5.284 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 505022114 AKWYQCZOUJIHHE-IFMALSPDSA-N 382.479 5.328 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 505022115 AKWYQCZOUJIHHE-IRLDBZIGSA-N 382.479 5.328 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(OCC(C)C)c(OC)c1 505254708 NHASFPISKZBOJN-IBGZPJMESA-N 396.531 5.189 30 20 GKED N#CCCN(Cc1cccnc1)Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 505843105 UZJXAZHHPJBZHW-UHFFFAOYSA-N 385.389 5.276 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccccc1C#N 508089796 UUADEPLEWVPDRF-UHFFFAOYSA-N 387.826 5.152 30 20 GKED C[C@H]1CCC[C@@H](N(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 509920362 RMPOZJPQEYEZPC-PGRDOPGGSA-N 391.515 5.374 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)NCC(C)(C)CCC#N)cc2c1 513118899 QSQKSSFZMRSTFW-UHFFFAOYSA-N 393.487 5.376 30 20 GKED C[C@H](NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 513808089 NEWBNTWJCACYNP-ZDUSSCGKSA-N 389.282 5.095 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2OC2CCCC2)c1 517655185 ZAAVOERLLSDKFN-UHFFFAOYSA-N 378.472 5.067 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)CCc2ccc3ccccc3c2)c1C 523529862 QGPIMUBZYUTGHM-UHFFFAOYSA-N 394.478 5.085 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)o2)cc1 535254509 IZRJKMYNPRIINU-UHFFFAOYSA-N 392.480 5.632 30 20 GKED CC(C)Cn1ncc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C(F)F 536374208 JWNPVXNWPSFLEU-UHFFFAOYSA-N 394.425 5.268 30 20 GKED N#Cc1ccc(CN2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)s1 537646395 BLSFRDKAPJEDHT-UHFFFAOYSA-N 381.328 5.108 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 537947540 YFYWPKDWFWEXML-KKSFZXQISA-N 380.438 6.137 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@@H](CC3CCCCC3)c3ccccc3)o2)c1 539262918 ORHZFBBMODSHOD-QFIPXVFZSA-N 386.499 5.410 30 20 GKED CC(C)(C)Cc1csc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)n1 539534312 VJUNJJQNQYBPQK-UHFFFAOYSA-N 392.484 5.043 30 20 GKED CC[C@@H](C)n1nc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1C 539761201 MEFMXRCGJPSCEL-CQSZACIVSA-N 392.434 5.218 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(C)(C#N)CC2)cc1 540949770 PVYMEVRBVGLPQF-KRWDZBQOSA-N 379.529 5.697 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1Cl 543653005 QRGFTZIZAIYSKQ-DOTOQJQBSA-N 389.833 5.581 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1ccc(C(C)C)nc1C 549056675 OYOSAYDGPDPZCH-UHFFFAOYSA-N 394.544 5.162 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2ccccc2OC)c1 554246329 TVZVBSDDUXDITE-UHFFFAOYSA-N 399.494 5.678 30 20 GKED C=CCC(C)(C)c1noc([C@@H](CCOC)Cc2cccc(Br)c2)n1 560008378 MNQBFLASFJZMFR-HNNXBMFYSA-N 393.325 5.049 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccc(COCc4ccccc4)cc3)CC2)cc1 560549593 OADMVAHQDVSVAA-UHFFFAOYSA-N 397.522 5.356 30 20 GKED N#Cc1nc(N2CCC([C@@H](F)c3ccccc3F)CC2)ccc1C(F)(F)F 561360499 VCVJWWIVUUPXEX-GOSISDBHSA-N 381.348 5.038 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccnc1C(F)(F)F 568133901 KHRDZQQOSWPROU-UHFFFAOYSA-N 375.803 5.035 30 20 GKED Cc1cccc(O[C@@H](C)c2nnc(N3CCC(CCC#N)CC3)n2C(C)C)c1C 571164995 MFQBUKMTWIOLAJ-IBGZPJMESA-N 395.551 5.136 30 20 GKED C=CCn1c(C2CCCC2)nnc1N1CCC[C@@H]1c1nc2ccccc2s1 576620014 KEAXNOIYHGBKBE-QGZVFWFLSA-N 379.533 5.073 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CC2(C(F)(F)F)CC2)cc1F 577428264 YTGOMAJKAFOHGA-UHFFFAOYSA-N 378.325 5.161 30 20 GKED CCCCN(Cc1ccccc1Cl)C(=O)c1cnc(C(F)(F)F)c(C#N)c1 590204716 YXZWTTBBKPEDOC-UHFFFAOYSA-N 395.812 5.068 30 20 GKED CC[C@H](C)c1nc(C)c(CC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)n1 593973523 CSWVZYLLACOLMN-CABCVRRESA-N 396.560 5.040 30 20 GKED CCN(C(=O)CC1(C#N)CCCCC1)[C@H](c1cccnc1)c1ccc(F)cc1F 597216865 JCKGGRLXZDSBPK-JOCHJYFZSA-N 397.469 5.162 30 20 GKED CCN(C(=O)c1oc2ccccc2c1CSC)[C@H](C)c1ccc(C#N)cc1 603530502 QQRVPSQRSKISTH-OAHLLOKOSA-N 378.497 5.391 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccc(Br)cc1 603967983 DDQXSJXJISRZTR-UHFFFAOYSA-N 397.297 5.230 30 20 GKED N#C[C@@H](C(=O)c1cc(Oc2ccccc2)ccn1)c1nc2cc(F)ccc2s1 608752441 HTQDGSAXMWXVKM-INIZCTEOSA-N 389.411 5.113 30 20 GKED Cc1ccc(C)c(CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 609058517 ZHTXYBIZUYJWIM-UHFFFAOYSA-N 384.479 5.130 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1csc(-c2ccc(Cl)s2)n1 609189537 XKZTUCWELWZWCW-UHFFFAOYSA-N 381.954 5.317 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)Nc1ccccc1SC[C@H](C)C#N 609401915 JYMLTCTUGHOKRM-AEFFLSMTSA-N 397.544 5.610 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCCCOC3CCCCC3)cc2)c1 609433983 USDLPGTVMUWCNU-UHFFFAOYSA-N 393.487 5.211 30 20 GKED C[C@H](Sc1ccc(Cl)cc1C#N)C(=O)Nc1ncc(Cl)cc1Cl 610654697 BCYZOHFYZUMTAF-QMMMGPOBSA-N 386.691 5.033 30 20 GKED N#Cc1cc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1C(F)(F)F 613272380 QATUCMBUYRVSLA-AOOOYVTPSA-N 390.249 5.144 30 20 GKED CC(C)(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 619125440 QJCXNTCSEUCKII-UHFFFAOYSA-N 387.339 5.273 30 20 GKED N#Cc1nc(Oc2ccc3ccc(C(F)(F)F)nc3c2)ccc1C(F)(F)F 619694892 WHYJCEOABVPMNX-UHFFFAOYSA-N 383.251 5.331 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 674894685 MEAUQCMCTVWBDI-LBPRGKRZSA-N 382.313 5.083 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC(CC(F)(F)F)C1 675357369 NXXJNQWRKNJJNK-UHFFFAOYSA-N 394.237 5.140 30 20 GKED N#Cc1ccc(NC(=S)N2CCC(c3c[nH]c4ccccc34)CC2)cc1Cl 726450115 CPLQBLKHEIDUBD-UHFFFAOYSA-N 394.931 5.269 30 20 GKED CCOc1cc(/C=C2/CCc3sccc3C2=O)ccc1OCC(F)(F)F 726893845 SSQSBROSBWNAIM-LCYFTJDESA-N 382.403 5.300 30 20 GKED CCOc1cc(/C=C2\CCc3sccc3C2=O)ccc1OCC(F)(F)F 726893849 SSQSBROSBWNAIM-UKTHLTGXSA-N 382.403 5.300 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCOc2cccc(Cl)c2Cl)cc1 726939987 APSBPQNGRSGJAS-UHFFFAOYSA-N 377.271 5.018 30 20 GKED Cc1ccc(-c2nc(CON=Cc3cccc(OCc4ccncc4)c3)co2)cc1 727434153 IPBNVYOJNGRBBN-UHFFFAOYSA-N 399.450 5.175 30 20 GKED CCC1CCC(N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 728738564 QYCJEWKWBLCOFO-UWFXLKAESA-N 375.516 5.775 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1c(Cl)cccc1Cl 730416656 HAVTXXDQANRHOI-GXSJLCMTSA-N 393.270 5.722 30 20 GKED N#C[C@H](C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1nc2cc(F)ccc2s1 730416860 JAMDIXQWVIBAIE-ZIAGYGMSSA-N 392.377 5.348 30 20 GKED N#C[C@H](C(=O)Cc1coc2cc3c(cc12)CCC3)c1nc2cc(F)ccc2s1 730421510 LKSPCBMGMYPOHH-QGZVFWFLSA-N 390.439 5.089 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(F)(F)c1cccc(Cl)c1 730990548 ZIKSVVXAXQFDQI-LBPRGKRZSA-N 380.847 5.322 30 20 GKED CC(C)N(C(=S)Nc1ccc(OC(F)F)c(Cl)c1)c1cccc(C#N)c1 735628196 NGVLKHWVSLKDNJ-UHFFFAOYSA-N 395.862 5.425 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)OC(=O)c1cccc(CC#N)c1 739590857 DXPAHEGPQMWRAY-INIZCTEOSA-N 376.481 5.026 30 20 GKED CC(C)c1ccc(/C=C\C(=O)c2ccc(S(=O)(=O)CC(F)(F)F)cc2)cc1 741843159 NUQUPLFNGKOMQX-XGICHPGQSA-N 396.430 5.042 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(OC3CCC3)cc2)cc1 744033107 MVXVKDRDBCRVMF-ZHRRBRCNSA-N 390.483 5.093 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1c(C)nn(-c2ccccc2)c1C 746483872 BIBRWKSHXOFSIP-UHFFFAOYSA-N 389.890 5.527 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C/C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 747003248 FTRKYPSHWAWXJP-CSKARUKUSA-N 399.809 5.086 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COc2ccc3oc4c(c3c2)CCCC4)n1 747194279 VZUUOYXQSFRKNE-KRWDZBQOSA-N 394.496 5.147 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)n1 747198862 MGCSGVUSMFYNGK-HNNXBMFYSA-N 385.489 5.104 30 20 GKED CCc1c(-c2csc(NN=Cc3ccccc3Cl)n2)[nH]c(C)c1C(C)=O 749263605 VOXYIFLIQKXONF-UHFFFAOYSA-N 386.908 5.311 30 20 GKED CCSc1ccc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 752480423 BNWVVRGTXYBZGS-OAHLLOKOSA-N 386.929 5.481 30 20 GKED C#Cc1cccc(NC(=O)N(C)[C@H](C)c2sc(-c3ccccc3)nc2C)c1 759504365 XBYXTFJPNDNJSX-MRXNPFEDSA-N 375.497 5.325 30 20 GKED COc1ccc(C(=O)/C=C\c2cnc(C3CCC3)s2)cc1Br 760263627 ORWBPMMTZUAHGN-SREVYHEPSA-N 378.291 5.078 30 20 GKED COc1ccc(C(C)(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 764841556 VSOXZAXJJUWCPG-HSZRJFAPSA-N 384.479 5.267 30 20 GKED Cc1cc(NCc2cccc(OCCCC#N)c2)ccc1OCC(F)(F)F 770578930 NFXMKGCPFXYWED-UHFFFAOYSA-N 378.394 5.231 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@H](Cc1ccccc1)c1ccccc1 780165018 PCSKJGOMVWGILQ-UGKGYDQZSA-N 384.479 5.333 30 20 GKED C#CCCCCCC(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 780258134 HWLRQBWRAQSPJT-UHFFFAOYSA-N 398.528 5.071 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1ccc(Cl)c(Cl)c1 782245011 GGCSNFAFPLKUAM-UHFFFAOYSA-N 395.340 5.048 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2cc(F)ccc2F)C(C)C)ccc1OC 794808793 CLICFVMSLATIJK-JTSKRJEESA-N 388.458 5.141 30 20 GKED CC(=O)Nc1ccc(C(C)=NOCc2nc(-c3ccc(C)cc3)cs2)cc1 795204556 XTHSUAKNTDPAJW-UHFFFAOYSA-N 379.485 5.018 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cscc2Br)cc1 795205902 RMKDXLVTGBWWNE-INIZCTEOSA-N 397.297 5.418 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nc2ccccc2n1C(F)F 795981821 FHSSUPCRXQXMFD-ZBFHGGJFSA-N 383.398 5.123 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)cs1 797156135 AOHPGGYQYAECPE-KTKRTIGZSA-N 382.510 5.141 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccc(OC(F)(F)F)c(C#N)c2)c(Cl)c1 799512339 LXSALOZKXBPFGL-UHFFFAOYSA-N 399.825 5.536 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(Cl)sc3[nH]2)cc1 810532368 SMBLQCVHQGFOPP-OAHLLOKOSA-N 399.903 5.187 30 20 GKED C=CCOc1ccc(CNc2cc(C(=O)N3CCCCC3)ccc2Cl)cc1 864003727 XDRJQKURRAEETB-UHFFFAOYSA-N 384.907 5.143 30 20 GKED C=CCC1(O)CCN(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)CC1 887739833 FXXLZAMVRLZFDS-LJQANCHMSA-N 394.515 5.070 30 20 GKED N#Cc1ccccc1NC(=S)N[C@H](c1ccc(Cl)cc1)c1cccs1 916025014 YULQNLNIAZKCIM-GOSISDBHSA-N 383.929 5.349 30 20 GKED Cc1c(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2)oc2ccc(Cl)cc12 916882754 JWRMVDPVJXAYQU-HNNXBMFYSA-N 387.222 5.009 30 20 GKED Cc1cc(C)c(/C=C/C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1C 916918111 MBNFFPMOECPYSC-VDZCTEQFSA-N 382.463 5.126 30 20 GKED CCCc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[nH]c(C)c1C(C)=O 917119861 YOBKYAGETZXAGH-QFIPXVFZSA-N 399.494 5.386 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CSc1ccc(C(C)C)cc1 920105527 HMLYDYNUGRSMFT-LJQANCHMSA-N 390.508 5.284 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(C(F)(F)F)cc3)cc2)c1 1776052152 LCSUZBLMKALDKM-UHFFFAOYSA-N 398.384 5.446 30 20 GKED CC(=NNc1ccc(C(=O)O)nc1)c1ccc(Oc2ccc(Cl)cc2)cc1 1776071763 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102737367 HFLWMPVTHRCADN-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Oc2ccncc2)c1 112637743 MYMRMOHYFBGBNC-MRXNPFEDSA-N 389.480 5.520 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccccc3SC[C@H](C)C#N)o2)cc1C 123565102 JQFHJWPCGDBSRQ-RHSMWYFYSA-N 392.528 5.778 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ncc(-c4cccs4)o3)o2)cc1 126340990 WYTBOCKVYJYDGQ-UHFFFAOYSA-N 397.481 5.310 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 151062143 QDLQYGJTYFWEKR-IEBWSBKVSA-N 394.544 5.189 30 20 GKED C[C@@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 177731137 WPARLZWWGKQOJC-XDBZFTIUSA-N 388.536 5.156 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(F)c(Cl)c1F 185618186 QUEFANJHWPQECF-UHFFFAOYSA-N 399.784 5.238 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(Br)s1 189912201 ZMLWYGDBSSBQLC-ZDUSSCGKSA-N 392.362 6.105 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)n1 245432264 NZZZZXBUHJANEX-BFHYXJOUSA-N 394.418 5.145 30 20 GKED C[C@H](ON=Cc1ccc([N+](=O)[O-])o1)c1ncc(-c2ccc(Cl)cc2Cl)o1 255661946 CYOCZSHKNFRHKW-VIFPVBQESA-N 396.186 5.261 30 20 GKED N#Cc1c(F)cccc1Oc1nc(-c2cccnc2)nc2sc3c(c12)CCC3 301845099 MAADHXUDWSFCJD-UHFFFAOYSA-N 388.427 5.045 30 20 GKED O=C(/C=C/c1cccc(Oc2ccccc2)c1)c1ccc(N2CCC(O)CC2)cc1 303347624 QGZTUSAXLYFXMF-NTEUORMPSA-N 399.490 5.336 30 20 GKED CCN(/C(O)=N/[C@@H]1CC2(CCCC2)Oc2ccccc21)[C@H]1CCOC(C)(C)C1 329653913 LLEUGNLGRXPIAU-PKOBYXMFSA-N 386.536 5.017 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](CC(F)(F)F)C1 421059788 KQDGQEYXMULBIQ-ZIAGYGMSSA-N 385.455 5.277 30 20 GKED CCCn1c(C)c(C(=O)Nc2ccc(C#N)cc2Cl)c2cc(OC)ccc21 430361495 ZPKSTQODGRWGNH-UHFFFAOYSA-N 381.863 5.146 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1)c1ccccc1 431984939 HKXBIQZRKRSMJJ-XPWALMASSA-N 375.516 5.132 30 20 GKED CC(C)Oc1cc(O)ccc1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 433504769 ADDANRPTYGMFHQ-AWEZNQCLSA-N 385.489 5.075 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](CC(F)(F)F)C3)cc2)cc1 434136629 HBVJICJYKVSLBZ-OAHLLOKOSA-N 389.377 5.157 30 20 GKED N#CCc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Sc2cccs2)c1 435441728 DKDMZUIXNMVVIT-UHFFFAOYSA-N 395.465 5.126 30 20 GKED Cc1oc(C#N)cc1C(=O)N(Cc1ccccc1C(F)(F)F)C1CCCC1 435701184 OALXYBDYWDHCDQ-UHFFFAOYSA-N 376.378 5.064 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1nc(-c2ccccc2)cs1 435701279 OXKUGRVTAMMOOV-UHFFFAOYSA-N 377.416 5.388 30 20 GKED CC(C)(C#N)CCCC[S@](=O)C(c1ccc(F)cc1)c1ccc(F)cc1 436105602 RXDMUJNMJKYERX-SANMLTNESA-N 375.484 5.523 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1SCCCCC(C)(C)C#N 436200384 WBCZGFNTPXBDGJ-UHFFFAOYSA-N 392.956 5.343 30 20 GKED C=CCC[C@@H](NC(=O)c1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 441846809 UPBCLZYGKPQUMO-MRXNPFEDSA-N 378.350 5.051 30 20 GKED Cc1cccc(Oc2ccccc2C(=O)[C@H](C#N)c2cnc3ccccc3n2)c1 442527344 XJJPNLDKTXNTRK-LJQANCHMSA-N 379.419 5.221 30 20 GKED N#CC1CCC(CNC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)CC1 442723302 RZWMSONEHZKBMC-RJYAGPCLSA-N 393.453 5.272 30 20 GKED N#Cc1ccc(/C=C2\CCn3c2nc2scc(-c4ccccc4)c2c3=O)c(F)c1 448113904 OBRBPQWJYJBGJE-GZTJUZNOSA-N 399.450 5.080 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)N[C@H](CCCC#N)c1ccccc1 458798332 HUUDURSTMRWYOI-WMZHIEFXSA-N 375.516 5.432 30 20 GKED CC1(C)CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C[C@@H]1c1ccccc1 458804821 SZSIBEOGDYOBPF-FGZHOGPDSA-N 375.516 5.257 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458832400 HTHXHXCVORYACT-OIBXWCBGSA-N 375.516 5.399 30 20 GKED CC(C)(C)c1cnc(NC(=O)c2ccccc2Sc2ccccc2C#N)s1 464096753 RONWYTYYOOGQFM-UHFFFAOYSA-N 393.537 5.716 30 20 GKED Cc1ccc(-c2nc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)cs2)cc1 464938909 VXAPUEFFXQQSGD-CTNGQTDRSA-N 387.508 5.031 30 20 GKED CCO[C@H](CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1=CCCC1 465125618 GFYRVNIHYBWLRO-JOCHJYFZSA-N 376.456 5.195 30 20 GKED C=CCn1c(SCc2nc3ccc(F)cc3o2)nnc1-c1cccc(C)c1 466721832 WAYIJZUVDJZWFG-UHFFFAOYSA-N 380.448 5.012 30 20 GKED CC(C)(C#N)CCCN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 472263228 YFQFDOQRXKFXDX-UHFFFAOYSA-N 376.504 5.019 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc(C(C)(C)C#N)cc1 475115989 WXNJUBUBLNAMDZ-OAHLLOKOSA-N 389.524 5.411 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Cl)c(Br)c1)c1ccccc1 476287798 OCKCRRVIYSXPGX-CYBMUJFWSA-N 377.669 5.129 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC[C@H]1c1cccc(OC)c1)c1ccc(F)c(F)c1 477736458 ANAJJTYGIGDQAP-LEWJYISDSA-N 386.442 5.137 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F)c1ccccc1 484143198 MBQVZACUNCRIND-NQIIRXRSSA-N 386.417 5.154 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc(-c2ccccc2)cs1 484549435 VGIAKUKIZJMNJM-QGZVFWFLSA-N 386.432 5.685 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CCC2 492147992 PGCMFXSUQNRQDG-NXVVXOECSA-N 387.508 5.159 30 20 GKED CSC[C@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 494198967 RKOQFIAIQJQNMU-IEBWSBKVSA-N 399.947 5.355 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)cc2F)nnc1-c1ccc(OC)cc1 498745572 VBIYIVHMRVMCOS-CYBMUJFWSA-N 387.455 5.271 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc(Cl)cc1 499815437 SRWDMFSMCPGUJF-INMHGKMJSA-N 379.674 5.131 30 20 GKED CC[C@@H](CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)cc1 503019059 VPXOQGRYKUKHRO-IRXDYDNUSA-N 382.529 5.612 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1 505299682 YYKDFOMQJPWHAX-MGPUTAFESA-N 385.508 5.596 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(F)cc1 505975279 CRJNYLYBDCPMOW-QFIPXVFZSA-N 381.410 5.036 30 20 GKED Cc1c(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)sc2ccc(C#N)cc12 506324394 JCBQMVCKBUDACN-HNNXBMFYSA-N 380.435 5.132 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(OC(F)F)cc3F)c2)cc1 512510610 ZSOKCKNIZMTKLL-UHFFFAOYSA-N 398.340 5.343 30 20 GKED C=CCN(CCc1ccccc1)C(=O)CCc1nc2cc(Cl)ccc2s1 515594628 FDRWPXVKFCACKD-UHFFFAOYSA-N 384.932 5.140 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 521016233 SVQGGYCHSKLZCT-ZDUSSCGKSA-N 382.316 5.051 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)c2ccccc2Sc2ccccc2C#N)C1 522669710 DOSGTUSFBJQBOD-DLBZAZTESA-N 382.554 5.113 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 523620456 ZDBNDPBFKLHLKJ-UHFFFAOYSA-N 381.863 5.434 30 20 GKED C=CCN(C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C)c1ccccc1 524539141 UYTDMZZTHYKYFJ-UHFFFAOYSA-N 387.405 5.469 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 524988377 MNKDWRGRQORZAK-HNNXBMFYSA-N 376.456 5.803 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N(CC(F)(F)F)C2CC2)cc1Cl 535587932 YNBGUECSNHEICE-UHFFFAOYSA-N 394.780 5.171 30 20 GKED COc1ccc2nc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C)cc4)cs3)ccc2c1 537665680 OEFISFFHMJYTHB-GOSISDBHSA-N 399.475 5.165 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 539840027 DWMJAEAEKIEEQI-UHFFFAOYSA-N 385.389 5.109 30 20 GKED N#CC1(CCCN[C@@H](c2ccccc2)c2ccc3ccccc3c2)CCOCC1 540809712 UXGQFPVLFNGYIB-VWLOTQADSA-N 384.523 5.619 30 20 GKED CC(=O)c1ccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542933326 JTBVBOMBNNVZKV-INIZCTEOSA-N 383.451 5.311 30 20 GKED CC[C@H](CC#N)NC(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 545861894 VPFYUCMLTDVNBC-RDTXWAMCSA-N 376.884 5.121 30 20 GKED C=CCn1c(SCc2ncc(C3CC3)o2)nnc1-c1ccc(C(C)(C)C)cc1 551331304 NZWCLLBKJDTNJC-UHFFFAOYSA-N 394.544 5.586 30 20 GKED Cc1cc(Cl)c2ncc(C#N)c(N[C@@H](c3ccccc3)c3nccn3C)c2c1 558754306 CUZKWUDPGNYDJO-FQEVSTJZSA-N 387.874 5.003 30 20 GKED N#C[C@@]1(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)CC12CCCC2 562721312 AERRIZOSLOZMOV-GOSISDBHSA-N 391.418 5.241 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 564517129 KKQKUDBGMNKQGH-INIZCTEOSA-N 389.480 5.173 30 20 GKED CC(C)(CC#N)CSc1nnc(-c2ccccc2F)n1Cc1ccccc1 578248179 XMGYEIJGDUNKAK-UHFFFAOYSA-N 380.492 5.164 30 20 GKED Cn1c(-c2ccc(C#N)cc2)nnc1N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 580979955 QYBIXBBENRCVTM-SFHVURJKSA-N 398.297 5.002 30 20 GKED CCCOc1cc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)ccc1OC 583292332 DNCVNSXYAISANO-UHFFFAOYSA-N 389.455 5.155 30 20 GKED CC(C)(C#N)CNC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 586805996 OEGOTQRJUURQTG-UHFFFAOYSA-N 396.343 5.060 30 20 GKED COc1ccccc1[C@H]1CCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 590942344 LXPZQPAFGCUKPR-FGZHOGPDSA-N 391.515 5.367 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc(C)c1OC(F)F 594362869 BPARCBKTMLBTBP-ZDUSSCGKSA-N 390.386 5.144 30 20 GKED N#CCc1cccc2c1CCN(C(=O)CCCc1cc(Cl)sc1Cl)C2 600780199 JYMHXCGCBAIMNQ-UHFFFAOYSA-N 393.339 5.029 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 600895977 DWXNDRIXEBSBIO-OAHLLOKOSA-N 392.421 5.173 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc2ccccc2n1CC#N 609165353 NKTYFSNAJZQRIV-UHFFFAOYSA-N 386.282 5.134 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H]1CCc2ccccc21 609371292 GJHXFZSTOBYTDS-KXBFYZLASA-N 382.554 5.440 30 20 GKED N#C[C@H](NC(=O)C1CC(c2cccc(F)c2)C1)c1cccc(Cl)c1Cl 609414080 GLHNSKCXVNNRAR-FVKWTLKZSA-N 377.246 5.007 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc2ccccc2[nH]1 609434295 QHTRXIOKKNXAOL-OAHLLOKOSA-N 397.438 5.110 30 20 GKED N#CCCCCNC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccccc1Cl 610139137 QWBVLQYQNOBCJN-SFHVURJKSA-N 376.287 5.076 30 20 GKED CCCOc1ccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cc1OCCC 610317780 XIBUQHFJTKIONQ-INIZCTEOSA-N 381.476 5.019 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)c1cc2ccccc2n1CC#N 610471898 IQCFCIPPDGILJV-CVEARBPZSA-N 379.891 5.082 30 20 GKED FC(F)c1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cn1 631037715 MXSYEXDKLKHQMK-URLYPYJESA-N 376.291 5.018 30 20 GKED CCCN(CC)Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 672583933 OIXFXDLBQCGNKC-GOSISDBHSA-N 395.503 5.157 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(OCc2ccccc2F)CC1)c1ccccc1 678165325 MNERRAJCSSFHSB-HSZRJFAPSA-N 396.506 5.224 30 20 GKED Cc1ccccc1CCC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 729070303 TXZJTPWFBBTAPL-OAQYLSRUSA-N 398.462 5.068 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1SC(F)(F)F 730988882 DJJLIGQEBPURNW-LBPRGKRZSA-N 396.459 5.803 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccnn3C3CCCC3)cc2)cc1 731959849 RBDWADWPEOHMEY-UHFFFAOYSA-N 386.455 5.109 30 20 GKED C[C@H](CC#N)OC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 735600897 WASOMSBEMURCEU-LLVKDONJSA-N 392.242 5.096 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](Cc1ccccc1)c1sccc1C)c1ccncc1 737048541 VYGYPONBLXWDKM-SFTDATJTSA-N 391.540 5.352 30 20 GKED N#C[C@@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2s1 744017021 XOJFKTPUCWIPKT-RTWAWAEBSA-N 396.515 5.889 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(SC)c(Cl)c2)c1 747572891 FAARRWKNXYUZBN-OAHLLOKOSA-N 389.908 5.065 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccccn3)n2)sc2c1CCCCCC2 749125628 XOAMYGKDVZSFNH-UHFFFAOYSA-N 394.525 5.050 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)[C@@H](C)c2ccc3ccccc3c2)cc1C#N 752193648 JSJZTQKIHQSDEL-HNNXBMFYSA-N 387.439 5.022 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)cc1 768969044 JCPBPYBYHLAYGY-ZYQDXHPFSA-N 393.490 5.049 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1ccco1 769771578 QSBPDSSPVMJLTC-TWGQIWQCSA-N 386.234 5.735 30 20 GKED N#CCOc1ccc(Cl)cc1CNC1(c2c(Cl)cccc2Cl)CC1 775551601 BBJLQMVWIBATHN-UHFFFAOYSA-N 381.690 5.328 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1 777834049 OSVUEPXCOMWLKZ-HXUWFJFHSA-N 380.488 5.010 30 20 GKED CC(C)(C)SCCSCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 783564656 IDSKIGWCNCTICY-HNNXBMFYSA-N 390.599 5.251 30 20 GKED CC(=NNc1cnnc2ccccc12)c1sc(-c2ccc(F)cc2)nc1C 814849189 LDMXZFSEBVSOLK-UHFFFAOYSA-N 377.448 5.037 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@]3(C)CC3(Cl)Cl)n2)cc1 835068671 SNMKJMAJGJVXJS-CXAGYDPISA-N 379.312 5.269 30 20 GKED N#C[C@@H]1CCC[C@@H](OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 839045301 AALAHVJAJRZQBR-TZMCWYRMSA-N 393.270 5.207 30 20 GKED COc1cc(NC(=O)Nc2ccccc2O[C@H](C)C#N)c(C2CC2)cc1Cl 847261992 TXOQJONCHKYIBJ-GFCCVEGCSA-N 385.851 5.161 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1nnc(-c2ccccc2)s1 853351654 PELFSTRFNXFAKG-UHFFFAOYSA-N 396.360 5.658 30 20 GKED CCCCCCN(C(=O)c1cccc(CC#N)c1)c1nc2ccccc2s1 915807786 MJBMUWPONRGLMK-UHFFFAOYSA-N 377.513 5.589 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4ccc(F)cc4)CCC3)n2)cc1 916973950 ASPVPMYCTJNJHZ-IBGZPJMESA-N 390.483 5.556 30 20 GKED CCCCSCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 916996081 FWCJAWVXFGPHAX-CYBMUJFWSA-N 399.368 5.826 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Oc2ccccc2)cc1 1776033321 GEMOTXLSFJUYRI-UHFFFAOYSA-N 380.831 5.667 30 20 GKED C=CCOc1ccc(/C=C\c2nc3ccccc3c(C(=O)O)c2C)cc1Cl 1776184156 NGZVAOGLUWOBFM-NTMALXAHSA-N 379.843 5.630 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(-c2cccnc2)c1 1776355403 JYPSHIZFWGNCIJ-CSKARUKUSA-N 387.435 5.130 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cccc(Cl)c2C(F)(F)F)c1)C(=O)O 1776471341 LRCUTDBKJXYABS-ANYFNZRUSA-N 398.764 5.107 30 20 GKED CCCCCCCSc1ccc(C(=O)N[C@H](CC(=O)O)c2ccccc2)cc1 1776787547 VRCVWBCUXVRGRI-OAQYLSRUSA-N 399.556 5.695 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1 1777559818 GRJBYEAIVYLDGM-YFHOEESVSA-N 388.375 5.301 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1cc(Br)cc(C(=O)O)c1 1777559882 SCTUDPQIHDRHOF-VOTSOKGWSA-N 385.213 5.098 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325584 NRMHKZVXHDRVHS-YRPNKDGESA-N 394.559 5.159 30 20 GKED N#Cc1ccc(CSc2nnc(-c3cccs3)n2-c2ccccc2)c(F)c1 10089845 DRTPNRMXLHPIFI-UHFFFAOYSA-N 392.484 5.299 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 41543194 GWVBCZONUYIING-CQSZACIVSA-N 393.855 5.403 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(Br)ccc2Cl)c1 54758752 OWXMTDAQUHZPSY-UHFFFAOYSA-N 393.668 5.037 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)NC(C)C)cc1 55009742 OHSZWXUGVOOCIA-UHFFFAOYSA-O 397.608 5.431 30 20 GKED COc1ccc(-c2nc(CSCCOc3ccccc3C#N)cs2)cc1 60522156 BUQBUJICWDJOOV-UHFFFAOYSA-N 382.510 5.003 30 20 GKED CCCOCc1ccccc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 108532603 GOKSTDHUOIJRDS-QGZVFWFLSA-N 397.544 5.187 30 20 GKED COCc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)o1 123696327 FWFPOWMAHQIHIU-QAPCUYQASA-N 399.516 5.047 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSCc2ccccc2)CCC1 128259711 PXZUCQHLTCPMCA-UHFFFAOYSA-N 376.481 5.042 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@@H](C)C(C)(C)C#N 131155112 SOAUBOPJSPCHGW-STQMWFEESA-N 392.908 5.098 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(-c3cccnc3)nc3ccccc23)n1 131174383 GOZXOQNUPOEDFV-SFHVURJKSA-N 398.491 5.367 30 20 GKED Cc1cccc(Oc2ccccc2NC(=O)N(CCC#N)Cc2ccccn2)c1 134510352 YCHBNDICYMTTDK-UHFFFAOYSA-N 386.455 5.130 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(OC(C)(C)C)cc2)ccc1OC 157252918 CXBFBWFZOMWVNO-XLIONFOSSA-N 396.531 5.404 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(NCCc3ccccc3)cc2)c1 175218389 OFHURWXRZQQMQT-UHFFFAOYSA-N 387.508 5.209 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)s2)ccc1OCc1ccccc1 176951293 DSWYZJGOGSEIMC-INIZCTEOSA-N 378.497 5.058 30 20 GKED Cc1nc(CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)oc1-c1ccccc1 177774267 WRVPVZGJJFRBDA-INIZCTEOSA-N 379.485 5.039 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](CC)c2ccc(Cl)s2)ccc1OC 180812496 AEHVZZASDSLWIY-LSDHHAIUSA-N 378.925 5.332 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](O)c1ccc(OC(C)C)cc1 191491338 CXSJWIRMZJKLQY-QFIPXVFZSA-N 396.531 5.181 30 20 GKED N#CCCCOc1cccc(NCc2cc(Br)c(Cl)s2)c1 227810977 CEAHACVSSHBKJN-UHFFFAOYSA-N 385.714 5.459 30 20 GKED CC(=NOCc1cc(-c2ccccc2)on1)c1nc2ccccc2n1C(F)F 252467312 CAGVFQLJDPTPRQ-UHFFFAOYSA-N 382.370 5.027 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(C#N)cc2Cl)[C@H](C)C2CC2)cc1 426156768 MROIDEDIIPDJCP-CQSZACIVSA-N 383.879 5.053 30 20 GKED CO[C@@H](c1cccc(Cl)c1)c1noc(-c2sc3ccc(C#N)cc3c2C)n1 426414390 AWLRGBSSYMNURW-KRWDZBQOSA-N 395.871 5.521 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3cccc(SCC#N)c3)sc2C)cc1 429949116 NCPBUDAOILSGLZ-UHFFFAOYSA-N 379.510 5.295 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431463347 HAQWIRODRPZCIJ-RXVVDRJESA-N 381.545 5.210 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 431958040 YXAVMOXHIGIZDQ-KBXCAEBGSA-N 390.314 5.789 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1 433377198 PKNYQURYIFIYNB-HXUWFJFHSA-N 395.462 5.130 30 20 GKED CCCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@@H](CC)c1ccccc1 435139242 WCCPXJQYIVJTCQ-QHCPKHFHSA-N 387.531 5.222 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C2(c3cccc(C#N)c3)CC2)c1C 435250448 TUMJQOCTBQGRNY-UHFFFAOYSA-N 376.500 5.242 30 20 GKED N#CCC[C@H](NC(=O)NCc1ccccc1OCc1ccccc1)c1ccccc1 438842961 QYYVWVBFHDVDFF-QHCPKHFHSA-N 399.494 5.110 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NCC2CCC(C#N)CC2)cc1Cl 441150488 YVPUNAJHNUPAHP-UHFFFAOYSA-N 393.874 5.064 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(NC3CCCC3)c2)c2ccccc21 444806980 YBEBWAMOATUQAP-UHFFFAOYSA-N 386.499 5.552 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 446377411 RGWNTRAEYGBIQX-UHFFFAOYSA-N 399.450 5.051 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1nc(C)cs1)C(F)(F)F 455254176 WPMQSYACGKPLMA-INIZCTEOSA-N 397.466 5.729 30 20 GKED CN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H]1CCCC[C@H]1C(F)(F)F 458839389 MRKJBAFTXSGKHI-SQNIBIBYSA-N 381.442 5.184 30 20 GKED C[C@@H](C(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12)c1cccc(C#N)c1 461775582 LGIRTHWCNLPXRB-KVRYQGLBSA-N 392.502 5.075 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H](C)c1cccc(C#N)c1 462028770 GAWRVKMSGCWFHY-SFHVURJKSA-N 395.462 5.060 30 20 GKED COc1ccc(C[C@@H](Nc2ncc(C#N)cc2Cl)c2ccc(OC)cc2)cc1 462915980 AGNOPRBSCBEFHF-OAQYLSRUSA-N 393.874 5.020 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc3nc(C)oc3c2)cc1 470894819 NITZPEPWXCGQAQ-UHFFFAOYSA-N 399.406 5.061 30 20 GKED CN(C(=O)c1ccnc(C#N)c1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 476220831 HCJKOMDORSCMAE-UHFFFAOYSA-N 396.277 5.122 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(SCCCOc2cccc(C#N)c2)o1 477533320 WIBNVUDGBCDHMH-IBGZPJMESA-N 379.485 5.044 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2c1 483228605 JTGHEHFPZKTQQP-NRFANRHFSA-N 393.446 5.159 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)c1 487144135 XYHGWPNWYGYXKH-UHFFFAOYSA-N 397.406 5.020 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cn1 491050498 MIWFSCKGNKYITP-OAHLLOKOSA-N 388.496 5.129 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 494752781 MERWSLVGCYUFQC-UHFFFAOYSA-N 396.450 5.496 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 498446725 ODOZHZNUYJYLNW-OALUTQOASA-N 386.417 5.119 30 20 GKED N#CC1(CCCN2CCCC[C@H]2c2ccccc2C(F)(F)F)CCOCC1 499534790 XMVZLXFDBSEBIJ-IBGZPJMESA-N 380.454 5.333 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)c1ccc(C(F)(F)F)cc1 499958792 PRQMXOFEACVNJM-YVEFUNNKSA-N 380.797 5.233 30 20 GKED CC(C)(C)c1ccc(OCCCSCCCC2(C#N)CCOCC2)cc1 507717937 YLYWZHCKTPMNJU-UHFFFAOYSA-N 375.578 5.587 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N[C@H]2CCc3ccccc32)cc1 508261405 ZPDOIRWXOATTQY-NRFANRHFSA-N 399.450 5.168 30 20 GKED CCCOc1ccccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 508565296 RPKCZMASBOSCHH-UHFFFAOYSA-N 386.451 5.178 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccn2)cc1)[C@H](C)c1ccc(C#N)cc1 508925572 VCDHXJYXFSKBBK-QGZVFWFLSA-N 387.508 5.328 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 509211555 OMAAFDHJGBSTEF-UHFFFAOYSA-N 396.249 5.740 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCC(=O)Nc1ccc(F)cc1Cl 510194865 BOVPVRPLNKIGSF-UHFFFAOYSA-N 397.862 5.144 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510676480 YDWSBUCICFVSKU-OAHLLOKOSA-N 389.480 5.563 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1 512202447 KIUMGYGENPBESN-OAHLLOKOSA-N 386.879 5.220 30 20 GKED C=C1CCN(C(=O)c2oc3ccccc3c2CSCc2ccccc2)CC1 517455228 ZJGDLDKNSPFFDF-UHFFFAOYSA-N 377.509 5.658 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1ccccc1Cl 517473261 MAHGJFPCRYPTQS-GJZGRUSLSA-N 387.936 5.817 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 518239807 MNQFPDUEHNSEHU-CABCVRRESA-N 388.920 5.449 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 519424095 RYEBPWBXGIWUOQ-LBPRGKRZSA-N 376.934 5.566 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 520198873 JFHRVTPQTJNOSH-PBHICJAKSA-N 387.936 6.007 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 523110796 FHOXRTDKXPXWEG-INIZCTEOSA-N 388.433 5.193 30 20 GKED CC(C)c1ccccc1OCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N 523594596 VYLOFAYURSILBG-KRWDZBQOSA-N 397.544 5.405 30 20 GKED C[C@@H](CC(=O)Nc1sc2c(c1C#N)CCC2)c1ccccc1C(F)(F)F 525519518 XRUOBQYZIYXSED-NSHDSACASA-N 378.419 5.260 30 20 GKED Cc1ccccc1-c1cccc(CNC2(c3ccc(C#N)cc3)CCOCC2)c1 527811914 OAGMEMKUZGNWAS-UHFFFAOYSA-N 382.507 5.329 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@H]1COc2ccccc21 533170794 WHXGNNDHZDYWCU-OPAMFIHVSA-N 399.450 5.037 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnc3onc(C(C)(C)C)c3c2)c(C#N)s1 538073890 NZOATWWKIYZWEH-UHFFFAOYSA-N 382.489 5.003 30 20 GKED C=CCC[C@H](NCc1nc2ccc(F)cc2o1)c1ccc(C(F)(F)F)cc1 539331469 MRWYSONEYRILHO-INIZCTEOSA-N 378.369 5.783 30 20 GKED Cc1cc([C@H](NCCSCc2ccccc2C#N)c2cccnc2)ccc1F 543401808 SJULPTRAXWAFDS-QHCPKHFHSA-N 391.515 5.013 30 20 GKED C[C@H](c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1)C(F)(F)F 546294911 USEBEGIGDKVEDH-RXMQYKEDSA-N 378.194 5.440 30 20 GKED COc1ccc(CN[C@H]2C[C@H](c3ccccc3Cl)C2)cc1OCCCC#N 549934215 FCLBITTZVQTBJB-IYARVYRRSA-N 384.907 5.067 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccccc2)n1 551140587 UUCJDOCIMMAVOP-FHWLQOOXSA-N 379.504 5.069 30 20 GKED N#Cc1cnc2c(F)c(F)c(F)cc2c1Sc1ccc(C(F)(F)F)cn1 557476188 YZJFXHLMLHBAPR-UHFFFAOYSA-N 385.292 5.089 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(-c2cccnc2)cc1 581758038 NAAPQNYELWFTAD-HNNXBMFYSA-N 381.401 5.490 30 20 GKED CCOc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1OCC 590104162 RJCYWCXIDUTKHH-LJQANCHMSA-N 381.476 5.041 30 20 GKED C[C@H](Oc1ccc([C@@H](C)NC(=O)N2CCC(CC#N)CC2)cc1)c1ccccc1 595750943 DKHGVVQEWOMAHR-MOPGFXCFSA-N 391.515 5.223 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cc(C#N)ccn2)c(C(F)(F)F)c1 598809347 VZUVHLIGFQYQMN-NSHDSACASA-N 379.407 5.115 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2cccc(C#Cc3cccs3)c2)cs1 601102923 MQLWABPVPSWCAP-AWEZNQCLSA-N 381.526 5.050 30 20 GKED CCCOc1ccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c(C)c1 609059351 FILUPZNOEXHRRW-UHFFFAOYSA-N 390.439 5.080 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC[C@H]2c2cccs2)cc1 609296460 SAEFGFFFPILFSB-IBGZPJMESA-N 392.455 5.528 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCCc4sccc4C3)c2)cc1 609340166 UWARYTIPYITGRN-UHFFFAOYSA-N 389.480 5.392 30 20 GKED COCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](C)c1ccccc1 609438909 NUZHBUFYWMZQIA-ZWKOTPCHSA-N 397.544 5.322 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)cn1 609640416 IRMWNWPDLIIKEG-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC[C@@H](CC(=O)Nc1c(C)c(C)nn1-c1ccc(C#N)cc1)c1ccc(C)cc1 610053724 JWRLJSRKVYOKEJ-FQEVSTJZSA-N 386.499 5.192 30 20 GKED Cc1ccc(-n2c(SCCC(C)(C)C#N)nnc2-c2ccccc2F)cc1 610165653 SACQHYMBCMOHGU-UHFFFAOYSA-N 380.492 5.414 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610719388 DLZAJIZPJOJSEJ-ROUUACIJSA-N 376.504 5.128 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)oc2c1ccc1ccccc12 613290772 LANHBPGYUDCETO-FQEVSTJZSA-N 376.415 5.933 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1sc2cccc(Cl)c2c1Cl 613372966 KRUZWNLLYSNEHN-UHFFFAOYSA-N 377.252 5.341 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)oc2ccc(F)cc12 618297765 NFZBIRIYJGFCKF-AOOOYVTPSA-N 397.290 5.083 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1)c1ccccc1 676423298 NOVBZANQDASAJV-UXHICEINSA-N 389.499 5.424 30 20 GKED CC(=O)C(C)(C)CCC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 676527029 OBZYIDGZCITLNQ-UHFFFAOYSA-N 398.890 5.125 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1nc2ccccc2s1 734209705 FEQJWWVOIRFSBG-ZIAGYGMSSA-N 396.541 5.431 30 20 GKED CCn1c(SCc2cc(Cl)ccc2OCC#N)nnc1-c1cccc(C)c1 735230776 QKUAOZRFLQATON-UHFFFAOYSA-N 398.919 5.122 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@@H](C)c3ccc(C(F)(F)F)cc3)[nH]c12 735792119 HUNFPWOKTFDLSM-CZUORRHYSA-N 385.389 5.260 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1 737479526 WPHIGJLDAFKUJN-LLVKDONJSA-N 397.780 5.023 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)ccc1O 741845169 YIRCZENLUDDPRU-YCRREMRBSA-N 382.403 5.341 30 20 GKED Cc1ccc([C@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)o1 742569718 OULVRKOCFMCLDP-AWEZNQCLSA-N 380.831 5.648 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)c2)cc1 743155389 KDFYDLHISDMROG-SFHVURJKSA-N 385.467 5.328 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cc1 743294206 DOYSMCKMEMQNDN-YTFSRNRJSA-N 385.442 5.159 30 20 GKED C[C@@H](Oc1ccc(Cl)c(COC(=O)c2sccc2C#N)n1)c1ccccc1 744291386 ZSUZEEQDDOVCIB-CYBMUJFWSA-N 398.871 5.165 30 20 GKED CC(C)CN(C(=S)Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 745686966 DNHHJFOSCXIUTM-UHFFFAOYSA-N 391.512 5.732 30 20 GKED COc1cc(Br)c(/C=C\C(=O)c2oc3ccccc3c2C)cc1O 747137835 AUAQZTKLGYOFSR-FPLPWBNLSA-N 387.229 5.114 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(SC)c(OC)c3)cs2)cc1 747614337 DZWRSLMQCAFFNC-JXMROGBWSA-N 397.521 5.445 30 20 GKED N#Cc1csc(/C=C2/SC(=S)N(c3ccc4ccccc4c3)C2=O)c1 748662182 QPQXGKBBMVVCFB-RQZCQDPDSA-N 378.503 5.179 30 20 GKED O=C1/C(=C\c2coc(-c3ccccc3)n2)CC/C1=C\c1coc(-c2ccccc2)n1 749886862 QYOAXVKQRKVYQS-LRVMPXQBSA-N 394.430 5.827 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CNCc1ccc(C#N)cc1F 754829826 NCRDYXIAEFIERG-UHFFFAOYSA-N 396.897 5.009 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(Br)cc2F)c1 767735783 IIPLDYBEYNGLAG-TWGQIWQCSA-N 388.236 5.167 30 20 GKED COc1cccc([C@@H](C#N)NC(=O)c2c3ccccc3cc3ccccc23)c1OC 768153558 ZDBCZAMZANPPTA-OAQYLSRUSA-N 396.446 5.005 30 20 GKED CC(C)c1ccc([C@H](NC(=O)CNc2ccccc2O[C@H](C)C#N)C(C)C)cc1 773369258 SPPRCJGSXIOUJK-HOYKHHGWSA-N 393.531 5.026 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2C[C@@H](C(C)C)c3ccccc32)ccc1OC 774235506 FWZSRCUZIJTIIE-BVYCBKJFSA-N 378.516 5.350 30 20 GKED C[C@@H]1COc2ccccc2CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782553287 OCLFPAVPLQQKIX-WZONZLPQSA-N 397.478 5.157 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1ccc2ccccc2c1)c1nccc2ccccc12 792094697 PKFQPMGDKVZJGK-QFIPXVFZSA-N 378.431 5.227 30 20 GKED N#Cc1c(NC(=O)c2cc(C3CC3)cnc2Cl)sc2c1CCCCCC2 796591093 GECXZIIGLXHNEO-UHFFFAOYSA-N 385.920 5.457 30 20 GKED CCCOc1ccc(C(=O)CCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797568414 RIRWCHQMTPYVQZ-KRWDZBQOSA-N 398.528 5.069 30 20 GKED Cc1nc2c(s1)[C@H](Nc1c(C#N)cnc3c(Br)cccc13)CCC2 799322898 QZOFWADVROHQMX-OAHLLOKOSA-N 399.317 5.123 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)c2ccc(C3SCCCS3)cc2)cc1 813377244 IFYJPAZQMFMFEG-FQEVSTJZSA-N 396.581 5.455 30 20 GKED COc1ccccc1C1(C(=O)[C@H](C#N)c2ccc3ccccc3n2)CCCCC1 815900051 MRSNMFYTYUVCBL-LJQANCHMSA-N 384.479 5.322 30 20 GKED N#CCSc1ccccc1C(=O)OCC[C@H](c1ccccc1)C(F)(F)F 816476527 BMXWCLKWSYWIID-MRXNPFEDSA-N 379.403 5.195 30 20 GKED Oc1nncc(NN=Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)c1Cl 818269903 OLZCMWAAAMSXQU-UHFFFAOYSA-N 398.797 5.029 30 20 GKED Cc1occ(C(F)(F)F)c1C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 824581940 YMVJDPBIIATOLZ-UHFFFAOYSA-N 399.253 5.390 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)O[C@H]1CCC[C@@H](C#N)C1 839050413 IVZXNKQNVAGPEU-YPMHNXCESA-N 379.243 5.196 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc3nc(C(F)(F)F)oc3c2)c1 864030043 FPKPPCSFPWQIFE-UHFFFAOYSA-N 396.166 5.093 30 20 GKED O=C(c1cccc(Oc2nccs2)c1)N(O)Cc1cc(Cl)cc(Cl)c1 901378645 OEVQSHKUKKUNFI-UHFFFAOYSA-N 395.267 5.274 30 20 GKED N#CC[C@@H](Cc1nc(-c2cccc(Oc3ccccc3)c2)no1)c1ccccc1 904591838 RTMGVELPWRZSRZ-IBGZPJMESA-N 381.435 5.769 30 20 GKED CC(=NOCc1cc(F)cc2cccnc12)c1nc2ccccc2n1C(F)F 914683419 HPEVHGSGMUIGRR-UHFFFAOYSA-N 384.361 5.060 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4c(F)cccc4s3)cn2)cc1 916073568 BDQBHZKUVZHOEK-UHFFFAOYSA-N 389.411 5.352 30 20 GKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1ccc2c(c1)OCCO2 916138629 QHAWBWXFZMMHQZ-SREVYHEPSA-N 383.856 5.131 30 20 GKED N#C[C@H](C(=O)COc1ccccc1Cc1ccccc1)c1nc2ccccc2s1 916627481 XRGVGWHEOOQKFU-LJQANCHMSA-N 398.487 5.142 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(-c3cccs3)nc3ccccc23)s1 917878084 KZVZSHOMVHZSEA-UHFFFAOYSA-N 389.505 5.711 30 20 GKED CCC/C(C)=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 920324804 VADQXOUJIPCIPP-OIOXUXFSSA-N 379.312 6.040 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)nc2)cc1 1776125343 FIUZUYDXDXBIJT-XMCSSRMMSA-N 381.472 5.271 30 20 GKED C=C(Cl)C[C@@H](NCc1ccc(-c2ccc(Cl)c(Cl)c2)s1)C(=O)O 1776142973 UGTGXWBSONQIOW-CQSZACIVSA-N 390.719 5.407 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(F)c(Br)c1F 1776784088 JKQHVNYABIMMHG-ZDUSSCGKSA-N 392.284 5.021 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2ccccc2F)c1 1776788202 YQABJXDAELMGJH-JOCHJYFZSA-N 387.495 5.481 30 20 GKED Cc1cccc2c1CC/C(=C\c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777457406 RZUBGIYAQPNOPQ-JLNBVAMESA-N 398.458 5.412 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(-c2cccs2)cc1 1777640957 HNOYBFRYCWKONA-VAWYXSNFSA-N 378.449 5.165 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCOc4cc(F)ccc4C3=O)s2)cc1 1777671015 RUBVJYJLKHTFCP-RVDMUPIBSA-N 394.423 5.301 30 20 GKED Cc1cc(C)cc(N/C(S)=C(\C(=O)c2cc(C)ccc2C)[n+]2ccccc2)c1 10172603 UCQDCKPQKQMLSL-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCN(CC(=O)N[C@@H](c1ccc(C)cc1)c1cccs1)Cc1cccs1 15519174 ITSUQYQYTLNMDC-QFIPXVFZSA-N 396.581 5.012 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc(C)sc2C)cc(Br)c1O 33502542 FIEZBYUYPFIOTQ-WAYWQWQTSA-N 381.291 5.128 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccc(C#N)cc1 47052156 KOKMOEQJKGUPOD-CQSZACIVSA-N 387.405 5.012 30 20 GKED N#C[C@@H](C(=O)c1ccccc1C(=O)c1ccc(F)cc1)c1ccc2ccccc2n1 48855466 RPDSAFRDPXICQH-OAQYLSRUSA-N 394.405 5.095 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl 58989264 HDGGHYZRDCSXKI-LJQANCHMSA-N 391.814 5.156 30 20 GKED C[C@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1Cl 66861320 YTPVAKFDUVAXSD-CABCVRRESA-N 387.936 5.024 30 20 GKED O=C(Nc1ccc(F)c(F)c1F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 91916614 UBLQRMLXFUITDB-LBPRGKRZSA-N 380.263 5.058 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1ccc(F)c(C#N)c1 97544201 IQUMIVNIYCOXIM-UHFFFAOYSA-N 377.853 5.097 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc4oc(C5CC5)nc4c3)o2)cc1 102720347 ZSEIUUBZEUFOBP-UHFFFAOYSA-N 399.406 5.001 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 108528743 OBIBZNOZUUAUFQ-JXFKEZNVSA-N 379.529 5.616 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)cs1 120086235 CBADUVCLVLHOQE-MDZDMXLPSA-N 390.464 5.311 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1ccccc1SCCC#N 120163869 AJYIQBRSDYMEGP-UHFFFAOYSA-N 381.432 5.047 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccc(Cl)cc1 122339484 CNRVFEJRTLGBBV-LJQANCHMSA-N 382.250 5.050 30 20 GKED Cc1n[nH]c(C)c1[C@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 131372584 JUQPUKXGKGGMFA-LBPRGKRZSA-N 394.862 5.086 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NCc1nnc(-c2ccc(C#N)cc2)o1 133897447 YUKXXKGOZCUOGZ-UHFFFAOYSA-N 396.450 5.108 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)c1 169188393 QONUHMOFAGKZOP-UHFFFAOYSA-N 391.858 5.337 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 171382260 CRVHWDSKHMFSHZ-UHFFFAOYSA-N 377.366 5.313 30 20 GKED C[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(OCC#N)cc1 171768550 UILNDHBUGONBPX-HNNXBMFYSA-N 389.480 5.309 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(Cl)c(Cl)c2)ccc1OC 174091902 LTXOICOBBHHLJL-CJNGLKHVSA-N 393.314 5.534 30 20 GKED CC(C)[C@@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 178392173 MVBKQJKHXHVMBW-OPAMFIHVSA-N 399.535 5.145 30 20 GKED N#C[C@H](C(=O)c1occc1-c1ccc(F)cc1)c1nc2ccccc2n1C(F)F 178709845 CHIASWGYQIFPKG-OAHLLOKOSA-N 395.340 5.321 30 20 GKED COc1cc([C@H](C)N[C@H](CCC#N)c2ccccc2)ccc1SC(F)F 181575858 UVVNRLQTARFDEG-WMLDXEAASA-N 376.472 5.706 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 189966600 DJYLZZIRBMNJFW-HNNXBMFYSA-N 383.517 5.862 30 20 GKED C=CCn1c(Sc2ncnc3c2oc2ccccc23)nnc1-c1cccs1 301716804 NMTCHVNDXGNEHJ-UHFFFAOYSA-N 391.481 5.033 30 20 GKED CC[C@H](C)CN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 303425148 AMOSKBZJDYRWEW-HNNXBMFYSA-N 385.895 5.300 30 20 GKED C=CCn1c(SCC/C=C/c2ccc(Br)cc2)nnc1C1CC1 303676239 LBYJRMRBKSLFER-HWKANZROSA-N 390.350 5.300 30 20 GKED Cc1cc(C)c(N=C(O)[C@@H](C)Sc2nnc(C3CCC3)n2C)c(Cl)c1 329324074 VKSXSCCRZVAAEH-GFCCVEGCSA-N 378.929 5.122 30 20 GKED C=CCCc1ccccc1NC(=O)c1nc(COC)sc1-c1ccccc1 410351622 MCWIZKOUAUGZJA-UHFFFAOYSA-N 378.497 5.327 30 20 GKED Cc1c(C(=O)Nc2cccc(OCc3cccnc3)c2)sc2ccc(C#N)cc12 428168931 WZMXVKASAUFPNF-UHFFFAOYSA-N 399.475 5.308 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 433145230 GAYFGZOTHKEZBO-UHFFFAOYSA-N 382.464 5.116 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 433226869 IPYRLPIBBRFOTF-LJQANCHMSA-N 398.466 5.042 30 20 GKED CC(C)[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccnc1 436113246 UREYEHGHNHHCSA-KOSHJBKYSA-N 383.495 5.237 30 20 GKED Cc1cc(O)c(C(C)C)cc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 436546590 QBSIOVDWTNENFX-MRXNPFEDSA-N 377.271 5.126 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)c1cc(C#N)oc1C 438382128 OKVNNZRVBDKHKQ-UHFFFAOYSA-N 391.427 5.436 30 20 GKED Cc1cc(C#N)ccc1C(=O)N(C)[C@H](C)c1sc(-c2ccccc2)nc1C 438933669 PGFIBYYJWQZNCA-MRXNPFEDSA-N 375.497 5.132 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCC34CCC4)cc2Cl)cc1 445232680 BSFZRVQEBRWBAC-UHFFFAOYSA-N 381.863 5.554 30 20 GKED CC1(C#N)CCC(N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CC1 449266628 WCSIUSSFLPKPQG-PCKAHOCUSA-N 378.360 5.761 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 466894560 SSSHIJWZFRBKKA-XMSQKQJNSA-N 397.478 5.154 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)nc2ccccc21 468268213 PNFZHRACKADWAI-GOSISDBHSA-N 376.479 5.008 30 20 GKED Cc1cccc(C(NCc2nnc(-c3cccc(C#N)c3)o2)c2cccc(C)c2)c1 471643602 RNKWOFABEAATSG-UHFFFAOYSA-N 394.478 5.104 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@](C)(OC)CC1)c1ccc(C(F)(F)F)cc1 474547591 MVCUQCUMJFJBCT-QUCCMNQESA-N 398.469 5.313 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1 476141297 HUADKPMPQFMNCM-WOJBJXKFSA-N 398.344 6.043 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCCC[C@H]2/C=C\c2cccs2)cc1 476667273 KCPSSXRYAUVUHI-ODLZTCLXSA-N 378.541 5.647 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N[C@H](CCC#N)c1ccccc1 480808326 XOQINOQGQSYSHZ-GOSISDBHSA-N 397.450 5.172 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc[nH]c1C1CCC1 486163798 JCFRCZWOVWZFDS-UHFFFAOYSA-N 385.467 5.294 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)s1 486633722 GQVYWISYNYRUOY-UHFFFAOYSA-N 375.478 5.073 30 20 GKED N#Cc1ccc(C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)s1 487524812 KAXKSFJEBUPNNL-UHFFFAOYSA-N 382.485 5.198 30 20 GKED C=CCC[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(C(F)(F)F)cc1 500103759 UTGUBLGYNPHBDY-QGZVFWFLSA-N 381.442 5.342 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3cccc(Cl)c3)n2)sc2c1CCC2 500260501 GBISBOSHKVBZQD-UHFFFAOYSA-N 385.901 5.138 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1cccc(-c2cccc(Cl)c2)c1 500265391 DLPIFCZHVAMDHS-UHFFFAOYSA-N 390.874 5.350 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(-c4ncco4)cc3)c2)cc1 500393905 GUNQSVZBAREEKT-UHFFFAOYSA-N 381.391 5.258 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 503153574 SFNZMKFFEVYKBQ-ZEQRLZLVSA-N 392.458 5.641 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(CN(C)Cc2ccccc2)CC1 505001432 SZQAEDRWZIMFRF-UHFFFAOYSA-N 391.559 5.181 30 20 GKED CC(C)N(C(=O)c1cccc(OCc2ccccc2C#N)c1)c1ccc(F)cc1 505078237 KRRZBZFPNSQAAY-UHFFFAOYSA-N 388.442 5.332 30 20 GKED N#CC1CCC(CNC(=O)[C@H](Sc2ccccc2F)c2ccccc2)CC1 508349339 OBANGWKMYJVEKB-MYKUNDNFSA-N 382.504 5.105 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1c(C(C)=O)oc2cc(C)ccc12 509409745 DIGOQEUXSRZOSK-UHFFFAOYSA-N 375.468 5.091 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1Oc1ccccc1 510341347 LRJRNSNUZLOJOP-SFHVURJKSA-N 385.467 5.253 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCOc2c(Cl)cccc21 513085891 IWRLUNKRUOORQV-OAQYLSRUSA-N 388.854 5.132 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)cc1Cl 515110328 KMXTYULZWZZTRN-CQSZACIVSA-N 396.903 5.233 30 20 GKED C[C@@H](NC(=O)c1cccnc1SCC1CCCCC1)c1ccc(C#N)cc1 523708760 WQPDSROYPHSJTF-MRXNPFEDSA-N 379.529 5.117 30 20 GKED COc1ccc2c(c1)[C@@H](N(Cc1ccccc1)Cc1ccc(C#N)cc1)CCO2 525124311 RXAHXRLAYDTBHZ-DEOSSOPVSA-N 384.479 5.093 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 533502801 QTSGICNMLISWRE-HNAYVOBHSA-N 392.890 5.202 30 20 GKED Cn1c([C@H](C#N)C(=O)c2cccc(-c3c(F)cccc3F)c2)nc2ccccc21 535316184 YWRBJRHSOIRSQQ-MRXNPFEDSA-N 387.389 5.009 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccc(C)cc1 539759736 WAWHJUVROWMRKG-OAHLLOKOSA-N 376.485 5.434 30 20 GKED C[C@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](C)c1ccccc1C(F)(F)F 540740960 FWABJUAZPHMAOZ-CABCVRRESA-N 386.417 5.183 30 20 GKED C[C@H](NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543034658 UMTJTTICJZWRAO-VUZGARFFSA-N 388.433 5.112 30 20 GKED C=CCN(C(=O)COc1ccsc1Cl)c1nc(-c2ccccc2)cs1 551096760 DCHSUJFJXWELBU-UHFFFAOYSA-N 390.917 5.123 30 20 GKED C[C@H]1CC[C@H](c2ccccc2)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 554204822 HPPSQXXYHFDASD-WAOWUJCRSA-N 393.556 5.943 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 557710153 RMSIVLVTSUVANR-OAHLLOKOSA-N 376.275 5.109 30 20 GKED CN(Cc1ccc(F)cc1C#N)[C@@H]1CCSc2ccc(Br)cc21 561431213 MYOSKGINSMLQQO-QGZVFWFLSA-N 391.309 5.129 30 20 GKED Cn1ccc([C@H](N[C@H]2CCCCc3cc(C#N)ccc32)c2ccc(Cl)cc2)n1 564813591 FSWRQNRRVKEYQC-JTHBVZDNSA-N 390.918 5.092 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 567038730 HTHQDZHITBQJEG-VXGBXAGGSA-N 379.312 5.223 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(-c2ccnc(Oc3ccccc3Cl)c2)no1 573165534 GIHMZJIAOQINAK-RDTXWAMCSA-N 383.835 5.026 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cccc(OCC(F)(F)F)c3)cc2)ccn1 578285280 AMXPSSHUOBKHGL-UHFFFAOYSA-N 399.372 5.299 30 20 GKED N#CCCCCCc1nc(-c2ncoc2-c2cccc(C(F)(F)F)c2)no1 589155059 AGOVXZQLQIWBLJ-UHFFFAOYSA-N 376.338 5.037 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccccc2C(F)(F)F)c1 589741362 YDRCNEVVAMJHLG-UHFFFAOYSA-N 378.394 5.324 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H](c4ccccc4)C3)cn2)cc1 590106564 FEGDUYLDDVETMO-FQEVSTJZSA-N 398.466 5.157 30 20 GKED C=CCC1(NC(=O)Nc2cccc(C[S@@](=O)Cc3ccccc3)c2)CCCC1 596750569 ULYPRWSMDNXQBN-NDEPHWFRSA-N 396.556 5.146 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c[nH]cc1-c1ccccc1 608876846 WWSISHQSIAPIJY-UHFFFAOYSA-N 394.434 5.301 30 20 GKED CC[C@H](C)c1ccc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 609384569 QCFSAMFTUSENJJ-IRXDYDNUSA-N 382.529 5.612 30 20 GKED C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cccc(C#N)c1 610344926 MVVWKFUDNZJTPT-ZDUSSCGKSA-N 381.819 5.231 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@@H](C)c3cccc(C#N)c3)sc2C)cc1 610361163 SJPDBGDSVPWMAA-AWEZNQCLSA-N 376.481 5.095 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCN(C)c2ccccc21 611014372 LJEWKNMCPFZCEG-JOCHJYFZSA-N 397.478 5.221 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 613290590 HSFVCFDEQFMEEG-INIZCTEOSA-N 387.826 5.342 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)ccc1OCC(C)C 614179832 OKZOYLGFAKDUPA-GOSISDBHSA-N 380.532 5.382 30 20 GKED N[C@H](CC(F)(F)F)c1ccc(-c2cc(F)ccc2OCC(F)(F)F)cc1 629736252 MTHUKEHHFCPGEX-CQSZACIVSA-N 381.291 5.386 30 20 GKED Cc1cc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2cccc(F)c2n1 675790007 PRNLPCSKHRKPMC-GHMZBOCLSA-N 380.307 5.249 30 20 GKED CCCCCNC(=O)[C@@H](C#N)C(=O)c1cc(C)c(-c2cccc(Cl)c2)s1 726732976 NTJUGPZFJZHLHE-INIZCTEOSA-N 388.920 5.006 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1N[C@H](C)C(=O)Nc1ccccc1C#N 728066914 VWIFXAQWRPYMNG-MOPGFXCFSA-N 399.494 5.446 30 20 GKED CC(C)c1ccc(SCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730417049 KDIUQRCHBSMVGY-INIZCTEOSA-N 384.501 5.527 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1csc2ccccc12 731113969 AOTBWLLSYLCUMY-LSDHHAIUSA-N 395.553 6.036 30 20 GKED CC(C)n1cc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)cn1 732713686 FHCVOMDHJOGBHT-OQLLNIDSSA-N 383.904 5.453 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3Cl)s2)c1 733800025 BKQVALAOEXLJRR-QGZVFWFLSA-N 396.943 6.039 30 20 GKED C=CC[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccncc1 734510710 YUXKXJRQOFDKJY-FQEVSTJZSA-N 393.418 5.328 30 20 GKED Cc1cccc(NC(=O)[C@H](C)SCc2cc(Cl)ccc2OCC#N)c1C 735318327 LELMIZFIFQBBRL-HNNXBMFYSA-N 388.920 5.120 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3cscn3)n2)o1 735417258 SEXZSURFGCRKCY-UHFFFAOYSA-N 381.404 5.289 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccc(OC3CCCCC3)cc2)c1 735443153 LKWVGVMMLDKEAA-HXUWFJFHSA-N 392.499 5.009 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)N[C@@H]2CCc3ccccc3C2)cc1 742984829 NMSCHWSJYWDAAV-RPWUZVMVSA-N 397.547 5.186 30 20 GKED Cc1nc(NC(=O)c2sccc2-c2ccc(F)cc2)sc1SCC#N 744325393 HHGXKMKJRCTLSR-UHFFFAOYSA-N 389.502 5.187 30 20 GKED CCCCn1nc(C)c(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1Cl 745990246 PGPXMOSEWKSTRZ-KTKRTIGZSA-N 379.891 5.603 30 20 GKED C[C@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ccc(-c2cccc(C#N)c2)cc1 757659985 XJLUOSLENWBVMC-LSDHHAIUSA-N 378.422 5.621 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2c(Cl)oc3ccccc23)ccc1OC 761312556 IDXHCBGVVDKAOH-HNNXBMFYSA-N 384.863 5.066 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1ccc2ccccc2n1 770842852 KVSHUAJSNJWKMN-SFHVURJKSA-N 382.385 5.453 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccc(Cl)cc2)no1 775669633 FWEHCJLMCIRMJZ-CQSZACIVSA-N 380.879 5.042 30 20 GKED C[C@H](Nc1ccc(CN2CCc3ccccc32)cc1)c1ccc(OCC#N)cc1 777657234 DFTNEBQZEURWTO-IBGZPJMESA-N 383.495 5.325 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c(Cl)nc4ccccn34)cc2)c1 779594079 CRZGIBXOLDKEIJ-UHFFFAOYSA-N 388.858 5.050 30 20 GKED Cc1nc(NC(=O)Nc2ccccc2O[C@H](C)C#N)sc1-c1ccccc1 780017298 ZRLJLSYUGBAFRC-CYBMUJFWSA-N 378.457 5.053 30 20 GKED C#CCC1(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)CCCCC1 788433474 XSZTVQKGRFSZOE-IBGZPJMESA-N 388.511 5.090 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 793362071 SAPLJUVCDRNZKX-UHFFFAOYSA-N 397.450 5.226 30 20 GKED CC(C)(C#N)c1ccc(C(=O)O[C@H](C(=O)Nc2ccccc2)c2ccccc2)cc1 796041493 VDFVLJSYRGDBFM-QFIPXVFZSA-N 398.462 5.025 30 20 GKED COc1ccc2cc(NC(=O)c3occc3COc3cccc(C#N)c3)ccc2c1 803453774 SPYYETJQLFDLHZ-UHFFFAOYSA-N 398.418 5.144 30 20 GKED C#C[C@H](NC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccc(Cl)cc1 810185170 NHMWSYWKFDDDQV-SFHVURJKSA-N 397.906 5.129 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H](c3ccccc3)C2)cc1 814576881 IJPZXXPCHFDDSI-ZCYQVOJMSA-N 395.506 5.754 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cc(Cl)ncc3Cl)c2C#N)[C@H](C)C1 839389343 OJRYSGHKGYBDNO-DTWKUNHWSA-N 380.300 5.260 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842940494 BGWMYZVAIXDREE-BFHYXJOUSA-N 377.296 5.307 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)SC1=Nc2ccccc2CS1 857759099 WACFLNSSTFTAOX-CQSZACIVSA-N 388.583 5.319 30 20 GKED C=CCCC[C@@H](NCc1ccccc1Oc1ccc(F)cc1Cl)C(=O)O 900068464 IWFPKYQXMQDZHK-QGZVFWFLSA-N 377.843 5.171 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3ccc4ccccc4c3)n2)cc1 916628654 XMPGCOGPCGWWHT-OAQYLSRUSA-N 398.487 5.527 30 20 GKED C[C@H](Cc1ccccc1F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919773624 VDALMDLUGJRQLF-VGSWGCGISA-N 387.458 5.234 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 920223204 CHSWLZAFNXMCAE-UHFFFAOYSA-N 378.815 5.287 30 20 GKED CC(C)(C)CC(=NNc1ccccc1C(=O)O)c1ccc(Br)cc1 1776030821 VDMASOJTDTYYHK-UHFFFAOYSA-N 389.293 5.400 30 20 GKED CCC(=NNc1ccc(C)c(Cl)c1)c1ccc(OCCCCC(=O)O)cc1 1776034828 BJSMASBMXKYZDK-UHFFFAOYSA-N 388.895 5.508 30 20 GKED Cc1cccc(Cl)c1NN=Cc1ccc(-c2cccc(CC(=O)O)c2)cc1 1776060564 AVGNUYMHSIESDL-UHFFFAOYSA-N 378.859 5.389 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)s2)cc1 1776125759 RWYPDYXGFRHUIG-BYIUCRAPSA-N 386.513 5.938 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cc1)C(=O)O 1776469860 WPTQURNFDHBJSW-IIEJUSTOSA-N 378.449 5.163 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)ccc1OCC(=O)O 1777289035 KGNWEGLRNGPAQK-QPEQYQDCSA-N 394.467 5.102 30 20 GKED O=C(O)c1cncc(C(=O)/C=C\c2ccccc2OCCC2CCCCC2)c1 1777694975 MZCZJVFBCFTJTM-KHPPLWFESA-N 379.456 5.025 30 20 GKED Cc1nc(SCC(=O)Nc2ccccc2-c2ccccc2)c(C#N)c(C)c1C 5172338 IDQNQSXMXKEYOO-UHFFFAOYSA-N 387.508 5.276 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)n1C 41538105 MUHXAMYOSUDUMJ-CYBMUJFWSA-N 390.295 5.254 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)n2)cc1 64379809 LDELMCNGDGPNEJ-DLBZAZTESA-N 379.872 5.077 30 20 GKED COc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 66955052 UTNYZLHPHXZKIM-AEFFLSMTSA-N 395.528 5.111 30 20 GKED Cc1ccc(C[C@@H](NC(=O)Nc2ccc(C#N)c(Cl)c2)c2ccccn2)cc1 97573089 RLLLBKVQWHROMW-OAQYLSRUSA-N 390.874 5.021 30 20 GKED Cc1noc(C)c1[C@@H](C)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116646262 MUROMZZZQIHEOO-GFCCVEGCSA-N 395.846 5.100 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1CCC(F)(F)F 126176398 UZEJTKJGHHIMQL-UHFFFAOYSA-N 380.385 5.541 30 20 GKED CC(C)n1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C1CC1 127960808 VMYYYLBHHLEPMV-UHFFFAOYSA-N 386.455 5.258 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 156468306 SGNBTMXHBQRXQN-GFCCVEGCSA-N 391.496 5.123 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3-c3cc(F)c(F)c(F)c3)cc2)CC1 181553848 VWYIBDSBIYYEGB-UHFFFAOYSA-N 392.380 5.578 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H]1OCCc2ccccc21 303593604 IJHXNANTTOGPPG-DEOSSOPVSA-N 398.462 5.302 30 20 GKED C[C@@]1(O)CCCN(C(O)=Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 329824196 HSOHAYSGWXXWDG-HXUWFJFHSA-N 390.936 5.274 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@H]1c1noc(C)n1 373697155 OTFNNVXFOVRJPI-IBGZPJMESA-N 382.508 5.379 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432488538 KKZPMQLGPFJLOO-QFIPXVFZSA-N 377.532 6.490 30 20 GKED N#CCCC[C@@H](NCc1cccc2c(Br)cccc12)c1ccccc1 433020774 UFQHWOKHHXRJRC-JOCHJYFZSA-N 393.328 6.127 30 20 GKED CCCCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@H](C)c1ccccc1 435127747 ACJXAVQSPYPYDC-HXUWFJFHSA-N 387.531 5.222 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@H](C)c1ccccc1Cl 437825450 AJJMWFHWKAWWDZ-CQSZACIVSA-N 383.879 5.368 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ncc(Cc2cccc(F)c2)s1)c1ccccc1 439130558 KOZHICBWBYVNKL-LJQANCHMSA-N 394.475 5.040 30 20 GKED Cc1ccc(OCc2ccccc2)c(NCc2nnc(-c3cccc(C#N)c3)o2)c1 442113137 WNBZPMZQRMNTOU-UHFFFAOYSA-N 396.450 5.108 30 20 GKED N#CCCCn1cc(C(=O)Nc2nc(-c3cccs3)cs2)c2ccccc21 444189861 VJLUURFJPFOUAZ-UHFFFAOYSA-N 392.509 5.382 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCCCc4ccccc43)cc2)nc1 460494294 UQSRRZNHWSNPFL-UHFFFAOYSA-N 383.451 5.119 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 466955820 UWHCCCYWUYEDBN-UGKGYDQZSA-N 391.515 5.086 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCCC[C@@H]2CC(=O)c2ccccc2)cc1 476236916 KYQHTEDVIYBMTG-JOCHJYFZSA-N 388.511 5.146 30 20 GKED N#C[C@H](C(=O)c1cccc(OC(F)(F)F)c1)c1nc(-c2ccccc2)cs1 477876702 LIEYUURLZVUKKS-OAHLLOKOSA-N 388.370 5.199 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@H]1c1ccccc1 480590702 ZLLCAUNDOJIYPI-GAJHUEQPSA-N 383.451 5.575 30 20 GKED C=CCn1c(S[C@@H](Cc2ccccc2)c2ccccc2)nnc1-c1cccnc1 496430981 WFQOIZDVVHTCBM-QFIPXVFZSA-N 398.535 5.602 30 20 GKED C=CCn1c(S[C@H](C)c2cccc(Cl)c2)nnc1-c1ccccc1OC 498747161 OWWGOAVMFXRRQO-CQSZACIVSA-N 385.920 5.646 30 20 GKED CC(C)c1ccc([C@H](NC(=O)NCc2ccc(C#N)cc2)c2cccs2)cc1 500429233 NJIRUWPVZYKQNE-QFIPXVFZSA-N 389.524 5.332 30 20 GKED CC[C@@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)cc1 503019060 VPXOQGRYKUKHRO-SJORKVTESA-N 382.529 5.612 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 504077471 SFHZUYDBSYYTCT-DSKINZAPSA-N 396.918 5.529 30 20 GKED CC(C)[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 504225619 IOJOJSSMQGKYQC-UUOWRZLLSA-N 383.495 5.237 30 20 GKED C=C(C)[C@@H](NC(=O)C[C@H](c1cccs1)n1cccc1)c1ccc(F)c(F)c1 505965485 VDNPEIANROGUOD-WIYYLYMNSA-N 386.467 5.241 30 20 GKED C[C@@H](NC(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21)c1ccc(C#N)cc1 509904787 KZLIVWQPIIRDFU-UZUQRXQVSA-N 397.478 5.109 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1 510842395 OVLJYZZDKBDEJR-UHFFFAOYSA-N 393.849 5.144 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC[C@@H]2C2CCCCC2)cc1 511024386 BTNABWCSHDIOMG-JOCHJYFZSA-N 395.547 5.077 30 20 GKED Cc1ccc2oc(C(=O)N(Cc3cccc(C#N)c3)c3ccc(F)cc3C)cc2n1 511544411 ZDBMFDQNEHUHAI-UHFFFAOYSA-N 399.425 5.302 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)cc2n1 511912886 XIMPTPYJOVRYDR-UHFFFAOYSA-N 397.434 5.148 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(C#N)cc2F)c2ccc(F)cc2)cc1 512644191 ZZADYIXHGHTEGN-CMJOXMDJSA-N 378.422 5.285 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 520323505 GPOQHFKZXPMXJG-UHFFFAOYSA-N 397.887 5.123 30 20 GKED Cc1cc(Cl)ccc1NC(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1 520635247 MWFYPYSVXIPVHP-UHFFFAOYSA-N 391.858 5.363 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 521016081 FVICEPNWDOECQP-MEDUHNTESA-N 398.837 5.220 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc(CC(C)C)n3)n2)cc1 521177325 QUYXVFAODFOSNH-OAHLLOKOSA-N 381.526 5.264 30 20 GKED Cc1ccc2oc(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cc2c1 521259820 WCQVDJOLKRHZKB-CYBMUJFWSA-N 394.402 5.633 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1oc(C(C)C)nc1C 521917775 FIXLIMOAEHWNIX-UHFFFAOYSA-N 391.446 5.273 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3cccs3)c2)c1 522306470 RYBWAIFLYBRNND-OAQYLSRUSA-N 388.492 5.176 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2ncc(-c3ccccc3)o2)n1 522856206 LKLITAAYYXUEAO-LBPRGKRZSA-N 389.402 5.789 30 20 GKED O=C(NCc1ccccc1OC(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 524441671 VZZODXLCBFMXRD-UHFFFAOYSA-N 396.262 5.065 30 20 GKED Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 539492997 DIBUWDJDEZUAOK-SBUREZEXSA-N 393.556 5.069 30 20 GKED CCN(C(=O)c1ccc(Cl)c(C#N)c1)[C@H](c1ccc(C)cc1)c1cccnc1 541625153 IQCBHUOKOZBTLO-JOCHJYFZSA-N 389.886 5.167 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(C)c1ccc(C#N)cc1 541936488 ZYSNXTLWOUQGGK-UHFFFAOYSA-N 386.238 5.105 30 20 GKED N#CCC1CCN(C(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)CC1 541979108 NVMPCUSGEVLNJK-UHFFFAOYSA-N 388.389 5.264 30 20 GKED Cn1cc(CN2CC[C@@H](C(F)(F)F)c3ccccc32)c(-c2ccc(C#N)cc2)n1 552316842 OOXGFSNZUNKNHZ-LJQANCHMSA-N 396.416 5.015 30 20 GKED N#CCCC[C@H](N[C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 556205768 MQUSHLLVLYNHCL-BVSLBCMMSA-N 377.488 5.331 30 20 GKED COc1ncc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1Cl 560234629 JWUMFLIPCWZSQW-HZPDHXFCSA-N 391.902 5.694 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 563656591 MKXYVCHUDNHUSE-UHFFFAOYSA-N 399.450 5.046 30 20 GKED N#Cc1ccc(CN2CCC(Nc3ccc4nc(C(F)F)sc4c3)CC2)cc1 572081898 YVJANCXLBSNXAI-UHFFFAOYSA-N 398.482 5.182 30 20 GKED Cc1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)c(OC2CCCC2)c1 589133850 GLTVFIIHPHIHJO-LJQANCHMSA-N 387.483 5.606 30 20 GKED N#CC1(CC(=O)Nc2ccc(Oc3nncc4ccccc34)cc2)CCCCC1 597479403 ZYGHEONQVIKQPQ-UHFFFAOYSA-N 386.455 5.225 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(Oc2ccccc2)cc1 608861139 WQVHFXOYXYENOA-FQEVSTJZSA-N 386.495 6.012 30 20 GKED N#Cc1ccccc1NC(=O)c1oc2ccccc2c1CSc1cccs1 609092277 GPJWSYOVPDPEOR-UHFFFAOYSA-N 390.489 5.911 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 609460488 BGPQICXCDVMPOK-HXUWFJFHSA-N 398.293 5.082 30 20 GKED Cc1ccc2c(c1)N(C(=O)c1cccc(COc3cccc(C#N)c3)c1)CCC2 609644314 IJACAZNCXNDSGZ-UHFFFAOYSA-N 382.463 5.039 30 20 GKED C=CCN(C(=O)c1cc2cccc(OC)c2o1)c1nc(-c2ccccc2)cs1 642288852 BKJCPQGFRWHLIU-UHFFFAOYSA-N 390.464 5.398 30 20 GKED Cc1cc(F)cc(C)c1C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 666254017 SCTQVPPHLLPOAS-QWRGUYRKSA-N 385.323 5.082 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 729082564 UOBCOGYPOLJXTI-OXJNMPFZSA-N 390.508 5.579 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccnc3SC(F)F)c2)cc1 729375940 XTQOBIOLAOHVLW-UHFFFAOYSA-N 397.406 5.313 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2s1 730685033 GCEYJJULWMNCDR-SMDDNHRTSA-N 389.307 5.658 30 20 GKED Cc1ccc(/C=C2\SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)cc1F 731500363 AZRMZISJCNAZCV-APSNUPSMSA-N 388.876 5.065 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=S)Nc2ccc(Cl)cc2Cl)c1 733755111 NVMMIXMUZHODPI-CQSZACIVSA-N 394.327 5.161 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc(C)n(C3CCCCC3)c2C)c1 733789914 YZBZNEQFVNLLCE-OAQYLSRUSA-N 393.531 5.221 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1CN(C)[C@H](c1ccccc1Cl)C(C)C 739855146 QTGRXVJRLIOFAK-NRFANRHFSA-N 393.922 5.065 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3nc4ccsc4s3)c2)s1 740455446 SEHSVKCXNLGVFT-UHFFFAOYSA-N 396.522 5.280 30 20 GKED Cc1cc(C(=O)Nc2ccccc2OCC2CC2)c(C)n1-c1ccc(C#N)cc1 740849532 COIBFNCRDMXXGL-UHFFFAOYSA-N 385.467 5.007 30 20 GKED C[C@@H]1/C(=C\c2nccn2Cc2ccccc2)C(=O)c2cccc(Br)c21 742434993 PFGQDCJUYHPURI-RFRKOGIWSA-N 393.284 5.077 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(N2CCCCCC2)cc1 743056616 IGQCLYNJMYFGJP-VGOFMYFVSA-N 399.494 5.545 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 743462107 FNEQTMVKSRHQPB-HNNXBMFYSA-N 396.462 5.632 30 20 GKED C[C@@H]1CN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)[C@@H]1c1ccccc1 743626610 YBAKEJSYPQKGKL-ZHRRBRCNSA-N 387.508 5.189 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N(Cc2ccco2)c2ccccc2C#N)s1 744358237 HYQQBKBEAITETA-ZHACJKMWSA-N 391.496 5.152 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(C2SCCS2)cc1 747979078 VNTILNRCJXLGQN-UHFFFAOYSA-N 383.542 5.111 30 20 GKED COc1cc(C(=O)/C=C/c2coc(-c3ccccc3)n2)ccc1SC(F)F 749891406 JIKJUFUQTIPETK-CMDGGOBGSA-N 387.407 5.561 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(OCC(F)(F)F)c(F)c1 758014690 BSRCZEZNKDFNCZ-FNORWQNLSA-N 384.373 5.057 30 20 GKED CCNc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 759226262 HWFSGJQKCNTSAK-UHFFFAOYSA-N 392.484 5.108 30 20 GKED C[C@@H](OC(=O)c1cc2ccccc2n1CC#N)c1nc(-c2ccccc2)cs1 767979296 GXYNKJHYIQYLML-OAHLLOKOSA-N 387.464 5.206 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1C(=O)N(CCC)C(C)C 771529147 VSUMDVVHEJOGNM-UHFFFAOYSA-N 393.531 5.167 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=S)Nc2ccccc2Cl)cc1 773159819 IBPYMJXQUOMIIV-UHFFFAOYSA-N 377.900 5.365 30 20 GKED C[C@@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 776083828 CILMSLOKIAVSPK-UWJYYQICSA-N 399.519 5.517 30 20 GKED N#C[C@@H](C(=O)c1ccc(N2CCCCC2)cc1)c1nc2cc(Cl)ccc2s1 777304682 XBNNVSGXIRUQHJ-KRWDZBQOSA-N 395.915 5.430 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)c(=O)oc2ccccc12 777973361 JZBSXXQXMXZRMN-UHFFFAOYSA-N 396.402 5.018 30 20 GKED CC1(C#N)CCN(C(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)CC1 780780572 URVDOVJNJIYWNO-UHFFFAOYSA-N 395.915 5.383 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc([N+](=O)[O-])cc3Cl)c2)s1 784560470 MKUGTPZSVPZGDW-UHFFFAOYSA-N 383.860 5.138 30 20 GKED CC(C)Oc1ccc([C@H]2CCCC2=NNc2nnc(-c3ccccn3)s2)cc1 788028562 NFLBDYKMDIZPFP-QGZVFWFLSA-N 393.516 5.123 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CCc3c(sc4ccccc34)C2=O)cn1 792886227 SVFLLTYTSXFPCZ-FOWTUZBSSA-N 398.487 5.579 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H](OC2CCCC2)c2ccccc2)s1 797568695 LINZISAGMFJTAP-XLIONFOSSA-N 382.529 5.317 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@H]2CCC(F)(F)C2)cc1Cl 797831533 RZFHCAPZNMTVNR-RDTXWAMCSA-N 388.845 5.759 30 20 GKED O=C(C[C@H]1CCC(F)(F)C1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 797975322 GTQVMDFTVRUHOF-RNCFNFMXSA-N 389.286 5.251 30 20 GKED N#Cc1ccc2c(c1)C(=O)/C(=C\c1csc(COc3ccc(Cl)cc3)n1)C2 811696935 WUFGNHZFESERTE-DHDCSXOGSA-N 392.867 5.070 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)F)cc2F)cc1 847625899 ANIJDFHGHZEFMD-SJKOYZFVSA-N 388.389 5.238 30 20 GKED O=C(O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ocnc1C(F)F 860578079 UNHQVXUKILUBCJ-JTQLQIEISA-N 389.198 5.091 30 20 GKED Cc1sc2ncn(N=Cc3ccc(-c4cccc(Cl)c4)s3)c(=O)c2c1C 914692376 QLIGHXMXJYPHMJ-UHFFFAOYSA-N 399.928 5.339 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1[nH]c(-c2ccccc2)nc1C 915111157 AVALAEYPZRBPKE-UHFFFAOYSA-N 394.693 5.576 30 20 GKED O=C(/C=C/c1ccc2ncccc2c1)c1ccc(OC(F)F)cc1OC(F)F 916140187 FIILNBCPEZAKEZ-XBXARRHUSA-N 391.320 5.334 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cc(Br)ccc1F)c1ccc2ccccc2n1 916848619 FRNGZQKSYSCARE-CXSQMQJXSA-N 395.231 5.026 30 20 GKED C/C(=C\C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 917806239 XSJMHKCRCZXFEO-HTXNQAPBSA-N 382.463 5.374 30 20 GKED Cc1ccc2nc(-c3ccc(NC(=O)c4ccccc4OCC#N)cc3)sc2c1 919839330 ACGPAXCPOQKXAR-UHFFFAOYSA-N 399.475 5.426 30 20 GKED C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 921006069 PGPFOUBSZAIVOL-MUYACECFSA-N 399.350 5.030 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ccccc3C(F)(F)F)s2)c1 1776033152 FBZRKTKJWDPJKO-UHFFFAOYSA-N 390.386 5.578 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C)cc3)s2)cc1CC(=O)O 1776131746 DEPMHKQUORDKPY-CSKARUKUSA-N 392.476 5.255 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2ccccc21 1776308878 ULUMZPWSDJJEMH-BCGDRIGESA-N 382.459 6.071 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C(F)(F)F)cc1F 1776354379 CFGIETWGNRIEKY-QPJJXVBHSA-N 396.336 5.226 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(N2CCCCC2)cc1 1776354553 PNFMDSNWQUELDF-XYOKQWHBSA-N 393.483 5.058 30 20 GKED CCCCCCCOc1ccc(CN[C@@]2(C(=O)O)CCCC(C)(C)C2)cc1 1776786410 FPFHHBXJMWLCPW-QHCPKHFHSA-N 375.553 5.549 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2ccc(C)c(F)c2)c1 55012352 HHLRCAAKNGZHRL-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H](C)c1cccs1 56800295 UNEFZJHWGDHCNL-INIZCTEOSA-N 391.496 5.945 30 20 GKED C=CCn1c(SCc2ccc(Br)cc2Cl)nnc1C1CC1 60797938 XFJGRQQZICZGKK-UHFFFAOYSA-N 384.730 5.050 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)c3cccs3)n2)cc1 115908997 POBLGWJSUCDQQG-HNNXBMFYSA-N 382.510 5.034 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2c1 154680844 MQKMWTZIIMFQCQ-KRWDZBQOSA-N 391.496 5.191 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 156956045 BHJHAMJLLQOXRK-ZDUSSCGKSA-N 393.418 5.227 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)c1ccccn1 173950924 ZSUILKRFTHYAFJ-CYBMUJFWSA-N 384.222 5.066 30 20 GKED CC(C)Cc1ccc([C@@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 175502755 AREABMNREOWLRL-QHCPKHFHSA-N 388.515 5.294 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 179028607 WAZHAGLYGFGLGH-JIIJFUIFSA-N 379.872 5.138 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)Cc1ccc(Cl)cc1 179808265 ILIJVHIBBXMXHK-KBXCAEBGSA-N 395.915 5.304 30 20 GKED CCC[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 181767521 RABGICYFTNAGHZ-PKOBYXMFSA-N 381.545 5.150 30 20 GKED C#CCCCCC(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 182769342 RFTSTDDMIAETPE-UHFFFAOYSA-N 378.497 5.553 30 20 GKED C=C(C)[C@H](NC(=O)CCc1nc(C)c(-c2ccccc2)o1)c1ccc(F)c(F)c1 186060044 SAWSBZXJRRBQEG-QFIPXVFZSA-N 396.437 5.294 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)Nc2ncccc2OCCCC#N)o1 188721231 MWGQJHADNDDKFQ-GOSISDBHSA-N 396.491 5.069 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1ccc(-c2cccnc2)cc1 191821802 PCFINIUSBXETEW-HNNXBMFYSA-N 392.300 5.234 30 20 GKED CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 281544413 XFGOWURSVSYFPJ-SJLPKXTDSA-N 397.548 5.056 30 20 GKED N#Cc1ccc(N[C@H](c2cccc(F)c2)c2ccccn2)c(Br)c1 301880300 JVKPDZFJUIGUGJ-LJQANCHMSA-N 382.236 5.056 30 20 GKED OC1=Nc2cc(F)ccc2[C@H](/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)C1 329525705 SRPPIMZUWJQGTG-MSOLQXFVSA-N 396.466 5.247 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CC[C@@H](c2ccccc2F)C1 432088655 KIWNDCIGLKQQPD-BRWVUGGUSA-N 397.519 5.535 30 20 GKED CC(C)n1ncc2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc21 432766316 BTPWENHZJVDXPK-FQEVSTJZSA-N 375.476 5.174 30 20 GKED Cc1nc(NC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)sc1SCC#N 433616151 LALPHVVXFLCKKS-UHFFFAOYSA-N 399.463 5.159 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@@H](CCC#N)c3ccccc3)sc2C)cc1 439668649 BKYPCTULELIJAW-NRFANRHFSA-N 390.508 5.507 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(CCC(F)(F)F)c1 441144455 WXRAKLLQFRLUJX-UHFFFAOYSA-N 380.385 5.541 30 20 GKED CSc1ccccc1[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 441624432 WPRLLGSJNUUDTM-GJZGRUSLSA-N 385.558 5.685 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccco1 454752179 LEVKDKJCZBSGAH-KXBFYZLASA-N 381.501 5.290 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c(C)c1 458855412 YAVYDELWABIFEC-GGAORHGYSA-N 375.516 5.238 30 20 GKED N#Cc1nnc2ccccc2c1NCc1ccc(Oc2ccccc2F)c(F)c1 462914582 RMDVDCIVAJOJNY-UHFFFAOYSA-N 388.377 5.184 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1coc(-c2cccc(Cl)c2)n1 464814360 LOUVYKLMAHPRLS-RTWAWAEBSA-N 377.875 5.267 30 20 GKED CC[C@H](NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1ccc(Cl)s1 465921106 JTFWVYLASDUJQT-IXDOHACOSA-N 387.936 5.334 30 20 GKED CCOc1ccc([C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)c2ccccc2)cc1 474786212 QIFHBZVAASAVIU-ZEQKJWHPSA-N 398.506 5.378 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cc(C)c(OC)c(C)c1 475552878 SUJXHWIQAZGEJN-UHFFFAOYSA-N 380.532 5.828 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476061273 LJJHKILROKDYKM-UHFFFAOYSA-N 384.479 5.628 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1 479140038 SIICINROWMOXHG-QGZVFWFLSA-N 398.555 5.119 30 20 GKED C=CCn1c(SCc2csc(CC)n2)nnc1-c1cccc(Cl)c1 481346731 XNQVLJRDHCRRHE-UHFFFAOYSA-N 376.938 5.096 30 20 GKED Cc1c([C@@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)cnn1-c1ccc(F)cc1 481659073 ILCKXILDERXCGQ-GYCJOSAFSA-N 388.490 5.310 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3c(Cl)cc(Cl)cc3C2)cc1 483030701 RQVSWSHQMXJUKP-UHFFFAOYSA-N 388.298 5.385 30 20 GKED CCCN1Cc2cccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)c2C1 484248590 BGIBOPZEDOIHCB-UHFFFAOYSA-N 397.478 5.328 30 20 GKED CCC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 489163423 QNIXKCUPTAHXIU-IBGZPJMESA-N 382.891 5.141 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1csc(-c2ccc(C(C)C)cc2)n1 493202280 GJYWPQFUQNBXLN-UHFFFAOYSA-N 377.469 5.066 30 20 GKED C[C@H](CCCC(F)(F)F)NCc1cccc(OCc2cccc(C#N)c2)c1 494846319 QCZOJZQBXOMMHN-MRXNPFEDSA-N 376.422 5.348 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 497541746 OGTFPIQNNRGZPO-ZWKOTPCHSA-N 396.462 5.411 30 20 GKED C[C@H](c1nc(-c2ccc(Cl)cc2)no1)N1CC=C(c2ccc(C#N)cc2)CC1 502530917 SXQVZZBUTDYMSO-OAHLLOKOSA-N 390.874 5.112 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)CC2)cc1 503874327 NQDPZZLQUSDLPW-RBUKOAKNSA-N 397.305 5.284 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 510664893 QHHHLOIQAQOMRV-HSZRJFAPSA-N 397.478 6.028 30 20 GKED C[C@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(F)(C#N)CC1 510936603 MISPFXHZYOBITC-MRXNPFEDSA-N 396.897 5.127 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1C[C@H](C)C[C@@H]1c1ccccc1 513235298 AKXYQMFEUOTLPM-LVCYWYKZSA-N 393.556 5.102 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2Cl)c1 518372931 GHLJEJYXIMBLGQ-IRXDYDNUSA-N 389.282 5.418 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519977104 HGLHMNBLMQZNOZ-UHFFFAOYSA-N 388.492 6.103 30 20 GKED Cc1ccc(-c2ccncc2)cc1N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1 522438650 FTXZZHHZPUKTHC-HNNXBMFYSA-N 390.874 5.021 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CC)c1cc(F)ccc1F 524926181 HGKMEJQSMVERFJ-MRXNPFEDSA-N 384.879 5.529 30 20 GKED COc1ccc(CNC(C)(C)c2nc3ccccc3s2)cc1OCCCC#N 527746346 WCWQPNOSXLRWLR-UHFFFAOYSA-N 395.528 5.012 30 20 GKED CC(C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 543758356 BEKTURVJSYBHOH-UHFFFAOYSA-N 384.888 5.410 30 20 GKED N#C[C@H](C(=O)c1cncc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 543986627 AGFKXEQYVPWART-CQSZACIVSA-N 391.402 5.127 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(SCc2ccccc2Cl)cn1 544884447 PBWUGANLTBHLLG-UHFFFAOYSA-N 385.901 5.213 30 20 GKED N#Cc1ccc(C(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)cc1Cl 548616499 MLKBDWPAFJOTJA-UHFFFAOYSA-N 390.792 5.160 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc(-c3ccccn3)cc2)c1 558562840 PEGRZVAKLMUKIG-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@@H](N[C@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1ccc(C#N)cc1 558872897 QTGJMXBMIIDIRE-UNEAEHENSA-N 393.962 5.476 30 20 GKED N#CCc1ccc(C[S@@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 559231945 SHCYHQPPMRFOLY-BKMJKUGQSA-N 379.912 5.444 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCSCc3ccccc3)cc2)ccn1 562911304 MCTGMBRDYKOCES-UHFFFAOYSA-N 389.480 5.008 30 20 GKED C[C@@H]1CC(CCNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C[C@@H](C)O1 564741044 NQUSIOPWAXYIFY-IAGOWNOFSA-N 393.487 5.066 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1 580766843 KLBUEBOWWFKAHU-QGZVFWFLSA-N 386.455 5.013 30 20 GKED CSc1cccc(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 583054210 HYBNPQNQGKLVJZ-UHFFFAOYSA-N 376.441 5.111 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3cc(OC(F)F)ccc32)c(C(F)(F)F)c1 589310505 GLOABQPNBFMYIT-GOSISDBHSA-N 396.359 5.346 30 20 GKED CCOC(=O)c1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)ccc1Cl 590108912 GPPSOSBRRMXSJT-IBGZPJMESA-N 399.878 5.073 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3sccc3OC(F)F)n2)cc1 591861827 FQPKAJXMRAXAPB-GFCCVEGCSA-N 390.436 5.272 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)cs2)cc1 592973385 FHBHEWJGOIOIOR-AWEZNQCLSA-N 393.468 5.357 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](C)(c2cccc(F)c2)C1 593157434 ITENVSGLNXSKHH-KSFYIVLOSA-N 397.519 5.415 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](CCF)C2)cc1Cl 596690590 HDICLPXIHGRKNR-OXJNMPFZSA-N 399.897 5.599 30 20 GKED CC[C@](C)(NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 596695134 PXDQEHFDFNNTMH-QHCPKHFHSA-N 377.488 5.032 30 20 GKED CC[C@@H](C)Cc1c(C)sc2nc(S[C@H](C#N)Cc3ccccc3)nc(O)c12 598795118 FZIUARJITAAZNN-CJNGLKHVSA-N 397.569 5.521 30 20 GKED N#CCCN(Cc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1)Cc1ccco1 599306873 DQUXQDGQYSHACE-UHFFFAOYSA-N 393.340 5.008 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccco1 599390795 QMCCMSVYRALORQ-GFCCVEGCSA-N 382.407 5.436 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 603969060 YNMPWYMMOFTVDW-UHFFFAOYSA-N 387.258 5.203 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1cccc(C#Cc2cccs2)c1 606548611 HIGRYXLPFJYKFM-NRFANRHFSA-N 375.497 5.158 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4occc4s3)cc2F)c1 609857467 MGKVXCYFNLJYPT-UHFFFAOYSA-N 392.411 5.336 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1sc(C)c(C)c1C#N 610037117 XVQCXFQRGCRUIU-UHFFFAOYSA-N 380.391 5.073 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 610334682 KULJAADWCNWWIG-UHFFFAOYSA-N 381.432 5.215 30 20 GKED CN(C(=O)c1cc2ccccc2n1CC#N)C1c2ccccc2-c2ccccc21 610483520 KAKYTJBUMMFAKF-UHFFFAOYSA-N 377.447 5.007 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1sc(-c2ccccc2)nc1C(F)F 611185421 QSAVPCMOBYHWAU-UHFFFAOYSA-N 377.460 5.150 30 20 GKED CC(C)(c1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1)C(F)(F)F 647379574 WHDATVBZVJCCSC-AWEZNQCLSA-N 378.419 5.350 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccccc2F)cc1 726858702 SRBQGYHWEUDZDM-FTRWYGJKSA-N 380.463 5.180 30 20 GKED CC(C)c1nc(C#N)c(NN=C2CCCc3nc(-c4ccc(F)cc4)sc32)o1 727684336 HHFVCZIXNPKWEJ-UHFFFAOYSA-N 395.463 5.085 30 20 GKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 727955673 MVHJTZOZIAJCCB-LPHOPBHVSA-N 379.529 5.855 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 729575824 DTGSXCYSGUXKGV-UHFFFAOYSA-N 381.476 5.254 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C/c1cn(Cc3ccccc3)nc1-c1cccnc1)C2 730948479 GPXXRJXZQVPEQS-HYARGMPZSA-N 391.474 5.124 30 20 GKED O=C(/C=C\c1ncc(-c2cccc(Br)c2)[nH]1)c1ccc(F)c(F)c1 731936587 BKKULHNNSUWOGU-SREVYHEPSA-N 389.199 5.014 30 20 GKED C/C(=C\C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1cccc(F)c1 731972874 PJZLBQYCXUYGPO-NTCAYCPXSA-N 387.414 5.235 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H]3CCc4ccccc4C3)n2)cc1 732596102 KJZNUHVHWBLRNE-UTKZUKDTSA-N 386.520 5.490 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNCc1ccc(C(F)(F)F)cc1 732924912 NSTKXMCVVFGEJA-UHFFFAOYSA-N 378.728 5.084 30 20 GKED C=CC[C@H](NC(=O)N(CCc1ccccc1F)C1CCCC1)c1ccncc1 734682406 CWAULTYWUOMZQT-QFIPXVFZSA-N 381.495 5.035 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1 741474853 ZWWBYYLSBTUOIH-YFHOEESVSA-N 381.435 5.043 30 20 GKED O=C(/C=C/c1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1F 743056833 MUMCSHXYNNEMEI-SEJWUHKESA-N 378.802 5.072 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)C1CCC(c2ccccc2)CC1 744028669 NGFPPSOEBZACRT-IRSIHTCSSA-N 396.490 5.461 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)cc1 748585081 WORUMKNJBVGSCS-AUWJEWJLSA-N 379.456 5.108 30 20 GKED O=C(/C=C/c1cc2ccccc2o1)c1ccc(S(=O)(=O)C2CCCC2)cc1 749004192 AVYSUVVAHTUJNS-SDNWHVSQSA-N 380.465 5.045 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1C 750912505 GGKZXIFOBNYIIY-TWGQIWQCSA-N 399.834 5.238 30 20 GKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 753920115 DRFOIUYQEFFJHU-HLLBOEOZSA-N 393.437 5.597 30 20 GKED COc1cc2c(cc1NC(=O)CSc1cccc(C#N)c1)oc1ccccc12 759056587 WQUGHRQRNYPMPT-UHFFFAOYSA-N 388.448 5.197 30 20 GKED C=CC[C@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccncc1 766019873 NOWFMWLHWJJCQV-OALUTQOASA-N 379.504 5.629 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Cl)s2)c(OCc2cccnc2)c1 766484866 RBQANOBGWSRUIZ-ALCCZGGFSA-N 385.872 5.280 30 20 GKED Cc1cncc(/C=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 772062304 UOAPBNGQLYFMTF-TYOLEZHBSA-N 387.870 5.351 30 20 GKED N#Cc1ccc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)c(F)c1 772798783 YHCABWNLHLWADE-OVCLIPMQSA-N 387.183 5.384 30 20 GKED COc1cc(Cl)ccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 775358650 STRFWGRWUUUZKQ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NCc1ccccc1)c1ccc2ccccc2n1 776074691 MODRFOKMWDRAIF-OAQYLSRUSA-N 377.447 5.337 30 20 GKED Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)OCCC(C)(C)C#N 776355771 GPYXHDGLJSGVDX-UHFFFAOYSA-N 392.455 5.120 30 20 GKED C[C@H](Nc1ccc(CC[C@H](O)c2ccccc2)cc1)c1ccc(OCC#N)cc1 777676015 SEAVOBVWXCEXLN-DFBJGRDBSA-N 386.495 5.428 30 20 GKED N#C[C@H](C(=O)CCCCC(=O)c1ccccc1)c1nc(-c2ccccc2)cs1 783356622 DZFDOSREDARLBT-LJQANCHMSA-N 388.492 5.430 30 20 GKED CC(C)Oc1c(F)cc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1F 784617713 USCCNEJRKDGFIQ-UHFFFAOYSA-N 396.441 5.141 30 20 GKED C[C@@H](C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1)[C@H]1OCCc2sccc21 796749608 WAUZQRROXRTHKF-IVZQSRNASA-N 389.476 5.142 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2c3ccccc3cc3ccccc23)CC1 800528385 MQIHOAXREOLFOK-UHFFFAOYSA-N 377.491 5.445 30 20 GKED COc1ccc(NC(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)c(C(F)(F)F)c1 801660272 AXKQLENPNAEBIU-CQSZACIVSA-N 395.274 5.382 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc(C(OC)OC)o1)c1ccc(C(F)(F)F)cc1 807133333 PHPSUZPATJKQCG-OAHLLOKOSA-N 397.393 5.027 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)c1 807925315 CVYOHUJGVJMXNX-UHFFFAOYSA-N 395.843 5.388 30 20 GKED N#C[C@@H](C(=O)CCCCc1nc2ccccc2s1)c1nc(C2CC2)cs1 842937429 GEJPTSPRTKAKFA-AWEZNQCLSA-N 381.526 5.219 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)N[C@@H](C)c1ccccc1 890165285 CMAAPHVQRWSWAI-SFHVURJKSA-N 378.516 5.135 30 20 GKED C=CCN(C(=O)c1cc2c(C)nn(Cc3ccc(Cl)cc3)c2s1)C(C)C 915147582 DVKFGYHDQUFPNZ-UHFFFAOYSA-N 387.936 5.145 30 20 GKED CCOCc1ccccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354183 WRWPMGKHQOWUEX-DEOSSOPVSA-N 399.494 5.200 30 20 GKED CC[C@H](NCc1c(F)c(F)c(F)c(F)c1F)c1ccccc1OC(F)F 915354423 RBWZHBBUINVJJI-JTQLQIEISA-N 381.291 5.224 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3nc4ccccc4s3)c2cc1C(C)C 916650380 JYBRUTAZINOIRJ-GOSISDBHSA-N 388.492 5.893 30 20 GKED CC(=O)c1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916975893 GGOYRYNGHQQKKT-SFHVURJKSA-N 394.883 5.085 30 20 GKED C[C@@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917044104 PUKKVMVKBXNYBY-QMTHXVAHSA-N 391.279 5.247 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3ccc(F)cc3)n2)cc1 918489784 NPMRHMYKDMCGTK-HNAYVOBHSA-N 378.472 5.628 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=S)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 920994343 QKUBNOIMFQRLNW-VGOFRKELSA-N 395.547 5.153 30 20 GKED Cc1cc(SCc2nc(O)c3c(-c4ccco4)csc3n2)ccc1C#N 1559429069 GFUPEUNZVOUMKL-UHFFFAOYSA-N 379.466 5.129 30 20 GKED Cc1c(NN=Cc2ccc(-c3cccc(Br)c3)o2)cccc1C(=O)O 1776086076 ANRHJRGAZLTGJW-UHFFFAOYSA-N 399.244 5.162 30 20 GKED Cc1c(NN=Cc2cc3c(Br)cccc3s2)cccc1C(=O)O 1776089383 PKGWSLVKRNKTMP-UHFFFAOYSA-N 389.274 5.116 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(F)c(Cl)c1Cl 1776354403 KVMOSLISOQFGKX-QPJJXVBHSA-N 397.229 5.514 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(-c2ccccc2)c1 1776355409 KDWAZRZRLNZXIK-ACCUITESSA-N 386.447 5.735 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)cc1)c1ccccc1 1776469387 DHIMTPSQPXXLHU-WPMUKRGUSA-N 390.410 5.560 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776471528 YNLOXJMAAQVKJT-OKACTXMXSA-N 378.468 5.482 30 20 GKED N#Cc1ccc(C(=O)CSc2ncnc3sc(-c4ccccc4)cc23)cc1 18473791 CGTHYKRUPBYNLI-UHFFFAOYSA-N 387.489 5.205 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@H](Sc2ccccc2)c2ccccc2)cc1 25438472 JXVZTJRZFPGWPB-JOCHJYFZSA-N 386.520 5.960 30 20 GKED CCOc1ccc(C#N)cc1N[C@@H](C)C(=O)Nc1ccccc1-c1ccccc1 63641843 XGJKVAXPPQBNDC-KRWDZBQOSA-N 385.467 5.063 30 20 GKED COc1ccc(CNC2CCC(c3ccccc3)CC2)cc1OCCCC#N 64613813 FPBCCGVRQZFFFE-UHFFFAOYSA-N 378.516 5.194 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)CSCc3ccccn3)c2C#N)C1 64693152 HJLCIDGVXOODIX-AWEZNQCLSA-N 399.585 5.038 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66955983 KLBPXBYQAUCZRA-YLJYHZDGSA-N 379.529 5.758 30 20 GKED CCOc1cccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108533236 JRARTEGVHKIAMS-JKSUJKDBSA-N 383.517 5.220 30 20 GKED N#C[C@@H](C(=O)c1coc(-c2ccccc2)n1)c1nc2cc(Cl)ccc2s1 121846093 CJCFODOAPWVMOD-ZDUSSCGKSA-N 379.828 5.095 30 20 GKED CCOc1cc(C)ccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 123440061 XPILXKSSPUNOBE-INIZCTEOSA-N 383.517 5.110 30 20 GKED N#CC1CCN(C(=O)N[C@@H](CCCCc2ccccc2)c2ccccc2)CC1 153729449 OZYVENVQOFFZDB-QHCPKHFHSA-N 375.516 5.086 30 20 GKED COCc1nc2cc(NC(=O)Nc3ccccc3S[C@@H](C)CC#N)ccc2o1 177090076 VAZPMZFCUPCFLP-ZDUSSCGKSA-N 396.472 5.012 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1 184357712 ZOFSCLCUHYKQGA-OPAMFIHVSA-N 389.430 5.028 30 20 GKED C=CCc1cc(OC)cc(CN2CCC(c3nc4ccccc4s3)CC2)c1O 302801949 LRRVSYSAHJDFEP-UHFFFAOYSA-N 394.540 5.119 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 302934530 HDTHBVLMBUFZEJ-LJQANCHMSA-N 376.378 5.166 30 20 GKED CC(O)=Nc1cccc(N=C(O)[C@@H](C)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 328727210 DBPXLMJYSZSJHL-CXAGYDPISA-N 397.441 5.326 30 20 GKED Cc1nc(-c2ccc([C@H](C)/N=C(/O)C3C[C@@H]4CCC[C@H](C3)C4=O)cc2)cs1 329104563 CRIYFWAHGNCSKT-ICCJLLLJSA-N 382.529 5.531 30 20 GKED COc1ccc2oc([C@H](C)/N=C(/O)N3CCC(c4nccs4)CC3)c(C)c2c1 329206520 ZQUJNHFIYHFKJP-AWEZNQCLSA-N 399.516 5.061 30 20 GKED Cc1csc(C2(/N=C(/O)Nc3ccc4nn(C(C)C)cc4c3)CCCC2)n1 329925421 JTAFSLBRLCZPIO-UHFFFAOYSA-N 383.521 5.178 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(C(F)(F)F)c1 329990834 JIUMAFVCZOGSAQ-MKQDKFQKSA-N 382.426 5.648 30 20 GKED C/C(O)=N/[C@H](Cc1c[nH]c2cc(F)ccc12)/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 330120017 GEKRCQHZOYKYIT-XKIVJUNCSA-N 399.510 5.510 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1C#N 435445877 YMPPXUCGTUYCIU-UHFFFAOYSA-N 399.372 5.165 30 20 GKED Cc1oc(C#N)cc1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 435459891 PGHLBTUGKXSKPD-IBGZPJMESA-N 389.455 5.215 30 20 GKED C[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 437834446 DEPRAYPVBMRDLT-KRWDZBQOSA-N 383.451 5.329 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438656722 OVRGIONVQXBPLJ-HNNXBMFYSA-N 379.407 5.180 30 20 GKED COc1ccc2cc(CN(C)C(=O)N[C@H](CCC#N)c3ccccc3)ccc2c1 438840147 MXPDIRAEEHAZOE-HSZRJFAPSA-N 387.483 5.035 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)SCc1ccc(C#N)cc1OC(F)F 439523079 DALAPJCBFNWOMG-AWEZNQCLSA-N 390.455 5.037 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1[N+](=O)[O-] 439658824 BYQKBZATSWWKHU-AWEZNQCLSA-N 377.375 5.571 30 20 GKED C[C@@H](Nc1cccc(CCC(F)(F)F)c1)C(=O)Nc1ccc(C#N)c(Cl)c1 441736988 MAYWYDIDSBXWPJ-GFCCVEGCSA-N 395.812 5.146 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CCSc3c(F)cccc32)c2ccccc21 443924356 DYRYPGCUOFQTOZ-IBGZPJMESA-N 393.487 5.051 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 443944881 OGLRRZZRVMMCRS-UHFFFAOYSA-N 394.862 5.281 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F 453080497 FGEPVEAYJSELDN-GFCCVEGCSA-N 395.406 5.620 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H](C)c1cccc(C#N)c1 463345462 POTVRJQTBDBCBX-SFHVURJKSA-N 397.453 5.214 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1cc(C(F)(F)F)ccn1 464468860 QZJDTNQCCMJLHV-GFCCVEGCSA-N 392.686 5.263 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)c(Cl)c1 469682859 CINBMESLZGZSOQ-UHFFFAOYSA-N 387.817 5.201 30 20 GKED CN(Cc1cc(Cl)ccc1F)C(=O)c1cn(CCCC#N)c2ccccc12 470096429 FKHKSBJEFLLFGR-UHFFFAOYSA-N 383.854 5.010 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)cc1 474417272 UZJPSHOUCMYSQQ-UHFFFAOYSA-N 380.451 5.283 30 20 GKED FC(F)c1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1 475095683 SNHRQMNORKBIEY-HNNXBMFYSA-N 397.309 6.426 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](CO)c1ccccc1Cl 482216428 VSLCCAGSMJMXSV-KRWDZBQOSA-N 386.923 5.090 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1nccc2ccccc12 483231797 GBYYEOHYFKYFOW-GOSISDBHSA-N 387.439 5.296 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 488492272 WODSKIZYRYIDQT-QGZVFWFLSA-N 383.879 5.165 30 20 GKED Cc1c(C(=O)Nc2ccc3c(c2)nc(C2CC2)n3C)sc2ccc(C#N)cc12 492180577 ICWHWNXOPSVJEC-UHFFFAOYSA-N 386.480 5.098 30 20 GKED N#Cc1cscc1C(=O)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 493837602 HPCZXNKWBMUMFW-UHFFFAOYSA-N 395.189 5.120 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)NCC(C)(C)CCC#N)s2)cc1 495109604 PYOCBBDCDNLRNA-INIZCTEOSA-N 384.549 5.117 30 20 GKED CC(C)(CC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)C(F)(F)F 500244709 JDJPUBUOCQWFDA-UHFFFAOYSA-N 375.284 5.074 30 20 GKED COc1cc([C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)ccc1OC(C)C 502618054 MNBKXAMSMXZVNG-INIZCTEOSA-N 395.503 5.166 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1N1CCCCC1 510600830 MKOFXDYSXMZHFR-UHFFFAOYSA-N 381.545 5.006 30 20 GKED Cc1nc(-c2ccccc2NC(=O)c2sc3ccc(C#N)cc3c2C)cs1 510634203 PGGDWCTWNPFYBB-UHFFFAOYSA-N 389.505 5.766 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](c2ccccc2)[C@@H](C)CC)cc1 511747981 FPONHJUGJOVZGV-WMZHIEFXSA-N 390.527 5.269 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CC[C@H](c4ccccc4F)C3)c2)cc1 517262671 BAAWJQSQYXEJTF-IBGZPJMESA-N 385.442 5.071 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccc(C#N)cc1 518736912 QXMLGXLYXGKMTP-XOBRGWDASA-N 395.915 5.423 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1 520476417 WLZQVNQUTAAERE-VWLOTQADSA-N 397.522 5.462 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2cccc3cccnc23)cc1 521096024 FHNBDSYIMDNTLT-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C=CCN(C(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1)c1ccccc1 525532467 PTWBUILKHBSQLY-UHFFFAOYSA-N 375.472 5.158 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc4ccsc4c3)n2)cc1 525796188 ANKBHJKBPOHVFT-HNNXBMFYSA-N 375.478 5.218 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3C)o2)nnc1-c1cccs1 534529914 VMEHLUGMZBAOQR-UHFFFAOYSA-N 394.525 5.448 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 536244944 SLZUWLSOLSLCPR-IBGZPJMESA-N 384.479 5.546 30 20 GKED CCOc1ccc(NC(=O)c2ccccc2Oc2ccccc2C#N)cc1OC 537553231 VXMKTWVXCYLHCN-UHFFFAOYSA-N 388.423 5.010 30 20 GKED N#C[C@@H](C(=O)c1ccn(Cc2ccccc2)c1)c1nc2cc(Cl)ccc2s1 541018113 DQRSGAAISCMFHE-KRWDZBQOSA-N 391.883 5.290 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](c2ccccc2)[C@H]2CCCc3ccccc32)CC1 542853562 FZNNCZPVJSBZNX-ZEQRLZLVSA-N 387.527 5.183 30 20 GKED COCc1ccccc1NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543851936 DLWZSYWAXGBIQG-QGZVFWFLSA-N 385.467 5.254 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccccc2NCc2ccc(Cl)cc2)c1 547320896 ALWLRRJBNMVYOS-UHFFFAOYSA-N 375.859 5.005 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 556931080 QLFDBYSYDNMJFL-QGZVFWFLSA-N 393.506 5.301 30 20 GKED C[C@H](NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-c2cccc(C#N)c2)cc1 569301283 NAWFQPBXHRRPHB-IRXDYDNUSA-N 399.450 5.114 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(-c2nc(C)cs2)c1 588261517 ZEJFBWOYAAAKEM-UHFFFAOYSA-N 377.513 5.381 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 591535935 IFVZJOSUGKAEDS-UHFFFAOYSA-N 398.450 5.774 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603693030 SZJDLAHAVCTKDR-OAHLLOKOSA-N 390.418 5.110 30 20 GKED COc1ccc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1F 603969009 UNCCPNQVLONHEP-UHFFFAOYSA-N 380.444 5.006 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 606938563 JLPDGOWOCRYMLD-UHFFFAOYSA-N 380.492 5.541 30 20 GKED COc1ccc(Cl)c(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c1 609643355 ZECFONCQSPXFLV-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)CCCCCc2cccs2)c1C 610053811 XJZHACAONZFBSB-UHFFFAOYSA-N 392.528 5.164 30 20 GKED Cn1ccnc1-c1cccc(NCc2cccc(OCc3ccccc3C#N)c2)c1 610910218 LNUFEHYLHXEWRU-UHFFFAOYSA-N 394.478 5.150 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 611557371 OPBLLKJCGWZPFM-HZSPNIEDSA-N 385.455 5.133 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(-c3ccccc3)s2)ccc1OC(F)F 727264640 UONSJZVNCZPZRX-CMDGGOBGSA-N 387.407 5.316 30 20 GKED N#CCOc1cccc(NC(=O)NCc2ccccc2Sc2ccccc2)c1 730663683 AUBMOYPCQWUUIJ-UHFFFAOYSA-N 389.480 5.062 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)o1 734304592 PEZZUUQGWYWOBR-LUAWRHEFSA-N 391.398 5.247 30 20 GKED N#C[C@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C1CCCCC1 734366870 BWEUQWAJGURPAR-FPOVZHCZSA-N 381.545 5.294 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccncc1 734662381 YTJQKEDQFPNFSD-LPHOPBHVSA-N 392.528 5.191 30 20 GKED C=CCN(C(=O)c1cccc(Sc2cccc(Br)c2)n1)C(C)C 741534162 UMQNWFHHOMALHB-UHFFFAOYSA-N 391.334 5.032 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1ccc(-c2ccc(CC)cc2)o1 744361598 ZNLWYYRSSIKHJT-UHFFFAOYSA-N 395.462 5.258 30 20 GKED C=CCN(C(=O)N[C@H](c1cccc(SC)c1)c1cc(F)ccc1F)C(C)C 745903706 MIASRWGGIQVRSO-HXUWFJFHSA-N 390.499 5.382 30 20 GKED CCc1cccc(CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 752476602 VDLFXABMBBFIKO-OAHLLOKOSA-N 388.414 5.296 30 20 GKED CCN1CCC[C@@H]1Cn1c(C)cc(C=NOc2ccccc2C(F)(F)F)c1C 754712881 WPDDUUGOFSHNDI-GOSISDBHSA-N 393.453 5.021 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1 756782023 QMTQOHUZIBARQZ-AVRDEDQJSA-N 393.490 5.466 30 20 GKED Cc1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(-c2ccccc2)o1 758947682 YUBCJJNMCXTEFI-JOCHJYFZSA-N 393.446 5.558 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(Oc2cccc(Cl)c2)cc1 760801208 RNBBQTQVPPWFDB-UHFFFAOYSA-N 396.805 5.426 30 20 GKED N#CCOc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCCCC2)cc1 763605609 VXIHCUFPPCCQCH-UHFFFAOYSA-N 388.433 5.557 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2[C@H]3CC[C@H]2c2ccccc23)c1=S 765025280 JTHJNKJNFKNZBV-SFTDATJTSA-N 388.540 5.425 30 20 GKED Cc1oc2ccccc2c1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 767956382 ODUUVCLJRLEPOM-OAHLLOKOSA-N 380.856 5.423 30 20 GKED CC(C)c1ncc(/C=C\C(=O)c2ccc(OC[C@H]3CCCCO3)c(F)c2)s1 771095378 ALPSSIHDROSXPC-XITLMJRVSA-N 389.492 5.250 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccnc(Cl)c3)n2)cc1 771261307 MPWHRTJTCMWLQA-OUOZUETKSA-N 379.872 5.057 30 20 GKED COc1ccsc1C(=O)/C=C\c1nc2ccc(Br)cc2s1 773147532 BMVBUKFCMRIXLN-PLNGDYQASA-N 380.288 5.025 30 20 GKED C=CC[C@H](NCc1cn(-c2ccccc2Cl)nc1C(C)(C)C)c1ccncc1 776185301 GWBKIGZKNMCFFX-FQEVSTJZSA-N 394.950 5.625 30 20 GKED CCC[C@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccc(Cl)cc1 777113398 BHPKNGXVWSEXFT-NRFANRHFSA-N 383.923 5.126 30 20 GKED Cc1ccc(-c2nnc(-c3ccc(C(=O)OCCCC(C)(C)C#N)cc3)o2)cc1 782198691 FKXSKEKGMJVUCU-UHFFFAOYSA-N 389.455 5.199 30 20 GKED C[C@H](NC(=O)/C=C\SCc1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 782485252 FYYMKAZORMAZJX-MOJYJUKOSA-N 388.492 5.443 30 20 GKED C[C@@H]1/C(=C/c2ncc(C(F)(F)F)s2)C(=O)c2cccc(Br)c21 788355844 PPHLBKGJCPQQRR-WVXOVRIESA-N 388.208 5.308 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc3cc(O)ccc3c2)c(-c2ccccc2)n1 788357262 XIGFARUOHPRSFZ-ZRDIBKRKSA-N 393.446 5.219 30 20 GKED O=C(/C=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccnc(F)c1 794718133 FHJGFTZWXTZHFG-AATRIKPKSA-N 378.350 5.259 30 20 GKED C[C@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(OCC#N)cc1 797040866 MPLZQLNTTZKZKX-VBKZILBWSA-N 390.405 5.289 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC1(C#N)CC1 797502142 NNMIZLDDNLULIF-UHFFFAOYSA-N 379.243 5.061 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cc(C)c(C)o2)cs1 799897185 MZXPJNZHUXZVCM-RMKNXTFCSA-N 384.432 5.073 30 20 GKED CSc1ccc(C(=O)/C=C/c2c(C)nn(-c3ccccn3)c2C)c(Cl)c1 802706801 ZAMBAMGRHJGCOM-MDZDMXLPSA-N 383.904 5.156 30 20 GKED N#CCCCCCc1nc(-c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)no1 809363655 POWNNZWKYLSEOZ-UHFFFAOYSA-N 378.388 5.064 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3ccc4ccccc4n3)c2)s1 813459011 LVQJAJQRCOPQDX-UHFFFAOYSA-N 397.503 5.084 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(C(C)(C)C2CCCCC2)no1 818421572 GBEYKYOXGBQCDT-INIZCTEOSA-N 390.528 5.187 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@]3(C)CC3(Cl)Cl)n2)cc1 835068683 SNMKJMAJGJVXJS-SUMWQHHRSA-N 379.312 5.269 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915085746 FDNUTAIRSXPLTL-HXUWFJFHSA-N 392.911 5.970 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=S)Nc1cccc(COc2ccc(CC#N)cc2)c1 916026315 XERBEZQJVLJOOV-JTSKRJEESA-N 393.556 5.197 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(SC(C)C)cc2)cc1 916949759 PVTQAFSSOVNUMF-HRAATJIYSA-N 394.540 5.662 30 20 GKED N#CCCCOc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1 917728210 OMXAMXXHGKMDRH-UHFFFAOYSA-N 386.451 5.054 30 20 GKED Cc1cc(C(=O)Nc2cc(C#N)ccc2OC(C)C)c(C)n1Cc1ccccc1 919864346 MZDAGJYXIMGGAE-UHFFFAOYSA-N 387.483 5.064 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccccc2F)o1 1776354460 MDRNWHNTGFCXPG-NTMALXAHSA-N 394.398 5.467 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)C2CCCCCC2)c1 1776788061 NEQUNWZVRMNZDB-HSZRJFAPSA-N 389.580 5.939 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776817218 DOVQIJXLXPJBNN-DHZHZOJOSA-N 392.407 5.035 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc([N+](=O)[O-])ccc3Cl)c2c1 1777685712 UXNXMXULVZLFNH-ORCRQEGFSA-N 387.800 5.057 30 20 GKED COc1ccc(-c2csc3ncnc(Oc4ccc(C#N)cc4OC)c23)cc1 15170541 LMYMCOPNSFJFLL-UHFFFAOYSA-N 389.436 5.039 30 20 GKED Cc1sc2ncnc(Sc3ccccc3C(=O)OCCCCC#N)c2c1C 24891295 ODZOBVDOWQNYTJ-UHFFFAOYSA-N 397.525 5.310 30 20 GKED N#Cc1cccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)c1 29600166 KYCUUNRKLFYUBX-SAPNQHFASA-N 391.430 5.439 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)c1ccccc1Sc1ccccc1C#N 33205973 UEABIRXHAASKHP-HNNXBMFYSA-N 378.522 5.132 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1-c1ccccc1 38638429 UMPMCSBIIQGHIT-QHCPKHFHSA-N 392.462 5.089 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2csc(Br)c2)S1 45110705 UYNWTVFMOMADAC-WUXMJOGZSA-N 393.331 5.019 30 20 GKED COc1ccc(CC[C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66953927 AGPRAIBMUBSNRF-DLBZAZTESA-N 397.544 5.232 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(F)c(Cl)nc1Cl 108241178 XGLPTLNULIBQPR-SECBINFHSA-N 384.263 5.032 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 114004096 ZMJCEIJIAYDZEM-UHFFFAOYSA-N 386.455 5.188 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cnoc1-c1ccc(Cl)s1 135574497 GHRJUJJNUWYVFL-GFCCVEGCSA-N 389.933 5.920 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@@H](C)c2ccc(Br)cc2)n1 153549924 HGNRCYPXFNWSHE-IUODEOHRSA-N 391.334 5.399 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nccs1 158732876 KJXXFYGKWOKWNR-NRFANRHFSA-N 392.484 5.254 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1SC[C@H](C)C#N)Sc1ccccc1 173115239 VQZRLTWWSCJVOI-CVEARBPZSA-N 385.558 5.241 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cc(C#N)cs2)c(C(F)(F)F)c1 177007576 JQPNUEQUFWHLHC-JTQLQIEISA-N 384.448 5.781 30 20 GKED Cc1cc(-c2cc(C(=O)OCC(C)(C)C#N)c3cnn(C(C)C)c3n2)c(C)s1 180175188 LLILIIQDBMGLML-UHFFFAOYSA-N 396.516 5.064 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1C1CCN(C(=O)[C@H](C)CC(=C)C)CC1 192990079 VBFBYIGVGRUMHQ-WOJBJXKFSA-N 396.575 5.536 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(C2CCOCC2)c1C 297846745 OIVPPJAKBNKQFD-UHFFFAOYSA-N 382.508 5.039 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 409471239 QDZWUICLDMJJJX-VQTJNVASSA-N 386.417 5.118 30 20 GKED CSc1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 409788596 FFKDXYPPPKSEGQ-MRXNPFEDSA-N 398.940 6.031 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(Br)cc1F)c1ccccc1 431692014 NJWJKRAMJQVESD-MRXNPFEDSA-N 390.256 5.145 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OC2CCCC2)cc1)c1ccccc1 432701148 ZAIPSAMJBJQRFO-JOCHJYFZSA-N 377.488 5.565 30 20 GKED N#C[C@@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1c(Cl)cccc1Cl 436033518 LHLGHLBWZLGAOB-SRHKJQAYSA-N 379.209 5.043 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 436138490 XQNAXVXKWQHTQT-LJQANCHMSA-N 375.815 5.021 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccc1O 436365362 PDWPLLXMKWMCBJ-UHFFFAOYSA-N 389.411 5.017 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(Br)c2COC)CCCC1(C)C 445243478 OCZWWTNYIOMRLU-KRWDZBQOSA-N 395.341 5.194 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1cccc(C)c1C 453462608 IIFOXIUKAZQUHH-RTWAWAEBSA-N 380.536 5.054 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471406003 PUKPTVVTODWKFT-UHFFFAOYSA-N 375.859 5.543 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 473054393 CWMMHAXPGBVDGI-MJGOQNOKSA-N 387.405 5.318 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cc2cccc(F)c2o1 473920639 DYQQOFYPYQTKSY-OAHLLOKOSA-N 379.435 5.126 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 474418296 WIZWVKNVHXQRBA-UHFFFAOYSA-N 397.503 6.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1SCCc2ccccc21 475560269 SVTTZRUGWJYYGQ-NRFANRHFSA-N 380.557 5.691 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1cccs1 481385280 CHBHPCPTNDRCSK-UHFFFAOYSA-N 386.527 5.201 30 20 GKED N#Cc1c(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)sc2c1CCCCC2 482245909 PNRDDSVTRRXOOW-MRXNPFEDSA-N 392.446 5.563 30 20 GKED C=CC[C@@H](C(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 489705442 VOJHUVPMAMTKTA-JKSUJKDBSA-N 394.462 5.228 30 20 GKED N#Cc1ccsc1C(=O)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 497990214 XSXUBUXRNLVHPI-UHFFFAOYSA-N 380.281 5.302 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C(C)C 499895387 NWFATSJAIJVJRF-MRXNPFEDSA-N 399.564 5.558 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc3c(ccn3CCC)c2)cc1 502445247 LAHWWVIASOJFPZ-UHFFFAOYSA-N 391.475 5.003 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1)CC1CCOCC1 505022160 AYFIONHQLYPWES-UHFFFAOYSA-N 378.516 5.266 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3ccc(Cl)s3)cc2)c1 509499745 IGMMXEUPXOPYNL-UHFFFAOYSA-N 382.872 5.033 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccc(SCC)cc1 509539824 IUKIKPBQVKINEC-KRWDZBQOSA-N 379.529 5.129 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)cc1Cl 510219275 AERAPBVVRGXKNN-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 512546883 YOANCJXBQUWRCK-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(Br)cc2F)cc1OC 513048108 XSNKSXUOUANCDJ-ZDUSSCGKSA-N 394.284 5.012 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 513130271 SEWAFKBQCXIWFT-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C=CCC[C@H](NC(=O)Cc1nc(CC)cs1)c1ccc(C(F)(F)F)cc1 513810571 DBOBKDZENKDKPH-INIZCTEOSA-N 382.451 5.091 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2CCc2ccccc2)c1 515441427 ILOJARFCSXGSKJ-UHFFFAOYSA-N 384.479 5.407 30 20 GKED COc1ccc([C@H](NC(=O)N[C@H](C)c2ccc(C#N)cc2)c2ccc(C)cc2)cc1 518005549 WCMIGBSHVUYICA-HOYKHHGWSA-N 399.494 5.025 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H]1CCCc2ccccc21 524390312 BSHLMFLVNYMRHW-XMMPIXPASA-N 396.490 5.504 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1ccc(F)cc1C#N 537703366 FMWUABPRSWLRBX-UHFFFAOYSA-N 379.460 5.041 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 538073061 GBGSVYRWMGYQBA-QGZVFWFLSA-N 391.298 5.303 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc4nc(Cc5ccccc5)oc4c3)cc2)CC1 540763092 ZZPSLLUJENGPPL-UHFFFAOYSA-N 393.446 5.226 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1ccc(F)c(C#N)c1)C1CC1 551521242 YBYQCHSJJGSPMF-LBPRGKRZSA-N 376.353 5.082 30 20 GKED Cc1nc2cccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)c2[nH]1 558869343 JWWPAMQXHVGSSP-UHFFFAOYSA-N 382.423 5.096 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1C1CC1 560295019 OUYNGWWIPBQAQL-LRQRDZAKSA-N 391.519 5.035 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@@H](c3c(Cl)cccc3Cl)C3CC3)o2)c1 562047778 ZRJXGSJVHPLGGH-LJQANCHMSA-N 399.281 5.156 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(OCc2ccccc2)c1 564458074 LSYIOSQOKBIBDY-LVXARBLLSA-N 384.523 6.351 30 20 GKED O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)[C@@H]1CC[C@H](C(F)(F)F)C1 567069389 DKVIZMAVTBWQJA-VDDIYKPWSA-N 391.714 5.177 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)c1 573477515 HVIWQGMVJIGOSU-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)s2)o1 592973523 GXHAPGCXHMZMOR-GFCCVEGCSA-N 397.456 5.259 30 20 GKED CC(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)CC1(C#N)CCOCC1 596872748 ZMCAPPLTVLBCMI-UHFFFAOYSA-N 397.346 5.079 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1Cl 603759198 XLQCJDNJZJDCJD-OAHLLOKOSA-N 397.843 5.217 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2ccco2)nc2c1cnn2C(C)C 606817262 VXBPSMJOVVUACV-UHFFFAOYSA-N 380.492 5.091 30 20 GKED CCC[C@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609080583 OVTMVFWLDHZNLG-HNNXBMFYSA-N 385.895 5.443 30 20 GKED Cc1c(Cl)c(CN2CCC(Oc3cccc(C#N)c3)CC2)nc2ccccc12 609195363 YUKMNBXLYCAQRP-UHFFFAOYSA-N 391.902 5.112 30 20 GKED CCc1ccc([C@H](C)NC(=O)[C@@H](C)Nc2ccccc2SC[C@@H](C)C#N)cc1 609387225 TXFVDRNZGFPOMN-OKZBNKHCSA-N 395.572 5.179 30 20 GKED COc1cccc([C@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609500026 IDNFDFVXDIHCJM-KRWDZBQOSA-N 386.451 5.045 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)cn3)cc2Cl)c1 609857255 CJSUHCMJMWZCEK-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#Cc1ccc(CCC(=O)Nc2cccc(Cl)c2SCC(F)F)cc1 609908444 AATZFAATMKQNRZ-UHFFFAOYSA-N 380.847 5.140 30 20 GKED N#Cc1ccc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(C(F)(F)F)c1 609962578 PJVIENMWYOIVPN-NXEZZACHSA-N 390.249 5.144 30 20 GKED C[C@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1cccc(C#N)c1 610362925 BMTVLAXEWFRTMR-AWEZNQCLSA-N 380.900 5.334 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC(Cc4ccccc4)C3)cc2)c1 610632569 VVGGBLBVUGEGCR-UHFFFAOYSA-N 383.451 5.057 30 20 GKED CO[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 611943033 SLNURWVFWIBNCA-KRWDZBQOSA-N 399.878 5.037 30 20 GKED C=CCn1c(SCc2cccc(C(=O)N3CCCCC3)c2)nc2ccccc21 614507563 LVBDBSRYMQZLGV-UHFFFAOYSA-N 391.540 5.141 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H](C)c1ccsc1 619788216 WCRBGMBEUSZMSG-MRXNPFEDSA-N 391.496 5.390 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)cn1)c1nc2cc(F)ccc2s1 669601475 DINQWVVGKISFOB-MRXNPFEDSA-N 389.411 5.113 30 20 GKED C=CCC[C@@H](C(=O)NCc1cccc(OCc2ccccn2)c1)c1ccccc1 681652111 LPTIOGIDRXZHLS-XMMPIXPASA-N 386.495 5.027 30 20 GKED N#Cc1ccc(NC(=S)N2CCC(=Cc3cccc(F)c3)CC2)cc1Cl 726477481 ZOCNANBZCJSKJL-UHFFFAOYSA-N 385.895 5.227 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2csc([N+](=O)[O-])c2)CC3)cc1 727655390 WBQDMTUPRWDYCZ-ZSOIEALJSA-N 382.466 5.301 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc(O)c(F)c1 728427997 NLTMSFOLWHNTTG-UHFFFAOYSA-N 378.432 5.039 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(Br)c2)c(Cl)c1OC 730433761 APRFKHGESFIKQV-SOFGYWHQSA-N 381.653 5.016 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 730688452 XEZJAPOLCVESHJ-VQIMIIECSA-N 390.508 5.264 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1ccccc1SCCC#N 730981960 FTVOCZHFCJGITK-NJWFCXLTSA-N 380.513 5.522 30 20 GKED CC(C)Oc1cccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 731114146 HNDKOCIGTYQINN-MRXNPFEDSA-N 383.517 5.047 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)/C=C\c1ccc(Cl)cc1 731341035 YSZQDSXETWIRSZ-FZDNWWAKSA-N 392.933 5.147 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2ccc(Oc3cccnc3)c(C)c2)cc1 732714646 WOKCWZGPWQEQOZ-WZUFQYTHSA-N 389.451 5.104 30 20 GKED CSc1ccc(C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)o1 732859392 IWHCKXFZIWLOIK-UHFFFAOYSA-N 377.465 5.058 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNc1ccc(Br)cc1 732924791 JATRBGKBXOJWRD-UHFFFAOYSA-N 375.600 5.150 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(-c4cnn(C)c4)c3)n2)cc1 744035011 MCOIXBHINNUQEK-HXUWFJFHSA-N 398.491 5.009 30 20 GKED N#CCOc1ccccc1C(=O)N(C1CC1)[C@H]1CCCC[C@H]1C1CCCCC1 744374031 JFIJTHVBIVJTBO-UNMCSNQZSA-N 380.532 5.333 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 749616607 YGVSSWLEVZPHRF-APHBUQMISA-N 392.343 5.182 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N=Cc2cc3ccccc3nc2O)cc1 750950410 UWVREAZQBJAIDL-UHFFFAOYSA-N 395.418 5.364 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc4ccccc4c(Cl)n3)n2)c1 752376540 RYBGPKKFSVXORW-UHFFFAOYSA-N 390.855 5.136 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ncc(Br)s1 756847423 SDWWCZRQZHWXGV-AATRIKPKSA-N 395.278 5.064 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cncc(-c3ccccc3)c2)cc1 757875682 TVYUXADESHCNQU-HSZRJFAPSA-N 397.478 5.052 30 20 GKED C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 760180591 FCBKWBGXPRWUEB-WFASDCNBSA-N 382.872 5.035 30 20 GKED CC(C)Cn1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C1CC1 768316242 BCLXEFFGBZBSLR-JOCHJYFZSA-N 398.510 5.324 30 20 GKED CCCCC[C@H]1NC(=O)N(c2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1=O 771819504 PSMQQUJAEGMRHR-UYAOXDASSA-N 395.890 5.001 30 20 GKED COc1cccc(C=NOCc2nc(-c3ccccc3Cl)cs2)c1OC 774726116 SJLWHVGHDPXGLM-UHFFFAOYSA-N 388.876 5.031 30 20 GKED CC1(C)C[C@H](N(Cc2ccccc2)C(=S)Nc2ccccc2C#N)C(C)(C)O1 776737264 ZPHUFMNINGFGCL-FQEVSTJZSA-N 393.556 5.103 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1cccc(Oc2ccc(Cl)cc2)c1 778297662 KKZSFWFNKNDEIZ-FQEVSTJZSA-N 390.826 5.093 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)Cc1c(Cl)cccc1Cl 780667647 KLBJYZMHSSQGNG-OLZOCXBDSA-N 392.286 5.037 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2c(CC=C)cccc2C(C)C)cc1OC 789720470 LUVKWLAYXLKWIG-FYWRMAATSA-N 391.511 5.764 30 20 GKED CC1(C)CC(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 796796249 CNPCTMGTAUAWIF-CYBMUJFWSA-N 379.312 5.729 30 20 GKED Cc1ccc(C(=O)O[C@@H](C)c2ccccc2NC(=O)c2ccccc2)cc1C#N 799606091 RCNRBDZBKMDLBD-KRWDZBQOSA-N 384.435 5.037 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(F)(F)F 801612816 QUGZHDCSGVKTER-QGZVFWFLSA-N 375.394 5.052 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc[nH]1)c1nc(-c2ccc(Cl)cc2Cl)cs1 802044037 BLEFKKWFYNZSAX-YVZNUBBCSA-N 388.279 5.335 30 20 GKED N#CCC1(OC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)CCC1 810858123 MDPQQIIIXJYYFP-UHFFFAOYSA-N 381.284 5.039 30 20 GKED CC1CCN(c2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)CC1 814525340 ZLMVYGMLZBBSLN-QHCPKHFHSA-N 390.531 5.480 30 20 GKED CCc1cccc(CC)c1NC(=O)CON=Cc1cccc(Cl)c1Cl 821456020 YMLOYUWKMLJSGL-UHFFFAOYSA-N 379.287 5.107 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCC(NC(=O)c2cc(C)oc2C)CC1 825633789 FCBDVSUQAPRQKA-QGZVFWFLSA-N 390.568 5.004 30 20 GKED CC(C)(C)OC(=O)N1CCCN(C(=O)CC2(C#N)CCCCC2)c2ccccc21 828565307 IKGGAEKPBUUPIR-UHFFFAOYSA-N 397.519 5.029 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC[C@]1(C)CC1(Cl)Cl 836385552 HNQMXHZEQGUXQP-MLGOLLRUSA-N 386.348 5.034 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842942211 WRQGQKMCLGLDEK-SMDDNHRTSA-N 378.419 5.409 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccn2Cc2ccccc2)cc1 915084950 BNGBAPLSIJVATG-XMMPIXPASA-N 391.474 5.444 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 915085537 CFCQIGXNRFXUMQ-FQEVSTJZSA-N 388.492 5.314 30 20 GKED COc1ccc2nc(C)c(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2c1 915101664 DVDFGLIHHUELDH-IBGZPJMESA-N 399.475 5.165 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(Cc2ccccc2)[C@H](C)C2CC2)c1=S 917437464 VVGBYXHPBHXRJU-QGZVFWFLSA-N 394.544 5.118 30 20 GKED Sc1nnc(-c2ccccc2Cl)n1N=Cc1cc(Cl)cc(Cl)c1 917538803 PMSRSPUDGVLJKN-UHFFFAOYSA-N 383.691 5.076 30 20 GKED Cc1cc(C=NNc2ccccc2C(=O)O)c(C)n1-c1ccc(C(C)C)cc1 1776030176 MMJFORKJCDZXSG-UHFFFAOYSA-N 375.472 5.362 30 20 GKED CCCCCCCCOc1ccc(C=NNc2ccc(C(=O)O)cc2OC)cc1 1776049581 FUPIJWTWCWWSIY-UHFFFAOYSA-N 398.503 5.579 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cccc(Br)c3)o2)cc1 1776114145 HIQWJJIXIICKND-CSKARUKUSA-N 397.224 5.303 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(O)c(C(=O)O)c2)cc1)c1ccccc1 1776469418 KWXNAIPMJLBBER-UDYBNVKDSA-N 388.419 5.127 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3cc(C(=O)O)c(Cl)s3)oc12 1776940838 YWGPUGQYILXEIL-VOTSOKGWSA-N 376.817 5.141 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@@H]3CCC5)o2)cc1O 1777670949 FZRWOTHLHGGFQZ-BKAYVGFPSA-N 386.403 5.050 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)Sc2ccc3ccccc3n2)c1 22451227 JCVITAIWZSPXTH-SFHVURJKSA-N 389.524 5.279 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 25394651 UHAQQYPMUTXRRC-HTXNQAPBSA-N 382.463 5.572 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 46346911 WWNPOMGPYGYHNX-UHFFFAOYSA-N 376.843 5.237 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 60306225 JWICZKKNJRCBHM-QWHCGFSZSA-N 375.456 5.516 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(C(C)C)cccc1C(C)C 63388591 SHSVCCSKXMVWGF-UHFFFAOYSA-N 375.516 6.025 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1C(C)C 63961904 HYLDCYBNGKVPKT-UHFFFAOYSA-N 378.863 5.082 30 20 GKED COc1ccc(CNCC2(c3ccc(F)cc3)CCCC2)cc1OCCCC#N 64614078 IMCGYVWHIXRCLQ-UHFFFAOYSA-N 396.506 5.118 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)cc1 64716896 MCXUJVLEIPYRJD-MRXNPFEDSA-N 389.430 5.159 30 20 GKED Cc1nc(NC(=O)c2c[nH]cc2-c2ccc(Cl)s2)sc1SCC#N 65515222 ZHVNATCRYWDABK-UHFFFAOYSA-N 394.934 5.030 30 20 GKED COc1ccc(CN(C)[C@@H](c2ccccc2)C(F)(F)F)cc1OCCCC#N 93052305 FZQROWUGGHSVTD-FQEVSTJZSA-N 392.421 5.113 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 108240522 RYVSTGODDYKORG-IRXDYDNUSA-N 382.529 5.154 30 20 GKED CCc1cccc2c(CC(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c[nH]c12 109413342 LCYXEPNXGGQINE-LJQANCHMSA-N 385.492 5.273 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(C[S@@](=O)C3CCCCC3)c2)cc1 116684879 XFVZRGDXLCXVBE-NDEPHWFRSA-N 397.540 5.085 30 20 GKED N#Cc1ccsc1NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 120734678 WIVYZWSURWZISQ-UHFFFAOYSA-N 386.807 5.759 30 20 GKED N#C[C@H](C(=O)CCc1ccc(OC(F)F)cc1)c1nc(-c2ccccc2)cs1 122370106 DBFIZJXLHAJEKQ-QGZVFWFLSA-N 398.434 5.221 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)oc12 128915156 RYZUWHXRADSRAI-MRXNPFEDSA-N 387.464 5.367 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(Br)cc1F 130200833 JLKBKHOMETUKLY-FNORWQNLSA-N 389.249 5.003 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2c(F)cc(C#N)cc2F)c1 152323739 DXNLFULELXHYSD-UHFFFAOYSA-N 386.345 5.052 30 20 GKED CC(C)Cc1ccc([C@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 175502740 AREABMNREOWLRL-HSZRJFAPSA-N 388.515 5.294 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)Nc3cc(C#N)cn3C(C)(C)C)c2)n1 178084178 PJVDLZHQKKPKEM-UHFFFAOYSA-N 377.448 5.031 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccccc2)n1)Cc1ccccc1F 179364893 IXNLIBMYAVSBOR-UHFFFAOYSA-N 395.503 5.155 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 182055212 DVAMXNSBNJUAKR-KBPBESRZSA-N 376.378 5.129 30 20 GKED Cc1ccccc1C(NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1C 185855330 NKVGTHZTVQTKJD-UHFFFAOYSA-N 394.478 5.104 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 192217306 HFTOFWMAEWRONE-BBRMVZONSA-N 399.482 5.523 30 20 GKED C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246744319 OOXTYVKBPVKAGB-QINHECLXSA-N 397.519 5.835 30 20 GKED CCN(C(=O)CSc1ccc(C#N)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 303207285 QCZKFSIWQAKIJR-CQSZACIVSA-N 392.446 5.279 30 20 GKED C=CC[C@H](CC)NC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 410118615 AXSPQZZUTARPQS-CJNGLKHVSA-N 378.925 5.088 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2sc3c(c2C#N)-c2ccccc2OC3)C1 410990336 WBEDHGBDCQEPSR-UHFFFAOYSA-N 396.512 5.101 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)N[C@@H]1CC[C@H](C#N)C1 424315652 AIBQKLVFYCAZBZ-PVXIVEMSSA-N 390.350 5.224 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(-c2cccnc2)cc1 426143717 PLJGQAGQRTZAFA-AWEZNQCLSA-N 376.847 5.156 30 20 GKED Cc1cc(NCC(=O)N(CCC#N)c2cccc(C)c2C)ccc1-c1ccncc1 427398917 MQFKKNAVPGKZQZ-UHFFFAOYSA-N 398.510 5.033 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 428953313 OLOSCONAURPTEP-DLBZAZTESA-N 385.467 5.052 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 429695485 HBUUNOQXNIAVDL-UHFFFAOYSA-N 375.394 5.062 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ncccc2Cl)cc1Cl 432005444 FMUAGFCJOUOQJS-INIZCTEOSA-N 382.250 5.296 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(C(=O)OC(C)(C)C)cc1 434881805 XPVPOWYYXOTVBH-INIZCTEOSA-N 382.529 5.648 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 438040892 VMFMAFUGWUJKBA-QUCCMNQESA-N 395.572 5.874 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Cl)c1cccc(OCc2ccccn2)c1 439427102 AJIALMVXBQCYAH-MRXNPFEDSA-N 377.875 5.036 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)c1 441196687 KBNDWMTUDYIJBO-LJQANCHMSA-N 396.878 5.150 30 20 GKED N#CC(CCSCC(=O)Nc1ccccc1)(c1ccccc1)c1ccccc1 443408552 HWIAJKWEWICSAB-UHFFFAOYSA-N 386.520 5.258 30 20 GKED C=CC[C@H]1N(CC(=O)Nc2c(Cl)cccc2C(F)(F)F)CCCC1(C)C 444776738 CXAZNMKEFQQRFQ-OAHLLOKOSA-N 388.861 5.364 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc3nc(C4CCCCC4)[nH]c3c2)c(F)c1 446108965 PLUBYJCEAPXXBR-UHFFFAOYSA-N 380.398 5.013 30 20 GKED CC[C@@H](N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C)c1ccc(C#N)cc1 447562565 MGYKZIFAHDHXNO-VBKZILBWSA-N 379.504 5.931 30 20 GKED COc1ccc(CN[C@@H]2C[C@H](C(C)C)c3ccccc32)cc1OCCCC#N 447989272 OZVGJEARSNVBPA-FGZHOGPDSA-N 378.516 5.352 30 20 GKED C[C@@H](SC1CCC(C(F)(F)F)CC1)C(=O)N(CCC#N)c1ccccc1 451041571 JXFXHZCXUYOTRG-HPUBIQBYSA-N 384.467 5.176 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CC[C@H]1CCCCO1 460166957 VADPXTKTAUBCHH-HXUWFJFHSA-N 382.891 5.094 30 20 GKED N#CC1(CCCSCc2cc(Cl)ccc2Br)CCOCC1 461248803 MMUHQHARAPSFPT-UHFFFAOYSA-N 388.758 5.436 30 20 GKED N#CCCCC(=O)Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1 462020959 SJLBZPCGRYXLEX-UHFFFAOYSA-N 393.434 5.262 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C 466121539 IAUPWAGZUKWMRR-URZJWIJPSA-N 393.918 5.307 30 20 GKED CC[C@@H](C)Cc1c(C)sc2nc(SCCCSCC#N)nc(O)c12 466625080 JYPYOCURYSLHJL-LLVKDONJSA-N 381.592 5.033 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2cccc(F)c2)c2cccc(Cl)c2)c1 468369481 XJFZNIJVQWGNKP-NRFANRHFSA-N 378.834 5.065 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 469852026 FNLLNAXEOZUQDP-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CC1(CSc2ccccc2)CC1 471825146 TUTIWYSKBNIHFP-KRWDZBQOSA-N 396.581 5.982 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 476714269 RMCPZKIUUKGVLC-HNNXBMFYSA-N 376.485 5.181 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)Cc1cccs1 480252036 MCQSQVOIHXBRLV-MRXNPFEDSA-N 391.496 5.473 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1ccccc1C 481366286 BQKUUHGXQWGXFX-UHFFFAOYSA-N 394.525 5.448 30 20 GKED C[C@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481662660 YAJCCUFBHQVSSB-KKSFZXQISA-N 395.478 5.319 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Cl)ccc1OCCOCC 481689947 XKHCSJKWOWZEQJ-UHFFFAOYSA-N 394.924 5.037 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482505896 OTNIDIOFAQPRPQ-UHFFFAOYSA-N 386.451 5.021 30 20 GKED C=CCC(C)(C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 487326872 ZTDRIRZNRUGILL-UHFFFAOYSA-N 381.863 5.616 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)CNc1ccccc1S[C@@H](C)CC#N 487378666 NGRRDZBAXRYVDM-IBGZPJMESA-N 395.572 5.240 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccccc1 488817546 DXKIERMCLQVAGL-HXUWFJFHSA-N 378.516 5.668 30 20 GKED CCN(CCCC1(C#N)CCOCC1)[C@@H](c1ccccc1)c1ccc(F)cc1 499535152 ZXYZJQCEKYEVBE-QHCPKHFHSA-N 380.507 5.338 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2cccc(-c3cccs3)c2)cc1 502493932 VWNOZNNMBMHNDK-UHFFFAOYSA-N 392.484 5.367 30 20 GKED CCC(CC)N(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H]1CCCc2cccnc21 511308119 ULVZIFZJJSUCEK-JOCHJYFZSA-N 387.527 5.345 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@@H](CC)c2ccc(C)cc2)cc1 513873862 DTVHNSASEYZDEE-QFIPXVFZSA-N 391.515 5.082 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 517428970 VXNVSTBTOQWVDP-BFUOFWGJSA-N 398.293 5.101 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)cc1Br 517455644 XRQKQCCQTYOIOZ-LLVKDONJSA-N 393.281 5.092 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 518315299 RVSTTYUTGSXJLF-INIZCTEOSA-N 392.549 5.273 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 520599978 UPBYHMGPJZALBZ-MRXNPFEDSA-N 389.430 5.715 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 521374035 RTIRRUMYSVRYQY-GOSISDBHSA-N 385.467 5.407 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1c[nH]c2ccc(Cl)cc12 523500748 RKJQZPMKCNLRHL-UHFFFAOYSA-N 389.842 5.062 30 20 GKED CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCCCOc1cccc(C#N)c1 524767896 DNQJEPSPJGJBCJ-DNQXCXABSA-N 390.527 5.292 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)N2[C@H]3CC[C@H]2c2ccccc23)cc1 525988386 NCYNCCOPKMYQRE-ZEQRLZLVSA-N 379.463 5.327 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)cc2)CC1 538499663 FCXSUTYMUKMMFM-UHFFFAOYSA-N 384.401 5.065 30 20 GKED N#Cc1ccc(CN2CCC(N[C@@H]3CCSc4ccc(Cl)cc43)CC2)cc1 539498624 VFCVBSOXYJUBGP-OAQYLSRUSA-N 397.975 5.003 30 20 GKED CC(C)C[C@H]1C[C@@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 539660167 JTGPMEULFSCIAY-PMACEKPBSA-N 394.540 5.033 30 20 GKED C=CCn1c(SCc2ccc(CC#N)cc2)nnc1-c1ccc(Cl)cc1 541287585 WCCSXEWOVWQMHC-UHFFFAOYSA-N 380.904 5.143 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc([C@H]3CCOC3)cc2)c1 559341667 RIBNXEIHBFOERH-QHCPKHFHSA-N 384.479 5.253 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)n1 560027307 ZLHQKNUQTFZRSS-HNNXBMFYSA-N 394.302 5.207 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1cc2ccccc2s1 561205684 HAIIOVOGNSUNDA-AWEZNQCLSA-N 381.526 5.475 30 20 GKED Fc1ccc(F)c([C@@H](NCc2cc(F)c(C(F)(F)F)cc2F)C(F)F)c1 561885431 YMQMUPMOMRHTTD-CQSZACIVSA-N 387.245 5.358 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)ccc1OC(C)C 562202340 VAVOMGIKPOTHOE-CQSZACIVSA-N 392.421 5.224 30 20 GKED C=C(C)Cn1c(SCc2nc([C@@H]3CCCC[C@@H]3C)no2)nnc1-c1ccco1 562214905 ZIGBPFKRIOTDOW-LSDHHAIUSA-N 399.520 5.083 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ncsc2C(F)(F)F)n1 571123691 BGSDRVGWSWQOBU-MRVPVSSYSA-N 397.275 5.290 30 20 GKED N#Cc1c(NC(=O)CCN2CCCCC[C@@H]2c2ccccc2)sc2c1CCC2 574046773 OLWTWYXYNZTAHT-HXUWFJFHSA-N 393.556 5.054 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@]4(CCSC4)C3)cc2)c1 590815616 ROCGWAXDWSUEAO-QFIPXVFZSA-N 393.512 5.102 30 20 GKED N#CC1(c2ccc(CNc3cccc(COCC(F)(F)C(F)F)c3)cc2)CC1 594921833 CXNMXLJMJIVKTH-UHFFFAOYSA-N 392.396 5.271 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1nc2ccccc2s1 603968896 JQEQXFYHAXMFAO-UHFFFAOYSA-N 389.505 5.468 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CSCc4ccccc43)c2)c1 604473835 WXYFOANPJLZXMA-DEOSSOPVSA-N 386.520 5.215 30 20 GKED C=CCN(C(=O)[C@H](C)Cc1ccccc1F)c1nc(-c2ccccc2)cs1 606159113 FBLMLEHMEUEVLJ-MRXNPFEDSA-N 380.488 5.347 30 20 GKED C[C@H]1CCN(C(=O)c2cc3ccccc3n2CC#N)c2cc(Cl)ccc2S1 609216744 QPUITDBNERDQKD-AWEZNQCLSA-N 395.915 5.349 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 609382674 MSOHNTMPPVIVCC-OAHLLOKOSA-N 389.524 5.551 30 20 GKED Cc1c(NC(=O)N[C@@H](C)c2cccc(C#N)c2)cccc1C(=O)Nc1ccccc1 610323213 CRPFSQSOVGGCOX-KRWDZBQOSA-N 398.466 5.002 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 612300499 JIIAKVZFXYCSOJ-UGKGYDQZSA-N 392.890 5.153 30 20 GKED C=CCOc1ccc(C(=O)N2CCC(Oc3ccc(C(C)C)cc3)CC2)cc1 612575290 DUEGCKHYXGQMAX-UHFFFAOYSA-N 379.500 5.058 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc2cc(F)ccc2s1 674045762 OITXNDBFIQUHGY-CQSZACIVSA-N 378.384 5.311 30 20 GKED FC(F)(F)c1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 683200436 HVBZTEORFAZLHR-HTQZYQBOSA-N 399.322 5.766 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 730689255 CLJNKPMKBLEXCC-BBRMVZONSA-N 398.915 5.403 30 20 GKED O=C(/C=C\c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccc(F)cc1F 732713770 GXRAHTBUPFSQBZ-FPLPWBNLSA-N 389.199 5.014 30 20 GKED C=CCCO[C@@H](C)C(=O)O[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 734731110 XLMFLRJVIWAWNW-KGLIPLIRSA-N 379.909 5.357 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ccc(Cl)cc1[N+](=O)[O-] 735319312 YVWNEELMUVOBJU-UHFFFAOYSA-N 383.256 5.237 30 20 GKED CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738896241 MYORIACEIQVYAX-TZYHBYERSA-N 375.516 5.775 30 20 GKED Cc1ccc(-c2cc(C(=O)N(C)c3ccc(C#N)cc3)c3ccccc3n2)cc1 742223082 KWTGXDLOGIWTAS-UHFFFAOYSA-N 377.447 5.359 30 20 GKED O=[N+]([O-])c1cc(Cl)cc(C=Nc2cccc(C3SCCS3)c2)c1O 743333856 BCZXLOGVBPOXFO-UHFFFAOYSA-N 380.878 5.183 30 20 GKED N#C[C@H](C(=O)Nc1ccc(SC(F)F)cc1)C(=O)C1CCCCCCC1 744024876 BVUNFDYWWVQAKO-INIZCTEOSA-N 380.460 5.009 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCC[C@H]2[C@@H](CC)c2ccccc2)c1=S 746713097 RMTDBOWKOXLSAS-PMACEKPBSA-N 382.577 5.093 30 20 GKED COc1cc(C(=O)/C=C\c2cnn(-c3ccc(Cl)cc3)c2)ccc1SC 747614883 NXODKYSNGOKTLP-OQFOIZHKSA-N 384.888 5.152 30 20 GKED Cc1nc(NC(=O)N[C@H](CCC#N)c2ccccc2)sc1-c1ccccc1 747825353 CTRUOVSLJSHQQD-GOSISDBHSA-N 376.485 5.285 30 20 GKED CC(C)C[C@H](C)OCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 756241791 LITVYMSIEANACD-GXTWGEPZSA-N 398.450 5.333 30 20 GKED C[C@@H](Cc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 756518061 SRNHITHJPKQJKR-KSSFIOAISA-N 380.900 5.519 30 20 GKED CC(C)(C)OC(=O)N1CCc2c(NCc3ccc(Cl)cc3C#N)cccc21 774305746 UMTBFOCCLYZVEP-UHFFFAOYSA-N 383.879 5.121 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2)cc1 779725460 FHMUDHFEHHDOIG-INIZCTEOSA-N 389.480 5.579 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCO[C@@H](C(C)C)C3)n2)cc1 781765509 OELSSKPPZZHSFC-YRISNDGFSA-N 382.529 5.136 30 20 GKED Fc1cccc([C@@H](NCc2c(F)c(F)c(F)c(F)c2F)C(F)(F)F)c1F 784315276 WPCWCWBNGVBXKN-CQSZACIVSA-N 391.208 5.054 30 20 GKED Fc1ccc(/C=C\C=Nn2cnnc2SCc2ccc(Cl)cc2)cc1F 794888465 QOYHGADUSBQEGU-YEXUNZOFSA-N 390.846 5.049 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H]1CCC(F)(F)C1 796747454 YCLDNHMKMKCJDN-MWLCHTKSSA-N 376.243 5.287 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1OC(=O)C[C@H](CC#N)c1ccccc1 796804276 AHXONTVEJIXAGN-SFHVURJKSA-N 394.471 5.335 30 20 GKED N#Cc1cc(NC(=O)N2CC[C@@H]2c2ccc(Cl)cc2)ccc1OC(F)(F)F 799459017 ACIGJMBJIHPCJL-OAHLLOKOSA-N 395.768 5.089 30 20 GKED N#CCOc1ccc(CN[C@H](Cc2ccccc2Cl)c2cccs2)cc1 813859045 FLPAGTDPQQXFPM-HXUWFJFHSA-N 382.916 5.377 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)c(C)n1[C@H](C)c1ccccc1 842936982 BCGAHAWVFOQRIB-FOIQADDNSA-N 389.524 5.538 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc3cc(Br)ccc3o2)c1 850137957 ZGIFSUNUKVCVTC-KRWDZBQOSA-N 399.288 5.166 30 20 GKED C[C@H](OC(=O)CC1(C#N)CCOCC1)c1ccc(Sc2ccccc2)cc1 851099493 UXKCISUAFMCNKX-KRWDZBQOSA-N 381.497 5.152 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 860424716 KMPNBHRMMTYYCJ-UFYCRDLUSA-N 381.426 5.136 30 20 GKED Cc1ccc(SCC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 916972189 KOZBMSRBFAZUBE-SFHVURJKSA-N 378.522 5.396 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917025479 LUVBBNGXUTYSBC-PBHICJAKSA-N 396.899 5.416 30 20 GKED Cc1ccc(SCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c(C)c1 917041063 OPBHSGHTBGRWMP-CQSZACIVSA-N 385.439 5.017 30 20 GKED CC(C)c1ccc(NN=Cc2cccc(O[C@H](C(=O)O)c3ccccc3)c2)cc1 1776060267 MJNCMXJZIPNPGK-QHCPKHFHSA-N 388.467 5.461 30 20 GKED O=C(/C=C/c1cc(C(=O)O)c(Cl)s1)c1ccc(Oc2ccccc2)cc1 1776126669 TVOUEPNXDQIJSA-ZHACJKMWSA-N 384.840 5.788 30 20 GKED C[C@H]1C/C(=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1776589589 OILZWZADHAPWDM-RSZPVBOMSA-N 398.458 5.737 30 20 GKED COc1cc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc2ccccc12 1777288483 JARKAUKUJHOMTK-CSKARUKUSA-N 390.435 5.230 30 20 GKED C[C@H](CC(=O)Nc1nnc(SCc2ccc(C#N)cc2)s1)CC(C)(C)C 6705264 YPMSVRJJRFIRJA-CYBMUJFWSA-N 388.562 5.103 30 20 GKED COc1cccc(-c2nnc(SCc3ccc(C#N)cc3)n2-c2ccccc2)c1 10250098 POABLNBGIMRKSB-UHFFFAOYSA-N 398.491 5.107 30 20 GKED O=C(CC/C(O)=N/c1nnc(Cc2ccccc2)s1)c1ccc(Cl)cc1 49984438 XVEMXAROZHIYMH-UHFFFAOYSA-N 385.876 5.033 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2cccnc2)cc1)c1cccc(Cl)c1Cl 78718765 IYHKWJUZZXZZMF-SFHVURJKSA-N 398.249 5.175 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C(=O)N1CCCCC1)c1ccccc1 108407400 NWUDCIOWUFNOGR-AVRDEDQJSA-N 393.556 5.104 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(C#N)cc1 118446283 HJEVNKAIBJJOKS-CVEARBPZSA-N 395.553 5.385 30 20 GKED Cc1ccc(-c2nnc(SCCCC(C)(C)C#N)n2Cc2ccco2)cc1 123128609 JNGNTLZJCRHBBK-UHFFFAOYSA-N 380.517 5.317 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2ccccc2SCCC#N)c1 153426005 IDNBGPSFSMYHQV-UHFFFAOYSA-N 375.291 5.016 30 20 GKED C[C@@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccc(C#N)cc1 154331311 UWXULYZVKXNHBT-KUHUBIRLSA-N 377.488 5.549 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N(c2ccccn2)C2CCCC2)c1 154475548 LZTPVWCJLMERPU-UHFFFAOYSA-N 397.478 5.122 30 20 GKED CN(C(=O)c1ccc(Sc2ccccn2)cc1)c1cc(Cl)ccc1C#N 156805840 SDFFJXONEWRGIV-UHFFFAOYSA-N 379.872 5.034 30 20 GKED CC1(C)C[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 162545617 TYDPZHIXQYVUIU-IEBWSBKVSA-N 397.906 5.075 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cccc(C3SCCS3)c2)C2CC2)cc1 171248681 IGONNINHZWXFDI-UHFFFAOYSA-N 395.553 5.233 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3ccccc3SC[C@H](C)C#N)cc12 173137305 ZHJYKCFZNWBQRS-CYBMUJFWSA-N 398.557 5.262 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)c1ccccc1 180289676 XAMOJZNVVREVOP-SFHVURJKSA-N 397.438 5.056 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCCCO[C@@H]2CCC[C@@H](C)C2)n1 245838903 BAHOOMQIBXCTRS-KURKYZTESA-N 376.566 5.598 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@H](C)c3ccc(C#N)cc3)n2C)cc1 303677116 HZFSJBSKRRBHPZ-MRXNPFEDSA-N 391.544 5.053 30 20 GKED CN(c1ccccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1)C1CCCC1 330013103 LQEBKYSAAPJUHD-UHFFFAOYSA-N 383.536 5.579 30 20 GKED Cc1ccnc2[nH]c([C@H](C#N)C(=O)c3csc(-c4ccc(Cl)cc4)c3)nc12 429669703 VHVVEUJCBCLURF-OAHLLOKOSA-N 392.871 5.138 30 20 GKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](C)Cc1ccccc1C(F)(F)F 431582070 HJMDAMVKSFUZPS-OAHLLOKOSA-N 389.421 5.256 30 20 GKED Fc1ccc(F)c([C@@H](NCc2cccc(OCC(F)(F)F)c2)C(F)F)c1 434683069 YVTGGVZHSKDRHI-OAHLLOKOSA-N 381.291 5.002 30 20 GKED CC(C)(C#N)CCCCSCc1nc(-c2cccc(Br)c2)no1 435881702 BOHPILKBKZAGMH-UHFFFAOYSA-N 394.338 5.452 30 20 GKED CC[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(Cl)s1 437095948 YBSQFWWRLRABEI-GPANFISMSA-N 375.925 5.099 30 20 GKED C=C[C@](C)(CCOC)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 438013399 PQKNHRPFLAQWDF-LJQANCHMSA-N 394.393 5.060 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCS[C@H]4CCCC[C@H]43)cc2)cc1 438045132 RAGSPPHCMWDEAH-YADHBBJMSA-N 392.524 5.045 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CC(F)(F)F 438630270 YKKIQKVMOMULID-UHFFFAOYSA-N 389.421 5.353 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2)cs1 442617445 NDBZFWGAEURGBI-OAHLLOKOSA-N 375.478 5.218 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N(Cc1ccco1)c1ccccc1C#N 443834443 IKNZJHCKHBZOFB-KRWDZBQOSA-N 376.431 5.092 30 20 GKED C[C@H](C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1)c1cccc(C#N)c1 462546347 ZVIQKJZTORCRKO-HNNXBMFYSA-N 386.417 5.087 30 20 GKED C[C@@H](C(=O)Nc1ccccc1CN(C)C1CCCCC1)c1cccc(C#N)c1 463254558 FTLBDTQBBJTAPE-GOSISDBHSA-N 375.516 5.065 30 20 GKED COc1ccc([C@H](N[C@@H]2CCC[C@@H](C#N)C2)c2ccccc2)cc1Br 463294471 DKXZEFJQDQRZFM-FQELHTAISA-N 399.332 5.219 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNC(=O)c1ccc(F)cc1C(F)(F)F 467054241 QZZGGNALQBMXPT-UHFFFAOYSA-N 379.275 5.102 30 20 GKED COc1cc(F)c(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 468381823 GOQQWMQKDUUUDT-UHFFFAOYSA-N 399.237 5.263 30 20 GKED C[C@H](CC(C)(C)c1ccccc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469242910 MXEOICOZORNBBW-LJQANCHMSA-N 389.543 5.438 30 20 GKED Cn1c(-c2cccc(NC(=O)C[C@H](CC#N)c3ccccc3)c2)nc2ccccc21 475166995 ZHOWLQYJJDEQTH-IBGZPJMESA-N 394.478 5.266 30 20 GKED N#CCCn1cc(CN[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)c(-c2ccccc2)n1 475346129 MRAASTARRCKUBK-NFBKMPQASA-N 388.490 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccco1)N1CCCCC1 475556472 QQKSFXRWPQTXDC-OAQYLSRUSA-N 395.547 5.480 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1c(F)cccc1OC(F)F 475573219 KXDVINKONUGILU-UHFFFAOYSA-N 392.421 5.601 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1ccccc1 476218878 FXSAAFMMTTYQSS-INIZCTEOSA-N 394.396 5.797 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2cccc(OC)c2)[nH]n1 476792911 CARRLXJVOHCWFO-UHFFFAOYSA-N 375.472 5.190 30 20 GKED Cc1c([C@@H](C)NCc2cccc(C#N)c2)cnn1-c1ccc(Cl)cc1Cl 480805363 YNBMNDMDEAIAIV-CYBMUJFWSA-N 385.298 5.210 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1)c1ccc(F)c(F)c1 481589679 AREXBIBLUFSBON-ORAYPTAESA-N 387.405 5.430 30 20 GKED C=CCN(C(=O)[C@H](C)c1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483952027 XTKALYDTNKAXMN-OAHLLOKOSA-N 393.468 5.041 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 490312176 DVMNAVWLCPRPSP-JTSKRJEESA-N 395.572 6.108 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(C(F)F)ccc1Cl 497214466 KDBVFYANPCNXNE-YJBOKZPZSA-N 389.833 5.581 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1coc(Br)c1 500752989 HBVMTKZUJLAMIO-UHFFFAOYSA-N 397.228 5.267 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2nc(-c3ccccc3)cs2)cc1Cl 501349552 INYXHGHOEALJTD-OAHLLOKOSA-N 384.932 5.879 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(C(C)C)cc2C(C)C)cc1 502358894 KLBFNCXCGJAGEC-UHFFFAOYSA-N 394.519 5.885 30 20 GKED Cc1ccc2oc(SCC(=O)Nc3ccccc3SC[C@H](C)C#N)nc2c1 504528773 YUCMKVXIFTYNFD-CQSZACIVSA-N 397.525 5.119 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)Nc1ccc(OC(F)(F)F)c(C#N)c1 508202327 RQRUPJYXMKTICW-UHFFFAOYSA-N 392.377 5.024 30 20 GKED CCN(C(=O)[C@H](C)Sc1nc(-c2ccccc2)ccc1C#N)c1ccccc1 510179688 IKOHYOFJVGNPGJ-KRWDZBQOSA-N 387.508 5.154 30 20 GKED CCCCS[C@H](C)C(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 515810092 MNVPOAAXAWBLAR-QGZVFWFLSA-N 384.520 5.461 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)C)cc3)n2)cc1 517800777 HMPVZCLRTIVNEC-IBGZPJMESA-N 376.481 5.432 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H](c3ccccc3)[C@@H]3CCCO3)c2)c1 520962590 JCAWCAMGUMGGHE-UIOOFZCWSA-N 398.506 5.147 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)Nc3ccccc3S[C@H](C)CC#N)oc12 521797939 VQYXAEQTUREHDX-OAHLLOKOSA-N 378.497 6.005 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 523184306 UXSCETKHYFMTGY-UHFFFAOYSA-N 391.496 5.495 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccc(C#N)cc2)c2ccccc2Cl)cc1 523567864 KNXOFVIFYMLBAN-NRFANRHFSA-N 391.858 5.131 30 20 GKED Cc1ccc(CN(C(=O)NCC#Cc2cccc(C(F)(F)F)c2)C(C)C)s1 523803277 OFXMPXFVWPMBAC-UHFFFAOYSA-N 394.462 5.047 30 20 GKED C[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)c1ccc(C#N)cc1 533608827 IZTHZACYMHBADO-GFCCVEGCSA-N 388.323 5.839 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@@H]3CCC[C@@H]3c3ccc(C(F)(F)F)cc3)CC2)c1 538579823 ZQLDLMBHMHWYLR-WOJBJXKFSA-N 398.428 5.061 30 20 GKED N#Cc1cc(F)ccc1CN[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 539422299 HCBQQIUTZUQCCS-OAHLLOKOSA-N 376.275 5.109 30 20 GKED CC[C@@H](C)Oc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccn1 540777394 PSUSOVKVUCHDLE-RISCZKNCSA-N 385.876 5.012 30 20 GKED CCC(C)(C)[C@H]1CCc2nc3ccccc3c(C(=O)[C@@H](C#N)c3ccncn3)c2C1 546152489 BXCATDWFOHALKY-LPHOPBHVSA-N 398.510 5.056 30 20 GKED C=CCC(C)(C)c1noc(-c2cc(-c3ccco3)nc3c2cnn3C(C)C)n1 551497856 HFVODYBEDRLLTB-UHFFFAOYSA-N 377.448 5.176 30 20 GKED CC(C)(CNC(=O)c1ccc(Sc2ccccc2C#N)cc1)C(F)(F)F 554719035 OAGPSCJYSHOIFU-UHFFFAOYSA-N 378.419 5.028 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC=C(c4ccccc4F)C3)cc2)c1 557966871 LGSQGYRKPKFUMO-UHFFFAOYSA-N 399.425 5.421 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)cc1 577511676 VQZQJBWCEZGPPC-LSDHHAIUSA-N 394.540 5.325 30 20 GKED N#CC[C@@H](CC(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 577875494 GPCSEILLMOYFSZ-KRWDZBQOSA-N 395.915 5.167 30 20 GKED CN(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc(Cl)c(C(F)(F)F)c1 589094351 UMGCCACGUSWSOS-UHFFFAOYSA-N 378.781 5.191 30 20 GKED CSCc1c(C(=O)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 590477752 HCHRBMTWDNCIIL-IBGZPJMESA-N 378.497 5.461 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1ccccc1CC(F)(F)F)c1ccccc1 599242936 DSBUCRYYBWBRTB-LJQANCHMSA-N 389.421 5.026 30 20 GKED COc1ccc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)cc1F 603532937 HJZVKMOMOYMPHW-UHFFFAOYSA-N 392.405 5.001 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 603649822 XPJSJUCEQGJLLQ-UHFFFAOYSA-N 398.491 5.499 30 20 GKED N#Cc1c(NC(=O)[C@@H]2Cc3ccccc3S2)sc2c1-c1ccccc1CC2 603991528 BEWNGPQZFGICHZ-IBGZPJMESA-N 388.517 5.041 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1c(Cl)cccc1Cl 609287080 JQZKVACXYCJPGT-OAHLLOKOSA-N 378.646 5.123 30 20 GKED C[C@@H](SCC(=O)Nc1cc(Cl)ccc1C#N)c1ccc(OC(F)F)cc1 609390982 AWWNWWMLKVBQLQ-LLVKDONJSA-N 396.846 5.246 30 20 GKED N#Cc1ccccc1OC1CCC(NCc2nc(-c3ccccc3)cs2)CC1 609544853 MLBRJKNNXUOWMJ-UHFFFAOYSA-N 389.524 5.162 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(Cl)c2O)cc1 609921576 OPIATBDWYGLCHY-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 610019142 DRFQZALTAGDWII-RLLQIKCJSA-N 393.556 5.614 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C[C@H](c2ccccc2)C(C)C)c1C 610054532 QQQDEPMMHVPQJC-QFIPXVFZSA-N 386.499 5.129 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)c[nH]c12 610171684 RUMPQOWQEUAKFK-UHFFFAOYSA-N 396.450 5.107 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1ccc(CC#N)cc1 611154020 HXWAKWHIJXVBFP-INIZCTEOSA-N 375.497 5.018 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccsc1 619825352 NTLYRHCIXCZMTI-MRXNPFEDSA-N 393.487 5.232 30 20 GKED O=C(Nc1cccc(F)c1Cl)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 672847137 BUNAFWDSVORHKG-HTQZYQBOSA-N 392.702 5.074 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)/C=C/c1ccccc1C#N 729419442 LATMSNIATIXROK-BRADTZPFSA-N 391.471 5.020 30 20 GKED C[C@@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)c1cccc(C#N)c1 730923951 IWJNITQUEKCGAT-GFCCVEGCSA-N 386.329 5.150 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(C3SCCS3)c2)c1 733618112 UWNCQQQJKUEVPO-UHFFFAOYSA-N 399.541 5.492 30 20 GKED Cc1csc(SCc2ccc(C(=O)N[C@@](C)(C#N)C3CCCCC3)cc2)n1 734239358 AYAAENZJOKKJQG-NRFANRHFSA-N 399.585 5.336 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(C)(C)C 734648856 VGOFSBZLVWAZML-QGZVFWFLSA-N 379.504 5.135 30 20 GKED CSCC[C@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 736963023 RHZRHXFBWKOVPR-ZDUSSCGKSA-N 389.908 5.267 30 20 GKED O=C(/C=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cncc(F)c1 737445854 GVWNRUSZAXXLBX-AATRIKPKSA-N 378.350 5.259 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(C(C)C)nn(C)c2Cl)s1 741527895 GDPYSKWYDOACGZ-UHFFFAOYSA-N 397.976 5.204 30 20 GKED Cc1c(C(=O)/C=C\c2cnn(C(C)C)c2)cnn1-c1ccc(Cl)cc1Cl 743056582 ZQZPMDFKXLVTGC-DAXSKMNVSA-N 389.286 5.161 30 20 GKED N#Cc1ccc(C(=O)O[C@H](c2ccccc2)c2cccc(Cl)c2Cl)cn1 745964625 KUNDCUNZYPDHAY-LJQANCHMSA-N 383.234 5.206 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)n1 747197947 PDWNMBDJZPKVFT-RRFJBIMHSA-N 379.312 5.553 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)ON=Cc1ccccc1C(F)(F)F 749351219 BSJOUANBHCACHY-CQSZACIVSA-N 378.394 5.207 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1cccc(Cl)c1 750682396 YJENLSJQPNYZPC-GFBZKKKVSA-N 376.843 5.125 30 20 GKED CC1(C)CCCC[C@@H]1CC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 752473875 MTXGERRVGYSQPK-HIFRSBDPSA-N 397.544 5.058 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)cc1C#N 753689396 YQJNLWQRTLAMKZ-RUZDIDTESA-N 397.453 5.133 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1F 753763393 PWWOVZWLXZBMHK-SPLOXXLWSA-N 395.478 5.382 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3OCC#N)c(F)c2)cc1C 760801108 HWNLXVAQDWRNCD-UHFFFAOYSA-N 392.405 5.403 30 20 GKED C[C@H](CCc1ccc(Br)cc1)N[C@H](C)c1ccc(OCC#N)cc1 776154474 CEFCKTMMXFMCFT-HZPDHXFCSA-N 387.321 5.023 30 20 GKED C[C@@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(OCC#N)cc1 777555200 MBHZRKXBUJWTON-MRXNPFEDSA-N 395.478 5.420 30 20 GKED C=CC[C@H](C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccccc1 777624265 DDJFBAZWQIYBTM-FQEVSTJZSA-N 392.499 5.283 30 20 GKED C#CCCCCCC(=O)O[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 780264239 MYIOTCHRPKYUQT-GFCCVEGCSA-N 381.259 5.231 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2ccc(Cl)c(OC)c2)cc1 788471885 JGHOINMTCBLTDR-UHFFFAOYSA-N 388.899 5.058 30 20 GKED N#C[C@H](C(=O)c1ccc(C2SCCS2)cc1)c1nccc2ccccc12 792096220 ZNYAQDDYWVQUTB-SFHVURJKSA-N 376.506 5.203 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(SC(F)(F)F)cc2)cc(OC)c1OC 796991510 BBFIPYXBUQMSKT-TWGQIWQCSA-N 398.402 5.220 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cc(Cl)c(O)cc1F 805257274 WMGQFQLGXDSSOS-UHFFFAOYSA-N 389.732 5.021 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1nccnc1C1CCC1 807992624 IDMGVLLQIPIVPA-UHFFFAOYSA-N 394.910 5.153 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1 808076101 MWHWBZUXWAVQJC-HXUWFJFHSA-N 398.434 5.080 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1sc(-c2ccccc2F)nc1C 814742851 IPYAQANRKPQAGV-UHFFFAOYSA-N 398.360 5.045 30 20 GKED C[C@@H](NCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)c1cccc(C#N)c1 820803005 IHVCPCGECLFGSY-QGZVFWFLSA-N 391.515 5.097 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)[C@@H](F)c1ccc(C(F)(F)F)cc1 857434187 ZNRFOKXBFUIXMQ-AWEZNQCLSA-N 395.274 5.296 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1cc2cnccc2o1 878675374 FTLYNXOKUPQWIK-KBPBESRZSA-N 380.473 5.105 30 20 GKED CCCc1ccc(S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915190703 MESVRPVNWCOFQZ-HSZRJFAPSA-N 390.508 5.095 30 20 GKED C[C@@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915359109 MUUYEQGFDQBHGV-YFXJRYMSSA-N 391.515 5.059 30 20 GKED N#C[C@H](C(=O)CCc1ccccc1F)c1nc(-c2ccc(Cl)cc2)cs1 916976762 GRBGNBRUMDOHND-MRXNPFEDSA-N 384.863 5.412 30 20 GKED N#C[C@@H](C(=O)CCc1ccc2ccccc2c1)c1nc(-c2ccccc2)cs1 917429133 KWWMWVJRWPYZKC-NRFANRHFSA-N 382.488 5.772 30 20 GKED CCCCCCCOC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 918494205 PZXBAFIINGZHMD-UHFFFAOYSA-N 399.453 5.071 30 20 GKED C[C@H](OC(=O)CCc1ccc(C#N)cc1)c1cccc(NC(=O)c2ccccc2)c1 919029406 KMXOUACEYJIIJA-SFHVURJKSA-N 398.462 5.048 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1 920292238 NOCIXYQWWXZOSQ-UHFFFAOYSA-N 380.831 5.365 30 20 GKED O=C(O)c1cc(NN=C(Cc2ccccc2F)Cc2ccccc2F)ccc1F 1776062250 KZYBDBCRSKMBBZ-UHFFFAOYSA-N 398.384 5.055 30 20 GKED CCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776112637 FBLJSPKJVBCJOU-FMIVXFBMSA-N 376.408 5.199 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1[N+](=O)[O-] 1776116169 SPJISPHEXQKNLM-UKTHLTGXSA-N 387.391 5.165 30 20 GKED CCCCCCCCCCCN(C)c1nc(C)nc2sc(C(=O)O)c(C)c12 1776787748 KUCVDHHWXOQZSK-UHFFFAOYSA-N 391.581 5.973 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccc(C)cc3)nc2C)cc1C(=O)O 1777361541 LMEJONFWVNLIEU-POHAHGRESA-N 393.464 5.030 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3cccc(C)c3C)cc2)oc1C(=O)O 1777423219 JAPMYWXFQUTELI-XFXZXTDPSA-N 390.435 5.378 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccc(SC(F)F)cc3)c2C#N)C1 10390886 YOSHRZPBUPTPMJ-JTQLQIEISA-N 378.469 5.312 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C(C)C)cc2)=C(\S)NC2CCCCC2)cc1 27329584 FWZADAFCFBUGFJ-UHFFFAOYSA-O 395.592 5.267 30 20 GKED CC(C)c1ccsc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 65072956 PDZZLQNBBQRJNR-UHFFFAOYSA-N 390.508 5.769 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(F)c(F)cc1F 78509614 GRDDDXSHBFUKIU-UHFFFAOYSA-N 384.382 5.379 30 20 GKED CN(Cc1cccc(OC(F)(F)F)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 157849094 BCRWQOUSCBMEGZ-UHFFFAOYSA-N 391.393 5.050 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCCc2ccccc21)c1nc2ccccc2n1C(F)F 171777092 WSWOOONGCOSDMM-WBVHZDCISA-N 379.410 5.118 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1 180117217 NNLUFKRSZOQVCU-UHFFFAOYSA-N 391.805 5.033 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1O)C1CCCCC1 184308120 QJJNEGSGNRKITB-QGZVFWFLSA-N 393.487 5.050 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]c(C)c(C(=O)OC(C)C)c1C 188069757 IYEKBRIHHCIJGX-UHFFFAOYSA-N 382.504 5.301 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 192217316 HFTOFWMAEWRONE-CJNGLKHVSA-N 399.482 5.523 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C 194728254 AOYLGAQOZYREAN-UHFFFAOYSA-N 386.451 5.064 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2cccc(C(F)(F)F)c2)cc1 206628739 IBSHGQTUOBLKCD-WDZFZDKYSA-N 376.378 5.131 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1 246627009 AOBRUPKXFLWELY-WSTZPKSXSA-N 393.556 5.596 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@H](c1ccccc1)C(C)(C)C 303397459 PYFZNEPSGDVWIE-HTAPYJJXSA-N 395.572 5.254 30 20 GKED OC(=Nc1ccccc1)N1CCC(/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@H]3C2)CC1 329092449 JVRMIRSMDOPPBI-HFSMHLIXSA-N 383.536 5.260 30 20 GKED O/C(=N/[C@@H]1CCCc2nc(O)ccc21)[C@]1(Cc2ccccc2)C[C@H]2CC[C@H]1C2 330090796 PNZAGASMDNVJCT-HVDAFXPBSA-N 376.500 5.170 30 20 GKED CCn1ccnc1[C@H]1CCCCN1C(O)=Nc1ccccc1N(C)C1CCCC1 330286179 AGFNPKUAYRNPHS-OAQYLSRUSA-N 395.551 5.055 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1ccccc1Cl 430635725 WEKDKTKGDDMELE-ZDUSSCGKSA-N 398.919 5.078 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@H](C)c2ccccc2[N+](=O)[O-])cc1 439567459 HHGCGPVGSGBQJC-OAHLLOKOSA-N 389.411 5.440 30 20 GKED CC[C@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(C#N)cc1 447543927 UDIQJBCXAGZPMY-DEOSSOPVSA-N 393.494 5.047 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@@H](C)Oc2ccccc21 454755167 HBOCMZCAHDXLGC-RVKKMQEKSA-N 381.501 5.115 30 20 GKED COc1cccc([C@H]2C[C@H](NC(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 454764284 PHVZVTNYOFVXBU-KBAYOESNSA-N 395.528 5.157 30 20 GKED CCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H]1CCc2ccccc21 458795606 COWGPVBRTDRFIB-GOTSBHOMSA-N 375.516 5.531 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)N[C@@H](CCCC#N)c1ccccc1 458800949 MEZPVRZQMDOTHX-IBGZPJMESA-N 389.421 5.282 30 20 GKED Cc1ccccc1[C@@H]1CN(C(=O)c2ccccc2-c2ccccc2C#N)[C@@H](C)CO1 460379082 FQXRSLNIXAFMAQ-DFBJGRDBSA-N 396.490 5.136 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1 462172860 YURIHCWZOPBNAV-HNNXBMFYSA-N 387.405 5.036 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(OC(F)(F)F)cc1 462224326 SJUWWLQOZBVGGS-UHFFFAOYSA-N 385.345 5.256 30 20 GKED CN(CCc1cccs1)C(=O)c1ccccc1Sc1ccccc1C#N 464356039 VOJDXZRTCSJIKS-UHFFFAOYSA-N 378.522 5.086 30 20 GKED CCC(=O)c1ccc(Cl)c(NC(=O)c2ccccc2-c2ccccc2C#N)c1 471405073 WVFKVSKCHBIIJY-UHFFFAOYSA-N 388.854 5.724 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1noc2c1CCCCC2 473616961 JZYUTJBMWQLTPJ-UHFFFAOYSA-N 387.439 5.168 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](COc2ccccc2)C1 475551375 TWZVFUXZIBLHPP-IBGZPJMESA-N 378.516 5.471 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCCc2c(O)cccc21 476069931 DCNNLUGPJMQTRZ-JOCHJYFZSA-N 398.462 5.423 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc3oc(C)c(C)c3c2)cc1 481644658 KEBACWGOLDHGRB-UHFFFAOYSA-N 378.432 5.001 30 20 GKED C[C@@H]1SCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)[C@@H]1C 483049683 JDCCFNOBWXZBFN-VCBZYWHSSA-N 399.947 5.353 30 20 GKED CCC[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccn1 483707948 XTWHGCBUEBHUPE-QHCPKHFHSA-N 399.494 5.249 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](CC(C)C)c1cccs1 484257745 SNLZAEDOCUGYKH-LJQANCHMSA-N 388.581 5.401 30 20 GKED Cc1cscc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 487329783 CGHQFTFPNRFCHC-UHFFFAOYSA-N 382.872 5.413 30 20 GKED CCn1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1cccc(Cl)c1 494584719 PLNCRSQIHDUNTL-GOSISDBHSA-N 382.920 5.154 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(CC(F)(F)F)CC1 497329180 KOKUFQRKXZQFHU-ZDUSSCGKSA-N 385.455 5.277 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2csc(-c3cccs3)n2)cc1 503633938 GJNZMBZXRFAEBA-UHFFFAOYSA-N 395.553 5.589 30 20 GKED CCc1ccc(N(C(=O)Cc2ccc(C#N)cc2)c2nc3ccccc3s2)cc1 504336560 NMIUFUQMDPTOAE-UHFFFAOYSA-N 397.503 5.638 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)CC1 506676087 JTFQSIJHSNXTLC-UHFFFAOYSA-N 395.506 6.178 30 20 GKED N#CCCCOc1cccc(NC(=O)CCc2ccc(Cl)c(Cl)c2)c1 511800638 CEWWLSUEALNTEW-UHFFFAOYSA-N 377.271 5.247 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N[C@H](c2cccs2)C2CC2)c1 513122565 GBZFBNUFGHQRJG-QFIPXVFZSA-N 388.492 5.080 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(-c2ccccc2Cl)on1 513556575 KMCISHXDMPZYRG-UHFFFAOYSA-N 393.874 5.165 30 20 GKED C=CCCO[C@H](C)C(=O)N(Cc1ccccc1)c1nc2c(C)cccc2s1 519071160 OALNVZQYKRGKFE-QGZVFWFLSA-N 380.513 5.119 30 20 GKED CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(C)Cc1cccc(C#N)c1 521299872 KRBYGVOJJYDPHP-GOSISDBHSA-N 390.314 5.028 30 20 GKED C=C(C)C[C@@H](C)c1nc(CC(=O)Nc2nc(-c3cc(C)ccc3C)cs2)no1 521941025 UXVRTHBTSOVHKS-OAHLLOKOSA-N 396.516 5.061 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 536724563 MTBLCTNVHXRGKP-JTQLQIEISA-N 386.820 5.023 30 20 GKED C=CCC[C@H](NCc1nc(-c2ccoc2)no1)c1ccc(C(F)(F)F)cc1 540432478 PMCKJOZPVGMBTR-INIZCTEOSA-N 377.366 5.146 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 541089394 VTXSSKNWZGJYQY-INIZCTEOSA-N 389.886 5.168 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 541254187 WVPSXNNCUZUYGO-CYBMUJFWSA-N 392.324 5.014 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1cccn1C)c1ccc(-c2cccc(C#N)c2)cc1 542085313 NPIJFVZTNAPFPH-HOYKHHGWSA-N 398.510 5.171 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3scnc3C3CCCC3)n2)cc1 545339118 VATATMSRNIFDJZ-UHFFFAOYSA-N 380.498 5.048 30 20 GKED N#Cc1c(NC(=O)c2scnc2C2CCCC2)sc2c1CCCCCC2 545359988 KOVXYQMNTYTAOO-UHFFFAOYSA-N 385.558 5.645 30 20 GKED C[C@H]1C[C@@H](c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCO1 546510388 KMTQHKMIADFPCG-KBPBESRZSA-N 395.846 5.336 30 20 GKED CSC[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(C(F)(F)F)cc1 551557407 FWFIMJYNOZYNFL-SFHVURJKSA-N 376.447 5.260 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1ccccc1NCc1ccc(Cl)cc1 552427701 OTHZSJVVQCRNMM-UHFFFAOYSA-N 393.849 5.144 30 20 GKED N#CCc1ccc(NC(=O)N(Cc2ccccc2C(F)(F)F)CC2CC2)cc1 554365337 HKXNYQHTKDXPDL-UHFFFAOYSA-N 387.405 5.216 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 576655411 QXTDOEFJDFGKDM-SFHVURJKSA-N 389.499 5.128 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H]1CCc2ccc(C#N)cc21 589339162 URCAUIYREYDVOI-RNODOKPDSA-N 393.943 5.982 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccsc1Cl 596395434 WWVNSJVRPVWMFW-LBPRGKRZSA-N 396.990 5.525 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCC[C@@]1(C)CC1(F)F 596724860 XWDGFGDOLWNRBK-NRFANRHFSA-N 399.441 5.003 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccccc2F)cc1Cl 603673226 OLMXOKJUASQJIA-IBGZPJMESA-N 378.834 5.316 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603968430 QUIQLPWYYNUXEI-UHFFFAOYSA-N 384.464 5.033 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3sccc3C3CC3)cc2F)c1 609110788 RZIOLBIZRAQQMR-UHFFFAOYSA-N 392.455 5.468 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@@H]3C3CC3)cc2Cl)c1 609137506 GSMWZZKYQYDPKG-HXUWFJFHSA-N 395.890 5.197 30 20 GKED N#Cc1ccc(NC(=O)[C@H](Oc2ccc(F)cc2Cl)c2ccccc2)cc1 609323998 PXDNPMVXCSWXQS-HXUWFJFHSA-N 380.806 5.110 30 20 GKED CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 609402835 CLUBFPCLAUWLCY-PKOBYXMFSA-N 381.545 5.471 30 20 GKED CCC[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccn1 609504867 OWTFPEFUFBBWEK-QHCPKHFHSA-N 385.467 5.211 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccco1 610174469 ZHXIBFPNLLDUNO-CQSZACIVSA-N 380.831 5.126 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1cccc(C#N)c1 610406964 NHNZSXHVTBUHTF-CQSZACIVSA-N 387.405 5.012 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccccc2CC)n1 661117105 OIIRTASGZKUOJR-CTNGQTDRSA-N 397.588 5.615 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N[C@H](C)c3cccc(C#N)c3)cc2)cc1 677664334 NXBDOXDGMVQFKC-MRXNPFEDSA-N 384.435 5.044 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 679541671 WELDXYKDKCDFRE-QGZVFWFLSA-N 387.439 5.296 30 20 GKED C=CCCC1(c2nc([C@@H](OCC)c3ccc(F)cc3C(F)(F)F)no2)CC1 685402247 UTNWFOPKYVMMAP-HNNXBMFYSA-N 384.373 5.351 30 20 GKED C#Cc1cccc(NC(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c1 729552063 AVSZGAFYMCBPLL-IBGZPJMESA-N 391.471 5.130 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1csc2ccccc12 730031346 XTPUEXVTSIVOFN-MRXNPFEDSA-N 377.513 5.456 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1-n1cccc1 730416221 BWFDGGQKCKEJHO-INIZCTEOSA-N 375.428 5.025 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)cc1F 731322117 UKRRWQWTNBFEAQ-GFCCVEGCSA-N 375.494 5.037 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1cccc(F)c1 732496544 YNSUYDPNZSSKEO-JVVYVMHDSA-N 376.456 5.537 30 20 GKED Cc1ccsc1C(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1 733749753 WWTJQNCSEOSQCZ-MDZDMXLPSA-N 385.492 5.259 30 20 GKED CCc1ccc([C@H](NC(=O)NCc2cccc(O[C@@H](C#N)CC)c2)C(C)C)cc1 733806546 JXSUEXCTMNQERI-FYYLOGMGSA-N 393.531 5.126 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)CCC(=O)N3)o1 734304839 XXNOOIBPVDQVLB-UITAMQMPSA-N 375.399 5.175 30 20 GKED Cc1cccc(-c2n[nH]cc2CNCc2cccc(-c3ccc(C#N)s3)c2)c1 740013731 JFFRQYPAKJLFHR-UHFFFAOYSA-N 384.508 5.275 30 20 GKED CC(C)c1cccc(S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 742028809 IDDGFWBABDMTRJ-HSZRJFAPSA-N 390.508 5.266 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 746659631 MOYMFHILKFSSTR-UZUQRXQVSA-N 385.467 5.233 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(C=O)c2)cc1Cl 754989764 SSKYYFVVTAAYON-GOSISDBHSA-N 380.856 5.122 30 20 GKED C[C@@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1cccc(F)c1 764749677 JGYKYFLTRAYSBE-QMMMGPOBSA-N 396.249 5.034 30 20 GKED C=C(C)C[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 767706847 UYWOSBRQPANXRW-NXEZZACHSA-N 378.683 5.119 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)ccc1OC1CCCC1 776154805 WDVQLSPMZHZKOK-ZWKOTPCHSA-N 394.515 5.331 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 777754237 MECYTWCISHBTHK-LJQANCHMSA-N 380.488 5.640 30 20 GKED N#Cc1ccc(CNc2ccc(OCc3ccccc3)c(Br)c2)o1 779600403 ZBYLYMSQCBHHRR-UHFFFAOYSA-N 383.245 5.105 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccccc1O[C@@H](C)C#N)c1ccc(Cl)cc1F 781911762 NUUVXWWOKDJXTK-ORAYPTAESA-N 389.858 5.289 30 20 GKED O=C1/C(=C/c2ccc3cnccc3c2)CSC/C1=C\c1ccc2cnccc2c1 782314214 QXJFRARSXWGFNI-ASIDMNOUSA-N 394.499 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccc(Cl)nc2)CC1 789449541 GZFJJVRKWVUALW-UHFFFAOYSA-N 395.934 5.908 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)[C@H]2CCC(=O)c3ccccc32)cc1 792658748 CGIINAQQPWPYKD-QHCPKHFHSA-N 381.431 5.029 30 20 GKED Cc1cc(NC(=O)CCCC(=O)Nc2ccccc2C#N)ccc1-c1ccccc1 792823461 FOQLTISCYIQVAL-UHFFFAOYSA-N 397.478 5.281 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cccc(-c2ccc(F)cc2Cl)n1 793247610 PLYSXSYRWUZGAN-UHFFFAOYSA-N 382.851 5.222 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccc(OC(F)(F)F)c(C#N)c1 799513050 YNHWPWJRPGIDTG-UHFFFAOYSA-N 385.798 5.228 30 20 GKED CON(Cc1ccccc1Cl)C(=O)Nc1ccccc1S[C@@H](C)CC#N 810184203 NAQKTYKCBCJEKS-AWEZNQCLSA-N 389.908 5.330 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)cc1Cl)c1cc(C(F)(F)F)ccn1 813213068 INFMEWGLJRTTQJ-CYBMUJFWSA-N 387.188 5.216 30 20 GKED COc1cccc2c1[C@H](C(=O)[C@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 815911112 RNTATHIEKUDRHA-MSOLQXFVSA-N 388.492 5.033 30 20 GKED COc1cccc(NC(=O)/C(=C/c2ccc(Cl)s2)C(=O)c2ccccc2)c1 834755434 GHGSMWNSBPYSTA-QGOAFFKASA-N 397.883 5.315 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@]3(CCSC3)C2)cc1 836274295 SUASYBSDGDZUJT-FYYLOGMGSA-N 391.540 5.093 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c(C#N)c2[C@@H]1C 839391389 YOJWHIUSOIVLPR-HTQZYQBOSA-N 398.290 5.399 30 20 GKED N#CCCCCCC(=O)Nc1cc2ccc(Br)cc2nc1Cl 857667533 ZXLHJKFNZMWCQS-UHFFFAOYSA-N 380.673 5.063 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3sccc3C#N)c3ccccc3n2)c(C)c1 908109471 PUHDYBQIKYCBII-UHFFFAOYSA-N 383.476 5.704 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 916942545 LSVRKWGTGNRJBW-GIZXNFQBSA-N 393.657 5.008 30 20 GKED CCOc1ccccc1CCC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 916974223 HEDIOUCHUJTSKS-IBGZPJMESA-N 390.508 5.326 30 20 GKED Cc1ccccc1OCCCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917046949 NTINGRDZDIABHF-HNNXBMFYSA-N 384.888 5.294 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NN[C@H](C)c1ccccc1 920385889 JVZYMPYUGCIUBU-CQSZACIVSA-N 387.314 5.231 30 20 GKED CCCC[C@H](CC)CN(Cc1ccc(C#N)cc1)c1ccc2nc(O)[nH]c2c1 1653643335 PHPSIBQNXMGRPQ-KRWDZBQOSA-N 376.504 5.363 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776014456 RMLWRMLYRGZPOH-UHFFFAOYSA-N 378.516 5.742 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(O[C@H](C)c2ccccc2)cc1 1776076094 VUKNLPKHVYSXEQ-MRXNPFEDSA-N 392.430 5.500 30 20 GKED O=C(O)Cc1ccc(NN=Cc2cc(F)ccc2Oc2ccc(Cl)cc2)cc1 1776085651 BVIQIZULXDJMRC-UHFFFAOYSA-N 398.821 5.345 30 20 GKED O=C(O)C(=O)/C(=C/c1ccc(-c2ccccc2)s1)c1ccc2ccccc2n1 1776116513 WLUABQDJZIDUEW-NBVRZTHBSA-N 385.444 5.158 30 20 GKED COc1ccc(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)c2ccccc12 1776132774 FLXZQDCJQWBZGX-OUKQBFOZSA-N 397.430 5.299 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(C(=O)O)nc2)c2c(c1)C(C)(C)CC2 1776269236 NUVRNBKFZWJGBT-VQHVLOKHSA-N 377.484 5.197 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2F)s1 1776782680 ALBRSKWVOGJYRB-INIZCTEOSA-N 377.525 5.848 30 20 GKED Cc1cccc2c1CC/C(=C\c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777457423 WIVZESLFVFWEDX-DEDYPNTBSA-N 398.458 5.485 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)CC(C)(C)C)cc2)CCC1 1787658369 PKFCMJMTIBKBME-HXUWFJFHSA-N 382.548 5.325 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2s1 41502457 XGJILDANQRQQJG-AWEZNQCLSA-N 393.468 5.357 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccncc1 66955761 FWUQOQYPBLXFMT-FXAWDEMLSA-N 394.544 5.625 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COC2CCCCC2)cc1Cl 107875703 TXYQWFOOJGAXOT-HXUWFJFHSA-N 382.891 5.283 30 20 GKED CCOCCC1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCCC1 121853099 RZYVNNGQJNGHHF-CQSZACIVSA-N 376.909 5.113 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCOC2(CCCCC2)C1 124698769 DYHCSNXZRNBPDS-IAGOWNOFSA-N 387.549 5.084 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2cccnc2)cc1 151279371 KBGSTXXREYRURN-JPYJTQIMSA-N 384.483 5.154 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Cl)ccc2-c2nc(C3CC3)no2)cc1Cl 157870139 RUZQSQJTITZOGG-UHFFFAOYSA-N 399.237 5.045 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 172997381 QWNIWYHCUJQJES-GFCCVEGCSA-N 389.318 5.262 30 20 GKED COc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 175116933 DDRUZVAZMYFPKR-KXBFYZLASA-N 376.481 5.189 30 20 GKED CCCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@H](C)c1cc2ccccc2o1 184312079 BOIOOPWNOLNFOE-IAGOWNOFSA-N 391.471 5.729 30 20 GKED O=C(CCCCCc1ccc(F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 188086174 UKBCVOYKHHOYOL-UHFFFAOYSA-N 399.350 5.272 30 20 GKED C=CC[C@H](C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)c1ccccc1 188774103 ZCUCRDSCYWKJQQ-APWZRJJASA-N 385.891 5.054 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)n1 193271127 FXORHVRONJRYPZ-SFHVURJKSA-N 387.439 5.296 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OCC)c(OC)c1 193607969 IWDUJDYFUNDZKL-UHFFFAOYSA-N 380.897 5.029 30 20 GKED CCc1ccc(-c2nc(CS(=O)(=O)CCCCC(C)(C)C#N)cs2)cc1 277860335 LRLIFMCKOFIUFG-UHFFFAOYSA-N 390.574 5.007 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)cc1 302948132 DDCAIUUYUXMENH-UHFFFAOYSA-N 395.462 5.191 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)c1 303544143 YZTKPPFWBOWLMP-XMMPIXPASA-N 388.511 5.176 30 20 GKED C[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(Cl)cn1 328782072 UZKSJQQKBVUPNW-GOEBONIOSA-N 386.927 5.259 30 20 GKED O=C1CCCc2ccc(N=C(O)N3CCCC[C@H]3c3nc4ccccc4o3)cc21 330150387 NCFJTHCQEVEHEO-IBGZPJMESA-N 389.455 5.120 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1ccc(Cl)cc1 430596702 KAMYHFMYIILATM-OAHLLOKOSA-N 398.919 5.078 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCCC(F)(F)C1 433141945 BTCLGVAHPYREMW-LSDHHAIUSA-N 381.492 5.418 30 20 GKED Cc1ccnc(-c2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)n1 433184191 VFDBFQLQWKCHCG-NRFANRHFSA-N 385.471 5.009 30 20 GKED CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 437535883 MBQGVHIKXWDQHB-KXBFYZLASA-N 382.533 5.038 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C 438637829 PWRGEEIGUAYRFI-LJQANCHMSA-N 387.405 5.563 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)N[C@H](CCC#N)c1ccccc1 438840132 MVHHQMCHRPCUNR-XMMPIXPASA-N 383.495 5.540 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccccc1 439311455 YQHNLAIVOGMAKA-HXUWFJFHSA-N 396.450 5.661 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(C#N)cc2Cl)cc1 439426271 ASSGSEATSMJOIL-MRXNPFEDSA-N 376.887 5.738 30 20 GKED N#Cc1cccc(NC(=O)Nc2cnccc2-c2ccc(C(F)(F)F)cc2)c1 440801499 PKPBULIAAKHNES-UHFFFAOYSA-N 382.345 5.283 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1cnc(C)s1)c1ccc(C(F)(F)F)cc1 441536340 ACBGFWPOBRTLEW-KRWDZBQOSA-N 397.466 5.319 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(F)c(OC(F)F)cc1F)c1ccccc1 455338224 RIPLGKJGHBTXMJ-HNNXBMFYSA-N 395.356 5.123 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 463747567 SKJGBRUYPRYACW-OAHLLOKOSA-N 394.327 5.411 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)CCc2ccc(C#N)cc2)c1 466624445 GRLFPPZVRGMJML-UHFFFAOYSA-N 389.886 5.081 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 468316320 MWVAXXHWLQHPEF-ROUUACIJSA-N 376.504 5.128 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OC)cc1Br 471291968 KOBHFKOCNRFLIJ-UHFFFAOYSA-N 389.293 5.068 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)CCCCOc1cccc(C#N)c1 474774125 JPOWYUFLXJDZOS-UHFFFAOYSA-N 394.515 5.370 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1NC(=O)C[C@@H]1C=CCC1)c1ccccc1 475760660 ORJATPITXOGVMZ-UYAOXDASSA-N 387.483 5.007 30 20 GKED COc1cc(C)c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1F 478775118 UBUADNPBTJRHFN-UHFFFAOYSA-N 375.403 5.010 30 20 GKED C=C(C)[C@@H](NCc1cccc(OCc2ccccn2)c1)c1ccc(F)c(F)c1 479402219 MJDHHXXUWQXHDX-HSZRJFAPSA-N 380.438 5.346 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(OCC(F)(F)F)cc1 483036890 SAOBRHGTCXHSKO-UHFFFAOYSA-N 392.421 5.410 30 20 GKED C=CCSc1ccccc1C(=O)NCC[C@@H](c1ccccc1)C(F)(F)F 491024538 TUQPDQBOCNDARR-KRWDZBQOSA-N 379.447 5.431 30 20 GKED CCCn1ncc(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)c1C1CC1 494035698 ANDOJSXBXRMOMD-UHFFFAOYSA-N 386.455 5.087 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(OC4CCCC4)c3)CC2)cc1 503627408 JNFQLQLIJFEMAV-UHFFFAOYSA-N 387.483 5.201 30 20 GKED CC(C)(C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1cc(F)cc(C#N)c1 505615029 VHTFELMZVSRFRQ-UHFFFAOYSA-N 389.430 5.146 30 20 GKED N#C[C@@H](NC(=O)c1cccc(Oc2ccncc2)c1)c1ccc(Cl)c(Cl)c1 505975343 DMYAXCUXWFDTAF-LJQANCHMSA-N 398.249 5.175 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)s1 512545811 XHCIIQSSVFMRKH-CHWSQXEVSA-N 393.965 5.926 30 20 GKED C[C@@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1F 512655667 WEOAWSRANTVTEI-QRQCRPRQSA-N 379.866 5.380 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1cccc(OC(F)F)c1 513225608 HRIHFLFGSNYBIV-HNNXBMFYSA-N 392.405 5.318 30 20 GKED CC[C@@H](C)[C@H](C)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CC1 513278782 HYIIQTRQFZSIMU-MSOLQXFVSA-N 376.500 5.176 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)cc1 515622877 LOUNNRLDNIHWAD-UHFFFAOYSA-N 387.405 5.317 30 20 GKED CC(C)Cn1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c2ccccc21 517456300 KPIKMCQMHVMZGH-QGZVFWFLSA-N 391.540 5.801 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 517531323 ASNAJBUWOHNDTC-GOSISDBHSA-N 381.545 5.771 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2ccc(OCC3CCOCC3)cc2)c1 523019634 WZFXTXVSQJETFX-UHFFFAOYSA-N 396.487 5.091 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1)C1CCCC1 523141621 YHSWSWKKTPNPGI-UHFFFAOYSA-N 394.418 5.222 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C2(Sc3ccccc3)CCCC2)cc1 523901410 QOEKFPXRUVUNPV-UHFFFAOYSA-N 395.528 5.038 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1)c1ccc(C#N)cc1 525298648 APQBFKMYYFUEKR-KRWDZBQOSA-N 379.479 5.303 30 20 GKED Cc1cccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c1Cl 525310209 MJKPFWDMHSMDBX-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CCN(C(=O)c1ccc(CC#N)cc1)[C@H](c1ccc(Cl)cc1)c1cccnc1 533949091 NHOSNYFAKRRCLE-JOCHJYFZSA-N 389.886 5.053 30 20 GKED C[C@H](NCCC(=O)Nc1sccc1C#N)c1ccc(Oc2ccccc2)cc1 537053109 DHRHHXNKHDUWKM-INIZCTEOSA-N 391.496 5.091 30 20 GKED CC(C)N(CCc1nccs1)Cc1cccc(OCc2cccc(C#N)c2)c1 539852362 MQUAZTUBLHTVNY-UHFFFAOYSA-N 391.540 5.047 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541156574 JPHXKDALENVQEJ-UUOWRZLLSA-N 398.510 5.474 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 541274827 ZFQFVWBWSWHXMI-CQSZACIVSA-N 384.476 5.331 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)ccc1Cl 544422870 FGTSSWACVGASNI-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1cc(CNC[C@H](C#N)CCC#N)ccc1Oc1ccc(Cl)cc1Cl 554552277 PVRUEESIIQEXBK-INIZCTEOSA-N 388.298 5.627 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 558338276 GGUWZFAYMJIXGE-LPHOPBHVSA-N 397.544 5.704 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2conc2Cc2ccccc2)cc1 571348302 XFVPBEIQIBNKMA-UHFFFAOYSA-N 379.463 5.094 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc2n[nH]cc2c1 588244315 ZECXJQCCTKNPGR-HNNXBMFYSA-N 397.438 5.110 30 20 GKED C=CCN(C(=O)CSC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 603457333 YYJODGWODOGZNL-UHFFFAOYSA-N 380.538 5.359 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2cc(Br)ccc2o1 603618731 HMBSHAODJPIRNQ-UHFFFAOYSA-N 397.272 5.118 30 20 GKED N#CCN(C(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccccc1 604456539 SEZFXHWRUSYDQR-UHFFFAOYSA-N 376.843 5.089 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 608840665 AEPIGNDTHQLIGW-FQEVSTJZSA-N 393.874 5.642 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 609061659 SIRZUQNSQMCPOI-UHFFFAOYSA-N 398.462 5.263 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 609307877 MNOGNXDBLOJWFI-UHFFFAOYSA-N 392.471 5.418 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1cc2ccccc2n1CC#N)c1ccccc1 609652383 SZHLQILUUYHSSR-SFHVURJKSA-N 395.462 5.557 30 20 GKED N#Cc1ccc(NC(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)cc1Cl 609711425 NQJXSXUIKQGLRU-QGZVFWFLSA-N 392.311 5.187 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C 620315062 WTYKWOMGYUULEM-BETUJISGSA-N 377.271 5.280 30 20 GKED C[C@H](CC(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 626995763 XQGNAVKYQWQXCE-MRVPVSSYSA-N 395.265 5.271 30 20 GKED C=CCOc1ccc(CNc2ccc(N=S3(=O)CCCC3)cc2)cc1Cl 630060867 CDQXMHDZOFMKPK-UHFFFAOYSA-N 390.936 5.410 30 20 GKED N#C[C@@H](C(=O)c1ccnc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 677974241 GGQXWAPLUMHYOZ-AWEZNQCLSA-N 397.381 5.353 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cccnc1C(F)(F)F 682798452 RMMROBFYHPWXEJ-UHFFFAOYSA-N 384.226 5.007 30 20 GKED CCn1cc(/C=C2/CC(C(C)(C)CC)C/C(=C/c3cnn(CC)c3)C2=O)cn1 732528826 ACHWERALXPFHCR-QJUDHZBZSA-N 380.536 5.002 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1 733083835 RFIGKFRFCHQBMA-HJWRWDBZSA-N 396.472 5.009 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4sccc4C)c23)cc1 733746097 FYJIBNHINLZHGO-UHFFFAOYSA-N 394.525 5.573 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccc(O)c4ccccc34)c2)cc1 734541543 AITNNAAWRPXGOX-UHFFFAOYSA-N 394.430 5.248 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(-c2cccs2)n1 735318699 OJOFOLLOEDYCJD-UHFFFAOYSA-N 392.958 5.861 30 20 GKED Cc1ncc(/C=C/C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)s1 741969672 HXUCLNHVLPDEQG-MDZDMXLPSA-N 393.899 5.223 30 20 GKED Cc1cccc(F)c1CNC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 743145684 DBVPLYVGXSEIGE-UHFFFAOYSA-N 375.403 5.120 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1F)C1CCCCC1)c1cccc(C#N)c1 745923571 SSRXLCMLEHPWRY-QGZVFWFLSA-N 379.479 5.303 30 20 GKED COc1cccc(/C(C)=C\C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 751829825 HIHORDRVFSIPCK-LJEUOOAZSA-N 382.872 5.238 30 20 GKED CCCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1cccnc1 761760756 MFMZWMVUIINQID-UHFFFAOYSA-N 391.858 5.456 30 20 GKED Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)OCCCCC(C)(C)C#N 768819240 JRELDWFKVCYSMQ-UHFFFAOYSA-N 393.409 5.281 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](Oc2cccc(Cl)c2)C(C)C)n1 770141585 NNDSZGAZTDSRHB-MAUKXSAKSA-N 376.909 5.200 30 20 GKED C=CCOc1ccccc1CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1 770579967 IHGXRMKXTVMJBS-UHFFFAOYSA-N 394.515 5.391 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 772691108 HBMJQRTWLSTBNT-UHFFFAOYSA-N 377.492 5.180 30 20 GKED N#CCCCn1cc(C(=O)O[C@H](c2ccccc2)c2ccccn2)c2ccccc21 774068931 MEEJDHLAIUMXSB-XMMPIXPASA-N 395.462 5.286 30 20 GKED N#C[C@H](C(=O)CCn1c2ccccc2c2ccccc21)c1nccc2ccccc12 792101700 BZTZIKQJQJGSHJ-JOCHJYFZSA-N 389.458 5.609 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](C)c1ccc(F)c2ccccc12 808842763 FWSLCFHDWHSAAC-GJZGRUSLSA-N 377.419 5.152 30 20 GKED FC(F)(F)c1cc(NN=C2CC[C@H](c3ccccc3)C2)nc(-c2cccnc2)n1 814850188 CITPFJRQJKCNIO-HNNXBMFYSA-N 397.404 5.293 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(C2CCCCCCC2)no1 818398152 VZOFPLXZAOCKCZ-MRXNPFEDSA-N 376.501 5.157 30 20 GKED Cc1ccccc1[C@H](C)c1noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n1 848610080 JJKSUVVCHCHNGD-FUHWJXTLSA-N 398.507 5.180 30 20 GKED Cn1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc(Cl)c1Cl 915084989 CNFHFZCHYMPXHC-MRXNPFEDSA-N 384.266 5.240 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc2oc3ccccc3c2cc1OC 915307165 WISRMOOMYXYSMX-UHFFFAOYSA-N 392.480 5.876 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccccc2)C2CC2)cc1 915353195 LVVJGSGSOHXDRC-XMMPIXPASA-N 381.479 5.539 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Br)o1)c1nc(-c2ccccc2)cs1 917024925 CNEKZNIGJBVJNG-QPBFKRLHSA-N 399.269 5.055 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 918034485 QSAIKRMWZJSZNS-NBGIEHNGSA-N 397.522 6.184 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)/C=C\c1nc2ccccc2s1 918585019 RLERQTUYYDRSOJ-PFONDFGASA-N 395.487 5.415 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 920026080 RSQIGYFVFFVEKQ-VWLOTQADSA-N 398.506 5.838 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(O)c2)cc1 1776125505 KICJVUQGXLCATG-ZSOIEALJSA-N 382.456 5.336 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)c2c(c1)C(C)(C)CC2 1776269195 CXUFEGQSLPJUDV-VQHVLOKHSA-N 394.486 5.941 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)cc1)c1ccccc1 1776469470 YUNZDOZAPUKOJD-DNXIFWLFSA-N 390.410 5.560 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(-c2cccc(C(=O)O)c2)s1 1777545338 KBSAYBSZNLUPNQ-CSKARUKUSA-N 394.496 5.404 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCOc4cc(F)ccc4C3=O)cc2)cc1 1777670924 BJEWFGIAUWRLDX-CPNJWEJPSA-N 388.394 5.240 30 20 GKED Cc1ccccc1N/C(S)=C(\C(=O)c1ccc(C(C)C)cc1)[n+]1ccccc1 11168288 MRDPAVKMEUWTSD-UHFFFAOYSA-O 389.544 5.457 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Br)cc1Cl 58861582 LWPHZGTWERPSQG-UHFFFAOYSA-N 379.685 5.323 30 20 GKED COCc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)cc1 58984845 HDJYUVFEPMGQON-INIZCTEOSA-N 382.529 5.169 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 116503588 LYHVCZARLXEGHU-SANMLTNESA-N 390.574 5.015 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](c1ccccc1)C1CC1 123096431 JYOKBNRQFPXCBD-QFIPXVFZSA-N 383.451 5.186 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1cccc2ncccc12 128861316 YEYFJBPZGBVQDI-UHFFFAOYSA-N 379.419 5.175 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSCc1ccccc1 148293428 UDXNMGKRKIPMEJ-MRXNPFEDSA-N 378.497 5.098 30 20 GKED Cc1ccc(OCc2nnc(SCc3ccccc3C(C)(C)C#N)o2)cc1 151458376 VMGZHRYTTPNSDX-UHFFFAOYSA-N 379.485 5.051 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2CCC(F)(F)F)cc1OC 157230014 SHQRJENALIDDNF-UHFFFAOYSA-N 379.378 5.007 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 160111949 YNQMLDVIXGBHOH-GOSISDBHSA-N 386.480 5.051 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnn(CC(C)C)c1C 160943054 QSADVGMPILZYJR-UHFFFAOYSA-N 388.471 5.072 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(CN(C)Cc2cscn2)c1)c1ccccc1 187884941 UBVOMFQWUPYEND-QFIPXVFZSA-N 391.540 5.074 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(NC(=O)C2CCCC2)CC1 189877660 ACOYZPBMAHRYER-UHFFFAOYSA-N 396.575 5.342 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1 191420368 XSHGAGFDYZNFKL-UYAOXDASSA-N 398.572 5.720 30 20 GKED OC(=Nc1ccc2nc(C3CC3)sc2c1)N1CCC(Cc2cccnc2)CC1 329103765 CHMVSPXSCYPJCY-UHFFFAOYSA-N 392.528 5.069 30 20 GKED CC[C@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1c(C)noc1C 329491620 VPOOYBMSMRUYNX-HKUYNNGSSA-N 384.524 5.206 30 20 GKED Cc1ccc(Br)cc1N=C(O)c1sc([C@H]2CCCOC2)nc1C 330265626 ZMFDOQMLBFTMQC-LBPRGKRZSA-N 395.322 5.053 30 20 GKED CC(C)[C@H](NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1ccc(F)cc1 410214964 KCTUOBAYQVYBJV-VSKRKVRLSA-N 379.479 5.004 30 20 GKED C[C@H](CC(F)F)C(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 415425868 DBPBAVPZALNIES-PELKAZGASA-N 377.275 5.059 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)c3cccc(SCC#N)c3)c2)C1 429854507 PVVFCHVROPBQFZ-LAUBAEHRSA-N 394.540 5.650 30 20 GKED N#CCCC[C@@H](NS(=O)(=O)c1ccccc1-c1ccccc1)c1ccccc1 431644714 LFCLAQXZWHBHGR-JOCHJYFZSA-N 390.508 5.067 30 20 GKED Fc1ccc(F)c([C@@H](NCc2ccccc2OCC(F)(F)F)C(F)F)c1 434666012 OQWJTPZUVMNENG-OAHLLOKOSA-N 381.291 5.002 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c1 437564677 CEKIHORJEOTEDY-UHFFFAOYSA-N 389.411 5.352 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)Nc2ccc(CC#N)cc2)cc1 437603227 OMRZKKFBVLGPOL-SFHVURJKSA-N 399.494 5.653 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)CCCC1(C)C 445241738 RQIOAQMCFVGVSN-LJQANCHMSA-N 381.476 5.131 30 20 GKED C=CCn1c(SCc2cccc(Cl)c2Cl)nnc1-c1ccccn1 446064720 WJNOBAYLXYGPIJ-UHFFFAOYSA-N 377.300 5.125 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455699317 GZOUUNMCQXMBJI-CYBMUJFWSA-N 390.940 5.519 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NCC(C)(C)CC#N)cc1 459252372 BTHSYPCCXNMGIA-KRWDZBQOSA-N 379.504 5.004 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)C(C)(C)C#N 460660476 SWLISXRQGHRZRG-UHFFFAOYSA-N 378.451 5.220 30 20 GKED N#C[C@H](C(=O)c1ccc(CCC(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 464472798 PTNGIBKKTJUIQM-AWEZNQCLSA-N 386.295 5.085 30 20 GKED CC[C@H](NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1ccc(Cl)s1 465921107 JTFWVYLASDUJQT-ULQDDVLXSA-N 387.936 5.334 30 20 GKED CSc1cccc(C)c1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 472238628 GRRDCHTWDCSKNR-UHFFFAOYSA-N 388.492 5.420 30 20 GKED N#CC[C@H](CC(=O)NC1(c2ccc(Br)cc2)CCC1)c1ccccc1 475181580 CWNHIFJRTUNMFI-QGZVFWFLSA-N 397.316 5.032 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc(C(C)(C)C#N)cc2)s1 475253736 DVLNBHLLZUIBPY-UHFFFAOYSA-N 378.497 5.293 30 20 GKED N#CC[C@@H](CC(=O)N1CCc2ccccc2[C@H]1c1ccccc1)c1ccccc1 475763020 PQMUBRBFKWUMPH-JYFHCDHNSA-N 380.491 5.248 30 20 GKED N#CCc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)cc1 480270287 XRDYBHFLRSCTHS-RPWUZVMVSA-N 382.463 5.074 30 20 GKED N#C[C@@H](C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1nccc2ccccc12 483240259 GTRJOAYSOPNPJD-OAQYLSRUSA-N 383.838 5.440 30 20 GKED CC1(C)CN(C(=O)Nc2cc(C(F)(F)F)ccc2F)CC[C@@H]1C(F)(F)F 483713117 NPWHQHLLEIXHPC-LBPRGKRZSA-N 386.311 5.287 30 20 GKED C=CC[C@@H](C(=O)Nc1nc(-c2ccc(NC(C)=O)cc2)cs1)c1ccccc1 487600172 WVZILNBKNZHESF-LJQANCHMSA-N 391.496 5.067 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(CC3CCC3)CC(F)(F)F)c2)cc1 488687347 QXIIWYWPFJHEQO-UHFFFAOYSA-N 388.389 5.155 30 20 GKED Cc1ccc2nc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)ccc2c1 497366571 TVLNMDLVQYQQJA-SFHVURJKSA-N 394.459 5.028 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Cl)c1OCC(F)F 497539476 XKZOTUFQWQMQME-UHFFFAOYSA-N 386.851 5.266 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)[C@@H](C)Oc3ccc(C#N)cc3)c2)C1 499170053 OXMLBUKKRLMJCE-PMAPCBKXSA-N 392.499 5.060 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)N(Cc1ccco1)c1ccccc1C#N 500993067 CKBADMFSQGKKNE-MRXNPFEDSA-N 394.858 5.114 30 20 GKED CCN(C(=O)CCOc1ccc(Cl)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 509584600 DAWAUPWLOOBXTO-AWEZNQCLSA-N 391.298 5.244 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)[C@H]1C[C@@H]1C(F)F 509973632 QEKXICFWWBZEGW-YUMQZZPRSA-N 393.299 5.200 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCCC2CCCC2)cc1 511320618 NKTOJWPTAPZNCB-UHFFFAOYSA-N 377.488 5.033 30 20 GKED C=CCN(C(=O)Cc1cc(Cl)ccc1OC)c1nc(-c2ccccc2)cs1 512083980 UEFZEPQUNXWPSV-UHFFFAOYSA-N 398.915 5.234 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1nc2ccccc2[nH]1 513696281 VWTYNJWAODDYGL-LLVKDONJSA-N 386.263 5.574 30 20 GKED N#Cc1c(NC(=O)CCCc2nc3ccccc3s2)sc2c1CCCCC2 514607625 TZEDOWRSTDLORZ-UHFFFAOYSA-N 395.553 5.460 30 20 GKED COc1ccc2oc(C(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)c(C)c2c1 517605615 NWTXTLNICKNVHA-MRXNPFEDSA-N 389.238 5.051 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3CCCC[C@@H]3C(F)(F)F)c2)cc1 517841305 KEFJVZBQZAXJDQ-OALUTQOASA-N 388.389 5.658 30 20 GKED Cc1ccc2oc(C(=O)N[C@@H](C#N)c3ccc(OCc4ccccc4)cc3)cc2c1 519129519 ZUIZTVOGZMXYFB-QFIPXVFZSA-N 396.446 5.315 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)CC1CCC1 519449019 QZIAGAJGWXXUHR-SFHVURJKSA-N 393.556 5.773 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4cc[nH]n4)c3)cc2)cc1 520336784 VECKLXMDXOSXDP-UHFFFAOYSA-N 394.434 5.187 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccccc1CSc1nc2ccccc2o1 521312118 PYNITOKLBBSSNH-UHFFFAOYSA-N 393.512 5.180 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1Cl 522073337 FFHVXXGWTYSQPA-UHFFFAOYSA-N 395.812 5.673 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1nc(C(C)(C)C)cs1 524672595 JWEIOBFHEQVCCV-OAHLLOKOSA-N 389.524 5.470 30 20 GKED C[C@H](Cc1nc2ccccc2s1)NC(=O)c1ccccc1-c1ccccc1C#N 532059670 QDYHEZGUGBKQPL-MRXNPFEDSA-N 397.503 5.196 30 20 GKED C=C[C@@H](CC(=O)N(C[C@@H]1CCCO1)c1nc2ccccc2s1)c1ccccc1 536215568 URWRCORVKFKUBN-HKUYNNGSSA-N 392.524 5.168 30 20 GKED C[C@@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(Oc2ccccc2)c(F)c1 543821196 RWUVSXSJTZTMNS-MRXNPFEDSA-N 381.451 5.014 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543863113 JFPACYGHQOXOAJ-UXHICEINSA-N 397.522 5.520 30 20 GKED CSC[C@](C)(C#N)NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 565564466 VDXHQXPUTFUMIY-SFHVURJKSA-N 395.311 5.161 30 20 GKED N#CCC1CCN(c2nnc(-c3sc4ccccc4c3Cl)n2C2CC2)CC1 576354015 MCYMNIVMXSKWOV-UHFFFAOYSA-N 397.935 5.278 30 20 GKED N#Cc1ccc(Oc2cc(C(F)(F)F)nc(-c3cccnc3)n2)c2ccccc12 581060040 UQDRXZNZWZCWEK-UHFFFAOYSA-N 392.340 5.375 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c12 583475430 MGUJQKKFXZUCNQ-SFHVURJKSA-N 396.450 5.262 30 20 GKED CCN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@@H]1CCOC(C)(C)C1 583593276 SNXMMFZYEIHVDP-LJQANCHMSA-N 393.487 5.162 30 20 GKED COc1cc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)ccc1OC(F)F 591807638 MSDGKTLZRCLKHH-UHFFFAOYSA-N 397.290 5.563 30 20 GKED C[C@@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(O[C@H](C)c2ccccc2)cc1 595750947 DKHGVVQEWOMAHR-RTBURBONSA-N 391.515 5.223 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 598822525 WTCYYKKXCNKIAS-MRXNPFEDSA-N 382.332 5.116 30 20 GKED Cc1ccc(CSCCC(=O)Nc2ccccc2C(F)(F)F)cc1C#N 600649251 UUCUFGWNOUGXSE-UHFFFAOYSA-N 378.419 5.148 30 20 GKED CCCCN(C(=O)Nc1cc(C#N)ccc1OC(F)F)[C@H](C)c1ccc(C)o1 609080235 DXEAMLSRDDARND-CQSZACIVSA-N 391.418 5.456 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)sc1C 609104299 UMNSOFFRLNLIGI-UHFFFAOYSA-N 380.444 5.207 30 20 GKED CCCCN(CC(F)(F)F)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297990 QFWKTDFRNLHZBC-UHFFFAOYSA-N 394.368 5.294 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H]1CCCc2ccccc21 609371141 GOVPCSISDDQYNR-LJQANCHMSA-N 397.478 5.503 30 20 GKED CC[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 609389459 RXDPJBFCJSAWDO-APWZRJJASA-N 384.570 5.904 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CC1 609643155 WLEAHNAQTJKXOL-QGZVFWFLSA-N 386.451 5.096 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1ccc(OCc2ccccc2)cc1 609669678 SHVXZZJAUUGHNQ-UHFFFAOYSA-N 383.373 5.163 30 20 GKED Cc1cccc([C@H](C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 610048272 SEMZQYCNEJTISW-IBGZPJMESA-N 384.479 5.496 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCC2(c3ccc(F)cc3)CCCC2)c(Cl)c1 611096106 NJMNLHTVEJVHSK-UHFFFAOYSA-N 391.273 5.246 30 20 GKED Cc1nc(C)c(C(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)s1 613393466 IHKSMLBKKQHREC-HIHZZFLASA-N 397.569 5.174 30 20 GKED CC(C)(C#N)c1ccc(CN2CCO[C@@H](c3ccc(C(F)(F)F)cc3)C2)cc1 614182516 UKMCJHNLOJBWNE-HXUWFJFHSA-N 388.433 5.080 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccccc2F)n1 661118062 VWSASERAVZROEN-QFBILLFUSA-N 387.524 5.191 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1ccc(OC(C)C)cc1 726446285 XFMLNEJCMFGSCZ-UHFFFAOYSA-N 380.966 5.574 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=S)Nc1ccc(C#N)c(Cl)c1 726455517 NIQXZZQDXGGSJN-UHFFFAOYSA-N 383.826 5.059 30 20 GKED Clc1ccc(C=NOCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1 726593792 CDTJCPGTIDGMHH-UHFFFAOYSA-N 382.634 5.248 30 20 GKED Cc1cccc2c1C/C(=C/c1csc(COc3ccc(Cl)cc3)n1)C2=O 729148813 BFQYAFUOXFKJMS-ZROIWOOFSA-N 381.884 5.506 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1cccnc1Cl 729244722 FLZDCAOEWOCMKD-UHFFFAOYSA-N 382.250 5.107 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(-c3ccccc3C)c2)cc1NC(C)=O 729644065 OTIPDLHDZIQYLR-QBFSEMIESA-N 385.463 5.525 30 20 GKED N#C[C@@H](C(=O)CSc1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 730420136 AAMBOGCZILZDJG-KRWDZBQOSA-N 392.480 5.557 30 20 GKED N#C[C@@H](NC(=O)c1ccc(SC(F)F)cc1)c1cccc(Cl)c1Cl 731195922 QMCQBHTUXSZFJD-CYBMUJFWSA-N 387.238 5.303 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc2nc(Cl)ccc2c1 736719008 RKGUCKORDRNULL-UHFFFAOYSA-N 377.875 5.058 30 20 GKED C=CCn1c(-c2cccnc2)nn(CN2CCCC3(CCCCCC3)C2)c1=S 743386415 ZFJVAQXVLKNKLE-UHFFFAOYSA-N 397.592 5.056 30 20 GKED C#Cc1cccc(NC(=O)N2CCC[C@H]2c2nc(-c3ccccc3)c(C(C)C)o2)c1 748940600 HDTSMSKIJJQCQP-NRFANRHFSA-N 399.494 5.815 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(-c2ccccn2)nc2ccccc12 752391274 UGOALPKLPNZCSD-UHFFFAOYSA-N 385.492 5.187 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(Br)c(Cl)c1Cl 754660393 UQVBUQYDWBMZEB-UHFFFAOYSA-N 398.087 5.003 30 20 GKED C#CC[C@@H](NCc1ccc(OCc2cn3cccc(C)c3n2)cc1)c1ccccc1 756998451 VXPOAQASLSKCBQ-RUZDIDTESA-N 395.506 5.076 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@@H](c1cccnc1)c1cccc(C(F)(F)F)c1)OCC 759594435 GNYMHOYRDILZRF-UYAOXDASSA-N 393.405 5.104 30 20 GKED CC(C)c1ccc([C@@H](NC[C@@H](O)c2ccc(C#N)cc2)c2cccs2)cc1 763233810 OQNPTNGHVFOFRQ-FYYLOGMGSA-N 376.525 5.156 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3c(C(C)C)cccc32)c1 772983732 KLNWVVNURJXFBS-AUSIDOKSSA-N 378.516 5.494 30 20 GKED COc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1NC(=O)OC(C)(C)C 774280254 JMRDRZPRIABSJJ-UHFFFAOYSA-N 395.503 5.455 30 20 GKED CC(C)N(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc(Nc2ccccc2)cc1 776843307 RPEMKXITYWOPRB-UHFFFAOYSA-N 395.506 6.041 30 20 GKED C#CC[C@H](NCc1c(C)nn(Cc2ccc(Cl)cc2)c1C)c1ccccc1 785784379 ACPLKYXLKQZILJ-QHCPKHFHSA-N 377.919 5.056 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC(N2CCCCC2)CC1 789449169 CTBIRCFFFVVUCO-UHFFFAOYSA-N 383.580 5.457 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2Cl)nnc1-c1ccc(F)cc1 799875320 WVBOSCCBGSNTGC-UHFFFAOYSA-N 395.290 5.264 30 20 GKED C=C(C)COc1cccc(NCc2cnc(NC(=O)OC(C)(C)C)s2)c1 800247999 CLNFDLHZEOQRJV-UHFFFAOYSA-N 375.494 5.057 30 20 GKED N#C[C@@H](C(=O)[C@H]1C[C@@H]1C(F)F)c1nc(-c2ccc(Cl)cc2Cl)cs1 802044199 JJMDCWQIVHPFQY-DCAQKATOSA-N 387.238 5.194 30 20 GKED CC(C)c1ccc(NC(=S)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 811708225 TZJPUMINSXTDCP-UHFFFAOYSA-N 388.496 5.678 30 20 GKED CC(=NNc1cc(C#N)cc(Cl)n1)c1sc(-c2ccc(F)cc2)nc1C 814890983 JNZAAHFINDDTJR-UHFFFAOYSA-N 385.855 5.014 30 20 GKED N#C[C@H](C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1nc2cc(F)ccc2s1 820031111 DBCXBWMPDJMFRD-DHWUFPBPSA-N 396.409 5.226 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 820125291 HAUNUPPJBLKJMH-KFWWJZLASA-N 397.371 5.687 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(NCc2cc(C#N)ccc2Br)cc1 864005490 YOPPKRXGIDPOGF-MRXNPFEDSA-N 398.348 5.307 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1ccc(N2CCCCC2)c(F)c1 915917454 BVNPXYCFNNMAOC-UHFFFAOYSA-N 380.389 5.066 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026894 RTDUAJOECYAREX-UZLBHIALSA-N 390.508 5.577 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1O 917605252 QXPRJBZTMKIMAH-NTMALXAHSA-N 395.436 5.324 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)C(=O)c2ccccc21 1776308874 ULLVQDNTGXSEOK-BHSBJAHRSA-N 388.419 5.370 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc(F)c(C(=O)O)c(F)c3)s2)cc1 1777430636 WIVDEISEHRBCKZ-YVMONPNESA-N 399.418 5.299 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(C)c(C(=O)O)c3)s2)cc1 1777430652 YPDBXFMIQUILNC-FLIBITNWSA-N 377.465 5.330 30 20 GKED C=CCCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(C)C)CC1 1823753537 SOVHNLPTUCLKRL-OAQYLSRUSA-N 390.612 5.035 30 20 GKED C[C@@H](N[C@@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccccc1C#N 12667558 GPNABHVLBWBPNN-YKSBVNFPSA-N 397.522 5.239 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(-c3ccccc3)no2)nnc1-c1ccccc1 53047999 JXGVFUADHPBCSP-HNNXBMFYSA-N 389.484 5.034 30 20 GKED C#CCOc1ccc(NC(=O)c2ccc(SCc3csc(C)n3)cc2)cc1 78667856 LMISKNCSYZSWLW-UHFFFAOYSA-N 394.521 5.008 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@@H](C)c1nc(C(C)C)no1 102778746 FCRKSMYGIPSURA-INIZCTEOSA-N 376.460 5.125 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 103329384 NKDSBXOWBXXCOO-IRXDYDNUSA-N 398.384 5.104 30 20 GKED C=CCc1ccc(OCC(=O)Nc2ccccc2-c2cccs2)c(OC)c1 105353971 CVRMFVQGMFNYFG-UHFFFAOYSA-N 379.481 5.170 30 20 GKED CO[C@@](C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 106985069 LEVXTGXDIQAEFP-DYESRHJHSA-N 396.899 5.202 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 111020766 YFCRFPDSQCPIAV-UHFFFAOYSA-N 394.471 5.513 30 20 GKED CC1(c2ccccc2)C/C(=C/c2cncs2)C(=O)/C(=C/c2cncs2)C1 119034632 HPJGEXVGRSDPLK-BSHIDLADSA-N 378.522 5.387 30 20 GKED N#CCC[C@H](NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccccc1 153119739 RJJQLXDQYIGXPO-IBGZPJMESA-N 393.874 5.089 30 20 GKED CC(C)(C)SCCCC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 155263642 OPOWPRZWNNRZNH-INIZCTEOSA-N 383.542 5.170 30 20 GKED CC(=O)N(c1nc(CN(CC#N)C2CCCC2)cs1)c1c(C)cc(C)cc1C 165994027 DIRJQUYOENWPRY-UHFFFAOYSA-N 396.560 5.021 30 20 GKED CC(C)(C#N)CCCSc1nnc(COc2ccccc2Cl)n1C1CC1 177153484 JESATBLSJNOMEX-UHFFFAOYSA-N 390.940 5.267 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 193045018 XWDONDNDVONKEO-CQSZACIVSA-N 378.501 5.322 30 20 GKED C=CCSCCNC(=O)c1oc2ccccc2c1CSc1cccs1 195728543 YJZDVAMHUXIKOE-UHFFFAOYSA-N 389.567 5.436 30 20 GKED C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cccc(C#N)c1 237556352 DYUFLXJHNZQCIW-HNNXBMFYSA-N 391.402 5.249 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2cc3ccccc3c(Cl)n2)ccc1OC 301288261 SHFDHIDHLHPBFB-MRXNPFEDSA-N 381.863 5.190 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(CN2CCCCC2)c1 302962605 PDWBMNMJMUYNQC-UHFFFAOYSA-N 395.506 5.463 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3ccccc3)c2)cc1 303664553 XEVUILGKRPASGB-XMMPIXPASA-N 382.463 5.115 30 20 GKED C/N=C(/O)C1(/C(O)=N/[C@@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)CC1 329140690 JPXOFOAUUPWVLY-GDBMZVCRSA-N 382.426 5.445 30 20 GKED Cc1cc(C)c(N=C(O)CN2CCCC[C@H]2c2n[nH]c(C(C)C)n2)c(Cl)c1 329852716 ROWJRQASZWLWAB-INIZCTEOSA-N 389.931 5.014 30 20 GKED C[C@H](NC(=O)NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccc(C#N)cc1 409494544 FZUINZCRCFABHJ-INIZCTEOSA-N 389.430 5.050 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@H]1CCC[C@H](C(F)(F)F)C1 410399330 DKGPMJPVABXMOO-UWVGGRQHSA-N 387.295 5.074 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1NC(=O)[C@H](C)CC(=C)C)C(C)C 411086569 OVPMYEQWSGYRAJ-UXHICEINSA-N 384.564 5.567 30 20 GKED N#CC1(CC[S@](=O)Cc2csc(-c3ccc(F)cc3)n2)CCCCC1 417161820 RCHLZVMPNBBFSY-VWLOTQADSA-N 376.522 5.062 30 20 GKED CC(C)(C)Cc1nc(-c2cccc(C(=O)Nc3ccc(C#N)cc3Cl)c2)no1 430357908 UAAUXLGTEOTALY-UHFFFAOYSA-N 394.862 5.103 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 431852771 BHVHKXOFWOYGQB-UHFFFAOYSA-N 384.357 5.109 30 20 GKED CCOc1ccc(OCC)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 432636428 YDECWWWKOCQGDB-IBGZPJMESA-N 381.476 5.041 30 20 GKED CCc1ccc(CCSCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 437437119 VAGXNPCHLJGRLY-QGZVFWFLSA-N 398.597 5.415 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(OC(F)(F)F)c1 441238666 ZDUZCKNVTMPYJI-ZDUSSCGKSA-N 391.393 5.269 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)s1 443885787 ZMBSHCFZPSBDJO-GFCCVEGCSA-N 389.546 5.085 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ncc(-c2ccccc2)o1 444253030 YFGMRYHGUPJOJP-QGZVFWFLSA-N 398.466 5.091 30 20 GKED CCC[C@H](NC(=O)NCc1cc(C#N)ccc1F)c1cccc(C(F)(F)F)c1 465835689 KDXYEGFFAALZLE-SFHVURJKSA-N 393.384 5.057 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(-c2cccnc2)cc1 466952288 RSDPEZYPTCCPEK-UHFFFAOYSA-N 397.931 5.361 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 469493278 DHCRBSKCDJPGGE-UHFFFAOYSA-N 385.389 5.525 30 20 GKED C=CCCC1(C(=O)N2CCC[C@H](c3nc(-c4ccccc4OC)cs3)C2)CC1 477088960 NAOYQMHXQWASQJ-KRWDZBQOSA-N 396.556 5.271 30 20 GKED N#Cc1cccc(OCCCSc2nnc(-c3cccc4ccccc34)o2)c1 477527315 QCNCZIZEOSBSHE-UHFFFAOYSA-N 387.464 5.323 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@H]1c1ccccc1 480803099 HLHAYTYANUMCIX-UZUQRXQVSA-N 383.451 5.575 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccccc1CC(=O)OC(C)(C)C 486434975 PNQJPQBFPNAMIK-UHFFFAOYSA-N 383.513 5.101 30 20 GKED Cc1c(Br)ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1F 487482072 FHBBWZFJYPPUAE-KRWDZBQOSA-N 389.268 5.062 30 20 GKED C=C[C@H]1CCCCN1C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 488866067 LFRWQCPZSPIRDQ-PBHICJAKSA-N 390.936 5.184 30 20 GKED C=CCC(C)(C)CNC(=O)c1ccccc1SCC(=O)Nc1ccc(C)cc1 490055391 BZEYSQLIIYGNIQ-UHFFFAOYSA-N 396.556 5.058 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](CC)c1ccccc1OCC 490061778 UBZHPKVEWLOOFF-OAQYLSRUSA-N 398.551 5.102 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3oc(-c4ccccc4)nc3C)n2)cc1 496574948 RXTQWGQWPRSAGE-GOSISDBHSA-N 399.475 5.572 30 20 GKED Cc1nc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)ccc1C#N 500343499 HHSYFLFCAHQPCS-UHFFFAOYSA-N 399.237 5.008 30 20 GKED N#CCCN(C(=O)CSC(c1ccccc1)c1ccccc1)c1ccccc1 502536049 QPYAKBWIJCVVJZ-UHFFFAOYSA-N 386.520 5.456 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 503201697 PSKAWXVUKDDFFZ-UYAOXDASSA-N 393.556 5.628 30 20 GKED CCCc1csc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 503910710 OEYRZLLSWXIBAB-UHFFFAOYSA-N 393.537 5.512 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCO[C@@H](c2ccc(F)cc2Cl)C1 505010072 BDWKZDWEJDLWQA-HXUWFJFHSA-N 388.870 5.203 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCCC[C@H]1c1noc(C(C)C)n1 505022172 BBSQKOTWKNFJNQ-IBGZPJMESA-N 382.508 5.461 30 20 GKED Cc1ccnc2sc(C(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)c(C)c12 505313766 JDGLSABMPPSQJT-ZDUSSCGKSA-N 390.295 5.215 30 20 GKED COc1cc(C)c([C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1OC 507650970 CDNCFEFYLYKJRV-NWKXHEKXSA-N 378.516 5.067 30 20 GKED Cc1noc(C)c1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 509717786 DEAXWOPHTZEBAW-QGZVFWFLSA-N 380.835 5.244 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(CC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 513235299 AKXYQMFEUOTLPM-OPYAIIAOSA-N 393.556 5.102 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1OCCC 513661635 UGWALNFEYYIWAP-INIZCTEOSA-N 394.496 5.364 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccc2ccccc2n1 514501527 DZPLQVPXOUZDPJ-UHFFFAOYSA-N 395.487 5.188 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 517653454 UJXYBBGPXFWFMO-KRWDZBQOSA-N 394.418 5.009 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518385913 GKQRQYCYEQKRDC-QFIPXVFZSA-N 383.451 5.031 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)cc12 519977705 OTDSHHPDODCRCI-UHFFFAOYSA-N 398.422 5.262 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1ccc2ncccc2c1 522763297 SUOJUYNBAQPMAA-UHFFFAOYSA-N 395.437 5.401 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)c1ccccc1 527215546 KVJLLCIYRIIBHE-RTBURBONSA-N 389.524 5.090 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccc(OC)nc1)C1CC1 529083310 UZNFTUQQMAMDFE-OAQYLSRUSA-N 379.504 5.215 30 20 GKED COc1cc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)ccc1SC 537012007 ACQIYBOINDAYIT-KRWDZBQOSA-N 388.536 5.807 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 537739897 UYLGWKWUPYAEQZ-HNNXBMFYSA-N 384.932 5.696 30 20 GKED CC(C)NC(=O)Nc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 540728953 QLFFPZOXTLKIKR-QGZVFWFLSA-N 380.492 5.072 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccnc(C3CC3)c2)cc1Cl 543095921 UQZPFXGVMYHLAA-HXUWFJFHSA-N 387.870 5.520 30 20 GKED N#Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1Cl 548631174 PAYZMOICNOEDIN-GFCCVEGCSA-N 399.809 5.103 30 20 GKED C=CCC(C)(C)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 550934292 CEITWYCJSPCRON-UHFFFAOYSA-N 391.515 5.126 30 20 GKED C[C@@H](Sc1nc(C(F)(F)F)ccc1C#N)c1nc2ccccc2n1C(F)F 551100832 IHXWKQIQFMCZHF-SECBINFHSA-N 398.360 5.570 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccc(-n2ccnn2)c1 554386447 YNFFRCCVMRMRTI-MOPGFXCFSA-N 393.494 5.218 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(Cl)cc2cccnc12)c1ccccc1 562410266 DRVMXIUKFOHOEH-SFHVURJKSA-N 378.863 5.445 30 20 GKED N#Cc1ccc(CNc2ccc(-c3ncc4n3CCCC4)cc2)c(C(F)(F)F)c1 567524411 PBQBDEHLHVTHNO-UHFFFAOYSA-N 396.416 5.389 30 20 GKED C[C@@H](NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-c2cccc(C#N)c2)cc1 569301282 NAWFQPBXHRRPHB-IAGOWNOFSA-N 399.450 5.114 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC1Cc2ccccc2C1 569477363 JHKPHNFLIVNQEK-INIZCTEOSA-N 379.529 5.007 30 20 GKED COc1cc(CNC(=O)c2sc3cc(Cl)ccc3c2Cl)ccc1C#N 569654894 LBUUHEOOIOYERC-UHFFFAOYSA-N 391.279 5.018 30 20 GKED N#C[C@H](C(=O)c1csc(C2CCCCC2)n1)c1nc(-c2ccncc2)cs1 570913041 YPZNPBLOBVTLHC-OAHLLOKOSA-N 394.525 5.199 30 20 GKED O=C(CSCc1cc(F)c(C(F)(F)F)cc1F)Nc1c(F)cccc1F 571678628 RXCHXDAFSHJUAP-UHFFFAOYSA-N 397.315 5.134 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)s2)c2ccccc2Cl)cc1OC 571829564 RUOYBLQWTDXOFF-NRFANRHFSA-N 398.915 5.170 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2(C(F)(F)F)CC2)cc1Cl 574430580 NKYOBBUANAKDCB-MRXNPFEDSA-N 392.808 5.667 30 20 GKED Cc1nc(-c2cccc(-c3noc([C@@H](C)Oc4ccc(C#N)cc4)n3)c2)cs1 580492977 SJHFWUBHQZYADC-CYBMUJFWSA-N 388.452 5.180 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)C1 596649606 CZPSCSXXCYJEOM-HNNXBMFYSA-N 376.485 5.121 30 20 GKED CC(C)CC1(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 596695519 SRBDVQIKFGGXER-UHFFFAOYSA-N 377.488 5.032 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4ccc(F)cc4s3)cn2)c1 603623411 IYCIPECXIAYGCE-UHFFFAOYSA-N 389.411 5.352 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCOc2ccccc2C1 604365115 TZFVSFITHVCAAA-UHFFFAOYSA-N 399.450 5.086 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3csc(-c4ccccc4Cl)n3)[nH]c12 605363109 JJTQIOWMOYVMKW-CYBMUJFWSA-N 392.871 5.138 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)c3cccc(CC#N)c3)cc2)c1 609032695 BYUABYQDSKMGQU-LJQANCHMSA-N 384.479 5.131 30 20 GKED N#Cc1ccc(CCC(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)cc1 609646986 NVGUAOYKFGUBMO-UHFFFAOYSA-N 393.446 5.470 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2cccc(C#N)c2)nc1-c1ccccc1 610112887 NQVSFXJPJKNYHB-HXUWFJFHSA-N 385.467 5.314 30 20 GKED CCOc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610432012 SOYJHWAKEVELAX-UWJYYQICSA-N 379.504 5.105 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 610559029 LKXWFOGGWUSIGJ-UHFFFAOYSA-N 377.357 5.134 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c(Cl)c1C 611944291 URVWVGHSXVUOOV-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F 615500768 BMAYCTOYKBYTGD-UHFFFAOYSA-N 395.400 5.131 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)c1sc(-c2ccccc2)nc1C(F)F 618740401 YJVXFVXEKWEMKG-MRXNPFEDSA-N 395.434 5.037 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 618762880 SOWVYAFTYHKXNG-GOSISDBHSA-N 398.304 5.253 30 20 GKED Fc1cc(-c2ncco2)ccc1CN1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 662543718 MYMNZKZHBGETCE-STQMWFEESA-N 396.306 5.043 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)s1)c1nc2cc(Cl)ccc2s1 671751720 MJUBAOLVVMSJAE-MRVPVSSYSA-N 386.807 5.520 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccccc2)c2ccc(OCC)cc2)c1 726456895 ICWUDLRIWTUMNB-HSZRJFAPSA-N 386.520 5.143 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 727589470 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XOCGQKFVUNYZST-QXMHVHEDSA-N 392.458 5.619 30 20 GKED CCCOc1ccc(C=NO[C@H](C)c2ncc(-c3ccccc3)o2)cc1OC 748097969 URAYMQMQFSJOTB-MRXNPFEDSA-N 380.444 5.251 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)c1c(C)oc(-n2cccc2)c1C#N 754629052 IFPVKIBPCYBSSI-UHFFFAOYSA-N 391.471 5.208 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(Br)c(F)c1 767738210 XEGXCJGFNBDWAZ-DUXPYHPUSA-N 389.249 5.003 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c2ccccc21 768308581 KAVWAEFBYREQAW-RXVVDRJESA-N 398.510 5.186 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCc2sccc21)c1nc(-c2ccc(Cl)cc2)cs1 771577230 CSUHXSYQTAOBQQ-HZPDHXFCSA-N 398.940 5.821 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(OC)c(C3CC3)c2)cc1 774049556 BFHBNGQJKPNXML-BTYIYWSLSA-N 390.483 5.047 30 20 GKED C#CCCCCCC(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 780255533 STDAJTDQLQAAIR-NSHDSACASA-N 390.694 5.101 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1CCC(=O)Nc1ccc(Cl)c(C#N)c1 790541327 GRLSRXRJPFIMLU-UHFFFAOYSA-N 399.878 5.130 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1c(CC)cccc1CC 795138386 FZMGFMGWKZIWSQ-UHFFFAOYSA-N 384.593 5.364 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)Nc3ccccc3O[C@@H](C)C#N)c2)o1 797642671 JUJRRMUAWPXMEJ-INIZCTEOSA-N 375.428 5.498 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810530991 DWITXKMYDYLRQV-GWCFXTLKSA-N 397.352 5.436 30 20 GKED O=C(Nc1ccccc1SC(F)F)c1c(F)cc(C(F)(F)F)cc1F 812833401 KSOYHFAEVKIVIL-UHFFFAOYSA-N 383.288 5.551 30 20 GKED C=C1CCC(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)CC1 888228000 XSMAACVHLYYCOA-UHFFFAOYSA-N 392.377 5.236 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 917042181 DCOHCSXEVBCYIW-SDQPKGBYSA-N 390.361 5.344 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 917510227 YMMYMEWCUQGOOT-LJQANCHMSA-N 388.467 5.400 30 20 GKED Cc1ccc(S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1Cl 917738145 RXSNJTIFGMJDGH-HXUWFJFHSA-N 396.899 5.105 30 20 GKED CCCCCCCCCN(C)C(=O)C(=O)Nc1cc(Cl)cc2cccnc12 918477066 PZDXYNGXZYXLIW-UHFFFAOYSA-N 389.927 5.036 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccccc1OCc1ccccc1 918749153 NQHJIZCLDRUNFL-OAQYLSRUSA-N 399.538 5.466 30 20 GKED Cc1ccc2c(c1)C/C(=C/c1csc(COc3ccc(Cl)cc3)n1)C2=O 921269088 JGCQPXMFWSBXRV-GDNBJRDFSA-N 381.884 5.506 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776119948 QLRBJYRSTMZZRV-NTMALXAHSA-N 382.456 5.932 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2ccc(Oc3ccccc3F)c(F)c2)C1 1776155503 SAPFMEHXFIFIOZ-JOCHJYFZSA-N 387.426 5.000 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3cc(C(=O)O)c(Cl)s3)c(C)c2c1 1777376037 GSHSIHONIKNYMZ-PLNGDYQASA-N 376.817 5.059 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(Cl)c(Br)c1 1777436129 KPIOCNWHBAZDAA-DAXSKMNVSA-N 379.637 5.005 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccnn3CC3CCC3)s2)cc1 1777671227 VNKJEGVMOMWQBX-NTMALXAHSA-N 392.480 5.006 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cc[nH]c3C)cc2)CCC1 1788802411 DSVZXNCVKMPRQW-UHFFFAOYSA-N 393.531 5.063 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cccc(Cl)c2)[n+]2ccccc2)s1 22730607 OYIACYJZLSRABZ-UHFFFAOYSA-O 387.937 5.048 30 20 GKED Cc1c(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)oc2ccccc12 31776956 WYGWMBIIYZTKHG-UHFFFAOYSA-N 382.419 5.444 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 41554387 AOBFXRUPDGQXRH-CQSZACIVSA-N 387.386 5.022 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/CCc3ccccc3C2=O)cs1 54895566 MRXBROPFSZWVMX-AQTBWJFISA-N 388.492 5.349 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C(=O)NC1CC1)c1ccccc1 63641500 ZGFQRFDSHHFYID-DEOSSOPVSA-N 397.478 5.091 30 20 GKED CCC(=O)Nc1ccc(Cl)c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 66159875 ZXODLZDAJKOXSP-UHFFFAOYSA-N 398.894 5.003 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(=O)oc2cc3c(cc12)CCC3 68782278 UMCQJSOCIHYXMR-HNNXBMFYSA-N 390.508 5.146 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)[C@H]1CCC[C@H](C(F)(F)F)C1 70868411 YMRASIKQBXOWGY-UWVGGRQHSA-N 387.295 5.074 30 20 GKED CC(=O)c1csc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 106619665 XSRYHUUBQANSAD-SFHVURJKSA-N 394.883 5.512 30 20 GKED COc1ccc(CC[C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108528690 NFEOJDQOSSICMK-IAGOWNOFSA-N 397.544 5.090 30 20 GKED CCN(C(=O)CCc1cccc(OC2CCCC2)c1)[C@H](C)c1ccc(C#N)cc1 110587920 QUFYQGLTURUYSB-LJQANCHMSA-N 390.527 5.422 30 20 GKED N#C[C@H](C(=O)CSC1=Nc2ccccc2C1)c1nc(-c2ccccc2)cs1 118606917 HLXOJTKJRNRNFV-MRXNPFEDSA-N 389.505 5.006 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 123764856 CQJQNMNBTYHWCK-UHFFFAOYSA-N 380.492 5.164 30 20 GKED N#C[C@@H](C(=O)c1cncc(-c2ccccc2)c1)c1nc2cc(Cl)ccc2s1 124603533 ZOOQESCMUUROJY-KRWDZBQOSA-N 389.867 5.502 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1ccc(C#N)cc1 126592838 WCKTXGINACMZML-UHFFFAOYSA-N 395.871 5.086 30 20 GKED N#C[C@H](C(=O)Nc1ccc(SC(F)F)cc1)C(=O)c1ccc2ccccc2c1 126596499 WIJNEXLBJLOPQM-SFHVURJKSA-N 396.418 5.116 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 126914361 QQRLLWWIJZIQBW-UHFFFAOYSA-N 397.381 5.298 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCc1cccnc1)c1ccc(C#N)cc1 128056627 HVEGZOAOIKITDF-MRXNPFEDSA-N 377.875 5.036 30 20 GKED COc1ccc(C(=O)Nc2cccc(CN[C@H](CCC#N)c3ccccc3)c2)cc1 130464292 JVBKSEIVRKEOQK-XMMPIXPASA-N 399.494 5.082 30 20 GKED C[C@H](Sc1nc2ccccc2s1)C(=O)Nc1ccccc1SCCC#N 134981377 UXMXRVZZZIZSEJ-ZDUSSCGKSA-N 399.566 5.421 30 20 GKED Cc1nc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)sc1C 138330889 GLFNBDYIQQYARW-UHFFFAOYSA-N 394.475 5.005 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 151062091 QDLQYGJTYFWEKR-PKOBYXMFSA-N 394.544 5.189 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc(Cl)ccc2Cl)ccc1OC 154691193 FBEPZOQVEZKYNY-XJKSGUPXSA-N 393.314 5.534 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 177088738 IPLYJADTOBWUPB-ZDUSSCGKSA-N 389.471 5.273 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2c(F)cccc21 181714855 PHOMMIVNNSQOSQ-PBHICJAKSA-N 399.491 5.255 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3cc4c(s3)SCC(=O)N4)cs2)cc1 184340546 UQAKQROAMGVGEU-VOTSOKGWSA-N 398.534 5.120 30 20 GKED C[C@@H](NCc1ccc(Cl)cc1C#N)c1cccc(OCc2ccccn2)c1 187415900 RGCKLQUNSXDGJK-MRXNPFEDSA-N 377.875 5.036 30 20 GKED COc1cc(O[C@H](C)c2nnc(-c3ccc(Cl)c(Cl)c3)o2)ccc1C#N 194496362 CNQYPNOFSBNRDG-SNVBAGLBSA-N 390.226 5.064 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1ccc(Br)cc1 206942983 ZIIBRGTUQLONJR-XFXZXTDPSA-N 394.268 5.319 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)c1)C(=O)O 208116637 PWVKOAMOVBBBLF-NVDWLVSRSA-N 399.657 5.395 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](CC)Sc2ccccc2)cc1 303503081 RTZGGIXVZUDBAS-NRFANRHFSA-N 394.540 5.010 30 20 GKED C[C@H](/C(O)=N/CC1CCCCC1)N1CCC([C@H]2C(O)=Nc3ccccc32)CC1 328704246 OSOCYQYOAKJWKO-IIBYNOLFSA-N 383.536 5.009 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@H]4CCC[C@H](C)C4)no3)C2)c1 329710299 MCDPTUNAJMGDHG-SZMVWBNQSA-N 382.508 5.097 30 20 GKED Cc1ccc(C2(C/N=C(/O)C3CCC(/N=C(/O)C4CC4)CC3)CCC2)cc1C 330046909 FBNKCFIBIIYCRJ-UHFFFAOYSA-N 382.548 5.607 30 20 GKED N#CCCCn1cc(C(=O)N[C@H](c2ccccc2)c2ccco2)c2ccccc21 426886401 LSZMPEKIARZBKC-HSZRJFAPSA-N 383.451 5.057 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCCC(F)(F)C1 433121306 RDXGDNVICWMVCN-HUUCEWRRSA-N 381.492 5.275 30 20 GKED CC(C)(c1ccc(C(=O)N[C@@](C)(C#N)CCc2ccccc2)cc1)C(F)(F)F 433842453 ICZXKUYDJOABNM-OAQYLSRUSA-N 388.433 5.171 30 20 GKED N#C[C@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1ccc(Cl)c(Cl)c1 436021227 OAEMSBDRQQTFJK-IUVQJJGASA-N 379.209 5.043 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2ccc(Cl)cc2n1 437557932 ODCRCZFFKVQVRX-CYBMUJFWSA-N 381.888 5.392 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCC(F)(F)F)cc1Cl 437763110 KKHBEEAOXPJDGV-MRXNPFEDSA-N 395.812 5.459 30 20 GKED C=CCN(C(=O)[C@H]1CO[C@H](C)C1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 439146037 KYFGZDYDAHZWPB-DGCLKSJQSA-N 397.327 5.061 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1)c1cnccn1 466994102 YHUXKOUDSRKUGL-CYBMUJFWSA-N 384.361 5.332 30 20 GKED C=CCCCCNC(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 474088738 KAOJTEJKVXFAKB-UHFFFAOYSA-N 391.437 5.169 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)c1ccc(F)c(F)c1 481198980 DLIGVXAJKNBFPT-QGZVFWFLSA-N 384.348 5.509 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1C 482787670 MCSJRLPAWPMJNN-MRXNPFEDSA-N 388.471 5.273 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C(C)(C)Oc1ccc(C#N)cc1 482803280 XLXAXGIIWHYVTL-GOSISDBHSA-N 391.515 5.042 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1CSCc1ccccc1 484290358 LUMOVXFYDWFUGZ-KRWDZBQOSA-N 392.524 5.488 30 20 GKED COc1ccc([C@@H](NCc2ccccc2C(C)(C)C#N)c2ccc(F)cc2)cc1 486460665 OVSMMYQBYWFBKX-DEOSSOPVSA-N 388.486 5.515 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1)c1ccccc1 489404299 OSOBGIOKBQCOPB-HXUWFJFHSA-N 397.465 5.136 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OC(C)(C)C)cn3)n2)cc1 496026729 DWFZIUWJQTUTCR-QGZVFWFLSA-N 391.496 5.181 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503894718 TWTANHAJOJKYJE-OAHLLOKOSA-N 382.916 5.008 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N(C)Cc1cccc(C#N)c1 515497959 FEDZLOPVEDIEKN-GFCCVEGCSA-N 379.312 5.004 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3csc4c3CCCC4)n2)cc1 518516488 GWOLQWODCJCLCH-MRXNPFEDSA-N 394.521 5.249 30 20 GKED Cc1cccc2c1CC[C@H]2NC(=O)c1ccccc1SCc1ccc(C#N)cc1 519112948 REVKXYMBBOOVMW-HSZRJFAPSA-N 398.531 5.576 30 20 GKED N#Cc1ccc(NC(=O)[C@H](Sc2ccc(F)cc2F)c2ccccc2)cc1 520679497 HPWWTLHVGXTPJA-HXUWFJFHSA-N 380.419 5.309 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]c3ncccc23)cc1Cl 521474913 GYYFQHKABLALCZ-SFHVURJKSA-N 386.842 5.124 30 20 GKED Cc1cccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 521811668 POYAQESMCNLFBG-QGZVFWFLSA-N 381.545 5.489 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)CCc1ccccc1 521811753 SKTWMZITZDJZDL-QGZVFWFLSA-N 381.545 5.614 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cc(C#N)ccc1OC(C)C 523582420 HTBXNPSNFSTMDD-UHFFFAOYSA-N 377.469 5.030 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc3nc[nH]c3c2)c1 523956119 ZAXAXNKJFSCJIX-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)[C@@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2 524018145 DWNXRUFXJOWDFH-XZOYJPPVSA-N 392.930 5.219 30 20 GKED CC[C@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 525345699 WKPWTKHPGYPWSI-IBGZPJMESA-N 393.487 5.546 30 20 GKED C=CC1CCN(Cc2nc(O)c3c(-c4ccc(C)cc4)c(C)sc3n2)CC1 532965553 AAMYJIUWENDMOM-UHFFFAOYSA-N 379.529 5.079 30 20 GKED C=CCCC[C@H](C)NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 540540452 VTSISRXBYNRLMR-LAUBAEHRSA-N 398.934 5.062 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(C(F)F)c1Cl 543653014 QRGFTZIZAIYSKQ-NVXWUHKLSA-N 389.833 5.581 30 20 GKED CC(=O)Nc1cccc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 543921920 ZNIVQBUIFIEVFB-ROUUACIJSA-N 383.495 5.595 30 20 GKED C[C@@H]1CN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)c2ccccc21 549816927 CIVMQBIRIZKXPA-QGZVFWFLSA-N 384.504 5.614 30 20 GKED C=CCn1c(S[C@H](CCOC)c2ccccc2)nnc1-c1cccc(OC)c1 569244154 HXHFWMOXMCEATJ-HXUWFJFHSA-N 395.528 5.010 30 20 GKED COc1cc(CN[C@H]2CCCc3nc(-c4ccc(C)cc4)sc32)ccc1C#N 569534631 MMKUMRWOJKVCFM-IBGZPJMESA-N 389.524 5.166 30 20 GKED Cc1cc(CN[C@@H](c2ccc(Cl)cc2)C2C[C@@H]3CC[C@H](C2)N3C)ccc1C#N 574332904 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O=C(C/C=C/c1ccc(F)cc1)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 673829616 AAVFNJSWZPIRFG-CKOUMYLXSA-N 397.334 5.255 30 20 GKED C[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 726441387 NCOBFMZJWLHRFJ-SNVBAGLBSA-N 383.826 5.278 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)ccc1F 728391997 DOWCIBHOUVZDSK-KRWDZBQOSA-N 377.341 5.085 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1OC 731113982 BCXWEKNXFRENIC-DOTOQJQBSA-N 383.517 5.220 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc(Cl)cc3)cc2)c1 731320495 VZVTWKZHCRXTCH-UHFFFAOYSA-N 379.872 5.813 30 20 GKED Cc1csc(Nc2ccc(NC(=O)c3ccccc3SCC#N)cc2)n1 732088820 YNARVAUOSURETI-UHFFFAOYSA-N 380.498 5.063 30 20 GKED Cc1sc2ncn(N=Cc3ccc([C@@H]4C[C@H]4C)o3)c(=O)c2c1-c1ccccc1 732764128 PYUMDAAUMUYBCS-CXAGYDPISA-N 389.480 5.032 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](Cc1ccccc1)c1cccs1)c1ccncc1 735189450 AACHFKXFAWHPEY-UXHICEINSA-N 377.513 5.044 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2ccc(F)cc2C)c(F)c1)c1ccncc1 735272947 NYUPZHMCLYBLRR-QFIPXVFZSA-N 378.422 5.382 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)Cc1cc(Cl)ccc1OCC#N 735309797 LPENJHKWBSZORD-ZDUSSCGKSA-N 382.813 5.454 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3c(Cl)nc4ccccn34)s2)cc1 737448023 CDLFNLBLQXZUEQ-MDZDMXLPSA-N 379.872 5.316 30 20 GKED O=C(/C=C/c1ccc(OC(F)F)c(Cl)c1)c1c(Cl)nc2ccccn12 737449051 METWEVYDNXASQQ-GQCTYLIASA-N 383.181 5.139 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1sc2c(c1C#N)CCCCC2 737469731 QARXAPAHIHLPKV-UHFFFAOYSA-N 395.459 5.244 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3ccccc3F)n2)cc1 739157837 XIDKGJZJUQWWEE-QAPCUYQASA-N 378.472 5.313 30 20 GKED C[C@H](NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1ccc(C#N)cc1 740778307 QFIHGLGHDJAMQQ-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED CCn1c(C(C)=NNc2nc(Cl)c(Cl)cc2Cl)nc2ccccc21 741458888 YTEMXMIXTYVCHT-UHFFFAOYSA-N 382.682 5.248 30 20 GKED N#C[C@@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc2cc(F)ccc2s1 744118139 FTTKJXMHYMZZAW-HTWSVDAQSA-N 378.472 5.586 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 747194274 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N#C[C@@H](CCc1ccccc1)c1nc(-c2ccccc2OCc2ccccc2)no1 904465546 UQEKPADCCAQQKO-OAQYLSRUSA-N 395.462 5.556 30 20 GKED COCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3F)o2)cc1OC 915993185 MEIDOFFGADHPMQ-CSKARUKUSA-N 396.414 5.016 30 20 GKED Cc1ccccc1C[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916681187 QNENTOPGEVBWRV-NTKDMRAZSA-N 383.495 5.403 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917027234 ZJHZZKHBBDVORI-HIFRSBDPSA-N 398.940 5.821 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccnc(Cl)c3)cc2Cl)cc1 917877183 WMRSKKXBRONOPK-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 918034678 VECOYZBSSGOTQY-HSZRJFAPSA-N 399.469 5.701 30 20 GKED Cc1c(NN=Cc2ccc(-c3cnc(C(F)F)s3)cc2)cccc1C(=O)O 1776090211 YKMICZWPNGAGBD-UHFFFAOYSA-N 387.411 5.200 30 20 GKED CCCCCCCOc1cccc(CNC2(C(=O)O)CCC(F)(F)CC2)c1 1776787377 XGDIPUVFOHDIND-UHFFFAOYSA-N 383.479 5.158 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C)c2nc(C(=O)O)cs2)c1 1776788094 RIFXGVHXZJZOBN-OAHLLOKOSA-N 376.522 5.041 30 20 GKED CCc1ccccc1N/C(S)=C(\C(=O)c1ccccc1C)[n+]1cccc(C)c1 55012292 ZBHZBAUGLPCOER-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(OCC2CC2)cc1 55993822 XNQIDTYVUTZYRZ-UHFFFAOYSA-N 399.450 5.095 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(SCc2cccc3ccccc23)s1 66239106 BRBMYTHPSDIPFQ-CQSZACIVSA-N 396.566 5.519 30 20 GKED Cc1ccccc1-n1ncc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1C 66802273 CSTKMPQVUAJFEL-MRXNPFEDSA-N 390.512 5.136 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C(=O)N1CCCCC1)c1ccccc1 108407404 NWUDCIOWUFNOGR-PGRDOPGGSA-N 393.556 5.104 30 20 GKED C=C(C)COc1cc(CNc2ccc(CN(C(C)=O)C(C)C)cc2)ccc1OC 150951717 KCHCVGAVWBWFTI-UHFFFAOYSA-N 396.531 5.019 30 20 GKED C[C@@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccc(C#N)cc1 154345350 SCTSXTBIGVQOFC-KUHUBIRLSA-N 377.488 5.549 30 20 GKED N#Cc1cccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)c1 159348110 TWRALVDFORYEFQ-UHFFFAOYSA-N 375.501 5.009 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1F 170673837 VWCPWBUAFZSVAC-KBXCAEBGSA-N 389.455 5.191 30 20 GKED COc1cccc(-c2nc(CNc3ccccc3S[C@@H](C)CC#N)cs2)c1 171000041 UPHCNIQBQXIAQR-HNNXBMFYSA-N 395.553 5.825 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)c2cccc(Br)c2)n1 177768830 CIZVVMQAPQIPBH-CQSZACIVSA-N 391.334 5.183 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(OC(C)C)cc2)ccc1OC 180811873 OPDZETWYPKYWGE-XLIONFOSSA-N 382.504 5.014 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1OC(F)F 181575318 BLKPCRXQZGIVRI-SUMWQHHRSA-N 396.384 5.585 30 20 GKED Cc1csc([C@@H](C)CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 185010022 FXYWSEPMRACACC-AWEZNQCLSA-N 392.484 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](Cc2ccccc2)C1 191434882 PVMDEYDFHGMNGX-NRFANRHFSA-N 378.516 5.014 30 20 GKED Cc1c(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1C1CCCC1 193558014 STCZDJVABYWHOO-CQSZACIVSA-N 383.521 5.202 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cnc(-c3cccs3)s2)cc1 195120094 PYJBIQAESUYMTF-UHFFFAOYSA-N 395.553 5.298 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1nc(-c2c(F)cccc2F)cs1 278063939 ZFXIACSJACTOTF-VWLOTQADSA-N 382.501 5.057 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCO2)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2 328714980 CQJZMYMQSFMTPV-BJWYYQGGSA-N 398.890 5.067 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1)N1CCCC1 329017030 QWSQWBIOAFSPBE-CEWLAPEOSA-N 383.536 5.391 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3ccc(C(C)(F)F)nc3)c2C#N)CC[C@H]1C 410976494 ATRCNRSSGLGUOY-MNOVXSKESA-N 375.444 5.065 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](CC(F)(F)F)C1 421064772 OAHYWMKECPSSLB-UONOGXRCSA-N 385.455 5.135 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ncccc1C(F)(F)F 425368421 WSOLCPZEKVLJIJ-GFCCVEGCSA-N 387.327 5.033 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2F)c1 430606411 VMQPJGOMANQOLR-QFIPXVFZSA-N 390.483 5.155 30 20 GKED CC1=C(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 431903231 OGGVDGGVIBIVGN-FQEVSTJZSA-N 379.891 5.569 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccnc3ccccc23)cc1F 437465093 DNYJCMXPWCJYNE-UHFFFAOYSA-N 383.382 5.290 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 438066813 RPLILLDHUMVBOU-ICSRJNTNSA-N 395.572 5.732 30 20 GKED COc1cc(CS[C@H](C)c2cccc(C#N)c2)c([N+](=O)[O-])cc1OC(F)F 443154880 QSKFLLZRQUTDHX-LLVKDONJSA-N 394.399 5.071 30 20 GKED CC[C@H](N[C@H](c1ccc(OC)cc1)c1ccccc1OC)c1ccc(C#N)cc1 447573759 JCNCGVQYTVYZGW-UKILVPOCSA-N 386.495 5.406 30 20 GKED CC(C)Cn1ncc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C(C)C 455038207 KLEGTGGQKQXMMD-LJQANCHMSA-N 381.524 5.219 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 455211515 CBCGHXVCRASIKA-IBGZPJMESA-N 385.895 5.684 30 20 GKED CCN(C(=O)c1cc(C)c(C#N)cn1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 457551900 GIPKERUTRJFBQZ-XMMPIXPASA-N 398.510 5.032 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=O)N[C@H](CCCC#N)c1ccccc1 458804161 SECZARICNNIZTG-JOCHJYFZSA-N 381.495 5.428 30 20 GKED Cc1oc2ccccc2c1CCNC(=O)Nc1ccccc1SC[C@@H](C)C#N 467335109 JHWCICCJAMKHPR-HNNXBMFYSA-N 393.512 5.357 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c(C)c1 471280587 WFBNAKAKTLRQLO-RTBURBONSA-N 393.556 5.719 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)Cc1ccccc1SC)c1ccc(F)c(F)c1 472195892 ZHRNDPWGAJRXIH-LJQANCHMSA-N 376.472 5.146 30 20 GKED Cc1ccc(-c2cccnc2)cc1N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1 479822671 FTDSSNKPXJWWEC-OAHLLOKOSA-N 390.874 5.021 30 20 GKED Cc1c(NCc2ccc(-c3ccccc3C#N)cc2)cccc1NC(=O)N(C)C 480148044 XNVDREJDUQMUAH-UHFFFAOYSA-N 384.483 5.239 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCCSC2)cc1Cl 483473085 TVFFZPVYFCQABO-WMZOPIPTSA-N 385.920 5.013 30 20 GKED CC(C)Oc1c(Cl)cccc1NCc1cn(C)nc1-c1ccc(C#N)cc1 490339068 HBHIJDYNPMDNLO-UHFFFAOYSA-N 380.879 5.011 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 494917746 BZWGTQXSNDEXGB-LGVFNWMJSA-N 396.515 5.025 30 20 GKED COc1cc(Cl)cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 496028428 LZGATWSLYCZYCQ-QGZVFWFLSA-N 382.872 5.271 30 20 GKED CC(C)c1cccc(O[C@@H](C(=O)Nc2ccc(CC#N)cc2)c2ccccc2)c1 499752452 ZGTCMWQOYPEZBN-XMMPIXPASA-N 384.479 5.635 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc(-c2ccc(Cl)cc2)nc1C 500623893 LALJSILTABHJCI-UHFFFAOYSA-N 397.887 5.295 30 20 GKED N#C[C@H](C(=O)c1cccc2c1CCC2)c1nc(-c2ccc(Cl)cc2)cs1 512487941 BNCMCCDRMTUGPL-GOSISDBHSA-N 378.884 5.442 30 20 GKED C=CCN(C(=O)COCC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 517304551 SSSIEMDQUYOLIC-UHFFFAOYSA-N 378.497 5.033 30 20 GKED CN(C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1cccc(C#N)c1 518527061 JALHAGVPGLOTIO-UHFFFAOYSA-N 384.407 5.165 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1nc(C)cs1 521077085 XSGCOXKMZMUCHF-FQEVSTJZSA-N 391.496 5.191 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2sc3ccccc3c2Br)cc1 521695038 ICEVXCKQMSOSHH-UHFFFAOYSA-N 399.313 5.717 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1c(Cl)cccc1Cl 521808924 QOWHTFKAWCIADF-LBPRGKRZSA-N 394.327 5.709 30 20 GKED C[C@H](SCc1cccc(C(=O)NCc2ccco2)c1)c1ccc(C#N)cc1 522840546 QNQFBRBLMSROPK-INIZCTEOSA-N 376.481 5.076 30 20 GKED C=CCN(C(=O)CCc1ccc2[nH]ccc2c1)c1nc(-c2ccccc2)cs1 538415953 PWHMGICNLSHRMF-UHFFFAOYSA-N 387.508 5.443 30 20 GKED Cc1ccc(-n2nc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2C)cc1 540778886 PJXXMXDSJYMRFM-IBGZPJMESA-N 398.491 5.103 30 20 GKED COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)c2cccc(CC#N)c2)c1 541441605 HWEVAEJMJANYKM-DQEYMECFSA-N 396.490 5.132 30 20 GKED C[C@H](NCc1ncc(Br)s1)c1ccc(-c2cccc(C#N)c2)cc1 542925471 VPIOCWGBJMUAEN-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED N#Cc1cccc(CC(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)c1 548089885 SZZOWNAHDZRXAS-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(F)c(Br)c(Cl)c1)c1ccccc1 552370055 QSCYUJBVZHUDAL-OAHLLOKOSA-N 395.659 5.016 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(COc2ccc3ccccc3c2)o1 553753585 DLAZXHZMYIROGF-UHFFFAOYSA-N 376.456 5.072 30 20 GKED C[C@H](N[C@H](CO)c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 560912960 DXWVZSHCHUNZLK-MGPLVRAMSA-N 395.318 5.248 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccccc1CC#N 565740901 XGKBQBZKFBETOO-UHFFFAOYSA-N 391.474 5.458 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C(F)(F)F)o1 594073026 ZAUXEVZZVZSNLF-ZBEGNZNMSA-N 397.422 5.265 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)n1 596533247 BYLBKKFKCUBBEH-KRWDZBQOSA-N 385.448 5.264 30 20 GKED C[C@H](NC(=O)N(C)CC(C)(C)C#N)c1ccc(O[C@H](C)c2ccccc2)cc1 596749448 JRKVQEWNUUOOCW-ZWKOTPCHSA-N 379.504 5.079 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 598822522 WTCYYKKXCNKIAS-INIZCTEOSA-N 382.332 5.116 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 604457073 OSMMUXNMMBEEAS-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)COc1ccccc1C#N 609066318 CDLZTMZACNXHDM-SFHVURJKSA-N 386.451 5.024 30 20 GKED CC(C)CN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccccc1 609388426 CATSYQIREBSZBK-LJQANCHMSA-N 395.572 5.178 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CSCc3ccccc32)c1 609433242 NMOJDWIJMILJLD-XMMPIXPASA-N 386.520 5.215 30 20 GKED CSc1cccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c1 609601054 NDIIGJTUCUTRQA-UHFFFAOYSA-N 376.441 5.111 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C1 609976288 DMDZMETUQROXJO-WIYYLYMNSA-N 397.478 5.072 30 20 GKED N#Cc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)F)c1 610180814 HKNGOYUOIZWQJM-UHFFFAOYSA-N 386.345 5.187 30 20 GKED CN(C(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccc(C#N)cc1F 611185374 OOMAKHQOKNZZEG-UHFFFAOYSA-N 387.386 5.035 30 20 GKED C[C@H](NC(=O)N1CC[C@H](c2ccco2)C1)c1ccc(-c2cccc(C#N)c2)cc1 611854958 FBUUHJLOOTXFIC-JTSKRJEESA-N 385.467 5.078 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)(F)F)cc3)n2)cc1 612894678 GWTAEXWHHLMXTK-INIZCTEOSA-N 386.398 5.627 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3sc(C(C)C)nc3C)n2)cc1 613318757 CNQCJHYJLSQWGK-HNNXBMFYSA-N 381.526 5.497 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)cc1)c1nc2cc(Cl)ccc2s1 613403933 XRYIECUYUMNOMH-GFCCVEGCSA-N 380.778 5.459 30 20 GKED Cc1cc(C#N)ccc1CN[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 614406050 PKHCRDVHBNAOJH-CQSZACIVSA-N 381.932 5.803 30 20 GKED C[C@@H](CC(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C(F)(F)F 626405020 VOKSCNGOCGXUPA-CPCISQLKSA-N 381.238 5.014 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(OC)c(Cl)cc1C1CC1 654322781 FICFJTSQIJMGIK-UHFFFAOYSA-N 376.909 5.508 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1F 678944655 FHXGXUAVTJHJFJ-UKKRHICBSA-N 375.303 5.525 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(OC)c(OC)c1 682777324 KJHCZHJVUVTVSL-UHFFFAOYSA-N 382.504 5.220 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1cnc2ccccc2n1 682993828 BGEJMVQAMXKRNR-QGZVFWFLSA-N 399.837 5.566 30 20 GKED C=CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C(C)C 728122025 UGGCSXHJYKIFQI-UHFFFAOYSA-N 383.879 5.219 30 20 GKED CC/C=C(/C)C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 729886261 DEDTUERHEYLZSG-JYRVWZFOSA-N 378.522 5.963 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)c1 730969496 ICMJHNQKKWRWSK-UHFFFAOYSA-N 391.902 5.216 30 20 GKED C#CCOc1cccc(NC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 731111461 QFQMWEOKUFHDFA-LJQANCHMSA-N 389.282 5.374 30 20 GKED CC(=O)CCc1ccc(OC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 732494091 FZHUPMLUBFORKF-UHFFFAOYSA-N 399.446 5.286 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)OC(=O)c1cccc(CC#N)c1 739590859 DXPAHEGPQMWRAY-MRXNPFEDSA-N 376.481 5.026 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)N[C@H]2CCOc3ccccc32)cc1 741483750 NBBBVLPQFACPKV-VXKWHMMOSA-N 399.519 5.152 30 20 GKED CC(C)c1ocnc1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 741920873 NFZJLDFXXJXJNW-UHFFFAOYSA-N 379.847 5.170 30 20 GKED CCN(c1ccccc1)c1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1 742370140 HQCIHJYNMVZPSY-FQEVSTJZSA-N 385.511 5.598 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)[C@H](C)c2ccncc2)s1 744746997 PDYCHFCKCOTAPP-OAHLLOKOSA-N 375.542 5.061 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1)C(C)C 750309252 YEKSIALKCYPUJJ-UHFFFAOYSA-N 390.281 5.065 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(SC(F)F)cc1 752616446 TYOCZSQNJGZOPI-MSOLQXFVSA-N 387.455 5.305 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2cccc(F)c2)CC1 752679586 RLPMVAQCTDRMIB-INIZCTEOSA-N 397.519 5.631 30 20 GKED C=C[C@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 759279327 NNOOGUCRBUTARG-ZBFHGGJFSA-N 394.446 5.624 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3sc4ccccc4c3Cl)CC2)cc1 767981424 NDPNMWYUWHJKHR-UHFFFAOYSA-N 378.884 5.356 30 20 GKED Cc1ccc(-c2ncc(C(=O)OC[C@@H](C#N)Cc3cccs3)s2)c(C)c1 772732096 FHVZDTSGRSLCJA-OAHLLOKOSA-N 382.510 5.028 30 20 GKED C[C@@H](NC(=S)Nc1ccccc1F)c1ccc(-c2cccc(C#N)c2)cc1 782205005 NSSXQSRRAPVLGS-OAHLLOKOSA-N 375.472 5.412 30 20 GKED C[C@H](NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccc(OCC#N)cc1 790533501 OLQVDCVTJIBRFB-AWEZNQCLSA-N 383.904 5.217 30 20 GKED CC(/C=C\C(=O)c1ccc(C(=O)N(C)C)cc1)=C/c1ccccc1C(F)(F)F 792926368 QDGXUMVJLBRVCC-NHGWDTOHSA-N 387.401 5.250 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797568845 WZABGZJBFWMVHE-JQVXPOPVSA-N 392.446 5.739 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCC[C@@H]([C@H]4CCOC4)C3)nc2c1 799111570 TZLOHCHCBKWGQQ-NEPJUHHUSA-N 383.439 5.310 30 20 GKED Cc1csc([C@@H](C#N)C(=O)C(C)(C)c2csc(-c3ccc(F)cc3C)n2)n1 810520059 QWUAZWJBGIIFQL-HNNXBMFYSA-N 399.516 5.177 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2nc3ccccc3cc2Cl)cc1 810692733 HRWXWWPXDKKHGQ-UHFFFAOYSA-N 394.858 5.150 30 20 GKED N#CCCC[C@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccccc1 814304177 HSWQWFRRBNMOPP-VWLOTQADSA-N 388.486 5.929 30 20 GKED O=C(/C=C/c1csc(-c2cccc(Br)c2)n1)c1cccc(O)c1 916155674 SDEGSPFDGOVECE-BQYQJAHWSA-N 386.270 5.174 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1nc(Br)ccc1F 926478939 FYWOSEPOGSWERG-CJNGLKHVSA-N 376.273 5.069 30 20 GKED C[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccnc(O)c1 926630638 GTRXPQVIYLDCMO-SECBINFHSA-N 382.279 5.250 30 20 GKED CCC(CCc1ccc(Br)cc1)=NNc1cccc(C(=O)O)c1C 1776086843 RPWLVIGLMFPNAC-UHFFFAOYSA-N 389.293 5.266 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3cccc(F)c3Cl)c2)c1 1776093170 BVNNQPQNEOCFPP-UHFFFAOYSA-N 398.821 5.202 30 20 GKED O=C(O)c1ccc2scc(C=NNc3nc4ccc(Cl)cc4s3)c2c1 1776093690 FJYVITQJRAZQHJ-UHFFFAOYSA-N 387.873 5.309 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Cl)cc1Br 1776784319 VBLIIBVXFFYTML-HNNXBMFYSA-N 390.749 5.396 30 20 GKED N#Cc1ccccc1/C=C/C(=O)OCc1csc(-c2ccc(Cl)cc2)n1 11248975 DFIPHAPBUBCBRN-JXMROGBWSA-N 380.856 5.092 30 20 GKED Cc1ccccc1-c1nnc(SCc2ccc(-c3ccccc3C#N)cc2)n1C 22415899 DRJFRQYYDTVYCP-UHFFFAOYSA-N 396.519 5.622 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1ccc(Cl)s1 44518955 IDLHWFMWXHAWLK-UHFFFAOYSA-N 397.887 5.340 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 48483187 UFIBOEFOTFMEPF-UHFFFAOYSA-N 391.496 5.221 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3sc4c(c3C#N)CCCC4)ccc2c1 60749531 ZOWJMAFAMNNZGU-AWEZNQCLSA-N 390.508 5.403 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)N[C@H](C)c1ccccc1Cl 66861322 YTPVAKFDUVAXSD-HUUCEWRRSA-N 387.936 5.024 30 20 GKED Cc1cccnc1[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 115769540 BCMLJYJAMNVSPK-KXBFYZLASA-N 382.533 5.161 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(C)(c2ccccc2)CC1 119941920 YVTHAFBYZYTLNQ-SFHVURJKSA-N 393.556 5.666 30 20 GKED N#CCCCCNC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 174624870 JBSLZRXAHJPTFW-UHFFFAOYSA-N 382.463 5.357 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1OC 177775796 KEUXEYFJFCGGDZ-CYBMUJFWSA-N 392.908 5.207 30 20 GKED COCc1ccsc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 180940708 VUJOCFYGJADQHY-UHFFFAOYSA-N 378.453 5.119 30 20 GKED COc1ccc(COCc2cccc(NCc3ccc(C#N)c(F)c3)c2)cc1 190358120 ADOCMECEQLHMEA-UHFFFAOYSA-N 376.431 5.035 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 192216488 UFTCOAGVQPRHLC-BBRMVZONSA-N 399.482 5.381 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(F)c(F)c(F)c1F 194102609 PFHCMFCAIFGEBX-UHFFFAOYSA-N 376.334 5.095 30 20 GKED N#CCN(C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)c1ccccc1 195115886 DWTGTZJGMUDPSC-UHFFFAOYSA-N 388.279 5.287 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)n1 245432413 OIWRSCPBVRHTIA-RRFJBIMHSA-N 389.318 5.009 30 20 GKED CCc1ccccc1N(C(C)=O)c1nc(CN(CCC#N)CCC(C)C)cs1 270352245 PZTDUTIXYSDWRU-UHFFFAOYSA-N 398.576 5.152 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCCCC3(C#N)CCOCC3)s2)cc1 281523303 ZLSGMQHPNSNYQV-QGZVFWFLSA-N 383.561 5.178 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cccc(Cl)c1 303417463 XAMWWVSUXAMJLD-WMLDXEAASA-N 387.936 5.865 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3ccccc3OC(F)F)cc2)cc1 303711812 QBHQEJVDRNKAHJ-UHFFFAOYSA-N 394.377 5.133 30 20 GKED O/C(=N/CC1(c2ccc(Cl)cc2)CCOCC1)c1coc(C2CCCC2)n1 328833198 WCKISKZXGAZSCC-UHFFFAOYSA-N 388.895 5.039 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c2[C@H]1C 410978176 CMSLOSOOKURJJI-RYUDHWBXSA-N 394.525 5.076 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(CN2CCCCC2)c1 413397006 DWIYRHVYRGPHPD-GOSISDBHSA-N 393.556 5.177 30 20 GKED CC(C)c1ccc([C@H](N)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 415159530 JROAHMVDCCYZIE-QFBILLFUSA-N 396.560 5.026 30 20 GKED Cc1coc(-c2cc(NC(=O)N[C@H]3CCCc4cc(C#N)ccc43)ccc2C)n1 416924217 WNADSCKKUHQMPC-NRFANRHFSA-N 386.455 5.029 30 20 GKED CC[C@H](CNC(=O)N[C@H](CCCC#N)c1ccccc1)Oc1ccccc1Cl 431982389 RZOUVNBQPHCBNT-UYAOXDASSA-N 399.922 5.232 30 20 GKED N#Cc1cc(NCc2cccc(NC(=O)c3ccccc3Cl)c2)ccc1F 432417245 VBOXQEGJDSQKAM-UHFFFAOYSA-N 379.822 5.215 30 20 GKED CCOc1ccc2c(c1)CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C2 434212315 TUPCLBOAKCPKQR-MRXNPFEDSA-N 395.528 5.070 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1 439128547 FLKYTKDTOWMQOY-KRWDZBQOSA-N 397.404 5.094 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccc(Cl)cc3)o2)c(OC(F)F)c1 439545249 VHMQSPKYCCGOBZ-UHFFFAOYSA-N 393.802 5.155 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444259270 MLIGMPWQCNNAOV-UHFFFAOYSA-N 395.890 5.638 30 20 GKED COc1ccccc1-c1csc(C2CCN(CCCCC(C)(C)C#N)CC2)n1 444716260 PAUATLVKQSXHMA-UHFFFAOYSA-N 397.588 5.718 30 20 GKED COc1cccc2c1CCCN2C(=O)Nc1ccccc1S[C@@H](C)CC#N 459392704 FASJOLAISDQTQV-HNNXBMFYSA-N 381.501 5.074 30 20 GKED N#CCCCn1cc(C(=O)N2CCCC[C@@H]2Cc2ccccc2)c2ccccc21 469047906 UREJDTRRJDFWHH-OAQYLSRUSA-N 385.511 5.182 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCN1CCC(C#N)(c1ccccc1)c1ccccc1 472571623 UUAJXYNDSIUGSJ-HSZRJFAPSA-N 384.527 5.063 30 20 GKED C=CCCCCNC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 473782747 IOTOCASYWGCCHE-UHFFFAOYSA-N 389.858 5.209 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccccc1Br 476106290 DJDTXOKFZUZZMV-UHFFFAOYSA-N 386.333 5.872 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccc2Cl)on1 476131331 CQRUQMJSFABSLB-UHFFFAOYSA-N 380.875 6.099 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)cc(Cl)c3)n2)cc1 477870733 ACZULBADYJPIIS-QGZVFWFLSA-N 382.872 5.271 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1[C@H]2Cc3ccccc3[C@H]21 478564715 ANWUITFLZUGPGL-QPTUXGOLSA-N 395.462 5.119 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 479813154 IQVUQOBCKZTBPF-UHFFFAOYSA-N 391.858 5.315 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc(Cc2ccc(F)cc2)no1)c1ccc(F)c(F)c1 481579719 HVORKHNLRKCRCX-XCLFUZPHSA-N 387.405 5.046 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)nc(-c2ccc(Cl)cc2)n1 483196304 CRSIIVZYHBKAMJ-LJQANCHMSA-N 398.853 5.144 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Br)c1)c1nccc2ccccc12 483206220 CDNIBAGLLMNMNA-MRXNPFEDSA-N 385.648 5.141 30 20 GKED N#C[C@@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1nccc2ccccc12 483210427 DHJVJFIKTCIWAZ-HSZRJFAPSA-N 394.499 6.017 30 20 GKED Cc1cccc(O)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 490660518 LXJOCTKOXKAVNM-UHFFFAOYSA-N 378.815 5.270 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(OCc2ccccc2C#N)c1 493624519 XMNRBZDICMTVFE-QGZVFWFLSA-N 388.442 5.110 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)CC1 506611745 RDAFIRPRZWRERF-UHFFFAOYSA-N 391.846 5.152 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)s1 510748741 KPEVMUYIIYNPSA-INIZCTEOSA-N 397.887 5.342 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2noc3c2CCCC3)cc1Cl 512199479 XILRYNMNADAUOL-SFHVURJKSA-N 391.858 5.115 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 517456753 QCSPUWQMKKKNIB-OAHLLOKOSA-N 384.570 5.676 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518256259 SFCMBFMBCLKJRU-INIZCTEOSA-N 383.517 5.191 30 20 GKED C[C@H](SCCC(=O)Nc1sc2c(c1C#N)CCCC2)c1ccc(F)cc1 520116539 MDEBGOKJRNBABZ-ZDUSSCGKSA-N 388.533 5.461 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(C#N)cc1 521768460 RLRIRJQPRLYLEU-MSOLQXFVSA-N 389.524 5.654 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4ccccc4s3)cs2)c(C)c1 521795739 QHHBHYDJCVVUPI-HNNXBMFYSA-N 389.505 5.527 30 20 GKED C=CC[C@H](C)NC(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 522660152 FIYQNZSDBYFMDF-ZDUSSCGKSA-N 391.393 5.044 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)c2ccccc2Sc2ccccc2C#N)C1 522669711 DOSGTUSFBJQBOD-IAGOWNOFSA-N 382.554 5.113 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)cc1OCCCC#N 525695099 RBPZDYQOFOEEHC-NIJIEXERSA-N 398.934 5.518 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccco2)c2ccccc2OC)cc1Cl 532866303 ANOQADIXMKOSCI-JOCHJYFZSA-N 383.875 5.386 30 20 GKED CC(C)Sc1ccc([C@H](C)NCc2ccc(C#N)cc2OC(F)F)cc1 538202399 MFEJFZFMLHUQSF-AWEZNQCLSA-N 376.472 5.511 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)ccc1Cl 541604823 ACZGTHHBSFGQPN-UHFFFAOYSA-N 399.853 5.122 30 20 GKED N#CCc1cccc(-c2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)c1 544840321 BRJDGXIEFJDFED-UHFFFAOYSA-N 388.814 5.310 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)c1 552441692 SBSLXNJJYSVIMP-CYBMUJFWSA-N 395.709 5.013 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 553262658 HEZRUTWNAMTSSA-UHFFFAOYSA-N 379.419 5.460 30 20 GKED C[C@H]1CCN(CC(=O)Nc2ccccc2S[C@H](C)CC#N)c2ccccc21 557553356 CUCMQYYCGIOVGZ-DLBZAZTESA-N 379.529 5.033 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cnccc2C#N)cc1Cl)c1ccccc1 563641466 HZAPTSYZLZMTQF-AWEZNQCLSA-N 376.847 5.032 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(OCc2ccccc2)c1 564458073 LSYIOSQOKBIBDY-HFZDXXHNSA-N 384.523 6.351 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)C1CC1 588235843 QYSJTRJLJQKPED-KRWDZBQOSA-N 398.466 5.503 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H](C2CC2)C1 588994729 GGHYIJHXCUMOJH-IBGZPJMESA-N 375.472 5.313 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@@H]21 599409099 GSUMEPSHWHDQHH-FWMLUHEOSA-N 382.916 5.259 30 20 GKED N#Cc1cccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c1 603940471 FRYVDBYEELGTGX-HXUWFJFHSA-N 377.806 5.122 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)Nc2ccc(C#N)cc2)cc1F 604360431 DRPBRWVIOJDLKV-UHFFFAOYSA-N 377.375 5.142 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc2cccc(F)c2o1 607789459 OYSSBYNSYZAYCX-UWVGGRQHSA-N 397.290 5.211 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)CC(C)(C)C 609435370 KKCHMIAGWRODLC-SFHVURJKSA-N 395.572 6.161 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)CC/C=C\c2ccccc2)cc1 609968498 KYYSOTPXUMWYCF-WTKPLQERSA-N 398.481 5.720 30 20 GKED N#Cc1csc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)c1 612593502 IADURUXFUUXTCI-CQSZACIVSA-N 389.240 5.166 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c(C)o1 613346752 PTMHWMGPGYFRLB-CQSZACIVSA-N 391.279 5.817 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2sc(-c3ccc(C)cc3)nc2C)cc1 727655503 XJYMOFAFDHTTEX-MDWZMJQESA-N 376.481 5.281 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccc(Cl)cc2)c1 728227394 IUSACNGQYBCDON-UHFFFAOYSA-N 376.912 5.725 30 20 GKED Cn1c(CC(=NOCCCOc2ccccc2)c2ccccc2)nc2ccccc21 730100576 PROVQTVLURRMBH-UHFFFAOYSA-N 399.494 5.006 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(C)cc1 739154883 FXYPKIZHSYWITQ-DOTOQJQBSA-N 381.426 5.500 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156966 SGLPDJYNQWLDKJ-RHSMWYFYSA-N 381.426 5.364 30 20 GKED C[C@@H](NC(=O)CCN1c2ccccc2Sc2ccccc21)c1cccc(C#N)c1 743778651 NUEXUPGXTVWIDP-QGZVFWFLSA-N 399.519 5.428 30 20 GKED C=CCn1c(SCc2cscn2)nc2scc(-c3ccccc3)c2c1=O 748218675 FRUAPVXYZJGKBC-UHFFFAOYSA-N 397.550 5.060 30 20 GKED CCOc1cccc(C=Nc2ccc(N3CCc4sccc4C3)cc2)c1O 748585608 JBHZWHWVZKCDRZ-UHFFFAOYSA-N 378.497 5.166 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 749912972 YBJXHPPXTLXXTM-NRFANRHFSA-N 375.497 5.068 30 20 GKED CCS(=O)(=O)c1c(Cl)cccc1/C=C/C(=O)c1cc2ccc(C)cc2o1 754830648 UEXALWLNSNNWJO-MDZDMXLPSA-N 388.872 5.084 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NOCc2ccc(F)cc2)cs1 758144402 MJHUGLPQRBDAMQ-UHFFFAOYSA-N 397.475 5.134 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 765911249 RKEKIUALESOMHY-WFASDCNBSA-N 399.313 5.114 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(C3SCCS3)c2)CC1 770409420 HFEMPCIPZRZNAI-UHFFFAOYSA-N 380.582 5.981 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(CN3CCc4ccccc43)cc2)cc1 770541926 IXLFLOPTNKQMRX-LJQANCHMSA-N 383.495 5.152 30 20 GKED CC[C@@H](C)n1c(Sc2snc(Cl)c2C#N)nnc1-c1ccccc1 771192251 QQCIGBAOKWINCS-SNVBAGLBSA-N 375.910 5.049 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NOC2CCCCC2)cs1 777457515 VTFLOSIPDKPENQ-UHFFFAOYSA-N 377.897 5.164 30 20 GKED C[C@@H](NCc1ccc(C#N)cn1)c1ccc(-c2ccccc2Br)s1 783300879 RNTYQKWFNDKLRI-CYBMUJFWSA-N 398.329 5.295 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2ccc(O[C@H](C)c3ccccc3)cc2)c1 788350028 CIQWEXIFZJEAAN-WZONZLPQSA-N 398.462 5.096 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc(Br)ccc1F)c1ccc(F)c(F)c1 788754557 PXSLBSUUOAZDFC-QLJPJBMISA-N 385.227 5.229 30 20 GKED O=C(/C=C/c1nc(-c2cc(Cl)ccc2Cl)cs1)c1ccnc(F)c1 794719606 PJUBDQAWMNWWJF-ONEGZZNKSA-N 379.243 5.547 30 20 GKED N#Cc1sc(Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)nc1Cl 804673815 KWVAVXNDOWPPSC-UHFFFAOYSA-N 398.662 5.301 30 20 GKED N#CCCCCCC(=O)O[C@@H](c1ccc(Br)cc1)C(F)(F)F 805878504 NEJYHEMJHXZYGH-AWEZNQCLSA-N 378.188 5.070 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 806207598 UJXYVTOADZBHLT-JTSKRJEESA-N 398.466 5.361 30 20 GKED CCOc1cc(/C=C/C(=O)c2c(F)cccc2Cl)cc(Br)c1O 809158491 AUCCBLMXURDFMY-VOTSOKGWSA-N 399.643 5.242 30 20 GKED N#Cc1c(F)cccc1/C=C(/Br)c1ncc(-c2ccc(F)cc2)o1 811687843 JTRDLCPPBHSXPS-OVCLIPMQSA-N 387.183 5.384 30 20 GKED CC1(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCOCC1 835067889 KTMVKUZIWLZAPK-FYCOFBDGSA-N 386.904 5.013 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@]23CCCC[C@@H]2C3(F)F)cc1 850762164 VXOCPSPUUVROMT-TVLKCDEOSA-N 388.458 5.063 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)Nc2nccc(C)c2C2CC2)s1 857646875 QGVYLXNOIDURTJ-UHFFFAOYSA-N 393.965 5.058 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2nc(Cl)ccc2Cl)s1 894684614 XVLMZSOGKUUXPG-UHFFFAOYSA-N 387.336 5.395 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(-c3ccccc3)cc2F)cc1OC 914764883 VAIBHXPGQGPXMU-UHFFFAOYSA-N 377.415 5.318 30 20 GKED Cc1cc(C)cc(OCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915085524 NBKRKNXEYRYGQI-XMMPIXPASA-N 384.479 5.367 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(Cc2cccs2)C2CC2)cc1 915351603 AFBBSXTVNPHARW-JOCHJYFZSA-N 387.508 5.600 30 20 GKED N#Cc1cccc(COc2cccc(NC(=S)Nc3ccc(Cl)cc3)c2)c1 916000783 QQBNURIXWURDQB-UHFFFAOYSA-N 393.899 5.600 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)sc1C 916902309 DLIMMLZEHHRFLZ-GOSISDBHSA-N 382.529 5.095 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1Cl 916915537 FCNIXPQIGOCVPY-LJQANCHMSA-N 390.870 5.082 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CCCC1)c1nc2cc(Cl)ccc2s1 917046334 JHEDYIHSACUTRP-MRXNPFEDSA-N 398.890 5.777 30 20 GKED COc1cc(/C=C\C(=O)C2CCCCC2)cc(Br)c1OC(F)F 917143642 NVXMEMIONUUFEP-FPLPWBNLSA-N 389.236 5.222 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2cccc(F)c2)cc1 918035982 SDKZOBCWJZNZSP-ZEQRLZLVSA-N 399.469 5.850 30 20 GKED CC(C)(C)N(N=Cc1csc(C2CC2)n1)C(=S)Nc1cccc(Cl)c1 920385076 LFAVIBBXPDIJIB-UHFFFAOYSA-N 392.981 5.505 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=NNc2nc(-c3ccccc3)cs2)C1 1776022368 KMQWBLXNLVRPOE-UHFFFAOYSA-N 397.887 5.048 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C=NNc3ccc(CC(=O)O)cc3)o2)cc1 1776084529 XDAPTFHKNZFFLB-UHFFFAOYSA-N 376.456 5.317 30 20 GKED CC(C)(C)Oc1cccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)c1 1776264966 KGUNATWNCWXBMT-NTEUORMPSA-N 382.456 5.004 30 20 GKED CCCCCCCOc1ccc(CN[C@@](C)(CCC(C)(C)C)C(=O)O)cc1 1776788232 SGWYMZQJKSRFFT-QHCPKHFHSA-N 377.569 5.795 30 20 GKED COc1cc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc(C(F)(F)F)c1 1777286044 WFIBFWSRRNECAK-AUWJEWJLSA-N 390.357 5.015 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1ccc(Cl)cc1)[n+]1ccccc1 7746696 FGQHAYXKLUEFDG-UHFFFAOYSA-O 395.935 5.241 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccc(Cl)s1 25912766 HLVCAYCEDOWXLI-UHFFFAOYSA-N 384.913 5.354 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cc(-c2ccccc2)no1 30969711 MXHIQYQYLNKIAC-UHFFFAOYSA-N 388.496 5.002 30 20 GKED N#C[C@H](C(=O)Cc1cccs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 51284691 NIFUZVOQRPKQEQ-CYBMUJFWSA-N 393.320 5.597 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccccc1Br 66800499 YGHYINNBQPWZIK-GFCCVEGCSA-N 375.291 5.096 30 20 GKED Cc1ccccc1OCCCN(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108531098 BAQJVVLBVGGQKX-KRWDZBQOSA-N 397.544 5.180 30 20 GKED CC[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1c(C)noc1C 124561362 SEBSWLLZIWHIBA-HXUWFJFHSA-N 390.443 5.228 30 20 GKED C#CCCOc1ccc(CNc2cccc(C[S@@](=O)c3ccccc3)c2)cc1 133230380 CSPFCQDILXUKLX-NDEPHWFRSA-N 389.520 5.009 30 20 GKED CC(C)n1ncc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C1CC1 153658994 ZZBMOQMZQCXRTG-UHFFFAOYSA-N 386.455 5.258 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](OC(C)(C)C)c1ccccc1 156694974 FLXCTXGYQLEBTO-OXQOHEQNSA-N 382.529 5.433 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1 181586529 UQVNNGFQANJAOE-OALUTQOASA-N 399.966 5.089 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3C[C@H]4CCC(=O)c5cccc3c54)c2)cc1 183807652 ZUIYOCFRUKEXQV-GOSISDBHSA-N 394.430 5.071 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCSc1nccs1 191475599 NTWHZYMKFDFSOX-UHFFFAOYSA-N 375.563 5.299 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1ccc(OC(F)F)cc1 213175708 VRWMIBFTEWAMFE-XFXZXTDPSA-N 381.378 5.158 30 20 GKED Cc1noc(CSc2ccccc2/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@H]3C2)n1 329011649 IIBRGEOMBMPHBX-YESZJQIVSA-N 385.533 5.334 30 20 GKED CC1(C)[C@H]2OCCC[C@H]2[C@H]1/N=C(/O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 329741455 VYYNWHSYXQNJBV-GTXWJXBTSA-N 396.556 5.506 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@@H](C)C[C@@H](C)C2 411015391 QCURGNGXFKMBBV-SFYZADRCSA-N 399.463 5.342 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc4cc(Cl)sc4[nH]3)cc2)ccn1 427024228 RXRMCCPDBQZHLX-UHFFFAOYSA-N 394.843 5.194 30 20 GKED Cc1cc(C(=O)NCCC#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 429453700 ZAFXWJKQSOKVOX-ZDUSSCGKSA-N 376.287 5.118 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)on1 432625842 DAZOCAMFEPYRDT-LJQANCHMSA-N 388.427 5.016 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 439363345 FSWOLBJZYKASEU-HSZRJFAPSA-N 396.450 5.517 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(Sc2ccc(C(F)(F)F)c(C#N)n2)o1 443512102 RWXDTOOXPZQHEC-LBPRGKRZSA-N 390.390 5.048 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C1CCCCC1 444099471 IYTIGHKBSQBNPO-OAHLLOKOSA-N 392.377 5.047 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](c1nc(C)cs1)C(F)(F)F)c1ccccc1 455709762 RUGSKGGLSPKLBA-GJZGRUSLSA-N 383.439 5.062 30 20 GKED N#CCc1ccc(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)c(Cl)c1 455710758 XYFWPWPWNPWPGB-UHFFFAOYSA-N 393.796 5.236 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458804739 SVLIGBIFBSZZAK-FUHWJXTLSA-N 392.528 5.434 30 20 GKED CSc1ccc(F)cc1CNCc1cccc(OCc2cccc(C#N)c2)c1 465014730 LVWQGNKPAXFNOZ-UHFFFAOYSA-N 392.499 5.288 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cccn2-c2c(Cl)cccc2Cl)n1 467190011 DOIXOYCOHGMPAG-NSHDSACASA-N 376.268 5.039 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1cn(CCCC#N)c2ccccc12 469136503 WLNFHZONOCUXFL-UHFFFAOYSA-N 399.416 5.236 30 20 GKED CCc1cccc2c(C3CCN(C(=O)C[C@@H](CC#N)c4ccccc4)CC3)c[nH]c12 475028870 CEVBDBXJZRIEKZ-JOCHJYFZSA-N 399.538 5.524 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCN(c2ccc(F)cc2)C1 475548088 ALEQFSPISLCOKY-SFHVURJKSA-N 395.522 5.326 30 20 GKED CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H](C)c1ccccc1OC 477525365 DOQRCXVBMBORGY-QGZVFWFLSA-N 379.504 5.501 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1)OCC 477678666 JNTIHKSPGOAZLN-OAHLLOKOSA-N 384.423 5.139 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)c(C)cc1Cl 477734317 QAFPDFXOYYLBSB-UHFFFAOYSA-N 395.334 5.689 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)Cc1ccc(C#N)cc1Br 481049774 FIUXEDXHWKKFFG-GFCCVEGCSA-N 386.318 5.123 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)ccc1OC1CCCC1)c1cnc2ccccc2n1 483208282 XGBROKXXHORILH-QGZVFWFLSA-N 391.858 5.095 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 489437673 ZBFWTEMVUHGHEE-GOSISDBHSA-N 376.504 5.130 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 499326232 YRNXYVZXJJDELF-QFIPXVFZSA-N 381.495 5.088 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1csc2ccccc12 503353373 IVEVUKQTSCVDNL-UHFFFAOYSA-N 376.934 5.514 30 20 GKED CSc1ccccc1[C@@H](C)NC(=O)c1cn(CCCC#N)c2ccccc12 504316991 NOWYLFHIJGHPGB-MRXNPFEDSA-N 377.513 5.158 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C)C(=O)c1c[nH]c2ncccc12 504386986 FKALTGJNNWNKCK-INIZCTEOSA-N 396.450 5.219 30 20 GKED Cc1ccc(-c2nnc(CSc3nc(-c4ccccc4)ccc3C#N)o2)cc1 510174716 ZCDXWMVWOUTMTE-UHFFFAOYSA-N 384.464 5.271 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](CC)c1ccc(Cl)s1 513080016 CJVFXSKJICFEFS-MRXNPFEDSA-N 378.925 5.259 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccc(F)c(F)c1 514193589 RHIZSVUJSGHGJK-KPZWWZAWSA-N 389.446 5.590 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1-c1ccccc1C#N 517461814 QBTGHOYMCTXWKW-QGZVFWFLSA-N 397.503 5.729 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2ccc(-c3ncon3)cc2)cc1 519667060 JMTBLEDXNNXFAU-UHFFFAOYSA-N 397.394 5.045 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(C)(C)C 520667390 JDDYVLFRQAXCRH-NRFANRHFSA-N 379.504 5.278 30 20 GKED COC(=O)[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc(Cl)c1 522753683 ZKCZITUCCHIRJK-NRFANRHFSA-N 392.842 5.330 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1 524831981 LTCAZXXJEHYQGA-KRWDZBQOSA-N 380.916 5.108 30 20 GKED CC[C@@H](C)N(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)Cc1ccccc1 532909356 LLPWEOZOVCUXKZ-RBUKOAKNSA-N 395.572 5.178 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 534244279 UJCNXAHALDNUDA-UHFFFAOYSA-N 397.931 5.274 30 20 GKED COc1ccc(C[C@H](C)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 536244696 OIHXDKRBJNPGTC-DLBZAZTESA-N 397.544 5.090 30 20 GKED C=CCN(C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)C1CC1 537928943 MJTBBERKJHSMRV-GFCCVEGCSA-N 375.925 5.193 30 20 GKED C=CCC[C@H](NCc1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccccc1 538259114 ZKDZWRITOGLGNZ-SFHVURJKSA-N 387.405 5.553 30 20 GKED CC(C)c1oc([C@H]2CCCN2Cc2cc(C#N)cs2)nc1-c1ccccc1 538719524 QTBGGRVSPHPRKO-LJQANCHMSA-N 377.513 5.735 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc(C(F)(F)F)cc1 539051935 QCHXTNUWYSZEQR-ZHDJGUKESA-N 395.490 5.801 30 20 GKED COC(=O)c1oc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1C 541085910 RSYDRFRIWFBCPG-SJORKVTESA-N 388.467 5.325 30 20 GKED CCc1ccccc1NC(=O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542015500 XCGFFHVVEPCXBG-GOSISDBHSA-N 383.495 5.077 30 20 GKED COc1ccc(C)cc1NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 543860792 LJNINXWVLZUSRU-GFCCVEGCSA-N 394.418 5.013 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 543986833 AYDXBMDAKRQLNN-IBGZPJMESA-N 396.471 5.326 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)C(F)(F)F 548169358 NQJBMSQXYKEXGI-IBGZPJMESA-N 389.421 5.029 30 20 GKED N#C[C@H]1N(C(=O)c2cc3sc4ccccc4c3s2)CCC[C@@]12CCCCO2 548399954 FJWCLNSQTBREMP-NQIIRXRSSA-N 396.537 5.183 30 20 GKED N#CCc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 551719313 WBJLPTXJMSRVQL-OAQYLSRUSA-N 388.433 5.029 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 554444210 ATEKZBMXJRPNNY-SJORKVTESA-N 379.529 5.838 30 20 GKED COc1cccc(CN(C)CC(C)(C)CCC#N)c1OCc1ccccc1F 555340225 UFKDAOBHQOJRPB-UHFFFAOYSA-N 384.495 5.175 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)[C@@H](C)c1ccc(C#N)cc1 558764303 CYNLDSQFSGRFGC-ROUUACIJSA-N 376.500 5.110 30 20 GKED C[C@](C#N)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CCCCC1 559595396 ZOQBUSCAXHORPI-XMMPIXPASA-N 387.483 5.137 30 20 GKED C=C[C@@](C)(CCOC)c1nc([C@H](c2ccc(Br)cc2)C(C)C)no1 561902970 SAWQMFQQMUQGKG-LPHOPBHVSA-N 393.325 5.100 30 20 GKED N#CCc1ccccc1NC(=O)CCSc1ccnc2cc(Cl)ccc12 563563926 HPUHYKAYAHKRBQ-UHFFFAOYSA-N 381.888 5.075 30 20 GKED N#Cc1cccc(-c2cc(-c3nc(Cc4cccc5ccccc45)no3)on2)c1 569737272 AUZPPCVQDMITMS-UHFFFAOYSA-N 378.391 5.007 30 20 GKED C=CCN(C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 580274551 VTDGBCAOHAWRTH-OAHLLOKOSA-N 393.468 5.041 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2(C#N)CCCC2)cc1Cl 593143992 UBHFEJIEHISBMH-LJQANCHMSA-N 392.890 5.201 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](c1ccccc1)c1ccccc1OC 595002220 GRXMNTJHJCRDAK-XMMPIXPASA-N 386.495 5.182 30 20 GKED N#CCCC[C@H](NC(=O)NCc1ccc(Cl)c(Cl)c1)c1ccccc1 595768366 ZENSUBBQCQFLQU-SFHVURJKSA-N 376.287 5.228 30 20 GKED CC(C)(C)[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596243092 GOCMOXLAKJWKLH-WMLDXEAASA-N 381.442 5.128 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3CC[C@@H](C3)C2)cc1Cl 596689984 DKJHFKOWOMJLRZ-FTRWYGJKSA-N 379.891 5.259 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 603649787 RPBBNZHEOSUQDL-UHFFFAOYSA-N 398.491 5.499 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)Nc1ccc(CC#N)cc1 603651002 VGLJHNJHRFICHM-UHFFFAOYSA-N 375.472 5.505 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2nc3c(ccc4ccccc43)s2)cc1 603727406 QNSWRNHXVMSNFP-UHFFFAOYSA-N 389.505 5.193 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)oc2c1ccc1ccccc12 605363118 JOWHXPPZAHHCHX-SFHVURJKSA-N 379.419 5.569 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)C1CC1 608995091 ZTECSEVNJRTCMP-UHFFFAOYSA-N 398.466 5.251 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCCOc1ccc2ccccc2c1 609236683 VVBHSUPIMQHKMM-UHFFFAOYSA-N 396.899 5.116 30 20 GKED CC(C)(CCC#N)CNCc1ccc(Oc2ccccc2C(F)(F)F)nc1 610271319 ARSVNHDFKYMFPM-UHFFFAOYSA-N 377.410 5.312 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccnc(Oc4ccccc4)c3)n2)c1 611052283 CGQFWCZCFNMASV-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 611561768 LBMNEFZDKKVQIE-PBHICJAKSA-N 387.405 5.105 30 20 GKED CCCCn1ncc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1C(C)C 616700273 WDKWBUTVAUJEKN-UHFFFAOYSA-N 379.291 5.237 30 20 GKED CC(C)(CC(F)(F)F)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F 622863888 NZTCDEOXLGJRJE-UHFFFAOYSA-N 375.284 5.074 30 20 GKED FC(F)(F)c1ccc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc1 642186725 VBZLVWFNKQPNKY-RKDXNWHRSA-N 380.254 5.422 30 20 GKED CC(C)n1cc(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cn1 648494414 OVUKOWLUAGRXKC-UHFFFAOYSA-N 397.294 5.006 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1csc(C(F)(F)F)n1 671188249 GEVKFVACEFGWPC-UHFFFAOYSA-N 390.255 5.068 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1c(Cl)cccc1Cl 726319136 ZBHXGXCPPREERP-WDEREUQCSA-N 375.280 5.583 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12)C(C)C 728393068 QFINTILEHZKJCE-UHFFFAOYSA-N 379.435 5.595 30 20 GKED C[C@H](N[C@H](C)c1csc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 730022448 OUYUHQDBCNMMQC-OLZOCXBDSA-N 383.904 5.104 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1c(Cl)cccc1Cl 733259302 WAIXYWWLRUUJOS-SECBINFHSA-N 380.083 5.356 30 20 GKED CCCCOc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)ccc1OC 741844939 SYWXUBAKTKJVEQ-FNORWQNLSA-N 390.892 5.133 30 20 GKED COCc1cccc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)c1 742434219 FYRJTIHDPQHHMB-SFQUDFHCSA-N 379.456 5.308 30 20 GKED C[C@@H]1/C(=C\c2cccc(OCCCC#N)c2)C(=O)c2cccc(Br)c21 742435732 XRLNEVQTAMMZKC-QFGUUYLXSA-N 396.284 5.515 30 20 GKED Clc1ccc(C(Cc2ccccn2)=NNCc2cccc3cccnc23)cc1 745202596 PXWSSYISQAJUBI-UHFFFAOYSA-N 386.886 5.020 30 20 GKED COc1cccc(C=NO[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)c1OC 752764189 PJPVHOQMDFPUSB-ZDUSSCGKSA-N 386.835 5.124 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2csc(C3CC3)n2)cc1OCC 758404738 FRAAGNKQTFLHFS-UHFFFAOYSA-N 394.924 5.412 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C(C)=C\c1cccc(Cl)c1 759204989 HJAOYEXUSHJJQH-NLBZTSMMSA-N 394.902 5.216 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(SC(F)F)cc3)CC2)cc1 767793384 KPZDUHFZFZOEQM-UHFFFAOYSA-N 385.439 5.194 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1-c1nc2ccccc2s1 776747609 GDHNWSCXFKEARX-UHFFFAOYSA-N 383.476 5.211 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(OC)c(OC)c2OC)cc1 777232071 PWZIBKHXGCMIMV-AWEZNQCLSA-N 377.868 5.017 30 20 GKED C=CCn1c(COc2ccc(C)cc2)nnc1SCc1ccc(CF)cc1 777539406 QYXVOFYWSPHNLI-UHFFFAOYSA-N 383.492 5.113 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCCCc1ccc(Cl)c(Cl)c1 780152975 VDSHPNLHIKAFTH-AWEZNQCLSA-N 391.298 5.636 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3c[nH]nc3-c3ccsc3)c2)s1 780528302 JYAXJHSHBWGPMT-UHFFFAOYSA-N 376.510 5.028 30 20 GKED C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)Nc1ccccc1O[C@H](C)C#N 780667649 KLBJYZMHSSQGNG-QWHCGFSZSA-N 392.286 5.037 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccsc1Cl 790148009 OUFPANHXQKIBCK-UHFFFAOYSA-N 385.901 5.031 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1nccc2ccccc12 792096387 OJOBASRXJXBDRO-IBGZPJMESA-N 382.385 5.453 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(F)c(C(F)(F)F)cc2F)c(C#N)s1 808632461 SHLGSMFQCQOZLZ-UHFFFAOYSA-N 388.361 5.467 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1ccc(C#N)nc1)CC(C)(C)O2 811862092 CBASVDKEHORBBW-GOSISDBHSA-N 394.475 5.015 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(C3CCCC3)cc2)ccc1OC 812756025 HCJFWFZUVOVSJH-QFIPXVFZSA-N 378.516 5.324 30 20 GKED C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915085919 PYNIPJCOMOVJMT-UZLBHIALSA-N 390.870 5.401 30 20 GKED N#CCOc1cccc(NC(=O)CSc2cccc3cccc(Cl)c23)c1 916410776 DITMNJPNCMYSFD-UHFFFAOYSA-N 382.872 5.126 30 20 GKED Cc1csc([C@@H](C#N)C(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)n1 916843704 DHRHSZHQGAMUJA-INIZCTEOSA-N 384.545 5.302 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@@H](C#N)c3ccc4ccccc4n3)cs2)cc1 916848121 BSXXIEFNDOWSLU-IBGZPJMESA-N 383.476 5.086 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1cc2c(C)cc(C)nc2s1 917353841 WKEXARDQNBDWFL-UHFFFAOYSA-N 386.860 5.056 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2cc(C)c(OCc3ccccn3)c(C)c2)c1C 920927794 PGQGCGBWCDCYND-KHPPLWFESA-N 389.499 5.007 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(N2CCCCC2)c(F)c1 1776033354 OENVEBRLLGKZNJ-UHFFFAOYSA-N 389.858 5.004 30 20 GKED CC[C@@H](NN=C1CC[C@H](c2ccc(Cl)c(Cl)c2)c2ccccc21)C(=O)O 1776067573 DXSAKOWDOFHGKQ-FZKQIMNGSA-N 391.298 5.076 30 20 GKED C=CCOc1cccc(/C=C(\CC(=O)O)c2nc3cc(Cl)ccc3s2)c1 1776184770 PIEVDKSAPNFDOP-NTEUORMPSA-N 385.872 5.530 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2c(Cl)ccc(Cl)c2Cl)c1)C(=O)O 1776470864 ZBIRSCIFCUXKRX-VHODGJRUSA-N 399.657 5.395 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(F)cccc1OC(F)(F)F 1776783761 HFMGLIMIXMGTPK-ZDUSSCGKSA-N 379.394 5.018 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Cl)cc1Br 1776784320 VBLIIBVXFFYTML-OAHLLOKOSA-N 390.749 5.396 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@H](C(=O)O)CC[C@H]2C)cc1 1776787564 XWRWOUVTFMPKKN-SJLPKXTDSA-N 377.550 5.074 30 20 GKED Cc1ccc(-c2ncc(/C=C3/C[C@@H](C(=O)O)c4ccccc4C3=O)s2)cc1C 1777431445 LLANPBWGSYODOP-IKXXZMEWSA-N 389.476 5.265 30 20 GKED CCCCc1ccc(N/C(S)=C(/C(=O)c2ccccc2)[n+]2ccccc2)cc1 27464811 OARPXDLLMWHASG-UHFFFAOYSA-O 389.544 5.368 30 20 GKED C=CCOc1ccccc1C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 30229840 LQQXJYDPROWZNG-OAHLLOKOSA-N 378.497 5.174 30 20 GKED C=CCN/C(S)=C(/C(=O)c1ccc(CC)cc1)[n+]1ccc(C(CC)CC)cc1 32813804 XIHVPIGHUNZQTB-UHFFFAOYSA-O 395.592 5.155 30 20 GKED N#C[C@@H](C(=O)c1sccc1OC(F)F)c1nc2cc(Cl)ccc2s1 105759488 FNCYCKJBZQROAW-QMMMGPOBSA-N 384.816 5.103 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1ccccc1Cl 108356557 YWIKKAAHZLMNRS-HUUCEWRRSA-N 387.936 5.024 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)CSCc2ccc(C#N)cc2)c(C)c1 109641060 ITIYQMJOZYKQIF-MRXNPFEDSA-N 384.570 5.629 30 20 GKED Cc1ccc(OCc2cccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c2)cn1 114233533 CBJYMMMAJVOKEW-UHFFFAOYSA-N 385.467 5.023 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1Oc1ccncc1 115068333 PYTMOHZEQDEVJG-UHFFFAOYSA-N 389.480 5.440 30 20 GKED CN(CCC#N)c1ccc(CNc2cccc(CSc3ccccn3)c2)cc1 125074988 TYIPDRPSAKYAKC-UHFFFAOYSA-N 388.540 5.336 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C(C)C 128340633 WPXVYONCXCYGGU-ZDUSSCGKSA-N 383.517 5.153 30 20 GKED COc1ccccc1NC(=O)c1ccc(NCc2ccccc2C(C)(C)C#N)cc1 131495342 RRYNNBJFPUSRJH-UHFFFAOYSA-N 399.494 5.361 30 20 GKED COc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 173116600 ARFLQOPLRJRDPE-IRXDYDNUSA-N 397.544 5.042 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccc(F)cc2)n1 303340911 YODHLBARPCIQJI-ZDUSSCGKSA-N 397.500 5.453 30 20 GKED N#CC1(F)CCN(C(=O)Nc2cc(Cl)ccc2Oc2cccc(F)c2)CC1 421164709 KXHPAOSOPFUFIL-UHFFFAOYSA-N 391.805 5.131 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 425423010 NNFYFBSBRABFJJ-KBPBESRZSA-N 375.394 5.041 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H]1CC[C@H](C)C1 429735427 FLCMDEAKRAZDQP-JXFKEZNVSA-N 377.488 5.098 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 430589474 IBLLSEBWXGIGHN-CQSZACIVSA-N 381.526 5.363 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 432991051 ILFZOBCHOFCZSH-ISKFKSNPSA-N 396.494 5.361 30 20 GKED N#CCCn1cc(CNc2ccccc2Cc2ccccc2)c(-c2ccncc2)n1 435131853 TYKRUXYCLNQXLF-UHFFFAOYSA-N 393.494 5.062 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 438465549 KSXDQDJOTRKNQF-WBVHZDCISA-N 386.417 5.324 30 20 GKED N#C[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccc(F)cc1 442286613 UXDQGFNZRAFOSM-MRXNPFEDSA-N 388.229 5.122 30 20 GKED C[C@@H]1COCC[C@H]1c1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 442691860 YSCRLWSUEWBVLC-CZUORRHYSA-N 395.846 5.194 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(CCC(F)(F)F)cc2)cc1 443671556 YWUZQCKYAXLKGF-UHFFFAOYSA-N 390.405 5.141 30 20 GKED N#CC(CCN[C@@H](c1ccccc1)[C@@H]1CCOC1)(c1ccccc1)c1ccccc1 444672060 FCAFPNZUNDZEAN-BVAGGSTKSA-N 396.534 5.254 30 20 GKED CC(C)n1c(S[C@@H]2CC[C@H](C#N)C2)nnc1-c1ccc(Cl)cc1Cl 450592934 HYSQVUPAXMTXSK-WCQYABFASA-N 381.332 5.617 30 20 GKED C[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 462541757 HLCCZFSRGPGPKQ-ROUUACIJSA-N 379.463 5.078 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1coc(-c2ccc(Cl)cc2)n1 464835240 UOQMIWWLKZXUNA-SFTDATJTSA-N 377.875 5.267 30 20 GKED C=CCC[C@H](NC(=O)c1cc(O)nc(C2CC2)c1)c1ccc(C(F)(F)F)cc1 474507654 XLHPFOWMKKUCJD-KRWDZBQOSA-N 390.405 5.121 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 476340933 QFFCNRVYKKCTGC-UHFFFAOYSA-N 386.499 5.404 30 20 GKED CCc1cccc2c(C3CCN(C(=O)Nc4cc(C#N)ccc4C)CC3)c[nH]c12 476797553 YPIMQFCYYXARHP-UHFFFAOYSA-N 386.499 5.322 30 20 GKED C=C(C)[C@H](NC(=O)N(CCOC)[C@@H](C)c1ccccc1)c1ccc(F)c(F)c1 477733111 ZEDCGFGMPLQLSQ-KKSFZXQISA-N 388.458 5.001 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F 482444241 GLFDGEJYASEEAH-FQEVSTJZSA-N 397.400 5.156 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C 483840152 LJCABZGSECPJPN-OAHLLOKOSA-N 389.459 5.471 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(F)c(F)cc1Br 486430388 HUMONVVAAZPSCD-UHFFFAOYSA-N 384.245 5.258 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(OC2CCOCC2)c(C)c1)c1ccccc1 488978084 FIDFJGJYEVGPSU-JOCHJYFZSA-N 379.500 5.241 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccccc1OCc1ccc(Cl)cc1 496829044 DOGJIORIWWNERV-UHFFFAOYSA-N 390.870 5.063 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2ccccc2)nc1)c1c(Cl)cccc1Cl 499810521 AYAWYTZVJVLZGY-QGZVFWFLSA-N 398.249 5.175 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H]1CCCC(F)(F)C1 500815235 LBYBAZAZKYTYJG-GOSISDBHSA-N 384.426 5.210 30 20 GKED C=CCC[C@H](NC(=O)[C@@H]1CCO[C@@H](CCC)C1)c1ccc(C(F)(F)F)cc1 503630240 QVNJTZYPTITRSB-NEWSRXKRSA-N 383.454 5.424 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCC[C@@H]3/C=C\c3ccccc3)o2)cc1 505359954 OTULENATGXMDLC-ZRKSWWEUSA-N 398.462 5.048 30 20 GKED Cc1csc(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)n1 506118824 LQEBYRWIQCPWNV-UHFFFAOYSA-N 395.487 5.910 30 20 GKED CCN(C(=O)c1cc2cc(Br)ccc2o1)[C@H](C)c1ccc(C#N)cc1 509572134 BCLRHCCPGSAENS-CYBMUJFWSA-N 397.272 5.290 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cccc(COc3cccc(F)c3)c2)s1 510500924 KKOLSOZZELNTOS-UHFFFAOYSA-N 380.444 5.153 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1c(F)cccc1F 510645475 DYEOZOJBYGIMKH-AWEZNQCLSA-N 393.393 5.511 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC)c1ccc(Cl)s1 513082284 LFRAAENWOGJYGN-OAHLLOKOSA-N 393.896 5.159 30 20 GKED CCCc1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)s1 518516535 JLEGMARDRKQVTK-OAHLLOKOSA-N 397.525 5.026 30 20 GKED Cc1ccc2nc(C)c(C(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)cc2c1 518709093 JOBCZJHLHFZGJB-SFHVURJKSA-N 384.266 5.153 30 20 GKED CCOc1ccc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 520600930 VRAAQLZTOMGALG-UHFFFAOYSA-N 387.439 5.071 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)[nH]n1 520927890 BDVRPFWDWAPGOD-CYBMUJFWSA-N 396.903 5.377 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C1(c2ccccc2)CCC1 524389232 XJVCFYBZTGWUOU-UHFFFAOYSA-N 396.490 5.506 30 20 GKED CC(C)(C)n1nccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534872994 DVSHSQIXEQDRSX-UHFFFAOYSA-N 394.862 5.208 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1scnc1C1CC1 536330341 XTOKWKJOHZWVQI-UHFFFAOYSA-N 391.471 5.187 30 20 GKED C=CCC[C@H](N[C@H](C)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 536841745 YXLPGDBOYBQPJF-VFNWGFHPSA-N 390.449 6.022 30 20 GKED Cc1nc(NC(=O)c2sc(C3CCCCC3)nc2C)sc1SCC#N 538271563 ULFABIMBFXLFJX-UHFFFAOYSA-N 392.575 5.132 30 20 GKED CC[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 559597897 WHRHJSVZCJLYNW-JOCHJYFZSA-N 378.497 5.288 30 20 GKED CC(C)(c1ccc(C(=O)Nc2cc(C#N)ccc2NC2CC2)cc1)C(F)(F)F 560707350 WZLDUXATSYQDFB-UHFFFAOYSA-N 387.405 5.225 30 20 GKED CC(C)(C#N)c1ccc(-c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1 564283191 XFKAEQCDUCDAIM-MRXNPFEDSA-N 389.352 5.615 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CCC(CC(F)(F)F)CC1 564479642 VWJVEENGMXUBIX-UHFFFAOYSA-N 395.343 5.075 30 20 GKED N#Cc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)c(C(F)(F)F)c1 573173131 XMKSEYAGHFQIKW-UHFFFAOYSA-N 384.323 5.375 30 20 GKED C[C@@H]1CCc2onc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)c2C1 577582992 PUZFDCCTMLEWBC-IAQYHMDHSA-N 397.887 5.066 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC3(CCCCC3)C2)cc1F 578287419 HCSFWPYMUVAWNI-UHFFFAOYSA-N 379.435 5.288 30 20 GKED N#CCCCn1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c2ccccc21 581231187 WWCDTNFVYJIDKT-MRXNPFEDSA-N 384.464 5.045 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccccc2[C@@H](C)C1 593157967 PWBLBJIBFUYYJI-DLBZAZTESA-N 379.529 5.275 30 20 GKED CC(C)c1cccc(C(C)C)c1NS(=O)(=O)c1ccc(C(C)(C)C#N)cc1 593276531 RYYGZVYPKQYVGJ-UHFFFAOYSA-N 384.545 5.535 30 20 GKED N#CC1(c2ccc(CN[C@@H](Cc3ccc(Cl)cc3)c3ccccn3)cc2)CC1 594935917 QVHJXPOWWVNYRA-QHCPKHFHSA-N 387.914 5.364 30 20 GKED Cc1ccc2cc(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)[nH]c2c1 603920867 CMGHXTOPFNPMSP-UHFFFAOYSA-N 395.462 5.374 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c2n[nH]cc2c1 608813261 ICVRXBSNJJQUDD-UHFFFAOYSA-N 382.423 5.096 30 20 GKED CCC[C@@H](NC(=O)NCc1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 609253091 SBBTVDKRZBVQMG-GOSISDBHSA-N 393.384 5.057 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)Cc3c[nH]c4ccc(Cl)cc34)c2C#N)C1 610037077 UQOCJHKIHZYXLQ-LLVKDONJSA-N 383.904 5.060 30 20 GKED C[C@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccc(C#N)c1 610406988 OMXQSTWMUBIYAW-AWEZNQCLSA-N 387.405 5.017 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)C1CC1 610663643 ZVPQWEVUNYDDIY-HNNXBMFYSA-N 388.427 5.096 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](CC)c1ccccc1OC(F)F 615674870 KROMDAKEXYJRBG-SFHVURJKSA-N 392.421 5.276 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 619804397 UUDWGMNVXLOUGX-UHFFFAOYSA-N 381.907 5.706 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)CCCCC1 625937152 NRIWJSPWDJBFHK-UHFFFAOYSA-N 397.588 5.813 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2cnc(C3CC3)o2)cc1)C(F)(F)F 628322072 YHJSVHJGQRSNGY-UHFFFAOYSA-N 382.279 5.454 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1F 675737557 HTGDCNUDSSCCNR-IVZWLZJFSA-N 375.303 5.525 30 20 GKED COc1cc([C@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1F 678113368 QHCGQEOOBFXBJF-FTYKPCCVSA-N 387.339 5.394 30 20 GKED C=CCCC[C@H](C)NC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 678895236 MLXGVPWECFOLMS-ZDUSSCGKSA-N 382.451 5.232 30 20 GKED O=C(c1ccc(F)c2ccccc12)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 684566003 COYXCIXLFJGGQC-GHMZBOCLSA-N 393.302 5.182 30 20 GKED CC(=NNc1ncnc2sccc12)c1cc2cc(Br)ccc2o1 725818889 DXDWIWNBNWLYHQ-UHFFFAOYSA-N 387.262 5.036 30 20 GKED N#CCCCCNC(=O)c1ccccc1Nc1ccc(SC(F)F)cc1 728892770 WJOSOZXWPBKLPE-UHFFFAOYSA-N 375.444 5.169 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)c1ccc(F)cc1 730209591 RNKFNHICMNNUGR-FQEVSTJZSA-N 382.797 5.280 30 20 GKED COc1ccccc1NC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1 731319125 OZIGPWRGJWCPGR-UHFFFAOYSA-N 375.453 5.168 30 20 GKED C[C@@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cnc2ccccc2c1 732498066 IQRXLAZOPICAPE-MRXNPFEDSA-N 395.418 5.212 30 20 GKED O=C(/C=C/c1cccc(NC(=O)C(F)(F)F)c1)c1cccc(Cl)c1Cl 734980955 NGBNSVYMCRNVMF-BQYQJAHWSA-N 388.172 5.390 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1/C=C\C(=O)c1c(Cl)nc2ccccn12 737445905 IAXGUAHEXLKZRZ-KHPPLWFESA-N 397.265 5.031 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(Br)nc2)cc1 741459495 BPCXNOYXYMDNGP-UHFFFAOYSA-N 396.288 5.356 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)/C=C(/C)c1ccccc1C(F)(F)F 741912157 PGFZRHSHYMCDDW-VBKFSLOCSA-N 384.401 5.195 30 20 GKED Cc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)c(OC(F)F)cc1C 742435021 PGXONAIOGIXSPO-ARJAWSKDSA-N 382.819 5.164 30 20 GKED Cc1cccc(NC(=S)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)c1 745723594 COGBNPJQAKOPSY-UHFFFAOYSA-N 389.499 5.718 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(Br)cc(Cl)c1O 756770390 VQBCHYQMRRHUJB-PXAZEXFGSA-N 393.712 5.504 30 20 GKED C#CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccccc1 757006805 ZKRKCJCHDUMTMN-IERDGZPVSA-N 389.524 5.243 30 20 GKED CC[C@@H]1CC[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)O1 757305210 NOMOZACQHVTDPC-FFSVYQOJSA-N 395.311 5.251 30 20 GKED CC(=NNc1nc(O)c2ccccc2n1)c1ccc2c(c1)Nc1ccccc1S2 757582457 APBQNIYZYCHWBW-UHFFFAOYSA-N 399.479 5.380 30 20 GKED C[C@@H](C#N)Oc1ccc(-c2nc3cc(Br)ccc3n2C2CC2)cc1 758454578 MMMHRWLETFLTJK-LBPRGKRZSA-N 382.261 5.092 30 20 GKED CC(C)(NC(=O)Nc1ccc(F)cc1OCC#N)c1ccc(Cl)c(Cl)c1 761665582 VJWGBDFOJJFPLQ-UHFFFAOYSA-N 396.249 5.092 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1ccc(Cl)c2ccccc12)c1ccncc1 765887215 ZSNSOTJHZQMFCP-YCRPNKLZSA-N 379.891 5.566 30 20 GKED CC(C)(C#N)CCCCOC(=O)Cc1csc(-c2ccc(Cl)cc2)n1 768405865 GQXRHLUTQBMTDO-UHFFFAOYSA-N 376.909 5.269 30 20 GKED C[C@H](N(Cc1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1)C(C)(C)C 768783145 BNGSPPTYNCPQEO-HNNXBMFYSA-N 385.964 5.845 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 782383440 PBDZWYCVBFPNOU-FQEVSTJZSA-N 394.522 5.426 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCCc2ccsc2)cc1 783432592 HZVJKLKIIKSZNI-UHFFFAOYSA-N 390.508 5.355 30 20 GKED CC(C)(C(=O)Nc1cccc(C2SCCS2)c1)c1cc(F)cc(C#N)c1 794809139 OPHORWNCZASVJV-UHFFFAOYSA-N 386.517 5.092 30 20 GKED Cc1cc(C#N)cc(N[C@@H]2CCCc3cc(NC(=O)OC(C)(C)C)ccc32)n1 804626241 PNUREWCBKRSSIM-LJQANCHMSA-N 378.476 5.098 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(C(F)(F)F)cc1 813212100 XFACPKZTPVIXPJ-YGRLFVJLSA-N 386.295 5.099 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813218823 ZQOBUFUFJUCDPL-FHWLQOOXSA-N 380.369 5.234 30 20 GKED CCSc1cccc(Br)c1NC(=O)/C=C\c1ccccc1C#N 813285734 RNKVRJVPXJERIX-KHPPLWFESA-N 387.302 5.085 30 20 GKED COc1ccc(-c2cc(NCc3cc(C#N)ccc3F)ccc2OC(F)F)cc1 825123290 MLPHSKGJVBPYTM-UHFFFAOYSA-N 398.384 5.586 30 20 GKED C[C@]1(CNC(=O)c2ccccc2Sc2ccccc2C#N)CC1(Cl)Cl 836828253 BYFDWPPWYLCTPV-GOSISDBHSA-N 391.323 5.023 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cc(C4CC4)cnc3Cl)c(C#N)c2[C@H]1C 839390971 ONYVQQACWGVKRP-QWRGUYRKSA-N 385.920 5.484 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)C2CC3(C2)CC3(F)F)c1 857589794 KQLDJOQMUQSDDP-UHFFFAOYSA-N 386.829 5.180 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C\c1ccsc1 914520452 KTBPXVPAOFITOE-YVMONPNESA-N 376.456 5.314 30 20 GKED O=C(/C=C/c1ccc(OCc2ccccc2)c(Br)c1)c1cccnc1 916136960 AWHQVDJSODVKAB-CSKARUKUSA-N 394.268 5.319 30 20 GKED Cc1cc(/C=C/C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)c(C)n1C1CCCCC1 916844768 BKPNGADCTOHNGT-DRUFCSCSSA-N 386.499 5.376 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCCc1ccc(Cl)cc1 920101557 DTSNZGDCVNGZCB-GOSISDBHSA-N 378.859 5.044 30 20 GKED Cc1ccc(CC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1C 920804431 QMYQQKQPAQZIDR-HNNXBMFYSA-N 382.435 5.124 30 20 GKED O=C(O)c1cc(NN=C(CCCc2ccccc2)c2ccccc2)ccc1Cl 1776033175 IDIJHAQKBVCSHK-UHFFFAOYSA-N 392.886 5.877 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCC[C@H]1c1ccc(Cl)c(Cl)c1 1776050252 VKDBNBIKDFPTEL-ZDUSSCGKSA-N 393.270 5.436 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3cnc(C(F)F)s3)cc2)ccc1F 1776064328 IPMALKZDAHQCQH-UHFFFAOYSA-N 391.374 5.031 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776120047 UGAPPKNBYLSRQU-SXGWCWSVSA-N 398.502 6.174 30 20 GKED CCc1cccc2c1OC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776977609 JSPNSIJAYFBCJS-STZFKDTASA-N 384.431 5.273 30 20 GKED COc1cc(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)cc2ccccc12 1777264291 SPSJRAZSUSDQSI-VAWYXSNFSA-N 397.430 5.299 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(C(F)(F)F)cs3)c2c1 1777685477 FPRKBWQMOXGGRE-IWQZZHSRSA-N 382.384 5.576 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2ccccc2)[n+]2ccccc2CC)c1 10174505 USPXCYKPQBWPGR-UHFFFAOYSA-O 389.544 5.150 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccccc2Cl)cc1 10826043 SGTKYCDVTNAKBP-UHFFFAOYSA-O 395.935 5.241 30 20 GKED COc1cc(C(=O)Nc2ccc(C#N)cc2)ccc1OCc1ccc(Cl)cc1 15543132 JSMXMRYJZNEPBL-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C[C@H](CCc1ccccc1)NC(=O)c1ccccc1Sc1ccccc1C#N 24587025 FZIXTYPOMGXVSZ-GOSISDBHSA-N 386.520 5.461 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 41536520 ATCAMKWGVZMNOH-QGZVFWFLSA-N 385.448 5.264 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc(-c2ccccc2)cs1 51534283 KNFICUCXIKZLSF-MRXNPFEDSA-N 387.489 5.424 30 20 GKED CCN(C[C@H](C)C#N)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 56409056 JCLPHXAOLYIWNQ-OAHLLOKOSA-N 395.553 5.089 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OCCCC)cc1C 63393224 XLHBANAXWGBZAP-UHFFFAOYSA-N 377.488 5.266 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)no1 69203092 BLBUIUZNFKUPKI-OAQYLSRUSA-N 388.427 5.016 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(Cl)nc1 98027705 KIPKPGBGRVQJDJ-UHFFFAOYSA-N 392.846 5.029 30 20 GKED CC(C)(C)c1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 114620310 FRLPBCMYWLYZNU-IBGZPJMESA-N 389.524 5.312 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2cccc(Cl)c2)c2ccccn2)c1 153318570 FYAUZXJNRMIWAE-HSZRJFAPSA-N 391.902 5.297 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(Cl)cc(Br)c2)n1 158142778 NXLQVKWJNUYFFH-GFCCVEGCSA-N 383.698 5.172 30 20 GKED C[C@@H]1CC(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 159505130 BLSUWNJTXLNJFY-SXGZJXTBSA-N 397.906 5.073 30 20 GKED CC1(C)C[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 162545376 TYDPZHIXQYVUIU-MJGOQNOKSA-N 397.906 5.075 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2[nH]c3ccccc3c2C1 171741389 LVHWRZIYIFFHTG-HNNXBMFYSA-N 390.512 5.010 30 20 GKED CC(C)(NCc1cccc(OCCCC#N)c1)c1ccccc1Br 179329320 FWNIDDVUSVAXON-UHFFFAOYSA-N 387.321 5.157 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccccc2C(F)(F)F)ccc1OC 180810748 CGIMIDUKAAEPTQ-GOEBONIOSA-N 392.421 5.246 30 20 GKED Cc1sc([C@@H](C)NCc2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 192184325 APOTXFKMMGXMST-GFCCVEGCSA-N 385.895 5.634 30 20 GKED COc1ccc([C@@H](C)NCc2cccc(OCc3ccccc3C#N)c2)cc1F 237483000 KPXKLPWXCYDFEQ-QGZVFWFLSA-N 390.458 5.136 30 20 GKED Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 280834706 WHNUHTNMHXBQQD-UHFFFAOYSA-N 388.471 5.222 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@@H]3C)c(C(F)(F)F)o1 410981793 OJUMGYBGYZIKHJ-IUCAKERBSA-N 382.407 5.478 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426135485 FZQYWELCMJJQCM-LLVKDONJSA-N 381.785 5.455 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N(CCC#N)CC1CC1 429060433 LWDLGTHPFZXMHW-SFHVURJKSA-N 377.488 5.293 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCc2ccc(F)cc21 432101184 YOUYRLAWEFUEGK-KBXCAEBGSA-N 383.492 5.277 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(Oc2ccncc2)c1)c1ccccc1 433157648 NFOQWDNMMNBTPU-JOCHJYFZSA-N 386.455 5.431 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 433985938 PUKQDMVFLRZIIP-UHFFFAOYSA-N 386.382 5.275 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)o2)cc1 436364612 OKKRQSUTMFTWGJ-VXKWHMMOSA-N 398.462 5.061 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 438050194 CXPDEYSOAUVWTP-DSKINZAPSA-N 384.545 5.002 30 20 GKED CO[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)[C@@H](C)C1 440911571 ATMJVVWVEQFDRA-KSSFIOAISA-N 399.878 5.035 30 20 GKED Cc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c(OC(C)C)c1 447059206 KSGPIPRNBSNEMG-QGZVFWFLSA-N 397.544 5.498 30 20 GKED CC(C)c1ccc2ncc(C#N)c(N3CCC(C(=O)Nc4ccccc4)CC3)c2c1 447689095 NTPXHFCTUSCZOI-UHFFFAOYSA-N 398.510 5.085 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc(CC(F)(F)F)cc3)c2)c1 462726324 QVTSZWSSRSHLCE-UHFFFAOYSA-N 396.412 5.854 30 20 GKED COc1cc([C@H](C)NCc2ccc(Cl)cc2C#N)ccc1OC1CCCC1 480889376 NFTAIAKQWJSJFZ-HNNXBMFYSA-N 384.907 5.392 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccc3ccccc23)n1)c1nc2ccccc2o1 480943380 UKXXJSJEJPNQBO-KRWDZBQOSA-N 395.443 5.595 30 20 GKED CC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1nc(C(F)(F)F)cs1 481665121 ZNYFFHADTIDVRV-HOTGVXAUSA-N 379.451 5.542 30 20 GKED Cc1sc(Br)c(C(=O)N[C@H](CCCC#N)c2ccccc2)c1C 487159650 SNKPQVLAGATMJK-OAHLLOKOSA-N 391.334 5.292 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1 487174362 DIESMUGBSYIMPV-AQNXPRMDSA-N 387.310 5.648 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccccc1OC[C@H]1CCCCO1)c1ccccc1 488688633 JBQDRVHRCUIBOH-NHCUHLMSSA-N 379.500 5.323 30 20 GKED C[C@H](NC(=O)c1cccc(SCC#N)c1)[C@H](C)c1ccccc1C(F)(F)F 499456153 JCJOSPRWUMDCRX-KBPBESRZSA-N 392.446 5.243 30 20 GKED CCc1ccc(NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 502653496 SGIBUXCJAJAOKG-UHFFFAOYSA-N 384.439 5.017 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CC1 504420708 YNHPCHNEVXZONQ-DHIUTWEWSA-N 387.527 5.183 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1ccc(Cl)c(Cl)c1 505955452 WUSZMVWQWCPLTD-QGZVFWFLSA-N 392.673 5.052 30 20 GKED N#Cc1ccc(Cl)c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1 505995770 KPLJCPKRDVDUSZ-FQEVSTJZSA-N 399.881 5.255 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)c1 508543654 WFCWNKICYCZKRZ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2ccc(-c3ccc(Cl)cc3)s2)nc2ccccc21 513676352 CVCRBSGBWAOJHC-HNNXBMFYSA-N 391.883 5.445 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@H](C#N)c2nc3ccccc3s2)s1 513681813 JVXMHFOOCOVAHO-AWEZNQCLSA-N 375.478 5.218 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 515697269 GIBZJYGMJGCXHG-UHFFFAOYSA-N 395.487 5.910 30 20 GKED CC(C)CCOc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 517456987 GDGRWVJJXOCADS-KRWDZBQOSA-N 382.529 5.616 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCC1 517532130 KVXJMPDZFKAWPI-KKSFZXQISA-N 379.529 5.744 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518256260 SFCMBFMBCLKJRU-MRXNPFEDSA-N 383.517 5.191 30 20 GKED CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518904443 IVXMCERBMZWSQD-UHFFFAOYSA-N 399.494 5.315 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccccc1SC[C@H](C)C#N 520825066 UKGBDARQDHBNNI-GFCCVEGCSA-N 399.566 5.684 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2o1)c1nc(-c2c(F)cccc2F)cs1 521260816 JMLFIDVRKHXHDA-GFCCVEGCSA-N 380.375 5.325 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cc(C)c(-c2cccc(Cl)c2)s1 522584021 HLVNAOMSHWXFJS-UHFFFAOYSA-N 382.872 5.510 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@H](C)c2nc3ccccc3o2)cc1 540852948 OJRKULRAGMIFQX-OAHLLOKOSA-N 385.423 5.673 30 20 GKED N#Cc1ccc(SCc2nnc(-c3cccc(Cl)c3)o2)cc1C(F)(F)F 542003804 MCOYYBGSUJDADX-UHFFFAOYSA-N 395.793 5.573 30 20 GKED C=C(C)Cn1c(S[C@@H]2CCc3ccc(Cl)cc32)nnc1-c1ccncc1 543149684 AXSDNBRLCLZWDQ-GOSISDBHSA-N 382.920 5.349 30 20 GKED C[C@@H]1C[C@@H](c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCO1 546510389 KMTQHKMIADFPCG-KGLIPLIRSA-N 395.846 5.336 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCc1ccccc1Oc1ccccc1 550217961 QIGHVFVSOCAOCK-UHFFFAOYSA-N 399.494 5.471 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)c1cc(C#N)ccc1Cl 552430749 CQEZJKSGQWDYEA-UHFFFAOYSA-N 375.859 5.385 30 20 GKED CC(C)(CCC#N)CNC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 554071761 NLEALVMHPDJAGD-UHFFFAOYSA-N 391.490 5.353 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 560664766 LEYSBZGPEKWHED-GOSISDBHSA-N 392.912 5.160 30 20 GKED Cn1ccnc1[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(Cl)cc1 571852933 VLGAIYIEGRLXSM-YADHBBJMSA-N 390.918 5.092 30 20 GKED CC(C)CN(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CCCC1 573610358 KMOPQSTVUOIRBL-UHFFFAOYSA-N 378.476 5.178 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN[C@H]2CCc3ccc(C#N)cc32)on1 576474356 UDJRSWBDMZWVLT-QFIPXVFZSA-N 395.462 5.152 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)CC1 577503905 NQECHWYHUBXNKA-QHCPKHFHSA-N 375.516 5.086 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCn2c(cc3ccccc32)C1 579779498 RDTJOZBCQGIVJI-MRXNPFEDSA-N 390.512 5.083 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 582882362 DUWHNERSJWYMSO-WIYYLYMNSA-N 379.504 5.269 30 20 GKED N#CCCCCCC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1 590531825 BEOOTLPBWYZEGA-UHFFFAOYSA-N 380.879 5.151 30 20 GKED N#CCC1(CNc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)CC1 594701500 QSSJZOLHBNPEHN-UHFFFAOYSA-N 391.368 5.203 30 20 GKED CCCCn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nnc1[C@H](CC)N(C)C 594884558 ZYDYRQXRTSGFBU-IRXDYDNUSA-N 391.972 5.101 30 20 GKED N#CC1(CNCc2cccc(NC(=O)c3ccccc3Cl)c2)CCCCC1 594994253 IUIPBFRXXKATKO-UHFFFAOYSA-N 381.907 5.156 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4cc(Cl)ccc4[nH]3)cn2)c1 603627089 PYCDMEYDCVYOEM-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CCOc1ccc([C@@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)cc1 603681185 YTKVYHMNTSJPMC-LJQANCHMSA-N 386.495 5.387 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cc2ccccc2o1 603690493 KKQLJCAEDWRTHI-HNNXBMFYSA-N 398.422 5.374 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nnc(-c2ccco2)n1C1CCCCC1 604044411 MIHNDVRHDQPQPB-GOSISDBHSA-N 378.501 5.270 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1 604665560 NUPVLJIFIDKEBD-DEOSSOPVSA-N 385.511 5.072 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(-c4ccc(F)cc4)s3)[nH]c12 605363292 SMSOLXAZTZMKQU-OAHLLOKOSA-N 375.428 5.229 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2ccc(C)cc2)nc2onc(C)c12 606813822 CNHSUSFLPGEBNE-UHFFFAOYSA-N 377.488 5.325 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)[nH]1 609377621 ZODCRBNRODQCFQ-QGZVFWFLSA-N 389.524 5.505 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1C 609378415 KYJSARHOKSVXIT-UHFFFAOYSA-N 378.419 5.580 30 20 GKED CCN(Cc1ccc(-c2ccc(C(C)(C)C)cc2)s1)C(=O)CSCC#N 609788803 QOCVHFZEHQDZBR-UHFFFAOYSA-N 386.586 5.318 30 20 GKED COc1cc(Br)c(CS[C@H](C)c2ccc(C#N)cc2)cc1OC 609825319 QPOYRYFOHQQYFG-GFCCVEGCSA-N 392.318 5.332 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(COC2CCCC2)cc1 610054248 GJPKVVXUGHNOBW-UHFFFAOYSA-N 396.490 5.937 30 20 GKED N#Cc1cc(CNc2cc(C(F)(F)F)ccc2SCC(F)(F)F)ccn1 610956748 AKJSMCMNKPESMK-UHFFFAOYSA-N 391.340 5.239 30 20 GKED N#C[C@@H](C(=O)c1sccc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 613407125 JATDAOLNFPOLHO-HNNXBMFYSA-N 394.908 6.168 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCCn3nccc32)cc1)C(F)(F)F 658047656 UDYDCOMZCSQJCU-GFCCVEGCSA-N 381.295 5.120 30 20 GKED N#C[C@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1cnc2ccccc2n1 682995719 ZRTFMUXIUXBEQJ-JTQLQIEISA-N 398.274 5.641 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(CN3CCCCC3)c2)cc1Cl 726461904 BBMCANIOBNBQAH-UHFFFAOYSA-N 384.936 5.006 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1ccc(OCc2cccc(C#N)c2)cc1 728062639 ROMBQJSFTOEAND-GOSISDBHSA-N 399.494 5.139 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2SCCC#N)cc1Cl 730952735 CHPIPTJPLMDOLM-UHFFFAOYSA-N 377.922 5.163 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1ccc(N2CCCCCC2)cc1 734096950 URUGCTOKZYXJLD-PFONDFGASA-N 385.511 5.208 30 20 GKED CCCN(C(=S)Nc1ccccc1C#N)[C@H]1C[C@@H](OCC)C12CCCCC2 741513523 QOBSFZYFZHDPEA-VQTJNVASSA-N 385.577 5.095 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@H](C)C[C@H]2c2ccccc2F)c1=S 743374229 PGXSQLOKTIWBPF-QAPCUYQASA-N 398.507 5.040 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1c(C)nn(C(C)C)c1C 743443985 BGTNSLVLHIFLMY-UHFFFAOYSA-N 395.454 5.545 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@H](C)c1ccc2ccccc2c1 753396986 WWYGNXLUBBRRMB-UZUQRXQVSA-N 398.506 5.416 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(Cl)cc1Cl 754393041 RUBORVGRZJFSPH-MRVPVSSYSA-N 388.081 5.663 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1cccc([N+](=O)[O-])c1 754699819 CXQFBGKCARYCKP-UHFFFAOYSA-N 397.866 5.062 30 20 GKED C[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)c1ccc(-c2cccc(C#N)c2)cc1 757660045 ZECRCTGWJQDXGM-HOTGVXAUSA-N 387.439 5.251 30 20 GKED C[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)c1ccc(-c2cccc(C#N)c2)cc1 757660046 ZECRCTGWJQDXGM-HZPDHXFCSA-N 387.439 5.251 30 20 GKED C[C@H](OC1CCCCCC1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 761045584 CUODZJLHNRHLRI-SWLSCSKDSA-N 376.909 5.254 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3ccc(F)c(Cl)c3Cl)cc2N1 761486994 RZYNEJCPMATNES-DUXPYHPUSA-N 388.272 5.134 30 20 GKED N#CCCCn1cc(C(=O)OCc2csc(-c3ccco3)n2)c2ccccc21 769541188 JBFSHOSVAJRQED-UHFFFAOYSA-N 391.452 5.019 30 20 GKED Cc1cccc(COc2ccc(CN[C@H](C)c3ccc(OCC#N)cc3)cc2)c1 776154116 NHLKFXLUZHTBLE-HXUWFJFHSA-N 386.495 5.327 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 780162660 KBFBZOARYCYLSY-HVCHUGMYSA-N 392.455 5.497 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCC1(C#N)CCCC1 781849422 GREZIKWVPZPCQE-UHFFFAOYSA-N 379.243 5.198 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(-c3nc4cc(F)ccc4s3)cc2C)cn1 784108791 UVRWSDDYABIFKP-UHFFFAOYSA-N 387.439 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C)=C(Br)C1 797649676 MMHHZHQIHPRYLM-UHFFFAOYSA-N 377.326 5.445 30 20 GKED N#CCSc1ccccc1C(=O)N(Cc1ccc(F)cc1Cl)CC1CC1 804183646 ROYNBNFFEZWDBS-UHFFFAOYSA-N 388.895 5.147 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)sc2cc(F)ccc12 805878165 ZOARJIITUSZXIR-CYBMUJFWSA-N 384.432 5.588 30 20 GKED O=C(/C=C/c1cc(Br)c(Cl)s1)c1cc([N+](=O)[O-])ccc1F 814190822 JGYKVYWKRHWSQZ-DUXPYHPUSA-N 390.617 5.107 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1 839645851 JIQGICBBKYBRPP-NSHGMRRFSA-N 384.401 5.044 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2cccc(Cl)c2C)cs1 915051515 XXCFUZBACLZQCG-UHFFFAOYSA-N 384.892 5.236 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1cccc(OC(F)F)c1 915983815 AQOXSWLOOSAARS-RMKNXTFCSA-N 381.378 5.158 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1cccc(Oc2ccccc2)c1 916881002 HXBDCKIINCDJGQ-HXUWFJFHSA-N 390.826 5.093 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3c(F)cccc3s2)cc1 916914703 RIKDFRDLNKHJEZ-QGZVFWFLSA-N 394.471 5.344 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCOc2ccc(C)cc2)cc1 916947384 IUGMTVYRWNUVAY-GCJKJVERSA-N 392.499 5.015 30 20 GKED Cc1ccc(OCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 917047017 OPYGDPGUHUTYLI-INIZCTEOSA-N 384.888 5.212 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)c1 919837828 LXUNTZRYDQCTFG-UHFFFAOYSA-N 381.435 5.114 30 20 GKED CCN(C(=O)/C=C/c1ccccc1OC(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 919862533 MDNAQJQTTVLGGR-LHNRBYRGSA-N 388.389 5.080 30 20 GKED CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)Nc1ccc(C#N)cc1C1CC1 933843064 VXFRFKSLNFQATJ-REWPJTCUSA-N 389.499 5.067 30 20 GKED O=C(O)c1cc2ccccc2c(C=NN(Cc2ccccc2)c2ccccc2)c1O 1776014755 WUJQLXWTSILBHJ-UHFFFAOYSA-N 396.446 5.284 30 20 GKED C=CCOc1ccc(/C=C(/CCC(=O)O)c2nc3ccccc3s2)cc1Cl 1776123508 QCAXDDUHGISPMA-QINSGFPZSA-N 399.899 5.920 30 20 GKED COc1c(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)cccc1C(C)(C)C 1777254514 JMUDNHFNVNNZDP-NTCAYCPXSA-N 396.483 5.132 30 20 GKED CCc1ccc(N/C(S)=C(\C(=O)c2ccccc2C)[n+]2cccc(C)c2)cc1 55012176 JMWWSDVJGKQHLG-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#C[C@@H](C(=O)c1cccc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 60477606 RLOLBKGNKGRUFA-IBGZPJMESA-N 388.879 6.107 30 20 GKED CCc1ccsc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 65072955 ZGQDDVXQMRPIKK-UHFFFAOYSA-N 376.481 5.208 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc(-c2cccc(Cl)c2)nc1C 108901871 VLYIHGYCGVZSOB-UHFFFAOYSA-N 397.887 5.295 30 20 GKED N#C[C@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccc(Cl)cc1 113178567 ZISWBVDVKKSJSA-KRWDZBQOSA-N 388.945 5.203 30 20 GKED CCOc1ccc2nc(-c3ccc(NC(=O)N(C)[C@@H](C)CC#N)cc3)sc2c1 119927670 QXTNCJACDKBQQL-AWEZNQCLSA-N 394.500 5.128 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C(/c2ccc(Cl)cc2)C(F)(F)F)n1 153550558 CFMXZRQRYJTEKW-CRMJKIRDSA-N 398.837 5.742 30 20 GKED Cc1oc(-c2cccs2)nc1CC(=O)Nc1cc(C(C)(C)C)sc1C#N 154269745 IHSIXDWRNZFAGB-UHFFFAOYSA-N 385.514 5.123 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](Oc2ccccc2)c2ccccc2)n1 177748858 NBINXRQWRSGYCO-NQIIRXRSSA-N 376.481 5.263 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)c2cccc(Br)c2)n1 177768818 CIZVVMQAPQIPBH-AWEZNQCLSA-N 391.334 5.183 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)NCCCCC#N 178641903 ZVJFOZWTRHSSKJ-LBPRGKRZSA-N 378.339 5.226 30 20 GKED Cn1cc(CNc2cccc(CCC(F)(F)F)c2)c(-c2ccc(C#N)cc2)n1 180286029 GLYVHCRPZWHWOY-UHFFFAOYSA-N 384.405 5.066 30 20 GKED CCC(CC)n1nc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 181102002 RKONYUWWKQIDDO-CQSZACIVSA-N 386.908 5.306 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 303170245 IORKVPSGHKBSHH-KRWDZBQOSA-N 386.451 5.491 30 20 GKED Cc1ccc(CCNC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 303711022 ZBABFCXFDOHXMZ-UHFFFAOYSA-N 399.494 5.004 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1cnc2c(C)cccn12 303911758 RVLFHKIGONKGOR-MDZDMXLPSA-N 377.444 5.110 30 20 GKED CC[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(Br)ccc1O 324155912 AEUJMKZFYSYGAF-GOSISDBHSA-N 389.293 5.400 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 328753277 RWKNLAZSRZAOPO-HZPDHXFCSA-N 396.318 5.086 30 20 GKED C[C@@H](/N=C(/O)N1CC2(CCC2)c2ccccc21)c1nc(C2CCCCC2)no1 330051451 NMYFCIRUONXNPF-OAHLLOKOSA-N 380.492 5.034 30 20 GKED N#Cc1ccccc1NC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 410067113 KBSKNXVSTZPPJH-UHFFFAOYSA-N 383.426 5.417 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1ncc(-c2ccccc2Cl)o1 410345385 QTQYVYULNALUDE-UHFFFAOYSA-N 380.875 5.685 30 20 GKED CC(C)c1ccc(-c2nc(C[S@](=O)CCCCC(C)(C)C#N)cs2)cc1 436108628 JHOKKPQRRQUDHF-AREMUKBSSA-N 388.602 5.902 30 20 GKED FC(F)C(F)(F)COCc1cccc(N[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 438109578 OVGIJAWCHHRMAK-TZMCWYRMSA-N 387.339 5.637 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)O1 439111851 NIUJKWRTZORKNN-RHSMWYFYSA-N 384.863 5.290 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)NCC1CCC(C#N)CC1 442718671 HQMFOZYIYDHVPW-UHFFFAOYSA-N 375.516 5.037 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2cc(Cl)ccc2s1 447164995 DAPYYOJFDPVLEC-LBPRGKRZSA-N 398.768 5.598 30 20 GKED N#C[C@H](C(=O)c1ccccc1COc1ccccc1)c1cc(C(F)(F)F)ccn1 464477600 SFZHCXMCKQRMFO-IBGZPJMESA-N 396.368 5.169 30 20 GKED C[C@@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)c(F)c1 468032086 YYXIWBZNKUQELD-BFUOFWGJSA-N 395.478 5.688 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-n2ccnc2C)cc1 472080651 RGAKAHUQQVHTND-IBGZPJMESA-N 388.515 5.030 30 20 GKED CC(C)CN(C(=O)c1cc(Cl)ccc1Br)c1ccc(C#N)cc1 480094605 GLNFYWMIKIHHIJ-UHFFFAOYSA-N 391.696 5.277 30 20 GKED Cc1ccc([C@H](Cn2ccnc2)N[C@H]2CCCCc3cc(C#N)ccc32)c(C)c1 481649413 FAILGIFDLYHHPY-DQEYMECFSA-N 384.527 5.170 30 20 GKED C=C(C)[C@@H](NC(=O)N(CCC)[C@@H]1CCCc2cccnc21)c1ccc(F)c(F)c1 483311211 SGBXDBXKBCNLSY-NHCUHLMSSA-N 399.485 5.476 30 20 GKED CC(C)(CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(F)(F)F 483345520 JDSXNBPYTRSILE-UHFFFAOYSA-N 390.405 5.249 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3ccc(C#N)c(F)c3)C2)nc2ccccc21 484073948 PWOLYVKGCAMCJK-LJQANCHMSA-N 376.479 5.008 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1ccccc1 488697200 VTNZYULNHHQATO-WIYYLYMNSA-N 375.472 5.103 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 494752786 MGAJUMDNIZECHE-AWEZNQCLSA-N 391.393 5.593 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccccc1 498249443 DQIWSFJHDMSGQI-GMAHTHKFSA-N 389.474 5.317 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)c1cc(Cl)cc(Cl)c1 499483028 FUJBIEWGOVVFAO-UHFFFAOYSA-N 377.271 5.077 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1c(Cl)cccc1Cl 499830410 DQMIXNRPJFFGPF-IBGZPJMESA-N 398.293 5.302 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)[C@@H](C)Oc1ccc(C#N)cc1 500449732 HJMZZAVGLXJWKM-ZWKOTPCHSA-N 390.508 5.177 30 20 GKED C=CCN(C(=O)c1cccc(-n2cccc2)c1)c1nc(-c2ccccc2)cs1 502954694 CXLZKJACQWZPNC-UHFFFAOYSA-N 385.492 5.434 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 505134335 NCHWPXAPZVZGMK-UHFFFAOYSA-N 384.483 5.237 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12 505174601 IPYFFJPKVKMWSQ-UHFFFAOYSA-N 394.475 5.008 30 20 GKED N#Cc1ccc(CCC(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc1 511621390 CFVWLPGBNBJPGT-UHFFFAOYSA-N 385.851 5.046 30 20 GKED O=C(N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F)c1cccc(C(F)F)c1 511743320 XAZBRGYPZSBEIG-ZDUSSCGKSA-N 395.274 5.259 30 20 GKED C=CCN(C(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1ccccc1 512248762 IWFNIYPQRQSPEK-UHFFFAOYSA-N 382.916 5.149 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2s1 513665057 BNROUDWOAVCCQH-AWEZNQCLSA-N 390.489 5.523 30 20 GKED COc1cccc(SCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517928818 QNOUDZVZXUFXJM-UHFFFAOYSA-N 390.464 5.090 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3sccc3C3CC3)cc2Cl)cc1 520866237 WQKZXGLUTNJUGW-UHFFFAOYSA-N 394.883 6.195 30 20 GKED N#CC1(C(=O)Nc2ccc(OCc3ccccc3)c(Br)c2)CCCC1 523125658 HXFUVHXLLAAGDM-UHFFFAOYSA-N 399.288 5.051 30 20 GKED CCCC[C@H](COC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 524079142 HYOPLBGMCIUPLG-UYAOXDASSA-N 399.922 5.322 30 20 GKED C=CCN(C(=O)c1ccc(Sc2ccccc2Cl)nn1)c1ccccc1 525173918 ZGRWDOFGUVSYIN-UHFFFAOYSA-N 381.888 5.114 30 20 GKED CN(C(=O)c1ccc(CC#N)cc1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 537334032 NSBJJROBQGLXLL-WOJBJXKFSA-N 386.417 5.180 30 20 GKED N#CC1(COc2ccccc2C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)CC1 537556625 XFEFEFAFELYBOF-UHFFFAOYSA-N 394.780 5.294 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)c1 537695565 XZIPBEBGWHCRNN-SFHVURJKSA-N 393.462 5.029 30 20 GKED N#CCC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 538426432 KGJMVHYGRRBQIN-FQEVSTJZSA-N 377.469 5.458 30 20 GKED Cc1nc(NC(=O)CCCc2ccc3ccccc3c2)sc1SCC#N 539519941 GLFZWSQBBKCPSJ-UHFFFAOYSA-N 381.526 5.182 30 20 GKED C[C@H](NCc1noc(-c2ccsc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541086829 RAWDSAXCTZEKKT-HNNXBMFYSA-N 386.480 5.188 30 20 GKED COc1ccccc1[C@@H](CC(C)C)NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 541507328 WGBMDJMTMXSTPJ-JOCHJYFZSA-N 391.515 5.028 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 543513302 SUGMFLJOUGRXDS-MHECFPHRSA-N 397.478 5.163 30 20 GKED COc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@@H](CCCC#N)c1ccccc1 551206064 PDVTVAIYWGDZHC-LPHOPBHVSA-N 399.922 5.090 30 20 GKED COc1ccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)cc1 552083097 RPYBKSJIIHAKJZ-OAQYLSRUSA-N 377.513 5.343 30 20 GKED CCN(CC)C(=O)c1ccc(NCc2cccc(OCCCC#N)c2)cc1Cl 556338872 QSHALNMBSMZDFT-UHFFFAOYSA-N 399.922 5.117 30 20 GKED N#CCCN(C(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccc(F)cc1 559234042 KTIKWRDTVPEZTK-UHFFFAOYSA-N 379.822 5.102 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 563984475 NQLZLDOEHOKHQA-KRWDZBQOSA-N 391.490 5.055 30 20 GKED CN(C(=O)c1ccccc1-c1ccccc1C#N)[C@H]1CC[C@@H](C(F)(F)F)CC1 569768002 WJFYAHJNMCPGEK-CALCHBBNSA-N 386.417 5.418 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2ccccc2)c(C)n1 580488171 BIWCHJUXXYCMTR-UHFFFAOYSA-N 382.467 5.149 30 20 GKED CC(C)(C#N)CCCN(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 582114864 KGROYWRXQWLHCZ-UHFFFAOYSA-N 376.331 5.721 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccc(F)cc2[C@@H](C)C1 593160885 ZWHBNDBNKDXQCJ-HOTGVXAUSA-N 397.519 5.271 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccc(F)cc2[C@H](C)C1 593160890 ZWHBNDBNKDXQCJ-JKSUJKDBSA-N 397.519 5.271 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 598823401 GAAYDBPOYBJDCR-AWEZNQCLSA-N 398.322 5.034 30 20 GKED CC[C@@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 600002802 XNPQQIYUUVDOMF-HZPDHXFCSA-N 395.528 5.172 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1N[C@H](C)c1cccc(C#N)c1 600848855 HOZUIQHZPXFJDJ-MRXNPFEDSA-N 389.886 5.946 30 20 GKED C[C@@H](S[C@H]1CCCc2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2 608801715 JWGMNGOLCOUWFR-ACJLOTCBSA-N 382.554 5.246 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3c2ccn3C)cc1 608879003 OMAASBKTVDGNOI-UHFFFAOYSA-N 397.434 5.103 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCC4(CCCCC4)C3)cn2)cc1 609553591 BSOIFICLSCEVHP-UHFFFAOYSA-N 390.487 5.324 30 20 GKED COc1ccc(C(C)(C)C)cc1NC(=O)Nc1cccc(OCCCC#N)c1 609600542 TUOQGENWTWZDHV-UHFFFAOYSA-N 381.476 5.319 30 20 GKED CCn1c(C)cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 613319348 CSJGDMXKVJGWGX-KRWDZBQOSA-N 383.904 5.392 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(F)ccc2s1)c1nc2cc(Cl)ccc2s1 613403067 LUALQHQBZZYODL-LBPRGKRZSA-N 386.860 5.794 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)C(C)(C)C(=O)N2C 613902109 XTNIJUKQHQMCIW-UHFFFAOYSA-N 376.500 5.045 30 20 GKED CCOc1cc(CN[C@H]2CCc3cc(C#N)ccc32)ccc1OCc1ccccc1 618741601 HKFCUZFAPPWBNY-DEOSSOPVSA-N 398.506 5.313 30 20 GKED C=CCCO[C@@H](C)C(=O)N(Cc1ccsc1)c1ccc(Br)cc1 620574697 WNNKUJPFEPLSFA-AWEZNQCLSA-N 394.334 5.025 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc(-c2ccccc2)cs1 642281571 KNPBAISKMIKTHI-HNNXBMFYSA-N 378.840 5.700 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2[nH]c3ccc(C)cc3c2C1 682777804 SCUVIMZUTRADNG-UHFFFAOYSA-N 387.527 5.918 30 20 GKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1csc(C(=O)O)c1 730150708 XDIXGPYAHFYTIG-AATRIKPKSA-N 375.858 5.119 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1ccccc1Cl 730951314 MKDJDVYPDWVJBI-YFHOEESVSA-N 382.799 5.106 30 20 GKED N#C[C@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1ccc(Cl)c(Cl)c1 731645424 LXDSPLWHDZVYHW-AWEZNQCLSA-N 392.044 5.434 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(OCCC(C)C)c2)c1 733843883 COUQNNSGGSSMRN-FQEVSTJZSA-N 395.503 5.114 30 20 GKED Cc1cccc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 734644577 RXTPSRRURBNXDG-NTKDMRAZSA-N 383.495 5.842 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](CCc1ccccc1)c1ccccc1)c1ccncc1 734659459 CNXMWDMDFCXEOL-RPWUZVMVSA-N 385.511 5.372 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 739143019 NKTRICAPVLQGQL-DOMZBBRYSA-N 388.414 5.370 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2ccccc2-c2ccc(Cl)cc2)cc1 740014250 OVYWKMBHIQLJDC-ZWKOTPCHSA-N 390.914 6.149 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@]34CCc3ccccc34)n2)cc1 744034342 GSEJQKHDWRNRSN-DRMXPCRNSA-N 384.504 5.199 30 20 GKED N#CCC1(COC(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 744277438 KYMNIIPPNXKFNH-HXUWFJFHSA-N 385.916 5.400 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 749911253 MRRDGJKFKJBKQZ-GOSISDBHSA-N 391.814 5.156 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 752238549 RTODFQVCKQRHFF-KBXCAEBGSA-N 385.920 5.713 30 20 GKED CCOC(=O)Nc1ccc(NC(=S)Nc2cccc(C(C)C)c2)cc1C#N 752766397 XMZDBJIFTGCHMY-UHFFFAOYSA-N 382.489 5.059 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 772983862 MNSVOVJPTOCVOM-RXVVDRJESA-N 395.522 5.348 30 20 GKED CC(C)COc1ccc(C2(C(=O)Nc3ccccc3O[C@@H](C)C#N)CCC2)cc1 780166405 VUSLDUMGSZXEKA-SFHVURJKSA-N 392.499 5.073 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C(C)(C)c1ccc(-c2ccccc2)cc1 780169501 PUYFIBYGLOYCFP-SFHVURJKSA-N 384.479 5.561 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@H](CCCc2ccccc2)C1 780673041 NDLRCXKHRBSMPX-FPOVZHCZSA-N 391.515 5.244 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)NCCc2ccc(F)cc2)cc1 789188573 YPDFINUYSUNSIM-QFIPXVFZSA-N 389.499 5.010 30 20 GKED N#CCOc1ccc(CC(=O)N[C@@H]2CCCCC[C@H]2c2ccc(Cl)cc2)cc1 791234988 NHYBFALISNPAIR-FCHUYYIVSA-N 396.918 5.018 30 20 GKED C#C[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1F 796085834 FYJWQSKZAUCKEH-OAQYLSRUSA-N 378.834 5.701 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)F)c1cc(F)c(C(F)(F)F)cc1F 804533357 DDRWIENHDQBPND-UHFFFAOYSA-N 399.237 5.019 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OC[C@H]1CC[C@@H](C#N)CC1 809088875 GUCDCHNOIIIHMQ-KFWWJZLASA-N 388.920 5.242 30 20 GKED N#Cc1ccsc1C(=O)O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809327163 UXJORALYNPRWIE-LBPRGKRZSA-N 379.281 5.099 30 20 GKED Cc1cc(OCCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)ccc1Cl 813211507 LLWXCHJZEAQAHD-HNNXBMFYSA-N 396.796 5.098 30 20 GKED N#C[C@@H](C(=O)C1(c2cccs2)CCCCC1)c1cc(C(F)(F)F)ccn1 813218242 MWLWWCBGAOXHDF-CQSZACIVSA-N 378.419 5.240 30 20 GKED OCCC[C@@H]1CCCCC1=NNc1ncnc2scc(-c3ccc(F)cc3)c12 814765691 PSWMATWEWVOHFH-HNNXBMFYSA-N 398.507 5.228 30 20 GKED CCC[C@H](OC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 835071006 XTLGDRABWYJTIQ-WFASDCNBSA-N 383.300 5.108 30 20 GKED N#C[C@H](C(=O)C1(C(F)(F)F)CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 842287810 BPTCIDJYWGTUJE-CYBMUJFWSA-N 398.837 5.762 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C3CCC(C4CC4)CC3)n2)cc1 850791975 ZAXWADLYYCFHPB-NKELODKYSA-N 375.497 5.074 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C(F)(F)c1ccc(F)cc1 855930138 IGTJKNLVTSBQIV-UHFFFAOYSA-N 395.265 5.087 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc(-c3ccccc3OCc3ccccc3)no2)c1 904464537 MQHIGGZEJADLMX-FCHUYYIVSA-N 393.446 5.458 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 915087559 VXCPDQAMJUDFQT-VSDWSMLSSA-N 384.479 5.630 30 20 GKED Cc1c(C(=O)/C=C\c2ccccc2OCc2cccnc2)cnn1-c1ccccc1 915986826 FRWLJZNCTGCWOR-YPKPFQOOSA-N 395.462 5.051 30 20 GKED CCCCC1CCC(C(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)CC1 916902339 DXVHPWXISGHHMY-FBPXKMNZSA-N 382.548 5.455 30 20 GKED O=C1c2cccc3cccc(c23)C(=O)N1N=Cc1cc(-c2ccccc2)cs1 917535018 SDLCCPRZNCMXPG-UHFFFAOYSA-N 382.444 5.198 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 920805501 CXHHJMNBPCGOIS-HNNXBMFYSA-N 382.435 5.206 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1cc(C(=O)O)ccc1OC(C)C 1776029589 DWNQJSPOJDIEKX-UHFFFAOYSA-N 381.259 5.315 30 20 GKED O=C(O)c1cccc(NN=Cc2cc(F)ccc2Oc2ccc(Cl)cc2)c1 1776038227 YFDHZBSASPTXHA-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C\C(=O)c3cc(C(=O)O)ccc3O)o2)cc1 1776271488 TZFUQSOTHDMGHN-XFXZXTDPSA-N 390.435 5.544 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2c(Cl)cccc2Cl)S1 7165075 PANBUYDFVQVVFN-OQLLNIDSSA-N 377.296 5.502 30 20 GKED N#CCC[C@@H](C#N)CSc1nc(Nc2ccccc2Cl)c2ccccc2n1 23674211 CSKROYLCRZHXSS-AWEZNQCLSA-N 393.903 5.562 30 20 GKED C=CCn1c(SCc2csc(C(C)C)n2)nc2cc(Cl)ccc2c1=O 31645740 UCSRZNRKWLJOKP-UHFFFAOYSA-N 391.949 5.108 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2[nH]1 41496110 PIQIDZUKRQOZIO-CQSZACIVSA-N 392.871 5.138 30 20 GKED N#C[C@@H](C(=O)c1cccc(OCc2cccs2)c1)c1nc2ccccc2s1 41497990 NWWWUBWRPGOHCZ-KRWDZBQOSA-N 390.489 5.427 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 47741973 KRLFFNAEXXVDCF-KRWDZBQOSA-N 390.508 5.195 30 20 GKED CSc1ccccc1C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 47974642 FINSHVYFFCDMOT-UHFFFAOYSA-N 375.453 5.028 30 20 GKED N#CCc1cccc(C(=O)NCCCN2c3ccccc3Sc3ccccc32)c1 78957412 MZHKIBWJMUAWBE-UHFFFAOYSA-N 399.519 5.175 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2ccc(N3CCC(O)CC3)cc2)cc1 97572468 ZUGVMQQRSLPAIG-VGOFMYFVSA-N 393.527 5.113 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Nc1cccc(OCCCC#N)c1 120604748 DJWFANUGMLMMAI-SFHVURJKSA-N 379.504 5.240 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)n1 120984740 QUFAGUJVDXTFOD-UHFFFAOYSA-N 382.876 5.106 30 20 GKED COCc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)o1 123695904 FWFPOWMAHQIHIU-CRAIPNDOSA-N 399.516 5.047 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 132820266 JIRXWBVIOLHRFL-APWZRJJASA-N 390.512 5.215 30 20 GKED CC(C)(C)OC1CCN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)CC1 151483049 KTAPCDIBBWIRSO-UHFFFAOYSA-N 394.540 5.129 30 20 GKED CC[C@H](C)Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 175119743 NJLRPCDBAYPGDD-BBRMVZONSA-N 383.398 5.099 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 175608849 ZRAKLEGGKKHSTM-UHFFFAOYSA-N 399.475 5.005 30 20 GKED Cc1cccc(-c2nnc(SCCCC(C)(C)C#N)n2Cc2ccco2)c1 177208555 GJIKKQBLFNWKDE-UHFFFAOYSA-N 380.517 5.317 30 20 GKED CC[C@@H]1C[C@@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 183137992 SAWMXVGWXIHSOJ-HQRMLTQVSA-N 382.891 5.139 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)Nc1ncccc1OCCCC#N)C1CC1 188775131 GEPLEMMXCIBZLJ-HNNXBMFYSA-N 398.894 5.175 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)c1cccnc1 191442896 GDJAAOHKCKVVCL-QHCPKHFHSA-N 385.511 5.845 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](COCc2ccccc2)C1 191476772 DUVZDGIMJOXVCS-NRFANRHFSA-N 392.543 5.609 30 20 GKED N#Cc1ccccc1C(=O)/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1 194590808 FEOSTUSDQKVQFD-OUKQBFOZSA-N 386.838 5.360 30 20 GKED CCN(C(=O)c1cc(-c2ccc(Cl)cc2)on1)[C@H](C)c1ccc(C#N)cc1 195629441 ZRDLHOQACVBJGZ-CQSZACIVSA-N 379.847 5.090 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC[C@@H]1c1ccccc1 246765999 QYSUQUJGTOGCCV-GGPKGHCWSA-N 393.556 5.738 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(C(C)(C)C)cc1 303306712 DUAINRCOSNMZAM-MRXNPFEDSA-N 381.545 5.429 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Oc2ccccc2)c1 303399483 ZQUNHSOTNCNCMB-QGZVFWFLSA-N 388.492 6.125 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cccc(COc2ccccc2C#N)c1 303576150 NUFOQANIAKXEKK-UHFFFAOYSA-N 396.490 5.008 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccoc3C3CC3)cc2Cl)c1 409647193 VNXHLVVSFNQZJR-UHFFFAOYSA-N 392.842 5.513 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1sc(C(C)(C)C)cc1C#N 411004866 DPNORVBTQBXKIK-UHFFFAOYSA-N 377.853 5.040 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@H](CC#N)c1ccccc1 425082496 GCJRIBVNNFRHKB-APWZRJJASA-N 399.416 5.034 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 429053745 FYELLDRLTIBGFB-UHFFFAOYSA-N 376.460 5.144 30 20 GKED Cc1cc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 429371818 KIKMRJITDJASPH-CYBMUJFWSA-N 391.279 5.817 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(COCC2CC2)c1)c1ccccc1 432752205 JMWGJCJEROTMQW-QFIPXVFZSA-N 377.488 5.170 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 433156903 KTGMDADXDFGARL-IEBWSBKVSA-N 392.528 5.638 30 20 GKED C/C(=C/c1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1nc(=O)c(C#N)c(C)[nH]1 435337465 WKOCYVYVWHBNEU-YFHOEESVSA-N 386.238 5.077 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 436330108 CRRSLUQNNDJRMC-QANKJYHBSA-N 385.920 5.412 30 20 GKED CCCc1c(NC(=O)[C@H](C)c2cccc(Cl)c2)cnn1-c1cccc(C#N)c1 440076704 KLOVUKQOZKYSSC-OAHLLOKOSA-N 392.890 5.092 30 20 GKED Cc1cc(F)ccc1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 454759407 LPGGJYGHZUEVRV-OXQOHEQNSA-N 397.519 5.897 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458807145 XEIFTLXZEKLAQD-GOTSBHOMSA-N 391.515 5.367 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CNc1c(C)cccc1C 460871432 CIUNNIIWCROOFE-UHFFFAOYSA-N 399.494 5.113 30 20 GKED C[C@H](C#N)N[C@@H](Cc1c(F)cccc1Cl)c1ccccc1Br 463910771 NQHPLSICUDXSQN-DIFFPNOSSA-N 381.676 5.027 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 471908195 WYDJWIKJSYQDIY-SFHVURJKSA-N 382.529 5.495 30 20 GKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 475757830 VMGMIGDYUJAAJZ-VQIMIIECSA-N 375.497 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(Cc2ccncc2)c1C 476792221 DTWSZVPSQJEXDJ-UHFFFAOYSA-N 387.527 5.652 30 20 GKED CC(C)CN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H]1CCCc2cccnc21 476828252 WOWFRBSJBHBTGQ-YADHBBJMSA-N 375.516 5.031 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@@H](Nc3ccccc3)C2)cc1 479669976 GANZTDPPEASFMZ-OAQYLSRUSA-N 399.519 5.036 30 20 GKED C[C@@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)cc1F 480752937 ZSZRLUWHQKOBOZ-NSPYISDASA-N 391.259 5.401 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3)o2)nnc1-c1ccccc1C 481402884 QQDOUZHLPKVMDZ-UHFFFAOYSA-N 388.496 5.387 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@H](C)[C@H]1C 482925974 YCLXFMSQUAYVKR-HZPDHXFCSA-N 381.501 5.017 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(Cl)c1 483229638 OPOCIRZBHSOITI-LJQANCHMSA-N 378.859 5.557 30 20 GKED Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c(-c2nc3ccccc3[nH]2)c1 483334136 AAQGXYDWCRTIQN-LJQANCHMSA-N 394.478 5.564 30 20 GKED CC(C)C[C@H](NC(=O)CNc1ccccc1SC[C@@H](C)C#N)c1ccccc1 487400083 ZDVTVOCHHAFPOC-RXVVDRJESA-N 395.572 5.254 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cnn(CCC(C)C)c1C(C)C 487607367 MAEAHIIVJLEIHI-UHFFFAOYSA-N 395.551 5.368 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496574059 PMXIVEXOGYPHHV-XMMPIXPASA-N 383.495 5.328 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCO[C@@H](C(CC)CC)C1 498384460 JVLJQDIZACKCEA-NVXWUHKLSA-N 384.973 5.083 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1 499838049 NCNFETXCAKDWKC-VBQJREDUSA-N 379.674 5.131 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1Cl 499943253 HYSUBOFIUITPED-XNJGSVPQSA-N 379.674 5.131 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1csc(-c2ccc(Cl)s2)n1 500610550 MNBLOUUQPYULHZ-UHFFFAOYSA-N 389.889 5.048 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 506687424 ATDZJAAIZBXUTA-SFHVURJKSA-N 387.291 5.446 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@@H](CCC)c2ccccc2)cc1 510534452 PSWJDYJAJMLDNS-QFIPXVFZSA-N 391.515 5.164 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cccc(C#N)c1 512818253 QQPNCSDDPCBKDN-UHFFFAOYSA-N 376.387 5.059 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@H](Cn1cnc3ccccc31)c1ccc(F)cc1)CC2 515925366 SXUBJCOTINJHHH-ISKFKSNPSA-N 396.469 5.065 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cc2)c1 518242207 VGAPORVKMOAPNH-UHFFFAOYSA-N 387.826 5.738 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(-c2ccncc2)cc1 523511324 ACEMRQFERBVCOS-UHFFFAOYSA-N 389.458 5.217 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc(C(F)(F)F)cc2)c1 523953401 DWJCGFSLBHJUHI-UHFFFAOYSA-N 386.329 5.001 30 20 GKED CO[C@H](C)CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(C)C 525417038 SVKYWPUCWKDVLE-OXQOHEQNSA-N 399.922 5.273 30 20 GKED C[C@H]1CC(F)(F)CCN1C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 530010563 ICKQUANJEDPAHX-ZDUSSCGKSA-N 390.817 5.264 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cccc1-c1ccccn1 535094243 IEAGATVWRYORIJ-IBGZPJMESA-N 396.277 5.359 30 20 GKED C[C@@H](c1ccco1)N(C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C1CC1 543943242 FWYHVLYNLGUNID-MSOLQXFVSA-N 399.494 5.814 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cnn1C1CCCC1 544148608 KLFAOWBFWIZKSO-OAHLLOKOSA-N 378.501 5.050 30 20 GKED CC(C)N(Cc1ccc(NCc2ccc(C#N)s2)cc1)C[C@H]1CCCCO1 546963635 ZDILMLNCLYBLKE-HXUWFJFHSA-N 383.561 5.011 30 20 GKED CC(C)(C)c1nc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cs1 549328522 YLWWJPYFXZORKP-SNVBAGLBSA-N 375.906 5.194 30 20 GKED C[C@@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1F 552318134 QZFYTDGDDMIIQR-CWTRNNRKSA-N 378.369 5.398 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 553119353 IMPGWFZQXKNCCD-BJKOFHAPSA-N 387.527 5.326 30 20 GKED N#CCCn1ncc(-c2nc(-c3cccc4ccccc34)no2)c1-c1ccccc1 558596539 QNUVKIYEVMZWOC-UHFFFAOYSA-N 391.434 5.334 30 20 GKED N#CCCn1cc(CN2CC3(CCC3)[C@H]2c2ccccc2)c(-c2ccccc2)n1 560569753 JTZSXZZNEDGLDC-XMMPIXPASA-N 382.511 5.191 30 20 GKED N#C[C@@]1(C(=O)Nc2ccc(Br)c(Cl)c2Cl)CC12CCCC2 572341225 KHTXULCZIWYCQY-OAHLLOKOSA-N 388.092 5.168 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1OC(F)F 582656537 CFRCSIXTAAKCDW-KSSFIOAISA-N 378.850 6.027 30 20 GKED O=C(CCc1ccccc1OC(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 590253325 KNRWAGPJMQXLEV-UHFFFAOYSA-N 395.274 5.314 30 20 GKED C[C@H](Sc1cccc(F)c1C#N)c1nc(O)c2c(-c3ccco3)csc2n1 590596234 HPRUAPWQZDQHFL-JTQLQIEISA-N 397.456 5.521 30 20 GKED N#CCCCCC(=O)Nc1ccc(OCc2ccccc2)c(Br)c1 593983053 SZHRLBNYROTQIX-UHFFFAOYSA-N 387.277 5.051 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](CCF)C2)cc1Cl 596690584 HDICLPXIHGRKNR-JXFKEZNVSA-N 399.897 5.599 30 20 GKED C=C(C)COc1cc(CNCc2ccc(Br)cc2C)ccc1OC 600806756 XYYZOZOVECQIIL-UHFFFAOYSA-N 390.321 5.011 30 20 GKED CCN(Cc1ccccc1C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603689236 CYSPCGJLOASKHM-UHFFFAOYSA-N 386.455 5.108 30 20 GKED CCC(CC)(C(=O)Nc1nc(C)c(SCC#N)s1)c1ccc(Cl)cc1 608847390 MLCMJLHJSYAWHU-UHFFFAOYSA-N 393.965 5.417 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3sc4c(c3C#N)CCC4)c(F)c2)cc1 609297660 ZYAPCRRUJBGAMS-UHFFFAOYSA-N 376.456 5.475 30 20 GKED Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C1 609976286 DMDZMETUQROXJO-NQIIRXRSSA-N 397.478 5.072 30 20 GKED CCN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)[C@H](C)c1ccc(C#N)cc1 609987173 HJANKGDAZBQKHD-GOSISDBHSA-N 394.478 5.397 30 20 GKED CC[C@@H](CC(=O)N[C@H](C#N)c1ccccc1Br)c1ccc(C)cc1 609994008 IXWOTUWLULHXBO-HNAYVOBHSA-N 385.305 5.022 30 20 GKED CC(C)n1ncc2cc(NCc3cn(CCC#N)nc3-c3ccccc3)ccc21 610910956 ODKPEQVIEXTWNO-UHFFFAOYSA-N 384.487 5.006 30 20 GKED C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1ccccc1Oc1ccccc1C#N 611548559 AVSLVOSWVFBFKQ-ZBFHGGJFSA-N 388.389 5.154 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnn(-c4ccccc4)c3C)n2)cc1 613314711 VBIWCGPYGWAWND-IBGZPJMESA-N 398.491 5.103 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@@](F)(C#N)C2)c(C(F)(F)F)c1 615528828 KBKKHQBAXMURRW-MEDUHNTESA-N 389.418 5.065 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(C)nn2)cc1 681599922 UEGPWJJUPQSJAG-UHFFFAOYSA-N 377.469 5.108 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(Cl)cc3)o2)cc1NC(C)=O 726429335 STUYYZOHFCFMKA-CSKARUKUSA-N 395.842 5.463 30 20 GKED CCc1ccc(C=NOCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1 726594782 QLHAHMRXTSTQKF-UHFFFAOYSA-N 376.243 5.157 30 20 GKED C/C(=C\C(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccccc1Cl 727303311 DYQRISVGXXPMHE-GXDHUFHOSA-N 392.808 5.206 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1 727654340 LLQFHXYHPSVJQC-LFYBBSHMSA-N 396.899 5.626 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1cccc2ccccc12)C1CCCC1 727978771 AFOJLCMYNUAAAB-UHFFFAOYSA-N 385.536 5.853 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)cc1 728695424 WQOCRYGNSPWWNC-XETPBLJFSA-N 393.389 5.628 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1ccc2ccccc2n1 730685495 HGNZFYWNFGMLRM-CXAGYDPISA-N 383.278 5.597 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1sc2cc(C(C)C)ccc2c1Cl 732637662 KBVLRRRCVLZPHC-UHFFFAOYSA-N 384.888 5.811 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3sccc3C)c2)cc1 733748529 BIPFQXZEJJAZBA-WDZFZDKYSA-N 377.465 5.214 30 20 GKED CC[C@H](NC(=S)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 734378020 PIPRTIHTNNFOOK-IBGZPJMESA-N 393.537 5.850 30 20 GKED CC(C)(C)/C=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 735206537 LNWWBEPKZPIGBK-FMFIFOJESA-N 379.312 5.895 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cc4c5ccccc5n(C)c4s3)[nH]c12 735791066 UCMVFYZZGKGISS-OAHLLOKOSA-N 384.464 5.068 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@]12CCc1ccccc12)c1nc2cc(Cl)ccc2s1 744036408 YGDSKAUXHRNMNF-IVZHQMGZSA-N 378.884 5.030 30 20 GKED CC[C@H](Oc1ccccc1F)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 749027224 YXFWWMLHWQKCOB-LPHOPBHVSA-N 394.471 5.292 30 20 GKED COc1c(O)cccc1/C=C\C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750915845 IOBUWQAABNSCCU-WAYWQWQTSA-N 390.279 5.335 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1)C(C)C 756487920 QMDSDLYLUDPHBV-UHFFFAOYSA-N 391.968 5.494 30 20 GKED C[C@@H](NCc1nc(Cl)ccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 766894129 PCQSOIGARLFNQC-CQSZACIVSA-N 382.294 5.778 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C(F)(F)F)o1 769863327 SUNPYXOOQINLCE-SFHVURJKSA-N 384.357 5.515 30 20 GKED COCCOc1c(Cl)cc(NCc2ccccc2C(C)(C)C#N)cc1Cl 773213667 XGKBOFQCWAIGFT-UHFFFAOYSA-N 393.314 5.432 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3cccc(C(C)C)c3)o2)c1 776517233 PLRIWXUKYWQNTC-FQEVSTJZSA-N 386.451 5.340 30 20 GKED C[C@@H](Nc1ccc(OCc2cn3ccccc3n2)cc1)c1ccc(C#N)c(F)c1 777685585 YQRYDNKRQKFUKL-MRXNPFEDSA-N 386.430 5.097 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCn3cc(C)nc3C2)c1 782564987 VITHWKJKOWMGKP-UHFFFAOYSA-N 398.551 5.116 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 782727978 JVVXWAXITVQFSL-HOYKHHGWSA-N 396.494 5.298 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(CC)cc2)n1 785762095 PWEYFNLDHTWCKS-OAQYLSRUSA-N 386.517 5.036 30 20 GKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc(OCC(F)(F)F)cc1 789126458 FHTABSAZUAPZMV-BQYQJAHWSA-N 379.359 5.240 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(F)c(Br)c(Cl)c2)cc1 795789257 HAHXRNVYCLHAIR-UHFFFAOYSA-N 395.659 5.111 30 20 GKED Cc1cccc(Oc2ccccc2C(=O)OCCCC2(C#N)CCOCC2)c1 800223642 BFLIDYSJGWZDSZ-UHFFFAOYSA-N 379.456 5.045 30 20 GKED O=C1/C(=C\c2cnc(-c3ccc(Cl)cc3)s2)C[C@H](C(=O)O)c2ccccc21 806560608 MUCDNZQLSPPEDU-GWCFYCIZSA-N 395.867 5.302 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2sc3ccc(Br)cc3c2C)n1 815898140 UMUIESHLCJVRRX-LBPRGKRZSA-N 391.315 5.227 30 20 GKED Cc1sc2ncn(N=Cc3ccc(Cl)s3)c(=O)c2c1-c1ccccc1 839394412 DLOOQAZYYUHOKQ-UHFFFAOYSA-N 385.901 5.031 30 20 GKED CCCCn1c(S[C@@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)nc(C)c1C 863874148 NNCFUBRKKLZEPD-IBGZPJMESA-N 398.576 5.036 30 20 GKED Cc1cc(NC(=O)OC(C)(C)C)cc(NC(=O)c2ccccc2SCC#N)c1 870736019 OKBFCPALWGLTGM-UHFFFAOYSA-N 397.500 5.210 30 20 GKED N#Cc1c(NC(=O)c2ccccc2SC(F)(F)F)sc2c1CCCC2 914711135 QGTYZVNORAZVHG-UHFFFAOYSA-N 382.432 5.363 30 20 GKED COc1cccc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)c1OC(F)F 916154745 SHOCAPIYPKVWQH-JLHYYAGUSA-N 387.426 5.183 30 20 GKED Cc1cc(C)c(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 917042877 IKRNGJVDJHBWMY-JJEJIETFSA-N 379.410 5.246 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)nc2)cc1OC 917146305 JFDHUFKXDYIEMQ-ZRDIBKRKSA-N 388.467 5.227 30 20 GKED COc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 920805086 GOJQUAAVLDMISG-WFASDCNBSA-N 398.434 5.077 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3cccc4c3CCCC4)cc2)c1 1776036568 ZLBBBXRUTZXOGJ-UHFFFAOYSA-N 384.479 5.306 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 1776155516 UUOBUMGKDOMDBE-QHCPKHFHSA-N 399.918 5.684 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)CO2 1776374728 VPQIDJQLYCBVRK-WOJGMQOQSA-N 388.419 5.427 30 20 GKED N#Cc1cc([N+](=O)[O-])cnc1Sc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1 8318791 RHHJTKWPWYKCRH-UHFFFAOYSA-N 399.435 5.070 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccccc1OC(C)C 46649000 MJAWDHQVYAOBHP-GOSISDBHSA-N 379.504 5.028 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc(OC(C)C)c1 46654406 YNAJUQWDJPZRDN-GOSISDBHSA-N 379.504 5.028 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 57683734 ZMVSZDFEUMAVES-UHFFFAOYSA-N 385.703 5.390 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 68455835 AOVZWOXEROYXKZ-SUNKGSAMSA-N 379.209 5.043 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccccc1SCCC#N 108199760 CCJLSNFFDMNSFV-UHFFFAOYSA-N 379.510 5.377 30 20 GKED N#Cc1ccc(F)cc1CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 130324351 UJZIUFHJCAFOPN-UHFFFAOYSA-N 389.459 5.064 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)Nc1ccc(F)cc1OCC#N 135307155 ZHFFERXUZALYEO-ZIAGYGMSSA-N 389.858 5.037 30 20 GKED Cc1ccc(C[C@@H](NC(=O)N[C@H](CCC#N)c2ccccc2)c2ccccn2)cc1 151435801 NJIBGCRBPTXQCU-ISKFKSNPSA-N 398.510 5.018 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3ccc(C#N)cc3)s2)cc1 174094278 ZJQLNKXVFKVFLT-LSDHHAIUSA-N 377.513 5.411 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)o1 176344017 FRSFVQQFTCLWAC-HNNXBMFYSA-N 378.453 5.718 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ncccc2C(F)(F)F)cc1 180000054 SBKICTVPGXHCBR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(Cc2cccc(F)c2)n1 180320540 AVCDHFFNKSACGY-UHFFFAOYSA-N 397.500 5.131 30 20 GKED C[C@H](NCc1ccccc1CN(C)C1CCCCC1)c1ccc(OCC#N)cc1 181548218 YCMQSFGGUMIUGQ-FQEVSTJZSA-N 391.559 5.204 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3-c3nc4ccccc4s3)cc2)CC1 182467871 HLMRXGXISZHQKW-UHFFFAOYSA-N 395.487 5.771 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(Br)s1 189912221 ZMLWYGDBSSBQLC-CYBMUJFWSA-N 392.362 6.105 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)c(OC)c1 237358621 CBJFVNXVTODHGE-HSZRJFAPSA-N 392.886 5.108 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)o2)c(C)c1 303027637 SOHQWHRHDHCYHP-UHFFFAOYSA-N 388.467 5.529 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)/C=C/c2nc3ccccc3s2)c1 303227980 WWEBJNLEMNWHLM-OUKQBFOZSA-N 384.460 5.117 30 20 GKED Cn1cc(CC/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c2ccccc21 329498977 JXZYXYNCWZENOJ-OAQYLSRUSA-N 390.531 5.457 30 20 GKED COc1ccc2c(c1)[C@H](/C(O)=N/[C@H]1CCCc3cn(C4CCCC4)nc31)CC2 330353785 OVVDBTVNEYRZMP-CTNGQTDRSA-N 379.504 5.071 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(NC(C)=O)cc(C(F)(F)F)c1 410344008 JAFNBQONROXQIP-UHFFFAOYSA-N 376.378 5.035 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 410349468 AJMMQPQDCOUCSP-UHFFFAOYSA-N 378.516 5.176 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1 433130569 AMGSJBWCVBCKFJ-WBVHZDCISA-N 399.947 5.613 30 20 GKED CC(=O)c1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)ccc1C 434568872 AEWADWNXOKRXHV-HNNXBMFYSA-N 396.418 5.089 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 438221450 AQQNITFUEMYNNN-HSQYWUDLSA-N 377.488 5.168 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)C1 452563579 VFXUKXKPCCGTPE-WPRPVWTQSA-N 387.719 5.674 30 20 GKED C[C@@H]1[C@H](Cc2ccccc2)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458797220 GBOJHROPKNVDFR-OIBXWCBGSA-N 375.516 5.084 30 20 GKED Cc1ccc(-c2csc(N(C(=O)CCCC#N)c3cc(C)ccc3C)n2)cc1 463100507 ZJSTWARYVNIFBX-UHFFFAOYSA-N 389.524 6.094 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc4ccsc34)n2)cc1 467838773 LBAAVSJUNYRPCW-QGZVFWFLSA-N 385.473 5.387 30 20 GKED O=C(Nc1cc(F)c(OC(F)F)cc1F)c1ccc(CCC(F)(F)F)cc1 468204532 IPCVDKWSKWUQLM-UHFFFAOYSA-N 395.274 5.313 30 20 GKED Cc1c([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cnn1C(C)(C)C 469202514 TUBQTPVFNOPAAQ-ZWKOTPCHSA-N 386.543 5.897 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1 476604196 TYLRROJJZDVJMT-NRFANRHFSA-N 383.495 5.633 30 20 GKED C=CCCC1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CC1 476694100 QMKMKJCYISROIR-UHFFFAOYSA-N 382.891 5.586 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2cccc(Cl)c2)C1=O 476808953 UUJYEPYMFQWGNL-HXUWFJFHSA-N 396.918 5.184 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)c(Cl)c1)c1nc2ccccc2s1 477864916 QVLBVVSYXAYKIY-SNVBAGLBSA-N 391.677 5.202 30 20 GKED C=CCCCC(=O)Nc1ccc(OC)c(OCc2ccc3ccccc3n2)c1 479645662 QEQUDIYGZHQNOE-UHFFFAOYSA-N 376.456 5.117 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc4c(Cl)cc(Cl)cc4[nH]3)CC2)cc1 480610739 KYPYAIIKPCKHRI-UHFFFAOYSA-N 396.277 5.276 30 20 GKED COCCSc1ccc([C@@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)cc1 481642366 HXATUZTWIWAOOS-UZUQRXQVSA-N 380.557 5.415 30 20 GKED CC(C)C(=O)Nc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 481964848 FVNQHTURNLAZJG-UHFFFAOYSA-N 399.450 5.197 30 20 GKED Cc1cc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)n(-c2ccccc2)n1 481969497 VFCOWCLZWBFZAY-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccc(CC)cc2)C1 484654934 PEGKDVHKXWUZEC-QHCPKHFHSA-N 392.543 5.706 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(F)cc(Br)c1 484764076 BCDZNSDCHLCHQC-GFCCVEGCSA-N 379.298 5.595 30 20 GKED Fc1ccc([C@@H](NCc2ccccc2OCC(F)(F)F)C(F)(F)F)cc1 484869352 XYPNPFSJPAVCIS-OAHLLOKOSA-N 381.291 5.160 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3ccc(C#N)s3)s2)cc1 487567613 BSRPCBWAXXTEHC-CQSZACIVSA-N 381.526 5.193 30 20 GKED CCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)oc1CC 487920747 XIAGUYYDZZIAQI-MRXNPFEDSA-N 380.469 5.027 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)ccc1C(F)(F)F 489735851 FIADNHDFXBMMKY-UHFFFAOYSA-N 395.812 5.675 30 20 GKED N#Cc1ccc(NC(=O)CCSc2ccccc2Br)c(Cl)c1 494576505 AUWKXRHOIPHPKK-UHFFFAOYSA-N 395.709 5.095 30 20 GKED CCN(C(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1)[C@H](C)c1ccc(C#N)cc1 499288931 WWODUEHKOQVERY-TXTKFYIRSA-N 384.564 5.623 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 503142596 WXNNQNXPTSMDJV-VQIMIIECSA-N 380.513 5.227 30 20 GKED COc1ccc(CNc2cc(C)ccc2Br)cc1OCCCC#N 503244219 KDDNEWMWMPUDLA-UHFFFAOYSA-N 389.293 5.061 30 20 GKED C=CCCc1ccccc1NC(=O)C(=O)Nc1cccc(COC(C)(C)C)c1C 504456745 UJEVMWOYUNWNRD-UHFFFAOYSA-N 394.515 5.006 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(Cl)c(OC(F)F)c2)c1 506991871 ZZUXATTXQIOESS-UHFFFAOYSA-N 395.793 5.268 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1 507808864 CDCOSJMAGBMVIL-UHFFFAOYSA-N 389.282 5.552 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(OC(F)(F)F)cc2)nnc1-c1ccco1 512518666 MAPXXICZPKMBDR-LBPRGKRZSA-N 395.406 5.476 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2F)c2ccccc2OC)cc1 512637698 YLHJESKFACSQLZ-UPCLLVRISA-N 390.458 5.155 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519988841 NQMCXIUEGPMWKN-UHFFFAOYSA-N 397.887 5.729 30 20 GKED C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 523970620 SMBISSGMKLNPGI-IVZQSRNASA-N 393.874 5.206 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)c(F)c2)CCC1 524059453 SCVCFGHBVUEQLC-UHFFFAOYSA-N 379.218 5.557 30 20 GKED N#Cc1ccc(OCc2ncc(-c3ccc(Br)cc3)o2)c(Cl)c1 525112043 KKABXKLENMUDPH-UHFFFAOYSA-N 389.636 5.208 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cc(F)ccc2Cl)cc1C 532312859 JCYNVKBXAHRUME-UHFFFAOYSA-N 396.853 5.125 30 20 GKED CCN(C(=O)c1ccc(CC#N)cc1)[C@@H](c1ccc(Cl)cc1)c1cccnc1 533949093 NHOSNYFAKRRCLE-QFIPXVFZSA-N 389.886 5.053 30 20 GKED COc1cc(C#N)ccc1NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 547415707 DVNYGKUUMTUORK-LLVKDONJSA-N 378.259 5.099 30 20 GKED N#CCCCn1cc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c2ccccc21 553296842 SQRRIKJRQQYOFQ-NIRIFSCTSA-N 397.522 5.353 30 20 GKED O=C(Nc1cccc(OC(F)(F)F)c1)c1c(F)cc(C(F)(F)F)cc1F 554967839 BWIDJAUVZAOBIT-UHFFFAOYSA-N 385.210 5.135 30 20 GKED N#Cc1ccc(C(=O)N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1Cl 557078167 DABGPJZMOMKUNZ-MRXNPFEDSA-N 392.808 5.250 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(-c2ccccc2)nc1C 557609245 RCGBPUMIHAJERG-UHFFFAOYSA-N 388.515 5.053 30 20 GKED Cc1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)c(Br)c1 566939945 JJZLSPSVDQCUGO-HNNXBMFYSA-N 382.261 5.048 30 20 GKED C[C@@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc([N+](=O)[O-])c1 574336957 CUWDJLSSEOSPLW-OAHLLOKOSA-N 387.395 5.001 30 20 GKED C=CCC[C@@H](Nc1ccc(Oc2ccnc(C(=O)NC)c2)c(F)c1)c1ccco1 577493374 BIAHWSJUDAJUJU-GOSISDBHSA-N 395.434 5.085 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Br 583038853 LBJGXSVWABQAQT-OAHLLOKOSA-N 397.297 5.371 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1sc2cccc(Cl)c2c1Cl 586818546 GDDBJRPKDPHBDQ-UHFFFAOYSA-N 376.268 5.374 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2ccc(OCC)cc2)c1 589740868 GODUHUUUAFDSDK-JOCHJYFZSA-N 380.488 5.409 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CC3(CCCC3)[C@@H]2c2ccco2)cc1C#N 596800962 MTRAPMTVCNZEII-FQEVSTJZSA-N 379.460 5.088 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccn1)C1CCC1 599736158 BKASSJYHNUVNRK-YWZLYKJASA-N 380.517 5.139 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(C3CC3)s2)cc1Cl 609164513 PQEPGWWBNOGMME-KRWDZBQOSA-N 393.899 5.582 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccccc2)s1)c1c(Cl)cccc1Cl 609287108 PTKDRORKJITVND-CQSZACIVSA-N 388.279 5.112 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)on1 609375557 QFHYSWQLVWDIAU-UHFFFAOYSA-N 383.860 5.253 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(C(F)(F)F)cc1 609377625 ZQSIRVQPBSUHHL-CYBMUJFWSA-N 378.419 5.138 30 20 GKED CCc1ccsc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378162 SOXKVJFAHRYKEW-UHFFFAOYSA-N 384.448 5.587 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-n2cccc2)c(F)c1 609382661 LJEIKEIAVSQBAB-OAHLLOKOSA-N 379.460 5.120 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(Sc3ccccc3)c2)c(F)c1 609398456 SNHVTLVKIZDTST-UHFFFAOYSA-N 377.444 5.170 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCSc4ccccc43)cc2)c1 610228146 MUEXVJPUPOHUKI-OAQYLSRUSA-N 386.476 5.569 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610323710 ANAJVJUNWYKZPP-MOPGFXCFSA-N 399.494 5.889 30 20 GKED C[C@@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1cccc(C#N)c1 610345002 PZZWQXBCLQPKBN-CQSZACIVSA-N 383.904 5.098 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 610355280 NBZAHYVRFMNIBD-JLTOFOAXSA-N 395.915 5.423 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)c(F)c1 611465408 KVKBOKVSDLYJNZ-QQUHWDOBSA-N 382.323 5.257 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4c(s3)CCCC4)n2)cc1 612941799 YTBVPTQCKKJDQI-MRXNPFEDSA-N 378.522 5.549 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 613291274 YUIOYZZMILRKHJ-JOCHJYFZSA-N 392.458 5.612 30 20 GKED CC(C)[C@@H](CNC(=O)c1c(Cl)cc(C#N)cc1Cl)Cc1ccccc1 615889484 KAWMAUUGWUOUDY-MRXNPFEDSA-N 375.299 5.110 30 20 GKED C=CCOc1c(Cl)cc(CN[C@](C)(CC)c2nc(C)cs2)cc1OC 623430162 DJKXJYJTEIOIEK-LJQANCHMSA-N 380.941 5.093 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1OC(C)C 656393395 LPHSUCSYYPQDJB-HNNXBMFYSA-N 396.512 5.180 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc2cc(F)ccc2s1 674045761 OITXNDBFIQUHGY-AWEZNQCLSA-N 378.384 5.311 30 20 GKED FC(F)(F)c1cscc1CN[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 685612722 YLCRPHFLXNCVTO-MYJAWHEDSA-N 399.322 5.766 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cccc(OC2CCCC2)c1 731288263 QZNUHMXZRDBZBE-JOCHJYFZSA-N 398.462 5.122 30 20 GKED CC(C)c1ocnc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 731992912 UWLAOBQFLAXNJG-UHFFFAOYSA-N 383.395 5.075 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N1CCC(c2nc(-c3ccccc3)cs2)CC1 732094660 RQGVZXGPFRLDPI-KHPPLWFESA-N 399.519 5.101 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNCc2ccc(Cl)cc2Cl)c1Cl 734745833 DWVNTIICQFMYIE-UHFFFAOYSA-N 393.705 5.171 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)/C=C\c2ccnc3ccccc23)c1 735439687 PZVVSYGFXVVOJL-SEYXRHQNSA-N 378.431 5.056 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc([N+](=O)[O-])cc1 740531243 NNMPLZRWXUNKKJ-AWEZNQCLSA-N 399.859 5.012 30 20 GKED CC(C)C[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 741111275 JIIJDLSLENRWKO-DLBZAZTESA-N 382.916 5.956 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1ccc(-c2ccccc2F)o1 741840894 GTJJCKJTYOHOGD-LUAWRHEFSA-N 384.378 5.146 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(SCC(F)F)cc2)c1 741846474 GLUMEKJICMVMGO-WDZFZDKYSA-N 387.451 5.622 30 20 GKED C=C(C)CNC(=S)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 741862116 LSUWPNBMJXISCH-UHFFFAOYSA-N 396.535 5.594 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccncc1 742075620 FREFFDQMXPOZOZ-HXUWFJFHSA-N 382.385 5.213 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(Cl)ccc2Br)c1 742709960 XLHLEHZRQFXYPY-INIZCTEOSA-N 393.712 5.073 30 20 GKED Cc1cc(C#N)ccc1COC(=O)c1ccccc1SCc1c(C)noc1C 748906144 HNJATBYQNAJDTE-UHFFFAOYSA-N 392.480 5.121 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(=O)oc2ccccc12 750610617 HTCLOWAXENBVFU-UHFFFAOYSA-N 396.402 5.018 30 20 GKED COc1cccc(/C(C)=C\C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 751829824 HIHORDRVFSIPCK-IYCSXQJISA-N 382.872 5.238 30 20 GKED CC(C)(C)SCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 754532816 YWJYSRNPMKPMTC-OAHLLOKOSA-N 392.977 5.952 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)C(F)(F)c1c(F)cccc1F 757054152 PJFFOVGAPAZJEV-UHFFFAOYSA-N 379.275 5.190 30 20 GKED N#Cc1cnc(NC(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)s1 759631448 GXQWGLMGUROAEX-UHFFFAOYSA-N 385.901 5.213 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2ccc(C(F)(F)F)s2)SC1=S 760990173 YNPPNDIVXPTLOY-GHXNOFRVSA-N 396.440 5.044 30 20 GKED COc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(C)cc4)sc32)cc1C#N 773086123 YPRZDHNNAFAYOB-LJQANCHMSA-N 389.524 5.166 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 773230355 HXRUJOFOGWAFBE-DEOSSOPVSA-N 398.506 5.909 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1sccc1Cl 782144350 YWTUPIBCMAJZIX-UHFFFAOYSA-N 385.901 5.031 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(OC(C)(C)C)cc2)cn1 792889025 CRIZWYJVKRQBHA-NTEUORMPSA-N 388.467 5.226 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(OC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 793577222 AJGIXMVDQFMXQE-UHFFFAOYSA-N 394.471 5.078 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(Cc3cccs3)CCCCC2)c1 810403021 LVSLWQRZWMTLNZ-LJQANCHMSA-N 396.556 5.238 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(CC)cc2)n1 821440213 YDUJTHYINLEALG-UHFFFAOYSA-N 386.517 5.036 30 20 GKED CC(C)CCO[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 854303904 RVGLJRFBABRJIN-PKTZIBPZSA-N 391.515 5.011 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086962 YTHAKRWKVLTYAM-LJQANCHMSA-N 399.475 5.619 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc4ccccc4c(Cl)n3)c2C#N)C1 915133624 RNKQETAISLWYNH-NSHDSACASA-N 381.888 5.198 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCSc3ccccc32)cc1 915350529 XPJAPCSMGPPMNP-YADHBBJMSA-N 399.519 5.701 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2ccc(Br)s2)cc1Cl 916154873 YOKPPTYGIBQNDV-HYXAFXHYSA-N 387.682 5.077 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc(OCC#N)cc1 916312368 UZKWHTPRHNFNDX-UHFFFAOYSA-N 399.479 5.097 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)CC(C)(C)C 916887132 LBNHYNBWNHDFJG-WFASDCNBSA-N 382.476 5.111 30 20 GKED N#C[C@H](C(=O)CSc1ccc2c(c1)CCC2)c1nc2cc(Cl)ccc2s1 917045824 ALRLPZDABNBUKC-MRXNPFEDSA-N 398.940 5.407 30 20 GKED N#C[C@@H](C(=O)Cc1cc2ccccc2o1)c1nc(-c2c(F)cccc2F)cs1 920806355 VQPNYPLCKJNXEW-AWEZNQCLSA-N 394.402 5.253 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccc(Cl)cc1Oc1ccc(F)c(Cl)c1 1776149435 UILHOXAZTDIKOT-CQSZACIVSA-N 398.261 5.434 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)cc1 1776215413 BOUVUCDRCXMJFL-HQAMWZJRSA-N 394.427 5.109 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C/c1ccc(-c2cccc(CC(=O)O)c2)cc1 1776665790 CVFYHOAGAFVIEI-HIQXPHMNSA-N 382.459 5.439 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2cccc(F)c2F)o1 1776782954 SAQPCHJBLALFFW-OAHLLOKOSA-N 379.447 5.518 30 20 GKED CCCCCCCOc1cccc(CN[C@H]2CCCc3cc(C(=O)O)ccc32)c1 1776787391 ZDQRHQQVQHHLMZ-DEOSSOPVSA-N 395.543 5.901 30 20 GKED CCCCCCCOc1cccc(/C=C\c2cc(C(=O)O)c3cnn(C)c3n2)c1 1776789236 XREUJFGNFCTXOG-QXMHVHEDSA-N 393.487 5.186 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C\c1ccc(OCc3occc3C(=O)O)cc1)C2=O 1777455890 KFEDXECVXYGHMN-RVZJCZPVSA-N 388.419 5.249 30 20 GKED Cc1ccc(C)c(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2ccccc2)c1 22729747 WVNLKHIXXVOQQR-UHFFFAOYSA-O 389.544 5.259 30 20 GKED COCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 41514887 YXGMHLJXYXIQKQ-KRWDZBQOSA-N 382.872 5.100 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]1c1ccccn1 56800464 XFMANLUNXKXPDG-HSZRJFAPSA-N 398.466 5.423 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3sc(C(C)C)nc3C)n2)cc1 66543569 REJBMNDSRYSJEA-HNNXBMFYSA-N 397.525 5.197 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 69572797 LNWAHJXGOCCCAS-BEFAXECRSA-N 393.874 5.813 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(F)c(F)c(F)c2)cc1 97548044 LOQUWWHEGAADME-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1c[nH]c2cc(Cl)ccc12 108239258 WQNAVGDZDWGGQW-ZDUSSCGKSA-N 383.904 5.254 30 20 GKED CCc1noc(C)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 120401137 OWVOIUHDWDFLMY-UHFFFAOYSA-N 381.819 5.115 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc(Cl)cc(Cl)c1 128674839 BWUYQOTUJHMDRQ-KRWDZBQOSA-N 383.234 5.108 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccccc3Oc3cccc(F)c3)o2)cc1 133461438 UMWPDMZOELQUTR-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(-c2cccs2)n1C1CC1 151286481 POUDZDIJNJPNRM-UHFFFAOYSA-N 380.542 5.435 30 20 GKED Cc1ccc(NCc2cccc(OCCCC#N)c2)cc1OCC1CCOCC1 153824370 DWXPDSREVWGEAX-UHFFFAOYSA-N 394.515 5.095 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 159985521 CAHMRRBALYQTNT-JXFKEZNVSA-N 379.529 5.480 30 20 GKED C[C@H](C#N)Oc1ccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc1 171563347 SSABMVXJAZPCGY-MRXNPFEDSA-N 378.422 5.135 30 20 GKED CCCOc1ccccc1Oc1ncccc1CN[C@@H](C)c1ccc(C#N)cc1 173958435 YOBFRPSYKWULBM-SFHVURJKSA-N 387.483 5.385 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(Cl)cc2)C2CC2)ccc1OC 180175221 WZGVIOHLSCFMFU-UGKGYDQZSA-N 384.907 5.270 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc(Cl)sc2Cl)ccc1OC 180812061 VUFRKMRBGVCRCE-DGCLKSJQSA-N 399.343 5.595 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1N1CCCCCC1 183626895 HJIKMEZIPOXASI-KRWDZBQOSA-N 378.476 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1nnc(-c2ccccc2)o1 189882014 NNJJCUHLMBGROP-UHFFFAOYSA-N 389.499 5.550 30 20 GKED Cc1cc(C[S@@](=O)CCCCC(C)(C)C#N)nc(-c2ccc(Cl)cc2)n1 277947840 QXYVLAFEGJNALL-SANMLTNESA-N 389.952 5.074 30 20 GKED OC(=Nc1cccc(C/N=C(/O)C2CCSCC2)c1)C1CCSCC1 329316072 BGPLMSQBAYCGIO-UHFFFAOYSA-N 378.563 5.018 30 20 GKED OC(=Nc1ccc2nc(C(F)F)sc2c1)N[C@H]1CCOC2(CCCCC2)C1 329467436 WOOMGOFNTYJVBX-ZDUSSCGKSA-N 395.475 5.251 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(C)cc2-c2nc3ccccc3[nH]2)cc1 409611488 JHDHKZBCGZXISW-UHFFFAOYSA-N 383.451 5.355 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)cc1 410401192 OEBWRUUENMYXBR-UHFFFAOYSA-N 396.796 5.335 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)C1(C(F)(F)F)CCCC1 415631590 QRJUTIUAFFXRSZ-UHFFFAOYSA-N 387.295 5.218 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ncccc3Cl)cc2Cl)cc1 428060113 SGMCEXGAKVEWCW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CCN(C(=O)Nc1cccc(C#Cc2ccccn2)c1)[C@H](C)Cc1ccsc1 429430219 AQYAJICGGDSBLE-GOSISDBHSA-N 389.524 5.028 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1cccc2c1CCO2 432071218 GSXPJABOFXKKSX-UHFFFAOYSA-N 399.450 5.025 30 20 GKED COCc1c(C(=O)Nc2ccc(OC(C)C)c(C#N)c2)sc2cccc(F)c12 435357514 KBORIRNMTRFJMO-UHFFFAOYSA-N 398.459 5.098 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(F)(F)F)c1 438561804 MKWQPRHPDMSNFA-RBUKOAKNSA-N 387.405 5.095 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2cc(F)ccc2F)cc1F 438667444 XQTJKKSLQUAFEU-UHFFFAOYSA-N 397.356 5.090 30 20 GKED C=CCOCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 443820941 HHOXIKZUWXNRSL-UHFFFAOYSA-N 394.540 6.067 30 20 GKED CC[C@H](NCc1cccc(NC(=O)c2cccc(F)c2)c1)c1ccc(C#N)cc1 447532092 UXUITJGDDWYXER-QHCPKHFHSA-N 387.458 5.191 30 20 GKED Cc1c(C(=O)N[C@]2(C#N)CCc3ccccc3C2)oc2c1ccc1ccccc12 472282743 XXBSHNNPHSIUIW-RUZDIDTESA-N 380.447 5.076 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccccc1 474435688 SLRICTDTQUOXFI-QFQXNSOFSA-N 394.474 5.726 30 20 GKED COCCCC[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccccc1 475348293 KTFRZRBLSZZWIO-OADZCNSWSA-N 376.544 5.538 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc2oc(CCOC)nc2c1 475553267 ODSGYOTXMZXPMN-UHFFFAOYSA-N 393.487 5.513 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccnc(O[C@H](C)CC)c1 475560820 JQSLGZCFSOGUMZ-QGZVFWFLSA-N 381.520 5.433 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 476119484 QLELFYCCLGBMAZ-WOJBJXKFSA-N 387.445 6.300 30 20 GKED COc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c(OC2CCCC2)c1 478898312 LJJCWEKFKPDOLO-UHFFFAOYSA-N 378.472 5.070 30 20 GKED CC[C@H]1[C@@H](C)CCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 480657151 DBESKJUJDDXVDV-AOMKIAJQSA-N 377.488 5.098 30 20 GKED Cc1nc2ccccc2n1C1CCN(c2ccc(C#N)cc2C(F)(F)F)CC1 480844139 JHMHWSCQIYUPHM-UHFFFAOYSA-N 384.405 5.077 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)o2)c(C)c1 483228311 MYNNAYSULWKCEL-NRFANRHFSA-N 396.446 5.514 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1nccc2ccccc12 483247750 YAFDBZMEGMUBDK-FQEVSTJZSA-N 381.410 5.290 30 20 GKED CO[C@H]1CCC[C@@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)C1 483488055 HCHRDCSMQZVONV-NQIIRXRSSA-N 396.918 5.340 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c1-c1ccccc1 488218520 LMDGLEIYIDEUEG-MRXNPFEDSA-N 386.480 5.231 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1CC2)c1nc2ccccc2s1 513653986 IKTPCJCBJPISFF-INIZCTEOSA-N 386.501 5.613 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1nc2ccccc2[nH]1 513682839 YYSROSZBRLBLQK-CQSZACIVSA-N 377.856 5.435 30 20 GKED CC(C)CN(C(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccc(C#N)cc1 514396490 LJGNFJDHTZTXNC-UHFFFAOYSA-N 388.492 5.482 30 20 GKED N#Cc1ccc(CSCc2csc(COc3ccc(Cl)cc3)n2)cc1 515723759 ZDRHWGBFKAFYRZ-UHFFFAOYSA-N 386.929 5.681 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 517531324 ASNAJBUWOHNDTC-SFHVURJKSA-N 381.545 5.771 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Br)ccc1F 518140094 OXDRAWCRZRLOFX-LLVKDONJSA-N 393.281 5.092 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2OC(C)(C)C1 518609743 MDOIYSVSLHNSDE-INIZCTEOSA-N 395.528 5.286 30 20 GKED Cc1[nH]c2c(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)cccc2c1C 520467173 FPVONWKTIAEWMS-UHFFFAOYSA-N 382.423 5.096 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F 525813878 XXRBXQRHOXFKED-HNNXBMFYSA-N 387.405 5.036 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccn2[C@@H](C)Cc2ccccc2)n1 536928002 CPAHKEMMIVBEHA-FUHWJXTLSA-N 377.513 5.362 30 20 GKED C[C@@H](SCC(=O)Nc1cc(C(C)(C)C)sc1C#N)c1nc2ccccc2[nH]1 538073710 JMVXMCBZOVQQKY-GFCCVEGCSA-N 398.557 5.226 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 538775674 ZPPHJSYWJVZRRX-FXAWDEMLSA-N 397.400 5.099 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)nn1C1CCCCC1 540642068 VOCANPKCYDYBEL-INIZCTEOSA-N 382.533 5.343 30 20 GKED N#CC1(c2ccc(C(=O)N(CCc3ccccc3F)C3CCCC3)cc2)CC1 540738786 BJXJJUZGLUIJAY-UHFFFAOYSA-N 376.475 5.008 30 20 GKED Cc1csc(-c2ccc(NC3CCN(Cc4ccc(C#N)cc4)CC3)cc2)n1 540973104 XMZRUMADEMJGJK-UHFFFAOYSA-N 388.540 5.067 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)C)s3)n2)cc1 545516167 RGBCSHHQYDUCRV-HNNXBMFYSA-N 382.510 5.494 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)c1ccccc1 569629079 KGSXORRYKAVCSA-NRFANRHFSA-N 389.499 5.472 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCC(=O)[C@@H](C)C1(C)C 573686982 ZWGCTVSBCFNEEG-UZLBHIALSA-N 390.483 5.239 30 20 GKED N#CCCC[C@H](NCc1cc(Br)ccc1Cl)c1ccccc1 575450043 MCUNMWQTXDVCKY-SFHVURJKSA-N 377.713 5.627 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H]1OCc2cc(Cl)ccc21 593975625 POJFVGIPZMUALF-ACJLOTCBSA-N 386.904 5.192 30 20 GKED N#Cc1cccc(C2(NCc3ccc(-c4cccc(F)c4)s3)CCOCC2)c1 594985077 VMNBWCJGGVSDHK-UHFFFAOYSA-N 392.499 5.221 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1 596735840 QYFZGOJFSBRPPI-JXFKEZNVSA-N 395.528 5.823 30 20 GKED CC(C)(CC(F)(F)F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 597120679 JESKNWIIMIGJOE-UHFFFAOYSA-N 376.378 5.054 30 20 GKED C[C@@H](Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cccc(C#N)c1 600849352 OSROKDPQFAFJIK-CYBMUJFWSA-N 384.266 6.225 30 20 GKED Cc1cccc(S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 603778259 RFVJYDUNYKVYDV-FQEVSTJZSA-N 396.899 5.105 30 20 GKED Cc1c(C(=O)Nc2cccc(OCCCC#N)c2)oc2c1ccc1ccccc12 603969507 AURKWBSMVJDTTR-UHFFFAOYSA-N 384.435 5.829 30 20 GKED C[C@H](CC#N)NC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 609306276 JRBVYJOFOHIMTJ-PXAZEXFGSA-N 379.312 5.245 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccc(C(F)(F)F)cc2)c1 609432868 XKDOTMGNCYOQHH-UHFFFAOYSA-N 396.412 5.446 30 20 GKED N#Cc1ccc(OCc2ncc(-c3ccccc3Br)o2)c(Cl)c1 610217511 SNSBPPRLSAPIKE-UHFFFAOYSA-N 389.636 5.208 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC(C1CC1)C1CC1 610322726 IQIFQVUBZUAMES-UHFFFAOYSA-N 375.472 5.217 30 20 GKED CC(C)C[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 611250927 OSVJWVATAFXUFX-CQSZACIVSA-N 384.526 5.455 30 20 GKED CSc1nc(NC(CCC(F)(F)F)CCC(F)(F)F)cc(C(F)F)n1 664469312 IFFVYZZNQDJXPK-UHFFFAOYSA-N 397.335 5.602 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3[nH]c(-c4ccco4)nc3c2)cc1Cl 726472973 FRSQPWUETCZBDC-UHFFFAOYSA-N 393.859 5.157 30 20 GKED Cc1ccc(-c2cc(CON=Cc3cccc(OCc4ccncc4)c3)on2)cc1 727434304 JPNZIFPOFBOHGH-UHFFFAOYSA-N 399.450 5.175 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ncoc2-c2ccccc2)cc1 732536249 HADWKYIUFIKMIK-NRFANRHFSA-N 379.419 5.249 30 20 GKED C#CC[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1ccccn1 733693462 ZCDCEEOIMRQIEF-OYRHQHFDSA-N 397.474 5.072 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)CC/C1=C/c1cccc([N+](=O)[O-])c1 743056065 BTAJWIPILGWFFX-BKHHGCLFSA-N 399.406 5.007 30 20 GKED N#CCOc1cccc(NC(=O)[C@@H](Oc2ccc(Cl)cc2)c2ccccc2)c1 743629570 WBQQMVXJHKAJGC-NRFANRHFSA-N 392.842 5.001 30 20 GKED COc1cccc(/C=C\C(=O)c2cc(Cl)sc2Cl)c1OC(F)F 744865798 LQAUHUUWKKFCEK-WAYWQWQTSA-N 379.211 5.561 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(C(C)(C)C)nc2C)cc1 747111618 HMKXXALLZCIONJ-KRWDZBQOSA-N 397.544 5.053 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1C 747117724 UOXLGIIYXANWPI-KRWDZBQOSA-N 382.460 5.088 30 20 GKED N#Cc1ccccc1N1CCC(NC(=O)c2ccc(C3CCCCC3)cc2)CC1 747335810 HRKIOMXJQWWTOA-UHFFFAOYSA-N 387.527 5.005 30 20 GKED Cc1cccc(-c2nn(CN(CC#N)C3CC3)c(=S)n2[C@H]2CCCC[C@@H]2C)c1 747789457 YHFBEJWGZGDWOC-PXNSSMCTSA-N 395.576 5.086 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H](C)c1ccc2ccccc2c1 753396977 WWYGNXLUBBRRMB-GAJHUEQPSA-N 398.506 5.416 30 20 GKED FC(F)(F)c1ccc(C#CCSc2nnc(-c3c[nH]c4ccccc34)o2)cc1 754269058 NVNSILYMILORIN-UHFFFAOYSA-N 399.397 5.381 30 20 GKED C[C@H](Cc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 756518060 SRNHITHJPKQJKR-KDOFPFPSSA-N 380.900 5.519 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@H]4CCCC[C@@H]4C3)n2)cc1 756530163 SSUAWSPVNBDBMZ-VBSBHUPXSA-N 389.524 5.465 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(C3CCC3)s2)ccc1SC(F)F 760264702 MAERROMTXBVIJP-VOTSOKGWSA-N 381.469 5.630 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)Nc2ccc(F)cc2OCC#N)cc1 761665915 YANHLNSXVCWPCB-AWEZNQCLSA-N 387.480 5.111 30 20 GKED C[C@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1ccc(C#N)cc1 761713491 SKFBTDOPRGYEBD-NJPLLEPOSA-N 378.781 5.035 30 20 GKED Cc1nc([C@@H](C)OC(=O)CCc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 763909569 PYSMNEBZAPFPFC-OAHLLOKOSA-N 394.858 5.412 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCc3c2sc2ccccc32)c1 772983404 HMEDITOEXGDGRZ-UTKZUKDTSA-N 376.525 5.749 30 20 GKED CCC[C@H](NCc1ccc(OC)c(O[C@@H](C#N)CC)c1)c1ccc(Cl)cc1 772987926 ZRYIKMUVFCLRQJ-UXHICEINSA-N 386.923 5.661 30 20 GKED CC(C)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776156944 OTRBSDOEMKJRRB-YWZLYKJASA-N 376.422 5.656 30 20 GKED CCCCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@@H](CC)c1ccccc1 780676218 ZZPHXAWCMWTEIY-RXVVDRJESA-N 379.504 5.763 30 20 GKED CC1(C#N)CCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)CC1 780779353 YVWSYNQSHFHOIN-UHFFFAOYSA-N 389.886 5.321 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCCS1)c1nc(-c2ccc(Cl)cc2Cl)cs1 783354702 GHBVDNZMGWOTKC-DOMZBBRYSA-N 397.352 5.579 30 20 GKED CCCn1c(C(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc2ccccc21 786925866 JGYQNIDNUJZRSR-GOSISDBHSA-N 383.451 5.046 30 20 GKED CC(C)Oc1ccc([C@@H]2CCCC2=NNc2nnc(-c3ccccn3)s2)cc1 788028561 NFLBDYKMDIZPFP-KRWDZBQOSA-N 393.516 5.123 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)c2ccc(OC(F)(F)F)cc2)n1 789393407 UAYNQWQCPQJRTN-AWEZNQCLSA-N 396.434 5.319 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@H](Oc2ccccc2)c2ccccc2)s1 797571374 OCAGPVDZGJBEFY-WIYYLYMNSA-N 390.508 5.437 30 20 GKED N#CCc1ccccc1CC(=O)N1CCC(c2c(Cl)cccc2Cl)CC1 808437641 SUNHPDFHTUGETI-UHFFFAOYSA-N 387.310 5.008 30 20 GKED COCc1nc(Cl)cc(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)n1 814979507 QVJKGZMUOKDAKO-CYBMUJFWSA-N 398.816 5.031 30 20 GKED COc1ccc(CNc2ccc(OC)c3ccccc23)cc1OCCCC#N 858277621 JTXNTVCLOKZKBO-UHFFFAOYSA-N 376.456 5.152 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(C2CCCCC2)cc1 916884190 ZVODRXIROUAJHL-HXUWFJFHSA-N 380.875 5.349 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=S)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 920994340 QKUBNOIMFQRLNW-JTSKRJEESA-N 395.547 5.153 30 20 GKED O=C(O)c1ccccc1NN=Cc1cc(F)ccc1Oc1cccc(Cl)c1 1776031181 RDKAEHBUTPVBIY-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NN1CCCC[C@@H]1C 1776091302 FZHICTOWSIDGSD-IBGZPJMESA-N 394.515 5.147 30 20 GKED CC(C)CCOc1ccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)cc1 1776326947 HJGLWGHHEITYHC-AUWJEWJLSA-N 396.483 5.251 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)c(Cl)c1 1777353285 OXTXXFDGTIHTBP-JYRVWZFOSA-N 392.838 5.610 30 20 GKED O=C1/C(=C/c2ccccc2OC2CCCCC2)C[C@@H](C(=O)O)c2ccccc21 1777698152 NZNAPNYAXKAFPQ-PVGBUVFQSA-N 376.452 5.236 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 63960591 CIWNYCPWXCSTCQ-UHFFFAOYSA-N 375.042 5.128 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3coc(-c4ccccc4)n3)cc2)cc1 66037473 VJJXUDAZNWIZRU-UHFFFAOYSA-N 395.418 5.187 30 20 GKED CCOc1cccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66954726 KCISPPUCLGMBAG-JKSUJKDBSA-N 383.517 5.362 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C/c1ccc2ccc(Cl)cc2n1 108201621 UFOUWUWGHAHSAU-ZHACJKMWSA-N 393.899 5.546 30 20 GKED COc1cc(Cl)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1OC 156465689 BVMQJFORJQUOKN-UHFFFAOYSA-N 398.871 5.210 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Cl)cc1-c1nc(CC(C)C)no1 156506715 WXFMKYQDLZKCFH-UHFFFAOYSA-N 394.862 5.021 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)Nc3cccc(OCCCC#N)c3)c2)n1 158236844 SQYNDXWLDNSYOX-UHFFFAOYSA-N 390.443 5.285 30 20 GKED CC(C)OC1CCC(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 162463048 CISYWWDBEFTGCK-UHFFFAOYSA-N 393.487 5.208 30 20 GKED CSc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 170974777 HISXKWCMYRYGQO-UHFFFAOYSA-N 396.459 5.685 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC(c2c[nH]c3ccccc23)CC1 171142062 OYNSNJVIPDPMQB-UHFFFAOYSA-N 389.503 5.008 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC3(CCCC3)C2)cc1 175374558 QBXVIYNKGQIION-UHFFFAOYSA-N 389.499 5.130 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)ccc2c1 177767380 MHPSPTROMVQBCQ-IFXJQAMLSA-N 378.497 5.408 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(Cl)nc2)cs1 179411385 KRFZHARHRABVED-RMKNXTFCSA-N 397.887 5.081 30 20 GKED COc1cc([C@H](C)Nc2cccc(OCCCC#N)c2)ccc1SC(F)F 179818471 SORXWYQAGGUEHD-AWEZNQCLSA-N 392.471 5.866 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2cccc(F)c2)CCOCC1 191430303 GAGRMBKYOKUKND-UHFFFAOYSA-N 396.506 5.505 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)c(F)c2)nnc1-c1ccccc1F 195593710 RQDDYEAEANNAJA-LBPRGKRZSA-N 375.419 5.402 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)c(F)c1 195695858 SQQPWFQILIOXSW-NRFANRHFSA-N 395.275 5.339 30 20 GKED CN(Cc1cccc(F)c1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 301218855 UNOZCYQQSRBEDB-UHFFFAOYSA-N 390.483 5.262 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 302758411 VHRAUGKEUBZVFY-MRXNPFEDSA-N 382.872 5.271 30 20 GKED OC(=Nc1ccc2oc(C(F)(F)F)nc2c1)C1CCC(/N=C(/O)C2CC2)CC1 330005747 CEMAFUHCWHHKFR-UHFFFAOYSA-N 395.381 5.360 30 20 GKED C[C@H]1CCCCN(C(O)=Nc2cccc(C(O)=Nc3ccc(Cl)cn3)c2)C1 330101042 HXNOWQRDLKGXQQ-AWEZNQCLSA-N 386.883 5.039 30 20 GKED CN(C(=O)c1cnn(CCC#N)c1-c1ccccc1)c1cc(Cl)cc(Cl)c1 428743361 KBJSNHBSRMUOBG-UHFFFAOYSA-N 399.281 5.047 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3nc(-c4ccccc4F)no3)c2)cc1 435893033 KCNWINKWZDJKSY-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CC1(C)[C@H]2CN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)c(Cl)c3)C[C@@H]21 437900552 ZSJSYBLCKAOSRF-IRXDYDNUSA-N 381.863 5.124 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 437919323 YSEVIGUTTVZHOZ-OAHLLOKOSA-N 381.907 5.899 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NCC1CCC(C#N)CC1 440972199 KQWMDDRPMDXENL-XEVCZEQESA-N 391.515 5.587 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(-c3cncs3)no2)c1 445601168 PHRRIARWRDNNMX-UHFFFAOYSA-N 380.816 5.177 30 20 GKED CCc1nc(C)c([C@H](C)N(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)s1 458808247 YRQYWXWGFVEFIZ-WMZOPIPTSA-N 384.549 5.152 30 20 GKED Fc1ccc(CN2CC[C@H](C(F)(F)F)C3(CCOCC3)C2)c(C(F)(F)F)c1 459646970 JDTBFJYBJJKTDQ-HNNXBMFYSA-N 399.350 5.026 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)cc1 464174511 LPNQNLKTRFEFSJ-UHFFFAOYSA-N 395.871 5.130 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SC[C@@H]1CCC2(CCCCC2)O1 466429311 XGOVDCWWRAIMTB-IBGZPJMESA-N 399.560 5.017 30 20 GKED C[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467466348 JEWXLNKJCXFOAB-HUUCEWRRSA-N 383.879 5.195 30 20 GKED Cc1c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cccc1C(F)(F)F 473829295 LAROLHQWSSIOSH-VQIMIIECSA-N 387.405 5.318 30 20 GKED N#CCC[C@@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccccc1 474884570 AQBVPSANYJTSHP-QGZVFWFLSA-N 397.238 5.603 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-c4ccccc4)[nH]3)n2)cc1 477844980 NFBIVSUOYHZIRH-GOSISDBHSA-N 399.475 5.304 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F 482396287 LPMGYEYQEOVDOM-OAHLLOKOSA-N 390.377 5.028 30 20 GKED CCOc1ccc(-c2nc(CC)c(C(=O)[C@H](C#N)c3nc(C)cs3)s2)cc1 483431821 MYCDSJBDAULCLN-HNNXBMFYSA-N 397.525 5.026 30 20 GKED CC[C@H](C)CN(CC)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 483624438 NSLFDONRQWAQOI-KRWDZBQOSA-N 379.504 5.346 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1 494020678 ODCSVAYHISQDSP-VQTJNVASSA-N 376.843 5.142 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nnc(-c3ccc(F)cc3)c3ccccc23)cc1 494168504 OATVDVRDTUPFEA-HXUWFJFHSA-N 399.494 5.971 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)Nc1ccccc1SCCC#N 497692270 SRTASOWOYUNKLI-UHFFFAOYSA-N 392.480 5.131 30 20 GKED Cc1nc(NC(=O)CCCSc2ccc(Cl)cc2)sc1SCC#N 504682909 AHJCTZQZAGCBEP-UHFFFAOYSA-N 397.978 5.232 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cccc(F)c1)C[C@@H]1CCCO1 505035138 JXGHMKOQZZPAAZ-NRFANRHFSA-N 382.479 5.157 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCc2nc3ccccc3o2)cc1 507892621 KHYZZWSWKOABOI-UHFFFAOYSA-N 383.407 5.063 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C 512506703 OXRATCCYRREWHE-FQEVSTJZSA-N 396.579 5.301 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)cc1 512900703 DRKURTYBXPMTMI-LJQANCHMSA-N 383.373 5.331 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@@H]1N[C@H]1CCc2ccc(C#N)cc21 515924636 HIVUVLTUQBWGIJ-CCMJGWDWSA-N 399.357 5.381 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1ccc(Cl)c(Cl)c1 518849183 RHCASROOLHZOCG-INIZCTEOSA-N 389.213 5.387 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519052690 APIAHFSOBLBOCX-XMMPIXPASA-N 397.478 6.028 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 520855261 GKMZRCPQIFCACH-QRWLVFNGSA-N 399.535 5.986 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1F 520923428 MPETWNXFPFRUED-QRWLVFNGSA-N 392.861 5.877 30 20 GKED CCc1nc2cc(NC(=O)c3cccc(COc4ccc(C#N)cc4)c3)ccc2o1 524526345 AUUHYHITDCWZKI-UHFFFAOYSA-N 397.434 5.093 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@@H](c2ccccc2)c2ccc(F)cc2)n1 525111052 FYVIARHLOLARBO-FQEVSTJZSA-N 392.455 5.151 30 20 GKED Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 537059947 HIVAEZJUHAKXTR-JPYJTQIMSA-N 395.572 5.315 30 20 GKED CC[C@@H](NCC(=O)N(CCC#N)c1cccc(Cl)c1)c1ccc(Cl)s1 541628281 ADBMNVXLYRTGAY-OAHLLOKOSA-N 396.343 5.042 30 20 GKED COC[C@@H](C#N)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 542189270 HTTUPRPQNIDOPB-GGAORHGYSA-N 395.506 5.095 30 20 GKED CC(C)[C@@H](Oc1ccccc1C#N)C(=O)Nc1cccc(C(F)F)c1Cl 543502630 BQRSKWFAZKCPBP-QGZVFWFLSA-N 378.806 5.191 30 20 GKED CC[C@H](CC#N)NC(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 545861892 VPFYUCMLTDVNBC-KDOFPFPSSA-N 376.884 5.121 30 20 GKED CN(C(=O)c1ccc(NCc2ccc(F)c(C#N)c2Cl)cc1)C1CCCCC1 556618030 UUMUOJKKNCRFRZ-UHFFFAOYSA-N 399.897 5.368 30 20 GKED N#CC[C@H](CC(=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1)c1ccccc1 558115485 AIXRIRHESVNEAJ-YLJYHZDGSA-N 384.932 5.121 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2cccc(Cl)c12)c1ccc(Cl)c(Cl)c1 559700253 JCJUHUCCPRKUTB-INIZCTEOSA-N 392.673 5.052 30 20 GKED N#Cc1ccc(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c(C(F)(F)F)c1 562206482 DCOJRYDBDAATRD-OAHLLOKOSA-N 376.344 5.132 30 20 GKED COc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c(Br)c1 565882744 FZZUWZGMKJHWCD-MGPUTAFESA-N 387.321 5.543 30 20 GKED COc1cc([C@H](C)N[C@H]2CCc3ccc(C#N)cc32)ccc1OCCC(C)C 580015917 IKEMHCOCQWOZQF-JTSKRJEESA-N 378.516 5.330 30 20 GKED CCCOc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)cc1OC 580015934 JCSAKMFRRHBYAS-UHFFFAOYSA-N 389.455 5.155 30 20 GKED COc1ccc([C@H](C)N[C@@H](C#N)c2ccc(Cl)cc2)cc1Br 585718988 GPAQPXFMQLTHDG-ZBEGNZNMSA-N 379.685 5.027 30 20 GKED COc1ccc(/C=C(/C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1F 588447776 XZVSDSISYRDLFX-QXSWTLKVSA-N 392.455 5.238 30 20 GKED O=C(CCc1ccc(OC(F)(F)F)cc1)Nc1ccc(F)cc1C(F)(F)F 590252839 CQQDLXRQTGHMFO-UHFFFAOYSA-N 395.274 5.314 30 20 GKED CC(C)(CC(F)(F)F)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 596828256 UFVGNMCKYNUVKI-UHFFFAOYSA-N 390.405 5.249 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCc3c(CC#N)cccc3C2)c(C)c1 599730125 MTEWJARVRXUBKP-KRWDZBQOSA-N 393.556 5.542 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(C2CC2)[C@@H](C)c2ccc(Cl)cc2)cc1 605412075 JQXQAVJFEVMQRG-HNNXBMFYSA-N 397.906 5.013 30 20 GKED Cc1ccc(OCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 609378339 FOXACNXSWDGCES-UHFFFAOYSA-N 394.418 5.037 30 20 GKED N#CCn1c(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc2ccccc21 609381365 FPUVIOWRVAIBBG-JOCHJYFZSA-N 382.467 5.014 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[C@H](C)c1cccnc1 609651759 GONPDBGTCOUROX-GOSISDBHSA-N 385.467 5.163 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1cc2ccccc2n1CC#N)c1ccccc1 609652382 SZHLQILUUYHSSR-GOSISDBHSA-N 395.462 5.557 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3nc4ccsc4s3)c2)cc1 609795453 YTUKBKAIIARLBT-UHFFFAOYSA-N 391.477 5.061 30 20 GKED C[C@H](CC(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccc(C(F)(F)F)c1 609970519 NPRSTXRBBLCJNV-LLVKDONJSA-N 398.331 5.311 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(CCC(F)(F)F)c2)cc1Cl 619789698 OHOGWHIDCHOWMO-UHFFFAOYSA-N 381.785 5.028 30 20 GKED Fc1ccc(C(F)(F)F)c(-c2noc([C@@H](C[C@@H]3CCCO3)C(F)(F)F)n2)c1 650535537 YALLXGNQVVVZCO-JOYOIKCWSA-N 398.278 5.110 30 20 GKED O=C(Nc1c(F)cccc1F)NC(CCC(F)(F)F)CCC(F)(F)F 665155317 QLVXBVPKUQAHED-UHFFFAOYSA-N 378.263 5.140 30 20 GKED COc1ccc(C2(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)CCC2)cc1 726322093 FWJINBOCMSVQDM-INIZCTEOSA-N 396.899 5.256 30 20 GKED CC(C)CC[C@@H](NC(=O)NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 727844778 MCUKOVUBULDCSP-OAQYLSRUSA-N 399.922 5.219 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cnc(Cl)c(Cl)c3)c2)cc1 729375710 RUUKVXLPINMOGK-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(F)ccc1C(=O)/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1 731320900 BQSSCIKMURSFQD-XFXZXTDPSA-N 393.845 5.936 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3ccccc3C)CCCCC2)c1 733774793 KVAZKKNVMLDYRU-NRFANRHFSA-N 390.527 5.194 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cccc(Nc2ccccc2)c1 733958192 XFPICGCUBORJLF-UHFFFAOYSA-N 382.423 5.246 30 20 GKED CC[C@@H](NC(=S)Nc1ccccc1Oc1ncccc1C#N)c1cccs1 734375230 SXZNFWSIUUPXBU-OAHLLOKOSA-N 394.525 5.245 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 739143927 TYGFTYVIONHWMB-SWLSCSKDSA-N 388.414 5.685 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cnc(-c4ccccc4)s3)c2)s1 740012119 WYPDFQKCJSZHPK-UHFFFAOYSA-N 387.533 5.700 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)cc1 741537819 HTNFNCWIMHXBJV-NJDAHSKKSA-N 388.417 5.362 30 20 GKED COc1ccccc1[C@H](C)S[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1 742455097 JRQHUARWCKLSNX-ZWKOTPCHSA-N 382.529 5.133 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3ccc(Oc4cnccn4)cc3)c(C)c2c1 743055636 HQFYZQPNFSOMTH-WEVVVXLNSA-N 386.407 5.228 30 20 GKED CSC(C)(C)CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 743117373 UWXDTHRUPSJXFA-UHFFFAOYSA-N 389.908 5.267 30 20 GKED C=CCN(C(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1)C(C)C 745902942 BKMUOMCNNSYLDY-FQEVSTJZSA-N 390.499 5.382 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1 753145309 YHQHZEUSSPNFFL-KHPPLWFESA-N 398.487 5.777 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C(C)=C\c1ccccc1Cl 756507584 DYJBWGYGYRBNTO-RXHHAWBHSA-N 394.902 5.216 30 20 GKED C#CC[C@@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccccc1 757621568 HAEXFAGMJMMRFB-HXUWFJFHSA-N 396.918 5.209 30 20 GKED C#CC[C@H](NC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 757778018 LNZMLXZFBFEGQK-QFIPXVFZSA-N 398.466 5.217 30 20 GKED O=C1/C(=C\c2nc(Cl)cs2)CCc2nc(-c3ccccc3F)sc21 759084780 QVADDOVZKNNPKG-CLFYSBASSA-N 376.865 5.272 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C2(c3c(Cl)cccc3Cl)CC2)n1 759563050 UCGPKDJHLWDEJR-LLVKDONJSA-N 379.312 5.481 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@@H]1/C=C/c1ccccc1 761674449 TUENAMKXVZFSGF-ZAHGZRRWSA-N 393.462 5.218 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 764873030 IDKJOVASFPUBPG-CYBMUJFWSA-N 376.378 5.070 30 20 GKED C=CCc1cc(CN[C@H](C)c2cccc(-c3ccncc3)c2)cc(OC)c1OC 772947499 TWMWHCNHEAERGW-GOSISDBHSA-N 388.511 5.345 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3oc(C)c(C)c3c2)c1 775884637 PJPIFTBFUAWWCR-SFHVURJKSA-N 377.444 5.052 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(Oc2ccc(Cl)cc2)cn1 777490897 SKBVKAUCQTWLPQ-UHFFFAOYSA-N 380.860 5.208 30 20 GKED CN(C(=O)c1ccccc1SCC#N)c1ccc(OCc2ccccc2)cc1 781696169 BCLISDOWYOCMNW-UHFFFAOYSA-N 388.492 5.158 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1c[nH]c2ccccc12 786325853 WLOIDQGMAIDMEC-HIFRSBDPSA-N 392.409 5.283 30 20 GKED N#Cc1cc(F)ccc1CN[C@@H](c1c[nH]c2ccccc12)C(Cl)(Cl)Cl 796470903 NCZDSDFZZLNTMA-KRWDZBQOSA-N 396.680 5.380 30 20 GKED Cc1c(C(=O)O[C@H](C)c2nnc(-c3cccs3)o2)sc2ccc(C#N)cc12 796610715 MHNKYOOSHIPIIQ-LLVKDONJSA-N 395.465 5.111 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3[C@@H](C)[C@H]3c3ccccc3)n2)cc1 797551300 NBWVHVPTKFRXMV-FCEUTRGCSA-N 388.492 5.045 30 20 GKED CC(C)(C)c1ncc(/C=C2/CCC/C(=C\c3cnc(C(C)(C)C)nc3)C2=O)cn1 806565893 UTRBMMWSASPCLM-OMYAATJGSA-N 390.531 5.082 30 20 GKED N#C[C@@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1cc(C(F)(F)F)ccn1 813216823 ZZMFETJIZCBSLX-LLVKDONJSA-N 399.199 5.315 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@H](c2ccccc2)C(F)F)c1C(F)F 813313637 YIHHNRDGKOOARZ-LLVKDONJSA-N 398.278 5.023 30 20 GKED N#C[C@H](C(=O)C1(c2c(F)cccc2F)CCC1)c1nc2cc(F)ccc2s1 817716200 JCTAOXDBKWXQFH-GFCCVEGCSA-N 386.398 5.012 30 20 GKED N#Cc1ccc(C(=O)CSc2ncc(-c3ccccc3)n2Cc2ccco2)cc1 829425149 AXIPWZRTGZSQJS-UHFFFAOYSA-N 399.475 5.038 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@@H]2C 839388599 KKZKEBIMSCPVLJ-MNOVXSKESA-N 390.940 5.068 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@H]1Cc1ccccc1)c1nc(-c2ccncc2)cs1 850791586 VZKGZAHEGBTFIC-XUVXKRRUSA-N 387.508 5.040 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc2cnccc2o1 878675375 FTLYNXOKUPQWIK-KGLIPLIRSA-N 380.473 5.105 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1ccc(NC(=O)NC2CC2)cc1 915049033 PAPYCMVJZQHGSC-UHFFFAOYSA-N 393.878 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 915085984 GQXMBWGSEVXIMH-IBGZPJMESA-N 391.814 5.156 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(F)c(Br)c1 915987056 PMSQDDIUQRGZSD-ALCCZGGFSA-N 389.249 5.003 30 20 GKED CCCCCCOc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)cc1 916910499 RRNFBPMSPNWCEQ-GOSISDBHSA-N 398.890 5.260 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916997292 UZUXOACOFBGPLG-CXOKCQFOSA-N 399.302 6.007 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 918034483 QSAIKRMWZJSZNS-CJFMBICVSA-N 397.522 6.184 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)CCc1ccc(-c2ccccc2)[nH]1 919985542 JMENEJQFYIYSDF-UHFFFAOYSA-N 394.858 5.144 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NN[C@H](C)c1ccc(C(C)C)cc1 1776106321 ZWFCGKVBOOIBNO-RTBURBONSA-N 396.531 5.321 30 20 GKED O=C(O)COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cc1Cl 1776131511 SUILDZMKZZKELF-SDQBBNPISA-N 392.838 5.367 30 20 GKED C=CCOc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1Cl 1776183933 KPMRORIHUPOBHU-WJDWOHSUSA-N 382.843 5.206 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Oc2cccnc2)c(C)c1 1776784713 LRVXDUVGKACGRY-HXUWFJFHSA-N 384.520 5.476 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cnc(-c2c(F)cccc2F)s1 1776785659 OWUCFULUFQNQEY-CQSZACIVSA-N 396.503 5.382 30 20 GKED O=C(O)c1ccc2scc(/C=C3/CSc4c(Cl)cccc4C3=O)c2c1 1777685578 NMBXIJJBQHNHKV-SDQBBNPISA-N 386.881 5.625 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3c[nH]c(C)c3)cc2)CCC1 1788817990 QVGQVOYZEBYKJQ-UHFFFAOYSA-N 393.531 5.063 30 20 GKED Cc1ccc[n+](/C(C(=O)c2cccc(Cl)c2)=C(/S)Nc2ccccc2F)c1 6504160 KESWPLSITXMQBU-UHFFFAOYSA-O 399.898 5.126 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)N2CCC[C@H]2c2cccs2)nc2ccccc21 22351787 WNPBIKGPMLYVLI-YJBOKZPZSA-N 397.569 5.128 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1ccoc1C 36852363 JLGBHBGYFNEALQ-UHFFFAOYSA-N 384.486 5.041 30 20 GKED N#C[C@@H](C(=O)COc1cc(Cl)c(Cl)cc1Cl)c1nc2ccccc2o1 41545139 FFWWJJPJSJTMNZ-VIFPVBQESA-N 395.629 5.043 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2SCCCS2)cc1 45404155 TXGMZBGNOZSJOR-UHFFFAOYSA-N 396.581 5.479 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c1 51656064 IOYPGFWWOWLTRQ-YOEHRIQHSA-N 397.425 5.199 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1c(C(C)C)cccc1C(C)C 63388589 UVPXCRONGVWXIB-UHFFFAOYSA-N 395.503 6.062 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1csc(-c2ccc(C)cc2C)n1 63947219 SZZWTTZRENGUBL-UHFFFAOYSA-N 387.508 5.127 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 108407676 VVXQCZLZXCYCAY-UKRRQHHQSA-N 387.936 5.339 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccc(Oc4cccc(C#N)c4)cc3)o2)cc1 109014022 TWUNQQQGFWMGCD-KRWDZBQOSA-N 396.450 5.882 30 20 GKED Cc1ccc(C[C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccn2)cc1 115851407 OKKUFHJUAIEHHF-QHCPKHFHSA-N 398.510 5.297 30 20 GKED Cc1cccc(F)c1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 133589161 WYHAMYITTHUZCP-UHFFFAOYSA-N 391.421 5.379 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2ccccc2C(C)(C)C)cc1C#N 154546771 ZRVYIRPTRMEVGF-UHFFFAOYSA-N 380.448 5.068 30 20 GKED Cc1c(CSC(C)C)cccc1NCC(=O)Nc1ccccc1SCC#N 172927748 PXEHXUDEVACHLA-UHFFFAOYSA-N 399.585 5.303 30 20 GKED CC(C)[C@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 178392128 MVBKQJKHXHVMBW-AOMKIAJQSA-N 399.535 5.145 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N4CCC(C#N)CC4)cc3C2)cc1 179654018 KKTVZCJCLQQKCE-UHFFFAOYSA-N 388.515 5.098 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1NCc1ccc(NC(=O)c2ccco2)cc1 301609842 BRRAVPDQURWONM-UHFFFAOYSA-N 385.345 5.034 30 20 GKED COc1ccccc1C1(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)CC1 329338782 NHGNCIPXUCSLHA-IBGZPJMESA-N 379.504 5.073 30 20 GKED COc1c(Cl)cc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cc1Cl 329988640 HIRCITPXYPUPHA-UHFFFAOYSA-N 385.291 5.515 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N(C)Cc2ccc(C#N)cc2)c1C 428755872 DIWMVFXMURQPFN-UHFFFAOYSA-N 379.504 5.236 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cn(CCCC#N)c3ccccc23)s1 430603271 JPUAFIUAXHUIPO-MRXNPFEDSA-N 390.512 5.189 30 20 GKED CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)NCC1(CC#N)CC1 431109227 CTQOESJVAOSTNC-UHFFFAOYSA-N 385.508 5.168 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2c1 435480210 FSBSTEICSBECBX-QGZVFWFLSA-N 383.476 5.520 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(Sc2ccccn2)cc1 436358629 GKWJQDAKLLTZBX-FGZHOGPDSA-N 399.519 5.145 30 20 GKED CCCc1c(NC(=O)c2ccc(C)c(C)c2Cl)cnn1-c1cccc(C#N)c1 440089665 RQUOOHNIQFZIKT-UHFFFAOYSA-N 392.890 5.219 30 20 GKED CCCc1c(NC(=O)[C@@H](C)c2ccc(Cl)s2)cnn1-c1cccc(C#N)c1 440108258 VNOCKGPGVCAXEH-ZDUSSCGKSA-N 398.919 5.154 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1 440999975 PNEKIEGCCBRDBI-BPZDKFOGSA-N 381.907 5.059 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 451504216 FNUFIXMQPGXUKG-ABAIWWIYSA-N 385.323 5.081 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(Cc2ccc(F)cc2)CC1 454778886 ZQYWDCRRHSULRO-OAHLLOKOSA-N 383.492 5.117 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1CCc1ccccc1)c1ccccc1 458795667 CVABKUUDQAJXKQ-GOTSBHOMSA-N 375.516 5.228 30 20 GKED CCCOc1ccc(CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 463752544 CMYZYRLFQQTUEX-KRWDZBQOSA-N 382.529 5.441 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)nc(C(F)F)n2C 466339974 NFRGHZRXEYCLBG-UHFFFAOYSA-N 383.442 5.615 30 20 GKED COc1ccc2c(c1)CN(C(=O)Nc1cc(C#N)ccc1C)[C@H](c1ccccc1)C2 470340141 IKEIERLBWNDUAK-DEOSSOPVSA-N 397.478 5.207 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 474948550 BOEOFTBEMCKNOM-OXJNMPFZSA-N 387.310 5.744 30 20 GKED COc1ccccc1COc1cccc(NC(=O)NCC(C)(C)CCC#N)c1C 478969789 XBQHCMNFUCVQQS-UHFFFAOYSA-N 395.503 5.034 30 20 GKED C[C@@H](NCc1cccc(C#N)c1)c1ccc(Br)cc1C(F)(F)F 479274489 GFWOCNQNMCRPRV-LLVKDONJSA-N 383.211 5.190 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 488323218 IIFDDOKBHNFLMV-NLWGTHIKSA-N 393.556 5.799 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 492236813 LWHYYXAVTMFSMG-UHFFFAOYSA-N 379.460 5.321 30 20 GKED Cc1ccc(C#N)cc1NC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12 495090905 IQDBDSCZOWNNPE-ZDUSSCGKSA-N 381.888 5.188 30 20 GKED N#Cc1ccc(SCc2nc(CCc3ccccc3)no2)cc1C(F)(F)F 499492371 SJKLBNSXOVAGNN-UHFFFAOYSA-N 389.402 5.038 30 20 GKED N#C[C@@H](NC(=O)CCCCC(=O)c1ccccc1)c1c(Cl)cccc1Cl 499832708 JUNJHIZHGDJSRT-QGZVFWFLSA-N 389.282 5.118 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Nc2cccc3[nH]ccc23)cc1 502480783 ZMBCMWNKDKAPLQ-UHFFFAOYSA-N 398.422 5.484 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(-c2ccc(OC)cc2)n1 512521351 CUBASXJETKTBPK-UHFFFAOYSA-N 396.560 5.174 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)CCC2)c1nc(-c2c(F)cccc2F)cs1 513305686 DPXLNSIXLFSKDG-OAHLLOKOSA-N 380.419 5.067 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)CCO3)cc1Cl 521473767 RXFAWYQPCVYFHO-FQEVSTJZSA-N 388.854 5.183 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2cscc2s1 528918420 IRWWAGMZGYBZNC-HNNXBMFYSA-N 382.510 5.049 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccc3)c2)n1 531715940 FHZRHOWKZCMKIV-DEOSSOPVSA-N 381.479 5.159 30 20 GKED N#CCc1ccnc(NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)c1 532437860 ITHSOTLWSOESTR-UHFFFAOYSA-N 398.441 5.006 30 20 GKED CC(C)c1cccc(N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 532485944 NHESDDFUTGJRMI-QGZVFWFLSA-N 381.545 5.279 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)s2)c2ccc(F)c(F)c2)c1 537328829 GIEJOVGWUTUGBR-HXUWFJFHSA-N 386.492 5.499 30 20 GKED N#CC1(c2ccc(C(=O)N[C@H](c3ccc(Cl)cc3)c3ccsc3)cc2)CC1 540730729 XINBLVZKQKHDJT-HXUWFJFHSA-N 392.911 5.476 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)c2ccc(C3(C#N)CC3)cc2)cc1 540734657 XIEWCSTUOZBKCA-UHFFFAOYSA-N 396.490 5.093 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccc4ncccc4c3)no2)c2ccccc21 545632339 QGJGQWFRSBVTIE-PKNBQFBNSA-N 391.434 5.324 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1nc(Cc2ccccc2)no1 552979254 VPGKLXBXRSZDPQ-SFHVURJKSA-N 394.478 5.050 30 20 GKED CN(C(=O)c1cc(F)c(F)c(F)c1F)c1ccc(Cl)c(C(F)(F)F)c1 558294195 SQLKHKGIOQIHIS-UHFFFAOYSA-N 385.666 5.192 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1[C@H]1CCCO1)c1ccc(C(F)(F)F)cc1 560107463 QJHCZHFGDXOPGJ-IPMKNSEASA-N 396.453 5.066 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 563513112 TZJCKWWDQRVLEF-HNNXBMFYSA-N 390.874 5.341 30 20 GKED CC(C)(CCC#N)CNC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 564028447 PESZKTRGTTVOEF-UHFFFAOYSA-N 389.735 5.921 30 20 GKED CCN(C(=O)NCc1ccc(CC#N)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 567759178 OQFSQTKTVYMAQL-OAHLLOKOSA-N 389.421 5.064 30 20 GKED N#CC1CCN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)CC1 572977748 GOGOVEATDUJEIO-LJQANCHMSA-N 393.453 5.272 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc(C#N)c([N+](=O)[O-])c1 579173688 FBWYDWAXYMUYFR-LLVKDONJSA-N 382.420 5.211 30 20 GKED C=CCN(CCc1ccccc1)CC(=O)Nc1c(Cl)cc(Cl)cc1Cl 579988079 UERTUUBJYYPSMV-UHFFFAOYSA-N 397.733 5.316 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@@](C)(C#N)C1CCCCC1 580734230 LGYXTNABFMAQEG-SFHVURJKSA-N 393.965 5.426 30 20 GKED CC(C)c1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)n(-c2ccccc2)n1 580803525 KLPITNJOXIZTPT-HXUWFJFHSA-N 387.487 5.162 30 20 GKED C[C@H](NC(=O)c1cc(C#N)ccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 586806205 DGCCOUAYOASZBY-HNNXBMFYSA-N 385.854 5.241 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(F)ccc1N1CCCCC1 588949397 AHYYIZBROLZSGF-UHFFFAOYSA-N 381.495 5.079 30 20 GKED C[C@H](Oc1ccc([C@@H](C)NCCCC2(C#N)CCOCC2)cc1)c1ccccc1 595683640 XBPMIZHPHPWHKH-RTWAWAEBSA-N 392.543 5.578 30 20 GKED CCCN(C(=O)[C@@H](C)CC#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 598802432 WFYDUQYVHDMIQQ-NSHDSACASA-N 382.316 5.410 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 599737683 OYXABSPKQREWED-KKUMJFAQSA-N 391.487 5.265 30 20 GKED COCc1c(C(=O)Nc2c(C#N)c(C)c(C)n2-c2ccccc2)oc2ccccc12 603614415 WREBYLQIHNYZQO-UHFFFAOYSA-N 399.450 5.111 30 20 GKED C[C@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)CC(C)(C)C 604005316 XAGLHCWQUJQMCZ-GOSISDBHSA-N 378.516 5.733 30 20 GKED C=CCCCCCN(C)C(=O)c1csc(-c2ccc(Br)s2)n1 606813943 FAEBBPKJZWPFAX-UHFFFAOYSA-N 399.379 5.453 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1cnc(-c2ccccc2Cl)s1 609526533 ZBEXCRXEWXWLEK-NRFANRHFSA-N 395.915 5.108 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N[C@H](C#N)c2ccc(F)cc2)cc1F 609761504 MYIGVKCLGKMWIN-OAQYLSRUSA-N 380.369 5.074 30 20 GKED C[C@@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)c1cccc(C#N)c1 610317993 UKUNUEMTZJDZJX-CYBMUJFWSA-N 396.903 5.142 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)c(F)c1 610812748 NRJZFPONTXEHKL-GOSISDBHSA-N 397.906 5.641 30 20 GKED CCn1ccc(CN(C)C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c1 616482821 MISZAUBMSXSTOB-UHFFFAOYSA-N 393.874 5.098 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc2cc(F)ccc2[nH]1 619124750 BCZFFIOBZSECEK-UHFFFAOYSA-N 384.295 5.090 30 20 GKED C=CCCC1(CNC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)CCCC1 665589866 IWUIBORNYBLWHQ-SFHVURJKSA-N 386.540 5.100 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](c2nc3ccccc3o2)C1 669727184 SCKZEXXWRCHVBF-SFHVURJKSA-N 375.472 5.358 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 680965854 OIWLJYFWPBHKAG-UHFFFAOYSA-N 399.450 5.046 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)c[nH]c2c1 726142983 VONFFBQXGBNBIL-UHFFFAOYSA-N 396.450 5.025 30 20 GKED CC(C)[C@H](C)N1Cc2cccc(N=Cc3cc(Cl)cc([N+](=O)[O-])c3O)c2C1 727685359 KHWVHPYBJYEYPT-ZDUSSCGKSA-N 387.867 5.065 30 20 GKED Cc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 728769684 UQDYEKWOMIGAKB-OAHLLOKOSA-N 396.462 5.551 30 20 GKED CN(CCc1ccccc1F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 731593325 ROWQFHIZTSEWQD-UHFFFAOYSA-N 393.302 5.178 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732596010 GTXMVTHJAUMHHY-RDTXWAMCSA-N 380.900 5.519 30 20 GKED COc1ccc(CNc2ccc(OC3CCCCC3)cc2)cc1OCCCC#N 734848624 KFQSCRBTGRUWRF-UHFFFAOYSA-N 394.515 5.701 30 20 GKED Cc1nc(-c2ccccc2Br)sc1C(=O)/C=C\c1nccs1 735232375 NIIDTGDXPHYLTF-SREVYHEPSA-N 391.315 5.234 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)c1ccnc(F)c1 740785604 JZCWWBRDVMHCOI-UHFFFAOYSA-N 398.303 5.146 30 20 GKED COCc1ccc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)cc1 741843058 XWEVZKQJMWHJGH-VBKFSLOCSA-N 379.456 5.308 30 20 GKED CCCOc1c(Br)cc(/C=C/C(=O)c2ccsc2)cc1OC 749102332 QSLMLBDDVJQHIP-SNAWJCMRSA-N 381.291 5.204 30 20 GKED CC(=NNc1nc(-c2cn(CCC#N)c3ccccc23)cs1)c1ccccc1 749262290 KSZBQNZDONAMND-UHFFFAOYSA-N 385.496 5.515 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 749927684 UJVIJLYABDUBJJ-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2OCC2CC2)cc1 751085613 XMWUILABSLDEOO-HSZRJFAPSA-N 382.463 5.383 30 20 GKED Cc1cc(C)cc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 765233970 JPBOZHZLECCAKS-XMMPIXPASA-N 383.495 5.623 30 20 GKED CCOc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cc1[N+](=O)[O-] 765617021 SPEMLBMDRIQMPE-KTKRTIGZSA-N 380.425 5.013 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2C[C@@H](c3ccccc3)C2(C)C)ccc1OC 766329630 MYJMGJIZBKZJGK-QTEQDKRBSA-N 378.516 5.048 30 20 GKED Cc1cc(C=Nn2c(C)nc3scc(-c4ccc(Cl)cc4)c3c2=O)c(C)o1 767897083 OWQFRXUAEDGUGV-UHFFFAOYSA-N 397.887 5.179 30 20 GKED N#Cc1c(Cl)nsc1N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 771258970 OLOQREIOHNHZOX-HNNXBMFYSA-N 375.284 5.112 30 20 GKED CCC[C@]1(COC)CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772230017 KTSQBLOGGXUWFA-LADGPHEKSA-N 391.515 5.155 30 20 GKED C#CC[C@H](N[C@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1)c1ccccc1 773103559 AQPIPTIMZDKIOF-JZWVFAODSA-N 381.491 5.189 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)no1 779923012 VTNLWLHKOQYKMO-HXUWFJFHSA-N 388.427 5.016 30 20 GKED O=C1/C(=C\c2scnc2C2CC2)CSC/C1=C/c1scnc1C1CC1 782315869 YWZCNPXZFNCJLD-GFIWHYBVSA-N 386.567 5.137 30 20 GKED CC(C)(C#N)CCCOC(=O)c1csc(-c2cc(Br)cs2)n1 783111554 ODMBMIQGANJGRO-UHFFFAOYSA-N 399.335 5.121 30 20 GKED Cc1cc(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)sc1Br 794733464 WUGUJGADOMHFMF-JECSTDCCSA-N 376.275 5.006 30 20 GKED Cc1nc(/C=C\c2ccnn2C(C)C)sc1C(=O)/C=C/c1ccnn1C(C)C 794938419 PIWGHBJFNBKNOJ-FFELTBSMSA-N 395.532 5.073 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 796660181 BRMRWHQUFHLZGW-MGPUTAFESA-N 399.475 5.002 30 20 GKED CC(C)(C)c1ccc([C@@H](O)CCC(=O)Nc2cccc(OCCCC#N)c2)cc1 798282007 UPFFBEHTVLZLFR-QFIPXVFZSA-N 394.515 5.119 30 20 GKED N#CCCCCCC(=O)OCc1csc(-c2ccc(Br)cc2)n1 805697904 KGSRWHKWJAXCJR-UHFFFAOYSA-N 393.306 5.090 30 20 GKED O=C1/C(=C\c2cnc(-c3ccc(Cl)cc3)s2)C[C@@H](C(=O)O)c2ccccc21 806560609 MUCDNZQLSPPEDU-YVJSUPCUSA-N 395.867 5.302 30 20 GKED C=CCCCCCCCNC(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 811927083 HZBHATXWVYAWHU-KBPBESRZSA-N 388.396 5.285 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1cccc(Br)c1)c1ccccc1 814209975 IKAWLDDWCWJSEW-QGZVFWFLSA-N 388.334 5.171 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1cc(F)c(N)c(F)c1 814859347 ONBNZCIJAOCGOV-UHFFFAOYSA-N 386.349 5.012 30 20 GKED C=CCC(F)(F)C(=O)N(CC)[C@@H]1CCSc2ccc(Br)cc21 815408038 SKGXLTDCRYBRSP-CYBMUJFWSA-N 390.293 5.046 30 20 GKED Cc1cc(C(=O)N(CC#N)c2ccc(Cl)cc2)ccc1NC(=O)OC(C)(C)C 843610946 OIXZOKWYLAQEQA-UHFFFAOYSA-N 399.878 5.166 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 854461180 UQECPAZNWBQTFB-HKUYNNGSSA-N 375.557 5.777 30 20 GKED Cc1cc(C)cc(C2(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)c1 917119616 PAVUDMQHKXEJTD-XMMPIXPASA-N 380.491 5.629 30 20 GKED CC(C)Sc1cccc(Cl)c1C=NNc1ccc(Cl)c(C(=O)O)c1 1776033718 WQJYSKZIALRUOU-UHFFFAOYSA-N 383.300 5.638 30 20 GKED CCCC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(Oc2ccccc2)cc1 1776063560 XBWCRXRTJGQHSW-UHFFFAOYSA-N 392.430 5.933 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2cccc(OCCC(=O)O)c2)cc1 1776125351 GDKNOBAAPHGGTK-MDWZMJQESA-N 382.456 5.005 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)s2)cc1 1776125760 RWYPDYXGFRHUIG-DVFVSVACSA-N 386.513 5.938 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c1)C(=O)O 1776126350 JRYZVMWHRWQTJY-MJSCBBHESA-N 388.419 5.227 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2cccc(C(=O)O)c2F)c2c(c1)C(C)(C)CC2 1776269225 JUQFVXYEIHCVMY-KTKRTIGZSA-N 394.486 5.941 30 20 GKED Cc1sc(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)c(C#N)c1C 12158627 NDVXDBJCHGPHKH-UHFFFAOYSA-N 395.534 5.827 30 20 GKED N#C[C@@H](C(=O)Cc1ccc2ccccc2c1)c1nc2ccccc2n1C(F)F 41559275 VNHSEYILSUXYEL-KRWDZBQOSA-N 375.378 5.004 30 20 GKED N#C[C@H](C(=O)c1cn(Cc2ccccc2)c2ccccc12)c1nc2ccccc2[nH]1 47359124 ZYZWEGPALHPCPW-LJQANCHMSA-N 390.446 5.056 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1nc2ccccc2s1 60477204 JSHVBGOYTSZFRX-INIZCTEOSA-N 395.443 5.595 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2Oc2ccccc2)c1 78875619 AOWAOTBKBIUFRT-UHFFFAOYSA-N 386.451 5.538 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1ccc(Cl)c(Cl)c1 108352580 NWDUDRMYJRKSRT-UHFFFAOYSA-N 380.300 5.050 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)CCCCc1ccccc1 108530137 RMBXCDAGMYLJOJ-GOSISDBHSA-N 381.545 5.425 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(OC2CCCC2)CC1 109029656 IHXUYYSSKWIQEI-INIZCTEOSA-N 387.549 5.036 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 109162935 OZDMUOJJTUFIQK-MRXNPFEDSA-N 387.439 5.281 30 20 GKED O=C(Nc1ccc2oc(C(F)(F)F)nc2c1)c1ccc(F)cc1C(F)(F)F 135273430 OLMHAVXHDNBPHS-UHFFFAOYSA-N 392.230 5.257 30 20 GKED C#Cc1cccc(N(CC)Cc2csc(N(C(C)=O)c3ccc(C)cc3)n2)c1 171395764 FJMNPJMOIOOFPF-UHFFFAOYSA-N 389.524 5.144 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CC1CCC(C(F)(F)F)CC1 183105421 PZUDFFLHVKNLRO-NFOMZHRRSA-N 384.467 5.636 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCOc1ccccc1OC 191487914 NVMXWUASQVUKLT-UHFFFAOYSA-N 382.504 5.090 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2 191489194 VJEAXQPDRCYBML-HXUWFJFHSA-N 392.499 5.636 30 20 GKED O/C(=N\C1CCC(/C(O)=N\CC2(c3ccc(Cl)cc3)CCC2)CC1)C1CC1 330026816 MBIVQATVTUFGKZ-UHFFFAOYSA-N 388.939 5.644 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c21 411024523 ZMPVTLLHMQOVLG-MNOVXSKESA-N 375.444 5.065 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)CSCCC#N)nc2c1C 413012397 LJWRMCLIEUZYNN-UHFFFAOYSA-N 395.553 5.093 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430614384 YYCNTAAVVGKTLI-AWEZNQCLSA-N 399.516 5.502 30 20 GKED O=C(c1cccc(C(F)(F)F)c1F)N(Cc1cccs1)CC(F)(F)F 430615771 DAZBUEMEASAORG-UHFFFAOYSA-N 385.304 5.111 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 431873806 AVQRNUXOJXSVMP-LIRRHRJNSA-N 390.314 5.789 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1cc(F)c(Cl)cc1F 432857345 DOLKMDPCLKPPRM-LLVKDONJSA-N 395.862 5.192 30 20 GKED N#CCCC[C@H](NCc1nnc(-c2cc3c(s2)CCCC3)o1)c1ccccc1 433017018 WQGNRWCESIHMCW-SFHVURJKSA-N 392.528 5.202 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 433994198 RBXSZICLHMUODD-UHFFFAOYSA-N 391.789 5.267 30 20 GKED C=CCC[C@@H](NCc1cnc(C(F)(F)F)s1)c1ccc(C(F)(F)F)cc1 443993667 MWGIJLYHJBWURV-CQSZACIVSA-N 394.384 5.978 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1CC1 444398833 RIKHAPVTTQJNSM-MRXNPFEDSA-N 387.439 5.701 30 20 GKED C=CCN(CCc1ccco1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1C 446860073 FBUUGEJEPVVURF-SFHVURJKSA-N 380.410 5.022 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1[C@@H](C)C[C@H](CC(F)(F)F)[C@H]1C 454762996 YFJVAYQKUSZNCQ-BYNSBNAKSA-N 399.482 5.522 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2)c1ccccc1 455337228 ZUPWUIBAIBHFDJ-JBACZVJFSA-N 388.515 5.232 30 20 GKED CN(CCc1cccc2ccccc12)C(=O)N[C@@H](CCCC#N)c1ccccc1 458804344 SIMKTFKIWCZJLZ-DEOSSOPVSA-N 385.511 5.459 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1)c1ccc(F)c(F)c1 460881594 JIUSQSOWCRHPGL-JKIFEVAISA-N 390.396 5.345 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 464713258 RNISKVBWQFLNBE-IBGZPJMESA-N 396.487 5.532 30 20 GKED Cc1cnc(C(C)(C)NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)s1 464747246 NFTZSIIEOVXIIO-UHFFFAOYSA-N 391.496 5.089 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cccc(COC(C)(C)C)c2C)c(OC)c1 474759005 PRFYWHZEDXMWID-UHFFFAOYSA-N 397.515 5.065 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H](OC)c1ccc(OC)cc1 475549194 NXHOCOMJNHPATF-GAJHUEQPSA-N 396.531 5.445 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCCc1csc2ccccc12 480975010 XTKNXOAUYDWBKG-UHFFFAOYSA-N 391.540 5.183 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NC3CCSCC3)cc2Cl)cc1 506316659 PAUAITGRAVNMMM-UHFFFAOYSA-N 387.892 5.021 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C(C)C 510003187 SBJDZUVWZGXOIR-UHFFFAOYSA-N 392.286 5.316 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(F)cc1 510326443 KQTAGYSORSVFSF-UHFFFAOYSA-N 375.403 5.120 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1nc(C)c(-c2ccc(Cl)cc2)o1 512511734 KXBINSYZLOZEKB-UHFFFAOYSA-N 398.938 5.659 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C[C@@H](C#N)CCC#N 513502517 AJBPBCBMUORSJR-OAHLLOKOSA-N 375.394 5.231 30 20 GKED C=CCC[C@H](NC(=O)C[C@@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 514060711 ROLMTQFKFIQMIQ-ACJLOTCBSA-N 394.437 5.628 30 20 GKED C=CCOCC(=O)N(c1nc(-c2ccc(C)cc2)cs1)c1cc(C)ccc1C 517151060 AJQJHPORNZAWDK-UHFFFAOYSA-N 392.524 5.603 30 20 GKED C[C@@H](c1ccccc1)N(C)C(=O)C1(C)CCN(c2ccc(Cl)cc2C#N)CC1 519728245 PAHRKOWJABKTDG-KRWDZBQOSA-N 395.934 5.038 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCCc4ccc(Cl)cc43)ccc21 527293120 STSVPCGFENTJJR-OAQYLSRUSA-N 393.918 5.412 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1csc(-c2ccc(F)cc2)n1 530970915 UEAIPAXPBPIAQW-RTWAWAEBSA-N 377.488 5.221 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccccc1C#N 534156437 VKLLFASGLBSDBG-UHFFFAOYSA-N 387.826 5.152 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccnc(Oc3ccccc3)c2)c(C#N)s1 536973112 LLMFKFJZGDRBPQ-UHFFFAOYSA-N 377.469 5.357 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 538046401 WRRDGCLEOSOYFO-AEFFLSMTSA-N 385.492 5.392 30 20 GKED C=CCn1c(SCc2ncc(Cl)cc2Cl)nnc1-c1cccs1 540730768 RDLCTJCZLSTTQK-UHFFFAOYSA-N 383.329 5.187 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 541076274 ZOUMMOKKLYXCRH-LLVKDONJSA-N 382.382 5.144 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nc(C3CC3)no2)cc1C 541505632 JVSDVTZKQYCHBP-UHFFFAOYSA-N 388.471 5.143 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccn1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543015915 AKOSJMRJSCHERH-GOSISDBHSA-N 396.494 5.055 30 20 GKED C=C(C)[C@H](NC(=O)c1cc(-c2ccccc2)c(C)nc1O)c1ccc(F)c(F)c1 547861947 XLYBVEZGJHQJTA-NRFANRHFSA-N 394.421 5.088 30 20 GKED Cc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)c(-c2nc3ccccc3[nH]2)c1 547955651 GTLLHTVJBDRUJX-UHFFFAOYSA-N 386.842 5.316 30 20 GKED N#CCCC[C@H](NCC1=Cc2cc(Br)ccc2OC1)c1ccccc1 556906885 FEMUGOSARUTNJX-FQEVSTJZSA-N 397.316 5.250 30 20 GKED COc1ccc(COCc2cccc(NCc3ccc(Cl)cc3C#N)c2)cc1 558721182 DQYQJISFZIQOFT-UHFFFAOYSA-N 392.886 5.549 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3SCCC#N)cs2)c(C)c1 561153470 GUKUUUOPAQYBBX-UHFFFAOYSA-N 393.537 5.685 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 561731600 PZHQTOIXVLYQEY-UHFFFAOYSA-N 392.286 5.240 30 20 GKED C=CCCCSc1nnc(CNc2cccc(OC)c2)n1C1CCCCC1 561792727 ABBAOSKMRYVBCU-UHFFFAOYSA-N 386.565 5.462 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NC[C@H](OCC2CC2)c2ccc(Cl)cc2)cc1 573512359 NZZNZNYOZWMDJV-NRFANRHFSA-N 396.918 5.039 30 20 GKED N#CCc1ccc(CS(=O)(=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 579603832 PMXBILYLXVHMAQ-QFIPXVFZSA-N 395.911 5.110 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 579891405 PSQDCZPMMAUBKO-UHFFFAOYSA-N 392.484 5.250 30 20 GKED CCc1nc2cc(CN[C@@H]3CCCCc4cc(C#N)ccc43)ccc2n1C1CC1 582015793 QKRSQIQDVFIIOP-JOCHJYFZSA-N 384.527 5.363 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)F)cc3)n2)cc1 588348930 HZGGHWNJOMWAPK-MRXNPFEDSA-N 384.407 5.246 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC[C@@H](Sc3cccc(Cl)c3)C2)cc1 590019604 DJZXWWGLRFWDAC-LJQANCHMSA-N 384.932 5.148 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1 590288639 MSOUCZFFSWLKGF-UHFFFAOYSA-N 398.462 5.047 30 20 GKED COc1cc(CSCC2(CC#N)CC2)ccc1OCc1cccc(C#N)c1 596338522 SQMDJVRYTGWPRY-UHFFFAOYSA-N 378.497 5.073 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 596696684 FVHYMISFMGQDAT-SZPZYZBQSA-N 387.483 5.047 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1 601184700 MAXKPRFFVKXELK-XMMPIXPASA-N 381.479 5.159 30 20 GKED N#Cc1c(Cl)cccc1NCc1cccc(NC(=O)c2ccc(F)cc2)c1 603871355 RVUUFEJDLRRADI-UHFFFAOYSA-N 379.822 5.215 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)Cc3c[nH]c4cc(Cl)ccc34)c2C#N)C1 609018562 FNJYHRGJQNDUCZ-NSHDSACASA-N 383.904 5.060 30 20 GKED CSCc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)oc2ccccc12 609321510 CAJREBVYQIATET-CYBMUJFWSA-N 396.468 5.535 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)sc2c1CCCC2 609496349 MPWPQLIUNVOSCK-GJZGRUSLSA-N 390.430 5.260 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(NC3CCCCC3)cc2)c1 609516664 CJFPSQVXQXPSJC-UHFFFAOYSA-N 391.515 5.491 30 20 GKED CC(C)(C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccs1 609643443 NTMXTSRNWRNDHU-UHFFFAOYSA-N 376.481 5.115 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@@H]2C2CCC2)c1 609731474 WRNXTFCUAQZXJR-HXUWFJFHSA-N 380.875 5.409 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccsc1 609970595 UXOYUAKMYXKUSB-AWEZNQCLSA-N 380.444 5.080 30 20 GKED CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 610792649 SLHZFPRQSPYWSJ-VGOFRKELSA-N 393.556 5.868 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)N(C)c1ccc(C#N)cc1F 611285407 UJKDHQMTGQODFE-UHFFFAOYSA-N 393.487 5.065 30 20 GKED C[C@H](NC(=O)NCc1ccc(Cl)o1)c1ccc(-c2cccc(C#N)c2)cc1 611807212 SGTLHJCPHRULTP-AWEZNQCLSA-N 379.847 5.032 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(N2CCCCCC2)nc1 616082550 AUUXAOQQAGRVDA-UHFFFAOYSA-N 389.952 5.005 30 20 GKED N#C[C@@H](Sc1nnc(-c2cccc3ccccc23)o1)c1ccc(Cl)cc1 619864295 DKASESNEYRNXMG-GOSISDBHSA-N 377.856 5.900 30 20 GKED CC(C)(C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccccc1F 624619306 OXIRIFLSJMQWPE-QWRGUYRKSA-N 399.350 5.129 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C(F)(F)F)s1 671787803 QYBJDVAQLASABL-SNVBAGLBSA-N 385.304 5.330 30 20 GKED CC(C)[C@H](C(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 677301344 WBHMWVPEGJMRKP-NFAWXSAZSA-N 399.350 5.155 30 20 GKED CC(C)(C)c1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 726501463 AXNWMFLVKLFQPL-GOSISDBHSA-N 375.497 5.348 30 20 GKED C#Cc1cccc(N(C(=O)CCCCOc2ccc(C(=O)CC)cc2)C(C)C)c1 728245523 AMXROPDIRQESKY-UHFFFAOYSA-N 391.511 5.251 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(Nc2ccc(C)cc2)sc1=S 729472016 SOFDHHOQHXSOKA-UHFFFAOYSA-N 389.594 5.335 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(Cl)c(Cl)c1 730954790 KQPOUXIGUBQVOE-LLVKDONJSA-N 396.368 6.054 30 20 GKED C=CC[C@H](NC(=O)c1ccc(N(CC)Cc2ccccc2)cc1)c1ccncc1 734455201 BBHJPZWBNINWKX-DEOSSOPVSA-N 385.511 5.155 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 734679455 MMXIEFSQZZPIIE-KSSFIOAISA-N 377.410 5.120 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)/C=C(\C)c1ccccc1C(F)(F)F 741912155 PGFZRHSHYMCDDW-FOWTUZBSSA-N 384.401 5.195 30 20 GKED CCOc1cccc(C=Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c1O 743045070 YEYVFJWUOQCFHI-OAHLLOKOSA-N 384.476 5.127 30 20 GKED N#C[C@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc(-c2ccccc2)cs1 744037236 QUIUXYHDQDTTBW-DQVLVPHSSA-N 386.520 5.960 30 20 GKED CC[C@@H](C)n1c(-c2ccccc2)nn(CN(C)Cc2ccc(C#N)cc2)c1=S 749884334 CAZHJWUOZYXCSH-QGZVFWFLSA-N 391.544 5.013 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3csc(C)n3)n2)cc1 750686582 GPJNQPSFRQIVEW-KRWDZBQOSA-N 381.526 5.083 30 20 GKED CCCN(CC)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 751329403 QQCUXVVHBALTMW-QHCPKHFHSA-N 398.510 5.226 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)N1CCC[C@H]1c1nc2ccccc2n1C(C)C 758296178 KPPMNKQHKXOCKZ-LEWJYISDSA-N 398.551 5.252 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2cc(C)ccc2C)c1 762041063 CUCDKMZQPLWRQS-OFNKIYASSA-N 391.515 5.031 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccc(Nc4ccccc4)cc3)on2)c1 789888962 WEUDVCSGOFIYMH-UHFFFAOYSA-N 380.407 5.209 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCc3cc(Br)ccc32)c1 794811905 UQUHBJWVLUGCCR-GHTZIAJQSA-N 399.332 5.297 30 20 GKED CC(C)c1nc(C#N)c(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)o1 799479168 LAVQYZZMPHWMTK-ZDUSSCGKSA-N 376.382 5.424 30 20 GKED C#C[C@@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccc(Cl)cc1F 806348081 LOIQTVVCQLABMG-GOSISDBHSA-N 397.837 5.247 30 20 GKED Cc1cc([C@H](C)OC(=O)c2ccccc2SCc2ccc(C#N)cc2)no1 810792886 DQORKVQSYUTDIG-HNNXBMFYSA-N 378.453 5.065 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 842943621 YBUNSCUQLZCJRW-GOSISDBHSA-N 380.513 5.202 30 20 GKED Cn1c2ccccc2c2cc(C(=O)Nc3sc4c(c3C#N)CCCC4)sc21 863967171 JVWPGISYMONZLH-UHFFFAOYSA-N 391.521 5.457 30 20 GKED N#C[C@H](C(=O)C1C[C@@H]2CC[C@H](C1)S2)c1nc(-c2ccc(Cl)cc2)cs1 892506811 HMWNBAXJXDQURK-YPAMNDHTSA-N 388.945 5.314 30 20 GKED C[C@@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)C2CC2)cc1 914557505 HQBGMELNGHNDNZ-FEJWEZRGSA-N 377.271 5.228 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)oc2c(F)cccc12 915086655 MELZMICRMWAYCW-HXUWFJFHSA-N 384.410 5.788 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)on1 916680929 MVMKFBPHSBAXSU-NHCUHLMSSA-N 386.455 5.008 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2sc3cccc(C)c3c2Cl)c1 916897992 WJVYCUBVWBKXPH-AWEZNQCLSA-N 382.872 5.133 30 20 GKED Cc1ccc(OCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 917047018 OPYGDPGUHUTYLI-MRXNPFEDSA-N 384.888 5.212 30 20 GKED C=CCn1c(SCC(=O)c2ccccc2C)nnc1-c1ccc(Cl)cc1 917183878 IMYVMKKLFROZAA-UHFFFAOYSA-N 383.904 5.068 30 20 GKED CSc1ccc2cc(CNc3cccc(OCCCC#N)c3)c(Cl)nc2c1 917820805 ILENFFWQQBGINR-UHFFFAOYSA-N 397.931 5.905 30 20 GKED O=C(C=C1CCCC1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 918480481 JHTVSYUBVUYZFX-UHFFFAOYSA-N 390.533 6.107 30 20 GKED N#C[C@H](C(=O)Cn1ccc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 918490574 UBERJYSCKCGSFE-QGZVFWFLSA-N 391.883 5.295 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 918677202 SXCCUUSDRBPYIM-UHFFFAOYSA-N 378.428 5.486 30 20 GKED N#C[C@@H](C(=O)C12CC3CC(CC(C3)C1)C2)c1nc(-c2c(F)cccc2F)cs1 920804442 QSCKCQMKJWAVKO-YYXFOKPRSA-N 398.478 5.481 30 20 GKED C=CCc1ccccc1CNC[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O 1776189646 NBJOQUTZCMWSKP-RUZDIDTESA-N 385.507 5.115 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1sc(CC)cc1Br 1776786679 AJBPJZFPBCWLQN-CYBMUJFWSA-N 390.387 5.366 30 20 GKED CCCCCCCOc1cccc(/C=C\c2nc3cc(C(=O)O)ccc3o2)c1 1776789263 YTYMTOQEBMYXCL-RAXLEYEMSA-N 379.456 6.046 30 20 GKED COc1cccc(Cl)c1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777380753 XUGMGBWQKCQGRH-MDZDMXLPSA-N 382.799 5.203 30 20 GKED COc1ccccc1Oc1ccc(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1 1777388485 MXSIEZDASBIVCW-DHZHZOJOSA-N 380.421 5.143 30 20 GKED Cc1cc2c(s1)C/C(=C\c1ccc(OCc3cc(C)c(C(=O)O)o3)cc1)C2=O 1777428077 MGTDGEUYGYPXTA-OQLLNIDSSA-N 394.448 5.058 30 20 GKED N#Cc1ccc(C(=O)O)nc1/C=C/c1sc(Sc2ccccc2)nc1Cl 1777566608 VSCAFPOLDSIJFK-CMDGGOBGSA-N 399.884 5.083 30 20 GKED COc1cc(/C=C/C(=O)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 6338593 ULVWGSWRVIJXTI-NTUHNPAUSA-N 389.407 5.079 30 20 GKED N#CCc1ccc(NC(=O)CNc2cc(Cl)ccc2Oc2ccccc2)cc1 15322357 PZBJMUIUJRDDCP-UHFFFAOYSA-N 391.858 5.249 30 20 GKED C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(C(C)(C)C#N)cc1 25438133 DAWPWFYXILKDGP-LBPRGKRZSA-N 377.271 5.201 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(C)c(C)cc2C)nnc1-c1ccco1 28503284 UHEAPZXSGAVRHI-INIZCTEOSA-N 381.501 5.013 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C)C(=O)Nc1c(C)cccc1C 63641490 JFLWPFXKNCSMAZ-IBGZPJMESA-N 399.494 5.715 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(NC(=O)c3cccs3)cc2)c1C#N 68677850 CDJXTEQPXODVCA-UHFFFAOYSA-N 395.509 5.057 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)nc2)c(C(F)(F)F)c1 115050018 XNTOAVYHMWFJHY-LLVKDONJSA-N 379.407 5.115 30 20 GKED C=CCCO[C@@H](C)C(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 116546145 CEPGQTFRGROIDF-KRWDZBQOSA-N 380.513 5.559 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 131378919 OUXRWVWNUJXWCZ-FQEVSTJZSA-N 381.451 5.220 30 20 GKED N#C[C@H](COC(=O)c1ccc(C2SCCCS2)cc1)Cc1cccs1 180107791 LKLJKRLMAKZIAZ-CQSZACIVSA-N 389.567 5.156 30 20 GKED N#CCOc1ccc(CN[C@@H]2CCCc3nc(-c4ccccc4F)sc32)cc1 180551556 YGKHEQBQIVJDBR-LJQANCHMSA-N 393.487 5.019 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 191486330 OVFYTLYQORYRNR-UHFFFAOYSA-N 393.487 5.643 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccccc3OCC3CC3)c2)c1 303133193 PTIKFKNMQBFZKB-UHFFFAOYSA-N 398.462 5.178 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1sc2c(c1C)CCCC2 328841791 PSHGPYUEYZJQOM-CYBMUJFWSA-N 376.547 5.231 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN([C@@H]2CCc3ccc(F)cc32)C1)C1CCCC1 329388137 RFSIRKSIFDUKTJ-LAUBAEHRSA-N 396.510 5.194 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426135486 FZQYWELCMJJQCM-NSHDSACASA-N 381.785 5.455 30 20 GKED N#Cc1ccc(NC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)c(Cl)c1 426140397 RLFOTGWRLJJYJL-UHFFFAOYSA-N 376.847 5.014 30 20 GKED N#Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 429691572 WZMKMBQSRLULDR-LBPRGKRZSA-N 388.235 5.072 30 20 GKED CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)N[C@H](CCCC#N)c1ccccc1 431305388 BRJBORJQBACTMO-YPAWHYETSA-N 385.552 5.095 30 20 GKED CCCOc1ccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 431928363 WJVCQCSOIABWNT-QFIPXVFZSA-N 379.504 5.018 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)N(Cc1cccs1)Cc1cccs1 433231872 ZBWIROIIRGGUCZ-GOSISDBHSA-N 380.538 5.111 30 20 GKED C=CCC[C@@H](NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)c1ccccc1 435298634 YOVYCDUQTBJYCR-XPPIMPSXSA-N 396.575 5.065 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1C(=O)N1CCCCC1)c1ccccc1 435657220 VFWZTRMSWSHCJR-OAQYLSRUSA-N 391.515 5.142 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 438377091 WESMMLZWYFOSCK-LEWJYISDSA-N 377.488 5.168 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(C(=O)c2ccccc2)c1)c1ccccc1 439387459 OVZYEDZHGSIORA-QFIPXVFZSA-N 383.451 5.084 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 441536924 YTCXUCMUHYGXNS-DNVCBOLYSA-N 391.437 5.510 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)N(Cc1ccco1)c1ccccc1C#N 443832546 DWRNHXPQPSVZNN-KPLVRAHFSA-N 380.488 5.058 30 20 GKED CC1(C#N)CCC(N[C@@H](CC(F)(F)F)c2ccc(Br)cc2)CC1 449237540 ODNUMIRKPDOYNW-PCKAHOCUSA-N 389.259 5.505 30 20 GKED CC(C)c1cccc(C(C)C)c1NS(=O)(=O)c1ccc(C#N)cc1Cl 461431620 RMJLVGFPTMWOJJ-UHFFFAOYSA-N 376.909 5.259 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ccccc3OC(F)F)c2)c1 462206413 BWNXNYNHZYBHDM-UHFFFAOYSA-N 380.394 5.351 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 463747529 UYYKUFHTGGPZID-SJKOYZFVSA-N 379.262 5.082 30 20 GKED COc1ccccc1[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1ccccc1Cl 466083766 XAKROECLQPMCHU-NRFANRHFSA-N 391.858 5.131 30 20 GKED C=CCCCNC(=O)C/C(=C/c1cccc(OC)c1)c1nc2ccccc2s1 468366623 CSRVWLMSQKZTBL-JXAWBTAJSA-N 392.524 5.318 30 20 GKED C[C@@H]1CCc2c(sc3nc([C@@H](C)Sc4cccc(C#N)c4)nc(O)c23)C1 468628033 PDCSEDDUDPCASZ-VXGBXAGGSA-N 381.526 5.247 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1ccc(Sc2ccccc2C#N)cc1 470622286 GAZVPZOUUFRWQU-DYVFJYSZSA-N 390.430 5.122 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)ccc1Cl 472532540 JGUDBALDEHXSCP-INIZCTEOSA-N 381.888 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC(Cc2ccccc2Cl)C1 475559112 CGDMDPGCBJJXGL-UHFFFAOYSA-N 382.935 5.898 30 20 GKED Cc1cc(Br)c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1Cl 476724148 XRNINJIKLWDBBL-UHFFFAOYSA-N 391.696 5.464 30 20 GKED C=CCN(C(=O)[C@@H](C)c1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483952025 XTKALYDTNKAXMN-HNNXBMFYSA-N 393.468 5.041 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(F)ccc2F)nnc1-c1ccccc1C 488919795 YVTAYVXRQRRURT-AWEZNQCLSA-N 399.466 5.081 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](c1cccc(F)c1)c1ccccn1)c1ccccc1 498249444 DQIWSFJHDMSGQI-JTHBVZDNSA-N 389.474 5.317 30 20 GKED CCc1sc(NC(=O)CSCc2ccc(C#N)cc2)nc1-c1ccccc1 501707979 GCAWRFJWCHJNBN-UHFFFAOYSA-N 393.537 5.116 30 20 GKED N#C[C@H](NC(=O)CCCc1c[nH]c2ccccc12)c1cccc(Cl)c1Cl 505314620 PBQMWQPTGFWJRA-SFHVURJKSA-N 386.282 5.178 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H](c2ccc(F)cc2)[C@H]2CCCO2)CC1 507581567 TVTSBBGEYCTKPV-BIELFDCTSA-N 378.491 5.040 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 510059129 XMHRFJSNBLVRFL-OXQOHEQNSA-N 381.907 5.649 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 511336821 ZZEPRXDTIHWNNZ-JOCHJYFZSA-N 379.479 5.160 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccc(C(F)(F)F)nc2)n1 512033586 XPESCSWAQJBBAZ-GFCCVEGCSA-N 391.246 5.228 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)CCCCOc1cccc(C#N)c1 512835673 UTUBVLKBYRAQSC-UHFFFAOYSA-N 399.494 5.040 30 20 GKED N#C[C@@H](C(=O)c1occc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 515539579 ZLYGRRBXQRIXFQ-HNNXBMFYSA-N 378.840 5.700 30 20 GKED Cc1nc(C(C)C)sc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 515547385 UNZVMFANRUSULS-NSHDSACASA-N 375.906 5.328 30 20 GKED CC(=O)c1csc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)c1 518536184 HXPRXLLMZKTTPK-UHFFFAOYSA-N 392.455 5.117 30 20 GKED COc1ccc(C(C)(C)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520198071 ZWIPJRAULZJWAO-INIZCTEOSA-N 397.544 5.189 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccccc3OC3CCCC3)cc2)nc1 521090300 GHEYBKLVEVPXRZ-UHFFFAOYSA-N 399.450 5.319 30 20 GKED C[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 521710948 PTYUIPHSGMOTQF-OXJNMPFZSA-N 381.907 5.649 30 20 GKED CC(C)(NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 522655369 HOTODFXEBHLELB-UHFFFAOYSA-N 377.469 5.469 30 20 GKED COc1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)cc1 523879422 JQQKRCOZFXOFBS-UHFFFAOYSA-N 378.815 5.265 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2ccncc12 530797274 MGACWKZBWHWFEA-UHFFFAOYSA-N 381.460 5.510 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)c1ccccc1 534655408 HQOINEZQFKMVGS-QGZVFWFLSA-N 376.431 5.098 30 20 GKED C=C[C@H](CC(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1)c1ccccc1 535373986 ITRBPMIAWIBWGR-HXUWFJFHSA-N 375.512 5.085 30 20 GKED N#CCCC[C@H](N[C@H]1CCCc2ccc(Br)cc21)c1ccccc1 551210667 IBEOXSYYZGZAFO-SFTDATJTSA-N 383.333 5.851 30 20 GKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(F)cc(Br)c1 556197955 ODYXPIKSAYUDPP-PMACEKPBSA-N 389.312 6.064 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 558844501 AGHIEGVYMKSOOY-UHFFFAOYSA-N 396.494 5.049 30 20 GKED Cc1csc(Nc2ccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)cc2)n1 564411857 JVRVDXBIDZCQEY-UHFFFAOYSA-N 376.485 5.249 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(Cl)c4cccnc34)cc2)ccn1 580134659 NHMHQFNMLBVXBI-UHFFFAOYSA-N 386.842 5.559 30 20 GKED C=C(C)Cn1c(C2CCCC2)nnc1N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 581165144 BFOLLMLITZGQDW-MRXNPFEDSA-N 382.474 5.071 30 20 GKED N#Cc1ccc(F)c(CSc2nc3c(c(-c4ccco4)c2C#N)CCC3)c1 589002443 CSQMZROXBAVEJS-UHFFFAOYSA-N 375.428 5.005 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 590153506 GRSDYPXHGSTGMU-UHFFFAOYSA-N 386.455 5.079 30 20 GKED C[C@@H](N[C@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)c(F)c1 595077270 QFCZPSZMKSNGKA-ZMZPIMSZSA-N 391.309 5.099 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC[C@@H](O)CC2(C#N)CCOCC2)cc1 600742110 JUAYABCETNWZKY-NQIIRXRSSA-N 396.556 5.023 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c1 603734266 ZOJGJCJUEOTFLP-UHFFFAOYSA-N 394.308 5.497 30 20 GKED CCSCc1ccc(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cc1 603946424 DQJGTHMMISANEE-UHFFFAOYSA-N 379.510 5.187 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H](c3cccs3)C3CC3)cc2)cc1 604461404 UUDUMSWQDHLGPE-OAQYLSRUSA-N 389.480 5.685 30 20 GKED Cc1ccnc2sc(C(=O)N[C@H](C#N)c3ccc(C(C)(C)C)cc3)c(C)c12 609414991 GVHIXSQGNBAIMX-QGZVFWFLSA-N 377.513 5.205 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc(F)c(F)c1 610228216 WPBVSJVSISBBPE-AWEZNQCLSA-N 378.378 5.371 30 20 GKED N#Cc1ccc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)c(Cl)c1 611186667 VTZKVFYYLMLXOU-UHFFFAOYSA-N 389.814 5.525 30 20 GKED N#C[C@H](C(=O)c1csc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 613320125 RUEMORIEWRMIIZ-OAHLLOKOSA-N 394.908 6.168 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(C(F)(F)F)CCCC1 619128261 HESHHIQJRKQNHN-UHFFFAOYSA-N 387.286 5.279 30 20 GKED C=CCCOCC(=O)Nc1cc(Cl)ccc1Oc1ccc(OCC)cc1 620326614 PUCDWZAKPRSITD-UHFFFAOYSA-N 375.852 5.062 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3cccs3)c2)[C@H]1c1cccnc1 644980449 SVPQOSMGAQQRTI-NRFANRHFSA-N 387.508 5.158 30 20 GKED O=C(c1ccc(C(F)(F)F)s1)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F 654183513 PSDJYWFJYOZORY-MUWHJKNJSA-N 399.278 5.112 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@@H]1CCC(F)(F)C1 671239365 UPGKFMCKAKKHLD-SNVBAGLBSA-N 389.286 5.118 30 20 GKED C=CCC[C@H](NC(=O)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1)c1ccccc1 676422917 GKTWAYOYFUHZOH-KKUMJFAQSA-N 394.359 5.076 30 20 GKED Fc1ccc2ccnc(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c2c1 678310178 ALQXXLRLBLKLGD-PJXYFTJBSA-N 380.307 5.695 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)C2CC2)o1 726457244 LASUOJNRTQJNBY-PXAZEXFGSA-N 385.920 5.289 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1cc2c(Cl)cccc2s1 726754478 JTKVDVXKSGSENF-UHFFFAOYSA-N 391.883 5.304 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1c(Cl)nc2ccccn12 727780874 VPJVQUWIYWOOIE-ZHACJKMWSA-N 379.872 5.316 30 20 GKED CCCCOc1ccc(/C=C(/C(=O)c2cccc(OC)c2)c2ncc[nH]2)cc1 729240339 HNNGIHVMDLZRCT-QNGOZBTKSA-N 376.456 5.021 30 20 GKED N#CCCCCOC(=O)[C@H](Oc1cccc(Cl)c1Cl)c1ccccc1 730333840 OGFFAONWOKABFB-GOSISDBHSA-N 378.255 5.351 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 732903785 WPRURJCJQRFZRS-YLJYHZDGSA-N 390.508 5.264 30 20 GKED C=CC[C@@H](NCc1ccc(Oc2cc(OC)cc(OC)c2)cc1)c1ccncc1 734509629 NDBBWDBODGCQTA-XMMPIXPASA-N 390.483 5.298 30 20 GKED C=CCc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc(OC)c1O 740011673 QQBJHCHCCITKFG-UHFFFAOYSA-N 390.508 5.019 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 752201430 IJDXBSQJSOOURH-HUUCEWRRSA-N 380.435 5.655 30 20 GKED C=C[C@H](CC(=O)O[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 758909430 BYOLAFGZPLZTJI-RTBURBONSA-N 379.500 5.349 30 20 GKED O=C(Nc1cccc(/C=C\C(=O)c2sccc2O)c1)c1ccccc1Cl 771744735 NGHNJJUDFDDUIL-HJWRWDBZSA-N 383.856 5.256 30 20 GKED CC1(C)CC[C@H]2C[C@@H](NC(=O)Nc3cccc(OCC#N)c3)c3cccc1c32 776467592 PKFYKXZVAYZXBT-MGPUTAFESA-N 375.472 5.010 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1 780669622 HKGMCKUGGFYMAG-SIKLNZKXSA-N 399.494 5.125 30 20 GKED Cc1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c(C)c1O 785838062 VERRAWWKFMWCQS-NRFANRHFSA-N 385.467 5.617 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ncc(C(F)(F)F)s3)c2)s1 788521376 PTRWDVLFGXANGF-UHFFFAOYSA-N 379.432 5.052 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 796793412 NWRCLDHTBDASQD-BVUBDWEXSA-N 393.314 5.247 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 797569606 SZMPINARKUQIAH-SWLSCSKDSA-N 394.462 5.829 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cs2)c1 797571500 SELQHRBUFBKNTF-MRXNPFEDSA-N 395.553 5.292 30 20 GKED O=C(Nc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1)c1ccco1 818214305 UXZBBHPWHSDJPA-UHFFFAOYSA-N 375.211 5.295 30 20 GKED C[C@H](N[C@H](C)c1cc(F)c(Br)cc1F)c1ccc(OCC#N)cc1 858376941 SYJVRSHPEIOENW-NWDGAFQWSA-N 395.247 5.041 30 20 GKED Cc1cc(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)c(C)n1[C@@H](C)c1ccccc1 914758733 NQTLQNXYBICUBT-IBGZPJMESA-N 397.522 5.391 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(F)c(F)c2F)cc1 915180050 KOBATTVRZANCLN-MRXNPFEDSA-N 384.332 5.151 30 20 GKED Cc1ccc(N(Cc2ccco2)C(=O)CSCc2ccc(C#N)cc2)cc1C 915850577 FRSYISUMWQBIJF-UHFFFAOYSA-N 390.508 5.235 30 20 GKED CC(=NNc1ccc([N+](=O)[O-])cn1)c1ccc2c(c1)Nc1ccccc1S2 915969918 YBIVYTBJYVAXPQ-UHFFFAOYSA-N 377.429 5.034 30 20 GKED N#Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 915992334 XHCKPRRCNWDNOD-VMPITWQZSA-N 378.771 5.276 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1csc2ccccc12 916945287 VDUXWZOZTQQXNH-CQSZACIVSA-N 389.263 5.169 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917025481 LUVBBNGXUTYSBC-RHSMWYFYSA-N 396.899 5.416 30 20 GKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 917042879 IKRNGJVDJHBWMY-XZVRFQMRSA-N 379.410 5.246 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2[nH]c3ccccc3c2Cl)cc1 918126914 HKDUHFKVCGCPRM-LJQANCHMSA-N 385.854 5.729 30 20 GKED Cc1cc(C)cc(OCCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 919904815 UJTDQTQBAIARHQ-DEOSSOPVSA-N 399.494 5.159 30 20 GKED C=CCOc1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)O)cc1Cl 1776120831 WLZUYPYBKIBFKT-QINSGFPZSA-N 391.854 5.638 30 20 GKED C[C@@H]1C/C(=C\c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2sccc21 1776589746 SRSCTQQZPKJRHU-WDGDVPDHSA-N 394.448 5.392 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ccc(/C=C/C(=O)O)cc1 1777488368 WNAYYDAJYDCNGP-PJABCKPXSA-N 393.439 5.252 30 20 GKED O=C(O)Cc1cccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c1 1777650959 JDPVHEOJCJEUNM-RGEXLXHISA-N 399.471 5.347 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2cc(C)ccc2C)cc1 27178870 GWAVLTNFMIVJOO-UHFFFAOYSA-O 395.573 5.320 30 20 GKED N#C[C@H](C(=O)c1ccccc1SCc1cscn1)c1nc2ccccc2o1 41541023 GYLQXIWXZGXHFX-OAHLLOKOSA-N 391.477 5.067 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21 60603268 VABZULGYHXSGMK-FQEVSTJZSA-N 386.442 5.063 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc1 62523807 LHFXFSFNSYPJEZ-UHFFFAOYSA-N 390.830 5.108 30 20 GKED C[C@@H]1C/C(=C/c2ccccc2)c2nc3ccccc3c(C(=O)N(C)CCC#N)c2C1 71837097 PACOASVYJBTAEX-FBKQIBBUSA-N 395.506 5.343 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 71922912 OTJCNFORBDSEOJ-VGSWGCGISA-N 377.488 5.032 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccccc1C#N 102830900 JKWKIENIRBDANM-ZDUSSCGKSA-N 397.887 5.127 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 108240980 RMFNMPWQEZQRAG-INIZCTEOSA-N 377.513 5.381 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2cc(Cl)ccc2o1 121085966 OJTKODOLUPTRMI-OAHLLOKOSA-N 376.799 5.081 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(c2c[nH]c3ccccc23)CC1)c1ccccc1 151374014 QIBYOGBZIBRLQN-QFIPXVFZSA-N 386.499 5.102 30 20 GKED N#Cc1cccc(COc2cccc(NCc3nc(C(F)(F)F)cs3)c2)c1 151687722 XHKPOQRACGXGJA-UHFFFAOYSA-N 389.402 5.225 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)o1 153997882 NOYYAMCSWHGFTC-IEBWSBKVSA-N 397.544 6.132 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@@H]1c1nc2ccccc2s1)c1ccccc1 160625938 CMNAMAQYZWQMOW-IEBWSBKVSA-N 390.512 5.188 30 20 GKED N#C[C@@H](C(=O)c1ccc2cc(Br)ccc2c1)c1nc2ccccc2o1 178845541 ZIUGRHWLMVREMA-INIZCTEOSA-N 391.224 5.234 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cnn1C(C)C 179909875 MDPGXUMXJBKKNM-IBGZPJMESA-N 392.890 5.334 30 20 GKED Cc1nc(-c2cccc(NCc3cn(C)nc3-c3ccc(C#N)cc3)c2)cs1 180079526 RUHRPVRIVOEGFJ-UHFFFAOYSA-N 385.496 5.003 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2sc(C(C)C)nc2C)ccc1OC 180813867 TVYIRQWFHTZEQA-PBHICJAKSA-N 387.549 5.115 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cc(OC)c(OC)cc1C 191424390 UBXRLFHZKQVKOG-UHFFFAOYSA-N 396.531 5.528 30 20 GKED C[C@H]1CCCCN1Cc1ccc(NCc2ccc(N(C)CCC#N)cc2)cc1 237527710 WGNCNNOXWFBQKY-FQEVSTJZSA-N 376.548 5.023 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(OC3CCCCC3)cc2)c1 237824310 VZMXYLVLXMULIV-UHFFFAOYSA-N 378.516 5.370 30 20 GKED CCN(C(=O)Cc1csc(-c2cccc(C)c2)n1)[C@H](C)c1ccc(C#N)cc1 248070525 GSJTWWXMSCHZOZ-QGZVFWFLSA-N 389.524 5.142 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](COc2ccccc2)C1 272598528 XESWSBNVYLTKMN-MSOLQXFVSA-N 395.528 5.014 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(OCc2ccc(F)cc2)CC1 301942396 XONPIEFDFFXTHD-UHFFFAOYSA-N 395.865 5.085 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)no1 303270315 HDDCUJMXQCAJCP-CYBMUJFWSA-N 397.887 5.499 30 20 GKED N=C(O)C1CCN(c2ccccc2N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1 329007029 NGLRMJNAZYUCKB-NZSAHSFTSA-N 383.536 5.633 30 20 GKED Cc1nc(C(C)(C)C)sc1C(O)=Nc1ccccc1-c1ncc2n1CCCC2 329548547 CGQJPOLDTMHKFE-UHFFFAOYSA-N 394.544 5.585 30 20 GKED CC(C)CCn1ncc(N=C(O)N2CC[C@@H](C(F)(F)F)C2(C)C)c1C(C)C 331151085 ZZDQTPFFRIMOCO-OAHLLOKOSA-N 388.478 5.261 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)CCCC3(C#N)CCOCC3)s2)cc1 410380983 VQONEFBPIRPLKM-IBGZPJMESA-N 397.588 5.520 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)c1 412339703 VEARTTKYMVPPLR-HLAWJBBLSA-N 398.428 5.087 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cc1 425131568 PXZDOSXXUDTEKE-INIZCTEOSA-N 389.524 5.061 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H]1CCCc2nc(CC)sc21)c1ccccc1 435758450 DRJFWJYZAZUDDV-HKUYNNGSSA-N 383.561 5.432 30 20 GKED CC[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 437839268 HYMNGBWSIUPSDH-HSZRJFAPSA-N 377.488 5.703 30 20 GKED Cc1cccc([C@H]2CCCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)c1C 437946782 JYMZCVZENMDNBI-LJQANCHMSA-N 399.441 5.536 30 20 GKED CCSCC[C@H](C)NC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 437979841 YYQHGXLFLUCCNV-KRWDZBQOSA-N 397.544 5.099 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638888 ZOEBCDBCFWMYLC-LBPRGKRZSA-N 387.361 5.548 30 20 GKED N#Cc1ccc(NC(=O)c2occc2COc2ccccc2)cc1C(F)(F)F 443879533 CREBSWOKDMYFPM-UHFFFAOYSA-N 386.329 5.001 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccc(C#N)cc1 445232671 BRGVOSAYCCQYGC-HWPZZCPQSA-N 399.775 5.015 30 20 GKED C/C(=C\c1nc(COCC(F)(F)C(F)F)no1)c1ccc(C(F)(F)F)cc1 445753682 UIUKSXBQKLWTBQ-RMKNXTFCSA-N 398.278 5.066 30 20 GKED CC[C@H](CC(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 457469938 YCJDVJGEGKJACR-CXAGYDPISA-N 376.834 5.615 30 20 GKED N#CCCCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 463110199 UPZOGDVTFZKGQT-UHFFFAOYSA-N 379.460 5.176 30 20 GKED C[C@@H](C(=O)Nc1ccc(Br)c(Cl)c1Cl)c1cccc(C#N)c1 464355610 TZIQNGUBZFLLJG-SECBINFHSA-N 398.087 5.370 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 464949996 FZVUXWWGNNVRFV-MHTWAQMVSA-N 398.428 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(-c2cccnc2)cc1 475547426 LAZHZMIVUIKHJU-UHFFFAOYSA-N 385.511 5.922 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480259974 UMBGBSNLIDKJGG-UHFFFAOYSA-N 381.476 5.019 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C 480566384 ZJWCPJKNLPZXHD-MGPQQGTHSA-N 385.455 5.276 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(CC1CC1)CC1CC1 480826495 UVGKUTRFLAEFCY-UHFFFAOYSA-N 375.472 5.313 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)NCCc3ccc(Cl)s3)c2)cc1 482850925 VBGIBRJMTHRHEO-UHFFFAOYSA-N 382.872 5.038 30 20 GKED COc1ccc(CN(CCc2ccccn2)Cc2ccccc2C(C)(C)C#N)cc1 483064252 UNMYXHAMHNHRBJ-UHFFFAOYSA-N 399.538 5.136 30 20 GKED C=CCN(C(=O)c1coc2cc(F)ccc12)c1nc(-c2ccccc2)cs1 483082038 JIVAVMAUZVBIJB-UHFFFAOYSA-N 378.428 5.528 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)c(Cl)c1)c1nccc2ccccc12 483227327 LDXJTKJOOFCDIP-AWEZNQCLSA-N 385.648 5.141 30 20 GKED CC(C)c1occc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 483297753 TXUHGZYQZWEBFB-LJQANCHMSA-N 378.859 5.964 30 20 GKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)csc2c1 483490230 MJYUBDUDNVBTHE-CYBMUJFWSA-N 381.407 5.445 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F 483616963 COGDDNMREODJJL-ILXRZTDVSA-N 399.482 5.429 30 20 GKED CC[C@H](c1ccc(F)cc1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 494721131 RQOJTHWBCBIAIF-HSZRJFAPSA-N 393.483 5.430 30 20 GKED C=CC[C@H](C(=O)N1CC=C(c2c[nH]c3ccc(OC)cc23)CC1)c1ccccc1 495049531 SWGSWDLGMKQSCV-NRFANRHFSA-N 386.495 5.152 30 20 GKED Cc1ccc2nc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)ccc2c1 496406421 GDFIADZASXQICK-AWEZNQCLSA-N 377.856 5.296 30 20 GKED CC1(C#N)CCN(C(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 507824517 JMZPMXBATLJYAD-NRFANRHFSA-N 398.959 5.315 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)C2CCCCCC2)cc1 508259781 OWJLOXYKYPTDGL-UHFFFAOYSA-N 393.487 5.546 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cscc1Br 511878926 ZPNRJRPMYZYVTM-SNVBAGLBSA-N 381.320 5.015 30 20 GKED N#CCCCOc1cccc(NCc2cccc(OCc3ccccc3F)c2)c1 512981179 MXSVYDLLGBHDDQ-UHFFFAOYSA-N 390.458 5.699 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCCCC[C@H]1c1ccc(C(F)(F)F)cc1 513140062 BEFNKXCOVPTKDA-SFHVURJKSA-N 395.469 5.662 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2s1 513673020 WVTJAQPELLGCJF-AWEZNQCLSA-N 378.453 5.654 30 20 GKED C=CCn1c(S[C@H](C)c2nc(CC)no2)nnc1-c1ccc(C(C)(C)C)cc1 513956183 VIYVQYYABZGHML-CQSZACIVSA-N 397.548 5.227 30 20 GKED C[C@@H]1CCc2sc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c(C#N)c2[C@@H]1C 517316975 SQRFCGJXWGYKTF-IOASZLSFSA-N 378.497 5.004 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CC[C@@H]2c2ccccc2)c1 523949001 GOCVKEYNJLDGIK-OAQYLSRUSA-N 388.854 5.591 30 20 GKED CSc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)ccn1 524706907 PRONZHJPBHSECA-GOSISDBHSA-N 393.899 5.365 30 20 GKED C=CCN(C(=O)c1ccccc1CCC(F)(F)F)c1nc2c(s1)CCCC2 536252350 BUIRITLLJDXTFF-UHFFFAOYSA-N 394.462 5.350 30 20 GKED C=CCN(C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1)C1CC1 539036381 PDNFDYUICKKBKQ-UHFFFAOYSA-N 389.282 5.036 30 20 GKED C[C@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)c(F)c1 540710422 SMOCRJZVBHVPMY-NYHFZMIOSA-N 379.866 5.380 30 20 GKED C=CCSCCNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 542835215 XBWQDJJGAGLUMW-UHFFFAOYSA-N 395.355 5.255 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC(CC#N)CC3)cc2)cc1 543831198 KFVAJOCITFOOED-UHFFFAOYSA-N 379.460 5.035 30 20 GKED CC(C)(C#N)CCN1CCO[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 545983938 BITYXDBSBUDKJW-OAHLLOKOSA-N 394.359 5.037 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)C(=O)Nc1cccc2ccccc12 557559883 XTPMHRUHWADZSI-IRXDYDNUSA-N 389.524 5.531 30 20 GKED Cc1ccc(NC(=O)C[C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 559860718 YFFAYHGVHBJSQE-PXNSSMCTSA-N 383.923 5.390 30 20 GKED C[C@H](NCc1nc(C#N)cs1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 564413918 ARVVEMBWKSYLJS-NSHDSACASA-N 393.459 5.613 30 20 GKED CN(c1ccccc1)c1ccc(CNC2(c3cccc(C#N)c3)CC2)cc1[N+](=O)[O-] 565471529 AYCLXTMMVHMTGK-UHFFFAOYSA-N 398.466 5.013 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1c(F)cccc1F 568427756 MDMLJUZCDVHNIF-UONOGXRCSA-N 389.471 5.441 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CN1CCC(CC#N)CC1 580526093 YMOSMNGRBUSTEU-UHFFFAOYSA-N 379.451 5.263 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@]1(C#N)CC12CCCC2 582646217 FNKNQVVOJIFLTO-HSZRJFAPSA-N 378.447 5.126 30 20 GKED CC[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 583433696 VJLPWFKLLLMISU-HRAATJIYSA-N 378.476 5.178 30 20 GKED N#CCCC[C@H](NC(=O)c1cnc(-c2ccccc2Cl)s1)c1ccccc1 590476082 SLQRBCGFOALYLH-SFHVURJKSA-N 395.915 5.628 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3nc(-c4ccccc4)cs3)cn2)c1 603739745 AXHPTNKLWMNLGJ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1occc1-c1nnc(S[C@@H](C#N)Cc2ccccc2)n1-c1ccccc1 604041752 SWRNBUMJRWKDPW-LJQANCHMSA-N 386.480 5.063 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609209012 PFJAHGFZGNJHFN-SFHVURJKSA-N 385.467 5.884 30 20 GKED CC(C)CCSCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378380 FJTSRNJAJDMHAC-UHFFFAOYSA-N 390.496 5.429 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3ccc4ccccc4n3)cc2)cc1 609500770 WGTYUAQDLQQWFV-UHFFFAOYSA-N 393.446 5.023 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cccc(Cl)c3F)c2)c1 609640306 BBKPIAVWHGAGLU-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC[C@@](C)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1nccs1 610048663 DVWPWBCEJJGPAB-JOCHJYFZSA-N 391.496 5.057 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 610341976 RAVZXNXDEJYGPY-SNVBAGLBSA-N 390.302 5.586 30 20 GKED C[C@H](NCc1ccc(C#N)cc1F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 610811662 HABFNLQTCCQDKP-ZDUSSCGKSA-N 381.432 5.185 30 20 GKED COc1ccc(CNc2cc(Cl)cc3cccnc23)cc1OCCCC#N 610909774 LEBMNFDRQFQRSC-UHFFFAOYSA-N 381.863 5.191 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1C 618349576 KLHWFWAMMLVMFM-UHFFFAOYSA-N 388.427 5.015 30 20 GKED FC(F)Oc1ccc(Cl)cc1CN1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 674463372 PHESEXJGHRCZMZ-NXEZZACHSA-N 397.693 5.114 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1Br)c1ccccc1 677564708 CGLCZUMYEOSHEV-OXJNMPFZSA-N 384.317 5.473 30 20 GKED FC(F)c1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 684368020 YTBOXUUIOURUAG-RYUDHWBXSA-N 375.303 5.623 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=S)Nc1ccccc1C#N 729164756 NMUCBZRYJWNDCM-CYBMUJFWSA-N 396.516 5.177 30 20 GKED Cc1ccc(C2=CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)CC2)cc1 731400153 LJONGCNOXHWWQV-GOSISDBHSA-N 391.540 5.711 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732901691 ZZOFROCIHSIFRR-APWZRJJASA-N 394.927 5.909 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)Nc1cccc(OCCCC#N)c1 733622076 PQFDPBYSJNLVHT-UHFFFAOYSA-N 385.467 5.989 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3c[nH]c4ccc(OC)cc34)cs2)cc1 734306582 HARVTQTWMHWYAK-BJMVGYQFSA-N 390.464 5.205 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)c3cccc(Cl)c3)n2)cc1 737321789 AUIQFERSJVSWST-SFHVURJKSA-N 394.927 5.926 30 20 GKED CCCOc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc1OC 740013739 JRJMAELMQXZSCN-UHFFFAOYSA-N 392.524 5.374 30 20 GKED C[C@@H](OC(=O)CCCCOc1cccc(C#N)c1)c1ncc(-c2ccccc2)o1 741319987 ORNTUUIHXOMBJE-QGZVFWFLSA-N 390.439 5.067 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1ccc2ccccc2n1 741427309 IMGWWPPJHQWWGN-ULQDDVLXSA-N 396.368 5.113 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3cccc(-c4ccncc4)c3)cs2)cc1 741473505 RHSJMCOIGGCPRQ-YFHOEESVSA-N 398.487 5.777 30 20 GKED CN(C)C(=O)Sc1ccc(CON=Cc2ccccc2C(F)(F)F)cc1 753118522 RHKUNKIGTXNSOK-UHFFFAOYSA-N 382.407 5.030 30 20 GKED Oc1nc(NN=Cc2c(Cl)cccc2Oc2ccccc2)nc2ccccc12 769584763 IVTVKFZDTXBJAU-UHFFFAOYSA-N 390.830 5.227 30 20 GKED CCCN(C[C@@H]1CCCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775487522 JJPCZLKBYDWDIM-GOTSBHOMSA-N 391.515 5.155 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(OCC#N)cc1 776155097 YCKXYDXNCBLHRJ-IACUBPJLSA-N 394.359 5.149 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C(C)=C\c3ccc(C)cc3)n2)cc1 779195144 RKCLJMDYEBGHNI-VMTBQTDASA-N 388.492 5.407 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3ccc(C)cc3)n2)cc1 779195177 SAQIMZYOQHNLLZ-UZLBHIALSA-N 390.508 5.182 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cccc(-c2c(F)cccc2F)c1 780153727 YCFMHXZMQNPEOV-CQSZACIVSA-N 378.378 5.175 30 20 GKED CN(CC1(c2ccccc2)CC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782011768 GXHUDADRCMIUEU-XMMPIXPASA-N 395.506 5.538 30 20 GKED C[C@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(-c2cccc(C#N)c2)cc1 782522516 CQTVJLHRFCRDJG-HNNXBMFYSA-N 375.403 5.123 30 20 GKED C=CCn1c(SCc2cc3ccccc3c(Cl)n2)nnc1-c1ccco1 787490807 LKCYHLQCTLGIMY-UHFFFAOYSA-N 382.876 5.218 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCC(F)(F)C1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 796648510 CDSYDKULEYIHSB-XMOPGZRTSA-N 390.499 5.223 30 20 GKED N#Cc1cc(NC(=O)N2CC[C@H]2c2ccc(Cl)cc2)ccc1OC(F)(F)F 799459013 ACIGJMBJIHPCJL-HNNXBMFYSA-N 395.768 5.089 30 20 GKED Cn1cc(/C=C/C(=O)c2ccc(-c3ccccc3Cl)s2)c(C(F)F)n1 812241579 KDQUWIMTMSOBTD-VOTSOKGWSA-N 378.831 5.636 30 20 GKED C=CCC1(C(=O)N2CCC(O)(c3ccccc3C(F)(F)F)CC2)CCCCC1 830514288 DKTJRJBVPPHXQV-UHFFFAOYSA-N 395.465 5.042 30 20 GKED C[C@@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCCO1 838786367 IKPYJVMLYAHSIY-ACJLOTCBSA-N 395.311 5.252 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)c(-c2ccncc2)n1 920066392 ZUKHOBWQSFNFFC-SREVYHEPSA-N 389.455 5.246 30 20 GKED COc1ccc(O)c(C=Nc2ccc(O)c(-c3nc4ccccc4s3)c2)c1 920943856 BRUKKZIZMKEFOS-UHFFFAOYSA-N 376.437 5.134 30 20 GKED O=C(O)c1ccc(NN=C2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1F 1776074079 GVACRIKKNRAHRK-HNNXBMFYSA-N 394.368 5.668 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cccc(Br)c3)c2c1 1776114643 VNFSVPHKBMHJPO-GQCTYLIASA-N 387.254 5.258 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3)s2)cc1CC(=O)O 1776131783 IRHMDBZWLMOSRL-SOFGYWHQSA-N 396.439 5.086 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cnc(-c2ccsc2)s1 1776354927 LGKSMPSBNYPZTJ-SNAWJCMRSA-N 399.493 5.253 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NC[C@H](C)Cc1ccc(C(C)(C)C)cc1 1776782342 KASSSDOMPRWUND-KNQAVFIVSA-N 375.597 5.956 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)[C@H](C)c2ccccc2)cc1 1776788279 WHAVEKJLAAJFAP-XXBNENTESA-N 383.532 5.382 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(/C=C\C(=O)O)cc3)s2)cc1 1777430641 XWMJGULJEKXEQP-FOIMCPNXSA-N 389.476 5.421 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)n1 41520363 GMRZAXIBLXDZND-KRWDZBQOSA-N 386.398 5.627 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1F 41548528 RSWYHOGZEQMVKU-GFCCVEGCSA-N 378.350 5.253 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1cccs1 56800262 QGLRSQLJEVXCAO-UHFFFAOYSA-N 377.469 5.384 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2F)n1)[C@@H](C)c1ccc(C#N)cc1 64311776 AOPOJKGFCSSCDX-AWEZNQCLSA-N 379.460 5.044 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CCCOc3ccccc3Cl)n2)cc1 64868225 FEMNXRCKJVBLCP-UHFFFAOYSA-N 397.887 5.133 30 20 GKED C[C@@H](C/C(O)=N/S(=O)(=O)/C=C/c1ccccc1)c1ccc(C(F)(F)F)cc1 66002835 NGFYXSLZYIXKAJ-GETOMWPZSA-N 397.418 5.156 30 20 GKED N#C[C@@H](C(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1nc2ccccc2o1 66516416 DBVXGODBTNTTAJ-NSHDSACASA-N 399.884 5.085 30 20 GKED CC(C)Oc1ccc(NC(=O)N(C)Cc2ccc(C#N)cc2)c(C(F)(F)F)c1 105059609 UNVOQOWOAMPMNO-UHFFFAOYSA-N 391.393 5.028 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccc2ccccc2n1 108145826 NCXHFKIRDFTPOE-HNNXBMFYSA-N 393.537 5.217 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 108408315 SMCQIOVENIMFLI-CRAIPNDOSA-N 381.545 5.303 30 20 GKED Cc1ccc(OCc2nc(CNc3cccc(OCCCC#N)c3)cs2)cc1 114764106 FMFYIUBTGGUPIV-UHFFFAOYSA-N 393.512 5.325 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)s1)c1nc2cc(Cl)ccc2s1 120009281 ANSVMUDUMXVJRY-QMMMGPOBSA-N 397.706 5.264 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(OC)cc1 178710058 QCOJGKKDQHYNST-YOEHRIQHSA-N 397.425 5.200 30 20 GKED C[C@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@H](CCC#N)c1ccccc1 181573001 RICCHVZFAUWVPF-CRAIPNDOSA-N 389.421 5.057 30 20 GKED CCc1c([C@H](C)NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)oc2ccccc12 181956275 SMBMWKHTZBROFI-FUHWJXTLSA-N 392.499 5.536 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1 245410116 PMCZBTLGKGIUCZ-WHSLLNHNSA-N 397.519 5.692 30 20 GKED Cc1nc(/C=C\c2cc(C#N)cs2)sc1C(=O)/C=C\c1cc(C#N)cs1 255003222 INMMBMDUZCZUOV-JVLMNHKTSA-N 393.518 5.384 30 20 GKED C=CCOc1c(Br)cc(CN[C@H](C)c2ccccc2)cc1OCC 409612768 NKUGUBLLOUSTNJ-OAHLLOKOSA-N 390.321 5.263 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)Nc2ccc(C#N)cc2Cl)CC1 426156223 GLKBSDOYHLBIQD-UHFFFAOYSA-N 392.890 5.413 30 20 GKED N#C[C@H](C(=O)c1cncs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 429689374 OBQXLUPXSQJQOW-SNVBAGLBSA-N 380.281 5.063 30 20 GKED CC(C)(C)Cc1nc(-c2ccc(C(=O)Nc3ccc(C#N)cc3Cl)cc2)no1 430367315 BNJNSHYAWGKTQN-UHFFFAOYSA-N 394.862 5.103 30 20 GKED Cc1c(C#N)cccc1NC(=O)CCSc1ccnc2cc(Cl)ccc12 431874485 DIMPUWYHHYDYMT-UHFFFAOYSA-N 381.888 5.189 30 20 GKED CC(C)CC(=O)Nc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 432687927 BEJSAYWZOVRAHV-OAQYLSRUSA-N 392.503 5.228 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)[C@H](C#N)CCc2ccccc2)cc1 433236088 WTYRVHHWACXTRY-IBGZPJMESA-N 386.451 5.199 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1)c1ccccc1 435114575 UJVMCMKGUPPKAW-RTWAWAEBSA-N 394.515 5.258 30 20 GKED C=CCC[C@@H](NC(=O)c1cc(NC(=O)C(C)C)ccc1Cl)c1ccccc1 435289327 NODGSWQUNGWPAQ-HXUWFJFHSA-N 384.907 5.372 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@]12CCCc1ccccc12 440634951 JIEPHZTVISNHHI-HFXUHXBXSA-N 376.525 5.171 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ncsc1-c1ccccc1 445829758 LETKZIMILVJPEI-AWEZNQCLSA-N 379.510 5.314 30 20 GKED CCN(C(=O)c1c(F)cc(C#N)cc1F)[C@@H](C)c1cccc(C(F)(F)F)c1 446066049 HEGQGPGLDMKLQH-NSHDSACASA-N 382.332 5.079 30 20 GKED C=C(C)Cn1c(N2CCC[C@H]2c2nc3ccccc3s2)nnc1C(C)(C)C 460566856 UQGCNZJEDXXYKT-INIZCTEOSA-N 381.549 5.103 30 20 GKED C[C@@H](C(=O)NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1cccc(C#N)c1 462316457 SIUJGJPILOLATC-GFCCVEGCSA-N 392.808 5.139 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2)cc1 467096005 WWBSCRIOSSXDDI-NRFANRHFSA-N 395.487 5.671 30 20 GKED CCN(C(=O)c1ccc(Br)c2cc(C)oc12)c1ccc(C#N)cc1 468023214 WZHRAZNZWGACMF-UHFFFAOYSA-N 383.245 5.042 30 20 GKED C[C@H](S[C@@H](c1ccccc1)c1ccc(Cl)cc1)C(=O)NC1(C#N)CCC1 468474965 LCKPJQIJBSMFCH-KXBFYZLASA-N 384.932 5.114 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1ccc(Sc2ccccc2C#N)cc1 470622287 GAZVPZOUUFRWQU-GUYCJALGSA-N 390.430 5.122 30 20 GKED CCC(C)(C)OCc1cccc(NCc2nnc(-c3cccc(C#N)c3)o2)c1C 471662401 LNDYJWJYUIKVMG-UHFFFAOYSA-N 390.487 5.234 30 20 GKED N#CC[C@H](CC(=O)NCc1ccc(COCc2ccccc2)cc1)c1ccccc1 474891339 DBMPELHGMAODDP-RUZDIDTESA-N 398.506 5.107 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4[nH]ccc4s3)c2)cc1 474900949 RENDAAWDYAKCQI-UHFFFAOYSA-N 387.464 5.127 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1N(C)C1CCCC1 475037793 HKQNALMGMPYHGI-UHFFFAOYSA-N 388.515 5.157 30 20 GKED CC(C)Oc1ccc2ccccc2c1CNC(=O)C[C@@H](CC#N)c1ccccc1 476692536 QULNSOSCYSRSNC-OAQYLSRUSA-N 386.495 5.331 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)[C@H](C#N)c1nccc2ccccc12 483227867 LYRBWKSQCBZGHW-OAQYLSRUSA-N 389.414 5.389 30 20 GKED C=CCSc1ccccc1C(=O)NCc1csc(CCc2ccccc2)n1 486717724 RHWCXPYJSYUNSH-UHFFFAOYSA-N 394.565 5.136 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 494646476 GHCGOKLIWZBYGX-QFIPXVFZSA-N 398.526 5.232 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CC=C(c3cccc4ccccc34)C2)c1 501546172 WXCAOEHGIFCYCZ-UHFFFAOYSA-N 396.490 5.186 30 20 GKED CCc1nc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c(C)o1 507765741 GQEKVPZHHZQRNE-UHFFFAOYSA-N 381.819 5.115 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 509697845 LWLKDNWPBNAOCK-OAQYLSRUSA-N 393.849 5.456 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3sccc3Cl)cc2F)c1 510858609 ZULKSZXAMTZTEY-UHFFFAOYSA-N 386.835 5.244 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(COc2ccccc2C#N)o1 515552235 KEAWFPIZMYIGOM-UHFFFAOYSA-N 394.858 5.046 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NC[C@H]3CCc4ccccc43)cc2)cc1 520326848 PTFLOZRUUOVTCV-OAQYLSRUSA-N 382.463 5.005 30 20 GKED N#Cc1cc2c(nc1SCc1ccc(OCc3ccccn3)cc1)CCCC2 520955597 UVTTZKSFVOXONN-UHFFFAOYSA-N 387.508 5.098 30 20 GKED CC(C)C[C@H](C)Oc1cc(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)ccn1 523616081 URXAUAPGHVCREK-KRWDZBQOSA-N 394.519 5.018 30 20 GKED COc1cccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 524120838 XPYZTBJUSBFVHG-UHFFFAOYSA-N 387.439 5.098 30 20 GKED Cc1cc(C(=O)CS[C@@H](C)c2ccc(C#N)cc2)c(C)n1CC(F)(F)F 533814026 PMOHUPYRHLOWOM-AWEZNQCLSA-N 380.435 5.216 30 20 GKED N#CCCCCN[C@H](COc1cccc(F)c1)c1cccc(C(F)(F)F)c1 538222230 OWUHEWDOYPQLPN-LJQANCHMSA-N 380.385 5.248 30 20 GKED CC(C)COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(CC#N)CC1 541968514 QVDOJQMCACJGOA-NRFANRHFSA-N 385.552 5.144 30 20 GKED N#CCC1CCN(C(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)CC1 543831323 FQYDHXVGGLRPJL-UHFFFAOYSA-N 386.826 5.339 30 20 GKED C[C@@H]1C[C@H](N[C@@H](CCCC#N)c2ccccc2)c2cccc(Br)c21 550827081 JRIBLIHRQYETMM-XPGWFJOJSA-N 383.333 6.022 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(OC(F)F)c(F)c3)cc2)ccn1 554982485 NHZXSIUXEVCTEW-UHFFFAOYSA-N 385.345 5.098 30 20 GKED C=CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 557397606 JUDDFYVWIQZJNN-ISLYRVAYSA-N 397.478 5.247 30 20 GKED COc1cc(CN[C@H]2CCCc3cc(C#N)ccc32)ccc1OCc1ccccc1 557517315 IXYLTMLZRIHLDC-DEOSSOPVSA-N 398.506 5.313 30 20 GKED N#Cc1ccc(N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)cc1[N+](=O)[O-] 562235389 CAHUXZPVVDBEKM-MRXNPFEDSA-N 394.431 5.219 30 20 GKED N#Cc1c(NC(=O)c2ccccc2Sc2ccccc2)sc2c1CCCC2 564589551 AURWUXHANWRQKB-UHFFFAOYSA-N 390.533 5.902 30 20 GKED N#CC1(N(C(=O)c2ccc(-c3nc4ccccc4s3)s2)C2CC2)CCC1 568786699 BADVLIWXZYFGNY-UHFFFAOYSA-N 379.510 5.076 30 20 GKED C=C[C@@](C)(CCOC)c1nc(-c2ccc(OC(C)C)cc2C(F)(F)F)no1 584258068 YQTOIQUWOUATHZ-SFHVURJKSA-N 384.398 5.023 30 20 GKED CC(C)(C#N)c1ccc(CNCc2cccc(NC(=O)C3CCCCC3)c2)cc1 594496293 JPDMJFQEPWFRMS-UHFFFAOYSA-N 389.543 5.296 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 597074921 HEFYTTDCFMUQGT-APWZRJJASA-N 387.405 5.318 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCOc1cccc(Cl)c1Cl 603755242 JQMFYLRABLUQAQ-UHFFFAOYSA-N 391.298 5.071 30 20 GKED Cn1ccc2c(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cccc21 608877278 XDDJXGNLEPJYIB-UHFFFAOYSA-N 395.462 5.076 30 20 GKED Cc1ccc(C)c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 609378596 XXQKEEOIEWTPFY-UHFFFAOYSA-N 378.419 5.580 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 609434413 HEDUQFVIDPXLRT-DEOSSOPVSA-N 397.478 6.028 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1C(F)(F)F 609498931 XIXAVSNSOHBSPF-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)cc1 609507338 DQGBRXFWINUSFJ-UHFFFAOYSA-N 385.398 5.077 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl 610106902 KUEJXBVXOGQVTI-IAGOWNOFSA-N 394.833 5.281 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 611300724 WPWKZLTXZOEFJY-OAHLLOKOSA-N 391.858 5.198 30 20 GKED C=CC[C@@H](CC)NCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 639133169 ZWQFXUXHQNFLGO-OAHLLOKOSA-N 397.466 5.291 30 20 GKED FC(F)(F)c1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 683200435 HVBZTEORFAZLHR-BRPSZJMVSA-N 399.322 5.766 30 20 GKED FC(F)(F)c1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)s1 683200437 HVBZTEORFAZLHR-YUMQZZPRSA-N 399.322 5.766 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2)[C@@H](C)c2cccs2)c1 726484200 HDVDPJLEKKYVIX-KRWDZBQOSA-N 376.550 5.690 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(CCc2ccccc2)C2CC2)cc1 728738854 UKXXLWXVIOLXNI-VWLOTQADSA-N 395.506 5.581 30 20 GKED O=C(Cc1ccc(OC(F)F)cc1)Nc1ccc(C(F)(F)C(F)(F)F)cc1 729832570 YFAIPFVTCZSZBR-UHFFFAOYSA-N 395.274 5.123 30 20 GKED Cc1cc(COc2ccc(/C=C3/CCc4sccc4C3=O)cc2)oc1C(=O)O 729936672 FUQPOPVNKAWZPR-PTNGSMBKSA-N 394.448 5.139 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(\CC(=O)O)c2nc3cc(Cl)ccc3s2)cc1 730436957 OATXIUVAAFSKOD-ACLQVGRQSA-N 398.871 5.256 30 20 GKED C[C@@H](Cc1ccccc1Cl)NC(=O)Nc1ccccc1S[C@H](C)CC#N 731400914 XSWBSCGALYUAHK-LSDHHAIUSA-N 387.936 5.487 30 20 GKED CC(C)C(=O)Nc1cccc(OC(=O)c2ccccc2-c2ccccc2C#N)c1 733172542 JCHOAZXNTRCTFC-UHFFFAOYSA-N 384.435 5.039 30 20 GKED C=CC[C@@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccncc1 734234812 UPSSHOSICCKNNM-HSZRJFAPSA-N 381.479 5.132 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1ccncc1 734678084 CBYAHDSGLYDULK-HSZRJFAPSA-N 389.474 5.250 30 20 GKED CC(C)c1cc(=O)oc2cc(OCc3cc(Cl)ccc3OCC#N)ccc12 735230677 OLQQQRKIVYAVHT-UHFFFAOYSA-N 383.831 5.051 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(SC(F)F)cc1)C(=O)C1CCCCCCC1 744024877 BVUNFDYWWVQAKO-MRXNPFEDSA-N 380.460 5.009 30 20 GKED Cc1ccsc1[C@@H]1C[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 748833483 CRQNPUWNLRQCAH-BZUAXINKSA-N 398.940 5.813 30 20 GKED Cc1sc2ncn(N=Cc3ccc(Sc4ccccc4)cc3)c(=O)c2c1C 753918850 PETSSMOOFQOXTA-UHFFFAOYSA-N 391.521 5.108 30 20 GKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 753935891 BHIFPYZDLBNNSN-SUMDDJOVSA-N 387.508 5.371 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)Cc2ccc(OCC#N)cc2)cc1 764281627 GPKZKIPVAIBRNA-QHCPKHFHSA-N 376.500 5.009 30 20 GKED Cn1c([C@H](C#N)C(=O)C2(c3c(Cl)cccc3Cl)CCC2)nc2ccccc21 774033763 FDOCRYUOJYCNPB-CYBMUJFWSA-N 398.293 5.178 30 20 GKED Cn1cc(CNc2ccc(OCc3cccc(C#N)c3)cc2)c(-c2ccccc2)n1 779594629 LCQZRRYPRYHBOY-UHFFFAOYSA-N 394.478 5.150 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C/C(=O)c1cccc(N2CCOC2=O)c1 781110081 FDNNMAYNIVVPDA-OUKQBFOZSA-N 399.446 5.215 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 782946206 LAUMGDKPTIXPCD-QHCPKHFHSA-N 397.478 5.043 30 20 GKED C=CCCN(C)Cn1nc(Nc2ccc(SC(F)F)cc2)sc1=S 786101740 OYMAGTIJPPRVFR-UHFFFAOYSA-N 388.534 5.198 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2cnc3ccccc3n2)cc1 792099788 GPISVLPTAGOVJW-FQEVSTJZSA-N 399.494 5.202 30 20 GKED CC[C@H](C)CON=Cc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 793144896 GFOJOUUIUPNNNO-LBPRGKRZSA-N 399.438 5.243 30 20 GKED CC[C@](C)(C#N)C(=O)O[C@@H](C)c1cnc(-c2ccc(Br)cc2)s1 797172348 RWFYSEMDVIBFBL-APPDUMDISA-N 393.306 5.117 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCOc2ccc3ccccc3c2)s1 797572790 ILDJBJKEVYACDU-SFHVURJKSA-N 378.497 5.239 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc(COCc2ccccc2)cc1 806302306 GVQLHDCIDHAWMX-UHFFFAOYSA-N 384.479 5.071 30 20 GKED CON(Cc1ccccc1Cl)C(=O)Nc1ccccc1S[C@H](C)CC#N 810184204 NAQKTYKCBCJEKS-CQSZACIVSA-N 389.908 5.330 30 20 GKED CCCCCCCC[C@H](C)C(=O)NC1CCN(C(=O)Nc2ccccc2)CC1 820200231 CXHHNABFTHBONT-IBGZPJMESA-N 387.568 5.186 30 20 GKED CSCC1(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 845445646 RCJYASOUOJJMRP-AWEZNQCLSA-N 376.934 5.173 30 20 GKED CC(C)(C)OC(=O)NCc1cccc(NCc2ccc(C(C)(C)C#N)cc2)c1 848541961 AMSJDEOVDOTPCN-UHFFFAOYSA-N 379.504 5.125 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)n2)cc1 860503081 TVRKNRHAERLKCA-ZCNNSNEGSA-N 388.492 5.107 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3ccc(OC(F)F)cc3)c(Cl)nc21 912859083 TTYPBBVTWKUMCT-YVMONPNESA-N 391.805 5.163 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)/C=C\c3cccc(F)c3)c2)cc1 916449587 HAVKYPXLKNNLLF-XFXZXTDPSA-N 386.426 5.123 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc4c(C)c(C)[nH]c34)n2)cc1 916975462 ZYTSRIRQFJDUSE-IBGZPJMESA-N 385.492 5.707 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 918713147 GEUSSEWTEFJFNO-HJWRWDBZSA-N 384.382 5.597 30 20 GKED Sc1nnc(-c2cccc(Cl)c2)n1N=Cc1ccccc1OC1CCCC1 920364786 VRVLPSXADYJNBL-UHFFFAOYSA-N 398.919 5.091 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3/Cc4cc(C)ccc4C3=O)c2)cc1 921264658 WRVTZHKUGMAPNH-MOSHPQCFSA-N 383.447 5.078 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1cc(F)ccc1Oc1ccc(Cl)cc1 1776012164 GJLUWSZQIVFWJQ-UHFFFAOYSA-N 398.821 5.806 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1OCc1ccccc1 1776786958 DMCYJNYNWVMGHT-QFIPXVFZSA-N 383.532 5.559 30 20 GKED CCCCCCCOc1cccc(/C=C\c2ncc([N+](=O)[O-])cc2C(=O)O)c1 1776789221 XGBKFEHSBCBWJU-KHPPLWFESA-N 384.432 5.208 30 20 GKED CCc1c(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)oc2ccccc12 1776956192 JMWWAFHXIUBBSQ-CLFYSBASSA-N 376.433 5.804 30 20 GKED Cc1nn(C2CCCCC2)cc1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1777555726 PBMOJNDPSZEQTN-PKNBQFBNSA-N 396.487 5.078 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2nc3ccccc3s2)cc1 22458193 DGKGMTXZMJAVAR-OAHLLOKOSA-N 381.526 5.032 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(F)cc2Cl)cc1 55823669 WVZUKCVKRCAZDQ-UHFFFAOYSA-N 394.833 5.376 30 20 GKED CC(C)c1ccsc1C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 56099099 KTTXQAGQHJYXBZ-UHFFFAOYSA-N 389.480 5.248 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc(O)c2)cc1Cl 56628657 CWQRBYNZICQCFG-HXUWFJFHSA-N 391.858 5.023 30 20 GKED C[C@@H](Cc1ccccc1F)NC(=O)c1ccccc1Sc1ccccc1C#N 64770707 PPFSTGUOWXTNCR-INIZCTEOSA-N 390.483 5.210 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Cc1csc(-c2ccccc2Cl)n1 65774857 GDUPCCVQZDBOAE-UHFFFAOYSA-N 396.943 5.263 30 20 GKED Cc1c(C#N)c(NC(=O)CS[C@@H](C)c2ccc(F)cc2)n(C2CCCC2)c1C 109369783 UXJRMPAYWPZBOR-INIZCTEOSA-N 399.535 5.664 30 20 GKED C=C1CCN(C(=O)Cc2sc(-c3ccccc3)nc2-c2cccs2)CC1 111195368 MYDMEJRDBTZZQR-UHFFFAOYSA-N 380.538 5.260 30 20 GKED Cc1ccc(NC(=O)CS[C@@H](C)c2ccc(C#N)cc2)c(Br)c1 118445280 DXXLNOSNKFVNJM-ZDUSSCGKSA-N 389.318 5.062 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(F)c(F)c1)c1nc(-c2ccccc2)cs1 120130156 TUSAGQJNOXZKPY-INIZCTEOSA-N 382.435 5.287 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)n1 177777272 XRAZBVQCDSHJEP-HNNXBMFYSA-N 399.903 5.384 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)CNc1ccccc1S[C@H](C)CC#N 178391488 CDAQMCJPASRQFE-CRAIPNDOSA-N 399.585 5.090 30 20 GKED N#Cc1ccccc1CSCCNC(=O)c1c(Cl)ccc(Cl)c1Cl 179517695 ILNUYXFUKPIXMY-UHFFFAOYSA-N 399.730 5.182 30 20 GKED COc1ccc(-c2csc(CN[C@H](C)c3ccc(OCC#N)cc3)c2)cc1 181850205 RFZRTFGOWOGROL-MRXNPFEDSA-N 378.497 5.177 30 20 GKED CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 281544409 XFGOWURSVSYFPJ-FUHWJXTLSA-N 397.548 5.056 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@H]4CCC[C@@H](C)C4)no3)C2)c1 329710297 MCDPTUNAJMGDHG-NJAFHUGGSA-N 382.508 5.097 30 20 GKED Cc1cc(Br)c(N/C(O)=N/CC2CCC(C#N)CC2)cc1Cl 331282219 VODKRQGJNIBTEO-UHFFFAOYSA-N 384.705 5.067 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Br)c(Cl)c2)cc1 387543811 WENGDVUOUGWKSZ-UHFFFAOYSA-N 377.669 5.156 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 432812578 IZRZUKJEUNXCHI-ZDUSSCGKSA-N 385.455 5.530 30 20 GKED N#Cc1csc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c1 437330552 YXHUQOCHVCFCAU-UHFFFAOYSA-N 380.281 5.302 30 20 GKED COc1cc(C)sc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437482704 PDJMMRGLZCWBOB-UHFFFAOYSA-N 382.416 5.121 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)Nc2ccc(CC#N)cc2)cc1 437603223 OMRZKKFBVLGPOL-GOSISDBHSA-N 399.494 5.653 30 20 GKED N#CCCSc1ccccc1NCCOc1cc(F)cc(Br)c1 438322067 AOIYJFHEYVUVHV-UHFFFAOYSA-N 395.297 5.085 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)Nc1cccc(C#N)c1C 438890734 BOFCICUIIQLOOT-UHFFFAOYSA-N 386.238 5.389 30 20 GKED C=CCC[C@H](NC(=O)NCc1sc(C)nc1C)c1ccc(C(F)(F)F)cc1 440863853 VQQAVCQTYJQYOG-INIZCTEOSA-N 397.466 5.285 30 20 GKED COc1cccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 442189187 BLQQAIPBAYTXOT-MRXNPFEDSA-N 397.544 5.046 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@H]2CCCC2(F)F)cc1 452861868 ZERSRHDCCVIFOL-QGZVFWFLSA-N 386.467 5.016 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 464758002 NYYNIOZEKVAAEC-GOSISDBHSA-N 394.478 5.468 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCC[C@H]3Cc3ccccc3)ccc21 469258604 SMPAPPBVLAUVNA-REWPJTCUSA-N 387.527 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCSc2ccc(F)cc21 475551873 YLMJPUQJNUKPGX-LJQANCHMSA-N 384.520 6.036 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)C[C@H](CC#N)c3ccccc3)c(C)c2c1 475647715 MELZUMBAFZALNC-WMZOPIPTSA-N 376.456 5.015 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1Cl 477799354 HVQHPZREMNXGQD-CHWSQXEVSA-N 391.899 5.614 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc4ccccc4c3C)n2)cc1 484560552 VOWZNHVCYNRHRV-GOSISDBHSA-N 399.475 5.165 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(OCc2cscn2)c1 485359986 QGSKFEXLDVOZJP-UHFFFAOYSA-N 385.533 5.322 30 20 GKED CC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cc(F)cc(Br)c1 486083473 CXPQDFOENPBPFC-BBATYDOGSA-N 379.248 5.401 30 20 GKED C=CCN(C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2c(s1)CCCC2 486509306 BGKWCBRSAXFDBI-UHFFFAOYSA-N 377.922 5.051 30 20 GKED Cc1cc(F)c2nc(O)cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2c1 489419629 WTKRJMKAYLWKBN-ZDUSSCGKSA-N 395.459 5.035 30 20 GKED CC(C)Cn1ncc(NC(=O)c2ccccc2-c2ccccc2C#N)c1C(C)C 499456977 LUDVDMSALCYAMN-UHFFFAOYSA-N 386.499 5.453 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)N[C@@H](C#N)c2ccc(Cl)cc2)C1 501208864 LIBBNWKLZOOTGK-AHRSYUTCSA-N 376.928 5.177 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3cccc(F)c3)c(Br)c2)CCC1 508336197 VRFQOYTUNXHULO-UHFFFAOYSA-N 389.224 5.013 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 508605711 SCXZSRUMHCZBSJ-UHFFFAOYSA-N 392.484 5.002 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(Br)c(Cl)c1Cl 509316507 KAFOZPYIXMGNAL-UHFFFAOYSA-N 384.060 5.188 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509906377 XZBQSHICUJMQIA-OAQYLSRUSA-N 377.488 5.128 30 20 GKED C[C@@H](N[C@H](C)c1ccncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 510971575 YLJQNHYSTLGLMV-NXEZZACHSA-N 380.307 5.670 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC)c1ccc(Cl)s1 513079085 ZBULRNVUCPRYBB-MRXNPFEDSA-N 375.925 5.346 30 20 GKED CN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1cccc2ccccc12 513504685 FWGXIMWCORAIFS-UHFFFAOYSA-N 392.458 5.567 30 20 GKED Cc1cccc(CN(CC(C)C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 518377463 IAUMQVXBRTVWKD-UHFFFAOYSA-N 399.494 5.352 30 20 GKED N#Cc1cn(CC(=O)c2ccc(-c3ccccc3)cc2)c2ccc(Cl)cc2c1=O 518473524 OJEYHANOTNAWFD-UHFFFAOYSA-N 398.849 5.076 30 20 GKED CC(C)Oc1ccc(CCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 518683253 OFVQCSKJYQQLSG-KRWDZBQOSA-N 397.544 5.090 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H]2C[C@@H]2c2cccc3ccccc23)cc1 519456279 FUFCOCAWZGXTEI-DNQXCXABSA-N 384.479 5.289 30 20 GKED C[C@@H](SCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccc(C#N)cc1 522840583 SMUMQNQRFHJXSU-OAHLLOKOSA-N 394.496 5.033 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2CCSCC2)cc1Cl 532134450 SRFMKJJZEJXNMC-LJQANCHMSA-N 384.932 5.467 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(COc2ccccc2)cc1 539176952 CZLQWDLMJGQWKR-UHFFFAOYSA-N 397.478 5.357 30 20 GKED N#CC1CCN(C(=O)c2cc(Cl)ccc2Sc2ccc(Cl)cc2)CC1 540473794 SQPRSMAEPSMKFH-UHFFFAOYSA-N 391.323 5.520 30 20 GKED Fc1ccc2nc(CN[C@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)oc2c1 540519518 AKNMQCIIYHHTTM-OAHLLOKOSA-N 392.274 5.379 30 20 GKED FC(F)(F)c1cc([C@H](NCc2ccno2)C(F)(F)F)cc(C(F)(F)F)c1 541195009 VYXUYFKJHRTBFX-NSHDSACASA-N 392.221 5.105 30 20 GKED CCC(=O)Nc1cccc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 542000095 BYLSNMNNVGQYCB-KRWDZBQOSA-N 397.478 5.065 30 20 GKED C[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c2ccccc21 542587609 SAYXFIGJTZFNJN-KRWDZBQOSA-N 383.451 5.290 30 20 GKED N#CCCCNC(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 544232458 DEFBWNBAMJINDQ-UHFFFAOYSA-N 390.306 5.026 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)ccc1Cl 544403648 KFMWYANEOQGSQH-UHFFFAOYSA-N 390.830 5.108 30 20 GKED C[C@@H]1C[C@@H](c2noc(-c3ccc(Sc4ccccc4C#N)cc3)n2)CCO1 547219944 LMGXTMIBHSICAP-ZBFHGGJFSA-N 377.469 5.042 30 20 GKED C=CCC(F)(F)c1nc([C@@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 551096795 DKCKSYICKPUXAW-LBPRGKRZSA-N 380.288 5.021 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2C(F)F)cc1Cl 554133681 CIQLKJCCFCZBPP-FUHWJXTLSA-N 389.833 5.257 30 20 GKED N#Cc1cccc(-c2nnc(CN3CC4(CCCCC4)[C@@H]3c3ccccc3)o2)c1 565702612 DIDJTRRJCIBNIA-QFIPXVFZSA-N 384.483 5.116 30 20 GKED CC(C)c1nn(-c2ccccc2)cc1CNCc1ccc(C#N)cc1C(F)(F)F 570764049 CAVWGQJUBWNBHY-UHFFFAOYSA-N 398.432 5.176 30 20 GKED CCO[C@H](C)c1nc(CSCc2ccc(Br)cc2C#N)cs1 579051163 UMOCCZCDZKBSSB-LLVKDONJSA-N 397.363 5.308 30 20 GKED COc1ccc([C@H](NC(=O)CCCCC#N)c2ccc(C(F)(F)F)cc2)cc1 594003428 BCBLXYFSTCITBG-HXUWFJFHSA-N 390.405 5.004 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)cn2)cc1 603763517 CWVUGPSZJBSELW-RBUKOAKNSA-N 389.842 5.141 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 604027067 BFAVCWXLCLPRSK-UHFFFAOYSA-N 387.826 5.322 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC[C@H](c2cc3ccccc3[nH]2)C1 608782288 JTTZAQPGIVYYEI-SFHVURJKSA-N 389.503 5.008 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N(Cc2ccc(Cl)cc2)C2CC2)c1 609082169 BYLHQGMXQVXHRH-UHFFFAOYSA-N 391.805 5.010 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc2sc3ccccc3c2s1 609375678 LGBNFZIFWJFDOO-UHFFFAOYSA-N 394.546 6.374 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@H]1c1cc(F)ccc1F 610171131 GUFZBOMZQDQBNX-RDJZCZTQSA-N 380.419 5.307 30 20 GKED C[C@@H](CCNC(=O)c1cc2ccccc2n1CC#N)c1cccc(C(F)(F)F)c1 610430613 PBGAJAFZKZQKGJ-HNNXBMFYSA-N 399.416 5.107 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2C(F)(F)C1 610922696 BYLWGUOLBAQUCV-AWEZNQCLSA-N 387.455 5.220 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(COCc2ccccc2)c1 611390439 AOVHXEBJNUEBGQ-SANMLTNESA-N 382.507 5.442 30 20 GKED CSc1cc(C(=O)NCc2ccc(C#N)c(Cl)c2)c(Cl)cc1Cl 619763865 SOPQOOUXVCIRGA-UHFFFAOYSA-N 385.703 5.170 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)cc1Cl 619767180 CHZHLJIBIIHWTH-IBGZPJMESA-N 399.878 5.001 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1sc(-c2ccc(C)cc2)nc1C 727648567 KMMGDGCRCGUXTJ-UHFFFAOYSA-N 394.397 5.214 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1nc(-c2ccccc2)cs1 727973915 DGAMXSGKRRGAQB-LVAJTGTJSA-N 388.448 5.548 30 20 GKED N#CCOc1cccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c1 730147167 LPXYAKDBTIJZSZ-CAPFRKAQSA-N 396.471 5.622 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN(C)c1ccc2ccccc2c1 731028022 FGPNRXSHYVPRHG-QGZVFWFLSA-N 389.524 5.166 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3csc(-c4ccccn4)n3)cc2)c1 731331584 KFCKKBOJJCNUNV-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)sc1Cl)c1c(Cl)cccc1Cl 733259303 WAIXYWWLRUUJOS-VIFPVBQESA-N 380.083 5.356 30 20 GKED Cc1cc(/C=C/C(=O)c2c(Cl)nc3ccccn23)ccc1Oc1cccnc1 737446009 KYOMMDJRNGXBCM-VQHVLOKHSA-N 389.842 5.380 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)CCc3ccccc3F)n2)cc1 744035376 QZAURUJDOBQSMO-APWZRJJASA-N 392.499 5.703 30 20 GKED N#C[C@H](C(=O)CCC(F)(F)F)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 744036770 IEGQXODZJFQDQO-UDMGLPGGSA-N 382.451 5.130 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(-c2ccncc2)cc1 745989962 IFVGBSNQRMXONW-MDZDMXLPSA-N 386.451 5.907 30 20 GKED O=C(Nc1cccc(/C=C2/Cc3ccc(F)cc3C2=O)c1)c1ccccc1Cl 749005538 LFXHLHFGTYCZHE-YBEGLDIGSA-N 391.829 5.554 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2ccccc2OCc2cccnc2)cc1 751514472 RXROXKOFSNFRMQ-RAXLEYEMSA-N 395.462 5.051 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CC[C@H]2CCCC[C@@H]2C1 756514789 HKOYWLRVWILGRJ-XRXFAXGQSA-N 380.532 5.065 30 20 GKED C=C[C@H](CC(=O)Oc1ccc(-c2noc(-c3cccnc3)n2)cc1)c1ccccc1 759314641 GUVKORSEWXCXTO-QGZVFWFLSA-N 397.434 5.064 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COC/C=C/c3ccccc3)n2)cc1 763479767 XKKAKYADGLCIJU-FKIZTMCRSA-N 388.492 5.025 30 20 GKED Cc1ccc(C)c(Oc2ccc(CN[C@H](C)c3ccc(OCC#N)cc3)cn2)c1 776153575 FJBLYWYLZXKMHX-LJQANCHMSA-N 387.483 5.244 30 20 GKED C[C@@H]1Cc2cc(-c3ccc(CN[C@H](C)c4ccc(OCC#N)cc4)cc3)ccc2O1 776171462 NIEAWVIJQNTMNZ-RTBURBONSA-N 398.506 5.430 30 20 GKED CC(C)[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776171603 UKXFCYLBWKGNTM-MGPUTAFESA-N 376.422 5.656 30 20 GKED CN(C(=O)c1ccccc1Oc1ccccc1C#N)c1nc2ccccc2s1 777922852 ONRYXSYGCGDKLI-UHFFFAOYSA-N 385.448 5.237 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(OCc2cccc(F)c2)cc1 779989190 QWGXSAGPIHDMJP-KRWDZBQOSA-N 376.431 5.308 30 20 GKED CC(C)O[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 794219711 BBYKWOANKYCDKB-ZEQRLZLVSA-N 384.479 5.447 30 20 GKED N#CCCCOc1cccc(CNc2ccc(OCC(F)(F)F)c(Cl)c2)c1 800290840 VLDQNPHCUCOWIZ-UHFFFAOYSA-N 398.812 5.576 30 20 GKED C=CCC[C@@H](NCc1c(Cl)ncnc1N(C)C)c1ccc(C(F)(F)F)cc1 801534069 RELPMJWOSSUQKC-MRXNPFEDSA-N 398.860 5.012 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(C)ccc2C(F)(F)F)c1 825446719 NFTSXVWTSXZTPP-HNNXBMFYSA-N 391.393 5.017 30 20 GKED O=[N+]([O-])c1cccc([C@H](NCc2ccccc2C(F)(F)F)C(F)(F)F)c1F 839650418 LVIXWGHJEKPXAL-AWEZNQCLSA-N 396.262 5.146 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)n2)cc1 850762692 MAKCHSBESXNLNN-BZUAXINKSA-N 392.446 5.664 30 20 GKED C=C(C)C[C@H](NCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)O 864530348 WNFRTNDTSSHYSW-IBGZPJMESA-N 394.298 5.081 30 20 GKED N#Cc1cccc(-c2cc(-c3nc(-c4ccc(C(F)(F)F)s4)no3)on2)c1 904968826 GYJQULDNYXYKFN-UHFFFAOYSA-N 388.330 5.011 30 20 GKED Fc1ccccc1NC(=S)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914706792 JDSKLXTVRMPXQX-RKDXNWHRSA-N 388.352 5.022 30 20 GKED CC(=NNc1ccc(-c2ccccc2)cc1)c1oc2cc(C)ccc2c1CC(=O)O 1776059686 FMVSGZIQIWZUBY-UHFFFAOYSA-N 398.462 5.871 30 20 GKED C[C@H](Oc1ccc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)cc1)C(=O)O 1776469728 ZMAICBKSKGVVSJ-ANHFWZFOSA-N 397.279 5.119 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2c(F)cccc2F)o1 1776782856 NEJAEYMLRSYNHH-HNNXBMFYSA-N 379.447 5.518 30 20 GKED CCCCCCCC[C@H](C)C(=O)NCc1ccc(C(F)(F)F)c(C(=O)O)c1 1776786210 ZVUUODXRFDUKAF-AWEZNQCLSA-N 387.442 5.407 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@@H]([C@@]23CC[C@@H](C2)[C@@H]3C(=O)O)C1 1776786821 PULFDPIZXDKJRG-GRBVSQBPSA-N 377.569 5.113 30 20 GKED CCCOc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1OCC 1776818090 KIRMFDCYXWOMKB-QGOAFFKASA-N 394.467 5.175 30 20 GKED CCCOc1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)c(OCCC)c1 1776818219 WDJRNFUMTQDJFA-WYPWOVKWSA-N 394.467 5.102 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cnn(CC4CCC4)c3)s2)cc1 1777671087 AJQZRVNWEIFRGU-NTMALXAHSA-N 392.480 5.006 30 20 GKED C#CCOc1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1 1848350007 DGXALNZISHDOKH-UHFFFAOYSA-N 386.494 6.706 30 20 GKED COc1ccc(/C=C2\C[C@H](C)Cc3c2nc2ccccc2c3C(=O)OCC#N)cc1 4550203 WTLGAGKHMBBTKC-XIGQLOAZSA-N 398.462 5.047 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1c(C)cccc1C 11153241 NAHBEGDOLDCGKC-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCN(CC(=O)Nc1ccccc1Oc1ccccc1)Cc1cccs1 19540410 NXFWOVDEUJOLAU-UHFFFAOYSA-N 378.497 5.167 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1ccc(C#N)cc1 26123163 RXZFOPJZGWGQQP-QGZVFWFLSA-N 393.446 5.371 30 20 GKED C=CCOc1ccccc1C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 30229842 LQQXJYDPROWZNG-HNNXBMFYSA-N 378.497 5.174 30 20 GKED N#C[C@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc(-c2ccccc2)cs1 41535984 BQWFIPGBTPPLEA-LJQANCHMSA-N 385.492 5.491 30 20 GKED Cc1occc1CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 56661242 OYWSECORXSVHRC-FQEVSTJZSA-N 393.874 5.561 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1ccccc1Cl 60127415 NNRUZFGWJVCMIP-HNNXBMFYSA-N 391.858 5.443 30 20 GKED O=C(/C=C/c1sc2ccccc2c1Cl)c1cccc(N2CCOC2=O)c1 63556735 OQDXTJQJKFBSRB-CMDGGOBGSA-N 383.856 5.407 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc3c(c2)CCCC3)cc1OCCCC#N 64613703 HJXUMTZXYKIKAN-SFHVURJKSA-N 378.516 5.107 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 66801917 JXTUGBXTDRQHAH-DLBZAZTESA-N 382.529 5.297 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(NC(=O)Nc2ccccc2)s1 97133788 UPIIPJDCCFCINR-UHFFFAOYSA-N 397.525 5.282 30 20 GKED CCc1ccc2c(CNc3ccccc3S[C@@H](C)CC#N)cc(=O)oc2c1 109323613 SMGSGHKZQJURKJ-HNNXBMFYSA-N 378.497 5.362 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cccc4cccnc34)o2)cc1 126249680 VSWUEVJBWPIHGM-UHFFFAOYSA-N 375.453 5.142 30 20 GKED C=CCN(C(=O)c1cnccn1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 127852396 XDFJLWIUVSZTSP-UHFFFAOYSA-N 398.491 5.100 30 20 GKED Cc1cncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 132021745 CJRXENONIJQJAA-AWEZNQCLSA-N 388.279 5.310 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc2ccccc2o1 175854487 ZWXCGJRHDMAEIP-HNNXBMFYSA-N 379.485 5.491 30 20 GKED CCC(CC)[C@@H]1C[C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCO1 181714751 ZNWHIQPREYCSLQ-IEZWGBDMSA-N 389.565 5.186 30 20 GKED COc1ccc([C@H](C)NCc2ccccc2C(C)(C)C#N)cc1Br 182101450 AFDPYEWRBIDFSF-AWEZNQCLSA-N 387.321 5.110 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1 191433405 XYMFCQCAHFHRRE-AUSIDOKSSA-N 392.543 5.828 30 20 GKED Cc1ccc(-c2nn(Cc3ccccc3)cc2CNCc2cccc(C#N)c2)cc1 237696501 QPMJIJDEXUFXIO-UHFFFAOYSA-N 392.506 5.068 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 246088805 JFHOSTQKINNUEH-OWCLPIDISA-N 377.579 5.076 30 20 GKED Cc1sc([C@@H](C)Nc2snc(Cl)c2C#N)nc1-c1ccc(Cl)cc1 301966796 VSOWIMMVLVSKIG-MRVPVSSYSA-N 395.340 5.927 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)CCc1ccc(C#N)cc1 303225977 WGOBOOLSYSPWIA-UHFFFAOYSA-N 388.442 5.156 30 20 GKED Cc1c(Cl)cccc1N=C(O)[C@@H](C)N[C@H]1c2ccccc2CC12CCOCC2 329778794 LKHOUVAFNGPHPS-IERDGZPVSA-N 398.934 5.309 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)c1c[nH]c2ccccc12 426333382 UJIQYMMMICSFML-CVEARBPZSA-N 377.513 5.694 30 20 GKED C=CCN(C(=O)c1cccc(C(F)(F)F)c1F)c1nc2c(s1)CCCC2 429953896 TYSMFVUIHMERID-UHFFFAOYSA-N 384.398 5.013 30 20 GKED C=CCn1c(S[C@H](C)CCSc2ccccc2)nnc1-c1ccccn1 431216165 MFCTUUMVMFCGHB-MRXNPFEDSA-N 382.558 5.189 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)N[C@H](c1cc(F)ccc1F)C(F)F 433014969 HWAYQAFLHNFATQ-CQSZACIVSA-N 394.290 5.198 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cn(C)nc1C(C)C)c1ccc(C(F)(F)F)cc1 435168008 HBYGMBWTVWOMMX-MRXNPFEDSA-N 394.441 5.391 30 20 GKED COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)cc1 437663011 VURJPTVKQKVECK-IBGZPJMESA-N 399.494 5.232 30 20 GKED CCSCC[C@@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 438189577 UCGNVUPYIWTTQK-OAHLLOKOSA-N 399.516 5.012 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 438484599 RLBDOURDEFRBBJ-UYAOXDASSA-N 377.488 5.168 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 438508624 MQXHXPFGXQWERI-UHFFFAOYSA-N 381.501 5.747 30 20 GKED N#CCC[C@H](NC(=O)N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 438845388 BBRKSVFYSDNYQR-ROUUACIJSA-N 385.920 5.221 30 20 GKED C[C@@H](Sc1ccccc1C#N)c1nc(O)c2c(-c3ccccc3)csc2n1 439700336 XKQUQMJFCROLPM-CYBMUJFWSA-N 389.505 5.789 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)NCC1CCC(C#N)CC1)c1ccccc1 441626207 OUTODOUJHAVJMB-LMDPOFIKSA-N 377.488 5.278 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)CCCC1(C)C 444838962 OMSWQDSLWKIRTR-GOSISDBHSA-N 389.927 5.065 30 20 GKED N#C[C@@H]1CCC[C@H](N[C@H](CC(F)(F)F)c2ccc(Br)cc2)C1 446764915 AOYJFTQZYOQXCJ-BYCMXARLSA-N 375.232 5.115 30 20 GKED C[C@@H]1CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC[C@H]1c1ccccc1 458799936 KMULUVSDEQAKCT-PTUXOGIPSA-N 375.516 5.257 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458805592 UTCAQZIKRYBHJR-XZOQPEGZSA-N 375.516 5.585 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1 461413168 AHZIDISWLAWUMX-PCCBWWKXSA-N 390.552 5.549 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2SCCc3sccc32)cc1 463144668 LGIWASFZZDFAHO-HXUWFJFHSA-N 392.505 5.381 30 20 GKED CC(C)Oc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)c(C(F)(F)F)c1 463943384 GZQBLAJDKFFTTR-CYBMUJFWSA-N 376.378 5.106 30 20 GKED C=C[C@](C)(CC)C(=O)N(C)c1ccc(Cl)c(N(C)C(=O)[C@@](C)(C=C)CC)c1 467971653 WZZPNUONWHYLDZ-YADHBBJMSA-N 390.955 5.470 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(OC)nc2ccccc12 475555559 XMEKYSUITIORSV-UHFFFAOYSA-N 389.499 5.417 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)Nc1ccc(C#N)cc1Cl 478168585 PUBDYLAKTSZSGZ-LIRRHRJNSA-N 383.879 5.225 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1c(F)cccc1Cl 478385193 UDXPRTBFLHPWDE-QOKNQOGYSA-N 385.870 5.021 30 20 GKED C=CCCCC(=O)N(CC)[C@H](c1ccc(Br)cc1)c1cccnc1 480829788 OPSQHXJNTISEBB-HXUWFJFHSA-N 387.321 5.138 30 20 GKED C[C@H](NC(=O)Nc1ccnn1[C@H](C)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 482461514 SVCVKNDNCIVXTL-DLBZAZTESA-N 399.498 5.275 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 482550962 KHRBIMSCRCHMDK-KRWDZBQOSA-N 375.925 5.120 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)CSCc1ccc(C#N)cc1)C1CC1 489094005 KGNJTMFEHDOLHQ-HNNXBMFYSA-N 384.932 5.197 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccco1)C1CCCCC1 489414465 NWMPOGRAVVZESZ-LJQANCHMSA-N 396.491 5.290 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)C[C@H](C)C2 492092851 CRLMFUQJWKEGGH-HMNTXPNISA-N 399.494 5.326 30 20 GKED N#C[C@@H](NC(=O)CSc1cc(Cl)ccc1Cl)c1ccc(Cl)cc1 499813675 PDYOMBOUCZWAMU-CQSZACIVSA-N 385.703 5.120 30 20 GKED N#Cc1c(F)cccc1Sc1nnc(Cc2cccs2)n1-c1ccccc1 506867557 JFZZFXJGYWRDSL-UHFFFAOYSA-N 392.484 5.082 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)c(OC(F)F)c1 506982691 GBFFGLAXMYCFJF-UHFFFAOYSA-N 393.821 5.256 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1 507765498 DODFZUWYVVTTNV-DNVCBOLYSA-N 393.487 5.258 30 20 GKED Fc1ccc(-c2noc(-c3csc(C(F)(F)F)n3)n2)c(C(F)(F)F)c1 507998773 LXKZJMZGGOBCKL-UHFFFAOYSA-N 383.248 5.037 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509906376 XZBQSHICUJMQIA-NRFANRHFSA-N 377.488 5.128 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cccc(F)c3Cl)c2)c1 515305514 YHAXYBOFPHTOBH-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC(=O)c1csc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 521607974 UMHUZMFZOSVGOR-UHFFFAOYSA-N 396.855 5.520 30 20 GKED N#C[C@H](Sc1nnc(Cc2cccs2)n1-c1ccccc1)C1CCCCC1 524535355 BOBLEYVFCKMGBQ-IBGZPJMESA-N 394.569 5.484 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(-c4cncnc4)cc3)c2)cc1 524552593 VVBLQVXDJLAKHM-UHFFFAOYSA-N 392.418 5.060 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1ccc(C#N)cc1F 532569688 VOQWMUHZASZWPZ-GFCCVEGCSA-N 385.895 5.634 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1F 536445191 ZWZCKIWCCXDIIE-UHFFFAOYSA-N 399.784 5.238 30 20 GKED N#CCCn1cc(CN2CC[C@@H](c3ccc(Cl)cc3)C2)c(-c2ccccc2)n1 536671285 FUGODSOZWSBFMM-HXUWFJFHSA-N 390.918 5.107 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(C#N)c(F)c2)c2ccc(F)cc2)cc1 537405632 RDLBEXPWGCERCN-IQMFZBJNSA-N 378.422 5.285 30 20 GKED N#Cc1ccccc1COc1cccc(-c2nc([C@@H]3CCCCS3)no2)c1 547223104 YMWFQEOEJYURBN-IBGZPJMESA-N 377.469 5.145 30 20 GKED CC[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 563486967 MBFIGOMIWFAQAY-LBPRGKRZSA-N 393.356 5.293 30 20 GKED C[C@@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1 564307698 QVRHEPJEXJPBSK-AWEZNQCLSA-N 378.369 5.285 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(F)c1Cl 573956851 JQHBROKFGSHBDV-UHFFFAOYSA-N 382.847 5.754 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@H](C)C[C@@H](C)C4)ccc12 574617913 DTSKFQVLLRMXBG-DGCLKSJQSA-N 391.496 5.120 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 576993352 SUQTWWWZXRJJJR-MRXNPFEDSA-N 378.472 5.383 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@H]1c1ccccc1 580131007 VPQCXHFVUGDNQW-NRFANRHFSA-N 381.483 5.021 30 20 GKED C[C@H](NC(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1)c1ccc(-c2cccc(C#N)c2)cc1 586806320 SXMDZCDAVZFECA-VHKYSDTDSA-N 386.417 5.381 30 20 GKED COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC(=O)CCCCCC#N)c1 588541560 FHPCXOXEEDTRCA-HSZRJFAPSA-N 378.516 5.186 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nnc(-c3ccccc3F)o2)cc1 591591508 KRVQOOCLJGNQFO-UHFFFAOYSA-N 387.439 5.707 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCc4cc(F)c(Cl)cc43)ccc21 599045054 TZTDSESWRDFGLH-FQEVSTJZSA-N 397.881 5.161 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(Br)cc1Cl 603956852 JEEZCAXFZOSZEF-UHFFFAOYSA-N 391.696 5.025 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 608784969 LNXFBJOIKHNURF-UHFFFAOYSA-N 392.484 5.250 30 20 GKED CN(C(=O)CSc1cccc2cccc(Cl)c12)c1ccc(C#N)cc1F 608798746 GGVKZGSYMJIMFA-UHFFFAOYSA-N 384.863 5.259 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCc1cccc(Cl)c1 609438080 BCSNJZVCSPPAHX-OAHLLOKOSA-N 387.936 5.489 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@H](Cc4ccccc4)C3)cc2)cc1 610178659 RZPLVAXCCVAWIT-JOCHJYFZSA-N 396.490 5.250 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 610179571 RMADEOBNVJSKFF-HSZRJFAPSA-N 397.478 5.421 30 20 GKED COc1ccc2c(c1)[C@H](N(Cc1ccccc1)Cc1ccccc1C#N)CCO2 610215876 AHTNJGSOACCMRQ-XMMPIXPASA-N 384.479 5.093 30 20 GKED CSc1cc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)ccc1F 619126666 KYKNFZQPWBBTEF-UHFFFAOYSA-N 391.352 5.331 30 20 GKED FC(F)(F)c1ccnc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 674244853 XWQRKVALTQTAOM-MYJAWHEDSA-N 380.254 5.422 30 20 GKED Cc1ccc2c(CNc3cccc(Oc4ccc(C#N)cc4)c3)cc(=O)oc2c1 729676633 QANDBSNPNJWFSP-UHFFFAOYSA-N 382.419 5.378 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)cc1 729936872 HFUXOJUMLRQHIF-GHXNOFRVSA-N 376.408 5.070 30 20 GKED CCCCCCCOc1ccc(C(C)=NNc2cnnc(O)c2Cl)cc1 730568158 NUCCFWLKVLVGMG-UHFFFAOYSA-N 376.888 5.021 30 20 GKED N#CCOc1cccc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)c1 731323109 KZOKTEBGIZEKLO-UHFFFAOYSA-N 395.418 5.163 30 20 GKED N#C[C@H](C(=O)CC[C@@H]1CCCCO1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 732496212 QFMGSZDJXNLWIU-IPELFKPHSA-N 398.572 5.136 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)o1 734304829 XOHDLEUSYQGYHI-CSKARUKUSA-N 391.398 5.247 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCc3ccc(-c4ccccc4F)o3)[nH]c12 735789653 PHHJQEYMDBLZIF-QGZVFWFLSA-N 387.414 5.080 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 740434318 FZYNEOMETGZWAQ-UHFFFAOYSA-N 395.551 5.272 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cccc(OCCCC#N)c2)cc1 741470897 XAGIVCHKFVMUIN-LFIBNONCSA-N 397.474 5.941 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1cccc(Cl)c1 744033658 UIHGLCKBXNAJGK-QLJPJBMISA-N 395.673 5.098 30 20 GKED C=CCCO[C@H](C)C(=O)O[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753355970 SKCAYXPJBGYLIG-VXGBXAGGSA-N 384.259 5.234 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C(C)C 753442826 IGSCOYYDSHEYDJ-NRFANRHFSA-N 399.494 5.557 30 20 GKED C[C@H](OC(=O)C1CC(F)(F)C1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 753811721 VABBMAJXIBKTHX-ZETCQYMHSA-N 376.243 5.374 30 20 GKED CC(C)c1cnc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 754306384 FJPSOUYBHWMCLQ-UHFFFAOYSA-N 381.863 5.514 30 20 GKED N#C[C@H](COC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)Cc1cccs1 772738135 RQHWDNMSNLAICM-UFTDPOHCSA-N 397.462 5.122 30 20 GKED C[C@H](N[C@H](C)[C@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772959315 KUNCZVAZAJKALV-XHSDSOJGSA-N 376.422 5.451 30 20 GKED C#CC[C@H](NCc1cc(Cl)ccc1OCc1cccnc1)c1ccccc1 775400950 USFBLESCJVZCLL-QFIPXVFZSA-N 376.887 5.168 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)Cc3ccccc3CC#N)c2)C1 776860827 LIHCBELGVHICCG-WZONZLPQSA-N 376.500 5.029 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(N2CCCc3ccccc32)cc1 780169957 VISOFRNPBNJYMN-SFHVURJKSA-N 397.478 5.314 30 20 GKED CC(C)Cc1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 780817085 MIEGOMDCSVLFNC-NRFANRHFSA-N 395.572 5.371 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1c[nH]c2ccccc12 786318884 LPROHKXDXLARKG-CRAIPNDOSA-N 385.492 5.661 30 20 GKED N#CC1(N(C(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)C2CC2)CCC1 791005340 SEYWVUZJOJAAMG-UHFFFAOYSA-N 385.442 5.092 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1 793390276 NQFQIRQWARKFHB-FXAWDEMLSA-N 386.417 5.456 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c1 796472492 XHLFZUNCAXRMIF-KRWDZBQOSA-N 396.680 5.380 30 20 GKED C[C@H](OC(=O)C1(c2cc(F)cc(C#N)c2)CC1)c1nc(-c2ccccc2)cs1 796992898 CNAVSPHOKIABGG-AWEZNQCLSA-N 392.455 5.157 30 20 GKED CC(C)(C#N)c1ccc(C(=O)O[C@H](c2nc3ccccc3o2)C(F)(F)F)cc1 816063516 MTBVOMOXSZRRFF-MRXNPFEDSA-N 388.345 5.089 30 20 GKED CC[C@@H](c1ccc(F)cc1F)[S@@](=O)Cc1c(F)c(F)c(F)c(F)c1F 841720093 GFOPQUDGCQHNNJ-FTJNGKRUSA-N 384.316 5.060 30 20 GKED N#C[C@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1nc(C2CC2)cs1 842940607 CUIFPOODWSPLHT-GFCCVEGCSA-N 387.917 5.093 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@]34CCCC[C@@H]3C4(F)F)n2)cc1 850762255 HLTHCZJOQXTXLA-BPAFIMBUSA-N 386.467 5.510 30 20 GKED CCCCOc1ccc(C=NOCc2ncc(-c3ccccc3)o2)cc1OC 852905897 HGENNKBXBAXHAM-UHFFFAOYSA-N 380.444 5.080 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccc(Br)cc1 915043907 DKVMDAYYUGBEAZ-XCVCLJGOSA-N 394.268 5.319 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915181052 WLGZWKKMCSKJIS-HSZRJFAPSA-N 386.520 5.771 30 20 GKED C[C@@H](Cc1ccco1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 916510038 ZOPZAYINDGIIFA-YWZLYKJASA-N 393.874 5.341 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cccc(OC3CCCC3)c2)S1 917515830 BHWCNRWJCUBDNR-XSFVSMFZSA-N 392.524 5.516 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 920082224 VVPUMLBSWIQUGR-VWLOTQADSA-N 395.506 5.190 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(OCCC(C)C)cc1 920106056 JMVRUKLISFZSCW-HXUWFJFHSA-N 388.467 5.107 30 20 GKED Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1N=Cc1cc2ccccc2nc1O 921138690 YRJIRBGFZVRANS-KRWDZBQOSA-N 387.483 5.014 30 20 GKED C/C(=C\C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 921279322 SMQAGGDSZIPGPN-SFGZWBMOSA-N 397.334 5.255 30 20 GKED CC(=NNc1ccccc1Oc1ccccc1)c1cccc(O[C@@H](C)C(=O)O)c1 1776090984 MGBAHPIROBHFFU-KRWDZBQOSA-N 390.439 5.167 30 20 GKED Cc1c(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)nc2ccccc2c1C(=O)O 1776131322 OFXQQAXVFMGIGY-NXVVXOECSA-N 393.442 5.805 30 20 GKED CCCCCCCCCCCCCCCCc1nc([C@@H](N)CC(=O)O)no1 1776785288 PSHULUKVWDROMA-SFHVURJKSA-N 381.561 5.568 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@H](C(=O)O)CC2(C)C)cc1 1776787503 HOQQZEPOAUGBEY-QGZVFWFLSA-N 377.550 5.074 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3ccc(CC(=O)O)cc3)ccc21 1777002840 LDETWCZZMKALNZ-GXDHUFHOSA-N 383.447 5.338 30 20 GKED COc1ccc2c(c1Cl)C(=O)/C(=C\c1csc3ccc(C(=O)O)cc13)CC2 1777373587 JAPZXHGHQNMVME-WQLSENKSSA-N 398.867 5.474 30 20 GKED COc1cccc(Oc2ccc(/C=C/C(=O)c3ccc(CC(=O)O)cc3)cc2)c1 1777382124 WELMLTDJDKZOSU-NTEUORMPSA-N 388.419 5.011 30 20 GKED COc1cccc(Oc2ccc(/C=C\C(=O)c3ccc(CC(=O)O)cc3)cc2)c1 1777382125 WELMLTDJDKZOSU-ZROIWOOFSA-N 388.419 5.011 30 20 GKED COc1ccc([C@@H]2C[C@@H]2/C(=N/c2ccsc2C(=O)O)c2ccccc2)cc1 1857777177 MVMWXAVSPAGSHI-PKBLUPHSSA-N 377.465 5.379 30 20 GKED C[C@@H](OC(=O)c1c2ccccc2cc2ccccc12)C(=O)Nc1ccccc1C#N 6643794 VSLDQOBAYFRVEA-MRXNPFEDSA-N 394.430 5.049 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1cccc(C)c1C 10167800 MJMRPINIAXXLHX-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1cc(C)cc(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)c1 22730234 ACOVJIPRYDFDBO-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)C(=O)Nc2cccc(C)c2C)n1 26142519 FKKLTIBEYBXPIX-CYBMUJFWSA-N 393.434 5.017 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)s1 41534619 COCGNGQYHLAYHL-OAHLLOKOSA-N 380.494 5.019 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 47375998 QSBBIYUEZGWIPB-CQSZACIVSA-N 375.478 5.218 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1nc2ccccc2s1 51897368 MOEUPYOEOHWJAV-LBPRGKRZSA-N 395.896 5.563 30 20 GKED N#CCCN(C(=O)CSCc1c(Cl)cccc1Cl)c1ccccc1 60825152 NNQLPLQNSJMEKY-UHFFFAOYSA-N 379.312 5.173 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(F)c(F)cc2Cl)cc1 65680141 XYCLBWOOVAHPBT-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 66953941 BABHABUMMQQMCU-LSDHHAIUSA-N 387.936 5.959 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)[C@H]1CCC[C@@H](C(F)(F)F)C1 70868415 YMRASIKQBXOWGY-VHSXEESVSA-N 387.295 5.074 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1ccc(F)cc1F 72030855 HVWZWGDEHLXOLI-CQSZACIVSA-N 393.393 5.068 30 20 GKED COc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1F 108241786 LXOGSWZYYHTCMR-UHFFFAOYSA-N 398.381 5.111 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)Nc2cccc(OCCCC#N)c2)c1C 113554360 ZTKKGZGSLAKPQL-UHFFFAOYSA-N 394.475 5.060 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)CCCCOc1cccc(C#N)c1 152952961 DRBIXTRKGOOLBH-QGZVFWFLSA-N 399.560 5.215 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N(CCC#N)CCC(C)C 176859719 RROPPVFVBVUEPE-UHFFFAOYSA-N 392.503 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C[C@H](O)CC 191494209 UTQBTFCGGWYDRG-OAQYLSRUSA-N 380.532 5.344 30 20 GKED CC(C)(C)[C@H]1CC(/C=N/c2ccccc2)=C(Cl)/C(=C/Nc2ccccc2)C1 204606632 SGNGRHNZHKGIJF-DCOBNTHWSA-N 378.947 7.334 30 20 GKED Cc1csc(C2(NC(=O)Nc3ccccc3S[C@@H](C)CC#N)CCC2)n1 267621228 UTMIDCIIXAUTMJ-AWEZNQCLSA-N 386.546 5.047 30 20 GKED Cc1cc(N=C(O)CC/N=C(/O)C23CC4CC(CC(C4)C2)C3)cc2n[nH]cc12 328969801 AXLNHLAOQRGGHL-UHFFFAOYSA-N 380.492 5.022 30 20 GKED C[C@H]1CN(C(O)=Nc2cccc(-c3ncc4n3CCCC4)c2)[C@H]1c1ccccc1 330265909 ZXCHBJQUUWBAIM-HTAPYJJXSA-N 386.499 5.125 30 20 GKED CC(C)C/N=C(/O)c1ccc(N=C(O)N2CC=C(C(C)(C)C)CC2)cc1Cl 330495011 QFFZRXJMNMUXLA-UHFFFAOYSA-N 391.943 5.524 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)C1 424978972 QUANUDCZRSOMBL-GOEBONIOSA-N 394.471 5.286 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@@H](c2ccccc2F)C1 432073514 WYWQSWOWADLYAZ-BRWVUGGUSA-N 397.519 5.678 30 20 GKED N#CCCn1cc(CNc2cccc(C(F)F)c2Cl)c(-c2ccncc2)n1 433340793 QINZUVZCEWQEBF-UHFFFAOYSA-N 387.821 5.062 30 20 GKED N#Cc1ccnc(NC(=O)[C@@H](Oc2cccc(Cl)c2Cl)c2ccccc2)c1 436028133 OAVYMVAYGAIJID-IBGZPJMESA-N 398.249 5.019 30 20 GKED Oc1cc(F)cc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436408844 LMNRIKJQFQLWFR-OAHLLOKOSA-N 381.291 5.333 30 20 GKED Cc1ccsc1CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438648388 JKWFFXVGYRWTGB-UHFFFAOYSA-N 395.459 5.524 30 20 GKED O=C(N1CCC(F)(c2ccccc2C(F)(F)F)CC1)C1(C(F)(F)F)CCC1 451418860 JWIOTSWXLDIVAR-UHFFFAOYSA-N 397.334 5.225 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1nc(C)cs1)C(F)(F)F 455254179 WPMQSYACGKPLMA-MRXNPFEDSA-N 397.466 5.729 30 20 GKED N#CCCC[C@H](NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2)c1ccccc1 458827607 DKIJPBBMKABYGG-KKXNLOMOSA-N 393.453 5.376 30 20 GKED CC[C@](C)(NCCC(C#N)(c1ccccc1)c1ccccc1)c1nccs1 472579489 OTVZOZMLPAIKJH-QFIPXVFZSA-N 375.541 5.258 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(OCC2CC2)nc1 475580704 CLKBLMSGYXUDJV-UHFFFAOYSA-N 379.504 5.044 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)N2CCC[C@@H]2/C=C\c2ccccc2)c1 475808224 JBTHMKQNRCFWBW-SSSWZJSRSA-N 398.462 5.048 30 20 GKED N#CC[C@@H](CC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1 476662930 OBQCSRWZPIQOOQ-IBGZPJMESA-N 399.321 5.697 30 20 GKED CN(C(=O)c1cc2c(s1)-c1ccccc1OC2)c1cc(Cl)ccc1C#N 479570727 QXOIZPBVNDIXKO-UHFFFAOYSA-N 380.856 5.109 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cccc(NC(=O)CCC)c1)c1ccc(F)c(F)c1 480370796 NGLRKLSLBGSAGJ-HXUWFJFHSA-N 387.430 5.142 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 480944876 IFFBESCCJJUQGT-NQIIRXRSSA-N 394.540 5.033 30 20 GKED N#CCSCCCSc1nnc(Cc2ccccc2)n1C1CCCCC1 489406127 RLWISHJKVZOQDQ-UHFFFAOYSA-N 386.590 5.113 30 20 GKED N#Cc1ccc(Br)c(CN[C@H](Cc2ccccc2)c2cccs2)c1 491612462 JMXFJSZYWYEREM-LJQANCHMSA-N 397.341 5.456 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(Br)c2Cl)c(C#N)s1 503614027 VZRWIXKPPQQMPN-UHFFFAOYSA-N 397.725 5.585 30 20 GKED C=CCOc1ccc(CN(CC)CC(=O)Nc2c(Cl)cccc2Cl)cc1 506283403 ZMVOUJOWGJYYEX-UHFFFAOYSA-N 393.314 5.019 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(SCC)cc1 509544246 QMFXKWJIWGVJJX-INIZCTEOSA-N 399.516 5.166 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cscc1Br 511702073 TVVHDPUSKRUWNT-SNVBAGLBSA-N 381.320 5.157 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1Cl 518239678 KIEGVZYIEZCKLJ-LSDHHAIUSA-N 388.920 5.449 30 20 GKED CCC(CC)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1cccs1 520475985 QOGHZAVWNKNAPT-OAQYLSRUSA-N 383.561 5.717 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)cc1 521106178 AVJZCVJYQNJXQA-XMMPIXPASA-N 382.463 5.522 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1 521135359 QLQUWBAPZJPSEU-UHFFFAOYSA-N 386.282 5.397 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(CC1CC1)C1CCCCC1 533277563 ZLFWSLIBEHREON-QGZVFWFLSA-N 385.577 5.064 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 542372320 INPIBYWURYWYFH-IEBWSBKVSA-N 379.529 5.411 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2ccncn2)c(Sc2ccc(Cl)cc2)c1 544814627 DWGCIMAWZVJUAC-KRWDZBQOSA-N 379.872 5.080 30 20 GKED CC[C@H](CC#N)NC(=O)c1sc2cccc(F)c2c1COc1ccccc1 545157089 YWEKHKOMIRDXDJ-CQSZACIVSA-N 382.460 5.041 30 20 GKED CCCN(CC1CCCCC1)C(=O)c1occc1COc1cccc(C#N)c1 549149329 QGVJAJDLBUEYDH-UHFFFAOYSA-N 380.488 5.163 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCCOc1ccccc1F 551699785 JOLKYOHXQNWKQR-UHFFFAOYSA-N 388.442 5.090 30 20 GKED Cc1ccccc1C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C1CC1 551778599 DPWXTMHCLGYTKY-QHCPKHFHSA-N 387.527 5.011 30 20 GKED CC(C)c1ccc(-c2noc(CNc3ccccc3SC[C@@H](C)C#N)n2)cc1 553010490 LSYUQQWQOSAUPM-INIZCTEOSA-N 392.528 5.724 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 553945089 STJGHUXOLBKUMO-HZPDHXFCSA-N 377.246 5.183 30 20 GKED N#CCCC[C@H](NC(=O)NCc1c(Cl)cccc1Cl)c1ccccc1 559379924 CCAKNONXBUDWQQ-SFHVURJKSA-N 376.287 5.228 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Cl)c2OCC(F)F)cc1 563763139 FJEXKUUPUJMSMD-UHFFFAOYSA-N 378.806 5.037 30 20 GKED CC1(C)CCN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c2ccccc21 567479956 RTXWFQJYOVANKG-UHFFFAOYSA-N 383.451 5.074 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC3(CCC3)CC2)cc1 588240901 DRVVDTWXKVNJNW-UHFFFAOYSA-N 391.471 5.157 30 20 GKED CC(C)c1scnc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 589126345 CULWKTAITHXXAY-UHFFFAOYSA-N 397.887 5.836 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H](c4ccccc4)C3)cn2)cc1 590106568 FEGDUYLDDVETMO-HXUWFJFHSA-N 398.466 5.157 30 20 GKED N#CCCC[C@@H](NC(=O)[C@@H]1CCc2cc(Br)ccc21)c1ccccc1 592635315 BJSJXNWOFKSSAF-WOJBJXKFSA-N 397.316 5.030 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H](OC(C)C)C1 593149846 WKPBUNWUTBASIL-OAQYLSRUSA-N 393.487 5.080 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccc(C(F)(F)F)cc1 595570428 ZOSKURPUHUMUNQ-QAPCUYQASA-N 379.426 5.048 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)C1 596752945 KJCAMMAFOWHAKC-INIZCTEOSA-N 383.879 5.077 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@H](c1ccc(O)cc1)C1CC1 597180919 WUYYVRVFAPSIIW-BEFAXECRSA-N 380.513 5.166 30 20 GKED Cc1ccc(-c2csc(N(C(=O)[C@@H](C)CC#N)c3cc(C)ccc3C)n2)cc1 598801692 NRCMYFLWXRTWHP-SFHVURJKSA-N 389.524 5.950 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc3ccccc3c2c1 604500836 MHUYEPVJVBFTPG-UHFFFAOYSA-N 399.450 5.138 30 20 GKED N#CCCCOc1cccc(-c2nc3cc(Br)ccc3n2C2CC2)c1 608858928 XDUOGNHMLXUSRH-UHFFFAOYSA-N 396.288 5.483 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1nc(-c2ccccc2)n2c1CCCCC2 609188425 XWHVMNWFBZOZMZ-UHFFFAOYSA-N 392.547 5.069 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H]3CCc4cc(F)ccc43)c2)cc1 609209927 WJBUKXMBFUMXQZ-JOCHJYFZSA-N 387.414 5.299 30 20 GKED N#CCN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)C1CCCC1 609976832 OWJUNDGCDMJNAH-UHFFFAOYSA-N 399.288 5.150 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@H](C)c1ccccc1)c1cccc(C#N)c1 610325065 MADWSNWXDJSYPI-ZWKOTPCHSA-N 385.467 5.581 30 20 GKED N#Cc1ccccc1-c1ccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1 610614536 YILAUOKAMHLOMD-ROUUACIJSA-N 398.350 5.398 30 20 GKED N#C[C@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1ccc2ccccc2n1 613291069 SAEAQXCWQFNUFW-QFIPXVFZSA-N 378.431 5.304 30 20 GKED C=CCC1(C(=O)N[C@@H](C)c2ccc(O[C@@H](C)c3ccccc3)cc2)CCOCC1 617940297 GXIJFTZKXVBHIL-PMACEKPBSA-N 393.527 5.377 30 20 GKED Fc1cc(-c2noc([C@H](C[C@@H]3CCCO3)C(F)(F)F)n2)cc(C(F)(F)F)c1 650625782 NVPHCDVWGYPEJH-RYUDHWBXSA-N 398.278 5.110 30 20 GKED Fc1ccc([C@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C2CC2)cc1 678685325 STVAFHRTMMBSAA-BFJAYTPKSA-N 383.351 5.776 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(C(F)(F)F)ccc2OCCC)c1 726436990 BNEYWIVULIGDPK-UHFFFAOYSA-N 378.419 5.284 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726484360 KRDZTZRPABVJQX-SNVBAGLBSA-N 398.746 5.908 30 20 GKED CC(C)c1ccc(-c2nnc(SCCCOc3ccc(C#N)cc3)o2)cc1 727268797 SOWVEMHPPMIHAR-UHFFFAOYSA-N 379.485 5.293 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)Cn1c(-c2ccccc2)nsc1=S 727822584 LAYDQMINSVYSFP-UHFFFAOYSA-N 380.542 5.081 30 20 GKED N#CC1(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CCC1 729263850 MAMUWGAQDPMQDN-UHFFFAOYSA-N 380.447 5.109 30 20 GKED CC[C@@H](C)Oc1ccccc1/C=C\C(=O)Nc1cccc(OCCCC#N)c1 729827668 RVKXTODXWRDAAH-SWNWVQGVSA-N 378.472 5.198 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417794 SOXMRIBQLLSAPL-OXQOHEQNSA-N 398.528 5.570 30 20 GKED CC(=NNc1nc(-c2ccc(Cl)cc2)no1)c1sccc1Br 732925730 PNEVANHVKBFEAP-UHFFFAOYSA-N 397.685 5.050 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](CCC)c1cccc(C(F)(F)F)c1)c1ccncc1 734667299 XKBRUOIAKDMAGO-MOPGFXCFSA-N 391.437 5.558 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2cccc(F)c2)cc1 734964674 YVGIPSTXPMRBOK-KKSFZXQISA-N 380.463 5.009 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1 735009711 JGUYMVMPGSGPAJ-UHFFFAOYSA-N 386.838 5.262 30 20 GKED COC(=O)[C@H](Nc1ccc(Oc2cccc(Cl)c2)cc1)c1ccc(C#N)cc1 739997955 ZLWAAFGTEOPTQC-OAQYLSRUSA-N 392.842 5.330 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1cc([N+](=O)[O-])ccc1C 743445194 ITQLRPAJXVKSHN-UHFFFAOYSA-N 394.378 5.368 30 20 GKED C[C@@H](CCNC(=O)c1ccccc1SCC#N)c1cccc(C(F)(F)F)c1 746348439 YLKKGTGJVGUYGQ-AWEZNQCLSA-N 392.446 5.245 30 20 GKED CC1(CC(=O)[C@H](C#N)C(=O)Nc2ccc(SC(F)F)cc2)CCCCC1 753531837 GSQZBCHNVSOXLD-HNNXBMFYSA-N 380.460 5.009 30 20 GKED CC(/C=C\C(=O)c1ccc(N2CCC(O)CC2)cc1)=C\c1ccc(Cl)cc1 753718304 WLKNBEMXHMBAJP-CMTGCINSSA-N 381.903 5.144 30 20 GKED O=C(/C(=C\c1nc(Cl)cs1)c1nc2ccccc2s1)c1ccccc1 759071956 ICKZKOHYUTWCAY-JLHYYAGUSA-N 382.897 5.830 30 20 GKED Cc1cc(C(=O)O[C@H](C)c2ccc(C#N)cc2)ccc1NC(=O)c1cccs1 759421453 QLDUNKFEVLSPKO-OAHLLOKOSA-N 390.464 5.099 30 20 GKED Cn1c(CNCc2cccc(-c3ccc(C#N)s3)c2)nc2ccc(Cl)cc21 763479346 VIBUELJQYYBWFE-UHFFFAOYSA-N 392.915 5.117 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CCC[C@H]2c2cccs2)c1=S 764860362 QWEWBKDSASTZJV-AWEZNQCLSA-N 388.587 5.185 30 20 GKED O=C1/C(=C/c2csc(-c3ccccc3)n2)CCc2ncc(C(F)(F)F)cc21 777467727 MVHAKOICMRIZMM-MDWZMJQESA-N 386.398 5.436 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1 780668277 AYTXQURNUQUWTG-KRWDZBQOSA-N 395.478 5.483 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)Cc2cccc(C(F)F)c2)cc1 790767551 NGHKOKLYTGDPAF-AUUYWEPGSA-N 384.426 5.028 30 20 GKED C[C@@H](OC(=O)c1csc(C(F)(F)F)n1)c1ccc(F)c(C(F)(F)F)c1 790875416 DSPLDFWWAHLYMC-ZCFIWIBFSA-N 387.276 5.238 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(Br)cc1 792091603 LTRQMQOJUPTVKX-LIRRHRJNSA-N 393.284 5.367 30 20 GKED Cc1csc(Nc2cccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)c2)n1 795478799 AKKPJYVOIOQDMS-UHFFFAOYSA-N 394.475 5.122 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)cc1 796747955 SCPBPGMIWQZTHZ-LJQANCHMSA-N 384.426 5.102 30 20 GKED COc1cc2c(cc1NC(=O)NCC1CCC(C#N)CC1)oc1ccccc12 799376489 SIGCAVLSVJACFB-UHFFFAOYSA-N 377.444 5.046 30 20 GKED N#Cc1sc(N[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)nc1Cl 804586840 CJUBJSFZDPEXSQ-AWEZNQCLSA-N 375.284 5.112 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(C2=CCCC2)cc1 810530104 VTBJZZIIXLCEIX-QFIPXVFZSA-N 386.495 5.340 30 20 GKED CSCc1cnc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)s1 816564727 OFUSWJADODMHKA-UHFFFAOYSA-N 399.516 5.208 30 20 GKED COc1cccc(-c2csc(CN[C@H](CCCC#N)c3ccccc3)n2)c1 894606661 JZRBUAWYASKCOE-HXUWFJFHSA-N 377.513 5.343 30 20 GKED C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)c1nc(-c2ccc(CC)cc2)no1 904574948 YRFYBFYEVXTDAF-OAHLLOKOSA-N 377.872 5.007 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1nncc2ccccc12 914554349 JDHXWIVPGHIBEP-UHFFFAOYSA-N 390.878 5.038 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)c3cccnc23)cc1 915086298 SGCWIMXSQAQFQN-OAQYLSRUSA-N 397.865 5.796 30 20 GKED Cc1ccc(/C=C/C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(Br)c1 916846117 IABIGUQRQZXKIS-MYSGNRETSA-N 397.297 5.257 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc(Cl)s3)n2)cc1 916974603 NRVHVJLNJNAYDV-DDJMYBDESA-N 384.913 5.723 30 20 GKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1ccc(N2CCOCC2)cc1 917516542 XLOQAMMCYPXUEE-KHPPLWFESA-N 375.493 5.148 30 20 GKED CC(C)(C)CC(=NNc1ccc(C(=O)O)cc1)c1ccc(Br)cc1 1776013177 LKUSZUVDIXWCDB-UHFFFAOYSA-N 389.293 5.400 30 20 GKED O=C(O)Cc1ccc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)cc1 1776083429 FVJZCXPWALGSRD-UHFFFAOYSA-N 389.238 5.327 30 20 GKED CC1(C)/C(=C/c2ccc(/C=C/C(=O)O)cc2)C(=O)c2cc(Br)ccc21 1776515253 SQIOWIRZRKZNHB-PFMZDYLOSA-N 397.268 5.104 30 20 GKED CCc1ccc(C(=O)O)cc1NCc1cccc(OCc2cccc(C#N)c2)c1 1776966723 MHCBGBKGCGYPRF-UHFFFAOYSA-N 386.451 5.010 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1777372662 RUERYYQDQNVRQD-XACIZNRCSA-N 378.449 5.067 30 20 GKED O=C(O)c1cccc(/C=C\C(=O)c2ccccc2Oc2cccc(Cl)c2)c1 1777685353 PEADQNQXGYWMKE-QXMHVHEDSA-N 378.811 5.727 30 20 GKED N#Cc1c(NC(=O)c2c(Cl)ccc(Cl)c2Cl)sc2c1CCCC2 5756697 VTOLIONSHQXOLX-UHFFFAOYSA-N 385.703 5.711 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3ccc(F)c(F)c3)c2)cc1 16388201 JKMMTBKNDYQHFE-LFYBBSHMSA-N 393.389 5.122 30 20 GKED CCCCCc1nnc(NC(=O)c2ccccc2-c2ccccc2C#N)s1 26559908 SYDVUEIUYBVWFX-UHFFFAOYSA-N 376.485 5.062 30 20 GKED Cc1cccc(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 46861528 OSHAGVMRUBKRKK-OAQYLSRUSA-N 390.870 5.321 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2\Cc3ccccc3C2=O)cs1 54895688 HBNJLSKXXVPWCF-RVDMUPIBSA-N 394.883 5.304 30 20 GKED Cc1cc([C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)c(C)o1 60138126 XPWZTBOLQQJWJB-HNNXBMFYSA-N 376.481 5.410 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)cc1 68360867 UKBVXUXJZISQOJ-ROUUACIJSA-N 385.467 5.137 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1 90665066 BHYQVSUGWAZLQY-AVRDEDQJSA-N 378.520 5.256 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)nc3Cl)cc2)c1 102736961 CIAWWUGUJOVASA-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(F)c(C#N)c2)cc1 102879460 FWSAJOBIGBLSMB-UHFFFAOYSA-N 387.439 5.114 30 20 GKED N#Cc1cccc(COc2cccc(/C=C/C(=O)c3ccc(F)cc3F)c2)c1 107841655 FNCLHAAILUZBMM-JXMROGBWSA-N 375.374 5.312 30 20 GKED Cc1ccccc1[C@H]1CCCN1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 108360034 FNCPHDFAGPBEEK-GHTZIAJQSA-N 393.556 5.165 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1CCc1ccccc1 108530434 RPFCAUWXVGCAME-ICSRJNTNSA-N 393.556 5.567 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccccc1Br 120812692 DQGTUSBBXJDSOB-UHFFFAOYSA-N 383.270 5.302 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 121102111 GLUHZJMRSPRYIZ-UHFFFAOYSA-N 391.471 5.187 30 20 GKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1c(Cl)nc2sccn12 130965002 VVXFBJCOGBJMFU-ONEGZZNKSA-N 383.835 5.146 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1cccc(OC(C)(C)C)n1 132028317 PTGHKSSDESIHCY-INIZCTEOSA-N 397.544 5.224 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC(OC(C)(C)C)CC2)cc1 151542399 YCAFUEBYJRVTMY-UHFFFAOYSA-N 392.499 5.079 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(CSc2cccc(C#N)c2)cs1 158673654 AUICZGOTISDNTQ-UHFFFAOYSA-N 399.928 5.645 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1cccc(F)c1 170992209 ZTOMQNRHLIVBCD-LSDHHAIUSA-N 388.533 5.510 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(F)c1 171742358 UBEJYKMIJDHIPQ-KXBFYZLASA-N 383.492 5.446 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171838698 DWPZSLHOTVPPJD-MRXNPFEDSA-N 390.512 5.149 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1cccc(CC#N)c1 177126938 YQGDRVILEWSUTI-MRXNPFEDSA-N 375.497 5.018 30 20 GKED Cc1ccc(SC2(C(=O)Nc3ccccc3O[C@@H](C)C#N)CCCC2)cc1 182038887 GYOGGTLXFNMRFD-KRWDZBQOSA-N 380.513 5.330 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)csc1Br 185351966 ZSRWTLVGTRWLOO-JTQLQIEISA-N 395.347 5.323 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 186366093 GOCFYCCUVGTWCT-OAHLLOKOSA-N 388.496 5.129 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)Nc1cccc(C#N)c1C 191929616 ZUVKKUFBIZARKL-UHFFFAOYSA-N 385.345 5.101 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(NC(=O)c2ccccc2)c1 237602923 SSPZYFSYKFYOOZ-MOPGFXCFSA-N 399.494 5.081 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303310924 QZBWUEXMNOCMKD-IRXDYDNUSA-N 382.529 5.468 30 20 GKED Cc1cccc(N=C(O)[C@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c1C 328700836 MYIINGLNLOJPHE-JTSKRJEESA-N 391.515 5.377 30 20 GKED C[C@@H](NC/C(O)=N/C12CC3CC(CC(C3)C1)C2)c1nc(C(C)(C)C)cs1 329678327 QGWIRWDYRFVPBV-BUBBNXEVSA-N 375.582 5.017 30 20 GKED CCCc1occc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 409623654 IKZCVMDJZUZPJK-UHFFFAOYSA-N 376.412 5.157 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cnc(-c3ccccn3)s1)c2C#N 410977949 LBQUUKZQOPDHGV-NEPJUHHUSA-N 394.525 5.076 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@H]2CCCc3sc(Cl)cc32)C2CC2)cc1 426082256 XAXFIMFATCRSJQ-KRWDZBQOSA-N 385.920 5.025 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N(CCC#N)CCC(C)C)c1 428882254 BTVRBOBLTBZFBE-UHFFFAOYSA-N 387.471 5.443 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)cc2)c1)c1nc2ccccc2o1 429671304 NINUGBVWTFSXSW-OAHLLOKOSA-N 378.840 5.700 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ncc(Cc2ccccc2)s1)c1ccccc1 431689124 APYUVNJHOHKTTL-FQEVSTJZSA-N 390.512 5.291 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 435653165 FPCXDNZADJCDHC-FQEVSTJZSA-N 395.528 5.408 30 20 GKED CCc1nc(C)c([C@H](C)N(C)C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 438638784 STXVRBODVPEVKT-NSHDSACASA-N 396.438 5.129 30 20 GKED N#CCC[C@H](NC(=O)N1CC=C(c2ccc(Cl)cc2)CC1)c1ccccc1 438854005 VLTAXCOGOFJDJZ-NRFANRHFSA-N 379.891 5.184 30 20 GKED N#CCC[C@@H](NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F)c1ccccc1 440261758 UTJWCPZFMVZCNN-RTWAWAEBSA-N 383.442 5.246 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 441534977 RYCVTQVTXFWWKK-WMLDXEAASA-N 380.410 5.708 30 20 GKED C=CCOc1ccc(CN[C@H](CC(F)(F)F)c2ccccc2C)cc1OC 444015939 XHHUQFRLOUKWQH-GOSISDBHSA-N 379.422 5.352 30 20 GKED N#Cc1cn(CCc2cc(Cl)ccc2Cl)c2ccc(Cl)cc2c1=O 447295981 RNYBLJDTVHFEBG-UHFFFAOYSA-N 377.658 5.076 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)NCc2ccc(C(F)F)cc2)c1 462916838 KIIDYFQMNXPDDV-UHFFFAOYSA-N 392.405 5.005 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c2cccnc2c1C 464466506 WRNMUYIZOKBWJJ-UHFFFAOYSA-N 394.434 5.163 30 20 GKED C=C(C)C[C@@H](C)C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 466245090 XABHQUJUXIGYSH-BXUZGUMPSA-N 378.232 5.161 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 475572301 INIKVLPQAOQESW-XZOQPEGZSA-N 387.527 5.842 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 476107553 DMZHSSSWLNUFNU-INIZCTEOSA-N 380.797 5.175 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](C(=O)Nc1ccccc1)c1ccccc1 481649408 DYXDYMZMPHMPSR-RPBOFIJWSA-N 395.506 5.295 30 20 GKED C=CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)CC1CCCCC1 484543346 PPDCCJUNTXPMAS-SFHVURJKSA-N 385.577 5.088 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 492253885 ROUHGAJGPSHFRQ-UHFFFAOYSA-N 396.409 5.348 30 20 GKED Cc1ccc(Br)c(NCc2cn(CCC#N)nc2-c2ccccc2)c1 503248236 WQOZRIPEBOVFEP-UHFFFAOYSA-N 395.304 5.147 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCc3ccc(Cl)cc3Cl)CC2)cc1 503878690 WFVTZTZPQAPNJD-UHFFFAOYSA-N 385.294 5.114 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 504034558 HQRQFYGUMWLLPV-KKSFZXQISA-N 389.886 5.878 30 20 GKED CCCOc1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1OCCC 505325929 QSMHXAHEFRLVMQ-INIZCTEOSA-N 381.476 5.019 30 20 GKED N#C[C@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc(Cl)cc1 505797640 WVIORLGUPNFYPG-ORBWHLTESA-N 396.840 5.170 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 509632286 GCAGKNLEBLXZDK-VXGBXAGGSA-N 379.312 5.223 30 20 GKED CCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H](C)c1cc2ccccc2o1 510769012 ZKHADIVCGAIWMD-MRXNPFEDSA-N 375.472 5.849 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)CSCc1ccc(C#N)cc1)C1CC1 512082420 FERLNRIQSGJUFJ-OAHLLOKOSA-N 384.932 5.197 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c(C)n1C1CCCCC1 513219113 NTMSPOZHICOMOH-SFHVURJKSA-N 389.421 5.514 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 516307049 IVACTIJWLVSECN-IRXDYDNUSA-N 389.524 5.750 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(C(F)(F)F)cc1 518243173 QTRBUOBKTIFUGG-ZDUSSCGKSA-N 394.418 5.117 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccc(F)cc1 519799871 ILWSMWPUCFYCCS-ROUUACIJSA-N 377.246 5.183 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1cc(F)ccc1F 520835379 LURIHIGILPSIJW-NSHDSACASA-N 386.389 6.162 30 20 GKED N#C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C1CCCCC1 524535790 SSRSUIGGWQNGKE-LJQANCHMSA-N 377.517 5.326 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C)c1ccccc1 534640259 DTDASTWLMODYMZ-PMACEKPBSA-N 390.527 5.308 30 20 GKED N#Cc1ccccc1/C=C(/CC(=O)O)c1nc2cc(C(F)(F)F)ccc2s1 535890659 DKXNFJPPONDDMB-QPEQYQDCSA-N 388.370 5.202 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 536331551 YGOVWNXFNSSNSI-UHFFFAOYSA-N 384.483 5.371 30 20 GKED C=CCC[C@H](N[C@H]1CC(=O)N(C)c2ccccc21)c1ccc(C(F)(F)F)cc1 537950411 WCZVTEQGOIXTKV-OALUTQOASA-N 388.433 5.410 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(C(F)(F)F)cc2Cl)cc1 538272684 IYUPSLBOMLYFIA-UHFFFAOYSA-N 396.796 5.318 30 20 GKED Cc1cc(C)n(-c2ccc(CN[C@H](C)c3ccc(C#N)cc3)c(C(F)(F)F)c2)n1 538396959 KFTJHLHYCJMGBS-MRXNPFEDSA-N 398.432 5.230 30 20 GKED N#Cc1cc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)ccc1Cl 543471973 PSKSJOWPZTZLNG-UHFFFAOYSA-N 389.867 5.163 30 20 GKED C=CCNC(=O)c1cccc(-c2noc([C@@H](C)Sc3ccc(Cl)cc3)n2)c1 544337036 VISUPHJFUWHFPR-CYBMUJFWSA-N 399.903 5.159 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(F)c(Br)cc2Cl)cc1Cl 546668253 JUWJKZCQSPTKMT-UHFFFAOYSA-N 388.023 5.019 30 20 GKED CCOC(=O)[C@@H]1CC[C@@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 550827132 KOIQZDKDRZLMQT-DNVJHFABSA-N 376.500 5.193 30 20 GKED CCN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@@H]1CCOC(C)(C)C1 558451661 ANWMELFQEYRNAJ-LJQANCHMSA-N 393.487 5.162 30 20 GKED C[C@@H](CCC#N)Sc1nnc(COc2ccccc2Cl)n1-c1ccccc1 559976468 ASOATPUTMOCPAL-HNNXBMFYSA-N 398.919 5.284 30 20 GKED COc1ccccc1[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccccn1 564809759 WJHZVEXCYLHYEQ-WIOPSUGQSA-N 383.495 5.109 30 20 GKED COc1ccc([C@@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccc(F)cc2)cc1 580943864 YQEJIVSNTCRODU-DQEYMECFSA-N 386.470 5.463 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(F)cccc1SCC 583411379 HWFBENMFPGFSAG-UHFFFAOYSA-N 390.528 5.325 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1 596735843 QYFZGOJFSBRPPI-UZLBHIALSA-N 395.528 5.823 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CC[C@@](C)(C#N)C3)c(F)c2)cc1 596916150 HVWKNZFGJTWZKZ-QFIPXVFZSA-N 381.451 5.047 30 20 GKED CCSc1ccccc1C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 603738919 IHBCEMZGCUNNKS-UHFFFAOYSA-N 389.480 5.418 30 20 GKED COc1ccc(SCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603968541 ZPMJRLCWHRCKMD-UHFFFAOYSA-N 380.494 5.026 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCC(F)(F)F)c(C)c1 606584550 BZBKONHAUFRLIG-UHFFFAOYSA-N 384.423 5.218 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cc(Cl)ccc2C)cc1C 608876897 AQOBGGYQECSACB-UHFFFAOYSA-N 392.890 5.295 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3nc(C)c(SCC#N)s3)sc2c1 609149853 LJTHNZYVYRISTM-UHFFFAOYSA-N 393.946 5.496 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)n1cccc1 609201106 WUKJRZPNUUDQAW-OAHLLOKOSA-N 379.847 5.395 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(Cl)c1 609296049 DPFXSYCNELPUJM-UHFFFAOYSA-N 394.833 6.012 30 20 GKED CC(C)[C@H]1CC[C@H](C)C[C@H]1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 609376694 HYAXYRZLLNOAHP-JRBPQWBISA-N 388.577 5.354 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)c1cccc(F)c1 609826944 PLTOMEPOQIDSLA-OAHLLOKOSA-N 385.508 5.319 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCc2ccc(F)cc2)c1)c1cccc(C#N)c1 610318758 YAHGTJWZBGKQJF-MRXNPFEDSA-N 389.430 5.159 30 20 GKED C[C@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1cccc(C#N)c1 610360673 CIBSQIHKQKRQJG-JTQLQIEISA-N 375.280 5.571 30 20 GKED Cc1cc(F)c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1F 610706259 CYVKTHKDWFDAPF-UHFFFAOYSA-N 380.419 5.224 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4ccc5ccccc5n4)cc3c2C1 613291230 WTGXVMAKXYAOCQ-YWZLYKJASA-N 379.463 5.331 30 20 GKED C=CCc1cc(C(=O)N(C)[C@H](C)c2cc3ccccc3o2)cc(OC)c1OC 641897665 GDMBZNSEABPFDU-OAHLLOKOSA-N 379.456 5.012 30 20 GKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 669727600 GMQIQPWLYAYNOJ-CHWSQXEVSA-N 380.332 5.010 30 20 GKED COc1ccc(C2(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)CCC2)cc1 726322099 FWJINBOCMSVQDM-MRXNPFEDSA-N 396.899 5.256 30 20 GKED CSc1ccc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 733083470 JTEULORSUHDCDM-YFHOEESVSA-N 382.466 5.336 30 20 GKED C=CC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccncc1 734685336 ZMOMZKAMCVXDEB-RBUKOAKNSA-N 390.314 5.552 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 736003279 WZZCOCNSFSPSIB-HXUWFJFHSA-N 391.814 5.156 30 20 GKED Cc1cccc(C(C)(C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 736955307 HLLYSYRCNCBJBE-QHCPKHFHSA-N 383.495 5.707 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2oc(C(C)(C)C)nc2C#N)cc1 741460439 OSSCZVOYMWCRPD-UHFFFAOYSA-N 388.471 5.355 30 20 GKED CS[C@@H]1CC[C@@H](NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 742744328 JNMGWFNRKGGESU-GDBMZVCRSA-N 386.904 5.018 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc3cccnc23)cc1 745267981 HFQHOYVBMLEMNN-HSZRJFAPSA-N 392.462 5.212 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)Nc3ccc(F)cc3OCC#N)cs2)cc1 760791394 AQVUMBJESZQBTH-UHFFFAOYSA-N 395.459 5.227 30 20 GKED CC(C)n1c([C@@H]2CCCN2Cc2ccc(O[C@@H](C)C#N)cc2)nc2ccccc21 769403206 FPFKYIUOPUFQEI-MBSDFSHPSA-N 388.515 5.245 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1Br 776733900 SGHBQCVRGVVLNM-UHFFFAOYSA-N 394.725 5.400 30 20 GKED C[C@@H](N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779082371 MPDAJICAAQQDPW-ZHRRBRCNSA-N 391.515 5.633 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)Nc1ccccc1O[C@H](C)C#N)C1CC1 780682358 UQDOOBMSFPIXHX-MSOLQXFVSA-N 399.494 5.888 30 20 GKED C#CC[C@@H](NCc1c(C)nn(Cc2ccc(Cl)cc2)c1C)c1ccccc1 785784355 ACPLKYXLKQZILJ-HSZRJFAPSA-N 377.919 5.056 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(Br)cc1 792091590 LTRQMQOJUPTVKX-AUUYWEPGSA-N 393.284 5.367 30 20 GKED Cc1cc(/C=C\C(=O)[C@@H](C#N)c2cnc3ccccc3n2)c(C)n1C1CCCCC1 792105916 YYLVRHNZKRCSJG-SQZREULQSA-N 398.510 5.443 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(CC[C@H](O)c2ccccc2)c1)c1ccccc1 793629855 SQLBSZJXGPXXAV-ZCYQVOJMSA-N 398.506 5.379 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1 814305484 JKHSUTHSJPMPSS-MRXNPFEDSA-N 382.250 5.296 30 20 GKED FC(F)(F)c1cc(NN=Cc2scnc2C2CC2)cc(C(F)(F)F)c1 814948886 KAVRCJKUWRDTLD-UHFFFAOYSA-N 379.329 5.504 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCC2)c(F)c1 815635863 KJTDUTAMCVWWHQ-AUSIDOKSSA-N 379.523 5.902 30 20 GKED Cc1cc(C#N)cnc1C(=O)O[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 815951698 NFGRMMXRWKZTCG-ZDUSSCGKSA-N 397.887 5.265 30 20 GKED N#CCCC[C@H](NC(=O)/C=C/c1ccccc1OC(F)(F)F)c1ccccc1 817319826 SHTYMBIVINYVCL-JKGDOXCYSA-N 388.389 5.150 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)O[C@@H]1CCC[C@@H](C#N)C1 839050397 IVZXNKQNVAGPEU-DGCLKSJQSA-N 379.243 5.196 30 20 GKED N#C[C@@H](C(=O)CC1(C#N)CCCCC1)c1nc(-c2ccc(Cl)cc2)cs1 850763088 VYQTXZIJVDUFEU-INIZCTEOSA-N 383.904 5.504 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccc(CC#N)cc2)c1 863856354 STGWOQASRYSRKQ-UHFFFAOYSA-N 385.851 5.005 30 20 GKED C=CCN(C(=O)c1cc2c(C)nn(Cc3ccccc3Cl)c2s1)C(C)C 914683036 BYRAUHHEKPSWDE-UHFFFAOYSA-N 387.936 5.145 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2Cl)cc1Cl 916056830 IZMISATXNBTOKS-QGZVFWFLSA-N 382.250 5.296 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3ccc4ccccc4n3)c2cc1C(C)C 916848580 DTADNBVYQMEGRT-OAQYLSRUSA-N 382.463 5.832 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(F)ccc3s2)cc1 916954678 JWOZIXWVNKSJRH-ACJLOTCBSA-N 394.471 5.515 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2cnc(-c3ccccc3)nc2)cc1 921215471 XYQRRTOVVUKFHC-UHFFFAOYSA-N 391.430 5.039 30 20 GKED CC[C@H](C)c1nnc(N2CCC[C@](C)(C#N)C2)n1Cc1ccc(C)cc1SC 1752750817 MKNQQQQUQGJUKO-HTAPYJJXSA-N 397.592 5.000 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3cccc(C(F)(F)F)c3)cc2)c1 1776014953 RWOPQVMBWSVUPG-UHFFFAOYSA-N 398.384 5.446 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776119819 MRJJRJSKCDWPPI-OWBHPGMISA-N 390.504 6.307 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)cc1OCCC 1776125808 SYFKMMXSARZXND-DCKTUCEMSA-N 394.467 5.258 30 20 GKED CC[C@H](C)Oc1cc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)ccc1OC 1776694867 JDWOZLUIEASYSN-BRYHAGSVSA-N 394.467 5.173 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccc(C(C)(C)C)cc3)n2C)cc1 7442607 ATFYFSRZWWTCOW-FQEVSTJZSA-N 390.556 5.315 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1[nH]c2ccc(Cl)cc2c1Cl 63251279 IDAWRXYJTHFCRV-UHFFFAOYSA-N 384.266 5.175 30 20 GKED CCc1nc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 69202950 JSGMEOCGBHHHQP-UHFFFAOYSA-N 392.484 5.033 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(C)noc1C 124358505 ODVLQSWFHXIQNE-HXUWFJFHSA-N 390.443 5.228 30 20 GKED C=CCCOCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 148857686 XERDRASKNQZFHA-UHFFFAOYSA-N 394.521 5.200 30 20 GKED CC(C)Oc1ccccc1CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 155487128 IYBUECSLCKBNDV-GOSISDBHSA-N 376.481 5.016 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 180202881 DWGUIJJSTLLASA-NSHDSACASA-N 398.837 6.005 30 20 GKED COc1ccc([C@H](C)N[C@H](CCC#N)c2ccccc2)cc1CN1CCCCC1 183370527 QMHXHBLKOQAFMJ-GBXCKJPGSA-N 391.559 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCCOC)Cc1ccncc1 191473046 HZUYLZDVOIVLCO-UHFFFAOYSA-N 381.520 5.004 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)cc1OC 248148342 YXAUVVKUHWCCKJ-UHFFFAOYSA-N 399.450 5.056 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)s1 303747205 KIEKQBVWEDRBPZ-HNNXBMFYSA-N 392.549 5.440 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)Nc1cc(C(F)F)ccc1Cl 416911135 BGDQTWHNUCWSBM-INIZCTEOSA-N 375.806 5.348 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425658369 JEUGZEGVDRGKKE-QGZVFWFLSA-N 379.504 5.407 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(F)cc3)CC2)sc2ccc(C#N)cc12 428007909 YCCMBWZEMBIBHT-UHFFFAOYSA-N 376.456 5.150 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 429823077 TVLMLESJYWMTJC-LJQANCHMSA-N 398.940 5.537 30 20 GKED N#Cc1ccnc(NC(=O)c2oc3ccccc3c2CSc2cccs2)c1 436021025 TVFZLUJVVBFIHG-UHFFFAOYSA-N 391.477 5.306 30 20 GKED FC(F)C(F)(F)COCc1cccc(N[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 438109571 OVGIJAWCHHRMAK-GXTWGEPZSA-N 387.339 5.637 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccccc1Sc1ccccc1[N+](=O)[O-] 441072683 WMMMHFWVMMDRIB-UHFFFAOYSA-N 389.436 5.178 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@@H]3/C=C\c3ccccc3)o2)cc1 441181927 OVMUFWSGZRLXNS-OOZJCBPQSA-N 384.483 5.066 30 20 GKED N#Cc1cnc(C(=O)Nc2ccc(Cl)cc2Nc2ccccc2)c(Cl)c1 447705700 DDKHTVKJIUTHAP-UHFFFAOYSA-N 383.238 5.256 30 20 GKED CC(F)(F)CCNC(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 455146372 SRSIEFXDEHEKHV-LLVKDONJSA-N 392.290 5.043 30 20 GKED CCOc1ccc(Cl)c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 455773676 MWLPWUALXLOPAQ-YLJYHZDGSA-N 383.879 5.042 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N1CC[C@@H](CSc2ccccc2)C1 462925323 MBDUCCKFJXAMOU-CQSZACIVSA-N 381.451 5.003 30 20 GKED C=CCn1c(SCCOc2ccc(SC)cc2)nnc1-c1ccccc1 462980988 MKQQYIOJHHPBRF-UHFFFAOYSA-N 383.542 5.024 30 20 GKED N#Cc1ccc(SCc2nnc(-c3ccccc3)s2)cc1C(F)(F)F 463790926 RQELTVPVJNVNES-UHFFFAOYSA-N 377.416 5.388 30 20 GKED Cc1cc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c(C(F)(F)F)o1 472353476 RGMVHFOHLKEKKB-LBPRGKRZSA-N 383.263 5.169 30 20 GKED CN(Cc1ccc(-c2ccccc2C#N)cc1)Cc1nc(C(F)(F)F)cs1 472466797 ZOLVHGKSINOXND-UHFFFAOYSA-N 387.430 5.333 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4sccc4c3)n2)cc1 473141425 FYAAZZZXUDQMKK-KRWDZBQOSA-N 390.489 5.523 30 20 GKED COc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(OCC(C)C)c1 475502741 JVYDCSGNXWNRRX-MRXNPFEDSA-N 398.528 5.234 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)N1CCc2sccc2C1 475547868 MOXBOVMJSOXKOB-KRWDZBQOSA-N 397.588 5.168 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)C[C@H](CC#N)c3ccccc3)CC2)n1 475932984 QNNZVGSUPCZTOL-IBGZPJMESA-N 395.572 5.234 30 20 GKED CCC1(Cc2ccccc2)CCN(C(=O)c2cccc(SCC#N)c2)CC1 478313300 QPIOJHRMOCXOMR-UHFFFAOYSA-N 378.541 5.177 30 20 GKED COc1cc([C@@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)ccc1OC(C)C 481913357 NCOAWVSSMYGOHQ-VGOFRKELSA-N 378.516 5.472 30 20 GKED CCc1c(NC(=O)Nc2ccc(OC(C)C)c(C#N)c2)cnn1C(CC)CC 484537507 QPBAAADKAGTKQG-UHFFFAOYSA-N 383.496 5.109 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCc2ccccc2C1 499598114 WBKAXLVUMPJDHU-UHFFFAOYSA-N 397.478 5.639 30 20 GKED Cc1c(C#N)cccc1C(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 509120811 GIJQAIQYZHVDHD-UHFFFAOYSA-N 395.915 5.150 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccc(SCC)cc1 509539827 IUKIKPBQVKINEC-QGZVFWFLSA-N 379.529 5.129 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc3c(c2)CCC3)cc1 513953913 VOXCPAGSYLAFQF-UHFFFAOYSA-N 399.469 5.420 30 20 GKED N#Cc1c(Br)cccc1N[C@@H](c1cccc(F)c1)c1ccccn1 514638481 GWRXNWIOKLTFHF-IBGZPJMESA-N 382.236 5.056 30 20 GKED CC(C)[C@H](NC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 515100709 DNRDRZMHJIBGRR-FQEVSTJZSA-N 390.512 5.124 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1cccc(Cl)c1Cl 518127748 KLSSMTIFLIQYTL-LBPRGKRZSA-N 395.311 5.405 30 20 GKED C[C@@H](NC(=O)Nc1cc(Cl)ccc1N1CCCCC1)c1ccc(C#N)cc1 518828010 HSWOBVBGXCLBLE-OAHLLOKOSA-N 382.895 5.085 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519050876 DEAWOJKKAZUMIP-UHFFFAOYSA-N 383.451 5.571 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccccc1SC[C@@H](C)C#N 520826160 BZRKZCWMINEPMZ-WMZOPIPTSA-N 394.540 5.396 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 521787966 YSJAHPHQOBBLCH-JOCHJYFZSA-N 395.934 5.531 30 20 GKED Cc1csc(C2(NCc3cccc(OCc4ccccc4C#N)c3)CCC2)n1 521833953 LNRGWEXHZROHAG-UHFFFAOYSA-N 389.524 5.071 30 20 GKED CCN(C(=O)c1csc(-c2c(F)cccc2F)n1)[C@H](C)c1ccc(C#N)cc1 523849989 GIDIPXGXYHZJML-CYBMUJFWSA-N 397.450 5.183 30 20 GKED C[C@H](Cc1noc(-c2ccc(Oc3ccc(C#N)cn3)cc2)n1)c1ccccc1 547175105 IPELHTMOWLDHSJ-MRXNPFEDSA-N 382.423 5.142 30 20 GKED COc1cc(C#N)ccc1OCc1nc(C(C)(C)c2cccc3ccccc23)no1 560010412 GNFCWYJTEZAZNG-UHFFFAOYSA-N 399.450 5.008 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)CCCCC2=O)c1nc(-c2ccccc2)cs1 562170581 RSACWDUELCMQIN-IBGZPJMESA-N 386.476 5.209 30 20 GKED N#CCCCCCC(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 588896318 OZOYLSRELZQXPI-FQEVSTJZSA-N 385.305 5.129 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(CNc3nc(C)cc(C)c3C#N)c2)c1 603870661 RYIGENOKWHQNHL-UHFFFAOYSA-N 385.471 5.135 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056117 AJVICJKWSKXCSN-UHFFFAOYSA-N 394.858 5.046 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C3(C#N)CCCCC3)cc2Cl)c1 609062556 VJFOPWHNIYJNDG-UHFFFAOYSA-N 393.874 5.203 30 20 GKED CC(C)[C@H]1CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079916 LGHJAGBCVUGYCP-HXUWFJFHSA-N 397.906 5.443 30 20 GKED Cc1c(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)oc2ccccc12 609681805 ATDGEWXXAREBML-UHFFFAOYSA-N 398.422 5.122 30 20 GKED Cc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c(O)c1 609742747 ZFINSEIPZJMNFL-UHFFFAOYSA-N 378.815 5.270 30 20 GKED COc1ccc(CNc2cc(C(F)(F)F)ccc2C)cc1OCCCC#N 610910683 ZZWBOGFNLVMGBT-UHFFFAOYSA-N 378.394 5.317 30 20 GKED Cc1cc(Br)cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1 614462249 DJTNACIOFADZOS-UHFFFAOYSA-N 384.060 5.188 30 20 GKED C=CCC[C@H](NC(=O)N1CC[C@]2(C1)CC2(F)F)c1ccc(C(F)(F)F)cc1 650982163 LXZOTTQLQOZIKJ-DOTOQJQBSA-N 388.380 5.153 30 20 GKED O=C(Nc1c(F)cc(F)cc1F)NC(CCC(F)(F)F)CCC(F)(F)F 666215705 PTQLUSSXIZOTHK-UHFFFAOYSA-N 396.253 5.279 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(F)c1 675739276 WZXGHEIEIKVILI-JMJZKYOTSA-N 375.303 5.525 30 20 GKED FC(F)Oc1ccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1Cl 678298871 ZFURCGLZBJQFCM-IUCAKERBSA-N 397.693 5.114 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1cc(CC)c(CCC)s1 726755861 ZKZUBASSYFXYGO-UHFFFAOYSA-N 377.513 5.012 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1 727222846 ADISEGCBGFZNJZ-UHFFFAOYSA-N 381.545 5.891 30 20 GKED CC(=NNc1nncc2ccccc12)c1ccc(OCc2ccc(F)cc2)cc1 727683750 LUPJZXLJVYOJBW-UHFFFAOYSA-N 386.430 5.184 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)[C@H]1CCCN1c1ccc(C#N)cc1 728163904 DBAIKOXHNMECOI-XMMPIXPASA-N 381.479 5.141 30 20 GKED N#Cc1cccc(OCCCCC(=O)OCc2ccc(Cl)c3cccnc23)c1 732398808 NYZPTQGICFLOQP-UHFFFAOYSA-N 394.858 5.052 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCc2ccccc2C1)c1nc2cc(Cl)ccc2s1 732595998 GQTQPAAHJRJOFZ-SUMWQHHRSA-N 380.900 5.321 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3cccc(F)c3C)o2)cc(OC)c1OC 734303277 JJCRKTGFBDMCFE-NTMALXAHSA-N 396.414 5.316 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1cccc(C)c1)Cc1ccco1)c1ccncc1 734680947 WTXKKNGNTCCYSV-JOCHJYFZSA-N 375.472 5.012 30 20 GKED C/C(=C\C(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccccc1C(F)(F)F 741919217 LVJZOFQASRFPPQ-DHZHZOJOSA-N 396.315 5.220 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)[C@@H]3SCCc4sccc43)cc2)cc1 742496276 AGRQGUBLRSYXAT-HXUWFJFHSA-N 377.490 5.223 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)c1 753680904 CBJBWHRFCUIGMJ-XMMPIXPASA-N 385.417 5.264 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2scnc2C2CCCC2)cc1 758946460 SFTJLFSXRIAOCT-HXUWFJFHSA-N 387.508 5.708 30 20 GKED N#Cc1cnc(NC(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)s1 759632151 DXHXYQSRYNKNHB-GOSISDBHSA-N 399.928 5.129 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(OCc3noc(C)n3)cc2)cc1 777686316 PUHZFVZUYIGHRF-OAHLLOKOSA-N 399.878 5.261 30 20 GKED CC(C)n1cc2c(n1)[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC2 780422113 GZEIVTVDEHQVSL-MAUKXSAKSA-N 397.548 5.057 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(C#N)cc3Cl)cs2)c1 788361276 YFYFHJRKUZCRJQ-SOFGYWHQSA-N 380.856 5.240 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc2c(c1)CCCC2)c1nccc2ccccc12 792095144 JWQFXKQGJXRTRY-HSZRJFAPSA-N 384.479 5.149 30 20 GKED N#C[C@H](C(=O)CCCCc1ccc(Cl)c(Cl)c1)c1cnc2ccccc2n1 792100417 NIZBPHPRZOBPTR-HNNXBMFYSA-N 398.293 5.526 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C[C@H]2CCC(F)(F)C2)cc1 797835799 MZEZAANKLOHDMX-QGZVFWFLSA-N 384.426 5.096 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](c3cccnc3)C(C)C)n2)cc1 797943981 ZEHXDFOIAQRKEA-ICSRJNTNSA-N 375.497 5.130 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801913289 BXIVRLNFUVFGHI-GUDVDZBRSA-N 390.380 5.014 30 20 GKED N#CCSc1ccccc1C(=O)N1CCC([C@@H](F)c2ccccc2F)CC1 804195089 VGWVRUOSIQSCFL-HXUWFJFHSA-N 386.467 5.004 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c1 806806245 AGKBBLJJQNNTIK-QTGUNEKASA-N 391.515 5.050 30 20 GKED Cc1cc(C)c(CNc2ccccc2O[C@@H](C)C#N)c(OCc2ccccc2)n1 809190694 QMIJZDYLINAJPZ-IBGZPJMESA-N 387.483 5.180 30 20 GKED O=[N+]([O-])c1c(Cl)cc(Cl)cc1C=NOc1ccccc1C(F)(F)F 811646136 LXTSCDKQCBXQGQ-UHFFFAOYSA-N 379.121 5.333 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)c(F)cc1O 815635935 MDWPGTZPFDDGJD-UGSOOPFHSA-N 391.284 5.380 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)SCc3cc(Cl)ccc3OCC#N)o2)cc1 842175695 UWRMXZLUMRMWLN-CQSZACIVSA-N 399.903 5.595 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC[C@H]1CC1(Cl)Cl 844533497 BLFPCRZUGXCQIA-OLZOCXBDSA-N 386.348 5.176 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1CC2(C1)CC2(F)F 850868652 GMUNWSAMMXHZKA-QDYJBQRPSA-N 388.254 5.287 30 20 GKED CC(=NOCC(=O)Nc1c(C(C)C)cccc1C(C)C)c1cc2ccccc2o1 852751623 BSLAMDBSSAJWFA-UHFFFAOYSA-N 392.499 6.059 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(N(C)C(=O)OC(C)(C)C)cc1 861497400 IALUPYKZUHLIGR-UHFFFAOYSA-N 395.503 5.278 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccccc3)CCCC2)cc1 915179349 CJGJBJWJNWTUIO-DEOSSOPVSA-N 380.491 5.793 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)n1 916843698 COUMNJVFLMPKSD-MRXNPFEDSA-N 399.422 5.287 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 916846617 ZWGSTNUEWLGWPD-WMLDXEAASA-N 378.497 5.238 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1Cl 917045333 YABZAZJYOYHPDD-AWEZNQCLSA-N 389.307 5.721 30 20 GKED Cc1cc(Cl)ccc1NN=Cc1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1776104317 AGJYFANUWVNISK-OAQYLSRUSA-N 394.858 5.299 30 20 GKED CC(=NNc1cccc(Cl)c1Br)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776110536 HAVRHKDAOUNGJZ-MNOVXSKESA-N 387.705 5.027 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C/c1ccc(OCc2occc2C(=O)O)cc1 1776665962 PHAODDFMAUBHIK-PCXKXAPESA-N 388.419 5.015 30 20 GKED CCN(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776855467 PLEXGECBGKYLTI-LICLKQGHSA-N 385.463 5.404 30 20 GKED O=C(/C=C\c1cc2ccncc2s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569398 OEWFDHRJCJTYQT-WAYWQWQTSA-N 375.405 5.151 30 20 GKED COc1ccc2cc(CNC(=O)c3ccccc3-c3ccccc3C#N)ccc2c1 9942186 LOWDSZNUBDCJLN-UHFFFAOYSA-N 392.458 5.317 30 20 GKED COc1ccc(S[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 51534833 NOUUWEHUZRPFLV-KSSFIOAISA-N 394.521 5.176 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cccc(Cl)c2F)c1 65769750 IGCMKKZUPQJESA-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(-n2cccc2)cc1 66801982 XKDCAILQCXKENM-KRWDZBQOSA-N 375.497 5.053 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(CCc1cccc(F)c1)C1CC1 114011040 POGNEVXOUKEHDM-INIZCTEOSA-N 397.519 5.316 30 20 GKED Cc1nc(-c2ccccc2)ncc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 133429078 JLYOGBIMQOBFOE-SFHVURJKSA-N 396.475 5.066 30 20 GKED CCSc1ccccc1OCC(=O)Nc1ccccc1S[C@@H](C)CC#N 133847182 FLDPSPDQJMYDHX-HNNXBMFYSA-N 386.542 5.210 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccccc2)c2nccs2)cc1 178380578 QDFJYDZWHFOGQS-HSZRJFAPSA-N 381.504 5.561 30 20 GKED C=CCn1c(S[C@H](C)c2c(F)cccc2F)nnc1-c1ccccc1F 195677365 UJRQWRTZTLXCEX-GFCCVEGCSA-N 375.419 5.402 30 20 GKED CCN(CC)[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1 302817683 RZAVOFUNFSGNOT-VWLOTQADSA-N 397.522 5.038 30 20 GKED O/C(CCc1cc2ccccc2o1)=N/C1CCN(/C(O)=N\C2CCCCC2)CC1 328920343 LUCXMEDIZZVDGI-UHFFFAOYSA-N 397.519 5.033 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Cc1ccc(C#N)cc1 410458897 QBBGMOKDXCXIQM-MRXNPFEDSA-N 377.513 5.017 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(CN)nc1C)c1ccc(C(F)(F)F)cc1 423001073 HNZQTHWBOKFTGJ-FOIQADDNSA-N 377.454 5.226 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccccc1OC(F)F 426130866 LZJFJIVKJQDRIY-CQSZACIVSA-N 379.794 5.086 30 20 GKED C=CC[C@@H](C(=O)Nc1nnc(SCc2cccs2)s1)c1ccccc1 429021928 SDOLHLWCAYWWEJ-OAHLLOKOSA-N 387.555 5.190 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 431465549 OOXBUWWPFOPYEK-SFTDATJTSA-N 383.442 5.316 30 20 GKED CCc1ccc(CCSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 437441693 XBMGBTOSCSARQK-KRWDZBQOSA-N 398.597 5.558 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(OC2CCCC2)c1 437907705 KIESAMHYOMBJJS-XZOQPEGZSA-N 389.499 5.312 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 438603794 SOUXZJWHBMSLBJ-LJQANCHMSA-N 390.405 5.252 30 20 GKED CN(C(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc(C(F)(F)F)cc1Cl 439123434 KYSVJSDNLFVPNC-UHFFFAOYSA-N 378.781 5.191 30 20 GKED C[C@H](CC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 439669342 DOFZIEQCWUEWGS-BEFAXECRSA-N 385.305 5.104 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)NCC1CCC(C#N)CC1 440981444 VWTAEJQYJBWHLR-UHFFFAOYSA-N 395.478 5.165 30 20 GKED C=CCC[C@H](NC(=O)c1ncc(C#N)cc1Cl)c1ccc(C(F)(F)F)cc1 441563160 FXKWILKWVSCVND-INIZCTEOSA-N 393.796 5.063 30 20 GKED C=CCC[C@H](NC(=O)Cc1noc2ccccc12)c1ccc(C(F)(F)F)cc1 441590118 MUVRPHXVSKDJPX-KRWDZBQOSA-N 388.389 5.213 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3csc(C)n3)cc2)cc1 442755337 RREJLSCVARZZQM-UHFFFAOYSA-N 391.496 5.078 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3cn(CCCC#N)c4ccccc34)c2)oc1C 444039943 OFQPLKALKQWVRN-UHFFFAOYSA-N 398.466 5.469 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)c1ccccc1C(C)(C)C 460822889 IPLJHMGBJGSOBU-OAHLLOKOSA-N 388.558 5.037 30 20 GKED C[C@@H](C(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F)c1cccc(C#N)c1 462571820 AIPRIBMTVYNMHY-JLTOFOAXSA-N 382.385 5.235 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCC[C@@H](C(F)(F)F)C1 475580490 YVFJEBKSDQMFHS-NVXWUHKLSA-N 382.470 6.029 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)[C@@H](C)c1ccccc1C(F)(F)F 476503046 AXKIBXYYAIPNOM-RYRKJORJSA-N 388.433 5.401 30 20 GKED CCCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1ccc(F)cc1 477108485 AMYVDAMTWWRCLQ-UHFFFAOYSA-N 390.462 5.017 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1ccc(F)c(F)c1 477740737 CNTMYFUYKBCJLI-NYVOZVTQSA-N 395.453 5.063 30 20 GKED C=CCC1(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)CCC1 480406381 DDYIZLGHQZRLSC-UHFFFAOYSA-N 382.891 5.586 30 20 GKED N#Cc1cc(Cl)ccc1CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1 481072185 KXDRSYXFAQVHHX-OAQYLSRUSA-N 382.294 5.334 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1csc(CCc2ccccc2)n1 481645981 PLDWUIGTXYRWSF-HSZRJFAPSA-N 387.552 5.357 30 20 GKED CCCn1c(C)c(C(=O)[C@@H](C#N)c2nccc3ccccc23)c2cc(OC)ccc21 483213265 ANDNWQDTFVHKOG-NRFANRHFSA-N 397.478 5.407 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(OCC(F)F)cc1 483654877 WTQAFYNDNDEWHS-CYBMUJFWSA-N 391.443 5.369 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CC1CC(OC(C)(C)C)C1 485789154 SXLVQKBMDRDHPM-UHFFFAOYSA-N 392.499 5.581 30 20 GKED COc1ccc(CN[C@@H]2CCC[C@@H](c3ccccc3)C2)cc1OCCCC#N 486904102 SCTRFHCPPKPCJA-FGZHOGPDSA-N 378.516 5.194 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 487603034 LVWWMACSRRGBES-AQNXPRMDSA-N 386.417 5.360 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)cc1 499849966 WTZUEAPVHJWWKM-MLGOLLRUSA-N 379.312 5.164 30 20 GKED N#C[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccccc1Cl 499926851 XLLMOCGYESFMRG-QGZVFWFLSA-N 379.312 5.247 30 20 GKED Cc1c(C#N)cccc1NC(=O)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 502656836 OTWQVSPTFYTBGV-NRFANRHFSA-N 390.874 5.021 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)c1ccccc1 505686534 QZVAUBTXXMBWBH-NRFANRHFSA-N 386.451 5.491 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 509933937 YUPRTSVJRFAPFY-UHFFFAOYSA-N 396.249 5.740 30 20 GKED N#C[C@@H](NC(=O)CCCCCc1cccs1)c1ccc(Cl)c(Cl)c1 518321097 GPQBPDJUPHNXMX-QGZVFWFLSA-N 381.328 5.539 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)[C@@H](Oc1cccc(Cl)c1Cl)c1ccccc1 518545808 GCGULSHRJHKYAD-LIRRHRJNSA-N 391.298 5.122 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccnc(Oc2ccccc2)c1 518660003 CNEPZOGXWDAGCA-INIZCTEOSA-N 389.480 5.378 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3c(c2)CCC=C3)cc1 519463759 TYTHBDDCCYBLBX-UHFFFAOYSA-N 394.474 5.543 30 20 GKED CC(C)Oc1ccc(CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520941741 YYHVQYVTFVXMBU-KRWDZBQOSA-N 397.544 5.232 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521034012 SBHLOWUGGODXIO-IAGOWNOFSA-N 397.544 5.608 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 523198591 JQPHHNCBWWORST-UHFFFAOYSA-N 383.451 5.172 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CSc2cc(C#N)ccn2)cs1 524290052 VIYRMZCBVVONRO-UHFFFAOYSA-N 394.525 5.004 30 20 GKED Cc1ccc(C)c(Oc2ccc(CNC(=O)C[C@H](CC#N)c3ccccc3)cn2)c1 527233220 WTZSALJMTNDJSC-QFIPXVFZSA-N 399.494 5.195 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)c2c[nH]cc2-c2ccccc2)cc1 536889860 MLUXDQOEDXDOEZ-UHFFFAOYSA-N 377.447 5.150 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 541944746 GUAKEWYRRASXNJ-MAUKXSAKSA-N 382.435 5.023 30 20 GKED N#Cc1ccccc1CSCCNC(=O)Nc1cccc(C(F)F)c1Cl 544628926 YDJAQBCAZNMTOB-UHFFFAOYSA-N 395.862 5.204 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1nc(C(F)(F)F)cs1 548154710 MPFRSFYQCZNZLV-UHFFFAOYSA-N 381.832 5.097 30 20 GKED C=CCC[C@H](NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)c1ccco1 552046154 ZLCGZWOKRVLCAS-QFIPXVFZSA-N 391.515 5.196 30 20 GKED CCN(C(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 553299479 DIUUIDPZTYXDHZ-GOSISDBHSA-N 385.467 5.204 30 20 GKED CCOc1c(Cl)cc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)cc1Cl 556973208 QBPLDCJQROSUKT-UHFFFAOYSA-N 393.245 5.073 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc([C@@H]2CCOC2)cc1 563962308 TWMSKZQQFCSJTJ-LJQANCHMSA-N 384.435 5.107 30 20 GKED CCCN(CC)Cc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 564435931 QAAJWXRDLDJJON-SFHVURJKSA-N 377.513 5.018 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(Br)c3ccccc23)CC1 564929488 PCLAESQVUWHTQH-UHFFFAOYSA-N 386.293 5.150 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)cc2)ccn1 567433811 CDLAAMNDYMGTHL-UONOGXRCSA-N 389.377 5.053 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](CCCC#N)c3ccccc3)s2)cc1 574298038 NTTCQTLNMFKOTR-PGRDOPGGSA-N 389.568 6.513 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc(F)ccc3-c3ccoc3)cc2)ccn1 579657488 UYWXQTQXYILHMM-UHFFFAOYSA-N 399.381 5.397 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccccc3CC#N)cc2)cs1 588988046 HBRCGGIDEWJUFQ-UHFFFAOYSA-N 379.510 5.062 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCOc2ccccc2[C@@H]1C 596736088 SDMDZJWYFCVVCE-HOTGVXAUSA-N 381.501 5.068 30 20 GKED N#CCCC[C@@H](N[C@@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598678977 CAFYWMHSIZTLSW-MSOLQXFVSA-N 393.275 5.780 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cn2)c1 603622125 LBNHDSHNAYWOGA-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc4c(F)cccc4[nH]3)c2)c1 603640054 SQISPBHMIXXQAP-UHFFFAOYSA-N 385.398 5.010 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(-c2cccc(OC)c2)n1 603681217 VUZKWQAWBGHOTB-UHFFFAOYSA-N 377.513 5.103 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@H]2c2ccccc2Cl)c1C 603857060 PMGLIZCOEZWQLJ-QFIPXVFZSA-N 395.934 5.041 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 609056780 UIEXKJVYQMOUGM-SFHVURJKSA-N 388.467 5.180 30 20 GKED N#CCCSc1ccccc1NC(=O)c1sc2cc(F)ccc2c1Cl 609375899 JHAZUJVKRSSMFI-UHFFFAOYSA-N 390.892 5.952 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)CC(C)(C)c1ccccc1 609398022 BMZANMDBPKZWMH-QZTJIDSGSA-N 395.572 5.816 30 20 GKED CC(C)(C)Cc1nc2cc(NC(=O)c3cc4ccccc4n3CC#N)ccc2o1 609415595 GAYHOKSGMBFCKB-UHFFFAOYSA-N 386.455 5.147 30 20 GKED COc1ccc(CCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 609428503 RDQUCRPEHQNFSD-KRWDZBQOSA-N 382.529 5.441 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609500516 PXFATKUEYFNMGV-HXUWFJFHSA-N 389.480 5.255 30 20 GKED CC(C)N(C(=O)CCCCOc1cccc(C#N)c1)c1ccc(F)cc1Cl 609815307 AUFPGCWAWLVNJR-UHFFFAOYSA-N 388.870 5.341 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2ccc(-c3ccc(Cl)cc3)s2)cc1 614999907 KMOWLBYIBNUUNF-UHFFFAOYSA-N 396.899 5.237 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2cc(Cl)ccc2OC2CCCC2)CC1 619726314 IKMQSIPWFYGRAK-UHFFFAOYSA-N 395.934 5.114 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(-n2cccn2)cc1C 682760600 JMHRGTKIPXCKPI-UHFFFAOYSA-N 386.908 5.116 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(-c2ccccc2COC)no1 685254705 CQYNDOAHESZRDU-UHFFFAOYSA-N 390.361 5.134 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1ccc(C#N)cc1 725827435 QSRMFDVOQATGBP-UHFFFAOYSA-N 383.480 5.375 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)cc1 728695422 WQOCRYGNSPWWNC-NRUITVPNSA-N 393.389 5.628 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cc1 728698395 JCGKENNGKYGNJW-QIENPNARSA-N 377.440 5.741 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(Cl)n1 730995044 OBFZPUXWQCBGEW-UHFFFAOYSA-N 399.825 5.320 30 20 GKED FC(F)(F)c1ccc2sc(NN=Cc3occc3Br)nc2c1 743445279 MVIVKYZNBRJGOA-UHFFFAOYSA-N 390.184 5.117 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](Cc2ccccc2)c2ccccc2)c1 744029914 WXJCMVQRVYZECF-ISKFKSNPSA-N 396.490 5.059 30 20 GKED N#Cc1cc(NC(=O)CSc2ccc3ccccc3c2)c(Cl)c([N+](=O)[O-])c1 746483145 ZIISAXLLUJDETB-UHFFFAOYSA-N 397.843 5.004 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COc2ccc(Cl)c3ccccc23)n1 747194148 VIGNMHROOBGVRW-OAHLLOKOSA-N 384.888 5.328 30 20 GKED N#C[C@H](C(=O)Cc1coc2cc(F)ccc12)c1nc2cc(Cl)ccc2s1 749025551 PENDFFWGLRYJJC-CQSZACIVSA-N 384.819 5.254 30 20 GKED COc1ccc(C(=O)/C=C\c2coc(-c3ccccc3)n2)cc1Br 749891403 JFSXNYDVABKDHM-HJWRWDBZSA-N 384.229 5.009 30 20 GKED COc1cccc(/C(C)=C\C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 751826179 DMUBTEXSGUCWMX-VZEGMYIASA-N 388.492 5.407 30 20 GKED CC[C@H](NCc1c(F)c(F)c(F)c(F)c1F)c1nc(C(F)(F)F)cs1 754500632 YNELKOURDQKPRY-LURJTMIESA-N 390.299 5.098 30 20 GKED Cc1cccc(C)c1Oc1ccccc1NC(=O)Cc1cccc(OCC#N)c1 760408320 XLAPJQLRUSEQNS-UHFFFAOYSA-N 386.451 5.179 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(Cl)cc2)C(C)C)ccc1OC 774449643 PPBVBFCGZSGRNK-DENIHFKCSA-N 386.923 5.516 30 20 GKED C=CCc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2O)cc(OC)c1OC 788641778 ALFJTRQDMWKNPR-CYBMUJFWSA-N 395.421 5.008 30 20 GKED CC(C)(C(=O)Nc1ccc(C#N)cc1Cl)c1ccc(OC(F)(F)F)cc1 789658336 HDMDKCAQCPQBMQ-UHFFFAOYSA-N 382.769 5.027 30 20 GKED CN(CCC(F)(F)F)[C@@H](C/N=C\c1ccccc1O)c1ccc(Cl)cc1 790572710 BCVNEGIEESUQNW-VJUVOTIISA-N 384.829 5.090 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl 794331541 VDQZYWYGXHBMCA-APWZRJJASA-N 381.347 5.586 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccnc(F)c1 794722793 VMJGCGPUZYSTSE-CMDGGOBGSA-N 380.806 5.023 30 20 GKED O=C(NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)[C@@H](F)c1ccc(C(F)(F)F)cc1 801679629 NIDQEDOEQAMPKE-HONMWMINSA-N 385.323 5.201 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)OCc1ccccc1C(C)(C)C#N 805663832 ZCRDEGGMEGBSOF-UHFFFAOYSA-N 389.451 5.031 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 835110039 MIEIWIZHVBJYKR-UWVGGRQHSA-N 388.361 5.243 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)s1 841073053 UXQORZUUZYZVOX-ZDUSSCGKSA-N 399.516 5.020 30 20 GKED Clc1ccc(-c2ccc(C=Nn3cnnc3-c3ccccc3)s2)cc1Cl 914865826 ABOYSPHNQVDGQF-UHFFFAOYSA-N 399.306 5.863 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2cccc(Cl)c2)cc1 915353893 ZENYYTUVTDHTCQ-QFIPXVFZSA-N 389.886 5.360 30 20 GKED CCCC[C@H](CC)CNC(=S)N(Cc1ccc(C#N)cc1)CC(F)(F)F 916012774 NULRFAIOAMHNHE-HNNXBMFYSA-N 385.499 5.013 30 20 GKED Cc1ccc([C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)s1 919701446 HGVYBJTYHNCHIO-HNNXBMFYSA-N 378.522 5.570 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3ccc(SC)cc3)cs2)cc1 920064753 ZEYFLNFLBHXZKI-XGICHPGQSA-N 397.521 5.349 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)ccc(Br)c1F 1776783164 GODNUDZLRSFTNS-CQSZACIVSA-N 388.321 5.190 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)[C@@H](C)c2ccccc2)cc1 1776788278 WHAVEKJLAAJFAP-WMZHIEFXSA-N 383.532 5.382 30 20 GKED CCCn1nc(C)c(Cl)c1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776848223 NIJSAJYODAMALN-CMDGGOBGSA-N 398.846 5.109 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C/c1ccc(-c2ccccc2C(=O)O)cc1 1777316306 UTVCEORFESZZPA-MDWZMJQESA-N 392.838 5.610 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c(Cl)c1 1777352336 MBRLQWHKIFGLOA-JXMROGBWSA-N 382.799 5.203 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3c[nH]c(C)c3)cc2)CCC1 1788812216 OIUYQVRWAVCQCD-UHFFFAOYSA-N 393.531 5.063 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(C)cc2C)cc1 10168472 MFWKKJPSYBICDV-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#Cc1ccc(Oc2ncnc3scc(-c4ccc(F)cc4)c23)c(Cl)c1 15117009 SCHGGKRMCDLDOR-UHFFFAOYSA-N 381.819 5.815 30 20 GKED CCN(Cc1cccc(C#N)c1)Cc1ccc(OCc2cccs2)c(OC)c1 15369665 SGPZCXVTTBXMIK-UHFFFAOYSA-N 392.524 5.229 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2ccccc2)c(C)c1 22729546 HQXBKVPEASGFLJ-UHFFFAOYSA-O 381.546 5.012 30 20 GKED CCN(C(C)=O)c1nc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)cs1 45615529 ZDEXZAAOBKWREE-BUHFOSPRSA-N 382.529 5.460 30 20 GKED O/C(=N\c1nc(-c2ccccn2)n[nH]1)c1sc2cc(Cl)ccc2c1Cl 53524803 DBDLXBBDKGVXDF-UHFFFAOYSA-N 390.255 5.025 30 20 GKED CC(C)N/C(S)=C(/C(=O)c1ccc(C(C)C)cc1)[n+]1ccc(C(C)(C)C)cc1 55009774 CHSADOXMBUOSKG-UHFFFAOYSA-O 397.608 5.332 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc(Cl)c2)cc1 55823586 LYRCIDAFAWYCIH-UHFFFAOYSA-N 376.843 5.237 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 66178164 NOGDHTIOQHAJMP-SFHVURJKSA-N 379.504 5.027 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 66179339 AYLJKSSSONCLJQ-GOSISDBHSA-N 379.504 5.027 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1c(Cl)c2ccccc2n1C 66855945 RYFCRIYTDPTISH-ZDUSSCGKSA-N 383.904 5.478 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)cn1 72047942 FQJUJKMLIKYIPL-ZHACJKMWSA-N 393.874 5.266 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2)c1 102737370 KDCWLAKUHBWABW-UHFFFAOYSA-N 396.368 5.408 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(OCCCC#N)c1 113570619 PCDAOXDNBOMQLC-INIZCTEOSA-N 394.500 5.407 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 120116638 ZBAIKJLDMYINQK-GXTWGEPZSA-N 395.311 5.252 30 20 GKED N#Cc1ccc(C(=O)Nc2cccc(Cl)c2Oc2cccnc2)cc1Cl 155280162 ITODBKVVTDQWMH-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CCCn1cc(CNc2ccc(CCC(F)(F)F)cc2)c(-c2ccccc2)n1 175803200 LYMRLTJCCBXLMY-UHFFFAOYSA-N 398.432 5.571 30 20 GKED N#CCSc1cccc(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 177272466 QHZBGIRVSQITNG-NRFANRHFSA-N 375.497 5.151 30 20 GKED CCN(C(=O)NCCCCC#N)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 177501283 HFQPVNPOICWWHP-SFHVURJKSA-N 379.504 5.149 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2C[C@H](C)Sc3sccc32)ccc1OC 180816785 NEZHFOTUGJCLML-JLJPHGGASA-N 388.558 5.153 30 20 GKED C=CCC1(C(=O)N2CCC(c3nc(-c4ccccc4OC)cs3)CC2)CCC1 190419969 VZUMHMLWPCWGMO-UHFFFAOYSA-N 396.556 5.271 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@@H](CO)C1CC1 191421561 QTWQVLUIGKSUQX-QHCPKHFHSA-N 392.543 5.344 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1ccsc1)C(=O)c1ccccc1 213678398 RGMGKXXTCJIFCA-QNGOZBTKSA-N 389.520 5.778 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3cccc(OC(F)F)c3)c2)c1 237909135 KBXHJLHPHKWKSS-UHFFFAOYSA-N 394.421 5.028 30 20 GKED N#C[C@@H](C(=O)CC/C=C\c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl 255071652 YRZAGJDUZRIYAE-FAOGRTBUSA-N 387.266 5.134 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(OC(F)F)cc3)cs2)c1 301492576 MPZQMEIJMATAIY-JXMROGBWSA-N 387.407 5.316 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc(Br)ccc1Cl 321335857 VBWMIWKGHSEBNI-UHFFFAOYSA-N 391.696 5.027 30 20 GKED Cn1c(-c2cccc(N=C(O)C3C[C@@H]4CCC[C@H](C3)C4=O)c2)nc2ccccc21 328842763 VXRGBYZCFZUKRF-BYICEURKSA-N 387.483 5.224 30 20 GKED CC(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1F 330009652 HKKZWWGBQJEBRA-KJXMEXGPSA-N 394.918 6.058 30 20 GKED CC(C)[C@@H]1CCc2ccccc2[C@@H]1/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330021266 XODJTUYPRRUJMH-PEVXEQIPSA-N 382.548 5.828 30 20 GKED O/C(=N/CC1CCC(C/N=C(/O)[C@@H]2CC23CCCC3)CC1)[C@H]1CC12CCCC2 330025218 KHCLYCGWBFQPPJ-KHSMEXAKSA-N 386.580 5.866 30 20 GKED Cc1ccnc2[nH]c([C@@H](C#N)C(=O)c3ccc(SCc4ccccc4)cc3)nc12 429572412 UJAHJFRJPDQKHG-IBGZPJMESA-N 398.491 5.049 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1cccc(COC2CCCCC2)c1 433308218 XNCZODNFUVCGLA-NRFANRHFSA-N 376.500 5.247 30 20 GKED Cc1cc2sc(NC(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)nc2cc1F 434530035 LNBGORUMZFKBFF-MAUKXSAKSA-N 394.475 5.048 30 20 GKED C[C@@H](N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1(C)CC1 438636470 YWLHQDXKQSRJGH-BEFAXECRSA-N 381.907 5.648 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)N[C@@H](CCC#N)c2ccccc2)c1 440251056 AMGJHOSFLPWPQU-QHCPKHFHSA-N 387.483 5.345 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccco1 454755761 HVJLFFORWJGIIJ-BEFAXECRSA-N 381.501 5.433 30 20 GKED Cc1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)n([C@H]2C[C@H]3CC[C@H]2C3)n1 455068858 VLDKYBKAVBBELL-VMXMFDLUSA-N 391.519 5.109 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl 461684954 KVLDEGPVFUWZKA-UHFFFAOYSA-N 387.270 5.421 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(F)cc1[N+](=O)[O-] 466395153 IZFDMUGJFPXHOA-UHFFFAOYSA-N 396.218 5.024 30 20 GKED CCSc1ccccc1[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469274817 RKYZPXPJYXYNMN-QGZVFWFLSA-N 393.556 5.555 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c(C)c1 470895983 COQFAZNWBBTVRR-QFBILLFUSA-N 377.513 5.078 30 20 GKED COc1c(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccccc12 474706617 HPKZOYIDLGJVJF-CQSZACIVSA-N 395.484 5.015 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(COCCc2ccccc2)c1)c1ccccc1 475175832 SCMJQVZWQGPBMT-DEOSSOPVSA-N 398.506 5.472 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cccnc1Oc1cccc(F)c1 481925102 UZGRLNOKLAIGND-HSZRJFAPSA-N 387.458 5.442 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 482928204 CXJFACSHVSLYBK-RXVVDRJESA-N 393.487 5.066 30 20 GKED C[C@@H]1N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOC1(C)C 483057975 YXCPLGZFPYBURJ-HNAYVOBHSA-N 397.906 5.027 30 20 GKED CC(C)(C)c1noc(-c2ccccc2C(=O)[C@@H](C#N)c2nccc3ccccc23)n1 483217528 NMZFICFJPSOCOX-IBGZPJMESA-N 396.450 5.072 30 20 GKED Cc1c([C@H](NC(=O)N[C@@H](C)c2ccc(C#N)cc2)C(C)C)oc2ccccc12 483778029 XZSHAJTZZKXIBT-HRAATJIYSA-N 375.472 5.370 30 20 GKED CC(C)(C)C[C@@H](O)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 485707481 FOAHALUQJCOFDF-HKUYNNGSSA-N 384.907 5.121 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1cccc(Br)c1 486125667 RRLZJGDRVPDIJF-UHFFFAOYSA-N 380.245 5.120 30 20 GKED Cc1sc(Br)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1C 487159646 SNKPQVLAGATMJK-HNNXBMFYSA-N 391.334 5.292 30 20 GKED CCCc1nc(C)c(CNc2c(C#N)cnc3c(Br)c(C)ccc23)o1 488775376 BEPGUQJEQUSDFE-UHFFFAOYSA-N 399.292 5.038 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(Br)c(Cl)c2)cc1 494019819 WDLHQZOXVONJFB-UHFFFAOYSA-N 394.700 5.022 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1oc2ccccc2c1COc1ccccc1 494164965 SMNHOPUSSRAUMX-UHFFFAOYSA-N 398.418 5.144 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)CCCCC(=O)c2ccccc2)cc1 498478249 VFXMGSSSQJFYHY-OAQYLSRUSA-N 376.500 5.108 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccc(Cl)cc1 499814224 INXCKKFFOJZMPF-FQEVSTJZSA-N 381.262 5.655 30 20 GKED O=C(CC1(C(F)(F)F)CC1)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 504337195 RXENBYACRPZVJL-LLVKDONJSA-N 393.249 5.158 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCCC[C@H]1C(F)(F)F)c1cccc(Cl)c1Cl 505321883 ZTLQNKZJJMDIMP-NDMJEZRESA-N 379.209 5.043 30 20 GKED CCOc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)c1 505676092 WLTJJMRNWYUNNU-UHFFFAOYSA-N 388.423 5.010 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)C1(c2cc(F)cc(C#N)c2)CC1 509943761 NUSCDJUWNZWAJA-UHFFFAOYSA-N 384.454 5.055 30 20 GKED CC(C)c1[nH]ccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 510825659 KKQWCPVPLFIVOZ-UHFFFAOYSA-N 393.874 5.494 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1ccc(C#N)cc1 512824481 SVTPEIOHYFBYRB-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)c1 520473717 NYJLUSPCQDWCCT-HXUWFJFHSA-N 382.460 5.363 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 520827680 WBIGIDUPGIQMGL-AWEZNQCLSA-N 396.512 6.058 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)NCC#Cc3ccccc3)cc2c1 524611585 ASWAXUYYFQXHAL-UHFFFAOYSA-N 398.462 5.098 30 20 GKED CC(C)C[C@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 524817806 CVMQXHIFYUEHSZ-VNXZQDSDSA-N 390.527 5.194 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cccc(-c3ncco3)c2)c1 532816591 NBAFOUHHRDQTNC-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@H]1CCCO1 534480797 SPWOLUAPSJUAIJ-HLAWJBBLSA-N 397.906 5.075 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 534677382 WNIVSOLESQFPNC-IBGZPJMESA-N 381.541 5.397 30 20 GKED COc1ccc(CN2CC[C@H](c3ccc(Cl)cc3)C2)cc1OCCCC#N 537629153 WMUVEMBVBSQUGD-IBGZPJMESA-N 384.907 5.021 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542928919 XFLGPIWEVPTJPU-GLDPYIMESA-N 390.527 5.244 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1C1CC1 556694737 RAQVQLHTYYIOPJ-LBPRGKRZSA-N 378.501 5.379 30 20 GKED CCOc1c(Cl)cc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)cc1OC 558276744 BQGPBDJGJYEYHY-HNNXBMFYSA-N 397.862 5.037 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cnc2ccccc2c1C(F)(F)F 558370017 BBRHLARYDUKJEN-UHFFFAOYSA-N 376.403 5.144 30 20 GKED N#Cc1ccc(N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)cc1[N+](=O)[O-] 562235388 CAHUXZPVVDBEKM-INIZCTEOSA-N 394.431 5.219 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N3CCC(CCC#N)CC3)ccc2C)c1 566189809 VHPVSXGCBBDNPM-UHFFFAOYSA-N 378.476 5.038 30 20 GKED Cc1c(NCc2ccc(Cl)cc2C#N)cccc1C(=O)Nc1ccccc1 570617851 JRQZYURWFSTJSU-UHFFFAOYSA-N 375.859 5.385 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1)c1ccccc1 572256457 MRNUGWDMFZCWIK-NRFANRHFSA-N 382.529 5.268 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)c(Cl)c1 574582789 XZMDVIAOJPEOLD-GOSISDBHSA-N 385.851 5.323 30 20 GKED N#Cc1cc(C(=O)N2CCCCC[C@H]2/C=C/c2ccccc2)cnc1C(F)(F)F 578032548 FYCLDPOQVGWCMA-VYENPZKTSA-N 399.416 5.070 30 20 GKED C=C[C@](C)(O)CC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 582094565 SJSRXWBPFOXGPR-IBGZPJMESA-N 388.876 5.008 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(CCCC)Cc2ccccc2Cl)cc1 588712708 SHZDBLMFVAYZBA-UHFFFAOYSA-N 399.922 5.090 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2sc(CC)cc2C#N)cc1OC 604027556 DNEINYDEZPBAPU-UHFFFAOYSA-N 392.908 5.275 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc([C@@H](C)OC)c1 606777270 VWHFWWUOUIBREF-CYBMUJFWSA-N 379.378 5.230 30 20 GKED COc1cccc([C@H]2C[C@@H]2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 609298326 SRSILKSPCHIHHF-PKTZIBPZSA-N 398.462 5.410 30 20 GKED CCCN(CC)c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609376135 OROUDWAJVDQNSV-QGZVFWFLSA-N 381.545 5.427 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cs2)o1 609376435 ACYPBTIMWSBNCS-LBPRGKRZSA-N 383.498 5.216 30 20 GKED N#Cc1ccc(C(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)cn1 609640657 NQSPQMMFHCFJGL-UHFFFAOYSA-N 390.855 5.195 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)c1 610343550 LAGZWFNJLFSXTP-YADARESESA-N 383.495 5.206 30 20 GKED C[C@@H](NC(=O)c1cccnc1SCC1CCCCC1)c1cccc(C#N)c1 610362053 OANZXWSGQDBYBY-MRXNPFEDSA-N 379.529 5.117 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccccc1SCC(F)(F)F 618745500 URZGONRJSKEYLX-OAHLLOKOSA-N 391.418 5.022 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccc(Cl)cc2n1)c1nc2cc(F)ccc2s1 674486161 SBQFMSJKFOGZIQ-ZDUSSCGKSA-N 381.819 5.127 30 20 GKED Cc1cc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c2cccc(F)c2n1 675790009 PRNLPCSKHRKPMC-QWRGUYRKSA-N 380.307 5.249 30 20 GKED CC(C)CN(CCc1ccc(F)cc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726485671 VGVDAAXDWZSXOP-UHFFFAOYSA-N 389.927 5.248 30 20 GKED CC(C)(C)OCc1cccc(CNC(=S)Nc2ccc(C#N)c(Cl)c2)c1 726489877 UAHDMGUZTLBXQY-UHFFFAOYSA-N 387.936 5.013 30 20 GKED Cc1ccc(N(CCC#N)C(=O)/C=C\c2ccc3ccc(Cl)cc3n2)cc1 726941739 KBFDPSJCXXUIPF-XFXZXTDPSA-N 375.859 5.157 30 20 GKED Cn1c(/C(Cl)=C/c2cccc(OCCCC#N)c2)nc2cc(Cl)ccc21 728439832 GJRJBZJRACHHIH-ATVHPVEESA-N 386.282 5.646 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1csc(-c2csc(C)n2)c1 729141618 BGTIQFGRHOVLJJ-UHFFFAOYSA-N 382.436 5.430 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 729159687 COSVLGYKFIGKGE-UHFFFAOYSA-N 377.444 5.607 30 20 GKED COCCOc1ccc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)cc1 730464518 FAKJCYRPMYCBRX-FMIVXFBMSA-N 397.471 5.179 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 730918286 ZTNPGKRIFLASQR-BHIFYINESA-N 392.458 5.325 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1cccc(Cl)c1Cl 731195201 AIHMQTTXDAGTKT-CYBMUJFWSA-N 392.044 5.434 30 20 GKED C#CCCOc1ccc(CNCc2nc(-c3ccc(Cl)cc3)c(C)s2)cc1 733327188 OOHGROAOQRPGCX-UHFFFAOYSA-N 396.943 5.464 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@@H](C)c1ccc(C)o1 733804873 KPBNXWLZPHXXAL-ICSRJNTNSA-N 397.519 5.342 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)c1cc(F)c(Cl)cc1Cl 735340213 NRJOQHDOLBFEQC-UHFFFAOYSA-N 388.609 5.045 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(N3CCOCC3)cc2)cc1 741467991 BURISXIXOKRQDI-OVCLIPMQSA-N 399.490 5.095 30 20 GKED O=C(/C=C/c1c(Cl)nc2sccn12)c1ccc(SCC(F)F)cc1 741842686 MOFBYSDHDPLGCF-AATRIKPKSA-N 384.860 5.303 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(SCC(F)(F)F)cc1 741845034 XSPHOTGJOOZQIR-SREVYHEPSA-N 395.233 5.277 30 20 GKED O=C1/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)Cc2cc(Cl)ccc21 742436013 DPQBUKMLEPHCIZ-MDWZMJQESA-N 382.828 5.194 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccnc1 751543830 RRKIPLWEXDVYFY-DNQXCXABSA-N 398.510 5.298 30 20 GKED C=CCOc1ccc(CN[C@@H]2CCOc3c2ccc(Cl)c3Cl)cc1OC 752987397 USOVGNCTJWSAIN-MRXNPFEDSA-N 394.298 5.180 30 20 GKED CC(C)c1ccc(N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 763635722 SVGHNKAQRAONCP-KRWDZBQOSA-N 381.545 5.279 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Br)cc2Cl)cc1 765612799 FQHOYLTWFUBISQ-TWLAMCEISA-N 390.664 5.289 30 20 GKED CCC1(CC)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCS1 767583996 KYDGKJNEOBQAPK-NRFANRHFSA-N 393.556 5.482 30 20 GKED CCOc1c(Cl)cc(C=NOCc2ccccc2C(C)(C)C#N)cc1OC 767826416 VKNPICCNQQANOX-UHFFFAOYSA-N 386.879 5.099 30 20 GKED CC(=NNc1c(F)cccc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 769830544 QXOHCTSGIJNKQU-UHFFFAOYSA-N 394.899 5.032 30 20 GKED Cc1csc(SCc2ccc(C(=O)Nc3cccc(C#N)c3C)cc2)n1 770235323 ABQUTMMMKKYJEA-UHFFFAOYSA-N 379.510 5.176 30 20 GKED COc1ccc(CNc2ccc(OC(C)C)c(Cl)c2)cc1OCCCC#N 770488474 GOZZTWSPUKVHBY-UHFFFAOYSA-N 388.895 5.430 30 20 GKED N#CCOc1ccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2Cl)cc1 772960178 UALYYBXZLIIQKH-QHCPKHFHSA-N 394.877 5.455 30 20 GKED N#Cc1cccc(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c1F 774875081 HKUSLVPFWZCLOK-UHFFFAOYSA-N 394.016 5.063 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)CC1CCC(C(F)(F)F)CC1 783287607 USDVQMYBODBNEJ-UHFFFAOYSA-N 389.801 5.044 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 785757189 HVSJXXWDAQQBLO-LJQANCHMSA-N 392.908 5.127 30 20 GKED C=CCN(C(=O)CCc1ccccc1NC(=O)OC(C)(C)C)c1ccccc1 790723502 IZVIVEXXEHNAMU-UHFFFAOYSA-N 380.488 5.185 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=O)Nc1ccccc1O[C@H](C)C#N 801896917 APFSXYHZEYCNCO-OAHLLOKOSA-N 390.418 5.131 30 20 GKED C=CCCCCCCNC(=O)c1c(Br)cccc1Br 805219960 CCCYNTVYFXQOMM-UHFFFAOYSA-N 389.131 5.078 30 20 GKED COCCC(C)(C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 810533071 ULKUXRGDJIGWGB-ZDUSSCGKSA-N 397.327 5.356 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cn(C)nc1C(F)F 812241937 OWBWYGDFLXWAMV-YVMONPNESA-N 393.846 5.339 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C(F)=C\C3CCCCC3)n2)cc1 815921937 XVMTVEKWSBIDQD-DKFVHQPUSA-N 379.460 5.292 30 20 GKED N#C[C@H](C(=O)Cc1ccccc1OC1CCCC1)c1nc2ccccc2s1 838782316 JYWDRTHKZPIIHB-QGZVFWFLSA-N 376.481 5.037 30 20 GKED C[C@H](N[C@@H](C)c1cc(F)c(Br)cc1F)c1ccc(OCC#N)cc1 858376942 SYJVRSHPEIOENW-RYUDHWBXSA-N 395.247 5.041 30 20 GKED CN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](CCc1ccccc1)C(F)F 863246970 CHWYSMHTCRMEQP-QGZVFWFLSA-N 393.890 5.107 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1cccc(C(F)F)c1 902686706 KQFRJILCUFBBRZ-ZDUSSCGKSA-N 376.428 5.036 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915084975 CAPYFFAMNCGOJJ-QHCPKHFHSA-N 379.463 5.313 30 20 GKED CCCCc1ccc(CC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916917272 GORHRHXIZVJDIM-JOCHJYFZSA-N 384.479 5.072 30 20 GKED CSc1nc(C2CC2)cc(C(=O)N(C)c2ccc(C(C)(C)C)cc2)c1C#N 918685925 ZFNOYVQALWKHDG-UHFFFAOYSA-N 379.529 5.127 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)Nc3ccc(Cl)cc3)cc2)cc1 920998186 JFVVYXYHPVLZRC-UHFFFAOYSA-N 379.872 5.813 30 20 GKED CC(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776370456 HSMAKAOOXAATLZ-QBFSEMIESA-N 376.477 6.133 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cs1 1776380475 GCAZJTDAGREBHU-FLIBITNWSA-N 391.492 5.457 30 20 GKED CCCCCCCCc1ccc(C(=O)NCc2ccc(C(=O)O)c(C)c2)cc1 1776785832 HXIDIKBZFZKRIR-UHFFFAOYSA-N 381.516 5.526 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1OC 1776801465 RXILOVNQHAPGEE-CSKARUKUSA-N 388.847 5.122 30 20 GKED CCn1c(S[C@@H](C#N)Cc2ccc(C)cc2)nc2cc3ccccc3cc2c1=O 24892355 DKDCGFIAOYNJOB-HXUWFJFHSA-N 399.519 5.105 30 20 GKED N#C[C@H](C(=O)c1csc(Br)c1)c1nc(-c2ccccc2)cs1 41522179 LNYHJWANMFUACK-GFCCVEGCSA-N 389.299 5.124 30 20 GKED N#C[C@H](C(=O)c1ccccc1Cc1ccccc1)c1ccc(C(F)(F)F)cn1 41555059 WHGRWHQNAPQKDF-IBGZPJMESA-N 380.369 5.181 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1cc(F)ccc1F 108413043 MTWFFYRMRVZYIY-ZDUSSCGKSA-N 392.496 5.231 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C 112130141 XPMOVGFNKLZLER-UHFFFAOYSA-N 379.504 5.200 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1cccnc1 123335975 UHYDEYGOFLCADZ-HNNXBMFYSA-N 389.484 5.034 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCC[C@H]3c3ccc(Cl)c(Cl)c3)o2)cc1 173546095 BIWSFSMXCCBTOL-SFHVURJKSA-N 399.281 5.252 30 20 GKED N#CCCCCNC(=O)NCc1ccccc1-c1ccc(Cl)cc1Cl 178164638 CJQVDFHVCZTHOU-UHFFFAOYSA-N 376.287 5.153 30 20 GKED CCC(C)(C)N/C(S)=C(/C(=O)c1ccc(C(C)C)cc1)[n+]1ccc(C)cc1 186970685 YCKBQVUKHLRBPK-UHFFFAOYSA-O 383.581 5.123 30 20 GKED CC(C)N(CC(=O)Nc1sccc1C#N)c1ccc(Nc2ccccc2)cc1 216461010 LFQUPQHXVJPHQV-UHFFFAOYSA-N 390.512 5.217 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Cl)s1)C(=O)Nc1ccc(Cl)cc1Cl 254929731 QSYPLQKCZHATSQ-SROOVFNMSA-N 399.686 5.069 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@@H]4CCC[C@@H](C)C4)no3)C2)c1 329710298 MCDPTUNAJMGDHG-NXHRZFHOSA-N 382.508 5.097 30 20 GKED Cc1nc2ccccc2n1C1CCN(/C(O)=N/[C@@H]2CCCc3sccc32)CC1 329961547 OPTPQKNDONTIMQ-GOSISDBHSA-N 394.544 5.035 30 20 GKED C[C@@H]1c2c(sc(NC(=O)C3CCC(OC(F)F)CC3)c2C#N)CC[C@H]1C 410975995 ALMJHGMAPVYRNA-IALDZJHCSA-N 382.476 5.042 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2C#N)[C@H](C)C1 410992182 WLKKEKKBFMXEHL-NXEZZACHSA-N 389.864 5.119 30 20 GKED N#CC1(CC[S@@](=O)Cc2coc(-c3ccc(Cl)cc3)n2)CCCCC1 417159551 OTGBOLYDVWTNQW-RUZDIDTESA-N 376.909 5.108 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)CCCCC(=O)c2ccc(F)cc2)cc1 426991840 OWEVZQWSXUJRDC-NRFANRHFSA-N 394.490 5.247 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 427956569 HUEGIYKCLUCNAM-CQSZACIVSA-N 375.394 5.153 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cnccc3-c3ccccc3)cc2)nc1 428467447 ZQZHBZAMRVSOCU-UHFFFAOYSA-N 392.418 5.060 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 428862070 MPZYMQLAOOUTCY-LEWJYISDSA-N 389.499 5.219 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 431947450 ZSRJMPVSEVYCQU-DQLDELGASA-N 399.922 5.150 30 20 GKED C=CCC[C@@H](NC(=O)CCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1 435296278 RPDSYSAFAWFPHB-HXUWFJFHSA-N 393.462 5.022 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccccc1 435670173 ROIUHPSVSAXBQV-JOCHJYFZSA-N 391.515 5.142 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)c12 437470093 GCEGUIJFTXNGFM-UHFFFAOYSA-N 399.425 5.461 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2c(F)cccc2F)C2CCCC2)cc1 437914584 ZLCRELWBAVFUHA-UHFFFAOYSA-N 397.469 5.743 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H](Cc3ccccc3)C2)cc1C(F)(F)F 438644972 CJEXTGVBWFJKGS-INIZCTEOSA-N 387.405 5.064 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1 439676485 VYJBTVFQCYFXGK-MRXNPFEDSA-N 387.464 5.331 30 20 GKED C=CCN(C(=O)c1sc(C2CCCC2)nc1C)c1nc2c(s1)CCCC2 443806092 UEPXUMMRFUOFER-UHFFFAOYSA-N 387.574 5.277 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 444389926 RFLUSZQIDVYJIY-MRXNPFEDSA-N 387.439 5.701 30 20 GKED CC(F)(F)c1cccc(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c1 444949270 OUXKSCDGGVQFNJ-UHFFFAOYSA-N 399.441 5.182 30 20 GKED Cc1cc(C)n(-c2ccc(CNC3CCC(C)(C#N)CC3)c(C(F)(F)F)c2)n1 449100403 WTXGTQHTQYKBCN-UHFFFAOYSA-N 390.453 5.070 30 20 GKED Cc1nc(CN2CCC[C@H]2[C@@H](C#N)c2ccccc2)oc1-c1ccc(Cl)cc1 468281209 WPHXUFWISGDMBB-SFTDATJTSA-N 391.902 5.575 30 20 GKED C[C@H](CCC#N)Sc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1 470444182 DEVIJNWDRSJXKN-OAHLLOKOSA-N 382.920 5.296 30 20 GKED CC1(c2cccc(Cl)c2)CCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1 478436919 OPSPFGNLENWZRX-IBGZPJMESA-N 380.919 5.308 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-n2cccn2)c1 480068474 KVEVSJCRUFGJNV-UHFFFAOYSA-N 396.475 5.147 30 20 GKED CCOc1cc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)ccc1OC 482903970 YUHWDSIJXUJSQV-UHFFFAOYSA-N 388.423 5.010 30 20 GKED CN(C(=O)[C@@H]1CCC(F)(F)C1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 484087489 YYNSXPDAYDTCSN-ZYHUDNBSSA-N 389.286 5.203 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)CSCc2ccc(C#N)cc2)c1C 488843935 NHICWALHDLVXMR-UHFFFAOYSA-N 396.556 5.444 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cc(-c4ccccc4)on3)o2)cc1 489781009 POBUVBXYRGQNES-UHFFFAOYSA-N 391.452 5.249 30 20 GKED CC(C)[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(F)cc1F 502157785 DSTYNOBHSCGDHO-JOCHJYFZSA-N 395.453 5.032 30 20 GKED CCCN(CCc1cccc(F)c1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 503220317 AZDBMISVNADGIC-KRWDZBQOSA-N 399.535 5.707 30 20 GKED C[C@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)cc1 504014133 USEOPIDSZKJVPO-MRXNPFEDSA-N 398.428 5.387 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 505337942 MQCXDOLCWZUNFE-HNNXBMFYSA-N 379.312 5.489 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccsc2)s1)c1cccc(Cl)c1Cl 505348838 IQADVJQDGIZMTA-LBPRGKRZSA-N 394.308 5.173 30 20 GKED COc1ccccc1-c1cccc(NC(=O)C(C)(C)c2cc(F)cc(C#N)c2)c1 511961898 VPRIOTLHIQXBHR-UHFFFAOYSA-N 388.442 5.289 30 20 GKED N#CC1CCN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)CC1 512705709 OOLVMPYMUNYRLN-UHFFFAOYSA-N 375.299 5.308 30 20 GKED CN(CC1CCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 520178520 NBYXQRRWISAHEO-FQEVSTJZSA-N 381.907 5.649 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCCc2ccccc21 520194383 RLNHSWJVIFOCAG-UZLBHIALSA-N 379.529 5.622 30 20 GKED Cc1cc(Br)c(NC(=O)c2ccc(Cl)c(C#N)c2)cc1Cl 525843530 MECYHJQZJWFTMM-UHFFFAOYSA-N 384.060 5.188 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC(C)(C)c2nc3ccccc3s2)cc1 528899542 JDUKXWPKLPYGTI-UHFFFAOYSA-N 378.501 5.154 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC[C@@H]2c2ccccn2)cc1 530882947 YPKCZORJHPLLHA-OAQYLSRUSA-N 385.492 5.082 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(N2CCc3ccccc3C2)cc1)c1ccccc1 532699960 OXLHCYMLCJOVQE-RUZDIDTESA-N 395.506 5.024 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(Br)cc1)c1ccccc1 533929146 ANQOHMDOANRNNS-OXJNMPFZSA-N 384.317 5.473 30 20 GKED CC(C)c1c(NCCCC2(C#N)CCOCC2)cnn1-c1ccc(Cl)cc1 538612097 SUKUXXXLRRZNQP-UHFFFAOYSA-N 386.927 5.162 30 20 GKED CCN(C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccc(C#N)c(Cl)c1 539175679 YQIDIHORQNGLGM-UHFFFAOYSA-N 393.849 5.443 30 20 GKED N#CC1(c2ccc(C(=O)Nc3nc(-c4ccccc4Cl)cs3)cc2)CC1 539594222 LVRJYRQPFVDHDP-UHFFFAOYSA-N 379.872 5.271 30 20 GKED C[C@H](NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(C#N)c1 540595939 IZSOGEFIXUZICF-HNNXBMFYSA-N 388.342 5.180 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccc(Cl)cc1 540859128 WXOMSCCUXLKFKH-ZDUSSCGKSA-N 396.903 5.779 30 20 GKED C[C@H](NCc1ncc(-c2cccc(F)c2)o1)c1ccc(-c2cccc(C#N)c2)cc1 542012296 DMNHUWJQNOMWIZ-KRWDZBQOSA-N 397.453 5.870 30 20 GKED C[C@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(Oc2ccccc2)c(F)c1 543821195 RWUVSXSJTZTMNS-INIZCTEOSA-N 381.451 5.014 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2ccccc2[C@@H]1C 548488978 RXSSRVBDXWUQKA-SFHVURJKSA-N 397.478 5.810 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)cc2)c1 550310967 GPSLIRPJVCWDFI-JOCHJYFZSA-N 382.419 5.049 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)c(F)c1 551211715 KPVHNICACNQJBY-LIRRHRJNSA-N 375.285 5.674 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1cc(C#N)cn1C(C)(C)C 554935526 TWWPFZANMCUJAX-UHFFFAOYSA-N 382.508 5.464 30 20 GKED N#CCCC[C@H](NC(=O)CCc1nc2cc(Cl)ccc2s1)c1ccccc1 558453928 ZHESORXUZMWSMF-KRWDZBQOSA-N 397.931 5.434 30 20 GKED C[C@@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1ccc(Br)cc1 567549599 MWFNQFHJAFKTNV-AWEZNQCLSA-N 389.268 5.029 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H]1c2ccccc2CC12CCOCC2 570205412 AHUSGSUZQOIVFB-JOCHJYFZSA-N 376.500 5.021 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F 577550771 OYCRIUIFTMSCMA-VQTJNVASSA-N 388.417 5.173 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CSc3ccccc3Cl)cn2)cc1 603764654 LZFUTGKWCLQZDR-UHFFFAOYSA-N 395.871 5.130 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)c2ncccc12 608915830 WEJFLJBHPTXAQS-UHFFFAOYSA-N 378.863 5.202 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)Nc1cccc(OCCCC#N)c1 608938385 LIJJLPQAPLUZFE-OAQYLSRUSA-N 382.529 5.266 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cccc(Cl)c1 609907220 XLMUSPCCSFKIJT-UHFFFAOYSA-N 391.858 5.315 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cs2)o1 613407516 WRPXCSBPDDZLOZ-NSHDSACASA-N 399.884 5.465 30 20 GKED C[C@@H](Cc1ccccc1F)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619124648 DSRGNWBGWXUXPW-NSHDSACASA-N 387.339 5.174 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619770250 NHJNNNPJRFABPZ-LBPRGKRZSA-N 395.812 5.133 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)NCc1ccc(C#N)c(Cl)c1 619770686 PPNPFCFRNKDWPB-MRXNPFEDSA-N 381.907 5.285 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 657529406 VMXHMQWAINNTGE-UZLBHIALSA-N 387.524 5.191 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(OC)c(F)c1 666866055 GZSHESKWRNUCRQ-NRFANRHFSA-N 396.506 6.055 30 20 GKED C=CCCN(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 671812531 PNWVIZOBUHEFNO-UHFFFAOYSA-N 383.344 5.429 30 20 GKED N#C[C@H](C(=O)c1c(-n2cccc2)sc2c1CCC2)c1ccc2ccccc2n1 677557940 ZSFYZCMZAPFGGF-KRWDZBQOSA-N 383.476 5.066 30 20 GKED N#Cc1cc(F)ccc1CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 728441523 KDELGIIQKNRCEC-UHFFFAOYSA-N 393.921 5.620 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C\c1cn(-c3ccccc3)nc1-c1ccncc1)C2 730949710 ZWRTUUJMDOGSKP-HKWRFOASSA-N 377.447 5.065 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(Cl)cc1Cl 731322358 YDERKGSORMYEIC-NSHDSACASA-N 396.368 6.197 30 20 GKED C/C(=C/C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1)c1ccccc1Cl 731645915 UPGUYNYDODDPAV-GKUQOKNUSA-N 378.781 5.143 30 20 GKED CC1(C)/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)C(=O)c2ccccc21 733083371 IOWPWEOEKKUJBC-WOJGMQOQSA-N 376.437 5.276 30 20 GKED N#CCCCCOC(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 733867338 YHVPFSNZVWSBTA-GOSISDBHSA-N 377.868 5.550 30 20 GKED CCOc1c(Cl)cc(/C=C/C(=O)c2c[nH]c3ccc(OC)cc23)cc1OC 734306630 HNPVBQRXPZALSE-VMPITWQZSA-N 385.847 5.133 30 20 GKED CSCCCCC(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 740535258 LTUZSYOPULBDEW-HQHQJUQOSA-N 388.602 5.320 30 20 GKED Cc1cc(/C=C\C(=O)c2c(Cl)nc3sccn23)ccc1Oc1cccnc1 741847674 JUVRPQRCFXMDLX-XQRVVYSFSA-N 395.871 5.441 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3cccc(Cl)c3)n2)cc1 744061129 GWCMYHSPKAUWGJ-FZKQIMNGSA-N 396.899 5.452 30 20 GKED C[C@@H](CCNC(=S)Nc1ccccc1C#N)c1cccc(C(F)(F)F)c1 746393092 JJIHXDUUMRRHSJ-ZDUSSCGKSA-N 377.435 5.057 30 20 GKED COc1cc(/C=C/C(=O)c2ccsc2)cc(Br)c1OC(F)F 749105734 XPYZAWWCPNAGLZ-NSCUHMNNSA-N 389.217 5.017 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/Cc1ccc(COC2CCOCC2)cc1 751522100 DUAWFFRISRTXKM-FSJBWODESA-N 394.298 5.014 30 20 GKED C=CCc1cc(CN[C@@H]2CCOc3c2ccc(Cl)c3Cl)cc(OC)c1O 752987238 SJOXFZWBUNYABR-MRXNPFEDSA-N 394.298 5.050 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@H]2/C=C/c2ccccc2)c1 753876655 OMGSXIUJZJITJV-ARKBFRDHSA-N 375.472 5.079 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCc3cc(Cl)sc3Cl)[nH]c12 756289770 JBCHRWCSGCSCKZ-GFCCVEGCSA-N 392.311 5.439 30 20 GKED O=C(/C=C/c1nc(Cl)cs1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 759075834 ONDOYPRVAWTAHG-VMPITWQZSA-N 376.846 5.329 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2cccc(C#N)c2)C1 761783308 QKDCMDQQQWFEQP-QFIPXVFZSA-N 391.515 5.410 30 20 GKED O=C(CCCC(F)(F)F)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 770738287 GJRJSQCACYNSMZ-LLVKDONJSA-N 382.222 5.585 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)OC[C@@H](C)C#N)cc1 770929521 PQZIIRVXNLDJJS-INIZCTEOSA-N 376.481 5.031 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(OCc2ccccc2)cc1 780445991 VVTHEZSULKWRTJ-KRWDZBQOSA-N 387.439 5.200 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CO[C@H]2CCCc3ccccc32)cc1 797433480 DZUMESOFQHHUCC-RPBOFIJWSA-N 396.490 5.375 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc1 798009003 YSJHIQLGTQBAGE-RRPUWOKSSA-N 399.469 5.549 30 20 GKED CN(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)C1CCC(F)(F)CC1 806842882 YBOVQSPJLOCVOP-UHFFFAOYSA-N 389.471 5.006 30 20 GKED CCCCn1nc(C)c(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c1Cl 810166273 GDRZXZOZVFESLR-UHFFFAOYSA-N 395.894 5.316 30 20 GKED C#C[C@@H](NC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccc(Cl)cc1 810170652 QWXRNZNFFJCBMI-LJQANCHMSA-N 379.847 5.108 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813217369 KUGKEPHQSUGDQN-RHSMWYFYSA-N 390.405 5.176 30 20 GKED CC(=NNc1ncnc2sc3c(c12)CCC3)c1sc(C(C)(C)C)nc1C 820547141 ULRXPWLHDAALSE-UHFFFAOYSA-N 385.562 5.079 30 20 GKED C#CC[C@H](NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1)c1ccccc1 825980338 ZDXUJCYDIJOCNQ-FQEVSTJZSA-N 393.487 5.228 30 20 GKED C[C@]1(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1(Cl)Cl 835068621 SHMLHSDUQMJMEC-WBMJQRKESA-N 399.730 5.614 30 20 GKED C[C@]1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1(Cl)Cl 836269588 DCXNGPQFGIBIDS-PKOBYXMFSA-N 388.298 5.047 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1nc(C(F)(F)F)cs1 853317183 QHKVDAGWNPVMEK-UHFFFAOYSA-N 387.271 5.615 30 20 GKED Cc1ccccc1OCCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915085286 KGVKBMZLMHNEQS-QHCPKHFHSA-N 384.479 5.448 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1ccccc1OCc1ccccc1 916325318 HVXUZLYJIMVURW-UHFFFAOYSA-N 389.352 5.053 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(Oc2ccccc2)cc1 920106415 YKNZPNQBLLDKJJ-OAQYLSRUSA-N 394.430 5.474 30 20 GKED Cc1ccc(Cl)cc1NN=Cc1ccc(-c2cccc(CC(=O)O)c2)cc1 1776106592 MIIYPJLQZVOYSI-UHFFFAOYSA-N 378.859 5.389 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C\C(=O)c3ccc(C(=O)O)s3)o2)cc1 1776271491 UFASPZZYNIZLIT-NTMALXAHSA-N 380.465 5.900 30 20 GKED CC(C)c1cccc2c1OCC/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1776378162 VVGJKKHXVYSJJM-UVTDQMKNSA-N 392.476 5.772 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)s2)cc1)c1ccccc1 1776469427 OFBAMIPLAVCONE-FQNOHDAGSA-N 378.449 5.482 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2nc(CC(=O)O)cs2)cc1 1776787518 KXCHEGIBFMMXSJ-UHFFFAOYSA-N 392.546 5.085 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(SC2CCCC2)cc1 1777268345 CUEUCVQOZFOXRY-RAXLEYEMSA-N 382.481 5.324 30 20 GKED COc1cc(C#N)ccc1OC(=O)[C@H](Sc1ccccc1)c1ccccc1 15988570 PZKOHFDYEPKXKO-OAQYLSRUSA-N 375.449 5.006 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nnc(-c2ccc(C)cc2)o1 20057448 AXMJVEIHEYIHBO-UHFFFAOYSA-N 397.525 5.054 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(-c3ccccc3)o2)n1 21515013 WPHXECQCFXSBJB-UHFFFAOYSA-N 375.375 5.228 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1nc2ccccc2o1 41544981 MFWSZFCPIKJTSR-PGRDOPGGSA-N 384.460 5.538 30 20 GKED COc1ccc(/C=C/c2ccc3cccc([N+](=O)[O-])c3n2)cc1OCCCC#N 64367339 JIKXAXQNYRCTGU-JXMROGBWSA-N 389.411 5.005 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccnc2)cc1)c1nc(-c2ccccc2)cs1 68336686 VIZPVGLJEJRWFE-FQEVSTJZSA-N 397.459 5.487 30 20 GKED Cc1csc(Sc2ccc(NC(=O)/C=C/c3ccccc3C#N)cc2)n1 108436016 QVAJVEYPEZJTAO-IZZDOVSWSA-N 377.494 5.126 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 108528746 OBIBZNOZUUAUFQ-OXJNMPFZSA-N 379.529 5.616 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@H]2c2ccccc2Cl)c1 110639916 SELYFBXIISGYMZ-NRFANRHFSA-N 382.891 5.124 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)CCc2ccc(C#N)cc2)cc1 112641630 NDTQYPRBSWUOFM-SANMLTNESA-N 397.522 5.086 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@H](C)c1cccnc1 115764028 BVTSZMRLPQHDQH-QGZVFWFLSA-N 386.455 5.361 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC[C@@H]4CCC[C@H]43)c2)cc1 120114938 MJZMCAYSHSLMNT-NZQKXSOJSA-N 389.499 5.128 30 20 GKED C#CCCCCNC(=O)c1oc2ccccc2c1CSc1nc(C)cs1 156418127 HBKFOKJSLQJMQQ-UHFFFAOYSA-N 384.526 5.023 30 20 GKED CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 175359572 JPVGIJGXUXXFNV-HRCADAONSA-N 377.579 5.124 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)c1ccc(Cl)s1 175465471 QZKANZAZFGSZHQ-ZDUSSCGKSA-N 397.887 5.511 30 20 GKED CCC(CC)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1C 181101719 RMVSJAXEWSHERR-KRWDZBQOSA-N 378.501 5.166 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 181579713 PZEJIVHPHXGYJC-UHFFFAOYSA-N 391.471 5.150 30 20 GKED CCC[C@@H]1C[C@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 183387143 AYCRYXQEJUQBSE-UYAOXDASSA-N 378.472 5.193 30 20 GKED C=C(C)[C@@H](NCc1csc(COc2ccccc2)n1)c1ccc(F)c(F)c1 187375402 TWZDYJCCXADUBP-OAQYLSRUSA-N 386.467 5.407 30 20 GKED C[C@@H]1CCSCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 192090193 UCSBQOXTYIKECQ-DNVCBOLYSA-N 399.947 5.355 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3cccc(OC)c3o2)cc1OCCCC#N 255311446 MPJDSDFNDKFOQB-NTMALXAHSA-N 391.423 5.029 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 303346223 MNXCTNOTLMLHGD-GOSISDBHSA-N 399.494 5.913 30 20 GKED O/C(=N/CCc1cc2ccccc2o1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329503717 ZDSGEJQIMSVYKG-IBGZPJMESA-N 391.515 5.439 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cc(F)c(F)cc2Br)s1 411009626 YSOZPFMDPOUNFT-UHFFFAOYSA-N 399.260 5.210 30 20 GKED CC(C)c1ccc([C@@H](N)CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 415159529 JROAHMVDCCYZIE-LPHOPBHVSA-N 396.560 5.026 30 20 GKED Fc1cc(CNC23CCC(C(F)(F)F)(CC2)CC3)ccc1OCC(F)(F)F 425961620 UBSFPXIXBSSDDE-UHFFFAOYSA-N 399.350 5.512 30 20 GKED C=CCC[C@H](C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1 428037514 ZAEVBMCQMIORGP-VXKWHMMOSA-N 377.532 5.242 30 20 GKED Cc1oc(C#N)cc1C(=O)N(C)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 436196243 UUPBYOOZXNSFQI-HXUWFJFHSA-N 382.822 5.114 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2ccc(OC3CCCC3)c(F)c2)cc1 437918401 WBDIYHVSMUBUNR-UHFFFAOYSA-N 381.451 5.592 30 20 GKED C[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 438223251 DODVLVNNIKLPOL-KRWDZBQOSA-N 383.451 5.329 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(Cl)ccc2NC2CC2)c2ccccc21 444282182 ATRMOVSRSOJJSR-UHFFFAOYSA-N 392.890 5.425 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)c1C1CC1 456108559 IWYILUCGHNELOC-AWEZNQCLSA-N 380.492 5.033 30 20 GKED CC[C@@H](CC(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 457580470 OUHYGXHEIHOWRY-JTQLQIEISA-N 380.382 5.331 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)C1(C#N)CCCCC1 464460996 XWAUSHWBRRYCSD-UHFFFAOYSA-N 395.890 5.313 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1cc(C(F)(F)F)ccn1 464463156 BMMNAHKZNULVDF-MRXNPFEDSA-N 399.347 5.155 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 464503294 YYOXOPVSTRVHTC-HNNXBMFYSA-N 398.871 5.013 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 469410859 XSHCKNHKSZWECP-CQSZACIVSA-N 395.915 5.839 30 20 GKED N#CCCCn1cc(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)c2ccccc21 469534250 YBMQGPCJJWRYEG-HOTGVXAUSA-N 391.437 5.044 30 20 GKED CCN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccc2[nH]ccc2c1 472284870 JBIGPDOIXPVTNN-UHFFFAOYSA-N 395.462 5.285 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476529213 DZDUJEUQAODSPC-MRXNPFEDSA-N 385.305 5.599 30 20 GKED Cc1cccc([C@@H](NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)C(F)(F)F)c1 482023673 BGXXBMYKWMVZEE-LJQANCHMSA-N 389.421 5.090 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H]2CCCc2ccccc2)cc1 494267787 JPCKQZZXIDEZBR-QFIPXVFZSA-N 375.516 5.507 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 494861651 RHUPDOCYZRRICU-ZDUSSCGKSA-N 394.368 5.341 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1oc2ccccc2c1COc1ccccc1Cl 497354755 LWUDWWDKRLHLIP-UHFFFAOYSA-N 396.874 5.287 30 20 GKED Cc1cccc(O[C@@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 500771501 OHTKVHMHDANHAU-SFHVURJKSA-N 386.451 5.373 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccccc3-c3ccccc3)CC2)cc1 503624082 HSFSPEDQOJZMHL-UHFFFAOYSA-N 379.463 5.546 30 20 GKED N#C[C@@H](NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1ccccc1F 505917165 NMUDDZIAMZHJFO-RTWAWAEBSA-N 394.446 5.179 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H]2CCCOc3ccccc32)cc1 506317083 XIZQUMFBBSFLMJ-NRFANRHFSA-N 399.450 5.386 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1c(Cl)ccc(F)c1Cl 511625937 GGMQDAFLUTVZPE-LLVKDONJSA-N 394.277 5.816 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(F)c(Cl)cc1Cl 519423922 KJFQWNHJDNVVTK-JTQLQIEISA-N 383.275 5.637 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1ccc(COc2ccccc2)cc1 523759862 RMSLYYVUZUPGPK-UHFFFAOYSA-N 383.373 5.163 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@@H]2C[C@H]2c2csc(Br)c2)cc1 527872498 VXCNRIAJEGZNTL-LSDHHAIUSA-N 389.318 5.054 30 20 GKED C=C[C@@H](CC(=O)NCc1cccc(Cn2cnc3ccccc32)c1)c1ccccc1 535391313 BIFJNIMGUMHNON-QFIPXVFZSA-N 395.506 5.061 30 20 GKED C=C[C@@H](CC(=O)NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccccc1 536129140 PPTQFQIEUQUWDQ-QFIPXVFZSA-N 395.506 5.061 30 20 GKED C[C@@H]1COc2ccccc2CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 541995566 ZMLUHXCOCKNYRX-QGZVFWFLSA-N 399.450 5.166 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@@H](C#N)c3ccccn3)c3ccccc3n2)c(C)c1 543733444 YKPPCMNPCAOQKO-NRFANRHFSA-N 377.447 5.404 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(-c3ccccc3)o2)cc1 544083078 BMNQSPRBHIYTDP-UHFFFAOYSA-N 386.451 5.013 30 20 GKED CSCc1cnc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 549804407 GEBUZDGINZQJIF-HNNXBMFYSA-N 379.554 5.396 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1csc(-c2cccs2)n1 558755260 MCCWHQLKPXYPQS-UHFFFAOYSA-N 397.912 5.068 30 20 GKED CC[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(OC)c(OC)c1 560571485 IMLYAIJQNJTIOD-ZPGVXSSASA-N 378.516 5.149 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cccc(C)c2Cl)cc1C 571870653 YNPDIWBLRIGCHX-UHFFFAOYSA-N 392.890 5.295 30 20 GKED Cc1ccc(Oc2ccccc2)c(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c1 572588203 JKIBZDSINYLRNA-UHFFFAOYSA-N 397.356 5.325 30 20 GKED Cc1sc2nc3n(c(=O)c2c1-c1ccccc1)CC/C3=C/c1cccc(C#N)c1 590778564 ZTXQYFDAMLJDIV-UYRXBGFRSA-N 395.487 5.249 30 20 GKED Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 606576423 IDOWBMDCVHNNOY-UNMCSNQZSA-N 395.506 5.200 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1cccc(C#Cc2cccs2)c1 606938993 VWUNQQBRJWBLSA-JOCHJYFZSA-N 389.524 5.548 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccccc3F)cc2Cl)c1 609063026 RETVMYSRMGCAPL-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N[C@@H](c2ccccc2)C2CCC2)o1 609177291 MDAXCSBWKQJZPB-QHCPKHFHSA-N 386.451 5.001 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609209953 XKMRCFXJVADFDC-INIZCTEOSA-N 387.439 5.242 30 20 GKED N#CCCSc1ccccc1NS(=O)(=O)c1ccc(-c2ccccc2)cc1 609379908 VYYJCYYYAIXHRD-UHFFFAOYSA-N 394.521 5.160 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1cccc(Cl)c1Cl 609414293 GARJDYAFWHRZLE-YCPHGPKFSA-N 379.674 5.131 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)CC1 609636092 OKOOZKYWXCLXAS-GOSISDBHSA-N 378.476 5.036 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 611390944 WXEOCEFLZRBZRE-CPUCHLNUSA-N 390.371 5.435 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1 619350960 AKUFDFUBXNWCAV-GOSISDBHSA-N 375.472 5.144 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1nn(-c2ccccc2)cc1C 681404177 FCJZIVXMDCJJMC-UHFFFAOYSA-N 386.908 5.116 30 20 GKED CC(C)CC(=NNc1nc(-c2ccncc2)no1)c1cccc(C(F)(F)F)c1 726423830 PLQAECOMEKEXSM-UHFFFAOYSA-N 389.381 5.013 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C=C(\C)c1ccccc1Cl 727626936 JFWTWIJROVUQKK-OCKXMSAZSA-N 394.902 5.216 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc(OCc2ccc(F)cc2)cc1 727683877 BBLQOPXTSRVMFA-UHFFFAOYSA-N 392.434 5.224 30 20 GKED CC(=O)Nc1ccc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1 727685393 LSGRYERPEGVQTA-VBKFSLOCSA-N 392.455 5.120 30 20 GKED O=C1/C(=C/c2csc(-c3ccc4c(c3)OCO4)n2)CSc2ccc(F)cc21 728439319 HJXCIJBUKISOKU-LFYBBSHMSA-N 397.452 5.050 30 20 GKED C[C@H](CC#N)N(C)Cn1nc(-c2ccccc2Cl)n(C2CCCC2)c1=S 728901898 DGXNLHQJIHSMLW-CQSZACIVSA-N 389.956 5.041 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2c[nH]c3cc(Br)ccc23)cc1 729937532 VEKVUUCNIPTIAO-VVOKDJNJSA-N 395.256 5.117 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccccc1SC[C@@H](C)C#N 730954867 MQVRQIAMCHUGMK-LBPRGKRZSA-N 375.950 5.709 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Nc3ccc(F)cc3)c3ccncc23)c1 732104256 OIIVROQDUITLPN-UHFFFAOYSA-N 396.425 5.436 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 732732105 JEOUVSZNQHKVTA-IBHIWXBSSA-N 393.899 5.412 30 20 GKED O=C(O)COc1cccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)c1 733206053 BWTUKTFBAJCLBB-JYRVWZFOSA-N 382.481 5.081 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 734679386 LRYSXRQFGMDZNH-ACJLOTCBSA-N 378.303 5.408 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1cnc2c(C)cccn12 741466903 GUAQWGDEVRKAEU-MDZDMXLPSA-N 377.444 5.110 30 20 GKED CC(C)[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 744034229 DHXXISPDMNRVLE-AZUAARDMSA-N 394.927 6.080 30 20 GKED O=C(/C=C/c1cncc(F)c1)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 750215412 GUYSKJKUEAFMMF-NFAHFFEMSA-N 393.258 5.100 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@@H]3CCOC3)c2)cc1 761311271 OJCZYDZNUWGRMD-ISKFKSNPSA-N 382.463 5.098 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](F)c2ccccc2)cc1 768990582 YQASEKCGMKMUBW-OAQYLSRUSA-N 376.387 5.008 30 20 GKED C[C@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1ncc(-c2ccccc2)o1 769541721 CWOKPDQVHVQJNY-KRWDZBQOSA-N 399.450 5.518 30 20 GKED C#CCCCCC(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 773188296 UIZJCCKCFVQHIH-IBGZPJMESA-N 378.903 5.263 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21 776959343 XNMGOQBQHHIUSE-UGGKCQTMSA-N 389.499 5.168 30 20 GKED Cn1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)c(-c2ccc(C#N)cc2)n1 777914936 GDTRRYICCIJXLN-VOTSOKGWSA-N 388.279 5.223 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(OCc3ccccc3F)cc2)cc1 779592944 KSFLYBUAYVNPIH-QGZVFWFLSA-N 376.431 5.308 30 20 GKED O=C(/C=C\c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cncs1 787171755 OWKPSJDEDIWVFJ-ALCCZGGFSA-N 386.816 5.393 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1cc(Cl)ccc1OC(F)F 788357334 YCWKDJDUNLSILE-DUXPYHPUSA-N 383.725 5.313 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C 789720215 VNFDEMAKXPZCES-APWZRJJASA-N 386.536 5.123 30 20 GKED N#CC[C@H](CC(=O)OCc1coc(-c2cccc(Cl)c2)n1)c1ccccc1 795989974 IMWPDNAURWRXPO-MRXNPFEDSA-N 380.831 5.126 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797567291 GACLKHIHWUUYTN-YJBOKZPZSA-N 384.545 5.599 30 20 GKED CN(c1ccccc1)c1ccc(/C=C\C(=O)c2c(Cl)nc3sccn23)cn1 797788838 VXIZMTTWRCDOOR-CLFYSBASSA-N 394.887 5.108 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccc(C2CCC2)c1 798815619 BAYUDZJZTNRGJV-MRXNPFEDSA-N 387.266 5.222 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C#N 799603883 OCKZKSUVEJDRLO-QGZVFWFLSA-N 377.856 5.134 30 20 GKED N#Cc1cccc(COc2ccc(Nc3nc(Cl)c(C#N)s3)cc2F)c1 804431091 ZKFRFDATZMYTTM-UHFFFAOYSA-N 384.823 5.002 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1-c1nc(-c2ccnc(C(F)(F)F)c2)no1 809534481 JKSWWNNVCFYLQL-UHFFFAOYSA-N 395.209 5.114 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cc4ccccc4nc3Cl)cc2)ccn1 811776960 BLICHKXLMUXRKL-UHFFFAOYSA-N 386.842 5.559 30 20 GKED CN(CCC#N)c1ccc(CNc2ccnc(Oc3ccc(F)cc3F)c2)cc1 811840709 QHRIZAALXQCVQG-UHFFFAOYSA-N 394.425 5.114 30 20 GKED CC(C)c1ccc(SCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813214492 YOLJJVXJFSVLBX-INIZCTEOSA-N 378.419 5.192 30 20 GKED N#C[C@H](CCc1ccccc1)c1nc(-c2cccnc2Oc2ccccc2)no1 904454891 WXYPQBCZRHHVAW-SFHVURJKSA-N 382.423 5.164 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccc(Cl)s2)cc1 915683967 RZMDYWQQZMWHCL-LJQANCHMSA-N 395.915 5.421 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917430147 FHBFCSJSQIHSAM-LMRWQKIVSA-N 386.398 5.595 30 20 GKED CSc1ccc2cc(COC(=O)c3cccc(CC#N)c3)c(Cl)nc2c1 919310891 ZQBOZTUNBFSJCC-UHFFFAOYSA-N 382.872 5.033 30 20 GKED COC(=O)c1sc2ncc(C(C)=NNc3cccc(Cl)c3F)cc2c1C 921137532 BFTIUNUUTDVQOU-UHFFFAOYSA-N 391.855 5.020 30 20 GKED Cc1cc2ccccc2nc1NN=Cc1ccc(-c2ccc(C(=O)O)cc2)s1 1776052719 LKQDBCMUTVHJEY-UHFFFAOYSA-N 387.464 5.416 30 20 GKED CC(C)(C)c1cc(C=NNc2ccc(CC(=O)O)cc2)cc(C(C)(C)C)c1O 1776083381 BWXVUOCOYPPZFS-UHFFFAOYSA-N 382.504 5.060 30 20 GKED CC(C)(C)c1ccc([C@@H](CC(=O)O)NCc2ccc(C(C)(C)C#N)cc2)cc1 1776271945 YHSOTGDXBTYQMB-OAQYLSRUSA-N 378.516 5.091 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)cc1)c1ccccc1 1776469438 RJVMBOFEZFBFMK-FCONWMNKSA-N 390.410 5.560 30 20 GKED CCCCCCCOc1cccc(CNCC[C@H](CC(=O)O)C(F)(F)F)c1 1776788694 MOZOLPQVQLHGGG-QGZVFWFLSA-N 389.458 5.169 30 20 GKED CCCCCCCOc1cccc(/C=C\c2ncc(C(=O)O)c(C(C)C)n2)c1 1776789244 YARYENKSRSDJIC-SEYXRHQNSA-N 382.504 5.818 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c(Cl)c1 1777353245 CNQOBLQYOXFRBU-RMKNXTFCSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@H]3CCC5)cc2)cc1 1777671069 YRYJXNDSYKBFFH-XUVWKZFSSA-N 380.443 5.752 30 20 GKED C=CCn1c(SCc2cc3ccccc3nc2Cl)nnc1-c1cccnc1 8472239 NXNODCRMPKLQEM-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 15336605 DEELOKHKMSIDQM-SFHVURJKSA-N 384.479 5.755 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccc(OCC#N)cc2)cc1OCC 15352600 PRZHNMAPSMRQOR-BJMVGYQFSA-N 399.874 5.326 30 20 GKED C=CCN(CC(=O)Nc1c(Cl)cc(Cl)cc1Cl)Cc1cccs1 19540426 HDMLTEHPWIQNGY-UHFFFAOYSA-N 389.735 5.335 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccccc2Cl)[n+]2ccccc2)s1 22730412 MLAIEUYVCIOCGO-UHFFFAOYSA-O 387.937 5.048 30 20 GKED N#C[C@H](C(=O)c1ccccc1COc1ccccc1)c1ccc2ccccc2n1 48854107 LYDUNRHQHCAEBM-QFIPXVFZSA-N 378.431 5.304 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1 66801573 SZUDBNYLKXGKNA-CQSZACIVSA-N 396.903 5.172 30 20 GKED COc1ccccc1-c1nnc(SCCCCC#N)n1-c1ccc(C)cc1 120991557 VQXXFGKWQUOBGU-UHFFFAOYSA-N 378.501 5.037 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@H](C)c3ncc(C(C)(C)C)o3)o2)cc1 126291443 YNZNVHSIWZMYRB-CYBMUJFWSA-N 385.489 5.440 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccccc2F)o1 128723038 IJXKXCSTBSEVFF-SFHVURJKSA-N 398.393 5.200 30 20 GKED CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccccc1OC 132839273 QKVBRTBEOBRBEA-UHFFFAOYSA-N 392.528 5.067 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2cccc(Cl)c2SCC(F)F)c(F)c1 152336374 LLHKVBVPMAOFMG-UHFFFAOYSA-N 388.773 5.099 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 160674342 HEODDMMPPAVMCR-HNNXBMFYSA-N 384.549 5.601 30 20 GKED Cn1cc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c(-c2ccncc2)n1 162679989 SLPYCKYEOFUIRP-HWKANZROSA-N 391.780 5.050 30 20 GKED Cc1cccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c1Cl 165631940 SURQGOYTDDZRLU-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)cc1 175559251 JFLUHOUKTFSVEQ-UHFFFAOYSA-N 380.369 5.214 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 177742991 HVTUEHSCLGRDJQ-CQSZACIVSA-N 385.489 5.328 30 20 GKED CCCN(CCC)C(=O)c1cccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c1 177764657 RRYWIDCUFDKACJ-SFHVURJKSA-N 397.544 5.019 30 20 GKED COc1cccc(F)c1NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 184428597 KUYIJEARGQROAF-UHFFFAOYSA-N 381.247 5.124 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)c(C)cc2C)=C(/S)NC(C)(C)CC)cc1 186981706 DSOGZUFCCCEXOJ-UHFFFAOYSA-O 397.608 5.179 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@H](c2ccc(F)cc2)C1 191461596 SOAXCQPZJGCTAJ-JTSKRJEESA-N 396.506 5.672 30 20 GKED C=CCCO[C@@H](C)C(=O)N(c1ccc(C(C)C)cc1)c1nc2ccccc2s1 302973498 DOSTYVBUZZOMKA-KRWDZBQOSA-N 394.540 6.066 30 20 GKED CC[C@H](C)n1ncc(N=C(O)N2CCSC3(CCCCC3)C2)c1C1CC1 328933171 PNDMXLMKBAGVNK-HNNXBMFYSA-N 376.570 5.029 30 20 GKED Cc1nn(CC(C)C)c(C)c1C/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329499470 JZPDAGQOIIQNMS-OAQYLSRUSA-N 397.567 5.044 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@H](c2ccccc2F)C2CCCC2)CC1)C1CC1 330024032 JMSBNIWNUWCVOF-NGICGMGXSA-N 386.511 5.939 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)CCCC2(C#N)CCOCC2)cc1 410379724 GZONPMROGJQBAN-HXUWFJFHSA-N 392.543 5.456 30 20 GKED N#CCCC[C@@H](NC(=O)NCCc1ccc(Cl)cc1Cl)c1ccccc1 431741069 BCSPTBDVKCLLAW-LJQANCHMSA-N 390.314 5.270 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)[C@@H](C#N)CCc2ccccc2)c1C 433312658 MWFWDQBNADVNEN-HXUWFJFHSA-N 385.467 5.202 30 20 GKED N#Cc1ccc(CSc2nnc(Cc3cccs3)n2C2CC2)c(Cl)c1 438903027 PBRPTZLRHFMEOZ-UHFFFAOYSA-N 386.933 5.083 30 20 GKED N#C[C@@H]1CCC[C@@H](N[C@H](CC(F)(F)F)c2ccc(Br)cc2)C1 446764917 AOYJFTQZYOQXCJ-KCPJHIHWSA-N 375.232 5.115 30 20 GKED CC[C@@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(C#N)cc1 447529891 LKCYEDJIVRHNHJ-LJQANCHMSA-N 384.405 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCOC[C@@H]1c1ccc(F)cc1 455254875 XKXCYHZRCCCMFR-OAQYLSRUSA-N 382.479 5.283 30 20 GKED C[C@@]1(c2ccccc2)CCCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458804379 SLVMUASBJOFTJR-LADGPHEKSA-N 375.516 5.185 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)CCCC#N 462131857 BQALHNGACYBVKD-UHFFFAOYSA-N 378.451 5.364 30 20 GKED CC#CCSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 463048433 LVMKABVDRZADKO-UHFFFAOYSA-N 378.284 5.009 30 20 GKED Cc1ccc(NC(=O)CSc2ccc(C#N)cc2Cl)c(Br)c1 465386820 DACNAKQVPRKHKX-UHFFFAOYSA-N 395.709 5.013 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccccc1F 474278413 VWRQIPHFFWXXPH-AWEZNQCLSA-N 379.275 5.268 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c1 475255680 KVRNFYUOVUGDPC-UHFFFAOYSA-N 385.920 5.198 30 20 GKED N#Cc1cc(F)ccc1NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 478705164 SAWSXSQYSKDOCH-UHFFFAOYSA-N 389.352 5.037 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ncc(Cl)s1 478914929 YTZGTXNDYHMFEQ-LLVKDONJSA-N 397.978 5.063 30 20 GKED C=CCCO[C@@H](C)C(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 481063086 VAICXOZTXPLYCU-JTSKRJEESA-N 394.540 5.215 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481567215 BFMRDTLCSRLBHN-IBGZPJMESA-N 381.451 5.073 30 20 GKED N#CCCCOc1cccc(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)c1 482995355 ZTYBLPWEFRDEDN-SFHVURJKSA-N 376.378 5.044 30 20 GKED CC(C)c1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1ccc(F)cc1 483241158 RVMZEMFPSJZFPH-FQEVSTJZSA-N 398.441 5.173 30 20 GKED Cc1cc(OCCCC(=O)Nc2ccccc2SCCC#N)ccc1Cl 517443247 RJGRCQCDSFJINL-UHFFFAOYSA-N 388.920 5.452 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H]1CCc2ccccc21 517533575 WSNPFMPFOFJNOJ-UTKZUKDTSA-N 393.556 6.012 30 20 GKED CCO[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 517905699 CBOBYQPTPONNNM-HSZRJFAPSA-N 386.451 5.375 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@H]2CCc3ccccc32)cc1 520349251 YGWRHMFLAAGPKT-OAQYLSRUSA-N 398.531 5.310 30 20 GKED N#Cc1cc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)ccc1F 524457000 YFOVDDKOSNWPOP-UHFFFAOYSA-N 398.768 5.837 30 20 GKED C[C@H](CC#N)NC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525060397 VAFBYVGDPIUHEV-GFCCVEGCSA-N 379.312 5.318 30 20 GKED C[C@H](NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(C#N)cc1 537295390 JOSFPHSVTJAZBK-HNNXBMFYSA-N 388.342 5.180 30 20 GKED CCN(C(=O)C[C@@H](C)C(=O)c1ccc(Cl)cc1)[C@@H](C)c1ccc(C#N)cc1 537479912 YXBVPUTZMZFAHP-CVEARBPZSA-N 382.891 5.030 30 20 GKED Cc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1NC(=O)C(C)(C)C 537728948 AOAMCECJCVNTOP-UHFFFAOYSA-N 389.543 5.796 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccc(C(F)(F)F)cc1Cl 540472320 WKFMBLIVZAWCLH-UHFFFAOYSA-N 385.666 5.769 30 20 GKED COc1cc(CN[C@H](C)c2ccc(C#N)c(F)c2)ccc1OCc1ccccc1 540707090 OSAPJECKKVEAGS-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccc(F)cc2)c2cccnc2)cc1 543424233 OOTIHROMURUBCV-AREMUKBSSA-N 393.465 5.639 30 20 GKED COc1ccc2ccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2c1 550912572 VLJSKRNRNJRVID-HNNXBMFYSA-N 376.481 5.495 30 20 GKED CC(C)(c1cc(F)cc(C#N)c1)c1nc(-c2cccc(-c3cscn3)c2)no1 569767503 UGKRBSHMLMSULU-UHFFFAOYSA-N 390.443 5.197 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c2[C@H](C)C1 576005634 QXYTYLRASDDSFV-QWHCGFSZSA-N 377.469 5.213 30 20 GKED N#Cc1ccc(CN(Cc2ccc(O)cc2)Cc2ccco2)c(C(F)(F)F)c1 589497029 GYLNWHKRPJXODH-UHFFFAOYSA-N 386.373 5.078 30 20 GKED Cc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)nnn1-c1ccc(Cl)cc1 590257340 NEJKHWVEUAGMOG-IERDGZPVSA-N 393.922 5.315 30 20 GKED Cc1cc(C)c2cc(C(=O)N(Cc3ccco3)c3ccccc3C#N)sc2n1 603533309 LACPXWVTKBHLGR-UHFFFAOYSA-N 387.464 5.225 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c(Cl)c1 604382234 AKFRQCWJMXKPMY-UHFFFAOYSA-N 390.870 5.660 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)o1 609416391 NMUKFOJGCSBKRR-XFJVYGCCSA-N 377.271 5.023 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2Cl)c1 609504052 QMYXMUXUGAQQDB-NWDGAFQWSA-N 397.208 5.209 30 20 GKED C[C@H](SCc1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(C#N)cc1 609825342 RWXUFEWJEWHACM-LBPRGKRZSA-N 389.402 5.621 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C(C)(C)C)cc2)nc1)c1cccc(C#N)c1 610153389 OQGFTZHVGYTITK-UHFFFAOYSA-N 385.467 5.320 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 610163141 MMPRWNVDPAXDPD-INIZCTEOSA-N 395.812 5.566 30 20 GKED N#Cc1c(NC(=O)c2ccc(Oc3ccc(F)cc3)cc2)sc2c1CCC2 610935056 DZDLYFSARKWBFB-UHFFFAOYSA-N 378.428 5.292 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 642473724 CKUWXXQJIJZSPU-UHFFFAOYSA-N 389.480 5.776 30 20 GKED O=C(C1CC(c2ccc(F)cc2)C1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 654183518 SUJWQHHEZUBYRK-CXTZMWEQSA-N 397.334 5.051 30 20 GKED C=C(CNC(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 672634583 UOQDPXRXJCPHDP-UHFFFAOYSA-N 385.467 5.082 30 20 GKED Cc1cccc2sc(C(=O)[C@H](C#N)c3nccc4ccccc34)c(Cl)c12 682995186 QCMDIVNJJUIGPC-OAHLLOKOSA-N 376.868 5.901 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=S)Nc1ccc(C#N)c(Cl)c1 726484227 HXSMJZIJHGDGLJ-UHFFFAOYSA-N 375.900 5.206 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccc(F)cc2F)c1 728227266 DYMXWIFHSDHINX-UHFFFAOYSA-N 378.447 5.350 30 20 GKED CCc1cccc2c(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c[nH]c12 731573878 KCVCZYYHUQHFGP-XMMPIXPASA-N 393.490 5.567 30 20 GKED C#CC[C@@H](OC(=O)c1csc(-c2ccc(C(C)C)cc2)n1)c1ccccn1 733691492 TUVNWOWDMHQKNV-HXUWFJFHSA-N 376.481 5.250 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCc1ccc(OCC#N)cc1 743582809 JISHMKDKJPKLOG-IBGZPJMESA-N 399.494 5.159 30 20 GKED CCCOc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 744114938 FRTOSZAEBIMIJC-QGZVFWFLSA-N 382.460 5.033 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 749346798 KXRMKDCBBPLECJ-VBKFSLOCSA-N 387.414 5.235 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(SC4CCCC4)cc3)cc12 750903733 CZVGBOFPSZWVQM-GHXNOFRVSA-N 377.513 5.208 30 20 GKED CCn1nc(C)c(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)c1C 750909530 MOIOUYSQVLHGGV-PKNBQFBNSA-N 377.469 5.286 30 20 GKED C#CCCSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 751740251 SFVSNZWHFMGZAF-UHFFFAOYSA-N 378.284 5.009 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(F)c(Cl)c2Cl)c2ncc[nH]2)c1 761475356 DTIXWPJBEDZWIT-UVTDQMKNSA-N 391.229 5.288 30 20 GKED COc1ccc(-c2cc(C(=O)N(C)c3ccccc3C#N)c3ccccc3n2)cc1 764397488 XLQHPZCKUQPXSA-UHFFFAOYSA-N 393.446 5.059 30 20 GKED O=C(/C=C\c1cncc2ccccc12)c1ccc(OC(F)F)cc1OC(F)F 772804485 BWBXKTSNPDTYGY-YVMONPNESA-N 391.320 5.334 30 20 GKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 772958925 ISHLZQIZQMWZGE-MSOLQXFVSA-N 390.458 5.932 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2ccccc2OC)C2CCCC2)c1 774449246 NATUDGLPPSCDMM-RDPSFJRHSA-N 378.516 5.397 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2csc(COc3ccc(Cl)cc3)n2)cc1F 776729961 XUMOVIPKBRVYCZ-VMPITWQZSA-N 398.846 5.282 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(C=NOC2CCCCC2)cs1 777456933 ISCAYTXLQJLONU-UHFFFAOYSA-N 377.897 5.164 30 20 GKED CCOc1c(Cl)cccc1/C=C1/SC(=Nc2c(C)cccc2C)NC1=O 779752993 UEYWMWZSPWXBAO-LFIBNONCSA-N 386.904 5.247 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792095927 YJWBXPNFAHEYSJ-HKUYNNGSSA-N 382.385 5.624 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(C4CC4)cnc3Cl)cc2)c1 793467332 IUMWWJNCUOCEMV-UHFFFAOYSA-N 389.842 5.529 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nnc(-c2ccccc2F)s1 795987349 CFYTVPBAYLQSHF-HOCLYGCPSA-N 395.459 5.036 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)C1 797573079 OAOKBFVKKFYUKI-KZNAEPCWSA-N 390.593 5.773 30 20 GKED CC(C)(C#N)CCCCOC(=O)C(C)(C)c1csc(-c2cccs2)n1 800292814 RVVRCPBAWRHKEU-UHFFFAOYSA-N 376.547 5.412 30 20 GKED C=CCCc1ccccc1NC(=O)c1oc(COc2ccc(C=O)cc2)cc1C 800592476 GSBAJGULALBYSG-UHFFFAOYSA-N 389.451 5.350 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cc4c(C)nn(C)c4s3)s2)cc1 806577208 RNGMSEULPZENNL-HJWRWDBZSA-N 379.510 5.271 30 20 GKED CCc1noc(C)c1C(C)=NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 814948862 ITIUKMMYNDCVIY-UHFFFAOYSA-N 379.304 5.419 30 20 GKED C=C[C@H](CCC(=O)O)NCc1cc(C)c(OCc2ccccc2Cl)c(C)c1 841810099 FHRGXPHKBANVHI-LJQANCHMSA-N 387.907 5.045 30 20 GKED N#C[C@H](C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1nc(C2CC2)cs1 842939136 OPWXXLXJZNULTI-OAHLLOKOSA-N 397.887 5.138 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(C(F)(F)F)cc1 842943720 YNRBEWGPVMRXGU-NHYWBVRUSA-N 378.419 5.409 30 20 GKED FC(F)(F)[C@@H]1CCC[C@@H](C=Nn2c(S)nnc2-c2ccccc2Cl)C1 853269097 KFMCXPCBGWNEPP-GHMZBOCLSA-N 388.846 5.090 30 20 GKED FC(F)(F)c1ccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)cc1 916546439 QZGISFUKCMTIRE-UHFFFAOYSA-N 396.825 5.125 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)s1)C(=O)Nc1cc(Cl)cc(Cl)c1 916946000 HRVHGRBJQNLMPV-CHWPNHQFSA-N 399.686 5.069 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C\C(=O)c2cc(Cl)sc2Cl)c1 918711993 FOYATLYNUJCVIV-WAYWQWQTSA-N 379.268 5.350 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/Cc3cc(C)ccc3C2=O)cs1 921270845 ZXSGSBLFQQQIDZ-WJDWOHSUSA-N 392.455 5.098 30 20 GKED COc1ccc(C=NN(c2ccccc2)c2ccccc2)c2cc(C(=O)O)oc12 1776032425 JHTJGGIZLQKRER-UHFFFAOYSA-N 386.407 5.312 30 20 GKED CCCC(=NNc1ccc(C(=O)O)nc1)c1ccc(Oc2ccccc2)cc1 1776071257 NRPLEOFPFLFSTK-UHFFFAOYSA-N 375.428 5.188 30 20 GKED CC(C)COc1ccccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776333768 UKJCCWSLGNUQCL-VAWYXSNFSA-N 390.435 5.576 30 20 GKED CC(C)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776356053 ZECNNBYSBYWDGC-LFYBBSHMSA-N 376.408 5.328 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@H](CC(=O)O)C2(C)C)cc1 1776787496 DZLDZOZDENHEKR-GOSISDBHSA-N 391.577 5.465 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc3cc(Br)ccc3s2)c1 1777686077 GMWBYYWBTQHXCA-AATRIKPKSA-N 387.254 5.258 30 20 GKED O=C1/C(=C/c2cccc(SC(F)(F)F)c2)C[C@@H](C(=O)O)c2ccccc21 1777698387 KKWDKNOFRWBIBI-OQRGYWNNSA-N 378.371 5.137 30 20 GKED N#Cc1ccc(F)c(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)c1 29890433 HSCSONRGSYMUFY-UHFFFAOYSA-N 389.459 5.064 30 20 GKED O/C(=N\c1nnc(C(F)(F)F)s1)c1ccc(-c2ccc(Cl)cc2)s1 31564719 CTSDOTMRIBSJTH-UHFFFAOYSA-N 389.811 5.575 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1ccc(C(=O)Nc2ccccc2)cc1 59423182 ASPKCDLJSPPGTL-UHFFFAOYSA-N 386.495 5.136 30 20 GKED N#Cc1cccc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)c1 60391883 ICBPZZSDYIHXSO-UHFFFAOYSA-N 398.491 5.294 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cn(C)c2ccccc12 65856262 WOQLVMMDCWVQNL-UHFFFAOYSA-N 395.462 5.332 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2csc(-c3ccc(C)cc3)n2)cc1 103960453 HCQLLLYGPYSVRD-UHFFFAOYSA-N 391.496 5.078 30 20 GKED N#CCCSc1ccccc1NC(=O)CSc1nc2ccccc2s1 108200950 LLDKBPLLRBVIQT-UHFFFAOYSA-N 385.539 5.033 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1nc2ccccc2s1 108240887 DLCCPRNNVJGJPD-CQSZACIVSA-N 381.526 5.119 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCO[C@H](C)c1ccccc1 108531615 CMUNQGPWMGLFHW-ZWKOTPCHSA-N 397.544 5.228 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(-c3ccc(C)cc3)o2)ccc1OC 113347695 KZFHWTYHBXPFAD-HXUWFJFHSA-N 390.483 5.234 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccc(Cl)cc2C1 123776808 JTNZZIMWZFAJND-AWEZNQCLSA-N 385.920 5.182 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(SCc3csc(C)n3)cc2)s1 126796533 ONMSIBUVWMZVAL-UHFFFAOYSA-N 399.566 5.492 30 20 GKED COc1cc(C#N)ccc1O[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 130292514 SYCBPWFQHIFJSK-SNVBAGLBSA-N 390.226 5.064 30 20 GKED CC(=O)Nc1ccc(NCc2ccccc2C(C)(C)C#N)c(C(F)(F)F)c1 131474020 VBTMRTHUMZOZNA-UHFFFAOYSA-N 375.394 5.077 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)n1 158624382 KVGVYSQGBHDSRB-SFHVURJKSA-N 387.439 5.296 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1C1CC1 161162135 LMXBGOVUQHCAAA-GTNSWQLSSA-N 391.302 5.033 30 20 GKED N#C[C@@H](C(=O)CCC(F)(F)F)c1nc(-c2ccc(Cl)cc2Cl)cs1 173989762 XZCPRFBUXOATFE-JTQLQIEISA-N 393.217 5.636 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(CS(=O)(=O)C(C)(C)C)c1)c1ccccc1 187956468 FBNQMPFPBOXNFD-NRFANRHFSA-N 399.556 5.088 30 20 GKED CC(C)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 236738125 LAHFOZJGAQIZIS-FOIQADDNSA-N 376.422 5.483 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 255136468 QRNIXPVETXSYSG-CPPNXCSESA-N 387.439 5.101 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)N1CCSC1=Nc1cccc(Cl)c1C 255435082 NFNIQVQCIZQMIG-NSHDSACASA-N 391.924 5.010 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)c1 303154439 GOGODUXZVJYVCU-IAGOWNOFSA-N 389.282 5.418 30 20 GKED CCc1cccc2c(C3CCN(C(O)=Nc4scnc4C4CC4)CC3)c[nH]c12 328918693 SDXFZNLGSHKPPU-UHFFFAOYSA-N 394.544 5.489 30 20 GKED C=CCC1(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)CCOCC1 424806363 COGXDGFJVIZSGS-UHFFFAOYSA-N 396.434 5.140 30 20 GKED CC(C)Cn1ncc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c1-c1ccccc1 429119481 ZESINUJVXIRPDD-QGZVFWFLSA-N 392.528 5.276 30 20 GKED Cc1ccc(Nc2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)cc1 433026226 DICBVCRPJVKNIU-NRFANRHFSA-N 376.529 5.720 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)[C@H](C#N)CCc1ccccc1 433377520 QLEHCHZWRLDBJJ-INIZCTEOSA-N 385.305 5.284 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)c(Cl)c1 433517371 BUYWDDMAXNEVOT-CYBMUJFWSA-N 391.899 5.537 30 20 GKED C/C(=C/c1ccc(-c2cccc(Cl)c2Cl)o1)c1nc(=O)c(C#N)c(C)[nH]1 435339535 VBVDWHGEENCAQB-NTMALXAHSA-N 386.238 5.077 30 20 GKED C=CCC[C@@H](NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)c1ccccc1 435760401 BRTURXRQNJBPEC-CQSZACIVSA-N 397.466 5.404 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1cccc(Cl)c1 436348695 AOHKRPIOGJXAAP-RPVQJOFSSA-N 385.920 5.269 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 438053137 AKFYYUOAVWUFMT-INIZCTEOSA-N 383.517 5.346 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(CCC(F)(F)F)c2)cc1OC 440931104 JJGSUIBCZPNRLP-UHFFFAOYSA-N 379.378 5.007 30 20 GKED N#CC1CCC(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 441336863 IDEYXGDIKIBPLA-UHFFFAOYSA-N 379.451 5.248 30 20 GKED C[C@@H](Sc1nnc(-c2ccccn2)n1-c1ccccc1)c1cccc(C#N)c1 442905390 ZOPPDYRYXQJUNX-MRXNPFEDSA-N 383.480 5.054 30 20 GKED CCN(C(=O)c1ccc(C#N)c(O)c1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 442966741 KQSAPUUHDTVVED-DEOSSOPVSA-N 399.494 5.034 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3c[nH]nc3-c3ccsc3)n2)cc1 444456494 DXCHALRIYUQIOT-HNNXBMFYSA-N 390.493 5.060 30 20 GKED N#CC(CCNC1(c2nccs2)CCCC1)(c1ccccc1)c1ccccc1 444659650 DTIJIYBAIYJWBW-UHFFFAOYSA-N 387.552 5.402 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccc(O)cc3Cl)no2)c2ccccc21 445450291 RVFLHYMYEGCRGN-TWGQIWQCSA-N 390.830 5.134 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1 445793394 COPVKVPWFYZODZ-LLVKDONJSA-N 382.382 5.349 30 20 GKED N#CCc1ccc(NC(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)c(Cl)c1 455735853 QYMUNJWGUUFXEY-UHFFFAOYSA-N 393.796 5.056 30 20 GKED CCCOc1ccc(CCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 463748250 XRUQBQQTUHPHQP-QGZVFWFLSA-N 382.529 5.298 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@H](C#N)C(C)(C)C 464706942 CSEFUGFPLYVANH-CYBMUJFWSA-N 394.302 5.440 30 20 GKED C=C(C)C[C@H](C)C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 466245097 XABHQUJUXIGYSH-SMDDNHRTSA-N 378.232 5.161 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(N(C)C(=O)[C@H](C)CC(=C)C)c(Cl)c1 466873448 JHMKMVHLFQCYCF-HZPDHXFCSA-N 376.928 5.446 30 20 GKED C[C@H]1C[C@@H](C)CN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@H]1C 474505359 HBXSVHMPGDXIRL-QYZOEREBSA-N 391.515 5.230 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)cn2)cc1 475638214 ISZKUGRVAHWMBW-UHFFFAOYSA-N 375.403 5.066 30 20 GKED C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)C[C@@H](CC#N)c1ccccc1 476479192 DYOZOOQKHRSCET-GOEBONIOSA-N 375.299 5.128 30 20 GKED C[C@@H](NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1ccc(C#N)cc1F 477855253 XAGHOAPADIZSQN-LLVKDONJSA-N 382.788 5.709 30 20 GKED Cn1cc(CNCc2ccc(Oc3ccccc3)cc2)c(-c2ccc(C#N)cc2)n1 479981911 OCJGFCZTOIDBRW-UHFFFAOYSA-N 394.478 5.041 30 20 GKED CC(C)(CC(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C(F)(F)F 480610342 ILMHUBKMUDDHMI-LLVKDONJSA-N 395.265 5.404 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(Oc2cccc(F)c2)nc1 481922135 MPCLXBDHGSPUBK-HSZRJFAPSA-N 387.458 5.442 30 20 GKED N#CCCC[C@H](NC(=O)COC(c1ccccc1)c1ccccc1)c1ccccc1 487416909 DCYFXERBDUCLQC-DEOSSOPVSA-N 398.506 5.344 30 20 GKED C=C(C)Cn1c(SC[C@@H](OC(C)C)c2ccccc2)nnc1-c1ccncc1 488288179 STANOQDAMFNLFH-HXUWFJFHSA-N 394.544 5.175 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@H]2CCCC(F)(F)C2)cc1 494237094 ILOKOYXDEJPNFD-SFHVURJKSA-N 399.441 5.031 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3sccc3Cl)c2)cc1 506668043 GAONIMHYZYMVSY-UHFFFAOYSA-N 382.872 5.299 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 512616351 AKLFFZNYCWKWQX-DLBZAZTESA-N 387.458 5.361 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)Nc2ncc(C#N)cc2Cl)cc1 513653525 RUNVHTGCHYAYMZ-HXUWFJFHSA-N 381.838 5.150 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)cn3)cc2)cc1 519032246 QJPLHSCQVSBGOM-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC(C)(C)[C@H]1CCCC[C@H]1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521093916 LPGXZLPTWVKZAM-VQTJNVASSA-N 377.488 5.080 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1ccccc1C(F)(F)F 525301538 FCYYAQCFYSGJAL-AWEZNQCLSA-N 380.385 5.303 30 20 GKED COc1ccc(CNc2cccc(-c3cccs3)c2)cc1OCCCC#N 532890473 NVYPSYUOEXZUMD-UHFFFAOYSA-N 378.497 5.718 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2cccc(Cl)c2)o1 533177021 MXDKXTMKQOYXJR-SNVBAGLBSA-N 376.268 5.768 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(NC(=O)C2CC2)cc1 535071563 AHEXHYUBDMQMOY-KETPHWKMSA-N 387.527 5.090 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC/C=C\c2ccccc2)cc1 537584713 NKQVTAUHEOGCCA-TWGQIWQCSA-N 384.504 5.294 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)c1 537695564 XZIPBEBGWHCRNN-GOSISDBHSA-N 393.462 5.029 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)Nc1ccc(C#N)cc1Cl 538669093 XTZLWGWKNWSQFQ-UHFFFAOYSA-N 389.814 5.174 30 20 GKED Cc1csc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542021053 YABAOWDWUGLJDS-JKSUJKDBSA-N 390.512 5.112 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cccc(N3CCCCCC3)c2)C2CC2)cc1 543327385 XQDLIHOEBUMRLJ-UHFFFAOYSA-N 388.515 5.135 30 20 GKED Cn1cc(CN2CC[C@H](C(F)(F)F)c3ccccc32)c(-c2ccc(C#N)cc2)n1 552316841 OOXGFSNZUNKNHZ-IBGZPJMESA-N 396.416 5.015 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCC2(C(F)(F)F)CC2)c1 557126448 KQMPUUUNSMATQB-UHFFFAOYSA-N 394.780 5.076 30 20 GKED Cc1cc([C@@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2ccccc2Cl)ccc1F 596398616 QWVOCBKFVZLJKZ-HRAATJIYSA-N 399.897 5.212 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)C1 597909994 SRAPBJBEDANGFQ-AWEZNQCLSA-N 389.282 5.552 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCC2(C#N)CCCCC2)cc1 598304401 MLBQZCAFXRECJN-UHFFFAOYSA-N 389.524 5.054 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1coc(-c2cc(Cl)cc(Cl)c2)n1 600929430 DNEJLPBWXFYUNK-RUZDIDTESA-N 399.343 5.617 30 20 GKED N#Cc1ccc(CSCc2nc(-c3ccc(C(F)(F)F)cc3)no2)c(F)c1 604058272 XDFZWHUEASYGNF-UHFFFAOYSA-N 393.365 5.200 30 20 GKED C[C@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 604699261 KELIQCMAUDHXCG-PBOSXPJTSA-N 399.350 5.345 30 20 GKED N#C[C@H](C(=O)c1cc(Oc2ccccc2)ccn1)c1nc2cc(F)ccc2s1 608752443 HTQDGSAXMWXVKM-MRXNPFEDSA-N 389.411 5.113 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc(C(F)F)cc3)c2)cc1 608805246 SDVSYJTXEAPRRO-UHFFFAOYSA-N 392.405 5.522 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1ccc(Cl)cc1 609062701 WCNSAIOPERKBHY-UHFFFAOYSA-N 390.870 5.280 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)c(C)c1 609098506 BYWAWRUBXKSZKF-HTAPYJJXSA-N 393.556 5.365 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnc(C2CC2)s1 609166606 HSQMTQLRZRXTMV-UHFFFAOYSA-N 375.453 5.245 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 609286872 FSVDWLXCBRRHKY-IBGZPJMESA-N 398.293 5.082 30 20 GKED N#CCCSc1ccccc1NC(=O)CCOc1cccc(Cl)c1Cl 609375620 XJXKHYHONXDTBE-UHFFFAOYSA-N 395.311 5.407 30 20 GKED CCN(c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1)C(C)C 609377120 PAKWUNVICLZIPE-QGZVFWFLSA-N 381.545 5.425 30 20 GKED CSCc1c(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)oc2ccccc12 609414999 HYQPTCTVDLNDOV-LJQANCHMSA-N 392.524 5.588 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@H](c4ccccc4)C3)cc2)cc1 609502934 ZLHGSQFAOLUZLT-QFIPXVFZSA-N 382.463 5.175 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3occc3s2)cc1 609855821 HQBSIDFCBRYWOI-UHFFFAOYSA-N 388.448 5.392 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 611299723 DXSBXDQRJWLVIS-OAHLLOKOSA-N 391.858 5.198 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1nc2ccccc2[nH]1 612893526 VSUNSIRMPWKLSI-IBGZPJMESA-N 388.430 5.268 30 20 GKED Cc1cc(C(=O)Nc2c(C#N)c(C)c(C)n2-c2ccccc2)c(C(F)(F)F)o1 613651069 GVWKLPXNGOQTSG-UHFFFAOYSA-N 387.361 5.138 30 20 GKED CC(C)(C#N)c1ccc(CN2CCO[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1 614182515 UKMCJHNLOJBWNE-FQEVSTJZSA-N 388.433 5.080 30 20 GKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc2cc(Br)ccc2o1 618803197 HMLXJGOTTOMDME-KPZWWZAWSA-N 381.273 5.405 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2nnc(-c3ccc(C)cc3)o2)cc1 620314329 ZPIXGEUYBBDUIQ-OYRHEFFESA-N 385.467 5.035 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ccc(C(F)F)o1 626404804 OJYLEHDKLSTKFI-LLVKDONJSA-N 387.226 5.269 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 661118126 WVMOHAOOHBITGC-PZJWPPBQSA-N 397.588 5.669 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc(Cl)c1Br 671279024 XYLQKXJXVSVMTM-AWEZNQCLSA-N 399.675 5.449 30 20 GKED Cc1nc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)sc1-c1ccccc1 727222613 HMFYTJUEOIERIF-UHFFFAOYSA-N 390.512 5.433 30 20 GKED COc1ccc(OC(F)F)c(/C=C\C(=O)c2sccc2Br)c1 732926709 SAWSCKFACXWVJH-RQOWECAXSA-N 389.217 5.017 30 20 GKED Oc1ccc2ccccc2c1C=Nc1cccc(CSC2CCOCC2)c1 734752962 MEHHDMHTMXNSHK-UHFFFAOYSA-N 377.509 5.708 30 20 GKED Cc1ccc(N2CCCC2)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 734998081 MHCVQCADLASYLP-DEOSSOPVSA-N 395.506 5.503 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)c1 735365916 IEMQBJNPXUKUJK-FQEVSTJZSA-N 383.879 5.392 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(CSC(F)F)o3)c2)s1 740011342 NLACWTLGSICVCJ-UHFFFAOYSA-N 390.480 5.625 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1cc(C)n([C@H](C)c2ccccc2)c1C 741729500 QPJJNKHCCRWFKI-QGZVFWFLSA-N 390.458 5.118 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC3(CCCC3)C2)c1 742879112 WPIOCWUVWYFHFF-UHFFFAOYSA-N 380.875 5.410 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)O1 744037205 PONCUSJPDRZPQU-NUWUUPJWSA-N 398.572 5.135 30 20 GKED CC(=NN(Cc1ccccc1)Cc1ccccc1)c1cccc(N2CCOC2=O)c1 745589000 YSMVARGTTOVZBG-UHFFFAOYSA-N 399.494 5.070 30 20 GKED CC(C)[C@@H](C#N)NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 746240099 VOWJGUMSBLIUAH-OAQYLSRUSA-N 382.463 5.211 30 20 GKED COc1cc(/C=C2\CSc3ccccc3C2=O)ccc1OCC(F)(F)F 750901261 QOBODVNKKUFIJX-MDWZMJQESA-N 380.387 5.008 30 20 GKED O=C1/C(=C/c2nc(Cl)cs2)Cc2c(Cl)cc(Br)cc21 759090453 LEKVEHOSPFSEEY-QHHAFSJGSA-N 375.074 5.035 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)cc1 772591523 ATRDDSPMEPFUBA-FGZHOGPDSA-N 390.870 5.058 30 20 GKED CCOC(=O)c1sc2cccc(F)c2c1CNc1ccccc1O[C@H](C)C#N 779742878 UQFILUSLGHKZEX-CYBMUJFWSA-N 398.459 5.120 30 20 GKED Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccccc3O[C@H](C)C#N)c2C)c1 781034655 MUVDCDDWLVCCCH-GOSISDBHSA-N 387.483 5.254 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(Cl)c2)CCCC1)c1cnc2ccccc2n1 792110427 LPRPFFJKEAMNGT-SFHVURJKSA-N 389.886 5.263 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797571933 SAKMFWFISBIHOV-AAEUAGOBSA-N 380.435 5.439 30 20 GKED Sc1nnc(-c2ccccc2)n1N=Cc1c(Cl)ccc(Cl)c1Cl 818224802 RDKPKHSNWLBBKL-UHFFFAOYSA-N 383.691 5.076 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]1Cc1ccccc1)c1nc2ccccc2n1C(F)F 850768894 AVKANZCGDDRSFC-KZNAEPCWSA-N 393.437 5.267 30 20 GKED CC1(C)CN(C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)CC[C@H]1C(F)(F)F 857493560 DXFINESXDODIFI-OLZOCXBDSA-N 385.323 5.153 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CC(C1CCC1)C1CCC1 860470906 XIZMGPWENHNLLG-NRFANRHFSA-N 380.532 5.065 30 20 GKED FC(F)(F)C(F)(c1ccc(-c2nc(-c3ccncc3)no2)cc1)C(F)(F)F 904580888 QSFDSFJUXKLBEM-UHFFFAOYSA-N 391.246 5.088 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-n3cccc3)cc2)cc1 915085752 BIKNGMDDTBZVGC-DEOSSOPVSA-N 377.447 5.385 30 20 GKED N#C[C@H](C(=O)C[C@H]1C[C@H]2CC[C@H]1C2)c1nc2cc(C(F)(F)F)ccc2s1 915103840 GNGBDYXVYVQXJZ-CIQGVGRVSA-N 378.419 5.318 30 20 GKED COc1ccc(/C=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1OC 915179341 CFYVDUKGDYMVPK-YTIHOSAGSA-N 398.462 5.011 30 20 GKED CC(C)(C)c1ccc(SCC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 916847895 TVPXOUSYTNHHDU-INIZCTEOSA-N 380.538 5.562 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)F)cc1)c1nc2cc(Cl)ccc2s1 917045098 XIWPMWFFRMAJQE-GFCCVEGCSA-N 394.855 5.754 30 20 GKED C=CC[C@@H]1CCN1Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 934473089 WWMVVVDXODITIJ-QGZVFWFLSA-N 389.952 5.248 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@@H](C(=O)O)C[C@H]2C)cc1 1776787487 DHIXKLYWWMBMLW-SJLPKXTDSA-N 377.550 5.074 30 20 GKED CCOc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1F 1776925920 CRNINJYOZPORCX-OQFOIZHKSA-N 380.371 5.079 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)[C@H]3CC=C(C)CC3)CCC2)cc1 1791729061 QBSTWMHBRMNNSX-FQEVSTJZSA-N 392.543 5.061 30 20 GKED C=CCN(C(=O)c1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 7724812 SAJBXJHVFUNFCS-UHFFFAOYSA-N 399.859 5.205 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc(OC)c1O 25252995 CBMUTNLFEZMRRR-FPYGCLRLSA-N 384.428 5.173 30 20 GKED Cc1cc(C(=O)/C(=C(/S)NC2CCCCC2)[n+]2ccccc2)c(C)c(C)c1C 27328681 RGMZDPNQEOXYJQ-UHFFFAOYSA-O 395.592 5.069 30 20 GKED N#C[C@@H](C(=O)c1ccc2c3c(cccc13)CC2)c1nc2ccccc2n1C(F)F 41557388 AHICEVUGXRKIQD-KRWDZBQOSA-N 387.389 5.173 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ncc(-c2cccc(Cl)c2)o1 66860972 XAZQLOVGDBQRBA-AWEZNQCLSA-N 383.904 6.001 30 20 GKED Cc1cccc2[nH]cc(CCNC(=O)Nc3ccccc3S[C@H](C)CC#N)c12 66954962 RCIVMECXNCIGGA-MRXNPFEDSA-N 392.528 5.235 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1ccc(CC#N)cc1 97173795 XHQLTMFWPUWXDT-OAHLLOKOSA-N 376.485 5.067 30 20 GKED C=C(Cl)CSc1nnc(Cc2cccs2)n1CCc1ccccc1 104502638 RDVQNWBRCKMKQD-UHFFFAOYSA-N 375.950 5.018 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cc(F)ccc1F 108242142 PSCUBRDKBWPUJT-UHFFFAOYSA-N 386.345 5.242 30 20 GKED CC(C)N(CCC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccc(C#N)cc1 109405759 WFXFNYPXEJAFSV-UHFFFAOYSA-N 390.314 5.104 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 110655068 PDBMCAJKEYODIT-VKJYCEFSSA-N 380.658 5.834 30 20 GKED N#CCCSc1ccccc1NCc1nc(-c2c(F)cccc2F)cs1 127493831 NIMJBWHCXSYHIS-UHFFFAOYSA-N 387.480 5.706 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171254715 TVGJWHGPVPTUEY-UHFFFAOYSA-N 398.304 5.134 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC[C@H](C)c1ccccc1 183337505 ZLEJGFRFWOLDQK-SJORKVTESA-N 384.570 5.414 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C#N)s1 189908158 PVRGWQORKMNAOS-IBGZPJMESA-N 383.517 5.134 30 20 GKED N#CCc1ccc(NCc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 237861079 KKEUREAHTJKFOV-UHFFFAOYSA-N 375.859 5.270 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)CC1 272460493 CGYZQXMCFAFHPL-CYBMUJFWSA-N 398.359 5.130 30 20 GKED CC(C)OCc1cc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1O 290577890 XCFLJSYLCPWPMA-HNNXBMFYSA-N 399.516 5.355 30 20 GKED C[C@@H]1C(O)=Nc2cc(/C(O)=N/C3CC(c4cccc(Cl)c4)C3)ccc2N1C 330243371 WRUNGDYNEIUQLF-OLJMKKDRSA-N 383.879 5.017 30 20 GKED C=CCC(CC=C)C(=O)N1CCC(F)(c2ccccc2OC(F)(F)F)CC1 410170254 ZKWKNZIMANWBAS-UHFFFAOYSA-N 385.401 5.141 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2c(F)cccc2F)CCC1 421455211 GJEQMPJIOCSYQU-AWEZNQCLSA-N 386.467 5.277 30 20 GKED C=C(C)Cn1c([C@H]2CCCS2)nnc1N1CCC[C@H]1c1ccc(OCC)cc1 424256425 VMNPNHLZLYCXQX-VQTJNVASSA-N 398.576 5.163 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F 425667396 CXOTVLFIHFZKFT-SJKOYZFVSA-N 395.812 5.218 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 437227105 JVFUBUQBCLBYHZ-NSHDSACASA-N 398.837 5.863 30 20 GKED CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CCC([C@H](F)c2ccccc2F)CC1 456045275 FRHDBCSINIOOQB-QFIPXVFZSA-N 396.481 5.215 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457740146 GQSNNOLWIRLTHG-GZMMTYOYSA-N 395.265 5.404 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458798204 HPOVWIMASSJQKC-WPYKKVEZSA-N 375.516 5.318 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)N[C@H](CCCC#N)c1ccccc1 458846674 RETLYLHSTXRCEQ-PJIZGREPSA-N 375.516 5.398 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NCC(C)(C)CC#N)cc1 459252382 BTHSYPCCXNMGIA-QGZVFWFLSA-N 379.504 5.004 30 20 GKED N#Cc1ccc(CN(Cc2cn(C3CCCC3)nc2-c2ccccn2)C2CC2)cc1 459303731 FLAQOYLMFWVYPC-UHFFFAOYSA-N 397.526 5.096 30 20 GKED C[C@@H](Cc1cccc(F)c1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 459401456 NXGAGPIJTZTSKI-JKSUJKDBSA-N 385.508 5.315 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3SCCc4sccc43)cc2)cc1 463657252 VAAROUCIJQDWIQ-HXUWFJFHSA-N 392.505 5.381 30 20 GKED O=C(CCc1cccc(C(F)(F)F)c1)Nc1ccc(F)cc1C(F)(F)F 463712956 FPZHWZCABJLOGY-UHFFFAOYSA-N 379.275 5.435 30 20 GKED CC(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 464306805 UQKVYTMNJUBRAK-KRWDZBQOSA-N 382.460 5.142 30 20 GKED N#Cc1ccc(CCC(=O)N2CCC[C@@H](Cc3csc4ccccc34)C2)cc1 466385205 BJPAGJWJTYITAZ-FQEVSTJZSA-N 388.536 5.187 30 20 GKED Cc1nc(CN2CCC[C@@H]2[C@@H](C#N)c2ccccc2)oc1-c1ccc(Cl)cc1 468281206 WPHXUFWISGDMBB-LEWJYISDSA-N 391.902 5.575 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](CCC)c1ccc(F)cc1F 468517117 QXVYZQMBCINTJG-OAQYLSRUSA-N 383.442 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1csc(Br)c1 475544599 HMCCUTIISKBFIM-UHFFFAOYSA-N 393.350 5.684 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)c3ccc(C(C)(C)C#N)cc3)ccc2C)c1 476108994 VZHBYCUOWUWAOP-UHFFFAOYSA-N 385.467 5.544 30 20 GKED C[C@@H](SCCCC(C)(C)C#N)c1nc(-c2cccc(C(F)(F)F)c2)no1 480362370 IUVWAKFQSGCIOF-GFCCVEGCSA-N 383.439 5.880 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccc(F)c(F)c1 481591170 FVVAKPDFLINPAQ-KPZWWZAWSA-N 389.833 5.636 30 20 GKED COc1cc([C@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)ccc1OC(C)C 481913356 NCOAWVSSMYGOHQ-JTSKRJEESA-N 378.516 5.472 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC[C@@H](c3ccccc3F)C2)c2ccccc21 482868891 RLLGIOCXAMZOQM-QZTJIDSGSA-N 389.474 5.150 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC(Nc2cccc(C)c2)CC1)c1ccc(F)c(F)c1 483312789 IRKUTOHLIQHUKQ-JOCHJYFZSA-N 399.485 5.177 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 483836069 DEJSOCSGYMAKQH-LPHOPBHVSA-N 394.824 5.489 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487622854 ZNCIZQHXZIAKGN-XMSQKQJNSA-N 376.500 5.180 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(SCc2ccccc2)cc1 490628662 RLFXBYWDZGVXLM-UHFFFAOYSA-N 376.481 5.128 30 20 GKED CCN(C(=O)c1cc(Cl)ccc1Br)[C@H](C)c1ccc(C#N)cc1 498140229 ATGWRYWXAWIBCE-GFCCVEGCSA-N 391.696 5.197 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(-c2ccccc2)s1 499290443 SWCIXZRIOGYSMD-AWEZNQCLSA-N 375.478 5.218 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccccc3OC3CCCC3)CC2)cc1 503492311 VVWHBEASVWRWMJ-UHFFFAOYSA-N 387.483 5.201 30 20 GKED Cc1oc(C2CC2)nc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 506480421 JJNWYZOMVMIGDM-GOSISDBHSA-N 391.858 5.422 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 520179005 KGMRYGTUFLFBIL-INIZCTEOSA-N 387.439 5.242 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 520978596 LBGCLUQLDPXGGQ-UHFFFAOYSA-N 392.846 5.170 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCc2c(Cl)cccc21 521257043 BJHMBJMKEQLFLG-SUMWQHHRSA-N 385.920 5.401 30 20 GKED N#Cc1cccc(COc2cccc(CNC3(c4cccc(Cl)c4)CC3)c2)c1 524882658 DORJBPUSJJKMDR-UHFFFAOYSA-N 388.898 5.570 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 525006070 DABZERVNYXJBSP-IAGOWNOFSA-N 396.462 5.411 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 531444292 KOHHAKVKNLGJBG-BWAGFHJFSA-N 391.515 5.016 30 20 GKED N#CCc1ccnc(NC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)c1 532433513 HASMJDYNAHWEOH-UHFFFAOYSA-N 399.347 5.225 30 20 GKED CCCC(=O)Nc1cccc(NCc2cccc(OCc3ccccc3C#N)c2)c1 533210421 FCDCLNZVJAIWMS-UHFFFAOYSA-N 399.494 5.488 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)C[C@@H](CC#N)c1ccccc1 553219800 MRYLQPJXPQMTBI-UZKOGDIHSA-N 376.500 5.082 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C1CCC(F)(F)CC1 564718724 QNKSTSDWATZZDC-UHFFFAOYSA-N 399.441 5.701 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NCC(C)(C)CCC#N)(C4)C2)C3)cc1 588783931 LYODFGRFORDHAX-JSZXIJHASA-N 378.560 5.279 30 20 GKED CCCN(C(=O)CCCCCC#N)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 588934205 RGPWTADEMKQEPP-HSZRJFAPSA-N 381.495 5.331 30 20 GKED N#Cc1ccc(CNCc2ccnc(Oc3ccccc3)c2)c(C(F)(F)F)c1 589308755 RSEXXJLFDLTOCP-UHFFFAOYSA-N 383.373 5.054 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@H]1CCCOC1 593143692 MIMDYGSQMAPVBS-ICSRJNTNSA-N 397.906 5.028 30 20 GKED N#CC1(CCS(=O)(=O)Cc2ccc(Cl)c(C(F)(F)F)c2)CCCCC1 594686037 MVZPRBVLUMLGRF-UHFFFAOYSA-N 393.858 5.138 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C[C@H](C)C1(F)F 599736045 BUUYQDDDXKESOR-GJZGRUSLSA-N 385.414 5.106 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3sc(C)c(C)c3C#N)sc2C)cc1 603445128 MWFZBTDHODOXSE-UHFFFAOYSA-N 382.510 5.534 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccccc1 608994756 SWINNXPKTQHILB-KRWDZBQOSA-N 386.455 5.013 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc(C(F)(F)F)cc3)o2)cc1 609054516 SZTLWGOFLMDUQE-UHFFFAOYSA-N 386.329 5.001 30 20 GKED Cc1ccc(CCCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 609434866 VZHDVABJDAKKLH-SFHVURJKSA-N 381.545 5.452 30 20 GKED C[C@H](N[C@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1)c1cccc(C#N)c1 610914553 DLPGQJKGCTUWNC-FVJLSDCUSA-N 382.479 5.057 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc(-c2ccccc2)cs1 613392500 QGZKZSHVMNSUHP-MRXNPFEDSA-N 388.423 5.699 30 20 GKED C=CCn1c(SCC(=O)C2CCCCC2)nnc1-c1ccc(Cl)cc1 648195463 BKVXYVBSMGILJM-UHFFFAOYSA-N 375.925 5.026 30 20 GKED O=C(CCCc1ccc(F)cc1)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 653565359 HYTGWIRKKJYQEW-STQMWFEESA-N 399.350 5.174 30 20 GKED FC(F)(F)Oc1ccccc1CN1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 678207805 DRXFKFUTXJJHGP-QWRGUYRKSA-N 395.265 5.148 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 726753728 QVXDHGAYKRKFGP-FQEVSTJZSA-N 389.524 5.277 30 20 GKED CC(C)(C)c1ccc(CCCC(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)cc1 727627720 PQPUGSFPHUVCRJ-SFHVURJKSA-N 396.918 5.308 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 728484957 QFGFZVFGOPZXMI-UHFFFAOYSA-N 380.806 5.301 30 20 GKED Cc1ccc2c(c1)[C@H](NC(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 730130686 GYHVCRBQQMCETP-BJKOFHAPSA-N 381.479 5.460 30 20 GKED C/C(=C/C(=O)Nc1ccccc1SCCC#N)c1ccc(C(F)(F)F)cc1 730982545 SYXXBMDPKWONEL-YPKPFQOOSA-N 390.430 5.753 30 20 GKED CCCN(C(=O)/C=C\c1ccccc1C#N)[C@H](c1ccc(F)cc1)c1cccnc1 732085539 LJPMAGPLRPEQOD-GPFJBENQSA-N 399.469 5.134 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3nc4ccccc4o3)sc2c1 732708225 OTLNIEMLRFEZOA-CQSZACIVSA-N 394.883 6.309 30 20 GKED CC(=NNc1cnnc2ccccc12)c1sc(-c2ccc(Cl)cc2)nc1C 733749826 ATYKWFGWBCQOMD-UHFFFAOYSA-N 393.903 5.551 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(CCc2ccc(C)cc2)CC1)c1ccncc1 734679258 LGCKSNYGWFCMNH-HSZRJFAPSA-N 377.532 5.062 30 20 GKED Cc1ccccc1-c1cnc(CSCc2cc(Cl)ccc2OCC#N)o1 742970820 KEAUPUZEXUKTTR-UHFFFAOYSA-N 384.888 5.639 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2ccc(Cl)c(Cl)c2)n1 747197941 OZYTXAXFADYART-CYBMUJFWSA-N 381.328 5.772 30 20 GKED C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1ccc(C#N)cc1 748683832 FEAQPANERUZXTN-NSHDSACASA-N 388.901 5.244 30 20 GKED C=CCC[C@@H](NC(=O)c1ccccc1OCC#N)c1ccc(C(F)(F)F)cc1 749945343 XOBFMEJRZYNUNA-GOSISDBHSA-N 388.389 5.045 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c2ccc(Cl)s2)cc1 750683824 IPULSONCIQDUID-BBRMVZONSA-N 388.920 5.195 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCc3cc(Cl)cc(Cl)c32)c1 772986772 YNZALFYQMXYJQR-QFBILLFUSA-N 375.299 5.451 30 20 GKED C[C@H](NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)c(F)c1 776741161 CKLXWWNMPQKEHO-JKSUJKDBSA-N 397.494 5.134 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 777015423 WVINALIPVQJGJI-UHFFFAOYSA-N 378.378 5.004 30 20 GKED C[C@@H](CNC(=O)c1ccccc1Oc1ccccc1C#N)c1nc2ccccc2o1 778024486 CPLIYFNTBFKOMW-INIZCTEOSA-N 397.434 5.025 30 20 GKED Cc1cnc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)c1 779845994 SFMLZUFFQPVERV-LJQANCHMSA-N 375.859 5.260 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC(C)(c1ccccc1)c1ccccc1 780668373 VHMKVYDRLZIGSG-GOSISDBHSA-N 385.467 5.063 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OC)cc2OCc2ccccc2)c1 783951852 WXUMMHIYGWDFCQ-UHFFFAOYSA-N 388.492 5.064 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cn1 792886718 XIMFPXZJAVMHRL-WDZFZDKYSA-N 393.446 5.110 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(Cl)cc3)o2)cc1 792926079 VLLORFABOKUMPR-ACCUITESSA-N 379.843 5.198 30 20 GKED N#CCOc1ccc(C(=O)/C=C/c2ccc(OCc3cccc(F)c3)cc2)cc1 797095720 ZCFZRHSGWTYSOD-AWNIVKPZSA-N 387.410 5.203 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797568905 XTAULKQKAWMIAW-KRWDZBQOSA-N 384.545 5.483 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C[C@H]3CCC(F)(F)C3)c2)cc1 797832490 BHLDWEAZUGZBOD-QGZVFWFLSA-N 384.426 5.096 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3ccccc3SCC#N)sc2C)s1 798954409 XGOXEPQBMWDUOA-UHFFFAOYSA-N 385.539 5.356 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2csc(-c3cccs3)n2)C(=O)c2ccccc21 802707121 FVAZVPOIESTFOY-JIIJFUIFSA-N 395.505 5.188 30 20 GKED N#CC1(CSc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)CCCC1 806583799 KWVNLRFKKPYMRW-UHFFFAOYSA-N 395.919 5.159 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1csc(-c2ccccc2F)n1 812244425 KGEROTJXHRTGIK-AATRIKPKSA-N 384.379 5.321 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)Nc1nc(Cl)c(C#N)s1 813369776 DYGDAHFDJUCYNP-UHFFFAOYSA-N 389.889 5.048 30 20 GKED Cc1cc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)ccc1NC(=O)OC(C)(C)C 825959347 IFWHPHAAKKEZBQ-HNNXBMFYSA-N 394.475 5.096 30 20 GKED C=CCC1(C(=O)N2CCC(c3nccc(-c4cccc(F)c4)n3)CC2)CCCC1 856528776 WBXBSAZXIUQSFP-UHFFFAOYSA-N 393.506 5.125 30 20 GKED COc1ccc(Cl)cc1CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 915100391 PSILYKLPYVBXGB-KRWDZBQOSA-N 396.899 5.200 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccccc2Cl)cc1 916912956 KTAOUZXBWHRNAZ-FIIODCPWSA-N 380.875 5.043 30 20 GKED C#Cc1cccc(NC(=O)[C@@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)c1 920022190 AEIUYSHOMVATPI-CQSZACIVSA-N 396.899 5.237 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)/C=C/c1ccc(C(C)(C)C)cc1 920106474 PJRBLMUMAFKLSJ-RDPWEWGOSA-N 384.479 5.379 30 20 GKED C=C(Br)CNC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 921042516 ITKRSLMDXCKVIA-UHFFFAOYSA-N 398.631 5.212 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3cc(F)cc(Cl)c3)c2)c1 1776091522 SARPPWAKMYCBFW-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2cccs2)cc1 1776354612 PBCIHYRTNLTSOC-XFFZJAGNSA-N 392.476 5.797 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(C3CCCCC3)cc2)c1)C(=O)O 1776471531 YNLOXJMAAQVKJT-VMEIHUARSA-N 378.468 5.482 30 20 GKED C[C@H](Sc1ccc2ccccc2c1)C(=O)N(CCC#N)c1ccc(F)cc1 22249806 XFBKPWNTJZHZRH-INIZCTEOSA-N 378.472 5.406 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)oc2c(C)cccc12 66544576 WPQPCNPTJIPIIX-SFHVURJKSA-N 397.459 5.535 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2c(C(C)C)cccc2C(C)C)c1 113998782 YSWRGUXHESJYLH-LJQANCHMSA-N 393.531 5.936 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(COCc2ccco2)c1)c1ccccc1 119015545 GWJVZUXTYNZFTH-QFIPXVFZSA-N 389.455 5.163 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](COCc2ccccc2)c2ccccc2)cc1 123902512 SCRAQVLUKDQIDB-NLFFAJNJSA-N 386.495 5.025 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccc(Cl)cn1 134726266 HXWFDRGJNZLZPO-UHFFFAOYSA-N 398.249 5.329 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(-c4ccncc4)s3)cc2)cc1 172805960 MEMSSZZQKAWINT-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(NC(=O)Nc4ccccc4)cc3)cc2)CC1 182632475 LMCFFVCBBITGMS-UHFFFAOYSA-N 396.450 5.138 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(OC2CCCC2)c(F)c1 184043998 SUBJNAKBSJYZPA-AWEZNQCLSA-N 383.423 5.082 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(-c2nc(C)cs2)c1 189889557 KFROLSCCZJFMNJ-UHFFFAOYSA-N 376.525 6.223 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1c2ccccc2CCN1C(C)=O 189904126 QADJKLCMJPXXFW-HSZRJFAPSA-N 390.527 5.013 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1ccc2c(c1)Nc1ccccc1S2 254836379 JZGOBJGQFXAMSR-UHFFFAOYSA-N 375.453 5.429 30 20 GKED C[C@H](ON=Cc1ccccc1F)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 255337790 COTHTGAPBVFTLL-JTQLQIEISA-N 380.206 5.294 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC=C(c2ccc(F)cc2)CC1 302841326 DGKZASOGBVSFQX-UHFFFAOYSA-N 382.438 5.294 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc(Cl)c(Cl)c2)c1 303141581 MDMCWZJIIGCYLY-UHFFFAOYSA-N 387.222 5.289 30 20 GKED COc1ccc(C(=O)N2CCCC2)cc1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 328983965 FWCZCAAEYYZYGU-NZSAHSFTSA-N 384.520 5.126 30 20 GKED OC1=Nc2cc(F)ccc2[C@H](/C(O)=N/C2[C@H]3CC[C@H]2Cc2ccccc2C3)C1 329444162 KODHNSFOCGRKAT-TXPKVOOTSA-N 378.447 5.051 30 20 GKED Cc1nc2ccc(N=C(O)N3CCCCC[C@@H]3c3noc(C(C)C)n3)cc2s1 329585963 YHUSIRDPAJJSOE-MRXNPFEDSA-N 399.520 5.274 30 20 GKED Cc1nc(-c2ccc(N=C(O)c3cnn(C4CCCCC4)c3C)cc2Cl)n[nH]1 329696887 DRWMSLINROCUJF-UHFFFAOYSA-N 398.898 5.080 30 20 GKED Cc1cc(C)n(-c2ccc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)cc2F)n1 330027357 MYYZJIDHSQKVGH-UHFFFAOYSA-N 398.482 5.142 30 20 GKED Cc1c(C(=O)Nc2cccc(OCCCC#N)c2)sc2ccc(C#N)cc12 428128155 AFVIKYGMAAUSJN-UHFFFAOYSA-N 375.453 5.016 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 438606817 JPDDTDRFNFKGTA-GOSISDBHSA-N 376.378 5.057 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 438636365 YJISSOPSUGUYBM-UHFFFAOYSA-N 395.478 5.461 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)[C@@H](C#N)c3nc(C)cs3)c2)c1 442601012 SCWBYJJWXWTHTA-LJQANCHMSA-N 392.549 5.851 30 20 GKED C[C@H](c1ccccc1)N(Cc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1 442890830 AYUHVIHSKVJSTA-GOSISDBHSA-N 380.451 5.376 30 20 GKED C=CCCCCNC(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 446204204 CNAHLMMXGXURLN-QGZVFWFLSA-N 399.560 5.064 30 20 GKED CC[C@H](N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1 447546244 UIFGLAKCCBZBBN-URXFXBBRSA-N 380.495 5.275 30 20 GKED C[C@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccc(CC#N)cc2Cl)C1 452646339 QCTUFYHWXMTRTK-FUHWJXTLSA-N 376.928 5.500 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCCc2c(N(C)C(=O)[C@H](C)CC(=C)C)cccc21 466273904 NYEPDDLUMXLJMF-MOPGFXCFSA-N 382.548 5.133 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(-c2ccccc2)o1 468948798 JVSUOUVZEJBSAY-GOSISDBHSA-N 399.494 5.703 30 20 GKED COc1cc([C@@H](C)NC(=O)c2ccc(C(C)(C)C#N)cc2)ccc1OCC(C)C 474776365 OXOXBMBYAPDGFO-QGZVFWFLSA-N 394.515 5.022 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc2cccc(Cl)c2n1C 475565141 OLOKSJOQRHDZPK-UHFFFAOYSA-N 396.922 5.400 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2Cl)cc1 479815824 QLNGBHVLUXQCOK-CYBMUJFWSA-N 376.790 5.378 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2ccco2)C1 481210582 WFSHZFWKJJFXHH-MLGOLLRUSA-N 377.366 5.175 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3scnc3-c3ccccc3)c2)cc1 483495921 ODZZCSKOQKZOIX-UHFFFAOYSA-N 397.459 5.726 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)[C@@H](OC)c1ccc(Cl)cc1 486236261 XFKHTQFACIZFPH-IFXJQAMLSA-N 375.921 5.124 30 20 GKED N#Cc1cc(NC(=O)c2cncnc2-c2ccccc2)ccc1Oc1ccccc1 494006641 KLSFHRLTVPMBOG-UHFFFAOYSA-N 392.418 5.060 30 20 GKED C=CCc1cc(CNCc2ccccc2Oc2ccccc2)cc(OC)c1O 500107543 CRANIMODSXWLAC-UHFFFAOYSA-N 375.468 5.211 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)[C@H]3CCCC(F)(F)C3)c2)cc1 500871699 BRXXHDSMSWGFRM-SFHVURJKSA-N 384.426 5.096 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)c2cc(C#N)ccc2Cl)cc1 505149282 SDAWWDIOLUXSAF-UHFFFAOYSA-N 392.842 5.655 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 507171016 RPGQLBLFCVXUNW-UHFFFAOYSA-N 392.484 5.001 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)NCC1CCC(C#N)CC1 508364181 ULNAILKCDQEUAF-UHFFFAOYSA-N 392.286 5.017 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@@H]3CC[C@H](C(F)(F)F)C3)cc2)c1 510843902 YCWIREMOJOVWFT-SJORKVTESA-N 388.389 5.054 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)c1 512492118 NXINIONXUBOWKX-UHFFFAOYSA-N 399.837 5.804 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1CC(c2ccccc2)C1 514588747 VWZNNDHYEMIVPE-LRYGQEGESA-N 379.529 5.254 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCCC2 514869529 FNFDJCZSSUTZEB-LLVKDONJSA-N 376.934 5.271 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)o2)c(C)c1 515089386 FUHXVFMGHRQIKZ-SFHVURJKSA-N 399.450 5.150 30 20 GKED CCCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 518739645 JKFGJXDIOIHQSJ-IRXDYDNUSA-N 375.472 5.548 30 20 GKED CCC(CC)SCC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccc(F)cc1 519964045 OYYVIWOQEQUSSP-UHFFFAOYSA-N 387.524 5.024 30 20 GKED C[C@@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)c1ccc(C#N)cc1 520381761 GEMZWVZCKYBHAL-CYBMUJFWSA-N 396.903 5.142 30 20 GKED CC[C@H](C)n1c(SCc2cn3ccccc3c2C#N)nnc1-c1ccccc1 523353564 HDKOSDXMFXQWGP-INIZCTEOSA-N 387.512 5.333 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C 525348823 PROIUZFSSNNFOB-LJQANCHMSA-N 385.552 5.220 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F 525559393 OYUQVXAYPPIVEE-CVEARBPZSA-N 380.419 5.307 30 20 GKED CC1(C)[C@@H](c2ccc(F)cc2)CCN1C(=O)Nc1ccc(CC#N)cc1Cl 529110193 XSJVCXUNHZLBEA-QGZVFWFLSA-N 385.870 5.345 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2cccc(C#Cc3ccccn3)c2)c1C1CC1 534964316 JWCSEYCLDIXHKN-KRWDZBQOSA-N 399.498 5.170 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OC)c(-c2ccccn2)c1 535848385 UJRVSERTJBBWLM-UHFFFAOYSA-N 398.915 5.301 30 20 GKED N#CCC[C@@H](NC(=O)NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1 539177467 HFWMLAFCUWYWQX-XMMPIXPASA-N 394.478 5.070 30 20 GKED C=CCN(C(=O)c1cc(C)n(C(CC)CC)n1)c1nc(-c2ccccc2)cs1 539565733 IXQJVHYEGMGCGU-UHFFFAOYSA-N 394.544 5.509 30 20 GKED Cc1csc([C@H](C)NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542021050 YABAOWDWUGLJDS-CVEARBPZSA-N 390.512 5.112 30 20 GKED N#CCCC[C@@H](NCc1csc(-c2ccc(Cl)cc2)n1)c1ccccc1 552083673 TUFQEIQVRQDCOE-HXUWFJFHSA-N 381.932 5.988 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2oc(C(C)C)nc2c1 562210813 WAAFKGDTTPFWAR-UHFFFAOYSA-N 395.507 5.339 30 20 GKED N#Cc1ccc(CNCC2(CCOCc3ccccc3)CC2)c(C(F)(F)F)c1 574964617 NRJXWSVXMNRBOM-UHFFFAOYSA-N 388.433 5.054 30 20 GKED C[C@@H](Oc1ccccc1C#N)c1nc(C2(c3cccc(C(F)(F)F)c3)CC2)no1 575367189 XQVYKGPNPVQAAI-CYBMUJFWSA-N 399.372 5.180 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)c1 589739086 HPSYJNFKVYONPV-OFNKIYASSA-N 394.515 5.273 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cn2)c1 590112178 DHMSQFYYHHZNOA-UHFFFAOYSA-N 399.450 5.127 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 597180743 UIHYNEIKABYCCA-AYBZRNKSSA-N 380.513 5.079 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@H]21 599736847 IPAWKXLEOAIFGS-OXUBRWNRSA-N 397.931 5.052 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603691950 ZKRACNOCWQWDHA-JOCHJYFZSA-N 398.466 5.423 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1N1CCC(OCc2ccccc2)CC1 603845306 FZEMDZUZHQXHEH-UHFFFAOYSA-N 395.865 5.085 30 20 GKED CCCN(CC1CCCCC1)C(=O)c1ccc(COc2ccccc2C#N)o1 604202357 TZRWDTKDQHCNKI-UHFFFAOYSA-N 380.488 5.163 30 20 GKED C[C@@H](CC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(C(F)(F)F)cc1 609067236 ZBHZUMKELWBPSE-NSHDSACASA-N 398.331 5.311 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@H](C)C#N 609402893 GUVYQVJFNRNYCN-QGZVFWFLSA-N 399.535 5.768 30 20 GKED Cc1nc(-c2ccccc2)c(NC(=O)CCCCOc2cccc(C#N)c2)s1 609504109 VZYYRAOPZGRSFX-UHFFFAOYSA-N 391.496 5.178 30 20 GKED C[C@H](NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F)c1ccc(C#N)cc1 610138591 NWZMVMJFCMTXFL-SBUREZEXSA-N 387.458 5.042 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 610319793 KDWYVWHUNQNJDT-QFIPXVFZSA-N 378.476 5.180 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1cc2cccc(OCC)c2o1 612199104 PKBIUYKJRXGFCA-OAHLLOKOSA-N 384.501 5.352 30 20 GKED FC(F)(F)c1cccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 618451052 OVILIFCPHONVPR-TXEJJXNPSA-N 379.266 5.268 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)N(Cc1cccs1)Cc1cccs1 618840764 KZGYPHDRKBLZQC-FQEVSTJZSA-N 393.537 5.081 30 20 GKED Cc1csc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 624005296 MDRJGAXADIPUTM-VIFPVBQESA-N 386.336 5.914 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 661115685 DLJPTXPDOVIMKR-FPOVZHCZSA-N 397.588 5.669 30 20 GKED Cc1nc(-c2ccc(CNC(=S)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 726452106 HLAWQOKDHHDLOT-UHFFFAOYSA-N 398.944 5.130 30 20 GKED C[C@H](OC(=O)CSCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 728326532 AFIVTNJXQBVNAD-ZDUSSCGKSA-N 379.403 5.115 30 20 GKED C#Cc1ccc(C(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)nc1 728797106 CQTOWGAAXCTMRG-UHFFFAOYSA-N 389.867 5.305 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Br)ccc2c1Cl)c1ccccn1 729888491 GJLSKEUYFDXLBS-NSHDSACASA-N 391.677 5.202 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1ccccc1S[C@@H](C)CC#N 731332731 QUIJGYOPLWRBSW-BFRYPLHYSA-N 394.540 5.910 30 20 GKED CC(C)Oc1ccccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 733621268 IQNPYLNLQXIYTD-NRFANRHFSA-N 385.467 5.773 30 20 GKED CCOc1cc(/C=C/C(=O)c2sccc2C)cc(Br)c1OC 733749057 BIBQFAORODQITC-AATRIKPKSA-N 381.291 5.122 30 20 GKED C[C@H]1c2ccc(F)cc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738894462 FMBJHUHYAMTSOA-XDHUDOTRSA-N 399.469 5.632 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(C)cc1 739155708 SWZUNJYFSKGHCO-PGRDOPGGSA-N 384.479 5.380 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3ccccc3)[nH]2)ccc1SC(F)F 742432764 HFQGDHWUSVUNPZ-HJWRWDBZSA-N 386.423 5.296 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cncc(-c3ccccc3)c2)cc1 757875081 NGHWSPWHKNBMAS-SBUREZEXSA-N 397.478 5.223 30 20 GKED C#CCCCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 757915496 KHPBZUWOHBAOKC-APWZRJJASA-N 390.914 5.660 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCO1 763931905 RULUYTOGQWFPNE-FKBYEOEOSA-N 391.515 5.057 30 20 GKED C=C(C)C[C@H](C)C(=O)O[C@@H](C)C(=O)N1c2ccccc2Sc2ccccc21 767697856 WRJYGFYWRRRXNO-HOTGVXAUSA-N 381.497 5.350 30 20 GKED C=CCC[C@H](NC(=O)c1ccoc1COc1ccc(C=O)cc1)c1ccccc1 772735509 LIFZFUXJPPDPKX-QFIPXVFZSA-N 389.451 5.108 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC(c2cccc3ccccc23)CC1 780669725 LYVSQRFXWYRKBB-GOSISDBHSA-N 399.494 5.542 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 782727985 JVVXWAXITVQFSL-KOSHJBKYSA-N 396.494 5.298 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)CCc2c(Br)cccc21 782889796 MUKXTKFQRPXQJD-ZRDIBKRKSA-N 397.297 5.180 30 20 GKED N#Cc1ccc(CN[C@@H](CCSc2ccc(F)cc2)c2ccc(F)cc2)nc1 783292866 CSJSQRXIEMUIJE-QFIPXVFZSA-N 395.478 5.245 30 20 GKED CC(=NNc1ncnc(Cl)c1C(C)C)c1sc2nc(C)nc(C)c2c1C 797404791 UCDDSAFSUOLQTJ-UHFFFAOYSA-N 388.928 5.019 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797568091 FFXFJQMWAYRLOU-IUODEOHRSA-N 394.462 5.514 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CC2(CSc3ccccc3)CC2)s1 797571408 OQJKFTVXTDVVTO-INIZCTEOSA-N 384.570 5.579 30 20 GKED C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797573731 VKQBGDMFMYHHOJ-WFASDCNBSA-N 388.920 5.179 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Oc2nc(Cl)c(C#N)s2)c(Cl)c1 804649143 SYGKPLMEAJHVEC-UHFFFAOYSA-N 386.260 5.461 30 20 GKED CC(C)(c1noc(Cc2cccc(OCC#N)c2)n1)c1cccc2ccccc12 815702867 LOJBJXOBTHVTTG-UHFFFAOYSA-N 383.451 5.042 30 20 GKED CC(C)c1nn(C)c(Cl)c1C=NNc1ccc(Cl)c(C(F)(F)F)c1 844607328 VGKVHGWEFIAOIF-UHFFFAOYSA-N 379.213 5.315 30 20 GKED N#CC[C@H](CC(=O)N1CCC(c2ccnc3ccccc23)CC1)c1ccccc1 854758371 OTEGBCCLJQKKFD-OAQYLSRUSA-N 383.495 5.028 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C\c2csc(C(F)(F)F)c2)s1 860732822 OSAIXTPDSNQHSB-WYGGZMRJSA-N 384.448 5.411 30 20 GKED N#Cc1ccccc1/C=C/C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1 914896086 SFDFFFZUAGQNAR-FOCLMDBBSA-N 392.458 5.015 30 20 GKED Cc1ccc(OCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 915085332 KXTFMRPFMKPTOL-HSZRJFAPSA-N 384.479 5.367 30 20 GKED COc1ccc(/C=C\C(=O)c2sccc2Br)cc1OC(F)F 915112652 GSIZXLVCHLRFNS-RQOWECAXSA-N 389.217 5.017 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351825 HASYSASJMAMFHQ-VWLOTQADSA-N 397.522 6.095 30 20 GKED COc1ccc(C(C)=NNc2cccc3ncccc23)cc1CN1CCCCC1 915964841 QUALASOCORZYRC-UHFFFAOYSA-N 388.515 5.065 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)on1 916680931 MVMKFBPHSBAXSU-RTWAWAEBSA-N 386.455 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(CC2CCCCC2)C2CC2)cc1 918034858 XRURDBGIEMFTQZ-DEOSSOPVSA-N 387.527 5.919 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(-c2ccccc2Br)cc1 1776030518 JHRYBGGKKZRYNG-UHFFFAOYSA-N 395.256 5.260 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(-c2ccc(F)cc2)s1 1776049780 BSTXHYRRFXPCEO-UHFFFAOYSA-N 384.432 5.097 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(CC(C)C)c1cccc(C(F)(F)F)c1 1776050057 SYVGVQKWEBHEIS-UHFFFAOYSA-N 394.393 5.275 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 1776782763 GNOIBKGBBOGCFR-KRWDZBQOSA-N 388.464 5.148 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776950886 FHVUMBBTFWZXQP-ZRDIBKRKSA-N 394.517 6.121 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4cccc(CC(=O)O)c4)cc3)coc12 1777449034 GWFXGNRBYGVWBN-JLHYYAGUSA-N 396.442 5.931 30 20 GKED Cc1ccccc1-c1cccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)c1 1777461749 NQJWVICQHNKXFX-RCCKNPSSSA-N 382.459 5.963 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786612473 FGTKYPUZVOEZSK-UWJYYQICSA-N 394.490 5.044 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)n1 41516613 VSDPYEASFZKLRS-SFHVURJKSA-N 385.448 5.264 30 20 GKED C=CCOc1cccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c1 65749463 HFCVECNKTHKSCU-UHFFFAOYSA-N 382.847 5.131 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)c1 66463644 GMURFAVJCAIXEV-UHFFFAOYSA-N 390.439 5.048 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 97169164 FYWICMMIQBELNB-PMACEKPBSA-N 386.417 5.118 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccccc3)n2)cc1 108979196 PMVHGOZDOQPPJA-LJQANCHMSA-N 376.481 5.018 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(Oc3cccnc3)c(C)c2)c1 113960719 FTEHTOVVRQSNOJ-NRFANRHFSA-N 387.483 5.153 30 20 GKED CCCN(Cc1ccccc1O)C(=O)Nc1ccccc1S[C@H](C)CC#N 118822046 FOYHSJQYGLOHTM-MRXNPFEDSA-N 383.517 5.231 30 20 GKED CCOCCC1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCCC1 121853267 RZYVNNGQJNGHHF-AWEZNQCLSA-N 376.909 5.113 30 20 GKED Cc1ccc(Br)c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 129639770 KXUVAHIHOORQPN-VQIMIIECSA-N 398.304 5.061 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)CCc1ccc(C#N)cc1 153074589 LOGZXRWSVFHVFG-KRWDZBQOSA-N 389.524 5.142 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)NCc3cccc(C#N)c3)cc2c1 153787830 GIAPEMBPKYZPIG-UHFFFAOYSA-N 399.450 5.118 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(Cc1cccnc1)C1CC1 170876258 IYFXAZKORCGHDC-UHFFFAOYSA-N 398.466 5.251 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2ccc(OC)c(OC)c2)c1 171274494 HHKPLIUMVTVYMA-FQEVSTJZSA-N 396.487 5.028 30 20 GKED COc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 173123773 NBFUQCRIWYRNQS-IAGOWNOFSA-N 397.544 5.184 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1ccc(C(F)(F)F)cc1Cl 180249186 CJDYUFCQRKKVRP-GOSISDBHSA-N 380.797 5.004 30 20 GKED COc1ccccc1-c1nnc(S[C@@H](C)CCC#N)n1-c1ccc(C)cc1 188248586 FGOORQRYNHJTMA-INIZCTEOSA-N 378.501 5.036 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccnc2C(F)(F)F)cc1 188360634 PEQDVMYYZLEIOZ-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1S[C@H](C)CC#N 189966487 APSWCOAHLXIWGO-MRXNPFEDSA-N 392.528 5.616 30 20 GKED Cc1ccccc1/C(O)=N/C1CCN(/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1 328806805 IBKLIEQEDXFOIG-QKNQBKEWSA-N 397.563 5.037 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CC[C@H](c2ccc(F)cc2)C1 329044984 FLVCBWMLFJTBEI-LZLYRXPVSA-N 388.508 5.126 30 20 GKED O/C(=N\C1CCC(/C(O)=N\C[C@@H]2CCC3(CCCCC3)O2)CC1)C1CCCC1 330145854 LGTMTZWMFYYRBO-MHJFOBGBSA-N 390.568 5.530 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)CCc1c[nH]c2ccccc12 425091909 YNBLWOALNMDHHB-OAHLLOKOSA-N 399.416 5.060 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4nc(C)sc4c3)n2)cc1 433108078 FLFBAHJXRBXEQF-MRXNPFEDSA-N 389.505 5.527 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(Oc2nccc(C)n2)cc1)c1ccccc1 435595188 UNWRIEHHBPMYGU-OAQYLSRUSA-N 388.471 5.406 30 20 GKED CCCCCN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)C 437741528 CXDJVUHKWGVAIK-UHFFFAOYSA-N 393.531 5.764 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)CCC[C@H]1C 437835601 GUSLZQFONDCYPM-SJLPKXTDSA-N 377.488 5.701 30 20 GKED Cc1ccsc1CNC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438661816 ATTUWPUZNOHYRY-UHFFFAOYSA-N 381.432 5.181 30 20 GKED C[C@@H](SCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 443156946 PRUROISOMHDTNA-LLVKDONJSA-N 390.295 5.909 30 20 GKED N#CCCCNC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 444994331 KBFSLXNMGKNAMP-UHFFFAOYSA-N 386.864 5.167 30 20 GKED Cc1ccc(NCC(C)(C)CCC#N)cc1Oc1ncccc1Br 448368297 VCKZOJXHJXLSLQ-UHFFFAOYSA-N 388.309 5.687 30 20 GKED C=CCC[C@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(C(F)(F)F)cc1 450686525 UVTAYTHBRWSBSJ-INIZCTEOSA-N 391.359 5.261 30 20 GKED N#CCc1ccc(NC(=O)CCCc2ccc(Br)s2)c(Cl)c1 452643046 IWATYBVCXDJDHA-UHFFFAOYSA-N 397.725 5.191 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 458540364 WIOYHDNMTZPMNG-JQHSSLGASA-N 381.442 5.089 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2cccc(Cl)c2C1 459405754 UBUNSAYKBSWFBE-AWEZNQCLSA-N 385.920 5.182 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)cc1 460338596 JIAZDGBCWUACQK-UHFFFAOYSA-N 388.854 5.261 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC3(CCCCC3)C2)cc1 460643006 YQIUZHKPNPOBHI-UHFFFAOYSA-N 378.447 5.286 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(F)c3Cl)cc2)c1 463478675 OTZJUVLEXRYGDH-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 463744235 IIIVSASDXAXJJJ-SJCJKPOMSA-N 379.262 5.082 30 20 GKED C[C@H](NC(=O)Nc1cc(C#N)cn1C(C)(C)C)c1ccc(-c2ccncc2)cc1 467770071 JTTBKFALMOXTJE-INIZCTEOSA-N 387.487 5.059 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)c(Cl)c1 471904701 GKOSKHIWSAKUAD-OLZOCXBDSA-N 393.339 6.130 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2csc(-c3ccc(Cl)s3)n2)n1 474434937 AICVETXRVKACMR-SECBINFHSA-N 393.946 5.595 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2-c2csc(C)n2)cc(OC)c1OC 477677302 SEMCPPOWKDHGHD-UHFFFAOYSA-N 394.496 5.117 30 20 GKED N#CCc1ccc(NC(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)cc1 480270289 XRDYBHFLRSCTHS-ZEQRLZLVSA-N 382.463 5.074 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(c4ccccc4)CC3)cc2)cc1 480380614 RJSQUXVAJMTTTC-UHFFFAOYSA-N 397.478 5.762 30 20 GKED C=CCn1c(SCc2nc(C)c(C)s2)nnc1-c1cccc(Cl)c1 481394380 VNDALTSWEAUMMW-UHFFFAOYSA-N 376.938 5.150 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cccc(C(=O)N(CCC)CCC)c1 482852688 ULOAXODBBXKNAN-UHFFFAOYSA-N 384.564 5.157 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cccc(OCc2c(C)noc2C)c1 482911623 RVXMTYGGUMVMKG-UHFFFAOYSA-N 382.504 5.079 30 20 GKED CC(C)CN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482935321 UNNMZJNLMSOXRX-UHFFFAOYSA-N 376.378 5.011 30 20 GKED C=CCN(CC1CCCCC1)C(=O)NCc1ccc(COCC(F)(F)F)cc1 483885141 MSVIYSKQHNKOAH-UHFFFAOYSA-N 398.469 5.043 30 20 GKED Cc1csc(Nc2ccc(C(=O)N[C@H](CCCC#N)c3ccccc3)cc2)n1 487239568 JKNANNYLGVWLTH-HXUWFJFHSA-N 390.512 5.360 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 487776615 MMTGVNFAADWDMR-IBGZPJMESA-N 384.863 5.274 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)oc12 488181526 NRPJOQXNGMWCBD-CYBMUJFWSA-N 394.402 5.633 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 490251966 TZDGUSGWIIJXPU-PGRDOPGGSA-N 395.572 6.250 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc(F)cc1OCC(F)(F)F 494778152 FTDYVCVAFRFHSE-VIFPVBQESA-N 390.299 5.009 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 500084276 PTASVMRDAQVJHJ-AZUAARDMSA-N 395.478 5.307 30 20 GKED N#C[C@H](C(=O)c1nccc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 503504918 XHZANAMKTITXFA-QGZVFWFLSA-N 389.867 5.502 30 20 GKED CCc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 513941364 BBATWCGYFRFIMV-UHFFFAOYSA-N 387.458 5.494 30 20 GKED C[C@H](Oc1ccccc1C#N)c1nc(-c2ccccc2OCc2ccccc2)no1 517630540 IDRPKSLVCMTGBY-KRWDZBQOSA-N 397.434 5.327 30 20 GKED Cc1ccc(SCCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520195575 DLLGXLBECHWSMR-MRXNPFEDSA-N 385.558 5.303 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cc(F)ccc3Cl)c2)cc1 522313723 XHVUTRADMGGCFH-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H]1CCCC[C@@H]1C 524442601 SYTSHAGQBOAJNR-GAJHUEQPSA-N 391.515 5.488 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccnc1-c1ccccc1 535110631 ITZRUZPKOQWEKO-IRLDBZIGSA-N 382.467 5.052 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(C#N)c(F)c2)cn1 539608497 OEDRJRHBKJZDSI-MRXNPFEDSA-N 391.446 5.134 30 20 GKED CCN(C(=O)c1ccc(Br)cc1C(F)(F)F)c1ccc(C#N)cc1 540656709 HSSCQUXSIMZCBT-UHFFFAOYSA-N 397.194 5.006 30 20 GKED Cc1cc(C)cc(CCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 540735160 TWBRXOVRUOIWLE-UHFFFAOYSA-N 385.467 5.242 30 20 GKED N#CC1(CN[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(F)(F)F)CC1 542124894 WXCKOBJGPADPCV-LLVKDONJSA-N 390.249 5.221 30 20 GKED COc1cc(C#N)ccc1NC(=O)[C@H](Sc1ccccc1F)c1ccccc1 546709632 MDKHWUFUVXPIAX-OAQYLSRUSA-N 392.455 5.178 30 20 GKED CCN(C(=O)[C@@H](C)CC(=O)c1ccc(Cl)cc1)[C@H](C)c1ccc(C#N)cc1 546794695 LXORKBXZWYVJBH-JKSUJKDBSA-N 382.891 5.030 30 20 GKED CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555007830 UAMXYJUNRSLFAR-IIBYNOLFSA-N 378.476 5.178 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(OCC2CCCCC2)CC1)c1ccccc1 579443917 NOZLQSSOSKAEAI-QHCPKHFHSA-N 397.563 5.192 30 20 GKED Cc1ccc2nc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)[nH]c2c1 584856032 XPKRAYHUNCOLDS-UHFFFAOYSA-N 398.491 5.288 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cncc(C(F)(F)F)c2)cc1 588894075 ILINKHQSUROMAA-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Cc1ccccc1)c1nc2cc(F)ccc2s1 592974188 OUXNOVWNKQOZJG-IBGZPJMESA-N 386.451 5.516 30 20 GKED FC(F)c1nc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c2ccccc2n1 595535137 KYSNIZDUSQXXJO-IUCAKERBSA-N 399.285 5.135 30 20 GKED Cc1ccc(C(C)(C)c2noc(/C=C\c3cn(CCC#N)c4ccccc34)n2)nc1 596625450 QUFWYRIOHWIZRZ-BENRWUELSA-N 397.482 5.138 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3cccc4cccnc34)c2)cc1 609176428 IWMCJXDSLSAUSJ-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1ccnc2sc(C(=O)N[C@@H](C#N)c3ccc(C(C)(C)C)cc3)c(C)c12 609414990 GVHIXSQGNBAIMX-KRWDZBQOSA-N 377.513 5.205 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc3occc3s2)cc1F 610313457 KMLFHXUMPSRSQF-UHFFFAOYSA-N 378.384 5.550 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1)c1cccc(C#N)c1 610788210 USCZJLQTQSUBIU-HNNXBMFYSA-N 399.416 5.137 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2nc(Cc3ccccc3)cs2)c(Cl)c1 612343665 PYJCVVZNWYPSIT-UHFFFAOYSA-N 388.279 5.165 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2coc(C3CC3)n2)cc1Cl 613072280 FDDPOYWFJUQSFO-KRWDZBQOSA-N 377.831 5.113 30 20 GKED N#C[C@H](C(=O)c1cccc(F)c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 613347087 WWESALOYRUUNAV-CQSZACIVSA-N 391.254 5.746 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)s1)c1nc2ccccc2n1C(F)F 671751438 XFGPMCWJPNORCU-QMMMGPOBSA-N 385.317 5.002 30 20 GKED C=CC[C@H](C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccccc1 681649280 OWWALXZCSNRVNA-DZKIICNBSA-N 393.371 5.372 30 20 GKED CC(C)Cc1ccc([C@@H](NC(=O)Nc2cccc(OCC#N)c2)C2CC2)cc1 726074719 YABSURYGEJCEKI-JOCHJYFZSA-N 377.488 5.060 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1 727709038 SLQKTISTDDIIMH-QFIPXVFZSA-N 399.881 5.658 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C\c3cccc(OC)c3O)s2)cc1 733750439 ZFZMVJJDZXDHJS-IKTNTUJMSA-N 382.485 5.021 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)c1ccccc1Sc1ccccc1C#N 737788299 PYMDJZLQAZYNSC-UHFFFAOYSA-N 393.899 5.030 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)OC(=O)c3ccccc3OCC#N)s2)cc1 739297688 FQRUOHKZUYDERE-INIZCTEOSA-N 392.480 5.247 30 20 GKED C=CCOc1ccccc1CNc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1 742389311 XTVHOTFPBCQGEP-QGZVFWFLSA-N 382.504 5.449 30 20 GKED COc1ccc(OCc2nc(/C=C3/Cc4cc(Cl)ccc4C3=O)cs2)cc1 742436905 GSYUUHPGRTZOOA-UVTDQMKNSA-N 397.883 5.207 30 20 GKED CCOc1cccc(C=Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c1O 743045069 YEYVFJWUOQCFHI-HNNXBMFYSA-N 384.476 5.127 30 20 GKED Clc1ccccc1Nc1nc(Cl)c(C=NOCc2cccnc2)s1 746587380 BBUVVWWPSSUPSG-UHFFFAOYSA-N 379.272 5.139 30 20 GKED C#CC[C@@H](NC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccccc1 757624537 VOGPPYNXEYZVSW-OAQYLSRUSA-N 392.549 5.238 30 20 GKED CCOc1ccc(C=NO[C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)cc1 763172011 CPIIXGLGWRAZHF-OAHLLOKOSA-N 384.863 5.814 30 20 GKED C#CC[C@H](N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccccc1 773113274 CVKNTAKEGPARTP-LEWJYISDSA-N 388.536 5.550 30 20 GKED C=CC[C@H](N[C@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccncc1 775392624 HVBUGAZZMABDQA-XXBNENTESA-N 379.548 5.044 30 20 GKED C[C@@H](CCc1ccc(Br)cc1)N[C@H](C)c1ccc(OCC#N)cc1 776154475 CEFCKTMMXFMCFT-JKSUJKDBSA-N 387.321 5.023 30 20 GKED C[C@@H](CCN[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776163212 QIEZEJAAMARHOH-JKSUJKDBSA-N 376.422 5.452 30 20 GKED C[C@H](N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779082368 MPDAJICAAQQDPW-AOMKIAJQSA-N 391.515 5.633 30 20 GKED C#CCCCCCC(=O)N(CCC)[C@H](c1cccnc1)c1ccc(F)c(C)c1 779965812 YEPCMWHDSLICMB-DEOSSOPVSA-N 380.507 5.441 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 780162656 KBFBZOARYCYLSY-FQNOHDAGSA-N 392.455 5.497 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCCc1ccc2c(c1)-c1ccccc1C2 780178578 UJZJSTDHVIRMAM-SFHVURJKSA-N 396.490 5.510 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)C34CC(c5ccccc5)(C3)C4)c2)s1 790661389 ARQHRUMGTROCOC-UHFFFAOYSA-N 384.504 5.025 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCC(=O)c4ccccc43)n2)cc1 793125717 PPRMOCVZYSRRME-RBUKOAKNSA-N 386.476 5.055 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CC[C@H](C(F)(F)F)C3)n2)cc1 796800980 XMPRTMROYIGHAM-SOUVJXGZSA-N 378.419 5.273 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c(Cl)c1 797766475 MNZZGKRUGVDLRW-UHFFFAOYSA-N 398.293 5.366 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)c(Cl)cc2F)c1 799243430 ZYEMHVPEOWYBQE-LBPRGKRZSA-N 396.249 5.135 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CN[C@@H](CCCC#N)c1ccccc1 814656826 ACIAICDUKRZSLW-NRFANRHFSA-N 378.907 5.359 30 20 GKED N#C[C@@H](C(=O)Cc1c[nH]c2cccc(Cl)c12)c1nc(-c2ccccc2)cs1 815912279 GPYTXCKMMLIILJ-HNNXBMFYSA-N 391.883 5.364 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)C4CC(F)(F)C4)c23)cc1 863071907 BGVOBWJZCXBUQS-UHFFFAOYSA-N 388.443 5.200 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 915085983 GQLGTRIDXOTKEH-LJQANCHMSA-N 391.814 5.156 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915087100 QCWLVDQFTMYBEI-XMMPIXPASA-N 392.462 5.089 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3c[nH]c4ccccc34)n2)cc1 915101111 CWNPERXLKLEORN-FQEVSTJZSA-N 399.519 5.799 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1SCc1ccccc1)c1ccc(C#N)cc1 915329925 MUNCXYNEMAIPJG-QGZVFWFLSA-N 387.508 5.733 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3cccc(OC)c3OC(F)F)oc12 916129884 AZVIKECGYCEYPT-KHPPLWFESA-N 388.366 5.338 30 20 GKED COc1cccc(C=Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1O 920942217 SDKVCYPGGDQYGV-IBGZPJMESA-N 376.843 5.460 30 20 GKED C[C@H]1C/C(=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1776589594 OILZWZADHAPWDM-WBRURWICSA-N 398.458 5.737 30 20 GKED CCCCCCCCOc1ccc(CN2CCC[C@](CC)(C(=O)O)C2)cc1 1776785575 MWZWJRAYXUZFDH-QHCPKHFHSA-N 375.553 5.503 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C/c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777455999 VZQVMWFAUFLERM-PGECNJAHSA-N 398.458 5.656 30 20 GKED O=C(O)c1ccc2scc(/C=C3/Cc4ccc(Br)cc4C3=O)c2c1 1777685541 LDIUVSLCBVJSBQ-SDQBBNPISA-N 399.265 5.184 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)c3cc(C(C)(C)C)oc3C)cc2)CCC1 1787389532 YEVHENVXICETNF-UHFFFAOYSA-N 394.515 5.209 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2ccc(C)s2)[n+]2ccc(C)cc2)c1 27295351 NCBJWJDDZNXRFJ-UHFFFAOYSA-O 395.573 5.266 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3cc(Br)ccc3o2)c1 55570239 IOUNSJJVOAEJBM-UHFFFAOYSA-N 399.244 5.130 30 20 GKED COc1cc(Cl)ccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 65652071 SYAVBXRZLNVOSB-GFCCVEGCSA-N 377.252 5.102 30 20 GKED Cc1ccc2c(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c2c1 102122350 MGDUWIZYJNGAEI-OAHLLOKOSA-N 379.872 5.158 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 105040583 BWWVSTNPXOAOLI-UHFFFAOYSA-N 399.413 5.258 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Br)s1 114273215 ZCJXDTWRGOUCCC-LLVKDONJSA-N 395.347 5.086 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(-c2cc3ccccc3o2)o1 121789405 HSHYHTSMUHMUIR-UHFFFAOYSA-N 375.453 5.576 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 123459091 PALVUUUPNYRDST-UHFFFAOYSA-N 381.382 5.173 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C1CC1 124947779 GCAQVPCOPLVAIA-GJZGRUSLSA-N 382.533 5.236 30 20 GKED N#CCC[C@H](Nc1cc(N[C@H](CCC#N)c2ccccc2)ncn1)c1ccccc1 127935706 MQIGDVJFKXWIJG-SZPZYZBQSA-N 396.498 5.391 30 20 GKED C=CCN(C(=O)[C@H](C)c1cccs1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 151167374 QEBSRBOZKDGWRT-CYBMUJFWSA-N 399.497 5.103 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 154000161 XCTQTJPUUBANGN-CEXWTWQISA-N 393.556 5.799 30 20 GKED N#C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(Cl)c(Cl)c1 161183191 GWNSSQZAOCLGAM-AWEZNQCLSA-N 391.151 5.146 30 20 GKED COc1cccc(-c2nnc(SCCCC(C)(C)C#N)n2Cc2ccco2)c1 177198628 QAUQWIFCLBVCIX-UHFFFAOYSA-N 396.516 5.017 30 20 GKED Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4cccc(C#N)c4C)cc3)o2)c1 178377900 AFWGFVHPBZJCHR-UHFFFAOYSA-N 394.434 5.144 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 181575699 MEJIOAJQAGRVGP-JPYJTQIMSA-N 396.556 5.099 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 182055229 DVAMXNSBNJUAKR-KGLIPLIRSA-N 376.378 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@]2(C1)OCc1ccccc12 191451073 OUYSCHBPSKSZAW-DEOSSOPVSA-N 376.500 5.202 30 20 GKED COc1ccc(-c2nnc(SCCCCC#N)n2-c2ccc(Cl)cc2)cc1 195562743 KIOVFZRYRMOAJQ-UHFFFAOYSA-N 398.919 5.382 30 20 GKED C[C@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)c1ccc(C#N)cc1 303673243 GZFARFMXEQJZAU-INIZCTEOSA-N 386.480 5.311 30 20 GKED Cc1ccccc1[C@H](/N=C(/O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)C(C)(C)C 328713624 SBDSBOZSFKZYTC-KNKQGSTJSA-N 392.547 5.050 30 20 GKED N=C(O)C1CCN(c2ccccc2N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1 329007032 NGLRMJNAZYUCKB-QXAKKESOSA-N 383.536 5.633 30 20 GKED Cc1csc(C(=O)Nc2sc(C(C)(C)C)cc2C#N)c1Br 411005824 HQTIUKRZFSCAPX-UHFFFAOYSA-N 383.336 5.302 30 20 GKED C[C@@H](NC(=O)c1cccc(SCC#N)c1)C(c1ccccc1)c1ccccc1 429950474 ZBPDMJYJEALHBM-GOSISDBHSA-N 386.520 5.253 30 20 GKED CCOC(=O)c1oc2ccccc2c1CN[C@@H](CCCC#N)c1ccccc1 433008886 FJDKFZWRPQBXHJ-FQEVSTJZSA-N 376.456 5.134 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@H](CC(F)(F)F)C3)c2)cc1 434158976 WJERZVINANHXNK-OAHLLOKOSA-N 389.377 5.157 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(F)c(F)cc2F)cc1F 437027600 SYFQDUDFUAQHDL-UHFFFAOYSA-N 386.304 5.159 30 20 GKED C[C@@H](c1ccc(Br)cc1)c1noc([C@H](C)c2cccc(C#N)c2)n1 463062771 YNRZLQKEIZQJHR-QWHCGFSZSA-N 382.261 5.007 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 464156134 DMMKEPOUUQCLPT-OAQYLSRUSA-N 381.863 5.062 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)cc2)cs1 464425852 LEYHPCMCOLUHKM-HNNXBMFYSA-N 387.386 5.022 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 464954022 SNUIAYDDUOPKQJ-LIONHTAISA-N 380.491 5.242 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Oc3ccccn3)cc2)c2ccccc21 469416843 VQOJBNSOXJSMQQ-UHFFFAOYSA-N 396.450 5.385 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 474423988 BAXHLGRXFQMKMY-AWEZNQCLSA-N 382.510 5.494 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 476107094 DCNZZYSOALMFQR-CRAIPNDOSA-N 380.797 5.147 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1 476141605 JDYGGTPPDYELAB-UHFFFAOYSA-N 379.891 5.630 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 477531071 TXBOLJHZZWHPCK-UHFFFAOYSA-N 394.478 5.568 30 20 GKED Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)o1 480639002 UWNOATZRKGJLMT-BLLLJJGKSA-N 389.402 5.066 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cncc(Cl)c1Cl 480838717 JYCNNXZPVHWBHM-UHFFFAOYSA-N 391.176 5.224 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)cc1 481900598 CTSJGMSMRILDHT-UHFFFAOYSA-N 396.450 5.179 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC(C(F)F)CC1 482754944 AJVZSGINVKYKNH-UHFFFAOYSA-N 390.274 5.233 30 20 GKED Cc1ccc(-c2nc(CC(=O)N[C@@H](CCCC#N)c3ccccc3)cs2)cc1 487277242 ZOABAUYIXZAZSN-NRFANRHFSA-N 389.524 5.212 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N[C@H](CCCC#N)c3ccccc3)ccc2c1 487300870 RHJCCRZVVFRZSS-MHECFPHRSA-N 386.495 5.503 30 20 GKED CC(C)CCn1ncc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1C(C)C 487627686 ARRVWIIFTRYHQK-UHFFFAOYSA-N 395.551 5.367 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cc2)cc1 495121592 MYFGHYYPJKRXEI-UHFFFAOYSA-N 375.428 5.328 30 20 GKED N#Cc1ccc(CNC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)cc1 495427515 PIBHFGIDZAXHDW-UHFFFAOYSA-N 397.453 5.095 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2cc(C#N)ccc2OC(F)F)C1 499369228 NUNGSMZNGYGBEM-NVXWUHKLSA-N 394.462 5.254 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCc2cc(OCC)c(OCC)cc2C1 505035446 MXPKGVSTQZUJAS-UHFFFAOYSA-N 394.515 5.193 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1 505046713 XVKWKUXUANJFPQ-UHFFFAOYSA-N 380.463 5.071 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 505326775 XDIHPIWPXSFXHM-MGPUTAFESA-N 385.508 5.739 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCCOc1ccccc1Br 507596371 NZQSBKVNCKPPCJ-CQSZACIVSA-N 391.334 5.334 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)c2ncccc12 509472388 RFKFPAPYBMFPHQ-ZDUSSCGKSA-N 381.888 5.535 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1sccc1Cl 511895624 YANMOUWIXQSFAM-UHFFFAOYSA-N 390.839 5.678 30 20 GKED CC1=C(c2ccco2)CN(C(=O)c2cccc(COc3cccc(C#N)c3)c2)CC1 512746381 HABAEVIWXGHBGF-UHFFFAOYSA-N 398.462 5.050 30 20 GKED Cc1sc(NC(=O)c2csc(-c3ccc(Cl)s3)n2)c(C#N)c1C 512976788 AFNWKCDBFJZRDS-UHFFFAOYSA-N 379.919 5.327 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(Cl)cc3Cl)cc2)nc1 517656579 KDWLYIZHKYMSEG-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#C[C@@H](C(=O)c1sccc1C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 518477116 GCPFMAHQRZOCEI-HNNXBMFYSA-N 384.913 5.892 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3OC(F)F)cc2)cc1 520557880 RUZPHTVZCAMMBI-UHFFFAOYSA-N 380.350 5.204 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1 523699190 APSXGTNAILLWGG-SJLPKXTDSA-N 387.405 5.184 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 525813916 CGGVYJAPPNLNMV-OAHLLOKOSA-N 389.421 5.258 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3CCc4ccccc4CC3)n2)cc1 528931536 FVVOOYHFKWAAJZ-NRFANRHFSA-N 397.503 5.053 30 20 GKED C[C@H]1CC(F)(F)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 529003745 UTWWKMYIHIJHSE-ZDUSSCGKSA-N 389.377 5.141 30 20 GKED Cc1cc([C@H](NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)C2CC2)ccc1F 534703146 YKDRLFZUHZDTES-JOCHJYFZSA-N 379.479 5.077 30 20 GKED C=C[C@H](CC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 535499554 KIDFYWYLJVJIRI-UZUQRXQVSA-N 376.887 5.301 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 537007477 VYZDKMYLKCKHOW-UHFFFAOYSA-N 387.508 5.185 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)CC1 537096706 IPORTWDPMMIDGT-JKYAZJQKSA-N 380.919 5.164 30 20 GKED C=C[C@@H](CC(=O)N1CCc2sc(-c3csc(C)n3)cc2C1)c1ccccc1 537930233 HMDZVNJWOGEGJC-INIZCTEOSA-N 394.565 5.425 30 20 GKED N#Cc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(F)c1 538323280 MNEJUJMKHRYLDH-OAHLLOKOSA-N 376.275 5.109 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N[C@@](C)(C#N)CC(C)C 542895658 MEMJNOHEZAPLKP-GOSISDBHSA-N 380.275 5.015 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1cccnc1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543004367 PPVMZRBSJYDHBM-MZNJEOGPSA-N 396.494 5.132 30 20 GKED Cc1nsc(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)c1C#N 561212776 QRCKSSHLRKQZBO-UHFFFAOYSA-N 390.390 5.141 30 20 GKED COc1ccc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1Br 576131631 ZXDSMXWEAUCTIA-YJYMSZOUSA-N 385.305 5.058 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccc(Oc4ccnc(C#N)c4)cc3)o2)cc1 581222582 AEPBCDLQSOJCRW-INIZCTEOSA-N 397.438 5.277 30 20 GKED N#CC1(Cc2nc(C3(c4cccc(C(F)(F)F)c4)CCCCC3)no2)CC1 590273450 VMSSCKFAFXVETM-UHFFFAOYSA-N 375.394 5.185 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 598841748 HEYABYMHTZBTHJ-LBPRGKRZSA-N 382.332 5.046 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cc1 603834526 POLZAHYKSCMHRU-AWEZNQCLSA-N 379.510 5.110 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc(Cl)c1 609062419 JTLUXLAMINNVLO-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 609744585 RZQDPUIATSDCRZ-MSOLQXFVSA-N 381.545 5.771 30 20 GKED C=CCN(C(=O)[C@H]1CCC[C@H](C)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610169109 BCKYVJPFYUTWAH-HOCLYGCPSA-N 385.489 5.064 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(-c3ccco3)s2)cc1 610799287 MQUMSUQZSPJOGI-UHFFFAOYSA-N 390.386 5.084 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(NC(=O)C2CCCCC2)c1 611391734 HSXMRTBUIYLHMD-DEOSSOPVSA-N 387.527 5.244 30 20 GKED CC(C)(C#N)CNC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 611688550 WKYUXXAFGKEIFD-UHFFFAOYSA-N 398.915 5.658 30 20 GKED FC(F)(F)c1cccnc1N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 642226892 XCKPVEKSJGUBQY-BRPSZJMVSA-N 380.254 5.422 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cn1 676459379 YNGVDABPDJMHCK-CYBMUJFWSA-N 389.402 5.324 30 20 GKED Cc1ccccc1CCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 729088342 BQPNZCOCKIHZQB-OAHLLOKOSA-N 382.435 5.206 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3sc(C)c(C)c3C#N)c(F)c2)cc1 730161353 YSNPCUOJOQSQGZ-UHFFFAOYSA-N 380.444 5.304 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416770 IJDHSXZJERCYES-FUHWJXTLSA-N 396.487 5.593 30 20 GKED CCCO[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 731108233 INUJUORBAUQTJU-XZOQPEGZSA-N 391.515 5.155 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(Br)c1 735319047 VHZVBVCBDANSOH-UHFFFAOYSA-N 388.739 5.500 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)c(SC)cc1OC 741166139 WNTBRZIFFOCWJC-FPLPWBNLSA-N 382.403 5.341 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1ccc(-c2ccc(F)cc2)o1 741840613 ASIMAIYVZUYQKT-LUAWRHEFSA-N 384.378 5.146 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(OC(F)F)cc3)cc2F)c1 742260780 CLEZJHIWNPWWKP-UHFFFAOYSA-N 398.384 5.490 30 20 GKED Cc1nc(COC(=O)CSc2ccc(C#N)cc2)oc1-c1ccc(Cl)cc1 757065333 CCZGXRITROIONX-UHFFFAOYSA-N 398.871 5.011 30 20 GKED CC(C)c1ncc(/C=C2\CSC/C(=C/c3cnc(C(C)C)s3)C2=O)s1 758428217 BGDOTAWMSXNEFZ-FUJGBLOQSA-N 390.599 5.629 30 20 GKED Cc1ccsc1/C=C1/CC(O)(C(F)(F)F)C/C(=C/c2sccc2C)C1=O 764431305 AXSXKDKLUIJSRP-PVRNWPCDSA-N 398.471 5.550 30 20 GKED O=C1C/C(=C\c2ccc(-c3nc4ccccc4s3)o2)C(=O)c2ccccc2N1 774147219 YRHIIAZQVYRGNX-ACCUITESSA-N 386.432 5.165 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1ccc(C#N)cc1F 781108262 OIUMKQDLZHKXCO-MDZDMXLPSA-N 393.849 5.109 30 20 GKED Cc1sc2ncn(N=Cc3sccc3Cl)c(=O)c2c1-c1ccccc1 782149699 GDYLADDKDAKZND-UHFFFAOYSA-N 385.901 5.031 30 20 GKED COc1ccc2[nH]c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2c1 786767848 ZWMBUFVZMSXLDV-NRFANRHFSA-N 381.435 5.084 30 20 GKED C=CC[C@H](NC(=O)N(CC(C)C)[C@@H](C)c1ccccc1Cl)c1ccncc1 806820202 UMXSADCGZUZJPR-UWJYYQICSA-N 385.939 5.781 30 20 GKED C=CCCCC(=O)N[C@@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21 811952818 FTNIYZZFCXARCE-QGZVFWFLSA-N 388.508 5.108 30 20 GKED N#C[C@@H](C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1nc2cc(F)ccc2s1 820031112 DBCXBWMPDJMFRD-XLQUKYQWSA-N 396.409 5.226 30 20 GKED CSc1ccc(CCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 842711816 JGCCTLMFGZVCGQ-INIZCTEOSA-N 384.501 5.356 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2nc(C3CC3)cs2)c(C)c1 842942704 QITVVDOMTOUFDN-QGZVFWFLSA-N 380.513 5.175 30 20 GKED O=C(N[C@H](c1cc(F)ccc1F)C(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 857498495 GWGOTIOSAYYYRK-ZIAGYGMSSA-N 397.265 5.117 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1 915085498 BZBBHOKWRGWVNC-FQEVSTJZSA-N 380.369 5.613 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(C)cc1 915353529 VASLNONAULNBHW-BJKOFHAPSA-N 383.495 5.923 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(OCc3ccccc3)c2)ccc1OCC#N 915989052 VRXDIMSDLODHAY-ZRDIBKRKSA-N 399.446 5.073 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2cc(Cl)ccc2o1 916906182 GMPGSHRRLAXJOY-QGZVFWFLSA-N 394.858 5.172 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1-n1cccc1 917025130 DZTPLUVOLJFJJP-IBGZPJMESA-N 383.476 5.399 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)NCc3cccs3)cc2Cl)cc1 917600425 RYIWKQRANYRSIR-UHFFFAOYSA-N 399.928 5.552 30 20 GKED O=C(O)c1ccc(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1F 1776074959 DSHCKRNRVTUAMM-CQSZACIVSA-N 380.341 5.278 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2OC)cc1 1776125315 DGVKFXLOTFIXPF-QINSGFPZSA-N 396.483 5.639 30 20 GKED C=CCOc1c(Cl)cc(CNc2ccc([C@@H](C)CC(=O)O)cc2)cc1OC 1776183372 AXBVSDPOZUPBIU-AWEZNQCLSA-N 389.879 5.104 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)cc1 1777472289 JIRGCKOIVWBNDY-UKTHLTGXSA-N 390.410 5.307 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(Cl)c(F)c1 1777569332 DZCWSZPKISJDJF-XVNBXDOJSA-N 386.762 5.039 30 20 GKED N#Cc1ccc(CCC(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)cc1 24878319 RQIOHBYSJIENNL-RUZDIDTESA-N 380.447 5.143 30 20 GKED C=CCn1c(SCc2ncc(-c3cccc(Cl)c3)o2)nnc1-c1ccco1 29991056 ONUIKVLUIWBUKJ-UHFFFAOYSA-N 398.875 5.325 30 20 GKED CCc1nc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cs1 57344685 MLHZKROHKVVKDQ-SFHVURJKSA-N 395.915 5.196 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1)c1ccccn1 106353747 CFEVEPGLLZKHJV-HRAATJIYSA-N 380.419 5.070 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1nc(-c2ccncc2)cs1 114619540 AAMOIFISUIWZBP-GOSISDBHSA-N 398.491 5.055 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2cccnc2Cl)cc1Cl 120330078 VLRVPOYIJCDRFB-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCN(C(=O)[C@@H](C)c1cccs1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 151167325 QEBSRBOZKDGWRT-ZDUSSCGKSA-N 399.497 5.103 30 20 GKED CC(C)c1nnc(SCc2ccccc2C(C)(C)C#N)n1Cc1ccco1 151365670 RJZQIOCOTJZPQN-UHFFFAOYSA-N 380.517 5.136 30 20 GKED C[C@H](Nc1ccn(CCC#N)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 152780622 IZDPNSXVBICBBL-JTQLQIEISA-N 376.304 5.007 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC(C(F)(F)F)CC3)c2)cc1 173085508 NIOOTMDFDYSZJO-UHFFFAOYSA-N 389.377 5.157 30 20 GKED Cc1ccccc1-n1c(SCCCC(C)(C)C#N)nnc1-c1cccnc1 177173047 LUZSONNWEKUVMW-UHFFFAOYSA-N 377.517 5.060 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(F)cc2Cl)ccc1OC 180814578 FFQUZNJXEDIQMM-BBRMVZONSA-N 376.859 5.019 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(Br)c2Cl)cc1 183014690 ZIJOXPWLHPVPIA-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C 189944367 PYCYVBSIZTZMGZ-UHFFFAOYSA-N 393.409 5.213 30 20 GKED OC(CSC[C@H]1CCCCO1)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328891439 SPVQGORVRVIMTN-MRXNPFEDSA-N 377.506 5.009 30 20 GKED C/C(O)=N/[C@@H](Cc1c[nH]c2ccccc12)/C(O)=N/[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 329093641 KHSCROLWWVXYCH-TYYYZTEESA-N 381.520 5.371 30 20 GKED CCOc1ccc(N/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c(C)c1 329373623 JZSZVACKYPYQEO-HXUWFJFHSA-N 382.508 5.109 30 20 GKED CC[C@@H](CNC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)CC(F)(F)F 413417606 KWAHARJSKLRYLZ-MFKMUULPSA-N 388.327 5.097 30 20 GKED N#Cc1c(F)cccc1CNc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 427416492 TZXZHHXQWOFHSF-UHFFFAOYSA-N 397.812 5.354 30 20 GKED CO[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 431987066 PFWKMSVZMXYNBJ-QHCPKHFHSA-N 393.487 5.082 30 20 GKED N#CCC[C@H](NC(=O)NCC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 432113816 RQDBAUJBORTKLN-MOPGFXCFSA-N 389.421 5.067 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 435171450 QFIKVEULTNBQGO-VXKWHMMOSA-N 375.516 5.424 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 438845967 GPURGGUVPHQUGU-ACJLOTCBSA-N 376.287 5.399 30 20 GKED C=CCC[C@@H](NC(=O)Cc1csc(CC)n1)c1ccc(C(F)(F)F)cc1 441562925 DPKIUMKQWLQQNC-MRXNPFEDSA-N 382.451 5.091 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)cc2)cs1 442027612 INLSVMLTMZBFPX-OAHLLOKOSA-N 375.478 5.218 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]2CCC[C@@H]21 444380427 DJMYEMLHCWCTJP-GCJKJVERSA-N 375.472 5.455 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CCCC1(C)C 444858389 YHFVVEILLSGYJL-OAQYLSRUSA-N 391.515 5.538 30 20 GKED N#C[C@H](NC(=O)c1cscc1-c1ccccc1)c1cccc(Br)c1 464400515 BXNRKIFUHVDZEA-SFHVURJKSA-N 397.297 5.172 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 465249232 DNKXKPNECMEYIU-UHFFFAOYSA-N 394.290 5.983 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCC1CCC(C(F)(F)F)CC1 471987267 XJCXNUSXQLCVBG-UHFFFAOYSA-N 375.394 5.526 30 20 GKED Cc1ccc(NC(=O)Nc2cccc3c2CCN(CCCC(C)(C)C#N)C3)cc1 472254670 FRZJXHGOBCPGHT-UHFFFAOYSA-N 390.531 5.327 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1cc2cccc(F)c2o1 473875088 JUZILPQIZSTBFT-ZAAXVRCTSA-N 391.446 5.114 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(Cl)c1Oc1cccnc1)c1ccccc1 475124127 ZUHUJUNAZVDYPY-QGZVFWFLSA-N 391.858 5.553 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1c[nH]c2ccc(F)cc12 475548850 KIHWYJHNTOOMPS-UHFFFAOYSA-N 379.479 5.523 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2c(F)cc(F)cc2F)nc2ccccc21 476635821 MBRBGSWYRIWEBS-NSHDSACASA-N 376.403 5.003 30 20 GKED CCC1(CC)[C@H](OC)C[C@H]1N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 483332453 VEYLGYPQDQFNEC-KFKAGJAMSA-N 389.565 5.138 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H](C)c1ccc(C#N)cc1 495168046 POIZGYRZBISHJP-KGLIPLIRSA-N 395.915 5.118 30 20 GKED O=C(CCSc1ccc(Cl)cc1)NCC#Cc1cccc(C(F)(F)F)c1 502464973 MEUQIYCXEPNIKN-UHFFFAOYSA-N 397.849 5.009 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c(C)c1 510213997 XMSGAPOFJNFNKS-QGZVFWFLSA-N 387.508 5.356 30 20 GKED Cc1sc(NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)c(C#N)c1C 512138033 KCNWESBIFCKRJW-UHFFFAOYSA-N 381.501 5.008 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccc(OCC(F)(F)F)cc1 516757593 XDZYKXPADJSKMG-LLVKDONJSA-N 397.784 5.035 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1 518537849 LBVRUGPIMSYFEH-JOCHJYFZSA-N 390.483 5.189 30 20 GKED CCCOc1ccccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 521090875 YWPXGVPGBGXBIR-UHFFFAOYSA-N 386.451 5.586 30 20 GKED C=C(C)COc1cccc(NC(=O)NC(c2cccs2)c2cccs2)c1 524129405 RYYUDTUHRQEOBN-UHFFFAOYSA-N 384.526 5.676 30 20 GKED Cc1ccc(-c2ocnc2C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 525133414 KCNBFGCBCZWARK-UHFFFAOYSA-N 391.496 5.495 30 20 GKED C=C[C@H](CC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 535370058 KBILPRIXHSMWBA-ZHRRBRCNSA-N 379.550 5.644 30 20 GKED C=CCC[C@H](N[C@@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 536839486 MSOHUUIIJFYVAC-LPHOPBHVSA-N 390.449 5.720 30 20 GKED C=C(C)[C@H](CC(=O)N1CC[C@@H](c2ccccc2)[C@H]1c1cccc(OC)c1)OCC 541446238 MDKAAUXPEJLYGF-SONWIMMPSA-N 393.527 5.124 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2COC(C)(C)CC)cc(OC)c1OC 541633980 LBRBYYRUACXPKG-UHFFFAOYSA-N 397.515 5.390 30 20 GKED N#Cc1ccc(CN2CCC(Nc3ccc(-c4cnc(C5CC5)o4)cc3)CC2)cc1 541901696 VBPOUPWDHKOMLI-UHFFFAOYSA-N 398.510 5.167 30 20 GKED CCC1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 543037339 PSTHKHUXSXAAAZ-LJQANCHMSA-N 397.906 5.076 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1occc1-c1ccc(F)cc1 561238100 MIOXXHFOZQNOIG-UHFFFAOYSA-N 381.451 5.082 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 566036023 OFTFVUJZKVGETD-UHFFFAOYSA-N 390.430 5.394 30 20 GKED COc1cc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)ccc1OC(C)C 570763930 MGXSLXOTCRJBFZ-UHFFFAOYSA-N 389.455 5.153 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCN(C)c2ccccc21 581471335 MDWJTFIFLRAZJE-AEFFLSMTSA-N 394.544 5.031 30 20 GKED N#C[C@@H](C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1nccc2ccccc12 582216267 AWCXYAUDEWDXHC-JOCHJYFZSA-N 397.478 5.244 30 20 GKED CC(C)(C)c1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 582989283 MWUACYYNVNWCKT-OAHLLOKOSA-N 396.903 5.041 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 586780138 VJJAURNAAOTAIT-IBGZPJMESA-N 377.315 5.008 30 20 GKED N#Cc1c(NC(=O)CCSc2ccc3ccccc3c2)sc2c1CCC2 589932476 VYMHBSSUZMQGQK-UHFFFAOYSA-N 378.522 5.383 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1CCc2cc(Br)ccc21)c1ccccc1 592635312 BJSJXNWOFKSSAF-UXHICEINSA-N 397.316 5.030 30 20 GKED CSC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 602811646 MJOYKLFPOYCGAV-UHFFFAOYSA-N 381.501 5.018 30 20 GKED Cn1ccc2c(C(=O)[C@H](C#N)c3nc4cc(C(F)(F)F)ccc4s3)cccc21 607274638 MKHJYTDECOXJIJ-AWEZNQCLSA-N 399.397 5.297 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)c(C)c1 609098509 BYWAWRUBXKSZKF-VGOFRKELSA-N 393.556 5.365 30 20 GKED CCCN(C(=O)c1ccc(-n2nc(C)cc2C)cc1)c1cc(Cl)ccc1C#N 609285580 BAQGQXQFOWRFST-UHFFFAOYSA-N 392.890 5.071 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(CC(F)(F)F)cc3)cc2)nc1 610179710 YKJMDCUXALIZGP-UHFFFAOYSA-N 397.356 5.103 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1ccccc1C(F)(F)F 610228157 ORMQUGDARBIDJT-ZIAGYGMSSA-N 392.446 5.842 30 20 GKED C[C@H](c1ccccc1)n1c(SCc2ccnc(C#N)c2)nnc1-c1ccccc1 610956627 YGKKWXWSQLJISV-QGZVFWFLSA-N 397.507 5.113 30 20 GKED CCc1c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cnn1CC(C)C 611139461 VSEPZVSYTCBBCV-UHFFFAOYSA-N 388.471 5.018 30 20 GKED CC(C)c1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)cnn1-c1ccccc1 613289540 FIRKLCKQAHTELD-INIZCTEOSA-N 386.480 5.095 30 20 GKED FC(F)(F)Oc1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 618449960 IEOJBPZYOHAGHA-QWRGUYRKSA-N 395.265 5.148 30 20 GKED Fc1ccc(NCc2cccnc2C(F)(F)F)c(OCCC(F)(F)F)c1 629197712 OPMLEZWANAUXPO-UHFFFAOYSA-N 382.279 5.183 30 20 GKED Cc1nc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)n1 642226830 HJGPLANQOYKKQB-BRPSZJMVSA-N 395.269 5.125 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)C1 665609870 VOBVLZABJJMDOX-SFHVURJKSA-N 392.503 5.459 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1C[C@@H]2CCCC[C@@H]21 667281539 NUQAZKVSCVULIE-GWCFXTLKSA-N 398.322 5.382 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=S)Nc1ccc(C#N)c(Cl)c1 726484545 ORQAUBHXJUAUFV-UHFFFAOYSA-N 396.318 5.613 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(O)c(C)c1 728225939 AMJNSOQVCCODRT-UHFFFAOYSA-N 392.459 5.348 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1cccc(OCC#N)c1 730150657 WIYUUKSLXGJDMV-BJMVGYQFSA-N 378.428 5.056 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3sccc3C)cc2)oc1C(=O)O 733749078 QVYCUFQMHJIJQT-VMPITWQZSA-N 382.437 5.131 30 20 GKED C=CC[C@H](NC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1ccncc1 734684834 WTTBDBRCQCEHOA-RPWUZVMVSA-N 383.495 5.056 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2c(Cl)nc3ccccn23)cc1OC 737451480 ZJSBOHYUOXXJPQ-NTMALXAHSA-N 384.863 5.071 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)cc1F 741847207 LUYBFZDKESYRTC-YWEYNIOJSA-N 379.456 5.418 30 20 GKED Cc1cc([C@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)ccc1F 742261456 YGZONWUHBJZDPK-QHCPKHFHSA-N 394.877 5.569 30 20 GKED COc1ccccc1[C@@H](Nc1snc(Cl)c1C#N)c1ccccc1Cl 742413387 YSJHWJPUPMZHDK-INIZCTEOSA-N 390.295 5.532 30 20 GKED CS[C@H]1CC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 743123145 GEKRIQVXNBAQSL-LPHOPBHVSA-N 381.501 5.065 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)CCc3nc4ccccc4o3)cc2)cc1 748683037 LMHBAZTWKWLVRT-UHFFFAOYSA-N 384.391 5.030 30 20 GKED CC[C@@H](C)n1c(SCCCOc2ccc(C#N)cc2)nnc1-c1ccccc1 749753235 ZSWWBLQNTUUQPQ-QGZVFWFLSA-N 392.528 5.349 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 750688669 VFQYFRCQNPHBQV-HVEPWOEZSA-N 376.456 5.537 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1cc(Cl)ccc1OC(F)F 753143589 GWCOEPRPMCJYCT-AATRIKPKSA-N 392.814 5.356 30 20 GKED C[C@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 762234883 QQSNMQPHQIAZBE-NJPLLEPOSA-N 378.781 5.035 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 765910199 KBEONDBHZHJQRG-KSSFIOAISA-N 393.284 5.052 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2)co1 767504356 XPWZIUUXPPXHMF-UHFFFAOYSA-N 384.439 5.161 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4cccc(C(F)F)c4)no3)cc2)nc1 771507357 FZBBWKOFEHBZPG-UHFFFAOYSA-N 390.349 5.400 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@H](C)c1nc2ccccc2o1 777871932 NISWPGONSAOYFY-QGZVFWFLSA-N 383.451 5.760 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@@H](C)c1c(Cl)cccc1Cl 780666600 AFPZHYUSCMXAAH-OLZOCXBDSA-N 392.286 5.209 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CC[C@H](O)C(C)(C)C2)c1 784431794 WKRXPAFPSRURGH-NRFANRHFSA-N 390.568 5.188 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(F)(F)CC1)c1ccc(C(F)(F)F)cc1 793008218 KLOGNSUEYJXSQQ-OAHLLOKOSA-N 376.369 5.153 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(C)c(Br)s2)c1 796307294 JXKFOZXLZYRTCP-DZGCQCFKSA-N 393.350 5.351 30 20 GKED CC(C)n1ncc2c(C(=O)OCC(C)(C)CCC#N)cc(-c3cccs3)nc21 798877697 ZICFDZISLZWQOY-UHFFFAOYSA-N 396.516 5.227 30 20 GKED CC(=O)c1cc(NCc2cccc(-c3ccc(C#N)s3)c2)ccc1[N+](=O)[O-] 804483526 HRXUOVIFRMGMOV-UHFFFAOYSA-N 377.425 5.010 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 814311678 IGFXBTIRLSTMCR-NHCUHLMSSA-N 389.499 5.167 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc3c(F)ccc(F)c3c2)cc1 815010262 IKNLVOALCBGMDA-HXUWFJFHSA-N 399.400 5.421 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)C(=O)c2sccc2Br)sc1C 845847752 XTUBMEBDWMUHAN-NSHDSACASA-N 396.331 5.038 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)O[C@@H](C)CC(C)(C)C#N 851207065 SBXOGTATHXAVFH-NSHDSACASA-N 380.366 5.154 30 20 GKED COc1c(Cl)cc(NCc2cc(C#N)ccc2Br)cc1Cl 864008953 AZSBFLOVFDDKDE-UHFFFAOYSA-N 386.076 5.248 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915086230 IGZVZMVVMLSSQU-DEOSSOPVSA-N 396.490 5.561 30 20 GKED C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915088000 YJGCWQJPXPTNDH-ZHRRBRCNSA-N 390.870 5.401 30 20 GKED Cc1c(C(=O)/C=C/c2ccccc2OCc2cccnc2)cnn1-c1ccccc1 915986825 FRWLJZNCTGCWOR-BUHFOSPRSA-N 395.462 5.051 30 20 GKED O=C(/C=C/c1cc(Br)cs1)c1ccc(Br)s1 916134195 FMFWBUBVMIUDJB-OWOJBTEDSA-N 378.110 5.231 30 20 GKED CCc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 917042301 AMHFEPDFDURABS-NSHDSACASA-N 380.416 5.429 30 20 GKED Cc1ccc(CCCC(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 920807169 ZDNYTNLHPXPWRF-MRXNPFEDSA-N 396.462 5.596 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)cc1 1776125688 QDIFTSUFAVLZTR-UVTDQMKNSA-N 384.447 5.769 30 20 GKED C=CCOc1cccc(/C=C/c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)c1 1776184804 WGKBKROHBGCICI-IZZDOVSWSA-N 381.428 5.383 30 20 GKED CC(C)(C#N)c1ccc(CNCc2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776230592 LCVJWIFRFBDTOO-UHFFFAOYSA-N 384.479 5.143 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2cccc(Oc3ccccc3)c2)c1)C(=O)O 1776471054 FBRLQFKDAQNMMW-CLVCIHKQSA-N 388.419 5.227 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1OC1CCCCC1 1776786950 CHPKXMGNJBVAHY-HXUWFJFHSA-N 375.553 5.692 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccccc1COC1CCCCC1 1776786983 GGWCXOBFIIMAGQ-QFIPXVFZSA-N 389.580 5.829 30 20 GKED COc1cc(Cl)c(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1Cl 1777313028 AOLLNDPWWPFHCV-WQLSENKSSA-N 391.250 5.303 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C1/CCc2occ(C(=O)O)c2C1=O 1777341914 AKERJJSTGGWLTJ-VBKFSLOCSA-N 388.419 5.174 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)o2)cc1 1777472290 JOXUIRRIXMMETE-QXMHVHEDSA-N 376.408 5.070 30 20 GKED O=C(O)/C=C/c1ccc(/C=C\C(=O)c2ccc(N3CCCCCC3)cc2)cc1 1777624132 QDWWZCSFKCUNIM-CKOAPEAFSA-N 375.468 5.061 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(F)cc2)=C(/S)Nc2ccc(C)c(C)c2)c1 28778587 DRALGRYUXLZKRB-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1csc2c1CCCC2 47993190 HXTJVQMHRNLFAV-UHFFFAOYSA-N 389.480 5.247 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cc1csc(-c2ccc(OCC)cc2)n1 63300170 PLSIRBAAOABPQP-UHFFFAOYSA-N 389.524 5.269 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccccc3F)n2)sc2c1CCCC2 64778256 YJWWESGZGRKFBG-UHFFFAOYSA-N 383.473 5.013 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1c(C)noc1Cl 66051782 WHTZUGZTDKJXPO-UHFFFAOYSA-N 395.846 5.180 30 20 GKED CCc1ccc(C(=O)CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108324924 PKQSZQBMKVXXTB-INIZCTEOSA-N 380.513 5.102 30 20 GKED CCN(Cc1csc(-c2cccc(OC)c2)n1)[C@@H](C)c1ccc(C#N)cc1 108815287 CHNHHRVAKQQUPE-INIZCTEOSA-N 377.513 5.273 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2nc(-c3ccncc3)cs2)cc1Cl 124114923 UYYFTFUEBCQQCL-AWEZNQCLSA-N 385.920 5.274 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(NC(=O)CC)ccc1Cl 124785567 SEWPKFPNPOBRQU-UHFFFAOYSA-N 389.858 5.048 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1nc(C)cs1 173116834 NLKNFZQMZBUWLQ-ORAYPTAESA-N 388.562 5.150 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)c(Br)c1 173265598 ZDQXKIVHHRUAIG-LLVKDONJSA-N 393.281 5.235 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 177112007 XDZFXVJPRPEYJU-SNVBAGLBSA-N 384.810 5.350 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COc2ccccc2-c2ccccc2)n1 177750969 JUGIYCLQAHSSGY-GOSISDBHSA-N 376.481 5.189 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 180015040 KRVATYCKYASRIT-IIBYNOLFSA-N 375.472 5.051 30 20 GKED COc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1 181734382 WLTSAXHCWNSJFT-SFHVURJKSA-N 388.467 5.241 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1 184297050 VTUSLGHKSMIENW-MBSDFSHPSA-N 397.478 5.309 30 20 GKED C[C@H](CCC#N)Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 188185416 PXYUQHCXQJLPKU-OAHLLOKOSA-N 382.920 5.431 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 255172697 VVAVVFQDHMCYGQ-YVMONPNESA-N 383.835 5.185 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1)C1CC1 271451150 ODZGVWADJXRGRD-UHFFFAOYSA-N 396.343 5.285 30 20 GKED C[C@H](Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)c1ccc(-c2cccnc2)cc1 301454387 BFBNRGMSIQFMIF-HNNXBMFYSA-N 395.422 5.250 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 303652026 ULBRFVMIARNBTI-QGZVFWFLSA-N 388.442 5.110 30 20 GKED O=C1CC[C@H](C(O)=Nc2sc3c(c2C(=O)C2CC2)CCC3)c2ccccc21 328855544 CRTMLAVLTKZFHE-HNNXBMFYSA-N 379.481 5.178 30 20 GKED CC(C)CC(O)=Nc1ccc(Cl)c(/C(O)=N/[C@H]2CCOC3(CCC3)C2)c1 330199531 VOAFOJPTGMPPRU-HNNXBMFYSA-N 378.900 5.380 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H]1CCCC(F)(F)C1 409961950 GGKGRQQSBDZSQI-SKDRFNHKSA-N 389.286 5.251 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(C#N)cc1Cl 426147370 BBKQVJSSNXNUNV-NSHDSACASA-N 381.785 5.455 30 20 GKED COc1ccc2cc(CNC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2c1 431697882 JSKNICSZEPZMEV-QHCPKHFHSA-N 387.483 5.083 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ncc(-c2ccccc2)o1 431977327 LPDBOLXQFHGUIW-YLJYHZDGSA-N 388.471 5.137 30 20 GKED COc1cccc2c1[C@H](C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)CC2 432880253 NNOLZWIZHPMUFH-OAQYLSRUSA-N 398.462 5.336 30 20 GKED N#CCCC[C@@H](NC[C@H](O)Cn1c2ccccc2c2ccccc21)c1ccccc1 433019108 LPGQKFXWDFYDEF-XUZZJYLKSA-N 397.522 5.180 30 20 GKED Fc1cccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1F 436407234 IOVHOKGZXPVTIZ-AWEZNQCLSA-N 383.282 5.767 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc(C#N)cs1 437671987 HHFLKRNBFBGLAQ-UHFFFAOYSA-N 382.416 5.121 30 20 GKED CN(CCC(C#N)(c1ccccc1)c1ccccc1)Cc1nc2ccccc2o1 444658097 AGLXIUBNZLHRRI-UHFFFAOYSA-N 381.479 5.160 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)[C@@]1(C#N)C[C@@H]1C 450005123 UVDKTQZBCBOVQW-NPMXOYFQSA-N 390.462 5.220 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1CCc1ccccc1)c1ccccc1 458795668 CVABKUUDQAJXKQ-PKTZIBPZSA-N 375.516 5.228 30 20 GKED CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H](C)c1cc2ccccc2o1 458798659 IHWLIFXHLIBMCY-NQIIRXRSSA-N 389.499 5.960 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc(C3CC3)ccn2)cc1 461446174 LAMMQELBAXUNKF-UHFFFAOYSA-N 385.492 5.375 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)[C@@H](C)c2cccc(C#N)c2)c1 463940220 CMYDABSEDGWRMR-ZDUSSCGKSA-N 378.419 5.263 30 20 GKED C=CCC[C@H](NC(=O)CCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 469691695 SGFYBWDKKIKGQA-INIZCTEOSA-N 382.451 5.227 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)C[C@@H](CC#N)c2ccccc2)cc1 474413964 NRQZYKWJVPMZEW-FYYLOGMGSA-N 376.500 5.226 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](CSc2ccccc2)C1 475549875 PUEJJJPNTRUXPO-LJQANCHMSA-N 394.584 6.185 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1 475567196 CHRQZCXIOIUNCF-GGAORHGYSA-N 377.532 5.105 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1cccc(OC(F)(F)F)c1 481254795 JSYDBKNPZCNPGT-NSHDSACASA-N 399.210 5.070 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 483642016 KZABMZSFTKDSLM-UHFFFAOYSA-N 395.418 5.141 30 20 GKED C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 486955052 JTQYVNQYGWUWQS-SECBINFHSA-N 379.275 5.354 30 20 GKED C[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 487175442 IYHLMOBCCLNGDO-JXFKEZNVSA-N 388.433 5.750 30 20 GKED Cc1cc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)ccc1-c1ccccc1 494253802 LDHUYBIPUKGMKP-UHFFFAOYSA-N 392.506 5.224 30 20 GKED N#CCCCn1cc(C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2)c2ccccc21 497005506 YRJFRBFMTBUDMM-GOSISDBHSA-N 391.902 5.228 30 20 GKED Cc1cc([C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)c(C)s1 498040698 YPLVVSOENZAHAO-HNNXBMFYSA-N 392.549 5.879 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1N1CCCCC1 499588241 URDDWFIJHQQILU-KRWDZBQOSA-N 379.529 5.181 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 500449729 HJMZZAVGLXJWKM-MSOLQXFVSA-N 390.508 5.177 30 20 GKED N#CCCCOc1cccc(NC(=O)c2csc(-c3ccc(F)c(F)c3)n2)c1 502948064 HZRCLLVOISIQIM-UHFFFAOYSA-N 399.422 5.023 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)c3cc(C#N)ccc3Cl)cc2)cs1 505242645 NHFGIUZJUMVEGE-GFCCVEGCSA-N 381.888 5.135 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(F)cc1OCCC(F)(F)F 505791615 YOQRDPXJIANOLA-SNVBAGLBSA-N 390.299 5.009 30 20 GKED N#C[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)c1cccc(C(F)(F)F)c1 505954564 PADIYGAHPLDHSU-HXUWFJFHSA-N 394.396 5.218 30 20 GKED CCSc1cccc(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c1 506861286 WELVAVJDJFUSTE-UHFFFAOYSA-N 395.528 5.182 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(Cl)c2Oc2cccnc2)c1 507489908 ZXLBDYLUBCIHPR-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CC1CCC(CNC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)CC1 508378216 WQXWBCNEOANIJJ-MYKUNDNFSA-N 382.504 5.105 30 20 GKED Cc1noc(C)c1NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 510123799 LOOCLLMYXTXGGT-UHFFFAOYSA-N 396.834 5.040 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 514514368 HQZLZBPXQZPCKE-CYBMUJFWSA-N 390.314 6.019 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CCc3ccccc3C2)cc1 514641266 TYVMLPMAUMBRLT-JOCHJYFZSA-N 398.531 5.138 30 20 GKED CC(C)c1nc2cc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2o1 519576936 ZRCKTMLRANREJK-SFHVURJKSA-N 376.460 5.508 30 20 GKED Cc1ccc(N(C(=O)c2ccc(C#N)cn2)c2nc3ccccc3s2)c(C)c1 522718098 FGJKFZCIJCIIEB-UHFFFAOYSA-N 384.464 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCn2cc(C(F)(F)F)nc21 529134035 ACFOYDLBWLBPEJ-INIZCTEOSA-N 391.437 5.270 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)CC1 537096709 IPORTWDPMMIDGT-YGZJECHCSA-N 380.919 5.164 30 20 GKED C=CCC[C@H](N[C@@H]1CC(=O)N(C)c2ccccc21)c1ccc(C(F)(F)F)cc1 537950412 WCZVTEQGOIXTKV-RBUKOAKNSA-N 388.433 5.410 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1nc2ccccc2s1 539264280 YHLLYPHIOHMDEN-AWEZNQCLSA-N 381.526 5.599 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 540777610 WBNHTWVKAHPEJC-RTBURBONSA-N 394.540 5.033 30 20 GKED CSCC[C@H](C)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542084978 IDKBMPQZEHORHC-IRXDYDNUSA-N 381.545 5.069 30 20 GKED C[C@@H]1CCN(C(=O)c2ccc(F)c(C#N)c2)c2cc(C(F)(F)F)ccc2S1 551564982 YVHQBEULSVHYBN-LLVKDONJSA-N 394.393 5.247 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1F 564522643 ZUWKSTUZKFMJIL-CQSZACIVSA-N 393.393 5.156 30 20 GKED Cc1nnc(N(CCC(C)C)C(=O)c2cc(C#N)ccc2Cl)c2ccccc12 571836897 RAGVYPYTXSLPPP-UHFFFAOYSA-N 392.890 5.156 30 20 GKED N#Cc1ccc(CN(Cc2cccc(C(F)(F)F)c2)Cc2ccccn2)c(F)c1 577424447 HZEYRXJNDMMOKT-UHFFFAOYSA-N 399.391 5.314 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N(CCC#N)c2ccc(F)cc2)cc1F 577895816 ZCASAGHTLJDJSP-UHFFFAOYSA-N 394.396 5.640 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(C(F)(F)F)ccc1Cl)c1ccccc1 599970644 VNBGCNVKSGFECD-KRWDZBQOSA-N 380.797 5.524 30 20 GKED Cc1ccc2c(c1)[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)CC2 609309381 BIORSPMHYNTZJZ-HSZRJFAPSA-N 398.531 5.576 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 609496445 XNMZXEZQDCZVAL-SFHVURJKSA-N 379.510 5.191 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C#N)C2CCCCC2)nnc1-c1cccnc1 609648703 QJTYQWRNBGIKAF-FQEVSTJZSA-N 389.528 5.202 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cccc(OC3CCCCC3)c2)c1 609970510 MIDIQSLUAXVOHF-UHFFFAOYSA-N 386.398 5.123 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 611303308 OCTALQMJNKKIRE-OAHLLOKOSA-N 390.418 5.076 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4c(s3)CCCC4)n2)cc1 612941798 YTBVPTQCKKJDQI-INIZCTEOSA-N 378.522 5.549 30 20 GKED C=CCC(C)(C)CNC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 644961528 BNGMAGZOSHPNNI-UHFFFAOYSA-N 382.451 5.090 30 20 GKED CC(C)n1cc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cn1 647229808 GGGDYAQASNANFT-UHFFFAOYSA-N 383.311 5.366 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676725031 KAYDKRCQDZAPMY-YVEFUNNKSA-N 395.425 5.378 30 20 GKED CCc1c(C)sc(NC(=O)Cc2sc(C)nc2-c2cccs2)c1C#N 727790835 VBBYPPLCLAJABB-UHFFFAOYSA-N 387.555 5.165 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cc(C(F)(F)F)ccc2F)S1 733204983 GJXXXQCHLZFKCT-DHDCSXOGSA-N 394.393 5.353 30 20 GKED C=CC[C@@H](NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1ccncc1 734460362 PARWKDXDGFJAGB-HSZRJFAPSA-N 384.479 5.145 30 20 GKED C[C@H](CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccc(F)c1 739589537 AYFDTTNTXZQQOW-OAHLLOKOSA-N 378.472 5.236 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)OC(=O)/C=C\c1ccccc1C#N 739592754 XPHYKGSHOADPAN-QOHRORDFSA-N 388.492 5.232 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc1OC 741843371 FRUWWFYFTJANCS-ALCCZGGFSA-N 390.892 5.133 30 20 GKED Cc1ccccc1O[C@@H](C)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743095519 LASLDZWKELZODK-WMZHIEFXSA-N 399.494 5.240 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1)c1cccc(C#N)c1 743490548 HUOPQLXSQBYABQ-ZWKOTPCHSA-N 385.467 5.028 30 20 GKED N#C[C@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 744017088 YCXZKESTKASWMK-ZEQRLZLVSA-N 390.486 5.828 30 20 GKED N#Cc1csc(/C=C\C(=O)c2ccc(Br)cc2Br)c1 748439574 WHZNXZAQKNZYOZ-RQOWECAXSA-N 397.091 5.041 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)c1ccc(Cl)c(C#N)c1 754382000 BOLSTBGBFNBKKH-UHFFFAOYSA-N 385.851 5.119 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2c(F)ccc(C3OCCO3)c2Cl)cc1 761782290 LUPFDTGVXMHRTE-CQSZACIVSA-N 390.886 5.333 30 20 GKED Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 769695213 YMDAFCPELSLFRA-NRFANRHFSA-N 399.450 5.428 30 20 GKED C=CCC[C@@H](C(=O)OCc1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 778551272 HTNIJYAIRWJFPR-GOSISDBHSA-N 382.847 5.183 30 20 GKED Cc1cc(CNC(=O)Nc2ccccc2O[C@H](C)C#N)ccc1-c1ccccc1 779449021 HNZISETZXKQQLR-GOSISDBHSA-N 385.467 5.275 30 20 GKED Cc1ccc(CCC2CCN(C(=O)Nc3ccccc3O[C@@H](C)C#N)CC2)cc1 780671856 YLOIKOGLCGNHET-IBGZPJMESA-N 391.515 5.163 30 20 GKED C=CCCC[C@@H](C)Sc1nnc([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)o1 795257907 HNPBWDRVDYJLEP-HUUCEWRRSA-N 381.542 5.021 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCC(C)(C)c3ccccc32)ccc1OC 795803212 ODFMUZHXFGQDJX-RXVVDRJESA-N 378.516 5.278 30 20 GKED CSc1c(F)cccc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 797881136 NPSAQDVVKQWJLT-UHFFFAOYSA-N 382.485 5.078 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 817325250 ZYRMRWQAMKZXBF-FQEVSTJZSA-N 393.487 5.199 30 20 GKED O=C(/C=C\c1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(C(F)F)nc1 853009628 MHYOFXSRTPNHJG-HQQUCIOCSA-N 393.817 5.127 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2NC(=O)CC1(C#N)CCCCC1 855813286 YLOIIIDEJUYYIE-IBGZPJMESA-N 397.519 5.001 30 20 GKED O=C1/C(=C\c2ccc(C(F)F)nc2)CCC/C1=C/c1ccc(C(F)F)nc1 865214234 POJSJHWCIMNQNK-SFGFDRCGSA-N 376.353 5.572 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 887767693 TYFINJKCBOXFNB-GLJUWKHASA-N 397.466 5.277 30 20 GKED CC(C)=CCC[C@@H](C)CC=Nn1cnnc1SCc1ccc(Cl)cc1 916546535 WZTSSMCJKQBTOF-MRXNPFEDSA-N 376.957 5.830 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CSCc2cccc(C)c2)cc1 916955947 VYQUTZZLPMWAAA-UWJYYQICSA-N 394.540 5.089 30 20 GKED Cc1ccc(O[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976487 POYNSLBOZAZDPG-KDOFPFPSSA-N 396.899 5.416 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1F)c1nc2cc(C(F)(F)F)ccc2s1 917045572 YDYHTAYUPDQKGB-SCXUMTSISA-N 390.361 5.344 30 20 GKED CCCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Cl)c(Cl)c1 1776033329 ILUPCNVTXZNLHV-UHFFFAOYSA-N 385.678 5.961 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C(F)(F)F)cc1F 1776354378 CFGIETWGNRIEKY-DAXSKMNVSA-N 396.336 5.226 30 20 GKED CCCCCCCOc1ccc(CNCc2ccc(CCCC(=O)O)cc2)cc1 1776786999 JLBZYWIMHVXEOU-UHFFFAOYSA-N 397.559 5.733 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2ccccc2C(=O)O)cc1 1777559807 FLPJIJANSMTQJL-QINSGFPZSA-N 382.415 6.003 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@@H]3CCC5)s2)cc1 1777671021 UEHWNXFSCAMNCV-JZQBQCRLSA-N 386.472 5.813 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3cc(Br)ccc3C2=O)c(Cl)c1 1777673294 KXAJMECUXCREGA-GHXNOFRVSA-N 391.648 5.013 30 20 GKED C=CCn1c(SCc2ccc3ccccc3n2)nc2sc(C)c(C)c2c1=O 7119727 BSYKRQVSFVPBJC-UHFFFAOYSA-N 393.537 5.101 30 20 GKED C=CCn1c(SCc2csc(-c3ccsc3)n2)nnc1-c1ccco1 29550193 DISFWNHYAXEHDE-UHFFFAOYSA-N 386.527 5.201 30 20 GKED CCN(Cc1ccc(Cl)s1)/C(O)=N/c1nnc(-c2ccsc2)s1 52496085 IZJSRUZVPHGGMO-UHFFFAOYSA-N 384.939 5.049 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccn2)cc1Cl 107648058 NXQSOUTYLMVVBZ-QGZVFWFLSA-N 382.250 5.296 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccccc2SCC(F)(F)F)cc1 107697514 UOAGMIOVAMGCQE-UHFFFAOYSA-N 396.459 5.085 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccccc2OCc2ccccc2)cc1 110964379 DNMPYDCRKMCXBV-XAVZPLJISA-N 383.447 5.453 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1 119929989 XOUPMHNSFQBQCS-ZDUSSCGKSA-N 388.265 5.007 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)n1 125449578 WTKWWALXABWFGM-QFBILLFUSA-N 380.517 5.153 30 20 GKED CN(C(=O)c1oc2ccccc2c1COc1ccccc1)c1cccc(C#N)c1 143471458 OALZUFRJJHBFTE-UHFFFAOYSA-N 382.419 5.160 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(NC(=O)CCC)c1 156799851 NKOQXSUALFHDPK-UHFFFAOYSA-N 391.924 5.360 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 159807840 PCKZPKKKNZYRTE-MEBBXXQBSA-N 385.876 5.048 30 20 GKED COc1cccc([C@@H](N[C@@H](C)c2cccc(C#N)c2)c2cc(F)ccc2OC)c1 181847720 XHOKBPSGNLSFFZ-UPCLLVRISA-N 390.458 5.155 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](c1ccccc1)c1nccs1)c1ccc(F)c(F)c1 185460418 WYSYQKNMZCUBJZ-RBUKOAKNSA-N 399.466 5.127 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1)c1ccccc1 188068406 PHUZGOQGPBPTQD-FIPFOOKPSA-N 395.568 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCCc2nc(C)sc21 191490555 XFLCERJMEWQZJF-LJQANCHMSA-N 383.561 5.845 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC(c3ccncc3)CC2)cc1 191870598 INOKZWPDNHFTOD-UHFFFAOYSA-N 398.466 5.157 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@H]4CCCC[C@H]4C)no3)C2)c1 329547104 AYMWZCFADOAUIM-AOIWGVFYSA-N 382.508 5.097 30 20 GKED CCCc1c(NC(=O)c2c(Cl)cccc2Cl)cnn1-c1cccc(C#N)c1 372678912 ZXWBZZPGUZWROX-UHFFFAOYSA-N 399.281 5.256 30 20 GKED C=CC[C@@H](CC)NC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 410136467 SEJUUMWMULMOBK-CYBMUJFWSA-N 376.909 5.047 30 20 GKED CC(C)[C@H](NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1ccc(F)cc1 410214963 KCTUOBAYQVYBJV-FSSWDIPSSA-N 379.479 5.004 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)c1ccccc1 428853541 ATWIDKZJJFENSG-RTBURBONSA-N 395.572 5.348 30 20 GKED C=CCN(Cc1cnc(-c2ccccc2OC)nc1)Cc1ccc(Cl)s1 430008899 XLIYFMLPBGEANP-UHFFFAOYSA-N 385.920 5.055 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2COc2ccccc2)s1 430631391 BIUUKORDSWOQIO-IBGZPJMESA-N 390.508 5.510 30 20 GKED N#CCCC[C@H](NC(=O)NCC1(c2ccc(F)cc2Cl)CC1)c1ccccc1 431469629 IAWJRJBYLNQIRG-FQEVSTJZSA-N 399.897 5.245 30 20 GKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 437624580 KBOPRHTZTGXAOP-UGKGYDQZSA-N 382.891 5.163 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 438040893 VMFMAFUGWUJKBA-UYAOXDASSA-N 395.572 5.874 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C1CC1 444398832 RIKHAPVTTQJNSM-INIZCTEOSA-N 387.439 5.701 30 20 GKED N#CCC[C@H](NC(=O)Nc1cc2c(cc1Br)CCC2)c1ccccc1 446421393 SRRULBUKKMGPMI-SFHVURJKSA-N 398.304 5.104 30 20 GKED CCCCn1ncc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1C 448432245 WCAOSNLBSUXPAM-UHFFFAOYSA-N 392.434 5.047 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N1CCCC[C@@H]1c1ccc(Cl)cc1 453447389 AXSAIMYLILNLPH-MOPGFXCFSA-N 386.927 5.091 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1CCC(c2ccccc2)CC1 463744521 JFZQJFHUDHHENY-QHGAOEGBSA-N 378.541 5.851 30 20 GKED C=C(C)Cn1c(SCC2CCC(C(F)(F)F)CC2)nnc1-c1ccncc1 471447479 SQXSAMXSTYLGJH-UHFFFAOYSA-N 396.482 5.377 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)Sc2ncc(C(C)(C)C)o2)c1 474391475 AUVFLIPRQDZQQJ-INIZCTEOSA-N 385.533 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1 475550038 MZCWUPXMVOUUBQ-JOCHJYFZSA-N 391.559 5.277 30 20 GKED CCCN(Cc1ccccc1Br)C(=O)Nc1cc(C#N)ccc1C 476831237 SPFGCQLIVJORKN-UHFFFAOYSA-N 386.293 5.073 30 20 GKED COc1ccc(CN[C@@H]2CCCC[C@H]2Cc2ccccc2)cc1OCCCC#N 477336002 FDXKBQMVCMTOBL-XZOQPEGZSA-N 392.543 5.269 30 20 GKED CCc1c(C)sc(NC(=O)c2sc(-c3ccccc3C)nc2C)c1C#N 483996848 WTIIIAQSGCIUBH-UHFFFAOYSA-N 381.526 5.483 30 20 GKED N#CCCC[C@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1ccccc1 487357529 RRCQEZPGRMHMCA-DEOSSOPVSA-N 394.478 5.467 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1ccccc1C 488912045 NDAZBVYDPMMSNQ-UHFFFAOYSA-N 390.487 5.419 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2CCCC(F)(F)C2)cc1 488978576 MYOHHKFFPVKPFT-QGZVFWFLSA-N 386.467 5.158 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1nc2ccccc2[nH]1 495221521 OZJKTRDOCBUXKB-AWEZNQCLSA-N 395.340 5.332 30 20 GKED CCN(C(=O)c1cc(C)n(-c2cccc(C#N)c2)n1)[C@H](C)c1cc2ccccc2o1 504077153 RRKGDJWIAWHPTI-QGZVFWFLSA-N 398.466 5.022 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)N(CCC#N)CCC(C)C)c12 505197906 RVNINVLJBMZLSX-UHFFFAOYSA-N 397.567 5.020 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccc(C#N)cc1 505364462 QJSWYDZSJLZSEG-JLTOFOAXSA-N 395.915 5.423 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Nc3ccc(F)c(Cl)c3)n2)cc1 505772175 RAXJVRUAKZVUGX-CQSZACIVSA-N 385.851 5.157 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccc(Cl)cc1 505818575 BQADXUTYXDDHSV-GOSISDBHSA-N 398.249 5.175 30 20 GKED N#CC1(CCCS[C@H](c2ccccc2)c2ccc(F)c(F)c2)CCOCC1 507704451 SKLJUUPVSMKIKA-OAQYLSRUSA-N 387.495 5.888 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CC1 507829137 KOKWURPPRDBTOV-UHFFFAOYSA-N 379.312 5.488 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)n1 513681896 LJSVBEAHRYMQLQ-ZDUSSCGKSA-N 393.320 5.977 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 518120107 SOIXDKIJWFIHQO-CABCVRRESA-N 391.323 5.741 30 20 GKED COc1c(Cl)cc(NC(=O)CCCCOc2cccc(C#N)c2)cc1Cl 518378586 WSCFXNKLMWRSBI-UHFFFAOYSA-N 393.270 5.061 30 20 GKED CC(C)(NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc(Cl)c1 523095583 CMZYYSAGKMCIFH-UHFFFAOYSA-N 391.858 5.064 30 20 GKED N#Cc1c(NC(=O)c2ccnc(Oc3ccccc3)c2)sc2c1CCCCC2 523182861 FEHYUUYWAYIYBC-UHFFFAOYSA-N 389.480 5.328 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2cccc(OCCCC#N)c2)c1 524216146 ZDPQBXQXLAHICQ-DEOSSOPVSA-N 397.478 5.449 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 525003522 HLCPORIZLJLCLG-UHFFFAOYSA-N 389.263 5.971 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C)c1ccccc1 533904092 DGVLCHABGWZCBW-HXUWFJFHSA-N 390.527 5.166 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C2CCC(F)(F)CC2)cc1 533958814 JJNQKFNNUGPXMJ-UHFFFAOYSA-N 386.398 5.123 30 20 GKED CCN(C(=O)c1c[nH]c2cccc(Br)c12)[C@@H](C)c1ccc(C#N)cc1 536074149 OBMNOAVVHPFPBG-ZDUSSCGKSA-N 396.288 5.025 30 20 GKED Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 537059948 HIVAEZJUHAKXTR-MBSDFSHPSA-N 395.572 5.315 30 20 GKED C=CCN(C(=O)c1coc(-c2ccccc2Cl)n1)c1nc2c(s1)CCCC2 538449564 DSHJUZYYWCKUDM-UHFFFAOYSA-N 399.903 5.163 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)Nc2ccc(-c3ncco3)cc2)cc1 538620739 ZPZLLOZOCRYECB-UHFFFAOYSA-N 394.434 5.202 30 20 GKED C[C@@H](NC(=O)c1ccccc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 541070640 JVRHPYDHCHCIGF-OAHLLOKOSA-N 394.396 5.735 30 20 GKED CN(C(=O)CCCC(F)(F)F)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 542180821 IPIZGQUFBCNSSC-LBPRGKRZSA-N 395.265 5.500 30 20 GKED N#C[C@H](C(=O)c1cccnc1C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 544146768 HQQYCPIXADXLFE-MRXNPFEDSA-N 379.872 5.226 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(C)C)nc1C 549338211 LYODMSATMDYXAS-UHFFFAOYSA-N 386.455 5.133 30 20 GKED C=CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 557397610 JUDDFYVWIQZJNN-ZCXUNETKSA-N 397.478 5.247 30 20 GKED Cc1ccccc1N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 557554303 SKWHFVSXUCCREU-SFHVURJKSA-N 381.545 5.243 30 20 GKED Cc1cc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(C)c1Cl 561136668 OXPGEDHSMVXUJV-HNNXBMFYSA-N 388.920 5.369 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)c2cccc(-c3csc(C)n3)c2)cc1 562322988 GDBHETYKJYQKRE-NRFANRHFSA-N 375.497 5.018 30 20 GKED CCCc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1C1CCCC1 564128380 FKUVVWOCIQRVNF-MRXNPFEDSA-N 396.560 5.455 30 20 GKED CC(C)c1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cs1 588349149 ZJHIZPKMJUQMMP-CYBMUJFWSA-N 387.917 5.533 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)C[C@@H]1CCCO[C@H]1c1ccccc1 589499686 ZISSXLYYBZOJKQ-FPOVZHCZSA-N 388.433 5.177 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1nc2cc(F)ccc2s1 592975786 RWAMMUHPIACFIX-GOSISDBHSA-N 388.423 5.718 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccn1)C1CCC1 599736156 BKASSJYHNUVNRK-MGPUTAFESA-N 380.517 5.139 30 20 GKED Cc1cc(Br)ccc1[C@H]1CCCN1C(=O)Nc1cccc(CC#N)c1 599796095 ZVQULUMAXIUYEX-LJQANCHMSA-N 398.304 5.193 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2)n1 607009966 TUIYCYJFVZUNMA-HNNXBMFYSA-N 393.468 5.357 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 608862688 JCKOCDKZZDKVPB-IBGZPJMESA-N 387.405 5.531 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2ccccc2[nH]1 609061850 IYFBCUHEFWDFRS-UHFFFAOYSA-N 381.435 5.179 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3cccc(OCCCC#N)c3)sc2c1 609149512 VTJXNDKSRHWDPX-UHFFFAOYSA-N 384.888 5.798 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCCC1 609399151 BEXZHRIEUYYASX-VGOFRKELSA-N 393.556 5.991 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1ccc(Cl)c(Cl)c1 609463636 OYUPGWCCQQZJEO-CQSZACIVSA-N 379.630 5.388 30 20 GKED N#C[C@@H](Sc1nc(O)c2c(-c3ccc(F)cc3)csc2n1)C1CCCCC1 609649074 VQVXITIHBIVZMD-MRXNPFEDSA-N 399.516 5.768 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609682638 UQPSQOHQZVOUKM-YLJYHZDGSA-N 398.466 5.155 30 20 GKED C=CCN(C(=O)[C@@H]1CCC[C@@H](C)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610169106 BCKYVJPFYUTWAH-GDBMZVCRSA-N 385.489 5.064 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)c1ccc(F)c(F)c1 610223830 MTSUKLLSJANFBO-CQSZACIVSA-N 393.393 5.074 30 20 GKED C[C@H](NCC1(c2ccc(Cl)cc2Cl)CCOCC1)c1ccc(C#N)cc1 610341457 RYUOICZYFNCALQ-HNNXBMFYSA-N 389.326 5.264 30 20 GKED Cc1ccc2nc(C)c(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc2c1 613403297 NELHGXSHOJTOHS-MRXNPFEDSA-N 391.883 5.605 30 20 GKED C=C(C)Cn1c([C@H]2CC[C@@H](C)O2)nnc1N1CCC[C@@H]1c1ccccc1Cl 624983184 NQRPGBDTPMYLIX-ATZDWAIDSA-N 386.927 5.089 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(C(F)F)nc1)c1ccc(C(F)(F)F)cc1 657929987 HUIZVVCPQINGOQ-CXAGYDPISA-N 384.392 6.396 30 20 GKED COc1cccc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)c1OC(F)F 681135474 QTSRFIOIJJVXJK-UHFFFAOYSA-N 397.290 5.563 30 20 GKED CN(CCC#N)c1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)cc1 729685676 JLYSOMYYEBOIKZ-HSZRJFAPSA-N 381.951 5.711 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417783 SOCCOMABHNMDGR-GUYCJALGSA-N 396.487 5.377 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1nc2cc(F)ccc2s1 730924413 YWMNAUJEZMQXPM-IPMKNSEASA-N 386.451 5.569 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3ccc(F)cc3C)cs2)cc1 731321503 HETLOBNBJJCFJJ-WMZJFQQLSA-N 383.444 5.074 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2Cc2ccccc2)c1 733842594 YQGRJYKIBKJFMW-QFIPXVFZSA-N 399.494 5.280 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CCc2ccccc2C1 734060419 WMJKHYPGMSLTSQ-LOSJGSFVSA-N 395.506 5.363 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2ccc(N3CCC(O)CC3)cc2)c1 734234675 BDBNCDHAQZSYCI-NTEUORMPSA-N 397.518 5.519 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccccc3Br)c2)s1 740010562 FFXJDSRUUAPGFN-UHFFFAOYSA-N 383.314 5.339 30 20 GKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1nc(Cc2ccccc2)no1 742971244 OYGDSMCJZACHDJ-CQSZACIVSA-N 399.903 5.211 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 745828824 WCXYXMUILMGDQD-NTKDMRAZSA-N 385.511 5.768 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)cc1 747377683 ZJEMSYVTEKYTJA-DNVJHFABSA-N 386.882 5.738 30 20 GKED CC[C@H](C)n1c(SCCCOc2ccc(C#N)cc2)nnc1-c1ccccc1 749753234 ZSWWBLQNTUUQPQ-KRWDZBQOSA-N 392.528 5.349 30 20 GKED C#CC[C@H](NC(=O)N1CC=C(c2c(C)[nH]c3ccccc23)CC1)c1ccccc1 757765096 ZDCUQENXHDGPBI-QFIPXVFZSA-N 383.495 5.040 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](Cc2nc(C)no2)c2ccccc2)cc1 760052931 UGXJXCKSVPBKOR-HRAATJIYSA-N 397.906 5.144 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 764755683 HTFVXJQEWFMPAX-RBUKOAKNSA-N 378.472 5.628 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)Nc1ccc(F)cc1OCC#N 766543304 FOHPFUYNIXQNDA-LUAWRHEFSA-N 379.218 5.077 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1cscc1Cl 771885258 QHTIIHIAJRAUFJ-UHFFFAOYSA-N 389.720 5.138 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cn(Cc2ccccc2)c2ccccc12 779988830 JYDQCPXTIJFJQV-LJQANCHMSA-N 381.479 5.593 30 20 GKED N#Cc1cnc2c(c1)CC/C(=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C2=O 788357308 QGYSTBNHRUOXCH-QLKAYGNNSA-N 396.290 5.203 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 789449616 IBKFQRIDPPNZMN-UHFFFAOYSA-N 391.559 5.801 30 20 GKED N#CC[C@H](CC(=O)OCc1csc(-c2ccccc2F)n1)c1ccccc1 795985713 MJDMHFDSZLOTQW-MRXNPFEDSA-N 380.444 5.080 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@@H](C(F)(F)F)C3)n2)cc1 796800977 XMPRTMROYIGHAM-RBSFLKMASA-N 378.419 5.273 30 20 GKED C=CC[C@H](OC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 797552634 GNFZBEAQYCMMMJ-XLIONFOSSA-N 399.277 5.408 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)ccc2c1 797571327 QLZYMVQWZRWPKY-FUKWUPMWSA-N 390.508 5.492 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccccc1COc1cccc(C=O)c1 800592822 MFPTZLKTWGCELE-UHFFFAOYSA-N 385.463 5.449 30 20 GKED CCc1ccc(CC(Cc2ccc(Cl)cc2)=NOCCC(F)(F)F)nc1 807983623 RXJFJRNSZQOTSW-UHFFFAOYSA-N 384.829 5.408 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1cc(C(F)(F)F)ccn1 813214337 VQXZSTNAMKUHFL-XQQFMLRXSA-N 399.199 5.387 30 20 GKED Fc1cc2nc(NN=C(CCC(F)(F)F)CCC(F)(F)F)[nH]c2cc1F 853287848 WBZLHIWYNRWSLE-UHFFFAOYSA-N 388.262 5.294 30 20 GKED O=C1/C(=C\c2ccc(OCc3ccncc3)cc2)CSc2ccc(F)cc21 915986135 WSVRDYHODSWYSS-BOPFTXTBSA-N 377.440 5.172 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4cc(C)oc4C)c23)cc1 916357462 RZWJFZKCTLPTHH-UHFFFAOYSA-N 392.484 5.413 30 20 GKED CCCc1sc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1CC 916916563 WFKUBVNACSUKHR-GOSISDBHSA-N 390.508 5.377 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(C)cc3C)n2)cc1 920143291 OPCVZCXQYLJCEW-FQEVSTJZSA-N 390.508 5.245 30 20 GKED CC(CCCCCCC(=O)O)=NNc1cc(Cl)ccc1Br 1776105231 UHEWRHSCPMUZGS-UHFFFAOYSA-N 375.694 5.316 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C(F)F)c(F)c1 1776354454 LGYNTJQKHOGNIL-QPJJXVBHSA-N 378.346 5.145 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1csc3ccc(C(=O)O)cc13)CO2 1776374852 YTVHKJUEQWQIFB-VIZOYTHASA-N 378.449 5.382 30 20 GKED CC[C@@H](C)Oc1cc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)ccc1OC 1776694869 JDWOZLUIEASYSN-PWDRBQJJSA-N 394.467 5.173 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](CC(=O)O)c2ccccc2)c1 1776788692 MOKKVUIUIUPUEB-QFIPXVFZSA-N 383.532 5.384 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c(Cl)c1 1777403173 GTDUMXZFULZQKF-UXBLZVDNSA-N 398.867 5.916 30 20 GKED COc1ccc2nc(NC(=O)c3ccccc3-c3ccccc3C#N)sc2c1 28714776 QVYUQRQZGHQTOM-UHFFFAOYSA-N 385.448 5.096 30 20 GKED N#C[C@@H](C(=O)c1ccsc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538199 WZHIQSXTJUSOIG-LBPRGKRZSA-N 379.293 5.668 30 20 GKED O/C(=N\c1nnc(-c2ccccn2)s1)c1cnc(-c2ccccc2Cl)s1 50333086 OWPVNGWLCAKHML-UHFFFAOYSA-N 399.888 5.013 30 20 GKED COc1ccc(OCc2nc(-c3cn(CCC#N)c4ccccc34)cs2)cc1 63629993 GYPQDANFOXUMQJ-UHFFFAOYSA-N 389.480 5.266 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1N1CCCC1 66954535 HSSBVPCLAVYTTA-QGZVFWFLSA-N 394.544 5.003 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 97169158 FYWICMMIQBELNB-WOJBJXKFSA-N 386.417 5.118 30 20 GKED CCCO[C@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 109027632 PIDHZUGEKAJMGN-FQEVSTJZSA-N 393.487 5.164 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)cc1-c1ccc(F)cc1 119835568 LVAWNPMOOQTJEU-QGZVFWFLSA-N 389.455 5.239 30 20 GKED N#C[C@@H](C(=O)c1cncc(-c2ccccc2)c1)c1nc(-c2ccccc2)cs1 124592596 DNCZHJPUQLEJBG-FQEVSTJZSA-N 381.460 5.362 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2c([nH]c3ccccc23)C1 129444427 QPNPIYGXPAQBHS-OAHLLOKOSA-N 390.512 5.010 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(F)c1F 161549148 OWFRMJYXDQDKJG-OLZOCXBDSA-N 375.444 5.099 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccccc2)n1)CC1CCCCC1 165829609 ZVDSVGAICHJQBH-UHFFFAOYSA-N 383.561 5.396 30 20 GKED COc1ccc(-c2cnc(CNc3ccccc3SC[C@@H](C)C#N)o2)cc1 174310320 FSRJAORRIOZPDY-HNNXBMFYSA-N 379.485 5.214 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nn(-c2ccccc2)c2c1CCC2 180589841 BOVIKOGZCPPCCF-KRWDZBQOSA-N 388.540 5.367 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)Cc1ccsc1 188917853 IDGKFKKJRNAIRY-HZPDHXFCSA-N 387.574 5.627 30 20 GKED C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)c1cccc(C#N)c1 189791231 VGQHBPNLDJKIEN-QGZVFWFLSA-N 397.507 5.113 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1C[C@@H](O)c1cccs1)c1ccccc1 246253985 FRVWIPYUIVUXLA-HSALFYBXSA-N 384.545 5.053 30 20 GKED C[C@H](OC(=O)/C=C\c1ccccc1C#N)c1ccccc1NC(=O)c1ccccc1 255616371 FVJAEVQNBRNMAD-ZPWFJYARSA-N 396.446 5.128 30 20 GKED CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 303383225 WMBPSFOKAVJOIR-HZPDHXFCSA-N 388.558 5.395 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 303487710 KFYVOKHPYWKNQO-IFMALSPDSA-N 396.918 5.672 30 20 GKED OC(=Nc1cccc2c1CN(CC(F)(F)F)C2)c1coc(C2CCCCC2)n1 328652399 KKMAMOSUNPICED-UHFFFAOYSA-N 393.409 5.237 30 20 GKED C[C@H](/C(O)=N/CC1CCCCC1)N1CCC([C@@H]2C(O)=Nc3ccccc32)CC1 328704243 OSOCYQYOAKJWKO-IERDGZPVSA-N 383.536 5.009 30 20 GKED COc1cccc2c1CC[C@@H]2/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329423812 GEANGJRKCOYSKY-UWJYYQICSA-N 393.531 5.146 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1cccc(OCc2ccc(Cl)cc2)c1 428893856 HZEMFDMCJNFKGP-UHFFFAOYSA-N 383.879 5.077 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 428898114 HWBBODNUHJYZMC-UHFFFAOYSA-N 377.366 5.265 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1)c1ccccc1 431330217 FZBFXYNFCJDDDV-FCEUIQTBSA-N 379.479 5.196 30 20 GKED CCCOc1ccc(CN(CCC)C(=O)Nc2cccc(C#N)c2C)cc1OC 431742726 VFXMOKDQNYCRGN-UHFFFAOYSA-N 395.503 5.108 30 20 GKED Cc1cc(C)n(-c2cccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2)n1 432678781 OMVQMTXSKSMCBB-QFIPXVFZSA-N 387.487 5.046 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CC=C(c2ccc(Cl)cc2)CC1 433839272 PVLOYXBIKACDGH-UHFFFAOYSA-N 382.895 5.089 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)s1 436401232 UMLWWNFVWUVJNT-CQSZACIVSA-N 378.341 5.422 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc(F)c(F)cc3F)c2)cc1 437148129 PMZYKLPXXCXDOA-UHFFFAOYSA-N 396.368 5.001 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(OC2CCCC2)c1 437907704 KIESAMHYOMBJJS-PKTZIBPZSA-N 389.499 5.312 30 20 GKED C[C@H](c1ccccc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438644294 CCQBLKIZHUUGGA-MRXNPFEDSA-N 389.430 5.715 30 20 GKED Cc1sc2ncn(Cc3ccc(C#N)cc3Cl)c(=O)c2c1-c1ccccc1 438889467 HCOZNQPMLWPRIZ-UHFFFAOYSA-N 391.883 5.007 30 20 GKED N#Cc1cn(CCc2cc(Cl)cc(Cl)c2)c2ccc(Cl)cc2c1=O 446066720 CGVPIKPZGZSYSR-UHFFFAOYSA-N 377.658 5.076 30 20 GKED CC(C)(C)n1cc(CNCc2ccc(C#N)c(F)c2)c(-c2ccccc2Cl)n1 449733594 IURMTEWEXSFIHW-UHFFFAOYSA-N 396.897 5.259 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)C1 456046547 JFUOKPHDRORWCE-VCPXZDPOSA-N 397.478 5.127 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)NCCCCC#N)cc1 466344077 SLCGJGZVDUXPDU-UHFFFAOYSA-N 389.524 5.138 30 20 GKED C[C@H](Nc1ccc(NC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)cc1)c1ccccc1 471947493 SAIYKSRLLQACAG-AVRDEDQJSA-N 394.478 5.052 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1 472135528 ZYNVZFIIAYQABK-HSZRJFAPSA-N 389.474 5.098 30 20 GKED Cc1ccc2sc(C(=O)N3CCC(Oc4ccc(C#N)cc4)CC3)c(C)c2c1 473437119 ROGIESGJMZGUCC-UHFFFAOYSA-N 390.508 5.073 30 20 GKED C=C[C@](C)(CCOC)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 473953984 WPVOYYISRSAUAL-RNODOKPDSA-N 392.952 5.178 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 476221932 OLCMTKZPOIULKT-GOSISDBHSA-N 399.425 5.516 30 20 GKED C=CCC1(C(=O)NCc2cccnc2Oc2ccccc2OCCC)CCC1 478704062 MFNSJUDWVHLARX-UHFFFAOYSA-N 380.488 5.025 30 20 GKED CC(C)c1c(NC(=O)NCC(C)(C)CCC#N)cnn1-c1ccccc1Cl 482115846 WCVLNEGJTSVDPK-UHFFFAOYSA-N 387.915 5.101 30 20 GKED C[C@H]1N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOC1(C)C 483057971 YXCPLGZFPYBURJ-BEFAXECRSA-N 397.906 5.027 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1nccc2ccccc12 483212491 RLJPTWKXZQVOLL-MRXNPFEDSA-N 389.867 5.502 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1sc2c(c1C#N)CCCCCC2 483444713 XCXCUWDQASPUMB-OAHLLOKOSA-N 382.529 5.420 30 20 GKED O=C(N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1CCC(F)(F)F 486843660 SCDOTKNHOCYKCX-OAHLLOKOSA-N 393.302 5.354 30 20 GKED N#CCCn1cc(-c2csc(-c3cnn(-c4ccccc4)c3)n2)c2ccccc21 503971037 XTXVNBYCMJEVEQ-UHFFFAOYSA-N 395.491 5.531 30 20 GKED CC[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(Cl)s1 504050994 TWYWAULCCQBFDF-QGZVFWFLSA-N 385.920 5.223 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccccc1SCc1cccs1 512865039 QWDPYLPRDRUXNR-UHFFFAOYSA-N 394.521 5.563 30 20 GKED O=C(c1cc(C(F)(F)F)ccc1F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513538008 GEKTZRLXCBQOSO-CYBMUJFWSA-N 383.307 5.039 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 514514369 HQZLZBPXQZPCKE-ZDUSSCGKSA-N 390.314 6.019 30 20 GKED CCOc1ccc(C#N)cc1N[C@H](C)C(=O)Nc1ccccc1-c1ccccc1 516839027 XGJKVAXPPQBNDC-QGZVFWFLSA-N 385.467 5.063 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccc(O)cc3)cc2Cl)cc1 517783510 SBCVKLRYQDPAIM-UHFFFAOYSA-N 393.830 5.031 30 20 GKED CC(C)COc1ccccc1-c1noc(CSCc2ccc(C#N)cc2)n1 519572741 RZPIMBSBPVZCJH-UHFFFAOYSA-N 379.485 5.076 30 20 GKED N#Cc1ccc(CNC[C@@H](Cc2ccccc2)C(F)(F)F)c(C(F)(F)F)c1 521319628 DPMFULVQAAVYQG-MRXNPFEDSA-N 386.339 5.088 30 20 GKED N#Cc1cccnc1NCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)c(F)c1 522760185 VGCIYUGTFDRIID-UHFFFAOYSA-N 398.781 5.058 30 20 GKED C=CCCCCCN(C)C(=O)N[C@H](c1ccccc1)c1nc2ccccc2n1C 525318622 QPFWIOIUPFUTBZ-JOCHJYFZSA-N 390.531 5.051 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@@H](C#N)c1ccc(OC(F)(F)F)cc1 535069305 QGWZZCIUIJSVBT-INIZCTEOSA-N 394.418 5.080 30 20 GKED C[C@@H](N[C@@H]1CCc2c(Cl)cc(Br)cc21)c1ccc(C#N)cc1 535509380 XLYWGONBPHHNBY-ADLMAVQZSA-N 375.697 5.312 30 20 GKED C=C[C@@H](CC(=O)Nc1nnc(SCc2cccs2)s1)c1ccccc1 536308925 USLSXEGDZKNDSO-ZDUSSCGKSA-N 387.555 5.190 30 20 GKED Cc1cnc(-c2cccc(NC(=O)c3ccccc3Oc3ccccc3C#N)c2)o1 538655890 RJAYNGYHDMZANL-UHFFFAOYSA-N 395.418 5.566 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1)c1ccccc1 545964594 IOVPEFOHKGNOAL-HXUWFJFHSA-N 399.897 5.355 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN[C@@H](C)c1ccc(C#N)cc1 549165759 KUVIUPYXGJCXRT-INIZCTEOSA-N 397.950 5.406 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1cccc2ccccc12 557559882 XTPMHRUHWADZSI-IAGOWNOFSA-N 389.524 5.531 30 20 GKED Cc1cc(Br)c(C(=O)N[C@H](CCC#N)c2ccccc2)cc1Cl 561336150 WQCCZRICZFHEOU-QGZVFWFLSA-N 391.696 5.186 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CC[C@@H](C(F)(F)F)CC1 565617949 AJUIPSISESBHFN-KFWWJZLASA-N 399.482 5.666 30 20 GKED Cc1onc(C2CC2)c1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 577597018 QHQUEUJPGMXPBU-CYBMUJFWSA-N 383.517 5.197 30 20 GKED Cc1ccc(-c2cc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)on2)cc1 577614194 QPJJYZRZBFBAAH-UHFFFAOYSA-N 382.423 5.321 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 581204753 AKELQBUZGFPWPE-UHFFFAOYSA-N 389.411 5.352 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc2cc(F)ccc2s1 592974528 SPRAJPRCXWAEKC-LJQANCHMSA-N 384.435 5.497 30 20 GKED Cc1ccc(-c2nnc3n2CCCCC3)cc1NCc1ccc(C2(C#N)CC2)cc1 594931631 QJRQCCAWJWDYNU-UHFFFAOYSA-N 397.526 5.147 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CC/C=C\c1ccccc1 609970199 ORADHXVJYAVLAG-YHYXMXQVSA-N 396.490 5.878 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 610334695 QTJGDPDABWNOCA-UHFFFAOYSA-N 379.391 5.137 30 20 GKED Cc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1Cl 610399703 ZLHAYUYGBIGSRI-UHFFFAOYSA-N 378.884 5.924 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NCc1nnc(-c2ccc(C#N)cc2)o1 610754753 BPMMNDSHYSOMRG-UHFFFAOYSA-N 382.423 5.321 30 20 GKED CSC[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 618805299 NKQWCNZZTIPBDO-OALUTQOASA-N 376.447 5.258 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1[C@H]2CCC[C@H]1CC2 646439067 UFLSIRUGTXOECK-STQMWFEESA-N 398.322 5.525 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(COc3ccccc3)c2)cc1Cl 726473143 XLFKUQAISSQBMD-UHFFFAOYSA-N 393.899 5.600 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccccc3Cl)cc2)c1 727980049 CHIJNUWMYYKJAG-UHFFFAOYSA-N 393.899 5.600 30 20 GKED Cc1ccc2c(c1C)OC[C@@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728392376 ZTTKMEWEBBLKIH-PKTZIBPZSA-N 397.478 5.214 30 20 GKED N#C[C@@H](NC(=O)c1ccc(SC(F)F)cc1)c1ccc(Cl)c(Cl)c1 731644980 DAFUIIGBZAPJOU-CQSZACIVSA-N 387.238 5.303 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccccc2-c2ccccc2)ccc1OC 733330520 YMXOIVIZHFKUCA-QFIPXVFZSA-N 386.495 5.333 30 20 GKED COc1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1F 747003869 RGAFJVTTZBGVFI-GHRIWEEISA-N 389.451 5.868 30 20 GKED CC[C@H](C#N)Oc1cc(CNC2CC(c3ccc(Cl)cc3)C2)ccc1OC 753566523 QWRWGFNNBJFRFF-LYBXBRPPSA-N 384.907 5.065 30 20 GKED N#C[C@@H](C(=O)CSc1ccc(N)cc1Cl)c1nc(-c2ccccc2)cs1 753860026 XAWLPEMQASCUAM-AWEZNQCLSA-N 399.928 5.014 30 20 GKED C#CC[C@H](NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1ccccc1 757599393 VIUOIAYQFXECJO-IBGZPJMESA-N 398.890 5.181 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cc(F)cc(F)c1O 757659982 XJLUOSLENWBVMC-CABCVRRESA-N 378.422 5.621 30 20 GKED C=CC[C@H](N[C@@H]1CCc2c(Cl)cc(Br)cc21)c1ccncc1 760329600 KXZAUNAMKXKJHT-ZWKOTPCHSA-N 377.713 5.392 30 20 GKED C[C@@H](OC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1cccc(C#N)c1 764614807 SRJGTWVFZKDUDT-MRXNPFEDSA-N 379.419 5.086 30 20 GKED CCCOc1ccc(Br)cc1CNc1ccccc1O[C@H](C)C#N 764953466 HWTZFRIPSKHRMF-CQSZACIVSA-N 389.293 5.141 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccc(-c3cccnc3)c2)C2CC2)c1 768472199 HYKWYTWGLNVFEC-UHFFFAOYSA-N 383.520 5.091 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C2\CCc3nc(O)ccc3C2=O)cc1 769613782 DJAWVMVFZQIDKU-CAPFRKAQSA-N 384.479 5.026 30 20 GKED N#C[C@H](C(=O)CC1(CSc2ccccc2)CC1)c1nc2cc(F)ccc2s1 770862822 VAIIOAOOGAYPEY-MRXNPFEDSA-N 396.512 5.574 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](Cc2ccccc2)c2sccc2C)c1 772982673 FCDIYUYAFIACPR-GGAORHGYSA-N 390.552 5.811 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 774052464 GFJZDUAQICYVNP-OXJNMPFZSA-N 398.487 5.607 30 20 GKED Cc1cc2cc(C=Nn3c(S)nnc3CSc3ccccc3)oc2cc1C 782245135 NJVDTVLEWVZPTL-UHFFFAOYSA-N 394.525 5.104 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC(F)(F)Cl)cc1 783356062 NXKYOKYZZBKMDG-GFCCVEGCSA-N 396.846 5.359 30 20 GKED CCN(C(=S)Nc1cccc(OC(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 783731722 XYEITHSECOOLOC-CYBMUJFWSA-N 393.434 5.237 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1 790966000 VDGFNEZHJOPKTI-HNNXBMFYSA-N 395.812 5.046 30 20 GKED Cc1nc(CCC(=O)[C@H](C#N)c2nccc3ccccc23)oc1-c1ccccc1 792096736 QKTKRXPWIRPZGN-FQEVSTJZSA-N 381.435 5.007 30 20 GKED O=C(Nc1cc(F)ccc1OC(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801682391 RAABGJLSZJCHFC-CYBMUJFWSA-N 381.247 5.095 30 20 GKED Cn1cc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)c(C(F)F)n1 812240321 LJARSSXNYVZYOF-VQHVLOKHSA-N 378.325 5.008 30 20 GKED CC(C)(c1cccc(C(F)(F)F)c1)c1noc(Cc2ccccc2CC#N)n1 815720307 AEMRHQSAVMKFTL-UHFFFAOYSA-N 385.389 5.071 30 20 GKED N#C[C@@H](C(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1nc(C2CC2)cs1 842938636 OIMGIVWCCHGCFP-HNNXBMFYSA-N 399.928 5.216 30 20 GKED N#C[C@H](C(=O)C1(C(F)(F)F)CCCCC1)c1nc2cc(Cl)ccc2s1 850771449 OGENHKANJMDTKW-LLVKDONJSA-N 386.826 5.639 30 20 GKED Cc1ccccc1CO[C@H](C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 860478585 CMPSVGPACYOULO-CJNGLKHVSA-N 384.888 5.040 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1cc(-c2ccncc2)nc2ccccc12 914611663 IHYGRCOMLOOCBM-UHFFFAOYSA-N 379.463 5.125 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCOc2ccccc2Cl)cc1 915180610 QCQUQAYPMIRGTF-HXUWFJFHSA-N 390.870 5.403 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cccc(Cl)c2)cc1 916948526 HOTHFNFOMQYDKS-QRWLVFNGSA-N 382.891 5.134 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043600 KHTKIYRPZUSWDP-INIZCTEOSA-N 384.888 5.294 30 20 GKED O=C1/C(=C\c2ccccc2)CC2(C/C1=C/c1ccccc1)C(=O)Nc1ccccc12 917518035 QRJLENXDUUJOHP-BMJUYKDLSA-N 391.470 5.407 30 20 GKED Cc1cc(NN=Cc2sc(Cl)cc2C(=O)O)nc2ccc(Cl)cc12 1776021471 HCFKNTQOPXDPKZ-UHFFFAOYSA-N 380.256 5.056 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776327488 WVNUWWYGNOYUFB-FPLPWBNLSA-N 378.877 5.421 30 20 GKED CCCCCCCCCCCN(C)Cc1occ(C(F)(F)F)c1C(=O)O 1776787774 UUWVCDNCDVGSNE-UHFFFAOYSA-N 377.447 5.959 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776805948 HDSZATNISAVFDD-SQFISAMPSA-N 390.504 6.352 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)s1 1777559875 RGZLYXFCGUBGJJ-ZRDIBKRKSA-N 388.444 6.064 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)c4ccccc4Cl)CCC3)cc2)C1 1785808007 DFRIVRQIVUNGMO-UHFFFAOYSA-N 394.902 5.054 30 20 GKED Cc1ccc(NC(=O)[C@@H](Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 28373773 PTGOOGYLHGEFSF-QHCPKHFHSA-N 383.495 5.588 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)N(CC)CC)c(Cl)c1 44142741 IPUVLSYLEBUTQZ-UHFFFAOYSA-N 399.922 5.042 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 45323760 LISJTGRFGBBNBN-XMMPIXPASA-N 395.462 5.235 30 20 GKED CC(C)OCc1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)oc2ccccc12 48853692 VJODCLOOOPQMEI-SFHVURJKSA-N 384.435 5.396 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2ccccc2C1 56800227 NRMOQHQKPDSRBS-UHFFFAOYSA-N 383.451 5.249 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)C2(C#N)CCCCC2)cc1 98115203 VFKNKKIBSJNFHE-UHFFFAOYSA-N 395.890 5.029 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 110308250 FFLDOTWXLIZEIR-HOTGVXAUSA-N 390.430 5.453 30 20 GKED C[C@@H](C(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(C(=O)c2ccccc2)c1 120270049 QDIRIZIJTKZFRT-NTKDMRAZSA-N 396.490 5.182 30 20 GKED CCN(C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccc(C#N)cc1 151941061 MYUCOONWCLUNKK-UHFFFAOYSA-N 377.831 5.066 30 20 GKED CS[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 172378595 MFIUHFXVAUMAQV-FQEVSTJZSA-N 389.480 5.097 30 20 GKED N#CCSc1cccc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)c1 175551650 QHXYHWLJPSEAKM-IBGZPJMESA-N 396.562 5.213 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2csc(-c3ccccc3Cl)n2)n1 177764582 WGGDNNSFYWOCKU-GFCCVEGCSA-N 387.917 5.533 30 20 GKED C[C@@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(OCC#N)cc1 181901496 RCXHTBQSBSTMIE-OPAMFIHVSA-N 377.875 5.078 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 184019472 VRUISEQHCLXUTI-LSDHHAIUSA-N 380.473 5.016 30 20 GKED C=CC[C@@H](C(=O)N[C@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 186746308 WPVGCMYJPIQMCH-XMSQKQJNSA-N 393.531 5.097 30 20 GKED Cc1cccc(OCCCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c1 193616942 MGYJHSNPJMGWMK-QGZVFWFLSA-N 397.425 5.165 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COc3ccc(C(C)C)cc3)n2)cc1 197667311 RESIVSMZFYPBFC-FQEVSTJZSA-N 390.508 5.497 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc1 208256156 DWWOICFMTHHIKF-QLENYVDCSA-N 386.476 5.313 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(F)cc3C)o2)c1 237022920 HMDDBHRRTIFCPP-IBGZPJMESA-N 378.447 5.365 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)c1 237828291 NCOSEWFDIILDBA-AREMUKBSSA-N 396.490 5.995 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301764424 QLPSYNOUEHHXRJ-KDOFPFPSSA-N 380.900 5.834 30 20 GKED N#Cc1ccc(N[C@H](Cc2ccccn2)c2ccc(Br)cc2)cc1 302643966 FGSUJBZKVVRNII-HXUWFJFHSA-N 378.273 5.112 30 20 GKED Cc1nc2cc(N=C(O)C3CCC(/N=C(/O)CC4CCCCC4)CC3)ccc2o1 328740819 NGQPUPOTMLZGJL-UHFFFAOYSA-N 397.519 6.210 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@H]1CCCC[C@H]1C(F)(F)F 410401845 XYZOOQJGHSBRJH-WDEREUQCSA-N 387.295 5.074 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cccc(OCc3cscn3)c2)s1 411005911 IAOXNTZCVJGCIJ-UHFFFAOYSA-N 397.525 5.205 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(CSc2ccc(F)cc2)cc1)C1CC1 417466382 KCUZBNZVRRGKSM-OAHLLOKOSA-N 383.492 5.274 30 20 GKED CN(Cc1ccccc1)c1ccccc1NC(=O)c1cccc(SCC#N)c1 429848008 PGUDGYMALWQVKQ-UHFFFAOYSA-N 387.508 5.191 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2occc2CSc2ccccc2)s1 430619932 BONUCWMOQQKADO-INIZCTEOSA-N 396.537 5.816 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 431780575 GFISZBRXHVDEBO-BEFAXECRSA-N 389.421 5.501 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)cc1C#N 433278944 MVMMEMOSRLPWDC-OAQYLSRUSA-N 375.472 5.105 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc2sc(C)nc2cc1Cl 435184064 QGCHCOOGMQXQKG-UHFFFAOYSA-N 396.903 5.350 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(F)c3SC)n2)cc1 435778821 UEXWTCCIGDAECP-OAHLLOKOSA-N 398.484 5.170 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)C[C@H]1C 439506116 ZPSQSUFFLGNFKE-GGPKGHCWSA-N 393.556 5.738 30 20 GKED Cc1ccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)s1 440590433 KMULVCXUEKWZIR-UHFFFAOYSA-N 377.469 5.460 30 20 GKED C[C@@H](NCCCCC(C)(C)C#N)c1cccc(NC(=O)Cc2ccccc2F)c1 444691417 YRHPMRZPSXHFAM-GOSISDBHSA-N 395.522 5.378 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)Nc1ccc(CC#N)cc1Cl 452642766 IIIKKHQOJPVTMX-UHFFFAOYSA-N 389.908 5.013 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 454562992 FRUQZKUZEGFTOW-UHFFFAOYSA-N 389.377 5.157 30 20 GKED Cc1ccc([C@@H]2CSCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458798151 HHBGPQDOMFEEMC-YADHBBJMSA-N 393.556 5.230 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 463663322 KSLXZJPZDWLIFL-AWEZNQCLSA-N 393.468 5.157 30 20 GKED CC(C)n1cnc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 467056113 FUUCCHQLVMUOQF-GOSISDBHSA-N 378.863 5.025 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(F)c(C#N)c1)c1ccccc1Cl 467764140 ZBJOYMICDLDESU-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CSc1cccc(C)c1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 472229434 BGCJEDKMKYRDJS-UHFFFAOYSA-N 388.492 5.828 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)cs2)c(C)c1 474422844 XGSNKZMODAJNNK-HNNXBMFYSA-N 381.526 5.497 30 20 GKED Cc1ccc([C@H](NC2CCC(C#N)(c3ccccc3)CC2)c2ccccn2)cc1 475349630 HCEYFWRTEIRYGJ-DHWVBAGJSA-N 381.523 5.473 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)C[C@@H](CC#N)c1ccccc1 475458906 OMGNVSCGSBJPIS-GDBMZVCRSA-N 375.299 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1cc(F)c(F)c(F)c1 475563323 IWSHCOYVJWNHHI-UHFFFAOYSA-N 376.422 5.320 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cc(-c4ccccc4)ccc3Cl)o2)c1 480162280 BATRPYAUFMLFRN-UHFFFAOYSA-N 386.842 5.541 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cncc(Cl)c3Cl)cc2)cc1 480837005 CWSMHJJRDZDZBI-UHFFFAOYSA-N 398.249 5.499 30 20 GKED C[C@H](NC(=O)C1(C#N)CCC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 482131973 YWCZCVBNONDRKS-LBPRGKRZSA-N 378.419 5.305 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(Br)cc1)c1ccccc1 487241658 NSWKTPHNRDSQRR-UFYCRDLUSA-N 397.316 5.104 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H](C#N)C1CCCCC1 489452961 YANIBMCUOKESJI-QGZVFWFLSA-N 390.940 5.095 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OCC2CCCCC2)cc1 498934055 QDDNFTWAXPHUOL-UHFFFAOYSA-N 377.488 5.181 30 20 GKED CCN(CCCC1(C#N)CCOCC1)[C@H](C)Cc1ccccc1C(F)(F)F 499775369 UBAOBCAKVJFOQT-QGZVFWFLSA-N 382.470 5.059 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@H]1c1ccccc1Cl 501017104 HNUCTMNBCUBCQL-OALUTQOASA-N 376.843 5.142 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccccc2Br)cc1 507916463 ANMIBLVPHGYQAT-UHFFFAOYSA-N 393.240 5.365 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 509718209 XRRDZAMGAPFNNU-AATZCTEQSA-N 399.494 5.326 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 510874029 XBQPNDMUYQJIBC-UHFFFAOYSA-N 385.467 5.631 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 511154016 BRLSQUWZGLHZSL-UHFFFAOYSA-N 382.797 5.338 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc(Cl)c1 517656099 PEEITTKWHYLORR-FQEVSTJZSA-N 391.858 5.280 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 518240288 VUMADYMAWNTFGN-INIZCTEOSA-N 387.508 5.704 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)Nc1cc(C(C)(C)C)sc1C#N 520281090 JJCXQDPNLVETPH-UHFFFAOYSA-N 394.496 5.356 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 521366091 HDVZHQUIRLTXOL-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc2ccccc2n1 525660089 DUGAGFPPSYXBGP-UHFFFAOYSA-N 393.446 5.370 30 20 GKED Cc1cccc(-c2nc(C)c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)[nH]2)c1 533849542 CFGUXAAZYMGBSF-HNNXBMFYSA-N 390.512 5.340 30 20 GKED N#CC1(c2ccc(C(=O)N3CCCCC[C@@H]3/C=C/c3cccs3)cc2)CC1 543110625 HVFCLDYTILDYHB-YVNCXZRQSA-N 376.525 5.401 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1cccc(F)c1Sc1ccccc1 552575915 OGMICISBBNOQES-UHFFFAOYSA-N 377.444 5.143 30 20 GKED COc1ccc([C@@H](C)NC2CCC(C#N)(c3ccccc3)CC2)c(C)c1OC 554402840 BLSAKQKLTGAZTN-NWKXHEKXSA-N 378.516 5.067 30 20 GKED C=CC[C@H](C)NC(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 558140058 SRBTWJGJKXGXJH-ZDUSSCGKSA-N 376.403 5.050 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccccc2OCC2CCCC2)no1)c1ccccc1 558362559 QCSKZWOAMXPIBM-FQEVSTJZSA-N 387.483 5.546 30 20 GKED C[C@@H](NC(=O)c1sc2ccccc2c1Br)c1ccc(C#N)cc1 562052658 OMGOEWKEUKZKMD-LLVKDONJSA-N 385.286 5.026 30 20 GKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1Cl)c1ccc(Br)cc1F 571084468 TUKPOVSHIWGNBQ-GHMZBOCLSA-N 381.676 5.525 30 20 GKED Cc1cc(-c2ncco2)ccc1NC(=O)c1ccccc1-c1ccccc1C#N 580008330 FLLBQJPVEGGBOE-UHFFFAOYSA-N 379.419 5.441 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cnc(-c4ccccc4)s3)c2C#N)C1 603727562 XLUVTQGISXIAKA-LBPRGKRZSA-N 379.510 5.120 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(C(F)(F)F)c3)cn2)cc1 603763757 DWGWPSZITJLANZ-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1c(NC(=O)COc2ccccc2Cl)sc2c1-c1ccccc1CC2 603990945 HILPWPOZMKEBAR-UHFFFAOYSA-N 394.883 5.056 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)oc12 604456707 IZHSYDMIVNDTHA-UHFFFAOYSA-N 384.391 5.358 30 20 GKED C=CCOc1ccc(CN[C@H](COC)c2cccc(C(F)(F)F)c2)cc1Cl 605322489 WGJRSVFDSBXTSR-GOSISDBHSA-N 399.840 5.401 30 20 GKED CN(Cc1csc2ccccc12)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609515836 KKVBJEYBIAUBPK-UHFFFAOYSA-N 399.475 5.232 30 20 GKED C[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609880300 DSSSFHYWBSTJSU-CEQIKUNHSA-N 378.447 5.283 30 20 GKED C[C@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn12)c1cccc(C#N)c1 611389517 YHQIXEWDVIOSFP-AWEZNQCLSA-N 392.915 5.439 30 20 GKED Cc1ccc(-c2nc(CNCCSCc3ccccc3C#N)cs2)cc1 611560019 ASVSSLSAQRJZIH-UHFFFAOYSA-N 379.554 5.013 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1c(Br)cccc1SCC 667121260 XINBKPSDPSJPPQ-BETUJISGSA-N 381.339 5.276 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccccc2OC)cc1 728767193 XFJXFGGXBUNANK-CSODHUTKSA-N 392.499 5.050 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2cncc(F)c2)cc1Cl 729318763 CBKMBDUHZVBIIG-AQDCRGGLSA-N 391.833 5.181 30 20 GKED COc1ccccc1CCN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 729552754 JKYMQJAWVVGSRU-QHCPKHFHSA-N 399.494 5.057 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](C)c1csc2ccccc12 730067964 JDPYEINWIDLPKA-OAHLLOKOSA-N 395.484 5.268 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 730918288 ZTNPGKRIFLASQR-YPAWHYETSA-N 392.458 5.325 30 20 GKED Cc1ccc(OC(F)F)c([C@H](C)OC(=O)CSCc2ccc(C#N)cc2)c1 734737171 IRLYLTQOICUERQ-AWEZNQCLSA-N 391.439 5.006 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 737844050 KGXGSNBZESEEMZ-IBGZPJMESA-N 391.446 5.081 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1CN(C)[C@@H](c1ccccc1Cl)C(C)C 739855147 QTGRXVJRLIOFAK-OAQYLSRUSA-N 393.922 5.065 30 20 GKED C=CCc1cc(C(=O)O[C@@H](C)c2ncc(-c3ccccc3)o2)cc(OC)c1OC 741309136 RGJMGDYFMKQWQU-HNNXBMFYSA-N 393.439 5.005 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1ccc(SCC(F)F)cc1 741763425 MYVMBBQTDFDTDB-UHFFFAOYSA-N 375.366 5.294 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(C)c1 743038143 VZYHINHJIZGVIM-UHFFFAOYSA-N 391.471 5.915 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)CSc2ccc(Cl)cc21 743056183 CQBONEBPMACKKU-ZROIWOOFSA-N 380.856 5.294 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)COc2c(Cl)ccc(Cl)c21 748585041 WEYRQILSGJOPIB-JXMROGBWSA-N 389.263 5.171 30 20 GKED CCN(C(=S)Nc1ccccc1-c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 751008995 CYOLRZDPCTVTNE-SFHVURJKSA-N 385.536 6.005 30 20 GKED Clc1ccc(CSc2nncn2N=C[C@@H]2CCCc3ccccc32)cc1 752163271 UPELFCRNPCRGAB-KRWDZBQOSA-N 382.920 5.178 30 20 GKED C#CCCCC(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 757856915 FRNRWHBUUBFAII-UHFFFAOYSA-N 394.540 5.092 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)O[C@@H](C)CC#N)cc1 757891461 RXDCXPCPSMNNQD-INIZCTEOSA-N 376.481 5.173 30 20 GKED Cc1nc([C@@H](C)OC(=O)c2ccccc2CC#N)oc1-c1ccc(Cl)cc1 763908241 IANDGNRZKRSEAC-CQSZACIVSA-N 380.831 5.288 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3c(s2)CCCC3)cc1OCCCC#N 764434411 WTOFZUXBQFSWNS-NTMALXAHSA-N 381.497 5.214 30 20 GKED Cc1ccc(C(=O)OCCCCC(C)(C)C#N)cc1NC(=O)c1ccccc1 768572974 KDCYUHPIFJJRHW-UHFFFAOYSA-N 378.472 5.124 30 20 GKED C#C[C@H](C)N(C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 770510457 ZDVTWRAECBMZFC-INIZCTEOSA-N 392.478 5.217 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCc2sccc21)c1nc(-c2ccc(Cl)cc2)cs1 771577229 CSUHXSYQTAOBQQ-HOTGVXAUSA-N 398.940 5.821 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(-c3cccs3)cc2)c1 772985595 SXPWTLXCUWFNBT-LAUBAEHRSA-N 376.525 5.947 30 20 GKED CC[C@@H]1C[C@@H](C=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CCO1 779762511 ZLNSYVCLFOONBZ-XJKSGUPXSA-N 384.480 5.100 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(Cl)cc1F 789369592 VVOTVCVPCAJCJF-GFCCVEGCSA-N 390.842 5.382 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nccn3-c3ccccc3)cc2F)c1 792173384 FJBZITLBBTUBDX-UHFFFAOYSA-N 398.441 5.074 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)cn1 792858748 LCQXSIUGTWDKDU-RMKNXTFCSA-N 385.250 5.355 30 20 GKED C[C@H](Cn1ccc2ccccc21)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 796811817 QUSKCIOBMIOBDL-VQIMIIECSA-N 385.492 5.277 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(F)ccc3s2)cc1 916954679 JWOZIXWVNKSJRH-FZKQIMNGSA-N 394.471 5.515 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2cccc(Cl)c2Cl)SC1=S 917644558 HONMJAPEGUIRIB-RIYZIHGNSA-N 391.304 5.271 30 20 GKED CCOc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 920111368 VAQPUJOFFOCFGT-FQEVSTJZSA-N 390.508 5.326 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc1)C(=O)O 1776469846 URDUHZVTYDRCDP-WPBGYSLVSA-N 396.508 5.469 30 20 GKED CCCCCCCOc1cccc(CNc2cc(C(=O)O)c3ccccc3c2)c1 1776787419 HMQQHYJFRCLXPT-UHFFFAOYSA-N 391.511 6.499 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(/C=C\C(=O)O)cc3)s2)cc1 1777430642 XWMJGULJEKXEQP-ITAGJCAXSA-N 389.476 5.421 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)o2)cc1 1777472297 LQTDAGUPRAOTLL-DZDAAMPGSA-N 388.419 5.161 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(F)cc2F)cc(Br)c1OC 7712570 BSPTVAGJOUFLKP-QPJJXVBHSA-N 397.215 5.031 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2cc(C#N)ccc2C)cs1 63961686 YKULTUGGHDYZAR-UHFFFAOYSA-N 379.510 5.176 30 20 GKED COc1ccc(CN[C@H]2CC(C)(C)Cc3oc(C)cc32)cc1OCCCC#N 64614210 XZIRFCFRQYDSSV-IBGZPJMESA-N 382.504 5.083 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(Cl)cc(Cl)c3)n2)cc1 66544960 CZBMLXUUIFCXFT-MRXNPFEDSA-N 398.274 5.479 30 20 GKED COc1ccc(CCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 66800961 XAFJRMINTWJSOK-CQSZACIVSA-N 388.920 5.314 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66954693 QEBFQQNCWQYAJD-GOSISDBHSA-N 379.529 5.343 30 20 GKED N#Cc1ccsc1NC(=O)CCN1CCC[C@H]1c1ccc(Cl)c(Cl)c1 117437487 PCRIVVDNNWQDSH-INIZCTEOSA-N 394.327 5.092 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1Br 119574212 IUFSNCKBSNDSAZ-GFCCVEGCSA-N 389.318 5.262 30 20 GKED Cc1cc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)oc2cc1C 123560758 USKZGNKFXVMYEF-SFHVURJKSA-N 397.459 5.535 30 20 GKED CN(Cc1cccc(C#N)c1)Cc1cccc(NC(=O)c2ccccc2Cl)c1 130749197 SOGMAGVLUNUKHG-UHFFFAOYSA-N 389.886 5.096 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2c[nH]c3ccc(OC)cc23)CC1)c1ccccc1 159332294 WGMXPMDRABEQKC-SFHVURJKSA-N 388.511 5.242 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(OC)cc1 178710042 QCOJGKKDQHYNST-RHSMWYFYSA-N 397.425 5.200 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1csc(-c2ccccc2F)n1 179831736 LFOIATDWBJIMTG-CQSZACIVSA-N 383.517 5.956 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2C)c1 189899593 FNDRHMVYHRANMR-IIBYNOLFSA-N 376.500 5.385 30 20 GKED COc1ccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)c2ccc(F)cc2)cc1 237273974 DZULLNZCZCZIHK-OSPHWJPCSA-N 390.458 5.004 30 20 GKED CNC(=O)c1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1 255777603 WXBPXUWCTOWKSX-XDJHFCHBSA-N 398.487 5.079 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 296439348 VXBLHDJUFOFAMN-UHFFFAOYSA-N 380.444 5.048 30 20 GKED CC(=O)c1ccc(C#N)cc1N1CCC(c2nc3cc(Cl)ccc3s2)CC1 302132918 YSESZCZBHHXZPF-UHFFFAOYSA-N 395.915 5.408 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303372955 KNAJMWANPVJBLU-SJORKVTESA-N 397.544 5.608 30 20 GKED CCN(C(=O)c1ccc([C@H](C)C(F)(F)F)cc1)c1ccc(C#N)c(Cl)c1 410617624 XUWIHRBVGYCHDV-LBPRGKRZSA-N 380.797 5.544 30 20 GKED N#CCCC[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccccc1 411762634 WTBLCKUPLIBOBK-LJQANCHMSA-N 389.421 5.059 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2C[C@@H]3CCCC[C@H]3C2)cc1 427138675 ZZBVGVMLDXHZDD-PMACEKPBSA-N 376.525 5.113 30 20 GKED COC(=O)c1cccc(-c2nc(CSCc3ccc(F)cc3C#N)cs2)c1 437267730 LBWHMMKNTPVZML-UHFFFAOYSA-N 398.484 5.041 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(CC(F)(F)F)cc1 438366820 XUGPUDBFNQZIJW-RBUKOAKNSA-N 387.405 5.095 30 20 GKED COc1ccccc1[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 438864153 NXDPATYIDRLYJQ-LADGPHEKSA-N 399.494 5.129 30 20 GKED Cc1oc(C#N)cc1C(=O)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 439089602 SFRUOGMCEISAEG-UHFFFAOYSA-N 391.427 5.056 30 20 GKED CCN(CCC#N)C(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 439135829 DOZOXTFNNVBIKN-UHFFFAOYSA-N 387.439 5.042 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@@H](C2CCC2)C2CC2)cc1 454532648 VWEVSVGVARHCAA-QHCPKHFHSA-N 389.499 5.032 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)c2)cs1 464472646 FGWMYSSWQLEQER-HNNXBMFYSA-N 387.386 5.022 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccccc1C1CC1 466470602 NZKGPUJTPSGMBU-MRXNPFEDSA-N 396.581 5.688 30 20 GKED CCN(Cc1nc(C)c(-c2ccc(Cl)cc2)o1)[C@@H](C)c1ccc(C#N)cc1 468282329 QFJIPLIZSWLDFN-INIZCTEOSA-N 379.891 5.758 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 471990929 ZFDAKYLIGYZGPE-HXUWFJFHSA-N 385.511 5.598 30 20 GKED N#CC[C@H](CC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1ccccc1 474941070 AAAUGSFNJWFZDU-MRXNPFEDSA-N 397.450 5.038 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC[C@H]1c1ccc(OC)cc1)c1ccc(F)c(F)c1 477730490 XAIYJCQIFPIVKN-LEWJYISDSA-N 386.442 5.137 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)[C@@H](C)C(F)(F)F 477974114 WKXYNWHMTIVNHL-AWEZNQCLSA-N 376.378 5.072 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NCc2ccc(C#N)cc2OC(F)F)c1 478953056 MBDGRGKKHRHCFK-UHFFFAOYSA-N 393.821 5.164 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C#N)ccc1OC(F)F 480645305 XKURQYYOGMVKSF-UHFFFAOYSA-N 397.834 5.095 30 20 GKED N#C[C@@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1nccc2ccccc12 483209992 XXNSCJNDXOEDTK-HSZRJFAPSA-N 394.499 6.017 30 20 GKED C=CC[C@@H](C(=O)Nc1nc(-c2cc(OC)ccc2OC)cs1)c1ccccc1 487616010 KQPMWRDLWOXAQT-QGZVFWFLSA-N 394.496 5.126 30 20 GKED Cc1cscc1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 488383209 WMOFEOOMAQHIJH-UHFFFAOYSA-N 377.469 5.351 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(F)cc1OC1CCOCC1)c1ccccc1 488707758 KBIORJJQMDFPMA-FQEVSTJZSA-N 398.478 5.213 30 20 GKED C=CCn1c(SCc2nc3cc(F)ccc3o2)nnc1-c1ccc(C)cc1 489658932 UBXOXNIUHVCRIT-UHFFFAOYSA-N 380.448 5.012 30 20 GKED N#C[C@H](C(=O)c1cnc2c(F)ccc(F)c2c1)c1nc(-c2ccccc2)cs1 496199328 ZFTKNZLMOAUQNM-OAHLLOKOSA-N 391.402 5.127 30 20 GKED N#CC1(CCCNC2(c3cccc(C(F)(F)F)c3)CCCCC2)CCOCC1 499551421 YRBJOJNCGRUCTR-UHFFFAOYSA-N 394.481 5.555 30 20 GKED CC(C)c1ccc([C@H](NC(=O)NCc2cccc(C#N)c2)c2cccs2)cc1 500232232 OIWJNQQLCPNROV-QFIPXVFZSA-N 389.524 5.332 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 504117625 XUGAAVDVEHPJKH-KRWDZBQOSA-N 391.540 5.577 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc2c(c1)CCC=C2 505320910 NQVVRUODMITIAQ-UHFFFAOYSA-N 381.435 5.266 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Oc1ccncc1 509478198 JIRDYFAIQGYNRN-INIZCTEOSA-N 389.480 5.378 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)cc1OCC(F)(F)F 511015917 TUDVURCKDRBFOU-UHFFFAOYSA-N 378.394 5.156 30 20 GKED CCc1sc(NC(=O)c2cc(C#N)ccc2Cl)nc1-c1ccc(OC)cc1 511160413 UGBRRPJPGBRBKC-UHFFFAOYSA-N 397.887 5.158 30 20 GKED Cc1cccc([C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)C(F)(F)F)c1 512889203 MKKHKHBYTOPXNB-QGZVFWFLSA-N 375.394 5.221 30 20 GKED C=CCn1c(SCCCC(=O)c2ccc(F)cc2)nnc1-c1cccc(C)c1 514233267 XOLKHLKRVGKXHH-UHFFFAOYSA-N 395.503 5.334 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4sccc4s3)n2)cc1 516270367 VCQJKCLLUQSNIF-ZDUSSCGKSA-N 391.502 5.448 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1 518030654 RWZSNYIDJCIWFM-CQSZACIVSA-N 375.513 5.039 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1 518463311 XZPXAPSRPSFEQD-QFIPXVFZSA-N 389.886 5.512 30 20 GKED CCc1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 520466208 UNPHIFNEYALLIS-INIZCTEOSA-N 381.888 5.267 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cs1 522073509 MZFUNENDGYZTDW-AWEZNQCLSA-N 392.484 5.252 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1nc2ccccc2o1 531335212 SFWAHUFEFKEGHK-AWEZNQCLSA-N 389.798 5.159 30 20 GKED Cc1cc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)ccc1F 534732818 LIVQAPWCVJCMIX-YCRPNKLZSA-N 397.519 5.801 30 20 GKED C=C[C@H](CC(=O)Nc1c(N2CCCC2)cccc1N1CCCC1)c1ccccc1 535453091 WIZQFJODGXEQJP-HXUWFJFHSA-N 389.543 5.185 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccccc1 536128479 MPRGVNRLVZZCCY-IBGZPJMESA-N 376.500 5.001 30 20 GKED Fc1cccc([C@@H](NCc2ccc(OCC(F)(F)F)cc2)C(F)(F)F)c1F 544124114 RYPGEVPDTAAGRT-OAHLLOKOSA-N 399.281 5.299 30 20 GKED Cc1noc(C2CC2)c1NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 546637566 VAEABVCZQWNCSB-AWEZNQCLSA-N 386.455 5.282 30 20 GKED N#CCCCOc1cccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c1 554981488 GZSKXHHMENBQDE-UHFFFAOYSA-N 384.439 5.040 30 20 GKED COc1ccc(CN2CC[C@H](c3cccc(Cl)c3)C2)cc1OCCCC#N 556909387 BHGANRCKKLAQKE-IBGZPJMESA-N 384.907 5.021 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1ccccc1C(F)(F)F 558097029 RMBIXRNVVMKSSD-NSHDSACASA-N 383.211 5.190 30 20 GKED N#Cc1ccc(CNCCc2csc(-c3ccccc3)n2)c(C(F)(F)F)c1 558485083 MNJVDYPKMFKDPG-UHFFFAOYSA-N 387.430 5.033 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 558906082 JEMFIWBEORDNBR-INIZCTEOSA-N 390.439 5.160 30 20 GKED C=CCOc1ccc(CNC(=O)N(Cc2ccco2)Cc2ccc(C)s2)cc1 561877373 NANIIYFWQGILNE-UHFFFAOYSA-N 396.512 5.126 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(F)cc2)C1 565929269 KXTPJMHHDYBRLL-QGPMSJSTSA-N 383.492 5.288 30 20 GKED COc1cc(CS[C@H](C)c2ccc(C#N)cc2)c([N+](=O)[O-])cc1OC(F)F 566703390 SSTOYWUBLRLHKO-LLVKDONJSA-N 394.399 5.071 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC(CCC#N)CC1 567816312 OYPYUBWDRLLXQQ-IBGZPJMESA-N 391.515 5.683 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)CC1 568274234 ZAPDGSHDMURGOM-UHFFFAOYSA-N 381.526 5.181 30 20 GKED Cc1csc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c1Br 571113799 UTRLSGIYMIAPSE-QMMMGPOBSA-N 395.347 5.129 30 20 GKED C[C@@H](N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1cccc(C#N)c1 571558898 GKCZSIMFYRIQQO-XCLFUZPHSA-N 394.316 5.530 30 20 GKED N#CCc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1 572879271 XWNKNDSLFBXVKX-JOCHJYFZSA-N 378.422 5.233 30 20 GKED Cc1nc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1-c1ccccc1 589958484 DIEFLYMZICTPML-UHFFFAOYSA-N 382.250 5.488 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1ccccc1 590476497 IDIQSWUQHUTKLG-INIZCTEOSA-N 382.332 5.149 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1ccc2ccccc2n1 591862693 YWZQAAHEBPOFBE-IBGZPJMESA-N 389.414 5.533 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(C)(C)C)cc1 603738803 RDMPQEISORPXJA-UHFFFAOYSA-N 385.467 5.604 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)COc1ccc(F)cc1Cl 603968425 PZLCNBCPAAKHEP-UHFFFAOYSA-N 386.835 5.097 30 20 GKED COc1ccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 608913312 UKLZQEPVPRSOOZ-FQEVSTJZSA-N 391.858 5.648 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)Nc1cccc(OCCCC#N)c1 608938384 LIJJLPQAPLUZFE-NRFANRHFSA-N 382.529 5.266 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@H](c2ccccc2)CC1 608995250 FYLFLPBJMLTLJI-FQEVSTJZSA-N 377.488 5.147 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c(Cl)c1 609054485 QEUIYNINXBKIJG-UHFFFAOYSA-N 380.831 5.253 30 20 GKED Cc1ccc(C)c(CC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 609058092 UOWAWIXVBJEVMV-UHFFFAOYSA-N 384.479 5.130 30 20 GKED C[C@@H](NC(=O)NCc1ccc(C#N)cc1F)c1ccccc1Oc1ccccc1 609240557 POJWPZPWYAXXHV-MRXNPFEDSA-N 389.430 5.050 30 20 GKED CC(C)(C)c1ccc(OCc2ccc(C(=O)Nc3ccncc3C#N)cc2)cc1 609785696 WLHJZONQLGZWLV-UHFFFAOYSA-N 385.467 5.082 30 20 GKED C[C@@H](NC(=O)CS[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 609825861 XSUJKAWZXDAWHP-CHWSQXEVSA-N 393.339 5.537 30 20 GKED CCN(C(=O)c1cccc(Oc2nccs2)c1)[C@@H](C)c1ccc(C#N)cc1 609907140 NCTRYYQBIDFRFV-HNNXBMFYSA-N 377.469 5.030 30 20 GKED COc1ccc(Cl)c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 609987346 UOGUERQYDNPBAC-UHFFFAOYSA-N 377.831 5.216 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@@H](C)c2cccc(C#N)c2)c2ccc(C)cc2)cc1 610355549 USGLMKVHTQTRRH-UUOWRZLLSA-N 399.494 5.025 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@@H]2/C=C\c2cccs2)cc2ccccc21 611988492 OWGKAVJCKHSXDW-YAINUAMHSA-N 389.524 5.325 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cc(C(F)(F)F)ccc1F 622477881 OJKKPCCZUDBYMG-AWEZNQCLSA-N 397.265 5.407 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccc(Br)c2)C(C)C)c1 726478554 NYOHLIWPWOJDMA-UHFFFAOYSA-N 387.346 5.038 30 20 GKED Cc1ccccc1C1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 726696399 PLVIFTBLZXXBFA-HSZRJFAPSA-N 395.506 5.504 30 20 GKED Clc1nc(Oc2ccccc2)sc1C=NNc1nc(-c2ccccc2)no1 726737631 AZUUUPRBIBOCRH-UHFFFAOYSA-N 397.847 5.085 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 726757894 QKHFXXUPMNKKIW-IMTHGLKYSA-N 384.401 5.344 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCc4ccccc4C3)n2)cc1 732596101 KJZNUHVHWBLRNE-LAUBAEHRSA-N 386.520 5.490 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC(C)C)c2ccccc2C)c1 733807284 UCMISVRFSRNGLB-NFBKMPQASA-N 393.531 5.263 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccccc2C)cc1 734964559 CPCFEZZQANDARM-CECAUBDESA-N 376.500 5.350 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 739153975 ANMIWQAWMFZKFW-MWLCHTKSSA-N 380.416 5.357 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 743485160 WXZGBWHEMUURFI-SNVBAGLBSA-N 390.302 5.586 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)Nc1ccccc1F 745724720 VSEKBFDOMZECNB-UHFFFAOYSA-N 393.462 5.549 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cc(Cl)ccc2OC(F)F)cc1 748440497 LPDUSTUORFJOHF-HXUAIIEXSA-N 377.774 5.128 30 20 GKED N#Cc1ccc(C(=O)O[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)s1 750216379 KDDTTYIHAAQWLL-GFCCVEGCSA-N 379.281 5.099 30 20 GKED COc1ccc(C2(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CCC2)cc1 751084326 OCYKWFBCAIZCCB-DEOSSOPVSA-N 396.490 5.411 30 20 GKED C[C@H](ON=C(N)c1cccs1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753821683 KAXQLQITYKTVTQ-VIFPVBQESA-N 382.272 5.108 30 20 GKED CCCCCCCC(=O)N(c1ccccc1)c1ncccc1Br 755369825 IWNAWGVRKYCBGP-UHFFFAOYSA-N 375.310 5.869 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc2ccccc2s1 756228709 SDTKOIIPOCUTOX-NSHDSACASA-N 395.336 5.864 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCc4c(F)cccc4C3)cc2)c1 757884330 YPMFDRKEWRJMGR-UHFFFAOYSA-N 387.414 5.080 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1ccccc1SCC#N 758872628 BSONKLVIIYMBNA-QGZVFWFLSA-N 379.529 5.242 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1c(C)nn(CC(C)C)c1Cl)c1ccccc1 759374492 QLQSCQVVAQQKPD-ICSRJNTNSA-N 399.966 5.524 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 766619283 VABLKOQVCBRFPB-RISCZKNCSA-N 385.286 5.039 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)OCc3ccccc3C(C)(C)C#N)o2)cc1 767997938 SPEKTPYIYBSHOZ-UHFFFAOYSA-N 388.467 5.127 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1ccccc1O[C@H](C)C#N 770652840 MDCQKGQVAYBFKH-PBHICJAKSA-N 391.393 5.101 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(N(C)C)cc1 775488602 PHOBLWQZGFEODH-UUOWRZLLSA-N 398.510 5.291 30 20 GKED O=C(OCc1ccc(C(F)(F)C(F)(F)F)cc1)c1ncccc1C(F)(F)F 777799252 UXHAOUXMJKBTCR-UHFFFAOYSA-N 399.237 5.112 30 20 GKED N#C[C@@H](C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1ccc2ccccc2n1 781445290 SMGOBJLVGJBVDV-QGZVFWFLSA-N 398.359 5.301 30 20 GKED Cc1cc(Br)ccc1CN[C@@H](c1cccc(C#N)c1)C(F)(F)F 783671849 LUQVFYMLEZVHRJ-INIZCTEOSA-N 383.211 5.022 30 20 GKED Cc1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c(C)c1O 785838065 VERRAWWKFMWCQS-OAQYLSRUSA-N 385.467 5.617 30 20 GKED C=CC[C@@H](NC(=O)[C@H](CC)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 786185353 MYMNTVRBMSWFQK-VQIMIIECSA-N 376.422 5.103 30 20 GKED COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCCCCC#N)cc1 792309075 JNDNHUXRYCELSI-UHFFFAOYSA-N 376.456 5.013 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 797195231 DESYNKOFQBCBNG-UHFFFAOYSA-N 397.409 5.196 30 20 GKED N#C[C@H](C(=O)[C@H]1CC12CCSCC2)c1nc(-c2ccc(Cl)cc2)cs1 835068864 UBXKFFDGYITHBF-HUUCEWRRSA-N 388.945 5.173 30 20 GKED N#Cc1cccc(OCCCCc2nc(-c3ccsc3C(F)(F)F)no2)c1 904923565 XJQLLYOSCGXJBE-UHFFFAOYSA-N 393.390 5.090 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)Nc3sccc3C#N)cc12 908097806 MQTYQXMDYTZSJH-UHFFFAOYSA-N 398.900 5.234 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2cccc(C(F)(F)F)c2)cc1 912698897 UPSMIWQLEHEMBQ-HNNXBMFYSA-N 392.446 5.441 30 20 GKED COc1cc(Br)c(/C=C/C(=O)c2ccc(SC)cc2)cc1OC 916133453 PWYQJCHQGISITC-RMKNXTFCSA-N 393.302 5.084 30 20 GKED CC(C)(C)c1nnc(S)n1N=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 916308768 UCMIROBBEQQQSD-UHFFFAOYSA-N 395.315 5.313 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)cc1 916948199 DWHAZBZNCHVDQD-SCLBCKFNSA-N 394.858 5.561 30 20 GKED Cc1cc(C)cc(OCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046441 KBGKHSYQQLYGMP-INIZCTEOSA-N 384.888 5.212 30 20 GKED COc1ccc(OCc2nc(/C=C3/C(=O)c4ccccc4C3(C)C)cs2)cc1 920070341 OWFRBCIDFBXUDZ-NDENLUEZSA-N 391.492 5.288 30 20 GKED CCO[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 920324810 VDSRAGDTJNYRGB-NQIIRXRSSA-N 376.481 5.073 30 20 GKED C=CCOc1cccc(/C=C\c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)c1 1776184805 WGKBKROHBGCICI-WDZFZDKYSA-N 381.428 5.383 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cs1 1776380470 DIQKTYMOPHQGDI-VURMDHGXSA-N 383.494 5.589 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cnc(-c2cccc(Cl)c2)s1 1776785451 COSAHROFDPOHHN-KRWDZBQOSA-N 394.968 5.757 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c(Cl)c1 1777353246 CNQOBLQYOXFRBU-TWGQIWQCSA-N 398.867 5.671 30 20 GKED Cc1cc2c(c(C)c1Cl)C(=O)/C(=C/c1cc(C(=O)O)c(Cl)s1)CO2 1777427864 LYZVUOHOMZQPJT-RUDMXATFSA-N 383.252 5.029 30 20 GKED O=C1/C(=C/c2ccccc2Oc2cccc(F)c2)C[C@H](C(=O)O)c2ccccc21 1777698065 BNQDTPLFOGMEDK-AUFJSOOLSA-N 388.394 5.456 30 20 GKED C[C@@H](C#N)Sc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccccc1 4800638 DBBWOFAOBZNQDP-LBPRGKRZSA-N 389.311 5.304 30 20 GKED C=CCSc1ccccc1NC(=O)CN(C)[C@@H](C)c1nc2ccccc2s1 7923038 YHMJUNURESDAKL-HNNXBMFYSA-N 397.569 5.206 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccccc2-c2ccccc2)cc1OC 15643164 DVMUGICJOPUCTQ-JQIJEIRASA-N 385.463 5.579 30 20 GKED COc1cc(C(=O)/C=C/c2cc([N+](=O)[O-])ccc2Cl)ccc1SC(F)F 63874724 PXTMFQDNVXKQFN-QHHAFSJGSA-N 399.802 5.468 30 20 GKED CN(CCC#N)c1ccc(CN[C@@H](Cc2ccccc2)c2cccs2)cc1 116923298 KLAUPCVJPLFCRC-QFIPXVFZSA-N 375.541 5.172 30 20 GKED FC(F)SCc1ccc(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)o1 128800775 XRRURKODOJGJOD-UHFFFAOYSA-N 383.304 5.052 30 20 GKED CC(=O)N(c1nc(COc2cccc(F)c2C#N)cs1)c1cccc(C)c1C 132102324 CQAAQKKBJHFMQP-UHFFFAOYSA-N 395.459 5.034 30 20 GKED C#Cc1cc(OCCCCCCCC)c(C#C)cc1OCCCCCCCC 136231102 DTQSWUKTVHNQNX-UHFFFAOYSA-N 382.588 7.128 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 152158458 VGSLJGJRHRHUMG-UHFFFAOYSA-N 394.862 5.113 30 20 GKED Cc1sc(CCNCc2cccc(OCCCC#N)c2)nc1-c1ccccc1 152403810 UALUOFOQUBGYHF-UHFFFAOYSA-N 391.540 5.133 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2c(Cl)cccc2C1 159276651 AYGXCPFWKZDRPC-CQSZACIVSA-N 385.920 5.182 30 20 GKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1nc2ccccc2n1C(F)F 171782863 QCEHCJBNXZTWBV-HNNXBMFYSA-N 387.455 5.472 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(Cl)s1 175132929 FYSSCTZIKSNQNE-SMDDNHRTSA-N 397.912 5.377 30 20 GKED C[C@H](Sc1cccc(C#N)c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 177111991 XDZFXVJPRPEYJU-JTQLQIEISA-N 384.810 5.350 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2COc2ccccc2)n1 177743952 MXJHYCABWWIMJQ-IBGZPJMESA-N 376.481 5.336 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c(C)c1 178103964 JIQXLDYKJGYWTH-MRXNPFEDSA-N 397.425 5.084 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)o1 184303463 SZTSZUHKOAIXMH-LPHOPBHVSA-N 381.476 5.282 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)cc1Br 189912532 ZBORQQCRUDUFOT-UHFFFAOYSA-N 392.724 6.207 30 20 GKED COc1cc(Br)ccc1[C@H](C)NCc1ccccc1C(C)(C)C#N 190458927 DHWOMXKDVNKKTO-AWEZNQCLSA-N 387.321 5.110 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)c(F)cc1F 190823664 URCZNAKAXSABBX-UHFFFAOYSA-N 394.259 5.832 30 20 GKED C=C(C)C[C@@H](C)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 191743760 PFMLWEWBYMZIRW-MRXNPFEDSA-N 384.545 5.127 30 20 GKED C=CCn1c(SCCSc2ccc(F)cc2)nnc1-c1ccoc1C 195570282 WFPSYNJTDPKLGS-UHFFFAOYSA-N 375.494 5.056 30 20 GKED N#Cc1cccc(COc2cccc(/C=C\C(=O)c3ccc(F)cc3F)c2)c1 208110269 FNCLHAAILUZBMM-YFHOEESVSA-N 375.374 5.312 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccccc2F)cs1 255413648 ZKFSSLFHCBBUQX-XFXZXTDPSA-N 380.444 5.171 30 20 GKED COc1cc([C@H](C)NCCCCC(C)(C)C#N)ccc1OCc1ccncc1 278807548 OYAUPKKFXDJSLD-SFHVURJKSA-N 381.520 5.040 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 303487159 PJQNCGKULHNSLC-PNHOKKKMSA-N 386.417 5.290 30 20 GKED O/C(=N/[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F)c1ccnc(O)c1 329147846 PHBHAHJCTWLXRV-NVXWUHKLSA-N 378.394 5.227 30 20 GKED COc1cccc(F)c1[C@H](C)/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329490893 VFHXXHGQQQDRAJ-DOTOQJQBSA-N 399.510 5.359 30 20 GKED CC(C)c1noc2ncc(/C(O)=N/[C@H]3CCCc4cn(C5CCCC5)nc43)cc12 329523289 ROVNROFBWRMVJO-SFHVURJKSA-N 393.491 5.040 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@H](c2ccc(F)cc2)C2CCCC2)CC1)C1CC1 330035992 XXCDUIYBYHWCNC-MNLRITNHSA-N 386.511 5.939 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@@H]3C)s1 410992443 WZSILTJYORCTOK-GRYCIOLGSA-N 389.546 5.112 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1c(-c2cccc(Cl)c2Cl)noc1C 430417089 UVGZLNMNMDSAIH-UHFFFAOYSA-N 386.238 5.389 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 433306251 RVAAAMXYNSBBBR-GHTZIAJQSA-N 394.927 5.380 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(C(=O)OC(C)(C)C)cc1 434878126 CIHSVNSMZURLOI-INIZCTEOSA-N 382.529 5.506 30 20 GKED N#Cc1cccc(C2(C(=O)N3CCC(c4ccccc4C(F)(F)F)CC3)CC2)c1 435263409 PMBVDRJUJXMMIT-UHFFFAOYSA-N 398.428 5.015 30 20 GKED COC(=O)c1cccc(-c2nc(CS[C@@H](C)c3ccc(C#N)cc3)cs2)c1 437280314 ZJPHHOXHJBHEPT-AWEZNQCLSA-N 394.521 5.463 30 20 GKED N#CCC[C@@H](NC(=O)c1cccc(OCc2cccs2)c1)c1ccccc1 439671755 HXAQTFQADMNKRY-OAQYLSRUSA-N 376.481 5.102 30 20 GKED CC(C)[C@@H](c1ccccc1Cl)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 441401893 NPALMUDXAGPYCA-FQEVSTJZSA-N 380.879 5.091 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cc(Cl)c(Cl)cn2)c1 443965971 PCLIQYPDOCQZFB-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)c2ccccc21 444347416 XZNKMRLFWMMCCK-UHFFFAOYSA-N 388.254 5.210 30 20 GKED CC(C)[C@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)c2ccccc2N1 444807928 YFYYDUSOAQLRRF-OAQYLSRUSA-N 386.499 5.042 30 20 GKED C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1Cc1nnc(-c2ccc(C#N)cc2)o1 446738219 GMTZMSNTQGZCSD-GFCCVEGCSA-N 399.281 5.034 30 20 GKED CC[C@H](CNc1ccccc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 454747895 ALMZMMXMHYXQMQ-DLBZAZTESA-N 382.533 5.093 30 20 GKED C[C@H](C(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)c1cccc(C#N)c1 461799366 WCAOKICEIPRVLW-ZDUSSCGKSA-N 381.888 5.001 30 20 GKED C[C@H](C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 461964390 JZVRGIFMKKNLRV-XOBRGWDASA-N 380.900 5.282 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)[C@@H](C)c2cccc(C#N)c2)cc1 462148210 ZHJLKEYBZJJPSD-ZWKOTPCHSA-N 384.479 5.215 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1cccc(COC(C)(C)C)c1C 464403784 IQKRUJPIKUSTKK-UHFFFAOYSA-N 383.488 5.136 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 465389984 WUIKHSDTMYJJGK-JTQLQIEISA-N 386.820 5.023 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccccc1C1CC1 466460745 FFVQOHXZRPGASE-MRXNPFEDSA-N 396.581 5.830 30 20 GKED COCC[C@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 467152953 SIVIMYIUNXYPJX-LJQANCHMSA-N 393.487 5.021 30 20 GKED C=CCC[C@@H](NC(=O)NCCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 467758899 MPOWTKMUHOKKOB-QGZVFWFLSA-N 397.466 5.020 30 20 GKED N#Cc1cccc(C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 474261379 YOORQOFECHONOH-OAHLLOKOSA-N 386.295 5.001 30 20 GKED Cc1sc([C@H](C)NC(=O)c2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 479215466 YCNRRZFVPIFPSC-LBPRGKRZSA-N 381.888 5.135 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1ccc2c(c1)CCC(=O)N2CC1CC1 482000409 OWBMZJKMDWCJMT-QHCPKHFHSA-N 385.511 5.127 30 20 GKED C=C(C)[C@H](NC(=O)NCc1ccc(-c2ccncc2)cc1)c1ccc(F)c(F)c1 483085528 FWHMQBJQQYSVBV-QFIPXVFZSA-N 393.437 5.143 30 20 GKED N#CCC[C@H](NC(=O)NC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1 483236941 ABQDBWYWOVZNQY-SCCNAQOGSA-N 385.870 5.011 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)cc1 483360797 RILGMTJWIGVGJD-UHFFFAOYSA-N 389.886 5.383 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@H](C)c1ccc(F)c(F)c1 489654296 YPUHITWOGIZKDQ-CQSZACIVSA-N 387.455 5.175 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 494800818 PGKDDWLKXQOIQI-GWCFXTLKSA-N 388.327 5.240 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)c1sc2ccc(C#N)cc2c1C 505701090 UTRPZGWQAJHQKS-UHFFFAOYSA-N 376.525 6.410 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cscc1Br 506045474 FPRDHODYALDDCJ-UHFFFAOYSA-N 378.335 5.544 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)cc1F 513712458 CSQDGMWTPUDOQP-GXTWGEPZSA-N 392.352 5.407 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 517785419 SFGDFOQZVVWLSN-UHFFFAOYSA-N 381.479 5.572 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 518005364 OICLVZZPGVVSGH-GOSISDBHSA-N 399.494 5.661 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)sc2c1CCC2 518073757 FZMCYJWYUVWASV-CHWSQXEVSA-N 377.296 5.157 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1 520634103 PZARLKJPZFEOSL-UHFFFAOYSA-N 396.277 5.103 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520724785 XCJQWVKUJBLXMW-CQSZACIVSA-N 392.455 5.311 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)Sc2ccnc3ccccc23)c1 521345405 AYTAQUFVNXXGLZ-SFHVURJKSA-N 389.524 5.279 30 20 GKED CC(C)(NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1nccs1 522581336 GJEVARJGQKPWIH-UHFFFAOYSA-N 397.887 5.126 30 20 GKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1 523142202 ZLBRMCDREMYOMG-CJFMBICVSA-N 390.527 5.416 30 20 GKED CC(C)c1ccc(CCCNCc2cn(CCC#N)nc2-c2ccccc2)cc1 523938818 GIGSJWMNDKYRPO-UHFFFAOYSA-N 386.543 5.310 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCCOc2cc(Cl)ccc21 540502503 MDSSAAFLEPODSF-QGZVFWFLSA-N 376.909 5.013 30 20 GKED COC1CCC(CCNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 541749702 RDAOIWXTGNOLNB-UHFFFAOYSA-N 393.487 5.067 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)s2)o1 542865296 ILWOSKJBZXPSCY-CQSZACIVSA-N 382.510 5.963 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543113322 RMTXYAYVIBHFRY-QGZVFWFLSA-N 386.543 5.644 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 558239490 RLYRXFRXEFCFKM-RTBURBONSA-N 387.405 5.229 30 20 GKED Cc1ccc2c(CCC(=O)N(Cc3ccccc3)c3ccccc3C#N)c[nH]c2c1 564702297 BVASUIQLMCDITJ-UHFFFAOYSA-N 393.490 5.514 30 20 GKED C[C@H](N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccc(C#N)c1 569462240 KNSCLTGZYOGUSV-BTYIYWSLSA-N 388.433 5.396 30 20 GKED C=CCC1(c2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)CCOCC1 570920230 SHCXTHKBRAMKQN-UHFFFAOYSA-N 397.862 5.202 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)CC1 572343431 OGFDTFOKFLQHBC-UHFFFAOYSA-N 388.298 5.818 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 576033431 IDKFGDGHGYNLQP-UHFFFAOYSA-N 398.466 5.356 30 20 GKED Cc1ccc(C#N)cc1NC(=O)C(C)(C)c1csc(-c2ccc(F)cc2C)n1 579538808 LKUKRWYYDBWTIN-UHFFFAOYSA-N 393.487 5.354 30 20 GKED Cc1cccnc1/C=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 588456804 CSQPNFORHBRVPH-HLRDLLSLSA-N 379.872 5.057 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1C(F)(F)F 597186160 FOHUITBYVLDKEG-LBPRGKRZSA-N 394.418 5.361 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1cccc(Cl)c1Cl 604496528 FVVDCGQJZOFTHT-UHFFFAOYSA-N 390.314 5.233 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cccc(OCc4cccs4)c3)[nH]c12 605363009 CPUWHXQLSHIFFQ-GOSISDBHSA-N 387.464 5.002 30 20 GKED CCS[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)C 608939145 ZMDVAALSEAGUBM-NRFANRHFSA-N 382.529 5.048 30 20 GKED COc1ccc(CN(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609209043 QFSNNQAIFSAZAW-UHFFFAOYSA-N 387.439 5.023 30 20 GKED CCCN(C(=O)c1ccc(Br)s1)c1cc(Cl)ccc1C#N 609285599 BRWAEYFBLYYVHC-UHFFFAOYSA-N 383.698 5.092 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610719389 DLZAJIZPJOJSEJ-ZWKOTPCHSA-N 376.504 5.128 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 611395009 DMVYRMLXPUNOSC-ISKFKSNPSA-N 387.914 5.558 30 20 GKED CC(C)(C#N)CNC(=O)c1oc2ccccc2c1CSc1ccccc1F 611693652 UEJRDSXVOBVHHJ-UHFFFAOYSA-N 382.460 5.144 30 20 GKED Cc1ccc(C(=O)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 611872171 VQKJDIMMODRTKE-FQEVSTJZSA-N 388.854 5.125 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c2ccccc12 613318186 OWDHDGFQPJMEHF-FQEVSTJZSA-N 398.487 5.770 30 20 GKED CC(C)(C#N)c1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 614160721 YAIUVBYZYCASSS-HUUCEWRRSA-N 378.360 5.050 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)C1 661378949 PCHZLMOBYPHQLZ-HXUWFJFHSA-N 397.588 5.541 30 20 GKED O=C(CCCCCc1ccc(F)cc1)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 681664867 MZXNPICLQAROKD-HUUCEWRRSA-N 399.350 5.128 30 20 GKED C=CCc1ccc(OC(=O)c2csc(-c3ccccc3Cl)n2)c(OC)c1 727297111 YBFNSNCWCGNLTN-UHFFFAOYSA-N 385.872 5.420 30 20 GKED Cc1ccccc1CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 729070653 SLERGXOLUWUKHT-GOSISDBHSA-N 380.900 5.581 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc2ccccc2c1 733080876 DZTICZRIXMQEKV-ZHACJKMWSA-N 386.432 5.768 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC[C@H](c2cc3ccccc3[nH]2)C1 735308672 ODKOGSCAOUBONF-KRWDZBQOSA-N 379.891 5.103 30 20 GKED C[C@H]1/C(=C/c2nccn2Cc2ccccc2)C(=O)c2cccc(Br)c21 742434994 PFGQDCJUYHPURI-VMOJBDSFSA-N 393.284 5.077 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 742538269 WKNCDLUNRYYCRB-QMTRIVCPSA-N 390.527 5.654 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)s1 744352329 ZCXXUKAKZLNHPM-HJWRWDBZSA-N 394.525 5.088 30 20 GKED CCc1oc2ccccc2c1C=NO[C@@H](C)c1nnc(-c2ccc(C)cc2)o1 748098187 XQYATOHNZZNATC-HNNXBMFYSA-N 375.428 5.465 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1cccc(Cl)c1 750684278 OYTYVMVEZPEINZ-NLBZTSMMSA-N 388.854 5.244 30 20 GKED CC(=C/c1ccc(Cl)cc1)/C=C/C(=O)c1ccc(N2CCC(O)CC2)cc1 753718303 WLKNBEMXHMBAJP-CKCRDDQJSA-N 381.903 5.144 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cs1)c1nc2cc(C(F)(F)F)ccc2s1 759441993 WIMJJJYHBXOVPA-VIFPVBQESA-N 386.807 5.520 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)cc1 765817999 NCPPYVIJTXJNIL-UHFFFAOYSA-N 393.874 5.185 30 20 GKED C#CCCOc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 767422277 QAGCXCNMHWZNFN-XMMPIXPASA-N 390.914 5.211 30 20 GKED COc1cccc([C@H](C#N)NC(=O)c2c3ccccc3cc3ccccc23)c1OC 768153552 ZDBCZAMZANPPTA-NRFANRHFSA-N 396.446 5.005 30 20 GKED Cc1cncc(/C=C/C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 772062299 UOAPBNGQLYFMTF-CLNPQZTCSA-N 387.870 5.351 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccccc1F)C1CCCC1 780674543 OZLZDHOTTVCLTC-YCRPNKLZSA-N 381.451 5.170 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)C(C)C 788787943 BCLDVDQWMWRDNV-UHFFFAOYSA-N 381.263 5.004 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792093973 BSZMZHNNYFVRMD-AUUYWEPGSA-N 382.385 5.624 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccccc1OC(F)F 792102558 QFUIVYQQHARUFL-FFWXCITRSA-N 378.378 5.116 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Oc2ccc(NC(=O)c3cccs3)cc2)cc1 792877580 ZZWLQBHUHOULBR-UHFFFAOYSA-N 390.464 5.021 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1 793892363 SNFLWAINXWMIGT-RTWAWAEBSA-N 396.535 5.102 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)CC1CCCCC1)c1nc(-c2c(F)cccc2F)cs1 796668948 BTJMHDVRKLLUKW-BBRMVZONSA-N 392.446 5.573 30 20 GKED C[C@H](NC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 797006972 ZBBGZPAUZOODLR-AOMKIAJQSA-N 384.907 5.061 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C/c3csc(-c4ccc(F)cc4)n3)cc12 806578473 HAPLAEDJJSTGMQ-BQYQJAHWSA-N 383.473 5.102 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@@H]([C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 814673922 LYSYJYSSLFMYDU-UXHICEINSA-N 391.600 5.066 30 20 GKED O=[N+]([O-])c1cccc([C@@H](NCc2cccc(C(F)(F)F)c2)C(F)(F)F)c1F 839650405 BGOFEYKABVLXEQ-CQSZACIVSA-N 396.262 5.146 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1nc(C2CC2)cs1 842940709 DHIBQOJLUSPRNO-BLRBJFNZSA-N 378.497 5.232 30 20 GKED CC[C@H](C)NC(=S)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 843277877 VBMOGEYRVFVLMJ-QMMMGPOBSA-N 376.341 5.061 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ncc(Cc2cccc(OC)c2)s1 915322415 YQIYKSRPSVEIRR-UHFFFAOYSA-N 399.541 5.024 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047301 WMRQJYWLZAQSJK-IUODEOHRSA-N 386.929 5.448 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(OCc2ccccc2)c1 1776033396 ZZZZKQPBCCZLGG-UHFFFAOYSA-N 394.858 5.453 30 20 GKED O=C(O)Cc1ccc(NN=C(CCc2ccccc2)CCc2ccccc2)cc1 1776084630 FQJFAJRGASMGDK-UHFFFAOYSA-N 386.495 5.347 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776388672 ZXIBKIDHDKWNJL-BENRWUELSA-N 392.476 5.797 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccccc2SC(F)(F)F)cc1)C(=O)O 1776470535 ZEZQLHADGYAIKA-OBIHZWKSSA-N 396.386 5.047 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)c1)C(=O)O 1776470697 CVKGEHHWGLUIFS-BWNDKRECSA-N 398.764 5.107 30 20 GKED CCCCCOc1cc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)ccc1OC 1776793060 IQYQQWHTMVPWHT-FLIBITNWSA-N 382.456 5.167 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3ccc(C(=O)O)cc3O)ccc21 1777002701 AHHVQMCDUKAUTN-XYOKQWHBSA-N 385.419 5.114 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(C2(NC(=O)c3occc3C)CCC2)cc1 1786103761 ZHBIYUBHUBWPPG-UHFFFAOYSA-N 392.499 5.104 30 20 GKED Cc1cc(C(=O)/C(=C(\S)Nc2ccc(C(C)C)cc2)[n+]2ccccc2)c(C)[nH]1 23603568 NRSKGOBWNBTXGZ-UHFFFAOYSA-O 392.548 5.093 30 20 GKED Cc1noc(C(C)C)c1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 46347357 IZJCXYPNCHZUME-UHFFFAOYSA-N 389.455 5.004 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)CCc1ccc(C#N)cc1 49758104 WVZXSHUXKUOYKL-UHFFFAOYSA-N 398.466 5.082 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)cc1 61109681 PEROEUNUEIIFNR-UHFFFAOYSA-N 388.279 5.170 30 20 GKED C=CCn1c(SCc2ccc(OCc3ccc(F)cc3)cc2)nnc1C1CC1 63415608 IMFWOPZMEUTROF-UHFFFAOYSA-N 395.503 5.352 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 78668939 MYHITVHQZPYZRC-HOTGVXAUSA-N 390.430 5.453 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(F)cc3)o2)nnc1-c1ccoc1C 79298135 OHIJHCYLKFLUJO-UHFFFAOYSA-N 396.447 5.119 30 20 GKED Cc1nc(COc2ccc(CNc3cccc(OCCCC#N)c3)cc2)cs1 122832119 YMLSIHBOBNXIFQ-UHFFFAOYSA-N 393.512 5.325 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(SC(F)F)cc1 128755797 SYTPDLPWIWUUFF-QGZVFWFLSA-N 396.418 5.116 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 133048785 FQKWGJZNYHUJSJ-AWEZNQCLSA-N 394.456 5.256 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1nc(Cc2ccc(F)cc2)no1 133216199 APDQZYNYJQHWJP-HUUCEWRRSA-N 396.491 5.224 30 20 GKED Cc1c(C#N)c(NC(=O)CS[C@@H](C)c2cccs2)n(Cc2ccco2)c1C 133845030 ZKROVUKNDYTATO-HNNXBMFYSA-N 399.541 5.112 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)c1 160757513 WMCJBJVEEPXCIP-UHFFFAOYSA-N 398.285 5.005 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-c4ccccc4)[nH]3)n2)cc1 171797796 SUMFOKDDKLZHLS-SFHVURJKSA-N 394.459 5.167 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2c1 176188765 SJCXDJYIKXBSKP-QGZVFWFLSA-N 375.497 5.491 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2ccc(OCC#N)cc2)ccc1OCC(C)C 181599277 YJKHLQMGLSJSBR-QZTJIDSGSA-N 382.504 5.044 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(C)cc2)n1)c1ccccc1 191971675 KNJBXMQNPUOJHQ-UHFFFAOYSA-N 377.513 5.329 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 192482448 OWBAWEPJALYRCJ-NRFANRHFSA-N 385.854 5.314 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C(\C)c3ccc(F)cc3)n2)cc1 211138706 GOQVEIVGDZOXJO-VUVZNRFTSA-N 392.455 5.238 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1ccccc1 212535213 GCELVWQRLKJJGH-QPEQYQDCSA-N 389.407 5.079 30 20 GKED N#CCCCOc1cccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1 255552830 VGTLGPXFPMEFCI-HAVVHWLPSA-N 385.423 5.261 30 20 GKED Cc1ccc(/C(O)=N/CC(F)(F)F)cc1N=C(O)N(C)[C@@H](C)C1CCCCC1 330450435 XTCPONZCGVIMFO-AWEZNQCLSA-N 399.457 5.308 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c2[C@@H](C)C1 411024019 YZGIMSCUTLKAEC-RYUDHWBXSA-N 394.525 5.076 30 20 GKED COC(=O)[C@@H](C)c1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 416822622 XKGZJYQFTOQZKT-GJZGRUSLSA-N 397.500 5.001 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1COCc1ccccc1 429108678 HTXBAVYWZXOVSK-UHFFFAOYSA-N 379.504 5.197 30 20 GKED Cc1ccnc2[nH]c([C@@H](C#N)C(=O)c3ccc(CSc4ccccc4)cc3)nc12 429597784 MGVVXMVLPIMANT-IBGZPJMESA-N 398.491 5.049 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2c(Cl)cc(F)cc2Cl)cc1 432990995 HUJIZXQEVCHVMA-MRXNPFEDSA-N 379.262 5.425 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(Cl)cc2Br)cc1C#N 435359010 UDADCQIWQZWXBX-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(Nc2cccc(C)c2)CC1)c1ccccc1 435766408 XMGCLPNVRDXAOO-HSZRJFAPSA-N 377.532 5.288 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(ccc3ccccc32)[nH]1 436336410 VQTFLVNELVHHRB-XUZZJYLKSA-N 379.463 5.233 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)o1 438636544 LCYJSZVEGMPJPN-QGZVFWFLSA-N 391.393 5.628 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)N[C@H](CCC#N)c2ccccc2)cc1 440239573 JPGWZULIDXPXHM-YTFSRNRJSA-N 375.516 5.318 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC2CCC(C#N)CC2)C1 441006569 UYSYLZHARGGGMV-XTUQQUOLSA-N 393.453 5.128 30 20 GKED CC[C@@H](CC(F)F)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457708078 MWMRBCUKIRICOX-QPUJVOFHSA-N 377.275 5.106 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccc(Cl)cc1 461109148 CTLFTVYTVOMQEV-IKGGRYGDSA-N 379.674 5.131 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464419042 UAWQVSDZINUCNM-LLVKDONJSA-N 393.415 5.084 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(OCCC(C)C)cc2)cc1 467348508 GFELLKDBKUDMJU-UHFFFAOYSA-N 396.491 5.063 30 20 GKED Cc1oc2ccccc2c1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 467839969 RFXFIYBQHAIYEQ-ZDUSSCGKSA-N 394.402 5.633 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc2c(c1)CCCC2 469089601 QBAVFDZJRSZDBV-GOSISDBHSA-N 387.527 5.321 30 20 GKED COc1ccc2c(c1)[C@H](N(CCCC(C)(C)C#N)Cc1ccccc1)CCO2 472235060 UXYCFZLZZYKYPV-JOCHJYFZSA-N 378.516 5.351 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)[C@H]1Cc2ccccc2O1 475564465 BEYGCGOZHDCYRV-HTAPYJJXSA-N 378.516 5.394 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N(C)c2cc(Cl)ccc2C#N)cc1 479572520 FHFSTPJTRJAJPF-UHFFFAOYSA-N 395.915 5.158 30 20 GKED Cn1cc(CNc2ccc3oc(C(C)(C)C)nc3c2)c(-c2ccc(C#N)cc2)n1 480025015 LLLMJUIGXKLBRZ-UHFFFAOYSA-N 385.471 5.010 30 20 GKED Cc1ccccc1[C@H](C)SCC(=O)Nc1ccccc1S[C@@H](C)CC#N 480380077 AYHRGCHVPWTBTE-IRXDYDNUSA-N 384.570 5.822 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@@H](C)Sc1ccc(C(C)C)cc1 481492493 HHALNFYIMXZKMI-QGZVFWFLSA-N 382.529 5.246 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@@H](c3ccccc3)c3ccco3)c2)cc1 482026443 SBHJDBFMIFMZEN-DEOSSOPVSA-N 394.430 5.463 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)Cn1ccc2ccccc21 483382130 VYERLBMXTIWWTN-UHFFFAOYSA-N 397.453 5.194 30 20 GKED CC1(C)C[C@]1(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 484908255 KNNWFBNVTHUMAU-JOCHJYFZSA-N 394.858 5.087 30 20 GKED Cc1ccc(-c2nnc(S[C@H](C#N)C3CCCCC3)n2Cc2ccco2)cc1 489445392 FCTLMFOKANWBHV-HXUWFJFHSA-N 392.528 5.459 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1F 499826628 IJZGNTAZDJMMLR-UHFFFAOYSA-N 382.341 5.329 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3nc(-c4cccc(C#N)c4)cs3)cc2c1 501133194 JKGLSLXQRSAHRT-UHFFFAOYSA-N 384.464 5.099 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(-c4ccccc4)ns3)n2)c1 501164765 SXWMCEFUHYCRLU-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C=CCCc1ccccc1NC(=O)CSc1nc(C)c(Cc2ccccc2)[nH]1 504277121 OMABEHSWYNAHAW-UHFFFAOYSA-N 391.540 5.158 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1 505052549 UZQWJBGRKDDRJE-OAHLLOKOSA-N 394.450 5.185 30 20 GKED C[C@@H]1C[C@@H](C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 510023641 NXWWKCBTQULAQZ-QINHECLXSA-N 381.907 5.505 30 20 GKED COCCN(CC(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510042035 GEALKJMSKOCRLE-FQEVSTJZSA-N 399.922 5.132 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)cc1 513191099 DLJQRBJGUGQUNX-SFHVURJKSA-N 384.479 5.503 30 20 GKED COc1cccc2c1N(C(=O)c1ccc(Oc3ccc(CC#N)cc3)cc1)CCC2 518903687 OWPXTYUKCXBHQF-UHFFFAOYSA-N 398.462 5.147 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCC[C@H]1c1ccccc1 519062659 VEPOZPSDNZRKLQ-GOTSBHOMSA-N 375.516 5.205 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2cccc(OCCCC#N)c2)c1C1CC1 534988996 RWNAGWPEAVKRGP-HNNXBMFYSA-N 381.480 5.058 30 20 GKED N#CC1(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)CC1 536585094 YTSNEJAMBNVOIX-UHFFFAOYSA-N 380.904 5.043 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 540364172 XDNDCWRFEJZJDM-AWEZNQCLSA-N 393.434 5.403 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@@H](C(C)(C)C)C1 543306254 IQZGDFCTHLEWOF-HXUWFJFHSA-N 391.515 5.346 30 20 GKED N#Cc1cccc(C2(NCc3cccc4c(Br)cccc34)CC2)c1 551412238 SMPCWFTUDOHYHL-UHFFFAOYSA-N 377.285 5.253 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1c(F)cccc1Cl 557427374 BHJUFLZCANBBFU-GFCCVEGCSA-N 377.872 5.195 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 558189717 CFUXLIOTSKHAQJ-UHFFFAOYSA-N 382.419 5.330 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(-c2nccs2)cc1 558266657 BJTCOIALQFLKSK-UHFFFAOYSA-N 395.532 5.198 30 20 GKED N#Cc1c(NC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)sc2c1-c1ccccc1OC2 560682002 AHJQFSCITQWEOO-QWRGUYRKSA-N 392.402 5.096 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@H]1c1ccsc1 564381335 WMNPTFBVJDHVMR-YJBOKZPZSA-N 398.507 5.146 30 20 GKED Cc1c(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)cnn1C1CCCCC1 571154701 XIYKVBRBIGHQLE-UHFFFAOYSA-N 394.563 5.021 30 20 GKED N#CCCCCCC(=O)NC1(Cc2ccc(Br)cc2)CCCCC1 588906708 LSKGFDZQLPBNTL-UHFFFAOYSA-N 391.353 5.285 30 20 GKED N#CCCC[C@H](NCc1ncc(Br)cc1Cl)c1ccccc1 595503339 RUEDBJSGZRMRJE-INIZCTEOSA-N 378.701 5.022 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 603991839 CRAOCNPMQKVPSW-UHFFFAOYSA-N 393.537 5.526 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c(C)c1 608552884 KWLBPABFAWEUJN-CQSZACIVSA-N 390.386 5.122 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cc2ccccc2n1CC#N 609169808 IDCOHLAWFYSBHI-SFHVURJKSA-N 399.519 5.630 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H]1CCc2ccccc21 609371398 IYPSLCVIMGUVOF-HNAYVOBHSA-N 382.554 5.298 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)cc1 609469302 WCRKFULQHKVSEX-RUZDIDTESA-N 391.474 5.817 30 20 GKED Cc1cccc([C@@H](C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 610048276 SEMZQYCNEJTISW-LJQANCHMSA-N 384.479 5.496 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc(C#N)c1 610324211 SYPSXRXEJHFSFD-MRXNPFEDSA-N 382.423 5.105 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1cccc(C#N)c1 610360223 TYCCOSFKDDXLOJ-MRXNPFEDSA-N 383.476 5.072 30 20 GKED Cc1noc(C(F)F)c1C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 610432229 ZSZWGVZWNRVXHZ-JTQLQIEISA-N 393.459 5.257 30 20 GKED Cc1ccc(F)cc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 613404873 PRYMNXQVOQDUTK-CYBMUJFWSA-N 378.350 5.253 30 20 GKED C=C(C)CN(CC)C(=O)[C@H](C)Sc1nnc(-c2ccccc2)c2ccccc12 617466016 LQPXQBSMQCWCEU-KRWDZBQOSA-N 391.540 5.202 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1-c1ccc(F)cc1 674895188 YVAGVDZSNAAHEM-IBGZPJMESA-N 386.451 5.901 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccc(OCC)cc3)cc2)c1 726439421 XZFGCDDHNVVEMV-UHFFFAOYSA-N 388.492 5.668 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 727267159 OJOOGBSQLBMBBZ-LXSSAFMLSA-N 398.764 5.107 30 20 GKED COc1ccc(/C=C\C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 727997193 UHCBFCKJFPREON-JYRVWZFOSA-N 398.462 5.106 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(Cl)n3)cc2Cl)c1 727999647 MKNUQJVBGLZNQT-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 732811714 WEKBQDZDOOYIER-XMSQKQJNSA-N 391.540 5.110 30 20 GKED C[C@@H](OC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccc(C#N)cc1 735675184 COKJNICIXFKTOM-MRXNPFEDSA-N 379.419 5.086 30 20 GKED C[C@@H](NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 739437632 OKPACRSHMDXAHR-OAHLLOKOSA-N 377.538 5.012 30 20 GKED C[C@H]1/C(=C/c2c[nH]c(-c3ccccc3)n2)C(=O)c2cccc(Br)c21 742434352 GBYLPGRVRFEXGX-KPENOIPVSA-N 379.257 5.223 30 20 GKED CS[C@@H]1CC[C@H](NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 742743244 VIXYYWJHZVDRQS-FUHWJXTLSA-N 386.904 5.018 30 20 GKED C[C@H](OC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 744336864 ZIUBLOYTCDTFNV-AIYRYJHASA-N 380.206 5.231 30 20 GKED CCOc1ccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)cc1 747705801 JUMZYDCNYIRNKP-UHFFFAOYSA-N 379.529 5.099 30 20 GKED CCOc1c(OC)cc(C=NN(Cc2ccccc2)c2ccccc2)cc1OC 750912391 NSHUYWPTGBDHEJ-UHFFFAOYSA-N 390.483 5.143 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(C(F)F)c2Cl)c1 758227336 ZUIQVBXIGNFKMR-CYBMUJFWSA-N 393.821 5.280 30 20 GKED COc1cc(C=NOCc2nc(-c3ccccc3)cs2)cc(Cl)c1OC 766685855 VIYBYXXHEYRTEP-UHFFFAOYSA-N 388.876 5.031 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(SC(F)F)nc1 771470561 NSBFEFZVSODVGE-UHFFFAOYSA-N 381.407 5.187 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2(Cc3ccccc3)CC2)cc1 775487012 FXLCAKHKVFWSIB-QHCPKHFHSA-N 381.479 5.239 30 20 GKED CC(C)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776156911 OTRBSDOEMKJRRB-FOIQADDNSA-N 376.422 5.656 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2ccccc2)c2ccccc2Br)c1 779120765 OOVAVTZHLANDHQ-OAQYLSRUSA-N 395.275 5.339 30 20 GKED CC[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 784821075 KWDNJIOFLKPICA-UKRRQHHQSA-N 385.533 5.058 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ncc(C(F)(F)F)s1 788357298 XVBAANXQCJQKFW-SREVYHEPSA-N 398.406 5.629 30 20 GKED Cc1ccc(/C=C\C(=O)[C@@H](C#N)c2nccc3ccccc23)c(Br)c1 792104214 NZXUYUPJNMXSTI-CNZFZVQHSA-N 391.268 5.195 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)c1 796350354 AYXDTBINESBNBO-JKSUJKDBSA-N 377.431 5.241 30 20 GKED CC1=C(c2ccco2)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 801612272 MQVWESDZKYEMMY-JOCHJYFZSA-N 397.478 5.646 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 804559720 FNBCEQHFYWJRBW-SFHVURJKSA-N 397.416 5.098 30 20 GKED O=C(O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)[C@H]1CCC(F)(F)C1 809126160 HKJZPZQXLQCENI-GXSJLCMTSA-N 376.243 5.287 30 20 GKED C#C[C@@H](NCc1cc(-c2ccncc2)ccc1OC)c1ccc(Cl)cc1F 809698533 CHQJPWXTUZGQMS-OAQYLSRUSA-N 380.850 5.014 30 20 GKED C=C(C)C[C@@H](C)C(=O)N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1 837847783 WLIJQYMAEGLPEZ-QGZVFWFLSA-N 386.536 5.342 30 20 GKED CC(=NO[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1cc2ccccc2o1 852017093 TVTXTOTXDLYJPI-OAHLLOKOSA-N 384.863 5.471 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F 860478197 RPRIBKGXVHXKHK-IONNQARKSA-N 380.313 5.080 30 20 GKED O=C(/C=C\c1cc(Br)cs1)c1sccc1Br 915113402 OLQDRXQVPXQJOS-UPHRSURJSA-N 378.110 5.231 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3cccc(F)c3)CCC2)cc1 915181031 WKCYSSMFXGIVCH-HSZRJFAPSA-N 384.454 5.542 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(F)ccc3s2)cc1 916913989 JGLPKZSTPYXJBG-SFHVURJKSA-N 394.471 5.344 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 916948462 GUZAAIKYDJDIKD-JXSMBQFASA-N 394.437 5.216 30 20 GKED COc1cc(/C=C/C(=O)c2ccccc2C)cc(Br)c1OC(F)F 917142471 FEFQZZHCGJUEMG-BQYQJAHWSA-N 397.215 5.264 30 20 GKED Cc1cc(Oc2cc(Cl)ccc2C=NNc2cccc(C(=O)O)c2)ccc1F 1776037925 JWHLUGLALOFREZ-UHFFFAOYSA-N 398.821 5.724 30 20 GKED C=CCC[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)c1ccc(-c2ccccc2)cc1 1776165911 GZUVEMHAKGIKLM-GOTSBHOMSA-N 393.527 5.614 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(Cl)cc1Cl 1776354383 KCQNIKZOOYAIAJ-QPJJXVBHSA-N 379.239 5.375 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC)c(O[C@@H](C)CC)c1 1776784264 ZGSVUWKDHOJSOP-PKOBYXMFSA-N 379.541 5.166 30 20 GKED CCCCCCOc1cccc(/C=C\C(=O)c2cccc(O[C@H](C)C(=O)O)c2)c1 1776790353 QLXBVJMEHHJCGA-SWNWVQGVSA-N 396.483 5.394 30 20 GKED COc1ccc(/C=C2/CCc3ccc(SC)cc3C2=O)c2cc(C(=O)O)oc12 1777360227 HCQBFVHAUMVAAO-ZROIWOOFSA-N 394.448 5.074 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2c(Cl)cccc2Cl)cc1 1777639358 HNLXFLQTWZCZEB-ZHACJKMWSA-N 379.239 5.133 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc3cc(Br)ccc3s2)c1 1777686078 GMWBYYWBTQHXCA-WAYWQWQTSA-N 387.254 5.258 30 20 GKED Cc1nc(COc2cccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c2)cs1 25439147 YZQGNJGTZGTYEL-UHFFFAOYSA-N 391.496 5.084 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1C(F)(F)F 66907344 HOHAWYVFHACLLB-LBPRGKRZSA-N 379.407 5.744 30 20 GKED Cc1ccccc1C1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 108530529 WELJTQNDQAHEBX-QGZVFWFLSA-N 393.556 5.658 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccs1 115910014 HZYDGFNFIWENLZ-LLVKDONJSA-N 388.464 5.304 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(CSc3ccccn3)c2)cc1 125082337 NBFFVCMIMSZCCU-KRWDZBQOSA-N 375.497 5.277 30 20 GKED CC(C)c1csc(CNCc2cccc(OCc3ccccc3C#N)c2)n1 125614978 VTIMYISDTPLWDC-UHFFFAOYSA-N 377.513 5.007 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CNC(C)(C)CCc1ccccc1 151936659 LQDTUMONOHELQW-GOSISDBHSA-N 395.572 5.020 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cccc(F)c1F 161549392 OWFRMJYXDQDKJG-CHWSQXEVSA-N 375.444 5.099 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1[N+](=O)[O-] 176989815 GUXULERBJBYNML-UKRRQHHQSA-N 398.488 5.038 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(CCc1cccc(F)c1)C1CCCC1 180013652 DVKXMQQTSLWOIA-KRWDZBQOSA-N 395.478 5.136 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCC[C@@H]1CCCCO1 184091267 XFQKDPAPDLQUBE-IBGZPJMESA-N 393.487 5.130 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(OCc2ccccc2)CC1 191487352 VKMJOLVUVCXECL-UHFFFAOYSA-N 392.543 5.752 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC(c3ccncc3)CC2)cc1 192286312 CQMGVDMLULTDCX-UHFFFAOYSA-N 397.478 5.074 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1cccc(Br)c1 209742133 GYZFBYSTBHAGQF-SREVYHEPSA-N 376.300 5.530 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 214013715 IWQAUXUIRVVEMR-RQOWECAXSA-N 376.846 5.329 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1Cl 214015415 KBMYNLWPQPPDNM-ARJAWSKDSA-N 391.901 5.438 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 237788602 KECJYHDKCDDGHV-JOCHJYFZSA-N 396.943 5.963 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl 284490660 BNQFLJAWGXPXDT-VMGRFDJRSA-N 398.359 5.128 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2ccc3nc(C4CC4)sc3c2)no1 329393063 ULGFKBCHQNYIPQ-MRXNPFEDSA-N 397.504 5.028 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)[C@@H](C#N)CCc2ccccc2)c1 433344947 VCMQBECBJMWILE-MRXNPFEDSA-N 392.446 5.361 30 20 GKED C/C(=C\c1ccc(-c2cccc(Cl)c2Cl)o1)c1nc(=O)c(C#N)c(C)[nH]1 435339534 VBVDWHGEENCAQB-CSKARUKUSA-N 386.238 5.077 30 20 GKED Cc1sc(NC(=O)CSCc2ccc(C#N)cc2OC(F)F)c(C)c1C 439520934 AOWFEFYGLATMPW-UHFFFAOYSA-N 396.484 5.018 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458853570 WRNIYUSSOZZHMG-FGZHOGPDSA-N 379.504 5.223 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)[C@H](C)c2cccc(C#N)c2)cc1 462135244 PJFWGHSMIKDARG-MOPGFXCFSA-N 398.506 5.557 30 20 GKED C[C@@H](C(=O)N(Cc1cccs1)c1ccc(F)cc1F)c1cccc(C#N)c1 463465157 UOOBHUJEPRQPKA-CQSZACIVSA-N 382.435 5.235 30 20 GKED CSc1cccc([C@H](NC(=O)c2cccc(C#N)c2)c2cc(F)ccc2F)c1 464113813 IPYHITQCWHOGCZ-NRFANRHFSA-N 394.446 5.078 30 20 GKED C=CCCCN(C)C(=O)N[C@H](c1cc(F)ccc1F)c1ccccc1Cl 466228518 VVHSZJXBRLTEPG-IBGZPJMESA-N 378.850 5.315 30 20 GKED N#C[C@@H](C(=O)c1ccc(Sc2ccc(Cl)cc2)o1)c1nc2ccccc2o1 478101847 CXRJUXUMNSTIGG-AWEZNQCLSA-N 394.839 5.715 30 20 GKED CCN(C(=O)[C@H](C)Oc1cccc(Cl)c1Cl)[C@@H](C)c1ccc(C#N)cc1 480045945 RZWAOFYJUYGRPX-KBPBESRZSA-N 391.298 5.242 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H](C)c1ccc(C#N)cc1 481335155 DUXCOCPWHPRDOU-CQSZACIVSA-N 398.919 5.255 30 20 GKED N#C[C@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1nccc2ccccc12 483210428 DHJVJFIKTCIWAZ-QHCPKHFHSA-N 394.499 6.017 30 20 GKED N#CC[C@@H](CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1)c1ccccc1 483966779 YOOJBJFWHPXHCR-HNNXBMFYSA-N 399.878 5.688 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cnc2ccccc12 484564503 AMEXIYBVWFFLLY-CQSZACIVSA-N 377.856 5.296 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487496871 AMCGBLDRRNNXPN-QFIPXVFZSA-N 390.527 5.536 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2C[C@@H](OC(C)C)c1ccccc1 488257808 CXDRNTXIXCTVGU-HXUWFJFHSA-N 380.875 5.001 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1ccccc1 488327158 DTFNZXGXVRVOPN-INIZCTEOSA-N 387.361 5.054 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](CC)c1ccccc1OCC 490061777 UBZHPKVEWLOOFF-NRFANRHFSA-N 398.551 5.102 30 20 GKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 494750639 GKDABLRXOZLYJA-ODECOBMASA-N 379.529 5.648 30 20 GKED Cc1ccc(-c2nc(NC(=O)CSCc3ccc(C#N)cc3)sc2C)s1 504832414 ZOSFGRKGYDWYNF-UHFFFAOYSA-N 399.566 5.232 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)c1cc(C#N)ccc1Cl 504846183 NSEGTJPNMLOERO-UHFFFAOYSA-N 396.899 5.124 30 20 GKED Cc1sc(CNc2ccc(C#N)cc2[N+](=O)[O-])nc1-c1ccc(Cl)cc1 505586159 SCBUAXAUSJNZLX-UHFFFAOYSA-N 384.848 5.164 30 20 GKED N#C[C@H](NC(=O)CCCc1c[nH]c2ccccc12)c1ccc(Cl)c(Cl)c1 505916306 AGEGMOBHFQJHAY-IBGZPJMESA-N 386.282 5.178 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c1C 510172880 OOPSSSWAQXKRJJ-QGZVFWFLSA-N 387.508 5.356 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2c2ccccc2)cc1 510673959 GFLBIOQQSLDTBK-QFIPXVFZSA-N 383.451 5.720 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)NCC(C)(C)CCC#N)s2)cc1 513134633 ANWBHDMLKQANSQ-QGZVFWFLSA-N 398.576 5.459 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc3[nH]c4c(c3c2)CCCCC4)c1 516399730 PQOOQZBMPZWOCR-UHFFFAOYSA-N 387.483 5.372 30 20 GKED C=CCOc1cccc(CNCc2ccc(-c3nc4ccccc4s3)o2)c1 517535393 GJOBKLXVSLYWAA-UHFFFAOYSA-N 376.481 5.411 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(Cl)c2F)cc1 518557729 NFDPTPJWVKOUGM-UHFFFAOYSA-N 384.769 5.534 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 518849975 IUVVCQPMONLIKU-ZDUSSCGKSA-N 392.267 5.013 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3ccccc3Cl)nc2)s1 530833848 GNGFZUVYHHFFLP-UHFFFAOYSA-N 383.860 5.275 30 20 GKED Cc1cc(C(=O)Nc2ccc(C#N)cc2Cl)ccc1NC(=O)c1cccs1 534000088 UYVOGOFAQPTUIN-UHFFFAOYSA-N 395.871 5.086 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c(C)n1 534892575 GNGNPAWNUNHKAM-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C=C[C@@H](CC(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1)c1ccccc1 535373985 ITRBPMIAWIBWGR-FQEVSTJZSA-N 375.512 5.085 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Cc1nc2ccccc2[nH]1 543066529 IYXHDCIZEAGMCO-HNNXBMFYSA-N 392.528 5.022 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1cc(C#N)ccc1F 544489768 DVKZCJOOYTVNJV-GFCCVEGCSA-N 385.895 5.634 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 545506522 KOAKULYTSCTNJE-OAHLLOKOSA-N 391.393 5.512 30 20 GKED C=CCC[C@@H](NC(=O)c1oc(C2CC2)nc1C)c1ccc(C(F)(F)F)cc1 546048160 GOVZWGXWGNDBTO-MRXNPFEDSA-N 378.394 5.317 30 20 GKED Cc1cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)sc1Br 551211486 ITVZKRXXIRMEIE-GOEBONIOSA-N 377.351 5.905 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1)CCO2 554161467 URNJMEZMBJGZPD-UHFFFAOYSA-N 399.450 5.086 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 568669598 MSXAPADFGZHEOR-AUSIDOKSSA-N 392.547 5.646 30 20 GKED C[C@H](NCc1cc(C(F)(F)F)ccc1Br)c1ccc(C#N)cc1 580679553 DABWCKDFQSMUJO-NSHDSACASA-N 383.211 5.190 30 20 GKED Cc1ncsc1/C=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 588522635 GAZVGTUMALSMRR-AFNCTOJWSA-N 385.901 5.118 30 20 GKED CCN(C(=O)CC1(C#N)CCCCC1)[C@@H](c1cccnc1)c1ccc(F)cc1F 597216866 JCKGGRLXZDSBPK-QFIPXVFZSA-N 397.469 5.162 30 20 GKED N#CC1(CC(=O)Nc2cccc(C[S@@](=O)C3CCCCC3)c2)CCCCC1 597259476 BJVIDHMEMSLOQJ-HHHXNRCGSA-N 386.561 5.071 30 20 GKED Cc1c(Br)cccc1NC(=O)c1ccccc1-c1ccccc1C#N 608871697 BVZHMRMXTCBHDT-UHFFFAOYSA-N 391.268 5.549 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=O)c1cc2ccccc2n1CC#N 609162489 LAWZFBOMCKZHAU-UHFFFAOYSA-N 383.854 5.010 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)Nc2ccccc2SCCC#N)s1 609375648 ZVGWTXZCMHFKCE-UHFFFAOYSA-N 399.566 5.367 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1C[C@H]1C[C@H]2CC[C@H]1C2 609435220 YZKUFGBKNPXVOX-LCWAXJCOSA-N 397.588 5.903 30 20 GKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1cc2ccccc2n1CC#N 609587675 ZUAZELDVCKEOJR-OAQYLSRUSA-N 379.891 5.288 30 20 GKED CSCC[C@H](C)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609870011 BWVKENWUPLWSCK-AWEZNQCLSA-N 388.920 5.218 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1noc(-c2ccc(Cl)cc2)n1 614185361 FVOKEWOTGGJZLJ-CQSZACIVSA-N 380.879 5.042 30 20 GKED C=CC[C@H]1CCN(C(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3)cc2C)C1 626504645 STMICWZDOQXTJL-INIZCTEOSA-N 397.906 5.331 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](OC)c1cccc(OC)c1 626534389 JMVPVVSWASYDSW-OAQYLSRUSA-N 382.504 5.056 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 726753729 QVXDHGAYKRKFGP-HXUWFJFHSA-N 389.524 5.277 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cn2cc(Cl)ccc2n1 727781535 PHNLJAGSNGORBZ-HJWRWDBZSA-N 379.872 5.316 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1c(F)cccc1F 729877910 DVAURKKKYPPTOQ-SECBINFHSA-N 394.290 5.502 30 20 GKED CC(C)c1ccc(C2(CNC(=O)c3ccccc3SCC#N)CCCC2)cc1 731017302 UTKDWMGWGRTZNI-UHFFFAOYSA-N 392.568 5.667 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N2CCCCC[C@@H]2c2ccco2)cc1OC 736526334 NZXBNPVMJVNNIN-NJBZPOFQSA-N 381.472 5.010 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)/C=C\c2cnc(C(C)(C)C)s2)cc1 742657606 PQPQRUYHXCEABP-YUIUBULTSA-N 381.545 5.132 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@@H](C)c1ccccc1[N+](=O)[O-] 742703874 KZXZLDMDTJBBGH-KRWDZBQOSA-N 387.439 5.527 30 20 GKED N#Cc1ccc(-c2nnc(COC(=O)c3ccc(C4CCCCC4)cc3)o2)cc1 744576605 KVZYVCRMFVTQOU-UHFFFAOYSA-N 387.439 5.013 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1NC(=O)OC(C)(C)C 747199581 XOBOEHTXQCRGRF-HNNXBMFYSA-N 399.516 5.412 30 20 GKED N#C[C@@H](C(=O)[C@H]1CC12CCCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 747477568 BVDYMLPYDXIRDH-UONOGXRCSA-N 391.323 5.873 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c(F)c(F)cc(F)c2F)cc1 748520922 KZWYIMMRRZXKOJ-OAHLLOKOSA-N 384.332 5.151 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)cc1 748585084 WORUMKNJBVGSCS-VGOFMYFVSA-N 379.456 5.108 30 20 GKED Cc1cc(C#N)ccc1COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 749154858 MJTLXHSKDKLPBL-UHFFFAOYSA-N 390.053 5.232 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cncc(-c3ccccc3)c2)cc1 757875077 NGHWSPWHKNBMAS-HXOBKFHXSA-N 397.478 5.223 30 20 GKED Sc1nnc(-c2ccccc2Cl)n1N=Cc1csc(Cl)c1Cl 761748499 GILKZJQLFHUOKZ-UHFFFAOYSA-N 389.720 5.138 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2nc(Cl)sc2C)cc1 762865367 PRGGWFHFEFEHPT-UHFFFAOYSA-N 399.859 5.030 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2cc(C)c3ccc(C)cc3n2)ccc1OC 763529422 JOFJHBBNBNPDFS-SFHVURJKSA-N 375.472 5.153 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccc(Cl)cc2)s1 772960657 VTCBKMHHKDLCCW-HNNXBMFYSA-N 382.916 5.822 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)cc2Br)c1 772985235 UQBQQNZGGHYFAX-BBRMVZONSA-N 391.284 5.120 30 20 GKED Cc1ccc(Oc2cc(-c3noc(-c4ccccc4OCC#N)n3)ccn2)cc1C 809331782 KSSNGTGTKDDDHR-UHFFFAOYSA-N 398.422 5.110 30 20 GKED Cc1cc(C(=O)N(C)[C@H](C)c2cccc(C#N)c2)ccc1NC(=O)OC(C)(C)C 819736294 HALIZXLXMSMHAL-MRXNPFEDSA-N 393.487 5.047 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 820125672 MZLWTDIGIXPWSC-UONOGXRCSA-N 398.359 5.130 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2Cl)CCC1)c1nc2ccccc2n1C(F)F 845451706 PDRSGZHFJPMYDN-ZDUSSCGKSA-N 399.828 5.383 30 20 GKED N#C[C@@H](C(=O)CSCc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 915101730 HSWSEFMVLHXDGU-KRWDZBQOSA-N 382.485 5.059 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3coc4cc(C)ccc34)n2)cc1 916650363 IJWPXDREXFXIKE-LJQANCHMSA-N 386.476 5.592 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3cccc(Cl)c3)n2)cc1 916650559 YEUSSKUKZNCYEZ-QGZVFWFLSA-N 382.872 5.027 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(COC(C)C)cc2)cc1 916954755 KCCAYJGAHPNANL-VGOFRKELSA-N 392.499 5.086 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(OCc2ccc(F)cc2)cc1 1776074255 QLNSCSVKWULHLB-UHFFFAOYSA-N 396.393 5.078 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c[nH]nc1-c1ccc(Cl)cc1 1776783971 MUSSXWOZGANNPN-SFHVURJKSA-N 377.916 5.024 30 20 GKED CCCCCCCOc1ccc(CN[C@](C)(CCc2ccccc2)C(=O)O)cc1 1776787841 BCZQVTVJBOLXFV-RUZDIDTESA-N 397.559 5.602 30 20 GKED CCc1oc2ccccc2c1/C=C\C(=O)c1ccc(OCCCC(=O)O)cc1 1776999368 LSIKAPCFCOYWCM-YPKPFQOOSA-N 378.424 5.135 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C\c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777455997 VZQVMWFAUFLERM-DMGPTTAYSA-N 398.458 5.656 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\Cc4c(Cl)cccc4C3=O)s2)c1 1777684345 UJCHXMRORZBLBP-GXDHUFHOSA-N 380.852 5.589 30 20 GKED O=C(O)C(=O)/C(=C\c1ccc(-c2ccccc2)cc1)c1ccc2ccccc2n1 6346563 YXCWNRVEEWEWKI-PGMHBOJBSA-N 379.415 5.096 30 20 GKED Cc1cc(C(=O)/C(=C(/S)Nc2c(C)cccc2C)[n+]2ccccc2)c(C)s1 11153732 MJHMPNCWBCPYAK-UHFFFAOYSA-O 395.573 5.320 30 20 GKED C[C@H](NC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)c1ccc(C#N)cc1 26129464 CXMUQHOTQDPSDB-HNNXBMFYSA-N 399.475 5.433 30 20 GKED C[C@@H](OC(=O)CCc1ccc(C#N)cc1)c1ccccc1NC(=O)c1ccccc1 51943789 KRFCAVBFOKPTGP-GOSISDBHSA-N 398.462 5.048 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@H]2CCCc3ccccc32)cc1 55823848 GQGZIFDHKSPGED-DEOSSOPVSA-N 396.490 5.390 30 20 GKED CCCOc1ccc(C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1OCCC 65839577 QAFQGUUSRMRTIE-UHFFFAOYSA-N 396.487 5.175 30 20 GKED CC(C)(C)n1cc(CNCc2cccc(C#N)c2)c(-c2ccccc2Cl)n1 66586717 FRQPCUGTPLUZPA-UHFFFAOYSA-N 378.907 5.120 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2cccc(F)c2)C1 66954356 IATHNZGPWHLGGL-WBVHZDCISA-N 383.492 5.241 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954550 AJRPDUXOWSZVQI-KRWDZBQOSA-N 392.528 5.395 30 20 GKED CCOc1cc(CNc2ccc(C#N)c(C(F)(F)F)c2)ccc1OC(F)F 78721797 FHKGRFIEGZEMQH-UHFFFAOYSA-N 386.320 5.189 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCCCC#N)c2)c(C)n1C1CCCCC1 108734567 XZXJDVCXZYPHDY-UHFFFAOYSA-N 379.504 5.545 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1 116453030 XPDOFWHONUHQMM-UHFFFAOYSA-N 398.249 5.234 30 20 GKED COc1ccc(CN[C@H](CCC#N)c2ccccc2)cc1OCc1ccccc1 130535976 VTUHMIYRDVDBOK-HSZRJFAPSA-N 386.495 5.409 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(F)c(SC)c3)n2)cc1 155681500 XXEITDXMWKLHRS-OAHLLOKOSA-N 398.484 5.170 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)o1 159983442 XXSLGYPDTHPWGU-GJYPPUQNSA-N 397.544 5.845 30 20 GKED CCO[C@@H](CCNC(=O)c1ccccc1SCc1ccc(C#N)cc1)C(C)C 173551531 QXYCYGWFYKIKGR-NRFANRHFSA-N 396.556 5.032 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)c1 175572896 YOWQCZZAIFBLFS-UHFFFAOYSA-N 390.430 5.126 30 20 GKED O=C1/C(=C/c2nccn2CC(F)(F)F)CCc2c(Cl)sc(Cl)c21 177692637 GZPKQDKSHCVADH-FNORWQNLSA-N 381.206 5.026 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 179389860 RYNCWVDDJCUGHZ-QSOAKEGCSA-N 379.872 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1 191425848 AIIINWXHOZYRSG-OAQYLSRUSA-N 398.934 5.797 30 20 GKED COc1ccc(-n2c(SCCCCC#N)nnc2-c2ccccc2Cl)cc1 195533487 KJBSVFLGCOSAEC-UHFFFAOYSA-N 398.919 5.382 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-n4cccc4)cc3)n2)cc1 197485670 IPSCSLWLRFOCFZ-FQEVSTJZSA-N 383.476 5.399 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC([C@H](O)c2ccccc2)CC1 276437891 QUFBWVVPHYBLLY-XMMPIXPASA-N 392.543 5.516 30 20 GKED Cc1ccc(-c2noc([C@H](C)SCCCC3(C#N)CCOCC3)n2)cc1F 281738801 DXTDLXZMMAKZGZ-HNNXBMFYSA-N 389.496 5.079 30 20 GKED C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 303168994 QXTPYUXQQXWNTR-GFCCVEGCSA-N 377.271 5.201 30 20 GKED Cc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 303184657 IUUWDTAMBYKLNN-SFHVURJKSA-N 394.927 5.926 30 20 GKED O/C(=N/[C@@H]1CCCc2nc(O)ccc21)C1(Cc2cccc(Cl)c2)CCCC1 329687431 FXSAPRJBXWFOQL-LJQANCHMSA-N 384.907 5.578 30 20 GKED CCc1noc(C)c1N=C(O)N1Cc2cc(OC)ccc2C[C@@H]1C1CCCCC1 329970718 XIPCAVBCQKCRHR-OAQYLSRUSA-N 397.519 5.107 30 20 GKED C[C@@H]1CN(C(O)=Nc2cccc(-c3ncc4n3CCCC4)c2)[C@H]1c1ccccc1 330265911 ZXCHBJQUUWBAIM-VGOFRKELSA-N 386.499 5.125 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 409866013 IDWBXZHDACRXKH-HUUCEWRRSA-N 375.255 5.006 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(Br)cc1C(F)(F)F 410343864 GMQUBZXOMLBVHX-UHFFFAOYSA-N 398.222 5.839 30 20 GKED N#CC1(CCCN[C@H](CCCc2ccccc2)c2ccccc2)CCOCC1 410419084 OIPHNWXUFJNJAP-XMMPIXPASA-N 376.544 5.441 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CO[C@H]1CCCc2ccccc21 430547075 DTDGDCCTFAPHJA-UZLBHIALSA-N 380.513 5.114 30 20 GKED N#CCCC[C@@H](NC(=O)NC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 431927634 ZFVAPAMHSBQSNW-RBUKOAKNSA-N 389.421 5.067 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCCC(F)(F)C1 433141943 BTCLGVAHPYREMW-HUUCEWRRSA-N 381.492 5.418 30 20 GKED CC(C)COc1cccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 433193275 PFHRYGSYGPOAPJ-FGZHOGPDSA-N 377.488 5.025 30 20 GKED C=CCn1c(SCc2ccn(C(CC)CC)n2)nnc1-c1ccc(F)cc1 433370968 BNWPAWFWPXDKTR-UHFFFAOYSA-N 385.512 5.120 30 20 GKED O=C(N[C@@H](c1cccc(F)c1F)C(F)(F)F)C1CCC(C(F)(F)F)CC1 436034305 NNMISJUKYCNXOB-RPTIHFLNSA-N 389.286 5.053 30 20 GKED FC(F)n1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)n1 436401645 QQGYGIDVNSACAS-LBPRGKRZSA-N 387.274 5.080 30 20 GKED CCO[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 437469129 GLLBHEQHBFVCOJ-JOCHJYFZSA-N 390.414 5.206 30 20 GKED C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438638113 QPZZMCLUPFACSP-KZULUSFZSA-N 391.368 5.331 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2cccc(F)c2)c2cccc(Cl)c2)CC1 441036308 QWISWQFCROFXQH-BUNACBEFSA-N 399.897 5.198 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@@H]3c3ccc(Cl)cc3)o2)c1 441407831 VDCIKFDKZPUBON-HXUWFJFHSA-N 392.890 5.379 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccccc3Cl)on2)cc1C(F)(F)F 443891713 LHEFUAFNJSAPTB-UHFFFAOYSA-N 391.736 5.138 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cc2c(cc1Br)CCC2)c1ccccc1 446421392 SRRULBUKKMGPMI-GOSISDBHSA-N 398.304 5.104 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)[C@@H](C)C2CC2)cc1 455702876 LOHNGPRKWWQFDM-HNNXBMFYSA-N 397.906 5.247 30 20 GKED COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(CC#N)cc1Cl 455725899 DNIDKIBAHDAPAG-FOIQADDNSA-N 397.906 5.420 30 20 GKED CCN(CC(C)(C)C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 463486383 ZSTHSZKQDLYUMN-UHFFFAOYSA-N 379.504 5.232 30 20 GKED C=CCN(C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C)C1CC1 467293460 KGWYUFVLZVPZOS-UHFFFAOYSA-N 383.879 5.083 30 20 GKED CSc1cccc(C)c1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 472223243 NUIHFRCHWZAYLI-UHFFFAOYSA-N 388.492 5.420 30 20 GKED CC(C)c1ncc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cn1 478671512 VBAGWIPDTQOIJW-UHFFFAOYSA-N 388.496 5.016 30 20 GKED C=C(C)[C@H](NCc1ccc(OC(F)F)c(OCC)c1)c1ccc(F)c(F)c1 479405481 DNLQFRLIVBPNGD-IBGZPJMESA-N 383.385 5.372 30 20 GKED Cc1csc(Sc2ccc(NC(=O)CSc3ccc(C#N)cc3)cc2)n1 482927874 COAHRCGDGIMDSB-UHFFFAOYSA-N 397.550 5.205 30 20 GKED Cc1ccc2c(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)csc2c1 483529778 GKXQJZUGXMWDFF-HNNXBMFYSA-N 375.478 5.218 30 20 GKED O=[S@](Cc1ccc(C(F)F)cc1)Cc1cc(F)c(C(F)(F)F)cc1F 488829818 NRIJLDJJWZYNPZ-RUZDIDTESA-N 384.316 5.370 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 497113864 JQCHSLZWCFTQSR-UHFFFAOYSA-N 397.837 5.698 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)[C@H](C)c1ccccc1C(F)(F)F 499238395 ZOIASJUHCVUDBX-UONOGXRCSA-N 375.394 5.085 30 20 GKED Fc1ccc(NCc2cnc(C(F)(F)F)s2)c(OCCC(F)(F)F)c1 500544224 HMNINSSFRDDGIG-UHFFFAOYSA-N 388.308 5.244 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccc(C#N)cc1 505364463 QJSWYDZSJLZSEG-VBKZILBWSA-N 395.915 5.423 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccco1)Cc1cccs1 507789198 SBTRDEWPUOISBS-UHFFFAOYSA-N 395.484 5.234 30 20 GKED C=C(C)CCc1noc(-c2sc(NC(=O)c3ccccc3Cl)cc2C)n1 508633981 UULODJHOFKVAGO-UHFFFAOYSA-N 387.892 5.521 30 20 GKED COc1ccc([C@H](NC(=O)NCC(C)(C)CCC#N)c2ccccc2Cl)cc1 513135624 MCMOHEPLRNLEST-FQEVSTJZSA-N 399.922 5.067 30 20 GKED CN(C(=O)c1ccc(C#N)cc1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 513427148 PKGGIRZNARUEKX-UHFFFAOYSA-N 397.356 5.041 30 20 GKED Cc1cc(F)ccc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 513952460 ZKMZVDMQFDKBPQ-UHFFFAOYSA-N 391.421 5.379 30 20 GKED C=CCOc1ccc(CNCc2ccnc(OCc3ccccc3)c2)cc1Cl 518265936 JJTNVBPCRWTNKO-UHFFFAOYSA-N 394.902 5.169 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCOc1ccc(F)c(Cl)c1 520826144 BIUJECRBDVVJGC-CYBMUJFWSA-N 392.883 5.138 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cccc2ccccc12 520856770 QIOHAXICMMCYRQ-QGZVFWFLSA-N 389.524 5.755 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(C)c1OC(F)F 520924119 JNDBIUKPEQHCCY-AWEZNQCLSA-N 390.455 5.551 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)cc1Cl 522072289 FQUYLCCMPFZFFB-UHFFFAOYSA-N 396.853 5.244 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2cc(F)ccc2F)c2ccccc2)cc1 522579870 OJCXVFNOSPZSJK-UHFFFAOYSA-N 394.446 5.162 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccc([N+](=O)[O-])cc1Cl 522748595 PCLLVPFEGGFQPJ-UHFFFAOYSA-N 397.843 5.030 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C#N)C2CCCCC2)nnc1-c1ccncc1 524534467 VRYSUIANAUGYND-FQEVSTJZSA-N 389.528 5.202 30 20 GKED COc1ccc2sc(C(=O)Nc3sc4c(c3C#N)CCCC4)c(C)c2c1 525116059 JNGPVWSFGSGUCB-UHFFFAOYSA-N 382.510 5.283 30 20 GKED COc1ccccc1-c1ccc(CNC2(c3ccc(C#N)cc3)CCOCC2)cc1 527810904 KISIZNVFSZBWQK-UHFFFAOYSA-N 398.506 5.029 30 20 GKED C=CCC[C@@H](NCc1cnn(CC(F)(F)F)c1)c1ccc(C(F)(F)F)cc1 532725536 AOUAWXJAESBXAX-MRXNPFEDSA-N 391.359 5.261 30 20 GKED CCOc1c(Cl)cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1OC 536972782 PVHKGLYVATUJGK-UHFFFAOYSA-N 392.908 5.230 30 20 GKED CSc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1C 538240175 OXAVGAHSXALFTN-UHFFFAOYSA-N 378.453 5.013 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(SCC(F)F)cc1 540727703 WWPITENMGLQTSQ-OAHLLOKOSA-N 376.472 5.899 30 20 GKED CSc1ccccc1NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 541075969 SKOYQWIVIRSPDI-LLVKDONJSA-N 396.459 5.418 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 542149305 DNOICPGRHZNWNA-ABIUDSBCSA-N 399.350 5.694 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)C2CC2)cc1 543299176 FVZSWXLYYWUNAB-IBGZPJMESA-N 397.931 5.123 30 20 GKED Cc1cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)sc1Br 551211488 ITVZKRXXIRMEIE-ZBFHGGJFSA-N 377.351 5.905 30 20 GKED N#CCCN(C(=O)CCCOc1ccc(Cl)cc1Cl)c1ccc(F)cc1 551935564 VPMHVJBUOQCTQV-UHFFFAOYSA-N 395.261 5.238 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc(C#N)cc1 553320155 ROLKBIINVISQHL-MRXNPFEDSA-N 382.423 5.105 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(-c3cccs3)o2)n1 553799709 MUPDMBJNWNCAGZ-UHFFFAOYSA-N 381.404 5.289 30 20 GKED CC(=O)c1cc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)ccc1F 557085140 RGFZBDWBFFLKOW-UHFFFAOYSA-N 388.398 5.253 30 20 GKED COCC[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)c(Cl)c1 562100624 UIBQEIWISBIOCY-WOJBJXKFSA-N 375.299 5.220 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N1CCC(C#N)(c2ccccn2)CC1 569827443 SOTJHCDFBGHIRD-UHFFFAOYSA-N 396.494 5.146 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 571844222 GGYDBYITYLXLOZ-OAHLLOKOSA-N 390.418 5.110 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 577895389 HHZNCMPOYFHWKB-XCLFUZPHSA-N 398.293 5.101 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)CC2 583663678 QKIOEYNDZPHBTQ-VQTJNVASSA-N 385.280 5.188 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)c(Cl)c1 590531327 RZFMMNDYFPEALA-HAQNSBGRSA-N 379.674 5.194 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 592974699 XJXYKGNRMGTTEM-IBGZPJMESA-N 397.434 5.464 30 20 GKED C=C1CCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccc(F)cc23)CC1 594848147 VFWXYPBSTAKIMZ-UHFFFAOYSA-N 380.438 5.224 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC[C@@H](C)O1 596692137 XBVDCJDJMRKYEL-GUXCAODWSA-N 397.906 5.027 30 20 GKED N#Cc1c(NC(=O)c2cscc2C(F)(F)F)sc2c1CCCCCC2 598810019 ZECZIZCOQLSVID-UHFFFAOYSA-N 384.448 5.611 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)c1oc2c(ccc3ccccc32)c1C 603521139 YWIZSBNDQVCOIS-UHFFFAOYSA-N 398.462 5.055 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 603946429 FDVVWSCNLZTNLJ-UHFFFAOYSA-N 398.285 5.005 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)o2)cc1 608552961 DKNLDIAMOBHITI-INIZCTEOSA-N 390.439 5.748 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCOc1ccc2ccccc2c1 609377469 VXWOWMIJWLSCNQ-KRWDZBQOSA-N 390.508 5.499 30 20 GKED CCC[C@H](NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 609387654 AYLOPPACDRZNLO-BJLQDIEVSA-N 395.572 5.396 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)CC(C)(C)c1ccccc1 609398023 BMZANMDBPKZWMH-ROUUACIJSA-N 395.572 5.816 30 20 GKED CCCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](C)c1ccc(C)o1 609401952 MLUVXMUQOPXCSQ-WMZOPIPTSA-N 399.560 6.235 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 609433735 FQNFGWWXGZJMFY-GOSISDBHSA-N 385.467 5.884 30 20 GKED N#Cc1ccccc1NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 612932979 QBKLQNQXTZLGDZ-UHFFFAOYSA-N 382.341 5.622 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1cccc(COC2CCCCC2)c1 618751417 PFYQACJRGXXMDR-QHCPKHFHSA-N 389.499 5.217 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc3ccc(Cl)cc3n2)c(Cl)c1 619729558 QOXCWWPJTNMNMW-UHFFFAOYSA-N 376.630 5.319 30 20 GKED N#C[C@@H](C(=O)c1cccc2c1CCC2)c1nc(-c2c(F)cccc2F)cs1 620304552 MHFAAZQUBTZZIB-HNNXBMFYSA-N 380.419 5.067 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1ccc2ccccc2n1 674407764 FIWNXHCYZUBVOR-IBGZPJMESA-N 397.865 5.804 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(OCC(F)(F)F)cc2)c1 726744237 YBPCWAYMXXPDQJ-IZZDOVSWSA-N 389.373 5.206 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(\CCCC(=O)O)c2nc3ccccc3s2)cc1 728699694 IMSFRCOMTDPZDN-OVGFGYAMSA-N 392.480 5.383 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(\CCCC(=O)O)c2nc3ccccc3s2)cc1 728699697 IMSFRCOMTDPZDN-XOAFGZPJSA-N 392.480 5.383 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)cnn1-c1cccc(Cl)c1 731565562 UEGPGVMDLMGGHH-QIENPNARSA-N 391.858 5.021 30 20 GKED N#CCOc1ccc(COC(=O)c2ccc(CSc3ccccc3)cc2)cc1 733380339 MGVWDUJZZZKEPK-UHFFFAOYSA-N 389.476 5.238 30 20 GKED C=CC[C@@H](NC(=O)NCC1(c2cccc(F)c2)CCCCC1)c1ccncc1 734662561 ABPGZYCBJNVCCP-OAQYLSRUSA-N 381.495 5.039 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C(C)C)c1ccncc1 734683668 ODQLDDOUAXKKFP-LJQANCHMSA-N 392.330 5.626 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 734965986 RXLBXHNEGLOREB-HOCLYGCPSA-N 396.462 5.767 30 20 GKED Cc1cc(N=Cc2cc(Cl)cc(Cl)c2O)ccc1OC1CCOCC1 737443659 KHLXTXJJRJHATR-UHFFFAOYSA-N 380.271 5.316 30 20 GKED CC(C)(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1F 739594867 SGGLOPCWQLKCQT-UHFFFAOYSA-N 378.472 5.020 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)/C=C\c3ccccc3C#N)cc2c1 739751086 LKXQCOLGAVQCHU-LUAWRHEFSA-N 396.446 5.448 30 20 GKED CC(C)C[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 741111283 JIIJDLSLENRWKO-SJORKVTESA-N 382.916 5.956 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3ccc(Oc4cnccn4)cc3)oc12 743056475 HQJIJJZTNKWARU-DHZHZOJOSA-N 386.407 5.310 30 20 GKED N#C[C@H](C(=O)Cc1cc(F)ccc1F)c1nc2cc(C(F)(F)F)ccc2s1 744038125 MUXYTCJQCDJTTI-GFCCVEGCSA-N 396.340 5.012 30 20 GKED N#C[C@@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2o1 744038864 AZTRGQOGOIIHPH-RTWAWAEBSA-N 380.447 5.421 30 20 GKED COc1ccc(-c2nc(S[C@H](C)c3cccc(Cl)c3)nc(O)c2C#N)cc1 750003118 UVYUDTTXIJPBIZ-GFCCVEGCSA-N 397.887 5.236 30 20 GKED C=CCNC(=O)c1ccc(NC(=S)Nc2ccccc2-c2ccccc2)cc1 751000274 DKSDZTAURGCLIA-UHFFFAOYSA-N 387.508 5.078 30 20 GKED CCCCCCC[S@@](=O)[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 764453150 OURXPBRMZNCWOR-WHDAMIPWSA-N 388.455 5.536 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc4cccnc34)n2)cc1 772637923 BBTJOBXHVVTTQR-IBGZPJMESA-N 383.476 5.086 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)c(C)n1-c1cccc(Cl)c1 781034868 RLUQTQLKYBPUEM-OAHLLOKOSA-N 393.874 5.291 30 20 GKED Cc1ccc(NC(=O)c2cc3ccccc3cc2OC(=O)CC(C)(C)C#N)cc1 786496024 GFNIAASLUGAIHN-UHFFFAOYSA-N 386.451 5.246 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCC[C@](C)(O)CC2)c1 791810600 LARNVDJVBYLXQK-QHCPKHFHSA-N 390.568 5.333 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3cc4cccc(OC)c4o3)cs2)cc1 797152719 UJYLBASCXNGWAI-DHZHZOJOSA-N 391.448 5.470 30 20 GKED C=C[C@H](CC(=O)O[C@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 798206941 CTFDINMBLGOEPH-FZKQIMNGSA-N 375.346 5.334 30 20 GKED CC(C)(O)c1cccc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 806264806 HIHAMFDZLWKXIA-UHFFFAOYSA-N 387.439 5.222 30 20 GKED C#C[C@H](NC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C)c1ccc(Cl)cc1 811961933 HPFTUTDIUNKPKB-PBHICJAKSA-N 389.952 5.305 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CN[C@@H](CCCC#N)c2ccccc2)c1 814661372 YDNMJOXMTCDSBE-NRFANRHFSA-N 379.504 5.558 30 20 GKED C=C(C)C(C)(C)C(=O)N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1 819562134 GTEVVDLRHHKWBN-UHFFFAOYSA-N 386.536 5.342 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433789 SEEBIWXMNOBBON-KSSFIOAISA-N 375.394 5.052 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cccc(C(C)(C)C)c1 847624785 WXQWBWBMUDDOKO-HXUWFJFHSA-N 376.500 5.070 30 20 GKED Fc1ccc(-c2nnc(S)n2N=Cc2ccc(-c3ccccc3F)s2)cc1 912808611 DPBWSXYBRJVVJW-UHFFFAOYSA-N 398.463 5.123 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1cc(-c2ccccc2)nc2ccccc12 914449862 MJNHMTPNGCFCFK-UHFFFAOYSA-N 377.447 5.046 30 20 GKED CCN(C(=O)/C=C\c1ccc2cc(OC)ccc2c1)[C@H](C)c1ccc(C#N)cc1 914509471 MRIHJNQXXDNLDT-DVNIYVAHSA-N 384.479 5.343 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(SC)ccc2C)cc1 916955475 RBGLIIBEWYBAEI-VLIAUNLRSA-N 380.513 5.192 30 20 GKED CC(=NNc1c(Cl)cccc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776048939 NKDTVUADJQFMSQ-UHFFFAOYSA-N 389.238 5.788 30 20 GKED CC(Cc1ccc(Cl)c(C(F)(F)F)c1)=NNc1cccc(C(=O)O)c1C 1776088959 UBMUNNWACRQBGM-UHFFFAOYSA-N 384.785 5.396 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(Oc2ccccc2)cc1 1776126833 YTZMNUZPFCHTJH-NTCAYCPXSA-N 388.419 5.229 30 20 GKED C=C(Br)CN(Cc1ccc(Cl)cc1)[C@@H](C)c1ccc(C(=O)O)o1 1776137020 NDAFAFMFWQGFFJ-LBPRGKRZSA-N 398.684 5.103 30 20 GKED C=CCOc1ccc(CNc2ccc(-n3cccc3C(=O)O)c(C)c2)cc1Cl 1776184614 VXWXSMLDSLWIHE-UHFFFAOYSA-N 396.874 5.314 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)s1 1777462956 SZDMKTBITAQWGH-KTKRTIGZSA-N 383.856 5.366 30 20 GKED O/C(=N\c1nnc(C(F)(F)F)s1)c1sc2cc(Cl)ccc2c1Cl 29283539 OIXRSSIOMJWQLF-UHFFFAOYSA-N 398.218 5.715 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1oc2ccccc2c1COc1ccccc1 32614777 ZVISXGKQRHYUOZ-UHFFFAOYSA-N 396.446 5.156 30 20 GKED N#C[C@@H](C(=O)Cc1c[nH]c2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 41515002 KMKAVHPJYGFJGD-KRWDZBQOSA-N 391.883 5.364 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@@H](C)C(=O)Nc1ccccc1-c1ccccc1 63640952 QKMNUNNLCAFLBU-SFHVURJKSA-N 399.494 5.452 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(-c3nc4ccccc4s3)o2)c1 65749361 FZLDPHALDMQJGT-UHFFFAOYSA-N 376.437 5.373 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 66802116 FFWBJTQQVCIKDV-INIZCTEOSA-N 377.513 5.524 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)cc1OC 72028898 AYPYKYFNXMDQFT-UHFFFAOYSA-N 390.439 5.008 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)cc1 108815941 AQYAUKALMQAJDM-UHFFFAOYSA-N 399.947 5.074 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Oc2ccncc2)c1 112212065 SKIRIEWKPOTNQR-UHFFFAOYSA-N 386.455 5.190 30 20 GKED CCOc1ccccc1-c1nnc(SCc2ccccc2C(C)(C)C#N)o1 151032886 XGWXQPNCDZFFFQ-UHFFFAOYSA-N 379.485 5.229 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)c1occc1COc1cccc(C#N)c1 155922210 ASUMMDFOZDCAOD-UHFFFAOYSA-N 390.439 5.120 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)c1nc2cc(Cl)ccc2s1 161404954 JRBRFGZBKUAWIU-JTQLQIEISA-N 396.686 5.502 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](C)Sc2ccnc3cc(Cl)ccc23)n1 175081240 BHHDQKCAMLMWNJ-BXUZGUMPSA-N 387.917 5.010 30 20 GKED CCOc1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)c(C(F)(F)F)c1 175693717 OQBWOTGTRNMHNC-UHFFFAOYSA-N 395.274 5.514 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C[C@H]1CCOC1)c1ccccc1 191433389 XYMFCQCAHFHRRE-XXBNENTESA-N 392.543 5.828 30 20 GKED N#CCCCOc1cccc(CN[C@H]2CCCc3cc(OC(F)F)ccc32)c1 237904409 NEKAWWKZTGBCDA-NRFANRHFSA-N 386.442 5.138 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ccnc3ccc(Cl)cc23)ccc1OC 301252132 DMMJRPMVCSMRKC-INIZCTEOSA-N 381.863 5.190 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)[nH]n1 303410931 USMLFKDIGWFMGK-ZDUSSCGKSA-N 396.903 5.234 30 20 GKED CC(=O)N1CC[C@@H](/N=C(/O)c2oc3c(C)ccc(C)c3c2C)c2ccccc21 328850189 ZAMMZMXCEIGYHF-GOSISDBHSA-N 376.456 5.161 30 20 GKED O/C(Cc1c[nH]c2ccc(Cl)cc12)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329486592 GHUSJBAIGGZOAS-FQEVSTJZSA-N 396.922 5.710 30 20 GKED C=CCC1(C(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)CCOCC1 424825338 KHRSHDIVIGMPIY-UHFFFAOYSA-N 382.331 5.072 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)cc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430638877 GKMMFKJGFJYUIB-OAHLLOKOSA-N 398.919 5.078 30 20 GKED CCCCCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(C)C 437889474 BOXUDGKYSWIDQP-UHFFFAOYSA-N 393.531 5.764 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(F)cc(Br)cc1F 438628486 COSQESLSFVUCQF-UHFFFAOYSA-N 399.210 5.087 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1ccc(Cl)cc1F 441393473 MCIJWSKVORZGAU-UHFFFAOYSA-N 398.821 5.189 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 441533548 IGDPMQVGJIPCEN-DNVCBOLYSA-N 391.437 5.510 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1csc(CCc2ccccc2)n1 444397508 BCWMTJXNJQXWGH-KRWDZBQOSA-N 393.581 5.792 30 20 GKED COCC[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 453331609 BXVPXILWRONWSF-ORAYPTAESA-N 380.385 5.145 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)c1cc(C(F)(F)F)on1 455248658 PJBAKKYQVHAHHO-UHFFFAOYSA-N 395.425 5.602 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1C 458793841 ABUGJRGWCFVPSB-DHIUTWEWSA-N 375.516 5.585 30 20 GKED CC#CCCCC(=O)N(C)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 466432913 BLBIJUNMRNJBFI-UHFFFAOYSA-N 376.378 5.049 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469273534 VUJFDVPDEIGGPP-GOTSBHOMSA-N 387.527 5.326 30 20 GKED C[C@@H](c1ccccc1Br)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1 474693307 IBAPNKVKMCEDOR-AWEZNQCLSA-N 385.305 5.083 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)C[C@H](CC#N)c3ccccc3)cc2)cs1 474701860 OMIIUBFKDDPOKY-KKSFZXQISA-N 389.524 5.383 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCCCC)c(OC)c1 476076455 AUYPGUZKGBNLAG-UHFFFAOYSA-N 381.516 5.978 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)ccc1OC(F)F 476172760 ZKOMIAOEPRHYAG-UHFFFAOYSA-N 379.834 6.046 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 476529820 GCRPFMCZHQRXRI-AEFFLSMTSA-N 378.369 5.023 30 20 GKED Cc1cc2sc(NC(=O)c3cn(CCCC#N)c4ccccc34)nc2cc1F 478075166 FUKFQUZMMPGEOP-UHFFFAOYSA-N 392.459 5.255 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(CC(F)F)c3ccccc3)cc2)cc1 485237014 HEGGZKLHEHQJLJ-UHFFFAOYSA-N 392.405 5.457 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487575137 OLOZUXBHIVUDDL-JXFKEZNVSA-N 388.433 5.435 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(Sc2ncccn2)cc1C)c1ccccc1 488718674 YCQRXAWWZBDKSI-FQEVSTJZSA-N 389.524 5.625 30 20 GKED Cc1c(C(=O)Nc2cnn(CC(C)C)c2C(C)C)sc2ccc(C#N)cc12 495132330 ULNMKTMTJCGXAQ-UHFFFAOYSA-N 380.517 5.310 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 495440734 WHXBPSBDGIJFOX-KRWDZBQOSA-N 390.270 5.243 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1ccccc1Cl 499325093 SGFVSWWGUSTNNM-UHFFFAOYSA-N 392.911 5.335 30 20 GKED O=C(Cc1cccc(C(F)(F)F)c1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 509277217 SWFNSHRSROGUPB-OAHLLOKOSA-N 393.302 5.197 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1ccc(SCC)cc1 509532793 MUFSNYJJPANMTN-QGZVFWFLSA-N 384.545 5.266 30 20 GKED CCN(Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)C[C@@H](C)C#N 509820273 PNRUHXZNCAOZBB-AWEZNQCLSA-N 390.314 5.227 30 20 GKED Cc1cc([C@H](C)Nc2cccc(OCCCC#N)c2)sc1Br 512136062 PNLUZPJAWRWCKL-ZDUSSCGKSA-N 379.323 5.675 30 20 GKED C=CCOc1cccc(N[C@H](C(=O)Nc2cccc(OC)c2)c2ccccc2)c1 513187902 JKCNBOKRTPIXLX-QHCPKHFHSA-N 388.467 5.052 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n[nH]1 516399167 BWZJTEWCMUXQNM-UHFFFAOYSA-N 380.835 5.103 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cn(C)nc1C1CCCCC1 517012752 YKBJGNXSVMUZKX-HNNXBMFYSA-N 397.548 5.506 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520941499 PQGUROOEEYWGNL-HNNXBMFYSA-N 389.480 5.563 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3nc4ccccc4s3)cc2)c1 521793066 OYGMUPMZLRFJSG-UHFFFAOYSA-N 399.475 5.532 30 20 GKED C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccc(C#N)cc1 537295339 UWENHFJGHCHIJI-ZDUSSCGKSA-N 381.819 5.231 30 20 GKED CCCN(C(=O)c1sccc1C#N)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 538556893 HQNIVEZAYZOIBH-HXUWFJFHSA-N 393.487 5.104 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C2(C#N)CC2)cc1 539635147 UJTTYFPOXQZNCT-UHFFFAOYSA-N 386.417 5.311 30 20 GKED N#CC1(c2ccc(C(=O)N(CCc3cccc(F)c3)C3CCCC3)cc2)CC1 539660760 OUNKKDKYHNDUKU-UHFFFAOYSA-N 376.475 5.008 30 20 GKED C[C@@H](NC(=O)Nc1cccc2cc[nH]c12)c1ccc(-c2cccc(C#N)c2)cc1 547850118 JPUVEBIYGMULLB-MRXNPFEDSA-N 380.451 5.589 30 20 GKED C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@H](CCCC#N)c1ccccc1 551204193 AUJQHGYQYPIXGP-PGRDOPGGSA-N 397.950 5.102 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccccc1CCC(F)(F)F 561241507 VUKYPVODPRRMFI-UHFFFAOYSA-N 393.453 5.177 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)Nc3sccc3C#N)c2)c1 562214614 SHZBZUCINDZTDA-UHFFFAOYSA-N 378.522 5.781 30 20 GKED C[C@H](NC(=O)C1(c2cc(F)cc(C#N)c2)CC1)C(c1ccccc1)c1ccccc1 583956497 KXQYIWUUFCODPK-SFHVURJKSA-N 398.481 5.066 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H]1OCc2cc(Cl)ccc21 593976756 XZWSFEKXESHHLE-SCLBCKFNSA-N 386.904 5.334 30 20 GKED N#CC[C@@H]1CCCN(C(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 597918493 PRBTVSVPMULIFQ-JTSKRJEESA-N 398.959 5.315 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692845 OXFBCKIPOWSUCM-CQSZACIVSA-N 378.457 5.032 30 20 GKED CN(C(=O)c1ccc(NCc2ccc(C#N)cc2)cc1Cl)C1CCCCC1 604009749 VEPWJDILTVGQTO-UHFFFAOYSA-N 381.907 5.228 30 20 GKED CCCOc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c(C)c1 604023719 RTLLPSYXDZUJBX-UHFFFAOYSA-N 390.439 5.080 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3F)o2)nnc1-c1ccccc1 607756397 JMFXJYDYDZDXDQ-UHFFFAOYSA-N 392.459 5.218 30 20 GKED N#Cc1cc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)ccc1F 609426563 FUSQAJYLTXPPKS-UHFFFAOYSA-N 383.382 5.272 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@H]3CCCC[C@@H]3c3ccccc3)cc2)nc1 609502194 SSXFLBRDZOZRCP-PKTZIBPZSA-N 397.478 5.202 30 20 GKED Cc1ccc2c(Cl)c(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)sc2c1 609589497 OJFWWUIXVYRTIJ-CQSZACIVSA-N 375.280 5.511 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)c2ccc(C#N)nc2)c2cccs2)cc1 609641395 XDCMQCIVHAWQFX-VFNWGFHPSA-N 375.497 5.048 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609988231 BZSQSOCCLBPJJS-SJCJKPOMSA-N 380.797 5.233 30 20 GKED N#C[C@H](NC(=O)CC/C=C/c1ccccc1)c1ccc(OCc2ccccc2)cc1 609988394 ZNWTZPDBFVAEAV-JEVDYFGZSA-N 396.490 5.440 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1c(C)noc1C(F)F 610431513 WIPQVVZVZLGZIM-UHFFFAOYSA-N 399.372 5.087 30 20 GKED Cc1cncc(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 610753853 XSCKANNCXVHUEK-LJQANCHMSA-N 375.859 5.260 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccccc3CC)n2)CCCC1 661848605 GXJMKGPOMUXIIK-UHFFFAOYSA-N 383.561 5.369 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](OC)c1ccccc1Cl 682776908 AIWJFAFASWYBOD-FQEVSTJZSA-N 386.923 5.701 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 727267157 OJOOGBSQLBMBBZ-JYKYSHPRSA-N 398.764 5.107 30 20 GKED C=C(C)COc1cccc(NC(=O)c2c(C)nn(Cc3ccccc3)c2Cl)c1 727330866 XBWROWPDYJSPNY-UHFFFAOYSA-N 395.890 5.100 30 20 GKED C#Cc1cccc(N(C)C(=O)c2c(-c3c(Cl)cccc3Cl)noc2C)c1 728482394 KKXYWEINGZBBQK-UHFFFAOYSA-N 385.250 5.215 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 729091210 YQQBJSSLQLZOJI-ZBFHGGJFSA-N 396.462 5.848 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1cccc(OCC#N)c1 730150886 YOJWNLFBYDAXDK-KTKRTIGZSA-N 378.428 5.056 30 20 GKED Cc1ccc(C(C)C)c(OCc2nnc(S)n2N=C/C=C\c2ccccc2)c1 730550862 MHJUERVKMALWIE-UOYFCZAXSA-N 392.528 5.125 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731536672 JNPIXPPKTLKKGL-SBUREZEXSA-N 385.467 5.273 30 20 GKED C=CC1CCN(C(=O)c2cc3ccccc3cc2NC(=O)OC(C)(C)C)CC1 732133828 OOWVICOMEFBJPJ-UHFFFAOYSA-N 380.488 5.225 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1cccc(F)c1 732496546 YNSUYDPNZSSKEO-XZGNNNQISA-N 376.456 5.537 30 20 GKED CC[C@H](C#N)Oc1cc(C/N=C\c2cc(Cl)cc(Cl)c2O)ccc1OC 733205009 HCWOCKOUHPSLBV-FCBDRWCKSA-N 393.270 5.008 30 20 GKED COC(=O)[C@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(Cl)c1 735508145 VNUJPTDXWJURHG-FCHUYYIVSA-N 390.870 5.322 30 20 GKED CCCCSCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 740530729 ADXXVJOTCLQDDS-GFCCVEGCSA-N 386.464 5.415 30 20 GKED COc1ccc2cc(/C=C/C(=O)c3cnn(-c4ccc(C#N)cc4)c3C)ccc2c1 741843526 HFVPALACJHDBMY-WUXMJOGZSA-N 393.446 5.110 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2cccc(C#Cc3cccs3)c2)c1 742983549 XOIYBOGYVYONDJ-UHFFFAOYSA-N 398.940 5.619 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccccc1Nc1ccc(SC(F)F)cc1 751338188 RJHYEGYHQBZWMR-CQSZACIVSA-N 389.471 5.367 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc([C@@H](C)CC)cc1 756232957 IHTFTOHLOXHUKT-HRAATJIYSA-N 376.500 5.286 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(Br)cc2)c1 760480461 ZWKGTVJBDURKTI-AZUAARDMSA-N 387.321 5.371 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)CCCc2ccc3ccccc3c2)c1 775743980 IEDYNYSLVVJKID-QHCPKHFHSA-N 386.495 5.160 30 20 GKED N#CC1(c2ccc(COC(=O)COC(c3ccccc3)c3ccccc3)cc2)CC1 777144319 SWPFRSACAGTULU-UHFFFAOYSA-N 397.474 5.091 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2F)CCC1)c1nc2cc(F)ccc2s1 777317745 INVOALQRLCNHDC-CYBMUJFWSA-N 386.398 5.012 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCc1ccc(Oc2ccccc2)cc1 780668729 FRFQCFHVJLSDJU-QGZVFWFLSA-N 387.439 5.091 30 20 GKED N#CCC1CCN(C(=O)c2sc3cc(Br)ccc3c2Cl)CC1 782053234 LATGYQZABGNONG-UHFFFAOYSA-N 397.725 5.083 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(OCC#N)cc1 782779428 YNFFETGXRUFAMI-MOPGFXCFSA-N 381.479 5.539 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2sc3cc(Br)ccc3c2Cl)C1 784749950 ZIRNWDIWTYCGRH-INIZCTEOSA-N 397.725 5.083 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCc2[nH]c3ccc(Cl)cc3c21 790603018 IOLBZZAISZJVMP-LCYFTJDESA-N 391.883 5.552 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1O[C@H](C)C#N 790927235 RUHLJLWFSKKBCY-ZBFHGGJFSA-N 390.405 5.204 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)[C@@H](F)CC1CCCCC1 793021441 OQYOUZHOXXDJRZ-BZPMIXESSA-N 391.371 5.321 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Nc2ccc(-c3ccncc3)c(C)c2)cc1 793909944 QLKXWVJGWNGWHW-HXUWFJFHSA-N 398.510 5.113 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(SC(C)(C)C)cc1 806250367 WOYNDLXEWQMRID-UHFFFAOYSA-N 388.533 5.273 30 20 GKED C[C@H](CC(=O)OCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1)C(F)(F)F 860326577 ZAPDKJJQIHXNLB-MRVPVSSYSA-N 399.262 5.131 30 20 GKED N#Cc1ccc(Br)c(CNc2cccc(CCC(F)(F)F)c2)c1 864018629 ZPXNITSXZJQFCP-UHFFFAOYSA-N 383.211 5.428 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(CN3CCCC3)cc2)cc1 915180769 RQRUBYYLSJZOHE-RUZDIDTESA-N 395.506 5.190 30 20 GKED N#C[C@@H](C(=O)CSCc1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 917043337 HRBJVSIFYAUCRH-AWEZNQCLSA-N 390.892 5.198 30 20 GKED COc1cc(F)cc(NN=C(C)c2ccc(Oc3ccc(C(=O)O)cc3)cc2)c1 1776048295 IRSQOSUYHUUYKA-UHFFFAOYSA-N 394.402 5.161 30 20 GKED Cc1c(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)cccc1C(=O)O 1776088155 UEQAEKJJFXOMSS-AWEZNQCLSA-N 376.378 5.448 30 20 GKED CCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776112672 GCRGXXVNAGGGOW-OWBHPGMISA-N 376.477 5.962 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2ccc(OCCC(=O)O)cc2)cc1 1776125690 QDVRDXLRAPFTJO-VGOFMYFVSA-N 382.456 5.005 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cccc(CC(=O)O)c2)cc1 1776125902 WAVJZHUTXJURCK-JVVYVMHDSA-N 394.511 5.805 30 20 GKED C=CCc1ccccc1/C=C/c1cc(C(=O)O)c2cc(Br)ccc2n1 1776189070 GQXPYTSIFSQOON-CSKARUKUSA-N 394.268 5.594 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2ccccc21 1776308645 JCXFNMWTKBYMQN-WVWKGNOCSA-N 388.488 6.133 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(F)cc1C(F)(F)F 1776354707 XAKRKOHXOFRMTG-DAXSKMNVSA-N 396.336 5.226 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1nc2c(s1)CC(C)(C)CC2 1776355182 QKSXUOWOQZBPCC-VURMDHGXSA-N 399.512 5.040 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1776665796 CYHBJLKVZLKOAE-VOCHNXLRSA-N 398.458 5.350 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)o1 1777424517 DRYKIHHMSMWRQG-RAXLEYEMSA-N 380.371 5.206 30 20 GKED Cc1ccc(C)c(N/C(S)=C(/C(=O)c2ccc(Cl)cc2)[n+]2ccccc2)c1 20834565 JJFIMYXCRJEQSE-UHFFFAOYSA-O 395.935 5.295 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccco3)n2-c2ccccc2)cc1 24722516 AALWZXKSGDFWKJ-IBGZPJMESA-N 386.480 5.063 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)C(=O)c1ccc(C)c(C)c1 32788515 SJVOETFXIOWARR-GOSISDBHSA-N 391.540 5.035 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 41553090 GYSUFQSTIAJNII-LJQANCHMSA-N 391.352 5.129 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(C)c(C)c2)cs1 54895849 OCCBVOPSGVRLCO-FMIVXFBMSA-N 390.508 5.649 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(N[C@H](C)C(=O)Nc3cccc(C#N)c3)c2)C1 63311809 NLXVOILEHJFCKD-PNCHPQGNSA-N 391.515 5.093 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccnc2ccccc12 68054214 SXMMBIQQOIFAFL-HNNXBMFYSA-N 393.537 5.360 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)NCc2ccc(OCC#N)cc2)c(C)c1 69662948 VPIOFZKEAKHBDN-MRXNPFEDSA-N 383.517 5.110 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 108240526 RYVSTGODDYKORG-SJORKVTESA-N 382.529 5.154 30 20 GKED C=C[C@@H](CC(=O)N1CCCC[C@H]1c1nc(-c2ccccc2)no1)c1ccccc1 126755919 SIZKHDDQBCBDQG-RXVVDRJESA-N 387.483 5.150 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cnc(-c4ccncc4)s3)c2)cc1 172833446 WXFUXSADMLQEJB-UHFFFAOYSA-N 398.447 5.121 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccc(F)cc2)cc1 181621808 AQSRCMUNGXRZMZ-OSPHWJPCSA-N 390.458 5.177 30 20 GKED N#C[C@@H](C(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)c1ccccn1 182866563 IXDIXINWTZVRQP-MRXNPFEDSA-N 395.245 5.109 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)NC(=O)CCS2 188067839 KQQLMUIUUVHEHH-UHFFFAOYSA-N 380.513 5.225 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)c(COCCOC)c1 189871447 MUYVIUXQLUBLBN-UHFFFAOYSA-N 385.479 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1ccc([S@](C)=O)cc1 191477805 UPVFHRPSEQKBEG-UULLZXFKSA-N 398.572 5.501 30 20 GKED CC(C)c1c(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cnn1-c1ccccc1 192335014 ANOOVRLRUNPQMY-UHFFFAOYSA-N 399.498 5.064 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(OCc3cccc(C#N)c3)c2)cc1OC 206947200 ZXPIDPDFGIAAFA-LUAWRHEFSA-N 399.446 5.051 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SC(F)F)c(OC)c2)ccc1OC 214921579 MZSHOCKTXCAEPP-YVMONPNESA-N 394.439 5.313 30 20 GKED N#CCc1ccc(NCc2cn(Cc3ccccc3)nc2-c2cccs2)cc1 237836155 CXCZBFPDVOXDSO-UHFFFAOYSA-N 384.508 5.338 30 20 GKED N#CCCCOc1cccc(CN[C@H](Cc2ccccc2)c2ccccc2F)c1 237875087 GWFURGIZIIASBU-RUZDIDTESA-N 388.486 5.582 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H]2C[C@H]2c2ccc(OCc3ccccc3)cc2)n1 246675929 UWLPUPWKWIJTRA-PCCBWWKXSA-N 388.492 5.011 30 20 GKED Cc1cc(N2CCCCCC2)ccc1N/C(O)=N/[C@H]1CCOC2(CCCC2)C1 329435021 LJIORBYCVKZKCI-IBGZPJMESA-N 385.552 5.193 30 20 GKED CCc1onc(-c2ccccc2)c1/C(O)=N/C1CCN(C2CCCCC2)CC1 330010252 HXGMUQZNHDCPTQ-UHFFFAOYSA-N 381.520 5.006 30 20 GKED C[C@H](/C(O)=N/C1(c2noc([C@@H]3CCCO3)n2)CCCCCC1)c1ccccc1 330016915 QHFURSNTHKYMIH-WMZOPIPTSA-N 383.492 5.231 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1CCCC(F)(F)C1 426119951 MHOOGAYJCYPZFN-GOSISDBHSA-N 399.441 5.145 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CSc2ccc(C#N)cc2)cs1 428277537 OFFNGOULOSJSSC-UHFFFAOYSA-N 393.537 5.609 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)c1 429834216 YHJHFOHECDQXPV-QHCPKHFHSA-N 398.487 5.568 30 20 GKED Cc1c(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)sc2ccc(C#N)cc12 429863497 CXKWEISRIMMVGO-ZDUSSCGKSA-N 391.521 5.524 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc2ncsc2c1 431916462 MNGHYFHHBAVEFR-YJBOKZPZSA-N 378.501 5.092 30 20 GKED CCCCOc1cccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 437851921 TXXRXPIGISYBNO-FCHUYYIVSA-N 377.488 5.169 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)S[C@@H](C)c1cccc(C#N)c1 443158787 PTMZFEKJCXZXKI-UONOGXRCSA-N 388.920 5.350 30 20 GKED C=CCn1c(SCc2nnc(C(C)C)s2)nnc1-c1cccc(Cl)c1 450872499 ILWYLGFAZCNOMA-UHFFFAOYSA-N 391.953 5.052 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 454538117 DGCHOPSOMZRMPX-HOCLYGCPSA-N 394.862 5.208 30 20 GKED O=C(NC1(c2cccc(C(F)(F)F)c2)CCC1)c1cc(F)c(F)c(F)c1F 460523450 HPXWQFXIKVTEST-UHFFFAOYSA-N 391.286 5.071 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CC[C@@H]2CCC[C@@H]2C1 460563573 JNFWPZWZSXTJIS-YQVWRLOYSA-N 376.525 5.408 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)CCCCc1nc2ccccc2s1 461672363 LXYSPUQYTOKSGY-UHFFFAOYSA-N 392.528 5.341 30 20 GKED C=CCn1c(S[C@H](C)c2cccc(C)c2)nnc1[C@H]1COc2ccccc2O1 463036301 QRQLQBSOVOSTMQ-OXQOHEQNSA-N 393.512 5.138 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cccc(F)c3Cl)c2)c1 463390162 JWBQNPDLBCTVCE-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(C#N)c1 463592929 SNZPBMZDNZCHSY-KSFYIVLOSA-N 399.881 5.609 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1c(F)cccc1Sc1ccccc1 463594671 LBIVLLZJGRCYDM-UHFFFAOYSA-N 392.455 5.500 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F 463740882 WQSUMBFISDMUSJ-FMKPAKJESA-N 399.482 5.523 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 464273726 HHYFMFFYXSBYHH-LLVKDONJSA-N 382.769 5.075 30 20 GKED CCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@H](Cc1ccc(F)cc1)C(C)C 465672015 XQGOIGAIQPOFOO-VGOFRKELSA-N 381.495 5.057 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@H](COC)C1)c1ccc(C(F)(F)F)cc1 468117907 UYJWRQKPFIYSQQ-LPHOPBHVSA-N 398.469 5.171 30 20 GKED C=CCC(CC=C)C(=O)N(Cc1ccccn1)c1ccc(Br)cc1 468685142 NTXOYEPONDMLKQ-UHFFFAOYSA-N 385.305 5.146 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cc2cccc(F)c2o1 473872512 DCNNKRBJJZCLJZ-OAHLLOKOSA-N 389.430 5.003 30 20 GKED CO[C@H]1CCC[C@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)C1 483488056 HCHRDCSMQZVONV-RXVVDRJESA-N 396.918 5.340 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 483846254 BWRXLOVQQYOBAC-OAHLLOKOSA-N 389.459 5.471 30 20 GKED C[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 487175446 IYHLMOBCCLNGDO-UZLBHIALSA-N 388.433 5.750 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1nc2ccccc2o1 496767130 AVBYXSQQNRPIFT-AWEZNQCLSA-N 396.324 5.597 30 20 GKED C=CCn1c(SCCOc2ccc3ccccc3c2)nnc1-c1ccco1 506563437 FMXSLZGOZNJUTD-UHFFFAOYSA-N 377.469 5.048 30 20 GKED CCN(C(=O)c1csc(Cc2ccc(C)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 507503011 FFMWGQFAZPBRBX-KRWDZBQOSA-N 389.524 5.137 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2nccn2CCCc2ccccc2)CC1 507614077 BKPNXJJTQGMYLQ-UHFFFAOYSA-N 398.554 5.010 30 20 GKED CCCN(CC(C)C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 508277671 IAYAYVQKULRDRJ-UHFFFAOYSA-N 381.476 5.259 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Oc1ccncc1 509478199 JIRDYFAIQGYNRN-MRXNPFEDSA-N 389.480 5.378 30 20 GKED COc1ccccc1SC[C@@H](C)CNC(=O)Nc1ccc(C(C)(C)C#N)cc1 509548216 FWXAQHPSPXVJLF-INIZCTEOSA-N 397.544 5.046 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1cccc(C#N)c1 510534031 PTCQLODTUPYVQW-ZDUSSCGKSA-N 386.282 5.713 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(C#N)cc2)cc1F 511567654 QEPSEZJKXHIBHB-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)n(-c2nccs2)c1C 512679294 YBTUFXGWRHCLCV-UHFFFAOYSA-N 391.949 5.094 30 20 GKED COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)Nc1cc(C#N)cn1C(C)(C)C 513518377 DTXWZWTZWJVJMJ-QFBILLFUSA-N 394.519 5.128 30 20 GKED C[C@H](NCc1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 514806167 AIEABXFOXZCBRT-NSHDSACASA-N 383.211 5.190 30 20 GKED CCN(C(=O)CCc1ccc(Cl)cc1Cl)[C@H](C)c1ccc(C#N)cc1 515130921 AJMIYFGCDLJFOW-CQSZACIVSA-N 375.299 5.407 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N[C@H](C)c3ccc(C#N)cc3)oc2c1 516253646 BTSJXOKEVJGVMB-MRXNPFEDSA-N 396.446 5.471 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2cccs2)n1)c1c(Cl)cccc1Cl 517343075 BTPLHTVWUMXSCR-LLVKDONJSA-N 394.308 5.173 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 517933889 LZLYBBTXPQXEDK-LJQANCHMSA-N 399.494 5.118 30 20 GKED Cc1cccc(CCC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1 518279763 LSMMIKRPYFCIHR-UHFFFAOYSA-N 386.470 5.167 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCCOc1cccc(C#N)c1 520315119 DMVONDFDZJSKGR-KRWDZBQOSA-N 393.512 5.140 30 20 GKED C[C@@H](C#N)CNC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 520358505 KUDFBZLLONHVAL-YVEFUNNKSA-N 379.312 5.103 30 20 GKED N#Cc1cccc(OCCCCC(=O)NC(c2ccccc2)c2ccccc2)c1 521955510 KBJGJAHQIGHODT-UHFFFAOYSA-N 384.479 5.013 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1Oc1ccccc1)c1ccc(C#N)cc1 522841549 FNLNPYIWIYUVPR-KRWDZBQOSA-N 388.492 5.783 30 20 GKED C[C@@H]1CCC[C@](C#N)(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)C1 523966550 ZZIHVVCKJTYUKK-OSPHWJPCSA-N 388.467 5.214 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1ccccc1C(F)(F)F 525041543 HTRITEOQCKGUPO-INIZCTEOSA-N 388.433 5.508 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 538362712 GUBDECSEKBUCBN-GOSISDBHSA-N 392.528 5.475 30 20 GKED C=CCC[C@H](N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21)c1ccccc1 539396661 MCZUDVCFVVYIMF-XZOQPEGZSA-N 376.544 5.272 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(=O)OC(C)(C)C)cc1 539940467 IAJHLVDQUIAMIB-HNNXBMFYSA-N 396.512 5.146 30 20 GKED CC[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(OC)c(OC)c1 540319303 YANLUTOATZZGSJ-QHCPKHFHSA-N 386.495 5.483 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccoc1)C1CCCCC1 541973215 NJQRIWFOWJKIKI-QGZVFWFLSA-N 397.544 5.898 30 20 GKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1cnc(C(F)(F)F)c(C#N)c1 551129643 LDGZSGUMCXHOJL-INIZCTEOSA-N 395.812 5.095 30 20 GKED COc1ccc(CNCc2ccc(-c3ccco3)cc2F)cc1OCCCC#N 556090956 IGLVRJHJFIEHHN-UHFFFAOYSA-N 394.446 5.067 30 20 GKED Fc1ccc(C(F)(F)c2noc([C@H](F)c3ccc(C(F)(F)F)cc3)n2)cc1 571563470 TYKVHXYMXIKBEY-CYBMUJFWSA-N 390.258 5.427 30 20 GKED CCSc1cccc(Br)c1NC(=O)c1ccc(Cl)c(C#N)c1 580509745 NJNJFCJQDZUQDY-UHFFFAOYSA-N 395.709 5.338 30 20 GKED N#CCCCCCC(=O)NC1(c2cccc(Br)c2)CCCCC1 588934848 KLLQPZDOWRMFAO-UHFFFAOYSA-N 377.326 5.199 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1cc2ccccc2n1CC#N 609169802 IDCOHLAWFYSBHI-GOSISDBHSA-N 399.519 5.630 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209154 SYIBOWWSNJTJRQ-HNNXBMFYSA-N 389.480 5.563 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)sc2cccc(F)c12 609460572 AVWJTHNBIWRKDJ-AWEZNQCLSA-N 392.377 5.362 30 20 GKED Cc1ccnc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)CC(C)C)c2)n1 609682551 MOQSZXRROSGKTC-UHFFFAOYSA-N 399.498 5.014 30 20 GKED C[C@H](SCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccc(C#N)cc1 609825840 XDLUBOLCOXBAHS-ZDUSSCGKSA-N 380.494 5.405 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1OC1CCCC1 615513180 YDNDNLYUCDBKLV-UHFFFAOYSA-N 380.488 5.237 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1 615969538 BOHKVHGQNBUEHZ-UHFFFAOYSA-N 377.415 5.117 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/Cc3c(C)cccc3C2=O)cs1 729148790 BCKRNYGSGMENSA-BOPFTXTBSA-N 388.492 5.267 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccccc2Oc2cccc(F)c2)cc1 731041484 BQCJHEMQIVKQAB-KRWDZBQOSA-N 376.431 5.199 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(-c3ccccc3)cc2C)c1 733843436 OZCNDOGZLNWPLX-QFIPXVFZSA-N 399.494 5.665 30 20 GKED C=CC[C@@H](NC(=O)NCC(C)(C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734663533 PCSOAVJIZJUIGF-GOSISDBHSA-N 392.330 5.283 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@H](C)C[C@@H]2c2ccccc2F)c1=S 743374222 PGXSQLOKTIWBPF-CRAIPNDOSA-N 398.507 5.040 30 20 GKED CCCCCC[C@](C)(CC)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 744038664 YSIIKYRNEAGRJM-BTYIYWSLSA-N 375.463 5.994 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1 746345736 JMZJTOFIJFIDMK-LUAWRHEFSA-N 379.416 5.145 30 20 GKED COc1ccc(/C=C2/CCc3cc(SC)ccc3C2=O)cc1OC(F)F 748146297 IONRZAOZWFSMRA-ZROIWOOFSA-N 376.424 5.231 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc(NC2CCCCC2)cc1 749370933 OFXSSOGAWYBUDQ-UHFFFAOYSA-N 388.471 5.247 30 20 GKED COc1ccc(-c2nc(S[C@H](C)c3ccc(Cl)cc3)nc(O)c2C#N)cc1 750002473 FNYVBWREZPESTI-GFCCVEGCSA-N 397.887 5.236 30 20 GKED CCCCCCCCCC(=O)N1CCC(C(=O)Nc2cccc(F)c2)CC1 751139869 HNRTXUSBGFHNHS-UHFFFAOYSA-N 376.516 5.144 30 20 GKED CCSc1ccc(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 752480419 BNWVVRGTXYBZGS-HNNXBMFYSA-N 386.929 5.481 30 20 GKED N#Cc1ccc([C@H](O)CSc2nc3cc(C(F)(F)F)ccc3s2)cc1 763233754 NUNXDMCUHVFSIL-CQSZACIVSA-N 380.416 5.012 30 20 GKED Cc1ccc(N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1Br 774259733 IAXBHJBBQSYKTP-UHFFFAOYSA-N 394.725 5.116 30 20 GKED C=CC[C@H](C(=O)OCc1csc(-c2ccccc2OC)n1)c1ccccc1 778416722 BOXVUJCPPWJWSK-SFHVURJKSA-N 379.481 5.222 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 787832282 MNHQBGKSEWGYAX-OAQYLSRUSA-N 395.553 5.257 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)C1=Cc2cc(OC)ccc2CC1 788847720 RQJWJSFULAEHAN-UHFFFAOYSA-N 397.540 5.276 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3ccsc3Cl)SC2=S)cc1Cl 790108492 RVRJROUBVPOTQR-XGICHPGQSA-N 397.333 5.332 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccccc1-c1nc2ccccc2s1)c1ccccc1 796533953 VKJFHVSKGYAYFK-SFHVURJKSA-N 398.487 5.956 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3cn(C(C)C)nc3C)s2)cc1 798370347 KPXUTGIUEGFRRI-FLIBITNWSA-N 381.501 5.109 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H]2c3cccc(Br)c3CC2(C)C)cc1 813790008 FOKXVSVIWABDOE-JLTOFOAXSA-N 399.332 5.153 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2CC[C@@H]2c2ccc(Cl)cc2F)n1 835201430 WBFJURDDMPPVTI-BPLDGKMQSA-N 376.884 5.429 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(C(F)(F)F)CCCC3)n2)cc1 842287667 AGNZYZPWONLYSL-AWEZNQCLSA-N 378.419 5.418 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 915807951 RAJSXIMHWOVJGJ-SNVBAGLBSA-N 383.498 5.022 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)on1 916680927 MVMKFBPHSBAXSU-LEWJYISDSA-N 386.455 5.008 30 20 GKED CCC(Cc1ccc(C(F)(F)F)cc1)=NNc1ccc(Cl)c(C(=O)O)c1 1776034281 XPXKOAQACQMDQN-UHFFFAOYSA-N 384.785 5.478 30 20 GKED C=CCC[C@H](CC(C)C)C(=O)Nc1cc(C(=O)O)cc(Br)c1C 1776166361 WWTXKIWVDZCXIX-CYBMUJFWSA-N 382.298 5.023 30 20 GKED C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1)c1nc2ccccc2n1CC#N 1776196746 HBBNZLFPNQOEAQ-MSUUIHNZSA-N 393.446 5.486 30 20 GKED CCCCCCCOc1ccc(/C=C2\CCc3occ(C(=O)O)c3C2=O)cc1 1776785939 UPRPVPIBAAMWSB-SAPNQHFASA-N 382.456 5.540 30 20 GKED CCN(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776855532 VPONMCWFIYNFEP-CXUHLZMHSA-N 399.490 5.333 30 20 GKED N#CCCCOc1cccc(/C=C\c2nc(C(=O)O)c(-c3ccccc3)s2)c1 1777566305 IFIOBRJWGAPTQK-QXMHVHEDSA-N 390.464 5.361 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2ccccc2Cl)cc1 15584202 HQUCDGUJWVXWMQ-UHFFFAOYSA-N 392.911 5.434 30 20 GKED N#C[C@H](C(=O)CCCOCCc1ccccc1)c1nc(-c2ccccc2)cs1 51534420 RDAZRQMCBMYMGA-HXUWFJFHSA-N 390.508 5.026 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3cc(C#N)ccc3C)c2C2CC2)cc1Cl 63961957 BVTHRCMLYXQWGD-UHFFFAOYSA-N 390.874 5.144 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 66801826 ALFXQMNQFDXDLG-LBPRGKRZSA-N 397.481 5.456 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954692 QEBFQQNCWQYAJD-SFHVURJKSA-N 379.529 5.343 30 20 GKED Cc1csc([C@@H](C#N)C(=O)Cc2cccc(OCc3ccccc3Cl)c2)n1 106353527 DEKKWUUOJBONAI-SFHVURJKSA-N 396.899 5.103 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1nc(-c2cc(Cl)sc2Cl)cs1 109234245 SGXDAVZNRVOKKP-QMMMGPOBSA-N 377.318 5.098 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc4c(c3)CCCC(=O)N4)c2)c1 130509839 VDWSKKAFRMALHE-UHFFFAOYSA-N 397.478 5.024 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)N[C@@H](CCC#N)c2ccccc2)C2CC2)o1 160683027 ULWAYDCVVYMHHY-HBGVWJBISA-N 377.488 5.122 30 20 GKED COCc1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 180501038 FIDMQRJNBKJVPU-SFHVURJKSA-N 396.899 5.456 30 20 GKED CCCOc1ccccc1Oc1ncccc1CN[C@@H](C)c1cccc(C#N)c1 181531728 BVFLYMYMFGBKNL-SFHVURJKSA-N 387.483 5.385 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2C2(CC2)C1 187130833 LMXHMMQNXALFIR-INIZCTEOSA-N 377.513 5.160 30 20 GKED CC[C@](C)(NCc1cccc(OCc2ccccc2C#N)c1)c1nc(C)cs1 236925066 YNJDSDDMMKMZAW-QHCPKHFHSA-N 391.540 5.317 30 20 GKED Cc1c(NC(=O)c2ccc(F)c(C(F)(F)F)c2)cccc1OCC(F)(F)F 303181962 KWJBNHOCHIWCOH-UHFFFAOYSA-N 395.274 5.346 30 20 GKED OC(=Nc1ccc(OC2CCCC2)c(Cl)c1)N1CCC(OCC2CC2)CC1 328618656 VHRLENQOHLWRTC-UHFFFAOYSA-N 392.927 5.098 30 20 GKED OC(=Nc1ccccc1N1CCCCCC1)C1CCC(/N=C(/O)C2CC2)CC1 329986780 FPSUQJCNNFELAP-UHFFFAOYSA-N 383.536 5.580 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Cc1ccc(C#N)cc1 410458896 QBBGMOKDXCXIQM-INIZCTEOSA-N 377.513 5.017 30 20 GKED Cn1nc(C(F)F)c2cc(C(=O)Nc3scc(C(C)(C)C)c3C#N)sc21 410928810 JWDRRBXPKAHOGA-UHFFFAOYSA-N 394.472 5.055 30 20 GKED Cc1ccc2cc([C@H](C)Nc3ccc4c(c3)CCC(=O)N4CCCC#N)oc2c1 426038161 WLFWQLSMINTUSI-KRWDZBQOSA-N 387.483 5.497 30 20 GKED Cc1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)ccc1Br 432484812 XGUNSISSONIEKM-GOSISDBHSA-N 386.293 5.314 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 435097559 SNIFSJKKZZVWRZ-LSDHHAIUSA-N 397.466 5.620 30 20 GKED N#C[C@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1c(Cl)cccc1Cl 436033519 LHLGHLBWZLGAOB-ZPPKWKGLSA-N 379.209 5.043 30 20 GKED CC[C@@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1 447585464 JCJLWJARDIUUHH-FYYLOGMGSA-N 375.903 5.631 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(CC#N)c1 455914498 GLSNHDNQMZCKSF-UHFFFAOYSA-N 375.394 5.214 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1c1cccc(Cl)c1)c1ccccc1 458797741 GPVZBUMLGIUQAL-SFTDATJTSA-N 381.907 5.622 30 20 GKED C[C@@H]1CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)[C@@H]1c1cccc(F)c1 458808625 ZGNNSOSGYCQVIV-YHYVQYDKSA-N 379.479 5.353 30 20 GKED C[C@H](C(=O)N1CC[C@@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462230254 HXYROSPSUUDZKS-QEEYODRMSA-N 386.417 5.290 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2cnccc12 465119170 GVGMXASFLNIEKU-UHFFFAOYSA-N 393.446 5.246 30 20 GKED Cc1coc(-c2cccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)c2)n1 467976628 FADLCHGBIOJWSA-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469157564 YKIISRQTBTVOCG-ZDUSSCGKSA-N 399.372 5.065 30 20 GKED Cc1ccc(C[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CC2)cc1 469244595 NIRJIMSCVILXAA-QHCPKHFHSA-N 387.527 5.011 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 474903169 YVGRTFHXHPVSOM-SCWSEQNSSA-N 396.918 5.529 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 476107555 DMZHSSSWLNUFNU-MRXNPFEDSA-N 380.797 5.175 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@H]1c1ccccc1OC)c1ccc(F)c(F)c1 477738825 AUMTYZULXBXNNF-FPOVZHCZSA-N 386.442 5.137 30 20 GKED COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)Nc1ccc(C#N)cc1Cl 478168583 PUBDYLAKTSZSGZ-IFXJQAMLSA-N 383.879 5.225 30 20 GKED CC(C)c1occc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 479375919 HBIGNEWTRPBHNR-UHFFFAOYSA-N 378.403 5.245 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(C)noc1-c1ccccc1 480204237 SNWGCOBJHVBAAK-UHFFFAOYSA-N 393.491 5.038 30 20 GKED CCS[C@@H]1CCCCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 480363840 GXMLKIVHZYRRTD-JOCHJYFZSA-N 394.540 5.293 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 483838542 IBMJFIZOPOMDBS-QGZVFWFLSA-N 394.824 5.517 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 485688565 FNCNOIOTWOIEHW-UHFFFAOYSA-N 378.834 5.589 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N[C@@H](CCCC#N)c1ccccc1 487271454 RRSOFYAPFAKMKA-YOEHRIQHSA-N 391.298 5.312 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(CSc3ccccn3)c2)cc1 499039931 WFVGCPFCVWMSIO-UHFFFAOYSA-N 376.481 5.191 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1 502557349 CIVRBCLYFXCAPX-KSFYIVLOSA-N 399.535 5.003 30 20 GKED C[C@H]1CCC[C@@H](OCCCCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)C1 503956113 ROQVEBQGAQKPNL-GBXCKJPGSA-N 394.559 5.330 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc2nccc(C)c2c1 505325315 HOLNTXHTIOSHJK-UHFFFAOYSA-N 394.434 5.163 30 20 GKED Cc1cc(C)cc(NC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 505773002 XCYPKHURNTZKMW-KRWDZBQOSA-N 381.888 5.326 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)c(Br)cc1F 511152823 CCSJKQAQCMBBPA-UHFFFAOYSA-N 387.249 5.009 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3sc4c(c3C#N)CCCC4)s2)o1 512144183 UDPYINAIRHAAJC-UHFFFAOYSA-N 383.498 5.084 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC[C@H](Cc2csc3ccccc23)C1 513118990 RXDYZYJOFOSKCD-QGZVFWFLSA-N 383.561 5.195 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccccc2c1Cl)c1ccc(Cl)c(Cl)c1 517605347 TVDRHGMIKMWWKB-CQSZACIVSA-N 378.646 5.123 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517902149 YXRDGEVRXIAGME-MRXNPFEDSA-N 389.430 5.715 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccccc1Cl 518141549 WBJWGRYNQGPFDT-OAHLLOKOSA-N 388.920 5.389 30 20 GKED Cc1ccc(Cl)cc1NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 519732972 JUSOMMZZHCABPO-UHFFFAOYSA-N 378.819 5.351 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522573072 FERBIGHEXDPKGQ-HNNXBMFYSA-N 394.858 5.348 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCCCC[C@@H]2c2cccc(C)c2)cc1 522790513 AYVPMOLIVOMGHG-JOCHJYFZSA-N 391.515 5.060 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCc3c[nH]c4ccccc34)cc2)c1 524414021 FSHUARXFQASGCS-UHFFFAOYSA-N 395.462 5.190 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524439256 OFXXZYZLQFPEFJ-LJQANCHMSA-N 397.906 5.587 30 20 GKED COc1cccc(Oc2ncccc2CNc2ccc(C#N)cc2C(F)(F)F)c1 525461088 CQAVZMYCOUFPDC-UHFFFAOYSA-N 399.372 5.385 30 20 GKED COc1cccc([C@H]2CN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2(C)C)c1 528900269 MKKIDLKKEDCWLS-OAQYLSRUSA-N 391.515 5.154 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)C1 530282687 SUYHZJGJUFIMKC-XMSQKQJNSA-N 394.490 5.134 30 20 GKED C=CCCOCCCCC(=O)N1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 540490873 YEJQREJZOGXLEK-APWZRJJASA-N 383.454 5.378 30 20 GKED Cc1ccc(-n2nc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2C)cc1 540778887 PJXXMXDSJYMRFM-LJQANCHMSA-N 398.491 5.103 30 20 GKED CCS[C@@H](C)c1noc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542017049 IKQRIRPAGGXMOC-HOTGVXAUSA-N 392.528 5.273 30 20 GKED Cc1sc(NC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)c(C#N)c1C 542198323 HIMUZJYYDGTANL-UHFFFAOYSA-N 391.374 5.163 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1scnc1C1CCCC1 546772363 GAMHNTRPICZBLG-UHFFFAOYSA-N 377.469 5.112 30 20 GKED C=CCC(C)(C)c1noc(CSc2nnc(-c3ccc4ccccc4c3)o2)n1 556361549 NSODCENSLBJQAZ-UHFFFAOYSA-N 392.484 5.419 30 20 GKED COc1ccc([C@H](CCC#N)NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 556606129 UHMKQXQTTFVRIM-FQEVSTJZSA-N 397.931 5.607 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1C(F)F)c1ccc(C(F)(F)F)cc1 561627895 ATIDEOPWZMUCKQ-LSDHHAIUSA-N 376.369 5.152 30 20 GKED CC[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 583433697 VJLPWFKLLLMISU-IERDGZPVSA-N 378.476 5.178 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)c1c(Cl)cc(C#N)cc1Cl 589833293 YDDUUALSHALNGV-LBPRGKRZSA-N 377.271 5.143 30 20 GKED COc1ccc([C@@H](NCc2ccc(C3(C#N)CC3)cc2)c2ccccc2OC)cc1 594935894 LGPLEZPVJDVPOQ-RUZDIDTESA-N 398.506 5.138 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)CSCc1ccc(C#N)cc1 604012878 CCQGKECJWUUNCI-UHFFFAOYSA-N 393.339 5.147 30 20 GKED Cc1ccc(-c2ncc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)s2)c(C)c1 604508775 DGXNHGAMOSXHKI-UHFFFAOYSA-N 389.524 5.601 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCc1cccc(OC2CCCC2)c1 609016452 BYMWVBAHCPIFFA-UHFFFAOYSA-N 392.499 5.238 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)sc2c1CCC2 609033385 KSZAPXVZHPCZAS-NWDGAFQWSA-N 377.296 5.157 30 20 GKED CC(C)Oc1ccccc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 609262234 WWUWEZGEKCABDM-UHFFFAOYSA-N 386.451 5.177 30 20 GKED CC(C)(C#N)C(=O)Nc1ccc(Oc2ccccc2Br)c(Cl)c1 609374201 JBYNXLBMWKOOKF-UHFFFAOYSA-N 393.668 5.383 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2F)o1 609375350 LFYVDKCGUOWJPO-UHFFFAOYSA-N 394.471 5.663 30 20 GKED CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 609402832 CLUBFPCLAUWLCY-HKUYNNGSSA-N 381.545 5.471 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)c1cc2ccccc2n1CC#N 610471901 IQCFCIPPDGILJV-JKSUJKDBSA-N 379.891 5.082 30 20 GKED CCCc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 620058229 PIPJOCOEDBELCQ-OAHLLOKOSA-N 388.414 5.758 30 20 GKED CCCc1nc(C)c(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 644786898 ZBFTWJBOBMJHPS-LLVKDONJSA-N 393.390 5.054 30 20 GKED C=C(C)[C@H](N[C@@H](CC)c1cc(OC)c(OC)c(OC)c1)c1ccc(F)c(F)c1 652190511 QEKCNIRZTURRED-RXVVDRJESA-N 391.458 5.349 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccccc2CC)n1 661117108 OIIRTASGZKUOJR-TZIWHRDSSA-N 397.588 5.615 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1c(C)cccc1C 669321959 ZNLXBILETRAGJP-WOJBJXKFSA-N 380.536 5.054 30 20 GKED O=C(N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F)C1=CCC1 679995248 LQRGHHDBQXTHKO-NSHDSACASA-N 391.233 5.164 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1cnc(-c2ccccc2)s1 727264397 QKKQJOPNUVWSJC-OUBUNXTGSA-N 388.448 5.548 30 20 GKED CC(=NNc1ncnc2sccc12)c1sc(-c2ccc(Cl)cc2)nc1C 727648691 PGHQXACMEQUBJQ-UHFFFAOYSA-N 399.932 5.613 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2ccccc2SCCC#N)c1 730982037 IJFMZLVJIQOKMC-UHFFFAOYSA-N 397.500 5.292 30 20 GKED Cc1ccc(C2=CCN(C(=O)Nc3cccc(C#Cc4ccccn4)c3)CC2)cc1 732434756 GEHXVFZXHYFPLH-UHFFFAOYSA-N 393.490 5.111 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732901692 ZZOFROCIHSIFRR-LPHOPBHVSA-N 394.927 5.909 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1C#N 741843127 YMKNWSKPIVISBX-YCRREMRBSA-N 378.428 5.034 30 20 GKED C[C@H](Nc1cccc(COc2ccccc2)c1)C(=O)N(CCC#N)c1ccccc1 743472948 TZZJOTMDNZBCCN-FQEVSTJZSA-N 399.494 5.013 30 20 GKED N#C[C@H](C(=O)C(C1CC1)C1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 753539250 JQZVCFYAUGRKFO-CQSZACIVSA-N 391.323 5.729 30 20 GKED C#CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccccc1 757006806 ZKRKCJCHDUMTMN-IIBYNOLFSA-N 389.524 5.243 30 20 GKED C[C@H](NC1(c2c(Cl)cccc2Cl)CCC1)c1ccc(OCC#N)cc1 774510961 UJAGNCDHZFKMFA-AWEZNQCLSA-N 375.299 5.626 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](CC2CCC2)c2ccccc2)ccc1OC 776165399 QDEYFABXURPDCD-FCHUYYIVSA-N 378.516 5.397 30 20 GKED C[C@@H](Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1cccc(C#N)c1 777686173 MZJVXOVNWHFJHE-MRXNPFEDSA-N 377.488 5.025 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc(OCc3nc(C)no3)cc2)cc1 777690575 UHGACTDASVMDGO-HNNXBMFYSA-N 399.878 5.261 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cc(Br)cc(C(F)(F)F)c1 779993197 NCZVDRIVFYGCJN-NSHDSACASA-N 399.210 5.371 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C\c3cc(Cl)cc(C(F)(F)F)c3)ccc21 780187895 XXDFLZVEIYMRPI-KXFIGUGUSA-N 393.792 5.164 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2ccc3c(C)cc(O)nc3c2)c1 808365395 SWUJJUUPYUOSJC-UHFFFAOYSA-N 398.487 5.139 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1 813218395 VKUCQJARDKRZFW-USYSOWRXSA-N 398.306 5.399 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(-c2ccc3sccc3c2)no1 818385729 XWTMYFITIOICFY-HNNXBMFYSA-N 398.488 5.211 30 20 GKED C[C@H](NCc1cc(C#N)cc(CN[C@@H](C)c2ccsc2)c1)c1ccsc1 878560712 GAOBWJLGHLJTCK-HOTGVXAUSA-N 381.570 5.383 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@H](C#N)c3nc4ccccc4s3)ccc2c1 916846073 GNNKKSHYVFPXGI-SSVWKNEZSA-N 384.460 5.348 30 20 GKED Cc1cc(C)cc(OCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046443 KBGKHSYQQLYGMP-MRXNPFEDSA-N 384.888 5.212 30 20 GKED O=C(/C=C\c1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605533 WKCJQIZQWIWIDB-KTKRTIGZSA-N 380.381 5.128 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CCCc2ccccc2)C(=O)O)c1 1776788187 WTKJVHRYVZVTRD-DEOSSOPVSA-N 397.559 5.602 30 20 GKED COc1cc(/C=C/C(=O)c2sc3c(Cl)cccc3c2C)ccc1C(=O)O 1777290547 ZCEKKPMSWNVODQ-VQHVLOKHSA-N 386.856 5.466 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3ccc(CC#N)cc3)c3ccccc3n2)cc1 8125754 XDKLFXSRYKENNK-UHFFFAOYSA-N 393.446 5.229 30 20 GKED C[C@@H](OC(=O)/C=C/c1ccccc1C#N)c1ccccc1NC(=O)c1ccccc1 51942128 FVJAEVQNBRNMAD-WXWBBQJKSA-N 396.446 5.128 30 20 GKED C=CCn1c(SCCOC(c2ccccc2)c2ccccc2)nnc1C1CC1 53727258 SWRSTAFLJXSHGR-UHFFFAOYSA-N 391.540 5.240 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)Cc1ccccc1C(F)(F)F 65473149 UXCFSQHVZGVHSA-UHFFFAOYSA-N 391.393 5.028 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1sc(-c2ccc(Cl)s2)nc1C 66027032 DYQXAYONFVDJDX-UHFFFAOYSA-N 380.844 5.024 30 20 GKED CN(Cc1ccc(OC(F)F)cc1)C(=O)c1ccccc1-c1ccccc1C#N 104877572 DAFRZBTVDDIMAD-UHFFFAOYSA-N 392.405 5.099 30 20 GKED Cc1csc([C@@H](C#N)C(=O)Cc2cccc(OCc3ccc(Cl)cc3)c2)n1 106353524 CQKMQVRNRRMWRK-IBGZPJMESA-N 396.899 5.103 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1Cl 108532505 WVXYWMOWGFLMIX-DNVCBOLYSA-N 399.947 5.961 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)Nc1ccc(F)cc1OCC#N 120114725 FECOKTZBXYVQHV-JTQLQIEISA-N 399.274 5.154 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 120185856 QGBPXPALSYIBJJ-ZDUSSCGKSA-N 395.459 5.293 30 20 GKED C=C[C@@H](CC(=O)Nc1ccccc1NC(=O)Cc1cccs1)c1ccccc1 131514265 YJTUFELHFBRLIU-KRWDZBQOSA-N 390.508 5.228 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Br)cc3)n2)cc1 166409471 FJQDKYZYLGOAEX-INIZCTEOSA-N 397.297 5.371 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 173968826 CNTPLWIMIXGGRY-APWZRJJASA-N 376.481 5.092 30 20 GKED Cc1csc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)n1 174494606 NMCQNOBMLLUNDL-ZDUSSCGKSA-N 396.447 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(Br)c1C 189885015 RESWIVZOJOOONO-UHFFFAOYSA-N 378.335 5.923 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(=O)N(c2ccccc2Cl)C1 189908936 VGKXWHXBAUWYFS-QGZVFWFLSA-N 396.918 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ncc(C)c(OC)c1C 191504716 VXEBODLZDQIOCR-UHFFFAOYSA-N 381.520 5.223 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1)N1CCCC1 329017035 QWSQWBIOAFSPBE-SESVDKBCSA-N 383.536 5.391 30 20 GKED C[C@@H]1CCCCN1C(=O)c1ccc(N=C(O)c2ccnc(C3CC3)c2)cc1Cl 329432657 IAUDZWVXBDPZCX-CQSZACIVSA-N 397.906 5.263 30 20 GKED C[C@H](NCc1nnc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 374676532 HDPDUOCHRLIBCL-KRWDZBQOSA-N 380.451 5.126 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(C(F)(F)F)cc1 410158027 OCEYSTNTNDJUCL-HNNXBMFYSA-N 389.421 5.260 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 410314145 DWWQOTGBMYBLSQ-LBPRGKRZSA-N 377.271 5.201 30 20 GKED Cc1c(C(=O)N(C)[C@H]2CCCC[C@H]2C(F)(F)F)sc2ccc(C#N)cc12 429941475 DCCPSXSCVKEIAY-CABCVRRESA-N 380.435 5.275 30 20 GKED Cc1cccc([C@@H]2CCCCCN2Cc2cn(CCC#N)nc2-c2ccncc2)c1 435125956 IDVAQFBKJCKSRB-DEOSSOPVSA-N 399.542 5.285 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCC(F)(F)F)cc1Cl 437763107 KKHBEEAOXPJDGV-INIZCTEOSA-N 395.812 5.459 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443888223 YPXRKTCHFNLTBO-UHFFFAOYSA-N 387.386 5.261 30 20 GKED CC(C)n1ncc2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc21 444144703 NMAPRGHQIHXBOR-UHFFFAOYSA-N 385.471 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C(F)(F)F)OC(C)(C)C1 455255846 ZUSLZPCKMWIFOY-MRXNPFEDSA-N 384.442 5.112 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458804742 SVLIGBIFBSZZAK-WMZOPIPTSA-N 392.528 5.434 30 20 GKED C=CCOc1cccc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2c2ccncc2)c1 463013646 SICDUCVMFBLDQC-OAQYLSRUSA-N 391.858 5.071 30 20 GKED Cc1cc(Br)cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 464508400 FFCKNAXVGVCMHC-INIZCTEOSA-N 397.297 5.371 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccnn2[C@@H](C)C2CC2)cc1 464930770 TYKCPZXJXSRSQV-INIZCTEOSA-N 386.455 5.079 30 20 GKED C=C(C)[C@H]1OCC[C@H]1C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 469297472 SCSXQZXWXVKDJW-NVXWUHKLSA-N 393.270 5.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCSC[C@H]1c1ccccc1 475549209 NXLRFIGUAIVOAY-NRFANRHFSA-N 380.557 5.861 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN[C@H](C)c2cccc(C#N)c2)on1 481266947 FBZSMAVHVOMXJV-MRXNPFEDSA-N 383.451 5.226 30 20 GKED C[C@@H](C1CC1)n1nccc1NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 482461517 SVCVKNDNCIVXTL-SJORKVTESA-N 399.498 5.275 30 20 GKED Cc1nc(COc2cccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2)cs1 483193464 ILWRFZSSURFPJB-NRFANRHFSA-N 399.475 5.069 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl)c1c[nH]c2ccccc12 486429067 UQTVEWYJKNJNLA-KZULUSFZSA-N 386.282 5.349 30 20 GKED C=CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccccc1F 487978625 HETNJICPFQDBHP-UHFFFAOYSA-N 392.503 5.364 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(NC(=O)CCC)ccc1Cl)c1ccccc1 489619176 OVXVQKRGEVCEQE-SFHVURJKSA-N 384.907 5.767 30 20 GKED N#C[C@H](NC(=O)CCCOc1cccc2ccccc12)c1ccc(Cl)cc1 499810047 IUMJFLDXDSXNQR-FQEVSTJZSA-N 378.859 5.033 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 505007045 ZBHSDVHTENXHFL-CYBMUJFWSA-N 383.439 5.553 30 20 GKED N#C[C@@H](NC(=O)c1cccc(-c2cscn2)c1)c1ccc(Cl)c(Cl)c1 505961359 XIBKUFSXNJPJRX-MRXNPFEDSA-N 388.279 5.112 30 20 GKED C[C@@H](Oc1ccccc1C#N)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 511980937 JBCLIJCASLVJMM-BDJLRTHQSA-N 391.324 5.159 30 20 GKED CC1=C(c2ccco2)CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 512766916 MUZKUIZRFPBJIS-UHFFFAOYSA-N 384.435 5.263 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(-c2ccccc2Nc2ccccc2COC)no1 516682703 FUMKTJXPHFXYHQ-WIYYLYMNSA-N 391.471 5.075 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccc1-n1ccnn1 517765782 IEURJNALZAKFSM-MOPGFXCFSA-N 393.494 5.218 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519029283 CIKVRNOILQTXJM-UHFFFAOYSA-N 395.418 5.566 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1 520938093 PQORCLKRKOTENY-KKSFZXQISA-N 379.529 5.662 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccccc3-c3ccccc3)cc2)nc1 521954980 MDESWAAWPYVSKH-UHFFFAOYSA-N 391.430 5.665 30 20 GKED C[C@H](CNC(=O)N[C@H](C)c1ccc(C#N)cc1)c1c(Cl)cccc1Cl 523820652 WLMPBIGHVUZRGB-CHWSQXEVSA-N 376.287 5.029 30 20 GKED COc1ccc([C@@H](NCc2cc(C#N)cs2)c2ccccc2Cl)c(OC)c1 530640306 LWBDQGDUIMANEY-NRFANRHFSA-N 398.915 5.170 30 20 GKED CSc1cccc([C@H](NCc2cc(C#N)cs2)c2ccc(F)c(F)c2)c1 530640509 DPJLBJAVFDKVEO-FQEVSTJZSA-N 386.492 5.499 30 20 GKED C=CCC[C@@H](NCc1nnc(-c2ccco2)o1)c1ccc(C(F)(F)F)cc1 537132796 QNESQVKVEIBNLZ-OAHLLOKOSA-N 377.366 5.146 30 20 GKED CCCCCn1cc(C(=O)Nc2ncccc2OCCCC#N)c2ccccc21 538574937 AWQMJAHHLMIIMC-UHFFFAOYSA-N 390.487 5.161 30 20 GKED C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(C#N)cc1 540597694 SOPSOVMNLRTXRN-IBGZPJMESA-N 378.479 5.262 30 20 GKED CC(C)COc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(CC#N)CC1 541968516 QVDOJQMCACJGOA-OAQYLSRUSA-N 385.552 5.144 30 20 GKED CCc1oc(C(=O)OC)cc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542942024 KJCCXNPSRHNVQG-INIZCTEOSA-N 388.467 5.018 30 20 GKED CCCN(C(=O)c1cc(C#N)cs1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 558082360 XBAPOJIWQNTMRW-OAQYLSRUSA-N 393.487 5.104 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 560709886 DXPBZHCRIJCHRM-UHFFFAOYSA-N 397.434 5.177 30 20 GKED C=CCn1c(S[C@H](C)c2nccn2-c2ccccc2)nnc1-c1cccs1 561476843 ZHGJKGFWMMOHNB-OAHLLOKOSA-N 393.541 5.232 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)s2)c2ccccc2Cl)cc1OC 571829565 RUOYBLQWTDXOFF-OAQYLSRUSA-N 398.915 5.170 30 20 GKED COc1cc([C@@H](C)N[C@H]2CCc3ccc(C#N)cc32)ccc1OCCC(C)C 580015919 IKEMHCOCQWOZQF-VGSWGCGISA-N 378.516 5.330 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C1CCC(F)(F)CC1 581687656 OXFCQLVDQDDOBW-UHFFFAOYSA-N 388.389 5.140 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CC(CC(F)(F)F)C2)cc1 590856163 IODZHPHPKMCASU-UHFFFAOYSA-N 391.418 5.126 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CC=CC2)[C@H]1c1ccccc1)c1ccccc1 592024891 GLEXHRPVGIZMPJ-DHIUTWEWSA-N 385.511 5.524 30 20 GKED N#CC[C@@H]1CCCN(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)C1 596101168 CTOKQVSHEKVQIO-GMAHTHKFSA-N 375.516 5.086 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(Cl)c1F 600423424 ATSFXXYKRPYHKQ-UHFFFAOYSA-N 382.847 5.754 30 20 GKED CC(C)c1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)cc1 603657776 KVYGMWHBGHRLMG-UHFFFAOYSA-N 375.516 5.808 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cc2ccc(F)cc2s1 604240740 VCXKJMAJMUSUFV-UHFFFAOYSA-N 376.412 5.352 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCCC[C@H]2c2ccc(Cl)cc2)cc1 609779102 DTWMENJLUHWOSI-NRFANRHFSA-N 395.934 6.290 30 20 GKED C[C@H](SCCC(=O)Nc1cccc(Br)c1)c1ccc(C#N)cc1 609901434 WEOHATUBHOSEQP-ZDUSSCGKSA-N 389.318 5.144 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N[C@@H](CC2CC2)c2ccccc2)o1 610236470 XPHHQFUXUVVCBM-NRFANRHFSA-N 386.451 5.001 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)C(=O)Nc1ccccc1Br 611103434 UJBAQZHSMBNUPR-SNVBAGLBSA-N 395.709 5.093 30 20 GKED CN(CCC1CC1)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646438998 FUXUGZWDFZPOHR-UHFFFAOYSA-N 386.311 5.240 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc2ccccc2n1 671746200 VINUSVNFKJUVLT-HSZRJFAPSA-N 399.453 5.940 30 20 GKED CC(=O)C(C)(C)CCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 676521804 YYXKDDUUZVDCHQ-LJQANCHMSA-N 382.891 5.329 30 20 GKED Cc1cccc(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1F 678897260 HXOJDMYOXBTCLU-NXEZZACHSA-N 386.311 5.165 30 20 GKED C#CCOc1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1 731112797 DQCSPKDPSJBLOZ-LJQANCHMSA-N 388.389 5.086 30 20 GKED COc1ccc(/C=C/C(=O)c2sccc2Br)c(OC(F)F)c1 734094730 GKJLOXRKBSRFLZ-HWKANZROSA-N 389.217 5.017 30 20 GKED C=CC[C@@H](NC(=O)N(CCC)[C@@H](C)c1cc2ccccc2o1)c1ccncc1 734678820 IUNIQGZPTAZYHP-FXAWDEMLSA-N 377.488 5.628 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1OC(F)F 734980776 LFVVRXUGGLYDIH-WAPJZHGLSA-N 386.366 5.507 30 20 GKED C[C@@H](SCCC(=O)Nc1sc2c(c1C#N)CCCC2)c1cccs1 737403630 ICVDUNVKZGXFFX-GFCCVEGCSA-N 376.572 5.383 30 20 GKED CS[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 740536375 RZMPBMYNMVAHSZ-QFBILLFUSA-N 398.940 5.744 30 20 GKED CCCn1ccc2ccc(NC(=O)NCc3cccc(O[C@@H](C#N)CC)c3)cc21 743179502 NOLLEQSDRLEPMY-HXUWFJFHSA-N 390.487 5.054 30 20 GKED CC[C@H](/N=C\c1cc(Br)ccc1O)c1nc(C(F)(F)F)cs1 745975917 CPFDDCYIPUTTOE-OPJQEUEOSA-N 393.228 5.200 30 20 GKED CCS[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748942214 NGWNMVPSQWOECI-QHAWAJNXSA-N 379.529 5.138 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2cccc(OCc3ccccc3F)c2)c1C 750911021 WUUYVMMZEKEXCS-SEYXRHQNSA-N 378.447 5.134 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cccc(O)c1F 762321112 QMBYFZAJTSYJRV-SNAWJCMRSA-N 393.258 5.221 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Br)c(Cl)c2F)cc1 767752861 AWQYCSPZKGILMI-UHFFFAOYSA-N 395.659 5.111 30 20 GKED CC(C)Oc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1Cl 770488913 LNZDHTMTLFMVME-UHFFFAOYSA-N 394.906 5.516 30 20 GKED C#Cc1cccc(NC(=O)N2Cc3cc(OC)ccc3C[C@H]2c2ccccc2)c1 776296397 LTZKFUTWEZIZSN-DEOSSOPVSA-N 382.463 5.008 30 20 GKED CN(Cc1ccccc1)c1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 776836891 PONKTCRTHXSRJV-UHFFFAOYSA-N 381.479 5.130 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CC(Cc1ccccc1)Cc1ccccc1 780150133 TXSZSJTWSCZUCI-HXUWFJFHSA-N 398.506 5.408 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(F)cc2)cc1 780168663 BDJHCEMQMNFUKD-OAHLLOKOSA-N 376.387 5.161 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1C1CCCCC1 781134805 HHPHZPZJBLVGCG-QHCPKHFHSA-N 398.510 5.605 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2scnc2C2CC2)CC3)cc1 782329106 XYSXXDXDRVSPIJ-GXDHUFHOSA-N 394.521 5.365 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(OCC#N)cc1 782779429 YNFFETGXRUFAMI-OALUTQOASA-N 381.479 5.539 30 20 GKED C=C[C@@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 785767279 FONKCYUAKUXQRT-NRFANRHFSA-N 386.517 5.036 30 20 GKED N#C[C@@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 792089869 AVZHFPGTQNDPKC-ZCYQVOJMSA-N 390.486 5.828 30 20 GKED N#C[C@H](C(=O)CO[C@H]1CCCc2ccccc21)c1nc(-c2ccccc2)cs1 797549397 IHRSMWITJWWUOV-KNQAVFIVSA-N 388.492 5.081 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566990 WZRGSDLSCPNWME-DOTOQJQBSA-N 384.545 5.516 30 20 GKED O=C(C[C@@H]1CCC(F)(F)C1)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 797972650 XFNKIAJZIJTTOQ-TVQRCGJNSA-N 389.286 5.251 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(C(C)(C)c2ccccc2)no1 848608261 CMFDWXJWBKQQQL-KRWDZBQOSA-N 398.507 5.045 30 20 GKED CC(C)(C#N)c1ccccc1CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F 853725024 JSOADXNRINDNOT-AREMUKBSSA-N 384.398 5.174 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccc(Br)cc1 915043906 DKVMDAYYUGBEAZ-KMKOMSMNSA-N 394.268 5.319 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1C=NNc1cccc2ncccc12 915963717 KRBWMQYTURBSGP-UHFFFAOYSA-N 389.890 5.196 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cc2ccccc2s1 916945004 PVHMVCKZMLTQEK-AWEZNQCLSA-N 389.263 5.169 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776471095 JJLJVNKWSWVBLH-IDVQTMNDSA-N 396.386 5.047 30 20 GKED C[C@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2c(O)ccc(F)c21 1776586861 ZDPOYEFVTHTHSA-KBVGCWLLSA-N 394.423 5.341 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](CC(=O)O)C2CCCC2)cc1 1776786292 MIYRMESKQMIYBJ-OAQYLSRUSA-N 375.553 5.407 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776817269 IVGWRXOZEKCRMR-BENRWUELSA-N 392.476 5.798 30 20 GKED O=C1/C(=C\c2ccccc2Oc2cccc(F)c2)C[C@H](C(=O)O)c2ccccc21 1777698067 BNQDTPLFOGMEDK-JQFUVSSDSA-N 388.394 5.456 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2nccs2)cc1Cl 57344708 QSIVVMCJNFTDQG-KRWDZBQOSA-N 381.888 5.023 30 20 GKED C=CCN(C(=O)CC(F)(F)F)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 58657523 MULDEGHWGJGUMZ-UHFFFAOYSA-N 395.233 5.588 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccccc2n1)c1nc(-c2c(F)cccc2F)cs1 64714137 PBJCWLGVEVNXLS-ZDUSSCGKSA-N 391.402 5.127 30 20 GKED C=CCn1c(SCc2sc3ccccc3c2Cl)nnc1-c1ccncc1 96992365 KJMWDLLCBRHXNB-UHFFFAOYSA-N 398.944 5.687 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccccc2SCc2csc(C)n2)c1 103031583 JOWORISILJPSFG-UHFFFAOYSA-N 378.522 5.002 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1sccc1SC(F)F 107105385 ZGCUJPKAIYRLEV-UHFFFAOYSA-N 386.448 5.110 30 20 GKED N#C[C@@H](Sc1nnc(-c2cccc(Br)c2)o1)C1CCCCC1 115186210 AAIQPLFKWCMKDL-CQSZACIVSA-N 378.295 5.064 30 20 GKED Cc1csc(-c2cccc(NC(=O)N[C@H](CCC#N)c3ccccc3)c2)n1 120542136 DGKUYDRIVOJPLF-LJQANCHMSA-N 376.485 5.285 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)n1 125449348 WTKWWALXABWFGM-LPHOPBHVSA-N 380.517 5.153 30 20 GKED N#CCC[C@H](NC(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccccc1 153539992 IRAXIQIDWGECLK-IBGZPJMESA-N 395.915 5.167 30 20 GKED CCCCc1ccc(NC(=O)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 159335620 OKDAWBCFXFODLU-INIZCTEOSA-N 395.528 5.001 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)c2sccc2-c2ccccc2)cc1C#N 161005778 ZAHDETZURLISRT-UHFFFAOYSA-N 391.452 5.107 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ncc(C)s1)C1CC1 175887838 AKQKGBAZIGHASL-OAHLLOKOSA-N 381.954 5.015 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)[C@H](C#N)c1nc(C)cs1 176516650 MMEVDCJVLWINIJ-INIZCTEOSA-N 378.453 5.133 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1cc(Br)ccc1F 177908354 ILOIACDGNAYAIB-FNORWQNLSA-N 389.249 5.003 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 179440747 OLOZVZGVPIAPDR-GOEBONIOSA-N 394.462 5.228 30 20 GKED COC(=O)[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(Cl)c1Cl 180615287 SAXPEDFKQNJNKD-SFHVURJKSA-N 393.270 5.002 30 20 GKED N#C[C@H](C(=O)Cc1cccc(F)c1F)c1nc(-c2ccc(Cl)cc2)cs1 181013377 LIZKRJQDKBRADD-CQSZACIVSA-N 388.826 5.161 30 20 GKED C=CCn1c(S[C@H](C)c2noc(-c3ccccc3)n2)nnc1-c1cccs1 194610847 NRHCQDFSGYVYCO-CYBMUJFWSA-N 395.513 5.096 30 20 GKED C=CCc1cc(CN[C@@H](c2ccccc2)c2ccccc2OC)cc(OC)c1O 237344303 RBJABGULBBMYSV-DEOSSOPVSA-N 389.495 5.017 30 20 GKED N#C[C@H](C(=O)/C=C\c1nc2ccccc2s1)c1nc2cc(Cl)ccc2s1 255367047 JXBRWWBNOFRFRD-XYLWRLHESA-N 395.896 5.449 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1cccc(C#N)c1 255934835 LIAKWGSOJCAQAP-UHFFFAOYSA-N 377.447 5.263 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1N1CCCCCC1 303270466 GDFBRHCRHXQDDI-UHFFFAOYSA-N 390.531 5.383 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 303336200 XOGDJLMYNVCMLE-IAGOWNOFSA-N 396.556 5.642 30 20 GKED C[C@H]1[C@H](c2ccccc2)C[C@@H](C)N1C(=O)c1cn(CCCC#N)c2ccccc12 426954937 GWCATWSDJREEKT-XQBPLPMBSA-N 385.511 5.352 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cn1 429354638 DCQZUQAPJPOEKH-HNNXBMFYSA-N 387.443 5.162 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)c1 429824162 VYDFJEIAOOLQIM-UHFFFAOYSA-N 378.428 5.486 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 432982764 DAYSELWPMWZLBL-FQEVSTJZSA-N 377.488 5.472 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCS1 433236724 RRGZLYYYHPRBHS-UHFFFAOYSA-N 381.501 5.100 30 20 GKED Cc1ccsc1-c1nnc(SCC#Cc2ccc(OC(F)(F)F)cc2)o1 433370132 CRXNCSCCIQRMBN-UHFFFAOYSA-N 396.415 5.149 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCCC[C@H]2c2cccc(Cl)c2)c1 436464613 FPVFLFPWWGGZMK-QFIPXVFZSA-N 396.918 5.515 30 20 GKED Cc1cc(Br)ccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 437567503 LWWPYIGEQBQKSB-HKUYNNGSSA-N 398.304 5.061 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)cc1Cl 439121961 HQBKXUKCZQOOBM-UHFFFAOYSA-N 380.797 5.437 30 20 GKED C=CCn1c(SCc2nccs2)nc2sc(-c3ccccc3)cc2c1=O 446954105 KLWFWKSNIONBBZ-UHFFFAOYSA-N 397.550 5.060 30 20 GKED Cc1nc(CC(C)C)c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)s1 447170555 VQPGLTUCOFBOKY-LBPRGKRZSA-N 389.933 5.403 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N(C)CC(C)(C)C#N 455137086 LAOJAJGQFHEJOW-UHFFFAOYSA-N 396.491 5.424 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455695974 BQSZXXDQLUSKIM-GFCCVEGCSA-N 395.812 5.650 30 20 GKED N#CCCC[C@@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)c1ccccc1 458477206 OVOKQNRJTSNQNW-HXUWFJFHSA-N 394.906 5.098 30 20 GKED N#CCCCC(=O)Nc1ccc(Oc2ccc(F)cc2)c(Br)c1 462413838 CFLCMKPWQVPHSM-UHFFFAOYSA-N 377.213 5.013 30 20 GKED C[C@H](C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 462543562 AKYDUZXGMCADSG-BOUXLOLZSA-N 386.417 5.133 30 20 GKED N#CCCSc1ccccc1NC(=O)c1c(F)cc(C(F)(F)F)cc1F 463954415 YMRRZIRUNNBZNX-UHFFFAOYSA-N 386.345 5.242 30 20 GKED CCC(C)(C)c1ccc(S(=O)(=O)Nc2ccccc2SCCC#N)cc1 467073427 GMWHBYQQJNMJLY-UHFFFAOYSA-N 388.558 5.181 30 20 GKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467690467 FWEZNMBEZFEMTO-DNVCBOLYSA-N 397.906 5.443 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471410381 XZDPABGAKGGTAM-UHFFFAOYSA-N 375.859 5.543 30 20 GKED COc1ccc(CN[C@H](C)c2cc3cccc(F)c3o2)cc1OCCCC#N 473980623 AOSAMIOQEBJVKD-OAHLLOKOSA-N 382.435 5.114 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)C[C@H](CC#N)c1ccccc1 475366053 GFFMWWKZSYRXKW-UGKGYDQZSA-N 388.536 5.925 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 476121306 GHOBVZOYTFCTHP-OALUTQOASA-N 387.445 6.300 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)ccc1F 481592254 APSHDKBXPUNBMB-KRWDZBQOSA-N 378.234 5.373 30 20 GKED N#Cc1cc2c(nc1SCc1coc(-c3ccc(F)c(F)c3)n1)CCCC2 483061218 OURMWCMTMHDMPZ-UHFFFAOYSA-N 383.423 5.058 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cccc(C#N)c1 493563395 KRDCKBLXYLJKSX-CYBMUJFWSA-N 397.887 5.127 30 20 GKED C=CCC[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(C(F)(F)F)cc1 499609904 ZBSZJYHZVKDXCE-LJQANCHMSA-N 380.454 5.403 30 20 GKED CC(C)c1ccc(-c2nn(-c3ccccc3)cc2C(=O)NCCCCC#N)cc1 505091689 AMTXPUSCMSOKPP-UHFFFAOYSA-N 386.499 5.086 30 20 GKED CC1(C#N)CCN(C(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)CC1 507828938 UXODGJPKYSTSPV-LJQANCHMSA-N 384.932 5.326 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccc(C(F)(F)F)cn2)n1 511997523 ADASEYFTAABQTI-GFCCVEGCSA-N 391.246 5.228 30 20 GKED Cc1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 518013943 SCRWPZNXCWYSGQ-SFHVURJKSA-N 385.467 5.407 30 20 GKED CC[C@@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 518133510 MSWPFKZJOUDRBJ-VQIMIIECSA-N 384.570 5.761 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)Cc1ccccc1-2 518239476 GGRDSGPGSOPZRP-INIZCTEOSA-N 384.504 5.904 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C)C(=O)N(C)c1ccccc1 518743937 QVKGGHYBNVMKSD-GOSISDBHSA-N 385.467 5.122 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccccc1SCCC#N 523087181 SPLQDJMAWARGCR-CQSZACIVSA-N 392.446 5.528 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(-c2ccc(Cl)cc2)nn1 530401887 WVMNFCDNFYTPPD-UHFFFAOYSA-N 380.879 5.025 30 20 GKED C=CCC[C@H](NC(=O)Nc1cnn(CC(C)C)c1C(F)F)c1ccccc1 534824707 JTYRXEGKYNUYLZ-INIZCTEOSA-N 376.451 5.306 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(Br)ccc2F)c(C#N)s1 535254966 VKIAYOKZZVRCEH-UHFFFAOYSA-N 381.270 5.071 30 20 GKED C[C@H](Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1cccc(C#N)c1 537531495 QFOBUAQSZJFXAV-IBGZPJMESA-N 395.506 5.253 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)CC1 540296486 SHKZYUCAWQDNTL-JXOAUVRXSA-N 398.909 5.303 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)nc1)c1nc2cc(Cl)ccc2s1 542876737 GAVYSHKCZGAALX-OAHLLOKOSA-N 397.887 5.156 30 20 GKED N#CCCN(C(=O)c1cc2c(s1)-c1ccccc1CC2)c1ccc(F)cc1 551816432 KPJORPWLVOHBGP-UHFFFAOYSA-N 376.456 5.213 30 20 GKED N#Cc1ccc(N2CCC(N[C@@H](c3ccc(F)cc3)c3cccs3)CC2)cc1 552227973 ISJYQAROXAFUME-QHCPKHFHSA-N 391.515 5.107 30 20 GKED COc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2ccc(C)cc2)cc1 556338906 ULPGJDSSXFYVOL-MRXNPFEDSA-N 378.501 5.036 30 20 GKED N#CCC[C@@H](C#N)CNc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 558506736 LOHKAKPGKLCTAH-LBPRGKRZSA-N 378.234 5.780 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H]2CCc3ccc(C#N)cc32)cc1 562095869 LYJXTKDRRPLYIJ-DQEYMECFSA-N 386.470 5.267 30 20 GKED CC(C)(C(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1cc(F)cc(C#N)c1 564040903 PHEWGDJIMOLQML-UHFFFAOYSA-N 384.760 5.286 30 20 GKED CC1CCN(CCC[C@H](NCC2CCC(C#N)CC2)c2ccc(F)cc2)CC1 565143471 WJWIJOBKVNAPLG-VUNKPPBISA-N 385.571 5.298 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N2CCC(CCC#N)CC2)cc1OCC 565306904 IAUYUKQSZVEECX-UHFFFAOYSA-N 392.927 5.074 30 20 GKED CC(C)c1ccc(CSc2nnc(SCc3ccc(C#N)cn3)s2)cc1 570349448 RDWWPIYHNFWNNK-UHFFFAOYSA-N 398.582 5.513 30 20 GKED N#C[C@@H](Sc1nnc(COc2ccccc2Cl)n1C1CC1)c1ccccc1 580843905 ITLMMBXFKMVOBD-GOSISDBHSA-N 396.903 5.202 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cc2)ccn1 583234647 QQZHQQANAAEJKU-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#CC1(CC(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)CC1 590181150 QDFQUFSJAMAAKE-UHFFFAOYSA-N 378.325 5.269 30 20 GKED COCc1c(C(=O)N(c2ccc(C#N)cc2)C2CCC2)sc2cccc(F)c12 598886292 YDFDHOCIGUPOAV-UHFFFAOYSA-N 394.471 5.258 30 20 GKED N#CCCCCCC(=O)N1CCC[C@]1(c1c[nH]c2ccccc12)C(F)(F)F 598887905 CSGAFNWPSCHUJJ-IBGZPJMESA-N 377.410 5.022 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1[C@H]2c3ccc(Cl)cc3C[C@H]21 599390122 FLUOAFKUYUBFNS-WWIODWGFSA-N 382.916 5.116 30 20 GKED Cc1ccnc2sc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c(C)c12 603564572 OUQJBNQNYMSLEA-SNVBAGLBSA-N 381.526 5.223 30 20 GKED Cc1csc(Sc2ccc(NC(=O)CCc3ccc(C#N)cc3)cc2)n1 604117427 OBZDSQIFGCJOQP-UHFFFAOYSA-N 379.510 5.046 30 20 GKED CCc1c(C)sc(NC(=O)c2sc3cccc(F)c3c2COC)c1C#N 609032843 IZEVQHGFJBKFBY-UHFFFAOYSA-N 388.489 5.243 30 20 GKED COc1ccc(-c2noc(CNc3cccc(Oc4ccc(C#N)cc4)c3)n2)cc1 609221239 MZYBXCKLIPNHEC-UHFFFAOYSA-N 398.422 5.021 30 20 GKED Cc1ccc(COc2c(C)cc(CN(C)C(=O)NCCCCC#N)cc2C)cc1 609685906 ABJUYRQKHQIODI-UHFFFAOYSA-N 393.531 5.026 30 20 GKED CC(C)n1ncc2cc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)ccc21 609764440 YAPVTOKLRCWDSW-UHFFFAOYSA-N 396.450 5.533 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2oc(C(C)C)nc2c1 609810464 RNQQMGYRTWTRLJ-UHFFFAOYSA-N 394.431 5.080 30 20 GKED CCCOc1ccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1OCCC 610317781 XIBUQHFJTKIONQ-MRXNPFEDSA-N 381.476 5.019 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N[C@H](C)c1cccc(C#N)c1 610361023 NQVHOBGTMSHWPV-GFCCVEGCSA-N 381.888 5.135 30 20 GKED CC(C)N1CCC(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 610422269 LYMYJGKUROYKKL-OAQYLSRUSA-N 395.934 5.054 30 20 GKED Cn1c([C@@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccccc2)nc2ccccc21 611392629 ZSILOISMWMNZAU-RDGATRHJSA-N 392.506 5.202 30 20 GKED O=C(C[C@]12CCCC[C@H]1C2(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 619129971 VMOKSLXNKMQXNA-DGCLKSJQSA-N 395.334 5.372 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cccc(COCc2ccco2)c1 619508219 SLDCHWVLDWAZKK-VWLOTQADSA-N 386.495 5.425 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1Cl 619755560 ZRHBYFRQBBUQPX-OAQYLSRUSA-N 398.840 5.692 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619769251 KNOQTFRUWFQJLG-NSHDSACASA-N 396.705 5.421 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)NCc1ccc(C#N)c(Cl)c1 619770271 OEFHVULRPDQLGG-UHFFFAOYSA-N 389.886 5.220 30 20 GKED C=CC[C@H]1CCCN(Cc2nc3ccccc3c(-c3ccccc3)c2C(=O)O)C1 656759408 FQQZUEDUVAQDEI-SFHVURJKSA-N 386.495 5.388 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 683634654 DOUDDELNYBAIND-JTQLQIEISA-N 394.718 5.113 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(Cn2ccc(-c3ccc(C#N)cc3)n2)CC1 725771408 VCMMRIMKMFLHDZ-UHFFFAOYSA-N 395.510 5.049 30 20 GKED C=CCOc1ccc([C@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)cc1Cl 727463276 HFMOTTFZTAMODK-KRWDZBQOSA-N 396.796 5.034 30 20 GKED C#Cc1cccc(N(C(=O)CSCc2cc(-c3cccs3)on2)C(C)C)c1 728246794 IGOGNVGHWHDEMB-UHFFFAOYSA-N 396.537 5.059 30 20 GKED CCn1c(/C(Cl)=C/c2cccc(OCCCC#N)c2)nc2c(F)cccc21 728438756 NCTMRUIPDBMEQH-VKAVYKQESA-N 383.854 5.615 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c1 728482019 BSIJPIHVYRDQNW-UHFFFAOYSA-N 378.431 5.267 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1ccc(Cl)cc1Cl 730953352 VTPDJGIBJKYZDN-UHFFFAOYSA-N 382.341 5.808 30 20 GKED COc1cc(C(=O)/C=C/c2cc(Cl)ccc2[N+](=O)[O-])ccc1SC(F)F 739424394 IZPWCLZNVGBHGO-QHHAFSJGSA-N 399.802 5.468 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@@H](C)C[C@H]2c2ccccc2F)c1=S 743374232 PGXSQLOKTIWBPF-YJBOKZPZSA-N 398.507 5.040 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)ON=Cc1cccc(Cl)c1Cl 749512243 REDZZHHBWFUUDX-CYBMUJFWSA-N 379.287 5.495 30 20 GKED CCc1cccc(CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 752476601 VDLFXABMBBFIKO-HNNXBMFYSA-N 388.414 5.296 30 20 GKED C#Cc1cccc(NC(=S)N(C)[C@@H](c2ccc(Cl)cc2)C(F)(F)F)c1 758446282 FEJSPPDFJGIIAH-INIZCTEOSA-N 382.838 5.254 30 20 GKED Cc1nc([C@H](C)OC(=O)Cc2cccc(C#N)c2)oc1-c1ccc(Cl)cc1 763991431 NNIAZQKULLOKLP-AWEZNQCLSA-N 380.831 5.022 30 20 GKED FC1(F)CCC(C2=NNC(=Nc3ccccc3C(F)(F)F)SC2)CC1 766284487 VCVKHRYAMFKAAB-UHFFFAOYSA-N 377.382 5.211 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@H](c2cccc(Cl)c2)c2ccccn2)cc1 766598337 GMOAKFFVWDUGEL-UZUQRXQVSA-N 376.887 5.187 30 20 GKED CC(C)OC(=O)NCc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 770430452 VYWZFCCHGDGWIG-UHFFFAOYSA-N 391.515 5.137 30 20 GKED Cc1cc(C(=O)Nc2ccc(C#N)c(Cl)c2)ccc1NC(=O)OC(C)(C)C 772014098 KHCNCYRBTYQXDD-UHFFFAOYSA-N 385.851 5.119 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc3c(ccc4ccccc43)o2)c1 776165688 UUFMGBZHHNONOM-XLIONFOSSA-N 384.479 6.118 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2F)CCC1)c1nc2cc(F)ccc2s1 777317748 INVOALQRLCNHDC-ZDUSSCGKSA-N 386.398 5.012 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1cc(C(F)(F)F)cnc1Cl 779616231 RTBAGDUZUMXWOR-UHFFFAOYSA-N 386.654 5.164 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CCCCC1 780160988 SZZBTGBPRYQLDI-INIZCTEOSA-N 382.891 5.471 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)nc1 782035773 AAXIWOLPULLETJ-UHFFFAOYSA-N 394.887 5.080 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3ccc(Cl)cn3)cc2Cl)cc1 785927553 ZZBQQNNTPKJAAX-UHFFFAOYSA-N 398.249 5.234 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1Cl 789156776 DJPPHMDYHRSPNS-SNAWJCMRSA-N 384.888 5.542 30 20 GKED Cc1nc(CCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)oc1-c1ccccc1 797570414 GUAMDVRTWVAGPZ-MRXNPFEDSA-N 393.512 5.213 30 20 GKED CC(C)(C)c1ccc(SCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813215889 LUQWVZXLRCIIJG-INIZCTEOSA-N 392.446 5.366 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cc(Cl)ncc3Cl)c2C#N)[C@@H](C)C1 839389344 OJRYSGHKGYBDNO-IUCAKERBSA-N 380.300 5.260 30 20 GKED C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942833 NYVRASDTEVUFLS-SHQCLWGWSA-N 392.402 5.199 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccc(Br)cn1 853302339 XGYRDJQOAHWBKW-UHFFFAOYSA-N 392.141 5.297 30 20 GKED N#Cc1c(NC(=O)/C=C/c2nc3ccccc3s2)sc2c1CCCCC2 878073984 XZOJIBXFNAABAP-ZHACJKMWSA-N 379.510 5.150 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2cccc(Cl)c2Cl)cc1 916546043 CHSHEWLCXZKRSX-UHFFFAOYSA-N 397.718 5.413 30 20 GKED CCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776112638 FBLJSPKJVBCJOU-XFXZXTDPSA-N 376.408 5.199 30 20 GKED C=CCOc1ccc(CNC[C@H](CC(=O)O)C2CCCCCC2)cc1Cl 1776184046 OANLRKYBDKKRCU-SFHVURJKSA-N 379.928 5.056 30 20 GKED C=CCOc1ccc(CNc2cccc(C(=O)O)c2OC(C)C)cc1Cl 1776184547 DFALVADNTDMPFQ-UHFFFAOYSA-N 375.852 5.002 30 20 GKED C[C@@H]1C/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2sccc21 1776589750 UKYGRVJNLIEEEU-RVZJCZPVSA-N 388.488 5.816 30 20 GKED CCCCCCCOc1cccc(CNCc2cc(C(=O)O)sc2C)c1 1776787684 QHMDMXCMZZCXCR-UHFFFAOYSA-N 375.534 5.394 30 20 GKED C[C@@H]1/C(=C/c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1777407879 KCVFTCOYLXGNRH-ZGWJWYQGSA-N 384.431 5.347 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCSc2ccc(F)cc21 28319593 TWKQYCARVOTCRJ-NRFANRHFSA-N 388.467 5.331 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 48372935 JNXSIEWKUNAXOB-KRWDZBQOSA-N 398.466 5.002 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)c(Cl)c2)nnc1-c1ccoc1C 59928202 FSTFKJKWUWLORX-LBPRGKRZSA-N 377.872 5.678 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCC(C)(C)c1ccccc1OC 63408595 KUTAQLNMZJMNHM-UHFFFAOYSA-N 392.952 5.086 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CSc3ccccc3C)n2)cc1 66543909 BGAAAAKSWGCTLV-QGZVFWFLSA-N 394.521 5.096 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccccc1F 111180672 WYXIMOIBLWIQAK-OAHLLOKOSA-N 393.468 5.159 30 20 GKED Cc1ccc(Br)cc1NC(=O)Nc1cccc(OCCCC#N)c1 113545663 PGNKEDHFIBPRIQ-UHFFFAOYSA-N 388.265 5.084 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](Nc2ccccc2)C1 151062043 QDLQYGJTYFWEKR-MJGOQNOKSA-N 394.544 5.189 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 152889132 IPPIWGIPVZFFRP-AWEZNQCLSA-N 375.428 5.088 30 20 GKED CC(=O)N(c1nc(CSc2ccccc2C#N)cs1)c1cccc(C)c1C 172680365 VHBJVGGYTUWMDT-UHFFFAOYSA-N 393.537 5.609 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc(OC)c2)nnc1-c1ccccc1OC 175237009 YRSLALLISCRBCS-HNNXBMFYSA-N 381.501 5.002 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cccc(C(F)(F)F)c2)ccc1OC 180815408 SPZJGUSVPXNDCF-RDTXWAMCSA-N 392.421 5.246 30 20 GKED Cc1nc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(-c2ccccc2)o1 184778878 SORWIXNIYACGSN-AWEZNQCLSA-N 377.469 5.154 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CCC(=O)OCC)C1 191517498 YRIRDVZDSMEQME-GOSISDBHSA-N 386.536 5.126 30 20 GKED CC(C)/N=C(/O)[C@@H]1CCC[C@H](/N=C(/O)N2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)C1 328735679 ZDNGEQQOLCLOHH-FVTFTPSCSA-N 395.547 5.144 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2ccccc2-c2cccs2)no1 329375802 KYSPTNZYLPHITR-QGZVFWFLSA-N 382.489 5.269 30 20 GKED Cc1sc([C@H](C)NCc2cccc(F)c2C#N)nc1-c1ccc(Cl)cc1 428358653 HSZWDYAOXRRJED-LBPRGKRZSA-N 385.895 5.634 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@@H]3CCCC[C@H]3C2)cc1 429076333 HNTLQZVLZBCDNV-ROUUACIJSA-N 391.471 5.013 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC1(CC#N)CC1 431132997 QHUXFSHJOXRJRW-UHFFFAOYSA-N 392.286 5.025 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC3(CCC3)C[C@H]2C)cc1 433509450 JSTPPDKNAWITMV-MRXNPFEDSA-N 391.471 5.156 30 20 GKED CC1(C)Cc2ccc(Cl)c(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)c2O1 435325355 ZQNIUCVHAPSDMS-UHFFFAOYSA-N 395.890 5.122 30 20 GKED C=C(C)Cn1c(SCc2cccc(Cl)c2Cl)nnc1-c1ccncc1 446050559 CJFRLCQCGLYOFF-UHFFFAOYSA-N 391.327 5.515 30 20 GKED CC(C)(C#N)CCCN(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 451383869 MPJYHZJIQCJXNY-UHFFFAOYSA-N 375.438 5.433 30 20 GKED C[C@H](c1ccc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cc1)C(F)(F)F 453564370 GWIXDSDHVGJAFG-QMTHXVAHSA-N 386.295 5.256 30 20 GKED C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458797050 FSXVSXPHFKKGRV-AGHHOFFYSA-N 379.479 5.148 30 20 GKED Cc1ccc(Br)cc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 461093909 XFCDDZYMDXIUDC-HNNXBMFYSA-N 398.087 5.059 30 20 GKED C[C@H](C(=O)NCc1ccc(Oc2ccccc2F)c(F)c1)c1cccc(C#N)c1 462145133 VFUWNXJIFWJKLD-HNNXBMFYSA-N 392.405 5.049 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 469238885 JZGADKNTFOTVSQ-UHFFFAOYSA-N 396.830 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)c1ccccn1 475577450 DVKFONDRTCRNKV-XMMPIXPASA-N 385.511 5.845 30 20 GKED CC(C)(C#N)CCCSc1nnc(Cc2ccccc2)n1-c1ccccc1 475948806 FVFKCBKCEBWZLK-UHFFFAOYSA-N 376.529 5.280 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)c3ccnc(C#N)c3)c2)cc1 476328591 SACHTXLEBJKATK-GOSISDBHSA-N 399.494 5.241 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc(OC)cc1Cl 476805091 LDRMLTZDCXJPED-UHFFFAOYSA-N 399.918 5.802 30 20 GKED Cc1noc(-c2ccccc2)c1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 481460947 DXILUGVZHVZXRM-UHFFFAOYSA-N 388.471 5.212 30 20 GKED N#C[C@H](C(=O)c1c(-n2cccc2)sc2c1CCC2)c1nccc2ccccc12 483208700 ZMQGLDYZGAKPEJ-SFHVURJKSA-N 383.476 5.066 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1C 486239545 LIVXXXKWHOSFLA-MRXNPFEDSA-N 382.529 5.054 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(-c2ccc(Cl)cc2)no1 487386756 BVZBAXHRKTTXIX-CQSZACIVSA-N 383.904 5.859 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cc(Cl)ccc1OC[C@@H]1CCOC1 488204033 VADIXCBEVHEKGT-MRXNPFEDSA-N 384.907 5.169 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(-c2ccco2)on1 500740975 XBCBVEXVXHLNFN-UHFFFAOYSA-N 385.379 5.159 30 20 GKED N#Cc1c(SCc2cc(-c3ccco3)on2)nc2c(c1-c1ccco1)CCC2 501531995 FKJPVUQNBARFAI-UHFFFAOYSA-N 389.436 5.242 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccccc1 505979849 WCPBECXQOORDDO-SFHVURJKSA-N 388.433 5.253 30 20 GKED N#Cc1ccsc1NC(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1 509563715 KGIYAKBABKTPLB-IBGZPJMESA-N 398.940 5.734 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@H](C)Oc1ccccc1C#N 516230288 GBBRTSDJZYTWAM-KRWDZBQOSA-N 388.492 5.424 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@@H](c4ccccc4)C3)c2)cc1 520603687 WHNYPQUBUZEDHJ-HXUWFJFHSA-N 383.451 5.372 30 20 GKED CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1ccccc1SC[C@H](C)C#N 520855694 XULAJYIBTPNTBP-QAPCUYQASA-N 395.528 5.146 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(OC(F)(F)F)cc1 521729091 ABBULETWKSWOKW-CYBMUJFWSA-N 394.418 5.018 30 20 GKED N#Cc1ccc(Cl)cc1NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 522936257 SGMSNMYLPNORLK-UHFFFAOYSA-N 398.897 5.736 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2ncccc2c1 524388977 IAXXNMKLENYEAF-UHFFFAOYSA-N 393.446 5.246 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Sc2ccc(C#N)cc2Cl)c(Cl)c1 533177352 IPZSIZFIGDSVCS-GFCCVEGCSA-N 379.312 5.601 30 20 GKED C[C@@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@@H](CCC#N)c1ccccc1 536838886 LPPGVONVUNDXJO-KXBFYZLASA-N 389.421 5.057 30 20 GKED C=CCC[C@@H](N[C@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 536839492 MSOHUUIIJFYVAC-VQIMIIECSA-N 390.449 5.720 30 20 GKED CS[C@H](C)CCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 538034733 NASWFXUZMPNDNX-LLVKDONJSA-N 376.469 5.181 30 20 GKED Cn1ncc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1-c1ccccc1 540392665 KZWUMDIUYULEAB-UHFFFAOYSA-N 394.434 5.003 30 20 GKED C[C@H](NC(=O)c1c(F)cc(F)cc1F)c1ccc(-c2cccc(C#N)c2)cc1 541130446 DCKJXLXLTBTNFD-ZDUSSCGKSA-N 380.369 5.134 30 20 GKED CSCC[C@H](C)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542084970 IDKBMPQZEHORHC-DLBZAZTESA-N 381.545 5.069 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 543776935 HMXFEZLPGDTTJE-QVKFZJNVSA-N 390.449 6.022 30 20 GKED CCCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)CC1CCCCC1 557554277 RZVRKQIJEGYVIB-GOSISDBHSA-N 387.593 5.312 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(Cl)cc(F)c1Br)c1ccccc1 568115487 JOSWEDKELPNVIR-OAHLLOKOSA-N 395.659 5.016 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 571833508 XFDHLICUQIRFJX-UHFFFAOYSA-N 392.396 5.571 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2C2CC2)cc1F 576077493 RJMAYEMLTHFPRB-NRFANRHFSA-N 391.446 5.286 30 20 GKED Cc1c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)sc2ccc(C#N)cc12 576305204 RLMNDGMEKJZSLG-QGZVFWFLSA-N 387.508 5.101 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CC[C@H](c2ccccc2)O1 584805250 YUWVDKLQRPZKKA-YVWKXTFCSA-N 395.528 5.123 30 20 GKED Cc1sc([C@H](C)NC(=O)CCCCCC#N)nc1-c1ccc(Cl)cc1 588161488 OEGKAVQQYHOJOW-ZDUSSCGKSA-N 375.925 5.423 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F 590327715 JXYFQZLAQVVPJF-UHFFFAOYSA-N 382.357 5.073 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)c(C(F)(F)F)c1 596710729 FCQFRAGCFSFISW-KGLIPLIRSA-N 399.482 5.754 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)CC2(C#N)CCOCC2)cc1 597363546 YCMLFPNVCTUOIX-KRWDZBQOSA-N 380.513 5.189 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc(-c4ccccc4Cl)on3)c2C#N)C1 603587661 OWZGINGCJKMPAU-LLVKDONJSA-N 397.887 5.305 30 20 GKED CCOc1cccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 604182030 QVUKSLKGVHMZNI-UHFFFAOYSA-N 388.492 5.502 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1sc2cccc(Cl)c2c1Cl 604511355 COUQCNTXOPSRLV-UHFFFAOYSA-N 377.252 5.341 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(Cl)cc2C)cc1C 608874718 GRBGFWDISUFCDI-UHFFFAOYSA-N 392.890 5.295 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCCCC[C@H]2c2ccccc2)c1 609501459 RBXPQCLITKTGSP-QHCPKHFHSA-N 376.500 5.251 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2cc(F)ccc2[C@H]1C 610019311 LWKLLRJLCSDVNE-HUUCEWRRSA-N 383.492 5.229 30 20 GKED CC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccc(F)cc1F 610026886 MQUOCYZNOYNORP-NRFANRHFSA-N 385.458 5.155 30 20 GKED N#CCCCCNC(=O)N[C@H](c1ccc(Cl)cc1)c1ccccc1Cl 610139136 QWBVLQYQNOBCJN-GOSISDBHSA-N 376.287 5.076 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cc1 610184197 YIHPLHKKFQLECU-UHFFFAOYSA-N 390.439 5.160 30 20 GKED CC(C)OC1CCC(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CC1 611051921 PXDZZSLPCNXPSD-UHFFFAOYSA-N 394.540 5.175 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@H]3CCCc4cc(C#N)ccc43)c2)cc1 611390917 KTEMSJPKDLYNBH-VWLOTQADSA-N 395.506 5.286 30 20 GKED N#C[C@@H](C(=O)c1cccc(Br)c1)c1nc2cc(Cl)ccc2s1 613407046 FISGAGXTFCATQQ-LBPRGKRZSA-N 391.677 5.202 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 619479087 KQGPDJLYMUTVDO-AWEZNQCLSA-N 382.332 5.367 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619768113 IVDOWXOGHQXAPI-KGLIPLIRSA-N 390.314 5.199 30 20 GKED Cc1ccc(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 642399855 JGHPCJSQGOQSSZ-IAZYJMLFSA-N 386.311 5.165 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccc(F)c(F)c1 681374631 CUUKVJRIQAMONK-HXUWFJFHSA-N 397.425 5.676 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2cc(C)c(-c3ccc(F)cc3)s2)c1 726733229 SPBZSCFLECONTB-GOSISDBHSA-N 392.455 5.132 30 20 GKED N#CCOc1cccc(NC(=O)N(Cc2c(Cl)cccc2Cl)C2CC2)c1 728737850 ULKDZEPYMVNPGH-UHFFFAOYSA-N 390.270 5.092 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1ccc(Cl)nc1 729244541 ANNZDWMCUOGOKS-UHFFFAOYSA-N 382.250 5.107 30 20 GKED COc1ccc(/C=C2\CCOc3cc(C)c(C)cc3C2=O)cc1OCCCC#N 733748877 MEWHCCHPRBXQIQ-XMHGGMMESA-N 391.467 5.043 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\CCc1nc(-c2cccc(Cl)c2)no1 734095827 HKDOGDQFJGGIED-NKVSQWTQSA-N 396.661 5.064 30 20 GKED CCCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](CC)c1ccccc1 734097668 ARUQGGCPAXIASG-HXUWFJFHSA-N 385.964 6.162 30 20 GKED CCCN(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 735911892 WIFBOLKFAHVNMM-INIZCTEOSA-N 383.904 5.286 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 740538700 IZPZKBLGXJXNEU-DZGCQCFKSA-N 382.435 5.377 30 20 GKED Cc1ccc2cccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2n1 741179122 ZYROMCORNFCEKV-QHCPKHFHSA-N 377.447 5.451 30 20 GKED COCc1ccc(/C=C2\CCc3nc(-c4ccc(OC)cc4)sc3C2=O)cc1 741843308 ZJHXSHFKADWFRI-QGOAFFKASA-N 391.492 5.178 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C/c1cc(Cl)ccc1OC1CCCC1 742430597 ANMFKMHHVLVASX-LDADJPATSA-N 390.936 5.164 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC3(CCCC3)C2)cc1 743135452 WKUHFLSELNZPBO-UHFFFAOYSA-N 391.471 5.157 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3c(C(C)C)nn(C)c3Cl)n2)cc1 744030392 ANBIHGVLYWBQSD-CQSZACIVSA-N 398.919 5.119 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCC[C@H]2[C@H](CC)c2ccccc2)c1=S 746713098 RMTDBOWKOXLSAS-UXHICEINSA-N 382.577 5.093 30 20 GKED C[C@@H](OC(=O)/C=C\c1ccccc1C#N)c1ncc(-c2ccc(Cl)cc2)o1 751656637 CPXFMDWHJBJNDE-KOTGUFOOSA-N 378.815 5.184 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3c(F)cccc3C2)cc1 757875954 AJBDXFYMAJQYIY-UHFFFAOYSA-N 387.414 5.080 30 20 GKED C#CCCCCCC(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 780322346 LVUDMSQQIZKXFT-QFIPXVFZSA-N 388.511 5.008 30 20 GKED Cc1[nH]c2ccc(F)cc2c1C=Nn1cnnc1SCc1ccc(Cl)cc1 782222834 DZGBJMOACBDSIK-UHFFFAOYSA-N 399.882 5.035 30 20 GKED O=C(/C=C/c1ccc(C(F)F)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 794942398 MMPDGGSQIBJXIM-VGOFMYFVSA-N 390.451 5.237 30 20 GKED N#CC1(CCCSc2nc3cc(C(F)(F)F)ccc3s2)CCOCC1 798367570 DSFXGIUKMPHPSD-UHFFFAOYSA-N 386.464 5.508 30 20 GKED Cc1cccnc1[C@H]1CCCC(=NNc2nc(C(F)(F)F)nc3ccccc23)C1 799106282 ARBCHXMGZGHQRY-AWEZNQCLSA-N 399.420 5.478 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2nc(CC(C)C)no2)cc1C#N 799346390 BIZMBGKWJQBWNX-UHFFFAOYSA-N 394.862 5.021 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)C(F)(F)c1ccc(F)cc1 800355869 NFUZLVUGTVDTJF-UHFFFAOYSA-N 395.274 5.027 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433790 SEEBIWXMNOBBON-RDTXWAMCSA-N 375.394 5.052 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1nc(Cl)ccc1Cl 914515624 YHTXXHSOAWUWAM-UHFFFAOYSA-N 382.250 5.107 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCOc2cccc(C)c2)cc1 916956011 WSLUROKUMJJCKC-XMSQKQJNSA-N 392.499 5.015 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917041247 ROSKDZQOKSGGSB-RTGRKSDTSA-N 393.437 5.619 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1ccc(Oc2ccc(F)cc2)cc1Cl 1776012603 GANVTNPDKZMCNX-UHFFFAOYSA-N 398.821 5.806 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)cc1 1776125836 UCWFFVXWTVTMHR-RIYZIHGNSA-N 384.447 5.769 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2c(OC(C)C)ccc3ccccc23)CC1 1776177604 RXLIPNHQVGEFQL-UHFFFAOYSA-N 381.516 5.260 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@H](CC(=O)O)c2cccc(F)c2)cc1 1776785908 QPWXTBLDWORAKR-JOCHJYFZSA-N 399.506 5.675 30 20 GKED CCCCCCCOc1ccc(CN[C@@](C)(Cc2ccccc2)C(=O)O)cc1 1776788025 MDRCAAYTPBLOMK-DEOSSOPVSA-N 383.532 5.211 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3cccc(C(F)(F)F)c3)o2)c1 1777686113 LLGUNHSXZDHIDK-CLFYSBASSA-N 386.325 5.560 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C34CC(F)(C3)C4)CCC2)cc1 1785840800 HFIKASODRPXAMW-UHFFFAOYSA-N 398.522 5.005 30 20 GKED C=CCC(CC=C)C(=O)NC1(c2ccc(NC(=O)c3occc3C)cc2)CCC1 1788689530 OUJGRJFGMKLJND-UHFFFAOYSA-N 392.499 5.104 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3c(s2)-c2ccccc2OC3)c1 55568116 VNNASIMXIQSQBA-UHFFFAOYSA-N 390.464 5.242 30 20 GKED C=CCN(Cc1coc(-c2ccc(Br)cc2)n1)Cc1cccs1 64507905 NIDNHELFYFMHOV-UHFFFAOYSA-N 389.318 5.354 30 20 GKED CCc1nc(C)c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)s1 64895843 FDVQHGVGDCUXCZ-LBPRGKRZSA-N 387.574 5.350 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1nc(Cl)ccc1Cl 72025279 IMWUQJPBJAKIOB-UHFFFAOYSA-N 398.249 5.613 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CC1 108532800 GJHYXJJNTMYJBR-OAHLLOKOSA-N 383.492 5.274 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4ccccc4s3)n2)cc1 108978589 VMSBVQHFFLYGLC-INIZCTEOSA-N 390.489 5.523 30 20 GKED CSc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)nc1 116240427 DTESIBLXCREELW-UHFFFAOYSA-N 377.494 5.079 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccc(O[C@H](C)C#N)cc1 124716560 VAEJCJJMERCFBG-XMSQKQJNSA-N 376.525 5.421 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H](C)c1c(C)noc1C 132942653 RKMIZRZMFRMLCT-HNNXBMFYSA-N 389.455 5.396 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)s2)c(C)c1 146873328 IVKRMCUEGKQNMG-GOSISDBHSA-N 383.476 5.465 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@@H](C)C[C@H]1c1ccco1 174043724 BCWFGVHAWYRINB-AOIWGVFYSA-N 397.544 5.086 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 178987535 REMJTSRRRHJUIO-SAAWKEMMSA-N 385.801 5.365 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1cccc(C#N)c1 190891183 UQHRHNOEBYVHKF-HZPDHXFCSA-N 395.553 5.385 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 217227248 ILHBCGCNAWGYDD-MSOLQXFVSA-N 381.545 5.913 30 20 GKED N#Cc1ccc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc1 255948965 DHSWEAKWYGISDD-UHFFFAOYSA-N 398.491 5.294 30 20 GKED O/C(=N/Cc1ccccc1)C1CCN(/C(O)=N\[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1 328877450 TZWMPTUTEGEJDV-KSEOMHKRSA-N 397.563 5.128 30 20 GKED Cc1sc2nc(CC/C(O)=N/[C@@H]3CCCCC34CCCC4)nc(O)c2c1C 329624167 OEBMWTJGWRFRSF-OAHLLOKOSA-N 387.549 5.406 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc(Br)c3ccccc23)c(F)c1 392668612 GFVHZYLIOKGQDS-UHFFFAOYSA-N 387.183 5.004 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N[C@@H]1CC[C@H](C#N)C1 425672836 WZJNSYNIVXNLRU-XJKSGUPXSA-N 394.475 5.225 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCCCC(=O)c1ccc(F)cc1 426611115 IEIORTZSUDEEHH-UHFFFAOYSA-N 393.911 5.499 30 20 GKED N#C[C@H]1CC[C@H](Sc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)C1 430152720 XGVIBCYAQCZLAV-IRXDYDNUSA-N 394.931 5.431 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc(Cc3ccc(F)cc3)n2)s1 430618033 QRGCVJCNUBZHSE-CQSZACIVSA-N 399.516 5.117 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccccc1 431719468 RAIHPRDNQSDSFF-OAQYLSRUSA-N 399.498 5.306 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1 432095636 QMKKWQLXHOPTLC-AYBZRNKSSA-N 397.519 5.535 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(SCC#N)c3)n2)cc1 432217091 DKTSAJPTCCSDHD-SFHVURJKSA-N 389.505 5.224 30 20 GKED N#CCCC[C@H](NCc1csc(COc2ccc(F)cc2)n1)c1ccccc1 433020832 UPDWLSRZAWWLPA-NRFANRHFSA-N 395.503 5.386 30 20 GKED CC(C)(c1ccc(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1)C(F)(F)F 433842533 PIYQYBKSPDUEDA-UHFFFAOYSA-N 398.428 5.328 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(-c2ccco2)nn1C(C)C 433902368 WYNMYGIRYBSDAS-UHFFFAOYSA-N 382.439 5.083 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccc(F)cc1C#N 433967227 CKPGAEZPFGTYRP-UHFFFAOYSA-N 395.437 5.402 30 20 GKED N#CCCN(C(=O)C1CCC(C(F)(F)F)CC1)C12CC3CC(CC(C3)C1)C2 436023222 DLKQLGFEBWGZHN-UHFFFAOYSA-N 382.470 5.066 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2cccc(Br)c2)o1 436139168 ZTJJWJTWSAXKPV-UHFFFAOYSA-N 380.311 5.311 30 20 GKED FC(F)n1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)n1 436401644 QQGYGIDVNSACAS-GFCCVEGCSA-N 387.274 5.080 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 437846960 LRBODPGBWXSKRC-BULFRSBZSA-N 377.488 5.168 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC1CCCCC1)c1ccc(C(F)(F)F)cn1 442613596 CVNFHQZWKYEREE-KRWDZBQOSA-N 388.389 5.302 30 20 GKED CC1(C)CN(C(=O)c2cn(CCCC#N)c3ccccc23)C[C@@H]1c1ccccc1 444270532 VITLSJGBKFXZHB-JOCHJYFZSA-N 385.511 5.211 30 20 GKED Cc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 444911379 ZGYBNJDQZYLXCO-ROUUACIJSA-N 381.545 5.484 30 20 GKED C=CCC[C@@H](NC(=O)NCc1cnc(C2CC2)o1)c1ccc(C(F)(F)F)cc1 454707611 LJDXLNBUBBXZCK-QGZVFWFLSA-N 393.409 5.078 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458801411 MZTOPHIBCHVCJA-JOCHJYFZSA-N 379.504 5.050 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)[C@H](C)c2cccc(C#N)c2)cc1 462148208 ZHJLKEYBZJJPSD-QZTJIDSGSA-N 384.479 5.215 30 20 GKED C[C@@H](C(=O)N(Cc1ccccc1C(F)(F)F)CC1CC1)c1cccc(C#N)c1 462446368 PXBQEWWCDPEGLC-OAHLLOKOSA-N 386.417 5.119 30 20 GKED Cc1ccc(-c2cncc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c2)cc1 466350534 TXMVKYYTPKWYIR-KRWDZBQOSA-N 387.508 5.561 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1nc2ccccc2[nH]1 475036142 XGAYENPXPDJBDM-ZDUSSCGKSA-N 395.340 5.332 30 20 GKED C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)C[C@@H](CC#N)c1ccccc1 476305195 JYHKIVYCDLFLAP-GOEBONIOSA-N 387.310 5.527 30 20 GKED C=CCn1c(SCc2cc(C#N)ccc2F)nnc1-c1cccc(Cl)c1 481367626 HFSDSBKWRRNQMY-UHFFFAOYSA-N 384.867 5.088 30 20 GKED N#C[C@@H](C(=O)c1cnc(Nc2ccc(Cl)cc2)c(Cl)c1)c1ccccn1 482598369 SDEYGDJXUJOVJD-OAHLLOKOSA-N 383.238 5.017 30 20 GKED Cc1cc(CNCCSCc2ccccc2C#N)ccc1Oc1cccnc1 489053126 LOFQRAHMCQJTJU-UHFFFAOYSA-N 389.524 5.077 30 20 GKED CC(C)(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)nc1 496408411 VVZLEVIQBMNGSL-CYBMUJFWSA-N 385.876 5.012 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 497801461 ZMMHFZHAHOPUMK-HSZRJFAPSA-N 394.490 5.277 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2Nc2ccc(F)cc2F)c(F)c1 499352659 TXWZXTMHFSYTOL-UHFFFAOYSA-N 385.320 5.111 30 20 GKED N#C[C@H](NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1ccc(F)cc1 504980071 TVXWCORWORUDKK-NRFANRHFSA-N 394.833 5.053 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](C(=O)c2ccc(F)cc2)C1 505058283 RYMTVYJINTWTJT-IBGZPJMESA-N 380.463 5.071 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(COc2ccccc2)cc1 509589016 RZSFJJWSJUDFCO-UHFFFAOYSA-N 386.451 5.177 30 20 GKED CC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(Cl)s1 513078794 WHEPUIMFHPPNJI-INIZCTEOSA-N 375.925 5.344 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1 516327832 YHDVMHUGSHETKF-MRXNPFEDSA-N 392.421 5.087 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 518739254 UVBSIOUWYKSDGD-CQSZACIVSA-N 393.537 5.765 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 520924443 WQLNEMFRSBTGMF-IBGZPJMESA-N 396.556 5.886 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(N[C@H](C)C(=O)Nc3ccccc3C#N)c2)C1 521107967 PSPPLHDIXQDCNT-HMFYCAOWSA-N 391.515 5.093 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1F 524442109 QVPHLTYDSLNLKZ-UHFFFAOYSA-N 394.290 5.527 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2n1C 525000511 QZDFFXVTBVNBHL-KRWDZBQOSA-N 375.497 5.122 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCCc4ccc(Cl)cc43)ccc21 527293119 STSVPCGFENTJJR-NRFANRHFSA-N 393.918 5.412 30 20 GKED CC(C)(C#N)CCCNc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 532413490 HQNAFMHINGAZMG-UHFFFAOYSA-N 389.421 5.700 30 20 GKED CC(C)c1ccc(CN(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 532917312 ZDBHLVLUQKTZRH-GOSISDBHSA-N 395.572 5.132 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)cc1 534876583 JHANILLQKMYPOU-UHFFFAOYSA-N 387.826 5.322 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CSc1cccc(Cl)c1C#N 537848107 YUMQSGAANSHFNK-UHFFFAOYSA-N 386.948 6.189 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3c(F)cc(Cl)cc3F)c2)c1 538246264 PWVQIRLZVRBYOR-UHFFFAOYSA-N 398.796 5.321 30 20 GKED N#CCC1CCN(C(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)CC1 541054478 NZTUXLRJUNFRLM-UHFFFAOYSA-N 390.380 5.277 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccccc1F)c1ccc(-c2cccc(C#N)c2)cc1 543943084 DFHGFJZBOUTEKY-KRWDZBQOSA-N 387.458 5.267 30 20 GKED C[C@H](CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)Nc1ccc(CC#N)cc1 544927664 LHPLJIUCHIGKNH-GFCCVEGCSA-N 395.812 5.254 30 20 GKED CC(=O)[C@@H]1C[C@H](CC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1(C)C 545451143 QCZHVGIIZQBBHC-FNVCAUGXSA-N 388.511 5.044 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2ccc(OC)cc2nc1C 552578893 KHYCAFMKCHWXLS-UHFFFAOYSA-N 386.904 5.095 30 20 GKED CCOC1(C)CCN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CC1 552634261 WKLPLQDTROGUKF-UHFFFAOYSA-N 398.890 5.035 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 554104811 HZFFIWMNCXMLRJ-UHFFFAOYSA-N 392.528 5.339 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 563513113 TZJCKWWDQRVLEF-OAHLLOKOSA-N 390.874 5.341 30 20 GKED COc1ccc(-c2nc(CSc3cccc(F)c3C#N)cs2)c(OC)c1 570763377 LEJPURNKVPJAJH-UHFFFAOYSA-N 386.473 5.130 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2)cc1 577689714 KIWNIFJWUGUQFT-SFHVURJKSA-N 375.497 5.301 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)CC1 583382859 NWLSNEGGZAMZCT-UHFFFAOYSA-N 390.455 5.172 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cc(Cl)ccc2C(F)(F)F)c(OC)c1 584475506 LQUZXLLNCPVMLV-UHFFFAOYSA-N 399.796 5.113 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC3(CCC3)CC2)cc1 588237499 HTOVKYKWYBLJHU-UHFFFAOYSA-N 389.499 5.130 30 20 GKED C=C(C)COc1cccc(NC(=O)NCc2ccc(-c3csc(C)n3)s2)c1 589740899 IPTJVYLLPIGCJJ-UHFFFAOYSA-N 399.541 5.457 30 20 GKED N#CC1(c2ccc(CNc3cccc(CSC4CCOCC4)c3)cc2)CC1 594949453 DSCWJKCRNUHARP-UHFFFAOYSA-N 378.541 5.266 30 20 GKED C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccc(O[C@@H](C)c2ccccc2)cc1 595750565 COLPFQXWNQPDHB-SLFFLAALSA-N 391.515 5.223 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(Cl)cc2cccnc12 603459853 VCZXAKQQTGNFOO-UHFFFAOYSA-N 383.838 5.679 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3ccc4ccccc4c3)cn2)cc1 603765445 VAHCCFRJDCYSSN-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1c(F)cccc1NC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 608776073 XXPIIQQMNNIADS-URLYPYJESA-N 386.311 5.165 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1cccc(CC#N)c1 609062167 CCHJPKMQGAAQCE-UHFFFAOYSA-N 390.870 5.546 30 20 GKED CCCN(C(=O)c1cc2ccccc2n1CC#N)[C@H](C)c1cc2ccccc2o1 609166471 CWVXZXCSOMIMHB-QGZVFWFLSA-N 385.467 5.524 30 20 GKED COc1cc(C)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609298351 OFWUDFIGKYWOMO-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C/C=C\c1ccc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(OC)c1 609384628 ZFEPFZLWYXEEBA-OUOZUETKSA-N 396.512 5.140 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(OC(F)F)cc3)cc2)cc1 609496406 SUANSTNTPNHSSV-UHFFFAOYSA-N 394.377 5.399 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)CCCc3ccccn3)c2C#N)C1 609579450 QDTBUXNEQZVZQG-OAHLLOKOSA-N 381.545 5.127 30 20 GKED Cc1ccc(O)c(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c1 609742753 ZQWBTGBHCFQTLJ-UHFFFAOYSA-N 378.815 5.270 30 20 GKED N#Cc1ccc(SCc2nnc(-c3c(Cl)cccc3Cl)o2)c(F)c1 610219856 ZRCNCNKFHXHPMC-UHFFFAOYSA-N 380.231 5.346 30 20 GKED CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610321160 JFKOPXVBHZLPIZ-OXQOHEQNSA-N 378.476 5.178 30 20 GKED C[C@H](NC(=O)N1CCC(c2cccc3ccccc23)CC1)c1cccc(C#N)c1 610355217 KWOUMYKHNKGAGY-SFHVURJKSA-N 383.495 5.362 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(OCc3ccccc3)cc2)c(Cl)c1 611092946 OMIVYQPZWMOORC-UHFFFAOYSA-N 397.261 5.696 30 20 GKED Cc1n[nH]c(C)c1[C@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 612280459 MHMKCJVOXYTREW-DJJJIMSYSA-N 392.890 5.078 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc12 613407056 GEOZQQZRCIMGFZ-INIZCTEOSA-N 392.867 5.602 30 20 GKED FC(F)(F)C1CCC(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CC1 681080648 FYJBFZBWWGZPKT-QQFIATSDSA-N 385.314 5.418 30 20 GKED O=C(Nc1cccc(/C=C2/CCc3sccc3C2=O)c1)c1ccccc1Cl 726891215 HIUKPSAJUBOSFJ-QINSGFPZSA-N 393.895 5.866 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1cccc(C#N)c1 727639016 CNECFOWKIVWFOJ-CYBMUJFWSA-N 382.872 5.182 30 20 GKED C#CCCOc1ccc(CNCc2ccc(Oc3ccccc3OC)cc2)cc1 733328409 UEUUPLBCEUTOOC-UHFFFAOYSA-N 387.479 5.179 30 20 GKED C[C@@H]1c2c(F)cccc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738897977 YGTWIWMVPDNKRI-VGOFRKELSA-N 399.469 5.632 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cccc(Br)c3O)c2)s1 740011250 MELSYLFGQQIDGC-UHFFFAOYSA-N 399.313 5.045 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3c(F)cccc3N3CCCC3)c2)s1 740013310 CZJQAAXPFWJNMF-UHFFFAOYSA-N 391.515 5.316 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cc(Cl)ccc3F)c2)s1 740431615 LVXBZLVBSDTUJO-UHFFFAOYSA-N 385.851 5.401 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(N3CCCC3=O)cc2)cc1 741466818 AGCZMKZXWGXKML-LICLKQGHSA-N 397.474 5.385 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccncc3)s2)cc1 741537883 JTMGFCVKTRUJOJ-HXUWFJFHSA-N 396.475 5.113 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746658022 ALLUSSLCAWMESQ-RPBOFIJWSA-N 397.522 6.347 30 20 GKED CC/C(=C/C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)cc1 746892087 PHATZHUEGQDBQG-CFBLSMTOSA-N 380.513 5.522 30 20 GKED CCc1cccc(CC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 752488565 UNQNRHPYZHURGZ-HNNXBMFYSA-N 382.435 5.070 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(SC(F)F)cc1 752616456 TYOCZSQNJGZOPI-ROUUACIJSA-N 387.455 5.305 30 20 GKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl 754573860 TYJQYQULLPNHNV-OCCSQVGLSA-N 383.835 5.048 30 20 GKED CCN1CCC[C@H]1Cn1c(C)cc(C=NOc2ccccc2C(F)(F)F)c1C 754712882 WPDDUUGOFSHNDI-SFHVURJKSA-N 393.453 5.021 30 20 GKED CC(C)c1ccc(C2(C(=O)Nc3ccccc3O[C@@H](C)C#N)CCCC2)cc1 780154705 YMAXOPATABGUFU-SFHVURJKSA-N 376.500 5.551 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 782727988 JVVXWAXITVQFSL-MHECFPHRSA-N 396.494 5.298 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN2CCCCC2=O)cc1 789718072 DTENBIHYTPFVRQ-UHFFFAOYSA-N 390.527 5.303 30 20 GKED N#C[C@H](C(=O)CCSc1nc2ccccc2s1)c1nccc2ccccc12 792100240 KZNQFPVBBSKHMZ-MRXNPFEDSA-N 389.505 5.203 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(Br)s1 792103506 SCLMEXJKVRIKMS-RISCZKNCSA-N 385.286 5.039 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797568841 WZABGZJBFWMVHE-INDWDQIESA-N 392.446 5.739 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1sc2cc(F)ccc2c1C 805844333 IBQWYNXYLUORST-MRXNPFEDSA-N 390.439 5.344 30 20 GKED Fc1cc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)cnc1Cl 846850647 KMWYEGRSSQZMKF-GFCCVEGCSA-N 386.698 5.286 30 20 GKED COc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1OCC(F)(F)F 848529129 RRJYHGQQEBJXOD-UHFFFAOYSA-N 378.394 5.050 30 20 GKED CCOc1ccc(C=NOCC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 852210072 XLVSOFJEAOUPOB-UHFFFAOYSA-N 382.504 5.321 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916681007 NJTBUCXYYJLPKJ-VGOFRKELSA-N 387.458 5.706 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)cc1 916948005 QVZVPUHYOFSURP-BLLLJJGKSA-N 389.282 5.468 30 20 GKED CCc1cccc2c(C(=O)[C@H](NCc3ccc(C#N)cc3)c3ccccc3)c[nH]c12 917934975 JCTGQVLYXDVRQZ-RUZDIDTESA-N 393.490 5.316 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1sc2cccc(F)c2c1C 920101806 JNIYVHZPBFXRQL-AWEZNQCLSA-N 390.439 5.344 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Oc2ccccc2)c(F)c1 1776033312 DYHVGNMDMDJBRZ-UHFFFAOYSA-N 398.821 5.806 30 20 GKED O=C(O)c1ccc(NN=Cc2c3ccccc3c(Cl)c3ccccc23)cc1F 1776073435 VBALZEDUIBSXGB-UHFFFAOYSA-N 392.817 5.930 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3cccc(Cl)c3Cl)cc2)cc1 1776081025 SBFPRNGWKJWPRF-UHFFFAOYSA-N 385.250 5.805 30 20 GKED CC(=NNc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776108086 CFAKKSXAHGNEDF-UHFFFAOYSA-N 399.790 5.043 30 20 GKED CN(Cc1cccs1)c1ccc(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1 1777077212 KBUSLNODBSYVLB-RMKNXTFCSA-N 383.494 5.040 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 1777268204 QDENHEZTZNXYMI-DAXSKMNVSA-N 385.630 5.250 30 20 GKED COc1ccc(/C=C2/CCc3cc(SC)ccc3C2=O)c2cc(C(=O)O)oc12 1777360281 QQCLQBGOVXCVOM-ZROIWOOFSA-N 394.448 5.074 30 20 GKED COc1ccccc1Oc1ccc(/C=C/C(=O)c2ccc(CC(=O)O)cc2)cc1 1777388410 FWXAVPXRYBMKJP-XNTDXEJSSA-N 388.419 5.011 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(F)(F)F)cc1 66954074 QXLQADPIRBOASE-CYBMUJFWSA-N 393.434 5.421 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccncc1 117663742 DZLXVLCQMAFFOD-UHFFFAOYSA-N 377.831 5.066 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc(-c2ccncc2)cs1 128894033 OQCFWAWNZUSBTF-NRFANRHFSA-N 393.471 5.266 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 156956195 BHJHAMJLLQOXRK-CYBMUJFWSA-N 393.418 5.227 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 171740736 JBAADFXKPQGYSR-DNVCBOLYSA-N 399.947 5.961 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccc(C)s3)n2)cc1 176026048 DDHXSGHLQPODFZ-SFHVURJKSA-N 396.537 5.388 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3O[C@@H](C)C#N)c2cc1C(C)C 182545305 LTJWYXVAYNYAAN-INIZCTEOSA-N 376.456 5.128 30 20 GKED N#CC1(c2ccc(C(=O)N3CCc4sccc4[C@@H]3c3cccs3)cc2)CC1 182586813 FJNOICWVDPOQNR-HXUWFJFHSA-N 390.533 5.153 30 20 GKED Cc1ccc(F)cc1CSCC(=O)Nc1ccccc1SC[C@@H](C)C#N 187533460 NHRBTTBJPJPKRN-AWEZNQCLSA-N 388.533 5.258 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1[nH]c2c(c1C)C(=O)CC(C)(C)C2 188061527 DSALCDBNGVTZOB-UHFFFAOYSA-N 378.516 5.582 30 20 GKED C=CCn1c(SCCCC(=O)c2ccccc2)nnc1-c1cccc(C)c1 195561825 OTNWMRSFIFEOSX-UHFFFAOYSA-N 377.513 5.195 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1ccccc1SC[C@H](C)C#N 255068009 BZFVRBPXIJFBDG-VZVUQDNOSA-N 380.513 5.074 30 20 GKED C[C@H](Nc1ccc2cc(C#N)ccc2n1)c1ccc(OCc2cccnc2)cc1 301974016 KMUDIWIUMUUPEL-KRWDZBQOSA-N 380.451 5.254 30 20 GKED C[C@H](Sc1nc2cc(Cl)ccc2o1)C(=O)Nc1ccc(C#N)c(Cl)c1 302769200 VWQXTIKHRNNSHV-VIFPVBQESA-N 392.267 5.126 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 429684486 KPORDMSCZPXKST-ZDUSSCGKSA-N 376.815 5.551 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)c2cccc(SCC#N)c2)c1 429940803 CLYMRLHSISOUPA-UHFFFAOYSA-N 376.481 5.046 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 431374628 OQPITVSWNLSIHO-HNAYVOBHSA-N 389.421 5.501 30 20 GKED N#CCCC[C@H](NC(=O)NC(c1cccs1)c1cccs1)c1ccccc1 431979835 GGLRPTDGABDOBT-KRWDZBQOSA-N 395.553 5.633 30 20 GKED C[C@@H](CCC(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 437033901 HEEIYXLBABKUJY-CABZTGNLSA-N 381.282 6.020 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cc(Cl)cc3cccnc23)cc1 437246184 MDPQSYGZSNKUSD-UHFFFAOYSA-N 391.902 5.315 30 20 GKED N#CCC[C@H](NC(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21)c1ccccc1 438863603 ZYLPOIFSFBXDJU-PMACEKPBSA-N 399.441 5.010 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1nccs1)c1ccc(C(F)(F)F)cc1 441528230 BURHKUWRIPXKPC-HNNXBMFYSA-N 383.439 5.011 30 20 GKED N#CCSc1ccccc1NC(=O)CN1CCCC[C@@H]1c1cccc(Cl)c1 444793077 OSEVLQPTAAVDAO-LJQANCHMSA-N 399.947 5.121 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 454730893 YXWGYCHVTLAZDN-BJLQDIEVSA-N 377.488 5.339 30 20 GKED C=CCOCCCC(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 463492977 OYASCERMPWFFGI-UHFFFAOYSA-N 380.419 5.088 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC(c3ccccc3F)C2)cc1 463524073 OXMQPFNQOFTEAM-UHFFFAOYSA-N 387.414 5.121 30 20 GKED COc1ccc(N(C)C(=O)c2ccccc2Sc2ccccc2C#N)cc1F 466886706 FWLBNXKRPVQFKX-UHFFFAOYSA-N 392.455 5.134 30 20 GKED C[C@@]1(c2ccccc2)CC[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C1 469267521 QTGHLLFQFMIMFX-WIOPSUGQSA-N 387.527 5.192 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(C(F)(F)F)o1 471764535 YMDDDDFLZBRFMF-UHFFFAOYSA-N 386.329 5.523 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 473584107 XGAPHRJRRFNZQH-UHFFFAOYSA-N 394.393 5.247 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)n1 474423317 YWWMMKFYIMIOJD-HNNXBMFYSA-N 395.532 5.206 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 476343941 ZQHATLSVBKZSSL-CTNGQTDRSA-N 375.516 5.400 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(NC(=O)CC)ccc1C)c1ccc(F)c(F)c1 480386246 LVQZXXGFZORWJL-FQEVSTJZSA-N 387.430 5.061 30 20 GKED C=CCn1c(S[C@@H](C)Cc2ccc3ccccc3n2)nnc1-c1ccoc1C 481754519 ZOUDKJSAZOXCMQ-HNNXBMFYSA-N 390.512 5.304 30 20 GKED N#CC[C@@H](CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1 483362526 ZNQLSEBFUIUUBG-SFHVURJKSA-N 397.503 5.411 30 20 GKED O=C(NC[C@H]1CCCC[C@H]1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 483675279 ZNZYTSSSNZBOFU-MWLCHTKSSA-N 386.311 5.335 30 20 GKED N#Cc1cc(Cl)cc(OCc2nnc(-c3c(Cl)cccc3Cl)o2)c1 487455276 MQXSXHZSPUAMOM-UHFFFAOYSA-N 380.618 5.147 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(Cc2ccccc2F)n1)c1ccccc1 487506966 WTLKYDPTKZYPAK-LJQANCHMSA-N 393.487 5.038 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 500741619 YUVUEBLFDZLKCK-UHFFFAOYSA-N 387.395 5.128 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(Cl)ccc1F 500744453 PSFOPJZLWFTPFG-UHFFFAOYSA-N 380.806 5.704 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCOc1ccc(F)cc1 500745652 SZLPXAPHLCMAEI-UHFFFAOYSA-N 390.414 5.206 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CSCc1ccc(Cl)cc1 500993591 DOGNDVVGIVMUHX-UHFFFAOYSA-N 396.899 5.271 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3ccccn3)n2)o1 504564280 UKRLQYMPOGFDEV-UHFFFAOYSA-N 375.375 5.228 30 20 GKED C[C@@H]1CCC[C@H](NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 505156952 PXNYGXOTETTZMT-XLIONFOSSA-N 377.488 5.032 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3cc(C#N)ccc3F)C2)nc2ccccc21 512265967 RGYVSGNJJWJVSD-SFHVURJKSA-N 376.479 5.008 30 20 GKED Cc1nc(C(F)(F)F)ccc1NC(=O)c1ccccc1-c1ccccc1C#N 512411388 KAOZSZUEOGKLQW-UHFFFAOYSA-N 381.357 5.200 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(-c2cccs2)c1 513971215 GBFKASMKOXXRHV-UHFFFAOYSA-N 393.468 5.543 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2C(=O)CSc2ccc(C#N)cc2)cc1 515571264 ANXZBWMRTOWSPS-OAQYLSRUSA-N 378.541 5.312 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 517653455 UJXYBBGPXFWFMO-QGZVFWFLSA-N 394.418 5.009 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cnc3ccccc3c2)cc1 518022460 OWKSJEFJUDJCHO-UHFFFAOYSA-N 395.487 5.651 30 20 GKED C[C@H](CC(=O)Nc1ccccc1SCCC#N)c1ccc(C(F)(F)F)cc1 518120215 VHFVXFHQWKCGNJ-CQSZACIVSA-N 392.446 5.843 30 20 GKED CCc1cc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1Cl 518661872 KHRJYRPTEHRKLA-CQSZACIVSA-N 388.920 5.314 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 519450860 LNYOAZVQQIWTQA-SFHVURJKSA-N 381.545 5.691 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 520178583 QHSCEQGPPFUDJD-CYBMUJFWSA-N 391.393 5.201 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CCCCOc1cccc(C#N)c1 520332757 VHGTXWMFIHNMPA-KRWDZBQOSA-N 376.456 5.073 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)cc1 520558833 OTKRFXDPEDMYIR-UHFFFAOYSA-N 380.403 5.863 30 20 GKED CN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1cccc2ccccc12 522313093 LNYZOQXNVAPZJG-UHFFFAOYSA-N 392.458 5.567 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522635585 PTNQLLRAOPUOBE-CQSZACIVSA-N 396.899 5.899 30 20 GKED CC(C)n1cc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2n1 522865012 KZKVVQXZCXDEMH-UHFFFAOYSA-N 380.451 5.408 30 20 GKED C=CCn1c(SCCCc2cccc3ccccc23)nnc1-c1cccnc1 524034140 KCXWUUWMZJONMS-UHFFFAOYSA-N 386.524 5.404 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NC3CCC(F)(F)CC3)c2)cc1 534163302 HTBASPLNYKELIJ-UHFFFAOYSA-N 399.441 5.031 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)CSc1ccc(C#N)cc1 535524475 LDZMMWAZFWDFIP-UHFFFAOYSA-N 389.318 5.175 30 20 GKED C[C@H](N[C@@H]1c2cc(Br)ccc2SC[C@H]1C)c1ccc(C#N)cc1 538394359 XRVKVUKVRMJRNI-NQCMUKECSA-N 387.346 5.454 30 20 GKED C=CCCOCCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C 538415657 JHNSNFQEZZBKBN-UHFFFAOYSA-N 394.540 6.032 30 20 GKED C=CCC[C@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)c1ccccc1 539054521 QLGFORSJKPCCKN-QFIPXVFZSA-N 382.935 5.242 30 20 GKED C[C@@H](NC(=O)c1ccnn1C1CCCC1)c1ccc(-c2cccc(C#N)c2)cc1 541072047 FZFQXNIHPDVUAH-QGZVFWFLSA-N 384.483 5.028 30 20 GKED C=C(C)Cn1c(S[C@H]2CCc3ccc(Cl)cc32)nnc1-c1ccncc1 543149685 AXSDNBRLCLZWDQ-SFHVURJKSA-N 382.920 5.349 30 20 GKED C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 558001856 JEBGMDGTJHFKHS-FUHWJXTLSA-N 388.433 5.182 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)c1ccccc1 558793195 FLDVSOYOARPAOL-GOSISDBHSA-N 375.472 5.082 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)N2CCC(CCC#N)CC2)c1 564941941 GFKILIMJBPACDR-UHFFFAOYSA-N 377.488 5.122 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1 567192967 VPURACZTVJDENH-IBGZPJMESA-N 388.870 5.045 30 20 GKED Cn1c(-c2cccc(C#N)c2)nnc1N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 569393338 BDQKNJJLXCFOIK-GOSISDBHSA-N 398.297 5.002 30 20 GKED Cc1cc(Cl)cc2cc(-c3noc([C@H](C#N)Cc4ccc(C#N)cc4)n3)oc12 579458186 AXQGHHHJYWALBL-INIZCTEOSA-N 388.814 5.166 30 20 GKED N#Cc1ccc(-c2csc(Cc3cn4cc(Cl)cc(Cl)c4n3)n2)cc1 587921508 ARSGYSUAKYRQQF-UHFFFAOYSA-N 385.279 5.227 30 20 GKED COc1ccc(CNC2(c3cccc(Cl)c3)CCC2)cc1OCCCC#N 592377740 YYTHCUJQOOWKLZ-UHFFFAOYSA-N 384.907 5.200 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H](CCF)C2)cc1F 596778758 NJEWBFCFSWQYKO-OAHLLOKOSA-N 385.414 5.093 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cc(F)ccc1F 605481157 DWJYYJCAKIVTQQ-UHFFFAOYSA-N 399.237 5.177 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccc(F)c1F 605481726 MDSCSHNGKOYCSG-UHFFFAOYSA-N 399.237 5.177 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2sccc2C2CC2)cc1Cl 609152193 MNSKRPFLLWDSAM-LJQANCHMSA-N 392.911 6.187 30 20 GKED CSCc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)oc2ccccc12 609321511 CAJREBVYQIATET-ZDUSSCGKSA-N 396.468 5.535 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609497567 JOVWPVZUYPKANC-UHFFFAOYSA-N 385.467 5.106 30 20 GKED CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610015735 RAEDFIPPXOIYRG-OXQOHEQNSA-N 378.476 5.178 30 20 GKED C[C@H](NC(=O)C1(c2cccc(Br)c2)CCCC1)c1cccc(C#N)c1 610360823 HZDZYDFPTIRDEG-HNNXBMFYSA-N 397.316 5.010 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1Cl)C1CCCC1)c1cccc(C#N)c1 610406937 LNDHHDQPYBQIAU-INIZCTEOSA-N 381.907 5.427 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 611278666 AQEUBMCHHPYSLO-OAQYLSRUSA-N 388.433 5.629 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2c(F)cccc2Cl)c1 612391482 CSOSVIBAPHPJIE-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1N[C@H](C#N)Cc1ccccc1 613450661 AJWUVXHNUNPCCS-NRFANRHFSA-N 389.886 5.448 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1c(F)cccc1Cl 619126459 UESBOZFRXRBTEN-UHFFFAOYSA-N 379.703 5.263 30 20 GKED C[C@@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 623973172 IZHIAHHQAIAGSL-HTQZYQBOSA-N 386.336 5.732 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1coc(C(F)F)c1 626370032 YWANHVCYNNJFKE-NSHDSACASA-N 387.226 5.269 30 20 GKED Cc1sc(Br)c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c1C 669600138 OGVVZUMPSAKOOY-CYBMUJFWSA-N 385.286 5.166 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)c(F)c(F)c1 675739623 ZGSLPXSSNIKCRT-FXBDTBDDSA-N 393.293 5.664 30 20 GKED N#CCCCOc1cccc(/C=C2\CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)c1 726743654 NSIXHXNEPRCJPU-IWGRKNQJSA-N 388.423 5.107 30 20 GKED C[C@@H]1C[C@@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC(C)(C)C1 727631423 DYAVNCLYEYIIEA-AYBZRNKSSA-N 391.540 5.711 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=NNc2oc(C(C)C)nc2C#N)CCC3)cc1 727651294 RWUZHJOJTJXHCO-UHFFFAOYSA-N 391.500 5.254 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(COc3ccc(F)cc3)o2)C(C)C)c1 728247351 BWLNSNTVAAFWPK-UHFFFAOYSA-N 377.415 5.034 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CCCC1)c1nc2cc(F)ccc2s1 730417559 QBRLZEOQRCJLDD-MRXNPFEDSA-N 398.890 5.777 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl 733273029 IZWFCRGFCZOVNZ-HNNXBMFYSA-N 377.296 5.026 30 20 GKED C[C@@H]1CCCC[C@@H]1OCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733681696 YQIUDFKMXQUOMW-FFSVYQOJSA-N 396.434 5.087 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3c(C)nn(-c4ccc(F)cc4)c3C)c2c1 734306914 IVTQBGWYJUPIFY-PKNBQFBNSA-N 389.430 5.014 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2coc(-c3ccccc3)n2)cc1 737501608 DBNFSQPJVHNZJX-OAQYLSRUSA-N 379.419 5.249 30 20 GKED O=C(/C=C/c1cnc2ccccn12)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 740765379 YHDQNHAHDRKOAO-SNAWJCMRSA-N 384.279 5.268 30 20 GKED Cc1ccc(NC(=O)Cc2ccc(OCC#N)cc2)cc1OCC1CCCCC1 741202137 ORMTUBRZMFWSIG-UHFFFAOYSA-N 392.499 5.038 30 20 GKED CN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1ccc(C#N)cc1 742223146 PWJCPBJHQGWSCP-UHFFFAOYSA-N 381.410 5.189 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccc3c(c2)COC3)cc1OCC 742436061 FRUDLQCEXVAHAS-YVMONPNESA-N 386.875 5.454 30 20 GKED Cc1ccccc1C1CC(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1 743440190 CYPJQQRIBKCMLE-UHFFFAOYSA-N 397.404 5.211 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1nc2ccccc2s1 744016106 JOMCKNHCFZMDMT-SOUVJXGZSA-N 387.291 5.583 30 20 GKED Cc1ccc(N(Cc2ccco2)Cc2nnc(-c3ccc(C#N)cc3)o2)cc1C 744394741 JJUGEAMGGVALQS-UHFFFAOYSA-N 384.439 5.025 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745989942 HHBRHEXRNJZYJH-OUKQBFOZSA-N 379.463 5.447 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(-c3ccccc3)ccc2OC)c1 756898130 AZSCAUMIRLFEPP-HSZRJFAPSA-N 386.495 5.333 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 761046853 GPXAZGLUNXBZLG-ICSRJNTNSA-N 382.529 5.423 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cc(C(F)F)ccc1Cl 768898467 VADZAUAOXHBRBW-UHFFFAOYSA-N 375.762 5.094 30 20 GKED C[C@@H](NC(=S)NCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 773164853 ZTSXCUSQPWIEKE-OAHLLOKOSA-N 377.538 5.012 30 20 GKED CC(C)(C#N)CCCOC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 783963409 RXYGRBFBOUHPNH-UHFFFAOYSA-N 382.407 5.316 30 20 GKED N#Cc1cc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)ccc1Cl 787093837 NGLBLEAGMHRMAN-UHFFFAOYSA-N 395.460 5.473 30 20 GKED Cc1cc(NC(=O)c2ccccc2SCC#N)ccc1Oc1ccncc1 787721132 MDIVPVLJMNJKFU-UHFFFAOYSA-N 375.453 5.050 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)C1CCC(F)(F)CC1 788715497 HYLUWJVOOPGFTH-UHFFFAOYSA-N 399.367 5.171 30 20 GKED Fc1ccc(F)c([C@@H](NCc2ccc(Cl)nc2C(F)(F)F)C(F)F)c1 789339977 LFFGXDUNDWERCR-GFCCVEGCSA-N 386.698 5.128 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 797569607 SZMPINARKUQIAH-WFASDCNBSA-N 394.462 5.829 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cc(C(F)(F)F)ccn1 813215411 XZQOXJVGELDCFP-IHRRRGAJSA-N 399.199 5.387 30 20 GKED Cc1cc2oc(=O)cc(CN[C@@H](CCCC#N)c3ccccc3)c2cc1C(C)C 814658682 GANOGMBHCLPPIG-QHCPKHFHSA-N 388.511 5.750 30 20 GKED CCC1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCC(F)(F)CC1 850771742 YDGKSNVBMKFNNR-LBPRGKRZSA-N 382.863 5.732 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(C2CC2)[C@@H](C)c2ccccc2)cc1OC 914481667 RAKKMAOOSSXHQF-OTMARIDSSA-N 377.484 5.025 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C/c1ccccc1Cl 915055333 HVQVWZMOOOFNIP-DHZHZOJOSA-N 389.842 5.359 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2sccc2-n2cccc2)cc1 915085852 PCFHCRNSJLJVRR-HXUWFJFHSA-N 383.476 5.447 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)c(-c2ccccc2)n1 916137447 UHPSETOMRTXJLA-ZHACJKMWSA-N 395.384 5.379 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(Oc2ccccc2)cc1 916905589 MAZRIGOLVCPYCT-GOSISDBHSA-N 390.826 5.093 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)cc1 916948008 QVZVPUHYOFSURP-WBMJQRKESA-N 389.282 5.468 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917430146 FHBFCSJSQIHSAM-HMVFGEFZSA-N 386.398 5.595 30 20 GKED Fc1cc(-c2cccs2)ccc1C=Nn1c(S)nnc1-c1cccs1 917536811 UXMRTWHYJMGTAF-UHFFFAOYSA-N 386.502 5.045 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)/C=C\c1ccc(C(C)(C)C)cc1 920106473 PJRBLMUMAFKLSJ-QKQONQEDSA-N 384.479 5.379 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3nc(Cl)ccc3Cl)cc2)cc1 921011447 WVDKBONXPDMYAL-UHFFFAOYSA-N 384.222 5.305 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H](c3cccc(Cl)c3)C2)ccc1Cl 1776034189 RNYKVLRRWUBTHT-ZDUSSCGKSA-N 377.271 5.817 30 20 GKED CC(=NNc1ncnc(Cl)c1C(C)C)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776056664 HEEGUUMIFIPELI-UHFFFAOYSA-N 398.850 5.048 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(OCc2cccc(C)c2)cc1 1776084276 FSOCFNLXDLNLDL-UHFFFAOYSA-N 388.467 5.037 30 20 GKED CC(=NNc1ccc(Cl)cc1Br)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776093834 NKOPOKRWYTXUCJ-PWSUYJOCSA-N 387.705 5.027 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1[N+](=O)[O-] 1776116392 YYNSWDIEIYFFCX-WLRTZDKTSA-N 387.391 5.165 30 20 GKED COc1ccc2c(c1)CC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776127385 RJQVDVLTLQZWDY-STZFKDTASA-N 384.431 5.273 30 20 GKED CC(C)(C#N)c1ccc(CNCc2ccc(-c3cccc(C(=O)O)c3)cc2)cc1 1776230646 QNTGJJJFUNYHMV-UHFFFAOYSA-N 384.479 5.143 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)CC2 1776374784 ZHTKKFAJJIMQNF-MOSHPQCFSA-N 386.447 5.981 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1F 1777353270 JTHKPLSYOUPBSC-VURMDHGXSA-N 382.412 5.157 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C/c1csc2ccc(C(=O)O)cc12 1777489961 LIUFIKUCMDPKLN-FNORWQNLSA-N 385.510 5.558 30 20 GKED C[C@@H](NC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccc(C#N)cc1 26114586 SJZJQIQJBUGOQW-QGZVFWFLSA-N 396.446 5.374 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2)n1)c1nc2ccccc2n1C(F)F 41558068 YJMFPTZTORKACX-CYBMUJFWSA-N 394.406 5.045 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 51284702 HXNKASMOPWTONE-YVARQFDVSA-N 389.263 5.600 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(C(F)(F)F)c1 66800361 LWABYCDVGQEQCM-CYBMUJFWSA-N 378.419 5.281 30 20 GKED O=C(/C=C/c1cnc2ccc(Br)cn12)c1cccc(C(F)(F)F)c1 97591069 LZMFOAGSHUYNIE-AATRIKPKSA-N 395.178 5.012 30 20 GKED CCCCCCCC(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 107899107 WBVGEXCEUHSGOT-KRWDZBQOSA-N 389.927 5.457 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H]2c2ccccc2Cl)c1 110639919 SELYFBXIISGYMZ-OAQYLSRUSA-N 382.891 5.124 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(OCCCC#N)c1 113570622 PCDAOXDNBOMQLC-MRXNPFEDSA-N 394.500 5.407 30 20 GKED C[C@H](c1cccnc1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116635159 WGRKUQDOAJIFKK-OAHLLOKOSA-N 391.858 5.232 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1sc2cc(Cl)ccc2c1Cl 116823020 NASIRFZDNKFDHD-UHFFFAOYSA-N 375.280 5.352 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2ccc(CN(C(C)=O)C(C)C)cc2)c1 117005489 NRDSZBPELCXOHR-UHFFFAOYSA-N 395.503 5.042 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1-c1ccc(F)cc1 119841049 PHNMWGLXRRFGQB-MRXNPFEDSA-N 375.428 5.229 30 20 GKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 128404977 RSDRAPGLHLEXRA-CQSZACIVSA-N 375.394 5.386 30 20 GKED CC(C)(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 176022341 WFWOZINEYVFCLV-OAHLLOKOSA-N 383.398 5.099 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)n1 177769988 DFFOMPIVYLTRKZ-ZDUSSCGKSA-N 391.418 5.267 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C(=O)N[C@H](C)CCC)C1 191458836 IQRQBLMHVJKEEL-QUCCMNQESA-N 399.579 5.087 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCN(c2ccccc2)C1 191487592 DQOSTTURAMKFNO-IBGZPJMESA-N 377.532 5.187 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccccc2F)cs1 255581673 LLNAOKBDNWMEQR-FLIBITNWSA-N 384.407 5.002 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCC1(C)CCCC1 303327179 IWSXISXEPSZKAF-UHFFFAOYSA-N 377.488 5.148 30 20 GKED CC(C)Cc1noc(-c2cc(Cl)ccc2N=C(O)[C@@H]2CCC(=O)[C@H](C)C2)n1 329368878 JIAHQEOLRSVXJB-CHWSQXEVSA-N 389.883 5.182 30 20 GKED Cc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1OC(C)C 427643916 DLICFGXIGXWHFX-UHFFFAOYSA-N 375.472 5.293 30 20 GKED CC1(C)[C@@H]2CN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)c(Cl)c3)C[C@H]21 437740028 YGGZQCDURVOPQH-GUDVDZBRSA-N 379.891 5.115 30 20 GKED C=CCN(C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2c(s1)CCCC2 439211501 DIKNCQVNBPQYGZ-UHFFFAOYSA-N 384.398 5.013 30 20 GKED N#CCC[C@H](NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F)c1ccccc1 440261656 UTJWCPZFMVZCNN-LEWJYISDSA-N 383.442 5.246 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)cc1O 447630788 VIHWAHRHKIHLQA-UHFFFAOYSA-N 383.234 5.490 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CC1CC(F)(F)C1 449852173 SJDUXMLTISEBNN-UHFFFAOYSA-N 378.366 5.085 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2c(c1)CC[C@H]2N(C)C 455850272 KQRHMMKUZQPAAY-GOSISDBHSA-N 389.952 5.171 30 20 GKED C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 460331650 BUOXWZDGDVKRDO-GOSISDBHSA-N 397.478 5.083 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1sc2ccccc2c1Br 464263502 FXBOFYVSLCJXKW-UHFFFAOYSA-N 379.323 5.256 30 20 GKED CC(C)Cn1cc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cn1 464328127 JCFTUXZOKCFITB-UHFFFAOYSA-N 394.862 5.109 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1noc2c1C[C@H](C)CC2 468945982 LMKVDKDLYSKZJV-CQSZACIVSA-N 387.439 5.024 30 20 GKED Cn1cc(-c2cc(CSCc3ccc(-c4ccccc4C#N)cc3)on2)cn1 469013487 PAWTZHSZRMTTMX-UHFFFAOYSA-N 386.480 5.047 30 20 GKED C=CC[C@H]1N(C(=O)Cc2ccc(OCc3c(C)noc3C)cc2)CCCC1(C)C 470300302 YYLUXDAVJXMRAZ-JOCHJYFZSA-N 396.531 5.006 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2c2cccc(Br)c2)cc1 475028381 GWFRQBVEGJQPJR-IBGZPJMESA-N 397.316 5.228 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccc2Cl)[nH]n1 476797259 RZPGKJYUKWFRRL-UHFFFAOYSA-N 379.891 5.834 30 20 GKED C[C@H](Sc1ccc(F)c(Cl)c1)C(=O)N(CCC#N)c1ccc(F)cc1 480545205 KDEXUJMPANPTTQ-LBPRGKRZSA-N 380.847 5.046 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cccc(C#Cc2ccccn2)c1 482099884 CSLFVCBRWDZHKM-NRFANRHFSA-N 394.396 5.156 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(OC)c(OC)c1C 482202563 WLKBPHXLTIFVSJ-QGZVFWFLSA-N 396.531 5.747 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cc2cc(C(F)(F)F)ccc21 483240293 GZGZXNFKVHQBHQ-QGZVFWFLSA-N 393.368 5.235 30 20 GKED C[C@H](Nc1c(C#N)cnc2c(F)cc(F)cc12)c1nc2ccccc2n1C(F)F 486453986 WNBPPNNHLSPUKC-JTQLQIEISA-N 399.351 5.303 30 20 GKED N#Cc1c(NC(=O)CCCCc2nc3ccccc3s2)sc2c1CCCC2 492219542 ICABKKRJCDJUCT-UHFFFAOYSA-N 395.553 5.460 30 20 GKED Cc1ccc(O[C@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500766410 ATVQZEAAVHQXBB-GOSISDBHSA-N 386.451 5.373 30 20 GKED C=CCN(C(=O)c1ccc(CCC(F)(F)F)cc1)c1nc2c(s1)CCCC2 507071648 FOUVHTNFKQRVBK-UHFFFAOYSA-N 394.462 5.350 30 20 GKED N#CCCn1cc(CN2CCC[C@H]2/C=C/c2ccccc2)c(-c2ccccc2)n1 507872470 CKBPUCPUHOWZNC-ZXYASIKESA-N 382.511 5.142 30 20 GKED CCSc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 508595734 PJAUZHITEZRANC-SFHVURJKSA-N 395.572 5.599 30 20 GKED CSc1cccc(NC(=O)CSc2nc(-c3ccccc3)ccc2C#N)c1 510173105 QSHGKXPNPQPXMB-UHFFFAOYSA-N 391.521 5.073 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)COc3ccccc3Cl)cc2)cc1 520560253 BCWBNNXDJIYCDL-UHFFFAOYSA-N 378.815 5.021 30 20 GKED COc1ccc(C[C@H](N[C@H](C#N)C2CCCCC2)c2ccccc2)cc1OC 522380938 URIGOTSZXBNVCC-FCHUYYIVSA-N 378.516 5.050 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2cccc(C#Cc3ccccn3)c2)c(C)s1 523591190 ZUJCTVJRZPNTMZ-MRXNPFEDSA-N 375.497 5.042 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)Nc1cccc(C2CCCCC2)c1 529649537 PQXGMPSHCKFPBP-UHFFFAOYSA-N 378.520 5.033 30 20 GKED N#Cc1cccc(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)c1 536490579 GSROEUFDFABJGK-UHFFFAOYSA-N 389.160 5.058 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2c(F)cc(Cl)cc2F)cc1 537148125 FRFIILHMSCLWBR-UHFFFAOYSA-N 398.796 5.321 30 20 GKED CCS[C@@H](C)c1noc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542017048 IKQRIRPAGGXMOC-CVEARBPZSA-N 392.528 5.273 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)[C@H](C)Sc2cccc(Cl)c2C#N)cc1 543031199 JYOZNAMWJAYZGL-ZDUSSCGKSA-N 386.904 5.170 30 20 GKED COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)c2ccc(CC#N)cc2)c1 544253205 FEYBNKNKKVNKOF-RPBOFIJWSA-N 396.490 5.132 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 545377698 BWDWNGVQOAYICH-SFHVURJKSA-N 394.540 5.771 30 20 GKED Cn1ccc([C@@H](Nc2ccc(C#N)c(C(F)(F)F)c2)c2ccc(Cl)cc2)n1 546581919 PJFGVXDRYIXPTB-SFHVURJKSA-N 390.796 5.165 30 20 GKED Cc1ccc(CN(C(=O)NCc2cccc(C#N)c2)[C@@H]2CCc3ccccc32)cc1 549141165 ILROVTSRGCSZGJ-RUZDIDTESA-N 395.506 5.266 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)c1 563679749 LENAVIHTATUBLR-BBWFWOEESA-N 387.336 5.290 30 20 GKED CC(C)(C)[S@](=O)Cc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 565569192 WAOMEGRQMLNLNG-HHHXNRCGSA-N 394.462 5.236 30 20 GKED N#CCCC1CCN(C(=O)[C@@H]2CCCO[C@@H]2c2ccc(Cl)cc2Cl)CC1 579477284 DIUXCIWZVHBOLN-IEBWSBKVSA-N 395.330 5.003 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC2 589337260 VERLXPWMCJSZQO-ORIJERBGSA-N 376.344 5.045 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)N[C@H]1CCc2cc(C#N)ccc21 589791058 GUNCHNTUZAELJU-DFBJGRDBSA-N 395.506 5.519 30 20 GKED CCN(C(=O)[C@@H](C)Cc1ccc(C#N)cc1)[C@@H](c1ccc(C)cc1)c1cccnc1 593972406 CBYKGACTHYRHHF-CPJSRVTESA-N 397.522 5.078 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2cccc(-c3ccc(Br)cc3)c2)C1 596908462 OCPRBRAZQHGXGG-OAHLLOKOSA-N 398.304 5.274 30 20 GKED C=CCN(CCC#N)C(=O)Nc1cc(C(F)(F)F)c(Cl)cc1SC 597052081 PZBBJEMEDGNOQG-UHFFFAOYSA-N 377.819 5.014 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1cccc(C#Cc2cccs2)c1 597261335 ANLSOSRGQANBQA-INIZCTEOSA-N 376.481 5.078 30 20 GKED CCCOc1ccc(CN(CCC)C(=O)Nc2ccc(C#N)cc2)cc1OCC 603500835 HOOGILBEWSRGFB-UHFFFAOYSA-N 395.503 5.190 30 20 GKED N#CCCCOc1cccc(NC(=O)CSc2cccc(C(F)(F)F)c2)c1 603969658 OPBJMXFYIBIUJS-UHFFFAOYSA-N 394.418 5.119 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccccc2)cc1 607802412 OKGYLWFXSPKWJN-UHFFFAOYSA-N 388.492 5.006 30 20 GKED CC(C)[C@H](NC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608837323 BYAQWLOUEOXMRF-LIRRHRJNSA-N 389.421 5.335 30 20 GKED CCc1c(C)sc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)c1C#N 609032321 BIZNLGSZAGAWQL-UHFFFAOYSA-N 399.903 5.370 30 20 GKED CN(Cc1csc2ccccc12)C(=O)Nc1cc(C#N)ccc1OC(F)F 609082502 NNMKDDDQINFPJN-UHFFFAOYSA-N 387.411 5.038 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)c1cc2ccccc2n1CC#N)C1CC1 609166986 RVCDGXNGQKXUMF-GOSISDBHSA-N 393.490 5.684 30 20 GKED Cc1ccc2nc(C)c(C(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)cc2c1 609287090 LOQFMAWBSFOLMD-SFHVURJKSA-N 384.266 5.153 30 20 GKED CCCN(CC)Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609382484 GUKXWKIVMRUIEY-SFHVURJKSA-N 395.572 5.423 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 609462409 DATZZVFEDMKRNC-NHYWBVRUSA-N 398.837 5.220 30 20 GKED C[C@@H](CC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccccc1C(F)(F)F 610174093 HRZQRKQOKSKMFS-NSHDSACASA-N 398.331 5.311 30 20 GKED CSc1cccc([C@H](NCc2cccc(C#N)c2)c2ccc(F)c(F)c2)c1 610271599 MAMJEIBJYWWLSE-QFIPXVFZSA-N 380.463 5.438 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(Cl)c4ncccc34)CC2)cc1 611245444 QXQKNCMWGPPHLW-UHFFFAOYSA-N 388.858 5.081 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2coc(C3CC3)n2)cc1Cl 613072282 FDDPOYWFJUQSFO-QGZVFWFLSA-N 377.831 5.113 30 20 GKED C=CCN(Cc1nc(-c2ccc(C(F)(F)F)cc2)no1)Cc1cccs1 644899342 QWZJPBOEPNOYLP-UHFFFAOYSA-N 379.407 5.005 30 20 GKED C=CCOc1ccc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1Cl 678296534 FTNQQDMWVFJLBO-RYUDHWBXSA-N 387.751 5.077 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(OCc2ccc(F)cc2)CC1)c1ccccc1 681667670 RGWLWGHXFVCFSC-HSZRJFAPSA-N 381.491 5.083 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1 726846189 BCEUZJCIMUXLJG-UHFFFAOYSA-N 397.544 5.129 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 727955661 MIXVRWQZWFOFID-YWZLYKJASA-N 390.508 5.361 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1 728698418 JXUDEQSFUFXCLQ-JZUUQJBKSA-N 387.410 5.805 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 729070529 XCHXYEHTVZUIQD-CJNGLKHVSA-N 389.282 5.225 30 20 GKED CCc1ccc2c(CNc3cccc(Oc4ccc(C#N)cc4)c3)cc(=O)oc2c1 729676968 WFBLPMTUTWAIMR-UHFFFAOYSA-N 396.446 5.631 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680112 QOZIKWKKROJIFM-KSSFIOAISA-N 377.410 5.120 30 20 GKED N#Cc1ccc2ncc(/C=C/C(=O)c3ccc(Oc4ccccc4)c(F)c3)n2c1 736434848 XBWKBNRXSUYDKR-CMDGGOBGSA-N 383.382 5.033 30 20 GKED COc1cc(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1C 741389440 BXLPFUBPCDIYPL-HSZRJFAPSA-N 399.494 5.023 30 20 GKED COc1cccc([C@H](Nc2snc(Cl)c2C#N)c2ccccc2Cl)c1 742413005 RSFKSZDOMYFCEP-INIZCTEOSA-N 390.295 5.532 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cccc(NCC(C)(C)C)c2C)c1 757382645 QTVQZYDGDDKGHD-LJQANCHMSA-N 393.531 5.064 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 758907473 JRBJPTRWSCETGN-ROUUACIJSA-N 376.456 5.318 30 20 GKED CC(=O)CCCCCCC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 764456389 JHEIBUXUSRBKPX-UHFFFAOYSA-N 382.435 5.358 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 764840050 MIXVBKYKGGMYJG-HSZRJFAPSA-N 395.462 5.010 30 20 GKED N#CC1(COC(=O)c2ccccc2C(=O)c2ccc(Cl)c(Cl)c2)CCC1 768084711 PHQHFFORIAMNBJ-UHFFFAOYSA-N 388.250 5.075 30 20 GKED N#Cc1cc(Cl)ccc1-n1ccc(NCc2ccc(CSC(F)F)o2)n1 782390986 DEISOCARIQGMIJ-UHFFFAOYSA-N 394.834 5.058 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1CN(CC)C(=O)OC(C)(C)C 785822524 YWOXPMKWYRUPOX-GOSISDBHSA-N 387.524 5.016 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)N[C@@H](CCC#N)c1ccccc1 793714504 VUILPYCHTDHEEA-FQEVSTJZSA-N 393.487 5.117 30 20 GKED Cc1nn(C(C)C)cc1/C=C1/Cc2c(Cl)cc(Br)cc2C1=O 798370485 OCLVULFUYGVYHO-WCIBSUBMSA-N 379.685 5.011 30 20 GKED C#Cc1ccccc1CC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 812981908 MQVDCFIRUATAFD-UHFFFAOYSA-N 386.451 5.265 30 20 GKED CC(C)(C)c1ccc([C@@H](O)CCC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 817319608 QAJZDXHNOYHNPW-GOTSBHOMSA-N 392.543 5.349 30 20 GKED CC(C)(NC(=O)Nc1cccc(C2SCCS2)c1)c1cccc(C#N)c1 854250387 BNDNMDHQAMFMAP-UHFFFAOYSA-N 383.542 5.094 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CSCc3ccc(F)cc3)n2)cc1 915102172 SUAOMXGJKYTVSL-GOSISDBHSA-N 396.512 5.367 30 20 GKED Cc1ccc(/C=C\C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(Br)c1 916849134 POSFGAHEUJEBQG-FPISAVPCSA-N 391.268 5.195 30 20 GKED COc1cc(C=NNCc2ccccc2Cl)c(-c2ccccc2)cc1OC 918152938 OUIVTMWXBJSRMG-UHFFFAOYSA-N 380.875 5.148 30 20 GKED O=C(O)c1cc2c(C=NNc3cc(Cl)cc(Cl)c3)c(F)ccc2s1 1776058567 RXWLGDKROIDZJB-UHFFFAOYSA-N 383.231 5.491 30 20 GKED CCCCCCCOc1cccc(CN[C@@]2(C(=O)O)C[C@]2(C)c2ccccc2)c1 1776787476 YUWQHQASBZNDSS-JWQCQUIFSA-N 395.543 5.310 30 20 GKED CCN(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776855345 CIFFIIUKUGZVQV-FMQZQXMHSA-N 385.463 5.404 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(N(C)Cc2cccs2)cc1 1777436256 ZTYDNYVDQSMXCD-XYOKQWHBSA-N 391.492 5.287 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)[C@H]3CC=CCC3)CCC2)cc1 1789455995 ICNLSIMIDPANIJ-UGKGYDQZSA-N 392.543 5.245 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(C)cs2)cc(Cl)c1OCCC(C)C 41520999 PHLYSJMDBUQFDC-CQSZACIVSA-N 392.908 5.029 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc2ccccc2c1 109002853 SDGWKZJUZTXRGU-INIZCTEOSA-N 375.497 5.285 30 20 GKED CCCN(Cc1ccccc1O)C(=O)Nc1ccccc1S[C@@H](C)CC#N 118822043 FOYHSJQYGLOHTM-INIZCTEOSA-N 383.517 5.231 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 123095637 GJUBUAMPXDRZCL-CXAGYDPISA-N 388.920 5.425 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Br)cc2F)c1 127926272 RTVATCDXZHEHMN-XJKSGUPXSA-N 391.284 5.120 30 20 GKED CN(C[C@H]1CCCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 128428065 FLTWMRWXLWMRLE-UYAOXDASSA-N 397.906 5.028 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nccs1 152800363 NVCZSUVUMMHAFZ-KRWDZBQOSA-N 378.457 5.080 30 20 GKED N#Cc1ccc(C(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1Cl 159222153 VKAQXAWHMDQOPD-UHFFFAOYSA-N 387.870 5.078 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc2nc(C(F)(F)F)ccc2c1C 189947257 SRYFGNOWBAVWKG-UHFFFAOYSA-N 383.439 5.168 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 213973733 MZDKRBUNYWDUNG-MLPAPPSSSA-N 399.406 5.219 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2cc(C)nc3c(F)c(F)ccc23)ccc1OC 302697973 FBDQLLMPDDNPAF-OAHLLOKOSA-N 397.425 5.123 30 20 GKED O/C(=N/CCc1cccc2[nH]ccc12)[C@H]1CCn2c(cnc2C2CCCCC2)C1 328647934 HVOPFBMOJFNZFV-IBGZPJMESA-N 390.531 5.174 30 20 GKED COc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/Cc5cnc(C)s5)(C4)C2)C3)cc1 328658532 REUXARHSUCCCEI-TWVWUCKLSA-N 396.556 5.455 30 20 GKED CC(=O)N1CC[C@@H](/N=C(/O)c2cc(C3CC3)nc3ccc(C)cc23)c2ccccc21 328806264 LCNBPGBZRYNAKT-JOCHJYFZSA-N 399.494 5.223 30 20 GKED COc1ccc(Cl)cc1C/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329485438 FYHUYHFVBXVKKV-SFHVURJKSA-N 387.911 5.237 30 20 GKED Cn1c(C(C)(C)C)nc2cc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)ccc21 330021481 XXAMCMSCHDJJLN-UHFFFAOYSA-N 396.535 5.384 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)C3CCC(OC(F)F)CC3)c2C#N)[C@H](C)C1 410991499 VHGULLMIYXIQJL-ZFDZMSFRSA-N 382.476 5.042 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@H](CC#N)c1ccccc1 425082497 GCJRIBVNNFRHKB-LPHOPBHVSA-N 399.416 5.034 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)c1ccccc1Oc1ccccc1C#N 427773930 AIARDQBFZZTPFU-UHFFFAOYSA-N 381.435 5.104 30 20 GKED C=CCn1c(S[C@@H]2CC[C@H](C#N)C2)nc2scc(-c3cccs3)c2c1=O 430090246 PVPPIJYFZBDESN-QWHCGFSZSA-N 399.566 5.157 30 20 GKED N#CCCC[C@H](NC(=O)NCCc1cc(Cl)cc(Cl)c1)c1ccccc1 431872695 UYZNAKASOFSAOE-IBGZPJMESA-N 390.314 5.270 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccc3)c2)[C@H]1c1ccncc1 432685823 IDHCPGWZHXBKAC-QHCPKHFHSA-N 381.479 5.096 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)C1 433148162 FYPQUGZMSMAKDX-IEBWSBKVSA-N 379.529 5.492 30 20 GKED C=CCOc1ccccc1CN[C@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1 433406057 LMIYZZBUNUZQBA-WIYYLYMNSA-N 399.506 5.189 30 20 GKED Cc1nc(-c2ccccc2NC(=O)Nc2cccc(OCCCC#N)c2)cs1 433810081 YESMYHIAXYHESS-UHFFFAOYSA-N 392.484 5.445 30 20 GKED Cc1c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cnn1-c1ccccc1 435342528 GXRHUFQUEPFIAE-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccccc2Br)o1 436131401 LYKVTSXEMGIOHT-UHFFFAOYSA-N 380.311 5.311 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 437030096 IUSMWCLKJLAABR-YVEFUNNKSA-N 386.339 5.921 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 437832473 GNPUOJYOEPAWJQ-INIZCTEOSA-N 383.517 5.346 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)C(=O)Nc1cccc(F)c1 439669650 HCGZDIRSOJESQE-CQSZACIVSA-N 393.393 5.068 30 20 GKED C[C@@H](NCc1cnc(C(F)(F)F)s1)c1ccc(-c2cccc(C#N)c2)cc1 443980299 AQUGBEOACNWRAX-CYBMUJFWSA-N 387.430 5.551 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)c(Cl)c1 452650364 KVOXAUGEYRFMKN-LSDHHAIUSA-N 394.780 5.047 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(Cl)c1 457585150 RYCWMAVHJFBTSD-CQSZACIVSA-N 388.920 5.774 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3cncc4ccccc34)cc2)cc1 462515961 YHSKDDOWUFIQME-UHFFFAOYSA-N 393.446 5.470 30 20 GKED N#Cc1ccc(NC(=O)c2sc3ccccc3c2Br)cc1Cl 463094791 CBAKTTUXYYVGQZ-UHFFFAOYSA-N 391.677 5.441 30 20 GKED Cc1nc2cc(C(=O)Nc3sc4c(c3C#N)-c3ccccc3CC4)ccc2o1 470832248 PYDHXRWOGBTVGQ-UHFFFAOYSA-N 385.448 5.087 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 471166645 WMXIIFFUQQTSJI-UHFFFAOYSA-N 375.472 5.089 30 20 GKED Cc1ccc(CCC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)o1 471296757 OCSSSLZOSPJDBZ-UHFFFAOYSA-N 376.431 5.073 30 20 GKED CCC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 471335249 HDRAMKUQRUAVKQ-UHFFFAOYSA-N 384.435 5.504 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)N2CCC[C@H]2/C=C/c2ccccc2)c1 475808223 JBTHMKQNRCFWBW-LEQVUBRHSA-N 398.462 5.048 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1Oc1cc(F)cc(F)c1)c1ccccc1 476331736 CIDDWVRKHPWBGA-KRWDZBQOSA-N 392.405 5.783 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc(Cl)c1F 477018499 JUPLOESRCYZJEU-UHFFFAOYSA-N 394.833 5.491 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)c1ccc(Sc2ccccc2C#N)cc1 480718631 WKKHYXPCHPWICQ-UHFFFAOYSA-N 387.508 5.155 30 20 GKED CC1(C)CC[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc21 481996581 DHYNXLICGJOQDA-JOCHJYFZSA-N 387.527 5.494 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(OC(C)C)c1 483203309 VJDUSHKKXSHJPP-OAQYLSRUSA-N 388.467 5.301 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(Cc2cccc(F)c2)n1)c1ccccc1 487174505 FASMWKRGWIKPTP-LJQANCHMSA-N 393.487 5.038 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Cl)c(Br)c1)c1ccccc1 487500251 JMNMIUDDILJPPJ-QGZVFWFLSA-N 391.696 5.267 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1coc(-c2cccc(Cl)c2)n1 488826245 ZHAUVAWMDFPNSP-UHFFFAOYSA-N 395.793 5.573 30 20 GKED C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)o1 499837941 JIXPAYCJBBSOEO-FSPSUXSGSA-N 389.282 5.194 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](Cc2ccccc2)c2ccccc2)cc1 503789698 HLSSBNXECAEVNP-HSZRJFAPSA-N 383.495 5.593 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1 509545269 SJWPUPHLTXCHNM-MRXNPFEDSA-N 379.529 5.105 30 20 GKED FC(F)Oc1ccc(CN[C@@H](c2ccc(OC(F)F)cc2)C(F)(F)F)cc1 510462678 YLFBQBUQKUOYSJ-AWEZNQCLSA-N 397.290 5.283 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510676479 YDWSBUCICFVSKU-HNNXBMFYSA-N 389.480 5.563 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1ccc(Cl)c(Cl)c1 511012878 KEIQMRBJEVHYRW-CYBMUJFWSA-N 392.286 5.115 30 20 GKED CCCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)c1 512499628 PWNMAIVATRUZCZ-IBGZPJMESA-N 392.480 5.098 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4nccs4)cc3)cc2)nc1 518373411 NYMHOFOPQUDQTO-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)cc2)cc1 519026546 LNRGLIIOMZPERB-JKSUJKDBSA-N 388.389 5.658 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCSc2c(F)cccc21 519894337 PISHQHMQKODKJF-HXUWFJFHSA-N 397.519 5.102 30 20 GKED CCC[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 520208556 NLTJEYCSNMSXAE-LJQANCHMSA-N 390.314 5.548 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1nc(C(C)(C)C)cs1 524672594 JWEIOBFHEQVCCV-HNNXBMFYSA-N 389.524 5.470 30 20 GKED C=CCC1(C(=O)N2CCC(Cc3nc(C4CCCC4)no3)CC2)CCCCC1 529639851 RMLOGHKZOKZGBV-UHFFFAOYSA-N 385.552 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccc(F)cc2F)c1C 530560828 XZPWQQIFEQIIOG-UHFFFAOYSA-N 395.453 5.563 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(Oc2ccc(C(C)C)cc2)CC1 531081471 QJLMUUXQYZCISF-UHFFFAOYSA-N 377.488 5.065 30 20 GKED C[C@H]1CSc2ccc(Br)cc2[C@@H]1NCc1ccc(C#N)cc1F 532567020 FJBQGUCSDPYJPG-BBATYDOGSA-N 391.309 5.033 30 20 GKED Cc1cc([C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)ccc1F 534036602 RCXLORBNFLASBN-QKKBWIMNSA-N 397.519 5.659 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H](c3cccnc3)C3CC3)cc2)cc1 534777038 PALSBQXMMBUMIZ-QFIPXVFZSA-N 384.439 5.018 30 20 GKED 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5.469 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)CCc2[nH]c3ccc(F)cc3c21 753142380 OIPMRUDNKJPSEE-FMIVXFBMSA-N 375.428 5.038 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CCC(C(F)(F)F)CC2)cc1 766397536 AUAFLZOZBFZYDO-AFMYVXGZSA-N 386.417 5.649 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCC(=O)c3cccc(F)c3)n2)cc1 767433596 VOCQBAZOXLALCL-GOSISDBHSA-N 392.455 5.097 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccn(-c3ccc(Cl)cc3Cl)n2)cc1 772612388 MUHJGHPJOUGTHU-UHFFFAOYSA-N 399.281 5.048 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)sc1-c1cccc(Cl)c1 780166973 YHVNCSHGUDNDHI-CQSZACIVSA-N 396.899 5.920 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1c(C)noc1C1CC1 783894358 HLYNOKSSLIQVRE-UHFFFAOYSA-N 389.430 5.027 30 20 GKED CC1CCC(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 796635963 VYRTUYPBQXKDSZ-QWFMPGPPSA-N 388.920 5.235 30 20 GKED N#CC[C@@H](CC(=O)O[C@H](c1cccc(Cl)c1)C(F)(F)F)c1ccccc1 796694189 VITJBSWIOJRIJY-KBXCAEBGSA-N 381.781 5.574 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 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5.241 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 68360864 UKBVXUXJZISQOJ-QZTJIDSGSA-N 385.467 5.137 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2Cl)cc1Cl 107647461 RBSVBXIZKUNBQJ-GOSISDBHSA-N 399.252 6.040 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1nc(-c2cccc(C(F)(F)F)c2)no1 114747467 GVKCSGKXMBOAIO-OLZOCXBDSA-N 386.377 5.039 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)Nc1cccc(OCCCC#N)c1 120607998 ZJGWSSLLUVAOTA-MSOLQXFVSA-N 379.504 5.322 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1ccc(C#N)cc1 126845799 XUBZGGMUSOGNPV-OAHLLOKOSA-N 376.485 5.215 30 20 GKED Cc1cc[n+](/C(C(=O)c2sc3ccccc3c2C)=C(/S)NC(C)(C)C)cc1 127678652 RHJYSQLQWCCMBI-UHFFFAOYSA-O 397.589 5.133 30 20 GKED C=CCCCCCN(C)C(=O)c1cccc(C)c1NC(=O)c1ccccc1F 128756183 JCZBIWYIUNMLEB-UHFFFAOYSA-N 382.479 5.205 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1c[nH]c2ccc(Cl)cc12 151831536 TVZUPDNORDCPEC-ZDUSSCGKSA-N 383.904 5.254 30 20 GKED Cc1cccc2c(CCNC(=O)Nc3ccccc3SC[C@H](C)C#N)c[nH]c12 173115151 ALZNVDUSOSKCPB-OAHLLOKOSA-N 392.528 5.092 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1 173730218 VQRCDVKJMMPJSB-AWEZNQCLSA-N 383.439 5.011 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c(F)c1 176077605 PDDCFAHIXKMXGP-GOSISDBHSA-N 388.826 5.071 30 20 GKED N#CCCCCN[C@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 178641853 OPRRUHBYGXXZGY-HNNXBMFYSA-N 390.350 5.233 30 20 GKED CCC[C@H]1C[C@@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 183387202 AYCRYXQEJUQBSE-ICSRJNTNSA-N 378.472 5.193 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)c1nc2ccccc2n1C 191511576 ODJHNYUVUWAPTL-UHFFFAOYSA-N 390.531 5.482 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)c(F)c2)ccc1OCc1ccccc1 192151114 FVNHLHGTPNHPKI-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#CCN(C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)c1ccccc1 215738657 SPMOHBXQAYTLEW-UHFFFAOYSA-N 397.453 5.463 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](c1ccccc1)c1ncc[nH]1 297961796 XYWLXJLAZLMILK-JOCHJYFZSA-N 388.515 5.515 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c1 304053101 PDGWUDYOOKZCRQ-OALUTQOASA-N 389.282 5.418 30 20 GKED C[C@H](NCc1cnc([C@H]2CCCO2)s1)c1ccc(-c2cccc(C#N)c2)cc1 374696866 ZAPDKCHSMMGKOZ-KSFYIVLOSA-N 389.524 5.384 30 20 GKED N#Cc1cnc(Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)c(Cl)c1 432926733 IDTFOZXCLGQCEX-UHFFFAOYSA-N 392.633 5.239 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c[nH]nc2-c2ccccc2)cc1F 437487939 VBMYTYMKJWZUEB-UHFFFAOYSA-N 398.397 5.132 30 20 GKED CC[C@H](c1ccccc1)c1nnc(Sc2ccc(C(F)(F)F)c(C#N)n2)o1 443512100 RWXDTOOXPZQHEC-GFCCVEGCSA-N 390.390 5.048 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSC1CCC(C(F)(F)F)CC1 451039766 DYIZFZWFCLHZSQ-UHFFFAOYSA-N 376.831 5.004 30 20 GKED C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1C(=O)c1cn(CCCC#N)c2ccccc12 452234105 WQNXYWQJIMOVFQ-ARFHVFGLSA-N 391.437 5.137 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 469959699 NZJFHSNFJBZGPJ-MRXNPFEDSA-N 398.528 5.521 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 473370396 ZZFYLXPPTMBBNK-JOCHJYFZSA-N 391.559 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCCOc1ccc(F)cc1 475553746 GKOKOBSQPCJRPW-UHFFFAOYSA-N 384.495 5.610 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccccc1OC(F)F 476171687 ZYIMDGQGVXHWON-MOPGFXCFSA-N 385.454 5.882 30 20 GKED CCc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 477012291 OTQRFYZUNMGOIW-QGZVFWFLSA-N 392.890 5.114 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@H]1c1ccccc1 480590712 ZLLCAUNDOJIYPI-UZUQRXQVSA-N 383.451 5.575 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)[C@@H](C)Oc3ccc(C#N)cc3)c2)C1 499170055 OXMLBUKKRLMJCE-PNCHPQGNSA-N 392.499 5.060 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cccc(C#N)c2)c(C(F)(F)F)c1 499580092 GXFPADKZYSXGBG-LBPRGKRZSA-N 378.419 5.720 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 506325115 KKEQCTFGWKYGEH-UHFFFAOYSA-N 391.279 5.649 30 20 GKED CCCN(CCC(=O)Nc1sccc1C#N)[C@H](C)c1cc2ccccc2o1 507021934 PKINEVSKNGNGSO-OAHLLOKOSA-N 381.501 5.168 30 20 GKED Cc1ccc(CNC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c(C)c1 509906498 ZYIAEYSMXJKQMA-UHFFFAOYSA-N 399.494 5.270 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2sc3c(c2C#N)CCCC3)s1 511922709 MPEORNSABXBNQJ-UHFFFAOYSA-N 379.510 5.183 30 20 GKED N#Cc1c(NC(=O)c2csc(Cc3ccccc3)n2)sc2c1CCCCC2 512138079 KRMNNVZTFPBVNQ-UHFFFAOYSA-N 393.537 5.188 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518757165 ZHRWXHFMHPPAQX-UHFFFAOYSA-N 391.858 5.668 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)C(C)(C)c1ccccc1 520197924 UEWFSIPEVUYLRM-IRXDYDNUSA-N 381.545 5.569 30 20 GKED COc1c(F)cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1F 521091092 DYHIGCUHVRGADL-UHFFFAOYSA-N 394.377 5.084 30 20 GKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Oc2cccnc2)cc1 521663020 GVIRMCGPRQBPQS-NQIIRXRSSA-N 385.467 5.139 30 20 GKED N#C[C@@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(Cl)c1Cl 524572864 ZBVXRXQDACGXCE-MRXNPFEDSA-N 381.690 5.351 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2cccc(CC#N)c2)C(C)C)cc1 525594118 IDRWBLYZFINXFW-UHFFFAOYSA-N 398.506 5.479 30 20 GKED CCC(C#N)(CC)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 528811450 JSBKKNBBYPRXCI-LBPRGKRZSA-N 375.925 5.279 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N[C@H]2CCCC(F)(F)C2)cc1Cl 534154850 UKVJJPCWHJDLFL-HNNXBMFYSA-N 390.817 5.312 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1)c1ccccc1 534625537 JOROROGWZIWTEO-MRXNPFEDSA-N 384.907 5.024 30 20 GKED N#CCCn1cc(CN2CC[C@H](c3ccc(Cl)cc3)C2)c(-c2ccccc2)n1 536671284 FUGODSOZWSBFMM-FQEVSTJZSA-N 390.918 5.107 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 539656935 BIWWNDPQMIKMQF-GOSISDBHSA-N 396.490 5.408 30 20 GKED N#CCCCOc1cccc(CN2CCCC[C@H]2c2nc3ccccc3o2)c1 539863656 NAUJKMKPHLJVCK-NRFANRHFSA-N 375.472 5.238 30 20 GKED C[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1Oc1ccccc1 540353264 DRCDJSZLZGXXEM-KRWDZBQOSA-N 396.450 5.251 30 20 GKED N#CCC1CCN(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)CC1 541020218 ZOLLLGASCCQUDY-KRWDZBQOSA-N 399.844 5.145 30 20 GKED COC(=O)c1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1F 541086162 NVIHPHUXUSMLIF-INIZCTEOSA-N 388.442 5.002 30 20 GKED CC(C)OCCCc1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 545762505 LBWVAYUNEDTJKW-UHFFFAOYSA-N 397.862 5.412 30 20 GKED C=C(C)Cn1c([C@@H](C)CC)nnc1N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 549665555 PQIQZEFTTPTTKX-HOTGVXAUSA-N 397.498 5.032 30 20 GKED COc1ccc(F)c(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 549816657 SPINBWDUBZUFNI-INIZCTEOSA-N 395.318 5.636 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CCCC(F)(F)F 551542375 FMROONSTELINAV-UHFFFAOYSA-N 395.265 5.415 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(F)cc(F)c1F 554354190 GPOCQMSVCNNICO-UHFFFAOYSA-N 384.382 5.379 30 20 GKED CCSc1cccc(Br)c1NC(=O)c1ccc(C#N)c(Cl)c1 563660296 QHSVFVCHLPPNEF-UHFFFAOYSA-N 395.709 5.338 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CC3(CCCCC3)C2)cc1 573374188 FOUZJQPHOHGRKP-UHFFFAOYSA-N 389.499 5.130 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1ccccc1)c1cccc(C#N)c1 589789476 LECRMPQMUALPQJ-PMACEKPBSA-N 383.495 5.592 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CC3(CC=CC3)[C@@H]2c2ccccc2)c1 592901267 KTOBDVYFUCJZMH-DEOSSOPVSA-N 386.495 5.027 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1Cl 594735732 PADKVNOPQKOQTD-UHFFFAOYSA-N 395.934 5.426 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2nccc3ccccc23)CC1 602259599 JSTIZOPWTOFVNP-MRXNPFEDSA-N 387.508 5.157 30 20 GKED CC(C)CN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccc(C#N)cc1 603529897 RMWQGWJAZSFZJQ-UHFFFAOYSA-N 397.478 5.113 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCc1c[nH]c2ccccc12 603968537 YVDVMZYQGPTVPK-UHFFFAOYSA-N 385.492 5.729 30 20 GKED Cc1cccc(O[C@@H](C)C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1 603991763 QITUWGJCRTUGMC-HNNXBMFYSA-N 388.492 5.100 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)Nc2cc(C#N)ccc2OC(C)C)s1 604342907 ANGZLBQSZGNTMB-UHFFFAOYSA-N 397.525 5.020 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCc3ccccn3)cc2Cl)cc1 609200821 FYFFLIIVACBNII-UHFFFAOYSA-N 391.858 5.360 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 609435173 WESXETRGQBBWFI-XLIONFOSSA-N 381.545 6.086 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cnc(-c4ccsc4)s3)n2)cc1 609566143 RBTMLGOJPXDCMN-UHFFFAOYSA-N 394.506 5.119 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccc(Cl)cc2)c2ccccc2Cl)cn1 609642779 NJHCDLCFHAJJOU-UHFFFAOYSA-N 382.250 5.107 30 20 GKED COc1ccc([C@@H](C)CCNC(=O)c2ccccc2-c2ccccc2C#N)cc1 610185708 OWKDGZWMBNORFJ-SFHVURJKSA-N 384.479 5.157 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(Cn2cnc3ccccc32)c1 611391953 CHIRXRIFDAQCQW-XMMPIXPASA-N 392.506 5.123 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(-c2ccccc2)s1 612571060 OGBLIBZZJFQTAA-QGZVFWFLSA-N 388.540 5.001 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4ccc5ccccc5n4)cc3c2C1 613291227 WTGXVMAKXYAOCQ-FOIQADDNSA-N 379.463 5.331 30 20 GKED N#Cc1ccc(C(F)(F)F)c(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 613873621 AJKZZUJRSLXVOF-AOOOYVTPSA-N 390.249 5.144 30 20 GKED C[C@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 615939962 NUMGNISNYLFPKR-PBOSXPJTSA-N 399.350 5.345 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)F 619312656 ZVUMORYVUSDDRI-OAHLLOKOSA-N 377.822 5.161 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 683150341 ZAXDYHJURAKINE-SECBINFHSA-N 392.290 5.583 30 20 GKED CN(Cc1ccc(Cl)cc1Cl)C(=S)Nc1ccc(C#N)c(Cl)c1 726443650 DQWHJWXOZFNWCN-UHFFFAOYSA-N 384.719 5.347 30 20 GKED C[C@H](NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccs1 726461196 WCGBZPBRCRTVGL-HNNXBMFYSA-N 393.537 5.246 30 20 GKED C[C@H](N[C@@H](C)c1csc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 730022587 OUYUHQDBCNMMQC-STQMWFEESA-N 383.904 5.104 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3cccc(OCC(F)(F)F)c3)c2c1 734306611 HKWUZFBIDYVNJX-VMPITWQZSA-N 375.346 5.014 30 20 GKED O=C(/C=C\c1cn(Cc2ccccc2)nc1-c1cccs1)c1cncc(F)c1 737444410 REZGAYOCANHQAN-HJWRWDBZSA-N 389.455 5.090 30 20 GKED Cc1cc(C)cc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c1 739437064 INAQEYYNXGMIFO-UHFFFAOYSA-N 377.538 5.390 30 20 GKED C=C(C)CNC(=S)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 741860705 HTRSHTCCEPFROI-UHFFFAOYSA-N 396.535 5.594 30 20 GKED C[C@H]1/C(=C/c2cccc(OCCCC#N)c2)C(=O)c2cccc(Br)c21 742435739 XRLNEVQTAMMZKC-RVAQLADHSA-N 396.284 5.515 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 743709016 PYHWANIVHCEHMW-LIRRHRJNSA-N 387.405 5.185 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)C2)cc1 752484997 KMBOESHJGNRJIY-ZCYQVOJMSA-N 395.506 5.672 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c(Cl)c1 754423803 VAJTZLUDZDHHPW-UHFFFAOYSA-N 394.689 5.371 30 20 GKED CCCCCCCCNC(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 754866446 VBPAJVMUIMKWHC-CHWSQXEVSA-N 376.385 5.119 30 20 GKED COc1cccc(C2(NC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)c1 758535418 LZEWNSAAKBAQAL-QHCPKHFHSA-N 397.478 5.161 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cs1)c1nc(-c2c(F)cccc2F)cs1 759453846 DSKDCQAKVXBDGO-SECBINFHSA-N 380.828 5.293 30 20 GKED COc1ccc(/C=C2/CCc3ccc(Cl)cc3C2=O)cc1OCCCC#N 761206130 OFIHGZKXSQCJDM-ATVHPVEESA-N 381.859 5.244 30 20 GKED COc1ccc2cc(/C=C/C(=O)c3cc(Br)ncc3F)ccc2c1 762427529 VGPZFNCSJIQWRG-XVNBXDOJSA-N 386.220 5.041 30 20 GKED Cc1cc(Cl)c2ccccc2c1NC(=O)Nc1ccccc1O[C@@H](C)C#N 765348431 LIBQABWBGPPPJH-AWEZNQCLSA-N 379.847 5.737 30 20 GKED CC(C)(C)c1ccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)s1 769796693 LTOWWRNRZHWPOG-UHFFFAOYSA-N 390.965 5.465 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccoc2Br)s1 770181840 ZRPPPGWTPJZCTL-UHFFFAOYSA-N 386.315 5.049 30 20 GKED CCCCCCCCCCC(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCCCC1 770922994 SYACZPAFHFDMAT-OAQYLSRUSA-N 390.612 5.158 30 20 GKED Cc1nc2ccccc2n1CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772160685 DJQQNBGRIRBCPB-QFIPXVFZSA-N 394.478 5.029 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 774037781 OPTOPDZIHVQLNN-CQSZACIVSA-N 393.468 5.133 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3cccs3)cc2F)C(=O)c2ccccc2C1 778519578 IVAJADQFIIXJGV-ODLFYWEKSA-N 391.467 5.183 30 20 GKED O=C1/C(=C\c2ccc3cnccc3c2)CCOc2ccc(Br)cc21 782321550 BEOUYZJHZFVMTC-GDNBJRDFSA-N 380.241 5.046 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC=C(c3ccccc3)C2)cc1 782552903 LQUXDAMKRHEBIN-XMMPIXPASA-N 379.463 5.273 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782708006 BINPISPFLSPPOL-RTBURBONSA-N 389.421 5.441 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC(C)(c2ccc(Cl)cc2)CC1 791861151 HIBXITADBFMHOD-MRXNPFEDSA-N 397.906 5.216 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792096061 ZGBKUVCXPBMUCM-MOJYJUKOSA-N 381.262 5.821 30 20 GKED CCc1c(C(=O)/C=C\c2csc(N(CC)C(C)=O)n2)oc2ccc(C)cc12 797148819 HTRABISWSPEUCK-HJWRWDBZSA-N 382.485 5.029 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C\Sc2cc(F)ccc2F)s1 797964251 FPRJWJQNTODNES-DGMVEKRQSA-N 378.469 5.201 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 801896916 APFSXYHZEYCNCO-HNNXBMFYSA-N 390.418 5.131 30 20 GKED N#C[C@H](C(=O)C1(c2cccnc2)CCCC1)c1nc2cc(Cl)ccc2s1 808978178 FPHHGBGTTAMHSF-OAHLLOKOSA-N 381.888 5.033 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(C#N)cc2C(F)(F)F)ccc1SC 811689857 NOFIXMMLSOCNEY-FNORWQNLSA-N 377.387 5.204 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)OCC[C@H](c3ccccc3)C(F)(F)F)CC2)c1 816476663 FVPFLOWBCKVPKJ-GOSISDBHSA-N 391.364 5.008 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)CC2(C#N)CCCCC2)cc1 829175933 PNKWIOYMVCJHHO-INIZCTEOSA-N 385.508 5.075 30 20 GKED CC(C)(C)Sc1c(F)cc(NC(=O)N(CCC#N)Cc2ccco2)cc1F 836725593 NSAZROFYQBMBRV-UHFFFAOYSA-N 393.459 5.396 30 20 GKED CC(C)Cc1nc(C#N)c(NN=C(CCC(F)(F)F)CCC(F)(F)F)o1 853296205 GEISQOFKZHKBGV-UHFFFAOYSA-N 384.324 5.198 30 20 GKED Cc1c(NCc2ccc(C3(C#N)CC3)cc2)cccc1NC(=O)OC(C)(C)C 858232819 FLHURSFQDVXOFN-UHFFFAOYSA-N 377.488 5.509 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1cc(-c2ccc(Cl)cc2)no1 913029467 OUGMERPCFBTRNF-UHFFFAOYSA-N 380.753 5.565 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC(F)F)cc2)cc1 915087925 CKBDUJXZKHTKIQ-FQEVSTJZSA-N 378.378 5.196 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915352889 KJEBEFAKUWPWGU-MHECFPHRSA-N 399.494 5.623 30 20 GKED O=C(/C=C\c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccnc1 916136989 DISDLHXGFDLUMP-UITAMQMPSA-N 380.787 5.332 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ncc(Cl)cc3Cl)cc2)cc1 1776022198 YZEKPVDCPMOCKN-UHFFFAOYSA-N 386.238 5.200 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1sc2ccccc2c1C(=O)O 1776032654 HMNBKRMJVOOHJO-UHFFFAOYSA-N 379.268 5.742 30 20 GKED CCCCCCCOc1ccc(C(C)=NNc2ccc(C(=O)O)cc2OC)cc1 1776049768 APDYRKWUKDLTQL-UHFFFAOYSA-N 398.503 5.579 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1ccc(C(=O)O)c(F)c1 1776076314 HYBVNWFVLZCTSF-UHFFFAOYSA-N 398.821 5.724 30 20 GKED O=C(O)Cc1ccc(NN=C/C=C\c2ccc(OCc3ccccc3)cc2)cc1 1776085506 QTVCLCSNZNTSCD-RJGAVAOUSA-N 386.451 5.004 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(O)c(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269202 GBKIANNVURDUMK-SOFGYWHQSA-N 392.495 5.508 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)cc1 1776700062 SKYWCADNUIVXFG-STRFDMGBSA-N 387.273 5.557 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)c(OCCC)c(OC)c1 1776782855 GTZABYGVLWOVQP-KRWDZBQOSA-N 399.959 5.431 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)o1 1777424593 VSNOKURCEWBIBY-RDPWEWGOSA-N 376.383 5.232 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2ccc(Cl)cc2)[n+]2ccccc2)c(C)c1 7611239 UKWRUTMPOBCBHJ-UHFFFAOYSA-O 395.935 5.295 30 20 GKED C=CCNc1nnc(SCC(=O)Nc2c(C(C)C)cccc2C(C)C)s1 11393729 IBGSIWBLEIKRQB-UHFFFAOYSA-N 390.578 5.114 30 20 GKED C[C@H](NC(=O)Nc1ccccc1CN(C)C1CCCCC1)c1ccc(C#N)cc1 43390759 GXBKAOOOFKCIEQ-SFHVURJKSA-N 390.531 5.205 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 47159464 RFFVJHAFERUSPZ-QFIPXVFZSA-N 389.886 5.143 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccccc2Cl)cc1 55823647 NSSOPMDCIDOHQF-UHFFFAOYSA-N 376.843 5.237 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(OC(F)F)cc1 66954185 BGSLGCBADUPGRM-ZDUSSCGKSA-N 391.443 5.004 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(NC(=O)OCC(C)C)c1 67585477 XYACAUVZWVWNQP-UHFFFAOYSA-N 387.505 5.173 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Sc2nc3c(cc2C#N)CCCC3)c(Cl)c1 97061376 IPSOCVUYPLTLSU-CQSZACIVSA-N 399.947 5.222 30 20 GKED C=CCn1c(C)nnc1SCC(=O)c1cc(C)n(CCC2=CCCCC2)c1C 104588601 QLVFUVXKTNMXJI-UHFFFAOYSA-N 398.576 5.056 30 20 GKED CCSc1ccc(Cl)cc1NCC(=O)Nc1ccccc1SCC#N 105397673 LIHXKRVPVGAJFM-UHFFFAOYSA-N 391.949 5.118 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1ccccc1SC[C@H](C)C#N 108237335 BZFVRBPXIJFBDG-HJUDDPQBSA-N 380.513 5.074 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2)n1 151867507 PLTIVLBFUPORGR-OAHLLOKOSA-N 393.537 5.765 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2ccc(Cl)cc2)n1)Cc1cccs1 180112989 WPALUXULIYBOJG-LBPRGKRZSA-N 388.901 5.064 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCOc2cc(F)ccc21 182338415 IZNIVCCYZANFEP-YOEHRIQHSA-N 399.491 5.113 30 20 GKED Cc1ccc(C)c(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 191884205 WICQENZVQCQTLU-UHFFFAOYSA-N 385.467 5.593 30 20 GKED Cc1oc(-c2cccs2)nc1CC(=O)Nc1ccccc1SC[C@H](C)C#N 264511948 IXZXVHZZWLSNFN-CYBMUJFWSA-N 397.525 5.145 30 20 GKED O/C(=N\C1CCC(/C(O)=N\Cc2cnc3ccccc3c2)CC1)C1CCCC1 328736473 LEEOFZPAEIDHEK-UHFFFAOYSA-N 379.504 5.397 30 20 GKED CC1(C)CCC[C@H](/C(O)=N/C2(c3noc([C@H]4CCCO4)n3)CCCCCC2)C1 328790658 QJVSJDNASMZLJO-DLBZAZTESA-N 389.540 5.644 30 20 GKED OC(=Nc1cccc(/C(O)=N/[C@@H]2CCN(C3CCCC3)C2)c1)C1CCCCC1 329134035 BOMGEWIFHZDKES-HXUWFJFHSA-N 383.536 5.176 30 20 GKED OC(=Nc1ccc2c(c1)OC1(CCCCC1)O2)N1[C@H]2CC[C@H]1c1ccccc12 329497831 GOQYKUYWIVOBBG-OALUTQOASA-N 376.456 5.556 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)/C(O)=N/[C@@H]1CCOC2(CCCCC2)C1 330216841 IBFGVJDCTNTQAS-HZPDHXFCSA-N 387.549 5.085 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 409803983 ZWYVAYVMLIQEOW-MJXNMMHHSA-N 387.310 5.578 30 20 GKED CC(C)CN(C(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccc(C#N)cc1 426113381 KDMGOSKZVQOTKY-UHFFFAOYSA-N 399.416 5.378 30 20 GKED CC(C)COc1ccccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 437825041 WAUBSTSKUIGSEI-TZIWHRDSSA-N 377.488 5.025 30 20 GKED CCCOc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c(C)c1 437890086 ORYLOCOWXQLLPW-RBBKRZOGSA-N 377.488 5.088 30 20 GKED CCn1c(COc2ccc(C)cc2)nnc1SCc1ccc(C#N)cc1Cl 438891015 AQRKYCNBAADXTE-UHFFFAOYSA-N 398.919 5.003 30 20 GKED CCCc1c(NC(=O)Nc2c(C)cccc2CC)cnn1-c1cccc(C#N)c1 439225348 OGVWNAVZSSWJRQ-UHFFFAOYSA-N 387.487 5.211 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 439353439 PXMGRFZLHMCZDM-UYAOXDASSA-N 397.906 5.028 30 20 GKED N#Cc1cccc(SCc2ccnc(-c3ccc(Br)cc3)n2)c1 440863198 UKPXEKYLHCTTPB-UHFFFAOYSA-N 382.286 5.070 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)NCC1CCC(C#N)CC1)C1CC1 442734647 DXIDKUPLSLPVAS-LMDPOFIKSA-N 375.516 5.405 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 443859916 SYDGKJNWHBOLOJ-UHFFFAOYSA-N 397.297 5.610 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(c3ccc(F)cc3C#N)C2)n1 447682985 LWHKBESXZRAWRB-HNNXBMFYSA-N 393.487 5.213 30 20 GKED C[C@H](O)CCCN[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 450722256 ZZFISSZKPCOSDZ-QPUJVOFHSA-N 397.281 5.078 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458797487 GJIXPGCGJYYOPG-GOTSBHOMSA-N 375.516 5.147 30 20 GKED C[C@H](C(=O)N[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462553028 PPEZWEQZKHCBFM-PNHOKKKMSA-N 386.417 5.133 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 463148369 SCLYPKOCOAWHBQ-CQSZACIVSA-N 393.468 5.157 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 464503295 YYOXOPVSTRVHTC-OAHLLOKOSA-N 398.871 5.013 30 20 GKED COc1cc(F)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1F 468378902 ILSRYZLDRNBRKY-UHFFFAOYSA-N 394.377 5.084 30 20 GKED CCCOc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c(C)c1 468918780 IVKKGHZERQDYNN-UHFFFAOYSA-N 375.472 5.295 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@H](C)c1ccc(F)cc1 469436985 SQGYVURTIXVCMR-QGZVFWFLSA-N 377.463 5.307 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cnn(CC(C)C)c1C(F)F 469910136 USQMHBOZTJWOPX-UHFFFAOYSA-N 376.451 5.087 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 474233144 FYDOTESRTQBGSK-UHFFFAOYSA-N 386.329 5.278 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(CSc2ccccn2)c1)c1ccccc1 475438699 IDHBOYXERRBPDS-HXUWFJFHSA-N 387.508 5.400 30 20 GKED COC(=O)[C@H](Nc1cccc(OCCCC#N)c1)c1cc(Cl)cc(Cl)c1 477572595 GQXVRKOHDILFKP-GOSISDBHSA-N 393.270 5.002 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C#N)c(Br)c2)s1 487837555 MQXBSLUPXWLSBO-HNNXBMFYSA-N 390.306 5.060 30 20 GKED CCc1cccc2c(C(=O)[C@@H](NCc3cccc(C#N)c3)c3ccccc3)c[nH]c12 489859446 MZABSOAIINGUST-VWLOTQADSA-N 393.490 5.316 30 20 GKED Cc1cccc(CN(Cc2ccco2)Cc2cn(C)nc2-c2ccc(C#N)cc2)c1 491109339 IHRNUUDVKAZVRE-UHFFFAOYSA-N 396.494 5.063 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](c1cccs1)n1cccc1 498647208 RMQFXXQLMFUKRT-NRFANRHFSA-N 391.540 5.086 30 20 GKED CCOc1ccccc1NC(=O)[C@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 499468253 CEYLDRFKRRHLGS-LBPRGKRZSA-N 394.418 5.095 30 20 GKED C[C@@H](NC(=O)NCc1ccccc1Sc1ccccc1)c1ccc(C#N)cc1 502626648 IKEAJIJZFGVLAI-QGZVFWFLSA-N 387.508 5.270 30 20 GKED C=CCn1c(C)nnc1S[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 504549110 SFUWVAQHGRXJMP-SECBINFHSA-N 395.372 5.663 30 20 GKED C[C@@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)c1ccc(F)cc1F 507577556 JOHQMGUCSNAYLX-HNNXBMFYSA-N 380.394 5.156 30 20 GKED C[C@H](Nc1cccc(C(F)F)c1)C(=O)Nc1sc2c(c1C#N)CCCCC2 507845112 PTYRDRIJTBGIQO-LBPRGKRZSA-N 389.471 5.265 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c1 513239096 UHCBTAZWMGLWLR-QGZVFWFLSA-N 386.451 5.097 30 20 GKED CC(C)[C@@H](Sc1cc(C#N)ccn1)C(=O)Nc1ccc(Cl)c(Cl)c1 515287929 GOILQGLUNROKOH-MRXNPFEDSA-N 380.300 5.015 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518242147 RQCLTEARUDMZSR-UHFFFAOYSA-N 388.492 6.103 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(F)c1 520627174 IKUHTXWAZYFEEX-INIZCTEOSA-N 389.430 5.237 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cn(C)c2ccccc12 524422412 NYYBIQBBFOWQGY-UHFFFAOYSA-N 395.462 5.190 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccn2[C@H](C)Cc2ccccc2)n1 536928003 CPAHKEMMIVBEHA-SJLPKXTDSA-N 377.513 5.362 30 20 GKED C=CCn1c(SCC2(C#N)CC2)nc2scc(-c3ccc(C)cc3)c2c1=O 537556820 WSEQPAGEDSYTPX-UHFFFAOYSA-N 393.537 5.015 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1COC(C)(C)C 539138105 ZPCDXTIAEVCASK-MRXNPFEDSA-N 382.529 5.506 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3ccc(C#N)cc3OC(F)F)oc12 543517071 MSGZSQLZJNREFD-CYBMUJFWSA-N 386.398 5.155 30 20 GKED C=CCN(C(=O)CCCCC(=O)c1ccc(C)cc1)c1nc2c(s1)CCCC2 545382586 ZSLUCJUZWJTJHS-UHFFFAOYSA-N 396.556 5.293 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccc(Cl)cc3C(F)(F)F)c2C#N)C1 547429411 MIRGECBKRIVINL-SECBINFHSA-N 398.837 5.669 30 20 GKED CCc1nc2cc(CN[C@@H](CCC#N)c3ccc(OC)cc3)ccc2n1C1CC1 549626132 RQOVLDNWXZDXBB-NRFANRHFSA-N 388.515 5.077 30 20 GKED CCOC1CC(N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 554398650 XTRUTFFMZFALEB-QLOJAFMTSA-N 397.906 5.027 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c2c1 561978652 LJWXQQCNWWJOKI-OAHLLOKOSA-N 393.393 5.791 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 563290668 QVPWSDFEOGOUKV-UHFFFAOYSA-N 383.923 5.779 30 20 GKED Cc1ccc(-c2csc(C(=O)[C@@H](C#N)c3ccccn3)c2-n2cccc2)cc1 571845294 GPOIFFXKOCHJGF-SFHVURJKSA-N 383.476 5.399 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1C 574657575 BRFZYBSGYODRLG-GOSISDBHSA-N 385.414 5.146 30 20 GKED N#Cc1cc(Oc2ccc(NCc3nc(C4CCCCC4)cs3)cc2)ccn1 577332221 RPZBBLXOVUAIEV-UHFFFAOYSA-N 390.512 5.862 30 20 GKED CCCCOc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c(C)c1 592753997 IENLHDIKNJCITD-UHFFFAOYSA-N 377.271 5.605 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N1Cc2ccc(C#N)cc2C1 594067785 UCNDVNNPVBCJKJ-UHFFFAOYSA-N 391.540 5.839 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2oc3ccccc3c2COc2ccccc2Cl)C1 598414952 GPDDKKILFJVVPT-JOCHJYFZSA-N 394.858 5.041 30 20 GKED N#CCc1cccc2c1CCN(C(=O)Nc1cc(Cl)ccc1C(F)(F)F)C2 599789900 UTXLWEPUECIOEM-UHFFFAOYSA-N 393.796 5.015 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(-c2cccc(F)c2)no1 603968594 DXAPNRIRZGWMTD-UHFFFAOYSA-N 389.411 5.333 30 20 GKED C=CCCCCCN(C)C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 606816830 OSRWEEMKXSYHEW-UHFFFAOYSA-N 395.330 5.786 30 20 GKED CCc1ccc([C@H](C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 609020416 TUARJBHEOURIGI-IBGZPJMESA-N 398.506 5.636 30 20 GKED CCc1c(C)sc(NC(=O)[C@H](C)Oc2cccc(Cl)c2Cl)c1C#N 609032535 MMSDGUCJHMSIEH-VIFPVBQESA-N 383.300 5.203 30 20 GKED Cc1c([C@H](C)NC(=O)Nc2cc(C#N)ccc2OC(F)F)oc2ccccc12 609082470 LMOYCCOTPHJTED-LBPRGKRZSA-N 385.370 5.097 30 20 GKED COc1ccc2[nH]cc(CC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)c2c1 609177297 OFEPYQYYWZQOHR-UHFFFAOYSA-N 397.434 5.022 30 20 GKED N#C[C@@H](NC(=O)c1cc2occc2s1)c1ccc(OCc2ccccc2)cc1 609875170 ZGWPTFSRVGCVDE-GOSISDBHSA-N 388.448 5.068 30 20 GKED N#Cc1ccc(SCc2nc(O)c3c(-c4ccccc4)csc3n2)c(F)c1 610219681 GHXQHVMXDMOCEU-UHFFFAOYSA-N 393.468 5.367 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cccc(Cl)c1 610224009 BNQPZMARQGXYCS-AWEZNQCLSA-N 377.831 5.141 30 20 GKED CCCc1ncc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)s1 610224930 KKOHQVAYNLWTPG-UHFFFAOYSA-N 379.510 5.047 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Oc3ccncc3)cc2)c(Cl)c1 611094055 YWARLMITJAJLSU-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccc(C#N)cc1 611182650 ICILWZBHGHHFCS-LBPRGKRZSA-N 383.423 5.110 30 20 GKED COc1cc(Br)ccc1[C@@H](C)N[C@H]1CCCc2cc(C#N)ccc21 615761928 GJSLVBHMDKSMLK-YJYMSZOUSA-N 385.305 5.058 30 20 GKED CCn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nc2sc(C)c(C)c2c1=O 619864101 PVOKZZOTHIJZRW-AWEZNQCLSA-N 389.933 5.105 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(NC(=O)CCCc2cccs2)c1 620313122 WMJAMNULOXKQAO-BGYRXZFFSA-N 394.540 5.033 30 20 GKED C=CCCc1ccccc1NC(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2 667028656 ABGIYTLZPSWZSI-PMACEKPBSA-N 376.500 5.412 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1ccc2ccccc2n1 679536265 HJQHEGXYBIJRPK-AWEZNQCLSA-N 391.402 5.127 30 20 GKED C=CCC[C@H](C(=O)N1CCC(c2noc3cc(F)ccc23)CC1)c1ccccc1 685890195 CMDWWRBSFVMLKT-FQEVSTJZSA-N 392.474 5.423 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)(F)F)cc1)c1nc2cc(F)ccc2s1 730420874 HYRCAUMDWARRPY-LBPRGKRZSA-N 396.390 5.537 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2cc1C 730421693 NLFBKWMTXJVGFF-INIZCTEOSA-N 378.428 5.217 30 20 GKED Cc1ccc(C)c(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)c1 730951410 NABLJQYYUZNUSW-JXMROGBWSA-N 376.408 5.070 30 20 GKED CC(C)COc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 731409966 AYZPTNJQWLEBDP-OAHLLOKOSA-N 384.888 5.475 30 20 GKED Cc1ccc(/C=C2/SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)cc1F 731500365 AZRMZISJCNAZCV-FRKPEAEDSA-N 388.876 5.065 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)CC2CCC(c3ccccc3)CC2)c1 733771752 UKILAMONYRKBIE-HXJXPZHGSA-N 390.527 5.348 30 20 GKED C=CC[C@H](NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccncc1 734234036 FGCCEUHNXMGNKG-XADARROHSA-N 378.472 5.396 30 20 GKED CCc1cc(NN=C(C)c2cccc(Cl)c2Cl)nc(-c2ccccn2)n1 734980371 ZXXZROBMDSVKDR-UHFFFAOYSA-N 386.286 5.244 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCSc3ccc(Cl)cc3)[nH]c12 735791875 CZDSNNLIDZTFCY-MRXNPFEDSA-N 383.904 5.274 30 20 GKED N#C[C@H](C(=O)CC/C=C\c1ccccc1)C(=O)Nc1cc(Cl)cc(Cl)c1 739156413 WZOLSPPQVXXOJG-MPYGFJLXSA-N 387.266 5.134 30 20 GKED C[C@@H]1/C(=C/c2c[nH]c(-c3ccccc3)n2)C(=O)c2cccc(Br)c21 742434355 GBYLPGRVRFEXGX-YUSFRKCESA-N 379.257 5.223 30 20 GKED O=C1/C(=C/c2ccc(Oc3cnccn3)cc2)CSc2c(Cl)cccc21 743055606 GWSIJVJGEMUAQM-GXDHUFHOSA-N 380.856 5.294 30 20 GKED N#Cc1ccc(NC(=O)c2sccc2SC(F)F)cc1C(F)(F)F 744371253 PEDMIXJNUWAAHL-UHFFFAOYSA-N 378.347 5.206 30 20 GKED C[C@@H](NC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1)c1cccc(C#N)c1 745922961 FYBCXZNNAXFILW-KOSHJBKYSA-N 381.479 5.128 30 20 GKED C[C@@H]1CCC[C@@H](CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 750668189 PAQPEZMXKVHYFX-YRGRVCCFSA-N 380.435 5.708 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc2ccccc2c1 753392418 BAKQIIHTOVZGAU-FZKQIMNGSA-N 394.833 5.083 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 757977041 DXCBQYRVGCIWIZ-MRXNPFEDSA-N 381.476 5.327 30 20 GKED CC(=NNc1cncc(Br)c1)c1csc(-c2csc(C)n2)c1 758123894 YQKCXXCWZLSUHU-UHFFFAOYSA-N 393.335 5.174 30 20 GKED C=C[C@H](CC(=O)O[C@@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 758906934 FSGWPUDAWNUENV-FXAWDEMLSA-N 379.500 5.042 30 20 GKED O=C1/C(=C/c2cccc(OCc3ccccc3Cl)c2)CCc2nc(O)ccc21 769610920 TWGGFBPZYFFMEP-FOWTUZBSSA-N 391.854 5.232 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1ccc(F)cn1 770597874 QRDPEGSSGPNYJR-UHFFFAOYSA-N 377.448 5.037 30 20 GKED O=[N+]([O-])c1ccc(F)cc1CN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 780391478 ALZNNEAQKAREPK-AWEZNQCLSA-N 396.262 5.146 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 780682362 UQDOOBMSFPIXHX-QZTJIDSGSA-N 399.494 5.888 30 20 GKED C[C@@H](NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccc(OCC#N)cc1 790533505 OLQVDCVTJIBRFB-CQSZACIVSA-N 383.904 5.217 30 20 GKED C[C@H]1CCc2ccc(Br)cc2[C@H](NCc2ccc(OCC#N)cc2)C1 794809681 HORIWVREVLFFRI-YCRPNKLZSA-N 399.332 5.155 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 796688328 AHOHANMTTNNVTO-QFBILLFUSA-N 376.481 5.502 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)c2sc3cc(F)ccc3c2C)cc1C#N 805192986 YOWJSMBHNQBELJ-UHFFFAOYSA-N 397.431 5.041 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccnc(C(F)(F)F)c3)n2)cc1 808980312 XSZZWVUIFSFELI-CQSZACIVSA-N 387.386 5.022 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)cc1 810184459 REGFZHXCVXOYGK-PBHICJAKSA-N 383.904 5.088 30 20 GKED O=C1/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)Cc2c(O)cccc21 810250922 SVVRSTBZGAMLIF-DHZHZOJOSA-N 381.771 5.036 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](Oc2ccc(Cl)cc2)C(C)C)n1 813072952 QHDCUQRWPUBXIT-CRAIPNDOSA-N 376.909 5.200 30 20 GKED CCN(C(=O)c1ccc(C#N)o1)[C@@H](c1cccnc1)c1csc2ccccc12 815571843 NQAVQTMMEDUPNH-NRFANRHFSA-N 387.464 5.013 30 20 GKED CC(C)n1ncc2cc(CSCc3cc(Cl)ccc3OCC#N)cnc21 842175423 RUEWGSBXEWUGBA-UHFFFAOYSA-N 386.908 5.001 30 20 GKED N#CC(CCOC(=O)c1c(F)cccc1F)(c1ccccc1)c1ccccc1 912956756 WOHRDISTLLPNOA-UHFFFAOYSA-N 377.390 5.022 30 20 GKED COc1cc(C=NN(c2ccccc2)c2ccccc2)ccc1OC(=O)C1CC1 916249767 JELIRSSKOPAXRI-UHFFFAOYSA-N 386.451 5.183 30 20 GKED Cc1nc2sc3c(c2c(=O)n1N=Cc1cccc2ccccc12)CCCCC3 916273366 ZCSWBLAMJPKLBZ-UHFFFAOYSA-N 387.508 5.071 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)cs2)cc1 920101741 HOLAGKUWDRVTCO-QGZVFWFLSA-N 399.475 5.114 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c(F)c1 1776127691 ATWPAYZMCSQKBF-TWGQIWQCSA-N 382.412 5.157 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CCC(=O)O)c2ccccc2)cc1 1776786530 QPMILZHDKTYGDX-QHCPKHFHSA-N 383.532 5.732 30 20 GKED COCc1c(C)cc(C)c(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)c1C 1777230216 KGFHJXOWDZUKGW-CMDGGOBGSA-N 396.483 5.140 30 20 GKED N#Cc1ccccc1CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 5228780 MSMCVRPBZLBSEZ-UHFFFAOYSA-N 375.931 5.481 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1ccc(F)cc1F 108533501 NDWOEKURAIIPGB-STQMWFEESA-N 375.444 5.099 30 20 GKED CCN(CCC(=O)Nc1cc(Cl)ccc1Cl)[C@@H](C)c1ccc(C#N)cc1 110982791 UEGDKLMBJNRRDY-AWEZNQCLSA-N 390.314 5.277 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](COCc2ccccc2)c2ccccc2)cc1 123902761 SCRAQVLUKDQIDB-NBGIEHNGSA-N 386.495 5.025 30 20 GKED CC(C)c1ncc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 133075005 CQFUGEHUGSWMRI-UHFFFAOYSA-N 399.463 5.543 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(C(F)(F)F)c2C)c1 135219842 FWUNGFUWCSKMPV-HNNXBMFYSA-N 391.393 5.017 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(C(=O)N2CCCC2)c1C)c1ccccc1 155490097 XWCQWTUZMSZWHQ-JOCHJYFZSA-N 391.515 5.060 30 20 GKED N#C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccc(Cl)c(Cl)c1 161183069 GWNSSQZAOCLGAM-CQSZACIVSA-N 391.151 5.146 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3ccc(OCC#N)cc3)s2)cc1 180539144 ADWDYGRHTVEQHI-IRXDYDNUSA-N 391.540 5.741 30 20 GKED CC[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(C)cc1 181683063 KDWAJDBOSXAJIN-IEBWSBKVSA-N 381.545 5.069 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(F)c(F)c2)C(C)C)ccc1OC 182136494 VBHZFKBWNUXLNZ-VGOFRKELSA-N 388.458 5.141 30 20 GKED COc1cc([C@@H](C)Nc2ccc(C#N)c(Cl)c2)ccc1OCc1ccncc1 301245674 NXNDRPNNPRDEAH-OAHLLOKOSA-N 393.874 5.367 30 20 GKED Cc1ccc(C#N)c(N[C@@H]2CCCc3cc(NC(=O)OC(C)(C)C)ccc32)n1 302452351 PSOOFCRYKXPNDJ-LJQANCHMSA-N 378.476 5.098 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SC)c(OC)c2)ccc1OC(F)F 302967716 ASIMOZCQQNJQGT-VMPITWQZSA-N 394.439 5.313 30 20 GKED O/C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)=N/CCc1c[nH]c2ccc(Cl)cc12 330120356 GIFHHHHVJXLXEN-ZNAOMFPMSA-N 386.923 5.042 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNC(=O)N[C@@H](CCCC#N)c1ccccc1 431899395 QHRVHLKGPVEDPT-IBGZPJMESA-N 389.421 5.248 30 20 GKED CC1=C[C@H](C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 431904639 UNKPYDAQJZBSRH-MGPUTAFESA-N 379.891 5.425 30 20 GKED C=C[C@](C)(CCOC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 437624575 KBOPRHTZTGXAOP-DENIHFKCSA-N 382.891 5.163 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1sc2c(c1C#N)CCCCC2 443811751 BPEQRNPVKIMWAC-UHFFFAOYSA-N 385.558 5.564 30 20 GKED C=CCN(C(=O)[C@@H]1CCCc2sc(C)nc21)c1nc(-c2ccccc2)cs1 447201359 TVRRDRURFPDMBU-MRXNPFEDSA-N 395.553 5.214 30 20 GKED CC[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)s1 458396470 NYYJWBFFDWHZKL-JKSUJKDBSA-N 375.925 5.587 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)cc1 458836833 KYIVIAUUXRBHPM-XZOQPEGZSA-N 375.516 5.183 30 20 GKED N#Cc1ccc(-c2nnc(COc3ccc(Cl)cc3C3CCCCC3)o2)cc1 462565833 MLQVBWXGHZXDKH-UHFFFAOYSA-N 393.874 5.888 30 20 GKED COc1ccc(F)cc1CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 462905771 ZJMIAIAGRSNGIA-HNNXBMFYSA-N 395.318 5.636 30 20 GKED Cc1cccc(Br)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 463946256 DEVDZMZFQKCJOY-GFCCVEGCSA-N 389.318 5.262 30 20 GKED Cc1cccc(Br)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 463946257 DEVDZMZFQKCJOY-LBPRGKRZSA-N 389.318 5.262 30 20 GKED CSc1cccc([C@H](NC(=O)c2ccc(C#N)cc2)c2cc(F)ccc2F)c1 464113535 KNXSWWCCZFWECE-NRFANRHFSA-N 394.446 5.078 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1ccccc1)c1cc(C(F)(F)F)ccn1 464412701 UJXYIKASKKZIDP-QGZVFWFLSA-N 382.341 5.383 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)Nc1ccc(C#N)c(F)c1 464641634 DGNCZOKSYIGLSV-UHFFFAOYSA-N 390.201 5.220 30 20 GKED COc1cc(F)c(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cc1F 468374948 YZOPQIXVTUVPCN-UHFFFAOYSA-N 396.418 5.249 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc2c(s1)CCCC2 468754345 AEUTXVQZMLKLRQ-MRXNPFEDSA-N 393.556 5.383 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(-c3ccccc3)cn2)c2ccccc21 469134587 XKAPEELBILNIHO-UHFFFAOYSA-N 380.451 5.259 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@](C)(OC)CC1)c1ccc(C(F)(F)F)cc1 474547590 MVCUQCUMJFJBCT-ICSRJNTNSA-N 398.469 5.313 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1oc(CC(C)C)nc1C 475249507 PZPHOIFLBKDYBY-UHFFFAOYSA-N 389.455 5.406 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1nc(C)c(C)c(C)c1C#N 476078073 GNLQMDKAQULJGL-UHFFFAOYSA-N 393.556 5.461 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nnn(-c2ccc(C)cc2)c1C)c1ccc(F)c(F)c1 480658260 BDWHZOXDQBHLOU-VFNWGFHPSA-N 382.458 5.130 30 20 GKED CCOc1cccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)c1OC(F)F 481676615 XXAZVHAZRIPPFM-LJQANCHMSA-N 386.442 5.116 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cc1 486097726 QQGWYTJJTWMGBW-ZLNRFVROSA-N 387.527 5.678 30 20 GKED CC(C)(C)n1ncc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1-c1ccccc1 488714834 VAJMRBQGQYPQAL-FQEVSTJZSA-N 394.478 5.343 30 20 GKED C=C(C)CN1CCC(N[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)CC1 491037230 OBWPYPXLOWYTOS-JOCHJYFZSA-N 386.486 5.008 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)NCC(C)(C)CCC#N)cc2)c1 492708728 XGCYCKFPWRHFEC-IBGZPJMESA-N 393.531 5.264 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1ccc(Oc2ccccc2)c(F)c1 499602289 MIAHRWDODUEOCX-SFHVURJKSA-N 382.479 5.369 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 503491345 PYEXSLINNLYSTE-RBBKRZOGSA-N 398.526 5.027 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SC[C@H]1CCCC(F)(F)C1 509097053 IAXRLFYSVIYAKW-AWEZNQCLSA-N 397.466 5.100 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)oc12 517801147 XQHIYTRIRZUGQP-CQSZACIVSA-N 393.393 5.593 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 518740251 RDWHYFIBXJQSEZ-FXAWDEMLSA-N 396.556 6.000 30 20 GKED CCCCCOc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 519515820 XTNFGIYNXFJAAX-QGZVFWFLSA-N 382.529 5.902 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 520832412 JIXHOZINFDNGAJ-MOPGFXCFSA-N 395.572 5.176 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H](c2ccccc2)[C@H]2CCCO2)c1 521831516 ZNKSMRSWVHLZOC-CLJLJLNGSA-N 398.506 5.147 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccc3nc[nH]c23)c1 522917749 AVILLISTMWRXMI-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc(F)ccc1F 525417166 VPKGHMXVVDJOOK-CXAGYDPISA-N 389.471 5.632 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@H]1COc2ccccc21 533630247 GVDLZZNHZDVKGQ-OPAMFIHVSA-N 399.450 5.037 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1nc(C(F)(F)F)cs1 537575466 VCCYYFFYAKRSQE-UHFFFAOYSA-N 389.358 5.078 30 20 GKED Cc1cccc([C@@H]2CCCN2Cc2cccc(OCc3cccc(C#N)c3)c2)n1 538727471 SWVLDZXUXDBWJU-VWLOTQADSA-N 383.495 5.178 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(Cl)ccc2Br)c(C#N)s1 539175312 MXNQQRGPSXNBKU-UHFFFAOYSA-N 397.725 5.585 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 544037264 BJDXVSAFLJYTQF-ZDUSSCGKSA-N 392.324 5.014 30 20 GKED CSCc1ccccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 546766654 QNGSQFZJIQEPMX-UHFFFAOYSA-N 388.492 5.660 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)Nc1ccc(C#N)cc1OC 547418905 MWYHNCKJICOTET-UHFFFAOYSA-N 388.423 5.010 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(NC(=O)CC(F)(F)F)cc2)CCCC1(C)C 549385719 GIUARAUJJWZGIC-INIZCTEOSA-N 397.441 5.176 30 20 GKED COc1ccc([C@@H](CCC#N)NCc2cccc(OCc3ccccc3)c2)cc1 558261074 ZJUJJDFHZINCHR-RUZDIDTESA-N 386.495 5.409 30 20 GKED N#CCCn1cc(/C=C\c2nc(Cc3cc4ccccc4o3)no2)c2ccccc21 560048680 XKOFGORPRDUVSR-KHPPLWFESA-N 394.434 5.445 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 563984476 NQLZLDOEHOKHQA-QGZVFWFLSA-N 391.490 5.055 30 20 GKED CC(C)(c1ccc(C(=O)N(CCC#N)c2ccc(F)cc2)cc1)C(F)(F)F 570762224 BKCDPVPWKKCYNG-UHFFFAOYSA-N 378.369 5.226 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)NC(c1cccs1)c1cccs1 572166405 BRAQJEJXHXUDHZ-UHFFFAOYSA-N 384.530 5.149 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC3(CCC3)CC2)cc1F 588256458 WESFUBGIMBBFPF-UHFFFAOYSA-N 379.435 5.288 30 20 GKED N#CCCCCCC(=O)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 589833215 MVKRFMKWCCYFGW-UHFFFAOYSA-N 384.867 5.397 30 20 GKED CC(C)(C)n1ncc(C(=O)Nc2cc(C(F)(F)F)ccc2F)c1C(F)(F)F 590393474 DAOJYTPKCMXTDE-UHFFFAOYSA-N 397.294 5.067 30 20 GKED N#Cc1c(NC(=O)C2(C(F)(F)F)CCCC2)sc2c1-c1ccccc1OC2 591307789 GOUZCWXCBUSHPH-UHFFFAOYSA-N 392.402 5.240 30 20 GKED COc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c(C2CC2)cc1Cl 594206788 SDDSYRSXFUZKKT-UHFFFAOYSA-N 395.890 5.294 30 20 GKED N#CC[C@H]1CCCN(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)C1 596101166 CTOKQVSHEKVQIO-FYYLOGMGSA-N 375.516 5.086 30 20 GKED N#Cc1c(Cl)cccc1NCc1cccc(NC(=O)c2cccc(F)c2)c1 603871330 QHOBWHAMAYBLPK-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1cccc2sc(C(=O)Nc3cc(C#N)ccc3OC(C)C)c(Cl)c12 604342730 YQNBUDBPXDUGJT-UHFFFAOYSA-N 384.888 5.774 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056203 DXSCBQJJISISQR-HNNXBMFYSA-N 394.858 5.217 30 20 GKED N#CCn1c(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc2ccccc21 609175488 WSCLGNWTIJVEIP-UHFFFAOYSA-N 387.389 5.362 30 20 GKED Cc1ccc(CN(C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C2CC2)o1 609297910 TVXUBUQOZAJKLF-UHFFFAOYSA-N 390.414 5.196 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cccc2ccccc12 609434675 INIIJDVGNLLMFV-DLBZAZTESA-N 389.524 6.117 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(F)cc2s1)c1c(Cl)cccc1Cl 609589180 OYBXFSPTDAXSBY-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 609985659 IOFPWHSXMJKLRX-UHFFFAOYSA-N 377.831 5.216 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)c1cccc(Cl)c1 610223994 ZLEBEODWDDITPI-HNNXBMFYSA-N 391.858 5.450 30 20 GKED CCc1cnc(CSc2nc(-c3ccc(C)o3)cc(C(F)(F)F)c2C#N)o1 610286343 TWEPDDXIWTXRJN-UHFFFAOYSA-N 393.390 5.383 30 20 GKED N#Cc1ccsc1NC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 610433781 AALJECZHYJELTH-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CSc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 613320145 SOFGTEZIKUGYGS-INIZCTEOSA-N 384.913 5.675 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N[C@H](C)c1cccc(C#N)c1 616357501 RDMUKRPJJIZNIF-GFCCVEGCSA-N 399.372 5.032 30 20 GKED COCCOc1cccc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)c1 727781102 DRROHRXLVSQUAI-VAWYXSNFSA-N 379.481 5.040 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)/N=C\c1ccc(O)c(O)c1O 730148013 XXAUXQHPNCPXHD-INRAOFHCSA-N 388.876 5.069 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)c[nH]c2c1 731331790 QACVFFVMUGWATA-UHFFFAOYSA-N 381.435 5.322 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1cccc(-c2ccncc2)c1 741471986 DFHRJWORRUUOBB-ZHACJKMWSA-N 392.458 5.619 30 20 GKED O=C(/C=C\c1cnn(-c2ccc(Cl)cc2)c1)c1cccc(-c2ccncc2)c1 741473145 MLVKJLOSCBPBQD-WTKPLQERSA-N 385.854 5.484 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 742537692 NPCGONWHEKXTBW-WZONZLPQSA-N 386.470 5.689 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)nc2Cl)cc1 747637605 NRYMMDSKSYAVMP-KRWDZBQOSA-N 382.250 5.296 30 20 GKED CCCCCCCS(=O)(=O)Cc1coc(-c2ccc(C(F)(F)F)cc2)n1 755428561 VUHPKWOTDOOESC-UHFFFAOYSA-N 389.439 5.246 30 20 GKED N#CCCCCN[C@H](c1ccc2c(c1)CCO2)c1cc(Cl)ccc1Cl 779046998 CVUATGYHAGQQHT-HXUWFJFHSA-N 375.299 5.301 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)NCc3ccc(C#N)cn3)cc2)cc1C 780639391 FLCRCXUKNYJDDY-UHFFFAOYSA-N 388.496 5.043 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1nccc2ccccc12 792096059 ZGBKUVCXPBMUCM-MLFXKNMZSA-N 381.262 5.821 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCc2ccc(-c3ccccc3)o2)s1 797572453 ZVKZSIPFPYIBFN-QGZVFWFLSA-N 378.497 5.510 30 20 GKED O=C(C[C@@H]1CCC(F)(F)C1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 797975330 GTQVMDFTVRUHOF-ZANVPECISA-N 389.286 5.251 30 20 GKED N#CCc1ccc(NC(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1 806173442 YESIRRFFKUQRTH-HSZRJFAPSA-N 385.467 5.063 30 20 GKED O=C(/C=C\c1cncc(Br)c1)c1csc(-c2ccccc2F)n1 812244400 JVKLZOFGSAUMMC-WAYWQWQTSA-N 389.249 5.003 30 20 GKED Cc1cc(NCc2ccc(O[C@@H](C)C#N)cc2)ccc1NC(=O)OC(C)(C)C 850415963 AAARRYMFGNYXCC-INIZCTEOSA-N 381.476 5.245 30 20 GKED CC(C)CCO[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 854303903 RVGLJRFBABRJIN-DHIUTWEWSA-N 391.515 5.011 30 20 GKED C=CCOc1ccc(-c2nc(-c3ccsc3C(F)(F)F)no2)cc1OC 904924876 MMNKADNDMOOGLE-UHFFFAOYSA-N 382.363 5.057 30 20 GKED N#C[C@@H](C(=O)CSCc1ccccc1Cl)c1nc(-c2ccccc2)cs1 915102233 PVGAXHZIJNUJIB-INIZCTEOSA-N 398.940 5.573 30 20 GKED C[C@@H](/N=C/c1cc2ccccc2nc1O)c1cccc(NC(=O)c2ccccc2)c1 915270833 CGRNDOINIZWXTE-MOROIOLQSA-N 395.462 5.373 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)c1 916848327 BLKRQKQAZFUKQK-HXUWFJFHSA-N 384.479 5.390 30 20 GKED O=C(O)c1ccc(NN=Cc2cc(F)ccc2Oc2cccc(Cl)c2)cc1 1776012163 GIXNKNQEYSENOF-UHFFFAOYSA-N 384.794 5.416 30 20 GKED O=C(O)c1cc(NN=Cc2cnc(-c3ccc(Cl)cc3)s2)ccc1Cl 1776033825 MAEWIOOWIKKJRI-UHFFFAOYSA-N 392.267 5.261 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cn(-c2ccc(Cl)cc2)nc1C 1776787158 XCYPLGIBZWOBAN-IBGZPJMESA-N 391.943 5.128 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)c2cc(F)ccc2F)cc1 1776788223 ROZAEIXBRLCLIS-NRFANRHFSA-N 391.458 5.230 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1C(=O)O 1777360994 GADXYZUAGCKXRU-JXMROGBWSA-N 392.382 5.221 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)c4csc(C)c4C)CCC3)cc2)C1 1785807162 JBVBZXBALPKKBW-UHFFFAOYSA-N 394.540 5.079 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)C(=O)Nc2ccccc2Cl)n1 18535725 OSLSMEAQXYGWKM-JTQLQIEISA-N 399.825 5.053 30 20 GKED O=C(/C=C/c1cccc(Oc2ccccc2)c1)c1cccc(N2CCOC2=O)c1 60095126 AXZNBUGSQBWGAL-OUKQBFOZSA-N 385.419 5.332 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)cc2)n1 63162824 UPFPKUDIIAHEHJ-CQSZACIVSA-N 394.525 5.357 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1Cl 66954768 GBWAHNFKXIYYRR-KXBFYZLASA-N 399.947 6.103 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 72001217 CSOOOVSVWOCVTR-UHFFFAOYSA-N 384.451 5.001 30 20 GKED N#CCOc1cccc(NC(=O)c2cc(-c3cccs3)nc3ccccc23)c1 107965672 ZIEKJXDWLPGLDB-UHFFFAOYSA-N 385.448 5.118 30 20 GKED Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c12 108981836 YIXPTDQJGKBSSI-CYBMUJFWSA-N 394.500 5.301 30 20 GKED Cc1cc(C)c(NC(=O)CNc2ccccc2S[C@@H](C)CC#N)c(Cl)c1 109002862 MCJPKPAGHDHCND-HNNXBMFYSA-N 387.936 5.402 30 20 GKED N#CCc1ccc(NC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)cc1 110058240 JBIWZJMIIPIQCQ-UHFFFAOYSA-N 387.386 5.147 30 20 GKED C[C@H](N[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(C#N)cc1 114747465 GVKCSGKXMBOAIO-STQMWFEESA-N 386.377 5.039 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2SCCC#N)c1Br 119548537 ZWWVIUMJYIZLHV-UHFFFAOYSA-N 375.291 5.016 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCCCC[C@@H]1c1ccco1 121206274 VHPKOAOWZIIFQY-PKOBYXMFSA-N 397.544 5.230 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(Cl)ncc3Cl)c2)c1 128324157 FXMMBAVLOBDQGQ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CSc1cccc(NC(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)c1 149850695 SCCLPLFWNNYOPW-UHFFFAOYSA-N 390.512 5.055 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 151167039 RWINATPLZWXUOE-SFHVURJKSA-N 392.499 5.056 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc(C3CCCC3)nc2C)cc1 173051598 WCTNCZXYGMZNMN-UHFFFAOYSA-N 383.517 5.068 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1cccc(F)c1 173123881 OOXTYVKBPVKAGB-GUXCAODWSA-N 397.519 5.835 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(CSc2ccccc2C#N)cs1 173719370 DSGGNBYMZZWZHB-UHFFFAOYSA-N 379.510 5.300 30 20 GKED N#C[C@H](C(=O)Cc1cc(F)ccc1F)c1nc(-c2ccc(Cl)cc2)cs1 173988561 WZJCTCLCGDTNQA-OAHLLOKOSA-N 388.826 5.161 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F)c1nc2cc(Cl)ccc2s1 174002617 FZWVUVTYPATTHQ-FRRDWIJNSA-N 388.826 5.208 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cc2sc3ccccc3c2s1 182046217 UOGZOOPCAYIRAN-LBPRGKRZSA-N 378.478 5.659 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)o1 184303522 SZTSZUHKOAIXMH-VQIMIIECSA-N 381.476 5.282 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 185481757 SYGMZPADSQTZJV-FZKQIMNGSA-N 393.503 5.312 30 20 GKED CCOc1cccc2[nH]cc(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)c12 188640015 GZVIOACXYGDZSF-HNNXBMFYSA-N 393.512 5.142 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cscn2)cc1Cl 195286467 MSADDWTVMRIUCU-GOSISDBHSA-N 381.888 5.023 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc([S@@](C)=O)cc1 276396816 JRRJAWIQECUUOY-RKOGDMNLSA-N 384.545 5.159 30 20 GKED COc1ccc([C@@H](Nc2ncccc2C#N)c2ccc(C(F)(F)F)cc2)cc1 302022731 IZJJZXSOLZLOFZ-IBGZPJMESA-N 383.373 5.182 30 20 GKED CCOC(=O)c1sc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1C 302535146 LEYCEGICAPSVEJ-UHFFFAOYSA-N 390.464 5.024 30 20 GKED CC(C)(C)CC(O)=Nc1ccc(Cl)c(C(=O)N2CCC[C@H]3COCC[C@H]32)c1 328857895 KTUUIGMVBLHOII-KBXCAEBGSA-N 392.927 5.005 30 20 GKED N=C(O)c1ccc(N=C(O)[C@@H]2CCCc3sccc32)cc1N1CCCCC1 329200702 BNUQYOSMLNZLIY-MRXNPFEDSA-N 383.517 5.330 30 20 GKED Cc1cccc2c(CC/C(O)=N/[C@@H]3CCCc4cn(C5CCCC5)nc43)c[nH]c12 329477071 BTEZMXNPSJHCER-OAQYLSRUSA-N 390.531 5.755 30 20 GKED COc1cc(NC(=O)c2ccc(F)cc2C(F)(F)F)ccc1C(F)(F)F 426933090 JVXPIKYLYDINJS-UHFFFAOYSA-N 381.247 5.124 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438845880 FTYSMECMRBARFE-BEFAXECRSA-N 389.421 5.453 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccccc1S[C@H](C)CC#N 439120918 WUIVFJRULIIUEG-GFCCVEGCSA-N 389.864 5.203 30 20 GKED C[C@H](SCc1nc(-c2cc(F)c(F)c(F)c2)no1)c1cccc(C#N)c1 443144353 KXFKKRGLMFTOKY-JTQLQIEISA-N 375.375 5.020 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H]3Cc3ccccc3)cc2)c1 443934984 GCWPJOGCQYLJKA-NRFANRHFSA-N 383.451 5.199 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccc(C#N)cc1 445232674 BRGVOSAYCCQYGC-MGPLVRAMSA-N 399.775 5.015 30 20 GKED Cc1nc(CC(C)C)c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)s1 447170554 VQPGLTUCOFBOKY-GFCCVEGCSA-N 389.933 5.403 30 20 GKED Cc1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)n([C@@H]2C[C@H]3CC[C@H]2C3)n1 455068860 VLDKYBKAVBBELL-ZIBCJSCZSA-N 391.519 5.109 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2ccnc(C#N)c2)C(C)C)s1 475457360 HOSZQCBRKQBZPL-UHFFFAOYSA-N 375.497 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1cccc(C)c1)c1ccccn1 475566200 SALGFVYEHSJLFX-VWLOTQADSA-N 399.538 6.153 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cc(F)cc(Cl)c2)cc1C 478933605 GTYWPSIGRCFANO-UHFFFAOYSA-N 396.853 5.125 30 20 GKED C[C@H](NCc1cnc(-c2ccco2)s1)c1ccc(-c2cccc(C#N)c2)cc1 487576810 QKHGWYOONWJUGI-INIZCTEOSA-N 385.492 5.793 30 20 GKED N#CCCC[C@H](NC(=O)CCC(=O)c1csc2ccccc12)c1ccccc1 487591987 ICNJCZOEHUGIMW-FQEVSTJZSA-N 390.508 5.416 30 20 GKED CCCc1cc(C(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)sc1C 487869095 CPHKEHSPHWOAGW-UHFFFAOYSA-N 380.435 5.085 30 20 GKED C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(OC(F)(F)F)c1 488180497 IKGTXJCLSVIBAN-SECBINFHSA-N 395.274 5.234 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)F)c(F)c1)c1nc(-c2ccccc2)cs1 496198032 QYCATIHDOVVLAT-ZDUSSCGKSA-N 388.370 5.041 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 498431307 UYLCUXAJCNTZRA-INIZCTEOSA-N 388.433 5.509 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1 500592334 UCQMRBNVOFPCBH-UHFFFAOYSA-N 392.480 5.255 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccc(F)c(F)c1 502667062 WEGISZZVBCKMFY-UHFFFAOYSA-N 399.210 5.087 30 20 GKED C=CCN(C(=O)c1cnc(-c2ccco2)s1)c1nc(-c2ccccc2)cs1 504468950 ZJLLYCMIEXEILB-UHFFFAOYSA-N 393.493 5.359 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)Cc2ccc(C#N)cc2)C(C)C)s1 504596642 GZBOMJQCZOCRCK-UHFFFAOYSA-N 388.536 5.575 30 20 GKED Cc1cc(CCCC(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)c(C)s1 505928540 PUIFXOHUBRBRAL-QGZVFWFLSA-N 380.435 5.088 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H]2CCC[C@@H](C)C2)cc1 508239037 CFLPSLUEGMLNOB-VQIMIIECSA-N 393.487 5.402 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(OC(F)(F)F)cc2)nnc1-c1ccco1 512518665 MAPXXICZPKMBDR-GFCCVEGCSA-N 395.406 5.476 30 20 GKED COCc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 515719455 LOBTYAQPJLGMIK-UHFFFAOYSA-N 392.842 5.403 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 518028742 IFILNNFCAHMFSL-CYBMUJFWSA-N 393.339 5.517 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 518653537 JYTRIUUMVWTICN-HNNXBMFYSA-N 392.842 5.410 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1 520714283 LRSPGSPGRBZUCQ-JOCHJYFZSA-N 390.483 5.189 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1cc(F)c(Cl)cc1Cl 520931381 CGMHDGOPCRVZHS-ZDUSSCGKSA-N 381.278 5.666 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c1 521261263 OUAPNLWSTOURCM-QHCPKHFHSA-N 389.499 5.882 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@@]1(C#N)CCC[C@H](C)C1 524197684 VDQHTTHAEQVSPL-BTDLBPIBSA-N 379.938 5.036 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1 525756673 ONHKFMMSOWUTTC-KBPBESRZSA-N 381.932 6.055 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ncoc2-c2ccccc2)c1 531661154 LHLSOEPQDLJYRH-UHFFFAOYSA-N 395.462 5.082 30 20 GKED C[C@H](N[C@@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1)c1ccc(C#N)cc1 532906915 HIAIHSRABJZDSC-FIKGOQFSSA-N 382.479 5.057 30 20 GKED C=C(C)[C@H](CC(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1)OCC 535966380 WVOLGVNNPOOUHM-KRWDZBQOSA-N 396.318 5.106 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](C)c1ccc(C#N)c(F)c1 538509839 VTTDETHCQCUBTH-OLZOCXBDSA-N 399.922 6.195 30 20 GKED N#CC1(c2ccc(-c3nc(Cc4nc5cc(Cl)ccc5s4)no3)cc2)CC1 544984041 JIDNFRZWGVLPJV-UHFFFAOYSA-N 392.871 5.146 30 20 GKED C=C[C@@H](Cc1nc(-c2cc(Cl)ccc2O[C@H]2CCOC2)no1)c1ccccc1 547267026 VPFXLQALKWZFHJ-YJBOKZPZSA-N 396.874 5.070 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC3(CCCC3)C2)cc1Cl 547996535 FAOQIYOGFJHPKN-IBGZPJMESA-N 379.891 5.403 30 20 GKED C[C@@H](C1CC1)N(C(=O)c1ccc(F)c(C#N)c1)c1cccc(C(F)(F)F)c1 551563097 GISPJIZETUQMMK-LBPRGKRZSA-N 376.353 5.161 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cncc(-c2cccc(C)c2)c1 553121112 LORQXTZAOXTVBD-UHFFFAOYSA-N 388.515 5.053 30 20 GKED CN(C)c1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 555085300 HAJWJBZOFZOMSB-QGZVFWFLSA-N 381.888 5.020 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1O[C@@H](C)C(F)(F)F 572520883 RMSFJYNSQSJOIK-ZDUSSCGKSA-N 384.423 5.298 30 20 GKED Cc1nsc(NC(=O)c2cc(Cl)ccc2SC2CCCC2)c1C#N 578323195 RYEXLYXYCDEZPE-UHFFFAOYSA-N 377.922 5.264 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(-c2nc3ccccc3s2)o1 583076071 PRILTRGUWCLKGT-IBGZPJMESA-N 385.492 5.595 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc2c1ccn2C(F)F 596981656 PIYKXTNJYMVZGX-PXNSSMCTSA-N 394.425 5.340 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2ccccc2)cc1Cl 603673447 YVMNPNOTWHSPMN-HXUWFJFHSA-N 392.911 5.726 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2cccs2)cc1Cl 603673455 ZUXFHRCDOOGZPY-LJQANCHMSA-N 380.900 5.628 30 20 GKED COc1ccc2c(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)coc2c1 604457037 MCZWUSIWCHGJKZ-UHFFFAOYSA-N 398.418 5.287 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1ccc(CC)cc1 604930569 SGSONPWYJSGMLG-UHFFFAOYSA-N 383.492 5.037 30 20 GKED CCc1c(C)sc(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)c1C#N 609032533 MLFQHNGBYYPMLS-UHFFFAOYSA-N 395.553 5.412 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)Nc1ccccc1S[C@@H](C)CC#N 609427782 LBUFPHDCUWJEQP-FUHWJXTLSA-N 394.540 5.538 30 20 GKED C[C@H](CSc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609500450 JQJGXBFCUKGLTP-MRXNPFEDSA-N 389.480 5.112 30 20 GKED CCOc1ccccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723348 IFBXOLGSKBZDLV-UHFFFAOYSA-N 392.842 5.655 30 20 GKED COc1cc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)ccc1OCC(C)C 611392609 YTGYKHBIVUQIOB-HTAPYJJXSA-N 378.516 5.330 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)CCCc1cc(Cl)sc1Cl 618738434 HNVATACCNVXYAM-HNNXBMFYSA-N 379.312 5.053 30 20 GKED C=CCN(C(=O)c1ccc(CN(CC)CC)o1)c1nc(-c2ccccc2)cs1 645939411 MCFSVUIYDPMFQV-UHFFFAOYSA-N 395.528 5.078 30 20 GKED C[C@@]1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCCc2ccccc21 726323034 WLVNMYAUNISFMH-YCRPNKLZSA-N 380.900 5.420 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCc1ccc(F)cc1F 727060637 TYMPSYQVZSTDPY-UHFFFAOYSA-N 388.849 5.051 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccco3)s2)cc1 728813081 HCWNCOXXSRUAEQ-SFHVURJKSA-N 385.448 5.311 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)NCCSc1ccccc1 730955241 VWBDKUVCEGWLRO-OAHLLOKOSA-N 387.599 5.017 30 20 GKED C#CCOc1ccc(NC(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)cc1 731112347 IJOAJYBCGQSNDM-INIZCTEOSA-N 391.496 5.013 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1ccccc1S[C@H](C)CC#N 731332735 QUIJGYOPLWRBSW-OYTYHKKUSA-N 394.540 5.910 30 20 GKED CC(C)c1ccc2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)[nH]c2c1 731349625 POKGEYPERQWLOQ-OAHLLOKOSA-N 377.513 5.938 30 20 GKED C=CCOc1ccc(CNCc2ccc(Br)cc2F)cc1Cl 732231256 PJRPOLUTIQVQIP-UHFFFAOYSA-N 384.676 5.096 30 20 GKED COc1ccc([C@H](C)OC(=O)CCCCOc2cccc(C#N)c2)cc1Cl 732503550 JAYPKJBYFCGUGM-HNNXBMFYSA-N 387.863 5.074 30 20 GKED C#CC[C@@H](OC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccccn1 733692784 LHPRIDDLJIPYCR-MRXNPFEDSA-N 390.489 5.341 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cccc(CSCc2ccccc2)c1 734762599 BNEYBEMQPBXUKP-UHFFFAOYSA-N 389.549 5.801 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3c(Cl)nc4ccccn34)cs2)cc1 737445678 FDZCJEHLMJFEGW-KTKRTIGZSA-N 379.872 5.316 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1ccc2c(c1)COC2 742434320 FSNYAKPPCHUNGI-VMPITWQZSA-N 397.883 5.302 30 20 GKED CCN(CCC#N)Cn1c(=S)cc(-c2ccccc2)c2ccc(OC)cc21 742540309 INBIKDLMUYBYPI-UHFFFAOYSA-N 377.513 5.239 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(OC)cc1 752481378 LFHVWHKDKJGSCC-SUMWQHHRSA-N 398.915 5.718 30 20 GKED C#CCCCCNC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 758887744 FXBJFAWIZYSGCK-IBGZPJMESA-N 379.504 5.115 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760365144 KLKFVOSGMIRVGX-DHIUTWEWSA-N 376.500 5.408 30 20 GKED O=C(/C=C/c1ccc(Cl)nc1Cl)c1ccc(Br)cc1F 761480797 UDGHTVKXGYMRGX-ORCRQEGFSA-N 375.024 5.186 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(C3CCCCC3)nc2C)cc1 775228411 UNONSIOYFRITIK-SFHVURJKSA-N 395.528 5.023 30 20 GKED CCCCCCCCC(=O)N1[C@H]2CC[C@H]1CC(N(C)C(=O)c1ccccc1)C2 777233066 ZWFCRDHVVKMFRF-SFTDATJTSA-N 384.564 5.031 30 20 GKED Cc1sc(NC(=O)c2ccccc2OCC#N)nc1-c1cccc2ccccc12 778250433 HPDHAPVTTJWMRQ-UHFFFAOYSA-N 399.475 5.426 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl 780668665 DLGCZVQAZUBURU-ABAIWWIYSA-N 390.270 5.093 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)C1CCCCC1 780671428 XQAUTDZJUBKBJV-GOSISDBHSA-N 377.488 5.344 30 20 GKED C=CC[C@@H](N[C@@H](CC)c1ccc(Br)cc1Cl)c1ccncc1 783247491 YTAUUKSXSHCYQD-ZWKOTPCHSA-N 379.729 5.856 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccncc1 788863325 IKBXKPNMMSTFGQ-KRWDZBQOSA-N 386.373 5.408 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C/c2ccccc2OC(F)(F)F)s1 797571078 NIUOELCHQBRSJY-MMQHEFTJSA-N 394.418 5.229 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2nc3ccc(Br)cc3s2)co1 806557595 FCAGDZUXLULHGO-AATRIKPKSA-N 377.263 5.066 30 20 GKED C#C[C@H](NC(=O)c1ccccc1SCc1cc(C)no1)c1ccc(Cl)cc1 811946948 OUKYBGQEKJJZGC-IBGZPJMESA-N 396.899 5.033 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211844 ROHXDFSLMQRSOV-YGRLFVJLSA-N 384.810 5.111 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)F)cc2F)cc1 847624394 UUFLLKPQUWNYFH-KRWDZBQOSA-N 388.389 5.067 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3)no2)cc1 915179784 IZTZHPPKSFRSIM-NRFANRHFSA-N 379.419 5.249 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1N=Cc1cc2ccccc2nc1O 915980166 XRRMFAGVANQMFM-UHFFFAOYSA-N 381.435 5.252 30 20 GKED N#C[C@H](C(=O)CCC1CCCC1)C(=O)Nc1ccccc1Oc1ccccc1 916904564 GGUCGVPSOSGASC-LJQANCHMSA-N 376.456 5.097 30 20 GKED Cc1ccc(-n2c(C)cc(-c3csc(NC(=O)C(C)(C)C#N)n3)c2C)cc1 917575697 FFHHZGNUVCJAAV-UHFFFAOYSA-N 378.501 5.014 30 20 GKED CC(=NN=C1c2ccccc2-c2ccccc21)c1cnc2ccccc2c1C(=O)O 1776027915 QKHFMNNDLXYSLP-UHFFFAOYSA-N 391.430 5.175 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(OCc2ccc(Cl)cc2)cc1 1776029997 ABQGLKXRPGMFHJ-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 1776086126 CSSKWAYFAJWHDL-UHFFFAOYSA-N 395.440 5.166 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1cc(F)ccc1Oc1ccc(Cl)c(CC)c1 1776148410 JJZQKPCMEFXSPF-KRWDZBQOSA-N 391.870 5.343 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3)s2)c1)C(=O)O 1776470956 RMGJJWFJTDJPOX-PABFRNLHSA-N 378.449 5.163 30 20 GKED O=C(/C=C\c1ccc([N+](=O)[O-])cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569996 YBOXTLNIFCUAGO-VURMDHGXSA-N 397.770 5.103 30 20 GKED O=C1/C(=C/c2cccc(Oc3ccc(F)cc3)c2)C[C@H](C(=O)O)c2ccccc21 1777698318 DVBYRNAPHODGDQ-KFGZODLXSA-N 388.394 5.456 30 20 GKED C=CCn1c(SCCCC#N)nc2scc(-c3ccc(C)cc3)c2c1=O 4286232 UHENCFJAEZYMCH-UHFFFAOYSA-N 381.526 5.015 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc2ccccc2n1C(F)F 41556579 YMCMZTHFTQRATC-QGZVFWFLSA-N 395.409 5.243 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cnn1C(C)(C)C 51154777 KDWIUMIQPLUAHB-INIZCTEOSA-N 392.528 5.123 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N(C)Cc3cccc(C#N)c3)cc2)c1 56711059 LTTTZVWTTZLLGV-UHFFFAOYSA-N 387.439 5.023 30 20 GKED C=C(C)COc1cc(CN[C@@H]2CCSc3ccc(Cl)cc32)ccc1OC 60949629 DITRNQNROIBLJC-GOSISDBHSA-N 389.948 5.630 30 20 GKED Cc1csc([C@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 67938962 FMMLKFZMNHPEDA-HNNXBMFYSA-N 393.537 5.107 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(-c3ccccc3)cc2)cc1 107830054 KIVBUFCWRPEHMJ-UHFFFAOYSA-N 394.396 5.430 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1coc(-c2cccs2)n1 109028158 OYBZMJVODVHRNS-CYBMUJFWSA-N 398.513 5.119 30 20 GKED N#CCCCOc1cccc(CNCc2ccccc2CN2CCCCCC2)c1 112710456 RUUNKTFDRNFBSX-UHFFFAOYSA-N 391.559 5.035 30 20 GKED N#CCCCOc1cccc(NCc2csc(COc3ccccc3)n2)c1 114764104 LPBRQHSEKNWWRB-UHFFFAOYSA-N 379.485 5.017 30 20 GKED C=CCC(CC=C)C(=O)Nc1c(Br)cc(F)cc1Br 122510167 YBJDIBWWXPQNEG-UHFFFAOYSA-N 391.078 5.058 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3ccsc3C2)cc1 131253112 MGTJPFCZJQOTKP-UHFFFAOYSA-N 375.453 5.002 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H](C)c2ccc(Br)cc2)n1 153550129 HGNRCYPXFNWSHE-SWLSCSKDSA-N 391.334 5.399 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Br)c2ccccc12 181373433 LIZXHVWVKCMADL-UHFFFAOYSA-N 398.260 5.143 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@H](c3ccc(Cl)cc3)C3CCCC3)o2)cc1 182540673 QQIIZCWLCGALTR-NRFANRHFSA-N 392.890 5.283 30 20 GKED C=C(C)[C@@H](NCC(=O)Nc1c(Cl)cccc1Cl)c1ccc(F)c(F)c1 187760565 DCVUMKPHINUQKR-QGZVFWFLSA-N 385.241 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)ccc1F 189897360 TUHJCOCIRXYUAF-UHFFFAOYSA-N 376.269 5.692 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(-c2ccncc2)ccc1OC 277247339 JORUOPHEWWZQOD-OAQYLSRUSA-N 384.520 5.051 30 20 GKED C=CCCc1ccccc1NC(=O)C1CCC(NC(=O)CC2CCCCC2)CC1 410350067 HRJVKYZLVNIHLP-UHFFFAOYSA-N 396.575 5.389 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cn1 429382720 JFRSKLUGIPGYBF-OAHLLOKOSA-N 387.443 5.162 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1)c1ccccc1 431303625 ZVNRAHMBSYXJAL-DXIQSLLYSA-N 379.479 5.196 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC[C@H]1CCC(F)(F)C1 432073010 VHYMMPPRKCTKLE-SFHVURJKSA-N 399.441 5.003 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(COC2CCCC2)cc1)c1ccccc1 432952858 AXWPSVKRCDDTAP-QHCPKHFHSA-N 391.515 5.702 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@@H](Sc3cccc(Cl)c3)C2)c(Cl)c1 433285778 SXFVTOFODQPEMI-OAHLLOKOSA-N 392.311 5.264 30 20 GKED CC(C)(C#N)CCCOc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1 433608112 MBFUKCLUMHEBQX-UHFFFAOYSA-N 384.907 5.021 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc2ccccc2n1C(F)F 437374790 RZVVTHDWEMFKNC-CYBMUJFWSA-N 394.406 5.045 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(C(F)F)cc2)cc1F 437477150 SYFUQMYQPYXQBD-UHFFFAOYSA-N 382.341 5.680 30 20 GKED C[C@H]1c2ccccc2O[C@@H]1[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 438667232 KBXAJKJCJXGAFU-KQDGPHEJSA-N 395.528 5.013 30 20 GKED CCOc1ccccc1NC(=O)[C@H](Sc1ccccc1C#N)c1ccccc1 439711560 UOPINADHOFKHCX-JOCHJYFZSA-N 388.492 5.429 30 20 GKED C[C@@H](SCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 443142443 HDUJATUZABBMPR-LLVKDONJSA-N 398.837 5.663 30 20 GKED N#CCCCCN[C@@H](c1ccc(Br)cc1C(F)(F)F)C1CC1 447533411 RILHMQNLIFOUFD-OAHLLOKOSA-N 375.232 5.202 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 448729332 NTONKTOIUMXNIR-KRWDZBQOSA-N 390.405 5.249 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@@H]2CCCC2(F)F)cc1 452861866 ZERSRHDCCVIFOL-KRWDZBQOSA-N 386.467 5.016 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCn1c(C)nc2ccccc21 475557282 XMAYQBGLYVUMJR-UHFFFAOYSA-N 390.531 5.408 30 20 GKED Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 477975399 LFAPQMRQYSVHAW-UHFFFAOYSA-N 378.435 5.176 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F 481483262 IVOORGLBJGHYEC-KRWDZBQOSA-N 377.410 5.072 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(C(C)(F)F)c1 482512332 QPMATJIWYYCYJE-UHFFFAOYSA-N 376.451 5.186 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)Nc1cccc(OCCCC#N)c1 484979377 JPXYYOOGVBPVPG-UHFFFAOYSA-N 394.258 5.329 30 20 GKED CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)[C@H](c1ccccc1)C(F)(F)F 485456291 VYRJBYKXWMCYIO-CQSZACIVSA-N 379.275 5.220 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccccc1Br 486461381 ZFLDXVZAJIEYLR-UHFFFAOYSA-N 380.245 5.120 30 20 GKED Cc1ccc2ncc(C#N)c(N3CCC(c4noc5cc(F)ccc45)CC3)c2c1 488088045 HNHLXMIAYMCVMA-UHFFFAOYSA-N 386.430 5.079 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)c(F)c2)nnc1-c1ccccc1OC 497662506 BGKUQNNGFGSAOI-CYBMUJFWSA-N 387.455 5.271 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)c1 506687415 ATDZJAAIZBXUTA-GOSISDBHSA-N 387.291 5.446 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H]2CCC[C@H](C)C2)cc1 508239033 CFLPSLUEGMLNOB-LPHOPBHVSA-N 393.487 5.402 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(OC(F)F)cc1 513048705 FEUBCWQAVRQRPJ-HNNXBMFYSA-N 392.405 5.318 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 518168312 AFZCPIVNJYFPMC-RHSMWYFYSA-N 385.558 5.541 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1cc(Cl)ccc1Oc1ccc(OC)cc1 520636658 PLMIQNMDZMOGBG-CQSZACIVSA-N 375.852 5.061 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(Cl)cc2cccnc12 520974008 MXQHDFUPCOTFNB-UHFFFAOYSA-N 377.875 5.058 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 521768312 CGTKPVPHGSAVIT-IBGZPJMESA-N 396.277 5.359 30 20 GKED CCc1ccc(O)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 535419489 OMBPNBGPBCNWLG-UHFFFAOYSA-N 388.492 5.371 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 540220327 YTZQCCSWPPYPOQ-AGILITTLSA-N 397.522 5.204 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 540538412 HXIZFLTXFJPGKY-CQSZACIVSA-N 390.936 5.437 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 541447409 YIUKUUVVDPXPJF-HKUYNNGSSA-N 379.529 5.268 30 20 GKED C=CCn1c(SCc2ccc3ncccc3c2)nnc1-c1ccccc1F 545314886 DSVCIGXTSXLKAC-UHFFFAOYSA-N 376.460 5.111 30 20 GKED C[C@H]1C(=O)CC[C@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1(C)C 548366733 FDUZKIXVFUQNRV-WMLDXEAASA-N 394.446 5.070 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)c(F)c1 551211713 KPVHNICACNQJBY-IFXJQAMLSA-N 375.285 5.674 30 20 GKED C[C@H](Nc1cccc(Oc2ccccc2)c1)C(=O)N(CCC#N)c1ccccc1 552445428 QOWKETRFYLMGNI-IBGZPJMESA-N 385.467 5.226 30 20 GKED Cc1c(C(=O)N[C@](C)(C#N)C2CCCCC2)sc2nc(C(F)(F)F)ccc12 555905299 YVMWLNZAUFXHIB-GOSISDBHSA-N 395.450 5.216 30 20 GKED Cc1c(C(=O)Nc2cc(F)ccc2OC(F)F)sc2ccc(C#N)cc12 556630349 QWLUGBSUUGWAKL-UHFFFAOYSA-N 376.359 5.074 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1Cl)c1ccc(Br)cc1F 566038964 TUKPOVSHIWGNBQ-MNOVXSKESA-N 381.676 5.525 30 20 GKED N#Cc1cccc(C2(NCc3cn(-c4ccccc4)nc3-c3ccccc3)CC2)c1 573987130 REHDGNODLUPXEY-UHFFFAOYSA-N 390.490 5.190 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CCCc1nc2ccccc2s1 584476233 VMYQJMNULHFHPQ-UHFFFAOYSA-N 396.560 5.001 30 20 GKED CCN(C(=O)CCCCCC#N)[C@@H]1CCSc2ccc(Br)cc21 588753666 BLLADOLGUAZDEQ-MRXNPFEDSA-N 395.366 5.309 30 20 GKED CCCc1c(N[C@H](C)c2ccc(C(F)F)nc2)cnn1-c1cccc(C#N)c1 595043717 ZJJNJGFSEFEVPR-CQSZACIVSA-N 381.430 5.202 30 20 GKED N#CC1(CCCSCc2oc3ccccc3c2Br)CCOCC1 596381206 JFILSAYYMRJDLJ-UHFFFAOYSA-N 394.334 5.529 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@H]1CCCCC1(F)F 596393315 JVVZVBJLBIVVTQ-LSDHHAIUSA-N 398.544 5.436 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1CC[C@@](C)(C#N)C1 598417414 JWIHWPNWTJGXLT-IBGZPJMESA-N 392.286 5.148 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 603754863 FIRFYEAUYWSFLS-HOCLYGCPSA-N 376.378 5.053 30 20 GKED CCOc1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1OC 609175910 OEQNDNNZUYRTNI-UHFFFAOYSA-N 388.423 5.010 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)sc2cccc(F)c12 609377808 NGWKOVZWMIIOIA-GFCCVEGCSA-N 384.501 5.853 30 20 GKED CC(C)(C)c1ccc(O)c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 609547898 ZAHBIUAAWBIKBV-UHFFFAOYSA-N 387.439 5.001 30 20 GKED Cc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 613347068 WMPPTDOYNWLQJT-OAHLLOKOSA-N 387.291 5.915 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)oc2c(F)cccc12 613403789 TZHVJJUEHLFVMJ-LBPRGKRZSA-N 384.819 5.634 30 20 GKED O=C(c1cc2cc(F)ccc2s1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618363758 NKDBPTZHVHZNPE-UWVGGRQHSA-N 399.331 5.243 30 20 GKED FC(F)(F)c1ccccc1CN1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618448790 BQVGNEDTZYBRKO-QWRGUYRKSA-N 379.266 5.268 30 20 GKED C[C@H](CC(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1)C(F)(F)F 626849074 MAENYUNQFITYRL-LLVKDONJSA-N 385.323 5.081 30 20 GKED C=CCN1C(=O)c2ccccc2N[C@@H]1c1cnc(-c2ccc(Cl)cc2)s1 639402709 AWPZETOBQVZIFK-SFHVURJKSA-N 381.888 5.216 30 20 GKED Cc1ccc2nc(C)c(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2c1 642281364 CXWGSKSEEHFXMG-IBGZPJMESA-N 383.476 5.465 30 20 GKED CCCn1nccc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 657498083 MWTGEGSUMMRRQN-UHFFFAOYSA-N 383.311 5.195 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1F 675627438 IFROETWBDRVYNZ-BRPSZJMVSA-N 391.714 5.118 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(C(F)(F)F)cc1 682777619 NXDPUQFTDPRJTQ-UHFFFAOYSA-N 390.449 6.221 30 20 GKED Cc1nc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)sc1-c1ccccc1 727586104 CSLQNEJHTOPOJB-UHFFFAOYSA-N 388.496 5.187 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(Cl)c2SC(F)F)cc1 728474138 VSYXNTYWZGAYDQ-UHFFFAOYSA-N 384.860 5.257 30 20 GKED C[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 734080692 ZTYLVGLPHUHYKZ-RISCZKNCSA-N 380.435 5.708 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccncc1 734237245 MDIRYWIJIQHHHG-HSZRJFAPSA-N 398.462 5.454 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)c1ccncc1 734461206 XCDJWWRHQKZARD-OAQYLSRUSA-N 380.850 5.588 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@H]2c2ccc(C)o2)c1 739023266 LJHGFWFFDLFXTR-FPOVZHCZSA-N 395.503 5.096 30 20 GKED C=CCCCCCN(C)C(=O)COc1ccc(C2SCCCS2)cc1 739653829 FZIVYGYUCYXLDC-UHFFFAOYSA-N 379.591 5.139 30 20 GKED C/C(=C\C(=O)Nc1nc(C)c(SCC#N)s1)c1cccc(C(F)(F)F)c1 742608690 BJSITTKCFDOUJP-CSKARUKUSA-N 397.447 5.128 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1C 747117764 UOXLGIIYXANWPI-QGZVFWFLSA-N 382.460 5.088 30 20 GKED CCS[C@@H]1CCC[C@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748942211 NGWNMVPSQWOECI-PWRODBHTSA-N 379.529 5.138 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])cc2)cc1 749923258 JJOFPBCGFOCUJS-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(F)cc3F)n2)cc1 752476445 RARMHTCRNJPCMR-QGZVFWFLSA-N 382.435 5.206 30 20 GKED Clc1cc(Cl)c(NN=Cc2cnc(-c3ccncc3)s2)nc1Cl 753160358 DDJLTFHIVLYROR-UHFFFAOYSA-N 384.679 5.006 30 20 GKED C#Cc1cccc(NC(=S)N(C)[C@H](c2ccc(Cl)cc2)C(F)(F)F)c1 758446296 FEJSPPDFJGIIAH-MRXNPFEDSA-N 382.838 5.254 30 20 GKED Fc1ccc(C2OCCO2)c(Cl)c1C=NNc1cc(Cl)cc(Cl)c1 761832164 WQFLNDZRXSPEON-UHFFFAOYSA-N 389.641 5.277 30 20 GKED CCCOc1ccc(C=NOCc2nc(-c3ccccc3)cs2)cc1OC 766683646 FCDWQSAZCNBSQZ-UHFFFAOYSA-N 382.485 5.158 30 20 GKED Cc1c(C#N)cccc1NC(=O)Nc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1 770291011 QVPLYMLKZFBXJJ-HNNXBMFYSA-N 394.475 5.096 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](Cc2ccccc2)c2sccc2C)c1 772982669 FCDIYUYAFIACPR-FYYLOGMGSA-N 390.552 5.811 30 20 GKED N#CCOc1ccc(Cl)cc1CNC1(c2ccc(F)cc2F)CCCC1 775537259 HLTQDJRFNNXUJA-UHFFFAOYSA-N 376.834 5.080 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3cccc(F)c3F)c2)cc1 776268077 LQUYCKXTGNXFKJ-JYRVWZFOSA-N 393.389 5.122 30 20 GKED N#Cc1cc(N[C@H]2CCCCc3ccc(Cl)cc32)ccc1N1CCC(O)CC1 777118148 RZJLZYZQTVDISQ-QFIPXVFZSA-N 395.934 5.052 30 20 GKED Cc1ccc(-c2cc(C(=O)O[C@H](C)C(C)(C)C#N)c3cnn(C(C)C)c3n2)cc1 777332570 DWVXJFDVUMPTOW-MRXNPFEDSA-N 390.487 5.083 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=S)N[C@@H](C)c1ccc(Cl)cc1Cl 779729256 YSDKMOMLHHZUSR-RYUDHWBXSA-N 394.327 5.332 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 785696097 BWLVWPFAJNKDSI-UONOGXRCSA-N 385.360 5.545 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)c2ccccc21 786314398 UNHIGJDQYJCPOT-ZYSHUDEJSA-N 394.902 5.305 30 20 GKED Cc1c(C(=O)/C=C\c2ccc3ccc(Br)cc3n2)cnn1C(C)(C)C 787187517 VHOQYUFXYXWTIJ-KTKRTIGZSA-N 398.304 5.153 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)[C@@H]3CCC(=O)c4ccccc43)cc2)cc1 790814554 JHCDUAVSMDDFJC-JOCHJYFZSA-N 383.403 5.016 30 20 GKED C=CC[C@H](OC(=O)Cc1ccc([S@](C)=O)cc1)c1ccc(Cl)c(Cl)c1 805947402 NGVLZQAQCKBHPX-BVZFJXPGSA-N 397.323 5.134 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C\C(=O)c2nccc3ccccc23)cc1 811698204 IZAGVUHJRFPVLA-YFHOEESVSA-N 399.402 5.001 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(C(F)(F)F)cc1 813212097 XFACPKZTPVIXPJ-HZMBPMFUSA-N 386.295 5.099 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(Cl)nc(C3CC3)c2)cc1 847626953 VIQTVPJESYXKDR-FZKQIMNGSA-N 395.890 5.087 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCC=C(Cl)Cl 853782740 LIHVWHLDTIUAIT-NSHDSACASA-N 375.346 5.072 30 20 GKED Cc1cc(NC(=O)[C@@H](C)Cc2ccc(C#N)cc2)ccc1NC(=O)OC(C)(C)C 856369722 PMFUAGZCUXNAMS-INIZCTEOSA-N 393.487 5.031 30 20 GKED Cc1sc(NC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)c(C#N)c1C 876049230 VJYNRTHCMNSJAM-YBEGLDIGSA-N 382.485 5.617 30 20 GKED N#Cc1ccccc1/C=C\C(=O)OCc1csc(Cc2ccc(Cl)cc2)n1 915232972 KVMMWIRHMIDFHD-YFHOEESVSA-N 394.883 5.016 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccc(Cl)s2)cc1 915683966 RZMDYWQQZMWHCL-IBGZPJMESA-N 395.915 5.421 30 20 GKED O=C1/C(=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)CCc2ccccc21 916135704 JQVFOAKEKOGWRG-RCCKNPSSSA-N 391.474 5.206 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917044433 RYDHIABNDRDHGY-HNNXBMFYSA-N 386.929 5.617 30 20 GKED C[C@@H](Cc1cccc(F)c1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921132366 QATCJXRJTVUXKT-UGSOOPFHSA-N 398.890 5.658 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1ccc(C(=O)O)cc1 1776012739 YZAKVZFZJNVDMF-UHFFFAOYSA-N 380.831 5.585 30 20 GKED O=C(O)c1cc(NN=C(CCc2ccccc2Cl)c2ccccc2)ccc1F 1776062102 FCQSTQGVSWCFAF-UHFFFAOYSA-N 396.849 5.626 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(O)c2)cc1 1776125766 RXZGVRDQSSAFJY-LEHPZIBWSA-N 396.483 5.582 30 20 GKED O=C(O)c1cc(F)c(/C=C/C(=O)c2ccccc2OCc2ccccc2)cc1F 1776126207 GCKHJWFMUKWHIO-ZHACJKMWSA-N 394.373 5.138 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)c1)C(=O)O 1776470695 CVKGEHHWGLUIFS-AYLMVEPYSA-N 398.764 5.107 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@@H](CC(=O)O)c2ccc(C)cc2)cc1 1776785866 LSQNVPVYJDPXDN-QHCPKHFHSA-N 395.543 5.844 30 20 GKED CCCCCOc1cc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)ccc1OC 1776793041 IABCAVAYZFOMQS-NXNYUAIASA-N 394.467 5.102 30 20 GKED O=C1/C(=C/c2cccc(SC(F)(F)F)c2)C[C@H](C(=O)O)c2ccccc21 1777698388 KKWDKNOFRWBIBI-RCLKMUNOSA-N 378.371 5.137 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc2ccccc2n1 47376716 DSJXBMGHNCXVSU-IBGZPJMESA-N 386.382 5.036 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)N[C@H](C)c1ccc(C#N)cc1 54839332 NARZTLPUJJMECV-GDBMZVCRSA-N 390.512 5.112 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(COc2ccc(C#N)cc2Cl)cs1 54915488 CHRSGFYQRCWXHR-UHFFFAOYSA-N 397.887 5.240 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(C2SCCCS2)cc1 56476668 ACYAVUSPBURLJU-UHFFFAOYSA-N 384.526 5.078 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1cc2ccccc2o1 60960676 SSQFBOCSHQNYHI-SFHVURJKSA-N 382.463 5.734 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCOc1ccc(Cl)cc1Cl 65839615 PWBQHKWBJSPNGU-UHFFFAOYSA-N 393.270 5.060 30 20 GKED C[C@H](NC(=O)Nc1cccc(CSc2ccccn2)c1)c1ccc(C#N)cc1 105029433 GYZJTPNWAIRAIZ-INIZCTEOSA-N 388.496 5.128 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(Cl)c1 109028935 HLBBBECAZROROV-BEFAXECRSA-N 399.947 6.103 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cccc(Cl)c2SC(F)F)cc1 110221322 KGRAJYVENPBVDU-UHFFFAOYSA-N 398.887 5.398 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C(C)C 128340889 WPXVYONCXCYGGU-CYBMUJFWSA-N 383.517 5.153 30 20 GKED CN(C[C@@H]1CCCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 128427488 FLTWMRWXLWMRLE-ICSRJNTNSA-N 397.906 5.028 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccc(Cl)cc1NC(=O)c1ccco1 131547046 WMRGTHLUCZGXNE-UHFFFAOYSA-N 393.874 5.599 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 154324797 IFTJFKZOZXUASM-UHFFFAOYSA-N 386.455 5.050 30 20 GKED C#CCOc1ccc([C@H](C)N[C@H](C)c2cccc(OCc3ccccn3)c2)cc1 165806078 HXYFBUBMOCIPME-VQTJNVASSA-N 386.495 5.084 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 174002887 SSRLIKLRXAAQAC-FPMFFAJLSA-N 388.826 5.208 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1F 178710327 JLTPKYGQMQHCPQ-RISCZKNCSA-N 389.352 5.080 30 20 GKED CC1CCN(c2ccc(NCc3cn(CCC#N)nc3-c3ccccc3)cc2)CC1 178814485 TXVZRMLZCBTCJK-UHFFFAOYSA-N 399.542 5.312 30 20 GKED COCCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 178843488 RHYLATUEDJIOOZ-ZDUSSCGKSA-N 395.311 5.110 30 20 GKED CCN(C(=O)c1cnc(-c2ccc(OC)cc2)s1)c1ccc(C#N)c(Cl)c1 179523089 FKWRRRVNTZQTII-UHFFFAOYSA-N 397.887 5.010 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)c1ccccc1 188044702 UZYGBDLQVXTPDV-JIPXPUAJSA-N 383.557 5.422 30 20 GKED COc1ccc(C(C)(C)/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)cc1 329518005 PMKMRXWQWBZCNS-FQEVSTJZSA-N 381.520 5.319 30 20 GKED O/C(=N/CCc1nc(C2CCCCC2)cs1)[C@@H]1C[C@@]12CCOc1ccccc12 329721696 NDEWZLHWUWVXQT-FDDCHVKYSA-N 396.556 5.430 30 20 GKED Cc1cc([C@@H]2CCCN2C(O)=Nc2cc(Cl)ccc2OCC2CCC2)on1 329799253 HILFEQAWJWHZCJ-KRWDZBQOSA-N 389.883 5.198 30 20 GKED COc1c(-c2noc(-c3sc4ccc(C#N)cc4c3C)n2)cnc2ccccc12 426420708 OPOUMFZZGNMAHJ-UHFFFAOYSA-N 398.447 5.355 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc(OCc3cccc(C#N)c3)cc1C)C2 432078712 RFSFEEWOWISNQK-UHFFFAOYSA-N 397.478 5.302 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2ccco2)nn1C(C)C 433894828 UGPICSRVHNKOCS-UHFFFAOYSA-N 391.475 5.038 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c(Br)c1 437647905 FDCAZJLAXDGOKN-QFBILLFUSA-N 398.304 5.061 30 20 GKED Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 437914410 YRMLPMJHKFKYAQ-YADHBBJMSA-N 375.516 5.596 30 20 GKED C[C@H](C(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccc2ccccc2c1 439794056 NWRQSTADOAYLHX-INIZCTEOSA-N 396.412 5.406 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1sccc1Br 448941064 CAMUTEVNLDYTSU-NSHDSACASA-N 395.347 5.086 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2F)c(Cl)c1 455708374 TXZXXHIODJTWQY-IBGZPJMESA-N 389.833 5.443 30 20 GKED Cc1cc(Br)c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 457563499 DDBHVCUVKAJPHM-JTQLQIEISA-N 395.347 5.466 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1)c1ccccc1 458807858 YAAHOTDYLQSQFQ-FCHUYYIVSA-N 379.479 5.497 30 20 GKED C[C@@H](NC(=O)NCc1cc(C#N)ccc1F)c1ccccc1Oc1ccccc1 465797206 KFDGDDTVVNCARQ-MRXNPFEDSA-N 389.430 5.050 30 20 GKED N#CC1(c2ccc(C(=O)N[C@H]3C[C@H](c4ccc(Cl)c(Cl)c4)C3)cc2)CC1 467839804 OMLXBDYJKLKJKJ-JCNLHEQBSA-N 385.294 5.225 30 20 GKED C[C@@H](CCC#N)Sc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1 470444181 DEVIJNWDRSJXKN-HNNXBMFYSA-N 382.920 5.296 30 20 GKED C[C@H](Oc1ccccc1NCc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1 471661178 ATNADAFQJBNOOZ-KRWDZBQOSA-N 396.450 5.360 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 471911809 OSGPTQOTNOOQOA-DHIUTWEWSA-N 389.543 6.066 30 20 GKED C=CCn1c(SCC(=O)c2csc3ccccc23)nnc1-c1ccoc1C 475965472 GIYVADCBTFMWTG-UHFFFAOYSA-N 395.509 5.222 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCC(C)C)c(OC)c1 476796365 RSLUMKOMNQNLPL-UHFFFAOYSA-N 381.516 5.834 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2ccccn2)cc1 480594212 VESIQZAEIGLKJR-UHFFFAOYSA-N 399.903 5.809 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C 482231028 KIGNPXAVUNWEJW-FDDCHVKYSA-N 379.548 5.351 30 20 GKED C[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc2ccccc2n1C(F)F 486436257 MMSXCTUGWLSPKJ-SNVBAGLBSA-N 380.320 5.495 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@H]3C[C@H]3c3ccccc3Cl)s2)cc1 487392143 ZHLRVIKXVYEQFS-ROUUACIJSA-N 393.899 5.001 30 20 GKED COc1cc(SC)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 487441249 QUNBJYLKWURCLA-UHFFFAOYSA-N 390.464 5.333 30 20 GKED C=C(C)CN1CCC(NC(=O)N(CC(C)C)[C@H](C)c2ccccc2Cl)CC1 493788934 NUVQOZMRPZPDIP-GOSISDBHSA-N 391.987 5.109 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c1C 499521098 VBZYODAHMHRZPP-GFCCVEGCSA-N 394.418 5.088 30 20 GKED Cc1ccc(O[C@@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500766411 ATVQZEAAVHQXBB-SFHVURJKSA-N 386.451 5.373 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cccc(C(F)(F)F)c1 502415982 IFABNMZSRSSNEA-HNNXBMFYSA-N 399.416 5.137 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC[C@@H]1C(F)F 503070502 HHUZYVWMXAXOKJ-HXUWFJFHSA-N 399.441 5.097 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1 505891833 QNSUQLVHYXPZOE-UHFFFAOYSA-N 378.815 5.265 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(Cl)ccc1F 508383265 QEALQLCTKIYMQP-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)cc1 511771512 IWKSWBFTKRFELC-VWLOTQADSA-N 386.495 5.507 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc(-c3ccccc3)cn2)o1 515991436 LGXVVLQMWGFWPY-UHFFFAOYSA-N 395.418 5.045 30 20 GKED COc1c(F)cc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1F 520713273 JLLCZVLGNJSACU-UHFFFAOYSA-N 398.340 5.029 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC[C@@H]2CCCCO2)cc1Cl 521107073 YEXMOLUWXRPWHV-AZUAARDMSA-N 382.891 5.283 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N(C2CCCC2)C2CC2)c1 522576987 NZTZXMHCOWMEQE-UHFFFAOYSA-N 380.875 5.551 30 20 GKED C[C@H](N[C@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1)c1ccc(C#N)cc1 532906913 HIAIHSRABJZDSC-CSODHUTKSA-N 382.479 5.057 30 20 GKED C=C[C@H](CC(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 536244947 SLZUWLSOLSLCPR-LJQANCHMSA-N 384.479 5.546 30 20 GKED C[C@H](NCC#Cc1ccc(Cl)cc1)c1cccc(OCc2ccccn2)c1 537053736 CBBCLKCDNQBHLZ-SFHVURJKSA-N 376.887 5.016 30 20 GKED CC(C)Oc1ccc(CN[C@H](C)c2ccc(C#N)c(F)c2)c(C(F)(F)F)c1 537406624 GPSAKQDXGHENKI-CYBMUJFWSA-N 380.385 5.354 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nc2sc(C)c(C)c2c1=O 537557706 PZAIICFBGIFBDE-CYBMUJFWSA-N 397.525 5.255 30 20 GKED COc1ccc(C#N)cc1CN[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1 538200960 FRAXPVGVLRPQSH-QGZVFWFLSA-N 390.458 5.136 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 539124952 OCCGJKGDHZWDRY-MRXNPFEDSA-N 386.455 5.191 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 539601139 HDJJKROGFPEUQD-UHFFFAOYSA-N 384.435 5.295 30 20 GKED C=CCOc1ccc(CN[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1Cl 543642426 PMTXFJUJRXZJQF-GHTZIAJQSA-N 375.871 5.054 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@H]3/C=C\c3cccs3)o2)c1 543988656 VDJVUAIQGZKEST-GDWUOILNSA-N 390.512 5.128 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(SCc3ccccc3Cl)cn2)cc1 546219422 DZEVDLSCLRFZDS-UHFFFAOYSA-N 393.899 5.080 30 20 GKED N#C[C@H](C(=O)c1cnc(C2CC2)s1)c1nc(-c2ccc(Cl)cc2)cs1 552498057 NSMDKAVQKSLLRP-CYBMUJFWSA-N 385.901 5.287 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCSc2ccc(Br)cc21 552956738 NYEPXXUXUGDYMT-RBUKOAKNSA-N 399.357 5.525 30 20 GKED C=CCC(F)(F)c1nc(C2(c3ccc(Br)s3)CCC2)no1 576128155 WSNNCLNUTBJXBN-UHFFFAOYSA-N 375.238 5.032 30 20 GKED C=CCn1c(SCc2cc(Cl)cc(Cl)c2)nnc1-c1cccnc1 579293443 FZGKVPGCFPZVQM-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C[C@@H](Sc1cccc(F)c1C#N)C(=O)Nc1ccccc1-c1ccccc1 580516302 KIFOEGJNACPXCL-OAHLLOKOSA-N 376.456 5.484 30 20 GKED CN(C(=O)c1ccc(NC(=O)CCCCCC#N)cc1Cl)C1CCCCC1 588151859 HJKQOGQCGOGJOF-UHFFFAOYSA-N 389.927 5.157 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1 589404675 DWYIASUYABSHCU-HZPDHXFCSA-N 399.947 5.199 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 591781588 URPGQFPSFXHLLH-MWLCHTKSSA-N 389.286 5.648 30 20 GKED CCN(CCCC1(C#N)CCOCC1)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 595866918 NCQQHBSXVZMCMG-KRWDZBQOSA-N 382.470 5.059 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2sc3cc(F)ccc3c2Cl)c1 609067771 ZAFJTNWISBZNCL-UHFFFAOYSA-N 396.777 5.419 30 20 GKED CCCN(CC(C)C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609078357 KSRKSOSLMFGYSD-UHFFFAOYSA-N 379.504 5.346 30 20 GKED COc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609261824 AXLVRVKPZLTMHK-UHFFFAOYSA-N 398.871 5.113 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC(c4cccnc4)CC3)c2)cc1 611261471 YTJFDXPVFSQCTQ-UHFFFAOYSA-N 398.466 5.157 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC2(CCCCC2)C1 612834519 WVCLMTIQSRTBQH-UHFFFAOYSA-N 389.499 5.244 30 20 GKED CCn1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc21 613403800 VDBCWIWDHRTQTD-AWEZNQCLSA-N 379.872 5.414 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1 614484575 MCQQSNIZUWDYAJ-UHFFFAOYSA-N 396.581 5.752 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)C[C@H](C)C1(F)F 626369193 SLNMZXQUMHMYTN-UWVGGRQHSA-N 386.311 5.096 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)cc1NC(C)=O 726428007 CQFKVFRHMIGWHA-CSKARUKUSA-N 395.842 5.463 30 20 GKED COc1cccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)c1OC 728441634 NADMIFIVDIUUKA-QXMHVHEDSA-N 383.444 5.171 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cc3cc(Br)ccc3o2)cc1 728700948 YPQULFAFLMKBOA-GBVBUYCNSA-N 396.240 5.382 30 20 GKED Cc1cccc2c1CCN(C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)C2 729552758 JTAGCRDITQBVCU-DEOSSOPVSA-N 381.479 5.241 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cccc(OCC#N)c2)cc1 730150884 YOAZFICRHJEAGC-ZROIWOOFSA-N 383.447 5.373 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 730171651 XSFHOKDGAXGMHP-RBZQAINGSA-N 382.463 5.093 30 20 GKED Cc1nc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cs1 733097423 NXAHUWMCZSIKRT-UHFFFAOYSA-N 397.887 5.340 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(Cl)c3)s2)c1 733801386 YXUQTXOHOVYUTB-LJQANCHMSA-N 396.943 6.039 30 20 GKED CCN(CC)C(=O)[C@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 734850230 YFACEXSKQDNVNE-JWQCQUIFSA-N 397.522 5.364 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(C)cc1 739154901 FXYPKIZHSYWITQ-WBVHZDCISA-N 381.426 5.500 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C\c1csc(-c2ccc(C)cc2)n1 741842082 RISDJYIBPFYHHS-KHPPLWFESA-N 397.471 5.179 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)ccc1O 741845167 YIRCZENLUDDPRU-OQFOIZHKSA-N 382.403 5.341 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C(C)(C)c2ccc3ccccc3c2)c1 741934048 PGTQLGLJMRHUKP-QFIPXVFZSA-N 386.495 5.115 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)N[C@H]2CCc3ccccc3C2)cc1 742989814 IFFLHLXGVXPOJW-NRFANRHFSA-N 399.519 5.194 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@]34CCCc3ccccc34)n2)cc1 744031567 MVZCMHCDDVSTBA-ZJCBTPCYSA-N 398.531 5.589 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@]3(C)CCc4ccccc4C3)n2)cc1 744034348 GXUMKGMPPBJQLZ-HYBUGGRVSA-N 386.520 5.490 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 750688668 VFQYFRCQNPHBQV-FERCGXDMSA-N 376.456 5.537 30 20 GKED CC1(C)C(=O)Nc2ccc(C(=O)/C=C\c3ccc(-c4ccncc4)cc3F)cc21 751537114 VJSLDTZLNVOSQH-VURMDHGXSA-N 386.426 5.014 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2)nnc1-c1cccc(Cl)c1 765333151 LUIVBDAKMGAUHN-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccccc2)c2ccncc2)cc1 765337756 UAFZTKKUUNLVRE-WZONZLPQSA-N 378.903 5.653 30 20 GKED N#CCCCn1cc(C(=O)OCc2csc(-c3ccoc3)n2)c2ccccc21 769542544 GBUVKPNPQLHPSX-UHFFFAOYSA-N 391.452 5.019 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)nn1C1CCCCC1 776299752 ABSQFTKXCFMPFK-QHCPKHFHSA-N 398.510 5.605 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cccc(OCc2ccccc2C#N)c1 779989425 SDRUJYGHVJYDNG-GOSISDBHSA-N 383.451 5.040 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1F 782209025 MOYYUUDMVXXQMP-UHFFFAOYSA-N 395.862 5.476 30 20 GKED N#C[C@@H](C(=O)CCCCC(=O)c1ccccc1)c1nc2cc(Cl)ccc2s1 783357630 JNYQOUFPSFBZCW-INIZCTEOSA-N 396.899 5.569 30 20 GKED CCCCCCOc1ccc(CC(=O)[C@H](C#N)c2cnc3ccccc3n2)cc1 792107139 BFLUPSCCEFLYLI-HXUWFJFHSA-N 387.483 5.008 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H]1C[C@H]1c1ccccc1 796276225 VDDKIHNPIRFBEY-JKSUJKDBSA-N 390.430 5.453 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C(C)(C)c2ccc(Cl)cc2F)s1 797572329 XTEPRFACGUFQSZ-GFCCVEGCSA-N 378.900 5.387 30 20 GKED CCCc1nc2ccccc2c(C(=O)OCCCC2(C#N)CCOCC2)c1CC 800081582 DPWOVOLSLGZMQA-UHFFFAOYSA-N 394.515 5.007 30 20 GKED C=CCC[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 801531937 SOYVNRVAJPGXKW-QGZVFWFLSA-N 375.266 5.154 30 20 GKED CC[C@@H](c1ccccc1)N(CC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)C(C)C 852690974 UYEOYKWXUGXUNK-UNMCSNQZSA-N 398.510 5.085 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc3nc(C(F)F)sc3c2)c1 864028669 XHYUHYMDOPFAOF-UHFFFAOYSA-N 394.244 5.480 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(Oc3ccccc3)cc2)cc1 916908918 GJKZPKXVHCWQNX-QFIPXVFZSA-N 384.435 5.002 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4cc(C)cc(C)c4)CC3)n2)cc1 916977712 XDJQNXZUFXPZMO-HXUWFJFHSA-N 386.520 5.643 30 20 GKED CC(F)(F)CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 916995703 COTYWNHMUIINQL-NSHDSACASA-N 389.254 5.729 30 20 GKED CC(=NNc1nncc2ccccc12)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917567942 IYMQCTNVFKGJCR-UHFFFAOYSA-N 389.440 5.103 30 20 GKED CCOc1c(Cl)cc(C=NOCc2csc(C(C)(C)C)n2)cc1OC 918185871 KELXBHRZHQJSFS-UHFFFAOYSA-N 382.913 5.052 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c(F)c1 1776127690 ATWPAYZMCSQKBF-RMKNXTFCSA-N 382.412 5.157 30 20 GKED Cc1ccc(C(=O)/C=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c(C)c1 1776133407 WGZVMSZBSURWBT-PEBGULEFSA-N 386.447 5.404 30 20 GKED C=C(C)C[C@@H](NCc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O 1776137810 BKDRICFULUQQOI-XMMPIXPASA-N 386.495 5.665 30 20 GKED CCCCCCCOc1cccc(CNCCC2(CC(=O)O)CCCCC2)c1 1776788723 SWDCBKZLSOTFCM-UHFFFAOYSA-N 389.580 5.941 30 20 GKED O=C(O)c1cc(Br)cc(/C=C2\Cc3cccc4cccc(c34)C2=O)c1 1777663520 FIAVDQSWMGACQH-VIZOYTHASA-N 393.236 5.123 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(C)o3)CCC2)cc1 1786102352 JFUHWBKDSZEKHU-UHFFFAOYSA-N 392.499 5.104 30 20 GKED Cc1cccn2c(/C=N/c3ccsc3C(=O)O)c(-c3ccc(Cl)cc3)nc12 1857777256 MPMVYTBUVHYZFI-SSDVNMTOSA-N 395.871 5.473 30 20 GKED C[C@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(C#N)cc1 31432901 TWDGLWXBFAHRMC-JTQLQIEISA-N 375.280 5.571 30 20 GKED O/C(=N\c1nnc2ccccn12)c1sc(-c2ccccc2)nc1-c1ccccc1 33175309 RTPXKOKAKLLYBS-UHFFFAOYSA-N 397.463 5.156 30 20 GKED CC(C)OCc1c(C(=O)Nc2cccc(OCCCC#N)c2)oc2ccccc12 55568126 KPFSICZHSVJMLO-UHFFFAOYSA-N 392.455 5.293 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)c1 56772171 YIUTZYACXQXCFN-SFHVURJKSA-N 379.485 5.230 30 20 GKED N#CCCCOc1cccc(NC(=O)CCc2ccc(Cl)cc2Cl)c1 59770475 XMPDXRAOGUUXMO-UHFFFAOYSA-N 377.271 5.247 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCCc1ccc(Cl)c(Cl)c1 62905684 LJZOXNOGKDSVQB-UHFFFAOYSA-N 387.310 5.403 30 20 GKED CSc1ccc(Cl)cc1NC(=O)c1ccc(COc2ccccc2C#N)o1 64492551 ATRWKUJMUVBASV-UHFFFAOYSA-N 398.871 5.358 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 64742504 WHXBPSBDGIJFOX-QGZVFWFLSA-N 390.270 5.243 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc(F)cc1F 66954222 MDQAERLASLBWPT-CHWSQXEVSA-N 375.444 5.242 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cc(C)ccc2F)[n+]2cccc(C)c2)cc1 68313859 MYSNFKLZIWGKSO-UHFFFAOYSA-O 393.507 5.089 30 20 GKED C[C@H](Oc1ccccc1C(F)(F)F)C(=O)Nc1ccccc1SCCC#N 78668578 PISIFUDHEURXME-ZDUSSCGKSA-N 394.418 5.117 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(SC(F)(F)F)cc2)cc1 105448617 NRAFLDOAJRASCM-UHFFFAOYSA-N 394.418 5.258 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1cccc(F)c1F 108409302 YVEVBAADSLLFPK-CYBMUJFWSA-N 392.496 5.231 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ncc(-c2ccccc2)o1 109028275 SRZJAMGVFHSZMM-OAHLLOKOSA-N 392.484 5.058 30 20 GKED N#C[C@H](C(=O)c1ccc(CCC(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 152078810 VABIKKRLDQORCX-AWEZNQCLSA-N 386.295 5.085 30 20 GKED CC[C@H](Cc1cccc(Br)c1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 172019807 FUWIVJGPWMJBDL-GDBMZVCRSA-N 397.272 5.035 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(-c3ccc(F)c(F)c3)nc2C)s1 182567021 IYGVXWPLHNIMHD-UHFFFAOYSA-N 389.452 5.145 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1nc(-c2ccsc2)no1 189887172 LJKAUFICWZVZMY-UHFFFAOYSA-N 381.501 5.221 30 20 GKED CCc1cccc(C)c1NC(=O)CNc1cccc(OCc2cccc(C#N)c2)c1 193476936 NHMRWNLYWVRZFE-UHFFFAOYSA-N 399.494 5.059 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(OCC#N)c(OC)c2)oc2ccc(C)cc12 209984146 ANVBQFJZFLBKDG-VURMDHGXSA-N 375.424 5.111 30 20 GKED Clc1ccccc1-c1nnc(CON=Cc2cccc(Cl)c2Cl)o1 255918003 COLRZNFYRYICIP-UHFFFAOYSA-N 382.634 5.248 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1cccc(C#N)c1 303256384 CCDIDRXWYABLND-LBPRGKRZSA-N 381.888 5.135 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)s1 303747207 KIEKQBVWEDRBPZ-OAHLLOKOSA-N 392.549 5.440 30 20 GKED Cc1csc([C@H]2CCCN(C(O)=Nc3cccc(-c4nccs4)c3)C2)n1 328600274 CWXHHWKMQBRWNN-HNNXBMFYSA-N 384.530 5.000 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cc(C#N)ccc1OC(F)F 409921220 ILYOWTDLTFWCLG-SNVBAGLBSA-N 399.224 5.284 30 20 GKED CCc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1CCC(C)C 427602459 PYQHJQPILUNGFR-INIZCTEOSA-N 384.549 5.138 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H]4CCC[C@H]43)cc2Cl)cc1 429356260 UWHITGWMDZRVFY-DNVCBOLYSA-N 381.863 5.410 30 20 GKED Cc1ccc(-c2csc(NC(=O)c3cccc(SCC#N)c3)n2)c(C)c1 429935658 GPQXEDPVOQBKKS-UHFFFAOYSA-N 379.510 5.295 30 20 GKED N#CCC1(CNC(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 430427481 OQLJZPJHVJCHAE-GOSISDBHSA-N 388.298 5.076 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NCC1(CC#N)CC1 430760858 KDASSUSZPVLFOR-GFCCVEGCSA-N 390.350 5.226 30 20 GKED COc1cc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc(OC)c1C 433148573 RKFYJKMBCORVRX-CYBMUJFWSA-N 385.489 5.051 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1F 436336864 NVVJZSZENRYCPV-OGHNNQOOSA-N 387.455 5.037 30 20 GKED CC(C)c1ccsc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437493586 LAGMHRGHJBKYDH-UHFFFAOYSA-N 380.444 5.927 30 20 GKED C=CCn1c(SCc2cccc(Cl)c2Cl)nnc1-c1cccnc1 446062503 NSPRPJRSWBRHIN-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(C)cc1Br 457732891 ADXSEPMZDLQAKG-UHFFFAOYSA-N 378.335 5.923 30 20 GKED C=C(C)C[C@@H](C)C(=O)N1CCCc2c(NC(=O)Nc3ccccc3F)cccc21 466865000 NDJYXERSQADRKL-MRXNPFEDSA-N 395.478 5.351 30 20 GKED C=CC[C@@H]1N(C(=O)CCc2ncc(-c3ccc(F)cc3F)o2)CCCC1(C)C 470298423 MSXZBMBUENSSKS-IBGZPJMESA-N 388.458 5.146 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1 471977839 JLQBHSGLSPIMRP-RPWUZVMVSA-N 392.543 5.251 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccc(C)cc2)c2c1CCC2 476086566 WYFJZQDCBRRIDO-UHFFFAOYSA-N 399.538 5.774 30 20 GKED C=CCCCC(=O)N1CCCc2c(NC(=O)Nc3ccccc3F)cccc21 480894868 GOWONXMUAQHXTR-UHFFFAOYSA-N 381.451 5.105 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1ccc(C(F)(F)F)cc1 481265763 BTUNAHRRBQADOL-NSHDSACASA-N 383.211 5.190 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nc(C)cs2)c(OC2CCCC2)c1 482565432 KHQZBGNZLNCYCW-SFHVURJKSA-N 384.501 5.052 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2nc(-c3ccc(F)cc3)cs2)c(C#N)s1 484126111 FBEOHPQLYLCBBU-UHFFFAOYSA-N 399.516 5.361 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2cc(-c3cncc(F)c3)ccc2C)cc1 485553009 RIGZKYNWISOJKT-UHFFFAOYSA-N 391.446 5.083 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc[nH]c3C3CCC3)cc2F)c1 486175474 JZCDJJHPMGQKRR-UHFFFAOYSA-N 389.430 5.124 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc(OC)c2)nnc1-c1cccc(OC)c1 488880817 MQHVFTWBGKMUQF-HNNXBMFYSA-N 381.501 5.002 30 20 GKED COc1ccc(CN[C@H]2CCCc3sc(Cl)cc32)cc1OCCCC#N 492125448 ALMFNSQYDFOJBH-INIZCTEOSA-N 390.936 5.260 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)c1ccccc1 494534969 ZXPRXSNYSPZJDL-YLJYHZDGSA-N 399.918 5.444 30 20 GKED CCN(Cc1csc(COc2ccccc2)n1)[C@H](C)c1ccc(C#N)cc1 497591287 XWHGMKALLWUECN-QGZVFWFLSA-N 377.513 5.177 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)Nc1ccccc1Cl 499472071 BTAIOZRMHJZKAC-SNVBAGLBSA-N 384.810 5.350 30 20 GKED Cc1c(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)oc2ccccc12 501423132 LTOMAHOOZSYJOR-UHFFFAOYSA-N 396.446 5.639 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 510582955 WYPMQUNNRZPHRC-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Br)c2cccnc12)c1ccccc1 511901917 KKRSDZIJYVERKF-OAHLLOKOSA-N 394.272 5.023 30 20 GKED CC(C)c1cccc2sc(N(Cc3ccccc3)C(=O)CSCC#N)nc12 512182672 QDNIASMQUGVNGI-UHFFFAOYSA-N 395.553 5.210 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)c1 512640960 BUDPKYKVPQIJLN-OAQYLSRUSA-N 384.376 5.595 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3ccc(C#N)cc3F)s2)cc1 512674439 XKVUYYSSDKTPBB-GJZGRUSLSA-N 379.504 5.850 30 20 GKED CC(C)Cn1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1C1CC1 512921064 IFQQLMLAVORKQT-UHFFFAOYSA-N 396.560 5.261 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1)c1ccccc1 513031001 KAKXKNVMUOJCPW-GOSISDBHSA-N 390.405 5.266 30 20 GKED CCC[C@H]1CC[C@H]([C@H]2CC[C@H](C(=O)Oc3cc(F)c(C#N)c(F)c3)CC2)CC1 514278396 BWAMUSVWLHSDDF-OPMHRUBESA-N 389.486 6.155 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CC)c1ccc(OC)cc1 514571661 FJCKJLBFYAIQES-KRWDZBQOSA-N 378.925 5.259 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCc1cccc(Oc2ccccc2)c1 517779081 CFGZYIBSIACKHZ-UHFFFAOYSA-N 399.494 5.471 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1c(Cl)cccc1Cl 518140359 YQKUYJUESUDKDM-GFCCVEGCSA-N 379.312 5.426 30 20 GKED C=CCCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 523227010 RAZJGFMWLFMQID-CRAIPNDOSA-N 378.903 5.823 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1 523282033 SXUSIOKSBUEOCL-UHFFFAOYSA-N 378.516 5.327 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1 523699189 APSXGTNAILLWGG-FUHWJXTLSA-N 387.405 5.184 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2cnc(C3CC3)s2)c1 525645536 CLJXZXWTMPTCKC-UHFFFAOYSA-N 393.899 5.393 30 20 GKED CC(C)(C)c1nc2cc(NCc3cn(CCC#N)nc3-c3ccccc3)ccc2o1 533211897 ONNMGUKQNNVHQO-UHFFFAOYSA-N 399.498 5.515 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 533299078 JNIRDRBACVDQPT-IEBWSBKVSA-N 395.572 5.187 30 20 GKED CCC[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 534775135 CSUZXJOLCBBHIJ-ICSRJNTNSA-N 397.906 5.028 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 536542216 WHJAUQPVXUJNBY-NXVVXOECSA-N 387.508 5.159 30 20 GKED Cc1ccc(-c2ncco2)cc1NCc1cn(CCC#N)nc1-c1ccccc1 537756775 UVKUNFQOYQWZOT-UHFFFAOYSA-N 383.455 5.039 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 537945845 AMNYRRUNEXNWKN-CVDCTZTESA-N 379.548 5.918 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(C#N)c(F)c2)ccc1OCc1ccccc1 540707088 OSAPJECKKVEAGS-KRWDZBQOSA-N 390.458 5.136 30 20 GKED C[C@H](NCc1cc(-n2ccnc2)cs1)c1ccc(-c2cccc(C#N)c2)cc1 544174427 HZFSIIWUUFVIRY-KRWDZBQOSA-N 384.508 5.323 30 20 GKED Cc1ccnc2ccc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc12 556895615 QEXIJJCLEIDBHO-IBGZPJMESA-N 394.459 5.028 30 20 GKED C=CCC[C@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccco1 560530017 OPEYLEZGKUXKTB-QFIPXVFZSA-N 384.483 5.324 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)cc1 577802909 RTKMIUOZQANGRS-VXKWHMMOSA-N 381.435 5.774 30 20 GKED CC(C)(C#N)c1ccc(CN[C@H](CCO)c2ccc(Cl)c(Cl)c2)cc1 586780139 VJJAURNAAOTAIT-LJQANCHMSA-N 377.315 5.008 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCC(F)(F)c2ccc(Cl)cc2)c(Cl)c1 588037852 KALZKABUIAUDTL-UHFFFAOYSA-N 389.616 5.040 30 20 GKED CC(C)(CCC#N)CNC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 588177723 WCVMCNFZMNFIGN-UHFFFAOYSA-N 394.302 5.027 30 20 GKED Cc1cccc2c(N3CCC(c4noc5cc(F)ccc45)CC3)c(C#N)cnc12 589602585 GOJAIUZDYVQTIF-UHFFFAOYSA-N 386.430 5.079 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC[C@H]1CCc2ccccc2N1 593758372 SXGGFRXGLCIWRL-SJLPKXTDSA-N 394.544 5.019 30 20 GKED N#CC1(c2ccc(CNc3ccc(F)c(NC(=O)C4CCCCC4)c3)cc2)CC1 594923263 HOWOFSCATMCTQC-UHFFFAOYSA-N 391.490 5.512 30 20 GKED COc1ccc(CNc2ccc(Cl)c(C(F)(F)F)c2)cc1OCCCC#N 600851316 YBDXNMBULYGCGM-UHFFFAOYSA-N 398.812 5.662 30 20 GKED Cc1cc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c(C)s1 604249066 ZODKMFPYLPBLAJ-UHFFFAOYSA-N 378.472 5.218 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CSCc4ccccc43)c2)c1 604473837 WXYFOANPJLZXMA-XMMPIXPASA-N 386.520 5.215 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 608995275 GXFKNWNZVMXSDC-GOSISDBHSA-N 385.467 5.618 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3c(F)cccc3Cl)cc2)c1 609064315 OIIRSVQJCPOUDF-UHFFFAOYSA-N 394.833 5.111 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1 609213279 AUHCENJPHWBIDQ-NRFANRHFSA-N 381.907 5.285 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)sc1SCC#N 609502403 ZTWVSHXMVGIIEF-GHMZBOCLSA-N 398.340 5.116 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ncoc3-c3ccccc3)c2)cc1 609558554 LSENXHFUEYUSNZ-UHFFFAOYSA-N 381.391 5.258 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2ccc(COC3CCCC3)cc2)cc1 610092892 CLLQDTQDFWOJPR-UHFFFAOYSA-N 377.488 5.591 30 20 GKED N#Cc1ccccc1SCC(=O)Nc1ccccc1Sc1ccccc1 610206593 PBDMLFAFGJSIMT-UHFFFAOYSA-N 376.506 5.440 30 20 GKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610321159 JFKOPXVBHZLPIZ-OXJNMPFZSA-N 378.476 5.178 30 20 GKED C[C@@H](NC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)c1cccc(C#N)c1 610359591 KRVHEYZHBXLYJN-ZHRRBRCNSA-N 390.483 5.408 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 612346325 OHGVXGIHACSSFO-UHFFFAOYSA-N 388.279 5.549 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC[C@@](C)(C#N)C3)o2)cc1 612366666 UAKMVNAMRPZZBY-DEOSSOPVSA-N 385.467 5.083 30 20 GKED Cc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 613346065 BNCSEPUCYDHNPJ-OAHLLOKOSA-N 387.291 5.915 30 20 GKED CC(C)COc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 613402471 AVMKCGUQBLJUAL-INIZCTEOSA-N 384.888 5.475 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1cc2ccccc2c2cccnc12 615080703 OVJQGTMJHMGCEB-UHFFFAOYSA-N 382.463 5.225 30 20 GKED O=C(N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F)[C@@H]1CC[C@H](C(F)(F)F)C1 648582632 CNQUUXBXDTYUKP-TVLCNXBWSA-N 396.306 5.005 30 20 GKED C=CCn1c(SCCCC(=O)c2ccccc2)nnc1-c1ccc(F)cc1 669910207 FCYWAAVVVRJGRQ-UHFFFAOYSA-N 381.476 5.025 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)N1CC=C(C(F)(F)F)CC1 677487600 VKLCJGBXOXMALB-UHFFFAOYSA-N 388.258 5.067 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cccc(OC(F)(F)F)c2)S1 727976170 MQXAMWLOYZFSSN-GDNBJRDFSA-N 392.402 5.094 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)N[C@H]1C[C@H]2CC[C@H]1C2 730954684 HOZXEOGJWQPYLC-OBJOEFQTSA-N 399.507 5.186 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1ccc(C)c(C)c1 733079994 OQOIRPCBGBZJAW-UHFFFAOYSA-N 385.393 5.010 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)c1nc2ccccc2s1 739497019 NGTKRNGANBMYLO-UHFFFAOYSA-N 392.402 5.157 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2ccccc2O)C2CCCCC2)c1 743120679 GXEFPWAEQXNKAF-UHFFFAOYSA-N 380.488 5.324 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1ccc(C)cc1)Cc1ccco1)c1ccncc1 745828306 RNVNIBDFPYVNNU-HSZRJFAPSA-N 389.499 5.055 30 20 GKED COc1ccc(C=NN[C@@H](C)c2ccc(C(C)C)cc2)cc1OCCCC#N 747356611 DTOIODUURGYDSO-SFHVURJKSA-N 379.504 5.186 30 20 GKED C[C@@H]1/C(=C\c2cnc(-c3ccccn3)s2)C(=O)c2cccc(Br)c21 753143852 IQSIMZUTTCIBBN-ZECSTPGPSA-N 397.297 5.351 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 758220318 FXOLBZWTDCBHLR-BHDDXSALSA-N 393.556 5.480 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC12CCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 759833641 JUBBSAKKEOGRCG-OLZOCXBDSA-N 377.296 5.483 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C/C=C/c2ccc(C(C)C)cc2)c1 764235021 AZQFXYLZIXDDIR-WMWRJIBUSA-N 376.500 5.211 30 20 GKED CC(=O)Nc1ccc(C(C)=NOCc2nc(-c3ccccc3Cl)cs2)cc1 774728315 GPNZNBIBEYCXQT-UHFFFAOYSA-N 399.903 5.363 30 20 GKED N#CCc1ccccc1CC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 776891365 RGVGNNWCDKOJFF-UHFFFAOYSA-N 399.881 5.054 30 20 GKED C=CC[C@H](C(=O)O[C@@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 778417506 HPAKIPZPMWULNQ-UWJYYQICSA-N 379.500 5.042 30 20 GKED Cc1cnc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)c1 779845990 SFMLZUFFQPVERV-IBGZPJMESA-N 375.859 5.260 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(C(C)(C)C#N)cc1 796041245 PPRXTNJPHIDUPU-IAGOWNOFSA-N 392.499 5.185 30 20 GKED CC(C)(C#N)c1ccc(C(=O)O[C@@H](C(=O)Nc2ccccc2)c2ccccc2)cc1 796041492 VDFVLJSYRGDBFM-JOCHJYFZSA-N 398.462 5.025 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(N(C)C(=O)OC(C)(C)C)s1 811496267 UMAOEYIIBDBRLD-UHFFFAOYSA-N 386.517 5.490 30 20 GKED CC(/C=C/C(=O)c1ccc2c(c1)CCC(=O)N2)=C\c1ccccc1OC(F)F 811688953 VVPFRLOOVCAWDA-LYZYBJJASA-N 383.394 5.015 30 20 GKED OCCC[C@@H]1CCCCC1=NNc1ncnc2sc(-c3ccccc3)cc12 814726684 GWSVMBWTFTWKEK-HNNXBMFYSA-N 380.517 5.089 30 20 GKED COc1cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)ccc1SC(F)F 815636045 NYOMTNUERGPYBG-MAUKXSAKSA-N 390.499 6.096 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NCc2cc(C#N)ccc2N(C)C)c1 864029218 FFCSDEXVFGYIIS-UHFFFAOYSA-N 379.451 5.199 30 20 GKED Cc1nc(/C=C\c2cncn2C(C)C)sc1C(=O)/C=C/c1cncn1C(C)C 901457387 KHWSNNGJLJQLOQ-FFELTBSMSA-N 395.532 5.073 30 20 GKED Cc1ccc(C)c(NN=Cc2cn(Cc3ccccc3)nc2-c2cccnc2)c1 916346155 WRVBMLCISCCWCO-UHFFFAOYSA-N 381.483 5.056 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2[nH]1 916844446 JXCGUTMEGAZDHN-KAMXEHQASA-N 387.439 5.320 30 20 GKED CC(C)c1ccccc1N=C1SCCCN1C(=O)CSCc1ccccn1 919680030 YPMCOAZPYHLCLT-UHFFFAOYSA-N 399.585 5.091 30 20 GKED O=C(O)[C@@H]1CCC(=NNc2c(Cl)cc(Cl)cc2Cl)c2ccccc21 1776014268 BCTWQRHVFHGLHQ-GFCCVEGCSA-N 383.662 5.425 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=NNc2c(Cl)cccc2Cl)C1 1776048881 IGUBHKYSORTQEE-UHFFFAOYSA-N 383.662 5.231 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1ccc(F)c(C(=O)O)c1 1776063911 OZNFYBHCYUHQMB-UHFFFAOYSA-N 398.821 5.724 30 20 GKED Cc1c(NN=Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cccc1C(=O)O 1776087703 RFULXYOIFIBHMK-UHFFFAOYSA-N 390.283 5.177 30 20 GKED Cc1ccc(C)c(C(=O)/C=C/c2cccc(OCc3ccccc3C(=O)O)c2)c1 1776132950 KFFVWVOEAYEJJU-OUKQBFOZSA-N 386.447 5.477 30 20 GKED C=CCOc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1Cl 1776183932 KPMRORIHUPOBHU-LFIBNONCSA-N 382.843 5.206 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776341474 REDXGCCYVOHYGD-ZRDIBKRKSA-N 390.504 6.208 30 20 GKED CCCCCCOc1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)cc1 1776788988 LPSKQVCLUGIQRR-BBXQBHCASA-N 378.468 5.484 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1sc2cccc(Cl)c2c1Cl 32618431 NIFXWWRCIBCYCR-UHFFFAOYSA-N 375.280 5.352 30 20 GKED CCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 41537185 MLPDBKKSNPMQCW-IBGZPJMESA-N 388.492 5.212 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1ccc(F)c(F)c1 60127433 USBKFXFOFHEZSB-AWEZNQCLSA-N 393.393 5.068 30 20 GKED C=CCN(C(=O)CCc1ccc(OC)c(F)c1)c1nc(-c2ccccc2)cs1 105283589 YYGUYVIHHKCIHW-UHFFFAOYSA-N 396.487 5.110 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)NC3(C#N)CCSCC3)c2)c1 162602907 RWSRQLWHSYHQGZ-UHFFFAOYSA-N 396.581 5.115 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1ccccc1SCCC#N 173133933 XTNNLSRHOFWTLD-UHFFFAOYSA-N 375.291 5.016 30 20 GKED N#Cc1csc(/C=C(/Cl)c2nc3scc(-c4ccccc4)c3c(=O)[nH]2)c1 176839456 CVIXFYHZKLZUPL-VIZOYTHASA-N 395.896 5.322 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 180063060 FLLZKXBGGRSROY-DYESRHJHSA-N 393.487 5.135 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nccs1 183515919 VUOWDRMFPUEROR-OAHLLOKOSA-N 392.484 5.074 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 184634080 ITHBJHGOFKATOE-AWEZNQCLSA-N 392.484 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)Cc1ccc(C#N)cc1 191426259 HIVNRMKTAZRKAY-UHFFFAOYSA-N 375.516 5.854 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(O[C@@H](C)C#N)cc1 237504229 DNBWTSFMWQHVRH-JKSUJKDBSA-N 377.513 5.260 30 20 GKED CCN(C(=O)CCCCOc1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 303439725 HNYUJMVSBKMKSC-SFHVURJKSA-N 390.483 5.463 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c1 303475824 NVECDUKFMJIDLT-RBUKOAKNSA-N 388.389 5.130 30 20 GKED O/C(=N/CC1(c2ccccc2Cl)CCOCC1)c1coc(C2CCCC2)n1 328835407 XCQQBCZDUWOMDC-UHFFFAOYSA-N 388.895 5.039 30 20 GKED N=C(O)[C@@H]1CCCN1Cc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 328975073 BFEZBCSMZBBGTL-WLRLJWMZSA-N 383.536 5.381 30 20 GKED CC(C)(C)c1nc2cc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)ccc2o1 329969310 UKTRIYYWFMRWNO-UHFFFAOYSA-N 383.492 5.639 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)C1 412198904 GHRANBPRTQYWLC-CCARFGRDSA-N 398.428 5.290 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 426121394 AHJFVJOQFHBAPS-UHFFFAOYSA-N 394.478 5.048 30 20 GKED CC(=O)c1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)ccc1C 434568873 AEWADWNXOKRXHV-OAHLLOKOSA-N 396.418 5.089 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438839520 FWSIGKJKVLOGFL-KXBFYZLASA-N 389.421 5.453 30 20 GKED CC[C@@]1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 443572153 RZWLCQGKRKSPNH-KNQAVFIVSA-N 397.906 5.028 30 20 GKED C=CC[C@@H](CC)NC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 464501949 OVXOLMNGODSFNE-GFCCVEGCSA-N 380.916 5.351 30 20 GKED N#Cc1ccc(C[C@@H](C#N)C(=O)Nc2cccc(CSC3CCCC3)c2)cc1 470987039 WPGOBDUIWPRTPE-FQEVSTJZSA-N 389.524 5.055 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(OC(F)F)c(OC)c1)c1ccc(F)c(F)c1 480704101 ZNVREPUQTIPJPO-CWTRNNRKSA-N 383.385 5.543 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C 482231030 KIGNPXAVUNWEJW-MBSDFSHPSA-N 379.548 5.351 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1S[C@@H](C)CC#N 482526523 CABVYSWKAKBUQZ-WMLDXEAASA-N 388.920 5.530 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@H](C)CC)cc2)nnc1-c1ccccn1 488921913 UONPTNLXJFHNAG-MRXNPFEDSA-N 392.528 5.015 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)NC2(c3cccc(C#N)c3)CC2)cc1 494667373 SQNVSUQAZPAMPF-INIZCTEOSA-N 379.529 5.108 30 20 GKED N#C[C@@H](C(=O)c1cnc2c(F)ccc(F)c2c1)c1nc(-c2ccccc2)cs1 496199326 ZFTKNZLMOAUQNM-HNNXBMFYSA-N 391.402 5.127 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 497358662 UVHZFHUGACBNON-WZONZLPQSA-N 395.572 5.348 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2)c(C(F)(F)F)c1 499558214 XSGDFTRAJYLHHQ-LBPRGKRZSA-N 378.419 5.720 30 20 GKED N#C[C@@H](NC(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1 499813057 OIWONTBTIPXCBU-QGZVFWFLSA-N 381.690 5.351 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)CCc1ccc(C#N)cc1)C1CC1 502888653 TWCSILUXMYPCAT-OAHLLOKOSA-N 386.417 5.262 30 20 GKED C[C@H](NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)c1ccc(C#N)cc1 505316753 DKQDNWRZKSUROV-HNNXBMFYSA-N 398.491 5.718 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C 509967653 FICCITSDGUYHLG-UHFFFAOYSA-N 375.394 5.328 30 20 GKED C=CCOc1ccccc1CNC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510773946 XEGGQSYLEMXLHF-UHFFFAOYSA-N 394.858 5.022 30 20 GKED COc1ccc([C@@H](NC(=O)NCC(C)(C)CCC#N)c2ccccc2Cl)cc1 513135625 MCMOHEPLRNLEST-HXUWFJFHSA-N 399.922 5.067 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)CSCc1ccc(C#N)cc1 515158843 PKIKWPDBTRAHSE-CQSZACIVSA-N 392.446 5.030 30 20 GKED N#CCc1ccccc1NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 516509626 WIHMNTYGSJMOLM-UHFFFAOYSA-N 394.805 5.892 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 518683114 IXYIMOZJEIBJER-MRXNPFEDSA-N 385.508 5.522 30 20 GKED N#Cc1cccc(NC(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c1 519145313 GKNVOLVJTUZPIY-SFHVURJKSA-N 392.459 5.020 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(Br)cs1 520012353 GQAPPSVJKGHVMN-UHFFFAOYSA-N 389.299 5.363 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)n1cccc1 520498241 YBBSMUFRHDPWJB-OXJNMPFZSA-N 377.875 5.387 30 20 GKED N#CCc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1 523882495 PTEIKUBMRLMCBM-UHFFFAOYSA-N 387.826 5.322 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2cc(C#N)ccc2OC(C)C)cs1 524295633 IUXGURLIXMZVDQ-UHFFFAOYSA-N 377.469 5.030 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)c1 531384722 CEIALKJJIBCPPN-UHFFFAOYSA-N 385.511 5.120 30 20 GKED Fc1ccc2nc(CN[C@@H](c3cccc(C(F)(F)F)c3)C(F)(F)F)oc2c1 540519517 AKNMQCIIYHHTTM-HNNXBMFYSA-N 392.274 5.379 30 20 GKED C[C@@H](c1ccncc1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542090958 RMTOENYABGELIW-MSOLQXFVSA-N 384.483 5.084 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2C2CC2)cc1Cl 542223082 XHLJCCBUVMLGSY-HXUWFJFHSA-N 387.870 5.520 30 20 GKED Cc1c(C(=O)Nc2ccccc2CCC(F)(F)F)sc2ccc(C#N)cc12 556603421 QTNUZZCZRQNECJ-UHFFFAOYSA-N 388.414 5.829 30 20 GKED COC(=O)c1sc(-c2ccccc2Cl)cc1NC(=O)CCCCCC#N 588887891 UQHMITXRARBBFI-UHFFFAOYSA-N 390.892 5.268 30 20 GKED CCCN(C(=O)CCCCC#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 593945666 WAPRKZOZHCOHEZ-UHFFFAOYSA-N 396.343 5.944 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCOc2ccccc2)cc1Cl 603758907 OINZOJGGRBBPEI-NRFANRHFSA-N 390.870 5.403 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCOCCc1ccccc1 603969781 MSFHRXABEQSKQO-UHFFFAOYSA-N 390.508 5.265 30 20 GKED COc1ccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cc1 604027228 OWYXCJJZJYRYEQ-UHFFFAOYSA-N 392.842 5.194 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(Cl)c1OC(C)C 605346947 OIMUJZAAJCACMF-UHFFFAOYSA-N 388.895 5.356 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)[C@H](C)c1ccc(C#N)cc1 609031016 AJRNYCVEBLSACI-JEBQAFNWSA-N 387.310 5.578 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2ccccc2n1 609062469 NXBBRDIIDZIVAB-UHFFFAOYSA-N 393.446 5.246 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)c2cc3ccccc3n2CC#N)o1 610050734 YAEZXYIUJZWKSX-FQEVSTJZSA-N 375.472 5.078 30 20 GKED C[C@H]1C[C@@H](C)C[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 610093355 DPNIWORBHMAXIM-WGMWDUQUSA-N 391.515 5.278 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2c(O)cccc2F)c1 610339769 LZBNQSWVYNTULR-UHFFFAOYSA-N 382.778 5.101 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1ccc(Oc2ccccc2Cl)cc1 610466056 UGZJZFIXURSFJA-UHFFFAOYSA-N 391.858 5.083 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 610634675 BDZRMMDYZIFXCF-VXKWHMMOSA-N 391.515 5.305 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 611557358 LUPLXEPXXUCSHL-MJBXVCDLSA-N 385.455 5.276 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)C1 612239835 NYMDQBKVNJHUHP-MRXNPFEDSA-N 386.826 5.339 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2nc([C@@H]3C[C@H]4CC[C@H]3C4)cs2)c(Cl)c1 616658912 QSCSGJSZWRZGNF-ZMLRMANQSA-N 392.311 5.477 30 20 GKED COc1cc(CNCc2ccc(C#N)c(Cl)c2)c(-c2ccccc2)cc1OC 619748828 POSTYUVZISCQFM-UHFFFAOYSA-N 392.886 5.186 30 20 GKED CCOc1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1F 683765608 RWNSMJVXPSTLOJ-RYUDHWBXSA-N 387.339 5.224 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 727955120 YSFYKGKOOIIFKZ-KPZWWZAWSA-N 389.282 5.007 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccccc3)cc2F)c1 728175229 MYJQIEKKUZWXRX-UHFFFAOYSA-N 377.444 5.085 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(N(C)c3ccccc3)cc2)c1 733800730 GWBVRZTWJSUDMV-XMMPIXPASA-N 385.511 5.425 30 20 GKED O=C(/C=C/c1cc(-c2ccccc2)cs1)c1ccc(N2CCC(O)CC2)cc1 734235533 QDNFRWLPOKXJJV-ZHACJKMWSA-N 389.520 5.272 30 20 GKED O=C(Nc1cccc(/C=C2/Cc3cc(F)ccc3C2=O)c1)c1ccccc1Cl 734307595 PJVGGFZTUPRVNH-YBEGLDIGSA-N 391.829 5.554 30 20 GKED CC[C@H](NC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 734379898 JYRQZFIIUPREDA-IBGZPJMESA-N 393.537 5.850 30 20 GKED CC(C)(C)OC(=O)N[C@H](C/N=C\c1c(O)ccc2ccccc12)c1ccccc1 741844975 RGUAESJUWXNLFV-QEMKNDADSA-N 390.483 5.230 30 20 GKED Cc1cc(C#N)ccc1C(=O)O[C@H](C)c1ccccc1NC(=O)c1ccccc1 748839582 PBNPNGBJMNNWJA-QGZVFWFLSA-N 384.435 5.037 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 752238556 RTODFQVCKQRHFF-KDOFPFPSSA-N 385.920 5.713 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2csc(-c3ccc(C(F)(F)F)cc3)n2)s1 762442209 GZSLLAVEMZYLIH-FNORWQNLSA-N 390.411 5.658 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 767701463 YHRHNZHWTAROMN-HNNXBMFYSA-N 386.517 5.036 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)CCc2ccc(Cl)s2)ccc1OC 772980526 RBWBTROMPPOXKN-GDBMZVCRSA-N 392.952 5.202 30 20 GKED CCCCCCCOc1ccc([C@@H](C)N[C@@H]2CCOC3(CCOCC3)C2)cc1 773077562 FCMULJFWWURVQB-IFMALSPDSA-N 389.580 5.415 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 774052470 GFJZDUAQICYVNP-OXQOHEQNSA-N 398.487 5.607 30 20 GKED N#CCCCn1cc(C(=O)O[C@H](c2ccccc2)c2cccnc2)c2ccccc21 774082841 OLFIQJNZDNLAJF-XMMPIXPASA-N 395.462 5.286 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(N(C)C)cc1 775488599 PHOBLWQZGFEODH-KOSHJBKYSA-N 398.510 5.291 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2cccc(CN3CCCC3=O)c2)cc1 776834047 RMRMYJMZEFLGRQ-KRWDZBQOSA-N 384.907 5.113 30 20 GKED O=C(/C=C\c1cnn(Cc2ccc(C(F)(F)F)cc2)c1)c1cccc(F)c1F 777466406 CELZWAPSIGZWMF-TWGQIWQCSA-N 392.327 5.125 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CC=C(c2cccc3ccccc23)CC1 780675268 OTEOQZIYDNHGQT-SFHVURJKSA-N 397.478 5.452 30 20 GKED CC(C)(C#N)CCCOC(=O)c1csc(-c2ccc(Br)s2)n1 783743972 JWVMYMSKTVVXKO-UHFFFAOYSA-N 399.335 5.121 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cc3cc(C)c(C)cc3o2)cn1 792882805 AZDOLRCNNAEAML-CMDGGOBGSA-N 384.435 5.411 30 20 GKED C[C@@H]1[C@H](C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)[C@H]1c1ccccc1 797551651 MXEJVLRAWLMKCY-ZCFKWTISSA-N 394.446 5.314 30 20 GKED N#CCC1(CNC(=O)c2ccc(CSc3nc4ccccc4s3)cc2)CC1 797564507 DGMAFPYDWWGSHP-UHFFFAOYSA-N 393.537 5.012 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 798206943 CTFDINMBLGOEPH-UGSOOPFHSA-N 375.346 5.334 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccncc2C(F)(F)F)cc1 800689485 NHVXJJFBZWIWIU-SFHVURJKSA-N 381.357 5.008 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)c(Cl)c2)ccc1SC(F)F 800990358 OGPYLAFNUDKCMD-NSHDSACASA-N 382.863 5.386 30 20 GKED O=C1/C(=C/c2cc(Br)c(Cl)s2)Cc2nc(Cl)ccc21 806579892 VKTCZIFGENIURO-ZZXKWVIFSA-N 375.074 5.035 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)nc1 809445687 GMICYCZMSCUWIY-MRXNPFEDSA-N 378.501 5.262 30 20 GKED N#CCCC[C@H](NC(=S)Nc1ccc(OC(F)F)cc1)c1ccccc1 814210034 JQBGBMZPKVQMMS-KRWDZBQOSA-N 375.444 5.010 30 20 GKED CC(C)[C@@H]1N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC12CC=CC2 831230092 CSYAORVGQXWAOZ-PKTZIBPZSA-N 385.511 5.551 30 20 GKED CC(C)=CCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842682362 WVFISDBJAWCWHY-GOEBONIOSA-N 397.544 5.225 30 20 GKED CO[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CCC1 850763469 APSFHAYLKRJPFF-SUMWQHHRSA-N 395.311 5.108 30 20 GKED Cc1ccc(-c2nn(-c3ccc(F)cc3)cc2CNCc2ccc(C#N)cc2)cc1 915681066 MVYMIXKVXWJZPI-UHFFFAOYSA-N 396.469 5.148 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 915807950 RAJSXIMHWOVJGJ-JTQLQIEISA-N 383.498 5.022 30 20 GKED CC(=NOCc1ccc(Cl)c2cccnc12)c1ccc(NC(=O)C2CC2)cc1 917398230 RPUQMSFIHSYZCI-UHFFFAOYSA-N 393.874 5.178 30 20 GKED CC(C)(C)c1ccc(OCCCC(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 917510043 IYYBRFFVARNGHC-SFHVURJKSA-N 376.456 5.161 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3sccc3s2)cc1 918486768 FTCLOUYISFWGDN-HNNXBMFYSA-N 382.510 5.267 30 20 GKED N#CCc1cccc(C(=O)O[C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)c1 919313268 CLHGPCYBHQCVNK-XMMPIXPASA-N 394.430 5.015 30 20 GKED C[C@H](NN=Cc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 920385966 MEPCPKGEWJNUSZ-INIZCTEOSA-N 377.875 5.277 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2ccc(Oc3ccccc3)c(F)c2)CC1 1776169404 NFWAOVUYBRRWIC-UHFFFAOYSA-N 383.463 5.251 30 20 GKED C=CCOc1ccc(CNCCCCCCCCCCCC(=O)O)cc1Cl 1776184305 YYQANTKTNXYCBZ-UHFFFAOYSA-N 395.971 5.980 30 20 GKED O=C(/C=C/c1ccc([N+](=O)[O-])cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569995 YBOXTLNIFCUAGO-SOFGYWHQSA-N 397.770 5.103 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)c(Cl)c1 1777673258 IIOPHDFCEPVRFB-YVMONPNESA-N 387.671 5.619 30 20 GKED Cc1ccc(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2cccc(C)c2)cc1 10173331 WLXQOVXYZHEYIB-UHFFFAOYSA-O 395.573 5.320 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1nc2ccccc2s1 14604050 GRSWSJPQKVZBCT-HNNXBMFYSA-N 399.475 5.241 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1cccs1)c1ccc(C#N)cc1 26122691 PHOJRGONPVLAGY-OAHLLOKOSA-N 378.522 5.403 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(F)c(F)c2)cs1 54897388 PSKWVJGXNQUWDS-UXBLZVDNSA-N 398.434 5.310 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2csc(Br)c2)cc1 65680383 YCYNNZDSMLIYFU-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2c1 66801138 XIMITPASFALLAO-HNNXBMFYSA-N 375.497 5.498 30 20 GKED CC(C)(C)c1ncc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)s1 67893572 ZKIBOJBLEHMVGY-SNVBAGLBSA-N 375.906 5.194 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)nc1 108981162 QMQXOAKVCBAUQA-INIZCTEOSA-N 389.480 5.520 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 114619058 DBSHFJXELWGSQF-PWRODBHTSA-N 395.487 5.338 30 20 GKED N#Cc1cccc(COc2cccc(NCc3nnc(-c4ccccc4)s3)c2)c1 121119697 VRJDKVYWVJRSGV-UHFFFAOYSA-N 398.491 5.268 30 20 GKED CCc1onc(C)c1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 156452297 NARURNRIHBGLCW-QGZVFWFLSA-N 394.862 5.498 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)c2cc3cc(Cl)ccc3o2)c1C 157805043 SMCZMUXLMHHTNA-UHFFFAOYSA-N 390.830 5.013 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCc1cc2ccccc2o1 159275238 FUDKNJNHAODHHO-OAHLLOKOSA-N 379.485 5.049 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COC2CCCC2)cc1 160583447 UNQXQPDCCYNEEZ-UHFFFAOYSA-N 391.515 5.460 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 173730231 VQRCDVKJMMPJSB-CQSZACIVSA-N 383.439 5.011 30 20 GKED Cc1cccc2c(CCC(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c[nH]c12 174001415 LYWZVTNKZYHPIV-INIZCTEOSA-N 392.409 5.030 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1c(F)cc(Br)cc1F 174085540 IHTAXLRADSRJLS-UHFFFAOYSA-N 387.249 5.009 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c(Cl)cccc1Cl 174984269 DWZLMUZCYWPPII-UHFFFAOYSA-N 398.249 5.613 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 182089313 APWOSEYIVURICB-INIZCTEOSA-N 399.475 5.253 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc3ccccc3c2O)ccc1OC 186029053 IWACXCPRPCBKNO-QFBILLFUSA-N 390.483 5.086 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccnc2-c2ccc(Cl)s2)c1 187134706 QEJACKFAPFUPGU-UHFFFAOYSA-N 385.901 5.331 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCCOC)cc1Cl 189873711 KJEARGAXZVKGBX-UHFFFAOYSA-N 387.907 5.469 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CCSc3ccccc32)c1 237840474 KFXIPIOBFLVXMV-QHCPKHFHSA-N 386.520 5.464 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)cc1 255771244 MMMGDVSGIASLIU-KAMYIIQDSA-N 399.446 5.215 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccncc1 303144365 DLJJMANZBCTASS-ZDUSSCGKSA-N 390.434 5.398 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H]1CCOc2ccccc21 303724458 WYVXVJNOWHYIFK-LJQANCHMSA-N 398.462 5.554 30 20 GKED O/C(=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1)C1CCC(F)(F)CC1 328884795 NAQVNWAEHGQELJ-OAHLLOKOSA-N 397.466 5.253 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2ccc3nc(C(C)C)sc3c2)no1 329389959 SDLLXESZNLZQTK-MRXNPFEDSA-N 399.520 5.274 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2/C(O)=N/CC2(c3ccncc3)CCCC2)cc1 329449245 LGMDOAMWNHSVSP-YADHBBJMSA-N 378.516 5.326 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1cc(F)c(Cl)cc1F 432857346 DOLKMDPCLKPPRM-NSHDSACASA-N 395.862 5.192 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(CCC(F)(F)F)c1)c1ccccc1 433023382 PMGPDHNPMHILQP-IBGZPJMESA-N 389.421 5.738 30 20 GKED Cc1ccc(C(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1Oc1ccncc1 436325547 BNJSJUPSKBBHRE-GOTSBHOMSA-N 397.478 5.094 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 437359159 YCZMSEFNLUEWIL-UHFFFAOYSA-N 396.218 5.024 30 20 GKED C=CCC[C@@H](NC(=O)NCc1nc(C)c(C)s1)c1ccc(C(F)(F)F)cc1 440879687 YPCQTTSYCNMARO-MRXNPFEDSA-N 397.466 5.285 30 20 GKED C[C@H](N[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cncc(F)c1 459621079 MKVCWNPKNUFKRG-UWVGGRQHSA-N 380.307 5.670 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c1 460171847 MKLJQQBCTHGTAF-KGLIPLIRSA-N 397.208 5.209 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2cn(CCCC#N)c3ccccc23)C1 469451538 CFTVQVDGJLLQQQ-VQTJNVASSA-N 385.511 5.272 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2CCC(F)(F)F)c2ccccc21 469593014 NSLGIBGGQKHCCP-UHFFFAOYSA-N 399.416 5.692 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1)c1ccccc1 472505898 SNAKUIYXCNHLED-UZLBHIALSA-N 382.419 5.458 30 20 GKED CCOc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)c(C(F)(F)F)c1 475185477 XHGWDWABAVLRKX-HNNXBMFYSA-N 376.378 5.130 30 20 GKED CCOc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c(C(F)(F)F)c1 475185478 XHGWDWABAVLRKX-OAHLLOKOSA-N 376.378 5.130 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)c2ccc(C(C)(C)C#N)cc2)o1 477920898 ZWTJAIIJJJYPKJ-UHFFFAOYSA-N 378.859 5.962 30 20 GKED C=C(C)CN(C)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 479219874 RDXVPAWMNRSWML-HHUWHTLVSA-N 397.403 5.143 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 479631853 HAFOJRWFSDUJJB-MRXNPFEDSA-N 388.471 5.387 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1C 479862995 QFFGAYWLRKTSBU-AWEZNQCLSA-N 392.434 5.218 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2cnn(C(C)C)c2c1 480638651 IONJHLVZMQPFRL-UHFFFAOYSA-N 388.924 5.552 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc2ccc(Cl)cc2n1C)c1ccc(F)c(F)c1 480692014 FDACYZIDYAAQJQ-BUXKBTBVSA-N 375.850 5.473 30 20 GKED Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)N[C@@H]1CCCCc2cc(C#N)ccc21 482010345 XEFHBLYRFNGDBN-BFUOFWGJSA-N 390.453 5.052 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2nc(C3CC3)no2)cc1C 486550457 QWQQFPRWNAVBAL-UHFFFAOYSA-N 391.496 5.453 30 20 GKED Cc1ccc(OCCCCNC(=O)c2ccccc2-c2ccccc2C#N)cc1 500485179 HRIAIDGFYILNMD-UHFFFAOYSA-N 384.479 5.123 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@](C)(c2ccccc2)C1 503227004 UQWCIRBXXFRQQC-MBSDFSHPSA-N 393.556 5.524 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 507154761 ONIVJYZZCMPUAH-UHFFFAOYSA-N 385.876 5.620 30 20 GKED Cc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1C 513956042 REIFYUDKRLDLSJ-UHFFFAOYSA-N 387.458 5.549 30 20 GKED CCN(C(=O)CCCCOc1cc(C)ccc1C)[C@H](C)c1ccc(C#N)cc1 517906145 RTKPPZZVAGXKRK-HXUWFJFHSA-N 378.516 5.334 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)n1C1CCCCC1 518662309 BKOILBCNBXAJLR-INIZCTEOSA-N 395.572 6.114 30 20 GKED CC(C)Cn1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c2ccccc21 520187311 HYKHANGMJULGHG-QGZVFWFLSA-N 391.540 5.944 30 20 GKED Cc1cccc(C)c1OC[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 521261113 MHXKMJVWMLMXLN-QAPCUYQASA-N 397.544 5.144 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)CCCCOc2cccc(C#N)c2)c1 522731035 VMAUYCMCDMGMSZ-XMMPIXPASA-N 390.527 5.560 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)c1c(C#N)nnc2ccccc12 525359445 WXZUYSKMDXVMNQ-UHFFFAOYSA-N 397.482 5.006 30 20 GKED Cc1ccc([C@@H]2CCCN2CC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 532896226 ISFITGUXKBQMLM-RXVVDRJESA-N 393.556 5.022 30 20 GKED N#Cc1cccc(COc2cccc(NCc3coc(-c4ccccc4)n3)c2)c1 535893177 YEZMMJKYMIMECJ-UHFFFAOYSA-N 381.435 5.404 30 20 GKED N#CCC[C@@H](NC(=O)NC1(c2ccc(F)cc2F)CCCC1)c1ccccc1 536317660 ZICHTEZXIJELPE-HXUWFJFHSA-N 383.442 5.078 30 20 GKED N#CC1(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)CCCCC1 536491077 JKUOYIIHNAULRQ-UHFFFAOYSA-N 395.208 5.347 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2cccc(OCC(F)(F)F)c2)c(C#N)s1 536972138 APYLNPROUMCPEW-UHFFFAOYSA-N 396.434 5.040 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)NCCC(C)(C)C#N 541644585 IXEKEYRMBOLHMO-LBPRGKRZSA-N 392.366 5.472 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC(CC#N)CC3)o2)cc1 541985038 SSQVDCOBPJAFLP-UHFFFAOYSA-N 385.467 5.083 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)cc1 544483439 NQAVBFGSQGWLEP-SBUREZEXSA-N 397.478 5.277 30 20 GKED CC[C@H](CC#N)NCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 545874356 AGXBOSZZSZISAS-OAHLLOKOSA-N 376.287 5.028 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)N[C@@H](CCCC#N)c1ccccc1 562289518 CQXALIBUEKOUFM-IBGZPJMESA-N 381.545 5.664 30 20 GKED CCSc1ccc(CC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 564009921 AWUSCSXXUNRDGK-UHFFFAOYSA-N 389.480 5.039 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)sc2c1-c1ccccc1CC2 564313943 OFFJVMOQXFONNI-OLZOCXBDSA-N 390.430 5.302 30 20 GKED C[C@@H](NC(=O)c1ccoc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 573769647 XJYNOFZECYKHTQ-CYBMUJFWSA-N 384.357 5.328 30 20 GKED N#CCn1c(/C=C/c2cn(C3CCCC3)nc2-c2ccccn2)nc2ccccc21 574051589 WRMCPIJNBNDBDV-OUKQBFOZSA-N 394.482 5.104 30 20 GKED N#CCCCCCC(=O)N[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 588162882 OKRTWRZPUXDFSD-IEBWSBKVSA-N 380.454 5.712 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@H](c1ccc(O)cc1)C1CC1 591059571 FGBIDQZIXFUUGE-BEFAXECRSA-N 380.513 5.309 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CCC[C@H](CC#N)C1 596707516 MYYNIKIHDDPZHQ-MRXNPFEDSA-N 397.450 5.093 30 20 GKED COc1cccc(C2(NC(=O)Nc3ccccc3S[C@H](C)CC#N)CCC2)c1 596737011 YAXXFQSSQABUNB-MRXNPFEDSA-N 395.528 5.290 30 20 GKED N#Cc1c(NC(=O)CSc2ccc3c4c(cccc24)CC3)sc2c1CCC2 602754577 ORZADXXHKDIMFR-UHFFFAOYSA-N 390.533 5.091 30 20 GKED COc1ccc2c(CC(=O)Nc3sc4c(c3C#N)CCCCCC4)coc2c1 603996043 CYVKEILBXXKMSU-UHFFFAOYSA-N 394.496 5.215 30 20 GKED C=CCN(C(=O)c1cc2cccc(F)c2o1)c1nc(-c2ccccc2)cs1 607766394 REUIELIJHZOQHN-UHFFFAOYSA-N 378.428 5.528 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCC1(c2ccc(Cl)cc2)CCC1 608894747 YGOFBBPBRWQVGO-UHFFFAOYSA-N 393.918 5.031 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)cc1 609176991 YQAMDIXBZJXMFE-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1SC[C@H](C)C#N 609402834 CLUBFPCLAUWLCY-MJGOQNOKSA-N 381.545 5.471 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609641293 IEIRJPJRCWVLOC-QGZVFWFLSA-N 388.442 5.110 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(Oc2ccccc2)cc1 725853381 PUBALQXUDNVQHR-FQEVSTJZSA-N 385.511 5.680 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(OCC(F)(F)F)cc2)c1 726744238 YBPCWAYMXXPDQJ-WDZFZDKYSA-N 389.373 5.206 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 728181791 CKUKYHWATYHODI-IAGOWNOFSA-N 391.458 5.631 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2cc(-c3ccc(C)cc3)nc3onc(C)c23)c1 728536958 PJEHWHLLMYCKPV-UHFFFAOYSA-N 395.462 5.155 30 20 GKED C#Cc1ccc(C(=O)N(c2ccc(OCC)cc2)c2nc3ccccc3s2)nc1 728797470 KWGHAFZPBSPHAQ-UHFFFAOYSA-N 399.475 5.050 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(OC(F)F)cc1 730954950 PQLWLQQYXASTQL-GFCCVEGCSA-N 393.484 5.349 30 20 GKED C#CCOc1ccc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1 731112794 DQCSPKDPSJBLOZ-IBGZPJMESA-N 388.389 5.086 30 20 GKED Cc1ccsc1C(=O)/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1 733749661 RXAMEFWIFCDHNB-MDZDMXLPSA-N 381.884 5.858 30 20 GKED CC(C)(C)n1cc(/C=C/C(=O)c2cncc(F)c2)c(-c2ccccc2Cl)n1 737445603 BKDMVMYIQVDFLO-CMDGGOBGSA-N 383.854 5.389 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c(SC)cc1OC 741471544 BHDJBIYJMFRDBP-FPLPWBNLSA-N 391.492 5.384 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744035280 LGAHSXIHCSHTNA-DOMZBBRYSA-N 386.879 5.534 30 20 GKED Cc1ccc(Sc2ccc(/C=C\C(=O)c3ccnc(O)c3)cc2[N+](=O)[O-])cc1 752877058 MCBMEWKYTKIFEJ-YWEYNIOJSA-N 392.436 5.051 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(C)s2)ccc1OCc1cccc(C#N)c1 754673627 XXOMPYHENOSLNQ-KRWDZBQOSA-N 392.524 5.367 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccccc2CCC(F)(F)F)cc1Cl 756800290 XNHGBWITUAOPNQ-UHFFFAOYSA-N 383.826 5.515 30 20 GKED C=C[C@H](CC(=O)Oc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 758156432 QQZDNEJZSKQLIP-MRXNPFEDSA-N 377.465 5.266 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 759218013 OZUJLYQTOZBBFR-RXEWJAMOSA-N 378.884 5.743 30 20 GKED COc1ccccc1SCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 763547239 DBRYFCNRYCUJOM-FQEVSTJZSA-N 388.492 5.081 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc4c(c3)-c3ccccc3C4)CC2)cc1 767984923 XHDPHNJANLAKAQ-UHFFFAOYSA-N 376.459 5.059 30 20 GKED C=CCC[C@@H](NC(=O)c1ccoc1COc1ccc(C=O)cc1)c1ccccc1 772735502 LIFZFUXJPPDPKX-JOCHJYFZSA-N 389.451 5.108 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@@H](C)CCCc1ccccc1 776076497 HAIOOYKOBULNKK-AVRDEDQJSA-N 390.527 5.118 30 20 GKED N#CC1(OC(=O)c2cc(-c3nc4ccccc4s3)nc3ccccc23)CCC1 780422567 JRNKBPNWFGVGAR-UHFFFAOYSA-N 385.448 5.115 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1 780682364 UQDOOBMSFPIXHX-ROUUACIJSA-N 399.494 5.888 30 20 GKED CCOc1ccccc1[C@@H](CC(C)C)NC(=O)Nc1ccccc1O[C@H](C)C#N 780682735 XJOSFFXRMACVPI-YLJYHZDGSA-N 395.503 5.285 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)OCCCC(C)(C)C#N)c1 783879662 DFTAFLDURSFJSW-UHFFFAOYSA-N 378.900 5.201 30 20 GKED C=C[C@@](C)(CC)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 785761053 HGZGKVWVXXLJOG-ABKXIKBNSA-N 378.683 5.119 30 20 GKED Cc1c(C(=O)/C=C\c2cccc(Br)c2OC(F)F)cnn1C(C)C 787187621 STVHFPRHQNXZKK-FPLPWBNLSA-N 399.235 5.032 30 20 GKED N#C[C@H](C(=O)c1ccc(C2SCCCS2)cc1)c1nccc2ccccc12 792095947 YOAHZPGKIGLLGU-IBGZPJMESA-N 390.533 5.594 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1 793444864 WZNTWCWLFACAKV-KRWDZBQOSA-N 379.460 5.060 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(C)c(Br)s2)c1 796307297 JXKFOZXLZYRTCP-ZFWWWQNUSA-N 393.350 5.351 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797566861 UXQUCUKHENNOPW-CQSZACIVSA-N 383.448 5.033 30 20 GKED N#C[C@@H](C(=O)CC1CC(c2ccccc2)C1)C(=O)Nc1cccc2ccccc12 798816115 HPUSETNVNWZNNA-QVHXHXEWSA-N 382.463 5.071 30 20 GKED CC(C)(CC(=O)c1ccccc1)CC(=O)[C@H](C#N)c1nc2ccccc2s1 799600855 NBQPDMOWGBGYHH-INIZCTEOSA-N 376.481 5.162 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)Cc2c(Cl)cccc2Br)n1 850874283 XUOIMBNBZQPJGW-LLVKDONJSA-N 397.725 5.101 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3c(Cl)n2)cc1 915179496 PSXRSCBBIXTXLU-OAQYLSRUSA-N 397.865 5.796 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1)C(=O)Nc1ccccc1Oc1ccccc1 916911670 XGZGOXPYUVSRRN-OAQYLSRUSA-N 398.462 5.149 30 20 GKED N#C[C@H](C(=O)[C@H]1CCCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 916977426 QBTQLHFNEDXPGG-RBUKOAKNSA-N 392.911 5.760 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(-n2cccc2)cc1)c1nc2cc(Cl)ccc2s1 917047536 ZKIOHLNWWQXJHL-KRWDZBQOSA-N 391.883 5.159 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C/c1nc2ccccc2s1 917715201 WAQMUPNHPWWZJX-ZHACJKMWSA-N 387.489 5.548 30 20 GKED N#CCCCOc1cccc(NC(=O)/C=C/c2ccc3ccc(Cl)cc3n2)c1 917726926 QDSZFYPSQWSVKK-ZHACJKMWSA-N 391.858 5.223 30 20 GKED Cc1ccc(/C=C/S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 917737722 HEHUWJHXRMGTCG-TVXVBNPNSA-N 388.492 5.063 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C/C=C/c4ccco4)c23)cc1 920367775 QAFOTVCMXZVJPK-WGRIMSMZSA-N 376.441 5.071 30 20 GKED O=C(O)c1ccccc1NN=C(CC12CC3CC(CC(C3)C1)C2)c1ccccc1 1776030071 TYTJLEIQJPOITQ-UHFFFAOYSA-N 388.511 5.808 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(-c2ccc(Cl)cc2)cc1 1776050437 VRYSECGLBAOOET-UHFFFAOYSA-N 380.831 5.160 30 20 GKED O=C(O)c1ccc(NN=C(CCc2ccccc2)Cc2ccccc2)cc1F 1776074395 YEYXOAABVKPCNA-UHFFFAOYSA-N 376.431 5.167 30 20 GKED CC[C@H](C)Oc1cc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)ccc1OC 1776694866 JDWOZLUIEASYSN-BRFSQIRFSA-N 394.467 5.173 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)[C@@]3(C)CC=CCC3)cc2)CCC1 1791994109 MNAUTJDIDJPMNX-DEOSSOPVSA-N 392.543 5.061 30 20 GKED C=CCOc1ccc(C(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)cc1OC 29146587 OSZNKZBISLPJSZ-UHFFFAOYSA-N 398.459 5.083 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCSc2c(F)cccc21 57666075 XXAXOJIIUMIWIZ-NRFANRHFSA-N 388.467 5.331 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)cc2c1 58129528 MVGFHIACMIHGDG-UHFFFAOYSA-N 383.407 5.361 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 61219806 DMLVPYAAUJVYFM-UHFFFAOYSA-N 377.488 5.324 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](CC)c1ccccc1OC(F)F 63402029 HVNMECOZIDRWHZ-LJQANCHMSA-N 399.441 5.009 30 20 GKED CC(C)[C@@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 64530820 NNSMJPQYRFTZHN-FPOVZHCZSA-N 381.907 5.648 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1cc(Br)ccc1F 65206872 QKZLXNKTWMTVTE-UHFFFAOYSA-N 398.235 5.259 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(C(F)(F)F)cc1 66801459 DBKZVITXQOCLAC-CYBMUJFWSA-N 378.419 5.281 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)C(=O)Nc1ccc(F)cc1Cl 108408209 ITPWXRYKDFRGOP-OLZOCXBDSA-N 391.899 5.170 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)OC1CCCCCC1 121815508 PGCJZKYVMXCKGN-QGZVFWFLSA-N 393.487 5.120 30 20 GKED N#CCCCOc1cccc(N[C@@H]2CCCc3ncc(C(F)(F)F)cc32)c1 133750546 ZIWLSBCXVYYNCB-LJQANCHMSA-N 375.394 5.272 30 20 GKED Cc1cn(-c2ccccc2Cl)nc1C(=O)Nc1ccccc1SCCC#N 163286848 JMYNHLOIICHLOL-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(CCc1ccc(F)cc1)C1CCCC1 180029313 CIPVTMULWUSWPH-KRWDZBQOSA-N 395.478 5.136 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1 182143128 RVDVYPGLKQGBFQ-AWEZNQCLSA-N 394.377 5.300 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccccc1N1CCCC1 191484392 QLRSKKMCLXDQRD-UHFFFAOYSA-N 391.559 5.803 30 20 GKED Cc1nc(/C=C\c2cnn(C(C)C)c2)sc1C(=O)/C=C/c1cnn(C(C)C)c1 255619792 GMFKXJKNIKUDSV-FFELTBSMSA-N 395.532 5.073 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(C)noc1C(C)C 263977052 PZMMQZNQHQVUTF-UHFFFAOYSA-N 389.455 5.118 30 20 GKED CC(C)c1ccc(SCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 303342421 YWRSBQWXPUETFS-INIZCTEOSA-N 384.570 5.935 30 20 GKED Cc1cc(C)cc(N=C(O)[C@@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c1 328717968 UVJUCZNJHZZCJB-VGSWGCGISA-N 391.515 5.377 30 20 GKED Cc1cnc([C@H](/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)C2CC2)s1 329439080 KMCFYNIBNAGWLR-PKOBYXMFSA-N 398.576 5.366 30 20 GKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1c(F)cccc1Cl 330016592 PUQRWBIWPFIFMN-UHFFFAOYSA-N 394.918 5.639 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1c1nc2ccccc2s1)c1ccccc1 375682252 FCEMEXYAMKRZGV-PKOBYXMFSA-N 375.497 5.047 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N[C@H](CCCC#N)c1ccccc1 432488537 KKZPMQLGPFJLOO-JOCHJYFZSA-N 377.532 6.490 30 20 GKED C=C[C@H](C)NC(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 434122433 BAEXQMKNBGIVRY-HNNXBMFYSA-N 397.544 5.046 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(c2c[nH]c3ncccc23)CC1)c1ccccc1 435762238 NXNQAHBGDRECOT-JOCHJYFZSA-N 388.515 5.159 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2CCc2ccccc2)cc1C(F)(F)F 438641916 OKXRHKCCDKTOKN-GOSISDBHSA-N 387.405 5.206 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438860118 QPUVXYNROWZRHA-FIKGOQFSSA-N 383.923 5.518 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1N1CCCCCC1)c1ccccc1 439300737 VNPIJHXGCSHGML-FQEVSTJZSA-N 376.504 5.234 30 20 GKED C=CCC[C@H](NCc1cc(C(F)(F)F)n[nH]1)c1ccc(C(F)(F)F)cc1 440642068 XCQBNQJYPJYJOK-AWEZNQCLSA-N 377.332 5.244 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](CC)c1nccs1)c1ccc(C(F)(F)F)cc1 441522869 SABGMSXZRJFVJL-HOTGVXAUSA-N 397.466 5.620 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C(F)F)CC1)c1ccc(C(F)(F)F)cc1 442292495 MSHXWHPKZMEJPB-MRXNPFEDSA-N 390.396 5.399 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 443852024 FHHPZJKSYHOCAS-UHFFFAOYSA-N 393.537 5.962 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)c(F)c1 445737480 WVVCJZYVTRSZRM-QFIPXVFZSA-N 388.373 5.102 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 458371846 UBPSFWIWOFZOSK-QFBILLFUSA-N 377.513 5.697 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CCCC2)[C@@H]1c1ccccc1)c1ccccc1 458810650 BCIPYRXFWWPUKB-PKTZIBPZSA-N 387.527 5.748 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C 466121538 IAUPWAGZUKWMRR-NPFVIJTESA-N 393.918 5.307 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@]1(C)C[C@@H](NC(=O)[C@@H](C)CC(=C)C)CC(C)(C)C1 467950428 VBMDXLMIXPOVDY-AZXNSQLWSA-N 390.612 5.008 30 20 GKED Cc1c(CSC(C)C)cccc1NCc1nnc(-c2cccc(C#N)c2)o1 471662279 BQQUMZMZDHOPSA-UHFFFAOYSA-N 378.501 5.170 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Br 473681946 LTRSYSYMNFYAJN-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED C[C@@H](NC(=O)c1c(F)ccc(F)c1F)c1ccc(-c2cccc(C#N)c2)cc1 477764775 MGTUVSPWQVUNKU-CYBMUJFWSA-N 380.369 5.134 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1c1ccccc1 480803298 KKXJDGJTHHYDDX-HXOBKFHXSA-N 383.451 5.575 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1c(F)c(F)cc(F)c1F 481751456 ANTKXRIMCYVUBB-UHFFFAOYSA-N 395.274 5.303 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(C#N)cc1Cl 483872744 WZZWSMCOZMZQDP-UHFFFAOYSA-N 386.238 5.335 30 20 GKED COc1ccc([C@@H](NCc2cccc(C#N)c2)c2ccc(C(F)(F)F)cc2)cc1 486199700 VHNPXCUDLSXILM-QFIPXVFZSA-N 396.412 5.465 30 20 GKED Cc1cc(C(=O)NC2CCCC2)ccc1NCc1ccccc1C(C)(C)C#N 486439448 YFKXYQAIUPPFMN-UHFFFAOYSA-N 375.516 5.081 30 20 GKED C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487498944 GSBRGRQVALHLRB-KXBFYZLASA-N 390.405 5.024 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1Cl 496407273 MVIOUVBUMAEASJ-LLVKDONJSA-N 377.252 5.102 30 20 GKED Cc1c(C#N)cccc1NC(=O)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 502656838 OTWQVSPTFYTBGV-OAQYLSRUSA-N 390.874 5.021 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(Cl)c(Cl)c1 510685786 LBVZCNYVIBCRBH-UHFFFAOYSA-N 375.299 5.236 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4ccccc4[nH]3)cs2)cc1 513655622 SIFRACVQMRTXFV-INIZCTEOSA-N 386.480 5.300 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(F)c(F)cc1Cl 515043709 RUKNLNYXRXAUND-UHFFFAOYSA-N 399.784 5.238 30 20 GKED C[C@H](NC(=O)CCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 515625024 YWYPABBPZPRDIK-KRWDZBQOSA-N 388.442 5.300 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1 516764696 JNFBARCHFLRBHR-OAQYLSRUSA-N 381.907 5.155 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 518239813 MNQFPDUEHNSEHU-LSDHHAIUSA-N 388.920 5.449 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 520196886 HUHSTOJTEOBIDD-INIZCTEOSA-N 385.508 5.664 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccc(Cl)cc1 521242227 WSZYQNSGRDSISF-HNNXBMFYSA-N 393.855 5.204 30 20 GKED CCSc1ccc(Cl)cc1N[C@H](C)C(=O)N(CCC#N)c1ccccc1 521535342 AQUCMUNYGJBMGG-OAHLLOKOSA-N 387.936 5.199 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N(Cc1ccco1)c1ccccc1C#N 523868233 WKESCCLOHVLSQX-UHFFFAOYSA-N 399.475 5.430 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(F)cc1OCC 524146665 YXAPNVBLGFSDDF-UHFFFAOYSA-N 383.341 5.060 30 20 GKED N#Cc1ccsc1C(=O)N(Cc1cccs1)C12CC3CC(CC(C3)C1)C2 525136868 IIAYSYPIMAESHQ-UHFFFAOYSA-N 382.554 5.292 30 20 GKED C[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(-c2ccncc2)cc1 527350075 DIJXKKOXTBYBAU-BIOCXDLKSA-N 398.510 5.056 30 20 GKED N#CCc1ccnc(NC(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)c1 532435596 QLPKTCWMGSVFAW-UHFFFAOYSA-N 396.475 5.190 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)OCC 534397045 PZJMDTOUVKBGEU-INIZCTEOSA-N 394.393 5.203 30 20 GKED Cc1sc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 539496129 IILQJFLXXXODOQ-ZIAGYGMSSA-N 381.932 6.055 30 20 GKED COc1ccccc1[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 539497657 PBLMMMMSDSNCRO-HJPURHCSSA-N 376.887 5.660 30 20 GKED COc1ccc(N(C)C(=O)c2ccccc2Oc2ccccc2C#N)cc1Cl 539761897 UTPUPBSPMXQRMS-UHFFFAOYSA-N 392.842 5.289 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(Br)s1)c1ccccc1 541367153 HSKONZXZGCDPGP-HOCLYGCPSA-N 390.346 5.534 30 20 GKED N#CCCCCNC(=O)c1ccc(Cl)cc1Sc1ccc(Cl)cc1 541624432 UHPRDKHXRXTSHU-UHFFFAOYSA-N 379.312 5.568 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cnc(C4CCCC4)s3)cc2)ccn1 554981561 HWDDAPPWEPYCHZ-UHFFFAOYSA-N 376.485 5.472 30 20 GKED N#C[C@H](C(=O)c1ccc(C2CCCC2)cc1)c1nc2ccccc2n1C(F)F 562163796 NKIGSXKXHXIAFH-QGZVFWFLSA-N 379.410 5.579 30 20 GKED CC(C)c1ccccc1OC[C@H](O)CNc1ccccc1S[C@H](C)CC#N 563881592 DJDXVNVFDGBYFI-QZTJIDSGSA-N 384.545 5.056 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1coc(-c2ccccc2)n1 564303077 BTHLIULOELZYDQ-UHFFFAOYSA-N 379.419 5.060 30 20 GKED CSCc1cccnc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 569283954 SMFZDSYQKBCFDE-UHFFFAOYSA-N 389.480 5.169 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(-n2cncn2)cc1Cl 570230276 OCPSFFNTLCDFDK-IIBYNOLFSA-N 379.895 5.006 30 20 GKED CC(C)(Oc1ccc(F)cc1)C(=O)N(Cc1ccccc1)c1ccccc1C#N 584673394 AHTFJITZWUZVIJ-UHFFFAOYSA-N 388.442 5.088 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 585720097 ISKFVKSIPRNILK-OAQYLSRUSA-N 395.553 5.136 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(F)c2ccccc12 589941546 MBLXMLBYUWOTJU-LLVKDONJSA-N 387.241 5.648 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccccc2Oc2ccccc2Cl)CC1 592215820 SNPLWAQREMECGT-UHFFFAOYSA-N 383.879 5.680 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H]1CCc2ccccc21 609371291 GJHXFZSTOBYTDS-HNAYVOBHSA-N 382.554 5.440 30 20 GKED Cc1nc(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2Cl)sc1SCC#N 609502414 ZTWVSHXMVGIIEF-QWRGUYRKSA-N 398.340 5.116 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccs1 609968362 YUICQYYZQFRFMD-KBXCAEBGSA-N 380.900 5.799 30 20 GKED N#Cc1c(NC(=O)Cc2csc(-c3ccoc3)n2)sc2c1CCCCCC2 609969005 IEDFYZIOWHSCMQ-UHFFFAOYSA-N 397.525 5.176 30 20 GKED Cc1cc(C)c(NC(=O)CCCN2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c(C)c1 610844140 BTEBTLSIAUYOKH-XZOQPEGZSA-N 389.543 5.102 30 20 GKED Cc1ccc(N[C@H]2CCCc3cc(C#N)ccc32)cc1OCC1CCOCC1 611474775 VERRTFXHXIIWEW-QHCPKHFHSA-N 376.500 5.162 30 20 GKED C[C@@H](NC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1cccc(C#N)c1 614843791 GBAVBIKBWZXPKF-GFCCVEGCSA-N 392.808 5.139 30 20 GKED CCOc1c(F)cccc1C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619125886 XZGXWEOVSOPSLT-UHFFFAOYSA-N 389.311 5.008 30 20 GKED O=C(c1ccc(F)cc1C(F)(F)F)N1CC(c2cccc(C(F)(F)F)c2)C1 622661975 YXIUEYRGAQJYPW-UHFFFAOYSA-N 391.286 5.103 30 20 GKED Cc1cncc(C)c1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494314 JDJBNUMRVXMHBB-UHFFFAOYSA-N 394.290 5.240 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1 669727183 SCKZEXXWRCHVBF-GOSISDBHSA-N 375.472 5.358 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 676999336 VQZYRUYWBGQUGE-CYBMUJFWSA-N 383.835 5.369 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1C[C@@H](C(F)(F)F)CC[C@@H]1C 679526693 OIPBJBFMLXPBSE-AAEUAGOBSA-N 395.343 5.073 30 20 GKED CC(C)c1ccc(SCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730417054 KDIUQRCHBSMVGY-MRXNPFEDSA-N 384.501 5.527 30 20 GKED N#C[C@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1ccc2ccccc2n1 730687467 XDQRWLAEKZVHQF-HNNXBMFYSA-N 391.883 5.307 30 20 GKED C[C@@H]1CCC[C@H](OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 733052915 UIIUDQLPRWZMOE-XOKHGSTOSA-N 388.920 5.235 30 20 GKED C#CC[C@H](OC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccccn1 733691613 ZUFFBRQZRCIJPL-NRFANRHFSA-N 379.362 5.074 30 20 GKED C=CC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1)c1ccncc1 734678869 JIAMCPHVFFGPPV-YADHBBJMSA-N 377.532 5.543 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 734679387 LRYSXRQFGMDZNH-FZKQIMNGSA-N 378.303 5.408 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)CCSc1ccccc1Cl 735333635 DPFYNMNPMQCNJP-UHFFFAOYSA-N 396.295 5.121 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)c2cc1C(C)C 735790667 OQFNPPFKVNRJCM-IBGZPJMESA-N 385.467 5.468 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)cc1 740435275 NKIXCAMROPXAQS-HJOGWXRNSA-N 379.463 5.766 30 20 GKED O=C(c1cccc(-c2cscn2)c1)N1CCCSC1=Nc1ccccc1 744349726 BDTFGUSEGAPNJM-UHFFFAOYSA-N 379.510 5.077 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1C(F)(F)F 744370601 BGILIKXUSTWBRY-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cc(Cl)ccc3Cl)cn2)c1 748176244 SXJLKRYOXAWKLV-UHFFFAOYSA-N 398.249 5.234 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)s1 750741718 JXOJCGNMORVLDC-AWEZNQCLSA-N 394.452 5.042 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2ccc(OCc3ccccc3F)cc2)c1C 750909609 NNRSJULLZWKYAB-KAMYIIQDSA-N 378.447 5.134 30 20 GKED Cn1cc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)c(-c2ccncc2)n1 750917634 VTXHAPZZUWHAMX-XNTDXEJSSA-N 397.450 5.009 30 20 GKED O=C(/C=C\c1nc(-c2cc(Cl)ccc2Cl)cs1)c1cncc(F)c1 753901104 WJZQESJSDYLEJJ-ARJAWSKDSA-N 379.243 5.547 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C(C)=C\c1ccc(Cl)cc1 759204253 BKQUKNLCMLAFNX-AFRXXKALSA-N 394.902 5.216 30 20 GKED Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)OCC(C)(C)CC#N 764844664 SGLBQEVPJOKBGZ-UHFFFAOYSA-N 392.455 5.120 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCCC(C)(C)C#N 776373915 FSGZHNHDXMRDBF-UHFFFAOYSA-N 390.892 5.059 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc4ccccc4c3)cc2F)c1 779594970 BHCGQJORDCOXEN-UHFFFAOYSA-N 383.426 5.437 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)Nc1ccccc1O[C@H](C)C#N 780678944 ZIDUSOIJNQDLMU-QWHCGFSZSA-N 392.286 5.037 30 20 GKED CCOc1ccccc1[C@H](CC(C)C)NC(=O)Nc1ccccc1O[C@@H](C)C#N 780682731 XJOSFFXRMACVPI-PXNSSMCTSA-N 395.503 5.285 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Cl)nc1C(F)(F)F 786764387 BYIXRFXICRBBLZ-LLVKDONJSA-N 385.842 5.618 30 20 GKED Cc1cccc(Cl)c1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 788081386 MMCABYKZQNHDSF-ZDUSSCGKSA-N 375.280 5.331 30 20 GKED Cc1sc(NC(=O)CCc2ccccc2NC(=O)OC(C)(C)C)c(C#N)c1C 790627219 RKBUDBCJDZQOFC-UHFFFAOYSA-N 399.516 5.155 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](OC(C)C)c3ccccc3)n2)cc1 796766710 ZMVAESXTCICHFP-DENIHFKCSA-N 390.508 5.461 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797569061 MWHLFIBDXOWQAP-IAGOWNOFSA-N 384.545 5.598 30 20 GKED CC(C)[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccnc1 797944249 AXBHIULQBUVZEV-KBXCAEBGSA-N 397.450 5.099 30 20 GKED C[C@H]1C[C@@H](C)O[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 800386813 NVCWPYJGDMSVFT-STTGHKBWSA-N 395.311 5.107 30 20 GKED CC(C)c1noc2nc(-c3ccco3)cc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)c12 809090401 KUYFBJXXOJVUHN-GASCZTMLSA-N 393.443 5.093 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c(Cl)c1 813217599 NMDRROTYRZRYDU-AWEZNQCLSA-N 396.796 5.098 30 20 GKED N#CCCC[C@@H](Nc1nc(-c2cccnc2)nc2ccccc12)c1ccccc1 814264039 VCBMDPCZZLDHMH-OAQYLSRUSA-N 379.467 5.539 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)c(F)c1)c1ccc(-c2ccc(F)cc2)s1 844255769 FHDAUNSGKZPMQQ-KRXBUXKQSA-N 393.418 5.170 30 20 GKED C(=NNc1nc(-c2ccccc2)cs1)c1ccccc1OCc1ccncc1 914693303 AOPUPJQBGXNDDD-UHFFFAOYSA-N 386.480 5.230 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915352882 KJEBEFAKUWPWGU-HOYKHHGWSA-N 399.494 5.623 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2c[nH]c3ccccc23)cc1 915354107 VNMCALLFFFAHNA-HSZRJFAPSA-N 394.478 5.188 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 916977324 QBTQLHFNEDXPGG-MOPGFXCFSA-N 392.911 5.760 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(Cl)cccc1OC(F)F 1776783285 MNXZPBHSNFCKMQ-CYBMUJFWSA-N 377.859 5.235 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(-c2ccccc2Cl)s1 1777268252 XOJPEZAIEZXBJU-CMDGGOBGSA-N 398.867 5.671 30 20 GKED N#Cc1cccc(/C=C(\Cl)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)c1 14179672 POYYOEDEJPUFMK-YVLHZVERSA-N 389.867 5.260 30 20 GKED Cc1cc(C)c(C(=O)/C(=C(\S)N[C@@H]2CCCC[C@@H]2C)[n+]2ccccc2)cc1C 27489588 BOGXOFBSUMPMIU-HRAATJIYSA-O 395.592 5.006 30 20 GKED Cc1noc(C)c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41537938 XVLUQYXBDCQTIM-GFCCVEGCSA-N 392.267 5.212 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 48161550 RTHPLYJAZIBBCQ-IBGZPJMESA-N 399.494 5.257 30 20 GKED COc1cc(C(=O)/C=C/c2csc(-c3ccsc3)n2)ccc1OC(F)F 63277242 VBTHYBPHWZLHCK-ONEGZZNKSA-N 393.436 5.378 30 20 GKED N#C[C@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1ccc(C(F)(F)F)cn1 105754797 PMTRGDVYQDEVIO-INIZCTEOSA-N 399.397 5.137 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1ccccc1SCCC#N 108199945 XAMKRLWXXWDGFQ-UHFFFAOYSA-N 375.291 5.016 30 20 GKED N#C[C@@H](C(=O)/C=C/c1nc2ccccc2s1)c1nc2cc(Cl)ccc2s1 119980810 JXBRWWBNOFRFRD-WMADIVHISA-N 395.896 5.449 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC(C)(C)O1 141994119 LXONZSDAABSIKD-KXBFYZLASA-N 397.906 5.027 30 20 GKED Cc1nc(Cn2nc(C(C)(C)C)c(CCC#N)c2O)oc1-c1ccc(Cl)cc1 153529974 URBOGUNIFZAQMX-UHFFFAOYSA-N 398.894 5.008 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/CC/C(=C/c3ccc(O[C@H](C)C#N)cc3)C2=O)cc1 171536357 GDNBJFVFRZPWJC-LTPJDHPDSA-N 398.462 5.098 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1 184323421 NBCBRYNSCNNXFF-AOMKIAJQSA-N 389.430 5.028 30 20 GKED Cc1ccc(NC(=O)CS[C@H](C)c2cccc(C#N)c2)c(Br)c1 190882840 OETKSZSHGURLPO-CYBMUJFWSA-N 389.318 5.062 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1cc2ccccc2o1 191947863 RTGALYAFSBACHO-GJZGRUSLSA-N 379.485 5.567 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(Br)c1F 192291103 ZAGTYAPFEKWBTI-NSHDSACASA-N 393.281 5.092 30 20 GKED N#Cc1csc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)c1 236745197 VVXJNFFEAFFDGG-LJQANCHMSA-N 383.314 5.261 30 20 GKED C[C@H](NC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)c1ccc(C#N)cc1 248245272 JFZXGPQSLAMJBH-KFKAGJAMSA-N 387.508 5.095 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)[nH]n1 303410927 USMLFKDIGWFMGK-CYBMUJFWSA-N 396.903 5.234 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1N=C(O)[C@H](C)N1CCC2(CCCCC2)C1 329624423 SJOZIMYFSQTFPB-IBGZPJMESA-N 380.536 5.122 30 20 GKED Cc1ccc(N2CCC[C@@H](/N=C(/O)Nc3c(C(C)C)cccc3C(C)C)C2)nn1 329662053 IWGJNUQZIQNOQU-GOSISDBHSA-N 395.551 5.027 30 20 GKED Cc1cccc(C2(C/N=C(/O)C3CCC(/N=C(/O)C4CC4)CC3)CCCCC2)c1 330005142 BQULITFTYOWNKK-UHFFFAOYSA-N 396.575 6.079 30 20 GKED C=CCC[C@H](NCc1nc(O)c2sccc2n1)c1ccc(C(F)(F)F)cc1 411488023 XNTKFAVSUFOCAT-AWEZNQCLSA-N 393.434 5.213 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2cccc(N)c2)CC1 415574610 DMKFLOABLXCNDS-UHFFFAOYSA-N 377.532 5.532 30 20 GKED CCc1ccc(CCSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 437441697 XBMGBTOSCSARQK-QGZVFWFLSA-N 398.597 5.558 30 20 GKED CC[C@@]1(C)CCCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 437746162 NIQLJVGKMFHSPR-DEOSSOPVSA-N 391.515 5.376 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444223933 OAUJMXZZIGNWIE-UHFFFAOYSA-N 375.472 5.375 30 20 GKED CC[C@H](NCc1ccc(OCc2ccccc2)c(OC)c1)c1ccc(C#N)cc1 447519423 YKPAJAWNMBSIOR-QHCPKHFHSA-N 386.495 5.387 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)N[C@H]3CC[C@@H](CC#N)C3)s2)cc1 455273836 NLIPZIHUFJZQLE-LNLFQRSKSA-N 396.560 5.212 30 20 GKED CCOc1ccc(Cl)c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 455773662 MWLPWUALXLOPAQ-FXAWDEMLSA-N 383.879 5.042 30 20 GKED CCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H]1CCCc2cccnc21 458849955 TXRBCUMDMXLUFI-YADHBBJMSA-N 390.531 5.316 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)cc1C#N 460113573 KHKMCBRIGADBQO-NRFANRHFSA-N 387.439 5.041 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2csc(C3CC3)n2)c1 460339363 NTRMPUJTUAOECJ-UHFFFAOYSA-N 393.899 5.393 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 463773159 BKOZCMTYNWHQIL-YVEFUNNKSA-N 379.262 5.082 30 20 GKED COc1ccc2c(c1)[C@H](NC1CCC(Oc3ccccc3C#N)CC1)CCS2 467410720 JVGMUHZUHJTRMB-WIXQSORDSA-N 394.540 5.084 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC[C@H](C(F)(F)F)[C@H]2C)cc1 470629554 VMASNTBQJSAJNX-KDOFPFPSSA-N 388.389 5.072 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1csc(Cc2ccc(F)cc2)n1 470642962 UWLUKEVZDQWHMY-UHFFFAOYSA-N 394.515 5.020 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2csc(-c3ccc(Cl)cc3)n2)n1 474445225 LEHFUVNIVZDSHD-CYBMUJFWSA-N 387.917 5.533 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1c1ccc(Br)cc1)c1ccccc1 475022409 JFGGYXZBWTYHHN-UYAOXDASSA-N 397.316 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H](OC)c1ccccc1F 475589131 YVYPHQWERUBFGU-AOMKIAJQSA-N 384.495 5.575 30 20 GKED N#Cc1ccc(Oc2ccc(OCC(=O)Nc3ccccc3Cl)cc2)cc1 480330941 FSWUSOPFNXJSFA-UHFFFAOYSA-N 378.815 5.021 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(CCCC)no2)nnc1-c1ccc(C)cc1 481389705 AMSJSCAGSPYZOK-HNNXBMFYSA-N 383.521 5.018 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(C)cc3)o2)nnc1-c1cccs1 481404507 RPKOGZZKDSRAPJ-UHFFFAOYSA-N 394.525 5.448 30 20 GKED N#CC[C@H](Cc1nc(-c2cccnc2Oc2ccccc2)no1)c1ccccc1 481915824 DKBPNLBFCDRBMQ-GOSISDBHSA-N 382.423 5.164 30 20 GKED Cc1ccc2c(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)csc2c1 483311595 FWMCMXQNQNTMMB-UHFFFAOYSA-N 399.475 5.829 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)s1 486677735 PUTOVBQOFVTDOX-UHFFFAOYSA-N 396.859 5.169 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2ccccc2Cl)on1)c1ccccc1 487243822 UPTIGQGAGXUEIY-GOSISDBHSA-N 379.847 5.160 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1ccccc1C 488907452 FNQJZEXYBLDJFP-UHFFFAOYSA-N 378.526 5.342 30 20 GKED N#Cc1c[nH]c(C(=O)Nc2c(Oc3ccc(Cl)cc3)ccc3ncccc23)c1 497460621 WZXBSMGLOQDZTN-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cc(OC)ccc1OC)C1CC1 505001380 SFJIXTARIHSALI-UHFFFAOYSA-N 380.488 5.019 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 506778293 QQOXLNIQEFYNNN-GOSISDBHSA-N 387.291 5.446 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCc3cc(Br)ccc32)cc1 510759681 AELRAFQKJZGCCN-GOSISDBHSA-N 398.304 5.059 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(COc3ccccc3C#N)o2)s1 513381738 CAYIIHJQEBQBNC-GOSISDBHSA-N 392.480 5.078 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(Sc2ccccc2)CCCC1 518362292 NVPQDQLVJUZCBZ-KRWDZBQOSA-N 396.581 5.982 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCCCC[C@H]3c3ccncc3)c2)cc1 523122782 WBNXBYJYOSWBKS-DEOSSOPVSA-N 396.494 5.454 30 20 GKED CN(CCc1cccc2ccccc12)C(=O)Nc1cc(C#N)ccc1OC(F)F 524437119 ZXVSIKYWTIDQBU-UHFFFAOYSA-N 395.409 5.019 30 20 GKED CC(C)(C#N)CCCNc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 531648230 GNBPIVRWFFBCTI-UHFFFAOYSA-N 381.373 5.774 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccc(CC#N)cc2)c(C(F)(F)F)c1 534007439 YGDJIRASWZKHMR-ZDUSSCGKSA-N 392.446 5.914 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2ccc(CC#N)cc2)nc1-c1ccccc1 534681890 VFSRBLKGEMIIIL-NRFANRHFSA-N 399.494 5.508 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)nn1[C@H](C)C1CC1 537421746 BDBYWHDZYZDDSM-MRXNPFEDSA-N 386.455 5.079 30 20 GKED C[C@@H]1CCCCN1C(=O)c1ccc(NCc2ccc(CC#N)cc2)cc1Cl 544098696 QCDKORHZPFJJQI-MRXNPFEDSA-N 381.907 5.033 30 20 GKED C[C@@H]1C[C@@H](c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)CCO1 547216258 UCCHITJPAXELHQ-KGLIPLIRSA-N 395.846 5.336 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)c(F)cc1Cl)c1cccc(C(F)(F)F)c1 550936557 SBDYRWKZEIWZJN-AWEZNQCLSA-N 391.151 5.146 30 20 GKED C[C@H](NC(=O)c1cc(C#N)ccc1Cl)[C@H](C)c1ccccc1C(F)(F)F 571509231 HFOJNVLXTVXCGX-RYUDHWBXSA-N 380.797 5.152 30 20 GKED CC(C)c1c(NC(=O)N2CCC(CCC#N)CC2)cnn1-c1ccccc1Cl 577749202 RJYODRAYAMWNME-UHFFFAOYSA-N 399.926 5.197 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(C)cc1OCCC 583222162 DJXQFXNZVIQPJX-UHFFFAOYSA-N 384.524 5.171 30 20 GKED N#Cc1ccc(C2(C(=O)N3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)CC2)cc1 586868949 UBPAOUSYWMXAFV-SFHVURJKSA-N 398.428 5.015 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccc2)cc1 589503188 SYWJKZLYTSSKJW-JOCHJYFZSA-N 396.412 5.465 30 20 GKED N#Cc1ccc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(C(F)(F)F)c1 609962577 PJVIENMWYOIVPN-AOOOYVTPSA-N 390.249 5.144 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1 609981753 ZNMNNUBBLLEHSI-HXUWFJFHSA-N 398.506 5.149 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610323713 ANAJVJUNWYKZPP-RTBURBONSA-N 399.494 5.889 30 20 GKED C=CCN(C(=O)c1ccco1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891441 IRBCSAFQQYAJIR-UHFFFAOYSA-N 386.476 5.903 30 20 GKED C[C@@H](NC(=S)N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 726481086 WOZMEDUVXCBIJJ-VXGBXAGGSA-N 378.328 5.151 30 20 GKED C[C@@H](NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 727980483 NEAACXQTFVQHMD-QGZVFWFLSA-N 387.508 5.185 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1 728440628 ZSXBNCVEOBOREO-JXMROGBWSA-N 399.493 5.011 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc(F)cc3F)c2)cc1 729160418 POHZYJFLJPYUTL-UHFFFAOYSA-N 381.407 5.438 30 20 GKED FC(F)(F)c1cc(NN=C2CCC[C@@H]2c2ccccc2)nc(-c2cccnc2)n1 733080245 HWGAQWLATHLSTJ-MRXNPFEDSA-N 397.404 5.293 30 20 GKED COc1c(C)ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1C 740434988 LGJOBHXRCOUYTA-UHFFFAOYSA-N 391.496 5.234 30 20 GKED O=C(/C=C\c1nccc2ccccc12)c1cc2cc(Br)ccc2o1 740765020 NPKJIWCLPXUPJK-SREVYHEPSA-N 378.225 5.640 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(SCC(F)F)cc2)c1 741846471 GLUMEKJICMVMGO-IZZDOVSWSA-N 387.451 5.622 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1 743200157 WPBMPZKSEIYAEE-HNNXBMFYSA-N 380.419 5.199 30 20 GKED Cn1c([C@@H](C#N)C(=O)C[C@H](Cc2ccccc2)c2ccccc2)nc2ccccc21 744010263 FFTRZBPTDCRYOJ-VXKWHMMOSA-N 393.490 5.166 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cn1 746686485 GSGGSDGCVHFPCK-OQFOIZHKSA-N 395.390 5.200 30 20 GKED COc1cc(C(=O)/C=C\c2cnn(Cc3ccccc3Cl)c2)ccc1SC 747615449 ZNMXGNQGSZRZPH-CLFYSBASSA-N 398.915 5.211 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)c(C)n1C1CCCCC1 748585512 ZXHFVUOVAVUGKH-JLHYYAGUSA-N 392.499 5.463 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1SCCc1cccs1 749453967 ZVSXOUGHPBLWGS-UHFFFAOYSA-N 391.949 5.093 30 20 GKED CCCCOc1ccc(C=NOCc2ncc(-c3cccc(F)c3)o2)cc1OC 754279018 JAWBUMRFKRFDTR-UHFFFAOYSA-N 398.434 5.219 30 20 GKED C#CC[C@@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 757764666 YIWIMXGHUUBQEA-WIYYLYMNSA-N 392.549 5.231 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C1(Cc2cccc(Cl)c2)CCCC1 760796212 SBQJSONKVCFFLX-UHFFFAOYSA-N 386.854 5.123 30 20 GKED N#Cc1ccc([C@@H](O)CSc2nc3cc(C(F)(F)F)ccc3s2)cc1 763233750 NUNXDMCUHVFSIL-AWEZNQCLSA-N 380.416 5.012 30 20 GKED C[C@H](N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772959312 KUNCZVAZAJKALV-PMPSAXMXSA-N 376.422 5.451 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccccc2OC(F)(F)F)c1 772985720 XPUBXHHYJCQCAJ-GOEBONIOSA-N 378.394 5.117 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cc(Cl)cc(Cl)c2O)cc1 775179342 OALFLYSLPGTUDV-UHFFFAOYSA-N 391.298 5.125 30 20 GKED CCCN(C[C@H]1CCCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775487521 JJPCZLKBYDWDIM-DHIUTWEWSA-N 391.515 5.155 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(C(F)(F)F)cnc1Cl 779769710 VYYIONFQILRCLI-JTQLQIEISA-N 399.825 5.400 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl 780169557 LUPYFFZQYXEHJL-OJIASSBASA-N 394.780 5.302 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1c[nH]c2ccccc12 786320608 CBCOLUKENVKTSJ-DOMZBBRYSA-N 393.899 5.801 30 20 GKED Cc1sccc1CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 786935037 LNBIFBAEWFBLKN-GFCCVEGCSA-N 380.416 5.104 30 20 GKED C=CCC[C@H](NCc1cccc(Br)n1)c1ccc(C(F)(F)F)cc1 794461703 GZOWAYBVYGALRV-INIZCTEOSA-N 399.254 5.660 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc2occc2c1 794870995 TUQAWCGGLYJTCO-UHFFFAOYSA-N 385.448 5.062 30 20 GKED C=CCC[C@H](NCc1c(Cl)ncnc1N(C)C)c1ccc(C(F)(F)F)cc1 801534065 RELPMJWOSSUQKC-INIZCTEOSA-N 398.860 5.012 30 20 GKED N#CCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 805857072 MEFRTYGLAVZAFA-CQSZACIVSA-N 392.311 5.767 30 20 GKED C[C@]1(C#N)CC[C@@H](OC(=O)C2=NN(c3ccccc3)[C@@H](c3ccccc3)C2)CC1 836159655 AGENWGYOZNOXFM-BKULYWANSA-N 387.483 5.010 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H]1CC[C@@](C)(C#N)CC1 836160482 PBFDXSCVWVEYEQ-NBEIKUQISA-N 384.501 5.213 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@H]21)c1nc2cc(Cl)ccc2s1 860479480 QJBMVJFWKIWKLK-DTTOXWODSA-N 399.302 5.365 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)/C=C/c1ccc2ccc(Cl)cc2n1 914501764 MQMMCVMEAJBUFH-VAWYXSNFSA-N 389.886 5.210 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 915103674 BIBJSAUXWCWGJE-GJZGRUSLSA-N 388.414 5.685 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCOc2ccc(C)cc2)cc1 916947383 IUGMTVYRWNUVAY-AVRDEDQJSA-N 392.499 5.015 30 20 GKED N#C[C@H](C(=O)CCc1c[nH]c2ccccc12)c1nc2cc(Cl)ccc2s1 917044118 QBHOYFYGJCSKDG-OAHLLOKOSA-N 379.872 5.240 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)c1nc(-c2c(F)cccc2F)cs1 920805173 AKZCQVVYVZSBJC-SOUVJXGZSA-N 398.409 5.207 30 20 GKED Cc1cc(Cl)ccc1NN=Cc1ccc(-c2cccc(CC(=O)O)c2)cc1 1776104414 GDMMPFDHQCBPNO-UHFFFAOYSA-N 378.859 5.389 30 20 GKED CC(=NNc1cc(Cl)ccc1Br)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776104950 HPLJWABAJZDUAZ-PWSUYJOCSA-N 387.705 5.027 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C/c2ccc(OCC(=O)O)c(Cl)c2)cc1 1776364817 LKUCBSGCGDVUDB-YCRREMRBSA-N 390.888 5.200 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)s2)cc1)c1ccccc1 1776469426 OFBAMIPLAVCONE-BMOGTNHUSA-N 378.449 5.482 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2csc(C(=O)O)c2)cc1)c1ccccc1 1776469525 VGJDGBAQDGUBOE-XCHKQJEOSA-N 378.449 5.482 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccccc2SC(F)(F)F)cc1)C(=O)O 1776470534 ZEZQLHADGYAIKA-NXIHDVOMSA-N 396.386 5.047 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2)cc1OC 1776782805 LCIIIXCHRJPHRT-QFIPXVFZSA-N 383.532 5.656 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)cc1 7741393 TWGDVJFSUICPGE-MDWZMJQESA-N 379.818 5.628 30 20 GKED COc1cccc(NC(=O)[C@@H](Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)c1 28373748 USUWBBZQOYSTCQ-QHCPKHFHSA-N 399.494 5.288 30 20 GKED N#C[C@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc2ccccc2n1C(F)F 41558998 CDGMZVXPOQAALD-MRXNPFEDSA-N 392.409 5.112 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccn1 43181761 MLYDBENZAPBHQQ-KXBFYZLASA-N 390.874 5.273 30 20 GKED N#Cc1cc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)ccc1Cl 54724962 FWNJYKFENXABQW-UHFFFAOYSA-N 386.238 5.091 30 20 GKED N#CC1CCN(C(=O)c2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)CC1 61584444 DBCHNPVJZNOOAF-UHFFFAOYSA-N 399.450 5.042 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1ccccc1S[C@H](C)CC#N 66800419 LRVYUZIOTYYHGS-INFVRCAFSA-N 380.513 5.217 30 20 GKED N#CC1(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)CCCC1 67832000 CSMHYNHUDCSZJY-UHFFFAOYSA-N 382.851 5.006 30 20 GKED Cc1ccc(F)c(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)c1 68313857 GSKJDTVPQPYVEL-UHFFFAOYSA-O 399.536 5.151 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1oc2ccc(Br)cc2c1C 108901582 JECUTAKWDAJADX-UHFFFAOYSA-N 399.244 5.026 30 20 GKED Cc1csc(N(C)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 116629908 AQGDQSSFMSOFLR-UHFFFAOYSA-N 383.860 5.046 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H](C)c1cccs1 119525764 CJGHUTITAIWBBU-MRXNPFEDSA-N 376.481 5.249 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c1 120825724 ABAAMSZXBKHIJD-JOCHJYFZSA-N 385.467 5.529 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 123750188 RLZQOMDQTKXDAW-LSDHHAIUSA-N 399.564 5.224 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2ccccc2N2CCC(CO)CC2)cc1 124202788 OPAHAODNDMEJNR-UHFFFAOYSA-N 397.522 5.046 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1cccnc1 131530450 SCHUQBYROMYBJQ-UHFFFAOYSA-N 377.831 5.066 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccccc2Oc2ccccc2Cl)c1 134805032 KHMFMJFDKXGUNI-UHFFFAOYSA-N 392.842 5.216 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 151402747 UVEILNNPXDTBAJ-WZONZLPQSA-N 384.483 5.154 30 20 GKED COc1ccc(CNc2ccc(OC3CCC3)c(F)c2)cc1OCCCC#N 152307989 KZDAQXBSTPHDDD-UHFFFAOYSA-N 384.451 5.060 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C)c1ccccc1 186975771 VOSWVNWARDSHBR-NRFANRHFSA-N 384.479 5.546 30 20 GKED C[C@@H]1CCN(CC(=O)Nc2ccccc2S[C@H](C)CC#N)[C@H](c2ccco2)C1 245432165 BCWFGVHAWYRINB-LMMKCTJWSA-N 397.544 5.086 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2nc(O)c3cc(-c4ccccc4)sc3n2)s1 255512970 DFPDTBLOJSGFHX-OVCLIPMQSA-N 395.896 5.734 30 20 GKED CC(C)(C)[S@@](=O)Cc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 255560903 QYTHKJZMXUQNPI-DEOSSOPVSA-N 384.328 5.497 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CCSc2ccccc2Cl)cc1 302223086 RLBUGOLYDGUNDQ-UHFFFAOYSA-N 388.920 5.168 30 20 GKED Cc1occc1-c1nnc(S[C@@H](C)c2ccc(C#N)cc2)n1-c1ccccc1 303728242 UJRCAYMNWIMFCF-INIZCTEOSA-N 386.480 5.561 30 20 GKED CC(C)C1=CC2=CC[C@@H]3[C@](C)(/C(O)=N/Cc4n[nH]c(=N)o4)CCC[C@]3(C)[C@H]2CC1 329081861 DIKHRLVOMQWJSL-ZRGHVXQMSA-N 398.551 5.074 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2)c1 426179775 UZXIQFFXKOGQPA-OAQYLSRUSA-N 395.487 5.671 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1Br 430606449 VRYBGAAYCYZGNW-GFCCVEGCSA-N 377.307 5.002 30 20 GKED N#CCSc1cccc(C(=O)NC[C@H](Cc2ccccc2)c2ccccc2)c1 430646588 WPMYJBQNUGFWIR-QFIPXVFZSA-N 386.520 5.059 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(OCc2ccccc2)c1 434245932 ZVQDDTNNWJWEQY-GOSISDBHSA-N 385.467 5.214 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(Sc2ccccn2)cc1 436358628 GKWJQDAKLLTZBX-FCHUYYIVSA-N 399.519 5.145 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 436413100 HGJTUHZOTFPETQ-LJQANCHMSA-N 396.490 5.677 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)Nc1ccc(CC#N)cc1)C1CC1 437620410 ZXASMRHJZUPMQE-AWEZNQCLSA-N 387.405 5.529 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(C4CC4)no3)cc2Cl)cc1 440682723 MMJJHBZPMGVEOW-UHFFFAOYSA-N 379.803 5.122 30 20 GKED C[C@@H](NC(=O)NCC1CCC(C#N)CC1)c1ccc(-c2ccc(F)cc2)cc1 440987377 HQFLWMQZNFWODW-WWDZGPRUSA-N 379.479 5.183 30 20 GKED Cc1nc(NC(=O)CCCc2csc3ccccc23)sc1SCC#N 445820450 SHZKRCJOWRQCPR-UHFFFAOYSA-N 387.555 5.243 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464468521 PYGVZGVHNXFTMA-GOSISDBHSA-N 395.384 5.358 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cccc4ccsc34)s2)cc1 464551870 UUCDWCZYJXYCAS-UHFFFAOYSA-N 375.478 5.073 30 20 GKED C=CC[C@@H](CC)NC(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 466366881 MPUCHSUDDGVUJM-GOSISDBHSA-N 391.437 5.167 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c(C)c1 471282349 LQQUACVQQMRYBP-MJGOQNOKSA-N 393.556 5.577 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H](C)CC1(C)C 472726076 RHCUIXUJGLTXTA-INIZCTEOSA-N 377.488 5.098 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1cc2cccc(F)c2o1 473887046 OFVYYTMCZJLUEW-OAHLLOKOSA-N 382.435 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2cccc(OC)c2)C1 475557634 ZOBLIGUNZOOQGZ-UHFFFAOYSA-N 376.500 5.478 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 475570802 LKIRONJKIBPVQK-GMAHTHKFSA-N 378.516 5.580 30 20 GKED C=CCn1c(S[C@H](C)c2nc(CCCC)no2)nnc1-c1ccc(C)cc1 481389707 AMSJSCAGSPYZOK-OAHLLOKOSA-N 383.521 5.018 30 20 GKED N#CC[C@@H](CC(=O)Nc1c(-c2cccs2)nc2ccccn12)c1ccccc1 483463835 TVKYRKKBRHYHIX-KRWDZBQOSA-N 386.480 5.089 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc(-c3cc4ccccc4o3)o2)c1C 484733294 ZBSMLHHRQVZEIG-UHFFFAOYSA-N 393.468 5.062 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(Cl)cc(Br)c1)c1ccccc1 487351418 GIGAAKRDSUAIGL-KRWDZBQOSA-N 391.696 5.267 30 20 GKED Cc1ccc2ncc(C#N)c(N3CCC[C@@H](c4nc5ccc(F)cc5o4)C3)c2c1 488130925 RAFZTCNOEYBTDR-OAHLLOKOSA-N 386.430 5.079 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(F)cc1OC1CCOCC1)c1ccccc1 488707759 KBIORJJQMDFPMA-HXUWFJFHSA-N 398.478 5.213 30 20 GKED Cc1ccccc1-c1noc([C@@H](C)Sc2nc(C(F)(F)F)ccc2C#N)n1 488771592 XSZHAQYIPKBCHJ-LLVKDONJSA-N 390.390 5.184 30 20 GKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 494750642 GKDABLRXOZLYJA-WBWKYDSYSA-N 379.529 5.648 30 20 GKED COc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 495444664 KNNMWDQGSQMRQA-FQEVSTJZSA-N 377.488 5.233 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC=C(c2ccccc2)C1 497327675 RPKLTXLOHPPCFQ-KRWDZBQOSA-N 377.513 5.260 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1Cl)c1c(Cl)cccc1Cl 499816662 VARUCBFGTXHJGT-MKBNYLNASA-N 379.674 5.131 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](C#N)c3ccccc3Cl)s2)c(C)c1 499947996 VADRSPGGQGLIDJ-SFHVURJKSA-N 395.915 5.383 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 500098697 MYBOOKLPNQSAKM-OPAMFIHVSA-N 375.447 5.384 30 20 GKED CC(C)c1[nH]ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 506479326 FPMVROCPYJYANA-LJQANCHMSA-N 377.875 5.699 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(CCC(C)C)C2CC2)cc1 508265248 BYURLTAUFJWRMG-UHFFFAOYSA-N 393.487 5.402 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@H](C)Sc1nc(-c2ccccc2)ccc1C#N 510224542 WFIXSAJYPKXALZ-HNNXBMFYSA-N 391.471 5.187 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@@H]2CCC[C@@H](C(F)(F)F)C2)n1 512034109 ZLTKHXLHVKNQEO-RAIGVLPGSA-N 396.306 5.983 30 20 GKED COc1ccc(-c2csc3ncnc(N[C@@H](C)c4ccc(C#N)cc4)c23)cc1 516827600 DSLATNCGXPXKNV-AWEZNQCLSA-N 386.480 5.412 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1c(-c2ccccc2Cl)noc1C 521541385 ADDZKQUJUQCXJO-UHFFFAOYSA-N 380.875 5.174 30 20 GKED CC(C)CN(C)c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 521800522 OUESIGBMBYUDNY-KRWDZBQOSA-N 381.545 5.425 30 20 GKED C=CCOc1ccc(CNCc2ccc(Oc3ccccc3)nc2)cc1Cl 521827480 LKLRRNQLPTUFCY-UHFFFAOYSA-N 380.875 5.382 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)CC1 522088715 CWFJXYMZBFVRKZ-CYBMUJFWSA-N 386.483 6.026 30 20 GKED CCN(CC)C(=O)[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 522548612 CSUSSUSDKYXHAM-DEOSSOPVSA-N 399.494 5.372 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 523153990 MOYPDPMCOOQMJJ-KRWDZBQOSA-N 385.467 5.144 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@H]1c1cccc(F)c1F 525559394 OYUQVXAYPPIVEE-HOTGVXAUSA-N 380.419 5.307 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)c1ccccc1C(F)(F)F 525575357 YAIYALLPKQQGOV-PXAZEXFGSA-N 380.797 5.233 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)CC1 526816060 NNSQINPSUVJGHO-UHFFFAOYSA-N 388.298 5.818 30 20 GKED CCN(C(=O)c1ccc(Br)c(Cl)c1)c1ccc(C#N)c(Cl)c1 538074208 ZAOFMHQDMZCMDH-UHFFFAOYSA-N 398.087 5.294 30 20 GKED COc1ccc(C#N)cc1CN[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 541660838 TXYNYSDBZHAOTD-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED CCCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cnn1-c1ccc(F)cc1 542003760 JEGSPQQBPZZKDR-UHFFFAOYSA-N 390.462 5.017 30 20 GKED N#Cc1csc(-c2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)c1 544883061 PJOLJWROHZWPFP-UHFFFAOYSA-N 380.816 5.177 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 554444698 OXEXMWJUOSKDPR-QHCPKHFHSA-N 399.494 5.105 30 20 GKED N#Cc1ccncc1C(=O)Nc1ccc2nc(-c3cccc(Cl)c3)sc2c1 557911370 SNXSFYPBDKYQFL-UHFFFAOYSA-N 390.855 5.136 30 20 GKED N#CC1(NC(=O)c2cccc(CSc3c(Cl)cccc3Cl)c2)CCC1 576439655 IXFYHTAECWSYSG-UHFFFAOYSA-N 391.323 5.462 30 20 GKED CN(C(=O)c1c(F)c(F)cc(F)c1F)c1ccc(Cl)c(C(F)(F)F)c1 580059327 CLNWHTDNCONGAR-UHFFFAOYSA-N 385.666 5.192 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NCC2(C#N)CCCC2)cc1 593428016 WPAHUSCAXRENJW-GOSISDBHSA-N 391.515 5.149 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NCc1cccc(F)c1C#N 600853929 YMTKLWQMUCJSEV-UHFFFAOYSA-N 393.849 5.524 30 20 GKED N#CCc1ccc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)cc1 603565821 XTPKMPPWUIZOOZ-UHFFFAOYSA-N 394.805 5.892 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1cccc(C#Cc2cccs2)c1 606548612 HIGRYXLPFJYKFM-OAQYLSRUSA-N 375.497 5.158 30 20 GKED C[C@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1cccc(C(F)(F)F)c1 609080999 CIKBFEZRMLMCQU-JTQLQIEISA-N 399.319 5.061 30 20 GKED C[C@H](Oc1ccccc1NC(=O)NCc1ccc(C#N)cc1F)c1ccccc1 609683707 ITMPUVHDWNXGEV-INIZCTEOSA-N 389.430 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CC1CC1)c1ccccc1 610324154 AWXMBVCKIUUDFZ-JXFKEZNVSA-N 379.529 5.744 30 20 GKED CC(C)(C#N)CCCN[C@H](CC(F)(F)F)c1ccc(Br)cc1 612536262 LPYQLDKCWBTQIL-CQSZACIVSA-N 377.248 5.362 30 20 GKED FC(F)(F)c1cccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 618451053 OVILIFCPHONVPR-VXGBXAGGSA-N 379.266 5.268 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(-c3n[nH]c4c3CCCC4)c2)cc1 619428936 PWXYNWFEVIDYGZ-UHFFFAOYSA-N 384.483 5.009 30 20 GKED Cc1ccc(C)c(OCc2nnc(S[C@H](C#N)c3ccc(Cl)cc3)o2)c1 619863845 JJLJLTOQVFZIRH-QGZVFWFLSA-N 385.876 5.276 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)s2)c(C)c1 647377327 DIEKFEZIPDSETA-INIZCTEOSA-N 393.537 5.559 30 20 GKED CC(C)n1nccc1NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 665532734 RRIWWIJKNJYQQL-UHFFFAOYSA-N 397.294 5.006 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)[C@H]1CCC(F)(F)C1 671239364 UPGKFMCKAKKHLD-JTQLQIEISA-N 389.286 5.118 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1nc(-c2ccccc2)cs1 730922013 IYCUPYOSMODIQR-FDFHNCONSA-N 394.499 5.943 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C2\Cc3c(Cl)cccc3C2=O)cc1 730948756 KRKHWYXSBKNZIX-GXDHUFHOSA-N 394.810 5.033 30 20 GKED O=C(/C=C\c1sc2ccccc2c1Cl)c1ccc(C(F)(F)F)nc1O 731564803 UCTADURKDAHOAA-SREVYHEPSA-N 383.778 5.570 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC(C)(C)C)c2ccccc2)c1 733808030 YKHNZAPHRMBGTP-RBBKRZOGSA-N 393.531 5.344 30 20 GKED C=CC[C@H](NC(=O)NCC1(Sc2ccccc2)CCCC1)c1ccncc1 734669281 RXWSXMYNVKPVMG-FQEVSTJZSA-N 381.545 5.103 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)cc1 734771722 GBNBNYQDQWAUOA-VAMGGRTRSA-N 388.417 5.362 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cc(Cl)ccc3Cl)c2)s1 739599671 OGYZZJJFSFUGHB-UHFFFAOYSA-N 387.291 5.524 30 20 GKED COc1ccc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)cc1C#N 741849331 WIZDDFFIMHAJEF-CXUHLZMHSA-N 399.219 5.254 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccnc(Cl)c2)c1 741969605 DVWRIBUQEJRPEW-UHFFFAOYSA-N 382.250 5.107 30 20 GKED Cc1sc(NC(=O)CSCc2cc(Cl)ccc2OCC#N)c(C)c1C 742970387 HMUWHEPIQVVCSN-UHFFFAOYSA-N 394.949 5.101 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccc(Oc2cnccn2)cc1 743055873 LXQKDOJSVZISQT-FMIVXFBMSA-N 399.475 5.597 30 20 GKED CCCOc1ccc(C=NOCc2csc(C3CCCCC3)n2)cc1OC 744180081 LGJIONIWYHBBEV-UHFFFAOYSA-N 388.533 5.539 30 20 GKED C[C@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1cccc(C#N)c1 756628867 YLQMIZZDQHDPEZ-WDEREUQCSA-N 379.685 5.092 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3ccc(SC(F)F)cc3)cc2N1 758024413 DPHZRUOFKLIETD-UTCJRWHESA-N 383.466 5.003 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12 759213476 BMYHWSDLADTBHH-IURSYISVSA-N 388.854 5.244 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](Cc2ccc(F)cc2)c2ccccc2)c1 774243462 KYCGMDWRCNHSMG-UKILVPOCSA-N 388.486 5.580 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 780486688 ZJFPCDQIOGRYKH-UTKZUKDTSA-N 396.450 5.277 30 20 GKED CC1C/C(=C/c2scnc2C2CC2)C(=O)/C(=C/c2scnc2C2CC2)C1 782301150 KJYIJOGOPVUZQY-IZKYPSLPSA-N 382.554 5.820 30 20 GKED C[C@H](NC(=O)c1ccccc1SCC#N)c1ccc(-c2cccc(C#N)c2)cc1 782828735 HYKHYTZWWIPVQU-KRWDZBQOSA-N 397.503 5.332 30 20 GKED C=C[C@@H](CC(=O)O[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784401694 CXRWHNSXURDHRH-CABCVRRESA-N 382.460 5.308 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](O)c1ccc2ccccc2c1 789455060 HVMIMZDFCDUZTM-HSZRJFAPSA-N 388.511 5.547 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(Br)s1 792103517 SCLMEXJKVRIKMS-SMDDNHRTSA-N 385.286 5.039 30 20 GKED CCc1cccc(C)c1NN=Cc1csc(N(C(C)=O)c2ccccc2)n1 799493728 NAXYUCSABFRDBB-UHFFFAOYSA-N 378.501 5.145 30 20 GKED C#CCCc1noc(-c2c(-c3c(Cl)cccc3Cl)noc2CCC)n1 809398264 WCWSPZTZWQDYAJ-UHFFFAOYSA-N 376.243 5.217 30 20 GKED N#C[C@H](C(=O)CCCc1csc2ccccc12)c1cc(C(F)(F)F)ccn1 813217725 OIEYFQLXXMLVJD-INIZCTEOSA-N 388.414 5.514 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(OC(F)(F)Cl)cc1)c1ccccc1 817325176 YVSCALPIRDEPKW-QGZVFWFLSA-N 378.806 5.019 30 20 GKED COc1cc(C=NOCc2ccc(Cl)cc2Cl)ccc1OC(F)F 849959081 QPZXXTVBUTZJND-UHFFFAOYSA-N 376.186 5.154 30 20 GKED C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915293391 KORGXPFOUDLRAY-IQGLISFBSA-N 396.490 5.237 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915352322 GWTKNCTWXHQSRH-LOSJGSFVSA-N 395.506 6.020 30 20 GKED N#C[C@@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1nc2ccccc2s1 916846361 QTAUWJSOMPUNMT-ZDUSSCGKSA-N 392.427 5.284 30 20 GKED CCCCCCN(C(=O)c1ccccc1OCC#N)c1nc2ccccc2s1 919976449 LFGQBEAWZOGFQG-UHFFFAOYSA-N 393.512 5.426 30 20 GKED O=C(O)CCOc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cc1 1776126251 HGEXGMLCTYXWHD-NVNXTCNLSA-N 388.419 5.229 30 20 GKED C[C@@H]1C/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2sccc21 1776589749 UKYGRVJNLIEEEU-GEYIUBJWSA-N 388.488 5.816 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2ccc(OC)cc2)cc1 1776787968 FTYPQSRHJDNSPV-HSZRJFAPSA-N 399.531 5.350 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1F 1777403230 ZZEAWASRGBKQFV-QCDXTXTGSA-N 392.451 5.809 30 20 GKED O=C(O)c1cc(/C=C2\Oc3cc(Cl)cc(Cl)c3C2=O)sc1Cl 1777663569 AMLTYERZSQELMG-WMZJFQQLSA-N 375.616 5.023 30 20 GKED C=CCn1c(S/C=C/c2ccc([N+](=O)[O-])o2)nnc1-c1ccc(Cl)cc1 14731002 NBMXOFXFMZUSBV-PKNBQFBNSA-N 388.836 5.049 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 41539641 VZTIHQRHKZIJPR-OXJNMPFZSA-N 382.419 5.139 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc3ccccc3n2)cc1 59333076 LIFQBGPKTGRRIU-UHFFFAOYSA-N 395.437 5.088 30 20 GKED CC(C)(C)c1ccc(SCC(=O)Nc2cccc(OCCCC#N)c2)cc1 59771275 HATFXQMCKZRCTD-UHFFFAOYSA-N 382.529 5.397 30 20 GKED C[C@H](Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)C(=O)Nc1ccccc1C#N 63311814 PSPPLHDIXQDCNT-FGSXEWAUSA-N 391.515 5.093 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 64565199 WXHFKJSEQBRXEG-UHFFFAOYSA-N 392.846 5.063 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 101751270 QMUDAIMDXCFXAJ-UHFFFAOYSA-N 398.441 5.112 30 20 GKED Cc1csc([C@H](C#N)C(=O)Cc2cccc(OCc3cccc(Cl)c3)c2)n1 106982363 SCGJMVCGYKMIBY-LJQANCHMSA-N 396.899 5.103 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(Cc2ccc(F)cc2)n1 108201083 XMCMEUDDCBUZAS-UHFFFAOYSA-N 397.500 5.131 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccccc3)n2)cc1 108979193 PMVHGOZDOQPPJA-IBGZPJMESA-N 376.481 5.018 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1c[nH]c2ccc(F)cc12 117007181 UURCCAQAXKJHFO-CQSZACIVSA-N 396.491 5.065 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1ccc(C(F)(F)F)cn1 122412216 FEJWXBDOMOQHPS-LJQANCHMSA-N 378.353 5.162 30 20 GKED CC(C)(C)c1nc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cs1 170673290 ZQTHFUACPGBCIW-GFCCVEGCSA-N 389.933 5.123 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](C)Sc2ccnc3cc(Cl)ccc23)n1 175081224 BHHDQKCAMLMWNJ-RISCZKNCSA-N 387.917 5.010 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cccc(SCC#N)c1 175686024 YQRMTAKXSUVJQE-CQSZACIVSA-N 393.537 5.225 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3nc(C4CC4)oc3c2)c1 177187111 PJLXRWRQJBOJJN-UHFFFAOYSA-N 376.416 5.032 30 20 GKED C#CCCCCC(=O)Nc1c(C)cccc1-c1nc2ccc(F)cc2n1C(C)C 180572229 PXLLSTDVCUAFGL-UHFFFAOYSA-N 391.490 5.864 30 20 GKED Cc1nc(C(F)(F)F)c(CN[C@@H](c2c(F)cccc2F)C(F)(F)F)s1 183658209 FBBFASLMFHBZAO-LBPRGKRZSA-N 390.299 5.142 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1O)C1CCCCC1 184308097 QJJNEGSGNRKITB-KRWDZBQOSA-N 393.487 5.050 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCc3ccccc3C2)cc1 255938840 FOTZDKRWOPCQHQ-UHFFFAOYSA-N 384.504 5.049 30 20 GKED CC(C)Sc1ccccc1N=C(O)N1CCC[C@H](c2ncc3n2CCCC3)C1 328647013 HDOLUWJBPMWHPB-KRWDZBQOSA-N 398.576 5.145 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cccc(-c3noc(C4CC4)n3)c2)s1 411008457 SSOLMWPDDOCWMS-UHFFFAOYSA-N 392.484 5.097 30 20 GKED C=CCC[C@@H](C(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644192 GPZSTPXNCIAAEC-UYAOXDASSA-N 392.474 5.423 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ncc(C#N)cc2Cl)cc1)c1ccccc1 427921308 FGTRJRRPEHCYEZ-CQSZACIVSA-N 376.847 5.032 30 20 GKED Cc1ccc(Cl)c(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c1C 434486960 UIJWDXATPVAHQY-UHFFFAOYSA-N 397.906 5.340 30 20 GKED Fc1ccc(F)c([C@H](NCc2ccc(OCC(F)(F)F)cc2)C(F)F)c1 434664149 SRPMJCCNKDFUOA-HNNXBMFYSA-N 381.291 5.002 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1)c1ccccc1 435663864 PIDXSXQAGLHXGE-HXUWFJFHSA-N 399.922 5.309 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CC1 437901477 VYQPIXBKYOUAKM-AWEZNQCLSA-N 395.890 5.799 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC(F)(F)F)cc1O 442920232 BXKDIZLTUWTEHY-UHFFFAOYSA-N 398.340 5.082 30 20 GKED CC[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(C#N)cc1 447543928 UDIQJBCXAGZPMY-XMMPIXPASA-N 393.494 5.047 30 20 GKED CCO[C@@H](C)c1nc(CN(C)c2c(C#N)cnc3ccc(C(C)C)cc23)cs1 447673345 XQLNWIVEPXATAJ-HNNXBMFYSA-N 394.544 5.420 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)C1 452561441 ABPNUIVJIZIAKC-LPHOPBHVSA-N 389.474 5.105 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC(C)(CC(F)(F)F)C2)cc1 457124265 SKMVQQBYNFRTPO-UHFFFAOYSA-N 388.389 5.074 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(=Cc2ccccc2F)CC1)c1ccccc1 458807646 XVLYWWPRFONEPS-QHCPKHFHSA-N 391.490 5.450 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1)c1cccc(C#N)c1 463572266 ABQIBFWVPOZHRY-CQSZACIVSA-N 393.849 5.776 30 20 GKED Cc1coc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)CC(C)C)c2)n1 468318408 UEFPUDCUBICITF-UHFFFAOYSA-N 388.471 5.212 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCC[C@H](C)c1cccc(OC)c1 469338208 UXJMIHQLXIOEIE-IBGZPJMESA-N 376.500 5.055 30 20 GKED N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)c1 470044869 TZSKXTOYEQWYET-LJQANCHMSA-N 387.405 5.014 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4sccc4c3)n2)cc1 473141433 FYAAZZZXUDQMKK-QGZVFWFLSA-N 390.489 5.523 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CCCn2ccnc2)CC1 475551009 PDBYPTJPCMFDFD-UHFFFAOYSA-N 394.563 5.459 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 476153110 OVTOMWKKAQIAGX-UHFFFAOYSA-N 390.386 5.300 30 20 GKED CCc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 477012286 OTQRFYZUNMGOIW-KRWDZBQOSA-N 392.890 5.114 30 20 GKED N#C[C@@H](C(=O)c1ccc(Sc2ccc(Cl)cc2)o1)c1nc2ccccc2[nH]1 477842603 AVVJLYHOLIAJAM-AWEZNQCLSA-N 393.855 5.451 30 20 GKED C[C@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)cc1F 480752936 ZSZRLUWHQKOBOZ-JEOXALJRSA-N 391.259 5.401 30 20 GKED C=C(C)[C@@H](N[C@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccc(F)c(F)c1 481570612 GTERCDKWLOHCPK-QVKFZJNVSA-N 386.486 5.324 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 487215388 BOPCXJQTLOHEHI-JOCHJYFZSA-N 394.478 5.190 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccc(Oc2cccnc2)cc1 489879874 CEHVHLGJOLJNSH-IBGZPJMESA-N 398.510 5.065 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2-c2c(F)cccc2F)c1 494525931 HOZBKXMHLFYRFQ-UHFFFAOYSA-N 380.419 5.500 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cnn(CC(C)C)c1C1CC1)c1ccc(F)c(F)c1 497672874 QLVQZAKSINRDDW-LJQANCHMSA-N 388.462 5.134 30 20 GKED N#C[C@@H](C(=O)c1nccc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 503504916 XHZANAMKTITXFA-KRWDZBQOSA-N 389.867 5.502 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)c1nccn1C 505005354 KNFRJQBVERPDHD-FQEVSTJZSA-N 394.906 5.103 30 20 GKED CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 516237359 ZVMRPYDKPFEBLR-UHFFFAOYSA-N 388.492 6.023 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)Cc2cccc(C#N)c2)C(C)C)cc1 531153482 ZEJKIWLOIMNCAT-UHFFFAOYSA-N 398.506 5.214 30 20 GKED CC(C)N(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccc(C#N)cc1 532490226 GQZIOBTVZNOCQI-UHFFFAOYSA-N 390.314 5.104 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)n1 532535528 YXJLZIWWEDGRMQ-DEOSSOPVSA-N 397.478 5.226 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(F)cc(Cl)c(C)c1F 534178644 YEHYWBSMKHIUEG-UHFFFAOYSA-N 375.806 5.018 30 20 GKED CSc1cccc(NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1C 537099267 PWEBHIYOBPXCGZ-UHFFFAOYSA-N 394.525 5.280 30 20 GKED COc1ccccc1[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccccn1 537953869 KXGAZDUOYOCBAN-DKEBNAFJSA-N 397.522 5.173 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)CCCc3ccc4ccccc4c3)CC2)c1 538295692 DDCRJJQFRUSTJB-UHFFFAOYSA-N 398.506 5.104 30 20 GKED Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 539492987 DIBUWDJDEZUAOK-GAJHUEQPSA-N 393.556 5.069 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 540146774 LPUFVBOPEZQLSR-FOIQADDNSA-N 395.959 6.468 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccc(Br)s2)s1 541080140 KPNDPSCAJYGUBM-UHFFFAOYSA-N 395.328 5.425 30 20 GKED CSc1cccc([C@@H](NCc2cccc(C#N)c2F)c2ccc(F)c(F)c2)c1 541293012 GZMLTBYKFHIKNM-JOCHJYFZSA-N 398.453 5.577 30 20 GKED CCc1nc(C)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)s1 548294360 INAZBGISSLETAO-UHFFFAOYSA-N 381.432 5.069 30 20 GKED CN(C)Cc1cccc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 553306978 RARCPFBWRHOMDZ-UHFFFAOYSA-N 386.455 5.056 30 20 GKED C[C@@H](C1CC1)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 556502829 KDQGPEBVTKHUGL-AWEZNQCLSA-N 383.879 5.053 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1OCC(C)C 558312493 GABLYEKHTIZOIV-UHFFFAOYSA-N 384.524 5.109 30 20 GKED N#Cc1ccc(CNC2(c3ccc(Br)cc3)CC2)c(C(F)(F)F)c1 565454148 YIOCNMVIEGWYOS-UHFFFAOYSA-N 395.222 5.118 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3c3cccc(Cl)c3)cc2)ccn1 583175135 LCMMMOYUXKRLQB-RTWAWAEBSA-N 389.842 5.141 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1F 595694970 XJOZQJPHLFBPNQ-ZHRRBRCNSA-N 399.535 5.145 30 20 GKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cc(F)c(Br)cc1F 598992015 JDEWWOIGLZPNSS-LBPRGKRZSA-N 391.259 5.133 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCc3c(CC#N)cccc3C2)c(C)c1 599730132 MTEWJARVRXUBKP-QGZVFWFLSA-N 393.556 5.542 30 20 GKED CC(C)(C#N)c1ccc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1 602756681 DLHJLDDQIAGOJQ-HSZRJFAPSA-N 381.479 5.254 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cc2ccccc2o1 603693587 ZOIIPCZCMMXUQF-OAHLLOKOSA-N 398.422 5.374 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2nccs2)c1)c1nc2cc(F)ccc2s1 606147110 TZQDJYCRCNBINW-CQSZACIVSA-N 395.440 5.174 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCc3c(Br)cccc32)cc1 609047440 YKZAQCFVYDOILF-SFHVURJKSA-N 398.304 5.059 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(Cl)c1 609372448 XXFDQPDTYVBQJF-UHFFFAOYSA-N 378.815 5.265 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c2ccccc2n1 609377584 AZGSOZXZHQIVLK-INIZCTEOSA-N 389.524 5.862 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc2ccccc2c1 609398598 CLEIEEVQMCNUOM-INIZCTEOSA-N 375.497 5.413 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)c1 609504051 QMYXMUXUGAQQDB-NEPJUHHUSA-N 397.208 5.209 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccccc2Cl)s1)c1ccc(Cl)cc1 609589420 FZQVSESGLHDKAI-HNNXBMFYSA-N 388.279 5.112 30 20 GKED N#Cc1cnc2c(F)ccc(F)c2c1N1CCc2[nH]c3ccc(Cl)cc3c2C1 610273503 JTPTUMZWBPYITK-UHFFFAOYSA-N 394.812 5.082 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2NCc2ccccc2)c1 611201342 RIJFWCWPIFSJBY-UHFFFAOYSA-N 385.467 5.234 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCOC3(CCC3)C2)cc1)C(F)(F)F 647229780 CHOJDQUNCMDAGX-CYBMUJFWSA-N 385.323 5.490 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C[C@@H]1CCCO1)C(F)(F)F 654046943 HCFZMBFQNBIMKA-RDJZCZTQSA-N 384.442 5.160 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1sc(C(C)(C)C)nc1C 726426405 XLJZMZPIUHRPPI-UHFFFAOYSA-N 380.439 5.476 30 20 GKED C=CCN(Cc1ccccc1)C(=S)NCCc1ccc(Cl)cc1Cl 726458040 VIWPSPPMUIVVTN-UHFFFAOYSA-N 379.356 5.099 30 20 GKED Cc1cc(C(=O)Nc2cc(F)ccc2OC(C)C)c(C)n1-c1ccc(C#N)cc1 728275086 YCJRUWBKIQEHOC-UHFFFAOYSA-N 391.446 5.144 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccc(F)cc3)CC2)cc1 729552251 CCNSLEIJQWJSTG-QFIPXVFZSA-N 385.442 5.292 30 20 GKED Cc1cccc2c1CCN(C(=O)Nc1cccc(Oc3ccc(C#N)cc3)c1)C2 729571877 OUEBBKJPZSTYFE-UHFFFAOYSA-N 383.451 5.249 30 20 GKED O=C(O)c1ccc(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)s1 730590082 OCAZZYDNKARORI-WAYWQWQTSA-N 375.858 5.119 30 20 GKED CC(C)CC(Cc1ccc(Cl)cc1Cl)=NNc1cnnc(O)c1Cl 730947637 AQZFWWPXFQOVLJ-UHFFFAOYSA-N 387.698 5.199 30 20 GKED N#C[C@@H](NC(=O)Cc1c(Cl)cccc1Cl)c1ccc(Cl)c(Cl)c1 731643498 GIQOQGBLXCXCNJ-OAHLLOKOSA-N 388.081 5.224 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(OC)c([N+](=O)[O-])c2)cc1 741468749 HLVBYYBPPQWCRH-NTUHNPAUSA-N 389.407 5.175 30 20 GKED C#Cc1cccc(NC(=O)N(C)[C@H](C)c2ccc(-c3ccccc3OC)cc2)c1 743084941 SJDNHEOFUYXELD-GOSISDBHSA-N 384.479 5.568 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@]12CCCc1ccccc12)c1nc2cc(Cl)ccc2s1 744035121 HUTFTRAWHYZDSV-JLDZCNIISA-N 392.911 5.420 30 20 GKED N#Cc1cc(NC(=O)c2ccc(Oc3ccccc3)cc2)c(Cl)c([N+](=O)[O-])c1 746486914 XNWAQRJEXUBNSE-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C[C@@H](OC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)C(C)(C)C#N 753628598 KSSQDFZMWKKVQI-LLVKDONJSA-N 379.243 5.276 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)c(F)c1 755084638 MDHMDEXBJPTZOM-UHFFFAOYSA-N 397.378 5.013 30 20 GKED N#C[C@@H](COC(=O)c1sc(-c2ccccc2)nc1C(F)F)Cc1ccccc1 762071717 ZUTFWRJPZZCGOV-HNNXBMFYSA-N 398.434 5.287 30 20 GKED O=C(/C=C\c1c(Cl)oc2ccccc12)c1cc(Br)ncc1F 762422807 MILZMGOPWJAHMC-WAYWQWQTSA-N 380.600 5.279 30 20 GKED CCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCCc2cccnc21 774233334 OKVZXZXCHSJHOY-SFHVURJKSA-N 384.936 5.093 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1 775722176 FRVFLQXRAYWRJN-OALUTQOASA-N 399.494 5.869 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1 777704580 WJYDORWHMMMNOZ-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cncnc2-c2ccccc2)cc1 783422714 XTEIMJDXHDKXSM-JOCHJYFZSA-N 390.446 5.051 30 20 GKED CC(C)(C#N)CCCOC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1 783908369 QVHMVWRADAVZAQ-UHFFFAOYSA-N 393.418 5.029 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 786321752 IONQIVSEWBDCSB-GMTAPVOTSA-N 393.320 5.645 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571462 OYTNLFQFJPPFJC-ZDUSSCGKSA-N 383.448 5.033 30 20 GKED N#CCCCCCC(=O)O[C@H](CC(F)(F)F)c1ccc(Br)cc1 805879909 ULVVZRYXEZBWPF-CQSZACIVSA-N 392.215 5.460 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)nc2)nnc1N1CCC[C@H]1c1cccc(F)c1 812181597 QGNBJEQTTHPBLH-SFHVURJKSA-N 397.885 5.050 30 20 GKED COc1ccc(-c2nc(C)c(C(C)=NNc3nccc4sccc34)s2)cc1 814808596 CKQSEPALPBQHKQ-UHFFFAOYSA-N 394.525 5.573 30 20 GKED Cc1ccc(NC(=S)NC(CCC(F)(F)F)CCC(F)(F)F)cc1F 849302979 QJMIADPGUAVDIX-UHFFFAOYSA-N 390.368 5.474 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)[C@H](C)Cc1ccc(C#N)cc1 862718462 DKGINPBMHJYPJV-OAHLLOKOSA-N 393.487 5.031 30 20 GKED CNC(=O)c1ccc(/C=C\C(=O)c2ccc(-c3ccccc3Cl)s2)cc1 915112690 HMSUWESMJAQJRV-FLIBITNWSA-N 381.884 5.324 30 20 GKED CCCCCCOc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)cc1 916910503 RRNFBPMSPNWCEQ-SFHVURJKSA-N 398.890 5.260 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976398 NKWXXLZCWDHXFC-GOSISDBHSA-N 380.900 5.581 30 20 GKED Cc1cccc(C2(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)CCC2)c1 917046189 HFCFYJDHWBFZPG-MRXNPFEDSA-N 380.900 5.556 30 20 GKED N#Cc1ccc(CN(CC/C=C/c2ccccc2)c2ccc3nc(O)[nH]c3c2)cc1 1653642881 KLODMDVZGKOEOG-XBXARRHUSA-N 394.478 5.250 30 20 GKED CCC(=NNc1ccc(C(=O)O)cc1OC)c1ccc(Oc2ccccc2)cc1 1776050011 OEWMKNKVNHSQIX-UHFFFAOYSA-N 390.439 5.412 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(Oc2ccc(F)cc2)cc1 1776064500 RAVLVZHXNUWFJI-UHFFFAOYSA-N 382.366 5.291 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=NNc2ccc(C(=O)O)c(F)c2)CCC3)cc1 1776074039 DHMKXVXNRIDDTJ-UHFFFAOYSA-N 395.459 5.108 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776697935 YNIZWLFFSPCPCM-HMVFGEFZSA-N 390.435 5.760 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2F)cc1 1777472320 UJTWIMXUGLEOJS-SDNWHVSQSA-N 390.410 5.307 30 20 GKED C=CCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nc2ccccc21 4492861 GXLAQUYPLOWLCY-UHFFFAOYSA-N 392.311 5.260 30 20 GKED C=CCN(Cc1cccs1)C(=S)NCCSc1ccc(Cl)cc1 8149925 FYPUDOJOFYKCTN-UHFFFAOYSA-N 383.007 5.056 30 20 GKED COc1cccc(/C=C/C(=O)c2cc(Cl)sc2Cl)c1OC(F)F 18065589 LQAUHUUWKKFCEK-AATRIKPKSA-N 379.211 5.561 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(F)cc2F)cs1 54897404 LPSJJOBLEWXYPM-POHAHGRESA-N 398.434 5.310 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(C2SCCCS2)cc1 62905354 VVVQTLDKLQUNES-UHFFFAOYSA-N 394.565 5.255 30 20 GKED N#Cc1ccc(CSCC(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1 63690462 RARIZHDKYTZMJS-UHFFFAOYSA-N 398.531 5.261 30 20 GKED COc1ccc(C(=O)CCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66856018 VJYQGXIGZVGWEA-MRXNPFEDSA-N 396.512 5.081 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)C1CCCCC1 115184405 RUHQIPWXTHMIKG-CQSZACIVSA-N 378.295 5.064 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)Nc1ccc(F)cc1OCC#N 135283781 MFIRNJFZVWSSFH-UHFFFAOYSA-N 387.480 5.322 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 152077458 OTAWGERVEQJBQV-ZDUSSCGKSA-N 377.753 5.034 30 20 GKED CC(C)[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 172545529 HEJOYRNWTOMMHB-DLBZAZTESA-N 381.426 5.123 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1ccccc1O[C@@H](C)C#N 180027817 WJHBXSQEBHEKMV-ZFWWWQNUSA-N 386.521 5.091 30 20 GKED C=CCC[C@H](NCc1csc(-c2ccc(O)c(OC)c2)n1)c1ccccc1 180046983 OZWJUKYBPNDDJI-IBGZPJMESA-N 380.513 5.321 30 20 GKED Cc1csc([C@H](C)CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 185010044 FXYWSEPMRACACC-CQSZACIVSA-N 392.484 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C 191433214 BEXXZCKJQOUNLH-KRWDZBQOSA-N 399.604 6.652 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccccc2F)CC1 191437196 ORPJFWNPVGUMAT-UHFFFAOYSA-N 381.495 5.032 30 20 GKED Cc1c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1C1CCCC1 193559549 CQNHYMVJRLLARR-CQSZACIVSA-N 383.521 5.345 30 20 GKED COc1cc([C@@H](C)NCc2ccc(O[C@@H](C)C#N)cc2)ccc1OC1CCCC1 237252364 NSDGJJMSOKPHHT-ZWKOTPCHSA-N 394.515 5.158 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 237603741 SPJGJBQSQJYBRW-OSPHWJPCSA-N 392.449 5.329 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CN2CCCC[C@@H]2C)C1 249058994 JDWOAFFBXQDJQK-LEWJYISDSA-N 397.607 5.657 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\SCc3ccco3)n2)cc1 255296164 GESIHBGYBHUMBF-PXAMLJHWSA-N 396.493 5.035 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nnc(/C=C\c2ccco2)s1 255907298 FATZSBNMIKZULW-QXMHVHEDSA-N 398.447 5.092 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 264587597 ZQPPHGGZCDYWQM-OXJNMPFZSA-N 395.528 5.316 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc([N+](=O)[O-])cc3C#N)s2)cc1 301292758 QUGROALHDPONEW-GFCCVEGCSA-N 394.456 5.080 30 20 GKED O/C(=N/Cc1cc(Cl)sc1Cl)[C@H]1CCc2[nH]nc(C(F)(F)F)c2C1 329109987 JEYCPKGRMADNQT-LURJTMIESA-N 398.237 5.058 30 20 GKED CCN(C(=O)NCC1(CC#N)CC1)[C@H](C)c1ccc(-c2cccc(OC)c2)cc1 431189327 ZTMYEEGAXFLPMW-GOSISDBHSA-N 391.515 5.149 30 20 GKED O=C(NCc1c(F)cc(F)c(F)c1F)Nc1ccc(CCC(F)(F)F)cc1 432211176 UYEBPEQLHRTLJU-UHFFFAOYSA-N 394.290 5.060 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 433494111 QDRIYYMLKFXWEK-HNNXBMFYSA-N 379.435 5.286 30 20 GKED N#CCCCCNC(=O)c1c(Cl)cccc1Oc1ccc(F)c(Cl)c1 436320899 XFOGSJOFWUYCET-UHFFFAOYSA-N 381.234 5.348 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(CCC(F)(F)F)cc1 440296733 UGZPPCRCAUDCDX-UHFFFAOYSA-N 380.385 5.541 30 20 GKED C[C@H](N[C@H]1CCC[C@@H](c2ccnn2C)C1)c1ccc(-c2cccc(C#N)c2)cc1 448024557 ZAFUCOHJBPCMBL-GLYQVZKVSA-N 384.527 5.336 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1C[C@H]1C(F)(F)F 450965484 DQRFRVTZRVAJCL-MXWKQRLJSA-N 393.249 5.014 30 20 GKED C=CCC[C@H](CC)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 461892050 YWKVXNMTHWYUQJ-PZJWPPBQSA-N 391.964 5.167 30 20 GKED C[C@@H](C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1)c1cccc(C#N)c1 462035773 KFQOTEMTAIXLJS-GFCCVEGCSA-N 399.422 5.025 30 20 GKED C=CCCN(C)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 466390883 JBAIZQJIPOPXLT-UHFFFAOYSA-N 376.403 5.003 30 20 GKED C=CCC(CC=C)C(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 468543412 ROFSGARFNMKCJM-UHFFFAOYSA-N 392.524 6.128 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(C(=O)C3CCC3)cc2)c2ccccc21 469850639 VYGXSCLNCGBJSQ-UHFFFAOYSA-N 385.467 5.180 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1ccc(C(C)=O)c(F)c1 476141743 JPMGMSFVMOSOQT-UHFFFAOYSA-N 385.504 5.611 30 20 GKED C=CCCC1(C(=O)NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)CC1 476159296 SCOLJYSUYGOQLG-UHFFFAOYSA-N 390.405 5.255 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCCc1nc2ccccc2s1 476171092 YWTPVYQSOMWTLQ-UHFFFAOYSA-N 392.568 6.500 30 20 GKED CCCc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cnn1-c1ccc(C)cc1 477090185 PTGYRCJBFICKFH-FQEVSTJZSA-N 386.499 5.159 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1nc(-c2cccc(F)c2)no1 478425219 GYLGEUNWSVGCAI-MRXNPFEDSA-N 398.441 5.265 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C(C)C 484162452 OXHQXNROOVGVGD-INIZCTEOSA-N 399.564 5.702 30 20 GKED C=CCSc1ccccc1C(=O)NCCc1nc(-c2ccccc2)c(C)s1 486233602 SKYDNHBSILWMDI-UHFFFAOYSA-N 394.565 5.369 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(N2CCSCC2)cc1C 486245058 VZZHVABGMIIQIF-UHFFFAOYSA-N 384.570 5.079 30 20 GKED CCN(Cc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1)C(C)C 487469162 FVXHNKZOBWWIOY-HSZRJFAPSA-N 377.532 5.082 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1CC 489065643 BPJVLICHBCTAKB-OAHLLOKOSA-N 392.425 5.026 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503467544 XDVBBWVNHQSFCW-UHFFFAOYSA-N 395.890 5.320 30 20 GKED C=CCn1c(C)nnc1S[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 504549111 SFUWVAQHGRXJMP-VIFPVBQESA-N 395.372 5.663 30 20 GKED N#C[C@@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccccc1Cl 505695765 XFNSZQSUBVLFGT-QGZVFWFLSA-N 383.904 5.044 30 20 GKED Cc1sc(NC(=O)c2cccc(CN(C)Cc3ccccc3)c2)c(C#N)c1C 508514636 XGZSENYZRMWNMO-UHFFFAOYSA-N 389.524 5.121 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2cccnc2C(F)(F)F)n1 512039949 KTXISNLANWJCRU-LLVKDONJSA-N 391.246 5.228 30 20 GKED Cc1c(C#N)cccc1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 512831453 CGBRWFGRRXFRRI-NRFANRHFSA-N 399.494 5.622 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4ccc(C(F)(F)F)cn4)cc3c2C1 513158223 ADHCVRFFKFPOEN-SJKOYZFVSA-N 397.400 5.197 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@@H]1N[C@@H]1CCc2ccc(C#N)cc21 515924641 HIVUVLTUQBWGIJ-ZQBYOIRZSA-N 399.357 5.381 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3ccc(Cl)cc3)CCCC2)c1 517102195 WOXMFKFMEYTJNK-UHFFFAOYSA-N 382.891 5.473 30 20 GKED CC(C)c1ccc(-c2noc(CNc3ccccc3S[C@H](C)CC#N)n2)cc1 517534865 HKNJWEXLKXFSRD-MRXNPFEDSA-N 392.528 5.866 30 20 GKED COc1ccc(CCCCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 518207386 HFUWZJPNLGEXHO-SFHVURJKSA-N 391.298 5.096 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cs2)cc1 520923971 BIRYJTXZXOZLEM-OAHLLOKOSA-N 393.537 5.765 30 20 GKED Cc1ccc(-c2ccncc2)cc1N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1 522438651 FTXZZHHZPUKTHC-OAHLLOKOSA-N 390.874 5.021 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)cc2F)c2ccc(F)c(F)c2)c1 525175943 LDDHDWVXLNQQFN-QFIPXVFZSA-N 398.453 5.577 30 20 GKED COc1cc(C)ccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 526084559 MDBDWGSPZUNENL-UHFFFAOYSA-N 394.418 5.281 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2c(-n3cccc3)sc3c2CCC3)n1 534715902 FZWABXWZKWUHFE-AWEZNQCLSA-N 381.526 5.097 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C1CC1 534967366 OFSWBSIVQDQQGT-CABCVRRESA-N 397.548 5.627 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2ccoc2)c1)c1nc2cc(Cl)ccc2s1 535553045 FTGHMJFJNFFUFI-INIZCTEOSA-N 378.840 5.700 30 20 GKED CCc1cc(C#N)c(NC(=O)[C@@H](C)c2cccc(C(=O)c3ccccc3)c2)s1 535587092 HSUATBXUEDXFTK-HNNXBMFYSA-N 388.492 5.155 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1c(F)cc(Cl)cc1F 537104307 RJXSJRPASJNPFK-UHFFFAOYSA-N 377.822 5.180 30 20 GKED C=CCCOCCCCC(=O)N1CCc2ccccc2[C@H](c2ccccc2)[C@H]1C 538281570 MKZQUCWELBPJFB-RLWLMLJZSA-N 391.555 5.355 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(CC#N)cc1)c1ccccc1Cl 541293291 HGXQMYLUBFGRNE-QHCPKHFHSA-N 376.887 5.294 30 20 GKED C[C@H](NCc1cnc(C(C)(C)C)s1)c1ccc(-c2cccc(C#N)c2)cc1 542946851 AMQSWJQDRFEZTI-INIZCTEOSA-N 375.541 5.830 30 20 GKED Cc1nc(-c2cccc(-c3noc(C4(c5cccc(C#N)c5)CC4)n3)c2)cs1 544723789 GFELHHJGNKDGMD-UHFFFAOYSA-N 384.464 5.120 30 20 GKED CCC[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 549401193 PVEULFNKRLSFTP-GOSISDBHSA-N 375.394 5.434 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccccc1-c1cccs1 554363018 DXFDZLITMUHZQQ-UHFFFAOYSA-N 382.485 5.111 30 20 GKED N#Cc1csc(CNCc2ccc(Oc3cc(Cl)cc(Cl)c3)cc2)n1 572566317 DKTHUXYONHHLRI-UHFFFAOYSA-N 390.295 5.404 30 20 GKED CC(C)[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1cccc(C(F)(F)F)c1 572597222 CNYNIGKPYPQYKE-GOSISDBHSA-N 381.442 5.128 30 20 GKED C=CCn1c(-c2sc(-c3ccccc3)nc2C)nnc1N1Cc2ccccc2C1 577801416 FBMOWKPBRQQGHM-UHFFFAOYSA-N 399.523 5.083 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 584873216 YUARGBHACJPMBU-CQSZACIVSA-N 393.434 5.403 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1csc(-c2ccccc2)n1 588337788 KSZSWMCWDZXDIV-UHFFFAOYSA-N 376.485 5.124 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)CCCCCC#N)nc2c1C 588820980 HOIJIOGSQOGBKY-UHFFFAOYSA-N 391.540 5.920 30 20 GKED CC[C@H](OCCNC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 593158634 BZXPATHVHCHECC-XLIONFOSSA-N 397.544 5.228 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N3CC(CC#N)C3)cc2)c1 596750007 JVHCCJQGKDMUSQ-UHFFFAOYSA-N 377.488 5.075 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CSCc1ccc(C#N)cc1 603701332 HYUBFVBMMDHZHE-ZDUSSCGKSA-N 393.339 5.318 30 20 GKED Cc1[nH]c2c(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)cccc2c1C 604241951 ZJVRKOMFHFCQPN-UHFFFAOYSA-N 382.423 5.096 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 605925032 SEMCEVCCMSWPBY-QFIPXVFZSA-N 391.515 5.094 30 20 GKED N#CCn1c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)cc2ccccc21 609165589 UDMRGXNMVSPNSZ-UHFFFAOYSA-N 398.293 5.276 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc(OCCCC#N)c1 609262002 FDTQKNURHJGPNN-OAQYLSRUSA-N 380.488 5.289 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)c1 609427191 UDBNIXUMYYOFSZ-CVEARBPZSA-N 388.389 5.658 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cccc3c[nH]nc23)c1 609722793 HGNUFQQEGNBDOE-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccco1 609929602 GEJXTXIUJVYGCS-AEFFLSMTSA-N 383.517 5.681 30 20 GKED C[C@@H](Nc1nc(-c2cccnc2)nc2sc3c(c12)CCC3)c1cccc(C#N)c1 610340418 UELRGCGVYIGYTO-CQSZACIVSA-N 397.507 5.287 30 20 GKED COc1ccc(C(NCc2ccc(Cl)cc2C#N)c2ccc(OC)cc2)cc1 614057202 SMDOVZXNVURLPJ-UHFFFAOYSA-N 392.886 5.108 30 20 GKED CC[C@@H](CC(F)F)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494264 GLEICVXAZNWQKZ-QMMMGPOBSA-N 395.265 5.596 30 20 GKED CC(C)c1ccoc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 671278908 JPXWDUUPCHDVLF-LBPRGKRZSA-N 378.375 5.522 30 20 GKED C=CC[C@H](C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 681649283 OWWALXZCSNRVNA-JJXSEGSLSA-N 393.371 5.372 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 726467741 AIYAUXXEIVMISN-NRFANRHFSA-N 376.912 5.397 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3cn(C)c4ccccc34)c(Cl)nc21 726740530 IXOZQOABLKJOCS-CMDGGOBGSA-N 378.863 5.053 30 20 GKED COc1cc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)cc(Cl)c1O 727781013 ZTPXEXBSBQPPAR-CMDGGOBGSA-N 385.872 5.382 30 20 GKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1sccc1Br 727973828 CLMJOWYETSMRME-SREVYHEPSA-N 376.300 5.530 30 20 GKED Cc1ccccc1NC(=O)[C@@H](C)Nc1ccc(OCc2cccc(C#N)c2)cc1C 728061955 BYTINYZUGWEJDT-LJQANCHMSA-N 399.494 5.193 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=S)Nc1c(Cl)ccc(C)c1Cl 728444926 MXKDUWFKORDFOK-UHFFFAOYSA-N 390.339 5.559 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cccc(-c2ccc3ccccc3c2)n1 729360139 NJSYCHBBUSYLRV-UHFFFAOYSA-N 379.419 5.056 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3ccc(OC)cc3)cc2F)s1 730173797 ARDFTFXOJAFZGG-UHFFFAOYSA-N 380.444 5.249 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416171 BKCMSTCUYIXFPL-VAABUUKESA-N 394.471 5.502 30 20 GKED CCCCc1ccc(NC(=S)Nc2ccccc2SC[C@H](C)C#N)cc1 730954744 JJLAZDNELQUMCJ-MRXNPFEDSA-N 383.586 6.090 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(SC(C)(C)C)cc2)c1 733844333 JAHFTBKJKRBLPO-GOSISDBHSA-N 397.544 5.580 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/CCc1nc(-c2cccc(Cl)c2)no1 734095828 HKDOGDQFJGGIED-ZVBGSRNCSA-N 396.661 5.064 30 20 GKED Cc1ccccc1NC(=S)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 745723565 BTWFYGFTFRKIQC-UHFFFAOYSA-N 389.499 5.718 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 754887451 AEGCVIMJDFFBSW-HTAPYJJXSA-N 385.467 5.693 30 20 GKED C[C@@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1cccc(C#N)c1 756628858 YLQMIZZDQHDPEZ-GHMZBOCLSA-N 379.685 5.092 30 20 GKED N#Cc1cc(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)ccc1F 758909922 LMOGZPVEEVYCFQ-UHFFFAOYSA-N 394.016 5.063 30 20 GKED Cc1ccc(Oc2cc(-c3noc(Cc4ccccc4CC#N)n3)ccn2)cc1C 761729977 UWMHULUOLBPUDK-UHFFFAOYSA-N 396.450 5.198 30 20 GKED CC(C)n1ncc2cc(/C=C3\C(=O)c4cccc5c4[C@@H]3CCC5)c(Cl)nc21 763287640 CLQAVBDYKGLTKV-LTKMBJGESA-N 377.875 5.365 30 20 GKED C[C@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccc(OCC#N)cc1 776157403 AXXSQOUMCLNVQB-BXKMTCNYSA-N 392.449 5.502 30 20 GKED C[C@@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(C#N)c(F)c1 776856515 TYMRUJYJUZWSKR-GFCCVEGCSA-N 384.348 5.287 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@](C)(C#N)CC(=O)OC(C)(C)C 779901512 KIVOQOPTECAQBZ-NRFANRHFSA-N 390.549 5.086 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2Cl)o1)c1ccc(N2CCNC2=O)cc1 782366455 QDYHSJPIKAAKLU-LUAWRHEFSA-N 392.842 5.026 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 792587640 DFVSYPMIRLTMPV-JHJOLFGTSA-N 376.500 5.264 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 793733740 WXVTZUFOOHUVBY-GOSISDBHSA-N 393.487 5.368 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 797568706 VBWNZINLKLGAMY-MRXNPFEDSA-N 395.553 5.292 30 20 GKED N#Cc1ccccc1C(=O)/C=C\c1ccc(/C=C\C(=O)c2ccccc2C#N)cc1 799497904 CPKCXSFYBAPLRQ-VMNXYWKNSA-N 388.426 5.222 30 20 GKED O=C(CC(F)(F)F)Nc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1 800790640 PSEFFLGYGJYMDW-UHFFFAOYSA-N 391.176 5.341 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(N2CCCOC2=O)cc1)c1ccc(F)c(F)c1 815617577 QEKPZBXBPNEBCE-BTYIYWSLSA-N 386.442 5.280 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1[N+](=O)[O-] 839311321 UJTNMSXXDWBOAQ-UHFFFAOYSA-N 377.853 5.040 30 20 GKED C[C@@]12CC[C@H]3[C@H](CC=C4C[C@@H](OC(=O)CCCCC#N)CC[C@@]43C)[C@@H]1CCC2=O 847654487 OQMCVLXJWFJBOI-GGYSQDOYSA-N 397.559 5.514 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 878218041 IQQYXBLMKCJBME-PKOBYXMFSA-N 387.405 5.148 30 20 GKED N#Cc1ccccc1/C=C\C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1 914896088 SFDFFFZUAGQNAR-NXVVXOECSA-N 392.458 5.015 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NNCC1(C)CCC1 1776090742 YAKMFVAKHKWSJQ-UHFFFAOYSA-N 394.515 5.052 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776801120 DLJCKPSFBFKVTN-NTMALXAHSA-N 398.455 5.814 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1 1776869247 LARXLMMHWLUHJL-RAXLEYEMSA-N 391.492 5.369 30 20 GKED Cc1c(/C=C2\Cc3cc(Cl)cc(Cl)c3C2=O)nc2ccccc2c1C(=O)O 1777414296 YFEIVZDIKPNWGF-XYOKQWHBSA-N 398.245 5.371 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2cccc(O[C@H](C)C(=O)O)c2)c1 1777461675 AQFPDIIRVAYJSQ-KAUXGEHWSA-N 386.447 5.410 30 20 GKED CCOc1cc(C#N)ccc1OCc1cc(=O)oc2cc(C)c(C(C)C)cc12 6540775 NZCHNXUYEJMZAY-UHFFFAOYSA-N 377.440 5.074 30 20 GKED CCCN/C(S)=C(/C(=O)c1cc(C)ccc1C)[n+]1ccc(C(CC)CC)cc1 22805117 WOSZKCWAHWTQNB-UHFFFAOYSA-O 397.608 5.433 30 20 GKED C[C@@H](Sc1ccc(F)c(Cl)c1)C(=O)Nc1sc2c(c1C#N)CCC2 26334424 TVYKSVQCGFZJRH-SECBINFHSA-N 380.897 5.020 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Cl)cc3[N+](=O)[O-])n2)cc1 46442655 GFWGCLYOAUOPJU-HNNXBMFYSA-N 397.843 5.170 30 20 GKED C[C@H](OC(=O)CCc1ccc(C#N)cc1)c1ccccc1NC(=O)c1ccccc1 51943787 KRFCAVBFOKPTGP-SFHVURJKSA-N 398.462 5.048 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1 63400587 JFMAXMHSHNIOMD-VWLOTQADSA-N 395.506 5.240 30 20 GKED Cc1nc(NC(=O)c2cc(C)n(C3CCCCC3)c2C)sc1SCC#N 101518285 IQFGTQFCTQRKJF-UHFFFAOYSA-N 388.562 5.243 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)cc1 125355890 CUOXWCJGRFLKGS-OVCLIPMQSA-N 399.446 5.215 30 20 GKED C=C[C@@H](CC(=O)N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 156085818 JACJXDWJOGHGBA-UXHICEINSA-N 386.495 5.198 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 173137392 YXPLOEPTHDAYPU-GFCCVEGCSA-N 389.318 5.262 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1ccc(F)cc1C#N 177591356 QVQVLSNKJAPFGD-UHFFFAOYSA-N 377.853 5.097 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN(C)Cc2ccc(C#N)cc2)on1 180912339 KWBHWMYAIRIGRV-UHFFFAOYSA-N 383.451 5.007 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 185323956 BASYIMCOWPGEET-APWZRJJASA-N 379.529 5.450 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2o1 189962431 RTGALYAFSBACHO-LSDHHAIUSA-N 379.485 5.567 30 20 GKED N#CCC[C@@H](NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccccc1 255363205 JQVLXLVCGIWGQC-GHYICZDASA-N 375.859 5.063 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3cccc(Cl)c3Cl)o2)cc1 255397361 FDMFDOKBTJWTLI-LBPRGKRZSA-N 376.243 5.464 30 20 GKED COc1cccc([C@H]2C[C@H]2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 303384952 WZEYQFMMCARBJN-DHIUTWEWSA-N 384.435 5.101 30 20 GKED Cc1ccc(N(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)C(C)C)cc1 303420020 YBRMYFQEOHCALI-SFHVURJKSA-N 381.545 5.100 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)cc1Br 322803339 RATMNKLLPRQLDN-ZDUSSCGKSA-N 377.257 5.444 30 20 GKED OC(=Nc1nc2ccccc2n1C1CCCCC1)c1coc(C2CCOCC2)n1 328823832 RXAYIYZBPMVJHQ-UHFFFAOYSA-N 394.475 5.060 30 20 GKED N=C(O)c1ccc(N=C(O)[C@H]2CCCc3sccc32)cc1N1CCCCC1 329200700 BNUQYOSMLNZLIY-INIZCTEOSA-N 383.517 5.330 30 20 GKED CC[C@@H]1C[C@H](C(O)=Nc2cc(Cl)ccc2OC[C@@H]2CCCCO2)CC(O)=N1 330271549 WCHVGTSRXCMVPL-IMJJTQAJSA-N 394.899 5.021 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)c1 409923620 QFRGZPGPSOPYOC-CHWSQXEVSA-N 397.208 5.209 30 20 GKED Cc1ccc(CN(CCCC2(C#N)CCOCC2)CCc2ccccc2)s1 410300429 YPXNIXDYVMYWRG-UHFFFAOYSA-N 382.573 5.202 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(Cl)c(Br)c2)s1 430595355 XMVCDPMHADBZMS-SNVBAGLBSA-N 397.725 5.347 30 20 GKED Cc1cn(-c2ccccc2Cl)nc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430607643 CQKJCCJFXMGXHD-CYBMUJFWSA-N 398.919 5.078 30 20 GKED C[C@@H](NC(=O)NC[C@@H]1CCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 430897202 KHNLKOFLVCWQFX-NVXWUHKLSA-N 383.442 5.021 30 20 GKED CC(C)(C#N)CCCCSc1n[nH]c(-c2ccccc2Br)n1 436137901 ATGZVCDFSNEKFS-UHFFFAOYSA-N 379.327 5.046 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 437906474 HJYILAKNSLUFNQ-HNNXBMFYSA-N 381.907 5.899 30 20 GKED CCC[C@@H](Cc1ccccc1)N(CCC)Cc1nnc(-c2ccc(C#N)cc2)o1 441502929 QYFNEQNSFGVOQB-QFIPXVFZSA-N 388.515 5.232 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 446362571 JHSRPIINWBURPV-KWQFWETISA-N 394.718 5.113 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)Nc2ccc(CC#N)cc2Cl)cc1 455706781 QRJBSRFXJADBOK-NQIIRXRSSA-N 397.906 5.004 30 20 GKED N#CCCC[C@H](NC(=O)NCC1(Sc2ccccc2)CC1)c1ccccc1 458363894 JZBJFUQRHYWBSG-FQEVSTJZSA-N 379.529 5.046 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F)c1ccccc1 458531745 ZOOSFAQNJMMIBI-KSZLIROESA-N 381.442 5.089 30 20 GKED CN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 459007102 JOXNUXGZUCMRIJ-ONGXBYRLSA-N 399.897 5.292 30 20 GKED N#Cc1ccc(NC(=O)[C@H](Sc2ccccc2F)c2ccccc2)cc1C#N 460104218 AGTCRAKQFYZXJQ-OAQYLSRUSA-N 387.439 5.041 30 20 GKED C=C(C)Cn1c(Cc2ccccc2Cl)nnc1N1CCC[C@H]1c1ccco1 460959448 PALDYYMLHPTOIN-SFHVURJKSA-N 382.895 5.033 30 20 GKED Cc1cccc([C@@H]2CCCCN2C(=O)CCCCOc2cccc(C#N)c2)c1C 464585044 LDZIVZSYGWGCNZ-DEOSSOPVSA-N 390.527 5.478 30 20 GKED C=CCn1c(SCc2ccc(Br)c(Cl)c2)nnc1C1CC1 468490854 CHURZMQVQRBIIL-UHFFFAOYSA-N 384.730 5.050 30 20 GKED N#Cc1ccc(Cl)cc1OCc1nnc(-c2ccc(Cl)cc2Cl)o1 474356385 RCMLBLHZYJOPES-UHFFFAOYSA-N 380.618 5.147 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(NC2CCOCC2)cc1 475567503 XPQPSOUAOWGMMM-UHFFFAOYSA-N 393.531 5.773 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 475639549 BTUMRNKXCKLDHU-HXUWFJFHSA-N 381.435 5.377 30 20 GKED Cc1cc(Br)c(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1Cl 476714174 HPDYBOIBUISPEX-CQSZACIVSA-N 391.696 5.437 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccco2)c2ccc(Cl)cc2)cc1 482639400 UYIGKWGVKWVUSW-UHFFFAOYSA-N 382.872 5.130 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C)(C)c1ccc(F)cc1 482843666 UHCPFXLAPICUTG-UHFFFAOYSA-N 389.430 5.109 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 482909057 AMGWKBTWXAPKOK-UHFFFAOYSA-N 381.520 5.432 30 20 GKED N#CC[C@H](CC(=O)Nc1nc(-c2cc(F)ccc2F)cs1)c1ccccc1 483075583 PKVNEENBKSVINK-CQSZACIVSA-N 383.423 5.114 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3nccc4ccccc34)sc2C)cc1 483218678 HVUZRYVQPPUVEJ-OAQYLSRUSA-N 398.487 5.770 30 20 GKED N#Cc1ccc(C(=O)N2CCC(Cc3cc(Cl)ccc3Cl)CC2)s1 487786069 RLUFZGNHHBKGFB-UHFFFAOYSA-N 379.312 5.021 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(-c2nc(C3CC3)no2)cc1C)c1ccccc1 490280082 VEYDUPGFMJIOFX-FQEVSTJZSA-N 387.483 5.611 30 20 GKED N#CC1(CCCN[C@@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CCOCC1 499611671 OXVPSDCEJGBFKT-RPBOFIJWSA-N 388.555 5.538 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccn2)cc1)[C@@H](C)c1ccc(C#N)cc1 508925571 VCDHXJYXFSKBBK-KRWDZBQOSA-N 387.508 5.328 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 509677980 CCGUIRKNANIXDP-UHFFFAOYSA-N 379.419 5.460 30 20 GKED C=C(C)C[C@H](C)c1nc(-c2ccc(C(F)(F)F)nc2OCC(F)(F)F)no1 516115735 ASHOAGAIZKUPTL-VIFPVBQESA-N 395.303 5.161 30 20 GKED CCCN(C(=O)[C@@H](C)Oc1ccccc1C#N)[C@@H](C)c1cc2ccccc2o1 516623173 QPSIKUXGGZNAEA-DLBZAZTESA-N 376.456 5.072 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](Cc2ccccc2)C1 518684891 QGJMHRFLJFFADY-ICSRJNTNSA-N 393.556 5.425 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(F)c(F)cc3Cl)cc2)cc1 519030611 TYOBPJXKQIKBJT-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 524089052 MCYVLHPANRWCTI-UHFFFAOYSA-N 397.372 5.462 30 20 GKED N#C[C@@H](C(=O)c1cccc(Nc2ccccc2)c1)c1ccc(C(F)(F)F)cn1 525427577 HPTJAPHSNHPHEG-GOSISDBHSA-N 381.357 5.334 30 20 GKED C=CCCC[C@@H](C)NC(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 538327882 PYCHPCRUPJKXJS-QGZVFWFLSA-N 390.483 5.089 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)Nc1cc(C#N)ccc1OC(C)C 540437817 WIOGLGWHIJWMKM-UHFFFAOYSA-N 383.517 5.410 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 541002236 FQANBMHJOJDJTK-GHTZIAJQSA-N 396.918 5.340 30 20 GKED CCn1c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2ccccc21 541066648 MFJDHBWCPCMVPV-SFHVURJKSA-N 380.495 5.446 30 20 GKED Cc1cc([C@@H](Nc2cccc(OCCCC#N)c2)c2cccnc2)ccc1F 542495264 UINUICJEHKNJSK-HSZRJFAPSA-N 375.447 5.413 30 20 GKED CC(C)(C#N)CCCN[C@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 558896009 JZKASQSQZBRYQA-RBUKOAKNSA-N 379.951 5.313 30 20 GKED Cc1cc(Br)c(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)cc1Cl 561132452 YDGGDITWGUQCGN-OAHLLOKOSA-N 398.087 5.059 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nccc4ccccc34)s2)cc1 571495359 GVEYWVLNPDGUPX-IBGZPJMESA-N 399.475 5.165 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCCCCC(=O)C1 575807047 YNJCGLZBJTURQG-SFHVURJKSA-N 376.456 5.137 30 20 GKED Cc1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2ccc(F)cc2Cl)cc1 580972034 NHUHSFDPAQREAE-NRFANRHFSA-N 399.897 5.212 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnn(C(C)C)c2-c2ccccc2)n1 584089237 AXZXWAGDYYKNTJ-MRXNPFEDSA-N 378.501 5.201 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)C1 598410021 JFYVBJLVSMJFOP-KROBSHITSA-N 399.519 5.159 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 599082495 XRROHMFIEXGOCN-WBMJQRKESA-N 380.797 5.522 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)c1ccccc1 602107864 IZCFOTYFKPKTPZ-QGZVFWFLSA-N 384.435 5.198 30 20 GKED CC(C)(C#N)c1ccc([C@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)cc1 602756682 DLHJLDDQIAGOJQ-QHCPKHFHSA-N 381.479 5.254 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc2cc(F)ccc2o1 605083646 UXCLXSVYTXBFIX-NXEZZACHSA-N 397.290 5.211 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)n1C 609164889 ZQDPVEVJKMKPEW-FQEVSTJZSA-N 377.875 5.203 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609434966 HTYGQJIBRKJOPA-ZWKOTPCHSA-N 381.545 5.923 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC(c4ccccc4)CC3)cc2)cc1 609498392 DZTOQCDRTBSSGN-UHFFFAOYSA-N 396.490 5.565 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3c3ccc(O)cc3)cc2)cc1 609548586 MAZUEWGWKMRWCG-XMMPIXPASA-N 398.462 5.228 30 20 GKED C[C@@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1C(F)(F)F 610388461 SBSQHZKWNYFQTP-SNVBAGLBSA-N 386.295 5.338 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)C1 612242613 QULMRPRRKHNKPF-DEOSSOPVSA-N 389.474 5.059 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N1CCC[C@@](C)(C#N)C1 612314915 LMSWGHBPYBLGHP-IBGZPJMESA-N 386.293 5.068 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(OCc2cccnc2)cc1 614180122 XKBGNKDCMWIHJD-LJQANCHMSA-N 385.511 5.313 30 20 GKED Cc1cc(C)c2cc(C(=O)N(CCC#N)C34CC5CC(CC(C5)C3)C4)sc2n1 614425525 MTODPDAXHBFVAB-UHFFFAOYSA-N 393.556 5.238 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1c(F)c(F)cc(F)c1F 619125376 PDWRDSCAIMEJDH-UHFFFAOYSA-N 399.228 5.026 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H](C)c1ccsc1 619788215 WCRBGMBEUSZMSG-INIZCTEOSA-N 391.496 5.390 30 20 GKED N#C[C@H](C(=O)c1cc2ccsc2[nH]1)c1nc(-c2c(F)cccc2F)cs1 620304230 JYYKTSJYKWQFJC-SNVBAGLBSA-N 385.420 5.121 30 20 GKED Fc1cc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 678207832 FMLVMCQRQUGLJM-PHIMTYICSA-N 397.256 5.407 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 680639498 WBLDCLIMCUBVQP-SECBINFHSA-N 378.263 5.193 30 20 GKED CCCCCCCCC(=O)N1CCC([C@@H]2C(=O)Nc3cc(Cl)ccc32)CC1 727414080 ZVDVELIZVUEOIX-NRFANRHFSA-N 390.955 5.365 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 732495460 ALIUERODSRCPFF-YJBOKZPZSA-N 378.522 5.415 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(-c2cccc(F)c2C)o1 734294659 FBOYVUFNFJGDGC-UHFFFAOYSA-N 392.459 5.132 30 20 GKED C=C(C)CNC(=S)N(C)Cc1cc(C)c(OCc2cccc(C)c2)c(C)c1 734308897 KMOVKRHMGCQELL-UHFFFAOYSA-N 382.573 5.073 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccncc1 734654764 YESCWNVWYUHJNA-VXKWHMMOSA-N 391.902 5.441 30 20 GKED C=CC[C@H](NC(=O)N1CCC(Oc2ccc(C(C)C)cc2)CC1)c1ccncc1 734679292 LIMYBIWQYKHSMF-QHCPKHFHSA-N 393.531 5.075 30 20 GKED CC(C)N(Cc1cccs1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740482988 KFTSOVWYEURQAI-UHFFFAOYSA-N 395.553 5.468 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)cc1F 741847206 LUYBFZDKESYRTC-XBXARRHUSA-N 379.456 5.418 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1ccc(N2CCO[C@@H](C)C2)cc1 743181785 ZCNJWIRWFSRPBR-IBGZPJMESA-N 375.557 5.126 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(c3ccccc3-c3ccccc3)C2=O)o1 743281476 ACZCNWJAFBIJIJ-XDHOZWIPSA-N 388.473 5.224 30 20 GKED C=CCN(C(=O)N[C@H](c1ccc(OC)cc1C)c1ccccc1Cl)C(C)C 745912639 VFPSMUWUWSVZFX-OAQYLSRUSA-N 386.923 5.352 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(CC)s2)cc(Br)c1O 747202186 HYBJMANHJSPYEJ-FNORWQNLSA-N 381.291 5.073 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1cc2c(s1)CCCCCC2 749362036 ZPBQDEAFVONNKP-UHFFFAOYSA-N 389.524 5.156 30 20 GKED COc1ccc(-c2nc(S[C@@H](C)c3cccc(Cl)c3)nc(O)c2C#N)cc1 750003119 UVYUDTTXIJPBIZ-LBPRGKRZSA-N 397.887 5.236 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)N[C@H]2CCCC[C@@H]2C)cc1 751013602 IZRYRTSMOGJCQL-KXBFYZLASA-N 395.528 5.224 30 20 GKED N#C[C@H](C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1nc2ccccc2o1 751830458 LCMKFVUIWYPAJJ-MTHQAXEFSA-N 388.389 5.153 30 20 GKED CCSc1ccc(Cl)cc1C(=O)NCc1cccc(O[C@H](C#N)CC)c1 752313206 AGYUNVGVYPDBKX-INIZCTEOSA-N 388.920 5.063 30 20 GKED CS[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)(C)C 752485169 MBSZOVNVPAHDAR-PMACEKPBSA-N 381.545 5.241 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1cc(Cl)sc1Cl)c1nc2ccccc2o1 756233463 DZVRVWTVJDNJSB-SNVBAGLBSA-N 393.251 5.035 30 20 GKED COc1cc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)ccc1OCC#N 760262566 BCXCFEYFOKPPEF-FLIBITNWSA-N 394.279 5.178 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCn2ccc3cc(Cl)ccc32)n1 760993002 FOUPXTMBISWIOB-MRXNPFEDSA-N 385.920 5.531 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(OC)c(OCC)c2)cc1 765997631 LKXOLSAROUUQHW-INIZCTEOSA-N 375.896 5.076 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1nc2ccccc2s1 767926434 ZFXNLTVVOZHZAL-OAHLLOKOSA-N 388.496 5.046 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 775148422 ZIWRWXNOBMCNLM-OAQYLSRUSA-N 392.628 5.260 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=S)N[C@H](C)c1ccc(Cl)cc1Cl 779729255 YSDKMOMLHHZUSR-NWDGAFQWSA-N 394.327 5.332 30 20 GKED CC[C@@H]1C[C@H](CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 781770254 KZTSFTSXIKJPMV-MRVWCRGKSA-N 396.434 5.087 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(Br)cnc1Cl)c1ccccc1 787951039 ZLSPOVBNLJGFLO-AWEZNQCLSA-N 379.685 5.186 30 20 GKED O=C(/C=C/c1ccc(-c2cccc(F)c2F)o1)c1ccc(N2CCOC2=O)cc1 790218140 IEFNIVUMIMYVMD-CSKARUKUSA-N 395.361 5.078 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Oc2ccc(NC(=O)c3ccsc3)cc2)cc1 793424631 SNUCHCMZADVPGO-UHFFFAOYSA-N 390.464 5.021 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571039 LIQKDHVQQWAPEM-WFASDCNBSA-N 394.462 5.514 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccnc(C(F)(F)F)c2)n1 809497506 PZDJHGZGNBEAOS-LBPRGKRZSA-N 391.246 5.228 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1nc2ccccc2s1 814301684 BIBUPNNFTNVTFR-DOTOQJQBSA-N 378.501 5.092 30 20 GKED CC(C)(C#N)CCCSC1=NC(=O)/C(=C\c2csc3ccccc23)S1 814774214 ZVLLCDMDNAVLHK-MHWRWJLKSA-N 386.567 5.935 30 20 GKED N#CC1(CC(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)CCOCC1 822910429 QUFXPGURTYVXDH-UHFFFAOYSA-N 389.282 5.309 30 20 GKED N#C[C@@H](C(=O)Cc1csc(C2CC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 873499149 YKNJBWXCDCMDGS-HNNXBMFYSA-N 399.928 5.216 30 20 GKED CC(=O)[C@](C#N)(CCN(C)[C@@H](C)c1sc(C(C)C)nc1C)c1ccccc1 878301797 CEYOYNNKAWOIFZ-HTAPYJJXSA-N 383.561 5.008 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1sccc1Br 915047995 MYBKFMUYNJZSRF-UHFFFAOYSA-N 399.528 5.702 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1ccc(NC(=O)NC(C)C)cc1 915049425 USJJMTXPTPZGDJ-UHFFFAOYSA-N 395.894 5.254 30 20 GKED C[C@@H](OC(=O)CCc1ccc(C#N)cc1)c1cccc(NC(=O)c2ccccc2)c1 919029405 KMXOUACEYJIIJA-GOSISDBHSA-N 398.462 5.048 30 20 GKED O=C(O)c1cc2c(C=NNCc3cccc(Cl)c3Cl)c(F)ccc2s1 1776058191 MTBAGSZGAISYMD-UHFFFAOYSA-N 397.258 5.169 30 20 GKED O=C(O)c1ccc(Br)c(C=NNc2ccc(-c3ccccc3)cc2)c1 1776059737 IAVOOLOQJLDRNL-UHFFFAOYSA-N 395.256 5.260 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c1 1776127893 ILWOHHDJBKGUSX-HYXAFXHYSA-N 388.391 5.405 30 20 GKED CCCCCCCOc1ccc(CNc2ccc([C@@H](C)CC(=O)O)cc2)cc1 1776789078 OSJMDUONBFKIHS-IBGZPJMESA-N 383.532 6.226 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)[C@H]4CC[C@H](CC)CC4)cc3)CCC2)C1 1791463335 VISQTWSHJJQCSM-WGSAOQKQSA-N 394.559 5.303 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 25115967 RNNAYUYZRFVZFK-UHFFFAOYSA-N 396.446 5.156 30 20 GKED CC(C)c1ccc(-c2nc(/C(O)=N/c3nnc(C(F)(F)F)s3)cs2)cc1 29284823 BSNOJSNPPYNXBO-UHFFFAOYSA-N 398.435 5.440 30 20 GKED Cc1nc2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc2[nH]1 42060518 HGIKFDAHPCPPEI-UHFFFAOYSA-N 384.464 5.147 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 63274953 IWQAUXUIRVVEMR-DUXPYHPUSA-N 376.846 5.329 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)ccc1SC 63394587 BTGDXBDYFFLDCQ-UHFFFAOYSA-N 391.880 5.190 30 20 GKED Cc1cc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)c(C)n1C1CCCCC1 63556728 WNECAAHURLKYFR-VAWYXSNFSA-N 392.499 5.463 30 20 GKED C=CCOc1cccc(NC(=O)c2c(-c3c(F)cccc3Cl)noc2C)c1 65749286 DFBBVJCRPLKVPQ-UHFFFAOYSA-N 386.810 5.260 30 20 GKED CCCN(C(=O)Nc1cccc(C#N)c1)[C@@H](C)c1ccccc1Br 71972767 XHQYYXZLUVJMBJ-AWEZNQCLSA-N 386.293 5.326 30 20 GKED N#CC1(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)CCCCC1 72029935 RKUQVKXZYUDBTN-UHFFFAOYSA-N 380.300 5.529 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1 78665482 HJVDSGOKCQNUKB-GFCCVEGCSA-N 395.311 5.405 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccco1 97545502 AXAGCGNRSVZEHJ-LBPRGKRZSA-N 379.407 5.596 30 20 GKED N#Cc1ccc(SCC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1 102997096 ZYLIBLXNZXUKJZ-UHFFFAOYSA-N 380.419 5.234 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 154265982 JSULVISZCDNBRU-UHFFFAOYSA-N 391.471 5.187 30 20 GKED N#CCCn1cc(CNc2ccc3oc(C4CC4)nc3c2)c(-c2ccccc2)n1 156644123 FGMAAFWMZLRYDH-UHFFFAOYSA-N 383.455 5.094 30 20 GKED CC[C@H](C)c1ccc([C@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 175502581 GVSJBUZPLWTFIN-GAJHUEQPSA-N 388.515 5.609 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ncc(Br)s1 180220861 UVFFMBNSSHKWFK-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED CCCN(CCc1cccs1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 187112150 COUDTCWMZHNAFG-INIZCTEOSA-N 387.574 5.486 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ncc(-c2ccccc2F)o1 189910169 DLQOCNIWHCOVOQ-UHFFFAOYSA-N 392.474 5.904 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C[C@H](C)c1ccccc1 303166843 IOJKCILGYSPBIC-SFHVURJKSA-N 384.479 5.578 30 20 GKED O/C(=N/CCc1cccc2[nH]ccc12)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 328647935 HVOPFBMOJFNZFV-LJQANCHMSA-N 390.531 5.174 30 20 GKED Cc1noc(C2CC2)c1N=C(O)N1CCC(c2cccc3ccccc23)CC1 329779104 QSCKSPXAXMMIGK-UHFFFAOYSA-N 375.472 5.439 30 20 GKED COc1cc(C)cc(N=C(O)N2CCC[C@@H](c3nc4c(s3)CCCC4)C2)c1C 330209159 HHOPYJNASODOAY-MRXNPFEDSA-N 399.560 5.072 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccc2nc(C3CC3)sc2c1 330299018 HTKXPPFRQLYSRL-ZDUSSCGKSA-N 399.541 5.469 30 20 GKED C=CCCc1ccccc1NC(=O)C(C)(C)c1csc(-c2cccs2)n1 410343391 FSBNYEPPQQHRMU-UHFFFAOYSA-N 382.554 5.907 30 20 GKED C=CC[C@H](Cc1ccccc1)NC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 416848834 XAEARYHJGYCGQI-NGOKVRLYSA-N 398.572 5.043 30 20 GKED Cc1cccc2nc(CCC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)[nH]c12 426137385 NWOKLMITNKIOIQ-UHFFFAOYSA-N 396.450 5.107 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1COc1ccccc1)c1ccccc1 432924708 ZRGBXPWQJKTWCE-HSZRJFAPSA-N 399.494 5.822 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1F 437462427 VAGUVISPVCFIJX-UHFFFAOYSA-N 382.341 5.680 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(Sc2ccccc2)cc1 438143435 UYPZIVLJENGFTI-UHFFFAOYSA-N 387.508 5.051 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3ccc(F)cc3)C3CCCCC3)o2)c1 441168441 ANBATBSRXXIXEU-UHFFFAOYSA-N 390.462 5.082 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)N(C)Cc2cccc(C#N)c2)c1 442460024 XBNNCUDEXJAWNV-UHFFFAOYSA-N 385.467 5.110 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)s1 444113648 SPQKQVXXRSAVQK-NSHDSACASA-N 392.322 5.194 30 20 GKED N#CCc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1 444746292 XSOJZHZFQAAZHW-KRWDZBQOSA-N 386.339 5.555 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1Cl)c1nc(C(C)(C)C)cs1 455701538 JMOGJFNAAKKDSY-LLVKDONJSA-N 376.913 5.043 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458809143 ZXVXOZIXGBTOQW-YLJYHZDGSA-N 375.472 5.570 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N1CC[C@H](CSc2ccccc2)C1 462925322 MBDUCCKFJXAMOU-AWEZNQCLSA-N 381.451 5.003 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2SCCc3sccc32)cc1 463144667 LGIWASFZZDFAHO-FQEVSTJZSA-N 392.505 5.381 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 465528130 SJYKUPZYRYEXEA-NMNUPHIUSA-N 391.515 5.016 30 20 GKED N#CCCCn1cc(C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccc21 469534252 YBMQGPCJJWRYEG-JKSUJKDBSA-N 391.437 5.044 30 20 GKED C=C(C)CN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccccc1 470919298 PMBKVSYGZMLCNT-LJQANCHMSA-N 393.556 5.098 30 20 GKED N#C[C@@]1(NC(=O)c2cc(-c3ccccc3)ccc2Cl)CCc2ccccc2C1 472262596 XTBJINRTZPNNBX-XMMPIXPASA-N 386.882 5.188 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(N2CCCC2)cc1C)c1ccc(F)c(F)c1 479952371 DRGBGXNVLOHGPY-NRFANRHFSA-N 385.458 5.312 30 20 GKED Cc1c([C@H](C)NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)oc2ccccc12 481686961 LUVFKGJJWVBCPN-INIZCTEOSA-N 397.434 5.291 30 20 GKED N#C[C@@H](C(=O)c1cc2sc3ccccc3c2s1)c1cnc2ccccc2n1 483228546 NDXRGOIMSCFNLM-CYBMUJFWSA-N 385.473 5.549 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)CSc1ccc(C#N)cc1 483349825 JDGXKIDYZDDUIU-UHFFFAOYSA-N 379.312 5.006 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2sc3c(c2C#N)CCCC3)s1 483932289 ZTXQIZVDYOZXNK-UHFFFAOYSA-N 393.537 5.491 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 489033187 AZPWRJRREUODFZ-QFIPXVFZSA-N 381.541 5.397 30 20 GKED CCCCc1noc([C@H](C)Sc2nc3c(c(-c4ccco4)c2C#N)CCC3)n1 498056122 ANOFAQAHLCMJBG-ZDUSSCGKSA-N 394.500 5.281 30 20 GKED C[C@@H](c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)c1cccc(SCC#N)c1 499456159 JCJOSPRWUMDCRX-ZIAGYGMSSA-N 392.446 5.243 30 20 GKED CCOc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 503499488 FQEWNXQDCFOAGE-QGZVFWFLSA-N 396.899 5.661 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3sc4c(c3C#N)-c3ccccc3CC4)c12 504298142 CNKFISZESLPNDE-UHFFFAOYSA-N 397.503 5.356 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccc(SC(C)C)cc1 509524117 GURKAISUXOXFGP-SFHVURJKSA-N 393.556 5.518 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 510857168 LFVVCPBPYWIMTG-UHFFFAOYSA-N 397.478 5.879 30 20 GKED Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)[C@@H](C#N)c2nc(C)cs2)c1 513676807 LAZBVUPPLHQFOT-LJQANCHMSA-N 398.491 5.103 30 20 GKED N#Cc1cccc(-c2nnc(CNC3(c4c(Cl)cccc4Cl)CCC3)o2)c1 516708519 LXRKDRLNEHRFEX-UHFFFAOYSA-N 399.281 5.084 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 517428972 VXNVSTBTOQWVDP-ORAYPTAESA-N 398.293 5.101 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)Nc3ccccc3SC[C@@H](C)C#N)oc12 519422678 DTUHTFXUWBPBFV-ZDUSSCGKSA-N 378.497 5.862 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 521801350 ZQQRUNZRDUHHTC-HBGVWJBISA-N 386.520 5.976 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC(CCc3ccccc3)CC2)c1 524434982 XFLCBLZAHMQGHY-UHFFFAOYSA-N 399.441 5.036 30 20 GKED COc1ccc(-c2nc(CN3CCC[C@H]3[C@@H](C#N)c3ccccc3)cs2)cc1 530970909 SGACSTVTVPCBCP-VXKWHMMOSA-N 389.524 5.090 30 20 GKED CC(C)(C#N)CCCN[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl 531648079 VTNSNBKLERTJMN-OAQYLSRUSA-N 384.907 5.120 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(CCC(=O)Nc1sccc1C#N)C1CC1 532556893 QDQOPRZNBUZNQE-INIZCTEOSA-N 389.524 5.327 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCC[C@H]2c2ccc(C(C)C)cc2)cc1 536281755 XZQGTKACIBHNAY-QFIPXVFZSA-N 391.515 5.095 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@@H](c3ccc(Cl)cc3)C3CCCC3)o2)c1 538204747 LNDMWZOVLSXWLA-OAQYLSRUSA-N 392.890 5.283 30 20 GKED COc1cc(CS[C@H](C)c2ncc(C)o2)ccc1OCc1cccc(C#N)c1 539951601 WTJJRMUKJQJXIB-MRXNPFEDSA-N 394.496 5.437 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c1 541447237 SFWISKCWCGJYOI-OALUTQOASA-N 393.556 5.577 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CC1CCC(C(F)(F)F)CC1 543101932 NVKNASQBAZWFBX-AWRGBYNESA-N 378.438 5.044 30 20 GKED CC(=O)c1cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)ccc1F 552631236 OCZBVSZBIJRDFJ-UHFFFAOYSA-N 388.398 5.139 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCc2c(Br)cccc21)c1ccccc1 559861612 APGTYIZWZYNBNK-NHCUHLMSSA-N 383.333 5.851 30 20 GKED Cc1nc(-c2cc([C@H](C)N[C@@H](CCCC#N)c3ccccc3)cs2)cs1 567296270 HQJURPRSWKBFEF-KXBFYZLASA-N 381.570 6.266 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)oc1C 590070550 IQIGZXFKNLKIEG-NRFANRHFSA-N 388.471 5.515 30 20 GKED CCOc1ccccc1Oc1ccc(CNCc2ccc(C3(C#N)CC3)cc2)cn1 594925958 QKIDFRQLZLIRDK-UHFFFAOYSA-N 399.494 5.118 30 20 GKED Cc1cc(C)cc(Oc2cccc(F)c2NC(=O)N2CCC[C@@H](CC#N)C2)c1 596949354 XUXIRTDBWLLSPA-KRWDZBQOSA-N 381.451 5.392 30 20 GKED N#CC1(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)CCCCC1 608903076 YIOKCWXMPQGUSF-UHFFFAOYSA-N 383.492 5.163 30 20 GKED N#CC1(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)CCCCC1 608948005 PDENOIAAKGGQLI-UHFFFAOYSA-N 378.863 5.296 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1CCCC[C@@H]1C 609078723 KRUCOMDZOHKSGG-HRAATJIYSA-N 377.488 5.146 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2sccc2C2CC2)cc1Cl 609152192 MNSKRPFLLWDSAM-IBGZPJMESA-N 392.911 6.187 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccccc1S[C@@H](C)CC#N 609430388 UPAQKTWLRAXNPL-AWEZNQCLSA-N 376.485 5.032 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCC[C@H]1c1ccccc1 609546881 UTXSRPDRHZJFSJ-GOTSBHOMSA-N 375.516 5.062 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc2cc(Cl)ccc2s1 613402493 BTFNOJPDYURIGQ-ZDUSSCGKSA-N 396.830 5.839 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1-c1ccc(F)cc1 647378240 HARAMWQLFLJJDL-INIZCTEOSA-N 382.485 5.687 30 20 GKED CC(C)c1ncsc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 651606968 VQVFMSBHGPAVAX-SNVBAGLBSA-N 395.431 5.385 30 20 GKED CCOc1cccc(C=Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1O 728173857 BBKRHOQDKUQMTN-UHFFFAOYSA-N 390.414 5.131 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1 728439716 DYJBQYQEKYPAKO-MDZDMXLPSA-N 397.525 5.298 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc(SC(C)C)cc2)cc1OC 728440976 BHUYECKWSJBQPN-GHXNOFRVSA-N 386.513 5.499 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)c(Cl)cc1Cl)c1c(Cl)cccc1Cl 730092825 QWCCXXAYFMZQAL-CYBMUJFWSA-N 392.044 5.434 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C/c1ccccc1OC(F)(F)F 731014786 KHPMGOASYLKAKH-ZHACJKMWSA-N 392.402 5.243 30 20 GKED C=CC[C@@H](NCc1ccc(OCc2ccc(F)cc2)c(OC)c1)c1ccncc1 734509653 NWGHNAKHWZQVRQ-JOCHJYFZSA-N 392.474 5.215 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cccc(Cl)c2Cl)cc1OC 734980819 LKRNOHWADSLCIW-CMDGGOBGSA-N 381.255 5.305 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738893987 CNANUUUEWNYYMH-DHIUTWEWSA-N 384.483 5.352 30 20 GKED CS[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 740535276 LUKZVNQIICNWKJ-PXNSSMCTSA-N 378.522 5.399 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1cc(Cl)ccc1OC1CCCC1 742430603 ANMFKMHHVLVASX-PDGQHHTCSA-N 390.936 5.164 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 742592267 NSCDWZODHXGPSX-UHFFFAOYSA-N 394.515 5.213 30 20 GKED CC[C@H](Oc1ccccc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 748294550 GEWCNGIVYQYQDB-UNMCSNQZSA-N 388.442 5.277 30 20 GKED CCCc1c(N[C@H](C)c2ccc(OCC#N)cc2)cnn1-c1cccc(F)c1 753769696 POHMWKBSFLQRML-MRXNPFEDSA-N 378.451 5.039 30 20 GKED Cc1oc2ccccc2c1C=Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O 758099464 KQGXGSSCFUSFGL-UHFFFAOYSA-N 399.475 5.370 30 20 GKED Cc1nnc(SCc2cc(Cl)ccc2OCC#N)n1[C@H]1CCC[C@H](C)C1 758168622 JMVRAJAJCLJUSL-GUYCJALGSA-N 390.940 5.186 30 20 GKED C=CCC(CC=C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 758510674 WLSHTSGZXFCBRU-HNNXBMFYSA-N 391.323 6.062 30 20 GKED N#Cc1cnc(NC(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)s1 759132620 CAWFBULKULCXCX-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 764775400 VOUFGVQSUXKGNS-OJLVUWQFSA-N 393.371 5.259 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)NCc2ccc(C#N)cn2)cc1 782049835 KXZCERQRDCILCU-INIZCTEOSA-N 388.496 5.128 30 20 GKED C#CCC1(C(=O)N2CCc3sc(-c4csc(C)n4)cc3C2)CCCCC1 788526318 RMZGDMIBSAWKLJ-UHFFFAOYSA-N 384.570 5.039 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cnc3ccccc3c2)cc1 796630243 OTTMIOAKQUREBI-VGSWGCGISA-N 399.494 5.028 30 20 GKED CC1CCC(OCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CC1 796651637 QVNUNYPYPIJINW-UXUKBGGZSA-N 396.434 5.087 30 20 GKED CC1(C)CC(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 796796250 CNPCTMGTAUAWIF-ZDUSSCGKSA-N 379.312 5.729 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1OC(=O)C[C@@H](CC#N)c1ccccc1 796804273 AHXONTVEJIXAGN-GOSISDBHSA-N 394.471 5.335 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCCCC(=O)c2ccc(F)cc2)s1 797568740 VQDLKIQQJJEHFG-INIZCTEOSA-N 386.492 5.199 30 20 GKED O=C1/C(=C/c2ccc(SC(F)(F)F)cc2)C[C@H](C(=O)O)c2ccccc21 806561214 SHCDJOBSUPACSJ-YHVDPYDOSA-N 378.371 5.137 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1cc(Cl)sc1Cl 810236003 YEBMDVBMIZJGMP-PLNGDYQASA-N 394.201 5.452 30 20 GKED COc1ccc(CCCCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813213166 JKGGELMJYVKKMA-GOSISDBHSA-N 390.405 5.088 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842939133 OPQKNFKTAZDYIR-ZDUSSCGKSA-N 395.311 5.363 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)o2)cc1 915087085 PKERCUKGZRRMLM-JOCHJYFZSA-N 396.421 5.993 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)s1 915353592 PFHXRJRGOOUGIO-AOMKIAJQSA-N 389.524 5.903 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)c2c1 916157521 NOUPKJQIEWNOLC-UHFFFAOYSA-N 399.406 5.061 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2c(Cl)nc3sccn23)cc1 917560266 KJBOVTGRBBRYDV-VOTSOKGWSA-N 379.268 5.077 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2cccc(OCc3ccccc3F)c2)c1 920065030 FASLMRWWHFITFR-SEYXRHQNSA-N 389.426 5.259 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2c(Cl)cccc2s1 920106001 QSCVKZUERWMUKY-AWEZNQCLSA-N 392.867 5.550 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c(C)c1 920804056 JQBHUIYLPYFVPA-INIZCTEOSA-N 396.462 5.514 30 20 GKED O=C(O)c1cc(-c2ccc(C=NNc3ccc(-c4ccccc4)cc3)o2)ccc1O 1776059603 AOUOJLYYLSRMFI-UHFFFAOYSA-N 398.418 5.463 30 20 GKED Cc1ccc(C(=O)/C=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)c(C)c1 1776133157 OTRVLEJRXSCWEV-ZRDIBKRKSA-N 386.447 5.477 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2c(Cl)ccc(Cl)c2Cl)c1)C(=O)O 1776470865 ZBIRSCIFCUXKRX-YVFTVSHDSA-N 399.657 5.395 30 20 GKED C[C@H](Oc1cccc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)c1)C(=O)O 1776472012 UCMKNDJREHMADZ-FKVCUQLRSA-N 397.279 5.119 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3C(=O)O)c2)s1 1776965939 IPKJYKYLVAXOHV-BENRWUELSA-N 392.476 5.484 30 20 GKED COc1c(C)cc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1Cl 1777252747 MSLUIUNZEHRPQC-HWKANZROSA-N 386.856 5.466 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCOc4ccc(F)cc4C3=O)s2)c1 1777684306 KUVUXBLOKIWDHA-SDNWHVSQSA-N 394.423 5.301 30 20 GKED COc1ccc([C@H]2C[C@@H]2/C(=N/c2ccsc2C(=O)O)c2ccccc2)cc1 1857777176 MVMWXAVSPAGSHI-OLRZEJHZSA-N 377.465 5.379 30 20 GKED Cc1cc(C)c(NC(=O)CN(C)Cc2ccc(-c3ccccc3C#N)cc2)c(C)c1 14855802 WJAMZBNQEVGKPF-UHFFFAOYSA-N 397.522 5.221 30 20 GKED COc1cc(C(=O)Nc2ccc(CC#N)cc2)cc(Cl)c1OCCC(C)C 15030191 LGYWQFLXTCXTOK-UHFFFAOYSA-N 386.879 5.092 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cc(C)ccc2C)cs1 54897335 GFBWQXIPUUFJLO-DHZHZOJOSA-N 394.471 5.480 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66956276 UBEANTZHFSPFAP-CVEARBPZSA-N 393.512 6.052 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1cc(F)ccc1F)c1ccccc1)c1ccccn1 106983675 HRORRMVBVLYFLU-HRAATJIYSA-N 380.419 5.070 30 20 GKED Cc1ncc(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 112484200 SITRRMNLEPANSL-LQYUOIDQSA-N 385.901 5.118 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(OC(F)(F)F)cc2)c1 113952505 SVYDTIFCYNKEHT-WMLDXEAASA-N 378.394 5.117 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 114098325 AJSMHDSPHIJARU-AWEZNQCLSA-N 393.874 5.153 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)c3cccs3)n2)cc1 115908994 POBLGWJSUCDQQG-OAHLLOKOSA-N 382.510 5.034 30 20 GKED CCO[C@@H](C)c1nc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)cs1 117132892 IXQLAZGCINKUIR-ZDUSSCGKSA-N 397.525 5.022 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC/C=C/c3ccccc3)n2)cc1 122018431 JEFFLBAVOGNITF-BFSLETRISA-N 383.476 5.352 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc(Cc2ccccc2)s1 150920214 HSXVMHGEUCGXMJ-HNNXBMFYSA-N 393.537 5.238 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N(C)Cc2cccc(C#N)c2)c1 151733601 DRTNLHUOKUYEAS-UHFFFAOYSA-N 393.434 5.185 30 20 GKED CC(C)[C@H](Sc1cccc(C#N)c1)C(=O)Nc1ccccc1C(F)(F)F 158685136 MNXQNWNWBUTIDD-KRWDZBQOSA-N 378.419 5.332 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1ccc(F)cc1 170986139 WCBLYLQITSIGNP-LSDHHAIUSA-N 388.533 5.510 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccccc3SC[C@@H](C)C#N)c2c1 174713111 WLBIGRXARKEHDP-INIZCTEOSA-N 377.513 5.299 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cccc(SCC#N)c1 175686045 YQRMTAKXSUVJQE-AWEZNQCLSA-N 393.537 5.225 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N(C2CCCC2)C2CC2)cc1 175752821 XKWCQANPRVUXAX-UHFFFAOYSA-N 389.499 5.271 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccn3C3CCCC3)n2)cc1 181489424 NFAFJVIBGOQWBA-SFHVURJKSA-N 386.480 5.088 30 20 GKED C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccco1)c1cccc(C#N)c1 189858901 WIQWJAJNTWGEDP-AWEZNQCLSA-N 392.509 5.373 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC(c3ccncc3)CC2)cc1 192291856 USPIBJMYXOXEOX-UHFFFAOYSA-N 399.519 5.124 30 20 GKED Cc1ccc(OC2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2)cc1C 193568176 MOSAIULJBZZAQZ-UHFFFAOYSA-N 391.515 5.180 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)/C=C(/C)c1ccc(C(F)(F)F)cc1 216189882 FCIFJAXHLYLEPP-VBKFSLOCSA-N 384.401 5.195 30 20 GKED Cc1cccc(-c2nc3ccc(F)cc3n2C(C)C)c1NC(=O)CCCC#N 291489604 MFICFBNEAWVVST-UHFFFAOYSA-N 378.451 5.364 30 20 GKED Cc1cccc2c(C/C(O)=N/[C@H]3CCCc4cn(C5CCCC5)nc43)c[nH]c12 329481106 DICGAGKMHLLAII-FQEVSTJZSA-N 376.504 5.365 30 20 GKED C[C@H]1CC[C@H](/N=C(\O)C2(C/C(O)=N\[C@H]3CC[C@H](C)CC3)CCOCC2)CC1 330211804 DHOGPXHLSSOOKK-VVPTUSLJSA-N 378.557 5.244 30 20 GKED C=CCCc1ccccc1NC(=O)c1scc(C)c1I 410348892 CHFLUGLQHHNHFI-UHFFFAOYSA-N 397.281 5.032 30 20 GKED Cn1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2OC3)c1C1CCC1 410990834 XGRPJTDDTIKPFE-UHFFFAOYSA-N 389.480 5.037 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCSc2ccc(F)cc21)c1ccccc1 431769463 IMWQMYNLBDFHSC-OALUTQOASA-N 383.492 5.097 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 431845861 PXMDUCWCDMQIEU-RTBURBONSA-N 383.492 5.097 30 20 GKED N#Cc1ccc(Br)c(CSCc2ncccc2C(F)(F)F)c1 432245893 KMOOYYLZSMIDBV-UHFFFAOYSA-N 387.224 5.168 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)N[C@@H](c1cc(F)ccc1F)C(F)F 433081565 GKWXCRIDIMTNIS-AWEZNQCLSA-N 394.290 5.198 30 20 GKED CC(C)c1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cn1 435057294 JUMSRIPGRLGDRK-UHFFFAOYSA-N 385.467 5.102 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1 435100271 DVKLOMHFJIMIHV-JTSKRJEESA-N 391.515 5.103 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)c1C 437853011 WBFWSOGTZYZHBJ-OAQYLSRUSA-N 377.488 5.331 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC(C(C)C)CC1 437977151 JGIDFUJPCCUOEG-UHFFFAOYSA-N 391.515 5.346 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)SCc2ccc(C#N)cc2OC(F)F)c(C)c1 439543073 QNLFTIOLZKBION-CQSZACIVSA-N 390.455 5.037 30 20 GKED C=C[C@H](CC(=O)N(Cc1ncc[nH]1)c1cc(C)ccc1Cl)c1ccccc1 440881119 OIESNXKYYKBEIW-QGZVFWFLSA-N 379.891 5.265 30 20 GKED CC(C)Oc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(Cl)c1 445037498 GWORBMHFEFORSC-UHFFFAOYSA-N 387.867 5.454 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)c1cccc(C2CC2)c1 451113859 JWOCLBRPFSUVDG-IRXDYDNUSA-N 393.556 5.248 30 20 GKED COc1cccc([C@H]2C[C@H](NC(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 454764291 PHVZVTNYOFVXBU-SZMVWBNQSA-N 395.528 5.157 30 20 GKED C[C@H](c1ccc(C(=O)N(CCC(F)(F)F)CC(F)(F)F)cc1)C(F)(F)F 456036682 WYIWNSFZQYHFOP-SECBINFHSA-N 395.265 5.309 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(OCC(F)(F)F)cc1 462221484 JADCKGBXOYUNFV-UHFFFAOYSA-N 399.372 5.299 30 20 GKED CC[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 464108530 DORJTNBLGZYZKM-CQSZACIVSA-N 384.888 5.410 30 20 GKED CN(CCc1cccs1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 464353770 RFEAODMFHLJBLH-UHFFFAOYSA-N 396.899 5.380 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCCC(F)(F)F)cc2Cl)cc1 466447678 CUMOLYMPDFGEAE-UHFFFAOYSA-N 383.757 5.078 30 20 GKED C=CCCN(C)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 468198104 CDRCFWVMCJRLGT-HHUWHTLVSA-N 397.403 5.143 30 20 GKED COc1ccc(C#N)cc1N[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471384363 YKQJMSUUYZPQBD-JTQLQIEISA-N 389.242 5.097 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477515101 ZOHOGWDPQJMZRC-ZDUSSCGKSA-N 390.314 6.019 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CC(C)(C)C(F)(F)F 479801501 WBLSRGRHLOUYSM-UHFFFAOYSA-N 376.378 5.576 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(C(F)F)c1Cl 480164145 UKTRFELMUCGPQD-UHFFFAOYSA-N 396.869 5.665 30 20 GKED C=CCCCC(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 480561937 ZOLIWNQTZPBKFJ-IBGZPJMESA-N 387.405 5.144 30 20 GKED C=C(C)CN1CCC(N[C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 482645715 IEXIJDKTRGAKKZ-HNNXBMFYSA-N 389.996 5.463 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1 486239214 IZUAYZJNFZJECX-UHFFFAOYSA-N 378.375 5.377 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1CC 489090021 TZWPBXSQDGGYHR-HNNXBMFYSA-N 392.425 5.026 30 20 GKED Cc1ccc(NC(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)c(Cl)c1 499516601 JODYFOCSXJCGCT-UHFFFAOYSA-N 384.810 5.270 30 20 GKED N#CC1(CCCN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)CCOCC1 499603034 QIEXQFHFEWWIOJ-JOCHJYFZSA-N 382.935 5.314 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1ccccc1SC 504021626 DQRVGTCHXWRHMK-KRWDZBQOSA-N 386.565 5.035 30 20 GKED CCOc1cc(C#N)ccc1OCc1csc(Cc2ccc(Cl)cc2)n1 506784933 VMWANNQLUIMGSY-UHFFFAOYSA-N 384.888 5.237 30 20 GKED C[C@H]1C[C@H]1c1ccc(CN(C(=O)Nc2cc(C#N)cn2C(C)(C)C)C2CC2)o1 508053277 JRJAXJFKBDMRIK-KBXCAEBGSA-N 380.492 5.028 30 20 GKED C[C@@H](NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1)c1cccc2ccccc12 509394605 ZQZLRHCHRJDICP-GOSISDBHSA-N 399.494 5.025 30 20 GKED Cc1nn(-c2ccccc2)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 510867251 OIZWQJIWNHBAJS-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1ccc(NC(=O)N(C)Cc2cccc(C#N)c2)c(OCc2ccccc2)c1 511454440 CGXDARPAPIAKAX-UHFFFAOYSA-N 385.467 5.110 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CSc3ccccc32)sc2c1-c1ccccc1CC2 522816209 WUVPJUGUBGFUSK-QGZVFWFLSA-N 388.517 5.213 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 524830331 QKGAZRDEBVIWFR-UHFFFAOYSA-N 395.478 5.486 30 20 GKED C=CCN(C(=O)c1ccc(-c2noc(CC(C)(C)C)n2)cc1)c1ccccc1 525532525 SCYZYVBXUFMDJM-UHFFFAOYSA-N 375.472 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC([C@](C)(O)C(F)(F)F)CC1 530447246 FYTGTVWNQXPWLM-FQEVSTJZSA-N 398.469 5.096 30 20 GKED Cc1cccc(N(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)C(C)C)c1 532683354 UFQDNZRAIHERNT-SFHVURJKSA-N 381.545 5.243 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1)C1CC1 533598382 ZRVDUTZGEVCHIE-IAGOWNOFSA-N 379.529 5.696 30 20 GKED COc1cc([C@H](C)NCc2ccccc2C(C)(C)C#N)ccc1OC1CCCC1 538151100 OEDQHMUEMCXVMC-SFHVURJKSA-N 392.543 5.669 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(-c3ccc(Br)s3)s2)CC1 543014227 AHUFHTYRXAHMJN-UHFFFAOYSA-N 395.347 5.005 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cncnc3-c3ccccc3)c2)cc1 543091819 SYDSYLXORUWFGH-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccc4cc[nH]c4c3)no2)c2ccccc21 544218782 NOXHACWRCZCELX-CMDGGOBGSA-N 379.423 5.257 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 554444697 OXEXMWJUOSKDPR-HSZRJFAPSA-N 399.494 5.105 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@H](c4cccc(F)c4)C3)c2)cc1 560663211 GWTYODQJVCKDFJ-FQEVSTJZSA-N 386.426 5.119 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc(C#N)c([N+](=O)[O-])c3)s2)cc1 570982006 IQSUQGWBZSNTJG-GFCCVEGCSA-N 394.456 5.080 30 20 GKED CCN(CC)Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 577516215 OYMPIBZIKITAEQ-KRWDZBQOSA-N 397.931 5.282 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 590253142 SZFVSCUUWLWIPM-NEPJUHHUSA-N 391.286 5.606 30 20 GKED Cc1sc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)c(C#N)c1C 590613362 PDNRVNPQSAOUCD-UHFFFAOYSA-N 385.876 5.116 30 20 GKED N#CC1(c2ccc(CNCc3cccc(COCc4ccccc4)c3)cc2)CC1 594925552 NWEKQRCZCHHHEL-UHFFFAOYSA-N 382.507 5.248 30 20 GKED Cc1ccc(-c2noc(CC3(C#N)CCOCC3)n2)c(Sc2ccccc2)c1 596593423 XAGDEISYVCSHQM-UHFFFAOYSA-N 391.496 5.059 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)N2CCC[C@H](CC#N)C2)cc1 596641047 BBRDNJTULJHJPX-OAHLLOKOSA-N 399.878 5.298 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)C1 596780281 DIXKBLSNOCGGJT-OAHLLOKOSA-N 385.920 5.649 30 20 GKED CC(C)(C)c1cc(NC(=O)N(CCC#N)Cc2ccco2)c2ncccc2c1 599901169 XLRBFQNGRPZXRO-UHFFFAOYSA-N 376.460 5.073 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(Cl)c4cccnc34)n2)cc1 603557686 USQLCXFEIGTJPD-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1 605919205 VNWRBBPVAOZKLB-UHFFFAOYSA-N 390.281 5.066 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 609371378 IRUSJSSJEOCPFP-CABCVRRESA-N 388.533 5.653 30 20 GKED CC(C)n1cc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cn1 609572978 IDYXNLYKORFFSF-MRXNPFEDSA-N 389.459 5.011 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609722878 COWBSDMFCUZLTP-AWEZNQCLSA-N 380.831 5.430 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)C2)c1 612299015 NAPKPVFWPFMERI-HXUWFJFHSA-N 398.466 5.075 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)cs2)cc1 647376904 BEZGJSMGOADAAE-OAHLLOKOSA-N 395.509 5.033 30 20 GKED N#C[C@@H](C(=O)c1ccnc(OC2CCCCC2)c1)c1nc2cc(F)ccc2s1 678572219 IYGXDHIBIHEQNW-INIZCTEOSA-N 395.459 5.032 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)C1CCCCC1 726322286 UGAIZYXKUXJYCO-IUODEOHRSA-N 381.303 5.247 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 726465784 LUKTZWWZPVSCHJ-IBGZPJMESA-N 382.941 5.459 30 20 GKED C#CC[C@@H](OC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1ccccn1 727776072 RHYKOVZJJNQRGI-MLGOLLRUSA-N 380.296 5.177 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)cc1 728698393 JCGKENNGKYGNJW-KUCQQTCKSA-N 377.440 5.741 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 739155775 VQGPBTIVIYTXFJ-JTSKRJEESA-N 384.479 5.243 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)OC(=O)CCc1ccc(C#N)cc1 739299126 BPWHRGPWWSUYNZ-HNNXBMFYSA-N 394.471 5.366 30 20 GKED Cc1cccn2c(/C=C/C(=O)c3ccc(SCC(F)(F)F)cc3)cnc12 741841285 FHLOPOHNKIGCLM-RMKNXTFCSA-N 376.403 5.193 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1c(Cl)nc2sccn12 741844533 QISXVTZSYLELQM-AATRIKPKSA-N 389.864 5.208 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Cl)c1SC(F)F)c1cccc(C#N)c1 743136856 XANCBQCDSXWVMW-SNVBAGLBSA-N 381.835 5.409 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)C1CCC(c2ccccc2)CC1 744016065 IKUXZWJWXNCTOY-GRERDSQWSA-N 384.479 5.342 30 20 GKED O=C(/C=C/c1cccc(OCC(F)(F)F)c1)c1ccc(-c2ccncc2)cc1 745990208 NQDFXIRFTMSOBO-RUDMXATFSA-N 383.369 5.586 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747198480 XNEYPZRCVIJQRG-SFHVURJKSA-N 382.529 5.448 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 758983241 GARNTOKMDVTDNS-HNNXBMFYSA-N 384.451 5.471 30 20 GKED CCOCCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CCCC1 763475776 INOUHAXSGWLMPA-SFHVURJKSA-N 382.529 5.282 30 20 GKED O=C(CC/C=C\c1ccccc1)OCC(F)(F)C(F)(F)C(F)(F)C(F)F 764751936 IXIHJJJHORLWBT-YWEYNIOJSA-N 390.270 5.194 30 20 GKED CCCCCCCCC(=O)N1CCC(O)(c2ccccc2C(F)(F)F)CC1 765091970 DNRLWYSRCBYFPC-UHFFFAOYSA-N 385.470 5.266 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 775144530 WCKWFXURXXLRRC-SFTDATJTSA-N 392.628 5.260 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc1Cl 797567982 NBPJRIASCAFUPI-TZMCWYRMSA-N 376.909 5.046 30 20 GKED CC(=NNc1nnc(-c2ccccc2)s1)c1sc(-c2ccccc2)nc1C 814947225 HQQDLYVQPZNUQJ-UHFFFAOYSA-N 391.525 5.473 30 20 GKED C=CCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCOCC1 819944509 ALPIULGEGIURBZ-MRXNPFEDSA-N 386.904 5.013 30 20 GKED C[C@]1(c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)CCCO1 854041847 HLPNVOWIJBLBIX-CYBMUJFWSA-N 398.278 5.052 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cscc1C(F)F 888129260 AKRYBGFSMZBLCC-JIGDXULJSA-N 395.315 5.325 30 20 GKED Cc1sc(NC(=O)Cc2csc(-c3ccc(C(C)C)cc3)n2)c(C#N)c1C 893225224 GNVRHGOJEBKXMB-UHFFFAOYSA-N 395.553 5.665 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1sc2nccc(C)c2c1C 914716772 RUTQDUYKIGRTFM-UHFFFAOYSA-N 386.860 5.056 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2ccccc12 915087536 UYCRNGDKTHZYKY-XMMPIXPASA-N 392.458 5.756 30 20 GKED COc1ccc2nc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)ccc2c1 915179260 BSVQECXMGJKYCD-JOCHJYFZSA-N 393.446 5.151 30 20 GKED CC(=NOCc1cc(-c2ccc(C)cc2)no1)c1nc2ccccc2n1C(F)F 915218664 CUXRYPQTFSXVMM-UHFFFAOYSA-N 396.397 5.336 30 20 GKED COc1ccc(-n2c(C)cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2C)cc1 916848103 BAWSNSFTENCYGQ-JOCHJYFZSA-N 395.462 5.141 30 20 GKED N#C[C@H](C(=O)CSc1cc(Cl)ccc1Cl)c1ccc2ccccc2n1 916849568 UVQDBMXOCDZNCN-AWEZNQCLSA-N 387.291 5.510 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc2ccccc2n1C(F)F 917041893 ZUMZTNMENRWQEQ-IBGZPJMESA-N 399.400 5.493 30 20 GKED CCCc1ccc([C@H](NC(=O)c2ccccc2OCC#N)c2cccs2)cc1 919987409 DFHRFQOBPUJEMW-QFIPXVFZSA-N 390.508 5.122 30 20 GKED COc1cc(C)ccc1Oc1ccccc1C=NNc1ccc(C(=O)O)c(F)c1 1776076387 LTUJTGHPGRDWER-UHFFFAOYSA-N 394.402 5.079 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3cccc(Cl)c3Cl)s2)c1 1776080974 PCZWQVIHDRYDTK-UHFFFAOYSA-N 391.279 5.866 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2OC)cc1 1776125692 QFIUABXEQBKMIV-UVTDQMKNSA-N 396.483 5.639 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2cccc(C(=O)O)c2F)c2c(c1)C(C)(C)CC2 1776269226 JUQFVXYEIHCVMY-MDZDMXLPSA-N 394.486 5.941 30 20 GKED COc1c(C)cc(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)cc1Cl 1777252733 JRXYFVIOTWGHTI-CMDGGOBGSA-N 395.842 5.108 30 20 GKED O=C(O)c1cncc(C(=O)/C=C/c2ccccc2OCCC2CCCCC2)c1 1777694976 MZCZJVFBCFTJTM-ZHACJKMWSA-N 379.456 5.025 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccccc1 4362043 KSDJUUGHFNPBAA-QGZVFWFLSA-N 377.513 5.111 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc(O)c3cc(-c4ccccc4)sc3n2)cc1 7135564 QDAPUZOTYVSHIQ-YVLHZVERSA-N 389.867 5.672 30 20 GKED N#Cc1ccc(F)c(CSc2nnc(-c3ccccc3)c(-c3ccccc3)n2)c1 11235839 IFIOSWGENDUUEN-UHFFFAOYSA-N 398.466 5.509 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)sc2C)cc1 25437900 OMNUOZYFPNJZNR-UHFFFAOYSA-N 390.508 5.786 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F 44368708 YAYVTEGLUGKXJS-UHFFFAOYSA-N 383.439 5.053 30 20 GKED C[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 48161848 QGFBCHOMDHCNOG-YLJYHZDGSA-N 377.488 5.032 30 20 GKED CCc1ccsc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 56102409 CNCDKADTHBLDJN-UHFFFAOYSA-N 376.481 5.208 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66800472 RAIVMGMQHGMWJX-LBPRGKRZSA-N 383.498 5.358 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)c1 67319463 IMXKSAWEKALIQS-QGZVFWFLSA-N 391.471 5.194 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@@H]2C[C@@H]2c2ccccc2)cc1 67583165 ZNZCMDXGDNBYJU-ISKFKSNPSA-N 397.478 5.009 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccccc1C#N 102830903 JKWKIENIRBDANM-CYBMUJFWSA-N 397.887 5.127 30 20 GKED COc1ccc2c(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)coc2c1 120012470 JGYDIECKZYQJFF-OAHLLOKOSA-N 396.855 5.123 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)cc1 124442698 LVEYLMHLBTXRDX-NRFANRHFSA-N 393.446 5.052 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ncc(C(C)(C)C)o1 130319063 FAWJLTWPANFEKJ-CYBMUJFWSA-N 389.546 5.097 30 20 GKED CC(C)Oc1ccccc1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 155493444 LRVHMDZPXIXGMJ-HNNXBMFYSA-N 384.888 5.156 30 20 GKED C[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)s1 173375268 UTJPQRDJDTULHU-LLVKDONJSA-N 377.307 5.054 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1OC(F)F 181575338 BLKPCRXQZGIVRI-CXAGYDPISA-N 396.384 5.585 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@@H](C)CCO 191450397 KZINUNHBMZTSIY-IBGZPJMESA-N 380.532 5.344 30 20 GKED COc1ccc2cc(/C=C\C(=O)c3ccc(OCc4nccn4C)cc3)ccc2c1 207054963 RPNGBUQZJZMAEE-QCDXTXTGSA-N 398.462 5.057 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1ccccc1F 215806764 LYKPKEOVSNIUSN-UHFFFAOYSA-N 398.488 5.279 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 246520047 UPSWLNLGVDXRGM-QTGUNEKASA-N 396.506 5.469 30 20 GKED O=C(C/N=C\c1cc(Cl)cc(Cl)c1O)Nc1cc(Cl)ccc1Cl 255362338 YAMXTYZWEBJBIT-IOXNKQMXSA-N 392.069 5.063 30 20 GKED Cc1ccccc1[C@@H](/N=C(/O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)C(C)(C)C 328713628 SBDSBOZSFKZYTC-WOIUINJBSA-N 392.547 5.050 30 20 GKED CC[C@H](CNC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)CC(F)(F)F 413417602 KWAHARJSKLRYLZ-GWCFXTLKSA-N 388.327 5.097 30 20 GKED CCC(=O)Nc1ccc(Cl)c(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 432421182 OIJAANGSRKBEBF-UHFFFAOYSA-N 397.887 5.336 30 20 GKED C[C@H](Nc1ccc(NC(=O)C2(c3cccc(C#N)c3)CC2)cc1)c1ccccc1 435676919 ZWLIHBACZCCNAT-SFHVURJKSA-N 381.479 5.402 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)c1ccc(C#N)cc1C 438824469 DSHPCQPPPIKLMZ-UHFFFAOYSA-N 398.441 5.120 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 441536921 YTCXUCMUHYGXNS-BEFAXECRSA-N 391.437 5.510 30 20 GKED C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1Cc1nnc(-c2cccc(C#N)c2)o1 446727273 BWBXFQVYBPGEKM-GFCCVEGCSA-N 399.281 5.034 30 20 GKED Cc1c(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)cccc1C(F)(F)F 464133889 VDYUITCNZKADLR-UHFFFAOYSA-N 383.238 5.563 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464463764 FXOXBWJBKRWJSF-QAPCUYQASA-N 397.400 5.196 30 20 GKED CCN(CCCSCC#N)Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 466732851 LBNQGDZTCHARGR-UHFFFAOYSA-N 382.451 5.434 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@]1(C)Cc1ccccc1 467340077 BYNOILXCSAKUFJ-WZONZLPQSA-N 393.556 5.567 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cccc(C(F)F)c2)cc1 468270013 JLNHYXKVFFMAPA-UHFFFAOYSA-N 378.378 5.469 30 20 GKED CN(Cc1csc2ccccc12)C(=O)c1cn(CCCC#N)c2ccccc12 469165696 ZHRZQVHJCVNOTA-UHFFFAOYSA-N 387.508 5.432 30 20 GKED C=CCc1ccc(OCC(=O)Nc2c(CCC)cccc2C(C)C)c(OC)c1 472691779 JSNYHUAWBFRFCY-UHFFFAOYSA-N 381.516 5.517 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc2[nH]ccc2c1 472975151 DDOLEVCXSDYLOD-UHFFFAOYSA-N 395.462 5.693 30 20 GKED CC(C)(C#N)CCCSc1nc(O)c2c(-c3ccc(F)cc3)csc2n1 476521995 ICRGSEXOHOSZCN-UHFFFAOYSA-N 387.505 5.625 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccccc1 477082064 AWBRZLIYLIMQPL-SCLBCKFNSA-N 398.787 5.286 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2Cl)cc1 479815826 QLNGBHVLUXQCOK-ZDUSSCGKSA-N 376.790 5.378 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)c2)C1 480354049 WTWTYHVWZYAQBK-PMAPCBKXSA-N 391.515 5.536 30 20 GKED N#Cc1cc(NC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)ccc1F 481619673 DSJKDVWVRLSSKT-GOSISDBHSA-N 385.851 5.323 30 20 GKED CN(Cc1ccccc1NC(=O)CSc1ccc(C#N)cc1)C1CCCCC1 482064674 IBGXOLAHFUXSOM-UHFFFAOYSA-N 393.556 5.054 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2nccc3ccccc23)s1 483237331 VMJMUTUYERDBJI-LJQANCHMSA-N 383.476 5.465 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccccn1 488901218 LUDNPZXGZGCHFY-MRXNPFEDSA-N 392.528 5.013 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCC3CC(F)(F)C3)cc2Cl)cc1 490815547 YNCXZGFXVNDXEM-UHFFFAOYSA-N 391.805 5.171 30 20 GKED CC[C@H](C)n1c(SCc2ccc(C#N)cc2OC)nnc1-c1ccccc1 499312937 ZACGLLYCRNAIIT-HNNXBMFYSA-N 378.501 5.089 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccsc2)cc1Cl 500225313 IFYLZOFKOYJPIU-SFHVURJKSA-N 381.888 5.379 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1oc2ccccc2c1C 500744177 NLWBXHQWZJLZHJ-UHFFFAOYSA-N 382.419 5.966 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)C1 508243832 SSBDGTFFNKVUKJ-MRXNPFEDSA-N 379.460 5.013 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)cc1 510457241 KUGGKBSAIHQSHP-SFHVURJKSA-N 385.467 5.253 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@H](C)c3ccc(C#N)cc3F)c2)cc1 512659452 HBKRNTJPTXGEHA-QGZVFWFLSA-N 387.458 5.109 30 20 GKED C=CCN(Cc1cccs1)C(=O)Cc1csc(-c2ccc(Cl)s2)n1 512957165 LUBBFGBCPFBTMB-UHFFFAOYSA-N 394.974 5.344 30 20 GKED CCN(Cc1cc(C)c(OCc2ccccc2C)c(C)c1)C(=O)C(C)(C)C#N 522337935 CEJUOHGVPPDVOV-UHFFFAOYSA-N 378.516 5.089 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 522434559 KORBSLXFGJFKDD-RXVVDRJESA-N 397.478 5.760 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1F 524387557 KSFPIRCZVBOIQH-UHFFFAOYSA-N 388.442 5.193 30 20 GKED C[C@H](CN(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccc1 524604537 SOTBWJDJLDPLGJ-QGZVFWFLSA-N 388.442 5.365 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)c2nc(Cc3ccc(Cl)cc3)no2)n1 525046362 XPGZIDQZCQTGKC-CYBMUJFWSA-N 384.892 5.051 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1)OCC 535966381 WVOLGVNNPOOUHM-QGZVFWFLSA-N 396.318 5.106 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccco1)c1ccccc1 536167396 LRIJCILVRQAWJS-OAHLLOKOSA-N 394.858 5.484 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)cc2)cc1 536305167 MJCLPQAHPKPMAF-UHFFFAOYSA-N 398.462 5.735 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 536513210 FJCVSJFXWFOSME-INIZCTEOSA-N 379.508 5.047 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc(C(F)(F)F)cc1 539051934 QCHXTNUWYSZEQR-ZDNGHDIGSA-N 395.490 5.801 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H](C)c2ccccc21 551707086 RMXVTWJEAAYUBH-SFHVURJKSA-N 397.478 5.601 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 561402843 MIKLCGIBXAQBBN-QHCPKHFHSA-N 398.466 5.423 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)[C@@H](C#N)CCc1ccccc1 563706600 HAYKSZYLGIUAJF-OAQYLSRUSA-N 375.516 5.087 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3CC(c4ccc(F)cc4)C3)cn2)cc1 589981282 BOYBUWLRCITFMW-UHFFFAOYSA-N 387.414 5.017 30 20 GKED C=CCOCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 591123042 XYDCAYRHZXOGBT-CRAIPNDOSA-N 394.902 5.059 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccncc1 596733817 KQIIYFGLFKCPBV-UZLBHIALSA-N 392.528 5.092 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 597074934 HEFYTTDCFMUQGT-VQIMIIECSA-N 387.405 5.318 30 20 GKED N#CCC[C@@H](N[C@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598677951 LSLRPOPBRZRHFT-IAGOWNOFSA-N 379.248 5.390 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)Oc1ccccc1 603533044 NUGQSXQJELFCCZ-SFHVURJKSA-N 388.442 5.007 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1 603925533 ZDUZPDMNAWUOAO-UHFFFAOYSA-N 394.858 5.068 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(Br)sc1Br 606814874 VSWVNYZPWDOCTI-UHFFFAOYSA-N 395.160 5.092 30 20 GKED CC(C)Oc1ncc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1Cl 609377930 KWSFTAWVGXDCCG-ZDUSSCGKSA-N 389.908 5.026 30 20 GKED C=CCN(C(=O)[C@H]1CCC[C@@H](C)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610169110 BCKYVJPFYUTWAH-ZBFHGGJFSA-N 385.489 5.064 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 611468854 MQBLEDWAFNSUSH-LJQANCHMSA-N 391.858 5.546 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 611803686 XQCGMJCYBMZITD-ZWKOTPCHSA-N 394.478 5.218 30 20 GKED C[C@@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 615939959 NUMGNISNYLFPKR-MUYACECFSA-N 399.350 5.345 30 20 GKED O=C(Nc1ccc(Cl)c(F)c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618543367 OYSWJKWVFCMTBF-YUMQZZPRSA-N 392.702 5.074 30 20 GKED C=CCN(C(=O)c1cc(Cl)ccc1OC)c1nc(-c2ccccc2)cs1 641900482 POASJRLFZJYYAD-UHFFFAOYSA-N 384.888 5.305 30 20 GKED C=CCC[C@H](NCc1nc(O)c2ccc(C(F)(F)F)cc2n1)c1ccccc1 678785366 AVNGUWLZJFABCH-KRWDZBQOSA-N 387.405 5.151 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 682099924 UOGPENSLJCRNMP-NSHDSACASA-N 392.290 5.439 30 20 GKED C=CCc1cc(/C=C(\Cl)c2nc3cc(F)ccc3n2CC)cc(OC)c1O 727267380 IZJZEYCBVQPIOD-YBEGLDIGSA-N 386.854 5.375 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)c3ccc(F)cc3)n2)cc1 728766754 JCMSYMVWAROIIY-SFHVURJKSA-N 378.472 5.412 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 733031121 NJTYEFDCXYYUTC-LOSJGSFVSA-N 397.522 6.203 30 20 GKED CCCCCCCCC(=O)N1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1 733763649 FRADZDONMDXYPY-UHFFFAOYSA-N 396.934 5.407 30 20 GKED C=CC[C@@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccncc1 734509254 JRKTXZAIXVBEHE-OAQYLSRUSA-N 388.471 5.165 30 20 GKED Cc1ccc(N(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1 735007032 JKVOMWFTLDKBKK-UHFFFAOYSA-N 376.843 5.589 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ncc(-c2ccc(F)cc2)o1 735319822 DXPLBQQEFAXFOS-UHFFFAOYSA-N 388.851 5.470 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)OC(=O)Cc3ccc(C#N)cc3)s2)cc1 739303525 RHGARJFVMQSSPT-MRXNPFEDSA-N 376.481 5.146 30 20 GKED N#CCC1(COC(=O)c2cccc(Oc3ccc(Cl)c(Cl)c3)n2)CC1 753557284 BMQLAIILCVXGCE-UHFFFAOYSA-N 377.227 5.031 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cncc(-c3ccccc3)c2)cc1 757875070 NGHWSPWHKNBMAS-GAJHUEQPSA-N 397.478 5.223 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CCC[C@H]2c2ccccc2)c1=S 764868744 ITJMMPDXIWYZAF-KRWDZBQOSA-N 382.558 5.123 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccccc2)C2CCOCC2)cc1 766023768 XURWENMULGUEGK-WZONZLPQSA-N 385.935 5.636 30 20 GKED N#Cc1cc(Cl)nc(NN=C2CCCc3nc(-c4ccccc4F)sc32)c1 768374912 MFEMNFKAQJZCDL-UHFFFAOYSA-N 397.866 5.022 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)CCc2ccc(Br)cc21 769616097 FAGLJRFEGOTZGN-UKTHLTGXSA-N 397.297 5.180 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(CC[C@H](O)c3ccccc3)c2)cc1 770557555 CYIRPCHVNZGEMA-DFBJGRDBSA-N 386.495 5.256 30 20 GKED C[C@@H](Nc1cccc(OCc2cccc(F)c2)c1)c1ccc(OCC#N)cc1 776856105 KBISPKMHQNLIRO-QGZVFWFLSA-N 376.431 5.480 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cn(Cc2ccccc2)c2ccccc12 779988829 JYDQCPXTIJFJQV-IBGZPJMESA-N 381.479 5.593 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 780314234 FTAGTQFXIFWFBP-IACUBPJLSA-N 396.434 5.087 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)O[C@H](C)c3cccc(C#N)c3)c12 780347013 IYYKVWLNCFSORN-CYBMUJFWSA-N 375.428 5.013 30 20 GKED O=C(/C(=C/c1scnc1C1CC1)c1nc2ccccc2s1)c1ccccc1 782303663 ZZMJXLVYHSFCAZ-VBKFSLOCSA-N 388.517 6.054 30 20 GKED N#C[C@H](C(=O)c1cc2cccc(Cl)c2o1)c1nc(-c2ccccc2)cs1 783070124 SNWNEKKYKCNZFF-CQSZACIVSA-N 378.840 5.700 30 20 GKED Oc1nc(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)nc2ccccc12 789023723 NMNFRPZCYUYQBJ-CQSZACIVSA-N 386.377 5.090 30 20 GKED C=CC[C@@H](N[C@@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccncc1 790679787 VUPQMZXTRYKRCZ-YVEFUNNKSA-N 399.254 5.831 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1nccc2ccccc12 792104932 SJCXBMHHYAMDBO-KURKYZTESA-N 381.262 5.522 30 20 GKED N#CC[C@H](Cc1nc(C(c2ccccc2)c2ccccc2)no1)c1ccccc1 795703672 HVRYNJLKEYQEMF-JOCHJYFZSA-N 379.463 5.490 30 20 GKED N#CCn1c(/C=C/c2nc3ccc(Br)cc3s2)nc2ccccc21 806562121 GJTBGWLSWDANAS-BQYQJAHWSA-N 395.285 5.102 30 20 GKED C#C[C@H](NC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccc(Cl)cc1 810170650 QWXRNZNFFJCBMI-IBGZPJMESA-N 379.847 5.108 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)OCCCC(C)(C)C#N)cs1 811307528 QUFCBLAEEPABAJ-UHFFFAOYSA-N 388.508 5.408 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1cc(C(F)(F)F)ccn1 813214393 WMAZUFLOFYWMCK-LJQANCHMSA-N 378.353 5.162 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813216791 ZCPOLFJQJQKHRA-SFHVURJKSA-N 396.368 5.093 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813218530 PZXFRUCCRWDBFQ-JBRJIWJGSA-N 388.389 5.167 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)Cc2ccccc2O1 814578356 YUHJXLYRZBGKEF-FDDCHVKYSA-N 397.478 5.157 30 20 GKED N#C[C@H](C(=O)C[C@@]12CCCC[C@H]1C2(F)F)c1nc2cc(Cl)ccc2s1 850771585 SVQBMPPRSRHZBH-JGFGOQIWSA-N 380.847 5.342 30 20 GKED CCO[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)C 860475937 WNDHKKVGYZDKHQ-SUMWQHHRSA-N 397.327 5.354 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc([C@H]2CCC(=O)N(CC3CCC3)C2)no1 904838576 YYXZBEBRNRWJGE-LEWJYISDSA-N 393.531 5.064 30 20 GKED CCOc1c(Cl)cc(/C=C/C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OC 916137372 ZLZVYBDVGPRYES-QPJJXVBHSA-N 396.226 5.205 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1C 917026604 JEJPUTCYYWGWDF-LJQANCHMSA-N 392.549 5.786 30 20 GKED C[C@H](Oc1ccc2c(c1)CCC2)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917045800 ABQQHRYFWCGWCR-YVEFUNNKSA-N 396.899 5.082 30 20 GKED CCOc1cc(/C=C\C(=O)c2[nH]c(-c3ccccc3)nc2C)cc(Cl)c1O 917145557 NQJSYHXEKSVULF-KTKRTIGZSA-N 382.847 5.039 30 20 GKED C=CCn1c(C)nn(CN2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1=S 917476346 DQNPTUZTJRPNMO-INIZCTEOSA-N 383.348 5.010 30 20 GKED Cc1c(NN=Cc2ccc(C(F)(F)F)c(Cl)c2Cl)cccc1C(=O)O 1776089101 BOQBZLZJPAJMKA-UHFFFAOYSA-N 391.176 5.465 30 20 GKED C=C(C)C[C@@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(Cl)c1)C(=O)O 1776137590 VNBSOPDVAFUVCC-QGZVFWFLSA-N 398.261 5.434 30 20 GKED C=CCCC[C@@H](NCc1cc(C)c(OCc2cccc(C)c2)c(C)c1)C(=O)O 1776174247 HLXOZBNTKXZMEH-JOCHJYFZSA-N 381.516 5.090 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCc2ccc(C)cc2)cc1 1776784808 ZFMMRCQNQJVMQE-HSZRJFAPSA-N 397.559 5.867 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)s1 1776966067 SVWPQBJBAPUBNU-YLQXFRFJSA-N 392.476 5.411 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1ccc(OCc2ccccc2C#N)cc1 32043048 DJQFLQOPAFRRSL-UHFFFAOYSA-N 396.899 5.124 30 20 GKED Cc1cc2cc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)ccc2[nH]1 47508146 WHSFRZMLJKVFMZ-UHFFFAOYSA-N 397.503 5.893 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1nc(-c2ccncc2)cs1 114619542 AAMOIFISUIWZBP-SFHVURJKSA-N 398.491 5.055 30 20 GKED Cc1ccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 115798395 XGOPDAGJLPTNBW-LJQANCHMSA-N 380.900 5.547 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F)c1nc2cc(Cl)ccc2s1 116593405 VGYAUVNNHQCQSC-QJPTWQEYSA-N 388.826 5.208 30 20 GKED CCS[C@H](C)c1noc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)n1 158252322 NTCGCVFJQQHDHR-CYBMUJFWSA-N 398.463 5.299 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(C(F)(F)F)CC3)cc2)cc1 175711528 CYXBHVZGKMQOAK-UHFFFAOYSA-N 389.377 5.157 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](Cc1ccccc1)c1cccs1 180033638 ADBHHWAPQXCAMC-VQIMIIECSA-N 391.496 5.144 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(Cl)cc2)C2CC2)ccc1OC 180175239 WZGVIOHLSCFMFU-KNQAVFIVSA-N 384.907 5.270 30 20 GKED Cc1cccc2c1OCC[C@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 189662017 HOPIAJREAIYXQM-NVXWUHKLSA-N 381.501 5.035 30 20 GKED C[C@H]1CCSCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 192090186 UCSBQOXTYIKECQ-KXBFYZLASA-N 399.947 5.355 30 20 GKED C[C@@H]1CCC[C@@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)[C@@H]1C 215992039 WQQVRIFZUMFFID-CBGDNZLLSA-N 378.541 5.405 30 20 GKED Cc1cncc(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 255581499 IEUNKXHMCANSEK-ZTSSLWBESA-N 379.872 5.057 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1CCC[C@@H](C)C1 303134614 CQYODKSKLFHLCW-UZLBHIALSA-N 377.488 5.146 30 20 GKED Cc1ccc(N=C(O)[C@@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c(C)c1 328712097 RPPZTIAUPDUKOC-VGSWGCGISA-N 391.515 5.377 30 20 GKED OC(=Nc1cccc(OC2CCCC2)c1)C1CCC(/N=C(/O)C2CCCC2)CC1 328772771 DNBBGMRPIYLFGW-UHFFFAOYSA-N 398.547 6.302 30 20 GKED N#CC1(/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CCN(Cc2ccccc2)CC1 329126290 YKPZUDZRTHBURT-FDFHNCONSA-N 379.548 5.108 30 20 GKED C[C@H](CC(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 413499315 DBBHAEJIONKGJH-SSDOTTSWSA-N 377.325 5.292 30 20 GKED C[C@H](NC(=O)Nc1ccc2cc[nH]c2c1)c1ccc(-c2cccc(C#N)c2)cc1 433639970 PLZXTPBYKHIBRB-INIZCTEOSA-N 380.451 5.589 30 20 GKED CCCN(CC(=O)Nc1ccccc1SCC#N)[C@@H](CC)c1ccccc1 434744328 HVMGJOAYTLIKPH-FQEVSTJZSA-N 381.545 5.104 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)Nc3ccc(OC(C)C)c(C#N)c3)c2)n1 435541575 ZRGDWENCMZOYSN-UHFFFAOYSA-N 390.443 5.261 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)cc1 439329548 PRBHCSJXLLVPIT-UHFFFAOYSA-N 399.897 5.634 30 20 GKED N#Cc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(Cl)c1 439453971 QQLFOGIGENRBOQ-OAHLLOKOSA-N 392.730 5.624 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 452142070 WOVGPWGHDFPSKL-NSHGMRRFSA-N 386.417 5.360 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc(F)cc(Cl)c2)cc1 464930568 GWRACWGFZMCXSX-UHFFFAOYSA-N 394.833 5.376 30 20 GKED C=C(C)C[C@H](C)C(=O)NCc1ccc(Cl)c(NC(=O)[C@@H](C)CC(=C)C)c1 466415470 GNRHLSGGCVLIDR-HOTGVXAUSA-N 376.928 5.099 30 20 GKED Cc1nc2c(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)cccc2o1 470971414 IYYZIQPMCZNDOI-UHFFFAOYSA-N 387.370 5.192 30 20 GKED CSc1cc(C(=O)N[C@](C)(C#N)CCc2ccccc2)c(Cl)cc1Cl 471270113 IGQUCRPCYZGADH-IBGZPJMESA-N 393.339 5.360 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccccc2C)CC1 475545987 IBLBKEIPIHAMQK-UHFFFAOYSA-N 377.532 5.201 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(OC2CCCCC2)CC1 475549099 DCHJZWUZYHRQIR-UHFFFAOYSA-N 384.564 5.884 30 20 GKED N#Cc1cccc(OCCCSCC(=O)Nc2ccc(Cl)cc2Cl)c1 477374022 ALRWLDRMLQZBKC-UHFFFAOYSA-N 395.311 5.006 30 20 GKED C=CCn1c(SCc2cc(-c3ccc(F)cc3)no2)nnc1-c1cccs1 481390072 CBYYBRKFXLUUIF-UHFFFAOYSA-N 398.488 5.279 30 20 GKED Cc1nc(NC(=O)[C@H](c2cccc(Cl)c2)C(C)C)sc1SCC#N 486036402 FOWJKZOUITWBQE-AWEZNQCLSA-N 379.938 5.099 30 20 GKED C=C[C@@H]1CCCCN1C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 488866071 LFRWQCPZSPIRDQ-RHSMWYFYSA-N 390.936 5.184 30 20 GKED C=CCCO[C@@H](C)C(=O)N(CC)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496453859 YMKYHFDBAGNTMP-CVDCTZTESA-N 380.532 5.124 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc(OC)c1 502592212 DHHGLBLUZFACIR-UHFFFAOYSA-N 389.411 5.012 30 20 GKED N#CCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(Cl)cc1)CCC2 503652372 BADAJYKKRGBAEH-JQIJEIRASA-N 387.870 5.018 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cc2ccccc2s1 504455239 DQBFSAKGRBPZSZ-INIZCTEOSA-N 377.513 5.454 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(CCC(F)(F)F)cc1 505578392 GXKAOCWTJMERBT-UHFFFAOYSA-N 375.394 5.127 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCc4cc(Cl)ccc43)ccc21 506218449 IOJVKZDUUXNYRO-FQEVSTJZSA-N 379.891 5.022 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3nccc4ccccc34)no2)c2ccccc21 507704489 CMTXZMQHLPLJQL-ZHACJKMWSA-N 391.434 5.324 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 509093827 NWLUIDVOIGDZNB-UHFFFAOYSA-N 382.529 5.095 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1Cl)Nc1cccc(C#N)c1 511907039 AEJWYGMSAKBIAI-NSHDSACASA-N 381.785 5.060 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cnn1C1CCCCC1 512736230 UBBFMWOINSHBJH-OAHLLOKOSA-N 398.919 5.450 30 20 GKED Cc1cc(C)c(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 518656370 RFSQEEFINVLQSH-INIZCTEOSA-N 398.597 5.736 30 20 GKED C=CCOc1ccc(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1OC 519430468 PLACKCLQMLTWSB-NRFANRHFSA-N 390.483 5.109 30 20 GKED CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)NCC(C)(C)CCC#N)nc1 520453952 MRGTWQNQUGNHOP-QFIPXVFZSA-N 383.967 5.371 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cnc(-c4ccccc4)nc3)c2)cc1 521497272 FXVGWSAYCPCCPK-UHFFFAOYSA-N 392.418 5.060 30 20 GKED C[C@@H](NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 522432404 MQRDXHIURBNCEX-GFCCVEGCSA-N 376.287 5.161 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1F 523456785 SOARXMSJRWPROI-SUMWQHHRSA-N 389.471 5.632 30 20 GKED C[C@H]1CCC[C@](C#N)(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 523970621 SMBISSGMKLNPGI-NYHFZMIOSA-N 393.874 5.206 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(F)c2)c2cccc(Br)c2)cc1 531836006 CFNLKKJAADAYTN-OAQYLSRUSA-N 395.275 5.339 30 20 GKED N#Cc1ccc(CC(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 536886968 SZJOOFCQBLFCSG-LJQANCHMSA-N 392.808 5.040 30 20 GKED C[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1Oc1ccccc1 538160247 VKGATFXOAFBMCU-KRWDZBQOSA-N 396.450 5.251 30 20 GKED C=CCCC[C@H](C)NC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 540538411 HXIZFLTXFJPGKY-AWEZNQCLSA-N 390.936 5.437 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)CC1 542902590 SKSYUQSHQRJAHN-UHFFFAOYSA-N 376.485 5.121 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 558805884 RHLGLTWMRYBQBZ-IRXDYDNUSA-N 394.540 5.662 30 20 GKED N#Cc1c(F)cccc1N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 561322891 BNHGOCYZXMBQRZ-IBGZPJMESA-N 378.369 5.296 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccccc1 562413276 IHJCBXLVLDDOLO-DYESRHJHSA-N 391.540 5.697 30 20 GKED CCSc1cccc(F)c1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 566650626 VHZSVNBZXZKACU-FUHWJXTLSA-N 383.492 5.241 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)C[C@@H]1CCCO[C@@H]1c1ccccc1 589499687 ZISSXLYYBZOJKQ-PZJWPPBQSA-N 388.433 5.177 30 20 GKED N#Cc1ccc(C2(NCc3coc(-c4ccc(C(F)(F)F)cc4)n3)CCC2)cc1 594033688 YAUIEZCZOIOOJB-UHFFFAOYSA-N 397.400 5.401 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1C(F)(F)F 597186151 FOHUITBYVLDKEG-GFCCVEGCSA-N 394.418 5.361 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 600203678 HCJSGHUWRVWNTA-IRXDYDNUSA-N 384.451 5.112 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cc(Cl)ccc2N2CCCCC2)cc1 604076707 KATCTRYHEAGQOH-UHFFFAOYSA-N 399.947 5.074 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)CNc1ccc(C#N)cc1 609073837 CHGDOUJPHFVDHK-SFHVURJKSA-N 385.467 5.057 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609080374 HRGFKCRBQDMBIM-GFCCVEGCSA-N 385.370 5.131 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CCC1 609378220 WGLUJDFKSXAIOS-OAHLLOKOSA-N 384.932 5.652 30 20 GKED CN(Cc1ccccc1Cl)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609640446 NIBBERBLPCRQQU-UHFFFAOYSA-N 390.870 5.063 30 20 GKED CCN(Cc1ccncc1)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609736569 MVCQLEOMTLZGMW-UHFFFAOYSA-N 391.858 5.061 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCCO1 609773407 AXTZFLXMAYEPEM-UHFFFAOYSA-N 399.878 5.037 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COc2cccc(F)c2)c1)c1cccc(C#N)c1 610318840 CSBCAIJMGHRKKV-MRXNPFEDSA-N 389.430 5.159 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 611480494 PSBFCVPJOYKORE-QFIPXVFZSA-N 391.490 5.706 30 20 GKED C[C@H](NCc1ncccc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 611983725 DYYROHIWSDOSPC-HNNXBMFYSA-N 381.401 5.490 30 20 GKED CN(C(=O)NCCCC#N)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 612380089 CFKFITWKCPJZEW-UHFFFAOYSA-N 376.287 5.028 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc(-c2ccccc2)cs1 613392499 QGZKZSHVMNSUHP-INIZCTEOSA-N 388.423 5.699 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cc(F)ccc2SCC(F)F)cc1Cl 619788811 CNMSOOSFMOAMEN-UHFFFAOYSA-N 399.825 5.030 30 20 GKED FC(F)(F)c1cc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ccn1 672161957 IFEDUYWWIDWVNN-YUMQZZPRSA-N 380.254 5.422 30 20 GKED CCN(Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1)C(C)C 672583880 FMMWCJWQHAUCAM-SFHVURJKSA-N 395.503 5.156 30 20 GKED CC(C)c1cccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)n1 675555992 FWGUSWQNAXWCFG-LBPRGKRZSA-N 389.402 5.324 30 20 GKED COc1cc([C@H](C)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1F 678113369 QHCGQEOOBFXBJF-MVWJERBFSA-N 387.339 5.394 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SCc1ccco1)c1cnc2ccccc2n1 682994913 LCKXKDIBHRMWHJ-QGZVFWFLSA-N 385.448 5.005 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCC#N)c2)sc1-c1cccc(Cl)c1 726502191 JJBFJJOZQMKVFZ-UHFFFAOYSA-N 382.872 5.532 30 20 GKED Cc1cccc(C2(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)CCCC2)c1 730416992 JNSDHSIZAKRVFE-KRWDZBQOSA-N 378.472 5.432 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCOc3ccccc32)cc1 731280665 SNKNAIIETQRLNA-REWPJTCUSA-N 397.478 5.030 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccccc2-c2ccccc2)ccc1OC 733330519 YMXOIVIZHFKUCA-JOCHJYFZSA-N 386.495 5.333 30 20 GKED CCCOc1ccc(C(C)=NNc2cnnc3ccccc23)cc1OCCC 733748132 INTQEWDFGXEJNP-UHFFFAOYSA-N 378.476 5.044 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(C)c(C(F)(F)F)c2)c1 733843668 TYCJMQCPKYRCBB-MRXNPFEDSA-N 391.393 5.017 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(C4SCCCS4)cc3)[nH]c12 735788052 BPLAUKNESBFJIV-INIZCTEOSA-N 393.537 5.230 30 20 GKED CC(=NNc1ccc(Br)nc1)c1ccc(SCC(F)F)cc1 741763374 KLTPVODJAXFCNJ-UHFFFAOYSA-N 386.265 5.037 30 20 GKED C=C(Cl)C[S@@](=O)Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 742440545 QZEARXTXQLZTDH-JOCHJYFZSA-N 375.704 5.787 30 20 GKED COc1ccc2cc(C(=O)/C=C/c3ccc(Oc4cnccn4)cc3)ccc2c1 743058168 GZQDBILLICWOEJ-NYYWCZLTSA-N 382.419 5.327 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)Cc1cccs1 743092972 IZDNYHUBSRKKDB-JTSKRJEESA-N 389.524 5.404 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2c2ccc(C)cc2)c1 745820135 HTSXKRCBHHHWDH-GGAORHGYSA-N 391.515 5.113 30 20 GKED FC(F)(F)c1ccc(CON=Cc2csc(COc3ccccc3)n2)cc1 746577553 WMQJNIQYVVKVAT-UHFFFAOYSA-N 392.402 5.292 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C\c2cccc(OC3CCCC3)c2)n1 747197353 YDFIKQMCVMFYBX-OEIFXAAASA-N 380.513 5.478 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1ccccc1C(C)(C)C#N 753908696 QLUHYWPREWZIBQ-UHFFFAOYSA-N 379.504 5.755 30 20 GKED CC(=NNc1cc(C(F)(F)F)ccc1F)c1sc(-c2cccnc2)nc1C 753945949 BQHRXNUUYFOTSC-UHFFFAOYSA-N 394.397 5.508 30 20 GKED CC(C)(C)c1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 763003801 BMOJXFJILBUNBT-FQEVSTJZSA-N 399.519 5.398 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@@H](C)c3ccc(Br)cc3)[nH]c12 770542289 MOEXHAJVXNQSRV-CJNGLKHVSA-N 396.288 5.004 30 20 GKED Cc1ccccc1-c1cc(C(=O)OCCC(C)(C)C#N)c2cnn(C(C)C)c2n1 776370036 AREAEHQTRFSNCO-UHFFFAOYSA-N 390.487 5.084 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 776781327 CLFDWYBUPBKJHP-JOCHJYFZSA-N 384.504 5.872 30 20 GKED C#CCCCCCC(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 779935322 FNSLGHAHJSAHDG-UHFFFAOYSA-N 382.331 5.085 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 789719415 PTENUWJAHWCORI-UHFFFAOYSA-N 394.515 6.138 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1C(F)(F)F 792095248 KDAVPYJAZMYBTE-KBXCAEBGSA-N 382.385 5.624 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@H](C#N)c3nccc4ccccc34)cs2)cc1 792100215 KXQHTWJAHYGBAP-FQEVSTJZSA-N 383.476 5.086 30 20 GKED Cc1cc(NC(=O)c2sc3ccc(C#N)cc3c2C)ccc1N1CCCC1 794181738 AGGCBEZEUWXCCS-UHFFFAOYSA-N 375.497 5.242 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](OC(C)C)c3ccccc3)n2)cc1 796766711 ZMVAESXTCICHFP-KNQAVFIVSA-N 390.508 5.461 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)o1 800907112 AIDXTBMSAFOUNO-UHFFFAOYSA-N 390.439 5.174 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@](F)(c3ccccc3)C2)cc1 801611035 AFXMMKCSUDQMPM-NOZRDPDXSA-N 399.469 5.445 30 20 GKED COCCCn1nccc1/C=C/C(=O)c1ccc(-c2ccccc2Cl)s1 802703936 GFKSIIAHCUFGDE-BQYQJAHWSA-N 386.904 5.198 30 20 GKED C[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCCC2=O)cc1 810262668 VJMZKRHBMFBJRJ-MHECFPHRSA-N 387.527 5.193 30 20 GKED CC(=NN(Cc1ccccc1)c1ccccc1)c1cnn(-c2ccccc2)c1C 818198547 VQBOBTKKJIYLDA-UHFFFAOYSA-N 380.495 5.612 30 20 GKED C#Cc1cccc(NC(=O)c2cc(-c3cc(C)oc3C)nc3c2cnn3C(C)C)c1 862633512 VYSFQDLAJLWAFW-UHFFFAOYSA-N 398.466 5.123 30 20 GKED Cc1nc(/C=C\c2cncn2C(C)C)sc1C(=O)/C=C\c1cncn1C(C)C 901457391 KHWSNNGJLJQLOQ-VRHVFUOLSA-N 395.532 5.073 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(SC(C)C)cc2)cc1 916949809 PVTQAFSSOVNUMF-KKSFZXQISA-N 394.540 5.662 30 20 GKED CCC1CC(=O)C(=CNc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C(=O)C1 920978589 LPYZTLFOYNUUJI-FUBQLUNQSA-N 392.886 5.249 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(SCC(F)(F)F)cc1 1776074219 ORFCOLOOGKWGGY-UHFFFAOYSA-N 386.370 5.014 30 20 GKED C[C@@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2c(O)ccc(F)c21 1776586862 ZDPOYEFVTHTHSA-MKVLZVNKSA-N 394.423 5.341 30 20 GKED COc1cccc(Oc2ccc(/C=C\C(=O)c3cc(C(=O)O)ccc3C)cc2)c1 1777382014 HVEZLGKUORCQLI-LCYFTJDESA-N 388.419 5.390 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@H]3CCC5)cc2)cc1 1777671068 YRYJXNDSYKBFFH-VQYZLWMVSA-N 380.443 5.752 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2ccc(F)c(F)c2)n(C2CCCC2)c1C 14073334 WUWOIBMAVJKYBW-UHFFFAOYSA-N 389.471 5.101 30 20 GKED Cc1c(C#N)c(SCC(=O)Nc2ccccc2-c2ccccc2)nc2c1CCC2 22121418 JTGZHEZCBZYPMC-UHFFFAOYSA-N 399.519 5.148 30 20 GKED Cc1ccc(-c2ccsc2C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)cc1 48828945 VTNWTBGMTNUPQN-MRXNPFEDSA-N 386.398 5.627 30 20 GKED N#Cc1c(NC(=O)c2cc3ccccc3c3cccnc23)sc2c1CCCC2 58185734 PIROMJZHHNNMIC-UHFFFAOYSA-N 383.476 5.452 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1OC 61134990 AZBSOWDTWJZKLB-QFIPXVFZSA-N 399.943 5.854 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2occc2-c2ccccc2)cc1 65680355 SITNWMSWKUGJHR-UHFFFAOYSA-N 380.403 5.863 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1F 66955180 VPVNYBXSSCGVKO-KBPBESRZSA-N 387.480 5.111 30 20 GKED Cc1cccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1Br 120706577 NKGDWEDTEDXQTJ-FUHWJXTLSA-N 398.304 5.061 30 20 GKED C=CCn1c(SCc2sc3ccccc3c2Cl)nnc1-c1cnccn1 124022886 QATWGVDXTSSZRN-UHFFFAOYSA-N 399.932 5.082 30 20 GKED Cn1c([C@H](NCc2ccccc2C(C)(C)C#N)c2ccccc2)nc2ccccc21 126007771 USKQNORDEZIECJ-XMMPIXPASA-N 394.522 5.254 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nnc(-c2ccccc2Cl)o1 133835655 MRYCCDOIWUQOOI-ZDUSSCGKSA-N 384.892 5.254 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(C)ccc2O)cs1 156699399 PLJMSCORRQQOII-YRNVUSSQSA-N 392.480 5.046 30 20 GKED C=CCn1c(SCc2cc(C)nc(-c3ccc(Cl)cc3)n2)nnc1C1CC1 161953293 JXLZYVWNAHJYJZ-UHFFFAOYSA-N 397.935 5.053 30 20 GKED Cc1ccc(-n2c(SCCCC(C)(C)C#N)nnc2-c2ccncc2)cc1 177225217 YJOVYCHJWWNJNP-UHFFFAOYSA-N 377.517 5.060 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc(C3(C#N)CC3)cc2)s1 179993351 QYCMTBCYFDBRQZ-UHFFFAOYSA-N 376.481 5.047 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)cc1)c1ccccc1 190883244 IUXGABOTZZDJKX-DYESRHJHSA-N 393.446 5.260 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCO)[C@H]1CCc2ccccc21 191444392 LFQJTALTKGXHPP-QFIPXVFZSA-N 378.516 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccccc1O[C@@H]1CCOC1 191478452 BIOLGUHFMCQXEM-GOSISDBHSA-N 380.488 5.350 30 20 GKED C=C(C)COc1cc(CNC(c2cccs2)c2cccs2)ccc1OC 237340540 RWEBOXJZZXAAEP-UHFFFAOYSA-N 385.554 5.652 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H](c2ccccc2)c2ccco2)c1 237840252 LRKBBZBVQLTWDU-AREMUKBSSA-N 394.474 5.609 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(C2CC2)nc2ccccc12 303288112 AGGARVBURYTUMN-HNNXBMFYSA-N 387.508 5.616 30 20 GKED Cc1cccn2c(/C=C/C(=O)c3cc4cc(Br)ccc4o3)cnc12 303840436 IVKCQUGWLPYHMR-AATRIKPKSA-N 381.229 5.048 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccccc1N(C)C1CCCC1 328941993 TYIOJJULJLRFLK-MRXNPFEDSA-N 399.560 5.361 30 20 GKED Cc1nc2c(s1)[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC2 371618633 JSHYJCFGJXSKNO-BLLLJJGKSA-N 386.546 5.045 30 20 GKED Cc1ccc2oc(CN(CCCC3(C#N)CCOCC3)Cc3ccco3)cc2c1 410381069 WCQLKWLIXIKAIK-UHFFFAOYSA-N 392.499 5.437 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cccc(SCC#N)c1)c2C#N 410977211 KOTDEVKWRXAITG-OLZOCXBDSA-N 381.526 5.174 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c2[C@H](C)C1 410994415 BABHRARUWUBALE-HTQZYQBOSA-N 385.436 5.033 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2coc(-c3ccccc3Cl)n2)s1 430613377 WDJPVOAHXVBJBA-LBPRGKRZSA-N 385.876 5.239 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1nc2ccccc2s1 435481020 IXUKMOWYVBAYRI-INIZCTEOSA-N 387.439 5.351 30 20 GKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)c2ncc(C#N)cc2Cl)c1 435946539 KNPWMFMSOJBJNQ-UHFFFAOYSA-N 382.250 5.488 30 20 GKED C[C@H](NC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1ccc(C#N)cc1 436100995 OQCXYEWGEUOWLF-LBPRGKRZSA-N 392.808 5.139 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nccs2)cc1 437563365 XEWGIBOQHBUGTR-UXHICEINSA-N 388.496 5.114 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438642423 PXRHWHXIHQYADU-UHFFFAOYSA-N 379.357 5.159 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(OCc3cccnc3)c2)CCCC1(C)C 444850357 RHBAIELITBAOCK-NRFANRHFSA-N 379.504 5.259 30 20 GKED C[C@H](NC(=O)C(C)(C)Cc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1 455549007 CNHBQNOZGHCUSH-INIZCTEOSA-N 389.524 5.128 30 20 GKED Cc1oc2ccccc2c1C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 464445072 VZUQKPBEZZKMHW-UHFFFAOYSA-N 395.418 5.118 30 20 GKED C=CC[C@@H](C)NC(=O)N[C@H](c1cccc(SC)c1)c1cc(F)ccc1F 466240418 FKNBGIPLFWVQSQ-BFUOFWGJSA-N 376.472 5.040 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2c1OCCC2 466731199 LJTORJHDKSKEGT-UHFFFAOYSA-N 386.476 5.287 30 20 GKED Cc1c(NC(=O)c2cn(CCCC#N)c3ccccc23)cccc1C(F)(F)F 469590757 LRRYJTGROGCXFY-UHFFFAOYSA-N 385.389 5.525 30 20 GKED N#Cc1ccc(C[C@H](C#N)C(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)cc1 470733906 VCUSYJLWWCIKKU-OAQYLSRUSA-N 391.430 5.292 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(c2cccc(Cl)c2)CC1)c1ccccc1 474542765 SNFVZXDFJHIMIQ-OAQYLSRUSA-N 381.907 5.274 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cccc(Br)c1)C1CC1)c1ccccc1 474692429 NPLSXAYGTSSCCZ-SFHVURJKSA-N 397.316 5.028 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 474718851 ZPBXYUYADGNDPR-KRWDZBQOSA-N 397.544 5.500 30 20 GKED CCN(C(=O)c1cccc(C#N)c1)[C@@H](c1cccnc1)c1csc2ccccc12 481025033 YZYXOYZUIZHTAI-QHCPKHFHSA-N 397.503 5.420 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@@H](c3ccccc3)[C@H]3CCCO3)c2)cc1 483668879 NZAWEKFOLUECJW-RPWUZVMVSA-N 398.462 5.001 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)c1cccc(Cl)c1F 484051186 ICSZXWWGNVDKLX-CYBMUJFWSA-N 390.911 5.647 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(-c2ccc3ccccc3c2)o1 488747230 NXWPYWCMOURKGO-UHFFFAOYSA-N 385.492 5.983 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cccc(Oc3ccncc3)c2)cc1 496465626 AACAROAMTXVLEX-JOCHJYFZSA-N 385.467 5.166 30 20 GKED CCCn1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C1CC1 498701140 ZSNUPZQVARDKKD-KRWDZBQOSA-N 390.512 5.093 30 20 GKED CC(C)c1cc(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)nn1C(C)(C)C 499866847 ZLONVCPUUWADBW-HNNXBMFYSA-N 393.318 5.063 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)CC2)cc1 503974015 TYIPQFKECPJTGQ-NHCUHLMSSA-N 397.305 5.284 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1cccc(Cl)c1Cl 505314409 NFPUQFFOVWKUTG-MRXNPFEDSA-N 392.673 5.052 30 20 GKED COc1cc(C#N)ccc1OCCCC(=O)Nc1cccc(-c2cccs2)c1 505860657 NMQLQZYQFSOMCM-UHFFFAOYSA-N 392.480 5.093 30 20 GKED N#CC1(c2ccccc2)CCC(NCCCC(=O)Nc2ccc(Cl)cc2)CC1 507617935 BCJPPZLUDBLBIA-UHFFFAOYSA-N 395.934 5.052 30 20 GKED CN(Cc1ccccc1)Cc1cccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 510784627 VKVMJLIJTJWZQY-UHFFFAOYSA-N 397.522 5.372 30 20 GKED Cc1ccc(C#N)cc1NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1 513827087 IRUHZRYDYYEKGF-UHFFFAOYSA-N 375.255 5.165 30 20 GKED Cc1ccc2oc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cc2c1 516465476 SAHKVASKYJWPHE-INIZCTEOSA-N 392.867 6.008 30 20 GKED CCc1cccc(CC)c1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 518556235 CLTNQTKTMUUZLG-UHFFFAOYSA-N 388.442 5.867 30 20 GKED C[C@@H](CC(C)(C)c1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 518755419 HTTGMUFLMAQLGL-ZWKOTPCHSA-N 395.572 5.959 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(F)c2)CCCC1 519433068 OYSPCOOMPNMFIM-MRXNPFEDSA-N 382.504 5.528 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N[C@@H](c2cccs2)C2CC2)cc1 520721163 BQKZFGDPUKNUBD-OAQYLSRUSA-N 392.455 5.432 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521748149 MYELQRGKXPIYHB-JKSUJKDBSA-N 399.585 5.933 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC(=Cc2cccc(F)c2)CC1 524697682 SXQIEMMRUCNHPU-UHFFFAOYSA-N 393.462 5.196 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCC(C1CC1)C1CC1 525734276 MZZLGALYVRCWQB-UHFFFAOYSA-N 389.499 5.003 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(C)cc2)n1)CC1CCCCC1 532571299 DBSGJZCWRCZUJK-UHFFFAOYSA-N 397.588 5.704 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N(C)c2cc(Cl)ccc2C#N)c1 536796298 MDDLMCHYOJEWQR-UHFFFAOYSA-N 390.870 5.554 30 20 GKED C[C@@H](C#N)CN(C)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 549658627 DKSVRCJRCKEZBZ-KSSFIOAISA-N 381.442 5.128 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C 558819537 KUVMQISHVQKECY-VCWGRIPDSA-N 386.967 5.139 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccc(COC4CCCC4)cc3)CC2)cc1 560553191 MJXUKTIDYCMOGS-UHFFFAOYSA-N 375.516 5.098 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 561603609 LRZBRFMZHHRGTO-PXAZEXFGSA-N 379.312 5.164 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)CC1 562514855 SLCCJUHGJSNENM-ZOJXTTQQSA-N 387.936 5.120 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@@H]1c1ccsc1 567547876 JXHPCBHNIPAALQ-LJQANCHMSA-N 387.512 5.082 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 572535884 XHMODPFURUKPCT-GHMZBOCLSA-N 397.302 5.362 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cccc1-c1ccccn1 572793201 MGSYTLILBKKQTD-QGZVFWFLSA-N 375.497 5.301 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1C[C@H]1c1ccccc1 576366934 JICRRAJJOHJUHX-UPVQGACJSA-N 397.478 5.123 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)cc1 596789293 NQKRIBUBSODVMI-MSOLQXFVSA-N 379.529 5.697 30 20 GKED CCCOc1nc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc2ccccc12 604134521 JPWLAOSCWZBXBT-INIZCTEOSA-N 387.464 5.123 30 20 GKED Cc1ccc(-c2ncc(C(=O)N(Cc3ccc(C#N)cc3)C3CC3)s2)c(C)c1 604509077 ZGRKFTOMAGMOBO-UHFFFAOYSA-N 387.508 5.103 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(OCC2CCOCC2)cc1 605944214 SKKYFJZHMXUEPB-UHFFFAOYSA-N 386.536 5.092 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCCc1cccs1 609062136 ZHLYOENRWRJCEN-UHFFFAOYSA-N 390.508 5.469 30 20 GKED N#CCn1c(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)cc2ccccc21 609162994 YYYFBCXFKPOLML-UHFFFAOYSA-N 399.425 5.135 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC#N)[C@@H](C)c1cccc(C(F)(F)F)c1 609168412 MLEPNDYXFVHXPK-HNNXBMFYSA-N 399.416 5.407 30 20 GKED Cc1cc(Br)ccc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 609287052 BPUKVXXYWKLRGX-CQSZACIVSA-N 398.087 5.059 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc(COc3ccccc3)no2)cc1 609474192 KMVKQQUCBIIHEX-UHFFFAOYSA-N 387.370 5.119 30 20 GKED C[C@@H](SCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 609825626 JFFIEWPRVMNPFM-CYBMUJFWSA-N 393.339 5.318 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2cc(Cl)ccc2C#N)cn1 609894797 XDDAFENNZAQECP-UHFFFAOYSA-N 379.847 5.410 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c1 610324621 KVQLJAQXCFDVKI-SFHVURJKSA-N 385.467 5.328 30 20 GKED C[C@@H](NC(=O)NCc1ccccc1Sc1ccccc1)c1cccc(C#N)c1 610350992 CTQNZACTOWBAFH-QGZVFWFLSA-N 387.508 5.270 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(-c2cccnc2)cc1 611094910 FWWGFCZSTXSDKS-ZDUSSCGKSA-N 396.277 5.418 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cc(F)ccc4s3)n2)cc1 613315640 VTPZHDROJDHRHP-MRXNPFEDSA-N 392.480 5.962 30 20 GKED COc1cc(/C=C/C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)ccc1O 727654388 MBUJNUGZGPFFJO-ONNFQVAWSA-N 385.872 5.382 30 20 GKED C[C@@H](OC(=O)CSCc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 728326530 AFIVTNJXQBVNAD-CYBMUJFWSA-N 379.403 5.115 30 20 GKED COCCOc1cccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)c1 728441843 RNJKOCASJHHFGH-KHPPLWFESA-N 397.471 5.179 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(O[C@@H](C)C#N)cc3)s2)cc1 728697714 HWRAQKHZITTYIE-RQPMMQJISA-N 388.492 5.614 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccccc2C(F)(F)F)cc1 729316104 IBIWNJMUAIZLLP-FQEVSTJZSA-N 394.396 5.542 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1nc2cc(F)ccc2s1 730924409 YWMNAUJEZMQXPM-GBESFXJTSA-N 386.451 5.569 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc(F)c(Cl)c3)cc2)c1 731319048 OAPMWZYWLOPTCZ-UHFFFAOYSA-N 397.862 5.952 30 20 GKED CCC/C=C\C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 735204354 UFMJBQZSTIFVEZ-WCIBSUBMSA-N 378.522 5.963 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(-c2cccc(Cl)c2)o1 735230432 LCFCNTIZZBYCAD-UHFFFAOYSA-N 392.267 5.238 30 20 GKED Cc1cc2nnc(SCc3cc(Cl)ccc3OCC#N)n2c2ccccc12 735230822 JLLVCCLIPOZYAH-UHFFFAOYSA-N 394.887 5.039 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC(c2c[nH]c3cc(F)ccc23)CC1 735309183 IPJINJJPEJEEHP-UHFFFAOYSA-N 397.881 5.242 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 739144440 XSVCZYPBMLYDCR-KSSFIOAISA-N 382.385 5.309 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(SC)c(F)c3)cs2)cc1 741846452 GGMXIMCNQFTTKT-RMKNXTFCSA-N 385.485 5.576 30 20 GKED O=C(CCC(F)(F)F)O[C@@H](c1cc(Br)ccc1F)C(F)(F)F 744113386 AKKFSCDCVQKRTJ-JTQLQIEISA-N 397.084 5.077 30 20 GKED CCC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)C1CCOCC1 745197797 NJWRAEJZOUCYID-UHFFFAOYSA-N 380.517 5.271 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=S)Nc1ccc(F)cc1 745723720 FNTZPYGVXLZMAG-UHFFFAOYSA-N 393.462 5.549 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2cccc(-c3ccccn3)c2)SC1=S 747698111 ICHPDGNKHWAIHN-MOSHPQCFSA-N 399.500 5.026 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COC/C=C/c2ccccc2)cc1 763259401 JHCOMGSEUORCEL-REXAPNPKSA-N 382.463 5.011 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2noc(-c3ccccc3)n2)cc1 766602112 SIEIHASHCYMKIY-HOTGVXAUSA-N 383.879 5.280 30 20 GKED CCC[C@@H]1C[C@H](C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 780314235 FTAGTQFXIFWFBP-MRVWCRGKSA-N 396.434 5.087 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc([N+](=O)[O-])cc1Cl 782190256 HPJLALKWNQWOGE-RJRFIUFISA-N 376.846 5.329 30 20 GKED C=CC[C@H](C(=O)O[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784832614 UXWCDRSYJOCRMC-HOCLYGCPSA-N 382.460 5.308 30 20 GKED COc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1OC1CCCC1 792974741 CSCZINVAIMSKRC-UHFFFAOYSA-N 378.472 5.070 30 20 GKED CC[C@@H](C)CON=Cc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 793144894 GFOJOUUIUPNNNO-GFCCVEGCSA-N 399.438 5.243 30 20 GKED CCc1cccc(CC)c1NC(=S)Nc1ccc(OC(F)(F)F)c(C#N)c1 799511628 PRRBJKCZYVRXID-UHFFFAOYSA-N 393.434 5.391 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813217382 KUGKEPHQSUGDQN-YOEHRIQHSA-N 390.405 5.176 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2CCSc3ccccc32)cc1 842289589 RKUCZMVFLXYYRG-CWFSZBLJSA-N 392.524 5.127 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)sc21 842940141 XWVHFQVUVDKQAQ-AWEZNQCLSA-N 377.494 5.217 30 20 GKED CC(C)c1ccoc1-c1noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n1 848613157 DEMSOYVTHJAJTL-HNNXBMFYSA-N 388.468 5.103 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccnc1)c1ccc(F)c(F)c1 916127563 JSCHODFTJVAOKN-LUAWRHEFSA-N 387.389 5.109 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917025460 KZZCXIBVCGDKSA-LJQANCHMSA-N 390.508 5.497 30 20 GKED CC(C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917043642 LQHUOFUYLJLVHB-HNNXBMFYSA-N 384.888 5.328 30 20 GKED O=C1CCCN1c1ccc(-c2csc(NN=Cc3ccccc3Cl)n2)cc1 918758315 NVPRTJSWLIEJHL-UHFFFAOYSA-N 396.903 5.036 30 20 GKED C[C@H]1CCCC[C@H]1NC(=S)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 920994338 QKUBNOIMFQRLNW-HTAPYJJXSA-N 395.547 5.153 30 20 GKED O=C(/C(=C/c1ccc(O)c(Cl)c1)c1nc2ccccc2s1)c1ccccc1 921262689 XHQGAURTWCBIBR-VBKFSLOCSA-N 391.879 6.079 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NC/C(C)=C\c1ccccc1C(F)(F)F 1776782388 POFOYJHSCHTCMV-ZUTYSQTGSA-N 385.470 5.902 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc(SC(F)(F)F)c1)C2=O 1777682949 IPIVXLLFQLEKIE-NTEUORMPSA-N 392.398 5.599 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1SCc1ccc(C#N)cc1 22522438 XZXCGXICCNLXTQ-UHFFFAOYSA-N 392.528 5.067 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2nc(Cl)ccc2Cl)cc1 23390202 WGUKKWSHCFHYPM-UHFFFAOYSA-N 383.234 5.284 30 20 GKED Cc1ccc(SCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1C 27444913 MNMJUINZTFILJP-GOSISDBHSA-N 378.522 5.396 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1cccc(C)c1 31616283 ZYKLTCVJLGUYJN-UHFFFAOYSA-N 390.487 5.419 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccc2ccccc2n1 47376734 SUNRGNAKAVPGQG-OAHLLOKOSA-N 395.443 5.595 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(C2SCCS2)cc1 56212795 XQVSRPGPEHYRGR-UHFFFAOYSA-N 384.526 5.076 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)cc1Br 66802318 NCHWEWONJPTOKT-NSHDSACASA-N 393.281 5.235 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 69572800 LNWAHJXGOCCCAS-DNVCBOLYSA-N 393.874 5.813 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1[C@@H](NCCCC(C)(C)C#N)C(F)(F)F 91710167 VHNRTMRPLVTAQG-GOSISDBHSA-N 378.442 5.012 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C/c1ccccc1Cl 108251811 GMLCZPVXXFCUMW-PLSXKVAHSA-N 392.933 5.004 30 20 GKED COCCSc1ccc([C@@H](C)Nc2ccc(C#N)cc2C(F)(F)F)cc1 112667700 YWRXENNQTIQRPW-CYBMUJFWSA-N 380.435 5.489 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccccc3SC[C@H](C)C#N)o2)cc1C 123565298 JQFHJWPCGDBSRQ-PBHICJAKSA-N 392.528 5.778 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@@H](C)c3ncc(C(C)(C)C)o3)o2)cc1 126291179 YNZNVHSIWZMYRB-ZDUSSCGKSA-N 385.489 5.440 30 20 GKED CCCCn1c(SCc2ccccc2C(C)(C)C#N)nnc1[C@H](CC)N(C)C 134026681 CQMBLQNAHQLXKM-IBGZPJMESA-N 399.608 5.184 30 20 GKED Cc1csc(N(C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)C2CC2)n1 153615368 IXRURQORQJWUED-UHFFFAOYSA-N 389.480 5.233 30 20 GKED CC[C@@H](C)N/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccc(C(C)(C)C)cc1 154518630 QWYMTLIKQIWFMM-GOSISDBHSA-O 397.608 5.215 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(F)c1 170992204 ZTOMQNRHLIVBCD-CABCVRRESA-N 388.533 5.510 30 20 GKED COc1ccc(COCc2cccc(NCc3cc(C#N)ccc3F)c2)cc1 178336695 BOXSOVZCYOVQTA-UHFFFAOYSA-N 376.431 5.035 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 180063089 FLLZKXBGGRSROY-UTKZUKDTSA-N 393.487 5.135 30 20 GKED Cc1cc(F)ccc1CSCC(=O)Nc1ccccc1S[C@H](C)CC#N 182080909 VGZXZXPHOOTFDK-OAHLLOKOSA-N 388.533 5.400 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(C#N)ccc1Br 191696853 RLPGDKLMMLKRGI-ZDUSSCGKSA-N 386.318 5.327 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1 195299178 YGXFKUWRJDPAPX-UHFFFAOYSA-N 391.858 5.107 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)sc2c1CCCC2 253614371 ONIURCYEEAXGTE-HUUCEWRRSA-N 390.430 5.260 30 20 GKED Cc1nc(/C=C\c2cc(C#N)cs2)sc1C(=O)/C=C/c1cc(C#N)cs1 255003221 INMMBMDUZCZUOV-HZDAAVBUSA-N 393.518 5.384 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccccc2SCCC#N)cc1 282779535 FSEIACHQIWVKNU-MRXNPFEDSA-N 380.513 5.273 30 20 GKED C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 296540822 FDGZLLZUGHQTFX-BFHYXJOUSA-N 385.455 5.276 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN([C@H]2C=CCCCCC2)C1)c1ccccc1 328853933 SRDXJYRUUCDOJZ-UXHICEINSA-N 378.520 5.114 30 20 GKED OC(=Nc1cccc(CSC2CCCCC2)c1)N1CCC(c2ncc[nH]2)CC1 330251584 NQOHZEHSGYPTFX-UHFFFAOYSA-N 398.576 5.401 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)n[nH]2)c(C)c1 426993170 VHFOCWUQLHJQEP-OAHLLOKOSA-N 390.512 5.198 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 438221449 AQQNITFUEMYNNN-BULFRSBZSA-N 377.488 5.168 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 438659593 DJDVEQROVXSGET-HNNXBMFYSA-N 375.403 5.372 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(Cl)cc1F 441416239 ODHWUINGNNVXRU-UHFFFAOYSA-N 398.821 5.189 30 20 GKED CCc1c(C)sc(NC(=O)c2ccnc(Oc3ccc(F)cc3F)c2)c1C#N 448216375 BUPSKFRBRWZYKJ-UHFFFAOYSA-N 399.422 5.208 30 20 GKED C[C@H](N[C@H](C)c1ccc(Cl)c2ccccc12)C(=O)Nc1ccccc1C#N 462354819 WFLJLMYQQGYGRC-CABCVRRESA-N 377.875 5.043 30 20 GKED C[C@H](Nc1ccccc1CCC(F)(F)F)C(=O)Nc1ccc(C#N)c(Cl)c1 464792434 PEFBGZABFCUAIS-LBPRGKRZSA-N 395.812 5.146 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(F)c(Br)c1 464966002 CHTKFUBQLLHISH-UHFFFAOYSA-N 395.231 5.379 30 20 GKED O=C(c1c(F)c(F)cc(F)c1F)N1CCSc2ccc(C(F)(F)F)cc21 469084997 VTFQILAZOASPJM-UHFFFAOYSA-N 395.299 5.014 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(COC(C)(C)C)c2C)cc1OC 474904105 AZVZWLCFXFEOCT-UHFFFAOYSA-N 383.488 5.136 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(CC2CC2)CC2CC2)cc1 480631866 ACWPXUGWGNCKCP-UHFFFAOYSA-N 391.471 5.013 30 20 GKED C[C@H]1CCC[C@H](N(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 481621598 HRRRCBGRXOBGBM-JXFKEZNVSA-N 395.478 5.319 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F 482444242 GLFDGEJYASEEAH-HXUWFJFHSA-N 397.400 5.156 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nccc2ccccc12 483205496 TWQFCVHFOYRPPQ-QGZVFWFLSA-N 389.867 5.502 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C(C)C 484148572 URHREOLMOCTWCF-INIZCTEOSA-N 399.564 5.845 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1sc(-c2ccccc2)nc1-c1ccccc1 484387855 TXIJBFINMMLIJU-INIZCTEOSA-N 375.497 5.099 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(SCc2ccccc2C(C)(C)C#N)o1 488826698 BUTDCCDLEGIHPY-SFHVURJKSA-N 377.513 5.705 30 20 GKED C=C[C@@H]1CCCCN1C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 488851968 JHGWZTCVVXCVRS-CQSZACIVSA-N 379.287 5.148 30 20 GKED CCOc1cccc(-c2cccc(NC(=O)c3cccc(SCC#N)c3)n2)c1 489545898 KASMEJGCILJOJS-UHFFFAOYSA-N 389.480 5.015 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H]1CCCC(F)(F)C1 500815236 LBYBAZAZKYTYJG-SFHVURJKSA-N 384.426 5.210 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)N[C@H](C)c3ccc(C#N)cc3)cc2)cs1 504173606 WFMYKRFVJVWRLU-HUUCEWRRSA-N 390.512 5.112 30 20 GKED N#C[C@H](NC(=O)c1cccc(Oc2ccncc2)c1)c1cccc(Cl)c1Cl 505345102 REYBRPZMGIXRQZ-SFHVURJKSA-N 398.249 5.175 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nc2sccc2c1=O 505835411 XIUZQWNNZYYBBC-UHFFFAOYSA-N 399.928 5.138 30 20 GKED CCN(C(=O)c1csc(Cc2ccc(C)cc2)n1)[C@H](C)c1ccc(C#N)cc1 507503012 FFMWGQFAZPBRBX-QGZVFWFLSA-N 389.524 5.137 30 20 GKED CC(C)CN(C(=O)c1ccc(Sc2ccccn2)cc1)c1ccc(C#N)cc1 509014796 JFYHIJWPFSFUNU-UHFFFAOYSA-N 387.508 5.407 30 20 GKED Cc1cc(N(C)C)ccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518376578 ZCEHBUFHBNQYOQ-UHFFFAOYSA-N 385.467 5.172 30 20 GKED C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 523032810 VPZRCUTXLQRGIY-GHTZIAJQSA-N 399.469 5.030 30 20 GKED N#C[C@@H](C(=O)c1cccc([C@@H]2CCCOC2)c1)c1nc(-c2ccccc2)cs1 536588780 NABAGDRVONBKMT-UXHICEINSA-N 388.492 5.194 30 20 GKED CC(C)Cc1ccc([C@@H](NCc2nnc(-c3cccc(C#N)c3)o2)C2CC2)cc1 537292674 ZGXZGEGOHMYZEI-HSZRJFAPSA-N 386.499 5.048 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 537947525 XRYFIEKCUHYCHF-HNAYVOBHSA-N 378.463 6.037 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccoc1C1CC1 541207828 GYZBEQGJNAJWTG-UHFFFAOYSA-N 380.391 5.434 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OCc2nccn2C)cc1 551211186 NMRJTGMIXUIBSC-XXBNENTESA-N 388.515 5.085 30 20 GKED Cc1ccc(NC(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)c(C)c1 557350770 GPWONWOTZKLTHY-UHFFFAOYSA-N 381.907 5.074 30 20 GKED N#CCCC[C@@H](NCc1ccc(Br)cc1Cl)c1ccccc1 560562478 QVPGTIFOHBKSHE-GOSISDBHSA-N 377.713 5.627 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2c[nH]c3ccc(F)cc23)CC1)c1ccccc1 561709582 CIVASUGONAJDIE-QGZVFWFLSA-N 376.475 5.373 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccnc2)cc1 564175604 QQYJQQFWLGDXLL-GOTSBHOMSA-N 398.466 5.178 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 565140763 QMTDEIWTKZQUBB-UHFFFAOYSA-N 380.806 5.590 30 20 GKED COc1ccc([C@@H](CCC#N)Nc2ccc(-c3cn4ccccc4n3)cc2)cc1 570010426 CUYDDCFXLAPPMW-JOCHJYFZSA-N 382.467 5.467 30 20 GKED CC[C@H](N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C#N)cc1 570514378 FQBZKIYNTOLRFV-HXOBKFHXSA-N 384.483 5.007 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)C1 597915071 BSCMITPSAOFAER-OAHLLOKOSA-N 388.389 5.264 30 20 GKED CC(C)c1ccc([C@H](NC(=O)Nc2ccc(CC#N)cc2)c2cccs2)cc1 603650758 QTOUSJBBYRWYRY-QFIPXVFZSA-N 389.524 5.849 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 605974686 ONRPIZZZRXGXRN-AWEZNQCLSA-N 377.941 5.441 30 20 GKED C=CCCO[C@H](C)C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 607040550 XACNNAOPWBIYQW-MJGOQNOKSA-N 382.504 5.110 30 20 GKED Cc1csc([C@H](NC(=O)Nc2cccc(C#Cc3cccs3)c2)C2CC2)n1 608273025 BVKODSXRROAMQQ-LJQANCHMSA-N 393.537 5.186 30 20 GKED Cc1cccc2cc(C(=O)N[C@H](C#N)c3ccc(OCc4ccccc4)cc3)oc12 609173906 AOTQESRZWDJIHV-JOCHJYFZSA-N 396.446 5.315 30 20 GKED C[C@H](NC(=O)CS[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 609825564 FQUWYLBKKMYAON-QWHCGFSZSA-N 393.339 5.537 30 20 GKED COc1cccc(NC(=O)[C@H](Sc2ccc(C#N)cc2F)c2ccccc2)c1 610218807 WODTUKYDRAGYMF-OAQYLSRUSA-N 392.455 5.178 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ncoc1C1CC1 648494219 DVEVJRNTTFWLIN-UHFFFAOYSA-N 396.262 5.094 30 20 GKED C=C(CNC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1 664899557 IEYDSCUNPSSHKN-UHFFFAOYSA-N 382.348 5.053 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1nc2ccccc2o1 673812263 SLCUSEMLZOODPQ-MRXNPFEDSA-N 388.810 5.764 30 20 GKED FC(F)(F)c1cnc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 682916166 DDGDYAVQOMOHJX-ZMONIFLSSA-N 386.283 5.483 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(CN2CCc3ccccc32)cc1 726949402 NHILNMIBMNHXPC-UHFFFAOYSA-N 399.519 5.117 30 20 GKED CC(C)CCO[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 729069953 JIZXRJFEBMIJCY-XJKSGUPXSA-N 376.909 5.091 30 20 GKED O=C1/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)CSc2c(F)cccc21 733084018 UZNGKRGNMHONSO-GHXNOFRVSA-N 398.440 5.229 30 20 GKED Cc1ccsc1C(=O)/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1 733749660 RXAMEFWIFCDHNB-KTKRTIGZSA-N 381.884 5.858 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C(CC)(CC)c2ccc(Cl)cc2)c1 733771847 WDEIIVJPWFAYNJ-FQEVSTJZSA-N 398.934 5.395 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2CC2CCCCC2)c1 733805328 QUANZHOKVMCGPC-SFTDATJTSA-N 383.536 5.012 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734683548 NSJPRUNISFVEGX-FZKQIMNGSA-N 378.303 5.408 30 20 GKED Cc1ccc(NC(=O)[C@H](C)SCc2cc(Cl)ccc2OCC#N)cc1C 735320154 LWWZNGPQDNROOO-HNNXBMFYSA-N 388.920 5.120 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cc(Cl)sc3Cl)c2)s1 739594720 OXIBDQQXUULYIA-UHFFFAOYSA-N 393.320 5.585 30 20 GKED Cc1ccc(NC(=O)c2ccccc2SCC#N)cc1OCC1CCCCC1 741238273 GMWCUGKYFIORSM-UHFFFAOYSA-N 394.540 5.822 30 20 GKED CSc1ccc(/C=C/C(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 741447987 SBILFBQUPWJUAF-OVCLIPMQSA-N 386.538 5.021 30 20 GKED C[C@]1(c2ccccc2)C[C@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093861 YTYSHLQBMCGERW-JBRSBNLGSA-N 381.479 5.194 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(C(F)(F)F)CC2)cc1 743095870 MWIRYEOLPWPLQH-IBGZPJMESA-N 387.405 5.148 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC(C)(C)c3ccccc3)n2)cc1 743458198 QEUNJYJNTKSANL-IBGZPJMESA-N 390.508 5.363 30 20 GKED N#C[C@@H](C(=O)C1CC(OCc2ccccc2)C1)c1nc2cc(Cl)ccc2s1 747106817 ZUQORWXZWPSOEM-PREGVCBESA-N 396.899 5.121 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cnc3ccccc3c2C)cc1 749025435 FCXYSWYRZQCTBO-YWZLYKJASA-N 385.467 5.018 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)COc2c(Cl)ccc(Cl)c21 753145174 WMNKWORCMQCPPC-YFHOEESVSA-N 389.263 5.171 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1cc(Cl)ccc1OCC#N 756647271 ZNHWPPKQDXVQKB-AWEZNQCLSA-N 377.941 5.324 30 20 GKED CC(=NNc1nc2ccccc2cc1C)c1sc2nc(C)nc(C)c2c1C 776785468 GPZBFFNFDDPGPG-UHFFFAOYSA-N 375.501 5.309 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 778297074 GCYWPTHLZRAYGW-IRXDYDNUSA-N 384.863 5.221 30 20 GKED CC(C)c1ccc(-c2nc(CNc3ccccc3O[C@@H](C)C#N)cs2)cc1 779740404 HINDQDRTQMFKIW-INIZCTEOSA-N 377.513 5.836 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCO1 781616553 KDHFMLHREBLKKU-NMNUPHIUSA-N 376.500 5.122 30 20 GKED CN(CC1(c2ccccc2)CC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782011767 GXHUDADRCMIUEU-DEOSSOPVSA-N 395.506 5.538 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1ccc([N+](=O)[O-])cc1Cl 782190121 XHPNAQNFDALTBO-YFHOEESVSA-N 394.814 5.118 30 20 GKED C[C@@H](Cc1ccccc1)NC(=S)N(Cc1ccccc1)c1ccccc1C#N 786070164 BYUQEUORMVGPMH-IBGZPJMESA-N 385.536 5.071 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1COC2(CCCCCC2)O1 789450290 MRVRENGGTABQLX-IBGZPJMESA-N 386.536 5.126 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3F)o2)cc1NC(C)=O 790216348 RQNRQUACNWTNGM-VQHVLOKHSA-N 397.377 5.088 30 20 GKED Cc1c(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)sc2ccc(C#N)cc12 794253438 BYJRVMWWOSSUOU-UHFFFAOYSA-N 399.519 5.583 30 20 GKED CCN(C(=O)c1ccc(C)c(C#N)c1)[C@@H](c1ccc(Cl)cc1)c1cccnc1 799338157 XGXNAAFDFFYFBV-QFIPXVFZSA-N 389.886 5.167 30 20 GKED CC(C)COC(=O)Nc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 810134722 DKKCZZAXFBYYII-UHFFFAOYSA-N 391.393 5.394 30 20 GKED Cc1ccc([C@H](C)c2noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)cc1 848607167 SLTAVWQNXOCKQF-FUHWJXTLSA-N 398.507 5.180 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCC[C@@H]1CC1(Cl)Cl 857690282 ZILZKWCQCKSUQY-CQSZACIVSA-N 391.323 5.023 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 914450058 VGPXSKJZSQSHAF-UHFFFAOYSA-N 395.437 5.185 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(F)cc2Cl)cc1 915088045 ZLPXJYYKTLLOFL-QGZVFWFLSA-N 382.797 5.526 30 20 GKED CCCCOc1ccc(C=NOCc2csc(C(C)(C)C)n2)cc1OC 918185883 LDRPVSSRBXZTML-UHFFFAOYSA-N 376.522 5.179 30 20 GKED O=C(O)c1ccc2c(c1)CCCC2=NNc1c(Cl)cc(Cl)cc1Cl 1776014393 GGPHAURTWZMBAM-UHFFFAOYSA-N 383.662 5.498 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCc4c(Cl)cccc4C3=O)o2)cc1O 1777670995 PHAWXWUTTDKSPM-RAXLEYEMSA-N 394.810 5.216 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1cc(C)ccc1C)[n+]1ccccc1 10174339 NQJABWBZSVRCTM-UHFFFAOYSA-O 389.544 5.204 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)o2)cc(OC)c1OC 16407683 ABZGGCNIBYIRKA-CSKARUKUSA-N 382.387 5.008 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccoc1C 21925498 LQKJPXOUHCFLDN-INIZCTEOSA-N 381.501 5.013 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2OCc2ccc(Cl)cc2)n1 41519964 UQSKBAOFOWMJAG-QGZVFWFLSA-N 382.872 5.174 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 56409055 JCLPHXAOLYIWNQ-HNNXBMFYSA-N 395.553 5.089 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCC)cc1C(F)(F)F 64564427 CWYHGZGYNAGVSE-UHFFFAOYSA-N 384.423 5.386 30 20 GKED COc1ccc(CCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1F 65680271 OXKYNJUNQHMUSI-UHFFFAOYSA-N 390.414 5.070 30 20 GKED CC(C)Oc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66955756 KNWJPRRPPKXSIV-MRXNPFEDSA-N 383.517 5.190 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)no1 69203091 BLBUIUZNFKUPKI-NRFANRHFSA-N 388.427 5.016 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Nc1ccc(OCc2cccc(C#N)c2)cc1 97543261 SGQPCCAVSDJDDH-IBGZPJMESA-N 399.494 5.193 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Br)cs1 108981558 UFEIAZJHBWWBOT-JTQLQIEISA-N 381.320 5.157 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 109028520 RXVVPECTQOHKQU-JXFKEZNVSA-N 395.528 5.458 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)N[C@@H](C)c1ccc(OCC#N)cc1 181777617 SWYKMULFBGKBNO-PGRDOPGGSA-N 376.525 5.594 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)nn1-c1ccccc1Cl 183531136 CTPFVWHACRGSQO-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C(=O)NCCCC)CC[C@H]1C 191488314 YEHOYYJWFCFHAB-QUCCMNQESA-N 399.579 5.087 30 20 GKED Cc1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)s1 194680850 MDEXGHTWBCQTFC-LLVKDONJSA-N 394.308 5.372 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2cccc(Cl)c2Cl)cc1OC 213135345 YGAJOAHWBZJFRV-NTMALXAHSA-N 378.255 5.219 30 20 GKED C[C@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 246537590 SNWPMYXVFWIXQM-AOIWGVFYSA-N 379.529 5.348 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 303338170 LBEPYPGJLJSAPV-ZWKOTPCHSA-N 396.556 5.919 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN([C@@H]2C=CCCCCC2)C1)c1ccccc1 328853936 SRDXJYRUUCDOJZ-WOJBJXKFSA-N 378.520 5.114 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccccc1-c1nc(C(C)(C)C)no1 410361963 BICWKTGKCKCZCZ-UHFFFAOYSA-N 375.472 5.405 30 20 GKED C[C@@H]1CN(CCCC(C)(C)C#N)c2ccccc2N(Cc2ccccc2)C1=O 430772343 KYJSSRJJQJEOJS-LJQANCHMSA-N 375.516 5.006 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1 433377197 PKNYQURYIFIYNB-FQEVSTJZSA-N 395.462 5.130 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(Cc3ccccc3)CC(F)F)c2)cc1 437161182 ARRDYNPQIKFPRQ-UHFFFAOYSA-N 392.405 5.258 30 20 GKED Cc1cc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)ccc1OC(C)C 438405637 WYJBKUAWLBMBSB-LEWJYISDSA-N 377.488 5.086 30 20 GKED CC(C)[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 438867011 QUOCPOTZDJYXHP-IBGZPJMESA-N 389.421 5.116 30 20 GKED C[C@H]1CCC[C@@](C#N)(NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)C1 442710032 BBJWEASHNGMSRA-HXPMCKFVSA-N 376.287 5.191 30 20 GKED CC(C)n1cc2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2n1 444799306 HQLGYWSIWTTYQV-UHFFFAOYSA-N 385.471 5.128 30 20 GKED CCSCc1ccccc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 448342916 SSCBQOKURRLDOK-INIZCTEOSA-N 379.312 5.241 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@H](NC1CCC(C)(C#N)CC1)c1ccc(Cl)cc1)C2 449308874 AGPKJOQIWZIMKC-LBYNRAJASA-N 385.983 5.316 30 20 GKED CCN(C(=O)c1sc2ccccc2c1Br)c1ccc(C#N)cc1 463960273 VZTGRPNKJFOPFA-UHFFFAOYSA-N 385.286 5.202 30 20 GKED Cc1cccc([C@H]2CCCCN2CC(=O)Nc2ccccc2SCC#N)c1C 464782517 XMUXCARBRSPNSE-OAQYLSRUSA-N 393.556 5.085 30 20 GKED C[C@H]1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)[C@H](c2ccco2)C1 469477897 LMJHPUQIVWCECU-UWJYYQICSA-N 375.472 5.151 30 20 GKED O=C(CCCC(F)(F)F)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1 470224236 UZPBQYMEEIJEEC-UHFFFAOYSA-N 379.247 5.020 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2ccc3ncccc3c2)cc1 471253118 CIAMHIPIFCZUSS-UHFFFAOYSA-N 394.434 5.220 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccccc1 474699733 VTDQKDDEDXQBSN-GOSISDBHSA-N 386.417 5.284 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccccc2Cl)c1C 476131215 DGQFIGKEFLPKOK-UHFFFAOYSA-N 393.918 5.938 30 20 GKED CCCCc1ccc([C@H](NC(=O)N2CCC(F)(C#N)CC2)c2cccs2)cc1 476903332 NRDJDZNPTCLQRA-FQEVSTJZSA-N 399.535 5.217 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1 486247454 AHGBESGJTARJTM-UHFFFAOYSA-N 394.540 5.089 30 20 GKED C=CCOc1c(Br)cc(CNCc2cscc2C)cc1OCC 487165120 MXFZCJJZFGXNAU-UHFFFAOYSA-N 396.350 5.072 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)c1 488333986 QAWLRAMEUPXNTD-UHFFFAOYSA-N 390.695 5.084 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H](C)c1ccccc1C(F)(F)F 495550007 YMHYKEXOLHSDTP-LSDHHAIUSA-N 396.478 5.021 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@H]1C[C@H]1c1cccc2ccccc12 503081183 ATWMJUPTSGXUCT-VXKWHMMOSA-N 393.408 5.130 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC2(c3ccc(Br)cc3)CC2)cc1 503280975 CDRKRZDFNLTAJG-UHFFFAOYSA-N 398.304 5.061 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)cc1 504059849 QFWIJEWATFHHRG-UHFFFAOYSA-N 385.511 5.120 30 20 GKED CCc1cccc(Cc2cnc(NC(=O)c3cc(C#N)ccc3Cl)s2)c1 507654706 WKAFKVMFUOTBTR-UHFFFAOYSA-N 381.888 5.074 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1 518165719 QALDWTMMEJVRMA-IIBYNOLFSA-N 379.529 5.520 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CC3(CC(=O)O)CCCCC3)cc2)cc1 519065670 ZTZDYGLPTCJEOP-UHFFFAOYSA-N 392.455 5.104 30 20 GKED N#Cc1ccc(NC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)cc1Cl 519968510 JUNAQWQXCVAVLK-NRFANRHFSA-N 387.870 5.391 30 20 GKED CC(C)[C@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524442100 QFOUUSXSAWZESN-HNNXBMFYSA-N 385.895 5.299 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1c(F)cccc1Br 537837470 UWMYIFLFVFDRKY-LBPRGKRZSA-N 379.298 5.595 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](Cc2ccccn2)c2cccnc2)cc1 539217053 IJEPQBDHWRENCJ-SANMLTNESA-N 390.490 5.089 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)ccc1Cl 543484112 QPHYOTSHMOVCIN-UHFFFAOYSA-N 386.760 5.548 30 20 GKED N#CCc1ccc(CNC2(c3noc(C4CCCCC4)n3)CCCCCC2)cc1 543555080 KSIDXFXMSUFFFY-UHFFFAOYSA-N 392.547 5.523 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(F)c(F)cc2Br)c(C#N)s1 552702945 ARCUUBXOZLDLAV-UHFFFAOYSA-N 399.260 5.210 30 20 GKED Cc1nc(-c2ccccc2)c(NC(=O)c2sc3ccc(C#N)cc3c2C)s1 555647356 AUDHZVWZLZLXDK-UHFFFAOYSA-N 389.505 5.766 30 20 GKED C=CCN(C(=O)c1cccc([C@H]2CCOC2)c1)c1nc(-c2ccccc2)cs1 556485403 GDWNRAIWKVHTBI-FQEVSTJZSA-N 390.508 5.147 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@H]1C(F)F)c1ccc(C(F)(F)F)cc1 561627882 ATIDEOPWZMUCKQ-HUUCEWRRSA-N 376.369 5.152 30 20 GKED Cc1cc(NC(=O)c2occc2COc2cccc(C#N)c2)c(Cl)cc1F 571545568 VMTNSMKCSAVOTC-UHFFFAOYSA-N 384.794 5.084 30 20 GKED CC(C)Oc1ccc(Cl)cc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 573048788 UAJKTTLUZVVDME-UHFFFAOYSA-N 395.890 5.320 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3ocnc3-c3ccccc3)c(C#N)c21 576005633 QXYTYLRASDDSFV-OLZOCXBDSA-N 377.469 5.213 30 20 GKED C[C@@H]1[C@@H](N(Cc2ccc3c(c2)OCO3)C(=O)CCCCCC#N)CCC[C@H]1C 588901223 XRZJOVUOXXTQQH-HBFSDRIKSA-N 384.520 5.043 30 20 GKED C=CCOc1ccccc1CNC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1 600896122 WLTBKUVVWDERPS-NRFANRHFSA-N 396.487 5.041 30 20 GKED N#C[C@H](C(=O)c1coc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 603627474 VSZIOCFIDKFMMI-GFCCVEGCSA-N 386.354 5.551 30 20 GKED C[C@@H](Nc1ncc(C#N)cc1Cl)c1ccc(NC(=O)c2ccc(F)cc2)cc1 608886033 MRVHNKFOCAKLEZ-CYBMUJFWSA-N 394.837 5.171 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2SCC(F)(F)F)cc2ccccc21 609161488 STAGPJFMDDNAGL-UHFFFAOYSA-N 389.402 5.072 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2[nH]1 609208731 CFQBCDRNSMTSDT-OAHLLOKOSA-N 397.438 5.110 30 20 GKED Cc1ccc(-c2ncc(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)s2)c(C)c1 609589582 JKHHXWSFUFUCFA-QGZVFWFLSA-N 381.888 5.075 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 609773536 JPVOVJRNSPEKKI-YLJYHZDGSA-N 395.528 5.455 30 20 GKED COCCN(C(=O)c1sc2cc(C)ccc2c1Cl)c1ccc(C#N)cc1 610233642 SQRFKTGWIXVULP-UHFFFAOYSA-N 384.888 5.028 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1cccc(C#N)c1 610406921 MVYLISNVWHCUAY-HNNXBMFYSA-N 383.442 5.052 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(C)noc1C(F)F 610431412 LQBDFQZGSSPYOQ-UHFFFAOYSA-N 383.354 5.145 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)N(CCC#N)Cc1ccccn1 610767112 OSUQENBBGGQBBK-UHFFFAOYSA-N 386.455 5.130 30 20 GKED CN(C(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccccc1C#N 611071944 INYLNUBGTPZZNU-UHFFFAOYSA-N 376.843 5.067 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)c(F)c1 611465407 KVKBOKVSDLYJNZ-OLRMPSLUSA-N 382.323 5.257 30 20 GKED Cn1c([C@H](NCc2ccc(C(C)(C)C#N)cc2)c2ccccc2)nc2ccccc21 614212618 SJEGDLQYXNECQI-XMMPIXPASA-N 394.522 5.254 30 20 GKED CC(C)(C)c1ccc([C@H](NCCCC2(C#N)CCOCC2)C(F)(F)F)cc1 619620955 UFKQBMDOZUNCAJ-SFHVURJKSA-N 382.470 5.278 30 20 GKED CCN(C(=O)NCc1ccc(C#N)c(Cl)c1)[C@@H](C)c1cc2ccccc2o1 619770219 ZTLLAEZBUOUWCT-AWEZNQCLSA-N 381.863 5.251 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)C1 665562205 LCESMQDTPQPYDC-GOSISDBHSA-N 377.488 5.067 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cnn1-c1ccc(F)cc1 679881940 XXMSALQHFZYAOS-IBGZPJMESA-N 398.441 5.002 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1nc2ccccc2s1 684682310 UETXACIUFBRQLO-SFHVURJKSA-N 388.423 5.718 30 20 GKED CCS[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 727627203 MARAQSNPZDRGHH-WMLDXEAASA-N 378.950 5.417 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cccc(OC)c2)CC3)cc1 727780666 RRKMDGLGNCDESC-VBKFSLOCSA-N 377.465 5.040 30 20 GKED CC(C)[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1 728766713 HJTYOIYKUDOUAC-FGZHOGPDSA-N 384.479 5.317 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(-c3ccccc3)cc2)c2ncc[nH]2)c1 729240497 PIWLSSKBEOCGTF-KQWNVCNZSA-N 380.447 5.509 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nc(C)cs1 729553291 NYATZLAFNDTJQP-PMACEKPBSA-N 390.512 5.380 30 20 GKED Cc1ccc([C@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 731979230 MODKQJNGSPMSRE-INIZCTEOSA-N 376.481 5.406 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(CCC#N)Cc3ccco3)cs2)cc1 732067021 YJUJVTJPELGEDI-UHFFFAOYSA-N 393.512 5.011 30 20 GKED C#CC[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1ccccn1 733693458 ZCDCEEOIMRQIEF-CUYJMHBOSA-N 397.474 5.072 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H](C)c2c(Cl)cccc2Cl)c1 733775161 RFPBVAMSNSHBDU-UKRRQHHQSA-N 391.298 5.094 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1cccc(Cl)c1Cl 734980958 NGBNSVYMCRNVMF-FPLPWBNLSA-N 388.172 5.390 30 20 GKED C=CC[C@H](NC(=O)N[C@H](Cc1ccccc1)c1cccs1)c1ccncc1 735189451 AACHFKXFAWHPEY-VQTJNVASSA-N 377.513 5.044 30 20 GKED O=C(/C=C\c1nccs1)c1ccc(-c2ccccc2Br)s1 735229258 XFUYFXMZSPJOID-YVMONPNESA-N 376.300 5.530 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735570192 SAGSVCYZIUZGEQ-UHFFFAOYSA-N 396.922 5.254 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cncc(F)c1 737445096 VXAYCRYAYMIYFA-RUDMXATFSA-N 380.806 5.023 30 20 GKED N#Cc1ccc(F)c(CNCc2ccc(-c3ccc(Br)cc3)o2)c1 742381649 AXDXPIWSBMBKNN-UHFFFAOYSA-N 385.236 5.010 30 20 GKED CC(C)[C@H]1CN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)CCS1 742909253 ZXHYIMNJQUTTQD-OAQYLSRUSA-N 396.581 5.064 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc3ccccc23)cc1 746658874 HUZDRPGOCYJCSK-RUZDIDTESA-N 391.474 5.817 30 20 GKED FC(F)Sc1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 747447476 KFOGAPGIOAMWON-QWRGUYRKSA-N 393.343 5.564 30 20 GKED C=CCCCC(=O)Oc1cc2ccccc2cc1C(=O)Nc1ccccc1OC 749026876 SCWLEMDYNZRXBP-UHFFFAOYSA-N 389.451 5.362 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2cc(Br)ccc2c1 764219875 LOKSOVDBZQOQJC-UHFFFAOYSA-N 394.272 5.138 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(Br)cc1F 767739828 ZUWWZSFOFOVQHY-BAQGIRSFSA-N 399.219 5.067 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)cc1 768969043 JCPBPYBYHLAYGY-ZGFBMJKBSA-N 393.490 5.049 30 20 GKED C[C@@H](OC(=O)c1ncccc1C(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 770761837 PVWUNKDWOTXKOC-MRVPVSSYSA-N 381.247 5.176 30 20 GKED CC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cc(F)cc(Br)c1 776808828 LDTYEDRGLLIXRM-ORAYPTAESA-N 391.284 5.120 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(Cl)cc(F)c2Br)cc1 786002393 KIRUGYYYVXPFBW-UHFFFAOYSA-N 395.659 5.111 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1csc(Cl)c1 787186995 WJQFOFLXXLFWLP-UTCJRWHESA-N 388.828 5.168 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)[C@H](C#N)c2nccc3ccccc23)c1 792093407 ICRRTUHDOUPFHE-LJQANCHMSA-N 387.439 5.072 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc2c(c1)CCCC2)c1nccc2ccccc12 792095145 JWQFXKQGJXRTRY-QHCPKHFHSA-N 384.479 5.149 30 20 GKED N#CC[C@@H](CC(=O)O[C@H](c1ccc(Cl)cc1)c1cccnc1)c1ccccc1 796691188 KBGRYHFEIYQIOQ-WMZHIEFXSA-N 390.870 5.455 30 20 GKED CC(=O)N1C/C(=C/C(C)=C\c2ccccc2C(F)(F)F)C(=O)c2ccccc2C1 799892603 RHQNVSKAZYHQFC-HZCNULMQSA-N 399.412 5.280 30 20 GKED CC(C)(C#N)CCOC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 811360756 DMPZICRFNNCBPV-UHFFFAOYSA-N 394.899 5.363 30 20 GKED C#C[C@@H](NCc1csc(COc2ccc(C)cc2)n1)c1ccc(Cl)cc1 811517152 JNFZYYHUWSBEAH-HXUWFJFHSA-N 382.916 5.148 30 20 GKED CSc1ccc(C=Nn2c(C)nc3scc(-c4ccccc4)c3c2=O)s1 814728699 HFERMMPRBIOQMF-UHFFFAOYSA-N 397.550 5.099 30 20 GKED N#C[C@@H](C(=O)C1(c2cc(F)cc(F)c2)CCCC1)c1cc(C(F)(F)F)ccn1 860780045 QZGXTUNMLIDHGD-MRXNPFEDSA-N 394.343 5.067 30 20 GKED C[C@H](NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl)c1ccc(C#N)cc1 863857430 OKLNYCZSBCDFPW-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED C=CC[C@H](OC(=O)CCc1nnc(C(F)F)o1)c1ccc(Cl)c(Cl)c1 870338679 AKLIWUGFCNMMOZ-LBPRGKRZSA-N 391.201 5.107 30 20 GKED CCOc1ccc(O)c(/C=N/C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 914703085 ODGMGFGHNHIZBH-JJKDVNPGSA-N 383.332 5.119 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1c(F)cccc1Cl 916309690 JXIWSAFBSONBEH-UHFFFAOYSA-N 397.862 5.108 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccc4ccccc4c3)n2)cc1 916650527 VYAVKGZECPKLDX-OAQYLSRUSA-N 382.488 5.691 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)n1[C@@H](C)c1ccccc1 916847620 MZBRQPKXUYSNRS-OXJNMPFZSA-N 399.519 5.814 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(Cl)cc(Cl)c2)cc1 916947381 ISXJEFMPGBVVMX-SGTLLEGYSA-N 389.282 5.468 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCOc3ccc(C)cc3C)n2)cc1 916974191 GCOFDQRRRIDJJK-LJQANCHMSA-N 390.508 5.381 30 20 GKED C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917045797 ABQQHRYFWCGWCR-PXAZEXFGSA-N 396.899 5.082 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3cccnc3)cc2Cl)cc1 917876645 OVDXPRZREUEXBG-YHYXMXQVSA-N 375.815 5.051 30 20 GKED O=C(O)c1ccc(Br)c(C=Nn2c3ccccc3c3ccccc32)c1 1776112887 OOTIKFDRJRGLJW-UHFFFAOYSA-N 393.240 5.137 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ccc(-c4ccccc4)cc3)c2c1 1776131436 QVFWLFAKVXBZQL-ZRDIBKRKSA-N 384.456 6.163 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776697587 IVPODHGSPYSQEU-DAIOKFOQSA-N 384.475 6.461 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(F)cc(Br)cc1F 1776784238 YYCXEELUOQOAPB-CYBMUJFWSA-N 392.284 5.021 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2nc3c(C(=O)O)cccc3o2)cc1 1776785443 AZRAFGHTQNHGJQ-DTQAZKPQSA-N 393.483 6.436 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)CC2CCCCC2)c1 1776787697 VGRHDSYBIYLSBG-JOCHJYFZSA-N 389.580 5.939 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2cccc(C)c2)cc1 1776788221 ROXGASAYEBDANW-HSZRJFAPSA-N 383.532 5.650 30 20 GKED CCCCCCCOc1ccc(/C=C/c2nc3c(s2)CCC[C@H]3C(=O)O)cc1 1776788282 XBPQMWXJGOQRNR-LBKOFNPBSA-N 399.556 6.167 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ccc(/C=C/C(=O)O)cc1 1777487698 FQVNPLYEYDYUSN-VOFKWTQNSA-N 393.439 5.252 30 20 GKED C=CCn1c(SCc2csc(-c3ccsc3)n2)nnc1-c1ccncc1 7644451 KBKYFUOSDAWNIW-UHFFFAOYSA-N 397.554 5.003 30 20 GKED C=CCNC(=O)c1ccccc1NC(=O)c1oc2c(ccc3ccccc32)c1C 21597970 MDRXAWJTDBIRJN-UHFFFAOYSA-N 384.435 5.063 30 20 GKED CC[C@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccccc1OC(F)F 58859681 MXVYZBVGGOQFAH-HNNXBMFYSA-N 379.794 5.086 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2c2cccs2)c1 65628103 VRAQIAYSERMPOP-OAQYLSRUSA-N 388.492 5.176 30 20 GKED COc1cc(Cl)ccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 66954328 ITOWEAFKEGPERP-CYBMUJFWSA-N 389.908 5.065 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1OC(F)F 66954459 PVKOYRGGPCODHU-CYBMUJFWSA-N 391.443 5.004 30 20 GKED CCN(C(=O)NCc1ccc(C#N)cc1F)[C@@H](C)c1cccc(C(F)(F)F)c1 105722157 BQRHXQYGXXBFEQ-ZDUSSCGKSA-N 393.384 5.009 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCCSc2ccccc21 108356746 UXJKIWFGGXIALN-MRXNPFEDSA-N 397.569 5.022 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 117006516 QSTXVJFYUPYHFI-LLVKDONJSA-N 387.402 5.139 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COC2CCCCC2)c1 120474704 FEVFFSOTJOBRPJ-UHFFFAOYSA-N 377.488 5.071 30 20 GKED C=CCn1c(C)nnc1SCCC(=O)Nc1c(C(C)C)cccc1C(C)C 126705897 UGMGFFCQMFDEJY-UHFFFAOYSA-N 386.565 5.140 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccccc1 155267558 BGRFZTJPIMPPLR-FQEVSTJZSA-N 397.906 5.061 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 178377357 XQYPODNXXGEVCW-UHFFFAOYSA-N 375.375 5.056 30 20 GKED N#C[C@@H](C(=O)Cn1c(C2CCCCC2)nc2ccccc21)c1nc2ccccc2o1 179457974 MYUJVCDPBPIDNU-KRWDZBQOSA-N 398.466 5.102 30 20 GKED N#C[C@H](NC(=O)c1ccccc1SCc1cccs1)c1ccccc1Cl 179552769 GPJCONAWAOGAHE-SFHVURJKSA-N 398.940 5.688 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 184021597 TWXDRKBYFPVFKC-CYBMUJFWSA-N 378.432 5.060 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 185220545 CNQSCGPTIAWRJP-AWEZNQCLSA-N 392.484 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](NC(C)=O)c1ccc(C)cc1 189887548 DADWFVSDLWIMCX-JOCHJYFZSA-N 378.516 5.053 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC(=O)Nc1c(C)cc(C)cc1C 191415231 IPARPOMFMPCBAK-UHFFFAOYSA-N 393.531 5.224 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCCO)[C@H]1CCc2ccccc21 191460903 XFCXFJSHKYDWPE-QHCPKHFHSA-N 392.543 5.442 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(CNC(=O)OC)cc1 191515854 ZTPVDIKOIPTJNB-UHFFFAOYSA-N 381.476 5.039 30 20 GKED CC1(C)CCC[C@H](/C(O)=N/C2(c3noc([C@H]4CCOC4)n3)CCCCCC2)C1 328774240 BTFGIJNVERQKRT-IRXDYDNUSA-N 389.540 5.296 30 20 GKED CC(=O)N1CCC(CCC(O)=Nc2cccc(N=C(O)C3CCCCC3)c2)CC1 330330616 XCJWALCSEHUSIC-UHFFFAOYSA-N 399.535 5.482 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2ccc(C#N)cc2Cl)cc1OC 430348797 BXHLQFSVBBSKEM-UHFFFAOYSA-N 393.270 5.305 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cccc(SCC#N)c2)c(C(F)(F)F)c1 430936982 YIKQRLYNCWLVDR-UHFFFAOYSA-N 394.418 5.361 30 20 GKED N#CCCC[C@H](NC(=O)NCCn1ccc2cc(Cl)ccc21)c1ccccc1 431305931 AYRTYJRPYRLPHN-FQEVSTJZSA-N 394.906 5.029 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC(C3CCCC3)C2)cc1 432038688 TVPXDURKLSBUCT-UHFFFAOYSA-N 391.471 5.013 30 20 GKED CC[C@H](c1ccccc1)[C@@H]1CCCN1Cc1cn(CCC#N)nc1-c1ccncc1 435122613 BKQXVHBLYKPEHQ-RPWUZVMVSA-N 399.542 5.017 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)c1ccc(F)cc1C(F)(F)F 436353639 SWLWTWOKNPIEOG-OAHLLOKOSA-N 393.302 5.576 30 20 GKED CCCCCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)C(C)C 437975529 NJGLUBUFESWKDP-UHFFFAOYSA-N 393.531 5.878 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H](C)C2(C)CC2)cc1 438596566 AZOARNGRPDZQNE-OAHLLOKOSA-N 379.460 5.011 30 20 GKED CCCc1c(NC(=O)c2c(C)oc3ccccc23)cnn1-c1cccc(C#N)c1 440088408 OGGBZGFTSUTXGE-UHFFFAOYSA-N 384.439 5.003 30 20 GKED CCCc1c(NC(=O)[C@H](C)c2ccc(Cl)s2)cnn1-c1cccc(C#N)c1 440108256 VNOCKGPGVCAXEH-CYBMUJFWSA-N 398.919 5.154 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 443116147 JQYQJHDZYZVLDC-UHFFFAOYSA-N 376.843 5.759 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 445201795 AWIZPXRJMCZKIM-QGZVFWFLSA-N 378.815 5.043 30 20 GKED N#Cc1ccc(NC(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)c(Cl)c1 445799624 XHCMANXWBXAXOE-UHFFFAOYSA-N 378.781 5.192 30 20 GKED C[C@@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 462541756 HLCCZFSRGPGPKQ-QZTJIDSGSA-N 379.463 5.078 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2cccc(C#N)c2)n(C2CCCCC2)c1C 468642741 LQWMUSLNWDRWDD-UHFFFAOYSA-N 392.528 5.084 30 20 GKED Cc1cc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc(C)c1F 469155400 XRKYAVVMECHXKM-QGZVFWFLSA-N 379.479 5.199 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cnn(-c3ccc(F)cc3)c2C(C)C)n1 474428124 CRZUOAPKMBMINI-MRXNPFEDSA-N 396.491 5.205 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cn(Cc3ccccc3)c3ccccc23)n1 474430590 GGCYPSOBFKZILY-IBGZPJMESA-N 399.519 5.760 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 475249801 VUSSNEIFNJXDCY-UHFFFAOYSA-N 379.510 5.257 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccco1)c1cccc(Cl)c1)c1ccccc1 475925033 DRPBHEGFHUHRDF-GOSISDBHSA-N 378.859 5.554 30 20 GKED Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1NC(=O)C(C)(C)C 475936579 ZRNXHUBHOCEZLW-GOSISDBHSA-N 377.488 5.006 30 20 GKED COc1ccc(N(Cc2ccco2)C(=O)C[C@@H](CC#N)c2ccccc2)cc1F 476095132 DVKOMKKJCGCYEE-GOSISDBHSA-N 392.430 5.048 30 20 GKED Cc1sc(NC(=O)c2occc2CN2c3ccccc3C[C@@H]2C)c(C#N)c1C 482271115 WIIPTLCKAPHIOF-ZDUSSCGKSA-N 391.496 5.033 30 20 GKED C[C@@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 487223227 BUNBJTDUKKVYTH-SECBINFHSA-N 379.275 5.354 30 20 GKED C=CCn1c(S[C@H](C)c2cccc(OC)c2)nnc1-c1cccc(OC)c1 488880818 MQHVFTWBGKMUQF-OAHLLOKOSA-N 381.501 5.002 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(F)cc3)c(Br)c2)CCC1 508296748 CEKXEYDRWUOPID-UHFFFAOYSA-N 389.224 5.013 30 20 GKED O=C(c1cc(Cl)c(F)cc1Cl)N(CCC(F)(F)F)CC(F)(F)F 509561134 WDRPERVMQVGMAH-UHFFFAOYSA-N 386.094 5.089 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2cccc(COc3ccccc3C#N)c2)C1 513266075 GJKRNMHCWWNGLB-QHCPKHFHSA-N 396.490 5.075 30 20 GKED CN(Cc1cc(C#N)cs1)[C@@H]1CCSc2ccc(Br)cc21 513733919 XPXYTXAXLRKAGF-OAHLLOKOSA-N 379.348 5.051 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 514528309 GXZTYYDKYDXIHK-JTQLQIEISA-N 383.498 5.022 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 516176911 KILVAPVRNWMZEO-INIZCTEOSA-N 397.569 5.639 30 20 GKED CC(C)Oc1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 520856626 LLFJLCMQOWJQTK-MRXNPFEDSA-N 383.517 5.047 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cccc2ccccc12 521092106 ISGXFUORNSBRFC-UHFFFAOYSA-N 379.419 5.175 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 521617853 FPBLSXAFYOTDLZ-UHFFFAOYSA-N 393.462 5.282 30 20 GKED COc1ccc(CNc2ccc(C)c(C(F)(F)F)c2)cc1OCCCC#N 532725791 ZVKSVXLUKQCFLT-UHFFFAOYSA-N 378.394 5.317 30 20 GKED CCCC(=O)Nc1cccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 532886847 HKWQNELOINQOIU-UHFFFAOYSA-N 399.494 5.488 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccccc1 534622176 UDBNWQADLFSVHF-INIZCTEOSA-N 395.396 5.402 30 20 GKED N#CCCCCNC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl 534626878 PFTCDXNKHGIWDY-UHFFFAOYSA-N 376.287 5.090 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC1CC(c2ccccc2)C1 537491630 PQFBEFBKGDINPM-UHFFFAOYSA-N 397.478 5.576 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)Nc1ccccc1C(F)(F)F 540047059 MXPMNWISJSYNHE-JTQLQIEISA-N 384.810 5.350 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)nn1[C@@H](C)C1CC1 540730777 RVTVNICQWWRHMY-AWEZNQCLSA-N 382.533 5.007 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 541102991 MZLIJHZWQOYEKX-UHFFFAOYSA-N 380.460 5.424 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(-c3cccs3)o2)cc1 543094470 DLVOUDDPCOZOGF-UHFFFAOYSA-N 390.386 5.084 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc2ncsc2c1 547944736 KHENIRDOJARPFF-MRXNPFEDSA-N 392.528 5.097 30 20 GKED N#Cc1cccc(C2(NC(=O)CCCc3cc(Cl)sc3Cl)CC2)c1 552471849 VWGQDYFBTMIIJU-UHFFFAOYSA-N 379.312 5.055 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)ccn1 562577070 QAEAGRIZEJOLHY-UHFFFAOYSA-N 381.391 5.258 30 20 GKED COc1ccc([C@@H](CCC#N)NCc2ccc(-c3csc(C)n3)cc2)cc1 565461268 QKFSCURGUBAMJY-OAQYLSRUSA-N 377.513 5.262 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCC1 577202017 JZYBYVOAPOBQFS-KKSFZXQISA-N 379.529 5.601 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NC3(C(F)F)CCCC3)c2)cc1 588992786 HIQZFMXYNSDNDG-UHFFFAOYSA-N 399.441 5.031 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(CC#N)cc3)cc2)cs1 591594648 COSVKKSJRSIUKA-UHFFFAOYSA-N 379.510 5.062 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 604497265 GBEOTGUMWXGSAB-UHFFFAOYSA-N 399.498 5.064 30 20 GKED CC(C)c1nc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cs1 608805105 WJYFGQZQRVAMQB-UHFFFAOYSA-N 379.510 5.218 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H]1CCC[C@H](C)C1 609078585 BBVADCGPLAGNMZ-LAUBAEHRSA-N 391.515 5.488 30 20 GKED CC[C@@H](Nc1ccccc1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 609240718 HJDNVBHXWDHXJG-XMMPIXPASA-N 399.494 5.161 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1c(Cl)cccc1Cl 609581086 CHEKVVFIPGCOCN-AWEZNQCLSA-N 375.299 5.407 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(CSC3CCCC3)c2)c(F)c1 610144156 WARKAEGAIIMCQD-UHFFFAOYSA-N 383.492 5.195 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@@H](C)c1cccc(C#N)c1 610543458 WCGYMDPROKMGPU-KBPBESRZSA-N 395.915 5.118 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)oc2ccc(Cl)cc12 613392563 URTVGSPMDIHKCE-MRXNPFEDSA-N 392.867 6.008 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cccc(F)c1Cl 622485050 CIZSESQRKVVPTR-ZDUSSCGKSA-N 399.693 5.531 30 20 GKED CC(C)[C@@H]1CCN1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646440915 PMDXIXDGXNEQKZ-LBPRGKRZSA-N 386.311 5.238 30 20 GKED CC[C@H](C(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1cccc(C(F)(F)F)c1 650352730 CPRATTHKSOXDJV-ZDUSSCGKSA-N 397.334 5.092 30 20 GKED CC(C)(C)c1ccc(CCCC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)cc1 727627719 PQPUGSFPHUVCRJ-GOSISDBHSA-N 396.918 5.308 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(/CCCC(=O)O)c2nc3ccccc3s2)cc1 728699696 IMSFRCOMTDPZDN-WIZMWCRPSA-N 392.480 5.383 30 20 GKED CC(C)CCO[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 729069949 JIZXRJFEBMIJCY-CZUORRHYSA-N 376.909 5.091 30 20 GKED CCOc1c(OC)cc(/C=C2/Cc3c(ccc(Cl)c3Cl)C2=O)cc1OC 729151032 NZVWNXPINCRPFX-GHXNOFRVSA-N 393.266 5.232 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416531 FLGCSYXSJYECKA-PBHICJAKSA-N 396.487 5.511 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)c1 733805251 PJDSJTHVYFYPOQ-GGAORHGYSA-N 391.515 5.031 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(C2CCCC2)n1 735318951 SKQNSQJEGYSODW-UHFFFAOYSA-N 378.950 5.790 30 20 GKED N#C[C@H](C(=O)/C=C/C1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 735593386 KOTHSCSGAQMYDU-UHPIZROJSA-N 388.467 5.263 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)c2)s1 739590758 PENUOQYLCGOFAK-HOTGVXAUSA-N 392.446 5.272 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1cc(Cl)cc(Cl)c1 745695084 PWTJHNRKKLYBGW-UHFFFAOYSA-N 392.355 5.720 30 20 GKED CC(=NNc1ccc(Br)cc1)c1c(C)nn(-c2ccccc2)c1C 746490198 SHELFUBMVCVIPH-UHFFFAOYSA-N 383.293 5.088 30 20 GKED C=C(C)COc1cc(/C=C\C(=O)c2sccc2Br)ccc1OC 747064007 SIYSMHMMWHICAB-XQRVVYSFSA-N 393.302 5.370 30 20 GKED N#CCN(C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)c1ccccc1 747652223 ACWMSCVXTVFJAZ-UHFFFAOYSA-N 381.410 5.211 30 20 GKED CCS[C@@H]1CCC[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748942192 NGWNMVPSQWOECI-NJDAHSKKSA-N 379.529 5.138 30 20 GKED CC[C@H](Oc1ccccc1C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 750689901 NDZCENJMXGKSAC-HOCLYGCPSA-N 384.888 5.292 30 20 GKED CCc1cccc(CC(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 752488566 UNQNRHPYZHURGZ-OAHLLOKOSA-N 382.435 5.070 30 20 GKED CC#CCCCC(=O)N(Cc1ccc2ccccc2n1)c1ccc(N(C)C)cc1 767113824 FDWPKHVUYODAQN-UHFFFAOYSA-N 385.511 5.028 30 20 GKED Cc1cc(NC(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)nn1CCC#N 768048300 UZGDKCSJEZFNNF-NTMALXAHSA-N 396.903 5.139 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 774037762 OPTOPDZIHVQLNN-AWEZNQCLSA-N 393.468 5.133 30 20 GKED CCC(C)(C)NC(=S)Nc1cc(C(F)(F)F)ccc1SCCC#N 774175098 CWHPAIWIOUEHEO-UHFFFAOYSA-N 375.485 5.186 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21 776959342 XNMGOQBQHHIUSE-RQGSJKACSA-N 389.499 5.168 30 20 GKED CCN(C(=S)Nc1ccc(Br)cc1)[C@@H](C)c1ccc(C#N)cc1 783728212 AZTMJYYKQMFARR-ZDUSSCGKSA-N 388.334 5.101 30 20 GKED Cc1ccncc1/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 783906261 GWUGKVJCOJNVPX-UKSYNSBOSA-N 387.870 5.351 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1csc(Cl)c1 787186964 UQYNRHVVIIOARO-PLNGDYQASA-N 376.846 5.329 30 20 GKED N#C[C@H](C(=O)COc1ccc2oc3c(c2c1)CCCC3)c1nccc2ccccc12 792108791 ZDFMMVYGRIQBNQ-OAQYLSRUSA-N 396.446 5.115 30 20 GKED Cc1ccc(Cl)c(NC(=S)NCc2ccc(C#N)c(Cl)c2)c1Cl 800825577 LICBUHKBORLVJG-UHFFFAOYSA-N 384.719 5.314 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3cc(Cl)c(O)cc3F)c2)cc1 805256002 HPCNPFOPRDEORF-UHFFFAOYSA-N 381.794 5.052 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(C#N)cc2C(F)(F)F)ccc1SC 811689856 NOFIXMMLSOCNEY-ALCCZGGFSA-N 377.387 5.204 30 20 GKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1O 815636245 RPNLBWGFCKOCSZ-OALUTQOASA-N 377.315 6.175 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 817324849 QTZRMYHRXWGTGX-HXUWFJFHSA-N 393.487 5.199 30 20 GKED CC(C)(C#N)CCCOC(=O)c1c(F)ccc(C(F)(F)F)c1Br 860241335 JBRAVRAGTLQRMD-UHFFFAOYSA-N 396.178 5.094 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3F)on2)cc1 915086329 TVUHKMVXQGADBN-HXUWFJFHSA-N 397.409 5.388 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915086918 YLAGMAVARRYSDS-RUZDIDTESA-N 397.522 5.436 30 20 GKED CCc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1C(C)(C)C 918126461 BQDJSTUILVLWCU-HXUWFJFHSA-N 386.499 5.108 30 20 GKED CC(C)CN(CCC#N)Cn1nc(-c2ccco2)n(C2CCCCC2)c1=S 919944750 ODJKVQIFNLFHMA-UHFFFAOYSA-N 387.553 5.008 30 20 GKED Fc1ccc(-c2nc(CON=Cc3ccc(Br)cc3)cs2)cc1 920760052 OYWJEQBDJFZPBQ-UHFFFAOYSA-N 391.265 5.262 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3ccsc3)n2)cnn1-c1ccc(F)cc1 920992016 YEYBXJQYCUODPD-DAXSKMNVSA-N 395.484 5.401 30 20 GKED CCCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(C(F)(F)F)c1 1776033440 HKIFMEFBJHXFDW-UHFFFAOYSA-N 384.785 5.673 30 20 GKED CC(C)CC(Cc1ccc(Cl)cc1Cl)=NNc1ccc(C(=O)O)nc1 1776069522 OSEWXBHOXUJROG-UHFFFAOYSA-N 380.275 5.143 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)cc1)C(=O)O 1776469891 ZGRFIXBIDQFGPE-STKCSNAVSA-N 378.468 5.482 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@H](CC(=O)O)c2ccc(C)cc2)cc1 1776785862 LSQNVPVYJDPXDN-HSZRJFAPSA-N 395.543 5.844 30 20 GKED CCOc1cccc(F)c1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776939645 MKPJNHORDRUKIE-KHPPLWFESA-N 380.371 5.079 30 20 GKED C=CCN(CC(=O)Nc1c(CC)cccc1CC)Cc1ccc(Cl)s1 8164002 OQTODBFBFMLSJJ-UHFFFAOYSA-N 376.953 5.153 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)c(C)c1)=C(/S)Nc1ccccc1 10170421 ZBVMASIJGHLPLQ-UHFFFAOYSA-O 389.544 5.204 30 20 GKED COc1ccc(Cl)cc1/N=C(\O)Cn1c2ccccc2c(=O)c2ccccc21 11246829 RYIITRJILSJIJI-UHFFFAOYSA-N 392.842 5.105 30 20 GKED C=CCn1c(S[C@H](C)C(=O)N2CCC[C@@H]2c2cccs2)nc2ccccc21 22351778 WNPBIKGPMLYVLI-CRAIPNDOSA-N 397.569 5.128 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(F)cc2)[n+]2cccc(C)c2)cc1 28781582 GPFQJOPGZRCEKT-UHFFFAOYSA-O 393.507 5.035 30 20 GKED COCc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 41514747 HUUCPDLICCPBMD-KRWDZBQOSA-N 382.872 5.100 30 20 GKED N#C[C@@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc(-c2ccccc2)cs1 41535978 BQWFIPGBTPPLEA-IBGZPJMESA-N 385.492 5.491 30 20 GKED N#C[C@H](C(=O)c1ccccc1C(=O)c1ccc(F)cc1)c1ccc2ccccc2n1 48855469 RPDSAFRDPXICQH-NRFANRHFSA-N 394.405 5.095 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1C 60043658 ULZGNMNQKHSRLE-HNNXBMFYSA-N 382.510 5.241 30 20 GKED Cc1ccc(CCCCC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 63594609 XBYFSCJHBXUJRG-UHFFFAOYSA-N 388.433 5.171 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc(Cl)cc3)n2)cc1 66545039 KEWHOQHIPOFWOO-CXKPLTABSA-N 389.867 5.225 30 20 GKED COc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 66955051 UTNYZLHPHXZKIM-WMZOPIPTSA-N 395.528 5.111 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3cccc(OCCCC#N)c3)o2)cc1C 130025305 FRCPPWVNNWRPNQ-KRWDZBQOSA-N 376.460 5.209 30 20 GKED CCN(CCC#N)C(=O)c1oc2ccccc2c1CSc1ccccc1F 133515935 BHPWIWMVFIQPHP-UHFFFAOYSA-N 382.460 5.240 30 20 GKED C#Cc1cccc(NC(=O)c2ccccc2CSc2nc3ccccc3o2)c1 139760996 NYZUARYUDHAUCD-UHFFFAOYSA-N 384.460 5.354 30 20 GKED Cc1cc(-c2noc(CNc3ccccc3SC[C@H](C)C#N)n2)ccc1F 157818158 KWLXWQDFFRJRHO-CYBMUJFWSA-N 382.464 5.048 30 20 GKED N#C[C@H](NC(=O)c1ccccc1SCc1cccs1)c1ccccc1F 161404400 SKGKGTOJXGXLEU-SFHVURJKSA-N 382.485 5.174 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCC3(CC3)C2)cc1Cl 184141385 NBFXCHZAQKQIQP-IBGZPJMESA-N 379.891 5.403 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(F)cc1Br 189875067 UKERANUCSGXIHX-UHFFFAOYSA-N 376.269 5.692 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2cn(-c3ccccc3)nc2-c2cccs2)cn1 214920418 HVADNHKRCQEHQD-KHPPLWFESA-N 388.496 5.274 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303289856 MEBGQHIDDJBPID-ZWKOTPCHSA-N 396.556 5.776 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 303719657 VXEBSWXZFDAACM-YLJYHZDGSA-N 381.501 5.146 30 20 GKED C[C@@H]1CCCC[C@@H]1/N=C(/O)C1CCN(c2noc3ccc(Cl)cc23)CC1 328729988 FVHLRFAJDYWWKB-DYVFJYSZSA-N 375.900 5.233 30 20 GKED N=C(O)C1CCN(Cc2cccc(N=C(O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)c2)CC1 328978980 CRNHPQQLBVBNGX-VLCRHTCISA-N 397.563 5.628 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H]1CCCC(F)(F)C1 409996748 HBAFUIWWWJQPTI-CMPLNLGQSA-N 389.286 5.251 30 20 GKED O=C(CCCC(F)(F)F)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 410096621 TWEIHWPDSHMVFQ-UHFFFAOYSA-N 385.323 5.225 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 411512182 RCVJLCZECGAIHH-QKLQHJQFSA-N 385.294 5.332 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1cccc(Cl)c1 430638245 FBISYLUKCKGJMH-OAHLLOKOSA-N 398.919 5.078 30 20 GKED COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)cc1 437663012 VURJPTVKQKVECK-LJQANCHMSA-N 399.494 5.232 30 20 GKED CC(C)c1nc2ccc(N[C@@H](C)C(=O)N(CCC#N)c3ccccc3)cc2s1 439575563 RXLMBBHUNDZGIR-INIZCTEOSA-N 392.528 5.167 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 441059280 GNFKFRNNKCMDDW-HNNXBMFYSA-N 393.478 5.343 30 20 GKED C[C@@H](NC1CCC(C)(C#N)CC1)c1cccc(NC(=O)Cc2ccccc2F)c1 449082731 PKOZGGJJLFVMHS-RAMCEHFNSA-N 393.506 5.130 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cs1 464421843 OFZIXQYWAOKKLY-AWEZNQCLSA-N 387.386 5.022 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464463762 FXOXBWJBKRWJSF-CRAIPNDOSA-N 397.400 5.196 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)c2ccccc21 468810352 CQPZLPMYZWPYAN-IBGZPJMESA-N 399.416 5.369 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1OC)C1CC1 475555431 MFTAZYUOBIQFLT-UHFFFAOYSA-N 378.516 5.744 30 20 GKED N#CCCn1cc(CN[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c(-c2ccccc2)n1 475674162 YAQMWNNILIHYTO-XYWHTSSQSA-N 390.918 5.153 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(-c3nc4cccc(Cl)c4s3)cc2)ccn1 476270867 GDIFBABBJVFWSC-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(-c2ncc(C)o2)c1 480581438 CGUDEDPJNRFETG-UHFFFAOYSA-N 387.892 5.585 30 20 GKED N#CCCCOc1cccc(NC(=O)N[C@H](C2CCCCC2)C(F)(F)F)c1 482287164 XGTMXXSVZQHFSH-QGZVFWFLSA-N 383.414 5.002 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)s1 487032757 GVMKWWWZRJRZRQ-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1 487302934 WOVGPWGHDFPSKL-GGPKGHCWSA-N 386.417 5.360 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(CN2CCSCC2)c1C)c1ccccc1 488713156 QYDXLGFLUOYVMY-JOCHJYFZSA-N 394.584 5.232 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(C(C)C)cc2)cc1C 497191639 RSWKRMLCNJJCRT-UHFFFAOYSA-N 386.499 5.456 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(Sc4ccccn4)cc3)CC2)cc1 503910638 NPIMMOSTZSOJRQ-UHFFFAOYSA-N 397.503 5.034 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccccc1OC)C[C@H]1CCCO1 505056191 ARYDEEMXKLWDLO-OAQYLSRUSA-N 394.515 5.027 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1 509720738 UDEGTJITBYKRRQ-MJGOQNOKSA-N 387.405 5.229 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@H](C#N)c3nc4ccccc4s3)cs2)cc1 509884815 KEKCVQSJKVMARW-HNNXBMFYSA-N 389.505 5.142 30 20 GKED COC(=O)[C@H](Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Cl)c1Cl 513438837 UBZPDPMIIRLRTG-QGZVFWFLSA-N 377.271 5.121 30 20 GKED CCCCOc1ccc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)c(C)c1 516471002 ZMBSFXCTCXLMRC-UHFFFAOYSA-N 379.504 5.490 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CSc1ccc(F)c(F)c1 517049155 RCBSJUFWZCRRDY-UHFFFAOYSA-N 394.446 5.162 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(Cl)c3Cl)cc2)c1 518229600 SJHOBHFJJKGKFO-UHFFFAOYSA-N 383.234 5.910 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1Cl 518677455 PCFZVLNLSVRINX-FQEVSTJZSA-N 378.863 5.452 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(CSCC)c1 520270153 UXCXVKIEYIHDML-UHFFFAOYSA-N 386.565 5.327 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccccc1Cl)C(C)C 523781308 CQEBIFBINDPTMX-NRFANRHFSA-N 381.907 5.307 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 524572722 PIURYWMLANAZLL-LRDDRELGSA-N 379.312 5.164 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 533993754 DBFQIKWIWHYFBT-MGPUTAFESA-N 379.891 5.240 30 20 GKED Cc1cccc(-c2nc(C)c(C(=O)Nc3ccccc3SC[C@@H](C)C#N)[nH]2)c1 536049419 HXYHZJUSJUSAIO-HNNXBMFYSA-N 390.512 5.198 30 20 GKED C=CCN(C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)C1CC1 539016936 VINFKAVLJQKPRN-ZDUSSCGKSA-N 375.925 5.193 30 20 GKED CCCN(CC)Cc1ccc(C(=O)N(CC)c2ccc(C#N)c(Cl)c2)cc1 540273555 OUHGEEAULYLGQJ-UHFFFAOYSA-N 383.923 5.110 30 20 GKED COc1cccc([C@@H](NCCCC2(C#N)CCOCC2)c2ccccc2Cl)c1 540809931 ZNNLVWFKYWMJAH-JOCHJYFZSA-N 398.934 5.128 30 20 GKED Cc1nc(C)c(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541095645 XTKQWBSJLACDEP-CYBMUJFWSA-N 376.485 5.181 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c1 541447239 SFWISKCWCGJYOI-RTBURBONSA-N 393.556 5.577 30 20 GKED N#C[C@H](C(=O)c1ccccc1OC1CC1)c1nc(-c2ccc(Cl)cc2)cs1 554319518 FMLROIQQZKTDQL-QGZVFWFLSA-N 394.883 5.495 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1c[nH]c2cccc(Cl)c12 555993856 IYFOVNXFSKFSKD-CYBMUJFWSA-N 383.904 5.397 30 20 GKED Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NCc1ccc(F)c(C#N)c1Cl 556338014 DFJRHWNFABGXBH-AWEZNQCLSA-N 399.897 5.143 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)C3(c4cccc(Cl)c4)CC3)cc2)ccn1 574091080 BKTJDSLAHYTQDL-UHFFFAOYSA-N 389.842 5.069 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@@H](C)[C@@H](C)CC4)ccc12 574286686 ABFLQRDYWAXHEK-AAEUAGOBSA-N 391.496 5.120 30 20 GKED CC(C)Sc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 591862055 LCMQJSHXPGJYTC-CQSZACIVSA-N 386.929 5.940 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(OC)c(Cl)cc1C1CC1 594205429 CRAPTXQJYHSSKJ-UHFFFAOYSA-N 397.906 5.542 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccc(OC)cc2)[C@@H](C)C2CC2)c1 595762977 ROYWQSLENXMIHI-SFHVURJKSA-N 394.515 5.483 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccnc1Oc1ccccc1 603689268 FZQNNSURELGNEX-UHFFFAOYSA-N 386.455 5.190 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603690049 GKQMSFLXBVQGKD-UHFFFAOYSA-N 390.468 5.027 30 20 GKED N#C[C@@H](C(=O)c1oc2ccccc2c1CSC1CCCCC1)c1ccccn1 603835756 XSYULSWOBFQYJJ-GOSISDBHSA-N 390.508 5.884 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc2cc(F)ccc2o1 605083647 UXCLXSVYTXBFIX-UWVGGRQHSA-N 397.290 5.211 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl 607655533 HIGWRWXWPVOBCJ-UHFFFAOYSA-N 379.932 5.078 30 20 GKED C[C@H](C#N)CN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)C1CC1 611086215 JKJKKVBHQSUPES-CQSZACIVSA-N 399.288 5.006 30 20 GKED C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 611548665 DQBHLNNWXCIVJT-PBHICJAKSA-N 388.389 5.154 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)(F)F)nc3)n2)cc1 613314200 BPLGTZGQQYRXPA-AWEZNQCLSA-N 387.386 5.022 30 20 GKED CC(C)(C#N)CC[S@](=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 616183055 VBXRXHSNHBNYIV-VWLOTQADSA-N 386.464 5.017 30 20 GKED CCc1ccsc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 619753822 RGJWNFHZFGMUJV-LLVKDONJSA-N 380.416 5.429 30 20 GKED C=CCC1(NCc2csc(CC(=O)Nc3cc(C)ccc3C)n2)CCCCC1 625935463 AXWKMHDMWXTKJW-UHFFFAOYSA-N 397.588 5.310 30 20 GKED Fc1ccccc1-c1nc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cs1 674460266 ORHVINBXIFUGKO-VXGBXAGGSA-N 398.347 5.122 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(C(F)(F)F)c1 678208121 LNODBCLMGVBOCT-UWVGGRQHSA-N 397.256 5.407 30 20 GKED CCOc1cc(/C=C2\CCOc3ccccc3C2=O)ccc1OCC(F)(F)F 728441688 OMAZMEXNZHQWKU-RVDMUPIBSA-N 392.373 5.075 30 20 GKED C#Cc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(OCC)cc2)cn1 728801936 HUWPXYCPLUNCGO-UHFFFAOYSA-N 392.842 5.160 30 20 GKED FC(F)(F)c1cc(NN=C2CCCCc3ccccc32)nc(-c2cccnc2)n1 733080563 QKDDZRGVYFQCIJ-UHFFFAOYSA-N 397.404 5.100 30 20 GKED CCc1nc(C)c(C(C)=NNc2ncnc3sc(-c4ccccc4)cc23)s1 735227762 HIPQCFBRRFNYBJ-UHFFFAOYSA-N 393.541 5.522 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)SCc2cc(Cl)ccc2OCC#N)c(C)c1 735317515 BVOSDKFMINZIRF-OAHLLOKOSA-N 388.920 5.120 30 20 GKED COC(=O)[C@@H](Nc1ccc(Oc2cccc(Cl)c2)cc1)c1ccc(C#N)cc1 739997950 ZLWAAFGTEOPTQC-NRFANRHFSA-N 392.842 5.330 30 20 GKED O=C(/C=C/c1cccc(OCC(F)(F)F)c1)c1cccc(-c2ccncc2)c1 741474310 XEAXWJXMZFWAML-BQYQJAHWSA-N 383.369 5.586 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(Br)cc1Cl 742433113 PPXGPJIBDKOZDT-SOFGYWHQSA-N 381.701 5.393 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)C1CCCCCCC1 744029740 UQUBBMPITREQPF-HXUWFJFHSA-N 390.483 5.487 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@@H](Cc3ccccc3)c3ccccc3)[nH]c12 744161631 VYJXHOXNAGLQFP-FGZHOGPDSA-N 393.490 5.464 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)N[C@@H](CCC#N)c1ccccc1 747988606 UTZGWVSJSKEGAP-IBGZPJMESA-N 389.421 5.282 30 20 GKED Cc1ccccc1[C@H](OC(=O)[C@H](C)Oc1ccccc1C#N)c1cccs1 748501224 AMTGOZXIBVGFDF-KKSFZXQISA-N 377.465 5.028 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2ncc(-c3ccccc3Br)o2)s1 749005634 MLDSVHDCWYTTRT-VGOFMYFVSA-N 391.677 5.774 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)c1C 750909528 MOIOUYSQVLHGGV-LUAWRHEFSA-N 377.469 5.286 30 20 GKED O=C1C(=Cc2cnc(-c3ccc(Br)cc3)s2)C(=O)c2ccccc21 751527839 ZOCNCJRUOPCMJT-UHFFFAOYSA-N 396.265 5.035 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(N2CCCCC2)c(F)c1 753142060 NPDHTHGQUJVFTP-FNORWQNLSA-N 393.487 5.231 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@H]1C)c1ccncc1 756041608 YIVUSGAIGANYHK-BFUOFWGJSA-N 390.314 5.335 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1)C(C)C 756489294 ZTMCYKCNTCGFBX-UHFFFAOYSA-N 397.466 5.243 30 20 GKED C#CCOCCC(=O)N(c1ccc(C(C)C)cc1)c1nc2ccccc2s1 756489943 ZPQIMEKYGNIHFO-UHFFFAOYSA-N 378.497 5.124 30 20 GKED C#CC[C@H](NC(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 757881192 RHISZVGQAGLTPS-QHCPKHFHSA-N 397.478 5.133 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 764930840 VSGDFWDIPLCJJF-UXHICEINSA-N 398.506 5.363 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2csc(-c3csc(C)n3)c2)c1 772982084 DOQPEMGQDYFYKO-KDOFPFPSSA-N 397.569 5.712 30 20 GKED C[C@@H](N[C@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccc(OCC#N)cc1 776164792 UMWQRNWGTJVEIH-MWTRTKDXSA-N 394.877 5.822 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc2cc(Br)ccc2c1 780162443 HKKAJCILSATYJN-CYBMUJFWSA-N 395.256 5.145 30 20 GKED CC[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1cccc2ccccc12 783274076 CDBMUDLLMUTBLF-XMMPIXPASA-N 385.511 5.236 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2coc3cc(F)ccc23)cc1 796630211 OIHKPOVWDVNUFO-ACJLOTCBSA-N 378.403 5.047 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCC(F)(F)C2)cc1 800519271 NCJHOUOEHYNOEF-JXFKEZNVSA-N 383.442 5.289 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1cc(Cl)nc2ccccc12 801664938 CHCCTVBELOHQPO-UHFFFAOYSA-N 394.261 5.085 30 20 GKED O=C(NC[C@@H](c1ccccc1)C(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801692601 SBJYHDSWZCMCCJ-GJZGRUSLSA-N 393.302 5.178 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)OCc2ccccc2C(C)(C)C#N)cc1 801904936 AHEFCVDYLBZRIO-KRWDZBQOSA-N 377.484 5.173 30 20 GKED Clc1ccccc1COc1cccc(Cl)c1C=NN[C@H]1CCSC1 808001864 HSBWLZAXWZAMIL-AWEZNQCLSA-N 381.328 5.001 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2ccc(C3CCC3)cc2)cc1 814768781 ASOVDKNVPBFYSS-UHFFFAOYSA-N 382.920 5.374 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1cccc(C(F)(F)F)c1 819840462 QILPKHXUNJEOAV-QXMHVHEDSA-N 383.369 5.576 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)c(F)c1)c1ccc(Cl)c(Cl)c1Cl 844239542 JQUUYNSBMQSALT-KXFIGUGUSA-N 396.636 5.263 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCc1ccc(C)c(Cl)c1 916903613 PTOJVQHQLUYKCN-IBGZPJMESA-N 396.918 5.053 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(Oc3ccccc3)c2)cc1 916910336 OZFMUJOHJREQNC-JOCHJYFZSA-N 384.435 5.002 30 20 GKED N#C[C@@H](C(=O)CCc1cccc(Cl)c1)c1nc2cc(Cl)ccc2s1 917046154 GMQRWHGUYJRZJV-AWEZNQCLSA-N 375.280 5.412 30 20 GKED CCc1cccc2c(C3CCN(C(=O)/C=C\c4ccccc4C#N)CC3)c[nH]c12 918678308 WBYPRYPNMLKEGV-KHPPLWFESA-N 383.495 5.021 30 20 GKED COc1ccc(COCc2cccc(N=Cc3cc(Cl)ccc3O)c2)cc1 921138294 CKPUNMWSMBINGF-UHFFFAOYSA-N 381.859 5.522 30 20 GKED N#CCCC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CC(F)(F)F)C2)c1ccccc1 922602791 NJDUSCMVFKVEBX-FHWLQOOXSA-N 393.453 5.327 30 20 GKED C=CCc1cc(C)c(OCCCN2CCC(CC(C)C)(C(=O)O)CC2)cc1C 1776186252 ZNXYSGFBOVRXFE-UHFFFAOYSA-N 387.564 5.014 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)CC2CCCCC2)c1 1776787462 VGRHDSYBIYLSBG-QFIPXVFZSA-N 389.580 5.939 30 20 GKED CCc1c(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)oc2ccccc12 1776956221 IZDCXHOBNYCHDG-BQYQJAHWSA-N 399.240 5.352 30 20 GKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c(Br)c1 18117035 MFUOTUKHJUEAFV-UHFFFAOYSA-N 391.268 5.549 30 20 GKED Cc1ccc(F)c(N/C(S)=C(/C(=O)c2ccccc2C)[n+]2cccc(C)c2)c1 68313848 BWQKNFRPVQOPCV-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)ccc1Oc1cccnc1 119861500 TWZGUZXZSGLZMA-NRFANRHFSA-N 386.455 5.349 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 129172300 LTMINHBJVJIPOJ-UHFFFAOYSA-N 399.494 5.072 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(NC(=O)CC(C)C)ccc2Cl)s1 151975335 VDPRDFAUMDEWJZ-UHFFFAOYSA-N 389.908 5.072 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1cccc(Cl)c1 181411876 AJWMLXBHJGMLST-LSDHHAIUSA-N 387.936 5.024 30 20 GKED CCCN(CCc1cccs1)C(=O)Nc1ccccc1S[C@H](C)CC#N 187129432 BTWWHQNJTKBARS-MRXNPFEDSA-N 387.574 5.629 30 20 GKED CC(C)c1ccccc1-n1c(S[C@@H](C)CCC#N)nnc1-c1cccnc1 188221007 UNJMVNFXBDHWCJ-INIZCTEOSA-N 377.517 5.237 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)S2 189880186 QXJONEJBBDYOPM-AWEZNQCLSA-N 380.513 5.224 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)o1 193607361 LNFRBKUCWGWJSH-UHFFFAOYSA-N 389.455 5.207 30 20 GKED COc1ccc(CNc2ccc(OC3CCCC3)c(F)c2)cc1OCCCC#N 237403287 UKABCZCBVLDPDQ-UHFFFAOYSA-N 398.478 5.450 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC[C@H](c2nc3ccccc3o2)C1 301528513 OGDOSEZIILILDD-AWEZNQCLSA-N 388.858 5.285 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCc2cccs2)c1 303674750 QCSWEVOXYPETNO-UHFFFAOYSA-N 382.872 5.038 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c(Br)c1 321628196 WMJFUEMMDUDEMI-UHFFFAOYSA-N 389.318 5.212 30 20 GKED O/C(=N/Cc1cccc(C/N=C(/O)[C@@H]2CC23CCCC3)c1)[C@H]1CC12CCCC2 329032798 QFHWCFTVOONEEQ-BGYRXZFFSA-N 380.532 5.760 30 20 GKED Cc1nc2c(c(C(F)(F)F)n1)C[C@H](/C(O)=N/[C@@H]1CC[C@@H]3CCCC[C@H]3C1)CC2 329857259 YYNAHMYWAQNODA-CAOSSQGBSA-N 395.469 5.224 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@H]3C)c(C(F)(F)F)o1 410981792 OJUMGYBGYZIKHJ-DTWKUNHWSA-N 382.407 5.478 30 20 GKED CC(=O)c1ccc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 419510048 STHQCZYFTSRGLU-HNNXBMFYSA-N 398.553 5.013 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCc2sc(Cl)cc21 426063263 SHYSDYBZLXIVGE-KRWDZBQOSA-N 387.936 5.272 30 20 GKED N#Cc1c(F)cccc1CN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 428349246 QYYNDMCBAMLKPJ-HNNXBMFYSA-N 376.275 5.109 30 20 GKED N#CCCC[C@H](NCc1nn(-c2ccc(F)cc2)c2c1CCC2)c1ccccc1 433021791 YOITZIUSBORBFR-QFIPXVFZSA-N 388.490 5.025 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CSCc1ccccc1 439965934 IKPKFOKUKZDDEN-IRXDYDNUSA-N 384.570 5.589 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)NCC1CCC(C#N)CC1 440935307 JDASIWSCVVIUMM-UHFFFAOYSA-N 379.529 5.598 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443882598 KCEOBMMECPLQOX-QGZVFWFLSA-N 385.467 5.524 30 20 GKED COc1ccc([C@@H](N[C@H]2CC[C@@H](CC#N)C2)c2ccccc2Cl)cc1OC 453288297 GRPIWVKWMCJZFO-GIMINZRKSA-N 384.907 5.119 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 464954021 SNUIAYDDUOPKQJ-JBXUNAHCSA-N 380.491 5.242 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1cccs1 465728818 XFPJSUYPTFQBQA-HSALFYBXSA-N 381.545 5.317 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F 473771015 XBHPZRGQXJPCAJ-UHFFFAOYSA-N 380.414 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H](OC)c1ccccc1F 475589135 YVYPHQWERUBFGU-ZHRRBRCNSA-N 384.495 5.575 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCN1C(=O)CSc2ccccc21 476119392 HRLVRXIPNSIWMX-UHFFFAOYSA-N 394.540 5.006 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2c(O)c(Cl)cc(Cl)c2Cl)cc1 476570612 JKUHTVFAFMGHRY-UHFFFAOYSA-N 383.662 5.406 30 20 GKED N#Cc1cccc(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)c1 480787909 SKDALYVKDOAZRP-SFHVURJKSA-N 379.916 5.502 30 20 GKED C[C@@](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)(C1CC1)C(F)(F)F 482655214 BUXDMMZDUGVQOA-HXUWFJFHSA-N 388.389 5.006 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(Cl)c1 483229637 OPOCIRZBHSOITI-IBGZPJMESA-N 378.859 5.557 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)Nc2nc3c(cc2C#N)CCCC3)c1 484178749 XUYFGWABHNFWDQ-UHFFFAOYSA-N 397.478 5.150 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1 485765310 DYCFXRJNNGQDKM-KRWDZBQOSA-N 394.540 5.232 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCc1cccc(C#N)c1 490683583 HWKJREQLAGBMIU-UHFFFAOYSA-N 379.529 5.613 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 494548657 OULYJTZYLJIXBQ-CQSZACIVSA-N 391.393 5.593 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(C)cc(OC)c(C)c1C 494728516 DMQLSPJSIUJVPQ-UHFFFAOYSA-N 384.524 5.008 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)cc1 498433195 BHYLRNRWHOLYJP-UHFFFAOYSA-N 386.451 5.064 30 20 GKED C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)N1CC=C(c2ccc(C#N)cc2)CC1 502530916 SXQVZZBUTDYMSO-HNNXBMFYSA-N 390.874 5.112 30 20 GKED N#C[C@@H](NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl)C1CC1 505961389 XUAKOYAZKKBSRZ-QGZVFWFLSA-N 396.899 5.410 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510138236 BZIMTSAWUYVGGY-UHFFFAOYSA-N 384.888 5.417 30 20 GKED N#CC1(CCCSCc2nc(-c3ccccc3Cl)cs2)CCOCC1 512383390 YBFYTXPYEFNQAH-UHFFFAOYSA-N 392.977 5.797 30 20 GKED COc1cccc(C(N[C@@H](C)c2ccc(C#N)cc2F)c2cccc(OC)c2)c1 512626158 SJSNBXHFANLRRH-INIZCTEOSA-N 390.458 5.155 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@@H](C)c2ccc(Cl)c(Cl)c2)n1 515850757 JWUSLJQQRZPEFY-JTQLQIEISA-N 381.284 5.290 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)sc2c1CCC2 518073758 FZMCYJWYUVWASV-OLZOCXBDSA-N 377.296 5.157 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@H]1CCc2ccccc21 519051554 IZNTYJORGQBBQW-QHCPKHFHSA-N 383.451 5.502 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(C(F)(F)F)nc3)c2)cc1 519125649 URVBDMNWBWBQKX-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc(-c2ccccc2F)s1 519427928 ZKCFXEGCQOYXPY-CYBMUJFWSA-N 397.500 5.453 30 20 GKED C=CCOc1cccc(NC(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)c1 521208250 IMWPHTGZLLCJDY-CQSZACIVSA-N 378.394 5.495 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 521327124 SMUDPDVMAJBYPN-MSOLQXFVSA-N 396.556 5.919 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]c3ncccc23)cc1Cl 521474912 GYYFQHKABLALCZ-GOSISDBHSA-N 386.842 5.124 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2cccc(Cl)c2)o1 521714443 HARHTOKZSCJTKD-UHFFFAOYSA-N 383.835 5.091 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 522660151 FIYQNZSDBYFMDF-CYBMUJFWSA-N 391.393 5.044 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1 523110797 FHOXRTDKXPXWEG-MRXNPFEDSA-N 388.433 5.193 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 525570557 JWQLWQQNXDMKAH-YVEFUNNKSA-N 380.797 5.233 30 20 GKED Cc1cccc(C(=O)N[C@@H](C#N)c2ccc(OCc3ccccc3)cc2)c1Cl 533650767 GBMCPGKAZSWBEJ-NRFANRHFSA-N 390.870 5.222 30 20 GKED C=CCC[C@H](NC(=O)c1cc(C)n(C(F)F)n1)c1ccc(C(F)(F)F)cc1 534204202 ZBFPBFOXBMCYCQ-AWEZNQCLSA-N 387.352 5.043 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCOc2c(Cl)cccc21 537270924 QVWFJLAFKYAJMP-FQEVSTJZSA-N 397.906 5.047 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(CN2CCCC2)cc1)c1cccc(C#N)c1 537296831 GXKQRBKIARBBIP-OAQYLSRUSA-N 395.550 5.672 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(Cl)ccc3OCC(F)(F)F)cc2)CC1 538499389 NNIMFDOAFAAVBW-UHFFFAOYSA-N 394.780 5.089 30 20 GKED Cc1ccccc1[C@@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 540363008 RCDWRVZVLBULKJ-SBUREZEXSA-N 395.572 5.172 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(Br)c(Cl)c2Cl)cc1 541632419 GQZAUBCDZBSXHI-UHFFFAOYSA-N 398.087 5.199 30 20 GKED C[C@@H](CC#N)NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 543586197 ZABVZWISRVVAJE-NSHDSACASA-N 382.382 5.028 30 20 GKED N#Cc1ccc(CSCc2nc(Cc3c[nH]c4ccc(Cl)cc34)no2)cc1 547165589 VWMXAIQTZYTLSJ-UHFFFAOYSA-N 394.887 5.100 30 20 GKED C=CCOc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)cc1OC 551395918 YIRRMYGVUIDLEN-UHFFFAOYSA-N 377.406 5.058 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)C[C@H](CC#N)c1ccccc1 553219798 MRYLQPJXPQMTBI-CBQOVEMMSA-N 376.500 5.082 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(-c2nccs2)c1 554426473 WMLYBWHJEUXDDT-UHFFFAOYSA-N 395.532 5.198 30 20 GKED C=CCC(C)(C)c1noc(C2CCN(C(=O)c3cccc4ccccc34)CC2)n1 556360874 CVWFSZMWQDTRHK-UHFFFAOYSA-N 389.499 5.096 30 20 GKED CC1=C(C)CN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)CC1 559384442 SVUSMIBAOJDTLX-UHFFFAOYSA-N 375.472 5.020 30 20 GKED CCc1cc(C#N)c(NC(=O)c2c(F)ccc(SCC3CC3)c2F)s1 568849004 HZDCCUOKGUZIBC-UHFFFAOYSA-N 378.469 5.215 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(Oc2nccc(C#N)c2Cl)cc1 574818332 QTLFKNQVLLMQGZ-UHFFFAOYSA-N 398.249 5.329 30 20 GKED N#CC1(CNC(=O)c2oc3ccccc3c2CSc2ccccc2Cl)CC1 578345691 VAYJZIOSHCRJGJ-UHFFFAOYSA-N 396.899 5.412 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccoc1C(F)(F)F 581282441 KZCHSZPAEHDPLM-UHFFFAOYSA-N 389.198 5.171 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)N[C@H]1CCc2cc(C#N)ccc21 589791057 GUNCHNTUZAELJU-CLOONOSVSA-N 395.506 5.519 30 20 GKED N#CC1(c2cccc(-c3cc(F)ccc3OC[C@@H]3CCCCO3)c2)CCOCC1 592982687 BATKXUXYTLVPQX-NRFANRHFSA-N 395.474 5.012 30 20 GKED CC[C@@H](NC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 604500708 YLDYVMJKJSAYPA-JOCHJYFZSA-N 398.466 5.083 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)C(C)(C)c2cccc(Cl)c2)cc1 605622090 DPWZPTLCUUXMIV-UHFFFAOYSA-N 396.918 5.071 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609031686 LHPPPTGGCYAIFI-KGLIPLIRSA-N 375.255 5.006 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3cccc(F)c3)cc2Cl)c1 609063218 QLVKTZGGGKFWQK-UHFFFAOYSA-N 394.833 5.111 30 20 GKED CCC[C@@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610321349 RHZPEPCIOCKHKZ-OXJNMPFZSA-N 378.476 5.178 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cccc(C(F)(F)F)c1 611093012 ZCFSPYUQLQNLCL-VIFPVBQESA-N 387.188 5.375 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 613356593 QQZFKBRWQCRWSW-ZDUSSCGKSA-N 397.849 5.007 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618807235 TVKATFQOMOJDDG-RNODOKPDSA-N 377.488 5.467 30 20 GKED C=CCC[C@H](C(=O)N1CCC(OCc2ccccc2F)CC1)c1ccccc1 681668331 XXYZNVBHRBEWKG-QFIPXVFZSA-N 381.491 5.083 30 20 GKED Cc1csc(-c2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2)n1 726489111 JJJXSWPPXBVDJK-UHFFFAOYSA-N 384.917 5.453 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 727233116 GFDNLYJBRXLCOE-BEFAXECRSA-N 399.466 5.425 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 727980979 XUOGEILOMVUCGL-UHFFFAOYSA-N 391.471 5.394 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)c1 728181792 CKUKYHWATYHODI-IRXDYDNUSA-N 391.458 5.631 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)N[C@H](C)c2cccs2)c1 728227867 WSSCQQOVMMYFGL-QGZVFWFLSA-N 376.550 5.372 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 731345490 YDUBHLSXILSGDY-UHFFFAOYSA-N 385.448 5.219 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1 735570808 QBNZURVAWMSGHN-UHFFFAOYSA-N 398.894 5.267 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 739157436 WLDLKHLVNBKZCL-DYVFJYSZSA-N 398.890 5.658 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2csc(-c3ccccn3)n2)cc1 741469223 KQBRBCDTFNXQMF-YPKPFQOOSA-N 398.487 5.777 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(SCC(F)F)cc1 741841379 GDLXOCAWZGHIIW-ZZXKWVIFSA-N 393.505 6.125 30 20 GKED CCCCN(CC(=O)[C@H](C#N)c1nc2ccccc2s1)[C@@H](C)c1ccc(C)o1 746164832 CJZYFHIBAUASBI-IRXDYDNUSA-N 395.528 5.237 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1)c1ccccc1 746326755 UMJARNWLHPGLSV-RJGXRXQPSA-N 396.506 5.131 30 20 GKED C(=NNc1cccc2ccccc12)c1cn(-c2ccccc2)nc1-c1ccncc1 747060571 YCIBGPGQTFJGNR-UHFFFAOYSA-N 389.462 5.534 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)cc1)c1ccc(Oc2ccccc2)c(F)c1 750913460 MZHALBFLUYPRQD-XYOKQWHBSA-N 385.398 5.095 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)c1cccc(N2CCOC2=O)c1 753712835 VBKVUNWQEWYYIJ-DAXSKMNVSA-N 395.764 5.212 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3ccc(C)cc3o2)cc1OCCCC#N 754831078 VJPOLYABRUIVRM-TWGQIWQCSA-N 375.424 5.329 30 20 GKED Cc1cnc([C@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 755755238 CTBJLKIEAJMHII-QRWLVFNGSA-N 390.512 5.032 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 760180725 IUIVYJAKTVNXTG-QGZVFWFLSA-N 390.508 5.470 30 20 GKED C[C@@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1cccc(C#N)c1 762234885 QQSNMQPHQIAZBE-YXHQGMJNSA-N 378.781 5.035 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2[C@H]3CC[C@H]2c2ccccc23)c1=S 765024523 FRWHOIQFRUJKTC-IRXDYDNUSA-N 380.542 5.178 30 20 GKED C=CC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccncc1 766018760 ITIUCAKKYSXGQU-WOJBJXKFSA-N 391.540 5.498 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F)c1ccncc1 766800808 REJCWVCAVWNKAA-CLCXKQKWSA-N 391.437 5.209 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(OCC3CCOCC3)cc2)CC1 770404924 UHOBQYBCHWEOOV-UHFFFAOYSA-N 390.527 5.308 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(NC(C)=O)c(Cl)c2)cc1 776805113 PGJQRBGOOQVHNM-CYBMUJFWSA-N 379.287 5.603 30 20 GKED CC(C)c1nc(/C=C2\CCc3ncc(C(F)(F)F)cc3C2=O)c2ccccn12 777470039 QNGYLPFYNNAIGW-UKTHLTGXSA-N 385.389 5.084 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(C)=C/c3ccc(C)cc3)n2)cc1 779195143 RKCLJMDYEBGHNI-GRFAERAESA-N 388.492 5.407 30 20 GKED CC(=O)Nc1ccc(C(C)=NNc2nc3cc(C(F)(F)F)ccc3s2)cc1 781592389 DLAUEJUKTVKBMS-UHFFFAOYSA-N 392.406 5.110 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2cc(F)ccc2s1 786401370 IPCWETSBTVPXBZ-GMTAPVOTSA-N 376.865 5.130 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1ccnc(F)c1 794889278 XWKOMDISIBNJCP-UHFFFAOYSA-N 377.448 5.037 30 20 GKED CC(C)(C#N)CCCOC(=O)Cc1csc2ccc(Br)cc12 795881109 AVQNGQZVVYCTIZ-UHFFFAOYSA-N 380.307 5.079 30 20 GKED Cc1cc(Cl)nc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 800519896 XZSBSZMVMZMPPM-HXUWFJFHSA-N 390.874 5.021 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 806207270 MNXJERMBWGHZLI-VGSWGCGISA-N 398.466 5.361 30 20 GKED N#Cc1ccc(CN(Cc2ccco2)Cc2ccccc2O)c(C(F)(F)F)c1 811453565 YRJFXUOKFCSRHY-UHFFFAOYSA-N 386.373 5.078 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NN[C@H](C)COc1ccccc1 811667632 ZNGOCTZWWCGPMF-QGZVFWFLSA-N 396.922 5.040 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)c1C#N 839369857 OXUHUEKJERXZMZ-UHFFFAOYSA-N 387.814 5.237 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@H]1CCCc2c(OC)ccc(Cl)c21)c1ccncc1 844990953 ZSEGWKRYDCMEHS-MOPGFXCFSA-N 399.922 5.080 30 20 GKED FC(F)Oc1ccccc1C=NOCc1cc(Cl)ccc1OC(F)F 849613124 CYAVTUAQCSPLMP-UHFFFAOYSA-N 377.721 5.094 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]2C[C@@H]2C1)c1nc(-c2ccc(Cl)cc2Cl)cs1 850764117 KPGOTTRFYOONDD-YAMSLAJTSA-N 377.296 5.339 30 20 GKED COc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 920805084 GOJQUAAVLDMISG-IUODEOHRSA-N 398.434 5.077 30 20 GKED C=C[C@H](CCC(=O)O)NCc1c(Cl)cccc1Oc1c(C)ccc(C)c1C 1776147491 JIQBBFCDJQOMFU-QGZVFWFLSA-N 387.907 5.567 30 20 GKED C=CCOc1cccc(/C=C/c2cc(C(=O)O)nc(-c3ccc(Cl)cc3)n2)c1 1776184743 JATFYFJFVZFNCB-IZZDOVSWSA-N 392.842 5.230 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cc(Cl)cc(Cl)c1 1776785336 WUFLIQCYFAGERE-IBGZPJMESA-N 388.379 6.582 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)s1 1777545333 JAZYFKLEHSCFDI-PKNBQFBNSA-N 394.496 5.404 30 20 GKED C=CCn1c(SCc2c(F)c(F)c(F)c(F)c2F)nnc1-c1ccccc1 11056094 YVUBINRRBIEWTB-UHFFFAOYSA-N 397.372 5.119 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3cccc(OCC(=O)O)c3)ccc21 13357770 AIYHBBHLXOKCQL-ACCUITESSA-N 399.446 5.174 30 20 GKED CSc1cccc(NC(=O)[C@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)c1 21372226 FOYZKTWSDAAQFL-INIZCTEOSA-N 388.492 5.353 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)Nc1c(C(C)C)cccc1C(C)C 43508329 OGRPJKAQXAALJI-UHFFFAOYSA-N 380.536 5.232 30 20 GKED Cc1ccc(C#N)cc1NC(=O)NCc1ccc(-c2nc3ccccc3s2)o1 58452305 XEZIKMFWQHLSJZ-UHFFFAOYSA-N 388.452 5.058 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(C1CC1)C1CC1 65368531 OJJJCKPESMBXJC-HXUWFJFHSA-N 393.918 5.648 30 20 GKED CC(=O)c1cccc(OCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66800312 PCNFOOKEYROVJX-INIZCTEOSA-N 396.512 5.081 30 20 GKED Cc1cccc2[nH]cc(CCNC(=O)Nc3ccccc3S[C@@H](C)CC#N)c12 66954961 RCIVMECXNCIGGA-INIZCTEOSA-N 392.528 5.235 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1cccc(Cl)c1 108148017 ZEQDTEOGXKGHKB-ZDUSSCGKSA-N 376.934 5.323 30 20 GKED Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c12 108240860 VWFAOPBJLNLZPK-ZDUSSCGKSA-N 394.500 5.159 30 20 GKED CSc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)o1 112246663 UKQAGRBYYUEQQW-UHFFFAOYSA-N 386.420 5.278 30 20 GKED N#C[C@H](C(=O)CCSc1ccc(Cl)cc1)c1nc(-c2ccncc2)cs1 114621127 QMOJOPVOXLBHLT-MRXNPFEDSA-N 399.928 5.217 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1nc2ccccc2o1 174016106 ZOBFTIQAWKQDRP-OAHLLOKOSA-N 392.336 5.402 30 20 GKED N#Cc1csc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1 176947746 NQFCONVPHCDYQW-UHFFFAOYSA-N 390.251 5.366 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 194065874 FNWPNIBKINCUQD-QGZVFWFLSA-N 376.431 5.371 30 20 GKED C=CCn1c(S/C=C\c2ccc([N+](=O)[O-])o2)nnc1-c1ccc(Cl)cc1 209878345 NBMXOFXFMZUSBV-LUAWRHEFSA-N 388.836 5.049 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\Sc3ccccc3)n2)cc1 255381928 SKNQSYXBKSRFHD-LENZSSGSSA-N 387.489 5.164 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C[C@H]1C 296857955 ZDIJRSIKNZFLPM-MGPQQGTHSA-N 385.455 5.133 30 20 GKED N#Cc1ccnc(Oc2ccc(-c3ccc(Br)cc3)cc2)c1[N+](=O)[O-] 301663132 VKAVBMZWUOFEJJ-UHFFFAOYSA-N 396.200 5.083 30 20 GKED COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 416819372 RZFAPUYKMOFWAA-AYBZRNKSSA-N 395.528 5.015 30 20 GKED CCSCc1ccccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 434621910 YGZMUGCJBSTJDF-HNNXBMFYSA-N 386.929 5.693 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCCO1 439357081 XEZRCMNHOAOYFJ-KRWDZBQOSA-N 399.878 5.037 30 20 GKED Cc1nc(-c2ccc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)cc2)cs1 442669444 CRSZURDOBMJAON-UNMCSNQZSA-N 387.508 5.031 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)c2ccccc21 444243526 IMYLLMOHTLJDHY-KXBFYZLASA-N 395.865 5.023 30 20 GKED CC(C)(C#N)CCCCN(CC(=O)Nc1ccccc1F)Cc1ccccc1F 444645017 GCVBEELWPJJZGM-UHFFFAOYSA-N 399.485 5.126 30 20 GKED CCCCn1ncc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 448360374 BOQVHUWJAGGKEP-UHFFFAOYSA-N 389.459 5.300 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1nc(CC(F)(F)F)cs1 455713291 DALAWSHIQPJYQY-UHFFFAOYSA-N 395.859 5.183 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458808282 YWHXVTXNZQOFER-LEWJYISDSA-N 393.535 5.088 30 20 GKED C=CCC[C@@H](NCc1nnc(-c2cc3c(s2)CCCC3)o1)c1ccccc1 461377110 ROTNVDWDEGTOIT-GOSISDBHSA-N 379.529 5.474 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1 470896735 IDUXFKOEMDJEAI-MRXNPFEDSA-N 383.904 5.033 30 20 GKED CC[C@@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 480637852 RWKDOPTVNRGMTE-HNAYVOBHSA-N 379.460 5.011 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1ccc(F)c(C#N)c1 481743372 UTPRZBIDBLRADC-OAHLLOKOSA-N 379.460 5.554 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3sc4c(c3C#N)CCC4)c2)cc1 482219925 ZAWHSXKTKAZKAJ-UHFFFAOYSA-N 385.448 5.025 30 20 GKED Cc1ccccc1-n1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cn1 482231803 LRCDTSQWVYNGEA-UHFFFAOYSA-N 384.464 5.033 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@](C)(Cc1ccccc1)[C@@H](C)O 484658042 WFSDZHXLBHJLHA-CLOONOSVSA-N 394.559 5.290 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1ccc(SCc2csc(C)n2)cc1 496674434 ZYGFLPJFYDGLQD-UHFFFAOYSA-N 398.553 5.208 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1oc2ccccc2c1CSc1cccs1 497344794 NWAGZKBKPZIKQX-UHFFFAOYSA-N 384.526 5.408 30 20 GKED N#C[C@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1Cl 499948985 XCSWHVJDAXPKLN-NRFANRHFSA-N 392.911 5.627 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@](C)(c2ccccc2)C1 503227002 UQWCIRBXXFRQQC-FDDCHVKYSA-N 393.556 5.524 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc4c(c3)Cc3ccccc3-4)CC2)cc1 503893182 PSSXKMUOCWYMTK-UHFFFAOYSA-N 376.459 5.059 30 20 GKED CCN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@@H](C)c1cccc(OC)c1 508614926 MGLFXSKSBRWWRJ-IBGZPJMESA-N 388.515 5.055 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)c1cc(C#N)ccc1Cl 514784691 DWRFAKSXAYOKFX-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1SCCc2ccccc21 514837631 KGCSSGCPHWUCQV-QHCPKHFHSA-N 384.504 5.122 30 20 GKED CCCc1ccc([C@@H](NC(=O)Nc2ccc(CC#N)cc2)c2cccs2)cc1 515219453 SQZCIPGQWODYBV-JOCHJYFZSA-N 389.524 5.678 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCCSc3ccccc3)cc2)cc1 517663459 FVBYBGBORLWDTP-UHFFFAOYSA-N 388.492 5.067 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCCCc3cccc(F)c3)cc2)cc1 518895351 UJWGVARIJLKLFV-UHFFFAOYSA-N 388.442 5.047 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1cccc(C(F)(F)F)c1 519413459 WVFGVLLWQIWQCT-ZDUSSCGKSA-N 394.418 5.117 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 520170821 QISHKPHDJOMWMX-LLVKDONJSA-N 381.785 5.455 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(Cl)c1 521816623 AWDCIZBMVBKORS-OAHLLOKOSA-N 395.915 6.068 30 20 GKED COc1ccc(CNc2cccc(C(F)(F)F)c2C)cc1OCCCC#N 532890542 GHUJUUXSRONDDW-UHFFFAOYSA-N 378.394 5.317 30 20 GKED COc1ccc(CSCC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1C#N 535394478 CYUAIUQXFWGVRS-UHFFFAOYSA-N 396.556 5.686 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(=O)c1c[nH]c2ncccc12 541089175 KXXJIBVUZNVMOM-IRXDYDNUSA-N 394.478 5.024 30 20 GKED Cc1c(C(=O)Nc2nc3cc(F)c(F)cc3s2)sc2ccc(C#N)cc12 549986902 FSQJTETXIYJBKX-UHFFFAOYSA-N 385.420 5.222 30 20 GKED C[C@H](NCc1ccccc1CN[C@@H](C)c1ccc(C#N)cc1)c1ccc(C#N)cc1 558742891 OWXIABKJDGLPII-PMACEKPBSA-N 394.522 5.132 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C1CC1 562173305 AWLLWOWEWFFNNS-OAHLLOKOSA-N 397.548 5.455 30 20 GKED CCO[C@@H](c1noc(C2(C#N)CCCCC2)n1)c1ccc(F)cc1C(F)(F)F 567084378 QJMMCGRROMRSOV-OAHLLOKOSA-N 397.372 5.079 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(SCc3ccccc3)cn2)cc1Cl 572192978 ORBUUGUXSYGZLU-UHFFFAOYSA-N 379.872 5.151 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)c2c1 574681945 BCWZPADGGFGXTC-UHFFFAOYSA-N 396.450 5.107 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1F 580428583 VMDMAXMBWFENOS-UHFFFAOYSA-N 397.450 5.174 30 20 GKED N#CCCCCCC(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1 588274519 QBXXGHFHMVKJCJ-UHFFFAOYSA-N 389.543 5.040 30 20 GKED CC1(C)CCCc2sc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)nc21 589971088 MGZZNNPWAIMXEW-UHFFFAOYSA-N 380.300 5.188 30 20 GKED Cc1c(C(=O)NCc2ccnc(Oc3ccccc3)c2)sc2ccc(C#N)cc12 589981291 HGWKYENPJCZSAS-UHFFFAOYSA-N 399.475 5.199 30 20 GKED CC(C)c1ccccc1N(C(=O)CC1(C#N)CC1)c1nc2ccccc2s1 590974143 QKKGUFODXOAYNM-UHFFFAOYSA-N 375.497 5.778 30 20 GKED N#CC1(c2ccc(-c3cc(F)ccc3OC[C@H]3CCCCO3)cc2)CCOCC1 592984370 PNHHHRIFXCIWHU-OAQYLSRUSA-N 395.474 5.012 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccccc1-c1ccc(Cl)cc1 595527590 VNEVJCKGODRZDF-SJORKVTESA-N 381.907 5.403 30 20 GKED CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 596698866 LSMYHOBFGFAYSY-IVXOOFBDSA-N 389.499 5.126 30 20 GKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 596733762 VGSWQBCLZCYMTA-QUCCMNQESA-N 393.556 6.067 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1csc(C(F)(F)F)c1)c1ccccc1 599225747 NNRLHDCSFYKPNV-OAHLLOKOSA-N 381.423 5.001 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCC2CCCCC2)cc1 604003582 GDBJXELZEATSFP-UHFFFAOYSA-N 376.500 5.631 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4sccc4s3)cn2)cc1 604242455 ZLZOSLQETMJSQP-UHFFFAOYSA-N 377.450 5.274 30 20 GKED Cc1cc(NC(=O)c2cc(C)c(-c3cccc(Cl)c3)s2)n(CCC#N)n1 608806708 IUVZGZCCAKMPNP-UHFFFAOYSA-N 384.892 5.048 30 20 GKED N#CCCCOc1cccc(CNCc2ccccc2-c2ccc(Cl)cc2)c1 608860856 KHIPLDZUGSCEKO-UHFFFAOYSA-N 390.914 5.979 30 20 GKED N#C[C@@H](NC(=O)CCSc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609460790 MCBWKFQXGJKZNM-MRXNPFEDSA-N 398.837 5.222 30 20 GKED C[C@@H](NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1cccc(C#N)c1 610318129 PWRRETVMCRAUIF-OAHLLOKOSA-N 382.423 5.249 30 20 GKED CCc1c(NC(=O)c2ccccc2Oc2ccccc2C#N)cnn1CC(C)C 611504404 FAFPLOJHLFHQQP-UHFFFAOYSA-N 388.471 5.018 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1 619424394 MWIKTMMTCIGLHL-UHFFFAOYSA-N 389.524 5.117 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Br)c(F)cc1Cl)c1ccccc1 619518618 RLBMJXBBMBUTRG-LBPRGKRZSA-N 395.659 5.268 30 20 GKED C=CC[C@H]1CCN(Cc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)C1 625702918 JWQLPNMCIQUQON-IBGZPJMESA-N 383.561 5.151 30 20 GKED CC(C)(CNC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)CC(F)(F)F 662195567 UCJGPKRWAVEMNW-LBPRGKRZSA-N 388.327 5.097 30 20 GKED CC(=O)c1cccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 679980379 XDLFHKZEEMJYCD-AWEZNQCLSA-N 388.370 5.008 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@](OC)(C(F)(F)F)C1 682777811 SIMDQRKWFPCSRX-LJQANCHMSA-N 384.442 5.114 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1c(Cl)cccc1Cl 726319134 ZBHXGXCPPREERP-MNOVXSKESA-N 375.280 5.583 30 20 GKED COc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc1NC(C)=O 726427860 ZTAJGPOTMCVKPN-MDZDMXLPSA-N 377.465 5.278 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726459057 VKSQIIABUQULKS-JTQLQIEISA-N 398.746 5.908 30 20 GKED c1ccc(-c2noc(NN=C3CCCc4nc(-c5ccccc5)sc43)n2)cc1 726738367 QRSGFSYBMJDHQN-UHFFFAOYSA-N 387.468 5.013 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccccc2F)cc1 726858509 NNAXGGMSFNWTSW-UZLBHIALSA-N 380.463 5.009 30 20 GKED C#CC[C@@H](OC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccccn1 727775771 ORYHIKCEIVKDJU-XYELWLDHSA-N 377.440 5.270 30 20 GKED CCOc1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1Cl 732733697 PJZCOEUTFCSLBF-IBGZPJMESA-N 391.858 5.041 30 20 GKED C=CC[C@@H](NCc1cccc(OCc2ccccc2Cl)c1)c1ccncc1 734509656 NYLSZMLHURRGAK-HSZRJFAPSA-N 378.903 5.721 30 20 GKED C=CC[C@H](NC(=O)N[C@H](CCc1ccccc1)c1ccccc1)c1ccncc1 734659457 CNXMWDMDFCXEOL-BJKOFHAPSA-N 385.511 5.372 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)c1cc(C2CC2)nc2ccccc12 735339099 AUSHVLFZDDQAFB-UHFFFAOYSA-N 392.842 5.025 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCOc3ccc(C(C)(C)C)cc3)[nH]c12 735792400 LGSCMBWYUNFFOZ-IBGZPJMESA-N 389.499 5.204 30 20 GKED C[C@H]1c2c(F)cccc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738897976 YGTWIWMVPDNKRI-JTSKRJEESA-N 399.469 5.632 30 20 GKED Fc1cc(F)c(NN=Cc2ccccc2C(F)(F)F)c(Br)c1 741771161 JMBMRSPIAMRVMK-UHFFFAOYSA-N 379.126 5.192 30 20 GKED CC(C)(C#N)CCSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1 742448123 WCCVEDFRLCHOPX-RGEXLXHISA-N 393.487 5.242 30 20 GKED CC(=NNc1ccc(C(F)(F)F)nn1)[C@H](C)Oc1ccc(Cl)cc1Cl 754710417 YOQKQHNGCRCKQT-VIFPVBQESA-N 393.196 5.058 30 20 GKED N#CCCCn1cc(C(=O)Nc2nnc(C3CCCCC3)s2)c2ccccc21 767688299 COONKAWPWKIZJP-UHFFFAOYSA-N 393.516 5.097 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Br)cc2F)cc(Cl)c1OC 767736433 KPJHDMCGRNDFED-ZZXKWVIFSA-N 399.643 5.155 30 20 GKED Cc1cc2c(cc1C)[C@H](C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CO2 769863057 OWHDYWGHSAQQDS-XZOQPEGZSA-N 382.463 5.074 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCCc4sccc43)n2)cc1 771578753 OJDIXLLFJDMDRS-DLBZAZTESA-N 378.522 5.476 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccc(C)cc2)cc1 776161399 VTNNFXMWSTXREP-UQBPGWFLSA-N 386.495 5.346 30 20 GKED FC(F)(F)CCON=C(CC(F)(F)F)c1ccc(Br)cc1 777462720 JFZOOAJJZSFGSK-UHFFFAOYSA-N 378.110 5.075 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccccc1 777624266 DDJFBAZWQIYBTM-HXUWFJFHSA-N 392.499 5.283 30 20 GKED Cc1nc(C)c(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 779596159 UHKBWTHMEGKTLR-UHFFFAOYSA-N 383.904 5.476 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCC1(C#N)CCCCC1 782644994 JAOHHOPJMGUYRU-UHFFFAOYSA-N 392.377 5.300 30 20 GKED CC(C)c1ccc(Nc2nn(CN3CCC[C@@](C)(C#N)C3)c(=S)s2)cc1 784013458 IRDLKYWXYRZYIV-IBGZPJMESA-N 387.578 5.124 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ncc(C(F)(F)F)s2)cc1 788355153 LSFYKXXSENTUIE-ZHACJKMWSA-N 389.398 5.734 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2F)o1)c1nccc2ccccc12 792102329 DXLUXOSDMKRDIV-FQEVSTJZSA-N 384.410 5.443 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)s2)cc1 795203473 BXQJACRAMFXUEC-MRXNPFEDSA-N 386.398 5.675 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ncc(-c2ccc(Cl)cc2)o1 795984239 WJUKSNWIFXMMLD-YJBOKZPZSA-N 394.858 5.687 30 20 GKED COc1cc(C)c(NC(=O)c2cc(C)n(-c3ccc(C#N)cc3)c2C)c(C)c1C 805290764 QZZZKXXOEXAUAD-UHFFFAOYSA-N 387.483 5.152 30 20 GKED CC(C)(C(=O)OCCCCC#N)c1csc(-c2c(F)cccc2Cl)n1 810583927 IKSLMSDNVFERHN-UHFFFAOYSA-N 380.872 5.117 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1csc(-c2ccccc2F)n1 812244678 MFQGSFOGKKJCDD-KHPPLWFESA-N 389.455 5.090 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)Cc1ccc(Cl)cc1 813211083 CXWTWMRLDPUQLL-WBMJQRKESA-N 380.797 5.199 30 20 GKED CN(C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)[C@H]1CCCC[C@H]1C(F)(F)F 813253193 CREKNMUUHOJGFJ-RDBSUJKOSA-N 385.323 5.296 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(Br)cc2)cc(Cl)c1O 916134292 JDMYSVSSCSEZRK-BAQGIRSFSA-N 381.653 5.103 30 20 GKED N#C[C@H](C(=O)Cc1cccc(C(F)(F)F)c1)c1nc2cc(Cl)ccc2s1 917045410 ZFCXCNWEWOQBOC-CYBMUJFWSA-N 394.805 5.387 30 20 GKED CC(C)Oc1ccc(N[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 917936499 XPPRBOMJYNXSMM-OAHLLOKOSA-N 397.544 5.115 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc(F)c1)c1nc2cc(Cl)ccc2s1 918492099 LRWAQWLZDJGEPA-OAHLLOKOSA-N 388.851 5.124 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2nc3ccccc3s2)cc1 918755619 XSXSNAAIEAURRH-UHFFFAOYSA-N 387.483 5.509 30 20 GKED CC(C)c1ccc(NN=Cc2ccc(OCc3ccc(C(=O)O)o3)cc2)cc1 1776060088 BZBNYAMEDCVPLS-UHFFFAOYSA-N 378.428 5.126 30 20 GKED CCc1ccc(-c2ccc(/C=C/C(=O)c3ccc(OC)c(CC(=O)O)c3)o2)cc1 1776131856 QCOBXXWPOLDURD-PKNBQFBNSA-N 390.435 5.041 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776801339 LCMMHBLVNBIHAL-AWNIVKPZSA-N 390.435 5.720 30 20 GKED C[C@H](CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccccc1 15745012 BQKXHUTXKKVJQK-GOSISDBHSA-N 386.520 5.384 30 20 GKED C=CCN(CC(=O)Nc1c(C(C)C)cccc1C(C)C)Cc1ccc(OC)cc1 59423188 BJXCSIGUBDNREE-UHFFFAOYSA-N 394.559 5.569 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 61068775 AIAVYJFHZZKUMY-AWEZNQCLSA-N 381.526 5.363 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 63403437 XXRBXQRHOXFKED-OAHLLOKOSA-N 387.405 5.036 30 20 GKED COc1ccc(SCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66801132 ILGBITBTHBDGDY-HNNXBMFYSA-N 386.542 5.210 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1 66956275 UBEANTZHFSPFAP-HOTGVXAUSA-N 393.512 6.052 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1 107340600 ZOSSRCUMJPSSQW-OAHLLOKOSA-N 383.542 5.330 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 108530990 DRLQPXASSDPPMJ-IERDGZPVSA-N 393.556 5.924 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(-c2ccncc2)cs1 114621170 DFUKWYVJKQYLMS-HXUWFJFHSA-N 397.459 5.487 30 20 GKED C[C@@H](SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1)c1ccc(C#N)cc1 118443772 NPYNDHBBMVLNED-GFCCVEGCSA-N 393.493 5.111 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 120034120 ISEJRKDSZCXPTD-HNNXBMFYSA-N 379.872 5.158 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 120523518 ABLYSEIDZUAPGS-SECBINFHSA-N 399.360 5.126 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc4ccccc4n3)o2)cc1 126275871 FAFAIEKAPBUBNY-UHFFFAOYSA-N 375.453 5.142 30 20 GKED COc1cc(CSCc2nccs2)ccc1OCc1cccc(C#N)c1 161681095 OXOLBJZZJMBPPI-UHFFFAOYSA-N 382.510 5.036 30 20 GKED Cc1cnc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)s1 173122414 PMSPRSLVBGBEQP-YVEFUNNKSA-N 386.546 5.119 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(CC(F)(F)F)c1 173122472 JLIUPKUCEDMNJN-CYBMUJFWSA-N 393.434 5.830 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Cc2cccc(C(F)(F)F)c2)n1 177746630 WPFLOZGKXKOUHJ-DOMZBBRYSA-N 380.435 5.340 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)Cc1ccc(Cl)cc1 179808277 ILIJVHIBBXMXHK-RDTXWAMCSA-N 395.915 5.304 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cccnc2-c2ccc(Cl)s2)cc1 187136769 JQIVAERPDFHPNY-UHFFFAOYSA-N 399.928 5.207 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](COc2ccccc2F)c2ccccc2)cc1 237500564 YCGDNIFZCCFUIX-MBSDFSHPSA-N 390.458 5.026 30 20 GKED N#C[C@@H](C(=O)CCSc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 247704896 CQEFECJBBMDSCF-KRWDZBQOSA-N 398.940 5.822 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)n1 255054089 CFMXZRQRYJTEKW-PZMUVPOTSA-N 398.837 5.742 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3ncsc3C(F)(F)F)c2C#N)CC[C@H]1C 297916773 RUDIDNVDADZZBC-SFYZADRCSA-N 385.436 5.033 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(Br)cc1F 303337967 KXEGXKAPQRPIBR-LBPRGKRZSA-N 379.298 5.595 30 20 GKED C[C@@H]1CCC[C@@H](/N=C(/O)C2CCN(c3noc4ccc(Cl)cc34)CC2)C1 328712500 RSXXLXRIIXYZRP-CZUORRHYSA-N 375.900 5.233 30 20 GKED C[C@H]1C[C@H](C(O)=Nc2sc3c(c2C(=O)c2ccccc2)CCC3)CCC1=O 329403843 WVDFGCREOXOJEG-DZGCQCFKSA-N 381.497 5.061 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCC([C@H]2C(O)=Nc3cc(Cl)ccc32)CC1 329507053 HQMCTARZDVSHKL-LHSJRXKWSA-N 379.891 5.370 30 20 GKED N#CC1(CC[S@@](=O)Cc2csc(-c3ccc(F)cc3)n2)CCCCC1 417161382 RCHLZVMPNBBFSY-RUZDIDTESA-N 376.522 5.062 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](CC(F)(F)F)C1 421059783 KQDGQEYXMULBIQ-KGLIPLIRSA-N 385.455 5.277 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1CCC[C@@H]1c1ccc(OCC)cc1 424256422 VMNPNHLZLYCXQX-UXHICEINSA-N 398.576 5.163 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425755678 KDRYZTRYTROCGW-HNAYVOBHSA-N 389.421 5.263 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1ccccc1Oc1ccccc1C#N 427729811 WRSUCEHWWBGLNC-AWEZNQCLSA-N 376.378 5.201 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 431726340 GVZOXFBFZWKLCB-LIRRHRJNSA-N 390.314 5.789 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 432082603 UNDSKCYQJZVUDZ-KSFYIVLOSA-N 397.519 5.415 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 435595972 DQAVIGAPJZTPNF-PKOBYXMFSA-N 379.529 5.767 30 20 GKED COc1ccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 438662193 RDHFLXUYLSPOBB-UHFFFAOYSA-N 377.375 5.142 30 20 GKED CC(C)(C)n1cc(CNCC2CCC(C#N)CC2)c(-c2ccccc2Cl)n1 441385315 NMSAKRHRRYTGSZ-UHFFFAOYSA-N 384.955 5.378 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccc(Cl)cc3-c3ccccc3)o2)c1 442867064 NOTHBBUSCPLMAY-UHFFFAOYSA-N 386.842 5.541 30 20 GKED C[C@@H](SCC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1cccc(C#N)c1 443163041 WYBDKHHDAFZNAG-OAHLLOKOSA-N 394.496 5.033 30 20 GKED Cc1cc(Cl)ccc1NC(=O)[C@H](C)Sc1nc(C(F)(F)F)ccc1C#N 461727406 ONACCNHMTLSYLR-JTQLQIEISA-N 399.825 5.053 30 20 GKED Cc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1Br 470025223 UOAYBVOMRPGYRN-UHFFFAOYSA-N 391.268 5.549 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(SCCOC)cc1 471805054 QDTLYYNRCIHZCH-LJQANCHMSA-N 398.572 5.274 30 20 GKED Cc1ccc(Cl)c(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 475001407 LYYRKNRVELCKKJ-UHFFFAOYSA-N 378.884 5.924 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H](COc2ccccc2Cl)C1)c1ccccc1 476508041 OVWGHICGAOFNIU-QUCCMNQESA-N 396.918 5.045 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nc(-c2ccccc2Cl)cs1 478341588 RRUTXOMEMAGPRS-AWEZNQCLSA-N 399.972 6.327 30 20 GKED Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 485602960 GMEXDVNFRUWOEW-XMMPIXPASA-N 399.494 5.523 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1)c1ccccc1 487386332 GQTYTMMEUPJZHY-KRWDZBQOSA-N 385.389 5.352 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 488856129 OTFPTHQQKPXXGD-CQSZACIVSA-N 388.920 5.143 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCCC[C@@H]2C(F)F)c1 500567294 LRQQKTBAUTYDND-QGZVFWFLSA-N 390.817 5.264 30 20 GKED COc1cccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 502315370 GQXXXMOKQWZSDW-FQEVSTJZSA-N 391.858 5.648 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CCCC)c1ccc(OC)cc1 503793519 HZJJPBVPDCNUSM-QHCPKHFHSA-N 391.515 5.196 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 504125645 OTTCSCVVFSNUSQ-NRFANRHFSA-N 375.859 5.317 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(C(F)(F)F)cc1 504396614 OJMYIFGBWSYPAW-KRWDZBQOSA-N 379.426 5.048 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccc(C#N)cc1 505320244 WBAWSVKEIPSBKR-WDEREUQCSA-N 380.250 5.126 30 20 GKED N#CC1(CCCSCc2ccc(OCc3ccccc3)cc2)CCOCC1 507697312 ISWHGZZKPDDGTE-UHFFFAOYSA-N 381.541 5.599 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N(C)Cc3cccc(C#N)c3)oc2c1 508286621 QXDHRYZFKVKMNC-UHFFFAOYSA-N 396.446 5.252 30 20 GKED Cc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cnn1C1CCCCC1 510300909 YMMMWRPBDSZWSE-UHFFFAOYSA-N 390.512 5.549 30 20 GKED Cc1cccc([C@@H](NC(=O)Nc2cccc(OCCCC#N)c2)C(F)(F)F)c1 512919076 WTLKWCKYWBQNLR-GOSISDBHSA-N 391.393 5.103 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3SC[C@@H](C)C#N)c2cc1C 519424789 HLSSWLWXLNYIIA-AWEZNQCLSA-N 378.497 5.483 30 20 GKED CC(C)c1ccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520813792 SUMQCORTTAJBOV-QGZVFWFLSA-N 398.597 6.076 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 535535893 VPISNVNQYFKBJF-ISKFKSNPSA-N 396.494 5.361 30 20 GKED Cc1cccc(F)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 537337791 CRTHNUNTXNNTES-UHFFFAOYSA-N 380.806 5.704 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(Cl)ccc3N3CCCCC3)cc2)CC1 537398429 NZMVRJPYJUBGOE-UHFFFAOYSA-N 379.891 5.138 30 20 GKED N#CC1(c2ccc(-c3nc([C@@H](F)c4ccc(C(F)(F)F)cc4)no3)cc2)CC1 548891160 CRNHXHIYVCKJKY-INIZCTEOSA-N 387.336 5.369 30 20 GKED N#CCCCn1cc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c2ccccc21 553296840 SQRRIKJRQQYOFQ-HOKHCIIBSA-N 397.522 5.353 30 20 GKED N#Cc1nc(N[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)ccc1Cl 553562785 QUGZZDJSRPNXSV-SFHVURJKSA-N 395.812 5.205 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)CCCCCC4)ccc12 554698402 PAMSDQMGEKHNEW-UHFFFAOYSA-N 391.496 5.093 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cscc1Br 567306391 YRWNKKMZHRUMJJ-UHFFFAOYSA-N 389.299 5.363 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)cc1F 571011784 QEXFPCHWDBZJHL-UHFFFAOYSA-N 395.274 5.301 30 20 GKED C[C@H](N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1cccc(C#N)c1 571558896 GKCZSIMFYRIQQO-RBZFPXEDSA-N 394.316 5.530 30 20 GKED C=CCC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CC(F)(F)F)c1ccco1 574421646 NKTFSUYWAXMPRB-MRXNPFEDSA-N 378.394 5.241 30 20 GKED CSC[C@@](C)(C#N)NC(=O)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 574792925 LAGJCAPUEQQGRP-MRXNPFEDSA-N 385.341 5.097 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 577166126 SQFPPVKEJZXCPA-UHFFFAOYSA-N 393.434 5.174 30 20 GKED C[C@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)c(F)c1 578611974 DSIMQUKQVSQMET-HXPMCKFVSA-N 378.369 5.398 30 20 GKED COc1ccc([C@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)cc1 578638040 NKSVNYDEPHORLT-RPWUZVMVSA-N 388.898 5.587 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1c(F)cccc1Sc1ccccc1 580475087 BYULMEUWMUVZAJ-UHFFFAOYSA-N 377.444 5.143 30 20 GKED Cc1ccc(C(C)(C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cn1 582390650 SMINXIHGRSFATH-UHFFFAOYSA-N 386.455 5.111 30 20 GKED Cc1c(C(=O)Nc2cccnc2Oc2ccccc2)sc2ccc(C#N)cc12 590071307 DHMKUNWFNUFLKK-UHFFFAOYSA-N 385.448 5.521 30 20 GKED N#C[C@@]1(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)CC12CCCC2 590978091 MRCRCOVXBJPPDI-JOCHJYFZSA-N 393.874 5.005 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 592679181 LAFCAVNJTOXSSB-UHFFFAOYSA-N 394.246 5.001 30 20 GKED Cc1c(F)cccc1-c1ccc(CNC2(c3cccc(C#N)c3)CCOCC2)o1 594985604 ZTEHIVKZKAZNFM-UHFFFAOYSA-N 390.458 5.061 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)c(Br)cc1F 599047942 GXKMJQKZBSNHHN-BFUOFWGJSA-N 393.275 5.813 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2nccs2)c1)c1nc2ccccc2s1 606145047 GWUDDKGEFSOAGN-AWEZNQCLSA-N 377.450 5.035 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccccc1SC[C@H](C)C#N 609377790 MYGBQDHEAKNJGN-CQSZACIVSA-N 377.469 5.154 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609399214 GGAYXGZKWLYZFJ-SFHVURJKSA-N 381.545 5.628 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1c(F)cccc1F 609433206 JBFIVCVAOPALFP-MRXNPFEDSA-N 378.422 5.266 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 609497284 ACPYBLBRSWACQH-OAHLLOKOSA-N 390.405 5.004 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCCC[C@@H]3c3ccccc3)cc2)nc1 609501341 HGXOYGCSTAKHAF-HSZRJFAPSA-N 397.478 5.503 30 20 GKED C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 610205631 ROSUKYVBKCCBJO-UKILVPOCSA-N 398.531 5.311 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2Br)s1)c1cccc(C#N)c1 610345122 SKRFMQDITOFOQK-AWEZNQCLSA-N 397.341 5.900 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)N[C@@H](C)c2cccc(C#N)c2)cc1 610406675 IMDPELQKAZQFLM-IBGZPJMESA-N 399.494 5.040 30 20 GKED N#CCn1c(C(=O)N(Cc2cc(F)ccc2F)C2CCCC2)cc2ccccc21 610578695 QWDFSGWLCMOOTR-UHFFFAOYSA-N 393.437 5.028 30 20 GKED CCOc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 612894855 RASPZPNJROGNIS-INIZCTEOSA-N 382.872 5.352 30 20 GKED N#C[C@H](C(=O)c1sccc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 613407126 JATDAOLNFPOLHO-OAHLLOKOSA-N 394.908 6.168 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 614931264 TYCHYVDVRHMGGA-UHFFFAOYSA-N 377.366 5.203 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 615472145 MHRSKRCDOSPSIO-UHFFFAOYSA-N 396.821 5.170 30 20 GKED C=CCn1c(S[C@@H](C)c2cccnc2)nnc1-c1ccc(C(C)(C)C)cc1 618427027 JARDUTYKXORBAQ-INIZCTEOSA-N 378.545 5.677 30 20 GKED CC(C)c1ccsc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 619753860 HQFXYMWVEXIUJN-OAHLLOKOSA-N 386.929 6.138 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cc(F)ccc1F 622484974 AKWWCDBZZUPJDR-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED C=CCCc1ccccc1NC(=O)c1nc2ccccc2cc1Br 685063010 QKAQBRMUYMMSQM-UHFFFAOYSA-N 381.273 5.368 30 20 GKED CCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](C)c1cc2ccccc2o1 726477869 ZAJCKSNZEBVJFK-AWEZNQCLSA-N 397.931 6.128 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN(C)C[C@@H](C)c2ccccc2)c1=S 727427357 HXLFHXUINHHRAV-QGZVFWFLSA-N 396.535 5.099 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cccc(OCCCC#N)c1 727781239 HVTWZOWGXUFVFS-SEYXRHQNSA-N 388.492 5.697 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 727978516 HPFGDZBKDSFLJB-UHFFFAOYSA-N 387.508 5.563 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 727987779 ZQILINRZIYKSED-UHFFFAOYSA-N 380.831 5.050 30 20 GKED N#C[C@H](C(=O)C1CCSCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 733053223 YUVQCDCFRSTAAC-CYBMUJFWSA-N 397.352 5.436 30 20 GKED C=CCCO[C@H](C)C(=O)O[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 734731112 XLMFLRJVIWAWNW-ZIAGYGMSSA-N 379.909 5.357 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(SCC(F)F)cc1 741760876 CRASRAQILIDHEE-UHFFFAOYSA-N 378.448 5.037 30 20 GKED CS[C@H]1CC[C@@H](NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 742744334 JNMGWFNRKGGESU-ZBFHGGJFSA-N 386.904 5.018 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1)c1ccccc1C(F)(F)F 744161408 UOPABRKXNIFHBM-NRMKIYEFSA-N 383.373 5.170 30 20 GKED C=CCC[C@H](NC(=O)CCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 749948405 JOPSINBKODAJPG-KRWDZBQOSA-N 382.451 5.227 30 20 GKED CN(C(=O)c1cc(-c2ccco2)nc2ccccc12)c1cc(Cl)ccc1C#N 751894122 REQQVXZOTSRUQP-UHFFFAOYSA-N 387.826 5.296 30 20 GKED C#CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 757761532 NALSHLXIYMOVOH-RPWUZVMVSA-N 379.463 5.228 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 760180723 IUIVYJAKTVNXTG-KRWDZBQOSA-N 390.508 5.470 30 20 GKED C=CC[C@@H](N[C@@H]1CCc2c(Cl)cc(Br)cc21)c1ccncc1 760329598 KXZAUNAMKXKJHT-QZTJIDSGSA-N 377.713 5.392 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(C#N)s1 762447353 PMFABRXLNGQTLU-UHFFFAOYSA-N 393.472 5.267 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)c(N)c(Cl)c2)cc1 763800155 LJMGDBPQGOAKJF-QGZVFWFLSA-N 396.277 5.483 30 20 GKED C=CC[C@H](N[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 766018240 GTSQQEYDIRADFS-SJCJKPOMSA-N 388.355 6.087 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](CC(C)(C)C)c2ccccc2)ccc1OC 776165880 YCEYFJBDTZUDLM-LEWJYISDSA-N 380.532 5.643 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C1(Cc2cccc(Cl)c2)CCCC1 780169381 ONLXWAFQNGSDPW-INIZCTEOSA-N 382.891 5.372 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C(C)C)[C@@H](O)c1ccccc1 788682598 SPBYCILCKTVHJY-GMAHTHKFSA-N 380.532 5.418 30 20 GKED C=CCC[C@H](NC(=O)N1CCC([C@H](O)c2ccccc2C)CC1)c1ccccc1 805223275 HMCMOANVCUNEFG-ZEQRLZLVSA-N 392.543 5.158 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)OC[C@H]1CC[C@@H](C#N)CC1 809092414 HOQBBOVSQMXRPT-CALCHBBNSA-N 384.501 5.071 30 20 GKED C[C@H](N[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 810264244 ZHZQGOSTNQWQHS-PGRDOPGGSA-N 393.531 5.255 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)c1cc(C(F)(F)F)ccn1 813216053 FKKYFRIVPLXEFJ-AWEZNQCLSA-N 398.306 5.027 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1ccccc1C(F)(F)F 819440546 SIHDYWPMLGDXOL-GUYCJALGSA-N 380.435 5.245 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cc(Cl)ncc3Cl)c(C#N)c2[C@@H]1C 839391269 WMACHHJUDYLJQP-RKDXNWHRSA-N 380.300 5.260 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@H]1c1ccccc1 841681585 IMTWPYBTEATCKJ-LMNJBCLMSA-N 377.488 5.168 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)Cc2ccc(OCc3ccccc3)cc2)n1 850873642 NMAUZFNKFPQYDZ-FQEVSTJZSA-N 390.508 5.264 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc4sccc4nc3Cl)c2C#N)C1 857567640 BWONWGZUOCVBPM-VIFPVBQESA-N 387.917 5.260 30 20 GKED Cc1csc(-c2ccc(NCc3cc(C#N)ccc3Br)cc2)n1 864009960 DIZBANCDXOBGBC-UHFFFAOYSA-N 384.302 5.365 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 864010508 CSIOVRODJAMKHU-UHFFFAOYSA-N 393.830 5.311 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(C(C)C)nc2C)cc1 916951440 YIWXSUNUSIHXJP-GUYCJALGSA-N 383.517 5.050 30 20 GKED Clc1ccc(OCc2cccnc2)c(C=NNCc2ccccc2Cl)c1 918153631 YSCBFKINPOSVHF-UHFFFAOYSA-N 386.282 5.091 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@@H](C)Sc1ccc(Cl)cc1 920102347 SFCTYONETFVXHI-DYVFJYSZSA-N 396.899 5.202 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1cc(-c2cccc3ccccc23)nc2ccccc12 920449070 AOTXWOQOXNSPNV-KRWDZBQOSA-N 379.463 5.287 30 20 GKED CC(=NNc1ccc(F)cc1C(F)(F)F)c1cc(C(=O)O)ccc1OC(C)C 1776110911 ZWIWXKANOYNGEI-UHFFFAOYSA-N 398.356 5.166 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(OC(F)(F)C(=O)O)cc1)CC2 1776374813 UFFOALFMAIWPPX-BOPFTXTBSA-N 386.394 5.079 30 20 GKED COc1ccc(OC)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1777368107 NFVKAHVYLRBURJ-CSKARUKUSA-N 394.448 5.027 30 20 GKED Cc1ccsc1C(=O)/C=C/c1cccc(OCc2ccccc2C(=O)O)c1 1777477302 ZMQGSIPUOKRALY-MDZDMXLPSA-N 378.449 5.230 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CC4(CC4)c4ccccc4C3=O)s2)c1 1777684327 QWGLQKMKGWZEAM-GHRIWEEISA-N 386.472 5.815 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)c1sccc1-c1ccccc1 24506029 RKLMKFNNPVZJCS-UHFFFAOYSA-N 385.410 5.215 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2cc(OC)ccc2nc1C 25804811 KWCZKBROIUFEER-UHFFFAOYSA-N 386.904 5.095 30 20 GKED COc1ccc(NC(=O)[C@H](Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 28373830 WRODAJWPVAJFQA-HSZRJFAPSA-N 399.494 5.288 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ccccc1)c1ccccn1 43296455 KVYPZAQPKZDVJO-HXUWFJFHSA-N 397.931 5.284 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2SCCS2)cc1 45403825 WTMHFYWYMYELFY-UHFFFAOYSA-N 382.554 5.089 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cccc1[N+](=O)[O-] 46443748 LXVQJWCIRAUXAJ-OAHLLOKOSA-N 397.843 5.170 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(C#N)c(Cl)c3)s2)c(C)c1 63570348 KJBQBHGFWLVIIU-UHFFFAOYSA-N 381.888 5.513 30 20 GKED N#C[C@H](C(=O)CCc1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 66510898 REIVBGDTVQZMEA-CYBMUJFWSA-N 376.815 5.037 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@H](C#N)c3nc4ccccc4o3)o2)c(C)c1 66516499 GZAVQCGYUPNFMI-KRWDZBQOSA-N 386.407 5.107 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)s1 66956029 SPDHXFLIAFMQIJ-OCCSQVGLSA-N 388.562 5.379 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)NCCCCC#N)cc3C2)cc1 91034673 NPQJXKKJGAAAPQ-UHFFFAOYSA-N 376.504 5.146 30 20 GKED COc1cc(C#N)ccc1OC(=O)c1ccccc1SCc1cccs1 105494179 ZXOPKRVCTSHNSF-UHFFFAOYSA-N 381.478 5.140 30 20 GKED CSc1cc(C(=O)Nc2ccc(F)cc2OCC#N)c(Cl)cc1Cl 120470183 KSXULVVSQSXUOT-UHFFFAOYSA-N 385.247 5.009 30 20 GKED C=CCN(C(=O)c1sc(Cl)nc1C)c1nc(-c2ccccc2)cs1 177611068 FHNPTCAIPXNFKU-UHFFFAOYSA-N 375.906 5.061 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2cccc(Cl)c2)n1)Cc1cccs1 180073764 DMDMPYGURAQLKJ-GFCCVEGCSA-N 388.901 5.064 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1c(F)cccc1F 182857766 BBUITMCBXVCCGH-ZDUSSCGKSA-N 392.496 5.088 30 20 GKED C=CCc1ccc(OCC(=O)Nc2c(CC=C)cccc2C(C)C)c(OC)c1 189891600 KTAVCWLGWZZZIL-UHFFFAOYSA-N 379.500 5.293 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc4ccccc4o3)sc2C)cc1 193622176 IHQUDCCVQXDATA-KRWDZBQOSA-N 388.448 5.363 30 20 GKED COc1cc(/C=C2/S/C(=N/c3cccc(C)c3)N=C2O)ccc1OC(F)F 206129527 FIQAVUFSYTVYSG-MHWRWJLKSA-N 390.411 5.337 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(CC#N)c1ccccc1 215740665 TXPMZRZYRJLFTQ-UHFFFAOYSA-N 391.474 5.310 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)ccc1SC(F)F 255529345 FAGWQLSIRBHCOJ-QGOGUYACSA-N 389.423 5.197 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301767149 WQESQFFJFCLVDO-ROUUACIJSA-N 380.900 5.834 30 20 GKED CC(C)[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccc(COC2CCCC2)cc1 303828674 QMZOECQSLKCVFU-HSZRJFAPSA-N 392.499 5.060 30 20 GKED Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2N=C(O)[C@@H]2CCC(=O)[C@@H](C)C2)n1 328929034 YHAAYECVPMUUAY-SMDDNHRTSA-N 393.409 5.101 30 20 GKED COc1cccc([C@@H]2C[C@H]2CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 416819373 RZFAPUYKMOFWAA-IEZWGBDMSA-N 395.528 5.015 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C(F)F)cc1 425085971 MQHYIOMQWVYJPY-GFCCVEGCSA-N 382.332 5.197 30 20 GKED Cc1cc(NCc2cc(C#N)ccc2Br)ccc1-c1ccncc1 427419035 DQXKGAONGAPXQV-UHFFFAOYSA-N 378.273 5.303 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC2(CCC2)[C@H]1c1ccccc1 432770366 RQHSOVYAXDUSND-OAQYLSRUSA-N 375.472 5.105 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2cc(C#N)oc2C)C(C)C)cc1 435446659 LKMPECDOZCJZTC-UHFFFAOYSA-N 388.467 5.186 30 20 GKED C=CCn1c(SCc2ccc(-c3ccsc3)cc2)nnc1-c1ccncc1 436127251 MJEVMBBCHIUGPY-UHFFFAOYSA-N 390.537 5.547 30 20 GKED Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 437914408 YRMLPMJHKFKYAQ-FGZHOGPDSA-N 375.516 5.596 30 20 GKED CC(C)N(CCCCC(C)(C)C#N)CC(=O)Nc1ccccc1C(F)(F)F 444661341 AKJRTCZNTWQCQQ-UHFFFAOYSA-N 383.458 5.074 30 20 GKED CC(C)Oc1ccc(-c2ccc(NC(=O)N3CCC(F)(C#N)CC3)c(F)c2)cc1 455510066 FZIVQBOFIZKQJP-UHFFFAOYSA-N 399.441 5.139 30 20 GKED Cc1ccc(CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C2CC2)cc1C 458800607 LKSYCQBOEQOPBI-HSZRJFAPSA-N 375.516 5.413 30 20 GKED COc1ccc(CN[C@@H]2c3ccccc3CCC[C@@H]2C)cc1OCCCC#N 462546955 GLUAMTMPWQJVOO-UUOWRZLLSA-N 378.516 5.181 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(-c4cscn4)c3)cc2)c1 463768234 HMLKSPDGMVXWQK-UHFFFAOYSA-N 397.459 5.726 30 20 GKED Cc1ccc(-c2cncc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2)cc1 466344706 BQTNYPVQTTYYMJ-KRWDZBQOSA-N 387.508 5.704 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cn(-c2ccccc2)nn1 471648318 LHWIZGKYWZGZOV-KRWDZBQOSA-N 381.439 5.104 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)c4ccc(C(C)(C)C#N)cc4)CC3)c[nH]c2c1 474907920 UNGPAAOFTYVFOK-UHFFFAOYSA-N 383.495 5.207 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1C 476248820 MOTZELFLEMYYRR-HXUWFJFHSA-N 378.516 5.726 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2-c2c(F)cccc2F)cc1 476873412 WEDAYEANLXQXGW-UHFFFAOYSA-N 376.406 5.685 30 20 GKED N#CCCn1cc(CN[C@@H]2CC[C@@H](c3ccccc3F)C2)c(-c2ccccc2)n1 481812276 CPYDNEVHTPUGMK-TZIWHRDSSA-N 388.490 5.029 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H]3Cc3ccccc3)c2)cc1 484916005 IXSCAOZJJXRKRR-QFIPXVFZSA-N 382.463 5.198 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(CC(F)(F)F)C3CCCC3)c2)cc1 485212901 VPPKXTWUZCAEAE-UHFFFAOYSA-N 388.389 5.298 30 20 GKED CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)c1cccc(OC(F)(F)F)c1 485540143 WONUAHGFIJHXIF-UHFFFAOYSA-N 381.247 5.020 30 20 GKED C[C@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 487455067 LYDJTGOBIYEYTR-IFXJQAMLSA-N 375.299 5.648 30 20 GKED Cc1nc(CNc2ccccc2SCCC#N)oc1-c1ccc(Cl)cc1 489728768 LWRLAONNZPLRPI-UHFFFAOYSA-N 383.904 5.921 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)c2ccc(COc3ccccc3C#N)o2)c(C)c1 497383291 GUYWVBZVXASWCX-SFHVURJKSA-N 388.467 5.180 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NC1CCC(c2ccccc2)CC1 500222662 VDIBUOZSPZUSHE-UHFFFAOYSA-N 375.516 5.206 30 20 GKED O=C(Nc1cccc(C#Cc2ccccc2)c1)N1CCC(OC2CCCC2)CC1 506129850 DRASHOVRSTWOJC-UHFFFAOYSA-N 388.511 5.042 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C1(c2ccc(OC)cc2)CCC1 508760981 FIEPIWWCNDXCHI-UHFFFAOYSA-N 375.921 5.047 30 20 GKED CCN(C(=O)c1csc(-c2cccc(Cl)c2)n1)[C@@H](C)c1ccc(C#N)cc1 509563245 FAHSFFOMNBHXCQ-AWEZNQCLSA-N 395.915 5.558 30 20 GKED N#Cc1ccc(SCc2nc(O)c3c(-c4ccccc4)csc3n2)cc1 509663233 DCDMPIAINXQYIY-UHFFFAOYSA-N 375.478 5.228 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1nc2ccccc2s1 513670821 BYNGDSKNXBNOFJ-ZDUSSCGKSA-N 393.855 5.403 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nc1 514639860 SFLCFQIANSMOQA-INIZCTEOSA-N 381.888 5.472 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cnc(-c4ccccc4F)s3)c2C#N)C1 518648200 MKPGMUAQLIPNDU-NSHDSACASA-N 397.500 5.259 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1cc(-c2ccncc2)ccc1OC 519478871 ZGOVWKWHMJOEIS-UHFFFAOYSA-N 390.531 5.113 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 520940202 IMOGJTVOHBUSSE-KRWDZBQOSA-N 399.535 6.054 30 20 GKED CC(C)c1ccc(CCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521259629 PTFKGEIMZODVQM-QGZVFWFLSA-N 381.545 5.426 30 20 GKED CC[C@@H](C)[C@@H](C)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CC1 524487448 JNPRWEBNMWUSTM-QZTJIDSGSA-N 376.500 5.176 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CSc3ccccc32)cc1 524560207 YRYFDGNXRIYGJH-LJQANCHMSA-N 387.464 5.319 30 20 GKED COc1cc(C#N)ccc1OCCS[C@H](C)c1ccc(OC(F)F)cc1 524887161 HWUCAHCOFCLDLJ-CYBMUJFWSA-N 379.428 5.041 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCC[C@H]2c2ccc[nH]2)cc1Cl 534918208 AAESZJKNRTXUMF-IBGZPJMESA-N 391.858 5.309 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 537478464 QYTJKAHWTXNTAN-OAHLLOKOSA-N 395.440 5.118 30 20 GKED CN(C(=O)c1cccc(CC#N)c1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 540632653 KKODHFAIEDOCKK-UXHICEINSA-N 386.417 5.180 30 20 GKED CC(C)(C)[C@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 542365285 VZRUNKAWSHIYDH-FQEVSTJZSA-N 391.515 5.232 30 20 GKED N#Cc1cc(Br)ccc1CNC1(c2cccc(C(F)(F)F)c2)CC1 554241632 OJRPNGGINHUYJC-UHFFFAOYSA-N 395.222 5.118 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(O)ccc2Cl)cc1F 556418604 VWSGYMIVINBNSE-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C[C@H](CSc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 563655156 GGTCQRSXDZKWDC-MRXNPFEDSA-N 389.480 5.112 30 20 GKED CC(C)c1ccccc1OC[C@@H](O)CNc1ccccc1S[C@H](C)CC#N 563881591 DJDXVNVFDGBYFI-MSOLQXFVSA-N 384.545 5.056 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC3(CCCC3)CC2)cc1 570405327 QJIZFYPXBUWWAM-UHFFFAOYSA-N 378.447 5.286 30 20 GKED N#CCC1(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)CC1 574705541 WOWLVOVLMYSVPK-PEZBUJJGSA-N 399.519 5.207 30 20 GKED N#CC[C@H](Cc1nc(Cc2nc3cc(Cl)ccc3s2)no1)c1ccccc1 579772159 QQGOHQGDRVCHAB-CQSZACIVSA-N 394.887 5.163 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 579999622 WRFGVKGJBVOCST-DEOSSOPVSA-N 399.494 5.105 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)C1 596745592 CBSFEORRGVCZJK-GOSISDBHSA-N 379.529 5.278 30 20 GKED Cc1ccc(-c2csc3ncnc(SC[C@H](O)CC(C)(C)C#N)c23)cc1 598705135 ZEMMFEUFJYOSEG-OAHLLOKOSA-N 383.542 5.060 30 20 GKED C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CC1 609080215 SYHYPWSTAYXEAJ-INIZCTEOSA-N 397.906 5.445 30 20 GKED CCC[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 609439022 SNRYWOJJEDMEPX-HKUYNNGSSA-N 381.545 5.614 30 20 GKED N#Cc1ccccc1/C=C/c1nc(-c2ccccc2OCc2ccccc2)no1 609475691 VUPNYMJQDMRWCT-CCEZHUSRSA-N 379.419 5.358 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)cc1 609552427 ZWJNKAHGBPXJDQ-RUZDIDTESA-N 391.474 5.817 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 609919558 FTTAXKAEGHLRBP-UWJYYQICSA-N 389.524 5.272 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)S[C@H](C)C1 610322714 DCVYOAMTHZHXQE-IYBDPMFKSA-N 381.501 5.017 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1oc2ccccc2c1COC 612795002 JHNBNUMRUZERAK-UHFFFAOYSA-N 375.877 5.123 30 20 GKED C=CCOc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320182 WEHBWORZBBTZFC-KRWDZBQOSA-N 394.883 5.518 30 20 GKED CC(C)(CC(F)(F)F)C(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 614393612 HLABVPJGRFWFSZ-UHFFFAOYSA-N 399.350 5.471 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2o1 614439790 IKBLLPUZLJXWRP-IBGZPJMESA-N 382.419 5.205 30 20 GKED C=CCC1(NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)CCCC1 619107089 ZYYWOBNTNIHOFR-UHFFFAOYSA-N 388.920 5.273 30 20 GKED CCSCc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 619108122 AYEJYZMVCXGAIM-UHFFFAOYSA-N 389.480 5.251 30 20 GKED C[C@H](CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(F)c1 619125169 KEDDUVLUBMZULM-LLVKDONJSA-N 387.339 5.489 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)cc2Cl)nnc1N1CCC(F)(F)CC1 670208420 KWVRCYADGVELBV-UHFFFAOYSA-N 387.261 5.064 30 20 GKED Fc1ccc(-c2nc(CN3C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C3)cs2)cc1 674458917 FCLGBLXWVMLUPZ-CHWSQXEVSA-N 398.347 5.122 30 20 GKED Fc1cc(Cl)ccc1CN[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 682085971 ZIYAQROORVOXFX-IAZYJMLFSA-N 377.731 5.478 30 20 GKED C#Cc1cccc(NC(=S)N(CC)[C@@H](C)c2cccc(C(F)(F)F)c2)c1 726484108 DCQNKKSVTJWSJQ-AWEZNQCLSA-N 376.447 5.467 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1csc(-c2ccccc2C)n1 727298297 RSWKOHQSEABAET-UHFFFAOYSA-N 398.871 5.262 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)Cn1nc(-c2ccccc2)sc1=S 729980821 IJZDLONFWIIIJC-UHFFFAOYSA-N 380.542 5.081 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccnn2C2CCCC2)cc1 730163039 AEOQIDSOZSQZNA-UHFFFAOYSA-N 390.418 5.054 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417809 SUDNNVKRJMNZRO-FZMZJTMJSA-N 388.851 5.041 30 20 GKED CC(=O)Nc1ccc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)cc1 731938682 RHPSUGVBZGKNGW-NTCAYCPXSA-N 392.455 5.120 30 20 GKED N#CCOc1ccc(COC(=O)[C@H](Sc2ccccc2)c2ccccc2)cc1 733382769 KXIZTZCBXTYYNX-JOCHJYFZSA-N 389.476 5.166 30 20 GKED COc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)ccc1SC 740010513 DFYPXIVNEQYVBW-UHFFFAOYSA-N 380.538 5.307 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc([N+](=O)[O-])ccc3Cl)c2)s1 740011768 SNCMDRQCCJASBB-UHFFFAOYSA-N 383.860 5.138 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC)c(OC)c2)c(SC)cc1OC 741165073 GHLMRTGPMHFCNB-SOFGYWHQSA-N 390.526 5.052 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cccc([N+](=O)[O-])c3)cc2Cl)c1 742261546 MFRZPDUEZRWKTL-UHFFFAOYSA-N 393.830 5.311 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744017177 ZOGYTCAQMMARCI-JSGCOSHPSA-N 388.414 5.685 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)CCc3ccccc3F)n2)cc1 744035379 QZAURUJDOBQSMO-VQIMIIECSA-N 392.499 5.703 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)COc2c(Cl)ccc(Cl)c21 748584304 PWZZFRZXZHXBIF-ZSOIEALJSA-N 383.234 5.109 30 20 GKED CC(C)(C)OC1CC(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)C1 753921071 NZTYINOSTLSCQR-UXUKBGGZSA-N 376.909 5.110 30 20 GKED CCS(=O)(=O)c1c(Cl)cccc1/C=C\C(=O)c1cc2ccc(C)cc2o1 754830646 UEXALWLNSNNWJO-KTKRTIGZSA-N 388.872 5.084 30 20 GKED CC(C)(C)OC1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 759494484 KUBYJBICKIQQGS-QFIPXVFZSA-N 391.515 5.153 30 20 GKED N#Cc1cccc(COc2ccc(Nc3snc(Cl)c3C#N)cc2F)c1 771204065 ULBSWYDOSZJMDC-UHFFFAOYSA-N 384.823 5.002 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)[C@H](C)c2nc3ccccc3s2)c1 772983805 LGHZVYGSDNJJNB-XYJFISCASA-N 379.529 5.259 30 20 GKED N#C[C@@H](C(=O)C1CCC(C(F)(F)F)CC1)c1nc(-c2ccccc2)cs1 774057321 XYWMMFUZHAEWOK-NRXISQOPSA-N 378.419 5.355 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 786308470 QGEVKJCSBGGSAH-OAGGEKHMSA-N 394.883 5.006 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)cc1 788571012 ISTSUJXTFMTMMQ-YTFSRNRJSA-N 385.442 5.159 30 20 GKED C[C@H]1C[C@H](CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C[C@@H](C)O1 801663450 SXXZXQLTONOEQM-YWNPBTLJSA-N 391.515 5.057 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3nc(Cl)c(C#N)s3)s2)cc1 804459485 WZHKAKCDFQGNEE-SNVBAGLBSA-N 390.921 5.282 30 20 GKED CCCCCCN(C(=O)CCCC#N)c1nnc(-c2ccc(Cl)cc2)s1 813037902 JKYDBYNUEVSAHP-UHFFFAOYSA-N 390.940 5.466 30 20 GKED N#C[C@H](C(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1nc(C2CC2)cs1 842939764 XDWXNMJNQUNYRW-VUUYWXRKSA-N 396.821 5.582 30 20 GKED CCCCCCN(C(=O)[C@H](C)CC#N)c1nnc(-c2ccc(Cl)cc2)s1 857593722 YQVVRTYTMSXSJU-CQSZACIVSA-N 390.940 5.322 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1coc(-c2cccc(Cl)c2)n1 914571817 JIWMAYLNTUXGGT-UHFFFAOYSA-N 380.753 5.565 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cnc(Cl)c(Cl)c1 915860058 FYLGECRYAFBOJH-UHFFFAOYSA-N 399.237 5.008 30 20 GKED CSc1ccc(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)cc1 916283568 IDTDAIWEEJSMDO-UHFFFAOYSA-N 391.521 5.038 30 20 GKED CCCCCCCCC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 916846794 FNUHMFFLXBSROY-HNNXBMFYSA-N 385.533 5.203 30 20 GKED Cc1cc([C@H](C#N)C(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)nc(C)n1 916880778 ZBDIHRXNAXOTAE-KMDWOBIYSA-N 393.899 5.365 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 916977427 QBTQLHFNEDXPGG-RTBURBONSA-N 392.911 5.760 30 20 GKED CC(=NNc1cccc(Cl)c1F)c1ccc(O)c(CN2CCCCC2)c1 921137810 MPVUHOBGYONQCU-UHFFFAOYSA-N 375.875 5.007 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc2ccccc2c1OC(F)F 1776075511 LWRVGUFRUBXNOX-UHFFFAOYSA-N 388.345 5.115 30 20 GKED Cc1c(NN=Cc2ccccc2OCCC2CCCCC2)cccc1C(=O)O 1776090154 WLCPFSRURPHWER-UHFFFAOYSA-N 380.488 5.488 30 20 GKED CC(C)(C)[C@@H]1C/C(=C\c2ccccc2C#N)c2nc3ccccc3c(C(=O)O)c2C1 1776121940 YGZYGISWVPBJAR-TVNWYLLRSA-N 396.490 5.954 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccc(C(=O)O)c3F)s2)cc1 1777430599 PELGKCRKPVCROK-KHPPLWFESA-N 381.428 5.160 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nnc(-c3ccc(C(C)(C)C)cc3)o2)cc1 7164287 BBOSXFBSXPTWLL-LJQANCHMSA-N 377.513 5.570 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2ccccc2Cl)[n+]2ccccc2)c1 10826973 ZWOKCPBXQLHAGT-UHFFFAOYSA-O 395.935 5.295 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)CCc2nc3ccccc3o2)cc1 23460022 QLYKBHRYWOULTC-UHFFFAOYSA-N 382.419 5.042 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Sc2nc3c(c(C)c2C#N)CCC3)c(Cl)c1 26523738 NHVHUBTYIVHJHL-AWEZNQCLSA-N 399.947 5.140 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2sc3cc(Cl)ccc3c2Cl)nc(C)n1 41574025 ISAKWFNIYSKSIY-GFCCVEGCSA-N 376.268 5.105 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCc2nc3ccccc3s2)cc1 65680167 BTCIZPYWMAJDSO-UHFFFAOYSA-N 399.475 5.532 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 66037245 JYZLYSBRQIVZGU-UHFFFAOYSA-N 386.451 5.319 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Cl)c(Cl)c1 66800695 UKIASSUSMTVRNK-GFCCVEGCSA-N 379.312 5.569 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66800986 YXEKTPXDPFUUBV-LBPRGKRZSA-N 399.566 5.827 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66954303 HALWDPXUVHEDOG-HZPDHXFCSA-N 383.517 5.362 30 20 GKED C=CCc1cc(C(=O)Nc2cc(-c3ccncc3)ccc2C)cc(OC)c1OC 101847740 KAMWAEWAJVRJOL-UHFFFAOYSA-N 388.467 5.055 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)nc1 107464143 WTFVRQCCFXQSNN-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1COc1ccccc1 113570177 LEYUBLOHVBDLRF-ROUUACIJSA-N 395.528 5.014 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 122853266 WLJCKJXPFWEDFH-UHFFFAOYSA-N 387.867 5.202 30 20 GKED C=CCn1c(S[C@H](C)c2nc(-c3ccccc3)no2)nnc1-c1cccs1 123163914 ISGFCZBCHSHOCH-CYBMUJFWSA-N 395.513 5.096 30 20 GKED C=C[C@@H](CC(=O)Nc1c(C)cccc1-c1nc(C(C)C)no1)c1ccccc1 124699844 SRVLBGVYERMCGI-KRWDZBQOSA-N 375.472 5.467 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1sccc1C#N 125696793 FHSDDVXHVRYWHZ-UHFFFAOYSA-N 383.476 5.325 30 20 GKED CCOc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)c(C(F)(F)F)c1 127988732 HKFUCBUWPBUCHP-UHFFFAOYSA-N 395.274 5.514 30 20 GKED CC[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 131984094 QXSXWPFFWBNYTJ-ZWKOTPCHSA-N 387.430 5.083 30 20 GKED COc1ccc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)cc1OCCCC#N 144668246 YUMHVEROQIJUJS-VQHVLOKHSA-N 389.411 5.005 30 20 GKED Cc1nc(-c2ccccc2)ncc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 151138448 NKOFGLNRYDEODR-UHFFFAOYSA-N 396.475 5.305 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 160970276 ZIBJXVICZWHFMF-WMZOPIPTSA-N 390.936 5.019 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)c1 176076070 KQRLLUYLRSOXCO-UHFFFAOYSA-N 398.409 5.639 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 185219428 MTFVZHYOGDEZCL-UZUQRXQVSA-N 398.466 5.361 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(NC(C)=O)ccc1Cl)c1ccc(F)c(F)c1 186352139 RKCPTPXYBQFFET-GOSISDBHSA-N 393.821 5.016 30 20 GKED Cc1cc(O)ccc1NC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 189916694 UNNUBNHXAZPQSE-UHFFFAOYSA-N 387.439 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)Oc1ccccc1OC 191461808 ZMHMTTHXZZBHFB-QGZVFWFLSA-N 382.504 5.136 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccn(-c2ccc(F)cc2F)n1 192200089 MYDKVHSEUCYFKI-CQSZACIVSA-N 384.455 5.157 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 208007073 PDBMCAJKEYODIT-NJHLSQGMSA-N 380.658 5.834 30 20 GKED CCSc1ccc(-c2nn(-c3ccccc3)cc2CNCCCCC#N)cc1 236949313 WPAPPCKFYFKNHE-UHFFFAOYSA-N 390.556 5.435 30 20 GKED C[C@@H](ON=Cc1ccc([N+](=O)[O-])o1)c1ncc(-c2ccc(Cl)cc2Cl)o1 255661944 CYOCZSHKNFRHKW-SECBINFHSA-N 396.186 5.261 30 20 GKED C[C@H](CC(F)F)C(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 415425869 DBPBAVPZALNIES-PRHODGIISA-N 377.275 5.059 30 20 GKED CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1cccc(SCC#N)c1 425154860 BOPDSUXQIKGYSU-UHFFFAOYSA-N 392.446 5.026 30 20 GKED C=CCC[C@@H](NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)c1ccccc1 426114918 WETYMKROVVJPSB-HSZRJFAPSA-N 396.506 5.224 30 20 GKED Cc1ccc(OC(F)F)c(CNc2ccccc2Oc2ncccc2C#N)c1 427549272 HZUZCIJKNRSNJA-UHFFFAOYSA-N 381.382 5.268 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C#N)cc2Cl)c(Sc2ccccc2)n1 430352545 KZGYLVDSHWLALO-UHFFFAOYSA-N 379.872 5.319 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 435615504 PLYQHAMEHIMQRU-HKUYNNGSSA-N 379.529 5.910 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)cc1 436115277 NUYVTNJBTJIMMW-UHFFFAOYSA-N 390.380 5.316 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N(CCC(F)(F)F)CC3CC3)c2)cc1 438979713 PZBXTMLZPMMVIG-UHFFFAOYSA-N 387.405 5.106 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N[C@H](CCC#N)c1ccccc1 439376723 GMGGMRJVWJKSDN-OAQYLSRUSA-N 381.545 5.803 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(c3ccc(F)cc3C#N)C2)n1 447682986 LWHKBESXZRAWRB-OAHLLOKOSA-N 393.487 5.213 30 20 GKED C/C=C/COc1cccc(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 448936377 FZVAULRSUGTFGD-IDOMTICXSA-N 380.513 5.074 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(OCC)ccc1Cl 455753777 KWRSOYUISMSOAS-UHFFFAOYSA-N 390.915 5.126 30 20 GKED COCCOc1ccc(C#N)cc1N[C@H](C)c1csc(-c2ccccc2F)n1 462812506 ZUKVISCPUVMIBB-CQSZACIVSA-N 397.475 5.019 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCCCSCC#N)n2)o1 466662659 ZLLLSHLQXHDNPI-UHFFFAOYSA-N 397.447 5.279 30 20 GKED C=CCC1(C(=O)N2CCC[C@H](c3nc(-c4ccccc4OC)cs3)C2)CCC1 470413467 FTJODPKDJMJAHP-KRWDZBQOSA-N 396.556 5.271 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)ccc1OCCC(C)C 474430322 HKVJUIJCKDFPJZ-MRXNPFEDSA-N 386.517 5.190 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F)c1ccccc1 476050201 LITZOYTWZOXAIX-CQSZACIVSA-N 396.796 5.307 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(OC(F)F)c(C(F)(F)F)c3)cc2)CC1 477586219 GPOIUHOYGXPAKU-UHFFFAOYSA-N 396.315 5.114 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1OCCC 483207428 ZVLFJNLKOXEDTN-FQEVSTJZSA-N 388.467 5.302 30 20 GKED CCCCCn1cc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)c2ccccc21 483233628 UQBYCLLXXQALPZ-GOSISDBHSA-N 382.467 5.265 30 20 GKED Cc1nc2ccc(NC(=O)c3ccccc3Sc3ccccc3C#N)cc2o1 483402945 QRMWPFFZQGUKES-UHFFFAOYSA-N 385.448 5.411 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)c(Cl)cc1OC 484971565 AYKVJSVHCVSSQH-UHFFFAOYSA-N 390.270 5.094 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCCC[C@H]1c1nc(-c2ccccc2)no1 487385947 AVPYQGCQFJTMEL-NRFANRHFSA-N 386.499 5.265 30 20 GKED C=CCn1c(SCc2cc(Br)ccc2Cl)nnc1C1CC1 495882386 FEXHBQQHYRXXAM-UHFFFAOYSA-N 384.730 5.050 30 20 GKED C=CCOc1ccc(C(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1OC 498972023 HWWIIXAYCXEYJC-AWEZNQCLSA-N 393.405 5.112 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)N(Cc2ccc(C#N)cc2)C2CC2)C1 499268728 BCTIZHVVLZITSL-AUSIDOKSSA-N 382.548 5.205 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)c12 504312039 XKPHMPZETCZTHW-UHFFFAOYSA-N 395.462 5.108 30 20 GKED Cc1sc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 512630233 LWBRXWYHFDSYPL-CHWSQXEVSA-N 399.922 6.195 30 20 GKED C[C@H](NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccncc1F 513387502 BWCKVCMYXKGMMO-ZDUSSCGKSA-N 395.821 5.029 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1)C1CC1 513899710 IHLPVQMUYKIOJZ-OAHLLOKOSA-N 399.441 5.035 30 20 GKED Cc1ccc(C)c(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1 513960866 QFDXAFGTAATDJS-UHFFFAOYSA-N 387.458 5.549 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 517789919 LKECKLQEDOAQNS-ICSRJNTNSA-N 392.396 5.068 30 20 GKED CC(C)Cc1ccc([C@H](C)NC(=O)CNc2ccccc2SCCC#N)cc1 518661248 VNEFECGOMXMIAW-SFHVURJKSA-N 395.572 5.180 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 520056241 LGYISSCJUZHPOX-INIZCTEOSA-N 378.950 5.336 30 20 GKED CN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600616 HEPOAJTVXOLAHS-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C=CCn1c(SCCc2c(F)cccc2Cl)nnc1-c1ccoc1C 520687542 ROBLZMOAYGTKDW-UHFFFAOYSA-N 377.872 5.160 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cn2)cc1Cl 522895268 ALAVVSHONCAZHK-KRWDZBQOSA-N 382.250 5.296 30 20 GKED CCCc1nnc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 523881710 OOAJVXBHWNQPJE-UHFFFAOYSA-N 398.875 5.060 30 20 GKED CCc1c(C)sc(NC(=O)COC(c2ccccc2)c2ccccc2)c1C#N 524105542 JGMNQWGAEJXQRS-UHFFFAOYSA-N 390.508 5.235 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 524567645 UWEQMLDHZJKWKS-FCHUYYIVSA-N 393.408 5.130 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 524938046 KNFNNEXECROHJF-DLBZAZTESA-N 393.380 5.043 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2sccc2C#N)nc1-c1ccccc1 525207299 KPWZRPGSRQVDNQ-KRWDZBQOSA-N 391.496 5.375 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 539126503 BRWSOAHNPPWMHG-INIZCTEOSA-N 386.455 5.191 30 20 GKED CC(C)N(Cc1ccco1)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543016279 HCQLFJYDSQNYBQ-SFHVURJKSA-N 387.483 5.499 30 20 GKED CC(=O)[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1(C)C 545395134 YRLCGHOPEKFPBO-NQIIRXRSSA-N 390.483 5.239 30 20 GKED CCc1nc(C)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 548294598 QRKFYVFQIMYDEC-UHFFFAOYSA-N 377.469 5.125 30 20 GKED C=C(C)Cn1c(-c2ccccc2C)nnc1N1CCC(OC2CCCCC2)CC1 549253909 IZHFSKRYSGXIOM-UHFFFAOYSA-N 394.563 5.148 30 20 GKED C=CCC(C)(C)c1noc(-c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 551144505 TUXGKMTUURCQQQ-CQSZACIVSA-N 393.447 5.067 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccc([C@H]2CCOC2)cc1 564778049 YWXRNDUMJSTILC-WBVHZDCISA-N 381.501 5.086 30 20 GKED CSc1nc(C2CC2)cc(-c2nc(CSc3ccc(F)cc3)no2)c1C#N 567144415 MPBGIUNIFNIZPZ-UHFFFAOYSA-N 398.488 5.034 30 20 GKED COc1ccc(CNc2ccc(Oc3cccnc3)cc2)cc1OCCCC#N 567645249 DYCSNDIUDRIEJL-UHFFFAOYSA-N 389.455 5.177 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(c2cccs2)CCCCC1 572708654 XGUYGTMJDRKGIN-UHFFFAOYSA-N 385.577 5.332 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(C)cc1C 577029821 YBJWZJVKUYJLFR-UHFFFAOYSA-N 388.427 5.015 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C)c(Cl)c1F 578145064 APIOXZWKBLRULN-UHFFFAOYSA-N 395.821 5.407 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCSc3ccccc3F)cc2)ccn1 583055616 OMZQCNDBOSAFOH-UHFFFAOYSA-N 393.443 5.006 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(F)cc2)cc1Cl 603673355 IFBKWCZSGLHKCQ-FQEVSTJZSA-N 394.833 5.152 30 20 GKED CCCCOc1ccccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 604025395 FURHHASZBCDNNE-UHFFFAOYSA-N 390.439 5.161 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc4sccc4s3)s2)cc1 604171842 WIWJPFURCLWQPK-UHFFFAOYSA-N 381.507 5.134 30 20 GKED C[C@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 606190480 OERVTLLSZIRIHZ-SNVBAGLBSA-N 393.302 5.996 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1 606941428 CHQCEPUCXBYBNT-UHFFFAOYSA-N 393.531 5.102 30 20 GKED CC(F)(F)CCC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 607535936 CVCMVJMHRBYMJO-UHFFFAOYSA-N 377.325 5.437 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1ccccc1Cl 609222010 NXMZXIQGLKRBSY-HNNXBMFYSA-N 391.858 5.443 30 20 GKED CC(C)c1cc(CNC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)on1 609724634 FSBLDRBGMFCWOW-UHFFFAOYSA-N 395.846 5.045 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNC(=O)c1c(Cl)cc(C#N)cc1Cl 615811482 ICDUXMRVQXGQFK-UHFFFAOYSA-N 387.188 5.122 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 679978398 YFBGWECDYKGOPH-JOCHJYFZSA-N 390.442 5.264 30 20 GKED C#Cc1cccc(N(C(=O)c2cnc(-c3ccccc3Cl)s2)C(C)C)c1 728247244 WAJGGHXZWVCTDH-UHFFFAOYSA-N 380.900 5.500 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1cccc(OCc2ccccc2)c1 734479176 HMPXXLRHYQTKPC-UHFFFAOYSA-N 383.373 5.163 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2ccc(Cl)cc2Cl)c1Cl 734745964 CLNNIAHJLPBYGZ-UHFFFAOYSA-N 379.678 5.493 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC3CCC3)cc2)cc1 742536889 DELOFSYNOPPZCG-XMMPIXPASA-N 382.463 5.526 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(C(F)(F)F)CC2)cc1 743095872 MWIRYEOLPWPLQH-LJQANCHMSA-N 387.405 5.148 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Cl)ccc2Cl)cc1OCCCC#N 747361612 RNFWMTOXVXMBIG-YWEYNIOJSA-N 390.266 5.581 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)cnn1-c1ccccn1 748441119 IQPQEFPGHWFLAX-SOFGYWHQSA-N 391.780 5.144 30 20 GKED N#CCSc1ccccc1C(=O)NCC1(c2ccc(Cl)cc2)CCCCC1 750761606 RNPNSMZSYRCYBD-UHFFFAOYSA-N 398.959 5.588 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C/c2ccnc(Cl)c2)cc1 757932582 GGWISQCVEOHONE-BJMVGYQFSA-N 375.815 5.051 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)C(=O)Nc1cccc(C)c1 766842303 WJZSUJBNDJORGR-ISBHARSQSA-N 387.266 5.053 30 20 GKED Cc1c(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1C1CCCC1 770177147 DPOSPWZGLSPBTI-QFIPXVFZSA-N 399.498 5.606 30 20 GKED CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(C=NOC2CCCC2)cs1 774609610 YLFROAQZAXPBAE-UHFFFAOYSA-N 397.422 5.140 30 20 GKED C[C@H](C1CC1)N(C(=O)Cc1ccccc1CC#N)c1cccc(C(F)(F)F)c1 776823483 DQXIKBNNSSBPMF-OAHLLOKOSA-N 386.417 5.146 30 20 GKED COc1ccc(N[C@H]2CCCc3cc(C#N)ccc32)cc1OCc1cccnc1 776827353 LPNXXEFAELQUBZ-QFIPXVFZSA-N 385.467 5.030 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc([N+](=O)[O-])cc1Cl 782188953 MPMLYGXWQLEGNQ-UTCJRWHESA-N 376.846 5.329 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCCS1)c1nc(-c2ccc(Cl)cc2Cl)cs1 783354712 GHBVDNZMGWOTKC-WFASDCNBSA-N 397.352 5.579 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2c(Cl)ccc(F)c2C)cc1OC 791042993 OIFIXWGTCCDNPZ-UXBLZVDNSA-N 375.827 5.013 30 20 GKED C/C(C=Nn1cnc2sc(C)c(C)c2c1=O)=C\c1cccc(C(F)(F)F)c1 807949180 XGYBWEPSMVVDDG-KONSTAPESA-N 391.418 5.031 30 20 GKED N#Cc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c(C(F)(F)F)c1 811690413 AOFXRKXLIOWIBD-BQYQJAHWSA-N 378.353 5.535 30 20 GKED N#CCCC[C@@H](NCc1cnn(Cc2ccccc2)c1Cl)c1ccccc1 814304794 RGKQYDIDRJJXOO-OAQYLSRUSA-N 378.907 5.110 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCCC2(F)F)cc1 836270566 UQQBGPAIJGWXIZ-AZUAARDMSA-N 383.442 5.289 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)CCCCC#N 846861055 SMQVFGTXTRUIDO-UHFFFAOYSA-N 385.386 5.075 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)sc2cccc(F)c12 917026456 ZJWKQWYDYNLQMX-CQSZACIVSA-N 392.480 5.962 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(-c2ccncc2)nc2ccccc12 917524826 FAIHBAAYTJFQJU-UHFFFAOYSA-N 385.492 5.187 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cc1)c1sc2ccccc2c1C(=O)O 1776052206 PUYATZMXLPRNGR-UHFFFAOYSA-N 378.375 5.454 30 20 GKED CC1(C)Cc2cccc(/C=C\C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)c2O1 1776569855 PUTDIHUSSPTAFB-KHPPLWFESA-N 388.419 5.254 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776697893 XEMURNQOAWJMAO-SICOMBFOSA-N 390.504 6.523 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CCc2ccccc2)C(=O)O)cc1 1776786484 MRBSWSCSJVEXRQ-HSZRJFAPSA-N 383.532 5.211 30 20 GKED COc1c(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)ccc2[nH]ccc12 1777254457 CSCBWVOYKIBIHK-VQHVLOKHSA-N 387.391 5.031 30 20 GKED COc1ccc2c(c1F)C/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777373697 SCQLIIVYDBPNCT-LDADJPATSA-N 388.394 5.022 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)ccc1OCC#N 22608729 HVZHQGDUTIQJTP-KRXBUXKQSA-N 393.439 5.361 30 20 GKED CCN(Cc1ccccc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161417 DQRHSJILJBKJCK-UHFFFAOYSA-N 399.494 5.386 30 20 GKED Cc1ccc(C#N)cc1NC(=O)NCc1nc(-c2ccc(Cl)cc2)c(C)s1 58451504 LMNNVMBQEIYKFL-UHFFFAOYSA-N 396.903 5.274 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3cccc(F)c3)n2)cc1 69286486 SWZDIOLOITYJOS-KUHUBIRLSA-N 394.471 5.013 30 20 GKED C[C@H](NC(=O)NCCC(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 106116372 SZNWYSMOEXOIGR-IBGZPJMESA-N 383.495 5.141 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1ccc(Cl)c(Cl)c1 108201882 HNSCVOHPXSMAHX-UHFFFAOYSA-N 381.284 5.017 30 20 GKED Cc1c(C#N)c(NC(=O)CS[C@H](C)c2ccc(F)cc2)n(C2CCCC2)c1C 109369785 UXJRMPAYWPZBOR-MRXNPFEDSA-N 399.535 5.664 30 20 GKED Cc1ccsc1CCCC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 129594547 NZSKKJPJSOJCCD-QGZVFWFLSA-N 391.521 5.251 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C/c1cnc(C(C)(C)C)s1 173265562 YNQQIIAHMILXSO-ATWMFIQVSA-N 385.558 5.487 30 20 GKED C=C(C)CN(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 181723951 QLZSEONSXYUMGX-UHFFFAOYSA-N 383.345 5.072 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3ccccc3O[C@@H](C)C#N)sc2C)cc1 182131338 YHNWGENCEOPWBB-AWEZNQCLSA-N 392.480 5.275 30 20 GKED CCCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@H](C)c1cc2ccccc2o1 184312035 BOIOOPWNOLNFOE-DLBZAZTESA-N 391.471 5.729 30 20 GKED Cc1cc2occ(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)c2cc1C 187492475 KEILVPNMYBMUGQ-GOSISDBHSA-N 397.459 5.535 30 20 GKED C[C@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)c1cccc(C#N)c1 189860068 BJFOSBHUPZDMBE-INIZCTEOSA-N 389.528 5.570 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CCCN2CCCC2)CC1 191494916 QRCWNGKDRYHDIU-UHFFFAOYSA-N 397.607 5.658 30 20 GKED N#Cc1csc(/C=C(\Cl)c2nc(O)c3c(-c4ccccc4)csc3n2)c1 255229201 CVIXFYHZKLZUPL-CHHVJCJISA-N 395.896 5.734 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](/C(O)=N/[C@@H]3CSc4ccccc43)C2)c1 329659821 OFSJVLIBCYDYBW-QFBILLFUSA-N 395.528 5.056 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](Cc2ccccc2)c2ccccc2F)c1 430606410 VMQPJGOMANQOLR-JOCHJYFZSA-N 390.483 5.155 30 20 GKED N#CCSc1cccc(C(=O)N2CCc3ccccc3[C@H]2c2ccccc2)c1 430703398 KDRMWOAODPWMNM-HSZRJFAPSA-N 384.504 5.090 30 20 GKED COC(=O)c1ccccc1-c1ccccc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 435617042 OCXFPWAUCLHDLL-UHFFFAOYSA-N 398.462 5.194 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c1 437560956 SYQSMOFHALAERT-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(OC2CCCC2)c1 437907702 KIESAMHYOMBJJS-DHIUTWEWSA-N 389.499 5.312 30 20 GKED N#Cc1cccc(-c2nnc(CN3CC=C(c4cccc5ccccc45)CC3)o2)c1 441535148 OZHQAJNWELBFNY-UHFFFAOYSA-N 392.462 5.051 30 20 GKED Fc1cccc(F)c1CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444741018 HBUPZWOLUWXSFP-HNNXBMFYSA-N 383.282 5.767 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cc(NC(=O)CC)ccc2Cl)CCCC1(C)C 444845557 HHWWNJZFTPETSW-KRWDZBQOSA-N 377.916 5.287 30 20 GKED Cn1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C2CCCCC2)n1 455718848 LTYJKVJDHPAIRH-IBGZPJMESA-N 379.508 5.024 30 20 GKED COc1ccccc1[C@H](C)SCC(=O)N(CCC#N)c1cccc(Cl)c1 463203622 GFIORVVUTZJCIY-HNNXBMFYSA-N 388.920 5.090 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)cc2)ccn1 464667950 KVUATOAXYVPPTM-MSOLQXFVSA-N 389.377 5.053 30 20 GKED CC(C)(C)Nc1ccccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 466449664 UEMCETQGKCVJLM-UHFFFAOYSA-N 389.455 5.193 30 20 GKED COc1ccc(-c2nc(NC(=O)C[C@@H](CC#N)c3ccccc3)sc2C)cc1 474396490 VZFMGSXROOVZCS-GOSISDBHSA-N 391.496 5.153 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccccc1 476059133 FNUQIMQRDAGYPU-SFHVURJKSA-N 384.479 5.880 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477523573 BLAHQTZRFFZJMR-FQEVSTJZSA-N 397.522 6.283 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)NCC(C)(C)CCC#N 477942744 OCRWJTCPKIARLQ-UHFFFAOYSA-N 397.544 5.439 30 20 GKED N#Cc1cc(C(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)ccn1 483057138 GMRCCLLQZKOPFM-UHFFFAOYSA-N 390.855 5.195 30 20 GKED N#C[C@@H](C(=O)c1occc1CSc1ccccc1)c1nccc2ccccc12 483202178 QUTDKFJQLPFGGB-HXUWFJFHSA-N 384.460 5.610 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1nccc2ccccc12 483229052 NLUMGSRRDYBVFD-IBGZPJMESA-N 388.373 5.479 30 20 GKED C=CCC[C@@H](C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 487762772 QXJKCOJDOCOVRX-NVXWUHKLSA-N 383.442 5.359 30 20 GKED Cc1cc(N[C@H](c2ccccc2)c2cccnc2)n2c(nc3ccccc32)c1C#N 488011728 VHODMVXKWRKKJT-XMMPIXPASA-N 389.462 5.264 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C)c1ccccc1 488695915 AVKAJSWMZSGAPG-DENIHFKCSA-N 390.527 5.308 30 20 GKED COc1cccc(Cn2ccc3ccc(NC(=O)C4(C#N)CCCCC4)cc32)c1 490273652 NWDYMZVRMQZKCB-UHFFFAOYSA-N 387.483 5.111 30 20 GKED CCOc1ccc([C@H](NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 505319355 QNJVAJRQLGVVMS-MHECFPHRSA-N 399.494 5.107 30 20 GKED N#Cc1c(NC(=O)c2ccc(Sc3ccccn3)cc2)sc2c1CCCC2 508912539 AFAIBAOFUBSPMQ-UHFFFAOYSA-N 391.521 5.297 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1sc(C(C)C)nc1C 516230050 PBUNFVBYMBJRBB-UHFFFAOYSA-N 391.496 5.800 30 20 GKED C=C(C)CN(CC)C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2 517131790 QUSAVHYQHLKDNT-UHFFFAOYSA-N 384.501 5.039 30 20 GKED CCc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 517461740 MZFNXYUQYLRUOG-UHFFFAOYSA-N 378.419 5.526 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518918972 AALDIAHJFMCBHZ-MRXNPFEDSA-N 376.481 5.440 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521748148 MYELQRGKXPIYHB-HZPDHXFCSA-N 399.585 5.933 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@H](C)O1 522088417 XGTPFLFQIPNROZ-YOEHRIQHSA-N 399.878 5.035 30 20 GKED CSCc1cccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1 522302610 KHJZWHHIQUTCKG-UHFFFAOYSA-N 388.492 5.253 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2cccc(COc3ccc(C#N)cc3)c2)C1 524500317 FQIQQBTUYGCQDF-HSZRJFAPSA-N 396.490 5.075 30 20 GKED CC[C@@H]1CCCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 524828677 NZGYKDZHEGDLKD-OAQYLSRUSA-N 391.515 5.632 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 533993757 DBFQIKWIWHYFBT-YWZLYKJASA-N 379.891 5.240 30 20 GKED Cc1ccc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c(Br)c1 535097694 YLAGAUMAGGNAND-OAHLLOKOSA-N 398.087 5.059 30 20 GKED C=CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1nc(-c2ccccc2)cs1 538268973 RRSRXVLFGNEAEW-UHFFFAOYSA-N 379.872 5.168 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1ccc(CC#N)cc1 539849378 AZOTXMHPXWQCRL-UHFFFAOYSA-N 375.497 5.096 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 543304916 SHDBEEUNZKXRSA-RTBURBONSA-N 393.556 5.719 30 20 GKED CCCc1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)co1 544738022 SHMXGVLHETVTAD-QGZVFWFLSA-N 379.847 5.188 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(Cl)c1 558512101 SJCMLHYZAMBBEI-CQSZACIVSA-N 392.846 5.282 30 20 GKED CC(C)c1scnc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 571812400 LCEJAJLNQRKZLM-UHFFFAOYSA-N 395.459 5.109 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(F)(F)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 574093128 DKXHBENVIKKXEJ-CZUORRHYSA-N 390.396 5.399 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](F)(c2ccccc2)C1 576532173 HTENKYRIJJXMFQ-IIBYNOLFSA-N 383.492 5.183 30 20 GKED C=C(C)COc1cccc(NC(=O)NCc2ccc(Oc3ccccc3)nc2)c1 589741480 HJNFUGGDMAMSJV-UHFFFAOYSA-N 389.455 5.151 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C2CCOCC2)cc1 601128834 DTJKAQSKKWYCQD-MRXNPFEDSA-N 380.513 5.085 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C1=Cc2ccccc2OC1 603532872 BJTZUQFVVAPCBS-UHFFFAOYSA-N 398.437 5.015 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)sc2c1CCCCCC2 603996118 AADMBMRIHCLEEH-OLZOCXBDSA-N 384.467 5.586 30 20 GKED CCC[C@@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609080584 OVTMVFWLDHZNLG-OAHLLOKOSA-N 385.895 5.443 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)CCOc1ccccc1-c1ccccc1 609358701 OMOAHTFZTJGKQQ-UHFFFAOYSA-N 387.483 5.189 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccccc2)n1 609376482 AVZORIDRRBLSAW-CQSZACIVSA-N 379.510 5.314 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 609427785 LBXLHNWEUITOOD-AWEZNQCLSA-N 388.920 5.774 30 20 GKED COc1ccc(CNc2cc(C)cc(C(F)(F)F)c2)cc1OCCCC#N 616999948 ZFYALBMENAFIHN-UHFFFAOYSA-N 378.394 5.317 30 20 GKED CC(C)c1ccc(C[S@](=O)CCCC2(C#N)CCOCC2)c(C(C)C)c1 619589487 DKJZKTOQUWVLGU-AREMUKBSSA-N 375.578 5.283 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)c1sccc1Br 642633525 OTIVSRUQOWLLCV-UHFFFAOYSA-N 388.311 5.224 30 20 GKED FC(F)(F)[C@@H]1C[C@@H](N[C@@H](c2ccccc2)C(F)(F)F)C[C@H](C(F)(F)F)C1 643307153 ZZNZIGUIMHWELP-LOWDOPEQSA-N 393.293 5.789 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2c1 674407787 HTPXNDNFQGZIJA-FQEVSTJZSA-N 377.447 5.459 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(C2CCC(C(F)(F)F)CC2)n1 685383450 ZGQDTQLCJYFZEV-GDKBPFBDSA-N 396.306 5.983 30 20 GKED O=C(NC[C@H]1CCCC[C@@H]1C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 685772853 GUSSBQXHXFXJRU-SCZZXKLOSA-N 389.286 5.082 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccccc2F)cc1 726858508 NNAXGGMSFNWTSW-OXQOHEQNSA-N 380.463 5.009 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1Cl 727627479 GQORCZOJEJTHRE-GWKQRERASA-N 378.884 5.743 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 731195453 HJCIBHOMXUJLBY-GFCCVEGCSA-N 392.267 5.013 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(F)cccc2s1)c1cccc(Cl)c1Cl 731196074 WPBVDHDHIIVPED-CYBMUJFWSA-N 379.243 5.342 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(N4CCCC4)cc3)cc2)cc1 731962306 ILDPMINSUKUPPL-UHFFFAOYSA-N 397.478 5.397 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 732732109 JEOUVSZNQHKVTA-RQMBKDMJSA-N 393.899 5.412 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)c(F)c2)cc1 733259061 PWZNPEMRNIMFTM-OAQYLSRUSA-N 394.833 5.149 30 20 GKED CC(C)Oc1ccccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733621269 IQNPYLNLQXIYTD-OAQYLSRUSA-N 385.467 5.773 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=S)Nc2ccc3ccccc3c2)c1 733753837 FNEVZYTZRFDYRF-HXUWFJFHSA-N 375.497 5.007 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc(OC)ccc3OC)s2)cc1 733867689 RYMIBJVZPULHDM-YRNVUSSQSA-N 395.480 5.040 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc(SC(F)F)cc1 734981164 OBWQLDMKACVRSC-FMIVXFBMSA-N 397.446 5.871 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ccn(-c2cccc(F)c2)n1 735318267 IYMOCNJUHKRHDX-UHFFFAOYSA-N 387.867 5.001 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)cc1 742259687 OIMFJAANKJWVFQ-AREMUKBSSA-N 378.475 5.621 30 20 GKED C[C@H](NC(=S)N[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 743059190 BHYZBRMUHQCUMN-NWDGAFQWSA-N 378.328 5.151 30 20 GKED N#C[C@H](C(=O)CCCC1CCCC1)C(=O)Nc1ccccc1Oc1ccccc1 744029421 TUFRCFZHHQGGFM-HXUWFJFHSA-N 390.483 5.487 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Oc3ccc(F)c(F)c3)n2)cc1 744936594 TZKLOUONMSDOOO-XJKSGUPXSA-N 398.434 5.041 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)n1 747198676 JUKFGZCTTMQSEY-MGPQQGTHSA-N 379.312 5.553 30 20 GKED Cc1cc(C(=O)NC2(c3cccc(C#N)c3)CC2)c(C)n1[C@H](C)c1ccccc1 749016106 SEBSCKGRHIHTKZ-GOSISDBHSA-N 383.495 5.005 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCCCCC2)cc1 750705073 XFMWFJGZNZEIJJ-UHFFFAOYSA-N 379.460 5.157 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(F)c(Br)c1 753143684 XWABVSHQXZZQDV-FNORWQNLSA-N 389.249 5.003 30 20 GKED C=C[C@H](CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 758983244 GARNTOKMDVTDNS-OAHLLOKOSA-N 384.451 5.471 30 20 GKED C=C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 759207466 BINUOBCVAFXUGJ-ACJLOTCBSA-N 387.266 5.001 30 20 GKED C=CC[C@H](N[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1)c1ccncc1 766022542 WUGQNKRBPUWXJB-KOSHJBKYSA-N 376.475 5.768 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Br)cc1 769772885 DUCRFHDUTFGGGA-IUODEOHRSA-N 399.313 5.429 30 20 GKED N#C[C@@H]1CCC[C@@H](NCCCCCCc2nc(-c3ccc(Cl)cc3)no2)C1 774368958 IHAIJBAVQPGCJW-VQIMIIECSA-N 386.927 5.165 30 20 GKED C[C@@H]1C[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCO1 776513918 BTNIWTLXTGNVHW-JTNHKYCSSA-N 395.311 5.108 30 20 GKED N#Cc1cc(C(=O)Nc2c(O)c(Cl)cc(Cl)c2Cl)ccc1Cl 777806064 FWKOVYVKOBYXHT-UHFFFAOYSA-N 376.026 5.130 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc(Cl)n1 778608046 WBXBRRPHYDTYIM-NSHDSACASA-N 395.793 5.162 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21 779302297 UPVBXWFFZYNVRA-QFIPXVFZSA-N 384.504 5.387 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(OCc3cccc(F)c3)c(F)c2)cc1 779595462 JLUODSTXZAIBKT-INIZCTEOSA-N 394.421 5.447 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)Nc3ccccc3O[C@H](C)C#N)cn2)cc1 780495579 KLXDLNCMNZUSNH-MRXNPFEDSA-N 388.427 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C(C)C)[C@@H](O)c1ccccc1 788682596 SPBYCILCKTVHJY-GGAORHGYSA-N 380.532 5.418 30 20 GKED CCOc1c(Cl)cccc1CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 791778255 TUDXOMBZCFZTAX-MRXNPFEDSA-N 396.899 5.281 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(Cl)cc2Cl)cn1 792860761 XSURVCXPSGECAH-RMKNXTFCSA-N 385.250 5.355 30 20 GKED COc1ccc(NN=C(C)c2nc(C(F)(F)F)cs2)c(C(F)(F)F)c1 793098389 MPFCELXILWUFSO-UHFFFAOYSA-N 383.317 5.025 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(F)c(Cl)c1)C(=O)c1ccc(C2=CCCC2)cc1 810531079 JOTDKRXHAMJURB-QGZVFWFLSA-N 382.822 5.008 30 20 GKED C#C[C@@H](NC(=O)c1ccccc1SCc1cscn1)c1ccc(Cl)cc1 811947957 UFVGDFKBPJDMJN-GOSISDBHSA-N 398.940 5.193 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1 813218396 VKUCQJARDKRZFW-XKOZXHHJSA-N 398.306 5.399 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(Cl)n2)cc1Cl 821671899 POMJTOLSJWMARD-CQSZACIVSA-N 388.279 5.358 30 20 GKED N#CCSc1ccccc1C(=O)Nc1nc(-c2ccccc2Cl)cs1 871208697 XMIOAPNODRZZJN-UHFFFAOYSA-N 385.901 5.331 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2cccc(C(F)(F)F)c2)cc1 914772041 ICVIGNUDYLTABC-UHFFFAOYSA-N 392.425 5.415 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCSc3ccccc32)cc1 915350527 XPJAPCSMGPPMNP-FGZHOGPDSA-N 399.519 5.701 30 20 GKED Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1C=NNc1ccccn1 916273612 NCYIYSAQQNRJTL-UHFFFAOYSA-N 394.693 5.041 30 20 GKED C[C@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047303 WMRQJYWLZAQSJK-WFASDCNBSA-N 386.929 5.448 30 20 GKED Sc1nnc(-c2cccc(Cl)c2)n1N=Cc1cccc(OC2CCCC2)c1 917540999 ZOBLQVZOGFLSKY-UHFFFAOYSA-N 398.919 5.091 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776114746 ZOHCPDGIXRXCHG-PXLXIMEGSA-N 398.458 5.966 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)o2)cc1 1776125804 SWNVXTTVMRCBPK-WXUKJITCSA-N 382.456 5.623 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cs1 1776280435 KPLLXGLUECWGCA-JLHYYAGUSA-N 391.492 5.702 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2F)cc1)c1ccccc1 1776469372 BFAHDVLECDOPLZ-ASNKMWSDSA-N 390.410 5.560 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C)c2ncc(C(=O)O)s2)c1 1776787900 CJYVDCCCIQPEIV-OAHLLOKOSA-N 376.522 5.041 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777545380 YFRHZSGDUUZLGR-AUWJEWJLSA-N 388.467 5.342 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(Cl)cc1)=C(/S)Nc1ccccc1 10170274 KMCVCZZGYBPWHY-UHFFFAOYSA-O 395.935 5.241 30 20 GKED CC(C)Cn1c(SCc2ccc(C#N)cc2F)nnc1-c1ccccc1F 11019609 WGMJRAJATOIGKN-UHFFFAOYSA-N 384.455 5.043 30 20 GKED N#C[C@H](C(=O)c1ccc(C2SCCCS2)cc1)c1nc2ccccc2o1 41544224 DVPCVJHCIFVDSK-OAHLLOKOSA-N 380.494 5.187 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)Cc1coc(-c2ccc(Cl)cc2)n1 63381221 JUTCUYJLKVTEBH-UHFFFAOYSA-N 383.835 5.091 30 20 GKED Cc1cccc(C)c1Oc1ccccc1NCC(=O)Nc1ccc(CC#N)cc1 63469581 XYLFVYGDZVWTNT-UHFFFAOYSA-N 385.467 5.212 30 20 GKED CCCN(C(=O)[C@H](C)Oc1ccccc1C#N)[C@H](C)c1cc2ccccc2o1 65419703 QPSIKUXGGZNAEA-SJORKVTESA-N 376.456 5.072 30 20 GKED CCOc1cccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66954728 KCISPPUCLGMBAG-HZPDHXFCSA-N 383.517 5.362 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)CCCOc1ccccc1 66954846 MZXWSVVNBGULNF-QGZVFWFLSA-N 383.517 5.014 30 20 GKED O=C(Nc1ccccc1Cl)/C(Cl)=N/Nc1ccc(Cl)cc1Cl 100356669 VHNCDIYEINKKNG-BKUYFWCQSA-N 377.058 5.250 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1OC1CCC1 118544603 DIOIGRQHKFELHJ-MRXNPFEDSA-N 395.528 5.334 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nc(-c2ccc(F)c(F)c2)no1 131707734 CYDRUGKMXYXOEO-LBPRGKRZSA-N 386.427 5.021 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cc2n1 171547853 SEFLEQRLFYTCAI-UHFFFAOYSA-N 397.434 5.034 30 20 GKED C[C@@H](c1ccccn1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174497394 CMHIMSVIBWLNMC-HNNXBMFYSA-N 390.418 5.110 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Cc2cccc(C(F)(F)F)c2)n1 177746642 WPFLOZGKXKOUHJ-IUODEOHRSA-N 380.435 5.340 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 184021581 TWXDRKBYFPVFKC-ZDUSSCGKSA-N 378.432 5.060 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](c1c(C)nn(-c2ccccc2)c1C)C(F)(F)F 186316593 CHPDKHWBWIAKLH-NRFANRHFSA-N 398.432 5.062 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3csc4ccccc34)c2)cc1 195640062 OWTRHWDXSHZPOY-UHFFFAOYSA-N 398.487 5.799 30 20 GKED Cc1oc(-c2cccs2)nc1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 264511949 IXZXVHZZWLSNFN-ZDUSSCGKSA-N 397.525 5.145 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N(Cc3cccs3)C3CC3)cc2)cc1 303019035 LERZTHOPSFBYQQ-UHFFFAOYSA-N 389.480 5.609 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1 303030723 NYOHYFXCFZWDLA-UHFFFAOYSA-N 389.886 5.395 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1OC 303116674 DKCRGIBDJHIUAN-ONNFQVAWSA-N 383.444 5.171 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 321380090 PKMMICREYXXEFQ-UHFFFAOYSA-N 389.318 5.212 30 20 GKED O/C(=N/CC1CCC(C/N=C(/O)[C@@H]2C[C@H]3C=C[C@H]2C3)CC1)[C@@H]1C[C@H]2C=C[C@H]1C2 330140527 POJWQQPHKQGPIH-ARGCFSIZSA-N 382.548 5.130 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1Br 425308422 FNAFYZSLUGYRRD-SECBINFHSA-N 383.336 5.063 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 425645908 ARGSGKIDWDXWKO-CQSZACIVSA-N 376.460 5.222 30 20 GKED N#CC1CCC(CNCc2nc(-c3cc(Cl)ccc3Cl)cs2)CC1 441360948 SSBYQCKGXQCYKL-UHFFFAOYSA-N 380.344 5.536 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)CC1 441895882 YEIMCACHZFPCSP-QPFKGPCDSA-N 387.483 5.151 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 448734613 HCPUYVYTNGBBEQ-SFHVURJKSA-N 392.396 5.205 30 20 GKED CC1(C#N)CCC(N[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)CC1 449316508 ZJRXSORSNHKMJU-IOJLRTSASA-N 380.454 5.235 30 20 GKED C[C@H](CC(F)(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 457449382 ILWHDZJNULATRT-MLGOLLRUSA-N 380.797 5.522 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 474407027 DCKIGHWGVHCJKJ-LJQANCHMSA-N 386.451 5.514 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCc2cc(F)c(F)cc21 479752908 UGCMSESQAXTBBT-UHFFFAOYSA-N 395.249 5.205 30 20 GKED CCOCCC1(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCC1 482917215 BRSHBVDCAVHPAS-UHFFFAOYSA-N 393.487 5.069 30 20 GKED Cc1cc(C)c(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1Br 486328785 VSFAEOIMYXCNKM-KRWDZBQOSA-N 386.293 5.233 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)s1 487327583 UCLMVOHAHIKWCF-UHFFFAOYSA-N 389.411 5.352 30 20 GKED CCS[C@H](C)c1noc(CSc2nc(-c3ccccc3)ccc2C#N)n1 488829515 FTQSKJNXJKVJKU-CYBMUJFWSA-N 382.514 5.110 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC[C@H](c2ccccc2F)C1 504123859 WUAONBMCWNNDAC-PMACEKPBSA-N 398.526 5.027 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccc(C#N)cc1 505364465 QJSWYDZSJLZSEG-XOBRGWDASA-N 395.915 5.423 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cscc2Br)cc1 506758058 JKPFIPMXALCFAA-UHFFFAOYSA-N 399.269 5.427 30 20 GKED COc1ccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)cc1 510652926 QJAILGDWFRTYFR-UHFFFAOYSA-N 389.411 5.012 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)C1CC1 513770615 BRRGJNQVEHUOPX-CQSZACIVSA-N 376.485 5.119 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)nc1 517456374 JISYYVHRCFWSIR-MRXNPFEDSA-N 389.480 5.378 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2cccc(C#Cc3ccccn3)c2)c1C1CC1 534964317 JWCSEYCLDIXHKN-QGZVFWFLSA-N 399.498 5.170 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 539660171 JTGPMEULFSCIAY-WOJBJXKFSA-N 394.540 5.033 30 20 GKED N#CC1(CCCSc2nc(-c3ccco3)nc3ccccc23)CCOCC1 539669189 ACYWWZLZTWOGNO-UHFFFAOYSA-N 379.485 5.082 30 20 GKED COc1cc([C@H](C)NCc2ccc(CC#N)cc2)ccc1OCc1ccccc1 542254470 UJSXYZMCTHXDOH-IBGZPJMESA-N 386.495 5.191 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cccc(Cl)c1Cl 544293563 ZAFYVEFMKAPGSM-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3o2)c1 548158566 YGWRKNCNMSWADW-HXUWFJFHSA-N 391.471 5.542 30 20 GKED N#Cc1cc(Oc2cnc3ccc(Cl)cc3c2)nc2ccc([N+](=O)[O-])cc12 561321733 VZDFYMAOJNBTOM-UHFFFAOYSA-N 376.759 5.009 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3ocnc3-c3ccccc3)c2C#N)CC[C@H]1C 571170353 PBLRAIWHDAQKLB-OLZOCXBDSA-N 377.469 5.213 30 20 GKED COc1ccc([C@H](CCC#N)NC[C@H](c2ccccc2Cl)N2CCCC2)cc1 575207154 NPDLNBADVUMNLT-XZOQPEGZSA-N 397.950 5.120 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(C2(c3cccc(C(F)(F)F)c3)CCC2)no1 579289108 ASCQNBPTHBTCKZ-HZPDHXFCSA-N 378.394 5.007 30 20 GKED N#C[C@H](C(=O)c1cnn(C2CCCC2)c1-c1ccccc1)c1nc2ccccc2o1 580062262 YARVHRALRBUFJA-GOSISDBHSA-N 396.450 5.296 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H]1CCc2ccc(C#N)cc21 589339166 URCAUIYREYDVOI-ZUOKHONESA-N 393.943 5.982 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccccc1 590116386 CUJHHMQKMLSJJV-LAUBAEHRSA-N 391.540 5.840 30 20 GKED C[C@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(O[C@@H](C)c2ccccc2)cc1 595750945 DKHGVVQEWOMAHR-OALUTQOASA-N 391.515 5.223 30 20 GKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 596735562 ZZZAGSBGPDOWFB-UZLBHIALSA-N 393.556 5.924 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)C1 597914441 SBCPZEULTJCYIZ-AWEZNQCLSA-N 390.380 5.277 30 20 GKED COc1ccc(CNc2cc(C(F)(F)F)c(F)cc2C)cc1OCCCC#N 600851514 ICDIOJLKKAEIFU-UHFFFAOYSA-N 396.384 5.456 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3csc(-c4ccccc4)n3)cn2)c1 603622949 ACHFHMXTNBDGMV-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 609501855 GHTGPMUKUSSRDS-SJORKVTESA-N 388.389 5.106 30 20 GKED Cc1noc([C@H](C)Sc2nc(-c3ccc(C)o3)cc(C(F)(F)F)c2C#N)n1 609604422 QHRDLSDEOOILJV-VIFPVBQESA-N 394.378 5.085 30 20 GKED CCN(C(=O)c1cccc(Oc2nccs2)c1)c1ccc(C#N)c(Cl)c1 611359398 IOPGETYHHNOYQK-UHFFFAOYSA-N 383.860 5.127 30 20 GKED N#CC1(c2ccc(C(=O)Nc3nc4cc(C(F)(F)F)ccc4s3)cc2)CC1 611466273 TVYUGOIMEBRFEJ-UHFFFAOYSA-N 387.386 5.123 30 20 GKED C[C@H](NC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1cccc(C#N)c1 614843800 GBAVBIKBWZXPKF-LBPRGKRZSA-N 392.808 5.139 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1coc2ccc(F)cc12 648239708 WQLFQZTYSPRBII-JZYVYDRUSA-N 397.290 5.211 30 20 GKED CC[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1OC(F)F 726458245 WWDIEFVKAZPTOU-OAHLLOKOSA-N 395.862 5.251 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C/c1cnc(-c3ccccc3)s1)CC2 727266652 BXNWAKDQKBEHKK-RVDMUPIBSA-N 393.464 5.101 30 20 GKED COc1ccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2ccc(C)cc2)cc1 728712115 UQZZRVMPZITNCZ-UQBPGWFLSA-N 386.495 5.174 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)/C=C\c3ccccc3C#N)s2)cc1 730761098 GUPLJSJGWRMURE-BFFYNSAMSA-N 387.508 5.189 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2cccc(OC(F)(F)F)c2)c1 730949439 WHTJHCCUCRMMCC-KTKRTIGZSA-N 375.346 5.164 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccccc2SC[C@@H](C)C#N)cc1 730955000 RGZWHPMCJRPOPY-HNNXBMFYSA-N 385.558 5.534 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732596009 GTXMVTHJAUMHHY-KSSFIOAISA-N 380.900 5.519 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 732596141 LGQHKGSDYDIYNL-GHTZIAJQSA-N 398.462 5.005 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)cc1 734059583 BBIFFROZIIJBSX-NOZRDPDXSA-N 385.511 5.696 30 20 GKED C=CC[C@@H](NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccncc1 734234037 FGCCEUHNXMGNKG-YBNHLDJLSA-N 378.472 5.396 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccncc1 734681109 YFXPZRKDJWWQJY-LJQANCHMSA-N 389.421 5.092 30 20 GKED CC(=NNc1c(C)cc(C)cc1C)c1ccc(S(=O)(=O)C2CCCC2)cc1 743445387 RYNXSYVDVRQXSU-UHFFFAOYSA-N 384.545 5.164 30 20 GKED COc1ccc(CCC(C)=NOCc2coc(-c3cccc(Cl)c3)n2)cc1 744179524 XYKOWFOQKFZKHB-UHFFFAOYSA-N 384.863 5.529 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cc(F)ccc1F 746437504 NCDQZKPSAXZGKT-CYBMUJFWSA-N 384.222 5.444 30 20 GKED COc1ccc(CNC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1C#N 746867946 JTQILUSGZHSYIL-UHFFFAOYSA-N 391.279 5.018 30 20 GKED FC(F)(F)c1cccnc1NN=C1CCCc2nc(-c3ccccc3)sc21 747048353 ZTDSZPBWPMNESM-UHFFFAOYSA-N 388.418 5.376 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SC)c(OC)c2)ccc1OC(F)F 747614293 ASIMOZCQQNJQGT-YVMONPNESA-N 394.439 5.313 30 20 GKED CN(C(=S)Nc1ccc(C#N)c(Cl)c1)C1c2ccccc2-c2ccccc21 748084061 XZPYBZKBEDVTHB-UHFFFAOYSA-N 389.911 5.610 30 20 GKED C[C@@H](OC(=O)c1c(F)cc(C#N)cc1F)c1ccc(Cl)c(C(F)(F)F)c1 759587538 LOHNCUVRVGMKNL-MRVPVSSYSA-N 389.707 5.427 30 20 GKED C[C@@H](Sc1ncc(C(C)(C)C)s1)C(=O)N(CCC#N)c1ccc(F)cc1 759719303 KMIRTXXDGVOXGW-CYBMUJFWSA-N 391.537 5.007 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C1(c2ccc(Cl)cc2)CCCCC1 760789766 KXSOXEUPWMZWFM-UHFFFAOYSA-N 386.854 5.222 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2cc(C(C)C)nc(C(C)C)n2)ccc1OC 761226073 ZVSZYDTUMWESRM-QGZVFWFLSA-N 382.508 5.025 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc([N+](=O)[O-])c(Cl)c2)cc1 761531658 HSOYWZVUHJUUKT-UHFFFAOYSA-N 377.831 5.077 30 20 GKED N#Cc1cc(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)c(Cl)c([N+](=O)[O-])c1 764302227 GJIIKGQQBWKTBW-DLBZAZTESA-N 391.814 5.015 30 20 GKED COC(=O)c1coc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c1 774120255 LBWZPLSUIPKMGJ-SFQUDFHCSA-N 389.432 5.099 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780678691 QMLCOWAGYDBQML-LMNJBCLMSA-N 377.488 5.086 30 20 GKED N#Cc1ccc(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)cc1F 791244008 FTVKFTMMZIEOFM-UHFFFAOYSA-N 394.016 5.063 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 796747732 QDDBOFBIHSIFJC-ZFWWWQNUSA-N 377.362 5.119 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 800577353 MVOAPKXJZFCQTN-LAUMOQQDSA-N 378.431 5.223 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801673646 VMYAVWDTHHBOET-PXAZEXFGSA-N 396.409 5.749 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)s1)c1nc(-c2ccc(Cl)cc2)cs1 802043465 BZBIMARUSNUXIC-ZDUSSCGKSA-N 393.320 5.597 30 20 GKED C[C@H](OC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1 803061615 OZFGRYBRDPYBBH-XPTSAGLGSA-N 395.274 5.434 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)OC(=O)CCCCCC#N 805884960 XVXBLBUPJZMVTL-AWEZNQCLSA-N 376.909 5.850 30 20 GKED CC(C)Oc1cccc([C@@H](OC(=O)C[C@H](CC#N)c2ccccc2)C(F)F)c1 810804479 COOWRUJVWJOQBI-LAUBAEHRSA-N 387.426 5.411 30 20 GKED N#CCSc1ccccc1C(=O)N[C@@H]1CCC[C@@H](c2ccc(Cl)cc2)C1 837099542 GPUJHSFPAXJRPQ-SJLPKXTDSA-N 384.932 5.412 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842940948 GENRCWVQUMRZCC-IAQYHMDHSA-N 378.419 5.094 30 20 GKED C[C@H](CC(C)(C)C#N)OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 851209351 FBCJUMDKOQMBQD-LLVKDONJSA-N 382.407 5.314 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 854460130 DDCWMXYAUULYRO-IPMKNSEASA-N 391.556 5.361 30 20 GKED N#Cc1cccc(COc2ccc(NCc3noc(C4CCC4)n3)cc2Cl)c1 863345721 IWFICYDVSZGILK-UHFFFAOYSA-N 394.862 5.053 30 20 GKED N#Cc1cccc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c1 917749469 KXIHALBYLYISFC-CQSZACIVSA-N 377.296 5.096 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccccn2)cc1 919905051 YGDINAKISADPSZ-JTHBVZDNSA-N 382.467 5.106 30 20 GKED N#CCCCCOC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 921216332 POMVLVUXHKOEBV-UHFFFAOYSA-N 383.444 5.715 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2c(O)c(C(=O)O)cc3ccccc23)cc1 1776105889 IHVLOUARACHZCV-HNNXBMFYSA-N 376.456 5.052 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cnc(-c2ccc(C)c(C)c2)s1 1776785698 SUFOICVSDKXBTG-IBGZPJMESA-N 388.577 5.720 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776817316 UXRFMYQWCDQHRM-DHZHZOJOSA-N 392.407 5.035 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1777033347 ABDZLDICYLMOOT-PKNBQFBNSA-N 391.492 5.071 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)ccc1Cl 1777263488 QPJBMGZFTRXWDK-JYRVWZFOSA-N 392.838 5.610 30 20 GKED COc1cc(/C=C\C(=O)c2sc3c(Cl)cccc3c2C)ccc1C(=O)O 1777290546 ZCEKKPMSWNVODQ-CLFYSBASSA-N 386.856 5.466 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)s1 1777462982 YZUQNIGMTOQRJV-DCIPZJNNSA-N 375.449 5.112 30 20 GKED CCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1OCC 41535244 SJBUHJXXNBGPSR-KRWDZBQOSA-N 392.480 5.098 30 20 GKED N#CCc1ccc(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)cc1 57820978 VLHDDCLNBDAXKL-UHFFFAOYSA-N 395.698 6.180 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc1 61967305 GCPXQEQDNBXCLL-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66953957 GDLCJBDTDHPTQG-HOTGVXAUSA-N 383.517 5.314 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955856 TTZKHGPBXVUKPX-ZDUSSCGKSA-N 393.965 5.850 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl 105056163 WKYSOFWZMLXKIH-UHFFFAOYSA-N 399.922 5.041 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)c1 107633725 GSJAFKRMPCVQKK-SFHVURJKSA-N 384.479 5.503 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C#N)nc2)cc1Cl)c1ccccc1 115361225 GLUKQEUTSGUFMY-CQSZACIVSA-N 376.847 5.032 30 20 GKED N#CCCn1ccc(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)n1 117716954 AWYPYBSZDYQKOP-UHFFFAOYSA-N 399.690 5.224 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)s1 126762835 BUBMSVIMWJXLJQ-UHFFFAOYSA-N 384.464 5.045 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 170986134 WCBLYLQITSIGNP-CABCVRRESA-N 388.533 5.510 30 20 GKED CC(C)[C@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 171402683 PBHLCODUDFSOEQ-IRXDYDNUSA-N 381.426 5.438 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 176599263 QZNLCSGZYVPBCR-LJQANCHMSA-N 398.510 5.303 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)n1 177777288 XRAZBVQCDSHJEP-OAHLLOKOSA-N 399.903 5.384 30 20 GKED N#C[C@@H](COC(=O)c1ccc(C2SCCCS2)cc1)Cc1cccs1 180107811 LKLJKRLMAKZIAZ-AWEZNQCLSA-N 389.567 5.156 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1OC1CCCC1 181572539 SECBHEHNQBNNHB-INIZCTEOSA-N 384.501 5.087 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2cccc(C)c2)n1 189892529 YBOHPEJROGWELC-UHFFFAOYSA-N 390.552 6.152 30 20 GKED Cc1cc(Br)c2ccccc2c1N=C(O)C[C@@H]1CCCC(O)=N1 329659213 NZKXWGMTGYLMGY-LBPRGKRZSA-N 375.266 5.398 30 20 GKED N#CCCCCNC(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 429660692 VCRYFWXKPGYQEN-UHFFFAOYSA-N 377.366 5.313 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(Cl)cc(C(F)(F)F)c2)s1 430600534 SFKPVJUHWKMZMA-GFCCVEGCSA-N 386.826 5.603 30 20 GKED COC(=O)c1cc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)oc1C 431120543 NNCXPEIBNDSGKH-JKSUJKDBSA-N 388.467 5.325 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)NCC2(CC#N)CC2)c(C(F)(F)F)c1 432015895 VACBVYRDLCHSGI-LBPRGKRZSA-N 385.455 5.411 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 432867809 UCILSXGQXLSHAA-UHFFFAOYSA-N 392.434 5.180 30 20 GKED C[C@H](NC(=O)CN[C@@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 433017283 YCTYGQNJPRYLMZ-CYFREDJKSA-N 385.511 5.042 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@@H](C)CCC[C@H]2C)cc1 438219452 YIGPYYPDTWZPHR-DLBZAZTESA-N 393.487 5.402 30 20 GKED N#Cc1ccc(CNc2ccccc2NC(=O)c2cccs2)c(OC(F)F)c1 439553934 UZBCYHDVLORRNG-UHFFFAOYSA-N 399.422 5.086 30 20 GKED CC[C@@H](N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 447540443 JDBXCCBXCQVMTJ-VWNXMTODSA-N 398.485 5.529 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)Nc2nc(C(F)(F)F)ccc2C#N)cc1 462886095 FVOSHEQENMDFAW-CQSZACIVSA-N 397.400 5.821 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(C)cc(F)c2)cc1 463608635 CRAZDLHNIIXLMO-UHFFFAOYSA-N 376.387 5.059 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nnc(-c2ccccc2)s1 463789706 NMKXEKJAKSCEJA-UHFFFAOYSA-N 386.505 5.431 30 20 GKED C[C@H](NC(=O)NCc1cc(C#N)ccc1F)c1ccc(Oc2ccccc2)cc1 465821539 UDGNMPKWVAAVKA-INIZCTEOSA-N 389.430 5.050 30 20 GKED C[C@](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)(C1CC1)C(F)(F)F 471133402 LECKFTXJDSVUAG-LBPRGKRZSA-N 393.249 5.185 30 20 GKED N#Cc1ccc(CNc2cc(C(=O)Nc3ccccc3)ccc2Cl)cc1F 479482663 KDUZACQUGFVRQT-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1Cl 483443031 VRODJBPAYVBYQC-UHFFFAOYSA-N 390.870 5.546 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccc2ncsc2c1 485689935 AAHJWSSHZMWLRH-QGZVFWFLSA-N 399.519 5.598 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)N(CCC#N)Cc3ccco3)cs2)cc1 502570614 QCJAMHCIUVJSDN-UHFFFAOYSA-N 379.485 5.083 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(OC[C@H]2CCCO2)CC1 506045405 DOGQIJKBXDYSJO-XVAXZDLZSA-N 385.548 5.231 30 20 GKED CN(Cc1ccc(C#N)cc1)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 506120380 CLUZVMJTWAZHEM-UHFFFAOYSA-N 387.430 5.333 30 20 GKED CCn1c(C)cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1C 520429542 REEOUPWWPCSAFO-CQSZACIVSA-N 385.439 5.017 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520601930 IRINNADDCPTRHX-OAHLLOKOSA-N 377.469 5.165 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC(F)(F)F)cc1 520827736 ZDFUGBMLBUUEBL-LBPRGKRZSA-N 380.391 5.089 30 20 GKED Cc1ccccc1-c1nnc(S[C@H](C#N)C2CCCCC2)n1Cc1ccco1 522332029 SHMSZHSDJAODFW-HXUWFJFHSA-N 392.528 5.459 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(-c3c(F)cccc3F)c2)n1 534584441 JRRZQMMVYJZKDE-OAHLLOKOSA-N 382.435 5.702 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1)OCC 535969885 YKJJYMVTDOKSAB-GOSISDBHSA-N 384.476 5.412 30 20 GKED C=C[C@H](CC(=O)NCc1ccc(Cn2cnc3ccccc32)cc1)c1ccccc1 536129139 PPTQFQIEUQUWDQ-JOCHJYFZSA-N 395.506 5.061 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1OCc1ccccc1 536936626 AVCJEZJWFRIJQH-LJQANCHMSA-N 399.494 5.040 30 20 GKED N#Cc1ccsc1NC(=O)CCN[C@@H](c1cccc(Cl)c1)C1CCCC1 540423096 IUCGEVLCEDIRRF-LJQANCHMSA-N 387.936 5.123 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@H](C(C)(C)C)C1 543306253 IQZGDFCTHLEWOF-FQEVSTJZSA-N 391.515 5.346 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1 551012417 QSYARMAQOSEIIM-DEOSSOPVSA-N 390.433 5.077 30 20 GKED C=CCOc1ccc(CN(C(=O)c2csc(C(F)(F)F)n2)C(C)(C)C)cc1 551652446 JJHJWQDXDBGQDS-UHFFFAOYSA-N 398.450 5.168 30 20 GKED N#Cc1ccsc1C(=O)N1c2ccc(Br)cc2[C@@H]2CCCC[C@@H]21 553115291 KOXRPHCCJAWYOQ-ZFWWWQNUSA-N 387.302 5.069 30 20 GKED C[C@H](NCc1ccncc1OCc1ccccc1)c1ccc(C#N)cc1Cl 560570705 FSNHZQSYUXRSRV-INIZCTEOSA-N 377.875 5.036 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567203588 WEJNWXXYSAOFLV-PKOBYXMFSA-N 398.466 5.155 30 20 GKED N#Cc1cc(F)cc(C2(c3nc(-c4ccc(Oc5cccnc5)cc4)no3)CC2)c1 569737957 VBMOLVQKVUHERP-UHFFFAOYSA-N 398.397 5.015 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H]1c1ccccc1 577563482 RZPFTCDQODFUIQ-YLJYHZDGSA-N 392.478 5.085 30 20 GKED N#C[C@H](NC(=O)C1CC(c2ccc(F)cc2)C1)c1c(Cl)cccc1Cl 590227229 RWPHZGNHHWZSNW-FVKWTLKZSA-N 377.246 5.007 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1N(C)C1CCCC1 591865484 PTQWGMJNXROPEG-KRWDZBQOSA-N 376.504 5.162 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCCc1cccs1 603532447 HZBVWWNRKLLQGQ-UHFFFAOYSA-N 392.499 5.623 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccsc3)cn2)c1 603691330 CDFIPUCFKMUJBD-LJQANCHMSA-N 390.468 5.176 30 20 GKED COc1ccc(Cl)cc1CNCc1cccc(OCc2cccc(C#N)c2)c1 604473786 GHWFTZMUSPUGST-UHFFFAOYSA-N 392.886 5.089 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 604547424 ZBLXUQVFBVOLPD-BXUZGUMPSA-N 385.533 5.118 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3ccsc3[nH]2)cc1 608777891 IKRLJAAJZNQUKO-UHFFFAOYSA-N 389.436 5.154 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3c3ccccc3)c2)cc1 609208950 LNLPMCHPKPSKDM-QHCPKHFHSA-N 383.451 5.720 30 20 GKED CCCN(C(=O)c1nc(-c2ccccc2)oc1C)c1cc(Cl)ccc1C#N 609286321 UDMYMHBEKWQEGB-UHFFFAOYSA-N 379.847 5.232 30 20 GKED N#C[C@H](NC(=O)c1sc2cc(F)ccc2c1Cl)c1ccc(Cl)cc1 609589596 OXMOSLBZPXVYMV-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED CCc1nc2cc(NC(=O)c3cccc(COc4cccc(C#N)c4)c3)ccc2o1 609660206 VLDQVIWTDLKAOP-UHFFFAOYSA-N 397.434 5.093 30 20 GKED N#Cc1c(NC(=O)c2cc3cc(F)ccc3o2)sc2c1-c1ccccc1CC2 609784076 JPWAAMYVPVPHCZ-UHFFFAOYSA-N 388.423 5.523 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 610355281 NBZAHYVRFMNIBD-VBKZILBWSA-N 395.915 5.423 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](C)c1cccc(C#N)c1 610355439 QOGIJFUNICIIOE-ZDUSSCGKSA-N 376.287 5.158 30 20 GKED Cc1ccccc1CC1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 610632482 BBOXOPFOGRFQOV-QGZVFWFLSA-N 379.529 5.096 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(SC(C)C)cc3)n2)cc1 613319402 ZHWHSAWXFGHDBP-IBGZPJMESA-N 392.549 6.109 30 20 GKED FC(F)(F)Oc1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 618449959 IEOJBPZYOHAGHA-PHIMTYICSA-N 395.265 5.148 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cc(F)c(C(F)(F)F)c(F)c1 683200141 OKOZPMGHRCXQGR-UHFFFAOYSA-N 387.201 5.394 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1cc(F)c(C(F)(F)F)c(F)c1 683208361 JGOJWDYLBCGBNY-UHFFFAOYSA-N 397.265 5.731 30 20 GKED C=CCOc1ccc(/C=C2/SC(=S)N([C@@H](C)c3cccs3)C2=O)cc1 726629167 JGZCAAYEILYMEG-VLURKWGBSA-N 387.551 5.275 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC3(CCCCC3)CC2)cc1 726695367 DJDSJZHSLCRKDQ-HSZRJFAPSA-N 387.527 5.920 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 726858452 LFVXTXOEVANCIX-GUYCJALGSA-N 398.890 5.973 30 20 GKED CCSc1ccc([C@H](C)NC(=O)NCc2cccc(O[C@H](C#N)CC)c2)cc1 733801766 WZRJLSCYTUJSNQ-LPHOPBHVSA-N 397.544 5.040 30 20 GKED CCc1ccc([C@@H](NC(=O)NCc2cccc(O[C@H](C#N)CC)c2)C(C)C)cc1 733806548 JXSUEXCTMNQERI-GMAHTHKFSA-N 393.531 5.126 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 738897494 VFJZNWZSEGBGQJ-OPAMFIHVSA-N 389.524 5.465 30 20 GKED Cc1ccc([C@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)o1 742650142 WGBWQFVOGNVOQL-LBPRGKRZSA-N 382.407 5.355 30 20 GKED CCCN(CCC)c1ccc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)cc1 748584246 NBVLLXHOMPNADY-AUWJEWJLSA-N 392.499 5.166 30 20 GKED C[C@@]1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCc2ccccc21 751084495 OQPMWAZOUGEOOS-ZEQKJWHPSA-N 380.491 5.575 30 20 GKED N#Cc1cnc(NC(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)s1 759632154 DXHXYQSRYNKNHB-SFHVURJKSA-N 399.928 5.129 30 20 GKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1cc(Br)ncc1F 762425867 WKLGBUAJDBMLJM-VOTSOKGWSA-N 389.249 5.003 30 20 GKED COc1cc(/C=C/C(=O)c2cc(Br)ccc2F)ccc1SC 763122663 TXWGYFSRJNUBCD-XVNBXDOJSA-N 381.266 5.215 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C[C@H](O)c3ccc(C#N)cc3)s2)cc1 763412464 XXLYCOVZEQXNDB-UTKZUKDTSA-N 391.540 5.025 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c(Cl)c1 766235949 AZVYDQZACNWOIB-CQSZACIVSA-N 384.888 5.294 30 20 GKED CCCCN(C)c1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 770564069 SFHUBAKNEMETEC-UHFFFAOYSA-N 387.531 5.312 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)C(=O)Nc2cccc(C)c2)c1 772644373 HIAQSSUXSKBQDW-QFIPXVFZSA-N 398.462 5.022 30 20 GKED C[C@@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1cnc2ccccc2c1 774067138 YTTXXLCAPLIAMV-QGZVFWFLSA-N 383.451 5.411 30 20 GKED C[C@@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)c1ccc(OCC#N)cc1 776157404 AXXSQOUMCLNVQB-MZNJEOGPSA-N 392.449 5.502 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cccc(C)c2OC(F)F)S1 777871063 XHOQGMPFAKTNFW-GDNBJRDFSA-N 388.439 5.105 30 20 GKED N#CCOc1cccc(NC(=O)c2csc(-c3cccc4ccccc34)n2)c1 777947380 PDLRVWMXSZVDTQ-UHFFFAOYSA-N 385.448 5.118 30 20 GKED N#C[C@@H](C(=O)[C@H](F)Cc1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 778295884 XIJNYPXAPPAITL-UONOGXRCSA-N 392.377 5.072 30 20 GKED N#Cc1ccc(CNCc2c(Cl)cccc2OCc2ccccc2Cl)nc1 780556127 TVUFATNDFPXXCU-UHFFFAOYSA-N 398.293 5.129 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@H](C)c1c(Cl)cccc1Cl 780666601 AFPZHYUSCMXAAH-QWHCGFSZSA-N 392.286 5.209 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 783070799 XCFTVWURDXIICW-FZMZJTMJSA-N 396.434 5.277 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc(-c2ccc(C(=O)O)o2)cc1 788349058 IKBZEBOTMUFFGZ-VMPITWQZSA-N 393.342 5.016 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 789423918 WGFQQJVVKNJNOO-KDOFPFPSSA-N 396.487 5.594 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccc(Cl)nc1C(F)(F)F 790004652 DVTUVUHMVODFON-UHFFFAOYSA-N 386.654 5.164 30 20 GKED COC1(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCC1 791773068 GXQKOJFYQQFINT-CYBMUJFWSA-N 395.311 5.252 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](O)c1cccc(C(F)(F)F)c1 803179638 LRXANSFIGSGLAG-LJQANCHMSA-N 377.406 5.229 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(C(F)(F)F)cc2O)c1 810226441 YAMIGSGDLBICIX-QFBILLFUSA-N 392.421 5.333 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccc(-c3nc4ccccc4s3)o2)SC1=S 814292185 PPCZQXRDDHLYNC-CXUHLZMHSA-N 398.534 5.334 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(F)(F)F)O[C@H](C)C1 879352573 WNENJFQTZIKKLS-PBHICJAKSA-N 384.442 5.112 30 20 GKED CC(C)c1cnc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)o1 901869029 ODPZOTPOAVUHSG-CQSZACIVSA-N 389.546 5.064 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 915352557 MFAANNNOMUIJIB-DNQXCXABSA-N 399.494 5.623 30 20 GKED Sc1nnc(SCc2ccccc2)n1N=Cc1cccc(Cl)c1Cl 916368821 PFXGFUBVAYGGHQ-UHFFFAOYSA-N 395.340 5.048 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917043997 NQZSCWQRAYEYTL-MRXNPFEDSA-N 398.915 5.637 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2csc(-c3ccc(Cl)cc3)n2)CC1 1776169941 SUNAUEWJNUTQBK-UHFFFAOYSA-N 390.936 5.097 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269251 SMWFWDOYMSORPI-CLFYSBASSA-N 394.486 5.941 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1sc2c(C)cc(C)cc2c1C 1777269510 MBHHUGMEXHNWIY-BQYQJAHWSA-N 380.465 5.429 30 20 GKED C[C@@H]1/C(=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1777407759 BOGPYIZYUXDSCL-RTMFLMTJSA-N 384.431 5.275 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791254571 TYBUITANKAUNHN-YSTOQKLRSA-N 394.559 5.159 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)N[C@H](C)c2ccc(C#N)cc2)cc1C 26127813 BMGFFWBSTBHGJE-QGZVFWFLSA-N 387.508 5.212 30 20 GKED CCc1cccc(N/C(S)=C(\C(=O)c2ccccc2C)[n+]2cccc(C)c2)c1 55012385 NPQNVSWJFKMVDW-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1sc(NC(=O)c2ccc(N3CCc4ccccc4C3)cc2)c(C#N)c1C 63891236 SUGPRFSQRLAEMV-UHFFFAOYSA-N 387.508 5.052 30 20 GKED C=C(C)CN(CC)C(=O)c1ccccc1Sc1ccc(Br)cn1 108014394 RWSSPTNTEXBHJO-UHFFFAOYSA-N 391.334 5.034 30 20 GKED CSc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)ccc1F 155681969 GVCBWLNNTVKPKE-HNNXBMFYSA-N 393.468 5.033 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1ccc(O[C@H](C)C#N)cc1 160418711 LIFXETQESNYSKE-MRXNPFEDSA-N 381.476 5.245 30 20 GKED CN(Cc1ccco1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 171221086 SPALUVFOTWYESP-UHFFFAOYSA-N 395.846 5.048 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cs1 171362869 JIUIMZDACTVVTH-QGZVFWFLSA-N 399.475 5.114 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(SC)c(F)c2)ccc1OC 180813680 SIWCALJZPMOFTO-YOEHRIQHSA-N 388.508 5.088 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3csc(-c4ccccn4)n3)oc12 302941330 LDFYONYBQOHNKE-MDZDMXLPSA-N 376.437 5.246 30 20 GKED OC(=Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)[C@H]1CCCCS1 329261691 BGNWYUKOFQWZPR-MRXNPFEDSA-N 390.940 5.199 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@H]1c1ccncc1 432756929 JJWCWNFJJIENCB-QFIPXVFZSA-N 398.466 5.361 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 432981954 FMUDRZNUTLOKSM-QFIPXVFZSA-N 393.531 5.867 30 20 GKED C=CCC[C@@H](NC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccccc1 435295899 DYPZWVGPTHQFDN-HXUWFJFHSA-N 394.902 5.751 30 20 GKED Cc1sc(NC(=O)c2cc(Cl)cc(Br)c2F)c(C#N)c1C 435667300 JETFIOIEVSQTAT-UHFFFAOYSA-N 387.661 5.044 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)C2(c3ccc(C#N)cc3)CC2)cc1 435938634 FDBQFNLWNDUNLM-UHFFFAOYSA-N 384.435 5.029 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1Cc1ccccc1)c1cccc(C#N)c1 443139530 ABMUESWYIAHJOU-SFHVURJKSA-N 386.520 5.582 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Nc2ncccn2)cc1 444621863 NIIBAPWOAUQBPA-UHFFFAOYSA-N 391.434 5.011 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1cccc(N2CCCC2)c1 446482713 VWAKGQSWRMLSRO-LJQANCHMSA-N 395.506 5.316 30 20 GKED C[C@@H](NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1ccc(C#N)cc1 448219871 JODBVNGJPSIOIL-OAHLLOKOSA-N 399.947 5.239 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458798202 HPOVWIMASSJQKC-KJXAQDMKSA-N 375.516 5.318 30 20 GKED CCc1c(C)sc(NC(=O)c2cc(C)cc(C)c2Br)c1C#N 461017659 DYYBKIFOQNZMAZ-UHFFFAOYSA-N 377.307 5.122 30 20 GKED COc1ccc([C@H](N[C@H]2CCC[C@@H](C#N)C2)c2ccccc2)cc1Br 463294472 DKXZEFJQDQRZFM-FYINFDKHSA-N 399.332 5.219 30 20 GKED Cc1nc(-c2cccc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)c2)cs1 463562060 IWYRBIMHSCVAOG-UHFFFAOYSA-N 375.497 5.293 30 20 GKED Cc1cccc([C@@H]2CCCCN2C(=O)CSCc2ccc(C#N)cc2)c1C 464586399 IUJJWXYTQKCTRC-QFIPXVFZSA-N 378.541 5.162 30 20 GKED Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 464735189 NBNMIDDIBPDQAJ-UHFFFAOYSA-N 399.494 5.281 30 20 GKED CCCNc1ccc(C(F)(F)F)cc1NC(=O)c1cccc(SCC#N)c1 469298958 TUIJVCXXSOBMDQ-UHFFFAOYSA-N 393.434 5.395 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3ccc4ncccc4c3)cc2)c1 471271614 DPXBOBYNMHABPG-UHFFFAOYSA-N 394.434 5.220 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)cc1 474417984 VOTDLEAEBCQGPM-UHFFFAOYSA-N 386.480 5.116 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(-n2cncn2)cc1Cl)c1ccc(F)c(F)c1 480696337 VBXMVINAAHMTHJ-ZUOKHONESA-N 388.849 5.167 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cnn1C(CC)CC 482580213 QBVMAPNZBDRTOX-AWEZNQCLSA-N 399.445 5.041 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nccc4ccccc34)cs2)cc1 483192715 HCMYNTLFBOUUQH-IBGZPJMESA-N 399.475 5.247 30 20 GKED Cc1cccc(C)c1NC(=O)CCCN(Cc1ccc(C#N)cc1)CC(C)C 485061648 ZAOGIBVWOGGMNS-UHFFFAOYSA-N 377.532 5.052 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccccc3-c3c(F)cccc3F)o2)c1 488200776 RUQOMMYBZREXIW-UHFFFAOYSA-N 388.377 5.166 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(F)cc3C(F)(F)F)CC2)cc1 503473577 WAVROUGHUHWVLL-UHFFFAOYSA-N 389.352 5.037 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCC(F)(F)C1 503663902 SVEBBUOXTJANRH-GOSISDBHSA-N 386.417 5.365 30 20 GKED C[C@@H]1CCC[C@@H](CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 504057817 JETNMCFMTTYDNT-UYAOXDASSA-N 376.500 5.487 30 20 GKED CCN(C(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccc(C#N)cc1 510407667 NFFVZTVKLYTMFT-UHFFFAOYSA-N 389.505 5.563 30 20 GKED C[C@H]1CN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c2ccccc21 511416931 VOQVQDWENNNGDJ-SFHVURJKSA-N 397.478 5.487 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSC2CCCCC2)CCCC1 514482633 BOBMFQAEGGKGFU-UHFFFAOYSA-N 382.529 5.565 30 20 GKED CC(C)CN(C(=O)c1cccc(OCc2cccs2)c1)c1ccc(C#N)cc1 515065514 QESYOAJZRCCQGY-UHFFFAOYSA-N 390.508 5.502 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1cccc(Cl)c1Cl 518127747 KLSSMTIFLIQYTL-GFCCVEGCSA-N 395.311 5.405 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1Cl 518239677 KIEGVZYIEZCKLJ-HUUCEWRRSA-N 388.920 5.449 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cnc(-c4ccsc4)s3)c2C#N)C1 522127872 AJYKBMCBJFEOPS-JTQLQIEISA-N 385.539 5.182 30 20 GKED N#CCc1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)cc1 522575897 NCTABEVMXWBDRU-UHFFFAOYSA-N 387.826 5.322 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cn2)cc1Cl 522895269 ALAVVSHONCAZHK-QGZVFWFLSA-N 382.250 5.296 30 20 GKED CCC[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 534775134 CSUZXJOLCBBHIJ-AZUAARDMSA-N 397.906 5.028 30 20 GKED N#CCc1ccc(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc1 536168791 GFSDQSYHLSGKOH-UHFFFAOYSA-N 395.915 5.036 30 20 GKED CCN(C(=O)C[C@@H](C)C(=O)c1ccc(Cl)cc1)[C@H](C)c1ccc(C#N)cc1 537479916 YXBVPUTZMZFAHP-HZPDHXFCSA-N 382.891 5.030 30 20 GKED CC(C)c1oc([C@@H]2CCCN2Cc2ccc(CC#N)cc2)nc1-c1ccccc1 541282744 SDOVIFIZIOTQFA-QFIPXVFZSA-N 385.511 5.868 30 20 GKED Cc1ccccc1-c1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)no1 542012779 LDAKIDOHEFRETQ-SFHVURJKSA-N 394.478 5.435 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccc[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543017791 WSNCUDLHEMXFGG-HXOBKFHXSA-N 384.483 5.161 30 20 GKED COc1cc(C)c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543874088 VMXJHYLUVMVDCO-SFHVURJKSA-N 386.495 5.402 30 20 GKED CC[C@H](CC1CCCCC1)C(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1 553206671 WIAUYGDLIQVJPH-LJQANCHMSA-N 386.511 5.064 30 20 GKED N#CC1(CCCN[C@H](c2ccc(F)cc2)c2ccccc2Cl)CCOCC1 558194894 KHEACVHWRXCONV-OAQYLSRUSA-N 386.898 5.259 30 20 GKED CN(C(=O)c1ccccc1Sc1ccccc1C#N)C1CCC(F)(F)CC1 564234277 SLSACURZHBJJAY-UHFFFAOYSA-N 386.467 5.359 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc(Cl)c1Br 582196166 MMJZFQPHAZECSF-NSHDSACASA-N 397.725 5.481 30 20 GKED CC1(CC(F)F)CN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)C1 592834655 HPJQTMBJHBDULQ-UHFFFAOYSA-N 390.817 5.121 30 20 GKED N#CCCCCC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 593973225 HBKWVZKXZJRQFG-UHFFFAOYSA-N 376.378 5.307 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccsc3)cc2Cl)cc1 604089834 NOUFLZJAYLWZTO-UHFFFAOYSA-N 383.860 5.387 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)c(C)c2)c1 609254135 IOBGXXGKTUVKLO-LJQANCHMSA-N 399.494 5.637 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)Nc3ccc(C(C)(C)C#N)cc3)c(C)c2c1 609294374 STGAPAGJMQMGQD-HNNXBMFYSA-N 391.471 5.434 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(F)ccc2s1)c1cccc(Cl)c1Cl 609416397 ORVFYGCTUQQHKX-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 609427786 LBXLHNWEUITOOD-CQSZACIVSA-N 388.920 5.774 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCCCC[C@H]1c1ccc(CC)o1 610094474 KLIUMHRSALTNTP-IBGZPJMESA-N 381.476 5.262 30 20 GKED C[C@@H](NCc1cccc(CN[C@H](C)c2cccc(C#N)c2)c1)c1cccc(C#N)c1 611389054 WTOSHJKZKZELCE-WOJBJXKFSA-N 394.522 5.132 30 20 GKED O=C(CCCc1ccc(F)cc1)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 653565357 HYTGWIRKKJYQEW-CHWSQXEVSA-N 399.350 5.174 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3cc4ccccc4o3)SC2=S)cc1Cl 726626202 AXGXUTNTYONSDA-MFOYZWKCSA-N 396.880 5.364 30 20 GKED C=CCN(CCc1ccccc1)C(=S)Nc1c(Cl)ccc(C)c1Cl 728447366 ZBQQJOCGSUFEJD-UHFFFAOYSA-N 379.356 5.729 30 20 GKED CCC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccn1 729553393 OYFSBYGZMTXOND-GGAORHGYSA-N 384.483 5.400 30 20 GKED Cc1ccc2c(c1)[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 730130855 GYHVCRBQQMCETP-ZEQRLZLVSA-N 381.479 5.460 30 20 GKED C#CCOc1cccc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1 731112280 DVRCDAHJWMEOFE-LJQANCHMSA-N 388.389 5.086 30 20 GKED N#C[C@H](C(=O)CC1CCC(c2ccccc2)CC1)C(=O)Nc1ccccc1Cl 731135603 FQBUXBAROHMRAU-NKELODKYSA-N 394.902 5.351 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 733631887 MLYVQLKKESUPFD-UHFFFAOYSA-N 383.517 5.904 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC[C@@H]1c1nc2ccccc2s1 735306963 VEHWHEPLRMEQQE-QGZVFWFLSA-N 383.904 5.189 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)C34CC5CC(CC(C5)C3)C4)c2)s1 739594557 LJWSMTVRYWIUBE-UHFFFAOYSA-N 376.525 5.119 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 742773810 VWMNQHYKFGGREN-WZUFQYTHSA-N 375.815 5.051 30 20 GKED CC(C)[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 744073922 IRICFSOXSVACDL-BEFAXECRSA-N 396.462 5.704 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(C3SCCS3)cc2)cc1C(F)(F)F 744371533 VGVOIYCLOOIXOM-UHFFFAOYSA-N 394.443 5.308 30 20 GKED CC/C(=C\C(=O)NCc1cccc(O[C@H](C#N)CC)c1)c1cccc(Cl)c1 744512388 DJKWWYIQWUXWSR-NXNYUAIASA-N 382.891 5.131 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)c(OC)c1OC 747188647 UTWSWDADRLBPED-LUAWRHEFSA-N 380.465 5.337 30 20 GKED CC(C)N(C(=S)Nc1ccc(Oc2ccccc2)cc1)c1cccc(C#N)c1 749767656 KLCVLLLXIHGLCS-UHFFFAOYSA-N 387.508 5.962 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)Nc2cccc(OCC#N)c2)c1C 750589003 CQKXBWHIGBPNHL-UHFFFAOYSA-N 381.476 5.247 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1cccc2c1CN(c1ccccn1)C2 756845768 GUOCEGRZQQSUQL-UHFFFAOYSA-N 384.266 5.365 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2cc(C)ccc2C)c1 762041059 CUCDKMZQPLWRQS-NZQKXSOJSA-N 391.515 5.031 30 20 GKED COc1cccc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c1F 770070799 WYWQUTZCBJIOIY-UHFFFAOYSA-N 396.805 5.404 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1cccc(Cl)c1 770651364 GFGUSYQUNVCMNW-KXBFYZLASA-N 383.879 5.390 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](Cc2ccccc2)c2sccc2C)c1 772982675 FCDIYUYAFIACPR-GMAHTHKFSA-N 390.552 5.811 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H]2CCc3ccc(-c4ccccc4)cc32)c1 779404901 WFIWCAVJRBHYDS-HSZRJFAPSA-N 383.451 5.065 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccccc1F)C1CCCC1 780674537 OZLZDHOTTVCLTC-BTYIYWSLSA-N 381.451 5.170 30 20 GKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780679016 STHMJJKLKLRDSI-DYESRHJHSA-N 377.488 5.470 30 20 GKED O=C(/C=C\c1cc(Cl)cs1)c1ccc(S(=O)(=O)C2CCCC2)cc1 782341837 LTPXKMTZUVRYTN-YFHOEESVSA-N 380.918 5.014 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2NC2CCCCC2)cc1OC 790163135 YVKLTPHMMAWVMA-UHFFFAOYSA-N 380.488 5.257 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 790342841 VAIHFENWRIZOAX-UHFFFAOYSA-N 386.691 5.336 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)cc1 801875757 UYLQNLQOOORIKX-GOSISDBHSA-N 394.368 5.062 30 20 GKED O=C1/C(=C/c2ccc(OCc3ccncc3)cc2)CSc2ccc(F)cc21 915986136 WSVRDYHODSWYSS-GZTJUZNOSA-N 377.440 5.172 30 20 GKED CC(C)(C)c1ccc(OCCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 916848452 BNQPDXDPBGPLJL-OAQYLSRUSA-N 386.495 5.568 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 916915447 JMROVEILGOOFAM-SOLBZPMBSA-N 394.437 5.045 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(SC(F)F)cc1 918024509 YWRJWGRNSATHKY-UHFFFAOYSA-N 378.444 5.230 30 20 GKED CCn1cc(C(=O)/C=C\c2ccc(OCc3ccc(Cl)cc3)c(OC)c2)cn1 920991988 WIIRWXWIAGKKJD-POHAHGRESA-N 396.874 5.040 30 20 GKED Cc1c(/C=C(\C(=O)C(=O)O)c2ccc3ccccc3n2)sc2cc(F)ccc12 1776116944 LENQRDJHVQKUKQ-WJDWOHSUSA-N 391.423 5.091 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1OC1CCCC1 1776354888 HAIGBAPSEZSQGW-ACCUITESSA-N 394.467 5.390 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2cccc(CC(=O)O)c2)cc1)c1ccccc1 1776469379 BOUDTSKPPZPORK-SPQRHKFCSA-N 386.447 5.350 30 20 GKED CCCCCOc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776794033 BJIGTGBMNICLNE-CYVLTUHYSA-N 378.468 5.556 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776801346 LFUNMLKVJCGXPV-WQLSENKSSA-N 382.456 5.247 30 20 GKED Cc1cccc2c1CC/C(=C/c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777457404 RZUBGIYAQPNOPQ-GCNVJJAOSA-N 398.458 5.412 30 20 GKED C=CC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)CCCCC)CC1 1831466950 MOBLIOQNQKLKIS-VWPQPMDRSA-N 390.612 5.035 30 20 GKED N#Cc1cccc(NC(=O)c2ccccc2CSc2nc3ccccc3o2)c1 15644098 YBHASOARINGJAY-UHFFFAOYSA-N 385.448 5.244 30 20 GKED COc1ccc(NC(=O)c2ccccc2SCC#N)cc1Cc1ccccc1 24538983 CAZMJJPPUFFFGH-UHFFFAOYSA-N 388.492 5.154 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c1 51656063 IOYPGFWWOWLTRQ-RHSMWYFYSA-N 397.425 5.199 30 20 GKED CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 54195147 UORHKFVRWZODPR-KRWDZBQOSA-N 397.478 5.006 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Nc1cc(C#N)ccc1OC(C)C 63640886 UVCIHYDDMODEAX-KRWDZBQOSA-N 379.504 5.216 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)c1 67319461 IMXKSAWEKALIQS-KRWDZBQOSA-N 391.471 5.194 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1nc2ccccc2o1 67622054 FFNMBXHBOPEFIZ-LBPRGKRZSA-N 379.828 5.095 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1C(F)(F)F 92874573 HNMHFBUBSQJOJH-CQSZACIVSA-N 379.275 5.268 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](Sc2ccccc2F)c2ccccc2)n1 106353505 NNNOEUMOPMRESU-KXBFYZLASA-N 382.485 5.301 30 20 GKED N#Cc1ccc(NCc2cccc(COCc3ccco3)c2)cc1C(F)(F)F 111119532 GVRVMGIILQJECV-UHFFFAOYSA-N 386.373 5.499 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)C1CCCCC1 115185556 AFKOGMYHKIPVCC-LJQANCHMSA-N 378.501 5.151 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 120051562 GBZUPSQYNAVBQA-HOFZKYPUSA-N 379.872 5.138 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nnc1-c1cccnc1 125480640 JEHFKNUVZMDYIV-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CCCOc1ccc(Oc2ncccc2CN[C@H](C)c2cccc(C#N)c2)cc1 181527624 KGPHKKYAJZMFKY-GOSISDBHSA-N 387.483 5.385 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](C)Cc1ccsc1 188911933 BYDPRIMNVVZLRW-JKSUJKDBSA-N 387.574 5.485 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@@H](c2ccccc2)C1 303012903 RGPOPAORDNPXPL-HXUWFJFHSA-N 384.504 5.339 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 303023928 MIVGXBGTWDIDFC-GOSISDBHSA-N 385.467 5.884 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)c1ccc(F)cc1 303364334 IBKJRLHGKTVTKX-HNNXBMFYSA-N 385.508 5.177 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)N2CCC(Oc3cccc(C#N)c3)CC2)cc1 303773287 JQKCFQWRCFQCMV-IBGZPJMESA-N 390.527 5.245 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/C(C)(C)c1cccc(Cl)c1 328840864 PCYCUZDJEALTOO-ZDUSSCGKSA-N 378.925 5.239 30 20 GKED O/C(CC12C[C@@H]3C[C@H](C1)CC(/C(O)=N/[C@@H]1CC=CCC1)(C3)C2)=N\[C@@H]1CC=CCC1 329756699 MKTBILYKTHUZNN-OTKRSDGRSA-N 396.575 6.094 30 20 GKED Cc1nc2c(c(C(F)(F)F)n1)C[C@H](/C(O)=N/[C@@H]1CC[C@@H]3CCCC[C@@H]3C1)CC2 329857260 YYNAHMYWAQNODA-ZJIFWQFVSA-N 395.469 5.224 30 20 GKED CC[C@@H]1CCc2nc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)sc2C1 330002725 ZDAQJHZTYZDLPT-LRVUVFPRSA-N 375.538 5.171 30 20 GKED C=CCC[C@H](C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1 428037505 ZAEVBMCQMIORGP-FCHUYYIVSA-N 377.532 5.242 30 20 GKED C[C@H](Sc1ccc(Br)cc1)C(=O)Nc1ccc(C#N)cc1Cl 430358345 UMIGFDOAQHQSHG-JTQLQIEISA-N 395.709 5.093 30 20 GKED CC(C)Oc1cc(O)ccc1NC(=O)Nc1ccccc1SC[C@H](C)C#N 433504770 ADDANRPTYGMFHQ-CQSZACIVSA-N 385.489 5.075 30 20 GKED Cc1cccc([C@H](C)SCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 437457289 ZZZXTFRWRKEOGG-SJORKVTESA-N 384.570 5.822 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(F)cc2Cl)cc1F 437480025 KHBADWPQJZVOOI-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc3ncsc3c2)cc1F 437488536 WYMUIIBNFGDWES-UHFFFAOYSA-N 389.411 5.352 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(OC(F)F)cc1 438645655 YFCQFIVVMFDDBJ-JTQLQIEISA-N 399.319 5.061 30 20 GKED CC(C)=CCN(Cc1ccc(Cl)cc1)Cc1nnc(-c2ccc(C#N)cc2)o1 439319946 SJEUDJPBLWYQNN-UHFFFAOYSA-N 392.890 5.230 30 20 GKED C=CCC[C@@H](NCc1cc(C(F)(F)F)n[nH]1)c1ccc(C(F)(F)F)cc1 440642071 XCQBNQJYPJYJOK-CQSZACIVSA-N 377.332 5.244 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1OCCC 474441654 PPKNYKIAKARCFC-INIZCTEOSA-N 386.517 5.334 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(Br)ccc2Cl)cc1 475583953 BDLYPBLGUBILRJ-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2ccccc2Cl)n1C1CCCC1 475931770 FILCOVSSOKOJMZ-UHFFFAOYSA-N 388.968 6.136 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2ccsc2)nc1C 476113993 XFPIRVLOHHXXTD-UHFFFAOYSA-N 376.525 6.223 30 20 GKED C=C(C)[C@@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(F)c(F)c1 476201165 HPBFQOKKFALSGR-JOCHJYFZSA-N 378.422 6.130 30 20 GKED CO[C@]1(C)CCCN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CC1 477861575 LPUCIVUXYQDTNP-JOCHJYFZSA-N 398.890 5.035 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NCc1cn(C)nc1-c1ccc(C#N)cc1 491034782 UBQQYXMRWWEGHQ-IBGZPJMESA-N 399.542 5.258 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Nc2ccc(F)cc2F)c1 494082287 CNPSPVHWUPKYDF-UHFFFAOYSA-N 395.434 5.576 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(F)cc4cccnc34)cc2)c1 502817876 PWRAHRPHZLLKPR-UHFFFAOYSA-N 397.409 5.077 30 20 GKED C[C@H](NC(=O)N(Cc1c(Cl)cccc1Cl)C1CC1)c1ccc(C#N)cc1 503248877 WYQHFBOMJWLYFB-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCC1 504968605 GRAGHEILCGKFOP-QGZVFWFLSA-N 381.442 5.176 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(NC(=O)CC(C)C)c1 505016477 HVZNODSEPCAVNF-UHFFFAOYSA-N 379.504 5.112 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)c1nc(-c2ccc(Cl)cc2)cs1 505445534 YTONUMQWAJXCKX-OAHLLOKOSA-N 388.279 5.363 30 20 GKED CCSc1cccc(NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1 506283218 IAPIWKUFJMTZKL-UHFFFAOYSA-N 394.525 5.362 30 20 GKED C[C@H](c1ccccc1)N1CCC(NC2CCC(C#N)(c3ccccc3)CC2)CC1 507638950 VIGYPVUFJPTRFP-NGYDJQAMSA-N 387.571 5.206 30 20 GKED CC(C)c1ccccc1OCCC(=O)Nc1ccccc1S[C@@H](C)CC#N 507691633 DYUOTQLGIHVLJQ-KRWDZBQOSA-N 382.529 5.612 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 509718212 XRRDZAMGAPFNNU-SOGDLCAJSA-N 399.494 5.326 30 20 GKED CN(CC1CCCCC1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509895487 DWZZWUPBROMEEA-UHFFFAOYSA-N 391.515 5.376 30 20 GKED N#C[C@H](C(=O)c1ccccc1N1CCCCC1)c1nc2cc(Cl)ccc2s1 513665922 IJOWGMYQTAELHL-MRXNPFEDSA-N 395.915 5.430 30 20 GKED Cc1ccc(F)c(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1 513956489 CVZQUBYKOBFIBA-UHFFFAOYSA-N 391.421 5.379 30 20 GKED C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1ccc(C#N)cc1F 515659237 CIOOEYWERRZCJC-HUUCEWRRSA-N 399.897 5.366 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3ccc(Cl)s3)cc2)c1 518256663 LQCZSSZSVRXMMO-UHFFFAOYSA-N 383.860 5.387 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cccc(F)c2Cl)cc1 518831579 VNCYUFKWOREJBE-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1ccc(F)cc1F 519065288 FLPUVHGWTZAUSJ-AWEZNQCLSA-N 393.393 5.068 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccccc1Cl 519190916 ZWMIDEWOTBSNKQ-CQSZACIVSA-N 398.915 5.610 30 20 GKED CCOc1cccc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 520600944 WPEZRUQLAQZABP-UHFFFAOYSA-N 387.439 5.071 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 521333605 NSZQPDHCGBJHPR-IBGZPJMESA-N 387.321 5.146 30 20 GKED Cc1ccc(SCCC(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)cc1C 521352912 WNOYEUJVPXDOJX-GOSISDBHSA-N 392.446 5.186 30 20 GKED COc1ccc(C#N)cc1NC(=O)[C@H](Sc1ccccc1F)c1ccccc1 521570502 OIEQSXCXKCPVTR-OAQYLSRUSA-N 392.455 5.178 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1c(C)[nH]c2ccccc12 524032864 RFUARJGABREMJB-UHFFFAOYSA-N 387.936 5.132 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)cc1 527228634 NPXHLYROSMRACI-UHFFFAOYSA-N 380.451 5.055 30 20 GKED C=CCOc1ccc(CNc2cccc3c2CN(c2ccccn2)C3)cc1Cl 533804020 SEJFLLZAPZERKD-UHFFFAOYSA-N 391.902 5.432 30 20 GKED Cc1ccc(Br)cc1NCc1cn(CCC#N)nc1-c1ccccc1 535842663 IJPPZFZGGHWHEC-UHFFFAOYSA-N 395.304 5.147 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2ccc(C3(C#N)CC3)cc2)c1 540721043 YNMLJTLKEDPFFH-UHFFFAOYSA-N 390.430 5.457 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1 555098009 CWSNGWSPGBAFSS-UHFFFAOYSA-N 389.421 5.108 30 20 GKED COc1ccc(C2CCN(C(=O)c3sc4ccc(C#N)cc4c3C)CC2)cc1 560093557 JAUXGSKQRCPZNZ-UHFFFAOYSA-N 390.508 5.110 30 20 GKED COc1cccc(C2=CCN(C(=O)c3sc4ccc(C#N)cc4c3C)CC2)c1 560219468 IPCOAGPEFKXAAC-UHFFFAOYSA-N 388.492 5.020 30 20 GKED CC(C)(CC#N)CSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 563976397 UWZJVHDVECSEJY-UHFFFAOYSA-N 383.908 5.015 30 20 GKED CC(=O)N(c1ccccc1)c1nc(CSc2cccc(F)c2C#N)cs1 570469572 OAXRXACXLZHPKY-UHFFFAOYSA-N 383.473 5.131 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1 576558498 FQDIHPIMXUPUOW-JKSUJKDBSA-N 399.947 5.057 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](COC)c1cccc(Cl)c1 582146503 XQPQHDNFFUNJMG-FQEVSTJZSA-N 386.923 5.701 30 20 GKED N#Cc1ccc(C2(C(=O)N3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)CC2)cc1 586868948 UBPAOUSYWMXAFV-GOSISDBHSA-N 398.428 5.015 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)cc1 596789306 NQKRIBUBSODVMI-ROUUACIJSA-N 379.529 5.697 30 20 GKED N#Cc1c(F)ccc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)c1Cl 602761549 SYYGRVIFTMMXJL-OAQYLSRUSA-N 391.833 5.117 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3csc(Cc4ccccc4)n3)c2C#N)C1 603615367 QIWCBBOEGAUHMR-CYBMUJFWSA-N 393.537 5.044 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2cccc(Cl)c2)n1 603690418 FKKZAURPIRGWMJ-UHFFFAOYSA-N 395.915 5.388 30 20 GKED C=CCc1cc(CN[C@@H](Cc2ccccc2)c2ccccc2F)cc(OC)c1O 607168184 MIYZFRYLXWJBKD-QHCPKHFHSA-N 391.486 5.342 30 20 GKED C[C@H](NC(=O)c1cc2ccccc2n1CC#N)C(c1ccccc1)c1ccccc1 609164131 YKHAPUPWBKOSDM-IBGZPJMESA-N 393.490 5.115 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1 609296555 ZKFTXHANXUFRJV-UHFFFAOYSA-N 394.399 5.499 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)C1(C#N)CCCCC1 609980512 MAIVKHRUGYDAFO-UHFFFAOYSA-N 390.462 5.100 30 20 GKED N#Cc1cc(Cl)ccc1SCC(=O)Nc1ccccc1-c1ccccc1 610655048 OEZSKVHUMNXKHM-UHFFFAOYSA-N 378.884 5.609 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccncc1 610722860 OQEOALNGERHJAJ-HNNXBMFYSA-N 391.858 5.531 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1sc(-c2cccs2)nc1C 615081494 MCRGZFYXIFFHIW-UHFFFAOYSA-N 384.526 5.017 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(c2cccc(F)c2)CCC1 619126465 UOGVLCQYCDWXHT-UHFFFAOYSA-N 399.350 5.417 30 20 GKED Cc1cc(C(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc(C)c1F 677856662 SZYNYJOLMPSALQ-RYUDHWBXSA-N 385.323 5.082 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1cc(C)ccc1OC(F)F 725844256 PEAZLTTWVRRODB-UHFFFAOYSA-N 382.370 5.122 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3ccc(C#N)c(Cl)c3)c(F)c2)cc1 730163339 RXKUIHWQZQGNJM-UHFFFAOYSA-N 380.806 5.279 30 20 GKED Cc1cc(/C=C/C(=O)c2c(C#N)c3n(c2C)CCC3)ccc1Oc1cccnc1 732713507 AXJORRPZENCTKE-VQHVLOKHSA-N 383.451 5.006 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c1ccc(C(C)C)cc1 739154299 ITILRILQSSGEKN-PXNSSMCTSA-N 392.499 5.050 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccc(Cl)cn3)cc2)c1 743008906 RERUZWYSVWQHSY-UHFFFAOYSA-N 379.872 5.318 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc2c3c(cccc13)CC2 743056668 JEBYEHPAOMEWJI-MLPAPPSSSA-N 378.431 5.417 30 20 GKED N#Cc1ccccc1CSCCNC(=O)c1sccc1-c1ccc(F)cc1 743746892 UWKPHFUZGTUDNN-UHFFFAOYSA-N 396.512 5.089 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](Cc2ccccc2)c2ccccc2)c1 744029917 WXJCMVQRVYZECF-VWNXMTODSA-N 396.490 5.059 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1OC(F)F 745990509 RGNPGXSACJIZNF-KRXBUXKQSA-N 381.378 5.255 30 20 GKED Cc1nsc(N(C)C(=O)c2sc3cc(Cl)ccc3c2Cl)c1C#N 748234480 SFCALZDLKHDDBD-UHFFFAOYSA-N 382.297 5.121 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(F)cc3F)n2)cc1 752476441 RARMHTCRNJPCMR-KRWDZBQOSA-N 382.435 5.206 30 20 GKED Cc1cc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c(C)s1 753401109 ZGAZZLLQMSBHQQ-GOSISDBHSA-N 380.538 5.688 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N(Cc1ccc2ccccc2c1)C1CC1 761664404 RNPBRGSQPKZSQH-UHFFFAOYSA-N 389.430 5.078 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(OC)c(OC)c2OC)cc1 777232073 PWZIBKHXGCMIMV-CQSZACIVSA-N 377.868 5.017 30 20 GKED C[C@@H](Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1ccc(F)cn1 777691990 IHHFXIMXRGFMCX-SECBINFHSA-N 382.279 5.354 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cccc(Br)n1 777915898 AMDMUDIZGDUCOO-ZHACJKMWSA-N 385.286 5.172 30 20 GKED O=C(/C=C\c1cnn(Cc2ccc(F)cc2)c1)c1cccc(-c2ccncc2)c1 780187525 SAKRUSWHESOULX-TWGQIWQCSA-N 383.426 5.029 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2cc(Br)c(Cl)s2)c1 790209466 RSDZLNVCWUKVPW-AATRIKPKSA-N 384.682 5.019 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cc(C(F)(F)F)cnc1Cl 790903880 OXAVULCUTHCTCT-UHFFFAOYSA-N 386.654 5.164 30 20 GKED Cc1ccccc1[C@@H](O)C1CCN(c2c(C#N)cnc3ccc(Cl)cc23)CC1 804811578 XRPAQKNVKOEHHN-QHCPKHFHSA-N 391.902 5.018 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)c1ccc(F)c2ccccc12 808842764 FWSLCFHDWHSAAC-HUUCEWRRSA-N 377.419 5.152 30 20 GKED CC[C@@H](Cc1ccccc1C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 819947842 RFXOEGWHWXZWCC-RDJZCZTQSA-N 381.426 5.185 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2CC[C@@H]2c2ccc(Cl)cc2F)n1 835201440 WBFJURDDMPPVTI-VHDGCEQUSA-N 376.884 5.429 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(C#N)cc1 915350541 XTXUBVRNRSWMNB-SBUREZEXSA-N 380.451 5.096 30 20 GKED N#C[C@H](C(=O)CCn1c2ccccc2c2ccccc21)c1nc2ccccc2s1 916847667 ODQMCAXTEDRRCU-GOSISDBHSA-N 395.487 5.671 30 20 GKED Cc1cccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916977193 MKJMDOCUJYUNKO-GOSISDBHSA-N 380.900 5.581 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1 918678411 ZNQRCGANPQSTAZ-LJQANCHMSA-N 387.568 5.043 30 20 GKED C=CCN(C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1)C(C)C 919912516 LGYOTEGTXVHUTF-UHFFFAOYSA-N 385.895 5.045 30 20 GKED CC(C)c1ccc([C@H](NC(=O)c2ccccc2OCC#N)c2cccs2)cc1 919990396 UJMMZIVXGWAVCU-QFIPXVFZSA-N 390.508 5.293 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=S)Nc2ccc(F)cc2)cc1 920993821 HWPULRHKKLPTRE-UHFFFAOYSA-N 393.462 5.236 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Cc3ccc(F)cc3)n2)cc1 921136815 PESKDDDHAZXYNL-AUUYWEPGSA-N 394.471 5.013 30 20 GKED CC[C@H](C)c1nnc(N2CCC[C@@](C)(C#N)C2)n1Cc1ccc(C)cc1SC 1752750819 MKNQQQQUQGJUKO-JTSKRJEESA-N 397.592 5.000 30 20 GKED C=CCCC1(C(=O)O)CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 1776168418 MVDKHSBWQVPMIU-NRFANRHFSA-N 383.919 5.562 30 20 GKED CCCCCCCCCCCN(C)Cc1cc(C(=O)O)ccc1Br 1776784555 FMJSEVLZAZPADB-UHFFFAOYSA-N 398.385 6.110 30 20 GKED CCc1cccc2c1OC/C(=C/c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1776977630 QDHGSENSRJPVIR-ATVHPVEESA-N 390.460 5.334 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)o1 1777424542 ITRICXZNTLXIMA-VSGCLNPGSA-N 394.398 5.142 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777455811 BSKMAUDBFDUWMD-QIWJOQEQSA-N 382.459 5.673 30 20 GKED CCc1cccc(CC)c1NC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 5407137 SGZILKFBNOJZMZ-UHFFFAOYSA-N 384.479 5.368 30 20 GKED C[C@H](Sc1nc2ccc(Cl)cc2o1)C(=O)Nc1ccc(C#N)c(Cl)c1 7769078 GEHZUSMCYQSTPW-VIFPVBQESA-N 392.267 5.126 30 20 GKED C=CCc1cc(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)cc(OC)c1OC 33215927 BDNUNJNFMCBSMH-UHFFFAOYSA-N 394.471 5.123 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)[C@@H]3CCCc4ccccc43)c2)c1 46744436 BIYXIJDGBTUSFW-XMMPIXPASA-N 382.463 5.196 30 20 GKED N#CCCN(CCC#N)C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 57027558 DBLWGMIXAXEVJG-UHFFFAOYSA-N 386.691 5.131 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 65680297 CHBRXTRHEDMMHI-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCc1nc2ccccc2s1 108201948 WVSURRJEDOVAIK-UHFFFAOYSA-N 381.526 5.263 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Cl)nc1 108241711 UZZJXPCCXLANDR-UHFFFAOYSA-N 385.798 5.012 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)s1 108529256 CERRWPSHFISOSY-OCCSQVGLSA-N 388.562 5.237 30 20 GKED CC(C)c1ncc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)s1 123269227 NCOTWSWVMSDROX-JTQLQIEISA-N 389.452 5.158 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1c(C)noc1C 123605253 JXFPVMNTLLGEMZ-IBGZPJMESA-N 390.443 5.228 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc2ccccc2c1 175947447 VRKBTBQFUDSPQQ-KSSFIOAISA-N 389.405 5.565 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3cccc(C#N)c3)s2)cc1 178178875 NTTADFPSFQUSQU-LSDHHAIUSA-N 377.513 5.411 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1SC[C@H](C)C#N 178388598 HHYHKRVLBRMZBJ-MRXNPFEDSA-N 397.569 5.267 30 20 GKED Cc1ncc(-c2ccc(NCc3cn(CCC#N)nc3-c3ccccc3)cc2)o1 178818508 QLTPJZQVPZWVQC-UHFFFAOYSA-N 383.455 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC(=O)Nc1c(C)cccc1C 191424659 DJVOYZUAAZNKAJ-UHFFFAOYSA-N 393.531 5.258 30 20 GKED COc1ccc(C[S@](=O)CCCCC(C)(C)C#N)cc1SC(F)(F)F 277505770 BPIZFAXMXMYFNO-RUZDIDTESA-N 393.496 5.276 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ccc(O[C@H](C)C#N)cc1 303230756 VJORRKGINGXZIX-BRADTZPFSA-N 392.455 5.445 30 20 GKED CC1(C)CC[C@@H]2C[C@H](/N=C(/O)N3CCCC[C@@H]3[C@@H]3CN=C(O)C3)c3cccc1c32 329246988 VYLUWZOXNATGOK-GIYDNNGJSA-N 395.547 5.031 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccccc1 410409423 UZKHXCISRPLGHW-CQSZACIVSA-N 396.796 5.307 30 20 GKED Cc1sc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1Br 424667711 VSRCONRGMRUOTO-JTQLQIEISA-N 395.347 5.323 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)C(C)(C)c1csc(-c2cccs2)n1 425631123 BAVHOEBYSDWWHP-CQSZACIVSA-N 395.553 5.240 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OCC(F)(F)F)c1 432677809 KSTPZZUOIATQON-CYBMUJFWSA-N 394.418 5.274 30 20 GKED Cc1nc(-c2cccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2)oc1C 432768235 OBDVPFGVINYGHD-OAQYLSRUSA-N 388.471 5.515 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OC2CCC2)c(F)c1)c1ccccc1 432995876 RZWLBYAYICLNNK-FQEVSTJZSA-N 381.451 5.314 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 433924442 CMTLKDHQDSKRGT-OAHLLOKOSA-N 390.414 5.028 30 20 GKED Cc1cc(C)cc(C[C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 438078180 WRSFPLDBDKKPSD-ROUUACIJSA-N 381.545 5.308 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1(Cc2ccccc2Cl)CC1 439111678 AUBLIFHIHAZZLN-HNNXBMFYSA-N 384.932 5.696 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 439385952 KPCCXMSTRFEZRO-UHFFFAOYSA-N 399.450 5.051 30 20 GKED COc1ccc2occ(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 442534790 YRTBKPYNTNTQBA-CYBMUJFWSA-N 382.828 5.195 30 20 GKED CC[C@H](NCC1(c2cc(Cl)ccc2OC)CCOCC1)c1ccc(C#N)cc1 447536914 RDOZVLLYULSQBN-NRFANRHFSA-N 398.934 5.009 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1C 458793863 ABUGJRGWCFVPSB-PKTZIBPZSA-N 375.516 5.585 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1 465669844 QMZQGDJCATYUSH-ZWKOTPCHSA-N 399.494 5.355 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CC)C(C)(C)c1ccccc1 465968735 XIAFOTMAPMPWQS-QFIPXVFZSA-N 375.516 5.012 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 473681046 XTGPZEZTPJRWTN-IRXDYDNUSA-N 399.585 5.692 30 20 GKED Cc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cccc1C(=O)Nc1ccccc1 475463342 IQWWGDMBSURMLE-FQEVSTJZSA-N 397.478 5.273 30 20 GKED COc1ccccc1-c1nc2sc3c(c2c(-c2ccncc2)c1C#N)CCC3 478261383 GDVXGBIOYOXCQB-UHFFFAOYSA-N 383.476 5.394 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)c(F)c2)c2ccc(F)c(F)c2)c1 479478658 GTUGUALCRRDQRI-JOCHJYFZSA-N 398.453 5.577 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(C)c(-c2ncco2)c1)c1ccc(F)c(F)c1 480963286 RNMOVPSDTNONRY-LJQANCHMSA-N 383.398 5.367 30 20 GKED C=C(C)[C@@H](N[C@@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccc(F)c(F)c1 481570616 GTERCDKWLOHCPK-YCRPNKLZSA-N 386.486 5.324 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c2c1 483227913 CNZLOMQPDSCVBE-QFIPXVFZSA-N 391.474 5.767 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(Sc2ccccc2C#N)cc1 494328702 VNBHYVATJXAFIT-UHFFFAOYSA-N 377.513 5.111 30 20 GKED CCCOc1ccc(-c2nc(C(=O)N(CCC#N)CC(C)(C)C)cs2)cc1 494377164 CAGRDLJANWCCJO-UHFFFAOYSA-N 385.533 5.001 30 20 GKED Cc1cnc(-c2ccccc2NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)[nH]1 494602890 KITYBTMUVARKES-UHFFFAOYSA-N 394.434 5.301 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 499493654 XBJRMNDZEAQLHT-GFCCVEGCSA-N 396.409 5.028 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)Cc1ccc(Br)s1 505030037 RSOZVSMLZLWMLG-UHFFFAOYSA-N 379.323 5.293 30 20 GKED CCN(C(=O)c1cc2ccc(Br)cc2[nH]1)[C@H](C)c1ccc(C#N)cc1 509565361 WYRVFVSROGTHDG-CYBMUJFWSA-N 396.288 5.025 30 20 GKED CC(C)[C@H]1C[C@H](CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 513731035 QOMMROXELIZIOC-XMSQKQJNSA-N 378.472 5.130 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 513865918 LSNLKUSQTUUXNA-UHFFFAOYSA-N 391.496 5.855 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@H]1Cc1ccccc1 518166109 VMFKMLJUWJGVJB-QUCCMNQESA-N 393.556 5.567 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3nc4ccccc4o3)cc2)cc1 519029688 PUNMOHWGVIQGPB-UHFFFAOYSA-N 383.407 5.063 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1 521720651 RRTDBQFEARUJPX-UHFFFAOYSA-N 392.528 5.036 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccccc1F 522640949 HHRBUOYWSXRAJP-UHFFFAOYSA-N 380.806 5.420 30 20 GKED CCN(C(=O)c1ccc(CC#N)cc1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 534685906 NNXRLYJOULZVCV-VWLOTQADSA-N 397.522 5.523 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCC[C@@H]2c2ccc[nH]2)cc1Cl 534918209 AAESZJKNRTXUMF-LJQANCHMSA-N 391.858 5.309 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc2ccccc2cc1OC(F)F 536416906 UWXQSJOVVBKMKO-UHFFFAOYSA-N 398.434 5.699 30 20 GKED C=CCC[C@H](NCc1nc(-c2ccco2)no1)c1ccc(C(F)(F)F)cc1 538230355 XOJDMCMSDNOKKM-HNNXBMFYSA-N 377.366 5.146 30 20 GKED C=CCC[C@H](NCc1cnc2nc(C)cc(C)n12)c1ccc(C(F)(F)F)cc1 539524142 XTQZYBYBQBATIW-IBGZPJMESA-N 388.437 5.162 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3OCCc3ccccc3)cc2)CC1 540735783 FKRVJMSZRIONIY-UHFFFAOYSA-N 382.463 5.116 30 20 GKED CSCC[C@@H](C)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542084976 IDKBMPQZEHORHC-IAGOWNOFSA-N 381.545 5.069 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)sc2ccc(C#N)cc12 556010403 XUELTXLNKUGTNO-MRXNPFEDSA-N 399.397 5.095 30 20 GKED CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 558060452 OEUZHJUHLPENQM-AWEZNQCLSA-N 390.314 5.277 30 20 GKED N#CCCC[C@H](N[C@H]1CCCc2c(Br)cccc21)c1ccccc1 559861614 APGTYIZWZYNBNK-SFTDATJTSA-N 383.333 5.851 30 20 GKED N#CCC[C@H](NC(=O)Nc1cc(F)c(F)cc1N1CCCCC1)c1ccccc1 567404448 CXQZUSGLIMSRIL-IBGZPJMESA-N 398.457 5.122 30 20 GKED Cc1cccc2nc(C3CCN(Cc4ccc(C#N)cc4C(F)(F)F)CC3)oc12 569799497 HSANOOTYJFZOTC-UHFFFAOYSA-N 399.416 5.406 30 20 GKED CCN(CC(=O)Nc1c(C)cccc1C)Cc1ccc(-c2ccccc2C#N)cc1 580865949 YMSCNPQKUOCKMN-UHFFFAOYSA-N 397.522 5.303 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2)cn1)c1ccc(C#N)c(Cl)c1 584210903 UHHXDBSWSIEJAG-UHFFFAOYSA-N 377.831 5.066 30 20 GKED N#CCCC[C@H](NCc1oc2ccccc2c1Br)c1ccccc1 594518516 JDARNPWXWFKUDT-KRWDZBQOSA-N 383.289 5.720 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccsc1Cl 596395433 WWVNSJVRPVWMFW-GFCCVEGCSA-N 396.990 5.525 30 20 GKED N#CC1(CC(=O)N2CCCCC[C@H]2c2noc(-c3ccccc3)n2)CCCCC1 597484729 RHECYASXRPPLEL-IBGZPJMESA-N 392.503 5.044 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)C(F)(F)F 599390756 PKZQMTLLIUOBMY-SECBINFHSA-N 384.345 5.238 30 20 GKED N#Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2cccc(C(F)(F)F)c2)s1 602754807 AYODMDXGKHQCNO-SFHVURJKSA-N 399.397 5.410 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 603991383 JWHKGBSOENVSPJ-UHFFFAOYSA-N 388.492 5.425 30 20 GKED CC(C)[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608838350 MBZDSFBMVCUPGQ-IBGZPJMESA-N 389.421 5.116 30 20 GKED N#CCCCOc1cccc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)c1 608860466 OALJIHJWNVLPBO-XMMPIXPASA-N 397.478 5.136 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1OC 609378058 PREXPTMAFZJOAA-MRXNPFEDSA-N 398.528 5.378 30 20 GKED Cc1c(Cl)cnc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1C#N 612070335 ZNRSDKNCTWEKGW-IUCAKERBSA-N 385.739 5.237 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Br)c(F)cc2Cl)cc1Cl 614500225 MUVYJEDVMLHWCW-UHFFFAOYSA-N 388.023 5.019 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 618750802 XKBWZIARZHBSJF-JOCHJYFZSA-N 394.434 5.031 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cccc(C(F)F)c1 622485772 XWAPJEIGYVHEJA-ZDUSSCGKSA-N 397.265 5.676 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c12 624581473 BXOITPAUPNWTDD-QGZVFWFLSA-N 396.450 5.091 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccc(-c3ccco3)s2)cc1 675752749 ULGACRTZBUJNJU-UHFFFAOYSA-N 392.480 5.075 30 20 GKED CC(C)n1cccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 677912809 VFNTYNOLBDHQKU-GFCCVEGCSA-N 377.391 5.188 30 20 GKED Cc1nc(-c2cccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2)cs1 726446305 XVCADYMKSOIBDJ-UHFFFAOYSA-N 384.917 5.453 30 20 GKED Cc1ccc([C@@H](C)NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)s1 730175998 RMLRBILEJQROSG-CQSZACIVSA-N 380.444 5.351 30 20 GKED C=CC[C@H](NC(=O)NCc1ccccc1Oc1ccc(C)cc1)c1ccncc1 734670123 ZLLYNTQKQUYGTH-QFIPXVFZSA-N 387.483 5.299 30 20 GKED C=CC[C@@H](NC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1ccncc1 734684833 WTTBDBRCQCEHOA-DNQXCXABSA-N 383.495 5.056 30 20 GKED N#CCOc1cccc(NC(=O)[C@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)c1 735633546 DFDMKOMCCCKYAW-IUKKYPGJSA-N 394.902 5.230 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cncc(F)c1 737445097 VXAYCRYAYMIYFA-WTKPLQERSA-N 380.806 5.023 30 20 GKED Cc1cn2c(/C=C/C(=O)c3ccc(SCC(F)F)cc3)c(C)nc2s1 741841270 FGQJOUUZAYHGLY-BQYQJAHWSA-N 378.469 5.266 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741844187 SQDYXRHBLNHATP-CNRJSHIUSA-N 391.414 5.528 30 20 GKED Cc1ncc(/C=C\C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)s1 741969671 HXUCLNHVLPDEQG-KTKRTIGZSA-N 393.899 5.223 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(O[C@@H](C)C#N)cc2)cc1 742376095 MHTVDGXXGUXCNH-RBUKOAKNSA-N 386.495 5.504 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(Oc3ccccc3F)c(F)c2)cc1 742377929 KYSNTPQTKXTEMQ-INIZCTEOSA-N 394.421 5.338 30 20 GKED C#Cc1cccc(N(C(=O)[C@@H](C)c2ccc(Br)s2)C(C)C)c1 742673600 ZFBHCWWLWJLMSB-ZDUSSCGKSA-N 376.319 5.037 30 20 GKED COc1ccc(CCC(C)=NOCc2csc(Cc3ccccc3)n2)cc1 744179254 ISHJDHJVXDBMGH-UHFFFAOYSA-N 380.513 5.268 30 20 GKED CC(C)CN(C(=S)Nc1cccc(Br)c1)c1ccc(C#N)cc1 745687511 JJBXQWUWOKUSBI-UHFFFAOYSA-N 388.334 5.180 30 20 GKED N#C[C@@H](C(=O)CCOCC1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 751826687 JSWPRBZIAHQMKO-AWEZNQCLSA-N 395.311 5.110 30 20 GKED CC1(c2ccccc2)C/C(=C\c2nccs2)C(=O)/C(=C/c2nccs2)C1 767886223 FVWWAOUAHQUQIW-JOBJLJCHSA-N 378.522 5.387 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1cc(Cl)ccc1OCC#N 769990917 PUVFTMBQUSCHDV-QGZVFWFLSA-N 382.813 5.334 30 20 GKED Fc1ccccc1NC(=S)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 779729435 AERXKKTZQWGATL-ZDUSSCGKSA-N 396.331 5.435 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccncc2)cc1 788349600 LQPJJTHZRBOMFC-KHPPLWFESA-N 384.483 5.097 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2F)o1)c1nccc2ccccc12 792102382 DXLUXOSDMKRDIV-HXUWFJFHSA-N 384.410 5.443 30 20 GKED N#CC[C@@H](CC(=O)OCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 795991931 PQAMAPQVPFMTLE-QFIPXVFZSA-N 398.462 5.070 30 20 GKED COc1ccc(-c2nc(/C=C3/CSc4ccc(F)cc4C3=O)cs2)cc1 797127179 UTRXUTMQJWLLPN-JYRVWZFOSA-N 383.469 5.330 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC1(C#N)CC1 797501094 ALMXYKNQDSHDDP-UHFFFAOYSA-N 379.243 5.232 30 20 GKED N#C[C@H](C(=O)CO[C@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 797549628 OVQVYGPVJVHFFI-APWZRJJASA-N 396.899 5.220 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCCC(F)(F)C2)cc1 800519274 NCJHOUOEHYNOEF-UZLBHIALSA-N 383.442 5.289 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(N2CCCCCC2)cc1 801778553 POUKKWAAUJMZSD-KRWDZBQOSA-N 378.476 5.002 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CCO2 806200560 HAXMGIKZLDOPMA-QHCPKHFHSA-N 397.478 5.077 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)CC1 809090762 KECCIBBQWBDWOV-BETUJISGSA-N 394.418 5.316 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2cccc(OCc3ccccc3)c2)SC1=S 814290816 OTVXQXJEVJPYAX-UNOMPAQXSA-N 381.522 5.043 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1sc(-c2ccccc2)nc1C 814711865 YUVMMNLZCHLAIN-UHFFFAOYSA-N 376.407 5.368 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)CCCC3=O)cc1 815011063 YXAIFHLDNWTKII-HSZRJFAPSA-N 380.447 5.113 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(N2CCCOC2=O)cc1)c1ccc(F)c(F)c1 815617580 QEKPZBXBPNEBCE-YCRPNKLZSA-N 386.442 5.280 30 20 GKED COc1cccc2cc(/C=C3/CC/C(=C/c4cccc([N+](=O)[O-])c4)C3=O)oc12 818240180 IMVWDQWSIRYTAU-CYRKZOTCSA-N 375.380 5.180 30 20 GKED CCCn1ncc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C1CC1 836270434 SUYGCRVFZSAAKT-NRFANRHFSA-N 399.498 5.470 30 20 GKED C=CCCC[C@@H](C(=O)NC12CCC(C(F)(F)F)(CC1)CC2)c1ccccc1 883982998 ROLKOOXXSANHGZ-KMFTYDHNSA-N 379.466 5.898 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1cccc(Cl)c1)C(=O)O 900069264 WUFANGUXRPLHMO-GOSISDBHSA-N 377.843 5.171 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3[nH]c(C)c(C)c3c2)cc1 916914978 ZVECIXJFVNJPKZ-NRFANRHFSA-N 387.483 5.089 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NNc1nc(-c2ccccc2)cs1 1776022397 MGORXEANGDAOOP-UHFFFAOYSA-N 377.469 5.051 30 20 GKED COc1cc(C(=O)O)ccc1NN=CCCCc1ccc(Cl)c(Cl)c1 1776050436 VRCMDDXOYPCHKT-UHFFFAOYSA-N 381.259 5.121 30 20 GKED O=C(/C=C\c1cc(F)c(C(=O)O)cc1F)c1ccc(OCc2ccccc2)cc1 1776127342 QFENNWMDMBUUIY-FLIBITNWSA-N 394.373 5.138 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1776665797 CYHBJLKVZLKOAE-XONHRPPISA-N 398.458 5.350 30 20 GKED CCCCCCCOc1ccc(CNCc2c(F)cc(C(=O)O)cc2F)cc1 1776787091 UFENIXYUCFEGLQ-UHFFFAOYSA-N 391.458 5.302 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)[C@H]3CC=C(C)CC3)cc2)CCC1 1789114187 GHMQDZDYRDBTFJ-FQEVSTJZSA-N 392.543 5.061 30 20 GKED CCN/C(S)=C(/C(=O)c1ccc(C(C)C)cc1)[n+]1ccc(C(CC)CC)cc1 22686830 LGSLPXUMGDSHKE-UHFFFAOYSA-O 397.608 5.549 30 20 GKED N#C[C@@H](C(=O)c1ccccc1C(=O)c1cccs1)c1ccc2ccccc2n1 48854377 COXAGCMZCJLPJF-GOSISDBHSA-N 382.444 5.017 30 20 GKED CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)Nc3ccc(CC#N)cc3)c12 59005990 CYDQTXIVNVSXSL-UHFFFAOYSA-N 388.471 5.007 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955388 PWFDDADCPABPHI-KRWDZBQOSA-N 390.512 5.173 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1nc(-c2ccncc2)cs1 114619048 YULLEXLOTQBIJB-NJDAHSKKSA-N 395.487 5.338 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1-c1ccc(F)cc1 119841211 PHNMWGLXRRFGQB-INIZCTEOSA-N 375.428 5.229 30 20 GKED COCc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 129783234 OUJFXARJRRZPGN-OAQYLSRUSA-N 390.870 5.394 30 20 GKED N#Cc1ccc(-c2nnc(CSc3ncc(-c4ccc(Cl)cc4)o3)o2)cc1 134180320 CDQUSLYCRGAUOZ-UHFFFAOYSA-N 394.843 5.209 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1ccc(F)cc1 170986137 WCBLYLQITSIGNP-HUUCEWRRSA-N 388.533 5.510 30 20 GKED Cc1ncsc1CN(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 172236638 NVEQABZDXYZSEN-UHFFFAOYSA-N 397.887 5.041 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 173115278 SVKUCBYWKCMYMK-IEBWSBKVSA-N 381.545 5.423 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(-c2cccnc2)cc1 175684012 HSJNQONMGFRPIT-LJQANCHMSA-N 399.494 5.047 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(F)ccc2SCC(F)F)c1 175989212 JSSAYPPVSSEHEJ-UHFFFAOYSA-N 382.432 5.051 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(NC(=O)C3CCCCC3)c2)n1 177759590 YYHVSTHBBNPRSB-GOSISDBHSA-N 395.528 5.275 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)cc2Cl)nnc1-c1cnccn1 178299904 DCJCSMMJDRCRCX-LLVKDONJSA-N 392.315 5.081 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 193883627 NTEKGXIKKNZMKQ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C=CCn1c(S[C@@H](C)c2cc(F)ccc2F)nnc1-c1ccccc1F 195542460 KAHCZONZMLMILV-LBPRGKRZSA-N 375.419 5.402 30 20 GKED C=CCN(C(=O)[C@H](C)c1cccc(OC)c1)c1nc(-c2ccccc2)cs1 195602471 ORIJBKPIIYMNDX-MRXNPFEDSA-N 378.497 5.141 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C[C@@H](C)c1ccccc1 303166841 IOJKCILGYSPBIC-GOSISDBHSA-N 384.479 5.578 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1 303291339 KSZLENQDYMPNPJ-QGZVFWFLSA-N 377.513 5.269 30 20 GKED CC(C)c1csc([C@@H]2CCCN(C(O)=Nc3scnc3C3CC3)C2)n1 328919468 SMQIOIDMBOSORS-CYBMUJFWSA-N 376.551 5.026 30 20 GKED COc1cc(C)cc(N/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1C 330222551 RXKZTBDYEYTXIA-GOSISDBHSA-N 382.508 5.027 30 20 GKED Cc1ccc(N(C(=O)c2cccc(C#N)c2Br)C2CCCCC2)nc1 410459271 REDOPHLTAZFGTG-UHFFFAOYSA-N 398.304 5.004 30 20 GKED CC(=O)c1ccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 419502538 GAAKVQXVCZGIGI-HNNXBMFYSA-N 398.553 5.155 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1ccccc1N1CCCC1)c1ccccc1 435104015 DASBIASULGCQIR-QFIPXVFZSA-N 377.532 5.136 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(-c3cnco3)cc2)cc1F 437487797 BEPWEIMIEIQCSZ-UHFFFAOYSA-N 399.381 5.397 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCS1 437854525 ZBKUWXMXUJNUTN-LJQANCHMSA-N 381.501 5.018 30 20 GKED CSc1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 438079709 KOIJNFSFPHZGBD-SJLPKXTDSA-N 385.920 5.366 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)N[C@H](CCC#N)c3ccccc3)oc12 438849032 RBNYNJHLOLQXHJ-VQIMIIECSA-N 391.471 5.237 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2Cc2ccccc2)c2ccccc21 443911879 ZJEYOFDFWQWKBK-UHFFFAOYSA-N 393.490 5.788 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 444172288 QTOBLMMAEGYQON-JOCHJYFZSA-N 398.510 5.237 30 20 GKED CC[C@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(C#N)cc1 447581270 SRUGJSKWVBLRRG-SFHVURJKSA-N 380.385 5.538 30 20 GKED C[C@H](C(=O)N1C[C@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462249984 XEBLJLAPZLLROY-QEEYODRMSA-N 386.417 5.290 30 20 GKED CS[C@H](C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464297894 UHSCMEVYHRYHAH-LLVKDONJSA-N 380.391 5.059 30 20 GKED C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)[C@H](C)C#N 468182403 HTVSGAFGBYKPFJ-JKIFEVAISA-N 377.875 5.016 30 20 GKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1cc(F)c(Cl)cc1Cl 474188330 GYCBDWPLSKAZEK-OCCSQVGLSA-N 379.262 5.397 30 20 GKED C[C@@H]1C[C@@H](C)[C@@H](C)N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 474505357 HBXSVHMPGDXIRL-GUDVDZBRSA-N 391.515 5.230 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1nc2ccccc2n1CC 476123325 OVINLHFQQIVAGJ-UHFFFAOYSA-N 393.556 5.639 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)o1 480639005 UWNOATZRKGJLMT-WBMJQRKESA-N 389.402 5.066 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)N[C@@H](C#N)c1ccccc1Cl 480818701 UZXVODFCAMAHRC-AWEZNQCLSA-N 398.087 5.059 30 20 GKED C=CCN(C(=O)c1cc(-c2ccccc2)nc2c1cnn2C(C)C)c1ccccc1 484253068 IDMXAADENGILNR-UHFFFAOYSA-N 396.494 5.512 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 494753374 OLFMKFSBWCOLCC-AWEZNQCLSA-N 391.393 5.593 30 20 GKED COc1ccc([C@@H](Nc2cccc(OCCCC#N)c2)c2ccc(F)cc2)cc1 494953179 QBRUMIYBFJFKMX-DEOSSOPVSA-N 390.458 5.718 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCCCc1nc2ccccc2s1 498448637 IYCCAIUXVVKROB-UHFFFAOYSA-N 391.540 5.320 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OCC2CCCCC2)cc1 498933678 MUIALYNIZXTPJP-UHFFFAOYSA-N 377.488 5.181 30 20 GKED C[C@H](NC(=O)c1c(Cl)cncc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 498950128 YYSUEIVFRQVXGL-ZDUSSCGKSA-N 396.277 5.418 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)c1 504060949 XWWLJZVALIWAEA-MRXNPFEDSA-N 393.512 5.648 30 20 GKED CCSc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 505128953 MIAWUPKOTGZRRM-UHFFFAOYSA-N 390.533 6.074 30 20 GKED CCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@H](C)c1cc2ccccc2o1 508096929 MMCOMJYXKQTYJJ-OAHLLOKOSA-N 378.476 5.476 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 511134254 IKOLRQIJBRMRQR-UHFFFAOYSA-N 387.439 5.535 30 20 GKED CC1=C(c2ccco2)CN(C(=O)c2ccccc2Oc2ccccc2C#N)CC1 512757308 IECMSIRMUDBCGU-UHFFFAOYSA-N 384.435 5.263 30 20 GKED CC1=C(c2ccco2)CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)CC1 512785609 LTWCKMOLXGVPDE-UHFFFAOYSA-N 398.462 5.458 30 20 GKED CC(C)c1ncncc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 514466578 VAVOESNTVKXJPL-SFHVURJKSA-N 390.874 5.161 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cs2)cc1 515597260 DMXQHKKXHGQHHA-INIZCTEOSA-N 387.464 5.565 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 517455216 VEOZLNKNHAQBAK-CQSZACIVSA-N 393.537 5.623 30 20 GKED CC(C)N(Cc1cccc(F)c1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 517473770 SZFFHYYZEWJNMQ-INIZCTEOSA-N 385.508 5.520 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1ccccc1S[C@@H](C)CC#N 517517626 FKABMSTVSLPHKZ-AJYBTWMASA-N 388.577 5.497 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)cc2Cl)nnc1-c1ccncc1 517785152 NNMIRGXTKAKRFA-GFCCVEGCSA-N 391.327 5.686 30 20 GKED CC(C)c1noc2nc(-c3ccco3)cc(C(=O)N(CCC#N)CC(C)(C)C)c12 517833530 WOVMNIGCOUDOCI-UHFFFAOYSA-N 394.475 5.008 30 20 GKED N#CCCSc1ccccc1NC(=O)CSc1cc(Cl)ccc1Cl 518123867 ZHGNGKFGXFAYNP-UHFFFAOYSA-N 397.352 5.730 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(F)cc1 518164424 BGJZSLOPKYNDFZ-HNAYVOBHSA-N 383.492 5.446 30 20 GKED C[C@H](SCC(=O)c1cn(CCC#N)c2ccccc12)c1ccc(Cl)cc1 520117645 DUSFRPUYKKHGEA-HNNXBMFYSA-N 382.916 5.885 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4cnco4)cc3)cc2)cc1 520324976 XMGGUWIQMJOWTN-UHFFFAOYSA-N 395.418 5.452 30 20 GKED C[C@H](NC(=O)N[C@@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 520416281 TVQGKZNKIBRNDD-CYFREDJKSA-N 383.495 5.293 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 521327061 OSYJGRPRLQCMBC-HBGVWJBISA-N 386.520 5.976 30 20 GKED C=CC1CCN(C(=O)c2cc(-c3ccccc3C)nc3c2cnn3C(C)C)CC1 521957210 XELBTUBRXNEQPT-UHFFFAOYSA-N 388.515 5.026 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1 524248919 JLHLIRLEQZFBJE-CQSZACIVSA-N 390.405 5.182 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(F)cc1OCC1CC1 524896262 OCMOJPRKJOHHOY-CQSZACIVSA-N 399.491 5.510 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)s2)o1 541018847 MUKKMTGXJJAUEJ-LBPRGKRZSA-N 376.359 5.220 30 20 GKED C[C@@H](C#N)CN(C(=O)c1ccc(-c2ccc(Br)s2)s1)C1CC1 543943978 VMMCHPAIZVGEDM-JTQLQIEISA-N 395.347 5.003 30 20 GKED C=C(C)Cn1c(SCc2nc(C3CCC(C)CC3)no2)nnc1-c1ccco1 547053984 RMVHQQMTOOHBGU-UHFFFAOYSA-N 399.520 5.083 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCC[C@@H]3c3ccccc3)cc2)nc1 547382153 BDTIARWKDADLRU-JOCHJYFZSA-N 383.451 5.113 30 20 GKED Cc1c(C(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)sc2ccc(C#N)cc12 559948893 CKQZLHAWYSCKCB-CQSZACIVSA-N 387.464 5.227 30 20 GKED C=CCn1cccc1-c1nc([C@@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 561932929 BREFFWQTYWEFLW-INIZCTEOSA-N 395.356 5.008 30 20 GKED C[C@H](Oc1ccccc1NCc1cccc(OCCCC#N)c1)C(F)(F)F 564680084 PZMSDEHYSYXIOT-HNNXBMFYSA-N 378.394 5.311 30 20 GKED C[C@H]1C[C@H](C(C)(C)C)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 574308607 ICGWADDIUGILTD-QFBILLFUSA-N 377.488 5.032 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N2CCC(CCC#N)CC2)cc1 578744064 ZYEKCLGLCTXSPL-GOSISDBHSA-N 391.515 5.149 30 20 GKED Cc1sc(NC(=O)[C@@H](C)Oc2ccc(C#N)cc2)nc1-c1cccc(Cl)c1 580350209 JHLKPYRVKTYKHE-GFCCVEGCSA-N 397.887 5.050 30 20 GKED CCOc1cc(CN(C)[C@@H](C#N)c2ccc(Cl)cc2)ccc1OC(F)F 585718202 MPHMGWAQILQGGE-INIZCTEOSA-N 380.822 5.037 30 20 GKED CSCc1c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)oc2ccccc12 589795023 SSDDJHXZCUTRGN-CYBMUJFWSA-N 390.386 5.200 30 20 GKED CCOc1ccc(N(C(=O)CC2(C#N)CC2)c2nc3ccccc3s2)cc1 590974136 MDQPCCLEDYNUHX-UHFFFAOYSA-N 377.469 5.054 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCC(F)(F)C2)cc1Cl 593143269 IAHQURQBDIPCRE-KRWDZBQOSA-N 389.833 5.258 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@@H]1CCc2ccccc21 596735342 YDBKRJLVIUMDKJ-AEFFLSMTSA-N 379.529 5.132 30 20 GKED N#CC1(CC(=O)N2CCCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)CCCCC1 597758961 YFSRMMHEHQULPH-SFHVURJKSA-N 384.911 5.134 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCOc1ccccc1 603533201 SOUFCLQWCYLZIC-UHFFFAOYSA-N 388.442 5.008 30 20 GKED N#Cc1ccc(CSCc2nc(-c3ccc(C(F)(F)F)cc3)no2)cc1 604058076 SVYTZZMJCTUPQV-UHFFFAOYSA-N 375.375 5.060 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 604487850 DCVDFDVTZGYLMS-OAHLLOKOSA-N 387.405 5.036 30 20 GKED N#C[C@H](C(=O)c1ncoc1-c1ccccc1Cl)c1nc2cc(F)ccc2s1 608553104 SFFHQEGQPMQVNX-GFCCVEGCSA-N 397.818 5.234 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccccc2F)CC1 609930296 ZMAOEILJITZAMK-INIZCTEOSA-N 397.519 5.489 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 610014576 BHZPBOCKQNQQHH-GCJKJVERSA-N 375.516 5.801 30 20 GKED Cc1nc(C2CC2)oc1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 612679737 QYTOXRREJNADNP-UHFFFAOYSA-N 391.858 5.233 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 615499223 RWZOIGYOTQDNKW-UHFFFAOYSA-N 380.488 5.237 30 20 GKED Cc1nc(Cc2ccc(F)cc2)sc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 647377156 TVLIZJHZMJNTAZ-HNNXBMFYSA-N 397.500 5.005 30 20 GKED N#C[C@H](C(=O)c1ccnc(C2CC2)c1)c1nc2cc(C(F)(F)F)ccc2s1 679980389 XOFYNTLJGSCAOI-CYBMUJFWSA-N 387.386 5.078 30 20 GKED Cc1ccc2c(CC(=O)N(Cc3ccccc3)c3ccccc3C#N)c[nH]c2c1 726140613 QGVAZDQGPNOUNL-UHFFFAOYSA-N 379.463 5.124 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1 726941627 HFLOJXOEFPYNFJ-UHFFFAOYSA-N 395.915 5.641 30 20 GKED CC(C)N(CCC#N)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 729263989 JTFMXJYLIVCLAG-UHFFFAOYSA-N 396.490 5.698 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)cc1Cl)c1nc2cc(F)ccc2s1 730422875 XVZWOZXFXDWADR-LBPRGKRZSA-N 379.243 5.161 30 20 GKED COCCOc1ccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc1 730464958 QCVNYRJHNACQQC-SDXDJHTJSA-N 391.492 5.048 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(Cl)cc1Cl 730954682 HLJRSPUWDSZJOX-LLVKDONJSA-N 396.368 6.054 30 20 GKED CCCCCCCCCC(=O)N1CCC([C@H]2CCCCCN2C(C)=O)CC1 731469197 UPCRUUXKZUBQHE-JOCHJYFZSA-N 378.601 5.157 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2ccc(C(F)(F)F)nc2O)cc1 731564547 JKWQUVZGKOCVOV-XYOKQWHBSA-N 393.405 5.661 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)c2cc3ccccc3s2)c1 733848596 ZCNWEHHAOADFAK-QAPCUYQASA-N 393.512 5.143 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1cnc2c(C)cccn12 741466899 GUAQWGDEVRKAEU-KTKRTIGZSA-N 377.444 5.110 30 20 GKED C[C@@H](NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1cccc(C#N)c1 744381926 MERWDZORNYQRLB-SSDOTTSWSA-N 389.069 5.058 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c[nH]c2c1 744463014 WIHVVVJAYANUMG-DEOSSOPVSA-N 393.490 5.703 30 20 GKED COc1cc(C=NNc2cccc3ccccc23)ccc1OCc1ccncc1 747060189 KXDSHAARRZIDNB-UHFFFAOYSA-N 383.451 5.268 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1)c1ccccc1 747987328 BXTUTNGSZDDWAU-NRFANRHFSA-N 386.499 5.102 30 20 GKED C[C@@H](OC(=O)/C=C/c1ccccc1C#N)c1ccc(NC(=O)c2ccccc2)cc1 748015417 SRYGWIHERYTQEZ-IYICPGQYSA-N 396.446 5.128 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1 753144969 SFVWWQQUHCQGLZ-YPKPFQOOSA-N 398.487 5.777 30 20 GKED C#CC[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 757059423 VQFQZJFAHQTEHT-FPOVZHCZSA-N 378.472 5.040 30 20 GKED C=CC[C@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccncc1 766019874 NOWFMWLHWJJCQV-RBUKOAKNSA-N 379.504 5.629 30 20 GKED C=CC[C@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccncc1 769109719 QMCNVXVMWNSXQE-DEOSSOPVSA-N 398.510 5.135 30 20 GKED N#C[C@H](C(=O)Cc1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 772641203 QKBZMIFJJPTXHA-CYBMUJFWSA-N 377.252 5.129 30 20 GKED N#C[C@H](C(=O)CCCCCc1ccc(F)cc1)c1nc2ccccc2n1C(F)F 778608238 YJMSEJLFBASUKN-QGZVFWFLSA-N 399.416 5.550 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 779459780 UTOREBNFNDMOOH-UHFFFAOYSA-N 394.085 5.159 30 20 GKED C#CCCCCCC(=O)Nc1cc(C(=O)N(C)c2ccccc2)ccc1Cl 779957430 BDYYIDDXWQBWCG-UHFFFAOYSA-N 382.891 5.139 30 20 GKED CC1(C#N)CCN(C(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)CC1 781027860 ZPZZVEBTEHJCRG-XSFVSMFZSA-N 382.866 5.172 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cccc2cccc(Br)c12 803083946 NDYOAFCJDUVQMT-ZDUSSCGKSA-N 395.256 5.145 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1cc(C#N)ccc1Cl 803832688 HBIQIRSFAMBLPH-UHFFFAOYSA-N 398.890 5.254 30 20 GKED C[C@@H](O)c1cc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)ccc1F 804803723 RVGWVPKDIVWHBB-CQSZACIVSA-N 392.455 5.154 30 20 GKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccn1 810530688 CORHWSDNVYXSEY-QZTJIDSGSA-N 375.497 5.274 30 20 GKED N#Cc1c(F)cccc1/C=C(\Br)c1ncc(-c2ccc(F)cc2)o1 811687842 JTRDLCPPBHSXPS-NVNXTCNLSA-N 387.183 5.384 30 20 GKED CC(C)[C@@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1 813216216 PAXXWIYFZOPKDA-NVXWUHKLSA-N 380.797 5.370 30 20 GKED C[C@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccc(N2CCCOC2=O)cc1 814263692 QLKGVRRMOYZQAF-ZDUSSCGKSA-N 389.377 5.097 30 20 GKED N#Cc1ccc(C2(c3nc(-c4ccccc4OCc4ccccc4)no3)CC2)cc1 904463179 FBNFJRXYZANPQK-UHFFFAOYSA-N 393.446 5.267 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCSc2ccccc2F)cc1 915179374 CZWPVHVNRLTTLQ-FQEVSTJZSA-N 390.483 5.602 30 20 GKED Cc1ccc(/C=C/C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(Br)c1 916849135 POSFGAHEUJEBQG-KAMXEHQASA-N 391.268 5.195 30 20 GKED C[C@H](/N=C\c1cc2ccccc2nc1O)c1cccc(OCc2ccccn2)c1 917559583 PSZBKHQDGRKQGD-QVMKDISWSA-N 383.451 5.095 30 20 GKED CCc1ccc(C=NOCc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1 920399212 NHFRGNAQDZURAV-UHFFFAOYSA-N 376.243 5.157 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 920792508 SBKKZIRZRFXEMK-HZMBPMFUSA-N 379.312 5.729 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(Cl)ccc1Cl 1776354830 ZEPWWECNNFDEOI-CLTKARDFSA-N 379.239 5.375 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 1776473546 PIMPVYZRCXZYKM-OFSNVTPPSA-N 398.764 5.107 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776816384 CKLCBFAGPAGQAE-VQHVLOKHSA-N 384.428 5.424 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccccc1-c1ccccc1C#N 49766382 ZRBPDKTVRCZDMV-UHFFFAOYSA-N 397.478 5.381 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 113656886 FLNJPUSIPOIWNT-SUMWQHHRSA-N 390.455 5.002 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2cc(Cl)ccc2o1 121085801 OJTKODOLUPTRMI-HNNXBMFYSA-N 376.799 5.081 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3cccc(OCCCC#N)c3)o2)cc1C 130025075 FRCPPWVNNWRPNQ-QGZVFWFLSA-N 376.460 5.209 30 20 GKED CN(C(=O)c1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1)c1ccccc1 157634467 REZQYEZXIIVFTB-UHFFFAOYSA-N 397.478 5.017 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2Cc3ccccc3-c3ccccc3C2)cc1 171150138 KPKNKFRJAYNIPH-UHFFFAOYSA-N 381.479 5.702 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 174346720 KOGRERZKXQOWBN-IBGZPJMESA-N 396.494 5.079 30 20 GKED CCCO[C@@H]1CCCN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)CC1 175605415 MHSQCKZSTGBTMM-HXUWFJFHSA-N 394.540 5.131 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)c1 176017880 UXDADRCORWRRFQ-UHFFFAOYSA-N 395.871 5.395 30 20 GKED CCS[C@H]1CCC[C@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 178056570 AXYQQLBWNYRWKO-CTNGQTDRSA-N 396.581 5.255 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 178844094 HRABVNGPKSLNSE-ZBFHGGJFSA-N 399.466 5.177 30 20 GKED C=C[C@H](CC(=O)N[C@@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 178960308 NJXVUOBLMBNDRC-RBUKOAKNSA-N 393.531 5.097 30 20 GKED N#C[C@@H](C(=O)c1cccc2ncccc12)c1nc(-c2ccc(Cl)cc2)cs1 181041494 BXDIJHUYHWEWHY-KRWDZBQOSA-N 389.867 5.502 30 20 GKED C=C(C)[C@H](N[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 187786322 YZLHUYKJJBUYOS-SGTLLEGYSA-N 398.375 5.218 30 20 GKED CCOC1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 292494293 BPECSENXTFXVMW-UHFFFAOYSA-N 393.487 5.082 30 20 GKED COc1cccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 302914685 UUKFLNVSIDDUFC-GOSISDBHSA-N 396.899 5.281 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 303214791 PZHYRKZWLQWSBO-UHFFFAOYSA-N 396.343 5.519 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 304120801 ZZUASGWFIKBOEL-WOJBJXKFSA-N 385.294 5.183 30 20 GKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)[C@@H]1CCC[C@H](C(F)(F)F)C1)C(O)=N2 329014218 FQSULSLCQAXISR-ILXRZTDVSA-N 382.426 5.650 30 20 GKED C[C@@H](NCc1ccc(C#N)s1)c1ccc(Br)cc1C(F)(F)F 421848814 APEFNRMAEGJBST-SECBINFHSA-N 389.240 5.252 30 20 GKED Cc1nc(C)n(Cc2cccc(NCc3ccc(-c4ccccc4C#N)cc3)c2)n1 425934760 AJHLRSHFPODWGD-UHFFFAOYSA-N 393.494 5.094 30 20 GKED C=CCSc1ccccc1C(=O)NCc1nc(-c2ccccc2F)cs1 428549648 PWCZNEDPTRKAJM-UHFFFAOYSA-N 384.501 5.157 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccccc1 429001504 YKVKQCKMNMQTEJ-FQEVSTJZSA-N 383.923 5.332 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@H](CCCC#N)c1ccccc1 431845426 OIMLMWAEMWRALG-UXHICEINSA-N 379.504 5.336 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)c2)o1 432991044 IJFPNMNPMUFNIE-GMAHTHKFSA-N 399.494 5.867 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 433314263 YUJOEFPZHKFINI-NQIIRXRSSA-N 394.927 5.380 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)CC1 433827104 VYNUGBUUPBUEMK-UHFFFAOYSA-N 388.298 5.818 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 436354177 VLPODEWBIKOUPM-RPVQJOFSSA-N 385.920 5.269 30 20 GKED CN(Cc1c(F)cccc1Cl)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438634623 IYFXZPVJNRUCQZ-UHFFFAOYSA-N 385.748 5.033 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3ccc(C#N)cc3C)c(C)c2)n1 438909493 DDOOAHMJBNBIGA-UHFFFAOYSA-N 379.510 5.344 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCCO1 439357083 XEZRCMNHOAOYFJ-QGZVFWFLSA-N 399.878 5.037 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(CC(C)(C)CCC#N)C2)n1 447067876 JRSVBXFGGOZMBY-QGZVFWFLSA-N 383.561 5.328 30 20 GKED COCc1ccc([C@H]2CCCN2c2c(C#N)cnc3ccc(C(C)C)cc23)o1 447678434 ZUMPGWOOSODHLX-OAQYLSRUSA-N 375.472 5.311 30 20 GKED N#Cc1cccc(COc2cccc(NCc3csc(Br)c3)c2)c1 462221160 IHMLJTWZOCNXHG-UHFFFAOYSA-N 399.313 5.573 30 20 GKED CC(C)(C#N)CCSc1nc2cc(Cl)ccc2c(=O)n1C1CCCCC1 463034222 MIRIEHMMDHOXBG-UHFFFAOYSA-N 389.952 5.587 30 20 GKED C=CCCCN(C)C(=O)N[C@H](c1cccc(SC)c1)c1cc(F)ccc1F 466238207 CNLHTQKLGDBTHC-HXUWFJFHSA-N 390.499 5.384 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C 467929579 JTJKCPSDMYEHKO-UHFFFAOYSA-N 394.515 5.181 30 20 GKED C[C@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)Cc1cccc(F)c1 470834226 ZXUXDTNBMRPCEY-KRWDZBQOSA-N 376.431 5.092 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-c4ccccc4)[nH]3)n2)cc1 477793606 PDZMLOVDADJJAL-SFHVURJKSA-N 383.476 5.604 30 20 GKED C[C@@H]1CCN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@H](c2ccco2)C1 480558494 BHHXHKITILBCAG-GCJKJVERSA-N 385.467 5.080 30 20 GKED COCCSc1ccc([C@@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)cc1 481642362 HXATUZTWIWAOOS-HXOBKFHXSA-N 380.557 5.415 30 20 GKED C[C@H](SCc1ccc(Cl)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 483302034 VSIYPDSRLFYNPO-AWEZNQCLSA-N 376.884 5.048 30 20 GKED C=CCn1c(SC(c2ccccc2)c2ccccc2)nnc1-c1ccccn1 488911877 GEZRRUUHJHFQMZ-UHFFFAOYSA-N 384.508 5.408 30 20 GKED CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H](C)c1cc2ccccc2o1 507667145 AUCSGLMCHDKETB-KRWDZBQOSA-N 389.499 6.239 30 20 GKED C[C@H](NC(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21)c1ccc(C#N)cc1 509904784 KZLIVWQPIIRDFU-GAJHUEQPSA-N 397.478 5.109 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1nc(-c2ccccn2)cs1 511828872 ZYSAFNFQPRPVEW-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC(c2noc3cc(F)ccc23)CC1 514892624 GNTPQRIRHBJDNH-UHFFFAOYSA-N 377.463 5.148 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)sc2c1CCC2 518073760 FZMCYJWYUVWASV-STQMWFEESA-N 377.296 5.157 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2ccc(C#N)s2)nc1-c1ccccc1 530675843 XLCOYCJDNJIWOK-QGZVFWFLSA-N 391.496 5.375 30 20 GKED C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NCCCC(C)(C)C#N 532412866 BETUWHOZPDPZMO-HOTGVXAUSA-N 375.944 5.485 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H]1CCCC[C@H]1C(C)(C)C 533512424 LDVYQGADUVWWDN-KURKYZTESA-N 387.593 5.214 30 20 GKED N#CCc1ccc(C(=O)N(c2cc3c(cc2Cl)OCO3)C2CCCCC2)cc1 538859458 HBYXFABKNXVBIF-UHFFFAOYSA-N 396.874 5.114 30 20 GKED C[C@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 541017368 BQODJODSOGAIRX-AWEZNQCLSA-N 387.936 5.465 30 20 GKED CC(C)(C)c1n[nH]cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 549376443 LTRSYXLMOXYYEE-QGZVFWFLSA-N 392.890 5.268 30 20 GKED Cc1nnc(SCc2ccc(C#N)cc2OC(F)F)n1[C@@H]1CCC[C@@H](C)C1 569110821 ONDZXWAQLHUZKQ-MLGOLLRUSA-N 392.475 5.103 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 570706880 ZOENYMLGHIMUNW-ZEQRLZLVSA-N 387.527 5.326 30 20 GKED COC(=O)[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc(Cl)c1 583405019 VBIMSMNWRUDHSP-OAQYLSRUSA-N 392.842 5.330 30 20 GKED COc1cc(CN[C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)ccc1C#N 583964449 LWFPCWHIBJKGBI-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED C[C@H](c1ccccc1)n1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cn1 592025100 IGRMTCXNZCBACX-XMSQKQJNSA-N 387.487 5.049 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@H]1CCc2ccccc21 596735343 YDBKRJLVIUMDKJ-FUHWJXTLSA-N 379.529 5.132 30 20 GKED N#CC1(CC(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)CCCCC1 596830815 DRYCCRGWDKXYQY-UHFFFAOYSA-N 385.895 5.051 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NC(=O)CC2(C#N)CCCCC2)cc1Cl 596855753 WCJHPJYIKWLNIU-UHFFFAOYSA-N 389.927 5.061 30 20 GKED Cc1csc(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1C#N 596905368 RLSNCFBKXRAPHL-UHFFFAOYSA-N 387.349 5.103 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)s2)C1 597911847 CVDLBIIJKYRTRH-CYBMUJFWSA-N 394.418 5.080 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N3CCC[C@H](CC#N)C3)c2)c(C)c1 597918402 NOULZYPFPJGBGO-LJQANCHMSA-N 378.541 5.362 30 20 GKED N#CCCC[C@H](NC(=O)NCc1ccccc1CC(F)(F)F)c1ccccc1 599242935 DSBUCRYYBWBRTB-IBGZPJMESA-N 389.421 5.026 30 20 GKED N#CCc1cccc2c1CCN(C(=O)Nc1ccccc1SC1CCCC1)C2 599723199 KDWXNLWLOLKTGC-UHFFFAOYSA-N 391.540 5.378 30 20 GKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccc(Br)cc1 609825476 AAUYJELKIPVWHV-CHWSQXEVSA-N 389.318 5.142 30 20 GKED N#Cc1cccc(N[C@H](c2ccccc2)c2ccc(Br)cc2F)n1 609894806 YNVLVKHQUGIVSH-LJQANCHMSA-N 382.236 5.056 30 20 GKED Cc1cccc2c(CCC(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)c[nH]c12 610168032 LGFGIQNATXMPGS-UHFFFAOYSA-N 386.480 5.043 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2cccc(F)c2o1 610223962 WELVVWMMAGSCRY-UHFFFAOYSA-N 387.370 5.192 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1cc(F)c(Cl)cc1Cl 610345424 JHGBSOHZGGXMOM-MNOVXSKESA-N 380.250 5.126 30 20 GKED C[C@H](C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1C(F)(F)F 610388460 SBSQHZKWNYFQTP-JTQLQIEISA-N 386.295 5.338 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 610811661 HABFNLQTCCQDKP-CYBMUJFWSA-N 381.432 5.185 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(C(F)(F)C(F)(F)F)cc3)cc2)CC1 611470059 CIJXTWDHZNAESH-UHFFFAOYSA-N 380.316 5.148 30 20 GKED N#C[C@H](C(=O)c1c(-n2cccc2)sc2c1CCCC2)c1nc2ccccc2o1 614439908 WUZQJKHIRYTHEK-OAHLLOKOSA-N 387.464 5.049 30 20 GKED COc1cccc([C@H](CNc2ccc(C#N)cc2)c2c[nH]c3ccccc23)c1OC 619510908 KMYZOOHDLXHYFH-QFIPXVFZSA-N 397.478 5.301 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCC=C(F)C1 646439109 ATBFEMGAHGPAKL-UHFFFAOYSA-N 388.258 5.067 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccco2)s1)c1nc(-c2ccncc2)cs1 675917774 DKTMWEWXLONEKF-ZDUSSCGKSA-N 377.450 5.017 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2sc3cc(C(C)C)ccc3c2Cl)nc(C)n1 732708042 JZQQEFYLAFQFAW-HNNXBMFYSA-N 383.904 5.575 30 20 GKED C/C(=C/C(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 733259098 RBWYKPLVJYAQRM-LUJNMSEFSA-N 378.781 5.143 30 20 GKED O=C1/C(=C/c2ccc3ncccc3c2)CCOc2c(Br)cccc21 733748849 KSYDXQREEAIYCI-NTCAYCPXSA-N 380.241 5.046 30 20 GKED CCCCN(C(=O)NCc1ccc(OCC#N)cc1)[C@@H](CC)c1ccccc1 734169189 OXDWOZKCFUYDJA-QFIPXVFZSA-N 379.504 5.052 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccc(CC(C)C)cc1)C1CC1)c1ccncc1 734666623 ZRCYDBLFZJQLCY-XZOQPEGZSA-N 377.532 5.348 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CSc3ccc(C(C)(C)C)cc3)[nH]c12 735789111 KAVIUWYUNWWACP-KRWDZBQOSA-N 377.513 5.137 30 20 GKED CCOc1ccccc1NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c1ccc(C(C)C)cc1 739154307 ITILRILQSSGEKN-YLJYHZDGSA-N 392.499 5.050 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1C(=O)/C=C\c1ccc(OCC(F)F)cc1 741841556 CBXVJKXWYQOEBL-RAXLEYEMSA-N 382.410 5.029 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(N(C)CCC#N)cc2)cc1 742376517 VVVUCODJSVOHBY-HXUWFJFHSA-N 399.538 5.563 30 20 GKED COc1ccccc1[C@@H](C)S[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1 742455091 JRQHUARWCKLSNX-MSOLQXFVSA-N 382.529 5.133 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 742537427 JRTRVKMOAOXTJP-KXBFYZLASA-N 391.496 5.148 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@H]2Cc2ccccc2)cc1 743096036 OAIFXDYWYBLJMA-GMKZXUHWSA-N 381.479 5.095 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1ccc2ccccc2n1 743443502 URHFLMOWYIQXIA-OAHLLOKOSA-N 399.277 5.577 30 20 GKED CC(=O)Nc1ccc(/C=C\c2cc(Cl)n3c(nc4ccccc43)c2C#N)cc1 747090370 MDHYJXIOEJWXEA-TWGQIWQCSA-N 386.842 5.141 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCOc2ccc(Cl)cc2Cl)n1 747198220 VOBRGPJDFIOIDB-CYBMUJFWSA-N 397.327 5.609 30 20 GKED C=CCc1cc(OCC)cc(CN(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c1O 747806083 PKZMIYBYBNCACT-SQJMNOBHSA-N 395.543 5.119 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1nc(-c2ccccc2)cs1 753145146 WCYUMQPHIDPPMD-MDZDMXLPSA-N 375.478 5.225 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cc(Cl)ccc1OC[C@@H]1CCCO1 754710624 VLRKSEDQFAZRAP-HNNXBMFYSA-N 399.796 5.330 30 20 GKED C[C@@H](CC(=O)OCCC(C#N)(c1ccccc1)c1ccccc1)c1ccncc1 754950065 USWMPPGMHHCIGO-FQEVSTJZSA-N 384.479 5.018 30 20 GKED Cc1csc([C@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 755755739 IZGLKPUVYLJERR-FOIQADDNSA-N 390.512 5.032 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1 761515321 LOXJXXKFVDOSTE-UHFFFAOYSA-N 397.450 5.617 30 20 GKED CCOc1ccc(C(=O)/C=C\c2ncc(-c3ccccc3)s2)cc1[N+](=O)[O-] 770576503 YKUPIFXPWBEVHZ-LUAWRHEFSA-N 380.425 5.013 30 20 GKED C=C(C)[C@@H](NC(=S)Nc1ccc(OC(F)F)cc1)c1ccc(F)c(F)c1 774205685 MGYGLMIPHSUJRI-MRXNPFEDSA-N 384.398 5.170 30 20 GKED C[C@H](NC(=O)Cc1ccccc1CC#N)c1ccc(Oc2ccccc2)c(F)c1 776837753 RVJJYBHRTKQCKH-KRWDZBQOSA-N 388.442 5.104 30 20 GKED COc1cc(/C=C2/CCc3ncc(C(F)(F)F)cc3C2=O)ccc1SC 777468218 PRTPGRARMARKQQ-GHXNOFRVSA-N 379.403 5.043 30 20 GKED C[C@H](NCc1ccc(C#N)cn1)c1ccc(-c2ccc(Br)cc2)s1 783300178 JPOVIQPKBGHVLR-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccccc1CN(CC)C(=O)OC(C)(C)C 785822526 YWOXPMKWYRUPOX-SFHVURJKSA-N 387.524 5.016 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)C[C@@H](C)c1c[nH]c2ccccc12 786277607 SNIMYOWXESFVEU-KDOFPFPSSA-N 383.451 5.043 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc(Br)cc1Cl)c1ccccc1 792865807 CCLAQIIMCVRYDU-CYBMUJFWSA-N 378.653 5.095 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)[C@H](C)c1nc2ccccc2s1 796750985 KJNJWSMNAPXTAB-BQFCYCMXSA-N 378.497 5.419 30 20 GKED C#CC[C@@H](Cc1ccccc1)NC(=O)c1sc(-c2ccccc2)nc1C(F)F 803520416 LWKCMIATUIPQFO-KRWDZBQOSA-N 396.462 5.112 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)CCCC(=O)c2ccc(Cl)c(Cl)c2)CC1 809090454 MKNKJGOGXAJJEH-OKILXGFUSA-N 382.287 5.220 30 20 GKED Cc1ccc(C(=O)OC[C@H]2CC[C@@H](C#N)CC2)cc1NC(=O)Nc1ccccc1 809092118 XVQUMEVILHWZNI-HDICACEKSA-N 391.471 5.126 30 20 GKED Cc1c(-c2noc([C@@H](CCCC#N)NC(=O)OC(C)(C)C)n2)oc2ccccc12 818418346 SVYDEUYFDRLFRV-OAHLLOKOSA-N 396.447 5.051 30 20 GKED CC(C)(C)OC(=O)CCCCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 847625886 WLFVUOXHKRIYPJ-CYBMUJFWSA-N 392.908 5.028 30 20 GKED C[C@H](c1ccccn1)N(C(=O)CC1(C#N)CCCCC1)c1ccc(N(C)C)cc1 857602398 FRYHYVXMJXIKSQ-LJQANCHMSA-N 390.531 5.106 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1ccc(F)cc1Cl)C(=O)O 900068331 FFBMMYHWTOCPRY-QGZVFWFLSA-N 395.833 5.310 30 20 GKED C=CCN(C(=O)c1cc(-c2ccc(C)s2)nc2c1cnn2C(C)C)C(C)C 914683145 IFMYJAQRUWHSKC-UHFFFAOYSA-N 382.533 5.086 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4cccc(Cl)c4)CC3)n2)cc1 915100378 PJMRCHUTCRNRII-GOSISDBHSA-N 392.911 5.680 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 915293983 VXIKSAPOUQAUBQ-IBGZPJMESA-N 375.497 5.312 30 20 GKED N#CCCn1cc(C=NNc2ncc(C(F)(F)F)cc2Cl)c2ccccc21 916286583 KXAZHTNNMOGHPK-UHFFFAOYSA-N 391.784 5.068 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1cccc([N+](=O)[O-])c1 916312423 WYAUIOWKMXLHDT-UHFFFAOYSA-N 389.440 5.103 30 20 GKED N#C[C@@H](C(=O)CC1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 916904900 KDMYXPOFSDOWLA-IBGZPJMESA-N 376.456 5.097 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccc(Cl)cc2)cc1 916914340 YNYXOJSTXDUXIS-VHNWJRSRSA-N 380.875 5.043 30 20 GKED N#C[C@H](C(=O)CCn1ccc2ccccc21)c1nc2cc(Cl)ccc2s1 917044532 TWZFOEZLEOWQOK-OAHLLOKOSA-N 379.872 5.171 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNc1cccc(F)c1 920383721 JPESZBFWZNQGBS-UHFFFAOYSA-N 377.250 5.132 30 20 GKED Cc1ccc(NCc2c(F)c(F)c(F)c(F)c2F)c(OCC(F)(F)F)c1 920402647 NQEFOIZCZBZOQJ-UHFFFAOYSA-N 385.254 5.244 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ncc(Cl)cc3Cl)s2)c1 1776022001 FTWCCIJJMMTFID-UHFFFAOYSA-N 392.267 5.261 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(Oc2ccccc2)cc1 1776049896 VSHIPHRHIVLRLY-UHFFFAOYSA-N 376.412 5.022 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ccc(C(F)(F)F)cc3)s2)c1 1776052242 STNYIHMLFREHFO-UHFFFAOYSA-N 390.386 5.578 30 20 GKED CCCCCCOc1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 1776788994 LPSKQVCLUGIQRR-JVCJXORTSA-N 378.468 5.484 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1777372613 OBESNOWCLTWDLS-CNRHGSOZSA-N 388.419 5.112 30 20 GKED N#Cc1cccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)c1 11374140 TZGIZNPZIAGZRZ-UHFFFAOYSA-N 386.238 5.091 30 20 GKED C=CCN(CC(=O)N[C@H](c1ccc(C)cc1)c1cccs1)Cc1cccs1 15519173 ITSUQYQYTLNMDC-JOCHJYFZSA-N 396.581 5.012 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1cccc(C)c1 23278404 MRXSSAKVSUWVAJ-HNNXBMFYSA-N 380.473 5.201 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N[C@H](C)c1ccc(C#N)cc1 26123112 PAMNAEYZMQFDIP-GFCCVEGCSA-N 381.888 5.135 30 20 GKED CC(C)OCc1ccccc1CNC(=O)c1ccccc1-c1ccccc1C#N 31342269 XJIARFKDNHJNPG-UHFFFAOYSA-N 384.479 5.080 30 20 GKED Cc1cccc(N/C(S)=C(/C(=O)c2cc(C)c(C)cc2C)[n+]2ccccc2)c1 41466013 YXCJEPVXTOBILP-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2o1)c1nc2cc(C(F)(F)F)ccc2s1 41549247 IGDYIJTZJCMCIT-GFCCVEGCSA-N 386.354 5.551 30 20 GKED Cc1nc(COc2cccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2)cs1 47375832 PCZWFFGNDLDWLG-HXUWFJFHSA-N 399.475 5.069 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1c1ccncc1 56800306 NBWIETIXVOZXMA-QHCPKHFHSA-N 398.466 5.423 30 20 GKED CSCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 66544816 YKBNWMNARIVLDR-SFHVURJKSA-N 389.505 5.035 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccccc1Br 66800498 YGHYINNBQPWZIK-LBPRGKRZSA-N 375.291 5.096 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1ccccc1Cl 66956265 GLUCLZGVCJTYFF-GJZGRUSLSA-N 387.936 5.959 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)c3ccc4[nH]c(C(F)F)nc4c3)cc2)cc1 110647198 FGUPBYAZBOGVNH-UHFFFAOYSA-N 389.361 5.258 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCc2ccccc2C1 114580467 UYOVFAKCFVNQJD-VQIMIIECSA-N 379.529 5.102 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc(Cl)c2)cc1 116525375 FYLUGOKIWVEUPP-UHFFFAOYSA-N 378.815 5.265 30 20 GKED COCCC1(CNC(=O)c2ccccc2Sc2ccccc2C#N)CCCC1 133304752 MCESRFFCWCCOAH-UHFFFAOYSA-N 394.540 5.036 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccccc1 155267663 BGRFZTJPIMPPLR-HXUWFJFHSA-N 397.906 5.061 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H](C)c2ccccc2C(F)(F)F)n1 177765247 DZXSWCGPDQERDR-GXTWGEPZSA-N 380.435 5.655 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1cccc(C[S@@](=O)Cc2ccccc2)c1 179634608 BROSCYGIGQPPOF-MYUZEXMDSA-N 384.545 5.002 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 180055279 TVVXONQCKGUBOD-HRAATJIYSA-N 388.471 5.218 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](NC(C)=O)c1ccc(Cl)cc1 189910096 TVEBTDBUHSFHMP-NRFANRHFSA-N 398.934 5.398 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 195562649 ZMIIHMNGOZUZSI-AWEZNQCLSA-N 394.824 5.113 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@]2(C)[C@@H](C1)C2(F)F 292720404 UMUVBRPQCRSCJP-TZIWHRDSSA-N 397.425 5.168 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1 303713227 QGZVQFSXKDIZIY-HXPMCKFVSA-N 379.262 5.139 30 20 GKED COc1ccc2c(c1)CCC[C@H]2C/C(O)=N/C1(c2noc(C3CC3)n2)CCCC1 330093128 RHXVCRWORUNDED-KRWDZBQOSA-N 395.503 5.192 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)Nc3ccc(Cl)cc3CC#N)c12 410967816 MPKNKOQMWPTXKM-UHFFFAOYSA-N 394.862 5.024 30 20 GKED N#C[C@@H]1CC[C@@H](NCCc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1 442774451 AJQOPHGNNHLQHD-DYESRHJHSA-N 390.918 5.017 30 20 GKED C=CCOc1ccc(CNC2(c3cccc(C(F)(F)F)c3)CCOCC2)cc1 446828881 AJQYZQIBYDCGSB-UHFFFAOYSA-N 391.433 5.066 30 20 GKED COc1ccc(C[C@H](Nc2ncc(C#N)cc2Cl)c2ccc(OC)cc2)cc1 462915979 AGNOPRBSCBEFHF-NRFANRHFSA-N 393.874 5.020 30 20 GKED Cc1cc2cc(C(=O)Nc3ncc(Cc4ccc(C#N)cc4)s3)oc2cc1C 463135976 GXVUPPFWZFYPJB-UHFFFAOYSA-N 387.464 5.221 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCC[C@@H](C)c1ccc(OC)cc1 466035750 OAJCYTTVFJHQLW-OAHLLOKOSA-N 392.952 5.302 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 466390839 FBVRJONORFMDNS-RBUKOAKNSA-N 381.520 5.666 30 20 GKED Cc1c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)ccc(C(F)(F)F)c1F 468519630 UABIFCQPFNREMM-UHFFFAOYSA-N 399.228 5.110 30 20 GKED C=C(C)CN(CC)C(=O)CN1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 471181223 KOVDTZBWEUGZOU-FQEVSTJZSA-N 395.547 5.027 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)cc1C#N 472369847 OQRGEUWIOFGKMX-UHFFFAOYSA-N 382.769 5.270 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)C(c1ccccc1)c1ccccc1 474791212 QXXKJIXBLPQHRI-RDPSFJRHSA-N 382.507 5.411 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)Sc1ccccn1 474929917 PKXZDVQHWOLGNE-INIZCTEOSA-N 389.480 5.173 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1ccc(C(C)(C)C#N)cc1 479675375 KEQDXHWTKUBHQB-UHFFFAOYSA-N 379.847 5.357 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)o2)c1 483200256 KYJASNUYLFRTHF-SFHVURJKSA-N 381.435 5.503 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCCSC2)cc1Cl 483473081 TVFFZPVYFCQABO-FUHWJXTLSA-N 385.920 5.013 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@H](CCCC#N)c3ccccc3)s2)o1 487606874 VPRCQWVOCMLWTG-QGZVFWFLSA-N 379.485 5.185 30 20 GKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1nc(-c2ccccc2)no1 489713305 WYCVYSXRJUWZHQ-KRWDZBQOSA-N 396.450 5.360 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CCCc3cccs3)c2)cc1 501443328 LYOYQAPVQCMXGR-UHFFFAOYSA-N 390.508 5.355 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(N)cc1Cl 502133925 RUIOSLDHALDLTA-LBPRGKRZSA-N 391.949 5.047 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1cc2cccc(F)c2o1 503115967 JWYZZMVMOQZTBZ-MRXNPFEDSA-N 398.482 5.198 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)N3CC=C(c4ccc(C#N)cc4)CC3)c2c1 503857570 NOUQTVSLAGZVIF-UHFFFAOYSA-N 393.490 5.222 30 20 GKED C[C@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccccc1C(F)(F)F 504012829 KBYMKIBJWKLHJF-MRXNPFEDSA-N 398.428 5.387 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)c1nc(-c2ccc(Cl)cc2)cs1 505445533 YTONUMQWAJXCKX-HNNXBMFYSA-N 388.279 5.363 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 507605250 MZSANLPFDYGUPX-AWEZNQCLSA-N 394.290 5.660 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)Cc1nc(-c2ccccc2Cl)cs1 512200639 XAPSWKYNJZPTCT-UHFFFAOYSA-N 388.920 5.127 30 20 GKED COc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(C#N)cc2F)cc1 512637184 SJTBIOFHRKVZRU-INIZCTEOSA-N 376.431 5.349 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](Nc4ccccc4)C3)cc2)cc1 517111672 DPENREJOHAKFJP-OAQYLSRUSA-N 398.466 5.069 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1SCCC#N 518121142 STUQXQDZNHHIGE-GFCCVEGCSA-N 395.311 5.405 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(-c3ccc4c(c3)CCO4)cc2)c1 518280230 VZNHDZBWERINIU-UHFFFAOYSA-N 398.506 5.261 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1ccc(Cl)c(Cl)c1 518319965 FCCIGSRCULNXFE-CPUCHLNUSA-N 379.674 5.131 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N[C@@H](c3ccccc3)C3CCC3)o2)cc1 520532462 VZPNAPQKJFYBFK-QHCPKHFHSA-N 386.451 5.001 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H](c3ccccc3)[C@H]3CCCO3)c2)c1 520962578 JCAWCAMGUMGGHE-CLJLJLNGSA-N 398.506 5.147 30 20 GKED N#Cc1c(NC(=O)Cc2c[nH]c3cc(Cl)ccc23)sc2c1CCCCC2 524100547 RQISOMJUQBJZJT-UHFFFAOYSA-N 383.904 5.205 30 20 GKED Cc1sc(CNc2c(C#N)nnc3ccccc23)nc1-c1ccc(Cl)cc1 524846547 DZDHHSAOBLPLJL-UHFFFAOYSA-N 391.887 5.199 30 20 GKED C=CC[C@H](C)[C@H](C)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 532238997 KXTWQFDIRQLDPO-CKJXQJPGSA-N 391.964 5.023 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2ccc(C#N)c(F)c2)ccc1OC1CCCC1 537406047 BCNXUOYRKPNRQR-HOTGVXAUSA-N 382.479 5.439 30 20 GKED C=C[C@@H](Cc1nc(Cc2ccc(OCc3ccncc3)cc2)no1)c1ccccc1 544965568 CSRCMXIAKVKUBG-NRFANRHFSA-N 397.478 5.147 30 20 GKED CC(=O)c1cc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)ccc1F 552626155 KUTCFTSWSGOFKO-UHFFFAOYSA-N 392.361 5.084 30 20 GKED CC(C)(CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(F)(F)F 554877793 QVJLINOZCCCOGR-UHFFFAOYSA-N 377.366 5.061 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC=C(c4ccncc4)C3)cc2)cc1 562128233 QVSSJKZINTVXRZ-UHFFFAOYSA-N 396.450 5.067 30 20 GKED Cc1onc(C2CC2)c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 562808330 COAXRFISQSYJPW-AWEZNQCLSA-N 383.860 5.127 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1 568903033 CHXNVLLVORBVPW-UHFFFAOYSA-N 396.516 5.065 30 20 GKED Cc1ccc(NC(=O)C[C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 574588776 AWHGRFBAMMCZIA-UWJYYQICSA-N 383.923 5.390 30 20 GKED CC(C)c1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1ccccc1 579427331 DDGORGMOOUOKAV-MRXNPFEDSA-N 392.528 5.240 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1c(F)cc(F)cc1F 581029205 SPBDXDCOBPRNMT-LLVKDONJSA-N 396.459 5.086 30 20 GKED C[C@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)c1ccc(C#N)cc1 582539200 YVAWIUSUCLKMKO-HNNXBMFYSA-N 375.497 5.237 30 20 GKED N#CC[C@H]1CCCN(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)C1 596101167 CTOKQVSHEKVQIO-GGAORHGYSA-N 375.516 5.086 30 20 GKED C[C@H](Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cccc(C#N)c1 600849359 OSROKDPQFAFJIK-ZDUSSCGKSA-N 384.266 6.225 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@H](C)c3ccc(C#N)cc3)cs2)cc1 603521295 RSNBRKUVJLXAJK-MRXNPFEDSA-N 389.524 5.225 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)cc1 603656260 BTAGNJFTHKYRQZ-HXUWFJFHSA-N 393.487 5.599 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603689209 CGBTZEWXOPOXJF-UHFFFAOYSA-N 392.846 5.063 30 20 GKED CCN(C[C@H](C)C#N)C(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1 603900325 CALMSFOJPXOJMX-IERDGZPVSA-N 386.948 5.171 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4sccc4s3)cn2)c1 604234702 FDXXZSXESZXDNU-UHFFFAOYSA-N 377.450 5.274 30 20 GKED C[C@H](NC(=O)c1occc1COc1cccc(C#N)c1)c1cccc2ccccc12 608802440 HVJVWJBFLZTHBA-KRWDZBQOSA-N 396.446 5.374 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccccc1SCCC#N 609378733 IOSYSMCKOYWFKV-UHFFFAOYSA-N 375.497 5.039 30 20 GKED CC(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 612894724 LGYRJXQCQIXTLQ-GOSISDBHSA-N 396.899 5.741 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(Cc3cccc4ccccc34)no2)cc1 615131478 OGWXGVJOLYGQQQ-QFIPXVFZSA-N 380.451 5.027 30 20 GKED Cc1cc(Br)cc2c1[C@@H](NCc1ccc(C#N)c(Cl)c1)CC2 619755765 RWUFUVBVOXXYDA-KRWDZBQOSA-N 375.697 5.060 30 20 GKED C=CC[C@H]1CCN(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)C1 626544081 FUFONMLHAXAOMF-LBPRGKRZSA-N 393.274 5.006 30 20 GKED CCCN(CC(F)(F)F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 642283588 AGEMPKUKRCGGBG-UHFFFAOYSA-N 381.238 5.139 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2ncc(Cl)s2)cc1)C(F)(F)F 647229821 IFFGFUBTEDEHHQ-UHFFFAOYSA-N 392.727 5.698 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 661115526 SWLVLRXEJYIFOM-KNQAVFIVSA-N 397.588 5.669 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCC(F)(F)F)c1nc2cc(F)ccc2s1 677564481 ORWNTMKDMBQJIP-CQSZACIVSA-N 392.377 5.420 30 20 GKED N#Cc1ccc(NN=Cc2c(Cl)cccc2OC(F)F)cc1C(F)(F)F 732924932 OHINLMKFBKZDHR-UHFFFAOYSA-N 389.711 5.278 30 20 GKED C[C@@H]1CCC[C@H](OCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 733053252 ZQRUQGOVKILUMF-XBFCOCLRSA-N 396.434 5.087 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(-c3ccccc3F)o2)ccc1OC 733329637 ILTRQCGQBZSBRK-KRWDZBQOSA-N 394.446 5.065 30 20 GKED C=CC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(C(C)(C)C)cc1)c1ccncc1 734678860 JIAMCPHVFFGPPV-FCHUYYIVSA-N 377.532 5.543 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1cccc(Cl)c1 737323239 QYSKLNMMKTXSKS-AWEZNQCLSA-N 389.307 5.757 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 740535835 PNBJXQQREGBOHS-KBXCAEBGSA-N 380.900 5.752 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(C(C)(C)C)nc2C)cc1OCCCC#N 747361237 IVCZCPNCJPSTIO-NTMALXAHSA-N 398.528 5.336 30 20 GKED C=CCCCC(=O)N1CCC([C@@H]2CCCCCN2C(=O)Nc2ccccc2)CC1 748311876 DOVKZPXXIUCKTN-QFIPXVFZSA-N 397.563 5.058 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)CCc1ccc(Cl)cc1Cl 749361197 UVHZOYBDMOTEHN-UHFFFAOYSA-N 398.293 5.061 30 20 GKED CC1(C)CCCC[C@@H]1CC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 752473876 MTXGERRVGYSQPK-UKRRQHHQSA-N 397.544 5.058 30 20 GKED C#CC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 757761530 NALSHLXIYMOVOH-DNQXCXABSA-N 379.463 5.228 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12 759213687 GPWODGPCCWIFJZ-UPTIQUDWSA-N 388.854 5.244 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNc2cc(C)ccc2F)cs1 759666656 UUTUXSILHBDBRD-UHFFFAOYSA-N 396.491 5.338 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2sccc2Br)S1 764889136 WPLIRAMWDDXCIF-MDWZMJQESA-N 393.331 5.019 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccc3[nH]ccc3c2)cc1 765622482 CNXSNSXALZALGR-ZCHVWDMZSA-N 377.447 5.475 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccccc3SC(F)(F)F)CC2)cc1 767967156 CBCYDGQULFHRDU-UHFFFAOYSA-N 388.414 5.100 30 20 GKED Cc1cc(Cl)cc2c1OCC/C(=C/c1csc(-c3ccccn3)n1)C2=O 768497641 DKKJBYKOWFDRRF-LCYFTJDESA-N 382.872 5.216 30 20 GKED CC(C)c1ncc(/C=C\C(=O)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)s1 771095375 ALPSSIHDROSXPC-PTZVLDCSSA-N 389.492 5.250 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 776746621 DKLOVFJCVPQHPD-UHFFFAOYSA-N 383.476 5.211 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 780451685 WMHPXVFARCXWKZ-SNVBAGLBSA-N 383.757 5.294 30 20 GKED CC(=O)c1cc(F)cc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1O 782523165 IENLPLDUUOTAEI-OAHLLOKOSA-N 388.442 5.123 30 20 GKED COc1ccc(C(=O)/C=C/c2cnc(-c3ccco3)s2)cc1Br 788097045 FTNWZELDZJVILX-AATRIKPKSA-N 390.258 5.070 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1ccccc1 790900784 HRMYKLVFONLLQP-OAQYLSRUSA-N 392.462 5.072 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1cccc(Cl)c1C 795140145 SHKMUSXNCDCLSU-UHFFFAOYSA-N 376.957 5.201 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)C[C@@H]2CCC(F)(F)C2)cc1 797835077 IBYUEKBNHDRYDD-SFHVURJKSA-N 386.417 5.052 30 20 GKED Cc1cc(/C=C\C(=O)OCCCC2(C#N)CCOCC2)c(C)n1C1CCCCC1 800122991 FPZWQKMINPAAHB-KTKRTIGZSA-N 398.547 5.267 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2cccc3[nH]ccc23)cc1 800519607 SCAGRCYAAUZYJM-QHCPKHFHSA-N 394.478 5.188 30 20 GKED Cc1cc2cc(CNC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)ccc2[nH]1 806200742 MFLKUYNGOPXJRY-QHCPKHFHSA-N 394.478 5.454 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1nc(C2CC2)cs1 842940999 MFUBSHCEMSWRKC-RRFJBIMHSA-N 377.296 5.307 30 20 GKED O=C(/C=C\c1cn(C2CCCC2)nc1-c1ccccn1)c1ccc(C(F)F)nc1 853009309 IRZGYBQGMZHONE-LUAWRHEFSA-N 394.425 5.289 30 20 GKED C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915085918 PYNIPJCOMOVJMT-OXQOHEQNSA-N 390.870 5.401 30 20 GKED C=CCN(C(=O)c1cc(-c2ccc(C)cc2)nc2c1cnn2C(C)C)C(C)C 915153381 JBBYQLHKMLMFJA-UHFFFAOYSA-N 376.504 5.024 30 20 GKED FC(F)(F)c1ccccc1C=Nn1cnnc1SCc1ccc(Cl)cc1 916546434 QQABWPZNUSDLTD-UHFFFAOYSA-N 396.825 5.125 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccc(C)cc3)n2)cc1 920140947 DEGBQLHJSHEFEV-HXUWFJFHSA-N 390.508 5.326 30 20 GKED C[C@H]1CN(CCCCC2(C#N)CCC2)[C@H](C)CN1CCCCC1(C#N)CCC1 930069015 HAWSJCGKSVUTHH-SZPZYZBQSA-N 384.612 5.109 30 20 GKED COc1ccc(F)cc1-c1cncc(CN[C@@H](CCCC#N)c2ccccc2)c1 930567629 NFGKIQRAFGKXAI-QHCPKHFHSA-N 389.474 5.421 30 20 GKED O=C(O)c1ccc(NN=C2CCC(c3cccc(C(F)(F)F)c3)CC2)cc1F 1776074911 BHHBODGEZAYYOH-UHFFFAOYSA-N 394.368 5.668 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(N2CCCCC2)cc1 1776354551 PNFMDSNWQUELDF-WQLSENKSSA-N 393.483 5.058 30 20 GKED CC(C)c1cccc2c1OCC/C(=C/c1cc(C(=O)O)c(Cl)s1)C2=O 1776378038 OOWFDSKXCWIBDJ-FLIBITNWSA-N 376.861 5.272 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776697891 XEMURNQOAWJMAO-DVFVSVACSA-N 390.504 6.523 30 20 GKED CCCCCCCOc1ccc(CN[C@H](Cc2ccc(C)c(C)c2)C(=O)O)cc1 1776786475 MGVVYFMQYTVHKK-XMMPIXPASA-N 397.559 5.438 30 20 GKED COc1cc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)ccc1SC(F)F 1777263419 QPQUDOOQUCUJLR-GQCTYLIASA-N 392.423 5.221 30 20 GKED Cc1cccc2c1C(=O)/C(=C/c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2 1777455780 YYVAFQWABLFWFI-RPISRQAYSA-N 384.431 5.022 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1791243588 WGIRHIMNYVCCDU-OAHLLOKOSA-N 396.453 5.065 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2ccc(-c3ccc(F)cc3)o2)S1 16440372 HIELMXNASHJVKQ-XDHOZWIPSA-N 392.455 5.594 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1cccs1)C(=O)c1ccccc1 18064907 QATLJSQTCRUJTM-LTGZKZEYSA-N 389.520 5.778 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 25074692 VMNQOUKEBBPVFA-ZDUSSCGKSA-N 397.849 5.007 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 29151225 KNQODHLWWWLRDR-UHFFFAOYSA-N 395.915 5.825 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2o1)c1nc2cc(C(F)(F)F)ccc2s1 41549249 IGDYIJTZJCMCIT-LBPRGKRZSA-N 386.354 5.551 30 20 GKED N#C[C@@H](C(=O)c1ccc(F)c(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 51656647 UXFKEIBGRQYRAP-JTQLQIEISA-N 382.313 5.083 30 20 GKED COc1ccccc1-c1nc(CSCCOc2cccc(C#N)c2)cs1 60514980 VYTOZWFTWURYSE-UHFFFAOYSA-N 382.510 5.003 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)oc2c(C)cccc12 66544575 WPQPCNPTJIPIIX-GOSISDBHSA-N 397.459 5.535 30 20 GKED COc1ccc2c(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)coc2c1 66801562 MTBQBYFBCAAEEG-AWEZNQCLSA-N 380.469 5.017 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1-c1ccccn1 66856239 FBTFSCXLPDISNV-INIZCTEOSA-N 390.512 5.136 30 20 GKED COc1ccc(CCCN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66953768 DTXFKWQTMQGMNE-QGZVFWFLSA-N 397.544 5.186 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl)c1ccccc1 133350582 NCZNNLSLHKNYKH-INIZCTEOSA-N 384.907 5.119 30 20 GKED C[C@H](SCC(=O)Nc1ccc(CC#N)cc1)c1ccc(OC(F)(F)F)cc1 140395247 OKKNQAKAQXTOFD-ZDUSSCGKSA-N 394.418 5.084 30 20 GKED COc1ccc(CNc2ccc(C)c(-c3nc(C)co3)c2)cc1OCCCC#N 152642832 LRVMHODEFKTHPS-UHFFFAOYSA-N 391.471 5.262 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 173553412 HECGRNLHJXCBMA-UWJYYQICSA-N 380.488 5.009 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)Nc2ccccc2O[C@H](C)C#N)s1 180076327 SXLMOBQGYXEQOW-OAHLLOKOSA-N 395.484 5.175 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccc(F)cc2)cc1 181621770 AQSRCMUNGXRZMZ-MZNJEOGPSA-N 390.458 5.177 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccncc1)c1ccc(F)c(F)c1 185464508 BFVUECLIAMONGQ-VXKWHMMOSA-N 393.437 5.066 30 20 GKED C=CC[C@H](C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl)c1ccccc1 187390688 RPGLDCWCMIOWCK-SFHVURJKSA-N 384.907 5.119 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 248610144 WBXJKNKUHBJAHT-HMFYCAOWSA-N 377.488 5.291 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1)c1nc2ccccc2o1 249705264 MNIDWFCQCZBPOV-BZUAXINKSA-N 399.475 5.364 30 20 GKED Cc1cccc(C(C)C)c1N/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329320320 DXOZFIQJSBODQZ-HXUWFJFHSA-N 380.536 5.834 30 20 GKED N#CCc1ccc(NCc2ccc(OC(F)(F)F)c(Br)c2)cc1 391412372 BBTYXZDLLWLHHM-UHFFFAOYSA-N 385.183 5.026 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1Cl 410022165 PQVPIKUWPLTKKI-QGZVFWFLSA-N 394.689 5.887 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Cl)cc1C(F)(F)F)c1ccccc1 410958190 VMYFPAWOVUCTKL-QGZVFWFLSA-N 380.797 5.524 30 20 GKED C[C@H](c1ccc(Oc2ccccc2)cc1)[S@@](=O)CCCC1(C#N)CCOCC1 417194217 MKZSTEUKISTAPO-GDJIYFAZSA-N 397.540 5.389 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1Cl 425454799 SAYMGHKQELOBBI-QWHCGFSZSA-N 376.287 5.329 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccccc1)c1ccc(F)cc1C(F)(F)F 429020754 NYFFHOQWQPIRKJ-AWEZNQCLSA-N 379.275 5.268 30 20 GKED COc1ccc2ccccc2c1CNC(=O)N[C@@H](CCCC#N)c1ccccc1 431769954 DNKOVUWQPMCPQG-QFIPXVFZSA-N 387.483 5.083 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1OC1CCCC1)c1ccccc1 432678082 FXOUSOGTQWVWJV-HXUWFJFHSA-N 377.488 5.565 30 20 GKED N#CCCC[C@@H](NCCc1cc(Cl)c2c(c1)OCCCO2)c1ccccc1 433028137 NROWWBZGIVWURC-HXUWFJFHSA-N 384.907 5.069 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1cccc(CSc2ccccn2)c1 433346616 GLIJUFFMHGTNAU-FQEVSTJZSA-N 387.508 5.085 30 20 GKED CC[C@H](NC(c1cccc(OC)c1)c1cccc(OC)c1)c1ccc(C#N)cc1 447587313 QWDOJBZOTMBQBJ-DEOSSOPVSA-N 386.495 5.406 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3ccc(CC#N)cc3Cl)c12 452647853 RCPXPGZXBXUSBB-UHFFFAOYSA-N 394.862 5.195 30 20 GKED CCCOc1c(Cl)cc(C(=O)N(CC)c2ccc(C#N)cc2)cc1OCC 461537968 BZCITNNOCWPBPS-UHFFFAOYSA-N 386.879 5.066 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cc(F)ccc2F)cc1Cl 463388600 BUUIENQOMFFQIK-IBGZPJMESA-N 396.824 5.455 30 20 GKED COc1cccc(-c2ccc(CNC(=O)Nc3ccc(C(C)(C)C#N)cc3)cc2)c1 466138408 ZXILLWIVFZPHIG-UHFFFAOYSA-N 399.494 5.485 30 20 GKED C=CC[C@@H]1N(C(=O)c2sc(NC(=O)c3ccco3)cc2C)CCCC1(C)C 470289009 REJYOUZQUQFRJJ-INIZCTEOSA-N 386.517 5.109 30 20 GKED Cc1csc(Nc2ccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)cc2)n1 475761404 JDMZVNIUESCQJB-UHFFFAOYSA-N 376.485 5.249 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1nc(C(C)C)c(C)s1 477985160 CGNAOWNIUPBDHJ-UHFFFAOYSA-N 383.970 5.188 30 20 GKED C=C(C)[C@@H](NCc1cc(-c2ccncc2)ccc1OC)c1ccc(F)c(F)c1 479387000 FDDBKAPBUKPSNU-HSZRJFAPSA-N 380.438 5.442 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cncc(Cl)c3Cl)c2)c1 480847463 ZEGLBPXHKUNLDV-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1CSCc1ccccc1 484290362 LUMOVXFYDWFUGZ-QGZVFWFLSA-N 392.524 5.488 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2cn3c(n2)CCCC3)cc1 486241893 MWIXGQMTZNPFGG-UHFFFAOYSA-N 389.524 5.417 30 20 GKED C=C(C)Cn1c(S[C@H](C)c2ccc(F)c(Cl)c2)nnc1-c1ccncc1 489431678 HCCWPIUORLWQKE-CYBMUJFWSA-N 388.899 5.562 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(COc2ccccc2C#N)o1 495111860 YFMLFMKCVXPMHL-HSZRJFAPSA-N 388.467 5.200 30 20 GKED CC(C)CN(C(=O)Cc1csc(-c2cccc(F)c2)n1)c1ccc(C#N)cc1 499298493 CMTHYTZVMUZFQV-UHFFFAOYSA-N 393.487 5.053 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SC[C@@H]3CCCCO3)n2)o1 504549203 UDIWGLULPXJNNF-LBPRGKRZSA-N 382.407 5.202 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510706666 YGWLORLYVZTCLJ-UHFFFAOYSA-N 389.430 5.196 30 20 GKED N#C[C@H](C(=O)c1ccc(-n2cccc2)c(F)c1)c1nc2cc(Cl)ccc2s1 511700092 KAEDMQQTJZNPKG-CQSZACIVSA-N 395.846 5.370 30 20 GKED N#CCSc1cccc(-c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)c1 512029646 BPYPTJJLLOSHTJ-OAHLLOKOSA-N 393.365 5.430 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 512542078 KEJJXFSDNAFEOY-LJQANCHMSA-N 393.535 5.270 30 20 GKED N#CCc1ccccc1NC(=O)Cc1cccc(OCc2ccccc2Cl)c1 516919396 HVBAKRAZECMDAH-UHFFFAOYSA-N 390.870 5.166 30 20 GKED C[C@@H](CN(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccc1 518910815 XPICFDFGORJXOO-IBGZPJMESA-N 384.479 5.421 30 20 GKED COc1ccc(CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1F 519504356 MAVWUOKOSAMMFN-UHFFFAOYSA-N 390.414 5.070 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1nc(C)cs1 521077086 XSGCOXKMZMUCHF-HXUWFJFHSA-N 391.496 5.191 30 20 GKED CCc1nc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 522085346 DSOPGWXUFFOCNS-AWEZNQCLSA-N 392.484 5.252 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc([C@H](CC)c3ccccc3)o2)c1C 524316741 WOJWBJHMDPFBNP-GOSISDBHSA-N 395.528 5.191 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1nc2c(s1)CCCC2 524824545 YMQNDHDILJJPFJ-QWHCGFSZSA-N 390.911 5.137 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)c2nc(Cc3ccc(Cl)cc3)no2)n1 525046363 XPGZIDQZCQTGKC-ZDUSSCGKSA-N 384.892 5.051 30 20 GKED CC(C)c1cc(Br)ccc1OCc1nnc(-c2cccc(C#N)c2)o1 533676357 JINOXHTVOMAQIQ-UHFFFAOYSA-N 398.260 5.073 30 20 GKED C=CCC[C@H](NCc1cnc([C@@H]2CCCO2)s1)c1ccc(C(F)(F)F)cc1 535184983 ITCXOEBZGAPHII-ROUUACIJSA-N 396.478 5.811 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2scnc2C2CC2)cc1 536487250 XHXPGGVNMMFICE-UHFFFAOYSA-N 377.494 5.296 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCCOc2cc(F)ccc21 539692145 PBEYRUGYAHERFP-QFIPXVFZSA-N 386.426 5.008 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC(CC#N)CC1 541042598 MQBRWYJHBRSBOR-GOSISDBHSA-N 377.488 5.293 30 20 GKED FC(F)(F)c1cc([C@@H](NCc2ccno2)C(F)(F)F)cc(C(F)(F)F)c1 541195008 VYXUYFKJHRTBFX-LLVKDONJSA-N 392.221 5.105 30 20 GKED C[C@H](NC(=O)Nc1cnn(C(C)(C)C)c1)c1ccc(-c2cccc(C#N)c2)cc1 542026452 QBHGPUIMEFJYKX-INIZCTEOSA-N 387.487 5.059 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 542090965 RMTOENYABGELIW-ZWKOTPCHSA-N 384.483 5.084 30 20 GKED N#C[C@H](C(=O)c1ccc(SC2CC2)cc1)c1nc2cc(Cl)ccc2s1 542130814 SPSQJJHKXZHXQQ-OAHLLOKOSA-N 384.913 5.694 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3scnc3C3CCCC3)n2)cc1 546155828 ZGBDZLXDONBFCG-MRXNPFEDSA-N 393.537 5.723 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCCCC2)c1nc(-c2ccccc2)cs1 549192231 UXYZINNQDWVECC-MRXNPFEDSA-N 378.522 5.631 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)NCc2cc(F)c(C#N)c(F)c2)c1 555533775 MWYGSRONYJUKOB-UHFFFAOYSA-N 386.467 5.110 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2cc(Cl)ccc2s1 564511579 WHRYCFXPADXAJC-SECBINFHSA-N 392.292 5.636 30 20 GKED N#CCc1ccc(NC(=O)c2c(F)ccc(SCC3CC3)c2F)c(Cl)c1 574737132 RPXCOBNMCAIIEB-UHFFFAOYSA-N 392.858 5.439 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 588316027 ZTSIGGIAFIHTRO-SFHVURJKSA-N 376.504 5.130 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H](C3CC3)C2)cc1 589000029 ZVUFGBUKMOBRKU-GOSISDBHSA-N 391.471 5.013 30 20 GKED CO[C@]1(C)CCCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CC1 590856110 QWUBDJQXZBVSTJ-JOCHJYFZSA-N 395.528 5.132 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)C1CCC(F)(F)CC1 594070577 KFTKIHYTFMATIM-ZIAGYGMSSA-N 381.492 5.416 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)NC3(c4ccc(C#N)cc4)CCC3)c2)n1 594073152 BKPMCCGOYSTZND-UHFFFAOYSA-N 386.455 5.031 30 20 GKED CC(C)(C#N)c1ccc(CNCc2ccc(COCc3ccccc3)cc2)cc1 594495046 NJVILIYVOVCOGT-UHFFFAOYSA-N 384.523 5.494 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)[C@@H](C)CC#N 597298640 LZOGHBLNZDBVST-HNNXBMFYSA-N 378.451 5.220 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)c(Br)cc1F 599047944 GXKMJQKZBSNHHN-ORAYPTAESA-N 393.275 5.813 30 20 GKED CCN(C(=O)CCCCCc1ccc(OC)cc1)[C@H](C)c1ccc(C#N)cc1 608936131 SATKIVUIJTUETR-LJQANCHMSA-N 378.516 5.279 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)Nc3ccc(CC#N)cc3)cc2)c1 609047397 WUTNYBWMZMCQAB-LJQANCHMSA-N 399.494 5.523 30 20 GKED CCCCS[C@@H](C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 609104255 CJMNQEYPSUZZAM-HNNXBMFYSA-N 386.492 5.137 30 20 GKED Cc1sc(NC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)c(C#N)c1C 609296248 OCYUGOXAZABGOJ-LJQANCHMSA-N 396.512 5.848 30 20 GKED CCCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@@H](C)c1ccccc1 609499706 XVKHPRXSHUBYOE-IBGZPJMESA-N 399.494 5.749 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609682688 WDEMLKGEGCTBBJ-XLIONFOSSA-N 398.466 5.155 30 20 GKED CC(C)(C#N)CCC[S@@](=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 610482357 CYFGHUHZWGVXBS-RUZDIDTESA-N 394.367 6.161 30 20 GKED CO[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 611943035 SLNURWVFWIBNCA-QGZVFWFLSA-N 399.878 5.037 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1CC[C@H](C(F)(F)F)C1 619125464 BAQZGABNYJPYDE-BDAKNGLRSA-N 387.286 5.135 30 20 GKED C=CCN(C(=O)[C@H]1CCCO1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891448 KCURISKKUHFTSS-OAQYLSRUSA-N 390.508 5.175 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)C1CCC(C(F)(F)F)CC1 683443584 SJSVWHDNNHSGMT-UHFFFAOYSA-N 389.286 5.648 30 20 GKED CC(C)[C@@H](C)N1Cc2ccc(N=Cc3cc(Cl)cc([N+](=O)[O-])c3O)cc2C1 726429836 RWOXBKYEUKYPMN-CYBMUJFWSA-N 387.867 5.065 30 20 GKED CCCOc1ccc(C(=O)N(CCC#N)c2ccc(C)cc2)cc1OCCC 726942402 XAOGVVPZCORYET-UHFFFAOYSA-N 380.488 5.133 30 20 GKED O=C(Oc1c(F)c(F)cc(F)c1F)c1cnc2ccccc2c1C(F)(F)F 729889490 RPDDFZKPVJZWMV-UHFFFAOYSA-N 389.226 5.029 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CCCC1)c1nc2cc(F)ccc2s1 730417557 QBRLZEOQRCJLDD-INIZCTEOSA-N 398.890 5.777 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420220 BRCPQMBKYPARQH-INIZCTEOSA-N 382.460 5.123 30 20 GKED Cc1cc(C)cc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)c1 730949450 WODQGVYWTJTVFC-VMPITWQZSA-N 376.408 5.070 30 20 GKED CC(=NNc1nccnc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733080223 HOFYETFMQUKTCF-UHFFFAOYSA-N 382.695 5.004 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 740535869 PNBJXQQREGBOHS-RDTXWAMCSA-N 380.900 5.752 30 20 GKED COc1ccc(C(=O)/C=C\c2c(C)nn(Cc3ccc(Cl)cc3)c2C)c(F)c1 740764546 YDUKUQPYHRMBSS-KHPPLWFESA-N 398.865 5.245 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1nc2ccccc2s1 744016103 JOMCKNHCFZMDMT-QLFBSQMISA-N 387.291 5.583 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1 747108793 SKBYPQYSVZQORJ-BLLLJJGKSA-N 389.282 5.007 30 20 GKED COc1cccc(/C(C)=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 751826178 DMUBTEXSGUCWMX-TUOAVLBBSA-N 388.492 5.407 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cn(C)c4ccccc34)n2)cc1 756231715 NFEQOMCSWQWJSQ-HXUWFJFHSA-N 399.519 5.419 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccccc2)CC1)c1nc(-c2ccc(Cl)cc2)cs1 771260633 JEEHMDGITDFQGG-SFHVURJKSA-N 392.911 5.663 30 20 GKED N#Cc1cc2ccccc2nc1N1CCC(c2nc3cc(Cl)ccc3o2)CC1 774519709 VFXMCCAVMBLYEI-UHFFFAOYSA-N 388.858 5.285 30 20 GKED C=CCCC[C@H](C)NC(=O)c1cc(Cl)c(NC(=O)OC(C)(C)C)cc1OC 775926181 SAQQVKQFXXTBBY-ZDUSSCGKSA-N 396.915 5.170 30 20 GKED CC(C)c1ccc([C@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776154027 LGXNZBWHFVZXCT-UUOWRZLLSA-N 390.552 6.214 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)C(=O)c1ccc(Cl)cc1 777295715 QAYHSOYBXHESIW-IUODEOHRSA-N 382.872 5.035 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)N3CCC(CC#N)CC3)c2cc1C 782056934 WHUSKBJPCZNLCO-UHFFFAOYSA-N 383.495 5.285 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccc(OC(F)(F)F)cc2)n1 796742896 DEZLZMOCSBQOND-RRFJBIMHSA-N 394.418 5.145 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CC1CC(c2ccccc2)C1 798815660 CCSUSXOTZJQYLK-IVXJCAOYSA-N 388.511 5.043 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)Nc1ccccc1SC[C@H](C)C#N 801628308 DWQJHXDYNNUTRW-QGZVFWFLSA-N 397.544 5.478 30 20 GKED Fc1ccccc1-c1nc2c(s1)C(=NNc1nccnc1C1CCC1)CCC2 807991966 WORSOUMGSVSHLD-UHFFFAOYSA-N 393.491 5.159 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H](c2c(Cl)cccc2Cl)C2CC2)c1 809873262 CWZPREFTKKQNSN-GOSISDBHSA-N 390.270 5.169 30 20 GKED Cc1nn(C)c(Cl)c1/C=C/C(=O)c1ccc2ccccc2c1OC(F)F 812488683 FEMSKVUEGLCZBE-MDZDMXLPSA-N 376.790 5.033 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1csc(-c2ccccc2)n1 818246336 SRHHCMDSYXVPEW-OUBUNXTGSA-N 388.448 5.548 30 20 GKED CC(C)c1cccc(CC(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)c1 838786305 HNJBTRQUJQFZPY-INIZCTEOSA-N 389.282 5.007 30 20 GKED Cc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1Cl 839310015 IGFYWTASULSTDG-UHFFFAOYSA-N 377.853 5.040 30 20 GKED N#Cc1ccccc1NC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 856434307 ZWCXRGRLHMPNTG-UHFFFAOYSA-N 383.838 5.679 30 20 GKED CC(=NOCc1coc(-c2ccc(C)cc2)n1)c1nc2ccccc2n1C(F)F 884637425 NDORQLYUJOCZIT-UHFFFAOYSA-N 396.397 5.336 30 20 GKED COc1cc(C=NNc2cccc(Cl)c2C)ccc1OCc1c(C)noc1C 915051185 NSDFWGKQXTUPMD-UHFFFAOYSA-N 399.878 5.287 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915086829 XLGBYHRCVDKPPB-HSZRJFAPSA-N 397.478 5.189 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C\C(=O)c1ccc(OC(F)F)cc1 916137764 UJWUQUOYGRYERL-SEYXRHQNSA-N 382.410 5.046 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1C(C)C 916847628 NEHKHGMBQLFDGK-QAPCUYQASA-N 378.497 5.372 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 917025143 FFHDVGMQIMUTSF-SFHVURJKSA-N 378.522 5.477 30 20 GKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776014294 BPYQPCOLICYRBK-KOLCDFICSA-N 377.699 5.572 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776817233 FBUSAPDEQYFHEP-QBFSEMIESA-N 376.408 5.330 30 20 GKED CSc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)c(Cl)c1 1777403292 LNXFXCHKKGTMHY-KXFIGUGUSA-N 388.897 5.871 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCOc4ccccc4C3=O)s2)cc1 1777671019 SUAMCTSXMCXKKB-SSZFMOIBSA-N 376.433 5.162 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\Cc4c(F)cc(F)cc4C3=O)s2)c1 1777684278 CNUCDXMIXIIABE-NTUHNPAUSA-N 382.387 5.214 30 20 GKED C=CCn1c(SCc2cccc3cccnc23)nc2cc(Cl)ccc2c1=O 10620014 ABYFRNUVGMJCLY-UHFFFAOYSA-N 393.899 5.076 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2cccc(Cl)c2)[n+]2ccccc2)c1 10830952 PPFSMHGCAMKPIX-UHFFFAOYSA-O 395.935 5.295 30 20 GKED N#CCCSc1nnc(-c2ccc(Cl)cc2)n1-c1ccc(Cl)cc1 21123450 FSYNHSLOXYPFJA-UHFFFAOYSA-N 375.284 5.247 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(COc3ccc(F)cc3)o2)cc1 25438369 SEMCYSUZPPLXAO-UHFFFAOYSA-N 378.403 5.051 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 41538456 HJPCLXACIMREOY-LBPRGKRZSA-N 377.252 5.508 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccccc2)cc1)c1nc2ccccc2s1 46442492 LRYVKXHNOSUPOZ-IBGZPJMESA-N 384.460 5.365 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 66953892 YMWJSLBEJOZXHX-MSOLQXFVSA-N 379.529 5.411 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc(-c2ccncc2)cs1 114620815 OUGUCTKMSCBJDF-OAHLLOKOSA-N 389.411 5.094 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 128113879 RGQNKPWCQIPPMV-INIZCTEOSA-N 380.856 5.030 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1c(F)cc(C#N)cc1F 132260922 AGOIDGJGRGLHIZ-HNNXBMFYSA-N 392.405 5.537 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 151290816 SPLAVRRLSSLMQI-NVXWUHKLSA-N 378.501 5.044 30 20 GKED CC[C@@H](SC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156556688 CTCQKXCTZLIRIY-BXUZGUMPSA-N 385.341 5.435 30 20 GKED N#CC1CCN(C(=O)N[C@H](c2ccccc2)c2cc(Cl)ccc2Cl)CC1 182643704 JZVNOCSTIRQFGI-LJQANCHMSA-N 388.298 5.028 30 20 GKED Cc1ccc(-c2nc(C(=O)N(CCC#N)C34CC5CC(CC(C5)C3)C4)cs2)o1 185095796 JOAJPDDANBDDPM-UHFFFAOYSA-N 395.528 5.036 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1cccnc1 185221199 OMNMYGUBXVNOPL-GJYPPUQNSA-N 380.517 5.091 30 20 GKED N#Cc1c(NC(=O)c2ccc(C3SCCCS3)cc2)sc2c1CCC2 194568697 HBZPNCRZSRYMRT-UHFFFAOYSA-N 386.567 5.229 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1cccc(OCCCC#N)c1 237786483 KZNFMFAMUZDRAE-HSZRJFAPSA-N 390.552 5.813 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)cc1 282462635 KIYMRJHBMCOZKF-INIZCTEOSA-N 379.426 5.074 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1ccccc1Cl 303383878 WRKPJNAQIJOZGL-HNNXBMFYSA-N 391.858 5.443 30 20 GKED Cn1c(COc2ccc(Cl)cc2)nnc1SCCC1(C#N)CCCCC1 412985831 UPLMYXCVFSDZDI-UHFFFAOYSA-N 390.940 5.004 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)Nc2ccc(C#N)cc2Cl)s1 426160914 METHQERRVCUXME-UHFFFAOYSA-N 385.876 5.409 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1OC(F)(F)F)c1ccccc1 431704618 ZDDOENZHIWFKIO-HNNXBMFYSA-N 377.366 5.142 30 20 GKED C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438039334 FIQNUPLPKIQXHO-KOSHJBKYSA-N 399.469 5.236 30 20 GKED CC(C)(CC(=O)Nc1ncccc1OCCCC#N)Cc1ccc(Cl)cc1 439110104 XPFNFSYYTZRNDP-UHFFFAOYSA-N 385.895 5.015 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1)c1ccccc1 439313518 KGUQTQFQCSQAFL-FQEVSTJZSA-N 390.418 5.180 30 20 GKED C[C@@H]1CCN(Cc2nnc(-c3cccc(C#N)c3)o2)c2cc(Cl)ccc2S1 440395014 WYPUGPWOWNGRRO-CYBMUJFWSA-N 396.903 5.153 30 20 GKED N#CC1CCC(CNC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)CC1 441003314 XERONMAODXOUJH-ZOJXTTQQSA-N 387.936 5.120 30 20 GKED C[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccc(C#N)cc1 442257314 NFRBYUHYHBZQDG-GFCCVEGCSA-N 384.266 5.351 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 446852185 MVXKTMMWKOVZTD-VGSWGCGISA-N 379.529 5.134 30 20 GKED Cc1cc(CSc2nnc(-c3cccs3)n2Cc2ccco2)ccc1C#N 447312382 METONCZROGIPHN-UHFFFAOYSA-N 392.509 5.120 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(CCCCC(C)(C)C#N)C2)n1 447389539 ZEYDXWXOTOEYPN-SFHVURJKSA-N 397.588 5.718 30 20 GKED CC[C@@H](N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccc(C#N)cc1 447581261 SPRAQKBCPLDKBQ-YCRPNKLZSA-N 391.540 5.801 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458797489 GJIXPGCGJYYOPG-PKTZIBPZSA-N 375.516 5.147 30 20 GKED COCCOc1ccc(C#N)cc1N[C@@H](C)c1csc(-c2ccccc2F)n1 462812505 ZUKVISCPUVMIBB-AWEZNQCLSA-N 397.475 5.019 30 20 GKED COc1ccccc1[C@H](C)SCC(=O)N(CCC#N)c1cc(C)cc(C)c1 463209558 KGVVIWYPZPKPBM-SFHVURJKSA-N 382.529 5.053 30 20 GKED Cc1sc(NC(=O)c2c(F)cccc2Sc2ccccc2)c(C#N)c1C 463620540 ASADPYQSZRVDHS-UHFFFAOYSA-N 382.485 5.779 30 20 GKED N#CCCCOc1cccnc1NC(=O)Nc1ccc(NCC2CCCC2)cc1 466598122 IMAGSFPMKOZICX-UHFFFAOYSA-N 393.491 5.010 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1 474697431 UZTCHVFIDJXCES-UHFFFAOYSA-N 386.417 5.311 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)[C@H](C)C(F)(F)F 477974127 WKXYNWHMTIVNHL-CQSZACIVSA-N 376.378 5.072 30 20 GKED N#C[C@H](C(=O)c1ccccc1NC(=O)c1ccsc1)c1nccc2ccccc12 483192209 GRMVOYBYQZIBJN-IBGZPJMESA-N 397.459 5.039 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)o2)c2ccc(C(F)(F)F)cc2)cc1 486804165 ZMYMENQITQSFHN-FQEVSTJZSA-N 386.373 5.058 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2nccc3ccccc23)c1-c1ccccc1 488714261 UFESPFSXUOZAER-HXUWFJFHSA-N 380.451 5.169 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 488839725 OFKMURGXEQGMSW-MRXNPFEDSA-N 376.378 5.073 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(=Cc2cccc(OC)c2)CC1 505011422 VHHHBZXZVSDUEA-UHFFFAOYSA-N 376.500 5.525 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)Cc2ccc(C#N)cc2)c(C(F)(F)F)c1 505079086 YZPNYPYSMJDJGS-CYBMUJFWSA-N 392.446 5.649 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1cc(Cl)ccc1F 506382602 QNIQABWCBMMUCO-LBPRGKRZSA-N 394.924 5.604 30 20 GKED COc1cc(C)sc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 507291545 NGYTWVBZOXRMNU-CYBMUJFWSA-N 388.901 5.332 30 20 GKED CCN(CCC#N)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 507442634 SMUBPIGSOGTCAK-UHFFFAOYSA-N 396.343 5.157 30 20 GKED C[C@@H](NC(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21)c1ccc(C#N)cc1 509904785 KZLIVWQPIIRDFU-HXOBKFHXSA-N 397.478 5.109 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 514108847 GJFWCKSEQYTSTP-PGRDOPGGSA-N 394.490 5.134 30 20 GKED CCOc1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c(C)c1 521244690 YYLVSEJAAUKHFK-UHFFFAOYSA-N 390.414 5.449 30 20 GKED C=CCC[C@@H](NC1CCN(C(=O)c2ccccc2Cl)CC1)c1ccccc1 539054519 QLGFORSJKPCCKN-JOCHJYFZSA-N 382.935 5.242 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)C(=O)N[C@H](C)c1cc2ccccc2o1 542102704 NFDJXPYZBYBLDB-CHWSQXEVSA-N 384.888 5.316 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(Sc2ccc(Cl)cc2)o1 542503305 RQPNZNMTRXRWBN-UHFFFAOYSA-N 386.860 5.233 30 20 GKED N#CCc1ccc(CSCc2nc(O)c3c(-c4ccco4)csc3n2)cc1 544083400 ZZHFHDRUHZVXCG-UHFFFAOYSA-N 393.493 5.156 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc3cc[nH]c23)cc1 547819924 INCAJIITBDZAKT-UHFFFAOYSA-N 383.476 5.584 30 20 GKED N#CCC[C@H](NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1)c1ccccc1 554024651 GNDMSWAVULXWBD-FCHUYYIVSA-N 397.469 5.303 30 20 GKED C[C@H]1CC(=O)CC[C@H]1C(=O)Nc1ccc(Sc2ccc(Cl)cc2C#N)cc1 562954297 ZKZTZTHGHCTWNC-ORAYPTAESA-N 398.915 5.307 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 564441107 NDGMUQSFZQDKPK-AWEZNQCLSA-N 378.457 5.032 30 20 GKED CCN(C(=O)NCc1ccc(CC#N)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 567759177 OQFSQTKTVYMAQL-HNNXBMFYSA-N 389.421 5.064 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 572417473 SKOHNKRINLWYDE-GAJHUEQPSA-N 390.531 5.160 30 20 GKED CC(C)Cn1cc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)c(C(F)F)n1 578584521 UPDONYHITQGOLF-UHFFFAOYSA-N 397.294 5.026 30 20 GKED COCC[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)c(Cl)c1 585754937 UTIRUIMYOZEPAV-FQEVSTJZSA-N 391.342 5.662 30 20 GKED N#CCc1ccccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 588988079 LQPYYCBKLDPCAP-UHFFFAOYSA-N 387.826 5.322 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)C3CC(c4ccc(F)cc4)C3)cc2)ccn1 589990658 BXOLLBHNCDAGRD-UHFFFAOYSA-N 387.414 5.017 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)N3Cc4ccc(C#N)cc4C3)c2)C1 594070948 KIRUFSIIHLHZEI-GAJHUEQPSA-N 389.499 5.201 30 20 GKED CCN(C(=O)Cc1sc(C)nc1-c1cccs1)[C@@H](C)c1ccc(C#N)cc1 603530493 NPSMZXXJEFREQS-AWEZNQCLSA-N 395.553 5.204 30 20 GKED CC(C)c1cc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)nn1C(C)(C)C 603749857 CXZPQIIPHLYVKS-ZDUSSCGKSA-N 384.549 5.072 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(-c4cnco4)cc3)cc2)c1 609063632 IBMVBABWNQWXDL-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CCC[C@@H](C#N)NC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 609071879 NTRRLMXBLBJOFS-FQEVSTJZSA-N 393.918 5.084 30 20 GKED CCCN(C(=O)Cc1csc(-c2ccc(C)o2)n1)c1cc(Cl)ccc1C#N 609286301 SPWHHVZQFKDVGD-UHFFFAOYSA-N 399.903 5.222 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 609428168 AYGBXDNBNALISH-CYBMUJFWSA-N 394.500 5.167 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 610019401 NWQPRGYUYURUTE-YZGWKJHDSA-N 393.556 5.471 30 20 GKED CC(C)(C)OCc1cccc(CNC(=O)c2c(Cl)cc(C#N)cc2Cl)c1 611093842 IDZOXJSSWBTJRM-UHFFFAOYSA-N 391.298 5.110 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1ccc2ccccc2n1 613291101 UEWSRWOXKKESDS-KRWDZBQOSA-N 388.879 6.107 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 619762450 FLCSADITSYPWLI-JKSUJKDBSA-N 375.497 5.408 30 20 GKED N#C[C@H](Sc1nnc(-c2cccc3ccccc23)o1)c1ccc(Cl)cc1 619864304 DKASESNEYRNXMG-SFHVURJKSA-N 377.856 5.900 30 20 GKED C=CCN(Cc1ccccc1)C(=O)C(=O)Nc1ccc(SC(C)(C)C)cc1C 726290509 JCLFBWRPIQTYNU-UHFFFAOYSA-N 396.556 5.039 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccnc(Cl)c3)cc2Cl)c1 727998791 CNLQTKHCKZHQNN-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#CCOc1ccc(CNCc2ccc(-c3ccc(C(F)(F)F)cc3)o2)cc1 729685266 BHONLCGPIPBSAR-UHFFFAOYSA-N 386.373 5.158 30 20 GKED Cc1ccc(C2CC(=Nn3cnc4sc(C)c(-c5ccccc5)c4c3=O)C2)cc1 729817117 VAKUKWGNHPOVGR-UHFFFAOYSA-N 399.519 5.524 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc2ccccc2c1 731322135 UNGPZCSKUSBVQE-HNNXBMFYSA-N 377.538 6.043 30 20 GKED CCN(CC)c1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 731400955 ZCMXZHSWMZGJAO-QGZVFWFLSA-N 396.560 5.249 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)c1csc2ccccc12 732919089 YVRKSHUDQIFZLV-QWHCGFSZSA-N 395.553 5.001 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)NCc3ccc(Cl)s3)c2)s1 740027750 WYPOMWFHVNWQCV-UHFFFAOYSA-N 387.917 5.001 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 742537243 JHKZGAHAQRWFJQ-KOSHJBKYSA-N 386.470 5.689 30 20 GKED C=CCOc1ccc(OC(=O)CCc2ncc(-c3ccccc3Cl)o2)cc1 742864319 NQZKMHKENTZLOY-UHFFFAOYSA-N 383.831 5.098 30 20 GKED CCCn1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 746024742 AHTVQCQPFUWYDX-IBGZPJMESA-N 393.878 5.246 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2c1 747116107 ARMFNEPTPPHTPF-INIZCTEOSA-N 377.444 5.034 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2nc3cc(Cl)ccc3s2)n1 747198525 YKAJRCWERZORMS-LBPRGKRZSA-N 389.933 5.339 30 20 GKED N#CCCCOc1cccc(NC(=S)Nc2ccccc2-c2ccccc2)c1 751000125 BYNVKSNPRKHSBM-UHFFFAOYSA-N 387.508 5.845 30 20 GKED N#Cc1csc(C(=O)O[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 752195003 HNXPOBDHSSICAE-GFCCVEGCSA-N 379.281 5.099 30 20 GKED C#CC[C@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccccc1 756996075 NPCLFIUMPRCFTB-QHCPKHFHSA-N 388.898 5.447 30 20 GKED CCc1noc(C)c1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 757544211 URZRIINCMZFOFM-UHFFFAOYSA-N 381.863 5.262 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cccc(CSC2CCOCC2)c1 768155754 SDZAQCFHHBFGNB-FQEVSTJZSA-N 392.565 5.009 30 20 GKED COCCOc1c(Cl)cc(N=Cc2cc3ccccc3nc2O)cc1Cl 773154167 XNYSUJXOKZUZGF-UHFFFAOYSA-N 391.254 5.023 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775615355 VPXJZZISUKMALF-JKSUJKDBSA-N 382.533 5.030 30 20 GKED C#CCOc1ccccc1NC(=O)c1sc(-c2ccccc2)nc1C(F)F 775950249 LXJXCQMZAZJUGF-UHFFFAOYSA-N 384.407 5.012 30 20 GKED C[C@@H](N[C@@H](c1ccc(Br)cc1)C1CCC1)c1ccc(OCC#N)cc1 776157600 COLMARFMEPWKLN-QVKFZJNVSA-N 399.332 5.543 30 20 GKED C[C@H]1/C(=C\c2ncc(C(F)(F)F)s2)C(=O)c2cccc(Br)c21 788355836 PPHLBKGJCPQQRR-JGESFRBXSA-N 388.208 5.308 30 20 GKED O=C1CCc2cc(C(=O)/C=C/c3cnc(-c4ccc(Cl)cc4)s3)ccc2N1 789128252 OXBQFJNYWDNTCG-VQHVLOKHSA-N 394.883 5.244 30 20 GKED Cc1nc2c(cnn2C(C)C)cc1C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1 789950841 NMWXNAMBCFGFEA-UHFFFAOYSA-N 396.450 5.079 30 20 GKED CN(CCC#N)c1ccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 790637286 WKQNXLGGYPJVPD-UHFFFAOYSA-N 396.947 5.103 30 20 GKED C=CCC1(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)CCC1 791560750 LWLFYOHDPGBUDD-JTQLQIEISA-N 390.694 5.263 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CCCCC1)c1cnc2ccccc2n1 792110460 LYOCRNKWFZPDDW-GOSISDBHSA-N 389.886 5.362 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(OC)c(OC)c3C)cs2)c1 794737151 BHEJNMAAQPCJNO-CSKARUKUSA-N 395.480 5.040 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)cc1 796749662 ZZLQJMJTPCKUIH-KUHUBIRLSA-N 384.426 5.273 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570111 CTIUTVZNKFGESM-OCCSQVGLSA-N 394.462 5.829 30 20 GKED Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC(C)(C)CCC#N)cc3)o2)cc1 798876031 MPAGGRZSPYWMJN-UHFFFAOYSA-N 389.455 5.199 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)C1CCC2(CC1)CC2 850758808 DUSFAQCRHLLZQX-IBGZPJMESA-N 388.467 5.097 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 916628522 WMVWWNNFMBDOQT-BJIFSAINSA-N 399.302 6.007 30 20 GKED Cc1ccc2c(C=Nn3c(C)nc4scc(-c5ccccc5)c4c3=O)c[nH]c2c1 917536467 WOOVSOJREGDAEL-UHFFFAOYSA-N 398.491 5.105 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2ccc(-c3ccccc3)o2)cc1 917542755 PLGVBDMTRQIJPT-UHFFFAOYSA-N 394.887 5.366 30 20 GKED CCc1ccccc1Oc1ccc(Cl)cc1C=NNc1cccc(C(=O)O)c1 1776038125 UAWYWACDWOTKPA-UHFFFAOYSA-N 394.858 5.839 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC[C@@H]([C@@]23CC[C@@H](C2)[C@H]3C(=O)O)C1 1776786820 PULFDPIZXDKJRG-BPDSMXLESA-N 377.569 5.113 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2cccc(C(=O)O)c2)cc1 1776869256 QTXJTHDTZMVAJP-DTQAZKPQSA-N 385.463 5.307 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1ccc([N+](=O)[O-])cc1 7718107 VHVOHDFCPYZOFQ-VAWYXSNFSA-N 395.846 5.006 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)Nc3ccc(CC#N)cc3)cccc2c1=O 15029604 PQAFANGGHSPPIF-UHFFFAOYSA-N 394.430 5.087 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2ccc(C)c(C)c2)cc1 27092136 NMKNSLIXNHJWGV-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 65680398 AYMOHKQJHRSFNE-UHFFFAOYSA-N 377.469 5.491 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2ccccc21 66953846 FWEQSNYFUPGQAG-NVXWUHKLSA-N 381.501 5.116 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1nc(C2CC2)no1 102778545 PGQLNVGBIBLKBF-CYBMUJFWSA-N 394.862 5.224 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(OC(F)F)cc1 108981181 SOSHXSWRYXAAGK-CQSZACIVSA-N 390.455 5.254 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(Oc2ccncc2)c1 112211720 ZKWRTGIZMPYZDP-UHFFFAOYSA-N 389.455 5.103 30 20 GKED CC[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nccs1 153717419 YNTHYOIZBVBFLC-GOSISDBHSA-N 378.457 5.080 30 20 GKED CS[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156374638 YMHMZEHYIJUQCT-JOYOIKCWSA-N 385.341 5.435 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1Cl 172088148 RSVQZFXSTGLKHW-ISBHARSQSA-N 379.872 5.138 30 20 GKED C[C@H](Sc1cccc(C#N)c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 177103696 RLSJCOORWLHIHK-VIFPVBQESA-N 385.703 5.638 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cn2cc(Cl)cc(Cl)c2n1 177236739 BSRSYWZFXDRXQV-LBPRGKRZSA-N 391.327 5.647 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)NCc1ccc(OCC#N)cc1 180551312 RGKYAXYZDTXVCZ-CQSZACIVSA-N 381.476 5.011 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(CC=C)c(OC)c(OC)c1 189869157 SLPSIQMINGAIIA-UHFFFAOYSA-N 379.500 5.537 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(O[C@H]2CCOC2)cc1 191461311 XUPMNQAUQJWCKT-FQEVSTJZSA-N 380.488 5.350 30 20 GKED Cc1cccnc1[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)C(C)C 236802160 CYKLAPSAAHDLPZ-DEOSSOPVSA-N 385.511 5.328 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCCCCC#N 282091883 XDHMFHHBHQXDHR-UHFFFAOYSA-N 380.275 5.195 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ncsc3C(F)(F)F)c2C#N)[C@@H](C)C1 297901755 QZVUTMUQJSJOKJ-YUMQZZPRSA-N 385.436 5.033 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)c(F)c2)cc1Cl 302947036 MYGAYEYBBXBXDL-QGZVFWFLSA-N 382.797 5.526 30 20 GKED COc1ccc([C@H](/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c2nccn2C)cc1 328990737 IGODKCNCCUMGJE-ZXNZYJFHSA-N 381.520 5.081 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1c(F)ccc(Br)c1F 410324497 SHFSNSQQXSZEIK-LLVKDONJSA-N 397.288 5.591 30 20 GKED CC(=O)c1cccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 419513587 ZIFMOCCJGGSXMM-OAHLLOKOSA-N 398.553 5.155 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(/C=C/c3ccccc3)cs2)c1 430634159 RFBQRLXJVPQNSC-MDZDMXLPSA-N 377.494 5.181 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccccc1 432842194 JCNPEQGIDPHELK-LJQANCHMSA-N 393.878 5.082 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1nc2ccccc2s1)c1ccccc1 435109746 FCDILWQBGOUOOM-SJLPKXTDSA-N 379.529 5.706 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCS1 435112862 ZNCXYUDFXOMNHJ-SFHVURJKSA-N 399.947 5.355 30 20 GKED Cc1ccc(-c2nnc(SCc3ccc(C#N)cc3OC(F)F)o2)c(C)c1 439536936 OWZKDXJOTNRPQD-UHFFFAOYSA-N 387.411 5.119 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC[C@H](c2nc3ccc(F)cc3o2)C1 443651804 JUTRURBJIGNHSD-KRWDZBQOSA-N 377.463 5.148 30 20 GKED CC(C)(C#N)CC(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 447205267 YIGLDPUFHHIBHM-UHFFFAOYSA-N 378.501 5.049 30 20 GKED C[C@H]1C[C@H]1c1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)C2CC2)o1 455758737 VSSPZIUNXLKYIW-SUMWQHHRSA-N 383.879 5.319 30 20 GKED CCC(C)(C)CC[S@](=O)Cc1ccc(OCc2cccc(C#N)c2)c(OC)c1 462990496 NYOJBYSPLDWGBX-NDEPHWFRSA-N 399.556 5.221 30 20 GKED C[C@@H](C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1)c1cccc(C#N)c1 464132280 OTBKQYHIGKWTQB-CQSZACIVSA-N 378.378 5.371 30 20 GKED COc1cccc([C@H](NCc2ccc(F)c(C#N)c2)c2ccccc2Cl)c1 467763614 JMGHXMZOFVOERW-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CCCC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 469165441 YLBYHJMOSXXEFU-JOCHJYFZSA-N 375.516 5.613 30 20 GKED N#Cc1ccc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)s1 469890955 FDPZBLLENXGQOG-UHFFFAOYSA-N 390.251 5.366 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)F)CC1 470188394 PFIGOOGBOBYFQO-OABAINGHSA-N 390.474 5.006 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 471173490 RXKRTWLCHPIAQO-UHFFFAOYSA-N 395.890 5.548 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 472188643 IHGZSYRFQMHWFA-JOCHJYFZSA-N 392.547 5.164 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCN1CCC(C#N)(c1ccccc1)c1ccccc1 472571624 UUAJXYNDSIUGSJ-QHCPKHFHSA-N 384.527 5.063 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CCC)c1nnc2ccccn12 475556963 VJIHAZSQNOGMQC-LJQANCHMSA-N 391.519 5.244 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2nc(C)cs2)CCCC1 475558008 GOHPHMBWXMBIPG-UHFFFAOYSA-N 383.561 5.894 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cc(OC)c(OC)cc1C 475560599 JBXNCOHIKTXVLO-QGZVFWFLSA-N 396.531 5.747 30 20 GKED N#CC[C@H](CC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1)c1ccccc1 476463979 WISWISPESYZKSG-AOYPEHQESA-N 394.518 5.443 30 20 GKED N#Cc1ccccc1-c1ccc(CS(=O)(=O)Cc2cccc(C(F)F)c2)cc1 479830428 POVHBPYMALXHSG-UHFFFAOYSA-N 397.446 5.278 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OC)c(OC(C)C)c1 481357867 INZTWGOBOJOWIZ-UHFFFAOYSA-N 394.924 5.417 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Cl)cc3Cl)s2)cc1 487416664 CALUKFGBIVYMKW-UHFFFAOYSA-N 388.279 5.165 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C(C)(C)Cc1ccccc1OC 495783166 FLXVUGOMGIJZSC-UHFFFAOYSA-N 377.937 5.194 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@@H](C#N)c3ccccc3Cl)o2)c(C)c1 499946471 QIVMNMFRCHFABA-IBGZPJMESA-N 394.858 5.124 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 500084279 PTASVMRDAQVJHJ-UYAOXDASSA-N 395.478 5.307 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)N[C@H](C)c3ccc(C#N)cc3)cc2)cs1 504173604 WFMYKRFVJVWRLU-CABCVRRESA-N 390.512 5.112 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1 504456804 UZMAQYFFHXYLMZ-MRXNPFEDSA-N 395.503 5.408 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCc1ccc(Cl)c(Cl)c1 508591181 XDGGRWJBNPXFTC-UHFFFAOYSA-N 377.271 5.224 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1csc(-c2ccoc2)n1 510198387 MGLHDZUHJKCHIO-UHFFFAOYSA-N 375.478 5.629 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1 511696040 SZLHRUQVJWSZDR-QHCPKHFHSA-N 390.487 5.088 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3nc(-c4ccccc4Cl)cs3)CC2)c1 511799315 HMODDBISOIBSNZ-UHFFFAOYSA-N 397.862 5.145 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)[C@@H](C)c1ncc(-c2ccc(Cl)cc2)o1 512202446 KIUMGYGENPBESN-HNNXBMFYSA-N 386.879 5.220 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)cc1F 513712461 CSQDGMWTPUDOQP-TZMCWYRMSA-N 392.352 5.407 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc4sccc4s3)c2)c1 516498703 JNHPVJGQTPOHAY-UHFFFAOYSA-N 390.489 5.666 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2cc3ccccc3o2)cc1 516503284 HGQOLGXMIRDLMB-UHFFFAOYSA-N 398.487 5.527 30 20 GKED CC(C)c1ccc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 517447831 SDZVYKLMXKSBHI-KRWDZBQOSA-N 398.597 5.934 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3SC[C@H](C)C#N)cs2)cc1 517457110 UPUDLMDNQZMUOI-OAHLLOKOSA-N 393.537 5.623 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 518028734 HCFIUHJPRYXHJU-ZDUSSCGKSA-N 393.339 5.517 30 20 GKED CCOc1ccc(SCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521725915 FWQWQIKHNSRMLH-HNNXBMFYSA-N 386.542 5.068 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3c3ccsc3)cc2)cc1 521962547 IBJSWWRFZIFWJR-QFIPXVFZSA-N 388.492 5.584 30 20 GKED CCC1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CC1 524154024 HTSVSFKGMDWBOD-UHFFFAOYSA-N 397.906 5.445 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCC[C@@H]1C1CCCCC1 532920458 VFCWONQKOZRHBQ-FXAWDEMLSA-N 385.577 5.064 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 532968207 XWRHNTCNJYYXNQ-UHFFFAOYSA-N 385.577 5.623 30 20 GKED COC[C@@H](Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 537427377 HUPNMGZZDSLKFV-LJQANCHMSA-N 378.394 5.188 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@H]3CCC[C@@H]3c3ccc(C(F)(F)F)cc3)CC2)c1 538579821 ZQLDLMBHMHWYLR-UXHICEINSA-N 398.428 5.061 30 20 GKED CC(=O)c1ccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(F)c1 539594570 VZABUFZFSRONKN-UHFFFAOYSA-N 393.258 5.318 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(=O)OC(C)(C)C)cc1 539940504 KCWPNQXYUCPTBF-HNNXBMFYSA-N 396.512 5.288 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 540311382 WCXFXRMABQGQMU-QGZVFWFLSA-N 387.458 5.267 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1C1CC1 551622414 RGZOOBIOOUWQOT-INIZCTEOSA-N 379.508 5.046 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(O[C@H](C)CC)cc1 558320974 WHDMTTIWEMBQER-GOSISDBHSA-N 384.524 5.252 30 20 GKED COc1ccc(OC(C)C)c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 561051929 SUQQJEGYMYHUBF-UHFFFAOYSA-N 395.503 5.044 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)cc2)ccn1 562228114 OFLYPUUVKVVDHK-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 568144567 PXMIIGSXBRRNKH-OAQYLSRUSA-N 398.466 5.114 30 20 GKED COc1cc(C2(C(=O)Nc3ccccc3SC[C@H](C)C#N)CCC2)ccc1C 570233551 OBMDJKVVJDKKHQ-MRXNPFEDSA-N 394.540 5.316 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)[C@@]3(C#N)CC34CCCC4)s2)cc1 581766355 NUMDJZFQHUXSRW-AOMKIAJQSA-N 379.529 5.078 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Oc2ccccc2)nc1 603968608 GDPOPPRJCKSCMK-UHFFFAOYSA-N 397.459 5.726 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CSc3ccc(F)cc3)cc2)c1 609064419 VACKRGGTGBDZLM-UHFFFAOYSA-N 392.455 5.007 30 20 GKED CSCc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccccc12 609377198 QMEHOHUHPJBCOF-CQSZACIVSA-N 396.537 5.800 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2nc3cc(Cl)ccc3s2)c1 609498426 HMPUDQCBBUWJCF-UHFFFAOYSA-N 385.876 5.009 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)CC1 609636134 VDDZKQYTIOLHLI-SFHVURJKSA-N 378.476 5.036 30 20 GKED CC(C)(NC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccc(Cl)c1 609976431 OJSCXOKICRPZBB-UHFFFAOYSA-N 394.858 5.049 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC2(CCCC2)CC1 610017122 HZNALLOOVCRJSB-UHFFFAOYSA-N 389.499 5.847 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc2cccc(F)c2o1 610225494 CGEDAZZCWGSDMC-UHFFFAOYSA-N 386.382 5.797 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 610387536 BZPHCCJMWTWNGZ-CQSZACIVSA-N 379.460 5.028 30 20 GKED C[C@@H](CCNC(=O)N[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610431970 KJRXEHKAJIJHAH-LSDHHAIUSA-N 389.421 5.131 30 20 GKED Cc1ccc(N[C@@H]2CCCc3cc(C#N)ccc32)cc1OCC1CCOCC1 611474774 VERRTFXHXIIWEW-HSZRJFAPSA-N 376.500 5.162 30 20 GKED N#CCN1CCC(N[C@H](c2ccccc2Cl)c2cccc3ccccc23)CC1 611519352 ZAFMIGIJJPDJOB-DEOSSOPVSA-N 389.930 5.160 30 20 GKED C[C@H](CC(=O)NCc1ccc(C#N)c(Cl)c1)c1ccccc1C(F)(F)F 619764675 DTBLWVBKMNXLGD-GFCCVEGCSA-N 380.797 5.040 30 20 GKED COc1cc2ccc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cc2cc1OC 659114536 FJPCXPSXIINNPZ-MRXNPFEDSA-N 394.496 5.101 30 20 GKED C=CCC[C@H](NC(=O)N(C)CC1=CCSC1)c1ccc(C(F)(F)F)cc1 660937941 DVFOHVGRWJHXND-KRWDZBQOSA-N 384.467 5.027 30 20 GKED CC1(C)CN(C(=O)c2cc(F)c(C(F)(F)F)c(F)c2)CC[C@@H]1C(F)(F)F 683250863 AHBRPWSIUPTRFT-NSHDSACASA-N 389.286 5.034 30 20 GKED COc1c(Cl)cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1Cl 726489996 SQCRGOFXTBGZNQ-UHFFFAOYSA-N 386.691 5.336 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cc(C)c(C)cc1C 733079851 KZWLOYPFMIVKFR-UHFFFAOYSA-N 399.420 5.319 30 20 GKED C=CC[C@@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccncc1 734460202 NRDFZWIEBODVPN-CYBMUJFWSA-N 377.296 5.650 30 20 GKED CC(C)(NCc1cc(Cl)ccc1OCC#N)c1ccc(Br)cc1 735308910 YBULAJVICOQOSU-UHFFFAOYSA-N 393.712 5.030 30 20 GKED Cc1nc(C)c(C=NNc2ncnc3scc(-c4ccc(F)cc4)c23)s1 736428361 UBXTTYDUCJWKGY-UHFFFAOYSA-N 383.477 5.017 30 20 GKED CCCCOc1cc(/C=C/C(=O)c2c(Cl)nc3ccccn23)ccc1OC 737446641 ZIRPGLZAWQRHKX-CSKARUKUSA-N 384.863 5.071 30 20 GKED COc1cc(/C=C2\C(=O)c3cccc(Br)c3[C@@H]2C)cc(Cl)c1O 742434945 OGXBYDFGWSJVRA-DKBJHAQFSA-N 393.664 5.200 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1cc(Cl)sc1Cl 743057066 PNQGDJYFSBISQK-UTCJRWHESA-N 377.252 5.533 30 20 GKED C[C@@H](OC(=O)C1(C#N)CCCCC1)C(=O)c1ccc(Oc2ccccc2)cc1 744858524 LZCDALJMYUUFIU-QGZVFWFLSA-N 377.440 5.067 30 20 GKED Cc1ccc(-c2ccc(/C=C\C(=O)c3ccc(N4CCOC4=O)cc3)s2)cc1 748584412 QBCQCEKIPICVCG-BENRWUELSA-N 389.476 5.576 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(Cl)c(Cl)c1Cl 753133222 AVBVIMLOSAKRDL-DAFODLJHSA-N 395.698 6.061 30 20 GKED N#Cc1cnc(NC(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)s1 759627653 WPGPUNQVPZFULM-UHFFFAOYSA-N 396.884 5.197 30 20 GKED CC(C)(c1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1)C(F)(F)F 761505479 AVDUGKGICOOOBX-UHFFFAOYSA-N 397.853 5.860 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1cc(Br)ccc1F 763123014 XRSZQJIRTVSMLE-RQOWECAXSA-N 389.249 5.003 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)O[C@H](C)c1sc2ccccc2c1C 767566807 QXLWGLPVXKUYRD-QGZVFWFLSA-N 395.528 5.174 30 20 GKED N#CCOc1cccc(NC(=O)Nc2cc(Cl)ccc2OC2CCCC2)c1 779402503 DYSHUFAMZUWLBL-UHFFFAOYSA-N 385.851 5.208 30 20 GKED O=C(/C=C/c1cccc2cnccc12)c1ccc(OC[C@H]2CCCCO2)c(F)c1 782889170 DRUXOGALGAOCND-FHVRUZERSA-N 391.442 5.218 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cccc(Cl)c2Cl)cn1 792882416 GBEKNQGNJXBHQL-KTKRTIGZSA-N 385.250 5.355 30 20 GKED Cc1cc(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)sc1Br 794733458 WUGUJGADOMHFMF-FZKGZDJFSA-N 376.275 5.006 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2ccc(Br)cn2)cc1 794835465 KCQXIXRYMVKYKD-UONOGXRCSA-N 395.728 5.387 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571038 LIQKDHVQQWAPEM-SWLSCSKDSA-N 394.462 5.514 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cncc(C(F)(F)F)c2)cc1 808240013 PJYGKNDIPVEYME-IBGZPJMESA-N 381.357 5.008 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1Cl)c1nc(-c2ccncc2)cs1 810549118 ICXMVNLQPKDWOU-MRXNPFEDSA-N 381.888 5.058 30 20 GKED N#C[C@@H](NC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccc(F)cc1 841740752 KVJLHUXXIRIOAC-FMAYLGMYSA-N 380.419 5.088 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCc2ccc(C#N)cc21 850539022 PTWFAEUEAQKMAR-FCHUYYIVSA-N 389.499 5.170 30 20 GKED Cc1cccc(OCCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915087622 VWDVPWGXRODIAC-XMMPIXPASA-N 384.479 5.448 30 20 GKED C=CCn1c(Cc2ccccc2)nn(CN(Cc2ccccc2)C(C)C)c1=S 915202081 RIISSZVVUSHYST-UHFFFAOYSA-N 392.572 5.059 30 20 GKED CCCOc1c(Br)cc(/C=C/C(=O)c2cccs2)cc1OC 916137070 KUAXFBVPEZCJPJ-VOTSOKGWSA-N 381.291 5.204 30 20 GKED C=CCc1ccccc1OC(=O)CCCc1nc(-c2ccc(Cl)cc2)no1 916860017 UWKFUCFANNXHON-UHFFFAOYSA-N 382.847 5.047 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 916942950 RAQFKJVXNXYELU-KRWDZBQOSA-N 389.282 5.252 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3csc4ccccc34)n2)cc1 916973983 BSFNUGYKZQHVAI-GOSISDBHSA-N 388.517 5.752 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 917510226 YMMYMEWCUQGOOT-IBGZPJMESA-N 388.467 5.400 30 20 GKED CCCCCCCCCC(=O)N1CCCN(C(=O)c2cccc(Cl)c2)CC1 919832962 YZNLKTGGUPXJBQ-UHFFFAOYSA-N 392.971 5.155 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776113470 KVBLMCQXVMKWHX-BENRWUELSA-N 380.490 5.731 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C)c(C(=O)O)c2)cc1 1776125576 MATPLMUZYDAOMD-XZGNNNQISA-N 394.511 6.185 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)cc1 1776125614 NKLIODJWOLXPOH-XMCSSRMMSA-N 398.474 6.015 30 20 GKED O=C(O)c1ccc(/C=C/C(=O)c2ccccc2OCc2ccccc2)c(Cl)c1 1776126427 LNVLMULLPWBXQD-OUKQBFOZSA-N 392.838 5.513 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccc(N(c2ccccc2)c2ccccc2)cc1 1776149273 ARBOBSDYJKOLEB-NRFANRHFSA-N 386.495 5.665 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(F)c(C(F)(F)F)c1Cl 1776784311 UBPKQAOUXFTOPT-CYBMUJFWSA-N 397.840 5.791 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)ccc1Cl 1777263152 ANRKHJNIEWJEKP-YFHOEESVSA-N 382.799 5.203 30 20 GKED CSc1ccc(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)c(Cl)c1 1777403297 LXODMOZRFURYEU-MDZDMXLPSA-N 397.883 5.513 30 20 GKED C[C@@H]1/C(=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1777408054 VLXNODCGVLIGAU-YQCVNYCESA-N 384.431 5.347 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(C2(NC(=O)CC3CCC3)CCC2)cc1 1786104521 YCDIRIWAFQXOLT-UHFFFAOYSA-N 380.532 5.079 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2SCc2cccs2)cc1Cl 8331482 RHXRKVHHXVZZSI-UHFFFAOYSA-N 384.913 5.818 30 20 GKED C=CCn1c(SCc2ncc(C(C)(C)C)o2)nnc1-c1ccc(Cl)cc1 45939973 JQCLKOYKYXNHTJ-UHFFFAOYSA-N 388.924 5.362 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC)c(OC)c2)cc1OCCCC#N 50234550 XMZJXKZAWHXILQ-RMKNXTFCSA-N 397.496 5.004 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)cc1 60203633 SVZDHMYRMUYDPT-JLHYYAGUSA-N 379.456 5.108 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3ccc(N(C)CCC#N)cc3)oc12 66236782 RPZKMRIQDYWPAJ-QGZVFWFLSA-N 377.488 5.032 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(C(=O)c3ccc(C)cc3)CC2)c1 67318628 WQMUXFPWVRISSM-UHFFFAOYSA-N 392.499 5.077 30 20 GKED Cc1cc(C(=O)N(CCC#N)Cc2cccnc2)sc1-c1cccc(Cl)c1 102340733 VFIINWOCZGSSJH-UHFFFAOYSA-N 395.915 5.328 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Br)c(F)c1 108237935 HTLJOFRROOUHPS-LLVKDONJSA-N 393.281 5.092 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ncc(-c2ccc(Cl)cc2)o1 108355401 WPJJUYANSCITND-CQSZACIVSA-N 383.904 5.859 30 20 GKED N#Cc1cccc(COc2cccc(CNc3cccc(NC(=O)C4CC4)c3)c2)c1 121934025 OVYBLIXTOMDISC-UHFFFAOYSA-N 397.478 5.098 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CNC(C)(C)CCc1ccccc1 151936593 LQDTUMONOHELQW-SFHVURJKSA-N 395.572 5.020 30 20 GKED CC(C)(CCC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1 155265376 QCUGMEIWTXPAKY-GOSISDBHSA-N 375.497 5.139 30 20 GKED N#C[C@@H](NC(=O)c1occc1CSc1ccccc1)c1ccc(Cl)cc1 159410485 USDZLKNXSDYFJK-GOSISDBHSA-N 382.872 5.220 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccccc2SC[C@@H](C)C#N)c(Cl)c1 170991835 ZOQCIOHPOAGDCR-GJZGRUSLSA-N 387.936 5.339 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)c1cccc(F)c1 170992206 ZTOMQNRHLIVBCD-GJZGRUSLSA-N 388.533 5.510 30 20 GKED N#C[C@H](C(=O)CCC(F)(F)F)c1nc(-c2ccc(Cl)cc2Cl)cs1 173989776 XZCPRFBUXOATFE-SNVBAGLBSA-N 393.217 5.636 30 20 GKED N#C[C@H](C(=O)CC[C@H]1CCOC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 176098063 ZTNRFNDMRXPYNR-SMDDNHRTSA-N 395.311 5.110 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Oc2cccc(Cl)c2Cl)n1 177773129 MWCNMRAKSZVNTK-GHMZBOCLSA-N 383.300 5.217 30 20 GKED Cc1ccc(-n2nc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2C)cc1 180537837 OQBHMTYZDQGOGO-QGZVFWFLSA-N 390.512 5.136 30 20 GKED N#C[C@@H](C(=O)c1scnc1C1CCCC1)c1nc2cc(Cl)ccc2s1 185257610 LGDQBIKIZWRPCR-LBPRGKRZSA-N 387.917 5.554 30 20 GKED C=C(C)[C@@H](NCc1coc(-c2ccc(F)c(F)c2)n1)c1ccc(F)c(F)c1 187760901 BDXVVLOMKCZPPD-LJQANCHMSA-N 376.353 5.305 30 20 GKED CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 195737646 WGHCVKZYENJTBU-VXKWHMMOSA-N 375.516 5.678 30 20 GKED CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 195737648 WGHCVKZYENJTBU-FCHUYYIVSA-N 375.516 5.678 30 20 GKED OC1=NC2(CCC2)[C@@H](/N=C(/O)C2(c3c(Cl)cccc3Cl)CCC2)CC1 328744250 NUXXZLKEKUAKLC-AWEZNQCLSA-N 381.303 5.413 30 20 GKED Cc1oc(-c2ccccc2)nc1/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329354532 VLDWDVFDDYEHBU-LJQANCHMSA-N 390.487 5.344 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@@H]3C[C@H]3c3ccccc3)c2)cc1 409779547 LJCARNGWFQJJLT-BJKOFHAPSA-N 397.478 5.009 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@H](C)CC3)c1C1CC1 410980680 GIGPOXGXJXOUOK-CHWSQXEVSA-N 382.533 5.213 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC(C)(C)[C@H]1C(C)C 432852742 RNBZGRDRMRPAJQ-JOCHJYFZSA-N 391.515 5.344 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CN[C@@H](CCCC#N)c1ccccc1 433019600 OTYCATVWKXSELM-QHCPKHFHSA-N 391.559 5.897 30 20 GKED N#CCCC[C@@H](NCc1nc(-c2c(F)cccc2F)cs1)c1ccccc1 433030915 XNNVMQTXCNORIB-GOSISDBHSA-N 383.467 5.613 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1nc(C2CCCCC2)cs1 435896709 FWNRDTCBNAUCAL-UHFFFAOYSA-N 390.512 5.862 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(Cl)c(C(F)(F)F)c3)[nH]c12 437380164 MNCDVFSMTTWCBS-NSHDSACASA-N 377.753 5.034 30 20 GKED Cc1ccc(Br)cc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 437753229 YBXAOHZAJIBKMU-IEBWSBKVSA-N 398.304 5.061 30 20 GKED CCCCOc1ccc(OC)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 439306718 UDOFXLSKVZUABS-LJQANCHMSA-N 381.476 5.041 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(N3CCSCC3)cc2C)CCCC1(C)C 445240961 PYRPCCKYSSWELY-FQEVSTJZSA-N 387.593 5.147 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(Cc3ccc(F)cc3)CC2)c(Cl)c1 455707430 RHPDJONHWDLUQV-UHFFFAOYSA-N 385.870 5.032 30 20 GKED CCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@@H]1CCc2ccccc21 458795608 COWGPVBRTDRFIB-XZOQPEGZSA-N 375.516 5.531 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CCc2cccs2)c1 460338655 KQZQLUGNSCVJFQ-UHFFFAOYSA-N 380.900 5.439 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(F)c(Br)c1 462232804 BJLNTGADGXQVII-LBPRGKRZSA-N 379.298 5.452 30 20 GKED COC1(c2noc([C@@H](C)c3cccc(C#N)c3)n2)CCC(c2ccccc2)CC1 463051755 CCBMPNNAVVWFIO-QWMSRCPPSA-N 387.483 5.293 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1 470151039 GBHOKAYPFQZKAI-UHFFFAOYSA-N 393.531 5.086 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 471908194 WYDJWIKJSYQDIY-GOSISDBHSA-N 382.529 5.495 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)[C@H](C)C(C)C 481748753 ZIQLQPSZJZFDKE-MRXNPFEDSA-N 383.467 5.175 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCCCCC(=O)C2)cc1Cl 485707561 GMYITCWGGKSEFY-UWJYYQICSA-N 394.902 5.473 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1cc(Cl)sc1Cl)c1ccccc1 487575600 PJJYTMFTEVXXOI-MRXNPFEDSA-N 395.355 5.929 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccc(C)cc1F 502666432 VTFYZBASUMNFPW-UHFFFAOYSA-N 395.247 5.256 30 20 GKED CCSc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 504159961 YZTASAPKVCGDEX-UHFFFAOYSA-N 378.453 5.095 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2c1 504555027 OEIUUURRAKJZLP-QGZVFWFLSA-N 399.475 5.221 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1cccc2c1CN(c1ccccn1)C2 505051340 JKVHVHYWXAYUOE-UHFFFAOYSA-N 384.483 5.364 30 20 GKED CCc1cccc(CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 508112071 AMFVOEVNSCHMOW-UHFFFAOYSA-N 384.479 5.075 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)cc1 510081519 MVZRPDRFHBJUGY-UHFFFAOYSA-N 391.858 5.581 30 20 GKED CC1CCC(CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 510619979 YEERTYBCFXKSRT-UHFFFAOYSA-N 391.515 5.279 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3cscn3)cc2Cl)cc1 511614413 ZUVDOOLTLHENAF-UHFFFAOYSA-N 383.860 5.032 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C)c1nc(C(C)(C)C)no1 516379151 IOZYSIIWOFSFPO-OAHLLOKOSA-N 376.460 5.513 30 20 GKED CC(C)CCOc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 517456988 GDGRWVJJXOCADS-QGZVFWFLSA-N 382.529 5.616 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1cnc2ccccc2n1 520502489 BQYRVOMPECAKKM-UHFFFAOYSA-N 398.853 5.002 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccccc3S[C@@H](C)CC#N)coc2c1C 521327223 XQUYBNCWESMMHQ-HNNXBMFYSA-N 378.497 5.625 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCc1cccs1 524389141 SEARFMKJAMYLPW-UHFFFAOYSA-N 376.481 5.079 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)Nc3ccc(F)c(C#N)c3)oc2c1 524458131 GXRWIRIQRQKTEH-UHFFFAOYSA-N 386.382 5.371 30 20 GKED C=CCCCN(C)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 530789962 MUFTWXHTDKLFFM-CYBMUJFWSA-N 377.941 5.441 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(CN2CCCC2)cc1)c1cccc(C#N)c1 537296811 GXKQRBKIARBBIP-NRFANRHFSA-N 395.550 5.672 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C4(C#N)CC4)cc3)n2)cc1 537477260 FVFBLGYLTULGAD-IBGZPJMESA-N 383.476 5.164 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2cccc(SCc3ccccc3)c2)CC1 554260590 VHIZRMFYFWDZRW-UHFFFAOYSA-N 399.563 5.431 30 20 GKED N#CCCN(C(=O)c1csc(-c2ccccc2Cl)n1)c1ccc(F)cc1 572141477 LHYDEVBAHHMORJ-UHFFFAOYSA-N 385.851 5.163 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1 572875390 GEHUVKWGWYUDDK-UHFFFAOYSA-N 379.460 5.035 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc([C@@H]4CCOC4)cc3)cc2)cc1 581270274 QWXHEBAMNLGFLP-OAQYLSRUSA-N 398.462 5.301 30 20 GKED N#Cc1ccsc1NC(=O)CS[C@@H](c1ccccc1)c1ccc(F)cc1 584851487 ZGFZRDHDKDIDMT-IBGZPJMESA-N 382.485 5.220 30 20 GKED CN(C(=O)c1ccc(Cl)c(NC(=O)CCCCCC#N)c1)c1ccccc1 588931545 UXEZAVJWILGEHR-UHFFFAOYSA-N 383.879 5.029 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc2cc(F)ccc2s1 592974094 NQCWEJQMHUIDED-CYBMUJFWSA-N 379.441 5.049 30 20 GKED COc1cc([C@H](C)NCc2ccc(C3(C#N)CC3)cc2)ccc1OCC(C)C 594914994 OFCZGBACDNSFFX-SFHVURJKSA-N 378.516 5.136 30 20 GKED N#C[C@H](C(=O)c1cccc(Nc2ccccc2)c1)c1nc2cc(F)ccc2s1 607274459 JCXJNAQVUSDHMF-GOSISDBHSA-N 387.439 5.669 30 20 GKED N#CCn1c(C(=O)Nc2ccc(OCc3ccccc3F)cc2)cc2ccccc21 609170398 RMALPTIQEZALKO-UHFFFAOYSA-N 399.425 5.135 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3cc4c(Cl)cccc4s3)CC2)c1 609185331 UOMFDIWBOXDOEI-UHFFFAOYSA-N 396.899 5.110 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCc2ccccc21 609398593 CEYGJKSFTFPXJC-WMZOPIPTSA-N 379.529 5.180 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1cccc(Cl)c1Cl 609414289 GARJDYAFWHRZLE-FMKPAKJESA-N 379.674 5.131 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)c1c(Cl)cccc1Cl 609580249 PLGULMHESLQUPO-STQMWFEESA-N 393.339 6.130 30 20 GKED Cc1occc1CN(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609731030 OFZWOZKEZCYPDA-UHFFFAOYSA-N 380.831 5.178 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCS[C@H](c2ccccc2)C1 609811106 NQBAUKNNLQMNTC-JXFKEZNVSA-N 397.569 5.403 30 20 GKED CN(Cc1ccccc1N[C@@H]1CCC[C@@H](C#N)C1)C(=O)c1cc2ccccc2o1 613255276 WBVMYSLPHOFPKJ-YLJYHZDGSA-N 387.483 5.199 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cnc(OC(C)C)c(Cl)c1 614526742 DVDCROUCPXBWIX-UHFFFAOYSA-N 385.316 5.066 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)c(Cl)c2)nnc1-c1ccncc1 615346722 YUAXCOFZWYTATG-LBPRGKRZSA-N 391.327 5.686 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCSc2ccc(Br)cc21 618807995 YJDBCNLIZTZMMT-MSOLQXFVSA-N 385.330 5.135 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc23)c(Cl)c1 619545141 DHPHPWNMMRDXCS-QFBILLFUSA-N 381.262 5.304 30 20 GKED C=CC[C@H](CC)NCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 639133168 ZWQFXUXHQNFLGO-HNNXBMFYSA-N 397.466 5.291 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1cscn1)c1ccc(C(F)(F)F)cc1 660940991 RLJNSZORWRGFCD-WFASDCNBSA-N 383.439 5.230 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCc4ccccc4C3)n2)cc1 732596587 YFYMJRRHELLLQT-DYESRHJHSA-N 397.503 5.053 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)ccc2SC)c1 733844375 LAAAJXDYABBRNQ-OAHLLOKOSA-N 389.908 5.065 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)CCc1ccc2ccccc2c1 735345065 ONAAQYVBIPNANO-UHFFFAOYSA-N 379.843 5.072 30 20 GKED CCn1c(-c2ccc(C(C)(C)C)cc2)nn(CN(CC#N)C2CCCC2)c1=S 738253773 DKNFHHWHVVXMEF-UHFFFAOYSA-N 397.592 5.124 30 20 GKED N#C[C@@H](C(=O)Cc1csc(-c2ccoc2)n1)c1nc2cc(Cl)ccc2s1 739155526 INYPNDWKGXRQQR-ZDUSSCGKSA-N 399.884 5.085 30 20 GKED CCN(CCC#N)Cn1nc(-c2cccc(C)c2)n([C@H]2CCCC[C@@H]2C)c1=S 742539280 HGVRQMMBAOCVHH-ICSRJNTNSA-N 397.592 5.334 30 20 GKED N#C[C@@H](C(=O)c1csc(C2CC2)n1)c1nc2cc(C(F)(F)F)ccc2s1 747562824 ZBSNVSBQQVOQGS-JTQLQIEISA-N 393.415 5.139 30 20 GKED CC(=NNc1ccc(C(F)(F)F)nn1)c1ccc(Cl)c(Cl)c1Cl 754708706 FVUDMQZBXBMZGZ-UHFFFAOYSA-N 383.588 5.292 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)cc1 760214894 BLDGYIYPACITEO-SFHVURJKSA-N 387.483 5.045 30 20 GKED C=CCSc1ccccc1C(=O)NCC[C@H](O)c1ccc(Cl)c(Cl)c1 760688162 ACZDUUWGFNDRPH-KRWDZBQOSA-N 396.339 5.125 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc2c(ccn2Cc2ccccc2)c1 762249758 PGPBGUQDHNERNF-SFHVURJKSA-N 395.462 5.233 30 20 GKED CC[C@@H]1CCCC[C@@H]1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 766846420 LZFWLVVGHDDJIY-IFIJOSMWSA-N 376.909 5.111 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)C[C@@H](CC)c2ccccc2)c1 773295947 YXIPJAWREBXTGD-IRLDBZIGSA-N 393.531 5.093 30 20 GKED C=C(C)CN(C)Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12 777961314 YRNHUCJIWZRVBI-UHFFFAOYSA-N 383.875 5.135 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCCSC(C)(C)C 783553681 YFVDBOUPSNNEIC-AWEZNQCLSA-N 382.620 5.284 30 20 GKED Cc1noc(C2CC2)c1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2 783745672 SJYMBPASRJXJMT-CYBMUJFWSA-N 383.517 5.197 30 20 GKED C=C[C@H](CC(=O)O[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784401697 CXRWHNSXURDHRH-LSDHHAIUSA-N 382.460 5.308 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc(-c2ccccc2)o1 784828736 JDYPVNDSDKEERX-MRXNPFEDSA-N 399.233 5.215 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Cl)nc1C(F)(F)F 786764308 AXVZYIBZJNQNPG-LLVKDONJSA-N 385.842 5.760 30 20 GKED N#C[C@@H](C(=O)CSc1cc(Cl)ccc1Cl)c1nccc2ccccc12 792095200 UXHQFEXOCARWBX-HNNXBMFYSA-N 387.291 5.510 30 20 GKED N#C[C@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1nccc2ccccc12 792103788 SZNCYCQTALCSMZ-QGZVFWFLSA-N 386.398 5.222 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 793122608 STJDSPHIAFCKIP-HOCLYGCPSA-N 386.373 5.292 30 20 GKED N#CCOc1cccc(/C=C(\Cl)c2nc3cc(Br)ccc3o2)c1 794738182 ISDZWWUQLDZMHJ-ZROIWOOFSA-N 389.636 5.230 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)c(Cl)c1 797570703 JCLLQTJLCKBXBZ-JQWIXIFHSA-N 381.328 5.727 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cc(C)c(C)o2)cs1 799897186 MZXPJNZHUXZVCM-TWGQIWQCSA-N 384.432 5.073 30 20 GKED C[C@H](O)c1cc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 804803961 VAZRBCLGQIVOKL-QMMMGPOBSA-N 395.274 5.169 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3cc4c(C)nn(C)c4s3)cs2)cc1 806576367 COFDZHKLMAOUIA-CMDGGOBGSA-N 379.510 5.271 30 20 GKED CC(=NNc1ncnc2sccc12)c1sc(-c2ccccc2F)nc1C 814765635 NPADZSONGAHFGY-UHFFFAOYSA-N 383.477 5.098 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2sc(C)c(C)c2C#N)c1 893143902 GCZWWKNXPYTEFE-UHFFFAOYSA-N 389.480 5.050 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC1CCC(F)(F)CC1 901736671 JCMZQSAAYUBAHO-ZDUSSCGKSA-N 384.517 5.188 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3cccc(OC(F)F)c3)c(Cl)nc21 913617543 IVHOSNYPASLPLQ-SREVYHEPSA-N 391.805 5.163 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3ccc(Cl)s3)cn2)cc1 916074669 VECORWDINLBLKF-CLFYSBASSA-N 381.844 5.112 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccc(OC)c(OC)c2)cc1OC 916545406 HMQZVPOEPLPJBH-SOFGYWHQSA-N 390.863 5.051 30 20 GKED Cc1cc(NN=C2CCCCc3cc(C(=O)O)ccc32)nc2ccc(Cl)cc12 1776021513 JRLPNBCIEXCCAM-UHFFFAOYSA-N 393.874 5.437 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(-c2c(F)cccc2F)cc1 1776063576 XJQMDJGUPJNGOJ-UHFFFAOYSA-N 384.357 5.305 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCC(C)(C)c1ccc(Br)cc1 1776782433 ZIJAEEROUDPELR-GOSISDBHSA-N 398.385 5.520 30 20 GKED COc1ccc([C@H]2C[C@H]2/C(=N/c2ccsc2C(=O)O)c2ccccc2)cc1 1857777175 MVMWXAVSPAGSHI-DZNXQGIDSA-N 377.465 5.379 30 20 GKED CN(C/C(O)=N/c1nc(-c2c[nH]c3ccccc23)cs1)Cc1ccccc1 28707441 HFFFPPXAEDLZDX-UHFFFAOYSA-N 376.485 5.011 30 20 GKED N#C[C@H](C(=O)c1cccc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 41549143 FMGCCSBFHUPNTM-GFCCVEGCSA-N 380.778 5.459 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)oc2ccc(Cl)cc12 41558239 VGCGSFWWLWRCQX-ZDUSSCGKSA-N 399.784 5.630 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955766 OAEIBHWRZIMSGV-YOEHRIQHSA-N 385.558 5.684 30 20 GKED CSc1ccsc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 107129506 NOGXWXCYPXEICA-UHFFFAOYSA-N 380.494 5.695 30 20 GKED N#CCCCOc1cccc(NC(=O)CCCOc2cccc3ccccc23)c1 108293577 BAAHFUNMDPNFCA-UHFFFAOYSA-N 388.467 5.320 30 20 GKED C=CCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1OC 119995274 MCEINMDBNMAOHD-CQSZACIVSA-N 398.871 5.013 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1cccs1 123190850 CVIGZBXVIYLXQU-UHFFFAOYSA-N 386.527 5.201 30 20 GKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 128404653 RSDRAPGLHLEXRA-AWEZNQCLSA-N 375.394 5.386 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCCCO[C@@H]2CCC[C@@H](C)C2)n1 156453018 BAHOOMQIBXCTRS-KZNAEPCWSA-N 376.566 5.598 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F 156977475 IJUGSSLFHMNLAM-NSHDSACASA-N 382.382 5.491 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c2ccccc2n1 161901173 UEQSFHJAFCDQBB-MRXNPFEDSA-N 383.373 5.262 30 20 GKED Cc1cnc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)s1 173122422 PMSPRSLVBGBEQP-SJCJKPOMSA-N 386.546 5.119 30 20 GKED CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1O[C@@H](C)C#N 184310029 BZBJKSPEJKFXAU-FBBABVLZSA-N 377.488 5.168 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc3ccccc3c2O)ccc1OC 186029033 IWACXCPRPCBKNO-LPHOPBHVSA-N 390.483 5.086 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)CC1(c2ccccc2)CC1 190187311 RGDVKHGGLMIDAI-KRWDZBQOSA-N 379.529 5.276 30 20 GKED C[C@@H](SCCC(=O)Nc1ccccc1C(F)(F)F)c1cccc(C#N)c1 190890298 PCGJREFWKCDIPF-CYBMUJFWSA-N 378.419 5.400 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c1 194189992 ZEBCHKCOHOILFP-OAHLLOKOSA-N 391.323 5.291 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3ccc(F)cc3F)c2)cc1 207085579 BVRLWZGKHHFUIK-XGICHPGQSA-N 393.389 5.122 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 255887250 REMJTSRRRHJUIO-HMVFGEFZSA-N 385.801 5.365 30 20 GKED COc1ccc(COCc2cccc(Nc3snc(Cl)c3C#N)c2)cc1 301931564 NYVGZCSNGCAMCB-UHFFFAOYSA-N 385.876 5.137 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1cccc(OCc2ccc(Cl)cc2)c1 303182898 IMQHABVCFRZYEB-UHFFFAOYSA-N 390.870 5.063 30 20 GKED C=CCOc1ccccc1CNC(=O)N(Cc1cccs1)Cc1cccs1 303581950 KNUZVOCJECHFPV-UHFFFAOYSA-N 398.553 5.286 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 429689588 GBONBMALDNBEAV-KRWDZBQOSA-N 393.418 5.284 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H]1CC[C@@H](C)C1 429735430 FLCMDEAKRAZDQP-UZLBHIALSA-N 377.488 5.098 30 20 GKED Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2cccc(SCC#N)c2)cc1 430626250 LQFDUOQFABMQHR-UHFFFAOYSA-N 390.512 5.172 30 20 GKED CC[C@H](NCc1nc(COC)sc1-c1ccccc1)c1ccc(C#N)cc1 442859793 RHBODKKZARJWGN-IBGZPJMESA-N 377.513 5.069 30 20 GKED N#Cc1ccc(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)cc1C(F)(F)F 443881596 RRGZXGLTEFJAJV-OAHLLOKOSA-N 386.295 5.252 30 20 GKED C[C@H](c1ccc(C(=O)Nc2cccc(OCCCC#N)c2)cc1)C(F)(F)F 454864909 RCQXMUAHFDUNNR-CQSZACIVSA-N 376.378 5.287 30 20 GKED N#CCC[C@H](NC(=O)c1cc(-c2ccccc2C(F)(F)F)on1)c1ccccc1 462243141 AQKFBMUWUZKWMP-KRWDZBQOSA-N 399.372 5.135 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(-c2ccccc2Cl)o1 464944236 WQGOAHRYGBFDAF-UYAOXDASSA-N 390.870 5.512 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2COc3c2ccc(Cl)c3Cl)cc1 466218107 PTDUJQWUQRKUEU-OAHLLOKOSA-N 390.270 5.050 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1)c1ccccc1 472505893 SNAKUIYXCNHLED-JXFKEZNVSA-N 382.419 5.458 30 20 GKED C=CCc1cc(C(=O)Nc2cccnc2-c2ccc(C)s2)cc(OC)c1OC 474524656 QFYZDSDJEIFUNJ-UHFFFAOYSA-N 394.496 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1SCCc2ccccc21 475560271 SVTTZRUGWJYYGQ-OAQYLSRUSA-N 380.557 5.691 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1 475570897 DIYUJWAVYWNZEW-IRLDBZIGSA-N 398.934 5.844 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC(c2ccsc2)CC1)c1ccc(F)c(F)c1 486254830 IHZGCQOFWPEFLL-LJQANCHMSA-N 376.472 5.233 30 20 GKED N#CCCN(C(=O)CCCc1c[nH]c2ccccc12)C12CC3CC(CC(C3)C1)C2 486574146 VHGMHOYYRWFIJV-UHFFFAOYSA-N 389.543 5.202 30 20 GKED C[C@@H](C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)s1 487421922 SQJROISHVKJMGJ-UKRRQHHQSA-N 391.334 5.165 30 20 GKED C=CCCC[C@H](C)NC(=O)NCc1cc(-c2c(OC)ccc3ccccc23)no1 487986397 UMYIUDPHOQRDAZ-INIZCTEOSA-N 393.487 5.047 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(Br)cc1C(F)(F)F 488368218 QAUJFNBLCUGKKN-LLVKDONJSA-N 377.204 5.040 30 20 GKED Cc1nc2ccccc2n1CCC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 497581780 FHCYQYDEIQRVRW-UHFFFAOYSA-N 396.450 5.038 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCCCCO[C@H]1CCC[C@H](C)C1 499297369 YGACTBNNUKUJHM-REWPJTCUSA-N 384.564 5.451 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3ccccc3Cl)c2)cc1 501450301 HKKGVIURLPQYCC-UHFFFAOYSA-N 390.870 5.166 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1cccc(C(F)(F)F)c1 505976524 MCQMANWQXKBYFH-CQSZACIVSA-N 378.737 5.100 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@H]1c1ccc(Cl)cc1 511544721 DLFDOYIPTMEJOL-KXBFYZLASA-N 399.947 5.120 30 20 GKED CN(C(=O)NCC(C)(C)CCC#N)[C@H](c1ccc(Cl)cc1)C1CCCC1 513141846 VRYTYYZDERZOQK-IBGZPJMESA-N 375.944 5.543 30 20 GKED CN(C(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1cccc(C#N)c1 517758350 SZJYBDMDAGQQEO-UHFFFAOYSA-N 376.843 5.067 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccnc(Oc2ccccc2)c1 518660004 CNEPZOGXWDAGCA-MRXNPFEDSA-N 389.480 5.378 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)cc1 519969099 OQGFHZKNVODCFT-DEOSSOPVSA-N 395.506 5.667 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 522067089 JNSIRMCTIGICSI-OAHLLOKOSA-N 392.421 5.173 30 20 GKED CCCn1c(S[C@H](C#N)C2CCCCC2)nc2cc(Cl)ccc2c1=O 524534295 LKVPARTVMBHVHL-QGZVFWFLSA-N 375.925 5.024 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N(CC#N)C3CCCC3)c2)c(C)c1 524583755 POGSHVKGVSCSPX-UHFFFAOYSA-N 378.541 5.504 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 532569924 AINZDPXQZIQSRK-RTBURBONSA-N 395.572 5.329 30 20 GKED Cc1cccc(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1Br 534596452 AWQIMWNWZVJJHM-UHFFFAOYSA-N 398.285 5.005 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)NCc1cc(Cl)sc1Cl 536148144 AZUMYKZROKJOOD-HUUCEWRRSA-N 394.327 5.036 30 20 GKED Fc1ccc([C@H](CC(F)(F)F)NCc2ccccc2OCC(F)(F)F)cc1 538176668 VDQVCBHBBXPYFE-HNNXBMFYSA-N 395.318 5.550 30 20 GKED C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1cccc(C#N)c1 538407013 DJENBEVKLMGWBB-SFHVURJKSA-N 396.469 5.401 30 20 GKED COc1ccccc1NC(=O)c1cc2ccccc2cc1OCCC(C)(C)C#N 540843174 JRXVORWSRKOIQB-UHFFFAOYSA-N 388.467 5.419 30 20 GKED N#Cc1cc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)ccc1Cl 540883649 UTYUZRJFEPUKGX-UHFFFAOYSA-N 378.781 5.035 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)c1ccc(C#N)s1 542201454 RONJQAHPYIXYJK-UHFFFAOYSA-N 393.468 5.596 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(Cc2ccccn2)ccc1C 555055089 ZIJSBZIOGCHNDP-UHFFFAOYSA-N 389.474 5.340 30 20 GKED C=CCN(CCC#N)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 557383742 MSNWMPQKLMWHBL-UHFFFAOYSA-N 393.537 5.009 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1nccc2ccccc12 572066316 MSMYHXJANPLMFD-SFHVURJKSA-N 375.497 5.538 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2ccnc(C(F)(F)F)c2)no1 573167122 WZFVUHMJLFDNLA-LBPRGKRZSA-N 391.246 5.228 30 20 GKED N#CC[C@H](Cc1nc(-c2ccc(C(F)(F)F)c(F)c2)no1)c1ccccc1 574361943 ACQJAEPLZBFNMM-CYBMUJFWSA-N 375.325 5.134 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 585720255 VJMCNMBUHURYKM-HSZRJFAPSA-N 392.524 5.534 30 20 GKED N#CCCCCCC(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2 588907243 RTJOUJFSXZUSOY-UHFFFAOYSA-N 382.485 5.022 30 20 GKED N#Cc1ccc(C2(NC(=O)Nc3cccc(C(F)F)c3Cl)CCC2)cc1 594079979 ITJCROKDUXFCQA-UHFFFAOYSA-N 375.806 5.350 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1F 595694967 XJOZQJPHLFBPNQ-AOMKIAJQSA-N 399.535 5.145 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H]1CCc2ccccc21 609398020 BKNGMLWDEAATHB-UWJYYQICSA-N 393.556 5.870 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609647654 XGBXKYAJWRNUPN-XXBNENTESA-N 396.490 5.563 30 20 GKED COc1cc(COc2cccc(F)c2F)ccc1OCc1cccc(C#N)c1 609722583 UPPADOYLCKTLTP-UHFFFAOYSA-N 381.378 5.003 30 20 GKED N#Cc1cnc2c(F)ccc(F)c2c1N1CC[C@@H](CSc2ccccc2)C1 610282532 RXDNLRAOOKCBFH-CQSZACIVSA-N 381.451 5.003 30 20 GKED C[C@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1cccc(C#N)c1 610359636 MFYBZSXEQWWZFP-SFHVURJKSA-N 379.463 5.052 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 615815625 CNPIZBWLVZTLJC-SFHVURJKSA-N 380.385 5.217 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(OC)cc2)n1 639303332 PBZQVLNJPLUKEV-UTKZUKDTSA-N 399.560 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)O[C@H](CC(F)(F)F)C1 666866696 YQUAZTZMTWEYEG-GDBMZVCRSA-N 384.442 5.112 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)C1CCCCC1 726324621 DSZCILHUMRIUIM-BEFAXECRSA-N 377.513 5.465 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(O[C@@H](C)C#N)cc3)s2)cc1 728697713 HWRAQKHZITTYIE-OIQJVACTSA-N 388.492 5.614 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccccc2OC)cc1 728767195 XFJXFGGXBUNANK-FVJLSDCUSA-N 392.499 5.050 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)c1csc2ccccc12 730022586 OUYUHQDBCNMMQC-QWHCGFSZSA-N 383.904 5.104 30 20 GKED Cc1cc(OCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc1C(C)C 730421817 QIHGLLMVNQQCQA-KRWDZBQOSA-N 382.460 5.123 30 20 GKED N#CCOc1ccc(COC(=O)c2sc3cccc(Cl)c3c2Cl)cc1 733433174 BQPMCIRGLWYNGB-UHFFFAOYSA-N 392.263 5.467 30 20 GKED C[C@@H](COc1cccc(C#N)c1)OC(=O)c1ccc(C2SCCCS2)cc1 733860844 HZBFQUBKRUMNED-HNNXBMFYSA-N 399.537 5.051 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)s1 744117129 UNRFBXWKZSVGEL-SZZPACECSA-N 385.489 5.079 30 20 GKED CC(=NNc1nc(-c2ccc(Cl)cc2)no1)c1ccc(-c2ccncc2)cc1 745202952 DDQPYLMWTSVLOL-UHFFFAOYSA-N 389.846 5.288 30 20 GKED CC(C)c1cccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)c1 745723943 GJDHSPGHYRTGBZ-UHFFFAOYSA-N 385.536 6.085 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 747399048 LLYKZWSLEAZKDJ-UHFFFAOYSA-N 397.409 5.173 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)cc1 751517553 MBKSUPFCYVDBBL-NYYWCZLTSA-N 395.462 5.051 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H](C)c1ccc2ccccc2c1 753389786 JAMZVTISCWDNOH-QVKFZJNVSA-N 380.447 5.325 30 20 GKED N#CC1CCC(COC(=O)c2csc(-c3cccc4ccccc34)n2)CC1 755963444 DMZVUWWAGDYHMR-UHFFFAOYSA-N 376.481 5.450 30 20 GKED N#Cc1ccc(Cc2cnc(NCc3ccc(CSC(F)F)o3)s2)cc1 758450723 QWYMZLZOYCFGRM-UHFFFAOYSA-N 391.468 5.266 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)C(=O)Nc1cccc(C)c1 766842309 WJZSUJBNDJORGR-QSOAKEGCSA-N 387.266 5.053 30 20 GKED COc1ccsc1C(=O)/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1 769744444 LGNDVIMOOLLEJQ-KTKRTIGZSA-N 397.883 5.559 30 20 GKED CCCCCCCCCCC(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1 770922985 SYACZPAFHFDMAT-NRFANRHFSA-N 390.612 5.158 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(Cl)c3SC(F)F)cc2)CC1 776873020 KVNOVVDVWFSAIQ-UHFFFAOYSA-N 378.831 5.462 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CCCC1 780676746 QPVWTIRJAMHJOL-INIZCTEOSA-N 381.451 5.093 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1)c1ccc2ccccc2n1 796627466 AYDYRUNGPOXFCA-RCCFBDPRSA-N 396.368 5.113 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C/Sc1cc(F)ccc1F 797865838 FWRSHBXAZVMWQI-MMQHEFTJSA-N 390.480 5.461 30 20 GKED CC(C)(CC(=O)c1ccccc1)CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 799609625 RJMQNGKQAMTBIY-INIZCTEOSA-N 394.471 5.301 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc[nH]1)c1nc(-c2ccc(Cl)cc2Cl)cs1 802044035 BLEFKKWFYNZSAX-SDQPKGBYSA-N 388.279 5.335 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](c1ccccc1)c1ccc3c(c1)CCCO3)CC2 810225616 ISNZXZBFFZPKBB-AHWVRZQESA-N 380.491 5.250 30 20 GKED Cc1ccc2sc(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)cc2c1 810530539 DORZYCUVCIGSAK-SFHVURJKSA-N 384.460 5.324 30 20 GKED N#C[C@@H](C(=O)CCCc1csc2ccccc12)c1cc(C(F)(F)F)ccn1 813217729 OIEYFQLXXMLVJD-MRXNPFEDSA-N 388.414 5.514 30 20 GKED CCCCCCCCCC(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21 914833293 RTLIWJMVEWBBMJ-NRFANRHFSA-N 386.580 5.232 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354020 SVLQUAUMSJTRTC-UZUQRXQVSA-N 387.458 5.706 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccccc2)cc1 916131253 RTIAGTFJQUBBOS-SDNWHVSQSA-N 385.467 5.147 30 20 GKED CC(C)Cc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 916944702 LFBAXLNJZAGFCP-GOSISDBHSA-N 389.282 5.153 30 20 GKED N#CCOc1cccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(Cl)cc2)c1 917499547 JRBXQXWDJHGPEJ-OAQYLSRUSA-N 389.842 5.013 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCC3CCCCC3)n2)cc1 920140751 JLEBTQIDJYRWKA-IBGZPJMESA-N 377.513 5.609 30 20 GKED N#CCCc1ccc(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)cc1 932561304 KWFKQLWCAPJYMD-UHFFFAOYSA-N 395.347 5.318 30 20 GKED Cc1ccc2c(C)cc(NN=Cc3csc4ccc(C(=O)O)cc34)nc2c1C 1776022415 NGAQBIVZNKLGTP-UHFFFAOYSA-N 389.480 5.519 30 20 GKED O=C(O)c1cc(NN=C(CCCc2ccccc2)c2ccccc2)ccc1F 1776061606 FGXGSWKIEMIUDF-UHFFFAOYSA-N 376.431 5.363 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)s1 1777462879 DXZIHPYKYKCOCG-VQHVLOKHSA-N 388.448 5.194 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)Nc1ccc(CC#N)cc1 31652636 JHLOTGCLVKAUCB-UHFFFAOYSA-N 377.513 5.350 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC2CCCC2)cc1 63391057 UGJADTNSBNBENO-UHFFFAOYSA-N 395.459 5.136 30 20 GKED CC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1nc(C)cs1 105503594 RYMMGJKIDOGZQY-OAQYLSRUSA-N 377.513 5.143 30 20 GKED COc1ccc(CN[C@@H]2CC(C)(C)Cc3oc(C)cc32)cc1OCCCC#N 120000872 XZIRFCFRQYDSSV-LJQANCHMSA-N 382.504 5.083 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cccc(-c3nc(C)cs3)c2)cc1 121130509 AFXUFDYAAPZOLH-UHFFFAOYSA-N 391.496 5.078 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1c(F)cccc1F 140244525 YGOZKIZKJXUJPU-CQSZACIVSA-N 393.393 5.068 30 20 GKED CN(C(=O)N[C@@H](CCC#N)c1ccccc1)C1c2ccccc2-c2ccccc21 160630385 XUYGVFUCLIDPEA-QHCPKHFHSA-N 381.479 5.443 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-n2cc[nH]c2=S)cc1 170977145 PFDCHJPLGFFSGF-CQSZACIVSA-N 394.525 5.039 30 20 GKED COc1ccccc1[C@H](NCc1ccc(OCC#N)cc1)c1ccccc1Cl 172920536 MJJHXCUCYWNHIP-HSZRJFAPSA-N 392.886 5.130 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H](C)Sc1ccccc1 173115247 VQZRLTWWSCJVOI-HZPDHXFCSA-N 385.558 5.241 30 20 GKED CC(=O)c1csc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 173537961 VQWWKHSTKORLBD-UHFFFAOYSA-N 380.400 5.006 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2oc3ccccc3c2C)ccc1OC 180813592 XZIGNQUQJFUWFN-AEFFLSMTSA-N 378.472 5.282 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccc(OC)cc1 182236488 CDOWPUXSYBTCRS-CQSZACIVSA-N 392.484 5.134 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1cnc2ccccc2n1 190886041 PJEKMQHYKOSNDP-QGZVFWFLSA-N 398.853 5.199 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)on2)nnc1-c1ccccc1F 215787582 KTMFNIGSRHCIIK-UHFFFAOYSA-N 392.459 5.218 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C 246605409 XUOKBWVWEIIHFE-LMMKCTJWSA-N 379.529 5.491 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C\c1cnc(C(C)(C)C)s1 255672878 YNQQIIAHMILXSO-CFYYFVFUSA-N 385.558 5.487 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1SCC(F)F 303866707 PVOAPMFHAQCEBX-UHFFFAOYSA-N 395.862 5.233 30 20 GKED CC1(C)C(O)=Nc2cc(/C(O)=N/[C@@H]3CCO[C@H]3c3ccc(Cl)cc3)ccc21 328939133 DOWXAXLOXVQKRY-AEFFLSMTSA-N 384.863 5.054 30 20 GKED Cc1ccc(C2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)CC2)cn1 378640348 VMVYHLAZUSJMAA-QGZVFWFLSA-N 394.544 5.196 30 20 GKED N#CCCCOc1cccc(NCc2c(F)ccc(Br)c2F)c1 410314047 CFRNRQZJWXNYSG-UHFFFAOYSA-N 381.220 5.022 30 20 GKED CN(C(=O)c1cscc1C#N)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410684954 BATDVNJZMSVNDH-ZDUSSCGKSA-N 392.324 5.014 30 20 GKED Cc1nc(CC(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c(C)s1 428341013 MFNRWXMFPLFXLZ-CYBMUJFWSA-N 387.574 5.025 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)c1ccccc1 428849156 HQUGZLDTZNUFAG-MOPGFXCFSA-N 395.572 5.491 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)o2)cc1 430605450 QZBSVFGZPOELLV-MRXNPFEDSA-N 392.480 5.393 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cnc(Cc3ccccc3F)s2)s1 430607331 BXXJYTKPKCOCSU-ZDUSSCGKSA-N 399.516 5.117 30 20 GKED CCCCOc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c(C)c1 437899472 VFDGUAGWCTUEEB-JTHBVZDNSA-N 391.515 5.478 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc2cc(C(F)(F)F)ccc21 442615709 LHHOCKILWQGKLU-CYBMUJFWSA-N 399.397 5.297 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1cccc(N2CCCC2)c1 446482712 VWAKGQSWRMLSRO-IBGZPJMESA-N 395.506 5.316 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 448518057 YQGNEWXQTXCDKR-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#CCc1ccc(NC(=O)NCCCCCOC2CCCCC2)c(Cl)c1 455707782 SMLKFKBLVBIWBQ-UHFFFAOYSA-N 377.916 5.047 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(Br)ccc1Cl 462236830 MOMXDDNFJOQHAE-LBPRGKRZSA-N 395.753 5.966 30 20 GKED C[C@H](N[C@H]1CCC[C@H](C#N)C1)c1nc(-c2ccc(Br)cc2)cs1 463241097 CBEZVUZTGDRONG-XEZPLFJOSA-N 390.350 5.306 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OC)cc1C(F)(F)F 471189446 YAQITDUZAWFIEC-UHFFFAOYSA-N 378.394 5.324 30 20 GKED Cc1c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cccc1C(F)(F)F 471836244 IGNPQVPNBJNDPH-UHFFFAOYSA-N 397.356 5.325 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)CCCCOc2cccc(C#N)c2)c1 474977973 QHPCEWCNMALSEP-QHCPKHFHSA-N 376.500 5.088 30 20 GKED CCc1cccc2c(C3CCN(C(=O)c4ccc(C(C)(C)C#N)cc4)CC3)c[nH]c12 475028841 BPOMTSCSKCJGHM-UHFFFAOYSA-N 399.538 5.551 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](CSc2ccccc2)C1 475549874 PUEJJJPNTRUXPO-IBGZPJMESA-N 394.584 6.185 30 20 GKED N#CC[C@@H](CC(=O)NCCc1cccc(OCc2ccccc2)c1)c1ccccc1 476541271 RVUXPNSZDPPEMS-DEOSSOPVSA-N 398.506 5.012 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(Br)c(C)cc1OC 486552943 XLFDIJZQYCLZDT-UHFFFAOYSA-N 392.318 5.297 30 20 GKED C=CC[C@H](C(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 489694286 HKQVVTNOZAYYFL-PXNSSMCTSA-N 379.891 5.240 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 495108779 CLLLKAOBNQANBE-AWEZNQCLSA-N 376.378 5.201 30 20 GKED C[C@@H](Sc1nc2c(c(-c3ccco3)c1C#N)CCC2)c1nc(C(C)(C)C)no1 498057686 LPXPTSVSRKUERZ-GFCCVEGCSA-N 394.500 5.236 30 20 GKED CC[C@@H](CC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 504324164 HPUOMHBFRHLHPQ-SFHVURJKSA-N 385.467 5.576 30 20 GKED CCN(C(=O)CCc1ccc(-c2ccccc2F)o1)[C@H](C)c1ccc(C#N)cc1 509562056 UTDXBYAUCOBARM-QGZVFWFLSA-N 390.458 5.500 30 20 GKED N#Cc1cccc(-c2nnc(CNc3c(F)cc(F)cc3-c3ccccc3)o2)c1 510130040 CRZMVOHFQGIMQT-UHFFFAOYSA-N 388.377 5.166 30 20 GKED CCC(CC)N(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H]1CCCc2cccnc21 511334883 RQEKYBVBUHYGBN-JOCHJYFZSA-N 389.543 5.591 30 20 GKED C=C1CCN(C(=O)C(C)(C)c2csc(-c3c(Cl)cccc3Cl)n2)CC1 511393346 BYFQAAGDXVTBFA-UHFFFAOYSA-N 395.355 5.573 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 513657134 BWSQMHPPGSSBAI-RBUKOAKNSA-N 378.472 5.193 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@H](CC)c2ccc(C)cc2)cc1 513873861 DTVHNSASEYZDEE-JOCHJYFZSA-N 391.515 5.082 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(COC2CCCCC2)c1 521444656 CZGPXWKOOSODMX-UHFFFAOYSA-N 384.545 5.818 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCc4ccc(F)cc43)cc2)cc1 521655413 DABBYMCLHJFGIB-JOCHJYFZSA-N 387.414 5.299 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cs1 522073510 MZFUNENDGYZTDW-CQSZACIVSA-N 392.484 5.252 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2csc(-c3c(F)cccc3F)n2)cc1 522349099 UESJLMLWYALYEK-UHFFFAOYSA-N 383.423 5.142 30 20 GKED CC(C)c1ccccc1N(C(=O)c1ccc(C#N)cn1)c1nc2ccccc2s1 523653723 NNDGPNXIUJBXLI-UHFFFAOYSA-N 398.491 5.665 30 20 GKED CC(C)COc1ccccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 524380772 XQWMQAOGKFRVOQ-UHFFFAOYSA-N 390.439 5.017 30 20 GKED N#Cc1c(NC(=O)[C@H]2CCSc3ccccc32)sc2c1CCCCCC2 525133613 PHSIGXDHTAUJSH-INIZCTEOSA-N 382.554 5.497 30 20 GKED C=CCN(C(=O)[C@@H]1CCSc2ccccc21)c1nc(-c2ccccc2)cs1 525632627 XAGKGFGAZXPURZ-GOSISDBHSA-N 392.549 5.609 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1ncoc1-c1ccccc1Cl 525648360 CRKZPIFRSFFTCD-UHFFFAOYSA-N 399.837 5.042 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(C(F)(F)F)nc1 536433781 UWZIAPDHQFPUOF-UHFFFAOYSA-N 399.397 5.376 30 20 GKED COc1cc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)ccc1OCc1ccccc1 537294221 ARMHQZZMNSSVNU-RBUKOAKNSA-N 386.495 5.558 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 537418948 OFGFWEBHCFEOOE-UHFFFAOYSA-N 382.463 5.382 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1csc(-c2cccc3ccccc23)n1 538656750 LUEOUNWDBZTSRD-UHFFFAOYSA-N 377.513 5.365 30 20 GKED CCCCSc1ccc(C(=O)N2CCC(CC#N)CC2)cc1C(F)(F)F 546906327 PUYWKQIBGBBROB-UHFFFAOYSA-N 384.467 5.363 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cccc(-c4cscn4)c3)cc2)ccn1 571695755 OVJPAOXSRKAGAJ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCC(=O)[C@H](C)C1(C)C 573686979 ZWGCTVSBCFNEEG-JXFKEZNVSA-N 390.483 5.239 30 20 GKED N#Cc1cccc(-c2cc(-c3nc(-c4cccc(-c5cscn5)c4)no3)on2)c1 574843095 GMQFNINISOHVHG-UHFFFAOYSA-N 397.419 5.054 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3nc4ccccc4cc3Cl)n2)cc1 575227956 DRMJTMIGJIZPHG-UHFFFAOYSA-N 390.855 5.136 30 20 GKED CO[C@@](C)(c1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1)C1CC1 579969123 KYVGYRROFCNHRR-OAQYLSRUSA-N 377.469 5.031 30 20 GKED N#CCCCCCC(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 588896319 OZOYLSRELZQXPI-HXUWFJFHSA-N 385.305 5.129 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1 589075272 HYPATQMIJRGIBY-INIZCTEOSA-N 397.450 5.305 30 20 GKED CC(C)CN(C(=O)CCCCC#N)C(C)(C)c1ccc(Br)cc1 594008715 JGXYFFDOUXDBSE-UHFFFAOYSA-N 379.342 5.253 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCSc3ccc(Br)cc32)s1 596093150 SQJXNLOMSIQZKD-OAHLLOKOSA-N 379.348 5.099 30 20 GKED N#CC1(CCCOc2cccc3sc(Br)cc23)CCOCC1 600682396 NNUAFYYFPSOFIF-UHFFFAOYSA-N 380.307 5.143 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N(Cc1ccc(C#N)cc1)C(C)C 603527591 TXGXLDPPUBUIEO-UHFFFAOYSA-N 375.497 5.041 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1 603727620 FRLPULOQCFGOHS-UHFFFAOYSA-N 399.928 5.207 30 20 GKED CCCCS[C@H](C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 604117215 MRAMHOOWHRQIRJ-QGZVFWFLSA-N 382.529 5.192 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCC1 609399441 XGAVAARHFWIGCC-HNNXBMFYSA-N 383.492 5.278 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N(Cc3cccs3)C3CC3)c2)c1 609641662 ADLUAJCVHILZQU-UHFFFAOYSA-N 388.492 5.004 30 20 GKED C[C@H]1c2c(F)cccc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 610019255 JYFUSXZQEIOBMA-CABCVRRESA-N 383.492 5.229 30 20 GKED C[C@H]1c2c(F)cccc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 610019381 NLEHKYMIBLOIIG-CABCVRRESA-N 383.492 5.371 30 20 GKED CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)c1c(C#N)cnc2ccc(Cl)cc12 610274733 APCMFJWAXDWUCR-GAJHUEQPSA-N 391.902 5.364 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2)c1 610343546 LAGZWFNJLFSXTP-DVECYGJZSA-N 383.495 5.206 30 20 GKED C[C@@H](NC(=O)NCCC(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 610356695 YDCLYZLBPMYLCX-LJQANCHMSA-N 383.495 5.141 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(Br)cc1C(F)(F)F 619431077 VKGXFQMOUBQBKL-QGZVFWFLSA-N 395.222 5.117 30 20 GKED Cn1c(S[C@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccccc1Cl 619864106 PXCOEBFOCOHMDC-OAHLLOKOSA-N 375.284 5.146 30 20 GKED O=C(c1cc(F)ccc1-c1cccc(C(F)(F)F)c1)N1CC(C(F)(F)F)C1 622400197 RQPLOXNHKRVELT-UHFFFAOYSA-N 391.286 5.146 30 20 GKED C=C(C)CN(CC)C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 642229265 JDZSXXZPWLKHSU-UHFFFAOYSA-N 391.298 5.284 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC[C@@H]2CCC[C@H]21 646439167 NSOOETGEYDHYRI-GXFFZTMASA-N 398.322 5.382 30 20 GKED CCN(C)c1ccccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730136144 ZROJTTFSSMLTGW-HSZRJFAPSA-N 398.510 5.120 30 20 GKED CC[C@H](NC(=S)Nc1ccccc1S[C@@H](C)CC#N)c1cccs1 734379195 DYEIFGDQWRXXDE-KBPBESRZSA-N 375.588 5.580 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1cccc(Cl)c1Cl 734980107 HLFUIZKFNLZDQM-TWGQIWQCSA-N 384.262 5.864 30 20 GKED CCCOc1c(/C=C\C(=O)c2c(Cl)nc3ccccn23)cccc1OCC 737448187 DPJUIKAONXDKBS-QXMHVHEDSA-N 384.863 5.071 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N(Cc3ccccc3)C3CC3)c2)s1 740483913 ZHHDZFRHVUBSOE-UHFFFAOYSA-N 387.508 5.161 30 20 GKED O=C(/C=C\c1cnn(Cc2ccccc2Cl)c1)c1cccc(-c2ccncc2)c1 741472798 KIFUMBRGKRFXSQ-HJWRWDBZSA-N 399.881 5.543 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1cccc(Cl)c1 744031398 VWAGCKDGOIVQCH-IINYFYTJSA-N 395.673 5.098 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)c1ccco1 744037741 ZTCVIJJFIOHLDE-BMECOQMASA-N 380.513 5.184 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](c3ccccc3)C(C)C)n2)cc1 744061756 OBIHTRADLNRXOU-PZJWPPBQSA-N 390.508 5.435 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/c3ccnc(Cl)c3)cc2)cc1 757941699 IBXAGDFZMZFOQM-XCVCLJGOSA-N 375.815 5.051 30 20 GKED N#CCOc1cccc(CC(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c1 760331938 WJGUHCWBSDLHHJ-UHFFFAOYSA-N 392.842 5.216 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1csc2ccccc12 767216196 IPEXJIXPFZKKHJ-INIZCTEOSA-N 387.508 5.333 30 20 GKED CC(=NNc1cc(C#N)cc(Cl)n1)c1sc(-c2ccc(C)cc2)nc1C 768375762 PYMDZLGCSLFFGJ-UHFFFAOYSA-N 381.892 5.183 30 20 GKED C#CCCCCC(=O)N(CC)[C@H]1CCSc2ccc(Br)cc21 773335487 ZXPNPXGXTFMVTF-INIZCTEOSA-N 380.351 5.028 30 20 GKED C[C@@H](Oc1cccc2ccccc12)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 774089048 HXLYCYGOJRPVPI-DYVFJYSZSA-N 390.439 5.232 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2ccc(Br)cc2)C2CC2)c1 774449378 PEOSTKWQLAATDY-FPOVZHCZSA-N 399.332 5.371 30 20 GKED COc1ccc(/C=C2/CCc3[nH]c4ccccc4c3C2=O)cc1OCCCC#N 781551107 GGBXLWSOVOAXFU-VKAVYKQESA-N 386.451 5.072 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCSc2ccc(Cl)cc21 788353879 CGPDQGMTXOIFRB-VMPITWQZSA-N 375.824 5.577 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(C)c(Br)s2)c1 796307296 JXKFOZXLZYRTCP-UKRRQHHQSA-N 393.350 5.351 30 20 GKED N#C[C@@H](C(=O)[C@H](F)CC1CCCCC1)c1nc(-c2c(F)cccc2F)cs1 796668965 BTJMHDVRKLLUKW-XJKSGUPXSA-N 392.446 5.573 30 20 GKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccn1 810556021 WYXVCSJEXQRJGL-UONOGXRCSA-N 397.450 5.243 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1nc2ccccc2n1C(F)F 812442468 CYMFYVXOAVGDLF-UHFFFAOYSA-N 383.427 5.391 30 20 GKED C[C@@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1(F)F 817713606 UIOHJSORCJDBAD-BMIGLBTASA-N 387.238 5.338 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(C(C)(C)C2=CCCCC2)no1 818423702 GEPDELGBDDNGAZ-INIZCTEOSA-N 388.512 5.107 30 20 GKED CC(C)n1ncc2c(C(=O)Nc3cc4ccccc4cc3C#N)cc(C3CC3)nc21 839434222 BBZWRILIJMMICJ-UHFFFAOYSA-N 395.466 5.167 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccccc1C(F)(F)F 845841857 QUIJOMXQEDKJNS-FDPSAONLSA-N 397.396 5.118 30 20 GKED N#CCCCCC(=O)O[C@@H](CC(F)(F)F)c1ccc(Br)cc1 846870133 YFLZTWLPNVZVMY-ZDUSSCGKSA-N 378.188 5.070 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 854460127 DDCWMXYAUULYRO-CEXWTWQISA-N 391.556 5.361 30 20 GKED O=C(c1ccc(C2SCCCS2)cc1)N(O)Cc1cccc2ccccc12 901371474 UTBCBHHKSCJFTP-UHFFFAOYSA-N 395.549 5.740 30 20 GKED Cc1c(-c2nc(-c3ccc(Br)o3)no2)sc2ccc(C#N)cc12 904628341 GEXBLJTVYHKLJM-UHFFFAOYSA-N 386.230 5.154 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915086231 IGZVZMVVMLSSQU-XMMPIXPASA-N 396.490 5.561 30 20 GKED Sc1nnc(Cc2cccc3ccccc23)n1N=Cc1ccc2ccccc2c1 916278156 CWASPNODAKQFIU-UHFFFAOYSA-N 394.503 5.346 30 20 GKED O=C1Nc2ccccc2C12CCC(=NNc1nc(-c3ccccc3)cs1)CC2 917542807 SEMWFZBXTUBIMK-UHFFFAOYSA-N 388.496 5.042 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cccc(Br)c3)o2)cc1 1776114146 HIQWJJIXIICKND-NTMALXAHSA-N 397.224 5.303 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)cc1 1776119850 NDEPZTBNTIVVSW-YRNVUSSQSA-N 387.273 5.341 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2OC)cc1 1776125314 DGVKFXLOTFIXPF-NTCAYCPXSA-N 396.483 5.639 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(F)c1)C(=O)O 1776170711 DEHHSHXZQFOOIV-GOSISDBHSA-N 395.833 5.310 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCOc4ccccc4C3=O)s2)cc1 1777671018 SUAMCTSXMCXKKB-DTQAZKPQSA-N 376.433 5.162 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc4c3CCCC4)n2)cc1 38189341 PNEXNPOQKSYQAI-INIZCTEOSA-N 378.522 5.549 30 20 GKED C[C@H]1CCCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161448 WHLJPMHOTRODON-LAUBAEHRSA-N 377.488 5.032 30 20 GKED CSC[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67001709 VSPDCYGDPKNVNO-JOYOIKCWSA-N 385.341 5.292 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H](C)c1cccnc1 68547065 UFEHNXRJZXOIRV-KRWDZBQOSA-N 386.455 5.279 30 20 GKED C=C(C)CN(CC)Cc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 102681347 SONXRAJIDZOARZ-UHFFFAOYSA-N 397.466 5.245 30 20 GKED CC(C)c1ccc(Sc2ccc(NC(=O)C3(C#N)CCOCC3)cc2)cc1 109141952 QQZCKSZLUSVUPO-UHFFFAOYSA-N 380.513 5.220 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3CCC[C@H]3C2)cc1Cl 120439734 KUTIZTNUPIAOJP-FUHIMQAGSA-N 379.891 5.259 30 20 GKED Cc1nc(Cl)sc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 129229149 KAKDKPULCFWRHT-UHFFFAOYSA-N 385.901 5.056 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 174159599 PXJLNNSRLMNUHL-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ncc(Br)s1 180220880 UVFFMBNSSHKWFK-CYBMUJFWSA-N 398.329 5.295 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)Nc1ccccc1O[C@H](C)C#N 184488487 LOOOMFMMNUIUTH-CYBMUJFWSA-N 378.457 5.053 30 20 GKED N#Cc1cccc(COc2cccc(NCc3cn4cc(Cl)ccc4n3)c2)c1 195708896 OBSQRZOUAIBLSC-UHFFFAOYSA-N 388.858 5.050 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc([N+](=O)[O-])c2)cc1OCc1ccccc1 212544114 QCVSBNSPLRAURN-BENRWUELSA-N 389.407 5.079 30 20 GKED CCCc1ccc(C(=O)/C(=C(\S)N[C@@H]2CCCC[C@@H]2C)[n+]2ccccc2)cc1 280503679 CYEBDQLZFWYAGO-GHTZIAJQSA-O 395.592 5.034 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301764418 QLPSYNOUEHHXRJ-KBXCAEBGSA-N 380.900 5.834 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3c(Cl)nc4ccccn34)cs2)c1 303763515 HXMDBNIGMUPPJW-CMDGGOBGSA-N 395.871 5.016 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)/C(O)=N/[C@@H]1CCO[C@H](C(C)(C)C)C1 330530124 ZRPZERRDUGVLEI-XHSDSOJGSA-N 381.586 5.075 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1 368576916 SYRGEDXSBHYRQG-VFNWGFHPSA-N 399.441 5.071 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c2[C@H](C)C1 411015034 PZQBQFIUDUSPIO-HTQZYQBOSA-N 385.436 5.033 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)c1 429781940 CXNDGPUZZNYBOW-UHFFFAOYSA-N 395.871 5.395 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1cccc(C#N)c1C 432257336 JUCDEKIIRRSXEO-OAHLLOKOSA-N 376.485 5.181 30 20 GKED C[C@H](SCC(=O)N(Cc1cccc(F)c1)C(C)(C)C)c1ccc(C#N)cc1 437276022 MLUULYYSKMJAMH-INIZCTEOSA-N 384.520 5.319 30 20 GKED CC(C)c1ccccc1NC(=O)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 439393104 ORCBKGFRPWQEBT-UHFFFAOYSA-N 399.450 5.051 30 20 GKED Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 444911378 ZGYBNJDQZYLXCO-QZTJIDSGSA-N 381.545 5.484 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cc(F)ccc1F 463143835 UHWYZZDUKXMQJR-UHFFFAOYSA-N 378.378 5.118 30 20 GKED N#CCc1ccc(NC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)cc1 463436558 MCRMEHHAMACRQG-UHFFFAOYSA-N 397.261 6.104 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](c2ccc(C)cc2)c2ccccn2)c1 471279912 OURBMHJQEWFZIE-QHCPKHFHSA-N 387.483 5.256 30 20 GKED COc1csc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1 473733632 LTOYIQALCWVYGO-UHFFFAOYSA-N 398.871 5.113 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)C[C@H](CC#N)c2ccccc2)cc1 474413974 NRQZYKWJVPMZEW-JTHBVZDNSA-N 376.500 5.226 30 20 GKED N#CC[C@H](CC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1ccccc1 475380873 PAMCSCJDKNBWIP-HSZRJFAPSA-N 380.491 5.543 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC(c3ccc(Cl)cc3)CC2)c1 476467163 KLZJPOZJMNGNFL-UHFFFAOYSA-N 396.918 5.167 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)c1 482187140 UEVVDUAJQUTDIF-SFHVURJKSA-N 388.467 5.275 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC[C@H](c3ccccc3F)C2)c2ccccc21 482868893 RLLGIOCXAMZOQM-ROUUACIJSA-N 389.474 5.150 30 20 GKED N#C[C@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1nc2ccccc2o1 483476928 IIDKCGORGZSCED-MRXNPFEDSA-N 379.375 5.126 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 486230994 JYQBMBSBZRAQSU-UHFFFAOYSA-N 378.453 5.062 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl)c1c[nH]c2ccccc12 486429071 UQTVEWYJKNJNLA-XIKOKIGWSA-N 386.282 5.349 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)cc1 486852590 LFEQLVOKRSZLHQ-UHFFFAOYSA-N 389.436 5.064 30 20 GKED C[C@@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(Br)c1 487157409 PEODNLSXCLQSBN-BEFAXECRSA-N 385.305 5.104 30 20 GKED CC(C)C[C@@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 487376848 LJPMWWKFYKRBOB-WIYYLYMNSA-N 395.572 5.396 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1csc2ccccc12)c1ccccc1 487501351 LLJVSVNYKQUUSE-OAQYLSRUSA-N 376.525 5.775 30 20 GKED Cc1ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)N(CC#N)C2CC2)cc1 495517537 RMBYPBIMTHACAL-MNDPQUGUSA-N 393.490 5.158 30 20 GKED CC(C)[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccncc1 499850301 SEFGQPPCTXYPGX-QFIPXVFZSA-N 389.430 5.263 30 20 GKED C[C@H]1CCC[C@@H](CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 508248134 OBVSNCAAUYRMLU-FXAWDEMLSA-N 378.541 5.407 30 20 GKED CC(C)(CCC#N)CNC(=O)NC1(c2ccc(C(F)(F)F)cc2)CCCC1 513109403 YMVBYIQGTQOALS-UHFFFAOYSA-N 381.442 5.104 30 20 GKED C[C@H](N[C@@H](C)c1c(F)cncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 513237282 XIKPENQGBFBMCO-IUCAKERBSA-N 398.297 5.809 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4nccc(C)c4c3)n2)cc1 513642477 LVQMCARJBUJSOG-LJQANCHMSA-N 383.476 5.465 30 20 GKED C[C@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCCCCC#N)nnc1-c1cccs1 514588801 FKDYNXZZUSVUHO-LTIDMASMSA-N 386.590 5.790 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-n4cccc4)cc3)n2)cc1 516714154 REZFCDBEKKDAHU-FQEVSTJZSA-N 399.475 5.099 30 20 GKED N#C[C@H](NC(=O)c1ccc(F)c(C(F)(F)F)c1)c1ccc(Cl)c(Cl)c1 518320242 CLKBIEPZUPUWPC-AWEZNQCLSA-N 391.151 5.146 30 20 GKED C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 520326181 QLMRBVKUSUOPIO-GOSISDBHSA-N 399.494 5.232 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)n1cccc1 520498240 YBBSMUFRHDPWJB-JXFKEZNVSA-N 377.875 5.387 30 20 GKED COCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](C)c1ccccc1 521259845 SCZYHMYLEVYHHO-ZWKOTPCHSA-N 397.544 5.180 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CC(C)(C)C)c1ccccc1 521696203 KAIMXRXZZNKXOB-QFIPXVFZSA-N 375.516 5.433 30 20 GKED C[C@H](N[C@@H](C)c1cc2ccccc2s1)C(=O)Nc1sc2c(c1C#N)CCC2 526944637 IELVUWLQUXVDCH-STQMWFEESA-N 395.553 5.001 30 20 GKED Cc1cccc(F)c1NC(=O)COc1cc(C(F)(F)F)cc(C(F)(F)F)c1 540641736 HCIOSQIPWXQGQA-UHFFFAOYSA-N 395.274 5.189 30 20 GKED C[C@@H](NCc1nc(-c2ccc(F)cc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541085371 CBQGHJOSCUDXHJ-MRXNPFEDSA-N 398.441 5.265 30 20 GKED CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nccs1 542964248 KVCFUKYJOCZWFE-YWZLYKJASA-N 390.512 5.193 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)N[C@H](c1ccccc1)c1cccs1 543031069 YQOUEMAOIXYISG-HXUWFJFHSA-N 398.940 5.271 30 20 GKED Cc1nc(C2CC2)oc1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 546072658 JCRAIPYYEBDWCO-UHFFFAOYSA-N 391.858 5.233 30 20 GKED CC[C@H](CC#N)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 546585879 VERFSIKEDVPYLN-UTZKEFOASA-N 387.508 5.205 30 20 GKED Cc1noc(C2CC2)c1NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 546637567 VAEABVCZQWNCSB-CQSZACIVSA-N 386.455 5.282 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1ccc2ncsc2c1 548599958 KSJWGUHESJTQOW-UONOGXRCSA-N 396.541 5.431 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 549299372 CWVFZTVEFXRXEL-IAGOWNOFSA-N 394.540 5.519 30 20 GKED C=C(C)Cn1c([C@@H](C)CC)nnc1N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 549665557 PQIQZEFTTPTTKX-JKSUJKDBSA-N 397.498 5.032 30 20 GKED CCC[C@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccn1 549757101 UJUSNMNQLXEHMP-QFIPXVFZSA-N 399.494 5.249 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(-c2nc3ccccc3s2)cn1 553134881 ZGNWBNQREZJEDA-UHFFFAOYSA-N 387.464 5.175 30 20 GKED C[C@H]1c2nnc(C3CCCC3)n2CCN1Cc1ccc(-c2ccccc2C#N)cc1 553954355 PLLRVCPTYMTKAQ-SFHVURJKSA-N 397.526 5.051 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)CC2CCC(=O)CC2)cc1 564709367 UBLMVVFOGSRLKF-UHFFFAOYSA-N 398.915 5.451 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3ccc(Cl)c(C#N)c3)c2C(C)C)cc1 568821495 SKKBBIBPONIQFE-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(Cl)c(C(F)(F)F)c1 570604808 SMAHTAFMGRNUPY-AWEZNQCLSA-N 380.797 5.409 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)oc2c(C)cccc12 574746716 XFTYCZUNYZIFNH-UHFFFAOYSA-N 383.407 5.361 30 20 GKED N#CCc1ccc(CS(=O)(=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 579603831 PMXBILYLXVHMAQ-JOCHJYFZSA-N 395.911 5.110 30 20 GKED CN(C(=O)c1cc(-c2cccc(C#N)c2)no1)C1c2ccccc2-c2ccccc21 580514098 BFVHTNLTJSKNAP-UHFFFAOYSA-N 391.430 5.055 30 20 GKED N#CCCC[C@@H](NCc1noc(-c2c(F)cccc2Cl)n1)c1ccccc1 592121694 BGIZWLNOQPCEFM-QGZVFWFLSA-N 384.842 5.054 30 20 GKED N#CC1(c2cccc(-c3cc(F)ccc3OCc3ccccn3)c2)CCOCC1 592986504 IJVGYFQZAYRARC-UHFFFAOYSA-N 388.442 5.038 30 20 GKED C=CCN(C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 592998232 IRIDBYPRBMXKSK-UHFFFAOYSA-N 390.430 5.467 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)Oc1ccccc1 603533043 NUGQSXQJELFCCZ-GOSISDBHSA-N 388.442 5.007 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)nc1)c1nc2cc(F)ccc2s1 603627382 BRYUNLODGBOIQW-MRXNPFEDSA-N 389.411 5.113 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)c1 606944557 UUJWHUAROIEDCE-INIZCTEOSA-N 377.444 5.179 30 20 GKED CCN(Cc1cccs1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208635 ARYRAVPVBOSPHC-UHFFFAOYSA-N 377.469 5.466 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1c(Cl)cccc1Cl 609287079 JQZKVACXYCJPGT-HNNXBMFYSA-N 378.646 5.123 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1 609398746 NSDCOMCCSSGIAS-QVKFZJNVSA-N 395.528 5.220 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CC3(CC(=O)O)CCCCC3)cc2)c1 609432550 YDSGQDHEYQSAQD-UHFFFAOYSA-N 392.455 5.104 30 20 GKED CS[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 610042298 ROKVMUONAZCZEY-JOCHJYFZSA-N 388.492 5.702 30 20 GKED C[C@@H](N[C@H]1CCc2c(Cl)cc(Br)cc21)c1cccc(C#N)c1 611166867 PHDSDBCAFKEJGX-ZMZPIMSZSA-N 375.697 5.312 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 657529403 VMXHMQWAINNTGE-JXFKEZNVSA-N 387.524 5.191 30 20 GKED C=CCC[C@H](NC(=O)[C@@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676730110 ALEXZCYNADTKIJ-SJCJKPOMSA-N 380.410 5.237 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(OCc3ccc(F)cc3)cc2)ccc1O 727685185 CNWHFAPBIPTGDU-UUILKARUSA-N 378.399 5.015 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(CCc3ccccc3)C3CC3)c2)cc1 728463966 ARHMMCWGHWDEPZ-UHFFFAOYSA-N 382.463 5.198 30 20 GKED C#CCOc1cccc(NC(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 731108943 HZFMRFZUWHMSQL-INIZCTEOSA-N 391.496 5.013 30 20 GKED COc1ccc(OCc2nc(/C=C/C(=O)c3ccc(F)cc3C)cs2)cc1 731321502 HETLOBNBJJCFJJ-ONNFQVAWSA-N 383.444 5.074 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)/C=C/c1cnc(C(C)(C)C)s1 742595095 DGSRBBGKRRSDJH-ZHACJKMWSA-N 381.545 5.010 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1cc(Cl)sc1Cl 743057070 PNQGDJYFSBISQK-ZZXKWVIFSA-N 377.252 5.533 30 20 GKED C=CCn1c(-c2cccnc2)nn(CN(CCCC)C2CCCCC2)c1=S 746044071 GVVFKIMIJQDIIP-UHFFFAOYSA-N 385.581 5.054 30 20 GKED O=C(Cc1ccc(F)cc1)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746441837 ZLPXPYYCMYVTPZ-HNNXBMFYSA-N 380.259 5.234 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2cnn(-c3ccccn3)c2C)cc1 748441245 KKSTYRYXVPDFLG-NTCAYCPXSA-N 395.462 5.147 30 20 GKED N#C[C@@H](COC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)Cc1ccccc1 751866718 JLWCABZEXJSURY-XGNNGGHXSA-N 391.433 5.061 30 20 GKED CC(C)(C=NOc1ccccc1C(F)(F)F)[C@@H](C[N+](=O)[O-])c1ccccc1 754712764 SIUDRQMVBFGYCG-INIZCTEOSA-N 380.366 5.157 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3sccc3c2)cc1 761035913 IACAFDVGJJRNJP-AUUYWEPGSA-N 376.481 5.376 30 20 GKED C=CC[C@@H](N[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1)c1ccncc1 766022539 WUGQNKRBPUWXJB-HOYKHHGWSA-N 376.475 5.768 30 20 GKED C[C@@H]1C[C@@H]1[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)cc1 776026569 OWVFVPGECAAUTN-ORPRQENYSA-N 375.299 5.383 30 20 GKED CN(C)C(=O)Sc1ccc(CSc2ccc(C#N)c(C(F)(F)F)c2)cc1 782239128 ZMUOIRXUKRCCJT-UHFFFAOYSA-N 396.459 5.643 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C\c1cnc(-c3ccncc3)s1)C2 782368459 GQDRFIOCGKSSOU-ZROIWOOFSA-N 397.297 5.098 30 20 GKED N#C[C@H](C(=O)[C@H]1CC[C@H](C(F)(F)F)C1)c1nc(-c2ccc(Cl)cc2)cs1 796799392 TXMFGZNPWDFOBE-SGMGOOAPSA-N 398.837 5.618 30 20 GKED C[C@@H](O)c1cc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 804803960 VAZRBCLGQIVOKL-MRVPVSSYSA-N 395.274 5.169 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccc(Cl)cc1F 806344718 KVIIVVWHSJWAPB-INIZCTEOSA-N 398.787 5.470 30 20 GKED C=C(C)C[C@@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 901682058 QQNCAXVSYMCDNX-LJQANCHMSA-N 377.843 5.089 30 20 GKED CCOc1cccc(/C=N\C2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1O 914703694 XFFMUELOZDDMSD-UPAHXGKCSA-N 383.332 5.119 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3cc4cccc(OC)c4o3)cs2)c1 916129889 BGHRHXPNYMSRKV-MDZDMXLPSA-N 391.448 5.470 30 20 GKED Cc1ccc(Nc2nn(CN(CCC#N)CC(C)C)c(=S)s2)cc1Cl 919944362 DJUUVFJWWNJYPG-UHFFFAOYSA-N 395.985 5.209 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140847 CJWDWQSSNVJZPI-RTBURBONSA-N 376.481 5.189 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3cnc(C(F)F)s3)cc2)cc1F 1776077150 XHRYXPJJUUQNIH-UHFFFAOYSA-N 391.374 5.031 30 20 GKED O=C(/C=C/c1cccc(C(=O)O)c1Cl)c1ccccc1OCc1ccccc1 1776126317 IWGSDPBUIYUTET-BUHFOSPRSA-N 392.838 5.513 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C/C(=O)c3csc(C(=O)O)c3)o2)cc1 1776271485 SZJHHSSVCRPWKH-CSKARUKUSA-N 380.465 5.900 30 20 GKED CCCCCCCOc1ccc(CNc2ccc3nccc(C(=O)O)c3c2)cc1 1776789247 YEBAUDKWRRSUBO-UHFFFAOYSA-N 392.499 5.894 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1nc2ccccc2s1 51897367 MOEUPYOEOHWJAV-GFCCVEGCSA-N 395.896 5.563 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1-c1ccccc1)Cc1ccc(C#N)cc1 63750984 NIYJXKMRFBTMLT-UHFFFAOYSA-N 383.495 5.074 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(-c3ccco3)nc3ccccc23)c1 71975188 SVVAZRSTAABAFD-UHFFFAOYSA-N 397.434 5.430 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1 108501191 NWJVHGUZHXOGON-SFHVURJKSA-N 386.495 5.262 30 20 GKED CCOc1ccccc1CN(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108531086 NIGMBIPMADMVJV-INIZCTEOSA-N 383.517 5.001 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1coc(-c2cccs2)n1 109028157 OYBZMJVODVHRNS-ZDUSSCGKSA-N 398.513 5.119 30 20 GKED N#C[C@H](NC(=O)CCCCC(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1 112910652 KWVDNWWXIJXFFB-SFHVURJKSA-N 389.282 5.118 30 20 GKED COc1ccc(CNc2ccc(N3CCCC3)c(Cl)c2)cc1OCCCC#N 124736185 IALPRSIHXWWABM-UHFFFAOYSA-N 399.922 5.243 30 20 GKED Cc1nc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)s1 151636853 KNAKKRCCQYXOCR-GOSISDBHSA-N 395.915 5.250 30 20 GKED C=CCOCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 173989794 IPXVFMBFXJAMEJ-CQSZACIVSA-N 395.311 5.276 30 20 GKED COCCC(C)(C)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 183938158 GJKXNUMLYZERMD-LJQANCHMSA-N 399.922 5.180 30 20 GKED CSCc1cccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 188171212 WCSRXLBENUQAQO-OAHLLOKOSA-N 385.558 5.266 30 20 GKED N#Cc1cccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)c1 236745332 BLQSLVSVCOLKSR-OAQYLSRUSA-N 377.285 5.200 30 20 GKED COc1ccc(-c2ccc(CNCc3ccc(N(C)CCC#N)cc3)s2)cc1 237432693 GDAIEPVHMJGXLE-UHFFFAOYSA-N 391.540 5.063 30 20 GKED CC[C@@H]1C[C@@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 245743488 SAWMXVGWXIHSOJ-ILZDJORESA-N 382.891 5.139 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 255948636 RTKAPMFYAIJKIU-UHFFFAOYSA-N 392.911 6.065 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)c(F)c2)cc1Cl 302947034 MYGAYEYBBXBXDL-KRWDZBQOSA-N 382.797 5.526 30 20 GKED C[C@@H](/C(O)=N/[C@H]1CCC[C@@H](C)[C@H]1C)N1CCC([C@@H]2C(O)=Nc3ccccc32)CC1 328723812 YFEZJSIAZFDKFI-JIKKJMIASA-N 397.563 5.254 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1 368576911 SYRGEDXSBHYRQG-BTYIYWSLSA-N 399.441 5.071 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c2[C@H](C)C1 411007268 FWYZLQHNWMAAGB-CHWSQXEVSA-N 381.526 5.174 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1c[nH]nc1-c1ccc(C(F)(F)F)cc1 418146413 PIBMRHCHCJOWRG-FQEVSTJZSA-N 396.416 5.134 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(CN3CCc4ccccc43)cc2)c1 429780519 AQKJCVQAHCZNRU-UHFFFAOYSA-N 399.519 5.117 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] 433145168 PIPITEVIFXVQNU-CQSZACIVSA-N 398.488 5.046 30 20 GKED CC(C)Oc1ccc(NC(=O)c2c[nH]cc2-c2ccc(Cl)s2)cc1C#N 435680438 DJJXIMNUAZBLMM-UHFFFAOYSA-N 385.876 5.308 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 436413098 HGJTUHZOTFPETQ-IBGZPJMESA-N 396.490 5.677 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(OC2CCCC2)c1 437907703 KIESAMHYOMBJJS-GOTSBHOMSA-N 389.499 5.312 30 20 GKED C[C@@H]1CCN(C(=O)NCC2CCC(C#N)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 440999759 CNWDPWMYYKAUKW-XTUQQUOLSA-N 393.453 5.128 30 20 GKED Cc1ccc(-n2c(S[C@@H](C)c3cccc(C#N)c3)nnc2-c2ccncc2)cc1 442915997 UBCHOGURXBAAJP-KRWDZBQOSA-N 397.507 5.363 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCC(=O)c1csc2ccccc12 446091139 OAFLACSJFRFGLY-UHFFFAOYSA-N 390.508 5.173 30 20 GKED CCc1nc2c(s1)[C@H](N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1)CCC2 458794592 BHRHXBSCKOCIHF-PKOBYXMFSA-N 396.560 5.159 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2cc(Cl)ccn2)c1 460332891 UFOQEEPKQGKPQS-UHFFFAOYSA-N 382.250 5.107 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 463717646 VRXDVJTWLJLQAU-UHFFFAOYSA-N 387.201 5.394 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cscc1-c1ccccc1 463948885 JXQXPYMJEMDIHG-OAHLLOKOSA-N 378.522 5.919 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469226182 FBRFEXTWUMZKBE-GJZGRUSLSA-N 393.874 5.131 30 20 GKED N#Cc1c(NC(=O)c2ccc(Cl)cc2C(F)(F)F)sc2c1CCCCC2 471362552 PBKGWNFVPDBYCZ-UHFFFAOYSA-N 398.837 5.813 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 476117368 IOOMVDDVIDNCLJ-UHFFFAOYSA-N 396.490 6.455 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1 476322203 QSUCJAZORDDFSB-NRFANRHFSA-N 389.886 5.056 30 20 GKED C=CCCC1(C(=O)Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)CC1 476449984 RSCVGBHRCIEVDY-UHFFFAOYSA-N 393.874 5.760 30 20 GKED N#CC[C@H](CC(=O)N1CCCCC[C@H]1/C=C/c1cccs1)c1ccccc1 476671588 OOYDOAXDERKTKR-NOBHMXGUSA-N 378.541 5.620 30 20 GKED Cc1c(C#N)c(NC(=O)CSCCC(F)(F)F)n(C2CCCCC2)c1C 478734702 PHKUNCMCEGRFND-UHFFFAOYSA-N 387.471 5.106 30 20 GKED CCOc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1OC 482127370 USPGMYPKMGJNTJ-UHFFFAOYSA-N 388.423 5.010 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(F)cc(F)cc1Br 487194079 ICTKSFDUOPAIJO-UHFFFAOYSA-N 399.210 5.087 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(C(=O)N2CCCCC2)c1)c1ccccc1 488678656 VYOFHWKYIPQSDN-JOCHJYFZSA-N 376.500 5.001 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1ccccc1C 488881301 NXARZTRTMOBQJR-UHFFFAOYSA-N 394.525 5.448 30 20 GKED N#CCN(C(=O)c1cccc(OCc2cccc(Cl)c2)c1)c1ccccc1 495490421 HURZMQMVIMWGLK-UHFFFAOYSA-N 376.843 5.089 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](C)c1ccc(C(F)(F)F)cc1 495627083 VVMWIKPDAWKPDZ-GJZGRUSLSA-N 396.478 5.021 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NCCCC3(C#N)CCOCC3)cc2)c1 499602086 JEZBFWUNYWZQNO-OAQYLSRUSA-N 392.543 5.325 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 510427177 HYZFBJBZQGTOTJ-QFIPXVFZSA-N 393.531 5.276 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(Br)cc1F 513051250 KXMMGVWWSANBRW-CQSZACIVSA-N 391.284 5.122 30 20 GKED N#CC1(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)CCCCC1 514239576 OEAYIZCWKIDCMM-UHFFFAOYSA-N 387.719 5.818 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccccc1Br 518146915 OAMIDOJHVUDNBZ-KGLIPLIRSA-N 375.335 5.874 30 20 GKED CCOc1ccc(-c2nc(CC)c(C(=O)Nc3scc(C)c3C#N)s2)cc1 520884321 SZYCKMWIMCEQQH-UHFFFAOYSA-N 397.525 5.265 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@H]1CCc2ccccc21 521957108 QXYPCNMHSSALCR-LJQANCHMSA-N 384.504 5.169 30 20 GKED CCC(CC)CN(CCC#N)C(=O)CCc1nc2cc(Cl)ccc2s1 521957869 YDRRYUNTDQAATP-UHFFFAOYSA-N 377.941 5.061 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](c1cccnc1)C1CC1 534777141 QPRGASRHQKEVPL-QHCPKHFHSA-N 398.466 5.327 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1C1CC1 535532171 HHSDTWZZDAACPC-AWEZNQCLSA-N 396.560 5.576 30 20 GKED N#Cc1ccccc1OC1CCC(N[C@@H](c2ccccc2)c2ccccn2)CC1 539813661 ZIQFHZHLECOHAM-OWWUNANSSA-N 383.495 5.022 30 20 GKED CC(C)c1oc([C@H]2CCCN2Cc2ccc(CC#N)cc2)nc1-c1ccccc1 541282743 SDOVIFIZIOTQFA-JOCHJYFZSA-N 385.511 5.868 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N2CCC(CC#N)CC2)cc1F 541972200 VMSFAHLEDNLSTR-UHFFFAOYSA-N 397.450 5.093 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1ccc(Cl)s1 544813854 AIFXGCXSNQAJHH-UHFFFAOYSA-N 377.922 5.050 30 20 GKED N#CCCn1cc(/C=C/c2nc(CSCc3ccco3)no2)c2ccccc21 546949417 AWEKZTAVCZKQIL-CMDGGOBGSA-N 390.468 5.135 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1c(CC)ccc(Cl)c1CC 554053959 OJFAVKFCHNCBQR-UHFFFAOYSA-N 390.911 5.160 30 20 GKED COc1ccc(-c2nc(CSc3cccc(F)c3C#N)cs2)cc1OC 555874465 ZHYOXOHPFFYVJE-UHFFFAOYSA-N 386.473 5.130 30 20 GKED CCSc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cn1 561286856 SCPFQSOQXIHKJB-UHFFFAOYSA-N 391.521 5.145 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1c[nH]c2ccccc12 562190859 ZLDZTOIACWGCBF-INIZCTEOSA-N 396.450 5.359 30 20 GKED COc1ccc2cccc(Cc3noc(C[C@@H](CC#N)c4ccccc4)n3)c2c1 563478984 HFKCLHHTYIBCDJ-LJQANCHMSA-N 383.451 5.062 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567203585 WEJNWXXYSAOFLV-HKUYNNGSSA-N 398.466 5.155 30 20 GKED C=CCC1(C(=O)Nc2nc(-c3ccccc3)c(-c3ccccc3)o2)CCOCC1 570039710 WZACDEDBNDXFMQ-UHFFFAOYSA-N 388.467 5.320 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1cccs1 570539879 WJZWYQMAEXJAFG-KDOFPFPSSA-N 385.558 5.615 30 20 GKED C[C@H](NC(=O)c1cc(C#N)ccc1Cl)[C@@H](C)c1ccccc1C(F)(F)F 571509229 HFOJNVLXTVXCGX-NEPJUHHUSA-N 380.797 5.152 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@H]1c1cccc(F)c1 578177128 CDAPHULKYKOXOX-NRFANRHFSA-N 399.473 5.160 30 20 GKED C=CCn1c(-c2sc3ccccc3c2Cl)nnc1N1CCC(CC#N)CC1 581381768 DIRHXVGAYWIODO-UHFFFAOYSA-N 397.935 5.129 30 20 GKED CCC(C#N)(CC)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 599496794 KGKLOIFWWHOIQC-UHFFFAOYSA-N 395.356 5.300 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc4ccc(F)cc4s3)s2)cc1 602228880 IIWHRLNROKMIEX-UHFFFAOYSA-N 393.468 5.212 30 20 GKED Cc1ccc2nc(-c3ccc(NC(=O)c4cccc(CC#N)c4)cc3)sc2c1 603726721 ZKYSWFZXGGSPSS-UHFFFAOYSA-N 383.476 5.590 30 20 GKED CCc1onc(C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604026624 DNPHDNDUVLXMIQ-UHFFFAOYSA-N 381.819 5.115 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(-c4ccccn4)s3)cc2)cc1 609011666 AHVFKBOHSVGDJL-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(F)cc(F)c3)cc2Cl)c1 609062955 MBLZRELBTYKPAB-UHFFFAOYSA-N 398.796 5.321 30 20 GKED N#CCCN(C(=O)CCC(=O)Nc1ccccc1-c1ccccc1)c1ccccc1 609091409 LGCBVQWJJCIOCW-UHFFFAOYSA-N 397.478 5.019 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 609402859 DXJGTOXZYNTIAI-NQIIRXRSSA-N 393.556 6.088 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)sc2n1 609427561 KGUTXJJRVYVLKT-AWEZNQCLSA-N 381.526 5.560 30 20 GKED Cc1cc2cc(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)ccc2[nH]1 609515121 MXFFNIDGTWUTSM-UHFFFAOYSA-N 381.435 5.587 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC(c2ccccc2F)CC1 609864312 XBDVYQFAJTVHOH-UHFFFAOYSA-N 384.454 5.384 30 20 GKED CCN(C(=O)C[C@H](C)c1ccccc1C(F)(F)F)[C@H](C)c1ccc(C#N)cc1 610171624 XQAZPRYOSCTAAT-JKSUJKDBSA-N 388.433 5.680 30 20 GKED COc1ccc2sc(C(=O)Nc3cc(C#N)ccc3OC(C)C)c(C)c2c1 610226082 CSKUXDXFVYBMBN-UHFFFAOYSA-N 380.469 5.130 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610320804 KIJLBKROTUBQNE-KRWDZBQOSA-N 398.466 5.002 30 20 GKED COc1cc(C)c(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 622520330 OLRWNQWPBZJTQU-UHFFFAOYSA-N 395.274 5.433 30 20 GKED N#C[C@H](C(=O)c1ccnc(Oc2ccccc2)c1)c1nc(-c2ccccc2)cs1 623759108 DGRHNEUNNCAFBW-LJQANCHMSA-N 397.459 5.487 30 20 GKED O=C(NC1CCC(C(F)F)CC1)NC(CCC(F)(F)F)CCC(F)(F)F 661308794 OKULVRNGRLGHPD-UHFFFAOYSA-N 398.338 5.163 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)c1Br 682990814 ZNXAPKTXALVEGO-CYBMUJFWSA-N 385.286 5.166 30 20 GKED CCC(CC)CN(CCC#N)C(=S)N[C@@H](C)c1ccc(Cl)cc1Cl 729642255 JDSHRNZDMVWEJJ-ZDUSSCGKSA-N 386.392 5.581 30 20 GKED C[C@@H]1C[C@H]1c1ccc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)o1 732765240 XAVWQXSVSRQBSK-NOZJJQNGSA-N 393.299 5.139 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc2ccccc12 733081453 YYRFSDKIRABCRB-VAWYXSNFSA-N 386.432 5.768 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccncc1 734657014 UOAOKKIBZSGFIQ-XUZZJYLKSA-N 397.478 5.534 30 20 GKED CC(=NNc1nc2ccccc2n1C)c1ccc(SCC(F)(F)F)cc1 741761416 NPVPGTVTOQHYLJ-UHFFFAOYSA-N 378.423 5.064 30 20 GKED COc1cc(/C=C2/C(=O)c3cccc(Br)c3[C@@H]2C)cc(Cl)c1O 742434947 OGXBYDFGWSJVRA-TZZQWBKVSA-N 393.664 5.200 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 743629274 KYRJDIQYPFWGLD-SFHVURJKSA-N 390.874 5.161 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)[C@@H](C)c2ccncc2)s1 744746996 PDYCHFCKCOTAPP-HNNXBMFYSA-N 375.542 5.061 30 20 GKED Cc1cc(C(=O)N[C@H](CCC#N)c2ccccc2)cc(C)c1OCc1cccnc1 749046478 WTJWGZOBMLLHKO-HSZRJFAPSA-N 399.494 5.052 30 20 GKED C#CC[C@H](N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21)c1ccccc1 773113280 CVKNTAKEGPARTP-SFTDATJTSA-N 388.536 5.550 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)CCc2ncc(C(C)(C)C)o2)c1 776432490 ZRVLTSHBLNCUQV-UHFFFAOYSA-N 386.495 5.119 30 20 GKED N#Cc1cc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)ccc1Oc1ccccc1 777477316 UQBOVTGLCCHIAG-UHFFFAOYSA-N 390.424 5.068 30 20 GKED C=CCC[C@@H](C(=O)O[C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 778554038 ZJFLNTJGKGNVNO-FXAWDEMLSA-N 376.456 5.015 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(OCC#N)cc1 782779432 YNFFETGXRUFAMI-RTBURBONSA-N 381.479 5.539 30 20 GKED N#CCCCOc1cccc(NC(=S)Nc2cccc(OC(F)(F)F)c2)c1 783724091 CRYPDKBGJMIADP-UHFFFAOYSA-N 395.406 5.077 30 20 GKED CCCc1c(NC(=S)Nc2c(C)cccc2C)cnn1-c1cccc(C#N)c1 783952278 GDQRCIIVIKNKIB-UHFFFAOYSA-N 389.528 5.122 30 20 GKED O=c1[nH]ccc2cc(NN=C3CC[C@H](c4ccc(C(F)(F)F)cc4)C3)ccc12 789077456 SMEIRBNVCLJVCO-AWEZNQCLSA-N 385.389 5.283 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C/Sc1cc(F)ccc1F 797866565 VZVIIIMORKUYCS-DHZHZOJOSA-N 376.453 5.215 30 20 GKED N#CC1(CCCNc2ccc(Cl)cc2C(=O)c2ccccc2)CCOCC1 798389028 OUWQLYPLOVSARP-UHFFFAOYSA-N 382.891 5.083 30 20 GKED Oc1nc(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)nc2ccccc12 799483823 OEWUUEVNPZYETH-ZDUSSCGKSA-N 386.377 5.090 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC=C(c3ccncc3)C2)cc1 806201418 WRCKAKDUZQMPNG-DEOSSOPVSA-N 394.478 5.058 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(C(F)(F)F)cc1 842943715 YNRBEWGPVMRXGU-ABAIWWIYSA-N 378.419 5.409 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(SC(F)(F)F)cc1 914502139 RZMXSRYTSXGAHZ-UHFFFAOYSA-N 378.419 5.221 30 20 GKED CC(C)c1sc(NC(=O)CN(CCC#N)CC(C)(C)C)nc1-c1ccccc1 1307486190 SAPIPNWCFQBMKS-UHFFFAOYSA-N 398.576 5.134 30 20 GKED O=C(O)Cc1ccc(NN=C(CCc2ccccc2Cl)c2ccccc2)cc1 1776084544 YFPZINPZQLYQNY-UHFFFAOYSA-N 392.886 5.416 30 20 GKED C=CC[C@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)c1ccc(-c2ccccc2)cc1 1776152039 WSWIZPAGNNWTRD-YADHBBJMSA-N 379.500 5.224 30 20 GKED C=CCCCc1ccc(C(=O)Nc2ccc(C3(C(=O)O)CCCC3)cc2)cc1 1776174501 FOUXWAGIFKDGAC-UHFFFAOYSA-N 377.484 5.344 30 20 GKED CC(C)(C#N)c1ncc(/C=C(/CCCC(=O)O)c2nc3ccccc3s2)s1 1776230676 YYTMSMYBOFDVIT-RAXLEYEMSA-N 397.525 5.349 30 20 GKED CCCOc1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)c(OCCC)c1 1776818220 WDJRNFUMTQDJFA-YULVEUEDSA-N 394.467 5.102 30 20 GKED COc1cc(C)ccc1C(=O)/C=C\c1ccc(-c2cccc(CC(=O)O)c2)cc1 1777280781 PLRGPICYWMLVQL-LCYFTJDESA-N 386.447 5.194 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1OC 1777353264 ISTPHRJGHGUFHV-NTMALXAHSA-N 394.448 5.027 30 20 GKED O=C(O)c1ccc2scc(/C=C3\Cc4cc(Cl)cc(Cl)c4C3=O)c2c1 1777685791 YHNRSDJJULWTHB-NYYWCZLTSA-N 389.259 5.729 30 20 GKED C=CCN(CC(=O)Nc1c(Cl)cccc1C(F)(F)F)Cc1cccs1 16395489 SKJRTSHVTHWIOT-UHFFFAOYSA-N 388.842 5.047 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(C)ccc2C)nnc1-c1ccoc1C 21181599 GRNMOLIBQFEICK-MRXNPFEDSA-N 381.501 5.013 30 20 GKED Cc1cc(C)cc(NC(=O)[C@H](C)Sc2nc(C)cc(C(F)(F)F)c2C#N)c1 26143275 NHUILTGJADEHJR-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nc(C)c(C)n1CC(C)C 60984763 AUEKFXYFTIFMNH-UHFFFAOYSA-N 389.590 5.165 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(F)cc1 66956317 WKFOTVLQAHHDSL-HNAYVOBHSA-N 383.492 5.589 30 20 GKED O=S(=O)(/C=C/c1ccccc1)/N=C(\O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 70030737 RHDKMCFYBDIIEI-VMFRVMOISA-N 396.295 5.054 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1[C@H](NCCCC(C)(C)C#N)C(F)(F)F 91710166 VHNRTMRPLVTAQG-SFHVURJKSA-N 378.442 5.012 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(F)cc1Cl 108529893 DQUVLNDJCJSSMC-ZDUSSCGKSA-N 391.899 5.395 30 20 GKED N#C[C@H](C(=O)Cc1ccc(F)cc1F)c1nc(-c2ccc(Cl)cc2)cs1 120112544 NBSWAPSCPCJNPK-OAHLLOKOSA-N 388.826 5.161 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 121362870 LDXLOIRWOQWJNP-CVDCTZTESA-N 390.531 5.540 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc4ccccc4[nH]3)sc2C)cc1 123120567 GEFBNCIHAWDLIO-QGZVFWFLSA-N 387.464 5.099 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N(CCC#N)Cc3ccco3)ccc2C)c1 125727894 CQKJKRMNOXDNFV-UHFFFAOYSA-N 390.443 5.032 30 20 GKED CC(C)N(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)C1CCOCC1 152993375 XKYUEPDAPLAAOG-UHFFFAOYSA-N 398.890 5.034 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1 154395240 IHFRPFYMUQHHNU-CYBMUJFWSA-N 389.846 5.043 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc(F)c2Cl)cc1 173673427 ONBOEXUNODJDLW-UHFFFAOYSA-N 394.833 5.376 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 183809846 BNKVPZAQRYMOGY-MRXNPFEDSA-N 398.422 5.285 30 20 GKED COc1cccc(NCc2nnc(S[C@H](C)CCC#N)n2C2CCCCC2)c1 188266316 OVPQHQKCEWWDKY-MRXNPFEDSA-N 399.564 5.188 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)Nc2ncccc2OCCCC#N)o1 188721209 MWGQJHADNDDKFQ-SFHVURJKSA-N 396.491 5.069 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(-n2cc[nH]c2=S)cc1 194467730 YXKOLDIOTUVAKK-UHFFFAOYSA-N 389.933 5.078 30 20 GKED CCN(C(=O)c1cc(-c2ccc(Cl)cc2)on1)[C@@H](C)c1ccc(C#N)cc1 195629440 ZRDLHOQACVBJGZ-AWEZNQCLSA-N 379.847 5.090 30 20 GKED N#Cc1c(Cl)nsc1N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21 302207687 XKKWZIAZDSRSJP-GFCCVEGCSA-N 390.896 5.420 30 20 GKED OC(=Nc1nc(-c2cc(Cl)sc2Cl)cs1)[C@H]1C[C@@]12CCOC2 329543752 FPBKNLCNSDKEMB-XLKFXECMSA-N 375.302 5.193 30 20 GKED Cc1nc(/C(O)=N/[C@@H](C)c2nc(C(C)(C)C)cs2)c(Br)s1 331328580 GXVPJSMARWUJIN-ZETCQYMHSA-N 388.356 5.034 30 20 GKED Cc1ccc(C2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CC2)cn1 371682279 XHZUMVORJKUNGG-INIZCTEOSA-N 394.544 5.053 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 390889456 KNGXNOAVLIOBMD-SNVBAGLBSA-N 389.318 5.068 30 20 GKED N#Cc1ccc(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)c(Cl)c1 426129791 SVYKTAHSTDJPRK-UHFFFAOYSA-N 379.769 5.041 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)Nc1ccc(C#N)cc1Cl 426151180 VDBHKSOZVAXXJY-UHFFFAOYSA-N 390.874 5.149 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H](c1ccccc1)C1CC1 433157295 LWVAVISAPHRFDU-QFBILLFUSA-N 379.529 5.396 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@]3(CCCc4ccccc43)C2)cc1 440266627 NXUACJFRBXPRSI-VWLOTQADSA-N 387.527 5.390 30 20 GKED N#Cc1ccc(NC(=O)c2ncoc2-c2ccccc2Cl)cc1C(F)(F)F 443892057 PNJOWMWQOKIQLD-UHFFFAOYSA-N 391.736 5.138 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C)nc3C(C)C)n2)cc1 453631177 SJHKWGVNTPKIMS-SFHVURJKSA-N 391.496 5.136 30 20 GKED N#Cc1c(NC(=O)c2c(Cl)cc(Cl)cc2Cl)sc2c1CCCC2 459842434 DEAIHXMMIRXQRO-UHFFFAOYSA-N 385.703 5.711 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1ccc([N+](=O)[O-])s1 460156968 QFFSSUGTOALUGC-UHFFFAOYSA-N 397.843 5.028 30 20 GKED C[C@H](C#N)N[C@H](Cc1c(F)cccc1Cl)c1ccccc1Br 463910773 NQHPLSICUDXSQN-PIGZYNQJSA-N 381.676 5.027 30 20 GKED Cc1ccc(-n2cc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)c(C(C)(C)C)n2)cc1 467429551 PACVRYLZTVPNOP-QGZVFWFLSA-N 398.466 5.110 30 20 GKED C=CCC(CC=C)C(=O)N1CCCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl 467822943 CWSCGUKADIKSEU-SFHVURJKSA-N 395.330 5.081 30 20 GKED C=C[C@](C)(CC)C(=O)NCc1ccc(Cl)c(NC(=O)[C@@](C)(C=C)CC)c1 467972427 ZUBPXDUNBSLBQW-RTWAWAEBSA-N 376.928 5.099 30 20 GKED C=C[C@](C)(CC)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 468025898 SJTWMRYMVIBGBD-LJQANCHMSA-N 378.394 5.111 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)c1cccc(SCC#N)c1 468297926 LZDJANPEXVHIIB-UHFFFAOYSA-N 392.446 5.072 30 20 GKED COc1cc([C@H](C)NC(=O)c2ccc(C(C)(C)C#N)cc2)ccc1OCC(C)C 474776363 OXOXBMBYAPDGFO-KRWDZBQOSA-N 394.515 5.022 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1-n1ccc(C)n1 475544085 GJHZRBNNOYNXSG-UHFFFAOYSA-N 388.515 5.354 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F 477590756 SVHGRZQBFUQKGQ-IUODEOHRSA-N 387.471 5.427 30 20 GKED CC(C)c1c(C(=O)N[C@@H](C)c2ccc(C#N)cc2)cnn1-c1ccccc1Cl 478097612 RYGKTALPYZFEHF-HNNXBMFYSA-N 392.890 5.012 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(OC(F)F)c(OC)c1)c1ccc(F)c(F)c1 480704100 ZNVREPUQTIPJPO-BUXKBTBVSA-N 383.385 5.543 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 480890753 GFBRRMVMSOQUHG-QGZVFWFLSA-N 395.443 5.450 30 20 GKED C=C(C)[C@H](NCc1nc2cc(C(F)(F)F)ccc2o1)c1ccc(F)c(F)c1 481578502 CWEHXIJERXHVSA-SFHVURJKSA-N 382.332 5.532 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1C 482804517 SVMUCEFKCGIQEP-MRXNPFEDSA-N 388.471 5.387 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 484146484 YGGBKDNCCNYXNR-CQSZACIVSA-N 394.862 5.446 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)[C@H](OC)c1ccc(Cl)cc1 486236262 XFKHTQFACIZFPH-KUHUBIRLSA-N 375.921 5.124 30 20 GKED COc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1OC1CCCC1 487498156 DBJFXYLSHCLUAJ-NRFANRHFSA-N 392.499 5.182 30 20 GKED N#Cc1c(NC(=O)CCc2ccc(OC(F)F)cc2)sc2c1CCCCC2 490429801 GYZKRGWNRJXUSS-UHFFFAOYSA-N 390.455 5.061 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 500098698 MYBOOKLPNQSAKM-ZHRRBRCNSA-N 375.447 5.384 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2nc(-c3cccs3)no2)n1 501613541 RVLZTDKLLAHRNP-VIFPVBQESA-N 396.419 5.245 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)c1cc(C)n(-c2cccc(C#N)c2)n1 502500029 TUIVVDOVNBCYFC-UHFFFAOYSA-N 392.890 5.083 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H]1CCc2ccccc21 510522558 QNYRMGLZTXPWFA-QHCPKHFHSA-N 383.451 5.468 30 20 GKED CCC(CC)N(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H]1CCCc2cccnc21 511308120 ULVZIFZJJSUCEK-QFIPXVFZSA-N 387.527 5.345 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 517138097 MSFQYJVTFZPYJJ-JOCHJYFZSA-N 395.934 5.673 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccoc3C(F)(F)F)cc2)c1 519038929 SDEXHKCLAVLEQW-UHFFFAOYSA-N 386.329 5.001 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccccc2F)n1 519516222 CYHFSVJPAIBNAT-ZDUSSCGKSA-N 397.500 5.596 30 20 GKED CCSc1ccc(Cl)cc1N[C@@H](C)C(=O)N(CCC#N)c1ccccc1 521535340 AQUCMUNYGJBMGG-HNNXBMFYSA-N 387.936 5.199 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1ccc(F)cc1F 524137458 XBUGWCVUGOPQEH-UHFFFAOYSA-N 393.393 5.368 30 20 GKED CSc1cccc([C@H](NCc2cccc(C#N)c2)c2cc(F)ccc2F)c1 525182380 OZIFISNCUPJHLE-QFIPXVFZSA-N 380.463 5.438 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](C3CC3)C2)cc1Cl 535001701 ZGQCRQCKOWYYFE-PXNSSMCTSA-N 379.891 5.259 30 20 GKED C=CCC[C@@H](NCc1nc(COc2cc(C)cc(C)c2)no1)c1ccccc1 539361198 MSUFRROCUOCMFH-OAQYLSRUSA-N 377.488 5.063 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCOc2cc(Cl)ccc21 539476763 OBVNNZGDJUEMBI-HXUWFJFHSA-N 397.906 5.046 30 20 GKED C[C@H](NC(=O)c1cccnc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 541133741 WBLSUPCTGMVDJS-AWEZNQCLSA-N 395.384 5.130 30 20 GKED C=CCC(C)(C)c1noc(/C=C/c2csc(N(C(C)=O)c3ccccc3)n2)n1 556363571 YLOQIRBHMDHNOH-VAWYXSNFSA-N 394.500 5.235 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1 558816450 MFCJFAVTAJYQCN-UHFFFAOYSA-N 391.393 5.340 30 20 GKED CC1(C)CN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)[C@@H]1c1cccnc1 561010145 OZWBJUBMZVJGBZ-JOCHJYFZSA-N 399.519 5.328 30 20 GKED C=C(C)Cn1c(-c2sccc2C)nnc1N1CCC(c2ncc(C)s2)CC1 568225011 JQWLAPKYTGCRSM-UHFFFAOYSA-N 399.589 5.040 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cn1)c1ccccc1 571972199 DXPVNFGTORSUQL-VGSWGCGISA-N 393.446 5.260 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1 579618531 ZQOPMTFIGOAEJV-CQSZACIVSA-N 382.529 5.498 30 20 GKED C=CCOc1ccc(CN[C@H]2c3ccccc3CC23CCOCC3)cc1Cl 580015854 FTZXVHMWGMSVKI-QFIPXVFZSA-N 383.919 5.089 30 20 GKED Cc1nc(NC(=O)Nc2cccc(OCCCC#N)c2)ccc1-c1ccccc1 581435919 WDHMXYXFMOHRIL-UHFFFAOYSA-N 386.455 5.384 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1ccccc1SCc1cccs1 582019317 IVRXEVMWOCRDMA-UHFFFAOYSA-N 379.510 5.206 30 20 GKED CC(C)n1c([C@H]2CCCN(C(=O)CC3(C#N)CCCCC3)C2)nc2ccccc21 597213584 DZRYQXOBPHSVOI-IBGZPJMESA-N 392.547 5.187 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCC[C@@H]1CCc1ccccc1 601187626 YZIHVASYIFMAFK-RUZDIDTESA-N 395.506 5.111 30 20 GKED Cc1sc(CC(=O)Nc2ccccc2S[C@H](C)CC#N)nc1-c1ccco1 602097295 MLRRSTMRIYTSGW-CYBMUJFWSA-N 397.525 5.287 30 20 GKED COCc1c(C(=O)Nc2sc3c(c2C#N)CCCCC3)oc2ccccc12 602774922 GXESQHWIXLWHEQ-UHFFFAOYSA-N 380.469 5.034 30 20 GKED N#Cc1ccccc1CN[C@@H](c1ccccc1)c1ccc(Br)cc1F 604009684 LWGGLZYRIPQJCJ-NRFANRHFSA-N 395.275 5.339 30 20 GKED N#Cc1cc(NC(=O)c2cc3sccc3s2)ccc1OCC(F)(F)F 604174143 YZMSIDNNCQZPLA-UHFFFAOYSA-N 382.388 5.028 30 20 GKED N#CCn1c(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc2ccccc21 609200513 JSVCXZYHKIQWSF-UHFFFAOYSA-N 392.871 5.194 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1ccccc1Cl 609222012 NXMZXIQGLKRBSY-OAHLLOKOSA-N 391.858 5.443 30 20 GKED CCCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](C)c1ccc(C)o1 609436628 BVLLRNKKLFNGDC-ROUUACIJSA-N 399.560 6.378 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cn1 609643979 CBVFOWAVEPGNQS-UHFFFAOYSA-N 375.431 5.540 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl 610106866 ISERJRZPLYWFOT-ROUUACIJSA-N 384.882 5.139 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1cccc(C#N)c1 610345423 JHGBSOHZGGXMOM-GHMZBOCLSA-N 380.250 5.126 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N[C@H](C)c1cccc(C#N)c1 610356561 VCZCGDBUUPZQPB-DYESRHJHSA-N 389.524 5.272 30 20 GKED N#Cc1ccc(NC(=O)c2cccc(Oc3nccs3)c2)cc1C(F)(F)F 610388519 SZTOKJCYOVZCLX-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](Cc2ccccc2)c2cccs2)cc1Cl 619770245 NDFFVTNPCIGEDV-IBGZPJMESA-N 395.915 5.056 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2noc(C(F)F)n2)CCC1 653016562 KAONTCBZSNUKPB-UHFFFAOYSA-N 390.434 5.060 30 20 GKED C=CCC[C@H](NC(=O)N(C)C[C@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 676423445 VKSSDUSWOYWMCE-SGNDLWITSA-N 392.543 5.503 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3cnc4ccccc4n3)sc2c1 682994201 FPWXISATJCMWJL-CYBMUJFWSA-N 377.856 5.296 30 20 GKED COc1cccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 729159709 DGCUAZCNBZYFAC-UHFFFAOYSA-N 375.453 5.168 30 20 GKED Cc1nc(CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)oc1-c1ccccc1 730394806 MTGAQRQCFFLZPS-IBGZPJMESA-N 381.435 5.007 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416769 IJDHSXZJERCYES-AEFFLSMTSA-N 396.487 5.593 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420379 CUBXKWIYVJNHRR-PWSUYJOCSA-N 390.892 5.446 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 732418346 QLYMYNHCRZBIDG-QHCPKHFHSA-N 397.478 5.229 30 20 GKED O=C(/C=C/c1ncc(-c2ccc(Br)cc2)[nH]1)c1c[nH]c2ccccc12 732714296 PKOPTSHWXKEOCV-MDZDMXLPSA-N 392.256 5.217 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(Sc3ccccc3)CCCC2)c1 733771264 MEZPKOUUTAQJJV-LJQANCHMSA-N 394.540 5.089 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)OC(=O)/C=C/c1ccccc1C#N 739592752 XPHYKGSHOADPAN-GZKZCVOOSA-N 388.492 5.232 30 20 GKED COc1cccc([C@@H](Nc2snc(Cl)c2C#N)c2ccccc2Cl)c1 742413011 RSFKSZDOMYFCEP-MRXNPFEDSA-N 390.295 5.532 30 20 GKED C[C@H](ON=Cc1cccc(Cl)c1Cl)c1nc(Cc2ccccc2)no1 744442820 FSJNWAQMEBADSM-LBPRGKRZSA-N 376.243 5.079 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(C(F)(F)F)ccc2C)c1 746728280 GXFDWQFEAKMPTO-INIZCTEOSA-N 391.393 5.017 30 20 GKED CC(=C/c1ccc(Cl)cc1)/C=C(/C(=O)C(=O)O)c1ccc2ccccc2n1 753713694 KVUOUTQEMZXBEQ-FGFUYGETSA-N 377.827 5.029 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](Cc2ccccc2F)c2ccccc2)c1 760002301 XIJDYGQECUFQPB-RCZVLFRGSA-N 388.486 5.580 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@H]3CCOC3)c2)cc1 761311275 OJCZYDZNUWGRMD-LADGPHEKSA-N 382.463 5.098 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](c1ccccc1)C1CCOCC1)c1ccccc1 771992247 VQUGZPKQCHBIPX-XZOQPEGZSA-N 378.516 5.161 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(N(C)C(=O)OCC)cc1)c1ccccc1 772422847 VSHTZDZQEDAXQX-HXUWFJFHSA-N 381.476 5.108 30 20 GKED C=CCC[C@H](NC(=O)N(Cc1ccco1)Cc1ccccc1O)c1ccccc1 772626242 QPBIZNQHTMMIOD-QFIPXVFZSA-N 390.483 5.405 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Cl)c(N)c(Cl)c2)c1 774450277 SZFUCRYMLJIVAG-WFASDCNBSA-N 378.303 5.107 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Cl)ncc3Cl)cc2)c1 780639134 SFGCTYLPQMEBGZ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 780676823 FVNIVMLWNQNUJH-UTKZUKDTSA-N 391.515 5.644 30 20 GKED C[C@@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(C#N)cc1F 781423682 WUOPUCMZCCJVOJ-CQSZACIVSA-N 381.838 5.498 30 20 GKED C[C@H](NCc1nnc(-c2cccc(F)c2)o1)c1ccc(-c2cccc(C#N)c2)cc1 782524752 UIQPORUNJHZKAH-INIZCTEOSA-N 398.441 5.265 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c[nH]c2ccccc12 782548042 ZOEFURITNHNTQC-JPYJTQIMSA-N 393.490 5.956 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(C)C)ccc(C(F)(F)F)c1F 785539457 QXAFUFKAUIQWAL-UHFFFAOYSA-N 380.341 5.064 30 20 GKED Fc1ccc(-c2csc3ncnc(NN=C4CCC5(CCCO5)CC4)c23)cc1 788016379 SXXDONBZIZHTCB-UHFFFAOYSA-N 396.491 5.389 30 20 GKED Cc1nc(CCC(=O)[C@@H](C#N)c2nccc3ccccc23)oc1-c1ccccc1 792096737 QKTKRXPWIRPZGN-HXUWFJFHSA-N 381.435 5.007 30 20 GKED C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797573765 WIMNEORQKXGAJQ-BXUZGUMPSA-N 396.434 5.103 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)ccc1OCC#N 818259278 BSLWPKMQCYOAOH-WMZJFQQLSA-N 375.449 5.222 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)F)cc2F)cc1 847625888 ANIJDFHGHZEFMD-PXAZEXFGSA-N 388.389 5.238 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NOCc2ccccc2)cc1Cl 916683963 OKFFPSJDAHPSBD-FQEVSTJZSA-N 391.858 5.249 30 20 GKED N#C[C@H](C(=O)Cc1cccs1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917031026 OBHHXSJCWDYDOP-BFKIHDCISA-N 382.554 5.091 30 20 GKED N#Cc1ccc(NC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1 917998121 BKDYUVBTFKIVFE-ZDUSSCGKSA-N 392.311 5.488 30 20 GKED COc1cccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)c1 918714108 VIRFITQAAYNBQR-YFHOEESVSA-N 385.872 5.280 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1sc2cccc(F)c2c1C 920101807 JNIYVHZPBFXRQL-CQSZACIVSA-N 390.439 5.344 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(-c2ccccc2F)s1 1776049770 AVOCHHOPZPGFFC-UHFFFAOYSA-N 384.432 5.097 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776120128 WPACGXMJGJKYKI-LICLKQGHSA-N 384.475 6.245 30 20 GKED Cc1ccc(C)c(C(=O)/C=C\c2cccc(OCc3ccccc3C(=O)O)c2)c1 1776132951 KFFVWVOEAYEJJU-SEYXRHQNSA-N 386.447 5.477 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(C(=O)O)cc2)c2c(c1)C(C)(C)CC2 1776269271 YSWHVYOBWJINAC-FLIBITNWSA-N 376.496 5.802 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)o2)cc1)c1ccccc1 1776469410 KOZKYMKAGWRLBI-PHCLJHKRSA-N 388.419 5.414 30 20 GKED CCCCCCOc1cccc(/C=C/C(=O)c2cccc(O[C@H](C)C(=O)O)c2)c1 1776790352 QLXBVJMEHHJCGA-KAUXGEHWSA-N 396.483 5.394 30 20 GKED CCCCOc1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)cc1OCC 1776801270 GTWZZVICCFVNHT-FOWTUZBSSA-N 398.455 5.076 30 20 GKED CCN(C)c1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(C)c1 1776855535 WCVVGVYJYVHCFT-BENRWUELSA-N 389.451 5.305 30 20 GKED C=CCn1c(SCc2ccc(Cl)c(Cl)c2)nnc1-c1cccnc1 8472102 SVTCEQUBOUUCEU-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1ccc(C)c(C)c1 11160501 QORQKULWKGCOEB-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CSc1cccc(NC(=O)[C@@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)c1 21372223 FOYZKTWSDAAQFL-MRXNPFEDSA-N 388.492 5.353 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(C(C)C)nc2c1cnn2C(C)C 21930258 LSKCVTAFDLJQQJ-UHFFFAOYSA-N 382.533 5.026 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)cc1F 26617775 RUZOLKOZNDHUFS-UHFFFAOYSA-N 376.456 5.087 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C2(c3cccc(Cl)c3)CCCC2)cc1 32058443 CVSRLUXLRINVRP-UHFFFAOYSA-N 397.906 5.098 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(COC(C)C)cc3)n2)cc1 41512721 MWOLVDFURRBJRC-HXUWFJFHSA-N 390.508 5.534 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OC2CCCC2)cc1 63391059 GHFNVTSVAZAAQY-UHFFFAOYSA-N 375.472 5.100 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1 65473121 DODFZUWYVVTTNV-HNAYVOBHSA-N 393.487 5.258 30 20 GKED Cc1ccc(CCCC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 66545254 PRQSGURUUXQPCB-FQEVSTJZSA-N 385.492 5.189 30 20 GKED Cc1ccc(F)cc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 67848556 GLDKNFNQZNPAFM-UHFFFAOYSA-N 376.456 5.550 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(Cl)cc2)o1)c1cccc(N2CCOC2=O)c1 72038604 SNIMOPTVPAWREC-CSKARUKUSA-N 393.826 5.453 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1coc2ccccc12 113652859 ULMCELRWUDOWRZ-SFHVURJKSA-N 396.402 5.186 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sccc2-c2ccc(F)cc2)cc1 116056564 DOYPNKPBNBSKIM-UHFFFAOYSA-N 395.459 5.114 30 20 GKED Cc1nc(NC(=O)Cc2cc3c(ccc4ccccc43)o2)sc1SCC#N 124619835 DGRPDTUYICOYHZ-UHFFFAOYSA-N 393.493 5.148 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cccc(Oc2nccs2)c1 134716706 BVHHPTQSNFVWSQ-UHFFFAOYSA-N 381.482 5.193 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](c3ccccc3)C3CC3)n2)cc1 162081119 YMAHARLELYOHMU-CTNGQTDRSA-N 388.492 5.189 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F 173122669 GIYAXNIXMOPBPS-GUXCAODWSA-N 397.519 5.835 30 20 GKED Cc1cc(Br)c(F)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 184819206 AZEVCZCNBOVZNU-MRXNPFEDSA-N 390.256 5.063 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 185337830 DLXOZEMFZUIXHX-CQSZACIVSA-N 390.405 5.499 30 20 GKED C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1SCCC#N 188623524 VDRYUGZJJZLEKT-ZDUSSCGKSA-N 394.418 5.117 30 20 GKED CCOc1c(Cl)cccc1CC(=O)Nc1ccccc1S[C@H](C)CC#N 191527884 ZBPLHVAAVZFZCX-CQSZACIVSA-N 388.920 5.314 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(O)ccc2C(F)(F)F)cc1 192862603 IYOPLQNBSZFUTH-UHFFFAOYSA-N 398.340 5.327 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(Sc2nnc(C)s2)cc1C 195389223 KEOBIIPMYOEJKR-UHFFFAOYSA-N 397.525 5.123 30 20 GKED Cc1ccc2nc(-c3ccc(N=Cc4ccc(O)c(O)c4O)cc3)sc2c1 254736269 ICUUPIFOFHFNJV-UHFFFAOYSA-N 376.437 5.139 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)c(Cl)c1 426154113 RLWKSHJFQRDIKO-OAQYLSRUSA-N 375.859 5.734 30 20 GKED Cc1nc2ccccc2c(C)c1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 427031510 RMYCEFUJPZHPPY-UHFFFAOYSA-N 394.434 5.163 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1ccccc1 431316913 XSYFWFDOHSTWAS-PWIZWCRZSA-N 385.870 5.069 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)[C@@H](C#N)CCc1ccccc1 433377521 QLEHCHZWRLDBJJ-MRXNPFEDSA-N 385.305 5.284 30 20 GKED CC[C@H](C#N)Sc1nnc(-c2cc(-c3ccccc3)nc3ccccc23)n1CC 436048094 UVJJXCQVJKYMAD-QGZVFWFLSA-N 399.523 5.574 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(Cl)c(Cl)cc2F)c1 439950714 AYRQXIXOLGZRJE-UHFFFAOYSA-N 382.222 5.459 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccccc1 440245262 UEJNNSUHUOCWDO-JOCHJYFZSA-N 397.469 5.464 30 20 GKED CSc1ccccc1[C@H](C)NCC(=O)Nc1ccccc1S[C@@H](C)CC#N 440632267 CJOYZIJKEAJIKD-HOTGVXAUSA-N 399.585 5.092 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)NCC3CCC(C#N)CC3)c2)C1 440920319 HUMARKRWEXVRHK-AITKFJGESA-N 383.536 5.233 30 20 GKED CC(C)(C#N)CCCCN1CCC(C(=O)Nc2ccc(Cl)c(Cl)c2)CC1 444669147 VNXAZTHPAAAYCM-UHFFFAOYSA-N 396.362 5.364 30 20 GKED N#CCCCOc1cccnc1NC(=O)N1CCCC[C@H]1c1cccc(Cl)c1 445155847 GJTGRMWIPBAGGW-SFHVURJKSA-N 398.894 5.177 30 20 GKED CC(C)CCn1ncc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C(C)C 455270274 SVWIEDHCZRBCPZ-FQEVSTJZSA-N 395.551 5.609 30 20 GKED C[C@]1(Cc2ccccc2)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458796628 FBBQTLSEKBPNSF-ISKFKSNPSA-N 375.516 5.228 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458803390 RDIBFVXHUSZYHS-OAQYLSRUSA-N 389.499 5.572 30 20 GKED N#CCCCC(=O)Nc1ccc(Oc2cccc(F)c2)c(Br)c1 462418919 RAEXRMUVRITKPV-UHFFFAOYSA-N 377.213 5.013 30 20 GKED C[C@@H](C(=O)Nc1ccccc1-c1nc2ccccc2s1)c1cccc(C#N)c1 463122863 MCTRRJWVJXLQDL-OAHLLOKOSA-N 383.476 5.577 30 20 GKED C[C@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccc(C#N)cc1 463574646 AKFIPGVPUXFGSG-HNNXBMFYSA-N 376.456 5.340 30 20 GKED C[C@H](C(=O)Nc1ccc(Br)c(Cl)c1Cl)c1cccc(C#N)c1 464355618 TZIQNGUBZFLLJG-VIFPVBQESA-N 398.087 5.370 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Sc3nc4c(c(C)c3C#N)CCC4)o2)cc1C 468647680 KTLBDNQOCHIZKM-OAHLLOKOSA-N 390.512 5.271 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 469497527 JZUWLNZHFBPUDN-NRFANRHFSA-N 387.527 5.347 30 20 GKED N#Cc1ccc(C[C@@H](C#N)C(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 471439797 CAUBEVWCBZIQKN-FQEVSTJZSA-N 385.854 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccccc1)[C@H](C)C(=O)OC 475570652 JSJLBFSYYUJMNX-LAUBAEHRSA-N 394.515 5.210 30 20 GKED CC[C@H](C)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C 480922377 TXZSSDXXMYUMHL-WMLDXEAASA-N 378.501 5.085 30 20 GKED CC[C@@H](C)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 480939332 IQRHOFNYYBBLFO-MLGOLLRUSA-N 398.919 5.430 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(Oc2ccc(F)cc2)nc1 481917306 FJJYGABWLNMJBG-QHCPKHFHSA-N 387.458 5.442 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc2c(c1)CCC2 486197170 PPPZQKXRQDIXBZ-INIZCTEOSA-N 396.581 5.441 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1cccc(C(F)(F)F)c1F 488407617 NJUFLWQPJKZZLZ-UHFFFAOYSA-N 383.307 5.230 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)ccn1C(C)C 497445485 SHAQNSYCKOUUAD-AWEZNQCLSA-N 385.439 5.269 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cc2cc(Cl)ccc2o1 501019406 IRPNIWSGZRKISO-UHFFFAOYSA-N 376.799 5.398 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(C#N)ccc2Cl)n(Cc2ccccc2)n1 511509205 VJCDLEGDSJUSIB-UHFFFAOYSA-N 392.890 5.006 30 20 GKED Cc1cc(C(=O)Nc2cc(C#N)ccc2OC(C)C)c(C)n1C1CCCCC1 512568430 JOVMNXQTHDVASW-UHFFFAOYSA-N 379.504 5.521 30 20 GKED Cc1ccc(CN(CCc2ccccc2)C(=O)Nc2ccc(C#N)cc2)s1 515366095 SKUJZPUWNQVEJH-UHFFFAOYSA-N 375.497 5.205 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)CC1 518001581 OFESYKIOZMDRDK-UHFFFAOYSA-N 399.922 5.294 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1Cl 518739008 JTHLHSSZVUHSEN-UONOGXRCSA-N 390.961 5.854 30 20 GKED COc1ccc2oc([C@H](C)Nc3nc(C(F)(F)F)ccc3C#N)c(C)c2c1 523756076 YWRRUJCAOLUXCD-NSHDSACASA-N 375.350 5.208 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@H]2c2cccc(OCCCC#N)c2)c1 524216147 ZDPQBXQXLAHICQ-XMMPIXPASA-N 397.478 5.449 30 20 GKED C[C@@H]1CCCN(Cc2ccc(NCc3cccc(OCCCC#N)c3)cc2)C1 532890589 RWODTXDELJRQDO-HXUWFJFHSA-N 377.532 5.213 30 20 GKED Cc1ccc([C@H]2CCCN2CC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 532896227 ISFITGUXKBQMLM-WIYYLYMNSA-N 393.556 5.022 30 20 GKED N#CCc1ccc(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)cc1 534689740 CENCXQQEWQAVPH-UHFFFAOYSA-N 387.386 5.147 30 20 GKED CN(C(=O)c1ccc(CC#N)cc1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 537334016 NSBJJROBQGLXLL-PMACEKPBSA-N 386.417 5.180 30 20 GKED CC[C@@H](CSC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 539303862 DZUOOWHCYLMYBS-YJBOKZPZSA-N 387.936 5.259 30 20 GKED N#Cc1cc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)ccc1F 540519224 FSMVVXXZFRDEGW-OAHLLOKOSA-N 376.275 5.109 30 20 GKED CSC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 540992045 QFISRUOIMLEAKF-RBUKOAKNSA-N 378.463 5.744 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)N3CCC(CC#N)CC3)cc2)cc1C 541040449 DLRKSFSRPFITCO-UHFFFAOYSA-N 379.529 5.612 30 20 GKED Cc1ccc(NC(=O)[C@H](C)SCCCOc2cccc(C#N)c2)c(Cl)c1 568339309 KAYCIUPDHKTBIW-HNNXBMFYSA-N 388.920 5.049 30 20 GKED CCc1cc(Oc2cnc(-c3noc(CCCCCC#N)n3)cn2)ccc1Cl 589138910 KMNYBSZQYUQXLN-UHFFFAOYSA-N 397.866 5.161 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)C1CCC(F)(F)CC1 594069617 FSGKRTWWSNQSHO-ZIAGYGMSSA-N 381.492 5.274 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1 596735842 QYFZGOJFSBRPPI-OXQOHEQNSA-N 395.528 5.823 30 20 GKED C[C@H](Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1)c1cccc(C#N)c1 600848439 RWZHVGOKDLKJRC-INIZCTEOSA-N 395.934 5.789 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692370 QSFBGTZZPYVCPH-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C=CCn1c(SCC(=O)c2cc(C)c(F)c(C)c2)nnc1-c1ccccc1F 607436600 RDYMATRASJVVAS-UHFFFAOYSA-N 399.466 5.001 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1 609460843 BRPCNBRFUACNNA-BZNIZROVSA-N 397.689 5.104 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(F)cc2s1)c1c(Cl)cccc1Cl 609589179 OYBXFSPTDAXSBY-CYBMUJFWSA-N 379.243 5.342 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(COc3ccccc3C#N)c2)c(Cl)c1 609627727 CCYZUZDZMNVOJR-UHFFFAOYSA-N 390.870 5.660 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c(Cl)c1 609640760 UDSAAKCZAWQPNA-UHFFFAOYSA-N 390.870 5.660 30 20 GKED CCOc1ccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c(C)c1 609642701 DDFUHCBQMFMEMQ-UHFFFAOYSA-N 386.451 5.097 30 20 GKED N#C[C@@H](NC(=O)C[C@@H]1CCc2ccccc21)c1ccc(OCc2ccccc2)cc1 609661956 NFTKKQZMOBUTRY-WIOPSUGQSA-N 396.490 5.067 30 20 GKED CCN(Cc1ccncc1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609736605 OJFICJBJMSINLJ-UHFFFAOYSA-N 391.858 5.061 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 610187188 YQWVONHWNCKGOO-PMAPCBKXSA-N 397.478 5.152 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N[C@H](C)c1cccc(C#N)c1 610361829 LDZRODHPFRXFDM-NEPJUHHUSA-N 379.312 5.223 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 610715098 GVFZETHFPHXEAR-GHMZBOCLSA-N 390.249 5.144 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618844925 AKJMUYGZPFCVPU-CWTRNNRKSA-N 388.298 5.255 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1Cl 619754574 DNZMAFFPDSAGDK-SFHVURJKSA-N 397.906 5.641 30 20 GKED C=CCCOCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 620326510 FGYOILPPLZIXRS-UHFFFAOYSA-N 396.487 5.075 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)cc1 622485433 NNPPMKOZGIYLEU-ZDUSSCGKSA-N 397.265 5.676 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)cc2)cs1 669601490 HSXFIKSKOIPMQO-OAHLLOKOSA-N 393.468 5.357 30 20 GKED C[C@@]1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCCc2ccccc21 726323032 WLVNMYAUNISFMH-QVKFZJNVSA-N 380.900 5.420 30 20 GKED C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1cccc(C#N)c1 727640770 SRDWNVYXESEZAI-AWEZNQCLSA-N 380.831 5.104 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccccn3)s2)cc1 727663851 JRIKMYLGUHVVQY-IBGZPJMESA-N 396.475 5.113 30 20 GKED C=CCNC(=S)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 727979957 HIYRQCWAMIKNST-UHFFFAOYSA-N 387.867 5.292 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc2ccccc2n1 730687661 ZGMQDLQRBXHBKC-IKGGRYGDSA-N 381.262 5.522 30 20 GKED CCc1cccc2c(CC(=O)[C@H](C#N)c3nc(-c4ccc(C)cc4)cs3)c[nH]c12 731767710 GBPAYAZDWZDTAG-FQEVSTJZSA-N 399.519 5.581 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)Nc1cccc(OCCCC#N)c1 733631717 JXFREIVNLCTADE-UHFFFAOYSA-N 397.544 6.212 30 20 GKED C=CC[C@H](NC(=O)NCc1ccccc1-c1ccc(Cl)cc1)c1ccncc1 734666811 LWEOGYIHBICSCF-QFIPXVFZSA-N 391.902 5.519 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CSc3ccccc32)cc1 735568003 ZZGAJUSFOBEALC-NHCUHLMSSA-N 385.492 5.311 30 20 GKED Clc1ccc(Cl)c(CON=Cc2cccc(OCc3ccncc3)c2)c1 742354816 OKLKCKVTYCUGOW-UHFFFAOYSA-N 387.266 5.518 30 20 GKED Cc1ccc(C)c(C=Nn2c(S)nnc2COc2cc(C)ccc2C(C)C)c1 744761252 AISPQZZMLAJXOL-UHFFFAOYSA-N 394.544 5.077 30 20 GKED COc1ccc(OC(F)F)c(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1 745990562 UTTKRJQJZNVQIC-VURMDHGXSA-N 381.378 5.255 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(N2CCCCC2)cc1 753133852 FFDHUUKEFCLOJI-CMDGGOBGSA-N 375.497 5.092 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2O)c1 756708617 DZYFOEXXGLCSMT-JSGCOSHPSA-N 379.287 5.231 30 20 GKED O=C1/C(=C\c2nc(Cl)cs2)CC[C@H](C2CC2)/C1=C/c1nc(Cl)cs1 759083227 IJWVBGGNNZEJRF-ZPGNYYNQSA-N 397.352 5.763 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cccc(OC(F)(F)F)c2)c1 772984831 QZQIIAZSAVGOSV-PBHICJAKSA-N 378.394 5.117 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775658351 NJIDXVVWZXPQPS-QFIPXVFZSA-N 386.499 5.460 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@@H]1CCc2cc(C#N)ccc21 782450519 GALGGTHQLLPWOF-OAQYLSRUSA-N 377.557 5.779 30 20 GKED C=CCCN(OCc1ccccc1)[C@H](C)C(=O)Nc1ccccc1C(F)(F)F 782665643 YVFHTLJADQLZNH-MRXNPFEDSA-N 392.421 5.042 30 20 GKED C[C@@H](OC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 784059082 DOXYMDYGRFVYLH-GFCCVEGCSA-N 386.329 5.150 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(Br)c1)c1nccc2ccccc12 792097906 YXCPEJSTMPMMGT-LJQANCHMSA-N 393.284 5.196 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1 800154676 WGBLCVNZSLCOKT-UHFFFAOYSA-N 392.377 5.168 30 20 GKED C=CCC(C)(C)c1noc(COc2ccc(C3SCCCS3)cc2)n1 815704405 GIERWWWEIKRLBG-UHFFFAOYSA-N 376.547 5.371 30 20 GKED C=CCNC(=O)c1ccccc1NC(=O)c1sc2cccc(C)c2c1Cl 827749237 SEABSXCYDOAGIE-UHFFFAOYSA-N 384.888 5.031 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(Cl)c2)CC1)c1nc2ccccc2n1C(F)F 835072830 IOPGAPXCCKCAOC-OAHLLOKOSA-N 399.828 5.284 30 20 GKED C=C[C@@H](Cc1nc(-c2cccc(Cn3nc(C)cc3C)c2)no1)c1ccccc1 904526256 USTOWFGMPHAHJZ-FQEVSTJZSA-N 384.483 5.111 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1cccc(OC(F)F)c1 915983816 AQOXSWLOOSAARS-TWGQIWQCSA-N 381.378 5.158 30 20 GKED O=C(/C=C/c1csc(-c2cccc(Br)c2)n1)c1ccc(O)cc1 916134939 ZCOIKBRDETUQNE-RMKNXTFCSA-N 386.270 5.174 30 20 GKED CC(C)CCSCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 920108740 BEYDBSDGMNHNMV-HNNXBMFYSA-N 378.950 5.419 30 20 GKED CC1(C)C(=NNc2cccc(C(=O)O)c2)C[C@@H]1c1ccc(Br)cc1 1776038266 AKONUVQGQLWMNE-MRXNPFEDSA-N 387.277 5.129 30 20 GKED CC(=NNc1cc(C)ccc1F)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776048180 XEUYNYKMOPPCHR-UHFFFAOYSA-N 378.403 5.461 30 20 GKED CCC(=NNc1ccc(C(=O)O)c(F)c1)[C@@H](C)c1cccc(Br)c1 1776077157 XJOAPBFJNCOLBK-NSHDSACASA-N 393.256 5.268 30 20 GKED CC(C)=CCOc1ccc(CCC(C)=NNc2ccc(CC(=O)O)cc2)cc1 1776084022 NSWPGBQSQNZSOV-UHFFFAOYSA-N 380.488 5.079 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2)c(Cl)c1 1776782979 UHQAALFPAQNEOR-FQEVSTJZSA-N 387.951 6.300 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](CC2CCCC2)C(=O)O)cc1 1776786239 FERBIOQTQHZUAZ-NRFANRHFSA-N 375.553 5.407 30 20 GKED C[C@@H]1/C(=C\c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1777407876 KCVFTCOYLXGNRH-YQCVNYCESA-N 384.431 5.347 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc4c(ccc5ccccc54)o3)c2c1 1777685670 STKQPOXIRAFVBG-YVMONPNESA-N 398.439 6.395 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3ccc(C)o3)cc2)CCC1 1786491908 JMXNATQIQSTZPD-HXUWFJFHSA-N 392.499 5.104 30 20 GKED C=CCCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(C)C)CC1 1831378118 SMUNEKQSFOUWDU-OAQYLSRUSA-N 390.612 5.035 30 20 GKED N#Cc1c(NC(=O)CCN2CCC[C@H]2c2ccccc2)sc2c1CCCCC2 10088768 JNEMQZAFLDKOGO-FQEVSTJZSA-N 393.556 5.054 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nc2ccccc2n1C(F)F 41559022 ZCHBPIPNHDDYRX-JTQLQIEISA-N 380.181 5.228 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 57130080 XINKRVJPHKNYHI-IBGZPJMESA-N 389.421 5.174 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C)c(C(F)(F)F)c1 63390195 RIXLEWVXXDMEOU-UHFFFAOYSA-N 393.365 5.142 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(Cl)c([N+](=O)[O-])c2)ccc1SC(F)F 63874736 XYXBZEQSXSAJGC-ZZXKWVIFSA-N 399.802 5.468 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(OCC#N)cc2)cc(C)c1OCc1ccccn1 71891222 TVVGXFIGDVSTON-IZZDOVSWSA-N 398.462 5.076 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 115212704 MLNDPQUXLMVYOG-UHFFFAOYSA-N 386.377 5.068 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 155702043 JFVYCPPYKVDOQQ-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)[C@@H]1CCCO1 171839613 LFHXIDFALQSPKY-PBEJRMEISA-N 395.528 5.123 30 20 GKED CCS[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 176990126 XSKXWIYMMVFMEQ-YQQAZPJKSA-N 377.579 5.124 30 20 GKED N#CCCCOc1cccc(CNc2nnc(Cc3ccc4ccccc4c3)o2)c1 181712163 ITSYQVNXOLKAPP-UHFFFAOYSA-N 398.466 5.108 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCO[C@H]1c1ccccc1 191466076 UXECLPUUDHOWKL-REWPJTCUSA-N 378.516 5.438 30 20 GKED COc1ccccc1-c1csc(C2CCN(CCCC(C)(C)C#N)CC2)n1 191513919 WYJBVYKEYHDOAB-UHFFFAOYSA-N 383.561 5.328 30 20 GKED Cc1cccc2c(O)nc(/C(Cl)=C\c3cccc(OCCCC#N)c3)nc12 255225847 CJPJCVMNAHDMKE-QGOAFFKASA-N 379.847 5.063 30 20 GKED N#CCOc1ccc(CC(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)cc1 303481901 OQMNRJIWEHDDCD-VWLOTQADSA-N 398.506 5.012 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1nc(CC(C)(C)C)cs1 328963959 LPUNNQKGCXTKFR-GFCCVEGCSA-N 379.551 5.027 30 20 GKED Cc1cccc([C@H]2CCCCN2C(O)=Nc2ccc3c(c2F)CCN=C3O)c1C 329134224 QAHHWTSYIFTLTH-HXUWFJFHSA-N 395.478 5.076 30 20 GKED CC1(C)CC[C@@H]2C[C@@H](/N=C(/O)CSc3nnc4ccccn34)c3cccc1c32 329431966 HUYAVGMOUPCMCN-RHSMWYFYSA-N 392.528 5.078 30 20 GKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1 329868315 XGXMKDLKDGVFQF-GOLJUSPKSA-N 384.564 5.916 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)c1 412198389 FNMPOIDQIRDSLX-LEWJYISDSA-N 396.943 5.098 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C[C@@H]1CCCO1)C1CCCC1 428889447 RWZAXFQAPUWWOM-WMZOPIPTSA-N 387.549 5.036 30 20 GKED N#Cc1ccc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)cc1Cl 433500684 AIFMIASEUSVBLJ-CCHVVGMOSA-N 382.813 5.299 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 438011884 LIRKYIJXSNFLKF-UHFFFAOYSA-N 379.382 5.323 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CSCc1ccccc1 439965932 IKPKFOKUKZDDEN-DLBZAZTESA-N 384.570 5.589 30 20 GKED C=CCC1(NC(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)CCCCC1 454800328 PZLWBOQYGVVLOD-SANMLTNESA-N 376.566 5.134 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(CCC)c1C1CC1 455746495 FEHLBDRUQYPIPH-UHFFFAOYSA-N 378.929 5.106 30 20 GKED Cc1ccc(CN(Cc2cccs2)C(=O)CCCC#N)c(Br)c1 462398822 VASNVYTVYMRYDX-UHFFFAOYSA-N 391.334 5.042 30 20 GKED C[C@H](Nc1ccc(F)cc1C#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1 462793454 ZJVRWVFMMLVHNF-AWEZNQCLSA-N 377.394 5.262 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)NCc3ccc(C(F)F)cc3)c2)cc1 462928646 XTFWFEZHCRBUAH-UHFFFAOYSA-N 392.405 5.005 30 20 GKED Cc1csc(-c2cccc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)c2)n1 464960946 LRADYWPKOMSHDG-LEWJYISDSA-N 387.508 5.031 30 20 GKED C=CC[C@@H]1N(C(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)CCCC1(C)C 470296430 MDROYBSYUSWTSF-IBGZPJMESA-N 386.923 5.521 30 20 GKED CCC(O)(CC)CCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 472336222 DUZNPOVENCKDAB-LJQANCHMSA-N 399.922 5.058 30 20 GKED N#CC[C@@H](CC(=O)NCc1ccccc1COCc1ccccc1)c1ccccc1 474891067 MJIYKEYBVODZEJ-QHCPKHFHSA-N 398.506 5.107 30 20 GKED CSc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1Cl 475973295 AMUOWFBYIFXABJ-FUHWJXTLSA-N 385.920 5.366 30 20 GKED N#Cc1ccc(NC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)cc1C#N 477428373 GGFXWUMKUFCTKJ-UHFFFAOYSA-N 399.262 5.113 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F 477524406 CHOFPLGTIKNNET-SWLSCSKDSA-N 387.471 5.569 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccc(Cl)cc1NC(=O)c1ccco1 478352011 DHHYNLXNHSPJEX-UHFFFAOYSA-N 386.238 5.322 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2c(c1)OC(C)(C)O2 480809892 CVMBOADEJJXKGF-UHFFFAOYSA-N 378.881 5.129 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1nccc2ccccc12 483247751 YAFDBZMEGMUBDK-HXUWFJFHSA-N 381.410 5.290 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 483469236 FXEKNWFOVGYPEP-OAHLLOKOSA-N 391.496 5.408 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(-c2ccccc2)no1 489739386 FGBFIACMXHMAMI-INIZCTEOSA-N 382.423 5.574 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H]2CCCC(F)(F)C2)cc1F 494037462 JYUSCRSJIHMRPS-HNNXBMFYSA-N 389.377 5.189 30 20 GKED CCN(CC(=O)Nc1c(C(C)C)cccc1C(C)C)[C@@H](C)c1ccc(C#N)cc1 497593410 BJRSVRTUIUUEDC-IBGZPJMESA-N 391.559 5.827 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c1C 502654680 XGRDRAGFEQSKLL-UHFFFAOYSA-N 384.439 5.071 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(Cc3ccc(F)cc3)CC2)cc1 508360885 RAXLZBAXWHIKOR-UHFFFAOYSA-N 379.479 5.113 30 20 GKED N#Cc1c(NC(=O)c2cccc(COc3cccc(F)c3)c2)sc2c1CCC2 510206023 AFHCBRSNZSCWME-UHFFFAOYSA-N 392.455 5.079 30 20 GKED C[C@@H](NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(F)cncc1F 513090881 WXWHDBYFVUITAG-MRVPVSSYSA-N 384.270 5.248 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1 518659604 XKGWFEFZMATCBM-IAGOWNOFSA-N 396.556 5.642 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1CCC(C)C 521218993 GUQJSWANRSPFBG-UHFFFAOYSA-N 381.476 5.404 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)c1occc1COc1cccc(C#N)c1 523287557 OGQSVGXKGIVAKT-UHFFFAOYSA-N 396.446 5.156 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523587223 MQQDYAHMYZILIE-QGZVFWFLSA-N 389.886 5.360 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCC(c2ccccc2F)CC1 524088991 JFOQHTKUXDBQFQ-UHFFFAOYSA-N 399.469 5.032 30 20 GKED COc1ccc(NC(=O)[C@H](Sc2ccc(C#N)cc2F)c2ccccc2)cc1 524987737 FNMCXJYKBYWTGL-OAQYLSRUSA-N 392.455 5.178 30 20 GKED N#CCc1ccnc(NC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)c1 532180361 RJHOQOLIDGSHIJ-UHFFFAOYSA-N 396.686 5.575 30 20 GKED Cc1scc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1C 536901943 WPCNHQWQBFJKAX-UHFFFAOYSA-N 376.481 5.262 30 20 GKED Cc1cc([C@H](Nc2cccc(OCCCC#N)c2)c2cccnc2)ccc1F 542495268 UINUICJEHKNJSK-QHCPKHFHSA-N 375.447 5.413 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)NC1(c2cccc(C#N)c2)CC1 554432458 GIPFHURHISQCDL-UHFFFAOYSA-N 388.515 5.058 30 20 GKED CC(C)c1c(NC(=O)N2CCC(CCC#N)CC2)cnn1-c1ccc(Cl)cc1 573442253 HVOXLPLDNFHDOS-UHFFFAOYSA-N 399.926 5.197 30 20 GKED Cc1oc(C#N)cc1C(=O)N1CC[C@H](C)Sc2ccc(C(F)(F)F)cc21 574234560 ZDYGWCIHFGJSJL-JTQLQIEISA-N 380.391 5.010 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@H]2CC[C@@H](C(F)(F)F)C2)n1 575954907 KTDYCZPVUNDDKJ-MVWJERBFSA-N 382.279 5.593 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1c[nH]cc1-c1ccc(C)s1 583015676 BXBOUBYAKRALSW-UHFFFAOYSA-N 382.533 5.048 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1OCC 592973800 HQSKEENGABOKEQ-HNNXBMFYSA-N 398.459 5.113 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1nc2ccccc2n1C(F)F 603656453 WVHATFNDFVJQFS-ZDUSSCGKSA-N 397.429 5.115 30 20 GKED CCc1cc(C#N)c(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)s1 604027800 WTEJHTVJNOCAJS-UHFFFAOYSA-N 381.526 5.104 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc(-c2cnco2)cc1 606769292 CFTPOKCBTROVFU-UHFFFAOYSA-N 388.345 5.178 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3ccc(C(F)F)cc3)c2)c1 608804691 HHDGOEMWZWWINU-UHFFFAOYSA-N 391.377 5.000 30 20 GKED N#CCn1c(C(=O)N(CCc2ccccc2)Cc2ccccc2)cc2ccccc21 609161039 ARBGPGPWSPEAFL-UHFFFAOYSA-N 393.490 5.050 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 609164759 VBCJOFHCNWMJKE-FQEVSTJZSA-N 399.881 6.038 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)oc12 609427002 GHMJWOCEMUTHCB-UHFFFAOYSA-N 384.391 5.358 30 20 GKED CN1CCCN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c2ccccc21 609974288 ZMFWYHIQNINLKA-UHFFFAOYSA-N 397.478 5.032 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)N[C@H](C)c3cccc(C#N)c3)cc2)cs1 610347395 IUFWUHQROSJNGB-HUUCEWRRSA-N 390.512 5.112 30 20 GKED C=CCC[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 610932697 VBBXJFPNNSFTJB-FQEVSTJZSA-N 379.485 5.515 30 20 GKED N#C[C@H]1CCC[C@H](N[C@H](CC(F)(F)F)c2ccc(Br)cc2)C1 618578494 AOYJFTQZYOQXCJ-TUKIKUTGSA-N 375.232 5.115 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc2cc(Br)ccc2o1 618803204 HMLXJGOTTOMDME-KZULUSFZSA-N 381.273 5.405 30 20 GKED Cc1cc(F)ccc1NC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 642422355 JRRLREQRHBHQJY-UWVGGRQHSA-N 386.311 5.165 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@@H](c2cccs2)C1 653016559 JKZVQTJCKPPRLB-IEBWSBKVSA-N 384.545 5.642 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1CCC(F)(F)CC1 682732928 OCQYTDRMJUDMJV-MVWJERBFSA-N 381.351 5.700 30 20 GKED C=CCCC(=O)N(C)c1ccccc1Oc1ccccc1N(C)C(=O)CCC=C 685125188 NTLOROIJOVRBKR-UHFFFAOYSA-N 392.499 5.337 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(-c3ccccc3)cc2F)cc1Cl 726457838 RKOSHWQYIVXIMW-UHFFFAOYSA-N 381.863 5.827 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)/C=C/c1ccccc1O[C@@H](C)CC 729827617 QAZWIUOAMWISDI-VVLLFNJHSA-N 399.494 5.013 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)[C@@H](C#N)c1nc2ccccc2s1 732811712 WEKBQDZDOOYIER-GCJKJVERSA-N 391.540 5.110 30 20 GKED CC(C)(C)/C=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 735206544 LNWWBEPKZPIGBK-KTRBRXNASA-N 379.312 5.895 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@@H](C)c3ccc(C#N)cc3)c2c1 735675773 OSWAKYUHRZKGAV-KRWDZBQOSA-N 393.446 5.395 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccccc1OCc1cccc(Cl)c1 735982806 MUJQMAHXPSWLIY-UHFFFAOYSA-N 393.899 5.600 30 20 GKED C[C@H](SCCC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2)c1cccs1 737406884 ZWZXCWCNLJYAJK-OLZOCXBDSA-N 390.599 5.629 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1cccc(OC(F)(F)F)c1 743055603 GSGRUEFIQKKVGB-TWGQIWQCSA-N 386.329 5.064 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1nc2ccccc2s1 744016104 JOMCKNHCFZMDMT-RBSFLKMASA-N 387.291 5.583 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1-c1ccccc1 744035497 MXDWFTJUDYDYCX-HNNXBMFYSA-N 391.883 5.445 30 20 GKED Cc1ccsc1-c1nnc(SCC#Cc2ccc(C(F)(F)F)cc2)o1 754276155 VCJRPOPHHNMBFJ-UHFFFAOYSA-N 380.416 5.269 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C\c3ccnc(Cl)c3)cc2)cc1 757941696 IBXAGDFZMZFOQM-KMKOMSMNSA-N 375.815 5.051 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(C(C)(C)C(F)(F)F)cc2)cc1 758597370 XZHCRQKYZMTIPI-UHFFFAOYSA-N 375.438 5.488 30 20 GKED CCC1(CC)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCS1 767583997 KYDGKJNEOBQAPK-OAQYLSRUSA-N 393.556 5.482 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2ccc(Cl)c(Cl)c2)C2CC2)c1 774450225 SFXDHXIGIAZOTA-LAUBAEHRSA-N 389.326 5.915 30 20 GKED CC(C)CCn1ccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 775489085 ROYYKVDNEOWGCR-OAQYLSRUSA-N 387.487 5.229 30 20 GKED Cn1c(CC(=NOCc2ccc(CF)cc2)c2ccccc2)nc2ccccc21 777538712 ASFWVOPRXSSRNR-UHFFFAOYSA-N 387.458 5.206 30 20 GKED Cc1noc(C2CC2)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 783905836 BQVUOEUAYXWMON-GOSISDBHSA-N 391.858 5.422 30 20 GKED N#C[C@H](C(=O)CCCCc1nc2ccccc2s1)c1nccc2ccccc12 792095637 WFXCWCNXJAZCRA-GOSISDBHSA-N 385.492 5.434 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cn1 792883399 DHOKYSQNVZWUBK-MDZDMXLPSA-N 393.446 5.110 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccc(Cl)cc2)no1 795984622 UOWZBHXEPYFLHD-RHSMWYFYSA-N 395.846 5.082 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)ccc2c1 797569806 XOFNXWCPOPWJKJ-IFXJQAMLSA-N 392.524 5.582 30 20 GKED COc1ccc2sc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c(C)c2c1 797571457 RRHAQXXQFBFPKJ-CQSZACIVSA-N 384.526 5.462 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(Cl)c2F)cc1 810114543 CLKRRFPIIAALOP-IBGZPJMESA-N 378.834 5.316 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)[C@H](O)c2ccccc2)c(C(F)(F)F)c1 811507957 UAELIFIGXYLWLY-FCHUYYIVSA-N 396.412 5.142 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)c1ccccc1 814210518 QDCWBANEFCWKDU-QGZVFWFLSA-N 377.435 5.427 30 20 GKED N#CCCC[C@@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccccc1 814658692 GMCLFFUHEUUAMQ-QGZVFWFLSA-N 378.259 5.426 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(Cl)c(F)c2)cc1 815010277 ISGSLDRUKPRLKA-IBGZPJMESA-N 394.833 5.152 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)Nc2c(C)cccc2Cl)s1 819332027 HTGFMARFDNWMHP-UHFFFAOYSA-N 387.357 5.439 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842939129 OPQKNFKTAZDYIR-CYBMUJFWSA-N 395.311 5.363 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2ccccc2C(F)(F)F)cc1 914772443 WLTGBWWYPDJHOS-UHFFFAOYSA-N 392.425 5.415 30 20 GKED COc1ccc2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)[nH]c2c1 915200257 WJNVIRJJGUTQIG-OAQYLSRUSA-N 381.435 5.084 30 20 GKED COc1ccc(-c2ccc(/C=C/C(=O)c3ccc(F)cc3F)o2)c([N+](=O)[O-])c1 916128009 CVUPNJBJTKVIMM-XBXARRHUSA-N 385.322 5.038 30 20 GKED Cc1nnc(S)n1N=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1 916304961 IKOSSUWZMSGARH-UHFFFAOYSA-N 385.496 5.227 30 20 GKED CCN(CC)c1ccc2cc(C(=O)/C=C/c3ccc4ncccc4c3)c(=O)oc2c1 917615251 OSVTXKKKKZPFOP-XYOKQWHBSA-N 398.462 5.084 30 20 GKED CCOc1cccc(C=Nc2ccc(O)c(-c3nc4ccccc4s3)c2)c1O 920944851 SGZGUUNZRJBUKQ-UHFFFAOYSA-N 390.464 5.524 30 20 GKED Cc1cccc(CCCN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)c1 1559615267 XLLYNCYCFWLCAT-UHFFFAOYSA-N 396.494 5.088 30 20 GKED N#Cc1cc2ccccc2cc1NC(=O)c1ccc(-c2cccc(Cl)c2)nc1O 1584892801 ZRPAKRZSQQWBFH-UHFFFAOYSA-N 399.837 5.385 30 20 GKED CC(C)(C)C(=O)Oc1ccc2c(c1)SCCC=C2B1OC(C)(C)C(C)(C)O1 1690107047 BMIJAFPRVGLAAF-UHFFFAOYSA-N 388.338 5.149 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)CCc1ccc(OCC=C(C)C)cc1 1776049851 PNWKSGXEUMDUTH-UHFFFAOYSA-N 396.487 5.159 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NNc1cccc(Cl)c1Cl 1776080960 OIGUGWCDZALZLJ-ZDUSSCGKSA-N 395.286 5.266 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)cc1 1776125265 BNKQDQACDDMRRE-ZSOIEALJSA-N 384.447 5.769 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc(-c4ccccc4)cc3)o2)cc1 1776131369 PHPKKWHLXURSSB-PEZBUJJGSA-N 394.426 6.208 30 20 GKED CCCCCCOc1cccc(/C=C\C(=O)c2ccc(OC)c(CC(=O)O)c2)c1 1776131849 POSHIJKGNVNDMV-BENRWUELSA-N 396.483 5.178 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1/C[C@@H](C(=O)O)c2ccccc2C1=O 1776365009 HXMODIITJXYYRF-DVFVSVACSA-N 386.900 5.679 30 20 GKED CCCCCCCCCCCN(C)Cc1cccc(C(=O)O)c1Br 1776784548 CKTPNXIHSKVITK-UHFFFAOYSA-N 398.385 6.110 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776817279 KJTWSJHOTLIZTC-QBFSEMIESA-N 392.476 5.798 30 20 GKED Cc1cc2c(s1)C/C(=C\c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777428067 JZHBCCOFOKMGCX-JRVGGCGHSA-N 390.460 5.084 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2)n1)c1nc(-c2ccccc2)cs1 41534071 UDHJCPALRNPXPA-MRXNPFEDSA-N 387.489 5.424 30 20 GKED N#CCCCOc1cccc(NC(=O)CCCCc2nc3ccccc3s2)c1 55569373 ATQWUBRRFYEJRO-UHFFFAOYSA-N 393.512 5.330 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3sc4c(c3C#N)CCC4)s2)c(C)c1 61112009 AFMSQQGLUWKAEI-UHFFFAOYSA-N 379.510 5.101 30 20 GKED CCOc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)ccc1C 113026540 OMYUPEGLEBRBQK-UHFFFAOYSA-N 387.439 5.013 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)s1 114272588 GNXHDHLKLOBYAB-SNVBAGLBSA-N 382.457 5.162 30 20 GKED C=CCn1c(S[C@@H](C)c2cccnc2)nc2sc3c(c2c1=O)CCCCC3 115672844 ISIAUYLWIOBZHK-AWEZNQCLSA-N 397.569 5.161 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2CCCc3occc32)cc1 119368851 AGZKZLBFGVFVDJ-FQEVSTJZSA-N 388.492 5.251 30 20 GKED Cc1coc(-c2cc(NC(=O)CCCCOc3cccc(C#N)c3)ccc2C)n1 120752461 VEIQZDDSVOLPIF-UHFFFAOYSA-N 389.455 5.018 30 20 GKED CN(CCC(F)(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 126924159 ZKAYNIDXAURNTL-UHFFFAOYSA-N 382.769 5.028 30 20 GKED CC(C)(C)OC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 129309861 MSWNFPNPJXSQGX-UHFFFAOYSA-N 393.487 5.162 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(F)cc(F)cc2F)cc1 153355796 DNGUMSLLTBVUGY-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(F)c(NC(=O)c2ccoc2C)c1)c1ccccc1 153665264 AHUGSLDPBVAGBA-MRXNPFEDSA-N 392.430 5.278 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C[C@H](C)C1 161412703 HODDFJCEDGLULT-RTBURBONSA-N 391.515 5.232 30 20 GKED N#Cc1c(NC(=O)c2ccc(C3(C#N)CC3)cc2)sc2c1-c1ccccc1CC2 179711094 NFXIJDQIXOBNTA-UHFFFAOYSA-N 395.487 5.193 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(CCC(F)(F)F)cc1 184063087 OGOMZYVHADVHBG-CYBMUJFWSA-N 377.366 5.116 30 20 GKED N#CCC[C@@H](NC(=O)Nc1nc(-c2ccccc2Cl)ns1)c1ccccc1 184374740 ULNYOLYPPPHHKM-MRXNPFEDSA-N 397.891 5.025 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)n1C 185390918 VKFCCWLXOYTPRR-AWEZNQCLSA-N 397.935 5.142 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CC#N)c3ccccc3)c3ccccc3n2)cc1 216753570 HJOHWPGPJGVATP-UHFFFAOYSA-N 377.447 5.381 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3cccc(OCCCC#N)c3)oc12 236992338 PATGPSIGFGCVKW-KRWDZBQOSA-N 378.472 5.365 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)cc1 237513470 BFYKECHTANXVET-QGZVFWFLSA-N 376.525 5.371 30 20 GKED Cc1cc(Cl)cc2nc(S[C@@H](C)C(=O)N(CCC#N)c3ccccc3)oc12 303688798 OVTMZBAEDRJCFE-AWEZNQCLSA-N 399.903 5.217 30 20 GKED C[C@]1(c2ccccc2)CCCN(C(O)=Nc2nc(C3CCOCC3)cs2)CC1 329430727 KFEKBZKBQPWWIX-QFIPXVFZSA-N 399.560 5.026 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC(C#N)(c2ccccn2)CC1 369207709 QNRNYGQHNBYXQW-INIZCTEOSA-N 392.890 5.008 30 20 GKED C[C@H](c1ccc(Oc2ccccc2)cc1)[S@](=O)CCCC1(C#N)CCOCC1 417194220 MKZSTEUKISTAPO-WHLCRQNOSA-N 397.540 5.389 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(C2CC2)cc1 419331763 HFBFGEHUJHDMQW-SJORKVTESA-N 393.556 5.248 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1cccc(Cl)c1 430600027 RLVBTOJCJJAATG-OAHLLOKOSA-N 398.919 5.078 30 20 GKED Cc1nc2ccc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)cc2s1 433120246 JFGCXGALVUSHGD-HNNXBMFYSA-N 375.478 5.218 30 20 GKED Cc1coc(-c2cc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2C)n1 433281079 APZVXDAHEZBRLX-NRFANRHFSA-N 388.471 5.515 30 20 GKED Cc1ccc(-c2csc3ncn(CCCCC(C)(C)C#N)c(=O)c23)cc1C 436124829 AMOQDJMSHUJMAC-UHFFFAOYSA-N 379.529 5.462 30 20 GKED C[C@@H](N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1(C)CC1 438636471 YWLHQDXKQSRJGH-DNVCBOLYSA-N 381.907 5.648 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Nc2ccc(O)c(C)c2)cc1 443571935 URDYLWNIUXVAHP-UHFFFAOYSA-N 389.411 5.017 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)C1 454290758 WQPQVILOFOVBHQ-FZMZJTMJSA-N 394.422 5.033 30 20 GKED CSCC1CCC(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 454757689 JTMAKHFVMWKVDH-FHERZECASA-N 377.579 5.124 30 20 GKED N#Cc1cc(NC(c2ccccc2)c2ccccc2)nc2ccc([N+](=O)[O-])cc12 461460883 PAGNTGUCHJBLEF-UHFFFAOYSA-N 380.407 5.216 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 464715099 XJENSUIQBGGREZ-INIZCTEOSA-N 376.884 5.298 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccccc2)ns1 469290119 UURXUGIMCILHNS-CQSZACIVSA-N 379.510 5.314 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1ccc(C(=O)N(C)c2ccccc2)cc1 470644026 ZDDPNYGLCPCXMG-UHFFFAOYSA-N 398.506 5.182 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)sc1-c1ccc(F)cc1 474435336 TWDAWCJPBAASJC-HNNXBMFYSA-N 384.501 5.933 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3[nH]ccc3s2)cc1 475444977 JNVXZCHOJWCJJJ-UHFFFAOYSA-N 389.436 5.154 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCC(F)(F)F)c1 476152726 MJYYCVVHEVKJES-UHFFFAOYSA-N 377.406 5.732 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C 482231029 KIGNPXAVUNWEJW-JPYJTQIMSA-N 379.548 5.351 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC[C@H](C4CC4)C3)cc2Cl)c1 482963560 YHPAGHPLDPCDSA-SFHVURJKSA-N 395.890 5.054 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)c1 484468520 XDNFQOUTPHEJAL-FQEVSTJZSA-N 394.490 5.043 30 20 GKED C=CCC[C@H](NC(=O)c1sccc1COC)c1ccc(C(F)(F)F)cc1 485479791 JOJBGOGHGSGQDZ-INIZCTEOSA-N 383.435 5.351 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1 488461389 ISMKFUIUHOPBBE-CQSZACIVSA-N 393.318 5.368 30 20 GKED Cc1ccc(OCc2nc(CSCc3ccc(F)cc3C#N)cs2)cc1 488540363 MSYXWRPCSSHVSC-UHFFFAOYSA-N 384.501 5.475 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1nc2ccccc2n1C(F)F 488765057 MEAVTQLBRPUGEO-UHFFFAOYSA-N 384.333 5.009 30 20 GKED Cc1cc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)ccc1C#N 488983315 MOVDPNFWEPXNMC-QGZVFWFLSA-N 386.339 5.669 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccccc1 489624356 OCTWGVGMLWJWEF-OAQYLSRUSA-N 383.495 5.290 30 20 GKED Cc1ccc(SCCC(=O)N(Cc2ccco2)c2ccccc2C#N)cc1C 500994110 FKEYHLSDKYQOLP-UHFFFAOYSA-N 390.508 5.484 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@H]1CCCc2ccc(C(C)C)cc21 501105664 NPZDXYAMUJKCEI-QHCPKHFHSA-N 396.531 5.061 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSC(c1ccccc1)c1ccccc1 502535561 JOKBPAAUGDGQAM-UHFFFAOYSA-N 392.911 5.673 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCc1ccc(F)cc1Cl 503228245 ZAAWFAYFAXIMMX-ZDUSSCGKSA-N 391.899 5.095 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 505311579 LUDONDVTNUEOTJ-CQSZACIVSA-N 397.481 5.197 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccc(F)cc2C(F)(F)F)no1)c1ccccc1 508052865 HAJBJBJOUOAWBB-ZDUSSCGKSA-N 375.325 5.134 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 509213583 WTZPBHWYHSAOQA-LLVKDONJSA-N 396.249 5.548 30 20 GKED O=C(c1ccc(C(F)(F)F)c(F)c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513516832 BILQJJFLUCCHGC-ZDUSSCGKSA-N 383.307 5.039 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513530651 BKHNRYBEAVZMPI-HXUWFJFHSA-N 398.428 5.420 30 20 GKED Cc1sc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c(C#N)c1C 514898803 IBHZGIHUJLFLBD-UHFFFAOYSA-N 385.876 5.116 30 20 GKED CCN(C[C@H](C)C#N)C(=O)[C@@H](Oc1cccc(Cl)c1Cl)c1ccccc1 518545807 GCGULSHRJHKYAD-KUHUBIRLSA-N 391.298 5.122 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@@H]3CCc4ccc(F)cc43)cc2)cc1 518894468 GAHFBPUSUJOTTF-HSZRJFAPSA-N 386.426 5.101 30 20 GKED CC1(C#N)CCC(Nc2ccc(CC(=O)N3CCCc4ccccc43)cc2)CC1 519745326 JXTPEWIZKLCFDT-UHFFFAOYSA-N 387.527 5.093 30 20 GKED C[C@H](C#N)CNC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 520358504 KUDFBZLLONHVAL-SJKOYZFVSA-N 379.312 5.103 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1 525345672 VGNGTROMMSQOCL-UHFFFAOYSA-N 391.515 5.100 30 20 GKED N#Cc1ccc(OCc2ncc(-c3cccc(Br)c3)o2)c(Cl)c1 525622863 JZOACNRGYSUROK-UHFFFAOYSA-N 389.636 5.208 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(NC(=O)CC)c1 530394479 RHCIGDMLQYJEIG-UHFFFAOYSA-N 379.504 5.209 30 20 GKED Cc1cccc(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c1Br 535299197 PTMVTZYFGIGZEB-ZDUSSCGKSA-N 398.087 5.059 30 20 GKED N#CCCCn1cc(C(=O)N2CC[C@H]2c2ccc(Cl)cc2)c2ccccc21 553324690 NESDQHQVDCKYFI-FQEVSTJZSA-N 377.875 5.186 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC(F)F)c(F)c1 555995706 REWNRWMFYTVSDQ-LLVKDONJSA-N 380.391 5.074 30 20 GKED CC[C@@H](NCc1cc(Br)ccc1OC(F)F)c1ccc(C#N)cc1 569660843 BPKZTPIJXCTMPE-MRXNPFEDSA-N 395.247 5.163 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3conc3C3CC3)cc2Cl)cc1 573848393 QCNDHGSVIZYQEI-UHFFFAOYSA-N 379.803 5.122 30 20 GKED N#Cc1cc(Oc2ccc(NCc3sccc3Br)cc2)ccn1 580766726 GHXYSOUEVMSHDE-UHFFFAOYSA-N 386.274 5.182 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(Cl)ccc1Cl 588768750 RQCYORLQHLUZIP-UHFFFAOYSA-N 375.708 5.928 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@]4(CCSC4)C3)cc2)c1 590815615 ROCGWAXDWSUEAO-JOCHJYFZSA-N 393.512 5.102 30 20 GKED N#CC1(c2ccc(CNC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2)CC1 594914758 KRCFLJHZMUNGCW-GJZGRUSLSA-N 390.371 5.241 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@H](C)c1ccc(C#N)cc1 604456575 OONVKOYFLWCXNL-SNVBAGLBSA-N 387.917 5.196 30 20 GKED CCCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)c1ccc(C)o1 609401951 MLUVXMUQOPXCSQ-SJLPKXTDSA-N 399.560 6.235 30 20 GKED CCc1nc([C@@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cs1 609508288 BSTRKWUPUVFYDX-OAHLLOKOSA-N 391.496 5.055 30 20 GKED Cc1nc(C(C)(C)NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)sc1C 609908468 BSEOHZNSCDGBEN-UHFFFAOYSA-N 391.496 5.089 30 20 GKED CSc1ccncc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 610543839 AVCSIHZEGVMRBA-UHFFFAOYSA-N 377.494 5.079 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc2cc(Cl)ccc2s1 613407244 NCYWHESGLQSCEZ-CYBMUJFWSA-N 395.896 5.563 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2[nH]c3c(c2c1)CN(C)CC3 613900820 KRHWCOWAWJQFPX-UHFFFAOYSA-N 387.527 5.260 30 20 GKED CC[C@H](C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 619126617 ITLGOOCBYLOWOI-AWEZNQCLSA-N 387.339 5.489 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 730486164 GIZQUUZHZOBWJY-UHFFFAOYSA-N 398.478 5.044 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Oc2cccc(Cl)c2Cl)cc1 733141915 XKJUSVMOQHAYIV-CQSZACIVSA-N 377.271 5.016 30 20 GKED Cc1ccc(OC[C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 743294465 KDFOKPNZELTMHX-DVECYGJZSA-N 399.494 5.240 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=S)Nc1ccccc1C#N 745708994 JKMJEFOERXFPDJ-INIZCTEOSA-N 377.538 5.580 30 20 GKED C=CCOc1ccccc1CNC(=O)N(Cc1ccccc1O)C1CCCCC1 745814354 KSBLIMUAHXFNFE-UHFFFAOYSA-N 394.515 5.002 30 20 GKED COc1cc(C(=O)/C=C\c2sc3ccccc3c2Cl)cc(OC)c1OC 747003878 RTYUPKZQXOQCDA-HJWRWDBZSA-N 388.872 5.477 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 747106599 WOFJPVMKOMVKAD-CYBMUJFWSA-N 378.375 5.026 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 749341952 GFWWBMNTVVDEEO-RXCTWCCOSA-N 397.334 5.255 30 20 GKED N#Cc1ccsc1C(=O)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 750219020 REBPATWDCAOMFH-GFCCVEGCSA-N 379.281 5.099 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C1CC1 766401554 ZSHYKWNQHWRQQU-QHCPKHFHSA-N 382.463 5.480 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 767700344 QJPMHEBVTAYODK-HNNXBMFYSA-N 386.517 5.090 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccccc2)CC1)c1nc(-c2ccc(Cl)cc2)cs1 771260593 JEEHMDGITDFQGG-GOSISDBHSA-N 392.911 5.663 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccc(N3CCCCC3)cc2)cc1 775180502 YOGAXMOVFNPXKN-UHFFFAOYSA-N 389.543 5.103 30 20 GKED CC[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 775658335 NBWNIXFPTKAUFX-DNQXCXABSA-N 384.479 5.483 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1SCC(F)(F)F 780471388 LKIVEHLKKDHXLT-GFCCVEGCSA-N 395.406 5.276 30 20 GKED C[C@@H](NCc1ccc(C#N)cn1)c1ccc(Oc2ccc(F)cc2)cc1Cl 783293400 GUHPKAVTMFQXJC-CQSZACIVSA-N 381.838 5.389 30 20 GKED CC(C)(C#N)CCCCOC(=O)Cc1csc(Cc2cccc(Cl)c2)n1 787009633 LGNCSPBETIHTGO-UHFFFAOYSA-N 390.936 5.193 30 20 GKED C[C@H](N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1ccc(OCC#N)cc1 798940158 BSQXNAVCXJRDSV-JQFCIGGWSA-N 375.299 5.493 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@@H]1c1cccnc1 814577509 PIUQBXPURKAWTE-DHIUTWEWSA-N 396.494 5.352 30 20 GKED COc1cccc2c1[C@@H](C(=O)[C@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 815911114 RNTATHIEKUDRHA-ROUUACIJSA-N 388.492 5.033 30 20 GKED CCN(Cc1ccccc1NCc1cccc(F)c1C#N)C(=O)OC(C)(C)C 864004809 WKVPBVXFJPWWKD-UHFFFAOYSA-N 383.467 5.066 30 20 GKED C=CCCC[C@H](NCc1ccc(-c2ccc(Br)cc2)s1)C(=O)O 900068292 DNICFQBJHVXGBS-INIZCTEOSA-N 394.334 5.077 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2csc3c2CCCC3)cc1 916947612 ORJAVQDMDKLAAH-KDOFPFPSSA-N 380.513 5.102 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)F)cc1)c1nc2cc(Cl)ccc2s1 917045246 XIWPMWFFRMAJQE-LBPRGKRZSA-N 394.855 5.754 30 20 GKED Cn1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(Cl)c2ccccc21 918127061 HZQKQPHSRUUVOX-FQEVSTJZSA-N 399.881 5.739 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/CC1(c2ccc(F)cc2)CCOCC1 920175240 UGLXRZNXWDEHSC-FOKLQQMPSA-N 382.262 5.005 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\Cc3cc(C)ccc3C2=O)cs1 921270682 XTNZYOGWTBZROV-LDADJPATSA-N 388.492 5.267 30 20 GKED CCc1ccccc1Oc1ccc(C=NNc2ccc(C(=O)O)cc2)c(Cl)c1 1776012479 TZTGNOPCJPJPNN-UHFFFAOYSA-N 394.858 5.839 30 20 GKED CC(C)(C)c1cc(C=NNc2ccc(C(=O)O)c(F)c2)c(O)c(C(C)(C)C)c1 1776073272 LZPMFYAHUSKRLR-UHFFFAOYSA-N 386.467 5.271 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)c(F)c1 1776128021 MCSQIDDCAKVSKC-MDWZMJQESA-N 376.383 5.096 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(OC2CCCC2)c1 1776355527 XPFXCIVYUSECDX-BENRWUELSA-N 394.467 5.390 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)Cc2ccccc2)cc1 1776787033 NCEXRJLUMMWSSZ-JOCHJYFZSA-N 383.532 5.211 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc(Oc2ccccc2)c(F)c1 1777268414 KJOAWNIOCCQQCN-LUAWRHEFSA-N 392.382 5.221 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(C)C)CC1 1831381398 YPQZTBVMPCPGTA-NRFANRHFSA-N 390.612 5.035 30 20 GKED O=C(CCCc1nc2ccccc2s1)Nc1cccc(C#Cc2ccccn2)c1 46538501 LKZLENBGSNZCPZ-UHFFFAOYSA-N 397.503 5.053 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)c3ccc(F)cc3)n2)cc1 103336576 DZLQOUWSEAFANE-SFHVURJKSA-N 394.471 5.112 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccn(-c2cccc(Cl)c2)n1 108241140 RPLQDNIGLRPLGE-CQSZACIVSA-N 396.903 5.030 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(F)ccc(F)c1F 120978310 GUPJUXXJLVOABL-UHFFFAOYSA-N 382.341 5.329 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc([N+](=O)[O-])c1 146951541 JFOPHBXWLVRSQO-INIZCTEOSA-N 397.843 5.170 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](c1cccc(C)c1)c1ccccn1 152710135 XLKWNBITAKARPO-HSZRJFAPSA-N 389.474 5.016 30 20 GKED COc1cc(Cl)c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1OC 153801468 MHUOWZRPNAZRAQ-LBPRGKRZSA-N 390.892 5.004 30 20 GKED CC(C)(NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1nccs1 174497967 MMJYLEWOHIIZGL-UHFFFAOYSA-N 396.447 5.003 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc2ccccc2n1C(F)F 176541138 STOXLNQOCJSFJD-AWEZNQCLSA-N 393.349 5.307 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 177079536 ARCSNIWBCXNSIV-UHFFFAOYSA-N 386.883 5.321 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1 180067943 CNGZFSOQAHLZFJ-HNNXBMFYSA-N 399.441 5.232 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(F)cc2F)CCC1 180491736 CHUVYSWJADQOPJ-AWEZNQCLSA-N 386.467 5.277 30 20 GKED Cc1cnc([C@H](C)CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 184579158 PGQIRFWIUMHLPQ-CQSZACIVSA-N 392.484 5.041 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(F)c(F)c1 186449193 FSPUGRYYEUYRAW-LHSJRXKWSA-N 385.458 5.217 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc(N)c2c(C)c(C)sc2n1)c1ccc(F)c(F)c1 187795489 DEMJWYRDWJDZJW-PIGZYNQJSA-N 388.487 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccccc2)c2c1CCC2 189904561 JIFCGCDBJKGQBN-UHFFFAOYSA-N 385.511 5.465 30 20 GKED N#Cc1ccc(CNC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)o1 237651099 GCCJRKNFSDHZIK-IBGZPJMESA-N 375.859 5.208 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 248785356 IHXKTYDLIYVTHF-YVWKXTFCSA-N 395.528 5.123 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301764433 QLPSYNOUEHHXRJ-RDTXWAMCSA-N 380.900 5.834 30 20 GKED N#Cc1cc(N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)ccc1[N+](=O)[O-] 302188014 JMCMVVWHHLBETM-INIZCTEOSA-N 394.431 5.219 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 303362283 QGMVRSPVUDKMAI-DLBZAZTESA-N 396.556 5.784 30 20 GKED Cc1scc(/C(O)=N/C2(c3noc([C@H]4CCCO4)n3)CCCCCC2)c1C 329191858 SPNJPIMKSRLXJP-MRXNPFEDSA-N 389.521 5.154 30 20 GKED CC(C)c1nc([C@@H]2CCCN2/C(O)=N/[C@H]2CC=C(c3ccc(F)cc3)CC2)no1 329296611 SWXIRUKUEUNSPP-OALUTQOASA-N 398.482 5.019 30 20 GKED CCS[C@@H]1CCC[C@@H](/N=C(/O)c2cc(NC(=O)C(C)(C)C)ccc2F)C1 331103176 DGIDKVRHRLMUTM-UKRRQHHQSA-N 380.529 5.179 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)N[C@@H]1CC[C@H](C#N)C1 424315644 AIBQKLVFYCAZBZ-DETPVDSQSA-N 390.350 5.224 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(C3CC3)nc3ccc(F)cc23)s1 430589155 CLRAUXATRBCVLH-INIZCTEOSA-N 393.487 5.495 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCSc2ccc(F)cc21)c1ccccc1 431769464 IMWQMYNLBDFHSC-RBUKOAKNSA-N 383.492 5.097 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cnc(C3CCCC3)s2)cc1 437241010 SOXWMBWYQZZZRN-UHFFFAOYSA-N 381.545 5.227 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)[C@@H]1CCCC(F)(F)C1 443526934 AZBLULGAJGJICM-MRXNPFEDSA-N 388.845 5.570 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(C)[C@H](C)CC#N)cc2Cl)cc1 444391742 LJFMMBJUKQSZBA-CYBMUJFWSA-N 389.908 5.266 30 20 GKED COc1cccc([C@H](C)CCCC(=O)Nc2ccccc2SCCC#N)c1 447464275 VNYVFTCAIVQWSK-QGZVFWFLSA-N 382.529 5.613 30 20 GKED CCCc1c(NCc2ncc(-c3cccs3)o2)cnn1-c1cccc(C#N)c1 447885878 LFQZDTGCXRWSSL-UHFFFAOYSA-N 389.484 5.025 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)s1 455791407 IXCBKJPOSVRAMT-ZDUSSCGKSA-N 386.521 5.034 30 20 GKED COc1ccc(Cl)cc1[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468927952 HPBJLCKXEHYRSK-HNNXBMFYSA-N 397.906 5.105 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1cnc2ccccc2c1 470826845 RMWVVHJXHFILCO-UHFFFAOYSA-N 383.476 5.406 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc3oc(C)nc3c2)cc1 470894198 CVEXOJMJXRZUAJ-UHFFFAOYSA-N 399.406 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)COc1ccccc1OC 475578851 QZRABVRNAXYIBE-GOSISDBHSA-N 396.531 5.384 30 20 GKED COc1cc([C@H](C)NC(=O)Nc2cc(C#N)ccc2C)ccc1OC1CCCC1 476770230 WWUMBNQFURVFPW-INIZCTEOSA-N 393.487 5.079 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(N2CCCCC2)c2ncccc12)c1ccccc1 477137320 MXTKZVCLKDBTNO-FQEVSTJZSA-N 398.510 5.251 30 20 GKED C[C@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)s1 487421924 SQJROISHVKJMGJ-ZFWWWQNUSA-N 391.334 5.165 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C)c1ccccc1 488704331 ZIUSRXGCJGVTMU-NRFANRHFSA-N 378.516 5.069 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)N[C@@H](CCC#N)c1ccccc1 500117919 BTGVDPUVYRNCMO-COPCDDAFSA-N 391.515 5.223 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCOCc1ccccc1 500741601 YTEWKXOVDAKXIE-UHFFFAOYSA-N 386.451 5.204 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(CCC#N)CCC(C)C 505174878 NCQLYFADXJRRDD-UHFFFAOYSA-N 375.925 5.174 30 20 GKED CC(C)S(=O)(=O)c1ccc(CSCc2ccccc2C(C)(C)C#N)cc1 513452994 QFZKQTZDZXDOMO-UHFFFAOYSA-N 387.570 5.103 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@H](Cn1cnc3ccccc31)c1ccc(F)cc1)CC2 515925367 SXUBJCOTINJHHH-LADGPHEKSA-N 396.469 5.065 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4ccccc4[nH]3)c2)cc1 516526851 GGPSGVJDGKYIPZ-UHFFFAOYSA-N 381.435 5.065 30 20 GKED N#C[C@@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1c(Cl)cccc1Cl 517343639 LKDFEPBDKZCRFR-CYBMUJFWSA-N 379.630 5.388 30 20 GKED C=C(C)CN1CCC(NC(=O)N[C@@H](CCC)c2ccc(Cl)c(Cl)c2)CC1 517998082 WUAYQOSPZYZORH-IBGZPJMESA-N 398.378 5.174 30 20 GKED CCc1c(C)sc(NC(=O)c2cc3cc(Br)ccc3o2)c1C#N 524330885 JEOIXMUGGJPBOM-UHFFFAOYSA-N 389.274 5.252 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@@H]1COc2ccccc21 532849680 RDZIHFCIFMUSBS-IERDGZPVSA-N 399.450 5.037 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1cccc(CSCc2ccccc2)c1)C1CC1 533138873 YXINBQYVQBTSIZ-QGZVFWFLSA-N 379.529 5.276 30 20 GKED C=C(C)[C@@H](CC(=O)N(CC)[C@@H](c1ccc(Cl)cc1)c1ccccn1)OCC 533712157 FVUQNXKYCIQMNX-IRLDBZIGSA-N 386.923 5.044 30 20 GKED O=C(CCCC(F)(F)F)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1 536116645 IMUSPCIDLFIOSL-UHFFFAOYSA-N 397.237 5.318 30 20 GKED CC(C)c1ccc(NC(=O)C[C@H](C)Nc2cccc(OCCCC#N)c2)cc1 537424433 AESVADXWTBTLLN-SFHVURJKSA-N 379.504 5.322 30 20 GKED C=CCOc1ccccc1CNc1ccccc1CN(C)C(=O)c1cccs1 537729004 BPCCPNXVEJXYRT-UHFFFAOYSA-N 392.524 5.197 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)CCCCC(=O)c2ccccc2)cc1 537999199 WXQWEJQWZFJBTB-UHFFFAOYSA-N 396.490 5.285 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 539393503 WYUDAZGUIIQNHC-UHFFFAOYSA-N 375.871 5.848 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccc[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543017789 WSNCUDLHEMXFGG-GAJHUEQPSA-N 384.483 5.161 30 20 GKED CCC1(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCOCC1 543042887 PXSMYBJYKMLBGN-UHFFFAOYSA-N 399.878 5.085 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1oc(C2CC2)nc1C 546772473 WRUFENFLPZHHIC-UHFFFAOYSA-N 389.430 5.027 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F 565943527 RGVQTNXZYKBVME-RTBURBONSA-N 388.417 5.173 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)[C@H]2CC23CCOCC3)cc1 573328856 GKQQIHIHYLIBFQ-GOSISDBHSA-N 398.915 5.118 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc(F)cc(F)c2F)cc1 575188364 VOFRHUNXMNCWCW-UHFFFAOYSA-N 398.409 5.520 30 20 GKED C=C[C@@](C)(CCOC)c1nc(-c2ccc(Oc3ccccc3F)c(F)c2)no1 580738984 JMQGGUUYVCZFSC-NRFANRHFSA-N 386.398 5.287 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccccc1-c1ncc(-c3ccccc3)o1)CC2 581383706 SUKYIJXBSCQBIL-UHFFFAOYSA-N 391.430 5.083 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC2(CCC2)CC1 588242268 LREQLZOCFGODEU-UHFFFAOYSA-N 389.499 5.244 30 20 GKED Cc1cncc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)c1 588476334 KKORNXDERBVIHU-KTKRTIGZSA-N 376.843 5.192 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC2(CCCCC2)O1 594073057 ZMAWEPIZOQVPOA-IAGOWNOFSA-N 387.549 5.036 30 20 GKED N#Cc1c(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)sc2c1CCC2 603819880 RYOZFOXQJJDJPY-UHFFFAOYSA-N 399.928 5.067 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3cccnc23)cc1 608876744 DJIABHSDIBJOAY-UHFFFAOYSA-N 393.446 5.132 30 20 GKED N#C[C@@H](NC(=O)c1ccc2ccccc2c1)c1ccc(OCc2ccccc2)cc1 609171963 KBCXYQJAUQNIEF-RUZDIDTESA-N 392.458 5.413 30 20 GKED N#CCCSc1ccccc1NC(=O)CCn1c2ccccc2c2ccccc21 609375589 URNXTBKONGAXEH-UHFFFAOYSA-N 399.519 5.829 30 20 GKED COC(=O)[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc(Cl)c1 609805228 HYWNSIPVKIVFFY-OAQYLSRUSA-N 392.842 5.330 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1OCC1CC1 610142656 GWELPXGSNYQKPJ-OAHLLOKOSA-N 381.501 5.514 30 20 GKED C[C@@H](N[C@H](C)c1cccc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 610158675 GZVBVJSWARHESQ-HUUCEWRRSA-N 377.875 5.043 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1ccccc1C(F)(F)F 610173201 UVZOAUOPAGDZFA-CYBMUJFWSA-N 376.378 5.108 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc2ccccc2n1CC#N 610303238 WXMGVTACZIZBAH-IBGZPJMESA-N 393.490 5.665 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)c1c(Cl)cc(C#N)cc1Cl 611094234 BXPPFJGMPUIFOR-QGHHPUGFSA-N 397.689 5.024 30 20 GKED N#CCCn1cc(/C=C/c2nc([C@H]3CCc4ccccc43)no2)c2ccccc21 612933232 OSJWBDSGDPFMGL-KONDSOJQSA-N 380.451 5.186 30 20 GKED COc1cc(Br)ccc1[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21 615761926 GJSLVBHMDKSMLK-DJJJIMSYSA-N 385.305 5.058 30 20 GKED Cc1cc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc(C(F)(F)F)c1 617033443 NAWSPZIYOZSLPL-UHFFFAOYSA-N 385.389 5.207 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618804526 AUSPYABCEAOJNT-RNODOKPDSA-N 393.943 5.982 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cc(C(F)(F)F)ccc1F 622477882 OJKKPCCZUDBYMG-CQSZACIVSA-N 397.265 5.407 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c1 728480528 ACOCROODRSLGNQ-UHFFFAOYSA-N 388.081 5.343 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@@H](C)c3ccc(C#N)cc3)c(F)c2)c(F)c1 730475102 KSQXMPFZJRICTJ-AWEZNQCLSA-N 392.405 5.003 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 731163390 VYTUEBGECYGLSV-ROUUACIJSA-N 377.827 5.083 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 731163391 VYTUEBGECYGLSV-ZWKOTPCHSA-N 377.827 5.083 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ncoc2-c2ccccc2)cc1 732536250 HADWKYIUFIKMIK-OAQYLSRUSA-N 379.419 5.249 30 20 GKED CCC(Cc1cccs1)=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1 733080700 XLPFKXTXPNGETO-UHFFFAOYSA-N 391.422 5.040 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C/c3cc(OC)ccc3O)s2)cc1 733750293 SLUKGTPLRXEUFU-AEOXGOBCSA-N 382.485 5.021 30 20 GKED C=CC[C@@H](NCc1ccc(-c2cccc(Br)c2)s1)c1ccncc1 734510404 UQIBDFZFNNYONS-LJQANCHMSA-N 399.357 5.980 30 20 GKED C=CCCCN(C)C(=O)c1oc2ccccc2c1CSc1nc(C)cs1 736525327 DUBUVCNSAMVLFR-UHFFFAOYSA-N 386.542 5.528 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1cccc(-c2ccncc2)c1 741471602 BQUVRZDRFJUXBO-FPLPWBNLSA-N 396.368 5.146 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)[nH]2)CC/C1=C\c1cnc(-c2ccccc2)[nH]1 742428968 APQMEVRGGQPGAL-LRVMPXQBSA-N 392.462 5.297 30 20 GKED C[C@@H](NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 743777024 NEIRIUANAYTOEF-FZKGZDJFSA-N 378.781 5.121 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 744036963 LIUPTNKXNIVRAD-BEFAXECRSA-N 378.472 5.394 30 20 GKED COc1ccc(OCc2nc(/C=C3/CCc4cc(F)ccc4C3=O)cs2)cc1 747440798 VMLBQZHJDVHQEG-PTNGSMBKSA-N 395.455 5.082 30 20 GKED C=CC[C@@H](NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1ccncc1 754037232 YPEYAQFEMUZKGZ-GOSISDBHSA-N 391.298 5.175 30 20 GKED O=[N+]([O-])c1ccc(-c2ccc(C=NOc3ccccc3C(F)(F)F)o2)cc1 754710693 XDFFPTKSSXESFS-UHFFFAOYSA-N 376.290 5.287 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccnc1 760181830 BGBQCMIEGCVBOH-INIZCTEOSA-N 381.888 5.013 30 20 GKED CC(C)(O)c1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 760896195 YUYALSHVZBKXDE-UHFFFAOYSA-N 386.451 5.025 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc4[nH]ccc4c3)n2)cc1 765938768 ZAESEDXJWLVENC-AMGQUURNSA-N 394.459 5.053 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(N3CCCCCC3)cc2)c1 772984856 RIWALHICIHWCDZ-RDPSFJRHSA-N 391.559 5.599 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(C(F)(F)F)n1 775733604 ZKHLFTYBKKKTFX-UHFFFAOYSA-N 375.803 5.035 30 20 GKED CCOc1c(Br)cc(/C=C\C(=O)c2cccc(F)c2F)cc1OC 776268043 KJNQVVYCDMFCAQ-FPLPWBNLSA-N 397.215 5.031 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 780634952 DXZUKRQHKDODOH-INIZCTEOSA-N 399.450 5.223 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2cccc(Cl)c2o1 783068263 KJKHPSVQZUZLJH-CQSZACIVSA-N 376.799 5.081 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792107048 UEPYJNIJUBQWSN-OAQYLSRUSA-N 384.479 5.409 30 20 GKED N#Cc1ccccc1/C=C\C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 799839990 IWEPVULCYFPADN-SYKNXGGPSA-N 391.474 5.001 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813214473 YAVVWIZPIFPOBL-PGJNLMOESA-N 399.199 5.687 30 20 GKED N#CCCC[C@@H](NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccccc1 817320145 YMHGNKGCDPCFCI-DZFTYQQFSA-N 389.886 5.453 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(OC(=O)[C@@]2(C#N)CC23CCCC3)c(Cl)c1 839338143 LCAZLRUQLUYCQA-FQEVSTJZSA-N 390.867 5.066 30 20 GKED Cc1cncc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 878671434 AENBCKKMXWXYMS-LPHOPBHVSA-N 380.517 5.011 30 20 GKED Cc1sc([C@@H](C)N[C@@H](C)c2cc(C#N)ccn2)nc1-c1ccc(Cl)cc1 902837201 VHJBUMXAZKYANS-QWHCGFSZSA-N 382.920 5.450 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915087059 PCOKEKAMLIJAME-DEOSSOPVSA-N 384.479 5.448 30 20 GKED N#C[C@@H](C(=O)CCc1cccs1)c1nc2cc(C(F)(F)F)ccc2s1 915103678 BKHJHINFTQWYFN-LBPRGKRZSA-N 380.416 5.186 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@H](C#N)c3ccc4ccccc4n3)ccc2c1 916849131 PNEYHOSUZDFSID-YRRMMHPESA-N 378.431 5.286 30 20 GKED CCOC(=O)Nc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043462 IURGBXLNDWQXFY-AWEZNQCLSA-N 399.859 5.008 30 20 GKED Cc1cccc(OCCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917047458 XXLSKTMBWNSJGC-INIZCTEOSA-N 384.888 5.294 30 20 GKED CCCCCCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1OC 917510026 HSJGYAKEYBWUQP-KRWDZBQOSA-N 392.455 5.286 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cccc(COc2ccccc2)c1 917852924 DGJNNAJRGNPNHP-UHFFFAOYSA-N 397.434 5.082 30 20 GKED CC(=NNc1ncc(Cl)cc1Cl)c1ccc(OCC(F)(F)F)cc1 920482217 JNCNYOZGBQCAEM-UHFFFAOYSA-N 378.181 5.166 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(-c2cc(Cl)ccc2Cl)o1 1776029947 SAJROHRJFMQUBN-UHFFFAOYSA-N 375.211 5.398 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc(F)cc(Br)c1 1776033689 RXWZANJAAHZOAM-UHFFFAOYSA-N 399.647 5.166 30 20 GKED Cc1ccc(-c2ccccc2C=NNc2ccc(Cl)c(C(=O)O)c2)c(C)c1 1776034542 LJYKKIGMEKHIJQ-UHFFFAOYSA-N 378.859 5.768 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc(Br)cc3)o2)cc1 1776114102 FZEYUHAZGYCKMG-PKNBQFBNSA-N 397.224 5.303 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)C(=O)c2ccccc21 1776308876 ULLVQDNTGXSEOK-LPRAYXGFSA-N 388.419 5.370 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC)c(OCCCCC)c1 1776783852 BPWPMIUPRNTKLN-HXUWFJFHSA-N 393.568 5.558 30 20 GKED CCCCCCCOc1ccc(CNc2cccc(C(C)(C)C(=O)O)c2)cc1 1776789208 VFOUOCYTNMMZQQ-UHFFFAOYSA-N 383.532 6.010 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(-c2c(F)cccc2F)cc1 1777268215 RPWILFWKUCJCMS-VAWYXSNFSA-N 394.373 5.235 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(OC(C)(C)C)cc2)c2cc(C(=O)O)oc12 1777361025 LQFULRISCZZWOI-YRNVUSSQSA-N 394.423 5.213 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)/C=C\C=C\C)CCC2)cc1 1789457881 DNBNYHCBIGWACB-BYLRXVRFSA-N 378.516 5.021 30 20 GKED CCCOc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1OCCC 25438580 DYTOBEZHRVLWPT-UHFFFAOYSA-N 380.488 5.318 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccs2)n1)c1nc(-c2ccccc2)cs1 41533782 YDQUIRXXJSCGMG-ZDUSSCGKSA-N 393.518 5.485 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1[N+](=O)[O-] 46706883 GIWJVRGGQOEBQJ-OAHLLOKOSA-N 397.843 5.170 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 66801960 SRYXLPJQUYEFBE-HNNXBMFYSA-N 391.496 5.226 30 20 GKED CCC1CCC(N(C(=O)c2ccc(COc3ccccc3C#N)o2)C2CC2)CC1 108260117 APZGHQXGQCQESF-UHFFFAOYSA-N 392.499 5.304 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1ccc(C2SCCCS2)cc1 110842557 CWAVZNUSTVDPNF-JOCHJYFZSA-N 396.581 5.200 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(CCc1cccc(F)c1)C1CC1 114011203 ZBEJKQLGSSODSH-MRXNPFEDSA-N 397.519 5.459 30 20 GKED O=C(Nc1cccc(C(F)(F)F)c1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117434242 FYMRZHFJRTVKHU-UHFFFAOYSA-N 394.237 5.054 30 20 GKED N#CCC[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccccc1 130452830 UOMOEYBHMCIKDO-RUZDIDTESA-N 381.479 5.272 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2cc3cc(C)c(C)cc3o2)ccc1OC 174977958 CYOUBSYTNWLJII-IBGZPJMESA-N 378.472 5.029 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 175762065 RHPJNFOZOIUEOA-UHFFFAOYSA-N 399.475 5.005 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)Cc1ccsc1 188917829 IDGKFKKJRNAIRY-JKSUJKDBSA-N 387.574 5.627 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 189906865 FMIBWSXUWZNADR-UHFFFAOYSA-N 394.441 5.180 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(-n2ccnn2)cc1 191517721 WITOQONWWNOVNT-QGZVFWFLSA-N 389.503 5.002 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccccc2CN(C)C2CCCCC2)cc1 237492100 FZBOZSXOQGIBLU-FQEVSTJZSA-N 391.559 5.032 30 20 GKED Fc1ccc(-c2nc(CON=Cc3ccccc3OC(F)F)cs2)cc1 255107744 AKKMYQBJJCSVMB-UHFFFAOYSA-N 378.375 5.101 30 20 GKED CCN1C(=O)CC[C@H](/C(O)=N/C2CCC(CC)(CC)CC2)[C@H]1c1ccncc1 329080619 CRNVACGTBNEUSS-PZJWPPBQSA-N 385.552 5.087 30 20 GKED CC(C)(C)/N=C(/O)N1CCC(/N=C(/O)C2(C3CCCCC3)CCCCC2)CC1 329492852 UBXGSOIUUXXGGC-UHFFFAOYSA-N 391.600 5.651 30 20 GKED C[C@H]1Cc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c2[C@H](C)C1 410995173 CEFLMUCMYKPUSQ-VXGBXAGGSA-N 397.525 5.203 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccnc(Oc2ccccc2)c1)c1ccccc1 432956678 VQLHBJASODOISM-NRFANRHFSA-N 386.455 5.431 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)Cc1ccncc1)c1ccc(C(F)(F)F)cc1 440858567 WZTXLJCUJGIESF-DNVCBOLYSA-N 391.437 5.038 30 20 GKED CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)N(Cc1ccco1)c1ccccc1C#N 443832549 DWRNHXPQPSVZNN-LZNRXBQRSA-N 380.488 5.058 30 20 GKED CC[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccc(C#N)cc1 447529885 LKCYEDJIVRHNHJ-IBGZPJMESA-N 384.405 5.004 30 20 GKED C=CCn1c(SCc2noc(C3CCCCC3)n2)nnc1-c1ccc(C)cc1 448048695 LJAMRVJXTYYGBW-UHFFFAOYSA-N 395.532 5.163 30 20 GKED Cc1ccc(CC[C@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)o1 460520570 NUDZQRAVJSSRSP-INIZCTEOSA-N 390.508 5.362 30 20 GKED CCO[C@@H](CC(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)C1=CCCC1 466990835 ALETWTPBKOQYEG-IBGZPJMESA-N 392.524 5.229 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC[C@@H]1c1ccccc1 472683870 NZFMXUIELSANAN-GCJKJVERSA-N 375.516 5.535 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCn1c(C2CC2)nc2ccccc21 476794747 PELGHVWTGQKVPL-UHFFFAOYSA-N 387.527 5.794 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCCc4c(O)cccc43)c2)c1 480452196 GZNGGGJEWHOXLY-DEOSSOPVSA-N 384.479 5.010 30 20 GKED C[C@H]1CCN(C(=O)c2ccc(C#N)s2)c2cc(C(F)(F)F)ccc2S1 486738221 QOVGIWQYQLNFEB-JTQLQIEISA-N 382.432 5.170 30 20 GKED N#CCCC[C@@H](NC(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccccc1 487454024 HGUWJSMRMSOXEU-JOCHJYFZSA-N 389.886 5.567 30 20 GKED C=CCOc1ccc(CN(C(=O)CC2CC(OC(C)(C)C)C2)C(C)(C)C)cc1 489777518 LFYXAYPUMTVQIN-UHFFFAOYSA-N 387.564 5.362 30 20 GKED N#C[C@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccccc1Cl 499947975 UXPHTDXATPUBIZ-NRFANRHFSA-N 390.870 5.157 30 20 GKED CC(C)c1ccccc1OCCC(=O)Nc1ccccc1SC[C@@H](C)C#N 502050030 LYJRUQIPFARIIC-KRWDZBQOSA-N 382.529 5.469 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CC1 507831473 XAKGKGHTFYAGBN-UHFFFAOYSA-N 379.312 5.488 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(-c2ccccc2)no1 513159403 GVZSEVDMKYJRGH-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)o2)cc1 513654265 KIERCUNODRVDNT-INIZCTEOSA-N 386.432 5.249 30 20 GKED N#Cc1ccc(N2CCC(N[C@@H](c3ccccc3)c3cccc(F)c3)CC2)cc1 513673779 XCNHEPNCGSFCQY-VWLOTQADSA-N 385.486 5.045 30 20 GKED Cc1ccnc2sc(C(=O)Nc3sc4c(c3C#N)CCCCC4)c(C)c12 514487864 VYTVCSNIUREHRJ-UHFFFAOYSA-N 381.526 5.368 30 20 GKED CC(C)(C)[C@@H]1CCc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cc2C1 515597258 DMTHKMLMRCHHES-HUUCEWRRSA-N 378.497 5.530 30 20 GKED N#Cc1cccc(/C=C/c2nc(-c3ccccc3OCc3ccccc3)no2)c1 517630111 CGBNIKNUWLONIJ-BUHFOSPRSA-N 379.419 5.358 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)C1CCCC1 520825965 XBDZUNCKSBGIIE-QHCPKHFHSA-N 375.516 5.411 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@@H](C)c1ccccc1F 521324639 CEVZGDAKFMZCGB-ZDUSSCGKSA-N 394.259 5.046 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)sc1-c1cccc(Cl)c1 524013940 COJOCIKFTMNOTL-HNNXBMFYSA-N 392.867 6.008 30 20 GKED C=C(C)CN(CC)C(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 524651934 IJQDGKKSAFPFRQ-UHFFFAOYSA-N 376.283 5.263 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccco2)c2ccccc2OC)cc1Cl 532866304 ANOQADIXMKOSCI-QFIPXVFZSA-N 383.875 5.386 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 533916588 PMZSUNSFJQGLHH-NRFANRHFSA-N 385.854 5.314 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1cc(C)ccc1[N+](=O)[O-] 540651786 ICYIMDFVIVDWDL-UHFFFAOYSA-N 382.460 5.163 30 20 GKED Cc1ccc(-c2c(C#N)c(C(F)(F)F)nc3sc4c(c23)CCN(C)C4)cc1 541585976 ISSJOAIDHBUUJJ-UHFFFAOYSA-N 387.430 5.150 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(Cl)cc2OC(F)F)c1 545816189 BBYLLWOCBVHTQN-UHFFFAOYSA-N 394.805 5.001 30 20 GKED COc1cc(C#N)ccc1NC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1 546711235 WFYWXMVXXUAPCS-OAQYLSRUSA-N 392.455 5.178 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1sccc1Cl 549617060 HXOKLTUQGYRAPV-UHFFFAOYSA-N 395.912 5.189 30 20 GKED N#C[C@H](NC(=O)c1cc(F)ccc1Cl)c1ccc(OCc2ccccc2)cc1 550217845 KQVFQRGKTGVDGQ-NRFANRHFSA-N 394.833 5.053 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 558239482 RLYRXFRXEFCFKM-MOPGFXCFSA-N 387.405 5.229 30 20 GKED N#Cc1cccc(C2(C(=O)N3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)CC2)c1 581386872 RTDIGNHXMVCMCR-GOSISDBHSA-N 398.428 5.015 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2cc(C)c(-c3cccc(Cl)c3)s2)nc(C)n1 588348228 FFUIVLBNRWPKPJ-INIZCTEOSA-N 381.888 5.274 30 20 GKED CCOc1ccc(-c2nc(CNC(C)(C)c3cccc(C#N)c3)cs2)cc1 595634919 IKHQCSXRXJNCEV-UHFFFAOYSA-N 377.513 5.105 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@](C)(C#N)C2)c(C(F)(F)F)c1 596712268 XUHQYYNCIWWINN-YVEFUNNKSA-N 385.455 5.363 30 20 GKED N#CCC[C@H](N[C@@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598677952 LSLRPOPBRZRHFT-IRXDYDNUSA-N 379.248 5.390 30 20 GKED C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1N[C@H](C)c1cccc(C#N)c1 600849349 OSEWCUBBBBOYTF-IXDOHACOSA-N 395.934 5.788 30 20 GKED Cc1cc(C(=O)CSc2ccc(C#N)cc2F)c(C)n1Cc1cccs1 607760895 BDIMPORPLATMMA-UHFFFAOYSA-N 384.501 5.201 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCc1nc2cc(Cl)ccc2s1 609326958 IIXLNKOSEXQLIW-UHFFFAOYSA-N 399.903 5.180 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1F 609438583 LGRWFEIQTZYHFE-QWHCGFSZSA-N 375.444 5.242 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cccc(-c2noc(CC(C)(C)C)n2)c1 610196824 MKGUUPYHUOZUIM-UHFFFAOYSA-N 396.535 5.117 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)N[C@H](C)c1cccc(C#N)c1 610320805 KIJLBKROTUBQNE-QGZVFWFLSA-N 398.466 5.002 30 20 GKED C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1cccc(C#N)c1 610359788 OGSMPSOAVKNJFG-RIEVBORMSA-N 396.490 5.118 30 20 GKED Cc1ccc(Oc2ccc(NCc3ccc(-c4ccccc4C#N)cc3)cc2)nn1 610515393 DKDFMGUPDIJGRL-UHFFFAOYSA-N 392.462 5.728 30 20 GKED Cc1cccc(-n2ncc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2C)c1 613392582 ZYSFPMHXRFGDII-LJQANCHMSA-N 398.491 5.103 30 20 GKED C=C(C)COc1cccc(NC(=S)Nc2cccc(Br)c2)c1 727284385 ZXLITQYKLISFRM-UHFFFAOYSA-N 377.307 5.213 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)O[C@H](C)c2cccc(C#N)c2)cc1 727639882 UFWVLQSGRBFBKE-OAHLLOKOSA-N 376.481 5.146 30 20 GKED Fc1ccc(C(F)(F)F)cc1NC(=S)NCc1cccc(C(F)(F)F)c1 727978182 AZYOZLGICVJBIJ-UHFFFAOYSA-N 396.331 5.350 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(OC3CCCC3)c(OC)c2)C(C)C)c1 728247054 QKQZTSZWUQBCFB-UHFFFAOYSA-N 377.484 5.053 30 20 GKED C[C@H](NC(=S)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 729160647 ZNIJAGMFFNIZKI-AWEZNQCLSA-N 379.510 5.460 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 730171652 XSFHOKDGAXGMHP-VXNXHJTFSA-N 382.463 5.093 30 20 GKED C=CCOc1ccccc1CNC(=O)c1ccc(C2SCCCS2)cc1 732021580 SDONGEZQMPXKGF-UHFFFAOYSA-N 385.554 5.050 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)[C@H](C)Oc1ccccc1C#N 733072722 RTFWGQXHEDOLFW-CVEARBPZSA-N 392.480 5.062 30 20 GKED O=C1/C(=C\c2ccc(OCc3ccncc3)cc2)CCOc2ccc(Cl)cc21 733748870 LRSJWVAOFDDHHE-AQTBWJFISA-N 391.854 5.363 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CCc2ccccc2C1 734060418 WMJKHYPGMSLTSQ-JWQCQUIFSA-N 395.506 5.363 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@H](C)Cc3ccc(Cl)cc3Cl)[nH]c12 735788548 DZUNKDZLRAANRU-IUODEOHRSA-N 386.282 5.233 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](Cc2ccccc2)c2sccc2C)c1 736447450 OQDQAKXRMXWPBC-HXUWFJFHSA-N 376.550 5.308 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccs1 739153978 ANMIWQAWMFZKFW-ONGXEEELSA-N 380.416 5.357 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(N3CCCC3=O)cc2)cc1 741466821 AGCZMKZXWGXKML-YVLHZVERSA-N 397.474 5.385 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1C#N 742366340 WUMYPZNRVZWOLG-QFIPXVFZSA-N 394.421 5.047 30 20 GKED N#C[C@H](C(=O)C1CC(OCc2ccccc2)C1)c1nc2cc(Cl)ccc2s1 747106816 ZUQORWXZWPSOEM-BDVYOWHSSA-N 396.899 5.121 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC12CCCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 747477567 BVDYMLPYDXIRDH-KGLIPLIRSA-N 391.323 5.873 30 20 GKED CC[C@@H](Oc1ccccc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748294544 GEWCNGIVYQYQDB-IFMALSPDSA-N 388.442 5.277 30 20 GKED CC[C@H](Oc1ccccc1F)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 749025588 PVHXPXKNYAOOFW-DOMZBBRYSA-N 388.851 5.123 30 20 GKED COc1ccccc1C1(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)CC1 749344529 WBNUXBGTWTUOFD-QGZVFWFLSA-N 388.492 5.035 30 20 GKED C=CCOCCCC(=O)O[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753375035 UHIOJXRVMOUFHP-GFCCVEGCSA-N 384.259 5.235 30 20 GKED COC1CCC(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 755754773 BBHMZHKPEDGMBD-CKRJSAQMSA-N 391.515 5.059 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2nc(-c3ccc(F)cc3)cs2)ccc1OC 756965717 PSRVPJUWDYCRQS-KRWDZBQOSA-N 397.475 5.251 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N(Cc1ccccc1)C1CCCCC1 761661218 DRKLRLAWTYBHJO-UHFFFAOYSA-N 381.451 5.095 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1)c1ccncc1 761704121 ZSBFIKUKYMXFLB-RPBOFIJWSA-N 397.522 5.251 30 20 GKED CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3ccccc3SCC#N)C2)cc1 764032959 BVBPTAXWYIVUQF-IBGZPJMESA-N 378.541 5.130 30 20 GKED C=CC[C@H](N[C@H](CC)c1ccc(I)cc1)c1ccncc1 766018091 FZTWGPUIOZFNJT-MSOLQXFVSA-N 392.284 5.044 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cccc(OCc2ccc(F)cc2)c1 779995739 XMFUSJHWYQZJRT-QGZVFWFLSA-N 376.431 5.308 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(C(F)(F)F)cc1 792095779 YEEOLXUNPMQHRO-IFXJQAMLSA-N 382.385 5.624 30 20 GKED N#C[C@@H](C(=O)Cc1coc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 796902662 FLKZZWJKCZQAGP-AWEZNQCLSA-N 394.402 5.253 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCCc3ccc(SC)cc32)ccc1OC 842852104 JRCQJUYBSMVXGA-WIYYLYMNSA-N 396.556 5.265 30 20 GKED O=C(N[C@H](c1cc(F)ccc1F)C(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 857498494 GWGOTIOSAYYYRK-UONOGXRCSA-N 397.265 5.117 30 20 GKED CSc1ccc(/C=C\C(=O)[C@H](C#N)C(=O)c2cc3c(s2)CCCC3)s1 860853152 DWTRIXQOURHWOX-QPBFKRLHSA-N 387.551 5.015 30 20 GKED Cc1nc2sccc2c(=O)n1N=Cc1ccc(-c2ccccc2Cl)s1 874096447 KVWIHAQLISRPDF-UHFFFAOYSA-N 385.901 5.031 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C\c1cccs1 914519997 FOPPEUKHWLJOMZ-NTMALXAHSA-N 376.456 5.314 30 20 GKED CCOc1ccc(/C=N/C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(O)c1 914702551 ITMPWVLSRQPBCU-JJKDVNPGSA-N 383.332 5.119 30 20 GKED Cc1cccc(OCCCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915351894 CYRSDLXFMJCGQF-DEOSSOPVSA-N 399.494 5.241 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=C1C(=O)c2ccccc2C1=O 916136589 UZHPAZPWBRLPOY-UHFFFAOYSA-N 397.261 5.009 30 20 GKED Clc1ccc(NN=Cc2sc(Nc3ccccc3Cl)nc2Cl)nn1 916287839 IAZDIQABEGHUMQ-UHFFFAOYSA-N 399.694 5.083 30 20 GKED CCCCc1oc2ccccc2c1C=Nn1cnc2sc(C)c(C)c2c1=O 917210833 FAGKKSINMRCPFE-UHFFFAOYSA-N 379.485 5.046 30 20 GKED CSc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 919904431 MIWQCQNTDFXOHB-JOCHJYFZSA-N 387.508 5.386 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(Oc3cc(F)cc(F)c3)cc2)cc1F 1776073802 PODVLDDVCMBGFM-UHFFFAOYSA-N 386.329 5.040 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(O)c2)cc1 1776125504 KICJVUQGXLCATG-RIYZIHGNSA-N 382.456 5.336 30 20 GKED CCCCCCCOc1cccc(CNCc2cccc(CCC(=O)O)c2)c1 1776787675 NHICFHFSIGOINW-UHFFFAOYSA-N 383.532 5.343 30 20 GKED O=C(O)c1ccc2scc(/C=C3/Oc4cc(Cl)cc(Cl)c4C3=O)c2c1 1777685700 UHJBAYKEFCHETP-LNKIKWGQSA-N 391.231 5.523 30 20 GKED CCN(C(=O)c1sc2cccc(F)c2c1COC)[C@H](C)c1ccc(C#N)cc1 45500141 FWEMDFHWQUJICF-CQSZACIVSA-N 396.487 5.282 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)NC(C)C)cc1 55009611 WOSCMLMNTYHUCW-UHFFFAOYSA-O 397.608 5.431 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c1 60036224 IFPKBYYHGCYCNS-GOSISDBHSA-N 385.467 5.407 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccco1)C1CCCC1 69343928 OHLRGNIVIDARCU-MRXNPFEDSA-N 383.517 5.508 30 20 GKED C=C(C)CN(CC)Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 102681331 VCQFBPXOYXWQJL-UHFFFAOYSA-N 391.968 5.496 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 121813981 AXTQELKFMZXUGX-OAQYLSRUSA-N 393.487 5.120 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)c(F)c1 132551388 RLXUWPNFSXVRGZ-UHFFFAOYSA-N 386.760 5.548 30 20 GKED CC(C)OC1CCC(NC(=O)c2ccccc2Sc2ccccc2C#N)CC1 159127544 UIRXACCABQOPDK-UHFFFAOYSA-N 394.540 5.175 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(Cl)c(Cl)c2)ccc1OC 174091911 LTXOICOBBHHLJL-CZUORRHYSA-N 393.314 5.534 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)c2ccc(Br)cc2)n1 177749311 AJOVPCQAKCNQAH-CQSZACIVSA-N 391.334 5.183 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1 182035385 KSHXXUMEOKCCAX-AWEZNQCLSA-N 394.377 5.300 30 20 GKED Cc1sc([C@H](C)NCc2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 192184332 APOTXFKMMGXMST-LBPRGKRZSA-N 385.895 5.634 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C)[C@@H]1c1cccc(F)c1 245407819 DAFJTRIOLXMZTN-WHSLLNHNSA-N 397.519 5.835 30 20 GKED OC1=NC2(CCC(/C(O)=N/CC3(C4CCCCC4)CCCCC3)CC2)C(O)=N1 329044177 PFSBWGQDCZWYSR-UHFFFAOYSA-N 389.540 5.287 30 20 GKED O/C(=N\C1CCC(/C(O)=N\CC2(c3cccs3)CCCCC2)CC1)C1CC1 330004969 CYRJQZQLVCAZHE-UHFFFAOYSA-N 388.577 5.832 30 20 GKED C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1csc(-c2ccccc2F)n1 417366789 NQWVHFHWKROCEM-VBKZILBWSA-N 377.488 5.549 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)Cc1cccc(C(F)F)c1 425085066 LCNBJZOEDLDDMG-ZDUSSCGKSA-N 396.359 5.126 30 20 GKED N#CCCC[C@H](NC[C@H](O)Cn1c2ccccc2c2ccccc21)c1ccccc1 433019107 LPGQKFXWDFYDEF-URXFXBBRSA-N 397.522 5.180 30 20 GKED COc1ccccc1-c1nc(CN[C@@H](CCCC#N)c2ccccc2)cs1 433021251 WSTWWEYIWNEVTD-FQEVSTJZSA-N 377.513 5.343 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C)c1ccccc1 435601438 MNSYPBZFBGMLIH-FQEVSTJZSA-N 393.531 5.809 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)Nc2cccc(C#N)c2)cc1 437648762 HMCXLPGEHAKGGF-KRWDZBQOSA-N 385.467 5.459 30 20 GKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ncc(-c2ccccc2)o1 439557002 JJNDSIJPDKNCJG-SFHVURJKSA-N 395.462 5.965 30 20 GKED CC[C@H](CC(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 457580474 OUHYGXHEIHOWRY-SNVBAGLBSA-N 380.382 5.331 30 20 GKED Cc1ccc(C[C@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458804119 SBXVKLGFXLCUSK-PKTZIBPZSA-N 375.516 5.147 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccc(Cl)cc1 461109145 CTLFTVYTVOMQEV-BBWFWOEESA-N 379.674 5.131 30 20 GKED C=C(C)COc1cccc(NC(=O)c2c(C)nn(C)c2Sc2ccccc2)c1 463719756 BKWHVLJTYNKVJN-UHFFFAOYSA-N 393.512 5.087 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@H](C#N)C(C)(C)C 464712325 PJDDJMHBUYCOEB-CQSZACIVSA-N 394.302 5.269 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1 472052774 MZPASHOVMRJKSY-FQEVSTJZSA-N 377.532 5.136 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)c(C)c1 473528929 IDUHOUSODHLFSX-HXUWFJFHSA-N 385.511 5.192 30 20 GKED CCN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H](c1ccc(C)cc1)c1cccnc1 475909379 ZERZDQGOZBEBEL-ZEQKJWHPSA-N 397.522 5.416 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(NC(=O)C(C)(C)C)cc1C 476118021 AJGSBIUFDDSILN-UHFFFAOYSA-N 398.572 6.145 30 20 GKED Cc1ccc(-n2ncc(NC(=O)C[C@H](CC#N)c3ccccc3)c2C(C)C)cc1 477011704 JWGNYMJCCRFITB-FQEVSTJZSA-N 386.499 5.330 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1Cl)c1ccccc1 487284857 FYQZUHFVDKBVFQ-QGZVFWFLSA-N 380.797 5.524 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)N[C@@H](CCCC#N)c1ccccc1 487597381 UNCBMCZMHCVHKH-NRFANRHFSA-N 388.467 5.038 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1)c1ccccc1 489661532 CSSXLBZKJOLIQZ-HSZRJFAPSA-N 375.512 5.166 30 20 GKED CCC[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccn1 499891287 XRRCHIMDZVCJHB-GOSISDBHSA-N 389.430 5.407 30 20 GKED CCN(C(=O)c1ccc(-c2cccs2)nc1C)[C@@H](C)c1ccc(C#N)cc1 500142572 FRTBLGCTCHHNNK-INIZCTEOSA-N 375.497 5.214 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H](C)c1ccccc1F 501601570 KEQLATSKSRELBU-AWEZNQCLSA-N 387.455 5.175 30 20 GKED CCCn1ccc2cc(NC(=O)Nc3ccccc3SC[C@H](C)C#N)ccc21 503228010 YLOQTZXFDXKIFD-MRXNPFEDSA-N 392.528 5.947 30 20 GKED Cc1sc(CNc2nc3c(cc2C#N)CCC3)nc1-c1ccc(Cl)cc1 505592498 YCZDPCOHBGUANO-UHFFFAOYSA-N 380.904 5.139 30 20 GKED C=CCOc1ccc(/C=C/c2nc(-c3nccc4ccccc34)no2)cc1OC 507691915 RRQRBODIQDMKNR-PKNBQFBNSA-N 385.423 5.029 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)[C@H](C)c1ccc(C#N)cc1 509565436 YFUUSTKYQLPFNS-MDASCCDHSA-N 386.417 5.290 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cccc(OCc3ccc(Cl)cc3)c2)n1 510344514 CICWSGCGZJVEBF-GOSISDBHSA-N 382.872 5.174 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(C#N)cc2F)ccc1OCc1ccccc1 512611190 IPGONHJFBJLZDO-KRWDZBQOSA-N 390.458 5.136 30 20 GKED CN(Cc1ccccc1Cl)C(=O)c1cccc(COc2ccccc2C#N)c1 513425635 AFMIMLMVEWSQJQ-UHFFFAOYSA-N 390.870 5.063 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)s2)o1 515076759 QPEYWGUFBOMBSS-JTQLQIEISA-N 397.525 5.330 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc2ccccc2c1 517473531 PKIHIWLTYZVWPS-KRWDZBQOSA-N 389.524 5.755 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cc(F)ccc2Cl)cc1 518525328 DJMSKZOUTZGSLD-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C=CCCO[C@H](C)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 519999993 NWJRUEFKDWMJHX-VQIMIIECSA-N 396.918 5.051 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 521325924 ZPLVYOJSBZSGJA-QGZVFWFLSA-N 386.451 5.491 30 20 GKED COc1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 521954659 YISSBTYRKLTCQD-UHFFFAOYSA-N 392.842 5.459 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 522702582 TWLNLMZCLPXTRL-FXAWDEMLSA-N 381.501 5.146 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1)c1cccc(C#N)c1 525825722 RFQHOHYVHNUUJK-UHFFFAOYSA-N 380.806 5.420 30 20 GKED N#CCC[C@H](NC(=O)CCc1nc2cc(Cl)ccc2s1)c1ccccc1 533051675 OTOGWKCEDGUURA-INIZCTEOSA-N 383.904 5.044 30 20 GKED C=CCCOCCCCC(=O)N1Cc2cc(OC)ccc2C[C@@H]1c1ccccc1 539391799 UULHSXRZOLZCPV-XMMPIXPASA-N 393.527 5.084 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC(CC#N)CC2)c(C(F)(F)F)c1 543829587 FSGMNSWPCJWVHN-CYBMUJFWSA-N 399.482 5.754 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3o2)cc1Cl 547827150 PIQVGCFTZDTPOQ-QGZVFWFLSA-N 380.835 5.112 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3cccc(Cl)c3)s2)CC1 548858078 AYGIVTREHTYIOQ-UHFFFAOYSA-N 393.943 5.521 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 551404457 CESPWOBBOQPHPL-UHFFFAOYSA-N 399.825 5.378 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC(C3CCC3)C2)cc1Cl 554398478 SFSBGQKMBFDWBY-HXUWFJFHSA-N 379.891 5.259 30 20 GKED COC(=O)c1csc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 560548794 BUAKOVLLPHBHSH-CVEARBPZSA-N 390.508 5.485 30 20 GKED Cc1c(C(=O)Nc2ccc3c(cnn3C(F)F)c2)sc2ccc(C#N)cc12 589984898 DMIICZHUNUCNBK-UHFFFAOYSA-N 382.395 5.079 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C(F)(F)F)o1 594073024 ZAUXEVZZVZSNLF-MEDUHNTESA-N 397.422 5.265 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1 596735841 QYFZGOJFSBRPPI-OXJNMPFZSA-N 395.528 5.823 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c1 609105346 JRPPZPWEPJCEKO-UHFFFAOYSA-N 397.409 5.485 30 20 GKED N#CCn1c(C(=O)Nc2nc(-c3ccc(Cl)s3)cs2)cc2ccccc21 609200722 XSJZWHRSNQFGDZ-UHFFFAOYSA-N 398.900 5.256 30 20 GKED C[C@@H]1CCN(C(=O)c2cc3ccccc3n2CC#N)c2cc(Cl)ccc2S1 609216746 QPUITDBNERDQKD-CQSZACIVSA-N 395.915 5.349 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H]1CCCc2ccccc21 609371784 XPYPOLLQBKQQCM-JXFKEZNVSA-N 396.581 5.688 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 609669762 UXFSYTPOAWXCDK-AWEZNQCLSA-N 386.204 5.620 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3cc(Cl)cs3)cn2)c1 609907210 WHXBUJJVTVWMJV-UHFFFAOYSA-N 383.860 5.032 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)CCc2ccc(C#N)cc2)cc1 610189111 LZYXAELFHZFROU-GOSISDBHSA-N 384.479 5.044 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)[C@H](C)c1ccc(C#N)cc1 610226899 OZBNRNDYIHNOAR-SMHULIPUSA-N 387.310 5.578 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)c(C(F)(F)F)c1 612303393 GDTZAASBMMTUHI-SCLBCKFNSA-N 399.482 5.754 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619769248 KNOQTFRUWFQJLG-LLVKDONJSA-N 396.705 5.421 30 20 GKED C[C@@H](CC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1ccc(C(F)(F)F)cc1 650351657 PCPKILLEPRHNMN-NSHDSACASA-N 397.334 5.092 30 20 GKED CC(F)(F)c1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 653567011 VVNNTRWAYSNAHO-AOOOYVTPSA-N 390.274 5.003 30 20 GKED Cc1cc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2cc(F)ccc2n1 675789521 DSIDAQSXVILMLA-GHMZBOCLSA-N 380.307 5.249 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c1 726478465 LORPSMWMHKSHNL-LJQANCHMSA-N 382.941 5.459 30 20 GKED COc1ccc(Sc2ccc(NC(=O)c3ccccc3OCC#N)cc2)cc1 728180479 QSWIFDYPXDABRX-UHFFFAOYSA-N 390.464 5.001 30 20 GKED O=C(/C=C\c1cccc(Oc2ccccc2)c1)c1ccc(N2CCC(O)CC2)cc1 730085529 QGZTUSAXLYFXMF-ZROIWOOFSA-N 399.490 5.336 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2c(c1)-c1ccccc1C2 731333344 YMNJPWFTKASQFZ-MRXNPFEDSA-N 384.504 5.904 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C(\C)c3cccc(F)c3)n2)cc1 732497144 LKKQQSIVSVDRBD-ATEOEAFZSA-N 392.455 5.238 30 20 GKED C=CC[C@H](NC(=O)c1ccc(CSc2nc(C)cs2)cc1)c1ccncc1 734459803 MUDDZYZSYBYAKX-IBGZPJMESA-N 395.553 5.186 30 20 GKED CCCc1ccc([C@H](NCc2ccc(OC)c(C#N)c2)c2cccs2)cc1 742366372 ZOCTYPIGWONIES-QHCPKHFHSA-N 376.525 5.460 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 744037828 FFHGRSQBKWYFJQ-KRWDZBQOSA-N 396.441 5.158 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H]2c2cccc(F)c2)cc1 752185126 NECIGQUKIWCIEG-GOTSBHOMSA-N 385.442 5.460 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc2ccccc2c1 753400298 MANYTTMXWBDBEP-IIBYNOLFSA-N 382.488 5.943 30 20 GKED C=C[C@H](CC(=O)N(Cc1ccccc1)C[C@H](O)c1ccsc1)c1ccccc1 759349888 UFVZREVEJGVPPJ-OFNKIYASSA-N 391.536 5.170 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1cnn(Cc2ccccc2)c1 760269262 FNUJUSRQXXDSIB-VOTSOKGWSA-N 377.494 5.013 30 20 GKED Fc1ccc([C@@H](CC(F)(F)F)NCc2c(F)c(F)c(F)c(F)c2F)cc1 775190084 DMUFFASPZUDZAI-SNVBAGLBSA-N 387.245 5.305 30 20 GKED C#CC[C@@H](NCc1cccc(CN[C@H](CC#C)c2ccccc2)c1)c1ccccc1 775402944 DNWDASFNHWAFIL-VSGBNLITSA-N 392.546 5.395 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780167135 WCVGBJUWMVEFGS-QGZVFWFLSA-N 388.492 5.689 30 20 GKED C=CCCC[C@H](C)Sc1nnc([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)o1 795257908 HNPBWDRVDYJLEP-LSDHHAIUSA-N 381.542 5.021 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)(F)F)s2)cc1 796797479 HBJBDPJSIGCOKM-AWEZNQCLSA-N 394.418 5.071 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCCOc2ccccc2Cl)s1 797571775 PUVFPDUEYQVZKB-ZDUSSCGKSA-N 376.909 5.129 30 20 GKED COCCn1nc(C)c(C(=O)/C=C/C(C)=C/c2ccccc2C(F)(F)F)c1C 799891195 ASSDUMPPOSWGDO-LBSPPQMYSA-N 392.421 5.008 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801656841 APEWZDOKWWAIHJ-GOSISDBHSA-N 378.369 5.026 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc3ccc(Br)cc3o2)c(F)c1 812247888 AAXGIWYFYWMTJN-SDQBBNPISA-N 377.600 5.338 30 20 GKED COCc1ccc([C@@H]2CCCN2C(=O)Nc2scc(C(C)(C)C)c2C#N)o1 821481421 KWKPFIQPDRDPIM-INIZCTEOSA-N 387.505 5.026 30 20 GKED CC[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433942 WHAABHMZWUZVKT-KXBFYZLASA-N 389.421 5.442 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842941546 QRNGEXXHIXTGEG-MSKHEQNASA-N 376.403 5.319 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 850770838 BXHXTRXECLZCTM-JQFCIGGWSA-N 396.899 5.328 30 20 GKED N#Cc1c(NC(=O)/C=C\c2nc3ccccc3s2)sc2c1CCCCC2 878073976 XZOJIBXFNAABAP-KHPPLWFESA-N 379.510 5.150 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCCSc1ccc(F)cc1 915057086 RLBSFDZAKCVBGU-UHFFFAOYSA-N 385.533 5.078 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)n1-c1ccc(F)cc1 916627273 JPFHNXHLMOWDKD-SFHVURJKSA-N 389.455 5.333 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/c2ccc(Cl)s2)cc1 916915862 QMVBNQVFSWSZQQ-KAMXEHQASA-N 386.904 5.105 30 20 GKED Cc1ccc(/C=C\S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 917737723 HEHUWJHXRMGTCG-VJVQGEDVSA-N 388.492 5.063 30 20 GKED N#CC1(C(=O)NCCCN2c3ccccc3Sc3ccccc32)CCCCC1 920036515 UGKDYRZSXHZVOK-UHFFFAOYSA-N 391.540 5.270 30 20 GKED CCOc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 920112695 HHHXHUHZSQEJNI-INIZCTEOSA-N 384.888 5.157 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776106009 NCJRPLZYNUFLPW-OAHLLOKOSA-N 392.455 5.159 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)cc1 1776125656 PAWOPMSRHFKBFI-OOXMNIKJSA-N 398.474 6.015 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1OCC 1776814661 LYFRSIORQQFRBP-AATRIKPKSA-N 394.876 5.183 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1F 1777353288 PKNSRATWLZLFGN-VQHVLOKHSA-N 382.412 5.157 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1F 1777403170 GPMPIEHBUQDODY-DAXSKMNVSA-N 398.411 5.108 30 20 GKED N#Cc1ccc(F)c(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)c1 11645354 NHEYAZFHDKAHOO-IBGZPJMESA-N 393.487 5.032 30 20 GKED Cc1cc(C)c(C(=O)/C(=C(\S)N[C@H]2CCCC[C@@H]2C)[n+]2ccccc2)cc1C 27489580 BOGXOFBSUMPMIU-KKSFZXQISA-O 395.592 5.006 30 20 GKED Cc1ccc2nc(C)c(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1 41557579 AJPQMIVEDNUCCD-INIZCTEOSA-N 390.393 5.087 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)no1 56745032 BATRKYOQGAWPIT-FQEVSTJZSA-N 388.427 5.016 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2c2ccsc2)cc1 60674376 SDCGPVKBOAHOKH-QFIPXVFZSA-N 388.492 5.176 30 20 GKED C=C(C)COc1cc(CNCc2ccc3cc(OC)ccc3c2)ccc1OC 60927421 UKWAYXDXUAZVNQ-UHFFFAOYSA-N 377.484 5.102 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 61787813 SASWTQRBEFVDCD-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCCCOc1ccc(C(=O)N(C)c2cccc(C#N)c2)cc1OCCCC 63326521 ZXFJJWRYMRPYRU-UHFFFAOYSA-N 380.488 5.193 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(Br)c1 66801425 BNQUNAPEMKTDCR-SNVBAGLBSA-N 381.320 5.157 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66953958 GDLCJBDTDHPTQG-CVEARBPZSA-N 383.517 5.314 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1 66954808 NHNJVKHAMZEVJQ-KBPBESRZSA-N 389.471 5.584 30 20 GKED CCN(Cc1c(F)cccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 66956037 GJTZVFIHLRVDOR-CQSZACIVSA-N 389.471 5.413 30 20 GKED N#Cc1cccc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4)csc3n2)c1 96939764 VLXVYXCUGHHEKF-LICLKQGHSA-N 389.867 5.672 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CCc2ccc(-c3ccccc3)o2)cc1 105448138 STPVUAHMXNLIKJ-UHFFFAOYSA-N 388.467 5.225 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2nccn2CC(F)(F)F)cc1 125544243 LNRJUTUJGICYCR-ZHACJKMWSA-N 386.373 5.017 30 20 GKED Cc1cccc(C)c1/N=C1/NC(=O)/C(=C/c2cnc(C3CCCC3)s2)S1 128716635 SROJUHFFQSPHJP-YBEGLDIGSA-N 383.542 5.309 30 20 GKED CCN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@@H](C)c1cc2ccccc2o1 151314927 YSZFXAJHNMBKAC-FXAWDEMLSA-N 375.472 5.570 30 20 GKED COc1ccccc1-c1nc(CNc2ccccc2S[C@@H](C)CC#N)cs1 171000029 OEQKBGRVZQPHJN-HNNXBMFYSA-N 395.553 5.825 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 173993277 PZFNUJCOAWLCKC-BZUAXINKSA-N 380.419 5.068 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(CCc2ccccc2)Cc2cccnc2)cc1 194337918 WFGRNEGECCUXBI-UHFFFAOYSA-N 398.510 5.160 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cccc(Nc3ccccc3)c2)c(OC)c1 302172368 MVFQELZHAVHYOJ-UHFFFAOYSA-N 388.467 5.185 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 302982009 VKFKADPAIKFZDV-UHFFFAOYSA-N 375.472 5.460 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 303191273 MEILDJVXZSRVPA-UHFFFAOYSA-N 376.387 5.141 30 20 GKED C[C@@]1(C(O)=Nc2ccc(F)c(N=C(O)C3CCCCC3)c2)CCC(O)=NC1 328652953 KGRYSDZGBHEQSU-HXUWFJFHSA-N 375.444 5.339 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1/C(O)=N/[C@H](C)c1oc2ccccc2c1C 330277629 ONOVAICXQHWTCW-AEFFLSMTSA-N 380.492 5.160 30 20 GKED Cc1cc2sc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)nc2cc1F 434504281 SVAVCYNRMNELBL-UHFFFAOYSA-N 382.464 5.058 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1c(Cl)ccc2c1OC(C)(C)C2 435323979 REEWLSYXIQXDCA-UHFFFAOYSA-N 397.906 5.368 30 20 GKED CC(C)(C)NC(=O)c1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 437123670 FLJLAVUBBZNDSV-UHFFFAOYSA-N 375.516 5.031 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CSc3ccccc32)cc1F 437463210 ZIDHTEUKUCSDJD-KRWDZBQOSA-N 390.439 5.318 30 20 GKED Cc1ccc(Br)cc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 437753230 YBXAOHZAJIBKMU-MJGOQNOKSA-N 398.304 5.061 30 20 GKED N#Cc1ccc(NC(=O)N[C@H]2CCSc3c(F)cccc32)cc1C(F)(F)F 438642212 PMEDDJZLWJKRAU-HNNXBMFYSA-N 395.381 5.075 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438842466 PSTFZRGETUWEFX-LIRRHRJNSA-N 390.314 5.741 30 20 GKED C=CCOCCCC(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 443872284 ZLXJEOWFKMNCEN-UHFFFAOYSA-N 380.513 5.561 30 20 GKED CSc1c(F)cc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1F 444362028 IHICQRGTSBKZEU-UHFFFAOYSA-N 385.439 5.197 30 20 GKED C=CC[C@H]1N(Cc2csc(CC(=O)Nc3ccccc3C)n2)CCCC1(C)C 444779723 LGCIMJAMFKVXOS-HXUWFJFHSA-N 397.588 5.199 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NCC1(C#N)CCC1 450736821 GXHGMRAFTDCWLL-GFCCVEGCSA-N 390.350 5.226 30 20 GKED CCSc1cc(Cl)ccc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 462020503 MZNLRRKXHAPGAU-ZDUSSCGKSA-N 384.810 5.356 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)N(CCC#N)Cc3ccccn3)o2)cc1 463868278 GHTARCKIWVTJTP-UHFFFAOYSA-N 387.483 5.195 30 20 GKED Cn1ccc2ccc(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)cc21 465071628 IEQURPDYEYSGCN-UHFFFAOYSA-N 397.503 5.595 30 20 GKED Cc1nc2c(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)cccc2o1 470846534 FMUXBTVGZMOASZ-UHFFFAOYSA-N 383.407 5.361 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C 480566383 ZJWCPJKNLPZXHD-MCIONIFRSA-N 385.455 5.276 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c(C)cc1Br 483197630 PLGXYCRJNCYICM-KRWDZBQOSA-N 379.257 5.104 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 484142204 WOQWMTWIHAQRKC-HNNXBMFYSA-N 389.459 5.471 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@H]1CCCO[C@H]1c1ccc(C)cc1 485460240 CMOVRFQHKDJIJF-KNQAVFIVSA-N 381.541 5.171 30 20 GKED C[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 487299396 ORDAWANATRNSGK-OXJNMPFZSA-N 388.433 5.750 30 20 GKED C=CC[C@@H](C(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)c1ccccc1 489022412 MTBPRLHVZVODRF-OAQYLSRUSA-N 381.903 5.121 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)N[C@@H](c1ccc(F)cc1)C(F)(F)F 489554302 VSOIGAMTTXSJRM-HOCLYGCPSA-N 393.302 5.282 30 20 GKED N#C[C@@H](C(=O)c1cc(F)c2ccccc2c1)c1nc2ccccc2n1C(F)F 496359756 UGXMDQMLEFZKQF-HNNXBMFYSA-N 379.341 5.214 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)c(F)c2)nnc1-c1ccc(F)cc1 497688132 ZXSLXAGRBZGNHA-LBPRGKRZSA-N 375.419 5.402 30 20 GKED C=C(C)CN(CC)C(=O)[C@@H](C)SCc1cc(-c2ccc(Cl)cc2)no1 497870515 WBLWSJRVFWLQNY-CQSZACIVSA-N 378.925 5.041 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CSCc1cccc(Cl)c1 500995551 IMMDJFVUDFWNPQ-UHFFFAOYSA-N 396.899 5.271 30 20 GKED COc1ccc(CN(C)[C@@H](C)c2cc3ccccc3o2)cc1OCCCC#N 506339547 ILEFVBRERKDOOC-KRWDZBQOSA-N 378.472 5.317 30 20 GKED CCN(C(=O)CCOc1cccc(Cl)c1Cl)[C@@H](C)c1ccc(C#N)cc1 509576986 ZJYUZGDJCHAEEM-AWEZNQCLSA-N 391.298 5.244 30 20 GKED CN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CCCCCC1 509903969 ZCSCKIVYNZTYHJ-UHFFFAOYSA-N 391.515 5.518 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2cccc(C)c2)Cc2ccco2)c1 510981031 HPKYBBQXAJMNQE-UHFFFAOYSA-N 376.456 5.387 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518754443 MDUUEFJVENRHIP-UHFFFAOYSA-N 385.467 5.447 30 20 GKED CCN(CCc1cccs1)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520714383 QRZXSVIYWKCNMD-UHFFFAOYSA-N 394.471 5.256 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cc(Cl)ccc3F)c2)cc1 522307028 BEJIYVQDNFLTCZ-UHFFFAOYSA-N 380.806 5.182 30 20 GKED COc1ccccc1Oc1ccc(CNc2nc(C(F)(F)F)ccc2C#N)cc1 522408173 NGVSHFNKEURDAR-UHFFFAOYSA-N 399.372 5.385 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(F)cc1OCC1CC1 524897542 QPVVMJQIDPBGHJ-AWEZNQCLSA-N 399.491 5.653 30 20 GKED N#CCc1ccc(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)cc1 533961323 KPYANHWYULDZJW-UHFFFAOYSA-N 376.843 5.237 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)c1 538998678 WEFRMFNGAOIQNJ-HXUWFJFHSA-N 395.462 5.427 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N[C@H](CCC#N)c2ccccc2)c1 539002956 GTVABVIVFSYHTI-HSZRJFAPSA-N 384.479 5.527 30 20 GKED C=CCCC[C@@H](C)NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 540540451 VTSISRXBYNRLMR-DYESRHJHSA-N 398.934 5.062 30 20 GKED C[C@H]1C[C@@H](c2noc(-c3ccc(Sc4ccccc4C#N)cc3)n2)CCO1 547219943 LMGXTMIBHSICAP-HOCLYGCPSA-N 377.469 5.042 30 20 GKED C=CCN(C(=O)c1coc(C2CCCC2)n1)c1nc(-c2ccccc2)cs1 548848349 UKXFUMXKSUVSHV-UHFFFAOYSA-N 379.485 5.289 30 20 GKED N#CCCC[C@@H](NCc1ccc(Br)c2cccnc12)c1ccccc1 552313044 IMXFQMNKDILNHT-HXUWFJFHSA-N 394.316 5.522 30 20 GKED C[C@H](N[C@@H](C)c1cccc(-n2ccnn2)c1)c1ccc(-c2cccc(C#N)c2)cc1 554386448 YNFFRCCVMRMRTI-OALUTQOASA-N 393.494 5.218 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1coc2ccc3ccccc3c12)c1ccccc1 554519109 RXPNFCRHVKYAHW-JOCHJYFZSA-N 382.463 5.680 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 558239488 RLYRXFRXEFCFKM-RBUKOAKNSA-N 387.405 5.229 30 20 GKED COc1ccc2c(CC(=O)N(Cc3ccccc3)c3ccccc3C#N)coc2c1 565911014 UEDIKPDSGWVUSA-UHFFFAOYSA-N 396.446 5.089 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3cn(C4CCCC4)nc32)c(C(F)(F)F)c1 567524186 CGRUGOKHQQTONV-IBGZPJMESA-N 388.437 5.056 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1Cc1ccccc1 573296127 UXBZEXSEKWNMEO-MRXNPFEDSA-N 390.483 5.407 30 20 GKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(OC(F)F)cc1 582936170 RNXULSUVULJHHH-AWEZNQCLSA-N 381.382 5.520 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(C(=O)NCc1ccc(C#N)s1)C1CC1 583137565 QPLFJWLXRYORKF-HNNXBMFYSA-N 375.497 5.208 30 20 GKED N#Cc1ccc(N2CCC(Nc3ccccc3SCC(F)(F)F)CC2)cc1 586792774 YEENQMJVIHBDEG-UHFFFAOYSA-N 391.462 5.294 30 20 GKED C[C@@H](CC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 590253259 MQXLPRNPWSPHAA-JTQLQIEISA-N 393.302 5.996 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)NC2(c3ccc(C#N)cc3)CCC2)cc1 594512092 BPNMUXPOPYRMLO-GOSISDBHSA-N 390.531 5.162 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccc(Oc2ccccc2)c(F)c1 595456083 VPTXPUIXXHYFFM-IRXDYDNUSA-N 381.451 5.014 30 20 GKED CCCc1ccc([C@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2cccs2)cc1 596108118 VDVHKVCXKKENCE-RXVVDRJESA-N 381.545 5.125 30 20 GKED CC[C@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 600002774 WVNUNJQQOVZLRP-CVEARBPZSA-N 395.528 5.029 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)o1 604506157 OXHSFWRPEDEMOL-UHFFFAOYSA-N 389.455 5.038 30 20 GKED CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 604509960 JGYAYYUOAQGUPI-SFHVURJKSA-N 378.476 5.178 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc(-c4cccc(Cl)c4)no3)c2C#N)C1 604528059 IQOAUKOYYMHPIE-NSHDSACASA-N 397.887 5.305 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 609376539 BSKIWHJUCHKCBX-TYCQWZJGSA-N 386.520 5.834 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCCOc1ccccc1-c1ccccc1 609669801 GLQYLFNQUIZKGQ-UHFFFAOYSA-N 383.373 5.130 30 20 GKED Cc1nc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)n1 642226831 HJGPLANQOYKKQB-HTQZYQBOSA-N 395.269 5.125 30 20 GKED C=CCn1c(SCCC(=O)Nc2ccc(Cl)cc2F)nc2ccccc21 644360492 IIXCHJHXISPGLG-UHFFFAOYSA-N 389.883 5.136 30 20 GKED CC(C)(C)c1cc(C=Nn2cnnc2-c2ccccc2)c(O)c(C(C)(C)C)c1 725855798 GWRAORLOPFPZBQ-UHFFFAOYSA-N 376.504 5.128 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(Cl)c(Cl)c1Cl 727745293 WPYVRMRERSYQFH-ARJAWSKDSA-N 383.584 5.302 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C\c1csc(-c3cccs3)n1)CC2 728440495 PAQXKXBSDSZESR-XFXZXTDPSA-N 399.493 5.162 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2\CCOc3c(ccc(Cl)c3Cl)C2=O)cc1 728697869 YIUFTCQNNDBBNU-LQELWAHVSA-N 388.250 5.333 30 20 GKED CN(CCC#N)c1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)cc1 729685677 JLYSOMYYEBOIKZ-QHCPKHFHSA-N 381.951 5.711 30 20 GKED N#Cc1ccc(-c2ccn(CN3CCCC[C@@H]3c3cc4ccccc4[nH]3)n2)cc1 731027760 OVCDHZIOSTYYDX-XMMPIXPASA-N 381.483 5.088 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Cl)nc(Cl)c3)cc2)c1 731331908 WBOICRYUDZGQDO-UHFFFAOYSA-N 384.222 5.305 30 20 GKED O=C(/C=C\c1ccc(-c2cccs2)cc1F)c1ccc(C(F)(F)F)nc1O 731562833 HMFOHRVNHCRROO-ALCCZGGFSA-N 393.361 5.570 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2ccc(Cl)cc2)c1 733807027 QAZHUNXHZCXRDK-FPOVZHCZSA-N 397.906 5.068 30 20 GKED COc1cc(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1C 741389442 BXLPFUBPCDIYPL-QHCPKHFHSA-N 399.494 5.023 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Br)s1 744016615 PFIKBELCXQNBJX-VHSXEESVSA-N 391.315 5.100 30 20 GKED C#CC[C@H](OC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccccn1 744101021 PETBHSARSNNLBI-IBGZPJMESA-N 398.890 5.031 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 755218814 AWCSDQKNRJZZMP-DNVCBOLYSA-N 389.421 5.585 30 20 GKED C#CC[C@@H](NCc1csc(-c2cccc(Br)c2)n1)c1ccccc1 756995411 HSPIXTDGEHAFTQ-LJQANCHMSA-N 397.341 5.427 30 20 GKED CC[C@H](SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 757749424 IZTPOHAYKPBCGL-NQIIRXRSSA-N 392.549 5.871 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(F)c(Cl)c2Cl)ccc1OC 762443041 NMUOXRBUBNPFPA-AWEZNQCLSA-N 397.277 5.112 30 20 GKED Cc1nc([C@@H](C)OC(=O)Cc2cccc(C#N)c2)oc1-c1ccc(Cl)cc1 763991433 NNIAZQKULLOKLP-CQSZACIVSA-N 380.831 5.022 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Cl)c(N)c(Cl)c2)c1 774450270 SZFUCRYMLJIVAG-DOMZBBRYSA-N 378.303 5.107 30 20 GKED C[C@@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(OCC#N)cc1 776855912 QRKXWFCTACWYOC-CQSZACIVSA-N 396.384 5.179 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cc(F)cc4cccnc34)cc2)c1 779594993 RUVACVHOKLCKFX-UHFFFAOYSA-N 383.426 5.437 30 20 GKED CC(C)Sc1cc(Br)ccc1CNc1cccc(OCC#N)c1 780768806 UTGGRUIXTLTRMO-UHFFFAOYSA-N 391.334 5.464 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c(C)cccc3Cl)n2)cc1 790769445 SXUIQENYHPEHCJ-KRWDZBQOSA-N 396.899 5.200 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNc1ccccc1O[C@H](C)C#N 797850507 SQKBWQYRQDBBEW-OAHLLOKOSA-N 394.906 5.105 30 20 GKED Cc1ccc(-c2ccc(C(=O)OCCCC3(C#N)CCOCC3)c(F)c2)cc1C 800165600 VHROUWASMYXRES-UHFFFAOYSA-N 395.474 5.367 30 20 GKED N#C[C@@H](C(=O)C1c2ccccc2Oc2ccccc21)c1cc(C(F)(F)F)ccn1 813211131 DWGMEVMIUNLZDP-MRXNPFEDSA-N 394.352 5.214 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c1 818194127 CDNONSBHCNFNPQ-LUAWRHEFSA-N 392.436 5.178 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc(OC)c1OC 844255429 BQJMJUJWSBJLMY-WTKPLQERSA-N 398.455 5.476 30 20 GKED COC(=O)c1cc(NN=C(CCC(F)(F)F)CCC(F)(F)F)ccc1F 853356014 YXAJVADCEFIBLL-UHFFFAOYSA-N 388.283 5.065 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c(=O)c(C)c(-c3ccccc3)oc12 856202375 LPXGZKPFYOPNNP-KDURUIRLSA-N 385.463 5.092 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc3cnccc23)cc1 875862981 APMSOPGXCHTVSV-UHFFFAOYSA-N 395.487 5.651 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(O)Cc1ccc(F)cc1 900095107 XGNVUAJPCXETTF-UHFFFAOYSA-N 395.217 5.128 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2ccsc2C(F)(F)F)no1 904922098 ZQECFLWMFSAYJS-JTQLQIEISA-N 396.287 5.895 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2nc3ccccc3s2)cc1 915351871 CUMYFHPRIJBVPY-IBGZPJMESA-N 398.491 5.273 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1ccncc1 916136088 HDDITIIXWPZRFD-QPJJXVBHSA-N 397.261 5.537 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccc(OCC#N)c3)c2c1 916410762 DAZFTOHSAMSEOK-UHFFFAOYSA-N 393.446 5.365 30 20 GKED Cc1cc2ccccc2n1CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047001 OIRXDBOFLODBSR-HNNXBMFYSA-N 379.872 5.089 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(F)c1)c1nc(-c2c(F)cccc2F)cs1 920803923 GREZAFKPBJUCOB-DANTVBBOSA-N 384.382 5.117 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NNc1ccnc2cc(Cl)ccc12 1776011827 RINNZYMDGMUELF-UHFFFAOYSA-N 379.847 5.129 30 20 GKED C=C(Cl)C[C@@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 1776143163 UOBMSJKDTXBJRG-GOSISDBHSA-N 398.261 5.265 30 20 GKED C=CCOc1ccc(/C=C\c2cc(C(=O)O)c3cc(C)ccc3n2)cc1Cl 1776183954 PHWWSTOUXKRHJN-ALCCZGGFSA-N 379.843 5.630 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776388581 KXUIWPPSEWTKSI-ACCUITESSA-N 392.476 5.797 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCC(C)C)c(OCC)c1 1776783898 IUOGERZNCCVZRO-HXUWFJFHSA-N 393.568 5.414 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cccc(C(=O)O)c1 1777487712 IEUKIOFKVFXERM-YHYXMXQVSA-N 383.856 5.366 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2ccc(N3CCCCC3)cc2)S1 7165130 NHVPAJMJLPFVBI-HMMYKYKNSA-N 391.540 5.185 30 20 GKED CCOc1ccc(SCCC(=O)Nc2sc3c(c2C#N)CCCC3)cc1 10768117 VOEKAORFXKFIFS-UHFFFAOYSA-N 386.542 5.018 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1ccc(C)cc1)[n+]1ccc(C)cc1 27292049 QNUWZBQJIQRBCH-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1nc(NC(=O)CCCOc2cccc3ccccc23)sc1SCC#N 44788929 GRHORQZTZCVXGD-UHFFFAOYSA-N 397.525 5.018 30 20 GKED C[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 47570351 DDPMSHXUWSATDH-LJQANCHMSA-N 399.494 5.557 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)C2CCCCC2)cs1 54897767 OEZGZUNGYGZDHH-XFXZXTDPSA-N 388.920 5.644 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 57787891 SRXKUYIYZKHZHG-UHFFFAOYSA-N 396.475 5.305 30 20 GKED COc1ccc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 61068780 KHOPXLQBXUIXOG-LJQANCHMSA-N 376.481 5.018 30 20 GKED CCOc1ccc(CN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66955501 HIHIZGULKLJPQP-INIZCTEOSA-N 383.517 5.143 30 20 GKED CCCN(C(=O)NCc1ccc(OCC#N)cc1)[C@@H](C)c1cc2ccccc2o1 69316395 SSKXOVUAKYDGTJ-KRWDZBQOSA-N 391.471 5.018 30 20 GKED C=CCN(C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 107835432 FJWJMIWUKGJPPP-JKSUJKDBSA-N 394.462 5.698 30 20 GKED CN(Cc1cccnc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 122906804 XXVGCWUKURCPOK-FQEVSTJZSA-N 390.874 5.054 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)N(CCC#N)Cc3ccco3)c2)C1 123576465 HSLMRKUFUPWYRU-RXVVDRJESA-N 395.503 5.323 30 20 GKED Cc1ccc(Cl)c(NC(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)c1 124477961 LSKKHCPRKQDFCG-UHFFFAOYSA-N 392.890 5.295 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1nc(Cc2ccc(F)cc2)no1 133215795 APDQZYNYJQHWJP-CABCVRRESA-N 396.491 5.224 30 20 GKED CSCc1cccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 188171185 WCSRXLBENUQAQO-HNNXBMFYSA-N 385.558 5.266 30 20 GKED Cc1cc(O)c(C(C)C)cc1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 189962501 GOMJEYFCBHLLPR-AWEZNQCLSA-N 383.517 5.720 30 20 GKED O=C(O)CCOc1cccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)c1 208116750 UPDBBLYAOFPELQ-DAXSKMNVSA-N 399.657 5.396 30 20 GKED Cc1cc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)c(C)n1C1CCCCC1 214908764 WNECAAHURLKYFR-QXMHVHEDSA-N 392.499 5.463 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3ccccc3OC(C)C)o2)cc1C 255845965 PMIGGHVYGHGIIV-KRWDZBQOSA-N 379.460 5.252 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303372954 KNAJMWANPVJBLU-IRXDYDNUSA-N 397.544 5.608 30 20 GKED CCn1ncc2ccc(N=C(O)CC/N=C(/O)C34CC5CC(CC(C5)C3)C4)cc21 328882160 MRRLGBFBJHSEDC-UHFFFAOYSA-N 394.519 5.207 30 20 GKED Cc1c(C(O)=Nc2ccccc2N2C[C@H]3CC[C@H]2C3)cnn1C1CCCCC1 329871078 CDWRWLUWADMUMJ-HKUYNNGSSA-N 378.520 5.322 30 20 GKED CC(C)(/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)c(Cl)c1 330026908 MEZNWUYVYFNYQW-UHFFFAOYSA-N 397.346 6.110 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1ncc(-c2ccc(F)cc2F)o1 410365453 OBYIGNIKJAOOQR-UHFFFAOYSA-N 382.410 5.310 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430603120 MTPFRSGPQWWOCN-ZDUSSCGKSA-N 399.903 5.548 30 20 GKED CC(C)c1ccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)cc1 433012908 MEGAPIOWONVNAN-QHCPKHFHSA-N 389.568 6.458 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1cc(Br)ccc1Cl 436101137 HAYXCJFLYMUQHN-HXUWFJFHSA-N 376.747 5.071 30 20 GKED C=CCOc1cccc(NC(=O)N(CC)Cc2cccc(-c3ccncc3)c2)c1 437838204 KTNRFOXAYSDJAS-UHFFFAOYSA-N 387.483 5.367 30 20 GKED CCSCc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 438365694 CVYZYNTWZQVODJ-UHFFFAOYSA-N 381.545 5.501 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H]2CCCc3occc32)cc1F 438665608 NFALKQSRZXNUJC-SFHVURJKSA-N 391.402 5.282 30 20 GKED C[C@H](c1cccc(C#N)c1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 442692948 OFZUAWFIMVWWDS-BEFAXECRSA-N 392.890 5.202 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)Nc2ccc(CC#N)cc2Cl)cc1 452645179 NRNGJASMMCOYIS-UHFFFAOYSA-N 382.891 5.342 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2ccc(CC#N)cc2Cl)cc1OC 452646347 OLQMUCLQVJZHLT-UHFFFAOYSA-N 393.270 5.109 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@H]2c2ccc(F)cc2F)c(Cl)c1 455738176 UXNLKCPTKOPUJD-SFHVURJKSA-N 375.806 5.053 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458797481 GJIXPGCGJYYOPG-DHIUTWEWSA-N 375.516 5.147 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)c(OC)c1 459391729 CVIMDWCGVSDCGW-HNNXBMFYSA-N 399.516 5.014 30 20 GKED CN1CCC[C@H](CNc2ccc(C#N)c(C(F)(F)F)c2)[C@H]1c1cccs1 462884668 RBBQVSCNJBTWCA-KDOFPFPSSA-N 379.451 5.134 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)c2)cs1 464472647 FGWMYSSWQLEQER-OAHLLOKOSA-N 387.386 5.022 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nnnn1C1CCCCC1 468867843 FSXCGOKUEIRXSB-MRXNPFEDSA-N 388.475 5.015 30 20 GKED CC[C@@H](CC1CCCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 470845484 UJYCFIIATMUPDA-IBGZPJMESA-N 395.547 5.205 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)C[C@H](CC#N)c1ccccc1 474415743 PTQAUZBWMGQBIB-INIZCTEOSA-N 390.405 5.520 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H](OC)c1ccccc1F 475589132 YVYPHQWERUBFGU-KSFYIVLOSA-N 384.495 5.575 30 20 GKED C=C(C)[C@@H](NC(=O)c1cc(C)sc1Br)c1ccc(F)c(F)c1 475683577 FFVIAGZWHPUNFH-CQSZACIVSA-N 386.261 5.144 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(NC(=O)C2CCCCC2)c1)c1ccccc1 476253197 DYXNYNDMVKFRDC-HXUWFJFHSA-N 389.499 5.231 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)[C@H](C)c1ccccc1C(F)(F)F 476503049 AXKIBXYYAIPNOM-XYJFISCASA-N 388.433 5.401 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccc(F)cc1)C(C)C 476841446 CSMCADWPEYGZQE-OAQYLSRUSA-N 386.515 5.088 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)sc1-c1ccc(F)cc1 483197285 KXWDAFWMJNKUTC-LJQANCHMSA-N 386.451 5.901 30 20 GKED Cc1cccc(OCCCCC(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)c1 499807417 ASHMHNFZPDVAOF-GOSISDBHSA-N 391.298 5.232 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cc(C(F)(F)F)ccc3F)CC2)cc1 503449504 DXKJODGUNWTREF-UHFFFAOYSA-N 389.352 5.037 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc4c(ccc5ccccc54)[nH]3)CC2)cc1 503832125 SSMVMAHULZKHQU-UHFFFAOYSA-N 377.447 5.122 30 20 GKED Cc1ccccc1CCC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 504347605 QJNSHWRJXGYTNH-UHFFFAOYSA-N 384.479 5.211 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc1 504606264 LDOHPUZWLPPKKN-UHFFFAOYSA-N 396.368 5.551 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc2ccccc12 518168499 JFMJUAXMMPXFMN-SJORKVTESA-N 389.524 5.974 30 20 GKED Cc1ccc(SCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c(C)c1 518709073 ISSKICFRQAAGDH-HNNXBMFYSA-N 379.312 5.083 30 20 GKED C=CCN1CCC(NC(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CC1 519274850 UZWRWXRVWTTZOJ-UHFFFAOYSA-N 395.355 5.102 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 520409105 RNJWZROOJHLOJI-UHFFFAOYSA-N 390.462 5.109 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3Cc3ccccc3)cc2)cc1 520596515 NVXOEIXBJSBGGT-QFIPXVFZSA-N 397.478 5.590 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1ccc(F)c(F)c1 521316376 JYFJZWTUTNTFJF-AWEZNQCLSA-N 393.393 5.068 30 20 GKED N#CCCCCNC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 521596049 WLHIXEGGJSZWIA-SFHVURJKSA-N 393.339 5.637 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21 521912147 MKTRMEHEODDFKN-GOSISDBHSA-N 392.471 5.125 30 20 GKED N#CC1(CCCNc2ccc(Br)c(Cl)c2Cl)CCOCC1 537509299 JYAFXUBJPKDBTM-UHFFFAOYSA-N 392.124 5.268 30 20 GKED N#Cc1ccccc1OC1CCC(N[C@H](C[C@@H]2CCOC2)c2ccccc2)CC1 537977431 HNFFIMNQMMSSHO-OIULLBJASA-N 390.527 5.006 30 20 GKED COc1ccc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543034544 OBMLEPSBRGNFDK-ZWKOTPCHSA-N 386.495 5.654 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)CC1 543822811 GKCWYYRQJFAASO-DEOSSOPVSA-N 383.495 5.264 30 20 GKED C[C@H](NCc1ccc(C#N)cc1OC(F)F)c1nc(-c2ccccc2)cs1 544490524 VSDZHSCXHHQUPB-ZDUSSCGKSA-N 385.439 5.134 30 20 GKED Cc1nc(C2CC2)oc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 546773519 ZQMFLHSHUXAKPV-SFHVURJKSA-N 391.858 5.422 30 20 GKED Cn1ccc([C@@H](N[C@H]2CCCCc3cc(C#N)ccc32)c2ccc(Cl)cc2)n1 564813590 FSWRQNRRVKEYQC-GMAHTHKFSA-N 390.918 5.092 30 20 GKED COc1ccc([C@H](CCC#N)NCCOc2cccc(Cl)c2Cl)cc1 572587503 OZUONISNEYVGNM-KRWDZBQOSA-N 379.287 5.015 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2cccc(COC(C)(C)C)c2C)cc1 581089001 FTMJAJJMBVYMLA-UHFFFAOYSA-N 382.504 5.197 30 20 GKED C=CCN(CCC#N)C(=O)c1oc2ccccc2c1COc1ccccc1Cl 581994213 HWZUGMSKZRTMIC-UHFFFAOYSA-N 394.858 5.207 30 20 GKED N#CCCC[C@H](N[C@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598678982 CAFYWMHSIZTLSW-ZWKOTPCHSA-N 393.275 5.780 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCSC[C@@H]1c1ccccc1 609682423 JNBWBPGIJKCAGX-QFBILLFUSA-N 397.569 5.403 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c2)n1 610036766 DDWVVCBZWMAQFM-LBPRGKRZSA-N 393.537 5.429 30 20 GKED C=CCN(CC=C)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 611631002 LDQUAGRBKMZYKM-LJQANCHMSA-N 393.918 5.337 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 612314456 BVNRARSODJNEHE-UHFFFAOYSA-N 396.412 5.052 30 20 GKED Cc1nc(C(C)C)oc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 644786610 BNYCWJLOXGNKFO-NSHDSACASA-N 393.390 5.225 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2)n1 657528485 BYKZBEWNCAFXQU-RXVVDRJESA-N 383.561 5.361 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(-c2csc(C)n2)cc1 672239646 XKNUHGDNKTUPKY-UHFFFAOYSA-N 394.544 5.114 30 20 GKED CN(C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)C1CCC(F)(F)CC1 672657961 DLCRXIREMDGQKX-UHFFFAOYSA-N 386.311 5.382 30 20 GKED C=CCC[C@@H](NC(=O)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1)c1ccccc1 676422919 GKTWAYOYFUHZOH-QLFBSQMISA-N 394.359 5.076 30 20 GKED N#C[C@@H](C(=O)c1cccnc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 680169891 REVYGFSEAAPBDQ-ZDUSSCGKSA-N 387.386 5.078 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cc(C)oc1C 725839994 ZMJZPIDNZHJUDU-UHFFFAOYSA-N 380.448 5.543 30 20 GKED COc1cccc(CN(CC(C)C)C(=S)Nc2ccc(C#N)c(Cl)c2)c1 726484729 QCDTZAXVAMITNV-UHFFFAOYSA-N 387.936 5.075 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(F)c(Cl)c1 731322390 YPUAWPZPUCEZQL-NSHDSACASA-N 379.913 5.682 30 20 GKED N#Cc1ccc(SCc2nc(C(c3ccccc3)c3ccccc3)no2)cc1 731787955 NOMBTMHEBPUPBL-UHFFFAOYSA-N 383.476 5.414 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 742537245 JHKZGAHAQRWFJQ-UUOWRZLLSA-N 386.470 5.689 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2SCCc3sccc32)cc1 742537760 PGKZEFYNVUZLFR-FPOVZHCZSA-N 390.533 5.373 30 20 GKED C[C@@H](ON=Cc1ccccc1F)c1nc(-c2cccc(C(F)(F)F)c2)no1 744445721 TYOGAKMLOOZZQS-LLVKDONJSA-N 379.313 5.006 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)COc2c(Cl)ccc(Cl)c21 748585043 WEYRQILSGJOPIB-YFHOEESVSA-N 389.263 5.171 30 20 GKED COc1ccc(OC)c(C=NO[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)c1 752762681 WMDHYFZAAFWFOQ-CYBMUJFWSA-N 386.835 5.124 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2\CCc3sc(Br)cc3C2=O)cc1 754687788 NAFKWZMWHOEHFZ-KAQJVSAMSA-N 388.286 5.014 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)CCc2sc(Br)cc21 754687977 OMILMUHPGMJSKI-ZSOIEALJSA-N 397.297 5.180 30 20 GKED O=C1/C(=C\c2nc(Cl)cs2)[C@@H](C2CC2)CC/C1=C\c1nc(Cl)cs1 759083225 IJWVBGGNNZEJRF-UXXDDSQLSA-N 397.352 5.763 30 20 GKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1cc(Br)ncc1F 762421079 GIKBFJVBTUUQRM-VOTSOKGWSA-N 389.249 5.003 30 20 GKED C[C@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(OCC#N)cc1 776171905 QWFKJZOFILXVKL-SBUREZEXSA-N 391.902 5.272 30 20 GKED C#CCCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 776304134 LRGZWCFDYLAKPI-UHFFFAOYSA-N 377.513 5.302 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1 777141475 MKTAVDIZNWJMHC-UHFFFAOYSA-N 398.528 5.242 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1ccc2ccccc2c1)c1nccc2ccccc12 792094696 PKFQPMGDKVZJGK-JOCHJYFZSA-N 378.431 5.227 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792100005 CLOGUBMCINGJEK-DENIHFKCSA-N 378.859 5.168 30 20 GKED C=C(C)Cn1c(S[C@H]2CCc3cc(Cl)ccc32)nnc1-c1ccncc1 795221698 GNAMRPIPUCWSFT-SFHVURJKSA-N 382.920 5.349 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C(Cc1ccccc1)Cc1ccccc1 798493531 VQRRAUYJCVZNKI-LJQANCHMSA-N 384.479 5.018 30 20 GKED N#Cc1sc(NCc2nc3c(s2)C[C@H](c2ccccc2)CC3)nc1Cl 804618217 OGOSFJOVFIYLSC-GFCCVEGCSA-N 386.933 5.009 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1cccc(OC(F)(F)F)c1 810147460 GCAKDSHODZIECN-LLVKDONJSA-N 388.311 5.326 30 20 GKED N#C[C@H](C(=O)C1C[C@@H]2CC[C@H](C1)S2)c1nc2cc(C(F)(F)F)ccc2s1 892539357 WXBIKCCKTWAULO-PLKNYFGKSA-N 396.459 5.166 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCOc2cccc(Cl)c2)cc1 915180857 SKJYCNHOHHZNEQ-QFIPXVFZSA-N 390.870 5.403 30 20 GKED O=C(O)C(=O)/C(=C\c1ccc(C2CCCCC2)cc1)c1ccc2ccccc2n1 1776117299 SQMWKVOWPUCXJK-PGMHBOJBSA-N 385.463 5.477 30 20 GKED O=C(/C=C\c1cc(C(=O)O)c(Cl)s1)c1ccc(Oc2ccccc2)cc1 1776126668 TVOUEPNXDQIJSA-KHPPLWFESA-N 384.840 5.788 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3)s2)c1)C(=O)O 1776470923 NOIOJNFAPRFEBV-PLWJUESGSA-N 396.439 5.302 30 20 GKED CCCCCC[C@](C)(NCc1cccc(OCc2cccc(C#N)c2)c1)C(=O)O 1776804107 PJXRRYWRYNSWFE-DEOSSOPVSA-N 394.515 5.041 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(F)c(Cl)c1 1777569372 JUTWBIIFIGQCEU-XVNBXDOJSA-N 386.762 5.039 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3csc(C(F)(F)F)c3)c2c1 1777684054 SFHDJOJLFDAYEO-IWQZZHSRSA-N 382.384 5.576 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCC(=O)c2cc(C)n(C3CC3)c2C)n1 22723165 DTHVYBOMLXNDQK-UHFFFAOYSA-N 393.434 5.009 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1ccc(-c2ccccc2)cc1F 25714756 WFYIMCASBSJTQA-UHFFFAOYSA-N 391.471 5.159 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nnc(C2CCCCC2)s1 29186566 GVPSBXYEIDMMGO-UHFFFAOYSA-N 388.496 5.377 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1-c1nc2ccccc2s1 29780726 DGDYQAVOYZFKSG-HNNXBMFYSA-N 399.475 5.241 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)sc1C 41549269 IZFPSNBLGNJNRY-NSHDSACASA-N 380.416 5.484 30 20 GKED CCOc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 41779761 MEPLIKGDUHMWBO-UHFFFAOYSA-N 388.492 5.502 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N(C)Cc3ccc(C#N)cc3)cc2)c1 56711060 UMXKDGSDSWYJJZ-UHFFFAOYSA-N 387.439 5.023 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc(Cl)c([N+](=O)[O-])c1 59269367 LLVUFYYSOLBMGC-CSKARUKUSA-N 394.814 5.118 30 20 GKED CC[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(OC)cc1 60960006 GJOKWEBHLOIVRF-VWLOTQADSA-N 386.495 5.387 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)c1C 67585039 LUGGHRBTGSNWSG-UHFFFAOYSA-N 392.503 5.049 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2oc3c(C)ccc(C)c3c2C)cc1 111183364 NHPTWHXFQDTXAD-UHFFFAOYSA-N 376.456 5.317 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCc2ccccc2C1 114580469 UYOVFAKCFVNQJD-LPHOPBHVSA-N 379.529 5.102 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N(c2ccccn2)C2CCCC2)cc1 154459757 HSRJYYOOUAEYFT-UHFFFAOYSA-N 397.478 5.122 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)N[C@@H](C)CC)cc1 154477555 XXJQDXHVGSFRMH-SFHVURJKSA-O 397.608 5.513 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 154650005 AMDINHDFFJLGHW-UHFFFAOYSA-N 394.340 5.019 30 20 GKED N#Cc1c(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])sc2c1CCCCCC2 175761638 OUWJPNONZGFVBE-UHFFFAOYSA-N 389.864 5.093 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 175780114 CVHKGSSQPNUVHO-UHFFFAOYSA-N 385.448 5.219 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2CSC2=NCCS2)c1 176200177 WBJAWYXFPGSGQR-UHFFFAOYSA-N 398.553 5.230 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCCc2nc3ccccc3s2)n1 177762604 RVEPHWWBHKQQPG-AWEZNQCLSA-N 383.542 5.465 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)c1 180090805 ZWACDJNOCBLCBW-NQIIRXRSSA-N 377.488 5.435 30 20 GKED Cc1cc2c(F)c(OCC(=O)Nc3ccccc3S[C@@H](C)CC#N)ccc2[nH]1 184960294 XHPFQDDHOIRCPZ-AWEZNQCLSA-N 397.475 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCc2cccnc2)c1 189882193 BOXFCMIJCNFRRF-UHFFFAOYSA-N 386.495 5.765 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1cccs1)C[C@H]1CCCO1 191485924 AJPDRPQEVIQCMX-LJQANCHMSA-N 398.572 5.813 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(F)cc3)s2)c1 236898833 DHJHKCCVQRSIBM-LJQANCHMSA-N 380.488 5.525 30 20 GKED N#C[C@H](C(=O)[C@H]1CSc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 303734773 WNLGSGYENXHTRH-CVEARBPZSA-N 396.924 5.529 30 20 GKED CCC(C)(C)C1CCC(C/C(O)=N/[C@@H]2CCO[C@@H](c3cncn3C)C2)CC1 328667310 DKBSBMRIFHSZLW-SMRJSYMMSA-N 375.557 5.229 30 20 GKED Cc1cc(C)c(N=C(O)CN2CCCC[C@@H]2c2n[nH]c(C(C)C)n2)c(Cl)c1 329852717 ROWJRQASZWLWAB-MRXNPFEDSA-N 389.931 5.014 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccc(Br)cc2)ccc1OC 409520554 KCJAITRBVYINKG-OAHLLOKOSA-N 390.321 5.263 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@@H](C)CC3)c(C(F)(F)F)o1 410990388 WJEQYJSPWZLQSE-WPRPVWTQSA-N 382.407 5.478 30 20 GKED N#CC1(CC[S@@](=O)Cc2cccc(C(=O)Nc3ccccc3)c2)CCCCC1 417150563 KJNDQMJGKHVLCD-MUUNZHRXSA-N 394.540 5.052 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1csc(-c2ccoc2)n1 425528944 ABIQYFRDGGDYGJ-ZDUSSCGKSA-N 391.418 5.336 30 20 GKED Cc1sc(CNC(=O)Nc2cccc(C#N)c2C)nc1-c1ccc(Cl)cc1 431714225 FXUCTMWMOQHUAQ-UHFFFAOYSA-N 396.903 5.274 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)cc1OCC1CC1)c1ccccc1 432954609 INTLLGKCRCIWTB-LJQANCHMSA-N 381.451 5.171 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CC2(CCC2)[C@@H]1c1ccccc1 433138835 ZJMFENJLIMFYFT-DEOSSOPVSA-N 393.490 5.241 30 20 GKED COC(=O)[C@@H](Nc1cccc(CSC2CCCC2)c1)c1cccc(C#N)c1 434858854 BQSJARFZWKOLQH-NRFANRHFSA-N 380.513 5.060 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H](CC)c1cccc(C(F)(F)F)c1 437677598 WTQRHTVPZBKUNF-MRXNPFEDSA-N 376.378 5.108 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC2(CCCCCC2)C1 438079940 ZVHGWWIXFAJZQN-GOSISDBHSA-N 385.577 5.907 30 20 GKED CCSCc1cccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 438375876 IKHINTXAVNUQPS-NHCUHLMSSA-N 379.529 5.243 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2Cc2nnc(-c3cccc(C#N)c3)o2)cc1 441221076 CMEBDUKEGBZKIN-NRFANRHFSA-N 386.499 5.243 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(Cl)cc1Cl 446859046 XZTIAGFVPLSAGR-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(-c2cscn2)c1 463744741 JPKQWCUKZCOHIQ-CQSZACIVSA-N 379.510 5.314 30 20 GKED C[C@H](C(=O)N(CCC(F)(F)F)CC(F)(F)F)c1ccc(C(F)(F)F)cc1 466357390 NIBZOCQCTCNIDG-VIFPVBQESA-N 395.265 5.152 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccn(-c2ccc(Cl)cc2)n1 467259408 YGRQCKIUTMFBKJ-HNNXBMFYSA-N 382.920 5.532 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1 475579103 SZIMXOYFVVZFKP-UHFFFAOYSA-N 381.476 5.504 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CN2CCCCC2)cc1 476082560 XVTSXZIQSVZJEO-UHFFFAOYSA-N 376.544 5.777 30 20 GKED COc1ccc(CN[C@H]2CCCC[C@H]2Cc2ccccc2)cc1OCCCC#N 477336000 FDXKBQMVCMTOBL-GOTSBHOMSA-N 392.543 5.269 30 20 GKED COc1cc2c(cc1OC)[C@H](N[C@@H](C)c1ccc(-c3cccc(C#N)c3)cc1)CC2 479460855 MEJPZXQWHCPWCR-BXKMTCNYSA-N 398.506 5.581 30 20 GKED COc1cc(Cl)c(Cl)cc1NCc1ccc(OC)c(OCCCC#N)c1 480500119 OVDHDFRIFKMZOE-UHFFFAOYSA-N 395.286 5.305 30 20 GKED C[C@@H](CC#N)NC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 480602586 QJJNORCWVAWZPX-LBPRGKRZSA-N 398.825 5.243 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480659725 DMJMZSZKCATIHX-RBZFPXEDSA-N 376.403 5.240 30 20 GKED CN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 481791074 BMJDEQXLYIFLBD-UHFFFAOYSA-N 375.403 5.154 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(OC2CCCC2)c1 482549957 DULQIPVWVVSLGX-QGZVFWFLSA-N 392.480 5.116 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cccc(-c3ccc(Br)cc3)c2)CC1 486338680 ADJFPOJAIPISOQ-UHFFFAOYSA-N 398.304 5.274 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cc(F)c(F)cc1F 487224841 OJBWPRIRRNPGIX-UHFFFAOYSA-N 396.368 5.258 30 20 GKED C=CCn1c(S[C@@H](c2ccccc2)c2ccccc2C)nnc1-c1cccnc1 491004640 INQSDJMQHAKJGQ-QFIPXVFZSA-N 398.535 5.716 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2nc(-c3cccs3)no2)n1 501613540 RVLZTDKLLAHRNP-SECBINFHSA-N 396.419 5.245 30 20 GKED Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccccc1Sc1ccccc1C#N 501981947 APTVNYSTCPKIQK-NRFANRHFSA-N 384.504 5.435 30 20 GKED N#Cc1ccc(C2=CCN(Cc3coc(-c4ccc(Cl)cc4)n3)CC2)cc1 502529473 GSPRUIYKSPRRQV-UHFFFAOYSA-N 375.859 5.156 30 20 GKED N#Cc1cn(Cc2csc(C3CCCCC3)n2)c2ccc(Cl)cc2c1=O 502834446 UCSHZZZYPUBBKJ-UHFFFAOYSA-N 383.904 5.079 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 505364515 RCOINOIGQCSSSK-ZHRRBRCNSA-N 389.886 5.361 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)N[C@@H](C#N)c1ccccc1F 505946686 ARGYSHLKXODWCU-IBGZPJMESA-N 390.414 5.011 30 20 GKED Cc1c(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)sc2ccc(C#N)cc12 506324396 JCBQMVCKBUDACN-OAHLLOKOSA-N 380.435 5.132 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1ccc(F)cc1F 510172840 OEXIEPVHEGRJAC-ZDUSSCGKSA-N 395.434 5.018 30 20 GKED Cc1ccccc1NCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 512578907 UNPMTMORXWWCLL-UHFFFAOYSA-N 385.467 5.408 30 20 GKED N#Cc1ccc(CN[C@H](c2c[nH]c3ccccc23)C(F)(F)F)c(OC(F)F)c1 513145337 RGADCNUDECKHOE-QGZVFWFLSA-N 395.331 5.034 30 20 GKED CCc1ccc2occ(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)c2c1 513659873 DULVJLVOYVGSFR-CQSZACIVSA-N 379.366 5.230 30 20 GKED Cc1ccc(-c2noc([C@@H](C)Nc3cc(C#N)ccc3OC(C)C)n2)cc1F 516381979 YNQLJSJVXZGBHC-CQSZACIVSA-N 380.423 5.016 30 20 GKED Cc1ccc(SCCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 518848067 WOBSEPWEXGLGMI-QGZVFWFLSA-N 379.312 5.165 30 20 GKED CC(C)Cc1nc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cs1 520164792 OSBRGMCKMASUQU-LLVKDONJSA-N 375.906 5.095 30 20 GKED CC(C)(c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1)C(F)(F)F 520720154 UGMJWXZTDJJMKB-AWEZNQCLSA-N 388.414 5.626 30 20 GKED N#Cc1ccc(/C=C\c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1 521049451 DCVVHGWXNJEHTK-WZUFQYTHSA-N 384.370 5.105 30 20 GKED COc1ccc(SCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 521498981 RRRKIXRRCUUVIG-UHFFFAOYSA-N 390.464 5.090 30 20 GKED C=CCOc1ccc(CNCc2ccc(Br)c(F)c2)cc1Cl 524155950 GACCVOBYNGYBAZ-UHFFFAOYSA-N 384.676 5.096 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc3[nH]ccc23)cc1 531330203 PICGUGCTMJAONU-UHFFFAOYSA-N 383.426 5.021 30 20 GKED N#CC1(CCCSc2nc3ccccc3n2-c2ccccc2)CCOCC1 537307151 DYMHMEGSAHLCGM-UHFFFAOYSA-N 377.513 5.218 30 20 GKED C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1Cc1nnc(-c2cccc(C#N)c2)o1 540054571 XXZMCTCWMIBJTA-GFCCVEGCSA-N 399.281 5.034 30 20 GKED CC(=O)c1cccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541074514 DHUIZJIQLYEACW-MRXNPFEDSA-N 383.451 5.311 30 20 GKED COc1cccc(CN(C)C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541158035 SNZOISSECFSQMW-SFHVURJKSA-N 399.494 5.136 30 20 GKED CCN(C(=O)c1ccc(Cl)c(C#N)c1)[C@@H](c1ccc(C)cc1)c1cccnc1 541625154 IQCBHUOKOZBTLO-QFIPXVFZSA-N 389.886 5.167 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1cccn1C)c1ccc(-c2cccc(C#N)c2)cc1 542085325 NPIJFVZTNAPFPH-UUOWRZLLSA-N 398.510 5.171 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCCCc1ccsc1 542104960 XVYMIPTWQQFBNE-HNNXBMFYSA-N 390.599 5.304 30 20 GKED C[C@H]1C[C@H](c2noc(-c3ccc(Sc4ccccc4C#N)cc3)n2)CCO1 547219942 LMGXTMIBHSICAP-GOEBONIOSA-N 377.469 5.042 30 20 GKED N#CCCC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1 552312199 XAVYMAAGHQXMPC-FQEVSTJZSA-N 391.496 5.848 30 20 GKED N#Cc1cc(NC(=O)C2CCC(OC(F)F)CC2)ccc1Oc1ccccc1 552446559 LGDTXFSTVVDUFB-UHFFFAOYSA-N 386.398 5.087 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1ccccc1 557490752 RGMYYCVKJZMJHT-MSOLQXFVSA-N 385.467 5.581 30 20 GKED CC(C)Cn1c(-c2cc(Cl)ccc2Cl)nnc1N1CCC(C)(C#N)CC1 559133670 KUSLGWGLCLMANM-UHFFFAOYSA-N 392.334 5.038 30 20 GKED Cc1ccc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)cc1OC(F)F 575032412 OXFGWWKLSFRAQO-UHFFFAOYSA-N 381.247 5.146 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2Oc2ccncc2)s1 576448330 RJXNUQVZSXSYAW-INIZCTEOSA-N 377.469 5.118 30 20 GKED COc1ccccc1[C@@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 590942345 LXPZQPAFGCUKPR-VXKWHMMOSA-N 391.515 5.367 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1 603746901 HMNNCFYNLBRKOQ-HNNXBMFYSA-N 389.421 5.260 30 20 GKED CC(C)CCc1ccccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 609058748 BTZULSSRLVYECM-UHFFFAOYSA-N 388.467 5.571 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)cc1 610078585 UFGWEXQQPUYIGQ-JOCHJYFZSA-N 380.850 5.239 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1CC2)c1ccc2ccccc2n1 613291117 UJZRAZFKWSEAKZ-LJQANCHMSA-N 380.472 5.552 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)n1C(C)C 613319128 PUCPXRYTMNNLPT-SFHVURJKSA-N 397.931 5.953 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 726559549 KFPBYIYGSCBLFU-KRWDZBQOSA-N 395.553 5.257 30 20 GKED Cc1c(C(=O)/C=C\c2cccc(C(F)(F)F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727267797 RLNRLLNLUAKRLO-SREVYHEPSA-N 394.305 5.035 30 20 GKED C=C(C)COc1cccc(NC(=S)Nc2ccc(SC(F)F)cc2)c1 727284453 HOIFSAMJLKXDCB-UHFFFAOYSA-N 380.485 5.765 30 20 GKED FC(F)(F)c1ccc(CON=Cc2cccc(OCc3ccncc3)c2)cc1 727433767 CEPVZDYKQFWZMO-UHFFFAOYSA-N 386.373 5.230 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1csc(-c2ccccn2)n1 727781277 IVNCUGXXIKZOTB-KHPPLWFESA-N 389.505 5.533 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)cc1 728168999 ORBHPLSPWITNFL-HXUWFJFHSA-N 379.529 5.056 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@H](C)c2ccccc2OC)c1 728475698 PUIYAAMXPOVIIR-SFHVURJKSA-N 389.520 5.465 30 20 GKED CCC1CCC(N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 728738563 QYCJEWKWBLCOFO-CKRJSAQMSA-N 375.516 5.775 30 20 GKED Cc1nc(CCC(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)cs1 733089526 IWBVWSGPNDIBGL-ZDUSSCGKSA-N 387.574 5.107 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cc(-c4ccccc4)no3)cc2F)c1 733995696 AHFPGLZWGWLFBI-UHFFFAOYSA-N 399.425 5.543 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccc(O)c3ccccc23)c1 734176624 IJPIXOVVKZAVAU-UHFFFAOYSA-N 394.430 5.248 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)cc1 736955097 FAGMBFZCNSFSGL-PKTZIBPZSA-N 399.494 6.084 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 739143929 TYTYRWMVEMBISE-KBXCAEBGSA-N 382.385 5.309 30 20 GKED O=C(/C=C\c1ccc(-c2cccs2)cc1F)c1cccc(N2CCOC2=O)c1 745626333 MRUYBFVWPZGXRH-HJWRWDBZSA-N 393.439 5.407 30 20 GKED C=CC[C@H](NC(=O)N[C@H](CC(C)C)c1ccccc1OCC)c1ccncc1 746419902 ACTANPFPRISHJD-LEWJYISDSA-N 381.520 5.184 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(Cl)c(Cl)c3Cl)cc12 748511350 KBMLGSQCAKHIEI-UTCJRWHESA-N 380.662 5.133 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(CCC#N)CC(F)(F)F)c2c1 748804635 WSXAQTCBOWUEEQ-UHFFFAOYSA-N 397.400 5.128 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)N[C@H]1CCCC[C@H]1C 749101090 AOVNHZSOKSFNKM-DYVFJYSZSA-N 399.373 5.029 30 20 GKED N#C[C@H](C(=O)CCCc1csc2ccccc12)c1nc2cc(F)ccc2s1 756274749 IMOJKRYWXIEHKD-MRXNPFEDSA-N 394.496 5.849 30 20 GKED COc1ccc(C(C)(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 764841557 VSOXZAXJJUWCPG-QHCPKHFHSA-N 384.479 5.267 30 20 GKED CC(=O)CCCCCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 774016828 KQWFSCIHUBKRAD-CQSZACIVSA-N 390.455 5.194 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(C)o2)C2CCCC2)ccc1OC 775631708 KUWDISUXXZWWFC-XXBNENTESA-N 382.504 5.299 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 775722178 FRVFLQXRAYWRJN-RTBURBONSA-N 399.494 5.869 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1)c1ccccc1 777665062 AYRPDTSZFYAMIK-IBGZPJMESA-N 393.874 5.611 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1)c1ccccc1 779141532 OCRXNIBCKZIKRC-HXUWFJFHSA-N 398.457 5.122 30 20 GKED CC[C@@H]1C[C@H](C=NNc2ccc(Br)cc2C(F)(F)F)CCO1 779775369 AOXVXRPWZNHSDU-ZYHUDNBSSA-N 379.220 5.071 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@@H](CCCc2ccccc2)C1 780673043 NDLRCXKHRBSMPX-PZJWPPBQSA-N 391.515 5.244 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)c1 796350352 AYXDTBINESBNBO-HZPDHXFCSA-N 377.431 5.241 30 20 GKED Cc1cccnc1[C@H]1CCCC(=NNc2ncnc3sc4c(c23)CCC4)C1 799106157 XHNPHZLREZREDU-AWEZNQCLSA-N 377.517 5.009 30 20 GKED O=C(Nc1ccc(F)cc1OC(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801677390 LQWXKEVILSXVJM-CYBMUJFWSA-N 381.247 5.095 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccccc2OCc2ccccc2)SC1=S 814290888 RCMCCBAMBRNOHU-XDHOZWIPSA-N 381.522 5.043 30 20 GKED C[C@H]1CCCCN1Cc1ccc(NCc2cc(C#N)ccc2Br)cc1 864005489 YOPPKRXGIDPOGF-INIZCTEOSA-N 398.348 5.307 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C2CCCCC2)cc1 916681657 VTFCIMZVZZEQLU-ZEQRLZLVSA-N 387.527 5.919 30 20 GKED CCCCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 916928974 ZJPGSCUFPJTNPI-MRXNPFEDSA-N 389.282 5.297 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(COC(C)C)cc2)cc1 916954750 KCCAYJGAHPNANL-HTAPYJJXSA-N 392.499 5.086 30 20 GKED CCCc1ccc(CN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)cc1 1167789737 WCQZSMWLHQWPGK-UHFFFAOYSA-N 396.494 5.299 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NNc1c(Cl)cc(Cl)cc1Cl 1776014418 HCZHXZHJKOWTKG-UHFFFAOYSA-N 397.689 5.888 30 20 GKED O=C(/C=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccccc1Cl 1776115393 XFCVEUNCFIHPMH-TWLJRWAQSA-N 392.838 5.441 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)c1 1776341422 GYMNAWCSJAXMKK-OVCLIPMQSA-N 384.475 6.146 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)CS2 1777371047 CZPNRVPNOUEZNW-XNTDXEJSSA-N 392.432 5.025 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)cc2C)[n+]2cccc(C)c2)cc1 41466049 MROBGTNVCZFQFQ-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(C)c(C)c2)cs1 54895846 OCCBVOPSGVRLCO-XFXZXTDPSA-N 390.508 5.649 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 66179338 AYLJKSSSONCLJQ-SFHVURJKSA-N 379.504 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)c1ccc2ccccc2c1 66814211 SRDFNDVCMUNXGN-OAHLLOKOSA-N 382.510 5.035 30 20 GKED CCS[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)C(C)C 97542483 CZLNOOMHIIOZRF-OAQYLSRUSA-N 382.529 5.162 30 20 GKED C=CCn1c(SCC(=O)c2ccc(C3CCCCC3)cc2)nnc1C1CC1 104588033 CWTMKPPJKNKGFS-UHFFFAOYSA-N 381.545 5.364 30 20 GKED CSc1ccsc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 107119331 WPUMOPXOKQUHIZ-UHFFFAOYSA-N 382.535 5.421 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Cl)ccc1Br 108201918 PFVMPMYMZGFAEE-UHFFFAOYSA-N 395.709 5.361 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cccc(SC(F)F)c2)c1 113563624 IBLZNLJAUGSZJJ-UHFFFAOYSA-N 377.416 5.328 30 20 GKED N#C[C@H](Sc1nnc(-c2ccccc2Br)o1)C1CCCCC1 115185749 NFTXJIYXLWTLIQ-AWEZNQCLSA-N 378.295 5.064 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)N(CCC#N)CC1CC1 120784554 AUURRKVIGNLKII-UHFFFAOYSA-N 395.528 5.145 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 131338387 WXUXOIICEDVZCY-KBXCAEBGSA-N 375.394 5.111 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 165802607 RYNCWVDDJCUGHZ-IVOILVROSA-N 379.872 5.138 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c2c(C(C)C)noc2n1 171819180 HPQWLWWQKUIMNT-CQSZACIVSA-N 394.500 5.301 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(OCC(F)(F)F)c1 172907159 UCPKTDCKYHYGOB-AWEZNQCLSA-N 380.435 5.634 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](C)Sc2ccnc3cc(Cl)ccc23)n1 175081276 BHHDQKCAMLMWNJ-SMDDNHRTSA-N 387.917 5.010 30 20 GKED C[C@@H](NCCCC(C)(C)C#N)c1nc(-c2ccc(Br)cc2)cs1 184955672 GQIYTJHMHGETFB-CYBMUJFWSA-N 392.366 5.553 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)Cc1nc2ccccc2s1)c1ccc(F)c(F)c1 185476980 QZGHEDVPAWQSCW-LJQANCHMSA-N 387.455 5.033 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCn1c(C)nc2ccccc21 191437521 ZZVRPEVAZQIPJX-UHFFFAOYSA-N 376.504 5.018 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cnn(C2CCCC2)c1C 192699772 UYHVISQFLCFZRQ-UHFFFAOYSA-N 393.409 5.143 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc(-c3ccc(F)cc3)nc3ccccc23)n1 193271142 FXORHVRONJRYPZ-GOSISDBHSA-N 387.439 5.296 30 20 GKED C=CCc1cc(CN[C@H](c2ccccc2)c2ccccc2OC)cc(OC)c1O 237411131 RBJABGULBBMYSV-XMMPIXPASA-N 389.495 5.017 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1 237611291 KAWGCIJULZDDQS-CJAUYULYSA-N 382.463 5.603 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3cccc(Cl)c3Cl)o2)cc1 255397355 FDMFDOKBTJWTLI-GFCCVEGCSA-N 376.243 5.464 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1sc2cccc(F)c2c1COc1ccccc1 303117961 LRGGXJQJJYRDLR-HNNXBMFYSA-N 396.487 5.241 30 20 GKED CCc1cccc(C)c1N=C(O)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 329431781 INALORSITPFTJW-LJQANCHMSA-N 395.551 5.148 30 20 GKED Cc1ccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)c(OC(C)C)c1 431297391 YVSPNNXHSUBBLU-NRFANRHFSA-N 379.504 5.017 30 20 GKED Cc1cc(F)ccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 433754046 QCEKHVMZIICPTP-UHFFFAOYSA-N 382.382 5.411 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 437657380 QQXSIEOZBHRYSM-GOTSBHOMSA-N 389.543 6.237 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 437736939 XSELAUYCABQOGB-QVKFZJNVSA-N 393.918 5.790 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)c1 438473887 GMXXMYLZLSKUKB-UHFFFAOYSA-N 396.859 5.169 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1)c1ccccc1 438850842 NIUFRWZBYBSUIN-GOTSBHOMSA-N 387.458 5.259 30 20 GKED C[C@H]1CCC[C@](C#N)(NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)C1 442710024 BBJWEASHNGMSRA-BUXKBTBVSA-N 376.287 5.191 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 442734965 HKCGUDCSZSRYCA-UHFFFAOYSA-N 378.303 5.390 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1cccc(COc2ccccc2C#N)c1 443109270 LRJKCMNCVMBNCY-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C=CCC[C@H](NC(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1)c1ccccc1 444254868 VSPRSRYVEPRBJJ-NRFANRHFSA-N 382.463 5.119 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cc3[nH]ccc3cc2C)cc1C 444453075 FYGKIWBQKOTBIX-UHFFFAOYSA-N 397.482 5.123 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1cc(F)cc(C(F)(F)F)c1 445674537 SYTCQCOAEWPHTF-UHFFFAOYSA-N 381.247 5.038 30 20 GKED N#CCCCOc1cccnc1NC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1 455162694 GKJDRSMEARHUFI-SFHVURJKSA-N 398.894 5.177 30 20 GKED C=CCC1(CNC(=O)c2ccccc2SCc2c(C)noc2C)CCCC1 456482673 FJLKCDYCEQKDAW-UHFFFAOYSA-N 384.545 5.450 30 20 GKED C=CCn1c(SCc2cncc(C(F)(F)F)c2)nnc1-c1ccc(C)cc1 460870400 USZJPRKMFLFATJ-UHFFFAOYSA-N 390.434 5.146 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H]1C[C@H]1c1ccccc1 461256083 GRLTVNOSUXONSL-NEWSRXKRSA-N 396.581 5.414 30 20 GKED Cc1ccc(CCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)o1 471904832 HMBXYBQHKBIPKN-UHFFFAOYSA-N 382.407 5.184 30 20 GKED CCCOc1nc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc2ccccc12 474442356 WEPPPURNYWWUGK-INIZCTEOSA-N 379.485 5.094 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1cccc(Cl)c1 475562273 NPGMDMSDLILYTF-NRFANRHFSA-N 382.935 6.561 30 20 GKED Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C[C@H](CC#N)c1ccccc1 475597987 BBAPMBSFKVZJGB-JTHBVZDNSA-N 398.510 5.143 30 20 GKED C=CCCC1(C(=O)N[C@@H]2CCCc3nc(-c4ccc(OC)cc4)sc32)CC1 475788150 BFLADCLNINPQEY-GOSISDBHSA-N 382.529 5.059 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 476205688 QDISYRHREGWLDA-MAUKXSAKSA-N 382.435 5.023 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1ccccc1 476401048 YGNPNGNXQSIHJN-SFHVURJKSA-N 398.959 5.511 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCCN(C)Cc1ccco1 482169867 ORLKVAWYKXLNJO-UHFFFAOYSA-N 383.536 5.117 30 20 GKED N#CCCCCN[C@H]1CCCc2nc(-c3ccccc3Br)sc21 482434701 GKHFOXZEEUNKJD-HNNXBMFYSA-N 390.350 5.233 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 484981221 REAFABGGXVXUTA-HNNXBMFYSA-N 378.259 5.169 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487496867 AMCGBLDRRNNXPN-JOCHJYFZSA-N 390.527 5.536 30 20 GKED Fc1ccc([C@H](NCc2nc3cc(C(F)(F)F)ccc3o2)C(F)(F)F)cc1 488215506 GOMWGYHXCANRKE-HNNXBMFYSA-N 392.274 5.379 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 497358660 UVHZFHUGACBNON-JPYJTQIMSA-N 395.572 5.348 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CNc3c(F)cc(C#N)cc3F)c2)cc1 500490740 LMYNPMHYPZEUAB-UHFFFAOYSA-N 377.394 5.009 30 20 GKED CC(C)[C@H](CNC(=O)N1CCC(C)(C#N)CC1)Cc1ccc(Cl)cc1Cl 503929417 QTNQKOAYHGTWAP-INIZCTEOSA-N 396.362 5.143 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(NC(=O)[C@H](C)CC)c1 505028362 CJIVYMWYFRWYQJ-QGZVFWFLSA-N 379.504 5.112 30 20 GKED COCCCCN[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 509007450 RKTKREFDAHOKFZ-LBPRGKRZSA-N 397.281 5.344 30 20 GKED CC(C)Oc1ccc(CN[C@H](C)c2ccc(C#N)cc2F)c(C(F)(F)F)c1 512641503 HPXQMEHAZPQJFS-CYBMUJFWSA-N 380.385 5.354 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cccc(-c3ncco3)c2)c1 513967782 PYQDYHYCGVZNFB-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CSc3ccc(F)cc3)cc2)cc1 519977636 GXGLQAJCIHIQLB-UHFFFAOYSA-N 378.428 5.220 30 20 GKED CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(C)Cc1cccc(C#N)c1 521299875 KRBYGVOJJYDPHP-SFHVURJKSA-N 390.314 5.028 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CCCOc2cccc3ccccc23)c1 524113656 BIRAMMBABDXANM-UHFFFAOYSA-N 396.393 5.111 30 20 GKED CC[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)N(CC)CC 531050486 LQGVCPDBGHVWCG-PZJWPPBQSA-N 383.923 5.054 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCc3ccsc3C2)cc1 535658706 MMAMMONOHBWECO-UHFFFAOYSA-N 390.533 5.111 30 20 GKED Cc1cccn2cc(-c3ccc(NC(=O)c4ccc(C5(C#N)CC5)cc4)cc3)nc12 537484149 GUNDXWOXVFXICK-UHFFFAOYSA-N 392.462 5.117 30 20 GKED CCN(C(=O)c1sc(C(C)(C)c2ccccc2)nc1C)c1ccc(C#N)cc1 538813000 VDDNIZOGZIXWNQ-UHFFFAOYSA-N 389.524 5.316 30 20 GKED C=CCC[C@@H](NCc1ncn(-c2ccccc2)n1)c1ccc(C(F)(F)F)cc1 539332025 YKXYFTHKKVEAOX-LJQANCHMSA-N 386.421 5.083 30 20 GKED CC[C@H](C)Oc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccn1 539679787 MEOVUPAVVCWIEE-YJBOKZPZSA-N 391.496 5.181 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1 540225981 OYCBAMJIFZBNSO-KRWDZBQOSA-N 385.467 5.254 30 20 GKED C[C@@H](C(=O)Nc1sc(-c2ccccc2)cc1C#N)c1ccc([N+](=O)[O-])cc1F 541612048 OYMBGEDWJYOYHM-GFCCVEGCSA-N 395.415 5.076 30 20 GKED N#Cc1ccc(CN2CCC(Nc3ccccc3N3CCCCCC3)CC2)cc1 541902341 DYTCMOCCRVTPOZ-UHFFFAOYSA-N 388.559 5.015 30 20 GKED Fc1ccc([C@@H](NCc2ccc(C(F)(F)F)cn2)C(F)(F)F)cc1Cl 556534158 OGCLXPIQSZRYRA-CYBMUJFWSA-N 386.698 5.286 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC=C(c3ccncc3)C2)cc1 558314393 ALVPQANKARLNEH-UHFFFAOYSA-N 396.450 5.067 30 20 GKED CC(C)(C)c1nc2ccc(NC(=O)N3Cc4ccc(C#N)cc4C3)cc2s1 594074303 FKTKPPFRMRBWDD-UHFFFAOYSA-N 376.485 5.013 30 20 GKED CC[C@@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)[C@@H](C#N)c1ccccc1 595292399 XRMQWGFOOBQTGB-BEFAXECRSA-N 389.421 5.009 30 20 GKED CSc1ccc(Cl)c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 596983559 FSEWRCLJWWDZPJ-APWZRJJASA-N 385.920 5.366 30 20 GKED C[C@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)o1 603624271 YDIVIRLUZNIIMB-MGPUTAFESA-N 387.439 5.033 30 20 GKED CC(C)c1cnc(SCC(=O)c2cn(CCC#N)c3ccccc23)n1C(C)C 606757318 FQNOGNWGOJRAJU-UHFFFAOYSA-N 394.544 5.431 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1F)c1ccccc1C(F)(F)F 607822831 URRWNIFYOKCXEX-SECBINFHSA-N 379.275 5.606 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609062897 MDCMYGAHUJYUAK-UHFFFAOYSA-N 382.872 5.413 30 20 GKED Cc1ccccc1COc1cccc(CC(=O)Nc2sc(C)c(C)c2C#N)c1 609261496 RXXXFTUQOWXLMZ-UHFFFAOYSA-N 390.508 5.305 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccc(F)cc12 609403047 OQVSWFLVQIBCBC-CYBMUJFWSA-N 397.475 5.454 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609436367 JUHJJNJUASEGCV-IRXDYDNUSA-N 397.544 5.751 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)cc1 609469305 WCRKFULQHKVSEX-VWLOTQADSA-N 391.474 5.817 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3ccccc3)c2)c1 609659187 XMUDTZBPNHDKTI-XMMPIXPASA-N 382.463 5.115 30 20 GKED Cc1c(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)oc2ccccc12 609682701 WIQZWVCFMQKHBN-UHFFFAOYSA-N 398.422 5.122 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3occc3s2)cc1 609861887 QTRKNEWXARSSSK-UHFFFAOYSA-N 390.420 5.419 30 20 GKED FC(F)(F)c1cccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 618451050 OVILIFCPHONVPR-RYUDHWBXSA-N 379.266 5.268 30 20 GKED COc1ccc([C@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 675737979 LCZMKUSGQCOCLQ-FTYKPCCVSA-N 387.339 5.394 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726447098 QWNMUQWCGABVTL-IBGZPJMESA-N 385.920 5.144 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417275 LXLFXCQQJQQAOX-SUMWQHHRSA-N 396.487 5.377 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)C(C)C)c1 730494447 VJLRJYSACWHSDC-UHFFFAOYSA-N 396.462 5.209 30 20 GKED C#CCOc1cccc([C@H](C)OC(=O)Cc2sc(C)nc2-c2cccs2)c1 730700274 QLVOLFOVIVWSKR-AWEZNQCLSA-N 397.521 5.039 30 20 GKED N#C[C@H](NC(=O)Cc1ccc(Cl)cc1Cl)c1cccc(Cl)c1Cl 731195727 NINSPRMRLTXCFR-AWEZNQCLSA-N 388.081 5.224 30 20 GKED CCCCCCCCCCC(=O)N1CCC([C@@H]2CCCCCN2C(C)=O)CC1 731469151 SMZHLGWPTQXQHY-QHCPKHFHSA-N 392.628 5.547 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(F)c1 736955540 MFMJWYTZUFJOEG-JOCHJYFZSA-N 387.458 5.538 30 20 GKED COCCOc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741842729 MRXOGOODSONPGG-NYYWCZLTSA-N 396.430 5.262 30 20 GKED O=C(/C=C/c1ccc(SC(F)(F)F)cc1)c1ccc(N2CCOC2=O)cc1 748583398 CCGUGAHZCRKDOH-XCVCLJGOSA-N 393.386 5.151 30 20 GKED N#Cc1csc(C(=O)O[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)c1 752195691 MJGZIVPTWGCFMZ-GFCCVEGCSA-N 379.281 5.099 30 20 GKED Cc1csc([C@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 755755741 IZGLKPUVYLJERR-QRWLVFNGSA-N 390.512 5.032 30 20 GKED CCCCCCC[S@](=O)[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 764453147 OURXPBRMZNCWOR-SRGMZFCMSA-N 388.455 5.536 30 20 GKED Cc1ccccc1-c1cc(C(=O)OCC(C)(C)CC#N)c2cnn(C(C)C)c2n1 764843487 FRMLYWFIWVQTNT-UHFFFAOYSA-N 390.487 5.084 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc(OCc2ccccc2)c1 766227228 YLGHETDLBQRHGH-NRFANRHFSA-N 399.538 5.466 30 20 GKED C#CCC(C)(C)C(=O)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 767653148 TXVAMEBJJBXCPK-UHFFFAOYSA-N 399.899 5.062 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccncc1 769109741 QMCNVXVMWNSXQE-XMMPIXPASA-N 398.510 5.135 30 20 GKED CC(C)n1c([C@H]2CCCN2Cc2ccc(O[C@@H](C)C#N)cc2)nc2ccccc21 769403199 FPFKYIUOPUFQEI-FDDCHVKYSA-N 388.515 5.245 30 20 GKED CC[C@@H](Nc1ccc(OC)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 774346522 XUHUOJKROFKNSI-OAQYLSRUSA-N 391.515 5.649 30 20 GKED CC(C)C[C@@H]1OCCC[C@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775486643 DBPIQYRPTUYSCQ-ZLNRFVROSA-N 391.515 5.057 30 20 GKED N#C[C@H](C(=O)[C@H](F)Cc1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 778295885 XIJNYPXAPPAITL-ZIAGYGMSSA-N 392.377 5.072 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3ccccc3Cl)o2)C(=O)c2ccccc2C1 778520161 PFKZCUHWMSYKGD-SFQUDFHCSA-N 391.854 5.228 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cc(Br)cs1 782370355 UETXFSDSXJFBNH-UPHRSURJSA-N 382.329 5.592 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCc3c(Br)cccc32)c1 783521901 JVKZLNFYGHAAKN-IERDGZPVSA-N 399.332 5.297 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C(C)C)[C@H](O)c1ccccc1 788682600 SPBYCILCKTVHJY-JTHBVZDNSA-N 380.532 5.418 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(C(F)(F)F)n2)cc1 793044748 RZGZPXMLWPNBHQ-OAHLLOKOSA-N 387.386 5.070 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1cccc(C(F)(F)F)c1 795139189 MNSSKSCJUOLLOY-UHFFFAOYSA-N 396.482 5.258 30 20 GKED C=CC[C@@H](OC(=O)c1csc([C@@H]2CCCO2)n1)c1ccc(Cl)c(Cl)c1 797553069 QRQAVOKMFUBSQG-CVEARBPZSA-N 398.311 5.776 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566453 KGDJRSMVVWRSHB-CHWSQXEVSA-N 376.909 5.046 30 20 GKED COC1(c2noc(-c3ccc(Oc4ccc(C#N)cc4C)cc3)n2)CCCC1 904837013 WXNTUWSBOHDIAL-UHFFFAOYSA-N 375.428 5.125 30 20 GKED C=CCOc1ccccc1C(=O)OCC(=O)Nc1c(C(C)C)cccc1C(C)C 913367621 RGACHBWAVWAIIT-UHFFFAOYSA-N 395.499 5.294 30 20 GKED Cc1cc(C)cc(NN=Cc2cn(Cc3ccccc3)nc2-c2cccnc2)c1 916346659 NECFPIKUVNGGKD-UHFFFAOYSA-N 381.483 5.056 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@H](C#N)c2ccc3ccccc3n2)s1 916849641 WKNXOVXVTHUQDY-OAHLLOKOSA-N 389.505 5.147 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)nc2)COc2c(Cl)cc(Cl)cc21 917146267 XUEOPVVUTMRWPT-MKMNVTDBSA-N 383.234 5.109 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C/C(=O)c2sc(C(C)(C)C)nc2C)c1 918713797 VQOYHWSEGURNCC-MDZDMXLPSA-N 381.501 5.044 30 20 GKED CC(C)(C)OCc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 932536891 KDNDJEGNONEYEI-FQEVSTJZSA-N 379.504 5.558 30 20 GKED O=C(O)c1ccccc1NN=C(CCc1ccccc1Cl)c1ccccc1 1776030177 MOAJQKRLQQWLEG-UHFFFAOYSA-N 378.859 5.487 30 20 GKED CCCCOc1ccccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776803791 RDAOWIBFYKAFLJ-SEYXRHQNSA-N 390.435 5.720 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776819140 NIFSRJODVIHBNL-LFYBBSHMSA-N 376.408 5.330 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)c(C)c1 1776819262 VYBIIZHIJPXMOQ-YFHOEESVSA-N 382.456 5.165 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)s1)=C(/S)Nc1cccc(C)c1 22729169 WYDZSJONVZBRMC-UHFFFAOYSA-O 395.573 5.266 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Cl)ccc2Br)cc1 25440413 YIERMCMUFYQYOF-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CC(C)C(=O)Nc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 46220911 RCQQTZVQOHXGJL-UHFFFAOYSA-N 383.451 5.072 30 20 GKED CCc1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 51899056 PFNRIJOCZRZMBH-CYBMUJFWSA-N 387.917 5.281 30 20 GKED C[C@H](OC(=O)/C=C/c1ccccc1C#N)c1ccccc1NC(=O)c1ccccc1 51942125 FVJAEVQNBRNMAD-ZPICJPFVSA-N 396.446 5.128 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Nc2cccc(OCCCC#N)c2)c(Cl)c1 56199542 MYOMQUZWTATDKT-INIZCTEOSA-N 385.895 5.079 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@H]2C[C@@H]2c2ccccc2)cc1 67583161 ZNZCMDXGDNBYJU-VWNXMTODSA-N 397.478 5.009 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc(Cl)c(OCCC)c(OC)c1 109328943 CUPPXLNDTCGTGN-UHFFFAOYSA-N 387.907 5.008 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N(CCC#N)Cc3ccco3)c2)C1 123576193 HSLMRKUFUPWYRU-NQIIRXRSSA-N 395.503 5.323 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cccc(-c2ccoc2)c1 127855403 ISTLFLCLYNVDPD-NRFANRHFSA-N 380.403 5.061 30 20 GKED CO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 132311464 XOWYLODXUUYHTH-VQIMIIECSA-N 382.872 5.027 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C[C@H](C)C1 161412840 HODDFJCEDGLULT-RBUKOAKNSA-N 391.515 5.232 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(N2CCOC2=O)c1 180220483 OHRFSDDEMOEJHK-GOSISDBHSA-N 397.478 5.033 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(SC(C)C)cc2)ccc1OC 180811225 STFQPXVNLWBAKX-YLJYHZDGSA-N 398.572 5.727 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)[C@H](C#N)c3nc4ccccc4[nH]3)cc2)cc1 182842879 GJRULWUURSCBFE-FQEVSTJZSA-N 395.418 5.048 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(OCc2nccn2C)cc1)c1ccc(F)c(F)c1 186447463 MFXFCWGPNWXCAW-QMHKHESXSA-N 397.469 5.245 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2sc(N(C)C)nc2s1 189882310 VNVCLRIFVHEORI-UHFFFAOYSA-N 385.558 5.528 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1 194889087 HKCRYYYWYFUHCD-JOCHJYFZSA-N 394.421 5.070 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(OCC#N)cc2)ccc1OCc1ccccc1 209556671 FZWPGYUSZIZPKW-QPEQYQDCSA-N 399.446 5.073 30 20 GKED C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 247084420 ZPLMVHKFKAHUAZ-SOLBZPMBSA-N 397.519 5.487 30 20 GKED N#CCN(C(=O)c1oc2ccccc2c1COc1ccccc1)c1ccccc1 302377048 SEZAHJKYJSROME-UHFFFAOYSA-N 382.419 5.182 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)N(C)Cc2cccc(C#N)c2)cc1F 303669428 JGHLHGRSXIRGPF-UHFFFAOYSA-N 376.406 5.084 30 20 GKED C[C@@H](/N=C(/O)N1CCCC12CCCCC2)c1nc2ccccc2n1C(F)F 328890491 RQPURUPEISVZLI-CQSZACIVSA-N 376.451 5.205 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c2[C@H](C)C1 411024526 ZMPVTLLHMQOVLG-WDEREUQCSA-N 375.444 5.065 30 20 GKED CCCc1ccc([C@@H](NC(=O)c2ncc(C#N)cc2Cl)c2cccs2)cc1 427930284 RJUOCZQKBMTSPA-LJQANCHMSA-N 395.915 5.140 30 20 GKED Cc1ccn2cc(-c3ccc(NC(=O)c4cccc(SCC#N)c4)cc3)nc2c1 429929381 GCBANXPIFOAZDW-UHFFFAOYSA-N 398.491 5.178 30 20 GKED N#Cc1ccc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CCC2)c(Cl)c1 430368885 ZJLRCNJVSGNSRX-UHFFFAOYSA-N 378.781 5.291 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cs1 430601710 JPIWIVDZYRSZGM-CQSZACIVSA-N 381.526 5.363 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccnc(Oc3ccc(F)cc3F)c2)n1 434558883 MKTDTYMWGRFWSM-CQSZACIVSA-N 399.422 5.222 30 20 GKED N#Cc1cccc(NC(=O)CS[C@@H](c2ccccc2)c2ccc(F)cc2)c1 437454025 OQYLBNFYHWGROX-QFIPXVFZSA-N 376.456 5.159 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccc(Cl)cc2)cc1C(F)(F)F 438646265 ZOMMMVJIPNGKBM-KRWDZBQOSA-N 393.796 5.599 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 439373138 SUDVYAQXESCVPU-QGZVFWFLSA-N 385.895 5.377 30 20 GKED N#CCC[C@@H](NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F)c1ccccc1 440261657 UTJWCPZFMVZCNN-NHCUHLMSSA-N 383.442 5.246 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)Cc1nnc(-c2cccc(C#N)c2)o1 441276297 JZPQCJCNLMEZPY-IBGZPJMESA-N 394.478 5.372 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C)c2cccc(C#N)c2)nnc1-c1ccncc1 442923539 WBOQTOUFJZFISY-KRWDZBQOSA-N 397.507 5.363 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)cc(C(F)(F)F)c1 445791867 ALUUXZUPMWLTEE-NSHDSACASA-N 382.382 5.491 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)cc1 446374805 PGMULXPJXVHRIX-UHFFFAOYSA-N 399.450 5.051 30 20 GKED CC(C)c1ccc(N(C(=O)CC(C)(C)C#N)c2nc3ccccc3s2)cc1 447183332 RXKUTIIYCRYNJR-UHFFFAOYSA-N 377.513 6.024 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c(Cl)c1 455754922 QXSZJOFLAZIJQW-UHFFFAOYSA-N 392.890 5.299 30 20 GKED C[C@H](CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)c1cccc(F)c1 456588053 ZRBWXFWECXPODT-RIEGTJTDSA-N 385.323 5.051 30 20 GKED Cc1ccc(Br)cc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 461115804 UVNMBVOOSXACPM-AWEZNQCLSA-N 398.087 5.059 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc2c1OCC2)c1nc2cc(Cl)ccc2s1 463072812 WSVXPMBQPKELSE-CYBMUJFWSA-N 389.263 5.028 30 20 GKED CN(C(=O)Nc1ccc(F)cc1C(F)(F)F)[C@H]1CCCC[C@H]1C(F)(F)F 463733549 DMRKJRLSKIOFEO-MFKMUULPSA-N 386.311 5.429 30 20 GKED C[C@@H](C#N)N[C@H](Cc1c(F)cccc1Cl)c1ccccc1Br 463910770 NQHPLSICUDXSQN-APPDUMDISA-N 381.676 5.027 30 20 GKED N#CCSCCCSc1nc2cc(Cl)ccc2n1Cc1ccccc1 466604600 QAYPAAZJMIJTER-UHFFFAOYSA-N 387.961 5.477 30 20 GKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 467708937 NHFZWPUSSJDBKI-JXFKEZNVSA-N 377.488 5.098 30 20 GKED C=C[C@](C)(CC)C(=O)Nc1cc(CNC(=O)[C@@](C)(C=C)CC)ccc1Cl 467972425 ZUBPXDUNBSLBQW-LEWJYISDSA-N 376.928 5.099 30 20 GKED CC(C)Sc1ccccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 472549687 SPJROAZXNGMSHG-UHFFFAOYSA-N 392.480 5.483 30 20 GKED CCN(C(=O)c1ccc(OCc2ccccc2C#N)cc1)c1ccc2[nH]ccc2c1 472983003 ZOZLVQAUSFHMCT-UHFFFAOYSA-N 395.462 5.285 30 20 GKED CC(C)N(Cc1ccc(Br)cc1)C(=O)C[C@H](CC#N)c1ccccc1 475122433 WHLAHAQCAJJKSH-IBGZPJMESA-N 399.332 5.274 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(COCc3ccccc3)cc2)cc1 476168169 WLHVJAWCTPYYFY-UHFFFAOYSA-N 384.479 5.457 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)F 476171695 ZYIMDGQGVXHWON-RBUKOAKNSA-N 385.454 5.882 30 20 GKED CC[C@@H]1CCc2ccccc2N1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 482836361 MVJVXOOPXUXKMS-HXUWFJFHSA-N 383.451 5.117 30 20 GKED CC(C)(C)[C@H]1C[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 483000272 ZTCSUDRLBYRWDP-GHTZIAJQSA-N 393.487 5.066 30 20 GKED N#CC[C@H](CC(=O)N1CCSc2ccc(C(F)(F)F)cc21)c1ccccc1 483835731 CYWQGNMXEWHDJQ-OAHLLOKOSA-N 390.430 5.232 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(F)c(Br)cc1F 486439290 SGAOVMQPQLQHIB-UHFFFAOYSA-N 384.245 5.258 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc2ncsc2c1 486535244 RKCXGLUQFPMSMR-SNVBAGLBSA-N 390.390 5.069 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1C)c1ccccc1 488629358 MKPNOFTXFWZSQP-QFIPXVFZSA-N 390.527 5.356 30 20 GKED C=CC[C@@H](C(=O)Nc1nc(-c2c[nH]c3ncccc23)c(C)s1)c1ccccc1 489667603 ODIRYJWJGDECOL-MRXNPFEDSA-N 388.496 5.293 30 20 GKED Cc1ccnc2sc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c(C)c12 489861181 YHNDBKGGBYYJFA-OAHLLOKOSA-N 389.505 5.527 30 20 GKED N#CC1(CCCN[C@@H](c2cccc3ccccc23)C(F)(F)F)CCOCC1 499617100 CYCJHZNFCIBPBP-IBGZPJMESA-N 376.422 5.133 30 20 GKED Cc1cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cn2ccnc12 502769093 XBKZPHWJVSFUOY-UHFFFAOYSA-N 398.491 5.059 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)Nc1ccccc1SC[C@H](C)C#N 503218553 PAPWEMKVAKZUBL-GFCCVEGCSA-N 389.908 5.553 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cccc(OC)c1)C[C@@H]1CCCO1 505030026 RQQCYTATKFOXJY-QFIPXVFZSA-N 394.515 5.027 30 20 GKED N#C[C@@H](NC(=O)CCCc1c[nH]c2ccccc12)c1c(Cl)cccc1Cl 505540700 QYDVKTNACOAPDF-GOSISDBHSA-N 386.282 5.178 30 20 GKED C=C(C)[C@@H](NC(=O)C[C@@H](c1cccs1)n1cccc1)c1ccc(F)c(F)c1 505965482 VDNPEIANROGUOD-GHTZIAJQSA-N 386.467 5.241 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)CC1 506578408 OBPJVUUPIIZDLM-UHFFFAOYSA-N 383.879 5.077 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 507765700 GBGPXPOMYROEHT-LJQANCHMSA-N 383.879 5.368 30 20 GKED CCN(C(=O)c1cc2c(s1)-c1ccccc1OC2)[C@@H](C)c1ccc(C#N)cc1 509580976 VSHLVKXWRCLXGV-HNNXBMFYSA-N 388.492 5.402 30 20 GKED CCc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cnn1C(C)(C)C 509670837 AGTCYWQJWWPCBM-UHFFFAOYSA-N 388.471 5.117 30 20 GKED C=CCN(Cc1cccs1)[C@H](C)C(=O)c1cc(C)n(Cc2ccco2)c1C 510830228 YHWKNVXORVZKSK-GOSISDBHSA-N 382.529 5.067 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)c(F)c1 511708191 QMUPNQTYCBRRTA-GOSISDBHSA-N 390.311 5.023 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1ccc(C#N)cc1 518042329 HTMYIERFWYCBML-LBPRGKRZSA-N 381.888 5.135 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1 518463310 XZPXAPSRPSFEQD-JOCHJYFZSA-N 389.886 5.512 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 519888981 PZYGUZMZCMMVLN-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519996651 UZLAZXHPTAXHSN-IBGZPJMESA-N 399.494 5.118 30 20 GKED N#C[C@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1ccc(Cl)c(Cl)c1 521017289 KFEMGJSPQVGXQI-FQEVSTJZSA-N 398.293 5.302 30 20 GKED CC[C@@H](C)[C@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 521111808 MYBNUAKQRFJXGJ-GGOOSFECSA-N 390.527 5.194 30 20 GKED C=C(C)[C@H](CC(=O)N(CC)[C@@H](c1ccc(Cl)cc1)c1cccnc1)OCC 533710408 NWCBBKISBLZSKR-UNMCSNQZSA-N 386.923 5.044 30 20 GKED Cc1cccc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1Br 534560758 HYIJFDNNFSCFOI-AWEZNQCLSA-N 398.087 5.059 30 20 GKED Cc1noc2nc(C(C)C)cc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)c12 538071893 JSCFJKFJZXWODU-UHFFFAOYSA-N 382.489 5.138 30 20 GKED CSc1ccsc1C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541073505 XEFYXUWUYGSDCI-AWEZNQCLSA-N 378.522 5.500 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)nc4ccccc34)n2)cc1 546155795 XIRHESMMJSESNL-LJQANCHMSA-N 383.476 5.465 30 20 GKED C=C(C)[C@@H](NC(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(F)c(F)c1 554961258 GGTTZDGKRCLNKY-QVKFZJNVSA-N 385.454 5.341 30 20 GKED CCc1nc2c(s1)[C@@H](N(C)Cc1ccc(C#N)cc1C(F)(F)F)CCC2 555092276 NHKLQRRUCUIGSB-INIZCTEOSA-N 379.451 5.105 30 20 GKED N#CCCC[C@@H](NCc1cc(Br)cc(F)c1F)c1ccccc1 563214550 BIGUFDIUMYQFCL-QGZVFWFLSA-N 379.248 5.252 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)Nc2cccc(C#N)c2C)cs1 569983091 XWMTZMWCRUHMPF-UHFFFAOYSA-N 393.487 5.354 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1 572417474 SKOHNKRINLWYDE-HXOBKFHXSA-N 390.531 5.160 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CCC3(CC2)CC3(F)F)cc1 593219518 ITXSXDBIIKYJQN-UHFFFAOYSA-N 399.466 5.363 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(C2(C#N)CC2)cc1 594919239 GKRQPYKFAMXPAK-HNNXBMFYSA-N 391.515 5.664 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 596696524 KDTOLEOSTUBLLO-MRXNPFEDSA-N 394.862 5.162 30 20 GKED Cc1nc(SCC(=O)Nc2ccccc2-c2cccs2)c(C#N)c(C)c1C 601704366 JPWVPSYSYZJIBU-UHFFFAOYSA-N 393.537 5.338 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cscc1Br)c1ccccc1 603013339 AINJZDMABATRMO-CQSZACIVSA-N 378.295 5.067 30 20 GKED Cc1ccccc1CN(C)C(=O)c1ccccc1SCc1ccc(C#N)cc1 603470193 XPKVJCYBDUIGIZ-UHFFFAOYSA-N 386.520 5.431 30 20 GKED N#Cc1c(NC(=O)c2ccnc3ccccc23)sc2c1-c1ccccc1CC2 603992306 PZVGWAPBLXVNOT-UHFFFAOYSA-N 381.460 5.186 30 20 GKED Cc1ccc(CCC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 604003648 JWTUBPYVVTUCPI-UHFFFAOYSA-N 384.479 5.211 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCCOc1ccc2ccccc2c1 604007682 PVGGZRIKBYORLH-UHFFFAOYSA-N 381.435 5.390 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCCC2)cc1)c1nc2ccccc2s1 605257627 WDEYZBWCWPGYCC-GOSISDBHSA-N 376.481 5.498 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 609432428 NRBYLWWEGXFEMC-KRWDZBQOSA-N 385.467 5.352 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccc(F)c(Cl)c2)c1 609433293 SHRFHSPMPBEUNT-UHFFFAOYSA-N 380.850 5.220 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C(F)(F)F)cc1Cl 609555669 AQPSNEJSYCKMPO-UHFFFAOYSA-N 393.796 5.451 30 20 GKED CCCn1c(S[C@@H](C)c2ccc(C#N)cc2)nnc1-c1ccc(Cl)cc1 609813539 KPSDQUYYIORVBD-AWEZNQCLSA-N 382.920 5.733 30 20 GKED C[C@@H](SCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccc(C#N)cc1 609825839 XDLUBOLCOXBAHS-CYBMUJFWSA-N 380.494 5.405 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)Cc1sc(C)nc1-c1cccs1 610726152 LVXXRENJLYWOLE-UHFFFAOYSA-N 396.541 5.055 30 20 GKED C[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)c1cccc(C#N)c1 611038893 CHXWZIKLDLYWJG-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccccc2)c2ccc(F)cc2)cc1OC 620514373 VDEQYSGRDKMBAC-XMMPIXPASA-N 377.459 5.278 30 20 GKED Cc1nccnc1[C@H](C)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647323538 WRDLXJYQUCUDPY-JTQLQIEISA-N 381.295 5.248 30 20 GKED O=C(Nc1c(F)cccc1Cl)NC(CCC(F)(F)F)CCC(F)(F)F 666637386 OYQNEMFLESOWID-UHFFFAOYSA-N 394.718 5.654 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C)ccc1C(F)(F)F 667937423 IGRFBSHTEYJPQB-UHFFFAOYSA-N 394.441 5.401 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 674461358 XKWGXNBZQCTPEO-GGZOMVNGSA-N 377.275 5.022 30 20 GKED COCCOc1cccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)c1 727268020 YSNGMDFYSQLYQN-IZZDOVSWSA-N 397.471 5.179 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)C[C@@H](c1ccccc1)C(C)C 728766666 FLAXDBWTOODIMQ-YADHBBJMSA-N 390.527 5.289 30 20 GKED Cc1ccccc1C(=O)/C=C/c1ccc(OCc2cc(C)c(C(=O)O)o2)cc1 729937057 LCCJAZUHCJWYBR-FMIVXFBMSA-N 376.408 5.070 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731972769 NPXCAGXNGIBDCX-DHIUTWEWSA-N 386.520 5.851 30 20 GKED O=C1/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)Cc2c(Cl)cccc21 733083809 QVTBLXHDCGXTIA-GHXNOFRVSA-N 382.828 5.194 30 20 GKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 733208651 AOIUNCIYFPZJFM-SFHVURJKSA-N 392.355 5.891 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)Nc1ccccc1Cl)C12CC3CC(CC(C3)C1)C2 733678704 GNPUFBZUBPJTIL-XUKDNJQASA-N 396.918 5.150 30 20 GKED CCSc1ccccc1OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 734790911 KXLSQXDBWFLZER-UHFFFAOYSA-N 376.437 5.077 30 20 GKED Cc1c(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)n[nH]c1C1CC1 735044307 NPIDUZYXKSOZJA-UHFFFAOYSA-N 392.846 5.165 30 20 GKED COc1ccc(C(C)=NNc2nc3cc(C(F)(F)F)ccc3s2)cc1OC 743445041 AVILJBAZHPDWEC-UHFFFAOYSA-N 395.406 5.168 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@]34CCCc3ccccc34)n2)cc1 744031565 MVZCMHCDDVSTBA-FZOAFFARSA-N 398.531 5.589 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)[nH]c12 744162366 ZZRJMGQMNOEWMX-BZUAXINKSA-N 384.266 5.158 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COc2ccccc2Cc2ccccc2)n1 747193303 HUXSWKUJNMTAGY-LJQANCHMSA-N 390.508 5.113 30 20 GKED CC(C)[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 747930112 YAADZTKZIMZGEF-FOIQADDNSA-N 376.422 5.483 30 20 GKED O=C(Nc1cccc(/C=C\C(=O)c2cccc(F)c2F)c1)c1ccccc1Cl 776268022 JOILYMLWVWUBDN-QXMHVHEDSA-N 397.808 5.767 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 785677348 KPHGNDOKYTYNIY-RPWUZVMVSA-N 392.462 5.023 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)(F)Cl)cc1)c1nc2cc(F)ccc2s1 786403402 XMJQDZHGJMQUSL-LBPRGKRZSA-N 396.777 5.093 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(OC(F)F)c(Br)c2)cnn1C(C)C 787186721 GEYFIWGTLQVPBI-GQCTYLIASA-N 399.235 5.032 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(OC(=O)C[C@H](CC#N)c2ccccc2)c1 796734430 UMZRABYGOWSHAL-KRWDZBQOSA-N 380.444 5.027 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC[C@H](C(F)(F)F)C1)c1nc(-c2ccc(Cl)cc2)cs1 796799388 TXMFGZNPWDFOBE-MBNYWOFBSA-N 398.837 5.618 30 20 GKED FC(F)(F)c1ccc([C@@H]2CCC(=NNc3ccc(C(F)(F)F)nn3)C2)cc1 799483085 TWOFNCZZHFWITK-LLVKDONJSA-N 388.315 5.250 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2Br)cc1)c1ccnc(O)c1 806556587 WKVRJETUILHRNA-YFHOEESVSA-N 380.241 5.113 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813216843 GDQPTCRDKPFRAC-MSKHEQNASA-N 398.306 5.399 30 20 GKED N#CCOc1ccc(CN[C@@H](CCCc2ccccc2)c2ccc(F)cc2)cc1 813860329 PXBDMMDQJMKRGO-VWLOTQADSA-N 388.486 5.582 30 20 GKED CC(C)(C)OC(=O)N1CCC[C@@H](CCN[C@@H](CCCC#N)c2ccccc2)C1 814661110 VPUIFPFNSXXLQI-FPOVZHCZSA-N 385.552 5.048 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)/C=C/c3nc4ccccc4s3)c2C#N)C1 877880244 HKIXJBDFSRYRIX-BCPZQOPPSA-N 379.510 5.006 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N(Cc1ccco1)C12CC3CC(CC(C3)C1)C2 914478386 KVLMNBUZFJYQGE-FPLPWBNLSA-N 386.495 5.162 30 20 GKED C[C@@H]1CCCC[C@@H]1OCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915359107 MUUYEQGFDQBHGV-LEOXJPRUSA-N 391.515 5.059 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Oc3cccc(Cl)c3)n2)cc1 916972342 NGKNJGDTECOCPJ-RDTXWAMCSA-N 396.899 5.416 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(Cl)s3)n2)cc1 916974138 DWTNQGAZJJRRMD-HNNXBMFYSA-N 386.929 5.643 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916997294 UZUXOACOFBGPLG-FSNWXROXSA-N 399.302 6.007 30 20 GKED COc1ccc(Oc2ccc(C=NNc3ccc(Cl)c(C(=O)O)c3)cc2)cc1 1776033595 FGCOXMAXHNPPSF-UHFFFAOYSA-N 396.830 5.285 30 20 GKED O=C(O)c1cc(NN=Cc2c[nH]c3cc(Cl)cc(Cl)c23)ccc1Cl 1776033703 UVTQCGKIVBNZQU-UHFFFAOYSA-N 382.634 5.272 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NOC1CCCCC1 1776056562 ZNLLYJXMPSKNID-UHFFFAOYSA-N 395.499 5.622 30 20 GKED CC(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776370479 NBTUPSKFQZNECV-BENRWUELSA-N 376.477 6.133 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)cc1)c1ccccc1 1776469405 JMGTXIVGKWBLNA-MUMAZLPKSA-N 386.447 5.350 30 20 GKED CCOc1cc(F)cc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776920209 VLFZWLZRLVWTAP-BAQGIRSFSA-N 380.371 5.079 30 20 GKED CCc1ccc(-c2ccc(/C=C/C(=O)c3cccc(O[C@@H](C)C(=O)O)c3)o2)cc1 1776964246 YMRKTDAEVCTXFS-BYIUCRAPSA-N 390.435 5.257 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)ccc1SC(F)F 1777263615 ZLDBVIBLWDPZGX-GQCTYLIASA-N 398.814 5.258 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3ccc(C)cc3o2)c2cc(C(=O)O)oc12 1777360859 XYKJXBJMZCLISE-FNORWQNLSA-N 376.364 5.090 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(CN2CCCCCC2)cc1 60566752 ITEUEOPHJCKAIO-UHFFFAOYSA-N 397.588 5.022 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cccc(OCc2cccc(Cl)c2)c1 64455365 YNLRQGKHRIPINA-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CCCN(C(=O)[C@@H](C)Oc1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 64820207 CQEIHEKVNFDERL-IAGOWNOFSA-N 376.456 5.072 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1nnc(-c2ccccc2)o1 97543278 JCPYBSGVAAZVRV-QGZVFWFLSA-N 396.450 5.360 30 20 GKED N#Cc1cc(NCC(=O)Nc2ccccc2Oc2ccccc2)ccc1Cl 105385455 GMPOWCHLSPXOGB-UHFFFAOYSA-N 377.831 5.055 30 20 GKED N#C[C@H](C(=O)Cc1ccccc1C(F)(F)F)c1nc(-c2ccccc2)cs1 105759005 VSXCWIAZIOJKMW-OAHLLOKOSA-N 386.398 5.248 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 108238393 KZXBSXIYKCDXBJ-LBPRGKRZSA-N 389.318 5.262 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)c1 131931598 KFSMGBLGBLDBIV-OAQYLSRUSA-N 393.446 5.052 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)s1 173992952 NVIAYCQVSHMDEK-SCOAYWHSSA-N 393.537 5.454 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 174001656 LGYAUKTWGSSFCR-UKRRQHHQSA-N 385.389 5.016 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(SCC#N)c1 175690800 FLYRTRFVYSPEQZ-UHFFFAOYSA-N 399.475 5.527 30 20 GKED CCN(C(=O)c1cc(Oc2ccccc2)ccn1)c1ccc(C#N)c(Cl)c1 179520668 BFGPEYFAHGOOPX-UHFFFAOYSA-N 377.831 5.066 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cc(F)c(F)c(F)c1 182338782 OUWVLFBVVPYGBV-GFCCVEGCSA-N 393.434 5.020 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1nc(-c2ccccc2)cs1 184538695 NJQKVQOECXGXNS-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 195629369 ZOVHVEOGEMQBCM-DLBZAZTESA-N 388.389 5.106 30 20 GKED CCOc1ccc([C@@H](NCc2ccc(N(C)CCC#N)cc2)c2ccccc2)cc1 237113243 VSSFHYCNDDVJKV-SANMLTNESA-N 399.538 5.314 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 247435501 XCTQTJPUUBANGN-IPMKNSEASA-N 393.556 5.799 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc([S@](C)=O)cc1 276396815 JRRJAWIQECUUOY-OQRWROFFSA-N 384.545 5.159 30 20 GKED N#Cc1cc([N+](=O)[O-])ccc1Oc1ccc2c(=O)c(-c3ccccc3)coc2c1 301062041 CERVROLSMBUUJH-UHFFFAOYSA-N 384.347 5.032 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1ccccc1F 303191991 ZKURLGWUEHHCPY-HNNXBMFYSA-N 396.487 5.486 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 303487713 KFYVOKHPYWKNQO-UNMCSNQZSA-N 396.918 5.672 30 20 GKED CC[C@@H](CNC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)CC(F)(F)F 413417608 KWAHARJSKLRYLZ-ZWNOBZJWSA-N 388.327 5.097 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1cccc(F)c1C#N 428321954 GAIGRXVDUGMSFD-GFCCVEGCSA-N 385.895 5.634 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)c1cccc(SCC#N)c1 430692743 VJBIFOPWWMGWLY-UHFFFAOYSA-N 376.934 5.708 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F 431404377 GIACXQJWXQUUTH-SFHVURJKSA-N 386.446 5.152 30 20 GKED Cc1cc(C)c(CN[C@H](CCCC#N)c2ccccc2)c(OCc2ccccc2)n1 433026704 HGNWZNNELXMMJO-RUZDIDTESA-N 399.538 5.802 30 20 GKED N#Cc1ccnc(NC(=O)c2cc(F)ccc2Sc2ccc(Cl)cc2)c1 436004382 CUKGOASFAPEAMH-UHFFFAOYSA-N 383.835 5.149 30 20 GKED CCN(Cc1ccccn1)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 437939575 ZHOXGDIUMGFIAR-UHFFFAOYSA-N 391.858 5.061 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2)cs1 440490133 UNMHRZVEOXVOTA-AWEZNQCLSA-N 393.537 5.765 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 441536929 YTCXUCMUHYGXNS-KXBFYZLASA-N 391.437 5.510 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H]1CCOC2(CCC2)C1)c1ccc(C(F)(F)F)cc1 441537591 XNYQMHNLKSHDBP-MSOLQXFVSA-N 396.453 5.114 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458808294 YWHXVTXNZQOFER-SFTDATJTSA-N 393.535 5.088 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)cc1 458836820 KYIVIAUUXRBHPM-DHIUTWEWSA-N 375.516 5.183 30 20 GKED C=C(C)Cn1c(COc2cccc(C)c2)nnc1N1CCC[C@H]1c1ccsc1 460372259 DSFOFIIWOSOEAQ-FQEVSTJZSA-N 394.544 5.145 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(CN(C(=O)[C@@H](C)CC(=C)C)C2CC2)cc1 467724870 UPMBDVWWELEMPK-OALUTQOASA-N 382.548 5.321 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(F)ccc1F 469145925 UDTRYWFSRBJZSS-HXUWFJFHSA-N 383.442 5.111 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@H](CO)C(C)C 475570358 CBIHTZVSBRMYJJ-HSZRJFAPSA-N 394.559 5.590 30 20 GKED N#CCCn1cc(CN[C@H]2CC[C@@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 475575272 ZOCUHTSZTLCMIW-OFNKIYASSA-N 388.490 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(NC(=O)C(C)(C)C)ccc1F 476118076 ANKJRQISZCXFIU-UHFFFAOYSA-N 396.506 5.915 30 20 GKED COc1cc(C)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1F 478039352 HCILAIYEVWICPB-UHFFFAOYSA-N 390.414 5.253 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C2CCC2)cc1 478687988 BOJQOKJJTHCEBS-UHFFFAOYSA-N 383.451 5.574 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(Cc2cccc(F)c2)CCC1 480538797 JAZTUKUBMQCRBW-MRXNPFEDSA-N 397.519 5.364 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1ccc(C#N)c(F)c1 483699860 JBZAGUCIAUWESY-GFCCVEGCSA-N 385.895 5.634 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 484157833 CPDVVSDQQZTQSF-AWEZNQCLSA-N 394.862 5.304 30 20 GKED Cc1csc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c1Br 489752119 NHIKDDUYQCQYMB-AWEZNQCLSA-N 391.334 5.111 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2CCSCC2)cc1Cl 502314386 CZUSNEZNHCEBLM-LJQANCHMSA-N 399.947 5.260 30 20 GKED N#Cc1cn(Cc2sc3ccccc3c2Cl)c2ccc(Cl)cc2c1=O 502851894 WCHLEYDYQNYKHO-UHFFFAOYSA-N 385.275 5.443 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503873066 MEAOUBMPVJWULC-MRXNPFEDSA-N 398.428 5.072 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N(C)Cc3ccc(C#N)cc3)oc2c1 508301333 UMKADNYDGNYHRA-UHFFFAOYSA-N 396.446 5.252 30 20 GKED CCN(C(=O)c1csc(-c2ccc(Cl)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 509557030 DKBVPVSLSXPSEW-AWEZNQCLSA-N 395.915 5.558 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@H](C)c1cc2ccccc2o1 510694433 XUIHGUMBEIIRLC-MRXNPFEDSA-N 391.471 5.707 30 20 GKED C[C@H](CC#N)NC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 512023684 JUOIHJKNVOMUAW-GFCCVEGCSA-N 379.312 5.318 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ccc(OC(F)F)cc1F 512468180 KHLSYZSCNBLWHS-UHFFFAOYSA-N 398.340 5.343 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)o2)cc1 513187309 XYKIVRWJADUABE-INIZCTEOSA-N 398.340 5.053 30 20 GKED CC(C)CN(C(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc(C#N)cc1 514535516 NVGFWMAJKJKEAR-UHFFFAOYSA-N 392.430 5.172 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 519888500 AFTIXCNDBJOSQQ-KGLIPLIRSA-N 375.394 5.041 30 20 GKED C=CC1CCN(C(=O)c2cc3c(C)nn(-c4ccc(Cl)cc4)c3s2)CC1 520326833 OXEIYFSUQSFUDU-UHFFFAOYSA-N 385.920 5.087 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1oc2ccc(OC)cc2c1C 521246154 PLNLKWADXOXVJQ-KRWDZBQOSA-N 378.472 5.209 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1)c1ccc(C#N)cc1 521768471 RLRIRJQPRLYLEU-QZTJIDSGSA-N 389.524 5.654 30 20 GKED Cc1ccc(C(=O)N[C@H](C)c2ccc(C#N)cc2)cc1NC(=O)Nc1ccccc1 525471946 PPPOZDYFIQMOLT-QGZVFWFLSA-N 398.466 5.002 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)Nc2cccc(SC)c2C)cc1 538206674 QXWVYABGYWOBHC-UHFFFAOYSA-N 395.528 5.175 30 20 GKED COc1cc([C@H](C)NCc2cccc(C#N)c2F)ccc1OCc1ccccc1 540353823 FAPYOKKFXMGKGN-KRWDZBQOSA-N 390.458 5.136 30 20 GKED CC[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(F)cc(Br)c1 540607112 OCJKCQFIJNQXRO-RTBURBONSA-N 375.285 5.674 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)NCCCC#N)c2)cc1 541518771 AOTBNRCTYJGIGZ-SFHVURJKSA-N 379.504 5.147 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 543821544 YXEZFPLJRHJRBU-OAQYLSRUSA-N 381.545 5.296 30 20 GKED COc1ccc(-c2nc(CSCc3ccc(CC#N)cc3)cs2)c(OC)c1 544083741 YQVLNJVBTMOSIO-UHFFFAOYSA-N 396.537 5.327 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cc(F)cc(F)c3)no2)c2ccccc21 546288632 LRBHFXGUXWQKEZ-VOTSOKGWSA-N 376.366 5.054 30 20 GKED COc1cc(CN[C@H](c2ccccc2)c2ccc(OC(F)F)cc2)ccc1C#N 554998794 VCKHKSZULXEMIG-JOCHJYFZSA-N 394.421 5.047 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Cl)cc2OCc2ccccc2)CC1 562924723 NXBSBHPBUAGQMY-UHFFFAOYSA-N 383.879 5.077 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(C2CCCCC2)no1 564623577 RSUIHTAKJYCNGU-WMAFBANVSA-N 378.520 5.172 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)c2c1 565381277 WRAQYSKFPYMWJY-KRWDZBQOSA-N 387.464 5.565 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(F)c2)C1 577699560 ZUMPPHOUZBGTPQ-ZVZYQTTQSA-N 383.492 5.288 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(C(F)F)c1 591009080 NPFAEMLIBKSSLL-GHMZBOCLSA-N 389.286 5.264 30 20 GKED N#Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c(F)c1 602758231 LHEXWQOLWUDUPC-FQEVSTJZSA-N 395.796 5.261 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc(C4CC4)nc4ccccc34)c2C#N)C1 603834508 JLXHENILTSMTMM-ZDUSSCGKSA-N 387.508 5.422 30 20 GKED CCC(C)(C)NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604046413 GJAMAFDCUMDWTD-CQSZACIVSA-N 385.895 5.109 30 20 GKED CO[C@@H](C)c1cccc(N[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 608889107 IIBLLPDJAJEOKJ-GJZGRUSLSA-N 397.544 5.035 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)n1cccc1 609201104 WUKJRZPNUUDQAW-HNNXBMFYSA-N 379.847 5.395 30 20 GKED CCn1c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)nc2ccccc21 609497790 JORPFSHQDPUGBZ-UHFFFAOYSA-N 396.450 5.167 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@H]1CCC[C@H](C)C1 609575678 MSSLKQPKWXHXLX-JTSKRJEESA-N 394.490 5.134 30 20 GKED N#CCCCOc1cccc(NCC2=Cc3cc(Br)ccc3OC2)c1 609634127 IJEWAJDIRDJQQP-UHFFFAOYSA-N 399.288 5.020 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 610196272 WSDSMRWAXWOLKK-ZDUSSCGKSA-N 393.339 5.517 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)c(F)c1 610812749 NRJZFPONTXEHKL-SFHVURJKSA-N 397.906 5.641 30 20 GKED C[C@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1cccc(C#N)c1 610829695 FJFLSOAGIMJURP-IFXJQAMLSA-N 377.488 5.549 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 614439914 XQYVMUIXBHUIPF-OAHLLOKOSA-N 388.448 5.445 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 615081465 JAYXJUFYSDWNTJ-RBUKOAKNSA-N 389.417 5.032 30 20 GKED Cn1cc(CN(Cc2ccc(Cl)cc2)Cc2ccc(C(C)(C)C#N)cc2)cn1 619532153 BCALJPFAMGXILE-UHFFFAOYSA-N 392.934 5.077 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622853801 OBSRPJVZMQXSSE-VIFPVBQESA-N 377.275 5.192 30 20 GKED O=C(NCC1CCC(F)(F)CC1)NC(CCC(F)(F)F)CCC(F)(F)F 661129015 MXEHSQYCODMHRN-UHFFFAOYSA-N 398.338 5.165 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(-c3ccco3)nc3ccccc23)cc1 726941703 ISNJMKCAWQRDQU-UHFFFAOYSA-N 381.435 5.364 30 20 GKED C=CC[C@@H](NC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1ccncc1 734684832 WTTBDBRCQCEHOA-BJKOFHAPSA-N 383.495 5.056 30 20 GKED CCOc1ccc(O)c(C=Nc2cccc(C[S@](=O)C3CCCCC3)c2)c1 734978993 HCRNLBFUTBKUHS-MHZLTWQESA-N 385.529 5.123 30 20 GKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)C(=O)Nc1ccccc1Cl 735320577 YPICESVIFMUUEM-GFCCVEGCSA-N 395.311 5.156 30 20 GKED COc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)c(Cl)c1OC 740013266 BPWFDGMFURXFBD-UHFFFAOYSA-N 398.915 5.247 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(O[C@@H](C)C#N)cc2)cc1 741470554 RPKAMECBVAOJCN-VUZIPCMWSA-N 383.447 5.549 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc3c(c2)COC3)cc(C)c1OCc1ccccn1 742435247 RVRAJVPHQXHUOL-RMKNXTFCSA-N 385.463 5.204 30 20 GKED C[C@@]1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCc2ccccc2C1 744034516 ACWPXDZZNZJNKJ-HRAATJIYSA-N 380.900 5.321 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 744462907 SACGSXZWAVDEFA-DVECYGJZSA-N 384.479 5.386 30 20 GKED C[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccncc2)cc1 746395845 NXNKALRUZGEQPV-CQSZACIVSA-N 392.915 5.321 30 20 GKED Cc1ccc(/C=C/C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(Br)c1 747198507 XZCPCZXGVGEFPR-UZYOAWRESA-N 389.318 5.227 30 20 GKED N#C[C@@H](NC(=O)c1cc2cccc(Cl)c2o1)c1cccc(C(F)(F)F)c1 753298893 LDOUOMGMQKDHGS-CQSZACIVSA-N 378.737 5.100 30 20 GKED C=CCCC(=O)CSc1nnc(Nc2ccc(SC(F)F)cc2)s1 762474211 BYURQNBEUJNBSJ-UHFFFAOYSA-N 387.502 5.224 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(C3CCCCC3)nc2C)cc1 775228410 UNONSIOYFRITIK-GOSISDBHSA-N 395.528 5.023 30 20 GKED N#CCC1(COC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)CC1 779214476 YLUUADDLLQMKDS-UHFFFAOYSA-N 377.227 5.031 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)OCCCC3(C#N)CCOCC3)cs2)cc1 800107880 VKVOSFGHHFYIIU-UHFFFAOYSA-N 398.528 5.191 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)nc2)nnc1N1CCC(c2ccsc2)CC1 802577518 CQKOLJZDBLOKNY-UHFFFAOYSA-N 399.951 5.015 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 810823444 DEZUGABMZOCYRQ-UHFFFAOYSA-N 399.237 5.008 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cn(C)nc1C(F)F 812241936 OWBWYGDFLXWAMV-VMPITWQZSA-N 393.846 5.339 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCC2)c(F)c1 815635864 KJTDUTAMCVWWHQ-CVDCTZTESA-N 379.523 5.902 30 20 GKED CC(C)Oc1ccccc1C=NOCC(=O)Nc1c(C(C)C)cccc1C(C)C 852286966 QDNIEHNPMCRXQO-UHFFFAOYSA-N 396.531 5.710 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)nc1Cl 862380085 QJJBERSQRKMYDI-CYBMUJFWSA-N 397.828 5.287 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1sc(CC(F)(F)F)nc1C 890165289 CQOHWTWGTIBBHE-UHFFFAOYSA-N 396.478 5.589 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)/C=C/c1ccccc1C#N)C1CC1 914482165 LZRADYNXIYKFIY-RZXPCSSPSA-N 384.401 5.342 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(Cl)s2)cc1 915350180 KQWQMLFRWSOWNM-GOSISDBHSA-N 381.888 5.379 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@H](C#N)c1nc2ccccc2s1 916847291 BVCWPZWYUACERN-PBHICJAKSA-N 378.497 5.238 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)[C@H](C#N)C(=O)Nc1ccccc1 916900854 XXQKUNQSXBTVIL-JWHUVLAVSA-N 386.451 5.136 30 20 GKED CCOc1ccccc1NC(=O)[C@H](C#N)C(=O)c1ccc(C2CCCCC2)cc1 916923798 SXGGYGJOWJZUBS-HXUWFJFHSA-N 390.483 5.094 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(-c2ccc(C)o2)nc2ccccc12 920017369 NZOLCLHFFDQIPB-UHFFFAOYSA-N 397.434 5.326 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(OC)cn1 931060927 YWHRIBPHTYQORQ-OAQYLSRUSA-N 379.504 5.311 30 20 GKED CC(=NNc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(-c2ccc(C(=O)O)o2)cc1 1776035705 ZWIZTTIMADBCNL-UHFFFAOYSA-N 399.790 5.043 30 20 GKED O=C(O)c1ccc(Br)c(/C=C/C(=O)c2cccc3ccccc23)c1 1776114078 FHDFTHRFZICSBC-PKNBQFBNSA-N 381.225 5.197 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2ccc(C(=O)O)cc2O)cc1 1776785592 QAFAZUANIRXWCC-XNTDXEJSSA-N 396.483 5.726 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@@H](CC(=O)O)C2(C)C)cc1 1776787497 DZLDZOZDENHEKR-SFHVURJKSA-N 391.577 5.465 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776806052 YFHFYEPEZNCSGD-RAXLEYEMSA-N 390.435 5.589 30 20 GKED Cc1c(/C=C2\COc3ccc(C(C)C)cc3C2=O)nc2ccccc2c1C(=O)O 1777414151 DZDKEFJTQHEXDE-LFIBNONCSA-N 387.435 5.024 30 20 GKED CCCCCCCCOc1c(F)cc(Br)cc1Br 1975564355 WAUQOSPMNXNHLY-UHFFFAOYSA-N 382.111 6.090 30 20 GKED Cc1ccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2S[C@@H](C)C#N)cc1 6841263 JQKFEGYITFLGMZ-RSZPVBOMSA-N 389.524 5.507 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1ccc(Cl)cc1 10831833 WUVXTCIZHZNXBW-UHFFFAOYSA-O 395.935 5.241 30 20 GKED Cc1nc(CSc2ccc(C(=O)OCc3cc(C#N)ccc3F)cc2)cs1 23514136 LEYNFHQJBSUWGZ-UHFFFAOYSA-N 398.484 5.112 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)cc1 28670199 FDYNAALDLHUSOX-UHFFFAOYSA-N 375.478 5.343 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(C)cc2)[n+]2cccc(C)c2)cc1 41466190 MUWSOJMJIWKDQD-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccccc2)cc1)c1ccc(C(F)(F)F)cn1 41553657 PXVXUOFDTSQXTJ-IBGZPJMESA-N 396.368 5.169 30 20 GKED CCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1OC 46706795 QROYGANBMAWNRO-KRWDZBQOSA-N 392.480 5.016 30 20 GKED Cc1cc(C)cc(C2(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)CC2)c1 55327191 GXUIELODUKKBET-UHFFFAOYSA-N 397.478 5.341 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2sccc2Br)cc1 55429232 LSGISBSETWCJSP-UHFFFAOYSA-N 399.269 5.427 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc(-c2ccccc2)s1 108237466 PGGAPPPOKGSXLR-CQSZACIVSA-N 379.510 5.314 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1ccc(C(F)(F)F)cn1 122412030 FEJWXBDOMOQHPS-IBGZPJMESA-N 378.353 5.162 30 20 GKED COc1ccc(CN[C@H](C)c2oc3ccccc3c2C)cc1OCCCC#N 147174739 XEOIJXWKSRYVBD-QGZVFWFLSA-N 378.472 5.283 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1cccc(-c2cccs2)c1 170642468 XRZOXRGAWIDFIM-UHFFFAOYSA-N 379.510 5.081 30 20 GKED CO[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 170974811 LGWKIODIOSKXSE-KRWDZBQOSA-N 394.418 5.037 30 20 GKED Cc1c(NC(=O)c2ccc(C3(C#N)CC3)cc2)cccc1C(=O)Nc1ccccc1 180073751 GZLWQQILRYQJKS-UHFFFAOYSA-N 395.462 5.055 30 20 GKED C=C(C)[C@@H](NCc1csc(-c2ccccc2OC)n1)c1ccc(F)c(F)c1 187781145 JIRBNGAROPJDJI-HXUWFJFHSA-N 386.467 5.504 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cn(C)nc1-c1ccccc1 191511279 ZSTPHCRBNNVRES-UHFFFAOYSA-N 388.515 5.261 30 20 GKED CC1(C)OB(c2ccc3cc(-c4cccc5ccccc45)ccc3c2)OC1(C)C 202390139 DMGOQGYEHGTQEC-UHFFFAOYSA-N 380.296 5.959 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cc1Cl 209718412 WTGWUJOQHBHPKC-HJWRWDBZSA-N 385.872 5.377 30 20 GKED CCN(C(=O)Cc1csc(-c2cccc(C)c2)n1)[C@@H](C)c1ccc(C#N)cc1 248070520 GSJTWWXMSCHZOZ-KRWDZBQOSA-N 389.524 5.142 30 20 GKED C=CCCSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1 303783397 IVLHSPAPAQTLFB-UHFFFAOYSA-N 390.306 5.017 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@H]3CCC[C@@H](C(F)(F)F)C3)n2)s1 328801730 ZMJNDYGDGQHMJE-WDEREUQCSA-N 389.468 5.840 30 20 GKED COc1ccc2c(c1)[C@H](/N=C(/O)[C@@H]1CC=CCC1)CCN2C(=O)[C@@H]1CC=CCC1 329544736 YYTFKEJKXVPGIT-DBXWQHBBSA-N 394.515 5.142 30 20 GKED Cc1ccccc1-c1noc(C)c1/C(O)=N/C1CCC(N2CCC(C)CC2)CC1 330091834 QHANVTNBTKVEDW-UHFFFAOYSA-N 395.547 5.306 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1nc2c(s1)CCCCCC2 330321664 GDAALURJPLGIKT-CYBMUJFWSA-N 391.562 5.097 30 20 GKED N#CC1(CCSc2nnc(-c3ccccc3Br)o2)CCCCC1 412986812 XNNWYHUGTQSHIR-UHFFFAOYSA-N 392.322 5.455 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425658592 VCTVHKCIJCGAJO-INIZCTEOSA-N 392.503 5.076 30 20 GKED Cc1cccc(-c2cncc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2)c1 426379484 JJWJUJPDKIBVMP-KRWDZBQOSA-N 387.508 5.704 30 20 GKED C[C@H](Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)c1cccc(C#N)c1 432511454 DDOUMXGOQLSBNW-LBPRGKRZSA-N 385.254 5.620 30 20 GKED COc1cc(C)ccc1-c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 432557850 MXLBFBOEJGZZNN-LUAWRHEFSA-N 384.439 5.092 30 20 GKED COc1ccccc1-c1nc(CN[C@H](CCCC#N)c2ccccc2)cs1 433021253 WSTWWEYIWNEVTD-HXUWFJFHSA-N 377.513 5.343 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1 435100272 DVKLOMHFJIMIHV-VGOFRKELSA-N 391.515 5.103 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc(C#N)cs2)cc1F 437680252 KWHAFATYBZMJLM-UHFFFAOYSA-N 382.416 5.121 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2cc(C#N)cs2)cc1 437695823 DGEUNGHBZJVCNX-HNNXBMFYSA-N 376.481 5.129 30 20 GKED C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 437745006 LQTUWEGTCUEYBK-RTBURBONSA-N 391.515 5.374 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)c1c(F)cc(C#N)cc1F 445925209 QZWYUJWOQYNBAC-UHFFFAOYSA-N 380.419 5.548 30 20 GKED N#CCc1ccc(NC(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)cc1 462438715 UZFIKMQJJGKSOH-UHFFFAOYSA-N 396.874 5.949 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc2ccsc12 464554309 FULYUYDGJLBLNH-UHFFFAOYSA-N 385.448 5.521 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 466367282 RVCRMONJEYBCBH-KRWDZBQOSA-N 399.560 5.062 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1C 471909257 YSFBBXIJCUWOFH-MRXNPFEDSA-N 382.529 5.353 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@@H]3CCC[C@H]3c3ccc(C(F)(F)F)cc3)CC2)cc1 474160804 VQFZMKGOLKFQEN-VQTJNVASSA-N 398.428 5.061 30 20 GKED C=CCCC1(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CC1 475026754 BLBUBJYIYWTTJY-INIZCTEOSA-N 380.463 5.002 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cccs1)c1ccc(F)cc1)c1ccccc1 475908184 AHJMWOKOFBECOP-SFHVURJKSA-N 378.472 5.508 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1)c1ccccc1 475935044 XEVWQNZNJBJYLN-IBGZPJMESA-N 389.474 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(F)cc(Br)c1 476137453 HVSNUMOBUXGFBD-UHFFFAOYSA-N 376.269 5.692 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(CCSC)cc1 480618160 WHYLGJQSACSCJM-UHFFFAOYSA-N 380.966 5.527 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482410699 UIWTYVMPCIBRTJ-UHFFFAOYSA-N 395.462 5.275 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F 483651069 RLUUCXTYIZHLHZ-ILXRZTDVSA-N 399.482 5.571 30 20 GKED N#Cc1csc(CN[C@@H](CC2CC2)c2cc(F)cc(Br)c2)c1 495169457 DTXJWWNXFFKPJO-KRWDZBQOSA-N 379.298 5.152 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(Br)cc1)[C@@H](C)c1ccc(C#N)cc1 499284834 DTSMYAHIYZOJMO-GJZGRUSLSA-N 385.305 5.034 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1Cl)c1c(Cl)cccc1Cl 499816660 VARUCBFGTXHJGT-HSMVNMDESA-N 379.674 5.131 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C(C)C 499892460 ZQHNRISSFZLRAM-INIZCTEOSA-N 399.564 5.701 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccc(O)cc1Cl 509092352 AWZVMJYDAGCWPA-UHFFFAOYSA-N 392.842 5.199 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 509607702 IWHLPFBPSZVHAW-HOTGVXAUSA-N 388.389 5.106 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cncc2ccccc12 510269363 KIHJXZOQSMGUON-UHFFFAOYSA-N 379.419 5.460 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1C1CCCCC1 511023412 CBKVEQNGJZNAKY-HNNXBMFYSA-N 382.533 5.343 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)Nc2sc(C)c(C)c2C#N)c(C)c1 515322656 OOMBVENXSJDDCR-UHFFFAOYSA-N 393.537 5.652 30 20 GKED Cc1cc(N(CCC#N)C(=O)CSc2c(F)cc(F)cc2F)ccc1Cl 515592219 OFRHUSACTFOMIH-UHFFFAOYSA-N 398.837 5.105 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccccc3F)s2)sc2c1CCCCC2 516778961 MXODCGMZJSZLBR-UHFFFAOYSA-N 397.500 5.404 30 20 GKED C=CCN(C(=O)c1cnc(-c2ccccc2F)s1)c1nc2c(s1)CCCC2 517899684 IDBGVQSKQKCFPY-UHFFFAOYSA-N 399.516 5.117 30 20 GKED Cc1cccc(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 518667671 HOENVRZSQNOMSD-UHFFFAOYSA-N 378.419 5.201 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC(C)C)c1cccs1 519511499 BUIMHEQQCJOLRZ-SFHVURJKSA-N 387.505 5.141 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccccc1C(F)(F)F 520855276 GUVFBVFJQZHXSZ-ZDUSSCGKSA-N 393.434 5.279 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 521747923 DNABKMANVOAHNR-ZDUSSCGKSA-N 393.965 5.707 30 20 GKED C[C@@H](Nc1ccc(NC(=O)Cc2ccc(C#N)cc2)cc1Cl)c1ccccc1 522219418 YDTSHLDUSNHGJC-MRXNPFEDSA-N 389.886 5.566 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)cc1 522999916 YVRFGOKJZYCNTM-RUZDIDTESA-N 391.474 5.300 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N(C[C@@H](C)C#N)C1CC1 533139498 DYYCKLIQRZGRFS-HNNXBMFYSA-N 397.906 5.383 30 20 GKED N#CCc1ccc(C(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)cc1 535367057 YIWHTYCSJTXNKR-UHFFFAOYSA-N 385.511 5.386 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 538043951 OEBPCVKAHUMOOA-INIZCTEOSA-N 397.425 5.237 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CCCC(F)(F)F 538840512 RHUDDNBVIUBDOP-UHFFFAOYSA-N 380.797 5.477 30 20 GKED CC(C)(C)C[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(F)cc1 540365279 JNXRSTZRTOHQFO-LJQANCHMSA-N 378.451 5.014 30 20 GKED N#Cc1ccccc1COc1ccc(-c2nc([C@H]3CCCCS3)no2)cc1 545102792 RDODMACNOMMLLJ-LJQANCHMSA-N 377.469 5.145 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc([C@H]2CCCOC2)nc1C 552010977 MEAYSYWYVNRHMJ-KRWDZBQOSA-N 384.545 5.450 30 20 GKED COc1ccc(C[C@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc2)cc1OC 554997894 QSCCJNDUAWGTAX-RPWUZVMVSA-N 398.506 5.136 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)cc2cccnc12 558295609 KXTUMVOKRSVKOZ-UHFFFAOYSA-N 397.910 5.276 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)C[C@@H]2C[C@H]3CC[C@H]2O3)cc1 562954144 NHSKWMXBYLZKCC-BOFPYLFWSA-N 398.915 5.259 30 20 GKED COc1cc(CS[C@H](C)c2cccnc2)ccc1OCc1cccc(C#N)c1 570999008 BTRNGCBOLPLQCI-QGZVFWFLSA-N 390.508 5.535 30 20 GKED N#CCc1ccc(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 572761758 DSSBYTXZQHXOOR-IBGZPJMESA-N 377.488 5.182 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1N1C[C@H]2CC[C@H]1C2 576543859 JCXSQQURVMGYFE-ROUUACIJSA-N 393.556 5.004 30 20 GKED N#CCCCCCC(=O)N(Cc1ccccc1)c1nc2ccc(Cl)cc2s1 588820981 HSXUKZIWKUDKGP-UHFFFAOYSA-N 397.931 5.957 30 20 GKED CC(C)(C#N)c1ccc(CNCc2csc(CCc3ccccc3)n2)cc1 594497607 ILYJPWGTMYMTCA-UHFFFAOYSA-N 375.541 5.019 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1[C@H]2CC[C@H]1CC(C)C2 596723329 BOHRQVKKGNRCPG-SFTDATJTSA-N 389.499 5.241 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)CCCCOc2cccc(C#N)c2)c1 598872445 WXRKYYQLIQQGLE-UHFFFAOYSA-N 376.378 5.073 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1F 599736190 CHOZMRJBGZGUQV-HNJNHCNJSA-N 387.455 5.037 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H]1CCC(F)(F)C1 601059983 MBLGUIUXWMRABG-ZIAGYGMSSA-N 384.517 5.045 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2cccc(Cl)c2C#N)cn1 603867547 ZNAYHTNTSRMSTL-UHFFFAOYSA-N 379.847 5.410 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(C(C)(C)C)ccc1OC 604488418 CHDBPHXOYYLKEL-UHFFFAOYSA-N 377.488 5.084 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccccc2Cl)n1 608934932 CQULMRKKLYPODU-UHFFFAOYSA-N 395.915 5.386 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)C1 609079169 NORGGFXVAQFUHQ-GOSISDBHSA-N 377.488 5.100 30 20 GKED C[C@H](NC(=O)N[C@@H](CCc1ccccc1)c1ccccc1)c1cccc(C#N)c1 610357242 JIWJDMRUXBPGAA-CYFREDJKSA-N 383.495 5.293 30 20 GKED FC(F)(F)c1csc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 676307712 ZIVMLCKBXQDQLR-ZMONIFLSSA-N 386.283 5.483 30 20 GKED Fc1c(F)c(F)c(CNC2(c3cccc(C(F)(F)F)c3)CC2)c(F)c1F 728291928 SPKDTCAGMIVODH-UHFFFAOYSA-N 381.266 5.180 30 20 GKED N#C[C@@H](C(=O)CCc1nc2cc(Cl)ccc2s1)c1nc2ccccc2s1 730685035 GFWFMZYVOJNJBH-LBPRGKRZSA-N 397.912 5.368 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 732495587 DNJDVSYFOXYRMX-UYAOXDASSA-N 392.549 5.866 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1c[nH]c2ccccc12 733084164 XFBZRKXVXOVKOO-HJWRWDBZSA-N 375.409 5.096 30 20 GKED C=CC[C@H](NC(=O)NCC(C)(C)c1ccc(OCC(C)C)cc1)c1ccncc1 734669899 WJBVXBDVCGMUFS-QFIPXVFZSA-N 395.547 5.011 30 20 GKED O=C1/C(=C/c2ccc(F)cc2)CC(O)(C(F)(F)F)C/C1=C\c1ccc(F)cc1 735792326 BSNZPVUWBPXVCY-KAVGSWPWSA-N 394.339 5.088 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 739143021 NKTRICAPVLQGQL-IUODEOHRSA-N 388.414 5.370 30 20 GKED CC(C)C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 741111778 YLZOAABOEXNCCS-SJORKVTESA-N 381.426 5.438 30 20 GKED C[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1nc(-c2cccc(F)c2)no1 743045479 MACHVVMLGJXWOD-SDMDJCRESA-N 380.206 5.068 30 20 GKED C[C@H]1CN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)[C@H]1c1ccccc1 743626608 YBAKEJSYPQKGKL-KSFYIVLOSA-N 387.508 5.189 30 20 GKED CC(C)[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 744073925 IRICFSOXSVACDL-HNAYVOBHSA-N 396.462 5.704 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](CC(C)C)c1ccccc1OCC)c1ccncc1 746419908 ACTANPFPRISHJD-RTWAWAEBSA-N 381.520 5.184 30 20 GKED C#CCCCCNC(=O)N(Cc1ccc(-c2ccccc2OC)cc1)C(C)C 758880304 PTVFDAWSAPSSFF-UHFFFAOYSA-N 378.516 5.086 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1nc(-c2ccccc2)n2c1CCCCC2 768561742 IHXHXGBPUVQKHP-UHFFFAOYSA-N 379.504 5.153 30 20 GKED CC(C)[C@@H]1C[C@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773982681 LKHZPZTVLNYTSB-BFHYXJOUSA-N 379.312 5.585 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(CNC(=O)OC(C)C)cc1)c1ccccc1 777670238 UDGSHZPFIYGRJR-OAQYLSRUSA-N 380.488 5.010 30 20 GKED N#C[C@H](C(=O)Cc1cccc(C(F)F)c1)c1nc2cc(Cl)ccc2s1 790773289 LVBAGHXLHMBAGF-CYBMUJFWSA-N 376.815 5.306 30 20 GKED Cn1cc(-c2ccc(CNCc3cccc(-c4ccc(C#N)s4)c3)s2)cn1 800885608 DWQCPSNJUUWUAV-UHFFFAOYSA-N 390.537 5.039 30 20 GKED O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 857498493 GWGOTIOSAYYYRK-KGLIPLIRSA-N 397.265 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1=CC[C@@H](NC(=O)OC(C)(C)C)C1 861269239 PYLVUXUHIFBOKE-GOSISDBHSA-N 384.520 5.091 30 20 GKED Cc1sc([C@H](C)N[C@@H](C)c2cc(C#N)ccn2)nc1-c1ccc(Cl)cc1 902837202 VHJBUMXAZKYANS-STQMWFEESA-N 382.920 5.450 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCSc2ccccc2F)cc1 915179376 CZWPVHVNRLTTLQ-HXUWFJFHSA-N 390.483 5.602 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNc2ccccc2Cl)cs1 916262260 GUSIBYRMFWULHK-UHFFFAOYSA-N 398.919 5.544 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916680997 NJTBUCXYYJLPKJ-HTAPYJJXSA-N 387.458 5.706 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2)CC1)c1nc(-c2ccc(Cl)cc2)cs1 916976421 ODEPLDNVZMLBFP-KRWDZBQOSA-N 378.884 5.372 30 20 GKED Cc1ccc(CCCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976936 XUMHUNUMGPWJQE-IBGZPJMESA-N 394.927 5.971 30 20 GKED CCOc1ccccc1CCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047079 QRJVZXRSONJVHL-HNNXBMFYSA-N 384.888 5.157 30 20 GKED N#C[C@H](C(=O)CN1CCCCC[C@@H]1c1ccccc1)c1nc2ccccc2s1 917155560 YZDPFOFLVLZJCA-UYAOXDASSA-N 389.524 5.090 30 20 GKED CCCN(C(=O)c1ccccc1OCC#N)[C@@H](C)c1ccc(Cl)c(Cl)c1 920003384 KPSAULFTPADZSZ-AWEZNQCLSA-N 391.298 5.509 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2ccsc2)c1 1776788060 NDDYPMBWMGCESO-HXUWFJFHSA-N 375.534 5.403 30 20 GKED Cc1cc(/C=C\c2nc3cc(C(=O)O)ccc3n2-c2ccccc2)ccc1C#N 1777421038 GNPDXJJLCCCMSP-WQLSENKSSA-N 379.419 5.074 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccn(-c4ccccc4)n3)cc2)cc1 1777671095 BZWHREFDDYCTTA-OVCLIPMQSA-N 394.430 5.134 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3cccc(Br)c3)o2)c1 1777686154 QVCJWOOFIDIAKA-VQHVLOKHSA-N 397.224 5.303 30 20 GKED Cc1cccc(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2cccc(C)c2)c1 10167373 QNIFUXBMNQLYSV-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1cccc(C)c1 24853936 GEHYCDUJPZQMLR-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CCc1cccc2c(C(=O)[C@H](Nc3ccc(CC#N)cc3)c3ccccc3)c[nH]c12 25692432 GWBIXOXIUUQTKK-RUZDIDTESA-N 393.490 5.832 30 20 GKED C=CCn1c(SCc2ccc(-c3ccccc3C#N)cc2)nnc1-c1ccco1 45773017 VLTGFRXWKOKIQP-UHFFFAOYSA-N 398.491 5.555 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 56739530 JECMDRSOQZOCHG-UHFFFAOYSA-N 379.435 5.318 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2SCCC#N)ccc1C(C)C 78668589 RRRBBTAYVNKYRV-KRWDZBQOSA-N 382.529 5.530 30 20 GKED CCCOc1c(Br)cc(/C=C\C(=O)c2ccc(C)o2)cc1OC 96930428 PSMFVBQBSSSOMT-SREVYHEPSA-N 379.250 5.044 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccc(F)cc1F 108238425 AVVOTNIIZXGQBJ-AWEZNQCLSA-N 390.455 5.014 30 20 GKED Cc1cc(C(=O)Nc2ccc(Cl)c(C#N)c2)ccc1NC(=O)c1cccs1 129063927 AFKGEKZOMKATQG-UHFFFAOYSA-N 395.871 5.086 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 152813535 PHLLMOOLUJSVIG-UHFFFAOYSA-N 386.293 5.108 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(SCc3cccnc3)cc2)c1 175551676 BTYCHGDCTWATRR-UHFFFAOYSA-N 391.521 5.242 30 20 GKED N#Cc1csc(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 177708034 JEQGSCPVKVMUCG-UHFFFAOYSA-N 379.432 5.052 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC(c2ccccc2)c2ccccc2)ccc1OC 180892453 HKUIHLMPHNPPLB-QFIPXVFZSA-N 386.495 5.255 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1noc(-c2ccccc2)n1 191447453 IKCZKCWBBHBYQA-INIZCTEOSA-N 390.487 5.471 30 20 GKED N#Cc1cccc(C#N)c1NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 302775735 AHLYSBIFKZDZOX-UHFFFAOYSA-N 384.386 5.184 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Oc1cccc(Cl)c1 303506685 NGSOLJAHBJZXMM-AWEZNQCLSA-N 388.920 5.388 30 20 GKED Cc1cccc(C)c1Oc1ccccc1NC(=O)Cc1ccc(OCC#N)cc1 303529052 WGSDICGPUPECFA-UHFFFAOYSA-N 386.451 5.179 30 20 GKED O/C(CC1(Cc2nc3ccccc3s2)CCCCC1)=N/C[C@@H]1CC[C@@H](O)C1 330016350 PKNMKYDRTYMPHR-IAGOWNOFSA-N 386.561 5.297 30 20 GKED N#Cc1ccccc1OC1CCC(/N=C(/O)[C@H]2CCCc3c(O)cccc32)CC1 330032817 VDHOLHYHZMDBPP-NGICGMGXSA-N 390.483 5.030 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCO2)N1CCCC[C@@H]1c1ccc(F)cc1 330099296 CXQVKKVLXVOIQE-QGZVFWFLSA-N 390.842 5.023 30 20 GKED CCn1ccnc1[C@H]1CCCCN1/C(O)=N/[C@H](C)c1oc2ccccc2c1C 330277631 ONOVAICXQHWTCW-SJLPKXTDSA-N 380.492 5.160 30 20 GKED CC[C@H](CC(F)F)C(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410691465 VQCUXRNGKVSPLI-RNCFNFMXSA-N 391.302 5.449 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2 410980418 FTPFBSZCZHRQCA-SNVBAGLBSA-N 380.391 5.096 30 20 GKED Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)SCCC#N)cc3)sc2c1 413017596 ZHIPBQJMVHIIAA-AWEZNQCLSA-N 381.526 5.246 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N(CCC#N)CC1CC1 429081333 MRTYEDTZFXZFQR-UHFFFAOYSA-N 397.906 5.385 30 20 GKED N#Cc1c(NC(=O)c2c(Cl)cc(F)cc2Cl)sc2c1CCCCCC2 432748375 CJGLSNOEVGIBPL-UHFFFAOYSA-N 397.302 5.977 30 20 GKED Fc1ccc(C#CCSc2nnc(-c3ccncc3)n2C2CCCCC2)cc1 433377383 MWYBPVIBLSRCIV-UHFFFAOYSA-N 392.503 5.128 30 20 GKED CC[C@@H](C)c1ccc([C@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 437643848 CYBNDVALMMKLSJ-UZUQRXQVSA-N 388.515 5.609 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@H](c2ccccc2)[C@H](C)C1 437829243 QVKURIRYLQCWTC-XLIONFOSSA-N 377.488 5.003 30 20 GKED CCCCOc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c(C)c1 437899468 VFDGUAGWCTUEEB-GMAHTHKFSA-N 391.515 5.478 30 20 GKED CCOCc1ccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 438224616 KTYSDVCCHORIDK-UHFFFAOYSA-N 387.439 5.531 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 438663186 GTASRFKKKFEFGF-UHFFFAOYSA-N 381.432 5.181 30 20 GKED Cc1sc(Br)c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1C 441066084 OCVGVTQSYBHQEC-UHFFFAOYSA-N 397.363 5.610 30 20 GKED C[C@H]1CSc2ccc(Br)cc2[C@H]1NCC1CCC(C#N)CC1 442876344 QXPVNMXQLMQDJG-YGFYOVKCSA-N 379.367 5.152 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 454703219 URVCCBYPAIAMLX-LPHOPBHVSA-N 397.906 5.431 30 20 GKED CC(C)Cn1ncc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C(F)F 455021547 IJDROGSEWKWJEH-MRXNPFEDSA-N 389.450 5.033 30 20 GKED COc1ccc(C2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)CC2)cc1 458799080 JDRHYHPEJVWQGS-HSZRJFAPSA-N 391.515 5.019 30 20 GKED C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1C(=O)N[C@H](CCCC#N)c1ccccc1 458838197 LWKQMNAKAFSSJJ-BURFUSLBSA-N 381.442 5.182 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)Cc1cccc(F)c1 459399418 LUUPWMDAGXSIFR-HZPDHXFCSA-N 385.508 5.172 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)C1(C#N)CCC1 460644957 FNBQKDARXCUFLD-UHFFFAOYSA-N 390.462 5.364 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)nc1 463462031 SYUBFCACOCQLPZ-UHFFFAOYSA-N 385.467 5.102 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NCc2cccc(C#N)c2)cc1 465516463 OMJDBSKJADJFTF-SFHVURJKSA-N 399.494 5.136 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 467515991 CXJMNNAGWHOKDJ-HXUWFJFHSA-N 378.516 5.897 30 20 GKED Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2cn(CCCC#N)c3ccccc23)C1 469451537 CFTVQVDGJLLQQQ-UXHICEINSA-N 385.511 5.272 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(C(F)(F)F)ccc1Br 471173833 UMTZPMGWILZCMF-UHFFFAOYSA-N 391.231 5.012 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c(C)c1 471280585 WFBNAKAKTLRQLO-OALUTQOASA-N 393.556 5.719 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 473384841 CVKQSQGOIDYJLX-UHFFFAOYSA-N 384.357 5.109 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(F)cc2)c(Br)c1 481089576 HPKMZZFDLOPVBJ-OAQYLSRUSA-N 395.275 5.339 30 20 GKED N#Cc1cc(NC(=O)c2cccc(Cl)c2Cl)ccc1OCC(F)(F)F 481908138 SCCPVGOEIIJBLA-UHFFFAOYSA-N 389.160 5.058 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1nccc2ccccc12 483229063 NLUMGSRRDYBVFD-LJQANCHMSA-N 388.373 5.479 30 20 GKED Cc1nc(CN(C(=O)C[C@H](CC#N)c2ccccc2)c2ccc(F)cc2)cs1 483306228 JQTWUVSJYWWYIB-SFHVURJKSA-N 393.487 5.211 30 20 GKED CCc1c(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cnn1C(CC)CC 484139528 GZYQWYFLRKVUSX-HNNXBMFYSA-N 399.564 5.845 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)cc2F)nnc1-c1ccccc1OC 497663373 MWJMNCBBZFWDSR-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@@H]2C)o1 499710986 PUGHMIUDYBNKMU-QCEMKRCNSA-N 375.921 5.436 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccnc(-c3ccccc3)c2)c1 500427599 RTGHEYQICDJZEE-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccccc1C(F)(F)F 502179853 DIKBFJBOSOIZMR-HNNXBMFYSA-N 399.416 5.137 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 503109161 IRXPCNVNDVQKGD-UHFFFAOYSA-N 397.372 5.462 30 20 GKED Cc1nc(-c2cccc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)c2)oc1C 503646791 XSWYJEIFTNYMRL-UHFFFAOYSA-N 398.466 5.151 30 20 GKED N#Cc1ccc(CC(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1 504625984 BSOWBVPKKCLKBM-UHFFFAOYSA-N 395.289 5.313 30 20 GKED CCc1cccnc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 506015172 QBUHLDFKUYKWBZ-UHFFFAOYSA-N 377.831 5.214 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 507903653 TVNJNPKXVSOIST-CYBMUJFWSA-N 376.378 5.106 30 20 GKED O=C(CC(F)(F)F)Nc1ccc(NCc2ccc(F)c(C(F)(F)F)c2)cc1 509961323 YQUCABALKSOFJM-UHFFFAOYSA-N 394.290 5.348 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1c(Cl)ccc(F)c1Cl 511625940 GGMQDAFLUTVZPE-NSHDSACASA-N 394.277 5.816 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Cn1ccc2ccccc21 511695597 OKVFNCHOQAAJIG-IAGOWNOFSA-N 377.513 5.310 30 20 GKED CCCN(C(=O)NCC(C)(C)CCC#N)[C@H](C)c1ccccc1Br 513151585 WORHSFSLHJGKSW-OAHLLOKOSA-N 394.357 5.262 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 517483340 ZADAGIOGWWFPHO-BJKOFHAPSA-N 392.458 5.641 30 20 GKED N#Cc1ccc(OCC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1 517905722 DWABIOPMOHNWDO-UHFFFAOYSA-N 378.815 5.021 30 20 GKED C=CCOc1c(Br)cc(CNCc2cccc(C)c2)cc1OCC 518749836 WHQOWHQGBMXJIM-UHFFFAOYSA-N 390.321 5.011 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3csc(-c4ccc(Cl)s4)n3)[nH]c12 524033343 RKBVWZKWFVQIKP-SNVBAGLBSA-N 398.900 5.200 30 20 GKED CCCN(CC#N)C(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525069394 TUDCSSJKBJKWDH-UHFFFAOYSA-N 393.339 5.661 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c1 536785426 SCEQPQXQELRBBK-IBGZPJMESA-N 390.508 5.822 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1cccc(OC)c1 539759680 NYKVZSJBGSVJKS-AWEZNQCLSA-N 392.484 5.134 30 20 GKED CCCCn1c(SCc2ccc(CC#N)cc2)nnc1-c1ccc(OC)cc1 544049307 DRJFQFUVGVLHGY-UHFFFAOYSA-N 392.528 5.112 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC[C@@H](c2ccccc2F)C1 554187032 BXYGVYSLQWEHHE-GOSISDBHSA-N 386.426 5.119 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1csc(-c2ccccc2F)n1 556201648 HMMOLKWIHGATKE-OXQOHEQNSA-N 379.504 6.035 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@@H](c4cccc(F)c4)C3)c2)cc1 560663219 GWTYODQJVCKDFJ-HXUWFJFHSA-N 386.426 5.119 30 20 GKED CC1(C(=O)N2CCCC3(CCCC3)C2)CCN(c2ccc(Cl)cc2C#N)CC1 561290683 DFUIKWFQOLQUJK-UHFFFAOYSA-N 399.966 5.001 30 20 GKED C[C@H](NC(=O)c1ccoc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 573769652 XJYNOFZECYKHTQ-ZDUSSCGKSA-N 384.357 5.328 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1nc2ccccc2nc1C1CC1 576682561 KIJZFGKIVZJSHH-CQSZACIVSA-N 388.496 5.011 30 20 GKED CC[C@@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(C#N)cc1 576695859 HIAXCTQBTAZASR-MHECFPHRSA-N 383.495 5.612 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 592975502 HKQHSJYNJOBQJD-QGZVFWFLSA-N 397.365 5.121 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@@](C)(C#N)C2)c(C(F)(F)F)c1 596712266 XUHQYYNCIWWINN-SJCJKPOMSA-N 385.455 5.363 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)[C@H](C)C(C)C 609079088 ZVAHDUWIFVVRKZ-GOSISDBHSA-N 379.504 5.344 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3ccc(OC(F)F)cc3)c2)cc1 609176216 BEODCUHAPAYDTN-UHFFFAOYSA-N 394.377 5.133 30 20 GKED Cc1cc(C)cc(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 609388189 RVTUEZYZCFGJDA-QGZVFWFLSA-N 384.570 5.427 30 20 GKED C[C@H](CCC(C)(C)C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 609927756 LFCRTAHOPKAFQL-GOSISDBHSA-N 393.531 5.668 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2C(F)(F)C1 610922712 HWBRWKPBTCXJKC-CQSZACIVSA-N 387.455 5.078 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN[C@H](C)c1cccc(C#N)c1 611388179 KJBSNQBRWCLQTF-MRXNPFEDSA-N 397.950 5.406 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1C 611568010 NLMSXDGETDTBBL-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C[C@@H](NC(=O)N1CC[C@H](c2ccco2)C1)c1ccc(-c2cccc(C#N)c2)cc1 611854961 FBUUHJLOOTXFIC-VGSWGCGISA-N 385.467 5.078 30 20 GKED C=C[C@@H](CC(=O)Nc1c(O)cc(Br)cc1Cl)c1ccccc1 673483528 TUEFLSDTQMHULO-NSHDSACASA-N 380.669 5.107 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3cccc(OCCCC#N)c3)oc12 726741920 JRXSFTBTPQPAJI-QXMHVHEDSA-N 375.424 5.410 30 20 GKED N#Cc1ccc(NC(=S)NC2(c3cccc(C(F)(F)F)c3)CC2)cc1Cl 727289673 FJILYWIARGMUMU-UHFFFAOYSA-N 395.837 5.206 30 20 GKED CCc1ccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1 727980438 LGZMPILETGJJJQ-UHFFFAOYSA-N 387.508 5.509 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)c(C)c1 728062099 DLHMJTOHLPLDGD-LJQANCHMSA-N 399.494 5.193 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC(C)C)cc2)cc1OCCCC#N 728441677 OLYJCAATEVFEAW-SDQBBNPISA-N 395.524 5.774 30 20 GKED CCCCN(C)c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 730669048 UCCOLVVJGLCOLL-UHFFFAOYSA-N 378.520 5.237 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2ncoc2-c2ccccc2)cc1 732578258 PGHSHGUZEGIAGQ-UHFFFAOYSA-N 380.403 5.237 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3ccc(F)cc3)CCCCC2)c1 733770693 JYTWFFGLXIRAEE-OAQYLSRUSA-N 394.490 5.025 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccncc1 734237554 QGEZPLQMMKGHBX-HXUWFJFHSA-N 395.553 5.186 30 20 GKED CN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccc2ccccc2c1 734315232 XGOKDWZYQWQCFO-UHFFFAOYSA-N 392.458 5.567 30 20 GKED C=CC[C@H](NC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1ccncc1 734456788 CTYWQOCXWLNQKV-QFIPXVFZSA-N 397.478 5.189 30 20 GKED C=CC[C@H](NC(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1)c1ccncc1 734684496 SJLSGDNGNGAPBQ-NRFANRHFSA-N 396.510 5.429 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(C)cc1 739159215 IMLGURDACWUPGG-NQIIRXRSSA-N 399.519 5.750 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cn3cc(Cl)ccc3n2)cc1 741469034 JHKHNVXYJSVGSF-QXMHVHEDSA-N 388.854 5.559 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(-n3cccn3)cc2)cc1 741470803 WGACKNLZROMZRF-CXUHLZMHSA-N 380.447 5.444 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@@H](C)C[C@H]2c2cccc(F)c2)c1=S 742176028 QPVPANPNTCICFH-YJBOKZPZSA-N 398.507 5.040 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 743457235 AINBUQUXICDTPO-ATEOEAFZSA-N 387.439 5.101 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(Cl)c(Cl)c1 747117427 QHUOBTXKSLZJHX-BXKDBHETSA-N 393.270 5.722 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2snc(Cl)c2C#N)nc1-c1ccccc1 749283742 PAOVOPCGMJSARF-OAHLLOKOSA-N 398.919 5.788 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 751544630 ZAWIHAOZMGXGIB-NGXZDTIWSA-N 395.506 5.752 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C(C)=C\c1ccc(Cl)cc1 759204261 BKQUKNLCMLAFNX-TXUZILRVSA-N 394.902 5.216 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1c(F)c(F)c(F)c(F)c1F 769989591 IFPFQWJDPSWODT-LLVKDONJSA-N 383.282 5.474 30 20 GKED CC(=NNc1nccnc1C(C)C)c1sc(-c2ccc(Cl)cc2)nc1C 773091128 NTLFNKSQNXUILC-UHFFFAOYSA-N 385.924 5.521 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)c(C)c1 780535726 XGEKOIDOUZPWNY-JKSUJKDBSA-N 383.517 5.821 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](F)CC3CCCCC3)n2)cc1 796662976 UHULMOCYNDUQCC-ZWKOTPCHSA-N 381.476 5.167 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)OCCCC(C)(C)C#N 797501317 COLLEYUMLWFCID-UHFFFAOYSA-N 381.259 5.444 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 798288550 YFOYOWMLXHHYPP-RCCFBDPRSA-N 396.874 5.583 30 20 GKED N#CCCCCCC(=O)OCc1nc2cc(Cl)ccc2n1Cc1ccccc1 805697308 TXBRHSAHHKYHPX-UHFFFAOYSA-N 395.890 5.255 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3cccc(Cl)c23)cc1 814305514 JYFQQJGLLOGWFG-FQEVSTJZSA-N 399.881 5.658 30 20 GKED CCOC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 820479106 RUEZHUCFFFNTQZ-IBGZPJMESA-N 399.878 5.073 30 20 GKED CCC(C)(C)OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 838785803 DUQLEILAVLWYJA-CYBMUJFWSA-N 397.327 5.498 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)c(F)c1 850538401 DUICCEXXQATLDO-SPLOXXLWSA-N 395.478 5.382 30 20 GKED Cc1cc(NC(=O)c2ccc(Cl)c(C#N)c2)ccc1NC(=O)OC(C)(C)C 856373531 NSQBQKJOCWDDJO-UHFFFAOYSA-N 385.851 5.119 30 20 GKED N#CC1(C(=O)OCc2coc(-c3ccc(F)c(C(F)(F)F)c3)n2)CCCCC1 859522583 JEIJCUITJHILLX-UHFFFAOYSA-N 396.340 5.017 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353961 RTTISIJKJDXYFF-IIBYNOLFSA-N 375.497 5.156 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(-c2cccs2)cc1F 917540669 SJRBULHITJMHJO-UHFFFAOYSA-N 394.500 5.292 30 20 GKED CCN(Cc1c(-c2ccccc2)nc2sccn12)[C@@H](C)c1ccc(C#N)cc1 919741221 KALBDEHNIPXMMV-KRWDZBQOSA-N 386.524 5.518 30 20 GKED CCCCCCCOc1cccc(C=NNc2ccc(Cl)c(C(=O)O)c2)c1 1776033322 GSRDTDPSSAGOPM-UHFFFAOYSA-N 388.895 5.833 30 20 GKED COc1ccc(Cl)cc1C(CC(C)C)=NNc1ccc(Cl)c(C(=O)O)c1 1776033543 XNEZDOFUGVLJMM-UHFFFAOYSA-N 395.286 5.563 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(Cl)c(Cl)c1Cl 1776061833 QHVOUTCLXXZICM-UHFFFAOYSA-N 375.614 5.320 30 20 GKED Cc1c(NN=C2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cccc1C(=O)O 1776086996 CKRNAFIEJXITJA-KRWDZBQOSA-N 390.405 5.838 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1ccccc1OC 6147770 QDQIMPBEYLZIDD-UHFFFAOYSA-N 394.525 5.042 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)c2ccccc2-c2ccccc2C#N)c1 8176451 VDZIKUNQTPBRDM-SFHVURJKSA-N 398.462 5.026 30 20 GKED Cc1sc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c(C#N)c1C 20836565 CUJQMLTYODGOEU-UHFFFAOYSA-N 398.491 5.342 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2c(s1)CCCC2 32571956 KZLSFFIMLQZIET-UHFFFAOYSA-N 382.460 5.254 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2)=C(/S)NC(C)(C)C)cc1 55015166 AQKINHOPKKIAKT-UHFFFAOYSA-O 383.581 5.205 30 20 GKED CCO[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 67581831 ANVRODYTCKFBBY-AZUAARDMSA-N 397.906 5.028 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1ccc(Cl)c(Cl)c1 68455840 AOVZWOXEROYXKZ-MJVIPROJSA-N 379.209 5.043 30 20 GKED CC(C)(C)c1csc(CNCc2cccc(OCc3cccc(C#N)c3)c2)n1 105498520 QABZSRYDYGIKTF-UHFFFAOYSA-N 391.540 5.181 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3[nH]ccc3c2)cc1 107563731 UJKXBJUJJSOGKE-UHFFFAOYSA-N 381.435 5.065 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1cccc(Br)c1 108293581 GMYAIAYZICKDLK-UHFFFAOYSA-N 389.318 5.026 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)(F)F 115769747 UZKJDALQNDJVBM-DYVFJYSZSA-N 393.434 5.506 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CC/C=C/c3ccccc3)n2)cc1 122018247 JEFFLBAVOGNITF-BTZGUFSASA-N 383.476 5.352 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccc(Cl)cc2C1 123806046 MOVCLFHNIBEKLF-CQSZACIVSA-N 385.920 5.324 30 20 GKED C=CCOc1ccc(CNc2cccc(C[S@](=O)Cc3ccccc3)c2)cc1 133123667 IYIHZBHBPCTPEA-NDEPHWFRSA-N 391.536 5.312 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccccc2)CCC1)c1nc2ccccc2n1C(F)F 177135931 BWYIWPZKEJDCDK-MRXNPFEDSA-N 379.410 5.021 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c(C)c1 178103981 JIQXLDYKJGYWTH-INIZCTEOSA-N 397.425 5.084 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1scnc1C1CCCC1 184087629 LIGVFRBKKWKLRT-UHFFFAOYSA-N 379.510 5.653 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(Cl)c1Br)c1ccccc1 191716549 XUTFZAMLHAVBNT-CQSZACIVSA-N 392.684 5.269 30 20 GKED Cc1ccccc1[C@H]1CCCN1CC(=O)Nc1ccccc1SC[C@H](C)C#N 247056375 GOEYIMSOWBIDCL-DYESRHJHSA-N 393.556 5.022 30 20 GKED C[C@@H](Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)c1ccc(-c2ccncc2)cc1 301418625 DCFAUHLYSSFLDZ-OAHLLOKOSA-N 395.422 5.250 30 20 GKED COc1ccccc1[C@H](Nc1c(C#N)cnc2c(C)cc(F)cc12)c1ccccn1 301840051 AEXRUOKKBOHKSC-DEOSSOPVSA-N 398.441 5.159 30 20 GKED COc1cc(N=C(O)N2CC[C@H](C(F)(F)F)C2(C)C)cc(OC)c1C(C)C 331010024 ZECPIZPJZPGIDA-HNNXBMFYSA-N 388.430 5.036 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCS1 433245630 JCJJQMNNSRHNBC-UHFFFAOYSA-N 381.501 5.100 30 20 GKED CC1(C)CCCN(C(=O)c2csc(-c3cccc4ccccc34)n2)[C@H]1C#N 434014220 FOJGJMZGKMGGJV-IBGZPJMESA-N 375.497 5.118 30 20 GKED C[C@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438660806 KWCILHRUUSLHQS-OAHLLOKOSA-N 393.418 5.225 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(COC2CCCCC2)c1)c1ccccc1 439367501 FYTCGUKMLFCBPO-HSZRJFAPSA-N 391.515 5.702 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)CS[C@H](C)c1cccc(C#N)c1 443135283 CGYUECDVUUUBDA-OXQOHEQNSA-N 382.529 5.019 30 20 GKED C[C@H](NC(=O)C1(c2ccc(C#N)cc2)CC1)c1ccc(-c2cccc(C#N)c2)cc1 444298947 ZNAIJBSAUZYFDF-SFHVURJKSA-N 391.474 5.006 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1 455787845 GGSDYOCAUPAMJU-LJQANCHMSA-N 380.492 5.136 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1cccnc1 460340009 RGXFPVGHWKNYFN-QGZVFWFLSA-N 389.886 5.334 30 20 GKED C=CCN(C(=O)CCc1cncc2ccccc12)c1nc(-c2ccccc2)cs1 462388485 OQZXSKUHGDIXSH-UHFFFAOYSA-N 399.519 5.510 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNC(=O)N(Cc1ccc(C#N)cc1)C(C)C 466853180 BQZFVEKFCROPDY-UHFFFAOYSA-N 389.421 5.006 30 20 GKED C=CCC(CC=C)C(=O)N1CCCN(C(=O)C(CC=C)CC=C)c2ccccc21 468720136 NBQDHCKMQBOEGB-UHFFFAOYSA-N 392.543 5.293 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469268228 UKUSBLWKTDSMCM-OAHLLOKOSA-N 396.560 5.331 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1cnc2ccccc2c1 470893285 XIXPLRQXDUDBCJ-INIZCTEOSA-N 375.497 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccc(OC)c(OC)c1 475567340 WKIGOQDHBQVTGN-UHFFFAOYSA-N 396.531 5.610 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C 480548285 BXAYLTOAYVVAHD-SJORKVTESA-N 386.499 5.192 30 20 GKED CC[C@@H](C)C(=O)Nc1cccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)c1 481663618 BUTILYYPBQVJDT-UZUQRXQVSA-N 375.516 5.100 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Br)c(F)c1 484751278 JRTPKHPOGOSDET-LBPRGKRZSA-N 379.298 5.452 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCCCCC(=O)C2)cc1Cl 485707560 GMYITCWGGKSEFY-UTKZUKDTSA-N 394.902 5.473 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1 487174361 DIESMUGBSYIMPV-AABGKKOBSA-N 387.310 5.648 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccccc1 487249052 GHWXWCRMBIIHIT-NSHGMRRFSA-N 387.310 5.648 30 20 GKED N#CCCC[C@H](NC(=O)c1c[nH]c2cccc(Br)c12)c1ccccc1 487390222 PHBNDSXGCKQJHC-KRWDZBQOSA-N 396.288 5.095 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)CNc1ccccc1SC[C@H](C)C#N 487400748 QKGAYTVOCNOPPW-LJQANCHMSA-N 395.572 5.098 30 20 GKED N#CCCC[C@H](NC(=O)c1coc(-c2ccccc2Cl)n1)c1ccccc1 487615904 IFNXINGAUIRPHZ-SFHVURJKSA-N 379.847 5.160 30 20 GKED Cc1cc(N[C@@H](c2ccccc2)c2cccnc2)n2c(nc3ccccc32)c1C#N 488011727 VHODMVXKWRKKJT-DEOSSOPVSA-N 389.462 5.264 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(CCC#N)CC(C)(C)C 494378118 JNMAUVCWBHGDHJ-UHFFFAOYSA-N 381.954 5.235 30 20 GKED CC[C@H](C)Sc1ccc(NCC(=O)Nc2cc(Cl)ccc2C#N)c(C)c1 498644320 FSVKJROYDUMELF-AWEZNQCLSA-N 387.936 5.461 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1Br 499181452 WMCYWQLTVSORDM-SECBINFHSA-N 397.363 5.317 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2coc3ccccc23)cc1Cl 499425916 YSOFNRLDDRZRQZ-LJQANCHMSA-N 386.838 5.994 30 20 GKED Cc1ccc(OCc2nc(CN(Cc3ccc(C#N)cc3)C3CC3)cs2)cc1 506563413 RXKCWECIXFKXIY-UHFFFAOYSA-N 389.524 5.067 30 20 GKED C[C@H](NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1)c1cccc2ccccc12 509394606 ZQZLRHCHRJDICP-SFHVURJKSA-N 399.494 5.025 30 20 GKED CCc1csc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 513198069 ZCOXKUSQWJBSQG-GOSISDBHSA-N 395.915 5.196 30 20 GKED CC(C)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CCCCC1 513238537 NHUMVBBPFUTNRH-UHFFFAOYSA-N 376.500 5.321 30 20 GKED CC(C)(C#N)C(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 515436241 KRDKKNROWPANBU-UHFFFAOYSA-N 375.291 5.089 30 20 GKED COc1ccc2oc(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)c(C)c2c1 515929364 NYGMDEFCYMLOAA-UHFFFAOYSA-N 399.406 5.061 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C[C@H](c2ccccc2)C(F)(F)F)cc1 519485121 FZJOHUFVZRMEPU-RTBURBONSA-N 388.433 5.401 30 20 GKED C=CCOc1ccc(CNCc2ccc(OCC(F)(F)F)cc2)cc1Cl 520209924 RKGDTYIHHVKPJM-UHFFFAOYSA-N 385.813 5.136 30 20 GKED C=CCN(C(=O)C[C@H](C)c1cccc(F)c1)c1nc(-c2ccccc2)cs1 522540843 JLAVMUFKYDQODH-INIZCTEOSA-N 380.488 5.662 30 20 GKED C=CCN(CC1CCCCC1)C(=O)NCc1cccc(COCc2ccco2)c1 524279269 FTXASRKDHXDPIW-UHFFFAOYSA-N 396.531 5.274 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccccc1Cl 524391351 HPVUFSRPHSNVRA-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CCSc3ccccc32)sc2c1CCCCCC2 525133614 PHSIGXDHTAUJSH-MRXNPFEDSA-N 382.554 5.497 30 20 GKED COc1cccc([C@@H]2CN(C(=O)Nc3ccc(CC#N)cc3Cl)CC2(C)C)c1 529108071 PGTDJWQOKXATMF-SFHVURJKSA-N 397.906 5.072 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3ccccc3C(C)(C)C#N)cc2)cs1 537079369 OJUOOANOQWJWAV-INIZCTEOSA-N 375.541 5.771 30 20 GKED N#CC1(CCCSc2ncnc3sc(-c4ccccc4)cc23)CCOCC1 540812439 RFOGZLWCWYIKMV-UHFFFAOYSA-N 395.553 5.551 30 20 GKED C[C@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccc(-c2cccc(C#N)c2)cc1 543861455 RFJCIJIJBAMVPN-SFHVURJKSA-N 398.510 5.170 30 20 GKED N#C[C@@H](C(=O)c1oc2ccccc2c1CSC1CCCCC1)c1ccncn1 545445715 IBQBDIJORNJMQK-QGZVFWFLSA-N 391.496 5.279 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)o1 548943961 CWWVZTBKRVZLQX-UHFFFAOYSA-N 389.455 5.011 30 20 GKED CCc1nc(C)c([C@@H](C)N(C)C(=O)c2sc3ccc(C#N)cc3c2C)s1 551408794 IDBGSJATTUINIS-CYBMUJFWSA-N 383.542 5.242 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1 555098951 MOLROZMECFUATJ-UHFFFAOYSA-N 399.416 5.003 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)C1(c2cc(F)cc(C#N)c2)CC1 561382922 SISVXMGQNYCQKT-CABCVRRESA-N 384.882 5.033 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1cccc2ccccc12 562198379 CEGFIBOJAXAEPJ-IBGZPJMESA-N 390.531 5.466 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1ccccc1OC(C)C 562255490 HSJHWMLWRZRABN-LJQANCHMSA-N 398.551 5.100 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)ns1 582645785 WMMWWLGXEWUTGR-LLVKDONJSA-N 394.308 5.372 30 20 GKED C[C@H](c1ccccc1)N(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)C1CC1 588235844 QYSJTRJLJQKPED-QGZVFWFLSA-N 398.466 5.503 30 20 GKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 589572305 NKEQHKNHCPXUQT-INIZCTEOSA-N 382.423 5.574 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCCc2cc3ccccc3s2)c(Cl)c1 590506206 TVRLEDQAPNRKMP-UHFFFAOYSA-N 375.280 5.052 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 598415484 NGRAHGAFQACMNT-HXUWFJFHSA-N 382.510 5.162 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(F)c(C(=O)OC(C)(C)C)c1Cl 599923054 SJNUAUPAHHBIER-BETUJISGSA-N 394.874 5.149 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccc(F)cc2)cc1 604359276 VWZQGKPMMVINRQ-UHFFFAOYSA-N 376.387 5.141 30 20 GKED C=CCN(C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1)c1ccccc1 607293934 QHLPCVDVAYMETF-UHFFFAOYSA-N 385.467 5.472 30 20 GKED Cc1nc(-c2ccc(CNCc3cccc(OCCCC#N)c3)cc2)cs1 608860963 BWFAZTWPPIRCRL-UHFFFAOYSA-N 377.513 5.091 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCSC[C@H]1c1ccccc1 609682419 JNBWBPGIJKCAGX-APWZRJJASA-N 397.569 5.403 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)Cc1ccc(Cl)cc1 609928096 LSPRBMFVNLLQDQ-HNNXBMFYSA-N 385.895 5.094 30 20 GKED CC[C@@H](C)[C@@H]1CCCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 610010280 HQUHRRVYNFVMFJ-BEFAXECRSA-N 382.533 5.038 30 20 GKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 610014578 BHZPBOCKQNQQHH-XMSQKQJNSA-N 375.516 5.801 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)NC2(c3cccc(F)c3)CC2)cc1 610052968 YZQDDURPOVGTLQ-UHFFFAOYSA-N 390.389 5.048 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl 610106864 ISERJRZPLYWFOT-MSOLQXFVSA-N 384.882 5.139 30 20 GKED C[C@@H]1CCc2c(sc3nc([C@@H](C)Sc4ccc(C#N)cc4F)nc(O)c23)C1 610218738 NXLDBXDHXHUGDP-GHMZBOCLSA-N 399.516 5.386 30 20 GKED COc1cccc(NC(=O)[C@@H](Sc2ccc(C#N)cc2F)c2ccccc2)c1 610218806 WODTUKYDRAGYMF-NRFANRHFSA-N 392.455 5.178 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 610355979 GJZYHAKBPVPQKA-KBPBESRZSA-N 375.394 5.041 30 20 GKED O=C(NCc1ncc(-c2ccccc2)o1)Nc1cccc(C#Cc2cccs2)c1 612890464 GBBCIGHQSKUROV-UHFFFAOYSA-N 399.475 5.125 30 20 GKED C=CCCOCc1nc(-c2ccc(Oc3cccc(Cl)c3Cl)nc2)no1 680789628 QXVCNRQNFWPKFN-UHFFFAOYSA-N 392.242 5.323 30 20 GKED C=CCC[C@H](C(=O)N(C)C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 681719464 CHMHYMHLOOIWLJ-TZRRMPRUSA-N 377.528 5.363 30 20 GKED O=C1/C(=C/c2csc(COc3ccc(Cl)cc3)n2)CCc2cc(O)ccc21 726427333 KDXINOGVRMVXGZ-NTEUORMPSA-N 397.883 5.294 30 20 GKED C#Cc1cccc(Nc2nc(-c3ccc(NC(C)=O)c(SC)c3)cs2)c1 727462546 MGDAVPPOIBEFGQ-UHFFFAOYSA-N 379.510 5.215 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)/N=C\c1cc([N+](=O)[O-])ccc1O 729149698 NXMMTSNVBJUJRV-GVHCZZSVSA-N 385.420 5.052 30 20 GKED C=C(Br)CNC(=O)[C@H](Sc1ccccc1Cl)c1ccccc1 729968683 XXWUCYLVLSAOLR-MRXNPFEDSA-N 396.737 5.198 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)ccc1N(C)C 730168684 NVQWVJLGSMHYRD-UHFFFAOYSA-N 389.430 5.116 30 20 GKED COc1ccccc1C/C(C)=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730170387 DDBFLUIJUSLIBW-SWXYAQJLSA-N 396.490 5.478 30 20 GKED C[C@@H]1CCC[C@@H](OCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 733053249 ZQRUQGOVKILUMF-BNOWGMLFSA-N 396.434 5.087 30 20 GKED N#C[C@H](C(=O)c1cc2c(F)cccc2s1)c1nc(-c2ccncc2)cs1 734082922 JCVHIEQTSSEZNN-CYBMUJFWSA-N 379.441 5.049 30 20 GKED C=CCc1cc(CNCc2ccc(-c3c(F)cccc3F)o2)cc(OC)c1OC 734511140 ZDMKUTALEYBEJJ-UHFFFAOYSA-N 399.437 5.260 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1ccc(-c2ccncc2)cc1 745192479 HKRRVVQISNNGNF-UHFFFAOYSA-N 390.796 5.652 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)Nc1cccc(C)c1 749101873 IAVZPTPONVWIGV-UHFFFAOYSA-N 393.325 5.282 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc4ccccc4n3)n2)cc1 752165815 ZIKMTADDJHBUMK-SJFMBGHLSA-N 395.487 5.556 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(C(F)(F)F)ccc2Cl)c1 753853680 KSXUEVDBOIUMPF-INIZCTEOSA-N 382.813 5.330 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 758508556 STFBMFRSMJVBCA-MWTRTKDXSA-N 394.877 5.649 30 20 GKED COc1cc(F)c(C(=O)/C=C/c2csc(-c3ccc(C)cc3)n2)cc1OC 760269279 FRCLUNRAAIQYIE-CMDGGOBGSA-N 383.444 5.171 30 20 GKED Cc1cncc(C(=O)/C=C\c2cccc(NC(=O)c3ccc(Cl)cc3)c2)c1 767368232 UGTMBCDAYQVGKF-YHYXMXQVSA-N 376.843 5.192 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cc(F)cc(C(F)(F)F)c2)S1 772808590 WNXRFHGWUFVLFT-OVCLIPMQSA-N 394.393 5.353 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc2ccccc2c1OC(F)F 772959386 LJGOWKFTTZQJQJ-OAHLLOKOSA-N 382.410 5.194 30 20 GKED C[C@@H]1CC[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 776515099 HDUNWRRLQMFIIE-JTNHKYCSSA-N 379.312 5.729 30 20 GKED C=CCc1cc(CNCc2ccc(SC(F)F)cc2)cc(OC)c1OC 781628913 CXWQNFGDPIBFSA-UHFFFAOYSA-N 379.472 5.037 30 20 GKED C[C@@H](NCc1ccc(C#N)cn1)c1ccc(-c2ccc(Br)cc2)s1 783300177 JPOVIQPKBGHVLR-CYBMUJFWSA-N 398.329 5.295 30 20 GKED CCc1cc(O)ccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 791157194 LMRUHGHAVYUWFI-UHFFFAOYSA-N 392.842 5.524 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCC(F)(F)C1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 796648503 CDSYDKULEYIHSB-PGPWEFTKSA-N 390.499 5.223 30 20 GKED C=CC[C@@H](OC(=O)C1CCN(C(=O)C(C)C)CC1)c1ccc(Cl)c(Cl)c1 797554823 YWJHSUSSIONXNN-GOSISDBHSA-N 398.330 5.048 30 20 GKED N#CC1(CCCOC(=O)c2ccc(SCc3ccccc3)cc2)CCOCC1 800142608 ZOURTZGCXIYSFL-UHFFFAOYSA-N 395.524 5.236 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4cccnc4)CCCC3)n2)cc1 808979655 KTNFEDXMPSNAHK-LJQANCHMSA-N 387.508 5.202 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2c(Cl)cc(Cl)cc2N(C)C)c1 810145344 ZSHDXSWNSINDHY-INIZCTEOSA-N 392.330 5.030 30 20 GKED N#C[C@@H]1CCC[C@H](OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)C1 839048261 CMYATEBYFSBJTD-RISCZKNCSA-N 380.391 5.068 30 20 GKED Cc1nc(F)ccc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 842733668 LNAAOUYYPUBTRQ-UHFFFAOYSA-N 384.270 5.431 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(C(F)(F)F)cc1 842943723 YNRBEWGPVMRXGU-XHDPSFHLSA-N 378.419 5.409 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3CCC(C4CC4)CC3)n2)cc1 850791972 ZAXWADLYYCFHPB-KVZIAJEVSA-N 375.497 5.074 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@@H]2c2cccnc2)s1 915311305 ATGACXCFOCDUMC-QGZVFWFLSA-N 387.553 5.205 30 20 GKED C=CCc1cc(CN2CCC[C@@H]2c2nc3ccccc3s2)c(O)c(OC)c1 915814362 XRBXNKVWDAQACD-GOSISDBHSA-N 380.513 5.076 30 20 GKED Cc1c(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Cl)oc2ccc(Cl)cc12 916907487 BFMWRZMTOYELTL-ZDUSSCGKSA-N 387.222 5.009 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(Oc3ccccc3)c2)cc1 916910339 OZFMUJOHJREQNC-QFIPXVFZSA-N 384.435 5.002 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccccc2Cl)cc1 916912958 KTAOUZXBWHRNAZ-KWRJMZDGSA-N 380.875 5.043 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3[nH]c(C)c(C)c3c2)cc1 916947006 CSFPDTNDJVVIAJ-LHSJRXKWSA-N 387.483 5.259 30 20 GKED CC(=NN=C1c2ccccc2-c2ccccc21)c1cccc(OCCCC(=O)O)c1 1776027673 XNCPQQJLVMOOIK-UHFFFAOYSA-N 398.462 5.172 30 20 GKED Cc1c(NN=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)cccc1C(=O)O 1776086242 JEHMFPXCPJFUGG-UHFFFAOYSA-N 389.238 5.706 30 20 GKED Cc1cc(NN=Cc2cccc(OCc3ccccc3C(=O)O)c2)ccc1Cl 1776104510 KFHUJCCQPCXZQF-UHFFFAOYSA-N 394.858 5.372 30 20 GKED C=C(C)COc1cc(/C=C/c2cc(C(=O)O)c3ccccc3n2)ccc1OC 1776140062 KMONDSGVHFQECB-CSKARUKUSA-N 375.424 5.067 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2cc(C(=O)O)cs2)c2c(c1)C(C)(C)CC2 1776269175 ABIMBMSWSOIFSS-SREVYHEPSA-N 382.525 5.864 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cs1 1776380545 UYJNIKHDWATBKZ-XFXZXTDPSA-N 377.465 5.528 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(Cl)cccc1OC(F)F 1776783286 MNXZPBHSNFCKMQ-ZDUSSCGKSA-N 377.859 5.235 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 47565577 JXCKPADUVHZGEE-IBGZPJMESA-N 395.915 5.721 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)CCc1ccc(OC(C)C)cc1 59849301 FHNWUJQGVDKIPR-SFHVURJKSA-N 386.561 5.254 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 64565200 SMHUXGKKOSJOTN-UHFFFAOYSA-N 392.846 5.063 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)COc1ccccc1-c1ccccc1 65839291 LJWPZPGLJXUZED-UHFFFAOYSA-N 386.451 5.030 30 20 GKED N#C[C@H](C(=O)[C@@H](Oc1ccc(Cl)c(Cl)c1)c1ccccc1)c1ccccn1 107408743 FGKNHEGWIMZJNK-KKSFZXQISA-N 397.261 5.385 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 120787250 PHSSOHVIYAKYCW-AEFFLSMTSA-N 378.501 5.247 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(-c3ccccc3)o2)nnc1-c1cccs1 123153992 GSTPIAWAGDVQCQ-ZDUSSCGKSA-N 395.513 5.096 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)F)cc1)c1nc(-c2ccncc2)cs1 128824572 MYUBSSMIBLZTDD-AWEZNQCLSA-N 387.436 5.010 30 20 GKED N#CCCCOc1cccnc1NC(=O)CCCc1cc(Cl)sc1Cl 150889047 XQPNEPHWIQSRHW-UHFFFAOYSA-N 398.315 5.094 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1)c1ccccc1 155770875 MPYNFWKCTAWXCO-QHCPKHFHSA-N 393.531 5.273 30 20 GKED CC(C)CN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@H]1CCCc2cccnc21 164583222 HKOYOWWPVJRQBG-YADHBBJMSA-N 390.531 5.172 30 20 GKED CC(C)[C@@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 178392142 MVBKQJKHXHVMBW-KSFYIVLOSA-N 399.535 5.145 30 20 GKED Cc1nc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(-c2ccccc2)o1 184778895 SORWIXNIYACGSN-CQSZACIVSA-N 377.469 5.154 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)O[C@H](c2ccc(F)cc2)C1 191461586 SOAXCQPZJGCTAJ-VGSWGCGISA-N 396.506 5.672 30 20 GKED N#CC1(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)CCCCC1 303043914 UBSIPQLKZOVGBK-UHFFFAOYSA-N 375.497 5.300 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 303336197 XOGDJLMYNVCMLE-DLBZAZTESA-N 396.556 5.642 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H]1CCCC[C@@H]1C(C)(C)C 303412101 VAGRPSYXTYGJTE-SQNIBIBYSA-N 387.593 5.071 30 20 GKED C/C(O)=N/C1(c2noc(-c3csc(-c4ccccc4C)n3)n2)CCCCC1 329225040 FWVHYNZPOFRRBK-UHFFFAOYSA-N 382.489 5.304 30 20 GKED O/C(=N/[C@@H]1CCOc2c(F)cccc21)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329483859 SCMCGCGYTOAUHZ-OXJNMPFZSA-N 397.494 5.113 30 20 GKED OC(=Nc1ccc(OC2CCCC2)c(F)c1)C1CCC(/N=C(/O)C2CC2)CC1 329991495 ADEZYZPSIZVINY-UHFFFAOYSA-N 388.483 5.660 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCN(c2ccncc2C)CC1 365157874 UBIZKFSUSBSBGL-UHFFFAOYSA-N 377.532 5.097 30 20 GKED CC(C)c1ccc2ncc(C#N)c(N3CCC[C@H](c4ncc5n4CCCC5)C3)c2c1 409642425 WCRXCIANKHUCPN-IBGZPJMESA-N 399.542 5.147 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(OC(F)(F)F)cc1 410245601 CXRVWPAWTAMVHL-CYBMUJFWSA-N 391.393 5.269 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(OCc2c(C)noc2C)c1 410344145 IKTMPTXBWSTYPF-UHFFFAOYSA-N 376.456 5.241 30 20 GKED C=CCC1(C(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)CCOCC1 424641775 NZSOUEWMLLTAKL-IBGZPJMESA-N 379.500 5.446 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NC[C@@H]2CCC(F)(F)C2)c1 431107437 KMHHHBOCBNHTOR-CYBMUJFWSA-N 390.817 5.169 30 20 GKED CCCCN(CC(=O)Nc1ccccc1SCC#N)[C@@H](C)c1ccccc1 434895436 KJEPRKYRRPDUHL-SFHVURJKSA-N 381.545 5.104 30 20 GKED CCCCn1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 435741837 QVIWLSHEJVABJB-MRXNPFEDSA-N 398.919 5.259 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)Nc1ccccc1S[C@H](C)CC#N 435856381 NIZVYIJAFAZLGM-SJORKVTESA-N 390.508 5.640 30 20 GKED N#Cc1ccc(F)c(CNC(=O)Nc2cccc(Cl)c2SCC(F)F)c1 438331136 MQEAMISKYQBINY-UHFFFAOYSA-N 399.825 5.030 30 20 GKED COc1ccc2occ(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 442534791 YRTBKPYNTNTQBA-ZDUSSCGKSA-N 382.828 5.195 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CC(C)(C)CC(=O)c1ccccc1 442750897 JVXGDAYNXQTZNK-KRWDZBQOSA-N 394.540 5.566 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)n1 447610433 RHHGBTIVJZNAPJ-CQSZACIVSA-N 380.435 5.596 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccc(-c4ccc(Cl)s4)cn3)CC2)cc1 448513078 DELHKUBVTHDBOO-UHFFFAOYSA-N 379.872 5.005 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)[C@]1(C#N)C[C@@H]1C 450004787 SQRAHHWYRNVWOU-WNSKOXEYSA-N 390.462 5.220 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1F 455123723 GBAQTCYSKPSQIG-LJQANCHMSA-N 387.430 5.309 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1)c1ccccc1 458797736 GPVZBUMLGIUQAL-NHCUHLMSSA-N 381.907 5.622 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c1 460171849 MKLJQQBCTHGTAF-UONOGXRCSA-N 397.208 5.209 30 20 GKED CC#CCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 464551790 JPAKIJVZVXKJDZ-UHFFFAOYSA-N 376.525 6.278 30 20 GKED C=CC[C@@H]1N(C(=O)c2cccc(OCc3c(C)noc3C)c2)CCCC1(C)C 470281775 AWMWRPAVVZCWAU-NRFANRHFSA-N 382.504 5.077 30 20 GKED C=C(C)[C@H](NC(=O)N(c1ccccc1)c1ccccc1)c1ccc(F)c(F)c1 476201166 HPBFQOKKFALSGR-QFIPXVFZSA-N 378.422 6.130 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC(C3CCCC3)C2)cc1 477921316 WXYDKQHFWOWHCI-UHFFFAOYSA-N 376.525 5.113 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)c(F)c1 481606079 QFBWDYXEQAOMGS-KPZWWZAWSA-N 389.833 5.636 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CC(C)(C)C(F)(F)F 483286164 MUBIRWONBCHEAS-UHFFFAOYSA-N 392.396 5.518 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)cc2)nnc1-c1ccccc1OC 497663134 IZSDRGWMAQTVTC-AWEZNQCLSA-N 385.920 5.646 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 497800848 VINKCGPIJZWVMF-QHCPKHFHSA-N 392.499 5.008 30 20 GKED N#Cc1ccsc1C(=O)Nc1sc2c(c1C(=O)c1cccs1)CCCC2 497988792 NBYCAIACUCPNCQ-UHFFFAOYSA-N 398.534 5.105 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(F)cc1OCCC(F)(F)F 500221086 YBAIXXODDFXCFV-UHFFFAOYSA-N 399.409 5.687 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3c3ccc4ccccc4c3)CC2)cc1 503843784 TXPZDLAIWQIAMR-JWQCQUIFSA-N 378.475 5.131 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1CCC(F)(F)CC1 505366111 KDFJARGPKCMIMS-GFCCVEGCSA-N 389.286 5.251 30 20 GKED CC[C@H](CC1CCCC1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 510042876 OHUOHBPERJDRPJ-GOSISDBHSA-N 377.488 5.599 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1cc2c(ccc3ccccc32)o1 510548236 ASAWRNCQHFEKQQ-UHFFFAOYSA-N 386.476 5.773 30 20 GKED C[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(C#N)cc1F 512616307 AFSAIQPDLAJASJ-ZDUSSCGKSA-N 377.444 5.418 30 20 GKED N#Cc1cnc(N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c(Cl)c1 513624071 IQKXGHCHLSAYEF-OAHLLOKOSA-N 384.867 5.359 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)oc2c1ccc1ccccc12 513686770 FTHOIVSFQPVDRD-QGZVFWFLSA-N 382.444 5.994 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1ccc(C#N)cc1 517887791 WPOVLVLTESZRLA-GOSISDBHSA-N 387.458 5.170 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cccs1 518681983 OBKQQYQGYVMKNC-RDJZCZTQSA-N 387.574 5.909 30 20 GKED N#Cc1c(NC(=O)Cc2c[nH]c3ccc(Cl)cc23)sc2c1CCCCC2 523510228 YRCRXRKPTDCOAS-UHFFFAOYSA-N 383.904 5.205 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C1CC1 534224971 VVIAYVQJQBAYGN-NSHDSACASA-N 391.397 5.266 30 20 GKED CC(C)c1oc([C@@H]2CCCN2Cc2ccc(C#N)s2)nc1-c1ccccc1 539819641 OOZBUZRSOYOXCA-IBGZPJMESA-N 377.513 5.735 30 20 GKED C[C@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)c1cc(F)c(Cl)cc1Cl 540693002 VKELKZRQUTUAJU-NSHDSACASA-N 377.246 5.179 30 20 GKED Cc1cc2ncc([C@H](C)N[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)c(C)n2n1 542106332 KQPQTSUBZIZFOO-MSOLQXFVSA-N 395.510 5.297 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cc(Cl)ccc2C(F)(F)F)c1 572758062 HVQPLWUMFPFLEI-UHFFFAOYSA-N 396.796 5.418 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)C1 575967381 ONOLCMCVQJQLBN-WBAXXEDZSA-N 379.426 5.024 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](CC(F)(F)F)c2ccccc2)c1 589740330 RFBAEMJXZQFLMA-GOSISDBHSA-N 378.394 5.457 30 20 GKED Cc1nn(-c2ccccc2)c(CSc2nc3ccccc3n2C(F)F)c1C#N 591599709 DWNKPGXENRICQL-UHFFFAOYSA-N 395.438 5.090 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1OCC 592973801 HQSKEENGABOKEQ-OAHLLOKOSA-N 398.459 5.113 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CSC[C@H]1c1ccccc1 593059762 WSIFAOVNRRAOBG-BPQIPLTHSA-N 382.554 5.024 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(-c3ccc(Br)s3)s2)C1 597905570 GCNHGNVYXQVOMF-NSHDSACASA-N 395.347 5.005 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)C1 597914498 GLSDRVUJGBSHDV-XMGGNUPJSA-N 397.478 5.080 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC(c4ccco4)CC3)cc2)cc1 597926160 QNMOMURTFMVDLQ-UHFFFAOYSA-N 386.451 5.158 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1 601184696 MAXKPRFFVKXELK-DEOSSOPVSA-N 381.479 5.159 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)Nc3ccc(C(C)(C)C#N)cc3)c(C)c2c1 609294375 STGAPAGJMQMGQD-OAHLLOKOSA-N 391.471 5.434 30 20 GKED COCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](C)c1ccccc1 609438908 NUZHBUFYWMZQIA-ROUUACIJSA-N 397.544 5.322 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 609566861 SKOFDGWRCYWWHD-HXUWFJFHSA-N 397.478 5.018 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1c(Cl)cccc1Cl 609580248 PLGULMHESLQUPO-QWHCGFSZSA-N 393.339 6.130 30 20 GKED CC[C@H](CC(=O)N[C@H](C#N)c1ccccc1Br)c1ccc(C)cc1 609994007 IXWOTUWLULHXBO-DNVCBOLYSA-N 385.305 5.022 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)c1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 610218739 NXLDBXDHXHUGDP-MNOVXSKESA-N 399.516 5.386 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(Br)cc1)c1ccc(C#N)cc1 612574839 KEQBMYMLTWDSBQ-PXAZEXFGSA-N 397.238 5.665 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)oc2ccc(F)cc12 613403781 TYEIZAMEEGNWBB-CYBMUJFWSA-N 384.819 5.634 30 20 GKED COc1cccc(NN=Cc2c(C)nn(Cc3ccc(Cl)cc3)c2Cl)c1 725853242 PJHAQBHGRXFGNU-UHFFFAOYSA-N 389.286 5.001 30 20 GKED CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726488423 VBPDGXADYMBDQD-XLIONFOSSA-N 399.947 5.008 30 20 GKED CCc1c(C)sc(NC(=O)c2cnc(-c3ccccc3Cl)s2)c1C#N 727790456 JNPBZADQHWLMDW-UHFFFAOYSA-N 387.917 5.520 30 20 GKED C#Cc1ccc(C(=O)N(Cc2ccc(Cl)cc2)[C@@H](C)Cc2cccs2)cn1 728804056 SZBKRLSGMLXVLQ-INIZCTEOSA-N 394.927 5.051 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1cccc(OCCCC#N)c1 729827663 RVKXTODXWRDAAH-JKGDOXCYSA-N 378.472 5.198 30 20 GKED C=C(C)CN1CCC(NCc2sc(Sc3ccccc3)nc2Cl)CC1 730017396 GTVWDJOBNUIREU-UHFFFAOYSA-N 394.009 5.078 30 20 GKED CC(=NNc1cnnc(O)c1Cl)c1ccc(-c2ccc(Cl)cc2)s1 730568632 SUKCEAIBYLPOSM-UHFFFAOYSA-N 379.272 5.054 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(Cc2ccccc2)CC(C)(C)C)c1 733805464 CFDJOCUFZCHICK-OAQYLSRUSA-N 393.531 5.125 30 20 GKED C=CC[C@@H](NC(=O)NCC1(c2ccc(Cl)cc2)CCCC1)c1ccncc1 734664446 RARCCGNSVGEFFT-HXUWFJFHSA-N 383.923 5.163 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744017187 ZOGYTCAQMMARCI-TZMCWYRMSA-N 388.414 5.685 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCO[C@H](c2cccc(C#N)c2)C1 761756425 HTWXCMULEJGSQP-VFNWGFHPSA-N 393.874 5.001 30 20 GKED Cc1nc([C@@H](C)OC(=O)/C=C/c2ccccc2C#N)oc1-c1ccc(Cl)cc1 763907816 GTTJRLZXSXMXJA-SAAWKEMMSA-N 392.842 5.493 30 20 GKED C[C@@H](OC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1cccc(C#N)c1 764603889 FBFODVYHMIWVJJ-KLVRIXIASA-N 377.406 5.311 30 20 GKED Cc1cc(Br)cc2c(C(=O)Nc3ccccc3O[C@H](C)C#N)coc12 770013739 DZCIIHQFXLTLHT-GFCCVEGCSA-N 399.244 5.047 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCOc3ccc(C(C)C)cc32)c1 772982323 CRJIIUQTYNLIIP-REWPJTCUSA-N 378.516 5.494 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccccc1 773076373 NCBBXRKANPYSJU-CVDCTZTESA-N 375.516 5.298 30 20 GKED C#CC[C@@H](OC(=O)c1csc(-c2cccc3ccccc23)n1)c1ccccn1 778300174 DDZUHDWIWWOMMA-OAQYLSRUSA-N 384.460 5.280 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(Cl)cc2F)cc1 779396181 BQRSTYYKGLIBBV-HXUWFJFHSA-N 393.849 5.456 30 20 GKED Cc1ccc(/C=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 779472155 SKDWPFFTMNEBLY-ZDKIGPTLSA-N 387.870 5.351 30 20 GKED CC(C)c1sc(NC(=O)c2ccccc2SCC#N)nc1-c1ccccc1 780445628 ZJYLUORPGWEWQH-UHFFFAOYSA-N 393.537 5.801 30 20 GKED N#CC1(COC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)CCCC1 780533407 UWZOKRVROSOFDU-UHFFFAOYSA-N 393.270 5.208 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1 780675299 PLCDLHMHPIXXNI-VQTJNVASSA-N 399.494 5.773 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(-c3ccc(F)cc3)o2)c2ncc[nH]2)c1 787169466 OEYZOGALKAWDIB-XSFVSMFZSA-N 388.398 5.241 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 787431484 NQBDIZKBBLEUTR-PMACEKPBSA-N 399.416 5.111 30 20 GKED COc1ccc(-c2nc(/C=C3\CSc4ccc(F)cc4C3=O)cs2)cc1 797127183 UTRXUTMQJWLLPN-MDWZMJQESA-N 383.469 5.330 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccccc2SCc2ccccc2)CC1 799382775 UEINEKCCZVDIOB-UHFFFAOYSA-N 379.529 5.430 30 20 GKED C#CC[C@H](Cc1ccccc1)NC(=O)c1sc(-c2ccccc2)nc1C(F)F 803520417 LWKCMIATUIPQFO-QGZVFWFLSA-N 396.462 5.112 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835073095 KDWCEFOQMUSRHD-WCBMZHEXSA-N 394.340 5.470 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 915180227 MAHVVCJLNCOLLE-SFHVURJKSA-N 391.814 5.156 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccc(F)cc3)CCC2)cc1 915181091 XCPLLBKDKOSWGY-QHCPKHFHSA-N 384.454 5.542 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2c(F)cccc2s1 916917223 GKKPLBCGGBDPIE-INIZCTEOSA-N 388.423 5.155 30 20 GKED C=CCCC[C@H](NCc1ccc(Cl)cc1Oc1ccc(C)cc1C)C(=O)O 1776171146 VYPZNPURJLGZMU-IBGZPJMESA-N 387.907 5.648 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)s1 1776339941 RWICKWNLKJKWJV-TWGQIWQCSA-N 396.533 6.269 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCCCCC)cc1 1776784793 WQQXIWJLHRZNBZ-OAQYLSRUSA-N 377.569 5.939 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(C(=O)O)s1 1777487779 SKGSFOQEXRQPRW-SOFGYWHQSA-N 389.885 5.428 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H]3CC=C(C)CC3)cc2)CCC1 1789115125 UDVYKQVYDQRWRY-RBUKOAKNSA-N 380.532 5.079 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 7202359 RUDFXEFJMMWWOC-AWEZNQCLSA-N 385.924 5.249 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 21841175 IZOHNZAULBIITG-UHFFFAOYSA-N 394.883 6.000 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccn1 49457109 CTCYCVHNFKVQRA-ZRUQZJFASA-N 384.279 5.009 30 20 GKED COc1ccc(CN[C@H](C)c2ccccc2C(F)(F)F)cc1OCCCC#N 64614308 KGDGKDAKNRVRCM-OAHLLOKOSA-N 392.421 5.247 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2cccc(F)c2)C1 66954357 IATHNZGPWHLGGL-DOTOQJQBSA-N 383.492 5.241 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 97599213 FWCVVIAGDVZFJR-UHFFFAOYSA-N 396.947 5.679 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1ccccc1F 108147821 IGRJKQKQJRKGDX-HUUCEWRRSA-N 388.533 5.510 30 20 GKED CC(C)(CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 119618432 HORBFEBOKLSNEV-HNNXBMFYSA-N 389.282 5.009 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)[C@H]1CCC[C@H](C(F)(F)F)C1 130987849 PMUBXWYWCHVAAP-SGMGOOAPSA-N 385.323 5.304 30 20 GKED CSc1ccc(O[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 131854915 USZXFSXCEZSWRZ-LSDHHAIUSA-N 386.542 5.209 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1c[nH]c2ccc(Cl)cc12 151865977 XFVIGRKYYVRELD-CYBMUJFWSA-N 383.904 5.397 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(C)ccc2F)cs1 160614460 HGADJAXTKPFTOQ-YRNVUSSQSA-N 394.471 5.480 30 20 GKED N#CCC[C@@H](Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccccc1 164276215 KXNYIKQAXVWPPN-MRXNPFEDSA-N 383.377 5.014 30 20 GKED COc1ccc2sc(C(=O)Nc3cccc(OCCCC#N)c3)c(C)c2c1 172838977 ZULJPCRDGFXQOV-UHFFFAOYSA-N 380.469 5.153 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n(C)n1 173308995 DACQXKYGPBMCSZ-SFHVURJKSA-N 392.890 5.105 30 20 GKED COc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 175116950 DDRUZVAZMYFPKR-BEFAXECRSA-N 376.481 5.189 30 20 GKED C[C@H]1CCC[C@@H](C)CN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 175373971 RFQHLCNFMFDSHA-MOPGFXCFSA-N 391.515 5.374 30 20 GKED COc1cccc(C(=O)/C(=C/c2ccc(-c3ccncc3)cc2F)c2ncc[nH]2)c1 188751543 IYJAPCPMLDYMRX-STZFKDTASA-N 399.425 5.043 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCSc1ccc(OC)c(OC)c1 189883417 NDRMTARKMCFYBN-UHFFFAOYSA-N 399.556 5.677 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H]1OCCc2ccccc21 303593605 IJHXNANTTOGPPG-XMMPIXPASA-N 398.462 5.302 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Cl)c(Br)c2)cc1 319056032 MTFPQGHQIDMXNS-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CC1CCN(C2CCC(/N=C(/O)C(C)(C)Cc3nc4ccccc4[nH]3)CC2)CC1 328674946 QJNJVPFFTWBDJK-UHFFFAOYSA-N 396.579 5.131 30 20 GKED N=C(O)N1CCC[C@H]1/C(O)=N/[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 329170330 JYXKPGFWEPMEPU-OIISXLGYSA-N 397.441 5.035 30 20 GKED C[C@H](/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1cc2ccccc2o1 329498847 JVYQGFQUCMAYST-KXBFYZLASA-N 377.488 5.882 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329522335 RCPQAAOHMAXLDJ-ORAYPTAESA-N 389.446 5.078 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(SCc2csc(C)n2)cc1 410366190 LNVGJOQBLIAWRI-UHFFFAOYSA-N 394.565 6.115 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1O[C@H](C)C(F)(F)F 425674112 OUUMEBMKAKDAOX-ZIAGYGMSSA-N 391.393 5.113 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 429060602 BAUUXJHJHRAAJI-UGSOOPFHSA-N 376.287 5.399 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1Cc1ccccc1)c1ccccc1 432739138 WOJMTIKGNOPQNW-QHCPKHFHSA-N 383.495 5.834 30 20 GKED Cc1cc(C)c(NC(=O)CCCN[C@H](CCCC#N)c2ccccc2)c(C)c1 433019610 OWNBPSIKWWIZCA-JOCHJYFZSA-N 377.532 5.355 30 20 GKED C[C@H]1[C@@H](c2ccccc2)c2ccccc2CCN1C(=O)Nc1ccc(CC#N)cc1 435666837 CODILDDWWQQQBO-DFBJGRDBSA-N 395.506 5.363 30 20 GKED CCOc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1Cl 437756853 IWWGXPIUROHMKR-MJGOQNOKSA-N 383.879 5.042 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2ccc(O)cc12 440947679 ZNFHNHIECAQZBM-UHFFFAOYSA-N 396.471 5.821 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 446509986 GFLFJHOZSMFECK-UHFFFAOYSA-N 399.450 5.051 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1)c1ccccc1 458843484 POVHDRRZYDKKAA-TZIWHRDSSA-N 381.907 5.274 30 20 GKED CC[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 464112298 RWODOFYWRMKFBB-CYBMUJFWSA-N 384.888 5.410 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1Oc1ccncc1 464476735 QPLPRDYKUTZLEJ-QGZVFWFLSA-N 397.356 5.086 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3cccc4cc[nH]c34)cc2)c1 466567022 MRBRSFIBCYUPQW-UHFFFAOYSA-N 382.423 5.154 30 20 GKED C=C(C)C[C@@H](C)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 466762556 BLJKRWOSCRHVEH-CQSZACIVSA-N 378.394 5.111 30 20 GKED CC#CCCCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 467825493 PLRVMXBUJOQVPV-UHFFFAOYSA-N 390.533 5.801 30 20 GKED C[C@H](NC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1ccc(C#N)cc1 467923127 PHALPCYNKJRNKI-INIZCTEOSA-N 396.450 5.173 30 20 GKED N#CC[C@@H](CC(=O)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1)c1ccccc1 474899531 CQCMQQMHHBPWBC-IBGZPJMESA-N 387.458 5.010 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccnc(O[C@@H](C)CC)c1 475560818 JQSLGZCFSOGUMZ-KRWDZBQOSA-N 381.520 5.433 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)C[C@@H](CC#N)c1ccccc1 476132805 DXOKLHAIEHURKZ-XMMPIXPASA-N 383.495 5.185 30 20 GKED COc1cccc([C@H](NCc2ccc(C#N)c(F)c2)c2ccccc2Cl)c1 479453477 NFQDTIDMRHCHLB-QFIPXVFZSA-N 380.850 5.239 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1nc(-c2ccc(CC)cc2)no1 486403063 FRCQMBWPPSACJQ-OAHLLOKOSA-N 393.512 5.068 30 20 GKED C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NCc2ccccc2C(C)(C)C#N)C1 486440549 BOQDUFBFMSQKJE-KDURUIRLSA-N 389.543 5.218 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)N(Cc1ccco1)c1ccccc1C#N 500993065 CKBADMFSQGKKNE-INIZCTEOSA-N 394.858 5.114 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1 503115966 JWYZZMVMOQZTBZ-INIZCTEOSA-N 398.482 5.198 30 20 GKED C[C@H]1CCC[C@H](NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 505156951 PXNYGXOTETTZMT-PXNSSMCTSA-N 377.488 5.032 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)o1 505354177 UYRMVEFPFSLQQP-JNCYCUAHSA-N 398.462 5.048 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)c1 505928440 OCRCOZINWPCZIN-UHFFFAOYSA-N 390.830 5.108 30 20 GKED CCN(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)[C@H](C)c1ccc(C#N)cc1 506758975 NSDJWTGQAHGITK-GOSISDBHSA-N 397.478 5.034 30 20 GKED N#CC1(CCCSCc2ccc(OCc3ccc(F)cc3)cc2)CCOCC1 507695275 RKOLRLQBEITAEW-UHFFFAOYSA-N 399.531 5.738 30 20 GKED C=CCOc1cccc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)c1 510050082 NVUBPVGHAISAPO-UHFFFAOYSA-N 384.888 5.210 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCCC[C@H]1C 512559901 NSPBKECMDMNVOU-GOSISDBHSA-N 377.488 5.242 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 513174880 ACUCVXJECPAPTN-SFHVURJKSA-N 395.384 5.358 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(-c2ccccc2Cl)n1 518122976 GWPIJWBXNJMYQH-UHFFFAOYSA-N 399.928 5.722 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3sccc3Br)cc2)c1 519509096 ZBGFSFUOWCMUBZ-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(C3CCCC3)n2)n1 520165564 MQLHMZXZIMTCGE-UHFFFAOYSA-N 383.464 5.687 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)N[C@@H](C)c1ccc2ccccc2c1 525116295 SZLJGFIVSPOLQT-GJZGRUSLSA-N 378.472 5.209 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NCc1ccc(C#N)cc1F 532566804 FJBQGUCSDPYJPG-ADLMAVQZSA-N 391.309 5.033 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCOc2cc(Cl)ccc21 539406877 FSHYCSCDDAXAQT-FQEVSTJZSA-N 397.906 5.047 30 20 GKED C[C@H](NCc1cnn(-c2ccccc2)c1)c1ccc(-c2cccc(C#N)c2)cc1 542186265 UKEKOYIHKCBRQF-IBGZPJMESA-N 378.479 5.262 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 546190347 VXWLWZIWMUCLNV-AUUYWEPGSA-N 389.421 5.316 30 20 GKED C[C@H]1C[C@H](c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCO1 547218446 MXJNXYSIOMNDMF-UONOGXRCSA-N 395.846 5.336 30 20 GKED C=CCn1c(S[C@H](C)CCC#N)nc2scc(-c3ccccc3)c2c1=O 551392261 KWJPNHLTZNXTEP-CQSZACIVSA-N 381.526 5.095 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(CCC(C#N)(c2ccccc2)c2ccccc2)C1 554265652 UJVGNXMQVJZXMR-BWKNWUBXSA-N 381.523 5.364 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC1(c2cccc(C#N)c2)CC1 556607913 INKJEHKIXKVAPW-OAHLLOKOSA-N 377.488 5.469 30 20 GKED CC(C)c1ccc([C@H](NCc2cnc3ccc(C#N)cn23)c2cccs2)cc1 560244394 WOQUYDNYABCSFI-QHCPKHFHSA-N 386.524 5.270 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccc([C@@H]2CCOC2)cc1 564778047 YWXRNDUMJSTILC-NVXWUHKLSA-N 381.501 5.086 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1nc(-c2ccccc2)cs1 571215999 APCQSDXICFPRHF-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(C)[C@@H]1CCCc2ccccc21 574386652 DEHCIHRIPMWESJ-DYESRHJHSA-N 393.556 5.029 30 20 GKED C=C(C)[C@H](Cc1nc(-c2ccnc(Oc3cccc(CC)c3)c2)no1)OCC 579417694 NIVIYIHASSGMTH-IBGZPJMESA-N 379.460 5.010 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 584873215 YUARGBHACJPMBU-AWEZNQCLSA-N 393.434 5.403 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C3(C#N)CC3)cc2)c1 602760661 QDMPOZUWBWCOTF-QHCPKHFHSA-N 379.463 5.321 30 20 GKED CSCc1c(C(=O)N(CC(C)C)c2ccc(C#N)cc2)oc2ccccc12 603529000 LFYDWOAUEHEMKB-UHFFFAOYSA-N 378.497 5.470 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 608891619 AEYFFRMVTCIZSU-IBGZPJMESA-N 381.907 5.649 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)c1sccc1C#N)C1CCCC1 609064990 WMILFMMFZYJNAK-UHFFFAOYSA-N 390.508 5.367 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c(Cl)c1 609125509 HFEFQILDTBJQLD-UHFFFAOYSA-N 376.843 5.873 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3ccc(C4CCCCC4)cc3)CC2)c1 609185350 KZZKLBCMRXPVCU-UHFFFAOYSA-N 388.511 5.290 30 20 GKED C[C@H](Oc1ccccc1NC(=O)[C@@H](C)Oc1ccc(C#N)cc1)c1ccccc1 609652332 OPXBKLWPDJOLJS-ZWKOTPCHSA-N 386.451 5.104 30 20 GKED CCCn1c(S[C@H](C)c2ccc(C#N)cc2)nnc1-c1ccc(Cl)cc1 609813543 KPSDQUYYIORVBD-CQSZACIVSA-N 382.920 5.733 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@@H](CC3CC3)c3ccccc3)cc2)nc1 610236439 WAOKQSRNCBPTFA-QFIPXVFZSA-N 383.451 5.017 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 610357257 JODSARQIKKRYSU-KSFYIVLOSA-N 389.886 5.361 30 20 GKED N#Cc1ccc(NC(=O)c2cccnc2Sc2ccccc2)cc1C(F)(F)F 610388489 QRKJIDIWUVQGQZ-UHFFFAOYSA-N 399.397 5.376 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 610436949 KIILNGLZPJUYLI-UHFFFAOYSA-N 395.450 5.231 30 20 GKED CN(C(=O)c1csc(-c2cccc3ccccc23)n1)c1ccc(C#N)cc1F 611492930 KTEBGABSOSYKSP-UHFFFAOYSA-N 387.439 5.251 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cn1)c1ccccc1 613289603 SSXSKVBCXJWSHG-QAPCUYQASA-N 399.475 5.321 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)CCc2ccc(C)c(Cl)c2)cc1 619210329 DDCNWLOQXOIWDL-UHFFFAOYSA-N 396.918 5.034 30 20 GKED C=CCCOCCCCC(=O)Nc1ccccc1-c1nc2ccc(C)cc2[nH]1 650185716 RQHSXOXJHGLANT-UHFFFAOYSA-N 377.488 5.240 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(CC(=O)Nc2cc(C)ccc2C)n1 661115260 AWZFWALUEPKWRY-UYAOXDASSA-N 397.588 5.166 30 20 GKED C=CCC[C@H](NC(=O)N(C)C[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 676423446 VKSSDUSWOYWMCE-TZRRMPRUSA-N 392.543 5.503 30 20 GKED Cc1ccccc1C1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 726696400 PLVIFTBLZXXBFA-QHCPKHFHSA-N 395.506 5.504 30 20 GKED CC(C)[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1 728766715 HJTYOIYKUDOUAC-YADHBBJMSA-N 384.479 5.317 30 20 GKED N#CCn1c(C(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc2ccccc21 729374711 WBBLQGFDQJFZSY-IBGZPJMESA-N 397.400 5.161 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)n1 730072304 TVINFWQLTGMOSC-KXBFYZLASA-N 398.940 5.815 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccccc2CCc2ccccc2)c1 733775428 URWCXLYZGAMUTR-HSZRJFAPSA-N 398.506 5.083 30 20 GKED CC[C@H](NC(=S)N(Cc1ccccc1)c1ccccc1C#N)c1cccs1 734377990 OZTAVIVHUHSPNC-IBGZPJMESA-N 391.565 5.652 30 20 GKED CCc1cccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c1 739436448 CPGQGFHQUQGNDG-UHFFFAOYSA-N 377.538 5.336 30 20 GKED CC[C@@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1nc(C)cs1 740060029 NYCQSOZXXJDZML-QGZVFWFLSA-N 396.541 5.002 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2c(C#N)c3n(c2C)CCC3)cc1 741467716 QDBLCKTWAJRPJY-SDNWHVSQSA-N 382.463 5.186 30 20 GKED Cc1cccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743036479 MSDXFACQSUEYJE-UHFFFAOYSA-N 377.444 5.607 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc2c3c(cccc13)CC2 743056667 JEBYEHPAOMEWJI-AWNIVKPZSA-N 378.431 5.417 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccc(C#N)cc1 743475702 WWXOJNGRQJHDDL-INIZCTEOSA-N 387.870 5.835 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(C)noc2C(F)(F)F)s1 746151365 GRQFNASBULGINT-UHFFFAOYSA-N 390.431 5.009 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2OCC2CC2)cc1 751085614 XMWUILABSLDEOO-QHCPKHFHSA-N 382.463 5.383 30 20 GKED C[C@H]1/C(=C/c2cnc(-c3ccncc3)s2)C(=O)c2cccc(Br)c21 753144946 RRZRHTZDRQLYIG-GPILYODUSA-N 397.297 5.351 30 20 GKED COCCC1(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCCC1 761048531 OARSLCFYCWFDMS-CYBMUJFWSA-N 396.434 5.088 30 20 GKED CCO[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 761049742 QHUNOWMAVWASGU-YJBOKZPZSA-N 376.909 5.091 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 767585813 MEXDIKDDVKROJD-RPBOFIJWSA-N 395.506 5.711 30 20 GKED CC(C)Oc1ccc(-c2nc(C(=O)OCCCCC(C)(C)C#N)cs2)cc1 768673765 VRIIHSFHZHBWSY-UHFFFAOYSA-N 386.517 5.474 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)c1 772984185 MTILYYQIQINGJQ-OXQOHEQNSA-N 390.405 5.043 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)OCc1ccc(CC#N)cc1 776114359 OIRVEPUQQQHDKS-UHFFFAOYSA-N 392.480 5.007 30 20 GKED C[C@H](N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 777655661 HPPRIFLSXCDFBZ-AOMKIAJQSA-N 391.515 5.633 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3cccc(F)c3)s2)C(=O)c2ccccc2C1 778519602 JFFAQJJFXLDZRR-PDGQHHTCSA-N 391.467 5.183 30 20 GKED CSc1ccc2cc(CNc3ccccc3O[C@H](C)C#N)c(Cl)nc2c1 779745997 LSQGDQBCGASRJM-CYBMUJFWSA-N 383.904 5.513 30 20 GKED CCCOc1c(Cl)cc(CNc2ccccc2O[C@H](C)C#N)cc1OCC 779989745 ZAQOLFSSBMUFAZ-OAHLLOKOSA-N 388.895 5.430 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)Nc3ccccc3O[C@@H](C)C#N)cs2)cc1 780163458 AYPGSNNGCVDKJL-HNNXBMFYSA-N 391.496 5.477 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl 780668667 DLGCZVQAZUBURU-NHYWBVRUSA-N 390.270 5.093 30 20 GKED COc1cc([C@@H](C)Nc2nc(Cl)c(C#N)s2)ccc1OCc1ccccc1 804361187 IPFXIKJERPKZLZ-CYBMUJFWSA-N 399.903 5.429 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2c(F)cccc2F)cc1 810224727 KTLQLVQXOZVPHO-INIZCTEOSA-N 378.422 5.385 30 20 GKED CCC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(F)cn1 814765386 DPOZRNYWFBLEAM-UHFFFAOYSA-N 395.438 5.258 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3[C@H]4CCCCCC[C@H]43)n2)cc1 850791574 VVAGVFMWCDHASE-RMJJICAUSA-N 375.497 5.074 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCSc2ccc(F)cc2)cc1 916949033 ZYFBRSCLJILQRX-FOIQADDNSA-N 398.503 5.169 30 20 GKED C[C@H](Oc1ccc2c(c1)CCC2)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917045798 ABQQHRYFWCGWCR-SJCJKPOMSA-N 396.899 5.082 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)/C=C\c2cccs2)cc1 918629693 MIKNDBPARBPOQL-KHPPLWFESA-N 376.456 5.001 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\Sc3ccccc3)n2)cc1 920138851 LAJLQPMFFWXECI-JYBLJSLWSA-N 392.505 5.301 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3ccc(F)cc3)n2)cc1 921136830 PESKDDDHAZXYNL-IFXJQAMLSA-N 394.471 5.013 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(Cl)cc3Cl)cc2)cc1 1776029618 HJLMZTQXGDCEPQ-UHFFFAOYSA-N 385.250 5.805 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc(F)ccc1SC(C)(C)C 1776033844 PHGBPBPDRYNGSL-UHFFFAOYSA-N 394.899 5.904 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C\C(=O)c3ccc(F)c(F)c3)c2)c1 1776125817 SZFYUBMIBSTPEP-YFHOEESVSA-N 394.373 5.138 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1 1776125962 XYRWXWLLECYWJH-SDNWHVSQSA-N 394.511 6.247 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c(C)c1 1776132927 JQFVIBIZCIJPAM-YRNVUSSQSA-N 390.435 5.378 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)s1 1776339894 OXSIQAFIAIVWID-WLRTZDKTSA-N 390.504 6.208 30 20 GKED COc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)c(Cl)c1 1777351921 DFMUDJFNPRSKSW-GQCTYLIASA-N 390.819 5.297 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccco3)cc2)CCC1 1787268808 LWYDCAQKCLUZCF-UHFFFAOYSA-N 380.488 5.020 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)C(=O)c1cc(C)ccc1C 32788527 KNHFTLALKPGSSW-GOSISDBHSA-N 391.540 5.035 30 20 GKED N#C[C@@H](C(=O)c1sc(-c2ccccc2)nc1-c1ccccc1)c1ccccn1 41482642 CGNYYHLYGFIXNY-GOSISDBHSA-N 381.460 5.362 30 20 GKED Cc1nn(-c2ccccc2)c2sc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cc12 41545409 MUMOURKMDVLMHQ-INIZCTEOSA-N 398.447 5.027 30 20 GKED CCN(C(=O)c1sc(NC(=O)C(C)(C)C)cc1C)[C@@H](C)c1ccc(C#N)cc1 45500675 PDORLJBJLOHDED-HNNXBMFYSA-N 397.544 5.136 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccccc2)cs1 54894937 JEWGRCGBJIFMDU-FMIVXFBMSA-N 382.872 5.377 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccsc2)cc1Cl 58989378 OKCCPXCNKSJIJS-LJQANCHMSA-N 380.900 5.628 30 20 GKED Cc1noc2nc(C3CC3)cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c12 66801110 OLUSTVKLUMXAEZ-LBPRGKRZSA-N 392.484 5.055 30 20 GKED N#CCCCOc1cccc(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 114764122 ONQSOPIJUPNUKX-UHFFFAOYSA-N 394.456 5.013 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 117317926 XTKUBDAGDDYJDV-RTBURBONSA-N 396.581 5.255 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(F)cc(C#N)cc1F 128044016 ADJSFKMBDXZRPE-UHFFFAOYSA-N 389.361 5.061 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F 156977623 IJUGSSLFHMNLAM-LLVKDONJSA-N 382.382 5.491 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(Cl)c(C(F)(F)F)c1 162684368 AEIYDWWBWYOFBV-ONEGZZNKSA-N 382.691 5.014 30 20 GKED Cc1csc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)cc2)n1 171261942 KRQMEBUTGNJCCY-UHFFFAOYSA-N 388.496 5.187 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(OCc2ccc(F)cc2)cc1 180550871 SRKPXDBCONUMEX-SFHVURJKSA-N 390.458 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(OC)c(OC)c(OC)c1 191453040 IIRRKHLKGSLGQA-UHFFFAOYSA-N 384.476 5.208 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(-c2ccncc2)cc1 426157825 YKMWCRLFDVQGNQ-CQSZACIVSA-N 376.847 5.156 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)n[nH]2)c(C)c1 426994177 FYCZCQUDUNMLDB-MRXNPFEDSA-N 390.512 5.340 30 20 GKED CC(C)c1noc(-c2ccccc2C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)n1 430594500 GJDSRQBJWHHLPJ-OAHLLOKOSA-N 394.500 5.104 30 20 GKED C=CCN(C(=O)c1ccccc1CC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 432360236 UWKYXXJURXVIJN-UHFFFAOYSA-N 393.468 5.114 30 20 GKED CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 432857758 FUFBLDNDNOGGFT-IERDGZPVSA-N 399.535 5.938 30 20 GKED C=CCC[C@H](NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1)c1ccccc1 435760400 BRTURXRQNJBPEC-AWEZNQCLSA-N 397.466 5.404 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)Nc1ccc(CC(F)(F)F)cc1 438270273 WFMWGWAOTBFUSD-UHFFFAOYSA-N 394.290 5.271 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1cccc(OC(F)(F)F)c1 441421594 IKLINXWOAMSNDB-CYBMUJFWSA-N 384.423 5.106 30 20 GKED N#CC1CCC(CNC(=O)NC2(c3c(Cl)cccc3Cl)CCC2)CC1 442716990 DLQOHRVEBSMIFH-UHFFFAOYSA-N 380.319 5.002 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNCc1ccc(C#N)c(C)c1 443976772 FFKISFKXCKJWRK-UHFFFAOYSA-N 387.483 5.133 30 20 GKED N#Cc1ccc(F)c(CNC(=O)NCc2ccccc2-c2ccc(Cl)cc2)c1 465829740 BIEXTCGNPXMFSP-UHFFFAOYSA-N 393.849 5.017 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)c1nnc(-c2ccc(Cl)cc2Cl)o1 466732177 YNOPQIGROIGCPI-VIFPVBQESA-N 377.256 5.163 30 20 GKED C[C@H](NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1ccc(C#N)c(F)c1 468028813 JBOJWMQTXNZLNM-MAUKXSAKSA-N 391.515 5.277 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCC3CCC(C(F)(F)F)CC3)ccc21 469233167 SKONCXAFZKHOAV-UHFFFAOYSA-N 393.453 5.050 30 20 GKED CCOc1ccc(-c2nc(CC)c(C(=O)Nc3ccc(F)cc3C#N)s2)cc1 471047815 MBLIEZMYOBXELX-UHFFFAOYSA-N 395.459 5.034 30 20 GKED CCOc1ccc(-c2csc(NC(=O)C[C@@H](CC#N)c3ccccc3)n2)cc1 475773743 LOSCICZRYANIPV-GOSISDBHSA-N 391.496 5.235 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(Cc2cccc(F)c2)CCC1 480585619 YVKUDOPDWLREDR-INIZCTEOSA-N 397.519 5.507 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(OC(F)F)c(OC)c1)c1ccc(F)c(F)c1 480704102 ZNVREPUQTIPJPO-HXPMCKFVSA-N 383.385 5.543 30 20 GKED N#Cc1ccc(NC(=O)c2cc(F)c(Br)cc2Cl)cc1Cl 483067653 AFNBPPZBKMRNMR-UHFFFAOYSA-N 388.023 5.019 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@]1(C)CCCO)c1ccc(C(F)(F)F)cc1 483190948 DBKDBSAJLHNJMD-QUCCMNQESA-N 398.469 5.049 30 20 GKED N#C[C@@H](C(=O)c1cccc(COc2cccc(F)c2)c1)c1nccc2ccccc12 483224004 DVCYMSUSDTXZRS-HSZRJFAPSA-N 396.421 5.443 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1N1CCC(OC2CCCCC2)CC1 496146140 GFIWPDVYNKOGDU-UHFFFAOYSA-N 387.886 5.217 30 20 GKED Cc1nc2ccccc2n1CCC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 496536023 ONXAHWACEGRQTP-UHFFFAOYSA-N 396.450 5.038 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)N[C@H](C)CCCC(C)C)cc1C 497207516 XANDHWSKJYTQDC-LJQANCHMSA-N 380.536 5.025 30 20 GKED Cc1cc(N[C@H](c2ccccc2)c2ccccn2)n2c(nc3ccccc32)c1C#N 502084001 DWKGGTVCDCLLKI-XMMPIXPASA-N 389.462 5.264 30 20 GKED C[C@@H](NC(=O)N(Cc1c(Cl)cccc1Cl)C1CC1)c1ccc(C#N)cc1 503248876 WYQHFBOMJWLYFB-CYBMUJFWSA-N 388.298 5.300 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@@H](C#N)c3cc(C)nc(C)n3)c3ccccc3n2)cc1 505313856 WHKDTYGDBHJLPO-NRFANRHFSA-N 392.462 5.107 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)CC1 508479800 XQMYCQODUDGBJI-INIZCTEOSA-N 381.442 5.128 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCCC[C@@H]1C 512559903 NSPBKECMDMNVOU-SFHVURJKSA-N 377.488 5.242 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(COc4ccccc4)cc3)no2)cc1 518342114 CHMDRNRXAFUDAP-UHFFFAOYSA-N 399.475 5.480 30 20 GKED N#C[C@H](NC(=O)CCCc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 518850015 LIRQIUPVYXVJQM-KRWDZBQOSA-N 381.690 5.351 30 20 GKED N#Cc1cccc(CC(=O)Nc2cc(Cl)ccc2NCc2ccccc2)c1 532417634 GGQOEZYKNLTGDH-UHFFFAOYSA-N 375.859 5.005 30 20 GKED C[C@@H](C#N)CN(C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)C1CC1 533601768 TXANNPYCXXHBGT-INIZCTEOSA-N 389.474 5.057 30 20 GKED C=C(C)[C@@H](CC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1)OCC 535158077 VULZVSZWQRXWQL-FDDCHVKYSA-N 381.516 5.253 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2nc(C(C)(C)C)cs2)CC1)c1ccccc1 536187126 PYLMMDUVOIDJDM-QGZVFWFLSA-N 382.573 5.507 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1nc2ccccc2n1C(C)C)c1ccccc1 536205852 YMSUQRVHGINERZ-XXBNENTESA-N 387.527 5.641 30 20 GKED N#Cc1cc(F)ccc1CN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 539422298 HCBQQIUTZUQCCS-HNNXBMFYSA-N 376.275 5.109 30 20 GKED C[C@@H](NC(=O)N1CCc2ccsc2C1)c1ccc(-c2cccc(C#N)c2)cc1 541159130 SUFMHKFQUAPECY-MRXNPFEDSA-N 387.508 5.116 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1N[C@H](C)c1ccccc1 554679622 UHKNGIXQVOIJCJ-MSOLQXFVSA-N 385.467 5.137 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)cn1 558271744 IPIMDXULQFIQPK-HZPDHXFCSA-N 375.447 5.180 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 558304604 PNAZEPKNYIXRTE-OAQYLSRUSA-N 385.511 5.137 30 20 GKED CC(C)(CNC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1)C(F)(F)F 558768195 KEWHBCJZSQYVOT-UHFFFAOYSA-N 394.262 5.017 30 20 GKED Cc1csc(C2(NC(=O)c3sc4ccc(C#N)cc4c3C)CCCC2)n1 559772219 PWGZPEWDSYRDRC-UHFFFAOYSA-N 381.526 5.046 30 20 GKED C=CCC[C@@H](Nc1ccc(Cc2nnc3n2CCCCC3)cc1)c1ccco1 560550028 SXRNFXYQJIHKJB-HXUWFJFHSA-N 376.504 5.308 30 20 GKED CC(C)n1c([C@H]2CCCN2C(=O)c2cc(C#N)ccc2Cl)nc2ccccc21 560557844 KZHGQHDRQFKMGG-HXUWFJFHSA-N 392.890 5.120 30 20 GKED Cc1ccccc1C1(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1 561205692 HESMQENLNLPBQU-INIZCTEOSA-N 379.529 5.100 30 20 GKED Fc1ccc(C(F)(F)F)c(-c2noc(-c3ncsc3C(F)(F)F)n2)c1 582631775 YECAYSAWJVBBKM-UHFFFAOYSA-N 383.248 5.037 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cccc(F)c1Cl 608110438 ZVMJHQAQBJQIJM-YUMQZZPRSA-N 391.714 5.118 30 20 GKED CCc1cccc2c1OCC[C@H]2NCc1cccc(OCc2cccc(C#N)c2)c1 609223626 QUOXWQVNZRZCTK-RUZDIDTESA-N 398.506 5.313 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297563 YRUCRVQTZVSYRV-UHFFFAOYSA-N 396.368 5.040 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1cccc(F)c1 609693870 HFUDTLNJXSWJCP-HNNXBMFYSA-N 375.403 5.017 30 20 GKED CC1(NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CCCCC1 609711784 RQIYMONKJCDPQZ-UHFFFAOYSA-N 377.488 5.176 30 20 GKED COc1ccc([C@@H](NCc2ccccc2C#N)c2ccccc2Cl)c(OC)c1 610259070 GGEXYOVNKJXQBN-QHCPKHFHSA-N 392.886 5.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C)S[C@H](C)C1 610322713 DCVYOAMTHZHXQE-HZPDHXFCSA-N 381.501 5.017 30 20 GKED CC[C@H](C)n1c(-c2ccccc2)nn(CN(CCC#N)CCC(C)C)c1=S 728901801 YRDUNVRGKHSDCI-SFHVURJKSA-N 385.581 5.271 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3csc(-c4ccsc4)n3)c(C)c2c1 729151310 QYZBHQPWCUFBHD-HWKANZROSA-N 381.478 5.831 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccc(F)cc3F)cc2)cc1 732655984 LSSJXQSLRNGORC-UHFFFAOYSA-N 392.405 5.626 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)N(CCC#N)Cc3cccnc3)sc2c1 732656049 QFBMAMFMBJWVHN-UHFFFAOYSA-N 397.931 5.629 30 20 GKED C=CC[C@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccncc1 734460208 NRDFZWIEBODVPN-ZDUSSCGKSA-N 377.296 5.650 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCSC[C@H]1c1ccc(Cl)cc1 735311633 SZGLOLHVUJMEJV-SFHVURJKSA-N 393.339 5.186 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cc4c5ccccc5n(C)c4s3)[nH]c12 735791063 UCMVFYZZGKGISS-HNNXBMFYSA-N 384.464 5.068 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(COC3CCCC3)cc2)cc1Cl 739455572 HFPIXLDMQGJVTA-UHFFFAOYSA-N 385.920 5.480 30 20 GKED COc1ccccc1-c1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)cc1 741451470 PMCFSGIZTQGURV-UHFFFAOYSA-N 380.831 5.160 30 20 GKED Cc1ccc([C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 744037631 ASNZTVHMQVBTPW-ZYHUDNBSSA-N 378.375 5.197 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(-c2ccncc2)cc1 745990182 MTYDNTDOUMWSLW-XCVCLJGOSA-N 379.419 5.227 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 748535576 FHSXBSYHOJFGPF-ZEQRLZLVSA-N 394.478 5.509 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)cc1 751512215 HLLKGGXLAWBGNT-MDZDMXLPSA-N 399.493 5.011 30 20 GKED C=CCC[C@H](C(=O)O[C@H](C)c1nnc(-c2cccc(C)c2)o1)c1ccccc1 753423420 RAMKCMUJUVDFIY-XLIONFOSSA-N 376.456 5.399 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)cc3cccnc23)cc1 767251212 PQFNXNNHXJZNQT-JOCHJYFZSA-N 381.410 5.282 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c(C)oc4ccccc34)n2)cc1 767959345 MCNFSJSPNMOQAE-IBGZPJMESA-N 386.476 5.592 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=Cc1cscc1Cl 771872384 VGXBELCMZQOLQA-UHFFFAOYSA-N 389.720 5.138 30 20 GKED C=CCOc1cccnc1C(=O)O[C@H](C)c1sc(-c2ccc(F)cc2)nc1C 775245567 ZPCHFFWZWSYBCI-CQSZACIVSA-N 398.459 5.135 30 20 GKED C=CC[C@@H](C(=O)O[C@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 778417465 HPAKIPZPMWULNQ-DYESRHJHSA-N 379.500 5.042 30 20 GKED C[C@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 779028778 BBYJMZFHOAEYLD-YCRPNKLZSA-N 377.488 5.243 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C/c3cc(Cl)cc(C(F)(F)F)c3)ccc21 780187904 XXDFLZVEIYMRPI-QHHAFSJGSA-N 393.792 5.164 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 780583925 IUBXUUHWUTVEMJ-HNNXBMFYSA-N 381.476 5.245 30 20 GKED C#CCC1(C(=O)Nc2cccc(C[S@](=O)C3CCCCC3)c2)CCCCC1 788226490 VYLHTIXMJCYXCR-MHZLTWQESA-N 385.573 5.180 30 20 GKED CCCCc1nc(-c2cccc(OC(=O)C[C@H](CC#N)c3ccccc3)c2)no1 796595262 GVGSWHPJMCPOFN-SFHVURJKSA-N 389.455 5.072 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2coc(C3CCCCC3)n2)cc1 802041959 JTJOYCBGYOCYRZ-DNVCBOLYSA-N 393.487 5.197 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(C(F)(F)F)cc1 813212098 XFACPKZTPVIXPJ-IINYFYTJSA-N 386.295 5.099 30 20 GKED Oc1cc(F)c(Cl)cc1CNC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 816532606 OFKVKXOFOHEOBO-IUCAKERBSA-N 393.730 5.184 30 20 GKED FC(F)(F)c1nc(NN=C2CCC(OC3CCCC3)CC2)c2ccccc2n1 834936036 OZYMGDROGDLIHW-UHFFFAOYSA-N 392.425 5.318 30 20 GKED Cc1occ(C(F)(F)F)c1C(=O)Nc1ccc(F)cc1OCCC(F)(F)F 875677582 ASHHOMMRGXUTQL-UHFFFAOYSA-N 399.262 5.329 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915598054 IYUWRRRBDJLCIA-IBGZPJMESA-N 399.475 5.619 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(CCC#N)CC(C)C 917363067 HAQYGHKMSSFNDN-UHFFFAOYSA-N 385.511 5.151 30 20 GKED CC1=Nc2ccccc2C12CCN(C(=O)Nc1ccc(C#N)cc1C1CC1)CC2 933858027 VVAUMPVTUAGPQI-UHFFFAOYSA-N 384.483 5.107 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3c(F)cccc3F)o2)ccc1Cl 1776033514 SUUWPOPISXTUJE-UHFFFAOYSA-N 376.746 5.022 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C2CCCC2)cc1 1776354715 XIMRSEWXDNWNCI-UKTHLTGXSA-N 378.468 5.726 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(O)c2)cc1)c1ccccc1 1776469393 GJFSKJFZFRJHKX-SBNBMVPLSA-N 388.419 5.127 30 20 GKED CCc1c(C(=O)/C=C/c2cccc(OCCC(=O)O)c2)oc2ccc(C)cc12 1776956190 JLJMYWVQJOVNQY-CMDGGOBGSA-N 378.424 5.053 30 20 GKED CSc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1Cl 1777403405 JSCIDGHVWCCZCA-QPJJXVBHSA-N 390.888 5.443 30 20 GKED O=C(O)/C=C\c1ccc(/C=C\C(=O)c2ccc(N3CCCCCC3)cc2)cc1 1777624135 QDWWZCSFKCUNIM-VULZFCBJSA-N 375.468 5.061 30 20 GKED Cc1cnn(-c2ccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)cc2)c1 66037285 DHCNHCVCNZLOTI-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2sc(-c3ccc(Cl)s3)nc2C)n1 69283726 FQXQMXFJTJIOKO-SECBINFHSA-N 379.919 5.088 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(C2SCCS2)c1 124490625 RPJCMECPNKKPKF-UHFFFAOYSA-N 388.533 5.524 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(SC(F)F)cc1)C(=O)c1ccc2ccccc2c1 126596275 WIJNEXLBJLOPQM-GOSISDBHSA-N 396.418 5.116 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N(CCC#N)Cc2ccccn2)c(C)c1 128973221 PSNWHCCHFCYZKP-QGZVFWFLSA-N 382.533 5.228 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cc2ccccc2s1 129672741 ZQOUWJPHHCFVKP-LBPRGKRZSA-N 389.263 5.169 30 20 GKED CC(C)(C#N)CCCNC1(c2ccc(OCc3ccccc3)cc2)CCOCC1 132461075 IKUPMKJSSNHOPZ-UHFFFAOYSA-N 392.543 5.191 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)cc2Cl)o1 134307967 YUIOEAZPOSQNSB-SECBINFHSA-N 378.190 5.194 30 20 GKED C[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccsc1 152226663 DBTYRIFGPAABQV-INIZCTEOSA-N 376.481 5.135 30 20 GKED CC(=O)Nc1cc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)ccc1C 156092554 OIJYPEJEBHFTIH-UHFFFAOYSA-N 399.450 5.178 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 160091774 VQFDPBYTVUMWOF-INIZCTEOSA-N 381.888 5.326 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(NC(=O)c3cccs3)c2)n1 177766423 KSMXLNSZZGJOIP-HNNXBMFYSA-N 395.509 5.070 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1)c1ccccc1 180216678 SACKDVLMBCERCU-GOSISDBHSA-N 381.479 5.667 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccccc2C(F)(F)F)ccc1OC 180810784 CGIMIDUKAAEPTQ-GDBMZVCRSA-N 392.421 5.246 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CC1CCC(C(F)(F)F)CC1 183287924 QLCJMTWVQNWOHW-NFOMZHRRSA-N 384.467 5.778 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1COc1ccccc1 183787001 FJHFTTSKSBPPBS-KRWDZBQOSA-N 387.439 5.200 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccccc1)c1cccc(F)c1 184323462 NBCBRYNSCNNXFF-KSFYIVLOSA-N 389.430 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(CCC(C)=O)cc1 189870768 HJHCVVNPOLNZHK-UHFFFAOYSA-N 379.500 5.078 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 237797633 HHVHBAVLMIWIRX-XMMPIXPASA-N 390.914 5.902 30 20 GKED COc1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)cc1OC 303175992 XLNSQNBXIWNIBH-ZROIWOOFSA-N 376.424 5.231 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1ccccc1SCCC#N 303337682 XULBMEQQKXTTOF-QGZVFWFLSA-N 382.529 5.530 30 20 GKED CC(C)C[C@@H]1C[C@H](/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CCO1 329503721 ZDTCQQYUNHZTIX-QKNQBKEWSA-N 387.568 5.043 30 20 GKED C=CCCc1ccccc1NC(=O)CSCc1coc(-c2ccccc2)n1 410343488 CYSGKWPGNJSXJG-UHFFFAOYSA-N 378.497 5.332 30 20 GKED CC1=C(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 431903232 OGGVDGGVIBIVGN-HXUWFJFHSA-N 379.891 5.569 30 20 GKED Cc1cc(C)n(-c2ccccc2NC(=O)N[C@@H](CCCC#N)c2ccccc2)n1 432698664 KVHUNWACOQZEEL-FQEVSTJZSA-N 387.487 5.046 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Cl)c(C(F)(F)F)c1 437359972 SONDVXREUBVNNM-LLVKDONJSA-N 398.837 6.005 30 20 GKED N#Cc1csc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c1 437413642 RMGQALDGESSXHR-UHFFFAOYSA-N 386.310 5.364 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1 437829242 QVKURIRYLQCWTC-PXNSSMCTSA-N 377.488 5.003 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438046455 XQDJYEIZUBAKOS-OXQOHEQNSA-N 399.535 5.609 30 20 GKED CSCCCN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 439354854 STUOSQVMDKXVDA-UHFFFAOYSA-N 389.908 5.221 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@H](CCC#N)c1ccccc1 439499062 SXDGAHUTXGOBBL-XMMPIXPASA-N 399.494 5.741 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 457700773 PNAIPQMUNMINEX-XVKPBYJWSA-N 381.238 5.014 30 20 GKED Cc1cc([C@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)ccc1F 462172969 AYOGJTZJIASVCM-QFIPXVFZSA-N 382.841 5.678 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)CC2 468969196 NVMMURAGGLTQLH-JOCHJYFZSA-N 398.462 5.336 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)C[C@H](CC#N)c1ccccc1 475124020 ZBUIMCSWUDYSIY-QHCPKHFHSA-N 383.495 5.006 30 20 GKED CC(C)CN(C(=O)Cc1nc(-c2ccc(F)cc2)cs1)c1ccc(C#N)cc1 475881319 NYDGWPNUDORQCW-UHFFFAOYSA-N 393.487 5.053 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2ccccc2F)n1Cc1ccccc1 475934329 RQIDEKVBMYQBSA-UHFFFAOYSA-N 394.519 5.555 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(CCc2cccc(F)c2)C2CCCC2)cc1 476285951 LAWXHBKDVZOOBX-UHFFFAOYSA-N 378.491 5.254 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(Cl)cc1OCC 476680523 BPKZPJGKWZVONB-UHFFFAOYSA-N 390.915 5.126 30 20 GKED O=C(NCC(F)(F)C(F)F)c1ccccc1-c1ccc(C(F)(F)F)cc1 482146797 HLTBUAJDDRYIQF-UHFFFAOYSA-N 379.275 5.003 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCCc4cc(F)cc(F)c43)c2)cc1 482784736 XYFHKZWNGHZSSH-UHFFFAOYSA-N 390.389 5.222 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)cc1F 483197802 MANFJSGNFGCPSR-IBGZPJMESA-N 399.400 5.374 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2cccc(Cl)c2)on1)c1ccccc1 487543485 XDRMXRLETNDVHK-SFHVURJKSA-N 379.847 5.160 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccc(F)c(C)c1)C1CC1 500520342 CSNAAGAGPDQBLQ-QFIPXVFZSA-N 398.526 5.151 30 20 GKED C=CCCc1ccccc1NC(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1 505035212 LECWWVRRGIOQBI-RXVVDRJESA-N 383.561 5.071 30 20 GKED N#C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1c(Cl)cccc1Cl 505540209 MJBMNLAVIBOPON-ZDUSSCGKSA-N 391.151 5.146 30 20 GKED CCN(Cc1ccccc1Cl)Cc1cn(CCC#N)nc1-c1ccccc1 507115105 DKURCOQPPMHFPH-UHFFFAOYSA-N 378.907 5.139 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cc(C)ccc4o3)n2)cc1 516270352 UNGXVLFORYXIDG-QGZVFWFLSA-N 388.448 5.363 30 20 GKED CCn1c(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc2ccccc21 517800897 NSLXQXBBEBJYRN-SFHVURJKSA-N 396.475 5.146 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(F)cc1Br 518660110 KDVSEVFFFNHCPU-GFCCVEGCSA-N 379.298 5.452 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCc2c(Cl)cccc21 518753708 YYJBPDDLQWUTBN-DYVFJYSZSA-N 385.920 5.543 30 20 GKED C=CCOc1ccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc1OC 518776556 FBBDVYNCGHOWRS-UHFFFAOYSA-N 395.449 5.417 30 20 GKED CCCCCc1ccc(NC(=O)N2CCC(Oc3cccc(C#N)c3)CC2)cc1 519189174 QJJDSKJZTMWRLR-UHFFFAOYSA-N 391.515 5.366 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)S[C@H](C)c1ccc(C#N)cc1 522842290 OQPGBWCQZSZNMW-ZIAGYGMSSA-N 388.920 5.350 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(-c2nc(C)cs2)cc1 523631106 XGENNZWTBHIGSK-UHFFFAOYSA-N 379.485 5.005 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c(Br)s1 532111372 YKYLLCUWGQEESJ-QMMMGPOBSA-N 395.347 5.129 30 20 GKED N#C[C@@H](C(=O)c1c(-n2cccc2)sc2c1CCC2)c1nc2ccccc2s1 534670445 KMDZUCBHKBJZHI-AWEZNQCLSA-N 389.505 5.127 30 20 GKED CC[C@@H](C)[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 538188263 PYWDKRXEGBPKME-JLTOFOAXSA-N 380.879 5.139 30 20 GKED N#Cc1ccc(CN(C(=O)c2csc(-c3ccccc3Cl)n2)C2CC2)cc1 541367222 JTDJFFSABANALX-UHFFFAOYSA-N 393.899 5.140 30 20 GKED N#Cc1cc(C(=O)Nc2ncccc2OCc2cccc(Cl)c2)ccc1Cl 543439058 QGJIXCJHDCFNHM-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1ccc(C)c(-n2ncc([C@H](C)N[C@H](CCCC#N)c3ccccc3)c2C)c1 550835677 LYKBARIJKCBTGB-GBXCKJPGSA-N 386.543 5.883 30 20 GKED N#CCCC[C@@H](NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 552311874 GCKQAXHWPHXUEC-HXUWFJFHSA-N 381.932 5.988 30 20 GKED Cc1sc(C2(NCCCCC(C)(C)C#N)CCC2)nc1-c1ccccc1F 555773838 VMYBQXNYZFLHQN-UHFFFAOYSA-N 385.552 5.947 30 20 GKED C=CCOc1ccc(CNC(=O)C(C)(C)c2csc(-c3cccs3)n2)cc1 557365192 NUWPDTNMQHLTPJ-UHFFFAOYSA-N 398.553 5.030 30 20 GKED C[C@@H](NC(=O)C1(c2cccnc2)CCCC1)c1ccc(-c2cccc(C#N)c2)cc1 571200997 GBLMNBHDHBTHHZ-LJQANCHMSA-N 395.506 5.309 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)c1ccc(COc2ccccc2C#N)o1)C1CC1 577302037 BWTAFCVKOBCUIA-KRWDZBQOSA-N 386.451 5.096 30 20 GKED CCN(C(=O)c1cc(C)sc1Br)c1ccc(C#N)c(Cl)c1 582622224 CVQYYIIMGFQCIJ-UHFFFAOYSA-N 383.698 5.011 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC2 589337257 VERLXPWMCJSZQO-NHIYQJMISA-N 376.344 5.045 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 591289458 IZBXYCUBTJEMBA-UHFFFAOYSA-N 382.504 5.055 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCSC3(CCC3)CC2)cc1 591336731 CBPCPSUIZZBHFM-UHFFFAOYSA-N 393.512 5.244 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccccc1-c1ccc(Cl)cc1 595527588 VNEVJCKGODRZDF-IAGOWNOFSA-N 381.907 5.403 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)c1ccccc1 602163619 PLSQLBCYMHEJEO-KRWDZBQOSA-N 384.435 5.198 30 20 GKED CSCc1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)oc2ccccc12 603613774 RRRJBMXDBUCBKT-ZDUSSCGKSA-N 378.478 5.396 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc3cc(Cl)ccc3c2Cl)s1 604030417 WATORIYKJDAZPP-UHFFFAOYSA-N 381.309 5.956 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1 604495673 CNCAPVITEXKPOE-LJQANCHMSA-N 393.531 5.274 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1ccccc1SC[C@H](C)C#N 609377208 QVSZNWPGMSDQPE-OAHLLOKOSA-N 389.524 5.285 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc2ccccc12 609434678 INIIJDVGNLLMFV-SJORKVTESA-N 389.524 6.117 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCS[C@@H](c2ccccc2)C1 609811108 NQBAUKNNLQMNTC-OXQOHEQNSA-N 397.569 5.403 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(CN4CCCC4)cc3)c2)cc1 610011291 SMCLBAVTSFXPHS-UHFFFAOYSA-N 396.494 5.150 30 20 GKED CC(=O)Nc1c(C)ccc(NCc2cccc(OCc3ccccc3C#N)c2)c1C 610910335 NWIZNBVFLJOYFG-UHFFFAOYSA-N 399.494 5.325 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2o1 614439912 XQYVMUIXBHUIPF-HNNXBMFYSA-N 388.448 5.445 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2cccc(C#Cc3cccs3)c2)C1 680450963 XUTJBPGVVJJKKQ-VGSWGCGISA-N 387.508 5.158 30 20 GKED N#C[C@H](C(=O)C1(C(F)(F)F)CC1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 726322443 UUNDZSALKVBVRA-UDMGLPGGSA-N 394.462 5.130 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(Nc3ccccc3)c2)cc1Cl 726444926 RTEUCNGCORDNBY-UHFFFAOYSA-N 378.888 5.764 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726478661 LFOZUQQQHJYCCC-UHFFFAOYSA-N 399.825 5.438 30 20 GKED C=CCc1cc(CNCc2cc(-c3ccccc3)cs2)cc(OC)c1OC 729683537 XWVKEDFKLYTYLJ-UHFFFAOYSA-N 379.525 5.451 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 733083458 JNNNJKRRQOXBDE-FLIBITNWSA-N 394.452 5.402 30 20 GKED CC(C)c1ccc2cc(C(=O)N[C@H](C#N)c3ccccc3Br)[nH]c2c1 733266746 MLYJZOCAPYTTHB-LJQANCHMSA-N 396.288 5.048 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccccc3OCc3ccccn3)c2c1 734307449 OYBMBRUCASZSEH-XFXZXTDPSA-N 384.435 5.047 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 741638515 FDHXGYRWWTZUSF-UHFFFAOYSA-N 381.353 5.035 30 20 GKED CC(C)(C)OC(=O)N[C@H](C/N=C/c1c(O)ccc2ccccc12)c1ccccc1 741844972 RGUAESJUWXNLFV-JAMLUQCHSA-N 390.483 5.230 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)[C@H]3SCCc4sccc43)cc2)cc1 742496269 AGRQGUBLRSYXAT-FQEVSTJZSA-N 377.490 5.223 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccc(F)cc1F 745724830 YLOCLOPECIQOIR-UHFFFAOYSA-N 379.435 5.240 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c(OC(F)F)c1 745989968 IHWYYUBUUMWKPH-CLFYSBASSA-N 381.378 5.255 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 747108141 MFJBKPCJXNYSIY-JQWIXIFHSA-N 395.673 5.098 30 20 GKED CC(C)(C#N)c1ccccc1CN(Cc1ccccc1)C[C@H](O)c1cccs1 767901447 HJBYTGIDFYPGHC-QFIPXVFZSA-N 390.552 5.285 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)Nc2cccc(OCC#N)c2)cc1 772067915 DVTCDJBWFFYQGG-UHFFFAOYSA-N 399.454 5.323 30 20 GKED CC1(C)CC[C@@H]2C[C@@H](NC(=O)Nc3cccc(OCC#N)c3)c3cccc1c32 776467591 PKFYKXZVAYZXBT-FOIQADDNSA-N 375.472 5.010 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cccc(Br)n2)cc1 777917584 DKRKWZMEDYOHIF-BUHFOSPRSA-N 394.268 5.416 30 20 GKED C#CC[C@H](OC(=O)c1csc(-c2cccc3ccccc23)n1)c1ccccn1 778300171 DDZUHDWIWWOMMA-NRFANRHFSA-N 384.460 5.280 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c3ccccc3n2)o1 780161158 MFEHEKYHCNRLBO-INIZCTEOSA-N 397.434 5.346 30 20 GKED O=C(O[C@H](Cc1ccc(F)cc1)C(F)(F)F)[C@H]1CCC[C@@H](C(F)(F)F)C1 781752517 AJRFTHRCKQLZJQ-OUCADQQQSA-N 386.307 5.211 30 20 GKED COc1ccc(CC(=NOC[C@H]2CCOC2)c2cc(Cl)ccc2Cl)cc1 788033636 KMXMFGMFVLBGJB-HNNXBMFYSA-N 394.298 5.002 30 20 GKED N#Cc1cc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)ccc1F 796470501 MCCHORFWQHWYQK-QGZVFWFLSA-N 396.680 5.380 30 20 GKED CC(C)(CC(=O)c1ccccc1)CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 799609627 RJMQNGKQAMTBIY-MRXNPFEDSA-N 394.471 5.301 30 20 GKED C=CCCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1Br 800154040 AEQUNSHWZTZRJM-UHFFFAOYSA-N 396.288 5.006 30 20 GKED N#CCSc1ccccc1C(=O)OCC[C@@H](c1ccccc1)C(F)(F)F 816476526 BMXWCLKWSYWIID-INIZCTEOSA-N 379.403 5.195 30 20 GKED N#C[C@H](C(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 819946355 MEQNDRSTGUGSNS-UDGJJRABSA-N 393.295 5.028 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 836304138 MFZGITMNMYKZNY-MJBXVCDLSA-N 398.359 5.176 30 20 GKED C[C@]1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCCO1 838786374 IKPYJVMLYAHSIY-SCLBCKFNSA-N 395.311 5.252 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)C[C@H](O)c1cccc(C#N)c1 844481869 VYSGOQPUALDTHZ-NRFANRHFSA-N 379.504 5.002 30 20 GKED CCCCSc1ccc(Cl)cc1-c1noc([C@H](N)CCCCC#N)n1 848625822 MIGXNLHABMFZGS-OAHLLOKOSA-N 378.929 5.366 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H]2CCCc3c2[nH]c2ccc(Cl)cc32)cc1 858297768 HJJYYQNXHAFXBW-SPLOXXLWSA-N 379.891 5.279 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904451698 YAKVMTPNGOJDBI-UHFFFAOYSA-N 398.422 5.110 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(Cc2ccc(C)s2)C(C)C)cc1OC 920028516 XKJASIBDDSUYTI-FMIVXFBMSA-N 385.529 5.080 30 20 GKED C=CC[C@@]1(C(=O)O)CCN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)C1 1776161811 FPXDWFBZPCDUJF-JOCHJYFZSA-N 385.891 5.294 30 20 GKED CC(C)(C#N)c1ccc(CNCc2cccc(-c3ccc(C(=O)O)cc3)c2)cc1 1776230549 CCWJIOMLXAGVIR-UHFFFAOYSA-N 384.479 5.143 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776473697 ZRPNXLVESNLSFH-CFYYFVFUSA-N 396.439 5.302 30 20 GKED C[C@@H]1/C(=C\c2c[nH]c3ccc(C(=O)O)cc23)C(=O)c2cccc(Br)c21 1776586503 AADCPPDTSGIUHZ-WWNSAXIVSA-N 396.240 5.012 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cn(CC(=O)O)nc2-c2ccccc2)cc1 1776697675 MJXRLDOWGYFMBR-CLVCIHKQSA-N 388.467 5.044 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-n2cc(Cl)c(C)n2)cc1 1776783100 XYZFIYNURYXDOM-GOSISDBHSA-N 391.943 5.128 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccccc1-c1ccc(C)cc1C 1776783989 RWAXIVHBLPMYLC-JOCHJYFZSA-N 381.560 6.264 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)o1 1776966090 XRFTWHUDDYDXIK-PKNBQFBNSA-N 376.408 5.015 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)[C@H](C#N)c1nc2ccccc2[nH]1 41495722 INODNKZFLQAAMS-AWEZNQCLSA-N 392.871 5.138 30 20 GKED CC(=O)N(c1nc(COc2ccc(C#N)c(F)c2)cs1)c1cccc(C)c1C 66749982 WHSTUFQQQWIJCR-UHFFFAOYSA-N 395.459 5.034 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1cccc(C(F)(F)F)c1 78714747 DBVALINGDFBRGD-ZDUSSCGKSA-N 393.434 5.279 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cn(CC(C)C)c3ccccc23)cc1 111184097 LPISZOLDBYMDCZ-UHFFFAOYSA-N 389.499 5.256 30 20 GKED COCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 126280965 GNYYBWQCHSXQCH-CYBMUJFWSA-N 383.300 5.110 30 20 GKED Cc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 126543166 GQSNIYSZUKDFAT-QGZVFWFLSA-N 377.856 5.134 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C/c2ccc3ccc(Cl)cc3n2)n1 131166314 TULKQNGXICOQSU-KXPUMZMLSA-N 381.888 5.358 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCSC2(CCCCC2)C1 177090006 DAFXQFSMFYUVBP-INIZCTEOSA-N 389.590 5.364 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2ccc(Br)s2)n1 177746961 FRZSNCOULPZSTI-GFCCVEGCSA-N 397.363 5.290 30 20 GKED C[C@H](CSCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 183333454 XSGBIKMZGLFCPE-IAGOWNOFSA-N 384.570 5.556 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ccc(F)cc2)CC1 191504656 BUQHJOVULIJPOL-UHFFFAOYSA-N 396.506 5.753 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1F 192170674 JKVORRCZLLAXJM-OAHLLOKOSA-N 376.275 5.109 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccoc3Cl)cc2Cl)c1 192304538 AIPYYMCVSKZUFZ-UHFFFAOYSA-N 387.222 5.289 30 20 GKED N#CC1(CCCSc2nnc(-c3cccc4ccccc34)o2)CCOCC1 280966992 KONQVYFOYRSRQL-UHFFFAOYSA-N 379.485 5.082 30 20 GKED C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1ccc(NC(=O)c2ccncc2)cc1 301270504 JLDLBEKQMRAODL-CQSZACIVSA-N 376.847 5.032 30 20 GKED Cc1nc(N=C(O)C2(C3CC3)CCOCC2)sc1Cc1ccc(F)cc1F 330179676 MPQPLHYPGMHLKN-UHFFFAOYSA-N 392.471 5.115 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1csc(COc2ccc(C)cc2)n1 410361254 UXAUPWCGAASZRK-UHFFFAOYSA-N 392.524 5.330 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@@H]3C)s1 410982271 OXSYXSVVQBNDHB-JFGNBEQYSA-N 389.546 5.030 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@@H](C)C[C@H](C)C2 410994858 BQZFDGSKIMIREE-RYUDHWBXSA-N 395.484 5.043 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(C(C)(C)C#N)cc1 425082809 GSHDHHUWWSGUCV-OAHLLOKOSA-N 399.416 5.061 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc(Cc3ccccc3F)n2)s1 430617651 OADUINWAZXLMSN-ZDUSSCGKSA-N 399.516 5.117 30 20 GKED C=CCN(Cc1ccccc1)C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 433872018 GCQOWLMWBZUFSD-FWGXRIOKSA-N 377.450 5.350 30 20 GKED CCCOc1cccc(CCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 434222643 LGFHNFWVACGMRW-KRWDZBQOSA-N 397.544 5.091 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@@H]1CCCc2nc(CC)sc21)c1ccccc1 435758452 DRJFWJYZAZUDDV-IEBWSBKVSA-N 383.561 5.432 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 438221454 AQQNITFUEMYNNN-WTOYTKOKSA-N 377.488 5.168 30 20 GKED C[C@@H](NCCC(=O)Nc1ccc(Oc2ccccc2)cc1)c1ccc(C#N)cc1 438833153 WLJUKTVOMVPFJW-GOSISDBHSA-N 385.467 5.030 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cc2)cs1 442557300 XZLYNSADHUBZJT-HNNXBMFYSA-N 381.526 5.363 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@H](C)c1cccc(C2CC2)c1 451116783 RYTWOFJTHIPSDF-DLBZAZTESA-N 393.556 5.105 30 20 GKED C=CCC1(c2nc(-c3ccc(NC(C)=O)c(C(F)(F)F)c3)no2)CCCC1 453173323 LXAXVFLZHBIVOO-UHFFFAOYSA-N 379.382 5.102 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC[C@@H]1CCCC1(F)F 454699913 YBCQGGAOJSCFBE-SFHVURJKSA-N 399.441 5.003 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1cccc(C)n1)c1ccc(C(F)(F)F)cc1 458580844 RJYFMUPDWHERJC-IBGZPJMESA-N 391.437 5.258 30 20 GKED C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458794652 BNZAVOHRPZJWSZ-VOQZNFBZSA-N 379.479 5.353 30 20 GKED CCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H]1CCc2ccccc21 458795607 COWGPVBRTDRFIB-PKTZIBPZSA-N 375.516 5.531 30 20 GKED N#CCCC[C@@H](NC(=O)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2)c1ccccc1 458840888 OCBXGKXSFHHKMX-UEQSERJNSA-N 387.527 5.542 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCCCOc1cccc(Cl)c1 462223824 QRJMHNOOUOHCEI-UHFFFAOYSA-N 379.847 5.280 30 20 GKED C[C@H](C(=O)N[C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462440888 MQYWRHCICYWRJH-GKCIPKSASA-N 386.417 5.133 30 20 GKED C[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1Br)c1cccc(C#N)c1 464194590 MRJIXPFPFDYEBB-SNVBAGLBSA-N 397.194 5.082 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c2ccccc2n1 464400369 HKIQFWCZTHOGQG-INIZCTEOSA-N 383.373 5.262 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 464938036 GRVPVNJEPYNTEG-LIONHTAISA-N 380.491 5.242 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 471170906 UVTMAWZSUBMQKQ-UHFFFAOYSA-N 375.472 5.203 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(Cl)c(Cl)c1 471931409 CWRGNXXKRFAQKV-GFCCVEGCSA-N 379.312 5.741 30 20 GKED CC(C)c1csc(CNC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)n1 478718615 KTONOMWZANUOJJ-UHFFFAOYSA-N 391.496 5.055 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)N[C@@H](CCC#N)c1ccccc1 480808328 XOQINOQGQSYSHZ-SFHVURJKSA-N 397.450 5.172 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3sc4c(c3C#N)CCCC4)c2)cc1 482168464 ZJKZMFUOKSYYPY-UHFFFAOYSA-N 399.475 5.415 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1S[C@@H](C)CC#N 482526525 CABVYSWKAKBUQZ-YOEHRIQHSA-N 388.920 5.530 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 484863165 NVVDCHBZLLQJHF-UHFFFAOYSA-N 385.467 5.431 30 20 GKED CC(C)CCn1ncc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1C(C)C 487617757 OESPLFYYMNTVOR-IBGZPJMESA-N 381.524 5.219 30 20 GKED N#CCCC[C@@H](NC(=O)COc1ccc(Cl)c2ccccc12)c1ccccc1 487619633 SFELTXLVKHSFFO-OAQYLSRUSA-N 392.886 5.423 30 20 GKED N#Cc1ccsc1C(=O)Nc1ncc(Cc2cccc(Cl)c2Cl)s1 497979407 FFLLQAGQBZHQBF-UHFFFAOYSA-N 394.308 5.226 30 20 GKED C=CCOc1ccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)cc1OC 500903435 YYWWIILFSUGXMF-KRWDZBQOSA-N 378.299 5.344 30 20 GKED COc1cc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc(OC)c1 503220189 AIBHYJMYKAXPMA-UHFFFAOYSA-N 389.411 5.012 30 20 GKED CCCOc1ccc(-c2nc(C(=O)Nc3sc(CC)cc3C#N)cs2)cc1 505070874 OSFRSSPIHOCDDA-UHFFFAOYSA-N 397.525 5.347 30 20 GKED C=CCCO[C@H](C)c1nc([C@@H](Oc2ccc(Br)cc2)C(C)C)no1 508682042 VOJQORBOSGRDQR-CJNGLKHVSA-N 395.297 5.262 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2sccc2Cl)cc1 509035548 CRJMSKQPDSJHNU-UHFFFAOYSA-N 384.844 5.326 30 20 GKED Cc1ccc(CN(Cc2cccc(OCCCC#N)c2)Cc2ccco2)s1 512287559 UNGPEGNUAUROKT-UHFFFAOYSA-N 380.513 5.535 30 20 GKED C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(C#N)cc1F 512621263 VYKKMAFLYQUGMP-SFHVURJKSA-N 396.469 5.401 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4nccc(C)c4c3)n2)cc1 513642476 LVQMCARJBUJSOG-IBGZPJMESA-N 383.476 5.465 30 20 GKED C=CCN(C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc2c(s1)CCCC2 518173680 QGVNJUHZUYEVDZ-UHFFFAOYSA-N 386.520 5.426 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521034014 SBHLOWUGGODXIO-SJORKVTESA-N 397.544 5.608 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc([C@@H](CC)c3ccccc3)o2)c1C 524316742 WOJWBJHMDPFBNP-SFHVURJKSA-N 395.528 5.191 30 20 GKED CCCCCOc1ccc([C@H](C)Nc2c(C#N)nnc3ccccc23)cc1OC 524846761 HHAKKWPLEPUIIT-INIZCTEOSA-N 390.487 5.252 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@@H](C)Nc1ccc(-c2ccccc2)cc1 525761177 YXIPGCNFENCVDO-LJQANCHMSA-N 399.494 5.109 30 20 GKED CC(C)(NCc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2s1 528602340 LKSHXQLBZBCXRH-UHFFFAOYSA-N 375.419 5.212 30 20 GKED CCC(CC)n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C 535312636 DFSVTSXVSWJVJO-SFHVURJKSA-N 392.528 5.475 30 20 GKED N#CCC1CCN(C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)CC1 543822812 GKCWYYRQJFAASO-XMMPIXPASA-N 383.495 5.264 30 20 GKED N#C[C@@H](C(=O)c1cccnc1C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 544146767 HQQYCPIXADXLFE-INIZCTEOSA-N 379.872 5.226 30 20 GKED COc1ccc(CNc2ccc(Cl)cc2OC(F)F)cc1OCCCC#N 547272573 OMXYKVJXYKEBPQ-UHFFFAOYSA-N 396.821 5.245 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1ccccc1SC 560149510 RGMFCZIRIMFCAT-CYBMUJFWSA-N 380.966 5.139 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NCc3nc(C#N)cs3)cc2)c1 581101225 XXXVOFVOXAWKNY-UHFFFAOYSA-N 377.513 5.638 30 20 GKED COc1cccc([C@H](C)c2noc(-c3cn(CCCC#N)c4ccccc34)n2)c1 589111964 FMPZGEFOLKGWKH-INIZCTEOSA-N 386.455 5.155 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(C3(C#N)CC3)cc2)cc1 594929007 JAYIXPIAUYEECF-LJQANCHMSA-N 382.507 5.768 30 20 GKED CCSc1ccccc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 603638907 CUOPSSVDPNTZPW-UHFFFAOYSA-N 388.492 5.502 30 20 GKED CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)C1(C)C 603738433 BRTLORHPGQLTCT-UYAOXDASSA-N 375.472 5.231 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4ccccc4F)o3)cn2)cc1 603763890 ATUATDACVPZHOE-UHFFFAOYSA-N 399.381 5.397 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C3CCCCC3)cn2)cc1 603828898 BQMWSFQHZFMFDL-NRFANRHFSA-N 390.487 5.322 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609082177 CHILTZIZARARSB-NSHDSACASA-N 379.794 5.038 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@@H](c4ccccc4)C3)cc2)cc1 609502933 ZLHGSQFAOLUZLT-JOCHJYFZSA-N 382.463 5.175 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c1 610326296 MMOJSVHOJPFSLS-ZDUSSCGKSA-N 393.434 5.404 30 20 GKED CCCCN(CC(=O)Nc1ccccc1SCC#N)[C@@H](C)c1ccc(C)o1 610390280 VDISVFKOYKHYAI-KRWDZBQOSA-N 385.533 5.006 30 20 GKED COc1c(F)cc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 615128528 IRCYTFNEFSLOPS-UHFFFAOYSA-N 399.237 5.263 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(Cl)c2ncccc12 615491746 XYTSUVMOIUSPHZ-UHFFFAOYSA-N 381.863 5.117 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)c(C(F)(F)F)c1 622477828 MSEBVNDXMFOFIX-AWEZNQCLSA-N 397.265 5.407 30 20 GKED Fc1cc(-c2noc([C@H](C[C@H]3CCCO3)C(F)(F)F)n2)cc(C(F)(F)F)c1 650625780 NVPHCDVWGYPEJH-NEPJUHHUSA-N 398.278 5.110 30 20 GKED C[C@@H](NCc1c(F)c(F)cc(F)c1F)c1ccc(OCC(F)(F)F)cc1 678595108 MIIAEJSBLXZWLE-SECBINFHSA-N 381.291 5.035 30 20 GKED Cc1ccc(C)c(OC2CCN(C(=S)Nc3ccc(C#N)c(Cl)c3)CC2)c1 726477673 YBFIAWDKXAPXDC-UHFFFAOYSA-N 399.947 5.069 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(O)c(F)c2)cc(C)c1OCc1ccccn1 728438707 LRJCEEVWZZLZFB-VURMDHGXSA-N 377.415 5.018 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)cc1 728441537 LOQIRDNPGZEZFX-XFXZXTDPSA-N 380.444 5.112 30 20 GKED COc1cccc(NN=Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)c1 731151568 LEPXPVQKUAZHNX-UHFFFAOYSA-N 382.895 5.413 30 20 GKED CC(C)c1ccc2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)[nH]c2c1 731349623 POKGEYPERQWLOQ-HNNXBMFYSA-N 377.513 5.938 30 20 GKED N#CCOc1ccc(COC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)cc1 733379224 BAQSWYZSUPXNJZ-ZHZULCJRSA-N 393.439 5.074 30 20 GKED N#CCN(C(=O)c1sc2cc(Br)ccc2c1Cl)C1CCCC1 737637493 AOWCRWYPWHLUSB-UHFFFAOYSA-N 397.725 5.226 30 20 GKED CC(C)(C)CCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 739157298 SWHXCNUWOMFZHF-ZDUSSCGKSA-N 381.328 6.119 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccnc4ccccc34)n2)cc1 741111431 NRENDIFRUVSSFU-JPMGXVIASA-N 395.487 5.556 30 20 GKED Cc1cc(C)cc(-c2ccc(C=Nn3cnc4sc(C)c(C)c4c3=O)cc2)c1 741454239 ADLDIAJYFYZESX-UHFFFAOYSA-N 387.508 5.241 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCSc3ccccc32)cc1 741901361 HLBIUSWUHCZIRC-YADHBBJMSA-N 384.504 5.560 30 20 GKED CCCCC/C(C=Nn1c(S)nnc1[C@@H]1CCCCO1)=C/c1ccccc1 743451371 FCBQRZXTTCCTGL-NYLSERQBSA-N 384.549 5.306 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)OCc2ccc(-c3ccccc3C#N)cc2)s1 745445894 CEMXLTVPLGYRFK-HNNXBMFYSA-N 392.480 5.136 30 20 GKED O=C(/C=C/c1coc(-c2ccccc2)n1)c1ccc(-c2ccc(C(=O)O)o2)cc1 749891907 OWZVXYPEGDQQFI-ZHACJKMWSA-N 385.375 5.196 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3c[nH]c4cccc(F)c34)c2)c1 761311984 WUFJNUICLYBTFP-UHFFFAOYSA-N 385.398 5.010 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCC[C@@H]3c3ccccc3)cn2)c1 762814442 ZIRALRAMKUCEPQ-JOCHJYFZSA-N 398.466 5.505 30 20 GKED C[C@@H](OC(=O)CSCc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1 767983170 KOUBFDVOUPEGIV-OAHLLOKOSA-N 394.521 5.219 30 20 GKED Cc1cc(C(=O)Nc2ccc(C#N)cc2Cl)ccc1NC(=O)OC(C)(C)C 772169974 PSFGFPMSEHQEEC-UHFFFAOYSA-N 385.851 5.119 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCCc3ccc(Cl)cc32)ccc1OC 772984986 HMKPMJVKROEIRD-UYAOXDASSA-N 384.907 5.197 30 20 GKED N#CCCN(C(=O)c1cc(Cl)nc2ccccc12)C12CC3CC(CC(C3)C1)C2 776910221 RKUAJNQXMKLLEL-UHFFFAOYSA-N 393.918 5.213 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cc(C)cc(C)c3)n2)cc1 777311058 WRDLJKJKEXDVCR-HXUWFJFHSA-N 390.508 5.245 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCc1cccc(C#N)c1 781721807 ZVVCXFWLVUFRRP-UHFFFAOYSA-N 387.222 5.186 30 20 GKED Cc1cccc(-c2nnc([C@@H](C)Sc3ccc(C#N)c(C(F)(F)F)c3)o2)c1 782233752 FGIJGAZVEYQKAB-GFCCVEGCSA-N 389.402 5.789 30 20 GKED COc1cc(C2(C(=O)[C@@H](C#N)c3nccc4ccccc34)CCCC2)ccc1C 792103952 VCXHJXBYQZARKO-NRFANRHFSA-N 384.479 5.240 30 20 GKED CCOC(=O)/C(=C/c1cc(C#N)cs1)c1nc(-c2ccc(C)cc2)cs1 797406614 VSIWMMCWXJDXNN-RQZCQDPDSA-N 380.494 5.155 30 20 GKED Cc1nn(-c2ccccn2)c(C)c1/C=C\C(=O)c1ccc(SCC(F)F)cc1 802705556 KMTBYTCHWFXDNA-KHPPLWFESA-N 399.466 5.137 30 20 GKED CC(=NNc1nccnc1C1CCC1)c1sc(-c2ccc(Cl)cc2)nc1C 807991180 IWKAJHOJBPMOIV-UHFFFAOYSA-N 397.935 5.666 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3ccc(Cl)c(F)c3)n2)cc1 810531830 MJHDDIYZBJYDIL-HNNXBMFYSA-N 384.863 5.330 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813214792 DOESSAPHVVVGSY-ZYHUDNBSSA-N 384.810 5.111 30 20 GKED COc1cc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)ccc1SC(F)F 815636047 NYOMTNUERGPYBG-YJBOKZPZSA-N 390.499 6.096 30 20 GKED CC(C)(C)Oc1ccc(NCc2nnc(-c3ccc(Cl)cc3)o2)cc1C#N 834634531 BTZJOFPKTZBFST-UHFFFAOYSA-N 382.851 5.051 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cc(Cl)ncc1Cl)c2C#N 839389342 OJRYSGHKGYBDNO-BDAKNGLRSA-N 380.300 5.260 30 20 GKED N#C[C@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1nc(C2CC2)cs1 842942045 MFULXUGPBQPTLG-LJQANCHMSA-N 380.513 5.151 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)[C@@H](O)c1ccccc1 878676270 PBRRPIQPINMNOT-LLGFUMIMSA-N 397.544 5.057 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(OC(F)F)cc2)cc1 915086534 KUFPWNURWWZZGC-NRFANRHFSA-N 392.405 5.125 30 20 GKED CCOc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1OC 915086645 MDGPWGOEDUHBAN-NRFANRHFSA-N 386.451 5.002 30 20 GKED COc1ccccc1CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353627 PPDCWLZANLFUPS-JOCHJYFZSA-N 385.467 5.015 30 20 GKED COc1cccc(COc2cccc(Cl)c2CNCc2ccc(C#N)cc2)c1 916835036 CMLYCEHUTRJXIO-UHFFFAOYSA-N 392.886 5.089 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 916847818 QXFDIZAFYOUIFQ-CYBMUJFWSA-N 389.307 5.802 30 20 GKED CCCCOc1ccc(-c2nnc(CON=Cc3ccc(C(C)C)cc3)o2)cc1 917395432 OTKMWFCOWALNGO-UHFFFAOYSA-N 393.487 5.590 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)sc2ccc(F)cc12 920112942 NOEOJKQCFPZXSR-ZDUSSCGKSA-N 399.397 5.584 30 20 GKED Cc1ccc(Cl)cc1NN=Cc1ccc(OCc2cc(C)c(C(=O)O)o2)cc1 1776106463 HCAJGCBRTFFKRS-UHFFFAOYSA-N 398.846 5.273 30 20 GKED C=CCOc1ccc(CN[C@]2(C(=O)O)CCC(C)(C)c3ccccc32)cc1Cl 1776185596 ATHIVUFTOWKWHN-HSZRJFAPSA-N 399.918 5.046 30 20 GKED C[C@@H]1/C(=C/c2cccc(C(=O)O)c2Cl)C(=O)c2cccc(Br)c21 1776587102 QEGYLAQDSMBOAX-PGEKAQRJSA-N 391.648 5.184 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)Cc2ccccc2)c1 1776787400 BKMZKEIHHWUGCF-QFIPXVFZSA-N 383.532 5.211 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccco3)n2C2CCCCC2)c(F)c1 11152424 ACHGKEFDFHNWRU-UHFFFAOYSA-N 382.464 5.346 30 20 GKED C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccc(C#N)cc1 31436146 FSUWJYCLARKTNS-ZDUSSCGKSA-N 389.505 5.387 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2nnc(-c3ccccc3)o2)n1 36781103 ZCFGWGDWUIHNSY-NSHDSACASA-N 390.390 5.184 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 51534129 QIYZELJUOZYJIN-CRAIPNDOSA-N 378.522 5.308 30 20 GKED CCOc1ccc(-c2noc(CNc3ccccc3S[C@H](C)CC#N)n2)cc1 66861324 SHDPVHAXEIDQBS-OAHLLOKOSA-N 394.500 5.142 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccco2)Cc2ccccc2O)c1 67319019 LQSUXQRHFGZQFR-UHFFFAOYSA-N 392.455 5.174 30 20 GKED C[C@@H](NC(=O)CSCc1ccc(C#N)cc1)c1cc(F)c(Cl)cc1Cl 107695788 HNDABUPJVZTRSF-LLVKDONJSA-N 397.302 5.115 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1CCc1ccccc1 108530431 RPFCAUWXVGCAME-QUCCMNQESA-N 393.556 5.567 30 20 GKED C[C@@H](Nc1c(F)cc(C#N)cc1F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 109809265 QRNPGLUHMWZLRR-CYBMUJFWSA-N 395.384 5.401 30 20 GKED N#C[C@@H](C(=O)c1ccc2ncccc2c1)c1nc(-c2c(F)cccc2F)cs1 120917142 DWWYGXBIUBSAOL-AWEZNQCLSA-N 391.402 5.127 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 123181042 KUWWAHUMMYMMCC-HSZRJFAPSA-N 398.466 5.423 30 20 GKED C=C[C@@H](CC(=O)Nc1ccccc1NC(=O)c1cccs1)c1ccccc1 126475389 LIMUKPLTKZKVFW-INIZCTEOSA-N 376.481 5.299 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1cc(-c2ccccn2)ccc1Cl 165639612 IOOALIZAZCYTMA-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)Nc1ccc(CC#N)cc1 175049162 VMEHFZBRRNCQQE-ZDUSSCGKSA-N 381.888 5.074 30 20 GKED N#CCC[C@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccccc1 179192326 JBPNIZFHKNFKQS-NRFANRHFSA-N 375.859 5.177 30 20 GKED CC[C@H](CSC)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 181200021 PAJJIUXKKRHNNJ-LJQANCHMSA-N 397.544 5.051 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 185482426 LTEZTIGEQHESBA-YVEFUNNKSA-N 379.476 5.058 30 20 GKED C=CCN(C(=O)c1ccc(C)c(C(C)=O)c1)c1nc(-c2ccccc2)cs1 193008078 LMZPMZVHRFCKNI-UHFFFAOYSA-N 376.481 5.154 30 20 GKED Cc1cccc(COc2ccc(CNCc3ccc(O[C@@H](C)C#N)cc3)cc2)c1 237495074 RHFUDKOIOSXNLD-FQEVSTJZSA-N 386.495 5.155 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)cs1)C1CC1 255194409 HYCLTWGVQKUWSQ-RAXLEYEMSA-N 388.492 5.222 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 303384955 WZEYQFMMCARBJN-GOTSBHOMSA-N 384.435 5.101 30 20 GKED CC(C)c1ccccc1N=C(O)[C@H](C)N1CCC[C@@H](c2ncc3n2CCCC3)C1 328665572 ZGLGXCYQBBIAFV-RBUKOAKNSA-N 394.563 5.199 30 20 GKED CC(C)[C@H](/N=C(/O)C12CC3CC(CC(C3)C1)C2)C(O)=Nc1cccc2ocnc12 330088028 NSFOBVYKGWTTFS-HAVBXNNZSA-N 395.503 5.613 30 20 GKED C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[S@](=O)CCC1(C#N)CCCCC1 417149989 PHBOBSVKHRDHGB-RMKBEBRYSA-N 391.924 5.064 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1SCCc2ccccc21 428877760 AATSWTLADICSPO-YWZLYKJASA-N 397.569 5.090 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)ccc1OC1CCCC1)c1nc2ccccc2o1 429733372 WEPNIWQCSKBCBT-INIZCTEOSA-N 380.831 5.293 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(CC#N)cc2)ccc1Br 431583868 UEQYAOODFTYIEP-LJQANCHMSA-N 398.304 5.193 30 20 GKED N#CCCC[C@@H](NC(=O)NCC1(c2cccc(Cl)c2)CC1)c1ccccc1 431973534 QELBXFLNODBVBH-HXUWFJFHSA-N 381.907 5.106 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(OC2CCCC2)c1)c1ccccc1 432699308 MPWLIWJJNVKJFF-QFIPXVFZSA-N 377.488 5.565 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccccn2)n1-c1ccccc1 436210128 YQGZVILPHMBJCE-UHFFFAOYSA-N 377.517 5.141 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2nc(C)c(C#N)cc2Cl)cn1 461782233 AEEDQQNTJIRONC-UHFFFAOYSA-N 394.862 5.113 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCc2cncc3ccccc23)cc1 462498000 DJTSGKHALGOKTL-UHFFFAOYSA-N 393.446 5.470 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H](C)c1cccc(C)c1 463033958 DDKMKPFTPOHPCR-MRXNPFEDSA-N 383.492 5.344 30 20 GKED CCC(C)(C)OCc1cccc(NCC(=O)N(CCC#N)c2ccccc2)c1C 470545279 CVHWWTNOTGQBAL-UHFFFAOYSA-N 393.531 5.059 30 20 GKED N#Cc1csc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 474275329 PAXNLZNRDIMCSJ-LBPRGKRZSA-N 392.324 5.062 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)C[C@@H](CC#N)c3ccccc3)oc12 474293802 RXSXJRXZOKHNFC-SJLPKXTDSA-N 376.456 5.096 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Oc3ccncc3)c(Cl)c2)n1 474445364 MAWZKYIFBQYFBP-OAHLLOKOSA-N 397.887 5.597 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCc2ccccn2)cc1 476789094 UGQZEUNYFIJEMN-UHFFFAOYSA-N 386.495 5.765 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2cccc(F)c2F)nc1)c1ccccc1 477119189 HIUYNEQNQDROCL-INIZCTEOSA-N 393.393 5.178 30 20 GKED C=C(C)[C@@H](NCc1ccc(C#N)cc1Br)c1ccc(F)c(F)c1 481591018 FEOWPAQEBOBMGT-GOSISDBHSA-N 377.232 5.006 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 482550972 KHRBIMSCRCHMDK-QGZVFWFLSA-N 375.925 5.120 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 486755620 QRNCFGCAUPXFIW-QGZVFWFLSA-N 377.856 5.181 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1C)c1ccccc1 488629355 MKPNOFTXFWZSQP-JOCHJYFZSA-N 390.527 5.356 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cccc(C#N)c2)c(C(F)(F)F)c1 499580091 GXFPADKZYSXGBG-GFCCVEGCSA-N 378.419 5.720 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1 504137605 AJBQYWBNRDBLQI-IRLDBZIGSA-N 398.526 5.027 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ccc(C#N)cc3[N+](=O)[O-])s2)cc1 505769346 QVNVPSFTIALLLQ-LBPRGKRZSA-N 394.456 5.080 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H]2C(C)C)cc1 508273977 LVJYVXKWGQPJKE-IBGZPJMESA-N 379.460 5.011 30 20 GKED CCC(CC)N(C(=O)CSc1ccc(C#N)cc1)[C@@H]1CCCc2cccnc21 511306975 PVJSBTFPJHNKHY-OAQYLSRUSA-N 393.556 5.140 30 20 GKED CC(C)c1ccc(CN(C)C(=O)c2ccc(COc3ccccc3C#N)o2)cc1 511316162 RLUJJXUYNWOBOI-UHFFFAOYSA-N 388.467 5.126 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)n(C(C)C)c3C)n2)cc1 517800759 GLETVBIKPIOZLZ-LJQANCHMSA-N 393.512 5.308 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)cc1 522575541 UCRZDCMBEYIVNV-INIZCTEOSA-N 390.439 5.160 30 20 GKED CCCN(CC1CC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 524441516 MTBZMDDETBZXME-UHFFFAOYSA-N 377.488 5.100 30 20 GKED Cc1csc([C@H](NCc2cccc(OCc3ccccc3C#N)c2)C2CC2)n1 525709327 QJJOLIXFGZQPBB-JOCHJYFZSA-N 389.524 5.143 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(CC#N)cc2)c(C(F)(F)F)c1 534007438 YGDJIRASWZKHMR-CYBMUJFWSA-N 392.446 5.914 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C1CC1 534229827 OPQCVJRNBBMPOB-GJZGRUSLSA-N 397.548 5.770 30 20 GKED C=C(C)[C@H](CC(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C)OCC 534469383 LPQJMXXMCIQSPX-FQEVSTJZSA-N 394.540 5.949 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC=C(C(F)(F)F)CC1 534540639 CQAWEEOIKDVMOQ-UHFFFAOYSA-N 391.233 5.059 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)c1 538998677 WEFRMFNGAOIQNJ-FQEVSTJZSA-N 395.462 5.427 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](C)c1cccc(C#N)c1 540594403 UAQVFPDYPIWYOU-KGLIPLIRSA-N 381.932 6.055 30 20 GKED C=C(C)COc1cccc(N[C@H](C)CC(=O)Nc2ccccc2C(F)(F)F)c1 542139226 XTGBQBQRTBZKTO-OAHLLOKOSA-N 392.421 5.490 30 20 GKED C=CCC[C@H](NC(=O)NC[C@@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 542536221 DLAJMNDQRIQRBI-CJNGLKHVSA-N 397.466 5.272 30 20 GKED CCCn1ncc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C1CC1 543919035 URGAXNCQPUPVRL-KRWDZBQOSA-N 398.510 5.200 30 20 GKED CC(C)n1ncc2cc(NCc3cccc(OCc4cccc(C#N)c4)c3)cnc21 545349954 DZDXVYMLUZSYHQ-UHFFFAOYSA-N 397.482 5.075 30 20 GKED COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554119850 FVPHZIBUJOFNTC-LAUBAEHRSA-N 391.515 5.501 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3ccccc3Cl)o2)CC1 558623458 UZMMSVUILZRSKN-UHFFFAOYSA-N 377.875 5.052 30 20 GKED Cc1cc(-c2ncco2)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 560688509 HCIVTBQJIHMQOU-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2ccccn2)cc1 564441801 GVJBFVUVAVINGU-UHFFFAOYSA-N 384.483 5.310 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1ccccc1SC[C@H](C)C#N 565678536 OJYCTXXXAVSLCH-SJORKVTESA-N 389.524 5.304 30 20 GKED N#Cc1c(F)cccc1/C=C1\CCn2c1nc1scc(-c3ccccc3)c1c2=O 567530641 AYBFXBZFPDQLRO-LFIBNONCSA-N 399.450 5.080 30 20 GKED C=CCn1c(S[C@@H](CCOC)c2ccccc2)nnc1-c1ccccc1C 570990765 NSVJKFFZXPSTOD-FQEVSTJZSA-N 379.529 5.309 30 20 GKED C[C@H]1CCc2onc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)c2C1 577582993 PUZFDCCTMLEWBC-NHYWBVRUSA-N 397.887 5.066 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3sc4ccc(C#N)cc4c3C)cc2)oc1C 589983438 CJVHPEAVRITYLB-UHFFFAOYSA-N 387.464 5.606 30 20 GKED N#CCCC[C@@H](NCc1cn(Cc2ccccc2)c2ccccc12)c1ccccc1 590068605 GGAFFSHAVQJRHB-AREMUKBSSA-N 393.534 6.214 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 590150885 RTDKBUQHQWFGPE-UHFFFAOYSA-N 377.419 5.372 30 20 GKED N#CC[C@@H]1CCCN(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 596534728 QLHQEFJIHMDMBX-YVEFUNNKSA-N 399.844 5.145 30 20 GKED C[C@H](Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1cccc(C#N)c1 600851058 WKASRFXTADVUBC-ZDUSSCGKSA-N 384.266 6.225 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cncc3ccccc23)cc1Cl 603962369 ROUMQOMHLILYIF-OAQYLSRUSA-N 397.865 5.796 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2csc3ccccc23)cc1 604003866 MPBGBVGZSBANGI-UHFFFAOYSA-N 398.487 5.799 30 20 GKED Cc1nc(NC(=O)[C@H](C)c2c(Cl)cccc2Cl)sc1SCC#N 604566994 CBMDMSWOONELEX-MRVPVSSYSA-N 386.329 5.116 30 20 GKED CCCCN(CC)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609080595 PMBKQNVHAOVYHI-UHFFFAOYSA-N 385.895 5.445 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCCC1 609437039 LZIVCJZYJJJYMS-HTAPYJJXSA-N 393.556 6.134 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CNc2cccc(Cl)c2)cc1 609622277 UBUBLUDAQHBUMI-UHFFFAOYSA-N 377.831 5.055 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3c[nH]c4ccc(F)cc34)cc2)cc1 609643206 CZUCGQPVXFFCCQ-UHFFFAOYSA-N 385.398 5.152 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCSc3ccccc32)cc1 610226033 BGPKLRGKAJIFHD-HXUWFJFHSA-N 386.476 5.569 30 20 GKED N#CCCCOc1cccc(CNc2ccccc2SCC(F)(F)F)c1 610909795 SXETYWWEPZEKBY-UHFFFAOYSA-N 380.435 5.636 30 20 GKED N#Cc1cc(CSc2ncnc3scc(-c4ccc(F)cc4)c23)ccn1 610956947 DMGIPHIQCXFQDT-UHFFFAOYSA-N 378.457 5.056 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1)C1CC1 611095309 ONTZLUGEOCTTPJ-ZDUSSCGKSA-N 394.475 5.258 30 20 GKED CC(C)c1c(C(=O)N[C@@H](C)c2cccc(C#N)c2)cnn1-c1ccccc1Cl 616357444 GHDUEXFPYSXBSK-HNNXBMFYSA-N 392.890 5.012 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)cc2cccnc12 619126114 FBIFQYYRRDGPNN-UHFFFAOYSA-N 396.306 5.157 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)F 619312651 ZVUMORYVUSDDRI-HNNXBMFYSA-N 377.822 5.161 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@@H]1CCC(F)(F)C1 675683354 RGQBTXPXHYWQNP-SECBINFHSA-N 376.247 5.034 30 20 GKED CC(C)[C@@H](C(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 677301345 WBHMWVPEGJMRKP-VNHYZAJKSA-N 399.350 5.155 30 20 GKED CC(C)c1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)C2CC2)cc1 726447615 XMRSPXIHJJSZNP-UHFFFAOYSA-N 383.948 5.696 30 20 GKED C[C@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 726474143 AOGYEAMFXHWDAG-AWEZNQCLSA-N 379.510 5.460 30 20 GKED CC(=NNc1cnc2ccccc2n1)c1ccc2c(c1)Nc1ccccc1S2 727256862 XDQYOKFDIHDIHC-UHFFFAOYSA-N 383.480 5.674 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2cscn2)c2ccccc2)cc1Cl 731160781 CDURKUZEJFVHQV-UHFFFAOYSA-N 384.917 5.072 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cc(C)n([C@H](C)c4ccccc4)c3C)[nH]c12 735791933 DJECBZHTHHJYIX-DYESRHJHSA-N 396.494 5.389 30 20 GKED C#Cc1cccc(NC(=O)N(Cc2ccc(-c3ccccc3OC)cc2)C(C)C)c1 743083926 GNCSFQWWRYBPRI-UHFFFAOYSA-N 398.506 5.786 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccc2ccccc2n1 744015366 OYAHOGUDUPGIAO-KURKYZTESA-N 381.262 5.522 30 20 GKED N#C[C@H](C(=O)c1cccc2cc[nH]c12)c1nc2cc(C(F)(F)F)ccc2s1 744037644 BHQRWECVUWMQDM-CYBMUJFWSA-N 385.370 5.286 30 20 GKED Cc1cc(-c2noc([C@@H](C)ON=Cc3ccccc3C(F)(F)F)n2)ccc1F 744443786 OROVCMZAOIZEOC-GFCCVEGCSA-N 393.340 5.315 30 20 GKED O=C(Cc1ccc(F)cc1)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746441838 ZLPXPYYCMYVTPZ-OAHLLOKOSA-N 380.259 5.234 30 20 GKED COc1ccccc1C(C)(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746778623 OXNSRYFGQOSWMA-OAQYLSRUSA-N 384.479 5.267 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 747108144 MFJBKPCJXNYSIY-ZYHUDNBSSA-N 395.673 5.098 30 20 GKED CC(=NNc1cc(C(F)(F)F)ccc1F)c1c(Cl)nc2sccn12 753947888 UFXZUQBQAQJPDQ-UHFFFAOYSA-N 376.766 5.043 30 20 GKED CSc1cc(O)ccc1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 754496350 YEYYZPCQLYNHRJ-UHFFFAOYSA-N 390.464 5.339 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)OCC 756468585 BUVCMXCTQBDCBM-IAQYHMDHSA-N 399.274 5.019 30 20 GKED C#CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 757761535 NALSHLXIYMOVOH-ZEQRLZLVSA-N 379.463 5.228 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3cccc(Cl)c3Cl)o2)cc1C 758410938 OVCHCLGUYJYNKF-CYBMUJFWSA-N 390.270 5.772 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccc(F)cc1OCC#N 761669561 VHQXSBWFKSDCII-NSHDSACASA-N 396.249 5.260 30 20 GKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)c1nc(-c2ccccc2)no1 762810795 DKLJHROSUGMTKF-CYBMUJFWSA-N 385.876 5.287 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)Cc1coc(-c2ccc(Cl)cc2)n1 768023494 DINGYFVQQQNMSN-UHFFFAOYSA-N 394.858 5.082 30 20 GKED Cc1ccc(F)c(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 770177873 INFQAQXPGAHUTR-JOCHJYFZSA-N 387.458 5.454 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3cscc3Cl)SC2=S)cc1Cl 771849916 ITIGAELSQPRQJE-QLKAYGNNSA-N 397.333 5.332 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCSc3ccc(Cl)cc32)c1 772983845 MHLYTMISQURENS-XLIONFOSSA-N 386.948 5.738 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Cl)c(N)c(Cl)c2)c1 774450274 SZFUCRYMLJIVAG-IUODEOHRSA-N 378.303 5.107 30 20 GKED C=CCC[C@H](C(=O)OCc1nnc(-c2ccccc2Cl)o1)c1ccccc1 777645724 ZHFOGXAMBHAHTF-INIZCTEOSA-N 382.847 5.183 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2cccc(N3CCOC3=O)c2C)cc1 777700468 KNERFFYSUNMERK-INIZCTEOSA-N 386.879 5.256 30 20 GKED C=CCC[C@H](C(=O)OCc1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 778551273 HTNIJYAIRWJFPR-SFHVURJKSA-N 382.847 5.183 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 779075155 XFPHZIYJJMMCCX-UHFFFAOYSA-N 399.491 5.198 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782015021 YBISYPLOASMFKZ-QGZVFWFLSA-N 375.394 5.195 30 20 GKED C[C@@H]1COc2ccccc2CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782553285 OCLFPAVPLQQKIX-JPYJTQIMSA-N 397.478 5.157 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1cnc(-c2ccco2)s1 789126962 GNHQOOTZARULJI-YFVJMOTDSA-N 378.409 5.141 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(Cl)c2)CCCC1)c1cnc2ccccc2n1 792110424 LPRPFFJKEAMNGT-GOSISDBHSA-N 389.886 5.263 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 793042050 FNWBDRSOYGEOTD-ISKFKSNPSA-N 379.463 5.368 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)OCCCC2(C#N)CCOCC2)c1 800195810 XLUSLWAVMRAGQG-UHFFFAOYSA-N 387.545 5.287 30 20 GKED COc1cccc(O)c1C=Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 812396099 ZLOHMPOWZUSNNW-SFHVURJKSA-N 376.843 5.460 30 20 GKED FC(F)(F)c1cc(NN=C2CC[C@H](c3ccccc3)C2)nc(-c2ccccn2)n1 814848051 NBPALGIDXCZECH-HNNXBMFYSA-N 397.404 5.293 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)OC(=O)[C@H](C)CC#N 850855524 YCESRTRAETXNEU-PWSUYJOCSA-N 393.306 5.035 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C(C)(C)c2cccc(C(F)(F)F)n2)s1 870339609 LEBLBJUNEFKNIT-NSHDSACASA-N 395.450 5.008 30 20 GKED O=C(c1ccc(-c2ccccc2OC(F)(F)F)o1)N(O)Cc1ccc(F)cc1 901371990 LXQUBFLIJYCVSP-UHFFFAOYSA-N 395.308 5.016 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c(Cl)cccc2Cl)cc1 915087357 SGAOUGJSRAYNNE-IBGZPJMESA-N 395.289 5.830 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2cccnc2)cc1 915351968 FAOAQWZMCCAXPM-XZOQPEGZSA-N 382.467 5.106 30 20 GKED O=C(O)Cn1cc(C=NNc2c(Cl)cc(Cl)cc2Cl)c2ccccc21 1776014794 ZPUOGLLKSILDRP-UHFFFAOYSA-N 396.661 5.132 30 20 GKED O=C(O)c1ccc(NN=CC(c2ccc(F)cc2)c2ccc(F)cc2)cc1F 1776075171 ROKBRFCLBKAASW-UHFFFAOYSA-N 384.357 5.032 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C\C(=O)c3ccc4ccccc4c3)s2)c1 1776131687 YXTLTMNBHLGWIU-BENRWUELSA-N 384.456 6.163 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2cccc(OC)c2)cc1 1776788262 VHJDIBUPGQFALL-QHCPKHFHSA-N 399.531 5.350 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777038392 QVGOSKWETAHKTD-RZNTYIFUSA-N 389.426 5.153 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)ccc1Cl 1777263517 SNWNFIFNPBZYAE-PQMHYQBVSA-N 392.838 5.610 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1777342067 VPCAFVFIZSAAEU-YHSGTQGLSA-N 398.458 5.509 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCOc4ccc(F)cc4C3=O)cc2)cc1 1777670990 ONGLLJKTVTXSCK-UYRXBGFRSA-N 388.394 5.240 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(C(F)(F)F)cs3)c2c1 1777685476 FPRKBWQMOXGGRE-HNQUOIGGSA-N 382.384 5.576 30 20 GKED COc1ccc(-c2nnc(S[C@H](C)C#N)n2-c2ccccc2C(C)C)cc1 3484212 FNISAYUNHBMPAD-OAHLLOKOSA-N 378.501 5.070 30 20 GKED COCc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 41514744 HUUCPDLICCPBMD-QGZVFWFLSA-N 382.872 5.100 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cccc(CC#N)c2)cc1 97365002 JUSPUNRHNQSFRV-UHFFFAOYSA-N 392.842 5.459 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(O[C@H](C)C#N)cc1 105494654 WEZMPHIFYMTIPT-HUUCEWRRSA-N 395.503 5.399 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1c[nH]c2cc(Cl)ccc12 108239255 WQNAVGDZDWGGQW-CYBMUJFWSA-N 383.904 5.254 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nc(-c2cccc(Cl)c2)no1 108354719 VSJNNAAPHCUYOZ-CYBMUJFWSA-N 384.892 5.254 30 20 GKED N#Cc1nc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)ccc1Cl 111218246 KGOKEUSLBNSGAM-UHFFFAOYSA-N 389.311 5.254 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1cc(-c2ccccn2)ccc1Cl 119342429 GSEBSZJHPKZENR-HSZRJFAPSA-N 389.886 5.047 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1)c1ccccc1 134932770 ZXKKZBRMTKAYJV-WTYVLRPYSA-N 389.520 5.293 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc(NC(=O)C3CC3)cc2)c1 155850516 ZQQOJPYHIIWOBM-UHFFFAOYSA-N 397.478 5.098 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCSc2ccccc21 171741488 IFXAAXDALSLZIY-ZBFHGGJFSA-N 383.542 5.297 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2)ccc1OC 174091887 LTXOICOBBHHLJL-XJKSGUPXSA-N 393.314 5.534 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CC(F)(F)F)c1 174302874 RZAUSDKZHDNVKH-UHFFFAOYSA-N 375.394 5.107 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(F)cc1OCC(F)F 179609464 ILWWDDMQYDHAQH-UHFFFAOYSA-N 396.368 5.261 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cc(-c2cccs2)nc2ccccc12 182044374 MEBWQKWBIAFAFW-HNNXBMFYSA-N 399.475 5.506 30 20 GKED C[C@@H](C#N)OC(=O)/C(=C\c1cccc(OCc2ccccc2)c1)c1cccs1 213832585 DFBCXFSLNWMYHB-XESZTULISA-N 389.476 5.323 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@@H](C)C1 246766020 QYSUQUJGTOGCCV-NLWGTHIKSA-N 393.556 5.738 30 20 GKED COc1ccccc1-c1csc(C2CCN(c3ccc(C#N)cc3F)CC2)n1 302708741 HLIVUDGIRXVUBH-UHFFFAOYSA-N 393.487 5.213 30 20 GKED C[C@@H](C(O)=Nc1ccccc1NC12CC3CC(CC(C3)C1)C2)c1ncccc1F 329914491 XVUZDXWZHABBOA-LJQCHSNASA-N 393.506 5.993 30 20 GKED Cc1ccc(N=C(O)N2[C@H]3CC[C@H]2c2ccccc23)c(-c2nc(C3CC3)no2)c1 329922107 GENMAVQDTQDANZ-PMACEKPBSA-N 386.455 5.360 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@H](CC2CC2)c2cc(F)cc(Br)c2)CC(O)=N1 330284136 XCAVYJNQMVGDIO-AKWBHNSASA-N 397.288 5.141 30 20 GKED Cc1cc(CNc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)ncn1 427410235 AXCZGTBDPYVVSY-UHFFFAOYSA-N 384.361 5.080 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(CC(F)(F)F)C3CCC3)cc2)cc1 427924727 QRXHRSZSLYZVRT-UHFFFAOYSA-N 388.389 5.102 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(COc3ccccc3)cc2)s1 430592213 PRZRRXAFXSLPPW-LJQANCHMSA-N 390.508 5.510 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1ccccc1N1CCCC1)c1ccccc1 435104013 DASBIASULGCQIR-JOCHJYFZSA-N 377.532 5.136 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)Nc1ccc(F)c(C#N)c1 435682780 FWEDTJFHKZGTOE-UHFFFAOYSA-N 390.201 5.220 30 20 GKED C[C@H](NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1 437839613 VACDLCVETDHFEK-ZWKOTPCHSA-N 383.495 5.708 30 20 GKED C=CC[C@@H]1N(Cc2csc(N(C(C)=O)c3ccccc3)n2)CCCC1(C)C 444784461 VSXUMFIKFIUUNI-FQEVSTJZSA-N 383.561 5.394 30 20 GKED C[C@H](NCC1(CF)CCOCC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 453306850 JPRJWIXKSYVPBH-NSHDSACASA-N 387.339 5.141 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)C2CC2)o1 455758734 VSSPZIUNXLKYIW-GUYCJALGSA-N 383.879 5.319 30 20 GKED CC(C)c1cc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)on1 460341944 DGSWYZUKCWXJHH-UHFFFAOYSA-N 379.847 5.170 30 20 GKED N#CCCN(C(=O)c1cnc(-c2ccccc2)s1)C12CC3CC(CC(C3)C1)C2 460472978 TXHZHVKJKVSLON-UHFFFAOYSA-N 391.540 5.135 30 20 GKED CC(C)c1ccc(C[C@H]2CCN(C(=O)c3cccc(SCC#N)c3)C2)cc1 461200000 FBVAFTDDUMQYPU-LJQANCHMSA-N 378.541 5.130 30 20 GKED CC(C)(C)c1cc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)c(C#N)s1 464406740 PELOOIXGJZTKGY-UHFFFAOYSA-N 388.361 5.467 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CCc1ccc(-c2ccccc2)o1 464958684 GBAJWAKLLBCSAH-XZOQPEGZSA-N 384.479 5.178 30 20 GKED COc1ccc(-c2cnc(CNc3ccccc3Oc3ncccc3C#N)o2)cc1 467270877 FMRPRYYUUIVRPQ-UHFFFAOYSA-N 398.422 5.021 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1Cc1c(F)cccc1Cl)c1ccccc1 474968153 NDIXLUJRGGRJAI-MSOLQXFVSA-N 384.882 5.100 30 20 GKED N#Cc1ccc(CN(Cc2nc(-c3c(F)cccc3F)cs2)C2CC2)cc1 480794486 JITYHOXCJOPURM-UHFFFAOYSA-N 381.451 5.125 30 20 GKED C=CCn1c(SCc2ccc(SC)c(OC)c2)nnc1-c1ccccc1C 481396918 GRYNVYSGLNSOSN-UHFFFAOYSA-N 397.569 5.462 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccc2c(c1)CCC2 481796393 PWNONIQAARVEMO-QGZVFWFLSA-N 394.540 5.225 30 20 GKED CC(C)(C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)cc1 482817100 KTARXDROIKVIPC-UHFFFAOYSA-N 388.442 5.193 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F 483616965 COGDDNMREODJJL-KFWWJZLASA-N 399.482 5.429 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 483707771 GRBFGAQAGROHIB-ZDUSSCGKSA-N 399.903 5.627 30 20 GKED COc1ccc([C@H](NCCCSCC#N)c2ccc(C(F)(F)F)cc2)cc1 492426262 UZNXBWBTTZHDAC-LJQANCHMSA-N 394.462 5.040 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1Cl 496028916 OTZGSYQKGJFYFP-HNNXBMFYSA-N 382.872 5.271 30 20 GKED COc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c(F)c1 498744747 NOHAFIRLCGESGG-GFCCVEGCSA-N 386.492 5.171 30 20 GKED C=CCOc1ccc(CNc2ccc(F)c(NC(=O)Cc3ccccc3)c2)cc1 501022349 YKXQOBBPVMHNRV-UHFFFAOYSA-N 390.458 5.184 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@H]1CCCC(F)(F)C1 503341459 CTNXXTAKUHDJKN-NSHDSACASA-N 392.393 5.475 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(CCC#N)CCC(C)C 505169487 NYRMEJVUXKMEEU-UHFFFAOYSA-N 381.954 5.235 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)oc2ccc(F)cc12 505336165 ACOCLVXDPFEEKJ-CQSZACIVSA-N 377.202 5.182 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 505775388 AWOYZQLNZTYKPB-QGZVFWFLSA-N 381.888 5.272 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1 506642288 KHBRVGZDZBEDBM-UHFFFAOYSA-N 399.494 5.202 30 20 GKED C[C@@H](Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1ccc(C#N)cc1F 512276460 DCUXKEXKUIZYNL-QGZVFWFLSA-N 399.469 5.002 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1csc(-c2ccc(C)o2)n1 513038280 QUISIZDOYXMYRE-UHFFFAOYSA-N 392.933 5.184 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2cccnc12 514472029 UPBPDRWVWSLEHO-UHFFFAOYSA-N 381.460 5.510 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)o1 520803067 SLQJZYROAPFMOU-UHFFFAOYSA-N 376.481 5.524 30 20 GKED CCOc1ccc(OC(C)(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 520837304 QEWDIAOUNRYYDY-MRXNPFEDSA-N 398.528 5.133 30 20 GKED C=CCn1c(S[C@H](CC)C(=O)c2ccccc2)nnc1-c1cccc(C)c1 523111857 XLROXWZGYUWPLV-LJQANCHMSA-N 377.513 5.193 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccccc2Cl)nc1 530591713 DONKWWRIFSSDOA-UHFFFAOYSA-N 393.830 5.050 30 20 GKED Cc1c(Cl)cccc1-n1ccnc1SCCCC1(C#N)CCOCC1 540769429 LAFVQLMCDKEXPR-UHFFFAOYSA-N 375.925 5.027 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccc4[nH]ccc4c3)no2)c2ccccc21 545033785 OZPDIKYUKQHPAH-CLFYSBASSA-N 379.423 5.257 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1Cl 548607357 AINNKXXQIHKKJL-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1)c1ccccc1 557488058 FQFFJVYHDJYTMJ-MQNAVGNWSA-N 376.500 5.136 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1c1ccccc1 558340805 PAXVNMAMXVVTPV-YTQUADARSA-N 379.529 5.539 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)C1 563572560 MVVCVTIMFNIUQP-KXBFYZLASA-N 383.492 5.322 30 20 GKED Cc1cc(Br)ccc1-c1noc(C[C@@H](CC#N)c2ccccc2)n1 564274472 JDCOSGAJTMGEJX-OAHLLOKOSA-N 382.261 5.048 30 20 GKED Cc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c(-c2cnn(C)c2)c1 566532781 YKCONFKYMANVBA-UHFFFAOYSA-N 395.466 5.067 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)c(C)c1 570359737 JUFCEBWRAIMMOV-HNNXBMFYSA-N 382.504 5.567 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(OCc2ccccn2)cc1 573036721 ADYUADZWHGCZIT-RUZDIDTESA-N 383.495 5.090 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cncc(C(F)(F)F)c3)cc2)cc1 580855157 JPYJVCCEFDZQFV-UHFFFAOYSA-N 383.329 5.017 30 20 GKED COc1cc([C@@H](C)N[C@@H]2CCc3ccc(C#N)cc32)ccc1OC1CCCC1 581518269 UFIZHJUAEPYFMW-OPAMFIHVSA-N 376.500 5.226 30 20 GKED N#CCCCCCc1nc(-c2ccccc2-c2ccc(Cn3cccn3)cc2)no1 589083378 HLFYXHGUHUJYHC-UHFFFAOYSA-N 397.482 5.275 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1ccccc1Cl 603652462 CNDJNXXPVIZSQO-UHFFFAOYSA-N 391.858 5.668 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3ncccc23)cc1Cl 603766058 LNIJHPLMJXVROE-NRFANRHFSA-N 397.865 5.796 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)COc3ccccc3)cc2Cl)cc1 604026901 LRWYSCPPSWYXEE-UHFFFAOYSA-N 378.815 5.021 30 20 GKED Cc1[nH]c2ccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)cc2c1C 604241871 SMJVRVZTKBNTLS-UHFFFAOYSA-N 382.423 5.096 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@@H](C)c1ccc(C#N)cc1 604456574 OONVKOYFLWCXNL-JTQLQIEISA-N 387.917 5.196 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C)c1 608916910 WXKNNEMOKSEAHV-GOSISDBHSA-N 395.572 6.200 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H]1CCCc2ccccc21 609371140 GOVPCSISDDQYNR-IBGZPJMESA-N 397.478 5.503 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)c1 609407719 ITZXOXSHLSMYHC-ROUUACIJSA-N 378.378 5.055 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 609428170 AYGBXDNBNALISH-ZDUSSCGKSA-N 394.500 5.167 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 609436266 HKFFWVVZIQDYKO-HZPDHXFCSA-N 399.585 6.076 30 20 GKED C[C@@H](CN(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccccc1 609643848 WYOAEMNQIAYRQW-IBGZPJMESA-N 384.479 5.013 30 20 GKED C[C@H](NC(=O)NCc1ccccc1Oc1cccc(F)c1)c1cccc(C#N)c1 610351012 GLLKOAAGEZLWDJ-INIZCTEOSA-N 389.430 5.050 30 20 GKED N#C[C@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1nc(-c2ccccc2)cs1 613392150 KREWMLOOHWKDAY-LJQANCHMSA-N 397.503 5.660 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 615624188 LKXUKSHGSIWFQG-OAQYLSRUSA-N 384.907 5.198 30 20 GKED C=CCn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccccc1OC 619863999 YNGFLTCGXFFYSH-SFHVURJKSA-N 396.903 5.150 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CCC(OC2CCCC2)CC1 624376827 NPIBGZXPDREEKS-UHFFFAOYSA-N 394.540 5.103 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(F)c(Br)c2)c1 726744291 ZTNIPUOTMHNSQK-RMKNXTFCSA-N 388.236 5.167 30 20 GKED N#Cc1cccc(COc2ccc(NC(=S)Nc3ccc(F)cc3)cc2F)c1 728175190 LLVFRECRYVBDDL-UHFFFAOYSA-N 395.434 5.224 30 20 GKED Cc1ncccc1/C=C1\CC(c2ccccc2)C/C(=C\c2cccnc2C)C1=O 728785653 MYLYNVRMAHRLSW-KOJZRSEWSA-N 380.491 5.707 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 732495456 ALIUERODSRCPFF-MAUKXSAKSA-N 378.522 5.415 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(=O)c1ccccc1 732753565 SSWCWYLTSLPZDT-MBSDFSHPSA-N 382.463 5.190 30 20 GKED Cc1ccsc1C(=O)/C=C\c1cn(Cc2ccccc2)nc1-c1cccnc1 733749752 WWTJQNCSEOSQCZ-KTKRTIGZSA-N 385.492 5.259 30 20 GKED CC[C@H](NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1ccc(Cl)s1 734013121 MJNHTJPLRRGOCO-ZBFHGGJFSA-N 391.924 5.033 30 20 GKED CC[C@@H](NC(=S)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 734378021 PIPRTIHTNNFOOK-LJQANCHMSA-N 393.537 5.850 30 20 GKED C=CC[C@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccncc1 734508697 CAFFKMPQWAPFNR-IBGZPJMESA-N 385.920 5.178 30 20 GKED CCC(CC)(CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)SC 742840042 GYKFEFCYXJQAMY-UHFFFAOYSA-N 398.597 5.502 30 20 GKED C(=NN(Cc1ccccc1)c1ccccc1)c1ccc(Oc2cnccn2)cc1 743418135 UWNZMNNZZSSRJA-UHFFFAOYSA-N 380.451 5.310 30 20 GKED CCSc1ccc(Cl)cc1C(=O)NCc1cccc(O[C@@H](C#N)CC)c1 752313212 AGYUNVGVYPDBKX-MRXNPFEDSA-N 388.920 5.063 30 20 GKED C#CC[C@H](NC(=O)N1CCC(c2c(C)[nH]c3ccccc23)CC1)c1ccccc1 757059877 XURRMGYZFVBUHM-QFIPXVFZSA-N 385.511 5.130 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2ncc(C3CC3)o2)cc1 760461478 MQLOPAQGNGQSLL-UHFFFAOYSA-N 390.464 5.073 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(CSc3ccc(C#N)cc3)n2)cn1 762351008 PSPBQRYPTXFORL-UHFFFAOYSA-N 382.514 5.186 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc(C#N)s1 762442396 KKPOGQWOVYMBLS-UHFFFAOYSA-N 375.482 5.128 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)sc2cccc(F)c12 764300609 ALNQZGMQQPZTSZ-UHFFFAOYSA-N 389.795 5.034 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccc(Cl)cc2Cl)cc1C#N 771840140 YCQGJUUDTXJEKT-UHFFFAOYSA-N 380.300 5.461 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C[C@@H](O)c3ccc(Cl)cc3)cc2)cc1 772626980 WQBRUVDJYYJAHT-OAQYLSRUSA-N 392.842 5.066 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2)cc1 772971361 MFGOHJDGTQDYNK-FQEVSTJZSA-N 386.476 5.107 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc3cc(OC)ccc3c2)c1 772982720 FLDMEEVNKYHXQP-RCZVLFRGSA-N 388.511 5.770 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(-c2cccnc2)cc1 775540859 YZJFYXKERYACBB-INIZCTEOSA-N 377.875 5.155 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1NC12CC3CC(CC(C3)C1)C2 777371706 ARZKBMPRHYRIBR-UHFFFAOYSA-N 399.538 5.315 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(OCc3nc(C)no3)cc2)cc1 777690577 UHGACTDASVMDGO-OAHLLOKOSA-N 399.878 5.261 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(O)c3ccccc3c2)cc1 792057368 MGVXQDDBJNJDJN-QHCPKHFHSA-N 378.431 5.453 30 20 GKED CC(C)O[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796757521 ZJXVORAMYKYDHL-BEFAXECRSA-N 384.888 5.292 30 20 GKED CCCOc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797568416 RIRWCHQMTPYVQZ-QGZVFWFLSA-N 398.528 5.069 30 20 GKED O=C(C[C@H]1CCC(F)(F)C1)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 797972649 XFNKIAJZIJTTOQ-RNCFNFMXSA-N 389.286 5.251 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 817617989 NTROERSUGZCYGC-UHFFFAOYSA-N 377.875 5.177 30 20 GKED N#CCN(C(=O)c1ccc(C2SCCCS2)cc1)c1ccc(Cl)cc1 843610972 PJGDVPWBLWKHEY-UHFFFAOYSA-N 388.945 5.379 30 20 GKED C[C@H](Nc1ccc([C@H](O)C(F)(F)F)cc1)c1ccc(F)cc1C(F)(F)F 864021362 AWHODTUYUNINLK-VFZGTOFNSA-N 381.291 5.613 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F 902590946 UEHHYFBYSHNGMC-APIJFGDWSA-N 396.528 5.044 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353983 SKFSBUWYHPTAKP-NRFANRHFSA-N 391.421 5.284 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2cccs2)C2CC2)cc1 915354093 VAZQSKWTVFEJAD-RBBKRZOGSA-N 387.508 5.676 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@H](C#N)c1nc2ccccc2s1 916847296 BVCWPZWYUACERN-YOEHRIQHSA-N 378.497 5.238 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)SCc3ccccc3)n2)cc1 916974369 JHXOHJUTBXSLRT-APWZRJJASA-N 392.549 5.617 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1cnn(-c2ccc(F)cc2)c1C 920986412 GQUSPWUEBBTUBQ-UHFFFAOYSA-N 376.357 5.175 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccccc1Oc1cccc(Cl)c1 1776088705 CYZPLLQCTMDLED-UHFFFAOYSA-N 394.858 5.975 30 20 GKED C=CCOc1ccc(/C=C/c2cc(C(=O)O)c3ccc(F)cc3n2)cc1Cl 1776183937 KZMUOSATURKPKJ-ZZXKWVIFSA-N 383.806 5.461 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cnc(C2CCCCC2)s1 1776355241 XQYUTZGUQPUYPB-MDZDMXLPSA-N 399.512 5.572 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Br)cc1Cl 1776782966 SRHBFQRDWGIVQA-OAHLLOKOSA-N 390.749 5.396 30 20 GKED CCCCCCCOc1ccc(CNCC[C@@H](CC(=O)O)C(F)(F)F)cc1 1776786220 CDRDOYXSFNRQLQ-KRWDZBQOSA-N 389.458 5.169 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](Cc2cccc(C)c2)C(=O)O)cc1 1776786289 MDHMLTWGXZMBNW-HSZRJFAPSA-N 397.559 5.377 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)Cc2ccccc2)c1 1776787638 BKMZKEIHHWUGCF-JOCHJYFZSA-N 383.532 5.211 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)C2CCCCCC2)cc1 1776787979 GORRVBSOCJLUTB-HSZRJFAPSA-N 389.580 5.939 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](Cc2ccccc2C)C(=O)O)c1 1776788669 KQAFGAUGDPACNB-QHCPKHFHSA-N 397.559 5.377 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3cc(C(=O)O)ccc3C)ccc21 1777003042 VCEWGYCPZCPKFP-RAXLEYEMSA-N 383.447 5.717 30 20 GKED CCOc1ccc(SCC(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 16168431 BMWCSINUNVITQJ-UHFFFAOYSA-N 386.542 5.018 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nc2ccccc21 22351398 INTBUMPGGVVAGB-OAHLLOKOSA-N 399.947 5.612 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1c(F)cccc1Cl 33197174 PNYMAWJOEVGVRV-YUMQZZPRSA-N 391.714 5.118 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3c(F)cccc3Cl)c2)cc1 46346843 GVQQBWUOVNKKSB-UHFFFAOYSA-N 394.833 5.376 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccc2ccccc2n1 47376735 SUNRGNAKAVPGQG-HNNXBMFYSA-N 395.443 5.595 30 20 GKED CC(=O)N(c1nc(COc2cccc(C#N)c2)cs1)c1c(C)cc(C)cc1C 71857968 XSUWJYHJIPQDOE-UHFFFAOYSA-N 391.496 5.204 30 20 GKED COc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 108530500 KHADOTQMULCLEB-APWZRJJASA-N 395.528 5.316 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(NC(=O)CCC)c1C)c1ccccc1 155401016 GRTQFNBFJLQCBA-NRFANRHFSA-N 379.504 5.563 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](O)c1cc(Cl)cc(Cl)c1 163900347 DFDUOMKTKGFNJG-DIFFPNOSSA-N 395.311 5.060 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 172682124 SYLXSGFITCCICK-JTQLQIEISA-N 384.810 5.350 30 20 GKED Cc1ccc(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)c(Br)c1 178825894 ZEEQIYGZCVOSLU-UHFFFAOYSA-N 398.285 5.005 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 179935903 SBNQPZOTVQBBQW-UHFFFAOYSA-N 393.446 5.466 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccn3C3CCCC3)n2)cc1 181488982 AFOMFLJXUDINPE-SFHVURJKSA-N 391.496 5.225 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nccs1 183515899 VUOWDRMFPUEROR-HNNXBMFYSA-N 392.484 5.074 30 20 GKED C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 183871117 RQVJMBISXBMLDD-SZGUKTLCSA-N 381.457 5.031 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)cc1 237510348 KAWGCIJULZDDQS-AVRWGWEMSA-N 382.463 5.603 30 20 GKED N#C[C@@]1(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CC12CCCC2 295885896 PVRCCQNPCHSMQR-JOCHJYFZSA-N 393.874 5.005 30 20 GKED COc1ccc(N=C(O)N2CC[C@H]3CCC[C@H]32)cc1N=C(O)C1CCCCC1 330245667 KVIBXWFJEKNKSF-DNVCBOLYSA-N 385.508 5.283 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 429066434 UCYIJKGAJVCZSB-QZTJIDSGSA-N 388.298 5.325 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc(Cc3cccc(F)c3)n2)s1 430599932 QYHWFMWKAHEOPH-AWEZNQCLSA-N 399.516 5.117 30 20 GKED N#CCCC[C@@H](NC(=O)NC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1 431304324 GBPUDONMQRTUNH-SNCIUUNGSA-N 399.897 5.402 30 20 GKED CC(C)[C@@H]1N(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1(C)C 432674103 ZYLUUKHPQNECFC-QFIPXVFZSA-N 391.515 5.230 30 20 GKED CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 432868733 XDQPDUMXNUYREU-IIBYNOLFSA-N 399.535 6.081 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 432991053 ILFZOBCHOFCZSH-UPVQGACJSA-N 396.494 5.361 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1cccc(OCc2ccccc2)c1 433918382 JOUUWAIKASAWJR-IBGZPJMESA-N 399.494 5.040 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2)c2ccccc21 434354226 DNBBVRYPOWVKNO-OAQYLSRUSA-N 375.447 5.061 30 20 GKED C=CCN(C(=O)C1CCC(C(F)(F)F)CC1)c1nc(-c2ccccc2)cs1 435658150 YNKQPGLBWRHVPP-UHFFFAOYSA-N 394.462 5.698 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1Cl 437901069 JFBGJDYZWHXBQA-ICSRJNTNSA-N 397.906 5.431 30 20 GKED C=C(C)Cn1c(S[C@H]2CCc3c(Cl)cccc32)nnc1-c1ccncc1 443522711 PSDRGTLZIVAITO-SFHVURJKSA-N 382.920 5.349 30 20 GKED CC(C)c1csc([C@@H]2CCCN(C(=O)C(C)(C)Cc3ccc(C#N)cc3)C2)n1 455761164 XTWBOALFVQPYFO-LJQANCHMSA-N 395.572 5.113 30 20 GKED N#CCCC[C@@H](NC(=O)N(Cc1ccoc1)C1CCCCC1)c1ccccc1 458803417 RFTAJVTWGFVBAI-JOCHJYFZSA-N 379.504 5.559 30 20 GKED N#CCCCN1C(=O)CCc2cc(NC3CC(c4cccc(Cl)c4)C3)ccc21 468896949 HKGZWXRRLXGVRE-UHFFFAOYSA-N 393.918 5.281 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H](Cc3ccccc3)C2)c2ccccc21 469368788 DIWGMGAXMHADIA-NRFANRHFSA-N 385.511 5.040 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)c3cn(CCCC#N)c4ccccc34)c2)n1 469606828 KIKOTATWPJESCH-UHFFFAOYSA-N 398.466 5.469 30 20 GKED Cc1cn(-c2ccccc2)nc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 471746469 CLADKFYLXDJGOV-UHFFFAOYSA-N 384.464 5.033 30 20 GKED C=CCOc1cccc(NC(=O)NCc2nc(C)c(-c3ccc(Cl)cc3)o2)c1 473739590 DGMIEPMAKYCTND-UHFFFAOYSA-N 397.862 5.190 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1 485479472 KMHNZAWPWRIPTG-UHFFFAOYSA-N 394.471 5.221 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1 499103394 UYXXWJSGDYNDMS-UHFFFAOYSA-N 386.451 5.073 30 20 GKED CCSc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 504145317 RBKILYGCTVFXMO-UHFFFAOYSA-N 375.453 5.110 30 20 GKED CCC[C@@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 504258102 NJTVSBBERJUEHV-FDDCHVKYSA-N 383.495 5.381 30 20 GKED CN(C(=O)NCC(C)(C)CCC#N)[C@@H](c1ccc(Cl)cc1)C1CCCC1 513141847 VRYTYYZDERZOQK-LJQANCHMSA-N 375.944 5.543 30 20 GKED C[C@H](CNC(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 513209647 KNLPNWRPAHUPSA-RTBURBONSA-N 399.494 5.071 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc3cnccc23)cc1 518050007 XKZIOFWQJZUAIW-UHFFFAOYSA-N 383.382 5.290 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CSc3ccc(F)cc3)c2)cc1 520532206 IATVPIGYSHMDHK-UHFFFAOYSA-N 378.428 5.220 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Oc1ccc(Cl)cc1 521734762 RVFRPHGFNZRHGC-CQSZACIVSA-N 388.920 5.388 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1sc(C(C)(C)c2ccccc2)nc1C 538790214 QLACLHFFJMTSIX-UHFFFAOYSA-N 375.497 5.210 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC2CCN(Cc3ccc(C#N)cc3)CC2)cc1 539494321 DQVBCTLOGNNQRB-LJQANCHMSA-N 393.600 5.374 30 20 GKED N#Cc1cc(NC(=O)c2cc(Cl)cc(F)c2Br)ccc1Cl 550640864 KFGSRFFUTGMCER-UHFFFAOYSA-N 388.023 5.019 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C(C)(C)c2cc(F)cc(C#N)c2)c1C 552056847 VSETYHPWNRCUJM-UHFFFAOYSA-N 396.506 5.627 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1nc(Cc2ccccc2)no1 552979253 VPGKLXBXRSZDPQ-GOSISDBHSA-N 394.478 5.050 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2scc(C)c2C#N)cc1OCC 557508451 GEWRFMBPGKTWEV-UHFFFAOYSA-N 378.881 5.021 30 20 GKED COc1ccc2ccccc2c1CN(Cc1nc(C#N)cs1)C1CCCC1 562207711 ZPNGXAKRTRJVLM-UHFFFAOYSA-N 377.513 5.121 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)CC1 563098430 IVSNITBHVKAFBV-UHFFFAOYSA-N 397.519 5.666 30 20 GKED N#Cc1cnc(N[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)c(Cl)c1 588050052 BJGUUIYQOSCINQ-KRWDZBQOSA-N 395.812 5.205 30 20 GKED COc1ccc2c(c1)c(C(=O)Nc1ccccc1S[C@H](C)CC#N)c(C)n2C 592593634 ZCAYQZNQUDRIEJ-CQSZACIVSA-N 393.512 5.142 30 20 GKED COc1cc(CNCc2ccc(C3(C#N)CC3)cc2)ccc1OCc1ccccc1 594916554 FQGZOWVOMIKKTR-UHFFFAOYSA-N 398.506 5.119 30 20 GKED CCCOc1ccc(CN(CCC)C(=O)Nc2cccc(C#N)c2)cc1OCC 603645852 TVJVOSKXZWHAJR-UHFFFAOYSA-N 395.503 5.190 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)oc12 604331237 ORTALLUPQRYSNL-UHFFFAOYSA-N 384.391 5.358 30 20 GKED C=CCCCN(C)C(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 605645142 LBPTVTYBJLFFLG-UHFFFAOYSA-N 397.569 5.498 30 20 GKED C[C@H](C[C@H]1CCCO1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 608841364 NXFYCDJMLNRXKL-XFQXTVEOSA-N 397.906 5.075 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)ccc1F)c1ccc(OCc2ccccc2)cc1 609027636 AEZYZRJJZDRLHU-NRFANRHFSA-N 394.833 5.053 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(C(F)F)cc3)cc2F)c1 609104556 KSCHILIBBFLNJC-UHFFFAOYSA-N 396.368 5.466 30 20 GKED Cc1ccc2[nH]c(C(=O)N[C@H](C#N)c3ccc(OCc4ccccc4)cc3)cc2c1 609173658 VSCOAHXOHXKJJB-XMMPIXPASA-N 395.462 5.050 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3ccccc3Oc3ccccc3)CC2)c1 609184915 FOLQWSGPQFCUTF-UHFFFAOYSA-N 398.462 5.034 30 20 GKED CCN(CC[S@](=O)c1cc(Cl)ccc1Cl)[C@H](C)c1ccc(C#N)cc1 609798395 ZNOPBUSZSUKIPN-PWECECGKSA-N 395.355 5.056 30 20 GKED C[C@H](NC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)c1cccc(C#N)c1 610359411 IYTUHFHDAYZCDV-AOMKIAJQSA-N 390.870 5.209 30 20 GKED C[C@@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cccc(C#N)c1 610830301 KSLVYGYIAZKBJW-KUHUBIRLSA-N 377.488 5.549 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)C1 612310207 KZTQROFFXYLHOU-HNNXBMFYSA-N 391.846 5.152 30 20 GKED C[C@H]1CCc2sc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2C1 613392034 BEDHYCNWPQTZQM-XJKSGUPXSA-N 378.522 5.486 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 615624187 LKXUKSHGSIWFQG-NRFANRHFSA-N 384.907 5.198 30 20 GKED CC1(c2cccc(Cl)c2)CCN(C(=O)c2cc3ccccc3n2CC#N)CC1 619458309 VRKQQHXWOAMDGK-UHFFFAOYSA-N 391.902 5.012 30 20 GKED Fc1ccc2ccnc(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c2c1 678310177 ALQXXLRLBLKLGD-GHMZBOCLSA-N 380.307 5.695 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(Br)c1 726729515 GZBNJXUDWISYCL-KRWDZBQOSA-N 393.284 5.151 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1csc(-c2ccccn2)n1 727781278 IVNCUGXXIKZOTB-ZHACJKMWSA-N 389.505 5.533 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)F)cc1)c1nc2cc(F)ccc2s1 730416999 JOKLYIZYHIFIAM-GFCCVEGCSA-N 378.400 5.240 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730476009 YEQRJEPSCKIRPM-DVECYGJZSA-N 398.506 5.558 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)OCc1ccc(OCC#N)cc1 733455407 CEUGSIYWAITPOJ-GFCCVEGCSA-N 396.295 5.120 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H]1CCc2ccccc2C1 734060417 WMJKHYPGMSLTSQ-DQEYMECFSA-N 395.506 5.363 30 20 GKED CC(=NOCc1cc(C)nc2ccccc12)c1nc2ccccc2n1C(F)F 735919790 UEHXKTYSVFMIMA-UHFFFAOYSA-N 380.398 5.229 30 20 GKED COc1ccccc1[C@H](Nc1snc(Cl)c1C#N)c1ccccc1Cl 742413388 YSJHWJPUPMZHDK-MRXNPFEDSA-N 390.295 5.532 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-c4ccccc4)n3C)n2)cc1 744035715 VBRLIQYUPTWHJK-LJQANCHMSA-N 397.503 5.614 30 20 GKED CC(=NN(Cc1ccccc1)c1ccccc1)c1cccc(N2CCOC2=O)c1 745583440 FOERFWXEESMDLV-UHFFFAOYSA-N 385.467 5.074 30 20 GKED O=C(/C=C\c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(-c2ccc(C(=O)O)o2)cc1 747122506 PAUCCTXDKIOAQC-WAPJZHGLSA-N 397.770 5.103 30 20 GKED N#CCC[C@@H](NC(=S)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1 747708550 HOCJCXHHTPVNEW-OAHLLOKOSA-N 395.862 5.273 30 20 GKED C[C@H](CCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 750330239 GFOCETKQJCSJAM-ZBFHGGJFSA-N 396.462 5.848 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2cnc(-c3cccs3)s2)cc1 751518808 ZOCPOGLUIBDQMC-HJWRWDBZSA-N 377.494 5.262 30 20 GKED Oc1cccc(C=Nc2ccc(Oc3nncc4ccccc34)c(Cl)c2)c1O 751524026 QOCDEZNYLMOYLP-UHFFFAOYSA-N 391.814 5.237 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@@H]2c2ccc(Cl)cc2)cc1C(F)(F)F 752257118 PMFUBQNLWVSKRD-MRXNPFEDSA-N 379.769 5.209 30 20 GKED C[C@H](c1ccco1)N(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 754887461 AEGCVIMJDFFBSW-VGSWGCGISA-N 385.467 5.693 30 20 GKED N#Cc1cc(NC(=O)c2cc3c(Cl)cccc3s2)c(Cl)c([N+](=O)[O-])c1 764304241 WLUBPXCGFHXLSU-UHFFFAOYSA-N 392.223 5.240 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cnn(C(F)F)c1)c1ccc(C(F)(F)F)cc1 772468195 RYRIKUDWJRTFJN-CQSZACIVSA-N 388.340 5.126 30 20 GKED C[C@@H](NCc1ccc(Sc2ccc(F)cc2)cc1)c1ccc(OCC#N)cc1 776172040 RIJSAFLQXKTSFI-QGZVFWFLSA-N 392.499 5.730 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(CC[C@H](O)c4ccccc4)c3)cc2)CC1 777410523 UDXBZMMKNGLRRO-DEOSSOPVSA-N 396.490 5.160 30 20 GKED Cc1cc2c(Br)ccc(C(=O)Nc3ccccc3O[C@H](C)C#N)c2o1 785596407 BWZUMCFDWKHNPC-GFCCVEGCSA-N 399.244 5.047 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)n2)cc1 786307776 DNMGHFWZBJTYLU-KFWWJZLASA-N 398.940 5.813 30 20 GKED CCOC1CC(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 789171205 JOSGKZNCKDDNAY-UHFFFAOYSA-N 384.863 5.148 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(F)cc1OC(F)F 796747726 QDDBOFBIHSIFJC-HIFRSBDPSA-N 377.362 5.119 30 20 GKED N#Cc1ccc(CNC(=O)c2ccc(C3SCCCS3)cc2)cc1Cl 801070027 AGPOWNFNGYAREQ-UHFFFAOYSA-N 388.945 5.010 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)NCC(C)(C)CCC#N 806353840 PJOUUSQPMKFIAY-UHFFFAOYSA-N 388.309 5.362 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(Cl)sc3[nH]2)cc1 810532360 SMBLQCVHQGFOPP-HNNXBMFYSA-N 399.903 5.187 30 20 GKED O=C(Nc1ccc(SC(F)F)cc1)c1c(F)cc(C(F)(F)F)cc1F 811893335 KJXBYKSPQLVFON-UHFFFAOYSA-N 383.288 5.551 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813217025 ATEWDRPRPZAHGS-CXAGYDPISA-N 390.405 5.042 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@@H]1c1ccncc1 814576642 FTWPETWQDJMOOA-XZOQPEGZSA-N 396.494 5.352 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1)c1ccccc1 819475135 HBWKYCMAGIITEV-TZIWHRDSSA-N 387.527 5.122 30 20 GKED C=C[C@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 909529798 NPQVYYYTAMNTNN-CQSZACIVSA-N 392.908 5.127 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1c(F)cccc1F 912706540 VMAUZXSTFYPOMD-PLNGDYQASA-N 395.249 5.654 30 20 GKED Brc1ccccc1-c1ccc(C=Nn2cnc3ccccc32)s1 912806640 TYSFEOYWOWJXAY-UHFFFAOYSA-N 382.286 5.410 30 20 GKED COc1ccc(N=Cc2cc(Cl)ccc2O)cc1NC(=O)OC(C)(C)C 915112747 DXQHVHOZNQAPDL-UHFFFAOYSA-N 376.840 5.152 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(N=Cc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 915113228 RQOQGADAIVFITQ-LJQANCHMSA-N 391.814 5.360 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc2cc(Cl)ccc2o1 916906166 GMPGSHRRLAXJOY-KRWDZBQOSA-N 394.858 5.172 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)sc1C 916915555 FLCHIHRXPHWJGX-SFHVURJKSA-N 376.481 5.123 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917042926 IZBRQJZEPDQSGK-CQSZACIVSA-N 388.414 5.469 30 20 GKED CNC(=O)Nc1cc(NC(CCC(F)(F)F)CCC(F)(F)F)ccc1F 926405552 DCYBEQBJLHFGBV-UHFFFAOYSA-N 389.315 5.043 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(Cl)c(Cl)c3)cc2)cc1 1776032754 PPHZGTIWTMWDLE-UHFFFAOYSA-N 385.250 5.805 30 20 GKED O=C(O)c1cc(NN=Cc2ccccc2OCCC2CCCCC2)ccc1F 1776064428 NQKJKGJGFBHKOO-UHFFFAOYSA-N 384.451 5.319 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1ccc2ccccc2c1 1776131505 SPHAALSKGINZQC-GHXNOFRVSA-N 398.414 5.606 30 20 GKED C=C(C)C[C@H](NCc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O 1776137809 BKDRICFULUQQOI-DEOSSOPVSA-N 386.495 5.665 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)s1 1776339950 SRQSTCWGHJPMMC-GQCTYLIASA-N 388.485 5.895 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2ccc(C(=O)O)s2)cc1)c1ccccc1 1776469428 OFBAMIPLAVCONE-HFBDAHEESA-N 378.449 5.482 30 20 GKED C[C@H]1/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2c(O)ccc(F)c21 1776586543 CCCPORPEKDANDG-SAIXKJTDSA-N 394.423 5.341 30 20 GKED COc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)c(Cl)c1 1777351922 DFMUDJFNPRSKSW-XQRVVYSFSA-N 390.819 5.297 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)C(C)(C)C(C)(F)F)CCC2)cc1 1791243641 AJSAYKPARVBXKK-HNNXBMFYSA-N 392.490 5.014 30 20 GKED N#CCSc1ccccc1NC(=O)COc1ccc(Cl)c2ccccc12 6642974 CHDNLCUXAZKEIW-UHFFFAOYSA-N 382.872 5.126 30 20 GKED C[C@@H](Sc1ncccc1Cl)C(=O)Nc1sc2c(c1C#N)CCCCC2 11251327 RTESZCMQMWUBDY-LLVKDONJSA-N 391.949 5.056 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nnc(-c3ccco3)n2-c2ccccc2)cc1 24722513 AALWZXKSGDFWKJ-LJQANCHMSA-N 386.480 5.063 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2Cl)on1)c1nc2ccccc2s1 48823674 ZMSTYTJSRDIKRH-GFCCVEGCSA-N 379.828 5.095 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3sc(C)c(C)c3C#N)s2)c(C)c1 63569196 LDJFOYUKVKXHDG-UHFFFAOYSA-N 381.526 5.538 30 20 GKED COc1ccc(CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1 108532777 RAKNHJSWMFKNCH-INIZCTEOSA-N 395.528 5.143 30 20 GKED N#C[C@H](C(=O)Cc1c(F)cccc1F)c1nc(-c2ccc(Cl)cc2)cs1 120113129 GRLAKMNTOWUGAU-CQSZACIVSA-N 388.826 5.161 30 20 GKED CC(C)N(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)C1CCOCC1 121498685 WCNZCXUTVACHFD-UHFFFAOYSA-N 398.890 5.034 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2cccs2)Cc2cccs2)c1 175540572 IEQMENGXCQWVNE-UHFFFAOYSA-N 384.551 5.268 30 20 GKED CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 185351379 YUIOHKRQBCTXTH-DOTOQJQBSA-N 397.500 5.196 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O 188069333 DIJPZXVZUISKFZ-FQEVSTJZSA-N 396.918 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccccc2F)c1C 189868865 WRFXJGAESVHWGT-UHFFFAOYSA-N 377.463 5.424 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1cccc(C#N)c1 190891169 UQHRHNOEBYVHKF-JKSUJKDBSA-N 395.553 5.385 30 20 GKED C[C@@H](SCC(=O)Nc1c(Cl)cccc1C(F)(F)F)c1cccc(C#N)c1 190907183 BCDYAWCZTZXNBJ-LLVKDONJSA-N 398.837 5.663 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(c4ccncc4)CC3)cc2)cc1 191875477 FZSNSWREFRTKIL-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CN(CCC#N)c1ccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)cc1 237214485 XEORLXLFXYUHMC-AREMUKBSSA-N 395.506 5.662 30 20 GKED C=CC[C@@H](CC)NCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 281452053 SXENUZKQGVWXIZ-OAHLLOKOSA-N 397.466 5.291 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N2CCCCC[C@H]2c2ccco2)cc1OC 303854823 NZXBNPVMJVNNIN-BPOBUFBUSA-N 381.472 5.010 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2C/N=C(/O)[C@@H]2CCC(=O)c3ccccc32)cc1 328832195 VGXPJECSFZXRDW-AAIMPIBUSA-N 377.484 5.180 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c2[C@H]1C 410988868 SZLWIFMDCHLVEB-STQMWFEESA-N 381.526 5.174 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1ccc(C#N)cc1 429476634 YKNUVWSLZWHIPK-ZDUSSCGKSA-N 375.394 5.281 30 20 GKED N#CCCC[C@@H](NCc1c(F)ccc(Br)c1F)c1ccccc1 433022512 VUWXIBQWHDOFIR-QGZVFWFLSA-N 379.248 5.252 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cc(Cl)ccc2Br)cc1C#N 435384201 LEGXOBINOWBIMY-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccccc1 435615825 KPCJIKHYUNESHX-FQEVSTJZSA-N 393.531 5.809 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(F)cc2)c(OC(F)F)c1 437155177 LPYLGLMWHRZQKF-OAQYLSRUSA-N 382.385 5.178 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc2nc(C3CC3)sc2c1)c1ccccc1 439367431 ATYMMKHKTDRVQO-QGZVFWFLSA-N 376.485 5.340 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(c2ccccc2Br)CC1 439668509 NJQAEHUZHJGOLV-UHFFFAOYSA-N 398.304 5.041 30 20 GKED COCc1nc(NCC2CCC(C#N)CC2)c2c(-c3ccccc3)csc2n1 440662454 LNIPZIWDXOXNNB-UHFFFAOYSA-N 392.528 5.247 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c(Cl)c1 445008748 QYTIWEJZGYPYBY-NQIIRXRSSA-N 397.906 5.431 30 20 GKED CN1CCC[C@H](CNC2CCC(C)(C#N)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 449153738 FUTPSPPMKHCSBS-PPXMBRMGSA-N 393.497 5.150 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)C(C)(C)Cc2ccc(C#N)cc2)c1 456024780 VKSYHHLGXYRRQD-UHFFFAOYSA-N 397.906 5.158 30 20 GKED CCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H]1CCc2ccccc21 458795605 COWGPVBRTDRFIB-DHIUTWEWSA-N 375.516 5.531 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCCC[C@@H]1c1ccncc1)c1ccccc1 458807640 XUWNSVCZWJHWJV-FGZHOGPDSA-N 376.504 5.143 30 20 GKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H]1CCC[C@@H]1c1ccccc1 458855472 YGNSVRKRGLZNOE-ZLNRFVROSA-N 375.516 5.399 30 20 GKED COc1ccc(C)cc1[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 459403415 QJYPXRXPWBWJND-CVEARBPZSA-N 383.517 5.138 30 20 GKED C[C@H](C(=O)N(c1ccc(F)c(Cl)c1)c1nccs1)c1cccc(C#N)c1 464398985 PULOSGXBFZCOQL-LBPRGKRZSA-N 385.851 5.276 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1coc(-c2cccc(Cl)c2)n1 464814358 LOUVYKLMAHPRLS-LEWJYISDSA-N 377.875 5.267 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 473850117 MTCSCNDSKYZLKT-UYAOXDASSA-N 379.529 5.491 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2csc(-c3cccc4ccccc34)n2)n1 480911558 KTPOLFKBQKEIFZ-MRXNPFEDSA-N 375.478 5.218 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 485487308 FREABYJEXRWDEK-SANMLTNESA-N 387.570 5.264 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1)c1ccccc1 487512367 HOOYNJCBXUYXCI-HXUWFJFHSA-N 377.875 5.500 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H](CC)c1ccccc1 494128922 USKZFKCOBNFKJH-IBGZPJMESA-N 383.492 5.426 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(C)c1 502516398 DKBJYKWLYWQBBE-KRWDZBQOSA-N 397.544 6.212 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(OCCc2ccccc2)CC1 505000832 KSGDBDKOEQXXHN-UHFFFAOYSA-N 378.516 5.061 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2sccc2Cl)cc1 507202832 LDQSENXIIYLTMO-UHFFFAOYSA-N 382.872 5.299 30 20 GKED CC[C@@H](SCCCC1(C#N)CCOCC1)c1ccc(Br)cc1 508585309 CBZLDAVKMNSCRU-QGZVFWFLSA-N 382.367 5.734 30 20 GKED N#Cc1ccc(N2CCC(N[C@H](c3ccccc3)c3ccc(F)cc3)CC2)cc1 513677818 CHBAVFMABFYGHX-RUZDIDTESA-N 385.486 5.045 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4nc5ccccc5s4)cc3c2C1 513682826 YWKBIBCYBYGUSR-GUYCJALGSA-N 385.492 5.392 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2nc(-c3ccccc3F)cs2)c1 517654604 ZYJKPSNEKPMFDU-UHFFFAOYSA-N 395.459 5.009 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Br 519847672 ZAVIOALGBUJHTL-KUHUBIRLSA-N 375.285 5.674 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccccc2)CCCC1 520938387 WYOGOWJZLLCAGG-SFHVURJKSA-N 393.556 5.714 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccccc1Oc1ccccc1 524680631 LBVRRVYQNOMJDM-HXUWFJFHSA-N 386.495 6.012 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)CCCCc1nc2ccccc2s1 532687463 WJYWZAXMNUERRW-HSZRJFAPSA-N 391.540 5.040 30 20 GKED C=C(C)COc1cc(CNc2ccc(C)c(-c3nc(C)co3)c2)ccc1OC 532744419 FBFXKHAQCLAFQF-UHFFFAOYSA-N 378.472 5.534 30 20 GKED C=C(C)[C@H](CC(=O)N(CC)[C@H](c1ccc(Cl)cc1)c1cccnc1)OCC 533710407 NWCBBKISBLZSKR-RBBKRZOGSA-N 386.923 5.044 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(CC#N)cc2)cc1F 535368353 GNJAXCXLQXXOIN-UHFFFAOYSA-N 390.414 5.253 30 20 GKED CC(C)NC(=O)Nc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 540728952 QLFFPZOXTLKIKR-KRWDZBQOSA-N 380.492 5.072 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1cccc(C#N)c1F 543519123 VPNJWVPPNAHBAZ-LBPRGKRZSA-N 385.895 5.634 30 20 GKED N#CCc1ccc(-c2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)cc1 545702523 VMCSEVBCWOTQIC-UHFFFAOYSA-N 388.814 5.310 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)[C@@H]1CC[C@@H](C(F)(F)F)C1 560686802 WBTYLZGTQAWITK-HTQZYQBOSA-N 391.258 5.224 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 561603616 LRZBRFMZHHRGTO-YVEFUNNKSA-N 379.312 5.164 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cnccc2C#N)cc1Cl)c1ccccc1 563641488 HZAPTSYZLZMTQF-CQSZACIVSA-N 376.847 5.032 30 20 GKED C=CCN(C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1)C1CC1 565680527 XUBFSFBFSJVIBF-UHFFFAOYSA-N 395.355 5.572 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1O[C@@H](C)C(F)(F)F 565798609 GPKTVPZISXIFMV-HNNXBMFYSA-N 378.394 5.236 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1 572589866 ZMLOMZMKJFUGPS-HLIPFELVSA-N 379.529 5.553 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)c1cc(-c2cccc(C#N)c2)no1)C1CC1 578712929 VPCBYCCAHUXDKX-AWEZNQCLSA-N 391.858 5.232 30 20 GKED N#CCCCCCC(=O)N1CCC(CCc2cccc(C(F)(F)F)c2)CC1 588152733 PMFAVTMDCBFVAI-UHFFFAOYSA-N 380.454 5.351 30 20 GKED CCCc1ccc([C@@H](NC(=O)N2CCC[C@H](CC#N)C2)c2cccs2)cc1 596108119 VDVHKVCXKKENCE-WIYYLYMNSA-N 381.545 5.125 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CSCc3cccc(Cl)c3)n2)cc1 602742431 FRPLCXPLMFXHOG-UHFFFAOYSA-N 399.928 5.207 30 20 GKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1nnc(-c2ccccc2)o1 604044389 KACOETAUJCNZEN-KRWDZBQOSA-N 396.450 5.360 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2cnc[nH]2)cc1 604484739 OBXDNYYYIQOBGW-UHFFFAOYSA-N 396.475 5.352 30 20 GKED CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 604499596 HBLXVGVGDNJUJU-UHFFFAOYSA-N 386.455 5.108 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(F)ccc1N1CCCCC1 608893717 VAZJPSVZESBPIT-UHFFFAOYSA-N 394.494 5.132 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1c2c(nc3ccccc13)CCC2 609377306 BKCGZCBCLIDENO-HNNXBMFYSA-N 387.508 5.228 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C[C@H]3CCOc4ccccc43)c2)cc1 609785455 GGXJCPLCZQRPHE-GOSISDBHSA-N 384.435 5.245 30 20 GKED CCc1ccc(CC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 610174084 GSLUEZPHHAMSBY-UHFFFAOYSA-N 384.479 5.189 30 20 GKED CSc1cccc([C@@H](NCc2ccccc2C#N)c2ccc(F)c(F)c2)c1 610258966 WTDYIFKPCZJSOG-JOCHJYFZSA-N 380.463 5.438 30 20 GKED CN(C[C@H]1CCCO[C@@H]1c1ccccc1)c1c(C#N)cnc2ccc(Cl)cc12 610274736 APCMFJWAXDWUCR-UZUQRXQVSA-N 391.902 5.364 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1C#N)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 610654781 CSNVLECUQMIQPB-SNVBAGLBSA-N 386.820 5.023 30 20 GKED Cc1nc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc(C(F)(F)F)n1 642226832 HJGPLANQOYKKQB-YUMQZZPRSA-N 395.269 5.125 30 20 GKED C=CCn1c(SCCCC(=O)c2ccc(F)cc2)nnc1-c1ccc(F)cc1 669910206 DJFYIURZFCPJHR-UHFFFAOYSA-N 399.466 5.165 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)c1cc(F)c(C(F)(F)F)c(F)c1 683204878 JMDURXQCFOBKKC-UHFFFAOYSA-N 383.238 5.341 30 20 GKED C=C(C)CCc1noc(-c2c(-c3ccc(Br)cc3)noc2CC)n1 685385098 QPYVNDGBFOIHQO-UHFFFAOYSA-N 388.265 5.225 30 20 GKED C#CCCOc1ccc(/C=C2/SC(=S)N([C@@H](C)c3cccs3)C2=O)cc1 726629742 QKRARIDDGRSAIK-RAOBZKRQSA-N 399.562 5.113 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CSc2ccc(OC)cc2)c1 728181380 DXVNGBQSDMLYIF-UHFFFAOYSA-N 393.533 5.064 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 728181790 CKUKYHWATYHODI-DLBZAZTESA-N 391.458 5.631 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1nc2cc(F)ccc2s1 730924411 YWMNAUJEZMQXPM-GUDVDZBRSA-N 386.451 5.569 30 20 GKED Cn1c(CC(=NOCc2ccc(Cl)s2)c2ccccc2)nc2ccccc21 731664837 XWYNSATZVZPVQQ-UHFFFAOYSA-N 395.915 5.452 30 20 GKED FC(F)Oc1ccc(NN=Cc2cc(Cl)ccc2Br)cc1 743437447 DXCANGQPUSCIAZ-UHFFFAOYSA-N 375.600 5.150 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744016553 OLYPRUPQXZUANP-IEZBTEQYSA-N 386.398 5.595 30 20 GKED CC(=NN[C@H](C)c1ccc(C(C)C)cc1)c1sc(-c2cccnc2)nc1C 747611740 VUGWLVBMNQBTAT-OAHLLOKOSA-N 378.545 5.712 30 20 GKED N#Cc1ccc(C(=O)O[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)s1 750205889 OAEGZVYFLDSACP-LBPRGKRZSA-N 379.281 5.099 30 20 GKED CCOc1cc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)ccc1O 750915070 BZSPFMQTPOPJDT-ZROIWOOFSA-N 376.424 5.318 30 20 GKED Cc1ncc(CO)c(C=Nc2ccc([C@@H](C)Sc3ccccc3)cc2)c1O 752152240 FRBFCPOWLPTMHX-MRXNPFEDSA-N 378.497 5.192 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1SC(F)F 752620092 DLOBBJSAXQMJHU-WBVHZDCISA-N 387.455 5.305 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)nc1 753538264 JBNISHVAQVTPFI-ZDUSSCGKSA-N 388.279 5.310 30 20 GKED Cc1nn(Cc2ccccc2)c(Cl)c1C=NOc1ccccc1C(F)(F)F 754711921 DBUZGWANOMEIAH-UHFFFAOYSA-N 393.796 5.325 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2cccc(NC(=O)C3CCC3)c2)cc1 764760385 IMWKJKKYCLUYIG-QGZVFWFLSA-N 398.934 5.407 30 20 GKED C=CCn1c(-c2cccs2)nn(CN(Cc2cccs2)C2CC2)c1=S 764877334 FHPVFTBAMITIBB-UHFFFAOYSA-N 388.587 5.012 30 20 GKED CCSc1ccc([C@@H](C)NCc2ccc(OC)c(O[C@H](C#N)CC)c2)cc1 772984956 HIJLFKCBMZTULB-APWZRJJASA-N 384.545 5.339 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1Cc2ccccc2C[C@H]1c1nnc(C)o1 775488723 LTQRIKUYAQDQJA-GCJKJVERSA-N 397.563 5.781 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc(O)cc2F)c1 782854930 JQLXCMCBDQRWPS-UHFFFAOYSA-N 382.778 5.101 30 20 GKED COCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)sc2cccc(F)c12 792108959 ZSKLQOGJPLYBAH-OAHLLOKOSA-N 390.439 5.225 30 20 GKED C=CC[C@H](OC(=O)c1csc([C@@H]2CCCO2)n1)c1ccc(Cl)c(Cl)c1 797553070 QRQAVOKMFUBSQG-HOTGVXAUSA-N 398.311 5.776 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567176 ZGMJBAZDPMLCOY-NWDGAFQWSA-N 378.950 5.451 30 20 GKED C[C@H](OC(=O)C(C)(C)c1csc(-c2cccs2)n1)c1cccc(C#N)c1 800293330 OVOOJJIJLRPKIL-ZDUSSCGKSA-N 382.510 5.325 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)s1 802250311 QNXLCEUWCGTYII-OCCSQVGLSA-N 384.398 5.346 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1O 806162336 UWONDEYISOEUHE-IBGZPJMESA-N 397.906 5.192 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 806201280 VXRTULJETMZWFD-DEOSSOPVSA-N 397.478 5.229 30 20 GKED N#C[C@H](C(=O)Cc1coc2ccc3ccccc3c12)c1cc(C(F)(F)F)ccn1 813218851 UCJQIWZQQYHNAA-KRWDZBQOSA-N 394.352 5.419 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 815010905 SHEXYERMIKHREO-QFIPXVFZSA-N 383.495 5.675 30 20 GKED CSc1ccccc1NC(=O)[C@@H](C)ON=Cc1cccc(Cl)c1Cl 818618612 UUPYMYGHCZFFAG-LLVKDONJSA-N 383.300 5.093 30 20 GKED Cc1ccnc2sc(C(=O)[C@H](C#N)C(=O)c3cc4c(s3)CCCC4)c(C)c12 845833300 FGWHLHKXIHNAEB-CQSZACIVSA-N 394.521 5.059 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3scnc3C)cc2)c1 850137545 QQINYXNEPBVKRG-FQEVSTJZSA-N 377.513 5.089 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3CC4(CCCCC4)C3)n2)cc1 850791057 QJFCHYGYNKMQPY-SFHVURJKSA-N 375.497 5.219 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CCC2)c1 915181174 YAZKTOZTYJQITN-DEOSSOPVSA-N 380.491 5.711 30 20 GKED CCc1cccc(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916652521 BFNSHUOLGWYRCA-GOSISDBHSA-N 396.899 5.281 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)COc2ccccc2C(C)C)cc1 916948459 VSWWJAUSVXONGH-DYESRHJHSA-N 392.499 5.050 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3ccc(F)cc3s2)cc1 916955271 NVQQUTYBFVFJQB-SCLBCKFNSA-N 394.471 5.515 30 20 GKED N#C[C@@H](C(=O)CCSc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 917024916 CJQRADCTQCKZMB-KRWDZBQOSA-N 398.940 5.822 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2[nH]c3ccccc3c2Cl)cc1 918126905 HKDUHFKVCGCPRM-IBGZPJMESA-N 385.854 5.729 30 20 GKED C=C(C)c1cccc(NC(=O)N(Cc2c(C)noc2C)Cc2c(C)noc2C)c1 934878758 OOTSEPFFBAXWEL-UHFFFAOYSA-N 394.475 5.164 30 20 GKED Cc1c(O)nc2ccccc2c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 1627605003 YEPKCLRZLKYKNM-UHFFFAOYSA-N 395.418 5.165 30 20 GKED O=C(O)c1cccc(NN=C(CC23CC4CC(CC(C4)C2)C3)c2ccccc2)c1 1776036739 CMUPXRRDAHXNGN-UHFFFAOYSA-N 388.511 5.808 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CCc2ccccc2)CC(=O)O)cc1 1776786581 WDMYUJQDBVQLQK-HSZRJFAPSA-N 397.559 5.602 30 20 GKED CCCCCCCOc1ccc(CN[C@](C)(CCCCCC)C(=O)O)cc1 1776788027 MJVRDXDJQCWOFX-HSZRJFAPSA-N 377.569 5.939 30 20 GKED CCc1cccc2cc(/C=C/C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)oc12 1776977830 OCBRKCUNXYEPOL-ZHACJKMWSA-N 386.403 5.850 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C3CC(=C)C3)CCC2)cc1 1789622788 YKSDSZZYLZIQCG-UHFFFAOYSA-N 380.532 5.079 30 20 GKED CCn1c(SCCCC#N)nnc1-c1cc(-c2ccccc2)nc2ccccc12 5622608 ACVKGJWUFZTXPV-UHFFFAOYSA-N 399.523 5.576 30 20 GKED Cc1ccc(-n2c(SC[C@@H](C#N)CCC#N)nnc2-c2cccc(C)c2)cc1 15242488 PNWJNQLQRWHZGM-GOSISDBHSA-N 387.512 5.087 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)NC2CCCCC2)cc1 27329840 UMQGOARPXQWCLV-UHFFFAOYSA-O 395.592 5.014 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nn1C(C)(C)C 51157183 RMUSWWBLIIJMIY-HNNXBMFYSA-N 398.919 5.214 30 20 GKED CN(C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)c1cccc(C#N)c1 63326205 DHBQNZLRFZHMPQ-UHFFFAOYSA-N 397.453 5.441 30 20 GKED Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c2cccnc12 105720411 KQKREELYCCWRNY-UHFFFAOYSA-N 395.487 5.818 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)Nc1cccc(OCCCC#N)c1 108293150 ODYDQZNTISVLNO-UHFFFAOYSA-N 392.480 5.359 30 20 GKED COc1ccc(CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1 109029401 GYISXDUABREHPM-INIZCTEOSA-N 395.528 5.286 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1COc1ccccc1 113570631 QXWICJHUAAHLJB-MSOLQXFVSA-N 395.528 5.156 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 116594569 AQMLLKREYJPOBW-OXQOHEQNSA-N 385.492 5.360 30 20 GKED N#CCCn1cc(CNc2cccc(-c3nccs3)c2)c(-c2ccccc2)n1 120783089 OAAIMOZWEWLKAG-UHFFFAOYSA-N 385.496 5.199 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1nnc(-c2ccc(Cl)cc2Cl)o1 123873565 UDIBIVWIGINPEC-NEPJUHHUSA-N 387.270 5.327 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)c2)c1 132099909 BMNFCJWTNCHUHI-FQEVSTJZSA-N 396.475 5.066 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)Nc1ccc(F)cc1OCC#N)C1CC1 135293767 ZBDVOUPIELMDQH-ZDUSSCGKSA-N 387.842 5.139 30 20 GKED CC(=O)Nc1ccc(Cl)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 151137747 HYMHXWAUHPNVJB-UHFFFAOYSA-N 395.871 5.151 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n(C)n1 173309010 DACQXKYGPBMCSZ-GOSISDBHSA-N 392.890 5.105 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1 184297031 VTUSLGHKSMIENW-WZONZLPQSA-N 397.478 5.309 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(O[C@@H](C)c2ccccc2)cc1 191224663 GUIUEZAQCWBRSN-ROUUACIJSA-N 386.451 5.370 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(NC(C)=O)c(OC)c1 191456272 WAIBKSHEJHNFST-UHFFFAOYSA-N 381.476 5.150 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1NC[C@H]1CCCO[C@H]1c1ccccc1 195670102 NPRHGGHCYHWQBK-QRQCRPRQSA-N 395.865 5.479 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1c(-c2c(F)cccc2Cl)noc1C 216650187 HNTGFIKUHHNEHQ-UHFFFAOYSA-N 390.867 5.332 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1OCCCC#N 237266288 RZUSWPVPIYNRPQ-HNNXBMFYSA-N 392.421 5.247 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cc(F)ccc1Oc1ccccc1 303203488 OTQFUNFFRJYHBM-UHFFFAOYSA-N 375.403 5.154 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cnn1-c1ccccc1 303375977 UPVRZVGPDGZMNL-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c(Br)c1 391344994 PWXQUCPKGMFSBO-NSHDSACASA-N 389.318 5.068 30 20 GKED N#CCc1ccc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)c(Cl)c1 411018177 RETTXXPSXQLFTQ-BAUKFBFWSA-N 396.840 5.493 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc1OC1CCCC1 430641238 IJSSUOMUWFFYRF-MRXNPFEDSA-N 398.528 5.261 30 20 GKED CC(C)COc1cccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 433193276 PFHRYGSYGPOAPJ-VXKWHMMOSA-N 377.488 5.025 30 20 GKED N#CCCn1cc(CN2CCC[C@@H]2CCC2CCCCC2)c(-c2ccncc2)n1 435124029 KZBJBFTUOCSOLA-HSZRJFAPSA-N 391.563 5.184 30 20 GKED Cc1cc(O)c(C(C)C)cc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 436542412 BQAOWHWWKZLXHG-QGZVFWFLSA-N 377.271 5.126 30 20 GKED CS[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 437477756 UNFHSIMEIMFZAG-NRFANRHFSA-N 392.455 5.532 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2noc(-c3cccs3)n2)cc1F 444400628 SEGZTHDBIXGJSU-UHFFFAOYSA-N 392.415 5.213 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(OCc3cscn3)c2)CCCC1(C)C 445237623 HYSYARRRLCQMNQ-IBGZPJMESA-N 385.533 5.321 30 20 GKED COc1cc(NC(=O)Nc2cccc(OCCCC#N)c2)ccc1C(F)(F)F 448087547 FWNNBKGSNGTXOA-UHFFFAOYSA-N 393.365 5.041 30 20 GKED N#Cc1ccc(NCC(=O)Nc2ccccc2-c2ccccc2)cc1C(F)(F)F 462188049 MNUITONCBOOKGR-UHFFFAOYSA-N 395.384 5.295 30 20 GKED Cc1cccc(Br)c1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 464409010 WXNZWRZOWVENMG-QGZVFWFLSA-N 385.305 5.050 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1 469203707 ZYEOLMQFCBBFNI-UHFFFAOYSA-N 385.895 5.755 30 20 GKED C[C@H]1[C@@H](Cc2ccccc2)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 472750524 JSZTUMRWKQOKEO-WSTZPKSXSA-N 393.556 5.423 30 20 GKED CC(C)CN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)CC(C)(C)C 474221944 VUTOEDXKMWNENU-QGZVFWFLSA-N 375.582 5.023 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)[C@@H](CC)CO 475556848 UKZUWXDWMIKONA-NRFANRHFSA-N 380.532 5.344 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccccn1)c1ccc(F)c(F)c1 477726285 SSGAJHUDQWKHTB-VXKWHMMOSA-N 393.437 5.066 30 20 GKED Cc1nc(NC(=O)c2ccccc2NC2CCCCC2)sc1SCC#N 479719235 GNSONRJIRSUPNG-UHFFFAOYSA-N 386.546 5.064 30 20 GKED N#Cc1c(NC(=O)c2c(F)c(F)cc(F)c2F)sc2c1CCCCCC2 481164847 AQFVOGJGEPLNEG-UHFFFAOYSA-N 382.382 5.087 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F 482230435 XLPLHUPNINKXOI-OXQOHEQNSA-N 386.417 5.324 30 20 GKED CCCN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@@H]1CCCc2cccnc21 482280287 YTEQADZASIMUKK-HSZRJFAPSA-N 399.542 5.148 30 20 GKED N#C[C@H](C(=O)c1cccc(COc2cccc(F)c2)c1)c1nccc2ccccc12 483224005 DVCYMSUSDTXZRS-QHCPKHFHSA-N 396.421 5.443 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3coc4cc(F)ccc34)n2)cc1 483451711 BNVDOQBUAFTHAW-INIZCTEOSA-N 376.412 5.494 30 20 GKED N#Cc1ccccc1-c1ccc(CS(=O)(=O)Cc2cc3ccccc3o2)cc1 486740094 GHUCHIMPQUROKR-UHFFFAOYSA-N 387.460 5.086 30 20 GKED C=CC[C@H](C(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 488619794 ANGKYPGZGKSGEC-CYFREDJKSA-N 398.506 5.476 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc([C@@H]2CCCOC2)c1 499140624 FJDKYWCSNYKDBR-QGZVFWFLSA-N 375.921 5.124 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1ccc(Cl)c(Cl)c1 501015182 AHGXBAWXSDTKLS-UHFFFAOYSA-N 385.250 5.234 30 20 GKED Cc1cc(Cl)ccc1Cc1cnc(NC(=O)c2cccc(CC#N)c2)s1 502535381 IGXIKAUHMWRQIH-UHFFFAOYSA-N 381.888 5.014 30 20 GKED C[C@H]1C[C@H](C)CC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 502633427 KCHBULXPYPYWPD-KGVIQGDOSA-N 391.515 5.278 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](c2ccccc2)[C@H]2CCCc3ccccc32)CC1 504420711 YNHPCHNEVXZONQ-XZOQPEGZSA-N 387.527 5.183 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1c(C)nn(CC(F)(F)F)c1C 505016627 KBGUOZPIZXHSAR-CYBMUJFWSA-N 394.441 5.064 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)N(C)C[C@@H](C)C#N)cc1 509229310 YFHSTIZNLLBMSV-AWEZNQCLSA-N 387.867 5.154 30 20 GKED Cc1cc(S(=O)(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(C)s1 511733615 HAYQCFYJGZTCMT-UHFFFAOYSA-N 398.509 5.138 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3c(Cl)cccc3Cl)C3CC3)o2)c1 513246646 APGNGQHPFJVNKT-UHFFFAOYSA-N 399.281 5.080 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@@H](C)Oc1ccccc1C#N 516230289 GBBRTSDJZYTWAM-QGZVFWFLSA-N 388.492 5.424 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc2ccccc12 517533700 YJTYJDIWAUIWLH-INIZCTEOSA-N 375.497 5.556 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccc(F)c(C(F)(F)F)c3)c2C#N)C1 519109581 IYDNCSLXQWFADP-SECBINFHSA-N 382.382 5.155 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 520924079 HYOUINZVLLJOHZ-UONOGXRCSA-N 390.961 5.854 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c1 521377080 CYHSMQTXLFLRSJ-UHFFFAOYSA-N 382.341 5.622 30 20 GKED C=CCOc1ccc(CN[C@@H](Cc2ccccc2)c2cccs2)cc1OC 522630423 NJTZZTWADSIJST-FQEVSTJZSA-N 379.525 5.395 30 20 GKED CC[C@@H](C)n1c(SCc2cn3ccccc3c2C#N)nnc1-c1ccccc1 523353565 HDKOSDXMFXQWGP-MRXNPFEDSA-N 387.512 5.333 30 20 GKED CCCCOc1ccc([C@@H](C)Nc2nc(C(F)(F)F)ccc2C#N)cc1OC 523755026 PHYVRXJBDRGASE-CYBMUJFWSA-N 393.409 5.333 30 20 GKED Cc1ccc(-c2ccc(CNC3(c4ccc(C#N)cc4)CCOCC3)s2)cc1 527812249 QGOAZTZIVMKDLE-UHFFFAOYSA-N 388.536 5.391 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(N2CCCC2=O)c1 538113615 WYLXPDHMNJGEFE-IBGZPJMESA-N 395.506 5.203 30 20 GKED Cc1ccccc1-c1cnc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 542017350 QGRZZMLXNKJPFL-LJQANCHMSA-N 393.490 6.040 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nc(-c2cccs2)no1 542931211 ADENTTTVHVKKGQ-VIFPVBQESA-N 381.404 5.542 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC2CCCC2)nc1 543794025 HSIJDAUFNIIJBM-HNNXBMFYSA-N 381.501 5.050 30 20 GKED C[C@H](NCc1cc(-c2ccccc2)n[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543876886 IHSXAPRFBNUANY-SFHVURJKSA-N 378.479 5.466 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc3nc(C(F)F)sc3c2)cc1OC 552378754 NGZNUQPQBGHDPG-UHFFFAOYSA-N 390.411 5.060 30 20 GKED C[C@@H](C#N)CNC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 554307924 DJAQBCRKFLLERR-LBPRGKRZSA-N 379.312 5.175 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 554399082 MKDBPKAQUZSBME-IBGZPJMESA-N 394.906 5.447 30 20 GKED N#Cc1ccc(CN[C@H]2CCSc3ccc(Cl)cc32)c(C(F)(F)F)c1 584561581 QAXKQFHKANJSAE-INIZCTEOSA-N 382.838 5.557 30 20 GKED COc1ccc(CNC2(c3ccccc3Cl)CCC2)cc1OCCCC#N 593648696 RPEXGILRJIQZFT-UHFFFAOYSA-N 384.907 5.200 30 20 GKED COc1ccc2nc(N(Cc3ccccc3)C(=O)c3cccc(C#N)c3)sc2c1 600836377 CFHGRXXIIXTZPV-UHFFFAOYSA-N 399.475 5.024 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H](C)C(=O)c1ccccc1 602109879 YLUHHSOXIIKIEB-SFHVURJKSA-N 398.462 5.507 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1cccc(OCCCC#N)c1 603972314 LRHCRQPRSNBSKY-GOSISDBHSA-N 380.488 5.207 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 609398066 AWCIFTZKUXSQAX-YCRPNKLZSA-N 397.519 5.740 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCc1cccc2ccccc12 609434778 PWXFLVXPBKMWBG-QGZVFWFLSA-N 389.524 5.598 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccc(Cl)c(Cl)c1 609463584 LSHQMANAHJQIRN-INIZCTEOSA-N 389.213 5.387 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@H]3CCCC[C@H]3c3ccccc3)cc2)nc1 609502191 SSXFLBRDZOZRCP-GOTSBHOMSA-N 397.478 5.202 30 20 GKED Cc1ccc(CN(C)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)o1 609729781 TXUDEILDLQZLML-UHFFFAOYSA-N 380.831 5.178 30 20 GKED C[C@@H]1CCC[C@@](C#N)(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)C1 609735242 DTOWJJPYLHLJPB-ZUOKHONESA-N 381.526 5.227 30 20 GKED COc1ccc(C(C)(C)C)cc1NCc1ccc(OC)c(OCCCC#N)c1 610909741 CURKWDHDSASPNM-UHFFFAOYSA-N 382.504 5.296 30 20 GKED CCn1c(S[C@H](C#N)c2ccc(Cl)cc2)nc2sc(C)c(C)c2c1=O 619864102 PVOKZZOTHIJZRW-CQSZACIVSA-N 389.933 5.105 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCN3CCC[C@@H]3C2)cc1)C(F)(F)F 647229886 XFRBFFAVEFJXCM-ZIAGYGMSSA-N 384.339 5.015 30 20 GKED C=CCC1(NCc2nc(-c3cc(Cl)ccc3Cl)cs2)CCOCC1 657632937 DBCQJRZBMDDXTI-UHFFFAOYSA-N 383.344 5.332 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 665395562 MSHJGJZAMBWPIE-VQIMIIECSA-N 381.476 5.097 30 20 GKED Cc1cc(F)ccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 676393906 OYEBLPARPVOWOE-ZDUSSCGKSA-N 378.350 5.253 30 20 GKED N#Cc1ccc(NC(=S)N[C@@H](c2ccccc2)c2ccc(F)cc2)cc1Cl 726462220 DXIGJPWPCQROCU-FQEVSTJZSA-N 395.890 5.427 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/CCc3sccc3C2=O)cs1 726894322 XYOXXNZPFWTOQE-RAXLEYEMSA-N 398.484 5.241 30 20 GKED N#Cc1ccc(CSCC(=O)O[C@@H](c2cccc(Cl)c2)C(F)(F)F)cc1 730419596 BRCMMLSWGZYYEB-KRWDZBQOSA-N 399.821 5.292 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](Oc2cccc(C(C)C)c2)c2ccccc2)n1 730684982 DUMXGGRTQONMAK-IRLDBZIGSA-N 390.508 5.572 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)OCc3nc4ccccc4o3)cc2)cc1 732379570 KUTCRWUVBMGVML-UHFFFAOYSA-N 384.391 5.043 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3c(c2)oc2ccccc23)c1 733842923 FRQJURKTRKVWJN-GOSISDBHSA-N 399.450 5.589 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)cc1 734771721 GBNBNYQDQWAUOA-SLFFLAALSA-N 388.417 5.362 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 740531251 OFFJUPRGCJLGFF-WFASDCNBSA-N 388.414 5.604 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(SCC(F)F)cc1 741759759 NNPIEVBMNGXTID-UHFFFAOYSA-N 384.835 5.232 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)CCc2[nH]c3ccc(F)cc3c21 743057546 UIJZHJMPOTUHMT-PTNGSMBKSA-N 385.398 5.102 30 20 GKED CCC(CC)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)SC 743092875 FSAVBWKPAPSNGQ-HXUWFJFHSA-N 381.545 5.385 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2occc2Br)s1 751224638 CFHMPSLSGTWMOT-UHFFFAOYSA-N 386.315 5.049 30 20 GKED C=CCCO[C@@H](C)C(=O)O[C@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753355962 SKCAYXPJBGYLIG-NEPJUHHUSA-N 384.259 5.234 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)cc1 772421687 GEPNUFWNSKSQDQ-FQUZAXHOSA-N 393.490 5.192 30 20 GKED COc1ccc(C(=O)/C=C/c2cc(Cl)cc(C(F)(F)F)c2)cc1NC(C)=O 780185917 ABJZIDZJHOWNAM-HWKANZROSA-N 397.780 5.222 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C/c1cnc(-c3ccccn3)s1)C2 782369741 OKBGVAIROWYMCS-UKTHLTGXSA-N 397.297 5.098 30 20 GKED C=C(Cl)CNC(=O)C/C(=C/c1cccc(OC)c1)c1nc2ccccc2s1 787379384 AXYTZFWHSHBKEW-YBEGLDIGSA-N 398.915 5.104 30 20 GKED CCc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1C1CCCC1 789620382 GOOUYRGUJZZOEY-JOCHJYFZSA-N 398.510 5.468 30 20 GKED Cn1nccc1[C@@H]1CCCC(=NNc2nc3cc(C(F)(F)F)ccc3s2)C1 790296133 BOHQEJPKNWYOTH-LLVKDONJSA-N 393.438 5.174 30 20 GKED C[C@H]1CCCN(c2ccc(CN[C@@H](C)c3ccc(OCC#N)cc3)cc2Cl)C1 800494295 VTVHWYORQCVZON-ROUUACIJSA-N 397.950 5.329 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2nc(-c3ccccc3)cs2)C(=O)c2ccccc21 802706985 CGBBYAOVAMCFIN-XCTGESOMSA-N 389.476 5.127 30 20 GKED O=C(Nc1ccccc1OC(F)(F)F)c1cc(F)c(C(F)(F)F)cc1F 804199168 QVGFWMGMKHKZOY-UHFFFAOYSA-N 385.210 5.135 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Nc1ccc(CC[C@H](O)c2ccccc2)cc1 806244386 YZLRZZKMKCEPFH-QHCPKHFHSA-N 385.467 5.177 30 20 GKED COc1sc(/C=C/C(=O)c2c(F)cccc2Cl)cc1Br 809159548 RKDVRKKPRJRPOB-AATRIKPKSA-N 375.646 5.208 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813218195 SWFHZVNUTVKPDZ-WMLDXEAASA-N 390.405 5.176 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)Cc2ccccc2O1 814578358 YUHJXLYRZBGKEF-JPYJTQIMSA-N 397.478 5.157 30 20 GKED N#CCCC[C@H](N)c1nc(C2(c3cccc(C(F)(F)F)c3)CCCCC2)no1 823110293 PKQDFCCWXAYSCN-INIZCTEOSA-N 392.425 5.032 30 20 GKED CC(C)(C)Oc1ccc(NCc2nnc(-c3cccc(Cl)c3)o2)cc1C#N 834634864 HYNNXPNVPOTNCA-UHFFFAOYSA-N 382.851 5.051 30 20 GKED CC(C)(CC#N)CNC(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 838754491 CAPWARJNWXMSFQ-GFCCVEGCSA-N 386.348 5.034 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@@H](C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc1 916938893 MRSYKBNROOJRGK-ACAQERRYSA-N 398.865 5.137 30 20 GKED Cc1c(NN=C(CCCc2ccccc2)c2ccc(F)cc2)cccc1C(=O)O 1776088642 ZTDNKGHSTWZKJR-UHFFFAOYSA-N 390.458 5.671 30 20 GKED O=C(/C=C\c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccc(Cl)cc1 1776114796 BEXGIFXUIKWQFU-VKVQTHCXSA-N 392.838 5.441 30 20 GKED CCCCCCCC/C=C\CCCCCCCC(=O)NCC1(CC(=O)O)CC1 1776785320 URVJPWMUIZHDKK-KTKRTIGZSA-N 393.612 6.395 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc3c(C(=O)O)c[nH]c3c2)cc1 1776786598 ATBVEJTWYJKDFW-UHFFFAOYSA-N 392.499 6.021 30 20 GKED CCc1cccc2cc(/C=C\C(=O)c3ccc(OCCCC(=O)O)cc3)oc12 1776977812 JTXZCTYPTVIUKN-SEYXRHQNSA-N 378.424 5.135 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)s1 1777462983 YZUQNIGMTOQRJV-FAEGWCMCSA-N 375.449 5.112 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2csc(C(=O)O)c2)cc1 1777472314 SZMGOVUQTLPOMK-IZZDOVSWSA-N 378.449 5.230 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1777566872 QAIFQSVTBIFIJO-DEDYPNTBSA-N 379.415 5.136 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)COc3c(Cl)cccc3Cl)c2C#N)C1 23055567 XLTRTGBCILHDAG-SNVBAGLBSA-N 395.311 5.069 30 20 GKED C[C@H](NC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccc(C#N)cc1 26122525 GZFZNQOKYMIYCJ-INIZCTEOSA-N 390.870 5.135 30 20 GKED CCN(C(=O)c1ccccc1-c1ccccc1C#N)c1nc2ccccc2s1 26907787 HOXZJZRYNPKINA-UHFFFAOYSA-N 383.476 5.502 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)[C@H](C#N)c1nc2ccccc2[nH]1 41496112 PIQIDZUKRQOZIO-AWEZNQCLSA-N 392.871 5.138 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1 46654403 YNAJUQWDJPZRDN-SFHVURJKSA-N 379.504 5.028 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCn1ccc2ccccc21 57089416 AUMNDJVIVFEZEC-UHFFFAOYSA-N 396.450 5.038 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1c[nH]c2cc(Cl)ccc12 66801597 SVYBNIYTPQLHFD-CYBMUJFWSA-N 383.904 5.397 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cccc(C(=O)N2CCCCC2)c1 108353950 OVFABDFXXQDVSO-GOSISDBHSA-N 393.556 5.177 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ncc(-c2ccccc2)o1 109028273 SRZJAMGVFHSZMM-HNNXBMFYSA-N 392.484 5.058 30 20 GKED CCc1nc2c(s1)[C@@H](N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1)CCC2 133532265 ZNTODBQOXIQATB-KRWDZBQOSA-N 382.533 5.048 30 20 GKED N#C[C@@H](C(=O)c1cncc(F)c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 151678834 XUSNHIWJOSKVTD-ZDUSSCGKSA-N 392.242 5.141 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccc(F)cc1 158666259 DFTLQPUDEAGUQU-HXUWFJFHSA-N 389.430 5.325 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2cccc(F)c2)CC1 159296255 PTJUNAIZMJNZRH-OAHLLOKOSA-N 383.492 5.073 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)c1cccc(SCC#N)c1 175629949 DJZRJCGTJRBNJW-UHFFFAOYSA-N 395.709 5.279 30 20 GKED COc1ccc(CNc2ccc(SC(F)F)cc2)cc1OCCCC#N 178810898 XAGYDNKHJCWOOH-UHFFFAOYSA-N 378.444 5.305 30 20 GKED CC[C@@H](CC#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 183818110 XMCUKDCSLVEOKF-AWEZNQCLSA-N 382.847 5.087 30 20 GKED Cc1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)s1 194680868 MDEXGHTWBCQTFC-NSHDSACASA-N 394.308 5.372 30 20 GKED Cc1ccccc1-n1c(SCCCCC#N)nc2cc(Cl)ccc2c1=O 195563883 HYKQHNCZBUXQCZ-UHFFFAOYSA-N 383.904 5.134 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)c(Br)c1 195656681 SLTZTURJFMTZPF-ZDUSSCGKSA-N 377.257 5.444 30 20 GKED CSc1ccsc1C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N 425636428 JWAGLQDCGCAOPC-NSHDSACASA-N 384.448 5.043 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)cc2)c1)c1cnc2ccccc2n1 429571786 YIDJZFSJOKBDTE-INIZCTEOSA-N 389.867 5.502 30 20 GKED N#Cc1ccc(NC(=O)CCSc2ccc(Br)cc2)c(Cl)c1 430354773 KYLYLAXTSABPHQ-UHFFFAOYSA-N 395.709 5.095 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC1(CC#N)CC1 431140450 VDFKHYYZVBWYEL-UHFFFAOYSA-N 392.286 5.195 30 20 GKED N#CCCC[C@H](NC(=O)NCCSc1ccc(Cl)cc1)c1ccccc1 431766537 QLYKLMYIGJSQPQ-IBGZPJMESA-N 387.936 5.166 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 432760797 XGRMMRPIJSEZTF-UHFFFAOYSA-N 389.377 5.431 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1c1ccncc1 433135778 OJHXSWDIEZGDMN-JOCHJYFZSA-N 398.466 5.361 30 20 GKED Fc1ccc(F)c([C@@H](NCc2nc3cc(C(F)(F)F)ccc3o2)C(F)F)c1 434667545 WGTYRZNEUBSJIG-OAHLLOKOSA-N 392.274 5.221 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1F 437844875 IYZHIIDUDMHROF-YWZLYKJASA-N 381.451 5.100 30 20 GKED Cc1cncc(N(Cc2ccc(F)cc2)C(=O)c2ccc(C(C)(C)C#N)cc2)c1 441415404 VROZOJBLFHZOKZ-UHFFFAOYSA-N 387.458 5.177 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccccc1 455028078 WPGAIIHOOOIMPX-OAHLLOKOSA-N 383.402 5.057 30 20 GKED C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1ccccc1Oc1ccccc1C#N 456116596 JBDFUJYQZFZLNT-GDBMZVCRSA-N 388.389 5.154 30 20 GKED CCc1nc2c(s1)[C@@H](N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1)CCC2 458794579 BHRHXBSCKOCIHF-HKUYNNGSSA-N 396.560 5.159 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1)c1ccccc1 458843483 POVHDRRZYDKKAA-PZJWPPBQSA-N 381.907 5.274 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c(-c2ccccc2)s1 464411222 LVHMWYMTEFNAGW-CQSZACIVSA-N 387.386 5.022 30 20 GKED C[C@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCCCC1 465998914 BOGWBLXKIUKUGX-SFHVURJKSA-N 391.515 5.422 30 20 GKED C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cn(CCCC#N)c2ccccc12 469455925 AKKHBTYJHURNDA-MJGOQNOKSA-N 389.474 5.102 30 20 GKED COc1ccc(CNc2cccc(C)c2Br)cc1OCCCC#N 469550150 SACLVNKLPPPPOT-UHFFFAOYSA-N 389.293 5.061 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 469600020 CLJGEHILHXYAOM-UHFFFAOYSA-N 381.863 5.249 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1cc(C2CC2)nc2c1cnn2C(C)C 470640766 DBAGDQWNWMVDKL-UHFFFAOYSA-N 388.515 5.108 30 20 GKED Cc1cc(C)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(OC2CCC2)n1 470887591 FPXGLMYUBVQYED-AWEZNQCLSA-N 395.528 5.134 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F 471519777 LGYMCMHLCPPNMN-INIZCTEOSA-N 398.457 5.280 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccccc1 474596180 RCLVQZLMYGIGRH-AWEZNQCLSA-N 396.796 5.307 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)CC(=O)c1ccc(Cl)cc1 476797822 UNFAFAMJKOAPEM-INIZCTEOSA-N 383.919 6.040 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)[C@@H](C)C(F)(F)F 477971195 UFDJANIOLVJVRY-LBPRGKRZSA-N 396.796 5.417 30 20 GKED C=CCC1(C(=O)Nc2ccc(Cl)c(-c3nnc4n3CCCCC4)c2)CCC1 478056870 YNHFNXPOMAWOPW-UHFFFAOYSA-N 384.911 5.010 30 20 GKED C[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc(C#N)cc1 479498633 DMMSJIVJKGBAMA-INIZCTEOSA-N 383.476 5.072 30 20 GKED COc1cc([C@@H](C)NCc2ccc(Cl)cc2C#N)ccc1OC1CCCC1 480889377 NFTAIAKQWJSJFZ-OAHLLOKOSA-N 384.907 5.392 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nccc2ccccc12 483238381 CQBQATKYDKBMPD-SFHVURJKSA-N 382.444 5.346 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2sc3c(c2C#N)CCC3)s1 483917276 VFVCIDKJWKODSZ-UHFFFAOYSA-N 379.510 5.101 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1)c1ccccc1 498249441 DQIWSFJHDMSGQI-GGAORHGYSA-N 389.474 5.317 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cccc(Br)c2Cl)cc1C#N 503328370 IHTRKAPGGLUAOA-UHFFFAOYSA-N 393.668 5.014 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)c3ccccc3Oc3ccccc3)CC2)cc1 504702370 GJMMXZLRYRUMKK-UHFFFAOYSA-N 398.462 5.034 30 20 GKED N#C[C@H](NC(=O)CCCc1c[nH]c2ccccc12)c1c(Cl)cccc1Cl 505540701 QYDVKTNACOAPDF-SFHVURJKSA-N 386.282 5.178 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Cl)c(C#N)c2)cc1NC(=O)c1ccccc1 506644204 UOMDKTILLNRBPT-UHFFFAOYSA-N 389.842 5.025 30 20 GKED CCCc1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508055140 UTXRROZYAGRDHD-FQEVSTJZSA-N 381.545 5.125 30 20 GKED Cc1c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)sc2ccc(C#N)cc12 509552019 AKDVREBQUJHDNS-UHFFFAOYSA-N 394.340 5.038 30 20 GKED CCC(CC)N(C(=O)CSc1ccc(C#N)cc1)[C@H]1CCCc2cccnc21 511306974 PVJSBTFPJHNKHY-NRFANRHFSA-N 393.556 5.140 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cccc(Cl)c2F)c1 513449533 YIZNESZQLFBVAR-UHFFFAOYSA-N 380.806 5.182 30 20 GKED O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513506702 RKCVXTSBDXRZTE-GFCCVEGCSA-N 383.307 5.039 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3oc4ccccc4c3C)n2)cc1 516714160 RITRHZNTONDYEG-KRWDZBQOSA-N 388.448 5.363 30 20 GKED CC(C)C[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 517654046 HJWTVQIFRMTVAL-JOCHJYFZSA-N 385.467 5.263 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC(C)(C)c1ccccc1 519099867 LOJSFZCKRWGXSE-UHFFFAOYSA-N 385.467 5.360 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)Sc2ccnc3ccccc23)c1 521345404 AYTAQUFVNXXGLZ-GOSISDBHSA-N 389.524 5.279 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1cccc(O)c1)c1ccc(C(F)(F)F)cc1 533546771 OSCRLYXGSNALFX-LJQANCHMSA-N 392.421 5.260 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1cccc(Br)c1)c1ccccc1 535354130 JEAYFTCMUHCJOO-OXJNMPFZSA-N 384.317 5.473 30 20 GKED Cc1ccc(NC(=O)Nc2cccc3c2CCN(CC(C)(C)CCC#N)C3)cc1 537631722 SWERNCFSTBZADW-UHFFFAOYSA-N 390.531 5.327 30 20 GKED C[C@@H](NCc1nc(Cc2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541084077 GMZCIOIHEKEULN-GOSISDBHSA-N 394.478 5.050 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542968361 XDKNWYRVEMQTEJ-HOTGVXAUSA-N 387.483 5.201 30 20 GKED C[C@H](N[C@H](C)c1ccc([S@](C)=O)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543033646 JZHGXAIYYPANJR-IYFHLELXSA-N 388.536 5.374 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc([N+](=O)[O-])ccc1SCC1CCCC1 543441641 IUTFDURCWREJAT-UHFFFAOYSA-N 395.484 5.310 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H]1CC[C@@H](C#N)C1 549933782 BQWWAGCGPIZOTB-IACUBPJLSA-N 390.350 5.224 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)sc2ccc(C#N)cc12 550847195 QMMGCRFQXJWNPL-ZDUSSCGKSA-N 391.521 5.585 30 20 GKED N#CCCCOc1cccc(NCc2cnc(-c3ccc(Cl)cc3)s2)c1 551560768 KKGCIMLXJMKYTM-UHFFFAOYSA-N 383.904 5.758 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2ccc(C#N)cc2F)C1 552871523 GQOAMLMFJTXFRE-GOSISDBHSA-N 393.506 5.409 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)C2)cc1 562099991 LHBGIVGTGHFSMR-LJQANCHMSA-N 398.466 5.075 30 20 GKED CC(C)Oc1ccc(Cl)cc1NCc1cn(CCC#N)nc1-c1ccccc1 565781218 CXHJQFNVNCDBNA-UHFFFAOYSA-N 394.906 5.516 30 20 GKED CN(CCC1CCCCC1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 565862666 AONODYUDAXZAPO-UHFFFAOYSA-N 378.476 5.180 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)CCOCc1ccccc1 569018741 OMCHCSOTPCPWLS-MSOLQXFVSA-N 397.544 5.198 30 20 GKED O=C(N[C@H](c1ccccc1)C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 574495501 QRCKPPBJOFMXOS-CYBMUJFWSA-N 383.238 5.017 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1cc(C)c(-c2cccc(Cl)c2)s1 578552455 MMKAMNAKDIEPPF-SFHVURJKSA-N 378.950 5.142 30 20 GKED CC(C)[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(C(C)(C)C)cc1 583884325 GXQGMSDRIYXLNZ-QFIPXVFZSA-N 388.515 5.393 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC[C@@H](C)O1 596692136 XBVDCJDJMRKYEL-GQIGUUNPSA-N 397.906 5.027 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 608851522 XZSBKBUGAMTWJZ-FQEVSTJZSA-N 386.417 5.263 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)C1CCCCCC1 609078377 MDXDNMFFJINXGA-UHFFFAOYSA-N 391.515 5.632 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 609497283 ACPYBLBRSWACQH-HNNXBMFYSA-N 390.405 5.004 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3ccc4ccccc4n3)c2)cc1 609638797 FJKNOUNUXVJYFI-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)(F)F 609682393 ISGZRSHHGFTHJJ-GUYCJALGSA-N 393.434 5.363 30 20 GKED C[C@H]1CC(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C[C@H](C)C1 610093353 DPNIWORBHMAXIM-QZTJIDSGSA-N 391.515 5.278 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1cccc(C#N)c1 610320808 LLQACZHDMHUOGW-GOSISDBHSA-N 385.467 5.158 30 20 GKED CCN(CCC(F)(F)F)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 611854602 SDQUFDPOQULCHT-HNNXBMFYSA-N 389.421 5.270 30 20 GKED COc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 613407265 NQKCHIGOQSMEDP-GFCCVEGCSA-N 377.252 5.102 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccccc4)sc32)cc1Cl 619754985 QDVFHQSYADFHKM-GOSISDBHSA-N 379.916 5.502 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 619804236 FRDLIYVZHSRPCK-UHFFFAOYSA-N 399.922 5.190 30 20 GKED CC1(C)CN(C(=O)c2cc(F)c(C(F)(F)F)c(F)c2)CC[C@H]1C(F)(F)F 683250862 AHBRPWSIUPTRFT-LLVKDONJSA-N 389.286 5.034 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C)cc3)o2)cc1NC(C)=O 726428724 PAMAMSSQWBWQPN-PKNBQFBNSA-N 375.424 5.118 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 728265088 CJBURSLQBJCWGW-UHFFFAOYSA-N 393.874 5.189 30 20 GKED Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 734644596 SMTIIMAIHDTUJJ-XMMPIXPASA-N 398.510 5.038 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccncc2)n1)c1ccc(Cl)cc1 735978669 IQFMAXYIWOVYEQ-UHFFFAOYSA-N 391.784 5.047 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)c1ccco1 744035193 LDEXTILXWBMOBB-MFKMUULPSA-N 391.279 5.690 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 747105943 FUVDPHVKALZWDJ-INIZCTEOSA-N 393.899 5.549 30 20 GKED CCCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1cccnc1 750122013 KNQZAIBDSDZFPD-UHFFFAOYSA-N 391.858 5.456 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(C)cc3)o2)cc(OC)c1OC 750897173 XRRDFOMKFJKCPN-LUAWRHEFSA-N 378.424 5.177 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCSc2ccc(Cl)cc21 753143309 DGEQRMLVLQVFGI-LCYFTJDESA-N 384.913 5.621 30 20 GKED CCc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1CC(C)C 755510417 GQLBKUSCTGIUMX-NRFANRHFSA-N 386.499 5.009 30 20 GKED CCC(=O)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)ccc1F 756927523 RZUYNYQCFMXZJH-NRFANRHFSA-N 386.426 5.326 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2nc(-c3ccc(F)cc3)cs2)ccc1OC 756965719 PSRVPJUWDYCRQS-QGZVFWFLSA-N 397.475 5.251 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1ccc(Cl)nc1 759083078 JYUJGALLOSHANT-QPJJXVBHSA-N 391.279 5.320 30 20 GKED C=C[C@H](CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)c1ccccc1 759862053 NMDCUEXEKJRKMF-GOSISDBHSA-N 390.449 5.003 30 20 GKED C[C@@H]1C(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C[C@H]1c1ccccc1 767783099 TZHNNJKYCOLIOO-XJKSGUPXSA-N 397.404 5.149 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](c1ccccc1)C1CCOCC1)c1ccccc1 771992245 VQUGZPKQCHBIPX-GOTSBHOMSA-N 378.516 5.161 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)OCC3(C#N)CCOCC3)c2)c1 780541729 FOQLXIOLDHQMRA-UHFFFAOYSA-N 395.524 5.073 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1 780576132 JSPROFVGCWMCJE-AWEZNQCLSA-N 392.459 5.351 30 20 GKED C=CCC[C@H](C(=O)O[C@@H](C)c1nnc(-c2ccc(F)cc2)o1)c1ccccc1 784824611 JLJNQDDVVKEHOR-KXBFYZLASA-N 380.419 5.230 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cn(C(C)(C)C)nn1 790214464 AXRLUAISRPFFAP-KTKRTIGZSA-N 386.908 5.015 30 20 GKED CC(C)(Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797569038 MSNNZGWVTHIBBK-AWEZNQCLSA-N 376.909 5.128 30 20 GKED N#CCCC[C@H](Nc1nc(-c2cccnc2)nc2ccccc12)c1ccccc1 814264032 VCBMDPCZZLDHMH-NRFANRHFSA-N 379.467 5.539 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 842939860 YVEBFLOJVYIVJI-MRXNPFEDSA-N 393.537 5.180 30 20 GKED O=C(O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)C1CC2(C1)CC2(F)F 851029692 ZOLZLKSNPZFYBA-QDYJBQRPSA-N 388.254 5.287 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc([C@@H](O)C(F)(F)F)cc2)cc1 864021007 FJEBVUYAVVCCIE-SCLBCKFNSA-N 385.813 5.587 30 20 GKED CCCc1ccc(S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915190705 MESVRPVNWCOFQZ-QHCPKHFHSA-N 390.508 5.095 30 20 GKED COc1ccccc1Nc1nc(Cl)c(C=NN[C@H](C)c2ccccc2)s1 920382759 NXHOWOLJKPLDEV-CYBMUJFWSA-N 386.908 5.233 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccccc3)nc2)cc1 921202589 UWHMDNOPIUDQHC-QHCPKHFHSA-N 390.446 5.051 30 20 GKED COc1ccc(C[C@@H](C)C=NNc2cccc(C(=O)O)c2C)cc1C(C)(C)C 1776088717 DSYYMURAODPRNF-OAHLLOKOSA-N 382.504 5.276 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cscc1C(F)(F)F 1776355226 WNQVFPMBQYMBMW-HYXAFXHYSA-N 384.375 5.148 30 20 GKED CCCCCCCCCCCN(C)CCOc1ccc(C(=O)O)cc1Cl 1776784543 AYEBJAJYFGOAPT-UHFFFAOYSA-N 383.960 5.880 30 20 GKED CCCCCCCOc1ccc(CN[C@@H]2CCCC[C@@H]2CCC(=O)O)cc1 1776786445 VZCAKNPWQZGMEO-IFMALSPDSA-N 375.553 5.549 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2csc(C(=O)O)c2)cc1OC 1776789391 ZEMATFWDYPRANV-VQHVLOKHSA-N 388.485 5.310 30 20 GKED COc1cc(C)ccc1C(=O)/C=C/c1ccc(-c2cccc(C(=O)O)c2)s1 1777280634 HPKLSYZTSLGFAQ-JXMROGBWSA-N 378.449 5.326 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(C)ccc2C)nnc1-c1ccccc1 4285688 HNQHPOQYQBFQMN-QGZVFWFLSA-N 377.513 5.111 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(-c2nccs2)c1 56776479 CTYBEJPHRXVWGT-UHFFFAOYSA-N 379.485 5.039 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1nc2c(c(C)c1C#N)CCC2 60715983 AMUTZELXPYXATR-INIZCTEOSA-N 393.556 5.302 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66802213 XXLCITMHVIBYOJ-CQSZACIVSA-N 377.469 5.297 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc2c(s1)CCOC2 103000472 NXLWZNQNNABOCY-UHFFFAOYSA-N 390.464 5.046 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1)c1ccccn1 106983695 COQFENGDIVLXPH-IIBYNOLFSA-N 396.874 5.584 30 20 GKED COc1ccc(F)cc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 108241946 ZKUUNAUJPHIIMF-UHFFFAOYSA-N 398.381 5.111 30 20 GKED Cc1ccc(-c2cc(-c3nnc(SCCCC#N)o3)c3ccccc3n2)cc1 119441436 RJMHOQCQQGPIAC-UHFFFAOYSA-N 386.480 5.656 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1nc2cc(Cl)ccc2s1 120048505 WZQTUEKJSTZMEF-JBLDHEPKSA-N 386.826 5.495 30 20 GKED N#C[C@H](C(=O)Cc1ccoc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 123700691 PPCPHIFAXFGGGB-CYBMUJFWSA-N 377.252 5.129 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2ccco2)c2ccccc2OC)ccc1OC 151108908 DEMOIAXHKOAGFD-XMMPIXPASA-N 393.483 5.131 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 173968790 CNTPLWIMIXGGRY-QFBILLFUSA-N 376.481 5.092 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ncccc3C(F)(F)F)c2)cc1 180081401 LOUCQLSHEQASGT-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H]1CSCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 192203235 QKKDKMXFCMZZJO-BEFAXECRSA-N 399.947 5.212 30 20 GKED CC(=O)c1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 192786896 GWCFHDMCDLQTOQ-SFHVURJKSA-N 394.883 5.465 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)o1 248540282 BFSBXJKBRNBODK-WDYCEAGBSA-N 397.544 5.987 30 20 GKED C[C@H](Nc1c(F)cc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 301075707 DFSHUMBAQJZWJT-AWEZNQCLSA-N 377.394 5.262 30 20 GKED Cc1ccc(C#N)c(N[C@H]2CCCc3cc(NC(=O)OC(C)(C)C)ccc32)n1 302452348 PSOOFCRYKXPNDJ-IBGZPJMESA-N 378.476 5.098 30 20 GKED OC(=Nc1ccc2c(c1)oc1ccccc12)N1CCC(OC2CCCC2)CC1 329251892 BSFLLQMBQSVRJB-UHFFFAOYSA-N 378.472 5.555 30 20 GKED Cc1ccc2c(c1C)OC[C@@H]2/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329446720 LZAOSKAWXCRLRY-RXVVDRJESA-N 393.531 5.200 30 20 GKED Cc1cc2c(cc1C)[C@H](/C(O)=N/[C@@H]1CCCc3cn(C4CCCC4)nc31)CO2 330000517 WNZDFZVAQUOJPL-WOJBJXKFSA-N 379.504 5.125 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1sccc1-c1ccccc1 409595757 AMDSLNZDPPFDQD-UHFFFAOYSA-N 378.453 5.152 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1ccccc1Oc1ccccc1C#N 427729813 WRSUCEHWWBGLNC-CQSZACIVSA-N 376.378 5.201 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C2 431976592 FMAIDHLETRMERT-UHFFFAOYSA-N 397.478 5.188 30 20 GKED C[C@@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N(C)CC(C)(C)C#N 433327411 SPXJUUCITOWPPQ-INIZCTEOSA-N 380.923 5.281 30 20 GKED O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)Nc1ccc(F)cc1C(F)(F)F 438583478 MUJHIZJJWWSNNC-ZJUUUORDSA-N 386.311 5.335 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 439859323 ZOFDTVSUOFMFPY-UHFFFAOYSA-N 398.249 5.613 30 20 GKED C=CCN(C(=O)c1coc2ccc(OC)cc12)c1nc(-c2ccccc2)cs1 440450358 YBBFNIDCURRKDX-UHFFFAOYSA-N 390.464 5.398 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441533322 MONFGHOHAFLAOC-KXBFYZLASA-N 391.437 5.510 30 20 GKED C[C@@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)c1cccc(C#N)c1 442915679 RFBKFBUGJSUBFO-MRXNPFEDSA-N 386.480 5.311 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H]1Cc1ccccc1 443850054 FJBDXZLDRRXAGX-NRFANRHFSA-N 397.478 5.508 30 20 GKED N#CCCCn1cc(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)c2ccccc21 444232345 QBJUHYHHDUGXIN-GOSISDBHSA-N 391.902 5.228 30 20 GKED N#CCc1ccc(NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)c(Cl)c1 452646005 OEPHMPGFJGNWOT-UHFFFAOYSA-N 395.890 5.177 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1 455200563 KPMLTFDRDVMAFC-ROUUACIJSA-N 393.384 5.163 30 20 GKED CSC[C@H]1CCCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)C1 455938882 FVOVSVOGWIRCJL-INIZCTEOSA-N 397.569 5.316 30 20 GKED CC(C)(CC#N)CNCc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 459704185 XBSBJPIDNKMZJG-UHFFFAOYSA-N 390.314 5.275 30 20 GKED C=CCc1cccc(C(C)C)c1NCC(=O)Nc1ccccc1SCC#N 473676796 NSBGDJHOFIGFED-UHFFFAOYSA-N 379.529 5.205 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(CN2CCCCCC2)cc1)c1ccccc1 475320378 PTHOPPFZIHAFJF-QFIPXVFZSA-N 375.516 5.089 30 20 GKED N#CCCn1cc(CN[C@H]2CC[C@@H](c3ccc(F)cc3)C2)c(-c2ccccc2)n1 475346136 MRAASTARRCKUBK-OFNKIYASSA-N 388.490 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2cccs2)nc1C 476138579 HULGWNLZSFXRFN-UHFFFAOYSA-N 376.525 6.223 30 20 GKED N#Cc1ccc(CC(=O)Nc2cc(Cl)ccc2NCc2ccccc2)cc1 477758044 YFBLICOZGUDUPN-UHFFFAOYSA-N 375.859 5.005 30 20 GKED Cc1nc(CSc2ccc(C(=O)N(CCC#N)CC(C)(C)C)cc2)cs1 477778045 URUYNXBBJJHITD-UHFFFAOYSA-N 387.574 5.146 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC(OCc3cccc4ccccc34)C2)cc1 478202686 CEXPZWXGZRQOHW-UHFFFAOYSA-N 399.494 5.074 30 20 GKED CC(C)c1cnc(-c2ccc(NCc3cn(C)nc3-c3ccc(C#N)cc3)cc2)o1 478234260 MNQDQBLHKQYBPM-UHFFFAOYSA-N 397.482 5.349 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 481329769 JVZXXJAVILWBKB-OAQYLSRUSA-N 395.528 5.490 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3nc(C(F)(F)F)cs3)c2)cc1 482814926 COZSZJLFKLVVBT-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)c1cccc(Cl)c1F 484051187 ICSZXWWGNVDKLX-ZDUSSCGKSA-N 390.911 5.647 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1cnn(-c2ccc(F)cc2)c1C 485735127 QJEILCRTOQBWCV-HNNXBMFYSA-N 395.503 5.089 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1csc(C(C)(C)C)n1 499337978 QRIPLQZLPOBTJS-UHFFFAOYSA-N 397.997 5.096 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2F)o1)c1ccc(Cl)cc1 499835460 DDLXWYBLUYKVPM-LJQANCHMSA-N 382.822 5.053 30 20 GKED N#CC1(CCCSCC/C=C\c2ccc(Br)cc2)CCOCC1 507697288 ICVASFNOWKCTGX-RJRFIUFISA-N 394.378 5.686 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(Cl)cc1-c1nc(CC(C)C)no1 510224057 SBTPTEIQMRKLFK-UHFFFAOYSA-N 394.862 5.021 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N(CC)c2ccc(C#N)cc2)cc1OC 510372309 IZKHGUPFWRVCAZ-UHFFFAOYSA-N 386.879 5.066 30 20 GKED C[C@@H](Cc1cccc(F)c1)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 520555505 ZGFQOVIFNKYXCB-KRWDZBQOSA-N 388.442 5.094 30 20 GKED C[C@@H]1CCN(C(=O)CCCCOc2cccc(C#N)c2)c2ccccc2S1 521087260 VODNYVYBIOLRBV-QGZVFWFLSA-N 380.513 5.025 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3ccccc3OC(F)F)cc2)c1 524022002 DHDIJKBBHUYCQY-UHFFFAOYSA-N 394.377 5.133 30 20 GKED CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CCCCOc1cccc(C#N)c1 524767895 DNQJEPSPJGJBCJ-BJKOFHAPSA-N 390.527 5.292 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)c(F)c1 525503691 QXOIJIFQEPMXFB-UHFFFAOYSA-N 388.773 5.100 30 20 GKED CC(C)c1cccc(O[C@@H](C(=O)Nc2cc(CC#N)ccn2)c2ccccc2)c1 531929587 YCDIUFKNOMONIZ-HSZRJFAPSA-N 385.467 5.030 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 532810854 WWQZMEQHKPRUGW-YWZLYKJASA-N 392.890 5.151 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 535585616 WKCGGZHXIQNYIR-AWEZNQCLSA-N 380.831 5.430 30 20 GKED C=C(C)Cn1c(SCCCSCc2ccccc2)nnc1-c1ccncc1 536446720 DQIYBKAPPKDASO-UHFFFAOYSA-N 396.585 5.332 30 20 GKED C=CCC[C@@H](N[C@H](C)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 536841744 YXLPGDBOYBQPJF-QVKFZJNVSA-N 390.449 6.022 30 20 GKED COc1ccc(C[C@H](N[C@H](C)c2cccc(C#N)c2)c2ccc(OC)cc2)cc1 538397699 SWQDKMGSOIWQMX-CJAUYULYSA-N 386.495 5.210 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NCCCC2(C#N)CCOCC2)cc1 538612209 ZZMXOZAAQNMGMU-LJQANCHMSA-N 380.557 6.052 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc([S@](C)=O)cc1)c1ccc(C(F)(F)F)cc1 539051932 QCHXTNUWYSZEQR-AGBIPYHCSA-N 395.490 5.801 30 20 GKED Cc1ccnc2[nH]c([C@H](C#N)C(=O)c3ccc(-c4cccc(C(C)C)c4)o3)nc12 539582421 IBFRLRBEAXOUFA-QGZVFWFLSA-N 384.439 5.140 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 540777609 WBNHTWVKAHPEJC-RBUKOAKNSA-N 394.540 5.033 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](CCCCc2ccccc2)c2ccccc2)CC1 542854255 PBZSPCAIZJFORH-DEOSSOPVSA-N 389.543 5.476 30 20 GKED C=CCn1c(SCc2sc(C)nc2C(F)(F)F)nnc1-c1ccccc1 544679489 IQPGJDFQDBKOIU-UHFFFAOYSA-N 396.463 5.207 30 20 GKED CC[C@H](CC#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 545156376 QEMAGJUDMJKJIN-QGZVFWFLSA-N 378.497 5.288 30 20 GKED Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c2c1NCCC2 552217128 WFPHSAYKFQMSBE-UHFFFAOYSA-N 399.519 5.628 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccn(C)c1C1CCC1 555819085 BHAPZQBLBPJQJP-UHFFFAOYSA-N 399.494 5.304 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(Oc2ccccc2)o1 557610162 CQCDJLBNBMBXMW-UHFFFAOYSA-N 379.460 5.068 30 20 GKED CC(C)(C)[C@@H](NCc1cnc2ccc(C#N)cn12)c1cccc(C(F)(F)F)c1 563739402 PTKGCFBMLBVCJO-IBGZPJMESA-N 386.421 5.102 30 20 GKED O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)[C@H]1CC[C@H](C(F)(F)F)C1 567069387 DKVIZMAVTBWQJA-HOTUBEGUSA-N 391.714 5.177 30 20 GKED C[C@@H](c1c(F)cccc1F)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 568427755 MDMLJUZCDVHNIF-KGLIPLIRSA-N 389.471 5.441 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(Br)s1 582391918 CFRNYQYNDILYCD-VIFPVBQESA-N 389.240 5.252 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1F)CC1CC1 596735016 KKHKTSFCYHNVPV-INIZCTEOSA-N 397.519 5.664 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)C1 597908809 BVQJKRADBREZLB-AWEZNQCLSA-N 389.282 5.552 30 20 GKED N#Cc1c(NC(=O)c2cccnc2Sc2ccccc2)sc2c1CCCC2 600840964 DENIHJFNMDABOA-UHFFFAOYSA-N 391.521 5.297 30 20 GKED N#Cc1c(NC(=O)CSc2c(F)cc(F)cc2F)sc2c1CCCCC2 603939147 XNIXPVPCDPVVRU-UHFFFAOYSA-N 396.459 5.037 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cnc(-c4ccccc4Cl)s3)[nH]c12 605362962 BAOPBHVNCIQETR-ZDUSSCGKSA-N 392.871 5.138 30 20 GKED C=CCCCCCN(C)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 606813797 CCODDIXRWIHFCG-UHFFFAOYSA-N 384.467 5.453 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 609080345 HLGOWDOSGJTOAS-RBUKOAKNSA-N 399.494 5.889 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCCn3cnc4ccccc43)cc2)c1 609429578 PRLLOFVKFPEGOV-UHFFFAOYSA-N 396.450 5.119 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 609501199 XRUXFOZASFPBRJ-UHFFFAOYSA-N 387.464 5.293 30 20 GKED N#C[C@H](NC(=O)C[C@H]1CCc2ccccc21)c1ccc(OCc2ccccc2)cc1 609661954 NFTKKQZMOBUTRY-RDGATRHJSA-N 396.490 5.067 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1OC(C)(C)C 609685099 QHDWQBBKOMESNF-UHFFFAOYSA-N 379.504 5.426 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 610097660 RKQUYHBXCIFSDV-UHFFFAOYSA-N 377.366 5.313 30 20 GKED C[C@H](NC(=O)Nc1cccc(COc2cccc(F)c2)c1)c1cccc(C#N)c1 610318839 CSBCAIJMGHRKKV-INIZCTEOSA-N 389.430 5.159 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 611468853 MQBLEDWAFNSUSH-IBGZPJMESA-N 391.858 5.546 30 20 GKED N#Cc1ccc(CN[C@@H](Cc2ccccc2)c2cccs2)c(Br)c1 612482071 LLKWUDVOPVZHPD-IBGZPJMESA-N 397.341 5.456 30 20 GKED C=C(CNCc1cc(OC)c(OCc2ccccc2)c(OC)c1)c1ccccc1 620757000 YKFXPEBKTSPOPW-UHFFFAOYSA-N 389.495 5.086 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C4CC4)[nH]c3C3CC3)n2)cc1 626312586 FWKJVTRSNXEZFM-SFHVURJKSA-N 398.491 5.255 30 20 GKED CCCCN1Cc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2C1 726489331 JMYXLFLXRGICLA-UHFFFAOYSA-N 384.936 5.136 30 20 GKED Cc1cccc(N2C(=O)/C(=C\c3cccc(OCCCC#N)c3)SC2=S)c1 726802277 ZMNHEDGYJJXDCG-XMHGGMMESA-N 394.521 5.083 30 20 GKED COc1cc(CON=C(C)c2nc3ccccc3n2C(F)F)ccc1SC 731664134 XFNDEFVVODCJMI-UHFFFAOYSA-N 391.443 5.103 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)c2csc3ccccc23)c1 733803172 UXSUHYJGXRZLKD-DOTOQJQBSA-N 393.512 5.143 30 20 GKED CC(C)(C)c1csc(C2CCN(c3nc(C(F)(F)F)ccc3C#N)CC2)n1 734479179 HNDSXCQUNFMGND-UHFFFAOYSA-N 394.466 5.110 30 20 GKED COc1ccc2cc(CN(C)Cc3cc(Cl)ccc3OCC#N)ccc2c1 735306084 HTHFZZDCROUTTQ-UHFFFAOYSA-N 380.875 5.036 30 20 GKED C[C@@H](S[C@H](C)c1cccs1)C(=O)Nc1sc2c(c1C#N)CCCCC2 737401885 HIFDJCUUXTUZPC-CHWSQXEVSA-N 390.599 5.772 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](C)c2ccc(C)o2)cc1 742610276 JLSZDFHJJMBTOT-OAHLLOKOSA-N 376.412 5.003 30 20 GKED O=C(/C=C/c1ccccc1-n1cncn1)c1ccc(Cl)c(Cl)c1Cl 745313342 MEZMMWSUIWTPOO-VMPITWQZSA-N 378.646 5.124 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746658017 ALLUSSLCAWMESQ-LOSJGSFVSA-N 397.522 6.347 30 20 GKED C=CCn1c(-c2ccncc2)nn(CN2CCC[C@@H]2CC2CCCCC2)c1=S 747076051 JVDLHBMQBIBHKA-HXUWFJFHSA-N 397.592 5.054 30 20 GKED COc1cc(C(C)=NNc2nc(Cl)c(Cl)cc2Cl)ccc1SC 747611345 SRSPTAIBSVGFEH-UHFFFAOYSA-N 390.723 5.608 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 752521047 KLVSHKDUQHOWFJ-GUYCJALGSA-N 398.359 5.130 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2nc3ccc(F)cc3s2)cc1Cl 761479866 WQOWJXWJQKVIBJ-AATRIKPKSA-N 377.824 5.002 30 20 GKED C=CC[C@H](N[C@@H]1CCSc2ccc(Br)cc21)c1ccncc1 766018185 GFJNLWUPAANGIH-DLBZAZTESA-N 375.335 5.288 30 20 GKED CCc1nc(C)c([C@H](C)OC(=O)c2cn(CCCC#N)c3ccccc23)s1 774111968 VYQKEJAXSINXFA-HNNXBMFYSA-N 381.501 5.190 30 20 GKED N#C[C@H](C(=O)[C@H]1CCc2c(Cl)cccc21)c1nc(-c2ccccc2)cs1 776081521 PDXKRIDWFCLURL-DLBZAZTESA-N 378.884 5.370 30 20 GKED CC(=O)c1ccc(NC(=S)Nc2ccc(Oc3ccccc3)c(C#N)c2)cc1 777476218 HDTBBTGYSBKCMV-UHFFFAOYSA-N 387.464 5.362 30 20 GKED C=CCCCN(C)C(=O)N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 779705219 GDGNGAPWTRCKAR-IBGZPJMESA-N 387.524 5.019 30 20 GKED CC(C)(CCC#N)COC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 798876961 XKONXXFQWGWFIZ-UHFFFAOYSA-N 394.258 5.062 30 20 GKED CC(C)c1nc(C#N)c(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)o1 799479167 LAVQYZZMPHWMTK-CYBMUJFWSA-N 376.382 5.424 30 20 GKED Cc1nc(Cl)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 802043662 LOXVRMXFROZTPR-CQSZACIVSA-N 388.279 5.310 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 813057336 JYXQZKAMTULGFZ-BEFAXECRSA-N 384.888 5.230 30 20 GKED C[C@H](CC(C)(C)C#N)OC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 851202750 LNFPETRXCNNKRC-CYBMUJFWSA-N 394.899 5.101 30 20 GKED CSc1ccc(C=Nn2c(C)nc3scc(-c4ccccc4)c3c2=O)cc1 916310292 WRVZPJXZUXDLJI-UHFFFAOYSA-N 391.521 5.038 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1ccc2ccccc2n1 916849623 WBZRLSZHSRELIO-YPNIWSFNSA-N 398.462 5.992 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1ccc(Cl)s1 916904338 AORLWJUHBPKREZ-CQSZACIVSA-N 396.855 5.155 30 20 GKED COc1ccc(Cl)cc1C(CC(C)C)=NNc1ccc(F)c(C(=O)O)c1 1776062042 BAXKDIJQUPWDFY-UHFFFAOYSA-N 378.831 5.048 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(-c2cccnc2)c1 1776355404 JYPSHIZFWGNCIJ-NTMALXAHSA-N 387.435 5.130 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)cc1)c1ccccc1 1776469398 GPQUOWGJFGWYOL-UCNGFQGMSA-N 398.458 5.821 30 20 GKED C[C@H]1C/C(=C\c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2ccccc21 1776589823 ZOHQPPNFQDASNP-XOAFGZPJSA-N 388.419 5.330 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2ccc(OC)cc2)c1 1776788013 MEFNLNXSJLJCMW-HSZRJFAPSA-N 399.531 5.350 30 20 GKED CCc1c(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)oc2ccccc12 1776956222 IZDCXHOBNYCHDG-FPLPWBNLSA-N 399.240 5.352 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(-c2ccccc2F)s1 1777640978 LGMQOOMLRQWGKU-KTKRTIGZSA-N 396.439 5.304 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1791243215 FQUZDXCWFYKWSH-UTKZUKDTSA-N 394.490 5.044 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)C(C)(C)C(C)(F)F)CCC2)cc1 1791243643 AJSAYKPARVBXKK-OAHLLOKOSA-N 392.490 5.014 30 20 GKED N#Cc1ccc(/C=C(\c2nc3ccccc3[nH]2)c2nc3ccccc3s2)cc1 6209877 FSGNXZLDRYLASP-GHRIWEEISA-N 378.460 5.633 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)c1ccccn1 41492596 ZFDKOXGCGXJIHE-SFHVURJKSA-N 382.341 5.383 30 20 GKED COc1ccc(C)cc1[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 66954202 YTJKXBZLBCSOJZ-HOTGVXAUSA-N 383.517 5.281 30 20 GKED COc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954267 BZIZSAZDWDVDAA-LPHOPBHVSA-N 395.528 5.458 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C/C(=O)c1cnn(C(C)C)c1 72047955 SEEXXOWIRNTFJW-BQYQJAHWSA-N 389.286 5.161 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)ccc1SC(F)F 103250748 FAGWQLSIRBHCOJ-NEXMIYJRSA-N 389.423 5.197 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccccc1SCCC#N 108201662 YCDZCDMOQMSMNP-KRWDZBQOSA-N 380.513 5.150 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 108407716 JDABZYICLCLCDI-SJORKVTESA-N 395.572 5.502 30 20 GKED C=CCn1c(SCc2cc(Cl)nc(Cl)c2)nnc1-c1ccccc1 108968173 ILWZFDATZLEFKP-UHFFFAOYSA-N 377.300 5.125 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1OCC(C)C 108998774 OHMRSCJCJUIYDL-MRXNPFEDSA-N 398.528 5.377 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)cc2)C(C)(C)C)cc1OCCCC#N 120008072 BSHQGKIEAMFSOE-QFIPXVFZSA-N 384.495 5.394 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1)c1ccccc1 177080230 LVNDULIRNZZJLW-QGZVFWFLSA-N 387.508 5.728 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1nc(-c2ccc(F)cc2)cs1 185674451 YZWHZTSNCLVNDM-UHFFFAOYSA-N 397.500 5.136 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 186646486 LWFNSNNJIVMVRK-KSFYIVLOSA-N 399.897 5.131 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c2ccccc12 193284944 KEMKAGZDYRXXGP-INIZCTEOSA-N 391.377 5.083 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccccc2OC)c1C 194838159 PSCSFVPJWDJXPU-UHFFFAOYSA-N 389.499 5.294 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1NC[C@@H]1CCCO[C@H]1c1ccccc1 195670100 NPRHGGHCYHWQBK-NYHFZMIOSA-N 395.865 5.479 30 20 GKED Cc1cccc([C@@H]2CCCN2CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 247022672 DJSAKHNFLBWTEP-NQIIRXRSSA-N 393.556 5.022 30 20 GKED CCCCN(CC(F)(F)F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 302977684 ULBQBUSVNPIBIH-UHFFFAOYSA-N 395.265 5.529 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C(C)(C)C 303397466 PYFZNEPSGDVWIE-VGSWGCGISA-N 395.572 5.254 30 20 GKED C[C@@H](/N=C(/O)C1CCCC1)C(O)=Nc1cc(Cl)ccc1N1CCSCC1 328802668 MLKZJLRFJIYDCF-CYBMUJFWSA-N 395.956 5.016 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2cccc(N)c2)CC1 415152129 BKHLPWCRMPGIFD-INIZCTEOSA-N 394.544 5.075 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc2oc(C(C)(C)C)nc2c1 425645900 ARGSGKIDWDXWKO-AWEZNQCLSA-N 376.460 5.222 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc(C)c1OC(F)F 430626136 RGWHAGIOHYIQSK-ZDUSSCGKSA-N 378.444 5.149 30 20 GKED Cc1cc2sc(NC(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)nc2cc1F 434530036 LNBGORUMZFKBFF-QAPCUYQASA-N 394.475 5.048 30 20 GKED COc1cccc(Oc2ccc(NC(=O)C3(c4ccc(C#N)cc4)CC3)cc2)c1 436083986 XOJCQTLEQUWKEC-UHFFFAOYSA-N 384.435 5.029 30 20 GKED Fc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c(F)c1 436401567 WEFLAQNFSIMBBJ-HNNXBMFYSA-N 383.282 5.767 30 20 GKED Cc1ccc(Br)cc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 437753227 YBXAOHZAJIBKMU-HKUYNNGSSA-N 398.304 5.061 30 20 GKED Cc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(OCC(F)(F)F)c1 439318385 QNNPNRHQHHBILX-INIZCTEOSA-N 391.393 5.103 30 20 GKED Cc1ccccc1CCCSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 439883763 QHRVZHWXOPEVPV-SFHVURJKSA-N 398.597 5.694 30 20 GKED C[C@@]1(Cc2ccccc2)CCCN1C(=O)c1cn(CCCC#N)c2ccccc12 444265680 MGKFJQHKGIYWKR-VWLOTQADSA-N 385.511 5.182 30 20 GKED CC1(C#N)CCC(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 449168081 LTFIHHRFIIUODM-UHFFFAOYSA-N 379.451 5.391 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)c(F)c1 463719734 BFBSCHUIWLCDSG-GOSISDBHSA-N 381.451 5.127 30 20 GKED C[C@H]1C[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccsc2S1 469317957 GIBYIIBGXZKHJB-KBXCAEBGSA-N 397.569 5.369 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 473676966 PLCBLJPUNRTGMA-IRXDYDNUSA-N 399.585 5.549 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)sc2C)cc1 474426083 KADKCRYBMYWTSO-KRWDZBQOSA-N 396.537 5.802 30 20 GKED Cc1c([C@@H](C)NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)oc2ccccc12 479266186 LXEDWTCZPHZHAY-QGZVFWFLSA-N 385.467 5.173 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OC(F)F)c2cccnc12 482086868 BSYSBGXKSOXXEW-UHFFFAOYSA-N 389.427 5.118 30 20 GKED Cc1c(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cnn1-c1ccccc1Cl 482423776 PQZFJTYARUZJTO-UHFFFAOYSA-N 392.890 5.009 30 20 GKED N#C[C@H](C(=O)c1occc1CSc1ccccc1)c1nccc2ccccc12 483202172 QUTDKFJQLPFGGB-FQEVSTJZSA-N 384.460 5.610 30 20 GKED C[C@H]1COC(C)(C)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 486231612 NOTKDZSGWMBVSK-HNAYVOBHSA-N 397.906 5.027 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 497804759 RGTFRLKMELOIDM-HSZRJFAPSA-N 394.490 5.277 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 503138515 KGTIYSSVTMHTPU-QFBILLFUSA-N 380.513 5.085 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(F)c(C(F)(F)F)c3)CC2)cc1 503496394 SQBRVQQQYMTIOC-UHFFFAOYSA-N 389.352 5.037 30 20 GKED CO[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 504078973 WUILYUXDVYPZAQ-IFMALSPDSA-N 390.870 5.322 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2cccc3cccnc23)cc1 504768364 HLCPYCIKVSTSMB-UHFFFAOYSA-N 377.447 5.046 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1CC(c2ccccc2)C1 514588748 VWZNNDHYEMIVPE-MUYFXNHWSA-N 379.529 5.254 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCOc2ccc(Cl)c(Cl)c2)cc1 514900579 IBBUAYQBHQHIDE-UHFFFAOYSA-N 377.271 5.202 30 20 GKED COc1ccccc1C(C)(C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 518683115 IXZGXZOIEMWWCK-HNNXBMFYSA-N 383.517 5.004 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c1 520678820 QGFBGOKLSSJYIB-UHFFFAOYSA-N 396.368 5.816 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccc(Cl)cc12 520827734 ZBNKNFQUSCSVSG-LBPRGKRZSA-N 384.888 5.899 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(-c2cccs2)no1 520923307 JZMHZJUYUJCLBK-AWEZNQCLSA-N 388.452 5.635 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1F 534911905 GCEDFASWSSISQV-UHFFFAOYSA-N 377.822 5.241 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1c(C)noc1C 536033581 YPWZLHXNQKAGKP-NRFANRHFSA-N 389.455 5.031 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2cnn(CC(C)C)c2C(F)F)c1 536332653 JBVSOETWMCFRCW-UHFFFAOYSA-N 378.423 5.076 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1c(F)cccc1Br 537837464 UWMYIFLFVFDRKY-GFCCVEGCSA-N 379.298 5.595 30 20 GKED N#CCCCCNC(=O)N[C@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 537873820 BNLYARLEGKOHCJ-AEFFLSMTSA-N 381.442 5.115 30 20 GKED CC(C)(C#N)NC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 540972328 MPKGLQPCWOURFW-UHFFFAOYSA-N 379.312 5.318 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)ccc2o1 541445100 IQANLTOLFHMFQX-UHFFFAOYSA-N 388.471 5.193 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CC1 542902235 OTFPTEGOGYFGOR-UHFFFAOYSA-N 385.920 5.649 30 20 GKED C=CCSCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 543760670 WHNZFVOEKSMEHW-SFHVURJKSA-N 385.920 5.036 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 545511935 MDHDWQLDMZDOAN-AWEZNQCLSA-N 377.366 5.203 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccncc1OCc1ccccc1 552089319 GUFQUKHXBWJNEJ-DEOSSOPVSA-N 383.495 5.090 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OCC(F)(F)F)cc1 559867090 ZEIRRTQHCKJSRF-JXFKEZNVSA-N 376.422 5.713 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)c1c(F)ccc(SCC2CC2)c1F 563178410 FPBAUAMJFOUJEE-UHFFFAOYSA-N 392.858 5.439 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CSc2ccccc21 573062501 XWHDHPPBIDQAAE-GJZGRUSLSA-N 383.542 5.092 30 20 GKED Cc1ccc(N(C(=O)c2cccc(C#N)n2)c2nc3ccccc3s2)c(C)c1 589759626 VSTJRZQQHSFYOF-UHFFFAOYSA-N 384.464 5.158 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CCCc3sc(Cl)cc32)c(Cl)c1 590452337 CCSZMYKIVMUGPP-GFCCVEGCSA-N 385.703 5.387 30 20 GKED N#CC1(CC(=O)Nc2cccc(C[S@](=O)C3CCCCC3)c2)CCCCC1 597259478 BJVIDHMEMSLOQJ-MHZLTWQESA-N 386.561 5.071 30 20 GKED N#Cc1c(NC(=O)c2ccc(SCc3ccccc3)cc2)sc2c1CCC2 603946373 ASICGHSLSSZWSL-UHFFFAOYSA-N 390.533 5.653 30 20 GKED C=CCCOCC(=O)Nc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1C 607852010 CHHQSTJJGQLBCH-UHFFFAOYSA-N 395.478 5.263 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c(F)c1 609252618 CRHAKJXLWROGFX-LJQANCHMSA-N 399.878 5.001 30 20 GKED CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(C#N)nc1 609642498 ZWCHLRQYGPAOIA-QFIPXVFZSA-N 391.421 5.025 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C#N)cc2)nnc1-c1ccc(Cl)cc1 609813829 WOHDQCWEEQYQPJ-CQSZACIVSA-N 380.904 5.509 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610319561 SPTUJYXHRDXGHD-KRWDZBQOSA-N 398.466 5.002 30 20 GKED Cc1ccc(SCCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccco2)cc1 610631246 LMUMQOGTEWEQBX-UHFFFAOYSA-N 393.512 5.047 30 20 GKED C=CCN(C(=O)c1ccc(Oc2ccccc2)nc1)c1nc2c(s1)CCCC2 611765699 SOUJZINIYZRGGQ-UHFFFAOYSA-N 391.496 5.042 30 20 GKED C=CCn1c(S[C@@H](C)c2c(F)cccc2F)nnc1-c1ccc(F)cc1 613936572 ARRGMJRWDSUJBE-LBPRGKRZSA-N 375.419 5.402 30 20 GKED CCCn1c(C)c(C(=O)Nc2sc(C)c(C)c2C#N)c2cc(OC)ccc21 619126707 AQDCOMQEYXNXRG-UHFFFAOYSA-N 381.501 5.171 30 20 GKED CCCCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 619756519 RNEPHTTVGIVNJZ-FQEVSTJZSA-N 385.492 5.514 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1CN(C)C1CCCCC1 642419060 SZLJNSJTOWUIMJ-UHFFFAOYSA-N 397.588 5.733 30 20 GKED C=CCC1(NC(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)CCCC1 665822191 BIYSZRFAHSZDFF-UHFFFAOYSA-N 387.867 5.196 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)s2)c(C)c1 673813619 DXAAKDRYQRRSIN-OAHLLOKOSA-N 381.526 5.497 30 20 GKED COC(=O)c1occc1/C=C/C(=O)c1sc(-c2ccc(Cl)cc2)nc1C 727655585 YOKLMKGTHKWDOI-VMPITWQZSA-N 387.844 5.048 30 20 GKED Cc1ccc(C)c(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 727980641 PUXFJSVMTRCYIT-UHFFFAOYSA-N 387.508 5.563 30 20 GKED CCN(C)c1ccccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730136145 ZROJTTFSSMLTGW-QHCPKHFHSA-N 398.510 5.120 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C/c1cn(-c3ccccc3)nc1-c1ccncc1)C2 730949713 ZWRTUUJMDOGSKP-HMMYKYKNSA-N 377.447 5.065 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)NC12CC3CC(CC(C3)C1)C2 730954990 QZYGCWURHUXNFJ-LFPRZYRFSA-N 385.602 5.194 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(SC(C)(C)C)cc2)c1 733844334 JAHFTBKJKRBLPO-SFHVURJKSA-N 397.544 5.580 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 738896333 OCBOJWCOCNWBOJ-CPJSRVTESA-N 397.522 5.745 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3ccccc3C(F)(F)F)c2)s1 739596065 PTCUWDAAUSRNQK-UHFFFAOYSA-N 386.398 5.236 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3[nH]c4ccccc4c3Cl)c2)s1 739749532 JWYYSLAGEPRUSV-UHFFFAOYSA-N 391.883 5.351 30 20 GKED CCN(C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(C#N)cc1 742223246 YKIFPZVEIBRFLO-UHFFFAOYSA-N 377.447 5.440 30 20 GKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1ccc(OCc2ccncc2)cc1 742437796 XQBKQEOQHAOFRB-BXUJETTOSA-N 379.506 5.483 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1 742531466 IWYGNXVHWOSLFH-UHFFFAOYSA-N 380.488 5.170 30 20 GKED CC(=NN=Cc1cc(C)c(OCc2ccccc2Cl)c(C)c1)c1cnccn1 745206823 QZMPOUBQXYGLSI-UHFFFAOYSA-N 392.890 5.169 30 20 GKED O=C(/C=C\c1cnn(Cc2ccccc2Cl)c1)c1ccc(-c2ccncc2)cc1 745990575 VBCQNSGFCMSOLV-YHYXMXQVSA-N 399.881 5.543 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2SCc2ccccc2)c(F)c1 755129220 DJPUCHFKHQYASH-UHFFFAOYSA-N 380.419 5.381 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(Br)cc2Cl)cc1 765612798 FQHOYLTWFUBISQ-REPPVQDKSA-N 390.664 5.289 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2cccc(OCc3ccccc3)c2)cc1 766227351 ZZJJIWNZODHUSN-WOJBJXKFSA-N 386.495 5.407 30 20 GKED N#CCC1CCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)CC1 781834790 MEOZWHVVIYFOSJ-CQSZACIVSA-N 398.359 5.130 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)CCc2cc(Br)ccc21 794958291 ZKLWUAQHTNEGKP-JLHYYAGUSA-N 397.297 5.180 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570806 JZUPICDNSBYTNO-BRADTZPFSA-N 392.446 5.739 30 20 GKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1nnc(-c2ccccn2)s1 799485352 KJNCWRQAMHWEQX-UHFFFAOYSA-N 390.516 5.237 30 20 GKED C[C@@H](Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccc(OCC#N)cc1 800497249 CXEYELUAHCAIOU-GFCCVEGCSA-N 384.785 5.357 30 20 GKED CC(C)(C)c1csc(NC(=O)N2CCC(OCc3ccccc3)CC2)c1C#N 821481223 HVMKISSBAFVDEC-UHFFFAOYSA-N 397.544 5.130 30 20 GKED C[C@]1(Cc2noc(-c3cn(CCCC#N)c4ccccc34)n2)CC1(Cl)Cl 834865563 KGYPRISXVKZAHZ-SFHVURJKSA-N 389.286 5.121 30 20 GKED CC(C)Oc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915353847 QYPOLEBTWWLCCA-XMMPIXPASA-N 399.494 5.451 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cccc(C(F)(F)F)c2)S1 915848295 HMVZJPXLYSWQEQ-XNTDXEJSSA-N 376.403 5.214 30 20 GKED CSCCCNC(=S)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 917600467 TXROVJBAZZULEK-UHFFFAOYSA-N 391.949 5.043 30 20 GKED Cc1ccc(/C=C\C(=O)Nc2cccc(OCCCC#N)c2)c(Br)c1 917728478 SJTJGNZWEFSIQG-KTKRTIGZSA-N 399.288 5.092 30 20 GKED C/C(=C/C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 917806240 XSJMHKCRCZXFEO-ZPHPHTNESA-N 382.463 5.374 30 20 GKED CCOc1ccc(C=Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)c(O)c1 918152718 KUDYOOZYTRMHCB-UHFFFAOYSA-N 384.819 5.040 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 921008730 YYLOGULQPJFLLU-QGZVFWFLSA-N 388.442 5.094 30 20 GKED O=C(O)c1ccc(C=NNc2c(Cl)cc(Cl)cc2Cl)c(Cl)c1 1776014374 FMNVSEIYZUCLGQ-UHFFFAOYSA-N 378.042 5.444 30 20 GKED CC(C)c1ccc(NC(=S)NN=Cc2csc3ccc(C(=O)O)cc23)cc1 1776017229 ZIRMIHGNABGEQU-UHFFFAOYSA-N 397.525 5.043 30 20 GKED O=C(O)c1ccc(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)cc1F 1776074958 DSHCKRNRVTUAMM-AWEZNQCLSA-N 380.341 5.278 30 20 GKED O=C(/C=C\c1cc(C(=O)O)c(Cl)s1)c1ccccc1OCc1ccccc1 1776126559 PGAPFWWGBNIXEX-KHPPLWFESA-N 398.867 5.575 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1ccccc1C(F)(F)F 1776180536 HYVRTSXNUGPPLL-KRWDZBQOSA-N 383.797 5.173 30 20 GKED CC(C)Oc1ccccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776362201 NXISTECEQXRELV-QXMHVHEDSA-N 376.408 5.328 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CCCc2ccccc2)C(=O)O)cc1 1776786480 MMCPVUSALMQTPX-DEOSSOPVSA-N 397.559 5.602 30 20 GKED COc1ccccc1Oc1ccc(/C=C/C(=O)c2csc(C(=O)O)c2)cc1 1777388521 ROSOUZCYWSNICC-DHZHZOJOSA-N 380.421 5.143 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)s2)cc1 1777472281 GLANAVWGKFUQDN-BENRWUELSA-N 378.449 5.230 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1ccc(F)cc1F 7712568 SIBUFMWFTXMOHP-DHZHZOJOSA-N 387.389 5.109 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)ccc1O 8322799 PLURIMJLIONQEJ-JXMROGBWSA-N 377.421 5.167 30 20 GKED N#Cc1c(NC(=O)CCN2CCC[C@H]2c2cccs2)sc2c1CCCCC2 21473155 YPKWZGGBXCEUOC-KRWDZBQOSA-N 399.585 5.116 30 20 GKED CCOc1ccc(-c2nc(C(=O)Nc3sc(C)c(C)c3C#N)cs2)cc1 24844393 RNRRACTWGORMPW-UHFFFAOYSA-N 383.498 5.011 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(CSc3ccccc3)cc2)cc1 29151599 XLAWZRLFXWJUAC-UHFFFAOYSA-N 386.520 6.032 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Cc1coc2ccc3ccccc3c12 62904921 HSCSCFHVMBSXGI-UHFFFAOYSA-N 380.447 5.215 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(CC)ccc(Cl)c1CC 63389181 XQEJCJRBUVZTRD-UHFFFAOYSA-N 381.907 5.557 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)o1 64809123 RODKSTVLDJZFQE-QFIPXVFZSA-N 398.462 5.022 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)nn1C(C)(C)C 66801050 QYCODIBAWATERG-HNNXBMFYSA-N 384.549 5.408 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cccc(F)c4o3)n2)cc1 123559435 RXTFNUYXBHQNTE-OAHLLOKOSA-N 392.411 5.194 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2SCCCS2)cc1 124470249 XYOBFFRCONJSPR-UHFFFAOYSA-N 396.581 5.478 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3CCCc4ccccc43)n2)cc1 171777558 FJGNXEVPHGYFJK-CTNGQTDRSA-N 397.503 5.368 30 20 GKED Cc1nc(NC(=O)c2ccccc2Sc2ccccc2)sc1SCC#N 172814228 MGEJFKJRLWIQNP-UHFFFAOYSA-N 397.550 5.471 30 20 GKED N#C[C@H](C(=O)c1cccc2cc[nH]c12)c1nc(-c2ccc(Cl)cc2)cs1 173988626 PXLMBHDVVTVBCD-MRXNPFEDSA-N 377.856 5.435 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H](C)c2ccc(C(F)(F)F)cc2)n1 177768580 WPHUIRKBZDOUFX-DOMZBBRYSA-N 380.435 5.655 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)Cc1ccc(Cl)cc1 179808287 ILIJVHIBBXMXHK-KSSFIOAISA-N 395.915 5.304 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Cl)cc2C(F)(F)F)c1 185298535 OJAZVKXZEBTEDY-UHFFFAOYSA-N 382.769 5.294 30 20 GKED C=CC[C@H](C(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1)c1ccccc1 188967276 FGNNSBHPPINZRL-INIZCTEOSA-N 393.468 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc2oc(COC)nc2c1 191492420 RMMCHGVFPBJFII-UHFFFAOYSA-N 379.460 5.470 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 303269141 GXJAQJZHJMDIQG-CQSZACIVSA-N 393.537 5.623 30 20 GKED C[C@H]1CC[C@H](/N=C(/O)C2CCN(c3noc4ccc(Cl)cc34)CC2)CC1 328889033 QDSWBPANDXPOTG-SAZUREKKSA-N 375.900 5.233 30 20 GKED CS(=O)(=O)c1ccc(N=C(O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1C(F)F 329280493 MXZZOCZLYYNIKX-MGPQQGTHSA-N 385.476 5.222 30 20 GKED O=C1CCCc2ccc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)cc21 329418751 DTTZVBBRRNFBAM-GOSISDBHSA-N 391.515 5.300 30 20 GKED Cc1ccc2c(c1C)OC[C@@H]2/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329446719 LZAOSKAWXCRLRY-NQIIRXRSSA-N 393.531 5.200 30 20 GKED CC(C)C[C@@H]1C[C@H](/N=C(/O)[C@@H]2CC=CC[C@@H]2c2nc3ccccc3s2)CCO1 329497242 UZWNPWUQFIXFGE-MKXGPGLRSA-N 398.572 5.896 30 20 GKED O/C(=N/[C@H]1CC2(CCCC2)Oc2ccccc21)N1CCC(c2nccs2)CC1 330125973 INQMSHMXGWAJDP-SFHVURJKSA-N 397.544 5.073 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1 409836701 OMBBBTPQAOFSEW-ROUUACIJSA-N 389.282 5.418 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nn(Cc2ccccc2Cl)c1C 410347996 GBQNTSLWCQKURH-UHFFFAOYSA-N 393.918 5.573 30 20 GKED N#CCCC[C@@H](NC(=O)NCC(F)(F)c1ccc(Cl)cc1)c1ccccc1 431314267 ORUFBWBYJNJSST-GOSISDBHSA-N 391.849 5.166 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 431780577 GFISZBRXHVDEBO-HNAYVOBHSA-N 389.421 5.501 30 20 GKED COC(=O)[C@H](Nc1cccc(CSC2CCCC2)c1)c1cccc(C#N)c1 434858855 BQSJARFZWKOLQH-OAQYLSRUSA-N 380.513 5.060 30 20 GKED C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438039336 FIQNUPLPKIQXHO-MHECFPHRSA-N 399.469 5.236 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 438670167 VPVKHFTWYYBUOO-QLFBSQMISA-N 399.482 5.429 30 20 GKED N#CCC[C@H](NC(=O)NCc1cccc(COc2ccccc2)c1)c1ccccc1 438840726 JBVKKHZCSAAVGB-DEOSSOPVSA-N 399.494 5.110 30 20 GKED C[C@@H](SCc1ccc(C#N)cc1OC(F)F)c1nc(-c2cccs2)no1 439535931 JUOXZJFCLJLYRH-SNVBAGLBSA-N 393.440 5.266 30 20 GKED CC[C@@H](NCc1nc(COC)sc1-c1ccccc1)c1ccc(C#N)cc1 442859794 RHBODKKZARJWGN-LJQANCHMSA-N 377.513 5.069 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@H]4CCC[C@@H]43)cc2F)c1 444389906 QYVDWUNLJAUCCM-NQIIRXRSSA-N 393.462 5.073 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2oc3ccccc3c2CSc2cccs2)C1 452561434 JRFXSGNUERXTLQ-GJZGRUSLSA-N 396.537 5.599 30 20 GKED C=CCn1c(SCc2cncc(C(F)(F)F)c2)nnc1-c1ccccc1C 460879326 WTCHIKAXTHOADT-UHFFFAOYSA-N 390.434 5.146 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1ccc(C(=O)Nc2ccccc2)cc1 464815818 USCCGVKQVBSSCZ-RPBOFIJWSA-N 395.506 5.211 30 20 GKED C=CCOc1ccc(CN(C(=O)c2cccc(SCC#N)c2)C(C)(C)C)cc1 467880337 ZQKZCKZESTYDIP-UHFFFAOYSA-N 394.540 5.308 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2)c1 468275857 FAVMUWVKPSOOPY-UHFFFAOYSA-N 378.884 5.875 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N(Cc3ccco3)c3ccccc3C#N)c2c1 470833610 WUKYWYNLKBJPEJ-UHFFFAOYSA-N 383.451 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1 475545572 FHQKEYAMIXGQDP-KRWDZBQOSA-N 376.500 6.510 30 20 GKED N#CC[C@H](CC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1)c1ccccc1 476147319 LULXBUKPCXCAMT-NOZRDPDXSA-N 380.491 5.400 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC[C@H](c3cccc(F)c3)C2)c2ccccc21 478261232 ORPPMNJXUTZYRJ-AZUAARDMSA-N 389.474 5.150 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccoc2C(C)C)cc1 479944272 XTUHIOUTXMRFKN-UHFFFAOYSA-N 376.412 5.328 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](CC(F)(F)F)c1ccc(F)cc1 481655413 KUCBUZAZFRHFPO-UXHICEINSA-N 376.397 5.748 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1ccc(F)c(C#N)c1 481743310 UTPRZBIDBLRADC-HNNXBMFYSA-N 379.460 5.554 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1nccc2ccccc12 483228541 NDRRRJHHZJABCW-XMSQKQJNSA-N 379.463 5.330 30 20 GKED CC(C)(CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)C(F)(F)F 483466746 BCTKDSBYGHIQHD-UHFFFAOYSA-N 398.372 5.628 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@@H](C)c1ccc(SCCOC)cc1 483707934 XOYQVROZSUWHLU-SFHVURJKSA-N 390.593 5.264 30 20 GKED N#Cc1ccc(/C=C(\c2nc3ccccc3[nH]2)c2nc3ccccc3s2)s1 484423138 FGFDLPJUTJVDSE-RVDMUPIBSA-N 384.489 5.695 30 20 GKED C=CCCCCCSCc1csc(-c2ccc(S(C)(=O)=O)cc2)n1 485575027 XBYAPSSFTPKEJE-UHFFFAOYSA-N 381.588 5.193 30 20 GKED C=CC[C@@H](C(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 489705439 VOJHUVPMAMTKTA-HZPDHXFCSA-N 394.462 5.228 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)Cc1coc(-c2ccc(F)c(F)c2)n1 491026197 GDMNEKRNQNPPLU-UHFFFAOYSA-N 381.426 5.150 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cn1 491050495 MIWFSCKGNKYITP-HNNXBMFYSA-N 388.496 5.129 30 20 GKED CC(C)Oc1cc(F)ccc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 492183803 ZUEZNSWMXVOCQL-CQSZACIVSA-N 387.480 5.651 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(F)c(Cl)c2)cc1C 495394215 CTXYSRLMMBKBMQ-UHFFFAOYSA-N 396.853 5.125 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2OC)c2ccccc2Cl)cc1 500839091 CZLXUSLKTCZZKX-HSZRJFAPSA-N 392.886 5.108 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3csc(-c4cccs4)n3)n2)c1 501132726 IKXGVFAOWNFINL-UHFFFAOYSA-N 394.506 5.119 30 20 GKED C=CCCc1ccccc1NC(=O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 504277022 MZDRBYIMUCHMQO-HXUWFJFHSA-N 377.532 5.251 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(Cl)cn1 507195410 MCKRZWIBYLJBJN-OAHLLOKOSA-N 391.858 5.084 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)[C@H](C)C(C)C 508273208 AIUFFUKTLONPCY-MRXNPFEDSA-N 381.476 5.257 30 20 GKED CN(CCC1CCCCC1)C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 510042178 QWXYFUKIDMRODH-UHFFFAOYSA-N 382.533 5.040 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1C(=O)NCC(C)(C)CCC#N 513139959 ABNRNMPHYMZJBM-XXBNENTESA-N 389.543 5.105 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCCCc1cccc(C(F)(F)F)c1 516837377 USAOJDQUUQOBIK-UHFFFAOYSA-N 382.451 5.097 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1csc(-c2cccs2)n1 518660858 DBZXYRIDMAVUTG-ZDUSSCGKSA-N 399.566 5.305 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)(C)c1ccccc1 520856633 LNRXVMHWQCOTIZ-SJORKVTESA-N 381.545 5.426 30 20 GKED C=CCCCCCN(C)C(=O)c1ccccc1SCc1ccc(C#N)cc1 523537512 UHBYXDCIZRQMDI-UHFFFAOYSA-N 378.541 5.669 30 20 GKED CCN(C(=O)c1csc(-c2c(F)cccc2F)n1)[C@@H](C)c1ccc(C#N)cc1 523849990 GIDIPXGXYHZJML-ZDUSSCGKSA-N 397.450 5.183 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H]1CC(C)C 524438278 YKRCGCFIFKBXML-OAQYLSRUSA-N 391.515 5.488 30 20 GKED C[C@@H]1CC(F)(F)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 529003733 UTWWKMYIHIJHSE-CYBMUJFWSA-N 389.377 5.141 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(-c2nc(C)no2)ccc1C)c1ccccc1 532943030 YFKWOJOOVXHZGY-LJQANCHMSA-N 376.460 5.182 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(F)c1 538323279 MNEJUJMKHRYLDH-HNNXBMFYSA-N 376.275 5.109 30 20 GKED N#CCC[C@@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccccc1 539050595 NJFROMGDNJGGBQ-UXHICEINSA-N 391.515 5.961 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(OCc3cscn3)c2)c(C#N)s1 539175684 ZAWNNWOUIQAWPD-UHFFFAOYSA-N 397.525 5.205 30 20 GKED N#Cc1ccc(CNCc2ccc(OCCSc3ccc(Cl)cc3)cc2)o1 540600150 CSQVHHAEIGYSJT-UHFFFAOYSA-N 398.915 5.266 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)Nc1cccc(C#N)c1C 541035435 UOSYEYMXIVPHKA-UHFFFAOYSA-N 386.238 5.389 30 20 GKED COCCOc1ccc(C#N)cc1N[C@H](C)c1csc(-c2csc(C)n2)c1 541556956 DTXUCVVLFFNEQO-CYBMUJFWSA-N 399.541 5.250 30 20 GKED Cc1sc([C@H](C)NCc2ccc(CC#N)cc2)nc1-c1ccc(Cl)cc1 542575605 NOXSCFIKHUZLBS-AWEZNQCLSA-N 381.932 5.689 30 20 GKED C[C@H](N[C@H](C)c1cn(-c2ccccc2)nn1)c1ccc(-c2cccc(C#N)c2)cc1 542934935 XSTKXAPIKUYUDX-RBUKOAKNSA-N 393.494 5.218 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 543304817 PMDZUJPEFFWKCP-HKUYNNGSSA-N 379.529 5.411 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc[nH]c2C2CC2)cc1Cl 550597815 NWBSHDAXOSSUQF-IBGZPJMESA-N 375.859 5.453 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 554442486 MUYZDXPUDDZRMZ-UHFFFAOYSA-N 390.443 5.012 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1CCC(F)(F)CC1 558320510 NEWMDBIPBBAMSU-UHFFFAOYSA-N 385.414 5.392 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)N(Cc1ccc(C#N)cc1)C1CC1 560863370 JAVMXQDQNFJRTD-JOCHJYFZSA-N 376.500 5.030 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(c2noc3cc(F)ccc23)CC1 562035700 MURHMNGMSLILII-UHFFFAOYSA-N 393.462 5.497 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 565659930 IFIDIVRDHSXSOK-UTKZUKDTSA-N 375.541 6.204 30 20 GKED N#CCCCOc1cccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)c1 572166328 KHBHIFVQZMMPLF-UHFFFAOYSA-N 397.931 5.436 30 20 GKED N#CCc1ccccc1NC(=O)c1oc2ccccc2c1COc1ccccc1 573041083 BVCUJQPDRPXCTO-UHFFFAOYSA-N 382.419 5.330 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 576655410 QXTDOEFJDFGKDM-GOSISDBHSA-N 389.499 5.128 30 20 GKED COc1ccc([C@H](Nc2cc(C#N)ccn2)c2ccc(C(F)(F)F)cc2)cc1 588013467 QOYUOGDRUXYWRW-HXUWFJFHSA-N 383.373 5.182 30 20 GKED N#CCCCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 593978068 JKYKGEQBXLDUSG-UHFFFAOYSA-N 381.329 5.054 30 20 GKED CCN(C(=O)CC1(C#N)CCCCC1)[C@H](c1ccc(C)cc1)c1cccnc1 597217108 MWLCXNOKMHFTCG-HSZRJFAPSA-N 375.516 5.192 30 20 GKED Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c(C#N)c1C 603728478 GCNALUXNNSASJD-UHFFFAOYSA-N 393.424 5.189 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N[C@H](C)c1ccc(C#N)cc1 603872427 SPPTVUYODUBZDB-NEPJUHHUSA-N 379.312 5.223 30 20 GKED CCCCS[C@@H](C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 604117214 MRAMHOOWHRQIRJ-KRWDZBQOSA-N 382.529 5.192 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1Oc1cccnc1 604523286 UOVAEVJSKRTRFM-UHFFFAOYSA-N 385.467 5.044 30 20 GKED COc1cc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)ccc1OCC(C)C 611392610 YTGYKHBIVUQIOB-JTSKRJEESA-N 378.516 5.330 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CCCc4sccc43)cn2)cc1 613460931 DMWRIFRRRKUECH-SFHVURJKSA-N 390.468 5.006 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC(CC2CC2)C1 621475438 IKRDKNXNXZZHAX-UHFFFAOYSA-N 398.322 5.240 30 20 GKED Cc1ccccc1-n1ncc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c1C(C)C 682988324 DGUDGRSOSYRAEH-IBGZPJMESA-N 394.478 5.342 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(CO[C@@H]3CCC[C@H](C)C3)c2)c1 726484883 KBGKELKHEAYECP-HTAPYJJXSA-N 378.541 5.572 30 20 GKED CC(=NNc1ccc(C(F)(F)F)cn1)c1sc(-c2ccc(C)cc2)nc1C 727648986 ZRVQNDWDKIPCTJ-UHFFFAOYSA-N 390.434 5.677 30 20 GKED Cc1cc(C(=O)Nc2cccc(-c3nccs3)c2)c(C)n1-c1ccc(C#N)cc1 728268257 JZTAICBNHWMPAO-UHFFFAOYSA-N 398.491 5.342 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 730475183 ZDKOFPPCXOFQLA-UHFFFAOYSA-N 384.451 5.001 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 730955007 RTMMMEQLFULRSQ-GFCCVEGCSA-N 386.933 5.272 30 20 GKED O=C(/C=C/c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccc(F)c(F)c1 732714761 XMFHGPAXQPORMD-BQYQJAHWSA-N 389.199 5.014 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1)C(C)C 733638690 WKPSEWYRXOZFPV-UHFFFAOYSA-N 397.372 5.460 30 20 GKED N#Cc1ccc(OCCCSc2nnc(-c3cccc4ccccc34)o2)cc1 741474092 XGORPPFFQQDOES-UHFFFAOYSA-N 387.464 5.323 30 20 GKED C[C@@H]1/C(=C\c2c[nH]c(-c3ccccc3)n2)C(=O)c2cccc(Br)c21 742434350 GBYLPGRVRFEXGX-HMHNVIDESA-N 379.257 5.223 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccc(F)c1 744037813 DWIVESLOGJVTLQ-IINYFYTJSA-N 392.377 5.434 30 20 GKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1cc(Br)ncc1F 762421552 JXBFNSUHRNTFPQ-SREVYHEPSA-N 389.249 5.003 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](Cc2ccc(F)cc2)c2ccccc2)c1 774243458 KYCGMDWRCNHSMG-NOZRDPDXSA-N 388.486 5.580 30 20 GKED C[C@H]1Cc2cc(-c3ccc(CN[C@@H](C)c4ccc(OCC#N)cc4)cc3)ccc2O1 776171454 NIEAWVIJQNTMNZ-OALUTQOASA-N 398.506 5.430 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)/C=C/c1ccc(OCCN(C)C)cc1 789887472 DMQHHKDGLZKPDC-DTQAZKPQSA-N 392.543 5.131 30 20 GKED CC(C)O[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 794219710 BBYKWOANKYCDKB-RPWUZVMVSA-N 384.479 5.447 30 20 GKED Cc1oc(-c2ccccc2)nc1Cc1noc(-c2ccc(C(C)(C)C#N)cc2)n1 809276757 DUUVJBRJYFGAHZ-UHFFFAOYSA-N 384.439 5.092 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2c3ccccc3CC23CCOCC3)cc1 810255642 QMNXMEYSAAQLMO-WZONZLPQSA-N 397.946 5.563 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(C)c3Cl)n2)cc1 810549787 PVXOQXROGSZKMY-QGZVFWFLSA-N 396.899 5.200 30 20 GKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccn1 810556020 WYXVCSJEXQRJGL-KGLIPLIRSA-N 397.450 5.243 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C=NNc1ccccc1Br 812462714 SXJZIJXSRWDJLK-UHFFFAOYSA-N 389.684 5.043 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(N)ccc1C)c1ccc(C(F)(F)F)cc1 841317248 UXIUAXUCQIUZPM-QGZVFWFLSA-N 377.410 5.425 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@]3(C2)CC3(F)F)ccc1Oc1ccccc1 844640003 YGIFZBWJBKCDBQ-HXUWFJFHSA-N 383.398 5.004 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)N(CCC#N)CCC(C)C 861398346 UGEONMPIQNBMOF-UHFFFAOYSA-N 388.512 5.136 30 20 GKED CC(=NNc1ncc(Cl)cc1Cl)c1sc2nc(C)nc(C)c2c1C 863966830 PVIBYQPGHVRXTP-UHFFFAOYSA-N 380.304 5.154 30 20 GKED CC(C)(CC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC(F)F 878202430 ODRWLQIZGSWPPB-RKDXNWHRSA-N 383.323 5.084 30 20 GKED N#CC1(CCCC[S@](=O)Cc2csc(-c3ccc(Cl)cc3)n2)CCC1 899384345 JIROWDOKVAPMHC-VWLOTQADSA-N 392.977 5.576 30 20 GKED CCOc1ccc(/C=N\C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(O)c1 914702553 ITMPWVLSRQPBCU-JZUIVORYSA-N 383.332 5.119 30 20 GKED COc1ccc(C(C)=NNc2nccc3sccc23)cc1CN1CCCCC1 915979319 GBALMZLDQCKYKF-UHFFFAOYSA-N 394.544 5.127 30 20 GKED COc1cc(Br)c(/C=C\C(=O)c2cc(C)sc2C)cc1OC 916155887 KGRNUCPIWXNMIJ-WAYWQWQTSA-N 381.291 5.041 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)COc2ccccc2C(C)C)cc1 916948465 VSWWJAUSVXONGH-UWJYYQICSA-N 392.499 5.050 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CSCc2cccc(C)c2)cc1 916955944 VYQUTZZLPMWAAA-DYESRHJHSA-N 394.540 5.089 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc(-c2ccccc2)cs1 917027025 TXNJIIHDWKOYFK-QFIPXVFZSA-N 392.483 5.871 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1sccc1Br 920066159 SMPUKPJWDSWXSF-UPHRSURJSA-N 382.329 5.592 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cccc(Br)c3)c2c1 1776114644 VNFSVPHKBMHJPO-XQRVVYSFSA-N 387.254 5.258 30 20 GKED CC(C)(C)[C@H]1C/C(=C/c2cccc(C#N)n2)c2nc3ccccc3c(C(=O)O)c2C1 1776121619 PGNQQKFCECWTLV-IRVMHKCDSA-N 397.478 5.349 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776339927 QWDHGGBDIOPXRZ-BENRWUELSA-N 390.504 6.208 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CCc3c(C(=O)O)cccc32)cc1 1776785814 CWJBINPVFPKIIK-UHFFFAOYSA-N 379.500 5.491 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCC3(CC2)C[C@H]3C(=O)O)cc1 1776787490 DOZTVHZUTYBDKV-IBGZPJMESA-N 389.561 5.076 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)cc1 1776794094 QXIDZMHAAMMZMA-SXGWCWSVSA-N 396.483 5.395 30 20 GKED CCCOc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(C)c1 1776819131 MQIXXPKHYFBRLR-LUAWRHEFSA-N 390.435 5.638 30 20 GKED CCc1c(C(=O)/C=C/c2cccc(O[C@@H](C)C(=O)O)c2)oc2ccc(C)cc12 1776956205 KNNGUXVYVLEVQX-FEAKQIBJSA-N 378.424 5.052 30 20 GKED CCn1c2ccccc2c2cc(/C=C3\C[C@@H](C(=O)O)c4ccccc4C3=O)ccc21 1777002908 PGHNLHHGVMWKTC-BRBKRDGESA-N 395.458 5.653 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc1C(=O)O 1777361039 PFMRNTZRDJILHX-WUXMJOGZSA-N 382.481 5.324 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cnc(-c3cccs3)s1)C2=O 1777682924 GNWPVHYLPARYMA-JLHYYAGUSA-N 381.478 5.172 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)C1 1787616570 DOYSQWYYUQNZPF-UHFFFAOYSA-N 380.532 5.057 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)c(C)c1 6367128 VLFKFAQXVNJVOD-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2ccc(SC)cc2)nc2ccccc21 22351471 IADIWZVUIZYYMI-AWEZNQCLSA-N 383.542 5.064 30 20 GKED CCCCc1noc([C@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)n1 56153439 TWFNLHYPDSHQLB-INIZCTEOSA-N 376.460 5.036 30 20 GKED CCOc1ccc(CN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66955502 HIHIZGULKLJPQP-MRXNPFEDSA-N 383.517 5.143 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccccc1Cl)c1ccccc1)c1ccccn1 106353715 SCJBUELPVNOQNR-HRAATJIYSA-N 378.884 5.445 30 20 GKED CC(=O)c1ccc(OCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 108981615 OFTLWVTZPDJCMK-MRXNPFEDSA-N 396.512 5.081 30 20 GKED CC(C)CCSCC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 115770461 SROGTEGURZKHNU-UHFFFAOYSA-N 384.520 5.005 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C)[C@@H](C)CC#N)cc2Cl)n1 120322133 AHCMWHMEBREZTC-NSHDSACASA-N 380.926 5.022 30 20 GKED COc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1-c1ccccn1 179550743 YWSVHNPLRZGOOY-UHFFFAOYSA-N 391.496 5.240 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1cccc(Oc2ccc(Cl)cc2)c1 181659309 MJAVQKLJIKQMPX-UHFFFAOYSA-N 391.858 5.083 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cccc(F)c2F)cs1 182722947 BIIQPJGZKODWIT-DHZHZOJOSA-N 398.434 5.310 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc3ccccc3s2)ccc1OC 188195820 SPDIHPVNGJCUHT-QAPCUYQASA-N 380.513 5.442 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccncc1 293265834 JASDXDGDWOJLLN-HNAYVOBHSA-N 380.517 5.091 30 20 GKED Cc1cc2occ(C/C(O)=N/CC3(N4CCCC4)CCOCC3)c2cc1C(C)C 329120345 VQPYPSLIDUYOGA-UHFFFAOYSA-N 398.547 5.009 30 20 GKED OC(=Nc1cc(N=C(O)[C@@H]2CC23CCCC3)c(F)cc1F)[C@H]1CC12CCCC2 329960480 RDNJXFVZKPIZNR-OKILXGFUSA-N 388.458 6.301 30 20 GKED COc1cc(N=C(O)N2CC[C@@H](C(F)(F)F)C2(C)C)cc(OC)c1C(C)C 331010025 ZECPIZPJZPGIDA-OAHLLOKOSA-N 388.430 5.036 30 20 GKED C[C@@H](NCc1nc2ccc(F)cc2s1)c1ccc(-c2cccc(C#N)c2)cc1 428870638 GFMVZKMKQUXCLG-OAHLLOKOSA-N 387.483 5.825 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 431726339 GVZOXFBFZWKLCB-KUHUBIRLSA-N 390.314 5.789 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)Nc2cccc(C#N)c2C)cc1 432282264 IXDBAUVTRYUXHZ-SFHVURJKSA-N 399.494 5.767 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3cccs3)c3ccc(F)cc3)o2)c1 440071528 ONKZXXKHWZOQNP-UHFFFAOYSA-N 390.443 5.016 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Nc2ccc(O)cc2)cc1Cl 443556264 DUZPTAAEZBCEIK-LJQANCHMSA-N 377.831 5.345 30 20 GKED N#CCCn1cc(-c2csc(-c3ccc(N4CCCC4)nc3)n2)c2ccccc21 463425130 RXNDLYCVFPRFQK-UHFFFAOYSA-N 399.523 5.341 30 20 GKED COc1ccc2ccccc2c1CNc1ccc2c(c1)CCC(=O)N2CCCC#N 468838622 FHHDGOKMHREVRF-UHFFFAOYSA-N 399.494 5.043 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(OC(F)F)cc1 468982464 MSWZYMQLNTZVDP-HNNXBMFYSA-N 399.441 5.044 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 474903168 YVGRTFHXHPVSOM-OZOXKJRCSA-N 396.918 5.529 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)C[C@@H](CC#N)c3ccccc3)CC2)n1 475932985 QNNZVGSUPCZTOL-LJQANCHMSA-N 395.572 5.234 30 20 GKED CSc1ccc(CS[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1 478734755 FXNUPOAZCMEXAZ-LBPRGKRZSA-N 388.583 5.091 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1)c1ccc(F)c(F)c1 480799398 QDTAOADKCVCQJH-FQEVSTJZSA-N 397.425 5.676 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)sc1-c1ccc(F)cc1 483197281 KXWDAFWMJNKUTC-IBGZPJMESA-N 386.451 5.901 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccc2ccccc2n1 486240991 SGCZFDVDTGCCLA-MRXNPFEDSA-N 375.497 5.058 30 20 GKED C[C@H](SCc1nc(-c2cc(F)c(F)c(F)c2)no1)c1ccc(C#N)cc1 486731462 AEEKFQKBQZEFCU-JTQLQIEISA-N 375.375 5.020 30 20 GKED C=CCOc1ccc(C(=O)Nc2c(C)cc(Br)cc2Cl)cc1 488572748 YEUAYZRJYSCBFB-UHFFFAOYSA-N 380.669 5.228 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 488670152 GDKVSJWKLLWFTF-HSZRJFAPSA-N 384.479 5.262 30 20 GKED C=CCC[C@@H](NC(=O)NCc1oc(CC)nc1C)c1ccc(C(F)(F)F)cc1 489759712 YLARDTPXAWHEPX-MRXNPFEDSA-N 395.425 5.071 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1cc2ccccc2s1 504463177 VQZUHWNAUFOJSP-INIZCTEOSA-N 375.497 5.232 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCC[C@@H]2C(F)F)cc1F 505351030 OQLVCQWBKMPIHA-MRXNPFEDSA-N 389.377 5.141 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(SCC)cc1 508577207 GHGRUWWJNWFCHP-QGZVFWFLSA-N 381.545 5.353 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2nc(C(F)(F)F)cs2)sc2ccc(C#N)cc12 508914967 PJHRVOWMISEAFB-VIFPVBQESA-N 395.431 5.048 30 20 GKED CC(C)N(Cc1ccco1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 509224932 JYYLEYWPPKWVOD-UHFFFAOYSA-N 375.428 5.386 30 20 GKED Cc1ccccc1CN(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509897329 IPMYTPSDHVSCOK-UHFFFAOYSA-N 399.494 5.304 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1C(F)(F)F 510767835 SBMVVVSSOOJMDK-CYBMUJFWSA-N 375.394 5.389 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 519204999 NUVRDUVMDPINSX-OAQYLSRUSA-N 381.907 5.285 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(COc2ccc(C#N)c(C)c2)cs1 520950017 OADYLZXSSUJMKK-UHFFFAOYSA-N 397.887 5.240 30 20 GKED Cn1c(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c(Cl)c2ccccc21 521352672 GQIACBMBNFXUOP-AWEZNQCLSA-N 392.673 5.133 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)sc2c1CCC2 521955729 VXJQJNZPOFOYQQ-NEPJUHHUSA-N 377.296 5.157 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)CC1 530494778 PRTPPPAEAWQPES-UHFFFAOYSA-N 389.286 5.213 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(OCCN(C)C)cc1 539214471 MBQPEBPIEUZJBX-HXUWFJFHSA-N 399.538 5.016 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(OCc3ccccc3)nc2)c(C#N)s1 540273298 FIJOOGQEBRECLW-UHFFFAOYSA-N 391.496 5.144 30 20 GKED N#CCC1CCN(C(=O)N[C@H](CCCCc2ccccc2)c2ccccc2)CC1 542854262 PBZSPCAIZJFORH-XMMPIXPASA-N 389.543 5.476 30 20 GKED C[C@H](NCc1noc(Cc2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 543871396 VEFAZKDPNFUQRD-SFHVURJKSA-N 394.478 5.050 30 20 GKED N#Cc1ccc(C2=CCN(c3nnc(-c4ccccc4Cl)s3)CC2)cc1 546182232 DIRIOTUEZVHQAJ-UHFFFAOYSA-N 378.888 5.024 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CCc1cccc(C(F)(F)F)c1 557601742 IZDOYNNBIBQNCR-UHFFFAOYSA-N 393.453 5.020 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2c(-c3ccccc3Cl)noc2CC)cc1 571242872 FWTGEXJEJNLLJE-SFHVURJKSA-N 393.874 5.114 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 577644262 FXSLWLMOIOYHFX-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CCN(C(=O)CCCCCC#N)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 588927169 SVFRRZMQBSYSBZ-XMMPIXPASA-N 377.532 5.617 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591781188 NVASZLJCGOVTHP-UHFFFAOYSA-N 398.253 5.315 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@H](CC#N)C2)cc1 596789309 NQKRIBUBSODVMI-ZWKOTPCHSA-N 379.529 5.697 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cscc3C(F)(F)F)c(C#N)c2[C@H]1C 598839444 RITORFLKFQQSCQ-IUCAKERBSA-N 384.448 5.638 30 20 GKED CSCc1c(C(=O)N(Cc2ccc(C#N)cc2)CC(C)C)oc2ccccc12 603530362 NUSRHHJFGZSCJS-UHFFFAOYSA-N 392.524 5.466 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(Cl)o1 604360714 INWYMHDHBBSMDI-UHFFFAOYSA-N 381.819 5.227 30 20 GKED N#C[C@@H](C(=O)c1cnc2ccsc2c1)c1nc(-c2c(F)cccc2F)cs1 608553031 KWDAPPRALOCZDM-NSHDSACASA-N 397.431 5.188 30 20 GKED COc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)ccc1C 609061648 RUQNWOHKTYJHFF-UHFFFAOYSA-N 386.451 5.015 30 20 GKED CC(C)c1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 609164453 OTOXCFYZFALGNJ-LJQANCHMSA-N 394.927 6.433 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(Sc2ccccc2)CC1 609469782 KVWRGUYGKPZHLT-INIZCTEOSA-N 397.569 5.527 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609499235 CUXNDNFROIZPIH-HNNXBMFYSA-N 391.858 5.232 30 20 GKED C[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609880303 DSSSFHYWBSTJSU-KUDFPVQQSA-N 378.447 5.283 30 20 GKED C[C@H](NC(=O)Nc1cccc(Cl)c1SCC(F)F)c1ccc(C#N)cc1 609932738 FWKKTKBXARLNCI-NSHDSACASA-N 395.862 5.452 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F 610173048 KZRCDYRBDDZLNG-MRXNPFEDSA-N 386.417 5.285 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2cccc(CC#N)c2)cc1 610191631 RPZDKXRUSWBYEK-GOSISDBHSA-N 384.479 5.261 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)N[C@H](C)c1cccc(C#N)c1 610355980 GJZYHAKBPVPQKA-KGLIPLIRSA-N 375.394 5.041 30 20 GKED N#Cc1ccccc1-c1ccc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1 610614534 YILAUOKAMHLOMD-HDICACEKSA-N 398.350 5.398 30 20 GKED Cc1cc(NCc2ccnc(C#N)c2)ccc1-c1ccc(Br)cc1 614481371 NGQRHCVUXXBMAV-UHFFFAOYSA-N 378.273 5.303 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 666971025 LYHXFEHZKNYSKT-GASCZTMLSA-N 393.434 5.544 30 20 GKED Cc1cccc(F)c1NC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 680877186 DQIVOXCMRJTEFN-UWVGGRQHSA-N 386.311 5.165 30 20 GKED C=C(C)CCc1noc(-c2cccnc2Oc2ccc(Br)cc2)n1 685385146 XWQISZBBLARYKH-UHFFFAOYSA-N 386.249 5.195 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)N[C@H]1CCCC[C@@H]1C 727978217 CMWQWNJXHYIUFA-KKSFZXQISA-N 393.556 5.311 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)/C=C/c2ccc3ccc(Cl)cc3n2)c1 728012172 BCWDHIPONRHTFT-SOFGYWHQSA-N 399.784 5.013 30 20 GKED CC(=NNc1cnnc2ccccc12)c1ccc(OCc2ccc(F)cc2)cc1 733747699 QPWBXQOSSAIFOK-UHFFFAOYSA-N 386.430 5.184 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2(c3cccc(F)c3)CC2)cc1 740435975 YQFPPQXNLMBSHK-QFIPXVFZSA-N 385.442 5.292 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741844180 SQDYXRHBLNHATP-BJTBTHHMSA-N 391.414 5.528 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccccc2CC(F)(F)F)cc1OC 741990130 XCHGETSKURGABH-PKNBQFBNSA-N 391.389 5.017 30 20 GKED N#C[C@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 744017087 YCXZKESTKASWMK-RPWUZVMVSA-N 390.486 5.828 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2cccc(C)c2[nH]1)c1ccccc1C(F)(F)F 744161410 UOPABRKXNIFHBM-VSKPTYQZSA-N 383.373 5.170 30 20 GKED CCn1cc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c2ccccc21 748174743 FRMSCXDBAYDRCL-DEOSSOPVSA-N 393.490 5.498 30 20 GKED O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(-c2ccc(C(=O)O)o2)cc1 750903906 UVXFKMUJRBNUBP-JHMJBTLWSA-N 389.363 5.005 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c2ccccc21 767920931 IBSPBSFMLQEZEH-NRFANRHFSA-N 393.437 5.201 30 20 GKED Cc1ccc(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 773982304 DTNBOZUQUGNYHG-ASRSSLEJSA-N 379.872 5.057 30 20 GKED C[C@@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccc(OCC#N)cc1 776159594 JWICKADGKKRZQA-KOSHJBKYSA-N 390.914 5.877 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)ccc1OC 776165997 ZSSYWWWGYFNKPN-RTWAWAEBSA-N 398.522 5.782 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(-c3ccco3)cc2F)c1 786500440 PKOZVTWFHQUGED-QGZVFWFLSA-N 393.418 5.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(C)[C@@H](C1)C2(Cl)Cl 794331558 VDQZYWYGXHBMCA-VQIMIIECSA-N 381.347 5.586 30 20 GKED C[C@H](OC(=O)Cc1ncccc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 795791547 HSCUVOGFTJLEMU-VIFPVBQESA-N 395.274 5.105 30 20 GKED N#C[C@@H](C(=O)[C@@H]1Cc2ccc(F)cc21)c1nc(-c2ccc(Cl)cc2)cs1 796632209 CNCFKQVMFRQSTF-SJORKVTESA-N 382.847 5.119 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C2CC(c3ccc(F)cc3)C2)cc1 796748217 UXDLVLVDTATXRR-VNGDJDOVSA-N 392.474 5.180 30 20 GKED C[C@@H](OC(=O)CCCCCC#N)c1nnc(-c2ccc(Cl)cc2Cl)o1 805696550 DSJQPVVWORMETD-LLVKDONJSA-N 382.247 5.122 30 20 GKED CN(Cc1ccccc1N(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 808816095 LEWYOXKJEVXBQF-QHCPKHFHSA-N 398.510 5.072 30 20 GKED CN(C(=O)c1ccc(C#N)o1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 814119187 DCWUSIMOKSIKKZ-UHFFFAOYSA-N 385.250 5.320 30 20 GKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)cc(Cl)c1O 815636246 RPNLBWGFCKOCSZ-RBUKOAKNSA-N 377.315 6.175 30 20 GKED COc1ccc2c(c1)CCCN2C(=O)Nc1ccccc1S[C@@H](C)CC#N 838923955 ZZGVFWARPQTGPJ-HNNXBMFYSA-N 381.501 5.074 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 842939853 YVEBFLOJVYIVJI-INIZCTEOSA-N 393.537 5.180 30 20 GKED Cc1cc(NC(=O)c2ccc(C#N)c(Cl)c2)ccc1NC(=O)OC(C)(C)C 856373172 UEGJNWKOYUCJDY-UHFFFAOYSA-N 385.851 5.119 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)oc2c(F)cccc12 915086653 MELZMICRMWAYCW-FQEVSTJZSA-N 384.410 5.788 30 20 GKED CC(=NN=C1c2ccccc2-c2ccccc21)c1sc2ccccc2c1C(=O)O 1776027723 ATXVVDORTNUKTE-UHFFFAOYSA-N 396.471 5.842 30 20 GKED CCC(=NNc1c(C)cccc1Cl)c1ccc(OCCCCC(=O)O)cc1 1776060948 XOPRQLRFGSMNPO-UHFFFAOYSA-N 388.895 5.508 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776526467 HFFRWHNJBQRZQD-HYARGMPZSA-N 396.486 5.928 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccc(Cl)c(Cl)c1 1776785353 ZHIMMZGRUPKZSY-IBGZPJMESA-N 388.379 6.582 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)C2(C)CCCCC2)c1 1776789209 VGCOYXNTQICGDQ-NRFANRHFSA-N 375.553 5.549 30 20 GKED O=C1/C(=C\c2ccccc2OCc2ccccc2)C[C@@H](C(=O)O)c2ccccc21 1777698111 HSACEPCGKSASAS-PZNLSKEWSA-N 384.431 5.104 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2cccc(Cl)c2)cc1 15584975 VUPNYOCCMWBYPW-UHFFFAOYSA-N 392.911 5.434 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)[C@H](C#N)c1nc(C)cs1 48787821 RFEDASFFASGSHW-AWEZNQCLSA-N 383.542 5.287 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 51655908 GWXLHBUOKFIXNW-INIZCTEOSA-N 399.466 5.407 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(OC(F)F)c2)cc1 65680339 WHKRCGWMZZFTEO-UHFFFAOYSA-N 380.350 5.204 30 20 GKED Cc1cccc(-c2nnc(SC[C@H](C#N)CCC#N)n2[C@@H]2CCCC[C@@H]2C)c1 66237889 MBDKJXWEFFQGNH-CMKODMSKSA-N 393.560 5.540 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(SCc3csc(C)n3)cc2)c1 103031735 WBWWDTPDFUHUBS-UHFFFAOYSA-N 378.522 5.002 30 20 GKED C[C@@H](SCc1cccc(C#N)c1)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 105623710 IFZVEHSZFVWYST-GFCCVEGCSA-N 393.493 5.111 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(Cl)c1 108531406 LAQASMNPBXAOSA-KXBFYZLASA-N 399.947 5.961 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)c1ccccn1 126063264 MDYJCFASDNKQFK-CYBMUJFWSA-N 384.222 5.066 30 20 GKED C[C@@H](c1ccccn1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 128657995 XGPLYFXAUCQHSG-HNNXBMFYSA-N 391.858 5.232 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)c1cccc(SCC#N)c1 175981935 RNUHKEJHNQWLTG-UHFFFAOYSA-N 388.492 5.442 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2cccc(SCC#N)c2)c1 175988108 WLQGFUIXYJNHSU-UHFFFAOYSA-N 396.459 5.517 30 20 GKED N#CCCCOc1cccc(CNc2ccc(-c3ncc4n3CCCC4)cc2)c1 178194411 VMTWXDDAMYFKCC-UHFFFAOYSA-N 386.499 5.181 30 20 GKED C=CCC[C@@H](NCc1csc(CC(=O)Nc2ccccc2)n1)c1ccccc1 180042754 RJHQUHHMYGPCQB-OAQYLSRUSA-N 391.540 5.121 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)Nc2ccccc2O[C@H](C)C#N)cc1 180075563 JCUYBJKIRKLHES-CVEARBPZSA-N 383.517 5.361 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 185323901 BASYIMCOWPGEET-QFBILLFUSA-N 379.529 5.450 30 20 GKED Cc1nc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cs1 188918340 XXBMXVJICGFQSV-CXAGYDPISA-N 386.546 5.215 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCCN(C(=O)c2ccccc2)C1 189883222 RRPBPXNXQKBWKW-NRFANRHFSA-N 390.527 5.029 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)c(C)n1[C@H](C)c1ccccc1 195659016 KLCFEHBDCKBLBV-UZLBHIALSA-N 382.467 5.081 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1ccc(CC#N)cc1 251977319 DWAPYAYNIMYNAY-UHFFFAOYSA-N 386.238 5.275 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303378039 VCZHJMAPOKOVGV-UHFFFAOYSA-N 381.435 5.322 30 20 GKED COc1ccc(Cl)cc1C/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329485437 FYHUYHFVBXVKKV-GOSISDBHSA-N 387.911 5.237 30 20 GKED Cc1nc2c(s1)[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)CCC2 371618635 JSHYJCFGJXSKNO-MLGOLLRUSA-N 386.546 5.045 30 20 GKED C[C@@H](CC(F)F)C(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 415425871 DBPBAVPZALNIES-UFBFGSQYSA-N 377.275 5.059 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(c3ncccc3Cl)CC2)c1 429756879 KXSRQLAFNBGPKU-UHFFFAOYSA-N 385.895 5.101 30 20 GKED C[C@@H](Sc1ccc(Br)cc1)C(=O)Nc1ccc(C#N)cc1Cl 430358346 UMIGFDOAQHQSHG-SNVBAGLBSA-N 395.709 5.093 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)s2)o1 430624190 IORJTCYWRZXBMC-LBPRGKRZSA-N 385.514 5.264 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 432869572 XXNNWIJODVBQRN-WZONZLPQSA-N 393.556 5.585 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Cl)cc2-c2nc(C3CCCC3)no2)c1 439661246 MOWBFUPBQGXPGP-UHFFFAOYSA-N 398.875 5.233 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2ccccc2-c2cn[nH]c2)cc1 439744978 LYLGZYIYMPSYQS-UHFFFAOYSA-N 396.475 5.352 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)CC1 441638881 VWFNKJPOQKIHSM-UHFFFAOYSA-N 392.434 5.085 30 20 GKED CC[C@H](Nc1cc(C(=O)N2CCCCCC2)ccc1OC)c1ccc(C#N)cc1 447598814 IGZWEWVSFBWNDC-NRFANRHFSA-N 391.515 5.146 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)c(OC)c1 459394783 HKAIPCFLSHMXML-OAHLLOKOSA-N 399.516 5.156 30 20 GKED CCO[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1=CCCC1 465175390 MCTSQBJBLBRPHH-QFIPXVFZSA-N 376.456 5.195 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)c1 465488468 GJJZVUCYWNTLIJ-HSZRJFAPSA-N 399.425 5.032 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ncc(-c2ccccc2F)o1 467270655 BXNHBEVBXIUIRC-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CCCCC1CCC(C(=O)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)CC1 470790718 WGJWWHMSFVWLFD-UHFFFAOYSA-N 395.547 5.205 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@H](OC)c1ccc(OC)cc1 475549201 NXHOCOMJNHPATF-SBUREZEXSA-N 396.531 5.445 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1 476125402 AJNRBFDKGAWWOM-UHFFFAOYSA-N 398.478 6.193 30 20 GKED Cc1occc1-c1nnc(SCC#Cc2ccccc2)n1Cc1ccccc1 478536075 IQLAHHACNYGUJS-UHFFFAOYSA-N 385.492 5.039 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C(C)(C)Oc2ccc(C#N)cc2)cc1)c1ccccc1 481290711 WLWLKRHUJBUGNH-GOSISDBHSA-N 399.494 5.527 30 20 GKED COc1ccc(Sc2ccc(NC(=O)NCc3cccc(C#N)c3)cc2)cc1 481601507 YCQPYSHCOSBQCI-UHFFFAOYSA-N 389.480 5.040 30 20 GKED C=CCN(CC1CCCCC1)C(=O)NCc1cccc(NC(=O)C2CCCC2)c1 483883375 JBTBIIHUONEEEN-UHFFFAOYSA-N 397.563 5.093 30 20 GKED CCCN(CCC)C(=O)c1cccc(C(=O)Nc2sc(C)c(CC)c2C#N)c1 484354440 WHZIIOGVQOBDOO-UHFFFAOYSA-N 397.544 5.005 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1 485405013 BVTHYRPETHRBDG-UHFFFAOYSA-N 391.943 5.080 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(Cl)ccc1OCCOCC 486249418 JHXWOCLYLLHWFQ-UHFFFAOYSA-N 391.920 5.286 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C)c(F)cc1Cl 487433782 ZJUIGJAKUNZORK-UHFFFAOYSA-N 378.879 5.175 30 20 GKED N#CCCC[C@@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 487500099 IUARJSFDXWTYSQ-HSZRJFAPSA-N 397.478 5.104 30 20 GKED CC(C)n1ncc(C(=O)Nc2cccc(OCCCC#N)c2)c1-c1ccccc1 489051515 MTIFMFCMOMVXSV-UHFFFAOYSA-N 388.471 5.066 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 494800821 PGKDDWLKXQOIQI-MFKMUULPSA-N 388.327 5.240 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2cccs2)Cc2cccs2)cc1Cl 502701222 SUGQXPCVKMTZPV-UHFFFAOYSA-N 387.917 5.569 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccnc(-c2ccccc2)c1 504151412 ORXLFXWFGIXIRB-FYYLOGMGSA-N 382.467 5.052 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 513652363 AASVYHPUNNHAGT-UHFFFAOYSA-N 391.789 5.267 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3cccc(C#N)c3)c3cnn(C(C)C)c3n2)cc1 513834707 YQNNYKCVDTVSTC-UHFFFAOYSA-N 395.466 5.112 30 20 GKED COc1ccc2oc(C(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)c(C)c2c1 522203493 CSBVURVFTPZIJY-HNNXBMFYSA-N 389.238 5.051 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 523091922 DXCVVRFGDPBFML-HSZRJFAPSA-N 385.467 5.163 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)sc2c1CCC2 525628371 CSQXXDDRXQWAOO-UONOGXRCSA-N 377.296 5.157 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 537947537 YFYWPKDWFWEXML-HRAATJIYSA-N 380.438 6.137 30 20 GKED COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)Nc2ccc(C#N)cc2)c1 542192132 JMSSQLHOPRFJIA-RPWUZVMVSA-N 397.478 5.330 30 20 GKED COc1cc(C#N)ccc1NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 546708366 CSGWIPYIYSOJGP-MRXNPFEDSA-N 391.496 5.424 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)Nc2ccc(F)c(C#N)c2)cs1 566650796 WZMUJQDUZSTPKT-UHFFFAOYSA-N 397.450 5.185 30 20 GKED COc1ccc(-c2ccccc2C)cc1CN1CCC(C#N)(c2ccccn2)CC1 571739329 ZQMQSQMSBYZAIS-UHFFFAOYSA-N 397.522 5.123 30 20 GKED CSC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 573271382 JAABTPSWAUHDQR-WOJBJXKFSA-N 392.490 6.134 30 20 GKED CC(C)(C)Oc1ccc(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 590915881 SJDLTGUDTZHUBY-NRFANRHFSA-N 379.504 5.098 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1F 595689909 FOWFMBXVJRTJMD-ZHRRBRCNSA-N 399.535 5.003 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21 599737669 OTEXAHJNKDRFTP-ALIQFICWSA-N 397.931 5.052 30 20 GKED COc1ccc(Nc2ccccc2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 603670468 RZSQZCSAWLTGFB-UHFFFAOYSA-N 385.467 5.492 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCCOc1ccc(Cl)cc1 603956226 HNQDHCYNNPAMOX-UHFFFAOYSA-N 394.858 5.197 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)[nH]c2c1 604101833 BLTGMBMZGAXLMW-UHFFFAOYSA-N 396.450 5.404 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(OC(C)(C)C)cc1 604506756 CUISQXCWIGATQE-UHFFFAOYSA-N 393.531 5.103 30 20 GKED CCc1ccc([C@H](C)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 609020230 IWBPNMCUFZRGSP-KRWDZBQOSA-N 385.467 5.359 30 20 GKED CSc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc1 609104170 SNHLTBJOEYXLJC-UHFFFAOYSA-N 392.455 5.251 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2F)c1 609106904 STPNULZHYCZQOR-UHFFFAOYSA-N 394.833 5.111 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)N(CCC#N)CC(CC)CC)s2)cc1 609188301 DGGUTDRQDOLUSH-UHFFFAOYSA-N 399.560 5.309 30 20 GKED CC1CCC(C)(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 609207221 LBRUIWREZGPPFY-UHFFFAOYSA-N 391.515 5.422 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H]1CCCc2ccccc21 609371785 XPYPOLLQBKQQCM-OXJNMPFZSA-N 396.581 5.688 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609428463 PTLXXPMFTSUNFR-QGZVFWFLSA-N 382.529 5.530 30 20 GKED N#C[C@@H](NC(=O)CCCOc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 609460482 AYXZUJMGRSQCMY-MRXNPFEDSA-N 397.689 5.187 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)c1 609789060 FZBWWVFCUGPTHT-UHFFFAOYSA-N 387.386 5.147 30 20 GKED CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)c1c(Cl)cc(C#N)cc1Cl 611094233 BXPPFJGMPUIFOR-DYZYQPBXSA-N 397.689 5.024 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc2ccccc2n1C1CC1 611111570 OVMZWBLBSRVAIZ-UHFFFAOYSA-N 378.435 5.162 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320175 UMEFDJVDDPURRI-INIZCTEOSA-N 391.883 5.743 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Br)cc1C 615477615 ODXOVXIDJJWSGV-UHFFFAOYSA-N 377.257 5.117 30 20 GKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 619754644 GPTLZNCCAGGUBY-CYBMUJFWSA-N 397.887 5.699 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc2ccccc2n1C(F)F 642282451 SGENWBJACOOLKE-LJQANCHMSA-N 399.400 5.493 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 642469696 XBPSRHPZPJVTIR-UHFFFAOYSA-N 384.501 5.400 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccccc2CC)n1 661117107 OIIRTASGZKUOJR-PZJWPPBQSA-N 397.588 5.615 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2SCc2ccco2)n1 673815164 VDHJOQMESYOSOV-MRXNPFEDSA-N 382.510 5.642 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 726447100 QWNMUQWCGABVTL-LJQANCHMSA-N 385.920 5.144 30 20 GKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 727952933 XWLBGBGBCUPPLJ-GOEBONIOSA-N 399.560 5.449 30 20 GKED C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 728411932 PSLQAHNQPDJGGQ-XLIONFOSSA-N 396.446 5.062 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cccnc1Cl 728699908 XSRPAXOONMYLFG-RMKNXTFCSA-N 375.280 5.716 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1c[nH]c2ccccc12 733084163 XFBZRKXVXOVKOO-CMDGGOBGSA-N 375.409 5.096 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)NCc1cccc(O[C@H](C#N)CC)c1 733842004 OWGBHWATGVCOKI-KRWDZBQOSA-N 399.922 5.467 30 20 GKED CC(C)(C)/C=C\C(=O)Nc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1 733920499 QLMUFGJVMXFNRS-SREVYHEPSA-N 393.434 5.165 30 20 GKED CC(=O)c1ccc(Cl)c(Cl)c1OCc1cc(Cl)ccc1OCC#N 735233274 OYXUYYRTGVRJLB-UHFFFAOYSA-N 384.646 5.331 30 20 GKED Cc1ccc(-c2cc(CSCc3cc(Cl)ccc3OCC#N)on2)cc1 735318969 SZOBVFZWTRERAY-UHFFFAOYSA-N 384.888 5.639 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccnc3ccccc23)cc1 735429308 RPEFQZBTFZWUND-ZHSJKAEUSA-N 389.458 5.542 30 20 GKED O=C1/C(=C\c2ccccc2F)CC(O)(C(F)(F)F)C/C1=C/c1ccccc1F 735792747 JUJBMLCGOXPDTP-VULZFCBJSA-N 394.339 5.088 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)[C@H](C)c2cccnc2)s1 744746692 DSWLNLJQGISQGA-OAHLLOKOSA-N 375.542 5.061 30 20 GKED CCN(C(=O)Nc1cccc(OCC#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 746663252 OKYGLMRVMKKEIZ-AWEZNQCLSA-N 391.393 5.223 30 20 GKED COc1ccc(/C=C\C(=O)c2ccsc2)cc1OCc1ccc([N+](=O)[O-])cc1 749103935 FFAZJSZSGCFWOI-YWEYNIOJSA-N 395.436 5.140 30 20 GKED Cc1nc(CON=Cc2ccccc2OC(C)C)oc1-c1ccc(Cl)cc1 768510722 BYEHTNUIWZIYQB-UHFFFAOYSA-N 384.863 5.641 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 770651360 GFGUSYQUNVCMNW-DNVCBOLYSA-N 383.879 5.390 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776167895 HVRBCKIMUDDHDE-IERDGZPVSA-N 388.433 5.966 30 20 GKED COc1ccc(OCc2nc(/C=C/C(=O)c3csc(Cl)c3)cs2)cc1 787186608 PRZYEPKGMYSYIL-FARCUNLSSA-N 391.901 5.342 30 20 GKED N#C[C@@H](C(=O)CC(c1ccccc1)c1ccccc1)c1nccc2ccccc12 792103699 KSCHKPRWWUETLY-DEOSSOPVSA-N 376.459 5.633 30 20 GKED C[C@H]1C[C@@H](C)O[C@@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 800386814 NVCWPYJGDMSVFT-YDXZUZSKSA-N 395.311 5.107 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1cc(F)c(C(F)(F)F)cc1F 804342272 HEAFOWVTKUEGOZ-UHFFFAOYSA-N 387.201 5.394 30 20 GKED CC(=O)N1C/C(=C/C(C)=C/c2cccc(C(F)(F)F)c2)C(=O)c2ccccc2C1 806573350 ZNLWXGPUGODLSK-LGDLHNLVSA-N 399.412 5.280 30 20 GKED N#Cc1csc(C(=O)O[C@@H](c2ccc(C(F)(F)F)cc2)C(F)(F)F)c1 809125885 BNPHBVZJSOUWHJ-LBPRGKRZSA-N 379.281 5.099 30 20 GKED N#CCCC[C@H](N[C@H]1CCCc2cc(SC(F)F)ccc21)c1ccccc1 815635364 BBYPLHXJVWFBTC-SFTDATJTSA-N 386.511 6.403 30 20 GKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1O 815635590 GDXHXAKJKGWGQI-ROUUACIJSA-N 377.315 6.175 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)OCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1 859717546 LDJQSNIOWODFHI-QMMMGPOBSA-N 399.262 5.131 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CC3CCC(F)(F)CC3)n2)cc1 860503090 UANUJCVENNOTKX-MRXNPFEDSA-N 385.439 5.074 30 20 GKED N#CCOc1cccc(NC(=O)c2sc3cccc(Cl)c3c2Cl)c1 915742286 KQLJPGDHJMPNHE-UHFFFAOYSA-N 377.252 5.363 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2c(s1)CCCCC2 916915871 QRZMAFDQFLWKPT-SFHVURJKSA-N 388.492 5.131 30 20 GKED O=C(Nc1cccc(CCC(F)(F)F)c1)N1CC[C@@]2(C1)CC(F)(F)C2(F)F 930312222 ZBMDONSVSPVHCB-AWEZNQCLSA-N 398.322 5.080 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)ccc1Cl 1777263384 KWIICICLDDHHQP-YFHOEESVSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCOc4c(Cl)cccc4C3=O)o2)cc1 1777670957 GQVBNQOPLYFHLN-NTCAYCPXSA-N 394.810 5.347 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4cc(F)cc(F)c4C3=O)s2)c1 1777684360 VQAHZMOLZQQYIJ-GXDHUFHOSA-N 396.414 5.604 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1ccc(C(F)(F)F)cc1Cl 11717300 NEYJVSVCKREYTI-UHFFFAOYSA-N 399.825 5.025 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(OCCC)c(OC)c1 46675150 JXZATDVRMMDZGW-INIZCTEOSA-N 388.533 5.004 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1cc(C)ccc1C 60384022 CZFBVTNNONTSMB-UHFFFAOYSA-N 383.492 5.091 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)c(Cl)nc1Cl 66802197 OODICFBFCAJZIB-SECBINFHSA-N 384.263 5.174 30 20 GKED Cc1[nH]c2ccccc2c1CCNC(=O)Nc1ccccc1S[C@H](C)CC#N 66955652 GNLNOXIMTNWYHN-OAHLLOKOSA-N 392.528 5.235 30 20 GKED C=CCn1c(SCc2ccccc2OC(C)C)nnc1-c1ccccc1OC 108307644 XCEOWCYJHCDKCG-UHFFFAOYSA-N 395.528 5.219 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC/C=C/c1ccccc1 108409004 JHLBCTHJJATREK-JEJOPICUSA-N 382.554 5.466 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 109352430 CXZJCDOSVXVICX-UHFFFAOYSA-N 388.492 5.427 30 20 GKED O=C(Nc1ccc(OC(F)F)cc1OC(F)F)c1ccccc1C(F)(F)F 120989725 XOMDVIPHGIRPSC-UHFFFAOYSA-N 397.246 5.161 30 20 GKED CC(C)(C#N)CCCSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1 123889430 GEWHOSWTXXCKIF-UHFFFAOYSA-N 384.480 5.148 30 20 GKED CC(C)c1ncc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)s1 130056839 KKLGEBJUEXGXCO-UHFFFAOYSA-N 391.496 5.164 30 20 GKED CCc1noc(C)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 133144363 SZRLMLKJLHYGEP-UHFFFAOYSA-N 381.819 5.115 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)Nc1ccc(F)cc1OCC#N)C1CC1 135270867 AMKLZUOCBSSEAE-ZDUSSCGKSA-N 387.842 5.139 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1-c1ccc(F)cc1 176733815 HGTDRMRXSKZXJF-INIZCTEOSA-N 376.412 5.494 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(NC(=O)c3ccccc3)cc2)n1 177762787 KUSLTJHNVVDIHZ-GOSISDBHSA-N 389.480 5.009 30 20 GKED CC(C)c1ccc(-c2ncc(CN(CCC#N)Cc3ccccn3)s2)cc1 178721220 XGWKKCPMZCQXAV-UHFFFAOYSA-N 376.529 5.244 30 20 GKED N#C[C@H](COC(=O)c1cc(-c2ccccn2)ccc1Cl)Cc1cccs1 180085476 BNFJXUJRGFTPCY-CQSZACIVSA-N 382.872 5.003 30 20 GKED N#C[C@@H](NC(=O)c1scnc1C1CCCC1)c1ccc(Cl)c(Cl)c1 185280905 CMWCGZJWOOGNQK-CQSZACIVSA-N 380.300 5.102 30 20 GKED C=CCC[C@H](C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1 188085968 VICAPBYLFJRKSF-AWEZNQCLSA-N 379.344 5.080 30 20 GKED CN(C(=O)c1cscc1C#N)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 410671396 IKXCEZHYOALUQT-RDJZCZTQSA-N 378.419 5.047 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1cn(C)nc1C(C)C 431981798 AKRHKAQROXQYDJ-UHFFFAOYSA-N 389.459 5.160 30 20 GKED C=CCC[C@@H](NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1)c1ccccc1 435759530 KXKNPDZQRFUVCS-PZJWPPBQSA-N 384.545 5.146 30 20 GKED C=CCc1cc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc(OC)c1O 436943097 YKSJXNMUOVMWPR-STZFKDTASA-N 388.423 5.021 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccnc1 437459456 JEEVUXZJPUVLCF-HNNXBMFYSA-N 375.403 5.017 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(CSCC)c1 438384491 WIMRNKPWSYLCTF-UHFFFAOYSA-N 385.489 5.068 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccc(F)cc1F 445921090 CQCSUBQUZHAUMJ-UHFFFAOYSA-N 378.378 5.118 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@@H]1C[C@H](C)O)c1ccc(C(F)(F)F)cc1 448153983 GVUOXLZBRAHQHH-IPELMVKDSA-N 398.469 5.048 30 20 GKED CCCN(C(=O)NCc1cc(C#N)ccc1F)[C@H](C)c1cc2ccccc2o1 466201122 XEAAZCUVKDOMDB-OAHLLOKOSA-N 379.435 5.126 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@]1(C)Cc1ccccc1 467341412 OAWJCHBFJOSVDZ-FDDCHVKYSA-N 393.556 5.710 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471254982 PDZZGYCUFWPDHI-JTQLQIEISA-N 376.268 5.768 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c[nH]c2ncc(Br)cc12 473227918 UIUWHNCPBAUHPS-UHFFFAOYSA-N 398.304 5.430 30 20 GKED N#CC[C@H](CC(=O)Nc1ccnn1Cc1cccc2ccccc12)c1ccccc1 475524575 BEDTYVMIEMUFIV-OAQYLSRUSA-N 394.478 5.111 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC[C@@H](c3cccc(F)c3)C2)c2ccccc21 478261234 ORPPMNJXUTZYRJ-QUCCMNQESA-N 389.474 5.150 30 20 GKED N#C[C@@H](C(=O)c1ccc(F)c2ccccc12)c1nc2ccccc2n1C(F)F 483494801 XKSAGAURPJSPHB-HNNXBMFYSA-N 379.341 5.214 30 20 GKED Cc1c(C(=O)Nc2c(-c3ccco3)nc3ccccn23)sc2ccc(C#N)cc12 487035071 YWONXVBLMNUJSZ-UHFFFAOYSA-N 398.447 5.241 30 20 GKED N#CCCC[C@@H](NC(=O)CCOc1cccc(Cl)c1Cl)c1ccccc1 487430960 SFRAYINUOFRAAS-QGZVFWFLSA-N 391.298 5.314 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)CC(=O)N(CCC#N)c1cccc(Cl)c1 497049213 QGXXDDFATHJKMA-INIZCTEOSA-N 395.890 5.026 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C[C@H](c1cccs1)n1cccc1 498647210 RMQFXXQLMFUKRT-OAQYLSRUSA-N 391.540 5.086 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCCC(F)(F)C1 503661509 BHDRZJONAQCBFN-GOSISDBHSA-N 386.417 5.365 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2occc2COc2ccccc2)cc1 505840489 YPUQNXRNZMETIS-OAQYLSRUSA-N 388.467 5.151 30 20 GKED CCC(CC)N(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H]1CCCc2cccnc21 511281064 KLZLAEDKSUTXDL-GGAORHGYSA-N 389.543 5.564 30 20 GKED CC(C)(C)CN(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 517646814 MDABBOVJJJQKRQ-UHFFFAOYSA-N 399.494 5.434 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)NCCCc3c[nH]c4ccccc34)c2)cc1 518590513 LDIGTVZUJWUVAS-UHFFFAOYSA-N 395.462 5.194 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1C1CCCCC1 520188451 CCEHSVJIMDYVMG-QGZVFWFLSA-N 395.572 6.257 30 20 GKED C=CCn1c(SCc2cc(C)nc3ccccc23)nnc1-c1ccccc1F 522701871 ZDCDAMVCPSEXAG-UHFFFAOYSA-N 390.487 5.419 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 524709410 YGEKJACBSRZASW-UHFFFAOYSA-N 395.459 5.630 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)sc2c1CCC2 525628370 CSQXXDDRXQWAOO-KGLIPLIRSA-N 377.296 5.157 30 20 GKED C=C(C)[C@@H](CC(=O)N(CC)[C@@H](c1ccc(Cl)cc1)c1cccnc1)OCC 533710406 NWCBBKISBLZSKR-IRLDBZIGSA-N 386.923 5.044 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ncccc3-c3ccccc3)c2)cc1 541877055 JMULLEIPZXOCFL-UHFFFAOYSA-N 391.430 5.665 30 20 GKED N#Cc1ccc(C(=O)Nc2cccc(CSc3ccccn3)c2)cc1Cl 548610954 IQUFALRKDXZVKM-UHFFFAOYSA-N 379.872 5.151 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCC[C@@H]1c1nc2ccccc2o1 548883979 VYNJBGJPWJIFKL-HXUWFJFHSA-N 375.472 5.706 30 20 GKED COc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@H](CCCC#N)c1ccccc1 551206065 PDVTVAIYWGDZHC-QFBILLFUSA-N 399.922 5.090 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC(C)(C)[C@@H]2c2cccnc2)cc1 553088755 LDTJZVIKTCHDSV-QHCPKHFHSA-N 397.478 5.277 30 20 GKED N#CCCN(C(=O)CCCOc1cccc(Cl)c1Cl)c1ccc(F)cc1 561916768 WNIANCOROWZDCF-UHFFFAOYSA-N 395.261 5.238 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)Nc1cc(C#N)ccn1 565969128 REFSTYPEWMYZID-NSHDSACASA-N 399.317 5.321 30 20 GKED CSC[C@](C)(C#N)NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 566624985 SSBCVNQMXHUJQT-INIZCTEOSA-N 385.341 5.097 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@@H](C)C[C@H](C)C4)ccc12 574617912 DTSKFQVLLRMXBG-AAEUAGOBSA-N 391.496 5.120 30 20 GKED CC(C)(CC#N)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 576053446 PGUVZOJTNBXVSY-UHFFFAOYSA-N 386.908 5.272 30 20 GKED CC(F)(F)c1ccc(-c2noc([C@H]3CCCN3c3ccc(C#N)cc3)n2)cc1 589373576 YBYMXBHKBRPYGU-GOSISDBHSA-N 380.398 5.061 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 599082492 XRROHMFIEXGOCN-BLLLJJGKSA-N 380.797 5.522 30 20 GKED COc1cccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 604026620 DMVJDFKKMFMVFW-UHFFFAOYSA-N 392.842 5.194 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3ccccc23)cc1 608877234 UKHNMPJBYYIFTE-UHFFFAOYSA-N 392.458 5.737 30 20 GKED N#Cc1ccc(CNC(=O)c2sc3cc(Cl)ccc3c2Cl)c(F)c1 609230017 KHOPXZUIVBIGOV-UHFFFAOYSA-N 379.243 5.149 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c(Cl)c1 611093314 YFKSZHGISJNIIL-UHFFFAOYSA-N 375.133 5.016 30 20 GKED COc1cccc(CN[C@H]2CCCc3cc(C#N)ccc32)c1OC1CCCC1 611392656 BFIXBHCSMDLRNC-QFIPXVFZSA-N 376.500 5.055 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cc3c(Cl)cccc3s2)cc1 626582486 AKNRIRNNAFCBMK-UHFFFAOYSA-N 385.876 5.115 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(C(F)F)nc1)c1ccc(C(F)(F)F)cc1 657929989 HUIZVVCPQINGOQ-GUYCJALGSA-N 384.392 6.396 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)NCc2ccc(OCC#N)cc2)C(C)C)cc1 727938240 HQCPIWDVGFNURB-WZONZLPQSA-N 393.531 5.299 30 20 GKED Cc1ccc([C@H](C)NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)s1 730175996 RMLRBILEJQROSG-AWEZNQCLSA-N 380.444 5.351 30 20 GKED CCCCCCCCCC(=O)N1CCC([C@@H]2CCCCCN2C(C)=O)CC1 731469198 UPCRUUXKZUBQHE-QFIPXVFZSA-N 378.601 5.157 30 20 GKED C#CCCOc1ccc(CNCc2ccc(-c3nc4ccccc4s3)o2)cc1 733324588 MKUQGUDRLPZTOY-UHFFFAOYSA-N 388.492 5.248 30 20 GKED C#CCCOc1ccc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1 733325202 DHNANNFXBCQGJJ-JOCHJYFZSA-N 381.928 5.683 30 20 GKED C[C@@H](SCc1cc(Cl)ccc1OCC#N)C(=O)Nc1ccc(Cl)cc1 735319826 FFULCJVOFUUYHV-GFCCVEGCSA-N 395.311 5.156 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740060232 RHMDOCUSXLOXGC-KRWDZBQOSA-N 389.524 5.498 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](Cc2ccccc2)c2ccccc2)c1 744029916 WXJCMVQRVYZECF-UPVQGACJSA-N 396.490 5.059 30 20 GKED CON=Cc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)cc1 745949629 FYOGJMCEAYTCOA-KRWDZBQOSA-N 378.497 5.132 30 20 GKED N#C[C@H](C(=O)c1csc(C2CC2)n1)c1nc2cc(C(F)(F)F)ccc2s1 747562825 ZBSNVSBQQVOQGS-SNVBAGLBSA-N 393.415 5.139 30 20 GKED Cc1nc2ccccc2nc1CNc1ccc(OCc2cccc(C#N)c2)cc1 749270217 PXHJQAWYAJFHOL-UHFFFAOYSA-N 380.451 5.001 30 20 GKED N#C[C@H](C(=O)Cc1ccc(F)cc1F)c1nc2cc(C(F)(F)F)ccc2s1 756244528 UWIXETQWKCYEFO-GFCCVEGCSA-N 396.340 5.012 30 20 GKED N#Cc1c(NC(=O)/C=C\c2ccc(Cl)nc2)sc2c1-c1ccccc1CC2 759842521 AHKSUPCHEATSFB-POHAHGRESA-N 391.883 5.086 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1c[nH]c2ncccc12 761813344 RVRPORWGCAYUFT-FPLPWBNLSA-N 399.397 5.601 30 20 GKED N#Cc1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c(F)c1 772804590 CTBBVQZZJNRZQO-QGOAFFKASA-N 384.435 5.731 30 20 GKED N#C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)C1CCCCC1 776355772 WYHKZNOUIAYYNT-MRVPVSSYSA-N 382.074 5.324 30 20 GKED C[C@@H]1CC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 776515101 HDUNWRRLQMFIIE-SUNKGSAMSA-N 379.312 5.729 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cccc(C)c2OC(F)F)S1 777871073 XHOQGMPFAKTNFW-XNTDXEJSSA-N 388.439 5.105 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C1(Cc2cccc(Cl)c2)CCCC1 780169386 ONLXWAFQNGSDPW-MRXNPFEDSA-N 382.891 5.372 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCO1 781616554 KDHFMLHREBLKKU-TZYHBYERSA-N 376.500 5.122 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nc2ccccc2n1C(F)F 795981818 FHSSUPCRXQXMFD-GOEBONIOSA-N 383.398 5.123 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CC1CC(c2ccccc2)C1 798815663 CCSUSXOTZJQYLK-JHJOLFGTSA-N 388.511 5.043 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)cs1 812243600 PHCJRVMOPZSFNW-YVMONPNESA-N 397.452 5.033 30 20 GKED CSCC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(C(F)(F)F)cc1 814822181 TUIQHGLKIWDYQK-UHFFFAOYSA-N 396.438 5.042 30 20 GKED C=CCc1cc(CNc2ccccc2NC(=O)OC(C)(C)C)cc(OC)c1O 816601779 UNTHNUZHVYTHGW-UHFFFAOYSA-N 384.476 5.088 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 824179004 NLAGBRYDKMMKBF-OAHLLOKOSA-N 382.895 5.037 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCCc3n[nH]cc32)cc1)C(F)(F)F 842892481 FHDYVQOZHFRHCP-LBPRGKRZSA-N 381.295 5.189 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842940363 BZEMGFSIIYPRRO-XKOZXHHJSA-N 376.403 5.319 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1nc(C2CC2)cs1 842940497 BGWMYZVAIXDREE-HZSPNIEDSA-N 377.296 5.307 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(OC(=O)CC2(C#N)CCCCC2)cc1 850828211 VYBXDPSWHLMMNA-UHFFFAOYSA-N 382.485 5.078 30 20 GKED C#CC[C@@H]1CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 862565527 SZJRMVLAJYZJBH-OAHLLOKOSA-N 381.522 5.272 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915354066 UMXCKHZYKNXFNV-KOSHJBKYSA-N 399.494 5.576 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCOc2ccc(C)cc2)cc1 916947386 IUGMTVYRWNUVAY-XMSQKQJNSA-N 392.499 5.015 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)nc1)c1ccc(N2CCCCCC2)cc1 917143311 YBHKXUAELLXZOI-GDNBJRDFSA-N 383.495 5.420 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804236 MQTBBJKTAXTIAR-HIFRSBDPSA-N 382.435 5.458 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1776030152 HZOCLTHKFNVAAZ-UHFFFAOYSA-N 390.283 5.259 30 20 GKED Cc1c(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)cccc1C(=O)O 1776087777 WCNUIGKLPQJCHL-INIZCTEOSA-N 376.378 5.448 30 20 GKED O=C(/C=C/c1ccc2oc(C(=O)O)cc2c1)c1ccc(OCc2ccccc2)cc1 1776126947 BXVDPTXSMHKHAK-WUXMJOGZSA-N 398.414 5.606 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@@H](C)CC[C@@H]2C(=O)O)cc1 1776787555 WMIDFFPORGVXNA-QFBILLFUSA-N 377.550 5.074 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1 15242233 IFBULMGMEOZPRR-OAHLLOKOSA-N 393.903 5.123 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F 62389044 KOPANOVNGBAHPG-UHFFFAOYSA-N 391.437 5.034 30 20 GKED COc1ccc(Cl)c(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c1 64828466 YYAKDQXPXSEHFI-UHFFFAOYSA-N 392.842 5.052 30 20 GKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1ccc(Cl)c([N+](=O)[O-])c1 72041981 ZXFSJUIFHDZIAG-FPYGCLRLSA-N 385.725 5.085 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 102982449 GJMCKHAHBDBIAM-UHFFFAOYSA-N 385.448 5.237 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ccc(Br)s2)n1 109264527 BMHWRPZVIJPBOM-UHFFFAOYSA-N 393.253 5.397 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 116573854 SFHXVKCYSIFGCL-CTBJKRMSSA-N 395.506 5.343 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc(C)cc1 122024447 RVPHTPWHJKUSHF-LPHOPBHVSA-N 375.497 5.274 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1sc(-c2ccccc2)nc1C 129376375 IQIYRXODRNHWSC-INIZCTEOSA-N 390.512 5.524 30 20 GKED COc1ccc(CNc2ccc3nc(C4CC4)oc3c2)cc1OCCCC#N 152508754 BMAZXSMNKOGKLZ-UHFFFAOYSA-N 377.444 5.008 30 20 GKED Cc1cc(-c2noc(CNc3ccccc3S[C@H](C)CC#N)n2)ccc1F 157834339 YKCVBFKZDDJCDJ-CQSZACIVSA-N 382.464 5.191 30 20 GKED CCc1noc(C)c1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 158378056 RXIDGZZAIPROIW-UHFFFAOYSA-N 376.416 5.162 30 20 GKED Cc1csc(N(C(=O)c2ccc(Sc3ccccc3C#N)cc2)C2CC2)n1 175730479 MRFQHPNTHBMPAE-UHFFFAOYSA-N 391.521 5.284 30 20 GKED CC(=O)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 182872002 UFTGZKWYIGNSRO-QGZVFWFLSA-N 380.856 5.156 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C2CC2)nc2onc(C)c12 189904676 GLBWMDRZYMRVLU-UHFFFAOYSA-N 375.472 5.513 30 20 GKED N#C[C@@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1cnc2ccccc2n1 190893980 JRNRJYPWIBZDTO-HXUWFJFHSA-N 395.487 5.412 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC=C)Cc1cccc([N+](=O)[O-])c1 191488735 CEGBYNUVLLWFHL-UHFFFAOYSA-N 393.487 5.667 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Cl)s1)c1nc2ccccc2n1C(F)F 255391599 DXMPZGQQPVASPY-JPVGGKMYSA-N 377.803 5.036 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Br)cc1F 321888037 OBHCDYSKAXNCSJ-ZDUSSCGKSA-N 377.257 5.444 30 20 GKED C[C@H](CC(F)F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 411974908 AYODGCGFOSWIMY-GFCCVEGCSA-N 378.806 5.020 30 20 GKED N#CCCC[C@H](NC(=O)NCCCCc1ccc(F)c(F)c1)c1ccccc1 431475653 YWEWZTLBEYYGNI-NRFANRHFSA-N 385.458 5.022 30 20 GKED C=CCn1c(S[C@@H](C#N)CC)nc2sc(C)c(-c3ccc(F)cc3)c2c1=O 436040879 LHBJDMGCRJYERB-OAHLLOKOSA-N 399.516 5.153 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)C1 437514337 BTZMMPVFUBNPPI-NRFANRHFSA-N 382.533 5.040 30 20 GKED Cc1cc(C#N)ccc1C(=O)N(C)CCCCCc1cc(-c2ccccc2)no1 438920173 POTJNFLHKULRDY-UHFFFAOYSA-N 387.483 5.007 30 20 GKED CCc1ccc(-c2nc(CC(=O)N[C@@H](CCC#N)c3ccccc3)cs2)cc1 439679817 YFXKBSOVVAEQFN-NRFANRHFSA-N 389.524 5.076 30 20 GKED COc1ccc(-c2csc3ncnc(Oc4ccc(C#N)c(OC)c4)c23)cc1 443947652 PDDXUJTUTFJAFN-UHFFFAOYSA-N 389.436 5.039 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)C1 455356802 QOYKYQWDUIFLSB-FZMZJTMJSA-N 394.422 5.033 30 20 GKED N#CCc1ccc(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)c(Cl)c1 455741373 ZOPQSKMOPVZUEA-UHFFFAOYSA-N 395.812 5.393 30 20 GKED C[C@H](C(=O)N[C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462440889 MQYWRHCICYWRJH-KPOBHBOGSA-N 386.417 5.133 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1cccc(C(F)(F)F)c1 464413692 DNBSJIWMGKFUQG-AWEZNQCLSA-N 392.446 5.671 30 20 GKED N#C[C@@H](C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1nc2ccccc2s1 467059565 MOAVDLUEAXDBNA-KRWDZBQOSA-N 389.867 5.502 30 20 GKED N#CC[C@@H](CC(=O)N1CCCCC[C@@H]1CC(=O)c1ccccc1)c1ccccc1 476240416 UPVBRTHWZGRZCN-XZOQPEGZSA-N 388.511 5.118 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477506057 CAYVKNJCCZRYKQ-AWEZNQCLSA-N 389.421 5.731 30 20 GKED O=C(NC[C@H]1CCCC[C@@H]1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 483675278 ZNZYTSSSNZBOFU-KOLCDFICSA-N 386.311 5.335 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1cccc(Cl)c1Cl 486438150 YFWRDTLZEMUFGA-FOGDFJRCSA-N 385.703 5.193 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC=C(c2ccccc2)C1 497329893 RZZNTFKMNAATJS-QGZVFWFLSA-N 377.513 5.402 30 20 GKED CC(C)(CCC#N)CNC(=O)NCc1ccccc1COc1ccccc1Cl 498013554 GBQQSJQZRKUXIT-UHFFFAOYSA-N 399.922 5.048 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1C[C@@H]1c1cccc(F)c1 499271463 HWHVHCUMWLGPGO-UXHICEINSA-N 388.467 5.134 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccccc1Cl 499958245 NXPXSNHUSVHRAM-FQEVSTJZSA-N 381.262 5.655 30 20 GKED Cc1nc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c(C)s1 501663676 IGVKGMINLYMJET-UHFFFAOYSA-N 397.887 5.116 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1cc2ccccc2o1 502612896 GHJXUUIKEUZXTP-KRWDZBQOSA-N 380.492 5.059 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc(OC)c1 503196225 YCXVNKSGNRVKRJ-UHFFFAOYSA-N 389.411 5.012 30 20 GKED N#Cc1ccc(CSCc2nc(C(F)(F)F)cs2)c(OC(F)F)c1 507606534 DKFANGZHRPKCBJ-UHFFFAOYSA-N 380.363 5.068 30 20 GKED C=CCOc1ccc(/C=C\c2nc(-c3nccc4ccccc34)no2)cc1OC 507691912 RRQRBODIQDMKNR-LUAWRHEFSA-N 385.423 5.029 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1 512531583 HJQFAPDNEZGBMA-QGZVFWFLSA-N 397.498 5.101 30 20 GKED N#CCCN(Cc1cccc(OCc2ccccc2Cl)c1)Cc1ccccn1 513750174 CBYWBUQFGYGAQQ-UHFFFAOYSA-N 391.902 5.230 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 515547422 XNEGNAWTZVILSN-CQSZACIVSA-N 393.855 5.403 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)cc2Cl)sc2c1-c1ccccc1CC2 515701635 RPTOELJNTHRYJK-UHFFFAOYSA-N 382.847 5.430 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCCOC2CCCC2)c1 522633684 ZRMZXWCXDVWWSA-UHFFFAOYSA-N 398.890 5.083 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)c1nc(O)c2c(-c3ccco3)csc2n1 525503634 LTVQHKLHKFSFLW-SNVBAGLBSA-N 397.456 5.521 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c(CN(C)C)c1 531790043 NSWZILVZOOYWMC-UHFFFAOYSA-N 399.494 5.281 30 20 GKED C=CC1CCN(C(=O)Nc2cccc(OCc3ccccc3OC)c2C)CC1 536256824 HTZUNCUFKDULGF-UHFFFAOYSA-N 380.488 5.013 30 20 GKED C=CCC[C@@H](NCc1csc(COc2ccc(F)cc2)n1)c1ccccc1 538257319 XYIKOVBSEJFZRL-OAQYLSRUSA-N 382.504 5.658 30 20 GKED C[C@H](N[C@H](C)c1nnc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 541076904 HEHATEJYXUDQGW-ZWKOTPCHSA-N 394.478 5.687 30 20 GKED Cc1cnc([C@@H](C)NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 541121185 ZOULNQMCMQQQDL-HZPDHXFCSA-N 390.512 5.112 30 20 GKED N#Cc1ccc(CN[C@H](Cc2ccccc2)c2cccs2)c(OC(F)F)c1 541596318 SIMUINFBSCKWIT-GOSISDBHSA-N 384.451 5.295 30 20 GKED Cc1cc(C(=O)NCCCC#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 543387811 UXFAVFNYBALBOA-CQSZACIVSA-N 390.314 5.509 30 20 GKED N#Cc1cccc(OCc2cccc(-c3nc([C@@H]4CCCCS4)no3)c2)c1 546517973 JKUWTQGGBHZVSU-IBGZPJMESA-N 377.469 5.145 30 20 GKED CCCCSc1ccc(C(=O)[C@H](C#N)c2ccccn2)cc1C(F)(F)F 546903877 HJHQSLKXLGHZMC-CQSZACIVSA-N 378.419 5.483 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2oc(C(C)C)nc2C)cc1 550008079 BHLHUHFIECQOOS-UHFFFAOYSA-N 391.427 5.031 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 558213212 RQEYHTIGLUGQHV-KRWDZBQOSA-N 399.368 5.487 30 20 GKED COc1cc([C@H](C)N[C@H]2CCc3ccc(C#N)cc32)ccc1OCc1ccccc1 558503970 KBHAIVZBLBCBSO-UUOWRZLLSA-N 398.506 5.484 30 20 GKED C[C@H](c1noc(-c2cn(CCCC#N)c3ccccc23)n1)c1c(F)cccc1F 561895428 WAALCMLOFCVQEP-AWEZNQCLSA-N 392.409 5.425 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1OCCCC 562132333 OHDAUTMOWKPJCG-UHFFFAOYSA-N 384.524 5.253 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2noc(C)n2)CCCCC1 562269110 HXRDCPUEKVJLCL-UHFFFAOYSA-N 382.508 5.211 30 20 GKED CC(C)c1oc([C@H]2CCCN2Cc2nc(C#N)cs2)nc1-c1ccccc1 566593009 SGSGMPNDQRWGBY-QGZVFWFLSA-N 378.501 5.130 30 20 GKED N#CCc1ccccc1NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1 572758108 JNMIXDNPBYXXGB-UHFFFAOYSA-N 376.843 5.237 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2 573223459 XVFCWWCTKLRZKV-NUNAXRQHSA-N 388.555 6.481 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ncsc2C(C)C)cc1 573362506 IQNHTIYLOJHOMB-UHFFFAOYSA-N 377.469 5.491 30 20 GKED CCC(CC)N(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@@H]1CCCc2cccnc21 580762196 RABRWSCCWJJRBV-YTFSRNRJSA-N 387.527 5.152 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(C(F)(F)F)s1 588886251 LLFVFVNVIBOTNV-UHFFFAOYSA-N 378.400 5.619 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(Cl)cc2OCc2ccccc2)C1 596926651 UOHPRGSELATTOI-MRXNPFEDSA-N 383.879 5.077 30 20 GKED C=CCOc1ccccc1CNC(=O)N[C@H](c1ccc(F)cc1)c1cccs1 600896123 WLTBKUVVWDERPS-OAQYLSRUSA-N 396.487 5.041 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(c4ccccc4)CC3)cn2)cc1 603690686 NZALOADLFPDPNH-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3sc4c(c3C#N)CCCCCC4)cc12 603996652 MXSMPLGAKPHLOV-UHFFFAOYSA-N 394.500 5.191 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 609042469 ZTHNODNZZQLGJB-UHFFFAOYSA-N 388.471 5.274 30 20 GKED CC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)C(C)(C)C 609254871 ZIEHHAJCHSYPCA-NRFANRHFSA-N 381.495 5.234 30 20 GKED COc1cc(Cl)ccc1CNCc1cccc(OCc2cccc(C#N)c2)c1 609353974 HWIGIGQREIQMLV-UHFFFAOYSA-N 392.886 5.089 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)CC(C)(C)C 609398293 SNFHACXUUHKNHW-GOSISDBHSA-N 395.572 6.019 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CCCCOc1cccc(C#N)c1 609496163 YZRHCZSWLRIFLX-UHFFFAOYSA-N 378.516 5.993 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)c1cccc(C(F)(F)F)c1 609993922 CLIKAZHRGLSXSD-SJCJKPOMSA-N 380.797 5.233 30 20 GKED COc1cc([C@H](C)Nc2c(C#N)nnc3ccccc23)ccc1OCCC(C)C 610129656 YTHUBRYGZZJPFT-INIZCTEOSA-N 390.487 5.108 30 20 GKED CC(C)(C)c1ccc(Oc2ccc(C(=O)Nc3ccc(C#N)c(C#N)c3)cn2)cc1 610231653 XVCHZVWKZWCDRD-UHFFFAOYSA-N 396.450 5.167 30 20 GKED CC(C)CN1Cc2cccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)c2C1 611264785 YYTWLLYTIUKUGD-UHFFFAOYSA-N 388.298 5.089 30 20 GKED CC(C)(C#N)CNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 611694249 HOUOYVQAXIVFHS-UHFFFAOYSA-N 398.915 5.658 30 20 GKED C[C@@](NC(=O)c1cscc1C(F)(F)F)(c1ccc(F)cc1)C(F)(F)F 622842682 LQDVPHFTJCRKDM-CYBMUJFWSA-N 385.304 5.114 30 20 GKED CN(CCC#N)c1ccc(CNCc2ccccc2-c2ccc(Cl)cc2)cc1 726797491 GWZDJWJGCGNQEF-UHFFFAOYSA-N 389.930 5.647 30 20 GKED Cc1cccc2c1C/C(=C/c1cn(-c3ccccc3)nc1-c1ccncc1)C2=O 729149271 CVIBNXDFFJJREN-RGEXLXHISA-N 377.447 5.065 30 20 GKED N#CCn1c(C(=O)O[C@H](c2cccc(Cl)c2)C(F)(F)F)cc2ccccc21 730420498 HNNGFIRUIPOTLR-QGZVFWFLSA-N 392.764 5.279 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1OC 731400381 OBCOUGMKLKFVBS-RDJZCZTQSA-N 383.517 5.362 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2ccc(Cl)c(Cl)c2)c1Cl 734744513 RCIIWLQUDUAFPY-UHFFFAOYSA-N 379.678 5.493 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)SCc1cc(Cl)ccc1OCC#N 735319799 CWHAEOFOCPYHTI-CQSZACIVSA-N 388.920 5.065 30 20 GKED C=CCCCN(C)Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12 736589770 MBVHPOILSSLHAF-UHFFFAOYSA-N 397.902 5.525 30 20 GKED CC(C)[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 744034230 DHXXISPDMNRVLE-ICSRJNTNSA-N 394.927 6.080 30 20 GKED CCCCCCC[S@@](=O)Cc1ccnc(-c2ccc(Br)cc2)n1 749710267 SHSCQZIMKQTCTK-HSZRJFAPSA-N 395.366 5.125 30 20 GKED N#CCc1ccc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1 758548042 SANQVUNIUVCRTN-OAHLLOKOSA-N 391.323 5.291 30 20 GKED Cc1ccc(C)c(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 760049285 VDMRCACUAKVUCW-DEOSSOPVSA-N 383.495 5.623 30 20 GKED C=CC[C@@H](N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccncc1 766020437 PMQWDHBNSJQTIG-BLLLJJGKSA-N 384.373 5.252 30 20 GKED C#C[C@@H](C)N(C)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 770513927 XEYKFADXLAKPGT-MRXNPFEDSA-N 392.478 5.217 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3ccc(F)cc3)s2)C(=O)c2ccccc2C1 778519071 FAGLRSRFLSHFNC-PDGQHHTCSA-N 391.467 5.183 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 779021495 SZBKKWFXNFPGKW-HSZRJFAPSA-N 385.467 5.198 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C(C)=C\c3ccc(C)cc3)n2)cc1 779195145 RKCLJMDYEBGHNI-WNJRYGEDSA-N 388.492 5.407 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc2cc(Br)ccc2c1 780162445 HKKAJCILSATYJN-ZDUSSCGKSA-N 395.256 5.145 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2c(-c3ccccc3)oc(C)c2C)c1 780707690 YSKIGCHKQFLNRB-HXUWFJFHSA-N 388.467 5.174 30 20 GKED FC(F)(F)c1cc(Br)ccc1NN=Cc1scnc1C1CC1 782229789 NJPSADGQVYYMHU-UHFFFAOYSA-N 390.228 5.248 30 20 GKED N#C[C@H](c1ccc(Cl)cc1)N1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 787718698 SQPQHXGLACDWFK-UXHICEINSA-N 375.299 5.004 30 20 GKED COc1cc(C(=O)/C=C/c2ncc(C(F)(F)F)s2)ccc1SC(F)F 788353575 ANCSILKLXYQERQ-HWKANZROSA-N 395.374 5.381 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1 791725808 SGCXPONZRFIULI-UHFFFAOYSA-N 397.906 5.077 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1 796079306 JEIKVABNEFYBHY-XZOQPEGZSA-N 382.463 5.188 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccc(C2CCC2)c1 798815618 BAYUDZJZTNRGJV-INIZCTEOSA-N 387.266 5.222 30 20 GKED C[C@H](OC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 801706482 HQYVNTPSJRDAFF-XPTSAGLGSA-N 395.274 5.434 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(F)c2)CCCCC1)c1cnc2ccccc2n1 805929557 JDWCLAQVMBHQPI-LJQANCHMSA-N 387.458 5.138 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)c2cc3cc(Br)ccc3o2)cn1 806566865 BPPPBPOFJQWJIP-GQCTYLIASA-N 385.261 5.179 30 20 GKED N#Cc1cc(Oc2ccc(NC(=S)Nc3ccc4ccccc4c3)cc2)ccn1 811708016 OOOLAIORGPROSY-UHFFFAOYSA-N 396.475 5.708 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2C[C@H]3[C@H](C2)C3(F)F)c1 844519627 HGFIUJPMEABDOZ-OALUTQOASA-N 380.479 5.293 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)[C@@H](F)c1ccc(C(F)(F)F)cc1 857453429 MECBZHXSMYEQNM-AWEZNQCLSA-N 379.275 5.460 30 20 GKED C=CCCC[C@H](C(=O)Nc1cccc(NC(=O)N(C)C)c1C)c1ccccc1 890324076 RGUCDHSMUSOKOF-IBGZPJMESA-N 379.504 5.167 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=Cc4cccc(OCC#N)c4)c23)cc1 915955969 MJOHAERBNYRQHR-UHFFFAOYSA-N 399.479 5.015 30 20 GKED CC(C)c1cccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 917574025 APPRANGZBFQEPI-QHCPKHFHSA-N 385.536 6.274 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N(C)Cc2ccccc2)cc1 918047261 RVHBQDNCDGIPQA-UHFFFAOYSA-N 391.540 5.605 30 20 GKED CON=Cc1ccc(C(=O)N(C2CC2)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 919862157 HPHXHRALCMWYSB-AWEZNQCLSA-N 390.405 5.052 30 20 GKED C#CCCOc1ccc(/C=C2/SC(=S)N([C@H](C)c3ccccc3)C2=O)cc1 920472924 POZGTYCWUVUNPC-MURKYSCBSA-N 393.533 5.051 30 20 GKED Cc1cccc(Cl)c1NN=Cc1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1776060940 XFARPNAASXHBAB-NRFANRHFSA-N 394.858 5.299 30 20 GKED CCCOc1ccc(C(C)=NNc2cccc(C(=O)O)c2C)c(OCCC)c1 1776086316 MNYGERDMFWADRN-UHFFFAOYSA-N 384.476 5.107 30 20 GKED Cc1cc(C(=O)/C=C/c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c(C)s1 1776133190 PIOQPTHZTWCCRB-RMKNXTFCSA-N 396.464 5.440 30 20 GKED CC[C@H](C)n1ncc2c(C(=O)O)cc(/C=C\c3ccc(C(C)(C)C#N)cc3)nc21 1776702138 YNITZXQJGNTUOT-QIENPNARSA-N 388.471 5.072 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Br)ccc1Cl 1776783715 DNHHGVYKGYYQTD-OAHLLOKOSA-N 390.749 5.396 30 20 GKED COc1cc(/C=C\C(=O)c2sc3c(C)cc(C)cc3c2C)ccc1C(=O)O 1777290473 OJOZQOADWHZPNP-VURMDHGXSA-N 380.465 5.429 30 20 GKED N#Cc1ccc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1C(F)(F)F 1848435922 SANYYXRYMXRKGK-UHFFFAOYSA-N 398.266 5.112 30 20 GKED in-vitro C=CCN(Cc1cccs1)C(=O)c1cc(-c2ccccc2)nc2onc(C)c12 22967468 VZBGPHITDPDBKZ-UHFFFAOYSA-N 389.480 5.088 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)s1)c1nc(-c2ccccc2)cs1 51533733 KJJUITUTAMUIMH-NSHDSACASA-N 389.299 5.124 30 20 GKED CCN(C(=O)c1csc(-c2ccc(C)cc2C)n1)[C@@H](C)c1ccc(C#N)cc1 63927658 PGKZWDDJMXBZGE-KRWDZBQOSA-N 389.524 5.522 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1F 66955181 VPVNYBXSSCGVKO-KGLIPLIRSA-N 387.480 5.111 30 20 GKED N#CCCN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Cc1ccccn1 93100717 ABNPFQKLJJWBSJ-UHFFFAOYSA-N 387.327 5.035 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c(F)cccc2Cl)cc1Cl 107879637 KMMAHOPFEUUUIC-INIZCTEOSA-N 399.252 6.040 30 20 GKED N#Cc1ccc(NC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1Cl 123949737 DNTTVFLWJCYEAD-UHFFFAOYSA-N 376.847 5.014 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2nc(-c3ccncc3)cs2)cc1Cl 124115195 UYYFTFUEBCQQCL-CQSZACIVSA-N 385.920 5.274 30 20 GKED CC(C)Cn1ncc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 131346181 XEHDOZDYZTWHOA-CQSZACIVSA-N 398.919 5.170 30 20 GKED N#CCc1ccc(NC(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)cc1 132544161 SACRKYOSLNBAMT-UHFFFAOYSA-N 385.389 5.093 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccncc1 133795753 GKCPNPDJRPKGLX-UHFFFAOYSA-N 377.831 5.066 30 20 GKED CC[C@@](C)(NCc1cccc(OCc2cccc(C#N)c2)c1)c1nccs1 152634896 DYSVWHAMOLXYRF-JOCHJYFZSA-N 377.513 5.009 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2ccc(OC)c(OC)c2)c1 171274488 HHKPLIUMVTVYMA-HXUWFJFHSA-N 396.487 5.028 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H](C)Sc1ccccc1 173115234 VQZRLTWWSCJVOI-JKSUJKDBSA-N 385.558 5.241 30 20 GKED N#CCSc1cccc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)c1 175551628 QHXYHWLJPSEAKM-LJQANCHMSA-N 396.562 5.213 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1cccc(SCC#N)c1)c1ccccc1 175975735 NVBINWSLPJFIAA-QGZVFWFLSA-N 388.492 5.695 30 20 GKED COc1ccc(-c2csc(CNCc3ccc(O[C@@H](C)C#N)cc3)c2)cc1 177583905 OHKSBYPORMDEOP-INIZCTEOSA-N 378.497 5.004 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCOc1ccccc1-c1ccccc1 182062853 DWEBAILOGOZQCM-SFHVURJKSA-N 386.451 5.052 30 20 GKED CCCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@@H](C)c1cc2ccccc2o1 184312056 BOIOOPWNOLNFOE-SJORKVTESA-N 391.471 5.729 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCCc2nc(CC)sc21 191478653 HUQGCUKTELYBDU-IBGZPJMESA-N 397.588 6.099 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc(OCCCC#N)c4)cc3c2C1 195569120 XLOSGFBLSRHSKK-MRXNPFEDSA-N 387.483 5.228 30 20 GKED N#Cc1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 237773478 BGMPEQCIVGSNRR-UHFFFAOYSA-N 393.830 5.202 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCO[C@H]1C(C)(C)C 246305427 FQURWALBSPQYCU-GPMSIDNRSA-N 389.565 5.044 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ncc(C)s2)CC1 277458323 MIMODPJYHASZMU-UHFFFAOYSA-N 383.561 5.715 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H]3CCc4cc(F)ccc43)cc2)c1 303365718 RDIRLCFJLPDUIP-JOCHJYFZSA-N 387.414 5.299 30 20 GKED Cc1oc2ccc(N=C(O)N3CCC[C@H](c4ncc5n4CCCC5)C3)cc2c1C 328649899 IWOGJOJULBSZSH-KRWDZBQOSA-N 392.503 5.008 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc2c(c1)C(=O)CCC2 427051598 CHNIMIIPGPOHRE-UHFFFAOYSA-N 398.487 5.481 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 427245059 YNYCDKRCQBXJJR-ROUUACIJSA-N 392.808 5.271 30 20 GKED N#CCC1(CNCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)CC1 430025844 YFZNKMJGGGKDNS-UHFFFAOYSA-N 388.298 5.029 30 20 GKED N#CCCC[C@H](NC(=O)NCC(F)(F)c1ccc(Cl)cc1)c1ccccc1 431314268 ORUFBWBYJNJSST-SFHVURJKSA-N 391.849 5.166 30 20 GKED Cc1ccc(Cl)c(S(=O)(=O)N[C@H](CCCC#N)c2ccccc2)c1Cl 431613867 KAECHYOYUPIDOJ-MRXNPFEDSA-N 397.327 5.015 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1COc1ccccc1)c1ccccc1 432924710 ZRGBXPWQJKTWCE-QHCPKHFHSA-N 399.494 5.822 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 432991054 ILFZOBCHOFCZSH-VWNXMTODSA-N 396.494 5.361 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 433314261 YUJOEFPZHKFINI-GHTZIAJQSA-N 394.927 5.380 30 20 GKED Cc1oc(NC(=O)CN(Cc2ccccc2)[C@@H](C)c2cccs2)c(C#N)c1C 435191941 FYMUJXNEURWELY-INIZCTEOSA-N 393.512 5.032 30 20 GKED N#Cc1ccc(NC(=O)CS[C@H](c2ccccc2)c2ccc(F)cc2)cc1 437453671 NCCJIFBUAFESTK-JOCHJYFZSA-N 376.456 5.159 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc2oc(C3CC3)nc2c1 437927372 PJCQSSYTLWEMFP-ICSRJNTNSA-N 386.455 5.009 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(Cc3ccccc3)CC2)cc1C(F)(F)F 438632878 DWLRGUSGANLPNN-UHFFFAOYSA-N 387.405 5.064 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC[C@@H]1c1ccccc1 438639300 VSLXUBGIZCLHDJ-KDOFPFPSSA-N 387.405 5.235 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 438841142 OUTCFYBISRGQOY-ROUUACIJSA-N 375.394 5.024 30 20 GKED CCOc1ccc(-c2nc(CN(Cc3ccc(C#N)cc3)C(C)C)co2)cc1 446765192 NBFXUAYMXFFAIE-UHFFFAOYSA-N 375.472 5.023 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)N[C@@H](c1cc(F)ccc1F)C(F)F 447720854 SXYUCUISWCJAQJ-BBRMVZONSA-N 393.302 5.123 30 20 GKED CCCOc1ccc(Oc2ncccc2CNC2CCC(C)(C#N)CC2)cc1 449093778 YIYZNBOXIMUGRK-UHFFFAOYSA-N 379.504 5.225 30 20 GKED Cc1sc([C@@H](C)NC(=O)N(C)CC(C)(C)C#N)nc1-c1ccc(Cl)cc1 458528535 PZLMHOIOQUMUAM-GFCCVEGCSA-N 390.940 5.024 30 20 GKED C=C(C)Cn1c(-c2ncccc2C)nnc1N1CCC[C@H]1c1ccc(Cl)cc1 460772249 QKMWFHQGQFPQMB-IBGZPJMESA-N 393.922 5.220 30 20 GKED Cc1sc(NC(=O)c2cc(-c3ccccc3C(F)(F)F)on2)c(C#N)c1C 463071131 QRHQSGZOBZZSKD-UHFFFAOYSA-N 391.374 5.163 30 20 GKED C[C@@H](C(=O)Nc1cccc(Cl)c1SCC(F)F)c1cccc(C#N)c1 463940581 FQMRHCGDXZFUAV-LLVKDONJSA-N 380.847 5.311 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2cccc3ccccc23)cn1 468790042 CAJHLVVKGYFQBV-UHFFFAOYSA-N 383.838 5.679 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cn(-c2ccccc2)nn1 471666454 GVHQOXIPDMUTBC-KRWDZBQOSA-N 381.439 5.104 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2SCc2cscn2)n1 474450918 XYWZAUWUEGHIFS-OAHLLOKOSA-N 399.566 5.505 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1OCCc1ccccc1)c1ccccc1 474889805 IMMACYCYSZPAMS-JOCHJYFZSA-N 384.479 5.334 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 475918676 LJVRJNRGEUIKHK-GOSISDBHSA-N 377.488 5.006 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1oc2ccccc2c1C 479350343 UMKLALBQNFNFKF-KRWDZBQOSA-N 375.472 5.296 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)c1ccc(COc2ccccc2C#N)o1 484868830 PXVBIGHGUCWJHW-UHFFFAOYSA-N 388.467 5.416 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1 485485631 CMBBTBCTBMAFNO-HNNXBMFYSA-N 396.487 5.265 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cccc2c1C[C@@H](C)N(C(=O)[C@@H](C)CC(=C)C)C2 486110651 NUKILSSINGZKPH-GBESFXJTSA-N 382.548 5.103 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccccc1 487474328 NYHPGLFMFDYORX-GOSISDBHSA-N 399.416 5.369 30 20 GKED COc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)ccc1OC1CCCC1 487598036 XAFFJFCULFOVGX-OAQYLSRUSA-N 392.499 5.182 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 495328054 LQKSJNIPRISLSK-UHFFFAOYSA-N 395.503 5.143 30 20 GKED COc1cc(Cl)cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 496406535 HKDCXVYSTOBKMH-CYBMUJFWSA-N 377.252 5.102 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc(CCC)c(C)s2)cc1 508149465 RHNUYMHQKYKHGR-UHFFFAOYSA-N 382.529 5.076 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)[C@H](C)c1ccc(C#N)cc1 509565437 YFUUSTKYQLPFNS-NIKGAXFTSA-N 386.417 5.290 30 20 GKED CC[C@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(Cl)s1 512528499 HLQXBDXPEBQPPL-JTQLQIEISA-N 385.823 5.147 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)s1 513375296 CMPJDMLKXXBXCS-IBGZPJMESA-N 389.480 5.093 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 515735387 BRIDTKCYLCXPJO-CQSZACIVSA-N 396.878 5.903 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 517658333 GZTUNRZMMQRNNO-CHWSQXEVSA-N 391.286 5.606 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Nc1ccc(C#N)cc1 517865837 QNEULAOTKJAHCE-ZDUSSCGKSA-N 380.448 5.012 30 20 GKED CCCCOc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 518906008 PYRBLEZMNSJSCU-UHFFFAOYSA-N 387.439 5.177 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccs1 520197895 SKKKOHYSJSIBSB-WBVHZDCISA-N 387.574 6.051 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 521140999 FPJAGXNBBPWOOH-SJCJKPOMSA-N 379.312 5.103 30 20 GKED CSc1cccc(N(C)C(=O)c2ccccc2Sc2ccccc2C#N)c1 523554845 IPGGBVWKHUJYRA-UHFFFAOYSA-N 390.533 5.708 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)c1C#N 524106078 WIXQDUALDQUMNK-GJZGRUSLSA-N 378.419 5.252 30 20 GKED COc1cc(CNC(C)(C)c2ccccc2)ccc1OCc1cccc(C#N)c1 532955594 PBIVUJWRVGXUGQ-UHFFFAOYSA-N 386.495 5.171 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 537947526 XRYFIEKCUHYCHF-KXBFYZLASA-N 378.463 6.037 30 20 GKED C=CCN(C(=O)c1csc(C)c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 538052117 PRKHTIUUWKKMCZ-UHFFFAOYSA-N 399.497 5.229 30 20 GKED C=CCCOCCCCC(=O)N1CCc2ccccc2[C@@H](c2ccccc2)[C@H]1C 538281569 MKZQUCWELBPJFB-QFQXNSOFSA-N 391.555 5.355 30 20 GKED CC(=O)[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1(C)C 542765550 KUJOZPGVHFSBHD-AEFFLSMTSA-N 394.446 5.070 30 20 GKED N#CCc1ccc(-c2nc(C(F)(F)c3ccc(Cl)c(Cl)c3)no2)cc1 545140000 XRUQFLFTVHOLKP-UHFFFAOYSA-N 380.181 5.250 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnc(Cc3ccccc3)s2)c(C#N)s1 552703122 JRFIVWMFEDHBFM-UHFFFAOYSA-N 381.526 5.217 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H](c2c[nH]c3ccccc23)C(F)(F)F)cc1 553452624 YHLBHGCHXRLHFE-GOSISDBHSA-N 385.389 5.002 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C1CC1)[C@@H](C)c1ccccc1 554444209 ATEKZBMXJRPNNY-IRXDYDNUSA-N 379.529 5.838 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C(C)C)oc3C)n2)cc1 560554090 RQNMRLPWLTXTRO-QGZVFWFLSA-N 380.469 5.334 30 20 GKED COc1ccc([C@@H](CCC#N)NC[C@H](Cc2ccccc2)C(F)(F)F)cc1 563654491 DXDVSIGAVVTCPD-AZUAARDMSA-N 376.422 5.051 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)cc2c1 571096902 CIXGKHOTZRLNDE-UHFFFAOYSA-N 394.434 5.163 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(C(F)(F)F)s3)cc2)ccn1 577547058 SYECPPPLHCQMNQ-UHFFFAOYSA-N 375.375 5.438 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NC2CC(C(F)(F)F)C2)c1 582202227 ZHKDRLATOLXINX-UHFFFAOYSA-N 394.780 5.075 30 20 GKED CCO[C@@H](CC(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2)C1=CCCC1 583917848 KTWDFEQMDOPGRD-SFHVURJKSA-N 394.496 5.023 30 20 GKED N#CCCCn1cc(-c2nc(Cc3ccc4ccccc4n3)no2)c2ccccc21 589089370 VTQGPNIRGTWHDX-UHFFFAOYSA-N 393.450 5.134 30 20 GKED CC[C@@H](C)c1nc(C)c(CC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)n1 593973533 CSWVZYLLACOLMN-HUUCEWRRSA-N 396.560 5.040 30 20 GKED CC(C)(C)c1cc(CCC(=O)N2CCC[C@H](CC#N)C2)cc(C(C)(C)C)c1O 597919220 XJUQEXOWGBLZHU-QGZVFWFLSA-N 384.564 5.072 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)N(c1ccccc1)c1nc2ccccc2s1 603558238 MPBRAPRFKRMMNY-MRXNPFEDSA-N 399.475 5.300 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCOc1ccccc1-c1ccccc1 603578144 HRWQTVMRPZCXKM-UHFFFAOYSA-N 398.506 5.431 30 20 GKED Cc1ccnc2sc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)c(C)c12 603968987 SMDLYQKEAAFENT-UHFFFAOYSA-N 389.505 5.766 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)N(Cc1ccccc1)C(C)(C)C 609384659 FIDPXZNJSNJRBL-SFHVURJKSA-N 395.572 5.178 30 20 GKED CCc1ccc([C@H](C)NC(=O)[C@H](C)Nc2ccccc2SC[C@H](C)C#N)cc1 609387226 TXFVDRNZGFPOMN-SQNIBIBYSA-N 395.572 5.179 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1Oc1ccccc1 610218879 FRJKLUAGZJXSSR-OAHLLOKOSA-N 392.455 5.609 30 20 GKED CC(C)(C)OC(=O)Cc1cccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 610318891 RROFVQNSJXHJTM-UHFFFAOYSA-N 393.487 5.016 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(-c4ccccc4)ns3)cn2)c1 610424034 ULSIFLXUXCWJTO-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1)c1ccc(C#N)cc1F 610431446 PGLUYPBATZVAKE-UHFFFAOYSA-N 398.796 5.559 30 20 GKED C=CCn1c(S[C@H](C)c2cc(F)ccc2F)nnc1-c1ccc(OC)cc1 615346694 WPHGYTKFMWUHLA-CYBMUJFWSA-N 387.455 5.271 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)c1 619350905 PKVYXRIRZIIXDY-INIZCTEOSA-N 393.512 5.273 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1Br)c1ccccc1 619439291 VYACEKZBXZMNDN-FXAWDEMLSA-N 397.316 5.200 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(OCc2ccccc2OC)c1C 666456887 YYSDQYMUOCDLII-BGYRXZFFSA-N 392.499 5.298 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1CCC(F)(F)CC1 682732927 OCQYTDRMJUDMJV-FTYKPCCVSA-N 381.351 5.700 30 20 GKED Cc1ccc(NN=Cc2sc(Nc3ccc(C)c(Cl)c3)nc2Cl)nn1 729936057 DPALNVDGRQDKJM-UHFFFAOYSA-N 393.303 5.046 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 732903781 WPRURJCJQRFZRS-PXNSSMCTSA-N 390.508 5.264 30 20 GKED Cc1ccc(-c2nnc(S)n2N=Cc2ccc(-c3cccc(F)c3C)o2)cc1 734297910 YXDCJFWFJDPUCK-UHFFFAOYSA-N 392.459 5.132 30 20 GKED CC1(C)C(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)[C@@H]2CCCO[C@H]21 743429571 SRFWMYCOMFJZFF-KBXCAEBGSA-N 396.491 5.100 30 20 GKED CSc1ccc2c(c1)CC/C(=C\c1cc3cnn(C(C)C)c3nc1Cl)C2=O 748148656 VVMWYXHIPITJMN-RIYZIHGNSA-N 397.931 5.600 30 20 GKED N#C[C@H](C(=O)CC1CCCCCC1)C(=O)Nc1ccc(SC(F)F)cc1 750683973 KLCVIRJKGAMRJW-MRXNPFEDSA-N 380.460 5.009 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3cnc(C4CCC4)s3)cc2c1C 760263117 NFPAUHYHQYIHEY-VOTSOKGWSA-N 398.509 5.011 30 20 GKED O=C(/C=C/c1nc2ccc(F)cc2s1)c1ccc(Br)cc1F 761480778 TZFYDDCVEXRHEU-AATRIKPKSA-N 380.213 5.233 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@H](C)c3ccc(Br)cc3)[nH]c12 770542297 MOEXHAJVXNQSRV-XJKSGUPXSA-N 396.288 5.004 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCCc1cccc(-c2ccccc2)c1 780677354 FZRMMTADIKYWDN-GOSISDBHSA-N 385.467 5.009 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)OCCCC(C)(C)C#N 782071792 ASPCQVDZJSNTSE-UHFFFAOYSA-N 394.302 5.033 30 20 GKED CC1C/C(=C\c2scnc2C2CC2)C(=O)/C(=C/c2scnc2C2CC2)C1 782301149 KJYIJOGOPVUZQY-BVXMOGEKSA-N 382.554 5.820 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)ccc1F 790292150 MMLPYQBOWTUKJC-CYBMUJFWSA-N 395.286 5.236 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)CCc2cc(Br)ccc21 794956698 IWHNMPZFSQAOBE-JLHYYAGUSA-N 397.297 5.180 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC(c2cccc(Cl)c2)CC1 797642721 LJQWCWZSYIFUAI-OAHLLOKOSA-N 383.879 5.042 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)cc1 810160360 DSDCTULZWRBHOH-XCLFUZPHSA-N 375.299 5.525 30 20 GKED COc1cc(F)c(C(=O)/C=C/C(C)=C/c2ccccc2OC(F)F)cc1OC 811692065 BWEORHHYNKNIGC-PEGOPYGQSA-N 392.373 5.287 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1nc2ccc(Br)cc2s1 841893389 DOYBRJSQSCBPCG-MRXNPFEDSA-N 398.329 5.098 30 20 GKED Cc1ccc([C@@H]2C[C@H]2C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 850769150 IZXXFGMCGGCJOI-GVDBMIGSSA-N 379.410 5.028 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccnc(C(F)(F)F)c1 863178935 LDRUWMARZICMLM-UHFFFAOYSA-N 381.242 5.553 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 916850006 XTAGAICQGMBDBR-NRFANRHFSA-N 384.479 5.273 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2cccc3c2CCCC3)cs1 917553591 ZZSOQNZERHRWHI-UHFFFAOYSA-N 390.512 5.153 30 20 GKED O=C(O)c1cc(NN=C(CC2CC2)c2cccc(C(F)(F)F)c2)ccc1F 1776064444 OFPDSEPERKMRAN-UHFFFAOYSA-N 380.341 5.159 30 20 GKED C=C(C)C[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(CC)c1)C(=O)O 1776137615 CHOTWWKHULTIGO-IBGZPJMESA-N 391.870 5.343 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1c(F)ccc3sc(C(=O)O)cc13)CO2 1776374691 SRHWSZJYPCLKBW-JYRVWZFOSA-N 396.439 5.521 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)s2)cc1)c1ccccc1 1776469429 OFBAMIPLAVCONE-HVCHUGMYSA-N 378.449 5.482 30 20 GKED CCc1c(C(=O)/C=C/c2ccccc2OCCC(=O)O)oc2ccc(C)cc12 1776956116 DVYVLUMRTKMCEN-MDZDMXLPSA-N 378.424 5.053 30 20 GKED Cc1cccc2c1OC/C(=C\c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1777459750 KFUBVZDGDMGMHW-LFIBNONCSA-N 376.433 5.080 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)c(Cl)c1 1777673177 DQHKYUIMJJYQFB-UVTDQMKNSA-N 395.867 5.374 30 20 GKED Cc1nn(-c2ccc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)cc2)c(C)c1Cl 25438176 XNUAHALDOORIIB-UHFFFAOYSA-N 392.890 5.196 30 20 GKED Cc1ccccc1C(C)(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 58687176 QZGFJJADFGYSGU-UHFFFAOYSA-N 398.506 5.556 30 20 GKED C=CCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 64715284 ZUGMXUAFPLKNID-HNNXBMFYSA-N 396.418 5.143 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 78876997 GJSFAGISNKJMJW-QZTJIDSGSA-N 385.294 5.183 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCc1c[nH]c2ccccc12 108529836 IQCHZKNTXOQCJH-INIZCTEOSA-N 392.528 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cc(-c2ccccc2)on1 109029640 DBNNHRVDEFALQX-OAHLLOKOSA-N 392.484 5.058 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1cccc(OCCCC#N)c1 113570170 VSBPFGFHHIAVJF-INIZCTEOSA-N 394.500 5.265 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC[C@H]3CCC[C@H]32)cc1 120156495 SFGBCUFQFVEWPD-AUSIDOKSSA-N 389.499 5.128 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(OC2CCC2)cc1Cl 132117073 STFBIMZALWJBFU-UHFFFAOYSA-N 386.904 5.529 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 151167086 RWINATPLZWXUOE-GOSISDBHSA-N 392.499 5.056 30 20 GKED CC(C)C[C@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 174788303 JMJDPLZUYABBSU-HXUWFJFHSA-N 391.515 5.232 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(Cl)s1 175109506 IDVJEYOPXUYEAE-IUODEOHRSA-N 382.872 5.006 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1nc2ccccc2o1 176101331 QJQJROBBDMWXJA-INIZCTEOSA-N 387.826 5.397 30 20 GKED Cc1nc(C(F)(F)F)c(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)s1 183642593 VVTBBEIJBFTWFJ-NSHDSACASA-N 386.336 5.393 30 20 GKED CCC(C)(C)N/C(S)=C(/C(=O)c1ccccc1C)[n+]1ccc(C(C)(C)C)cc1 186977662 LJOLADWVZIXBQJ-UHFFFAOYSA-O 397.608 5.297 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(-c2cncnc2)cc1F 189896701 OHISENOVEQHVTR-UHFFFAOYSA-N 375.447 5.387 30 20 GKED Cc1csc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1Br 191412963 CPBGITHHHBLWKT-JTQLQIEISA-N 395.347 5.323 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)cc1 302949576 AFSNLPRBJZPEKM-UHFFFAOYSA-N 399.538 5.510 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c(C)n1C(C)C 303210563 QXOHTYWMFZHPSN-UHFFFAOYSA-N 387.483 5.389 30 20 GKED CCC1CCC(N(C)C(O)=Nc2ccc(NC(C)=O)cc2C(F)(F)F)CC1 330573985 GUXDCBFBNPBILI-UHFFFAOYSA-N 385.430 5.110 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 410198957 GTKFTJWGYGYYCN-IBGZPJMESA-N 395.915 5.687 30 20 GKED C=CCN(C)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 429419551 TUWSRDNONLNRNP-UHFFFAOYSA-N 380.467 5.381 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccnc(OC3CCCCC3)c2)s1 430610759 LYRACMVJBRBYTJ-MRXNPFEDSA-N 383.517 5.037 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1ccccc1 431312223 KAADULXEWRIZRN-AYOQOUSVSA-N 385.870 5.069 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 432076704 DNGCRVMDJKDNCJ-ZVZYQTTQSA-N 399.947 5.802 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N(CC)C[C@@H](C)C#N 435527729 SWSIMAAQRKRUKC-LBPRGKRZSA-N 394.302 5.223 30 20 GKED CC(C)(C#N)CCCCSCc1nc(O)c2c(-c3ccco3)csc2n1 435884283 PXVVAZJTAOAARK-UHFFFAOYSA-N 387.530 5.610 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccc(F)c(F)c1 437458812 KNFFLTWFGNOVFX-CYBMUJFWSA-N 396.368 5.510 30 20 GKED N#Cc1ccc(NC(=O)N[C@H]2CCSc3ccc(F)cc32)cc1C(F)(F)F 438641384 MBTKOKVZOMUVDF-HNNXBMFYSA-N 395.381 5.075 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc([C@H]3CCC(F)(F)C3)no2)cc1 439570137 LKHSBZBQMRAEHF-ZDUSSCGKSA-N 385.345 5.442 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c1 442671677 HESARFWZNYVOHU-KRWDZBQOSA-N 395.409 5.266 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 448896409 QLOZRCPBHYWAOF-KRWDZBQOSA-N 390.405 5.363 30 20 GKED COc1ccc(-c2nnc(S[C@@H]3CC[C@H](C#N)C3)n2C2CCCCC2)cc1 450651251 LGGIMJFXRARPRX-HNAYVOBHSA-N 382.533 5.243 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)c(Cl)c1 452641927 GUMLPEWCHQIMLG-LSDHHAIUSA-N 378.781 5.167 30 20 GKED Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 454759405 LPGGJYGHZUEVRV-JXFKEZNVSA-N 397.519 5.897 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)s1 460336601 CQNUYQCDTVSADM-UHFFFAOYSA-N 394.883 5.323 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 463502685 FDEAQRDKICDGQP-UHFFFAOYSA-N 396.218 5.024 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1)Cc1cccc(F)c1 469003042 QQBBVNXNZZVQTM-KPZWWZAWSA-N 379.262 5.082 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](C)C(=O)c1ccc(Cl)cc1 476793734 DVFJWQXYSGQLSX-MRXNPFEDSA-N 383.919 6.040 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F 477590757 SVHGRZQBFUQKGQ-SWLSCSKDSA-N 387.471 5.427 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccnc1-c1ccccc1 477599766 SZZKEPJBOPKGIQ-UHFFFAOYSA-N 389.503 5.136 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C(C)(C)Oc1ccc(C#N)cc1 482803281 XLXAXGIIWHYVTL-SFHVURJKSA-N 391.515 5.042 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(OCC(F)(F)F)c1C 485372744 LLZFYNOABQVAFQ-UHFFFAOYSA-N 384.442 5.536 30 20 GKED Cc1ccnc2sc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c(C)c12 489861171 YHNDBKGGBYYJFA-HNNXBMFYSA-N 389.505 5.527 30 20 GKED N#CCCCn1cc(C(=O)N2CC[C@H](c3cccc(Cl)c3)C2)c2ccccc21 497005507 YRJFRBFMTBUDMM-SFHVURJKSA-N 391.902 5.228 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2cc(Cl)ccc2F)nc2ccccc21 501409883 FCILSWOXTIYVJH-LBPRGKRZSA-N 389.883 5.134 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4c(s3)CCC4)c2)cc1 501426768 ROUNBVOADRVXLY-UHFFFAOYSA-N 388.492 5.134 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cnccc2Oc2ccccc2)s1 502755351 FUBXHJLXQPIWPE-OAHLLOKOSA-N 377.469 5.118 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1Cl 503641153 FJBIEWDREWNALO-UHFFFAOYSA-N 395.890 5.320 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCc2c(Cl)cccc2Cl)cc1 506266226 BFWSWCVIUKRTEI-UHFFFAOYSA-N 376.287 5.159 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 507605251 MZSANLPFDYGUPX-CQSZACIVSA-N 394.290 5.660 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1c[nH]c2ccccc12 508379663 BVSCYGDYAFLFEZ-UHFFFAOYSA-N 396.450 5.107 30 20 GKED Cc1oc(C2CC2)nc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 511895414 WJOMWSLWGDUMRV-UHFFFAOYSA-N 395.406 5.137 30 20 GKED C=CC[C@@H](C)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 512744973 ULVNZEPKNJIIQA-LLVKDONJSA-N 383.344 5.475 30 20 GKED O=C(Nc1ccc(NCCC(F)(F)F)c(C(F)(F)F)c1)c1ccccc1F 514821539 BNLHFHSXRLPTQD-UHFFFAOYSA-N 394.290 5.461 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c(C)s1 515101357 UPIZZKDHQBBLOP-ZDUSSCGKSA-N 396.541 5.167 30 20 GKED COc1ccc(Oc2cc(CNc3ccc(C#N)c(C(F)(F)F)c3)ccn2)cc1 518298091 BDKHTJGOEQBOCH-UHFFFAOYSA-N 399.372 5.385 30 20 GKED Cc1cccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 519450843 KXPBEAIHBLBBLH-QGZVFWFLSA-N 381.545 5.346 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N[C@H](c3ccccc3)C3CCC3)o2)cc1 520532461 VZPNAPQKJFYBFK-HSZRJFAPSA-N 386.451 5.001 30 20 GKED CC(C)(c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1)C(F)(F)F 520720155 UGMJWXZTDJJMKB-CQSZACIVSA-N 388.414 5.626 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)CC/C=C/c3ccccc3)c2)c1 523102159 UTXAFVNUAHVQSE-ONNFQVAWSA-N 395.462 5.243 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1nc2ccccc2s1 524076529 BQTAGVPNXYVUOH-GFCCVEGCSA-N 395.896 5.563 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 530622438 UJVIXLQUWFBPDH-UHFFFAOYSA-N 383.234 5.910 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(CC#N)cc2)cc1Cl)c1ccccc1 533907986 XDNYDSZTQVAOPB-INIZCTEOSA-N 389.886 5.831 30 20 GKED C=CCC[C@@H](N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21)c1ccccc1 539396658 MCZUDVCFVVYIMF-DHIUTWEWSA-N 376.544 5.272 30 20 GKED C=CCCCc1nc(-c2ccccc2-c2ccc(CN3CCCC3=O)cc2)no1 546320461 JWXFVJHRKZKESC-UHFFFAOYSA-N 387.483 5.035 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](C)c1ccc2ccccc2c1 553115910 HRZNVOQKACBPFK-IBGZPJMESA-N 375.516 5.326 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN1CCCC[C@@H]1c1ccccc1 571013603 WGOWCGZKSMHRCV-GHTZIAJQSA-N 393.556 5.104 30 20 GKED Cc1ccc([C@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)cc1 581076672 AAGHTWHCZOFCGN-NRFANRHFSA-N 381.401 5.160 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C(C)C)cc1 583398240 IHHKAQHKXIRAEG-HRAATJIYSA-N 397.544 5.608 30 20 GKED Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)CCCCCC#N)c1C 588930356 XRZXMIDWXHIJGT-UHFFFAOYSA-N 379.291 5.209 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@@H]3CCCC[C@@H]32)cc1Cl 596692240 ZTSXNHQASVYWDJ-SCWSEQNSSA-N 379.891 5.402 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c1 602756428 SKAIUZAEZHMKDL-SNVBAGLBSA-N 376.934 5.372 30 20 GKED COc1ccc(Cl)cc1CC(=O)Nc1sc(-c2ccccc2)cc1C#N 603968005 GMXMVRMRINUBNZ-UHFFFAOYSA-N 382.872 5.130 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1 607113992 JNPITEXBPVZTIP-UHFFFAOYSA-N 385.552 5.124 30 20 GKED Cc1ccc(-c2csc(NC(=O)c3cc4ccccc4n3CC#N)n2)c(C)c1 609200658 TXKLUABHIRFQRF-UHFFFAOYSA-N 386.480 5.158 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc4ncccc4c3)cc2)cc1 609504173 WEOZXVMVIPACNR-UHFFFAOYSA-N 379.419 5.345 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCS[C@H](c4ccccc4)C3)c2)cc1 609991823 VJKKSOKFOMFCBB-QHCPKHFHSA-N 399.519 5.232 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1C[C@H]1Cc1ccccc1 610187207 ZMZPUYQZIGRRTH-CTNGQTDRSA-N 384.504 5.070 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1cccc(C#N)c1 610322820 KYHNBTDGFQPHEN-CQSZACIVSA-N 392.846 5.282 30 20 GKED O=C(Cc1ccc(Cl)c(F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 619126821 NVNLURYBTDGKLY-UHFFFAOYSA-N 393.730 5.191 30 20 GKED CC(C)[C@@H](C)N1Cc2cccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2C1 727705690 XBWCNASWEZKKLI-CQSZACIVSA-N 398.963 5.381 30 20 GKED C#Cc1cccc(N(C(=O)c2sc(-c3ccc(OC)cc3)nc2C)C(C)C)c1 728247442 DMMXQMJFYSNLKN-UHFFFAOYSA-N 390.508 5.164 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2/CCOc3c(ccc(Cl)c3Cl)C2=O)cc1 728697867 YIUFTCQNNDBBNU-GVIGZQTCSA-N 388.250 5.333 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2ccccc2)C2CCC2)cc1 729552357 FPQSMSMOQORWDG-JWQCQUIFSA-N 395.506 6.005 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 730689257 CLJNKPMKBLEXCC-CZUORRHYSA-N 398.915 5.403 30 20 GKED N#CCCN(C(=O)CCC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccccc1 731224032 QGCJTASYYGQUSI-UHFFFAOYSA-N 397.478 5.019 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(C(F)(F)F)nc2O)c(C)n1C1CCCCC1 731564682 OXEOZDZHNBSJNL-CSKARUKUSA-N 392.421 5.626 30 20 GKED O=C(/C=C\c1cccc(Oc2ccccc2)c1)c1ccc(C(F)(F)F)nc1O 731564805 UCWPOWSRZJOWPO-LUAWRHEFSA-N 385.341 5.494 30 20 GKED CC(C)c1ocnc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 731901835 FQRBWEOCGBECII-KRWDZBQOSA-N 379.847 5.359 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 732878633 SBJBNNKAHWFBJP-DQEYMECFSA-N 395.506 5.923 30 20 GKED O=C1/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)CSc2ccc(F)cc21 733083189 DRXPXXAYELOXLU-WUXMJOGZSA-N 398.440 5.229 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2ccccc2Cl)c1 733804318 BPHCBBJNDZGYRP-UWJYYQICSA-N 397.906 5.068 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(-c3cccc(N)c3)no2)c1 734976301 RMUQGLVMOYNKCE-UHFFFAOYSA-N 388.814 5.303 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)cc1C#N 741843028 XMXCFAUTIUOJQO-GXDHUFHOSA-N 390.439 5.042 30 20 GKED C/C(=C/C(=O)Nc1nc(C)c(SCC#N)s1)c1cccc(C(F)(F)F)c1 742608691 BJSITTKCFDOUJP-NTMALXAHSA-N 397.447 5.128 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c1 743028832 VFJHTCQAMXEDAA-OAHLLOKOSA-N 395.528 5.063 30 20 GKED CCC(CC)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)SC 743092874 FSAVBWKPAPSNGQ-FQEVSTJZSA-N 381.545 5.385 30 20 GKED CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743097374 VAEOAQCKPQXKIA-SXSPYAJSSA-N 375.516 5.775 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC(Cc3ccccc3)C2)cc1 752638525 YGYMADAZCRVRLX-DEOSSOPVSA-N 381.479 5.048 30 20 GKED C#CC[C@@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1 757616731 FZUXUMOKOIHMER-HXUWFJFHSA-N 376.843 5.022 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1)c1ccccc1 759051887 SFKMQVPZKUHSLO-GOSISDBHSA-N 380.488 5.010 30 20 GKED COc1cc(/C=C\C(=O)c2cc(Br)ccc2F)ccc1SC 763122661 TXWGYFSRJNUBCD-CLTKARDFSA-N 381.266 5.215 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(SC(F)F)cc2)c2ccccc21 767396841 VOCFENBMSPGXLT-UHFFFAOYSA-N 385.439 5.512 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCCCC(C)(C)C#N 782461977 HBIRQENSICIYNM-UHFFFAOYSA-N 386.495 5.626 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 792587609 DFVSYPMIRLTMPV-IVXJCAOYSA-N 376.500 5.264 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1coc(C(C)C)n1 799474036 UUFCZCNCMIPUEB-UHFFFAOYSA-N 395.463 5.445 30 20 GKED CCCCCC(CCCCC)NC(=O)N1CCC(C#N)(c2ccccn2)CC1 799969291 MYORPVXSMHCXEL-UHFFFAOYSA-N 384.568 5.178 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2CCC(F)(F)CC2)cc1 800518989 ICLUZPFNDZKLKW-HXUWFJFHSA-N 383.442 5.289 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ncc(C(C)(C)C)o3)n2)cc1 805855253 JAZGLPNHTORZBS-INIZCTEOSA-N 393.512 5.213 30 20 GKED O=C(O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)[C@@H]1CCC(F)(F)C1 809126164 HKJZPZQXLQCENI-MWLCHTKSSA-N 376.243 5.287 30 20 GKED C=CC[C@H]1N(C(=O)c2ccc(N(C)C(=O)OC(C)(C)C)s2)CCCC1(C)C 811460951 CLFGWZUBFOUUMW-MRXNPFEDSA-N 392.565 5.326 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2oc3ccccc3c2Br)c1 848536776 VIJSZORHGLWREH-OAHLLOKOSA-N 399.288 5.166 30 20 GKED C=CCCC[C@H](C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1 883979051 ARTMEBGAHTVPLJ-HNNXBMFYSA-N 393.371 5.470 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccncc2)cc1 915352436 IIDZKDRCUQHFJR-PKTZIBPZSA-N 382.467 5.106 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 916627881 BOFUEFXWDBZQSK-IBGZPJMESA-N 392.549 5.786 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1 920014149 RVAIEBRHCVJFRG-PDGQHHTCSA-N 392.455 5.337 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3ccc(C)c(C)c3)cs2)cc1 920062933 HRQQXGDUUFHTCM-WDZFZDKYSA-N 379.481 5.244 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4ccccc4)CCC3)n2)cc1 920142837 MQKPRWLJCFQWEV-IBGZPJMESA-N 388.492 5.117 30 20 GKED O=C(Nc1cccc(/C=C2/Cc3c(F)cccc3C2=O)c1)c1ccccc1Cl 921264028 NTQHEYRMGNYUNR-PTNGSMBKSA-N 391.829 5.554 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(-c2c(F)cccc2F)cc1 1776075575 PQGQOROXBVQPOO-UHFFFAOYSA-N 384.357 5.305 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C(F)(F)F)s1 1776354417 GLFJCQFEQLAJGS-XQRVVYSFSA-N 384.375 5.148 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)cc1)c1ccccc1 1776469441 RJVMBOFEZFBFMK-WPMUKRGUSA-N 390.410 5.560 30 20 GKED CC1(C)C/C(=C/c2c(F)ccc3sc(C(=O)O)cc23)C(=O)c2ccccc21 1776526657 MTLXXURHQGVLBX-XFXZXTDPSA-N 380.440 5.686 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-n2cc(Cl)cn2)cc1C 1776782794 KKOFMZXOZMULKK-LJQANCHMSA-N 391.943 5.128 30 20 GKED CCCCCOc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776794034 BJIGTGBMNICLNE-XDJHFCHBSA-N 378.468 5.556 30 20 GKED C[C@H](c1ccccc1Cl)N(C)/C(O)=N/c1nnc(-c2ccsc2)s1 52496256 AQUWOUNZMBSIRP-SNVBAGLBSA-N 378.910 5.159 30 20 GKED C#CC[C@H](OC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccccn1 68594987 AWGQUXKJEYRDPM-FQEVSTJZSA-N 394.521 5.060 30 20 GKED CC(C)CC[C@@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 71944537 BRVQLTTZDBBPGF-GOSISDBHSA-N 379.504 5.278 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2)c1 78719949 DKXVKNBERDDNGU-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#C[C@@H](C(=O)CCCCCc1cccs1)c1nc(-c2ccncc2)cs1 114621150 GLJYYYMLJBGAQJ-KRWDZBQOSA-N 381.526 5.246 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccccc1 159984000 REUAMDPOVCMFHW-SFHVURJKSA-N 383.542 5.332 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1 175131568 ZHAUKSRAZQPSQM-UHFFFAOYSA-N 391.446 5.020 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(CCC(F)(F)F)CC1CC1 175997777 IDAGNQRHBPMUPA-CYBMUJFWSA-N 385.455 5.277 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1 187131249 GAYZXGREBRCWST-HNNXBMFYSA-N 385.558 5.411 30 20 GKED C=C(C)[C@H](NCc1coc(-c2ccc(F)c(F)c2)n1)c1ccc(F)c(F)c1 187760879 BDXVVLOMKCZPPD-IBGZPJMESA-N 376.353 5.305 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(-c2csc(C)n2)c1 189871842 CUCXPYPDCAEJPP-UHFFFAOYSA-N 376.525 6.223 30 20 GKED CC(C)Oc1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)c(C(F)(F)F)c1 236718744 JGTLBGGXCMFLQC-OAHLLOKOSA-N 392.421 5.073 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Br)cc1F 303337965 KXEGXKAPQRPIBR-GFCCVEGCSA-N 379.298 5.595 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 303453147 DEOISRPVLHBCDY-MBSDFSHPSA-N 395.572 5.206 30 20 GKED Cc1cc2c(cc1C)O[C@H](C(O)=Nc1ccccc1-c1ncc3n1CCCC3)C2 329109531 PWTUETKCRPYEHT-QFIPXVFZSA-N 387.483 5.095 30 20 GKED C[C@@H]1C[C@@H](C(O)=Nc2ccc(Cl)c(/C(O)=N/C3CCCCC3)c2)CC(O)=N1 329350674 TUQVBVKHTMDGLZ-CHWSQXEVSA-N 391.899 5.320 30 20 GKED CC(C)c1scnc1N=C(O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1 329590264 YJBMAUBHXIADDS-CYBMUJFWSA-N 390.578 5.027 30 20 GKED Cc1csc(Sc2c(Cl)cccc2N=C(O)[C@H]2C[C@@]23CCOC3)n1 329659374 NTFSVUPEROPUFM-PIGZYNQJSA-N 380.922 5.271 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)c3ccc(C(C)(C)C#N)cc3)CC2)n1 332432131 FSCKSOJEHNJBSV-UHFFFAOYSA-N 395.572 5.262 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1N1CCCCCC1)c1ccccc1 432690350 PNHLXVDLZGVECD-NRFANRHFSA-N 390.531 5.624 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 433000265 OKEJQERYTSTXJF-KRWDZBQOSA-N 375.394 5.571 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(Sc2ccccn2)cc1 436358631 GKWJQDAKLLTZBX-YADHBBJMSA-N 399.519 5.145 30 20 GKED N#Cc1ccc(NC(=O)CCCc2nc3ccccc3s2)cc1C(F)(F)F 443884205 XNKGFZCDPPLACT-UHFFFAOYSA-N 389.402 5.148 30 20 GKED CCCn1ncc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C1CC1 454761486 NAPQEVPCDWXNDN-CQSZACIVSA-N 383.521 5.209 30 20 GKED CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 458670837 XOVSHALTQPQDFS-CZAAIQMYSA-N 399.922 5.150 30 20 GKED Cc1ccc(C[C@@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458804121 SBXVKLGFXLCUSK-XZOQPEGZSA-N 375.516 5.147 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1cccs1)C(C)(C)CO 459521401 HJFYRSLVGVUPTN-HXUWFJFHSA-N 386.561 5.481 30 20 GKED C=CCn1c(SCCC(C)(C)C#N)nc2scc(-c3ccccc3)c2c1=O 463026580 AFDIARYCMWGBHD-UHFFFAOYSA-N 395.553 5.343 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1Cl)C1CCCC1)c1ccc(C#N)cc1 465651212 CYMDSGBBXDGZAZ-MRXNPFEDSA-N 381.907 5.427 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccc2)ns1)c1c(Cl)cccc1Cl 469048321 OZEJFZXGDXHLGM-HNNXBMFYSA-N 388.279 5.112 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cc(F)ccc3OC(F)F)c2)cc1 470121177 JNFPNLMOJLIXPD-UHFFFAOYSA-N 398.340 5.343 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(C)n(-c2ccc(Cl)c(Cl)c2)n1 471165944 SIXQDMNZRMJPOP-UHFFFAOYSA-N 393.318 5.032 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(C(=O)N(CC)CC)CCCCC1 475581565 GWJSDXUQRBYRTM-UHFFFAOYSA-N 399.579 5.231 30 20 GKED N#Cc1c(F)cccc1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 477694635 PZYNUBUBDLLCEP-UHFFFAOYSA-N 391.349 5.092 30 20 GKED CC(C)(C)c1csc(CNC(=O)c2ccccc2Oc2ccccc2C#N)n1 480593740 DVWHBQNOPCQDPO-UHFFFAOYSA-N 391.496 5.035 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2ccco2)C1 481210581 WFSHZFWKJJFXHH-LRDDRELGSA-N 377.366 5.175 30 20 GKED N#Cc1cc2c(nc1NC(=O)c1cc(-c3ccccc3)ccc1Cl)CCCC2 484150963 ZCHUGNFJWUIKBO-UHFFFAOYSA-N 387.870 5.405 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 488632481 UXRSAUVSXCGRQG-JOCHJYFZSA-N 397.478 5.743 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1cccc(C)c1Cl 489297276 TWWRODIPDJBJHB-UHFFFAOYSA-N 391.858 5.197 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)CCCc1ccccc1 496308576 KHRGFIWLYVLAGT-GOSISDBHSA-N 380.557 5.926 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F 497813530 SHAMSDBUABOKOG-IAGOWNOFSA-N 380.419 5.307 30 20 GKED Cc1sc(NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(C)C)c(C#N)c1C 498279324 YYYJASITSCGSLX-UHFFFAOYSA-N 398.919 5.451 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(F)cc1 499489209 ZZWKNXLRKIBCON-NWDGAFQWSA-N 396.409 5.074 30 20 GKED N#Cc1cccc(C(=O)N(Cc2ccc(F)cc2)c2nc3ccccc3s2)c1 501772722 VTRKXTRJSHNLDZ-UHFFFAOYSA-N 387.439 5.154 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1c(Cl)cccc1Cl 505481349 RJKAHIONQFGHBV-NRUUGDAUSA-N 379.209 5.043 30 20 GKED Oc1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)nc2cc(C(F)(F)F)ccc12 509073927 FDOKJEXWAXHQAE-ZDUSSCGKSA-N 390.258 5.432 30 20 GKED COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ccccc2C#N)cc1 511821606 LZNLYVQAXZANAJ-UHFFFAOYSA-N 395.462 5.286 30 20 GKED COc1c(C)ccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c1C 513136075 RZKYZELFWKHLQU-UHFFFAOYSA-N 386.451 5.015 30 20 GKED C[C@H](N[C@@H](C)c1ccccc1-n1ccnn1)c1ccc(-c2cccc(C#N)c2)cc1 517765783 IEURJNALZAKFSM-OALUTQOASA-N 393.494 5.218 30 20 GKED COc1ccccc1C1(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 518728719 RJDRTZRMJIGKFR-UHFFFAOYSA-N 384.435 5.029 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 521260300 AZWFGEQSSUKVNC-WMZOPIPTSA-N 381.545 5.780 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 524200449 PMWJJNTUASMJBX-GOSISDBHSA-N 375.394 5.290 30 20 GKED N#CCCCOc1cccnc1NC(=O)c1cc2sc3ccccc3c2s1 524275265 UYAOMKOAGNDOBU-UHFFFAOYSA-N 393.493 5.446 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 531309458 VPAPKFOPDNQNAT-UHFFFAOYSA-N 399.237 5.008 30 20 GKED C[C@H]1CN(c2ccccc2NC2CCC(C#N)(c3ccccc3)CC2)C[C@@H](C)O1 535840961 OSQLLGOAOMWXIJ-WZCXXNLUSA-N 389.543 5.116 30 20 GKED C=CCCC[C@H](C)NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F 540540129 RTRRLOLVIIWMFS-LBPRGKRZSA-N 385.817 5.019 30 20 GKED CC[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc(F)cc(Br)c1 540606737 OCJKCQFIJNQXRO-MOPGFXCFSA-N 375.285 5.674 30 20 GKED COc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1OC1CCCC1 543152474 TUWOTMSJJSTTJW-UHFFFAOYSA-N 378.472 5.070 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-c3cccc4cccnc34)cc2)n1 552073247 WQQILIKAAVMALW-FQEVSTJZSA-N 397.503 5.972 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc3cccc(Br)c23)n1 552076318 HAHPXUGLKJCJKV-CQSZACIVSA-N 399.313 5.672 30 20 GKED C=CCN(C(=O)c1ccn(C)c1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 558033426 NYAVJLOCDBTEHS-UHFFFAOYSA-N 392.311 5.288 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2cccnc2)cc1 573163326 DXXJYNCFOQOESP-UHFFFAOYSA-N 399.903 5.809 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cccc(Br)c3)cc2)ccn1 577327839 JJIUEMLVBLLXTE-UHFFFAOYSA-N 380.245 5.120 30 20 GKED N#Cc1cccc(C2(N[C@@H]3CCCc4nc(-c5ccccc5F)sc43)CC2)c1 582501953 MCJAZGIMEZXRSB-HXUWFJFHSA-N 389.499 5.477 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N(Cc1ccco1)c1ccccc1C#N 582568001 KQESTZYMNAJVJL-SFHVURJKSA-N 395.462 5.111 30 20 GKED N#Cc1cc(F)cc(C2(c3nc(CSc4ccc(Cl)cc4)no3)CC2)c1 589081298 PQVSMXUAMCFCTK-UHFFFAOYSA-N 385.851 5.106 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(OCC(F)F)cc3)cc2)ccn1 589323680 QIPDKDBPNFWUOM-UHFFFAOYSA-N 381.382 5.002 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cccc(C#N)n2)cc1Cl)c1ccccc1 589335468 BEKNFTUDKZVEJC-CQSZACIVSA-N 376.847 5.032 30 20 GKED CCc1nccn1[C@H](C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 592755799 ZGYKJFAVYYPEEM-QGZVFWFLSA-N 388.471 5.008 30 20 GKED C[C@@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(O[C@H](C)c2ccccc2)cc1 595640856 VOUZZFHVWKDYCL-IWQHBPENSA-N 391.515 5.269 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N3CCc4c(CC#N)cccc4C3)c2)o1 599787111 SDRWYJHGCIXHCA-UHFFFAOYSA-N 385.467 5.220 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccsc3)cn2)c1 603691329 CDFIPUCFKMUJBD-IBGZPJMESA-N 390.468 5.176 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccc(Cl)c1 609438055 AJUBNLZDLRQKPP-WMLDXEAASA-N 387.936 6.007 30 20 GKED CCN(C(=O)c1cccc(-c2nc(C)cs2)c1)[C@H](C)c1ccc(C#N)cc1 610038790 HPASXOUYSWSONK-MRXNPFEDSA-N 375.497 5.214 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1)c1cccc(C#N)c1 610406698 JDSJIVNJBHOYRF-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)cc2ccccc21 610655095 SHQMGYDLASSRRR-KSAKKHMLSA-N 383.495 5.263 30 20 GKED C[C@H](N[C@@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1)c1cccc(C#N)c1 610914554 DLPGQJKGCTUWNC-XGHQBKJUSA-N 382.479 5.057 30 20 GKED CCOc1ccc([C@@H](NCc2cc(C#N)cs2)c2cccc(Cl)c2)cc1 611039266 KDFGJMROUDOQRS-OAQYLSRUSA-N 382.916 5.551 30 20 GKED N#CCC[C@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccccc1 611186795 KCFYMNIMIUCOQC-INIZCTEOSA-N 397.450 5.523 30 20 GKED N#Cc1ccccc1CN[C@H](CC(F)(F)F)c1ccc(Br)cc1 612539111 RAQYMCTYZNIOHB-MRXNPFEDSA-N 383.211 5.104 30 20 GKED Cc1ccccc1-n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1C 613392519 XGWXJWMFNLSEAQ-SFHVURJKSA-N 398.491 5.103 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1csc(COc2ccc(C)cc2)n1 615456693 SGHVFALYPGCDBS-UHFFFAOYSA-N 394.540 5.227 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 618758576 VNTTYADJGKTQKB-XMMPIXPASA-N 397.478 5.255 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(C(F)F)nc1)c1ccc(C(F)(F)F)cc1 657929988 HUIZVVCPQINGOQ-DYVFJYSZSA-N 384.392 6.396 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)C1 666081301 OMBANPRLSWDFRK-INIZCTEOSA-N 397.906 5.412 30 20 GKED CCC1(C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCC(F)(F)CC1 667004156 KTDHPMFLBCHQGH-GHMZBOCLSA-N 395.334 5.181 30 20 GKED CC(F)(F)c1cccc(NC(=O)N2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c1 682055332 JGWSCNNJEWPRIZ-PHIMTYICSA-N 390.274 5.003 30 20 GKED CCCn1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc2ccccc21 682497927 KIDPQEGLFLBJKR-HNNXBMFYSA-N 377.444 5.290 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(SC(F)F)c1 727597097 YMWDXFPODDNIFO-UHFFFAOYSA-N 393.415 5.130 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cnc(-c2ccccc2)nc1 727781936 ZVQNYMVKKAQNHM-SEYXRHQNSA-N 383.476 5.472 30 20 GKED C[C@H](NC(=O)NCCSCc1ccccc1C#N)c1csc2ccccc12 730021081 HABSGDPZAYHHCC-HNNXBMFYSA-N 395.553 5.067 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1nc2ccccc2s1 734210404 KKRHQKPUKNWIAO-KGLIPLIRSA-N 396.541 5.573 30 20 GKED C=CCN(CCc1ccccc1)C(=S)Nc1ccc(OC(F)F)c(Cl)c1 735622726 FBPMDSTVTDSUQC-UHFFFAOYSA-N 396.890 5.369 30 20 GKED N#CC1(C(=O)Oc2cccc(OCc3cccc(C(F)(F)F)c3)c2)CCCC1 741962964 LMWFGCVNYBAFSW-UHFFFAOYSA-N 389.373 5.274 30 20 GKED Cc1csc(COC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 744313232 XZJAWIWCXVVCGY-UHFFFAOYSA-N 384.844 5.126 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCOc2cccc(Cl)c2Cl)n1 747193701 NNMZJXWCZAZSOC-GFCCVEGCSA-N 397.327 5.609 30 20 GKED CC(C)[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(C(F)(F)F)cc1 747928180 HEBJDGIFPZUTLZ-OAQYLSRUSA-N 389.465 5.542 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cc(Cl)ccc2OC(F)F)cc1 748440499 LPDUSTUORFJOHF-LDJOOVGUSA-N 377.774 5.128 30 20 GKED CC(C)c1sc(NC(=O)c2ccc(C#N)c(Cl)n2)nc1-c1ccccc1 753002109 LFAKQQRQBJCJMW-UHFFFAOYSA-N 382.876 5.106 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1c(-c2ccccc2)nc2ccccn12 754713134 ZVKDVTUFXZOTOM-UHFFFAOYSA-N 381.357 5.433 30 20 GKED N#Cc1cc(F)c(C(=O)O[C@H]2CCCc3nc(-c4ccccc4)sc32)c(F)c1 755343633 CZXKWYQSXQVHRA-KRWDZBQOSA-N 396.418 5.194 30 20 GKED FC(F)(F)c1ccc2sc(NN=Cc3cnc([C@@H]4CCCO4)s3)nc2c1 755751438 XWWKBQGDOMMWJS-LBPRGKRZSA-N 398.435 5.069 30 20 GKED C[C@H](N[C@@H](C)c1cc(F)cc(F)c1O)c1ccc(-c2cccc(C#N)c2)cc1 757659983 XJLUOSLENWBVMC-GJZGRUSLSA-N 378.422 5.621 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(OCC(F)(F)F)c(F)c1 758014687 BSRCZEZNKDFNCZ-ALCCZGGFSA-N 384.373 5.057 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccccc2-c2nnc(C)o2)s1 764397202 VYVGZCQHFCILDG-UHFFFAOYSA-N 399.520 5.052 30 20 GKED CC(C)(C#N)CCCCOC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1 768458589 WIBMOWINXGJBQB-JOCHJYFZSA-N 389.499 5.257 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1nc2ccccc2s1 770843711 VFUMFOACUQLUDW-HNNXBMFYSA-N 388.414 5.514 30 20 GKED CCCCCC[C@]1(C)NC(=O)N(c2ccc([C@@H](C#N)c3ccccc3)cc2)C1=O 771903033 HNBJIXSGLKZROE-URXFXBBRSA-N 389.499 5.127 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccccc2F)CC1)c1nc2cc(Cl)ccc2s1 785880502 MMCDNIQHDZFSTB-AWEZNQCLSA-N 384.863 5.288 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@@H](F)C(F)(F)F)c(C(F)(F)F)c1 788126219 GRDNAFLBYNXGNZ-WRWORJQWSA-N 377.325 5.435 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(OC(C)C)c(Cl)c2)c1 793539915 KPBJHYUEXPAHPC-QFBILLFUSA-N 386.923 5.659 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H]2CCOc3c2ccc(Cl)c3Cl)cc1 793962845 XXIZZOJHWDKZOA-INIZCTEOSA-N 389.282 5.048 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)s1 797571153 MDJVWCTXQSCICH-AWEZNQCLSA-N 392.446 5.367 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)COc2c(Cl)cccc2Cl)s1 797571707 VBRTZXKPMQHPPX-SNVBAGLBSA-N 383.300 5.003 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3CC(c4ccccc4)C3)n2)cc1 798819718 HUYWIKIIZJJEGJ-JITJBCMDSA-N 397.503 5.442 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2 808730459 HEBBNPRUBYCXRC-UHFFFAOYSA-N 392.330 5.022 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813217224 DHWFMOQRGDFEMF-SUMWQHHRSA-N 390.405 5.042 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(SC(F)F)c1)c1ccccc1 814629781 FVKGANMNJHITMM-QGZVFWFLSA-N 375.444 5.558 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 817324848 QTZRMYHRXWGTGX-FQEVSTJZSA-N 393.487 5.199 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccccc1 836557768 HKJSPCWJQQLVCK-TZYHBYERSA-N 388.515 5.232 30 20 GKED COc1ccc([C@@H]2C[C@H]2C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 850762747 NFXVHEQQVTVOKQ-ZCNNSNEGSA-N 388.492 5.107 30 20 GKED COc1ccc(C)cc1CCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354133 VYSSMIJMMMUHDB-HSZRJFAPSA-N 399.494 5.023 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2csc3c2CCCC3)cc1 916947614 ORJAVQDMDKLAAH-RDTXWAMCSA-N 380.513 5.102 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917025485 LUVBBNGXUTYSBC-YOEHRIQHSA-N 396.899 5.416 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCC(C3CCCCC3)CC2)o1 917338385 FTZUJPUDLXVODA-UHFFFAOYSA-N 392.499 5.163 30 20 GKED CCCCCCCCC(=O)Nc1cccc(-c2nnc3n2CCCCC3)c1C 917677781 WSEWNTHJDWVVIH-UHFFFAOYSA-N 382.552 5.669 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 919773342 FGTRKWIHRHPFHV-OXQOHEQNSA-N 375.497 5.595 30 20 GKED O=C(O)c1cc2ccccc2c(C=NN=C2c3ccccc3-c3ccccc32)c1O 1776027982 WALZNBCJUBZSHE-UHFFFAOYSA-N 392.414 5.096 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(O)c(C(=O)O)c2)cc1)c1ccccc1 1776469416 KWXNAIPMJLBBER-DJXGBFBFSA-N 388.419 5.127 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(CC#N)cc1 8126385 OOGHOOGCZBRJIA-UHFFFAOYSA-N 392.462 5.166 30 20 GKED C=CCn1c(SCc2nnc(-c3ccccc3Cl)o2)nc2ccccc21 12046124 JJQFBVKPDWDOKI-UHFFFAOYSA-N 382.876 5.218 30 20 GKED Cc1nc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)sc1SCC#N 44789673 XAEPDKLNGPHHSL-UHFFFAOYSA-N 389.502 5.187 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nnc1-c1ccco1 46415652 ZQKYFXMSYUPJHB-UHFFFAOYSA-N 382.876 5.218 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(C2SCCCS2)cc1 56212711 NKIIRBXDGYHEDW-UHFFFAOYSA-N 398.553 5.466 30 20 GKED C[C@@H](SCc1ccc(C#N)cc1)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 58453105 KKUHMMUYZBRTOK-GFCCVEGCSA-N 393.493 5.111 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1 66801572 SZUDBNYLKXGKNA-AWEZNQCLSA-N 396.903 5.172 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1cc(Cl)ccc1Cl 108354629 LFSXXKVANUMQID-GFCCVEGCSA-N 394.327 5.296 30 20 GKED CN(C)c1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1Cl 108885864 PMPROOFBRCBXLF-UHFFFAOYSA-N 375.859 5.197 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cnc(-c3ccc(C)cc3)s2)c1 115618503 CHAWQGBSLQHCFS-IBGZPJMESA-N 377.513 5.089 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)cc1C(F)(F)F 129561807 YPKLGLRARGKWOZ-AWEZNQCLSA-N 397.265 5.407 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 131948369 GFISSKZQWRDMOQ-KDOFPFPSSA-N 375.394 5.111 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(NC(=O)OC(C)(C)C)c(C)c2)cc1 151375474 ZHMNXKRXXFWFAH-UHFFFAOYSA-N 393.487 5.211 30 20 GKED C#CCCOc1ccc(CN[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1 153345286 ZLXLQVXILBWZOO-QHCPKHFHSA-N 376.887 5.016 30 20 GKED CC(C)Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 153383972 AEFANUCWLJGPNK-FQEVSTJZSA-N 389.524 5.213 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ncoc1-c1ccccc1Cl 172997534 IFJPIGQWQBTOIO-ZDUSSCGKSA-N 397.887 5.499 30 20 GKED Cc1nnc([C@H](C)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)o1 174271007 BJRVDTMFAHFHRK-NSHDSACASA-N 388.349 5.234 30 20 GKED CC[C@@H](C)Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 175119698 NJLRPCDBAYPGDD-CZUORRHYSA-N 383.398 5.099 30 20 GKED CN(C)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2F)c(C(F)(F)F)c1 175600779 FAVXSIPMODBAHB-UHFFFAOYSA-N 394.290 5.182 30 20 GKED CC(C)Oc1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)c(C(F)(F)F)c1 181658152 HBJUZLMSXIQDDS-OAHLLOKOSA-N 392.421 5.246 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@@H]2NCc1cc(C#N)cs1 189913230 DQSMKMFCHDJGEU-IBGZPJMESA-N 383.517 5.134 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(OCc2ccccc2F)CC1 301911701 CMPDYANSFMQLMJ-UHFFFAOYSA-N 395.865 5.085 30 20 GKED CCc1c(C(=O)/C=C/c2csc(N(CC)C(C)=O)n2)oc2ccc(C)cc12 302908902 HTRABISWSPEUCK-CMDGGOBGSA-N 382.485 5.029 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)cc1 303146621 FKFYLENTUBUAOG-UHFFFAOYSA-N 383.382 5.290 30 20 GKED C[C@@H](/N=C(/O)CC1CCCCC1)C(O)=Nc1ccccc1N1C[C@H]2CC[C@H]1C2 328668811 DVGLTFXJPDOCRY-NEWSRXKRSA-N 383.536 5.579 30 20 GKED O=C1CC[C@H](/C(O)=N/C2(c3ccc(Cl)cc3)CCOCC2)c2ccccc21 328874821 RUGJEHRJJNBWNZ-IBGZPJMESA-N 383.875 5.063 30 20 GKED COc1c(N=C(O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc(Cl)cc1C(=O)N(C)C 329150355 RMHWIHPNVAWXNC-RBSFLKMASA-N 392.927 5.245 30 20 GKED C=CCCc1ccccc1NC(=O)c1cnn(-c2ccccc2C)c1C(F)(F)F 410366676 QUTUUQRBOHOWJT-UHFFFAOYSA-N 399.416 5.570 30 20 GKED N#CCCC[C@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccccc1 411762632 WTBLCKUPLIBOBK-IBGZPJMESA-N 389.421 5.059 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1ccccc1 431316911 XSYFWFDOHSTWAS-FFZOFVMBSA-N 385.870 5.069 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCC[C@H](c1ccccc1)C(F)(F)F 432461652 ISEFJQMMMFPKAQ-QGZVFWFLSA-N 382.451 5.182 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@@H](CC(F)(F)F)C1 433743985 FEMXBMPVVLAFCU-QMMMGPOBSA-N 393.249 5.139 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)c1C 437981120 BFQLZDYOFBPGDV-GOSISDBHSA-N 385.414 5.146 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1OC(F)F 438640151 FSSMRWMDEAQNFA-SNVBAGLBSA-N 399.319 5.061 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(Cc2ccccc2)no1 439572682 NVSGKZJKFVEZFP-KRWDZBQOSA-N 396.450 5.497 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(Cl)c(Cl)cc1F 439967890 PLEHLSOZCFWVIA-SCLBCKFNSA-N 392.261 5.436 30 20 GKED COc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1SC 459393873 GHBLRJHINHBQSC-ZDUSSCGKSA-N 387.530 5.455 30 20 GKED C[C@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cncc(F)c1 459621111 MKVCWNPKNUFKRG-ZJUUUORDSA-N 380.307 5.670 30 20 GKED Cc1c(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)sc2c1CCCC2 465111375 MQEOAPGMXWPSOC-UHFFFAOYSA-N 392.480 5.231 30 20 GKED CN(C(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccc2cc[nH]c2c1 473583353 QKAMVNHPMRIZMB-UHFFFAOYSA-N 397.503 5.608 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 474420825 HPTDEBBLNJVZGH-LJQANCHMSA-N 398.466 5.357 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 475579590 WEINAPCJMLHXRT-LJQANCHMSA-N 399.538 6.483 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1sc(C)c(CC)c1C#N 483460803 LQVMXCHTPADICY-UHFFFAOYSA-N 399.903 5.614 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 487573546 JOFWHAZREGNZFX-QHCPKHFHSA-N 397.478 5.104 30 20 GKED CCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 489163424 QNIXKCUPTAHXIU-LJQANCHMSA-N 382.891 5.141 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)s1 490480238 NHYOJVXWNXZNQP-AWEZNQCLSA-N 393.468 5.157 30 20 GKED O=C(N[C@H](c1ccccc1OC(F)F)C(F)(F)F)c1cccc(C(F)F)c1 493371738 WDODJSYBPGHCGD-CYBMUJFWSA-N 395.274 5.259 30 20 GKED COc1cc(Cl)cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 496028427 LZGATWSLYCZYCQ-KRWDZBQOSA-N 382.872 5.271 30 20 GKED COCc1cccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c1 499151473 RHYQJUSFEPOMHX-INIZCTEOSA-N 382.529 5.169 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCc3ccccc3C2)cc1 499552704 FGECATKGLINNAL-UHFFFAOYSA-N 383.451 5.331 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C(C)C 499860263 MAWOGHLLTYIUAP-UHFFFAOYSA-N 393.413 5.197 30 20 GKED C=CCN(C(=O)CCc1cccc(F)c1F)c1nc(-c2ccccc2)cs1 504387515 IJSYZSBCFGNRBY-UHFFFAOYSA-N 384.451 5.240 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)Cc2csc(-c3cccs3)n2)cc1 505809137 MCVARJRBCHBZGH-KRWDZBQOSA-N 395.553 5.093 30 20 GKED C[C@H](NC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F)c1ccc(C#N)cc1 506846138 TVPGLQIPFZGSSH-NSHDSACASA-N 397.784 5.035 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@@H](C)c2nc(C(C)(C)C)no2)cc1 507826779 BUHIECJYBIKVOV-AWEZNQCLSA-N 392.459 5.213 30 20 GKED Cc1oc(C(C)C)nc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 513634160 WYPDJZVSABTVEP-AWEZNQCLSA-N 385.876 5.373 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1 518710264 UWXDVZOFBAMDOC-ABAIWWIYSA-N 397.689 5.104 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccc(O)cc2)Cc2ccco2)c1 520603640 TXTBYXISAMEIGF-UHFFFAOYSA-N 392.455 5.174 30 20 GKED N#Cc1ccc(CC(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)cc1 522316272 LQVRTUALRIIPJQ-UHFFFAOYSA-N 379.419 5.080 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1nc(-c2ccco2)c(-c2ccco2)s1 533050346 WPMLVYFVBDFMNA-UHFFFAOYSA-N 375.409 5.096 30 20 GKED C[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)c1ccc(C#N)cc1 533564688 XOZOCTOZQWKEME-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C=CCCOCCCCC(=O)N1Cc2cc(OC)ccc2C[C@H]1c1ccccc1 539391798 UULHSXRZOLZCPV-DEOSSOPVSA-N 393.527 5.084 30 20 GKED CC[C@H](C)Oc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccn1 540777393 PSUSOVKVUCHDLE-FZMZJTMJSA-N 385.876 5.012 30 20 GKED C=CCn1c(SCc2ccc(C(C)C)nc2C)nnc1-c1ccccc1OC 549010150 SEMWFTUDDIZPKB-UHFFFAOYSA-N 394.544 5.259 30 20 GKED C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1 554122355 BZAYYRQVXHGMAT-HNNXBMFYSA-N 388.433 5.210 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccccc2OC(F)F)cc1 560974527 PTZPFTCRPQVJFU-UHFFFAOYSA-N 398.340 5.343 30 20 GKED C[C@H]1CN(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCC1(F)F 576388379 UKRCIASDIGNKJK-QMMMGPOBSA-N 390.274 5.233 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)CC2)cc1 583700587 NBAVJMBIYYOUEF-WOJBJXKFSA-N 398.428 5.061 30 20 GKED Cc1ocnc1-c1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 584390027 VYHYCXIOAVISID-UHFFFAOYSA-N 378.775 5.017 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)sc1-c1ccc(F)cc1 588348333 JGOFYUCJJSKUTJ-OAHLLOKOSA-N 392.480 5.962 30 20 GKED COCC[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 594947521 APHYGNZYHZALFQ-HXUWFJFHSA-N 388.433 5.128 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CN1CCC[C@@H](CC#N)C1 595622797 DHZUVCXKIPOGCW-AWEZNQCLSA-N 379.451 5.263 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N1CCc2c(CC#N)cccc2C1 599750159 FNMYWBBXSBUWBX-UHFFFAOYSA-N 393.556 5.293 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cccc(OCc2cccs2)c1 603618665 CCLVHAAZGDAOOH-UHFFFAOYSA-N 390.508 5.250 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N[C@H](c1ccccc1)C(F)(F)F 604621479 BMKWQYLMGFFPKD-CYBMUJFWSA-N 380.263 5.270 30 20 GKED CCCN(C(=O)c1cccc(Br)c1)c1cc(Cl)ccc1C#N 609286279 RKCWMWNFERIICG-UHFFFAOYSA-N 377.669 5.031 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1cccc(Cl)c1Cl 609796503 WIXOFCPCEKFDMG-AWEZNQCLSA-N 391.298 5.292 30 20 GKED C[C@H](NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1cccc(C#N)c1 610364596 SDAULVGHQIBDAO-AOMKIAJQSA-N 390.483 5.408 30 20 GKED C=CCC[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 610932698 VBBXJFPNNSFTJB-HXUWFJFHSA-N 379.485 5.515 30 20 GKED N#CCCn1cc(/C=C/c2nc([C@@H]3CCc4ccccc43)no2)c2ccccc21 612933233 OSJWBDSGDPFMGL-ZOXUKVPXSA-N 380.451 5.186 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618745257 HHQIUHVTUSPINR-OAQYLSRUSA-N 399.450 5.168 30 20 GKED CSC[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 618805302 NKQWCNZZTIPBDO-RTBURBONSA-N 376.447 5.258 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618848456 UQWPBOBQEKNFDU-ZSDSOXJFSA-N 381.907 5.033 30 20 GKED O=C(NC[C@H]1CCCCC1(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 661255489 IHNCJZSKCXZHJL-SNVBAGLBSA-N 398.338 5.165 30 20 GKED CC(C)[C@H](C(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1 677301346 WBHMWVPEGJMRKP-YDHLFZDLSA-N 399.350 5.155 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711447 YDOXDAXRXRYNBG-UHFFFAOYSA-N 377.787 5.039 30 20 GKED C#Cc1cccc(N(C(=S)Nc2cc(OCC)ccc2OCC)C(C)C)c1 728226591 GFDKXRNVTZUAAI-UHFFFAOYSA-N 382.529 5.077 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(SCc3csc(C)n3)cc2)c1 728480645 HGWVYIHEYNZFDZ-UHFFFAOYSA-N 392.549 5.392 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H](C)c1csc2ccccc12 732918573 OLPOKPKVCHHLFO-JKSUJKDBSA-N 384.570 5.217 30 20 GKED CCCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@@H](CC)c1ccccc1 733805056 MZLYNWSLOFDADA-GMAHTHKFSA-N 393.531 5.440 30 20 GKED O=C(/C=C/c1ccc(O)c(Br)c1)c1cccc(-c2ccncc2)c1 741473472 QLYUNEPKBMPFDL-GQCTYLIASA-N 380.241 5.113 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)/C=C/c2ccccc2C#N)cc1 741639897 IVMQJOYQEIECPB-ZPICJPFVSA-N 382.463 5.124 30 20 GKED N#Cc1c(Cl)nsc1NCc1ccc(Oc2ccccc2F)c(F)c1 742416711 CVRGJMBZJGQRKZ-UHFFFAOYSA-N 377.803 5.351 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1)c1cccc(C(F)(F)F)c1 744159472 CTWWADYSFQALMS-OVHOFWQVSA-N 383.373 5.170 30 20 GKED CCCN(CCC)c1ccc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)cc1 745625653 CNXMZUIIBQXLJO-RAXLEYEMSA-N 392.499 5.166 30 20 GKED C#CCOc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1OCC 745989908 GKXHJJSKYCDBIZ-VZUCSPMQSA-N 383.447 5.055 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2cccc(-c3ccccn3)c2)SC1=S 747698110 ICHPDGNKHWAIHN-DEDYPNTBSA-N 399.500 5.026 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccc(F)cc2)CC1 752678015 LRLPEOYEHNQUSD-MRXNPFEDSA-N 397.519 5.489 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)cc1C=NOc1ccccc1C(F)(F)F 755815742 KACAHQAMNKXFAW-UHFFFAOYSA-N 379.769 5.266 30 20 GKED C#CCN(Cc1csc(N(C(C)=O)c2ccc(C)cc2C)n1)C1CCCCC1 756500440 HXCFLUJFYPTEKK-UHFFFAOYSA-N 395.572 5.212 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccc[nH]1 760756200 MUGWGXFMWNAPQH-CYBMUJFWSA-N 380.835 5.215 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2n1C 766836971 GJQKHGYKPQIKJA-WONIAPNHSA-N 384.266 5.160 30 20 GKED C=C(C)C[C@@H](C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 767048599 YPVPYMMAUSJYPC-GCJKJVERSA-N 389.543 5.084 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 767697320 BSLURMXUSPPDBM-CYBMUJFWSA-N 392.908 5.127 30 20 GKED N#C[C@@H](C(=O)CN(Cc1ccccc1)c1ccccc1)c1nc2ccccc2s1 772636214 DZTIXRDFEPCIMT-FQEVSTJZSA-N 397.503 5.179 30 20 GKED N#CCc1ccc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)cc1 783886626 XTFGSMAQVHDSBJ-UHFFFAOYSA-N 389.958 5.675 30 20 GKED C#CCC1(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)CCCCC1 788433458 XIDRLPXSPQOURH-UHFFFAOYSA-N 389.499 5.551 30 20 GKED Cc1cc(N[C@@H]2CCCCc3cc(C#N)ccc32)ccc1OC1CCOCC1 795809648 NNHRZQUDXMXHRV-HSZRJFAPSA-N 376.500 5.304 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801853532 RXDRZPXOOVIQGB-AWEZNQCLSA-N 394.290 5.329 30 20 GKED N#CC1(CSc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)CCCC1 806584671 PDSVYHPWZPNRLM-UHFFFAOYSA-N 392.503 5.309 30 20 GKED O=C(/C=C/c1csc(-c2ccc3c(c2)OCO3)n1)c1c(F)cccc1Cl 809159348 NRBUUSNENLUHEC-AATRIKPKSA-N 387.819 5.227 30 20 GKED C#CCCc1noc(-c2c(-c3c(Cl)cccc3Cl)noc2C(C)C)n1 809396550 MCMZZZIOZULZNL-UHFFFAOYSA-N 376.243 5.388 30 20 GKED Cn1cc(/C=C2/CC(C)(C)c3ccc(Br)cc3C2=O)c(C(F)F)n1 812241201 ABAZKDDXIDHNHL-POHAHGRESA-N 395.247 5.068 30 20 GKED N#C[C@H]1CCC[C@H](OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 839045296 AALAHVJAJRZQBR-JSGCOSHPSA-N 393.270 5.207 30 20 GKED CCc1nc(C)c(C(C)=NNc2ccc(-c3ccc(Cl)s3)nn2)s1 848415780 YHFRRRFCQCNSTG-UHFFFAOYSA-N 377.926 5.022 30 20 GKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)c(Br)cc1F 858168718 CSALUCLQJSLANE-IBGZPJMESA-N 375.285 5.421 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1ccc(C#N)c(Cl)c1 862718449 KPFZUXIZJBKETO-UHFFFAOYSA-N 385.851 5.119 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 918548226 QBJHYTHMTDVXRR-IERDGZPVSA-N 375.497 5.156 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CC/C1=C\c1csc(-c2ccsc2)n1 920065693 GQGVECDXBYSURF-UYSZGSBFSA-N 394.477 5.610 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(OCC2CCC2)c1 1776355482 RJHIMCXLRYDHJE-PKNBQFBNSA-N 394.467 5.247 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(OC(F)(F)C(=O)O)cc1)CC2 1776374814 UFFOALFMAIWPPX-GZTJUZNOSA-N 386.394 5.079 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](C(=O)O)C2CCCCCC2)cc1 1776786301 NMROWOIFDCXZMA-QHCPKHFHSA-N 389.580 5.797 30 20 GKED CCc1c(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)oc2ccccc12 1776956195 JMWWAFHXIUBBSQ-VQHVLOKHSA-N 376.433 5.804 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(C)(C)CC)CC1 1829070479 JDZYMUXCQIMHSF-HXUWFJFHSA-N 390.612 5.035 30 20 GKED COc1ccc(-c2nc(CSc3nc(C)cc(C)c3C#N)cs2)c(OC)c1 36729255 AXHIUEWXFCMDMS-UHFFFAOYSA-N 397.525 5.003 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1nc2ccccc2o1 41544970 MFWSZFCPIKJTSR-GCJKJVERSA-N 384.460 5.538 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1ccc(C(F)(F)F)cn1 41554758 OJXHBHSXDYHKLY-ZDUSSCGKSA-N 390.748 5.504 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c(F)cccc1Cl 49723992 RKKDPWSZBLRKRZ-UHFFFAOYSA-N 381.794 5.099 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 64456477 QHOHLKWXIUHZHU-UHFFFAOYSA-N 377.252 5.341 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3sc4c(c3C#N)CCC4)o2)c(C)c1 64680082 VLFLNGALBCFCFF-UHFFFAOYSA-N 392.480 5.150 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccn(-c2cccc(Cl)c2)n1 66802161 WZMLOEZMRIEPJS-CQSZACIVSA-N 396.903 5.172 30 20 GKED CCCOCc1ccccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 66955730 XOINUHUSAVXWDK-QGZVFWFLSA-N 397.544 5.329 30 20 GKED N#Cc1c(NC(=O)CCSc2cccc(Cl)c2)sc2c1CCCC2 72076764 UWUIBORLXFQEBK-UHFFFAOYSA-N 376.934 5.273 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 110308245 FFLDOTWXLIZEIR-CVEARBPZSA-N 390.430 5.453 30 20 GKED N#CC1CCN(C(=O)NCc2ccccc2-c2ccc(Cl)cc2Cl)CC1 120084230 BJQZZKWKBDNGNL-UHFFFAOYSA-N 388.298 5.106 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122020455 SGWNBOVYHLRILS-OXQOHEQNSA-N 389.524 5.699 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)c1 131931825 KFSMGBLGBLDBIV-NRFANRHFSA-N 393.446 5.052 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1c(F)cccc1F 153463101 XSQBTXFFZSBVDW-MWLCHTKSSA-N 376.815 5.208 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2c(C)cccc2C(C)C)cc1C#N 154540203 INCSQTUVESMEND-UHFFFAOYSA-N 380.448 5.203 30 20 GKED CCC(CC)n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1C 156384555 HYPHHNMKCIOKPG-KRWDZBQOSA-N 378.501 5.166 30 20 GKED CC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1nc(C(F)(F)F)cs1 173732370 BZEJQTAOWOKUPF-ZDUSSCGKSA-N 396.438 5.236 30 20 GKED CC(C)[C@H](NC(=O)CNc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 178388693 PNLPMOIQFZMVIX-ZHRRBRCNSA-N 399.535 5.003 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SC[C@@H](C#N)CCC#N)n2)o1 181152290 MNRMCBWHMKIJFC-GFCCVEGCSA-N 390.390 5.076 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 182941223 OCEIOLYEJSKUEW-LJQANCHMSA-N 396.475 5.066 30 20 GKED N#C[C@@H](C(=O)c1cc(Br)cs1)c1nc(-c2ccccc2)cs1 194589938 UQHCVIWIJMRWDC-LBPRGKRZSA-N 389.299 5.124 30 20 GKED CC(C)c1ccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2cccs2)cc1 236800396 SKNSPSYJZKPUCU-MHECFPHRSA-N 390.552 6.042 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(C)ccc2O)cs1 255036965 PLJMSCORRQQOII-XFFZJAGNSA-N 392.480 5.046 30 20 GKED C/C(O)=N/C1(c2noc([C@@H]3C[C@H]3c3cccc4ccccc34)n2)CCCCC1 329239617 QLTNPGRHENRHTP-VQTJNVASSA-N 375.472 5.630 30 20 GKED OC1=Nc2cc(N=C(O)N3C[C@H](c4ccccc4)[C@@H]4CCCC[C@@H]43)ccc2CC1 330147932 UJMFDJZSAYXHPO-VWPQPMDRSA-N 389.499 5.425 30 20 GKED C[C@@H]1CCCC[C@@H]1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 409796085 RQVWAFLECXJALJ-UYAOXDASSA-N 391.515 5.279 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1SCCc2ccccc21 428886762 KZFBUVAUVPFCFL-MGPUTAFESA-N 397.569 5.233 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccn2)cc1 438190566 ODJPCVAEGZLJLC-VXKWHMMOSA-N 398.466 5.178 30 20 GKED N#CCC[C@H](NC(=O)N1CCc2cc(Cl)cc(Cl)c2C1)c1ccccc1 438841598 ZUMMGZSVCMXHIP-IBGZPJMESA-N 388.298 5.106 30 20 GKED CC(C)[C@@H](c1ccccc1Cl)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 441391867 AABPCLNBNSHGGZ-FQEVSTJZSA-N 380.879 5.091 30 20 GKED C=CC[C@@H]1N(Cc2nnc(-c3c(-c4ccccc4)noc3C)o2)CCCC1(C)C 444779717 LERXUZOYPMGSFE-SFHVURJKSA-N 392.503 5.267 30 20 GKED C=CCC1(C(=O)N2CCC(c3nc(-c4ccncc4)cs3)CC2)CCCC1 449857762 SAZGFURZQYIHTQ-UHFFFAOYSA-N 381.545 5.048 30 20 GKED C=CCC[C@H](NC(=O)N1CC[C@@H](OCC)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 454706461 KAXSTBTWQVFEAT-AYOQOUSVSA-N 398.469 5.169 30 20 GKED Cc1cccc([C@H]2CCCCN2C(=O)Nc2ncccc2OCCCC#N)c1C 466613467 FLTBURITVMHXTD-HXUWFJFHSA-N 392.503 5.140 30 20 GKED C=C(C)C[C@H](C)C(=O)NC[C@]1(C)C[C@@H](NC(=O)[C@H](C)CC(=C)C)CC(C)(C)C1 467950429 VBMDXLMIXPOVDY-CMCWBKRRSA-N 390.612 5.008 30 20 GKED CCCn1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 470565232 QYFRQJQIBDFMDA-MRXNPFEDSA-N 398.919 5.177 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(OCc3ccccc3)cc2)n1 474420449 FLUWZUAZANOBOO-IBGZPJMESA-N 376.481 5.336 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2SCc2cscn2)n1 474450910 XYWZAUWUEGHIFS-HNNXBMFYSA-N 399.566 5.505 30 20 GKED CC[C@H](C)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 480939330 IQRHOFNYYBBLFO-LRDDRELGSA-N 398.919 5.430 30 20 GKED Cc1c([C@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)cnn1-c1ccc(F)cc1 481659075 ILCKXILDERXCGQ-UPCLLVRISA-N 388.490 5.310 30 20 GKED CN(C(=O)Cc1ccc(C#N)cc1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482812268 XHVTZLJWNXHJJK-HSZRJFAPSA-N 392.861 5.141 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1 483322657 ICHLSJXAUMEALU-FQEVSTJZSA-N 398.940 5.271 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@@H]2CCCc3sc(C)nc32)C(C)(C)C)cc1 485680372 FMOQMMKSEGOITG-LJQANCHMSA-N 398.572 5.264 30 20 GKED CSc1ccc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)o1 485996985 GSQULKCGNFMXPT-UHFFFAOYSA-N 380.444 5.168 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(Oc2cccc(Br)c2)cc1 486994623 HKTSJUDLOKRCFC-UHFFFAOYSA-N 393.240 5.365 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 497808894 KOQPAYDUQGWSHW-GOSISDBHSA-N 380.513 5.062 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c1 510841882 NEJDGZAQAZHPNU-UHFFFAOYSA-N 396.277 5.729 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(COc2ccc(F)cc2)o1 517441157 OKAHZWCZPSAQPD-UHFFFAOYSA-N 396.443 5.256 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1c(F)cccc1F 517533614 YGUZVBORUIHPDL-UONOGXRCSA-N 389.471 5.584 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(COC2CCCCC2)c1 521448317 PWJJRVNBEJKSAX-UHFFFAOYSA-N 378.516 5.756 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 521787967 YSJAHPHQOBBLCH-QFIPXVFZSA-N 395.934 5.531 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(COc2ccccc2C#N)c1 524512587 ZNTNOJYEFNFKPD-NTKDMRAZSA-N 396.490 5.155 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@H]1c1ccccc1OC(F)(F)F 524938048 KNFNNEXECROHJF-IRXDYDNUSA-N 393.380 5.043 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)c1nnc(-c2ccc(Cl)cc2Cl)o1 531559708 UNKUDRQTHKOHRR-JTQLQIEISA-N 376.268 5.768 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 536973731 WSDUWWBXYSGRSB-NRFANRHFSA-N 378.516 5.294 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 536973732 WSDUWWBXYSGRSB-OAQYLSRUSA-N 378.516 5.294 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1csc(-c2cccc3ccccc23)n1 540854649 FMHQLAZAHOHUSP-UHFFFAOYSA-N 385.448 5.096 30 20 GKED COc1ccc([C@@H](NCCC(C)(C)C#N)c2ccc(C(F)(F)F)cc2)cc1 540915728 IJSIXXLNINXWHC-IBGZPJMESA-N 376.422 5.333 30 20 GKED C=C(C)[C@@H](Cc1nc(-c2ccnc(Oc3ccccc3Cl)c2)no1)OCC 544841580 UZXDZZQGNKOUQG-QGZVFWFLSA-N 385.851 5.101 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 546004080 IJHRQLMAYWGEKR-UHFFFAOYSA-N 398.418 5.144 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)C(F)(F)F 548169359 NQJBMSQXYKEXGI-LJQANCHMSA-N 389.421 5.029 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N(CCC#N)c1ccc(F)cc1 553943868 AJMPHSNSQMKHKX-ZDUSSCGKSA-N 379.262 5.258 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 569397524 OWCMUEJMUNMRJG-MRXNPFEDSA-N 378.476 5.036 30 20 GKED CC(=O)c1ccc(C#N)c(N2CCc3nc(-c4ccccc4Cl)sc3C2)c1 571797990 NWQASJKHCYBVTN-UHFFFAOYSA-N 393.899 5.100 30 20 GKED N#CCCN(C(=O)CCCc1cccc(C(F)(F)F)c1)c1ccc(F)cc1 573894040 OCUJEULPZVSNGZ-UHFFFAOYSA-N 378.369 5.114 30 20 GKED N#CCC1(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)CC1 574705540 WOWLVOVLMYSVPK-JQIJEIRASA-N 399.519 5.207 30 20 GKED N#CC[C@H](CC(=O)N(c1ccccc1)c1nc2ccccc2s1)c1ccccc1 577810708 QPLGCFOVLQGOJV-LJQANCHMSA-N 397.503 6.049 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 588157919 QNFXYBHXRPDKLP-UHFFFAOYSA-N 377.366 5.305 30 20 GKED CCOc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1OCC 590104161 RJCYWCXIDUTKHH-IBGZPJMESA-N 381.476 5.041 30 20 GKED Cc1nnc(N(CCC(C)C)C(=O)CC2(C#N)CCCCC2)c2ccccc12 598824884 QXNXYDLIXHYHFM-UHFFFAOYSA-N 378.520 5.182 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)s1 603673452 ZNRFXWADHIERBD-LJQANCHMSA-N 380.900 5.926 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)CCc3ccc(C#N)cc3)cc2)c1 609033330 SIXSGRHGZCWHTB-FQEVSTJZSA-N 398.506 5.256 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1CCCC[C@H]1C 609078724 KRUCOMDZOHKSGG-IERDGZPVSA-N 377.488 5.146 30 20 GKED CC(C)Oc1ccccc1CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176551 QJJYGZIMODJPOP-UHFFFAOYSA-N 386.451 5.319 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2Cc2ccccc2)c1 609496398 RXNQCSMEJJOWNN-UHFFFAOYSA-N 384.479 5.337 30 20 GKED C[C@H](C#N)CNC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 609524304 GCUNPXXTCTYQMG-GFCCVEGCSA-N 379.312 5.175 30 20 GKED C=CCN(Cc1csc(-c2ccc(OC)cc2OC)n1)Cc1ccccc1F 615463642 CWNWIEZVLDSKJE-UHFFFAOYSA-N 398.503 5.155 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)NCC#Cc2cccc(C(F)(F)F)c2)c(C)c1 615641185 OYPPAHGPLOZGER-QGZVFWFLSA-N 388.433 5.076 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cnc2ccc(F)cc2c1 619125578 SQEMUTZXZJFQOD-UHFFFAOYSA-N 396.306 5.157 30 20 GKED N#Cc1ccc(CN(C(=O)/C=C\c2cccc(OC3CCCC3)c2)C2CC2)cc1 727664609 WSSYLKAYVYMFLG-QINSGFPZSA-N 386.495 5.084 30 20 GKED N#C[C@H](C(=O)CCc1cccc(OC2CCCC2)c1)c1nc2ccccc2s1 727952667 PANFBPYMAVPWCL-LJQANCHMSA-N 390.508 5.427 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cc(Cl)c(N)c(Cl)c3)c2)cc1 728517524 RQWDONJVSWJGKD-UHFFFAOYSA-N 398.249 5.492 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cccnc2Cl)CC3)cc1 728699118 RWCRJKVHTHZSLF-ACCUITESSA-N 382.872 5.080 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)[C@@H](C)Oc1ccc(C#N)cc1 733070406 CSEHGKLEHUFKMO-HZPDHXFCSA-N 392.480 5.062 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 734966022 STNKLRBEWSHIOC-CZUORRHYSA-N 389.282 5.143 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)n1cccc1 735207180 OVGHWEQFHLVIFW-VKGHLNKFSA-N 393.556 5.240 30 20 GKED CC[C@H](c1ccccc1)c1nnc(SCc2cc(Cl)ccc2OCC#N)o1 735233163 JNLBKJZURSPVRU-QGZVFWFLSA-N 399.903 5.460 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)CCSc1ccc(Cl)cc1 735334898 VCTMZBIWHOXLQT-UHFFFAOYSA-N 396.295 5.121 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 735625961 KTNLCZHPMWZMNZ-UHFFFAOYSA-N 380.300 5.461 30 20 GKED CC(C)(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccc(F)c1 739590517 KAIIPNUNIBZQDI-UHFFFAOYSA-N 378.472 5.020 30 20 GKED C[C@@H](C#N)CN(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 746155089 CSCGPAGAJMIVDF-INIZCTEOSA-N 382.463 5.165 30 20 GKED C[C@H](OC(=O)/C=C\c1ccccc1C#N)c1ccc(NC(=O)c2ccccc2)cc1 748015420 SRYGWIHERYTQEZ-ZUTYSQTGSA-N 396.446 5.128 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3cc(CC#N)ccn3)c3ccccc3n2)c(C)c1 764206295 QMGXSISNVFVYAK-UHFFFAOYSA-N 392.462 5.232 30 20 GKED N#C[C@H](COC(=O)c1ccc(Oc2ccccc2Cl)nc1)Cc1cccs1 772737520 RFOLFUDIGPFRHU-CQSZACIVSA-N 398.871 5.128 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cccc(OC(F)(F)F)c2)c1 772984832 QZQIIAZSAVGOSV-RHSMWYFYSA-N 378.394 5.117 30 20 GKED CCOc1c(Cl)cc(C=NO[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1OC 778591093 SVPBOGRDTNFOLV-ZDUSSCGKSA-N 392.839 5.076 30 20 GKED N#C[C@H](C(=O)CCCCC(=O)c1ccc(F)cc1)c1nc2cc(F)ccc2s1 778637091 WCBFUQFODKKBJD-MRXNPFEDSA-N 398.434 5.194 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)CCO1 780167563 WCIVYNYHGLRPDZ-NZQKXSOJSA-N 391.511 5.025 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ncc2Cl)cc1 780347169 XHQRKYMRJWLTDA-KRWDZBQOSA-N 382.250 5.296 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F 780682854 YSDZNDRNBAQXMJ-IFXJQAMLSA-N 385.414 5.015 30 20 GKED C[C@@H](OC(=O)CC(C)(C)C#N)c1nc2cc(Cl)ccc2n1Cc1ccccc1 785091264 SRHCIWDZTTXYMW-OAHLLOKOSA-N 395.890 5.282 30 20 GKED Cn1ccc2cccc(NC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c21 788284869 KRYMMOSLBPZTEU-NRFANRHFSA-N 380.451 5.478 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)[C@H](F)CC1CCCCC1 793021448 OQYOUZHOXXDJRZ-YRGRVCCFSA-N 391.371 5.321 30 20 GKED N#CC[C@@H](CC(=O)OCc1csc(CCc2ccccc2)n1)c1ccccc1 795990199 JQFMNBKLHXBJSY-FQEVSTJZSA-N 390.508 5.059 30 20 GKED Cc1cc(CNCc2ccc(C#N)c(Cl)c2)cc(C)c1OCc1ccccn1 800895327 BVZSZFZYOWTWCN-UHFFFAOYSA-N 391.902 5.092 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCCC[C@@H]3[C@@H]3CCOC3)nc2c1 814860133 LMNTWFPWMPTVET-DGCLKSJQSA-N 383.439 5.310 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N[C@H](CCCC#N)c3ccccc3)sc21 817320047 WHSNZYBBSLFXCH-LJQANCHMSA-N 387.508 5.558 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)C(=O)c2sccc2Br)cc1 845846571 HWNGXQJJHSGYTG-FZMZJTMJSA-N 390.302 5.229 30 20 GKED CCC(C#N)(CC)C(=O)N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1 861949029 FIABCBIJHJXMMM-UHFFFAOYSA-N 399.535 5.070 30 20 GKED CCCc1sc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1CC 916916564 WFKUBVNACSUKHR-SFHVURJKSA-N 390.508 5.377 30 20 GKED O=C(O)c1cc(Cl)sc1C=NNc1c(Cl)cc(Cl)cc1Cl 1776014726 UAFOFOPANWLHPS-UHFFFAOYSA-N 384.071 5.506 30 20 GKED CCOc1ccc(C(CC)=NNc2ccc(Cl)c(C(=O)O)c2)cc1OCC 1776033306 BOKQOMXTHXMAHH-UHFFFAOYSA-N 390.867 5.062 30 20 GKED O=C(O)c1cc(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)ccc1F 1776063047 YGCXOBLOEMBKLZ-GFCCVEGCSA-N 380.341 5.278 30 20 GKED Cc1cc(NN=Cc2cccc(O[C@H](C(=O)O)c3ccccc3)c2)ccc1Cl 1776105336 ZGUHJVHZNKEWBF-NRFANRHFSA-N 394.858 5.299 30 20 GKED CC(/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1)=C/c1cc(F)cc(F)c1 1776398809 KDUWDEPTXSXFNJ-AEKZSSLNSA-N 394.373 5.765 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1)C(=O)O 1776469869 WSRRDLBCBAJFBH-YIEQYZEGSA-N 396.439 5.302 30 20 GKED CC1(C)Sc2ccccc2C(=O)/C1=C\c1csc2ccc(C(=O)O)cc12 1776573005 KCCLBEKRNIBBRD-MHWRWJLKSA-N 380.490 5.750 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C/c1ccc(-c2cccc(C(=O)O)c2)s1 1777038346 HTKOMKIMZNCQQM-JXMROGBWSA-N 395.455 5.215 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/C=C/c2ccc(OCc3ccccc3)cc2)c1 1777684949 RWOJAAKQBXMKGW-WICBUYNWSA-N 384.431 5.416 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)CCC=C(C)C)CCC2)cc1 1791730649 OTKXFBCHGRIECX-UHFFFAOYSA-N 380.532 5.061 30 20 GKED C=CCN(Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1)Cc1cccs1 29704449 AJIJDXABWAKNHO-UHFFFAOYSA-N 397.565 5.078 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1[N+](=O)[O-] 46443575 YFUQAEDYZBFWRA-OAHLLOKOSA-N 397.843 5.170 30 20 GKED C=CCc1cc(CNC(=O)Nc2c(C)cccc2C(C)C)cc(OC)c1OC 51583951 JVBJLDCIGJFQCO-UHFFFAOYSA-N 382.504 5.186 30 20 GKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 51656489 GYUXNWVIAMFABZ-OAHLLOKOSA-N 385.439 5.422 30 20 GKED N#C[C@@H](C(=O)c1cn(Cc2ccccc2)c2ccccc12)c1nc2ccccc2o1 54735480 XFGPKTFPMGIATF-IBGZPJMESA-N 391.430 5.321 30 20 GKED C[C@@H](NCc1ccc(Oc2ccccc2F)c(F)c1)c1ccc(OCC#N)cc1 105487529 RAXZUBQJNYUSIL-MRXNPFEDSA-N 394.421 5.510 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CC1 108532802 GJHYXJJNTMYJBR-HNNXBMFYSA-N 383.492 5.274 30 20 GKED C=C(C)Cn1c(SCc2csc(C3CCCC3)n2)nnc1-c1ccncc1 123343575 PLEVHEYKDDZUCI-UHFFFAOYSA-N 397.573 5.323 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1C(C)C 128397379 MIIFNIJPSIQSHN-CYBMUJFWSA-N 383.517 5.296 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1nc2cc(Cl)ccc2s1 131061854 MTSPVPTVOIVSFM-GFCCVEGCSA-N 392.223 5.001 30 20 GKED Cc1ccc(NC(=O)N(CCC#N)Cc2ccco2)c(OCc2ccccc2)c1 156111275 IWZCPNVDBYVLKP-UHFFFAOYSA-N 389.455 5.115 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(-c2nccn2C)c1 159561467 SWZSXLPJLILIIK-UHFFFAOYSA-N 386.908 5.022 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 173115273 SVKUCBYWKCMYMK-MJGOQNOKSA-N 381.545 5.423 30 20 GKED Cc1nc(CCC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)oc1-c1ccccc1 175266715 PDKKKNLRTPRENK-UHFFFAOYSA-N 399.372 5.112 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(C)[C@H](c1ccncc1)c1ccc(Cl)cc1 175290849 BOJWXJZLFKNOSG-NRFANRHFSA-N 390.874 5.168 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](Oc2ccccc2)c2ccccc2)n1 177748812 NBINXRQWRSGYCO-GHTZIAJQSA-N 376.481 5.263 30 20 GKED N#CCCCCNC(=O)N[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl 182482909 YRBVGJRWXWNFAI-SFHVURJKSA-N 376.287 5.076 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 189879457 QLCHIKACDVOZMQ-UHFFFAOYSA-N 377.444 5.109 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1 193048276 TVKWUUGNEMTEPB-GOSISDBHSA-N 390.512 5.466 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccnc4ccccc34)c2)cc1 195640060 XCVJILLDFSLPDL-UHFFFAOYSA-N 393.446 5.132 30 20 GKED Cc1cccc2c1CCN2C(=O)c1ccccc1SCc1ccc(C#N)cc1 195735335 MURASDAWWLBFLP-UHFFFAOYSA-N 384.504 5.362 30 20 GKED C[C@@]12CC3CC(/C(O)=N/Cc4ccnc(OC5CCOCC5)c4)(C1)C[C@](C)(C3)C2 329303855 XRLBBFDBFIRXNH-SYQRVOMBSA-N 398.547 5.093 30 20 GKED N#CCC[C@H](NC(=O)c1c(F)ccc(SCC2CC2)c1F)c1ccccc1 410600070 CCQMKWBOMPXAEZ-KRWDZBQOSA-N 386.467 5.242 30 20 GKED CC(C)(C)n1cc(CNCc2ccc(C#N)s2)c(-c2ccccc2Cl)n1 421345314 ALXSNSBDGJEROX-UHFFFAOYSA-N 384.936 5.181 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C[C@H]1CCCO1)C1CCCC1 428889444 RWZAXFQAPUWWOM-FUHWJXTLSA-N 387.549 5.036 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C#N)cc2Cl)cnn1-c1cccc(Cl)c1 430361918 VCTMCOQZXQTPAL-UHFFFAOYSA-N 399.281 5.426 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431463348 HAQWIRODRPZCIJ-WIYYLYMNSA-N 381.545 5.210 30 20 GKED N#CCCC[C@H](NCC[S@@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 433021604 RMLXGPKUTPXUJF-AVRWGWEMSA-N 395.355 5.126 30 20 GKED CC1(C)CCCN(C(=O)c2ccc(COc3ccc4ccccc4c3)o2)[C@H]1C#N 434022942 QQUKRWIADAZKQI-QFIPXVFZSA-N 388.467 5.166 30 20 GKED C=CCC[C@@H](NC(=O)N(Cc1ccccc1)CC1CCOCC1)c1ccccc1 435761180 DVMNLKNNPUYVID-XMMPIXPASA-N 392.543 5.332 30 20 GKED C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438069576 CIIQRAYEWBYLPJ-MHECFPHRSA-N 399.469 5.236 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H]2CCSc3c(F)cccc32)cc1C(F)(F)F 438642213 PMEDDJZLWJKRAU-OAHLLOKOSA-N 395.381 5.075 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 439313106 JGLJVHNRMYQJTK-JOCHJYFZSA-N 396.450 5.517 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCc1csc2ccccc12 445797573 AWIVKBLMZYMMIQ-UHFFFAOYSA-N 380.538 5.868 30 20 GKED COc1ccc(F)c(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1 446485767 QHAYAUVAEMEOEU-UHFFFAOYSA-N 378.428 5.109 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 460322268 QZHCJGZYESDMNF-DEOSSOPVSA-N 398.506 5.231 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3SCCc4ccccc43)cc2)c1 463740351 BWAWWQMXTZFTQI-QFIPXVFZSA-N 386.476 5.320 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c(C)n1C1CCCCC1 464467680 NOXNSIWEGLYSRP-SFHVURJKSA-N 389.421 5.514 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1Br)c1cccc(C#N)c1 464488910 CNAPTMBTEYPTFD-SNVBAGLBSA-N 397.194 5.082 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1coc(-c2ccc(Cl)cc2)n1 464835230 UOQMIWWLKZXUNA-LEWJYISDSA-N 377.875 5.267 30 20 GKED COC(C)(C)C[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 466104276 FRMZDZMPKSABRC-KXBFYZLASA-N 399.922 5.321 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](c1cccc(SC)c1)c1cc(F)ccc1F 466242560 HRALPMBKJFCQFZ-FQEVSTJZSA-N 390.499 5.384 30 20 GKED CC(C)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(F)cc1F 468527402 JCJSTZPWYQIPIF-NRFANRHFSA-N 385.458 5.154 30 20 GKED C=CCC[C@@H](NC(=O)NCC1(C(F)F)CC1)c1ccc(C(F)(F)F)cc1 472122061 KTVJFAHLBLGJLB-CQSZACIVSA-N 376.369 5.057 30 20 GKED COc1ccc(-c2ccc(CNC(=O)C[C@H](CC#N)c3ccccc3)s2)cc1 476245648 KCQLISUWSNXVPX-IBGZPJMESA-N 390.508 5.127 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](CC)c1ccc(Cl)cc1 477832505 YAMJZPCVSHWLFM-FQEVSTJZSA-N 388.943 5.356 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cccc(-c2nccc(C)n2)c1)c1ccc(F)c(F)c1 480594511 WLMCSMHIHCHBTJ-FQEVSTJZSA-N 394.425 5.169 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccc3ccccc23)n1)c1nc2ccccc2[nH]1 480936841 DROXWKMNEMILKJ-KRWDZBQOSA-N 394.459 5.330 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](CC(C)C)c1cccs1 484257743 SNLZAEDOCUGYKH-IBGZPJMESA-N 388.581 5.401 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N(CCC#N)CCC(C)C)c2C(C)C)cc1 484808100 FUHBEQSGWACJHJ-UHFFFAOYSA-N 381.524 5.098 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 487322360 GNICWOFIYKYBRJ-OXQOHEQNSA-N 388.433 5.435 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 488797876 JVSCZIAMAVGHFS-IBGZPJMESA-N 397.906 5.473 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2cccc(C)c2)Cc2ccccn2)c1 489002053 KBJXWHNRDLLETE-UHFFFAOYSA-N 387.483 5.189 30 20 GKED Cc1cccc([C@@H](NCc2cc(C#N)ccc2Br)C(F)(F)F)c1 491597369 UNULARBLZDTCFR-MRXNPFEDSA-N 383.211 5.022 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnn(C(C)C)c3C3CC3)n2)cc1 498693607 BCIOOTYWVDTSFE-KRWDZBQOSA-N 390.512 5.263 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(F)cc1OC(C)(C)C 500080082 HGFZVOOYTXRNEG-UHFFFAOYSA-N 381.451 5.095 30 20 GKED Cc1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2ccc(F)cc2Cl)cc1 508513724 SXBPZQYUCYTXBO-HXUWFJFHSA-N 399.897 5.212 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NCc1ccc(C#N)cc1OC(F)F 509504670 BZGOXQGINPGRMZ-UHFFFAOYSA-N 379.410 5.066 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccccc2Cl)o1 509564124 KXJVDWWJNUEUMO-UHFFFAOYSA-N 380.831 5.511 30 20 GKED COc1ccc(CNC(C)(C)Cc2ccccc2Cl)cc1OCCCC#N 518275425 DAXSIEUABBAASE-UHFFFAOYSA-N 386.923 5.142 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1occc1COc1ccccc1 520100867 ZRGKNUTTZGVHED-UHFFFAOYSA-N 388.467 5.029 30 20 GKED C=CCCCN(C)C(=O)c1cc(-c2ccccc2C)nc2c1cnn2C(C)C 522950570 IYACEDLKDOBSIR-UHFFFAOYSA-N 376.504 5.026 30 20 GKED N#Cc1ccc(-c2ccc(OCc3nnc(-c4ccccc4Cl)o3)cc2)cc1 531759664 XFIYEIQDQKGWHI-UHFFFAOYSA-N 387.826 5.508 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccc(C#N)cc1 532206766 YWAFTFVGIXEJIC-HUUCEWRRSA-N 377.469 5.607 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C)(COC)CC1)c1ccc(C(F)(F)F)cc1 536976983 XXQFKPSERCEGPE-GOSISDBHSA-N 398.469 5.171 30 20 GKED O=C(CCCC(F)(F)F)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 537245828 MVHMXYHZMQSOIE-LLVKDONJSA-N 381.238 5.158 30 20 GKED N#Cc1csc(CN2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)c1 538751172 TVUHTXYNUUOZLH-UHFFFAOYSA-N 381.328 5.108 30 20 GKED N#Cc1cccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)c1F 541307558 MNFHYRWZPYSONU-HSZRJFAPSA-N 399.469 5.287 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)c1sccc1C#N 544062361 RZXCIUAAOZTRFQ-UHFFFAOYSA-N 393.468 5.596 30 20 GKED COc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2cccc(C)c2)cc1 551413103 FHZVGMBJLAGKCH-INIZCTEOSA-N 378.501 5.036 30 20 GKED Cc1c(C(=O)N2CCCCC[C@H]2[C@H]2CCCCC2=O)sc2ccc(C#N)cc12 551798423 VVPFBYRPYGZWOM-MJGOQNOKSA-N 394.540 5.226 30 20 GKED CC(C)(CCC#N)CNC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 553756385 YHTYFAYWIKQLAU-UHFFFAOYSA-N 391.490 5.353 30 20 GKED COc1cc([C@@H](C)N[C@H]2CCc3ccc(C#N)cc32)ccc1OCc1ccccc1 558503968 KBHAIVZBLBCBSO-KOSHJBKYSA-N 398.506 5.484 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2NC(=O)c2sc3ccc(C#N)cc3c2C)cc1 560135010 KCZHQTCGFPJDPP-FPOVZHCZSA-N 390.508 5.040 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H]1c1ccsc1 564381285 WMNPTFBVJDHVMR-CRAIPNDOSA-N 398.507 5.146 30 20 GKED N#Cc1cc(Oc2ccc(NCc3csc(C4CCCCC4)n3)cc2)ccn1 564694076 QZFDTPAJFKPUCL-UHFFFAOYSA-N 390.512 5.862 30 20 GKED CCCN(CCC(=O)Nc1ccccc1-c1ccccc1)Cc1ccc(C#N)cc1 576011761 VPHLWWPABSFGMI-UHFFFAOYSA-N 397.522 5.466 30 20 GKED N#C[C@H](Sc1nnc(COc2ccccc2Cl)n1C1CC1)c1ccccc1 580843930 ITLMMBXFKMVOBD-SFHVURJKSA-N 396.903 5.202 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)N(Cc2ccc(C#N)cc2)C(C)C)s1 603527449 RMGNXFDNDARAKY-UHFFFAOYSA-N 395.553 5.031 30 20 GKED C[C@H](NCc1ccc(OCc2c(F)cccc2Cl)cc1)c1ccc(C#N)cc1 603633315 XOHQMHSYHCRCNS-INIZCTEOSA-N 394.877 5.781 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1 606180962 MPOPXDFSNACKMD-MRXNPFEDSA-N 391.433 5.107 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCc1ccccc1F 609061408 BUCSAXKCXPCVOK-UHFFFAOYSA-N 388.442 5.156 30 20 GKED CC(C)Oc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609261818 AFHRVHMMRKUYIO-UHFFFAOYSA-N 386.451 5.177 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(Cl)c1 609496757 WJUFHGTWITXTKK-UHFFFAOYSA-N 377.831 5.268 30 20 GKED Cc1nc(NC(=O)C[C@@H](C)c2ccccc2C(F)(F)F)sc1SCC#N 610171896 JJLKQNRVPJASNU-SNVBAGLBSA-N 399.463 5.218 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1ccccc1C(F)(F)F 610227830 MQOFCZALEMWFSG-CYBMUJFWSA-N 378.419 5.453 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)S[C@@H](C)C1 610322712 DCVYOAMTHZHXQE-HOTGVXAUSA-N 381.501 5.017 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 610577678 WSHBCORMDRKFRQ-UHFFFAOYSA-N 391.349 5.092 30 20 GKED Cc1cc(F)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1F 610706503 NPRKSNCOXJULMI-UHFFFAOYSA-N 392.405 5.285 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)N2CC[C@H]2c2cccc(F)c2)cc1 611362925 XHKBHHBJNRLARK-QHCPKHFHSA-N 385.442 5.021 30 20 GKED C[C@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1ccc(Oc2ccccc2)c(F)c1 612103147 WTVUOVCFRFDVEP-AOMKIAJQSA-N 381.451 5.014 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ccc(OC)cc1)C(C)C 612200001 JJCFMDZDEYRUNR-IBGZPJMESA-N 392.952 5.505 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC[C@@](C)(C#N)C3)c(C)c2)n1 612303694 XRSVRNNHZNBYJX-IBGZPJMESA-N 386.546 5.069 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3nc4c(cc3C#N)CCCC4)sc2c1 614299391 QNTQGDBFGGWXJZ-UHFFFAOYSA-N 381.888 5.261 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 615927465 IMDPIERYPRZJSD-UHFFFAOYSA-N 395.450 5.373 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1Cl 619828228 PHOJSURAQPKTMM-OAQYLSRUSA-N 392.890 5.130 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCC(=O)c1ccc2ccccc2c1 642041237 PXYDNXWGIGHJDZ-UHFFFAOYSA-N 384.479 5.113 30 20 GKED N#C[C@H](C(=O)c1occc1-c1ccccc1)c1nc2ccccc2n1C(F)F 642282333 FFTHOPOXBTZGMZ-OAHLLOKOSA-N 377.350 5.181 30 20 GKED COc1ccc([C@H](C)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 675737159 AYLGCRRICLKLFO-HBNTYKKESA-N 387.339 5.394 30 20 GKED CCCCN(Cc1ccccc1Cl)C(=S)Nc1ccc(C#N)c(Cl)c1 726746533 HLVLIZJATATXEC-UHFFFAOYSA-N 392.355 5.864 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc1 728175216 MHZOFVGMGUJKOV-UHFFFAOYSA-N 391.471 5.394 30 20 GKED N#C[C@@H](NC(=O)c1ccc(SC(F)F)cc1)c1c(Cl)cccc1Cl 730093103 YJBUFXJHYQQGGE-CYBMUJFWSA-N 387.238 5.303 30 20 GKED COc1ccc(/C=C2\CCc3[nH]c4ccc(F)cc4c3C2=O)c(Cl)c1OC 730434232 MTMPVCHCHKBNRN-FMIVXFBMSA-N 385.822 5.190 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)Cc1ccccc1Cl 731115314 DJGYMUWUNYFOEH-GJZGRUSLSA-N 387.936 5.344 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)NC12CC3CC(CC(C3)C1)C2 731320737 LQXMQNITCPLRDG-LFPRZYRFSA-N 385.602 5.336 30 20 GKED N#CCOc1ccc(COC(=O)[C@@H](Sc2ccccc2)c2ccccc2)cc1 733382770 KXIZTZCBXTYYNX-QFIPXVFZSA-N 389.476 5.166 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 736483907 CTNNFSBYXVDMEK-FMIVXFBMSA-N 398.853 5.407 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1ccc(N2CCCCC2)c(F)c1 739421787 PEIYUEFYYJDJFL-UHFFFAOYSA-N 380.389 5.066 30 20 GKED CC(C)(C)OC1CC(CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)C1 753921069 NZTYINOSTLSCQR-UBHUBRDASA-N 376.909 5.110 30 20 GKED Cc1c(Cl)cccc1N=C1SCCN1C(=O)CC1CC(OC(C)(C)C)C1 754525600 NJXSPARUQDGVPG-UHFFFAOYSA-N 394.968 5.195 30 20 GKED O=C(/C(=C/c1ccc(O)c(F)c1)c1nc2ccccc2s1)c1ccccc1 755570335 HHPFLSHEZHQCQT-VBKFSLOCSA-N 375.424 5.565 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cccc(Cl)c3SC(F)F)o2)c1 760455238 GTFZMJKMTKYDMM-UHFFFAOYSA-N 392.818 5.188 30 20 GKED O=C(/C=C/c1csc(Cl)c1Cl)c1cc(Br)ncc1F 761484917 BXRDXSNPZJZOLE-OWOJBTEDSA-N 381.053 5.248 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc4[nH]ccc4c3)n2)cc1 765938770 ZAESEDXJWLVENC-LKJUBWIJSA-N 394.459 5.053 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCc3cc(F)ccc3C2)cc1 768868600 NABWRRYAUICPDV-QHCPKHFHSA-N 385.442 5.071 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCSc3ccc(Cl)cc32)c1 772983846 MHLYTMISQURENS-YLJYHZDGSA-N 386.948 5.738 30 20 GKED CC[C@H](NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 774234953 YQAJXKBWXAYOSY-VGSWGCGISA-N 393.531 5.385 30 20 GKED CC(=O)N1C/C(=C\c2ccc(-c3ccc(F)cc3)s2)C(=O)c2ccccc2C1 778519070 FAGLRSRFLSHFNC-LDADJPATSA-N 391.467 5.183 30 20 GKED C[C@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1F 781420246 AIDLXUACHZCOGI-AWEZNQCLSA-N 381.451 5.168 30 20 GKED N#Cc1c(NC(=O)c2cc(C(F)(F)F)cnc2Cl)sc2c1CCCCC2 790625878 GMAFWNWYQZGGMQ-UHFFFAOYSA-N 399.825 5.208 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)Cc2coc3ccc4ccccc4c23)s1 797568065 OGRKQVJVSBASBC-KRWDZBQOSA-N 388.492 5.759 30 20 GKED Cc1ccc(C(=O)Nc2cnn(-c3ccccc3Cl)c2C(C)C)cc1C#N 799373583 IPQPDQVRJWNGDZ-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CC1CCN(c2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2)CC1 814525338 ZLMVYGMLZBBSLN-HSZRJFAPSA-N 390.531 5.480 30 20 GKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1O 815636412 UUYPFKYVGCHVRN-RBUKOAKNSA-N 387.321 5.631 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(C2SCCS2)cc1)c1ccccc1 817319409 OLEZJWLXKDLEJS-IBGZPJMESA-N 382.554 5.330 30 20 GKED N#C[C@@H](C(=O)C1CC2(CC2)C1)c1nc(-c2ccc(Cl)cc2Cl)cs1 850765564 YKPWMLOCLVEBHW-ZDUSSCGKSA-N 377.296 5.483 30 20 GKED CC(C)n1ncc2cc(C=NNc3ccnc4cc(Cl)ccc34)c(Cl)nc21 873852576 OFCTXXOITMUOSJ-UHFFFAOYSA-N 399.285 5.313 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353959 RTTISIJKJDXYFF-HRAATJIYSA-N 375.497 5.156 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(N2CCCCC2)c(F)c1 915985476 LOZRCWWHYZQVTE-CSKARUKUSA-N 393.487 5.231 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 917426452 LRLIOFXCHSPMRA-VUANCPLDSA-N 396.446 5.230 30 20 GKED CC(=NNc1cccc2c1CCCC2)c1oc2cc(C)ccc2c1CC(=O)O 1776036570 ZVICYVOODOZXSK-UHFFFAOYSA-N 376.456 5.083 30 20 GKED O=C(/C=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccc(Cl)cc1 1776114794 BEXGIFXUIKWQFU-UBLKFNIESA-N 392.838 5.441 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1nc(-c2cccc(OC)c2)cs1 1776784462 QAYGBXKNFWYQDH-QGZVFWFLSA-N 390.549 5.112 30 20 GKED CCCCCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1 1776785938 UKXKBBCJPKEZMB-RVDMUPIBSA-N 380.484 5.939 30 20 GKED CCCCCCCC[C@H](C)C(=O)NCc1ccccc1-c1cccc(C(=O)O)c1 1776786024 CSKOEOAUEPNVGM-IBGZPJMESA-N 395.543 6.055 30 20 GKED Cc1cc2c(s1)C/C(=C/c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777428151 YLRZDOYCNHRKCV-YVLHZVERSA-N 390.460 5.156 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)C3(F)CCCCC3)cc2)CCC1 1789161622 AGAVGCQAHTZGDY-QGZVFWFLSA-N 386.511 5.005 30 20 GKED Cn1c(SCc2ccc(-c3ccccc3C#N)cc2)nnc1-c1cccs1 22417325 YOQDBFKEYQMSDX-UHFFFAOYSA-N 388.521 5.375 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(Cl)ccc3Cl)c2)c1 32291934 SEJUATNGVVAJDB-UHFFFAOYSA-N 397.261 5.696 30 20 GKED CN(CC1CCCCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161742 LDALZHJRABZRJD-UHFFFAOYSA-N 391.515 5.376 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl 58989267 HDGGHYZRDCSXKI-IBGZPJMESA-N 391.814 5.156 30 20 GKED COc1cccc(-c2nc(CNc3cc(C#N)ccc3OC(C)C)cs2)c1 63469728 IBGAOCWBYNGIBV-UHFFFAOYSA-N 379.485 5.090 30 20 GKED Cc1ccc(CCCCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 63593259 UGTQUGBJLVINIH-UHFFFAOYSA-N 399.494 5.714 30 20 GKED O=C(/C=C/c1cnc2ccc(Br)cn12)c1ccc2ccccc2c1 97591065 BNGCZLOQPBVPAO-CMDGGOBGSA-N 377.241 5.146 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@H](C)C#N 108529946 ODSTVWJKDAYSFG-MRXNPFEDSA-N 383.492 5.298 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 121008873 RVOUISAPKBWJDA-QGZVFWFLSA-N 399.475 5.114 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)c1c(F)cccc1F 153984566 NEERMNYXLKNZBO-CQSZACIVSA-N 393.393 5.074 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 172682130 SYLXSGFITCCICK-SNVBAGLBSA-N 384.810 5.350 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2)cn1 177755844 KHIVFSITLKHETM-LJQANCHMSA-N 391.496 5.039 30 20 GKED N#C[C@H](C(=O)c1cnc2ccc(F)cc2c1)c1nc2cc(Cl)ccc2s1 178989343 IUXAHYVFMGJBHA-CQSZACIVSA-N 381.819 5.127 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)C1 329055899 ICZGZRPCERVQKG-FYZZASKESA-N 397.563 5.628 30 20 GKED CC(C)c1nc([C@@H]2CCCN2/C(O)=N/[C@@H]2CCCc3sc(Cl)cc32)no1 330253997 JEIAJAFRVMZLAD-OLZOCXBDSA-N 394.928 5.036 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)c1 430610183 JVBZVMWUJXOGQM-UHFFFAOYSA-N 395.871 5.395 30 20 GKED N#CCCC[C@@H](NS(=O)(=O)c1cccc(-c2ccccc2)c1)c1ccccc1 431639784 YTOZKLALELVGAM-HSZRJFAPSA-N 390.508 5.067 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)cs1 432637987 IHYFSKIVCXZKKE-FQEVSTJZSA-N 390.512 5.675 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1c1ccncc1 432756928 JJWCWNFJJIENCB-JOCHJYFZSA-N 398.466 5.361 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1 433157054 LBEYDUVMHYSGGV-DOTOQJQBSA-N 399.947 5.756 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N1CCCC(C)(C)[C@@H]1C#N 434010086 AZLCSQPNTUYMNZ-HNNXBMFYSA-N 392.286 5.111 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c[nH]c2cc(F)ccc12 434518508 RWEKTYUJPPRNOS-UHFFFAOYSA-N 399.425 5.318 30 20 GKED CSc1c(F)cccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 435779748 YMQPMVXHNLQGLB-NSHDSACASA-N 376.865 5.301 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccccc3COc3ccccc3)on2)c1 436422622 VVXJDQKTDXKLRJ-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@@H](C(=O)Nc1ccc(O)c(-c2nc3ccccc3s2)c1)c1cccc(C#N)c1 436703086 FYJOCDITOYEGEK-CQSZACIVSA-N 399.475 5.283 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)Nc2ccc(C#N)cc2)cc1 437675644 PTAIXSDWIGICMF-QGZVFWFLSA-N 385.467 5.459 30 20 GKED C[C@H]1CCC[C@@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 437984142 GLZFVOGDEOPGKL-SJORKVTESA-N 395.478 5.319 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])cc1 440408123 IVOWAMFUOOHFGF-UHFFFAOYSA-N 389.436 5.064 30 20 GKED C=CCn1c(SCc2nc(C)sc2C)nnc1-c1ccc(Cl)cc1 443453454 JXEUWORNORTCMC-UHFFFAOYSA-N 376.938 5.150 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cc1 454449117 OYXGJEUMOSBQKA-HXUWFJFHSA-N 387.487 5.123 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@H]1OCCc2sccc21 455254916 XOURFKKLVZAATI-QVKFZJNVSA-N 384.545 5.424 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccccc1 458797045 FRZCJWPICUPRGL-QHCPKHFHSA-N 391.490 5.450 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1csc(C2CC2)n1 460159063 CWGFPGUECBJMTK-UHFFFAOYSA-N 393.899 5.393 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1coc(-c2cccc(Cl)c2)n1 464814359 LOUVYKLMAHPRLS-NHCUHLMSSA-N 377.875 5.267 30 20 GKED CCCn1ccc2ccc(NC(=O)c3ccc(COc4ccc(C#N)cc4)o3)cc21 465146927 MTZJHEGJFSEXIM-UHFFFAOYSA-N 399.450 5.347 30 20 GKED N#C[C@H](C(=O)c1csc(Cl)c1)c1nc(-c2c(F)cccc2F)cs1 467277258 HFOSKLDFZDZZQC-SECBINFHSA-N 380.828 5.293 30 20 GKED C=CCC(CC=C)C(=O)N1CCCC[C@@H]1C(=O)Nc1cc(Cl)ccc1Cl 467822942 CWSCGUKADIKSEU-GOSISDBHSA-N 395.330 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccccc1)C(F)(F)F 475551040 PLXPSCCMBFUHAN-LJQANCHMSA-N 390.449 6.006 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 477042458 ILFRMCWPWBHGFP-XOBRGWDASA-N 397.425 5.297 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@@H](C)c1cc(F)ccc1F)c1ccc(F)c(F)c1 477745469 VNACRVFXXOOYQK-BUXKBTBVSA-N 380.385 5.263 30 20 GKED C=CCn1c(SCc2cc(-c3ccco3)on2)nnc1-c1cccc(Cl)c1 481377612 YNAVHWDYMJKNJG-UHFFFAOYSA-N 398.875 5.325 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Br)cc1Cl)c1ccccc1 483078431 PFAUEZCKRRYLHF-CYBMUJFWSA-N 377.669 5.129 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F 483616966 COGDDNMREODJJL-QLFBSQMISA-N 399.482 5.429 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 483836065 DEJSOCSGYMAKQH-APWZRJJASA-N 394.824 5.489 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(Cc2ccc(F)cc2)n1)c1ccccc1 487248703 DUYNUGPCGUIPFL-LJQANCHMSA-N 393.487 5.038 30 20 GKED Cc1c(Cl)cccc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 495076595 AJHXGYJQGBKKFH-UHFFFAOYSA-N 390.870 5.546 30 20 GKED COCc1c(C(=O)N(CC(C)C)c2ccc(C#N)cc2)sc2cccc(F)c12 499324638 AQURSNFTMWUMOS-UHFFFAOYSA-N 396.487 5.361 30 20 GKED C[C@H]1CCC[C@@H](CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 504057794 JETNMCFMTTYDNT-AZUAARDMSA-N 376.500 5.487 30 20 GKED CCN(C(=O)c1cc2c(Br)cccc2[nH]1)[C@H](C)c1ccc(C#N)cc1 509239706 LKZLIQMURVDBGY-CYBMUJFWSA-N 396.288 5.025 30 20 GKED CC1(C)CC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 509696127 HNBJWQJSBZIPEC-IBGZPJMESA-N 377.488 5.032 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1csc([N+](=O)[O-])c1 509956310 ZDUVQTBZQQGOJU-UHFFFAOYSA-N 397.843 5.028 30 20 GKED O=C(Nc1ccc(C(F)(F)F)nc1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 510048492 HJVNIVFPDLFRQY-GFCCVEGCSA-N 395.278 5.055 30 20 GKED C=C(CNC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 512672161 ITWHKNHIZGZMPH-UHFFFAOYSA-N 383.495 5.136 30 20 GKED Cc1nc(-c2ccc(NC(=O)[C@H](Oc3ccccc3C#N)C(C)C)cc2)cs1 516464989 ICGDUOAEBKUETQ-OAQYLSRUSA-N 391.496 5.032 30 20 GKED Cc1csc(NC(=O)c2cc(-c3ccco3)nc3onc(C(C)C)c23)c1C#N 518831384 QXKHPHOCAILXAD-UHFFFAOYSA-N 392.440 5.100 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(N(C)C(C)C)c1 520289154 WPBZZYQKYYRWHN-UHFFFAOYSA-N 378.520 5.093 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 525284243 ZBOWKELNSSXAKL-CQSZACIVSA-N 379.460 5.028 30 20 GKED C[C@H](Nc1ccc(NC(=O)Cc2cccc(C#N)c2)cc1Cl)c1ccccc1 531388696 IHRGSHLOOBBVRV-INIZCTEOSA-N 389.886 5.566 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1CCC(F)(F)CC1 537245755 IREYUGAIYBLHAD-LBPRGKRZSA-N 389.286 5.251 30 20 GKED N#CC1(c2ccc(C(=O)Nc3nc(-c4cccc(Cl)c4)cs3)cc2)CC1 538573940 WZXGMBMTNCHKBJ-UHFFFAOYSA-N 379.872 5.271 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccccc3)Cc3ccccc3F)cc2)CC1 538583066 CWXTZBOUKPENLN-UHFFFAOYSA-N 384.454 5.223 30 20 GKED CN(C(=O)Cc1ccc(F)cc1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 543106745 ADWVMWWVIYDPLG-MRXNPFEDSA-N 393.302 5.149 30 20 GKED C[C@H](NCc1cnc(-c2ccccc2)nc1)c1ccc(-c2cccc(C#N)c2)cc1 543874726 MROOXWAWSLSPDK-IBGZPJMESA-N 390.490 5.533 30 20 GKED C[C@H](Nc1ccc2c(c1)N(CC(F)F)CCS2)c1ccc(C#N)c(F)c1 551572122 PUBGGWNLAIGIAE-LBPRGKRZSA-N 377.435 5.048 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCCCC[C@@H]2c2ccccc2)c1 551713329 WAYZILXFBIWSNP-GOSISDBHSA-N 385.414 5.309 30 20 GKED C=CCn1c(SCc2ncc(Cl)cc2Cl)nnc1-c1ccccc1 572790963 XEFKTHHSFKZVQK-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CC1(C)CN(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)[C@@H]1c1cccs1 579273281 LFMAGXOFLYHXQN-HXUWFJFHSA-N 392.480 5.015 30 20 GKED COc1ccc(CN(C(=O)CCCCCC#N)[C@H]2CCCC[C@H]2C)cc1OC 588953912 OOABNQXFTJDTFI-QUCCMNQESA-N 386.536 5.085 30 20 GKED C=CCN1CCC(NC(=O)Nc2ccc(SC3CCCCC3)cc2C)CC1 592906438 DZRZQFYZUORGLY-UHFFFAOYSA-N 387.593 5.192 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N2CCC[C@@H](CC#N)C2)cc1 596643305 WPFWMNVEKDSCBL-KRWDZBQOSA-N 379.460 5.035 30 20 GKED C[C@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)[C@H](C)CC#N 596714636 ROGNTXKMVWHUTF-VKJFTORMSA-N 391.902 5.406 30 20 GKED COc1ccc(CNCc2c(Cl)oc3ccccc23)cc1OCCCC#N 598993974 VFWKQWHHKMWAGL-UHFFFAOYSA-N 384.863 5.067 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1csc(C(F)(F)F)c1 599737987 RDMLSADDKCDQSY-LLVKDONJSA-N 399.463 5.340 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692844 OXFBCKIPOWSUCM-AWEZNQCLSA-N 378.457 5.032 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1ccc(Cl)cc1 603738872 FCRHKULRVFHIDT-UHFFFAOYSA-N 391.858 5.279 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CCCc2ccc(Cl)c(Cl)c2)c1 609066667 HHDUQVOLTKEVPN-UHFFFAOYSA-N 399.224 5.428 30 20 GKED C[C@](C#N)(CCc1ccccc1)NC(=O)c1cnc(-c2ccccc2Cl)s1 609526534 ZBEXCRXEWXWLEK-OAQYLSRUSA-N 395.915 5.108 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2occc2s1 609857546 NLDUPNZUPDONNL-UHFFFAOYSA-N 388.448 5.506 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@@H](CCC#N)c2ccccc2)c2ccccc2)cc1 610973734 DCFILXZODKDNOP-ZEQRLZLVSA-N 399.494 5.129 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)C1 665822908 ULAKGNUWGYECIW-AWEZNQCLSA-N 387.867 5.005 30 20 GKED COc1cc(/C=C/C(=O)c2sc(-c3ccc(C)cc3)nc2C)cc(OC)c1O 727654602 OCRKSRKAMRKVPW-JXMROGBWSA-N 395.480 5.046 30 20 GKED CC[C@H](Cc1ccccc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727935242 SAWJXRPZMCGJCV-ISKFKSNPSA-N 383.495 5.485 30 20 GKED N#Cc1ccc(SCC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1 728521791 HJDAORFBWVWADV-SFHVURJKSA-N 390.430 5.033 30 20 GKED Cc1ccc(Nc2nnc(SCc3ccc(OCC#N)cc3)s2)cc1C 729241124 LTCZIQLQAYOFIH-UHFFFAOYSA-N 382.514 5.093 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420763 FXOKWTUFHIRQAH-KSSFIOAISA-N 394.471 5.130 30 20 GKED COc1cc(C)c(C(C)=NNc2nc(Cl)c(Cl)cc2Cl)cc1OC 731315042 ZSNQHYYWIBVCRG-UHFFFAOYSA-N 388.682 5.204 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(=O)c1ccccc1 732753567 SSWCWYLTSLPZDT-WZONZLPQSA-N 382.463 5.190 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)CCc1ccc(C#N)cc1 733072403 NYIGEYPGTRTUTA-MRXNPFEDSA-N 376.481 5.227 30 20 GKED N#CCOc1ccc(CNC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)cc1 735385580 UEAUVUUKTPLLLI-OAQYLSRUSA-N 397.906 5.069 30 20 GKED C(=NN=C1c2ccccc2-c2ccccc21)c1ccc(Oc2cnccn2)cc1 743433885 OAYRJJMBJZJVJU-UHFFFAOYSA-N 376.419 5.121 30 20 GKED COc1ccc(OC(F)F)c(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1 745990561 UTTKRJQJZNVQIC-SOFGYWHQSA-N 381.378 5.255 30 20 GKED CCOCc1cc(/C=C\C(=O)c2ccc(OCC(F)(F)F)cc2)ccc1OC 747613311 XDMVQTDYGHNCFA-WMZJFQQLSA-N 394.389 5.069 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc3ccsc23)cc1 767960433 RCVCCJCGPYIUND-LIRRHRJNSA-N 376.481 5.376 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)Cc4ccc(C#N)cc4)cc3C2)cc1 771806818 RYCLEVYXKKSTCI-UHFFFAOYSA-N 395.506 5.383 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(OC(F)F)cc2OC(F)F)cc1 774295144 XNOWQEYGIHEWDT-UHFFFAOYSA-N 382.357 5.303 30 20 GKED C=C(C)[C@H](NC1CCC(NC(=O)OC(C)(C)C)CC1)c1ccc(F)c(F)c1 775558320 OCRZJFZYBJBRTO-RJYAGPCLSA-N 380.479 5.008 30 20 GKED CCCc1c(NC(=S)Nc2cc(C)ccc2C)cnn1-c1cccc(C#N)c1 783950764 AMKCSBFMLPJLRD-UHFFFAOYSA-N 389.528 5.122 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3ccc(C#N)cc3Cl)cs2)c1 788361277 YFYFHJRKUZCRJQ-VURMDHGXSA-N 380.856 5.240 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2ccccc2Cl)n1 789720132 UVFWLRWECXGWOL-UHFFFAOYSA-N 379.891 5.630 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792095675 WQVTWQDKHYXHGF-QFIPXVFZSA-N 384.479 5.273 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)Nc1ccc(Cl)c(C#N)c1 792937761 ZPVHQONCTGNAAQ-UHFFFAOYSA-N 385.851 5.119 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccc(Cl)nc1C(F)(F)F 796455258 SQVJVTKNXHASFM-UHFFFAOYSA-N 386.849 5.110 30 20 GKED C[C@H](NCc1ccc([N+](=O)[O-])c(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 801540107 UFTHPAKAHQXVSP-HNNXBMFYSA-N 375.403 5.123 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 803082441 HVYFNFZEAAXWLK-QGZVFWFLSA-N 393.446 5.445 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NCc1ccc(C#N)cc1C(F)(F)F 811501871 BAXGVRAGRIISEL-UHFFFAOYSA-N 381.401 5.483 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211229 GIOGMWSKSUOCGY-SJLPKXTDSA-N 390.405 5.258 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H](c1ccccc1)[C@@H](O)c1ccccc1 813874236 DLQRPGJCROHTBI-NXCFDTQHSA-N 382.507 5.390 30 20 GKED N#CCCC[C@@H](N)c1nc(C2(c3ccc(Cl)cc3Cl)CCCCC2)no1 823279860 DOMKIWVCWMFITC-MRXNPFEDSA-N 393.318 5.320 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1nc2ccccc2n1C(F)F 835075304 XIBGIQCXGADDAH-ZNMIVQPWSA-N 385.801 5.065 30 20 GKED Cc1cnc([C@H](C)OC(=O)c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 850225312 BKJFCHVRQVLZNG-VIFPVBQESA-N 399.262 5.190 30 20 GKED FC(F)(F)[C@H]1CCC[C@H](C=Nn2c(S)nnc2-c2ccccc2Cl)C1 853269099 KFMCXPCBGWNEPP-QWRGUYRKSA-N 388.846 5.090 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2cnccc2o1 878675377 FTLYNXOKUPQWIK-UONOGXRCSA-N 380.473 5.105 30 20 GKED O=C(Nc1ccccc1)c1ccc(C(=O)N(O)Cc2cccc3ccccc23)cc1 901371122 MVIVKAYLSJHLJS-UHFFFAOYSA-N 396.446 5.124 30 20 GKED C=CCC[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 901691338 WKSLUZSCKVLPDJ-KRWDZBQOSA-N 377.843 5.089 30 20 GKED C[C@@H](Sc1cccc(C(F)(F)F)c1)C(=O)N(CCC#N)c1ccc(F)cc1 912698782 UFRPPQXRALJAHH-CYBMUJFWSA-N 396.409 5.272 30 20 GKED CCOc1ccc(O)c(/C=N\C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 914703086 ODGMGFGHNHIZBH-JZUIVORYSA-N 383.332 5.119 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915088136 ZWWYWBVORKEHMM-QHCPKHFHSA-N 377.447 5.451 30 20 GKED CC(C)Oc1cccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 916679464 OZQZTHSRZMDBRP-XMMPIXPASA-N 399.494 5.451 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916707933 BZAPENXBYVACND-JWQCQUIFSA-N 395.506 6.020 30 20 GKED C[C@@H](Oc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047473 YBNSKJVIMCONOX-ZYHUDNBSSA-N 391.279 5.247 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 917783240 QZRDLIULDAGPQQ-UHFFFAOYSA-N 397.525 5.556 30 20 GKED CCCCCCCCCC(=O)N1CCC(C(=O)Nc2ccc(Cl)cn2)CC1 918131671 KSYDBGMRAVPGFV-UHFFFAOYSA-N 393.959 5.053 30 20 GKED CC(C)OCc1c(C(=O)OC[C@H](C#N)Cc2ccc(F)cc2)oc2ccccc12 920876932 UIZSDKNOPVDMSL-KRWDZBQOSA-N 395.430 5.036 30 20 GKED O=C(O)Cc1ccc(NN=Cc2c(Cl)cccc2Oc2ccccc2)cc1 1776084766 NRESCBSMBMUNBS-UHFFFAOYSA-N 380.831 5.205 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)c1ccc(OC)c(CC(=O)O)c1 1776131908 VGURQRBGIURXOS-QXMHVHEDSA-N 392.451 5.307 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(OCc3ccccc3C(=O)O)c2)c(C)s1 1776133526 YYTRJUARJLSDGL-KHPPLWFESA-N 392.476 5.538 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2cccs2)c1 1776788109 SCQVTVDPCHJIID-IBGZPJMESA-N 375.534 5.403 30 20 GKED N#CCCSc1nc2sc(-c3ccccc3)cc2c(=O)n1-c1ccccc1 6169925 GJTOQEUFYBVZRL-UHFFFAOYSA-N 389.505 5.120 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc2ccccc2n1C(F)F 41557898 UCEDOZDWKQCQKN-LBPRGKRZSA-N 385.757 5.321 30 20 GKED N#Cc1cc(NC(=O)c2cc(Cl)sc2Cl)ccc1OCC(F)(F)F 46933549 XELXSXGFABWRMW-UHFFFAOYSA-N 395.189 5.120 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(Br)c3)n2)cc1 60477264 VEAWTRQRGCWMCH-INIZCTEOSA-N 397.297 5.371 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 64027780 OULLLHYADKKSLK-UHFFFAOYSA-N 397.478 5.199 30 20 GKED C=CCc1cc(C(=O)Nc2cc(Cl)ccc2SC)cc(OC)c1OC 64492938 KWFNYDRLRNYJSG-UHFFFAOYSA-N 377.893 5.060 30 20 GKED COc1ccc2cc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)[nH]c2c1 65680276 AMFARZWNIDIAJW-UHFFFAOYSA-N 383.407 5.093 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1cc(F)ccc1F)c1ccccc1)c1ccccn1 106983678 HRORRMVBVLYFLU-IERDGZPVSA-N 380.419 5.070 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccoc2)n1)c1nc2cc(Cl)ccc2s1 108624781 AFDJDYLWYRHCCD-LLVKDONJSA-N 385.857 5.156 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC(=O)Nc2c(C)cccc2C(C)C)ccc1OC 113525109 JOAAMOPRYOTGNK-SFHVURJKSA-N 395.503 5.130 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1cccc(C#N)c1 127654708 SJTRFXRZDAKZOV-UHFFFAOYSA-N 387.826 5.152 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(Oc2nccs2)c1 134717667 HFLFZVXKSWURMY-AWEZNQCLSA-N 395.509 5.439 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 172997375 QWNIWYHCUJQJES-LBPRGKRZSA-N 389.318 5.262 30 20 GKED CCCO[C@H]1CCCN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)CC1 175605429 MHSQCKZSTGBTMM-FQEVSTJZSA-N 394.540 5.131 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)sc2C)cc1 193622161 IHQUDCCVQXDATA-QGZVFWFLSA-N 388.448 5.363 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)c1ccccn1 194345901 LJLLDKLKEAFFMH-SFHVURJKSA-N 383.838 5.440 30 20 GKED COc1ccc([C@@H](Nc2ccc(C#N)cn2)c2ccc(C(F)(F)F)cc2)cc1 302011805 CSGHJXUPIVNWSR-FQEVSTJZSA-N 383.373 5.182 30 20 GKED C[C@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)c1ccc(C#N)cc1 303707859 PGBXFDSKSGQERN-SFHVURJKSA-N 396.519 5.583 30 20 GKED OC1=NCCN(C(O)=Nc2ncc(C3CCCCC3)s2)[C@H](c2ccccc2)C1 329484838 WYBYXXQHRYSPHB-KRWDZBQOSA-N 398.532 5.140 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCC[C@H]1c1cccs1 330242739 JMBDNAABYMCRNK-IBGZPJMESA-N 392.528 5.331 30 20 GKED N#CC1(CCCN2Cc3cc(Cl)ccc3C[C@H]2c2ccccc2)CCOCC1 410407810 MHOAFKNHEYPBGU-QHCPKHFHSA-N 394.946 5.540 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H]2Cc2cc(F)ccc2F)cc1 416752783 DSAGINIBEDDYQB-IBGZPJMESA-N 383.442 5.005 30 20 GKED CCc1sc(NC(=O)c2cccc(SCC#N)c2)nc1-c1ccccc1 430041530 WCHOVKYCKRLYPB-UHFFFAOYSA-N 379.510 5.240 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccc(F)cc12 436349951 FESMQTHOLDPWST-ZJSXRUAMSA-N 399.469 5.163 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438641588 MSNQYJCYQAYPIT-JTQLQIEISA-N 383.320 5.080 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1nc(C(C)(C)C)no1 439664536 VIGYJAXFQBMAAX-ZDUSSCGKSA-N 380.423 5.343 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458853571 WRNIYUSSOZZHMG-VXKWHMMOSA-N 379.504 5.223 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(-c3cscn3)c2)cc1 463144595 KUWLWGTXWQBKJV-UHFFFAOYSA-N 397.459 5.726 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1ccccc1)c1ccc(C#N)cc1 463503006 FHKOBYHTFVMANE-WOJBJXKFSA-N 383.495 5.592 30 20 GKED N#CCCCC(=O)Nc1cc(Br)ccc1Oc1ccc(Cl)cc1 464099189 YBGDITSMNAPBAR-UHFFFAOYSA-N 393.668 5.527 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)c2)n1 464411820 RCRAONIGMFYJHF-HNNXBMFYSA-N 387.386 5.022 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1ccc(C(=O)Nc2ccccc2)cc1 464815816 USCCGVKQVBSSCZ-LOSJGSFVSA-N 395.506 5.211 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)c1cn(CCCC#N)c2ccccc12 469415783 IISPXGFQMVQJOZ-NRFANRHFSA-N 385.511 5.101 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cc2cccc(F)c2o1 474710512 QBUSEAIXGHMLNJ-KGLIPLIRSA-N 397.475 5.706 30 20 GKED CC(C)(CC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)C(F)(F)F 481155468 KULFOPYIOORODH-LLVKDONJSA-N 379.703 5.177 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1ccccc1C 481366682 CERMTEKWRHKICA-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482379782 JSQORVYNEZTNBR-UHFFFAOYSA-N 376.481 5.463 30 20 GKED N#C[C@@H](C(=O)c1c(-n2cccc2)sc2c1CCC2)c1nccc2ccccc12 483208699 ZMQGLDYZGAKPEJ-GOSISDBHSA-N 383.476 5.066 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@](C)(Cc1ccccc1)[C@@H](C)O 484658051 WFSDZHXLBHJLHA-KBMIEXCESA-N 394.559 5.290 30 20 GKED CCCCn1ncc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1C(C)C 485191417 FUCGKCZMMZRESK-PZJWPPBQSA-N 393.535 5.110 30 20 GKED N#CCCN(C(=O)CSc1ccc(F)c(Cl)c1)c1cccc(Cl)c1 487229897 CTQODBLYYNLDML-UHFFFAOYSA-N 383.275 5.171 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2ccc(Cl)cc2)on1)c1ccccc1 487294374 CYFSIXARDHXDJI-GOSISDBHSA-N 379.847 5.160 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccccc1 487357401 REEAAENDPFZJKA-QFIPXVFZSA-N 389.886 5.567 30 20 GKED C[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 487384648 AZRLLAQRWFHLDY-JXFKEZNVSA-N 388.433 5.750 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1nc2ccccc2o1 496767131 AVBYXSQQNRPIFT-CQSZACIVSA-N 396.324 5.597 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(C(F)F)ccc2Cl)c1 497444439 RCGHCPXIFDHKEN-UHFFFAOYSA-N 379.794 5.604 30 20 GKED N#Cc1cnccc1/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 504711571 JYBUGIRDKIDIQZ-PLNGDYQASA-N 394.261 5.683 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccnc(OC(C)C)c1)C1CC1 505023010 IPBWAFNUTIUQJE-UHFFFAOYSA-N 379.504 5.184 30 20 GKED N#C[C@@H](NC(=O)c1cccc(C(F)(F)F)c1F)c1ccc(Cl)c(Cl)c1 505959526 IERQJPOIPDNYNX-CYBMUJFWSA-N 391.151 5.146 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccccc2)c2nc(-c3ccccc3)no2)cc1 506619526 QJTQIUNDNANBLQ-QHCPKHFHSA-N 397.478 5.181 30 20 GKED COc1cc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cc(OC)c1C(C)C 510328866 HGGKCFJNJDSMBB-UHFFFAOYSA-N 380.488 5.002 30 20 GKED C[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@@H](COC(F)F)C1 512850904 MBTUGTDQZQLQOJ-NXEZZACHSA-N 391.302 5.346 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(Cl)cc1 517447464 HCYDJHOWRKNBDH-CQSZACIVSA-N 390.961 5.606 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccc(Oc4ccc(C#N)cc4)cc3)o2)cc1 519065335 HRICKKQWENFHBP-KRWDZBQOSA-N 396.450 5.882 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2)cc1 519977603 CRDQYKOSCMXARO-UHFFFAOYSA-N 382.341 5.622 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 524441299 AAESQIDYHFRRJH-UHFFFAOYSA-N 391.496 5.693 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc([C@H](C)Sc2ccccc2)cc1)C1CC1 533598384 ZRVDUTZGEVCHIE-SJORKVTESA-N 379.529 5.696 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccccc2Cl)CCC1 536275262 LBMKSKOLFAEUNU-UHFFFAOYSA-N 396.899 5.555 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3ccc(F)cc3F)CCCC2)c1 536327023 ADNLMHOHPUDALC-UHFFFAOYSA-N 384.426 5.098 30 20 GKED N#CC1(CSc2nnc(-c3ccccc3F)n2-c2ccc(Cl)cc2)CC1 540856438 OCSWJVMRRRQQRV-UHFFFAOYSA-N 384.867 5.123 30 20 GKED C[C@@H](NCc1cc(F)cc2c1OCOC2)c1ccc(-c2cccc(C#N)c2)cc1 541085515 FWANZIMEZVXMOH-MRXNPFEDSA-N 388.442 5.082 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 546123000 HRXXHHBREKYPIV-NRFANRHFSA-N 376.500 5.145 30 20 GKED COc1cc(C#N)ccc1NC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C 546707727 KYJSPQQEWVHLTM-UHFFFAOYSA-N 391.393 5.028 30 20 GKED C=CCOc1ccc(CN[C@@H](Cc2cccnc2)c2cccc(Cl)c2)cc1 552322199 GPWVATFPMVLAJB-QHCPKHFHSA-N 378.903 5.373 30 20 GKED Cc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 556198701 WBOICCOKSSRPSB-GAJHUEQPSA-N 392.934 5.920 30 20 GKED N#Cc1ccc(C[C@H](C#N)c2nc(-c3cccc(Oc4ccccc4)c3)no2)cc1 558300663 WJFBWCUTPLEFQC-HXUWFJFHSA-N 392.418 5.250 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2OCC2CCC2)c1 560665774 XOJUEUMBGOPZKS-UHFFFAOYSA-N 375.255 5.296 30 20 GKED C=C(C)C[C@@H](C)c1nc(CC(=O)Nc2ccc(Oc3ccccc3)cc2)no1 565918975 WJYHRYDRPYTYDT-MRXNPFEDSA-N 377.444 5.113 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1 575866527 WSKJAFGMWACVDA-SFHVURJKSA-N 393.556 6.088 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c1 589740945 LPYCRUDMAONQMH-LJQANCHMSA-N 393.512 5.620 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)CC1(C#N)CC1 590279722 SNDYMERNEUZJSG-UHFFFAOYSA-N 390.462 5.364 30 20 GKED COc1ccc2c(c1)[C@@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)CCC2 593975167 OCIRULLHAUBIOH-QAPCUYQASA-N 380.513 5.148 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4occc4s3)n2)cc1 606144820 DHVSBXOUNPQFSO-ZDUSSCGKSA-N 380.450 5.116 30 20 GKED CCc1c(C)sc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c1C#N 609032425 HYMABTHEIAIVHF-UHFFFAOYSA-N 399.903 5.370 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@H]3C3CC3)cc2Cl)c1 609137505 GSMWZZKYQYDPKG-FQEVSTJZSA-N 395.890 5.197 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1 609398747 NSDCOMCCSSGIAS-VFNWGFHPSA-N 395.528 5.220 30 20 GKED COc1ccccc1C(C)(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609427381 KLXOVQLMRUQPFE-UHFFFAOYSA-N 386.451 5.275 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609988233 BZSQSOCCLBPJJS-YVEFUNNKSA-N 380.797 5.233 30 20 GKED CC(C)(C)c1ccc(Oc2ccc(C(=O)Nc3sccc3C#N)cn2)cc1 610150852 ZFVKKMGACASFDM-UHFFFAOYSA-N 377.469 5.357 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N[C@H](C)c1cccc(C#N)c1 610361379 BJMQOYMUBQQYMO-MRXNPFEDSA-N 391.540 5.394 30 20 GKED N#CCn1c(C(=O)N2CCCc3cc(Cl)cc(Cl)c32)cc2ccccc21 611072094 PIZIBYOGCJQJPD-UHFFFAOYSA-N 384.266 5.065 30 20 GKED C=CCC1(C(=O)N[C@H](C)c2ccc(O[C@@H](C)c3ccccc3)cc2)CCOCC1 617940298 GXIJFTZKXVBHIL-UXHICEINSA-N 393.527 5.377 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618804529 AUSPYABCEAOJNT-ZUOKHONESA-N 393.943 5.982 30 20 GKED O=C(Nc1ccccc1C(F)F)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 645015442 KKPPQVRDMDVACC-RKDXNWHRSA-N 390.274 5.219 30 20 GKED C=CCC[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccco1 671743396 BNWHCMPNLGMTFE-KRWDZBQOSA-N 375.394 5.281 30 20 GKED Cc1ccc(C(=O)c2ccsc2NC(=O)c2cc(C#N)ccc2Cl)cc1 677447802 PDNJCAWZZLIMNP-UHFFFAOYSA-N 380.856 5.065 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)[C@H](C)Oc1ccc(C#N)cc1 733070401 CSEHGKLEHUFKMO-CVEARBPZSA-N 392.480 5.062 30 20 GKED C=CC[C@@H](NC(=O)CCCc1ccc2c(c1)-c1ccccc1C2)c1ccncc1 734461011 UCZUZBUKEFVQDS-RUZDIDTESA-N 382.507 5.409 30 20 GKED Cc1cccc2c(CCC(=O)NCc3cccc(-c4ccc(C#N)s4)c3)c[nH]c12 741569909 KAGZBUSUKFVZTQ-UHFFFAOYSA-N 399.519 5.326 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2cccc(C)c2C)c1 743612914 YZPQCAXICPLJEX-NZQKXSOJSA-N 391.515 5.031 30 20 GKED C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743629343 QHYPAYITWWAHQH-FOIQADDNSA-N 392.405 5.026 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)c1ccco1 744035195 LDEXTILXWBMOBB-ZWNOBZJWSA-N 391.279 5.690 30 20 GKED C[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2cccnc2)cc1 747667472 RBJJQUYUBHLRTE-AWEZNQCLSA-N 392.915 5.321 30 20 GKED C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc(C#N)cc1 748679703 MNJMLCIOMHTUML-AWEZNQCLSA-N 380.831 5.104 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)c1ccc(N2CCOC2=O)cc1 753712521 SPJWEETVIXBAMU-BAQGIRSFSA-N 395.764 5.212 30 20 GKED CC(C)(C)OC(=O)N1CCc2cc(N[C@H]3CCCc4cc(C#N)ccc43)ccc21 777220667 AADSZLPILZCJHO-NRFANRHFSA-N 389.499 5.345 30 20 GKED N#Cc1cccc(COc2ccc(NCc3coc(C4CC4)n3)cc2Cl)c1 779594966 BFMLFIQAJGOCTD-UHFFFAOYSA-N 379.847 5.268 30 20 GKED CC(C)c1ccc(-c2ncc(CNc3ccccc3O[C@@H](C)C#N)s2)cc1 779744013 YOSJPSMOLJDZOS-INIZCTEOSA-N 377.513 5.836 30 20 GKED CC(C)(C#N)CC(=O)O[C@@H](c1c(F)cncc1Br)C1CCCCC1 786418510 LBRKXFYEIZVVTM-QGZVFWFLSA-N 397.288 5.088 30 20 GKED O=C(/C=C\c1ccc(-c2cccc(F)c2F)o1)c1cccc(N2CCOC2=O)c1 790218099 GCNGESJYXPIZOQ-CLFYSBASSA-N 395.361 5.078 30 20 GKED CCc1cc(O)ccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 791157837 PGGWFVFISBWBIQ-UHFFFAOYSA-N 392.842 5.524 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cn1 792883750 MRRJBWZZXQIMGS-WDZFZDKYSA-N 398.434 5.363 30 20 GKED CC(C)O[C@@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796757523 ZJXVORAMYKYDHL-HNAYVOBHSA-N 384.888 5.292 30 20 GKED COc1ccc2cc(NC(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)ccc2c1 806614116 LADILJVZMNCZHH-PKTZIBPZSA-N 385.467 5.152 30 20 GKED Cc1c(C(=O)Nc2cccc(SC(=O)N(C)C)c2)sc2ccc(C#N)cc12 815540216 PWYCPVBKKANSBM-UHFFFAOYSA-N 395.509 5.107 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2nc3ccc(Cl)cc3[nH]2)sc2ccc(C#N)cc12 815569861 KIBITTQZNVCOAW-NSHDSACASA-N 394.887 5.102 30 20 GKED CC(C)[C@@H]1N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC12CC=CC2 831230091 CSYAORVGQXWAOZ-GOTSBHOMSA-N 385.511 5.551 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC[C@H]1c1ccc(Cl)cc1F)c1cc(C(F)(F)F)ccn1 835455448 NBYRTHLTZQJLHO-CFVMTHIKSA-N 396.771 5.263 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCSC3(CCC3)CC2)cc1 841599006 USBFXMURBYFVGN-OAQYLSRUSA-N 391.540 5.236 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@@H]1CCCc2c(OC)ccc(Cl)c21)c1ccncc1 844990955 ZSEGWKRYDCMEHS-RBUKOAKNSA-N 399.922 5.080 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(-c2ccc(Cl)s2)no1 848608328 DOICVFUGNMLJQN-LLVKDONJSA-N 396.900 5.101 30 20 GKED N#C[C@@H](CCc1ccccc1)c1nc(-c2cccnc2Oc2ccccc2)no1 904454890 WXYPQBCZRHHVAW-GOSISDBHSA-N 382.423 5.164 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(-c2noc(/C=C/c3ccccc3C#N)n2)c1 904631300 GPDDBTOMBPVSQN-VAWYXSNFSA-N 388.427 5.126 30 20 GKED Cc1cc(C)c(C=Nn2c(C)nc3scc(-c4ccccc4)c3c2=O)cc1C 916310070 RXDCHESRNRMPJS-UHFFFAOYSA-N 387.508 5.241 30 20 GKED Cc1nn(Cc2ccccc2)c(Cl)c1C=NNc1ncc(Cl)cc1Cl 916317758 WKCONXKIGJNNKZ-UHFFFAOYSA-N 394.693 5.041 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2oc3c(ccc4ccccc43)c2C)cc1 916909439 JQLGXTPGINDTJK-NRFANRHFSA-N 396.446 5.418 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1cc(F)ccc1Oc1cccc(F)c1 1776088795 JDONLRKMDIUIGZ-UHFFFAOYSA-N 396.393 5.600 30 20 GKED C=C(C)C[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(CC)c1)C(=O)O 1776137616 CHOTWWKHULTIGO-LJQANCHMSA-N 391.870 5.343 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(Cl)c1Cl 1776355388 HHUGOFSFCCBFED-VURMDHGXSA-N 379.239 5.375 30 20 GKED CN(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1777038835 JPVNZEPZUVPZLO-ACCUITESSA-N 377.465 5.075 30 20 GKED Cc1c(/C=C2/COc3c(cccc3C(C)C)C2=O)nc2ccccc2c1C(=O)O 1777414127 ARMLXUDSFJXFKW-PTNGSMBKSA-N 387.435 5.024 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(Cl)cc3)o2)nnc1-c1ccco1 29991194 KJXBYYKWSKLJSI-UHFFFAOYSA-N 398.875 5.325 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1COc1ccccc1 56747878 ZPEMDSUTKAMNJW-UHFFFAOYSA-N 399.494 5.581 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(-c3ccc(C)cc3C)nc2C)s1 63597292 KIDIZBSUIHYICT-UHFFFAOYSA-N 381.526 5.483 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ncccc1C)C(C)C 115841048 UQCHNHSHIUGDHK-QGZVFWFLSA-N 377.941 5.200 30 20 GKED C[C@H](c1ccncc1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116635112 SANJVRAJENRUEH-OAHLLOKOSA-N 391.858 5.232 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1c(C)noc1C 124618915 BKEFGYNLUPCAAL-HXUWFJFHSA-N 390.443 5.228 30 20 GKED CCN(CCC#N)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 133421870 RLTVQDMBZVRKNK-UHFFFAOYSA-N 382.460 5.240 30 20 GKED C=CCN(Cc1nnc(-c2ccc(Cl)cc2Cl)o1)Cc1cccs1 139594393 RBTMHUBPBUBEBX-UHFFFAOYSA-N 380.300 5.293 30 20 GKED Cc1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)c(OCC(F)(F)F)c1 151587195 YDIPHEHAKWDIDL-UHFFFAOYSA-N 395.274 5.346 30 20 GKED COc1ccc2cccc(CC(=O)Nc3ccccc3S[C@H](C)CC#N)c2c1 153801130 HADLUAVAKCCNDV-MRXNPFEDSA-N 390.508 5.424 30 20 GKED N#CCSc1ccccc1NC(=O)CSc1ccc(Cl)c(Cl)c1 172938595 HDGUVHPAWZGNEL-UHFFFAOYSA-N 383.325 5.340 30 20 GKED CN(Cc1nccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 175734262 PSNPVKMHHOXENL-QGZVFWFLSA-N 396.903 5.116 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc1OC(F)F 215710456 PUQCCEMSHBAKEP-DUXPYHPUSA-N 379.211 5.561 30 20 GKED CCc1nnc(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)c(C#N)c1CC 301610463 CMCCUGMYOUHFQV-UHFFFAOYSA-N 397.434 5.039 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3cccc(OC(F)F)c3)c2)cc1 409930164 GAFWMTHGGNRVJJ-UHFFFAOYSA-N 394.377 5.133 30 20 GKED Cc1cccnc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 429352471 WUNGFQDMKCBRJO-CYBMUJFWSA-N 388.279 5.310 30 20 GKED N#Cc1ccc(NC(=O)c2cccnc2SCc2ccc(F)cc2)c(Cl)c1 430355629 PQLAJWBYHHCMRK-UHFFFAOYSA-N 397.862 5.290 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 431780578 GFISZBRXHVDEBO-KXBFYZLASA-N 389.421 5.501 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C)CC(C)(C)C#N)cc2Cl)n1 432865681 JAJVHUOSYIXRMF-UHFFFAOYSA-N 394.953 5.270 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C)CCC[C@H]1C 437835598 GUSLZQFONDCYPM-FUHWJXTLSA-N 377.488 5.701 30 20 GKED N#CCSc1cccc(C(=O)N2CCC[C@H](CCCc3ccccc3)C2)c1 439163626 GAMGWFCZBCIHCO-FQEVSTJZSA-N 378.541 5.177 30 20 GKED C[C@H]1CCN(Cc2nnc(-c3ccc(C#N)cc3)o2)c2cc(Cl)ccc2S1 440396873 GMTQWAAFDPPBCI-ZDUSSCGKSA-N 396.903 5.153 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 444808656 ULOCTLXOKOYQIM-QGZVFWFLSA-N 384.804 5.673 30 20 GKED CC[C@H](C)Cc1c(C)sc2nc(SCCCSCC#N)nc(O)c12 466625081 JYPYOCURYSLHJL-NSHDSACASA-N 381.592 5.033 30 20 GKED CSc1cccc([C@@H](NCc2ccc(F)c(C#N)c2)c2cc(F)ccc2F)c1 467767450 DSTNUZSNLIUHTM-JOCHJYFZSA-N 398.453 5.577 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cccc(C(F)F)c1 468300387 KQVPQRBIWJEMJN-UHFFFAOYSA-N 392.405 5.778 30 20 GKED C=CCCCCNC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 471688234 MHCGTTVZIJZSIB-UHFFFAOYSA-N 394.899 5.187 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 473244727 OQQRHFQXSMCSAM-UHFFFAOYSA-N 398.253 5.210 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CCCN(CC)CC)CC1 475546138 GHXIDTIDUHJXNL-UHFFFAOYSA-N 399.623 5.904 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)C[C@H](CC#N)c3ccccc3)c(C)c2c1 475647712 MELZUMBAFZALNC-AEFFLSMTSA-N 376.456 5.015 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1 475740858 DJMJDBGPFOCDDG-UHFFFAOYSA-N 392.503 5.231 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)Nc3cc(C#N)ccc3C)cc2)cs1 476886678 YHCVGTWPZFVKBZ-CQSZACIVSA-N 376.485 5.181 30 20 GKED CCC1(CC)[C@H](OC)C[C@H]1N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 483332445 VEYLGYPQDQFNEC-ATZDWAIDSA-N 389.565 5.138 30 20 GKED C=CCCOCCCCC(=O)Nc1cc(C(F)(F)F)ccc1Br 484793330 GLYMKOHASROPGU-UHFFFAOYSA-N 394.231 5.169 30 20 GKED C[C@@H](NC(=O)CSCc1ccc(F)cc1C#N)c1ccc(Cl)cc1Cl 488480948 KHAPWTFGWYPIHB-LLVKDONJSA-N 397.302 5.115 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1cc(-c2cc(C)oc2C)nc2c1cnn2C(C)C 488840871 POOZQWMKSHPVOH-KRWDZBQOSA-N 392.503 5.070 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 492072237 WRIJAJKQDZNXGO-UHFFFAOYSA-N 397.862 5.383 30 20 GKED C=CCn1c(S[C@H](Cc2ccccc2)c2ccccc2)nnc1-c1ccncc1 496566119 BEWIZFKXOLAJEX-JOCHJYFZSA-N 398.535 5.602 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1Br 498971722 BHOQWCHTZRXRHM-CYBMUJFWSA-N 385.286 5.111 30 20 GKED Cc1ccc(F)c(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1F 499615249 BYSHAMYSJCJWDV-UHFFFAOYSA-N 392.405 5.171 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)C1 501094408 MSTHXBVQFYXWOU-AYVPJYCDSA-N 396.575 5.440 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 503352767 DZJXOEUCJJXTJY-XZOQPEGZSA-N 386.451 5.066 30 20 GKED N#CCCCCNC(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 505091702 APBYDVAJVFOKMU-UHFFFAOYSA-N 387.439 5.090 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)cc1 506223800 MSBYFWPWJCFXQC-OAQYLSRUSA-N 375.859 5.317 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(CC(C)C)C2CC2)cc1 508285354 ZZPFEUWZLDITTM-UHFFFAOYSA-N 379.460 5.011 30 20 GKED CCN(C(=O)c1cc(C#N)ccc1Cl)[C@@H](c1ccc(C)cc1)c1cccnc1 512334152 MOKDUTGXYZOVQM-QFIPXVFZSA-N 389.886 5.167 30 20 GKED Cc1ccc(-c2nc(COc3c(Br)cccc3CC#N)co2)cc1 516639723 QPFFGJODBALNEM-UHFFFAOYSA-N 383.245 5.058 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnc(C(C)(C)C)s1 516780359 XWVPMXWJARJTKI-UHFFFAOYSA-N 391.496 5.665 30 20 GKED CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccccc2)[C@H]1c1cccs1 517439413 XEQFGAAHUMQMBE-NRFANRHFSA-N 376.529 5.108 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1cccc(C(F)(F)F)c1 517605419 CMQVNAHUQJDGQW-HKBOAZHASA-N 394.396 5.343 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)Nc1ccc(CC#N)cc1 523024575 PMINGTAPLFGRNP-FQEVSTJZSA-N 375.497 5.228 30 20 GKED CC(=O)N(c1ccccc1)c1nc(CSc2ccc(C#N)cc2F)cs1 525503816 BKELQNDVZXYEFF-UHFFFAOYSA-N 383.473 5.131 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(Cl)cn1 525937372 QGNMBQGUWTYHCS-ZDUSSCGKSA-N 395.821 5.029 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1F 534174268 LGIMBAOXPZVFDW-YOEHRIQHSA-N 389.833 5.230 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnn(-c3ccccc3Cl)c2)c(C#N)s1 536972777 PLENRRDVVUCZTF-UHFFFAOYSA-N 384.892 5.009 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(-c2ccncc2)cs1 537968796 XLZHVNMBRLCZEM-WMAFBANVSA-N 388.540 5.260 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)cc1C#N 538226060 JUQBIQUAXPNMAL-UHFFFAOYSA-N 382.769 5.270 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)c1nc2ccccc2o1 539757218 TXNQKBMVSBZXEC-HNNXBMFYSA-N 392.484 5.038 30 20 GKED CN(C(=O)c1cccc(CC#N)c1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 540632649 KKODHFAIEDOCKK-PMACEKPBSA-N 386.417 5.180 30 20 GKED N#CCCCOc1cccc(N[C@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 546872677 XNCRQESRTVTOMQ-HSZRJFAPSA-N 391.902 5.813 30 20 GKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 552871600 QQOLZBAGNFGBPZ-YLJYHZDGSA-N 377.488 5.241 30 20 GKED C[C@H](NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccc(C#N)cc1Cl 563681048 DLIIGDLHQDNXAF-LBPRGKRZSA-N 388.323 5.839 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)C1 597914495 GLSDRVUJGBSHDV-LXMVLSBBSA-N 397.478 5.080 30 20 GKED CSc1ccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 602493465 KEFKWOMITGRONH-SECBINFHSA-N 382.388 5.120 30 20 GKED C[C@@H](c1ccccc1)n1c(SCc2ccc(C#N)cc2)nnc1-c1ccccc1 603917493 WFVWCNQQHSOJEY-SFHVURJKSA-N 396.519 5.718 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N(C2CC2)[C@@H]2CCc3ccccc32)o1 604446271 RODKSTVLDJZFQE-JOCHJYFZSA-N 398.462 5.022 30 20 GKED Cc1nc(CC(C)C)sc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 609020131 KWHKZVFCQZFCLC-UHFFFAOYSA-N 381.526 5.503 30 20 GKED Cc1nc(NC(=O)C[C@@H](C)c2cccc(C(F)(F)F)c2)sc1SCC#N 609968500 KZMJOKWMWHPQRS-SNVBAGLBSA-N 399.463 5.218 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 610355982 GJZYHAKBPVPQKA-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED C[C@H](NC(=O)c1oc2ccccc2c1COc1ccccc1)c1cccc(C#N)c1 610359179 GQWJXGJYWLQKDE-KRWDZBQOSA-N 396.446 5.374 30 20 GKED C=CCN(C(=O)c1cc(F)c(F)cc1Cl)c1nc(-c2ccccc2)cs1 641900644 NIOWBDQIYTVXSY-UHFFFAOYSA-N 390.842 5.575 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCC2(CCC2)C1 646439071 VPODMWLWORWDKO-UHFFFAOYSA-N 398.322 5.384 30 20 GKED C[C@@H](CC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1ccccc1C(F)(F)F 650351946 APKXPDOIWHDCGY-NSHDSACASA-N 397.334 5.092 30 20 GKED O=C(Nc1ccc(F)cc1F)NC(CCC(F)(F)F)CCC(F)(F)F 664404575 DDNOCSJUSHTKPA-UHFFFAOYSA-N 378.263 5.140 30 20 GKED Fc1cccc(-c2cnc(CN3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)o2)c1 673856487 MGOCTXJTFUDUIA-VXGBXAGGSA-N 396.306 5.043 30 20 GKED C=CCCCN(C)C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 680523645 HJHRLIUEDADYPC-CQSZACIVSA-N 393.247 5.050 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(F)c(Cl)c2)cc1 726073868 ITPCJEXPKWWVET-IBGZPJMESA-N 393.849 5.456 30 20 GKED CC(C)(CNC(=O)c1ccccc1SCC#N)c1cccc(C(F)(F)F)c1 727108259 QARYMNLNUQMDCO-UHFFFAOYSA-N 392.446 5.029 30 20 GKED COc1cc(OC)c(OC)cc1/C=C/C(=O)c1sc(-c2ccccc2)nc1C 727780573 PBDVGMLTSYCAGT-ZHACJKMWSA-N 395.480 5.040 30 20 GKED C[C@@H](NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccs1 727980858 SIGSFEPBTNCYNO-OAHLLOKOSA-N 393.537 5.246 30 20 GKED N#C[C@H](NC(=O)c1cc2c(F)cccc2s1)c1c(Cl)cccc1Cl 730092905 VCQPQYXDJAJGLO-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(/CC(=O)O)c2nc3cc(Cl)ccc3s2)cc1 730436963 OATXIUVAAFSKOD-UGMNDJHYSA-N 398.871 5.256 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccccc2S[C@@H](C)CC#N)cc1 731321688 QLFNMHBRBIAELV-HNNXBMFYSA-N 385.558 5.677 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(-c3ccccc3)cc2F)c1 733621697 MWJGKRLKOYYIJX-UHFFFAOYSA-N 389.430 5.819 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)C2CCCC2)c1 733805134 NSUZMRULZKITMP-GGAORHGYSA-N 391.515 5.098 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1nc2ccccc2s1 734210408 KKRHQKPUKNWIAO-ZIAGYGMSSA-N 396.541 5.573 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1nc2ccccc2s1 734223430 OCLJWGVEHBWWJK-GFCCVEGCSA-N 391.949 5.470 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2csc(N(C(C)=O)C3CC3)n2)cc1 734306434 OLGRMPOIJISENF-MDWZMJQESA-N 398.528 5.124 30 20 GKED C[C@H](Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(C#N)cc1 735675115 AQAKXJBQVQNQTB-INIZCTEOSA-N 377.488 5.025 30 20 GKED N#CCOc1ccc(Cl)cc1COc1cccc(NC(=O)c2cccs2)c1 742361273 SSECSEYTVFFVIN-UHFFFAOYSA-N 398.871 5.135 30 20 GKED CC(=NNc1cccc2ccccc12)c1ccc(S(=O)(=O)C2CCCC2)cc1 747060583 YUGRRYJLWHNEOK-UHFFFAOYSA-N 392.524 5.392 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1OC(F)F 753390109 JPTLMWQORWVSQR-HCYCVZQXSA-N 384.407 5.177 30 20 GKED CC(/C=C(\C(=O)C(=O)O)c1ccc2ccccc2n1)=C\c1ccc(Cl)cc1 753713692 KVUOUTQEMZXBEQ-COVZNBLNSA-N 377.827 5.029 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2)n1 759666921 DWHHLZODMRMVSK-UHFFFAOYSA-N 382.876 5.292 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2SC(C)C)c1 761676802 FJRMOLUWMACJMZ-KRWDZBQOSA-N 383.517 5.190 30 20 GKED C[C@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1ccc(C#N)cc1 761713493 SKFBTDOPRGYEBD-VAKHEIKFSA-N 378.781 5.035 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](NCc2cc(C#N)ccc2F)CCC3)cc1 773030370 PKKIYCYZUFVOJV-IBGZPJMESA-N 377.488 5.297 30 20 GKED CC(=NNc1nccnc1C(C)C)c1ccc2c(c1)Nc1ccccc1S2 773086869 UHOHXHKPITZJIA-UHFFFAOYSA-N 375.501 5.644 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)cc1 773120223 RQLCVJFETHAZFM-KUHUBIRLSA-N 399.840 5.221 30 20 GKED N#CCCCn1cc(C(=O)O[C@@H](c2ccccc2)c2cccnc2)c2ccccc21 774082834 OLFIQJNZDNLAJF-DEOSSOPVSA-N 395.462 5.286 30 20 GKED C[C@@H](NCc1c(F)c(F)c(F)c(F)c1F)c1ccc(OCC(F)(F)F)cc1 775223590 HCJMGDGZUXJFOA-MRVPVSSYSA-N 399.281 5.174 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)C(c1ccccc1)c1ccccc1 788027615 NSYZHMACTPXLFV-UHFFFAOYSA-N 385.496 5.220 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1nccc2ccccc12 792097608 XXVYJKWMLAISHC-XTXLJPNXSA-N 383.838 5.326 30 20 GKED N#Cc1ccc([C@H](O)C(=O)Nc2ccc(Cl)cc2-c2ccc(Cl)cc2)cc1 792588846 RQPTZDSWGKENHQ-FQEVSTJZSA-N 397.261 5.204 30 20 GKED O=C(/C=C/c1ccc2occc2c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 794702387 PPJGLNSIWLCFBE-VZUCSPMQSA-N 380.465 5.045 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(OC(=O)C[C@@H](CC#N)c2ccccc2)c1 796734433 UMZRABYGOWSHAL-QGZVFWFLSA-N 380.444 5.027 30 20 GKED CC(C)[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccnc1 797943060 MWYCVYJNXVYYOW-PKOBYXMFSA-N 395.915 5.475 30 20 GKED N#CC1CCC(CNC(=O)c2cc(-c3cccs3)nc3ccccc23)CC1 799385671 ALFINNIFWHHZHE-UHFFFAOYSA-N 375.497 5.023 30 20 GKED FC(F)(F)c1nc(NN=Cc2cscc2C(F)(F)F)c2ccccc2n1 811635643 FPIZQBCLARYPIT-UHFFFAOYSA-N 390.312 5.175 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1C#N 836820333 XNXWRFLYFWFQJD-UHFFFAOYSA-N 397.784 5.055 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@]2(C1)CC2(F)F 844517989 DOCRYRIXHHEXQR-NRFANRHFSA-N 397.425 5.312 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC(F)(F)CNC(=O)OC(C)(C)C 845998997 HAZVGTLFWCRMRO-UHFFFAOYSA-N 396.478 5.027 30 20 GKED CC(=NNc1ccc(Br)cc1)c1nc2ccccc2n1C(F)F 912828042 GXLLXWCZTBQAKV-UHFFFAOYSA-N 379.208 5.030 30 20 GKED Oc1nc2ccccc2cc1C=Nc1cccc(COCC(F)(F)C(F)F)c1 915981028 JRJHHYQLTWCPRT-UHFFFAOYSA-N 392.352 5.108 30 20 GKED CCOc1cc(/C=C2/CCC/C(=C/c3ccc(O)c(OCC)c3)C2=O)ccc1O 916137231 QCQZRDXCECWIMK-BKHHGCLFSA-N 394.467 5.115 30 20 GKED N#CC1(NC(=O)CCN2c3ccccc3Sc3ccccc32)CCCCC1 916934762 JNWRLOBLOQPZIK-UHFFFAOYSA-N 377.513 5.022 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cn(CC)c3ccccc23)cc1 916955825 VDGPKKZQOZTYHH-OXJNMPFZSA-N 387.483 5.136 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1Cl 917026039 VRKAYXDGWWEATF-KRWDZBQOSA-N 380.900 5.581 30 20 GKED Cc1cc(C(C)(C)C)cc(C)c1CCNC(=O)c1ccccc1SCC#N 917366671 XYTXGUZGIGGVME-UHFFFAOYSA-N 380.557 5.189 30 20 GKED COc1cccc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 918034212 JVKIZPVUMNZBEK-HXOBKFHXSA-N 385.467 5.233 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)s1 1776030096 YYSMZPRVAPLSFN-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)c1ccccc1NN=C(CCCc1ccccc1)c1ccc(F)cc1 1776030826 VLHMRISJSHATMS-UHFFFAOYSA-N 376.431 5.363 30 20 GKED COc1cc(NN=Cc2ccc(-c3cccc(CC(=O)O)c3)cc2)ccc1Cl 1776056627 FJPNLKRQLGWEBW-UHFFFAOYSA-N 394.858 5.089 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c(F)c1 1776128359 XWEPEEUFTHADQB-YFHOEESVSA-N 382.412 5.157 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccccc2SC(F)(F)F)cc1)C(=O)O 1776470532 ZEZQLHADGYAIKA-JATZPVMKSA-N 396.386 5.047 30 20 GKED C[C@@H]1C/C(=C/c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2sccc21 1776589745 SRSCTQQZPKJRHU-LKKYZFDUSA-N 394.448 5.392 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2ccc(OCCCC(=O)O)cc2)cc1 1776801287 HNMXUKKRARFYNY-OVCLIPMQSA-N 382.456 5.005 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)cc1C(C)(C)C 1777360999 GQBDDEAXMKBZCF-QPEQYQDCSA-N 396.483 5.132 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nc3sc(C)c(C)c3c(=O)n2C(C)C)cc1 7437102 CYHACDQFFJORFO-KRWDZBQOSA-N 397.569 5.191 30 20 GKED Cc1cc(C(=O)/C(=C(/S)Nc2ccc(C)c(C)c2)[n+]2ccccc2)c(C)s1 11163956 JJACURRCUVRIPG-UHFFFAOYSA-O 395.573 5.320 30 20 GKED O=C(Nc1cccc(C=C2C(=O)c3ccccc3C2=O)c1)c1ccc(Cl)cc1 23776618 ZFNHAZABJPSLEM-UHFFFAOYSA-N 387.822 5.055 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2cccc(C)c2)cc1 28777526 XZZMSMISNWIKOD-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)C3(c4ccccc4)CCC3)c2)c1 32290510 PLDHEUMNRUQZEL-UHFFFAOYSA-N 382.463 5.198 30 20 GKED Cc1ccc(CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)s1 48161903 UUKWBAFEYULVSL-UHFFFAOYSA-N 391.496 5.023 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)nn1C(C)(C)C 51534728 HABSYOLDACUHHS-INIZCTEOSA-N 392.528 5.375 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(Cl)cc1 66955899 KONCEHJOXUBEIO-BEFAXECRSA-N 399.947 6.103 30 20 GKED CCN(C[C@H]1CCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 69032048 VJIMIGCVKOBTEQ-QUCCMNQESA-N 397.906 5.028 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCCc2ccccc21)c1ccc(OCc2ccccc2)cc1 72096707 XMZRMCFRAZHMHQ-RPBOFIJWSA-N 396.490 5.067 30 20 GKED C=CCN(C(=O)C[C@@H]1OCCc2ccccc21)c1nc(-c2ccccc2)cs1 79356183 WKCWPVWCMXLFDB-NRFANRHFSA-N 390.508 5.033 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cs1)C1CC1 114991494 LUEBVQBRXNNSNR-DHZHZOJOSA-N 394.521 5.283 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)[C@@H]1CCC[C@H](C(F)(F)F)C1 128964303 VSWAGLDUYHMXSU-ZJUUUORDSA-N 387.295 5.074 30 20 GKED CN(C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12)C1(C#N)CCC1 179678831 WWWRRCYHCFNCRI-UHFFFAOYSA-N 375.859 5.073 30 20 GKED N#CC1(c2ccc(C(=O)Nc3c(O)c(Cl)cc(Cl)c3Cl)cc2)CC1 181903177 IOOIODDLGNBBPM-UHFFFAOYSA-N 381.646 5.160 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cccc(Br)c2Cl)c1 183225394 SGXIIUDCQNJQHM-UHFFFAOYSA-N 393.668 5.037 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)NC2CC2)c1 188072991 GXAMJHYYPBETRA-UHFFFAOYSA-N 377.488 5.075 30 20 GKED Cc1ccc(C[C@@H](Nc2nc(C(F)(F)F)ccc2C#N)c2ccccn2)cc1 301274831 IOFJPSLHSXMSLY-GOSISDBHSA-N 382.389 5.071 30 20 GKED O/C(=N/[C@@H]1CC2(CCCC2)Oc2ccccc21)c1ncsc1C(F)(F)F 328751653 RBIFSJAHRRTRBM-GFCCVEGCSA-N 382.407 5.303 30 20 GKED C[C@@H]1CC(=O)CC[C@@H]1C(O)=Nc1nc(-c2ccc(Br)s2)cs1 329188517 BQNAHNKEPMECOT-SCZZXKLOSA-N 399.335 5.227 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)/N=C(/O)C1CCC(=O)CC1 329903912 QPSLTWLAICNNGH-NSHDSACASA-N 376.909 5.549 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)ccc1OC1CCCC1)c1nc2ccccc2o1 429733373 WEPNIWQCSKBCBT-MRXNPFEDSA-N 380.831 5.293 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)C1CCC1)c1ccccc1 431922912 BUKLOCQEOJICEK-FCHUYYIVSA-N 379.479 5.401 30 20 GKED Cc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1Br 432685483 GIRNBJYHTZYFCY-GOSISDBHSA-N 386.293 5.314 30 20 GKED CC(C)COc1cccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 433193274 PFHRYGSYGPOAPJ-FCHUYYIVSA-N 377.488 5.025 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)cc1 440263759 GLHKEZSQDGOUTI-UHFFFAOYSA-N 375.394 5.627 30 20 GKED CCCCOC1CCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1 444652734 JZDJMVIEPJPWFJ-UHFFFAOYSA-N 376.544 5.167 30 20 GKED CC[C@@H](NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1ccc(C#N)cc1 447595916 BABUIBHGKBBUEB-LEWJYISDSA-N 387.552 5.528 30 20 GKED COC(C)(C)c1nc(C)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 463469423 JPQNWAPQHYTOPM-UHFFFAOYSA-N 397.525 5.186 30 20 GKED COc1cccc([C@@H](NC(=O)Nc2cccc(C#N)c2)c2ccccc2Cl)c1 466043541 SEJJJQRNCCFNOJ-OAQYLSRUSA-N 391.858 5.131 30 20 GKED CCN(c1ccccc1)c1ccc(CNC(=O)Nc2ccc(CC#N)cc2)cc1 466221420 FTRCDKJZOGQHSK-UHFFFAOYSA-N 384.483 5.232 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)F 476171696 ZYIMDGQGVXHWON-RTBURBONSA-N 385.454 5.882 30 20 GKED C[C@@H](Nc1ccc(NC(=O)CSc2ccc(C#N)cc2)cc1)c1ccccc1 486554164 DHTPRDAMELDJHF-QGZVFWFLSA-N 387.508 5.462 30 20 GKED CCc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c2c(C(C)C)noc2n1 487189066 UYJCSNFENXGENT-IBGZPJMESA-N 390.487 5.074 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@H](c2ccc(F)cc2)CC1)c1ccccc1 487936555 SBEBKAWHRYQTAZ-PGRDOPGGSA-N 379.479 5.150 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c1-c1ccccc1 488218519 LMDGLEIYIDEUEG-INIZCTEOSA-N 386.480 5.231 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1oc2ccccc2c1CSc1nnc(C)s1 488875407 DTQTXUTZJVFPOD-CQSZACIVSA-N 399.541 5.066 30 20 GKED C=CCn1c(SCc2csc(C3CCCC3)n2)nnc1-c1cccs1 489427055 CPCHHNYHQBEZIG-UHFFFAOYSA-N 388.587 5.599 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@H](C)c1cccc(C(F)(F)F)c1 492805358 FUMFYAZIQUVCFZ-HUUCEWRRSA-N 396.478 5.021 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)c3cccc(Oc4ccccc4)c3)CC2)cc1 504711594 KCDLSOLQSSHOAV-UHFFFAOYSA-N 398.462 5.034 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)n1 507830509 MHVPYKHHXCXQQL-OAHLLOKOSA-N 392.459 5.258 30 20 GKED CN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CCCCC1 509903248 BDFJFMSGCQVWDV-UHFFFAOYSA-N 377.488 5.128 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510501910 OSVRCRVTMZUQHM-UHFFFAOYSA-N 393.830 5.050 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(C(F)F)c2)cc1Cl 511554152 LVWLCTVQOZIMFS-IBGZPJMESA-N 396.824 6.185 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 513113341 MTDBFUDXJPACIV-KRWDZBQOSA-N 388.442 5.110 30 20 GKED C=C(C)CN1CCC(NC(=O)N[C@H](CCC)c2ccc(Cl)c(Cl)c2)CC1 517998084 WUAYQOSPZYZORH-LJQANCHMSA-N 398.378 5.174 30 20 GKED CN(Cc1cc(C#N)ccc1F)[C@H]1CCSc2ccc(Br)cc21 518251964 IQDKUBFXECRJBL-KRWDZBQOSA-N 391.309 5.129 30 20 GKED N#C[C@H](NC(=O)c1ccc2c(c1)Cc1ccccc1-2)c1cccc(C(F)(F)F)c1 521016107 HYQDXSCCDDYPCB-NRFANRHFSA-N 392.380 5.271 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3sc(CC(C)C)nc3C)n2)cc1 524377326 ATLBHOYYCLSRST-INIZCTEOSA-N 395.553 5.572 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ncsc3C(F)(F)F)cc2)c1 525920408 XXLLPQSVPRUTLR-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1cc2ccccc2s1 527491595 DURQRXQZUGASNP-MRXNPFEDSA-N 378.497 5.199 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3o2)oc2c(Br)cccc12 541093743 LWEPMPSMJJQUGD-GFCCVEGCSA-N 395.212 5.135 30 20 GKED N#CC1(c2nc(-c3ccc(Oc4cccc(Cl)c4Cl)nc3)no2)CCC1 545834866 IYKXBJBAMCBVTN-UHFFFAOYSA-N 387.226 5.176 30 20 GKED COC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 550833490 YMEYLIUUBWIWQH-UXHICEINSA-N 376.422 5.418 30 20 GKED CC(C)Oc1ncccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 551507784 WQEMLRPQQKMBJY-INIZCTEOSA-N 397.887 5.136 30 20 GKED Cc1c(C(=O)Nc2ccc3c(c2)C(=O)CC(C)(C)O3)sc2ccc(C#N)cc12 552110048 VHFPXKWTVJVTSH-UHFFFAOYSA-N 390.464 5.078 30 20 GKED N#CCc1cccc(C(=O)N2c3ccc(Br)cc3[C@@H]3CCCC[C@@H]32)c1 553111009 UVMUJHNEXSUMAS-HKUYNNGSSA-N 395.300 5.202 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N(CCC#N)c1ccc(F)cc1 553943860 AJMPHSNSQMKHKX-CYBMUJFWSA-N 379.262 5.258 30 20 GKED CC(C)CCc1ccccc1NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1 560469740 CACIARHNARBODI-UHFFFAOYSA-N 391.515 5.222 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)c1cn(CCCC#N)c2ccccc12 562468633 WHNALRVLMKGTMF-SFHVURJKSA-N 389.499 5.223 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1cc(C)c(-c2cccc(Cl)c2)s1 578552454 MMKAMNAKDIEPPF-GOSISDBHSA-N 378.950 5.142 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@@H]3C)c1C1CC1 582287346 SXPGJNHUBBPISY-OLZOCXBDSA-N 382.533 5.042 30 20 GKED CCOc1ccc(C[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 591173685 AZONBEZPWOZQML-IRXDYDNUSA-N 382.529 5.154 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cc(F)c(F)c(F)c2F)c(C(F)(F)F)c1 591298021 ANRJXMJKXAXOGC-UHFFFAOYSA-N 395.274 5.301 30 20 GKED COCCC[C@@H](c1ccc(Cl)cc1)c1noc(CC2(C#N)CCCCC2)n1 596598066 JQGURNURCWZWLY-SFHVURJKSA-N 387.911 5.298 30 20 GKED C=CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@@H](C)COC 596691124 IQFQXNGCALWWTI-JXFKEZNVSA-N 397.906 5.050 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184952 ZCRVEBXEDCIHGW-DEOSSOPVSA-N 381.479 5.159 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 610023539 JFIMAESDCMEPDN-LJQANCHMSA-N 387.405 5.014 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2C3CCCC2CCC3)c1 610236006 NEVRQYWCDWZHTR-UHFFFAOYSA-N 380.875 5.551 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccccc1COCc1ccccc1 611390977 YKOAJASZPQYSOE-AREMUKBSSA-N 382.507 5.442 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)CCC2)c1nc2cc(C(F)(F)F)ccc2s1 613403291 FJYCWIDAFKBIHS-OAHLLOKOSA-N 386.398 5.294 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2cc(Cl)ccc2s1 613403793 UPEWPLXOHBITCC-AWEZNQCLSA-N 396.830 5.839 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1[nH]c2ccc(F)cc2c1Cl 615403602 BIYLENSFBXSUIK-UHFFFAOYSA-N 389.817 5.008 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1)c1cccc(C#N)c1 617598567 RZCLGZPOANGHDV-ZDUSSCGKSA-N 375.394 5.281 30 20 GKED C=C(C)[C@H](N[C@@H]1CC[C@@H](C(=O)OCC)c2ccccc21)c1ccc(F)c(F)c1 619822816 PNENDQWRBLTUQY-QIJUGHKUSA-N 385.454 5.353 30 20 GKED COc1cccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1F 622283800 AXCSOQFNFHUBBT-UHFFFAOYSA-N 381.247 5.124 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 727589079 HURFPOMSHHUUAS-YADARESESA-N 383.495 5.609 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1F 731411383 XLFKJDIAZSBBKX-ZWNOBZJWSA-N 392.377 5.434 30 20 GKED N#C[C@H](C(=O)CCCCCc1cccs1)c1nc2cc(Cl)ccc2s1 731547384 ZZFAVZJKIRGWDJ-OAHLLOKOSA-N 388.945 5.991 30 20 GKED C[C@H](OC(=O)C1(C(F)(F)F)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733710748 ZKIBKOKYRQVFRU-ZETCQYMHSA-N 394.233 5.671 30 20 GKED COc1ccc(O)c(C=Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1 733903895 SJFBJHBCTUWHQV-UHFFFAOYSA-N 388.345 5.358 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccc(SC(F)F)cc1 734981753 STNSMVHCFOAHDJ-XCVCLJGOSA-N 397.446 5.871 30 20 GKED C[C@H]1c2ccc(F)cc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738894459 FMBJHUHYAMTSOA-BXKMTCNYSA-N 399.469 5.632 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 739160104 QQKGYZYISFIKES-IERDGZPVSA-N 399.519 5.614 30 20 GKED Cc1csc(-c2cccc(C(=O)OCc3cc(Cl)ccc3OCC#N)c2)n1 740407121 KOEWNYLMMLTVCX-UHFFFAOYSA-N 398.871 5.031 30 20 GKED COc1ccc(CN[C@H](c2ccc(C(C)C)cc2)c2cccs2)cc1C#N 742366538 JJBRVLYYZIPIJU-HSZRJFAPSA-N 376.525 5.631 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1c[nH]c2cc(Cl)ccc12 743056045 BDIZUGPMIXGVEZ-BAQGIRSFSA-N 375.815 5.300 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)CCOc3ccccc3)n2)cc1 745948373 YXSSKPRYCUQFQV-PXNSSMCTSA-N 390.508 5.400 30 20 GKED C[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccncc2)cc1 746395833 NXNKALRUZGEQPV-AWEZNQCLSA-N 392.915 5.321 30 20 GKED CS[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)(C)C 752485176 MBSZOVNVPAHDAR-VQTJNVASSA-N 381.545 5.241 30 20 GKED COc1cccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 753397338 ZGQZJECAGOKXPV-UZLBHIALSA-N 390.508 5.497 30 20 GKED C[C@H](Cc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 754531806 MMLYWFVCPOPFGJ-RHSMWYFYSA-N 380.900 5.519 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2SCC#N)c(Oc2ccccc2)c1 755484790 FBJDDEYZHQQBDN-UHFFFAOYSA-N 388.492 5.333 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 756517069 LYSUPHJDZMUENM-GWKQRERASA-N 378.884 5.743 30 20 GKED C#Cc1cccc(NC(=S)N(C)[C@H](C)c2sc(-c3ccccc3)nc2C)c1 759126507 FZTUUWXVFPMCTA-MRXNPFEDSA-N 391.565 5.490 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(Oc2ccc(C(C)=O)cc2)cc1)c1ccncc1 760465180 ONDHWNZAOQJIQV-HSZRJFAPSA-N 386.451 5.124 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(-c3ccoc3)c2)cc1 760969055 MCNFJONGRSIARQ-ZHRRBRCNSA-N 386.451 5.421 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H]1CCC(F)(F)C1 763842841 SXHRRUVDWFRBTA-ISUDXETCSA-N 387.270 5.041 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2cc(C#N)cc(Cl)n2)cc1 768376440 SLQCUOWBCMJTIF-UHFFFAOYSA-N 376.847 5.118 30 20 GKED Cc1nc2sccc2c(=O)n1N=Cc1c(Cl)cccc1Oc1ccccc1 769570004 NYBNOWLILWUVQF-UHFFFAOYSA-N 395.871 5.094 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Br)s2)c1 772985929 UZTFGDSSBDROHZ-GXTWGEPZSA-N 379.323 5.042 30 20 GKED N#Cc1cccc(COc2ccc(NCc3nccc4ccccc34)cc2F)c1 779595975 QVLXFNULMJSPBE-UHFFFAOYSA-N 383.426 5.437 30 20 GKED CCCOc1ccc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1OCCC 780456029 XEOSPSMDQOGQEC-INIZCTEOSA-N 397.475 5.199 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 805877568 LDAQXFWJPHWSDJ-FZKQIMNGSA-N 389.455 5.039 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)CCCCC3=O)cc1 810115018 QJSLIKWDTDIAHW-DEOSSOPVSA-N 394.474 5.503 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(Cl)sc3[nH]2)cc1 810532329 CPDUTWLYLHHFRY-XHDPSFHLSA-N 399.903 5.357 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccncc1 812047562 HXEOJKBMGYVORF-MJGOQNOKSA-N 390.314 5.456 30 20 GKED COc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cc1OC1CCCC1 824031485 MMMBQGXDQZJKKL-INIZCTEOSA-N 393.487 5.113 30 20 GKED COCC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 834891511 IRHHXHVUHKZDKN-YWZLYKJASA-N 392.421 5.036 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CN[C@H]2CCCc3cc(C#N)ccc32)c1 850483789 URRZWZWMNDZAAV-NRFANRHFSA-N 377.488 5.072 30 20 GKED CCCOc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1F 858310058 PRWMNXYLBJXNDJ-UHFFFAOYSA-N 378.451 5.004 30 20 GKED O=C(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ocnc1C(F)F 860400522 RBZLFPOYCBZJIK-UHFFFAOYSA-N 389.198 5.007 30 20 GKED Sc1nnc([C@@H]2CCCCO2)n1N=Cc1ccc(-c2ccccc2)c(Cl)c1 863097192 FDTYCCMEJRSJQA-SFHVURJKSA-N 398.919 5.011 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1cc(F)ccc1Oc1cccc(F)c1 1776031186 RKLXJGLJJZWJRS-UHFFFAOYSA-N 382.366 5.291 30 20 GKED C=CC[C@@]1(C(=O)O)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)C1 1776159860 DFDQGUNIYHYNFT-XMMPIXPASA-N 399.481 5.230 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1CC(F)(F)F 1776355405 KCWDJJOQPGQRCC-CLFYSBASSA-N 392.373 5.173 30 20 GKED CC(C)c1cccc2c1OC/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1776377864 AGDOUSPMMLNPRL-RIYZIHGNSA-N 378.449 5.382 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3cc(C)c(C)cc3o2)c2cc(C(=O)O)oc12 1777360712 CDMYNXRDWFFCFX-GQCTYLIASA-N 390.391 5.399 30 20 GKED COc1ccc(/C=C\C(=O)c2oc3ccccc3c2C)c2cc(C(=O)O)oc12 1777361509 DLYICIDHYOMUAD-CLFYSBASSA-N 376.364 5.090 30 20 GKED O=C1/C(=C/c2cccc(OCc3ccccc3)c2)C[C@@H](C(=O)O)c2ccccc21 1777698380 KCEWMACXPYSJOI-UOCRBVKVSA-N 384.431 5.104 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2ccc(C)c(C)c2)[n+]2ccccc2)c1 11162561 HBDBJVRLNOTOMA-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)c1cccc(C#N)c1 63326011 ZNUHUGAMKRBLEF-UHFFFAOYSA-N 396.368 5.646 30 20 GKED C=CCn1c(SCC(=O)c2ccc(Cl)c(Cl)c2)nnc1-c1ccco1 69519358 JIRDEUJHAGBGKM-UHFFFAOYSA-N 394.283 5.006 30 20 GKED COc1ccccc1[C@@H](NCc1cccc(OCCCC#N)c1)c1ccccc1 108421443 YGEJRPWFVRDING-VWLOTQADSA-N 386.495 5.257 30 20 GKED CC(C)CCOC1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 109028379 MIFNMLHTVFIJGQ-QGZVFWFLSA-N 389.565 5.140 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(OC(F)(F)F)cc2)c1 110401440 HBSAXUAWHNMBSI-IZZDOVSWSA-N 375.346 5.164 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(OC(F)F)c1 113570574 FPBOWXKWUMBOAW-GFCCVEGCSA-N 377.416 5.326 30 20 GKED COCc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)o1 123754418 OPXLWMTZKIPVBD-QAPCUYQASA-N 399.516 5.189 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1C1CC1 161162015 LMXBGOVUQHCAAA-DIFFPNOSSA-N 391.302 5.033 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cs2)cc1 177744173 JWNAJLZYCAMDGJ-MRXNPFEDSA-N 381.526 5.117 30 20 GKED N#Cc1ccc(CN2CCC(Nc3cccc(CCC(F)(F)F)c3)CC2)cc1 182574989 AZACOEOWDYKPHK-UHFFFAOYSA-N 387.449 5.130 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c2ccccc12 193284929 KEMKAGZDYRXXGP-MRXNPFEDSA-N 391.377 5.083 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 237503974 SSPZYFSYKFYOOZ-RBUKOAKNSA-N 399.494 5.081 30 20 GKED CC(C)(C)CC(O)=Nc1ccc(Cl)c(C(=O)N2CCC[C@@H]3COCC[C@@H]32)c1 328857905 KTUUIGMVBLHOII-KDOFPFPSSA-N 392.927 5.005 30 20 GKED Cc1nc(N=C(O)[C@H]2CCC(=O)[C@H](C)C2)sc1Cc1ccccc1Cl 328893224 ACWFMCWJCQHEDK-RISCZKNCSA-N 376.909 5.289 30 20 GKED CC[C@H]1C[C@@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329406401 CUPSUEPKKAPCIH-IGKRJTOJSA-N 395.547 5.800 30 20 GKED CC(C)c1nc([C@@H]2CCCCN2CC(O)=Nc2ccc(Cl)cc2Cl)n[nH]1 329833051 KOEZHGZHYQCPCM-HNNXBMFYSA-N 396.322 5.050 30 20 GKED Cc1cc2occ(/C(O)=N/C3CCN(/C(O)=N/C4CCCCC4)CC3)c2cc1C 329978430 HOEOGGIIVKMVLB-UHFFFAOYSA-N 397.519 5.065 30 20 GKED CC(C)CCn1ncc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c1C(C)C 425674342 BFIVPOBHXCSKDF-QGZVFWFLSA-N 381.524 5.149 30 20 GKED C=CC[C@H](C(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644377 IAVNKRYFHXISCR-MJGOQNOKSA-N 378.447 5.033 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N(CC(F)(F)F)C2CCC2)cc1 427917986 XBDNIPRUTUJOLM-UHFFFAOYSA-N 392.352 5.047 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(C)nc1Sc1ccccc1 429064706 XITREFVNQMZSGC-UHFFFAOYSA-N 389.480 5.064 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 431947493 AAQWAPZBUXMDHM-DJJJIMSYSA-N 387.405 5.501 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1ccccc1 431980655 KAADULXEWRIZRN-ZYSHUDEJSA-N 385.870 5.069 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccc3)c2)[C@H]1c1cccnc1 432686617 LXRAJRCQCOGWFA-QHCPKHFHSA-N 381.479 5.096 30 20 GKED CSc1ccc(-c2csc(NC(=O)C3(c4cccc(C#N)c4)CC3)n2)cc1 435148898 RGOUJWCMZNZYAF-UHFFFAOYSA-N 391.521 5.074 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 445971798 PGFOEKXVGIIEIF-QMTHXVAHSA-N 397.334 5.066 30 20 GKED C[C@H](C1CC1)N(Cc1ccccc1)C(=O)N[C@H](CCCC#N)c1ccccc1 458798330 HUUDURSTMRWYOI-AUSIDOKSSA-N 375.516 5.432 30 20 GKED CCCOc1ccccc1[C@@H](CC(C)C)NC(=O)N(C)Cc1cccc(C#N)c1 470029711 GGWSQUYFUWAXMD-JOCHJYFZSA-N 393.531 5.276 30 20 GKED C=CCOCCCC(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 470125944 YZQPOEDUKAVTEF-UHFFFAOYSA-N 381.259 5.102 30 20 GKED CC(C)(C)OC(=O)C[C@@](C)(C#N)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471442510 HKDJCHGCTRQGBH-QFIPXVFZSA-N 398.890 5.207 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)sc2C)cc1 474426084 KADKCRYBMYWTSO-QGZVFWFLSA-N 396.537 5.802 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)cc1Cl 476171035 YMDWBLBFXFERJV-UHFFFAOYSA-N 381.825 6.463 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)s1 478555840 VOCIVPSJUDIBNZ-MRXNPFEDSA-N 386.480 5.102 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 485381420 IKIODAUFCYAUBA-UHFFFAOYSA-N 385.552 5.580 30 20 GKED N#CCCN(C(=O)CC1CCC(C(F)(F)F)CC1)C12CC3CC(CC(C3)C1)C2 486575363 NGLVWNXXPBSYBP-UHFFFAOYSA-N 396.497 5.456 30 20 GKED C=CCC[C@@H](C(=O)NCc1ccc(OCc2ccccn2)cc1)c1ccccc1 488678867 WDVHAFPEJKVFJQ-XMMPIXPASA-N 386.495 5.027 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1oc2ccccc2c1CSc1nnc(C)s1 488875406 DTQTXUTZJVFPOD-AWEZNQCLSA-N 399.541 5.066 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(-c2ccco2)cc1F 490502243 XLFIOAPKCYCBMJ-RXVVDRJESA-N 389.430 5.389 30 20 GKED N#C[C@@H](C(=O)c1cccn1C1CCCC1)c1nc(-c2c(F)cccc2F)cs1 496590369 GSHLPPWYYQIGPG-AWEZNQCLSA-N 397.450 5.495 30 20 GKED C[C@H](NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 498407997 IHESGSZXCWALHK-SFHVURJKSA-N 382.463 5.066 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 501450264 GWZNJHYDQCTMJM-UHFFFAOYSA-N 398.462 5.149 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccc(C(F)(F)F)cc1 502276267 NDJICWMXSMSAMV-OAHLLOKOSA-N 399.416 5.137 30 20 GKED C=CCC[C@H](NC(=O)[C@H]1CCO[C@@H](CCC)C1)c1ccc(C(F)(F)F)cc1 503630243 QVNJTZYPTITRSB-WDSOQIARSA-N 383.454 5.424 30 20 GKED COc1cc(C)sc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 507291546 NGYTWVBZOXRMNU-ZDUSSCGKSA-N 388.901 5.332 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 521796396 LMATYYKBLMITTH-UHFFFAOYSA-N 399.475 5.094 30 20 GKED Cc1cc([N+](=O)[O-])ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 522487800 KWJWPBCFAAAERL-INIZCTEOSA-N 397.843 5.170 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@H]1c1c(F)cccc1F 522537813 LACUHIMWDAJHGI-CABCVRRESA-N 380.419 5.307 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N(CC(F)(F)F)C2CC2)c1 522640126 UPMVCMIMPYYKIK-UHFFFAOYSA-N 394.780 5.171 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCCC(F)(F)F 538839922 GQFXRCVMKMWRRU-UHFFFAOYSA-N 378.369 5.272 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCCc3ccc4ccccc4c3)CC2)cc1 539418087 QFCOEAYIQVJDPT-UHFFFAOYSA-N 380.491 5.350 30 20 GKED N#Cc1ccccc1OCc1cccc(-c2nc([C@H]3CCCCS3)no2)c1 547222087 DWDUFQDWYTUCSV-LJQANCHMSA-N 377.469 5.145 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)c2cc(C#N)ccc2Cl)c1 552589885 KYMGKJUBDTUGLI-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc[nH]c3C3CC3)cc2Cl)cc1 582560638 XFRDYHXRJVTJIT-UHFFFAOYSA-N 377.831 5.462 30 20 GKED C[C@@H](Sc1nc2c(cc1C#N)CCCC2)c1nnc(-c2cccc(Cl)c2)o1 585688493 PIGUYLHZAPWWLV-GFCCVEGCSA-N 396.903 5.389 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1 588942539 ZXAVXDUCYAWFSC-UHFFFAOYSA-N 386.883 5.460 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccs3)cc2)ccn1 589363511 RLLFFUTWZRLELY-IBGZPJMESA-N 390.468 5.176 30 20 GKED CC(C)(C)c1nc2ccc(NC(=O)N3Cc4cccc(C#N)c4C3)cc2s1 593166383 UVPSJDQCMWGKQX-UHFFFAOYSA-N 376.485 5.013 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)cc1F 596704062 ZKYWLIOHRYRXEO-MRXNPFEDSA-N 397.450 5.093 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)N1CC[C@@](C)(C#N)C1 596828973 JZBCZVQRARRQAZ-NRFANRHFSA-N 394.475 5.178 30 20 GKED COc1cc(C)sc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 603779749 INFPCQPLIZNFOC-JTQLQIEISA-N 396.415 5.184 30 20 GKED CCCN(C(=O)NCc1cccc(C#N)c1)[C@H](C)c1ccc(Cl)c(Cl)c1 604131143 WPOKNEBSXGQZAO-CQSZACIVSA-N 390.314 5.548 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccccc1Cl 609370974 NVGNMNVSSWHAPB-CYBMUJFWSA-N 376.934 5.323 30 20 GKED COCCc1ccc(Oc2ccc(NC(=O)C3(C#N)CCCCC3)cc2)cc1 609375790 GJYAKYAWCCOENP-UHFFFAOYSA-N 378.472 5.080 30 20 GKED Cc1ccc(-c2ncc(CNCCSCc3ccccc3C#N)s2)cc1 609677680 WKSWHLVTCNUOBZ-UHFFFAOYSA-N 379.554 5.013 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 609967839 KJKXNOVMIYBQNQ-MRXNPFEDSA-N 388.433 5.509 30 20 GKED CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 610121420 SUHOEAHGGJIUDI-FQEVSTJZSA-N 377.488 5.176 30 20 GKED C[C@H](NC(=O)Nc1ccccc1Oc1cccc(F)c1)c1cccc(C#N)c1 610322660 UWEQGKQBQNBGCL-HNNXBMFYSA-N 375.403 5.372 30 20 GKED CC(C)[C@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610349935 LUNNUDMQEMDNDG-LIRRHRJNSA-N 389.421 5.335 30 20 GKED CCCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@H](C)c1cc2ccccc2o1 610357020 FPYUDUSPTPCZRH-DLBZAZTESA-N 375.472 5.548 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccco2)s1)c1cccc(C(F)(F)F)c1 610806615 OMVSEDQUENRDAG-ZDUSSCGKSA-N 376.359 5.022 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@@H]3c3cccc(F)c3)c2)cc1 611049277 FPWZLZMBCLWLTQ-JOCHJYFZSA-N 387.414 5.469 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)cc1 612313959 NKYMHJUGDKWMIA-HTAPYJJXSA-N 379.529 5.697 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618841881 COYKMIBIIJRIRY-IBGZPJMESA-N 388.298 5.084 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccs2)c2ccc(OC)cc2)c1 726444668 JZHGSMJCGWBUMG-UHFFFAOYSA-N 378.522 5.142 30 20 GKED Cc1cccc(C(=O)/C=C/c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c1 729936913 IMXZMXNYRUYQOP-DHZHZOJOSA-N 376.408 5.070 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(SC(F)F)cc2)c1 731952967 HVYSAHVQORSMRD-UHFFFAOYSA-N 376.428 5.061 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 734965170 IICUPUMTPSFDGX-DNVCBOLYSA-N 394.927 6.142 30 20 GKED COCc1cccc(/C=C2\CCc3nc(-c4ccc(OC)cc4)sc3C2=O)c1 742434851 OVOYEXSTDGVBBQ-QGOAFFKASA-N 391.492 5.178 30 20 GKED Cc1ccc([C@@H](C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 742630444 JMTJPBZOZKTCSV-OAHLLOKOSA-N 394.858 5.434 30 20 GKED Cc1nc(COC(=O)c2ccccc2SCc2ccc(C#N)cc2)sc1C 744255135 GYKDJJAYRAHDTB-UHFFFAOYSA-N 394.521 5.281 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(SCC(F)F)cc1 753144717 RDNLVKVCNPLCRM-HJWRWDBZSA-N 388.464 5.458 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3ccccc3OC3CCCC3)cc2N1 758027265 VTVGUUPXIBPULU-MDZDMXLPSA-N 385.510 5.010 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2nccn2CCc2ccccc2)cc1 766529624 QTEDIVDCBRATKN-LJQANCHMSA-N 395.934 5.108 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccccc2)CC1)c1nc(-c2c(F)cccc2F)cs1 771267508 UYIBJHQPJFWSOL-HNNXBMFYSA-N 394.446 5.287 30 20 GKED O=C1C/C(=C/c2ccc(-c3nc4ccccc4s3)o2)C(=O)c2ccccc2N1 774147224 YRHIIAZQVYRGNX-QBFSEMIESA-N 386.432 5.165 30 20 GKED COc1ccc(O)c(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1 779595261 GTSKMEOUHKXZCP-UHFFFAOYSA-N 394.858 5.117 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@H]1/C=C\c1cccs1)c1ccncc1 783230391 MCUJIFYEUSSSBJ-AKFUDEIGSA-N 381.545 5.428 30 20 GKED N#C[C@H](NC(=O)CCCc1ccsc1)c1ccc(OCc2ccccc2)cc1 783509230 OEWATTHYYKNTQY-QFIPXVFZSA-N 390.508 5.031 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)[C@H](C)Oc1ccc(Cl)cc1Cl 789075822 CGCGLUXGGUDDKJ-LBPRGKRZSA-N 390.270 5.090 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nnc(-c2ccccc2F)s1 795987341 CFYTVPBAYLQSHF-GDBMZVCRSA-N 395.459 5.036 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)cc1 796749648 ZZLQJMJTPCKUIH-AUUYWEPGSA-N 384.426 5.273 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCSc2ccc(Cl)cc2)s1 797568055 FAXVTHPLOHAVAG-AWEZNQCLSA-N 378.950 5.453 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)c1cc(C#N)ccc1Cl 802863556 ULHUEJGQRWVNPA-UHFFFAOYSA-N 385.851 5.119 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccs2)CCCCC1)c1cnc2ccccc2n1 810716645 KOQLFEPXHSFRPC-KRWDZBQOSA-N 375.497 5.061 30 20 GKED COCC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 834891507 IRHHXHVUHKZDKN-MGPUTAFESA-N 392.421 5.036 30 20 GKED CC(C)(C)OC(=O)N1CCc2cccc(/C=C/C(=O)c3cc4cnccc4o3)c21 849252547 WGJOZHQGAFYWKR-BQYQJAHWSA-N 390.439 5.022 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1ncnc2sccc12 914555013 FZJZYKVRLGFRDK-UHFFFAOYSA-N 396.907 5.100 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2nc3ccccc3s2)cc1 914772080 JJBJSBMDQASPHI-UHFFFAOYSA-N 381.505 5.006 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2cc1C 915179168 AUDNVDYRTHKIIQ-DEOSSOPVSA-N 394.474 5.886 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cc2ccccc2s1 916945005 PVHMVCKZMLTQEK-CQSZACIVSA-N 389.263 5.169 30 20 GKED N#C[C@H](COC(=O)CCCCc1nc2ccccc2s1)Cc1ccc(F)cc1 920879990 QQSDBGQDYBNBHQ-QGZVFWFLSA-N 396.487 5.074 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(OC(C)C)c3)n2)cc1 921131470 JUDHMUXKHYSJKD-FQEVSTJZSA-N 390.508 5.325 30 20 GKED Cc1cc(NN=Cc2cc(C(=O)O)c(Cl)s2)nc2ccc(Cl)cc12 1776021653 WGFXRHWNEMRXCK-UHFFFAOYSA-N 380.256 5.056 30 20 GKED Cc1cc(C=NNc2ccc(C(=O)O)c(F)c2)c2c(C)ccc(C(C)C)cc1-2 1776073163 GVIOYYHGHXCFCX-UHFFFAOYSA-N 378.447 5.815 30 20 GKED C=CCCCc1ccc(C(=O)NCc2cc3sc(C(=O)O)cc3s2)cc1 1776174488 AHCPMGKJTUVGIA-UHFFFAOYSA-N 385.510 5.100 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NC/C(C)=C/c1ccccc1C(F)(F)F 1776782387 POFOYJHSCHTCMV-QCUIPMNBSA-N 385.470 5.902 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776801699 JJNVBHCQQLFLGT-POHAHGRESA-N 380.465 5.675 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)CC(C)(C)C)CCC2)cc1 1789451667 QUADYALRXHHZJZ-FQEVSTJZSA-N 382.548 5.325 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(COC(C)C)cc3)n2)cc1 41512715 MWOLVDFURRBJRC-FQEVSTJZSA-N 390.508 5.534 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 45323756 LISJTGRFGBBNBN-DEOSSOPVSA-N 395.462 5.235 30 20 GKED C[C@H](Oc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443760 VKFAWUJGDJTUJJ-SUMWQHHRSA-N 382.872 5.107 30 20 GKED Cc1ccc(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)s1 71794998 CODBLMQFSSXKNS-ZHACJKMWSA-N 385.492 5.259 30 20 GKED COc1ccccc1Oc1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc1 111390234 AECZRIURTFQBLK-SFHVURJKSA-N 388.467 5.068 30 20 GKED CSc1ccsc1C(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1 157696840 OQPZGHPIOCSEKQ-SFHVURJKSA-N 394.521 5.044 30 20 GKED N#CCOc1ccc(CNC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1 170785335 AVNRBNDXAOSHSF-UHFFFAOYSA-N 391.279 5.040 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 176881534 WFWXWPZCEHKQDN-FQEVSTJZSA-N 392.890 5.153 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)Nc3ccccc3O[C@H](C)C#N)oc12 180026080 PBRDWSMOEWNYEW-CABCVRRESA-N 393.443 5.005 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 180075518 JCUYBJKIRKLHES-JKSUJKDBSA-N 383.517 5.361 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)s2)o1 181565575 SLZNWFBDNVKDGD-AWEZNQCLSA-N 391.477 5.325 30 20 GKED Cc1cc([C@@H](C)NCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)s1 182745252 PFIFSROJSKBQAR-UKRRQHHQSA-N 387.574 5.049 30 20 GKED C=CCn1c(S[C@H](C)c2noc(-c3ccccc3)n2)nnc1-c1ccccc1 189444763 UZHKVQPVDDLWOZ-OAHLLOKOSA-N 389.484 5.034 30 20 GKED C=CCc1cc(CNCc2csc(-c3ccc(C)cc3)n2)cc(OC)c1OC 237300497 ANNFOPMFKVVVAU-UHFFFAOYSA-N 394.540 5.154 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cnc(-c4ccccn4)s3)c(C#N)c2[C@@H](C)C1 411008562 IKSZBABNLGMIRL-RYUDHWBXSA-N 394.525 5.076 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H]2c3ccccc3CC23CCOCC3)cc1 411742437 DKAUPGWUSLPYAN-AREMUKBSSA-N 394.518 5.409 30 20 GKED CCO[C@@H](C)c1nc(CN(Cc2cccc(C(F)(F)F)c2)[C@@H](C)C#N)cs1 425541837 XKADDFUQJXOHNC-KBPBESRZSA-N 397.466 5.174 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(-c3ccccc3Cl)o2)s1 430592444 HJFFCTJYZCLZOZ-CYBMUJFWSA-N 384.888 5.844 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc2oc(C3CC3)nc2c1 437927376 PJCQSSYTLWEMFP-UYAOXDASSA-N 386.455 5.009 30 20 GKED C[C@H]1CCC[C@H](C)N(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 437984140 GLZFVOGDEOPGKL-IRXDYDNUSA-N 395.478 5.319 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)cc3cccnc23)cc1C(F)(F)F 443874395 BMOAGDUCFRNDCF-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#CCCCn1cc(C(=O)N(Cc2ccoc2)C2CCCCC2)c2ccccc21 444240423 DFYNTEOMKVSTHL-UHFFFAOYSA-N 389.499 5.513 30 20 GKED C[C@H](NCc1cncc(C(F)(F)F)c1)c1ccc(-c2cccc(C#N)c2)cc1 463155365 NDFGEGMBKYPITL-HNNXBMFYSA-N 381.401 5.490 30 20 GKED Fc1ccc([C@@H](NCc2cncc(C(F)(F)F)c2)C(F)(F)F)cc1Cl 463210395 NETOBTOXZIVUIZ-CYBMUJFWSA-N 386.698 5.286 30 20 GKED C[C@H](C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1)c1cccc(C#N)c1 464132279 OTBKQYHIGKWTQB-AWEZNQCLSA-N 378.378 5.371 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 466192887 FGLYFSKZYGAIHT-SFHVURJKSA-N 392.261 5.051 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)c1ccccc1-c1ccccc1C#N 470215241 UISJVGDICYACIS-UHFFFAOYSA-N 380.369 5.805 30 20 GKED C=CCC1(C(=O)N2CCC[C@@H](c3nc(-c4ccccc4OC)cs3)C2)CCC1 470413468 FTJODPKDJMJAHP-QGZVFWFLSA-N 396.556 5.271 30 20 GKED CC(C)OCc1c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)oc2ccccc12 474433821 KCTBSCQGPSEUOP-HNNXBMFYSA-N 382.485 5.428 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC(N2CCC(C)CC2)CC1 475553316 UHFGBKWIIJEGJN-UHFFFAOYSA-N 397.607 5.703 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1C 479862998 QFFGAYWLRKTSBU-CQSZACIVSA-N 392.434 5.218 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480382470 UZEHRTATINPGLY-UHFFFAOYSA-N 375.403 5.154 30 20 GKED COc1ccccc1CN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 483406622 LQKRFPOEBAUDIV-UHFFFAOYSA-N 398.462 5.164 30 20 GKED CCCN(C(=O)CSc1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 483475224 ZAEDLJSILHAPPG-MRXNPFEDSA-N 378.497 5.396 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1 486252157 FJCDUXFJPBAZQP-UHFFFAOYSA-N 388.920 5.010 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Oc2ccccc2F)nc1)c1ccccc1 490195259 UBXXPEIFJPQIGD-IBGZPJMESA-N 390.418 5.180 30 20 GKED O=C(c1cc(F)c(F)c(F)c1F)N(Cc1ccccc1C(F)(F)F)C1CC1 496581135 CHZPCGPLAQCNKV-UHFFFAOYSA-N 391.286 5.067 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)CCCCOc1cccc(C#N)c1 498820428 FEXPOESRZCEGBU-UHFFFAOYSA-N 384.451 5.062 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1F 499607829 HHMZBKKXKRPZRS-UHFFFAOYSA-N 392.405 5.171 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCc2c(Br)cccc2C1 505029103 LJRPPTWGDMGJDR-UHFFFAOYSA-N 385.305 5.158 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1 509549997 RWPUJOUAKOTWIR-LBPRGKRZSA-N 378.259 5.409 30 20 GKED N#CCCn1cc(/C=C/c2nc([C@@H]3C[C@H]3c3ccccc3)no2)c2ccccc21 511985376 BMGWOILOFIPTBL-LBNTZDJNSA-N 380.451 5.379 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H]1CCO[C@@H](C(C)C)C1 513658767 WOANQJRTJJOCFV-WMZHIEFXSA-N 392.499 5.439 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 518143605 OHRADXLBELMBTN-CYBMUJFWSA-N 379.460 5.186 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(OC(F)F)c3)cc2)cc1 518370274 LFABUFOJDIGFIM-UHFFFAOYSA-N 394.377 5.399 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1ccc(F)cc1F 519065289 FLPUVHGWTZAUSJ-CQSZACIVSA-N 393.393 5.068 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C 520197866 ROWUQQMDBARSCB-OXJNMPFZSA-N 381.545 5.990 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccc(Cl)cc1 521242228 WSZYQNSGRDSISF-OAHLLOKOSA-N 393.855 5.204 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N(CC(F)(F)F)C2CC2)c1 523957401 XAPAYXMUWZHKAT-UHFFFAOYSA-N 394.780 5.171 30 20 GKED C=CC1CCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)CC1 525047992 ZGCGTLDTNFFXRL-UHFFFAOYSA-N 377.271 5.219 30 20 GKED C=C(C)COc1cc(CNc2ccccc2OCc2cscn2)ccc1OC 533211621 PVSHKRQOCCWWNG-UHFFFAOYSA-N 396.512 5.298 30 20 GKED C=C[C@H](CC(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C)c1ccccc1 533923362 DWFHMZQFZFQNJT-LJQANCHMSA-N 399.494 5.937 30 20 GKED N#CCCn1cc(C(=O)CSc2cccc(Cl)c2C#N)c2ccccc21 538947137 VQJBJICDDXOGSN-UHFFFAOYSA-N 379.872 5.055 30 20 GKED Cc1cccc(-n2c(SCC3(C#N)CC3)nnc2-c2c[nH]c3ccccc23)c1 539756446 GFKRJZURAYVXMF-UHFFFAOYSA-N 385.496 5.120 30 20 GKED COc1ncc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1Cl 542018055 INJJYSRAPTZFPA-HNNXBMFYSA-N 377.875 5.133 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 545377697 BWDWNGVQOAYICH-GOSISDBHSA-N 394.540 5.771 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cccc4cnccc34)no2)c2ccccc21 545696521 UDFXFAIIFQEITI-KTKRTIGZSA-N 391.434 5.324 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 549212780 AOKCBWOWDONSMR-IBGZPJMESA-N 390.527 5.185 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2NCCCc2ccccc2)c1 552188940 UEYRLPAFYVVVIK-UHFFFAOYSA-N 389.886 5.509 30 20 GKED C[C@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1ccc(Br)cc1 567549600 MWFNQFHJAFKTNV-CQSZACIVSA-N 389.268 5.029 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(C)[C@H]1CCCc2ccccc21 574386657 DEHCIHRIPMWESJ-UTKZUKDTSA-N 393.556 5.029 30 20 GKED CC(C)(CCC#N)CNC(=O)c1sc(-c2ccco2)nc1-c1ccccc1 588782967 MDMJKMMBXDMAOI-UHFFFAOYSA-N 379.485 5.130 30 20 GKED C=CCN(Cc1ccccc1)C(=O)NCc1sc(-c2ccccc2)nc1C 589790066 DKXIGLLRHFYMHI-UHFFFAOYSA-N 377.513 5.016 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H](CCF)C2)cc1Cl 596690591 HDICLPXIHGRKNR-OXQOHEQNSA-N 399.897 5.599 30 20 GKED C[C@H]1CC(F)(F)CCN1C(=O)c1ccccc1SCc1ccc(C#N)cc1 600450539 WNWHZVZYRFZBNU-HNNXBMFYSA-N 386.467 5.110 30 20 GKED C[C@@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 604699260 KELIQCMAUDHXCG-MUYACECFSA-N 399.350 5.345 30 20 GKED Cc1cc(C)c(C)c(OCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 609376918 LRAYACZKKVMAML-INIZCTEOSA-N 382.529 5.271 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCc1ccccc1 609378682 ZNHBAWKVOKVTFB-UHFFFAOYSA-N 378.419 5.282 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(c3ccccc3)C3CCCC3)cc2)nc1 609505205 ITGKRCPIJIZOIT-UHFFFAOYSA-N 383.451 5.335 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)c1cccc(F)c1 609826859 HAWKRPQSXPMOMU-HNNXBMFYSA-N 385.508 5.177 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609970555 QNFMKWXLJJVLNA-QGZVFWFLSA-N 388.442 5.094 30 20 GKED Cc1ccc2cccc(C(=O)Nc3sc4c(c3C#N)CCCCCC4)c2n1 610152441 YLBXMNZMDDJTPW-UHFFFAOYSA-N 375.497 5.388 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](CC1CC1)c1ccccc1 611395730 RQUKUQZAUFIZJP-DYESRHJHSA-N 393.556 5.150 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cc(C)ccc4nc3C)n2)cc1 613314325 KSZNLHAPTAPFGD-FQEVSTJZSA-N 397.503 5.774 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(-c2csc(C)n2)cc1 615486659 AHDYFPBPMFOESO-UHFFFAOYSA-N 393.512 5.347 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 618741952 OBNNFRHDPBQNSK-QGZVFWFLSA-N 384.323 5.373 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c(C)cc1C 619536357 UCVYQRFDHHNAGH-UHFFFAOYSA-N 388.427 5.015 30 20 GKED Cc1nc([C@@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cs1 647323536 WPLZQWGHLAWVEQ-MRVPVSSYSA-N 386.336 5.914 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 671910450 ZAMCRPYOCXCWIR-LJQANCHMSA-N 381.438 5.058 30 20 GKED O=C(CCCCCc1ccc(F)cc1)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 681664839 MZXNPICLQAROKD-GASCZTMLSA-N 399.350 5.128 30 20 GKED C=CCNC(=S)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 726749989 DGAMJQXXHLPHJC-UHFFFAOYSA-N 399.903 5.046 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/Cc3c(C)cccc3C2=O)cs1 729151685 VUUBRRJRNWXKLR-GDNBJRDFSA-N 392.455 5.098 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(-c3ccc(OC)cc3)cc2F)c1C#N 730182361 GGZMXBBJLNGLSG-UHFFFAOYSA-N 394.471 5.558 30 20 GKED Fc1ccccc1-c1nc2c(s1)C(=NNc1ncnc3sccc13)CCC2 731924754 JDASVOHNZUCUGG-UHFFFAOYSA-N 395.488 5.106 30 20 GKED CC(=O)Nc1ccc(NC(=O)Nc2cccc(C#Cc3cccs3)c2)cc1C 733618452 AFXVCZAVVPDSBY-UHFFFAOYSA-N 389.480 5.059 30 20 GKED C#CCOc1ccc(NC(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)cc1 733634613 UBASHKFFCLESEB-SFHVURJKSA-N 385.467 5.516 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733680825 IZLKYHGYHACETO-UKRRQHHQSA-N 396.434 5.229 30 20 GKED COc1cc(C(=O)O[C@H](C)CC#N)ccc1OCc1ccc(Cl)cc1Cl 733710636 FYXDBLZUTJJDEB-GFCCVEGCSA-N 394.254 5.040 30 20 GKED O=C1/C(=C\c2nccn2Cc2ccccc2)CCOc2c1ccc(Cl)c2Cl 734096011 VDHLQVUAMLURHU-QINSGFPZSA-N 399.277 5.287 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)OC(=O)c1ccccc1OCC#N 734737734 BAWWCMCNJQSISI-CQSZACIVSA-N 396.443 5.078 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccnc3ccccc23)cc1 735429306 RPEFQZBTFZWUND-INYRMVIESA-N 389.458 5.542 30 20 GKED CCO[C@H](C)c1nc(COC(=O)c2ccccc2-c2ccccc2C#N)cs1 736747946 VDEPHPVCFMBXTL-OAHLLOKOSA-N 392.480 5.136 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)cc1 743294208 DOYSMCKMEMQNDN-ZRBLBEILSA-N 385.442 5.159 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 744031332 KRZVPJZVJCBXGA-RBAQFSTRSA-N 396.556 5.669 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1cccc(OCc2cccc(C#N)c2)c1 746345481 FXKBPRKIODZKHF-QXMHVHEDSA-N 399.494 5.428 30 20 GKED Cc1sc2ncn(N=C[C@@H]3CCCc4ccccc43)c(=O)c2c1-c1ccccc1 752158610 WEGJVBNLMGIBJD-IBGZPJMESA-N 399.519 5.387 30 20 GKED CC(/C=C\C(=O)c1ccc(N2CCC(O)CC2)cc1)=C/c1ccc(Cl)cc1 753718306 WLKNBEMXHMBAJP-YLYBUDPASA-N 381.903 5.144 30 20 GKED N#Cc1c(F)ccc(/C=C/C(=O)c2ccc(Br)cc2F)c1Cl 761480777 TXVAKLNLZJEUHG-QHHAFSJGSA-N 382.591 5.148 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2cccc(NC(=O)CCC)c2)cc1 764987257 ANQOENPEDDGEJZ-QGZVFWFLSA-N 386.923 5.407 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=S)Nc1ccc(C#N)c(Cl)c1 766547131 CHGFPKWUTRBYGG-INIZCTEOSA-N 397.853 5.500 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(NC(=O)OC(C)(C)C)c(C)c1 772026645 VWWSNQAEYIHDLG-UHFFFAOYSA-N 386.517 5.232 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2ccccc2OC(F)(F)F)c1Cl 777452304 UWYJZNMYECGCOB-UHFFFAOYSA-N 394.784 5.085 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792105366 MGUGBHJVCNFWRT-DOOKAGJSSA-N 382.341 5.023 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792105397 MGUGBHJVCNFWRT-IBSYWUHOSA-N 382.341 5.023 30 20 GKED COCCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CC[C@H](C)C1 792230709 XJYRTKORHYBJNG-OFAXGOBFSA-N 391.515 5.011 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2cnc(-c3ccc(Cl)cc3)s2)cc1 792926170 PLTLQRYEBBQBJT-VAWYXSNFSA-N 396.899 5.061 30 20 GKED CN(C)Cc1cnc(/C=C/C(=O)c2ccc(-c3ccc(Cl)cc3)s2)s1 794698134 MSEXYCVQOMRIRY-JXMROGBWSA-N 388.945 5.483 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)C(=O)c1ccc(Cl)cc1 797568016 NIOFGIBREYHAJS-DOMZBBRYSA-N 388.920 5.179 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2ncc(-c3ccccc3)s2)C(=O)c2ccccc21 802709117 ZQSJGMLHGRCOJL-XCTGESOMSA-N 389.476 5.127 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1c(F)cccc1Cl 809159019 GJIMQTJSWLCCHF-BQYQJAHWSA-N 388.807 5.407 30 20 GKED N#C[C@H](C(=O)CCSc1ccc(Cl)cc1)c1cc(C(F)(F)F)ccn1 813218805 ZPIVNJGTDLGPIO-AWEZNQCLSA-N 384.810 5.112 30 20 GKED N#CCCC[C@H](NCc1cc(Br)cnc1Cl)c1ccccc1 842710086 JWSKMHBKUUUKQW-INIZCTEOSA-N 378.701 5.022 30 20 GKED CC(C)(C)OC(=O)N1CCc2c(NCc3ccc(C4(C#N)CC4)cc3)cccc21 850180618 AGIJXOYCZHIVSI-UHFFFAOYSA-N 389.499 5.151 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)CC(F)(F)F 854303307 KIWBPXKADLTVDJ-SFHVURJKSA-N 389.421 5.442 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1ccccc1 916134273 FSCLCYWLNMRXCY-FMIVXFBMSA-N 396.273 6.142 30 20 GKED Cc1cccc(CCC(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 916909617 PZHDFJNAUKPUPH-NRFANRHFSA-N 398.462 5.068 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1sc(-c2ccc(Cl)cc2)nc1C 1776086948 ZCDLVMBRISJMMT-UHFFFAOYSA-N 399.903 5.615 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)cc1 1776125613 NKLIODJWOLXPOH-QHIITQONSA-N 398.474 6.015 30 20 GKED C=CCCC1(C(=O)O)CCN(CCSc2cc(Cl)ccc2Cl)CC1 1776169577 USYFRQSTEHDUPV-UHFFFAOYSA-N 388.360 5.219 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1/CCc2oc(C(=O)O)c(C)c2C1=O 1776200021 RKCMLJHNJWTCBZ-RGPVUHAUSA-N 390.357 5.464 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(C(=O)O)s2)c2c(c1)C(C)(C)CC2 1776269190 BVPJWCBBXYEOCD-VURMDHGXSA-N 382.525 5.864 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1ccc(C#N)c(Cl)c1 8331518 YZCITWIQTQUGCK-UHFFFAOYSA-N 388.279 5.549 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2c(C)cc(C)cc2C)nc2ccccc21 12046251 FLCVIINWOHZQSA-QGZVFWFLSA-N 379.529 5.267 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2OCc2ccccc2Cl)cc1 15029177 BWHDDHVCNCYRAA-UHFFFAOYSA-N 376.843 5.237 30 20 GKED C=CCOc1cccc(/C=C(\Cl)c2nnc(C(=O)Nc3ccccc3)s2)c1 26223968 HATVCBVNXDUJLY-LGMDPLHJSA-N 397.887 5.092 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F 66954439 MDLNUYYXVCYELO-MELADBBJSA-N 385.455 5.323 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](Oc2ccc(Cl)cc2)c2ccccc2)n1 68721855 FCAGSMVPHNDHOT-PKOBYXMFSA-N 382.872 5.102 30 20 GKED CSc1cccc(NC(=O)[C@H](C)Nc2ccccc2SC[C@H](C)C#N)c1 108407471 ZJMAIFAMAKGSBG-CABCVRRESA-N 385.558 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccccc1OC1CCC1 118544470 VLFAXMXPRPWOLW-INIZCTEOSA-N 395.528 5.191 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(Cl)cc2Br)c1 127306158 CTNSBTIFDSYNOT-INIZCTEOSA-N 393.712 5.073 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(N(C(C)=O)c2ccccc2F)n1 131313801 FIJNLVRSUAFHFC-UHFFFAOYSA-N 395.503 5.155 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 131803793 RKNINQAXRMOZMO-GJZGRUSLSA-N 386.542 5.066 30 20 GKED C=CCOc1cccc(CNc2cccc(C[S@@](=O)Cc3ccccc3)c2)c1 133163855 JHRRKRKBIXDXCG-MUUNZHRXSA-N 391.536 5.312 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 133191747 NRENPMUBXSZCMH-CQSZACIVSA-N 375.428 5.088 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nccs1 153035948 UCIRQIXPWFKDET-SFHVURJKSA-N 378.457 5.080 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2cccc(F)c2)c2ccccn2)ccc1OC 154060351 HLUFBKJJUUGNQB-DEOSSOPVSA-N 392.474 5.063 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)c2ccc(Br)cc2)n1 156452338 MPFQPGKDXLNVEM-FZMZJTMJSA-N 377.307 5.009 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)ccc1Cl)c1nc2cc(Cl)ccc2s1 161401026 PYHKVJOXRVOMQV-JTQLQIEISA-N 396.686 5.502 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(C(F)F)c1 171538027 NZADAMPTJOSGST-UHFFFAOYSA-N 379.366 5.244 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)Nc1ccc(F)cc1C#N 181299280 XRAZKFDBSRJFSK-UHFFFAOYSA-N 390.201 5.220 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 183420766 RUYZZYNWKPRCGE-UHFFFAOYSA-N 398.482 5.137 30 20 GKED CCn1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c2ccccc21 193665074 YTYCTPADFNJDLK-SFHVURJKSA-N 396.475 5.146 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1cccc(OCCCC#N)c1 237335246 NTVVROFDAHUAHP-QGZVFWFLSA-N 391.540 5.652 30 20 GKED Cc1nc(-c2cccc(NC(=O)[C@@H](Oc3ccccc3C#N)C(C)C)c2)cs1 302953147 KPQVAXMDKYICLC-NRFANRHFSA-N 391.496 5.032 30 20 GKED COc1ccc2c(c1)c(C(O)=Nc1nncn1C1CC1)c(C)n2C1CCCCC1 329099441 DFEKRIDUEYKFAK-UHFFFAOYSA-N 393.491 5.026 30 20 GKED CN1CCCC[C@H]1CCC(O)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329248460 SMQGESNWWVEQSV-SFHVURJKSA-N 389.515 5.847 30 20 GKED Cc1cc(CC/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)cc(C)c1O 329913134 XDMXSZRNQCXWGZ-HXUWFJFHSA-N 395.547 5.015 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@H](C)CC3)s1 410990036 VNSHMIHYXOHIBR-JFGNBEQYSA-N 389.546 5.030 30 20 GKED N#CCC[C@@H](NC(=O)NCc1ccc(COc2ccccc2)cc1)c1ccccc1 429071595 PZNKABORBKOONP-XMMPIXPASA-N 399.494 5.110 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(C(=O)c2ccccc2)c1)c1ccccc1 433148399 APZMXSZMLQKVSV-QHCPKHFHSA-N 397.478 5.474 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)C1CCC(C(F)(F)F)CC1 435640916 FAEUCJOEHWGITF-UHFFFAOYSA-N 387.295 5.074 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccccc1 435761173 PFWSGEIFQNQWHU-JOCHJYFZSA-N 381.495 5.119 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ncc(Cc2cccc(Cl)c2Cl)s1 436125954 LDGSFGAUFJMRHI-UHFFFAOYSA-N 392.267 5.066 30 20 GKED N#CC1CCC(CN[C@@H](c2ccc3c(c2)OCCO3)c2ccccc2Cl)CC1 442868044 PQUJGZZJCOBPBT-OCJFHSIUSA-N 396.918 5.120 30 20 GKED O=C(Cc1ccc(NCC#Cc2ccc(Cl)cc2)cc1)Nc1ccccc1F 443544987 XVPXOQGFPPFFIM-UHFFFAOYSA-N 392.861 5.124 30 20 GKED C[C@H](c1ccccc1)N(CC(=O)Nc1ccccc1SCC#N)CC1CCC1 444223124 GYBNFCANNHBSRH-GOSISDBHSA-N 393.556 5.104 30 20 GKED Cc1cc(-c2ncccc2NC(=O)N[C@H](CCC#N)c2ccccc2)cs1 446429418 JIEVQFZSVJJXRH-GOSISDBHSA-N 376.485 5.285 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(Br)s1 462223756 PUYASGRGDRNOOY-UHFFFAOYSA-N 386.274 5.182 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C 466121368 HSSYWFKVFSWEAF-HVETUWLQSA-N 395.934 5.529 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2cccc3cccnc23)cc1 466371091 GSCQOGNYWKFJFJ-UHFFFAOYSA-N 393.446 5.484 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)c1cncc(F)c1 469317186 QEJXWWCVNYYJCD-UHFFFAOYSA-N 398.303 5.146 30 20 GKED C[C@H]1CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c2c(O)cccc21 469318133 XCBPUVJSTRDRLU-INIZCTEOSA-N 384.435 5.210 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)cc1)c1ccccc1 472501660 ODRGAKLCEUKLOG-DYESRHJHSA-N 395.462 5.203 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Br 473681943 LTRSYSYMNFYAJN-CYBMUJFWSA-N 389.318 5.404 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCC(F)(F)F)cc1 476165033 WAJRRFRIWJQONF-UHFFFAOYSA-N 377.406 5.732 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)[C@@H](C)Oc2ccccc2C#N)o1 477895485 MUNGSCNOFCPAMF-CQSZACIVSA-N 380.831 5.186 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c(Br)c1 481192901 BIFMNTYSWVNQSE-GOSISDBHSA-N 375.697 5.215 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(OCc2ccccn2)c1 485746503 UCKSTTJUHIHEPS-UHFFFAOYSA-N 376.481 5.191 30 20 GKED C[C@@H](Nc1c(C#N)cnc2c(F)cc(F)cc12)c1nc2ccccc2n1C(F)F 486453987 WNBPPNNHLSPUKC-SNVBAGLBSA-N 399.351 5.303 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(N2CCCC[C@H]2C)cc1C 493877631 BKUZTQWKALFKEL-LJQANCHMSA-N 381.520 5.229 30 20 GKED Cn1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C1CCC1 496025992 AZJAAUKGBYWAQE-KRWDZBQOSA-N 395.915 5.560 30 20 GKED N#CCCCOc1cccc(N[C@@H](c2cccnc2)c2cc3ccccc3o2)c1 498752794 CQIHPZXJAALIOX-DEOSSOPVSA-N 383.451 5.712 30 20 GKED C[C@H](NCCCC1(C#N)CCOCC1)c1ccccc1-c1ccc(Cl)cc1 499604803 GGJDPFRUBGFVTL-SFHVURJKSA-N 382.935 5.758 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCCC[C@@H]1C(F)F 502227926 MXLIFGPBRLPZAH-LJQANCHMSA-N 385.414 5.311 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1/C=C\c1ccccc1 506683890 UFFDSWWBRHXFEK-HSDOYDEGSA-N 391.540 5.648 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@@H](Cc2nc(C3CCCCCC3)no2)C1 510942369 ALOSRMRDVBOTPF-SFHVURJKSA-N 385.552 5.057 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)c3ccc4c(c3)oc3ccccc34)CC2)c1 511155361 UBBFWZLEBRDNJB-UHFFFAOYSA-N 396.446 5.141 30 20 GKED CCN(C(=O)c1cc(OC)c(C(C)C)c(OC)c1)c1ccc(C#N)c(Cl)c1 511593194 NMSXGHOSFDSYEZ-UHFFFAOYSA-N 386.879 5.019 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1 521190502 CRZMTJRURPYRGI-UHFFFAOYSA-N 375.394 5.267 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(C(C)(C)C)cc1 521261708 WWFUAKYGMGXSLF-QGZVFWFLSA-N 395.572 5.900 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@]1(C)CCCc2ccccc21 522977182 AXLJZUJURNWJAO-VWLOTQADSA-N 397.478 5.287 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(Cl)cc2Br)c(C#N)s1 536973533 LQQFEPUENKBTCW-UHFFFAOYSA-N 397.725 5.585 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2Cl)cc1 537306347 UHFJGPPFACFYAO-QMHKHESXSA-N 376.887 5.660 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccc(F)cc2)c2cccs2)c1 539711974 BTOBGQNHHOYHLZ-QFIPXVFZSA-N 380.488 5.449 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)Nc1cccc(OCCCC#N)c1 540726373 RDNAFVMYDHLURS-QGZVFWFLSA-N 391.540 5.898 30 20 GKED COc1ccc2oc([C@@H](C)NCc3ccc(C#N)cc3OC(F)F)c(C)c2c1 542581546 CIXJZILQJNNMIG-CYBMUJFWSA-N 386.398 5.074 30 20 GKED C[C@@H](NCc1cnn(Cc2ccccc2)c1)c1ccc(-c2cccc(C#N)c2)cc1 543875554 BUYYELXQPLJUBX-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C[C@@H](C#N)CN(C)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 549658615 DKSVRCJRCKEZBZ-KBXCAEBGSA-N 381.442 5.128 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(-n2cccn2)c(F)c1 550895225 RHKKUIWJCGCDOB-SJDLUZLQSA-N 388.490 5.066 30 20 GKED N#Cc1ccc(NCc2ccnc(OCc3ccccc3)c2)cc1C(F)(F)F 553491023 VTMUSBKMCWEQSZ-UHFFFAOYSA-N 383.373 5.163 30 20 GKED CC(C)(C#N)CCCCN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 560179805 VXUAKUWFNHFCDV-LJQANCHMSA-N 382.470 5.483 30 20 GKED Cn1ccc([C@@H](N[C@@H]2CCCCc3cc(C#N)ccc32)c2ccc(Cl)cc2)n1 564813588 FSWRQNRRVKEYQC-GGAORHGYSA-N 390.918 5.092 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2csc(C(F)(F)F)n2)n1 575094059 MTQNQYGLSMOJHN-VIFPVBQESA-N 397.275 5.290 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@H]2C[C@H](c3ccc(Cl)c(Cl)c3)C2)c1 583397410 UPNABZIZJRDNHU-JOCQHMNTSA-N 379.674 5.194 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cccc4ccccc34)cn2)cc1 603764169 GHMQNSXOYHXZMZ-UHFFFAOYSA-N 379.419 5.080 30 20 GKED N#CCCCOc1cccc(NC(=O)CCn2c3ccccc3c3ccccc32)c1 603972308 KVUHQTUILQGLGM-UHFFFAOYSA-N 397.478 5.506 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C 606813885 DBZXFLJPFVBUHO-UHFFFAOYSA-N 396.560 5.559 30 20 GKED Cc1cnc([C@@H](NC(=O)Nc2cccc(C#Cc3cccs3)c2)C2CC2)s1 608273011 AQMDDPBMLVQRRV-IBGZPJMESA-N 393.537 5.186 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2ccc(OCc3ccccc3)cc2)oc2ccccc12 609028812 QWIBLHMMAZFZAP-QFIPXVFZSA-N 396.446 5.315 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc3ccccc3n2CC#N)c(C)c1 609168845 IDNGIHOUJKAGJX-MRXNPFEDSA-N 377.513 5.616 30 20 GKED CC(C)c1nc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cs1 609378547 VDLGFAUGWIMOMZ-UHFFFAOYSA-N 399.463 5.543 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(CCc1ccc(F)cc1)C1CC1 609744562 QXSWHHQZOOOOPJ-MRXNPFEDSA-N 397.519 5.459 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3C=CC[C@H]2CC3)cc1Cl 611048114 JVTVDGFIHIOGHC-CMKODMSKSA-N 377.875 5.320 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCC(=O)N(c2cccc(F)c2)C1 613901816 VPERNEDIJXFNJA-GOSISDBHSA-N 394.490 5.059 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N[C@H](C)c3cccc(C#N)c3)c2C(C)C)cc1 616871048 ZPFYMIPFCAXVTM-QGZVFWFLSA-N 387.487 5.059 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H]1CCCCC1(F)F 622485547 QKNFWROSOUOSIK-NWDGAFQWSA-N 389.286 5.251 30 20 GKED COc1cc(NC(=O)c2cc(C(F)(F)F)ccc2F)ccc1C(F)(F)F 622605869 DLOLXXQFGAOSKB-UHFFFAOYSA-N 381.247 5.124 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(-c2ccc(OC)cc2OC)n1 642099294 HFEQPVJOWXETBX-UHFFFAOYSA-N 380.513 5.016 30 20 GKED COc1cc2ccc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cc2cc1OC 659114531 FJPCXPSXIINNPZ-INIZCTEOSA-N 394.496 5.101 30 20 GKED C=CCN(C(=O)c1csc2ccccc12)c1nc(-c2ccccc2)cs1 670802587 MUDJCGBCYGPMNU-UHFFFAOYSA-N 376.506 5.858 30 20 GKED COc1ccc(C(=O)/C=C/c2sc3ccccc3c2Cl)cc1CC(=O)O 726743908 SNVADLQSCYNIOB-VQHVLOKHSA-N 386.856 5.087 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)c1ccccc1OCC#N 726762493 HKIXIWMBYYFKMM-UHFFFAOYSA-N 376.843 5.470 30 20 GKED CCc1c(C)sc(NC(=O)c2cnc(-c3ccc(C)cc3C)s2)c1C#N 727790779 RNUXEZCZOAZRPX-UHFFFAOYSA-N 381.526 5.483 30 20 GKED O=C(/C=C/c1nc(-c2ccccc2)cs1)c1sccc1Br 727973829 CLMJOWYETSMRME-VOTSOKGWSA-N 376.300 5.530 30 20 GKED FC(F)(F)CC(=Nn1cnc2ccccc21)c1ccc(Br)cc1 731925970 FAFFXPYNXLVCIB-UHFFFAOYSA-N 382.183 5.004 30 20 GKED Cc1c(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)oc2ccccc12 733083449 JKMJHDKXSRIHAX-MDZDMXLPSA-N 390.420 5.669 30 20 GKED CCOc1ccc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 733083833 RENJDYCSIILIFY-FLIBITNWSA-N 380.425 5.013 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C\c3cc(OC)ccc3O)s2)cc1 733750295 SLUKGTPLRXEUFU-QGNWGPJTSA-N 382.485 5.021 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(C(C)C)cc2C(C)C)c1 733843739 UYNYDABFXXWUAP-HXUWFJFHSA-N 393.531 5.936 30 20 GKED CC[C@@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 734082458 BURHIVJSBUDDKF-QFBILLFUSA-N 382.529 5.601 30 20 GKED C=CC[C@H](NCc1ccc(Oc2cc(OC)cc(OC)c2)cc1)c1ccncc1 734509628 NDBBWDBODGCQTA-DEOSSOPVSA-N 390.483 5.298 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)c2)s1 739590759 PENUOQYLCGOFAK-HZPDHXFCSA-N 392.446 5.272 30 20 GKED O=C(/C=C\c1cnc2ccc(Br)cn12)c1ccccc1C(F)(F)F 740763633 FDRNMZJYBUETHG-SREVYHEPSA-N 395.178 5.012 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1 741470779 VPWNCQYNNCLPMT-CMDGGOBGSA-N 381.435 5.043 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 747105624 UFQOZZYNCBLBEV-IAQYHMDHSA-N 399.277 5.478 30 20 GKED O=C(/C=C\c1ccc(SC(F)(F)F)cc1)c1ccc(N2CCOC2=O)cc1 748583396 CCGUGAHZCRKDOH-KMKOMSMNSA-N 393.386 5.151 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=C(c3ccccc3)C(F)(F)F)o2)cc1 751955089 OWVZMXAABBATLE-ZDUSSCGKSA-N 375.350 5.089 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 758508558 STFBMFRSMJVBCA-WAIKUNEKSA-N 394.877 5.649 30 20 GKED Cn1nc(C(F)(F)F)c(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1Cl 758933006 YGNKVVLGKRAYIG-AATRIKPKSA-N 391.780 5.050 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@@H](C)c2ccc(F)c(F)c2)c1C(F)F 764347835 WACDUJYZJDLGMO-ZETCQYMHSA-N 398.278 5.056 30 20 GKED O=C1/C(=C\c2cccc(OCCCc3ccccc3)c2)CCc2nc(O)ccc21 769611070 VKQAWKWRSVDGNV-SILNSSARSA-N 385.463 5.011 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2ccc3cc(OC)ccc3c2)c1 772982700 FLDMEEVNKYHXQP-DHLKQENFSA-N 388.511 5.770 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CCCc3ccc(Cl)cc32)ccc1OC 772984983 HMKPMJVKROEIRD-ICSRJNTNSA-N 384.907 5.197 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](CO)c2ccc(C(F)(F)F)cc2)cc1 773120215 RQLCVJFETHAZFM-AUUYWEPGSA-N 399.840 5.221 30 20 GKED C[C@H](Nc1ccc(N2CCSCC2)c(Cl)c1)c1ccc(C#N)c(F)c1 777658174 GKSXCZZLKDGIHR-ZDUSSCGKSA-N 375.900 5.077 30 20 GKED Cn1c([C@H](C#N)C(=O)CC(C)(C)Cc2ccc(Cl)cc2)nc2ccccc21 783067632 ZMNXRIAWARLQDF-QGZVFWFLSA-N 379.891 5.062 30 20 GKED CC(C)c1noc2nc(-c3ccco3)cc(C(=O)OCCCC(C)(C)C#N)c12 783438413 PYZMYQBQSFKMHY-UHFFFAOYSA-N 381.432 5.093 30 20 GKED Cc1cc(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)c2cnn(C(C)C)c2n1 785934606 UAZVTJYDRMIKFY-UHFFFAOYSA-N 396.450 5.079 30 20 GKED N#CCCn1cc(C(=O)CSc2cccc(C(F)(F)F)c2)c2ccccc21 786597725 RZKJINNLCWEEPQ-UHFFFAOYSA-N 388.414 5.549 30 20 GKED N#Cc1ccc(NC(=S)N(CCC(F)(F)F)Cc2ccccc2)cc1Cl 790347279 ZAHFFKQJFAEIIQ-UHFFFAOYSA-N 397.853 5.363 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)cn1 792867673 WTINCRRLFBVYTB-ZROIWOOFSA-N 399.494 5.039 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)s2)cc1 795203469 BXQJACRAMFXUEC-INIZCTEOSA-N 386.398 5.675 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc1 798009002 YSJHIQLGTQBAGE-KJXAQDMKSA-N 399.469 5.549 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 802706947 BOSIQGUEDKKXMH-RTGRKSDTSA-N 395.505 5.188 30 20 GKED COc1sc(/C=C\C(=O)c2c(F)cccc2Cl)cc1Br 809159549 RKDVRKKPRJRPOB-WAYWQWQTSA-N 375.646 5.208 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 814575009 VGYAHOQISDHZGF-XMMPIXPASA-N 383.495 6.219 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2SCCCS2)cc1Cl 841055375 ILPPPEKZQJYDFI-MRXNPFEDSA-N 388.945 5.130 30 20 GKED CC(=NOCC(=O)Nc1ccccc1-c1ccccc1)c1cc2ccccc2o1 852749149 QHCZFGSIMMTKHR-UHFFFAOYSA-N 384.435 5.479 30 20 GKED Cc1nc(-c2ccc(CC/N=C\c3cc4ccccc4nc3O)s2)cs1 912780564 ADJWCCQXJLLDKP-NHDPSOOVSA-N 379.510 5.095 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4cccs4)c23)cc1 916357171 CPVOYNHWTGBFTA-UHFFFAOYSA-N 380.498 5.265 30 20 GKED Cc1cc(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3o2)c(C)n1C1CCCCC1 917509919 GXLMJUDPEGYMER-GHYICZDASA-N 387.483 5.641 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)Nc3ccccc3)cc2Cl)cc1 917599949 DPIGSXNTZRZKIV-UHFFFAOYSA-N 379.872 5.813 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)cc3cccnc23)cc1 917668533 ASEOQCBGYIIFTA-QFIPXVFZSA-N 397.865 5.796 30 20 GKED CC(=NNc1ccc(OC(F)F)cc1)c1sc2ccccc2c1C(=O)O 1776040734 OPDFBSTWBOBDDY-UHFFFAOYSA-N 376.384 5.037 30 20 GKED C=CC[C@]1(C(=O)O)CCCN([C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)C1 1776154016 RCEJVWORRRDVRS-VFNWGFHPSA-N 388.895 5.107 30 20 GKED CCN(C)c1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776855381 XZEJBOQFXRYSGN-CSKARUKUSA-N 383.444 5.091 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66801292 VERFBJPXEXVCLT-LBPRGKRZSA-N 376.934 5.708 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1 67494675 NZKITMVBXXUEEQ-UHFFFAOYSA-N 394.446 5.375 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)c1 123974007 WIIXPUBOSJCWSU-UHFFFAOYSA-N 394.833 5.230 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)oc12 147306538 NETRRPRPZFCVDT-KRWDZBQOSA-N 383.432 5.226 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(-c2cccs2)cc1 161659724 LNKZNXFKLOBVHL-QGZVFWFLSA-N 388.540 5.001 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccccc3SC[C@H](C)C#N)c2c1 174713125 WLBIGRXARKEHDP-MRXNPFEDSA-N 377.513 5.299 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(Cl)s1 175120246 BOQUHPZHOHYDDC-WPRPVWTQSA-N 381.309 5.645 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(COc3ccc(F)cc3)o2)n1 177762022 SECJVZZIPZPIDY-INIZCTEOSA-N 384.432 5.068 30 20 GKED CC[C@H](C#N)Oc1cc(CNC(c2ccccc2)c2ccccc2)ccc1OC 180892471 HKUIHLMPHNPPLB-JOCHJYFZSA-N 386.495 5.255 30 20 GKED Cc1cc(F)ccc1CSCC(=O)Nc1ccccc1SC[C@@H](C)C#N 182077826 CVBUTHXRGQTPMT-AWEZNQCLSA-N 388.533 5.258 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)c(C)n1[C@H](C)c1ccccc1 183110560 PRQJYKVTEBYMNY-QZTJIDSGSA-N 387.483 5.257 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)s1 187157693 WLFFUVVFIIKOEQ-AWEZNQCLSA-N 393.468 5.075 30 20 GKED O/C(Cc1c[nH]c2cc(F)ccc12)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329526965 UAGZKUGDIGWTHU-LJQANCHMSA-N 380.467 5.195 30 20 GKED CC(C)[C@H](/N=C(/O)C12CC3CC(CC(C3)C1)C2)c1nc([C@@H]2CCCS2)no1 329547863 CCSWKPMFSLOAGS-MTPYNGCESA-N 389.565 5.508 30 20 GKED C[C@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 409475569 OJUIEEPOXLTYSX-AWEZNQCLSA-N 376.378 5.130 30 20 GKED N#Cc1c(NC(=O)Cc2cccc(OC(F)F)c2)sc2c1CCCCCC2 409801985 BBGIZBDCFWUTJG-UHFFFAOYSA-N 390.455 5.061 30 20 GKED Cc1nc([C@H]2CCCN2Cc2cccc(OCc3ccccc3C#N)c2)cs1 428400876 PLXXTSIXUXCYHY-HSZRJFAPSA-N 389.524 5.239 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccccc3)nc2)cc1C(F)(F)F 443883432 VRLWDAYVMQGSHR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#CCC[C@@H](NC(=O)N1C[C@H](c2ccccc2)c2ccccc21)c1ccccc1 445216105 NQXFOYYYGHHLRT-DHIUTWEWSA-N 381.479 5.393 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(Cl)cc1Cl 446857931 XZTIAGFVPLSAGR-CYBMUJFWSA-N 388.298 5.300 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](C)(c2ccccc2)C1 447057093 BVCPHRXDVGXNKE-HTAPYJJXSA-N 379.529 5.276 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)[C@]1(C#N)C[C@@H]1C 449978908 BOWAWCOZYNBCNH-WNSKOXEYSA-N 390.462 5.220 30 20 GKED CSc1c(F)cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1F 455129308 WBDSPTVCJUQZJP-KRWDZBQOSA-N 375.444 5.243 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Sc2ccc(Cl)cc2C#N)cc1 455967947 BUUCWARAADKPFH-UHFFFAOYSA-N 398.919 5.376 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)[C@@H](C)c2cccc(C#N)c2)cc1 462135246 PJFWGHSMIKDARG-RBUKOAKNSA-N 398.506 5.557 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](CC(C)(C)C)c1ccc(Cl)cc1 465970156 SQIHOFFTPRHOKU-HXUWFJFHSA-N 383.923 5.531 30 20 GKED N#CCCCOc1cccnc1NCc1ccc(-c2nc3ccccc3s2)o1 466619797 YMOZJGCQJQJAKI-UHFFFAOYSA-N 390.468 5.246 30 20 GKED CN(Cc1ccc(F)c(Cl)c1)C(=O)c1cn(CCCC#N)c2ccccc12 470007281 AANOHROXUZRUCT-UHFFFAOYSA-N 383.854 5.010 30 20 GKED CCOc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2ccccc2)cc1 470436695 DEJMCNNLKGUJKG-MRXNPFEDSA-N 378.501 5.117 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 471283736 UOSYUOCSUXPSIV-AYBZRNKSSA-N 397.519 5.535 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCOc1ccc2c(c1)OCO2 476172401 ZXKQMNCQNIWWPZ-UHFFFAOYSA-N 381.472 5.065 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Cl)cc1Br 478738959 OPVZOZSETYCLQE-UHFFFAOYSA-N 385.714 5.384 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)c1ccc(Sc2ccccc2C#N)cc1 479495179 FOEOGCRXDVTASP-NRFANRHFSA-N 387.508 5.025 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 481329768 JVZXXJAVILWBKB-NRFANRHFSA-N 395.528 5.490 30 20 GKED C[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481662656 YAJCCUFBHQVSSB-IERDGZPVSA-N 395.478 5.319 30 20 GKED C[C@H](C(=O)Nc1ccccc1NCCCc1ccccc1)c1cccc(C#N)c1 487311996 VHEXFCGAIXMUIG-IBGZPJMESA-N 383.495 5.345 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CSCc2cc(-c3cccs3)on2)cc1 488857563 HWHUSIXCKFFVMW-UHFFFAOYSA-N 397.525 5.076 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N(CCC#N)Cc1ccco1 490626572 KQVRRTJSHSAATN-GFCCVEGCSA-N 383.300 5.009 30 20 GKED CSC[C@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 494198968 RKOQFIAIQJQNMU-MJGOQNOKSA-N 399.947 5.355 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 498088562 KYLQUXQXLOURCM-QHCPKHFHSA-N 392.499 5.122 30 20 GKED N#CC1(CCCN2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 499522929 NIBQJJNNEWGRCG-LJQANCHMSA-N 380.454 5.333 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@@H]1c1ccccc1Cl 501017103 HNUCTMNBCUBCQL-MOPGFXCFSA-N 376.843 5.142 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4ccccc4o3)c2)cc1 501439829 YFKFAJUHXRYUHL-UHFFFAOYSA-N 382.419 5.330 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)CSCc1ccc(C#N)cc1 506526965 WSXLKXLDSLGLTG-UHFFFAOYSA-N 386.520 5.117 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(Cc1ccccc1)C1CC1 510887286 MQHKZOAGYFAPCX-UHFFFAOYSA-N 397.478 5.856 30 20 GKED CCC(CC)CN(CC)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 511500856 VVBGOMSJYMBULM-UHFFFAOYSA-N 392.503 5.101 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)s1 513375298 CMPJDMLKXXBXCS-LJQANCHMSA-N 389.480 5.093 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(-c2ccccc2)o1 520197494 FFAQPZKJTSJUOA-INIZCTEOSA-N 391.496 5.663 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 521352613 AZUCDDJTTKQXTB-HXUWFJFHSA-N 382.385 5.172 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Cl)cc1F)c1ccc(OCc2ccccc2)cc1 524335440 REVMDDSYTLVQLW-OAQYLSRUSA-N 394.833 5.053 30 20 GKED Cc1ccc2c(CCC(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c[nH]c2c1 524793361 FGPKBHCVSQITTJ-CQSZACIVSA-N 377.513 5.106 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1cnc(C2CC2)s1 525130250 YONWKDFJYNYYQR-UHFFFAOYSA-N 393.899 5.393 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN[C@H](C)c2cc3ccccc3s2)c1C 526944823 ISDCGIMVQMIIMO-GOSISDBHSA-N 391.540 5.116 30 20 GKED COc1ccc([C@@H](NCCC(C)(C)C#N)c2ccccc2)cc1Br 537361849 AKDCJJNKEVETHJ-IBGZPJMESA-N 387.321 5.077 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1sc(-c2ccccc2)nc1C 541437975 NFFFMLDGYYOBJX-UHFFFAOYSA-N 388.496 5.210 30 20 GKED C[C@H](NCc1csc(C(C)(C)C)n1)c1ccc(-c2cccc(C#N)c2)cc1 543873068 MXIQHKKSCCDTHV-INIZCTEOSA-N 375.541 5.830 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-c4ccccc4)o3)n2)cc1 544154427 JXPFZWKSHCZKEK-GOSISDBHSA-N 395.443 5.432 30 20 GKED Cc1cc(Br)cc2c1[C@H](N[C@@H](CCCC#N)c1ccccc1)CC2 551214492 FOAYJWUTKMAROK-VQTJNVASSA-N 383.333 5.770 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)c1 552387705 WGBQFUBIGICVOI-UHFFFAOYSA-N 387.870 5.078 30 20 GKED N#Cc1csc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)c1 556617086 WMVLLUWJPNCHJP-QFIPXVFZSA-N 387.508 5.209 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@](C)(C#N)C3CCCCC3)sc2C)cc1 583712708 UGRHZCRONJNSBI-JOCHJYFZSA-N 382.529 5.325 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1 591507699 UZGJWXLSWLNQGE-UHFFFAOYSA-N 390.281 5.066 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CC2CCC(F)(F)CC2)cc1 599124352 OXIIEJNXUGFLEB-UHFFFAOYSA-N 398.453 5.486 30 20 GKED Cc1ccnc2sc(C(=O)N(Cc3ccc(C#N)cc3)CC(C)C)c(C)c12 603569285 GCXXZXHFXYELPR-UHFFFAOYSA-N 377.513 5.083 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(F)ccc3F)cc2Cl)cc1 604027185 MHBUIAHGXPECAO-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc2ccccc2n1CC#N 609162910 XOVBFGVPINXSIU-CQSZACIVSA-N 385.389 5.017 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 609452079 LAJYGMGUOLBSCV-UHFFFAOYSA-N 399.494 6.102 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CO[C@@H]1CCC[C@@H](C)C1 609575679 MSSLKQPKWXHXLX-VGOFRKELSA-N 394.490 5.134 30 20 GKED COc1cc(COc2cc(F)ccc2F)ccc1OCc1cccc(C#N)c1 609722059 BQEIZHJRMHOWOD-UHFFFAOYSA-N 381.378 5.003 30 20 GKED C[C@H](SCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccc(C#N)cc1 609825954 DSGIWTCHRDPKRY-NSHDSACASA-N 398.837 5.663 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1cccc(COc2cccc(C#N)c2)c1 610053147 RSNGRGBBHIOZIX-DEOSSOPVSA-N 399.494 5.146 30 20 GKED CC[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1 618562071 VCRBVAWHWBDWPM-FMKPAKJESA-N 378.360 5.508 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@@H]2CCN3CCC[C@H]3C2)cc1)C(F)(F)F 647229884 XFRBFFAVEFJXCM-KGLIPLIRSA-N 384.339 5.015 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(Cl)c(F)c1 677956986 PTHPGTXOSZEXLG-RKDXNWHRSA-N 391.714 5.118 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(\CC(=O)O)c2nc3cc(Cl)ccc3s2)cc1 730436964 OATXIUVAAFSKOD-ZBQKXELDSA-N 398.871 5.256 30 20 GKED Cn1c(C(=O)Nc2ccccc2SCCC#N)ccc1-c1ccc(F)cc1 730982200 LDZIAOXJXSVIGL-UHFFFAOYSA-N 379.460 5.089 30 20 GKED Clc1ccc(Cl)c(C=NNc2ccc(Br)nc2)c1Cl 732713322 XXJKPNRULQYTTO-UHFFFAOYSA-N 379.472 5.250 30 20 GKED C#CCCOc1ccc(CNCc2ccc(OCc3cccc(F)c3)cc2)cc1 733322252 DYJDFMUVHGMGHE-UHFFFAOYSA-N 389.470 5.097 30 20 GKED C[C@H](Nc1ccc(NC(=O)Nc2cccc(OCC#N)c2)cc1)c1ccccc1 733623157 WSHYRBPFBGUJPG-KRWDZBQOSA-N 386.455 5.406 30 20 GKED COc1ccc(/C=C2\CCOc3c(Cl)cccc3C2=O)c(Cl)c1OC 733748826 KOTHEYQDYLGWBQ-ZRDIBKRKSA-N 379.239 5.059 30 20 GKED C#Cc1ccc(C(=O)O[C@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cn1 733797676 BOMAFZCBLSQTCJ-SNVBAGLBSA-N 387.279 5.019 30 20 GKED Cc1ccc(NC(=O)CSCc2cc(Cl)ccc2OCC#N)c(Cl)c1 735319001 USDLUZCJBSBMJK-UHFFFAOYSA-N 395.311 5.076 30 20 GKED CCN(Cc1ccccc1C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740064310 KSWMISWRRYTNEN-UHFFFAOYSA-N 389.524 5.327 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3c[nH]c4c(C)cccc34)n2)cc1 741431123 PLCAYSFDXASSSN-IBGZPJMESA-N 385.492 5.327 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1 741647135 WHRZIMZLGALIHT-UHFFFAOYSA-N 395.455 5.136 30 20 GKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1cccc(-c2ccncc2)c1 741840849 GFUSGMONCRXSNS-CMDGGOBGSA-N 383.369 5.586 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCCOc3ccccc32)cc1 750304024 UUHNPCFPEPWYRQ-PKTZIBPZSA-N 397.478 5.377 30 20 GKED O=C1/C(=C\c2nc(Cl)cs2)Cc2c(Cl)cc(Br)cc21 759090446 LEKVEHOSPFSEEY-KXFIGUGUSA-N 375.074 5.035 30 20 GKED C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1C(=O)Nc1cccc(OCC#N)c1 759494418 KHMDGTHUHWPNQE-GFCCVEGCSA-N 390.270 5.047 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c[nH]c2cccc(F)c12 761658705 HROMFFWKNMATPP-UHFFFAOYSA-N 399.425 5.318 30 20 GKED CCc1nc2ccccc2n1N=Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 767374230 RWXOFLMNMCYOLP-UHFFFAOYSA-N 394.818 5.303 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1Cc2ccccc2C[C@H]1c1nnc(C)o1 775488718 LTQRIKUYAQDQJA-AVRDEDQJSA-N 397.563 5.781 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)N[C@@H](C)c1ccc(OCC#N)cc1 776165222 ZARLZGHVFFUULH-HRAATJIYSA-N 386.923 5.689 30 20 GKED N#CCOc1cccc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 779587979 HRIQBUKPYZBOSB-UHFFFAOYSA-N 393.374 5.041 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)c1 781439214 RCUQXOSYLFRSKL-IBGZPJMESA-N 399.372 5.167 30 20 GKED C=CCOc1cccc(NC(=O)C(=O)Nc2ccc(SC(C)(C)C)cc2C)c1 783889840 MJEOEWUFRZXXEH-UHFFFAOYSA-N 398.528 5.028 30 20 GKED C=CCCN(C)Cn1nc(-c2cccnc2)n(-c2ccccc2C(C)C)c1=S 786101088 IXAVEOBRVZFBBG-UHFFFAOYSA-N 393.560 5.054 30 20 GKED COc1cccc(C=Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)c1O 788317638 JHIHSWNNRXODAE-UHFFFAOYSA-N 390.226 5.041 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2c(Cl)nc3cc(Cl)ccn23)c(Cl)c1 794711976 HDNFTTFRZHEKGY-ONEGZZNKSA-N 376.630 5.062 30 20 GKED Cc1ccc(-c2nnc([C@H](C)OC(=O)C[C@@H](CC#N)c3ccccc3)o2)cc1C 795982918 JBVBJWWDOUEHOE-PKOBYXMFSA-N 389.455 5.045 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)Nc3ccc(F)cc3OCC#N)c2)o1 797634970 RGTPAPCFUUHSFZ-UHFFFAOYSA-N 379.391 5.249 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc(F)cc1C(=O)c1ccccc1)c1ccccc1 802964297 CZBLYQIUVZIESG-LJQANCHMSA-N 387.410 5.050 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1ccc(OC(F)F)cc1)c1ccccc1 814210036 JQBGBMZPKVQMMS-QGZVFWFLSA-N 375.444 5.010 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)c1ccccc1C(F)(F)F 819440545 SIHDYWPMLGDXOL-DYVFJYSZSA-N 380.435 5.245 30 20 GKED CC(C)(C#N)CC[S@](=O)Cc1nc(-c2cccc(Cl)c2Cl)cs1 905209566 KZQGXQGTYAJJBV-QHCPKHFHSA-N 387.357 5.305 30 20 GKED N#CC(CCOC(=O)CCC(=O)c1ccccc1)(c1ccccc1)c1ccccc1 912957623 NBUMQQSTPCUTMS-UHFFFAOYSA-N 397.474 5.093 30 20 GKED COc1cc(C=NOCc2cc(Cl)cc3cccnc23)cc(Cl)c1OC 914786235 ZQNYBCZREFIKLX-UHFFFAOYSA-N 391.254 5.110 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3cccc(OC(F)F)c3)cs2)c1 916129030 QLEKGNUUBCYEOQ-HJWRWDBZSA-N 387.407 5.316 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2cc3sc4ccccc4c3s2)c1 916897464 ZSFVJJMJGJQKAQ-HNNXBMFYSA-N 390.489 5.386 30 20 GKED N#C[C@@H](C(=O)CCCC1CCCCC1)C(=O)Nc1ccc(Cl)cc1Cl 916927730 CGGZCYBDBRXGCR-HNNXBMFYSA-N 381.303 5.391 30 20 GKED COc1cc(C=NOCc2c(Cl)ccc3cccnc23)cc(Cl)c1OC 917395375 KHZFRHCYQKKLCL-UHFFFAOYSA-N 391.254 5.110 30 20 GKED COc1ccc(/C=C/C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 917774026 GXFDKWILDPGRCY-MDWZMJQESA-N 386.476 5.046 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1ccc(Cl)cc1Cl 1776179909 ASQSOHLBTRTIOH-KRWDZBQOSA-N 384.690 5.461 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)o2)cc1)c1ccccc1 1776469408 KOZKYMKAGWRLBI-KGDCLLSVSA-N 388.419 5.414 30 20 GKED CCCCCCCOc1ccc(/C=C/c2nc3c(s2)CCC[C@@H]3C(=O)O)cc1 1776788284 XBPQMWXJGOQRNR-QZEGLACASA-N 399.556 6.167 30 20 GKED COc1cc2ccc(C(=O)/C=C/c3cc(C(=O)O)c(C)cc3C)cc2cc1OC 1777339042 UUADORDMRYYLDE-BQYQJAHWSA-N 390.435 5.068 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(-c3ccccc3)on2)n1 19359349 LEHLREONJGNIMF-UHFFFAOYSA-N 375.375 5.228 30 20 GKED CCCCN/C(S)=C(/C(=O)c1cc(C)c(C)c(C)c1C)[n+]1ccc(CC)cc1 27323360 QIHWVWCCFVVBIA-UHFFFAOYSA-O 397.608 5.099 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 33242890 GJGIHBSQLDYYKK-DEOSSOPVSA-N 382.463 5.115 30 20 GKED N#C[C@H](C(=O)CCc1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41537978 PDWTWUKLCSVNMM-CQSZACIVSA-N 391.279 5.519 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1C 41541295 URJZKCBQZGCWCV-HXUWFJFHSA-N 394.430 5.166 30 20 GKED C[C@H](Nc1snc(Cl)c1C#N)c1cccc(NC(=O)c2ccccc2)c1 52104354 ZFIVVXOUUXTGMQ-LBPRGKRZSA-N 382.876 5.094 30 20 GKED Cc1cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c(C)n1C1CC1 58426035 CSYGUESGGQLBQU-UHFFFAOYSA-N 399.494 5.337 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C/c2ccc(Cl)c(Cl)c2)cc1 59324386 YORDRPZUGALPRE-YCRREMRBSA-N 387.266 5.202 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 59994571 YEVRZNSSQPBAJI-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1 60064379 BQWZSCZFPYUUTJ-AWEZNQCLSA-N 398.450 5.148 30 20 GKED N#CCCN(Cc1ccco1)Cc1cn(-c2ccccc2)nc1-c1ccccc1 96970576 GCZJSCAHNMDGGW-UHFFFAOYSA-N 382.467 5.048 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108528560 KQOZOLJETDYFIK-FXAWDEMLSA-N 379.529 5.616 30 20 GKED CCC(CC)n1c(COc2ccccc2Cl)nnc1S[C@H](C#N)CC 126970017 WRWGJAJNWHFGGO-AWEZNQCLSA-N 378.929 5.266 30 20 GKED C=C(C)COc1cc(CN[C@H](c2cccc(C)c2)c2ccccn2)ccc1OC 153512747 SUVKAXWABCQLPK-RUZDIDTESA-N 388.511 5.233 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCSc2ccccc21 171741492 IFXAAXDALSLZIY-HOCLYGCPSA-N 383.542 5.297 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1nc(C(F)(F)F)cs1 173732386 BZEJQTAOWOKUPF-CYBMUJFWSA-N 396.438 5.236 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1cccc(Cl)c1 175134054 QAPOYJOFDYUQHL-VEMDQMBVSA-N 379.872 5.138 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)Nc3nc(C)c(SCC#N)s3)c2c1 176707022 GCZGIFUAXKZRID-UHFFFAOYSA-N 394.525 5.054 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Cl)c(OC(F)F)c1)c1ccccc1 180135320 DLKDIFJZDSAOKC-HNNXBMFYSA-N 379.794 5.108 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(SC(C)C)cc2)ccc1OC 180811185 STFQPXVNLWBAKX-FXAWDEMLSA-N 398.572 5.727 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](C(=O)N[C@@H](C)CCC)C1 191458845 IQRQBLMHVJKEEL-ICSRJNTNSA-N 399.579 5.087 30 20 GKED COc1ccccc1-c1n[nH]c(=S)n1N=Cc1ccc(-c2ccccc2)cc1 254448237 HCAUTFOCINESLO-UHFFFAOYSA-N 386.480 5.165 30 20 GKED N#Cc1ccc(N[C@@H](Cc2ccccn2)c2ccc(Br)cc2)cc1 302643964 FGSUJBZKVVRNII-FQEVSTJZSA-N 378.273 5.112 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1ccccc1SC[C@@H](C)C#N 303271562 HNBBKBJLINWMFO-BFRYPLHYSA-N 394.540 5.768 30 20 GKED Cc1ccc([C@H](C)/N=C(/O)CN2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1C 329368972 LKTSOCTVANRHMR-PXNSSMCTSA-N 396.535 5.199 30 20 GKED COc1cccc([C@@H]2C[C@@H]2/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1 329522566 RESFIZMANQZYHQ-ACRUOGEOSA-N 379.504 5.144 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1)c1ccccc1 378102733 SEYFHVIBZPQEIW-VQTJNVASSA-N 394.519 5.281 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(C(=O)OC(C)(C)C)c1 410321572 DGMLPHWEDSMPQA-INIZCTEOSA-N 382.529 5.648 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(Cl)c1Cl 431958041 YXAVMOXHIGIZDQ-KDOFPFPSSA-N 390.314 5.789 30 20 GKED CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 432857760 FUFBLDNDNOGGFT-KKSFZXQISA-N 399.535 5.938 30 20 GKED CCCCOC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 438219335 LQLKJNDCJDTDRZ-UHFFFAOYSA-N 393.487 5.164 30 20 GKED CC(F)(F)c1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 440635587 IFWKAOHAOICARR-UHFFFAOYSA-N 382.366 5.094 30 20 GKED N#Cc1ccc(SCc2ccnc(-c3ccc(Br)cc3)n2)cc1 440840388 GEJLOIKBWCDTOX-UHFFFAOYSA-N 382.286 5.070 30 20 GKED C[C@@H](Sc1nnc(-c2cccc(Br)c2)o1)c1cccc(C#N)c1 442914236 LLETZDBIGIQQRL-LLVKDONJSA-N 386.274 5.224 30 20 GKED C=CCCCNC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 447968314 PQOGPQPXUKRCND-UHFFFAOYSA-N 391.393 5.045 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)c2ccccc2Sc2ccccc2C#N)C1 457135620 FQICRGMLSQVRHA-UHFFFAOYSA-N 390.430 5.124 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccccc1SC[C@H](C)C#N 460467510 PICGCWFEMBEYDZ-LLVKDONJSA-N 389.864 5.061 30 20 GKED C[C@H](C(=O)Nc1ccccc1-c1nc2ccccc2s1)c1cccc(C#N)c1 463122862 MCTRRJWVJXLQDL-HNNXBMFYSA-N 383.476 5.577 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1cc(C2CC2)nc2ccc(F)cc12 463284209 OOXBMCLDJNKZBT-UHFFFAOYSA-N 390.458 5.088 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)o2)cc1 463743383 CNUKMFVZLXSROH-INIZCTEOSA-N 390.508 6.013 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3SCCc4ccccc43)c2)cc1 463878438 NIOJKFNMUAYRRQ-JOCHJYFZSA-N 386.476 5.320 30 20 GKED Cc1ccccc1-c1nc(C(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cs1 464933821 BCFJENHOSZLTNO-CTNGQTDRSA-N 387.508 5.031 30 20 GKED C=C(C)C[C@@H](C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1 466245094 XABHQUJUXIGYSH-RISCZKNCSA-N 378.232 5.161 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(OC)ccc1Br 471287747 LDRYJXGRVSOLRD-UHFFFAOYSA-N 389.293 5.068 30 20 GKED CC[C@H](C)Sc1ccc(NCc2nnc(-c3cccc(C#N)c3)o2)c(C)c1 471636181 UJODLYTXNSJASH-HNNXBMFYSA-N 378.501 5.419 30 20 GKED CC(C)[C@@H](CNc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 475200804 CAXRZALCOZQBJR-JOCHJYFZSA-N 375.516 5.121 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@]1(CO)Cc1ccccc1 475549940 RNWHMJCGWDHTQR-RUZDIDTESA-N 392.543 5.140 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccccc3Cl)cc2F)c1 477820741 HOPSYEDRVIKOKO-UHFFFAOYSA-N 395.821 5.574 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)c1 479280497 HWJBVSBRXRBFHK-NRFANRHFSA-N 395.275 5.339 30 20 GKED C[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(Br)s1 481988748 GOIHAMJUSURCFD-LRDDRELGSA-N 375.335 5.501 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1nccn1-c1ccccc1 482154940 ACJSDXALXHVOKR-GOSISDBHSA-N 388.515 5.607 30 20 GKED Cc1nc(-c2cccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)c2)cs1 487185337 LHBIXHMLLYKTRP-FQEVSTJZSA-N 375.497 5.284 30 20 GKED N#CCCC[C@H](NC(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 487500101 IUARJSFDXWTYSQ-QHCPKHFHSA-N 397.478 5.104 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@@H](C)Sc1nc(C(F)(F)F)ccc1C#N 488729853 DPMGEHCUYBYBLO-SNVBAGLBSA-N 399.825 5.053 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)C[C@H](C)C2 492092852 CRLMFUQJWKEGGH-HVESIFNPSA-N 399.494 5.326 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C 498851799 FUWCLPSMCIGOSC-SFHVURJKSA-N 395.572 6.201 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1C 500772275 QQUIYRCIOUZSBD-UHFFFAOYSA-N 387.395 5.128 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2-c2cccs2)c1 502339803 OKBKBJNZSBEQHO-UHFFFAOYSA-N 377.469 5.742 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 509563232 DVCLRJBYNOMVHX-PNHOKKKMSA-N 386.417 5.290 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1csc(-c2ccccn2)n1 510212067 TYNOZTSBXDWVBP-UHFFFAOYSA-N 386.505 5.431 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 515459879 VOYOSOLQRYMTAA-UHFFFAOYSA-N 398.865 5.282 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H](c3cccs3)C3CC3)c2)cc1 517901446 CZNWKYAFIIKIMJ-OAQYLSRUSA-N 389.480 5.685 30 20 GKED C[C@@H](Nc1ccc(C#N)c(Cl)c1)c1cccc(NC(=O)c2ccccc2)c1 518903829 XYMQYGAOARHOOC-OAHLLOKOSA-N 375.859 5.637 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 519309547 YJWCSXSXBXHGNH-UHFFFAOYSA-N 399.425 5.543 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C#N)cc2)cc1Cl)c1ccccc1 521281376 YBDDPDLNTWOKIT-OAHLLOKOSA-N 375.859 5.637 30 20 GKED CCCCn1c(S[C@@H](C#N)C2CCCCC2)nnc1-c1ccc(OC)cc1 524533810 OZNIBZLPINOFMF-IBGZPJMESA-N 384.549 5.318 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2sccc2C#N)nc1-c1ccc(Cl)cc1 531518945 FJSRVGAJZWRRAT-SNVBAGLBSA-N 387.917 5.196 30 20 GKED Cc1cnc([C@H](C)NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 536396697 ZFELPVPFTCOTPB-ZDUSSCGKSA-N 397.887 5.260 30 20 GKED C[C@@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)Cc1ccc(Cl)cc1 536792698 ZOQJVWMZCSLCQM-QGZVFWFLSA-N 378.903 5.096 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(C#N)c(F)c1 538506859 GFMVDBMJGTXHDJ-GOSISDBHSA-N 387.502 5.277 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 539098140 GTUNQGXGLNTNQE-GOSISDBHSA-N 392.808 5.306 30 20 GKED Cc1cc(Br)ccc1NC(=O)CSc1cccc(Cl)c1C#N 540046350 JXRROHYMTVXWBP-UHFFFAOYSA-N 395.709 5.013 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 540220329 YTZQCCSWPPYPOQ-HUVFLSCGSA-N 397.522 5.204 30 20 GKED N#CCC1CCN(Cc2ccc(-c3ccccc3Br)s2)CC1 541921348 FAJOIOXLTSZHRK-UHFFFAOYSA-N 375.335 5.303 30 20 GKED C[C@@H](NCc1nc(C(F)(F)F)cs1)c1ccc(-c2cccc(C#N)c2)cc1 542018191 ZRAYPTHRSQKGHC-CYBMUJFWSA-N 387.430 5.551 30 20 GKED N#C[C@@H]1N(C(=O)c2cc3sc4ccccc4c3s2)CCC[C@]12CCCCO2 548399953 FJWCLNSQTBREMP-GHTZIAJQSA-N 396.537 5.183 30 20 GKED COc1ccc(Sc2ccc(NC(=O)NCC(C)(C)CCC#N)cc2)cc1 558323718 KKRCQZOPKMSHHQ-UHFFFAOYSA-N 383.517 5.298 30 20 GKED C=C(C)Cn1c(SCc2nc([C@H]3CCCC[C@@H]3C)no2)nnc1-c1ccco1 562214900 ZIGBPFKRIOTDOW-GJZGRUSLSA-N 399.520 5.083 30 20 GKED C=CCCCCS(=O)(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 565409065 HIGPSWZJEVBUPB-UHFFFAOYSA-N 389.464 5.100 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)cc1 577511673 VQZQJBWCEZGPPC-CABCVRRESA-N 394.540 5.325 30 20 GKED CC(C)(c1noc(C[C@H](CC#N)c2ccccc2)n1)c1cccc2ccccc12 581325282 QGDADZHVUCCKCU-FQEVSTJZSA-N 381.479 5.789 30 20 GKED N#CCCCCCC(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1 588274441 ZBZXKURNPVSESP-UHFFFAOYSA-N 381.423 5.165 30 20 GKED N#CCCCCCC(=O)Nc1cc([N+](=O)[O-])ccc1Sc1cccs1 588949250 WHTCVDCMCXCMFB-UHFFFAOYSA-N 375.475 5.220 30 20 GKED N#Cc1cc(N2CCC(c3nc(-c4ccccc4)no3)CC2)ccc1C(F)(F)F 589571904 HVOAOKGKEMQGBA-UHFFFAOYSA-N 398.388 5.011 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC[C@@H](CC#N)C3)c(C)c2)c1 596731207 HDPPXLKRHRVART-IBGZPJMESA-N 377.488 5.040 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603690765 PZCJHMZRYJPKIK-HNNXBMFYSA-N 390.418 5.110 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCc3nc4ccccc4s3)c2)cc1 609176016 WCMMADMHFRZALE-UHFFFAOYSA-N 399.475 5.532 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)CC(C)(C)C 609435369 KKCHMIAGWRODLC-GOSISDBHSA-N 395.572 6.161 30 20 GKED Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)Nc2cc(C#N)ccc2OC(C)C)C1 610016241 KDDJFLVLTLLHKQ-HKUYNNGSSA-N 377.488 5.064 30 20 GKED N#CCn1c(C(=O)Nc2ccc(COCc3ccccc3)cc2)cc2ccccc21 610184707 FCVQMOKVCCXIIY-UHFFFAOYSA-N 395.462 5.134 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCSc4ccccc43)cc2)cc1 610225990 NKEORWFIWOVBPX-NRFANRHFSA-N 386.476 5.569 30 20 GKED C=CCN(C(=O)[C@H](C)OC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 614509571 MVHLWCRNRHSJMH-INIZCTEOSA-N 378.497 5.031 30 20 GKED C[C@@H](CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1F 619125353 OBZSQBWBKWIFCU-NSHDSACASA-N 387.339 5.489 30 20 GKED CN(C(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(OC(F)(F)F)c1 622353384 LROZLBZJPNBKFX-UHFFFAOYSA-N 381.247 5.020 30 20 GKED N#C[C@H](C(=O)c1cc(F)c(Br)c(Cl)c1)c1nc(C2CC2)cs1 647379712 HGYSCAZXZPIHAB-SECBINFHSA-N 399.672 5.066 30 20 GKED C=C(C)CN(C)C(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 671790969 PZDXSNXCHBOVAR-UHFFFAOYSA-N 383.344 5.429 30 20 GKED Cc1ccccc1-c1cccc(C=Nn2c(S)nnc2-c2cccs2)c1 729636361 ZQHBORGBOSXQMK-UHFFFAOYSA-N 376.510 5.153 30 20 GKED CCOc1c(OC)cc(/C=C2\CSc3c(Cl)cccc3C2=O)cc1OC 731939689 QLAXBEMIJPJVNA-MDWZMJQESA-N 390.888 5.128 30 20 GKED COc1ccc(/C=C2\CSc3c(Cl)cccc3C2=O)cc1OCCCC#N 731939952 YQYKFXBCIYKGRJ-RVDMUPIBSA-N 399.899 5.403 30 20 GKED CCn1cc(/C=C2/CC(C(C)(C)CC)C/C(=C\c3cnn(CC)c3)C2=O)cn1 732528824 ACHWERALXPFHCR-KFSYKRRRSA-N 380.536 5.002 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1C#N 741843124 YMKNWSKPIVISBX-OQFOIZHKSA-N 378.428 5.034 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2cc(F)ccc2[N+](=O)[O-])cc1F 742463908 BRVANIDJOFWFRF-UHFFFAOYSA-N 381.338 5.149 30 20 GKED N#C[C@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc2ccccc2n1C(F)F 744037616 ARGIYHLQWPORLB-DAWZGUTISA-N 393.437 5.582 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Cc2ccc(Cl)cc2Cl)n1 747197393 YVGOYTHCSFLJQZ-RISCZKNCSA-N 381.328 5.628 30 20 GKED CCC(=O)c1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)ccc1F 757934357 YOYZAUYRWFPDPX-UHFFFAOYSA-N 384.476 5.263 30 20 GKED Cc1ccc(-c2cnc(CON=Cc3cccc(OCc4ccncc4)c3)o2)cc1 760435035 QCZSIPGRJAECCU-UHFFFAOYSA-N 399.450 5.175 30 20 GKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1sccc1Br 770572880 MUGVOYKOVRNIBN-SREVYHEPSA-N 376.300 5.530 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2ccc(OC(C)C)c(C#N)c2)c1Cl 771836242 BNQPJPWQHYOPAL-UHFFFAOYSA-N 394.327 5.770 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(F)cc2Br)c1 772985236 UQBQQNZGGHYFAX-CJNGLKHVSA-N 391.284 5.120 30 20 GKED CC(C)(C)OC(=O)N1CCc2cc(N[C@@H]3CCCc4cc(C#N)ccc43)ccc21 777220668 AADSZLPILZCJHO-OAQYLSRUSA-N 389.499 5.345 30 20 GKED O=C1/C(=C\c2scnc2C2CC2)CCc2nc(-c3ccccc3F)sc21 782327589 SJOYYOFBGFPXOE-XFXZXTDPSA-N 382.485 5.496 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 790635530 LSKDZVVEKMZHOO-AWEZNQCLSA-N 383.904 5.044 30 20 GKED C[C@@H](CSCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 794441380 OTLZJYPCGIRMAS-QFBILLFUSA-N 392.549 5.523 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)s1 797568196 OVOIVSAUOJQAEM-ZJUUUORDSA-N 397.363 5.245 30 20 GKED COCc1nc(Cl)cc(NN=C(C)c2ccccc2SC(C)(C)C)n1 814974867 INTOGZGQZYEZMA-UHFFFAOYSA-N 378.929 5.003 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(N2CCCOC2=O)cc1)c1ccc(F)c(F)c1 815617578 QEKPZBXBPNEBCE-QVKFZJNVSA-N 386.442 5.280 30 20 GKED C[C@H](N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cc(C#N)ccn1 902965484 SZALSGKWEJOSSU-YWZLYKJASA-N 392.503 5.028 30 20 GKED C=C[C@@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 909529797 NPQVYYYTAMNTNN-AWEZNQCLSA-N 392.908 5.127 30 20 GKED Cc1cccc(OCCCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915351895 CYRSDLXFMJCGQF-XMMPIXPASA-N 399.494 5.241 30 20 GKED O=C(Nc1cccc(/C=C/C(=O)c2cc(F)ccc2F)c1)c1ccc(Cl)cc1 916134468 KPMHINMNUPCIKT-NYYWCZLTSA-N 397.808 5.767 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccco1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917029849 CEGMTTLGFUIERJ-WONOZZCYSA-N 378.497 5.094 30 20 GKED O=C(O)Cc1ccc(NN=Cc2c3ccccc3c(Cl)c3ccccc23)cc1 1776083518 LAUQMQDNWNHHIP-UHFFFAOYSA-N 388.854 5.720 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NOCc3ccc(C(F)(F)F)cc3)cc2)cc1 1776112192 IATSQIQMOMKOJQ-UHFFFAOYSA-N 399.368 5.621 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2cc(-c3cccc(F)c3F)ccc2F)CC1 1776162159 WSHGQPSPJPLFGR-UHFFFAOYSA-N 389.417 5.014 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cccc(Br)c1 1776785154 GNDCPSPLQWWSCC-IBGZPJMESA-N 398.385 6.037 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc3c(Br)cccc3s2)c1 1777686174 UKUXJFAFGFXNIN-FPLPWBNLSA-N 387.254 5.258 30 20 GKED N#Cc1c(NC(=O)CSc2cc(Cl)ccc2Cl)sc2c1CCC2 7253986 ODKINTIHPUQDAK-UHFFFAOYSA-N 383.325 5.146 30 20 GKED Cc1cc(F)ccc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 44673415 MTVVZBNTXOQPMV-UHFFFAOYSA-N 376.456 5.550 30 20 GKED CN(Cc1ccncc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 47565609 MJSCAEQPQSAGCG-HXUWFJFHSA-N 390.874 5.054 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccc(F)cc1F 66801028 CECIHKVJWGDQQS-AWEZNQCLSA-N 390.455 5.157 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N(C)[C@@H]1CCCc2ccccc21 66861085 KCSLGXSEUVWYCL-LAUBAEHRSA-N 393.556 5.029 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 66955767 OAEIBHWRZIMSGV-RHSMWYFYSA-N 385.558 5.684 30 20 GKED C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)c1ccc(C#N)cc1 118174007 VNTKDQKAOFRPJE-AWEZNQCLSA-N 385.496 5.486 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(C(=O)Nc3ccccc3)cc2)n1 131160435 VDQQYKYFJHBGHX-GOSISDBHSA-N 389.480 5.009 30 20 GKED N#CCCN(C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)C12CC3CC(CC(C3)C1)C2 133742795 AQQRVAJQBMJDPZ-KQCPESONSA-N 382.470 5.066 30 20 GKED N#C[C@@H](C(=O)c1ccc(CCC(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 152078891 VABIKKRLDQORCX-CQSZACIVSA-N 386.295 5.085 30 20 GKED CC[C@@H](C)N/C(S)=C(/C(=O)c1cc(C)ccc1C)[n+]1ccc(C(C)(C)C)cc1 154479064 LDLRTONFIXJEMI-GOSISDBHSA-O 397.608 5.215 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1occc1Br 176889801 HIJRSEDQGPQJCY-UHFFFAOYSA-N 397.228 5.267 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 183809833 BNKVPZAQRYMOGY-INIZCTEOSA-N 398.422 5.285 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1nc(-c2ccccc2)c[nH]1 191509794 KBAJJYKWZDEPHO-UHFFFAOYSA-N 388.515 5.593 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C\c2ccc3ccc(Cl)cc3n2)n1 255326886 TULKQNGXICOQSU-XITLMJRVSA-N 381.888 5.358 30 20 GKED Cc1ccc(-c2csc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)n2)c(C)c1 330010998 HMPMZOSRUKPXDB-UHFFFAOYSA-N 397.544 5.940 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3ccc(Cl)cc3CC#N)c12 410972142 UAQUFFAODQGDAH-UHFFFAOYSA-N 394.862 5.195 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2oc3ccccc3c2CSc2ccccc2F)C1 424977789 NMAXEGDTWTUREI-LSDHHAIUSA-N 394.471 5.286 30 20 GKED N#C[C@H]1CC[C@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1 430100169 NJZMBWZLZYBNAB-LPHOPBHVSA-N 394.931 5.431 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 432289335 OCMSKHKARIKBRY-KRWDZBQOSA-N 375.497 5.724 30 20 GKED Cc1csc(-c2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2)n1 432839164 KALCQBMVIUHRBF-HXUWFJFHSA-N 390.512 5.675 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1ccccc1[N+](=O)[O-] 433145167 PIPITEVIFXVQNU-AWEZNQCLSA-N 398.488 5.046 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(Oc2ccccc2F)c(F)c1 436108346 ZEYGXVCWNUREES-MHZLTWQESA-N 391.483 5.726 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1ccc(C#N)cc1Br 444775991 BSVLWJCRMJIMTB-QGZVFWFLSA-N 397.238 5.413 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccccc1 458797044 FRZCJWPICUPRGL-HSZRJFAPSA-N 391.490 5.450 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)CCc2cncc3ccccc23)cc1 462610588 CQWBJNYZPSGLCE-UHFFFAOYSA-N 391.474 5.022 30 20 GKED Cc1c(Br)cccc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 463742630 CJNAVUPDIIVXHY-HNNXBMFYSA-N 398.087 5.059 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H]2c2cccc(F)c2)c2ccccc21 468850247 GFKTYOKLSBIJEY-OAQYLSRUSA-N 375.447 5.061 30 20 GKED CCc1cccc(Cl)c1CNc1ccc2c(c1)CCC(=O)N2CCCC#N 474010101 OTZGFWIBPCFQRK-UHFFFAOYSA-N 381.907 5.097 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)N2CCC(F)(C#N)CC2)c2cccs2)cc1 476839785 ATIQZQCSQOSKBH-OXQOHEQNSA-N 399.535 5.388 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(OC)cc1)c1ccc(F)c(F)c1 477730493 XAIYJCQIFPIVKN-NHCUHLMSSA-N 386.442 5.137 30 20 GKED CCSc1cccc(Br)c1NC(=O)c1cc(C#N)ccc1Cl 484871159 CBCBBNJWEVFHBW-UHFFFAOYSA-N 395.709 5.338 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@H](C)CSc1ccccc1OC 486228788 IHTLCYMTYLPOHZ-INIZCTEOSA-N 387.570 5.132 30 20 GKED CCc1sc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Br 487629343 RLEUQJWTBRZYNS-HNNXBMFYSA-N 391.334 5.238 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cccc(Oc3ccncc3)c2)cc1 496465629 AACAROAMTXVLEX-QFIPXVFZSA-N 385.467 5.166 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(N)cc1Cl 502133924 RUIOSLDHALDLTA-GFCCVEGCSA-N 391.949 5.047 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)Cc1cc(C#N)ccc1F 507243452 QQDXOHGGMXZEIB-UHFFFAOYSA-N 377.463 5.197 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3c3ccsc3)c2)cc1 517905496 GABLTVIIUSUIBO-NRFANRHFSA-N 389.480 5.781 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(Cl)c(Cl)c1 519515773 WECWMTKZJDKZEM-CYBMUJFWSA-N 393.339 5.959 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ncc(-c2ccccc2)s1 520153393 FOXZFCRJBDTPEO-UHFFFAOYSA-N 376.485 5.124 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(Cl)c1 521816622 AWDCIZBMVBKORS-HNNXBMFYSA-N 395.915 6.068 30 20 GKED N#CCN(C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)C1CCCC1 523145580 BFBMXBZMUDHLRP-UHFFFAOYSA-N 386.826 5.482 30 20 GKED N#Cc1cccc(-c2nnc(CSc3ccc(C4CCCCC4)cc3)o2)c1 525624438 WRXWMIYLHVJFIH-UHFFFAOYSA-N 375.497 5.948 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCC[C@H]1C1CCCCC1 532920460 VFCWONQKOZRHBQ-XLIONFOSSA-N 385.577 5.064 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(NC(=O)C2CC2)cc1 535071562 AHEXHYUBDMQMOY-HYCNBMAASA-N 387.527 5.090 30 20 GKED C[C@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)Cc1ccc(Cl)cc1 536792692 ZOQJVWMZCSLCQM-KRWDZBQOSA-N 378.903 5.096 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 536935091 MQUQEOUKIGLIIZ-CRAIPNDOSA-N 397.400 5.196 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cnc(-c3ccccn3)s2)cc1 538001912 HADHKUGSBUHIAA-UHFFFAOYSA-N 382.492 5.034 30 20 GKED COc1cc(C#N)ccc1CN[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 539421515 NGKLAJKMBQVZPQ-LJQANCHMSA-N 394.824 5.480 30 20 GKED C=CCCOCCCCC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1 540490283 AKJTZKAUIDQBQD-XMMPIXPASA-N 377.528 5.118 30 20 GKED CC(C)C[C@H]1C[C@@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 540777608 WBNHTWVKAHPEJC-OALUTQOASA-N 394.540 5.033 30 20 GKED Cc1nc(-c2cccc(-c3noc([C@H](C)Oc4ccccc4C#N)n3)c2)cs1 546401747 PNWMIJFMCWBGPR-ZDUSSCGKSA-N 388.452 5.180 30 20 GKED C=CCn1c(SCC(=O)c2cccc(Cl)c2Cl)nnc1-c1ccco1 549222731 AGLAYAYOSLWTBN-UHFFFAOYSA-N 394.283 5.006 30 20 GKED COCC[C@@H](NC(=O)c1cc(C#N)ccc1Cl)c1ccc(Cl)c(Cl)c1 552397992 DASCMNDOMTWICK-QGZVFWFLSA-N 397.689 5.026 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 553640433 WUTLORCLNVTUFI-SFHVURJKSA-N 385.467 5.407 30 20 GKED N#CCC[C@@H](NC(=O)NCc1cccc(OCc2ccccc2)c1)c1ccccc1 554020684 LLWVCKWAPVOZIQ-XMMPIXPASA-N 399.494 5.110 30 20 GKED Cc1sc(C2(NCc3ccc(C#N)c(F)c3)CCC2)nc1-c1ccccc1F 563461751 JPWYQUQFFMWNEA-UHFFFAOYSA-N 395.478 5.437 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)[C@H]1c1cccs1 572107555 PCTGMABWTLIFDB-NRFANRHFSA-N 387.508 5.158 30 20 GKED N#CCCC1CCN(C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)CC1 574918104 DNWAZKODJSFTRY-UHFFFAOYSA-N 394.327 5.273 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)CC2)c1 587110549 VXTKMHXLKAVYIX-UXHICEINSA-N 398.428 5.061 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 588151649 DRHAQDGEXOWGIV-UHFFFAOYSA-N 378.259 5.593 30 20 GKED CCCN(C(=O)CCCCCC#N)[C@H](c1cccnc1)c1ccc(F)c(C)c1 588934206 RGPWTADEMKQEPP-QHCPKHFHSA-N 381.495 5.331 30 20 GKED C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N1CCC(CCC#N)CC1 592135543 ZNRFUCJRVICUQU-LBPRGKRZSA-N 379.291 5.120 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N2Cc3cccc(C#N)c3C2)c1 593161258 BQSZQFHDMKNANP-UHFFFAOYSA-N 391.418 5.069 30 20 GKED CCN(C(=O)CC1(C#N)CCCCC1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 597216305 CKIWZQFBJCQLQD-QFIPXVFZSA-N 397.469 5.162 30 20 GKED N#Cc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c(F)c1 602758239 LHEXWQOLWUDUPC-HXUWFJFHSA-N 395.796 5.261 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(F)c(F)cc3Cl)c2)cc1 609175963 RUCLTCXXMHAOQB-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#C[C@H](NC(=O)c1cc(C2CC2)nc2ccccc12)c1cccc(C(F)(F)F)c1 609460633 INGLZDRQWOBGOD-FQEVSTJZSA-N 395.384 5.126 30 20 GKED CCN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)[C@@H](C)c1ccc(C#N)cc1 609987174 HJANKGDAZBQKHD-SFHVURJKSA-N 394.478 5.397 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)C1 612295212 QHWAYPCZFQZFTM-QFIPXVFZSA-N 390.512 5.045 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 612536021 BCEMHALHHOHJEL-MRXNPFEDSA-N 383.211 5.104 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-n4nccc4C)cc3)n2)cc1 613315623 SAANLNIXMHNFQK-HXUWFJFHSA-N 398.491 5.103 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCCC2)c1nc2ccccc2n1C(F)F 613401895 RFEUMAGLARHOAF-AWEZNQCLSA-N 399.466 5.642 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCCCCCc2ccc(F)cc2)c(Cl)c1 614668282 QJCZCFUVKOQYJY-UHFFFAOYSA-N 379.262 5.147 30 20 GKED C=CC[C@@H]1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)nn2)C1 617782889 OKETYZIHQIGDRH-CYBMUJFWSA-N 392.286 5.004 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c(Cl)c1 619781744 VRXNYRAVOWCMJQ-CYBMUJFWSA-N 391.220 5.060 30 20 GKED COc1ccc(F)cc1[C@H](C)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 625288946 RJYCDFULEJFRPH-JTQLQIEISA-N 395.318 5.723 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1[C@H]2C=CC[C@H]1CC2 646438984 CBGPCTKPZQAJLR-STQMWFEESA-N 396.306 5.301 30 20 GKED C[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cncc(F)c1 647229853 OIZGWCYHXPFJEN-SECBINFHSA-N 384.270 5.683 30 20 GKED C=CCOc1ccc(C(=O)Nc2cc(OC)c(Cl)cc2C2CC2)cc1OC 655383603 ACOQMVTWMJRMPM-UHFFFAOYSA-N 387.863 5.052 30 20 GKED CCOc1ccccc1CCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727934396 GNUGDFFLAYSLAS-HSZRJFAPSA-N 399.494 5.105 30 20 GKED CC(C)C[C@@H](C)N(C(=O)c1cc2ccccc2n1CC#N)c1ccc2[nH]ccc2c1 729653941 RDFYQPGBJQCWGC-GOSISDBHSA-N 398.510 5.728 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCc3ccc(F)cc32)cc1 730131379 LNAWBXXTEKHHMJ-DHIUTWEWSA-N 385.442 5.290 30 20 GKED CCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730422409 XKHRDKTXOOOOCL-QGZVFWFLSA-N 394.471 5.227 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)-c1ccccc1C2 730990034 REOWIQIYHZWKFO-INIZCTEOSA-N 384.504 5.762 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)c(C#N)c2n1CCC2 731937831 NDZKZFJVNWYLCE-ALCCZGGFSA-N 378.781 5.183 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N(CCC#N)c3ccc(F)cc3)sc21 732093610 JDAUWSATIBDFTE-UHFFFAOYSA-N 377.444 5.093 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cncc(F)c1 737445856 GVWNRUSZAXXLBX-WAYWQWQTSA-N 378.350 5.259 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC(F)F)c(OC)c2)ccc1SC 746345377 FOINHHFXDXLXNV-DAXSKMNVSA-N 396.480 5.637 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3ccccc3C(F)(F)F)o2)cc1 748095468 MNTXSHLNYGSKRO-CYBMUJFWSA-N 375.350 5.176 30 20 GKED Cc1nc(/C=C\c2ccccc2C#N)sc1C(=O)/C=C\c1ccccc1C#N 755586180 IISVFICQCJEFTL-MIMPSMLTSA-N 381.460 5.261 30 20 GKED C[C@H](OC(=O)c1ccc(C(F)(F)F)cc1C#N)c1ncc(-c2ccccc2)o1 758120813 ADIMOQRKCNQBCG-LBPRGKRZSA-N 386.329 5.150 30 20 GKED Cc1noc(C)c1CCOC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 761487312 HXNMURIXPQMLFO-UHFFFAOYSA-N 396.830 5.008 30 20 GKED CCCCCCC[S@@](=O)Cc1coc(-c2ccc(Br)cc2)n1 764454198 KGESLXCLPKQUJC-JOCHJYFZSA-N 384.339 5.323 30 20 GKED CC(C)c1ccc(C[C@H]2CCN(C(=O)Nc3ccccc3O[C@H](C)C#N)C2)cc1 764694907 SKTRKZRAIRDIAF-UYAOXDASSA-N 391.515 5.197 30 20 GKED N#Cc1ccc(F)c(CN[C@@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)c1 773024594 JMTQAISGSDBTGH-GOSISDBHSA-N 397.906 5.641 30 20 GKED CC(C)[C@@H]1C[C@@H]1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773982692 LKHZPZTVLNYTSB-MELADBBJSA-N 379.312 5.585 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1)c1ccccc1 777665064 AYRPDTSZFYAMIK-LJQANCHMSA-N 393.874 5.611 30 20 GKED C=CCC[C@@H](C(=O)O[C@H](C)c1nnc(-c2ccc(C)cc2)o1)c1ccccc1 778550930 FCBMCNJXVPAAHR-YLJYHZDGSA-N 376.456 5.399 30 20 GKED N#C[C@@H](C(=O)CCn1c2ccccc2c2ccccc21)c1cnc2ccccc2n1 792113108 FADCEFAHFSUAHH-LJQANCHMSA-N 390.446 5.004 30 20 GKED COCC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCC1 793124247 KNXPJIAHHMNEEV-CYBMUJFWSA-N 395.311 5.110 30 20 GKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccc(OC(F)(F)F)cc1 796817029 OHGIQWZSEILLIX-XLIONFOSSA-N 392.421 5.507 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccccc1SC(C)(C)C 798181826 ZVHRENWFLJGMOH-KRWDZBQOSA-N 394.588 5.163 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CSCCCC2(C#N)CCOCC2)c1 798401622 ZNRPKKBTTDVBFD-UHFFFAOYSA-N 390.549 5.367 30 20 GKED N#C[C@H](C(=O)CC1CC(c2ccccc2)C1)C(=O)Nc1cccc2ccccc12 798816114 HPUSETNVNWZNNA-INXVGGANSA-N 382.463 5.071 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 808385538 SVAOKOHSRARKHS-JTQLQIEISA-N 380.300 5.343 30 20 GKED C[C@@H](NCc1ccnc(Cl)c1Cl)c1ccc(-c2cccc(C#N)c2)cc1 811489083 VPFXPGXTPLEWGI-CQSZACIVSA-N 382.294 5.778 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)c1cc2c(s1)CCCC2)c1ccc(Cl)s1 845838406 SKEKCEVUBHGDTC-PWSUYJOCSA-N 377.918 5.037 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 850770839 BXHXTRXECLZCTM-RRQGHBQHSA-N 396.899 5.328 30 20 GKED C=CCCC[C@H](NCc1ccc(-c2ccccc2Br)cc1)C(=O)O 900068200 BHBZFUAEQAMPGP-IBGZPJMESA-N 388.305 5.015 30 20 GKED CCCCCCCCCC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 916654065 VGEZUUJLFMPMFF-MRXNPFEDSA-N 399.560 5.593 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccc(Cl)cc2)cc1 916914333 YNYXOJSTXDUXIS-CBHXRGPZSA-N 380.875 5.043 30 20 GKED Cc1cccc(CSCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917047092 QUUDOKSQDYIXEF-OAHLLOKOSA-N 386.929 5.368 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)Nc1ccc(Cl)cc1 920078338 PQVBOPQLUOWEIE-UHFFFAOYSA-N 393.899 6.121 30 20 GKED CC(C)(C)[C@@H]1C/C(=C\c2cccc(C#N)c2)c2nc3ccccc3c(C(=O)O)c2C1 1776121594 OLCPXTFFBFLKMI-TVNWYLLRSA-N 396.490 5.954 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccccc1Oc1cc(Cl)cc(Cl)c1 1776148929 QSHFMNUBSVQRGR-MRXNPFEDSA-N 380.271 5.295 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)s1 1776339872 IQWXOJGZPUWRGF-XBXARRHUSA-N 396.464 5.507 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccccc2SC(F)(F)F)c1)C(=O)O 1776473365 AFYVIWOHIGASIK-BZYZDCJZSA-N 396.386 5.047 30 20 GKED CCCCCCCOc1ccc(/C=C2/CCc3ncc(C(=O)O)cc3C2=O)cc1 1776785874 GSHHNLSSMAIONM-JXAWBTAJSA-N 393.483 5.342 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1777033346 ABDZLDICYLMOOT-LUAWRHEFSA-N 391.492 5.071 30 20 GKED Cc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)c(Br)c1 1777433855 ZVRQHUFPPCASTK-HYXAFXHYSA-N 385.666 5.067 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(C2CCCCC2)cc1 1777640967 IVGRNQRBICUZAE-PFONDFGASA-N 378.468 5.484 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)c1 1777686172 UHUQFVVVDJQPGE-NTMALXAHSA-N 375.405 5.151 30 20 GKED C=CCn1c(SCc2cccc3cccnc23)nnc1-c1ccc(F)cc1 11394046 AKNBPXKZZHANFQ-UHFFFAOYSA-N 376.460 5.111 30 20 GKED CC(C)[C@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 66861006 ZCVIOEKTMUDETR-VGSWGCGISA-N 381.545 5.006 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2ccccc21 66953847 FWEQSNYFUPGQAG-RDJZCZTQSA-N 381.501 5.116 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 108530841 DAFUOYDVRPQPOK-KGLIPLIRSA-N 389.471 5.441 30 20 GKED COc1cc(CCC(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1Cl 122852880 UWGIPGNKNWVGAI-CQSZACIVSA-N 388.920 5.172 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 129457383 FGOVXGIXZURDOZ-HNNXBMFYSA-N 392.484 5.688 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1c(F)cccc1F 171759144 KZKUBVTZEUUGQA-AWEZNQCLSA-N 393.393 5.068 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccccc1SC[C@H](C)C#N 174713373 DEUFPTZAEHKNNW-CQSZACIVSA-N 377.469 5.154 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1OC(F)F 175982605 HHEGQYSCZXUVTN-CEFACKQISA-N 376.428 5.148 30 20 GKED COc1cc([C@@H](C)Nc2cccc(OCCCC#N)c2)ccc1SC(F)F 179818485 SORXWYQAGGUEHD-CQSZACIVSA-N 392.471 5.866 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 181131447 ONIIAPRUSNZMJP-CQSZACIVSA-N 379.441 5.226 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@@H](c3ccc(Cl)cc3)C3CCCC3)o2)cc1 182540659 QQIIZCWLCGALTR-OAQYLSRUSA-N 392.890 5.283 30 20 GKED CC[C@H](C#N)Oc1cc(CNC2c3ccccc3-c3ccccc32)ccc1OC 183901183 ZCCJBGOOPRYVPM-GOSISDBHSA-N 384.479 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(O[C@@H]2CCOC2)cc1 191461297 XUPMNQAUQJWCKT-HXUWFJFHSA-N 380.488 5.350 30 20 GKED C#CCCCC(=O)Nc1c(C)cccc1-c1nc2cc(F)ccc2n1C(C)C 192352148 JMCQHODNMKVFBK-UHFFFAOYSA-N 377.463 5.474 30 20 GKED CCCCCOc1ccc(C=Nn2c(-c3ccccc3OC)n[nH]c2=S)cc1 254738942 PGBHFXMTYKXYSJ-UHFFFAOYSA-N 396.516 5.067 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 301764429 QLPSYNOUEHHXRJ-KSSFIOAISA-N 380.900 5.834 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](C)c2cccc(OC(F)F)c2)c1 303217308 TYYYMXPJSWURAV-CQSZACIVSA-N 376.403 5.126 30 20 GKED C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 303310722 FOSDVYFDFWXQAL-CQSZACIVSA-N 394.377 5.035 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1CC1CCCCC1 303370426 JWCPZGYFUNFPLW-IEBWSBKVSA-N 385.577 5.905 30 20 GKED CCS(=O)(=O)Nc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc1 303447979 ZZDCJQOVBWEPNH-OUKQBFOZSA-N 397.521 5.073 30 20 GKED CC[C@H](/C(O)=N/C1(c2noc([C@H]3CCOC3)n2)CCCCCC1)c1ccccc1 329783730 VJUCTYZAUPJMNT-OALUTQOASA-N 397.519 5.273 30 20 GKED Cc1ccc(-c2nc(C)sc2C/C(O)=N/[C@H]2CCOC3(CCCCC3)C2)cc1 330233687 YAKHCPQHXQRNJS-IBGZPJMESA-N 398.572 5.808 30 20 GKED CC[C@@H]1OCCC[C@H]1C(O)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 330245270 KPFVWONLTQDCDC-APWZRJJASA-N 376.472 5.787 30 20 GKED OC(=Nc1ccc(Cl)c(/C(O)=N/C2CCCCC2)c1)[C@@H]1CCCN1C1CC1 330271628 WEVSEAYHRXQYJK-IBGZPJMESA-N 389.927 5.192 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccccc1 431313773 QHNIPGVVHVXFDZ-KMDXXIMOSA-N 383.495 5.430 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)cc1 431525992 RHXXTDXPYYSOCP-HXUWFJFHSA-N 383.442 5.525 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 432815797 KFSMRBJLKAZFGM-UHFFFAOYSA-N 394.478 5.250 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(Cl)c1-n1cccn1)c1ccccc1 432916695 IYVBKNJBYXGACL-SFHVURJKSA-N 393.878 5.082 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(Cl)cc1Cl 440577403 BJOWWUJYWYFEMO-LLVKDONJSA-N 380.300 6.032 30 20 GKED N#CC1CCC(CNC(=O)N2CCC(c3cccc4ccccc34)CC2)CC1 441015958 ZNHYZMLCTRXOLA-UHFFFAOYSA-N 375.516 5.059 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(Cc2ccccc2)CCOCC1 455237981 APEFOHBEXXWELD-UHFFFAOYSA-N 392.543 5.452 30 20 GKED CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H](C)c1cccc(OC)c1 458794259 ATBSYQHWTNQRAJ-GCJKJVERSA-N 379.504 5.223 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(F)c(F)c1F 465453391 QAAPDMMIBWXFLW-UHFFFAOYSA-N 382.341 5.329 30 20 GKED N#CCCCn1cc(C(=O)N2CCCC[C@H]2Cc2ccccc2)c2ccccc21 469047724 UREJDTRRJDFWHH-NRFANRHFSA-N 385.511 5.182 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 471255289 SAACHBDCGIXCEU-DYVFJYSZSA-N 389.377 5.155 30 20 GKED Cc1c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cccc1C(F)(F)F 473829284 LAROLHQWSSIOSH-APWZRJJASA-N 387.405 5.318 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2cccc(Cl)c2)c1C 476083477 CJHXRSUMRHHXBN-UHFFFAOYSA-N 393.918 5.938 30 20 GKED C[C@@H](c1cccc(Cl)c1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 480339435 UCLPSXAHHZQUQI-INIZCTEOSA-N 395.911 5.555 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1c1ccccc1 480803097 HLHAYTYANUMCIX-SBUREZEXSA-N 383.451 5.575 30 20 GKED N#CCCC[C@@H](NC(=O)c1[nH]c2ccccc2c1Br)c1ccccc1 487212715 SQISAIUPSIKKKM-MRXNPFEDSA-N 396.288 5.095 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 498079944 NMEYETDSQLBTKR-FQEVSTJZSA-N 394.471 5.035 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](CCCCc2ccccc2)c2ccccc2)CC1 504394261 CUPHOOFYGXJTLE-HSZRJFAPSA-N 389.543 5.476 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1nc2ccccc2s1 505029669 PEXHKRGUMXOXTI-IBGZPJMESA-N 377.513 5.784 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2-c2nc3ccccc3s2)c1 505945187 YPWJJTFIZZNEPR-UHFFFAOYSA-N 389.867 5.741 30 20 GKED CC(C)N(Cc1ccccc1F)Cc1cn(CCC#N)nc1-c1ccccc1 507153734 DZKKHBDSOKDTQH-UHFFFAOYSA-N 376.479 5.013 30 20 GKED C=C(C)COc1cccc(NC(=O)c2c(Br)sc(C)c2C)c1 507639280 YPOHHCMEORHFBI-UHFFFAOYSA-N 380.307 5.335 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)N(CC)c3ccc(C#N)cc3)s2)cc1 510378226 XUXPYQNLKWEMEB-UHFFFAOYSA-N 391.496 5.056 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C(F)(F)F)cn1 513159938 JSAWFHGSODBNIE-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#Cc1ccccc1-c1ccc(CN(Cc2ccccc2)Cc2cc[nH]n2)cc1 519532724 UXGATNIZYWLLHO-UHFFFAOYSA-N 378.479 5.151 30 20 GKED CCn1c(C)cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1C 520429541 REEOUPWWPCSAFO-AWEZNQCLSA-N 385.439 5.017 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cc(Cl)ccc3Cl)cc2)nc1 521955070 QMVPGYXLAXWQPX-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1 522434723 PXQWIPCMAMSUKE-RUZDIDTESA-N 399.538 5.114 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1ncc(C(C)C)n1C(C)C 523500141 CRONIUPOWMFDIH-UHFFFAOYSA-N 389.590 5.596 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@H]3c3c(F)cccc3Cl)n2)cc1 524824335 JPRZVZCQQXYAPN-ZIAGYGMSSA-N 397.862 5.216 30 20 GKED Clc1ccccc1C#CCSc1nnc(C2CC2)n1Cc1ccccc1 532620280 CWWSSQHHAPKZRH-UHFFFAOYSA-N 379.916 5.001 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccccc1SCc1ccccc1OC)OCC 534452621 WAKTUSKEDJOVIK-FQEVSTJZSA-N 385.529 5.297 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)c1ccccc1 534647679 SGFMAUFKXRYJNW-MJGOQNOKSA-N 376.525 5.362 30 20 GKED N#CC1CCN(C(=O)N[C@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)CC1 538972498 FYHNUWNDQGGPBY-HKUYNNGSSA-N 393.453 5.067 30 20 GKED COc1cccc(CNCc2ccc(-c3ccccc3C#N)cc2)c1OC(C)C 540202473 KUDMAIYKHQDUIA-UHFFFAOYSA-N 386.495 5.311 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2csc(-c3ccsc3)n2)cc1 540203200 WSFBCTYQUPZFMT-UHFFFAOYSA-N 387.533 5.700 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1cccn1C)c1ccc(-c2cccc(C#N)c2)cc1 542085321 NPIJFVZTNAPFPH-KOSHJBKYSA-N 398.510 5.171 30 20 GKED CCc1nc(C)c([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542996271 XKHQMYPAPAROQP-HOTGVXAUSA-N 375.541 5.964 30 20 GKED N#CCc1ccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)cc1 544099548 QSGHCUAPHJWORX-RUZDIDTESA-N 395.506 5.342 30 20 GKED C=CCC(CC=C)C(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1 544254002 MHWBOENDGHWBNI-DNQXCXABSA-N 375.512 5.521 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H](CCCC#N)c1ccccc1 556198864 YCTYTORKHHHQRW-KKSFZXQISA-N 393.531 6.343 30 20 GKED N#CCc1ccc(C[S@@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 559231944 SHCYHQPPMRFOLY-ATIYNZHBSA-N 379.912 5.444 30 20 GKED Cc1cc(Oc2cc(C(F)(F)F)nc(-c3ccncc3)n2)c(C)c(C)c1C#N 561450041 VVMQLQUCCSVMOY-UHFFFAOYSA-N 384.361 5.147 30 20 GKED COc1ccccc1-c1ccc(CN(Cc2nc(C#N)cs2)C(C)C)cc1 567528499 BVLKLFPANNAOHB-UHFFFAOYSA-N 377.513 5.101 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CC1CC1)c1ccc(C#N)cc1Cl 573663421 CTNCBFQBSPAUBJ-CQSZACIVSA-N 379.891 5.074 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 573893457 SMXLTOXBEJIFHQ-UHFFFAOYSA-N 375.472 5.293 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 590076763 ZMZUKRKWDUDGBK-UHFFFAOYSA-N 391.471 5.187 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)CCCCC#N)c2)cc1 593991497 FIUUAKCBJIPXAH-IBGZPJMESA-N 378.516 5.744 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(-c2ccccc2F)on1 604116605 ADSJQGMCZBUUNU-UHFFFAOYSA-N 389.411 5.333 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)sc2c1 605363338 VAEIRCIURFKKQO-ZDUSSCGKSA-N 379.872 5.538 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)c2)cc1 609177117 KCBUPTCCAXFKQF-HZPDHXFCSA-N 388.389 5.658 30 20 GKED CCCN(C(=O)c1cc(F)cc(Br)c1)c1cc(Cl)ccc1C#N 609286315 UAJDSJULPDSATE-UHFFFAOYSA-N 395.659 5.170 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3csc(-c4ccoc4)n3)c2)cc1 609372574 HQUFYMXRNUTFPB-UHFFFAOYSA-N 387.420 5.319 30 20 GKED Cc1ccccc1CCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378445 MNWLKDJNAFQKCC-UHFFFAOYSA-N 392.446 5.591 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2cccs2)n1 609428294 KYKGNEYJOMTEJU-LBPRGKRZSA-N 385.539 5.518 30 20 GKED CCOc1cccc([C@@H](C)NCc2cccc(OCc3ccccc3C#N)c2)c1 609433173 BCNWFJPSPAYRJW-LJQANCHMSA-N 386.495 5.387 30 20 GKED C[C@H]1c2cccn2CCN1C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609730972 HBBCCAZGDMICBE-HNNXBMFYSA-N 391.858 5.022 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1N(C)Cc1ccccc1)c1cccc(C#N)c1 610325178 GAZHBTRGLCDMFA-GOSISDBHSA-N 384.483 5.077 30 20 GKED N#Cc1cc(C(=O)Nc2cc(Br)c(F)cc2Cl)ccc1Cl 612477959 NMCWOGSXGCRLKP-UHFFFAOYSA-N 388.023 5.019 30 20 GKED C=CCCO[C@H](C)C(=O)N(Cc1ccsc1)c1ccc(Br)cc1 620574698 WNNKUJPFEPLSFA-CQSZACIVSA-N 394.334 5.025 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)cc2)cs1 669601489 HSXFIKSKOIPMQO-HNNXBMFYSA-N 393.468 5.357 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)c3cc(F)c(Cl)nc3Cl)cc2)cc1 727746810 VJURDMHBBZEXTF-UHFFFAOYSA-N 387.197 5.285 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(OC)c(F)c3)s2)cc1 727975190 RDMMDNKRNXZXLH-ONNFQVAWSA-N 383.444 5.171 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(C(F)(F)F)n3)c2)cc1 728472062 NTIWAIMUZYCUMR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccn1 729553390 OYFSBYGZMTXOND-FYYLOGMGSA-N 384.483 5.400 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2c(C)cccc2C1 729562949 HYRBILPREGPOLS-UHFFFAOYSA-N 397.478 5.558 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)Cc2ccc(OCC#N)cc2)C(C)C)cc1 731962263 LDNNBWBLFSPYHY-KOSHJBKYSA-N 378.516 5.158 30 20 GKED C/C(=C/C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 731970838 HBCYIPJJAOEVMO-DCKDXSSCSA-N 397.334 5.255 30 20 GKED C=CCN1CCC(NC(=O)c2sc3cc(C(C)C)ccc3c2Cl)CC1 732659645 GUKLZWHVJAIESU-UHFFFAOYSA-N 376.953 5.058 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)/C=C/c2ccccc2C#N)cc1 732963618 PDLIZPAOWAMUMW-ZSNJSTEGSA-N 395.506 5.167 30 20 GKED FC(F)(F)c1cc(NN=C2CCC[C@H]2c2ccccc2)nc(-c2cccnc2)n1 733080244 HWGAQWLATHLSTJ-INIZCTEOSA-N 397.404 5.293 30 20 GKED CCN(c1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1)C(C)C 733614612 JHSFRAQDCVERDH-UHFFFAOYSA-N 380.492 5.248 30 20 GKED C=C(Cl)CNC(=O)c1oc2ccccc2c1COc1ccccc1Cl 736242985 UZDPROKULHNNKS-UHFFFAOYSA-N 376.239 5.148 30 20 GKED Cc1nc2ccccc2cc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739598181 FGBYVJYGLZMOFI-UHFFFAOYSA-N 383.476 5.073 30 20 GKED N#CCC[C@H](NC(=S)Nc1ccc(SC(F)F)cc1)c1ccccc1 747711273 ZOPZSGZUWRYAEA-INIZCTEOSA-N 377.485 5.333 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2ccc(Cl)cc2)n1)Cc1ccccc1 750785158 ZSIUEZHXIKGISM-HNNXBMFYSA-N 382.872 5.003 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccnc1 760181831 BGBQCMIEGCVBOH-MRXNPFEDSA-N 381.888 5.013 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(O)(c2cccc(C)c2C)CC1)c1ccccc1 768401536 BZXPSJFWOWJHQY-QHCPKHFHSA-N 392.543 5.004 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 772417500 LTLQIIGJAPLKFY-RTWAWAEBSA-N 379.529 5.091 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 772981354 VXVIMIXCCBTDTG-CJNGLKHVSA-N 384.501 5.181 30 20 GKED C[C@H](NC(=S)NCc1ccc(-c2ccccc2C#N)cc1)c1cccs1 773164823 ZTSXCUSQPWIEKE-HNNXBMFYSA-N 377.538 5.012 30 20 GKED CC(=NOC1CCOCC1)c1ccc(-c2ccccc2Br)s1 774430466 GGXOMYGRDTZTFW-UHFFFAOYSA-N 380.307 5.097 30 20 GKED C[C@H](NCc1cccc(COCc2ccccc2)c1)c1ccc(OCC#N)cc1 776153572 FIKSGIZSDPFPRX-FQEVSTJZSA-N 386.495 5.157 30 20 GKED N#Cc1ccc(CNC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)nc1 782025850 KXRQVBCEXZAMPG-UHFFFAOYSA-N 396.686 5.058 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc(O)cc2F)c1 782852805 PSTBRNZQIXNGOV-UHFFFAOYSA-N 382.778 5.101 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(OC(F)F)cc1 796990341 BJMAQHHIMMDGKL-JXMROGBWSA-N 375.371 5.447 30 20 GKED COc1ccc2cccc(CC(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2c1 797567220 DSWBRZUKGDNXHO-GOSISDBHSA-N 378.497 5.021 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1nc(-c2c(F)cccc2F)cs1 798287034 AKZCQVVYVZSBJC-ZNMIVQPWSA-N 398.409 5.207 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CCC(F)(F)CC1 806201285 WCPLSKLPEOCZSW-FQEVSTJZSA-N 383.442 5.384 30 20 GKED C=CCCCCCCCNC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 812493260 CHPFLEDGVIKSNP-RTWAWAEBSA-N 376.516 5.214 30 20 GKED N#Cc1c(COC(=O)c2ccc(C3SCCCS3)cc2)cn2ccccc12 818064121 WHOFJUJEWOFVHL-UHFFFAOYSA-N 394.521 5.037 30 20 GKED C[C@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCCO1 838786372 IKPYJVMLYAHSIY-FZKQIMNGSA-N 395.311 5.252 30 20 GKED CCCCCCCC[C@@H](C)C(=O)Nc1cccc(C(=O)NC)c1Br 857621170 YSRBVQRMBDFOTC-CQSZACIVSA-N 397.357 5.134 30 20 GKED CCCCCCCCCCC(=O)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 915700499 IRQMGZDQHYFDFT-HXUWFJFHSA-N 388.600 5.241 30 20 GKED N#C[C@@H](C(=O)CSc1ccc2c(c1)CCC2)c1nc2cc(Cl)ccc2s1 917045823 ALRLPZDABNBUKC-INIZCTEOSA-N 398.940 5.407 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1ccc(-c2ccc(Cl)cc2F)s1 1776013297 NCHCMNZJUUAMMP-UHFFFAOYSA-N 388.851 5.742 30 20 GKED CC(CCCCCCC(=O)O)=NNc1ccc(Cl)c(Br)c1 1776105345 ZRJAEXDXCUDOAT-UHFFFAOYSA-N 375.694 5.316 30 20 GKED CCOc1cccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)c1 1776937454 SOZROZBVNYDKGJ-SDNWHVSQSA-N 386.447 5.276 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H]3CC=C(C)CC3)cc2)CCC1 1789115127 UDVYKQVYDQRWRY-RTBURBONSA-N 380.532 5.079 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)cs1 27041758 ZWKAJQGCRVCQOS-UHFFFAOYSA-N 395.487 5.910 30 20 GKED Cc1cc(C)c(C(=O)/C(=C(\S)NC(C)C)[n+]2ccc(C(C)(C)C)cc2)cc1C 55009719 XMUXIQHUZBKVGA-UHFFFAOYSA-O 397.608 5.134 30 20 GKED Cc1ccccc1C(C)(C)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 58694243 MZUHSNBLSUXWPY-UHFFFAOYSA-N 397.478 5.035 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1scnc1C 66668651 ICRHDVKMWSKGAI-UHFFFAOYSA-N 392.484 5.088 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(F)c(Cl)nc1Cl 103382442 SLRYXYCRGXPBGJ-UHFFFAOYSA-N 392.242 5.380 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc(-c2ccsc2)s1 112246652 DOULDMRUYWYAFN-GFCCVEGCSA-N 385.539 5.376 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 113656883 FLNJPUSIPOIWNT-CXAGYDPISA-N 390.455 5.002 30 20 GKED Cc1ccc(CO)cc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 132210272 PWSNWRXWGVOBKC-UHFFFAOYSA-N 392.842 5.057 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C/c2ccccc2OC(F)(F)F)n1 177744883 ZPXKMPYEXSODMC-GWJCSSMESA-N 380.391 5.055 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2c(C3CC3)nc3sccn23)cc1 181957394 CZRZRAKYABHSKK-UHFFFAOYSA-N 384.508 5.102 30 20 GKED Cc1cc(N=C(O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c2ncccc2c1 329383008 OSSCZCSHSOXOTL-SFHVURJKSA-N 393.491 5.212 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(=O)C(C)(C)C)cc1 428870203 GFNZVGZFALMPKR-UHFFFAOYSA-N 377.488 5.231 30 20 GKED Cc1ccc(NC(=O)[C@H](C#N)CCc2ccccc2)c(OCc2ccccc2)c1 433302820 JQSIAKXUXWVDHV-QFIPXVFZSA-N 384.479 5.285 30 20 GKED CCSc1nnc(SCCC(C#N)(c2ccccc2)c2ccccc2)s1 434644159 UKTIGUWZYSYMKV-UHFFFAOYSA-N 397.594 5.642 30 20 GKED COc1ccc(CSCCCCC(C)(C)C#N)c(Br)c1OC 435888160 GQNLZMMRMNJXKZ-UHFFFAOYSA-N 386.355 5.420 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 436329532 BNMOCTWOYKOUHX-QGPMSJSTSA-N 399.947 5.802 30 20 GKED CN(Cc1ccc(F)cc1Cl)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438644452 BEIVBSGKGNPIHO-UHFFFAOYSA-N 385.748 5.033 30 20 GKED C=CCC[C@@H](NC(=O)CCCc1ncc(C)o1)c1ccc(C(F)(F)F)cc1 450192749 AZYMPADAZFMVHS-QGZVFWFLSA-N 380.410 5.148 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccccc1)Cc1ccco1)c1ccccc1 458804327 SGSKZOCPMKVDCA-QHCPKHFHSA-N 387.483 5.427 30 20 GKED O=C([C@H]1CCC[C@H](C(F)(F)F)C1)N(Cc1ccc(F)cc1)CC(F)(F)F 460453970 YOEWXXIBJQGVNI-STQMWFEESA-N 385.323 5.085 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Oc1cccc2ccccc12 469407427 FRNUGDHYFHZAAW-IRXDYDNUSA-N 390.508 5.498 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12 471175278 GCWBMUSTEBVZIQ-UHFFFAOYSA-N 394.475 5.151 30 20 GKED C=C[C@](C)(CCOC)C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 473577160 SMXIHUPCRGSECI-VBKZILBWSA-N 392.952 5.178 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 475181183 GKMHEHQQNGTBKI-OAQYLSRUSA-N 395.462 5.685 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(COC3CCCCC3)c2)cc1 475254856 LASZFOGSJZPIOH-UHFFFAOYSA-N 376.500 5.589 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1cccc(C(F)F)c1 475869829 HNRLMUHERQHMTP-UHFFFAOYSA-N 387.455 5.273 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2cccc(Cl)c2)c1 476086106 XBILSYQYPHGYHR-UHFFFAOYSA-N 379.891 5.630 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1nc(-c2cccc(F)c2)no1 478425218 GYLGEUNWSVGCAI-INIZCTEOSA-N 398.441 5.265 30 20 GKED C=CCn1c(SCc2ccc(SC)c(OC)c2)nnc1-c1cccs1 481370289 JFOSSSPEIDJUGK-UHFFFAOYSA-N 389.571 5.215 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CCOCC1 483297854 UJZCRPCRWAQNRC-FQEVSTJZSA-N 396.918 5.387 30 20 GKED CCC1(CC)[C@@H](N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)C[C@H]1OC 483332455 VEYLGYPQDQFNEC-ZYSHUDEJSA-N 389.565 5.138 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 483470626 OGCVWOHKHVSSRP-KRWDZBQOSA-N 386.451 5.491 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3sc4c(c3C#N)CCCC4)cs2)cc1 499101263 KQMKXLWEGNURMZ-UHFFFAOYSA-N 393.537 5.112 30 20 GKED N#Cc1c(NC(=O)c2cccc([C@@H]3CCCOC3)c2)sc2c1CCCCC2 499153093 XSAKCJOYJLAFIC-QGZVFWFLSA-N 380.513 5.035 30 20 GKED Cc1ccc(-c2nc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)cs2)cc1 499317793 FAKUZNVQJPGGBN-UHFFFAOYSA-N 375.497 5.293 30 20 GKED Cc1ccc(-c2nc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)cs2)c(C)c1 499326630 HJBCCDSALRAHMP-UHFFFAOYSA-N 389.524 5.601 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 499494248 YOZDLSFRLSGQEB-UHFFFAOYSA-N 392.446 5.740 30 20 GKED COc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(C(F)(F)F)c1 502236190 XMBDZZOJFXGYLW-UHFFFAOYSA-N 393.365 5.041 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)Nc1ccc(C#N)c(Cl)c1 502645953 DGPRUBKEUKDOAM-UHFFFAOYSA-N 390.874 5.149 30 20 GKED C=C(C)COc1cc(CN[C@@H]2CCCc3cn(C4CCCC4)nc32)ccc1OC 505995216 BWJJPZSBHXFNBI-OAQYLSRUSA-N 395.547 5.129 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(-c3nc4c(F)cccc4[nH]3)cc2)c1 510169980 OISIINVLHOHIIW-UHFFFAOYSA-N 390.805 5.146 30 20 GKED Cc1cc(C)c(NC(=O)CSc2nc(-c3ccccc3)ccc2C#N)c(C)c1 510204783 AYTWLONDKYYIHR-UHFFFAOYSA-N 387.508 5.276 30 20 GKED C=C(C)CN(CCCC(=O)Nc1c(C)cc(C)cc1C)Cc1cnn(C(C)C)c1 512547999 WDXNLWLQPFQRHR-UHFFFAOYSA-N 396.579 5.186 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(COCc3ccccc3)cc2)c1 513478955 HQFWMOHWIZMRAD-UHFFFAOYSA-N 376.843 5.181 30 20 GKED C=CCOc1c(Br)cc(CNc2cccc(OC)c2)cc1OCC 513562173 GPRYLOLWNGXEHC-UHFFFAOYSA-N 392.293 5.033 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2Br)s1)c1ccc(C#N)cc1 518779545 XSXIHMQPUCBWOK-CQSZACIVSA-N 397.341 5.900 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)c1 524113687 CPLWOYNGKNIVGA-VXGBXAGGSA-N 397.208 5.209 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)cc1OCCCC#N 525695098 RBPZDYQOFOEEHC-AYPBNUJASA-N 398.934 5.518 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 533502805 QTSGICNMLISWRE-KXBFYZLASA-N 392.890 5.202 30 20 GKED C=C[C@@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 534001742 YWFOZQLUFAVBEJ-NRFANRHFSA-N 396.490 5.630 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(Sc2nc(C)cs2)cc1C)OCC 534392308 CZIBJOVUVFSFNO-QGZVFWFLSA-N 376.547 5.221 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@@H](c1cccc(F)c1F)C(F)(F)F 541262232 WCAIUAYRZLNDEV-ZDUSSCGKSA-N 398.253 5.409 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)ccc1Cl 544423894 UZOXESYILKUUCQ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccccc1SCc1cccs1 546003985 DPASKBNPJNFGOZ-UHFFFAOYSA-N 380.494 5.173 30 20 GKED N#Cc1ccccc1NC(=O)CCN1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 552829814 RVBHDLZPOOKHIP-LJQANCHMSA-N 388.298 5.031 30 20 GKED C=CCn1c([C@@H]2OCC[C@@H]2C)nnc1N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 558457099 RENIHKQQMHYYET-GDZNZVCISA-N 395.334 5.066 30 20 GKED N#CCc1cccc(Br)c1OCc1csc(Cc2ccccc2)n1 559644867 PEYCBAKVBLSQQY-UHFFFAOYSA-N 399.313 5.141 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1cc(C)c(-c2ccc(F)cc2)s1 561215914 GWDLEPJKRRSVHU-UHFFFAOYSA-N 399.487 5.166 30 20 GKED COc1cc(CN[C@H](C)c2ccc(SCC(F)(F)F)cc2)ccc1C#N 566885294 LLWQUZCCAKNGGD-CYBMUJFWSA-N 380.435 5.072 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1cccc(CSc2cc(C)ccc2C)c1 574283884 YSYWPRICPGYCBC-JOCHJYFZSA-N 398.597 5.361 30 20 GKED C=CC[C@@H](C(=O)N1CCC(c2noc3cc(F)ccc23)CC1)c1ccccc1 576735915 IAGTVURKBRHMNL-LJQANCHMSA-N 378.447 5.033 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc2sccc2c1 581338439 BLKMDXKUONMBER-CQSZACIVSA-N 381.526 5.617 30 20 GKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(OCc2ccccn2)c1 594926709 VQABGQHUKQYZRC-IBGZPJMESA-N 383.495 5.067 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N5CCC[C@H](CC#N)C5)(C4)C2)C3)cc1C 597916664 YKHOBCLAWFDUCA-PHGFOVGGSA-N 390.571 5.294 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)o1 609176779 YDTOUOQGZFYXEW-UHFFFAOYSA-N 389.455 5.038 30 20 GKED CCCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](C)c1ccc(C)o1 609401950 MLUVXMUQOPXCSQ-FUHWJXTLSA-N 399.560 6.235 30 20 GKED CCCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 610357023 FPYUDUSPTPCZRH-SJORKVTESA-N 375.472 5.548 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 610357945 WOGSWVJFNXFBBX-JLTOFOAXSA-N 395.915 5.423 30 20 GKED CCN(C(=O)c1cnc(-c2ccc(C)cc2C)s1)c1ccc(C#N)c(Cl)c1 611359575 SZKPJSFKQCMARP-UHFFFAOYSA-N 395.915 5.619 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 614640235 FRKVPXZKNKAPOG-UHFFFAOYSA-N 388.471 5.171 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(C(F)(F)F)ccc1F 622329052 XKSYYPQQGDWDOP-UHFFFAOYSA-N 395.274 5.514 30 20 GKED C[C@@H]1CCCc2ncc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)n21 651265200 JDLGKNYOBIWGMP-DOMZBBRYSA-N 396.903 5.047 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(F)c(C(F)(F)F)c(F)c2)s1 684673618 AHDCOVPBTSXKAR-VIFPVBQESA-N 388.361 5.228 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1ccc(F)cc1 727849607 GLPFDXRGAYHPRR-HSZRJFAPSA-N 381.410 5.036 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1sc2ccccc2c1Cl 730989750 PGIGKZDSUDPAMQ-GFCCVEGCSA-N 386.929 6.059 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732596008 GTXMVTHJAUMHHY-KDOFPFPSSA-N 380.900 5.519 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1 734979353 CFCYDZBPIRNPGJ-WDZFZDKYSA-N 386.423 5.296 30 20 GKED C=CC[C@H](NC(=O)N[C@H](Cc1ccccc1)c1ccccc1F)c1ccncc1 741088676 AHQGTMFYABAETJ-XZOQPEGZSA-N 389.474 5.121 30 20 GKED COCCOc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3OC)cc2)cc1 741470768 VFZGBEQSNGHYDW-CXUHLZMHSA-N 388.463 5.284 30 20 GKED C=CCOc1ccc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc1Cl 741843429 GDTPZJLKLWVDDD-HYXAFXHYSA-N 379.268 5.164 30 20 GKED N#C[C@@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2s1 744017022 XOJFKTPUCWIPKT-SFTDATJTSA-N 396.515 5.889 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744035283 LGAHSXIHCSHTNA-SWLSCSKDSA-N 386.879 5.534 30 20 GKED Cc1cc(CSc2ccccc2C(=O)Nc2sc(C)c(C)c2C#N)on1 746091127 MHHUWYRVRRVTRJ-UHFFFAOYSA-N 383.498 5.078 30 20 GKED N#CC1CCC(COC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)CC1 755977634 VDAXHUIFQGFIBH-UHFFFAOYSA-N 395.311 5.604 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 759216710 FKDCOFMWIIPPPH-RMHQSFGDSA-N 378.884 5.743 30 20 GKED C#Cc1cccc(NC(=O)N2Cc3cc(OC)ccc3C[C@@H]2c2ccccc2)c1 776296398 LTZKFUTWEZIZSN-XMMPIXPASA-N 382.463 5.008 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1 776849515 LGODLGNMGHIQBU-ZDUSSCGKSA-N 399.903 5.159 30 20 GKED N#Cc1ccc(C2(C(=O)OCc3nc4ccccc4c4ccccc34)CC2)cc1 781401495 QABNAYWUTROHDA-UHFFFAOYSA-N 378.431 5.035 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C#N)cc2Cl)ccc1OCC(F)(F)F 788359195 AKDHFRMJDXQVKT-ZZXKWVIFSA-N 395.764 5.057 30 20 GKED N#CCOc1cccc(CC(=O)N[C@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 791234489 KLRSZKHPMPJSOM-YADHBBJMSA-N 396.918 5.018 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccnc(F)c1 794718134 FHJGFTZWXTZHFG-WAYWQWQTSA-N 378.350 5.259 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC(C)(c2cccc(Cl)c2)CC1 797643374 VQDIVSRVIJGHQA-INIZCTEOSA-N 397.906 5.216 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccccc2-c2cccs2)cc1OC 800696407 SQDBXNHKMRHOBS-ACCUITESSA-N 391.492 5.640 30 20 GKED FC(F)(F)c1ccccc1N=C1NN=C(c2ccc(Cl)s2)CS1 806674066 UVMDWOABFWWHMH-UHFFFAOYSA-N 375.828 5.149 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3[C@H]4C=C[C@@H](CC4)[C@H]3C2)cc1 836269792 JBNUABJFRRGNNW-HRKPPWRHSA-N 383.495 5.018 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCC23CCOCC3)cc1)C(F)(F)F 842893673 OMRDABFDFWGWSN-ZDUSSCGKSA-N 385.323 5.347 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2SCCS2)cc1 914519026 YPYPSSFJLPBEQC-UHFFFAOYSA-N 396.581 5.335 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915087094 QCWLVDQFTMYBEI-DEOSSOPVSA-N 392.462 5.089 30 20 GKED COc1ccc2oc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c(C)c2c1 915088219 LIXDELPWCWCIBC-JOCHJYFZSA-N 396.446 5.658 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2ccc(N3CCCCC3)cc2)cc1 918156722 SMSYBISVWVVCOY-NVNXTCNLSA-N 391.515 5.103 30 20 GKED CCC(=NNc1ccccc1C(=O)O)[C@H](C)c1cccc(Br)c1 1776032239 VAQOUWIWMYULIP-GFCCVEGCSA-N 375.266 5.129 30 20 GKED COc1cccc(CC(=NNc2ccc(Cl)c(C(=O)O)c2)c2ccccc2)c1 1776033532 WJWWMUGFQBQXQR-UHFFFAOYSA-N 394.858 5.106 30 20 GKED CCC(=NNc1cccc(C(=O)O)c1C)[C@@H](C)c1cccc(Br)c1 1776089615 AEBDWVIEXYVHGZ-LBPRGKRZSA-N 389.293 5.437 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2F)cc1 1776125324 DOMUVKLOCSPHRW-NTCAYCPXSA-N 384.447 5.769 30 20 GKED CC(C)COc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776126374 KODBIEPYOJNSFB-WEVVVXLNSA-N 380.465 5.530 30 20 GKED C=CCc1ccccc1/C=C\c1cc(C(=O)O)nc(-c2ccc(Cl)cc2)n1 1776189058 FMFBLRFTMYKVNX-RAXLEYEMSA-N 376.843 5.394 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)cc1 1777673495 ZWWVSHXYUVYOTI-RVDMUPIBSA-N 395.867 5.374 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1cccc([N+](=O)[O-])c1 7740515 AOPQUECFGXGQTK-ZHACJKMWSA-N 395.846 5.006 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)CSc2nc3ccc(Cl)cc3o2)c1 22207581 CZALPBKGKTVBKP-UHFFFAOYSA-N 399.903 5.137 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)c(C)c2)[n+]2ccc(C)cc2)cc1 27092352 LPHLDXYQLHJSEH-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C[C@@H](c1ccccc1)N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161578 BPZCGMYNLWPTJB-IBGZPJMESA-N 399.494 5.557 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1ccc(Cl)cc1Cl 56199960 HHWLLOJDBFAKCM-CYBMUJFWSA-N 392.286 5.115 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(CC)cc2)nnc1-c1ccccc1 58059793 ZVSMMPVDLSLGGI-MRXNPFEDSA-N 377.513 5.057 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1ccccc1 63389071 JPSMJYQOTNEDCK-UHFFFAOYSA-N 383.451 5.571 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)c1ccccc1Sc1ccccc1C#N 65847075 JGAPRNWHICNRJH-UHFFFAOYSA-N 390.483 5.163 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCc4sccc4C3)cc2)c1 66953745 XOHOUKXDRMDHHD-UHFFFAOYSA-N 375.453 5.002 30 20 GKED C=CCN(Cc1nnc(-c2c(-c3ccccc3)noc2C)o1)CC1CCCCC1 70015907 NCUKADCPQZXVPQ-UHFFFAOYSA-N 392.503 5.268 30 20 GKED N#CCCn1cc(C(=O)CSc2nc3ccc(Cl)cc3o2)c2ccccc21 104527877 BRSOWZNKWWTBJC-UHFFFAOYSA-N 395.871 5.325 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1ccc(Cl)c(C#N)c1 105411483 JRDICOSIPBHVPT-UHFFFAOYSA-N 388.279 5.549 30 20 GKED CCOCCC1(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCCC1 134971392 BSKZZWHHCFLFPZ-KRWDZBQOSA-N 389.565 5.047 30 20 GKED CCCn1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 151021743 CLXHWSMJSCSWLL-UHFFFAOYSA-N 388.471 5.135 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1cccs1 160412127 ZUPJMKXWQLMHOP-CQSZACIVSA-N 384.526 5.408 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ccc(SC(=O)N(C)C)cc1 176881070 LAYDVEVKLSEUJC-HNNXBMFYSA-N 385.558 5.467 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1coc(-c2ccc(C(F)(F)F)cc2)n1 182550505 JKMLDTYQVMGCMK-ZDUSSCGKSA-N 387.361 5.263 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1nnc(-c2ccsc2)o1 189904755 NMMVAVMUWUWKMN-UHFFFAOYSA-N 381.501 5.221 30 20 GKED C[C@@H]1CCSCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 192090182 UCSBQOXTYIKECQ-BEFAXECRSA-N 399.947 5.355 30 20 GKED N#CCC[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccccc1 301785596 LLBWBLVWZUIFMA-FQEVSTJZSA-N 390.874 5.444 30 20 GKED C[C@H]1Sc2ccc(C(O)=Nc3ccccc3N3C[C@H]4CC[C@H]3C4)cc2N=C1O 329839302 JEBMFVHLKSCILI-YCPHGPKFSA-N 393.512 5.394 30 20 GKED O=C(Nc1cccc(N=C(O)C2CCCCC2)c1)c1ccnn1C1CCCC1 330086501 SFDXGCFIYKNRSI-UHFFFAOYSA-N 380.492 5.419 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)sc1SCC#N 409817904 IKHVVHGMXMTPMT-VXGBXAGGSA-N 398.340 5.116 30 20 GKED CC(C)(C(=O)Nc1ccc(CC#N)cc1Cl)c1cccc(C(F)(F)F)c1 411014751 LIIKIKCNAYZDLS-UHFFFAOYSA-N 380.797 5.341 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)CCC(=O)c1cc(Cl)sc1Cl 425129709 MKVSOMSDUIDFBS-NSHDSACASA-N 395.311 5.109 30 20 GKED CCCn1ccc2ccc(NC(=O)c3cnn(CCC#N)c3-c3ccccc3)cc21 428629435 VHJXQBGZRZTMOI-UHFFFAOYSA-N 397.482 5.081 30 20 GKED N#C[C@@H](C(=O)c1cnc2c(F)cccc2c1)c1nc2cc(Cl)ccc2s1 429684900 NRHXBXVPQBFJAN-ZDUSSCGKSA-N 381.819 5.127 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(SCC#N)c3)n2)cc1 432217090 DKTSAJPTCCSDHD-GOSISDBHSA-N 389.505 5.224 30 20 GKED Cc1cc2nc(/C=C/c3cn(CCC#N)nc3-c3ccncc3)sc2cc1C 432711375 UDUVABFHXVQFKW-SNAWJCMRSA-N 385.496 5.256 30 20 GKED N#CCCC[C@H](NCc1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 433018413 GZVISDAVIGLYCB-DEOSSOPVSA-N 383.495 5.464 30 20 GKED C=CCC[C@H](NC(=O)CCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1 435296277 RPDSYSAFAWFPHB-FQEVSTJZSA-N 393.462 5.022 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1Cc1ccccc1 437596190 VPWMLSMSLMPTHA-ZCYQVOJMSA-N 395.506 5.581 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 439396689 ZCASCJIJUUDJSO-HSZRJFAPSA-N 396.450 5.517 30 20 GKED CN(C(=O)CSc1ccccc1C#N)[C@@H](c1ccccc1)c1ccc(F)cc1 439704593 KPZJDMIPOUCPLA-QHCPKHFHSA-N 390.483 5.037 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)CCCC1(C)C 445239865 SMONNEOUXUZVES-NRFANRHFSA-N 397.563 5.266 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4coc5ccccc45)no3)cc2)nc1 445577943 ZEJCTXJPGSDZCF-UHFFFAOYSA-N 380.363 5.209 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCSc1ccccn1 445920675 WQTCRCCYJAKLRB-UHFFFAOYSA-N 389.480 5.175 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)Nc2ccccc2SCCC#N)c1 447464274 VNYVFTCAIVQWSK-KRWDZBQOSA-N 382.529 5.613 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2ccc(-c3ccco3)cc2F)cc1 448009071 ASVRCTGYQNDJBK-UHFFFAOYSA-N 377.419 5.209 30 20 GKED N#CC1(CSc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)CCC1 450872996 CKJMXILQTNYCIK-UHFFFAOYSA-N 384.892 5.026 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N1CCCC[C@H]1c1ccc(Cl)cc1 453447390 AXSAIMYLILNLPH-OALUTQOASA-N 386.927 5.091 30 20 GKED CCN(C(=O)Nc1cccc(CC#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 455909342 BCFOHRZXZSSBDO-CQSZACIVSA-N 375.394 5.386 30 20 GKED C=C(C)Cn1c(COc2ccc(C)cc2)nnc1N1CCC[C@@H]1c1ccsc1 460390720 WTVVZWBDEVOCLU-HXUWFJFHSA-N 394.544 5.145 30 20 GKED C[C@H](Sc1cccc(C#N)c1)c1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 468628027 PDCSEDDUDPCASZ-NEPJUHHUSA-N 381.526 5.247 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(C(C)(C)C#N)cc1 474780226 NPBTXEHNXLVPQG-UHFFFAOYSA-N 393.874 5.611 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl)c1c[nH]c2ccccc12 486429069 UQTVEWYJKNJNLA-SGTLLEGYSA-N 386.282 5.349 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccccc1 487176406 MIXODASJECHIOZ-SCTDSRPQSA-N 387.310 5.648 30 20 GKED CC(C)C[C@@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 487376841 LJPMWWKFYKRBOB-GHTZIAJQSA-N 395.572 5.396 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 487622847 ZNCIZQHXZIAKGN-AVRDEDQJSA-N 376.500 5.180 30 20 GKED N#C[C@H](NC(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1 499813047 OIWONTBTIPXCBU-KRWDZBQOSA-N 381.690 5.351 30 20 GKED C=CCCc1ccccc1NC(=O)NCCc1coc(-c2ccc(C)cc2)n1 505010697 KOSYJXVJALRRES-UHFFFAOYSA-N 375.472 5.133 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1cccc(C(F)(F)F)c1 505948266 OCMAZIPOWJNDCX-MRXNPFEDSA-N 388.320 5.099 30 20 GKED Oc1nc([C@H](F)c2ccc(C(F)(F)F)cc2)nc2cc(C(F)(F)F)ccc12 509073922 FDOKJEXWAXHQAE-CYBMUJFWSA-N 390.258 5.432 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1cccc(Cl)c1Sc1nc(C)cs1 509215590 NGSWAMOQHPDCQH-LBPRGKRZSA-N 382.938 5.176 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC(C)(C)CCC#N)C1 513130440 UPKLYAXQMXAQEA-PBHICJAKSA-N 381.442 5.128 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CC[C@H]3CCCCO3)cc2Cl)cc1 517654485 UAAPLVSNOUKUGE-QGZVFWFLSA-N 384.863 5.292 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)n2)cc1 519939145 LDELMCNGDGPNEJ-IAGOWNOFSA-N 379.872 5.077 30 20 GKED CN(C)Cc1cccc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 522336702 NNNNNCGOOCLODO-UHFFFAOYSA-N 386.455 5.056 30 20 GKED C=CCN(C(=O)[C@@H]1CSc2ccccc21)c1nc(-c2ccccc2)cs1 524025456 KCHWHWAQAWAGPC-QGZVFWFLSA-N 378.522 5.219 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)N[C@@H](CC(F)(F)F)c1ccccc1 524440342 ILRWFDPUJOMRME-AWEZNQCLSA-N 394.290 5.660 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 524718775 JDKPULLJBPXZNM-UHFFFAOYSA-N 377.271 5.550 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@H](Cc4ccccc4)C3)c2)cc1 525033312 GKCAPKJPMYOTLE-OAQYLSRUSA-N 382.463 5.055 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1ccc(C#N)cc1OC(F)F 534476463 SZEAUTIQIUDGMV-CYBMUJFWSA-N 379.476 5.241 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cc(Cl)cc4cccnc34)CC2)cc1 535062792 XVKREBGVTGCOTO-UHFFFAOYSA-N 388.858 5.081 30 20 GKED C=C[C@@H](CC(=O)N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccccc1 535366612 ZAUNEEVPVGMPSI-UQBPGWFLSA-N 395.506 5.139 30 20 GKED CSc1cc(C(=O)Nc2cc(C#N)ccc2NC2CC2)c(Cl)cc1Cl 535833367 PUGSXXFIPNSCQW-UHFFFAOYSA-N 392.311 5.414 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 536840576 RLRPNDBWMXBLQW-DYESRHJHSA-N 375.541 5.738 30 20 GKED C[C@@H](NCc1cc(-c2cccs2)on1)c1ccc(-c2cccc(C#N)c2)cc1 542945578 UHVUVEUHRHYHLN-MRXNPFEDSA-N 385.492 5.793 30 20 GKED N#CC1(c2ccccc2)CCC(NCC[C@H](c2ccccc2)C(F)(F)F)CC1 550856682 MADMFWXKHWVJLW-ATKRNPRHSA-N 386.461 5.716 30 20 GKED CC(=O)N(c1nc(COc2cc(F)cc(C#N)c2)cs1)c1ccc(C)cc1C 554684074 UCHCBPXTLMSYDB-UHFFFAOYSA-N 395.459 5.034 30 20 GKED N#Cc1c(NC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)sc2c1-c1ccccc1CC2 564313945 OFFJVMOQXFONNI-STQMWFEESA-N 390.430 5.302 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC(CCC#N)CC2)c(C(F)(F)F)c1 566188992 FCGRAKWAZCSVFM-UHFFFAOYSA-N 383.414 5.040 30 20 GKED CC[C@@H](N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1)c1ccc(C#N)cc1 570514375 FQBZKIYNTOLRFV-GAJHUEQPSA-N 384.483 5.007 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1nccc2ccccc12 572066315 MSMYHXJANPLMFD-GOSISDBHSA-N 375.497 5.538 30 20 GKED CSC[C@@](C)(C#N)NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 572109613 VAKYVTSXBHCJCO-CQSZACIVSA-N 393.748 5.237 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2cccc(C(F)(F)F)n2)no1 583406419 FXRWSORGFBDSEW-LBPRGKRZSA-N 391.246 5.228 30 20 GKED N#CCCCCCC(=O)N1CCC(COc2cc(Cl)cc(Cl)c2)CC1 588159381 SOQPYIRPRFJWHH-UHFFFAOYSA-N 383.319 5.085 30 20 GKED CCSc1cccc(-c2noc([C@@H]3CCCN3c3ccc(C#N)cc3)n2)c1 589952189 QLAIYDOFRCIAKV-IBGZPJMESA-N 376.485 5.062 30 20 GKED C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccc(Oc2ccccc2)c(F)c1 595456081 VPTXPUIXXHYFFM-DLBZAZTESA-N 381.451 5.014 30 20 GKED CCCN(C(=O)CC1(C#N)CCOCC1)[C@@H](C)c1ccc(Cl)c(Cl)c1 597280099 XNDFECALKYNCTK-AWEZNQCLSA-N 383.319 5.003 30 20 GKED N#Cc1c(NC(=O)c2sc3cccc(Cl)c3c2Cl)sc2c1CCC2 603484044 ZZJJNNCFFIWZLR-UHFFFAOYSA-N 393.320 5.882 30 20 GKED C[C@H](Oc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cn1)c1ccccc1 603737964 YBNXXKMNOJCYPA-KRWDZBQOSA-N 385.467 5.275 30 20 GKED Fc1ccc(-c2nc(CN3CCC(C(F)(F)F)(C(F)(F)F)C3)cs2)cc1 605000889 WPZIJZIVJQTRMM-UHFFFAOYSA-N 398.347 5.266 30 20 GKED Cc1csc([C@@H](NC(=O)Nc2cccc(C#Cc3cccs3)c2)C2CC2)n1 608273024 BVKODSXRROAMQQ-IBGZPJMESA-N 393.537 5.186 30 20 GKED Cc1ccc2c(Cl)c(C(=O)Nc3cc(C#N)ccc3OC(F)F)sc2c1 609149677 JGHHJMXCJUQRFU-UHFFFAOYSA-N 392.814 5.589 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccc(Cl)cc1 609377274 TVUPPPXCMKXJSJ-HNNXBMFYSA-N 388.920 5.389 30 20 GKED N#CCn1c(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc2ccccc21 609381367 FPUVIOWRVAIBBG-QFIPXVFZSA-N 382.467 5.014 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609398314 UKLBGDYRJDRIGQ-KRWDZBQOSA-N 397.544 5.391 30 20 GKED COCCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)C1CCCC1 609722838 AQUCXXZDIINEKT-UHFFFAOYSA-N 398.890 5.035 30 20 GKED CCCCSCCC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 610048127 IKEXBQNQUYEOFN-UHFFFAOYSA-N 386.492 5.138 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccccc1Oc1ccccc1)c1cccc(C#N)c1 610343742 RFUHXWVHKUBLRR-ZWKOTPCHSA-N 385.467 5.028 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(Oc2ccccc2Cl)cc1 610466269 NDMUKFNAUKVNEG-UHFFFAOYSA-N 380.831 5.281 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccncc1 610723109 PYOPLIDSHITLHM-ZDUSSCGKSA-N 393.434 5.238 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(C[S@@](=O)c3ccccc3)c2)cc1 619669073 DPFWOJQZBYPMFM-MUUNZHRXSA-N 388.536 5.408 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(N)c1C)c1ccc(C(F)(F)F)cc1 625915959 FPDOACSATZSVKU-SFHVURJKSA-N 377.410 5.425 30 20 GKED Cc1ncc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)s1 647323494 QWVWTGAONZOKDI-QMMMGPOBSA-N 386.336 5.914 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)NCC1CCC(C(F)(F)F)CC1 657707667 ZXLGOCDQMBQCIL-UHFFFAOYSA-N 387.330 5.998 30 20 GKED Cc1c(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)ccc(F)c1F 667253621 IJAIGQUNDSMESU-UHFFFAOYSA-N 392.290 5.448 30 20 GKED FC(F)(F)C1CCC(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 681007564 QFRFBBJWOZCDMY-NGEZQELSSA-N 399.341 5.854 30 20 GKED C#Cc1cccc(NC(=S)N2CCc3sccc3[C@@H]2c2cccs2)c1 726449294 NWZWHTBHYLKRSX-LJQANCHMSA-N 380.563 5.135 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(COc3cccc(F)c3)c2)c1 726458994 FACKACKCJLZMKL-UHFFFAOYSA-N 376.456 5.195 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C2CCCCC2)n1 726754083 ZYZYSAOEKIKRSK-QFIPXVFZSA-N 398.510 5.376 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)NCc1ccc(C#N)cc1 728123165 CDIBLEAIBDBHMI-GOSISDBHSA-N 385.467 5.328 30 20 GKED Cc1cc(C(=O)Nc2ccc(O)c3ccccc23)c(C)n1-c1ccc(C#N)cc1 728306145 IYOCEWNHFSIQEB-UHFFFAOYSA-N 381.435 5.077 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1nc(-c2ccccc2)cs1 730085091 MZWIWOCHKSQZRL-VOTSOKGWSA-N 380.519 5.891 30 20 GKED C/C(=C/C(=O)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 731970842 HBCYIPJJAOEVMO-SEACUGGUSA-N 397.334 5.255 30 20 GKED C/C(=C\C(=O)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 731970844 HBCYIPJJAOEVMO-UCKUCIOWSA-N 397.334 5.255 30 20 GKED CCN(Cc1cccc(Br)c1)Cc1cc(Cl)ccc1OCC#N 735309864 MELKRBQKMZDRPV-UHFFFAOYSA-N 393.712 5.027 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3CSc4ccccc43)n2)cc1 735769219 HMRJAHVVHSUSQK-IRXDYDNUSA-N 376.506 5.184 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCOc3cccc4ccccc34)[nH]c12 735792847 OIYSTGXWCWBBPK-IBGZPJMESA-N 383.451 5.060 30 20 GKED C[C@@H](NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1ccc(C#N)cc1 740778306 QFIHGLGHDJAMQQ-CYBMUJFWSA-N 399.878 5.050 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)NCc2cccs2)cc1F 743034941 FDWGQJOEIFRGKG-UHFFFAOYSA-N 383.473 5.038 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(COc2ccccc2)c1)c1ccccc1 748570813 WXWGBFHOXYTXJV-QHCPKHFHSA-N 385.467 5.432 30 20 GKED C=CCC[C@H](NCc1ccc(-n2ccnc2)nc1)c1ccc(C(F)(F)F)cc1 749840140 MDQBPFFSTDTWKY-IBGZPJMESA-N 386.421 5.083 30 20 GKED Cc1nc(NN=C2CCC3(CCOCC3)CC2)c2c3c(sc2n1)CCCC3 751521122 JIOAFEYHTDQZNT-UHFFFAOYSA-N 384.549 5.017 30 20 GKED Cc1c(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)oc2c(F)cccc12 752377061 ZHGXVARAKQMLQR-UHFFFAOYSA-N 377.400 5.128 30 20 GKED CS[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(C)(C)C 752485175 MBSZOVNVPAHDAR-UXHICEINSA-N 381.545 5.241 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(NC(=O)OC(C)(C)C)ccc2C)c1 753908568 YNUOFTHEVGBBEM-UHFFFAOYSA-N 381.501 5.132 30 20 GKED Clc1cc(Cl)c(NN=Cc2cnc([C@@H]3CCCO3)s2)c(Cl)c1 755465626 LVUMRDQCKZHCEE-LBPRGKRZSA-N 376.696 5.401 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\SCc3ccco3)n2)cc1 759833590 JEYJANDSVQTKQL-PXAMLJHWSA-N 380.494 5.335 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\SCc3ccco3)n2)cc1 759833607 JEYJANDSVQTKQL-SECOEOQKSA-N 380.494 5.335 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccc(F)cc2)c2nccn2C)cc1 764815520 QULJSVVKUSRGFT-HRAATJIYSA-N 399.897 5.131 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)C1 766619254 SMZVZAZDDRYOSN-HLAWJBBLSA-N 378.516 5.567 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)c2ccccc21 767949415 PLQFSMTYYHHXRJ-OAQYLSRUSA-N 399.494 5.121 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(C(F)F)ccc2Cl)c1 769006995 ACUPIHOQZTZQQW-AWEZNQCLSA-N 393.821 5.280 30 20 GKED O=C1/C(=C\c2cccc(OCc3ccccc3Cl)c2)CCc2nc(O)ccc21 769610924 TWGGFBPZYFFMEP-VBKFSLOCSA-N 391.854 5.232 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 776837961 BFZJZQVNQKLCDX-UHFFFAOYSA-N 376.481 5.713 30 20 GKED CC[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 784821073 KWDNJIOFLKPICA-DZGCQCFKSA-N 385.533 5.058 30 20 GKED Cc1cc(OCCCC(=O)[C@@H](C#N)c2nccc3ccccc23)ccc1Cl 792103094 KJHOTKDDUGQKPP-LJQANCHMSA-N 378.859 5.232 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCCc2ncc(-c3ccccc3)o2)s1 797570139 DGJNSYJSRREDQQ-INIZCTEOSA-N 393.512 5.295 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 797613066 BFXNUPPJIALIDH-UNMCSNQZSA-N 375.516 5.632 30 20 GKED N#C[C@@H](C(=O)CCCC1CCOCC1)c1nc2cc(C(F)(F)F)ccc2s1 798815888 CBYLVCNOSCYGOV-AWEZNQCLSA-N 396.434 5.088 30 20 GKED C=CCCc1ccccc1NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c1ccccc1 800156652 UFXKMXCFOBMCEK-FQEVSTJZSA-N 394.515 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CC(c2ccc(C)cc2)=NO1 800566265 UZNZMBARTJVYTN-FQEVSTJZSA-N 391.515 5.162 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 806200731 LWFJUCSCGKPYDH-UQBPGWFLSA-N 395.506 6.100 30 20 GKED CCN(Cc1ccccc1NC(=O)CC1(C#N)CCCCC1)C(=O)OC(C)(C)C 822476091 UVFLUCGFDUGFDT-UHFFFAOYSA-N 399.535 5.246 30 20 GKED Cc1cn(C2CCCCC2)nc1NC(=O)C1(c2ccc(C#N)cc2)CCCC1 860748570 YWXOJVQHHYZXCT-UHFFFAOYSA-N 376.504 5.019 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccc(Cl)cc3)CC2)cc1 915088439 RPXYAQCUIYTLOW-QFIPXVFZSA-N 386.882 5.666 30 20 GKED Cc1ccc(Cl)c(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915088695 VEVHFZMHGFPXFJ-HXUWFJFHSA-N 390.870 5.321 30 20 GKED C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915293388 KORGXPFOUDLRAY-CJAUYULYSA-N 396.490 5.237 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1N=Cc1cc2ccccc2nc1O 915982196 ROKUGSIABCPGGD-UHFFFAOYSA-N 381.435 5.252 30 20 GKED N#CCCn1cc(C=NN(Cc2ccccc2)c2ccccc2)c2ccccc21 916250049 UNDOXSQZORGVSJ-UHFFFAOYSA-N 378.479 5.596 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Br)cc1 1776033139 DDUMIIAFSNTZOI-UHFFFAOYSA-N 381.657 5.027 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3ccc(F)cc3F)cc2)c1 1776125884 VRPGGTYWPLFFMK-WDZFZDKYSA-N 378.374 5.155 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776339947 SGWRGKRHWDQZMZ-FLIBITNWSA-N 390.435 5.445 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](C(=O)O)C2CCCCCC2)c1 1776788716 QVPRNNVAGAOSFJ-QHCPKHFHSA-N 389.580 5.797 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C1/C[C@@H](C(=O)O)c2ccccc2C1=O 1777260628 NGTGDLHFRIRAKM-DUBROFONSA-N 384.431 5.200 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ccc(/C=C\C(=O)O)cc1 1777488366 WNAYYDAJYDCNGP-FAEGWCMCSA-N 393.439 5.252 30 20 GKED N#Cc1cccc(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)c1 26366276 MRYMANHNEVALAF-UHFFFAOYSA-N 388.279 5.165 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1nc2ccccc2o1 41546210 LSAGHOOIUABOJQ-ZDUSSCGKSA-N 389.238 5.170 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccc(OC)c(F)c1 45103599 JKOIIOCCVQOYKE-GFCCVEGCSA-N 382.888 5.008 30 20 GKED COc1ccc(S[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 51534831 NOUUWEHUZRPFLV-RDTXWAMCSA-N 394.521 5.176 30 20 GKED C=CCn1c(SCc2noc(CCC)n2)nnc1-c1ccc(C(C)(C)C)cc1 63416290 KKIJZSIIYOOVMB-UHFFFAOYSA-N 397.548 5.056 30 20 GKED CC(C)Oc1ccccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 66953830 NTEROGVSHQLPIT-MRXNPFEDSA-N 383.517 5.190 30 20 GKED C[C@H](Nc1ccc(Cl)c(C#N)n1)c1cccc(NC(=O)c2ccccc2)c1 67351133 VTLQNKNLLUDVCC-AWEZNQCLSA-N 376.847 5.032 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1c(F)cccc1F 108242023 WZDRZTXCUQEFJU-UHFFFAOYSA-N 386.345 5.242 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1COc1ccccc1 113570175 LEYUBLOHVBDLRF-MSOLQXFVSA-N 395.528 5.014 30 20 GKED C=CCOc1ccc(C(=O)N(CC)[C@@H](C)c2cc3ccccc3o2)cc1OC 115740847 DEXMIYNZBKPQHW-INIZCTEOSA-N 379.456 5.230 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2)c1 127458354 ZRDATGWRCOOSGW-CYFREDJKSA-N 383.495 5.206 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 159280388 QCFWIPJMJMAZSS-LPHOPBHVSA-N 382.533 5.338 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 165802749 RYNCWVDDJCUGHZ-DDKJEQMHSA-N 379.872 5.138 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1 175550133 SDYZUXOAJZOIEO-UHFFFAOYSA-N 390.464 5.355 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(Cl)cc1C(F)(F)F 185610482 DVAKUPDWEXMUPK-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(O)c(OC)c1)C1CC1 191514413 OPNVQEXYWUUMBZ-UHFFFAOYSA-N 394.515 5.449 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C 246605416 XUOKBWVWEIIHFE-ZHALLVOQSA-N 379.529 5.491 30 20 GKED N#Cc1cccc(OCCCCC(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)c1 303493175 QEGDFWCPORQNBY-QFIPXVFZSA-N 382.891 5.028 30 20 GKED CC(C)(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1 329207951 YNGDPWYTHXQURF-YZGWKJHDSA-N 391.577 5.594 30 20 GKED Cc1cc(C)c(N=C(O)N2CCC[C@@H](c3n[nH]c(C4CCCCC4)n3)C2)c(C)c1 329430854 IHPAJWKZVRGUFI-LJQANCHMSA-N 395.551 5.203 30 20 GKED C[C@@H](CC(F)F)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 412276447 YUIQMRWWESTLKZ-GZMMTYOYSA-N 377.275 5.106 30 20 GKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1csc(-c2ccccc2F)n1 417366790 NQWVHFHWKROCEM-VLIAUNLRSA-N 377.488 5.549 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@@H](CC#N)c1ccccc1 425082498 GCJRIBVNNFRHKB-QFBILLFUSA-N 399.416 5.034 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1 425423011 NNFYFBSBRABFJJ-KGLIPLIRSA-N 375.394 5.041 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2N2CCc3ccccc32)c1 429845642 BILRCQVTRLAQBD-UHFFFAOYSA-N 385.492 5.249 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CO[C@@H]1CCCc2ccccc21 430547074 DTDGDCCTFAPHJA-OXQOHEQNSA-N 380.513 5.114 30 20 GKED N#CCC1(CNC(=O)c2oc3ccccc3c2CSc2cccs2)CC1 431141543 WJUFDLJNGSHDTK-UHFFFAOYSA-N 382.510 5.210 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(Oc2ccccn2)c1)c1ccccc1 432996950 IXQHBDYQAINQCI-OAQYLSRUSA-N 386.455 5.431 30 20 GKED CCCOc1cc(C)ccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 437807399 SBHPBQWOZBGJMJ-TZIWHRDSSA-N 377.488 5.088 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 439506119 ZPSQSUFFLGNFKE-WSTZPKSXSA-N 393.556 5.738 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)c1ccc(C#N)cc1 439571225 KXTLQRHPYMFEJG-HNNXBMFYSA-N 375.859 5.637 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)NCC3CCC(C#N)CC3)s2)cc1 441027547 UXUIEGYNCMJOCD-AOCRQIFASA-N 396.560 5.117 30 20 GKED C=CCC[C@@H](NC(=O)CSCc1cccnc1)c1ccc(C(F)(F)F)cc1 441547627 QNAMNDFYXZNKDU-GOSISDBHSA-N 394.462 5.157 30 20 GKED C[C@H](Sc1nnc(-c2ccccc2Br)o1)c1cccc(C#N)c1 442898968 DPYLLOBFZXIPOB-NSHDSACASA-N 386.274 5.224 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCCC34CCC4)cc2Cl)c1 444900558 JXZLWFBYKUPSLZ-UHFFFAOYSA-N 395.890 5.341 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 455010558 ZLIMNMYGFNWBPM-IBGZPJMESA-N 393.878 5.156 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 464711844 PLXWTROITMUWPD-LJQANCHMSA-N 396.874 5.333 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471243405 MQAFQHJOFXTYRO-SNVBAGLBSA-N 376.268 5.768 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 471904702 GKOSKHIWSAKUAD-QWHCGFSZSA-N 393.339 6.130 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 476123234 UHKLUASAFUYDBC-UHFFFAOYSA-N 392.377 5.718 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)s1 481860155 GPNBGBDTSPDPHA-QGZVFWFLSA-N 381.888 5.075 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1cccc2c1CN(c1ccccn1)C2 482003791 VOIWBXMMDIBIGJ-QHCPKHFHSA-N 380.495 5.353 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2c(F)cccc2F)c1)c1cnc2ccccc2n1 483220867 PUVPPVAKJHSDFH-INIZCTEOSA-N 385.373 5.065 30 20 GKED CC(C)(C)C[C@@H](O)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 485707484 FOAHALUQJCOFDF-PKOBYXMFSA-N 384.907 5.121 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Cl)cc1Br 486421552 XJZPPTNZCSPDEH-UHFFFAOYSA-N 382.710 5.633 30 20 GKED N#CCCCOc1cccc(NC(=O)c2csc(-c3cccc(Cl)c3)n2)c1 488483045 PCQIEEHZKPDDML-UHFFFAOYSA-N 397.887 5.398 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2oc3c(C)cc(Br)cc3c2C)n1 494867915 IEGLUKFTUCNFJD-ZDUSSCGKSA-N 389.274 5.067 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnn(C(C)C)c3C3CC3)n2)cc1 498693610 BCIOOTYWVDTSFE-QGZVFWFLSA-N 390.512 5.263 30 20 GKED N#C[C@H](NC(=O)CCCCC(=O)c1ccccc1)c1c(Cl)cccc1Cl 499832707 JUNJHIZHGDJSRT-KRWDZBQOSA-N 389.282 5.118 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCC(=O)c2cccc(F)c2)cc1 502789238 KRUIGVVTRIRALD-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C=CCOc1ccc(CN[C@@H]2CCCc3cn(C4CCCC4)nc32)cc1Cl 505986041 FSPRQTNUBKMUQM-HXUWFJFHSA-N 385.939 5.384 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(C)c1 517168948 PISBDUCNIKGYTB-SFHVURJKSA-N 385.467 5.407 30 20 GKED C=CCn1c(SCCn2nc(C)cc2C)nnc1-c1ccc(C(C)(C)C)cc1 519560651 OEOAWICMUAVZDK-UHFFFAOYSA-N 395.576 5.034 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 520178751 XTAHNPOKGJWOJY-CYBMUJFWSA-N 391.393 5.201 30 20 GKED CCCN(CC)Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520929401 YUNLXKVHPSXCMO-GOSISDBHSA-N 395.572 5.565 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@H](C)c1ccccc1F 521324636 CEVZGDAKFMZCGB-CYBMUJFWSA-N 394.259 5.046 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(-c4cccnc4)s3)cc2)cc1 535588935 MFCZBZVTRWAQQF-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(C#N)c(F)c1 537401322 XTSOYICBFWUPDD-GOSISDBHSA-N 396.469 5.401 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)c2c1 539172779 LZLXZERNLHCLAS-UHFFFAOYSA-N 379.485 5.035 30 20 GKED C[C@H](NC(=O)c1c(F)c(F)cc(F)c1F)c1ccc(-c2cccc(C#N)c2)cc1 542000140 CTDAAHNZFFHWRS-LBPRGKRZSA-N 398.359 5.273 30 20 GKED CCc1ccccc1NC(=O)CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542015501 XCGFFHVVEPCXBG-SFHVURJKSA-N 383.495 5.077 30 20 GKED N#CCCCOc1cccc(CNC2(c3ccc(Cl)c(Cl)c3)CC2)c1 545958360 RYGXVFJXNCPMSD-UHFFFAOYSA-N 375.299 5.455 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)Nc3ccc(C#N)cc3OC)oc2c1 546004540 DYZYPBIKJPDLLF-UHFFFAOYSA-N 398.418 5.241 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc(Cl)ccc2O)cc1 551084255 UOVHAPVSEKBLHH-UHFFFAOYSA-N 394.883 5.462 30 20 GKED Cc1nn(C(C)C)cc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 565154725 BAURVMJLSJQWFE-UHFFFAOYSA-N 396.438 5.049 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ccc(C#N)c([N+](=O)[O-])c3)s2)cc1 570982007 IQSUQGWBZSNTJG-LBPRGKRZSA-N 394.456 5.080 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)COc1cccc2ccccc12 576936994 UFMPIJARSYABQX-MJGOQNOKSA-N 392.524 5.086 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)c1 579386662 ZZIBHRWEXTVYSD-UHFFFAOYSA-N 390.695 5.084 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)cc1 581157673 MBBWIOALASXMIL-UHFFFAOYSA-N 376.847 5.263 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3cc4c(s3)SCC(=O)N4)cs2)cc1 588450280 UQAKQROAMGVGEU-SREVYHEPSA-N 398.534 5.120 30 20 GKED Cc1cccc2sc(C(=O)N[C@@H](CCCC#N)c3ccccc3)c(Cl)c12 590477899 CUYRTKHGOAYHIR-INIZCTEOSA-N 382.916 6.028 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1c(F)ccc3ccncc13)c2C#N 598840736 ZDGICWBINPEJOZ-NEPJUHHUSA-N 379.460 5.245 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 603652454 BZBBJVMTLVEWJS-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)c2ncccc12 604499870 SPIKAXNWVKHXJS-UHFFFAOYSA-N 392.890 5.450 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c[nH]nc3-c3ccc(F)cc3)c2)cc1 609202708 SCDQZCAXJWBBRU-UHFFFAOYSA-N 398.397 5.132 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609499737 YUFADPLRRSFMSM-JOCHJYFZSA-N 385.467 5.359 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCSC[C@@H]1c1ccccc1 609682425 JNBWBPGIJKCAGX-VQIMIIECSA-N 397.569 5.403 30 20 GKED CCc1cccc(CC)c1S(=O)(=O)Nc1ccccc1S[C@H](C)CC#N 609873229 OSCBWZRBLNZQDS-OAHLLOKOSA-N 388.558 5.006 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccccc3Cl)nc2)c(Cl)c1 610896559 QQDKRFLQMUCNDH-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cccc2sc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c(Cl)c12 613292707 PUQZYNPHVGMTJZ-CQSZACIVSA-N 376.868 5.901 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)(F)F)nc3)n2)cc1 613314209 BPLGTZGQQYRXPA-CQSZACIVSA-N 387.386 5.022 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H]3CCCc4sccc43)cn2)c1 613460851 IKIJQFDPWDWMSS-GOSISDBHSA-N 390.468 5.006 30 20 GKED CCN(CC)C(=O)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1Cl 614055456 VIFXMKVPILBWFY-UHFFFAOYSA-N 383.923 5.235 30 20 GKED CC(C)(C#N)CC[S@@](=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 616183054 VBXRXHSNHBNYIV-RUZDIDTESA-N 386.464 5.017 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N[C@@H]3CCc4cc(C#N)ccc43)ccc2C)c1 618758724 KVVSDQHFGPUDLZ-OAQYLSRUSA-N 398.466 5.171 30 20 GKED Fc1ccc(F)c2c1CC[C@@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 677129543 MPRVFKMVZOKKQR-KSQLKPTDSA-N 387.314 5.451 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(Cl)sc2Cl)c(Cl)c1OC 730433267 DYHXIVTZLFSUIE-HYXAFXHYSA-N 377.676 5.622 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1SC(F)(F)F 730988881 DJJLIGQEBPURNW-GFCCVEGCSA-N 396.459 5.803 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732596007 GTXMVTHJAUMHHY-KBXCAEBGSA-N 380.900 5.519 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C\c3c(O)cccc3OC)s2)cc1 733750059 KUMUPEADZKUJLD-IKTNTUJMSA-N 382.485 5.021 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@H]2c2ccccc2)c1 733851945 NQZDXMSNPHPVNY-GGAORHGYSA-N 391.515 5.194 30 20 GKED COc1ccc(CNCc2ccccc2COc2ccccc2Cl)cc1C#N 742374271 UOEHFXSBZPQTSZ-UHFFFAOYSA-N 392.886 5.089 30 20 GKED Cc1nc(-c2cccnc2)nc(NCc2cccc(-c3ccc(C#N)s3)c2)c1C 742409152 URRAXSSKAAYDOI-UHFFFAOYSA-N 397.507 5.368 30 20 GKED C=CCN(CC(F)(F)F)C(=O)Nc1cc2oc3ccccc3c2cc1OC 746509573 MTCZKSIBJASDBT-UHFFFAOYSA-N 378.350 5.177 30 20 GKED Cc1nc(NC(=O)N[C@@H](CCC#N)c2ccccc2)sc1-c1ccccc1 747825356 CTRUOVSLJSHQQD-SFHVURJKSA-N 376.485 5.285 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)CCCc2csc3ccccc23)c1 755320454 OBKZTMYHSPPAMD-IBGZPJMESA-N 392.524 5.221 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C(C)=C\c1ccccc1Cl 756507586 DYJBWGYGYRBNTO-ZDRDQBANSA-N 394.902 5.216 30 20 GKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Br)cc(Cl)c1O 756855963 HYZCZUVKXXOXSI-NSHDSACASA-N 391.696 5.020 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CN(Cc2ccc(C#N)cc2)C2CC2)c1 760819974 MTKFERWJZMUMDW-UHFFFAOYSA-N 377.488 5.070 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)s1 762442377 KBTCGVUKQPZPOZ-QHHAFSJGSA-N 384.800 5.337 30 20 GKED N#CCCN(C(=O)/C=C/c1nc2ccccc2s1)C12CC3CC(CC(C3)C1)C2 763178284 XUFGGHSSHGPIOK-VOTSOKGWSA-N 391.540 5.021 30 20 GKED Cc1csc(SCc2c(C(=O)N[C@H](C#N)CC(C)C)oc3ccccc23)n1 768143050 KXFYWCYLKANSIQ-AWEZNQCLSA-N 399.541 5.158 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc3c(c2)CCCC3)ccc1OC 772979764 MECMJBBKKVUNSZ-JTSKRJEESA-N 378.516 5.106 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccccc2Cl)cc1 780167272 ZKWZMTGPSXJTED-OAHLLOKOSA-N 392.842 5.675 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc([N+](=O)[O-])cc1Cl 782187548 CHXCEJKJBDHCHA-DHZHZOJOSA-N 394.814 5.118 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 782383446 PBDZWYCVBFPNOU-HXUWFJFHSA-N 394.522 5.426 30 20 GKED C=C[C@@](C)(CCOC)COC(=O)c1sc(-c2ccccc2)nc1C(F)F 784633042 FJIPYZZEBCTCNJ-IBGZPJMESA-N 381.444 5.133 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1ccsc1Cl 790151044 WKUYGDUMCSPMHR-UHFFFAOYSA-N 389.720 5.138 30 20 GKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1nc(Br)ccc1F 794969894 KXTOCVZKLOXLCC-SOFGYWHQSA-N 389.249 5.003 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2nc(Cl)c(C#N)s2)nc1-c1ccccc1 804512160 NDXYQWXLDJANGK-AWEZNQCLSA-N 398.919 5.788 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(C2CCCCCCC2)no1 818398150 VZOFPLXZAOCKCZ-INIZCTEOSA-N 376.501 5.157 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)O[C@H]1CC[C@@](C)(C#N)CC1 836157016 SYTBQWCUAHJMDI-GLRZTSSQSA-N 392.377 5.298 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1)c1ccccc1 838604677 UYCPVESDNDWYEH-SFTDATJTSA-N 383.442 5.246 30 20 GKED CC1CCC(c2noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)CC1 848604052 AMFKHBFTEMXDLJ-UYSNPLJNSA-N 376.501 5.013 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(C)[C@H](C)c2cccc(Cl)c2)cc1OC 914490263 HRJRZOFFWLZWTF-YBHKSSGVSA-N 385.891 5.146 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C2CC2)cc1 915350349 UFTKGNLZVRDLTA-LOSJGSFVSA-N 395.506 5.923 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1C 916905884 QEVNWNYAAWEJLC-FQEVSTJZSA-N 384.435 5.057 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cccc(Cl)c2)cc1 916948524 HOTHFNFOMQYDKS-FOIQADDNSA-N 382.891 5.134 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(SC(C)C)cc2)cc1 916949808 PVTQAFSSOVNUMF-IIBYNOLFSA-N 394.540 5.662 30 20 GKED CCn1cc(C(=O)/C=C\c2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cn1 920992013 YCNLZKPQYGAVII-CLFYSBASSA-N 397.818 5.153 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2)cc1 921010433 JGQSGQZUDYQFHR-UHFFFAOYSA-N 393.786 5.164 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccccc1Oc1ccc(F)c(Cl)c1 1776031235 UVFDYNPSCZFFDQ-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)o2)cc1 1776125262 BMZMGYPRPWXBJC-QOHRORDFSA-N 384.472 5.778 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cccc(CC(=O)O)c2)cc1 1776125901 WAVJZHUTXJURCK-DQXUBXGMSA-N 394.511 5.805 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2ccc(C)cc2C(=O)O)cc1 1776787480 CAEIDMRGRUBZPP-UHFFFAOYSA-N 385.529 6.008 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2cccc(C)c2C)cc1 1776787992 JZBGROFNRRQJDA-DEOSSOPVSA-N 397.559 5.958 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)o2)cc1 1777472298 LQTDAGUPRAOTLL-GQJHWZHGSA-N 388.419 5.161 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4ccc(F)cc4C3=O)s2)c1 1777684376 YKMGYBUIPQYBMV-PTNGSMBKSA-N 378.424 5.465 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3sc(C)c(C)c3C#N)c3ccccc3n2)o1 6279031 WQYRUVFIFRCORU-UHFFFAOYSA-N 387.464 5.606 30 20 GKED C=CCOc1ccc(/C=C(\Cl)c2nnc(C(=O)Nc3ccccc3)s2)cc1 22608362 GWQCNVCPGIHLPV-LGMDPLHJSA-N 397.887 5.092 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)ccc1OCC#N 23987118 VBTUGXMTUXPEKG-NTUHNPAUSA-N 399.446 5.073 30 20 GKED CC(C)(C)NC(=O)c1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 46605023 FTPYUEQGDKHHLA-UHFFFAOYSA-N 397.478 5.006 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)s1)c1nc(-c2ccccc2)cs1 51533734 KJJUITUTAMUIMH-LLVKDONJSA-N 389.299 5.124 30 20 GKED COc1ccc(S[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66800283 SUTNIMKPKGPVBZ-CABCVRRESA-N 386.542 5.209 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)no1 66953442 ANBZJUCZGISYEL-OAQYLSRUSA-N 388.427 5.016 30 20 GKED N#CC1(NC(=O)c2cccc(CSc3cc(Cl)ccc3Cl)c2)CCC1 72056350 DCQCMGLRVJYKHM-UHFFFAOYSA-N 391.323 5.462 30 20 GKED CCn1c(SCc2ccc(-c3ccccc3C#N)cc2)nnc1-c1cccnc1 122896527 KGTBVCQHQLOEKL-UHFFFAOYSA-N 397.507 5.191 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCC[C@@H]1c1cccc2ccccc12 135250890 UUONXUIXNWOMCN-OAQYLSRUSA-N 389.430 5.250 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C 135953683 LVPFRWFCRXTMJB-CYBMUJFWSA-N 394.972 5.120 30 20 GKED O=C1/C(=C\c2nccn2CC(F)(F)F)CCc2c(Cl)sc(Cl)c21 157295221 GZPKQDKSHCVADH-ALCCZGGFSA-N 381.206 5.026 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)c(F)c1 176012960 QRDIUKISSBTSJI-GOSISDBHSA-N 388.826 5.071 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2F)n1)c1ccc(C#N)c(Cl)c1 179526002 NEBIXOYDJILTLS-UHFFFAOYSA-N 385.851 5.141 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2ccc(Cl)s2)n1)Cc1cccs1 180100028 KJFFOMNWNQLHMA-SNVBAGLBSA-N 394.930 5.126 30 20 GKED CCN(C(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C)c1ccc(C#N)cc1 181568898 JPWZUMCVIJKLFN-UHFFFAOYSA-N 399.372 5.207 30 20 GKED CCOc1ccc([C@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccccc2)cc1 181599739 MAKAPJFGSKICOF-UQBPGWFLSA-N 386.495 5.428 30 20 GKED CCC[C@@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 181774585 FUPNLJBQCNFFLT-PKOBYXMFSA-N 381.545 5.008 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2-c2nc(C(C)(C)C)no2)n1 183380349 ULXNRWUVJCHIPN-HNNXBMFYSA-N 394.500 5.104 30 20 GKED Cc1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 183498454 WVBBICZYPOOEAP-LBPRGKRZSA-N 392.267 5.212 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2cccs2)cs1)c1ccc(F)cc1F 206338488 MSOFLTOCZSGQLK-ALCCZGGFSA-N 390.436 5.064 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cc(F)ccc1F 303859658 MGDAPWNPEVVQNH-GUYCJALGSA-N 389.471 5.489 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c2[C@H](C)C1 411024017 YZGIMSCUTLKAEC-NWDGAFQWSA-N 394.525 5.076 30 20 GKED C[C@@H](SCc1nc(C#N)cs1)c1nc(-c2cccc(C(F)(F)F)c2)no1 419446865 WAOHHXKNEBIOEJ-SECBINFHSA-N 396.419 5.078 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2c(F)cccc2F)C2CCCC2)c1 430703320 JTKCFCFEZYTBRZ-UHFFFAOYSA-N 386.467 5.165 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1cccc(COC2CCCCC2)c1 433308220 XNCZODNFUVCGLA-OAQYLSRUSA-N 376.500 5.247 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1)c1ccccc1 434279980 KOTQGEDGOJYGGJ-JOCHJYFZSA-N 394.490 5.138 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(Cl)cc1Cl 438845970 GPURGGUVPHQUGU-UGSOOPFHSA-N 376.287 5.399 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@@H](CCC#N)c3ccccc3)o2)c(C)c1 439653554 JZZAWOWGNMQKEZ-NRFANRHFSA-N 388.467 5.250 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)CC1 441003313 XERONMAODXOUJH-JFIBYHEFSA-N 387.936 5.120 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1c(F)cccc1F 446249716 SQIIABGFWVOXBM-CYBMUJFWSA-N 397.265 5.407 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@@H](C)c1cccc(OC)c1 468761187 AQZOMLNZKSPQJW-SFHVURJKSA-N 389.499 5.177 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc2c(cnn2CC(C)C)c1 476141725 IPFLKHLCAMLSEU-UHFFFAOYSA-N 376.504 5.192 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Br)cn1 479413439 JZWBZAPTQLSFCB-HNNXBMFYSA-N 392.300 5.234 30 20 GKED Cc1cc(Br)cc(NC(=O)Nc2cccc(OCCCC#N)c2)c1 486383707 XOOJQEPZBRZGFW-UHFFFAOYSA-N 388.265 5.084 30 20 GKED Cc1oc(-c2ccccc2)nc1CSc1nc(C(F)(F)F)ccc1C#N 488763691 JURFEIYMOYUANT-UHFFFAOYSA-N 375.375 5.228 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 495109736 GVAPAGFXZQMIKY-UHFFFAOYSA-N 395.462 5.298 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC 505024719 VTBNICNJVYSUPR-NRFANRHFSA-N 380.488 5.191 30 20 GKED Cc1ccc(-c2nn(Cc3ccccc3)cc2CN2CCC(C)(C#N)CC2)cc1 507708054 LUQVVZRPNNTJBP-UHFFFAOYSA-N 384.527 5.033 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1C 513955389 BOKMLDBEDKZLQS-UHFFFAOYSA-N 387.458 5.549 30 20 GKED CC(C)OCc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 515539960 HCWDUDMHGVQRFI-MRXNPFEDSA-N 384.888 5.365 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)Cc1csc(-c2ccccc2Cl)n1 515592167 JWHIQKHLKDEVGZ-UHFFFAOYSA-N 398.919 5.073 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 518175951 LPCNUUBAMWAJRE-IBGZPJMESA-N 392.549 5.862 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2cccs2)n1 519434230 SREPUAGASPZTPX-LBPRGKRZSA-N 385.539 5.376 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 520096885 RNURDISPTPSYPT-UHFFFAOYSA-N 390.527 5.076 30 20 GKED CN(Cc1ccc(C#N)cc1F)[C@H]1CCSc2ccc(Br)cc21 521334597 UIJDWNFODUWWKQ-KRWDZBQOSA-N 391.309 5.129 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc4c5c(cccc35)CC4)cc2)nc1 521954929 JFKVQOMFMTUPOC-UHFFFAOYSA-N 391.430 5.250 30 20 GKED CC(C)COc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 522570150 GALLRJREHCFHTI-UHFFFAOYSA-N 390.439 5.017 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccccc1Cl)C(C)C 523781309 CQEBIFBINDPTMX-OAQYLSRUSA-N 381.907 5.307 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3[C@H]4CC[C@H]3c3ccccc34)c2)c1 527021685 LNSOXWWCZSIVHC-ZEQRLZLVSA-N 380.447 5.169 30 20 GKED C=CCN(C(=O)c1ccc(CN(CC)CCC)cc1)c1nc2c(s1)CCCC2 531017036 KVDIDEUOOUISTB-UHFFFAOYSA-N 397.588 5.087 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 533876287 MSCOGQXEXSJPEK-IBGZPJMESA-N 394.302 5.026 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(OC)c(Cl)c3)o2)cc1 534244978 XUGPYIZYBRFLMJ-UHFFFAOYSA-N 388.876 5.256 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc([C@@H]2CCCOC2)c1 535037292 SIIKEQOYLPJTJH-VQIMIIECSA-N 380.513 5.227 30 20 GKED C[C@H](N[C@H]1CCc2c(Cl)cc(Br)cc21)c1ccc(C#N)cc1 535509382 XLYWGONBPHHNBY-VOJFVSQTSA-N 375.697 5.312 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](CCC#N)c3ccccc3)s2)cc1 536835484 ZGRAPVWKIWWYIS-DYESRHJHSA-N 375.541 6.123 30 20 GKED COCc1c(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)oc2ccccc12 536887322 UGGQTBVPYVWTJC-UHFFFAOYSA-N 396.446 5.048 30 20 GKED C=CCCOCCCCC(=O)N1CCc2ccccc2[C@H](c2ccccc2)[C@@H]1C 538281568 MKZQUCWELBPJFB-LVXARBLLSA-N 391.555 5.355 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1)C1CC1 540082866 TXEQSDIHXFORFU-UHFFFAOYSA-N 394.862 5.258 30 20 GKED C[C@H](NCc1cnc(-c2ccccn2)s1)c1ccc(-c2cccc(C#N)c2)cc1 542019814 NPWUCYBBTIOMNF-KRWDZBQOSA-N 396.519 5.595 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1)[C@@H](C)c1ccc(C#N)cc1 546018404 PTGTZHGICFEQMI-ROUUACIJSA-N 386.495 5.433 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 555341739 NFFXYDCXTXBAIB-UHFFFAOYSA-N 399.237 5.008 30 20 GKED CCN(Cc1ccccc1C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 565921032 CIBLCIIILLOEAH-UHFFFAOYSA-N 386.455 5.108 30 20 GKED N#Cc1cc(C(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)cnc1C(F)(F)F 578032547 FYCLDPOQVGWCMA-OEIFXAAASA-N 399.416 5.070 30 20 GKED Cc1csc(NC(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)c1C#N 578575720 DWMYCNGNYJXARU-UHFFFAOYSA-N 392.358 5.339 30 20 GKED CCN(C(=O)CCCCCC#N)[C@H]1CCSc2ccc(Br)cc21 588753665 BLLADOLGUAZDEQ-INIZCTEOSA-N 395.366 5.309 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(Cl)c2ncccc12)c1ccccc1 590104794 YXAIXWYDCBIGFG-SFHVURJKSA-N 378.863 5.445 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3nc4ccccc4n3C)sc2c1 591019463 RJOMCZIAWZSREI-ZDUSSCGKSA-N 379.872 5.240 30 20 GKED CCCCn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nnc1[C@@H](CC)N(C)C 594884559 ZYDYRQXRTSGFBU-SJORKVTESA-N 391.972 5.101 30 20 GKED CSc1ccc(Cl)c(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1 596983565 FSEWRCLJWWDZPJ-VQIMIIECSA-N 385.920 5.366 30 20 GKED N#CC1(CC(=O)N(c2ccc(F)c(Cl)c2)c2nccs2)CCCCC1 598825999 ISBNEUSQFCJOTC-UHFFFAOYSA-N 377.872 5.464 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)[C@H](C)Oc3ccccc3C#N)n2)c(C)c1 603557689 WFRNYNAHDCEHCE-INIZCTEOSA-N 391.496 5.013 30 20 GKED Cc1[nH]c2ccc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)cc2c1C 603627098 QOXYACOHBWPOSL-UHFFFAOYSA-N 382.423 5.096 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)N(Cc1ccco1)c1ccccc1C#N 603755082 OOZIIWNWLZBKMU-QGZVFWFLSA-N 376.481 5.006 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1nc2ccsc2s1 606782725 DYAIHMDONOURAI-UHFFFAOYSA-N 384.404 5.194 30 20 GKED Cc1cc2occ(CC(=O)Nc3ncccc3OCCCC#N)c2cc1C(C)C 608868646 CPTVKISYEVIXLM-UHFFFAOYSA-N 391.471 5.123 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCc1cccc(Cl)c1Cl 608918026 BCDXTZQCMURVOX-UHFFFAOYSA-N 390.314 5.028 30 20 GKED N#CCn1c(C(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc2ccccc21 609165012 MKKZALREKRMZIY-IBGZPJMESA-N 398.293 5.449 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1ccccc1 609435508 SRWJKSHFOUIHPI-OXJNMPFZSA-N 379.529 5.696 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N[C@H](CC2CC2)c2ccccc2)o1 610236471 XPHHQFUXUVVCBM-OAQYLSRUSA-N 386.451 5.001 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cnc(-c2ccc(C(F)(F)F)cc2)s1 610901102 VLRMDBDOIQBUEB-UHFFFAOYSA-N 387.386 5.261 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)c(Cl)c1 611093296 VZQASVGZBJAMQS-UHFFFAOYSA-N 379.246 5.689 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 611480493 PSBFCVPJOYKORE-JOCHJYFZSA-N 391.490 5.706 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Cc1sc(C)nc1-c1cccs1 615971872 TWXMFAXHWJKVTE-UHFFFAOYSA-N 386.517 5.076 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1csc(-c2ccccc2)n1 672829645 QGRKDFLYGYIIHV-UHFFFAOYSA-N 395.532 5.198 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)sc2ccc(F)cc12 674471052 AXCTXYPRRZOZMQ-PHIMTYICSA-N 399.331 5.162 30 20 GKED C[C@H]1CCCC[C@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 728175612 YGASBXOBOXOBIA-MGPUTAFESA-N 397.519 5.141 30 20 GKED C#Cc1ccc(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)nc1 728802279 OUZLOBWOKXDRGT-UHFFFAOYSA-N 390.851 5.212 30 20 GKED COCCOc1ccc(/C=C/C(=O)c2sc(-c3ccccc3)nc2C)cc1 730464996 RNMHFOLVBCBDCO-JLHYYAGUSA-N 379.481 5.040 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccccc3Cl)cc2)c1 731318440 MMNAGKYMPGAXQQ-UHFFFAOYSA-N 379.872 5.813 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)c(C#N)c2n1CCC2 731937149 GNTSHILXKKMMDD-NTMALXAHSA-N 399.475 5.380 30 20 GKED Cc1ccc(NC(=O)/C=C/c2ccccc2C#N)c(-c2nc3ccccc3[nH]2)c1 731979237 MROLECOEJCTVMP-ACCUITESSA-N 378.435 5.062 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cc(C(F)(F)F)ccc2F)S1 733204984 GJXXXQCHLZFKCT-OQLLNIDSSA-N 394.393 5.353 30 20 GKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 733208650 AOIUNCIYFPZJFM-GOSISDBHSA-N 392.355 5.891 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 733322493 JHUYOZYDNQRQEL-QGZVFWFLSA-N 376.525 5.371 30 20 GKED C=CC[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc(C)cc1)c1ccncc1 734510159 RTMCJQHITMQJOU-VWLOTQADSA-N 394.522 5.650 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)cc1 741540822 ZJUBCUJOQLTVEY-CEMLEFRQSA-N 388.417 5.362 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C\c1cnc(C(C)(C)C)s1 742486722 XRRGPSQZDLWOHB-CLFYSBASSA-N 380.966 5.384 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Nc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1 743127381 IDJQTXJAVPGHPD-HNNXBMFYSA-N 394.475 5.096 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 743447400 OKRCIBUIPCQUAC-LSSBLYJVSA-N 376.456 5.537 30 20 GKED CCCCCC[C@@](C)(CC)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 744038665 YSIIKYRNEAGRJM-QVKFZJNVSA-N 375.463 5.994 30 20 GKED COc1ccc(C=NNc2cccc3ccccc23)cc1OCc1cccnc1 747060045 GAUAPEWSARWXHN-UHFFFAOYSA-N 383.451 5.268 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2ccc(C)cc2)cc1 751015990 ZSQLDDNOQDDYPN-UHFFFAOYSA-N 389.480 5.477 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 759218008 OZUJLYQTOZBBFR-MDNBWPLSSA-N 378.884 5.743 30 20 GKED N#C[C@@H](C(=O)C1CCC(F)(F)CC1)c1nc2cc(C(F)(F)F)ccc2s1 759223467 UZNFNNALZJTVDH-NSHDSACASA-N 388.361 5.317 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C1CC1 760350432 KIRZHWMQRUXRJI-JTSKRJEESA-N 398.510 5.639 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 761668566 OXCHVPHIPBOMQZ-LJQANCHMSA-N 387.842 5.044 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(OCC)c(OC)c2)cc1 764912609 IVCBREBEDNKUSG-INIZCTEOSA-N 375.896 5.076 30 20 GKED C=CC[C@H](N[C@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)c1ccncc1 766019207 KQFZQAMUKQYLPR-OALUTQOASA-N 395.959 6.143 30 20 GKED O=C(CCCC(F)(F)F)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 770751508 XIFWSASETHXRLU-NSHDSACASA-N 382.222 5.585 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCCn1ccc2cc(Cl)ccc21 780155682 AEEJYPGDVILZFY-OAHLLOKOSA-N 381.863 5.004 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCCc1ccc(-c2ccccc2)cc1 780668690 XPAYIEZRWOBUNZ-SFHVURJKSA-N 385.467 5.009 30 20 GKED CN(CCC(C#N)(c1ccccc1)c1ccccc1)Cc1ccc(Cl)nc1 788483149 RWNJWPUNLUCRIZ-UHFFFAOYSA-N 375.903 5.067 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@H](CC#N)c1ccccc1 793770918 DPXOBLVEPPMHIY-OFNKIYASSA-N 398.506 5.570 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(-c3cccc4cccnc34)cc2)cc1 795789989 NGHFVLWEZORMDX-UHFFFAOYSA-N 391.474 5.771 30 20 GKED C#CC[C@H](Cc1ccccc1)NC(=O)c1ccccc1SCc1cccs1 804456767 IQCMEFSDYSGNKT-LJQANCHMSA-N 391.561 5.405 30 20 GKED N#C[C@H](C(=O)[C@@H](Oc1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813213394 ITARJBVCRRWXGR-RXVVDRJESA-N 396.368 5.097 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)C1 821470516 VVBFMSUIECGWJU-SJORKVTESA-N 387.524 5.092 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)CC2(C#N)CCCCC2)cc1 829175935 PNKWIOYMVCJHHO-MRXNPFEDSA-N 385.508 5.075 30 20 GKED N#C[C@@H](C(=O)CCCSc1ccc(Cl)cc1)c1nc(C2CC2)cs1 842936896 AXGTUVNTCKESII-HNNXBMFYSA-N 376.934 5.423 30 20 GKED CC1CCC(c2noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)CC1 848604043 AMFKHBFTEMXDLJ-GPANFISMSA-N 376.501 5.013 30 20 GKED O=C(O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)c1ocnc1C(F)F 860770182 UMTATXYFDAYFIG-JTQLQIEISA-N 389.198 5.091 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc(C(C)(C)NC(=O)OC(C)(C)C)no1 904763562 BWXYOZWZNKIHOH-KRWDZBQOSA-N 385.508 5.318 30 20 GKED CC(=NNc1nnc(-c2ccccc2)n1C)c1cc2c(ccc3ccccc32)o1 915968296 GKNGVCTXEJZDHK-UHFFFAOYSA-N 381.439 5.218 30 20 GKED COc1cc(C=NOCc2ccc(Cl)c3cccnc23)ccc1OC(C)C 917395357 IVVOFFMJMPUOOF-UHFFFAOYSA-N 384.863 5.235 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccc(F)cc2)cc1 918488201 XAPBBQFBZFCVFI-IIBYNOLFSA-N 380.463 5.009 30 20 GKED Cc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3C(=O)O)c2)c(C)c1 1776132726 CWXQLQGGHYYQPI-ACCUITESSA-N 386.447 5.477 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2cnc(-c3ccc(C(C)C)cc3)s2)C1 1776155387 ZLAOHWNPBPOLMC-JOCHJYFZSA-N 384.545 5.176 30 20 GKED CC(C)Oc1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776361070 QXHKNBRLQIUANO-WDZFZDKYSA-N 376.408 5.328 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)c(OCCC)c(OC)c1 1776782857 GTZABYGVLWOVQP-QGZVFWFLSA-N 399.959 5.431 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(F)ccc1N(C)C[C@H](C)CC 1776782908 LUHIJZOSUBCWJD-NQIIRXRSSA-N 394.575 5.601 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(SC(F)(F)F)c1 1776783672 BLZUAMVZVQGNNG-HNNXBMFYSA-N 377.472 5.592 30 20 GKED CCOc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(C)c1 1776925994 TVPULXDPPOIBQJ-LUAWRHEFSA-N 376.408 5.248 30 20 GKED CCSc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776950916 NURVYWBBTIWHPZ-CLFYSBASSA-N 386.469 5.747 30 20 GKED Cc1cccc2c1OC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1777459772 PFCFUMJNBSRIDQ-LFIBNONCSA-N 376.433 5.080 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(Cl)cc(Cl)c3)n2)cc1 60477291 YGZOTRKDEHMPTD-MRXNPFEDSA-N 387.291 5.915 30 20 GKED CSc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66954147 SAJPBCURWRCYQM-GJZGRUSLSA-N 385.558 5.685 30 20 GKED C[C@@H](c1cc(F)ccc1F)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66956083 CUDJUAVBOMDAKZ-KGLIPLIRSA-N 389.471 5.584 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2SC(F)F)c1 78875680 NVTNSVXORBDSBN-UHFFFAOYSA-N 376.428 5.061 30 20 GKED Cc1csc([C@@H](C#N)C(=O)Cc2cccc(OCc3cccc(Cl)c3)c2)n1 106982360 SCGJMVCGYKMIBY-IBGZPJMESA-N 396.899 5.103 30 20 GKED Cc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 108242218 BCJDUZIEEJDRKR-UHFFFAOYSA-N 384.448 5.262 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCc1cccc(C#N)c1)C1CC1 121500032 KMYLXXVKMQIQTK-CQSZACIVSA-N 387.405 5.012 30 20 GKED CCO[C@H](C)c1nc(CSc2nc(C)cc(C(F)(F)F)c2C#N)cs1 133363190 HZMUTMSMEFPULI-SNVBAGLBSA-N 387.452 5.127 30 20 GKED Cc1csc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)n1 174494596 NMCQNOBMLLUNDL-CYBMUJFWSA-N 396.447 5.137 30 20 GKED Cc1nc(CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)oc1-c1ccccc1 177774248 WRVPVZGJJFRBDA-MRXNPFEDSA-N 379.485 5.039 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc(N)c2c(C)c(C)sc2n1)c1ccc(F)c(F)c1 187795504 DEMJWYRDWJDZJW-APPDUMDISA-N 388.487 5.137 30 20 GKED CC(C)c1ccccc1-n1c(S[C@H](C)CCC#N)nnc1-c1cccnc1 188221030 UNJMVNFXBDHWCJ-MRXNPFEDSA-N 377.517 5.237 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(CNCc2cccc(OCCCC#N)c2)cc1 237350130 DOGSBWHWMGAHAE-OAQYLSRUSA-N 391.559 5.033 30 20 GKED COc1cc(C=NO[C@H](C)c2ncc(-c3ccccc3)o2)ccc1OC(F)F 255755714 NNQMKVLPJOJBTC-CYBMUJFWSA-N 388.370 5.063 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(F)cc2)=C(\S)NC2(C)CC2)cc1 284423102 OIGQZCXADFJEOE-UHFFFAOYSA-O 399.555 5.098 30 20 GKED O/C(=N/C1(c2noc(C3CCCC3)n2)CCCCCC1)c1ncoc1C1CC1 329009740 ZGVIRGYDIUSAKD-UHFFFAOYSA-N 384.480 5.147 30 20 GKED Cc1c(Cl)cccc1N=C(O)[C@H](C)N[C@@H]1c2ccccc2CC12CCOCC2 329778793 LKHOUVAFNGPHPS-HRAATJIYSA-N 398.934 5.309 30 20 GKED Cc1nc2c(cnn2C(C)C)cc1/C(O)=N/[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 329897685 DBJBLURVASAUNC-VQIMIIECSA-N 380.467 5.101 30 20 GKED O=S1(=O)CC[C@@H](/N=C(/O)C2(C3CCCCC3)CCCCC2)c2ccccc21 329925709 VPPOHQHKXOVTRD-LJQANCHMSA-N 389.561 5.392 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@@H](C)/N=C(/O)Nc1c(F)cc(Cl)c(C)c1F 330953771 SAZAPVHABFZKAH-SNVBAGLBSA-N 384.858 5.274 30 20 GKED CC(C)(C#N)CCOc1cccc(OCCC(C)(C)C#N)c1-c1ccccc1 419097410 PPUREZLFUAEZLG-UHFFFAOYSA-N 376.500 5.991 30 20 GKED C=CCN(C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 429438153 RWTRRFRMSDPVTO-UHFFFAOYSA-N 380.467 5.381 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2COCc2ccccc2)c1 430042701 CAUBJLUINOVYED-UHFFFAOYSA-N 388.492 5.271 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)N1CCc2ccc(C#N)cc21 436156234 UKIWYJDRGSNLCO-UHFFFAOYSA-N 398.249 5.031 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 438050198 CXPDEYSOAUVWTP-QFUCXCTJSA-N 384.545 5.002 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438842463 PSTFZRGETUWEFX-KUHUBIRLSA-N 390.314 5.741 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 457777932 DDKKTNOIDQYRKQ-MRVPVSSYSA-N 395.265 5.271 30 20 GKED C=C(C)COc1cc(CNC[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)ccc1OC 464049310 KNFAEHGWMKLGES-WIOPSUGQSA-N 395.543 5.216 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 466394935 GEBMJSPUPOYRNJ-OAHLLOKOSA-N 385.335 5.039 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CC[C@H](Cc4ccccc4)C3)ccc21 468970890 LJHZVBFXQJGICD-IRLDBZIGSA-N 387.527 5.093 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 472672571 SGIZQSIWVYTMCJ-UHFFFAOYSA-N 399.494 6.074 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 475548006 LCMSTYJCEHEFPL-IBGZPJMESA-N 380.507 5.774 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCO[C@@H]1c1ccc(C)cc1 475571532 GFZLCNLPOVHFLR-ISKFKSNPSA-N 392.543 5.889 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cncc(Cl)c1Cl 480866098 PYGVLZYOJUZBDL-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1cnc2ccccc2n1 483231699 FPQQAAJOOSOULC-LJQANCHMSA-N 399.837 5.566 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@H](C)c1ccc(SCCOC)cc1 483707933 XOYQVROZSUWHLU-GOSISDBHSA-N 390.593 5.264 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)C1 489905013 ALJCKZJKZQJQHO-UHFFFAOYSA-N 394.540 5.308 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1sc2cc(Cl)ccc2c1Cl 490174340 NNXBSRBKGFIGQM-UHFFFAOYSA-N 390.295 5.159 30 20 GKED N#Cc1ccc(CN[C@H](CC2CC2)c2cc(F)cc(Br)c2)s1 495163910 LHPKQISSNWKCAI-QGZVFWFLSA-N 379.298 5.152 30 20 GKED C=CCC[C@H](NC(=O)C[C@@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 496015630 WIYZXUHIGMYPFU-ACJLOTCBSA-N 393.453 5.363 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)F)c(F)c1)c1nc(-c2ccccc2)cs1 496198031 QYCATIHDOVVLAT-CYBMUJFWSA-N 388.370 5.041 30 20 GKED C[C@@H](N(Cc1ccccc1)C(=O)c1cnc(C(F)(F)F)c(C#N)c1)C(C)(C)C 500588980 YQTPHUYRNDJVRR-CQSZACIVSA-N 389.421 5.049 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1cccc(C(F)(F)F)c1 505981993 ORYOWBVMJKNJHN-HXUWFJFHSA-N 397.400 5.014 30 20 GKED CCN(C(=O)c1cccc(C#N)c1C)[C@@H](c1ccc(Cl)cc1)c1ccccn1 509431416 UHJQYSNPKDECBS-QFIPXVFZSA-N 389.886 5.167 30 20 GKED CC(C)Oc1ccccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513483798 LKJCUBMLSDTBHK-UHFFFAOYSA-N 386.451 5.177 30 20 GKED COc1ccccc1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 514544264 FTWKQFFZTFQQKH-FQEVSTJZSA-N 390.870 5.185 30 20 GKED CC(C)[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(C(C)(C)C)cc1 515154695 PKKCLJKPUGCCDM-QFIPXVFZSA-N 388.515 5.393 30 20 GKED Cc1cc(CN(C(=O)c2cccc(CC#N)c2)C2CCCC2)c2ccccc2n1 517678405 BLLDMWJABVKPFR-UHFFFAOYSA-N 383.495 5.194 30 20 GKED COCC[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(Cl)c(Cl)c1 520207480 VCJOBKYYYFDYFK-SFHVURJKSA-N 383.706 5.386 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)o1 521797234 MMOUIQNUWQREBL-CQSZACIVSA-N 380.444 5.732 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)C[C@@H]3CCOc4ccccc43)c2)c1 522739712 LYYJLRCMDPIREC-FQEVSTJZSA-N 398.462 5.032 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)C1CCC(F)(F)CC1 536246420 VWEVRFNSCHLLIZ-UHFFFAOYSA-N 388.845 5.570 30 20 GKED COc1ccc2c(c1)[C@H](N(Cc1ccccc1)CC(C)(C)CCC#N)CCO2 536661087 XNWJJKVZQPOFPJ-JOCHJYFZSA-N 378.516 5.351 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 538775676 ZPPHJSYWJVZRRX-XLIONFOSSA-N 397.400 5.099 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c1 538982643 QIVZVRHATIEWRT-IBGZPJMESA-N 398.487 5.852 30 20 GKED CC(C)Sc1ccc([C@H](C)NC2CCN(Cc3ccc(C#N)cc3)CC2)cc1 539494309 DQVBCTLOGNNQRB-IBGZPJMESA-N 393.600 5.374 30 20 GKED COc1cccc(Oc2ccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)c1 539629709 BXOCPKRATOFEOE-UHFFFAOYSA-N 384.435 5.295 30 20 GKED C=CCCC[C@H](C)NC(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 540540454 VTSISRXBYNRLMR-UWJYYQICSA-N 398.934 5.062 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)NCCCC#N)c2)cc1 541518764 AOTBNRCTYJGIGZ-GOSISDBHSA-N 379.504 5.147 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccn(Cc4ccccc4)c3)n2)cc1 542881720 VIRNGTBIBMFVGD-OAQYLSRUSA-N 397.503 5.458 30 20 GKED Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)c3ccc(C#N)cn3)sc2c1 548795886 QZVGGJXGMSFIQK-UHFFFAOYSA-N 398.491 5.027 30 20 GKED N#Cc1ccc(N2CCC(NC(c3cccs3)c3cccs3)CC2)cc1 552275256 PLEYOIVUXRZHIZ-UHFFFAOYSA-N 379.554 5.029 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3ccc(Oc4ccccc4)c(C#N)c3)ccc12 569617382 CTHIZGUBXIUGMG-UHFFFAOYSA-N 395.418 5.165 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)NC[C@H](C)C#N)c2)cc1 570000585 UNJGKVZIGJDOCL-QZTJIDSGSA-N 379.504 5.003 30 20 GKED C[C@@H](Oc1ccccc1NCc1ccc(C#N)cc1OC(F)F)C(F)(F)F 577678610 BDACVMWINKVMOZ-LLVKDONJSA-N 386.320 5.101 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 582211196 ANBZKWYAKDWVRD-HNNXBMFYSA-N 390.418 5.110 30 20 GKED N#CCC[C@@H](NCc1cc(OC(F)F)ccc1Br)c1ccccc1 592365933 LBLOHWDHNNUSOA-QGZVFWFLSA-N 395.247 5.185 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCc2c(CC#N)cccc2C1 599792992 XLCOJRMFEPKRBK-UHFFFAOYSA-N 375.516 5.419 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)Cc2ccc(C#N)nc2)c(C(F)(F)F)c1 602249057 JBZVCBDHZAFYKR-GFCCVEGCSA-N 393.434 5.044 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 603996788 VLXCBEFENPIXLX-UHFFFAOYSA-N 395.528 5.126 30 20 GKED CN(C(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(C#N)cc1F 609217234 AMZRTOMJVCEBQH-UHFFFAOYSA-N 379.243 5.495 30 20 GKED CC(C)c1ccccc1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 609552331 NUQOPEMQXSWMLR-UHFFFAOYSA-N 377.488 5.193 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@@H]1CCCC(F)(F)C1 622284063 MWDIJVUPZZWAFP-MRVPVSSYSA-N 375.259 5.488 30 20 GKED C[C@H]1C[C@H](Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c2nccn21 647323529 WDXPQXPVKKGTOG-CABZTGNLSA-N 381.295 5.290 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1sccc1Br 726425710 CNRGWOBLAYRWAZ-UHFFFAOYSA-N 388.212 5.237 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1 728440630 ZSXBNCVEOBOREO-YFHOEESVSA-N 399.493 5.011 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)nc1 728865914 UOQKJVGOMURMTL-HNNXBMFYSA-N 375.859 5.142 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 731136686 UZSXAAXCPCCAJH-PBHICJAKSA-N 380.900 5.636 30 20 GKED CC(=O)c1ccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 731317568 HZXZQBZWOVCDTC-UHFFFAOYSA-N 387.464 5.362 30 20 GKED Cc1cccc(-c2nnc([C@@H](C)Sc3nc(-c4ccccc4)ccc3C#N)o2)c1 733902457 FQYMJJOCKHFUEE-MRXNPFEDSA-N 398.491 5.832 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccs1 734706613 OAPPCGWPNFZTCZ-CQSZACIVSA-N 386.929 5.679 30 20 GKED CCCCCCCCCCC(=O)N1Cc2ccccc2C[C@H]1c1nnc(C)o1 737619613 YEFWNEXCVFMTFP-NRFANRHFSA-N 383.536 5.535 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(OC3CCC3)cc2)cc1 744033104 MVXVKDRDBCRVMF-AOMKIAJQSA-N 390.483 5.093 30 20 GKED O=C(Cc1ccccc1F)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746435983 BPFLYWKXYQJQMA-HNNXBMFYSA-N 380.259 5.234 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)COc1cccc(C#N)c1 748194379 FJMGCJSIJOVZIH-UHFFFAOYSA-N 380.513 5.309 30 20 GKED C=CCCCC(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 748224418 AIUUEQJZDLQJLN-UHFFFAOYSA-N 385.074 5.138 30 20 GKED Cc1cc(NC(=O)Nc2ccccc2O[C@H](C)C#N)cc(C)c1Br 755501913 VLPOIZQXBUJZHX-CYBMUJFWSA-N 388.265 5.001 30 20 GKED C[C@@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1c(Cl)cccc1Cl 764300541 AAZBMXOIOQPCDJ-MRVPVSSYSA-N 398.633 5.169 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](Cn2cccn2)c2ccccc2)cc1 766135971 GLMJENRSTFVONR-XMSQKQJNSA-N 381.907 5.107 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ncccc2C(F)(F)F)cc1 770645185 QEHSLNIIPCEOCM-QGZVFWFLSA-N 381.357 5.008 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)C[C@H](CC)c2ccccc2)c1 773295948 YXIPJAWREBXTGD-RBBKRZOGSA-N 393.531 5.093 30 20 GKED C[C@@H](N[C@H](C)c1cccc(OCc2ccccc2)c1)c1ccc(OCC#N)cc1 774381289 AZBYAVAXFGTRKX-WOJBJXKFSA-N 386.495 5.580 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccccc1O[C@@H](C)C#N 780667045 FQKBRNZKFABGSQ-AZUAARDMSA-N 379.504 5.161 30 20 GKED O=C1/C(=C\c2ccc3cnccc3c2)CCOc2c(Br)cccc21 782329116 YECNIMNUIDWZCC-PTNGSMBKSA-N 380.241 5.046 30 20 GKED CCN(C(=S)Nc1cccc(OC(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 783731723 XYEITHSECOOLOC-ZDUSSCGKSA-N 393.434 5.237 30 20 GKED CC[C@@H](NC(=O)[C@@H](C#N)C(=O)c1sc2ccccc2c1Cl)c1ccccc1 787034157 ZOFYNBZPHBNDMH-JKSUJKDBSA-N 396.899 5.145 30 20 GKED CCCCCCCCS(=O)(=O)[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1 790143610 OPQNBLPCJYWMGZ-OAHLLOKOSA-N 382.501 5.020 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)cc1 792924687 OIHOKASNJXGLEW-VAWYXSNFSA-N 396.899 5.061 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(Br)cn1 794470262 GWNUSAJUSIEFKW-UHFFFAOYSA-N 394.487 5.035 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)C[C@@H](CC#N)c1ccccc1 795980142 BUAIWEYOWZILML-UYAOXDASSA-N 392.499 5.076 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1 808297547 RKUCFNMROUVDCE-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1csc(C(=O)O[C@H](c2ccc(C(F)(F)F)cc2)C(F)(F)F)c1 809125883 BNPHBVZJSOUWHJ-GFCCVEGCSA-N 379.281 5.099 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)c2c1 811613102 UUTYCSGXJGGXLU-UHFFFAOYSA-N 399.406 5.061 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(C3CCCCC3)C2=O)c(C(F)(F)F)c1 811624588 JWJITPFNIHZOQY-OQLLNIDSSA-N 396.459 5.111 30 20 GKED C=CCC(F)(F)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 839280642 YGMJBDHEWVWJDX-UHFFFAOYSA-N 394.340 5.202 30 20 GKED CC(=NO[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1cc2ccccc2o1 852017092 TVTXTOTXDLYJPI-HNNXBMFYSA-N 384.863 5.471 30 20 GKED COc1ccc(Cl)cc1CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915087408 UDQAXJQQCWBQOO-NRFANRHFSA-N 390.870 5.185 30 20 GKED Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1C=NNc1ccccc1 916245981 QOBUWZFUWPFZNY-UHFFFAOYSA-N 378.785 5.299 30 20 GKED CCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)s1 916906520 CUXVCWSSAGDMKK-QGZVFWFLSA-N 390.464 5.064 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(OC)c2)cc1 1776125779 SGHKMUNDCZORGL-DHDCSXOGSA-N 396.483 5.639 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1\CCc2occ(C(=O)O)c2C1=O 1776199796 AKOUVOXVHQDBCP-ZXXZFBTCSA-N 376.330 5.155 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776341473 REDXGCCYVOHYGD-BENRWUELSA-N 390.504 6.208 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(C(F)(F)F)ccc1F 1776354456 LQRFHQKZJOHOOP-XVNBXDOJSA-N 396.336 5.226 30 20 GKED CCCCCCCOc1cccc(CNCc2cc(F)c(C(=O)O)c(F)c2)c1 1776787657 ILIXYRDZXXFYMO-UHFFFAOYSA-N 391.458 5.302 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3ccc(C(=O)O)cc3O)ccc21 1777002700 AHHVQMCDUKAUTN-WQLSENKSSA-N 385.419 5.114 30 20 GKED CCCn1c(S[C@@H](C)C(=O)Nc2ccccc2C#N)nc2cc(Cl)ccc21 5919597 LABCWXGVJMLPLO-ZDUSSCGKSA-N 398.919 5.091 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c1 23580388 CDNONSBHCNFNPQ-PKNBQFBNSA-N 392.436 5.178 30 20 GKED O=C1/C(=C\c2ccccc2OCc2cccnc2)CSc2ccc(F)cc21 58167333 DCJGQYKOSDVOCB-YVLHZVERSA-N 377.440 5.172 30 20 GKED C[C@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 66861308 UEORUROEWRKRHQ-CABCVRRESA-N 387.936 5.024 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 66953580 WUMOLHCQYCGXQL-QFIPXVFZSA-N 386.455 5.058 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(C3CC3)nc3ccccc23)cc1 103960520 AAUGIENUBFILDO-UHFFFAOYSA-N 385.467 5.071 30 20 GKED C=CCN(Cc1nc(-c2ccc(OCC)cc2)no1)Cc1ccc(Cl)s1 105823870 LRBICJIHANUZPU-UHFFFAOYSA-N 389.908 5.038 30 20 GKED COc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108532607 YHCDTAXVGPIWPZ-OXQOHEQNSA-N 395.528 5.316 30 20 GKED CC[C@H](C)N/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccc(C(C)(C)C)cc1 154518742 QWYMTLIKQIWFMM-SFHVURJKSA-O 397.608 5.215 30 20 GKED Cc1ccc(NC(=O)c2cccc(SCC#N)c2)c(-c2nc3ccccc3[nH]2)c1 175686307 ZLDLZSHZIMAPAB-UHFFFAOYSA-N 398.491 5.406 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)Nc1ccn(CCC#N)n1 191346661 YCSNSAPQKDNVQH-UHFFFAOYSA-N 383.521 5.174 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1OC 255053197 MHBOFWNNYNHRCL-HJWRWDBZSA-N 389.451 5.061 30 20 GKED N#CCC[C@H](NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccccc1 255363203 JQVLXLVCGIWGQC-CBUFDYBVSA-N 375.859 5.063 30 20 GKED COc1cc(/C=C/C(=O)c2cnn(C(C)C)c2)ccc1OCc1ccc(F)cc1 303019368 TWPKDLGFRNGNKO-UXBLZVDNSA-N 394.446 5.087 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nc(-c2cccnc2)no1 368060531 NKUKOXKXGCXMCC-SJORKVTESA-N 395.466 5.082 30 20 GKED CCCN(CCCC1(C#N)CCOCC1)[C@H](C)c1ccccc1Br 410325530 KIBACIDZSYOHES-QGZVFWFLSA-N 393.369 5.323 30 20 GKED C=CCC1(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)CCOCC1 424649275 XDYLEWDLTZFNIJ-UHFFFAOYSA-N 384.907 5.264 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2nc3c(s2)CCCC3)CC1)c1ccccc1 425023793 RYDPEZKALBXJLO-QGZVFWFLSA-N 380.557 5.088 30 20 GKED C=CCC[C@@H](C(=O)N[C@@H](C)c1nc(-c2ccncc2)cs1)c1ccccc1 426990014 FTYJPDLCQSHUCI-QFBILLFUSA-N 377.513 5.132 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)Nc1ccc(F)c(C#N)c1 435681853 CDULOQPICZAXFD-UHFFFAOYSA-N 390.201 5.220 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)c2ccccc21 437415584 YUAZGSMIKDCHOC-UAPYVXQJSA-N 391.902 5.274 30 20 GKED Cc1cccc([C@@H]2CCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C 437911336 BAZMBYDNSDDJIW-QFIPXVFZSA-N 375.516 5.864 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccncc2)c1 438167403 OVWZRTJUEBALJR-DHIUTWEWSA-N 398.466 5.178 30 20 GKED C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639743 YDBACPZCPOQCTK-DOMZBBRYSA-N 391.368 5.126 30 20 GKED CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438651270 SJABFWSJAVMOBH-UHFFFAOYSA-N 395.459 5.605 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3cccc(OCCCC#N)c3)cc2)cs1 440693772 ORZGOPYVLMQVHJ-UHFFFAOYSA-N 377.469 5.053 30 20 GKED Cc1sc(CNc2ccc([N+](=O)[O-])c(C#N)c2)nc1-c1ccc(Cl)cc1 443446712 PPPVMYYBFSDADR-UHFFFAOYSA-N 384.848 5.164 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3c(F)cc(F)cc3F)cc2)cc1 443917181 OJZFFUYISMUJQQ-UHFFFAOYSA-N 382.341 5.215 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 448938487 ROMSXNGHZUMWFL-JTQLQIEISA-N 398.372 5.628 30 20 GKED C[C@@H](O)CCCN[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 450722254 ZZFISSZKPCOSDZ-PELKAZGASA-N 397.281 5.078 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C1CC1 455058618 RSONXGUORJNBCI-QFBILLFUSA-N 379.508 5.288 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ncc(-c4ccc(Cl)cc4)s3)cc2)CC1 461112170 SOQQMMTVQFTIIP-UHFFFAOYSA-N 379.872 5.271 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1c(Cl)cccc1Cl)C1CC1 462050202 IOHQJJPGXGRBQL-IBGZPJMESA-N 388.298 5.158 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1[N+](=O)[O-] 463920892 FAROGHXECNSUST-LBPRGKRZSA-N 395.406 5.792 30 20 GKED C[C@@H]1C[C@H]1[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 466133153 UKVMYOLXYONADD-XMCHAPAWSA-N 381.907 5.660 30 20 GKED CC(C)Cc1ccc(CNc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 468966738 LXDQLLLPNWPNMT-UHFFFAOYSA-N 375.516 5.080 30 20 GKED C=C(C)COc1cccc(NC(=O)c2c(F)ccc(C)c2Br)c1 469300539 IFYOZOYDHBGUAR-UHFFFAOYSA-N 378.241 5.104 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)cc1 474903121 RTZSVOFKLYNRSK-UHFFFAOYSA-N 387.458 5.038 30 20 GKED CCCc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cnn1-c1cccc(C)c1 477097351 FUAJJSZMPCTQQR-FQEVSTJZSA-N 386.499 5.159 30 20 GKED CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1 480481828 OOCAJXCXNSAVEZ-UZLBHIALSA-N 379.504 5.648 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(NC(=O)NC(C)C)cc1)c1ccc(F)c(F)c1 480696850 XYMIGLLCZAWLQL-BTYIYWSLSA-N 387.474 5.463 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](C(=O)Nc1ccccc1)c1ccccc1 481649406 DYXDYMZMPHMPSR-JWQCQUIFSA-N 395.506 5.295 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2NCc2ccccc2Cl)cc1 481882512 YMIIDVXQKCIMQV-UHFFFAOYSA-N 375.859 5.270 30 20 GKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)cc1Br 487422387 UWUABZVIZBGWKC-LJQANCHMSA-N 385.305 5.231 30 20 GKED C=CCOc1ccc(CN2CCC3(CC2)OCCc2ccsc23)cc1Cl 497077948 JYCLYCMQZXCDSF-UHFFFAOYSA-N 389.948 5.030 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@H]1c1ccc(F)cc1F 497813531 SHAMSDBUABOKOG-IRXDYDNUSA-N 380.419 5.307 30 20 GKED CC[C@@H]1C[C@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCO1 502924263 HGZTUFBGWGEZAQ-NVXWUHKLSA-N 384.863 5.148 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H](C)c1ccccc1 504051478 HNOWMCKKBWLMOY-GOSISDBHSA-N 385.467 5.328 30 20 GKED CCN(C(=O)c1cc(-c2ccc(Cl)s2)on1)[C@@H](C)c1ccc(C#N)cc1 509563994 KDPIQAZUFRCHQS-LBPRGKRZSA-N 385.876 5.151 30 20 GKED C[C@@H](Oc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 515241057 RZSNSRBNIBCDOV-IERDGZPVSA-N 390.870 5.401 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(Cl)cc2F)cc1 518555392 IBUSYQQXBJTCMX-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 520056339 RNVWGICFTZNYJD-GOSISDBHSA-N 390.911 5.414 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc4cccnc34)cc2)cc1 521091438 OOHKZKKKXLDANZ-UHFFFAOYSA-N 379.419 5.345 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC1CCCC1 521418342 DVTGCGDPUGSVTC-UHFFFAOYSA-N 393.556 6.035 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)c2)c1 522831003 BMGBPGAYBCAZQS-OAQYLSRUSA-N 395.462 5.249 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 523105015 XVMXRXARNZEOKE-ZDUSSCGKSA-N 376.378 5.108 30 20 GKED Cc1ccc([C@H]2CCCCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)o1 524129293 OERPPZGKYYSZOI-LJQANCHMSA-N 381.476 5.396 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ccccc1)[C@@H]1CCCO1 524258497 QBFGZPASQPWZBR-PKOBYXMFSA-N 390.936 5.019 30 20 GKED COc1ccc(C[C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccc(OC)cc2)cc1 525248041 YGQYAHGFRFWEIE-BVZFJXPGSA-N 386.495 5.210 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccc(Br)cc1)c1ccccc1 533929148 ANQOHMDOANRNNS-UZLBHIALSA-N 384.317 5.473 30 20 GKED C=C[C@@H](CC(=O)Nc1c(N2CCCC2)cccc1N1CCCC1)c1ccccc1 535453088 WIZQFJODGXEQJP-FQEVSTJZSA-N 389.543 5.185 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)Cc3cnc4ccc(C#N)cn34)cc2c1 539827270 MRTJXCKUDVVYPF-UHFFFAOYSA-N 396.450 5.056 30 20 GKED Cc1cc(C(=O)NCCCC#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 543387810 UXFAVFNYBALBOA-AWEZNQCLSA-N 390.314 5.509 30 20 GKED Cc1c(C(=O)N2CCCCC[C@H]2[C@@H]2CCCCC2=O)sc2ccc(C#N)cc12 551798421 VVPFBYRPYGZWOM-HKUYNNGSSA-N 394.540 5.226 30 20 GKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 552871599 QQOLZBAGNFGBPZ-XLIONFOSSA-N 377.488 5.241 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)N2CCC(CCC#N)CC2)cs1 580331121 DSPPFRKJFSZFKY-UHFFFAOYSA-N 399.535 5.078 30 20 GKED CC(=O)c1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)ccc1F 584712196 WKGQBQKFFHDMPB-UHFFFAOYSA-N 390.439 5.303 30 20 GKED Cc1c(CN(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)oc2c(C)cccc12 593406438 IPQMCMOPBNCPTR-NRFANRHFSA-N 389.499 5.626 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)CCC2 593975165 OCIRULLHAUBIOH-CRAIPNDOSA-N 380.513 5.148 30 20 GKED N#CC1(c2ccc(CNc3ccc(NC(=O)N4CCCCCC4)cc3)cc2)CC1 594933472 GJQSNQOBQUBBMD-UHFFFAOYSA-N 388.515 5.262 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC[C@H](CC#N)C3)cc2)cc1 596726458 OQTRPBKZIQHZSA-MRXNPFEDSA-N 381.501 5.004 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@@H](c1ccc(O)cc1)C1CC1 597180920 WUYYVRVFAPSIIW-DNVCBOLYSA-N 380.513 5.166 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)C1 597916536 NXSRQGQPIVTNJA-QGZVFWFLSA-N 387.508 5.243 30 20 GKED COc1ccc2oc(C(=O)N(Cc3ccco3)c3ccccc3C#N)c(C)c2c1 603531194 GUXWJNBYXZSNJU-UHFFFAOYSA-N 386.407 5.062 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCc1cccs1 603532720 NAILFOSPAMOSEL-UHFFFAOYSA-N 378.472 5.233 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCc3sccc3C2)cc1 609338739 FXOINDYMBSYUQH-UHFFFAOYSA-N 389.480 5.392 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cc(Cl)cc(Cl)c3)cc2)nc1 609496024 GXAICRHUDHHXHN-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@@H]1CCCc2cc(OC(F)F)ccc21 609669864 YGYGWBKNHUOHAC-CQSZACIVSA-N 383.320 5.063 30 20 GKED COC(=O)[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccc(Cl)c1 609805227 HYWNSIPVKIVFFY-NRFANRHFSA-N 392.842 5.330 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)c1cc2ccccc2n1CC#N 610234334 YIMRJOGMUQWSAD-UHFFFAOYSA-N 377.513 5.367 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1cccc(C#N)c1 610406724 JVBGTQBRAKJPSN-CQSZACIVSA-N 387.405 5.012 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 611384940 DHKOHJSJEQTCNO-QGZVFWFLSA-N 391.452 5.134 30 20 GKED CCC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 611802980 DMFJUYZVHTYFKB-UUOWRZLLSA-N 398.510 5.522 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)C1 612239830 NYMDQBKVNJHUHP-INIZCTEOSA-N 386.826 5.339 30 20 GKED N#CCCn1cc(/C=C\c2nc([C@H]3CCc4ccccc43)no2)c2ccccc21 612933230 OSJWBDSGDPFMGL-BUVUWQSRSA-N 380.451 5.186 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCn3c(cc4ccc(Cl)cc43)C2)cc1 618455793 PAUNCKXHPPUIHH-UHFFFAOYSA-N 392.890 5.144 30 20 GKED Cc1c([C@@H](C)N[C@H]2CCc3cc(C#N)ccc32)cnn1-c1cccc(Cl)c1 618803280 HRZNRWFIRPSTFS-PEBXRYMYSA-N 376.891 5.044 30 20 GKED CCn1ccnc1[C@H](C)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647323481 PYVCOCKLGGSZPA-JTQLQIEISA-N 383.311 5.366 30 20 GKED Fc1cc(Cl)cc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 681594672 HBFYNQJCPVYIES-NXEZZACHSA-N 377.731 5.478 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccccc2F)cc1 726858507 NNAXGGMSFNWTSW-OXJNMPFZSA-N 380.463 5.009 30 20 GKED C#Cc1cccc(N(C(=O)CCc2ncc(-c3ccccc3Cl)o2)C(C)C)c1 728246628 BKYWXMCYZJKRJS-UHFFFAOYSA-N 392.886 5.351 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)cc1 728441535 LOQIRDNPGZEZFX-FMIVXFBMSA-N 380.444 5.112 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3ccc(F)c(F)c3)cc2)oc1C(=O)O 729937576 WJPIGUKOMBYVDX-RUDMXATFSA-N 398.361 5.040 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@H](C#N)C(=O)Nc3ccccn3)sc2c1 732708094 LXBRXBLQRSPARQ-AWEZNQCLSA-N 397.887 5.034 30 20 GKED CCSc1cccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 733843798 VWUCGVWVLPUBDR-QFIPXVFZSA-N 387.508 6.098 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)SCc2cc(Cl)ccc2OCC#N)c1 735317464 AOBFVGRELRZONZ-HNNXBMFYSA-N 388.920 5.120 30 20 GKED CCCCCCCC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 740726854 IXRQVYGPGPMNOF-FQEVSTJZSA-N 382.548 6.489 30 20 GKED CCCCn1nc(C)c(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c1Cl 741473475 QMHXSVOTIUTQBF-HJWRWDBZSA-N 379.891 5.603 30 20 GKED C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743629445 QHYPAYITWWAHQH-QRWLVFNGSA-N 392.405 5.026 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc(-c2ccccc2[N+](=O)[O-])s1 745612463 XOLDGLPSXQAXIU-UHFFFAOYSA-N 395.444 5.142 30 20 GKED C[C@H](OC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)C(C)(C)C#N 753607882 IHLYLAKVOSLXMR-NSHDSACASA-N 379.243 5.276 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 755218812 AWCSDQKNRJZZMP-BEFAXECRSA-N 389.421 5.585 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1 756234536 VRPHPHGRPPHNIL-GUYCJALGSA-N 398.890 5.132 30 20 GKED CCCCCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(F)cc1OCC#N 761664492 HQBOEDIJGBIDLX-UHFFFAOYSA-N 387.430 5.091 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccc(Cl)cc3)c2)s1 762446293 HRLPHMJQLHCRMN-ONNFQVAWSA-N 392.867 5.422 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C/c1ccc2[nH]ccc2c1 765624522 NCFBSOAKNRVPJM-WEVVVXLNSA-N 394.434 5.187 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCCc3sccc32)cc1 767582769 CVWMJWQQIRZNDD-SFTDATJTSA-N 387.508 5.603 30 20 GKED C=C(C)C[C@H](C)C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 767698854 UZAHBBGRZXCZBS-QMMMGPOBSA-N 399.101 5.384 30 20 GKED N#C[C@@H](COC(=O)c1cnc(-c2ccccc2Cl)s1)Cc1cccs1 772738014 ZIPYSJPQMXWFRZ-LBPRGKRZSA-N 388.901 5.064 30 20 GKED CC1(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCC1 772972635 UXUGLZHHHXNUGV-CYBMUJFWSA-N 395.311 5.252 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCc3c2sc2ccccc32)c1 772983405 HMEDITOEXGDGRZ-UWJYYQICSA-N 376.525 5.749 30 20 GKED C#CC[C@H](NCc1ccccc1CN[C@@H](CC#C)c1ccccc1)c1ccccc1 775400935 UJBOCZJJJOWWNV-NSOVKSMOSA-N 392.546 5.395 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cccc(Cl)c2Cl)cn1 792882420 GBEKNQGNJXBHQL-MDZDMXLPSA-N 385.250 5.355 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2SCc2ccccc2)c1 794852299 GNLJXXYPJODXIN-UHFFFAOYSA-N 378.884 5.756 30 20 GKED CC(C)O[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796757524 ZJXVORAMYKYDHL-KXBFYZLASA-N 384.888 5.292 30 20 GKED N#C[C@@H](C(=O)CO[C@H]1CCCc2ccccc21)c1nc(-c2ccccc2)cs1 797549399 IHRSMWITJWWUOV-UGKGYDQZSA-N 388.492 5.081 30 20 GKED C[C@@H]1CC(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C[C@@H](C)O1 801663448 SXXZXQLTONOEQM-PMAPCBKXSA-N 391.515 5.057 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)ccc1C(C)C 813216085 NEDHDYITDWPVGJ-KSSFIOAISA-N 390.405 5.176 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccccc1 814524228 PSPKQKJJDPXRFU-LJQANCHMSA-N 397.569 5.722 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)c(F)cc1Cl)c1ccc(Cl)c(Cl)c1 815544071 IJCVCAKHFQANAB-CQSZACIVSA-N 392.044 5.434 30 20 GKED O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 857498492 GWGOTIOSAYYYRK-KBPBESRZSA-N 397.265 5.117 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1 915085143 HDWZCHRUHPIXAZ-HXUWFJFHSA-N 385.854 5.729 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(C(F)(F)F)c2)cc1 915085646 DLRIKCITZBYSDN-NRFANRHFSA-N 394.396 5.542 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccc2Cl)cc1 915086242 ITPWDBKZTFQKCH-IBGZPJMESA-N 381.262 5.901 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc2ccccc2c(Cl)n1 915147635 KTPHWMCYRIMWRH-UHFFFAOYSA-N 377.875 5.058 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C#N)cc2)ccc1OCc1ccc(F)cc1 916135410 ZLPVTRMJKSDRCH-WUXMJOGZSA-N 387.410 5.181 30 20 GKED N#C[C@@H](C(=O)COc1ccc(-c2ccccc2)cc1)c1nc2ccccc2s1 916627184 DBZJEKOPALIJJW-IBGZPJMESA-N 384.460 5.219 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c(C)c1 916907365 YDMVUTAZOFQPOV-FQEVSTJZSA-N 384.435 5.057 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2csc3ccccc23)cc1 916914655 QCPSMFMGTKERAT-SFHVURJKSA-N 376.481 5.205 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/c2nc(C(=O)O)c(-c3ccc(F)cc3)s2)cc1 1776215415 BOUVUCDRCXMJFL-RVFSUOIPSA-N 394.427 5.109 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(-c2ccccn2)c1 1776355494 SYHJWRBEECHIAN-PKNBQFBNSA-N 387.435 5.130 30 20 GKED C[C@H]1/C(=C\c2cc(C(=O)O)c(Cl)s2)C(=O)c2cccc(Br)c21 1776586648 JTICKSAYNNFUFQ-OYSUNCFMSA-N 397.677 5.246 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-n2cnc3ccccc32)cc1 1776782704 BEOXMNOQFHWZKZ-HXUWFJFHSA-N 393.531 5.319 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(NC(=O)CCCC)cc1 1776783992 QLFNRBUWNYESGY-HXUWFJFHSA-N 376.541 5.109 30 20 GKED CCCCCCCOc1cccc(CNCc2ccc(CCCC(=O)O)cc2)c1 1776787641 CNWUKUHLVVUPIH-UHFFFAOYSA-N 397.559 5.733 30 20 GKED Cc1ccc(-c2cccc(/C=C/C(=O)c3cccc(O[C@H](C)C(=O)O)c3)c2)cc1 1777429696 INVIEPOUGJEQNK-GPZRYRNASA-N 386.447 5.410 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC(C)(C)C)CC1 1826335098 XZWOQQQMEVUNRS-FQEVSTJZSA-N 390.612 5.035 30 20 GKED C=CCN(C(=O)CCc1c[nH]c2ccccc12)c1nc(-c2ccccc2)cs1 14723797 ADGMPNMYHGUOBJ-UHFFFAOYSA-N 387.508 5.443 30 20 GKED N#Cc1ccc(OCC(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 15710566 QBXDNADPSYKHLI-UHFFFAOYSA-N 378.815 5.021 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(C(=O)c3ccccc3)CC2)cc1 25946945 LUQIVMRKBZGDDQ-UHFFFAOYSA-N 380.491 5.320 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cc(-c2cccs2)on1 48053454 SOXKIGIRBRKHCU-UHFFFAOYSA-N 394.525 5.064 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)cc1 61058819 GJYQDKBHGPSRBT-UHFFFAOYSA-N 382.419 5.330 30 20 GKED Cc1ccccc1OCCCN(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66954314 KTVJKJVNMZNAAQ-GOSISDBHSA-N 397.544 5.322 30 20 GKED O=C(/C(=C\c1ccc2c(c1)OCCO2)c1nc2ccccc2s1)c1ccccc1 96767024 WNLOGQNAMVPZJH-NBVRZTHBSA-N 399.471 5.491 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1F)C1CC1 108533462 BPIFNEMXUKIKRI-HNNXBMFYSA-N 383.492 5.274 30 20 GKED CSCCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 151833591 NQSSBPPLDLBKOF-UHFFFAOYSA-N 376.469 5.183 30 20 GKED N#CC1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccccc2Cl)CC1 155660868 WQXRMHZCGAXYCF-IBGZPJMESA-N 388.298 5.028 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2ncon2)cc1 171011404 XUGWFSHKWHMVFZ-UHFFFAOYSA-N 398.447 5.012 30 20 GKED CCc1cnc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 175663827 FUXADRQJGCYLPC-UHFFFAOYSA-N 392.484 5.033 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)[C@@H](C#N)c3nc(C(C)C)cs3)o2)cc1 177771895 GZKSBVMDKHDKHO-MRXNPFEDSA-N 379.485 5.039 30 20 GKED COc1ccc([C@H](C)N[C@@H](CCC#N)c2ccccc2)cc1CN1CCCCC1 183370487 QMHXHBLKOQAFMJ-RDPSFJRHSA-N 391.559 5.377 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1cn(C)c2ccccc12 185727764 NSMYLBFZFSCCKB-CVEARBPZSA-N 377.513 5.315 30 20 GKED C=CCC[C@H](C(=O)NCCCc1nc(-c2ccncc2)cs1)c1ccccc1 189031909 JCNPMQODAIYHDN-FQEVSTJZSA-N 391.540 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(Cn2cccn2)cc1 191439280 KIWJOKWMQUOVAV-UHFFFAOYSA-N 388.515 5.105 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1csc(-c2ccco2)n1 191517205 LOMCQABZMXVCCC-UHFFFAOYSA-N 381.501 5.577 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCO[C@H]1C(C)(C)C 246305457 FQURWALBSPQYCU-JTDSTZFVSA-N 389.565 5.044 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1Cl 255658876 YPKGHBBICPCPSF-GAJOTYCWSA-N 385.801 5.365 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 301767095 VRQRWYJEWLPJOC-CQSZACIVSA-N 386.929 5.886 30 20 GKED Cc1ccc(-n2nc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c3c2CCCC3)cc1 303258439 DTOKBCIUDNULIA-UHFFFAOYSA-N 398.510 5.113 30 20 GKED C[C@H](/N=C(/O)C1CCCCC1)/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329500204 KEWLQRJPMTYQTA-HNAYVOBHSA-N 386.540 5.257 30 20 GKED C=CCC1(C(=O)Nc2ccc(Br)c(Cl)c2Cl)CCOCC1 425558812 FVIFQIZNXMABDF-UHFFFAOYSA-N 393.108 5.067 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2c[nH]nc2-c2ccc(Cl)s2)s1 430633233 ZJIGDIUONKZZAW-SECBINFHSA-N 390.921 5.036 30 20 GKED N#CCC[C@@H](NC(=O)NCC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 432113818 RQDBAUJBORTKLN-RBUKOAKNSA-N 389.421 5.067 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2cccnc2)ccc1C 432812641 QZXPIFDSBQBFMI-UHFFFAOYSA-N 384.483 5.373 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2o1 433150301 LKRCGYBIYRMFOV-SFHVURJKSA-N 390.487 5.682 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 433156904 KTGMDADXDFGARL-MJGOQNOKSA-N 392.528 5.638 30 20 GKED Cc1cccc([C@@H]2CCCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)c1C 437946751 JYMZCVZENMDNBI-IBGZPJMESA-N 399.441 5.536 30 20 GKED Cc1ccc(C(C)(C)CN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 438036354 GTNBKPVTQWYZES-SFHVURJKSA-N 395.572 5.831 30 20 GKED N#Cc1ccccc1SCC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 439715463 FCBYLOPLZLZPSU-QFIPXVFZSA-N 392.911 5.210 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](NCC2CCC(C#N)CC2)CCC3)cc1 442856998 OZISQFWGGRVJAV-LADRWXRNSA-N 381.545 5.116 30 20 GKED FC(F)Oc1ccc(-c2nnc(SCC#Cc3ccc(Cl)cc3)o2)cc1 443427556 MRZOSSLRCYBHHN-UHFFFAOYSA-N 392.814 5.135 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccc(O)c1 445250625 OLOSCONAURPTEP-SJORKVTESA-N 385.467 5.052 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 455565954 AVTTVPMOSQESAY-ZIAGYGMSSA-N 392.446 5.999 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCc2cc(-c3ccccc3)oc2C1)c1ccccc1 458798379 HZLJTLBDLCFVOU-JOCHJYFZSA-N 399.494 5.449 30 20 GKED C[C@@H]1CCN(C)c2ccccc2N1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 460207501 VDSOZDDAWHEXGY-GOSISDBHSA-N 397.478 5.226 30 20 GKED C[C@@H](C(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)c1cccc(C#N)c1 461802272 JLQWWOCZYNPWCQ-JPYJTQIMSA-N 393.490 5.091 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(F)c(F)c2F)cc1 465460490 VRRUDRMSXZQOPU-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C[C@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1F 468033102 GNTSGFSIILKOAU-ORAYPTAESA-N 395.478 5.688 30 20 GKED CC(C)[C@H]1C[C@@H](NC(=O)c2cnn(CCC#N)c2-c2ccccc2)c2ccccc21 468740310 WBVHJWMPUXFGJQ-FYYLOGMGSA-N 398.510 5.078 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(F)ccc2SCC(F)F)cc1 476074977 XNFNMRXOYCWKDD-UHFFFAOYSA-N 378.419 5.236 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ncc(C(C)(C)C)o1 476517587 ZUQUZOURGLVOOJ-AWEZNQCLSA-N 379.435 5.948 30 20 GKED CC(C)[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(F)ccc1F 479457720 RMVLSMUYJVMNNO-HSZRJFAPSA-N 397.469 5.357 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 480541377 POEQMCYFOTZKAL-HZSPNIEDSA-N 385.455 5.133 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccc(C#N)cc1 482298706 CCDQRMXTZAAVKE-AWEZNQCLSA-N 378.378 5.120 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c(F)cc1F 482524195 PBOCGLATGQALSV-UHFFFAOYSA-N 392.405 5.285 30 20 GKED C[C@H](NC(=O)CC1CC(OC(C)(C)C)C1)c1ccc(-c2cccc(C#N)c2)cc1 485951608 MJEKSFZQQXMRCG-OYMFQORVSA-N 390.527 5.386 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCCCC(=O)C1 486265363 DOHNAQMWBDWOJS-HXUWFJFHSA-N 392.474 5.079 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(-c2ccccc2F)n1C1CC1 486974293 YCZJBEKMYIIUEG-UHFFFAOYSA-N 392.503 5.513 30 20 GKED Cc1ccc([C@H](NC(=O)N2C[C@@H](C#N)[C@H](c3ccccc3)C2)c2ccccc2)cc1 487523918 WTNVUFJPRZCSRM-DSNGMDLFSA-N 395.506 5.033 30 20 GKED N#Cc1cccc(CNC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)c1 487541805 MGITXMCJBVOMDI-UHFFFAOYSA-N 397.453 5.095 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C#N)c(C)c3)s2)cc1 488284359 YKVFJZXXHUZVQS-OAHLLOKOSA-N 377.513 5.158 30 20 GKED CSC[C@H]1CCCN(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1 489998451 PXAYBLONUCZLPF-MJGOQNOKSA-N 393.556 5.071 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1Br 495284909 DINHONAGDMCSLA-VIFPVBQESA-N 391.315 5.173 30 20 GKED CC(C)[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccncc1 499849984 SEFGQPPCTXYPGX-JOCHJYFZSA-N 389.430 5.263 30 20 GKED Cn1cc(CNc2ccc(COc3ccccc3)cc2)c(-c2ccc(C#N)cc2)n1 500764686 MRHJMWSLHUXXPY-UHFFFAOYSA-N 394.478 5.150 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 501767149 FDXQARUIEGDWID-QGZVFWFLSA-N 383.398 5.112 30 20 GKED CC(C)CCOc1cccc(NC(=O)Nc2cccc(OCCCC#N)c2)c1 502653818 UBBVNCUSRJFBHW-UHFFFAOYSA-N 381.476 5.438 30 20 GKED CCc1c(C)sc(NC(=O)c2cccc(Br)c2Cl)c1C#N 503030646 UVOMYQRBSJRGLL-UHFFFAOYSA-N 383.698 5.159 30 20 GKED CCC[C@H]1C[C@H](C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 503053656 AGDLFMTVOHBJBW-NQIIRXRSSA-N 396.918 5.340 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccc(C#N)cc1 504911025 ZMNVXSKXUQGTJV-NSHDSACASA-N 397.784 5.035 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)cc1 509720736 UDEGTJITBYKRRQ-HKUYNNGSSA-N 387.405 5.229 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H](C)CC[C@@H]2C)cc1 510094261 SPAOLYDSBFIZER-CVEARBPZSA-N 379.460 5.011 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1 512532802 VLDPYHJFYSOVGJ-INIZCTEOSA-N 399.926 5.307 30 20 GKED C=CCCO[C@@H](C)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 519999992 NWJRUEFKDWMJHX-QFBILLFUSA-N 396.918 5.051 30 20 GKED CC(C)Oc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1Cl 520477188 ASBFIWYQNUSSRA-UHFFFAOYSA-N 385.895 5.441 30 20 GKED C[C@@H](NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1ccc(C#N)cc1 521606145 GKHGGQLZEYYOPB-ZHRRBRCNSA-N 390.483 5.408 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)cc1 530622073 KMBJWRMLEPADRJ-UHFFFAOYSA-N 383.234 5.910 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 538840642 ZZNLKPAGBAEUHX-OAHLLOKOSA-N 384.932 5.553 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 542086826 WTXDTRHKEDQDNW-KOSHJBKYSA-N 396.494 5.228 30 20 GKED CO[C@@H]1CCCC[C@H]1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 549779116 TWUVQCFLZBYPHL-SVFBPWRDSA-N 382.891 5.139 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cs1 559147177 NIXFWMRKKGOKHE-UHFFFAOYSA-N 396.855 5.520 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)cc(F)c2Br)c(Cl)c1 565721181 VWJXXMXIXOSNDQ-UHFFFAOYSA-N 388.023 5.019 30 20 GKED C[C@H]1CC(CCNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C[C@H](C)O1 577709285 IPIKBWBDDMYVSN-IRXDYDNUSA-N 393.487 5.066 30 20 GKED COc1ccsc1C(=O)/C=C\c1csc(N(C(C)=O)c2ccc(C)cc2)n1 588489087 TTZUKAQLPPLIHW-TWGQIWQCSA-N 398.509 5.102 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc4cc(Cl)ccc4[nH]3)cc2)ccn1 589541645 XDNPVAKHKHWOSW-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C[C@]1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1(F)F 596692028 USLUTOXYBKIHBG-QFBILLFUSA-N 389.833 5.162 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C[C@@H](C)C1(F)F 599736044 BUUYQDDDXKESOR-GASCZTMLSA-N 385.414 5.106 30 20 GKED N#CC1(c2ccc([C@H]3Nc4ccccc4C(=O)N3Cc3ccccc3)cc2)CC1 602759595 MZKRJZVRIVPOSO-QHCPKHFHSA-N 379.463 5.008 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc(-c4cccc(Cl)c4)no3)c2C#N)C1 604528058 IQOAUKOYYMHPIE-LLVKDONJSA-N 397.887 5.305 30 20 GKED C[C@H](C(=O)Nc1cccc(OCCCC#N)c1)c1c(Cl)cccc1Cl 604566860 PAXGALQUSRPSQT-ZDUSSCGKSA-N 377.271 5.418 30 20 GKED Cn1ccc2c(NC(=O)c3ccccc3SCc3ccc(C#N)cc3)cccc21 608882503 OOTKNDFOJNUMIU-UHFFFAOYSA-N 397.503 5.595 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609376768 JAQIBFDRWOUNOV-PXNSSMCTSA-N 396.556 5.858 30 20 GKED COc1ccc(CCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 609428508 RDQUCRPEHQNFSD-QGZVFWFLSA-N 382.529 5.441 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](Cc1ccccc1)C(C)C 610040472 VGFOZEMINQJBGN-QFIPXVFZSA-N 399.494 5.507 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 610355329 OAVOWMNHYXSUMZ-STQMWFEESA-N 376.287 5.329 30 20 GKED O=C(Nc1ccc(Cl)cc1F)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618539926 YMWKAHQRKPTKIO-HTQZYQBOSA-N 392.702 5.074 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)c(F)cc1Cl 619124175 JWADOQUQFPZDCL-UHFFFAOYSA-N 397.693 5.402 30 20 GKED Cc1ccc(N(CCC#N)C(=O)Cc2csc(-c3ccc(Cl)cc3)n2)cc1 726940266 BWUAQTJRASCAAR-UHFFFAOYSA-N 395.915 5.261 30 20 GKED O=C(Cc1ccc(N=Cc2cc(Cl)ccc2O)cc1)Nc1ccccc1F 727972905 KTTBEWXXQDJJDJ-UHFFFAOYSA-N 382.822 5.117 30 20 GKED COC(=O)C[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccc(SC)cc1 728174719 YYXVILZGNDUEEJ-QZPXRHMKSA-N 398.311 5.144 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc(-c2ccco2)nc2ccccc12 729433011 LZHZPQYFGQPQRU-UHFFFAOYSA-N 375.472 5.287 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 730995046 OEAXFLHHMXJPFU-LBPRGKRZSA-N 383.498 5.216 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741473889 UJQANNUYQJUYKB-KHPPLWFESA-N 397.453 5.586 30 20 GKED CC(=NNc1c(F)cc(F)cc1Br)c1cnc2ccsc2c1 741770467 BYUMRWNOIYOAJP-UHFFFAOYSA-N 382.233 5.173 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCc1cc(C#N)ccc1F 743677973 YTEULJXLRMWJSB-GOSISDBHSA-N 387.458 5.170 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccc(F)c(Cl)c1 745724391 QDONDBVHSWIKEV-UHFFFAOYSA-N 395.890 5.754 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1 751516587 DQFQPIXOLCAXDB-TWGQIWQCSA-N 377.494 5.262 30 20 GKED COc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1Cl 758408597 DROYCZSWUKVFHR-LJQANCHMSA-N 376.843 5.256 30 20 GKED Cc1cc(C(=O)O[C@@H](C)c2cccc(C#N)c2)ccc1NC(=O)c1cccs1 759306871 QIWUETOWKZBVEE-HNNXBMFYSA-N 390.464 5.099 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 762616928 WJHGJVUDZREXEM-UHFFFAOYSA-N 393.915 5.279 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCc2ccc(Br)cc21 769616007 VJQALOVQKDHOBU-NTEUORMPSA-N 397.297 5.180 30 20 GKED Cn1c([C@H](C#N)C(=O)C23CC4(C)CC(C)(CC(C)(C4)C2)C3)nc2ccccc21 773943805 OMPIQSYLCRSRLY-FEBWINHCSA-N 375.516 5.136 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)ccc1OC 776165995 ZSSYWWWGYFNKPN-LEWJYISDSA-N 398.522 5.782 30 20 GKED C[C@H](Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)c1cccc(C#N)c1 777243548 VBHLGQWBMDVKRU-INIZCTEOSA-N 377.488 5.025 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc([C@@H]3CCCOC3)cc2)cc1 779836208 AFRIGVLMMXLKEI-NOZRDPDXSA-N 396.490 5.488 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 780314236 FTAGTQFXIFWFBP-YUTCNCBUSA-N 396.434 5.087 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)COc2cccc(C#N)c2)c2cccs2)cc1 800690480 XXISNUQKCLUWGP-HSZRJFAPSA-N 390.508 5.028 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(-c3ccccc3)c2)c1 806761208 BPESAEYODPJYMQ-QFIPXVFZSA-N 385.467 5.356 30 20 GKED CC(C)(C)Sc1ccc(-c2noc([C@H](C#N)Cc3ccc(C#N)cc3)n2)cc1 809441150 XWFKINZXOQZAIY-SFHVURJKSA-N 388.496 5.349 30 20 GKED N#CCCCn1cc(-c2nc(-c3cccc(C(F)F)c3)no2)c2ccccc21 809479796 CEEQNSFFTMLCMW-UHFFFAOYSA-N 378.382 5.600 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813213612 OMDZQGPGQSSNPZ-CRAIPNDOSA-N 378.419 5.094 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)[C@H](C)[C@@H](C)CC2 839391000 PGBWEQLNXYAXSK-WDEREUQCSA-N 390.940 5.068 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@]4(C3)CC4(F)F)cc2)cc1 844522307 MKURTUNAQFWKHZ-FQEVSTJZSA-N 383.398 5.004 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CCC[C@@]3(C2)CC3(F)F)cc1 844702367 ZEZDPWHUMPJVDR-FQEVSTJZSA-N 399.466 5.363 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C3CC4(CCCCC4)C3)n2)cc1 850791056 QJFCHYGYNKMQPY-GOSISDBHSA-N 375.497 5.219 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc(C(F)(F)F)s2)no1 904968875 ILRLMQYYYNVFEU-NSHDSACASA-N 396.287 5.895 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc1OC 914490261 HRJRZOFFWLZWTF-TYZQSYOASA-N 385.891 5.146 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3ccccc3)CC2)cc1 915350423 VMHXNHSRFJHLQR-RUZDIDTESA-N 395.506 5.754 30 20 GKED Cc1ccc(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 916134549 YHPUHENMSXBIHU-BUHFOSPRSA-N 379.463 5.198 30 20 GKED N#CCOc1ccccc1C(=O)N[C@H](CCCc1ccccc1)c1ccccc1 919992486 IMFRVHBZVKHQQZ-HSZRJFAPSA-N 384.479 5.083 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/Cc3cc(C)ccc3C2=O)cs1 921270683 XTNZYOGWTBZROV-PDGQHHTCSA-N 388.492 5.267 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H](c3cccc(Cl)c3)C2)ccc1Cl 1776034188 RNYKVLRRWUBTHT-CYBMUJFWSA-N 377.271 5.817 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O 1776049757 ZKXCYHDLJMHHJN-UHFFFAOYSA-N 398.503 5.140 30 20 GKED CC(=NN[C@H](C)c1ccc(C(C)C)cc1)c1cccc(OCCCC(=O)O)c1 1776105694 ASZUAEONXBTHLR-QGZVFWFLSA-N 382.504 5.128 30 20 GKED C=CCCC[C@H](NCc1ccccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776172195 HORMEADJEZLPAX-SFHVURJKSA-N 394.298 5.685 30 20 GKED C=CCc1cc(C)c(OCCCN(CC)CC2CCC(C(=O)O)CC2)cc1C 1776188830 FTEHTJFJEZPGKM-UHFFFAOYSA-N 387.564 5.014 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2F)cc1)c1ccccc1 1776469374 BFAHDVLECDOPLZ-RTYFKUQISA-N 390.410 5.560 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Cl)c(C(F)(F)F)c1 1776784284 NULFWUXVGOWNAU-CQSZACIVSA-N 379.850 5.652 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2ccc(CC(=O)O)cc2)cc1 1776785593 QDOHBDOWYRZNGB-ATVHPVEESA-N 394.511 5.949 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1C 1777275166 CTTNIHUTIHRFRX-AWNIVKPZSA-N 386.447 5.573 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccc(/C=C/C(=O)O)cc1 1777488305 ZPXHDZNYRCMMER-HEEUSZRZSA-N 375.449 5.112 30 20 GKED C=CCSC1=N/C(=C/c2cccs2)C(=O)N1c1ccc(OC)c(Cl)c1 4513673 JDQDQXGYNMGYGH-RVDMUPIBSA-N 390.917 5.073 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(-n3cnc4ccccc43)cc2)cc1 25438725 HZMMCXRYXNRTJS-UHFFFAOYSA-N 380.451 5.079 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccccc1C(F)(F)F 66801358 GSOKLLFSSUDHSS-ZDUSSCGKSA-N 378.419 5.281 30 20 GKED N#C[C@@H](C(=O)c1oc2ccccc2c1CSc1cccs1)c1ccccn1 67798241 OVMCYVAHDRVQGR-OAHLLOKOSA-N 390.489 5.672 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 112128255 JBXCXHLPBADEGH-HOTGVXAUSA-N 377.579 5.078 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(-c3ccccc3)o2)nnc1-c1cccs1 123154153 GSTPIAWAGDVQCQ-CYBMUJFWSA-N 395.513 5.096 30 20 GKED C[C@H](NCc1ccc(C#N)cc1)c1nc(-c2ccc(Br)cc2)cs1 126148959 JURMNCAGUCOJQH-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED CCc1cccc(N/C(S)=C(\C(=O)c2ccccc2C)[n+]2ccc(C)cc2)c1 127604179 NTSAAXYKMLSGEO-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CC[C@H](C)N/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1ccc(C)cc1 154484133 JPJBUSUZFJPZOH-HNNXBMFYSA-O 397.589 5.133 30 20 GKED CCN(C(=O)c1ccc(C2SCCS2)cc1)c1ccc(C#N)c(Cl)c1 156567664 JLHGZFHYKKCACI-UHFFFAOYSA-N 388.945 5.357 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccc(F)cc1 158666164 DFTLQPUDEAGUQU-FQEVSTJZSA-N 389.430 5.325 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 176575010 HZCDSVINGRTNFQ-AWEZNQCLSA-N 393.468 5.075 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cs2)c1 177772490 VTXZEOHVALNWSM-MRXNPFEDSA-N 381.526 5.117 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccccc3Cl)n2)cc1 193666053 GEOPAHBNSROLIV-OAGJVSPASA-N 389.867 5.225 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc(Cl)s3)n2)cc1 193666876 XCCVCZLMKNCGGC-KEDPEKRHSA-N 395.896 5.286 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(Cl)c1Cl 194075536 VGMFCGZEGDKUHX-LBPRGKRZSA-N 379.312 5.569 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCCC3(C#N)CCOCC3)o2)cc1 281066382 UWILGBAUDQBGLN-UHFFFAOYSA-N 385.533 5.227 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H]1CCOc2ccccc21 303724457 WYVXVJNOWHYIFK-IBGZPJMESA-N 398.462 5.554 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 321085325 MMKDODYMZSDSFI-SNVBAGLBSA-N 389.318 5.068 30 20 GKED CC1(C)CCC[C@H](/C(O)=N/C2(c3noc([C@@H]4CCCO4)n3)CCCCCC2)C1 328790659 QJVSJDNASMZLJO-IRXDYDNUSA-N 389.540 5.644 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN([C@@H]2CCc3ccc(F)cc32)C1)C1CCCC1 329388133 RFSIRKSIFDUKTJ-DYESRHJHSA-N 396.510 5.194 30 20 GKED C[C@@H]1OCCC[C@H]1/C(O)=N/C1(c2noc(C3CCCC3)n2)CCCCCC1 330060091 MCVORSQPUBEZHM-DOTOQJQBSA-N 375.513 5.048 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c2[C@H](C)C1 411007270 FWYZLQHNWMAAGB-QWHCGFSZSA-N 381.526 5.174 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 417628010 QETMTEWQQSNXAZ-MRXNPFEDSA-N 394.298 5.081 30 20 GKED Cc1c(C(=O)Nc2cccc(OCC(F)(F)F)c2)sc2ccc(C#N)cc12 428175480 INNJZICNQXLQLA-UHFFFAOYSA-N 390.386 5.275 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 432075139 IUZHFHINPXCXEX-SZVBFZGTSA-N 397.519 5.678 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 433968005 OVDIUOQCBCKYGX-UHFFFAOYSA-N 391.789 5.267 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(c3ncc4n3CCCC4)CC2)cc1 434680177 HUDSXEPGCCSVTP-UHFFFAOYSA-N 396.538 5.138 30 20 GKED CCCCOc1ccccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 437884719 XFIQZJRAMPOLQE-TZIWHRDSSA-N 377.488 5.169 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccc(C(C)(C)C#N)cc1 437906720 HTDBSGCEXBUUJL-JOCHJYFZSA-N 377.532 5.671 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(NC(C)=O)cc2C(F)(F)F)CCCC1(C)C 444832946 FFTUMXXTOJDCNO-KRWDZBQOSA-N 397.441 5.262 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 456027585 OMUZMZZIHXWCGF-OAHLLOKOSA-N 375.434 6.457 30 20 GKED CCOc1ccc(CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C(C)C)cc1 458795750 CXXSXQZZULOWKH-HSZRJFAPSA-N 393.531 5.440 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@H]3Cc4ccccc43)cc2Cl)c1 460154116 IEHVTOTWHQRPGD-FQEVSTJZSA-N 388.854 5.069 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@H]3CCC[C@H]32)c1 460395886 WBOBQYAMEOCURR-FOIQADDNSA-N 380.875 5.409 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CC[C@H]2CCC[C@@H]2C1 460563576 JNFWPZWZSXTJIS-ZHALLVOQSA-N 376.525 5.408 30 20 GKED N#Cc1cc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)ccc1F 467766419 BELWZMSMWNWLHH-OAQYLSRUSA-N 395.275 5.339 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 471283739 UOSYUOCSUXPSIV-SZVBFZGTSA-N 397.519 5.535 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)c3ccc(C(C)(C)C#N)cc3)c(C)c2c1 475652391 VREVTDGQMJBHOK-OAHLLOKOSA-N 376.456 5.042 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)cc(Cl)c3)n2)cc1 477870732 ACZULBADYJPIIS-KRWDZBQOSA-N 382.872 5.271 30 20 GKED C=C(C)[C@@H](NCc1nc2cc(C(F)(F)F)ccc2n1C)c1ccc(F)c(F)c1 479410734 SAYGLMPMYFRIEO-LJQANCHMSA-N 395.375 5.277 30 20 GKED CCCCn1ncc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)c1C(C)C 485147484 NTPUQDCWAJNULU-UHFFFAOYSA-N 381.524 5.122 30 20 GKED CCc1c(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1CCC(C)C 494753579 PGVARVHBYDCFIW-MRXNPFEDSA-N 399.564 5.387 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)CCCc1cc(-c2ccccc2)no1 505040767 WXMNNOYMGDZUSK-UHFFFAOYSA-N 389.499 5.557 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510469939 GQLPPKQSAHHGAV-UHFFFAOYSA-N 396.849 5.495 30 20 GKED Cc1cc(F)ccc1N(Cc1ccco1)C(=O)CSCc1ccc(C#N)cc1 514425208 YWSQMMWZWQTVLP-UHFFFAOYSA-N 394.471 5.065 30 20 GKED N#CCCN(C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccc(F)cc1 517610526 AKZCOIIKOZGHIT-UHFFFAOYSA-N 395.821 5.227 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(Cl)cc1Cl 518255923 JYGDABNKNZJOKZ-LBPRGKRZSA-N 394.327 5.709 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 519330831 BMTBEWMSQKXLMN-CQSZACIVSA-N 377.941 5.441 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)n1cccc1 520498242 YBBSMUFRHDPWJB-OXQOHEQNSA-N 377.875 5.387 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520597930 LNMPSTRGPFFBBX-MRXNPFEDSA-N 389.430 5.715 30 20 GKED CN(C(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1)C1(C#N)CCC1 520723962 FPDVVYOBHJJOTC-FQEVSTJZSA-N 384.932 5.067 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 521469973 VWBFOPXYUOIHGW-IBGZPJMESA-N 399.947 5.370 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)CC1CCC1 521809284 YTJAGQILLRHNQI-SFHVURJKSA-N 393.556 5.915 30 20 GKED Cc1cc([N+](=O)[O-])ccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 522487801 KWJWPBCFAAAERL-MRXNPFEDSA-N 397.843 5.170 30 20 GKED CSc1ccc(O[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 524822651 RNQCADZQTKQVAC-CYBMUJFWSA-N 386.542 5.017 30 20 GKED CSc1ccc(C)c(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 538344833 GNNHNQXRPSJLBR-UHFFFAOYSA-N 378.453 5.013 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CNc2cccc(C(F)F)c2Cl)c1C 543656648 GYOOXBIRRMAFHU-UHFFFAOYSA-N 391.849 5.253 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2ccccc2Oc2ncccc2C#N)s1 545343256 VGQKPTGLEMSXEI-UHFFFAOYSA-N 390.390 5.141 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ncc(Br)cc1F 550826387 DOAKKQWYWWPMOG-CXAGYDPISA-N 376.273 5.069 30 20 GKED C=CCC[C@@H](NCc1nc2cc(F)ccc2o1)c1ccc(C(F)(F)F)cc1 557572096 XYJCDXFSCMUGPH-MRXNPFEDSA-N 378.369 5.783 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc(Cl)c1Br 560228013 CHZRNFSTLYDVKI-LLVKDONJSA-N 389.636 5.042 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3C[C@H]3c3cccc(Cl)c3)cc2)ccn1 583175138 LCMMMOYUXKRLQB-SFTDATJTSA-N 389.842 5.141 30 20 GKED C[C@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1cccc(C#N)c1 586791011 RQRNKNIOGHYNED-KRWDZBQOSA-N 377.447 5.264 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1cccc(C#N)c1 588151026 SGSVPGAJEXYDLY-CQSZACIVSA-N 385.870 5.034 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(OC(C)C)c(OC)c2)cc1Cl 589639971 PWAGYZZXUCIJIT-MRXNPFEDSA-N 389.923 5.551 30 20 GKED CCOc1ccc(NC(=O)c2sc3ccc(C#N)cc3c2C)cc1OCC 589981624 YHNWIJHBLXRUSN-UHFFFAOYSA-N 380.469 5.131 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2)cn1 604005469 RXHMWJBWJHSTMH-JOCHJYFZSA-N 393.446 5.007 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 606938581 KELPVIRIBVOBNA-UHFFFAOYSA-N 397.441 5.264 30 20 GKED CCc1c(C)sc(NC(=O)CSc2cccc(C(F)(F)F)c2)c1C#N 609032785 HCONPNNFYOBJEY-UHFFFAOYSA-N 384.448 5.240 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2cccc(C)c2o1 609060429 DWWGEEKAXSSFJJ-UHFFFAOYSA-N 396.446 5.753 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1csc(-c2ccccc2Cl)n1 609188801 ZIOPJODQKVVTLJ-UHFFFAOYSA-N 375.925 5.256 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCOc1ccc2ccccc2c1 609427651 XJVKOQRUFYXSGZ-KRWDZBQOSA-N 390.508 5.642 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N[C@@H](c3cccs3)C3CC3)c2)c1 609641262 GDQLIUCEQKTDMO-JOCHJYFZSA-N 388.492 5.080 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 609695014 SNODNRVHDLYJPG-INIZCTEOSA-N 375.497 5.046 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCC(c4ccc(O)cc4)CC3)c2)cc1 610011337 WTJXSPVQUMNIBS-UHFFFAOYSA-N 397.478 5.027 30 20 GKED CCOc1ccc(Oc2cc(CN[C@@H]3CCCc4cc(C#N)ccc43)ccn2)cc1 611390989 LUFBEMIYNPEZPH-XMMPIXPASA-N 399.494 5.311 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 612536018 BCEMHALHHOHJEL-INIZCTEOSA-N 383.211 5.104 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@@H](Sc1ccccc1)c1ccccc1 618789810 PXLLOPTZWAJFDM-GOTSBHOMSA-N 384.504 5.195 30 20 GKED C[C@H](NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccsc1 619787399 KXPNVTRASVKNRP-INIZCTEOSA-N 391.496 5.276 30 20 GKED C=CCOc1c(Cl)cc(CN[C@@H](C)c2ccc3ncsc3c2)cc1OC 623496180 LABSPARKZDASKA-ZDUSSCGKSA-N 388.920 5.374 30 20 GKED CN(C)c1ccncc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647229879 VQZXOPCCODWRSZ-UHFFFAOYSA-N 395.322 5.049 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccccc2CC)n1 661117106 OIIRTASGZKUOJR-FPOVZHCZSA-N 397.588 5.615 30 20 GKED Cc1ccc(OCc2nc(C=NNc3ccc(OC(F)F)cc3)cs2)cc1 726427459 YMDFYOWWBVIEIF-UHFFFAOYSA-N 389.427 5.078 30 20 GKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1cccc(N2CCOC2=O)c1 727266846 HXNKEXYWLFCYHU-ALCCZGGFSA-N 395.764 5.212 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1 730215454 GYDBHQDOAQRIPI-UHFFFAOYSA-N 396.434 5.326 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(Oc3ccncc3)c2)cc1Cl 732623717 KLJSUPQVDJONOC-UHFFFAOYSA-N 380.860 5.208 30 20 GKED Cc1ccc(Cc2sc(NC(=O)c3ccccc3SCC#N)nc2C)cc1 734423320 MFLMIWAKGSUKKV-UHFFFAOYSA-N 393.537 5.219 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1)c1ccncc1 734660757 AGQCNEDJLLBKRU-CVDCTZTESA-N 385.511 5.219 30 20 GKED CC(CCc1ccccc1[N+](=O)[O-])=NNc1ncc(C(F)(F)F)cc1Cl 741452048 VNNMUMVWHHZLHH-UHFFFAOYSA-N 386.761 5.083 30 20 GKED C=CCN(C(=O)N[C@@H](c1cc(F)ccc1F)c1ccccc1Cl)C(C)C 745876476 OSLRISDQZNQHAB-LJQANCHMSA-N 378.850 5.314 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](CC(C)C)c1ccccc1OCC)c1ccncc1 746419905 ACTANPFPRISHJD-NHCUHLMSSA-N 381.520 5.184 30 20 GKED O=C1/C(=C\c2cn(-c3ccccc3)nc2-c2ccncc2)CCc2ccccc21 747003719 MRZVSTWHLRDCEO-SILNSSARSA-N 377.447 5.147 30 20 GKED COc1c(Cl)cc(N=Cc2cc(Cl)cc([N+](=O)[O-])c2O)cc1Cl 750949029 BUXIMPVCFCMQBF-UHFFFAOYSA-N 375.595 5.020 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nccs1 752485697 PRRIBHAOFDXMBH-JXFKEZNVSA-N 390.512 5.066 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 752521049 KLVSHKDUQHOWFJ-SUMWQHHRSA-N 398.359 5.130 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(F)c(Br)c1 753143683 XWABVSHQXZZQDV-ALCCZGGFSA-N 389.249 5.003 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3c(Cl)oc4ccccc34)cc2N1 758027974 YHVCWEPJSBTCCF-WAYWQWQTSA-N 375.858 5.088 30 20 GKED Cc1nc(C(F)(F)F)c(CSCc2cc(Cl)ccc2OCC#N)s1 759026945 KGBFLRADGNDQNW-UHFFFAOYSA-N 392.855 5.460 30 20 GKED Cc1ccc(C)c(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 760049294 VDMRCACUAKVUCW-XMMPIXPASA-N 383.495 5.623 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2cc(C(F)F)ccc2Cl)cc1OC 768901452 XZLUAWLYCWWLLU-WEVVVXLNSA-N 393.817 5.503 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Br)c(F)c2)c1 772985277 WADOJDAOIHKTKQ-BBRMVZONSA-N 391.284 5.120 30 20 GKED C[C@@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 776515104 HDUNWRRLQMFIIE-UHIISALHSA-N 379.312 5.729 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)C(=O)c1ccc(Cl)cc1 777295717 QAYHSOYBXHESIW-SWLSCSKDSA-N 382.872 5.035 30 20 GKED Cc1cnc(Cl)c(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1 787984271 FBNVLBZNTRQUHM-UHFFFAOYSA-N 379.872 5.319 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(CC[C@@H](O)c2ccccc2)cc1)c1ccccc1 793629816 SEFQBSLHLBQUCR-UKILVPOCSA-N 398.506 5.379 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(OC(F)(F)F)cc2)S1 797060573 CENIZSPAFNRFNR-GDNBJRDFSA-N 392.402 5.094 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C2(CCOCc3ccccc3)CC2)s1 797572262 WPDTZSPMWOBFGK-QGZVFWFLSA-N 382.529 5.004 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 798813937 BLRHZUYTJNGHOD-PXAZEXFGSA-N 398.384 5.190 30 20 GKED CCOC(=O)Oc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 799906500 ULAVZEKHIRWEIR-UHFFFAOYSA-N 392.436 5.074 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc[nH]1)c1nc(-c2ccc(Cl)cc2Cl)cs1 802044036 BLEFKKWFYNZSAX-YVARQFDVSA-N 388.279 5.335 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)ccc12 808240103 QXYXSUXFXOBJAD-JOCHJYFZSA-N 393.446 5.157 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNc1ccccc1F 812460493 QGVWVEGVBGMVDO-UHFFFAOYSA-N 377.250 5.132 30 20 GKED COc1ccc(CN[C@@H](CCCC#N)c2ccccc2)cc1SC(F)(F)F 814659666 OKAUGKFUBXASAI-KRWDZBQOSA-N 394.462 5.832 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@H]([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1 814673924 LYSYJYSSLFMYDU-VQTJNVASSA-N 391.600 5.066 30 20 GKED COc1cc(C(=O)Nc2sccc2C#N)ccc1OCc1ccc(Cl)cc1 908151051 IWBVEOJLNGYAOI-UHFFFAOYSA-N 398.871 5.113 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(-n3cccc3)c2)cc1 915085700 AKJCUGSVQYJVDM-XMMPIXPASA-N 377.447 5.385 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)nn1-c1ccccc1 915861769 GDXZHLBNMCWHKM-HSZRJFAPSA-N 392.462 5.089 30 20 GKED O=C(Nc1cccc(/C=C\C(=O)c2ccccc2F)c1)c1ccc(Cl)cc1 916136370 LCGNKZWICDOIHW-JYRVWZFOSA-N 379.818 5.628 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)c(C)s1 916155812 DCLBXQQFQUTOCB-KHPPLWFESA-N 395.911 6.167 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916679243 KQBBJWWBTZZECH-DEOSSOPVSA-N 383.495 5.439 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Cl)cc1)C(=O)Nc1cc(Cl)cc(Cl)c1 916942546 LSVRKWGTGNRJBW-QQNRWZHASA-N 393.657 5.008 30 20 GKED N#C[C@@H](C(=O)CSc1ccccc1Cl)c1nc2cc(Cl)ccc2s1 917045440 ZWOHOPVWUGQCNX-NSHDSACASA-N 393.320 5.572 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccs1)c1nc2cc(C(F)(F)F)ccc2s1 917045658 ZHPVSMVESFAIQX-QMAVJUDZSA-N 378.400 5.266 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3ccc(-c4ccccc4)cc3)s2)c1 1776059788 KJEAMUVMSOUTKU-UHFFFAOYSA-N 398.487 6.226 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(OCc3ccccc3C(=O)O)c2)c(C)s1 1776133527 YYTRJUARJLSDGL-ZHACJKMWSA-N 392.476 5.538 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1776200113 UFLSWAFCVXOSAR-YZNGDSSZSA-N 384.378 5.073 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(F)ccc1N(C)CCCCC 1776782928 NPZPLRZGJPYSJC-OAQYLSRUSA-N 394.575 5.746 30 20 GKED CCCCCCCOc1ccc(CNCc2cc(C(=O)O)c3n2CCCC3)cc1 1776786972 HATKQMJEMSYVPA-UHFFFAOYSA-N 398.547 5.162 30 20 GKED CCn1c2ccccc2c2cc(/C=C3/C[C@@H](C(=O)O)c4ccccc4C3=O)ccc21 1777002911 PGHNLHHGVMWKTC-DAKPFUFHSA-N 395.458 5.653 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@H](C)c3ccc(Cl)cc3)cc2)CCC1 1785988817 QDGASCBDPIDDLJ-MRXNPFEDSA-N 396.918 5.154 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2ccc(Cl)c(Cl)c2)S1 7165042 BTBUVZMMVFXMBW-OQLLNIDSSA-N 377.296 5.502 30 20 GKED Cc1nc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)sc1C 43003464 IULMKFBEBWRWCJ-UHFFFAOYSA-N 379.510 5.176 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccc(C)cc2C)cs1 54897284 JKUMSHYQXIHEJF-XFFZJAGNSA-N 394.471 5.480 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)NC(C)(C)C)[n+]2ccc(C(C)(C)C)cc2)cc1C 55014871 VGNWGMKJLPWJKJ-UHFFFAOYSA-O 397.608 5.215 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2nc(C3CC3)sc2c1 58454210 AUEKGRCQWWVTAY-UHFFFAOYSA-N 390.512 5.489 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCCCc1nc2ccccc2s1 62903798 PONLYMIFTBAWJX-UHFFFAOYSA-N 389.524 5.096 30 20 GKED C[C@H](SCc1cccc(Cl)c1)C(=O)N(CCC#N)c1ccc(F)cc1 63128727 QQFPSXKJXRLSNL-AWEZNQCLSA-N 376.884 5.048 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(-c3cccs3)on2)cc1 65680307 KJXFFLOJTGFVPG-UHFFFAOYSA-N 387.420 5.319 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(N2CCCCCC2)nc1 66800151 NWFNPZKNFUXQCO-QGZVFWFLSA-N 394.544 5.109 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 66956225 MOUMVRDVEAVWDK-ZWKOTPCHSA-N 393.556 5.913 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)c2cccnc12 108237444 XJNICJRQGYHCQS-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC(F)F)c1nc2cc(Cl)ccc2s1 120013567 MYVHOYXXCZBWDJ-NSHDSACASA-N 378.787 5.041 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccccc1 153280631 CETYRJPTPVFUMK-LJQANCHMSA-N 382.554 5.330 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3noc(C4CCCCC4)n3)o2)cc1 160077696 MJJGYVUIEYTDGV-UHFFFAOYSA-N 398.488 5.024 30 20 GKED N#CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccccc1 172234021 QGACJMHQJOBJAE-UHFFFAOYSA-N 387.826 5.174 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)c1cccs1 180033609 ADBHHWAPQXCAMC-APWZRJJASA-N 391.496 5.144 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 185322214 AOCXERYBCGPDTR-QFBILLFUSA-N 379.529 5.307 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1cccc(C#N)c1 190879308 IXRRZEZCFZLLJE-HZPDHXFCSA-N 395.553 5.243 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 192217319 HFTOFWMAEWRONE-XJKSGUPXSA-N 399.482 5.523 30 20 GKED N#CCCn1cc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c(-c2ccccc2)n1 237754095 AHJPVQRMVSVXTE-JOCHJYFZSA-N 390.918 5.358 30 20 GKED COc1cc(C=NO[C@@H](C)c2ncc(-c3ccccc3)o2)ccc1OC(F)F 255755729 NNQMKVLPJOJBTC-ZDUSSCGKSA-N 388.370 5.063 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303639554 AVJCKDCYCHDABS-SECBINFHSA-N 379.266 5.583 30 20 GKED O=C1CCC(/C(O)=N/[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)CC1 329753835 KIXQPFVLDOURLH-KRWDZBQOSA-N 389.293 5.024 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ncc(C(=O)OC)s1)c1ccc(C(F)(F)F)cc1 414101883 MIFRRXFDBMOWNO-SWLSCSKDSA-N 398.450 5.307 30 20 GKED CC1(C)CCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 429042284 DKPIXHQTBQXTSG-NRFANRHFSA-N 377.488 5.032 30 20 GKED Cc1c(C(=O)Nc2ccccc2OC(F)(F)F)sc2ccc(C#N)cc12 429920872 UPESOIQTHPBNGL-UHFFFAOYSA-N 376.359 5.232 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2C(=O)c2ccccc2)s1 430610575 LBUXUORGRAUHHC-GOSISDBHSA-N 388.492 5.162 30 20 GKED Fc1cc(C(F)(F)F)cc(C2(CNCc3ncc(C(F)(F)F)s3)CC2)c1 433334301 HBBKGYZEYFLVAO-UHFFFAOYSA-N 398.347 5.141 30 20 GKED Cc1csc(Sc2ccc(NC(=O)C3(c4cccc(C#N)c4)CC3)cc2)n1 435069585 ZLOVBSHEISMJTM-UHFFFAOYSA-N 391.521 5.145 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cc(C#N)oc3C)cc2Cl)n1 435702021 WQXSFYBIGVFZEK-UHFFFAOYSA-N 389.889 5.282 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 438643057 SNXLUDSROLKDSB-ILXRZTDVSA-N 399.482 5.571 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CC(C)(C)CC(=O)c1ccccc1 442729659 BENUNXPYJIQCJH-KRWDZBQOSA-N 394.540 5.709 30 20 GKED C[C@@H](NCc1ncc(C(C)(C)C)s1)c1ccc(-c2cccc(C#N)c2)cc1 447898003 QUNZCRHZPZTSJE-MRXNPFEDSA-N 375.541 5.830 30 20 GKED N#CCCC[C@H](NC(=O)NC1(c2ccc(F)cc2F)CCC1)c1ccccc1 458797087 FZTXBGYUEQRNMS-FQEVSTJZSA-N 383.442 5.078 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1)c1cccc(C#N)c1 463572265 ABQIBFWVPOZHRY-AWEZNQCLSA-N 393.849 5.776 30 20 GKED COc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)ccc1OC(C)C 464231457 QSUJZFIDTNQMPP-UHFFFAOYSA-N 386.451 5.273 30 20 GKED CCN(C(=O)c1cc(-c2cccc(C#N)c2)no1)[C@@H](C)c1cc2ccccc2o1 469020422 PYAYBMKEXIFUNC-HNNXBMFYSA-N 385.423 5.183 30 20 GKED C=C[C@](C)(CC)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 470396497 FKUBKJSYTPTQKL-OPAMFIHVSA-N 384.545 5.127 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc2nc(C)n(C)c2c1 475186449 YWWOQOKVUZJTNG-UHFFFAOYSA-N 396.450 5.106 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 476376908 JNZLCFQFSLITGE-QHCPKHFHSA-N 395.506 5.327 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2ccc(-c3cnco3)cc2)cc1 487560460 AXFBWCKKMRCUHS-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CSC[C@@H]1CCCN(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1 489998452 PXAYBLONUCZLPF-PKOBYXMFSA-N 393.556 5.071 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(C#N)cc3Cl)cc2)cs1 494593713 ZHWSZARSYLRTLW-UHFFFAOYSA-N 399.928 5.521 30 20 GKED N#C[C@H](NC(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccccc1Cl 499924526 UFBITTHLLPXSEN-KRWDZBQOSA-N 381.690 5.351 30 20 GKED CC(C)CN(C(=O)NCC1CCC(C#N)CC1)[C@@H](C)c1ccccc1Cl 503922715 YDBDMRJFOSOQPO-AOCRQIFASA-N 375.944 5.399 30 20 GKED C=CCCc1ccccc1NC(=O)NC(C)(C)c1nc(C(F)(F)F)cs1 505035637 OGUQJQFMXDEAJP-UHFFFAOYSA-N 383.439 5.337 30 20 GKED Cc1oc(C2CC2)nc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 506480422 JJNWYZOMVMIGDM-SFHVURJKSA-N 391.858 5.422 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 509846261 NJWOAXGVRFQXCK-UHFFFAOYSA-N 379.419 5.034 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(-c2ccccc2)o1 520197495 FFAQPZKJTSJUOA-MRXNPFEDSA-N 391.496 5.663 30 20 GKED N#C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1 521016257 VNGFOOUDKHMMQS-HNNXBMFYSA-N 385.703 5.120 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccc(Cl)cc2)C2CCCC2)c1 521829517 GNYMYCOGICARFK-QHCPKHFHSA-N 382.935 6.044 30 20 GKED Cc1cc(Br)ccc1NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 522840534 PQCZPOILDUOVQW-ZDUSSCGKSA-N 389.318 5.062 30 20 GKED Cc1ccc(CN(C(=O)NCc2ccc(C#N)cc2)[C@@H]2CCc3ccccc32)cc1 523003051 GAAJFJJVXRRWSA-RUZDIDTESA-N 395.506 5.266 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(COc2cccc(C#N)c2)c1 524512513 WXPDLHCNQRNNCY-YADARESESA-N 396.490 5.155 30 20 GKED N#Cc1cccc(-c2nnc(COc3cc(Cl)c(Cl)cc3Cl)o2)c1 525623584 NCSMKWDNTRCQTE-UHFFFAOYSA-N 380.618 5.147 30 20 GKED N#CCc1ccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)cc1 544096824 PARRZNNAAQBVIC-JOCHJYFZSA-N 391.312 5.394 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Br)c2Cl)cc1 549330062 ZCTYSOBWNPNQDO-UHFFFAOYSA-N 377.669 5.156 30 20 GKED Cc1ccc(OCc2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)cc1 552082873 HJUOBQUTDSTRTM-QFIPXVFZSA-N 391.540 5.555 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(Cl)cc1-c1cccc(Cl)c1 556810608 YCRXLJWDWLHLBV-UHFFFAOYSA-N 382.250 5.488 30 20 GKED C[C@](C#N)(NC(=O)c1ccc(-c2nc3ccccc3s2)o1)C1CCCCC1 557898737 DUBVESLQMUEOIX-OAQYLSRUSA-N 379.485 5.149 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1Cl)c1cccc(Cl)c1Cl 561290243 BOLZFHMOTCCYHM-ZENOOKHLSA-N 379.674 5.131 30 20 GKED C[C@H](N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccc(C#N)c1 569462243 KNSCLTGZYOGUSV-YCRPNKLZSA-N 388.433 5.396 30 20 GKED CC[C@H](NCc1cc(Br)ccc1OC(F)F)c1ccc(C#N)cc1 569660842 BPKZTPIJXCTMPE-INIZCTEOSA-N 395.247 5.163 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CSc2ccccc21 573062503 XWHDHPPBIDQAAE-LSDHHAIUSA-N 383.542 5.092 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2csc(C(F)(F)F)n2)n1 575094058 MTQNQYGLSMOJHN-SECBINFHSA-N 397.275 5.290 30 20 GKED Cc1ccc(-c2nc(COc3c(Br)cccc3CC#N)cs2)o1 577921129 SCEFEAROXBCKMQ-UHFFFAOYSA-N 389.274 5.119 30 20 GKED COc1cc(CN[C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)ccc1C#N 583964448 LWFPCWHIBJKGBI-CYBMUJFWSA-N 397.931 5.503 30 20 GKED N#CCCCCCC(=O)Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 588157303 CKNLGQDOTIKOHX-QFIPXVFZSA-N 389.499 5.076 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)CSc1ccccc1 593159017 HHFHVFJGAQPNRC-IAGOWNOFSA-N 399.585 5.583 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1[C@@H]2Cc3c(Cl)cccc3[C@@H]21 599736846 IPAWKXLEOAIFGS-HHLQROKJSA-N 397.931 5.052 30 20 GKED C=CCOc1ccccc1CNCc1c(C)nn(Cc2ccccc2Cl)c1C 600809492 HIJHNOKIRMKXGB-UHFFFAOYSA-N 395.934 5.056 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N[C@@H](c1ccccc1)C(F)(F)F 604621480 BMKWQYLMGFFPKD-ZDUSSCGKSA-N 380.263 5.270 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NC[C@H]3CCOc4ccccc43)cc2)cc1 609422401 QXTUOLKGRCUMQQ-GOSISDBHSA-N 399.450 5.038 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(OCc2ccccc2C#N)cc1 609647420 NAFLIKFXJSJVJU-YADARESESA-N 396.490 5.155 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(Cl)c2ncccc12 610628361 DUGUTJJBTIYLDU-XLIONFOSSA-N 390.874 5.192 30 20 GKED Cc1nc(-c2ccc(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)cc2)oc1C 611247885 XNOZZWNJVQMTIJ-UHFFFAOYSA-N 398.466 5.151 30 20 GKED C[C@@H](N[C@H](C)c1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 616354015 MZVLRIZWMIYJRZ-VXGBXAGGSA-N 397.238 5.751 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(Oc3ccc(C(C)C)cc3)CC2)c1 619350963 ASADEQDSSJWKJA-UHFFFAOYSA-N 394.515 5.450 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622853800 OBSRPJVZMQXSSE-SECBINFHSA-N 377.275 5.192 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCN3CCC[C@H]3C2)cc1)C(F)(F)F 647229883 XFRBFFAVEFJXCM-KBPBESRZSA-N 384.339 5.015 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)sc2C)cc1 647374970 PGKMNKDXEHDDCP-KRWDZBQOSA-N 394.521 5.556 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ccc(OC)cn2)CC1 650154627 NXPCDIVPKAIMDD-UHFFFAOYSA-N 393.531 5.354 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccc2ccccc2n1 674407904 NGQTVALVOSANDU-LJQANCHMSA-N 381.410 5.290 30 20 GKED C[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 726441385 NCOBFMZJWLHRFJ-JTQLQIEISA-N 383.826 5.278 30 20 GKED N#Cc1ccc(NC(=S)NC2c3ccccc3-c3ccccc32)cc1Cl 726444673 YQEDPBWBWLLHCB-UHFFFAOYSA-N 375.884 5.268 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(NC(=O)Nc3ccccc3)cc2)c1 726462713 QPAAXWNGUYNUCO-UHFFFAOYSA-N 386.480 5.121 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCOc2ccccc2-c2ccccc2)cc1 726940782 RWEBFNRFGDWTRR-UHFFFAOYSA-N 384.479 5.378 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1sc(-c2ccc(Cl)cc2)nc1C 727651361 VRVUBIIEGKDEKD-UHFFFAOYSA-N 399.907 5.591 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)cn1 728865352 HMJATIVEFJBZPS-HNNXBMFYSA-N 375.859 5.142 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(-c3ccccc3)cc2)c2ncc[nH]2)c1 729240498 PIWLSSKBEOCGTF-XQNSMLJCSA-N 380.447 5.509 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)C(=O)Nc3ccc(Cl)cc3)o2)cc1 744025408 LCRAYQJFOYKDOF-GOSISDBHSA-N 392.842 5.124 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c(OC(F)F)c1 745989969 IHWYYUBUUMWKPH-VQHVLOKHSA-N 381.378 5.255 30 20 GKED Cc1c(C(=O)/C=C/c2cc3ccccc3nc2N2CCOCC2)oc2ccccc12 747138436 DIJLSGYDICTKIK-ZHACJKMWSA-N 398.462 5.022 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1 747210902 PCKDXHWGSLLCBY-IBGZPJMESA-N 396.475 5.113 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 749341950 GFWWBMNTVVDEEO-KXGXAOLJSA-N 397.334 5.255 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)N(CC)[C@@H](CC)c2ccccc2)cc1C#N 752302878 MOGOCUJFKOESJD-FQEVSTJZSA-N 394.475 5.132 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)nc1Cl 753001495 MAGDLXLKZHKZMK-UHFFFAOYSA-N 390.855 5.136 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)COc2c1ccc(Cl)c2Cl 753145157 SPEKLJGOSMBKGI-YRNVUSSQSA-N 389.263 5.171 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1 756234538 VRPHPHGRPPHNIL-SUMWQHHRSA-N 398.890 5.132 30 20 GKED C=CCc1cc(OCC)cc(CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1O 758257820 HLPBOCWNFQOOFB-GGAORHGYSA-N 399.506 5.011 30 20 GKED C#CC[C@H](N[C@@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1)c1ccccc1 773103564 AQPIPTIMZDKIOF-ZEYPLWLESA-N 381.491 5.189 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3cn(C)c4ccccc34)n2)cc1 773983592 ZALWSPUDPSOPTL-LPHOPBHVSA-N 399.519 5.590 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Cl)c(Cl)cc2O)c1 774246455 ZTROVPWSRPFBEO-JSGCOSHPSA-N 379.287 5.231 30 20 GKED O[C@@H](CN[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1 775191981 NPQROLLAIBWIBX-HOTGVXAUSA-N 395.318 5.161 30 20 GKED Cc1cc(CN(C(=O)Cc2ccccc2CC#N)C2CCCC2)c2ccccc2n1 777392437 KFCCHPKJXWXPKS-UHFFFAOYSA-N 397.522 5.123 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H]2CC=C(c3ccc(F)cc3)CC2)ccc1OC 779408848 DADUBGHDCXFNRK-VXKWHMMOSA-N 394.490 5.241 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NS(=O)(=O)c2cccc(C(F)F)c2)cc1 780376235 DSXPEIOQXOIFBF-HXUWFJFHSA-N 398.434 5.080 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=Cc1sccc1Cl 782142373 HRPZWCZCVVCCHO-UHFFFAOYSA-N 389.720 5.138 30 20 GKED COc1ccc(CNc2cc(F)c(OC(C)C)c(F)c2)cc1OCCCC#N 784616509 MCCQGQPYZNBBFP-UHFFFAOYSA-N 390.430 5.055 30 20 GKED C=CCOc1cccc(NC(=O)CCc2ccccc2NC(=O)OC(C)(C)C)c1 790543702 XGVZVZCKAGWUMH-UHFFFAOYSA-N 396.487 5.170 30 20 GKED N#CC[C@H](CC(=O)N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 793830749 NWNIVZCWZYTEJZ-RTBURBONSA-N 386.417 5.109 30 20 GKED CC(C)(C)OCCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 796811128 LCUYHZTZZARVIU-GFCCVEGCSA-N 384.423 5.087 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NN[C@@H](C)COc1ccccc1 811667631 ZNGOCTZWWCGPMF-KRWDZBQOSA-N 396.922 5.040 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CC3(C2)CC3(F)F)cc1Cl 822144201 CLMOIYBLAXZVLS-GBXVCHKXSA-N 386.829 5.369 30 20 GKED C[C@]1(C=Nn2cnnc2SCc2ccc(Cl)cc2)C[C@@H]1c1ccccc1 841614717 QDTCLIVCRZEGBD-UYAOXDASSA-N 382.920 5.252 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cnc(Cl)c(C(F)(F)F)c1)c1ccccc1 841796862 QKWOBALSOFBPIR-OAHLLOKOSA-N 396.800 5.310 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942172 NOOPFDLYVZXRCJ-IAQYHMDHSA-N 378.419 5.094 30 20 GKED C=CCc1cc(CNc2ccc(N(C)C(=O)OC(C)(C)C)cc2)cc(OC)c1O 858248133 SXAWBPAWORHWCZ-UHFFFAOYSA-N 398.503 5.113 30 20 GKED Cc1ccc(Cl)c(OCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 915101494 CQEAQYOPBGLSPP-HNNXBMFYSA-N 382.872 5.027 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3cc4ccccc4c(Cl)n3)c2C#N)C1 915133613 RNKQETAISLWYNH-LLVKDONJSA-N 381.888 5.198 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 916849506 WULNHPNENUEYLH-PXDATVDWSA-N 394.499 5.945 30 20 GKED COc1cc(C=NOCc2csc(Cc3ccccc3)n2)ccc1OC(C)C 918733334 OWUZTQIOTCBUKZ-UHFFFAOYSA-N 396.512 5.080 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(Cc2ccc(C)s2)C(C)C)cc1OC 920028517 XKJASIBDDSUYTI-XFXZXTDPSA-N 385.529 5.080 30 20 GKED O=C(O)c1cc(NN=C2CCCCC[C@@H]2c2ccc(Cl)cc2)ccc1Cl 1776033886 UAECXWCKXLJJSZ-MRXNPFEDSA-N 391.298 6.207 30 20 GKED O=C(O)c1cc2cc(/C=C\C(=O)c3ccccc3OCc3ccccc3)ccc2o1 1776126130 CUCHKKASYRZWEQ-BENRWUELSA-N 398.414 5.606 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2ncc(C(=O)O)c(C(C)C)n2)cc1 1776785428 AAETYSPJBNMENM-NTCAYCPXSA-N 396.531 6.208 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](Cc2ccccc2C)C(=O)O)c1 1776788668 KQAFGAUGDPACNB-HSZRJFAPSA-N 397.559 5.377 30 20 GKED Cc1sc(NC(=O)c2cc(-c3ccccc3)nc3onc(C)c23)c(C#N)c1C 22314570 OIIDENZBRADLHV-UHFFFAOYSA-N 388.452 5.001 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@@H](Sc2ccccc2)c2ccccc2)cc1 25438470 JXVZTJRZFPGWPB-QFIPXVFZSA-N 386.520 5.960 30 20 GKED C[C@H](S[C@@H](C)c1ccc(Cl)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 62698122 ZEIAFVLUGKPDLH-GJZGRUSLSA-N 390.911 5.609 30 20 GKED CCN(C(=O)CSCc1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 65702462 VIEJVFHNCFXBDW-INIZCTEOSA-N 378.497 5.147 30 20 GKED Cc1ccc(NC(=O)[C@@H](Sc2cc(C#N)ccn2)c2ccccc2)cc1Cl 71918279 JSNKWWXUGJFIEZ-FQEVSTJZSA-N 393.899 5.387 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1OCC(C)C 108998772 OHMRSCJCJUIYDL-INIZCTEOSA-N 398.528 5.377 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCc2ccccc2C1 114580465 UYOVFAKCFVNQJD-QFBILLFUSA-N 379.529 5.102 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2nccs2)CCCC1 116500593 DPOYESYHHNOWFP-AWEZNQCLSA-N 386.546 5.128 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H]2CCC[C@H]21 120346597 NFDUXUBKYYGBMA-NZQKXSOJSA-N 389.499 5.242 30 20 GKED C=C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 136643700 UVQATGBOKNDYKC-XJKSGUPXSA-N 387.266 5.001 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(OCC(F)(F)F)cc1 172907423 HPRQMNMHTXYVNQ-CQSZACIVSA-N 380.435 5.634 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C 173122698 JPJGLQBGCOSUBN-LAUBAEHRSA-N 393.556 6.067 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(O[C@H](C)C#N)cc2)cc1 174649448 DHCODQFQPHYRSV-SJORKVTESA-N 395.503 5.175 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cc2)cc1 182876767 IUGUFSFPWYEABX-HXUWFJFHSA-N 396.402 5.313 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 185219470 MTFVZHYOGDEZCL-HXOBKFHXSA-N 398.466 5.361 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C#N)cc3C)s2)cc1 186329918 MGUWCRWOQFZKOC-HNNXBMFYSA-N 377.513 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc(-n2cncn2)cc1 191415412 RASKTPIICGXHEQ-QGZVFWFLSA-N 389.503 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C(=O)N[C@H](C)CCC)C1 191458811 IQRQBLMHVJKEEL-UYAOXDASSA-N 399.579 5.087 30 20 GKED Cc1c(NC(=O)c2ccccc2Oc2ccccc2C#N)cnn1C1CCCC1 192983362 RNQYWTPMNIUPKS-UHFFFAOYSA-N 386.455 5.223 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 193044992 XWDONDNDVONKEO-AWEZNQCLSA-N 378.501 5.322 30 20 GKED N#CCCn1cc(CNCCc2csc3ccccc23)c(-c2ccccc2)n1 237830246 LAGFSFRNQKVGNB-UHFFFAOYSA-N 386.524 5.011 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@H](C)C#N 303281859 KIFLDYLQCXRBAF-KGLIPLIRSA-N 390.961 5.711 30 20 GKED CC(C)[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1nc(-c2cccnc2)no1 329012489 OZDNJXPSGVQICB-KANFNMMFSA-N 382.508 5.392 30 20 GKED Cc1cc(F)cc2c(N3CCC(/N=C(/O)CC4CCCC4)CC3)c(C#N)cnc12 330193556 YQFGSSOLSNFBGQ-UHFFFAOYSA-N 394.494 5.060 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/Cc1ccc(Cl)cc1Cl 330231168 DWIWUXJUXDWMJH-GFCCVEGCSA-N 385.316 5.157 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@H](C)C3)s1 411007471 GLYTUEDPRVRFOD-QJPTWQEYSA-N 389.546 5.112 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@@H](C)C3)s1 411021912 XEZCTVSQYWFYIX-CKYFFXLPSA-N 389.546 5.030 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(Br)c(F)cc2F)c(C#N)s1 428777817 HDXOYVDSZNWYSH-UHFFFAOYSA-N 399.260 5.210 30 20 GKED Cc1nc(NC(=O)c2cccc(SCC#N)c2)sc1Cc1ccccc1F 429879422 YOPPTHSASOSCIM-UHFFFAOYSA-N 397.500 5.049 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccccc1 432962139 QMFCFTTZVCOIGJ-SFHVURJKSA-N 386.377 5.134 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1 434223607 VXBFZVKFAWOXEK-HKUYNNGSSA-N 393.556 5.596 30 20 GKED COc1ccc([C@H](C)CCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 438080849 QNQXGNAOPCRUAI-DLBZAZTESA-N 397.544 5.262 30 20 GKED CSCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438669162 HUIPZKSEQNWWAE-CQSZACIVSA-N 387.480 5.095 30 20 GKED C=CCN(C(=O)c1cccc(F)c1OCC)c1nc(-c2ccccc2)cs1 443819310 XWGIWVKHNQMHCL-UHFFFAOYSA-N 382.460 5.181 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2cn(CCCC#N)c3ccccc23)s1 444224653 UUYDANRBXUOFCA-HXUWFJFHSA-N 377.513 5.292 30 20 GKED CC[C@H](NCc1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc(C#N)cc1 447538833 DLBSXHYOJXASAK-QHCPKHFHSA-N 387.458 5.191 30 20 GKED Cc1ccc(CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C2CC2)cc1C 458800613 LKSYCQBOEQOPBI-QHCPKHFHSA-N 375.516 5.413 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1sc(-c2cccs2)nc1C 461671753 HFXNBEBWILRDLI-UHFFFAOYSA-N 382.514 5.126 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(Cl)c2ccccc12 463258686 RFPQCCICDVPMQN-HNNXBMFYSA-N 377.875 5.267 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)Nc1cccc(C#Cc2ccccn2)c1 474590437 VGEFMXBBHNAHIG-UHFFFAOYSA-N 393.446 5.006 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1 476162927 RLAZJBKZBMAKDE-JOCHJYFZSA-N 376.544 5.389 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc2ccccc2c1 476778669 XCMWCSQGWYJLKP-UHFFFAOYSA-N 385.507 6.293 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c[nH]c2cccc(Br)c12 476806506 RQCLQQPTDNVKIX-UHFFFAOYSA-N 397.316 6.035 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](c3ccccc3)C2)cc1 477366926 UZWCKMUHZLLQLG-FQEVSTJZSA-N 383.451 5.372 30 20 GKED N#Cc1ccc(NC(=O)N2CCC([C@H](F)c3ccccc3F)CC2)c(Cl)c1 478071789 OLPFKPQKXCOUQQ-IBGZPJMESA-N 389.833 5.305 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nnc(Cc2c(F)cccc2Cl)o1 479210719 OVMIQFLECLENJL-UHFFFAOYSA-N 394.258 5.270 30 20 GKED C[C@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccc(C#N)cc1F 480661592 KOQACMBIHRYQEW-ZDUSSCGKSA-N 377.444 5.418 30 20 GKED N#Cc1cc(Cl)ccc1CN1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 480893266 CSGYZCIVPSGTTN-GFCCVEGCSA-N 385.842 5.067 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cn(CC(C)C)nc1C(F)F)c1ccc(F)c(F)c1 481082594 NSMQYJJRTHRQAL-INIZCTEOSA-N 398.404 5.194 30 20 GKED N#C[C@H](C(=O)c1cnc2ccccc2c1C(F)(F)F)c1nccc2ccccc12 483234382 VTUXWRKXXJGDSP-INIZCTEOSA-N 391.352 5.292 30 20 GKED N#CC[C@H](CC(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1)c1ccccc1 484267111 IRSPTDMTCCAOOS-MRXNPFEDSA-N 393.393 5.178 30 20 GKED CCn1c([C@@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)nc2ccccc21 484895727 UYCFMLUAPPHKAV-QGZVFWFLSA-N 394.478 5.086 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(c2ccccc2)[C@@H]2CCOC2)cc1 485809539 HQDJPYPUWFAUPM-JOCHJYFZSA-N 398.462 5.095 30 20 GKED N#CCCN(C(=O)c1cc(C(F)(F)F)ccc1F)C12CC3CC(CC(C3)C1)C2 486580620 JATCEKYWZKFVIS-UHFFFAOYSA-N 394.412 5.169 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccccc1 487176403 MIXODASJECHIOZ-LMMKCTJWSA-N 387.310 5.648 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc1 501827940 QTCSDSLCPLTWFE-UHFFFAOYSA-N 398.249 5.234 30 20 GKED CCCOc1ccc(-c2nc(C(=O)N(CCC#N)CCC(C)C)cs2)cc1 505207423 PMHSWSFMXWSJAN-UHFFFAOYSA-N 385.533 5.001 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1 506112662 MKLWPBHOSZPYNS-UHFFFAOYSA-N 390.830 5.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)CCc1ccco1 510506957 CFUMZWSULSQUHD-KRWDZBQOSA-N 389.455 5.395 30 20 GKED C[C@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)cc1F 512661044 PSBHQKBGRDZGFC-KSFYIVLOSA-N 378.422 5.307 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@H]2c2cccs2)c1 513443420 OHCUMWUYYCMHFY-FQEVSTJZSA-N 388.492 5.176 30 20 GKED C[C@@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCCCCC#N)nnc1-c1cccs1 514588802 FKDYNXZZUSVUHO-LUKYLMHMSA-N 386.590 5.790 30 20 GKED CC(C)[C@@H](Oc1ccccc1C#N)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 517176661 ZTIONMRDHBRRHK-QGZVFWFLSA-N 396.796 5.273 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)cc2)cc1 519026544 LNRGLIIOMZPERB-HOTGVXAUSA-N 388.389 5.658 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cnc(C2CC2)s1 519434148 PZYGYKVZHQIJIV-UHFFFAOYSA-N 397.447 5.297 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2csc3ccccc23)c1 520205145 ZQLJXWUFLJTDSP-UHFFFAOYSA-N 384.504 5.642 30 20 GKED CCN(CC)C(=O)[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 523849973 KHQSRPMLLADTCS-XMMPIXPASA-N 399.494 5.372 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)c1nc(-c2cccc(C(F)(F)F)c2)no1 524986839 NOFBHMDDSFSFIJ-JTQLQIEISA-N 393.365 5.619 30 20 GKED C=CCN(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccccc1F 533252050 ZZFQHXVHDCPMSR-UHFFFAOYSA-N 381.278 5.149 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccccc1CCC(F)(F)F 533901656 NIHOILANJUBZMT-UHFFFAOYSA-N 379.275 5.592 30 20 GKED C[C@H]1CN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC(C)(C)C1 543294847 WAGUNFZNICRYEA-GOSISDBHSA-N 391.515 5.232 30 20 GKED N#CCCn1cc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)c(-c2ccccc2)n1 549409048 TZOWZWFJBQZIAN-RHHYMUMYSA-N 396.538 5.374 30 20 GKED C=CCn1c([C@H](C)Oc2ccccc2F)nnc1N1CCC[C@@H]1c1cccs1 558450747 VULFLBXZTPXOEW-DOTOQJQBSA-N 398.507 5.146 30 20 GKED CC(C)Oc1ccccc1NC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 559143949 BDYPZUWBMXEKNY-UHFFFAOYSA-N 392.484 5.037 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C[C@@H](C)c1c[nH]c2ccccc12 561237586 QSJOYBURIFKWQV-GOSISDBHSA-N 378.520 5.044 30 20 GKED Cc1c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cccc1-c1ncco1 563698563 SHTIHUKSAKODTI-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@H](C)CC3)c1C1CC1 575637011 YKSDAAGFNJVBDH-OLZOCXBDSA-N 382.533 5.042 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cccc(Cl)c3Cl)c2)c1 577240800 IBHGDMGXRQSTHV-UHFFFAOYSA-N 397.261 5.696 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(Cl)c1OCC(F)F)c1ccccc1 579048022 YQNUGFSQPAUMNM-AWEZNQCLSA-N 378.806 5.010 30 20 GKED COc1ccc2c(c1)c(C(=O)Nc1cc(C#N)ccc1C)c(C)n2C1CCCC1 581282849 OTTOPTBSOYQGKP-UHFFFAOYSA-N 387.483 5.506 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@H]3C[C@H]3c3ccccc3Cl)n2)cc1 581386888 SXKSHQYTGPEGHE-HOTGVXAUSA-N 379.872 5.077 30 20 GKED COc1cccc(Cn2ccc3ccc(NC(=O)CCCCCC#N)cc32)c1 588663514 RMQGMFDDSMWPTJ-UHFFFAOYSA-N 375.472 5.111 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N1Cc2ccc(C#N)cc2C1 594404524 HYABHUQBFXYKRV-UHFFFAOYSA-N 389.524 5.059 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(C2CC2)nc2c1c(C)nn2C(C)(C)C 606816805 MVKGBKHJTXCYAD-UHFFFAOYSA-N 382.552 5.191 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC(F)(F)F)cc1 609387262 VLBZDLQXCUXBGT-KGLIPLIRSA-N 380.435 6.010 30 20 GKED CCOc1ccc(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 609433740 FRKNDIPCUOQUSI-UHFFFAOYSA-N 387.439 5.071 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(F)c(F)c1 609497413 SAEVDAJMEQTEOB-HNNXBMFYSA-N 392.405 5.314 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(Cl)cc3cccnc23)c1 609600572 LQUZIHXORCXDPT-UHFFFAOYSA-N 380.835 5.215 30 20 GKED C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1ccccc1-c1ccccc1C#N 609909299 AVYUWSJSYQNRII-YLJYHZDGSA-N 384.454 5.383 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)c2oc3c(C)ccc(C)c3c2C)c1C 610053928 ZEVSLVUAJRUBIO-UHFFFAOYSA-N 398.466 5.285 30 20 GKED C[C@H](NC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)c1cccc(C#N)c1 610364306 OLCQRFZIOVYXHZ-HNNXBMFYSA-N 386.417 5.266 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2)c1 676103724 GSDAGTBQZMRIPH-SFHVURJKSA-N 387.439 5.296 30 20 GKED COc1cc([C@@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1F 678113370 QHCGQEOOBFXBJF-XEZLXBQYSA-N 387.339 5.394 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 726876358 OYRITOUNPBPMMF-SNAWJCMRSA-N 384.477 5.583 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(-c2ccc(Cl)cc2)s1 728699296 FPLWIOYSKDFMLA-YVMONPNESA-N 396.821 5.723 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CNC2(c3ccccc3)CCC2)c1=S 728706833 GNUJFDBTTOOJDZ-UHFFFAOYSA-N 394.519 5.033 30 20 GKED N#C[C@@H](C(=O)c1cccc2c3c([nH]c12)CCCC3)c1nc2cc(F)ccc2s1 730418699 YFRQGDXJHAAEFA-INIZCTEOSA-N 389.455 5.286 30 20 GKED COc1cc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2F)ccc1OC(F)F 733206250 DWMXASRQPUJOBF-QHHAFSJGSA-N 390.279 5.351 30 20 GKED CC(C)(C)/C=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 735206545 LNWWBEPKZPIGBK-YBJDMEARSA-N 379.312 5.895 30 20 GKED Cc1cc(C(=O)Nc2ccc3c(cnn3C(C)C)c2)c(C)n1-c1ccc(C#N)cc1 735293858 YGTCUIWGRPLQHT-UHFFFAOYSA-N 397.482 5.149 30 20 GKED C=CC[C@@H](NC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1)c1ccncc1 735386752 QACKBSCOJLDCAP-NHCUHLMSSA-N 383.923 5.679 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(NC(=O)CC(C)C)ccc2Cl)cc1 741681654 SGTBYDGPHYATQQ-UHFFFAOYSA-N 397.906 5.194 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 743030048 ZMVAERGZDUFLAP-LJQANCHMSA-N 389.927 5.247 30 20 GKED CCN(c1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1)C(C)C 754400605 KUQBVMTVUJSDMG-UHFFFAOYSA-N 376.287 5.352 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 755261426 UXUAPISHKZHARW-CYBMUJFWSA-N 395.450 5.207 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)OCC1CCC(C#N)CC1 755965552 HOQBBOVSQMXRPT-UHFFFAOYSA-N 384.501 5.071 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1)C(C)C 756487933 QTIANGMMKZJBMR-UHFFFAOYSA-N 398.359 5.531 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2c(Cl)ccc(C)c2C)cc1C#N 765421057 SNGWKVUMGLNQAM-UHFFFAOYSA-N 386.839 5.041 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3c(C(C)C)cccc32)c1 772983735 KLNWVVNURJXFBS-WMZHIEFXSA-N 378.516 5.494 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1cccc(Cl)c1F 774071072 DQIVOAMGDGLXNZ-LLVKDONJSA-N 390.842 5.382 30 20 GKED CN1C(=O)CCc2cc(/C=C/C(=O)c3cc4c(ccc5ccccc54)o3)ccc21 774117795 GGNLJXOFVPONCD-YRNVUSSQSA-N 381.431 5.391 30 20 GKED C[C@H](Nc1nccc2c1C(=O)OC2(C)C)c1ccc(-c2cccc(C#N)c2)cc1 782379777 ZPQLRDYVBLCHBD-HNNXBMFYSA-N 383.451 5.199 30 20 GKED CC(=C/c1cccc([N+](=O)[O-])c1)/C=C1\SC(=Nc2c(C)cccc2C)NC1=O 787170265 WHHNLSDJZHSKDJ-OPSIFPOWSA-N 393.468 5.050 30 20 GKED N#C[C@H](C(=O)CCn1c2ccccc2c2ccccc21)c1cnc2ccccc2n1 792113105 FADCEFAHFSUAHH-IBGZPJMESA-N 390.446 5.004 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1 796777669 DGDSYRSMHKNLTG-CYBMUJFWSA-N 399.878 5.050 30 20 GKED Cc1c(C#N)cccc1NC(=O)Nc1ccc(CC[C@H](O)c2ccccc2)cc1 806358773 WSDDMEXQVKPEFV-QHCPKHFHSA-N 385.467 5.177 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H]2c3cccc(Br)c3CC2(C)C)cc1 813790021 FOKXVSVIWABDOE-VBKZILBWSA-N 399.332 5.153 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@@H]1c1cccnc1 814577512 PIUQBXPURKAWTE-XZOQPEGZSA-N 396.494 5.352 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2cc(F)c(C(F)(F)F)cc2F)CCC1 899406636 POGLIJVJPSGZQM-RUZDIDTESA-N 379.394 5.096 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(-c2noc([C@@]3(C#N)CC4CCC3CC4)n2)c1 904636955 VOMULRAKRPTPEX-SDDNFHFQSA-N 394.475 5.055 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2c(C)nn(-c3ccccc3)c2C)cc1Cl 916154854 XRBLDQGVBSYNHI-KHPPLWFESA-N 396.874 5.056 30 20 GKED C[C@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047302 WMRQJYWLZAQSJK-SWLSCSKDSA-N 386.929 5.448 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3ccc(Cl)s3)cs2)cc1 920063057 WNPYTBUGNPOCIX-UQCOIBPSSA-N 391.901 5.342 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2scnc2Cl)cc1Cl 920080548 GPKVSXPVGBUXIZ-AWEZNQCLSA-N 388.279 5.358 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C\C(=O)c3ccc4c(c3)CCCC4)s2)c1 1776113341 GTTMFTIJPLIXIY-BENRWUELSA-N 388.488 5.888 30 20 GKED C=CCc1cc(C)c(OCCCN(CC(=O)O)[C@H](CC)c2ccccc2)cc1C 1776188399 XBSBQWBAGFLLAO-HSZRJFAPSA-N 395.543 5.339 30 20 GKED CC#CC[C@H](NCc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O 1776194565 FIFOQXDZXNEBAB-DEOSSOPVSA-N 384.479 5.113 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1csc(-c2ccc(OC)cc2)n1 1776784465 QXLDAKIWRJGXHJ-KRWDZBQOSA-N 390.549 5.112 30 20 GKED CCCCCCCOc1ccc(CNCC2(CC(=O)O)CCCCC2)cc1 1776786219 BPXMSQSPBFFNAE-UHFFFAOYSA-N 375.553 5.551 30 20 GKED CCCCCCCOc1ccc(CNCc2cc(F)c(C(=O)O)c(F)c2)cc1 1776787116 VTYINYYNFRPJEY-UHFFFAOYSA-N 391.458 5.302 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776801124 DXUFFUUHOQXCCH-OWBHPGMISA-N 390.435 5.720 30 20 GKED CCSc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776950917 NURVYWBBTIWHPZ-VQHVLOKHSA-N 386.469 5.747 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c2cc(C(=O)O)oc12 1777360807 QXDHPLLYZZNGQU-VURMDHGXSA-N 399.402 5.098 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)ccc1OCC#N 6580900 WXKANBCVXWQPIV-QHHAFSJGSA-N 396.657 5.454 30 20 GKED N#CCOc1ccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)cc1 8321754 NGLDERJJQNGOCM-PKNBQFBNSA-N 386.432 5.355 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 56750759 BFOPOAGBEDGYKY-AWEZNQCLSA-N 392.846 5.282 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)c(Cl)c2)nnc1-c1ccoc1C 59928205 FSTFKJKWUWLORX-GFCCVEGCSA-N 377.872 5.678 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC1CCCC1 63392156 YRBIRYQLVKYLIB-UHFFFAOYSA-N 395.459 5.136 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4c(c3)CCCC4)n2)cc1 66544865 IEUNVOQERSZSHF-FQEVSTJZSA-N 383.476 5.051 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 66955897 KONCEHJOXUBEIO-DNVCBOLYSA-N 399.947 6.103 30 20 GKED N#Cc1cc2c(nc1SCC(=O)Nc1ccccc1-c1ccccc1)CCCC2 96994904 XNFCWSNUSQNTHN-UHFFFAOYSA-N 399.519 5.230 30 20 GKED C=CCn1c(SCc2nc(C(F)(F)F)cs2)nnc1-c1ccccc1C 155883080 PVSRTLBVWRUONF-UHFFFAOYSA-N 396.463 5.207 30 20 GKED N#C[C@H](NC(=O)c1ccccc1Oc1cccnc1)c1ccc(Cl)c(Cl)c1 161179246 KBUCZIJPGPGFOE-SFHVURJKSA-N 398.249 5.175 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c(Cl)cc1F 163246897 VIFQNNNNBVHPHX-UHFFFAOYSA-N 395.821 5.407 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1nc(Cc2ccccc2)no1 173777304 YYDDJPUKFGGKCQ-JKSUJKDBSA-N 378.501 5.085 30 20 GKED C[C@@H]1CCC[C@@H](C)N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 175374007 RFQHLCNFMFDSHA-RTBURBONSA-N 391.515 5.374 30 20 GKED Cc1nc(COc2cccc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2)cs1 177743150 BJSYLONGGLNRQP-QGZVFWFLSA-N 397.525 5.101 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)Nc3ccccc3O[C@@H](C)C#N)oc12 180026045 PBRDWSMOEWNYEW-LSDHHAIUSA-N 393.443 5.005 30 20 GKED N#CCCSc1ccccc1NCc1ccc(Br)c2cccnc12 181847927 LINNDPANXDVSQM-UHFFFAOYSA-N 398.329 5.615 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c(Sc2ccccc2)n1 182109407 XPHARNUTQMWWBP-INIZCTEOSA-N 389.480 5.084 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 185355524 CYCPRUZBGNWZFQ-LBPRGKRZSA-N 380.366 5.092 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C4CCC4)cc3)n2)cc1 192209567 IPHVDXVFMXNERM-HXUWFJFHSA-N 383.476 5.439 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)c2cc3ccccc3o2)cc1 237611600 KAWGCIJULZDDQS-IQGLISFBSA-N 382.463 5.603 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3c[nH]c4ccccc34)c2)cc1 302986143 WIIDMCVZTDRABL-NTEUORMPSA-N 396.446 5.325 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 303424953 DLJJEYCAEANOKM-UXHICEINSA-N 389.417 5.032 30 20 GKED CC1(C)CCc2ccccc2[C@H](/N=C(/O)[C@@H]2CCS(=O)(=O)c3ccccc32)C1 328845958 AJVJFHUUVDRHNZ-WOJBJXKFSA-N 397.540 5.008 30 20 GKED Cc1ccccc1[C@H]1C[C@H](/N=C(/O)N2CCC(/N=C(/O)CC3CCCC3)CC2)C1 329799147 HFLJTUFEZJTPGG-XUTJKUGGSA-N 397.563 5.156 30 20 GKED CSc1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 409788587 FFKDXYPPPKSEGQ-INIZCTEOSA-N 398.940 6.031 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)CCCCc1nc2ccccc2s1 425121332 BWZZPDNORPAFQT-MRXNPFEDSA-N 377.513 5.100 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1Cl 425454802 SAYMGHKQELOBBI-STQMWFEESA-N 376.287 5.329 30 20 GKED CCOCCC1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCC1 432443028 SQXXJDGZDKQMCR-UHFFFAOYSA-N 378.472 5.194 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ncsc3-c3ccccc3)n2)c1 432679905 SWWOPCJDSVQYOE-UHFFFAOYSA-N 388.477 5.058 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433968620 SOVFVQBSTCILAH-UHFFFAOYSA-N 399.237 5.008 30 20 GKED N#Cc1cc(NC(=O)c2c(Cl)cccc2Cl)ccc1OC(F)(F)F 441524797 XNNKHFAJUOMREF-UHFFFAOYSA-N 375.133 5.016 30 20 GKED COc1ccc(CSc2nnc(SCc3ccc(C#N)c(C)c3)s2)cc1 447310803 BLRSBLYXMGSYPE-UHFFFAOYSA-N 399.566 5.311 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C1CC1 455058617 RSONXGUORJNBCI-LPHOPBHVSA-N 379.508 5.288 30 20 GKED CN1CCC[C@@H](CNc2ccc(C#N)cc2C(F)(F)F)[C@@H]1c1cccs1 462870148 JJUIELNINPZYRT-KBXCAEBGSA-N 379.451 5.134 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CCSc3ccc(F)cc32)c2ccccc21 468923818 JUMBPNDCLDQMHF-LJQANCHMSA-N 393.487 5.051 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2NC(=O)c2cccs2)cc1 475532797 AXRGQNSJSSSQRT-UHFFFAOYSA-N 389.480 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 475570786 LKIRONJKIBPVQK-FYYLOGMGSA-N 378.516 5.580 30 20 GKED CCc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cnn1-c1ccccc1Cl 477025680 NZWYIIJYMZKTRD-KRWDZBQOSA-N 392.890 5.114 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccccc2F)nc1)c1ccccc1 477121328 YRQQYYYUOZYERL-KRWDZBQOSA-N 375.403 5.039 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1c(F)cccc1Cl 478385194 UDXPRTBFLHPWDE-URLQWDBASA-N 385.870 5.021 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2c1 483199239 ONXNMCYCIFQUKT-OAQYLSRUSA-N 377.447 5.459 30 20 GKED N#C[C@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1nccc2ccccc12 483210004 XXNSCJNDXOEDTK-QHCPKHFHSA-N 394.499 6.017 30 20 GKED C=C(C)Cn1c(SC[C@H](OC(C)C)c2ccccc2)nnc1-c1ccncc1 488288178 STANOQDAMFNLFH-FQEVSTJZSA-N 394.544 5.175 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(Oc2cccc(Cl)c2)cc1 504620947 QMNFLFNXWSNQAQ-UHFFFAOYSA-N 378.815 5.265 30 20 GKED Cc1ccc(OCc2cccc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)c2)cn1 510325865 VBLYOHNSLZWZBA-UHFFFAOYSA-N 399.494 5.144 30 20 GKED CCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H](C)c1cc2ccccc2o1 510769007 ZKHADIVCGAIWMD-INIZCTEOSA-N 375.472 5.849 30 20 GKED C[C@@H](CC#N)NC(=O)c1sc(-c2ccccc2)cc1OCc1ccccc1 512025667 PUXUSGSSYIETCQ-INIZCTEOSA-N 376.481 5.026 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc(F)c(F)c2)cc1 513959574 PPSJDACZICIXFK-UHFFFAOYSA-N 395.384 5.210 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccc(Oc4ccccc4)nc3)c2C#N)C1 514450614 FHBGALFFYHNFSR-AWEZNQCLSA-N 389.480 5.184 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(-c2nc3ccccc3s2)s1 519902439 CEBHNDXEECNOCU-UHFFFAOYSA-N 382.432 5.215 30 20 GKED C[C@@H](Nc1ccc(F)c(C(F)(F)F)c1)C(=O)Nc1ccccc1C(F)(F)F 520060173 PGNYUNJJPKTOME-SECBINFHSA-N 394.290 5.302 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520280536 GUFRIWZGGVGXIA-IRXDYDNUSA-N 397.544 5.751 30 20 GKED Cc1cccc(CN(CC(C)C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 520941286 IRJVZMYLPGWOEB-LJQANCHMSA-N 395.572 6.079 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C3(c4ccccc4)CCC3)cc2)c1 524390829 FLXLXHBECJWQPP-UHFFFAOYSA-N 382.463 5.198 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1F 524441062 PXBIPKJDZLYJJU-UHFFFAOYSA-N 379.357 5.160 30 20 GKED C=CCN(C(=O)[C@H]1CCSc2ccccc21)c1nc(-c2ccccc2)cs1 525632628 XAGKGFGAZXPURZ-SFHVURJKSA-N 392.549 5.609 30 20 GKED C=CCC[C@H](NCc1cnc2c(c1)c(C)nn2C)c1ccc(C(F)(F)F)cc1 533069634 QFMASRWYOINJSA-IBGZPJMESA-N 388.437 5.093 30 20 GKED C=CCC[C@@H](NCc1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccccc1 538259113 ZKDZWRITOGLGNZ-GOSISDBHSA-N 387.405 5.553 30 20 GKED C[C@H](NC(=O)c1c(F)cccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 542989336 OUMBTUQSCGJTFK-AWEZNQCLSA-N 378.834 5.509 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)NCC3CC(c4ccccc4)C3)cc2)ccn1 563920240 BYMXZTXQZGIWFZ-UHFFFAOYSA-N 398.466 5.061 30 20 GKED COc1cc(COc2ccc(F)cc2F)ccc1OCc1cccc(C#N)c1 569524698 FKPZJBCTMTYBHL-UHFFFAOYSA-N 381.378 5.003 30 20 GKED C[C@H](CCC#N)Sc1nc2scc(-c3ccccc3Cl)c2c(=O)n1C 585728015 IJVBXBNIIXLRJE-LLVKDONJSA-N 389.933 5.100 30 20 GKED O=[N+]([O-])c1cc(F)c(CNc2ccc(C(F)(F)C(F)(F)F)cc2)c(F)c1 586340564 KOASORZFFPBZKX-UHFFFAOYSA-N 382.235 5.139 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2cccc(-c3ccc(Br)cc3)c2)C1 588302876 BECIPISNAWVGRP-FQEVSTJZSA-N 398.304 5.274 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1cccc(C#N)c1 596734051 WOQYPGYBGBSCDZ-OAHLLOKOSA-N 378.501 5.009 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1[C@@H]2Cc3c(Cl)cccc3[C@H]21 599409098 GSUMEPSHWHDQHH-DDAIWRKXSA-N 382.916 5.259 30 20 GKED Cc1nc(NC(=O)C2(c3cccc(Cl)c3)CCCC2)sc1SCC#N 603775557 ROIJCLYEFBTZCY-UHFFFAOYSA-N 391.949 5.171 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@@H]2c2ccccc2Cl)c1C 603857059 PMGLIZCOEZWQLJ-JOCHJYFZSA-N 395.934 5.041 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc(OCCCC#N)c1 603972359 URIMRIOBOYXPJD-KRWDZBQOSA-N 380.488 5.073 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)Cc2ccc(-c3ccccc3)cc2)c1 609067672 NKJBADCUJYAHJL-UHFFFAOYSA-N 378.378 5.008 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)o1 610018473 NXQZTNICCFKEBH-INIZCTEOSA-N 389.402 5.210 30 20 GKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1OC(F)F 618804456 ADDMXCUYKYYGRS-QKKBWIMNSA-N 378.422 5.651 30 20 GKED C=C(C)Cn1c([C@H]2CC[C@@H](C)O2)nnc1N1CCC[C@H]1c1ccccc1Cl 624983185 NQRPGBDTPMYLIX-AYOQOUSVSA-N 386.927 5.089 30 20 GKED COc1ccc(-c2cncc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2)c(C)c1 626355809 BRYNIPYZDNBYMA-IBGZPJMESA-N 391.496 5.136 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccccc1F 645077398 VHUWTRXKKNIXBX-MRXNPFEDSA-N 395.503 5.251 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 661115530 SWLVLRXEJYIFOM-UGKGYDQZSA-N 397.588 5.669 30 20 GKED COc1cc2c(cc1F)CC[C@@H]2NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 684953209 DPHYXUXYFZKTRH-PGUXBMHVSA-N 399.350 5.321 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3c(c2)Cc2ccccc2-3)cc1Cl 726439001 IMGAFBPDANOEIK-UHFFFAOYSA-N 375.884 5.592 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(NC(=O)c3cccs3)c2)C(C)C)c1 728247711 NFZJSCNOUPCHAI-UHFFFAOYSA-N 388.492 5.037 30 20 GKED CCC(CC)CN(CCC#N)C(=S)Nc1ccc(Oc2ccccc2)cc1 729642753 SUKKJSCUEYSFJQ-UHFFFAOYSA-N 381.545 5.828 30 20 GKED CCN(C(=O)/C=C/c1ccccc1C#N)[C@@H](c1ccccc1)c1ccc(F)cc1 730193659 PNQCJDACJVQZNB-MIWMXLOXSA-N 384.454 5.349 30 20 GKED N#C[C@@H](C(=O)CC1=CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 730398641 LHHSEIZSYWQHQO-HNNXBMFYSA-N 391.323 6.184 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)N[C@@H](C#N)c3ccc(F)cc3)sc2c1 732654837 KOQCEKCKHPQDKU-INIZCTEOSA-N 386.879 5.812 30 20 GKED Cc1ncc(/C=C\C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)s1 732730179 OQWGRIRBIHDECB-NTMALXAHSA-N 391.471 5.017 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1oc2ccccc2c1C)C(C)C)c1ccncc1 734668519 IPHGKSGSDXBWNY-PZJWPPBQSA-N 377.488 5.450 30 20 GKED O=C(/C=C\c1cn2cc(Cl)ccc2n1)c1ccc(SCC(F)F)cc1 741841168 DRXBGUQGLWAFEU-DAXSKMNVSA-N 378.831 5.241 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1ccc(Oc2cnccn2)cc1 743056255 SDKSIDZFFXTJKE-WEVVVXLNSA-N 380.831 5.217 30 20 GKED C#CC[C@@H](OC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccccn1 744101028 PETBHSARSNNLBI-LJQANCHMSA-N 398.890 5.031 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCOc2ccc(Cl)cc2Cl)n1 747198225 VOBRGPJDFIOIDB-ZDUSSCGKSA-N 397.327 5.609 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3sccc3C)n2)cc1 748835427 YNFGAJZPYOUYCS-KRWDZBQOSA-N 380.538 5.688 30 20 GKED COc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 750685971 AJKWTHSGUNTWSD-UZLBHIALSA-N 390.508 5.497 30 20 GKED CC(CC1CCOCC1)=NNc1ncnc2scc(-c3ccc(F)cc3)c12 757568795 MZSRTUVSLCMLLC-UHFFFAOYSA-N 384.480 5.102 30 20 GKED C=CCC(CC=C)C(=O)O[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 759010826 MIEYUGWRGOWKKH-LLVKDONJSA-N 381.259 5.416 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 772417477 LTLQIIGJAPLKFY-LEWJYISDSA-N 379.529 5.091 30 20 GKED Cn1ncc(Br)c1/C=C/C(=O)c1ccc(Cl)c(Cl)c1Cl 782299819 ANPZWSPLSHGCRY-SNAWJCMRSA-N 394.483 5.039 30 20 GKED CCCCCCCCS(=O)(=O)[C@H](C)c1nc(-c2ccc(Cl)cc2)no1 790146409 VYLGAJRKLKXQSZ-CQSZACIVSA-N 384.929 5.226 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CCc3cc(SC)ccc3C2=O)cn1 792884940 MNRPODOJSXRGDZ-GZTJUZNOSA-N 388.492 5.087 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)[C@H](F)CC1CCCCC1 793021450 OQYOUZHOXXDJRZ-ZOBORPQBSA-N 391.371 5.321 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2cccc(OC3CCCC3)c2)s1 797570126 CZNGXZZVHUDOJW-IBGZPJMESA-N 396.556 5.571 30 20 GKED Cc1c(C#N)cccc1NC(=O)Nc1ccc(CC[C@@H](O)c2ccccc2)cc1 806358770 WSDDMEXQVKPEFV-HSZRJFAPSA-N 385.467 5.177 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCCc3c2[nH]c2ccccc32)ccc1OC 808705861 UXMFJOCZIGRRJI-LAUBAEHRSA-N 389.499 5.025 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC(C)(C)CCC#N)cc1 809260851 ULCFKTGTSVLGHA-UHFFFAOYSA-N 377.492 5.228 30 20 GKED N#Cc1c(F)cccc1/C=C(/C(=O)c1ccccc1)c1nc2ccccc2s1 811684722 BSQATCBYOOPZKP-LGMDPLHJSA-N 384.435 5.731 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(C)cc1 915353532 VASLNONAULNBHW-ZEQRLZLVSA-N 383.495 5.923 30 20 GKED O=C1/C(=C\c2csc(-c3cccc(Br)c3)n2)Cc2ccccc21 916137113 LMOVTMMXEFKGFJ-UVTDQMKNSA-N 382.282 5.395 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)cc1 916411056 OAJUDFHBUVGFKP-UHFFFAOYSA-N 398.491 5.080 30 20 GKED Cc1cc(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1C(C)C 917044583 UTLOJONHUWGFRU-QGZVFWFLSA-N 398.915 5.637 30 20 GKED Cc1c(Cl)c(COC(=O)CSCc2ccc(C#N)cc2)nc2ccccc12 917264423 XGVQYGUZOYWMTD-UHFFFAOYSA-N 396.899 5.045 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1oc2ccc(Cl)cc2c1C 920101542 DAGUQUUDOOEWAH-MRXNPFEDSA-N 390.826 5.390 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1F)c1nc(-c2c(F)cccc2F)cs1 920804809 ZSFBEQUADJFMIN-YXVBKTCISA-N 384.382 5.117 30 20 GKED CC(=NOc1ccccc1C(F)(F)F)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776052032 ZSYLJSVIILIFKU-UHFFFAOYSA-N 389.329 5.467 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(O[C@H](C)c2ccccc2)cc1 1776089030 XSRCISZHIWFNMJ-GOSISDBHSA-N 388.467 5.669 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccccc3OC(F)F)o2)cc1 1776119803 LZUVNPMEPBKYOG-LUAWRHEFSA-N 384.334 5.142 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(O)c(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269203 GBKIANNVURDUMK-VURMDHGXSA-N 392.495 5.508 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1c(Cl)oc2ccccc12 1776354474 CXZAOHSDMXVHIC-CMDGGOBGSA-N 384.815 5.468 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C\c2ccc(OCC(=O)O)c(Cl)c2)cc1 1776364816 LKUCBSGCGDVUDB-OQFOIZHKSA-N 390.888 5.200 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1777033444 ZHZYNOFDHZAQBI-ZRDIBKRKSA-N 391.492 5.071 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1ccc2ccccc2n1 51897444 AENRAORWTVMIJU-OAHLLOKOSA-N 389.867 5.502 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1Cl 58989307 IIIYVVVMDVRRTH-OAQYLSRUSA-N 399.881 5.658 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1sc(COc2ccc(Cl)cc2)nc1C 63961506 BTIYVGQTFBUKTO-UHFFFAOYSA-N 397.887 5.116 30 20 GKED N#CCSCC(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 65806534 BTXJDEAPSHRKJX-UHFFFAOYSA-N 385.247 5.120 30 20 GKED CSc1ccsc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 107115898 NMRYXTNFUHTOBN-UHFFFAOYSA-N 394.521 5.367 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(OC)cc1 108529717 FYTCPUPFBCGLNR-CRAIPNDOSA-N 383.517 5.220 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 109160211 CHMOALUCQOTAFY-MRXNPFEDSA-N 387.439 5.281 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccncc1 175617392 MKVRXHBGOFIPPG-OAQYLSRUSA-N 386.455 5.327 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2SCC)cc1 175699521 XMJXSQMVSKVSSH-UHFFFAOYSA-N 389.908 5.012 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1 180021650 SBUPDWRERWAXBA-GCJKJVERSA-N 397.478 5.157 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(NC(=O)Nc4ccccc4)c3)cc2)CC1 182632039 PASVUJHXFWEAAQ-UHFFFAOYSA-N 396.450 5.138 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc1 208256116 DWWOICFMTHHIKF-LUJRCDHRSA-N 386.476 5.313 30 20 GKED C=C(C)COc1cc(CN[C@H](c2nc3ccccc3[nH]2)C(C)C)ccc1OC 237282752 BHMYZQADFUQIHL-QFIPXVFZSA-N 379.504 5.013 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@@H](C)C[C@@H]1c1ccco1 245432169 BCWFGVHAWYRINB-ZIFCJYIRSA-N 397.544 5.086 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1 303369059 RYHZNUJUQTWMQZ-DLBZAZTESA-N 396.556 5.784 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)C1 329055897 ICZGZRPCERVQKG-AYWYSENESA-N 397.563 5.628 30 20 GKED O/C(=N/[C@@H]1CCOc2ccc(F)cc21)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329219305 AUVXAGTVDUTAPV-OXJNMPFZSA-N 397.494 5.113 30 20 GKED COc1ccc2c(c1)[C@H](/C(O)=N/[C@@H]1CCCc3cn(C4CCCC4)nc31)CC2 330353786 OVVDBTVNEYRZMP-TZIWHRDSSA-N 379.504 5.071 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCCCC(=O)c1ccc(F)cc1 426992043 PPRXJYLWWNWPJD-MRXNPFEDSA-N 398.503 5.459 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](C)c1ccccc1 428853540 ATWIDKZJJFENSG-RBUKOAKNSA-N 395.572 5.348 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccccc1)c1ccc(F)cc1C(F)(F)F 429020756 NYFFHOQWQPIRKJ-CQSZACIVSA-N 379.275 5.268 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2sccc2[nH]1 430064705 DTKSJOROZLKJGB-UHFFFAOYSA-N 387.464 5.241 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 433117796 OQQJIZXIBGNDFM-FXAWDEMLSA-N 393.556 5.522 30 20 GKED C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438638114 QPZZMCLUPFACSP-SGTLLEGYSA-N 391.368 5.331 30 20 GKED N#CCc1ccc(NC(=O)CCCCc2nc3ccccc3s2)c(Cl)c1 452647324 QGAAZJUWVMAFGY-UHFFFAOYSA-N 383.904 5.367 30 20 GKED N#CCc1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)c(Cl)c1 455738170 UUNYVWIXGLWLPZ-PMACEKPBSA-N 393.918 5.424 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(-c2cscn2)c1 463744740 JPKQWCUKZCOHIQ-AWEZNQCLSA-N 379.510 5.314 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(F)cc(Cl)c3)n2)cc1 465417362 NHQUVVQWMDJIEP-MRXNPFEDSA-N 386.835 5.101 30 20 GKED C=CC[C@@H](C)NC(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466250366 OWTVYTRSVSJVFS-BFUOFWGJSA-N 376.472 5.040 30 20 GKED N#Cc1cc(NCc2ncc(-c3ccc(Br)cc3)o2)ccc1Cl 467263822 ZXDYUDOMYRFSPI-UHFFFAOYSA-N 388.652 5.241 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(-c3ccncc3)cc2)cc1Cl 467763138 RFKBPLDSCCZRSN-KRWDZBQOSA-N 378.903 5.818 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc2cc(C)cc(Br)c2o1 471173256 PPJLDEDVNHEGAY-UHFFFAOYSA-N 377.282 5.048 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1ccc2c(c1)OCCO2 475563337 JCLXINDPGGMLCB-UHFFFAOYSA-N 394.515 5.064 30 20 GKED C=CCn1c(SCCCCC(C)=O)nc2scc(-c3ccccc3)c2c1=O 475742428 PVKQFPFFDFNFSE-UHFFFAOYSA-N 398.553 5.162 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 476168622 XMZOPWOTIRWZBJ-KRWDZBQOSA-N 396.918 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(OC2CCCC2)c1 476172881 ZPAFMQNSTBPXIU-UHFFFAOYSA-N 393.527 6.121 30 20 GKED CN(C(=O)CCCCOc1cccc(C#N)c1)C1c2ccccc2-c2ccccc21 477517720 AVPNAQLKXKNSIM-UHFFFAOYSA-N 396.490 5.336 30 20 GKED COc1cc2c(cc1OC)[C@@H](N[C@H](C)c1ccc(-c3cccc(C#N)c3)cc1)CC2 479460857 MEJPZXQWHCPWCR-OSPHWJPCSA-N 398.506 5.581 30 20 GKED C[C@@H]1SCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@H]1C 483049684 JDCCFNOBWXZBFN-YZVOILCLSA-N 399.947 5.353 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(OC)cc1Br 485407195 DUNKQVXSXUTMFM-UHFFFAOYSA-N 381.314 5.058 30 20 GKED CC(C)(C)[C@H]1C[C@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 485707208 NRBPJHRWVUHNRB-DYESRHJHSA-N 394.540 5.033 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(C(C)(C)C)cc1 488271767 IZRLOGVWYKIGJO-GOSISDBHSA-N 389.543 5.740 30 20 GKED CC(C)c1ccc2ncc(C#N)c(N3CCC(c4noc(C(C)C)n4)CC3)c2c1 488474832 YYJNJKHQWWICGA-UHFFFAOYSA-N 389.503 5.120 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(-c2nc3ccccc3s2)s1 494396148 KOLAKOIAIBZWEK-UHFFFAOYSA-N 383.542 5.427 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC(C)C)cc1F 498106186 NIPMZAFSNSHUAH-UHFFFAOYSA-N 383.467 5.175 30 20 GKED C[C@@H]1CCN(CCCC2(C#N)CCOCC2)[C@@H]1c1ccc(C(F)(F)F)cc1 499569625 CCDLDUJGEMJMCH-APWZRJJASA-N 380.454 5.189 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(-c2cccc(Cl)c2)on1 500310830 FRAPLVXBLXXOQH-UHFFFAOYSA-N 393.874 5.165 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(CCN2CCCC[C@H]2C)CC1 505036738 ZAZYKZICADBYLR-HXUWFJFHSA-N 383.580 5.314 30 20 GKED Fc1ccc2nc(CN[C@H](c3ccccc3C(F)(F)F)C(F)(F)F)oc2c1 505833099 OXHSKZKHMJPUIR-OAHLLOKOSA-N 392.274 5.379 30 20 GKED CCc1nc(C)c(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 506131199 MAXRLTSJFTXETK-UHFFFAOYSA-N 393.537 5.430 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 509631923 GCAGKNLEBLXZDK-RYUDHWBXSA-N 379.312 5.223 30 20 GKED C=CCc1cc([N+](=O)[O-])ccc1OCc1csc(-c2ccccc2OC)n1 514494252 RFDUDJJACFMEJJ-UHFFFAOYSA-N 382.441 5.034 30 20 GKED N#CCc1ccc(NC(=O)Cc2cccc(OCc3ccccc3Cl)c2)cc1 517978692 XGNBJYRCSGOEGS-UHFFFAOYSA-N 390.870 5.166 30 20 GKED CC(C)Oc1ccc(CCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 518683254 OFVQCSKJYQQLSG-QGZVFWFLSA-N 397.544 5.090 30 20 GKED CN(C(=O)Nc1cccc(C#Cc2ccccn2)c1)[C@@H]1CCCc2ccccc21 522071409 NQUUDNJNZRNCDR-XMMPIXPASA-N 381.479 5.023 30 20 GKED N#CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccccc1 522641503 LTEJEBMQFZIVQQ-UHFFFAOYSA-N 387.826 5.174 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cc1 523153991 MOYPDPMCOOQMJJ-QGZVFWFLSA-N 385.467 5.144 30 20 GKED Cc1ccnc(C(C)(C)c2noc(/C=C\c3cn(CCC#N)c4ccccc34)n2)c1 528267591 VCAKNPMHLZBPBE-KTKRTIGZSA-N 397.482 5.138 30 20 GKED CN(CCc1cccs1)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534886492 YQFYYSPBDKPHEQ-UHFFFAOYSA-N 396.899 5.380 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccnc1-c1ccccc1 535110634 ITZRUZPKOQWEKO-RBBKRZOGSA-N 382.467 5.052 30 20 GKED C[C@@H](NC1CCC(O)(C(F)(F)F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543034657 UMTJTTICJZWRAO-TVRCVXMWSA-N 388.433 5.112 30 20 GKED CC(C)(CCC#N)CNC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 553754466 NCRQLPOAQLOJJE-UHFFFAOYSA-N 382.316 5.177 30 20 GKED CCC(CC)N(C(=O)c1ccc(C#N)c(Cl)c1)[C@@H]1CCCc2cccnc21 554731547 NCEGOKCNJBUGRW-HXUWFJFHSA-N 381.907 5.315 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccccc1SC[C@H](C)C#N)C1CC1 562167200 IMBFFUNYBKOVBF-SJORKVTESA-N 379.529 5.696 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccccc2F)C1 565284018 MRTGZHPVWZUVSK-BZUAXINKSA-N 383.492 5.288 30 20 GKED N#CCCC1CCN(Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 566172940 JZCPWKZWEOIPSA-UHFFFAOYSA-N 379.451 5.345 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 596691893 QGTOVVHHJYEYJV-SVFBPWRDSA-N 391.902 5.710 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CC[C@@](C)(C#N)C2)c(C(F)(F)F)c1 596712265 XUHQYYNCIWWINN-PXAZEXFGSA-N 385.455 5.363 30 20 GKED Cc1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 603758864 LONDVULRALXIEE-QGZVFWFLSA-N 381.888 5.321 30 20 GKED Cc1cccc(CCNC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 604536148 QJULPVOHDZLXQD-UHFFFAOYSA-N 386.520 5.132 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(Br)cc1C(F)(F)F 606941222 VFEYYAGCMJYXSV-UHFFFAOYSA-N 393.247 5.678 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)c1 609081289 KDJPSXJESMFTMB-QGZVFWFLSA-N 391.805 5.086 30 20 GKED CCOC(=O)c1oc2ccccc2c1CNc1ccccc1SCCC#N 609385996 VRTASEMWCARLDD-UHFFFAOYSA-N 380.469 5.227 30 20 GKED N#C[C@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(Cl)cc1 609589624 ZFPOFZMMHHMMJL-LBPRGKRZSA-N 395.698 5.856 30 20 GKED C[C@@H](NC(=O)N(CCc1ccccc1)Cc1ccccc1)c1cccc(C#N)c1 610407089 RXIDOEGFWNTBOX-HXUWFJFHSA-N 383.495 5.074 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(COC(C)(C)C)cc1 610632260 FDAUUDCIFBLOJN-MRXNPFEDSA-N 397.544 5.897 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4ccc5ccccc5n4)cc3c2C1 613291228 WTGXVMAKXYAOCQ-MGPUTAFESA-N 379.463 5.331 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-n4ccc(C)n4)cc3)n2)cc1 613319029 MSNHWZKWVLDUGG-FQEVSTJZSA-N 398.491 5.103 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)c(Cl)c1 619147934 GFFSLVUBVNIBQZ-UHFFFAOYSA-N 399.237 5.045 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3nc(-c4ccccc4F)sc32)cc1Cl 619754458 ABPCJDRRBGUVKF-GOSISDBHSA-N 397.906 5.641 30 20 GKED Fc1cccc(CNc2cccc(NCC(F)(F)F)c2)c1OCC(F)(F)F 630068578 UYEVZHKJZDZSSI-UHFFFAOYSA-N 396.306 5.353 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(COCCOC)c1 682777200 HRMDOYCMJGXSOC-UHFFFAOYSA-N 382.504 5.346 30 20 GKED COc1ccccc1/C(C)=C\C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 727302560 MBHOQJIPVKMACB-PEZBUJJGSA-N 399.450 5.105 30 20 GKED Cc1cc(C(=O)Nc2ccc(OC(C)C)cc2F)c(C)n1-c1ccc(C#N)cc1 728272118 FZPHWVWEGHWTCP-UHFFFAOYSA-N 391.446 5.144 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1c(Cl)nc(Cl)n1C 728440969 BBNVFYLJWYAJMA-FPLPWBNLSA-N 396.274 5.194 30 20 GKED C#Cc1ccc(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccccc3)s2)cn1 728812957 RAFMESPBLJKZHL-UHFFFAOYSA-N 395.487 5.030 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2sc3cc(C)ccc3c2Cl)c1 729189012 UHHAZFIHCKLPGC-OAHLLOKOSA-N 382.872 5.133 30 20 GKED O=C(/C=C\c1ncc(-c2cccc(Br)c2)[nH]1)c1ccc(Cl)s1 731938593 QOQSWUUOTAHXDC-DAXSKMNVSA-N 393.693 5.450 30 20 GKED C=CCn1c(SCc2ncc(C(C)C)o2)nnc1-c1ccc(C(C)(C)C)cc1 733207645 LHBAREUYEUOCHS-UHFFFAOYSA-N 396.560 5.832 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3cccc(Cl)c3)CCCC2)c1 733771317 RSXLIILXGFTEKM-FQEVSTJZSA-N 396.918 5.149 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3ccc(Cl)cc3)CCCC2)c1 733787759 WMWIQJBGORFEQU-HXUWFJFHSA-N 396.918 5.149 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(SC(F)F)cc2)c1 733842454 VWRKZQWNXCUBCR-HNNXBMFYSA-N 391.443 5.004 30 20 GKED CN1CCC[C@H](C/N=C/c2cc(Cl)cc(Cl)c2O)[C@@H]1c1cccs1 741464998 RWXGLYJGGYQAAO-YQFNBRROSA-N 383.344 5.263 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744766378 PIJHHMOCAVXKPR-RUZDIDTESA-N 395.506 5.605 30 20 GKED Cc1nc(C)c2c(C)c(C=NOCc3ccc(C(F)(F)F)cc3)sc2n1 746576293 IEUNJZMWBJKPNH-UHFFFAOYSA-N 379.407 5.186 30 20 GKED CC[C@@H](Oc1ccccc1C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 750689899 NDZCENJMXGKSAC-GDBMZVCRSA-N 384.888 5.292 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)c2ccccc2OCC#N)cc1 752474815 WBXPTXOEPQSYDZ-QGZVFWFLSA-N 388.492 5.695 30 20 GKED CN(C)C(=O)Sc1cccc(CSCCCOc2cccc(C#N)c2)c1 763211927 IQRJHFBEIPNVON-UHFFFAOYSA-N 386.542 5.034 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)c1ccc(Cl)c2ccccc12 765255320 UZHNDVAAMSBEGX-LSDHHAIUSA-N 393.874 5.667 30 20 GKED C=C(C)C[C@@H](C)C(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 767697862 WRJYGFYWRRRXNO-HZPDHXFCSA-N 381.497 5.350 30 20 GKED COCCOc1c(Cl)cc(N[C@@H](C)c2ccc(C#N)c(F)c2)cc1Cl 777706345 FTYRITIGWLQMEK-NSHDSACASA-N 383.250 5.202 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 782087944 OJZLYSDOQQGZDH-UHFFFAOYSA-N 386.480 5.398 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2cnn(C(C)C)c2C)cc1OC 787186764 IBZBKJYKLPSXAT-FPLPWBNLSA-N 376.884 5.119 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1Cl 789156936 HGWPEMYRILLQKE-FPLPWBNLSA-N 384.888 5.542 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cnc3ccccc3c2)cc1 791510743 QZLXBKZHUMRMFW-DEOSSOPVSA-N 391.474 5.462 30 20 GKED C#C[C@@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccc(Cl)cc1 811963618 QTNAVDRKQSRQQZ-LJQANCHMSA-N 384.888 5.081 30 20 GKED C=CCn1c(SCCSc2ccc(Cl)cc2)nnc1-c1ccncc1 824981370 UFHUHOZIBGLEFV-UHFFFAOYSA-N 388.949 5.064 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c(C#N)c2[C@H]1C 839390770 KLFJSANOIJUXTD-UWVGGRQHSA-N 389.864 5.119 30 20 GKED Cc1ccc(CN[C@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)cc1C#N 859309461 PGQHIWSUASFMLM-JOCHJYFZSA-N 393.531 5.003 30 20 GKED Cc1cncc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 878676171 OSXAVFNSFAVJBM-APWZRJJASA-N 380.517 5.153 30 20 GKED Cc1cc(Cl)ccc1OCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086166 HYHOAJQWLAEDQQ-OAQYLSRUSA-N 390.870 5.321 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1nc(-c2ccc(Cl)cc2Cl)cs1 915103257 RAXJDNNIHFKXFS-UOVKNHIHSA-N 391.323 5.729 30 20 GKED CCOc1ccc(Oc2ccc(NC(=S)Nc3ccccc3C#N)cc2)cc1 915995278 NVQKMLUORCIPBP-UHFFFAOYSA-N 389.480 5.558 30 20 GKED CCOc1c(Br)cc(/C=C\C(=O)c2ccc(F)c(F)c2)cc1OC 916127758 XORBWUHVVRRSHQ-DAXSKMNVSA-N 397.215 5.031 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1 916683630 AMQAUXDFCZTIRP-UHFFFAOYSA-N 394.494 5.130 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 919936244 HUCALDABPKHAGJ-UKSYNSBOSA-N 378.884 5.192 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 1776050263 WUUKFNVQKTUXPM-OAHLLOKOSA-N 392.377 5.148 30 20 GKED O=C(O)Cc1ccc(NN=Cc2ccc(SCc3ccccc3)cc2)cc1 1776084602 BVGMWSPNXKLTHD-UHFFFAOYSA-N 376.481 5.052 30 20 GKED CC(=NN[C@@H](C)c1ccc(C(C)C)cc1)c1oc2cc(C)ccc2c1CC(=O)O 1776105715 CBRDEMHFWYZPTH-INIZCTEOSA-N 392.499 5.567 30 20 GKED C/C(=C/c1ccc(-c2ccc(C(=O)O)cc2)o1)c1nc2ccccc2n1CC#N 1776196798 LTNXFCCULWAWLC-PFONDFGASA-N 383.407 5.079 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NC/C(C)=C/c1ccccc1OC(F)F 1776782363 LJDSEHMHJUIVSA-QCUIPMNBSA-N 383.479 5.485 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](Cc2ccccc2C)C(=O)O)cc1 1776786216 AYAFGPHOTXKPGN-QHCPKHFHSA-N 397.559 5.377 30 20 GKED COc1ccc(/C=C2/CC(C)(C)c3ccccc3C2=O)c2cc(C(=O)O)oc12 1777360057 WYRDBBHSSDCOKS-UVTDQMKNSA-N 376.408 5.087 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)CC3CCC3)cc2)CCC1 1792269969 GVQSNKBAOAAJRC-NRFANRHFSA-N 380.532 5.079 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)c(C)c1 5406966 RHHQDRDMXIJQSR-LJQANCHMSA-N 384.479 5.557 30 20 GKED Cc1cccc(N/C(S)=C(\C(=O)c2cc(C)sc2C)[n+]2cccc(C)c2)c1 10167590 JCTQIRFRDANNQZ-UHFFFAOYSA-O 395.573 5.320 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(C(C)(C)C)cc2)=C(/S)NC)cc1 22734181 QUKPROAYZPHLMT-UHFFFAOYSA-O 397.608 5.333 30 20 GKED C=CCc1cc(C(=O)Nc2nc(-c3ccccc3C)cs2)cc(OC)c1OC 31788747 QEFZAMAYMOWYHS-UHFFFAOYSA-N 394.496 5.117 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2ccccc2)c1)c1ccc(C(F)(F)F)cn1 41555453 HERLJPALYDXDNU-SFHVURJKSA-N 382.341 5.383 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3ccccc3[nH]2)cc1 55823550 QHZPPARUHBJLPZ-UHFFFAOYSA-N 381.435 5.065 30 20 GKED Cc1cc(C)c(NC(=O)CNc2cccc(OCc3cccc(C#N)c3)c2)c(C)c1 55843794 DEUNPPNKTINGQM-UHFFFAOYSA-N 399.494 5.113 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1 60064380 BQWZSCZFPYUUTJ-CQSZACIVSA-N 398.450 5.148 30 20 GKED C=CCN(C(=O)c1sccc1CC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 64681473 XXRARTYPSISNIX-UHFFFAOYSA-N 399.497 5.175 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nc(-c2ccc(Cl)cc2)no1 66861112 LOSZFCJAWIWSEP-CYBMUJFWSA-N 384.892 5.396 30 20 GKED COc1ccc(C)cc1[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 66954201 YTJKXBZLBCSOJZ-JKSUJKDBSA-N 383.517 5.281 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 106701536 AVSNCQAFBBAYCJ-UHFFFAOYSA-N 379.441 5.288 30 20 GKED CC(C)CCOC1CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1 109028376 MIFNMLHTVFIJGQ-KRWDZBQOSA-N 389.565 5.140 30 20 GKED Cc1sc(NC(=O)COc2ccc3oc4ccccc4c3c2)c(C#N)c1C 115043283 FREGMNWGXNKRCW-UHFFFAOYSA-N 376.437 5.154 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCOc2ccccc21)c1nc2cc(Cl)ccc2s1 118143514 VAYSCTBIIZZKFX-DOMZBBRYSA-N 382.872 5.082 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(COC2CCCC2)cc1)c1ccccc1 121010533 UYSMKMLAWMMCHG-JOCHJYFZSA-N 377.488 5.312 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)CCCCOc2cccc(C#N)c2)o1 154225453 CVMVHJIRFPDVNR-NRFANRHFSA-N 380.488 5.153 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 155858624 BCJRERJLODKGSQ-OAHLLOKOSA-N 393.855 5.259 30 20 GKED CC(C)C[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 179717885 RMTYPIHWRZUGPC-IBGZPJMESA-N 380.879 5.139 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)c(C)n1[C@@H](C)c1ccccc1 183110539 PRQJYKVTEBYMNY-MSOLQXFVSA-N 387.483 5.257 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)c2ccccc2OCC#N)cc1 194096479 OMEJWDGIUCJKJA-UHFFFAOYSA-N 388.423 5.032 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@H](c2ccccc2)C1 303012898 RGPOPAORDNPXPL-FQEVSTJZSA-N 384.504 5.339 30 20 GKED C/N=C(/O)CCOc1ccc(NC(=O)N2CCCC3(CCCCC3)CC2)cc1 329953105 NCXTYPAIJNDCTD-UHFFFAOYSA-N 387.524 5.010 30 20 GKED C[C@H](/N=C(/O)[C@@H]1CC12CCCC2)c1nc(-c2ccc(Br)cc2)no1 329974161 ZZFPEKMWVWUQTE-FZMZJTMJSA-N 390.281 5.097 30 20 GKED C=C(C)[C@H](N[C@@H]1CCCc2ncc(C(F)(F)F)cc21)c1ccc(F)c(F)c1 427877842 PHVCGHINUXGUFD-MOPGFXCFSA-N 382.376 5.663 30 20 GKED C=C(C)Cn1c(S[C@H](C)CCSc2ccccc2)nnc1-c1ccncc1 431247542 FPLVXCSCLBHYFW-QGZVFWFLSA-N 396.585 5.579 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1 432700622 WHLGHHYNWNWCLR-MRXNPFEDSA-N 393.821 5.498 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1 434211986 PSVQMPISAKOQNQ-HKUYNNGSSA-N 393.556 5.738 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 438451213 QQTAVIAKFPWOBV-FHZYATBESA-N 378.516 5.056 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(OC3CCC3)cc2Cl)c(Cl)c1 452643402 JMLSQLVCAUFKHR-UHFFFAOYSA-N 375.255 5.243 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1C(C)(F)F 455782091 DOARNAOLKSFYQI-UHFFFAOYSA-N 376.451 5.186 30 20 GKED Cc1ccncc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464275403 NHDKVAHCOKMQBA-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)c1ccc(Sc2ccccc2C#N)cc1 470622288 GAZVPZOUUFRWQU-SUMWQHHRSA-N 390.430 5.122 30 20 GKED Cc1csc(C(C)(C)NCCC(C#N)(c2ccccc2)c2ccccc2)n1 472591446 XBKBRIGNHCQUPV-UHFFFAOYSA-N 375.541 5.176 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccccc1C(F)(F)F 477639104 SOJGHDWCLHUDLD-UHFFFAOYSA-N 399.237 5.578 30 20 GKED C=CCn1c(SCc2ncc(Cl)s2)nnc1-c1ccc(Cl)cc1 478851817 HHLFEWQPEPMFBB-UHFFFAOYSA-N 383.329 5.187 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cnc2ccccc12 484554885 ILXFABSTJXPVOT-GOSISDBHSA-N 394.459 5.028 30 20 GKED CCOc1ccc(Oc2cc(CNc3c(F)cc(C#N)cc3F)ccn2)cc1 500567954 ZUFHQQIRUSIOBY-UHFFFAOYSA-N 381.382 5.035 30 20 GKED COc1cc(C2(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)CC2)ccc1C 501908000 RVZURHIUKUOFJW-UHFFFAOYSA-N 398.462 5.338 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@H](c1c(F)cccc1F)C(F)(F)F 504478480 WOETVAMRGPBTAT-CYBMUJFWSA-N 398.253 5.409 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2ccc(Oc3cccc(Cl)c3)cc2)nc(C)n1 507032202 UBWDZTQTIIWDJK-LJQANCHMSA-N 377.831 5.029 30 20 GKED Cc1cccc([C@H](NC(=O)c2ccc(F)cc2C(F)(F)F)C(F)(F)F)c1 511705505 FFLZFBIIDYVRCU-AWEZNQCLSA-N 379.275 5.186 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@H]2CCC[C@H](C(F)(F)F)C2)n1 512034110 ZLTKHXLHVKNQEO-WCFLWFBJSA-N 396.306 5.983 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 512512465 VRGAYNGOMFAQIU-INIZCTEOSA-N 399.926 5.307 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)CC1 512550180 ZRXIYJVAFJMYRI-UHFFFAOYSA-N 391.393 5.323 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)c1ncc(-c2ccc(Cl)cc2Cl)o1 512746187 CWRXOMHLQRDFSU-SNVBAGLBSA-N 376.268 5.768 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1NCc1csc(-c2ccccc2)n1 514764674 AEVHLRABNRQOKZ-UHFFFAOYSA-N 378.407 5.120 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)oc2ccccc12 515624271 KBSFVWKKLGGUMC-UHFFFAOYSA-N 384.460 5.692 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 519422699 GGGZUOWXJZLYEF-UONOGXRCSA-N 390.961 5.711 30 20 GKED C=CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)CC1 521957305 ALYUVHMEFIARLA-VLGSPTGOSA-N 384.479 5.353 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 523708321 XGLNIRLJHDVUPL-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 534091196 VTOCUXOCGTXIMH-ZDUSSCGKSA-N 386.293 5.327 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 538001169 YXLLJQKHKRHDKE-IEBWSBKVSA-N 386.417 5.210 30 20 GKED COc1ccc2nc(C)cc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2c1 538767886 ICLNIVXYXGZZCK-IBGZPJMESA-N 399.475 5.165 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccccc2OCc2cscn2)CC1 538834834 XOOYOPSZAPTGLB-UHFFFAOYSA-N 389.524 5.538 30 20 GKED N#CC1(c2ccc(-c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)cc2)CC1 539627325 SFRVUOBROOVSIN-UHFFFAOYSA-N 398.397 5.285 30 20 GKED C=CCN(C(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1)C1CC1 540109897 ABUZICDOFJHIQW-FQEVSTJZSA-N 388.483 5.136 30 20 GKED Cc1cc(-c2nc(C3CC3)no2)ccc1NCc1cccc(OCCCC#N)c1 541383079 HYIQNVBZSWQKKK-UHFFFAOYSA-N 388.471 5.217 30 20 GKED N#CCCC[C@@H](NCc1cccc(OCc2ccc(F)cc2)c1)c1ccccc1 552313001 GZZRZGRFSBTHRI-RUZDIDTESA-N 388.486 5.929 30 20 GKED CC(=O)c1cc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)ccc1F 552627427 SXEZDSBRVAZLGD-UHFFFAOYSA-N 390.439 5.303 30 20 GKED Cc1nc(NC(=O)c2cn(CCCC#N)c3ccccc23)ccc1-c1ccccc1 555115815 VIEARXRPHAGWAX-UHFFFAOYSA-N 394.478 5.568 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCC(=O)c2ccccc21 555792188 NVWDACZGUBKVQT-JOCHJYFZSA-N 396.446 5.358 30 20 GKED Fc1ccc([C@H](NCc2ccc(C(F)(F)F)cn2)C(F)(F)F)cc1Cl 556534167 OGCLXPIQSZRYRA-ZDUSSCGKSA-N 386.698 5.286 30 20 GKED N#Cc1ccc(CN2CC[C@H](C(F)(F)F)C3(CCC3)C2)c(C(F)(F)F)c1 562206476 DCOJRYDBDAATRD-HNNXBMFYSA-N 376.344 5.132 30 20 GKED Cc1c(NC(=O)N[C@H](CCC#N)c2ccccc2)cnn1-c1ccc(Cl)cc1 562894904 HBUFEZCEYNXBDJ-LJQANCHMSA-N 393.878 5.001 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 582211197 ANBZKWYAKDWVRD-OAHLLOKOSA-N 390.418 5.110 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)c1cc2ccccc2n1CC#N 587152677 LDBXBODQBCXWCF-UHFFFAOYSA-N 386.499 5.106 30 20 GKED C=CCCn1cc(CS[C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)nn1 594564861 JBYLTFAICYKNTO-CQSZACIVSA-N 388.924 5.465 30 20 GKED CCCC[C@@H](CC)COCc1cccc(NC(=O)N2CCC[C@@H](CC#N)C2)c1 596705124 VIUDNNNYKLPUJK-UXHICEINSA-N 385.552 5.577 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cccs2)cc1Cl 603673454 ZUXFHRCDOOGZPY-IBGZPJMESA-N 380.900 5.628 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3SCCC#N)c(F)c2)cc1 609375587 UFFVLZZNYRPDIG-UHFFFAOYSA-N 390.483 6.059 30 20 GKED N#C[C@H](NC(=O)CCCOc1ccccc1Cl)c1ccc(Cl)c(Cl)c1 609460481 AYXZUJMGRSQCMY-INIZCTEOSA-N 397.689 5.187 30 20 GKED C[C@@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1cccc(C#N)c1 610586500 RCNNFOLGFIZAHI-OAHLLOKOSA-N 383.442 5.052 30 20 GKED C[C@H](N[C@@H]1CCc2c(Cl)cc(Br)cc21)c1cccc(C#N)c1 611166865 PHDSDBCAFKEJGX-BBATYDOGSA-N 375.697 5.312 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 615200843 YMVUHYONGYYGOO-UHFFFAOYSA-N 396.855 5.520 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(OC(F)(F)F)c1 622477767 KKNDOTMXFRHRON-CQSZACIVSA-N 395.274 5.148 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2COCc2ccccc2)n1 626355951 KBQOQKRBKWAHRF-FQEVSTJZSA-N 390.508 5.473 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)C1CCCCC1 726320327 WUVBZFFTTPRSMV-GUYCJALGSA-N 394.487 5.255 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@@H](c1ccccc1)C(C)C 728766664 FLAXDBWTOODIMQ-FGZHOGPDSA-N 390.527 5.289 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1csc(-c2csc(C)n2)c1 729140527 HEPZXZBSKNNWQV-UHFFFAOYSA-N 391.905 5.368 30 20 GKED COc1ccc(/C=C\C(=O)c2sccc2Br)c(Cl)c1OC 730435156 XXUBEEYZACHFKR-HYXAFXHYSA-N 387.682 5.077 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3cc(OC)c(OC)cc3C)cs2)cc1 731317882 FFLZIGVITCKPJI-JXMROGBWSA-N 395.480 5.040 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3C#N)c2)cc1OC 731320134 VSWCTBHKYKUWMC-BENRWUELSA-N 399.446 5.051 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)c2c1 731645898 UGJMDUIFWJAKRR-MRXNPFEDSA-N 389.238 5.051 30 20 GKED O=C(/C=C\c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccccc1Cl 732714056 QOYKSTJWQFLPTM-KTKRTIGZSA-N 387.664 5.389 30 20 GKED Fc1ccc(NCc2c(F)c(F)c(F)c(F)c2F)c(OCC(F)(F)F)c1 733793458 CTKXCBGFWWMEEZ-UHFFFAOYSA-N 389.217 5.074 30 20 GKED COc1ccc(/C=C2/CCCc3ccc(Cl)cc3C2=O)cc1OCCCC#N 735232533 OPFHACUHXDIFHI-AQTBWJFISA-N 395.886 5.634 30 20 GKED Cc1ccccc1-c1noc(CSCc2cc(Cl)ccc2OCC#N)n1 735318290 JULKPQQUOHKYDT-UHFFFAOYSA-N 385.876 5.034 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1cnn(-c2ccc(C#N)cc2)c1C 741806720 OFKSKWRVAVPTDU-UHFFFAOYSA-N 384.270 5.195 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3cccc(F)c3F)n2)cc1 744034683 KDLYRVKBYINKOM-BRWVUGGUSA-N 394.446 5.377 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(F)c(CSC)c2)cc1 747109317 OZGCUCJMGGWGIG-KUHUBIRLSA-N 398.503 5.163 30 20 GKED C[C@@H]1CCC[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)C1 750667762 KUWAXBTWQCXFNT-QWFCFKBJSA-N 390.483 5.343 30 20 GKED Fc1ccc(-c2nnc(SCC#Cc3ccc(C(F)(F)F)cc3)o2)cc1 754270532 VRHBCMBJDDSEQG-UHFFFAOYSA-N 378.350 5.038 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1c(C)nn(CC(C)C)c1Cl)c1ccccc1 759374482 QLQSCQVVAQQKPD-AZUAARDMSA-N 399.966 5.524 30 20 GKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1cc(Br)ncc1F 762425864 WKLGBUAJDBMLJM-SREVYHEPSA-N 389.249 5.003 30 20 GKED CCOCCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCC1 763259107 GMNDNRDSIQLQHR-JOCHJYFZSA-N 376.500 5.268 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(-c2ccco2)s1 766258229 XPZNWHFZBVCOJA-INIZCTEOSA-N 392.480 5.094 30 20 GKED CCCCCC[C@@]1(C)NC(=O)N(c2ccc([C@H](C#N)c3ccccc3)cc2)C1=O 771903035 HNBJIXSGLKZROE-ZJSXRUAMSA-N 389.499 5.127 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 773029917 IHLNOBZRAVLCBX-CYBMUJFWSA-N 381.432 5.185 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21 776959340 XNMGOQBQHHIUSE-JWUVWSEFSA-N 389.499 5.168 30 20 GKED C#CCCCCCC(=O)N[C@@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 780370019 KHMFWOSAICDVBZ-SFHVURJKSA-N 377.488 5.092 30 20 GKED CC(C)(C#N)CCCOC(=O)CCSc1ccnc2cc(Cl)ccc12 784054923 OELFMCXOUWWYMA-UHFFFAOYSA-N 376.909 5.244 30 20 GKED Cc1cnc([C@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cn1 793912809 YIRIXSVOKNMQKG-HNNXBMFYSA-N 378.863 5.062 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801666249 SRUIHVCDJWHJKT-KRWDZBQOSA-N 380.341 5.014 30 20 GKED Cc1cc([C@@H]2CCCN2c2nc(Cl)c(C#N)s2)ccc1Br 804682162 LKDICYGBCJQNOD-LBPRGKRZSA-N 382.714 5.081 30 20 GKED Oc1ccc(Cl)cc1C=Nc1ccc(-c2nnc3n2CCCCCC3)cc1 812415970 SHXZQXPWTAERAZ-UHFFFAOYSA-N 380.879 5.171 30 20 GKED N#CCCC[C@H](NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccccc1 814658690 GMCLFFUHEUUAMQ-KRWDZBQOSA-N 378.259 5.426 30 20 GKED C[C@@H](NCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1 820802932 CZPJFWKOBRBITG-QGZVFWFLSA-N 391.515 5.097 30 20 GKED Cc1cccc2cc(C(=O)Nc3sc4c(c3C#N)CCCC4)c(Cl)nc12 839214089 OGAVZOYHYLGIBJ-UHFFFAOYSA-N 381.888 5.261 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942176 NOOPFDLYVZXRCJ-XHDPSFHLSA-N 378.419 5.094 30 20 GKED C=CCCC[C@@H](NCc1ccc(-c2ccc(Br)cc2)s1)C(=O)O 900068293 DNICFQBJHVXGBS-MRXNPFEDSA-N 394.334 5.077 30 20 GKED N#Cc1c(NC(=O)c2cc3ccccc3c(Cl)n2)sc2c1CCCCC2 915132612 FARJFIOUPYOQQY-UHFFFAOYSA-N 381.888 5.343 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3ccccc3)CC2)cc1 915352131 FLISVGKIRPFWTC-HSZRJFAPSA-N 381.479 5.195 30 20 GKED C=CCN(C(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1)C(C)C 918064364 DHPGBESYJFKCNH-UHFFFAOYSA-N 391.559 5.055 30 20 GKED O=C(Nc1cccc(/C=C2\Cc3c(F)cccc3C2=O)c1)c1ccccc1Cl 921264030 NTQHEYRMGNYUNR-RVDMUPIBSA-N 391.829 5.554 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1CC(F)(F)F 1776355406 KCWDJJOQPGQRCC-VQHVLOKHSA-N 392.373 5.173 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3cc(C(=O)O)ccc3C)ccc21 1777003040 VCEWGYCPZCPKFP-JLHYYAGUSA-N 383.447 5.717 30 20 GKED N#Cc1ccc(CCC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1 24878312 RQIOHBYSJIENNL-VWLOTQADSA-N 380.447 5.143 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(F)cc2)cs1 54895544 LOMYIDFOMFKIQO-XFXZXTDPSA-N 380.444 5.171 30 20 GKED CCc1cc(C#N)c(NC(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)s1 59829183 VTKQUMUFOGMUIE-HNNXBMFYSA-N 376.481 5.255 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccc(F)cc2)CC1 66955462 UMPVYFBQYDPZMT-OAHLLOKOSA-N 383.492 5.073 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3ccccc3OCc3ccccn3)oc12 96942832 ZJDYPUXQKCEBKG-SEYXRHQNSA-N 385.419 5.312 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1ccc(C(=O)Nc2ccccc2)cc1 107701366 IBCNRHIOVFBDFO-UHFFFAOYSA-N 383.495 5.223 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1csc(C2CCCC2)n1 116135284 VFRURDGBXAFKKY-UHFFFAOYSA-N 396.585 5.461 30 20 GKED C[C@@H](c1cccnc1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 128749626 AIVPABIGVQVTNB-HNNXBMFYSA-N 391.858 5.232 30 20 GKED CC(C)Cn1ncc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 131346368 XEHDOZDYZTWHOA-AWEZNQCLSA-N 398.919 5.170 30 20 GKED C[C@@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccc(C#N)cc1 175807347 OEMZLQQXSWSRLN-CQSZACIVSA-N 380.831 5.104 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(CNc3ccccc3)cc2)cc1 176764564 MCLYTYIINWBVIR-UHFFFAOYSA-N 387.508 5.042 30 20 GKED N#Cc1csc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c1 176968007 QLJBPDFFEXCLOY-NSHDSACASA-N 383.325 5.158 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1Br)c1cccc(C#N)c1 190899231 SBJPUBJAEJDDTA-QWHCGFSZSA-N 389.318 5.142 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)sc1-c1ccc(F)cc1 190964532 HMOSYPHZQXHHCT-MRXNPFEDSA-N 387.439 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(c2ccccc2)CC1 191488128 FKTGTJQXYRYIFL-UHFFFAOYSA-N 377.532 5.329 30 20 GKED CCOc1ccc(-c2nnc(SCCCCC#N)n2-c2ccccc2F)cc1 195579891 GCNJBSAZCNNTHP-UHFFFAOYSA-N 396.491 5.258 30 20 GKED CO[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)[C@H](C)C1 282662977 JWMNHTQIMKFLEQ-ZTNFWEORSA-N 397.906 5.027 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1cccnc1 293277618 JPIPFKMUFHDDGI-HNAYVOBHSA-N 380.517 5.091 30 20 GKED COc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cc1 303214216 SFXYHYVSYXGKTN-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC[C@@H](CC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 303214271 PUKZSKJWKUCFQD-SFHVURJKSA-N 375.497 5.128 30 20 GKED O/C(=N/C1CCC1)[C@H](Cc1ccccc1)/N=C(/O)C12CC3CC(CC(C3)C1)C2 328780047 JBASBWGSFCQIHK-IOFSEFHDSA-N 380.532 5.280 30 20 GKED C[C@@H]1C[C@@H]1[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1 330014870 NJRPCEKHYIVJMR-NYNZUECMSA-N 388.939 5.919 30 20 GKED C[C@@H](NCc1cc2ccccc2nc1O)c1ccc(-c2cccc(C#N)c2)cc1 374694623 PNKQERXEHLIZSQ-QGZVFWFLSA-N 379.463 5.330 30 20 GKED CN(C(=O)CC1CC(F)(F)C1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410684967 BBWUXPKXLCCICH-ZDUSSCGKSA-N 389.286 5.203 30 20 GKED COc1cc(Cl)c(Cl)cc1C(=O)[C@H](C#N)c1nc2ccccc2s1 429346976 DKMAKTROSDNAOE-JTQLQIEISA-N 377.252 5.102 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CC[C@@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 437762798 VZBZHFXERVHDGA-AUUYWEPGSA-N 387.405 5.501 30 20 GKED CCCCCN(C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)C(C)C 437891201 RYFLRNAKQIYBJR-UHFFFAOYSA-N 392.503 5.243 30 20 GKED Cc1ccc(Sc2c(Cl)cccc2NC(=O)N2CCC(C#N)CC2)cc1 438375050 MJZCIRZMHAEOED-UHFFFAOYSA-N 385.920 5.567 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OC4CCC4)cc3)n2)cc1 442678549 JNILSPMMUWNWEB-HXUWFJFHSA-N 388.492 5.540 30 20 GKED Cc1csc(C2(NCCC(C#N)(c3ccccc3)c3ccccc3)CCC2)n1 444671720 DMMUCGJTPJBCJV-UHFFFAOYSA-N 387.552 5.320 30 20 GKED CC(C)(C#N)CC(=O)N(Cc1ccccc1)c1nc2ccc(Cl)cc2s1 447126411 YXBOUMQUSAQZOF-UHFFFAOYSA-N 383.904 5.423 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)C1 452562087 HGOSVNJTXWLXIN-LPHOPBHVSA-N 389.474 5.105 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)[C@H](C)c2cccc(C#N)c2)C1 462249987 XEBLJLAPZLLROY-SXGZJXTBSA-N 386.417 5.290 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H]1CCCCC12CCCC2 463458380 XGAOJDZLMBLTDW-YLJYHZDGSA-N 385.577 5.112 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1ncc(-c2cccc(Cl)c2)o1 464821733 JORUSVHSOSQAPS-WOJBJXKFSA-N 377.875 5.267 30 20 GKED COC(C)(C)C[C@@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 466104274 FRMZDZMPKSABRC-DNVCBOLYSA-N 399.922 5.321 30 20 GKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 467606327 GDIJJUKGACWKKB-CRAIPNDOSA-N 379.460 5.011 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2(O)CCCCC2)cc1Cl 468438758 XMNVLEWQWMMZJZ-IBGZPJMESA-N 382.891 5.019 30 20 GKED C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 469417282 BATDNCQCPYDGAY-QGZVFWFLSA-N 393.918 5.302 30 20 GKED CC(C)Oc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1 470564033 KIWWOEOUCWKIBW-MRXNPFEDSA-N 397.887 5.136 30 20 GKED COc1ccccc1CN(Cc1cccs1)C(=O)Nc1ccc(F)c(C#N)c1 470583936 PJMGKFGYPNHMML-UHFFFAOYSA-N 395.459 5.002 30 20 GKED COc1c(F)cc(F)cc1NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 472498764 LJHAPTBOHMZNON-UHFFFAOYSA-N 399.237 5.263 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCn1c(CCC)nc2ccccc21 476795549 QEMWPCWRBOXJCQ-UHFFFAOYSA-N 389.543 5.870 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 477419618 BASKPSCQVAFSQI-KUHUBIRLSA-N 388.389 5.154 30 20 GKED C=CCN(CC1CCCCC1)C(=O)CCc1ncc(-c2ccc(F)cc2F)o1 482909856 IOPFXUJGWZCYLP-UHFFFAOYSA-N 388.458 5.147 30 20 GKED COc1ccccc1-c1csc(C2CCN(Cc3ccccc3C#N)CC2)n1 483486654 FKEGJIPWUJZWPY-UHFFFAOYSA-N 389.524 5.070 30 20 GKED Cc1ccc(CCC(=O)N[C@@H](CCCC#N)c2ccccc2)c(Br)c1 487499389 HMKNFCVKKUNQHK-FQEVSTJZSA-N 399.332 5.242 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Cc2csc3ccc(Cl)cc23)cc1 503325799 VUEASHCTANFBCY-UHFFFAOYSA-N 399.903 5.043 30 20 GKED CCCC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(OC)cc1 503798744 SMTYSNXVZYPJBR-QHCPKHFHSA-N 393.531 5.418 30 20 GKED C[C@@H](CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cccc(C(F)(F)F)c1 504005476 OMVSOMPVHXNUFF-INIZCTEOSA-N 398.428 5.387 30 20 GKED Cc1ccccc1[C@]1(F)CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 505340690 ZBJKKOLMDYFFPX-VGSWGCGISA-N 397.519 5.492 30 20 GKED CCN(C(=O)c1cccc(C#N)c1C)[C@H](c1ccc(Cl)cc1)c1cccnc1 509454130 MZAOOPXBPKJLAW-JOCHJYFZSA-N 389.886 5.167 30 20 GKED CCN(C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1ccc(C#N)cc1 510425947 QWNPSZYAYCYCTJ-UHFFFAOYSA-N 375.859 5.304 30 20 GKED CCCN(CC#N)C(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 510808998 GBYBIVCREVBLDS-UHFFFAOYSA-N 387.439 5.042 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC[C@H]2C2CCCCC2)cc1 511024388 BTNABWCSHDIOMG-QFIPXVFZSA-N 395.547 5.077 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 518137720 PZCIUFADGVXSON-HUUCEWRRSA-N 388.920 5.306 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@H](c2ccccc2)c2ccccc2C)n1 521098481 UXIAYFVOKLHVDR-OAQYLSRUSA-N 388.492 5.320 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)c1ccccc1F 521748306 SABBKLFFDJOUOO-HNNXBMFYSA-N 385.508 5.177 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](CC(C)C)c2ccccc2)cc1 525337314 RUIMNBLHPINMAZ-QHCPKHFHSA-N 390.527 5.269 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N(C[C@H](C)C#N)C3CC3)c(C)c2)c1 533140352 VEFAYCBZUHFVRN-QGZVFWFLSA-N 377.488 5.038 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H](CC(F)(F)F)c2ccc(F)cc2)CC1 540164388 UIQVCYYVBCPGLS-KBWCOIMZSA-N 390.424 5.813 30 20 GKED C[C@H](N[C@H]1c2cc(Br)ccc2SC[C@H]1C)c1cccc(C#N)c1 540593761 KZJGJIYLRPQKFJ-QHRIQVFBSA-N 387.346 5.454 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 544889670 MBCXHINWAPDUMF-CQSZACIVSA-N 377.366 5.203 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ncc(Br)cc1F 550826390 DOAKKQWYWWPMOG-SUMWQHHRSA-N 376.273 5.069 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1csc(-c2ccc(C)cc2)n1 553119193 DBTWEKMRXXTZQZ-UHFFFAOYSA-N 394.544 5.114 30 20 GKED COc1ccc([C@@H](CCC#N)NCC[C@H](c2ccccc2)C(F)(F)F)cc1 556221294 LPNVCBDRWQHRHH-WOJBJXKFSA-N 376.422 5.366 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@H](C)N(C)C(=O)NC[C@@H](C)C#N)c2)cc1 570000586 UNJGKVZIGJDOCL-ROUUACIJSA-N 379.504 5.003 30 20 GKED COc1cc(CN[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)ccc1C#N 581578391 ZVACSJJGAPJNTR-OAHLLOKOSA-N 377.513 5.158 30 20 GKED N#CCCCCCC(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 588146890 FTCUSUQGZGHXSO-LJQANCHMSA-N 393.918 5.543 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)nc(C)n1 588737129 ITZYDORSHRMIMD-QGZVFWFLSA-N 387.508 5.146 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccccc1OC1CC1 588915267 GMXOTRQWKJGSDV-UHFFFAOYSA-N 398.462 5.239 30 20 GKED CCO[C@@H](C)c1nc(CSCc2ccc(C#N)cc2C(F)(F)F)cs1 596342126 IJWSSZZRALWXME-NSHDSACASA-N 386.464 5.564 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)C(F)(F)[C@@H](C)C1 599729393 XNUSUISWFFQOQT-HOTGVXAUSA-N 399.441 5.414 30 20 GKED CCc1ccc([C@@H](NC(=O)CSc2ccc(C#N)cc2)c2cccs2)cc1 603917033 CEUUFTGENZOCDW-JOCHJYFZSA-N 392.549 5.180 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@@H](c3ccco3)C2)cc1 609529615 ULGLBXFDUXQOCC-LJQANCHMSA-N 388.492 5.073 30 20 GKED C[C@H](CCNC(=O)N[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610431969 KJRXEHKAJIJHAH-HUUCEWRRSA-N 389.421 5.131 30 20 GKED CC(C)(C#N)CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 611695693 ZWDVIPSBWYWEKA-QINSGFPZSA-N 387.508 5.063 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2sc(-c3ccccc3)nc2C(F)F)n1 677793446 UPYXIBAUMFKODO-LLVKDONJSA-N 375.425 5.003 30 20 GKED CC(=NNc1ncnc2sccc12)c1ccc(-c2ccccc2[N+](=O)[O-])s1 725819719 XMGGIGJHLZHTDG-UHFFFAOYSA-N 395.469 5.164 30 20 GKED Cc1cc(Br)ccc1N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726477721 ZTLGFBSTOPAQRM-UHFFFAOYSA-N 394.725 5.116 30 20 GKED COc1cccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)c1OC 727267101 CNUIFYDINCQUGD-FMIVXFBMSA-N 383.444 5.171 30 20 GKED Cc1cccc(C(=O)/C=C\c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)c1 729936914 IMXZMXNYRUYQOP-FLIBITNWSA-N 376.408 5.070 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3cc(C#N)ccc3C)c(F)c2)c(F)c1 730489893 WDVJIZIQRIHSTM-UHFFFAOYSA-N 378.378 5.073 30 20 GKED CCCCN(C)c1ccc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)cc1 730668473 JQOVQJZJQSZNMM-UHFFFAOYSA-N 378.520 5.239 30 20 GKED CCCCCCCC(=O)Nc1cccc(CS(=O)(=O)C2CCCCC2)c1 732647179 OLYSZOIRERMOSD-UHFFFAOYSA-N 379.566 5.233 30 20 GKED CCN(CC)C(=O)[C@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 734850231 YFACEXSKQDNVNE-LOSJGSFVSA-N 397.522 5.364 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)cc1 741540823 ZJUBCUJOQLTVEY-ILWGZMRPSA-N 388.417 5.362 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 744073812 GDASXGZJPYJZOA-SMDDNHRTSA-N 386.398 5.207 30 20 GKED C[C@@H](OC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc(C#N)cc1 751290066 VGLJLTCEAHJRCW-KLVRIXIASA-N 377.406 5.311 30 20 GKED C[C@@H](C#N)CN(C(=O)c1sc2cc(Br)ccc2c1Cl)C1CC1 754173834 AZBVIGHSQXKRQN-VIFPVBQESA-N 397.725 5.081 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(OC)c(OCCCC#N)c2)cc1 755607290 WSZLMXRCRYWKLC-SDQBBNPISA-N 381.497 5.386 30 20 GKED CC[C@@H]1CC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)O1 757305212 NOMOZACQHVTDPC-PVXIVEMSSA-N 395.311 5.251 30 20 GKED COc1ccc(/C=C2/CCc3c(Cl)cccc3C2=O)cc1OCCCC#N 758041523 ZOGDXVQGKSANNX-SSZFMOIBSA-N 381.859 5.244 30 20 GKED CC(C)n1ncc2c(C(=O)OCCCCC(C)(C)C#N)cc(-c3ccco3)nc21 768538073 GDSZKAMWQZFNLZ-UHFFFAOYSA-N 394.475 5.149 30 20 GKED CC(C)(C#N)CCCOc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 771182242 UTVAIHKMEWAMSL-UHFFFAOYSA-N 392.411 5.077 30 20 GKED C#CC[C@@H](NCc1ccccc1CN[C@H](CC#C)c1ccccc1)c1ccccc1 775400936 UJBOCZJJJOWWNV-VSGBNLITSA-N 392.546 5.395 30 20 GKED CC(C)(C)[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(F)cc1F 775542510 MTCHAYPTEKCQDA-IBGZPJMESA-N 378.850 5.398 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(Cc4ccc(F)cc4)CC3)n2)cc1 783075669 DHYBDAMQPJHJHN-LJQANCHMSA-N 390.483 5.457 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2ccc(C#N)cc2Cl)cc1OC 788360740 MFZWHPBVWCNTJC-ALCCZGGFSA-N 376.239 5.168 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1nccc2ccccc12 792095956 YREKVMHZAZSVQC-FRHQNKJESA-N 382.463 5.446 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccccc1OC(F)F 792102559 QFUIVYQQHARUFL-QIXNEVBVSA-N 378.378 5.116 30 20 GKED O=C(O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)[C@@H]1CCC(F)(F)C1 809126162 HKJZPZQXLQCENI-KOLCDFICSA-N 376.243 5.287 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)C1 813217337 KNPHBYFZITYEAT-NXHRZFHOSA-N 396.453 5.432 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(-c2ccccc2Cl)o1 916882970 MTNAOXHUUNJCRB-OAHLLOKOSA-N 399.233 5.215 30 20 GKED O=C(/C(=C/c1ccc2c(c1)CCO2)c1nc2ccccc2s1)c1ccccc1 917516207 OMHQJPRIQWVQFA-CYVLTUHYSA-N 383.472 5.655 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)NCc3ccccc3)cc2Cl)cc1 917600480 URLGELDVMXEMJH-UHFFFAOYSA-N 393.899 5.491 30 20 GKED Cc1sc(NC(=O)CSc2ccccc2C#N)nc1-c1ccc(Cl)cc1 1458949426 MSZVKNUMGNZQJR-UHFFFAOYSA-N 399.928 5.374 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(F)cc1C=NNc1ccccc1C(=O)O 1776031224 TZYQKNZSASBCCY-UHFFFAOYSA-N 398.821 5.724 30 20 GKED C[C@@H](ON=Cc1cccc(OCc2cccc(C(=O)O)c2)c1)c1ccccc1 1776083190 QODMKPMUVYBVCT-QGZVFWFLSA-N 375.424 5.076 30 20 GKED O=C(O)C(=O)/C(=C/c1ccc(Cc2ccccc2)cc1)c1ccc2ccccc2n1 1776116763 GGYYAZCUGXUYDR-OQKWZONESA-N 393.442 5.020 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cccc(OCC(=O)O)c2)cc1 1776125700 QQEALBWMYMBBHJ-XNTDXEJSSA-N 396.483 5.395 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCc4c(Cl)cccc4C3=O)cc2)cc1 1777671002 QBYKKYWJOSBXDY-RGEXLXHISA-N 388.850 5.918 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccccc2F)o1)c1nc2c(s1)CCCC2 24090543 OWZNMYMHPHBRMB-UHFFFAOYSA-N 382.460 5.254 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc(Cl)cc3)n2)cc1 66545038 KEWHOQHIPOFWOO-YPHWWSSASA-N 389.867 5.225 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(OCc2nccn2C)cc1)c1ccccc1 90580881 VEUCOOCSXYLWCY-XXBNENTESA-N 375.516 5.357 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 102800265 WUKCZASQJLQTBD-UHFFFAOYSA-N 379.357 5.160 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(O[C@H](C)C#N)cc3)s2)cc1 107718282 TVTRGPHVWQVFTG-IAGOWNOFSA-N 391.540 5.569 30 20 GKED COc1cccc(-c2nc(CN(Cc3ccc(C#N)cc3)C(C)C)cs2)c1 109436666 WXGDRQPWWZMJEP-UHFFFAOYSA-N 377.513 5.101 30 20 GKED COc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1F 124638618 FAYDWDDEEQDJQT-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F 156563654 PPNFVHLMEDUQMQ-NSHDSACASA-N 382.382 5.349 30 20 GKED C[C@H]1CCC[C@H](C)N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 175373990 RFQHLCNFMFDSHA-OALUTQOASA-N 391.515 5.374 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)c3cccc(SCC#N)c3)ccc2C)c1 176016298 QHALNPZWVMNGHI-UHFFFAOYSA-N 389.480 5.359 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2cccc(SCC#N)c2)CC1 177007822 MOXSIJGDYUGZPE-UHFFFAOYSA-N 389.524 5.112 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(CCC(F)(F)F)c1 184064092 YIKRVFCGFOGYLT-ZDUSSCGKSA-N 377.366 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCSc1ccc2c(c1)OCCO2 189883463 DBGDIOWDRITEAQ-UHFFFAOYSA-N 397.540 5.431 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)o1 193517742 KQXVPNCSAWGORV-UHFFFAOYSA-N 389.455 5.207 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C(\C)c3ccc(F)cc3)n2)cc1 211138638 GOQVEIVGDZOXJO-FIIODCPWSA-N 392.455 5.238 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc(NC(=O)CC(C)C)ccc1Cl 303948852 SPWDZZNNYXJNJF-UHFFFAOYSA-N 391.943 5.117 30 20 GKED O/C(CC1CCCCC1)=N/C1CCC(c2nc([C@@H]3CCCCS3)no2)CC1 329736873 STKHGGMYFKRGCB-ABHNRTSZSA-N 391.581 5.981 30 20 GKED N#CCCC[C@@H](NCCC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 411756801 LDPBPJNKRHYAIK-GOSISDBHSA-N 390.314 5.347 30 20 GKED N#CC1(CC[S@](=O)Cc2cc(F)c(C(F)(F)F)cc2F)CCCCC1 417179922 NZIPGEYWALNRCW-VWLOTQADSA-N 379.394 5.096 30 20 GKED N#CCSc1cccc(C(=O)N(c2ccccc2)C2Cc3ccccc3C2)c1 430603365 YKPKEINJPBPDAK-UHFFFAOYSA-N 384.504 5.116 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C1CCC(C(F)(F)F)CC1 435550590 GKQFTOBIULLIQT-UHFFFAOYSA-N 378.419 5.594 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438636695 ZHYPHGQARIFIRP-SFHVURJKSA-N 375.394 5.438 30 20 GKED CCCc1c(NC(=O)c2cc3cc(C)ccc3o2)cnn1-c1cccc(C#N)c1 440084182 VPGQPCKANQJIJC-UHFFFAOYSA-N 384.439 5.003 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 446371578 FIOFIWIBFWTGGE-UHFFFAOYSA-N 399.450 5.051 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(Cc3cc(C#N)cs3)C2)n1 447061680 XURRCOZCHRXSCA-INIZCTEOSA-N 395.553 5.131 30 20 GKED COCC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 453336948 GEFORHMVSPCDKG-DJJJIMSYSA-N 380.385 5.145 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1 455787840 GGSDYOCAUPAMJU-IBGZPJMESA-N 380.492 5.136 30 20 GKED CCC1(C)CN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 463758207 XUQKNLLRQSJJCC-UHFFFAOYSA-N 383.879 5.054 30 20 GKED Cc1oc2ccccc2c1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 467334909 IXBDASLPPBKURX-AWEZNQCLSA-N 379.485 5.315 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCCc4c(Cl)cccc43)ccc21 469155754 DDVKJDYYKRMYBL-OAQYLSRUSA-N 393.918 5.412 30 20 GKED N#C[C@H](NC(=O)c1cc(F)ccc1-c1ccoc1)c1cccc(Cl)c1Cl 471088027 CQWBATUTVKZNQK-KRWDZBQOSA-N 389.213 5.387 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(-n2cccn2)c1 475575979 ULOWUEKUKWOPPT-GOSISDBHSA-N 388.515 5.607 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccc(F)c(F)c1F 475588644 YSEUCOTVSNNKPR-UHFFFAOYSA-N 376.422 5.320 30 20 GKED CC[C@@H](N[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc(C#N)cc1 479528725 JSOXWMOIZVGVOC-MSOLQXFVSA-N 382.813 5.005 30 20 GKED Fc1ccc([C@@H](NCc2nc3cc(C(F)(F)F)ccc3o2)C(F)(F)F)cc1 484880609 GOMWGYHXCANRKE-OAHLLOKOSA-N 392.274 5.379 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1C 485247158 RHNVVUHQAFGQLE-GOSISDBHSA-N 385.552 5.124 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1)c1c(C)noc1C 493960592 MQNDHAVOVUHVEQ-IBGZPJMESA-N 375.428 5.088 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(NCCc4ccccc4)cc3)CC2)c1 497018360 OWIJXEKQDFLMAW-UHFFFAOYSA-N 399.469 5.022 30 20 GKED C=CCCO[C@@H](C)c1nc([C@H](Oc2ccc(Br)cc2)C(C)C)no1 508682046 VOJQORBOSGRDQR-XJKSGUPXSA-N 395.297 5.262 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCC(=O)Nc1cc(Cl)ccc1F 510195452 FAVJSFHJNYZTHS-UHFFFAOYSA-N 397.862 5.144 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1sccc1C 510920143 VHZSHLMMIYYIBQ-UHFFFAOYSA-N 391.496 5.693 30 20 GKED Cc1ccc(CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c(C)c1 511336965 BVHCYPSUNLJHDW-UHFFFAOYSA-N 399.494 5.270 30 20 GKED Cn1c([C@H](C#N)C(=O)c2ccc(-c3ccc(Cl)cc3)s2)nc2ccccc21 513676353 CVCRBSGBWAOJHC-OAHLLOKOSA-N 391.883 5.445 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(Cl)c(OC)c(Cl)c1 513968570 GLYKCMHRWMSPCB-UHFFFAOYSA-N 383.250 5.361 30 20 GKED N#C[C@@H](C(=O)c1csc(C2CCCCC2)n1)c1ccc(C(F)(F)F)cn1 515375816 JOTFWRVFPBJAID-CYBMUJFWSA-N 379.407 5.095 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H]1CCCc2ccccc21 518127707 IGPAOLJGEXQZOU-OXJNMPFZSA-N 396.581 5.830 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc(C)c1OC(F)F 518140026 NTMQVJHIPRHALT-LBPRGKRZSA-N 390.455 5.409 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 518654135 BMUXURRVFXTRBU-OAHLLOKOSA-N 392.842 5.410 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cccs1 518681980 OBKQQYQGYVMKNC-DOTOQJQBSA-N 387.574 5.909 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1sc(-c2ccccc2)cc1OCc1ccccc1 518759594 LHKPQKHWUMZIPO-QGZVFWFLSA-N 390.508 5.226 30 20 GKED C=CCCO[C@@H](C)C(=O)N(Cc1ccccc1)c1nc2c(C)cccc2s1 519071159 OALNVZQYKRGKFE-KRWDZBQOSA-N 380.513 5.119 30 20 GKED COc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 520940492 UGMMYSGAGXDRIY-MRXNPFEDSA-N 397.544 5.232 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CC/C=C/c2ccccc2)cc1 523100848 HZOJOWFIBQBDLB-ONNFQVAWSA-N 396.490 5.764 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2ccc(C#N)cn2)C(C)C)s1 523311672 PAGHDPMHVFZEIA-UHFFFAOYSA-N 375.497 5.041 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N(C3CCCC3)C3CC3)c2)cc1 531079897 HJCNALDGJRCUOF-UHFFFAOYSA-N 389.499 5.271 30 20 GKED C=CCC[C@@H](NCc1ccc(Br)cn1)c1ccc(C(F)(F)F)cc1 533528396 RZSFZPQMWIGLPQ-QGZVFWFLSA-N 399.254 5.660 30 20 GKED CCOC(=O)c1nc(-c2ccccc2)oc1CSc1cccc(Cl)c1C#N 536724967 ZEJMYBOKECPDIF-UHFFFAOYSA-N 398.871 5.336 30 20 GKED CC[C@@H](C)[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 538188265 PYWDKRXEGBPKME-VLIAUNLRSA-N 380.879 5.139 30 20 GKED C[C@H](NCc1ccn(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541994979 OIPSGAKCZVRBBV-IBGZPJMESA-N 378.479 5.262 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 542003867 PYPZZAQZZKXBNX-LBPRGKRZSA-N 378.419 5.259 30 20 GKED N#CCCCCN[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 542122895 ILTATXZYAVLVPC-LBPRGKRZSA-N 392.265 5.611 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)c2ccc(Sc3ccccc3C#N)cc2)C1 542585014 QGCRBFPNLILLQC-VGSWGCGISA-N 399.519 5.328 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)N[C@@H](c1ccccc1)c1cccs1 543031068 YQOUEMAOIXYISG-FQEVSTJZSA-N 398.940 5.271 30 20 GKED N#CCCCOc1cccc(N[C@@H](Cc2cccnc2)c2ccc(Cl)cc2)c1 546872680 XNCRQESRTVTOMQ-QHCPKHFHSA-N 391.902 5.813 30 20 GKED N#CCc1ccccc1NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 561798483 YDHPPLGPEQADLZ-UHFFFAOYSA-N 397.453 5.611 30 20 GKED CC(C)(C(=O)Nc1cc(Br)ccc1Cl)c1cc(F)cc(C#N)c1 565649754 VIRFQGQGFWWNOL-UHFFFAOYSA-N 395.659 5.030 30 20 GKED N#Cc1c(F)cccc1/C=C1/CCn2c1nc1scc(-c3ccccc3)c1c2=O 567530642 AYBFXBZFPDQLRO-WJDWOHSUSA-N 399.450 5.080 30 20 GKED Cc1oc(C#N)cc1-c1nc(CC2(SCc3ccccc3)CCCC2)no1 579644438 HIDGWXBTHGKGAL-UHFFFAOYSA-N 379.485 5.298 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCN(C)c2ccccc21 581471336 MDWJTFIFLRAZJE-FUHWJXTLSA-N 394.544 5.031 30 20 GKED CCCOc1ccc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)cc1OC 589504922 ZYQYGOYPDOZNLZ-CQSZACIVSA-N 392.421 5.225 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C)OC2(CCCCC2)C1 594073059 ZMAWEPIZOQVPOA-SJORKVTESA-N 387.549 5.036 30 20 GKED Cn1ccc2c(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cccc21 607274069 DUTWGSXCKJDGJW-QGZVFWFLSA-N 391.883 5.445 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H](C)c1ccccc1 609078672 GTGNPVWVXIXAKV-LJQANCHMSA-N 399.494 5.671 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176583 RSIVIMAXNOMCPG-QGZVFWFLSA-N 386.451 5.491 30 20 GKED Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)sc1C 609378321 DPTNAVWTOPVRMS-UHFFFAOYSA-N 384.448 5.642 30 20 GKED N#C[C@H](NC(=O)C[C@@H]1CCc2ccccc21)c1ccc(OCc2ccccc2)cc1 609661951 NFTKKQZMOBUTRY-DHLKQENFSA-N 396.490 5.067 30 20 GKED Cc1cc(CN(C)C[C@@H](C#N)CCC#N)cc(C)c1OCc1ccccc1Cl 609681739 VZZNKFGWQHVLGR-LJQANCHMSA-N 395.934 5.411 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cc(F)ccc2F)c1 609722528 JMGJKYVUIORUHF-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C[C@@H](NCc1ccccc1CN[C@H](C)c1cccc(C#N)c1)c1cccc(C#N)c1 611387320 KIKJFMFLOYZGTB-WOJBJXKFSA-N 394.522 5.132 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccc(O)cc2)n1 731373140 HHPFCDFHWBZUMP-CYBMUJFWSA-N 395.509 5.162 30 20 GKED O=C(/C=C/c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccc(Cl)s1 732713839 MHJBVMJXZJCIIX-VMPITWQZSA-N 393.693 5.450 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)c2cc3ccccc3s2)c1 733848593 ZCNWEHHAOADFAK-MAUKXSAKSA-N 393.512 5.143 30 20 GKED N#CCOc1ccc(CC(=O)Nc2cccc(CSC3CCCCC3)c2)cc1 735018336 QNUUOKUFEXCRGK-UHFFFAOYSA-N 394.540 5.336 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3cc(C)c(F)c(C)c3)cs2)cc1 741467585 OWGLWMIQVOBHSZ-WTKPLQERSA-N 397.471 5.383 30 20 GKED COc1cccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743038154 WGAHWTOQNRHOJL-UHFFFAOYSA-N 393.443 5.307 30 20 GKED C=CCN(C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F)C(C)C 743191405 BXCACYSUIHHMNB-UHFFFAOYSA-N 382.398 5.491 30 20 GKED O=C(/C=C/c1cnc(-c2ccc(Br)cc2)s1)c1cncc(F)c1 751536539 VSRGLOJNSKNTHC-AATRIKPKSA-N 389.249 5.003 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](Cc1ccccc1)c1cccs1 754366620 JUKMPOYLIUBBSP-IBGZPJMESA-N 382.916 5.377 30 20 GKED Cn1cc(C=NOc2ccccc2C(F)(F)F)c(-c2cc3ccccc3o2)n1 754722320 BOXLYAMIANHRMT-UHFFFAOYSA-N 385.345 5.265 30 20 GKED C=CCC[C@@H](NCc1cc(C)c(OCc2ccccc2Cl)c(C)c1)C(=O)O 756387293 LDGNFMUQWVQDLZ-HXUWFJFHSA-N 387.907 5.045 30 20 GKED COCCC1(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCCC1 761048535 OARSLCFYCWFDMS-ZDUSSCGKSA-N 396.434 5.088 30 20 GKED CC(C)[C@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1cccc(Cl)c1 764307203 OSEFESPCCYHCBR-INIZCTEOSA-N 392.242 5.152 30 20 GKED Cc1nc(CCC(=O)OCc2ccccc2C(C)(C)C#N)oc1-c1ccccc1 768022387 LYUSIOQVLIHNEC-UHFFFAOYSA-N 388.467 5.127 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCc3sccc3[C@@H]2c2cccs2)cc1 768209468 YIBXCKDPUJUGLD-QVKFZJNVSA-N 380.538 5.248 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cccc4nccn34)cc2Cl)c1 779596606 YPWKKPFTLLPLOF-UHFFFAOYSA-N 388.858 5.050 30 20 GKED C=C[C@@](C)(CCOC)COC(=O)c1nc(-c2ccc(Cl)c(Cl)c2)oc1C 784623685 CXTWJBZVHUQTAW-IBGZPJMESA-N 398.286 5.342 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](O)c1c(F)cccc1Cl 789452136 QNTLTUVNTRJJHR-GOSISDBHSA-N 390.886 5.186 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 791751843 QLJHJNXQYXJXEY-RUZDIDTESA-N 395.506 5.952 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797569063 MWHLFIBDXOWQAP-IRXDYDNUSA-N 384.545 5.598 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C\Sc1cc(F)ccc1F 797867712 RXMQMAHGENBUJC-FUWURINLSA-N 390.480 5.604 30 20 GKED Cc1nn(C(C)C)cc1/C=C1\Cc2c(Cl)cc(Br)cc2C1=O 798370484 OCLVULFUYGVYHO-NYYWCZLTSA-N 379.685 5.011 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCC2)c(F)c1 815635865 KJTDUTAMCVWWHQ-WMZHIEFXSA-N 379.523 5.902 30 20 GKED C[C@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1(F)F 817713614 UIOHJSORCJDBAD-MEBBXXQBSA-N 387.238 5.338 30 20 GKED Cc1nc2ccccc2cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915088135 ZWWYWBVORKEHMM-HSZRJFAPSA-N 377.447 5.451 30 20 GKED O=C(O)Cc1ccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)cc1 915987883 MFUDKTAKSRQYOU-LUAWRHEFSA-N 389.432 5.080 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc(Cl)cc3)n2)cc1 916627345 NRPAPNJLZLHBCS-HJLMUGLJSA-N 378.884 5.662 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc2ccccc2n1C(F)F 917041895 ZUMZTNMENRWQEQ-LJQANCHMSA-N 399.400 5.493 30 20 GKED O=C(/C=C\c1cccc([N+](=O)[O-])c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605096 NUHUSCFKUDQQIY-HJWRWDBZSA-N 380.381 5.128 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(Cl)c(F)c1 921255427 RUSWPGATLCLWMG-UHFFFAOYSA-N 397.862 5.108 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cccc4ccccc34)cc2)cc1 1776114329 MLHRJKFFVGEEKN-LICLKQGHSA-N 378.427 6.101 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C/C(=O)c3cc(C(=O)O)ccc3O)o2)cc1 1776271487 TZFUQSOTHDMGHN-FMIVXFBMSA-N 390.435 5.544 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccsc2)cc1 1776354469 NDMGUPPHPQJUOY-WEVVVXLNSA-N 392.476 5.797 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776388568 GXSQQMMNLQTYHZ-CLFYSBASSA-N 384.428 5.422 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2cccc(SC(F)(F)F)c2)cc1)C(=O)O 1776470392 MIIIFFYUVARKNZ-UMAGTOLTSA-N 396.386 5.047 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(C(F)(F)F)ccc1Cl 1776784162 VQENOSNIVCISIW-HNNXBMFYSA-N 379.850 5.652 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CCC[C@@]3(C(=O)O)CCC[C@@H]23)cc1 1776785894 OHJXLFGQZYOYDY-QPPBQGQZSA-N 385.548 5.449 30 20 GKED CCCCCCCOc1cccc(CNCCCCC2(C(=O)O)CCC2)c1 1776788718 RHJOTEXLHGCFQZ-UHFFFAOYSA-N 375.553 5.551 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2cccc(C(=O)O)c2)cc1OCC 1776814627 CDLPDYLGNIPKCS-HJWRWDBZSA-N 388.847 5.122 30 20 GKED COc1ccc2c(c1Cl)C(=O)/C(=C/c1ccc3oc(C(=O)O)cc3c1)CC2 1777373620 LQVCKTZFXAGUKP-MDWZMJQESA-N 382.799 5.006 30 20 GKED O=C(O)c1ccc2scc(/C=C3\CSc4c(Cl)cccc4C3=O)c2c1 1777685580 NMBXIJJBQHNHKV-WUXMJOGZSA-N 386.881 5.625 30 20 GKED N#Cc1ccc(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)c(F)c1 11645917 PPGHYEZSAWEEDT-IBGZPJMESA-N 393.487 5.032 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2ccc(C)cc2C)cc1 27177217 YYAHOZLPFCRXRC-UHFFFAOYSA-O 395.573 5.320 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1 46065304 RRZMWMJLGVDYCG-GOSISDBHSA-N 379.504 5.028 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 48483259 PFUJIJYJUOGMGA-UHFFFAOYSA-N 385.467 5.159 30 20 GKED COc1ccc(-c2cc(C(=O)N(C)c3cccc(C#N)c3)c3ccccc3n2)cc1 60083727 WETRQNUITCZZFW-UHFFFAOYSA-N 393.446 5.059 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 60459749 KXCVRWNBQPIVAI-UHFFFAOYSA-N 392.889 5.353 30 20 GKED COc1ccc(C#N)cc1NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 64741842 PQFOIQGLQNPNSO-LJQANCHMSA-N 397.887 5.193 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)Nc2cccc(C(F)F)c2)CC1 111747491 VFJRAYFCSDMGKV-UHFFFAOYSA-N 385.414 5.008 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(-c3nccs3)cc2)c1 113530938 BPALQMRKISTDJC-UHFFFAOYSA-N 378.457 5.137 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccc(O)c2F)c1 129749754 HVXUOZZAGOPYQE-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 160039228 KRTKQHFDPJDBTR-SOLBZPMBSA-N 383.517 5.679 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c2)cs1 173137556 BTGHLVKJZUAKMK-AWEZNQCLSA-N 393.537 5.623 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(Oc2cccnn2)c1 173169879 RZGXHLKEXTYOMD-UHFFFAOYSA-N 392.418 5.060 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)o1 176344033 FRSFVQQFTCLWAC-OAHLLOKOSA-N 378.453 5.718 30 20 GKED CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 178056522 AXYQQLBWNYRWKO-PZJWPPBQSA-N 396.581 5.255 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1COc1ccccc1 183787017 FJHFTTSKSBPPBS-QGZVFWFLSA-N 387.439 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(NC(=O)CCC)c1 191416556 QCVGQPCANNKWDT-UHFFFAOYSA-N 393.531 5.599 30 20 GKED N#CCCCOc1cccc(CNC2(c3ccc(Br)cc3)CCC2)c1 236680795 DAJKLMPGYCIVMU-UHFFFAOYSA-N 399.332 5.301 30 20 GKED Cc1cc(CSc2nc(-c3ccc(C)o3)cc(C(F)(F)F)c2C#N)no1 303646454 STONNWVNXSJNHM-UHFFFAOYSA-N 379.363 5.129 30 20 GKED CC1(C)CC[C@@H](/N=C(/O)C2CCN(c3noc4ccc(Cl)cc34)CC2)C1 329053115 XAMYTYIPEGJMIG-OAHLLOKOSA-N 375.900 5.233 30 20 GKED COc1ccc([C@H](C)/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)cc1F 329425246 GRKXPMMWNVQGCP-MAUKXSAKSA-N 399.510 5.359 30 20 GKED C[C@H](C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 409746281 AANMMLGSMALIKW-CWFSZBLJSA-N 386.417 5.107 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 425454797 SAYMGHKQELOBBI-OLZOCXBDSA-N 376.287 5.329 30 20 GKED Cc1ccccc1Cc1noc(CNc2cccc(Oc3ccc(C#N)cc3)c2)n1 430968438 APENFOFIAHSKOY-UHFFFAOYSA-N 396.450 5.245 30 20 GKED N#CCCC[C@H](NCC(=O)N(c1ccccc1)C1CCCCC1)c1ccccc1 433012755 LTURQDZFFRYRNU-DEOSSOPVSA-N 389.543 5.377 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 433778191 UXTHGOHKUNMGNN-CQSZACIVSA-N 381.423 5.401 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)c(Cl)c1 439445204 WFVVKYNDTUMBGA-OAHLLOKOSA-N 392.730 5.624 30 20 GKED Cc1ccccc1[C@H]1C[C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 439509375 DVVRHOBHMOIYFL-KZNAEPCWSA-N 379.529 5.457 30 20 GKED CC(C)[C@H](c1ccccc1Cl)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 441401895 NPALMUDXAGPYCA-HXUWFJFHSA-N 380.879 5.091 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1)C(C)C 443878937 CHCSZYPGDHJOKD-UHFFFAOYSA-N 389.421 5.060 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444015991 BWWKWFUIZTYZES-AWEZNQCLSA-N 382.348 5.307 30 20 GKED CC(C)[C@@H]1C[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc21 447597077 FCCPOIJHWCJJRF-XZOQPEGZSA-N 387.527 5.566 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(Cl)ccc1C(F)(F)F)c1ccccc1 455408740 KHAKKJYFPXOZPP-INIZCTEOSA-N 395.812 5.915 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)c1ccccc1 456041438 BDHUVFJRHAKKNZ-ZCNNSNEGSA-N 397.316 5.104 30 20 GKED CCSc1cc(Cl)ccc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 462020502 MZNLRRKXHAPGAU-CYBMUJFWSA-N 384.810 5.356 30 20 GKED CCC(CC)N(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H]1CCCc2cccnc21 464479556 IUFKNPFLDRSFPU-JTSKRJEESA-N 375.516 5.152 30 20 GKED C=C(C)COc1cc(CNCc2cc(Cl)ccc2OC(F)F)ccc1OC 465017943 VWQQLOBUUBRNNC-UHFFFAOYSA-N 397.849 5.195 30 20 GKED Cc1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)c(OCC(F)(F)F)c1 471362522 OSXTXBRBJQMCCG-UHFFFAOYSA-N 395.274 5.346 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccccc1OC(F)F 475568759 FQKTZXRTJUVOIX-UHFFFAOYSA-N 388.458 5.504 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1NC(=O)C[C@@H]1C=CCC1)c1ccccc1 475760659 ORJATPITXOGVMZ-QUCCMNQESA-N 387.483 5.007 30 20 GKED CC(C)OCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)oc2ccccc12 483194146 IGNAJGFDDHVLEA-IBGZPJMESA-N 384.435 5.396 30 20 GKED C=C(C)COc1cc(CNc2cn(CC(C)C)nc2C(F)F)ccc1OC 486490218 PSQSUWFHWHFCTC-UHFFFAOYSA-N 379.451 5.052 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3c(F)cccc3[nH]2)cc1 490627901 PCWKINZRJXXFAC-UHFFFAOYSA-N 399.425 5.204 30 20 GKED N#CC1(CCCN2CCCCC[C@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 499773422 OPQKUPKUSBKNNM-FQEVSTJZSA-N 394.481 5.723 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc(Cl)s3)c2)cc1 501446408 GVDPVHBSRVTEHY-UHFFFAOYSA-N 382.872 5.299 30 20 GKED CCN(C(=O)c1sc(-c2cccs2)nc1C)[C@@H](C)c1ccc(C#N)cc1 509563259 FGOPLPIIZHIUCF-AWEZNQCLSA-N 381.526 5.275 30 20 GKED Cc1ccccc1[C@H](C)N(C)C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 511592038 KKPSZUADCYHWCR-AWEZNQCLSA-N 391.393 5.033 30 20 GKED N#C[C@H](C(=O)c1occc1CSc1ccccc1)c1nc2ccccc2s1 513686739 FJDMVDJPBFRKQS-MRXNPFEDSA-N 390.489 5.672 30 20 GKED CC(C)OCc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 515539959 HCWDUDMHGVQRFI-INIZCTEOSA-N 384.888 5.365 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(Cl)cc1 517447463 HCYDJHOWRKNBDH-AWEZNQCLSA-N 390.961 5.606 30 20 GKED N#Cc1cc(NC(=O)CCc2nc3cc(Cl)ccc3s2)ccc1Cl 520764867 KPIMEBKAKSCJQG-UHFFFAOYSA-N 376.268 5.046 30 20 GKED N#Cc1ccc(CC(=O)N(Cc2cccs2)C23CC4CC(CC(C4)C2)C3)cc1 525138556 NAMIOXBFSYWBAY-UHFFFAOYSA-N 390.552 5.160 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 525140182 JDJNTKRAEYXRJH-UHFFFAOYSA-N 397.297 5.610 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1c(F)cccc1F 534136666 CRROCZNCHRREPW-UHFFFAOYSA-N 398.796 5.559 30 20 GKED CC(=O)N(c1ccccc1)c1nc(CSc2cccc(Cl)c2C#N)cs1 536736608 VFLKDVBRENTOFK-UHFFFAOYSA-N 399.928 5.645 30 20 GKED N#Cc1ccc(CN(C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)C2CC2)cc1 541384440 UGOGHQPXLMNQFR-MSOLQXFVSA-N 385.294 5.160 30 20 GKED C[C@@H](NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1ccc(C#N)cc1F 545943974 YHTKRZZWWMKNJI-QAPCUYQASA-N 391.515 5.277 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1cc(Cl)ccc1NCc1ccccc1 556897495 XZJUTQTZEYEIBI-UHFFFAOYSA-N 393.849 5.144 30 20 GKED O=C(NCCc1ccccc1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 560165226 BEQQELZDZLMQCM-UHFFFAOYSA-N 394.290 5.228 30 20 GKED N#Cc1ccc2ncc(CN[C@@H](c3ccccc3)[C@@H]3CCCc4ccccc43)n2c1 560259630 ZIQWRJMBKWIATC-RSXGOPAZSA-N 392.506 5.157 30 20 GKED N#Cc1cc(Br)ccc1CNc1ccc(Oc2ccccn2)cc1 579403345 HOYUNHCHFWWQPU-UHFFFAOYSA-N 380.245 5.120 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@](C)(C#N)C1CCCCC1 580734229 LGYXTNABFMAQEG-GOSISDBHSA-N 393.965 5.426 30 20 GKED CC(C)n1c(S[C@H](C)c2ccc(C#N)cc2)nc2cc(Cl)ccc2c1=O 583717030 AMCVUAMBTXPLPE-CYBMUJFWSA-N 383.904 5.356 30 20 GKED Cc1cccc(-n2ncc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2C)c1 592273636 OEUOLCBMLRHSPA-OAQYLSRUSA-N 387.487 5.046 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603621904 CERCFQBBZYDQBT-UHFFFAOYSA-N 389.480 5.175 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3csc4ccccc34)c2)c1 603996003 ZECNUCCJLFRICA-UHFFFAOYSA-N 397.459 5.278 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)cs2)c(C)c1 605363064 FWLXURZNWHQGEJ-MRXNPFEDSA-N 386.480 5.102 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3cccc(OCCCC#N)c3)c(F)c2)cc1 609298563 XLLUSUMDODDVGH-UHFFFAOYSA-N 388.442 5.736 30 20 GKED C[C@H](Sc1c(C#N)nnc2ccccc12)c1ccc(OC(F)(F)F)cc1 610129741 KJEFNAZPRPFBTE-NSHDSACASA-N 375.375 5.253 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3n[nH]cc3c2)cc1Cl 610436204 GVRREYQTFHJPSA-IBGZPJMESA-N 386.842 5.124 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 610715100 GVFZETHFPHXEAR-QWRGUYRKSA-N 390.249 5.144 30 20 GKED C#Cc1cccc(NC(=S)NCc2ccc(-c3nc4ccccc4s3)o2)c1 726449818 COVUMTZFZIUPEB-UHFFFAOYSA-N 389.505 5.024 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNc1ccccc1Br 732923822 KIOYXDWIQCPAEQ-UHFFFAOYSA-N 375.600 5.150 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 734206408 ZNSAAVMYUWBMNN-AUSIDOKSSA-N 375.516 5.632 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)OC(=O)Cc1ccc(C#N)cc1 734727853 DWQKEFZHJKRSQR-CQSZACIVSA-N 396.899 5.491 30 20 GKED C[C@H](S[C@H](C)c1cccs1)C(=O)Nc1sc2c(c1C#N)CCCCC2 737401886 HIFDJCUUXTUZPC-OLZOCXBDSA-N 390.599 5.772 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)c(SC)cc1OC 741166138 WNTBRZIFFOCWJC-BQYQJAHWSA-N 382.403 5.341 30 20 GKED COc1ccc(CN[C@H](c2cc(F)ccc2F)c2ccccc2Cl)cc1C#N 742378354 GBUZPIOMLGXRIC-QFIPXVFZSA-N 398.840 5.378 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=S)Nc1ccc2c(c1)CCC2 745724401 QHNPWWRMUBAVBN-UHFFFAOYSA-N 383.520 5.451 30 20 GKED C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc(C#N)cc1 748679705 MNJMLCIOMHTUML-CQSZACIVSA-N 380.831 5.104 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCC[C@@H]2c2ccccc2)cc1 762819099 RDNAZKQGQHFUJS-LOSJGSFVSA-N 395.506 6.101 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)c2ccccc12 765255315 UZHNDVAAMSBEGX-CABCVRRESA-N 393.874 5.667 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3cn(CCCC#N)c4ccccc34)c2)[nH]c1C 767685383 UBDHMALHHRRBPX-UHFFFAOYSA-N 397.482 5.204 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cn(C)c2ccccc12 772161769 MECQMJSYKKYOMX-JPYJTQIMSA-N 393.490 5.576 30 20 GKED C=C(C)[C@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1ccc(F)c(F)c1 773290791 OHQLJPSSLNRZPM-SGTLLEGYSA-N 387.455 5.252 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccccc3)s2)c(Br)c1 777931358 XAYIWQVWXUGHEQ-UHFFFAOYSA-N 388.315 5.132 30 20 GKED C#CCCCCCC(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 783536583 OHVBFQHRQKFTBF-INIZCTEOSA-N 379.344 5.351 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C#Cc1ccc(C(F)(F)F)cc1 790818557 PWFUJOIFGONMJW-CQSZACIVSA-N 394.462 5.165 30 20 GKED N#Cc1ccc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)cc1 796472843 YLDBEELXMTVKRL-QGZVFWFLSA-N 378.690 5.241 30 20 GKED Oc1nc(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)nc2ccccc12 799483822 OEWUUEVNPZYETH-CYBMUJFWSA-N 386.377 5.090 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nn(Cc2ccccc2)c1Cl 800152620 DJMGVHKKORNJGW-UHFFFAOYSA-N 379.891 5.264 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 805857418 UMQAHKRONSBJAS-IERDGZPVSA-N 397.503 5.413 30 20 GKED N#CCCC[C@@H](NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1ccccc1 817318936 IZSOQQUMOFGDMW-QZTJIDSGSA-N 378.369 5.267 30 20 GKED Cc1csc(SCc2c(C(=O)NCC(C)(C)CC#N)oc3ccccc23)n1 837885320 NBTPZUYEOLLQAI-UHFFFAOYSA-N 399.541 5.160 30 20 GKED N#Cc1ccc2c(c1)CN(C(=O)Nc1ccc(N3CCCCCCC3)c(F)c1)C2 847165381 IJBLDCOSQCRUKT-UHFFFAOYSA-N 392.478 5.016 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(Br)cc2)cc(Cl)c1O 916134293 JDMYSVSSCSEZRK-FPYGCLRLSA-N 381.653 5.103 30 20 GKED C(=NNc1ncnc2sccc12)c1ccc(-c2nc3ccccc3s2)o1 916368274 KSLMMPHOXWLILG-UHFFFAOYSA-N 377.454 5.007 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCSc2ccccc2)cc1 916953731 DMBBNDNTPMCZTD-UZLBHIALSA-N 380.513 5.030 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)/C=C\c1ccc(C(C)(C)C)cc1 920106406 PJRBLMUMAFKLSJ-ACQXMXPUSA-N 384.479 5.379 30 20 GKED Cc1cccc(COc2c(C)cc(C=NNc3cccc(C(=O)O)c3)cc2C)c1 1776036877 ITSGGVAMIITKGD-UHFFFAOYSA-N 388.467 5.335 30 20 GKED CC(C)COc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776332968 PSIWBCYTFRGZOP-YRNVUSSQSA-N 382.456 5.103 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)cc1 1776339907 PQINVQLOEZJWJO-YVMONPNESA-N 387.273 5.242 30 20 GKED CC1(C)/C(=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)C(=O)c2ccccc21 1776515351 RCBMVGVPDLBBGK-HAHDFKILSA-N 398.458 5.521 30 20 GKED CCCCCCCC[C@@H](C)C(=O)Nc1cc(C(=O)O)cc(Br)c1C 1776786032 DOASZEPAWKMFLM-CYBMUJFWSA-N 398.341 5.781 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2ccc(-c3ccccc3F)o2)S1 8205954 MPPKMLQORSSAOG-XDHOZWIPSA-N 392.455 5.594 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 25103456 CHHORONNHNXTPG-UHFFFAOYSA-N 393.446 5.152 30 20 GKED CC(C)(CNC(=O)c1ccccc1Sc1ccccc1C#N)c1ccccc1 32474217 OSJCKLDNEQZFTP-UHFFFAOYSA-N 386.520 5.417 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)c1ccccn1 41492594 ZFDKOXGCGXJIHE-GOSISDBHSA-N 382.341 5.383 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3ccc(SC)cc3)cc2c1C 58745137 BVDFGZJSHNIZEH-RMKNXTFCSA-N 383.494 5.009 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1csc(-c2ccccc2Cl)n1 72090438 QVEHTISEZDMSRS-UHFFFAOYSA-N 393.899 5.164 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3c3ccncc3)c2)cc1 105039770 KYBGUPAZXSMYIX-QFIPXVFZSA-N 384.439 5.115 30 20 GKED CC(C)C[C@H](C)OCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 120777385 BZNBXWFURYNWNZ-UONOGXRCSA-N 392.471 5.106 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc(C)cc1 122024659 RVPHTPWHJKUSHF-APWZRJJASA-N 375.497 5.274 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccc(C#N)cc1 122720349 HSGFGQIZMNLXED-AWEZNQCLSA-N 387.405 5.012 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)ncc2Cl)sc2c1CCCCCC2 126715907 INHLLRTXVSWFRM-UHFFFAOYSA-N 380.300 5.233 30 20 GKED N#Cc1cc(NCc2ccc(NC(=O)c3ccco3)cc2)ccc1C(F)(F)F 165367260 CNYFTCJZEICIPV-UHFFFAOYSA-N 385.345 5.034 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(F)c1 171742350 UBEJYKMIJDHIPQ-HNAYVOBHSA-N 383.492 5.446 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1cc(Br)ccc1F 177908715 BAJHVFLPGRHASV-FPYGCLRLSA-N 399.219 5.067 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)N(CCC#N)Cc2ccccn2)cc1 178055922 JNUSKTIVPYKRBM-UHFFFAOYSA-N 386.455 5.130 30 20 GKED N#C[C@@H](C(=O)c1occc1-c1ccc(F)cc1)c1nc2ccccc2n1C(F)F 178709830 CHIASWGYQIFPKG-HNNXBMFYSA-N 395.340 5.321 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN(C)Cc2cccc(C#N)c2)on1 180912130 RNONAECZBXBQDI-UHFFFAOYSA-N 383.451 5.007 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)CC1(c2ccccc2)CC1 190186614 JWXJBZNFMFPJMG-QGZVFWFLSA-N 379.529 5.134 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1cccs1)C[C@@H]1CCCO1 191485904 AJPDRPQEVIQCMX-IBGZPJMESA-N 398.572 5.813 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1ccc(-c2ccncc2)cc1 191821593 DCZVUPDQPHSZSN-HNNXBMFYSA-N 392.300 5.234 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2C/N=C(/O)[C@H]2CCC(=O)c3ccccc32)cc1 328832196 VGXPJECSFZXRDW-JZWVFAODSA-N 377.484 5.180 30 20 GKED Cc1ccc(Cl)cc1N=C(O)[C@@H](C)N[C@H]1c2ccccc2CC12CCOCC2 329539595 WDCGXMIYODJXMO-IERDGZPVSA-N 398.934 5.309 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c1 390856040 LKCIQZGLTYKLMC-LLVKDONJSA-N 389.318 5.068 30 20 GKED Cc1oc(-c2ccsc2)nc1CC(=O)Nc1scc(C(C)(C)C)c1C#N 410928277 LYIIDDDSZUJYBI-UHFFFAOYSA-N 385.514 5.123 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 431845859 PXMDUCWCDMQIEU-RBUKOAKNSA-N 383.492 5.097 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2cccc(C#N)c2C)ccc1Br 432315182 YEQJPEDNKFGGRN-LJQANCHMSA-N 398.304 5.307 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(-c2cccnc2)ccc1C 432789540 STNSVJYNJUDSMQ-UHFFFAOYSA-N 397.931 5.992 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(F)c(Cl)c1 433507006 QFWMUOGEOILVRF-ZDUSSCGKSA-N 391.899 5.395 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCCN(c2ccccc2)C1 433859688 UPUNIUCDPKBRLH-HXUWFJFHSA-N 391.559 5.577 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)NCC1CCC(C#N)CC1 442968726 AYGZSULZHLFHOO-UHFFFAOYSA-N 383.561 5.091 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N[C@H]1CCCc2cn(C3CCCC3)nc21 445596684 KNANPWRTCICGAJ-IBGZPJMESA-N 393.441 5.186 30 20 GKED CC(C)c1ncc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)s1 448145903 FKGQCTVEYSGIHO-UHFFFAOYSA-N 391.496 5.164 30 20 GKED COc1cc(C(=O)Nc2ccc(CC#N)cc2Cl)ccc1OCCC(C)C 452640960 FTMXGBDZNHZIKB-UHFFFAOYSA-N 386.879 5.092 30 20 GKED C[C@H](c1ccc(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1)C(F)(F)F 456016709 MUMLQNALJAIVSJ-OAHLLOKOSA-N 384.401 5.154 30 20 GKED N#Cc1ccccc1Oc1ccc(NCC(=O)Nc2ccccc2Cl)cc1F 463224554 XKMGSIHDMPUQAF-UHFFFAOYSA-N 395.821 5.194 30 20 GKED C[C@H]1CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@H]1c1ccccc1 464540887 NQGXRVWMJMQUAF-MHECFPHRSA-N 382.463 5.378 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 471248831 FIKOYUMYWAOCAG-ACJLOTCBSA-N 389.377 5.155 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(C(F)(F)F)o1 471852052 KGMUAFIOQPRSHT-UHFFFAOYSA-N 386.329 5.523 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(COc3cccc(F)c3)c2)n1 474430749 YNZYUNVXNCOLEW-LJQANCHMSA-N 394.471 5.475 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 474443629 DUOUJGOYONYNHN-GFCCVEGCSA-N 389.546 5.111 30 20 GKED CC(C)c1cccc2c1CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C2 474717503 VAKOHJZBYJGAGJ-KRWDZBQOSA-N 393.556 5.794 30 20 GKED CC(C)CCN1Cc2cccc(NC(=O)C[C@@H](CC#N)c3ccccc3)c2C1 475587239 YKVJVCJRZMGLFY-HXUWFJFHSA-N 375.516 5.074 30 20 GKED C[C@H](CC#N)NC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 480939642 STZRGKGHAVXGGA-CYBMUJFWSA-N 380.835 5.104 30 20 GKED C=CCN(Cc1nnc(-c2c(Cl)cccc2Cl)o1)CC1CCCCC1 484638426 ANYYCOFMAOAHCA-UHFFFAOYSA-N 380.319 5.612 30 20 GKED C=CCSc1ccccc1C(=O)N(C)CCCc1cc(-c2ccccc2)no1 485464452 IFSWRQYNPDHAKY-UHFFFAOYSA-N 392.524 5.325 30 20 GKED C[C@@H](NC(=O)C1(C#N)CCCCC1)c1ccc(OCc2ccc(F)cc2)cc1 485559101 CWCMZPOBCMDUDF-QGZVFWFLSA-N 380.463 5.056 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1c(Cl)cccc1Cl 499818911 QYIFLYONPOUQCR-CYBMUJFWSA-N 396.636 5.262 30 20 GKED C=CCN(C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)c1ccccc1 508801275 MVUQVBKEMVAFBD-UHFFFAOYSA-N 388.414 5.662 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Cn1ccc2ccccc21 511878285 XPNIQPHSDJMCMU-IAGOWNOFSA-N 377.513 5.168 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)c1 515615497 XIGRGAVHTOERIK-MOPGFXCFSA-N 388.389 5.130 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Cl)sc3Cl)cc2)cc1 520558940 ZZNYSVBUCIGQJY-UHFFFAOYSA-N 389.263 5.971 30 20 GKED Cc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 520939203 NOUWOFSGXZPFHU-QGZVFWFLSA-N 381.545 5.532 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)sc2ccc(F)cc12 524379492 HZFHXDGIKDUHHP-UHFFFAOYSA-N 376.359 5.074 30 20 GKED N#C[C@@H](C(=O)C1(c2cc(F)cc(F)c2)CCCC1)c1nccc2ccccc12 529000197 QZNIUWSTPBQPNH-HXUWFJFHSA-N 376.406 5.201 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc2ncsc2c1 530447178 NAWJWRNNXNQUBP-OAHLLOKOSA-N 379.529 6.031 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnn(-c3ccc(Cl)cc3)c2)c(C#N)s1 536971021 PIHYZEOBZYSFMY-UHFFFAOYSA-N 384.892 5.009 30 20 GKED C[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Oc2ccccc2)cc1 538159295 TZOHNALSNSUTOE-QGZVFWFLSA-N 396.450 5.251 30 20 GKED CN(C(=O)c1sccc1C#N)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 538438205 SEADSDYVVXPLQQ-HOTGVXAUSA-N 378.419 5.047 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)c1cc(C#N)cs1 542201347 KTZWYPYYXXFXHH-UHFFFAOYSA-N 393.468 5.596 30 20 GKED N#CCc1ccnc(NC(=O)c2cc(F)ccc2Sc2ccc(Cl)cc2)c1 546048926 SOZHGNAYDBMCEK-UHFFFAOYSA-N 397.862 5.344 30 20 GKED N#Cc1ccc(N2CCC(N[C@H](c3ccc(F)cc3)c3cccs3)CC2)cc1 552227972 ISJYQAROXAFUME-HSZRJFAPSA-N 391.515 5.107 30 20 GKED N#CCCN(C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccc(F)cc1 558434912 IPQXQDQWMSIHCX-UHFFFAOYSA-N 396.368 5.457 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 560738391 RPGXQVDERCDJLI-NRFANRHFSA-N 375.516 5.402 30 20 GKED C=CCn1c(S[C@@H](C)c2nccn2-c2ccccc2)nnc1-c1cccs1 561476835 ZHGJKGFWMMOHNB-HNNXBMFYSA-N 393.541 5.232 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2c(-c3ccccc3Cl)noc2CC)cc1 571242871 FWTGEXJEJNLLJE-GOSISDBHSA-N 393.874 5.114 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)NCC3(C#N)CC3)cc2)c1 580624349 ZAGVXBGSSZUTIP-UHFFFAOYSA-N 377.488 5.123 30 20 GKED N#Cc1ccc2ncc(CN[C@H](c3ccccc3)c3ccc4ccccc4c3)n2c1 582077959 SYJRRMKSZSANIJ-AREMUKBSSA-N 388.474 5.238 30 20 GKED N#CC1(c2ccc(CNC(CCC(F)(F)F)CCC(F)(F)F)cc2)CC1 594985885 BYWRYAZXQSSMIT-UHFFFAOYSA-N 378.360 5.385 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)CC2(C#N)CCOCC2)c2cccs2)cc1 596712135 WQZPBUAGDCPYLP-HTAPYJJXSA-N 396.556 5.178 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@@H](CC#N)C1 596723616 LTNWGPMPYDAOPN-MOPGFXCFSA-N 377.488 5.293 30 20 GKED CC(C)n1c([C@@H]2CCCN2C(=O)CC2(C#N)CCCCC2)nc2ccccc21 597330331 SAOXYYNOIJQNAL-FQEVSTJZSA-N 378.520 5.145 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(CC(C)C)C1CC1 609079038 YEPZVIKHXVKJKA-UHFFFAOYSA-N 377.488 5.098 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N(C)c1ccc(C#N)cc1F 609216502 KBWRVTBMDJECDF-UHFFFAOYSA-N 391.880 5.121 30 20 GKED CC(C)COc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 609501582 ZHVMALUKYUZUCY-UHFFFAOYSA-N 387.439 5.033 30 20 GKED CC[C@H](CC(=O)Nc1c(C)c(C)nn1-c1ccc(C#N)cc1)c1ccc(C)cc1 610053725 JWRLJSRKVYOKEJ-HXUWFJFHSA-N 386.499 5.192 30 20 GKED CCN(C(=O)N[C@H](C)c1cccc(C#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 610355384 PFRLLOMLOAXDQP-CABCVRRESA-N 389.421 5.431 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)Cc1cn(CCC#N)nc1-c1ccccc1 610931070 ZFNGUZHPAUVPDN-UHFFFAOYSA-N 398.432 5.115 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2C[C@H]2c2ccc3ccccc3c2)c(Cl)c1 619555945 MJKAFRZUTYSAIP-QFBILLFUSA-N 381.262 5.304 30 20 GKED O=C(N[C@H](c1c[nH]c2cccc(F)c12)C(F)(F)F)[C@H]1CC[C@H](C(F)(F)F)C1 648582633 CNQUUXBXDTYUKP-UINNMSKDSA-N 396.306 5.005 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCCn3nccc32)cc1)C(F)(F)F 658047657 UDYDCOMZCSQJCU-LBPRGKRZSA-N 381.295 5.120 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cnn1-c1cccc(F)c1 680169873 QRCKBARYSMDYHH-LJQANCHMSA-N 398.441 5.002 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)NCc1cccc(C#N)c1 726847950 FKBLUPBCKVVJJJ-UHFFFAOYSA-N 375.859 5.509 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)c(OC)c1OC 727780157 IHVRTEGDJREPED-BENRWUELSA-N 395.480 5.040 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 727979148 VNRHDQVHNOLERN-UHFFFAOYSA-N 397.503 5.236 30 20 GKED Cc1ccc(Oc2ccccc2CNC(=O)c2ccccc2SCC#N)cc1 730224533 WOHJCKWVADRGOF-UHFFFAOYSA-N 388.492 5.333 30 20 GKED N#C[C@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)c1ccc(Cl)c(Cl)c1 731644261 OKGFSEAVPVELQT-HNNXBMFYSA-N 388.081 5.224 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1ccncc1 734678085 CBYAHDSGLYDULK-QHCPKHFHSA-N 389.474 5.250 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cc(C)n([C@@H](C)c4ccccc4)c3C)[nH]c12 735791934 DJECBZHTHHJYIX-LAUBAEHRSA-N 396.494 5.389 30 20 GKED C[C@@H](NC(=O)c1ccccc1OCC#N)c1ccccc1-c1ccc(Cl)cc1 739629602 FDOLFLYIMQEVQN-MRXNPFEDSA-N 390.870 5.400 30 20 GKED C[C@H](CN(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 740060200 QFSMSASDLQRRHA-QGZVFWFLSA-N 389.524 5.232 30 20 GKED CCCN(Cc1ccccc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740065052 UZRQMOAMSBESNW-UHFFFAOYSA-N 389.524 5.409 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cccc(OCCCC#N)c2)cc1 741470902 XAGIVCHKFVMUIN-WJDWOHSUSA-N 397.474 5.941 30 20 GKED Cc1ccc([C@H](C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 742542055 CGUIQMXMGYYJCD-HNAYVOBHSA-N 378.859 5.639 30 20 GKED C[C@@H](OC(=O)CCC(F)(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 744134895 GVJAHBBCRUNXKU-SSDOTTSWSA-N 382.222 5.671 30 20 GKED CCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)[C@@H](CC)c1ccccc1 746144527 APYTXYJYJABLGA-IRLDBZIGSA-N 398.510 5.087 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1oc2ccc(Cl)cc2c1C 749360818 HBFCETBMVVIQSJ-UHFFFAOYSA-N 389.842 5.144 30 20 GKED N#Cc1ccsc1C(=O)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750204854 LYSZJRDHCBANSS-GFCCVEGCSA-N 379.281 5.099 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cnc(-c4cccs4)s3)c2)s1 751505732 JXOOBKJHBVJBNK-UHFFFAOYSA-N 393.562 5.762 30 20 GKED C[C@]1(c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCCO1 763339185 MDUPBVJYABBXHZ-HXUWFJFHSA-N 381.819 5.080 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(Cl)cc1 763921452 IBABHGNZSDLLIX-INIZCTEOSA-N 396.922 5.059 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)[C@@H](C)c1ccccc1C(F)(F)F 766484916 BWXZBBHZLWCZJO-OAGGEKHMSA-N 376.422 5.278 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 773230364 HXRUJOFOGWAFBE-XMMPIXPASA-N 398.506 5.909 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2nc3cccc(Cl)c3n2C)cc1 775562607 KRIKRJOBIXQTEJ-CQSZACIVSA-N 390.314 5.209 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=S)Nc1ccccc1-c1ccccc1 795132220 SIRGNMYFPDKHRQ-UHFFFAOYSA-N 392.524 5.214 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](CC#N)c3ccccc3)n2)cc1 796633107 GWQUFJFZUWRRJI-VQTJNVASSA-N 385.492 5.382 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)COc2ccc(Cl)c(Cl)c2)s1 797567685 AHOIDGAULDCMPD-LLVKDONJSA-N 383.300 5.003 30 20 GKED C[C@@H](OC(=O)c1cccc(C(F)(F)F)c1F)c1ccc(C(F)(F)F)cn1 798667475 RWSALTAXTJOKDS-MRVPVSSYSA-N 381.247 5.176 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801673651 VMYAVWDTHHBOET-SJCJKPOMSA-N 396.409 5.749 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cc(Cl)c(O)cc3F)c2)cc1 805259248 FPTLENXQQCUSSG-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 806207269 MNXJERMBWGHZLI-VGOFRKELSA-N 398.466 5.361 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1csc(C)n1 812443431 RPJUKCGHDGUKJS-UHFFFAOYSA-N 379.514 5.268 30 20 GKED Cc1ccc(SCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1C 813218167 MNIAWZJUJXQLBP-MRXNPFEDSA-N 378.419 5.076 30 20 GKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1O 815636411 UUYPFKYVGCHVRN-OALUTQOASA-N 387.321 5.631 30 20 GKED O=[N+]([O-])c1cccc([C@@H](NCc2ccc(C(F)(F)F)cc2)C(F)(F)F)c1F 839649927 ITNOHQTVCRZPIJ-CQSZACIVSA-N 396.262 5.146 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)/C=C\c3nc4ccccc4s3)c2C#N)C1 877880246 HKIXJBDFSRYRIX-JLVNDZCYSA-N 379.510 5.006 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc12 915086119 GIQUNDIWMXZSQH-NRFANRHFSA-N 396.450 5.254 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2csc(-c3ccccc3)n2)S1 915849039 PQASDMBHPHQEGL-BOPFTXTBSA-N 391.521 5.319 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(-c2ccccc2Cl)o1 916904694 CMEXPGKRFPTPTG-CYBMUJFWSA-N 399.233 5.215 30 20 GKED Cc1cc(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1C(C)C 917044580 UTLOJONHUWGFRU-KRWDZBQOSA-N 398.915 5.637 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 917047083 QRQREDJTMZPOJX-JRBALWBOSA-N 379.293 5.554 30 20 GKED Clc1ccc2cccnc2c1CON=Cc1ccccc1Br 917394718 PVSZQBYADUYHMW-UHFFFAOYSA-N 375.653 5.201 30 20 GKED O=C(O)c1cc2c(C=NNc3ccc(-c4ccccc4)cc3)c(F)ccc2s1 1776059601 AKGJBXDRXWDZDC-UHFFFAOYSA-N 390.439 5.852 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)ccc1F 1776062811 LEQMAVVLJNPHKY-UHFFFAOYSA-N 392.308 5.249 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cc1c(C(=O)O)sc2ccccc12 1776180211 BRUCFGONYRSYDL-UHFFFAOYSA-N 377.918 5.503 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(C(F)(F)F)c1F 1776355479 QUKZXMDPORIVJK-SOFGYWHQSA-N 396.336 5.226 30 20 GKED C[C@H]1C/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2sccc21 1776589751 UKYGRVJNLIEEEU-SLDJAQPHSA-N 388.488 5.816 30 20 GKED COc1ccc(CSc2nnc(SCc3ccccc3C#N)s2)cc1 7942750 UOCXTPGPXWNDDJ-UHFFFAOYSA-N 385.539 5.003 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3OC(F)F)n2)cc1 41512041 JMQANWKZSPYUCY-OAHLLOKOSA-N 384.407 5.210 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3csc(-c4cccs4)n3)n2)cc1 61198277 NDVUFADYSYTJSO-UHFFFAOYSA-N 394.506 5.119 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(Cl)c1OCCOCC 63398147 LOVOVLNVVLQOGJ-UHFFFAOYSA-N 394.924 5.037 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OCC)cc1C(F)(F)F 64563661 RYHCOUQEWQDSBV-UHFFFAOYSA-N 396.384 5.463 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1ccccc1 67428140 LQLKHEXCKSWVQA-UHFFFAOYSA-N 380.498 5.140 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 71919991 ZQAYERMWXDRHMN-GOSISDBHSA-N 385.467 5.214 30 20 GKED COc1ccc(CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1 109029403 GYISXDUABREHPM-MRXNPFEDSA-N 395.528 5.286 30 20 GKED N#C[C@@H](Sc1nnc(COc2ccc(Cl)cc2Cl)o1)C1CCCCC1 115186440 NSEXIOFQXYZQHW-OAHLLOKOSA-N 398.315 5.520 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1c(C)noc1C1CC1 121905892 JOMWUZHGXTXVHZ-UHFFFAOYSA-N 388.427 5.477 30 20 GKED Cc1cc(C)c(CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)c1 134184960 UMSBZZZBZSTUKN-FQEVSTJZSA-N 385.492 5.026 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1 163897686 YJVMLGHHQYXHOO-OAHLLOKOSA-N 393.903 5.123 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cccc(Cl)c2Cl)ccc1OC 180815768 USOMLSDADXSDGT-UKRRQHHQSA-N 393.314 5.534 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(C2SCCCS2)cc1 182111882 XWPSUWHXEXGPKF-CQSZACIVSA-N 384.526 5.098 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)c(OC)c1 237268363 CBJFVNXVTODHGE-QHCPKHFHSA-N 392.886 5.108 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ccc([N+](=O)[O-])cc3C#N)s2)cc1 301292759 QUGROALHDPONEW-LBPRGKRZSA-N 394.456 5.080 30 20 GKED C=C(C)CN(CC)C(=O)c1oc2ccccc2c1CSc1nc(C)cs1 302170653 JGOPNBGDEGCICZ-UHFFFAOYSA-N 386.542 5.528 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H]2Cc2ccccc2Cl)cc1 302965625 HFVSVKSLGSPJHO-LJQANCHMSA-N 381.907 5.380 30 20 GKED N#Cc1ccc(CSCC(=O)N[C@H](c2ccc(Cl)cc2)C2CCC2)cc1 303250009 MVOKUKGJPIWSQZ-NRFANRHFSA-N 384.932 5.102 30 20 GKED CC(C)c1noc([C@H](/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)C2CCOCC2)n1 329101633 NCAVNAWPRURAHL-GDAAHCPNSA-N 389.540 5.224 30 20 GKED Cc1nc([C@H]2CCCCCN2C(O)=Nc2ccc3c(c2)oc2ccccc23)no1 329515847 DHEWKTMNNZVWOI-GOSISDBHSA-N 390.443 5.440 30 20 GKED OC(=Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)[C@@H]1CCCSC1 329574277 AOIAQLCZAOSDFA-CQSZACIVSA-N 390.940 5.056 30 20 GKED C=CCC[C@@H](C(=O)N[C@H]1CCCc2cn(C3CCCC3)nc21)c1ccccc1 428037517 ZAEVBMCQMIORGP-YADHBBJMSA-N 377.532 5.242 30 20 GKED CSC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 432996070 SFKNHLUGBVORBH-OAHLLOKOSA-N 399.491 5.097 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3cc(C#N)cs3)s2)cc1 437691544 JOOVRJXEGGQXLK-AWEZNQCLSA-N 381.526 5.193 30 20 GKED N#Cc1ccc(CN2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)c(Cl)c1 439454528 RXJTYHJSDRCSPB-ZDUSSCGKSA-N 385.842 5.067 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 439588617 SLASMEVICFBTHV-RBUKOAKNSA-N 395.469 5.095 30 20 GKED C[C@@H](CCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 440791478 IPQRBPQNCUTVBO-FQEVSTJZSA-N 398.506 5.854 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCC[C@@H]3c3ccc(Cl)c(Cl)c3)o2)c1 441210825 UPXHIHGBDOVASW-GOSISDBHSA-N 399.281 5.252 30 20 GKED CCCO[C@H]1CCCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1 444611417 RGQDTNQGQFLEEF-DEOSSOPVSA-N 376.544 5.167 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(N3CCSCC3)cc2C)CCCC1(C)C 445240962 PYRPCCKYSSWELY-HXUWFJFHSA-N 387.593 5.147 30 20 GKED Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 454754297 NLKFMMVSNKEOOB-YWZLYKJASA-N 397.519 5.755 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC=C(c2ccc(Cl)cc2)CC1)c1ccccc1 458797036 FQMZFKJENHGCPE-JOCHJYFZSA-N 393.918 5.574 30 20 GKED C[C@H]1CCN(C(=O)c2cscc2C#N)c2cc(C(F)(F)F)ccc2S1 460003076 WCXDCGIQKABLQM-JTQLQIEISA-N 382.432 5.170 30 20 GKED Cc1cc(Cl)c2ccccc2c1NC(=O)N(CCC#N)Cc1ccccn1 462866070 IHNMRZXXWAYBPT-UHFFFAOYSA-N 378.863 5.144 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CC(C)(C)C)c1ccc(Cl)cc1 465970155 SQIHOFFTPRHOKU-FQEVSTJZSA-N 383.923 5.531 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ncccc1C 466497974 YLZIOCJSPOIOLD-UHFFFAOYSA-N 391.858 5.374 30 20 GKED O=C(c1cc(F)ccc1-c1ccoc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 470980241 WJVRSGHDUZTYTP-UHFFFAOYSA-N 395.274 5.043 30 20 GKED Cc1cc(F)cc2c(N3CCC(n4c(C)nc5ccccc54)CC3)c(C#N)cnc12 480853194 ORPRIXBXQROGCN-UHFFFAOYSA-N 399.473 5.054 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1)c1ccc(F)c(F)c1 481589680 AREXBIBLUFSBON-YJYMSZOUSA-N 387.405 5.430 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N1CCC(c2c[nH]c3ccccc23)CC1 488300900 ACNVYVVUIHYPEK-UHFFFAOYSA-N 388.421 5.250 30 20 GKED C=CCn1c(SCc2ccc(OC(F)F)cc2)nnc1-c1cccs1 489441399 UYPSGJXXEPOVLI-UHFFFAOYSA-N 379.457 5.086 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1nc2c(c(C)c1C#N)CCC2 494995398 AMUTZELXPYXATR-MRXNPFEDSA-N 393.556 5.302 30 20 GKED Cc1c(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cnn1CC(C)C 501351237 FJTMXAHAPLSMGE-UHFFFAOYSA-N 390.512 5.123 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 504071440 NEXIXIKCYSIOBI-LJQANCHMSA-N 388.492 5.433 30 20 GKED C[C@@H]1C[C@H](NC2CCC(C#N)(c3ccccc3)CC2)CCN1Cc1ccccc1 507651512 UCBRWMJEZMWOSB-VEMGEMFASA-N 387.571 5.033 30 20 GKED C=C(C)CCc1noc(CSc2nnc(-c3ccccc3)n2[C@@H](C)CC)n1 508610927 ZJGBAUQCEKEUSN-HNNXBMFYSA-N 383.521 5.100 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510661304 XJOYWZVWEJEJOT-MRXNPFEDSA-N 389.430 5.715 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nc(-c2ccc(Cl)cc2)no1 512532803 VLDPYHJFYSOVGJ-MRXNPFEDSA-N 399.926 5.307 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc(C4CC4)nc4ccccc34)n2)cc1 515165319 IJRRUVYPDJADNB-UHFFFAOYSA-N 396.475 5.360 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1C[C@H]1C[C@H]2CC[C@H]1C2 517473476 OAFUPALVWLTXQE-LCWAXJCOSA-N 397.588 5.761 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)o1 518239748 LTXQCTREXQAEKF-KRWDZBQOSA-N 390.508 5.912 30 20 GKED Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 523285396 MFZOBOJPYVBLHK-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CS[C@@H]2CCCc3ccccc32)c1C 523950612 YOVQEQWZHCOQAG-JOCHJYFZSA-N 378.541 5.361 30 20 GKED C[C@H]1CCC[C@@](C#N)(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)C1 523966548 ZZIHVVCKJTYUKK-BXKMTCNYSA-N 388.467 5.214 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)CCCC1 524097510 DTIVNYMNAPAFNT-UHFFFAOYSA-N 375.403 5.189 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(COc2cccc(C#N)c2)c1 524512512 WXPDLHCNQRNNCY-NTKDMRAZSA-N 396.490 5.155 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1ccccc1SCC(=O)Nc1ccc(C)cc1 538335644 LHKFZQSSSLYPPI-GOSISDBHSA-N 396.556 5.200 30 20 GKED C[S@](=O)c1ccc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 538821205 YIYDWQCOLTTWFE-SANMLTNESA-N 399.331 5.213 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1 539152672 QVCUMVKGIITXPH-UHFFFAOYSA-N 387.405 5.297 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccccc1 540147405 UMGRGGQKNKBBLV-CYFREDJKSA-N 397.584 5.761 30 20 GKED N#Cc1ccc(CNC2(c3noc(C4CCCC4)n3)CCCCCC2)c(F)c1 541697591 RLYWIHZKNSKRQV-UHFFFAOYSA-N 382.483 5.077 30 20 GKED Cc1sc([C@@H](C)NCc2ccc(CC#N)cc2)nc1-c1ccc(Cl)cc1 542575606 NOXSCFIKHUZLBS-CQSZACIVSA-N 381.932 5.689 30 20 GKED C=C(C)[C@H](Cc1nc(-c2ccnc(Oc3ccccc3Cl)c2)no1)OCC 544841579 UZXDZZQGNKOUQG-KRWDZBQOSA-N 385.851 5.101 30 20 GKED C[C@@H]1C[C@H](c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCO1 546510391 KMTQHKMIADFPCG-ZIAGYGMSSA-N 395.846 5.336 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H]1c2ccccc2CC12CCOCC2 570205413 AHUSGSUZQOIVFB-QFIPXVFZSA-N 376.500 5.021 30 20 GKED C=C1CCN(C(=O)C(C)(C)c2csc(-c3c(F)cccc3Cl)n2)CC1 578054739 IUMIBLMJFXDRTP-UHFFFAOYSA-N 378.900 5.059 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)NC(C)(C)c1cccc(C#N)c1 596835531 YRBPMVBSPVHFHT-UHFFFAOYSA-N 379.504 5.320 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(C(=O)CC1(C#N)CCOCC1)c1ccccc1 598818375 KMXUOANBEDHJAL-KRWDZBQOSA-N 382.891 5.145 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Oc3ccc(F)cc3)cc2)c1 603972119 XROFCQXMLKTXLJ-UHFFFAOYSA-N 390.414 5.553 30 20 GKED CC[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)c1ccccc1 609062096 XDEILNNRJFQJMS-QHCPKHFHSA-N 384.479 5.578 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 609377102 OJOQKSQSYNOSJR-GOEBONIOSA-N 392.446 5.613 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CNc3cccc(Cl)c3)cc2)cc1 609622236 MDHGHTYMCVDLAQ-UHFFFAOYSA-N 377.831 5.055 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)cn2)cc1 610238627 AEPOKCMYEKQPEP-UHFFFAOYSA-N 398.397 5.132 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1c1ccccc1Br 610677915 GKBRRNCNEJUGFB-CQSZACIVSA-N 396.210 5.076 30 20 GKED CC(C)(CNC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cccc(Cl)c1 611094028 VZQFCIPRBWZXTR-UHFFFAOYSA-N 381.690 5.226 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)C1 612295208 YPMSQVXDKUMAJA-JOCHJYFZSA-N 399.441 5.036 30 20 GKED CN(Cc1ccccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1 619020920 DJVDTDPELNOIPG-XMMPIXPASA-N 396.494 5.004 30 20 GKED C[C@H](NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 726460438 BPIDXBKPZOLYOH-KXBFYZLASA-N 377.538 5.451 30 20 GKED Cc1ccccc1Oc1ccccc1CNC(=O)Nc1cccc(OCC#N)c1 730129650 ZVTXWIXRWCQSLN-UHFFFAOYSA-N 387.439 5.011 30 20 GKED C[C@H](CSc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731973408 XVXSOASIHYJVAE-WZONZLPQSA-N 386.520 5.709 30 20 GKED COc1cc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc(OC)c1 733621763 OHSRHZOWVDQAOB-JOCHJYFZSA-N 387.439 5.003 30 20 GKED O=C1/C(=C\c2csc(COc3ccc(Cl)cc3)n2)Cc2cc(F)ccc21 734305450 VVIBDRZXXOVTIS-LCYFTJDESA-N 385.847 5.337 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccncc1 734661018 DFXXTYWUBIGYCX-UYAOXDASSA-N 397.931 5.503 30 20 GKED COc1cc(/C=C\C(=O)c2sc(C(C)(C)C)nc2C)c(SC)cc1OC 741165424 MKGLEPBZDHSMBF-HJWRWDBZSA-N 391.558 5.384 30 20 GKED CSc1ccc(/C=C\C(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 741447980 SBILFBQUPWJUAF-NVNXTCNLSA-N 386.538 5.021 30 20 GKED Cc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc(C)c1OC(F)F 741844361 OKGIPAKMUFFRAC-ONEGZZNKSA-N 382.819 5.164 30 20 GKED N#C[C@@H](C(=O)c1cccc2cc[nH]c12)c1nc2cc(C(F)(F)F)ccc2s1 744037647 BHQRWECVUWMQDM-ZDUSSCGKSA-N 385.370 5.286 30 20 GKED C[C@@H](ON=Cc1ccccc1C(F)(F)F)c1nc(-c2ccc(Cl)cc2)no1 744443235 ILOFCWKELKDVKF-LLVKDONJSA-N 395.768 5.521 30 20 GKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1ccc(-c2ccncc2)cc1 745990249 PHNPROZUTXRWJW-XCVCLJGOSA-N 383.369 5.586 30 20 GKED C[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2cccnc2)cc1 747667474 RBJJQUYUBHLRTE-CQSZACIVSA-N 392.915 5.321 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](c1cccc(Cl)c1)c1ccccn1 749447900 HTTIJGVZQGYKFS-OAQYLSRUSA-N 398.293 5.170 30 20 GKED Cc1cc(C(F)(F)F)c(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)nn1 750465304 XTVJASVUOSGTOI-YUMQZZPRSA-N 395.269 5.125 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H](C)c1ccc2ccccc2c1 753215625 ZPESURLYNKJVGD-SFHVURJKSA-N 379.463 5.079 30 20 GKED C=C[C@@H](CC(=O)O[C@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 758906937 FSGWPUDAWNUENV-XLIONFOSSA-N 379.500 5.042 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2o1)c1cccc(C(=O)c2ccccc2)c1 762040486 PWPPSEBSORZJGY-UZLBHIALSA-N 394.430 5.039 30 20 GKED C=CC[C@@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1ccncc1 762220031 FPQKIYLYZQFXNA-NWNNTGRJSA-N 380.797 5.114 30 20 GKED O=C1/C(=C/c2ccc(-c3ccc(Br)cc3)o2)CCc2nc(O)ccc21 769611164 WNNKVBRWKIHKPW-ACCUITESSA-N 396.240 5.022 30 20 GKED C[C@@H]1C[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCO1 776513904 BTNIWTLXTGNVHW-GYSYKLTISA-N 395.311 5.108 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1 776849513 LGODLGNMGHIQBU-CYBMUJFWSA-N 399.903 5.159 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccnc(Oc3ccc(F)cc3F)c2)cc1 789916063 BZDZDUALUZVXLE-UHFFFAOYSA-N 393.393 5.021 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cc(F)cc(C#N)c1 795204653 KAMUWENUCSLVLB-QHCPKHFHSA-N 397.453 5.269 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 806200729 LWFJUCSCGKPYDH-DFBJGRDBSA-N 395.506 6.100 30 20 GKED N#CCCCCC(=O)O[C@@H](c1ccc(Br)cc1Cl)C(F)(F)F 851278220 NOUISLGSUXQQIF-ZDUSSCGKSA-N 398.606 5.333 30 20 GKED C[C@H](CCc1ccc(O)cc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354035 TUIXMEBYAWVINP-HOYKHHGWSA-N 399.494 5.190 30 20 GKED COc1ccc(C(=O)/C=C\c2c(C)nn(Cc3ccccc3Cl)c2C)c(F)c1 916141993 XBVWVQRGYQKQMT-KHPPLWFESA-N 398.865 5.245 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(-c2ccc(F)cc2)s1 1776033395 ZTWDJLSEFVUURA-UHFFFAOYSA-N 388.851 5.742 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2F)cc1CC(=O)O 1776131819 MGUHNYCTXXYVOP-VURMDHGXSA-N 396.439 5.086 30 20 GKED CC1(C)/C(=C\c2ccc(/C=C/C(=O)O)cc2)C(=O)c2cc(Br)ccc21 1776515256 SQIOWIRZRKZNHB-YJMOAXFXSA-N 397.268 5.104 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3c(F)cccc3F)cc2)cc1C(=O)O 1777360819 SPFSOKHEVABSIR-WZUFQYTHSA-N 394.373 5.235 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3c(F)ccc4sc(C(=O)O)cc34)oc12 1777385394 LBFRSNXAIQFZSD-ALCCZGGFSA-N 396.395 5.390 30 20 GKED C[C@H](C#N)Sc1nnc(-c2ccc(Cl)cc2Cl)n1-c1ccccc1 5360759 HDSKWXNCGWEXNG-LLVKDONJSA-N 375.284 5.245 30 20 GKED Cc1cccc(N/C(S)=C(\C(=O)c2ccc(C(C)C)cc2)[n+]2ccccc2)c1 10167489 DHIONWILZSTVJD-UHFFFAOYSA-O 389.544 5.457 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2cccc(C)c2)cc1 27173853 PLQQKQXPSDENNQ-UHFFFAOYSA-O 381.546 5.012 30 20 GKED O/C(=N\c1nnc(-c2ccco2)s1)[C@@H](Oc1ccccc1)c1ccccc1 49616408 DOSGKXBWKXGJDL-KRWDZBQOSA-N 377.425 5.206 30 20 GKED COc1cccc(C(=O)/C=C/c2csc(N(C(C)=O)c3ccc(C)cc3)n2)c1 54895708 LRYAYSROWVRFRZ-FMIVXFBMSA-N 392.480 5.041 30 20 GKED N#Cc1ccc(NCc2ccc(NC(=O)c3ccco3)cc2)cc1C(F)(F)F 67348942 KWMPZJWCIJNUJX-UHFFFAOYSA-N 385.345 5.034 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2cccc(NC(=O)c3ccc(Cl)cc3)c2)cn1 72047949 XYLCFMRFALVOFR-IZZDOVSWSA-N 393.874 5.266 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccccc1C(C)(C)C 108354277 LVODHWJOZVEBQW-INIZCTEOSA-N 381.545 5.286 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(C[S@](=O)C3CCCCC3)c2)cc1 116684881 XFVZRGDXLCXVBE-MUUNZHRXSA-N 397.540 5.085 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3c(F)cc(C#N)cc3F)cc2)n1 123335485 BAPHLQDNRAYGRH-UHFFFAOYSA-N 387.436 5.005 30 20 GKED COc1ccc(CNc2cccc(-c3nc(C)cs3)c2)cc1OCCCC#N 125821224 VKUOPZARQGUTGJ-UHFFFAOYSA-N 393.512 5.422 30 20 GKED CCC(CC)c1cc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)on1 173116010 BUMFTNZURAXOHA-CQSZACIVSA-N 386.521 5.152 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cccc(SC(=O)N(C)C)c1 176880606 NKBTWEJJQQNYDS-OAHLLOKOSA-N 385.558 5.324 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)s2)o1 181522404 SNZNJAPXUKZHBA-LBPRGKRZSA-N 397.406 5.551 30 20 GKED CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 185349595 TUPGFFSNHZVYFE-DOTOQJQBSA-N 397.500 5.054 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](C)Cc1ccsc1 188917788 IDGKFKKJRNAIRY-HOTGVXAUSA-N 387.574 5.627 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1NCc1coc(-c2cccs2)n1 195663911 KDZIFRWFEBFWLF-UHFFFAOYSA-N 384.823 5.228 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC[C@H]1c1ccccc1 246627004 AOBRUPKXFLWELY-QWFCFKBJSA-N 393.556 5.596 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2ccc(C#N)c(Cl)c2)cs1 248033904 MPEOSKWEHWQZJU-UHFFFAOYSA-N 399.928 5.521 30 20 GKED N#CCc1ccc(NC(=O)CCN2c3ccccc3Sc3ccccc32)cc1 302662412 YVGCBDASKJFGGP-UHFFFAOYSA-N 385.492 5.384 30 20 GKED CC[C@@H]1Oc2cc([C@@H](C)/N=C(/O)N3CCCC34CCCCC4)ccc2N=C1O 328813022 FWCHJMRCZWPXDP-QAPCUYQASA-N 385.508 5.219 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CC(F)F)c1ccccc1 421066320 PQQPQAOGOJMVCF-YOEHRIQHSA-N 389.471 5.456 30 20 GKED CC1CCN(c2cccc(NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)c2)CC1 425646557 BVGSEJAHMFHHCX-SFHVURJKSA-N 376.504 5.019 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2c(-c3cccc(Cl)c3Cl)noc2C)n1 430519818 LNFJJKVMEGKPFK-LLVKDONJSA-N 392.267 5.212 30 20 GKED N#CCCC[C@H](NC(=O)NCc1ccc(OC2CCCC2)cc1)c1ccccc1 431319440 RKPXNLZCOHBFSD-QHCPKHFHSA-N 391.515 5.242 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 431861037 KJCLWOWAIJRKRL-HNAYVOBHSA-N 389.421 5.501 30 20 GKED N#Cc1ccnc(NC(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)c1 436008889 GBQMSBAKEPICBP-UHFFFAOYSA-N 383.835 5.149 30 20 GKED CC(C)c1ncc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)s1 448159393 YJNCJHFRPOYOOF-UHFFFAOYSA-N 393.487 5.120 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N1CCCC[C@@H]1c1ccc(Cl)cc1 453447392 AXSAIMYLILNLPH-RTBURBONSA-N 386.927 5.091 30 20 GKED N#C[C@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccc(Cl)cc1 464402949 JIUHJCMHYKSYPD-SFHVURJKSA-N 396.874 5.625 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1C 464424465 XLUBHOMAQWHLQH-INIZCTEOSA-N 384.357 5.467 30 20 GKED N#CC[C@@H](CC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1)c1ccccc1 476147325 LULXBUKPCXCAMT-UKILVPOCSA-N 380.491 5.400 30 20 GKED N#CC[C@H](CC(=O)NCCc1cccc(OCc2ccccc2)c1)c1ccccc1 476541273 RVUXPNSZDPPEMS-XMMPIXPASA-N 398.506 5.012 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccccc3F)nc2)cc1 477113790 JPQRYFOUIHYQLF-UHFFFAOYSA-N 375.403 5.066 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(N2CCCC2)cc1C)c1ccc(F)c(F)c1 479952374 DRGBGXNVLOHGPY-OAQYLSRUSA-N 385.458 5.312 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OCC(F)F)cc1 481045181 WNYKDUDZDKFFDR-UHFFFAOYSA-N 386.851 5.266 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 485267818 CLZVFDZKJURFMR-UHFFFAOYSA-N 394.563 5.655 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](c2cccc(Cl)c2)C(C)C)cc1 486620910 PELLWXJLLQNHTQ-LJQANCHMSA-N 385.895 5.026 30 20 GKED COc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)c12 486773973 PPWUTMQBAGGAJZ-UHFFFAOYSA-N 397.434 5.022 30 20 GKED C=CCC[C@H](NC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccccc1 487859622 SPMGJRSFEAHWQM-FQEVSTJZSA-N 396.556 5.029 30 20 GKED C=CCn1c(S[C@H](CC)c2ccccc2)nnc1[C@@H]1COc2ccccc2O1 494119288 KFIVVGCZDVWDAR-VQTJNVASSA-N 393.512 5.220 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(C(F)(F)F)cc1 495533842 GLHKNJRFSHZCKF-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1nc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(-c2ccccc2)s1 498167197 RTWFDEAACRKCAY-CQSZACIVSA-N 393.537 5.623 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4ncccc4c3)c2)cc1 499693096 JCOUUNFANJBFBI-UHFFFAOYSA-N 393.446 5.132 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1ccc(COCC(F)(F)F)cc1 505037560 CKIYKGKTWMUXOL-UHFFFAOYSA-N 392.421 5.206 30 20 GKED N#C[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccc1F 505942224 HIGCKXKIGMILPP-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)c1 506749235 AGKLSXXAWRVBJH-UHFFFAOYSA-N 375.255 5.439 30 20 GKED N#CC1CCC(CNC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)CC1 508361215 KHKGNZZDDAIRLP-UHFFFAOYSA-N 385.467 5.068 30 20 GKED C=CCn1c(SCc2sccc2Br)nnc1-c1ccccc1 516397720 NMOBNZZGWPQVBP-UHFFFAOYSA-N 392.347 5.247 30 20 GKED Cc1cccc(C)c1OC[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520197570 HKHMGCQTVAARAC-MSOLQXFVSA-N 397.544 5.287 30 20 GKED C[C@H](N[C@H]1c2cc(Br)ccc2SC[C@H]1C)c1ccc(C#N)cc1 538394360 XRVKVUKVRMJRNI-QHRIQVFBSA-N 387.346 5.454 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 539215131 ASMBLCTUNACBFC-KRWDZBQOSA-N 395.506 5.306 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCCCc1ccsc1 541172367 SUAQXAGAKVRQFV-OAHLLOKOSA-N 390.599 5.447 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@@H]1CCCCS1 544222786 VORVGCLEQKCHHF-IBGZPJMESA-N 381.501 5.066 30 20 GKED CCOc1c(Cl)cc(-c2noc(-c3ccc(C4(C#N)CC4)cc3)n2)cc1OC 545543467 UUVOHIZKEFMCEW-UHFFFAOYSA-N 395.846 5.019 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)NC1(C#N)CCC(C(C)(C)C)CC1 567142196 IHOHFKWKUQGJHG-QWMSRCPPSA-N 377.532 5.028 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1 568806948 MVKXVIMDURZNIK-UHFFFAOYSA-N 380.414 5.101 30 20 GKED Cc1ccc2c(Cl)c(C(=O)N[C@@H](CCCC#N)c3ccccc3)sc2c1 590477557 RMGBTQHFSIJXJX-KRWDZBQOSA-N 382.916 6.028 30 20 GKED Cc1sc(NC(=O)c2c(F)ccc(SCC3CC3)c2F)c(C#N)c1C 590974660 ZYBHBSSCEPGTCO-UHFFFAOYSA-N 378.469 5.269 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)s2)o1 592973524 GXHAPGCXHMZMOR-LBPRGKRZSA-N 397.456 5.259 30 20 GKED CSCc1c(C(=O)Nc2sc3c(c2C#N)CCCCC3)oc2ccccc12 602777964 WYTCYQMLFQMFAN-UHFFFAOYSA-N 396.537 5.750 30 20 GKED Cc1cc(-c2noc([C@@H](C)Sc3nc4c(cc3C#N)CCCC4)n2)ccc1F 603724303 OVOUZVXJGFGANF-CYBMUJFWSA-N 394.475 5.183 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)cn2)c1 603756023 CSMORURXHYBESH-CABCVRRESA-N 389.377 5.053 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)c(C)c1 604044181 ADVVVCKIFOWPPW-IBGZPJMESA-N 399.494 5.193 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3sc4cccc(C)c4c3Cl)[nH]c12 605363383 WZPGVOVTNQSMQN-GFCCVEGCSA-N 379.872 5.538 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C)c1 608916911 WXKNNEMOKSEAHV-SFHVURJKSA-N 395.572 6.200 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 609078233 QNYOUBACDNPXOJ-UHFFFAOYSA-N 377.469 5.384 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCCn3cnc4ccccc43)c2)cc1 609177346 PTELXYFDRCOCOK-UHFFFAOYSA-N 396.450 5.119 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 609377080 OIWPNUKTWJORST-CYBMUJFWSA-N 394.500 5.024 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)N[C@H](C)c1cccc(C#N)c1 610349135 ZSFICBJEQYBUCI-GDBMZVCRSA-N 390.512 5.112 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 614182594 UYUQZJOTFQTQRE-QHCPKHFHSA-N 389.930 5.610 30 20 GKED N#Cc1c(NC(=O)c2ncsc2C(F)(F)F)sc2c1CCCCCC2 619791427 IKTFCOSJXXCWMT-UHFFFAOYSA-N 385.436 5.006 30 20 GKED N#C[C@@H](C(=O)c1cc(C2CC2)[nH]c1C1CC1)c1nc2ccccc2n1C(F)F 626300031 JWYGUNNDUOPHCM-AWEZNQCLSA-N 380.398 5.004 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccccc2OC)n1 661116278 ICXZFHNMBOOSMH-PKOBYXMFSA-N 399.560 5.061 30 20 GKED C=C[C@H](CC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccccc1 677515339 TUMGWLDVBXUNHH-SNPRPXQTSA-N 393.371 5.372 30 20 GKED C[C@@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 726474146 AOGYEAMFXHWDAG-CQSZACIVSA-N 379.510 5.460 30 20 GKED Cc1ccccc1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1C 727978533 HUVIIBMWAKFWRA-UHFFFAOYSA-N 387.508 5.563 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccnn3C3CCCCC3)c2)cc1 728459185 SITIZNQBZDUAJY-UHFFFAOYSA-N 386.455 5.305 30 20 GKED Cc1ccc(Oc2ccccc2CNCc2ccc(N(C)CCC#N)cc2)cc1 730107297 AZSBLPLLWQIIHO-UHFFFAOYSA-N 385.511 5.427 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(C(C)(C)C)nc2C)c(Cl)c1OC 730434300 OLAOZMFEULWVRH-CLFYSBASSA-N 379.909 5.316 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)cc1 731030521 IYPHZVLWMOMJLD-HNNXBMFYSA-N 387.936 5.199 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)cc1 731321691 QLFNMHBRBIAELV-OAHLLOKOSA-N 385.558 5.677 30 20 GKED Cn1c(CC(=NOC/C=C/c2ccccc2)c2ccccc2)nc2ccccc21 731664195 BLMSLOSWZRILOM-PVYWFCJDSA-N 381.479 5.250 30 20 GKED CN(CCc1ccccc1F)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 731756377 NPZTUEQFMKXIHY-UHFFFAOYSA-N 389.430 5.196 30 20 GKED Oc1ccccc1C=Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 733205212 NIPAZAYJLORBFP-UHFFFAOYSA-N 376.309 5.488 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 733633345 DLZQZKACBXGIGT-CQSZACIVSA-N 398.488 5.151 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)o1 734304507 LZKZYCZJAXZNTB-JXMROGBWSA-N 391.398 5.247 30 20 GKED C=CC[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccncc1 734460601 RDOLGYCPRYSSEF-CQSZACIVSA-N 377.296 5.650 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@H]1c1ccccc1C(F)(F)F 734479198 IWTNAIXYXRIJHT-AWEZNQCLSA-N 385.311 5.332 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=Cc4sc(C)nc4C)c23)cc1 736429897 JAKSSXIOOYXDFU-UHFFFAOYSA-N 379.514 5.186 30 20 GKED CC[C@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1nc(C)cs1 740060022 NYCQSOZXXJDZML-KRWDZBQOSA-N 396.541 5.002 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1 743201935 RQRWZNZMZIXKFA-OAHLLOKOSA-N 380.419 5.199 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cc2c3ccccc3n(C)c2s1 745063353 IXMITYYKBRYQAV-UHFFFAOYSA-N 385.492 5.093 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1ccccc1)Cc1ccccc1F 745710083 YFQKMGXQJOHVSR-UHFFFAOYSA-N 375.472 5.097 30 20 GKED O=C(/C(=C\c1ccc(Cl)nc1)c1nc2ccccc2s1)c1ccccc1 748994113 GIQBEKSJWZKNPI-FOWTUZBSSA-N 376.868 5.768 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccc(C(F)(F)F)cc1)C(C)C)c1ccncc1 749202015 LARMVVMKTMDJBL-RTBURBONSA-N 391.437 5.414 30 20 GKED Cc1nc(Cl)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 751612024 ITJXVGSBJZJIKI-SFHVURJKSA-N 396.277 5.605 30 20 GKED CC(CC1CCOCC1)=NNc1nc(C)nc2sc(-c3ccccc3)cc12 757559298 AHNXVEYEUFZXHF-UHFFFAOYSA-N 380.517 5.271 30 20 GKED COC1CCC(CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CC1 759861366 IYGVQDLBXKTZML-UHFFFAOYSA-N 396.918 5.340 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1ccc2ccccc2n1 760963785 OIUVHQKTOBLSBH-KRWDZBQOSA-N 376.406 5.201 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1CCC(c2nnc3ccccn23)CC1 775144103 SFDYEWORZVLZNE-IBGZPJMESA-N 384.568 5.212 30 20 GKED C[C@H](NCC/C=C\c1ccc(Br)cc1)c1ccc(OCC#N)cc1 775336630 OHAYSHWUUMIRBB-OUMXJLHTSA-N 385.305 5.106 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(COc2ccccc2)c1 779030182 LCCMWMOONMJTIX-UHFFFAOYSA-N 376.456 5.121 30 20 GKED CC(C)(C#N)CCCOC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 783209943 LAWJHXUJXLLUTP-UHFFFAOYSA-N 393.270 5.667 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccsc3)n2)cc1 783360949 JTEBCRBKWVBTRQ-QGZVFWFLSA-N 382.510 5.079 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 785755743 YOBWNPCREBVNIC-OAQYLSRUSA-N 386.517 5.090 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCc2cn(C(C)C)nc21 789457654 JOFTTWKVLJOLPD-HXUWFJFHSA-N 380.536 5.515 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2cccc(C(F)(F)F)c2)cn1 792858819 MUFLJKPZPWWUBH-MDZDMXLPSA-N 384.357 5.067 30 20 GKED Cc1cc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1C=O 793390722 PGQXVDOAAKWDMP-UHFFFAOYSA-N 398.462 5.127 30 20 GKED COc1ccc(-c2cc(NCc3cc(C#N)cs3)ccc2OC(F)F)cc1 798089936 BCKKQRYSXZJVDO-UHFFFAOYSA-N 386.423 5.509 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2cccc3cccnc23)cc1 803082440 HVYFNFZEAAXWLK-KRWDZBQOSA-N 393.446 5.445 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 845842120 RHLHHWKHZMGPTF-LJQBUTKESA-N 397.396 5.118 30 20 GKED N#Cc1ccc(C2(NC(=S)Nc3ccc(SC(F)F)cc3)CCC2)cc1 848654367 YULBPNCBQXRJSO-UHFFFAOYSA-N 389.496 5.239 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CON=Cc1ccccc1C(F)(F)F 852185794 UPNNDEXNMAQXBF-UHFFFAOYSA-N 378.394 5.126 30 20 GKED CCC(C#N)(CC)C(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 860193849 DWIUBKRWHAFGTM-OAHLLOKOSA-N 394.496 5.078 30 20 GKED CCOC(=O)Nc1ccc(Br)cc1N[C@@H](C)c1cccc(C#N)c1 864021158 ICZGJSSTPGPNBS-LBPRGKRZSA-N 388.265 5.062 30 20 GKED Cc1nc(-c2ccc(CC/N=C/c3cc4ccccc4nc3O)s2)cs1 912780571 ADJWCCQXJLLDKP-SRZZPIQSSA-N 379.510 5.095 30 20 GKED CCCCCCCCCC(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21 914833294 RTLIWJMVEWBBMJ-OAQYLSRUSA-N 386.580 5.232 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c(F)cccc2Cl)cc1 915085304 AAZCWUIFOYKTBC-IBGZPJMESA-N 378.834 5.316 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915861599 DFWFTNXFFGWKFG-HSZRJFAPSA-N 397.503 5.086 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1cccc(OC(F)F)c1 915985845 YJAMMDMLCVNHLM-ZHACJKMWSA-N 381.378 5.158 30 20 GKED C[C@H](C=Nn1c(S)nnc1-c1ccc(Cl)cc1Cl)c1ccccc1 916276730 HVNATIVCHQBYEL-LLVKDONJSA-N 377.300 5.178 30 20 GKED Cc1cc(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1Cl 917046207 HSMQUZMIRHXEGK-ZDUSSCGKSA-N 391.279 5.167 30 20 GKED COc1ccc(C=Nn2c3ccccc3c3ccccc32)c2cc(C(=O)O)oc12 1776112892 OXDWWNFYYCPXEV-UHFFFAOYSA-N 384.391 5.130 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2csc(-c3ccc(CC)cc3)n2)CC1 1776169874 DEBPPCYHIAZHDI-UHFFFAOYSA-N 384.545 5.006 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(C(=O)O)s2)c2c(c1)C(C)(C)CC2 1776269189 BVPJWCBBXYEOCD-SOFGYWHQSA-N 382.525 5.864 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(F)c(C(F)(F)F)c1 1776354291 BBEUENVOZFCYKQ-DAXSKMNVSA-N 396.336 5.226 30 20 GKED CC(C)c1cccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)c1 1776375330 GKOHDGXJGVUPJI-FLIBITNWSA-N 390.435 5.576 30 20 GKED Cc1cc2c(s1)C/C(=C\c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777428024 DNGPOLAOOQJUJX-GIJQJNRQSA-N 390.460 5.156 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccc(F)cc2)c2ccc(OC)cc2)cc1 62258746 SESFOFNNEMOAOH-XMMPIXPASA-N 377.459 5.278 30 20 GKED C=CCN(C(=O)c1sc2ccc(F)cc2c1C)c1nc2c(s1)CCCC2 64692217 MBMDXIMRNXSZSJ-UHFFFAOYSA-N 386.517 5.517 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccc(F)cc2Cl)c1 65663912 OYPJRSMUFUVTRS-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccoc1C 97545431 WXTKFFZUPPTGAA-CYBMUJFWSA-N 393.434 5.905 30 20 GKED Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c12 108981834 YIXPTDQJGKBSSI-ZDUSSCGKSA-N 394.500 5.301 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 109234714 GGTURUZJGWSNAJ-QGZVFWFLSA-N 394.515 5.156 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccccc1SCc1cccs1 109552861 BYTWVBRDMOIZOF-UHFFFAOYSA-N 380.494 5.173 30 20 GKED CN(C(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1)c1cccc(C#N)c1 128705404 NUDCNUXQHPBAIL-UHFFFAOYSA-N 398.491 5.003 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 153717101 HCRIGNQGJQCAMO-QFIPXVFZSA-N 386.455 5.361 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 158772926 MNKGGJVZGLDRJZ-KBXCAEBGSA-N 394.521 5.176 30 20 GKED CCCCn1ncc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1C 162868611 DQYUJMXVVXWRDH-UHFFFAOYSA-N 390.512 5.267 30 20 GKED CC(C)(C)O[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 179224515 KKVABRSKINJSGO-BEFAXECRSA-N 397.425 5.164 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1ccc2[nH]ccc2c1 179788316 MMZCAWBVNFVGAD-UHFFFAOYSA-N 396.450 5.107 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1)c1ccccn1 179791192 IZJJADHVRDEEGZ-AWEZNQCLSA-N 388.370 5.199 30 20 GKED CC(C)(C)n1cnnc1SCCC(C#N)(c1ccccc1)c1ccccc1 193067612 AYFOYRZZPJNIIX-UHFFFAOYSA-N 376.529 5.025 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(F)ccc2s1)c1nc2ccccc2n1C(F)F 193284870 QHSWKGPXLHFYEM-LBPRGKRZSA-N 385.370 5.275 30 20 GKED N#CCCn1cc(CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c(-c2ccccc2)n1 248967726 CUJDUOLVTQXZQJ-CYFREDJKSA-N 397.526 5.065 30 20 GKED COc1ccccc1[C@@H](Nc1cc(C#N)ccc1C(F)(F)F)c1ccccn1 302378222 HOAHOOLPWDCYRS-HXUWFJFHSA-N 383.373 5.182 30 20 GKED N#Cc1cc(N2CCCC[C@H]2c2cc3ccccc3[nH]2)nc2ccc([N+](=O)[O-])cc12 302699171 WZXIZNRYRQITHE-QFIPXVFZSA-N 397.438 5.228 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/[C@H]5CCCN=C5O)(C4)C2)C3)cc1C 328968363 AIXPHXYUSGOBOB-WBJPEYBSSA-N 380.532 5.217 30 20 GKED CC[C@H](CC(F)F)C(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410691458 VQCUXRNGKVSPLI-NOZJJQNGSA-N 391.302 5.449 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cnc(-c4ccncc4)s3)c2C#N)[C@H](C)C1 410977778 KWBMPDMFRBTMAX-NWDGAFQWSA-N 394.525 5.076 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@H]3C)s1 410982260 OXSYXSVVQBNDHB-CKYFFXLPSA-N 389.546 5.030 30 20 GKED CC(C)C1(c2ccccc2)CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 416807599 HHRUVSUJFATMPK-SFHVURJKSA-N 393.556 5.380 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 426668546 FUUPLWRULGMXLH-RBBKRZOGSA-N 389.886 5.247 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(Cl)ccc2c1OC(C)(C)C2 435334035 VWSFTAVLGOLEJY-UHFFFAOYSA-N 395.890 5.145 30 20 GKED CN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438660464 JENQHTFCHISMIZ-UHFFFAOYSA-N 393.393 5.293 30 20 GKED N#Cc1ccc(OCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1Cl 438885827 LBICSGXWWPEPPN-UHFFFAOYSA-N 380.618 5.147 30 20 GKED Cc1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c(C)c1O 439290780 BQPXDFNSRARYAL-UHFFFAOYSA-N 392.842 5.579 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 439309878 LVFDBVXKMGXGGW-OAHLLOKOSA-N 381.785 5.525 30 20 GKED CCCc1c(NC(=O)CC/C=C\c2ccccc2)cnn1-c1cccc(C#N)c1 440090476 HBSXDJWATNSEET-SDQBBNPISA-N 384.483 5.129 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2)cs1 442617442 NDBZFWGAEURGBI-HNNXBMFYSA-N 375.478 5.218 30 20 GKED Cc1cc(Br)ccc1NC(=O)CS[C@@H](C)c1cccc(C#N)c1 443152624 BSDOYMOPAAISIF-ZDUSSCGKSA-N 389.318 5.062 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 444453483 IMDQYRAYTSYZMC-UHFFFAOYSA-N 381.435 5.179 30 20 GKED N#CCCCOc1cccnc1NC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1 455162693 GKJDRSMEARHUFI-GOSISDBHSA-N 398.894 5.177 30 20 GKED C=CCn1c(SCc2ncc(-c3ccc(C)cc3)o2)nnc1-c1ccccc1 462982768 YGZMLWKPFCJFQI-UHFFFAOYSA-N 388.496 5.387 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1ccccc1)c1ccc(C#N)cc1 463503003 FHKOBYHTFVMANE-PMACEKPBSA-N 383.495 5.592 30 20 GKED C[C@@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccc(C#N)cc1 465659945 MSMVQHFWFGTTLR-OAHLLOKOSA-N 383.442 5.052 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 467283567 KBWVOGFPWJGFDX-UHFFFAOYSA-N 383.879 5.107 30 20 GKED C[C@@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)CC[C@@H]1c1ccccc1 469454569 LQZWDIFJKXRWOT-CTNGQTDRSA-N 385.511 5.211 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 474407627 JAAICZCJFXKAPV-KRWDZBQOSA-N 389.480 5.026 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nc3cccnc3s2)cc1F 478379359 OTTFTPOKCKUGNY-UHFFFAOYSA-N 376.416 5.106 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nnn(-c2ccc(C)cc2)c1C)c1ccc(F)c(F)c1 480658261 BDWHZOXDQBHLOU-YCRPNKLZSA-N 382.458 5.130 30 20 GKED CC(C)C[C@@H]1CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481738258 GOUSMBWZBHPYIK-FQEVSTJZSA-N 395.478 5.319 30 20 GKED CC[C@@H](C)n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C 482556330 JRCDVKRCADZULW-PBHICJAKSA-N 378.501 5.085 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCCC[C@@H]1C(F)(F)F 484045780 UJBPKMWPMJKYAP-OALUTQOASA-N 395.469 5.095 30 20 GKED N#CCc1ccc(NC(=O)CNc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 488040068 FCONNBOYLYGPRH-UHFFFAOYSA-N 393.849 5.263 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F 497813527 SHAMSDBUABOKOG-DLBZAZTESA-N 380.419 5.307 30 20 GKED Cc1nc(C(=O)N(Cc2ccc(-c3cccc(F)c3)s2)C(C)C)ccc1C#N 501747664 GEANSQHNLVZHNS-UHFFFAOYSA-N 393.487 5.180 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc(C)cs3)c3ccccc3n2)c(C)c1 505294692 YEOGSEZWUAREOI-FQEVSTJZSA-N 397.503 5.774 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1/C=C\c1ccccc1 506683889 UFFDSWWBRHXFEK-CFQPOLKNSA-N 391.540 5.648 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(F)cc2)cc1Cl 510004166 HJKIYFJXUXDGPK-HXUWFJFHSA-N 393.849 5.456 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC)c1ccc(Cl)s1 513079084 ZBULRNVUCPRYBB-INIZCTEOSA-N 375.925 5.346 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)Nc1ccc(CC#N)cc1 513720395 KIJDIQIKXRBXOL-UHFFFAOYSA-N 386.238 5.275 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 519049688 BTRNLKJUQLTLEQ-NXVVXOECSA-N 387.508 5.207 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3coc(-c4ccccc4)n3)cc2)c1 519504231 FOKOOZQHAKQTGF-UHFFFAOYSA-N 395.418 5.187 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(F)(F)F)c1 520171263 ZDBUKVWTAKJRKU-UHFFFAOYSA-N 375.394 5.267 30 20 GKED N#C[C@H](C(=O)c1sccc1C1CC1)c1nc(-c2c(F)cccc2F)cs1 521552211 MRWGEVCBQWSMQZ-GFCCVEGCSA-N 386.448 5.517 30 20 GKED C[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)n1cccc1 522899239 WVYUNAXGLCYELO-CYBMUJFWSA-N 381.423 5.102 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)Cc2ccc(C#N)cc2)C(C)C)cc1 525079884 RXBJLZBYPAFJFT-UHFFFAOYSA-N 398.506 5.214 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)Cc1cccc(C#N)c1 530913203 VGTOUVDAUASTSG-ZDUSSCGKSA-N 395.915 5.064 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=O)Nc1ccc(C(C)(C)C#N)cc1 532884303 ZKXYRDXDSHEFSK-UHFFFAOYSA-N 376.287 5.458 30 20 GKED CC[C@H](C)N(CC(=O)Nc1ccccc1SC[C@H](C)C#N)Cc1ccccc1 532909354 LLPWEOZOVCUXKZ-MOPGFXCFSA-N 395.572 5.178 30 20 GKED C[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)c1ccc(C#N)cc1 533608828 IZTHZACYMHBADO-LBPRGKRZSA-N 388.323 5.839 30 20 GKED CCCN(Cc1ccccc1Br)C(=O)c1ccc(C2(C#N)CC2)cc1 535507617 LSULYNJVXJYAQF-UHFFFAOYSA-N 397.316 5.057 30 20 GKED N#Cc1ccc2ncc(CNc3cc(Cl)ccc3SCC(F)(F)F)n2c1 536101061 JMQDOEWGDBYZPT-UHFFFAOYSA-N 396.825 5.126 30 20 GKED C=C[C@H](CC(=O)N1CCc2sc(-c3csc(C)n3)cc2C1)c1ccccc1 537930234 HMDZVNJWOGEGJC-MRXNPFEDSA-N 394.565 5.425 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 542124770 QPXWXZOCLILDDW-QHCPKHFHSA-N 389.930 5.610 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1ccc(Oc3cccc(C#N)c3)cc1)CCO2 554212999 PVYUAFUGECHFGQ-UHFFFAOYSA-N 399.450 5.086 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)N[C@H](CCCC#N)c1ccccc1 562289519 CQXALIBUEKOUFM-LJQANCHMSA-N 381.545 5.664 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(Br)c1Cl)c1ccccc1 578085133 JWACFKRRAKXUGO-CYBMUJFWSA-N 377.669 5.129 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 578462847 HCLWSZJUTIZNTQ-LJQANCHMSA-N 388.870 5.045 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(-c2ccsc2)nc1C 580109739 NVUMKJNHDCEUMJ-UHFFFAOYSA-N 394.544 5.114 30 20 GKED C[C@@H]1CCC[C@H](N(Cc2ccc3c(c2)OCO3)C(=O)CCCCCC#N)[C@@H]1C 588901219 XRZJOVUOXXTQQH-GGPKGHCWSA-N 384.520 5.043 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2F)o1)c1nc2cc(F)ccc2s1 592974733 YHAIFSGRWDEAJG-CYBMUJFWSA-N 380.375 5.325 30 20 GKED N#Cc1csc(CN[C@H]2CCCSc3ccc(Br)cc32)c1 598997061 UJXZWZIHFXNNGX-HNNXBMFYSA-N 379.348 5.099 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3)on2)sc2c1-c1ccccc1CC2 603992503 WSTKWWJTNONOBM-UHFFFAOYSA-N 397.459 5.293 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)s1 604029876 IWRAKDHAJLQBIX-UHFFFAOYSA-N 392.509 5.143 30 20 GKED CCC[C@@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608860873 MQHOJIVYEXDJQY-AUUYWEPGSA-N 389.421 5.479 30 20 GKED Cc1ccc(CC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 609062314 LWWHIBRZIHKOAJ-UHFFFAOYSA-N 396.899 5.342 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609437105 PJKFZLYPDIBAPU-DEOSSOPVSA-N 397.478 6.028 30 20 GKED CN(Cc1ccc(C(C)(C)C)cc1)C(=O)CCCCOc1cccc(C#N)c1 609497131 XWPMHIAGRALHJU-UHFFFAOYSA-N 378.516 5.063 30 20 GKED CC[C@@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610015350 FZEJMIBZFRKAOE-OXQOHEQNSA-N 378.476 5.178 30 20 GKED CN(Cc1ccc(Cl)cc1Cl)C(=O)N[C@H](CCC#N)c1ccccc1 610972558 IDVSNQVYTZWPCE-GOSISDBHSA-N 376.287 5.180 30 20 GKED CCCCc1noc([C@@H](C)SCc2ccc(C#N)cc2Br)n1 611496578 MVMJZRNAOXRFIW-LLVKDONJSA-N 380.311 5.041 30 20 GKED CC(C)(C#N)CNC(=O)c1oc2ccccc2c1CSCc1ccccc1 611688689 JLZMTPYYYIFKAT-UHFFFAOYSA-N 378.497 5.146 30 20 GKED Cn1cc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c2cc(F)ccc21 619126137 FUJMWGMKNBIMRZ-UHFFFAOYSA-N 398.322 5.101 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)NCc1ccc(C#N)c(Cl)c1 619769233 YXYXVBPNOHAIBW-UHFFFAOYSA-N 396.705 5.250 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1C[C@H]2CCC[C@H]2C1 646439051 QNHSFJFIWWGSRN-PHIMTYICSA-N 398.322 5.240 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc1C(F)(F)F 678296543 FYVGHCZMPBSTKT-AOOOYVTPSA-N 383.229 5.017 30 20 GKED N#C[C@H](C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1nc2ccccc2s1 683221502 PJRBCZMKVDOWRR-SECBINFHSA-N 382.313 5.083 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1cc(OCC)ccc1OCC 726903244 FKHVJZLUNZMDCU-UHFFFAOYSA-N 388.508 5.008 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1Cl 727627419 NQXWSXVPSYUFEM-LLLGYDHXSA-N 388.854 5.244 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(N3CCCCC3)c(F)c2)cc1 728700262 MXHFQTKHAWEOON-UUKWBXHYSA-N 378.447 5.003 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1ccnc(Cl)c1 729245659 XQZRLKOXLFXVCY-UHFFFAOYSA-N 382.250 5.107 30 20 GKED O=C(/C=C\c1ccc2ncccc2c1)c1c[nH]c2cc(Br)ccc12 729937029 KUENOJRUFZXFAX-YWEYNIOJSA-N 377.241 5.375 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1sc2ccccc2c1Cl 730989751 PGIGKZDSUDPAMQ-LBPRGKRZSA-N 386.929 6.059 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)OC(=O)c3ccccc3OCC#N)s2)cc1 739297692 FQRUOHKZUYDERE-MRXNPFEDSA-N 392.480 5.247 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 749322430 DNRWEPCSOKMCMM-DNVCBOLYSA-N 391.496 5.067 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@H]2c2ccc(Br)s2)cc1 753589534 IVKIXFPALXUBLZ-CJNGLKHVSA-N 391.334 5.139 30 20 GKED C#CC[C@@H](NC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 757778016 LNZMLXZFBFEGQK-JOCHJYFZSA-N 398.466 5.217 30 20 GKED Cc1ccc(C(C)(C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 759945794 OKXWSSIBIZOKLA-JOCHJYFZSA-N 384.483 5.102 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CCC[C@@H]2c2ccsc2)c1=S 764888617 HOHFNUZYIAPTRJ-OAHLLOKOSA-N 388.587 5.185 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 770181598 WKHKFIMZNWKAKN-OAQYLSRUSA-N 385.467 5.612 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 770588352 KMGWBUFVTADLRL-GOSISDBHSA-N 387.842 5.141 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NCc1ccccc1Oc1ccccc1 780670271 IWHCXBQVBKUUSV-KRWDZBQOSA-N 387.439 5.091 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3)cc2OC)c1 781417062 YBABAGGYNGZSAT-QHCPKHFHSA-N 386.495 5.333 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 785765213 FRGUJBGOWUOFEY-HXUWFJFHSA-N 379.529 5.566 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)C#Cc1ccc(C(F)(F)F)cc1 790818556 PWFUJOIFGONMJW-AWEZNQCLSA-N 394.462 5.165 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nccc2ccccc12 792094590 GFOOQTCAYRJSCF-HNNXBMFYSA-N 389.307 5.802 30 20 GKED N#C[C@@H](C(=O)CCCSc1ccc(Cl)cc1)c1nccc2ccccc12 792102287 HZIGAFMIICVWKC-IBGZPJMESA-N 380.900 5.637 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C/C(=O)c1ccc(C(=O)N(C)C)cc1 792926370 QDGXUMVJLBRVCC-VEEDHSDUSA-N 387.401 5.250 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 796750125 ZGDHLMNQWGUDNI-INIZCTEOSA-N 399.516 5.412 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797568932 YCYPZNDRGVCHQY-RISCZKNCSA-N 378.950 5.451 30 20 GKED C[C@H](O)c1cc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)ccc1F 804803721 RVGWVPKDIVWHBB-AWEZNQCLSA-N 392.455 5.154 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC[C@H](O)CC(C)(C)C#N)cc3C2)cc1 857242367 BGANFYAPIPYWDM-HSZRJFAPSA-N 377.532 5.043 30 20 GKED Cc1nc(C2CCC2)sc1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 888862462 GKYLYZGAHHQOKN-ZDUSSCGKSA-N 385.558 5.152 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2sccc2-c2ccccc2)cc1 915087896 BQRUCPNODUZEOI-HSZRJFAPSA-N 394.499 6.323 30 20 GKED Oc1cccc(C=Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1O 915983345 YZUNYBAZXGQBGL-UHFFFAOYSA-N 375.211 5.343 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc2ccccc2c1 916309573 IHBINZQCPPQPCA-UHFFFAOYSA-N 395.487 5.469 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1C(C)C 916847629 NEHKHGMBQLFDGK-YJBOKZPZSA-N 378.497 5.372 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 917046423 BPIXHFVXCRYPAV-NSHDSACASA-N 381.309 5.474 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 917716515 FNUGHYPUBIKJRS-UHFFFAOYSA-N 391.477 5.564 30 20 GKED Cc1ccc(-c2ncc(C=NNc3ccc(Cl)c(C(=O)O)c3)s2)cc1C 1776034277 XLDBPIMMDYSEHF-UHFFFAOYSA-N 385.876 5.225 30 20 GKED CCC(=NNc1nccc2sccc12)c1ccc(OCCCCC(=O)O)cc1 1776036160 IYAYAFADQZEJOW-UHFFFAOYSA-N 397.500 5.156 30 20 GKED CCCCCCCOc1ccc(C(C)=NNc2ccc(C(=O)O)c(F)c2)cc1 1776073652 GDSCRQFWGGTLMS-UHFFFAOYSA-N 386.467 5.709 30 20 GKED COc1cc(C)ccc1C(=O)/C=C/c1ccc(-c2cccc(CC(=O)O)c2)cc1 1777280785 PLRGPICYWMLVQL-UKTHLTGXSA-N 386.447 5.194 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(Cl)c(F)c1 1777569331 DZCWSZPKISJDJF-CLTKARDFSA-N 386.762 5.039 30 20 GKED O=C(/C=C/c1cc2c(Br)cccc2s1)c1csc(C(=O)O)c1 1777569477 YTZGUZHTMAEEMA-SNAWJCMRSA-N 393.283 5.320 30 20 GKED CCCn1c(C)c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c2cc(OC)ccc21 25439415 IZPQCTZHUYZKQY-UHFFFAOYSA-N 389.499 5.422 30 20 GKED Cc1nc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)ccc1C#N 31889568 ZVCYYISZPFOWNF-UHFFFAOYSA-N 395.296 5.006 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1 46065646 SLECWBOPSLRKAU-UHFFFAOYSA-N 398.249 5.499 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)c1ccccc1Sc1ccccc1C#N 57469298 BIHOASTULFATJB-INIZCTEOSA-N 376.481 5.054 30 20 GKED O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 58099830 XYQFFHNHNISBDN-UHFFFAOYSA-N 396.218 5.024 30 20 GKED Cc1ccsc1CN(C)C(=O)c1ccccc1Sc1ccccc1C#N 60637462 CVSXCMQOAJVXOH-UHFFFAOYSA-N 378.522 5.352 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 72025226 MZDKRBUNYWDUNG-AWNIVKPZSA-N 399.406 5.219 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1csc(-c2cccs2)n1 104914882 FSJUHJXKBSIXNO-UHFFFAOYSA-N 394.974 5.344 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@H](C)c3ccc(OCC#N)cc3)c2)cc1 105487548 QBIOBMTVIJOSRY-LJQANCHMSA-N 399.494 5.001 30 20 GKED CCC[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 106116850 LYNABGMUUCLAEH-OAQYLSRUSA-N 385.467 5.576 30 20 GKED C=CC[C@H](C)NC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 117001021 OXMKDADORBZIBH-ZDUSSCGKSA-N 391.393 5.044 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 132833866 PREXIJXPLZOFMM-CQSZACIVSA-N 375.428 5.088 30 20 GKED Cc1ccc(C(=O)N[C@@H](CCC#N)c2ccccc2)cc1NC(=O)OC(C)(C)C 153699733 YDWNHHVIQMBQKE-IBGZPJMESA-N 393.487 5.117 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(NC(=O)c2ccccc2)c1C)c1ccccc1 156657733 OZRNEJZFZZMDQH-IBGZPJMESA-N 384.479 5.546 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)n1 177780107 NZZZZXBUHJANEX-HZSPNIEDSA-N 394.418 5.145 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccn(-c2c(F)cccc2F)n1 180589099 LDHAKQJPCJDFNT-CQSZACIVSA-N 384.455 5.014 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCOc2c(F)cccc21 181712433 KDCILQUBDKDSKZ-PBHICJAKSA-N 399.491 5.113 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)csc1Br 185728002 GALVBDCSHREIKR-SNVBAGLBSA-N 395.347 5.466 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2csc(-c3ccccc3Cl)n2)cc1 303191834 WZMQXEHHHYMAKY-UHFFFAOYSA-N 381.888 5.517 30 20 GKED OC(=Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)[C@@H]1CCCCS1 329356062 ZEAPXQXODCFIRF-INIZCTEOSA-N 390.940 5.199 30 20 GKED OC(=Nc1cccc(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1)C1CC1 329515457 ONASUOJMDCURQQ-FQEVSTJZSA-N 392.503 5.378 30 20 GKED CCN(C(=O)c1csc(CCc2ccccc2)n1)[C@@H](C)c1ccc(C#N)cc1 409801614 PSIVJFUVQHYLAX-KRWDZBQOSA-N 389.524 5.023 30 20 GKED C[C@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccc(Cl)s1 426163919 BJLGASFWFUJEQT-NSHDSACASA-N 387.917 5.063 30 20 GKED N#Cc1c(F)cccc1CNC1(c2noc(C3CCCC3)n2)CCCCCC1 428418817 GTHZHXNJCUVWEW-UHFFFAOYSA-N 382.483 5.077 30 20 GKED N#Cc1ccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2)c(Cl)c1 430353082 LWCPEZCBYCYIOV-UHFFFAOYSA-N 398.853 5.317 30 20 GKED CC(C)[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431289038 VTIOASUJTNOMQN-LEWJYISDSA-N 385.458 5.396 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 433489476 RQZUHHIJLCJZOA-OXJNMPFZSA-N 393.918 5.792 30 20 GKED CC(C)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cn1 435005065 WOCJKCYAIUEGCJ-UHFFFAOYSA-N 393.434 5.482 30 20 GKED O=C(NCCC(F)(F)F)Nc1cc(C(F)(F)F)ccc1SCC(F)F 438377641 LTJFLVIAVFSMOW-UHFFFAOYSA-N 396.303 5.137 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@@]12CCCc1ccccc12 439232522 KKNOPCIGWBPLMA-ZDWFVDTJSA-N 376.525 5.314 30 20 GKED CC(C)[C@@H](NC(=O)NCC1CCC(C#N)CC1)c1cccc(C(F)(F)F)c1 440990934 VRVDMXYOBUYBAH-JTTJXQCZSA-N 381.442 5.032 30 20 GKED CCOc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1Cl 444033981 TVFSQDJOZISVEZ-UHFFFAOYSA-N 381.863 5.249 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(OC(F)F)c(F)c1 448944887 UDYFHTVDENHWRX-LBPRGKRZSA-N 394.418 5.003 30 20 GKED C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1C(=O)Nc1ccc(F)cc1C(F)(F)F 454700186 NORYUGOCWKZXOK-AEJSXWLSSA-N 386.311 5.428 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(Cc2ccc(F)cc2)CC1)c1ccccc1 458808751 ZNEIMWAUEPXPCN-HSZRJFAPSA-N 393.506 5.225 30 20 GKED C=C(C)Cn1c(COCC)nnc1N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 460944463 RJBGNDVLPOAMLQ-QGZVFWFLSA-N 395.334 5.039 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCCc2c(NC(=O)Nc3ccccc3F)cccc21 466864999 NDJYXERSQADRKL-INIZCTEOSA-N 395.478 5.351 30 20 GKED O=C(Nc1ccc(OCC(F)F)c(C(F)(F)F)c1)c1c(F)ccc(F)c1F 470218459 FFCQPVOOOIWCOA-UHFFFAOYSA-N 399.237 5.019 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 470477865 PZZJFEDOFPNJAW-HXUWFJFHSA-N 385.511 5.250 30 20 GKED N#CCCSc1ccccc1NC(=O)CCCc1cccc(C(F)(F)F)c1 471850076 YBPSYHJXALEEKT-UHFFFAOYSA-N 392.446 5.673 30 20 GKED Cc1nc(NC(=O)C[C@@H](CC#N)c2ccccc2)sc1Cc1ccc(F)cc1 474953511 LKBWMQZKPMNECB-GOSISDBHSA-N 393.487 5.208 30 20 GKED Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c(OCc2ccccc2)c1 475030979 MLXWLUBGFHLSKK-JOCHJYFZSA-N 384.479 5.600 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)[C@@H](C)Oc2ccc(C#N)cc2)o1 477905293 WUUZPXWJAOOZFK-CQSZACIVSA-N 380.831 5.186 30 20 GKED N#Cc1cccc(NC(=O)CSCc2nc(-c3ccccc3Cl)cs2)c1 478675973 QEAHIXHHRYSRRH-UHFFFAOYSA-N 399.928 5.207 30 20 GKED C[C@H](Sc1nnc(-c2ccccn2)n1-c1ccccc1)c1ccc(C#N)cc1 481352633 ZMQUOAVHGGFDMK-INIZCTEOSA-N 383.480 5.054 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccccc1OCc1csc(C)n1 482751051 OJMMPEHRNRHDCY-UHFFFAOYSA-N 384.545 5.239 30 20 GKED O=C(Nc1cc(F)c(OC(F)F)cc1F)c1ccccc1CCC(F)(F)F 490276903 YDGHWAPHPVXGPZ-UHFFFAOYSA-N 395.274 5.313 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 502049609 KLPSPUUJZGNBCL-UHFFFAOYSA-N 395.274 5.514 30 20 GKED C[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 505156953 PXNYGXOTETTZMT-YLJYHZDGSA-N 377.488 5.032 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2ccccn2)cc1 506855489 CEQLCBMLQHNKRH-UHFFFAOYSA-N 377.419 5.233 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1(c2cc(F)cc(C#N)c2)CC1 507769102 INMSFTFWVYCPBF-UHFFFAOYSA-N 391.273 5.084 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)o1)c1nc(-c2ccc(Cl)cc2Cl)cs1 509541199 LSVODTWDZDALPZ-JTQLQIEISA-N 397.670 5.853 30 20 GKED CCN(C(=O)c1cc(Br)ccc1Cl)[C@H](C)c1ccc(C#N)cc1 509593924 TUXMLIVOLSTCGB-GFCCVEGCSA-N 391.696 5.197 30 20 GKED C=CCOc1ccc(CNCc2cc(Cl)ccc2OCc2cccnc2)cc1 512551939 HSVBOEGTQMNWJM-UHFFFAOYSA-N 394.902 5.169 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 513325120 NPEVKHFQCLKBCQ-UHFFFAOYSA-N 382.504 5.318 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(Br)c2)n1 515287970 CIDQCPQABJDDOV-UHFFFAOYSA-N 393.253 5.397 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 515540144 LENFUXIRGWRWTO-INIZCTEOSA-N 384.888 5.619 30 20 GKED CCc1cccc2c1OCC[C@@H]2NC(=O)Nc1ccccc1SC[C@@H](C)C#N 520855695 XULAJYIBTPNTBP-YJBOKZPZSA-N 395.528 5.146 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)Nc3sc(C)c(CC)c3C#N)c12 524105438 DNPWEYQHOPSZJL-UHFFFAOYSA-N 394.500 5.109 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1cccc(F)c1 524406422 BHNITHXVBHCPFA-UHFFFAOYSA-N 375.403 5.229 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-c2cn3ccccc3n2)cc1)c1ccccc1 526979723 ZYIARGFTKASYSX-HXUWFJFHSA-N 380.451 5.027 30 20 GKED COc1ccc(CNC2(c3cccc(Cl)c3)CCCC2)cc1OCCCC#N 532470821 NNIADXZUHSYSIT-UHFFFAOYSA-N 398.934 5.590 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)Cc1cccc(C#N)c1 532740665 DXHGVYIYYZQUTM-UHFFFAOYSA-N 388.492 5.040 30 20 GKED C=CCn1c(S[C@@H](CCOC)c2ccccc2)nnc1-c1ccccc1OC 534054980 HFXAIPKKZSOJPW-FQEVSTJZSA-N 395.528 5.010 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccn2[C@@H](C)Cc2ccccc2)n1 536928004 CPAHKEMMIVBEHA-WMZOPIPTSA-N 377.513 5.362 30 20 GKED CN(C(=O)c1sccc1C#N)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 538438207 SEADSDYVVXPLQQ-JKSUJKDBSA-N 378.419 5.047 30 20 GKED C[C@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)c(F)c1 540710423 SMOCRJZVBHVPMY-OYHNWAKOSA-N 379.866 5.380 30 20 GKED CN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 540759549 XCJXVQQGXABHBX-KRWDZBQOSA-N 392.808 5.271 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@](F)(c2ccccc2F)C1 558797436 UJYJGENTTPRAAD-QHCPKHFHSA-N 384.470 5.780 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2NC(=O)c2sc3ccc(C#N)cc3c2C)cc1 560135005 KCZHQTCGFPJDPP-CTNGQTDRSA-N 390.508 5.040 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nccc4ccccc34)s2)cc1 571495360 GVEYWVLNPDGUPX-LJQANCHMSA-N 399.475 5.165 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 571844220 GGYDBYITYLXLOZ-HNNXBMFYSA-N 390.418 5.110 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NCc1cn(C)nc1-c1ccc(C#N)cc1 573407122 DUBCBMPLNODNNK-UHFFFAOYSA-N 399.542 5.260 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H]3CCc4ccc(C#N)cc43)s2)cc1 580680087 FGGDTUUIGZYXLG-SPLOXXLWSA-N 389.524 5.337 30 20 GKED C/C(=C/c1ccc(C)cc1)C(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 588402201 SZPPOGDBGREYOQ-RCBBPTIPSA-N 387.266 5.053 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC(C4CCCC4)CC3)cc2)ccn1 589364513 CGFYMWCUXQOKIJ-UHFFFAOYSA-N 390.487 5.180 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(CCc3ccc(O)cc3)CC2)c1 589741416 ZGLQLVWQNLKDKH-UHFFFAOYSA-N 394.515 5.224 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cc2)c1 596320167 SYCWHENQAYXONG-UHFFFAOYSA-N 398.462 5.732 30 20 GKED CCCN(C(=O)c1ccc([C@@H]2CCCOC2)cc1)c1cc(Cl)ccc1C#N 598808038 CBURTPMLSDYUDI-LJQANCHMSA-N 382.891 5.162 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603968328 LHBITLQYUKGBFZ-UHFFFAOYSA-N 376.481 5.464 30 20 GKED CC(C)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(Cl)cc1 608918540 JDKQWQKKAWSBSG-NRFANRHFSA-N 383.923 5.529 30 20 GKED Cc1ccccc1-c1nc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cs1 608935869 IRYSIMDWIFHQTN-UHFFFAOYSA-N 375.497 5.293 30 20 GKED CCC1(C)CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 609207024 NMXQUGSJFCUDEY-UHFFFAOYSA-N 377.488 5.703 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(F)c1 609221965 LWSAWEVOZUEJNO-MRXNPFEDSA-N 389.430 5.237 30 20 GKED CCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@H](CC)c1ccccc1 609499343 LVELDXXQEGJRFQ-HSZRJFAPSA-N 399.494 5.749 30 20 GKED Cc1nc(-c2cccc(NC(=O)CCCCOc3cccc(C#N)c3)c2)oc1C 609504315 MRCUSGBQXXMZIH-UHFFFAOYSA-N 389.455 5.018 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1OC(F)F 609636191 ATRZELWXJKVTFY-ZDUSSCGKSA-N 391.443 5.635 30 20 GKED Cc1cc(C(=O)CS[C@@H](C)c2ccc(C#N)cc2)c(C)n1-c1nccs1 609825946 DAYVMCHAEPSBLD-HNNXBMFYSA-N 381.526 5.099 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)cc1 610078586 UFGWEXQQPUYIGQ-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCCCC[C@@H]1c1ccc(CC)o1 610094475 KLIUMHRSALTNTP-LJQANCHMSA-N 381.476 5.262 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccncc1 610722861 OQEOALNGERHJAJ-OAHLLOKOSA-N 391.858 5.531 30 20 GKED Fc1ccc([C@@H](NCc2cccnc2C(F)(F)F)C(F)(F)F)cc1Cl 625378365 KMDKQQKQEGDXRF-GFCCVEGCSA-N 386.698 5.286 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cc(C2CC2)no1 648494172 BGPMLHRLTBXNOZ-UHFFFAOYSA-N 396.262 5.094 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)CCCC1 661848177 ITPBYWBYNCUXKT-UHFFFAOYSA-N 383.561 5.423 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cccc1-c1ccccn1 677274688 CYFMXXMZQFUDDZ-KRWDZBQOSA-N 387.439 5.296 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)cc1NC(C)=O 726429907 WLHIFZPZPDUEPB-NTMALXAHSA-N 395.455 5.417 30 20 GKED N#Cc1ccccc1NC(=S)N1CCC[C@H]1c1ccccc1C(F)(F)F 727980472 MZBQDSZGVGIFNH-KRWDZBQOSA-N 375.419 5.111 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 729260886 PDHDQUOLHCANLY-KRWDZBQOSA-N 396.490 5.555 30 20 GKED Cc1cccc2c1CCN(C(=O)Nc1ccc(Oc3cccc(C#N)c3)cc1)C2 731400761 TVBPXXWVOMACMZ-UHFFFAOYSA-N 383.451 5.249 30 20 GKED N#C[C@H](NC(=O)Cc1c(Cl)cccc1Cl)c1ccc(Cl)c(Cl)c1 731643496 GIQOQGBLXCXCNJ-HNNXBMFYSA-N 388.081 5.224 30 20 GKED C#CC[C@H](OC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccccn1 733691861 CGCGYYMMWMPVCY-DEOSSOPVSA-N 380.447 5.006 30 20 GKED C#Cc1cccc(N(C(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)C(C)C)c1 733977961 SYOJJNVJWKJEMG-UHFFFAOYSA-N 387.483 5.260 30 20 GKED C=CC[C@H](NC(=O)N(CCc1ccc(F)cc1)C1CCCC1)c1ccncc1 734684373 NKKXRCBHGYQWOK-QFIPXVFZSA-N 381.495 5.035 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)Cc1cc(Cl)ccc1OCC#N 735309324 CSHSEHCCOLNQQV-UHFFFAOYSA-N 382.813 5.283 30 20 GKED CCC(CC)CN(CCC#N)C(=S)Nc1ccc(OC(F)F)c(Cl)c1 735628195 NGQVMEVFMWHZET-UHFFFAOYSA-N 389.899 5.290 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 740538703 IZPZKBLGXJXNEU-ZFWWWQNUSA-N 382.435 5.377 30 20 GKED C/C(=C\C(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 742646387 NMWUMEMWPAWKEQ-KQPPXVQYSA-N 378.781 5.143 30 20 GKED CC(=NNc1ccc(Cl)nc1)c1cnn(-c2ccc(Cl)cc2Cl)c1C 743449863 GQJLOTGQQBLQAB-UHFFFAOYSA-N 394.693 5.372 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC3(CCCCCC3)C2)c1 743612036 RWJJOZKCBNEGSO-FQEVSTJZSA-N 383.536 5.014 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1cccc(Cl)c1 744033657 UIHGLCKBXNAJGK-QFYYESIMSA-N 395.673 5.098 30 20 GKED N#CCC1(COC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccc(F)cc23)CC1 744279648 XQAHMIGFKXMGNV-UHFFFAOYSA-N 394.421 5.283 30 20 GKED CCN(CCc1cccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746659616 MGXKZLMELBDMRT-JOCHJYFZSA-N 389.524 5.500 30 20 GKED CCn1cc(CC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c2ccccc21 748483927 ZBIOPDBYWMIZGQ-FQEVSTJZSA-N 399.519 5.512 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](c1cccc(Cl)c1)c1ccccn1 749447898 HTTIJGVZQGYKFS-NRFANRHFSA-N 398.293 5.170 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 754474886 XLHWEEQGHGKRMT-UHFFFAOYSA-N 375.513 5.552 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2/CCc3sc(Br)cc3C2=O)cc1 754687790 NAFKWZMWHOEHFZ-LFTLCWSBSA-N 388.286 5.014 30 20 GKED Cc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 770176488 COJMCMLYKLSGJO-CPJSRVTESA-N 397.522 5.745 30 20 GKED C#CCCCCCC(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 780255516 STDAJTDQLQAAIR-LLVKDONJSA-N 390.694 5.101 30 20 GKED N#CC1(NC(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)CCCC1 786736650 ZBSKHSMFDSLNTL-UHFFFAOYSA-N 375.859 5.121 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1 789450661 ONQRQYYLUDOUEM-OAQYLSRUSA-N 384.470 6.186 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797569066 MWHLFIBDXOWQAP-SJORKVTESA-N 384.545 5.598 30 20 GKED C=CC[C@H](NCc1cc(Br)cc(Br)c1)c1ccncc1 808390012 YRQSVUYVECCYKG-INIZCTEOSA-N 396.126 5.014 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(-c3ccccc3Cl)s2)c(C(F)F)n1 812241576 KDQUWIMTMSOBTD-SREVYHEPSA-N 378.831 5.636 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1cc(C(F)(F)F)ccn1 813215793 BTUQQJYLIPHOQE-FHWLQOOXSA-N 380.369 5.234 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1 819440583 TURFCBKXQURJTK-DYVFJYSZSA-N 396.434 5.125 30 20 GKED N#C[C@@H](C(=O)CCc1ncc(-c2ccccc2Cl)o1)c1nc(C2CC2)cs1 842938574 LBOJTINHVDPORJ-AWEZNQCLSA-N 397.887 5.138 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C)[C@H](C)c2cccc(Cl)c2)cc1OC 914490262 HRJRZOFFWLZWTF-UILAEWCASA-N 385.891 5.146 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H]1CCCc2ccccc21 915352405 HXFLCTSKDJRUJU-LOSJGSFVSA-N 395.506 5.883 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354001 SPFYSHKRMMUDDP-FQEVSTJZSA-N 390.874 5.054 30 20 GKED COc1cccc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 918034214 JVKIZPVUMNZBEK-UZUQRXQVSA-N 385.467 5.233 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 918491087 XOYVAFCWBKYKKF-ACJLOTCBSA-N 398.890 5.973 30 20 GKED C#CCCOc1ccc(/C=C2\SC(=S)N([C@@H](C)c3ccccc3)C2=O)cc1 920472943 POZGTYCWUVUNPC-UKEODDKASA-N 393.533 5.051 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)c1 1776036758 HJZPSENHUCYIGO-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)c1cccc(NN=C2CCCCC[C@H]2c2ccccc2C(F)(F)F)c1 1776036956 ATHAMLBFNAUHDG-KRWDZBQOSA-N 390.405 5.919 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C/C(=O)c3ccc(F)c(F)c3)c2)c1 1776125816 SZFYUBMIBSTPEP-JXMROGBWSA-N 394.373 5.138 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2cc3[nH]c(C(=O)O)cc3o2)cc1 1776125920 WLQHMWBTWFVLII-VAWYXSNFSA-N 395.455 5.704 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776364795 HEQCSJRWNSZYKC-WEVVVXLNSA-N 382.506 5.996 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776388546 BVYLBUXKXWQQEV-QBFSEMIESA-N 376.408 5.328 30 20 GKED CCCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776794110 SXYFJCNFRFLDTI-UKTHLTGXSA-N 396.483 5.637 30 20 GKED COc1cccc2cc(C(=O)/C=C/c3c(F)ccc4sc(C(=O)O)cc34)oc12 1777385395 LBFRSNXAIQFZSD-FNORWQNLSA-N 396.395 5.390 30 20 GKED N#Cc1ccc(/C=C\c2nc3ccccc3c(-c3ccccc3)c2CC(=O)O)cc1 1777566542 ZCGZAGMAJOYWAQ-PFONDFGASA-N 390.442 5.571 30 20 GKED Cc1[nH]c2ccccc2c1CCNC(=O)Nc1ccccc1S[C@@H](C)CC#N 66955651 GNLNOXIMTNWYHN-HNNXBMFYSA-N 392.528 5.235 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(C(C)C)nc2c1cnn2C(C)C 72001215 KJYXDYPAFYSXHH-UHFFFAOYSA-N 394.494 5.103 30 20 GKED CSc1ccc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 97428225 RXTOMNFFBNZSPB-UHFFFAOYSA-N 388.492 5.306 30 20 GKED N#CC1CCN(C(=O)[C@H](Sc2ccc(F)c(Cl)c2)c2ccccc2)CC1 106758599 LURHDXDCPXLERM-LJQANCHMSA-N 388.895 5.075 30 20 GKED CC[C@H](OC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 113656881 FLNJPUSIPOIWNT-DYVFJYSZSA-N 390.455 5.002 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)CCCc1cc(Cl)sc1Cl 120468559 GJQUANDOKJNBPE-UHFFFAOYSA-N 387.263 5.058 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 134799792 LVSFMANXNDDPIF-UHFFFAOYSA-N 398.894 5.004 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(CSC3CCOCC3)c2)cc1 151022861 PBDUKKNAYFWHNU-QGZVFWFLSA-N 382.529 5.002 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 153785176 FBZRCQFUMUPUDV-CQSZACIVSA-N 375.428 5.088 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)c1nc2cc(Cl)ccc2s1 161404827 JRBRFGZBKUAWIU-SNVBAGLBSA-N 396.686 5.502 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1cccc2cccnc12 170986060 KRWAAYGWUPWHLN-HNNXBMFYSA-N 393.537 5.217 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2[nH]c3ccccc3c2C1 171741385 LVHWRZIYIFFHTG-OAHLLOKOSA-N 390.512 5.010 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC(C(F)(F)F)CC2)cc1 176070143 DVODAIDNHFWAFU-UHFFFAOYSA-N 390.430 5.124 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2ccccc2Cl)n1)Cc1cccs1 180088841 JLQVBRWMSATROR-LBPRGKRZSA-N 388.901 5.064 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1ccc(-c2ccncc2)cc1 181230800 NHPSGMJXMODUJT-HNNXBMFYSA-N 392.300 5.234 30 20 GKED CCCn1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc2ccccc21 191476644 LKURMIPEVUNMLX-OAHLLOKOSA-N 392.409 5.286 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3ccc(Cl)cc3C)n2)cc1 197541013 UNAQQZMYQWRLSK-QGZVFWFLSA-N 396.899 5.336 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\SCc3ccco3)n2)cc1 255296165 GESIHBGYBHUMBF-SECOEOQKSA-N 396.493 5.035 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3c[nH]c4ccc(OC)cc34)cs2)c1 303599165 JRKFQAIFHMWTRL-RMKNXTFCSA-N 390.464 5.205 30 20 GKED Cc1nc(N=C(O)[C@@H]2CCC(=O)[C@H](C)C2)sc1Cc1ccccc1Cl 328893216 ACWFMCWJCQHEDK-BXUZGUMPSA-N 376.909 5.289 30 20 GKED O/C(=N/Cc1cccc(C/N=C(/O)[C@H]2CCCCS2)c1)[C@@H]1CCCCS1 329258069 ABHLBIOIWSJURQ-HDICACEKSA-N 392.590 5.171 30 20 GKED Cc1nc2c(cnn2C(C)C)cc1/C(O)=N/[C@@H]1CC[C@H](c2ccc(F)cc2)C1 329897684 DBJBLURVASAUNC-QFBILLFUSA-N 380.467 5.101 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(COc2ccccc2OC)o1 410368071 STPXPFMOOXALFK-UHFFFAOYSA-N 377.440 5.238 30 20 GKED Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1Br 425664117 NZBFZXZDGJJASR-CQSZACIVSA-N 386.293 5.163 30 20 GKED CC(C)CCn1ncc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c1C(C)C 425674341 BFIVPOBHXCSKDF-KRWDZBQOSA-N 381.524 5.149 30 20 GKED CC[C@H](CNC(=O)N[C@@H](CCCC#N)c1ccccc1)Oc1ccccc1Cl 431982388 RZOUVNBQPHCBNT-QUCCMNQESA-N 399.922 5.232 30 20 GKED CCCCOc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1 432911152 QCPRALOJOPCHKY-JOCHJYFZSA-N 379.504 5.731 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2c(Cl)cc(F)cc2Cl)cc1 432990994 HUJIZXQEVCHVMA-INIZCTEOSA-N 379.262 5.425 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1cc(Cl)ccc1Cl 437448040 FTXOGZFAVHTHJI-UHFFFAOYSA-N 385.703 5.390 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC4(CCCCC4)C3)c2)cc1 438037455 UZNFOSQSDVDKCF-UHFFFAOYSA-N 375.472 5.539 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 438638737 SLTCYDUXJIMVOC-UHFFFAOYSA-N 398.478 5.376 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1 439676484 VYJBTVFQCYFXGK-INIZCTEOSA-N 387.464 5.331 30 20 GKED CCc1noc(C)c1-c1noc(-c2ccc(Oc3ccc(C#N)cc3C)cc2)n1 445808473 AIYPCAREUNUAMF-UHFFFAOYSA-N 386.411 5.235 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2noc(-c3ccccc3)n2)n1 446063376 QMTHFTNKQPYEEI-NSHDSACASA-N 390.390 5.184 30 20 GKED Cc1onc(CC(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)c1C#N 447631302 VPHPXKUINPIOMK-UHFFFAOYSA-N 386.238 5.010 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(c2ccc(Cl)cc2)C1 454759309 LIKPPSSSKWWPBO-CQSZACIVSA-N 385.920 5.366 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1noc(-c2ccccc2C)n1 455242084 GQHKPFQVEZAOAZ-UHFFFAOYSA-N 390.487 5.219 30 20 GKED CC1(C)CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC[C@H]1C(F)(F)F 458812231 CPKQPFGHKYHXKV-DLBZAZTESA-N 381.442 5.042 30 20 GKED C[C@@H](C(=O)N1CCC(c2ccc(C(F)(F)F)cc2)CC1)c1cccc(C#N)c1 462546348 ZVIQKJZTORCRKO-OAHLLOKOSA-N 386.417 5.087 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3C[C@@H](c4ccccc4)c4ccccc43)on2)c1 469320259 GGTMNOAFHNTNOT-NRFANRHFSA-N 391.430 5.006 30 20 GKED C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 469525849 UBWXFICTUHENFE-FPOVZHCZSA-N 385.511 5.038 30 20 GKED COc1ccccc1-c1nnc(S[C@@H](C)CCC#N)n1-c1ccc(Cl)cc1 470444339 FHPPYJUHLCZASK-AWEZNQCLSA-N 398.919 5.381 30 20 GKED N#CCCSc1ccccc1NCC(=O)N[C@@H](c1ccccc1)C1CCCC1 476398220 OELIPCKFMDEIRS-QHCPKHFHSA-N 393.556 5.152 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1C1CC1 477321154 KGFSPWCASTXJDX-INIZCTEOSA-N 399.498 5.599 30 20 GKED Cc1ccc([C@H]2C[C@@H](C)N(C(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)C2)cc1 486640344 NMUFYDKYCNTIRR-GCJKJVERSA-N 397.478 5.072 30 20 GKED CC(C)c1ccc(/C=C\CC(=O)N2CCC(Oc3cccc(C#N)c3)CC2)cc1 487420112 OBELRGVWDXZEMQ-PLNGDYQASA-N 388.511 5.155 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1ccccc1 488697198 VTNZYULNHHQATO-NQIIRXRSSA-N 375.472 5.103 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3cccc(Cl)c3)no2)sc2c1CCCC2 499330302 YJAFLRGMRSJECZ-UHFFFAOYSA-N 383.860 5.059 30 20 GKED N#Cc1ccc(CCC(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 502406479 OLUCMWPANFHQDA-QHCPKHFHSA-N 392.861 5.189 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 503066955 PUGBCYWQRJOLDW-UHFFFAOYSA-N 382.916 5.221 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCc2ccc(F)cc2)c1)c1ccc(C#N)cc1 505311666 RZKWWTGUYGLFGR-MRXNPFEDSA-N 389.430 5.159 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 510644679 KKOCOEQWZKZCHA-SFHVURJKSA-N 377.469 5.685 30 20 GKED C[C@H](N[C@@H](C)c1ccncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 510971578 YLJQNHYSTLGLMV-UWVGGRQHSA-N 380.307 5.670 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(C#N)cc2F)cn1 512637038 QUHMAWUSAPRGGE-MRXNPFEDSA-N 391.446 5.134 30 20 GKED Cc1c(C#N)cccc1C(=O)N[C@@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 513226422 PJMWDQGILXENGU-KRWDZBQOSA-N 398.466 5.002 30 20 GKED CSc1cccc(N(C)C(=O)c2cccc(COc3ccccc3C#N)c2)c1 513262524 NUWJBAUORAXURQ-UHFFFAOYSA-N 388.492 5.136 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2cc[nH]n2)cc1 516358972 OELZATLGGOSCNF-UHFFFAOYSA-N 396.475 5.352 30 20 GKED C=CCN(C(=O)c1cc(-c2ccco2)nc2onc(CCC)c12)c1ccccc1 516780087 JHAGYZCWNJEPBM-UHFFFAOYSA-N 387.439 5.268 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 518683217 MQXDKYUUWKXZLH-XLIONFOSSA-N 381.545 5.847 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 522074696 XFDSDVMDYPPIQC-UHFFFAOYSA-N 395.915 5.250 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)sc2c1CCC2 525628372 CSQXXDDRXQWAOO-ZIAGYGMSSA-N 377.296 5.157 30 20 GKED CC(C)(C)[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C(F)(F)F 525802105 LTOYOYXKARYSCD-LJQANCHMSA-N 390.405 5.252 30 20 GKED COc1ccc([C@H](NCCCC(C)(C)C#N)c2ccccc2Cl)c(OC)c1 531648068 MIUUGHIIBKTCJX-OAQYLSRUSA-N 386.923 5.366 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 537739907 UYLGWKWUPYAEQZ-OAHLLOKOSA-N 384.932 5.696 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ncc(-c3ccccc3)s2)cc1 538001907 IGROHPGKFLMNPH-UHFFFAOYSA-N 381.504 5.639 30 20 GKED CC[C@@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)c1ccc(Cl)s1 541626976 PAMAFRFZTUQKGY-MRXNPFEDSA-N 389.952 5.006 30 20 GKED COc1ccccc1[C@@H](NCc1cccc(C#N)c1F)c1ccccc1Cl 542222243 GCSPKMQXFFHEPO-QFIPXVFZSA-N 380.850 5.239 30 20 GKED CC(C)[C@H](Oc1ccccc1C#N)C(=O)Nc1cccc(C(F)F)c1Cl 543502628 BQRSKWFAZKCPBP-KRWDZBQOSA-N 378.806 5.191 30 20 GKED N#Cc1ccc(C(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)cc1Cl 548610314 BYPMAJUQKURVHE-UHFFFAOYSA-N 382.250 5.107 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1 549384099 BTLHPLYIHCLKIA-UHFFFAOYSA-N 397.441 5.178 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC([C@H](F)c3ccccc3F)CC2)cc1 552267953 QEMLJAFVZHAPCE-NRFANRHFSA-N 382.454 5.190 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)cc1 560472399 WOVUWKNNAQCFPH-BYICEURKSA-N 390.508 5.043 30 20 GKED COc1ccc(C[C@@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccc(OC)cc2)cc1 581303428 ZLQTWSRVNJIIMJ-CLJLJLNGSA-N 398.506 5.136 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCC2CCC(F)CC2)cc1 592898472 KVWOHVWBOJVDPY-UHFFFAOYSA-N 382.504 5.109 30 20 GKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 596606071 KFHWEPYOBXDSOE-FCHUYYIVSA-N 375.516 5.585 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)C1 597914480 GLSDRVUJGBSHDV-KCGBVJQISA-N 397.478 5.080 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCSc3ccccc3F)cn2)c1 603624178 UTSMDFMRBVWJCZ-UHFFFAOYSA-N 393.443 5.006 30 20 GKED Cc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1C 609378468 KHLRFLWQKAEBES-UHFFFAOYSA-N 378.419 5.580 30 20 GKED CC1(C)CN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C(C)(C)CO1 609724990 YEMHLBCHWLLIBU-UHFFFAOYSA-N 398.890 5.034 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(Nc2ccccc2)c1 609820842 MBAKHBUZHJNMTJ-QGZVFWFLSA-N 387.508 5.934 30 20 GKED COc1cccc(-c2nc(CSc3ccc(C#N)cc3F)cs2)c1OC 610164630 JDKXBNPYSJCEAX-UHFFFAOYSA-N 386.473 5.130 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)oc2ccc(Cl)cc12 613392562 URTVGSPMDIHKCE-INIZCTEOSA-N 392.867 6.008 30 20 GKED Cc1ccc(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(F)c1 642403582 GVQRWLBAIAFVLE-UWVGGRQHSA-N 386.311 5.165 30 20 GKED COc1cc(C)ccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 682013021 YWRQCGOYQIYJFM-ZDUSSCGKSA-N 390.386 5.122 30 20 GKED FC(F)(F)c1cnc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 682916162 DDGDYAVQOMOHJX-PHDIDXHHSA-N 386.283 5.483 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C\c3cccc(Cl)c3)SC2=S)cc1Cl 726627594 SBVJXSCOPGEWMB-VIZOYTHASA-N 391.304 5.271 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)/C=C\c3ccco3)cc2Cl)c1 727998695 DNNBOOQTUORHHP-CLFYSBASSA-N 378.815 5.036 30 20 GKED C#Cc1ccc(C(=O)N(c2nc3ccccc3s2)c2ccc(C)cc2C)nc1 728817534 NDTBSODYNVYYRH-UHFFFAOYSA-N 383.476 5.268 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)Nc1snc(Cl)c1C#N 730110058 YMJCYORVZITYKA-SECBINFHSA-N 395.340 5.927 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(Oc3ccc(C)cn3)cc2)cc1OC 733279948 OHRSRYOBBCOETP-UHFFFAOYSA-N 390.439 5.008 30 20 GKED CCCCN(C(=O)NCc1ccc(OCC#N)cc1)[C@H](CC)c1ccccc1 734169188 OXDWOZKCFUYDJA-JOCHJYFZSA-N 379.504 5.052 30 20 GKED C=CC[C@H](NC(=O)NCC1(c2ccc(Cl)cc2)CCCC1)c1ccncc1 734664443 RARCCGNSVGEFFT-FQEVSTJZSA-N 383.923 5.163 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 740037556 YPYCSUGQEREETM-KUHUBIRLSA-N 391.496 5.003 30 20 GKED O=C(/C=C/c1nccc2ccccc12)c1ccc(OC(F)F)cc1OC(F)F 740764358 SPCWNEWDRRLZMW-BQYQJAHWSA-N 391.320 5.334 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2c(Cl)nc3ccccn23)cc1 741468247 DPSUGDDMCIAVMM-YPKPFQOOSA-N 388.854 5.559 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 741564022 QQMFRHJDDQXYRK-QGZVFWFLSA-N 381.545 5.344 30 20 GKED Cn1c([C@H](C#N)C(=O)C[C@H](Cc2ccccc2)c2ccccc2)nc2ccccc21 744010260 FFTRZBPTDCRYOJ-FCHUYYIVSA-N 393.490 5.166 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cn1cc(C(F)(F)F)cc(Cl)c1=S 745162296 LPOKUKCYVUHAKT-UHFFFAOYSA-N 397.853 5.407 30 20 GKED CCOc1c(Cl)cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1OC 745990788 YFGQSACGTUGFMO-RUDMXATFSA-N 393.870 5.705 30 20 GKED CC(=NNc1ccc(Br)nc1)[C@@H](C)c1nc2ccccc2s1 748789018 XGVPIMNIOMWYDG-SNVBAGLBSA-N 375.295 5.045 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 752201431 IJDXBSQJSOOURH-LSDHHAIUSA-N 380.435 5.655 30 20 GKED CC(=O)Nc1ccc(C(C)=NO[C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)cc1 752765149 SCARWGKRQNHMEX-AWEZNQCLSA-N 397.862 5.455 30 20 GKED COc1cccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 753397327 ZGQZJECAGOKXPV-JXFKEZNVSA-N 390.508 5.497 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(C(C)(C)CC)cc1 753531008 CXCGCEZAEGKTJD-NRFANRHFSA-N 390.527 5.460 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1CNCc1cccc(-c2ccc(C#N)s2)c1 756028383 DKYBKEXNDKPCHS-UHFFFAOYSA-N 378.545 5.145 30 20 GKED Cc1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(-c2ccccc2)o1 758947691 YUBCJJNMCXTEFI-QFIPXVFZSA-N 393.446 5.558 30 20 GKED CSCc1ccccc1NC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 760129578 DOGKAYFTUVJZIK-UHFFFAOYSA-N 375.497 5.081 30 20 GKED O=C(C1=CCCC1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 761001226 HYPVUMSHVYHNDP-UHFFFAOYSA-N 376.506 5.717 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 765911245 RKEKIUALESOMHY-IUODEOHRSA-N 399.313 5.114 30 20 GKED C=C(C)C[C@H](C)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 767706849 UYWOSBRQPANXRW-VHSXEESVSA-N 378.683 5.119 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Br)ccc2F)c1 772986496 XPZFCOXYLVYEAU-CZUORRHYSA-N 391.284 5.120 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 780682365 UQDOOBMSFPIXHX-ZWKOTPCHSA-N 399.494 5.888 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1cnc(-c2ccccc2OC)nc1 792882703 HVYRRQHKJASKGB-CSKARUKUSA-N 394.858 5.100 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1cc(F)c(C(F)(F)F)cc1F 804442475 COBRHAJJRBWWCK-UHFFFAOYSA-N 397.265 5.731 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2csc(-c3ccccc3F)n2)c1 812724883 OVEGAOLKTZGCKI-DOTOQJQBSA-N 395.503 5.481 30 20 GKED N#C[C@@H](C(=O)c1sccc1-c1ccc(F)cc1)c1cc(C(F)(F)F)ccn1 813211776 PYCMQACVZGTRLS-OAHLLOKOSA-N 390.361 5.458 30 20 GKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)cc(C)c1OCc1ccccn1 814304495 MNPKUPPWYAIAGP-VWLOTQADSA-N 399.538 5.802 30 20 GKED N#CC[C@H](CC(=O)O[C@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 816066205 WDXWRUPZBYPEGQ-RDTXWAMCSA-N 388.345 5.062 30 20 GKED CC(C)N(CC(=O)[C@H](C#N)c1nc2ccccc2s1)[C@@H](C)c1ccsc1 817287150 KUEGFEWGAYWEJO-HOCLYGCPSA-N 383.542 5.006 30 20 GKED CCC[C@@H](OC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 835070997 XTLGDRABWYJTIQ-IUODEOHRSA-N 383.300 5.108 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2Nc1snc(Cl)c1C#N 853850375 IVQBGDFRCKOYSX-AWEZNQCLSA-N 390.896 5.115 30 20 GKED COCC1(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCCCC1 857010524 QBKDMUAFOIAJSI-ZDUSSCGKSA-N 396.434 5.088 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)no1 915354256 YKADFRQLFCNQFB-IRLDBZIGSA-N 386.455 5.008 30 20 GKED CC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1OC 915678557 RYTSKKJAOYLLPA-XMMPIXPASA-N 386.495 5.387 30 20 GKED Oc1ccc(C=Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c(O)c1O 915982989 LZFDVOIHTIGXON-UHFFFAOYSA-N 391.210 5.048 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2csc3ccccc23)cc1 916050842 JQZHFKHGKHTXKI-JOCHJYFZSA-N 382.488 5.738 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3cc(F)ccc3F)c2)cc1 916134177 GEFMZFDEFKEFDL-XGICHPGQSA-N 393.389 5.122 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccnc1)c1cc(F)ccc1F 916135052 ZZKKIWWQFYXASH-FLIBITNWSA-N 387.389 5.109 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916707932 BZAPENXBYVACND-DQEYMECFSA-N 395.506 6.020 30 20 GKED Cc1cccc(CCC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 916909619 PZHDFJNAUKPUPH-OAQYLSRUSA-N 398.462 5.068 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\CC1(c2ccc(F)cc2)CCOCC1 920175241 UGLXRZNXWDEHSC-KSEXSDGBSA-N 382.262 5.005 30 20 GKED Cc1ccc(C(Cc2ccccc2)=NNc2ccc(C(=O)O)c(F)c2)cc1C 1776074152 LBFZNUCXCNLEBZ-UHFFFAOYSA-N 376.431 5.200 30 20 GKED CC(C)(C)Oc1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776265001 PFOAHYYXNOZNPS-GHXNOFRVSA-N 390.435 5.718 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2csc(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269275 ZEZAGMNBHOSFGR-SREVYHEPSA-N 382.525 5.864 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)s1)=C(/S)Nc1ccc(C)cc1 22730954 KVIIQLYIEYHRKY-UHFFFAOYSA-O 395.573 5.266 30 20 GKED C=CCn1c(SCc2csc(-c3ccco3)n2)nnc1-c1ccccc1 25352363 AYTDZQZZAJDJTB-UHFFFAOYSA-N 380.498 5.140 30 20 GKED N#CC1(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)CCCC1 26496707 KSAXVSUKYOWYJL-UHFFFAOYSA-N 380.300 5.063 30 20 GKED Cc1ccc[n+](/C(C(=O)c2cc3ccccc3o2)=C(/S)Nc2ccccc2)c1 27183733 AMSWASLOBCTKDF-UHFFFAOYSA-O 387.484 5.080 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(F)cc3Cl)c2)c1 31777070 QYGGTVSXWMZZGA-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3nc4ccccc4s3)cc2)cc1 66037490 PQTIVWFFAUFQEY-UHFFFAOYSA-N 399.475 5.532 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1)C(C)C 108237301 DGTDOXNNRRARNC-SFHVURJKSA-N 395.572 5.421 30 20 GKED CCc1cccc2c(CC(=O)Nc3ccccc3SC[C@H](C)C#N)c[nH]c12 109211987 HFNOBRXNQCLEOT-OAHLLOKOSA-N 377.513 5.163 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(F)c(Cl)cc2Cl)cc1 111020735 CTBXAMQZQNWAIS-UHFFFAOYSA-N 381.234 5.092 30 20 GKED C=C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 120031085 CEUSBZJEYOKMOY-YLJYHZDGSA-N 383.476 5.218 30 20 GKED N#CC1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccccc2Cl)CC1 155660742 WQXRMHZCGAXYCF-LJQANCHMSA-N 388.298 5.028 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(F)c(F)c2F)cc1 175858310 XVLOSLKAJZASNX-UHFFFAOYSA-N 396.368 5.001 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2ccc(Cl)s2)n1)Cc1cccs1 180100044 KJFFOMNWNQLHMA-JTQLQIEISA-N 394.930 5.126 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Cl)c(OC(F)F)c1)c1ccccc1 180135304 DLKDIFJZDSAOKC-OAHLLOKOSA-N 379.794 5.108 30 20 GKED C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)c1cccc(C#N)c1 189755601 WOWGXRSGZGKVFI-NSHDSACASA-N 386.274 5.224 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CN2CCCC[C@@H]2C)C1 191504108 JDWOAFFBXQDJQK-SFTDATJTSA-N 397.607 5.657 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)c(C)n1-c1cccc(Cl)c1 195652733 YOVSZHZVOOXWNV-GOSISDBHSA-N 388.858 5.114 30 20 GKED O=C1CCc2cc(C(=O)/C=C\c3ccc(-c4ccccc4Cl)o3)ccc2N1 215072419 HZVNPCQGIUSCNM-YFHOEESVSA-N 377.827 5.381 30 20 GKED C[C@@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)c1ccc(C#N)cc1 303673245 GZFARFMXEQJZAU-MRXNPFEDSA-N 386.480 5.311 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)Nc1cccc(C(F)F)c1Cl 416997727 RMRVEYVQTSVWBW-OAHLLOKOSA-N 375.806 5.348 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cn(CCCC#N)c3ccccc23)s1 430603270 JPUAFIUAXHUIPO-INIZCTEOSA-N 390.512 5.189 30 20 GKED CC(C)(C)OCc1cccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)c1 431902316 OGECOYASNAVPCU-JOCHJYFZSA-N 393.531 5.236 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)F 433145340 PVJAGVFWUJAPTE-DYVFJYSZSA-N 375.444 5.209 30 20 GKED CC(C)n1c([C@@H]2CCCN2c2nc(C(F)(F)F)ccc2C#N)nc2ccccc21 433758625 NFJPFQQOWDZOFR-KRWDZBQOSA-N 399.420 5.244 30 20 GKED CCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@H](C)c1cc2ccccc2o1 435127503 WZWFPHXDVQWIHJ-GOSISDBHSA-N 399.498 5.188 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C2CC2)[C@@H](C)C2CC2)cc1 438192036 YUHYDYUSSJYYJL-HNNXBMFYSA-N 391.471 5.154 30 20 GKED Cc1ccc(-c2ocnc2C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 442670662 JTIWMXQILGVMKM-AWEZNQCLSA-N 393.855 5.403 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2cscn2)c1)c1nc2cc(Cl)ccc2s1 442672243 PVJDALGGSOMIHM-CQSZACIVSA-N 395.896 5.563 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NCC1CCC(C#N)CC1 442876336 QXPVNMXQLMQDJG-PNDQRGPWSA-N 379.367 5.152 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)O1 443876934 HQQZKOGFLKBMPL-IIBYNOLFSA-N 382.891 5.093 30 20 GKED COc1c(F)ccc(F)c1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 446031968 SRGJFVDCBWKEDX-UHFFFAOYSA-N 398.340 5.029 30 20 GKED CC(C)(C#N)CC(=O)Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1 447423072 OMHZXDOCAUIEHX-UHFFFAOYSA-N 390.487 5.088 30 20 GKED Cc1sc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)nc1C(C)C 447487352 IRAPJLKWTMKJSU-UHFFFAOYSA-N 391.496 5.420 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1cccs1)C1(CO)CCC1 459516770 CQCHGFOLZKWWDD-OAQYLSRUSA-N 398.572 5.625 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(-c2noc(C3CC3)n2)c1 463460321 GELQDOROHGPSQQ-UHFFFAOYSA-N 399.903 5.157 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccccc1)c1c(F)cc(C(F)(F)F)cc1F 463467780 DGJHTDWWHGPSCY-ZDUSSCGKSA-N 397.265 5.407 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCN(c2ccccc2F)C1 463727971 KQGFHOTWSORLHM-SFHVURJKSA-N 395.522 5.326 30 20 GKED C=C(C)C[C@@H](C)C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 467826275 USNURLCGQBSNBU-CQSZACIVSA-N 392.549 6.209 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(OC(F)F)c1 469276399 UYZCEEVGKHJRBM-OAHLLOKOSA-N 399.441 5.044 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)cc1 476133784 FNZNYLQSSOKVPO-UHFFFAOYSA-N 391.858 5.581 30 20 GKED Cc1nc2ccccc2n1C1CCN(c2ccc(C(F)(F)F)c(C#N)c2)CC1 480832950 ZSAVKTZFXZZDPH-UHFFFAOYSA-N 384.405 5.077 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 482463222 KSNDOAWIMWJQRZ-FQEVSTJZSA-N 388.433 5.279 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)nn1-c1ccccc1 483215778 RXXOGROKLIRJDY-FQEVSTJZSA-N 380.451 5.034 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1 485708439 QHMVBXVAYYZSAX-UHFFFAOYSA-N 380.419 5.234 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@H](CC1CCCC1)c1ccccc1 499946304 AXOGTZQGUKVCHO-HSZRJFAPSA-N 396.531 5.181 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCSc1ccccc1 500745708 SGJPEIXLROSXAL-UHFFFAOYSA-N 388.492 5.780 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1ccccc1C(F)(F)F 502179854 DIKBFJBOSOIZMR-OAHLLOKOSA-N 399.416 5.137 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 503153572 SFNZMKFFEVYKBQ-RPWUZVMVSA-N 392.458 5.641 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)CC1 506276669 DFEPKSIXFIJNQF-UHFFFAOYSA-N 399.441 5.036 30 20 GKED Cc1ccc(S[C@H](C(=O)N2CCC(C)(C#N)CC2)c2ccccc2)c(C)c1 507827848 GTTNJSYPWCLFCL-NRFANRHFSA-N 378.541 5.289 30 20 GKED N#Cc1ccc(NC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1Cl 515381915 IJDBCSMBZLDVGG-UHFFFAOYSA-N 393.796 5.427 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ncc(-c4ccccc4F)o3)cc2)ccn1 516610223 PLGUCRKNFGRGNE-UHFFFAOYSA-N 386.386 5.152 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2oc3ccc(OC)cc3c2C)ccc1OC 521337396 WTLQBXPJVOQVLU-QGZVFWFLSA-N 395.499 5.564 30 20 GKED COc1ccc([C@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 521955437 GQUGHPJJVULJRF-KRWDZBQOSA-N 386.451 5.045 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 521992379 CESURQIPCYVIHI-BLLLJJGKSA-N 379.312 5.103 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 522067088 JNSIRMCTIGICSI-HNNXBMFYSA-N 392.421 5.173 30 20 GKED COc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1Cl 526051256 CIZKZRQQPPZMNZ-OAHLLOKOSA-N 397.906 5.105 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 534091195 VTOCUXOCGTXIMH-CYBMUJFWSA-N 386.293 5.327 30 20 GKED CCc1ncsc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534890889 UBIQVAQIKVHBRA-UHFFFAOYSA-N 383.860 5.275 30 20 GKED C=C[C@H](CC(=O)N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccccc1 535366611 ZAUNEEVPVGMPSI-KBMIEXCESA-N 395.506 5.139 30 20 GKED Cc1ccc(-c2noc(CN[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)n2)cc1 542016867 LALSYKLWAOXHCN-SFHVURJKSA-N 394.478 5.435 30 20 GKED C=C(C)Cn1c(SCc2nc([C@@H]3CCC[C@H](C)C3)no2)nnc1-c1ccco1 545640162 JSPRWDYWXKDAPW-LSDHHAIUSA-N 399.520 5.083 30 20 GKED Cc1ccc(Cc2ccccn2)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 549054001 WYAPIVVBJFTLRP-QFIPXVFZSA-N 384.483 5.147 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)c1ccccc1 549268129 QOTJAUMDYRQDRB-HXUWFJFHSA-N 375.472 5.082 30 20 GKED CC(C)(C)c1csc(NC(=O)c2ccccc2Sc2ccccc2C#N)n1 559474495 SUOKDCUFVJGSCM-UHFFFAOYSA-N 393.537 5.716 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1sc2ccc(C#N)cc2c1C 560604382 MTBTVQADIGRYRY-UHFFFAOYSA-N 392.528 5.077 30 20 GKED CC(C)c1scnc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 564760146 LJFJIOSXDNIQKF-UHFFFAOYSA-N 391.496 5.164 30 20 GKED C=CCn1c([C@H]2CCO[C@@H]2C(C)(C)C)nnc1N1CCC[C@@H]1c1ccc(C)cc1 576742860 HLNBJUQYMQIEEL-HBMCJLEFSA-N 394.563 5.033 30 20 GKED N#Cc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)c(C(F)(F)F)c1 580009673 MOCYEWPNJLOERV-UHFFFAOYSA-N 391.396 5.406 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 580319627 RLORSLLRLBDYGN-HSZRJFAPSA-N 398.466 5.423 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)cc1 581265616 ZTRNVRBSYXYCMM-LJQANCHMSA-N 387.405 5.531 30 20 GKED N#CCCCCC(=O)NCc1ccc(Oc2ccc(C(F)(F)F)cc2)cc1 593972288 OFZIGHRCZPOQPL-UHFFFAOYSA-N 376.378 5.198 30 20 GKED C[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cccc(C#N)c1 600851332 NLWHDSBMFYOLNT-LLVKDONJSA-N 390.302 6.021 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)Nc3ccc(CC#N)cc3)cs2)cc1 604483427 ZDEDFYQJXZMRQN-UHFFFAOYSA-N 375.497 5.181 30 20 GKED CCCCS[C@H](C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 609104257 CJMNQEYPSUZZAM-OAHLLOKOSA-N 386.492 5.137 30 20 GKED N#CCn1c(C(=O)N(Cc2ccccc2)Cc2ccccc2F)cc2ccccc21 609169740 GVZZPNGBVJLKCF-UHFFFAOYSA-N 397.453 5.147 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1c(F)cccc1F 609500223 WQKRURZXSSIPQP-HNNXBMFYSA-N 392.405 5.314 30 20 GKED CC[C@](C)(NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1nccs1 610049354 SUAMQVOSNORXQT-NRFANRHFSA-N 395.459 5.001 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3cccc(C#N)c3)s2)cc1 610050810 KQYGKDFNKMOGQK-INIZCTEOSA-N 375.497 5.132 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc([N+](=O)[O-])ccc1SC1CCCC1 611205696 XVCVAYUBLBMMHY-UHFFFAOYSA-N 381.457 5.062 30 20 GKED CCCCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@H](C)c1ccc(C)o1 619067906 BKBXWCWNBKGISE-LJQANCHMSA-N 391.519 5.124 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1Cl 619124083 HXGCDZHMMIUULE-UHFFFAOYSA-N 379.703 5.263 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2COc2ccccc2)cc1Cl 619787271 JNJJOZYNRRGSQN-UHFFFAOYSA-N 391.858 5.112 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)cc1OC 642631070 AZBSOWDTWJZKLB-JOCHJYFZSA-N 399.943 5.854 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2ncc(C3CC3)o2)cc1)C(F)(F)F 647633941 IGKHDOJMPCJDNU-UHFFFAOYSA-N 382.279 5.454 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](CC(F)(F)F)O[C@H](C)C1 666866699 YQUAZTZMTWEYEG-ZBFHGGJFSA-N 384.442 5.112 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2coc(-c3cccs3)n2)cc1 729946460 CMSLUADNJJPSOX-HXUWFJFHSA-N 399.475 5.240 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)cc1C 730950587 HEKJWFMFNVVEGG-POHAHGRESA-N 376.408 5.070 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)c2ccccc2SCC#N)c1 732660386 PWCAUUQSLMGZMP-UHFFFAOYSA-N 388.492 5.442 30 20 GKED Cc1ccc2c(c1)CCCN2C(=O)c1cccc(COc2ccccc2C#N)c1 734101310 HAPGAZVZYJHGQA-UHFFFAOYSA-N 382.463 5.039 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)NCc3coc4ccccc34)c2)s1 740062510 WIDMIRDBORAJCO-UHFFFAOYSA-N 387.464 5.032 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(SC)c(OC)c2)cc1Br 746342438 ULZZIBSYCMAXMD-DAXSKMNVSA-N 393.302 5.084 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 747315127 TWIMPUOGWICGLE-MDZDMXLPSA-N 378.353 5.294 30 20 GKED N#CCCN(Cc1ccco1)C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 749370188 FORCEJMKMASMBF-LUAWRHEFSA-N 380.444 5.103 30 20 GKED CCCC(=NNc1nc(-c2ccncc2)no1)c1ccc(Cl)c(Cl)c1 750945883 REGJYDJJBHWGCU-UHFFFAOYSA-N 376.247 5.055 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(N3CCCCCC3)c2)c(Cl)c1 754429399 VSLMPKVEYLMRPX-UHFFFAOYSA-N 388.298 5.498 30 20 GKED O=C(/C=C/c1cc(Cl)cc(C(F)(F)F)c1)c1cccc(N2CCOC2=O)c1 780187397 QXUNKQASHKIFAH-SNAWJCMRSA-N 395.764 5.212 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1 780634958 DXZUKRQHKDODOH-MRXNPFEDSA-N 399.450 5.223 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)Nc1ccccc1O[C@@H](C)C#N 780678946 ZIDUSOIJNQDLMU-STQMWFEESA-N 392.286 5.037 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C\c1csc(-c2cccs2)n1 787183090 HPHMMAXYYSJAON-ALCCZGGFSA-N 389.885 5.208 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)c1ccc(-c2ccccc2)s1 788031838 JPZYRVZBZVYMGV-UHFFFAOYSA-N 377.498 5.165 30 20 GKED CCc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1C1CCCC1 789620386 GOOUYRGUJZZOEY-QFIPXVFZSA-N 398.510 5.468 30 20 GKED C[C@@H](NCc1ccc(Cl)nc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 801539888 PZCHGEPGMIBSSJ-CQSZACIVSA-N 382.294 5.778 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1SC(F)F)c1ccccc1 814506563 KEUCJNGJWPSDHU-OAHLLOKOSA-N 375.444 5.558 30 20 GKED CC(=NNc1ncnc2sccc12)c1sc(-c2ccc(F)cc2)nc1C 814767082 BNDQYEJGYCELQQ-UHFFFAOYSA-N 383.477 5.098 30 20 GKED O=c1c2ccccc2ncn1N=Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1 818263240 DIKFLVTWVNOOMX-UHFFFAOYSA-N 399.397 5.026 30 20 GKED Cc1ccc(C2(CNC(=O)c3ccccc3SCC#N)CCCC2)c(C)c1 819159468 CRSIXYIUUWEGEQ-UHFFFAOYSA-N 378.541 5.161 30 20 GKED C[C@@]1(Cc2noc(-c3cn(CCCC#N)c4ccccc34)n2)CC1(Cl)Cl 834865559 KGYPRISXVKZAHZ-GOSISDBHSA-N 389.286 5.121 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1 837847781 WLIJQYMAEGLPEZ-KRWDZBQOSA-N 386.536 5.342 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)C(=O)c2sccc2Br)cc1 845846573 HWNGXQJJHSGYTG-RISCZKNCSA-N 390.302 5.229 30 20 GKED N#Cc1ccc(Br)c(CNc2ccccc2N2CCCCCC2)c1 864002193 QIBTVQGQFUIMEZ-UHFFFAOYSA-N 384.321 5.313 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917025459 KZZCXIBVCGDKSA-IBGZPJMESA-N 390.508 5.497 30 20 GKED C=CCc1cc(OCC)cc(CN2CCC[C@@H](c3nc4ccccc4o3)C2)c1O 919940673 IJMLSXXZQHOZPA-GOSISDBHSA-N 392.499 5.040 30 20 GKED CCc1cccc(C)c1NN=Cc1cccc(OCc2cccc(C(=O)O)c2)c1 1776056670 HNWYTJMJXGVBON-UHFFFAOYSA-N 388.467 5.281 30 20 GKED CCCCCOc1cc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)ccc1OC 1776793114 KTJNNCROAUWJHP-VBKFSLOCSA-N 398.455 5.076 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)c(C)cc2C)=C(/S)Nc2ccccc2)cc1 27184217 FHCBMMPGVCNMRV-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CCOc1c(Br)cc(/C=C\C(=O)c2ccc(F)cc2F)cc1OC 33476470 KHYLYIOOGBWNLE-DAXSKMNVSA-N 397.215 5.031 30 20 GKED CCC(CC)c1nnc(/N=C(\O)[C@H](C)Sc2ccc(NC(C)=O)cc2)s1 51118580 JJOMBNZPZMWYHN-NSHDSACASA-N 392.550 5.169 30 20 GKED C[C@H](CC#N)N(C)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 110976269 ONQBIGIUUZPLJB-CYBMUJFWSA-N 393.339 5.660 30 20 GKED Cc1nc(-c2cccc(NC(=O)Nc3cccc(OCCCC#N)c3)c2)oc1C 113553022 STKKVILJLQCBKM-UHFFFAOYSA-N 390.443 5.285 30 20 GKED N#C[C@@H](C(=O)c1csc(Br)c1)c1nc2cc(Cl)ccc2s1 120050804 MHMHAIQLPAKCSP-VIFPVBQESA-N 397.706 5.264 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc(-c3cccs3)nc3ccccc23)n1 122342869 SUXPWNTYULHTCN-HNNXBMFYSA-N 375.478 5.218 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1cccc(OC(C)(C)C)n1 131862829 XJQTVUYILADBSV-MRXNPFEDSA-N 397.544 5.082 30 20 GKED CC1CCN(c2cccc(NCc3cn(CCC#N)nc3-c3ccccc3)c2)CC1 151507294 MNORXYDXRSHFEB-UHFFFAOYSA-N 399.542 5.312 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCSc2ccccc21 171839134 PUNLHNDQGBDOSU-HOCLYGCPSA-N 383.542 5.439 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2nc(C3CC3)sc2c1 183875208 BHUUZMJFVQDWFA-GFCCVEGCSA-N 378.457 5.109 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)c(C)c(C)c1C)=C(/S)N[C@H](C)CC 194972003 GCJUDQDRLYBCLO-MRXNPFEDSA-O 397.608 5.097 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(Cl)s1)c1nc2ccccc2n1C(F)F 255391601 DXMPZGQQPVASPY-XOIDGJRKSA-N 377.803 5.036 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 303719647 VXEBSWXZFDAACM-FXAWDEMLSA-N 381.501 5.146 30 20 GKED C[C@]1(/N=C(/O)C2CCC(/N=C(/O)C3CCCC3)CC2)CCCc2ccccc21 328644705 GDICXDZHYQEIST-IMQCZEGASA-N 382.548 5.900 30 20 GKED C=CCCc1ccccc1NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 410356104 UKBBCQWIERXVEK-XBLGPDGASA-N 377.450 5.893 30 20 GKED Cc1cc(CN[C@@H](CCCC#N)c2ccccc2)nc(-c2ccc(Cl)cc2)n1 433022258 JMOPTMUMSDOBPQ-QFIPXVFZSA-N 390.918 5.630 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1nc2ccccc2s1 435481021 IXUKMOWYVBAYRI-MRXNPFEDSA-N 387.439 5.351 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1)c1ccccc1 435615828 KPCJIKHYUNESHX-HXUWFJFHSA-N 393.531 5.809 30 20 GKED N#CC1CCC(CNCc2cn(-c3ccccc3)nc2-c2cccs2)CC1 441380169 PZYDOJUPVNHYTL-UHFFFAOYSA-N 376.529 5.020 30 20 GKED CC(C)[C@H](c1ccccc1Cl)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 441391869 AABPCLNBNSHGGZ-HXUWFJFHSA-N 380.879 5.091 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)C(C)C)cc1 457536556 ZMWVJLKWJOYTFD-YADHBBJMSA-N 379.504 5.127 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1Oc1ccncc1 464476734 QPLPRDYKUTZLEJ-KRWDZBQOSA-N 397.356 5.086 30 20 GKED CC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)C(C)(C)c1ccccc1 465973582 QYCYUNJZTJPYMM-QFIPXVFZSA-N 377.532 5.235 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1OC(F)F 468884891 GAMBDINNZVRRRE-HNNXBMFYSA-N 399.441 5.044 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2cc(-c3nc(C)co3)ccc2C)c1 470580701 BWGGRHHVOLZFNY-UHFFFAOYSA-N 377.444 5.557 30 20 GKED CC(C)(C#N)CCCN1CCCC[C@H]1C(=O)Nc1ccc(Cl)cc1Cl 472236466 DXKDVWGYJLLKJH-KRWDZBQOSA-N 382.335 5.116 30 20 GKED CC(C)c1nccn1Cc1cccc(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 474897309 CLNJONQULRUWKM-OAQYLSRUSA-N 386.499 5.081 30 20 GKED COc1ccc([C@H](NCc2ccc(Cl)cc2C#N)c2ccccc2OC)cc1 478362162 OVKRFKKKXLPADG-QHCPKHFHSA-N 392.886 5.108 30 20 GKED C=CCOCCCS[C@H](C)c1nc(O)c2c(-c3ccco3)csc2n1 479599017 FIFDVGYMOQMGSP-GFCCVEGCSA-N 376.503 5.044 30 20 GKED Cc1nc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c(C)s1 480681335 ZFANIRQAKVQHCC-UHFFFAOYSA-N 397.887 5.259 30 20 GKED CC(C)(CC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)C(F)(F)F 481155470 KULFOPYIOORODH-NSHDSACASA-N 379.703 5.177 30 20 GKED N#CC[C@H](CC(=O)Nc1c(-c2cccs2)nc2ccccn12)c1ccccc1 483463842 TVKYRKKBRHYHIX-QGZVFWFLSA-N 386.480 5.089 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@]1(c1ccccc1)C(F)(F)F)c1ccccc1 484143201 MBQVZACUNCRIND-RXVVDRJESA-N 386.417 5.154 30 20 GKED Clc1ccc(C#CCSc2nnc(C3CC3)n2Cc2ccccc2)cc1 485251257 GKXXZZWFCJFEBF-UHFFFAOYSA-N 379.916 5.001 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC2(CC1)OCCc1ccsc12)c1ccccc1 487859623 SPMGJRSFEAHWQM-HXUWFJFHSA-N 396.556 5.029 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1nc2ccccc2s1 494875841 VEJWBZZVEAIPNS-LBPRGKRZSA-N 380.778 5.459 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C(F)F)ccc1Cl 497199977 QPUYYFCQZHCESK-UHFFFAOYSA-N 391.270 6.213 30 20 GKED CCN(Cc1csc(COc2ccc(F)cc2)n1)[C@H](C)c1ccc(C#N)cc1 497620631 PBPSZRWJZQMSDU-MRXNPFEDSA-N 395.503 5.316 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C[C@H]1CCOC1)c1ccccc1)c1ccccc1 510268292 FSPVVZDPALZDGA-WTIAFYNJSA-N 378.516 5.161 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3ccc(C#N)cc3F)s2)cc1 512648452 NEKRZJKFWWNQAY-KGLIPLIRSA-N 395.503 5.550 30 20 GKED COc1cccc([C@H]2C[C@@H]2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 517338788 IGEUADDKEKVDPP-PKTZIBPZSA-N 384.435 5.101 30 20 GKED Cc1cnn(-c2ccc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)cc2)c1 518231721 FADMPLOABJIDBE-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Cl)c2cccnc12 520100665 GWZGWSGMRWGZOG-UHFFFAOYSA-N 377.875 5.058 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCCCC(=O)c3ccccc3)c2)cc1 520567092 KMZXMAAWUNYQQU-UHFFFAOYSA-N 398.462 5.732 30 20 GKED Cc1ccn(-c2ccc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)cc2)n1 521316049 ASEITXPOZSBADG-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CCN(C(=O)c1ccc(-c2ccsc2)nc1C)[C@H](C)c1ccc(C#N)cc1 523582379 DQEZSFYUOWGYIW-MRXNPFEDSA-N 375.497 5.214 30 20 GKED CC[C@@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 525348698 LYOBRIKCOIPKBY-LJQANCHMSA-N 377.488 5.846 30 20 GKED C=CCN(C(=O)c1sc2ccc(OC)cc2c1C)c1nc2c(s1)CCCC2 525632679 BAYCUIOREZYZIM-UHFFFAOYSA-N 398.553 5.386 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](n2ncc3ccccc32)C1 530553132 WYEYHMSMLKFSLO-HXUWFJFHSA-N 388.515 5.367 30 20 GKED C=CC[C@H](C)[C@@H](C)N[C@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 532238998 KXTWQFDIRQLDPO-GCKMJXCFSA-N 391.964 5.023 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1F 534170881 DLKZSXZGFRMNHF-UHFFFAOYSA-N 391.849 5.488 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H](c2ccccc2)[C@H]2CCOC2)c1 537865410 ZUSMKDILVLJDID-AHWVRZQESA-N 398.506 5.005 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 540314613 RIXDWXBQSWIGKU-RLWLMLJZSA-N 382.507 5.483 30 20 GKED CC[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nccs1 542964247 KVCFUKYJOCZWFE-QRWLVFNGSA-N 390.512 5.193 30 20 GKED CCC[C@H](NC(=O)N1CCC(CCC#N)CC1)c1cccc(C(F)(F)F)c1 566617474 PFGDKFCHDICRNB-SFHVURJKSA-N 381.442 5.272 30 20 GKED N#CCC[C@H](NCc1cc(C(F)(F)F)ccc1Br)c1ccccc1 572651825 UOPKPVCKACTIDT-KRWDZBQOSA-N 397.238 5.603 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(C)[C@@H]1CCCc2ccccc21 574386655 DEHCIHRIPMWESJ-LAUBAEHRSA-N 393.556 5.029 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1ccc(C(F)(F)F)cc1 588205438 SZMNBQAEMXNREE-NSHDSACASA-N 383.211 5.190 30 20 GKED C[C@H]1CN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CCC1(F)F 589539230 UOSQZCLLFDUQDH-ZDUSSCGKSA-N 390.817 5.121 30 20 GKED Cc1c(C(=O)N[C@H](C)c2cccc(N3CCCC3)c2)sc2ccc(C#N)cc12 589985246 MKFAVIXHCZGKJU-MRXNPFEDSA-N 389.524 5.173 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1)c1ccccc1 596605551 FQYOWKYTDSDNNW-CTNGQTDRSA-N 377.488 5.341 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1[C@@H]2c3cccc(Cl)c3C[C@H]21 599736840 IPAWKXLEOAIFGS-DDAIWRKXSA-N 397.931 5.052 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(C)Cc3ccc(C#N)cc3)cs2)cc1 603523834 ACGZCBZQZFVGAI-UHFFFAOYSA-N 389.524 5.006 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCOc2cccc(Cl)c2Cl)cc1 603754903 IDJLUUSFYSNIFO-UHFFFAOYSA-N 377.271 5.202 30 20 GKED Cc1ccc(OCc2nc(CSCCOc3ccc(C#N)cc3)cs2)cc1 604049853 NXHDUQKYTUYOQN-UHFFFAOYSA-N 396.537 5.214 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cccc(Cl)c1 609012114 NCHZTUCMFQBWFQ-UHFFFAOYSA-N 376.843 5.494 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 610226898 OZBNRNDYIHNOAR-QTJFZDIUSA-N 387.310 5.578 30 20 GKED C[C@H](NC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1cccc(C#N)c1 610359507 KTRHKPAMIWIAEG-INIZCTEOSA-N 390.870 5.135 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)N[C@H](C)c2cccc(C#N)c2)cc1 610406676 IMDPELQKAZQFLM-LJQANCHMSA-N 399.494 5.040 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N[C@@H](C)c1cccc(C#N)c1 616357502 RDMUKRPJJIZNIF-LBPRGKRZSA-N 399.372 5.032 30 20 GKED C=CCn1c(S[C@H](C(=O)c2ccccc2)C(C)C)nnc1-c1ccoc1C 643092527 WYFIDVZPAXLLRT-IBGZPJMESA-N 381.501 5.032 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc2nc(O)oc2c1)c1ccc(C(F)(F)F)cc1 671753889 GYZWMOWLMKZHIB-CXAGYDPISA-N 390.405 5.910 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1Br 726473979 BVFQAWHPUPHLOO-UHFFFAOYSA-N 380.698 5.092 30 20 GKED CC(=NNc1nc(-c2ccccc2)no1)c1sc(-c2ccc(C)cc2)nc1C 727651177 LRAFTEPRFIFGGJ-UHFFFAOYSA-N 389.484 5.313 30 20 GKED C=CCOc1ccccc1C(=O)Oc1ccc(NC(=O)c2sccc2C)cc1 729215597 KSUUJXQMCFQPLD-UHFFFAOYSA-N 393.464 5.093 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 731030523 IYPHZVLWMOMJLD-OAHLLOKOSA-N 387.936 5.199 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)Nc3cccc(OCC#N)c3)sc2c1 732635221 KCJHSQRSQXNYEY-UHFFFAOYSA-N 384.888 5.833 30 20 GKED FC(F)(F)c1cc(NN=C(CC2CC2)c2ccccc2)nc(-c2cccnc2)n1 735973796 UEUDVNKYMLMNKB-UHFFFAOYSA-N 397.404 5.174 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cc(C#N)ccc2F)cc1 742380375 CWAMGSXGPFFXGY-UHFFFAOYSA-N 396.469 5.148 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 742537689 NPCGONWHEKXTBW-FDDCHVKYSA-N 386.470 5.689 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1[N+](=O)[O-] 743473579 DFDTUICJEHNVJM-OAHLLOKOSA-N 391.402 5.358 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 744117648 ALTGIVZUINLEGG-QGZVFWFLSA-N 381.476 5.162 30 20 GKED N#CCCN(Cc1ccco1)C(=O)/C=C\c1ccc(-c2ccccc2Cl)s1 749380385 VROQKTLISRZUAT-LUAWRHEFSA-N 396.899 5.617 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1ccccc1[N+](=O)[O-] 754699335 AMDRMBBLRTWCOU-UHFFFAOYSA-N 397.866 5.062 30 20 GKED C#CC[C@@H](NC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 757887070 RMZIEVVAIYBNIN-GOSISDBHSA-N 397.450 5.059 30 20 GKED O=C(/C=C\c1ccc(Cl)nc1Cl)c1cc(Br)ccc1F 761479724 MSQBIPFMXLZRET-KTAJNNJTSA-N 375.024 5.186 30 20 GKED C[C@@H]1CN(c2ccc(NC3CCC(C#N)(c4ccccc4)CC3)cc2)C[C@@H](C)O1 770420846 NCXCXVIWWGNQAL-ZYCLUUQBSA-N 389.543 5.116 30 20 GKED C#C[C@@H](C)N(C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 770510459 ZDVTWRAECBMZFC-MRXNPFEDSA-N 392.478 5.217 30 20 GKED CC(C)c1ncc(/C=C/C(=O)c2ccc(OC[C@H]3CCCCO3)c(F)c2)s1 771095373 ALPSSIHDROSXPC-KXPUMZMLSA-N 389.492 5.250 30 20 GKED C#CCCCCCC(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1 778263761 YQXGPOQGHDJTNW-OAHLLOKOSA-N 390.243 5.143 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)c1 779105081 SAEGJDQEFUDJNZ-QFIPXVFZSA-N 392.449 5.525 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c[nH]nc3-c3ccsc3)cc2)c1 783659605 HXYMBCCEJZUGSY-UHFFFAOYSA-N 386.480 5.201 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 787431496 NQBDIZKBBLEUTR-UXHICEINSA-N 399.416 5.111 30 20 GKED C=CCN(C(=O)CCc1ccc(N(C)C)cc1)c1nc(-c2ccccc2)cs1 790067508 AXBXXSBHCPZZOR-UHFFFAOYSA-N 391.540 5.028 30 20 GKED CC(/C=C\C(=O)c1ccc(C(=O)N(C)C)cc1)=C\c1cccc(C(F)(F)F)c1 792924507 DAWIMWIKEDHXCC-XSAPRFFASA-N 387.401 5.250 30 20 GKED C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797573728 VKQBGDMFMYHHOJ-DOMZBBRYSA-N 388.920 5.179 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC=C(c3ccncc3)C2)cc1 806201419 WRCKAKDUZQMPNG-XMMPIXPASA-N 394.478 5.058 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3cc4c(C)nn(C)c4s3)cs2)cc1 806576368 COFDZHKLMAOUIA-HJWRWDBZSA-N 379.510 5.271 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1 818211246 APXMSEHANDCMOY-LUAWRHEFSA-N 390.420 5.122 30 20 GKED COc1cccc(-c2nc(CON=Cc3ccccc3OC(C)C)cs2)c1 836498319 NMKOXGDSBWBVOT-UHFFFAOYSA-N 382.485 5.157 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cc(C4CC4)cnc3Cl)c2C#N)[C@H](C)C1 839387682 GRQBNNOSPPWTEH-GHMZBOCLSA-N 385.920 5.484 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)s1 841073050 UXQORZUUZYZVOX-CYBMUJFWSA-N 399.516 5.020 30 20 GKED Cc1cccnc1C(F)(F)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 857432905 NCGBZTICESBPOH-UHFFFAOYSA-N 398.253 5.158 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)cc2)CCCC1)c1nc2ccccc2s1 916627477 XMEMFSDWCMXXGH-INIZCTEOSA-N 380.900 5.638 30 20 GKED Cc1csc([C@H](C#N)C(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)n1 916844137 WDPXPTPHFYJVGK-XLYVWGIVSA-N 396.874 5.661 30 20 GKED C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)CC(C)(C)C 916887127 LBNHYNBWNHDFJG-DOMZBBRYSA-N 382.476 5.111 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(SC)ccc2C)cc1 916912482 AVYPJYQSVLUTHH-FQEVSTJZSA-N 380.513 5.021 30 20 GKED O=C(O)c1ccc(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)c(Cl)c1 1776127397 RSAUCAKMDQNYHC-RAXLEYEMSA-N 392.838 5.513 30 20 GKED C[C@@H](Oc1ccc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)cc1)C(=O)O 1776469729 ZMAICBKSKGVVSJ-FJUNDMEASA-N 397.279 5.119 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2cc(C)cc(C)c2)cc1 1776782778 JTFGEACTCZQUJF-DEOSSOPVSA-N 381.560 6.264 30 20 GKED Cc1ccc(S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 6315277 QKOWPRWYXYUIRW-HXUWFJFHSA-N 396.899 5.105 30 20 GKED Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c(Cl)c1 14861454 JYPRFLCZNONXRM-UHFFFAOYSA-N 378.884 5.924 30 20 GKED N#CCc1ccccc1C(=O)O[C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 22872204 AOSUPSZOOWNVGV-DEOSSOPVSA-N 394.430 5.015 30 20 GKED N#C[C@@H](C(=O)Cc1cccc2ccccc12)c1nc2ccccc2n1C(F)F 41559140 JSBPGVRKNBSSCO-KRWDZBQOSA-N 375.378 5.004 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 116573851 SFHXVKCYSIFGCL-BAOGPQIGSA-N 395.506 5.343 30 20 GKED CCCc1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 173988437 AHDWFKGSZYQUMM-CYBMUJFWSA-N 387.917 5.363 30 20 GKED N#CCCCOc1cccc(NCc2ccc(OCC(F)(F)F)c(F)c2)c1 183399518 YHVQMOJUPZZBBC-UHFFFAOYSA-N 382.357 5.061 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(Sc2nnc(C)s2)cc1C)c1ccccc1 187392843 LLENNAAJUAMIDP-GOSISDBHSA-N 395.553 5.605 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)cc1 237510309 PNJLZZBHAJFASV-CCLHPLFOSA-N 392.502 6.010 30 20 GKED C[C@@H](/N=C(/O)C1CCCCC1)C(O)=Nc1cccc(N=C(O)C2CCCCC2)c1 330213374 FJBZYTYSDDIBHK-MRXNPFEDSA-N 399.535 6.368 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(F)(c3ccc(Cl)cc3)CC2)cc1 410222600 FITIHLXQNHXGGJ-UHFFFAOYSA-N 384.882 5.242 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)CCCCc1nc2ccccc2s1 410973719 WQMLOOUITRIMQT-UHFFFAOYSA-N 383.904 5.367 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2ccc(C#N)cc2Cl)cs1 430366239 PLAXXDWGOXYWBK-UHFFFAOYSA-N 399.928 5.521 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1 432075138 IUZHFHINPXCXEX-SUMDDJOVSA-N 397.519 5.678 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 436138489 XQNAXVXKWQHTQT-IBGZPJMESA-N 375.815 5.021 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1C 438647466 ODNUGNCRAOGUHX-IBGZPJMESA-N 387.405 5.563 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1nc(-c2ccc(OC(F)F)cc2)c(C)s1 439058795 OJUDWRRVDYFPIN-UHFFFAOYSA-N 399.422 5.152 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)c1ccc(C#N)cc1 439571234 KXTLQRHPYMFEJG-OAHLLOKOSA-N 375.859 5.637 30 20 GKED N#Cc1ccc(NC(=O)c2cnc(-c3ccccc3F)s2)cc1C(F)(F)F 443876389 GOZBTBKBKARMMS-UHFFFAOYSA-N 391.349 5.092 30 20 GKED Cc1coc(-c2cccc(NC(=O)c3cn(CCCC#N)c4ccccc34)c2)n1 444309684 OXALORNANDSHPY-UHFFFAOYSA-N 384.439 5.161 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 448406507 WCHOHHWTIOJBTK-UHFFFAOYSA-N 389.459 5.300 30 20 GKED CC[C@H](CC(F)F)C(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 457690534 DZOQNJBLMLDTAR-PRHODGIISA-N 377.275 5.106 30 20 GKED CCN(C(=O)c1cc2cc(C(F)(F)F)ccc2n1C)[C@@H](C)c1ccc(C#N)cc1 463138607 AKHHBMNMWUBREH-AWEZNQCLSA-N 399.416 5.292 30 20 GKED N#C[C@@H](NC(=O)c1nc2ccccc2cc1Cl)c1ccc(Cl)c(Cl)c1 464408577 VTOIZKUZWRXJBR-MRXNPFEDSA-N 390.657 5.190 30 20 GKED C[C@H]1CCc2c(F)cccc2[C@@H]1Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468879153 GLANEUQPDLBPPR-UPCLLVRISA-N 391.490 5.144 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccc(-n2cccn2)cc1 475553344 OORLLAYRCWTFFD-UHFFFAOYSA-N 388.515 5.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(C)cc1OCCOC 475576951 BSYJHKCQOMTELO-UHFFFAOYSA-N 396.531 5.194 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(C)c(-c2ncco2)c1 478023352 REFZPRPFVTTZLW-UHFFFAOYSA-N 393.491 5.038 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NCc2nnc(-c3cccc(C#N)c3)o2)o1 480260554 ILOHZCPATWKIAA-UHFFFAOYSA-N 390.830 5.442 30 20 GKED CC(C)n1c(SCc2ccccc2C(C)(C)C#N)nc2ccccc2c1=O 487989243 PQWAFJWOHKGAOH-UHFFFAOYSA-N 377.513 5.071 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 488062572 GWSFCMTVSSRUCN-OAHLLOKOSA-N 391.393 5.465 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N(CCC#N)CC(C)(C)C 494299271 VLVPRJNIIYXXGF-UHFFFAOYSA-N 375.925 5.174 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)N(Cc1ccco1)c1ccccc1C#N 501021368 OSMSYVQJFPLALX-SFHVURJKSA-N 388.467 5.277 30 20 GKED COc1ccc(CNc2ccc(C)cc2Br)cc1OCCCC#N 503051324 VRKPNPBTIQLNPI-UHFFFAOYSA-N 389.293 5.061 30 20 GKED C=CCn1c(SCc2ccccc2SC)nnc1-c1ccccc1OC 510241342 WGHTYNMOTNTJNQ-UHFFFAOYSA-N 383.542 5.154 30 20 GKED N#C[C@H](NC(=O)c1cccc(COc2cccc(F)c2)c1)c1ccccc1Cl 510277453 QLZVRGWYVSVQMH-NRFANRHFSA-N 394.833 5.053 30 20 GKED Cc1c(C(=O)NCC2CCC(C#N)CC2)sc2ccc(Br)cc12 512481038 RPTWDOYOUCMYGV-UHFFFAOYSA-N 391.334 5.032 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 512512466 VRGAYNGOMFAQIU-MRXNPFEDSA-N 399.926 5.307 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)c1 512558585 FTCCDXMZJAJUJF-DEOSSOPVSA-N 387.483 5.705 30 20 GKED CC(C)(CCC#N)CNC(=O)c1c(Cl)cccc1Oc1ccccc1Cl 516677400 YIBPEAKJWUJNRV-UHFFFAOYSA-N 391.298 5.845 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@H]3CCc4ccc(F)cc43)cc2)cc1 518894469 GAHFBPUSUJOTTF-QHCPKHFHSA-N 386.426 5.101 30 20 GKED Cc1nc2ccc(NC(=O)N(Cc3ccc(C#N)cc3)CC(C)C)cc2s1 520170827 QUBOKKMWTNZLLO-UHFFFAOYSA-N 378.501 5.167 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1cccc(C#N)c1 521787410 IJKYVPIDUBDPBT-KRWDZBQOSA-N 375.497 5.093 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1Br 521889031 YNDRBVNMOLAKFN-UHFFFAOYSA-N 399.741 5.062 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)o1 524129292 OERPPZGKYYSZOI-IBGZPJMESA-N 381.476 5.396 30 20 GKED N#Cc1ccc(SCc2csc(COc3ccc(Cl)cc3)n2)c(F)c1 524988771 VSACYIQBMFGQEY-UHFFFAOYSA-N 390.892 5.679 30 20 GKED CC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC(F)(F)CC1 528921573 YHWJTKQSQHQDIZ-AWEZNQCLSA-N 394.874 5.855 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2C(C)(C)C1 534036746 SKWWLCGTAGPHOC-MRXNPFEDSA-N 379.529 5.264 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cnoc2-c2ccc(F)cc2Cl)cc1 538122340 YULZLKUHWXJUOL-UHFFFAOYSA-N 383.810 5.188 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)cc1 539183985 RZZPYEWBEHKHMC-UHFFFAOYSA-N 394.478 5.348 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(Cl)cc2Cl)n1 540732335 UCHWEOQITZCHEM-UHFFFAOYSA-N 378.206 5.275 30 20 GKED C=C(C)[C@@H](Cc1nc(-c2cccc(Oc3ccc(Cl)cc3)n2)no1)OCC 547266700 DETSWUSUFXEPES-QGZVFWFLSA-N 385.851 5.101 30 20 GKED C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(OC(F)F)cc1OC(F)F 551571177 KNTJYZRGOYYEGQ-LBPRGKRZSA-N 394.368 5.101 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OCC1CC1)c1nc2cc(Cl)ccc2s1 587988852 ZIPJAZJKNYWQFE-HNNXBMFYSA-N 382.872 5.229 30 20 GKED CC(C)c1ccccc1N(C(=O)CCCCCC#N)c1nc2ccccc2s1 588814598 RDERJLKRCNOPLW-UHFFFAOYSA-N 391.540 6.558 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@@H](C)c2ccc(Cl)cc2Cl)n1 603946922 VICDOYMKVWHGSG-JTQLQIEISA-N 381.284 5.290 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209097 ANLUPYSTOXAOLF-OAHLLOKOSA-N 377.469 5.165 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccccc1Cl 609370915 JBHOYPTVMOCLQH-ZDUSSCGKSA-N 376.934 5.465 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(C#N)nc2)cc1 609640482 RYDQIRFFTNCSPR-UHFFFAOYSA-N 393.830 5.050 30 20 GKED Cn1c(S[C@@H](C#N)C2CCCCC2)nc2scc(-c3ccccc3)c2c1=O 609648715 SKJFSGGNPNGWNV-KRWDZBQOSA-N 395.553 5.227 30 20 GKED CCN(C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 609967724 ASFGIZFGLAACFI-HOTGVXAUSA-N 388.433 5.365 30 20 GKED C[C@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1cccc(C#N)c1 610320809 LLQACZHDMHUOGW-SFHVURJKSA-N 385.467 5.158 30 20 GKED CC(C)(C#N)CCC[S@](=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 610482358 CYFGHUHZWGVXBS-VWLOTQADSA-N 394.367 6.161 30 20 GKED C=CCn1c(S[C@H](C)c2cccnc2)nnc1-c1ccc(C(C)(C)C)cc1 618427041 JARDUTYKXORBAQ-MRXNPFEDSA-N 378.545 5.677 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(COCc2ccccc2)cc1 618758069 LBYBNCKCACMJSD-DEOSSOPVSA-N 397.478 5.084 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCSc2ccc(Br)cc21 618808001 YJDBCNLIZTZMMT-ZWKOTPCHSA-N 385.330 5.135 30 20 GKED C=CCn1c(Sc2ncnc3sc(C)c(C)c23)nnc1-c1ccc(F)cc1 669640149 UQAAPYUPKWHFQY-UHFFFAOYSA-N 397.504 5.043 30 20 GKED N#C[C@H](C(=O)c1cnccc1Oc1ccccc1)c1nc2cc(F)ccc2s1 669694181 ICPWUGJTSAJPRY-OAHLLOKOSA-N 389.411 5.113 30 20 GKED O=C(NCC1CCC(F)(F)CC1)Nc1ccc(C(F)(F)C(F)(F)F)cc1 669718030 PWHGEWDYEVNCNB-UHFFFAOYSA-N 386.311 5.288 30 20 GKED Cc1nc2c(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cccc2o1 672580846 FNDGGIFSVVZTGN-HNNXBMFYSA-N 393.855 5.403 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 678759172 OGVSMOFWCLCPQB-QGZVFWFLSA-N 375.497 5.538 30 20 GKED CCOc1cccc(C=NNc2ccc(C#N)c(C(F)(F)F)c2)c1OC(F)F 726425765 GLYMGDLPOVVISH-UHFFFAOYSA-N 399.319 5.023 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccc(O)c(F)c1 728438985 SOELWYDWYHXXLI-ONNFQVAWSA-N 395.817 5.333 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)cc1OC 728697976 APKYWNQRYYPDIB-SAYIFAPPSA-N 379.456 5.061 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1csc2ccccc12 730067884 HOXUURUIXSFACP-HNNXBMFYSA-N 375.497 5.208 30 20 GKED C[C@H](Nc1ccccc1SC[C@H](C)C#N)C(=O)Nc1ccc2ccccc2c1 731039950 FQTYHIXXCLJSQL-SJORKVTESA-N 389.524 5.531 30 20 GKED C=CC[C@H](NC(=O)N(CCc1ccc(OC)cc1)CC(C)(C)C)c1ccncc1 734684110 STUIAUOSOFUYMN-QFIPXVFZSA-N 395.547 5.008 30 20 GKED C[C@H](CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1F 739599413 MADCTVYFZVFCNV-OAHLLOKOSA-N 378.472 5.236 30 20 GKED O=C(/C=C\c1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(-c2ccncc2)c1 741472898 LPVKWUSYXJOQAR-XQRVVYSFSA-N 396.349 5.154 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2\Oc3ccccc3C2=O)cs1 742435447 BDNJJUXJVGJMQK-ZDLGFXPLSA-N 396.855 5.097 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2cccc(Cl)c2)cc1F 743038278 XCOGSDVXPQNMLF-UHFFFAOYSA-N 397.862 5.952 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2cccc(Cl)n2)cc1 744454929 OSRIUOIUWYYHBA-UHFFFAOYSA-N 394.883 5.256 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2sc(Cl)nc2C)cc1 748093990 ZAAZSRCNGDFSQY-UHFFFAOYSA-N 399.859 5.030 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1 758328265 PMXHMCYYPJUMHV-UHFFFAOYSA-N 399.475 5.287 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 763547968 IGKTUJRWVINQDQ-DNVCBOLYSA-N 376.406 5.362 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@H]2c2cccc(Br)c2)cc1 768420241 ACSQYFJCBVPTCT-YWZLYKJASA-N 385.305 5.077 30 20 GKED C[C@@H](CSCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 772981348 VXVIMIXCCBTDTG-BBRMVZONSA-N 384.501 5.181 30 20 GKED C=C(C)[C@H](N[C@H](C)c1cc(Br)ncc1F)c1ccc(F)c(F)c1 775559145 WBKJNLJFUOCZLN-QGHHPUGFSA-N 385.227 5.229 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(CF)cc1 776909768 YJMMOGQJACYQLE-HNNXBMFYSA-N 388.533 5.422 30 20 GKED Cc1cc(C=Nn2cnnc2SCc2ccc(Cl)cc2)ccc1Cl 779761025 GFLDHQHQAFTPKT-UHFFFAOYSA-N 377.300 5.068 30 20 GKED C[C@@H](NCc1nnc(-c2cccc(F)c2)o1)c1ccc(-c2cccc(C#N)c2)cc1 782524753 UIQPORUNJHZKAH-MRXNPFEDSA-N 398.441 5.265 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 785696099 BWLVWPFAJNKDSI-ZIAGYGMSSA-N 385.360 5.545 30 20 GKED CC[C@H](NC(=O)[C@@H](C#N)C(=O)c1cc2c(Cl)cccc2s1)c1ccccc1 787044192 FTMJDEAAIWIQBR-RDJZCZTQSA-N 396.899 5.145 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(OC(F)(F)F)cc1 789337736 YFVXYTRSGJHQAY-KRWDZBQOSA-N 398.384 5.287 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=S)Nc3ccsc3)cc2Cl)cc1 790310054 XLPJYIIUCJVENO-UHFFFAOYSA-N 385.901 5.874 30 20 GKED Cc1cc(CCC(=O)[C@H](C#N)c2nccc3ccccc23)ccc1Br 792093077 HOXBUBXWJXBZIO-SFHVURJKSA-N 393.284 5.115 30 20 GKED C=CC[C@@H](OC(=O)c1cccc(C[S@@](C)=O)c1)c1ccc(Cl)c(Cl)c1 797566412 JFZKNGFSWDBXDP-IQGLISFBSA-N 397.323 5.346 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(N(CC)C(C)C)cc1 806128340 JGCAORWQMJMKCQ-UHFFFAOYSA-N 397.567 5.309 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C(F)=C\C3CCCCC3)n2)cc1 815921499 ITSRVKDAYKUVFK-AUUUKSDWSA-N 384.476 5.429 30 20 GKED Cc1c(NC(=O)N[C@H](C)c2cccc(C#N)c2)cccc1NC(=O)OC(C)(C)C 861398015 FYXHHOPFXRQSEB-OAHLLOKOSA-N 394.475 5.096 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1cccc(Cl)c1)C(=O)O 900069265 WUFANGUXRPLHMO-SFHVURJKSA-N 377.843 5.171 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)cc1 915085839 OVWYDGLVFFWCJZ-QGZVFWFLSA-N 382.250 5.296 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(C(C)(C)C)cc1 916900860 UOAQVODCBLKMOE-HXUWFJFHSA-N 376.500 5.070 30 20 GKED COc1ccc(/C=C/C(=O)c2ccccc2)cc1OCc1ccc([N+](=O)[O-])cc1 917030591 IBWLOQSOPRMNDJ-UKTHLTGXSA-N 389.407 5.079 30 20 GKED Oc1ccc2ccccc2c1C=Nc1ccc(-c2nnc3n2CCCCC3)cc1 920943178 QXGRFOYJZPIMLN-UHFFFAOYSA-N 382.467 5.281 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3c[nH]c(C)c3)CCC2)cc1 1785842141 QBDQVNIHAZXNJE-UHFFFAOYSA-N 393.531 5.063 30 20 GKED COc1ccc2cc(/C=C3\S/C(=N\c4c(C)cccc4C)NC3=O)ccc2c1 7165117 FSSNTCZTKBQJFQ-NDENLUEZSA-N 388.492 5.357 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc(C#N)cc1 56712721 BWELEPZFDGOAOZ-INIZCTEOSA-N 382.423 5.105 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(C)n(C(C)C)c1C 57089874 CNHXTHJMGSCFJP-UHFFFAOYSA-N 388.471 5.306 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)n1 59408083 VARJKUPPIIKBAH-KRWDZBQOSA-N 387.508 5.676 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c(C)c1 60036231 JKSJFKBKPKKAFU-SFHVURJKSA-N 385.467 5.407 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3sc4c(c3C#N)CCCC4)cs2)cc1 61046240 PCYINXKABCCFJW-UHFFFAOYSA-N 379.510 5.183 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 66917452 IGQXDTLYOKHHTJ-AWEZNQCLSA-N 382.460 5.096 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(F)(F)F)cc1 66954073 QXLQADPIRBOASE-ZDUSSCGKSA-N 393.434 5.421 30 20 GKED Cc1ccccc1OCCCN(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 108531102 BAQJVVLBVGGQKX-QGZVFWFLSA-N 397.544 5.180 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccncc1 120714144 MILIJHZUEWJRQR-HRAATJIYSA-N 389.886 5.523 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc2cc(Br)ccc2c1 127143603 LBCRIRKFPIHNAJ-UHFFFAOYSA-N 398.260 5.143 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(-c3ccccn3)ccc2Cl)cc1 132254432 MHUVVBXFRDTGDJ-UHFFFAOYSA-N 375.859 5.455 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1)c1ccccc1 134723823 GXRVDUJIOKUTOB-OAHLLOKOSA-N 379.847 5.221 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC(C)(C)O1 141994312 LXONZSDAABSIKD-HNAYVOBHSA-N 397.906 5.027 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(F)cc2Cl)cc1C 151763459 DHMJDHNQCXHYLE-UHFFFAOYSA-N 396.853 5.125 30 20 GKED Cc1c(NC(=O)c2ccc(F)cc2C(F)(F)F)cccc1OCC(F)(F)F 157833418 ONMJMBNTUROELS-UHFFFAOYSA-N 395.274 5.346 30 20 GKED N#C[C@H](NC(=O)c1cccc(C(F)F)c1)c1ccc(OCc2ccccc2)cc1 171501317 BJPXQHZBCNIFGZ-NRFANRHFSA-N 392.405 5.198 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(F)c1 171742354 UBEJYKMIJDHIPQ-BEFAXECRSA-N 383.492 5.446 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(C)c1cc(Cl)ccc1C#N 176427789 BYJMILCWOPDXDH-UHFFFAOYSA-N 385.851 5.059 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Cl)cc2-c2nc3ccccc3[nH]2)c1 177061414 OJSVTMZUULIHBN-UHFFFAOYSA-N 378.844 5.069 30 20 GKED C[C@H](C#N)Oc1ccccc1NCc1cccc(OCc2cccc(C#N)c2)c1 181118418 ABZVMACXCGCREG-GOSISDBHSA-N 383.451 5.040 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 185009676 NLOWAVRWDKOGKA-SBUREZEXSA-N 398.466 5.361 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C(C)C)cc2)=C(\S)NC(C)(C)CC)cc1 186973378 TZLGGRLBMFRBJH-UHFFFAOYSA-O 397.608 5.377 30 20 GKED C[C@H](Nc1cc(C#N)nc2ccccc12)c1ccc(OCc2cccnc2)cc1 301366813 NXOMLUGLOPJDGX-KRWDZBQOSA-N 380.451 5.254 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1 303936993 YBIUSBOUVODRBM-MRXNPFEDSA-N 391.433 5.107 30 20 GKED CCc1ccccc1C/C(O)=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1 329825407 IGHCKOOVKCZGHW-LJQANCHMSA-N 397.519 5.232 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1CN1CCC(C)(C#N)CC1 411494891 IMJFSCNJQQTFKO-UHFFFAOYSA-N 379.451 5.263 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 439353437 PXMGRFZLHMCZDM-QUCCMNQESA-N 397.906 5.028 30 20 GKED N#Cc1ccc(CSc2nnc(-c3cc4ccccc4o3)o2)c(OC(F)F)c1 439539853 FSBPFJSMQBAXHO-UHFFFAOYSA-N 399.378 5.248 30 20 GKED N#Cc1cccc(CNc2ccc(Oc3nncc4ccccc34)c(Cl)c2)c1 443455253 QVDIWXAMDMMXLD-UHFFFAOYSA-N 386.842 5.559 30 20 GKED N#CCC[C@@H](NC(=O)C1(Cc2ccc(C(F)(F)F)cc2)CC1)c1ccccc1 445781929 DCMZPKIOFVPCOB-LJQANCHMSA-N 386.417 5.189 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(Cl)c(OC(F)F)c1)c1ccccc1 455111063 QMSFXKVQMLMTFO-MRXNPFEDSA-N 393.821 5.498 30 20 GKED C=CCOCCCC(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 463473442 HNGUAQJLJDUWPP-IBGZPJMESA-N 396.918 5.052 30 20 GKED Cc1cccc(Cl)c1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 467675234 GGWNEKWVFBZFPI-UHFFFAOYSA-N 383.879 5.032 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N(CCC(F)(F)F)CC(F)(F)F 468541351 KBUYEJLRZYRTAW-UHFFFAOYSA-N 387.286 5.089 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCc4ccc(Cl)cc43)ccc21 468876779 GZUUKMHNISJSLO-HXUWFJFHSA-N 379.891 5.022 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)c(Br)cc1C 473864469 NLJDHLBWJHJFRG-UHFFFAOYSA-N 383.286 5.178 30 20 GKED C[C@H](C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(F)(F)F 474259965 QEMCYUAHWAXBLB-XCBNKYQSSA-N 381.238 5.014 30 20 GKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)C(c1ccccc1)c1ccccc1 474791213 QXXKJIXBLPQHRI-YKSBVNFPSA-N 382.507 5.411 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C[C@@H]1CCCO1 475542913 AWVIZXFYLHAZEX-QFIPXVFZSA-N 392.543 5.752 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H](c2ccco2)C1 481210580 WFSHZFWKJJFXHH-BLLLJJGKSA-N 377.366 5.175 30 20 GKED C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487427120 HQVLVRCKCZRHMO-OXJNMPFZSA-N 382.891 5.100 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 494750640 GKDABLRXOZLYJA-RZPKCTKSSA-N 379.529 5.648 30 20 GKED C=CCOc1ccc(C(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)cc1OC 499378207 NBQDMKPPKMEEBL-CQSZACIVSA-N 393.405 5.112 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3cc[nH]c3n2)cc1Cl 499780798 XZGXWWMTDLMLMA-GOSISDBHSA-N 386.842 5.124 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2SC2CCCC2)c1 502339668 ZMJDTLLIZXZMHO-UHFFFAOYSA-N 395.528 6.048 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1csc2ccc(Cl)cc12 502995182 BANOSDCGXQRYLT-UHFFFAOYSA-N 386.929 5.742 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1Cn1c(C)nc2ccccc21 505028839 JANARDQVMJZMKV-HXUWFJFHSA-N 388.515 5.160 30 20 GKED Cc1ccccc1[C@]1(F)CCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 505311752 SRGMXTCPDDYMQK-AOMKIAJQSA-N 397.519 5.349 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1ccc(C#N)cc1 510413137 KEQUBYUWWCNREW-UHFFFAOYSA-N 381.435 5.197 30 20 GKED N#Cc1cccc(C(=O)N(Cc2cccs2)C23CC4CC(CC(C4)C2)C3)c1 520330017 APMNSLJKWRPKIZ-UHFFFAOYSA-N 376.525 5.231 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1CCSc2ccccc21 521377502 KAJRGPKJYTZAHE-NRFANRHFSA-N 384.504 5.371 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N(C)c3cccc(C#N)c3)c2)c1 525021444 GIAWTZBHMSMFDN-UHFFFAOYSA-N 386.520 5.744 30 20 GKED Cc1cccc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1Br 534560766 HYIJFDNNFSCFOI-CQSZACIVSA-N 398.087 5.059 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccccc1 536128480 MPRGVNRLVZZCCY-LJQANCHMSA-N 376.500 5.001 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 538001168 YXLLJQKHKRHDKE-HKUYNNGSSA-N 386.417 5.210 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)N[C@@H](C)c1cc2ccccc2o1 542102711 NFDJXPYZBYBLDB-STQMWFEESA-N 384.888 5.316 30 20 GKED Cc1ccoc1CNc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1 542762689 VZNWLGDGBWNEKI-UHFFFAOYSA-N 377.391 5.138 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cs1 555320865 XBRJNYWQDNYLKC-SFHVURJKSA-N 394.883 5.512 30 20 GKED Cc1ccc(-c2ccncc2)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 559443862 VIOJPASSLFNKQY-UHFFFAOYSA-N 383.476 5.704 30 20 GKED Cc1c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)ccn1C(C)C 559652584 RXOUOOYSKCDDKX-UHFFFAOYSA-N 395.450 5.654 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C#N)c1ccc(-c2cccnc2)cc1 561854987 FMJJUKYOUVRNPE-OAHLLOKOSA-N 392.300 5.234 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@@H](Cc2ccccc2)C(F)(F)F)CC1 565923909 QYAOBAOKIORRJQ-ITAUSPCMSA-N 386.461 5.401 30 20 GKED N#Cc1c(F)cccc1SCC(=O)Nc1ccccc1Oc1ccccc1 575739691 SZAYOWZCIPXVNT-UHFFFAOYSA-N 378.428 5.220 30 20 GKED CC(C)N1CC[C@@H](NCCCCC(C)(C)C#N)[C@H]1c1ccc(Cl)c(F)c1 578859361 VPHWOOYMQDILQS-WOJBJXKFSA-N 379.951 5.313 30 20 GKED CSc1cccc(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1C 581577846 XGKUMAOSMOQQPC-UHFFFAOYSA-N 390.468 5.420 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cscc3-c3ccccc3)cc2)ccn1 582213319 AIUCQOYASVSMQK-UHFFFAOYSA-N 397.459 5.726 30 20 GKED N#CCCCCC(=O)Nc1ccc(COc2ccc(Br)cc2)cc1 593953055 WZSRAQQSRYNZET-UHFFFAOYSA-N 387.277 5.051 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 602739403 DPMRCXBNOVOOFJ-UHFFFAOYSA-N 398.491 5.028 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc2c(c1)CCC2 609370632 JIXLPNVNSIIIEW-HNNXBMFYSA-N 382.554 5.300 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3ccccc3SC[C@H](C)C#N)cs2)o1 609376765 JQKAUQPCZMLGSF-CYBMUJFWSA-N 397.525 5.145 30 20 GKED C[C@H](C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccccc1C(F)(F)F 610223348 SFGOURLWMYZWFQ-NSHDSACASA-N 378.419 5.260 30 20 GKED COc1ccc([C@@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccccc2OC)cc1 611394726 ZCFHJVBMHKXWHR-AOYPEHQESA-N 398.506 5.332 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccc(C#N)c1 611803683 XQCGMJCYBMZITD-MSOLQXFVSA-N 394.478 5.218 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3occc3-c3ccccc3)n2)cc1 613317975 BCIXJMREQBKBCP-LJQANCHMSA-N 384.460 5.869 30 20 GKED Cc1ccc(-n2ncc(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2C)cc1 613392203 MEQWXUQZGYCWAU-IBGZPJMESA-N 398.491 5.103 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@H]1Cc2ccc(F)cc21 619435688 KKSAKZVDJSLLDH-HNNXBMFYSA-N 394.393 5.129 30 20 GKED CC(C)(C)c1ccc([C@@H](NCCCC2(C#N)CCOCC2)C(F)(F)F)cc1 619620954 UFKQBMDOZUNCAJ-GOSISDBHSA-N 382.470 5.278 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)NCc1ncc(C(F)(F)F)s1 657705954 HSNUBMLLNWRBFD-UHFFFAOYSA-N 388.299 5.305 30 20 GKED N#C[C@@H](C(=O)c1cc2cccc(F)c2o1)c1nc(-c2c(F)cccc2F)cs1 682127145 HKPWIUGHRPYAAC-NSHDSACASA-N 398.365 5.464 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)C3CCCCC3)n2)cc1 726324452 AFPMVYQZZJWIOE-BEFAXECRSA-N 382.529 5.601 30 20 GKED C[C@@H](OC(=O)c1ccc(COc2ccccc2C#N)o1)c1cnc2ccccc2c1 726333503 XWVDMIRRFJAWIK-MRXNPFEDSA-N 398.418 5.196 30 20 GKED CCCOc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1Cl 726473405 JWZXHDDLOGXRNO-UHFFFAOYSA-N 380.300 5.463 30 20 GKED COc1c(O)cccc1/C=C1\CCc2nc(-c3ccc(C)cc3)sc2C1=O 727654600 OCOVUQFQPAASGG-NTCAYCPXSA-N 377.465 5.045 30 20 GKED COc1ccc(/C=C/C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 727997194 UHCBFCKJFPREON-MDWZMJQESA-N 398.462 5.106 30 20 GKED COC(=O)C[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(SC)cc1 728174715 YYXVILZGNDUEEJ-CTJICSLTSA-N 398.311 5.144 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(O)c(F)c2)ccc1OCc1ccccc1 728439237 YXROMRQTKJNFPL-JXMROGBWSA-N 378.399 5.015 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1c(Cl)nc(Cl)n1C 728440481 OGKFSVHUNROCMW-CMDGGOBGSA-N 378.284 5.055 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1)c1ccccc1 746326757 UMJARNWLHPGLSV-VABKMULXSA-N 396.506 5.131 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)N1CCCSC1=Nc1ccccc1C(C)C 749784677 BTIDOADMFWBBDY-AWEZNQCLSA-N 385.533 5.172 30 20 GKED C=CCC[C@@H](C(=O)O[C@H](C)c1nnc(-c2cccc(C)c2)o1)c1ccccc1 753423421 RAMKCMUJUVDFIY-YLJYHZDGSA-N 376.456 5.399 30 20 GKED Cc1sc([C@H](C)NCc2ccc(OCC#N)cc2)nc1-c1ccc(Cl)cc1 754942807 NSTLTHRASDOXQH-AWEZNQCLSA-N 397.931 5.525 30 20 GKED Cc1cccc2c1CN(C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 760050511 YJAKMZUPJOBBKO-QHCPKHFHSA-N 381.479 5.241 30 20 GKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1ccc(Br)cc1 760480473 ZWKGTVJBDURKTI-QUCCMNQESA-N 387.321 5.371 30 20 GKED N#Cc1cc(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc23)c(Cl)c([N+](=O)[O-])c1 764302230 GJIIKGQQBWKTBW-SJORKVTESA-N 391.814 5.015 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2ccc(O[C@@H](C)c3ccccc3)cc2)c1 788350024 CIQWEXIFZJEAAN-FDDCHVKYSA-N 398.462 5.096 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(C2SCCS2)c1 791722249 HLFKQFJMJNQVMW-UHFFFAOYSA-N 384.570 5.775 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1O)C(=O)C[C@H](CC#N)c1ccccc1 793770925 DPXOBLVEPPMHIY-REWPJTCUSA-N 398.506 5.570 30 20 GKED Cn1cc2c(n1)CC/C(=C/c1nc(-c3cc(Cl)ccc3Cl)cs1)C2=O 794961637 ISDUQOVHSZHBOY-POHAHGRESA-N 390.295 5.063 30 20 GKED N#CC[C@H](CC(=O)O[C@@H](C(=O)c1ccccc1)c1ccccc1)c1ccccc1 795988237 FXWYIJHRMADPGU-RCZVLFRGSA-N 383.447 5.241 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)(F)F)s2)cc1 796797481 HBJBDPJSIGCOKM-CQSZACIVSA-N 394.418 5.071 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)s1 797568189 OVOIVSAUOJQAEM-NXEZZACHSA-N 397.363 5.245 30 20 GKED CC[C@@H](NC(=O)[C@@H](C#N)C(=O)c1coc2ccc(C(C)C)cc12)c1ccccc1 805928909 RQJACSCFFRQKBE-PZJWPPBQSA-N 388.467 5.146 30 20 GKED N#Cc1sc(NC(=O)c2cc(-c3ccccc3)nc3ccccc23)nc1Cl 813369964 SHLOYVKLMDQSSY-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)c1ccc(C2SCCCS2)cc1 819737736 ZRQNUZNKEBNHNI-OAHLLOKOSA-N 382.554 5.260 30 20 GKED CC[C@H](Cc1ccccc1C)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 819947843 RFXOEGWHWXZWCC-WBVHZDCISA-N 381.426 5.185 30 20 GKED C=CCc1ccc(OC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c(OC)c1 822074026 RSHYSCMDOVUHRT-UHFFFAOYSA-N 397.858 5.270 30 20 GKED CO[C@@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 850765156 UFJGPKUMTPTZEK-ZKYQVNSYSA-N 395.311 5.108 30 20 GKED O=C(CON=Cc1ccccc1C(F)(F)F)Nc1ccccc1-c1ccccc1 852188090 WIJLPAJYIGDTDO-UHFFFAOYSA-N 398.384 5.362 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ocnc1C(F)F 860577933 PKSVZMBMSUPXTH-SNVBAGLBSA-N 389.198 5.091 30 20 GKED Cc1ccc(-c2ccc(/C=C3\SC(=Nc4c(C)cccc4C)NC3=O)o2)cc1 915983581 OAVJRTMVLDNYPH-MOSHPQCFSA-N 388.492 5.763 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccccc2)cc1 916915947 SEYKGFTWBOFNKV-HSZRJFAPSA-N 390.442 5.468 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)/C=C\c2cccc(F)c2)cc1 918629638 LPEZBBLHOZJHAO-QXMHVHEDSA-N 388.417 5.079 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCCc1ccc(Cl)cc1 920101558 DTSNZGDCVNGZCB-SFHVURJKSA-N 378.859 5.044 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccc(F)cc3)CCC2)cc1 920342390 SBSGXTRNSKITSJ-QHCPKHFHSA-N 399.469 5.682 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3cc(Cl)cc(Cl)c3)cc2)c1 1776058613 WYXHWLJOBRTGDR-UHFFFAOYSA-N 399.277 5.734 30 20 GKED O=C(O)Cc1ccc(NN=Cc2ccc(C(F)(F)F)c(Cl)c2Cl)cc1 1776085762 JINMYGADLKVSJV-UHFFFAOYSA-N 391.176 5.085 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2ccc(O[C@H](C)C(=O)O)cc2)cc1 1776125996 ZBVJTQJDGSIWHJ-YBYKNVHQSA-N 382.456 5.004 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(-c3ccc(C)cc3)c2)cc1CC(=O)O 1776131798 KDNVEOHZEZXQNZ-WQLSENKSSA-N 386.447 5.194 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)cc1 1776339944 SDIRNKMJQSEFKE-CSKARUKUSA-N 387.273 5.242 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc2c(c1)CCC(C)(C)O2 1776354564 PZYMBWCPKRZSPR-YVMONPNESA-N 394.467 5.172 30 20 GKED N#CCc1ccc(NC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)cc1 11001010 RXDCNYCXBCGHGW-UHFFFAOYSA-N 397.453 5.611 30 20 GKED CSc1ccc2cc(COC(=O)CCc3ccc(C#N)cc3)c(Cl)nc2c1 12958005 DQZZWDOLQGVHLM-UHFFFAOYSA-N 396.899 5.158 30 20 GKED Cc1ccoc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538122 ZULWKQNHGPREAN-GFCCVEGCSA-N 377.252 5.508 30 20 GKED Cc1noc(C)c1CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 47227190 UJGYYDXVHFCLEC-FQEVSTJZSA-N 393.874 5.172 30 20 GKED CCCN(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccc(C#N)cc1 52825806 VAOFMOIPJLNQQV-UHFFFAOYSA-N 390.314 5.106 30 20 GKED N#C[C@@H](C(=O)CCc1ccc2ccccc2c1)c1nc2ccccc2n1C(F)F 54466144 YHUUDLDJNOKABA-SFHVURJKSA-N 389.405 5.394 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 63389343 AGGQONMPAAQLFO-UHFFFAOYSA-N 379.463 5.350 30 20 GKED C=CCn1c(Sc2nc(C(F)F)nc3ccccc23)nnc1-c1ccoc1C 66451889 QMNILOSTRINULT-UHFFFAOYSA-N 399.426 5.065 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1cc(F)ccc1F 72030819 QGKKHMVZDWRSND-CQSZACIVSA-N 393.393 5.068 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccccc1C(C)(C)C 108354274 LVODHWJOZVEBQW-MRXNPFEDSA-N 381.545 5.286 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(C#N)cc1 118444507 BLWHPDIGNFQMDR-CVEARBPZSA-N 395.553 5.243 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2SCc2cccs2)cc1C#N 150783690 FPVUJWCCTWVSQO-UHFFFAOYSA-N 375.478 5.036 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1cccs1 160412008 ZUPJMKXWQLMHOP-AWEZNQCLSA-N 384.526 5.408 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(-c2cccs2)n1-c1ccc(Cl)cc1 163654631 BHWZMJHPSHHZKP-ZDUSSCGKSA-N 399.932 5.185 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1cccc2cccnc12 170986058 KRWAAYGWUPWHLN-OAHLLOKOSA-N 393.537 5.217 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 174713361 DEUFPTZAEHKNNW-AWEZNQCLSA-N 377.469 5.154 30 20 GKED CCc1ccccc1N(C(C)=O)c1nc(CSc2cccc(C#N)c2)cs1 177102568 UMGVNCNWHHDDSI-UHFFFAOYSA-N 393.537 5.554 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 180559244 QEQHHYHBSCKRKK-HNNXBMFYSA-N 393.468 5.076 30 20 GKED Cc1sc(C(=O)Nc2ccccc2O[C@H](C)C#N)cc1-c1ccc(F)cc1 182110934 LFNXJXYPZYQKCZ-CYBMUJFWSA-N 380.444 5.406 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN([C@H](C)c2ccsc2)CC1 191465626 WPMSMMCFUWRXLB-GOSISDBHSA-N 397.588 5.511 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC)c(OC)c2)cc1Br 207747077 LLKZFLRNBATUAN-DAXSKMNVSA-N 393.302 5.084 30 20 GKED N#Cc1ccc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4)csc3n2)s1 255360019 YZNCQKUHRHMYSK-OVCLIPMQSA-N 395.896 5.734 30 20 GKED Cn1c(NC(=O)c2ccccc2-c2ccccc2C#N)nc2cc(Cl)ccc21 302941217 BECNSGDLHAUELN-UHFFFAOYSA-N 386.842 5.018 30 20 GKED O/C(Cc1ccc2ccccc2c1)=N/C1CCN(/C(O)=N\C2CCCCC2)CC1 328910289 FMAKSSPGUHDBCH-UHFFFAOYSA-N 393.531 5.050 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](C)c1oc2ccccc2c1C 328982519 FFAUESQYOLTEDI-UKRRQHHQSA-N 384.501 5.466 30 20 GKED O/C(=N/[C@@H]1CCOC2(CCCC2)C1)c1ccc2nc(-c3ccccc3)oc2c1 330016156 PCYZBANTZVGIFV-GOSISDBHSA-N 376.456 5.291 30 20 GKED CC1CCN(CCC[C@@H](NCc2ccc(C#N)s2)c2ccc(F)cc2)CC1 421871211 FWRAGYNIDSVVFM-JOCHJYFZSA-N 385.552 5.102 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 426668544 FUUPLWRULGMXLH-IFMALSPDSA-N 389.886 5.247 30 20 GKED C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(C#N)cc1Cl 430365169 DDTFLJQCTHETLR-CQSZACIVSA-N 391.858 5.008 30 20 GKED Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(C#N)cc1Cl 430379703 VVGUNQWDJAOIMC-UHFFFAOYSA-N 390.201 5.220 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)c1cccc(SCC#N)c1 430621009 IYUKAGAXXFPZBW-FQEVSTJZSA-N 392.549 5.386 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1 431161448 YDKUFMQJKFLGKW-SFHVURJKSA-N 398.316 5.015 30 20 GKED N#CCCC[C@@H](NCc1csc(CCc2ccccc2)n1)c1ccccc1 433011370 FVRFQOLRDDNXJP-JOCHJYFZSA-N 375.541 5.453 30 20 GKED C[C@@H](c1cc(F)ccc1F)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438641284 KXCBZUMKIHCXBH-JTQLQIEISA-N 383.320 5.080 30 20 GKED CSc1c(F)cccc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 439109138 DZOYOSBXFRVQIC-UHFFFAOYSA-N 394.496 5.499 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCCOCc1ccccc1 439388806 PYANWSHOIFCJAH-UHFFFAOYSA-N 380.532 5.609 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccc1 439675091 YZGQGNIHLQCEEU-DEOSSOPVSA-N 395.462 5.320 30 20 GKED COc1ccc(NC(=O)N(CCC#N)CCC(C)C)c(OCc2ccccc2)c1 439690396 ZGBJKAGVRXTIFS-UHFFFAOYSA-N 395.503 5.068 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3cccc(Cl)c3)no2)cc1C(F)(F)F 443892205 ROJDDXKGMUVQBC-UHFFFAOYSA-N 391.736 5.138 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1ccc(C#N)cc1OC(F)F 444795456 YOCYGDFZFFZIQG-MRXNPFEDSA-N 384.348 5.251 30 20 GKED O=C(Nc1ccccc1NCC(F)(F)F)c1cc(F)cc(C(F)(F)F)c1 446089994 IOEQVYQRAXIRGQ-UHFFFAOYSA-N 380.263 5.071 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)c1 455922419 QQCMNODEPJMPAH-LJQANCHMSA-N 387.405 5.531 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 457785409 KYQDBKPAXZFBBL-NSHDSACASA-N 385.323 5.081 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798158 HIBVEYIYBFAIDD-KRWDZBQOSA-N 375.925 5.368 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCc1ccccc1)c1cc(C(F)(F)F)ccn1 464405967 MXHUVABVFZVJPE-HXUWFJFHSA-N 394.396 5.376 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(OCCC(C)C)cc1 467384267 WHZJCGUOJOGHJS-UHFFFAOYSA-N 377.488 5.203 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Sc3nc4c(cc3C#N)CCCC4)o2)cc1C 468625314 NAHVIJHLFACYFP-OAHLLOKOSA-N 390.512 5.352 30 20 GKED Cc1ccc([C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CCC2)cc1 468825548 CVZZPFTXALSNBT-RUZDIDTESA-N 387.527 5.531 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccccc1Cl 475574923 MOMIYUXYDFPWGL-OAQYLSRUSA-N 382.935 6.561 30 20 GKED N#CCCn1cc(CN[C@H]2CC[C@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 475575273 ZOCUHTSZTLCMIW-REWPJTCUSA-N 388.490 5.029 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 476714272 RMCPZKIUUKGVLC-OAHLLOKOSA-N 376.485 5.181 30 20 GKED Cc1cc(C)c(NC(=O)CCCSCCCOc2cccc(C#N)c2)c(C)c1 477349574 GQZZVMPTZXJGDQ-UHFFFAOYSA-N 396.556 5.405 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477506058 CAYVKNJCCZRYKQ-CQSZACIVSA-N 389.421 5.731 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cccc(-c2ncc(C)o2)c1)c1ccc(F)c(F)c1 480587940 MKPMQLVQWCRANJ-IBGZPJMESA-N 383.398 5.367 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)c1 480869636 FRGHXUNGIFPKSK-UHFFFAOYSA-N 386.304 5.159 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483231799 GBYYEOHYFKYFOW-SFHVURJKSA-N 387.439 5.296 30 20 GKED C=CCN(C(=O)c1cccc(OCc2cn3cc(C)ccc3n2)c1)c1ccccc1 484267992 YPOFOHLRQQTDER-UHFFFAOYSA-N 397.478 5.055 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(CO)c(Cl)c1 485026653 ZSOYSMZDOWMTKL-UHFFFAOYSA-N 394.883 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1cc(Cl)ccc1OC 486566276 YFMXXQNIIBRWEE-UHFFFAOYSA-N 379.909 5.001 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1c[nH]c2ccccc12)C(F)(F)F 490855220 OFLYHGAQLPJJHK-QGZVFWFLSA-N 393.434 5.231 30 20 GKED Cc1ccc2ccccc2c1CS(=O)(=O)c1ccc(C#N)c(C(F)(F)F)c1 492417874 PRIHAFWWAHOXTE-UHFFFAOYSA-N 389.398 5.013 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2c[nH]nc2-c2ccccc2)cc1 492729498 TUGMVJKFXGPWGJ-UHFFFAOYSA-N 398.397 5.132 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC(F)(F)F)[C@H](C)c1ccc(C#N)cc1 495101414 YWMYSAIXZGCCRV-OAHLLOKOSA-N 399.416 5.299 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)C(=O)Nc1ccccc1Sc1ccccc1 495275880 DQLJKWXPXXHLDE-HNNXBMFYSA-N 391.521 5.224 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc3ncccc3c2)cc1 499460888 YHCBVZJNVFZFGZ-UHFFFAOYSA-N 395.437 5.088 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 500306915 QRQZYDILDNHDOB-JOCHJYFZSA-N 390.527 5.062 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCC(=O)c3cccc(F)c3)cc2)cc1 502789228 KMXLSIVKLRYZJJ-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C=CCC[C@H](NC(=O)N(C)CCc1nccs1)c1ccc(C(F)(F)F)cc1 510270291 MFGILHMEWIQIFM-INIZCTEOSA-N 397.466 5.053 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc(C(F)F)c1 511786660 OAKIHEQEGDKMIX-UHFFFAOYSA-N 378.378 5.849 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](CCc1ccccc1)c1ccccc1 515901483 TYBAZXLYZBPMGA-XMMPIXPASA-N 383.495 5.074 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(-c2ccccn2)cc1 517060725 MMZMMESQJPLKRD-UHFFFAOYSA-N 389.503 5.136 30 20 GKED Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 517975412 JKBMOEROUCGBLD-OAHLLOKOSA-N 394.862 5.017 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1cccc(Cl)c1Cl 518207191 BCVHEELCIRYRGW-HNNXBMFYSA-N 389.213 5.387 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 518240289 VUMADYMAWNTFGN-MRXNPFEDSA-N 387.508 5.704 30 20 GKED Cn1c(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c(Cl)c2ccccc21 521768927 KQEFIVBXMMOTBR-CYBMUJFWSA-N 392.673 5.133 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)CC1 521841025 RFGJWMAOKKGVDN-UHFFFAOYSA-N 383.492 5.276 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3COc4ccccc43)cc2Cl)cc1 522202210 BHMLGPXMKAQJRB-SFHVURJKSA-N 390.826 5.119 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CS[C@H]2CCCc3ccccc32)cc1 523953818 WPEOQEPTWNJGBB-QFIPXVFZSA-N 394.540 5.143 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 525570554 JWQLWQQNXDMKAH-PXAZEXFGSA-N 380.797 5.233 30 20 GKED Cc1ccc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)c1 525632581 UBDPHVHTMFCQDZ-ZDUSSCGKSA-N 397.500 5.240 30 20 GKED C[C@H](NC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 525734269 KGJBVOIEGILCEV-VIFPVBQESA-N 394.290 5.746 30 20 GKED C[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(-c2ccncc2)cc1 527350076 DIJXKKOXTBYBAU-WZFBRQLOSA-N 398.510 5.056 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@H]1COc2ccccc21 533630246 GVDLZZNHZDVKGQ-KSFYIVLOSA-N 399.450 5.037 30 20 GKED C=CCC[C@H](NC(=O)Nc1c(CC)noc1C)c1ccc(C(F)(F)F)cc1 533659977 IKEJVBHFIGDPDR-INIZCTEOSA-N 381.398 5.393 30 20 GKED CC(C)C[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 539296153 ZNSPXULBRVPFAE-IBGZPJMESA-N 380.879 5.139 30 20 GKED Fc1cccc([C@@H](NCc2cccc(OCC(F)(F)F)c2)C(F)(F)F)c1F 542262477 XORKCZPGKVEHQK-OAHLLOKOSA-N 399.281 5.299 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 544527618 ABLGAHUMIXBYBZ-SFTDATJTSA-N 391.408 5.048 30 20 GKED C=C(C)[C@H](Cc1nc(CC2(SCc3ccccc3)CCCC2)no1)OCC 545838727 VPHKCSJDQKEWOD-IBGZPJMESA-N 386.561 5.382 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc(CCC(F)(F)F)no2)cc1 546295631 ZFJUYZUOMBHHSK-UHFFFAOYSA-N 377.297 5.035 30 20 GKED Cc1cc(CN(C(=O)c2ccc(CC#N)cc2)C2CCCC2)c2ccccc2n1 550972243 XIOGAXVKPNHSSP-UHFFFAOYSA-N 383.495 5.194 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2csc(-c3ccccc3)n2)c(C#N)s1 552703435 ZNBWYIVKYBYWSE-UHFFFAOYSA-N 381.526 5.222 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1ccccc1 553677923 XBTJCNAXXAXSLT-OAQYLSRUSA-N 399.897 5.446 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccccc2F)C1 569719162 DPQWSFXNRBLMOU-CVEARBPZSA-N 383.492 5.099 30 20 GKED CSc1nc(C2CC2)cc(-c2nc([C@H](C)c3c(F)cccc3F)no2)c1C#N 583110170 PXZMASCADOFXSC-SNVBAGLBSA-N 398.438 5.033 30 20 GKED Cc1cc(Br)c(C[S@@](=O)CCCCC(C)(C)C#N)cc1Cl 594678565 DCPUUQLZEXCEIJ-NRFANRHFSA-N 390.774 5.380 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C[C@H](C)C1(F)F 599727324 ZLQZIBUTZXUKTK-GJZGRUSLSA-N 385.414 5.106 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@@H]1c1ccccc1 604364103 NVZJSLYMYQKKTC-HSZRJFAPSA-N 397.478 5.966 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(Sc2ccccn2)cc1 604567342 LOZSXKCYHXOPAO-UHFFFAOYSA-N 387.508 5.155 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)C[C@@H](c3ccccc3)C(F)(F)F)c2C#N)C1 609125467 ROSUXZBKADKZNZ-WBMJQRKESA-N 392.446 5.419 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc3scnc3c2)cc1 609298723 MZFONMFGDJNHGE-UHFFFAOYSA-N 389.411 5.352 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1C(C)C 609427551 JGJTUSHFWIHGNT-MSOLQXFVSA-N 396.556 5.919 30 20 GKED CCC[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccn1 609504865 OWTFPEFUFBBWEK-HSZRJFAPSA-N 385.467 5.211 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 609669763 UXFSYTPOAWXCDK-CQSZACIVSA-N 386.204 5.620 30 20 GKED CC(C)CN(C(=O)c1csc(Cc2ccccc2F)n1)c1ccc(C#N)cc1 609784429 OSLCTTIGCDDZTJ-UHFFFAOYSA-N 393.487 5.047 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)c2)n1 610036765 DDWVVCBZWMAQFM-GFCCVEGCSA-N 393.537 5.429 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)c3sccc3C#N)cc2c1 610066781 IRNUUSMDGUDXFR-UHFFFAOYSA-N 376.437 5.110 30 20 GKED C[C@@H](C#N)CN(C(=O)c1ccc(Oc2cccc(Br)c2)cc1)C1CC1 611086214 JKJKKVBHQSUPES-AWEZNQCLSA-N 399.288 5.006 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@H]2/C=C\c2cccs2)cc2ccccc21 611988484 OWGKAVJCKHSXDW-JZHDPFOFSA-N 389.524 5.325 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2c(C)cc(C)nc2s1 613657366 GBRUCABJFQRCRC-UHFFFAOYSA-N 376.934 5.456 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1cc(C(F)(F)F)ccc1Cl 618741805 MDEMXXHRSAOSJY-OAHLLOKOSA-N 379.769 5.039 30 20 GKED CSc1cc(C(=O)N[C@H]2CCc3cc(C#N)ccc32)c(Cl)cc1Cl 618785542 KDUROOJXIPMUAF-INIZCTEOSA-N 377.296 5.004 30 20 GKED N#C[C@H](C(=O)c1ccc(C(F)(F)F)s1)c1nc2ccccc2n1C(F)F 671751437 XFGPMCWJPNORCU-MRVPVSSYSA-N 385.317 5.002 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(Oc2ccccc2)cc1 672598957 KWIVXRPFNFZIIJ-UHFFFAOYSA-N 392.455 5.174 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)csc1Br 681356840 NRKYWWWZCVMMPI-SECBINFHSA-N 395.278 5.058 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2)Cc2ccccc2)cc1Cl 726435032 ZMCZTCANYXRSJI-UHFFFAOYSA-N 391.927 5.611 30 20 GKED Cc1cccc(C2(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)CCCC2)c1 726857923 CIGJOKCACAPBGH-QGZVFWFLSA-N 393.437 5.428 30 20 GKED COc1ccc(Sc2ccc(NC(=O)NCc3ccc(C#N)cc3)cc2)cc1 728392638 KFDISDDMYYECTQ-UHFFFAOYSA-N 389.480 5.040 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 728687701 JVJHDAMWLGUMNY-HSZRJFAPSA-N 399.494 5.323 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2cncc(F)c2)cc1Cl 729318766 CBKMBDUHZVBIIG-ZGBFETHSSA-N 391.833 5.181 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 729574556 ZCXXIXNCMNVYFU-UHFFFAOYSA-N 399.466 5.393 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)[C@@H](C)Oc1ccccc1C#N 733072725 RTFWGQXHEDOLFW-JKSUJKDBSA-N 392.480 5.062 30 20 GKED Cc1ccc(N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 733311295 PUJLQIZAVOCPKB-HNNXBMFYSA-N 387.936 5.118 30 20 GKED CC[C@H](OC(=O)CCC(=O)N(CCC#N)c1ccccc1)c1ccc(Cl)cc1 733492737 CWJADBLYOHRDTA-FQEVSTJZSA-N 398.890 5.061 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=S)Nc2cc(Cl)cc(Cl)c2)c1 733754192 HNVHMBVBSYJOSS-INIZCTEOSA-N 394.327 5.161 30 20 GKED CC[C@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 734375566 REIMWUXFLPRYSE-SFHVURJKSA-N 393.537 5.850 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C/C(=O)c2ccc(SC(F)F)cc2)c1 734979799 DRDOEFMPPYKWEL-JXMROGBWSA-N 386.423 5.296 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1ccc(SCC(F)F)cc1 741844832 VXVVYHCQZFDKEM-KHPPLWFESA-N 384.451 5.185 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1cc2cc(Br)ccc2o1 745612457 XIQZGFTXMLPPHO-UHFFFAOYSA-N 387.237 5.014 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)NCc1cc(C#N)ccc1F 745891221 LIHNKQRENGTCPF-UHFFFAOYSA-N 393.462 5.128 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3c[nH]c4ccc(C)cc34)n2)cc1 747109469 SQFYCRPVYMHPQB-HXUWFJFHSA-N 399.519 5.717 30 20 GKED Cc1cc(C(F)(F)F)c(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nn1 750465301 XTVJASVUOSGTOI-HTQZYQBOSA-N 395.269 5.125 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(C(C)(C)CC)cc1 753531010 CXCGCEZAEGKTJD-OAQYLSRUSA-N 390.527 5.460 30 20 GKED C=CC[C@H](NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1)c1ccncc1 754921929 UBCDROQSVNBVFZ-KOSHJBKYSA-N 385.511 5.787 30 20 GKED N#C[C@@H](C(=O)Cc1c(F)cccc1F)c1nc2cc(C(F)(F)F)ccc2s1 756240305 GPBPGTAJMLFDHI-NSHDSACASA-N 396.340 5.012 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CC[C@@]3(CCOC3)C2)c1 757212496 YGKIARRHBDYNMJ-HSZRJFAPSA-N 388.552 5.208 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 772985608 SZPBKSZYKHWGCA-FXAWDEMLSA-N 384.907 5.350 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cc(Br)ccc2F)cc1 779017186 HEXUXHMPNAEPES-OAQYLSRUSA-N 395.275 5.339 30 20 GKED CCCCCn1cc(C(=O)Nc2ccccc2O[C@H](C)C#N)c2ccccc21 781033722 ABUNOZWJHNDRRN-QGZVFWFLSA-N 375.472 5.375 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccccc1-c1nc2ccccc2[nH]1 781088240 UYZDTNQVJILLHS-HXUWFJFHSA-N 378.476 5.140 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2CCC(=O)c3ccccc32)c1 786138555 AOCFGIBMDFTEEX-QFIPXVFZSA-N 385.488 5.023 30 20 GKED O=C1C/C(=C/c2cnc(-c3ccc(Cl)cc3)s2)C(=O)c2ccccc2N1 789149442 YWIXMFUWXGRFCX-LCYFTJDESA-N 380.856 5.072 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 789400001 QFEJTIZVRXEVIR-MAUKXSAKSA-N 378.497 5.455 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cn(C(C)(C)C)nn1 790214465 AXRLUAISRPFFAP-MDZDMXLPSA-N 386.908 5.015 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1nccc2ccccc12 792107647 WUUIQYHNUOIZGP-QGZVFWFLSA-N 399.277 5.577 30 20 GKED Cc1csc(Nc2cccc(NC(=O)C[C@@H](CC#N)c3ccccc3)c2)n1 793168914 KUYVWNZDAHKYMH-QGZVFWFLSA-N 376.485 5.221 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1OC(F)F 797567171 ZCZDMWRYNJPJLY-UQTJOTSZSA-N 390.455 5.322 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2CCC(F)(F)C2)cc1Cl 797831531 RZFHCAPZNMTVNR-KSSFIOAISA-N 388.845 5.759 30 20 GKED O=C1/C(=C\c2cc(Br)c(Cl)s2)Cc2nc(Cl)ccc21 806579891 VKTCZIFGENIURO-UTCJRWHESA-N 375.074 5.035 30 20 GKED Cc1ccc2c(Cc3noc(-c4cn(CCCC#N)c5ccccc45)n3)c[nH]c2c1 809371126 NKOWMQMGQUTQGN-UHFFFAOYSA-N 395.466 5.376 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1ccccn1)c1csc(-c2c(F)cccc2Cl)n1 810527656 KDLQUHPFIHNADG-GFCCVEGCSA-N 399.878 5.152 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cccc([N+](=O)[O-])c1Cl 813245947 PXQVPQJMZBJLHE-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CC(=NNc1cccc2cnccc12)c1sc(-c2ccccc2F)nc1C 814836167 KJMFBRDHLYAWQT-UHFFFAOYSA-N 376.460 5.642 30 20 GKED Cc1cc(C#N)cnc1C(=O)O[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 815951697 NFGRMMXRWKZTCG-CYBMUJFWSA-N 397.887 5.265 30 20 GKED O=C(c1sccc1C(F)F)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 823410438 UYPUODOGHMLSLQ-IONNQARKSA-N 381.288 5.031 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cnn(Cc3ccccc3)c2Cl)c1C#N 839369909 PKYCDVAMIBKHAG-UHFFFAOYSA-N 398.919 5.068 30 20 GKED C[C@]1(C#N)CC[C@@H](OC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)CC1 839439634 RDMWQDASOQKXOY-BGIOPWKHSA-N 382.074 5.324 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]1Cc1ccccc1)c1nc(-c2ccncc2)cs1 850791584 VZKGZAHEGBTFIC-VAMGGRTRSA-N 387.508 5.040 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 856199690 DPJPKOYZVCVEBM-CALCHBBNSA-N 388.389 5.216 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc(CC(=O)Nc2ccc(C)cc2)no1 904246250 OBNOFVSVBWTUTG-FQEVSTJZSA-N 375.472 5.047 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1[nH]c(-c2ccccc2)nc1C 915110315 QWIZOQCNBVWMII-UHFFFAOYSA-N 375.863 5.423 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915200082 UPWVSFKZSWBECQ-NRFANRHFSA-N 383.476 5.210 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)cc1OC 916137730 PHBWIKNXKSEPRO-NTMALXAHSA-N 391.448 5.470 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@H](C#N)c2nc3ccccc3s2)s1 916846268 OFIHKUHRVZOHIR-LBPRGKRZSA-N 395.534 5.209 30 20 GKED CCc1nc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 920278906 CXPZQCGVSQCDLH-FQEVSTJZSA-N 390.512 5.025 30 20 GKED CCC(=NNc1cccc(C(=O)O)c1)[C@H](C)c1cccc(Br)c1 1776038375 HPHNRDDQHBRVEF-GFCCVEGCSA-N 375.266 5.129 30 20 GKED CC#CC[C@@H](NCc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O 1776194566 FIFOQXDZXNEBAB-XMMPIXPASA-N 384.479 5.113 30 20 GKED CC1(C)/C(=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776515378 ZFOBRKILCLXZRT-FVIVVMBBSA-N 398.458 5.449 30 20 GKED COc1ccc(/C=C2\CCc3ccc(SC)cc3C2=O)c2cc(C(=O)O)oc12 1777360226 HCQBFVHAUMVAAO-NTEUORMPSA-N 394.448 5.074 30 20 GKED COc1ccc2c(c1Cl)C(=O)/C(=C\c1ccc3oc(C(=O)O)cc3c1)CC2 1777373619 LQVCKTZFXAGUKP-JYRVWZFOSA-N 382.799 5.006 30 20 GKED COc1cc(C#N)ccc1OC(=O)[C@@H](Sc1ccccc1)c1ccccc1 15988569 PZKOHFDYEPKXKO-NRFANRHFSA-N 375.449 5.006 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2c(-c3c(Cl)cccc3Cl)noc2C)n1 41516005 QRRDVVVEQRALBL-JTQLQIEISA-N 392.267 5.212 30 20 GKED N#C[C@H](C(=O)c1cccc(Br)c1)c1nc(-c2ccccc2)cs1 42654286 ZKNWZZSWOPRZAE-OAHLLOKOSA-N 383.270 5.063 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)[nH]1 66800107 XMIVXULFOIKMAE-QGZVFWFLSA-N 389.524 5.647 30 20 GKED COc1cc(C(=O)/C=C/c2c(C)nn(-c3ccc(F)cc3)c2C)ccc1SC 72050206 WMMGOPCMBHLYDB-ZHACJKMWSA-N 396.487 5.255 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)n1 120545475 IFNSHFJTWFWPTL-UHFFFAOYSA-N 377.831 5.011 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 128897022 BPVJXUOUEMWQKR-GXTWGEPZSA-N 399.928 5.216 30 20 GKED CCc1nc(CN(C)C(=O)c2ccccc2Sc2ccccc2C#N)cs1 149696214 LJZKXBSJULCZFA-UHFFFAOYSA-N 393.537 5.001 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(-c2nnc(CC)o2)cc1)c1ccccc1 155945654 YRLWPCOFSOMBNI-LJQANCHMSA-N 376.460 5.128 30 20 GKED CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1 155971544 DNDVDIRHAGPBRD-UHFFFAOYSA-N 399.450 5.178 30 20 GKED C[C@@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1cccc(F)c1 172848270 ROMHTQRQCZHDBU-QGZVFWFLSA-N 388.442 5.213 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc3nc(C4CC4)oc3c2)c1 176623066 SPTKRBXILWYXBN-UHFFFAOYSA-N 399.406 5.001 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2C(=O)c2cccs2)n1 177744059 QNHYGHCCZBOIPK-HNNXBMFYSA-N 380.494 5.049 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1cncs1)C(=O)c1ccccc1 178321791 XTUPQXOVHFAADM-MOSHPQCFSA-N 390.508 5.173 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 178987610 LYHSPNFYWNLAKT-PABFRNLHSA-N 385.801 5.365 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)c1 180090822 ZWACDJNOCBLCBW-WIYYLYMNSA-N 377.488 5.435 30 20 GKED N#Cc1ccc(SCc2nnc(-c3ccccc3Cl)o2)cc1C(F)(F)F 180389955 JJGFWQUGMZWYRL-UHFFFAOYSA-N 395.793 5.573 30 20 GKED N#C[C@H](C(=O)c1cccc2ncccc12)c1nc(-c2ccc(Cl)cc2)cs1 181041474 BXDIJHUYHWEWHY-QGZVFWFLSA-N 389.867 5.502 30 20 GKED C=CC[C@H](C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 186767803 JXIAZEDDFXAUAE-QFIPXVFZSA-N 384.479 5.546 30 20 GKED COCCC1(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)CCCCC1 187112398 AGJPKXUSHDDJBI-QGZVFWFLSA-N 389.565 5.047 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC[C@@H]2CCCO2)cc1 189908539 FQJDYABCIAEIMO-NRFANRHFSA-N 379.500 5.349 30 20 GKED C[C@@H]1CCCC[C@@H]1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 195667236 CBLQSILQLUOULW-YLJYHZDGSA-N 378.541 5.407 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(F)cc3C)o2)c1 236898875 HMDDBHRRTIFCPP-LJQANCHMSA-N 378.447 5.365 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1C[C@@H](O)c1cccs1)c1ccccc1 246253990 FRVWIPYUIVUXLA-SLFFLAALSA-N 384.545 5.053 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1Cl)C(=O)Nc1ccc(Cl)cc1Cl 255771863 LDMDONYDOUPJDS-UJZCVKTISA-N 393.657 5.008 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCCCC1(C#N)CCOCC1 281485092 WXVYAOXNNBZSDP-OAHLLOKOSA-N 387.524 5.009 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 292803045 NIRGDWCNSLBSSE-UHFFFAOYSA-N 397.422 5.383 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 303362742 QGMVRSPVUDKMAI-IRXDYDNUSA-N 396.556 5.784 30 20 GKED OC1=N[C@@H](/C(O)=N/[C@@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)CCC1 328770607 CNOPOCRQWGTLAQ-DJIMGWMZSA-N 382.426 5.587 30 20 GKED COc1ccc(C(C)(C)/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)cc1 329518006 PMKMRXWQWBZCNS-HXUWFJFHSA-N 381.520 5.319 30 20 GKED C=CC[C@H](CC)NC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 410118613 AXSPQZZUTARPQS-BBRMVZONSA-N 378.925 5.088 30 20 GKED C=CC[C@H](C)NC(=O)C/C(=C/c1cccc(OC)c1)c1nc2ccccc2s1 426875210 MZCYCPAKAASRGH-CQUHBBLWSA-N 392.524 5.316 30 20 GKED C=CCN(C)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 429330525 SNDMZLOXKRMOPT-UHFFFAOYSA-N 380.467 5.381 30 20 GKED CCCOc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 429342502 ZJRMDBPHOOKZSU-AWEZNQCLSA-N 382.769 5.033 30 20 GKED N#CCC[C@H](NC(=O)NCC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 432113817 RQDBAUJBORTKLN-OALUTQOASA-N 389.421 5.067 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CC4(CCCC4)c4ccccc43)cc2)nc1 434030405 HKMXKSMAMQTABF-UHFFFAOYSA-N 395.462 5.218 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1 437143959 HFSJKCGQRUYFPR-UHFFFAOYSA-N 382.769 5.294 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccc(C#N)cc1 440046200 BCQGVZRZZIMBMG-UHFFFAOYSA-N 387.826 5.152 30 20 GKED CC(C)c1oc([C@H]2CCCN2CCCCC(C)(C)C#N)nc1-c1ccccc1 444664685 ROMSTTVWZCBOLC-HXUWFJFHSA-N 379.548 6.322 30 20 GKED Cc1sc(NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)c(C#N)c1C 445571855 PDSAOLPPAQSREN-UHFFFAOYSA-N 382.382 5.065 30 20 GKED N#Cc1cccc(C2(C(=O)N3CCC(Sc4ccc(Cl)cc4)CC3)CC2)c1 448185695 QLVNAOWUFGGQTA-UHFFFAOYSA-N 396.943 5.027 30 20 GKED CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)N[C@H]2CC[C@@H](CC#N)C2)nc1 453295994 SSLYMKNSVSAILH-VJBMBRPKSA-N 381.951 5.123 30 20 GKED C=CCC[C@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(C(F)(F)F)cc1 454701568 AFPHCNILRWMEEC-WBAXXEDZSA-N 379.426 5.094 30 20 GKED COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 458799701 JTSYJDDNHILJAL-LEOXJPRUSA-N 391.515 5.223 30 20 GKED C=CCn1c(S[C@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1cccc(C)c1 463044690 SZWIXOCXACEZJS-OAHLLOKOSA-N 380.473 5.201 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCc1c[nH]c2ccc(Cl)cc12 463893653 GFOCBHQACSSYQK-UHFFFAOYSA-N 399.881 5.332 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3C[C@@H]4CCC[C@H]4C3)cc2Cl)cc1 465159725 SRKAAMBCBSGIKO-HOTGVXAUSA-N 381.863 5.268 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(OCC2CC2)c(F)c1 469515964 VXSNJVVGYSGPOE-OAHLLOKOSA-N 395.478 5.298 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 471174074 XCYRCJKLOLFFDR-UHFFFAOYSA-N 379.435 5.034 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@H]3CCC[C@H]3c3ccccc3C(F)(F)F)CC2)cc1 474144931 FLGUGMYDBWEUHR-ICSRJNTNSA-N 398.428 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(NC(=O)N(C)C)ccc1Cl 476097073 DNOBDQBQELFHCQ-UHFFFAOYSA-N 399.922 5.538 30 20 GKED Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 478015213 JHIAVLFVAFBZOY-UHFFFAOYSA-N 393.450 5.253 30 20 GKED C=CCCO[C@H](C)C(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 481063088 VAICXOZTXPLYCU-VGSWGCGISA-N 394.540 5.215 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccnn2C2CCCC2)cc1F 482493359 GADCAHCTDNIATL-UHFFFAOYSA-N 390.418 5.054 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1C 482781176 RSHRUNMPRWNJQT-OAHLLOKOSA-N 390.512 5.438 30 20 GKED C[C@H](NC(=O)c1ccoc1Br)c1ccc(-c2cccc(C#N)c2)cc1 486145770 OJWSLDLMUXTSPU-ZDUSSCGKSA-N 395.256 5.072 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C)cc1C 488453808 BVFPEPDYIFVJLL-SFHVURJKSA-N 392.478 5.260 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cccc(C(C)C)c2)cc1C 492246348 QTUBVUAAJFLDQY-UHFFFAOYSA-N 386.499 5.456 30 20 GKED Cc1c(C(=O)Nc2ccc(OC(F)F)cc2F)sc2ccc(C#N)cc12 513271662 MJNCYAWHGOLGPV-UHFFFAOYSA-N 376.359 5.074 30 20 GKED C[C@@H]1CCc2c(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)csc2C1 515540913 GMLWZHAFVJGWJG-DGCLKSJQSA-N 385.439 5.108 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(CCc2ccccc2)C2CCCC2)c1 518361411 KCIYMOVFAWOESL-UHFFFAOYSA-N 390.527 5.121 30 20 GKED C=CCCO[C@@H](C)C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 519999991 NWJRUEFKDWMJHX-LPHOPBHVSA-N 396.918 5.051 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2cccc(N3CCCC3)c2)ccc1OC 531529846 JGVBKHXSCHSXGH-LJQANCHMSA-N 380.532 5.101 30 20 GKED C=CCN(CC=C)C(=O)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 534252188 WDDWUINLXHUDHZ-UHFFFAOYSA-N 383.197 5.140 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1CCC(F)(F)F 535467654 FNVVAXSIYCSNLJ-AWEZNQCLSA-N 392.446 5.686 30 20 GKED C=C[C@H](CC(=O)N(C)Cc1c(C)nn(-c2ccccc2C)c1C)c1ccccc1 536162713 GOJWBNOIVHTBEU-OAQYLSRUSA-N 387.527 5.116 30 20 GKED C=CCC[C@@H](NCc1ncc(-c2ccccc2Br)o1)c1ccccc1 538257336 WLJCPDCSOFAEKV-LJQANCHMSA-N 397.316 5.901 30 20 GKED N#CCCCOc1cccc(N[C@@H]2CCc3ccc(OC(F)(F)F)cc32)c1 540725632 BUJHWBADVBUOID-LJQANCHMSA-N 376.378 5.367 30 20 GKED C=CCOc1cccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3o2)c1 548159310 KFQRQGOMZIKBFX-LJQANCHMSA-N 377.444 5.152 30 20 GKED CCN(C(=O)c1cnn(-c2ccccc2Cl)c1C)c1ccc(C#N)c(Cl)c1 552703396 WYSPRWJTDBAQNH-UHFFFAOYSA-N 399.281 5.026 30 20 GKED CC(C)c1c(NC(=O)c2ccc(Cl)c(C#N)c2)cnn1-c1ccccc1Cl 558806601 YBUNPUNJIUKFSI-UHFFFAOYSA-N 399.281 5.426 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C1CC1 561256262 ZNYVFYUKGAYFEU-KRWDZBQOSA-N 383.451 5.111 30 20 GKED Cc1ccc(Br)cc1-c1noc(C[C@H](CC#N)c2ccccc2)n1 570171784 VOKCLCJIYSVGHR-HNNXBMFYSA-N 382.261 5.048 30 20 GKED Cc1c(C(=O)Nc2cccc(Oc3ccccn3)c2)sc2ccc(C#N)cc12 579384098 ZBJRFYPQGMAHPD-UHFFFAOYSA-N 385.448 5.521 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1ccc(Sc2ccc(Cl)cc2)cc1 583269354 LOUNZQPWJDXUMN-IBGZPJMESA-N 390.961 5.256 30 20 GKED CC1(C)C[C@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccc(F)cc2O1 583534384 MXXPGLCKNRLATG-KRWDZBQOSA-N 378.369 5.108 30 20 GKED N#CCCCn1cc(C(=O)Nc2csc(-c3ccccc3)n2)c2ccccc21 588080151 FYMKVNSOPVFNLE-UHFFFAOYSA-N 386.480 5.321 30 20 GKED Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)CCCCCC#N 588381058 YMZYFENYIZANQZ-UHFFFAOYSA-N 398.816 5.172 30 20 GKED CC(C)[C@H](Oc1ccc(Br)cc1)c1noc(CCCCCC#N)n1 589152291 CDKFJYDJTQQRKG-KRWDZBQOSA-N 392.297 5.235 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3OC(C)C)n2)cc1 592360818 MLJFURZPWOONTH-GOSISDBHSA-N 376.481 5.396 30 20 GKED CC[C@H](C#N)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 593481396 GRDUVTGHESXUCE-OAHLLOKOSA-N 378.451 5.220 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1cc(OC)c(C#N)cc1F 599813929 AVCRTPJMFIFCOD-UHFFFAOYSA-N 385.439 5.055 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c1 603727559 XGAZDEDLOZYEEM-UHFFFAOYSA-N 388.279 5.435 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc2ccccc2n1CC#N 609162909 XOVBFGVPINXSIU-AWEZNQCLSA-N 385.389 5.017 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609499700 XJJSEFWZIQGOTH-UHFFFAOYSA-N 391.858 5.061 30 20 GKED COc1ccc(-c2nnc(S[C@@H](C#N)C3CCCCC3)n2CC(C)C)cc1 609648549 HWBDVKUSRMYTJY-IBGZPJMESA-N 384.549 5.174 30 20 GKED N#CCN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)C1CCCC1 610175589 LOIISXGYSBXYSQ-UHFFFAOYSA-N 389.282 5.694 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1cccc(Sc2ccccc2)c1 610767133 ZQMUAANKBMRGET-UHFFFAOYSA-N 388.496 5.181 30 20 GKED COc1ccc(CN2CCCC[C@H]2c2ccccc2OC)cc1OCCCC#N 611268969 XIOCBORBCVPGBU-NRFANRHFSA-N 394.515 5.114 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3ccc(C(F)F)cc3)cn2)c1 613199004 GWAPCNHXRHGIAE-UHFFFAOYSA-N 394.381 5.005 30 20 GKED CSC[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 618805291 NKQWCNZZTIPBDO-MOPGFXCFSA-N 376.447 5.258 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2Cc2ccccc2)cc1Cl 619786132 JKOBVLSOWHQUHO-UHFFFAOYSA-N 375.859 5.124 30 20 GKED C=CCN(C(=O)c1cc2ccc(F)cc2s1)c1nc(-c2ccccc2)cs1 620655519 FNRLRCCXMAGZNV-UHFFFAOYSA-N 394.496 5.997 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2sc3cccc(Cl)c3c2Cl)nc(C)n1 642282564 GHGSIPUTEPXGBU-JTQLQIEISA-N 376.268 5.105 30 20 GKED COc1ccc2c(c1F)CC[C@H]2NC(CCC(F)(F)F)CCC(F)(F)F 658252983 HEHAOLDUHSPPFL-CYBMUJFWSA-N 387.339 5.465 30 20 GKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 669727599 GMQIQPWLYAYNOJ-BETUJISGSA-N 380.332 5.010 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2c(cnn2C(C)C)c1 672664952 WCBPNVSNZCFGIY-UHFFFAOYSA-N 394.523 5.005 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Cl)c(N2CCCC2=O)c1 682803851 UMKLCYHZAWIAQN-UHFFFAOYSA-N 396.918 5.571 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCc3ccccn3)c(Cl)c2)c1 726483832 VTFSJAMASDBPMF-UHFFFAOYSA-N 393.899 5.104 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 727953878 IAECSIIJROKXEB-WBMJQRKESA-N 389.282 5.007 30 20 GKED C#CCCOc1ccc(CN[C@H](c2ccc(C)cc2)c2ccc(OC)cc2)cc1 733326060 GSWGHYYCXJNFET-AREMUKBSSA-N 385.507 5.285 30 20 GKED Cc1oc(-c2ccccc2)nc1CSCc1cc(Cl)ccc1OCC#N 735317581 CRTBNZXEOAEOQY-UHFFFAOYSA-N 384.888 5.639 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2coc(-c3ccccc3)n2)cc1 737501603 DBNFSQPJVHNZJX-NRFANRHFSA-N 379.419 5.249 30 20 GKED C=CCn1c(Cc2ccccc2)nn(CN2[C@H]3CC[C@H]2c2ccccc23)c1=S 739875387 DHRBQAXRISGCIE-SFTDATJTSA-N 388.540 5.040 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)[nH]2)CCc2nc(-c3ccccc3)sc21 742432726 GBQZNGCGSARGND-GHRIWEEISA-N 383.476 5.413 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(Cl)c1 744061352 KDZFAEZNVVDVQL-UGSOOPFHSA-N 391.883 5.315 30 20 GKED CC/C(=C/C(=O)NCc1cccc(O[C@H](C#N)CC)c1)c1cccc(Cl)c1 744512389 DJKWWYIQWUXWSR-QUHSPFQSSA-N 382.891 5.131 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1F)C1CCCCC1)c1ccncc1 745828654 VOFYHWOMFJXBEE-QFIPXVFZSA-N 381.495 5.382 30 20 GKED CC(C)N(C(=S)Nc1ccc(SC(F)F)cc1)c1cccc(C#N)c1 749767061 HRUNPRVEBKVVOB-UHFFFAOYSA-N 377.485 5.485 30 20 GKED CCOc1c(OC)cc(/C=C2/CSc3ccc(Cl)cc3C2=O)cc1OC 750905609 OOWHLSXPFMFXFT-QPEQYQDCSA-N 390.888 5.128 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3c(C)noc3C)n2)cc1 754531326 JRBGOLCZCKTFPP-SUMWQHHRSA-N 379.485 5.093 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1csc(COc2ccccc2)n1 754712195 FVHJRVVGPKHZQH-UHFFFAOYSA-N 378.375 5.154 30 20 GKED COc1ccc(-c2nc(C=NOc3ccccc3C(F)(F)F)cs2)cc1 754724627 MOFKDUWDVRDGBV-UHFFFAOYSA-N 378.375 5.250 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCCc3c(Cl)cccc32)ccc1OC 756705156 KJHBCJWHGLBTPF-OXJNMPFZSA-N 384.907 5.197 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 758906935 FSGWPUDAWNUENV-PXNSSMCTSA-N 379.500 5.042 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12 759213480 BMYHWSDLADTBHH-IZLCOFNUSA-N 388.854 5.244 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 761513026 WZLLTLZKYVVTRP-UHFFFAOYSA-N 381.863 5.016 30 20 GKED CC(C)(C#N)CCCCOC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1 768458590 WIBMOWINXGJBQB-QFIPXVFZSA-N 389.499 5.257 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cccc(OC(F)(F)F)c2)c1 772984833 QZQIIAZSAVGOSV-WMLDXEAASA-N 378.394 5.117 30 20 GKED COc1cc(C(=O)/C=C/c2nc3c(s2)CCCC3)ccc1SC(F)F 776263167 BMKJUKVXIMYEEH-VQHVLOKHSA-N 381.469 5.241 30 20 GKED N#CCc1ccccc1CC(=O)Nc1nc(-c2ccccc2)c(-c2ccccc2)o1 777045019 RNCDKYOEJMHDHS-UHFFFAOYSA-N 393.446 5.256 30 20 GKED C#CC[C@H](N[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)c2ccccc21)c1ccccc1 780732153 LKQDRSGZRCZNMB-BHDDXSALSA-N 376.500 5.051 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cccc(-c2ncc(C)o2)c1 782774034 QPJBTRBHRMPWRA-UHFFFAOYSA-N 377.444 5.192 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2cccc(C(F)F)c2)cc1 790767560 NGHKOKLYTGDPAF-LIRRHRJNSA-N 384.426 5.028 30 20 GKED COc1cc(/C=C/C(=O)c2cccs2)c([N+](=O)[O-])cc1OCc1ccccc1 796974066 MVOVBMZJOBBXCU-MDZDMXLPSA-N 395.436 5.140 30 20 GKED C[C@@H](NC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 797006977 ZBBGZPAUZOODLR-OPAMFIHVSA-N 384.907 5.061 30 20 GKED c1ccc(CSc2cccc(CON=C3CCC4(CC3)OCCO4)c2)cc1 808251176 DXNYAXVLQRQTFM-UHFFFAOYSA-N 383.513 5.169 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813217365 KUGKEPHQSUGDQN-PBHICJAKSA-N 390.405 5.176 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCC[C@@H]1CC1(Cl)Cl 844533420 ABMIRVRDKJEYDT-QWHCGFSZSA-N 386.348 5.034 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC(F)(F)F)cc2)cc1 915086181 IBYVXJPTDKHTGU-FQEVSTJZSA-N 396.368 5.493 30 20 GKED CCCCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1OC 916627161 BJVPGTAORXXWAM-QGZVFWFLSA-N 391.471 5.021 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2ccc(Cl)c(Cl)c2)SC1=S 917644977 PMLMHXJNVCISNN-OVCLIPMQSA-N 391.304 5.271 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1c(C)cccc1C(=O)N1CCCC1 918540936 BRRUGDOFNHBLJD-UHFFFAOYSA-N 387.568 5.445 30 20 GKED COc1cc(C=NOCc2csc(-c3cccs3)n2)cc(Cl)c1OC 920399245 OMOMAPXBDDOJFQ-UHFFFAOYSA-N 394.905 5.093 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)c(O)n1 1569091140 IXLXXRFXPPSGDY-UHFFFAOYSA-N 389.480 5.186 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc3cc(Cl)ccc23)cc1CC(=O)O 1776133280 RTZJDYXQVCXYFF-UITAMQMPSA-N 380.827 5.025 30 20 GKED CC(C)(C)Oc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776264903 WDAOHOQZMUMMDD-UXBLZVDNSA-N 380.465 5.673 30 20 GKED C[C@@H]1C/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2sccc21 1776589567 MOLYTQRFESYMPX-QJMZJAKPSA-N 380.490 5.948 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc(Cl)cc2)o1 1776783113 YPOLMSYMHOJRFG-SFHVURJKSA-N 377.912 5.893 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(C(F)(F)F)ccc1Cl 1776784164 VQENOSNIVCISIW-OAHLLOKOSA-N 379.850 5.652 30 20 GKED CCCCCCOc1cccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)c1 1776790294 LDJWNZAFJGGIOU-MTPVXSITSA-N 378.468 5.484 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cnn(CC4CCC4)c3)s2)cc1 1777671086 AJQZRVNWEIFRGU-CSKARUKUSA-N 392.480 5.006 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 1777686081 GYPTVSZZAPCUNB-VMPITWQZSA-N 397.770 5.103 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(F)c(F)c2)cc(Br)c1OC 15349027 MZQYOTGRVAAVMA-QPJJXVBHSA-N 397.215 5.031 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)CSC2=Nc3ccccc3CS2)c1 21627373 AEXFXESHTRLHFE-UHFFFAOYSA-N 395.553 5.218 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CCn3ccc4ccccc43)c2)c1 32289295 BKSMDAZVZMAQNI-UHFFFAOYSA-N 395.462 5.121 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 41557220 SEKKAXSFRKRQNM-ZBFHGGJFSA-N 397.425 5.200 30 20 GKED COc1cc(C(=O)/C=C/c2csc(Br)c2)ccc1OC(F)F 43735079 SIQUSRJAXROCKF-DUXPYHPUSA-N 389.217 5.017 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nn1C(C)(C)C 51157181 RMUSWWBLIIJMIY-OAHLLOKOSA-N 398.919 5.214 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc3ccccc3c3cccnc23)c1 55570306 HTDOIMCPMLIQNJ-UHFFFAOYSA-N 381.435 5.323 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cccc(Br)c1 97546128 GYZFBYSTBHAGQF-VOTSOKGWSA-N 376.300 5.530 30 20 GKED C[C@H](S[C@@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1C(F)(F)F 118445081 IIKXHYZAKKATNK-STQMWFEESA-N 378.419 5.398 30 20 GKED C=CCN(CC=C)Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 133097613 GMCJPFTUJKJXSH-UHFFFAOYSA-N 389.952 5.272 30 20 GKED COc1cc(C(=O)/C=C\c2csc(-c3ccsc3)n2)ccc1OC(F)F 141460709 VBTHYBPHWZLHCK-ARJAWSKDSA-N 393.436 5.378 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 160674238 HEODDMMPPAVMCR-OAHLLOKOSA-N 384.549 5.601 30 20 GKED CCc1ccccc1N(C(C)=O)c1nc(CN(CCC#N)CC(C)(C)C)cs1 166000698 YDJCLSQYOPRJKL-UHFFFAOYSA-N 398.576 5.152 30 20 GKED Cc1c(NC(=O)N(CCC#N)CCC(C)C)cccc1C(=O)Nc1ccccc1 176941781 YTMLQQPSBZMPIA-UHFFFAOYSA-N 392.503 5.041 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@H](C#N)c3nc(C(C)C)cs3)cs2)c1 177772501 VTXZEOHVALNWSM-INIZCTEOSA-N 381.526 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(-c2noc(C3CC3)n2)c1 189895193 BHYRRYAKFRXXHZ-UHFFFAOYSA-N 387.483 5.718 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C/C=C\c1ccc(F)cc1 255893855 HVXKJYMUAHSTQV-RQOWECAXSA-N 387.414 5.235 30 20 GKED O/C(=N/[C@@H]1CC12CCCCC2)[C@H]1CC[C@H](/C(O)=N\[C@@H]2CC23CCCCC3)CC1 329256545 AXWDVPLQXMMOSU-UAFMIMERSA-N 386.580 6.151 30 20 GKED Cc1ccc2nc(C3CC3)cc(/C(O)=N/[C@H]3CCc4cnn(C(C)C)c4C3)c2c1 330175489 ZSZLQWSIBXREPD-SFHVURJKSA-N 388.515 5.060 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 410198958 GTKFTJWGYGYYCN-LJQANCHMSA-N 395.915 5.687 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccc(-c2ccncc2)c(C)c1 427432730 XIVAKBBONCIEJI-UHFFFAOYSA-N 389.524 5.386 30 20 GKED Cc1sc(NC(=O)c2cnn(CC(C)C)c2-c2ccccc2)c(C#N)c1C 428328403 YJHKHBYYOLXXPH-UHFFFAOYSA-N 378.501 5.008 30 20 GKED Cc1cccnc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 429352472 WUNGFQDMKCBRJO-ZDUSSCGKSA-N 388.279 5.310 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H]1[C@@H](c2ccccc2)[C@H]1C 430392852 KIEGSKZSYUNHFV-NPFVIJTESA-N 383.451 5.042 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1)c1ccccc1 431330219 FZBFXYNFCJDDDV-NNWRFLSQSA-N 379.479 5.196 30 20 GKED CC[C@@H](Nc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437493057 JZUPBTILACRFBZ-HXUWFJFHSA-N 389.430 5.319 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)c1ccc(C#N)cc1 439931786 ZVCYCDZTWBLZJJ-UHFFFAOYSA-N 388.279 5.265 30 20 GKED Cc1sc(Br)c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1C 442546894 OSMQZLNKTUUQNL-SNVBAGLBSA-N 397.363 5.372 30 20 GKED N#Cc1nc(Oc2cccc(C(=O)Nc3ccccc3)c2)ccc1C(F)(F)F 443510681 QURHAXLGIHMFKF-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCN(C(=O)[C@@H]1CCCS1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 443850343 GDRDMFSBBPLBAM-HNNXBMFYSA-N 399.368 5.532 30 20 GKED CCC(=O)c1ccc(OCCCCC(=O)Nc2ccc(CC#N)cc2Cl)cc1 452647105 GMBTZRYHOJMWOX-UHFFFAOYSA-N 398.890 5.187 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1cccc(C)c1C 453462607 IIFOXIUKAZQUHH-NHCUHLMSSA-N 380.536 5.054 30 20 GKED CC(F)(F)CCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 454486976 OWVNIGBGMPKNBY-MRXNPFEDSA-N 377.822 5.162 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1ccccc1OC1CCCC1)c1ccccc1 457830125 UJGFEAHRQIGUQY-JOCHJYFZSA-N 376.500 5.102 30 20 GKED N#CCCCn1cc(C(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)c2ccccc21 469553563 FCBRZBMJYLGZOC-MAUKXSAKSA-N 391.437 5.044 30 20 GKED CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N 469701175 DNHDZNYFEMFXIS-ICSRJNTNSA-N 395.572 5.813 30 20 GKED COc1cc(C#N)cc(Br)c1OCc1csc(C2CCCC2)n1 479966787 YAFDMXFZCDZKNH-UHFFFAOYSA-N 393.306 5.022 30 20 GKED C=C(C)[C@@H](NC1CCC2(CC1)C(=O)Nc1ccccc12)c1ccc(F)c(F)c1 480663837 CIUUELAPXKUHLN-FCRSDJTPSA-N 382.454 5.004 30 20 GKED C=C(C)[C@H](N[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)c(F)c1 481627016 MVOBXFVVLSIISZ-IERDGZPVSA-N 386.486 5.631 30 20 GKED C=CCN(CCOC)C(=O)c1oc2ccccc2c1CSc1cccs1 482358201 DDDUSMMWUBURDK-UHFFFAOYSA-N 387.526 5.061 30 20 GKED Cc1sc(NC(=O)c2cc(F)c(Br)cc2Cl)c(C#N)c1C 483072507 RVXLHEJJOHQPBW-UHFFFAOYSA-N 387.661 5.044 30 20 GKED CCn1c(CSc2nc(C)cc(C(F)(F)F)c2C#N)nc2c(F)cccc21 483175775 FBDHPFKDMQIFFC-UHFFFAOYSA-N 394.397 5.082 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl)c1c[nH]c2ccccc12 486436357 SXDDPTJFAFMPQY-SGTLLEGYSA-N 386.282 5.349 30 20 GKED Cc1ccc(-c2nc(CSc3nc(C(F)(F)F)ccc3C#N)co2)cc1 488790906 XVLBQHNBNGYDOI-UHFFFAOYSA-N 375.375 5.228 30 20 GKED CCOc1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1Cl 491976476 HYQXHZLXYGRRCP-HNNXBMFYSA-N 397.887 5.056 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1oc2ccccc2c1COc1ccccc1 496878719 ACCPSSBFNHTMCU-UHFFFAOYSA-N 396.446 5.156 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1)c1c(Cl)cccc1Cl 499845116 MCFBALSGBKXMHX-WWGRRREGSA-N 379.674 5.131 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 500084277 PTASVMRDAQVJHJ-ICSRJNTNSA-N 395.478 5.307 30 20 GKED CCCN(C(=O)[C@@H](C)Oc1ccc(C#N)cc1)[C@@H](C)c1cc2ccccc2o1 501624062 CQEIHEKVNFDERL-DLBZAZTESA-N 376.456 5.072 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccccc2)CCCC1 506839377 NRWFMPDEZAEMJV-QGZVFWFLSA-N 379.529 5.529 30 20 GKED Cc1oc(C(C)C)cc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 511889488 LHIRRIURYDOPRQ-UHFFFAOYSA-N 396.434 5.988 30 20 GKED N#Cc1ccc(NC(=O)N[C@H]2CCSc3ccc(Cl)cc32)cc1Cl 520786442 MJTZWCBMFZNHBD-HNNXBMFYSA-N 378.284 5.224 30 20 GKED N#C[C@@H](NC(=O)c1ccc(F)cc1Cl)c1ccc(OCc2ccccc2)cc1 524109835 ZANRKRJBARAGJD-OAQYLSRUSA-N 394.833 5.053 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)Nc1ccc(CC#N)cc1 524594016 BCIIRDSVVYMGJJ-LJQANCHMSA-N 385.895 5.324 30 20 GKED COc1ccc(NC(=O)[C@@H](Sc2ccc(C#N)cc2F)c2ccccc2)cc1 524987736 FNMCXJYKBYWTGL-NRFANRHFSA-N 392.455 5.178 30 20 GKED CCCc1ncc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 525136718 BEXHBQYOVZOIJS-UHFFFAOYSA-N 399.463 5.372 30 20 GKED N#CC1CCN(C(=O)Nc2ccc3nc(-c4cccc(Cl)c4)sc3c2)CC1 527306775 GWVYTKCXQZWLRT-UHFFFAOYSA-N 396.903 5.384 30 20 GKED CCC(CC)n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C 535312628 DFSVTSXVSWJVJO-GOSISDBHSA-N 392.528 5.475 30 20 GKED N#Cc1c(NC(=O)CCN[C@@H](c2cccs2)C2CC2)sc2c1CCCCC2 537165535 KKYRFYGCCISVDD-HXUWFJFHSA-N 399.585 5.020 30 20 GKED N#Cc1cc(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)ccc1Cl 537546441 ROLXJGIHUJJLKD-UHFFFAOYSA-N 378.781 5.035 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 539506589 CGANBLIPBFXNOL-RDTXWAMCSA-N 383.289 5.891 30 20 GKED CCC(CC)n1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C 539582359 GTLRSEPKJWWCLS-GOSISDBHSA-N 392.528 5.475 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)o1)c1nc2cc(Cl)ccc2s1 541357858 ZCGMRFDYCMJSPR-AWEZNQCLSA-N 378.840 5.700 30 20 GKED N#Cc1cccc(Cc2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)c1 545701473 LDCYBYDRAGQZGH-UHFFFAOYSA-N 388.814 5.040 30 20 GKED C=C(C)[C@@H](NCc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccc(F)c(F)c1 555427860 PMPAODWBVQIGIE-QGZVFWFLSA-N 386.320 5.299 30 20 GKED COc1ccc([C@@H](CCC#N)NCc2cc(F)c(C(F)(F)F)cc2F)cc1 558255586 GFOLNZWAJACXQB-GOSISDBHSA-N 384.348 5.127 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F 558532472 FZRXRTMXXQZORP-LEWJYISDSA-N 388.417 5.173 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(Cl)c1OCC(F)F 561629905 HKWLLAVYKURBFZ-UHFFFAOYSA-N 383.847 5.514 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2c(ccn2CCC)c1 562170098 KMGFIRSTIQUZBR-UHFFFAOYSA-N 393.535 5.439 30 20 GKED COc1cc(CSCc2scnc2C)ccc1OCc1cccc(C#N)c1 582876697 BFNOMHCCRNFGQL-UHFFFAOYSA-N 396.537 5.344 30 20 GKED CC(C)C[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589363551 FXKLOZSHRPNDAF-LJQANCHMSA-N 378.476 5.178 30 20 GKED C=CCN(C(=O)[C@H]1CCCOC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 589897103 MFYINBXLTOUOOF-ZDUSSCGKSA-N 397.327 5.063 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 597074932 HEFYTTDCFMUQGT-LPHOPBHVSA-N 387.405 5.318 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(F)c(Cl)cc1Cl 603967852 BTBUXONTPNUNGM-UHFFFAOYSA-N 391.254 5.985 30 20 GKED N#Cc1ccc(CNC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)cc1 609261078 LGNPTOUPVPNAGB-NRFANRHFSA-N 392.911 5.361 30 20 GKED CCn1c(S[C@H](C)c2ccc(C#N)cc2)nc2cc3ccccc3cc2c1=O 609813849 YTDDDFHVVVUXDH-OAHLLOKOSA-N 385.492 5.295 30 20 GKED COc1cc(C#N)ccc1OCCSCc1csc(-c2ccsc2)n1 610137226 IQULERAJIMKLIM-UHFFFAOYSA-N 388.539 5.064 30 20 GKED CC(C)N(C(=O)c1cc2ccccc2n1CC#N)c1cccc(C(F)(F)F)c1 610795224 HCIAWZWRUKCASX-UHFFFAOYSA-N 385.389 5.239 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1 619425942 JJMPGEYGIZJHIL-UHFFFAOYSA-N 378.419 5.394 30 20 GKED O=C(Nc1cccc(CCC(F)(F)F)c1)N1CCC2(CC1)C(F)(F)C2(F)F 650072592 FHJYDRGKLKHLHA-UHFFFAOYSA-N 398.322 5.080 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2)C2CCCCC2)cc1Cl 726468806 HXIWBFZQAXULEQ-UHFFFAOYSA-N 383.948 5.743 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccccc2F)cc1 726858704 SRBQGYHWEUDZDM-TWOQFEAHSA-N 380.463 5.180 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1Cl 728812822 CQAUYAYKVBKOTQ-FQEVSTJZSA-N 388.898 5.912 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2cc3ccccc3n2CC#N)c1 729656137 PGDJRIGSBGLZTJ-UHFFFAOYSA-N 395.487 5.055 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)s1 729937047 LACFLKLESBUPNC-TWGQIWQCSA-N 382.437 5.131 30 20 GKED CC(C)COc1ccccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 731409965 AYZPTNJQWLEBDP-HNNXBMFYSA-N 384.888 5.475 30 20 GKED C=CCOc1ccc(C(=O)c2ccccc2)c(OCc2ncc(C(C)C)o2)c1 733208046 XKRPZGGZDLSTIC-UHFFFAOYSA-N 377.440 5.173 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccc(OCC(F)(F)F)cc3)c2c1 734307390 OKAQZGCIKSLTMJ-RUDMXATFSA-N 375.346 5.014 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cc4cc(F)ccc4o3)c2)s1 739596172 TWQHOEYVXMIYGG-UHFFFAOYSA-N 376.412 5.102 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](CC2CC2)c2ccccc2)cc1 743097998 ZCXVPWVYUPIDHC-RPBOFIJWSA-N 395.506 6.005 30 20 GKED Cc1ccc(-c2noc([C@@H](C)ON=Cc3ccccc3C(F)(F)F)n2)cc1F 744442254 AXROHRDSUKYXLE-GFCCVEGCSA-N 393.340 5.315 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCOCc2ccccc2)cc1 747637678 QNSDNMUTLNGJOJ-XMMPIXPASA-N 384.479 5.278 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccccc3O)cc2Cl)cc1 748446727 IAKQNOGWXMZJTD-UHFFFAOYSA-N 393.830 5.031 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Cl)s2)ccc1OCC(F)(F)F 750896066 MTDLYKSUGCXHRB-DUXPYHPUSA-N 376.783 5.247 30 20 GKED C=CC[C@@H](NC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1)c1ccncc1 754921933 UBCDROQSVNBVFZ-MHECFPHRSA-N 385.511 5.787 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3c[nH]nc3-c3ccccc3F)c2)s1 756127248 JROFMKDQZJVIKF-UHFFFAOYSA-N 388.471 5.106 30 20 GKED COc1cccc(C2(NC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)c1 758535405 LZEWNSAAKBAQAL-HSZRJFAPSA-N 397.478 5.161 30 20 GKED C#CCCCCNC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 758887745 FXBJFAWIZYSGCK-LJQANCHMSA-N 379.504 5.115 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2cccc(NC(=O)C3CCC3)c2)cc1 764760381 IMWKJKKYCLUYIG-KRWDZBQOSA-N 398.934 5.407 30 20 GKED CCCCC[C@@H]1NC(=O)N(c2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1=O 771819502 PSMQQUJAEGMRHR-QUCCMNQESA-N 395.890 5.001 30 20 GKED Cc1nc(-c2ccc([C@H](C)N[C@H](C)c3ccc(OCC#N)cc3)cc2)cs1 776153660 CAGKOTGUQBWTBK-JKSUJKDBSA-N 377.513 5.433 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@H]2NCc1ccc(C#N)cc1F 778218161 PVCUTJDIAFWNNL-OAQYLSRUSA-N 395.478 5.212 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3sccc3Cl)SC2=S)cc1Cl 779205627 ZTENCFFYHYYFLJ-MLPAPPSSSA-N 397.333 5.332 30 20 GKED O=C(/C=C\c1cccc2cnccc12)c1ccc(OC[C@H]2CCCCO2)c(F)c1 782889173 DRUXOGALGAOCND-YHAGJJCESA-N 391.442 5.218 30 20 GKED N#C[C@@H](C(=O)CCCCC(=O)c1ccccc1)c1nc(-c2ccccc2)cs1 783356619 DZFDOSREDARLBT-IBGZPJMESA-N 388.492 5.430 30 20 GKED C/C(=C/C(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc([N+](=O)[O-])cc1 783975964 XRFBNCZFIOYYRL-SEWDUPMJSA-N 381.457 5.031 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc(F)c(Cl)c2)c(-c2ccccc2)n1 788347514 BKKXKYNLWJTATR-CSKARUKUSA-N 379.822 5.152 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C 789720224 VNFDEMAKXPZCES-LPHOPBHVSA-N 386.536 5.123 30 20 GKED C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797573730 VKQBGDMFMYHHOJ-SWLSCSKDSA-N 388.920 5.179 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccccc2C)C2CCCC2)ccc1OC 813860256 PSPYUGLMONLEOJ-OFVILXPXSA-N 392.543 5.706 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cc(Br)c2ccccc2c1 816016652 WOABXEAUKCOMLP-ZDUSSCGKSA-N 395.256 5.145 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)N(O)Cc1ccc(F)cc1 901372592 INRODONWNFBYMU-UHFFFAOYSA-N 381.403 5.048 30 20 GKED C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)c1nc(-c2ccccc2Cl)no1 904566412 CZQYPUZTVNOPSO-CYBMUJFWSA-N 384.263 5.098 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1sccc1Br 915113966 YWTMWARCPJBHPB-AATRIKPKSA-N 394.290 5.669 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3nc4ccccc4n3C)c2cc1C(C)C 916650336 FFNRKQXRLCQZFX-IBGZPJMESA-N 385.467 5.170 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cn3c(C)cc4ccccc43)n2)cc1 916975008 URVBPFMIEPWUQC-LJQANCHMSA-N 385.492 5.258 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(OC(C)C)c3)n2)cc1 921131472 JUDHMUXKHYSJKD-HXUWFJFHSA-N 390.508 5.325 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(O)c(C(=O)O)c2)cc1 1776125502 KEUKNNVENABIEH-SDSFWRRZSA-N 396.483 5.582 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2OC)cc1 1776782745 DKGVVXYXCPECBW-OAQYLSRUSA-N 383.532 5.656 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1sc2c(Cl)cccc2c1C 1776786871 XIJSOSPDRRAMLG-HNNXBMFYSA-N 381.969 6.157 30 20 GKED CCCCCCCOc1cccc(CNc2ccc([C@H](C)CC(=O)O)cc2)c1 1776787437 MWOAODNSYIQXEE-LJQANCHMSA-N 383.532 6.226 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCC[C@@H]2C(C)(C)C(=O)O)cc1 1776787507 IIEUWPHSDLWDQY-LJQANCHMSA-N 391.577 5.465 30 20 GKED CCc1ccc(-c2ccc(/C=C\C(=O)c3cccc(O[C@H](C)C(=O)O)c3)o2)cc1 1776964247 YMRKTDAEVCTXFS-DVFVSVACSA-N 390.435 5.257 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791254576 TYBUITANKAUNHN-ZRNYENFQSA-N 394.559 5.159 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1ccc(-c2ccccc2Cl)s1 22841531 SHEAEAIPXZYMLR-BOPFTXTBSA-N 388.945 5.571 30 20 GKED N#C[C@H](C(=O)CCCCc1nc2ccccc2s1)c1nc2ccccc2o1 41544326 DZHNJOUGACWNRP-CQSZACIVSA-N 375.453 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(N2CCCC2)cc1 66955510 JQUNWVGNVABVGR-QGZVFWFLSA-N 394.544 5.003 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(NC(=O)CCC)c1C 67585264 YZIWKPPRNPUIDE-UHFFFAOYSA-N 383.467 5.093 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2cccnc2)cc1)c1cccc(Cl)c1Cl 78718761 IYHKWJUZZXZZMF-GOSISDBHSA-N 398.249 5.175 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Sc3nc4c(cc3C#N)CCCC4)o2)cc1 121903850 YBWHIAQMIDATQL-AWEZNQCLSA-N 376.485 5.044 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1nc(-c2ccc(Cl)cc2)no1 123473951 HXBNNDGUUZASCP-CQSZACIVSA-N 382.851 5.246 30 20 GKED CC(C)c1cc(Br)ccc1OCc1nnc(-c2ccc(C#N)cc2)o1 133882429 PEXWUSCDHLTPBL-UHFFFAOYSA-N 398.260 5.073 30 20 GKED CCN(C(=O)CNc1ccccc1SC[C@@H](C)C#N)[C@@H](C)c1ccc(F)cc1 153930521 YNFWELNSTHUMRX-IRXDYDNUSA-N 399.535 5.099 30 20 GKED CC(=O)c1csc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 158766148 DNVOGWUAAMDJTE-CQSZACIVSA-N 386.885 5.218 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCc1cc2ccccc2o1 159275269 FUDKNJNHAODHHO-HNNXBMFYSA-N 379.485 5.049 30 20 GKED Cc1cnc([C@@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C2CC2)s1 174544880 OOMZDTFDGNJMII-QFIPXVFZSA-N 389.524 5.143 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)n1 181489228 BYFQYZCJNCVOQV-NSHDSACASA-N 392.267 5.212 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](c2ccsc2)O[C@H](C)C1 191420971 CCPWBLIASSCGCK-OXQOHEQNSA-N 384.545 5.594 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(F)cc2F)cc(Br)c1OC 211155718 BSPTVAGJOUFLKP-DAXSKMNVSA-N 397.215 5.031 30 20 GKED COc1cccc(Oc2ccc(NC(=O)CSc3ccc(C#N)cc3)cc2)c1 303157703 GMMRFXDNEUJYIE-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C)nc2)c1)[C@@H](C)c1ccc(C#N)cc1 303516897 DKIOVUKPSZCRHH-IBGZPJMESA-N 399.494 5.064 30 20 GKED N#Cc1c(N=C(O)CCN2CC=C(C(F)(F)F)CC2)sc2c1CCCCC2 328853862 JJMHTXWYOZQHDO-UHFFFAOYSA-N 397.466 5.061 30 20 GKED CC(C)Cn1ncc(/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1C1CC1 329315686 HHROKVNBDFZIAY-FQEVSTJZSA-N 395.551 5.110 30 20 GKED CC(=O)Nc1ccc(N=C(O)N(C)[C@H](C)C2CCCCC2)c(C(F)(F)F)c1 330450969 YCZWLCYPQSABGP-GFCCVEGCSA-N 385.430 5.110 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)c1 410292001 ZYITYVXQWUKKLI-INIZCTEOSA-N 394.858 5.114 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@H]1CCC[C@H](F)C1 424799366 JNJFUOABPATARQ-FPMFFAJLSA-N 385.323 5.343 30 20 GKED N#Cc1ccnc(NC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)c1 435999091 HRHXHYBDQBHONB-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2csc(-c3ccccc3)n2)cc1 437239655 XSLDUZVXGQGBHK-UHFFFAOYSA-N 389.524 5.236 30 20 GKED N#Cc1csc(C(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)F)c1 437691403 GHYJLYXERFSITC-UHFFFAOYSA-N 392.374 5.248 30 20 GKED CCCc1c(NC(=O)Cc2cccc3ccccc23)cnn1-c1cccc(C#N)c1 440082570 VSXXQJRJHKCAJC-UHFFFAOYSA-N 394.478 5.031 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 444825166 KQAKMCMFXREUCQ-OAQYLSRUSA-N 391.515 5.232 30 20 GKED CC[C@@H](NCc1nc(-c2ccc(Cl)cc2)c(C)s1)c1ccc(C#N)cc1 447563237 PBSYKBGVSLLLLF-LJQANCHMSA-N 381.932 5.885 30 20 GKED CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458831178 GQMZOFRLFXXMJF-VXKWHMMOSA-N 381.495 5.599 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)cc2)c1 461097766 KTCJJMCGLNRFMW-UHFFFAOYSA-N 397.409 5.737 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@@H](C)c3cccc(C#N)c3)cc2)n1 462245523 OEDZAPSHJODKHD-AWEZNQCLSA-N 379.510 5.217 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccc(O)cc2C2(CC2)C1 463727915 KGXWPSHEKCPMMN-UHFFFAOYSA-N 376.500 5.323 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(O)c2ccccc2c1 471744834 FJMGSWOWSPAYFW-UHFFFAOYSA-N 395.418 5.165 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1 475567198 CHRQZCXIOIUNCF-JTHBVZDNSA-N 377.532 5.105 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1)c1ccc(C#N)cc1 477818195 QZPCRKDYYWEBTK-HNNXBMFYSA-N 399.416 5.137 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2)[nH]1)c1nc2cc(Cl)ccc2s1 477882099 RREUJLPSTDGTSC-CQSZACIVSA-N 377.856 5.435 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(F)c(F)cc(F)c2F)cc1 481154840 NFDMUPDRSZIYNO-UHFFFAOYSA-N 386.304 5.159 30 20 GKED Cc1c([C@@H](C)NC(=O)CCCCOc2cccc(C#N)c2)oc2ccccc12 481670965 XESVDCDPNPZDKE-QGZVFWFLSA-N 376.456 5.039 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483244406 NSWLFDOTFCMZMZ-SFHVURJKSA-N 391.452 5.134 30 20 GKED N#C[C@H](C(=O)c1coc2cc(F)ccc12)c1nc(-c2ccc(Cl)cc2)cs1 483461754 OGAFIQQFEUHDGC-OAHLLOKOSA-N 396.830 5.839 30 20 GKED CCC[C@@H](NC(=O)CSc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 483671226 SNRAKGNWOVZGIG-GOSISDBHSA-N 392.446 5.327 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)CCCCOc3cccc(C#N)c3)cc2s1 484684778 ZWVYYLIQGLZXSJ-UHFFFAOYSA-N 399.903 5.318 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cccc2c1C[C@H](C)N(C(=O)[C@H](C)CC(=C)C)C2 486110653 NUKILSSINGZKPH-OTWHNJEPSA-N 382.548 5.103 30 20 GKED Cc1c(C(=O)Nc2ccc(CC#N)cc2)oc2c(C)cc(Br)cc12 487737061 HRYLCZWEGIDRQL-UHFFFAOYSA-N 383.245 5.131 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 487866297 CAVYAVKSIBHMLQ-KRWDZBQOSA-N 395.465 5.001 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCc4ccccc4C3)cc2)cc1 499557416 OJUULLIBZPMCDC-UHFFFAOYSA-N 383.451 5.331 30 20 GKED N#CC1(CCCN[C@H](c2ccccc2)[C@H]2CCCc3ccccc32)CCOCC1 499611670 OXVPSDCEJGBFKT-LOSJGSFVSA-N 388.555 5.538 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H]2CCCC(F)(F)C2)cc1 500816832 PWXSKBXZSAJLAF-HNNXBMFYSA-N 386.398 5.123 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1/C=C\c1ccccc1 506641497 FKUFEBMLCUYDHZ-CFQPOLKNSA-N 391.540 5.791 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 509718211 XRRDZAMGAPFNNU-SKQHNDAPSA-N 399.494 5.326 30 20 GKED C[C@H](c1ccc(Br)cc1)c1noc(C[C@H](CC#N)c2ccccc2)n1 515182334 VDCGPSKKNKHYJL-PBHICJAKSA-N 396.288 5.224 30 20 GKED CCn1c(C)cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1C 521474936 IMDXPGLKDKTQJQ-NRFANRHFSA-N 391.902 5.686 30 20 GKED C=CCN(C(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1nc2c(s1)CCCC2 524824547 YMQNDHDILJJPFJ-STQMWFEESA-N 390.911 5.137 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3OCC3CC3)c2)cc1 524851569 PAVKHKGMNXYHRT-UHFFFAOYSA-N 384.435 5.392 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c(F)c1 531503262 XBXPBXGOZVBUSE-UHFFFAOYSA-N 391.402 5.365 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)c3ccc(C#N)cn3)c2)cc1 531847503 DYSXMFWFKNQELK-GOSISDBHSA-N 399.494 5.241 30 20 GKED C[C@H](NCc1ccc(C#N)cc1F)c1ccc(OCc2ccc(F)cc2)cc1 533309506 CDDWIOKAMKOXES-INIZCTEOSA-N 378.422 5.266 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)Nc2cc(SC)ccc2C)cc1 538345668 SBRDBFCAJTVMIP-UHFFFAOYSA-N 395.528 5.175 30 20 GKED CC[C@@H](NCC#Cc1ccc(C(F)(F)F)cc1)c1nc(C(F)(F)F)cs1 543492325 HKGGUTCOAKDPOW-CYBMUJFWSA-N 392.368 5.273 30 20 GKED C[C@H](NCc1ncc(Cl)cc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 543876183 SREDXRKMDIFCKD-AWEZNQCLSA-N 382.294 5.778 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@@H]1CCOC(C)(C)C1 554919431 JIHMDGLFKHCSFT-LJQANCHMSA-N 393.487 5.162 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(CSc2cccc(F)c2C#N)cs1 559629141 KERWYTMWFJBYOW-UHFFFAOYSA-N 397.500 5.439 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1[C@@H]1CCCO1)c1ccc(C(F)(F)F)cc1 560107456 QJHCZHFGDXOPGJ-FHWLQOOXSA-N 396.453 5.066 30 20 GKED CC(C)CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccoc1 560552028 JXEVPZVWRLFQIY-NRFANRHFSA-N 379.504 5.452 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 576426258 QFLBUFDUBAILKQ-UHFFFAOYSA-N 377.469 5.058 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cc1 580730943 WJLUPYIVCLCBTP-GCJKJVERSA-N 399.506 5.189 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)s1 582876905 ZZZZBXAIKZVACG-LJQANCHMSA-N 390.405 5.657 30 20 GKED CC(C)Sc1ccccc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 591862054 LCMQJSHXPGJYTC-AWEZNQCLSA-N 386.929 5.940 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)CSc1ccccc1 593157137 GFNLQNDZWYMZGI-IRXDYDNUSA-N 399.585 5.725 30 20 GKED CC[C@H](C#N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 593487494 QBBIPIIILDCGHX-OAHLLOKOSA-N 378.451 5.220 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccsc1Cl 596390632 IEWKDIZIDKLOMC-LBPRGKRZSA-N 396.990 5.668 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2CC1(c1ccccc1)C2 596734576 HGIDFWCTMDDFEW-YPHUNTSASA-N 377.513 5.234 30 20 GKED C=CCOc1ccccc1CNCc1cc(OC)c(OC)cc1-c1ccccc1 600809350 BZEJANZDIVSYIB-UHFFFAOYSA-N 389.495 5.225 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)o1 603765404 UESSDMRGQBRSJX-QRWLVFNGSA-N 387.439 5.033 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc3nc[nH]c3c2)c1 609730659 CXFJPHHNHGLEOJ-UHFFFAOYSA-N 388.814 5.133 30 20 GKED N#Cc1nnc2ccccc2c1Oc1ccc2cc(Br)ccc2c1 610128526 WCOPGINELUCNDX-UHFFFAOYSA-N 376.213 5.209 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(C(C)(C)C)on1 610225530 GQQWZYXFNWFPAO-UHFFFAOYSA-N 375.428 5.197 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccc(C#N)c1 610322166 KACLDHZTOSJSGO-INIZCTEOSA-N 382.423 5.105 30 20 GKED C[C@H](NCc1ccc(OCCN(C)C)cc1)c1ccc(-c2cccc(C#N)c2)cc1 611764584 HTODWYWVOBBFRV-FQEVSTJZSA-N 399.538 5.016 30 20 GKED COc1ccc([C@H](NCc2ccc(C(C)(C)C#N)cc2)c2ccc(F)cc2)cc1 614056099 HKOOZXBSPOWPSG-XMMPIXPASA-N 388.486 5.515 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nc2sccc2c1=O 642359688 JOACADKAUJXWOB-UHFFFAOYSA-N 399.928 5.138 30 20 GKED CCn1nc(C)c(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c1C 647229686 OCAPDFIWXWSCMF-UHFFFAOYSA-N 397.338 5.421 30 20 GKED Cc1c(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)sc2cc(F)ccc12 672460263 AFYLJCCFAYFQAJ-QWRGUYRKSA-N 399.331 5.162 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ncccc1C(F)(F)F 678359419 NUUSNNCTVDFZJI-UHFFFAOYSA-N 384.226 5.007 30 20 GKED C=CCCOCc1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 680767070 JDYLYZNOXIGBQC-UHFFFAOYSA-N 391.349 5.035 30 20 GKED CCOc1ccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 729160194 JNVWCUONWCKZGI-UHFFFAOYSA-N 389.480 5.558 30 20 GKED C#Cc1cccc(N(C(=O)CCc2nc3cc(Cl)ccc3s2)C(C)C)c1 730492729 BPDXFBZUQKXKGC-UHFFFAOYSA-N 382.916 5.305 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3cc(OC)c(OC)cc3C)cs2)c1 731318807 LBNZFTLFZVWYFL-CMDGGOBGSA-N 395.480 5.040 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2ncnc3sc4c(c23)CC[C@H](C)C4)c1 733793160 KSSQTEHIJAEVDX-HOCLYGCPSA-N 392.528 5.109 30 20 GKED Cc1ccc(OC(F)F)c([C@@H](C)OC(=O)CSCc2ccc(C#N)cc2)c1 734737173 IRLYLTQOICUERQ-CQSZACIVSA-N 391.439 5.006 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(C[S@](=O)C3CCCCC3)c2)c1 734986770 NDSQNQNZZIEHSD-MHZLTWQESA-N 396.581 5.058 30 20 GKED Cc1cccc(C)c1NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1 739438420 WOXYABKAXSTKFF-UHFFFAOYSA-N 377.538 5.390 30 20 GKED Cc1cccc(O[C@@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 743093052 KVYRDPXMFXRTQM-YADARESESA-N 399.494 5.240 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC2(CCCC2)C1 743123191 GTGIGGYRYCTAIP-UHFFFAOYSA-N 375.472 5.457 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)c2)cc1 743155384 KDFYDLHISDMROG-GOSISDBHSA-N 385.467 5.328 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)c2cnc([C@@H](C)OCC)s2)c1 744364399 YSSHIYOJMBWGFG-QGZVFWFLSA-N 390.508 5.069 30 20 GKED Cc1ccc(C=Nn2c(S)nnc2COc2cc(C)ccc2C(C)C)c(C)c1 744761735 PKJHYEAIJLOHNS-UHFFFAOYSA-N 394.544 5.077 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1c(F)cccc1F 746438608 YIJOZEDSWSNEFS-CYBMUJFWSA-N 384.222 5.444 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)ON=C(c1ccccc1)C(F)(F)F 751961582 FGNAJTIDTKPAAD-HNNXBMFYSA-N 392.421 5.429 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(CSc3ccc(C#N)cc3)n2)nc1 762389932 NIAPSZHTJCZTCX-UHFFFAOYSA-N 382.514 5.186 30 20 GKED C#CCOc1ccc([C@H](C)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 764930819 VSGDFWDIPLCJJF-PMACEKPBSA-N 398.506 5.363 30 20 GKED C=CCNc1ncc(C(=O)N(C)[C@H](C)c2sc(-c3ccccc3)nc2C)s1 771031817 HREDQTIJIKVHOA-CQSZACIVSA-N 398.557 5.006 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccccc2F)C2CCCC2)ccc1OC 774449706 QLHMNIQBEZMBGF-DVECYGJZSA-N 396.506 5.536 30 20 GKED C=CC[C@H](NCc1c(C(C)(C)C)nn(-c2ccccc2)c1Cl)c1ccncc1 776185734 KYLCSFHLDZNLTP-FQEVSTJZSA-N 394.950 5.625 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc([C@H]3CCCOC3)cc2)cc1 779836209 AFRIGVLMMXLKEI-UKILVPOCSA-N 396.490 5.488 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)Nc2ccccc2O[C@H](C)C#N)c1 780161716 ITOPFYAUKNHABE-QGZVFWFLSA-N 386.451 5.295 30 20 GKED N#C[C@@H](C(=O)CC1CCC(C(F)(F)F)CC1)c1nc2cc(F)ccc2s1 783379402 VQIOGTVFUAIOJD-XIVSLSHWSA-N 384.398 5.370 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ccc3c(Cl)cccc3n2)ccc1OC 785831142 WMBQSMAOPLOLBM-HNNXBMFYSA-N 381.863 5.190 30 20 GKED C=C(Cl)CNC(=O)C/C(=C\c1cccc(OC)c1)c1nc2ccccc2s1 787379383 AXYTZFWHSHBKEW-MHWRWJLKSA-N 398.915 5.104 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C23CC(c4ccccc4)(C2)C3)cc1 790292445 JFCOPRYEGCTKFB-XPWZEYHZSA-N 378.475 5.402 30 20 GKED N#CC[C@@H](CC(=O)OCc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 796672934 RJCVXUCWEXWAQS-QFIPXVFZSA-N 398.462 5.070 30 20 GKED CC(=NNc1ncnc2ccsc12)c1sc(-c2ccccc2F)nc1C 814879101 OEECBMSKPTWGNG-UHFFFAOYSA-N 383.477 5.098 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1ccncc1 815623416 XAIGRQONDVIQNJ-QGZVFWFLSA-N 386.373 5.408 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2ccc(F)cc2)CC1)c1ccccc1 838604457 SNBZEBZTBJBUBL-JOCHJYFZSA-N 379.479 5.150 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cccc(C(C)(C)C)c1 847624782 WXQWBWBMUDDOKO-FQEVSTJZSA-N 376.500 5.070 30 20 GKED C[C@@H](C#N)N(C(=O)c1ccc(CSc2nc3ccccc3s2)cc1)C1CC1 855583641 GCDYKZARPFVYAT-AWEZNQCLSA-N 393.537 5.105 30 20 GKED C=C1CCC(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)CC1 885653443 ODMILWBNKZNKLG-UHFFFAOYSA-N 398.528 5.234 30 20 GKED COc1cccc2cc(C(=O)/C=C/c3cc4cnn(C(C)C)c4nc3Cl)oc12 913617545 IVHPMAZFWYPFJJ-BQYQJAHWSA-N 395.846 5.317 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COc3cccc(C(C)C)c3)n2)cc1 916974741 OUDRQZLQGAOFFF-FQEVSTJZSA-N 390.508 5.497 30 20 GKED CC(C)c1cccc(N2C(=O)/C(=C\c3cccc(OCC#N)c3)SC2=S)c1 917645376 XQUKLJKYWDANCB-XDHOZWIPSA-N 394.521 5.118 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(-c3ccccc3C)c2)cc1CC(=O)O 1776131749 FAUICSOIIIRRAQ-BENRWUELSA-N 386.447 5.194 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1ccc(Cl)c(Cl)c1 1776179916 CPYHUBUBJYKKIZ-QGZVFWFLSA-N 384.690 5.461 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776950961 YLWAUZLBMHIUKD-IZZDOVSWSA-N 394.448 5.359 30 20 GKED COc1ccc(/C=C/C(=O)c2oc3ccccc3c2C)c2cc(C(=O)O)oc12 1777361510 DLYICIDHYOMUAD-VQHVLOKHSA-N 376.364 5.090 30 20 GKED C[C@@H](C#N)Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1Cc1ccccc1 4287583 PHXJCJNSDLMKPD-INIZCTEOSA-N 376.529 5.295 30 20 GKED C=CCn1c(SCc2c(C)noc2C)nnc1-c1ccc(C(C)(C)C)cc1 6148239 RPHJVXJKSSEYGI-UHFFFAOYSA-N 382.533 5.326 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccc(C(F)(F)F)cn1 41554695 HHYGVVSAOCFYBH-AWEZNQCLSA-N 390.361 5.458 30 20 GKED CC(=O)Nc1ccc(C)c(NCc2cccc(OCc3ccccc3C#N)c2)c1 155480939 UQBKRTKRFHEVES-UHFFFAOYSA-N 385.467 5.016 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2ccc(CC#N)cc2)C1 157093644 DHOIDAIKKRRSMK-IFXJQAMLSA-N 387.405 5.386 30 20 GKED C[C@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(C#N)cc1 172113135 VJNLGILBNSLDMV-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F 173122654 GIYAXNIXMOPBPS-GQIGUUNPSA-N 397.519 5.835 30 20 GKED Cc1nc(-c2cccnc2)sc1[C@@H](C)Nc1cccc(OCCCC#N)c1 179820928 SYVLSVGRPOPZIW-OAHLLOKOSA-N 378.501 5.369 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C1CCCC1)C(F)(F)F 184011861 BQHMYPCGLIOBKN-LRDDRELGSA-N 385.455 5.323 30 20 GKED C=CCC1(C(=O)Nc2c(Br)cc(F)cc2Br)CCC1 191948470 QMYMGVCJRUMOPC-UHFFFAOYSA-N 391.078 5.036 30 20 GKED CC(C)(CCC#N)COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 195074289 PKYRPZUXWXROGS-UHFFFAOYSA-N 382.407 5.316 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccc(N(C)CCC#N)cc1 237208209 JOKIPWXXTMAASB-QHCPKHFHSA-N 389.568 5.480 30 20 GKED COc1ccc(/C=C2\C(=O)c3ccsc3S[C@H]2C)cc1OCCCC#N 255896136 KYCVXVFJAGIKEQ-RERGGYADSA-N 385.510 5.200 30 20 GKED C[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1cccc(C#N)c1 301465706 XEMQYCYOIOAQCC-AWEZNQCLSA-N 376.847 5.032 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(/C(O)=N/[C@@H]1CCC(O)=NC12CCC2)C1CC1 328701227 NGAYXLJZIULWMZ-IIBYNOLFSA-N 391.515 5.321 30 20 GKED O/C(=N/[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ncoc1[C@H]1CCCO1 329087298 VFQUTDXSODJJRZ-FVQBIDKESA-N 394.393 5.186 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)/C(O)=N/[C@H]1CCOC2(CCCCC2)C1 330216840 IBFGVJDCTNTQAS-CVEARBPZSA-N 387.549 5.085 30 20 GKED C[C@H](NCc1ccc(C#N)s1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 421198037 IJLWWLDMVSPSJS-VIFPVBQESA-N 378.341 5.508 30 20 GKED COc1cc(Cl)ccc1[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 421836056 GKEWMLFKBIGKNZ-HNNXBMFYSA-N 397.906 5.105 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(COc3ccc(F)cc3)o2)s1 430600303 HHBAMZFJHMRCQK-INIZCTEOSA-N 398.459 5.242 30 20 GKED N#CCC[C@@H](NC(=O)NCC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 432113819 RQDBAUJBORTKLN-RTBURBONSA-N 389.421 5.067 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1Cl 432707512 XUHRDTCGTCCDHY-LJQANCHMSA-N 385.895 5.684 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCSC(C)(C)C1 435127300 BHVDHERGEOBOBF-UHFFFAOYSA-N 381.501 5.018 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2C[C@H]2c2ccc(Cl)c(F)c2)c2ccccc21 437371926 KPUFZWHKMWNZID-OXJNMPFZSA-N 395.865 5.023 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)CCC[C@@H]1C 437835589 GUSLZQFONDCYPM-AEFFLSMTSA-N 377.488 5.701 30 20 GKED N#CCC[C@H](NC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1ccccc1 439309877 LVFDBVXKMGXGGW-HNNXBMFYSA-N 381.785 5.525 30 20 GKED Cc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1-c1ncco1 444302436 QRWDOHWSTMMKJA-UHFFFAOYSA-N 384.439 5.161 30 20 GKED C[C@@H](CN(C)CCC(C#N)(c1ccccc1)c1ccccc1)c1nccs1 444690446 SPIXDVSQOYIRJA-IBGZPJMESA-N 375.541 5.078 30 20 GKED CC[C@@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 447596777 DGBUBDYVQFYUSZ-OAQYLSRUSA-N 379.479 5.779 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc3cc(Br)ccc3c2)n1 448330289 ZZVMLJRZZDBFEX-INIZCTEOSA-N 399.313 5.672 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N[C@H]3CC[C@@H](CC#N)C3)c(C)c2)c1 454750020 XTWKAVLUNZESJU-ICSRJNTNSA-N 377.488 5.086 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccc([N+](=O)[O-])s2)c1 460340545 UHWGXEUHCQNQOG-UHFFFAOYSA-N 397.843 5.028 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CC[C@H]2CCC[C@H]2C1 460563578 JNFWPZWZSXTJIS-ZIFCJYIRSA-N 376.525 5.408 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 463743912 IUGYKWOZFTUQJO-SGTLLEGYSA-N 379.262 5.082 30 20 GKED COCCCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464293958 HTUZNOVIRUMCJJ-UHFFFAOYSA-N 392.377 5.125 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)c2c1 464468191 MLVGKRRJRMSYRA-KRWDZBQOSA-N 395.384 5.325 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cncc(-c4ccc(Cl)cc4)c3)[nH]c12 467058975 KKSCKRFCHAIZEE-SFHVURJKSA-N 386.842 5.077 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cn(-c3ccccc3)nc2C(C)(C)C)n1 467850402 KPIPGIYWDSCVLE-MRXNPFEDSA-N 392.528 5.240 30 20 GKED C[C@@](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)(C1CC1)C(F)(F)F 471133401 LECKFTXJDSVUAG-GFCCVEGCSA-N 393.249 5.185 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@@H](CC#N)c1ccccc1 475391815 PTKCJFQXMKXLJI-LJQANCHMSA-N 388.433 5.530 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C 475640697 DPVPAIZFJXESFR-UHFFFAOYSA-N 379.869 5.147 30 20 GKED C=CC1CCN(C(=O)N[C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 477505282 YHTULRPAYNSPRA-CQSZACIVSA-N 389.952 5.441 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3cccc(F)c3)cc2F)c1 477820742 HOQFMTANXCLTPI-UHFFFAOYSA-N 379.366 5.059 30 20 GKED C=CCN1CCC(N[C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 482651451 YDECZCQPKBVTHM-AWEZNQCLSA-N 375.969 5.073 30 20 GKED Cc1ccccc1[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C(C)C 482997740 FDMWLARIPQYXAO-QHCPKHFHSA-N 385.467 5.181 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1nccc2ccccc12 483236568 OYJKAACLYIWLOC-FQEVSTJZSA-N 397.865 5.804 30 20 GKED CCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)oc1CC 487920746 XIAGUYYDZZIAQI-INIZCTEOSA-N 380.469 5.027 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)cc(Br)c1F 490477915 NVZIQFDQKCQZOG-UHFFFAOYSA-N 387.249 5.009 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2cccs2)ns1 497984080 XTOWOPLUPMIBGN-UHFFFAOYSA-N 388.477 5.058 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(Cl)cc1F 500757837 XHVOOZMGJIQEDD-UHFFFAOYSA-N 380.806 5.704 30 20 GKED N#Cc1ccccc1-c1ccc(Cn2cc(C#N)c(=O)c3cc(Cl)ccc32)cc1 502831880 FKZAKBWUBHXVOC-UHFFFAOYSA-N 395.849 5.114 30 20 GKED N#Cc1cc(NC(=O)c2cccc(Cl)c2Cl)ccc1OC(F)(F)F 508251488 YOACEDTZQPIQRU-UHFFFAOYSA-N 375.133 5.016 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3cc(C#N)ccc3Cl)s2)cc1 510178550 ZNIGBDUWBKQGHO-CYBMUJFWSA-N 395.915 5.443 30 20 GKED N#CCc1ccc(NC(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)cc1 512903085 VPAVDWRINAWLHO-UHFFFAOYSA-N 386.282 5.381 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Cl)cc1 518147800 JTULWDUIGKSIRK-UHFFFAOYSA-N 384.810 5.617 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3CC3CCCCC3)cc2)nc1 518399084 RFLYOHQSURJZER-NRFANRHFSA-N 389.499 5.321 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cc2)cc1 519068420 WXAMBXQEARQTEH-UHFFFAOYSA-N 387.826 5.738 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520280535 GUFRIWZGGVGXIA-IAGOWNOFSA-N 397.544 5.751 30 20 GKED C[C@@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(F)c(F)c1 525658946 YLRGVATZBQUQOZ-OAHLLOKOSA-N 392.405 5.158 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2cccc(C#Cc3ccccc3)c2)n1 531715941 FHZRHOWKZCMKIV-XMMPIXPASA-N 381.479 5.159 30 20 GKED C=CCCC[C@H](C)NC(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 538327879 PYCHPCRUPJKXJS-KRWDZBQOSA-N 390.483 5.089 30 20 GKED CC[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ncc(-c2ccccc2)[nH]1 540446769 YGUHHQYGNODFQW-IBGZPJMESA-N 387.487 5.151 30 20 GKED C[C@H](N[C@@H](C)c1cnc2ccsc2c1)c1ccc(-c2cccc(C#N)c2)cc1 541175792 DWEGHWODKIMVFA-IRXDYDNUSA-N 383.520 6.247 30 20 GKED N#CCc1ccnc(NC(=O)c2c(F)cccc2Sc2ccc(Cl)cc2)c1 547318386 DHXMYHVJAPSLTG-UHFFFAOYSA-N 397.862 5.344 30 20 GKED Cc1nc(CSc2ccc(C(=O)N[C@](C)(C#N)C3CCCCC3)cc2)cs1 550352063 WQKZXHYFAFSVBA-OAQYLSRUSA-N 399.585 5.336 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 552586312 CZXQLUPBJDRGSJ-UHFFFAOYSA-N 385.254 5.154 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1 558308566 YNWLKFIBBRBKHO-OAQYLSRUSA-N 399.441 5.051 30 20 GKED CCc1nc2cc(CN[C@@H](C)c3ccc(C#N)cc3Cl)ccc2n1C1CC1 558968627 RPSNVWGHANSZDT-AWEZNQCLSA-N 378.907 5.309 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccccc1 560594519 FQQBDTPVTUNZIN-XMMPIXPASA-N 391.474 5.677 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@@H](C)CC3)c1C1CC1 575637012 YKSDAAGFNJVBDH-QWHCGFSZSA-N 382.533 5.042 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 590253148 SZFVSCUUWLWIPM-VXGBXAGGSA-N 391.286 5.606 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@@H]3CCCc4cc(C#N)ccc43)cc2)oc1C 591336743 DETRRAKXEKNBRV-OAQYLSRUSA-N 386.455 5.029 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 597910870 BSJQYLMQNNWZSE-OAHLLOKOSA-N 396.537 5.552 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c2)cs1 608552946 BHTJUVNHBRUTCE-HNNXBMFYSA-N 393.468 5.357 30 20 GKED CCSc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cn1 609031872 NQBQAEJYLOTVLA-UHFFFAOYSA-N 389.480 5.418 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3c3ccccc3)c2)cc1 609208949 LNLPMCHPKPSKDM-HSZRJFAPSA-N 383.451 5.720 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)c2)cc1 609209909 VGZMIFYGPBDIQQ-FUUYNRHESA-N 387.483 5.393 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1cccc(OCc2ccccc2C#N)c1 610055797 NALSCIWOQWUQLZ-XMMPIXPASA-N 399.494 5.146 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 610334706 VPVCXMPKRGBFLB-AWEZNQCLSA-N 395.459 5.304 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 610400454 QGADUJSRCXGSTF-XDHUDOTRSA-N 395.462 5.454 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1ccc(Sc2ccccc2C#N)cc1 610490063 YHVUAYZJCIFITM-UHFFFAOYSA-N 378.419 5.124 30 20 GKED COc1ccc(CNc2ccc3oc(C(C)(C)C)nc3c2)cc1OCCCC#N 610909689 KWPYNIUAVWIYFU-UHFFFAOYSA-N 393.487 5.429 30 20 GKED O=[N+]([O-])c1cccc(F)c1CN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 611434620 DDSUPNGEMCUKLW-AWEZNQCLSA-N 396.262 5.146 30 20 GKED COc1ccc(Cl)cc1-c1nc(S[C@H](C#N)c2ccc(Cl)cc2)n[nH]1 619864084 PGGOMWBALBCJBU-OAHLLOKOSA-N 391.283 5.144 30 20 GKED O=C(N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1(C(F)(F)F)CCCCC1 667004165 KXPXWTVAYILUNU-AOOOYVTPSA-N 399.297 5.089 30 20 GKED N#C[C@H](C(=O)c1cccc2ncccc12)c1nc2cc(C(F)(F)F)ccc2s1 678919978 GKYMADAFHKJYLP-CQSZACIVSA-N 397.381 5.353 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)CCc2nc(-c3ccccc3)sc21 727266831 HJFKZJODWYWSNL-UYRXBGFRSA-N 395.487 5.480 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(C3SCCS3)cc2)cc1 731192372 ADLGGMBIWYJCQT-UHFFFAOYSA-N 398.553 5.124 30 20 GKED FC(F)(F)c1cc(NN=C2CCC[C@H]2c2ccccc2)nc(-c2ccccn2)n1 733079978 OJNTWTPPHOZGBB-HNNXBMFYSA-N 397.404 5.293 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 734965985 RXLBXHNEGLOREB-GOEBONIOSA-N 396.462 5.767 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](c1ccccc1)c1ccc(F)cc1 735309033 CTPONCPCTSHPBX-QFIPXVFZSA-N 380.850 5.261 30 20 GKED Cc1ccc(/C=C2\CC(O)(C(F)(F)F)C/C(=C\c3ccc(C)cc3)C2=O)cc1 735792521 GGIYWZRDYQYZLW-AYKLPDECSA-N 386.413 5.427 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1C#N 742369167 NGURWBHMPZYCTL-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746660194 NRYFHEYIPYXNAJ-XMMPIXPASA-N 383.495 5.705 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1F 752635938 IYZWVHNPEXQZQY-YCRPNKLZSA-N 391.421 5.503 30 20 GKED C#CC[C@H](NC(=O)N(Cc1ccco1)Cc1ccc(C)s1)c1ccccc1 757058798 IYDBVEUGTUUMED-NRFANRHFSA-N 378.497 5.126 30 20 GKED Fc1ccccc1CC(=NOCC(F)(F)F)c1ccccc1Br 764847475 RFEFSHNRSJRDPP-UHFFFAOYSA-N 390.174 5.114 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)C(=O)Nc1cccc(C)c1 766842300 WJZSUJBNDJORGR-DDKJEQMHSA-N 387.266 5.053 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2nc(-c3ccccc3)cs2)c1 772983188 GQFAIMBUBAJTLS-VQIMIIECSA-N 377.513 5.342 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C1(c2c(Cl)cccc2Cl)CCC1 784695679 IYLIHBWAUJYSTA-CYBMUJFWSA-N 389.282 5.345 30 20 GKED Cc1nc(F)ccc1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 787267753 ONKJOPVPJUHSRD-UHFFFAOYSA-N 381.838 5.245 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)ccc1Cl 788352118 RLVZPTBGWPGLHX-LJQANCHMSA-N 396.918 5.378 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801694216 QYSCBDQLJQCVFI-GOSISDBHSA-N 379.397 6.207 30 20 GKED Cc1nn(-c2ccccn2)c(C)c1/C=C\C(=O)c1ccc(SC(F)F)cc1 802705405 GWXOLTYDAQTPAF-KHPPLWFESA-N 385.439 5.095 30 20 GKED O=C1/C(=C/c2cc(Br)c(Cl)s2)C[C@H](C(=O)O)c2ccccc21 806560863 PCYDQDBXOVRTLU-ZCRIDZFUSA-N 397.677 5.002 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)C1 821470510 VVBFMSUIECGWJU-DLBZAZTESA-N 387.524 5.092 30 20 GKED C[C@@]12CC[C@H]3[C@H](CC=C4C[C@H](OC(=O)CCCCC#N)CC[C@@]43C)[C@@H]1CCC2=O 847654480 OQMCVLXJWFJBOI-ABHYAECCSA-N 397.559 5.514 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1 850166165 URWIPXGUXNWWPH-QGZVFWFLSA-N 391.515 5.440 30 20 GKED CCC(C)(C)OCc1ccccc1NCc1cc(C#N)ccc1Br 864025659 HYUYWSQKGSJWOI-UHFFFAOYSA-N 387.321 5.638 30 20 GKED C=CCN(C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12)C(C)C 915153418 KWRKWTLEEGDMRH-UHFFFAOYSA-N 387.508 5.548 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2cc(C)ccc2C)cs1 916346043 SYSBIMPRPAWJJF-UHFFFAOYSA-N 398.919 5.544 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 919773340 FGTRKWIHRHPFHV-JXFKEZNVSA-N 375.497 5.595 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3cc(Cl)nc(Cl)c3)s2)c1 1776082072 UUIRNOJYUGTACT-UHFFFAOYSA-N 392.267 5.261 30 20 GKED O=C(O)c1cc(F)c(/C=C/C(=O)c2ccccc2OCc2ccccc2)c(F)c1 1776126070 BEHVRVKDDUAPNN-ZHACJKMWSA-N 394.373 5.138 30 20 GKED C=CCCC[C@H](NCc1ccc(Oc2ccccc2CC)cc1Cl)C(=O)O 1776171420 YINXTMOSSFZGSA-FQEVSTJZSA-N 387.907 5.594 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776364820 LSNXVYTZWMQJPL-UKTHLTGXSA-N 392.476 6.041 30 20 GKED CC(C)c1cccc2c1OC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1776377848 KQXOWIAQTZBLDA-SFQUDFHCSA-N 388.419 5.427 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](CC(=O)O)C2CCCC2)c1 1776788656 HGEWHEADNGKDJQ-OAQYLSRUSA-N 375.553 5.407 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(-c2ccccc2F)s1 1777268096 ATEYTUNZGSEOLG-CMDGGOBGSA-N 382.412 5.157 30 20 GKED COc1cc(C(=O)O)ccc1/C=C\C(=O)c1ccc2ccccc2c1OC(F)F 1777268461 OHPXPBLXRWQXBL-LUAWRHEFSA-N 398.361 5.044 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C1\C[C@@H](C(=O)O)c2ccccc2C1=O 1777342059 VPCAFVFIZSAAEU-CMYVBNMBSA-N 398.458 5.509 30 20 GKED C=CCN(C(=O)COc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 3558693 JQIZMLHKOBUFJX-UHFFFAOYSA-N 384.888 5.062 30 20 GKED COCc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 46861703 RTDSNXXPVUFSRT-NRFANRHFSA-N 390.870 5.394 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2cn(-c3ccccc3)nc2-c2cccs2)cn1 58465436 HVADNHKRCQEHQD-ZHACJKMWSA-N 388.496 5.274 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 59994585 KCBVLMQYBYRRBV-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc2ncccc2c1 60789215 GJLAKLKKHNJMRL-UHFFFAOYSA-N 381.460 5.510 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)cc1 66954786 DIBIIBLOHRNZOT-YCRPNKLZSA-N 395.528 5.362 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2ccc(Oc3cccnc3)cc2)cc1 78719002 YECRCKSUPCIXDH-JOCHJYFZSA-N 385.467 5.166 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)cc1 91950911 WTSYLOVLMAHUCU-QGZVFWFLSA-N 393.384 5.442 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(-c3ccc(C)cc3)o2)nc2ccccc21 104932816 CYZCAVGMIFDLHW-OAHLLOKOSA-N 376.485 5.434 30 20 GKED Cc1ccc(C)c(OCc2nnc(SCc3ccccc3C(C)(C)C#N)o2)c1 131489478 XZDHKNURIZJVFW-UHFFFAOYSA-N 393.512 5.359 30 20 GKED Cc1ccc(C(=O)N[C@H](CCC#N)c2ccccc2)cc1NC(=O)c1ccccc1 153471918 MGSRYUKAWJHANX-JOCHJYFZSA-N 397.478 5.022 30 20 GKED N#CC1CCN(C(=O)c2oc3ccccc3c2COc2ccccc2Cl)CC1 170683208 JELUTYTZGAYRQJ-UHFFFAOYSA-N 394.858 5.041 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccccc2COc2ccccc2)C2CC2)cc1 171257778 UXHRJTKRWBBCBQ-UHFFFAOYSA-N 397.478 5.334 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCSc2ccccc21 171839136 PUNLHNDQGBDOSU-ZBFHGGJFSA-N 383.542 5.439 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1cccc(Cl)c1 172349325 WQIKFZHLMJYEEG-AWEZNQCLSA-N 387.817 5.239 30 20 GKED COc1ccc(-c2csc(CNCc3ccc(N(C)CCC#N)cc3)c2)cc1 177583823 QAKCSZMKLPZZDL-UHFFFAOYSA-N 391.540 5.063 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)oc2c(C)cccc12 193617303 SHHQKIYCELBOPK-AWEZNQCLSA-N 379.366 5.285 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1NCc1cccc(OC(F)F)c1 215877067 CIAVQLHTSSOFMH-UHFFFAOYSA-N 377.753 5.112 30 20 GKED COCc1nc(Oc2ccc(C#N)cc2F)c2c(-c3ccccc3)csc2n1 301679759 FBJZGYYIRRESND-UHFFFAOYSA-N 391.427 5.308 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 302966364 HKHMJAMMKSQKSY-UHFFFAOYSA-N 380.822 5.204 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cn1ccc2ccc(Cl)cc21 303346379 ZPMWYXZFMJNGEW-CQSZACIVSA-N 383.904 5.185 30 20 GKED Cc1c([C@H](NC(=O)CSc2ccc(C#N)cc2)C(C)C)oc2ccccc12 303493551 WMRBXWMDNIRHKO-OAQYLSRUSA-N 378.497 5.219 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2ncc(C3CCCCC3)s2)no1 329363003 DBAIAXUBOXYFIX-HNNXBMFYSA-N 389.525 5.045 30 20 GKED O/C(CC1(/C(O)=N/C2CCCCCC2)CCOCC1)=N\C1CCCCCC1 330163809 VMEJJGMZACQGQB-UHFFFAOYSA-N 378.557 5.532 30 20 GKED CO[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 378623853 MDVKUOQXCPQWEM-UYAOXDASSA-N 397.906 5.028 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc(Cl)ccc1Br 391523025 BWROUDLEARKFJT-UHFFFAOYSA-N 391.696 5.027 30 20 GKED N#C[C@H]1CCC[C@@]2(C1)Nc1ccccc1C(=O)N2c1cccc(C(F)(F)F)c1 414170043 BMQQWUUDWUJGKH-VBKZILBWSA-N 385.389 5.188 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2C[C@H]3CCCC[C@H]3C2)cc1 427138674 ZZBVGVMLDXHZDD-BGYRXZFFSA-N 376.525 5.113 30 20 GKED Cc1oc2ccccc2c1CCNC(=O)N[C@@H](CCCC#N)c1ccccc1 431467171 YOUOYYHLHCOGLE-NRFANRHFSA-N 375.472 5.018 30 20 GKED N#CCCCn1cc(C(=O)N(Cc2ccccc2)Cc2ccco2)c2ccccc21 434728097 QVSVGWZZUKOWMH-UHFFFAOYSA-N 397.478 5.381 30 20 GKED CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 436335039 LNEJINIIPAELOW-ZAAXVRCTSA-N 395.528 5.157 30 20 GKED C=C[C@@](C)(CCOC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 437624576 KBOPRHTZTGXAOP-KNQAVFIVSA-N 382.891 5.163 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438656724 OVRGIONVQXBPLJ-OAHLLOKOSA-N 379.407 5.180 30 20 GKED CC(C)c1nc(SCC(=O)Nc2cc(Cl)ccc2C#N)c2ccccc2n1 447331918 TYRHOTLFMRMLRH-UHFFFAOYSA-N 396.903 5.009 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2 448081741 CMDGADAUMTYIOQ-HKUYNNGSSA-N 379.479 5.035 30 20 GKED N#CCc1cccc(NC(=O)N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)c1 455911628 WKEBBESAVQGNOI-KRWDZBQOSA-N 387.405 5.183 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(Cc2cccnc2)C(C)C)cc1 464934295 PDKQQWDQSMGVPV-UHFFFAOYSA-N 385.467 5.105 30 20 GKED CCO[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C1=CCCC1 465167357 OOVXSHLGKRILQU-QHCPKHFHSA-N 390.483 5.503 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1sc(NC(=O)c2ccco2)cc1C 470647681 ZTTNLKIVQTTXSD-UHFFFAOYSA-N 394.496 5.120 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(N2CCCCC2)c2ncccc12 471401288 LHXAYPZBHVLJAI-UHFFFAOYSA-N 393.535 5.019 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)c1ccccc1C(F)(F)F 473255451 MMMPECKWNDVGLQ-UHFFFAOYSA-N 380.263 5.071 30 20 GKED C=CCN(C(=O)c1oc(CC(C)C)nc1C)c1nc(-c2ccccc2)cs1 475472441 PUXPQTWRTVJBNW-UHFFFAOYSA-N 381.501 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1 475558362 IXSHTXFNGFBHQA-IBGZPJMESA-N 390.449 6.354 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccccc2F)nc1)c1ccccc1 477121329 YRQQYYYUOZYERL-QGZVFWFLSA-N 375.403 5.039 30 20 GKED N#Cc1cscc1C(=O)N1CCC(=Cc2cc(Cl)ccc2Cl)CC1 477510353 DQAXIBFLXKAWQF-UHFFFAOYSA-N 377.296 5.246 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 487622853 ZNCIZQHXZIAKGN-PGRDOPGGSA-N 376.500 5.180 30 20 GKED C[C@@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)c1cccc(CC#N)c1 488703813 QIURAWWKKUTSHK-ZDUSSCGKSA-N 399.281 5.118 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@H]1[C@H]2c3ccccc3C[C@H]21 494917745 BZWGTQXSNDEXGB-IMSXRSKXSA-N 396.515 5.025 30 20 GKED Cc1ccc2nc(-c3ccc(NC(=O)c4sccc4C#N)cc3)sc2c1 497982424 ROHFXKFFVUHHIJ-UHFFFAOYSA-N 375.478 5.457 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1cc(Cl)ccc1F 506396997 UJBRIKURAPMUKD-GFCCVEGCSA-N 394.924 5.462 30 20 GKED CC(C)COc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(C)(C#N)CC1 508307244 SDCOWIADDHSOEO-FQEVSTJZSA-N 385.552 5.144 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(-c2cccc(OC)c2)n1 512506244 JCSORBPVVJGHMF-UHFFFAOYSA-N 396.560 5.174 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 513654243 KFSVLNUFNZAODH-LJQANCHMSA-N 398.487 5.674 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 517529486 BTBOSORNTDDYQZ-GOSISDBHSA-N 385.467 5.618 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 518719446 XZGXCYNALMOGGX-WMZOPIPTSA-N 381.545 5.308 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2Br)s1)c1ccc(C#N)cc1 518779542 XSXIHMQPUCBWOK-AWEZNQCLSA-N 397.341 5.900 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)Nc3ccccc3SC[C@H](C)C#N)oc12 519422677 DTUHTFXUWBPBFV-CYBMUJFWSA-N 378.497 5.862 30 20 GKED CC(C)CN(CCc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 519451161 RTWUOMBSWWYYQS-IBGZPJMESA-N 395.572 5.671 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)S[C@@H](C)c1ccc(C#N)cc1 522842289 OQPGBWCQZSZNMW-UONOGXRCSA-N 388.920 5.350 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1)c1ccc(C#N)cc1 525298649 APQBFKMYYFUEKR-QGZVFWFLSA-N 379.479 5.303 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(Cl)c2c(c1)OCCCO2 531389530 GWCQOZYQWIJEFJ-CQSZACIVSA-N 388.920 5.365 30 20 GKED C[C@H]1CCCN(Cc2ccc(NCc3cccc(OCCCC#N)c3)cc2)C1 532890588 RWODTXDELJRQDO-FQEVSTJZSA-N 377.532 5.213 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 538001171 YXLLJQKHKRHDKE-PKOBYXMFSA-N 386.417 5.210 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N[C@@H](CCC#N)c2ccccc2)c1 539002973 GTVABVIVFSYHTI-QHCPKHFHSA-N 384.479 5.527 30 20 GKED Cc1cccc(Oc2cc(CN[C@@H](C)c3ccc(C#N)c(F)c3)ccn2)c1C 539606248 IYUCLJLAPBXORZ-KRWDZBQOSA-N 375.447 5.352 30 20 GKED C[C@H](NCc1coc(-c2cccs2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541085083 PRGZNGWLQVLVFO-INIZCTEOSA-N 385.492 5.793 30 20 GKED CCOc1cc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)ccc1OC 541090420 PHFOJRWXUHHWLX-SFHVURJKSA-N 386.495 5.483 30 20 GKED CSc1cccc([C@H](NCc2ccc(CC#N)cc2)c2cc(F)ccc2F)c1 543149876 ICOPVQMDZPURDM-QHCPKHFHSA-N 394.490 5.632 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c1 543303000 HFKFDBAZQJDYOK-PKOBYXMFSA-N 379.529 5.268 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCSc2ccc(Br)cc21 552956739 NYEPXXUXUGDYMT-RTBURBONSA-N 399.357 5.525 30 20 GKED N#CC1(CNC(=O)c2oc3ccccc3c2CSc2ccc(Cl)cc2)CC1 555862742 DKTQMAVEZCNOKM-UHFFFAOYSA-N 396.899 5.412 30 20 GKED N#C[C@]1(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)CC12CCCC2 562721313 AERRIZOSLOZMOV-SFHVURJKSA-N 391.418 5.241 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)C3CCC(C(F)(F)F)CC3)cc2)ccn1 563526381 SYFFNKNXONTAMY-UHFFFAOYSA-N 389.377 5.053 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1 570545838 XVUHEDMIPRMHGV-PKOBYXMFSA-N 386.417 5.460 30 20 GKED Cc1sc(CN[C@H]2CCc3ccc(C#N)cc32)nc1-c1ccc(Cl)cc1 572050639 NBHLDBFRPWVKHH-IBGZPJMESA-N 379.916 5.421 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCc3cc4ccccc4o3)cc2)ccn1 574089682 LVUOVJYQWHMOBI-UHFFFAOYSA-N 383.407 5.063 30 20 GKED C[C@@H]1CN(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCC1(F)F 576388378 UKRCIASDIGNKJK-MRVPVSSYSA-N 390.274 5.233 30 20 GKED N#CCCC[C@@H](NCc1cnn(Cc2ccccc2Cl)c1)c1ccccc1 590069751 WCJYECXDSZXOSQ-JOCHJYFZSA-N 378.907 5.110 30 20 GKED N#C[C@@H](C(=O)c1sccc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 591862051 KYPOLMJLLLZWJH-LBPRGKRZSA-N 392.427 5.744 30 20 GKED C[C@H](NC(=O)N(C)CC(C)(C)C#N)c1ccc(O[C@@H](C)c2ccccc2)cc1 596749446 JRKVQEWNUUOOCW-ROUUACIJSA-N 379.504 5.079 30 20 GKED N#Cc1c(NC(=O)CCN2CCC[C@H]2c2ccsc2)sc2c1CCCCC2 603662315 SDAVZFITAVIOHG-SFHVURJKSA-N 399.585 5.116 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(F)c2)cc1Cl 603673248 QZCNLOCVWFMPBL-FQEVSTJZSA-N 378.834 5.316 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2Cl)n1)[C@@H](C)c1ccc(C#N)cc1 608936229 XDEDKWGAUNUBRO-AWEZNQCLSA-N 395.915 5.558 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 609377788 MYGBQDHEAKNJGN-AWEZNQCLSA-N 377.469 5.154 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3ccc(OC(F)F)cc3)cc2)c1 609427419 QKAXBIJYAHMDPR-UHFFFAOYSA-N 394.377 5.133 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc3c(c2)CCO3)c1 609723188 SCWRLCQXGJZSCJ-UHFFFAOYSA-N 390.826 5.191 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)c3)cc2)cn1 610052088 LGPGOODCCFPKDZ-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2C[C@H]2Cc2ccccc2)cc1 610203919 VLYVCWGHAWPOTN-FYYLOGMGSA-N 398.531 5.212 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 610225565 KSVNXVGXJUCGJZ-UHFFFAOYSA-N 392.842 5.573 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)N[C@H](C)c1cccc(C#N)c1 610355454 REGSCSGJFVLVMF-MOPGFXCFSA-N 383.495 5.689 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)C1 612295220 YPMSQVXDKUMAJA-QFIPXVFZSA-N 399.441 5.036 30 20 GKED C=CCC1(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CCCC1 663678208 IKARFZCKOMFOJK-RYUDHWBXSA-N 386.380 5.084 30 20 GKED N#C[C@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1ccc2ccccc2n1 727952841 TUOJHGKHHHNACY-GLBTYYSXSA-N 382.463 5.446 30 20 GKED CC(C)c1ccc2cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)[nH]c2c1 731025813 NYOZVCZDCURFBU-HNNXBMFYSA-N 377.513 5.795 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3cccc(Cl)c3)cc2)c1 731317289 CCGADJPDEONCDO-UHFFFAOYSA-N 379.872 5.813 30 20 GKED N#C[C@@H](NC(=O)Cc1ccc(Cl)cc1Cl)c1ccc(Cl)c(Cl)c1 731645662 POOGNRXGGYDYAH-OAHLLOKOSA-N 388.081 5.224 30 20 GKED C#CCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1 733327699 CDHIPWLRLXUVBO-KRWDZBQOSA-N 376.525 5.290 30 20 GKED CC[C@H](OC1CCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679443 HZMOOVCDLBATNZ-WMZOPIPTSA-N 388.920 5.378 30 20 GKED CCCCCCCCC/C=C/C(=O)N1CCC(C(=O)N2CCC(C)CC2)CC1 737805606 GKUWIWWGUHZXIX-VAWYXSNFSA-N 390.612 5.180 30 20 GKED COc1cc(/C=C2/Cc3cc(Cl)ccc3C2=O)ccc1OCC(F)(F)F 742437427 NPBCAQWYOHLNHK-MLPAPPSSSA-N 382.765 5.112 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(C#N)c1 743095487 KOVUMUUBHVSHBP-SBUREZEXSA-N 380.451 5.096 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)OCc1cc(Cl)ccc1OCC#N 745608288 UBYPRJVLZWNFID-UHFFFAOYSA-N 390.892 5.022 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CSc2cccc(C(F)(F)F)c2)n1 747197623 KQAIHYJTVSJYMX-CYBMUJFWSA-N 384.448 5.254 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)C(=O)N1c2ccccc2Sc2ccccc21 759056422 TXIWAHSIDPQWKC-OAHLLOKOSA-N 388.517 5.868 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2cccc(F)c2)c2ccccn2)cc1 773133694 RKYAWVJSIKZPOM-UZUQRXQVSA-N 396.893 5.792 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1ccc(F)c(F)c1 773290788 OHQLJPSSLNRZPM-KZULUSFZSA-N 387.455 5.252 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc4[nH]ccc4c3)n2)cc1 776078612 ZTBVLTNXWRZCHU-LJQANCHMSA-N 385.492 5.409 30 20 GKED COc1ccc(OCc2nc(/C=C3/CCc4ccc(F)cc4C3=O)cs2)cc1 776192092 HZFRAAQMSZJQMG-GDNBJRDFSA-N 395.455 5.082 30 20 GKED C=CC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21)c1ccncc1 777242901 JVPYGVJAUKMORX-GSPCLOLRSA-N 375.516 5.067 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@H](C)c1c(Cl)cccc1Cl 780666602 AFPZHYUSCMXAAH-STQMWFEESA-N 392.286 5.209 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCCc1ccsc1 783421116 NKEFJBUHZMZGJU-UHFFFAOYSA-N 377.469 5.077 30 20 GKED C=CCCCNC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 790500934 IDSLKXQHYJQIAH-UHFFFAOYSA-N 387.402 5.140 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792093976 BSZMZHNNYFVRMD-LIRRHRJNSA-N 382.385 5.624 30 20 GKED N#C[C@H](C(=O)Cc1coc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 796902665 FLKZZWJKCZQAGP-CQSZACIVSA-N 394.402 5.253 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1 810216739 NKMSBDSTBWIELP-LUAWRHEFSA-N 390.420 5.122 30 20 GKED N#CCCC[C@@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccccc1 814304176 HSWQWFRRBNMOPP-RUZDIDTESA-N 388.486 5.929 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2nc(-c3ccccc3F)cs2)ccc1OC 814849179 KUZLAQODNNPELG-HNNXBMFYSA-N 397.475 5.251 30 20 GKED CC(C)[C@H](CCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 815913638 XJSIGQAIJZXIDM-ZWKOTPCHSA-N 395.453 5.513 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccccc1C(F)(F)F 819440547 SIHDYWPMLGDXOL-SUMWQHHRSA-N 380.435 5.245 30 20 GKED N#C[C@@H](C(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1nc(C2CC2)cs1 842941827 SXDPMLYCLJNBJW-PZMUVPOTSA-N 396.821 5.496 30 20 GKED C[C@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)c(F)c1 850538384 DUICCEXXQATLDO-LHSJRXKWSA-N 395.478 5.382 30 20 GKED Cc1sc(NC(=O)c2ccccc2SCC#N)nc1-c1ccc(F)cc1 912658750 KYVZDTLHLDVTJJ-UHFFFAOYSA-N 383.473 5.126 30 20 GKED CC(C)CN(C(=O)c1cc2c3ccccc3n(C)c2s1)c1ccc(C#N)cc1 914510433 LIQYTDXJRIFVPV-UHFFFAOYSA-N 387.508 5.567 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nc2ccccc2[nH]1 915351384 AGVSTZHTCLYENJ-JXFKEZNVSA-N 395.466 5.101 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc(Cl)c2)cc1 915352977 PNWPGCFBDHXMQF-NRFANRHFSA-N 375.859 5.317 30 20 GKED Cc1ccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976486 POYNSLBOZAZDPG-KBXCAEBGSA-N 396.899 5.416 30 20 GKED CCCCS[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 918492987 YKEMFMFHJQHABZ-ZYHUDNBSSA-N 386.464 5.413 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc2[nH]c3c(c2c1)CCCC3 920102530 UJSKSAAKVJHNHT-LJQANCHMSA-N 395.462 5.042 30 20 GKED CC1(C)C(=NNc2ccccc2C(=O)O)C[C@@H]1c1ccc(Br)cc1 1776032088 MNHMTKIBEWDREL-OAHLLOKOSA-N 387.277 5.129 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)c1 1776128187 RFFPTYKHOZHNMA-VQHVLOKHSA-N 398.361 5.451 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(OCC(=O)O)c(Cl)c2)oc2ccc(C)cc12 1776956362 VEMFFZXNHQSCDH-FNORWQNLSA-N 398.842 5.317 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1C 1777275245 UJGGFFGIZIMBJE-VQHVLOKHSA-N 392.476 5.635 30 20 GKED COc1cc(C)ccc1Oc1ccccc1/C=C\C(=O)c1csc(C(=O)O)c1 1777281625 DIOJLKCIFSJTBD-HJWRWDBZSA-N 394.448 5.452 30 20 GKED C=CCCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H](C)CC)CC1 1824343333 YAHGVQQWYRDXEU-PZJWPPBQSA-N 390.612 5.035 30 20 GKED COc1ccc2nc(N(Cc3ccccc3)C(=O)c3ccc(C#N)cc3)sc2c1 5299712 FMDUYWLYZYDHPL-UHFFFAOYSA-N 399.475 5.024 30 20 GKED N#CCCSc1nnc(-c2ccc(Cl)cc2Cl)n1-c1ccccc1 5360778 MBELEUFQQYSEBG-UHFFFAOYSA-N 375.284 5.247 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2c2ccsc2)cc1 56745123 PUVPJCSJXGJZLT-FQEVSTJZSA-N 389.480 5.781 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)NC1CCC(c2ccccc2)CC1 63401690 UUCYCVIKMQIXMN-UHFFFAOYSA-N 393.487 5.019 30 20 GKED C=CCOc1cccc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)c1 65749403 UPKVPJOVLNGUSJ-UHFFFAOYSA-N 384.888 5.210 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 78877000 GJSFAGISNKJMJW-MSOLQXFVSA-N 385.294 5.183 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cc1 110965908 DWWOICFMTHHIKF-COYFKBPASA-N 386.476 5.313 30 20 GKED Cc1csc(C(C)(C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 116493335 XLMCUDMKZZZJDH-UHFFFAOYSA-N 392.484 5.172 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 118446286 HJEVNKAIBJJOKS-HZPDHXFCSA-N 395.553 5.385 30 20 GKED C#CCCCCC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 121105791 YSCYECAVJIBWEB-UHFFFAOYSA-N 384.398 5.185 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cccc(F)c4o3)n2)cc1 123562400 BIQCKTIUWCBVAM-OAHLLOKOSA-N 387.395 5.057 30 20 GKED N#CCCn1cc(CNc2cccc(SC(F)F)c2)c(-c2ccccc2)n1 129222608 CJRFEAUVKWKSES-UHFFFAOYSA-N 384.455 5.391 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccco1 150974347 KFXPRHSWNBEZIR-WMZOPIPTSA-N 383.517 5.823 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(F)cc(F)cc1F 152265830 OVGBOCBRMPQVNL-UHFFFAOYSA-N 382.341 5.329 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)c2ccc(Br)cc2)n1 156452583 MPFQPGKDXLNVEM-RISCZKNCSA-N 377.307 5.009 30 20 GKED Cc1ncsc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 173989706 AIPMCVJDAVMDIS-LLVKDONJSA-N 394.308 5.372 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)c1cccc(SCC#N)c1 176059030 ZIAPTFXQIIJWEN-UHFFFAOYSA-N 388.492 5.442 30 20 GKED N#CCOc1ccc(CN[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 176978892 XCIJXOVBUAJXPP-JOCHJYFZSA-N 380.850 5.261 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(C)cc2)C2CCC2)ccc1OC 187338278 DAWNUJBSJFWQFA-ZJSXRUAMSA-N 378.516 5.316 30 20 GKED C=CCn1c(SCCCC(=O)c2ccccc2)nnc1-c1ccc(Cl)cc1 255936130 ZJNFJUMVULINOC-UHFFFAOYSA-N 397.931 5.540 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1nccc2ccccc12 303055986 WTFWWLYRTCYANB-UHFFFAOYSA-N 379.419 5.460 30 20 GKED Cc1ccc(N2CCC[C@H](/N=C(/O)Nc3c(C(C)C)cccc3C(C)C)C2)nn1 329662054 IWGJNUQZIQNOQU-SFHVURJKSA-N 395.551 5.027 30 20 GKED CC(C)Oc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1[N+](=O)[O-] 412077606 JHBMKFRDYBMTPK-CQSZACIVSA-N 399.472 5.029 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC(F)F)c1ccccc1 422252119 AYRKNMQTWVCJAO-FQEVSTJZSA-N 385.458 5.122 30 20 GKED N#Cc1c(F)cccc1CN[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 428348241 JHKAZHZQVPYTRF-HNNXBMFYSA-N 376.275 5.109 30 20 GKED Cc1c(C#N)cccc1NC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 429735490 DUCQCKJYLHJCEP-UHFFFAOYSA-N 397.450 5.185 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NC[C@H]2CCC(F)(F)C2)c1 431107438 KMHHHBOCBNHTOR-ZDUSSCGKSA-N 390.817 5.169 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(N2CCCC2)c1 431282888 MUZVKOCQVIJQLM-CVDCTZTESA-N 390.531 5.082 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1 431927885 VUNWJOIWSQSAOV-BVSLBCMMSA-N 379.479 5.196 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 432756741 ZYFBJMVIYIZXOD-UHFFFAOYSA-N 389.377 5.431 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1 432833247 VSLQHSJVVKGTDC-GCJKJVERSA-N 395.572 6.442 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)C1 433130360 HNOCERISGJOJQK-MJGOQNOKSA-N 379.529 5.350 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 433930111 JHXOEVSNPCXIDO-QGZVFWFLSA-N 386.451 5.084 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)NCc3cc(C#N)ccc3F)c2)C1 438093081 CAZCBKHKNQICDX-HRAATJIYSA-N 395.478 5.114 30 20 GKED CC(C)(NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccs1 438675444 ZLNSOJGUSHQLCB-UHFFFAOYSA-N 395.459 5.608 30 20 GKED O=C(Nc1cncc(F)c1)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 439629912 WTCBHMFDBIYWNG-ZDUSSCGKSA-N 395.278 5.055 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cccc(C[S@](=O)c2ccccc2)c1 442118884 CHJWNPIUUBZREP-NDEPHWFRSA-N 388.536 5.408 30 20 GKED C[C@@H](Sc1nnc(-c2ccccc2Br)o1)c1cccc(C#N)c1 442898966 DPYLLOBFZXIPOB-LLVKDONJSA-N 386.274 5.224 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)c1cn(CCCC#N)c2ccccc12 443904483 GCGWEKIAQJTSFN-UHFFFAOYSA-N 399.416 5.236 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(-c3nccs3)c2)c2ccccc21 444040654 YTLHXPTZVYAEKW-UHFFFAOYSA-N 386.480 5.321 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(CCCC(C)(C)C#N)C2)n1 447397810 QKAFUMHEYQKECS-KRWDZBQOSA-N 383.561 5.328 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458809135 ZXVXOZIXGBTOQW-FXAWDEMLSA-N 375.472 5.570 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccc(C#N)c1 462185145 YHAOQMSLNWJICP-OAHLLOKOSA-N 385.398 5.104 30 20 GKED COc1c(CNCc2cccc(OCc3ccccc3C#N)c2)oc2ccccc12 474014573 DQZKOZKCVBFPJR-UHFFFAOYSA-N 398.462 5.182 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCCc1ccc(OC)cc1 475549851 POBYXVSLQCTZSM-UHFFFAOYSA-N 380.532 5.644 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cc(OC)c(F)cc2C1 475576504 XFIUSZIDIANVDG-UHFFFAOYSA-N 382.479 5.276 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 475590794 SDNNAGOCJDVROI-JOCHJYFZSA-N 395.462 5.163 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476218191 FMCZBVLZHWFHQM-OAQYLSRUSA-N 384.479 5.600 30 20 GKED C=CCC(C)(C)C(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)cs1 477998526 YUEPCOAEEATDSF-GFCCVEGCSA-N 393.350 5.352 30 20 GKED N#Cc1ccc(CNC(c2ccccc2)c2ccccc2)c(Br)c1 481033504 KDAAOZLIOGFWPB-UHFFFAOYSA-N 377.285 5.200 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(N(C)C)cc1C(F)(F)F 485382284 JQAVPMWRMOPJRD-UHFFFAOYSA-N 383.458 5.372 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(C)c(Oc2cc(C)ccn2)c1 492081041 ONQQZFGTDAYNIM-UHFFFAOYSA-N 391.471 5.346 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@H]3C[C@H]3c3cccc(Cl)c3)s2)cc1 493732518 AKRFVRWOOCREQS-OALUTQOASA-N 393.899 5.001 30 20 GKED CC[C@H](OC1CCCC1)C(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 497801465 ZMMHFZHAHOPUMK-QHCPKHFHSA-N 394.490 5.277 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3coc4ccccc34)cc2F)c1 499567144 ZVYVBUBPENXISE-UHFFFAOYSA-N 386.382 5.275 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)COc1cccc(Cl)c1 500734697 WLIFGAJBSATUNO-UHFFFAOYSA-N 392.842 5.330 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)Nc2ccc(C#N)c(Cl)c2)c1 503012470 LVQJCOLIIUCCEV-UHFFFAOYSA-N 379.847 5.347 30 20 GKED CCC[C@H]1C[C@H](C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 503417889 HFRQCRXIBYSMLV-KNQAVFIVSA-N 396.918 5.340 30 20 GKED C[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509906426 YRLCDLVODRQJFZ-WZONZLPQSA-N 391.515 5.374 30 20 GKED CC(C)CN(CC(C)C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509914146 TZTZDVIDXMSVOE-UHFFFAOYSA-N 393.531 5.478 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nc2ccccc2n1C(F)F 512505876 CZWKYFQZPAZSSU-INIZCTEOSA-N 387.478 5.348 30 20 GKED O=C(c1cccc(C(F)(F)F)c1F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513506703 RKCVXTSBDXRZTE-LBPRGKRZSA-N 383.307 5.039 30 20 GKED N#Cc1ccc(N2CCC(N[C@@H](c3ccccc3)c3ccc(F)cc3)CC2)cc1 513677819 CHBAVFMABFYGHX-VWLOTQADSA-N 385.486 5.045 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CCc3ccc(Cl)s3)c2)c1 515296754 MVYWQPUCHLHBBD-UHFFFAOYSA-N 396.899 5.423 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(-n4cccc4)c3)n2)cc1 517801023 VYHPJDGLDQQXFR-HXUWFJFHSA-N 399.475 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 518113140 MIEJEZLSTCMDFM-HNNXBMFYSA-N 388.558 5.037 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 518654134 BMUXURRVFXTRBU-HNNXBMFYSA-N 392.842 5.410 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2SCCC#N)c1 520803156 VQGYBLJELBNZOZ-UHFFFAOYSA-N 382.529 5.497 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H](C)CC2)cc1 522952038 FHIILHSOTYWZOH-INIZCTEOSA-N 379.460 5.013 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc([C@@H]2CCOC2)c1 534138589 YDYLWCOSCGQUOA-OAQYLSRUSA-N 398.462 5.415 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2cccc3ncccc23)cc1 534843356 VTFVEBJINKOOOO-UHFFFAOYSA-N 393.446 5.484 30 20 GKED C[C@H](NCc1ccc(Br)cn1)c1ccc(-c2cccc(C#N)c2)cc1 541088928 HHJKSSDCRAIRIT-HNNXBMFYSA-N 392.300 5.234 30 20 GKED N#CCc1ccc(CNc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1 542233165 GZTHYTMWVZQTAG-UHFFFAOYSA-N 399.372 5.229 30 20 GKED CCOc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543875358 XISZCJYVRNLASY-SFHVURJKSA-N 386.495 5.483 30 20 GKED CN(C(=O)CCC(F)(F)F)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 544035833 ZEQIXPXIYURCDH-NSHDSACASA-N 381.238 5.110 30 20 GKED COc1cccc([C@H](NCc2ccc(CC#N)cc2)c2ccccc2Cl)c1 544083599 NWSNVKRAIBUUBA-QHCPKHFHSA-N 376.887 5.294 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cncc4ccccc34)no2)c2ccccc21 545688869 YPDRPSUKBPEOAP-ZHACJKMWSA-N 391.434 5.324 30 20 GKED C[C@H]1C[C@@H](c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)CCO1 547216256 UCCHITJPAXELHQ-KBPBESRZSA-N 395.846 5.336 30 20 GKED Cc1cc(Br)cc2c1[C@H](N[C@H](CCCC#N)c1ccccc1)CC2 551214493 FOAYJWUTKMAROK-WOJBJXKFSA-N 383.333 5.770 30 20 GKED CC(C)c1nccn1Cc1cccc(NC2CCN(c3ccc(C#N)cc3)CC2)c1 556887538 XXOYTRWGRCGPQV-UHFFFAOYSA-N 399.542 5.007 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1CCc2ccc(C#N)cc21 559473225 HMGQAHKXQGMNKU-UHFFFAOYSA-N 398.249 5.031 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1Cl)c1cccc(Cl)c1Cl 561290242 BOLZFHMOTCCYHM-XEZPLFJOSA-N 379.674 5.131 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)C2)cc1 562099990 LHBGIVGTGHFSMR-IBGZPJMESA-N 398.466 5.075 30 20 GKED COc1ccc([C@H](CCC#N)NCc2ccc(-c3csc(C)n3)cc2)cc1 565461266 QKFSCURGUBAMJY-NRFANRHFSA-N 377.513 5.262 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](COc1ccccc1)c1ccccc1 594308871 PGNDLPSTTPKOPU-JOCHJYFZSA-N 392.524 5.266 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1N[C@@H](C)c1cccc(C#N)c1 600848850 HOZUIQHZPXFJDJ-INIZCTEOSA-N 389.886 5.946 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cn2)c1 603622060 IOZLJDROZMMKOW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CSc1ccc(C)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c1 603627107 QZCIXXGFYFGXJG-UHFFFAOYSA-N 375.453 5.028 30 20 GKED C=CCCCN(C)C(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1 605831836 NJNYPENANJUJMY-UHFFFAOYSA-N 383.439 5.183 30 20 GKED N#C[C@@H](C(=O)c1cc2occc2s1)c1nc2cc(C(F)(F)F)ccc2s1 606147522 YIKGLXXIUMHLLJ-VIFPVBQESA-N 392.383 5.613 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCc3sccc3C2)c1 609722820 KARNTVIVEPZSHT-UHFFFAOYSA-N 394.883 5.264 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(COC(C)(C)C)cc1 610634718 GICRXNBOKGCVDJ-UHFFFAOYSA-N 377.488 5.093 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SCCC#N)c(C)c1Br 616325984 BPLJEJKOCAZBJR-UHFFFAOYSA-N 389.318 5.324 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](C)c2c(Cl)cccc2Cl)cc1 625110980 YIBPRKSDWKFPBX-LBPRGKRZSA-N 392.286 5.043 30 20 GKED Fc1ccc([C@H](NCc2cccnc2C(F)(F)F)C(F)(F)F)cc1Cl 625378366 KMDKQQKQEGDXRF-LBPRGKRZSA-N 386.698 5.286 30 20 GKED Fc1ccc(-c2csc(N3C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C3)n2)cc1 674932527 IRSUULCQVQFRJK-PHIMTYICSA-N 384.320 5.126 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 675015920 FLILRTLPEWRCMA-LBPRGKRZSA-N 398.768 5.598 30 20 GKED O=C1/C(=C\c2cccnc2)CCc2nc(-c3ccc(Br)cc3)sc21 728438128 AKLLMELCSCSJJB-UVTDQMKNSA-N 397.297 5.180 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(N3CCCCC3)c(F)c2)cc1 728700261 MXHFQTKHAWEOON-PJCWUCBCSA-N 378.447 5.003 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1ccc(Cl)cc1 730950553 FNJSQTIFIWPTEY-KMKOMSMNSA-N 382.799 5.106 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)NCCSc1ccccc1 731322424 ZLYKRICQRCRWOB-HNNXBMFYSA-N 387.599 5.160 30 20 GKED C=CC[C@@H](NC(=O)c1sc2nc(C(F)(F)F)ccc2c1C)c1ccncc1 734235231 ZGWXNTROERRVGE-CQSZACIVSA-N 391.418 5.066 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1cc(F)ccc1F)c1ccccc1 734982383 CHESRNNKWCZQNZ-UHFFFAOYSA-N 379.435 5.240 30 20 GKED N#Cc1c(NC(=O)Cc2cc(-c3ccccc3)on2)sc2c1CCCCCC2 736006851 VJWJYCIFMIDFBN-UHFFFAOYSA-N 391.496 5.115 30 20 GKED Cc1cc(-c2noc([C@H](C)ON=Cc3ccccc3OC(C)C)n2)ccc1F 744444466 WZYIAHQWPXGJJN-HNNXBMFYSA-N 383.423 5.083 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1ccc2ccccc2n1 749810276 OWUIOCIBOSRSEI-UHFFFAOYSA-N 381.361 5.033 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2ccc(Cl)s2)n1)Cc1ccccc1 750782572 BQGYIENFYPQXGI-ZDUSSCGKSA-N 388.901 5.064 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2ncnc3oc(-c4ccccc4)cc23)c1 752634872 KTRTXIIOFIMJDS-GOSISDBHSA-N 384.439 5.183 30 20 GKED CCN(C(=O)c1ccc(-c2ccc(F)cc2)n1C)c1ccc(C#N)c(Cl)c1 774148352 IKPMPGDKSICENN-UHFFFAOYSA-N 381.838 5.023 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2cc(F)ccc2F)C(C)C)ccc1OC 794808787 CLICFVMSLATIJK-HTAPYJJXSA-N 388.458 5.141 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)C[C@H](CC#N)c1ccccc1 795980138 BUAIWEYOWZILML-QUCCMNQESA-N 392.499 5.076 30 20 GKED N#C[C@@H](C(=O)CO[C@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 797549630 OVQVYGPVJVHFFI-LPHOPBHVSA-N 396.899 5.220 30 20 GKED N#Cc1ccc2c(c1)C(=O)/C(=C/c1csc(COc3ccc(Cl)cc3)n1)C2 811696940 WUFGNHZFESERTE-OQLLNIDSSA-N 392.867 5.070 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1nccc2ccccc12 811698913 MZXQRTHTRZAQLQ-HJWRWDBZSA-N 387.420 5.163 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNc1ccccc1F 812460300 NJIRCTKPLIASOK-UHFFFAOYSA-N 377.250 5.132 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813218196 SWFHZVNUTVKPDZ-YOEHRIQHSA-N 390.405 5.176 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)Nc3ccc(C#N)c(F)c3)cccc2c1=O 813258685 GZFWZLBPFXGIGS-UHFFFAOYSA-N 398.393 5.032 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CN)(c2ccccc2)CC1 904446236 XGQNFGKPTBZXDZ-UHFFFAOYSA-N 391.559 5.063 30 20 GKED N#Cc1ccsc1NC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 908169892 CNZNMOGPZKEPHP-UHFFFAOYSA-N 389.867 5.741 30 20 GKED O=[N+]([O-])c1cc(Cl)cc(C=Nc2ccccc2COCc2ccccc2)c1O 915981355 AFFSSWUGTVVJGC-UHFFFAOYSA-N 396.830 5.421 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccccc1[N+](=O)[O-] 916311345 CICPBKXPFBDQJS-UHFFFAOYSA-N 389.440 5.103 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(C)n(C3CCCCC3)c2C)cc1 916914402 ZJGFABROQMWAGD-JOCHJYFZSA-N 391.515 5.134 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@@H]1CCCC[C@@H]1C 920078341 PTHFVYXKSFNIRD-MGPUTAFESA-N 379.529 5.524 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCc2ncc(Br)cc21)c1ccccc1 926479812 MSEBEBQTMHCJQW-UYAOXDASSA-N 384.321 5.246 30 20 GKED CCC(=NNc1cc(C)c2cc(Cl)ccc2n1)c1cc(C(=O)O)ccc1F 1776021423 BPQDZUPHNKYOKH-UHFFFAOYSA-N 385.826 5.260 30 20 GKED COc1cc(C)ccc1Oc1ccccc1C=NNc1cccc(C(=O)O)c1C 1776088787 IOPRESSHSTZEKL-UHFFFAOYSA-N 390.439 5.249 30 20 GKED O=C(O)c1cc2cc(C=NNc3ccc(OCc4ccccc4)cc3)ccc2o1 1776093293 IFKCWILCXHVLDH-UHFFFAOYSA-N 386.407 5.156 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3cccc4ccccc34)cc2)c1 1776114589 TVNDFGSAQZTTPV-DTQAZKPQSA-N 392.454 6.030 30 20 GKED C=C(Cl)C[C@H](NCc1cc(F)ccc1Oc1ccc(SC)cc1)C(=O)O 1776142364 YAXVFKUIAOCTKD-KRWDZBQOSA-N 395.883 5.025 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)s1 1776339943 RXNRKZAAJNIDEJ-YFHOEESVSA-N 396.533 6.269 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(OCCCCCC)c1 1776783822 OCXUIIVOJCDTJR-NRFANRHFSA-N 377.569 5.939 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(F)cccc1OCC(F)(F)F 1776784222 XFFPUPMKCCXTRG-AWEZNQCLSA-N 393.421 5.060 30 20 GKED COc1cc(OC)c(C(=O)O)cc1/C=C/C(=O)c1sc2c(C)cccc2c1C 1777326400 ZVJHLSNDTNVKJU-CMDGGOBGSA-N 396.464 5.130 30 20 GKED Cc1ccc(-c2ncc(/C=C3\C[C@@H](C(=O)O)c4ccccc4C3=O)s2)cc1C 1777431446 LLANPBWGSYODOP-NXZBIGBUSA-N 389.476 5.265 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccc(C#N)cc1 45218899 YCKRVNIVJJMTPR-KRWDZBQOSA-N 397.503 5.213 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccc2ccccc2n1 47376521 DYPQMRBRNZEWHO-QGZVFWFLSA-N 382.444 5.346 30 20 GKED N#Cc1cccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2F)c1 62422509 VDZXVAXSIIKWLX-OAQYLSRUSA-N 395.275 5.339 30 20 GKED N#Cc1c(NC(=O)c2ccc(Br)c(F)c2)sc2c1CCCCC2 64622033 OWHVCCQLKNZQMW-UHFFFAOYSA-N 393.281 5.043 30 20 GKED Cc1sc(NC(=O)c2cccnc2SCc2ccc(F)cc2)c(C#N)c1C 107766153 LAIIIKSWLTVHIQ-UHFFFAOYSA-N 397.500 5.315 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108528564 KQOZOLJETDYFIK-XLIONFOSSA-N 379.529 5.616 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccncc1 108532110 VAVMKKRMIUMULN-PXNSSMCTSA-N 394.544 5.483 30 20 GKED C=CCN(C(=O)C[C@H](C)OC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 109882842 STWNMJDIHKMVEG-NSHDSACASA-N 385.316 5.061 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(C#N)nc2)cc1Cl)c1ccccc1 115361224 GLUKQEUTSGUFMY-AWEZNQCLSA-N 376.847 5.032 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1ccccc1SC1CCCC1 128709444 PJRJIVBCGYQFHV-UHFFFAOYSA-N 380.517 5.064 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(F)cc1OCC#N 135251439 QLLRMPZUZKEMOA-UHFFFAOYSA-N 396.249 5.089 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 173915980 PRLWMXIVVXZXGF-INIZCTEOSA-N 391.496 5.104 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1cn(C)nc1-c1ccc(C#N)cc1 180240707 PEROOBQZCAETDC-INIZCTEOSA-N 393.560 5.040 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1C[C@@H]2CCC(=O)c3cccc1c32 184390873 XVQCSPAEBQVHMZ-KRWDZBQOSA-N 394.430 5.071 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(NC(=O)C(C)C)ccc1Cl 189894676 BMSXZTJXCIOWOX-UHFFFAOYSA-N 398.934 6.039 30 20 GKED COc1ccc(CN[C@H](c2cccc(F)c2)C2CCCC2)cc1OCCCC#N 237301677 ZJLKDHONSKYJEW-DEOSSOPVSA-N 396.506 5.538 30 20 GKED C=CCc1cc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)cc(OC)c1O 237401355 LCMARYKOKPFCGP-OAHLLOKOSA-N 394.540 5.412 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3c(F)cccc3F)o2)cc1 237792690 NDYNTAOQQFEWCC-UHFFFAOYSA-N 383.398 5.144 30 20 GKED N#Cc1cnc2ccc(OC(F)F)cc2c1N[C@H]1CCO[C@@H](c2ccccc2)C1 302155021 DMXYPSIRTZILFU-OXJNMPFZSA-N 395.409 5.040 30 20 GKED Cc1coc2ccc(N=C(O)N3CCCCC[C@H]3c3noc(C(C)C)n3)cc12 330077709 NEIDXLHWZHUSPP-KRWDZBQOSA-N 382.464 5.410 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@H]3C)c1C1CC1 410973283 IANQFJYSZINIRI-QWHCGFSZSA-N 382.533 5.213 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H]4CCC[C@@H]43)cc2Cl)cc1 429356259 UWHITGWMDZRVFY-BEFAXECRSA-N 381.863 5.410 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)C1 433130356 HNOCERISGJOJQK-HKUYNNGSSA-N 379.529 5.350 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H](c1ccccc1)C1CC1 433157294 LWVAVISAPHRFDU-LPHOPBHVSA-N 379.529 5.396 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 436065526 LUNZKPVXKMWIKH-UHFFFAOYSA-N 393.443 5.167 30 20 GKED C[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 437834453 DEPRAYPVBMRDLT-QGZVFWFLSA-N 383.451 5.329 30 20 GKED C=CCN(C(=O)[C@@H]1CO[C@@H](C)C1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 439146036 KYFGZDYDAHZWPB-AAEUAGOBSA-N 397.327 5.061 30 20 GKED COc1cc(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)ccc1C#N 441335132 PRVIFHKKBIPLJS-UHFFFAOYSA-N 389.402 5.321 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccncc2Oc2ccccc2)s1 442542587 KDMZSFHIAAADTM-MRXNPFEDSA-N 377.469 5.118 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ncoc1-c1cccc(C(F)(F)F)c1 448134251 IHIQNUZJUGPPSE-UHFFFAOYSA-N 392.402 5.250 30 20 GKED C[C@@H](c1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1)C(F)(F)F 453797169 ZVTRFMZLDNZDTM-IINYFYTJSA-N 386.295 5.256 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCC(OC3CCCCC3)CC2)cc1C#N 455783118 ZATFPCFADNQCMG-UHFFFAOYSA-N 399.535 5.081 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 464244373 UMKPZGSUBYVVHT-UHFFFAOYSA-N 382.891 5.608 30 20 GKED CCSc1cc(Cl)ccc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464466041 HSOGUJFCDWVMDU-CYBMUJFWSA-N 384.810 5.356 30 20 GKED C=C(C)C[C@H](C)C(=O)NCc1ccc(Cl)c(NC(=O)[C@H](C)CC(=C)C)c1 466415472 GNRHLSGGCVLIDR-JKSUJKDBSA-N 376.928 5.099 30 20 GKED CC1CCN(CCc2cccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2)CC1 476555939 YYSDWESPOVVCQX-UHFFFAOYSA-N 389.543 5.014 30 20 GKED CCc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cnn1-c1ccccc1Cl 477025681 NZWYIIJYMZKTRD-QGZVFWFLSA-N 392.890 5.114 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@H](CC(C)(C)C)c1ccccc1 480518678 NBQANUFHMKJFHS-OAQYLSRUSA-N 384.520 5.037 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 481652073 CEAXJSDXEWXGBE-UHFFFAOYSA-N 377.419 5.372 30 20 GKED C=CCN(C(=O)c1cc2c(C)nn(Cc3ccccc3)c2s1)c1ccccc1 484261324 HTLMNFUZZRIIPX-UHFFFAOYSA-N 387.508 5.287 30 20 GKED N#C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1c(Cl)cccc1Cl 486424950 LZYNEAWZUPEVIV-KBVBSXBZSA-N 385.703 5.193 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(Cl)c1Br 486826147 PRINSTDGTCPYLZ-UHFFFAOYSA-N 382.710 5.633 30 20 GKED C=CCC[C@H](NC(=O)Nc1ncc(COC)s1)c1ccc(C(F)(F)F)cc1 487113730 JLXLKPITFLHKBR-HNNXBMFYSA-N 399.438 5.137 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(-c2ccco2)cc1F 490509366 IDALVCSKORUEIW-UHFFFAOYSA-N 380.419 5.314 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 497541742 OGTFPIQNNRGZPO-QZTJIDSGSA-N 396.462 5.411 30 20 GKED CCCn1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1C1CC1 498701141 ZSNUPZQVARDKKD-QGZVFWFLSA-N 390.512 5.093 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)CC2)cc1 503897023 GHVZBAPNZPJHSB-UXHICEINSA-N 397.305 5.284 30 20 GKED CC[C@H](CC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 504324163 HPUOMHBFRHLHPQ-GOSISDBHSA-N 385.467 5.576 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 508296490 DBDVHGZVMSXGJJ-HXUWFJFHSA-N 397.478 5.680 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1ccc(F)cc1F 510172839 OEXIEPVHEGRJAC-CYBMUJFWSA-N 395.434 5.018 30 20 GKED C=CCC[C@@H](NCc1cccc(C(=O)NCc2ccc(C)cc2)c1)c1ccco1 514095634 SAFMWJTWLQALSS-HSZRJFAPSA-N 388.511 5.315 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1-c1ccccc1C#N 517461813 QBTGHOYMCTXWKW-KRWDZBQOSA-N 397.503 5.729 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1 518754608 TVTZOOROFKONQO-VFNWGFHPSA-N 397.519 5.883 30 20 GKED C=CCCO[C@H](C)C(=O)N(c1cccc(Cl)c1)c1nc2ccccc2s1 519070228 VZAUFWYRVUTHTD-CQSZACIVSA-N 386.904 5.596 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ncc(-c2ccccc2)s1 520492149 ZPOQWHLYTOWHFY-UHFFFAOYSA-N 376.485 5.126 30 20 GKED C=CCOc1ccccc1CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 521175721 QPIBEXRYGVPULE-UHFFFAOYSA-N 380.469 5.178 30 20 GKED C=CCOc1cccc(NC(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)c1 522615993 RKXXJZZCXBIGCI-LJQANCHMSA-N 388.920 5.227 30 20 GKED CCn1ncc2ccc(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)cc21 524692162 SAZUZEHBABYYTH-UHFFFAOYSA-N 396.450 5.167 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1c(Cl)cccc1Cl 524854208 NWNRROAHFSVTBY-FCHSOHFDSA-N 397.664 5.270 30 20 GKED Cc1cccc2c(CCC(=O)Nc3sc(-c4ccccc4)cc3C#N)c[nH]c12 525044286 LNTXZCWFYGGYSF-UHFFFAOYSA-N 385.492 5.648 30 20 GKED C=C[C@@H](CC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 535370055 KBILPRIXHSMWBA-AOMKIAJQSA-N 379.550 5.644 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)cc1 535370683 AIHSQSREBQWAKS-UHFFFAOYSA-N 383.476 5.205 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)C1(C#N)CCCC1 544087390 JTNRINXNOIPYNW-UHFFFAOYSA-N 379.460 5.433 30 20 GKED CSc1cc(C(=O)Nc2cc(C#N)c3ccccc3n2)c(Cl)cc1Cl 554775676 MCVQVRZFSHWCQF-UHFFFAOYSA-N 388.279 5.387 30 20 GKED C=CCC(C)(C)c1noc(/C=C\c2csc(N(C(C)=O)c3ccccc3)n2)n1 556363570 YLOQIRBHMDHNOH-QXMHVHEDSA-N 394.500 5.235 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H]1CCCc2cc(C#N)ccc21 561129900 COWDTFWMRQFUFU-SZNDQCEHSA-N 391.515 5.858 30 20 GKED CC(C)[C@H](CNC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccccc1 572537563 XEHKLQHZLIBSKY-QUCCMNQESA-N 395.572 5.049 30 20 GKED N#CCc1ccc(NC(=O)NC23CCC(C(F)(F)F)(CC2)CC3)c(Cl)c1 578958883 IESCDIDUGVJWAY-UHFFFAOYSA-N 385.817 5.183 30 20 GKED CC(C)[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(C(C)(C)C)cc1 583884324 GXQGMSDRIYXLNZ-JOCHJYFZSA-N 388.515 5.393 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603689941 UWVKFONEXLUKRZ-QGZVFWFLSA-N 386.455 5.279 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c1 604086552 LPASPMQMXDXZPQ-JOCHJYFZSA-N 398.466 5.423 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 604368172 WYMZPBKGMOPKFR-OAHLLOKOSA-N 389.421 5.260 30 20 GKED N#C[C@H](C(=O)c1ccccc1Sc1ccccc1)c1ccc2ccccc2n1 608552734 BTQDRVFPMZKFSV-FQEVSTJZSA-N 380.472 5.876 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(Oc3ccc(F)cc3)cc2)c1 608860457 MSOCQFHMYXQQEB-UHFFFAOYSA-N 390.458 5.590 30 20 GKED N#CCn1c(C(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc2ccccc21 609165016 MKKZALREKRMZIY-LJQANCHMSA-N 398.293 5.449 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1SC[C@H](C)C#N 609376772 JAQIBFDRWOUNOV-YLJYHZDGSA-N 396.556 5.858 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1cc2ccccc2o1 609432655 FOXLGWOUHCHWSF-GOSISDBHSA-N 382.463 5.734 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](CC)c1ccccc1 609435017 KURKXRVWXHHLLI-GHTZIAJQSA-N 395.572 6.476 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)c1 610321932 UTBWDBWDCLJRRF-INIZCTEOSA-N 387.439 5.242 30 20 GKED COc1cc(CN[C@H](C)c2cccc(C#N)c2)ccc1OCc1ccc(F)cc1 610345102 RKPLEZCIQMNOSV-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#C[C@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1nc2ccccc2[nH]1 613287396 NKEPWMNUJAFRCZ-SECBINFHSA-N 386.263 5.574 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)c(F)c(F)c1F 619125128 IKFGOVOOFMMHHY-UHFFFAOYSA-N 399.228 5.026 30 20 GKED C=CCc1ccc(OCc2nc(-c3ccc(C(F)(F)F)cc3)no2)c(OC)c1 649467907 LHJHYLWXZPHLBH-UHFFFAOYSA-N 390.361 5.072 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccccn3)s2)cc1 727663857 JRIKMYLGUHVVQY-LJQANCHMSA-N 396.475 5.113 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3CCCc4ccccc43)n2)cc1 731135648 FZXLFAVVQOFNHM-CTNGQTDRSA-N 386.520 5.805 30 20 GKED O=C(Nc1ccc(Cl)cn1)c1cccc(N=Cc2cc(Cl)ccc2O)c1 731488661 OMMZCXIUQZXTJT-UHFFFAOYSA-N 386.238 5.097 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCCC[C@H]2c2ccccc2)c1 733851946 NQZDXMSNPHPVNY-GMAHTHKFSA-N 391.515 5.194 30 20 GKED CCC/C=C/C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 735204353 UFMJBQZSTIFVEZ-NYYWCZLTSA-N 378.522 5.963 30 20 GKED Cc1ccc(-c2nc(CSCc3cc(Cl)ccc3OCC#N)cs2)o1 735318739 PPKJIBCDFXYJBW-UHFFFAOYSA-N 390.917 5.701 30 20 GKED Clc1nc(N2CCCC2)sc1C=NN=C1c2ccccc2-c2ccccc21 735972697 OOQUUOFGJRZIOT-UHFFFAOYSA-N 392.915 5.249 30 20 GKED CC(C)c1csc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)n1 740022109 CGFIBCGVSWRFEA-UHFFFAOYSA-N 382.514 5.188 30 20 GKED C[C@H](NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccc(C#N)cc1 741901965 XBUBUDSQFRHCKG-ZDUSSCGKSA-N 380.369 5.134 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CNCc1cc(C#N)ccc1F 742382798 GHULMBVURYTKGJ-UHFFFAOYSA-N 396.469 5.148 30 20 GKED CCCN(Cc1ccccc1O)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093878 ZBTUMEVBSMGDOV-QHCPKHFHSA-N 399.494 5.492 30 20 GKED COc1ccc2sc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c(C)c2c1 744017023 XOUUVRFBBNNBDL-AWEZNQCLSA-N 378.478 5.318 30 20 GKED COc1cc(C(=O)/C=C\c2cccc(OC(F)F)c2)ccc1SC(F)F 747061761 NUQQKSOIPVMJOE-ALCCZGGFSA-N 386.366 5.507 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)c1ccccc1OCC#N 748194213 BLTRABLZMOJYGZ-UHFFFAOYSA-N 380.513 5.575 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 750692915 IWUWWWJNBSTLKX-HMVFGEFZSA-N 398.409 5.507 30 20 GKED N#C[C@H](C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc2ccccc2n1 751825908 MVGRZJGCTXHYTQ-JOTOOZHTSA-N 398.428 5.560 30 20 GKED Cc1ccccc1CC1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 752636521 LUBTVSGRAUWHNI-RUZDIDTESA-N 395.506 5.357 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2cc(C)c3ccc(C)cc3n2)ccc1OC 763529376 JOFJHBBNBNPDFS-GOSISDBHSA-N 375.472 5.153 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc4[nH]ccc4c3)n2)cc1 765938603 ZABPQRQOHIKKFY-FOTOIKQHSA-N 399.475 5.190 30 20 GKED Cc1noc(C)c1-c1ccc(OC(=O)c2cn(CCCC#N)c3ccccc23)cc1 774267156 UHWVSVGJFHKFMA-UHFFFAOYSA-N 399.450 5.436 30 20 GKED C[C@@H]1C[C@H]1[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)cc1 776026566 OWVFVPGECAAUTN-CFSSXQINSA-N 375.299 5.383 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 779028774 BBYJMZFHOAEYLD-QVKFZJNVSA-N 377.488 5.243 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780678892 QMLCOWAGYDBQML-SLYNCCJLSA-N 377.488 5.086 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)c(F)c1 781111711 QAFMFZMEQLCSRL-YWEYNIOJSA-N 398.846 5.282 30 20 GKED OC1(c2cccc(F)c2)CCC(=NNc2ccnc3cc(Cl)ccc23)CC1 783784108 PDRGURGFQJEQQB-UHFFFAOYSA-N 383.854 5.257 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2c(Br)cccc21 788355356 QBYLGMPZXTVKDV-SOFGYWHQSA-N 388.208 5.137 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2nc(Cl)cs2)cc1Cl 789897793 WKXGHFZSXRQJOJ-AWEZNQCLSA-N 388.279 5.358 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C34CC(c5ccccc5)(C3)C4)n2)cc1 791772970 GXETWYHBZOIKHA-NNAHLOSHSA-N 384.504 5.417 30 20 GKED CC(C)n1nccc1/C=C1/CC[C@H](C2CC2)/C(=C\c2ccnn2C(C)C)C1=O 794942599 PIKUOWLEMLXSPB-KVIUKHKTSA-N 378.520 5.098 30 20 GKED N#CC1(CCCOC(=O)c2ccccc2N=Nc2ccc(O)cc2)CCOCC1 800107455 QQPOUIUNKPBZLS-UHFFFAOYSA-N 393.443 5.065 30 20 GKED N#CCn1c(/C=C\c2nc3ccc(Br)cc3s2)nc2ccccc21 806562122 GJTBGWLSWDANAS-FPLPWBNLSA-N 395.285 5.102 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@H]1CCOC(C)(C)C1 809872632 JIGKCQLQDWSXQR-VXKWHMMOSA-N 391.515 5.153 30 20 GKED CSCC1(CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CC1 845452053 RYDNZDPHZZUMCD-NSHDSACASA-N 384.448 5.025 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccsc1)c1nc2cc(C(F)(F)F)ccc2s1 860477778 LSGOLCFHZUGVMU-XQQFMLRXSA-N 392.427 5.357 30 20 GKED C=CC[C@@H](c1ccccc1)c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904483034 JHSBREGLISYQAE-IBGZPJMESA-N 393.450 5.179 30 20 GKED Clc1cc(CON=Cc2ccc(Br)cc2)c2ncccc2c1 914785678 BATWOABDLAFWIM-UHFFFAOYSA-N 375.653 5.201 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915088158 HIMUIBQHTVBFTJ-JOCHJYFZSA-N 393.446 5.558 30 20 GKED CC(=NNc1nccc2sccc12)c1ccc(-c2ccc(C(=O)O)o2)cc1 915980608 VYZFLMJTNNWFRH-UHFFFAOYSA-N 377.425 5.091 30 20 GKED Cc1ncsc1C(=O)/C=C/c1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 915987944 OBROQWUZXLVVDP-KRXBUXKQSA-N 384.388 5.187 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1ccccc1Br 916286698 PJUCKYMOXWZYSX-UHFFFAOYSA-N 392.606 5.352 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc4c(C)c(C)[nH]c34)n2)cc1 916975485 ZYTSRIRQFJDUSE-LJQANCHMSA-N 385.492 5.707 30 20 GKED CC(C)COC1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 918034551 SHLHBYIQHUYMHN-HSZRJFAPSA-N 391.515 5.011 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NN=C1c2ccccc2-c2ccccc21 1776027694 YTKBCIFATYIUFY-UHFFFAOYSA-N 380.447 5.333 30 20 GKED CCC(=NNc1ccc(F)c(C(=O)O)c1)[C@H](C)c1cccc(Br)c1 1776064658 YDSASQGRTHYOOQ-LLVKDONJSA-N 393.256 5.268 30 20 GKED Cn1c(C(=O)O)c(C=Nn2c3ccccc3c3ccccc32)c2cc(F)ccc21 1776113113 XSAKNLKXLNBIFA-UHFFFAOYSA-N 385.398 5.006 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776327469 TZAMNIPSXOHGJW-YCRREMRBSA-N 378.424 5.452 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776473410 FNXFQDDZYSUCQV-IDVQTMNDSA-N 396.386 5.047 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776700111 ZIOUIOMRNQDRKP-KJJQSCHISA-N 382.456 6.148 30 20 GKED Cc1ccc(N/C(S)=C(/C(=O)c2ccc(Cl)cc2)[n+]2ccccc2)cc1F 7746874 ORKXALBEAOQWOR-UHFFFAOYSA-O 399.898 5.126 30 20 GKED O=C1N/C(=N\C2CCCC2)S/C1=C\c1ccc(-c2nc3ccccc3s2)o1 24099974 DMTKXAYDBVMNJG-BOPFTXTBSA-N 395.509 5.059 30 20 GKED Cc1ccc(NC(=O)[C@H](Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 28373780 PTGOOGYLHGEFSF-HSZRJFAPSA-N 383.495 5.588 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2c(s1)CCCC2 49723966 ZXBNROCYXGXORB-UHFFFAOYSA-N 389.480 5.247 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)N[C@H](C)c1ccc(C#N)cc1 54839333 NARZTLPUJJMECV-ZBFHGGJFSA-N 390.512 5.112 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cccc(F)c2)cs1 54895224 UWGXQVMBHICEJP-DHZHZOJOSA-N 380.444 5.171 30 20 GKED COc1ccc(CCN(Cc2ccccc2)C(=O)Nc2ccc(CC#N)cc2)cc1 66158533 UJZZCEPVDDOAAV-UHFFFAOYSA-N 399.494 5.038 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nnc(-c2ccccc2)o1 66903751 HQPHOYGYVDKASK-MRXNPFEDSA-N 382.423 5.574 30 20 GKED CC(C)(NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1nccs1 116647230 CBWDTRSOYAGFSA-UHFFFAOYSA-N 397.887 5.126 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(CCC#N)Cc1ccco1 123709990 ALTGIECQTNXADT-UHFFFAOYSA-N 397.544 5.961 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2ccncc2)cc1Cl 129778000 PZTASIYKYPKJCH-IBGZPJMESA-N 393.899 5.121 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3nc(C(F)(F)F)cs3)c2)cc1 151912976 KHAFDLKZLJHUOX-UHFFFAOYSA-N 375.375 5.438 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCc2ncc(-c3ccccc3Cl)o2)n1 177743234 DNGFGJOYAZEQMT-CQSZACIVSA-N 399.903 5.384 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(NC(=O)c3cccs3)c2)n1 177766436 KSMXLNSZZGJOIP-OAHLLOKOSA-N 395.509 5.070 30 20 GKED COc1cccc([C@H](N[C@H](C)c2cccc(C#N)c2)c2cc(F)ccc2OC)c1 181847701 XHOKBPSGNLSFFZ-GYCJOSAFSA-N 390.458 5.155 30 20 GKED N#C[C@H](C(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)c1ccccn1 182866544 IXDIXINWTZVRQP-INIZCTEOSA-N 395.245 5.109 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)n1 245432266 NZZZZXBUHJANEX-MELADBBJSA-N 394.418 5.145 30 20 GKED N#Cc1c(Cl)nsc1Sc1nnc(-c2ccco2)n1C1CCCCC1 301932448 PHFGPKDEIPSCLJ-UHFFFAOYSA-N 391.909 5.176 30 20 GKED CC[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(F)cc1F 303756640 NGRGENLNXFIVCT-QFIPXVFZSA-N 376.406 5.385 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(O)=Nc1cccc(-c2nccs2)c1 329304823 ONWHTXXDHHWQNE-SFHVURJKSA-N 395.532 5.313 30 20 GKED CC(C)[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1ccc(F)cc1 410214961 KCTUOBAYQVYBJV-BDTNDASRSA-N 379.479 5.004 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 425639988 OVDSAXDAVSEETB-SCLBCKFNSA-N 385.920 5.151 30 20 GKED CC(C)C[C@@H](C)N(C(=O)c1ncc(C#N)cc1Cl)c1ccc2[nH]ccc2c1 431589033 IWNSASRJAVSRRE-CQSZACIVSA-N 380.879 5.169 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438658952 XNXSARPCGHMOLF-UHFFFAOYSA-N 379.357 5.160 30 20 GKED C[C@H](Oc1ccc(C#N)c(Cl)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 438918372 KKQLBMCDHGVHJW-VIFPVBQESA-N 394.645 5.708 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3ccccc3F)C3CCCCC3)o2)c1 441080866 QLTGUSPJPFHHHE-UHFFFAOYSA-N 390.462 5.082 30 20 GKED N#CC1CCC(CNC(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)CC1 442982749 MBPVUQDGRBUSSW-UHFFFAOYSA-N 399.441 5.091 30 20 GKED N#C[C@H](C(=O)c1ccc(C2CC2)cn1)c1nc(-c2ccc(Cl)cc2)cs1 447239497 SICTYGWTAZCZOK-MRXNPFEDSA-N 379.872 5.226 30 20 GKED N#CCCCn1cc(C(=O)N2CCC(F)(c3ccccc3)CC2)c2ccccc21 447613093 XRMSWIXHARTPPX-UHFFFAOYSA-N 389.474 5.046 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(OC)c1 448940912 BMNFAUZSNHKLLY-HNNXBMFYSA-N 384.501 5.131 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)C[C@H](c1ccccc1)C(F)(F)F 464957473 ZBYWILRFKZQHGZ-VAMGGRTRSA-N 386.417 5.021 30 20 GKED CC[C@@H](C)C[C@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 466162939 KCRWWFKGRYGGQB-MSOLQXFVSA-N 379.504 5.278 30 20 GKED Cc1cc([C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CC2)ccc1F 469212830 JNSZMGSMFYDLAK-DEOSSOPVSA-N 391.490 5.280 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1 474411825 MRPHJHRWYPKCHB-SFHVURJKSA-N 375.497 5.075 30 20 GKED CC(C)CCN1Cc2cccc(NC(=O)C[C@H](CC#N)c3ccccc3)c2C1 475587237 YKVJVCJRZMGLFY-FQEVSTJZSA-N 375.516 5.074 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)c3ccc(C(C)(C)C#N)cc3)c(C)c2c1 475652390 VREVTDGQMJBHOK-HNNXBMFYSA-N 376.456 5.042 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)cn1C(C)C 476123291 OQTZNLHUUKNJNI-UHFFFAOYSA-N 389.337 5.936 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Cl)c(Br)c1)c1ccccc1 476287807 OCKCRRVIYSXPGX-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED C[C@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)cc1F 480752938 ZSZRLUWHQKOBOZ-WLRWDXFRSA-N 391.259 5.401 30 20 GKED C[C@@H]1N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOC1(C)C 483057977 YXCPLGZFPYBURJ-KXBFYZLASA-N 397.906 5.027 30 20 GKED N#Cc1ccc(F)c(CNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1 487376523 MWLUEDHLVDACBD-UHFFFAOYSA-N 387.336 5.516 30 20 GKED COCc1ccsc1C(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 489383246 GJHTUBWPUXEHEQ-UHFFFAOYSA-N 394.471 5.061 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccc(F)cc3)c3ccccc23)cc1 494168503 OATVDVRDTUPFEA-FQEVSTJZSA-N 399.494 5.971 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)c(Cl)c3)CC2)cc1 503874325 NQDPZZLQUSDLPW-MOPGFXCFSA-N 397.305 5.284 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 505046638 WVFQPSKPENZXHP-QGZVFWFLSA-N 393.462 5.497 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc(-c3ccc4c(c3)CCC4)cs2)c1 511873599 OLIICMQSBGPAQJ-UHFFFAOYSA-N 379.872 5.076 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)CSCc1ccc(C#N)cc1 514420549 FHDHULAXACTTFP-CQSZACIVSA-N 392.446 5.030 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Br)s1 515689498 HPITVLNYEGZSDU-UHFFFAOYSA-N 389.299 5.363 30 20 GKED C=CCN(C(=O)[C@H]1C[C@@H]1c1cccc(OC)c1)c1nc(-c2ccccc2)cs1 519321160 AYUMPKHFFRANPK-UXHICEINSA-N 390.508 5.141 30 20 GKED C=CCCC(=O)Nc1cc(NC(=O)c2cccc(C(F)(F)F)c2)ccc1C 523252597 SAZZLXKSCCRCNW-UHFFFAOYSA-N 376.378 5.171 30 20 GKED N#Cc1csc(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)c1 534969584 YCHAOSLQEDYRLF-UHFFFAOYSA-N 395.189 5.120 30 20 GKED N#CCc1ccc(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)cc1 535448348 YBHYWJQOCDZCQT-UHFFFAOYSA-N 384.810 5.313 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cnc(-c4ccccc4)s3)cc2)nc1 536645036 MVWXBHQMKFBZCF-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC[C@@H](C)n1ncc2c(C(=O)Nc3cc(C(C)(C)C)sc3C#N)cc(C)nc21 536971293 DKHLUAXZZJTALZ-CYBMUJFWSA-N 395.532 5.194 30 20 GKED COc1ccc([C@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)c2ccc(C)cc2)cc1 537429647 VDZCULIIIXQUCD-XMMPIXPASA-N 396.490 5.078 30 20 GKED C=CCC[C@@H](N[C@@H]1CC(=O)N(C)c2ccccc21)c1ccc(C(F)(F)F)cc1 537950413 WCZVTEQGOIXTKV-RTBURBONSA-N 388.433 5.410 30 20 GKED C=C(C)[C@H](CC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1)OCC 541446237 MDKAAUXPEJLYGF-LSQMVHIFSA-N 393.527 5.124 30 20 GKED Fc1cccc(F)c1C(F)(F)c1nc(-c2ccccc2OC(F)(F)F)no1 545616603 UXMKOPCYFBFZMQ-UHFFFAOYSA-N 392.230 5.054 30 20 GKED CC[C@@H](CC#N)NC(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 545861893 VPFYUCMLTDVNBC-KSSFIOAISA-N 376.884 5.121 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ncsc3C(F)(F)F)n2)cc1 549086400 QRVQOBOEFYIXJW-NSHDSACASA-N 393.415 5.084 30 20 GKED N#CCCCCCC(=O)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 588905527 JCMSPGSJNHMHDB-UHFFFAOYSA-N 381.476 5.443 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596241672 VWWZKWRMHFYXBJ-YJBOKZPZSA-N 381.442 5.128 30 20 GKED N#CC1(CC(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CCOCC1 596944242 RTPSLNXHKMCYMF-UHFFFAOYSA-N 386.904 5.140 30 20 GKED C[C@H](SCc1cccc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCC2 604502215 JAQSKAZIMIZVEU-AWEZNQCLSA-N 392.549 5.522 30 20 GKED CC[C@H](c1ccc(F)cc1F)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606431682 LLBLSKOGOBIUCN-ISTVAULSSA-N 375.303 5.479 30 20 GKED CC(C)N(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 609058996 GBWHOHCNXJQFNH-UHFFFAOYSA-N 394.858 5.439 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1c(Cl)cccc1Cl 609287003 WOPXZLCRICTDTL-HNNXBMFYSA-N 389.213 5.387 30 20 GKED Cc1ccc([C@@H](NC(=O)Cc2ccc(C#N)cc2)c2ccc(F)cc2Cl)cc1 609374283 OFBDPKCYQFMIHE-HSZRJFAPSA-N 392.861 5.108 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)Nc3ccc(C#N)cc3)s2)cc1 610089281 RVFFOQHLDWIACB-INIZCTEOSA-N 390.512 5.524 30 20 GKED Cn1c([C@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccccc2)nc2ccccc21 611392630 ZSILOISMWMNZAU-WIOPSUGQSA-N 392.506 5.202 30 20 GKED CC(C)C[C@@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361798 BTLYZMNOBHDYND-IEBWSBKVSA-N 381.442 5.128 30 20 GKED C=CCOCCCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 618524785 PNENQIXSNHLVJS-UHFFFAOYSA-N 397.302 5.094 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCCc2nc(-c3ccccc3F)sc21 618805528 HITAGMJLBPPGMU-VQTJNVASSA-N 389.499 5.475 30 20 GKED CC(C)(c1ccc(C(=O)N2CCC3(CC2)C(F)(F)C3(F)F)cc1)C(F)(F)F 650353457 FVEPGVYPDWXISO-UHFFFAOYSA-N 397.334 5.033 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 678761094 XADJUUGANXHEMD-AWEZNQCLSA-N 399.516 5.738 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cnn1C1CCCC1 680167884 JSSWSCQQAWNCMM-HNNXBMFYSA-N 396.491 5.190 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2csc(-c3ccc(Cl)s3)n2)cc1 726940327 QWHGXYSLEMOKEZ-UHFFFAOYSA-N 387.917 5.394 30 20 GKED CC(=NNc1ccc(Br)cc1C)c1nc2ccccc2n1C(F)F 728432807 CAFTZDOZUWVASU-UHFFFAOYSA-N 393.235 5.338 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2ccccc2)C2CCC2)cc1 729552355 FPQSMSMOQORWDG-DQEYMECFSA-N 395.506 6.005 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccccc2C)cc1 734964560 CPCFEZZQANDARM-SGXKBVARSA-N 376.500 5.350 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)C[C@H](C)c1ccc(C(C)C)cc1 737530270 TWTZCIPYCBDXAR-IBGZPJMESA-N 385.511 5.439 30 20 GKED Cc1ccc(-c2nc(/C=C\C(=O)c3ccc(NC(=O)NC(C)C)cc3)co2)cc1 749890789 BJJDPTZBPQODEV-SEYXRHQNSA-N 389.455 5.076 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3ccc(Cl)s3)n2)cc1 750687032 JOVXKJJXKAHMMB-TZMCWYRMSA-N 386.929 5.813 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnoc3-c3ccco3)cc2F)c1 753900453 FZBGLYXZLHLANS-UHFFFAOYSA-N 389.386 5.136 30 20 GKED O=C(/C=C/c1nc(-c2cc(Cl)ccc2Cl)cs1)c1cncc(F)c1 753901105 WJZQESJSDYLEJJ-ONEGZZNKSA-N 379.243 5.547 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2SC(F)F)c(Cl)c1 754718318 AJWRSLQZJUYOIC-UHFFFAOYSA-N 384.860 5.257 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCc3cc(Cl)sc3Cl)[nH]c12 756289771 JBCHRWCSGCSCKZ-LBPRGKRZSA-N 392.311 5.439 30 20 GKED C#CC[C@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccccc1 757773847 QYZHSZSZBNJTOA-FQEVSTJZSA-N 386.417 5.144 30 20 GKED CN(C(=O)c1cnn(CCC#N)c1-c1ccccc1)c1ccc(C(C)(C)C)cc1 758126388 NHCSVMMPBHSQMC-UHFFFAOYSA-N 386.499 5.038 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COC/C=C\c3ccccc3)n2)cc1 763479766 XKKAKYADGLCIJU-DASIIQCKSA-N 388.492 5.025 30 20 GKED C[C@H](NCc1ccc2c(c1)COC(C)(C)O2)c1ccc(-c2cccc(C#N)c2)cc1 769550131 AJGQQMGNVWPNLG-SFHVURJKSA-N 398.506 5.721 30 20 GKED C#CCOc1ccc([C@H](C)Nc2ccc(NC(=O)N3CCCCCC3)cc2)cc1 777232575 UTXFNROFODYFPQ-IBGZPJMESA-N 391.515 5.280 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)c1ccccc1 780678948 ZKXTVDMDVKJVQT-AVRDEDQJSA-N 385.467 5.083 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792092490 BZFYEKZCOHXIFJ-KUHUBIRLSA-N 382.385 5.309 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nc2ccccc2n1C(F)F 795981814 FHSSUPCRXQXMFD-GDBMZVCRSA-N 383.398 5.123 30 20 GKED C=CC[C@H](OC(=O)CCCc1nc(C2CC2)no1)c1ccc(Cl)c(Cl)c1 797566980 WTBOQZQJELJTDY-INIZCTEOSA-N 395.286 5.437 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c(Cl)c1 797570767 KBBVCAKBDUYVSO-CQSZACIVSA-N 390.936 5.438 30 20 GKED CC(C)(CCC#N)COC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 798877073 FOUVACQQJKLALD-UHFFFAOYSA-N 397.327 5.533 30 20 GKED Cc1cc(NCc2ccc(C#N)cc2C(F)(F)F)ccc1OC1CCOCC1 810149591 BOYBELNNJUZZME-UHFFFAOYSA-N 390.405 5.055 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 813213806 QBIJMDOFSMJRIE-OCCSQVGLSA-N 390.258 5.006 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1 815635701 HVUWEWHTZDZKAA-GHTZIAJQSA-N 385.552 5.047 30 20 GKED CCCCCCCCCC(=O)N1CC[C@H](C(F)(F)F)C2(CCOCC2)C1 837773622 MFJUVCGGYJBQCB-KRWDZBQOSA-N 377.491 5.335 30 20 GKED CC(C)(C)OC(=O)CCCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 846819034 VPHUPLSCJKQMFA-NRFANRHFSA-N 392.499 5.183 30 20 GKED N#C[C@H](C(=O)Cc1ccc(OCc2ccccc2)cc1)c1nc(C2CC2)cs1 851100382 IBVKJSOKPUPUQL-HXUWFJFHSA-N 388.492 5.018 30 20 GKED CC[C@H](c1ccccc1)N(CC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)C(C)C 852690971 UYEOYKWXUGXUNK-RBBKRZOGSA-N 398.510 5.085 30 20 GKED C=CCCC[C@@H](C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1)c1ccccc1 883979052 ARTMEBGAHTVPLJ-OAHLLOKOSA-N 393.371 5.470 30 20 GKED Cc1ccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1F 915124576 QEDNJCVZSLIIBP-FQEVSTJZSA-N 375.472 5.599 30 20 GKED N#Cc1cccc(OCC(=O)Nc2ccccc2Oc2ccccc2Cl)c1 916116491 DSPLKRDFYWAXRT-UHFFFAOYSA-N 378.815 5.021 30 20 GKED COc1cc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc(OC)c1OC 917517623 TUHNPMOITLNMFZ-MDZDMXLPSA-N 380.465 5.337 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 919910059 KGQMJLXFRILNTF-HNNXBMFYSA-N 377.469 5.603 30 20 GKED CCN(C(=S)Nc1cc(Cl)cc(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 920993530 TZXZTVXOASOCCE-LBPRGKRZSA-N 378.328 5.645 30 20 GKED Cc1cc(Oc2ccc(C=NNc3cccc(C(=O)O)c3)c(Cl)c2)ccc1F 1776037816 DNGFEISQVDRUEX-UHFFFAOYSA-N 398.821 5.724 30 20 GKED CCC(Cc1ccc(Cl)cc1Cl)=NNc1ccc(C(=O)O)cc1OC 1776049999 NATHXFLLVKJEQO-UHFFFAOYSA-N 381.259 5.121 30 20 GKED Cc1c(NN=C2CCCc3nc(-c4ccccc4F)sc32)cccc1C(=O)O 1776087069 GQYFWLUEBCXYQZ-UHFFFAOYSA-N 395.459 5.108 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)cc1 1776125835 UASRDBSRHWJMLJ-XMCSSRMMSA-N 398.474 6.015 30 20 GKED C[C@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2c(O)ccc(F)c21 1776586863 ZDPOYEFVTHTHSA-SAIXKJTDSA-N 394.423 5.341 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccc(C)cc2)cs1)c1ccc(F)cc1F 15187867 SAZCEQRJJXRSSM-CSKARUKUSA-N 398.434 5.310 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nc2ccccc2o1 41543119 GDDFZWYCLFOUDR-CYBMUJFWSA-N 379.828 5.095 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 41554383 STYWOUJAIQJVLA-LLVKDONJSA-N 393.415 5.084 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(Br)cc2)s1)c1ccccn1 49458413 WPHKBULMFYYABC-CQSZACIVSA-N 383.270 5.063 30 20 GKED CN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1cccc2ccccc12 56225758 GLJDQPQHDZRLBG-UHFFFAOYSA-N 382.419 5.160 30 20 GKED CN(CC1CCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 58424562 NBYXQRRWISAHEO-HXUWFJFHSA-N 381.907 5.649 30 20 GKED N#C[C@H](C(=O)[C@H](Oc1cc(Cl)ccc1Cl)c1ccccc1)c1ccccn1 106983644 ZHFUOWCDRGMTRL-HRAATJIYSA-N 397.261 5.385 30 20 GKED Cc1ccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 115798392 XGOPDAGJLPTNBW-IBGZPJMESA-N 380.900 5.547 30 20 GKED Cc1cncc(/C=C/C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 127677343 AUGXEFMHVXXLIV-ZZXKWVIFSA-N 391.418 5.067 30 20 GKED COc1ccc(CNc2ccccc2CC(F)(F)F)cc1OCCCC#N 151785531 QNQFKRGZCVDCEM-UHFFFAOYSA-N 378.394 5.095 30 20 GKED CC[C@H](CC#N)NC(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 158645840 PPMFJSXINURQJI-HXUWFJFHSA-N 376.504 5.144 30 20 GKED N#CC1CCN(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)c3)cc2)CC1 160095235 YYOYZSSENQXIFM-UHFFFAOYSA-N 389.377 5.265 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3ccccc3F)n2)cc1 170673826 OEHZTLKGCFCVIM-KDOFPFPSSA-N 394.471 5.328 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccc(F)cc2)c2cnn(C)c2)cc1 186646467 LWFNSNNJIVMVRK-ZHRRBRCNSA-N 399.897 5.131 30 20 GKED C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)c1cccc(C#N)c1 189784042 GBTCFHYOIKWOPP-MRXNPFEDSA-N 383.480 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Br)s1 189883289 LTMBSKBJYCQTAH-UHFFFAOYSA-N 378.335 5.544 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 189898525 BKBQSMKRXQVLIU-UHFFFAOYSA-N 398.459 5.106 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCN(Cc2ccccc2)CC1 191501656 IRBZSSVXTZENJJ-UHFFFAOYSA-N 391.559 5.278 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@H](c2ccccc2)C1 191516644 WJOUUYWBSNBEDX-AVRDEDQJSA-N 378.516 5.532 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@]2(CCc3ccccc32)C1 191517649 QSVADESXOVNPEH-RUZDIDTESA-N 390.527 5.244 30 20 GKED Cc1nc(C2CC2)oc1/C(O)=N/C1(c2cccc(Br)c2)CCC1 329768775 DYAJCYBWZQZFFQ-UHFFFAOYSA-N 375.266 5.007 30 20 GKED O/C(=N/[C@@H]1CC2(CCCC2)Oc2ccccc21)N1CCC(c2nccs2)CC1 330125972 INQMSHMXGWAJDP-GOSISDBHSA-N 397.544 5.073 30 20 GKED C=CCC[C@@H](NC(=O)c1cn(C)nc1C(C)(C)C)c1ccc(C(F)(F)F)cc1 426260854 LOVUCVIDMSCFBM-QGZVFWFLSA-N 393.453 5.174 30 20 GKED C=CCCOCCNC(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 430810686 MLVWXXXCKAOXGN-UHFFFAOYSA-N 397.302 5.094 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc3c(ccn3Cc3ccccc3)c2)n1 433186363 DUFMZHGQIORERF-FQEVSTJZSA-N 399.519 5.760 30 20 GKED COc1ccc2ccccc2c1CNC(=O)c1cn(CCCC#N)c2ccccc12 434227988 LBFYPTGKWQRHTE-UHFFFAOYSA-N 397.478 5.037 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(SCc2ccccc2Cl)cn1 436101972 KPJPHYVAYNCWTC-UHFFFAOYSA-N 383.860 5.053 30 20 GKED CC[C@H](C)c1ccc([C@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 437643840 CYBNDVALMMKLSJ-GAJHUEQPSA-N 388.515 5.609 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 438046457 XQDJYEIZUBAKOS-UZLBHIALSA-N 399.535 5.609 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)[C@H]1Oc2ccccc2[C@H]1C 438645285 XMSHWPKEQKGQGT-PFKNGNAYSA-N 395.528 5.156 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H]3CCC[C@H]32)cc1 444386284 DLGNMUOSRWIWHS-FXAWDEMLSA-N 391.471 5.156 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)cc1OCC(F)F)c1ccccc1 455078270 UNXQTWJTLQJVHN-MRXNPFEDSA-N 391.393 5.026 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 466192868 FGLYFSKZYGAIHT-GOSISDBHSA-N 392.261 5.051 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 466392580 NQKPIAVGXWDKHZ-SJORKVTESA-N 399.560 5.062 30 20 GKED N#CCCCn1cc(C(=O)NC2(c3ccc(Cl)cc3)CC2)c2ccccc21 469403593 IBPPDPOFKCEWHM-UHFFFAOYSA-N 377.875 5.018 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1 474949601 TVFMATYTCMLAKL-UHFFFAOYSA-N 397.450 5.066 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2c2ccc(Br)cc2)cc1 475021684 FNWNJJZWILGXRA-LJQANCHMSA-N 397.316 5.228 30 20 GKED C[C@H](CCNC(=O)C[C@H](CC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 476207729 OGPPNHQKGRSXEL-APWZRJJASA-N 388.433 5.403 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F 477524403 CHOFPLGTIKNNET-IUODEOHRSA-N 387.471 5.569 30 20 GKED C=CCC1(C(=O)NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCC1 479878394 WDOWCIHZWVVUCP-UHFFFAOYSA-N 380.435 5.192 30 20 GKED C[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1c(F)cccc1F 482440240 WVGUCJCAIVNHCY-CQSZACIVSA-N 378.378 5.120 30 20 GKED C[C@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)N1[C@H]2CC[C@H]1c1ccccc12 483065408 CYTHDKDMRDGYRL-UAOJZALGSA-N 391.540 5.107 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 483480859 XHLRQWLSVIATNH-CQSZACIVSA-N 391.496 5.463 30 20 GKED C=CCCCCCN(C)C(=O)c1coc(-c2ccc(Br)cc2F)n1 485661272 GZVZSNKECGQEBS-UHFFFAOYSA-N 395.272 5.062 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1)c1ccccc1 488695362 HKGWYMUTIVKGOT-SFHVURJKSA-N 384.907 5.168 30 20 GKED CC[C@H](c1ccc(F)cc1F)[S@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488805632 MTOTWZSPAHBFIN-AKJBCIBTSA-N 398.343 5.662 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C)c(OCC2CCOCC2)c1)c1ccccc1 489006662 DCAAMLCXCPSILA-QFIPXVFZSA-N 379.500 5.099 30 20 GKED CC[C@H](C)Sc1ccc(NCC(=O)Nc2ccccc2SCC#N)c(C)c1 498636267 ALAMVOUWLGOENQ-INIZCTEOSA-N 399.585 5.552 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccccc1Cl 499956878 KFKRTVORBSRZSU-VBQJREDUSA-N 379.674 5.131 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccc(F)cc2)c2nc3ccccc3s2)cc1 501770628 OEMQCPQQDUEFDC-UHFFFAOYSA-N 387.439 5.154 30 20 GKED CC[C@@H]1C[C@@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCO1 502924262 HGZTUFBGWGEZAQ-DOTOQJQBSA-N 384.863 5.148 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCc3ccc(-c4ccccc4)o3)CC2)cc1 503879274 VWWQYNQBPMOCKN-UHFFFAOYSA-N 382.463 5.067 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(C)noc2C(C)C)cc1 505615971 ABOCUVUQJQMEAB-UHFFFAOYSA-N 391.427 5.031 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1sccc1Cl 510817371 WYXLGSBYVWYOHZ-UHFFFAOYSA-N 382.872 5.413 30 20 GKED Cc1cc(C)c(C#N)c(SCC(=O)c2cc(C)n(Cc3cccs3)c2C)n1 511186446 LHQQZQABXJCCQB-UHFFFAOYSA-N 395.553 5.073 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCc2cccc(F)c2)c1)c1ccc(C#N)cc1 511354947 IUQSWLXSAHNSLR-INIZCTEOSA-N 389.430 5.159 30 20 GKED C=CCOc1cccc(NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)c1 517659539 KKFDOBDGXYTGKR-UHFFFAOYSA-N 377.440 5.080 30 20 GKED CC(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)cc1 518906095 VXQCPWVYVGRTAX-MRXNPFEDSA-N 380.513 5.226 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(OCCCC#N)c1 523101409 HVZFCKFMWONXHQ-HNNXBMFYSA-N 390.405 5.205 30 20 GKED Cc1ccc([C@H]2CCCN2CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 532745367 WRFAHQLXYDEXMG-WIYYLYMNSA-N 393.556 5.165 30 20 GKED COc1cccc([C@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)c1 537295819 RASBATJCHSUEFG-MWTRTKDXSA-N 376.887 5.660 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c(C#N)s1 538072737 NUOGJAKOPULEQK-UHFFFAOYSA-N 397.378 5.097 30 20 GKED C[C@H](NCC#Cc1ccccc1Cl)c1ccc(OCc2cccnc2)cc1 538126507 XCMFKDLYKRFRCN-SFHVURJKSA-N 376.887 5.016 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@@H]1c1cccnc1 557375865 DBXOVFNJFQFEEQ-HSZRJFAPSA-N 397.478 5.163 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(c3c[nH]c4ncccc34)CC2)cc1 558271572 RWOROGDHLNXUQU-UHFFFAOYSA-N 392.506 5.481 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)CC[C@@H]1c1ccccc1 562168813 LLGSDXUJFZPYII-LVCYWYKZSA-N 393.556 6.086 30 20 GKED CN(C(=O)Cc1ccc(NCc2ccc(Cl)cc2C#N)cc1)c1ccccc1 562309268 CTKXARFZGYMJBI-UHFFFAOYSA-N 389.886 5.029 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)NCc3ccc4ccccc4c3)cc2)ccn1 570607725 IWPIVOKFNNGNOP-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C=C1CCN(c2nnc(CSc3ccc(C)cc3)n2Cc2cccs2)CC1 583643948 HUHLXTFGQJHEIO-UHFFFAOYSA-N 396.585 5.145 30 20 GKED N#Cc1ccc(CN[C@@H]2CCSc3ccc(Cl)cc32)c(C(F)(F)F)c1 584561582 QAXKQFHKANJSAE-MRXNPFEDSA-N 382.838 5.557 30 20 GKED COc1ccc(-c2cc(NC(=O)CCCCCC#N)ccc2OC(F)F)cc1 588147460 NRPYFGOBCVPAAC-UHFFFAOYSA-N 388.414 5.376 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4ccccc4n3CC#N)n2)cc1 591861756 DDSBXUQWHGJBLH-SFHVURJKSA-N 396.475 5.087 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccncc1 596736987 XTRPOCIMHDZEHP-UZLBHIALSA-N 392.528 5.235 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CSc1ccccc1 603532830 XMWMTAQHOVKAGV-UHFFFAOYSA-N 390.483 5.331 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3csc(-c4cccs4)n3)c2C#N)C1 604513965 FRYIVUOKWFHFSU-SNVBAGLBSA-N 385.539 5.182 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NC3(c4ccccc4)CC3)c2)cc1 608841269 NFSRQCFCMLGYIW-UHFFFAOYSA-N 397.478 5.142 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 609398836 VXZHZDCEKWZUAY-WMZOPIPTSA-N 381.545 5.780 30 20 GKED CCCN(C(=O)CCCCOc1cccc(C#N)c1)[C@H]1CCc2ccccc21 609499636 VYLBSOTWIVESBN-QHCPKHFHSA-N 376.500 5.033 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3cccc(C#N)c3)s2)cc1 610050811 KQYGKDFNKMOGQK-MRXNPFEDSA-N 375.497 5.132 30 20 GKED CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610321158 JFKOPXVBHZLPIZ-JXFKEZNVSA-N 378.476 5.178 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H]1F 611503328 WMKGXHZVTIEXSH-WNYOCNMUSA-N 385.870 5.207 30 20 GKED C=CCn1c(S[C@@H](C(=O)C2CC2)c2ccccc2)nnc1-c1ccccc1C 647118859 QDXIQNJTXDNFJM-OAQYLSRUSA-N 389.524 5.252 30 20 GKED C[C@@H](C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cccnc1 648494586 ZNLRSCVHGFPWSM-SNVBAGLBSA-N 394.290 5.113 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 684226781 XDVUXRWTAQXYER-UHFFFAOYSA-N 375.472 5.569 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)/N=C\c1ccc(O)c(O)c1O 730148020 XXAUXQHPNCPXHD-UQXWMBKDSA-N 388.876 5.069 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2cccc(OC(F)(F)F)c2)c1 730949441 WHTJHCCUCRMMCC-MDZDMXLPSA-N 375.346 5.164 30 20 GKED Cc1ccc(CN2C(=O)c3ccccc3N[C@@H]2c2ccc(O[C@@H](C)C#N)cc2)cc1 731298552 KDOHDXJJZMPLQF-UUOWRZLLSA-N 397.478 5.053 30 20 GKED C[C@H](SCCC(=O)Nc1sc2c(c1C#N)CCCC2)c1cccs1 737403631 ICVDUNVKZGXFFX-LBPRGKRZSA-N 376.572 5.383 30 20 GKED CN(Cc1ccccc1Cl)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740059481 JMHBLJLVCWFUJT-UHFFFAOYSA-N 395.915 5.282 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)nc1)c1ccc(SCC(F)F)cc1 741843141 NPYOJRKNKUAALX-WDZFZDKYSA-N 382.435 5.397 30 20 GKED COc1ccc(OCc2ccccn2)c(C=NNc2c(C)cc(C)cc2C)c1 743445431 UIAHLCUNQFWKTQ-UHFFFAOYSA-N 375.472 5.040 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)c1ccco1 744035180 LDEXTILXWBMOBB-GWCFXTLKSA-N 391.279 5.690 30 20 GKED CCOC(=O)Nc1ccc(NC(=S)Nc2c(CC)cccc2CC)cc1C#N 752763842 AOUBBOXYSUTDFZ-UHFFFAOYSA-N 396.516 5.060 30 20 GKED C=CCCO[C@@H](C)C(=O)O[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753355968 SKCAYXPJBGYLIG-RYUDHWBXSA-N 384.259 5.234 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(Cl)s3)cc2Cl)c1 760297808 XDTPNZROYPKSPW-UHFFFAOYSA-N 390.295 5.513 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)c1 760349468 AHRQWCBCSNXNIU-UHFFFAOYSA-N 382.419 5.183 30 20 GKED O=C(/C=C/c1c(Cl)oc2ccccc12)c1cc(Br)ncc1F 762422805 MILZMGOPWJAHMC-AATRIKPKSA-N 380.600 5.279 30 20 GKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C/c1csc(-c3ccccn3)n1)CCO2 767737746 PSAQWGZRIDQZFV-JLHYYAGUSA-N 382.872 5.216 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(C(=O)N2CCCCC2)CC1 774806848 SWUFQSOVHWXIBW-HXUWFJFHSA-N 378.601 5.014 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](Cc1ccccc1)c1ccccc1F 775455390 RDLCJQNCNATBLE-JOCHJYFZSA-N 394.877 5.455 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)ccc1OC 776165996 ZSSYWWWGYFNKPN-NHCUHLMSSA-N 398.522 5.782 30 20 GKED N#CCc1ccccc1CC(=O)Oc1ccccc1-c1nc2ccccc2s1 776745706 ZBNNRNASEZIXDG-UHFFFAOYSA-N 384.460 5.177 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc(Cl)n1 777638786 XSXURWGGPHWHKW-UHFFFAOYSA-N 391.858 5.055 30 20 GKED COc1cccc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1O 779596116 SFSYPDROAQLEGK-UHFFFAOYSA-N 394.858 5.117 30 20 GKED CN(C(=O)CNc1ccccc1SCc1ccccc1)C1(C#N)CCCCC1 780653910 VEQMACCQTOAKRM-UHFFFAOYSA-N 393.556 5.076 30 20 GKED C[C@H](Cc1ccccc1)NC(=S)N(Cc1ccccc1)c1ccccc1C#N 786070168 BYUQEUORMVGPMH-LJQANCHMSA-N 385.536 5.071 30 20 GKED N#Cc1ccccc1C(=O)/C=C\c1csc(COc2ccc(Cl)cc2)n1 799500468 WSTNGDXZPXMMOB-YFHOEESVSA-N 380.856 5.143 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 806200964 QKJIFYVTXJNSGL-NGXZDTIWSA-N 395.506 5.957 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 808817468 GYKCUDFMWDZQFY-ABAIWWIYSA-N 381.785 5.068 30 20 GKED O=C(/C=C/c1csc(-c2ccc(F)cc2)n1)c1ccc(Br)nc1 811697448 SQBKCDJFBDTZLX-VOTSOKGWSA-N 389.249 5.003 30 20 GKED CC(C)(C)Sc1ccc(NCc2nnc(-c3cccc(C#N)c3)o2)cc1F 834633162 CGNFQYHSGZSQBZ-UHFFFAOYSA-N 382.464 5.250 30 20 GKED C=C(Cl)C[C@@H](NC(=O)OC(C)(C)C)c1nc(-c2cccc(Cl)c2)no1 904287941 DDNGJKFWGJHUDC-CYBMUJFWSA-N 384.263 5.098 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 914490938 LLVSPJDASGCYGM-BENRWUELSA-N 376.456 5.098 30 20 GKED O=C(O)c1cc(NN=CC2=Cc3cc(Cl)cc(Cl)c3OC2)ccc1Cl 1776033372 STQKEWFBZLEOBK-UHFFFAOYSA-N 397.645 5.219 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)cc1 1776125833 UASRDBSRHWJMLJ-LEHPZIBWSA-N 398.474 6.015 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc4ccccc4c3)cc2)cc1 1776131358 PFMIUSBDKDWAJV-APSNUPSMSA-N 378.427 6.101 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1776341423 HGIXOWQLELQFET-LUAWRHEFSA-N 390.504 6.208 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cn(C(C)(C)C)nc1C(C)C 1776355020 ZHGQSWRUKWDHER-CSKARUKUSA-N 398.503 5.143 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1-c1ccccc1 1776355471 QFFVMJCEMJVXPO-OWBHPGMISA-N 386.447 5.735 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cccc3cc(Cl)ccc23)c1)C(=O)O 1776471318 OHDKMBACXDXSSX-BMGYJQCNSA-N 380.827 5.241 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776472195 YPQLWGMVAHAXEQ-AZWQULSGSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(C(F)(F)C(F)(F)F)cc1 1776784117 JXQMUZJPVCWQGM-MRXNPFEDSA-N 395.412 5.634 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)c1 7744257 BMXHNPPZYIYQIY-MDZDMXLPSA-N 382.872 5.318 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCC(=O)Nc2ccccc2C(C)C)n1 21514540 JYRXQEJCLZBGGO-UHFFFAOYSA-N 393.434 5.135 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1ccc(C(F)(F)F)cn1 41555617 OBUOTTGPMRYAAL-GOSISDBHSA-N 382.341 5.383 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccc1)c1cccc(N2CCOC2=O)c1 60095094 LTIPBGSLPPOIBJ-BUHFOSPRSA-N 399.446 5.118 30 20 GKED CCc1cccc2c(CC(=O)Nc3ccccc3SC[C@@H](C)C#N)c[nH]c12 109211985 HFNOBRXNQCLEOT-HNNXBMFYSA-N 377.513 5.163 30 20 GKED C#CCCCCC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 119731052 ZTHSORXUJLDTRM-UHFFFAOYSA-N 375.299 5.111 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1nc(-c2ccc(Cl)cc2)no1 123473720 HXBNNDGUUZASCP-AWEZNQCLSA-N 382.851 5.246 30 20 GKED N#C[C@H](NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1ccccc1F 161346092 NNCNDUFNKFBBKK-NRFANRHFSA-N 397.409 5.142 30 20 GKED Cc1ncc(CN(C)C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 179097096 DYZYPKPBSVYWFI-UHFFFAOYSA-N 397.887 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)O[C@H](c2ccsc2)C1 191421012 CCPWBLIASSCGCK-JXFKEZNVSA-N 384.545 5.594 30 20 GKED CC(=O)Nc1cccc([C@H](C)NCCC(C#N)(c2ccccc2)c2ccccc2)c1 193084706 WIWUTQCMDPXMMN-FQEVSTJZSA-N 397.522 5.196 30 20 GKED CSc1ccccc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 194261869 HWJINSPTGGFYPP-UHFFFAOYSA-N 376.506 5.360 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCSc1ccc(OC)cc1 247906049 IFAGVUITZIXRLQ-UHFFFAOYSA-N 381.950 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1nccs1)C(F)(F)F 297969054 YPCJZOVIASAJLH-HNNXBMFYSA-N 383.439 5.420 30 20 GKED N#CCC[C@@H](Nc1nn2cc(-c3ccc(Cl)cc3)nc2s1)c1ccccc1 302496903 KJMDPGIYQGIDEC-QGZVFWFLSA-N 393.903 5.568 30 20 GKED N#CCCC[C@@H](NCc1nnc(-c2cc3c(s2)CCCC3)o1)c1ccccc1 433017017 WQGNRWCESIHMCW-GOSISDBHSA-N 392.528 5.202 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1 433157056 LBEYDUVMHYSGGV-RDJZCZTQSA-N 399.947 5.756 30 20 GKED N#CCCCOc1cccc(CN[C@H]2C[C@H](c3ccc(C(F)(F)F)cc3)C2)c1 435780840 GSPWQONSGZPFLZ-KESTWPANSA-N 388.433 5.424 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1Br 437670051 PWLBCOAQYUEDHJ-PKOBYXMFSA-N 398.304 5.061 30 20 GKED Cc1cc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)ccc1OC(C)C 438405640 WYJBKUAWLBMBSB-NHCUHLMSSA-N 377.488 5.086 30 20 GKED O=[S@@](Cc1cccc(NCC#Cc2ccc(Cl)cc2)c1)c1ccccc1 442119857 DEBLJIZKUJFJDH-SANMLTNESA-N 379.912 5.111 30 20 GKED N#Cc1ccc(NC(=O)C2(c3cc(F)cc(C(F)(F)F)c3)CC2)c(Cl)c1 445797031 DZPRMWMKTYAXMS-UHFFFAOYSA-N 382.744 5.040 30 20 GKED CN1CCC[C@@H](CNC2CCC(C)(C#N)CC2)[C@@H]1c1ccc(C(F)(F)F)cc1 449153736 FUTPSPPMKHCSBS-AFVILVPDSA-N 393.497 5.150 30 20 GKED C=CCC[C@H](NC(=O)N1CC[C@H](OCC)[C@H](C)C1)c1ccc(C(F)(F)F)cc1 454706462 KAXSTBTWQVFEAT-MNEFBYGVSA-N 398.469 5.169 30 20 GKED Cc1sc([C@H](C)NC(=O)N(C)CC(C)(C)C#N)nc1-c1ccc(Cl)cc1 458528537 PZLMHOIOQUMUAM-LBPRGKRZSA-N 390.940 5.024 30 20 GKED CCCN(C(=O)c1cccc(C#N)c1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 461532250 GFBSGAUCSZYJQH-HSZRJFAPSA-N 387.458 5.043 30 20 GKED N#C[C@@H](NC(=O)C1CCC(c2ccccc2)CC1)c1ccc(Br)cc1 463312584 XCWUKAHMSNMOCM-OUNSHVDWSA-N 397.316 5.104 30 20 GKED N#C[C@H](C(=O)c1cccc(Nc2ccccc2)c1)c1cc(C(F)(F)F)ccn1 464472350 OPOWWLDCQGOVBY-SFHVURJKSA-N 381.357 5.334 30 20 GKED Cc1cccc(COc2cccc(NCc3nnc(-c4cccc(C#N)c4)o3)c2)c1 471660481 XSCVGSHBMSIMNS-UHFFFAOYSA-N 396.450 5.108 30 20 GKED N#CC[C@H](CC(=O)N1CCC(c2cccc3ccccc23)CC1)c1ccccc1 475365317 COOZFXSFNGVUKB-HSZRJFAPSA-N 382.507 5.633 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COC2CCCCC2)c1)c1ccc(C#N)cc1 480316530 KLCGNKXPGGOKEM-QGZVFWFLSA-N 377.488 5.290 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C 480548283 BXAYLTOAYVVAHD-IRXDYDNUSA-N 386.499 5.192 30 20 GKED CCCCN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 483063436 VJGDKKSOZRFTFB-UHFFFAOYSA-N 376.378 5.155 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1nccc2ccccc12 483228538 NDRRRJHHZJABCW-PGRDOPGGSA-N 379.463 5.330 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)C1 485782552 IERSAGPRUPGOCG-UHFFFAOYSA-N 392.499 5.060 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)o2)cc1 487266691 JHUWLASQLUVPDW-NRFANRHFSA-N 386.451 5.314 30 20 GKED CCOc1cc(CN(C)Cc2ccccc2C(C)(C)C#N)ccc1OC(F)F 487411609 PRFYJZUUZVPFTC-UHFFFAOYSA-N 388.458 5.120 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1 490546751 PSXQOPSXXAJNTB-QFIPXVFZSA-N 391.421 5.136 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2ccc(C#N)cc2Cl)cc1OCC 494613734 RIVPOIUGGVXVNY-UHFFFAOYSA-N 393.270 5.305 30 20 GKED N#Cc1ccccc1CSCCN[C@H](c1cccnc1)c1cc2ccccc2o1 497518209 LAUGLBBIIBGEAX-XMMPIXPASA-N 399.519 5.312 30 20 GKED C[C@@H](c1ccccc1)N1CCC(NC2CCC(C#N)(c3ccccc3)CC2)CC1 507638955 VIGYPVUFJPTRFP-YFPLAWBCSA-N 387.571 5.206 30 20 GKED CCOc1ccc(-c2nc(CSc3ccc(C#N)cc3)cs2)cc1OC 509638050 HWMRPTZRGOTOOK-UHFFFAOYSA-N 382.510 5.381 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)c1 515286595 QWLYXFRDBRAWSC-UHFFFAOYSA-N 392.405 5.197 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3Cc3ccccc3)c2)cc1 517905598 LIQKYNBMRTUWMA-JOCHJYFZSA-N 397.478 5.590 30 20 GKED Cc1cc(C)c(CSCC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 518656371 RFSQEEFINVLQSH-MRXNPFEDSA-N 398.597 5.736 30 20 GKED CCc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cnn1C(C)(C)C 519033373 XJCRYKYSPVAIMP-UHFFFAOYSA-N 388.471 5.117 30 20 GKED N#C[C@H](NC(=O)C1CC(c2cccc(F)c2)C1)c1c(Cl)cccc1Cl 522204318 VGTSYMZQGWHGPV-FVKWTLKZSA-N 377.246 5.007 30 20 GKED CC1(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CCCCC1 522618268 QCOQOMRVINQTGC-UHFFFAOYSA-N 377.488 5.176 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 524163814 POVMIQXPNRIADO-UHFFFAOYSA-N 386.455 5.188 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3CCC[C@H]2CC3)cc1Cl 530979539 AGIPCVXANTXPLS-BJLQDIEVSA-N 379.891 5.544 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)Nc3ccc(C#N)cc3Cl)c(C)c2c1 533199263 SWXDREOCFDVWRL-UHFFFAOYSA-N 380.831 5.040 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542060188 BDUPLQZANPLXEM-QZTJIDSGSA-N 376.500 5.188 30 20 GKED COc1cccc([C@H](NCc2cccc(C#N)c2F)c2ccccc2Cl)c1 542222100 BOUJVRRZKRVOAQ-QFIPXVFZSA-N 380.850 5.239 30 20 GKED COc1cc(C)ccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 548709391 HOWURMZCWHUAQC-INIZCTEOSA-N 382.872 5.271 30 20 GKED CSCc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 558343905 JSJPLLLDTNOMRF-OAHLLOKOSA-N 385.558 5.266 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@H]1c1ccc(F)cc1F 558532475 FZRXRTMXXQZORP-SFTDATJTSA-N 388.417 5.173 30 20 GKED Cn1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(C2CCCCC2)n1 588739091 VXZCNSGHXSCFAF-AWEZNQCLSA-N 398.919 5.221 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2OCc2csc(C)n2)c1 589381912 BBUGGABGHGDTGM-UHFFFAOYSA-N 394.496 5.238 30 20 GKED N#Cc1ccc(CN(Cc2ccccc2)CC2CCOCC2)c(C(F)(F)F)c1 589498260 SIUGPTRVMFXYLK-UHFFFAOYSA-N 388.433 5.006 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 590942325 JPIQMADGLABWOU-JOCHJYFZSA-N 379.504 5.052 30 20 GKED Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)CC3(C#N)CC3)sc2c1 590974657 YYXGADLADNBRAA-UHFFFAOYSA-N 375.497 5.140 30 20 GKED N#CC1(c2cccc(-c3cc(F)ccc3OCC(F)(F)F)c2)CCOCC1 596639724 SXSPLVBETHTBPZ-UHFFFAOYSA-N 379.353 5.006 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc4[nH]c5c(c4c3)CCCCC5)[nH]c12 605362959 BABVYOFKHQTRBA-GOSISDBHSA-N 382.467 5.112 30 20 GKED Cn1c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc2ccccc21 609105378 XXRKOTTZWMCQMB-UHFFFAOYSA-N 399.425 5.020 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCCC1 609399149 BEXZHRIEUYYASX-HTAPYJJXSA-N 393.556 5.991 30 20 GKED CCCCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@H](C)CCC 609502033 PQTNPSSBAJXXQR-GOSISDBHSA-N 379.504 5.567 30 20 GKED Cc1ccc(-c2ccc(CN(C(=O)c3ccc(C#N)nc3)C(C)C)s2)cc1 609643186 AAUJBEQMKDTIMN-UHFFFAOYSA-N 375.497 5.041 30 20 GKED C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1c(Cl)cc(C#N)cc1Cl 611097172 VXCNSTKTZOHFCF-ZDUSSCGKSA-N 375.299 5.351 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1C[C@@H]1c1ccc(F)cc1 619126574 ZEHHFAKUVKPCTO-KGLIPLIRSA-N 385.323 5.099 30 20 GKED COc1c(F)ccc(F)c1C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 622283999 KGQWLXASJWNYHL-UHFFFAOYSA-N 399.237 5.263 30 20 GKED Cc1nn(C(C)C)cc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647229820 IFELTAMJKZSNSS-UHFFFAOYSA-N 397.338 5.674 30 20 GKED C=CCC[C@@H](NC(=O)N1CC(CC(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 676760566 INPUWIJNQYANQC-OAHLLOKOSA-N 394.359 5.307 30 20 GKED C[C@H](NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 677151090 ZKUDQSTULLOWCE-ZDUSSCGKSA-N 389.282 5.095 30 20 GKED CON=Cc1ccc(C(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 726777819 VRFUWWBLLHGWIT-LJQANCHMSA-N 390.405 5.053 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCc2cccc(OC3CCCC3)c2)cc1 727675798 SMQFBBOGRZZPII-UHFFFAOYSA-N 376.500 5.196 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ncc(C(C)C)o2)cc1OCC 733304654 OIKXRRSMEYPJTJ-UHFFFAOYSA-N 380.872 5.190 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2ccc(OC(F)(F)F)cc2)c1Cl 734746187 IPFNCMHLKXVXKH-UHFFFAOYSA-N 394.784 5.085 30 20 GKED CC[C@@H](C)Oc1cc(/C=C\C(=O)c2c(Cl)nc3ccccn23)ccc1OC 737445620 CAVFNUDXIHLYPW-QQBNSCQMSA-N 384.863 5.070 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)[nH]2)cc1 742435283 VFBGRWDWJLRZMA-NXVVXOECSA-N 380.447 5.648 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N1Cc2ccccc2-c2ccccc2C1 743202160 ZPMLXJGOQRMWQJ-UHFFFAOYSA-N 386.426 5.052 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(-c4ccncc4)cc3)cs2)cc1 745989883 FEODDRKODXBQAF-DHZHZOJOSA-N 398.487 5.777 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cc(F)ccc1F 746437505 NCDQZKPSAXZGKT-ZDUSSCGKSA-N 384.222 5.444 30 20 GKED C[C@H](c1ccccc1)n1cnnc1SCC#Cc1ccc(C(F)(F)F)cc1 754274846 GQYLICJVBJWDPW-OAHLLOKOSA-N 387.430 5.050 30 20 GKED Cc1nc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)sc1C 755951767 GMYJHGSRZSUTCF-UHFFFAOYSA-N 383.904 5.476 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(Cl)nc2)cc(C)c1OCc1ccccn1 759081849 AMJVRTLXWLHNTP-SOFGYWHQSA-N 378.859 5.222 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C#N)C(C)(C)C 765633022 HOSYVVVDSOJOLA-BLLLJJGKSA-N 392.908 5.098 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 765911246 RKEKIUALESOMHY-SWLSCSKDSA-N 399.313 5.114 30 20 GKED CC(C)c1ccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776154025 LGXNZBWHFVZXCT-KOSHJBKYSA-N 390.552 6.214 30 20 GKED C=CCC[C@H](C(=O)OCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 777640605 PUWONCDCQDKZCB-SFHVURJKSA-N 382.847 5.183 30 20 GKED COc1cc(C#N)ccc1OC(=O)c1csc(-c2cccc3ccccc23)n1 777888711 QPIJDKANAWYBHD-UHFFFAOYSA-N 386.432 5.063 30 20 GKED Cc1nc2c(s1)[C@H](NCc1cccc(OCc3cccc(C#N)c3)c1)CCC2 779988785 RGWNIQFAMNPMIK-OAQYLSRUSA-N 389.524 5.069 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccccc1O[C@H](C)C#N 780674121 JYXUMBLNCNTYHH-KGLIPLIRSA-N 391.393 5.221 30 20 GKED N#C[C@H](C(=O)CCCCC(=O)c1ccccc1)c1nc2ccccc2n1C(F)F 783359317 VAPRXVISDKRNCL-MRXNPFEDSA-N 395.409 5.051 30 20 GKED COc1cc(C(=O)/C=C/c2cc(-n3ccnc3)cs2)ccc1SC(F)F 783708472 RGKZVGDKWKOIHV-ONEGZZNKSA-N 392.452 5.153 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)cc1 797571887 WQRJNKPZGZDTRT-RISCZKNCSA-N 391.334 5.183 30 20 GKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1ccc(C(F)(F)F)nn1 799483081 TVWOJRJKEVRDAE-UHFFFAOYSA-N 375.398 5.132 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2nc(-c3ccccc3)cs2)C(=O)c2ccccc21 802706984 CGBBYAOVAMCFIN-XAVZPLJISA-N 389.476 5.127 30 20 GKED N#Cc1ccc(/C=C/C(=O)c2sccc2Br)c(C(F)(F)F)c1 811688370 PABTWTXYVLBILJ-ONEGZZNKSA-N 386.192 5.297 30 20 GKED COc1cc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)ccc1SC(F)F 815636046 NYOMTNUERGPYBG-QAPCUYQASA-N 390.499 6.096 30 20 GKED Cn1ncc(C2CC2)c1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 825450202 COAUBDJWTVQPDG-UHFFFAOYSA-N 392.890 5.014 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1 862831675 NMTKKQJOQGZEOC-SFHVURJKSA-N 393.487 5.084 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2cc3sc4ccccc4c3s2)c1 916897465 ZSFVJJMJGJQKAQ-OAHLLOKOSA-N 390.489 5.386 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046524 KPGQNSLVUHAKDC-MRXNPFEDSA-N 396.899 5.406 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(Cl)cc2)o1)c1ccc(N2CCOC2=O)cc1 920749794 QSFOUYNDFBVPPC-LUAWRHEFSA-N 393.826 5.453 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1nc(Br)ccc1F 926478938 FYWOSEPOGSWERG-BBRMVZONSA-N 376.273 5.069 30 20 GKED CC(C)CC(=NNc1ccccc1C(=O)O)c1cccc(Br)c1 1776030452 BIIVAMOANHGDDK-UHFFFAOYSA-N 375.266 5.010 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c1)C(=O)O 1776126351 JRYZVMWHRWQTJY-OBHPCNEJSA-N 388.419 5.227 30 20 GKED COc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1F 49223538 XMGAXNRJMILTTO-UHFFFAOYSA-N 378.428 5.109 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc(F)cc2F)cc1 53747930 YOMYYNHTODXPBW-UHFFFAOYSA-N 395.384 5.210 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 64456858 HTMIDEGUHRCSML-UHFFFAOYSA-N 398.418 5.144 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(SCc2cccc3ccccc23)s1 66239105 BRBMYTHPSDIPFQ-AWEZNQCLSA-N 396.566 5.519 30 20 GKED CC(C)c1nc(CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cs1 66954660 XUUUKGXHPXCCCQ-AWEZNQCLSA-N 388.562 5.025 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(C(=O)N2CCCCC2)c1 109002479 FIXZBVQSYCWQRV-GOSISDBHSA-N 393.556 5.319 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@H](C)c1cccnc1 115762448 GBINXLBIBFKUPS-QGZVFWFLSA-N 386.455 5.361 30 20 GKED Cc1ccc(C)n1C1CCN(C(=O)c2ccccc2-c2ccccc2C#N)CC1 116583090 DQQQJLZXNYEFMM-UHFFFAOYSA-N 383.495 5.121 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc(F)c(F)cc2F)cc1 129690290 KHXXMUPWCJCJCC-UHFFFAOYSA-N 396.368 5.001 30 20 GKED COc1cc(C#N)ccc1O[C@@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 130292293 SYCBPWFQHIFJSK-JTQLQIEISA-N 390.226 5.064 30 20 GKED CSCC[C@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 134108107 BYMHTUQVMJWHGD-INIZCTEOSA-N 383.517 5.264 30 20 GKED COc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)cc1OC1CCCC1 160396961 ZIOHPBKTJDWNOV-HXUWFJFHSA-N 393.487 5.183 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@H]1c1ccc2c(c1)OCCO2 189871818 NZFMFKSLNPQDBA-PMACEKPBSA-N 377.484 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1 191453481 NMWDEOYESSFFIX-ZJSXRUAMSA-N 392.543 5.828 30 20 GKED N#C[C@H](C(=O)c1cc2cc(F)ccc2s1)c1nc(-c2ccncc2)cs1 194181375 JNTLYDBXKKMARK-CQSZACIVSA-N 379.441 5.049 30 20 GKED COc1cc(C(=O)/C=C\c2c(C)nn(-c3ccc(F)cc3)c2C)ccc1SC 214948485 WMMGOPCMBHLYDB-KHPPLWFESA-N 396.487 5.255 30 20 GKED CCCc1ccc(C(=O)/C(=C(/S)NC(C)C)[n+]2ccc(C(C)(C)C)cc2)cc1 280507456 DHVAEFNMWQSIQT-UHFFFAOYSA-O 397.608 5.161 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/[C@@H]5CCCN=C5O)(C4)C2)C3)cc1C 328968362 AIXPHXYUSGOBOB-RBFUXZAUSA-N 380.532 5.217 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c2[C@H]1C 410988909 TWPSDBQSHRQPNE-RYUDHWBXSA-N 394.525 5.076 30 20 GKED N#Cc1cnc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c(Cl)c1 428026634 CYAKWLJUMCZUDJ-UHFFFAOYSA-N 397.265 5.124 30 20 GKED N#Cc1cccc(C#N)c1NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 436406439 HSTLNPYYGPSYQV-UHFFFAOYSA-N 394.356 5.248 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCc2c[nH]c3ccccc23)cc1F 437468155 BMPJUVVUYHZDDU-UHFFFAOYSA-N 399.425 5.542 30 20 GKED CCCOc1cc(C)ccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 437807165 SBHPBQWOZBGJMJ-FPOVZHCZSA-N 377.488 5.088 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccncc2)c1 438167408 OVWZRTJUEBALJR-PKTZIBPZSA-N 398.466 5.178 30 20 GKED CCc1ccccc1CSCC(=O)Nc1ccccc1SC[C@H](C)C#N 438299080 ATWGTMLAJMYJOG-MRXNPFEDSA-N 384.570 5.373 30 20 GKED C=CCC[C@@H](NC(=O)CSc1ccncc1)c1ccc(C(F)(F)F)cc1 441581658 NOVSONTZTDMYLL-QGZVFWFLSA-N 380.435 5.016 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3ccoc3c2)cc1 442936291 SBSXBRPIDVOKMJ-UHFFFAOYSA-N 384.460 5.849 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1)c1ccccc1 452529873 HUTNVBLEBLYFFH-AWEZNQCLSA-N 394.462 5.228 30 20 GKED COc1ccc(-c2csc(NC(=O)[C@@H](C)c3cccc(C#N)c3)n2)cc1Cl 461794987 JNJNTPANCONHDV-LBPRGKRZSA-N 397.887 5.086 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c(Cl)cccc1Oc1ccccc1Cl 463120843 AFVMTCPCEWYGAF-ZDUSSCGKSA-N 377.271 5.407 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCCc1cccc(C#N)c1 464321757 QVTMVRRDANUSJY-FQEVSTJZSA-N 383.495 5.074 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCS2)cc1Cl 465156750 PXARVABDNXHDCC-AEFFLSMTSA-N 385.920 5.013 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H]1c1ccccc1F 475550065 NHZNLHZLHFORQR-JTSKRJEESA-N 380.507 6.293 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](OC)c1ccc(Cl)cc1 475552510 ZLDIBQLBCRRDLA-FQEVSTJZSA-N 386.923 5.701 30 20 GKED Cc1ccc(-c2nc(C(=O)N(C)c3cc(Cl)ccc3C#N)cs2)c(C)c1 479570124 OPJSGGNUSWYBAS-UHFFFAOYSA-N 381.888 5.229 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccc2c(c1)CCC2 481794499 KFLNTLCNEQHJMB-QGZVFWFLSA-N 394.540 5.367 30 20 GKED CC(C)(CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 483290441 HGGBCNGGMFZSAY-INIZCTEOSA-N 394.824 5.913 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1)c1c[nH]c2ccccc12 486429683 GEDGBOKWPAWDAG-HXPMCKFVSA-N 386.282 5.349 30 20 GKED N#Cc1cc2c(nc1SCc1ccc(OCc3cccnc3)cc1)CCCC2 499328328 RVFDEPDMWSSPDU-UHFFFAOYSA-N 387.508 5.098 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)[C@@H]3CC[C@H](C(F)(F)F)C3)c2)c1 506443679 HBWOWNCOWMAGFS-SJORKVTESA-N 388.389 5.054 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)Cc2ccc(C#N)cc2)n1 509207749 KEPQRUNTQLIPSQ-UHFFFAOYSA-N 399.928 5.309 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)s1 513143369 NBIKDJJMPWPCDA-AWEZNQCLSA-N 387.386 5.022 30 20 GKED CC(C)OCc1ccccc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 517471967 OCUUBFQUTZZZOC-QGZVFWFLSA-N 397.544 5.185 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1ccccc1S[C@H](C)CC#N 518239812 MNQFPDUEHNSEHU-HUUCEWRRSA-N 388.920 5.449 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc2ccccc12 521327060 OSYJGRPRLQCMBC-CZAAIQMYSA-N 386.520 5.976 30 20 GKED N#Cc1ccccc1COc1cccc(CNCCc2ccc3ccccc3n2)c1 521834030 SPRUGRLHEZZHAB-UHFFFAOYSA-N 393.490 5.018 30 20 GKED CC(C)C[C@@H](C)Oc1cc(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)ccn1 523616089 URXAUAPGHVCREK-QGZVFWFLSA-N 394.519 5.018 30 20 GKED CCOc1ccc(-c2nc(CN(CC)[C@H](C)c3ccc(C#N)cc3)co2)cc1 532999835 LBWZHMBAOUUPBP-QGZVFWFLSA-N 375.472 5.195 30 20 GKED C=C(C)[C@@H](CC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1)OCC 533684308 YUCFFRGONRSLAY-VQTJNVASSA-N 396.531 5.500 30 20 GKED COc1ccc(C[C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccc(OC)cc2)cc1 538397698 SWQDKMGSOIWQMX-BVZFJXPGSA-N 386.495 5.210 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)nn1C1CCCCC1 539584410 JZOMBIWSHHXVKF-OAHLLOKOSA-N 398.919 5.450 30 20 GKED Cc1ccc(C(=O)N2CCC(CC#N)CC2)c(Sc2ccc(Cl)cc2)c1 546158899 ATDWTWDLIWLPBS-UHFFFAOYSA-N 384.932 5.566 30 20 GKED N#Cc1ccc(CSCc2nc(CSc3ccc(Cl)cc3)no2)cc1 546239335 ATPIQMDQJCBJSO-UHFFFAOYSA-N 387.917 5.320 30 20 GKED N#Cc1ccccc1NC(=O)CCN1CCC[C@H]1c1ccc(Cl)c(Cl)c1 552829813 RVBHDLZPOOKHIP-IBGZPJMESA-N 388.298 5.031 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cccc(-c2nc(C)cs2)c1 553447892 IHQKFWSBLFJPSC-UHFFFAOYSA-N 394.544 5.114 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCSc1ccc(Cl)cc1 558754214 BGTMENCYIKOANB-UHFFFAOYSA-N 389.307 5.281 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC1CC(C(F)(F)F)C1 562127438 CXODOOOZFMBGJQ-UHFFFAOYSA-N 389.377 5.121 30 20 GKED Cc1ccc(C#N)cc1NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 596707658 JTEZMBMUVGKZIW-UHFFFAOYSA-N 381.320 5.042 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@H](CC#N)C2)cc1 596789304 NQKRIBUBSODVMI-QZTJIDSGSA-N 379.529 5.697 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC12CC3CC(CC(C3)C1)C2 601044395 MFGUMHCMRXIDCO-UHFFFAOYSA-N 388.536 5.408 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nnc(-c2cccs2)n1-c1ccccc1 603990779 ORSQUTFKPXYENP-SFHVURJKSA-N 388.521 5.223 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nnc(-c2ccc(F)cc2)c2ccccc12 604035671 INLTUNYERZVETE-LJQANCHMSA-N 385.467 5.663 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc(C)cs1 609207975 SRHLRRRDPDIPMM-LJQANCHMSA-N 392.484 5.388 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N(C)c1ccc(C#N)cc1F 609216903 QMGCEZMTKSNUGP-JTQLQIEISA-N 383.275 5.148 30 20 GKED CCCN(C(=O)Cc1nc(-c2cccs2)oc1C)c1cc(Cl)ccc1C#N 609286207 NNFBEIZBOGBHHO-UHFFFAOYSA-N 399.903 5.222 30 20 GKED CSCc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccccc12 609428283 JETWRETZBBIXOZ-CQSZACIVSA-N 396.537 5.942 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](CC)c1ccccc1 609435019 KURKXRVWXHHLLI-RXVVDRJESA-N 395.572 6.476 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cccc2cccnc12 609525989 FKKRFWQILMCTSC-UHFFFAOYSA-N 395.437 5.401 30 20 GKED N#Cc1cccc(CNC(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)c1 609556691 RUGFBXJJKYUZOO-RUZDIDTESA-N 391.474 5.300 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C#N)cc2)nnc1-c1ccc(Cl)cc1 609813828 WOHDQCWEEQYQPJ-AWEZNQCLSA-N 380.904 5.509 30 20 GKED Cc1ccc(OCc2nc(CS[C@H](C)c3ccc(C#N)cc3)cs2)cc1 609825296 PPNBLSOOEUUYIO-MRXNPFEDSA-N 380.538 5.897 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3sc4c(c3C#N)CCCCC4)c2)n1 610037125 YSSCYZKJPXRUDR-UHFFFAOYSA-N 393.537 5.573 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1 610634882 XYWHZKUYPHEEEK-UHFFFAOYSA-N 377.488 5.070 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1cc2ccccc2n1CC#N 610721506 RYOBOXBLLIGKKQ-GOSISDBHSA-N 386.499 5.104 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](CC(F)(F)F)c1ccc(Br)cc1 614405695 COTMNFNIEVYTJN-KRWDZBQOSA-N 397.238 5.413 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)COc1ccc(C(F)(F)F)c(C#N)c1 619266758 UTDRDIDAMNDBRY-UHFFFAOYSA-N 376.378 5.026 30 20 GKED CC(C)N(C)c1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1F 726475695 SPTVVQHYHGSIRR-UHFFFAOYSA-N 376.888 5.004 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(F)cc1O 727776737 DLVHQFVUSIGOME-UHFFFAOYSA-N 396.422 5.178 30 20 GKED C#Cc1cccc(N(C(=O)c2sc3cccc(F)c3c2COC)C(C)C)c1 728248072 ZFVMMBPYKMGXTH-UHFFFAOYSA-N 381.472 5.223 30 20 GKED CC(C)CN(CCC#N)C(=O)c1sc2cc(Br)ccc2c1Cl 729841764 NMMQNCDLRQBXAI-UHFFFAOYSA-N 399.741 5.329 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 731293464 ZSPUSVTZDBAOAF-GBESFXJTSA-N 386.451 5.569 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC(C)C)c2cccs2)c1 733804218 ADRCPNKLGKTOHE-IEBWSBKVSA-N 385.533 5.016 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc3c(c2)nc(C(F)(F)F)n3C(C)C)c1 734389878 AHAQNWLRJPJRDT-UHFFFAOYSA-N 399.416 5.284 30 20 GKED Cc1nc(SCc2cc(Cl)ccc2OCC#N)[nH]c1Cc1ccccc1 735231376 UJQVNJXAVKCQKZ-UHFFFAOYSA-N 383.904 5.157 30 20 GKED O=C(OCC1(C(F)(F)F)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 739342083 UIRXTRRMGPQGJO-UHFFFAOYSA-N 380.206 5.224 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C/C(=O)c1ccc(-c2ccncc2)cc1 745989873 DYHOYPLKZKRYFU-OUKQBFOZSA-N 393.490 5.506 30 20 GKED COc1ccc(C=NNc2ccc(Cl)cc2Cl)cc1OCCCC#N 747357708 VMEZOOZXKYSVPJ-UHFFFAOYSA-N 378.259 5.131 30 20 GKED CC(C)N(C(=S)NCCSc1ccc(Cl)cc1)c1cccc(C#N)c1 749767121 IRRRRNURGVFHDZ-UHFFFAOYSA-N 389.977 5.093 30 20 GKED C[C@H](OC(=O)CCC(=O)c1cc(Cl)sc1Cl)c1cccc(C#N)c1 756272510 LDFXSAAVLDUEJD-JTQLQIEISA-N 382.268 5.194 30 20 GKED CC[C@@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)O1 757305209 NOMOZACQHVTDPC-AXAPSJFSSA-N 395.311 5.251 30 20 GKED Cc1ccc(C(C)(C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cn1 759945798 OKXWSSIBIZOKLA-QFIPXVFZSA-N 384.483 5.102 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCc3sccc3[C@H]2c2cccs2)cc1 768209472 YIBXCKDPUJUGLD-VFNWGFHPSA-N 380.538 5.248 30 20 GKED CSc1ccc(C)c(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 775984605 KWUPSXZISLZMHD-OAQYLSRUSA-N 387.508 6.016 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1coc(-c2ccccc2Cl)n1 776449491 YAMRNIWGXGEFCW-UHFFFAOYSA-N 380.831 5.153 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C/c1scnc1C 776773012 VPTHOYWTZKEZLI-CMDGGOBGSA-N 391.471 5.017 30 20 GKED CC(C)(C#N)CNC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 782100769 WOEOPBVYUCDNDO-UHFFFAOYSA-N 382.463 5.213 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3ccccc3-c3ccccc3)ccc21 786826813 JWFFWJOJWGQXKK-UHFFFAOYSA-N 395.506 5.549 30 20 GKED N#C[C@H](C(=O)CCC(F)F)c1nc(-c2ccc(Cl)cc2Cl)cs1 796642361 BQXREQCOEMAIOP-SNVBAGLBSA-N 375.227 5.338 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570943 MDAXVNCWHRWNKS-OCCSQVGLSA-N 376.909 5.046 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CSCCCC1(C#N)CCOCC1 798400777 OQWJRYCJPWEQPC-UHFFFAOYSA-N 389.952 5.168 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 800387884 WEUJRLANIIKGRU-KOLCDFICSA-N 388.361 5.317 30 20 GKED C=CCCCCCCNC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 806224639 OCCFNVFSEQBOEK-UHFFFAOYSA-N 389.883 5.443 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Nc2ccc(F)cc2)c2ccncc12 806829281 OVEMOBVPPNACGT-UHFFFAOYSA-N 376.435 5.530 30 20 GKED N#C[C@@H](C(=O)[C@H](Oc1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813213400 ITARJBVCRRWXGR-WIYYLYMNSA-N 396.368 5.097 30 20 GKED COc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Cn1cccn1 815635883 LJCOFXRTXVMFSK-CVDCTZTESA-N 388.515 5.026 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3)on2)cc1 915180832 SFYWAIKUFGTPQS-OAQYLSRUSA-N 379.419 5.249 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915293520 PITUPVCBVMXHMQ-LJQANCHMSA-N 375.497 5.483 30 20 GKED N#C[C@H](C(=O)CCCC1CCCCC1)C(=O)Nc1ccc(SC(F)F)cc1 916885757 BBLDIRCHSNCZLO-QGZVFWFLSA-N 394.487 5.399 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917027237 ZJHZZKHBBDVORI-ZFWWWQNUSA-N 398.940 5.821 30 20 GKED N#C[C@H](C(=O)Cc1ccc2ccccc2c1)c1nc2cc(Cl)ccc2s1 917045846 BFVJVYDUKSGNDO-QGZVFWFLSA-N 376.868 5.522 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN2CCC[C@H]2c2ccsc2)c1=S 917455993 YYEYHIBGEAAMFF-IBGZPJMESA-N 396.585 5.432 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cc1 917600151 KJBKGGRQLXZGMR-UHFFFAOYSA-N 393.899 6.121 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1F 1776062858 NYSYLRYXGCUVKG-AWEZNQCLSA-N 380.341 5.278 30 20 GKED O=C(O)[C@H](Oc1cccc(C=NNc2cccc(F)c2Cl)c1)c1ccccc1 1776093469 SRBMZBQXPVKFRJ-HXUWFJFHSA-N 398.821 5.130 30 20 GKED CCC(=NNc1cccc(F)c1Cl)c1ccc(OCCCCC(=O)O)cc1 1776093547 XIMVKVLJBPXNGW-UHFFFAOYSA-N 392.858 5.339 30 20 GKED CCCCCCCOc1ccc(/C=C(\CC(=O)O)c2nc3ccccc3o2)cc1 1776785863 DIFSPSJBRZQADF-KNTRCKAVSA-N 393.483 6.192 30 20 GKED CCCCCCCOc1cccc(CN[C@](C)(CCCCCC)C(=O)O)c1 1776788077 PDJGBSZDXMDBLR-HSZRJFAPSA-N 377.569 5.939 30 20 GKED COCc1ccccc1/C=C(C)/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1777237684 WSIQSTDBBCDJSS-OWYFNJFGSA-N 394.467 5.161 30 20 GKED COc1ccc(/C=C2/CCCc3ccc(Cl)cc3C2=O)c2cc(C(=O)O)oc12 1777359985 MPWWXRRISNIIQF-ZROIWOOFSA-N 396.826 5.396 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C\c2cc(Cl)cc(Cl)c2)cc1 1777639373 OQJXTWXAYGGXSV-BAQGIRSFSA-N 379.239 5.133 30 20 GKED C=CCN(C(=O)c1ccc(OCC)c(OC)c1)c1nc(-c2ccccc2)cs1 14723671 XLPBNMZSWZCMON-UHFFFAOYSA-N 394.496 5.050 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 66954927 ZHZXXWFCMJSJSV-AZUAARDMSA-N 393.556 5.882 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2ccc(F)c(C#N)c2)cs1 102855806 BOVAUMGIBDZTTO-UHFFFAOYSA-N 383.473 5.007 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 120252366 RWHYQKXHDHNULJ-CYBMUJFWSA-N 377.366 5.264 30 20 GKED CCN(C(=O)Nc1ccc(F)cc1OCC#N)[C@@H](C)c1cc2ccccc2o1 135301070 WJGQBCYYCQKCES-AWEZNQCLSA-N 381.407 5.089 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OC)c(OCC)c1 156549813 RJMVGWPYKDOAHB-UHFFFAOYSA-N 380.897 5.029 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccncc1 160928186 JKKAPEYQIBAVEB-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C#N)cn2C)c(C(F)(F)F)c1 176978204 UCTAXAYSIZXYTJ-LLVKDONJSA-N 381.423 5.058 30 20 GKED COCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)sc2cccc(F)c12 177759151 JNYIZKFANTUCLO-LLVKDONJSA-N 388.489 5.257 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C2(c3cccc(C(F)(F)F)c3)CC2)n1 177760702 WCEURWXZDPLRAP-AWEZNQCLSA-N 378.419 5.193 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OCC(F)(F)F)n1 189878199 XBKMZGBJZIXESF-UHFFFAOYSA-N 378.394 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(Cl)c2cccnc12 189888401 ONRHKHWADAHSTG-UHFFFAOYSA-N 394.902 5.758 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc2c(c1)OCCCO2 191471403 UYKDSOULAMYRPM-UHFFFAOYSA-N 380.488 5.022 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1 193048295 TVKWUUGNEMTEPB-SFHVURJKSA-N 390.512 5.466 30 20 GKED N#CCN(C(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccccc1 195123480 JCDJOZJWIQPOTB-UHFFFAOYSA-N 375.478 5.195 30 20 GKED N#CCN(C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)c1ccccc1 195730251 UYKYQBNEPULKHL-UHFFFAOYSA-N 397.453 5.463 30 20 GKED N#Cc1cc(N2CCCC[C@@H]2c2cc3ccccc3[nH]2)nc2ccc([N+](=O)[O-])cc12 302699170 WZXIZNRYRQITHE-JOCHJYFZSA-N 397.438 5.228 30 20 GKED N#Cc1ccc(SCC(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1 303154130 FYCBEMWXJWAATR-UHFFFAOYSA-N 385.901 5.066 30 20 GKED OC(C[C@@H]1Oc2ccccc2N=C1O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 329193563 UFQNSZZVOQFGPS-IBGZPJMESA-N 394.427 5.146 30 20 GKED OC(=Nc1ccc2c(c1)oc1ccccc12)N1CC2(CCC2)[C@H]1[C@H]1CCCO1 329781015 NAKVWROLESLYIA-TZIWHRDSSA-N 376.456 5.165 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@H](C)CC3)s1 410990031 VNSHMIHYXOHIBR-CKYFFXLPSA-N 389.546 5.030 30 20 GKED Cc1cccc(NC(=O)Nc2cccc3c2N(CCCSCC#N)CCC3)c1 426472173 YYIYFSCQJLVUBC-UHFFFAOYSA-N 394.544 5.039 30 20 GKED N#Cc1cc(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)ccc1Oc1ccccc1 432605821 DZPYVDWJDJHYTI-VXKWHMMOSA-N 381.435 5.774 30 20 GKED N#CCCC[C@@H](NCc1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 433018414 GZVISDAVIGLYCB-XMMPIXPASA-N 383.495 5.464 30 20 GKED CCC(CC)(CC)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 437892968 UMGPQYAERYVZRN-UHFFFAOYSA-N 379.504 5.422 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H](C)c1ccc(F)cc1F 438046139 WNHDFBDRZJBZFS-KBPBESRZSA-N 389.471 5.142 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2ccn(CCC)c2c1 438309419 ZVELJDNDWXBLJA-UHFFFAOYSA-N 377.488 5.280 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](CC)c1nccs1)c1ccc(C(F)(F)F)cc1 441522870 SABGMSXZRJFVJL-HZPDHXFCSA-N 397.466 5.620 30 20 GKED C=C(C)[C@H](Cc1nc(C2(c3cccc(C(F)(F)F)c3)CCC2)no1)OCC 445527127 DTBWGSUMMSKEIF-INIZCTEOSA-N 380.410 5.082 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)c1C1CC1 455761977 ASTKYAKEDBTGEN-AWEZNQCLSA-N 395.507 5.424 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(Cc2ccccc2F)CC1)c1ccccc1 458799079 JDHRMILZXDRIQK-QHCPKHFHSA-N 393.506 5.225 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458801938 OIBDNJSXHYYRJT-IBGZPJMESA-N 389.421 5.282 30 20 GKED C[C@@H](C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 461916917 AOMFYUZXMZYDTE-JLTOFOAXSA-N 380.900 5.282 30 20 GKED N#C[C@@H](C(=O)c1csc(Cl)c1)c1nc(-c2ccc(Cl)cc2)cs1 467271371 MYEXZXGANMGILV-LBPRGKRZSA-N 379.293 5.668 30 20 GKED N#Cc1ccc(CSCc2nnc(-c3ccccc3)s2)c(OC(F)F)c1 467315316 PSWXJXJEAQIQTQ-UHFFFAOYSA-N 389.452 5.112 30 20 GKED COc1ccc(Cl)cc1[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468928308 HPBJLCKXEHYRSK-OAHLLOKOSA-N 397.906 5.105 30 20 GKED C=CC[C@H]1N(C(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)CCCC1(C)C 470304802 YBQZPBUFKXUCIP-HXUWFJFHSA-N 380.488 5.047 30 20 GKED COc1csc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 473658466 LYGGQQCKPJVJKN-QGZVFWFLSA-N 382.872 5.318 30 20 GKED CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1 480481825 OOCAJXCXNSAVEZ-OXJNMPFZSA-N 379.504 5.648 30 20 GKED Cc1nc(COc2ccccc2C(=O)[C@@H](C#N)c2nccc3ccccc23)cs1 483233476 IHLQUVRPGSOZLT-FQEVSTJZSA-N 399.475 5.069 30 20 GKED N#CCCC[C@H](NC(=O)CCCOc1cccc2ccccc12)c1ccccc1 487403360 IXTSRNCETIQZDQ-QHCPKHFHSA-N 386.495 5.550 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1 488461382 ISMKFUIUHOPBBE-AWEZNQCLSA-N 393.318 5.368 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2nc(C(F)F)sc2c1 492995378 RWKXYIBSEBCPSC-UHFFFAOYSA-N 379.457 5.516 30 20 GKED N#Cc1ccc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)c(Cl)c1 494636297 XYYQMNQLPDVHHK-UHFFFAOYSA-N 386.238 5.091 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 498926718 FFTUQCONOSCGEE-UHFFFAOYSA-N 393.556 5.955 30 20 GKED N#Cc1c(NC(=O)c2ccc3ncccc3c2)sc2c1-c1ccccc1CC2 499779900 UXVCVORHMZYTIX-UHFFFAOYSA-N 381.460 5.186 30 20 GKED C=CCc1cc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc(OC)c1O 500138554 BVAZGTPSPLXMAD-NRFANRHFSA-N 399.943 5.723 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C3(c4ccccc4)CCC3)c2)cc1 501419920 HGUDHFKCKFWFBH-UHFFFAOYSA-N 396.490 5.392 30 20 GKED N#Cc1ccc(C2=CCN(Cc3csc(-c4ccc(F)cc4)n3)CC2)cc1 502531347 UHUVNBDZCVXYMI-UHFFFAOYSA-N 375.472 5.110 30 20 GKED CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 503618324 LPOZOWIRAQNTIY-UHFFFAOYSA-N 399.472 5.008 30 20 GKED CCCOc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1Cl 503625381 NGBILYZJSDLWKK-UHFFFAOYSA-N 395.890 5.322 30 20 GKED CC(C)[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 504225617 IOJOJSSMQGKYQC-KOSHJBKYSA-N 383.495 5.237 30 20 GKED FC(F)Oc1ccc([C@H](NCc2ccccc2OC(F)F)C(F)(F)F)cc1 510420212 OUTIIZJZMYEIDB-AWEZNQCLSA-N 397.290 5.283 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc12 515690119 ABGIDMGIORRSAK-UHFFFAOYSA-N 388.452 5.199 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 517641006 DBTUJPFOWMLBJQ-OAQYLSRUSA-N 388.854 5.450 30 20 GKED Cc1ccc(N(C(=O)CCCCOc2cccc(C#N)c2)C2CCCCC2)nc1 517646462 ZLANFNWEKKFVOP-UHFFFAOYSA-N 391.515 5.177 30 20 GKED CCCn1ccc2cc(NC(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)ccc21 517657417 VXOJWMKJFQGAQG-UHFFFAOYSA-N 396.450 5.363 30 20 GKED COc1cc(C2(C(=O)Nc3cccc(OCCCC#N)c3)CCCC2)ccc1C 518109651 DHOSYWVKUIBZSY-UHFFFAOYSA-N 392.499 5.137 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1ccccc1Br 518146917 OAMIDOJHVUDNBZ-ZIAGYGMSSA-N 375.335 5.874 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 518168316 AFZCPIVNJYFPMC-YOEHRIQHSA-N 385.558 5.541 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 518256990 VURBVCXKZDZGLC-HKUYNNGSSA-N 381.545 5.642 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H]2C[C@H]2c2cccc3ccccc23)cc1 519456278 FUFCOCAWZGXTEI-BJKOFHAPSA-N 384.479 5.289 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1ccc2ccccc2c1 521725526 FALWURYNEGEUDE-INIZCTEOSA-N 376.481 5.109 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)c1occc1COc1cccc(C#N)c1 523944338 IVNQJRBIXFXTJY-UHFFFAOYSA-N 394.858 5.046 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2[C@H]3CC[C@H]2c2ccccc23)c1 526028924 LEZBUPYARPEQKQ-GOTSBHOMSA-N 380.447 5.169 30 20 GKED C[C@H](c1ccc(CNC2(c3ccc(C#N)cc3)CCOCC2)cc1)C(F)(F)F 528780018 AHWMFIGYIYAXRR-MRXNPFEDSA-N 388.433 5.020 30 20 GKED CC(C)C[C@@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 537041314 BTGBBVOZGGFSAC-GHTZIAJQSA-N 395.572 5.254 30 20 GKED COc1cc(CSc2cccc(O)c2)ccc1OCc1cccc(C#N)c1 542712191 GXSRUOFQRGJAPL-UHFFFAOYSA-N 377.465 5.144 30 20 GKED C[C@@H](NCC#Cc1ccc(C(F)(F)F)cc1)c1nc2ccccc2n1C(F)F 548074868 DMSYKTRTHUMPIH-CYBMUJFWSA-N 393.359 5.153 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)c3cc(C#N)ccc3Cl)n2)c(C)c1 552159677 VYHOWGPKFHCBLN-UHFFFAOYSA-N 381.888 5.513 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1 562870417 XODIBGCDLOHEST-UWVAXJGDSA-N 379.529 5.744 30 20 GKED N#C[C@@H](C(=O)c1ccn(C2CCCCC2)n1)c1nc(-c2ccccc2)cs1 567537018 VFTFFKFSDNYWAT-KRWDZBQOSA-N 376.485 5.002 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F)C(F)(F)F 567949463 FPTJSFUGYJKEEH-SECBINFHSA-N 395.274 5.426 30 20 GKED N#CCC[C@@H](C#N)CNc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 569309767 LUVNLHPXNCBVFL-AWEZNQCLSA-N 384.361 5.225 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@H]1C1CC1 579221500 TUNPUZGOEFAWPQ-CTNGQTDRSA-N 393.918 5.648 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c2n[nH]cc2c1 588349140 YDRVHCFEVVXEQT-INIZCTEOSA-N 392.871 5.138 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnn(-c3ccccc3)c2C(C)C)c1 589382571 GPLIDFQAICMGHJ-UHFFFAOYSA-N 375.472 5.203 30 20 GKED Cc1c(C(=O)Nc2c(-c3ccccc3)ncn2C2CC2)sc2ccc(C#N)cc12 590198509 KFRWUKVDTBJBIS-UHFFFAOYSA-N 398.491 5.532 30 20 GKED COc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C2CC2)cc1Cl 594207221 WVPONWWDPYUTHY-UHFFFAOYSA-N 397.906 5.540 30 20 GKED N#CCCCCC(=O)Nc1cc(C(F)(F)F)ccc1NCc1ccccc1 594311552 GGURWFWZVSICKA-UHFFFAOYSA-N 375.394 5.340 30 20 GKED FC(F)c1nc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2ccccc2n1 595535136 KYSNIZDUSQXXJO-DTORHVGOSA-N 399.285 5.135 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1CC[C@](C)(C#N)C1 598417415 JWIHWPNWTJGXLT-LJQANCHMSA-N 392.286 5.148 30 20 GKED C[C@@H]1CC(F)(F)CCN1C(=O)c1ccccc1SCc1ccc(C#N)cc1 600450543 WNWHZVZYRFZBNU-OAHLLOKOSA-N 386.467 5.110 30 20 GKED C[C@H](CC#N)NC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 609306283 JRBVYJOFOHIMTJ-SJKOYZFVSA-N 379.312 5.245 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)C[C@@H](c2ccccc2)C(F)(F)F)cc1 609413549 XJTYNIJPXSQFKM-IBGZPJMESA-N 390.405 5.068 30 20 GKED Cc1occc1-c1nnc(S[C@@H](C#N)C2CCCCC2)n1-c1ccccc1 609648665 NCEHVWZCUOQCGM-IBGZPJMESA-N 378.501 5.400 30 20 GKED COc1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c(C)c1 609724303 OXHGYNXIBIGEJD-UHFFFAOYSA-N 392.842 5.573 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 610165602 NNIHBTKEZQRXEQ-UHFFFAOYSA-N 396.947 5.679 30 20 GKED CC(C)c1c(C(=O)N[C@@H](C)c2cccc(C#N)c2)cnn1-c1ccc(Cl)cc1 610364826 YHEXAWCEWWZQRZ-HNNXBMFYSA-N 392.890 5.012 30 20 GKED N#Cc1ccc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)c(OC(F)F)c1 610647876 ZAAAJKCXCOWKGO-UHFFFAOYSA-N 392.274 5.426 30 20 GKED C=CCCC(=O)Nc1ccc(Cc2ccc3c(c2)CCN3C(=O)CCC=C)cc1 726533779 GXVBQZXQGDQYJW-UHFFFAOYSA-N 388.511 5.037 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ccc(O[C@H](C)C#N)cc2)cc1OC 728697974 APKYWNQRYYPDIB-FWVUHSSSSA-N 379.456 5.061 30 20 GKED N#CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 730152065 ZHULXFCGRYGFTK-CMDGGOBGSA-N 390.420 5.122 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 730989643 MBRBRNRNGUVECB-CYBMUJFWSA-N 395.459 5.293 30 20 GKED CCC(CC)[C@@H](NC(=O)NCc1cccc(O[C@H](C#N)CC)c1)c1ccccc1 733845600 GAUXEVIWHIKPAW-JTHBVZDNSA-N 393.531 5.344 30 20 GKED Cc1oc(-c2cccs2)nc1CSCc1cc(Cl)ccc1OCC#N 735318744 PQDRACRXPNNCLD-UHFFFAOYSA-N 390.917 5.701 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2cc3ccccc3o2)cc1 740434872 IXUHIHYFXDRWRW-QHCPKHFHSA-N 395.462 5.452 30 20 GKED Cc1ncc(/C=C/C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)s1 741919753 HFNSWGNANQFAPP-MDZDMXLPSA-N 393.899 5.223 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)cc1 745406172 FWDIAHSBMPGATH-UHFFFAOYSA-N 389.503 5.005 30 20 GKED Cc1c(C(=O)/C=C/c2cccc(-c3ccccn3)c2)cnn1-c1ccc(C#N)cc1 747692648 JBWZNZYWWXUBCM-JLHYYAGUSA-N 390.446 5.011 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1ccc(-c2ccccc2)cc1 749358768 FYNACOVDUVJROK-UHFFFAOYSA-N 377.447 5.103 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)n2)cc1Cl 749487302 XBTDVURSJWSMFE-MRXNPFEDSA-N 382.250 5.296 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2cccc(F)c2)CC1 752679589 RLPMVAQCTDRMIB-MRXNPFEDSA-N 397.519 5.631 30 20 GKED CCOc1ccc(NC(=O)C(F)(F)c2c(F)cccc2F)c(C(F)(F)F)c1 756950918 YZWJRWQBPFDFCN-UHFFFAOYSA-N 395.274 5.113 30 20 GKED C#CC[C@H](NC(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 757017511 ZFHBFUSLKRNMNU-PXNSSMCTSA-N 389.524 5.243 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1nc(Cl)ccc1F 758675117 QEXNEPVTDZLUSI-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2cc(Br)ccc2F)c1 763122308 PTSRXSFGLCOPMZ-TWGQIWQCSA-N 388.236 5.167 30 20 GKED Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H](C)c1cccc(C#N)c1 764614234 QRXWMVIWRRZFBI-OAHLLOKOSA-N 392.480 5.373 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCC(C)(C)CC#N 764839108 USNRQWQFBSMOMD-ZDUSSCGKSA-N 392.908 5.100 30 20 GKED CC(C)(C)c1nc(C#N)c(NN=C2CC(c3ccc(C(F)(F)F)cc3)C2)o1 781588337 RXCCBXIXFPPKPL-UHFFFAOYSA-N 376.382 5.208 30 20 GKED N#CC(CCOC(=O)C12CC(C(F)(F)F)(C1)C2)(c1ccccc1)c1ccccc1 786330202 FFFLHZAXJOMWCC-UHFFFAOYSA-N 399.412 5.162 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)c1 786852699 IGASXSHYEROZSG-UYAOXDASSA-N 399.332 5.216 30 20 GKED Cc1c(C(=O)/C=C/c2ccc3ccc(Br)cc3n2)cnn1C(C)(C)C 787187519 VHOQYUFXYXWTIJ-MDZDMXLPSA-N 398.304 5.153 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 787431514 NQBDIZKBBLEUTR-WOJBJXKFSA-N 399.416 5.111 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)[C@@H]2C[C@H]2c2ccccc2)cc1 795361220 FEVWVMHDEQHMRF-BJKOFHAPSA-N 384.454 5.030 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 796472848 DWEHXKKHLKUERK-UHFFFAOYSA-N 386.517 5.090 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F 796650579 MPXBKVGUNSPJTR-VIFPVBQESA-N 394.340 5.470 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1cc(C(F)(F)F)ccn1 813217197 CUJJUMNQVIVTCU-QGZVFWFLSA-N 384.357 5.169 30 20 GKED CC1(NC(=S)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)CCC1 843277841 URDFAGQNQWLQRH-UHFFFAOYSA-N 388.352 5.205 30 20 GKED C=CC[C@H](c1ccccc1)c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904483044 JHSBREGLISYQAE-LJQANCHMSA-N 393.450 5.179 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 915085985 GQXMBWGSEVXIMH-LJQANCHMSA-N 391.814 5.156 30 20 GKED Cc1ccc(OCCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)c1 915353679 WAFYXIMGSFSWNI-HSZRJFAPSA-N 399.494 5.159 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3F)o2)cc1OC 915993186 MEIDOFFGADHPMQ-NTMALXAHSA-N 396.414 5.016 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccccc3Cl)n2)cc1 916627249 IBJVHRYNGJTCGG-DVQDXYAYSA-N 378.884 5.662 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)sc1C 916902310 DLIMMLZEHHRFLZ-SFHVURJKSA-N 382.529 5.095 30 20 GKED N#C[C@@H](C(=O)CCc1ccccc1F)c1nc(-c2ccc(Cl)cc2)cs1 916976761 GRBGNBRUMDOHND-INIZCTEOSA-N 384.863 5.412 30 20 GKED N#CCOc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1 918197888 OKVJWPPFZFBJSB-HSZRJFAPSA-N 376.887 5.316 30 20 GKED C[C@@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1ccc2nc(O)oc2c1 1473684982 NUSPSHAYYNZUDD-GOSISDBHSA-N 397.478 5.084 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccncc2)cc1 1776354328 AVWHQCRVAWJXTK-UITAMQMPSA-N 387.435 5.130 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2ccc(C(=O)O)cc2O)cc1 1776785591 QAFAZUANIRXWCC-GDNBJRDFSA-N 396.483 5.726 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2cccc(F)c2C(=O)O)cc1 1776787501 GUQJWKAMOMKGKX-UHFFFAOYSA-N 389.492 5.839 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C\C(=O)c1csc(C(=O)O)c1 1777341938 GFUPJCYMXHMRJK-CLFYSBASSA-N 378.449 5.326 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1csc(-c2cccs2)n1 26782957 SCEIJJRELGZHPV-UHFFFAOYSA-N 390.873 5.015 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1Cl 44551962 XJQXVHITIFYCRU-MRXNPFEDSA-N 397.843 5.217 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1ccc(Cl)cc1Cl 56199958 HHWLLOJDBFAKCM-ZDUSSCGKSA-N 392.286 5.115 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(OC(F)F)c1 66956051 UNZXFWMRONSAHB-CYBMUJFWSA-N 391.443 5.004 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2F)n1)c1nc2ccccc2s1 68336008 YTCNLDRRPQRUNB-LBPRGKRZSA-N 379.441 5.049 30 20 GKED N#C[C@@H](C(=O)CCCOCCc1ccccc1)c1nc2cc(Cl)ccc2s1 120055663 LGPFLGSIUGBPAA-KRWDZBQOSA-N 398.915 5.165 30 20 GKED C=CCOc1ccc(CNc2cccc(C[S@@](=O)Cc3ccccc3)c2)cc1 133123459 IYIHZBHBPCTPEA-MUUNZHRXSA-N 391.536 5.312 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC=C(c2ccc(F)cc2)CC1 171839199 HQRCCGQUVIDYHK-INIZCTEOSA-N 395.503 5.541 30 20 GKED Cc1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C(C)C)n1 172239364 HTOKFDMDSWQHLZ-HNNXBMFYSA-N 396.903 5.175 30 20 GKED CC(=O)N(c1nc(CSc2ccccc2C#N)cs1)c1ccccc1F 173720904 NPWAJZJYDGMOID-UHFFFAOYSA-N 383.473 5.131 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 176105417 YWAUCROYVDQBCZ-UHFFFAOYSA-N 389.282 5.060 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2)o1)c1nc2ccccc2n1C(F)F 176541128 STOXLNQOCJSFJD-CQSZACIVSA-N 393.349 5.307 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2ncc(-c3ccccc3)o2)n1 177759983 GCXPDSVXHOGUNT-INIZCTEOSA-N 379.485 5.121 30 20 GKED CC(C)C[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 179717898 RMTYPIHWRZUGPC-LJQANCHMSA-N 380.879 5.139 30 20 GKED Cc1nc(NC(=O)c2c(-c3ccccc3)oc(C)c2C)sc1SCC#N 189177267 LFGQNODPWGBCLX-UHFFFAOYSA-N 383.498 5.196 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(-c2ccc(F)cc2)n1 303303955 PEGIGRPZANQSFI-UHFFFAOYSA-N 383.473 5.207 30 20 GKED CC(NC(=O)CCCCOc1cccc(C#N)c1)(c1ccccc1)c1ccccc1 303449721 JEYZADLPZHIZCF-UHFFFAOYSA-N 398.506 5.187 30 20 GKED CC(C)(C)CC(O)=Nc1ccc(Cl)c(C(=O)N2CCC[C@H]3COCC[C@@H]32)c1 328857908 KTUUIGMVBLHOII-KSSFIOAISA-N 392.927 5.005 30 20 GKED OC(CC/N=C(/O)C12CC3CC(CC(C3)C1)C2)=Nc1ccc2ncsc2c1 328921831 MIKUFJGRFSNPHH-UHFFFAOYSA-N 383.517 5.447 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCOCc2ccccc21 329940906 GLUVVUBPBLZDJH-UHFFFAOYSA-N 378.472 5.032 30 20 GKED CC(C)c1cccc(C(C)C)c1N=C(O)N1CCC(C(=O)OC(C)(C)C)CC1 330632585 IGIBLOGLZDSBGN-UHFFFAOYSA-N 388.552 5.533 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)cc2)c1)c1nc2ccccc2o1 429671301 NINUGBVWTFSXSW-HNNXBMFYSA-N 378.840 5.700 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 431810509 NLEBQPLHQMPHDZ-PGRDOPGGSA-N 379.504 5.269 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CCCc3occc32)cc1F 438665606 NFALKQSRZXNUJC-GOSISDBHSA-N 391.402 5.282 30 20 GKED N#CCC[C@H](NC(=O)c1cccc(OCc2cccs2)c1)c1ccccc1 439671754 HXAQTFQADMNKRY-NRFANRHFSA-N 376.481 5.102 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1Cl 440631974 BEAQVIAPRCWAAE-OAHLLOKOSA-N 387.936 5.199 30 20 GKED COCc1nc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(-c2ccccc2)s1 442555996 WITXIZMPRRDJAR-CQSZACIVSA-N 397.525 5.026 30 20 GKED Cc1sc(C(C)(C)NCc2ccc(CC#N)cc2)nc1-c1ccccc1F 451165177 JQLJSTHYNYARQW-UHFFFAOYSA-N 379.504 5.349 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(-c2ncco2)c1C 455546088 XSTGNGUFWWOTDC-UHFFFAOYSA-N 393.491 5.038 30 20 GKED COc1cccc([C@H]2C[C@H](C)CN2C(=O)Nc2ccc(CC#N)cc2Cl)c1 455725141 CXYICYAZHZCEHZ-VBKZILBWSA-N 383.879 5.030 30 20 GKED C[C@@H](C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1cccs1 460344245 YIKFGUUCOBTFCA-OAHLLOKOSA-N 380.900 5.610 30 20 GKED CCN(CC(C)(C)C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 463512268 FUALITHKYIIMCO-UHFFFAOYSA-N 379.504 5.232 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2ccc(C#N)c(F)c2)cs1 464648984 HSUKBCDEZZQHOO-UHFFFAOYSA-N 383.473 5.007 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 466684020 QMEKPZQCZWNTJY-OAHLLOKOSA-N 397.466 5.053 30 20 GKED COCC[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 467152952 SIVIMYIUNXYPJX-IBGZPJMESA-N 393.487 5.021 30 20 GKED N#CCC[C@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccccc1 474884567 AQBVPSANYJTSHP-KRWDZBQOSA-N 397.238 5.603 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1c1ccc(Br)cc1)c1ccccc1 475022408 JFGGYXZBWTYHHN-QUCCMNQESA-N 397.316 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2cccc(C#N)c2)n1 476108671 JQATVMKCQKJYAP-UHFFFAOYSA-N 384.483 5.157 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cc(NC(=O)N2CCCC[C@@H]2C=C)ccc1C 485571711 RTEOFRKQAQZTQX-VQTJNVASSA-N 396.535 5.140 30 20 GKED Cc1cccc2cc(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)oc12 488842163 WKVXMMLNAZPATI-UHFFFAOYSA-N 396.446 5.639 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(OC2CCOCC2)c(C)c1)c1ccccc1 488978089 FIDFJGJYEVGPSU-QFIPXVFZSA-N 379.500 5.241 30 20 GKED C=CCC[C@@H](NC(=O)C[C@H](C)c1c(C)n[nH]c1C)c1ccc(C(F)(F)F)cc1 496015632 WIYZXUHIGMYPFU-SCLBCKFNSA-N 393.453 5.363 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)Cc1cc(Cl)ccc1Cl 498319517 NILUGGQQBZRHAS-UHFFFAOYSA-N 385.250 5.234 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccccc1Cl 499951498 DTBCAUYHDOHMQS-WWGRRREGSA-N 379.674 5.131 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC)c1ccccc1OC(F)F 502643851 HKQVWYLWHPHZAE-MRXNPFEDSA-N 380.460 5.198 30 20 GKED CCN(C(=O)[C@@H](C)Sc1nc(-c2ccccc2)ccc1C#N)c1ccccc1 510179689 IKOHYOFJVGNPGJ-QGZVFWFLSA-N 387.508 5.154 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)ccc1Br)c1ccc(C#N)cc1 510431612 VNBXFLLRLDDNNJ-UHFFFAOYSA-N 397.194 5.006 30 20 GKED C=CCN(C(=O)CCCCOc1cccc(C)c1)c1nc2c(s1)CCCC2 512966045 FYQUSKQXUFLNRE-UHFFFAOYSA-N 384.545 5.099 30 20 GKED N#CCCCOc1cccc(CNc2cccc(Cl)c2OCC(F)F)c1 515088461 YREKLRVIEJSFAK-UHFFFAOYSA-N 380.822 5.279 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(COc3ccccc3C#N)o2)cc1 515551382 LEEFRLSCBCESHB-NRFANRHFSA-N 386.451 5.016 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CNC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 517652784 AOJOBESPHCUIFW-AOMKIAJQSA-N 386.451 5.191 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H](c3cccs3)C3CC3)c2)cc1 517901445 CZNWKYAFIIKIMJ-NRFANRHFSA-N 389.480 5.685 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1ccc(Cl)cc1Cl)c1ccccn1 520463663 BVIHRLAPSXENPN-HNNXBMFYSA-N 383.234 5.671 30 20 GKED CCN(C(=O)CNc1ccccc1SCCC#N)c1cccc2ccccc12 521727372 WHFPCRPNUXQXFG-UHFFFAOYSA-N 389.524 5.311 30 20 GKED N#C[C@@H](NC(=O)c1cccc2ccccc12)c1ccc(OCc2ccccc2)cc1 524109491 DJRSHSQMUKJNAG-RUZDIDTESA-N 392.458 5.413 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc4ccccc4n3)cc2F)c1 524459912 YFYZCHBJXFTZLV-UHFFFAOYSA-N 397.409 5.077 30 20 GKED C[C@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(C#N)c(F)c1 539651242 ZPUOKKWVOIINAA-INIZCTEOSA-N 380.467 5.278 30 20 GKED N#C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1)C1CC1 544413048 XRUHLARCPOJCCT-INIZCTEOSA-N 394.393 5.028 30 20 GKED CSCc1ccccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 546769758 VBEIJMLURFZWCL-UHFFFAOYSA-N 388.492 5.253 30 20 GKED N#C[C@H](C(=O)c1coc(-c2ccccc2Cl)n1)c1nc2ccccc2s1 553663897 JYSPOFIAULTAHB-GFCCVEGCSA-N 379.828 5.095 30 20 GKED CC(C)c1oc([C@@H]2CCCN2Cc2nc(C#N)cs2)nc1-c1ccccc1 566593008 SGSGMPNDQRWGBY-KRWDZBQOSA-N 378.501 5.130 30 20 GKED COc1cc(CS[C@@H](C)c2ccc(C#N)cc2)c([N+](=O)[O-])cc1OC(F)F 566703391 SSTOYWUBLRLHKO-NSHDSACASA-N 394.399 5.071 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(F)c1Br 574344025 XVJJTRKZWJYCDT-NSHDSACASA-N 393.281 5.235 30 20 GKED COc1ccc([C@H](CCC#N)NC[C@@H](c2ccccc2Cl)N2CCCC2)cc1 575207152 NPDLNBADVUMNLT-GOTSBHOMSA-N 397.950 5.120 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 578462846 HCLWSZJUTIZNTQ-IBGZPJMESA-N 388.870 5.045 30 20 GKED N#CCCSc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1 581365079 DCWXGMHRJXBJCE-UHFFFAOYSA-N 393.434 5.152 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@@H]3CCC[C@@H]3c3cccc(C(F)(F)F)c3)CC2)c1 587110551 VXTKMHXLKAVYIX-WOJBJXKFSA-N 398.428 5.061 30 20 GKED N#Cc1csc(CNCc2ccc(Oc3cccc(Cl)c3Cl)cc2)n1 589313087 CAGRYMGTOASMTC-UHFFFAOYSA-N 390.295 5.404 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2ccc(C#N)c(Cl)c2)c2ccccc2)cc1 603647200 UHSILGKEFZIVTA-NRFANRHFSA-N 391.858 5.131 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSc2nc3cc(Cl)ccc3o2)c1C 603901006 ZDVDXYSILRKHFE-UHFFFAOYSA-N 399.903 5.137 30 20 GKED Cn1ccc2c(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cccc21 607274048 DUTWGSXCKJDGJW-KRWDZBQOSA-N 391.883 5.445 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H]1CCC[C@@H](C)C1 609078584 BBVADCGPLAGNMZ-DYESRHJHSA-N 391.515 5.488 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2COCc2ccccc2)cc2ccccc21 609164361 OSYOSWLXDJDLPJ-UHFFFAOYSA-N 395.462 5.134 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297782 NJIVWMWUYQAPTD-UHFFFAOYSA-N 394.377 5.280 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)sc2n1 609376375 ACJBIBGODLROAQ-LBPRGKRZSA-N 381.526 5.417 30 20 GKED CCCCN(C)c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609377719 JQZOLJIAQZIPCJ-KRWDZBQOSA-N 381.545 5.427 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H]3CCc4ccc(F)cc43)cc2)c1 609433971 UFHGOJJLPNXAFF-JOCHJYFZSA-N 387.414 5.299 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434345 WUFYTSNSGHHSMB-OAHLLOKOSA-N 377.469 5.165 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609435172 WESXETRGQBBWFI-PXNSSMCTSA-N 381.545 6.086 30 20 GKED CC(C)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccccc1Cl 609687080 LRNBXGGYGQRCDA-NRFANRHFSA-N 383.923 5.529 30 20 GKED COc1cccc(-c2nc(CS[C@H](C)c3ccc(C#N)cc3)cs2)c1OC 609825362 SWILJTZVRMADEG-CQSZACIVSA-N 396.537 5.693 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(C(C)(C)C#N)cc1 614184883 BNVLARMYMKADEK-HNNXBMFYSA-N 393.531 5.910 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1cccc(COC2CCCCC2)c1 618751415 PFYQACJRGXXMDR-HSZRJFAPSA-N 389.499 5.217 30 20 GKED CC(C)CCOC1CCN(C(=O)Nc2cccc(C#Cc3cccs3)c2)CC1 620649549 WQNXIOLKBYUIBH-UHFFFAOYSA-N 396.556 5.207 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2ccnn2CC2CC2)cc1)C(F)(F)F 657498420 SGMMWHLIOPWKCC-UHFFFAOYSA-N 395.322 5.195 30 20 GKED CC(C)(C)n1ncc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c1-c1ccccc1 683106031 OYZGWAHWTCKBOP-IBGZPJMESA-N 394.478 5.343 30 20 GKED Clc1ccc(-c2nc(CON=Cc3cccc(Cl)c3Cl)no2)cc1 731445572 KIXSGGKNTUTZQK-UHFFFAOYSA-N 382.634 5.248 30 20 GKED Cc1ccc(-c2ccc(/C=C/C(=O)c3ccc(C(F)(F)F)nc3O)s2)cc1 731564458 FWLNPLALRDUVJW-RMKNXTFCSA-N 389.398 5.739 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc2ccccc2c1 731982629 YEUJGYGVTRNGQH-UHFFFAOYSA-N 393.446 5.565 30 20 GKED C[C@@H]1CCCC[C@H]1OCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733681698 YQIUDFKMXQUOMW-PVXIVEMSSA-N 396.434 5.087 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=S)Nc3ccccc3Cl)c2)s1 739436511 CYYOKGJZNLCDDJ-UHFFFAOYSA-N 383.929 5.427 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cnc2ccccn12 740765483 CPXHRSZAGLCDNC-KTKRTIGZSA-N 379.872 5.316 30 20 GKED O=C(/C=C\c1c(Cl)nc2sccn12)c1ccc(SCC(F)F)cc1 741842690 MOFBYSDHDPLGCF-WAYWQWQTSA-N 384.860 5.303 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c1 749324184 KSTRCMFCEQHSMP-OAHLLOKOSA-N 391.323 5.025 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(=O)oc2ccccc12 750610307 RYPSZBCWZZRWOW-UHFFFAOYSA-N 396.402 5.018 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)cc1 751084707 OYLRJDWUPXKGRZ-JOCHJYFZSA-N 383.426 5.144 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc2sccc2c1 761035283 GZFXPZJGZFIZDM-OAHLLOKOSA-N 389.263 5.169 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1O[C@H](C)C#N 766596825 MMFXHYIDGMAUFZ-KXXVWKPMSA-N 375.255 5.326 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc(Cl)c2ccccc12 766633165 PTOVWMBSBZZXIJ-CYBMUJFWSA-N 381.888 5.392 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCCCO[C@@H]3CCC[C@H](C)C3)[nH]c12 766648041 HNGVBEKMUFPAHC-QXAKKESOSA-N 381.520 5.203 30 20 GKED Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 770176478 COJMCMLYKLSGJO-CJFMBICVSA-N 397.522 5.745 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Br)ccc2F)c1 772986497 XPZFCOXYLVYEAU-XJKSGUPXSA-N 391.284 5.120 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(F)c2)CCC1)c1nc2cc(F)ccc2s1 774072123 LFRZWVKTGAYXMK-MRXNPFEDSA-N 382.435 5.164 30 20 GKED C#CC[C@H](N[C@@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccccc1 775414002 CHZGKEGMTPUXNE-RDPSFJRHSA-N 376.544 5.096 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1 776920432 GZQFQYJFOBIGGQ-UHFFFAOYSA-N 393.446 5.274 30 20 GKED Cc1nc(-c2cc3c(s2)CCN(Cc2ccc(O[C@H](C)C#N)cc2)C3)cs1 779608154 IYEDNROIXKPMMH-CQSZACIVSA-N 395.553 5.029 30 20 GKED N#Cc1cccc([C@H](NCc2cc(Cl)ccc2OC(F)F)C(F)(F)F)c1 783672915 YCUCOHZRLKXUTR-HNNXBMFYSA-N 390.739 5.206 30 20 GKED Cc1c(C(=O)Nc2ccccc2[C@H](O)C(F)(F)F)ccc(C(F)(F)F)c1F 785626821 YDPWRIQAVHSSQM-AWEZNQCLSA-N 395.274 5.001 30 20 GKED C=CCC1(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)CCC1 791560751 LWLFYOHDPGBUDD-SNVBAGLBSA-N 390.694 5.263 30 20 GKED N#CC[C@@H](CC(=O)OCc1ncc(-c2ccc(Cl)cc2)o1)c1ccccc1 795992160 QYYVTCPRMUCABZ-KRWDZBQOSA-N 380.831 5.126 30 20 GKED C=CCC[C@@H](NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)c1ccco1 796945775 BMFIXBKBXWMGFL-HXUWFJFHSA-N 382.504 5.327 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cn(-c3ccc(Cl)c(Cl)c3)cn2)cc1 797715295 NCMOUCFTMVEUGE-UHFFFAOYSA-N 399.281 5.048 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2csc(-c3cccs3)n2)C(=O)c2ccccc21 802707123 FVAZVPOIESTFOY-QFSNBGPKSA-N 395.505 5.188 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(SC(F)F)cc1 806081687 KJOUHHWSAJNHOM-UHFFFAOYSA-N 394.491 5.389 30 20 GKED O=C(/C=C\c1csc(-c2ccc3c(c2)OCO3)n1)c1c(F)cccc1Cl 809159349 NRBUUSNENLUHEC-WAYWQWQTSA-N 387.819 5.227 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(-c2ccc(OC(C)C)cc2)cc1F 817049845 QBRPOJCLZSETGR-UHFFFAOYSA-N 389.430 5.107 30 20 GKED C=C(C)C[C@@H](NCc1c(Cl)cccc1OCc1ccccc1Cl)C(=O)O 864529711 LJQDQCNMXOHKMB-GOSISDBHSA-N 394.298 5.081 30 20 GKED N#C[C@@H](C(=O)C1C[C@@H]2CC[C@H](C1)S2)c1nc2cc(C(F)(F)F)ccc2s1 892539354 WXBIKCCKTWAULO-CTEVKTCYSA-N 396.459 5.166 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccccc2OC(F)F)ccc1OC(F)F 916140217 GJCRGUODKJLALJ-VQHVLOKHSA-N 384.325 5.184 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1ccc(Cl)c([N+](=O)[O-])c1 916286515 JNPQAHSXYICUFO-UHFFFAOYSA-N 393.152 5.152 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)[C@@H](C#N)c5ccccn5)(C4)C2)C3)cc1C 916627033 OZMTUOQMKGOTOH-ANYKCEHJSA-N 384.523 5.413 30 20 GKED COc1cccc(C=Nc2ccc(O)c(-c3nc4ccccc4s3)c2)c1O 920944847 SFNLEYFESHIVFM-UHFFFAOYSA-N 376.437 5.134 30 20 GKED CCN(CC)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 921201935 OHCMXCMGVYBWGQ-DEOSSOPVSA-N 383.495 5.441 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(SCC(F)(F)F)cc1 1776087085 HVPRWMLWQSIVKE-UHFFFAOYSA-N 382.407 5.184 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C(=O)O)c1ccc(C(F)(F)F)cc1 1776180274 PCCHYHNZVBHAQG-OAHLLOKOSA-N 389.826 5.234 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(SC(F)(F)F)cc2)c1)C(=O)O 1776471372 NWDWEHOYFOGVHX-OFFHKIPUSA-N 396.386 5.047 30 20 GKED CCCCCCCCOCCCN=c1c(C(=O)O)c[nH]c2c(C)cc(C)cc12 1776785387 MFMXRJRELORPQT-UHFFFAOYSA-N 386.536 5.151 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](CC(=O)O)Cc2ccccc2)c1 1776788708 PVYFAUUVQWXWHG-QHCPKHFHSA-N 397.559 5.459 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O 1777341301 FKIRTTPCZOSYDS-DJAVKIJBSA-N 384.431 5.200 30 20 GKED COc1ccc(/C=C2\CCc3ccc(Cl)cc3C2=O)c2cc(C(=O)O)oc12 1777360313 WJBRYTIWNHQGDK-MDWZMJQESA-N 382.799 5.006 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)CC(F)(F)F)CCC2)cc1 1785840739 ATYXGJNVNOHWBL-UHFFFAOYSA-N 396.453 5.065 30 20 GKED C[C@H](Sc1ccc(F)c(Cl)c1)C(=O)Nc1sc2c(c1C#N)CCC2 26334426 TVYKSVQCGFZJRH-VIFPVBQESA-N 380.897 5.020 30 20 GKED CN(CCc1ccccc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161959 TUDOVBHNXPRCSJ-UHFFFAOYSA-N 399.494 5.038 30 20 GKED COc1ccccc1/C=C(/C(=O)[C@H](C#N)c1nc2ccccc2o1)c1ccccc1 54735260 GLJQPEMKZKMGGS-ZAQQZEBGSA-N 394.430 5.253 30 20 GKED CCOc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 60477564 RASPZPNJROGNIS-MRXNPFEDSA-N 382.872 5.352 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](CC)c1ccc(Cl)cc1 63401123 XAYXQNOPEGLOTA-LJQANCHMSA-N 387.867 5.097 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H]2c2ccc(OC)cc2OC)c1 72093576 PFXCNKZSTVCMFC-NRFANRHFSA-N 396.487 5.028 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccccc3C(F)(F)F)o2)cc1 102717009 CZMLKOZFLCRUJO-UHFFFAOYSA-N 386.329 5.001 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 115300530 AIDIOCAYIGUVLJ-UHFFFAOYSA-N 390.439 5.160 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 117081865 KKWDHAQIHHIYGJ-QGZVFWFLSA-N 393.855 5.259 30 20 GKED Cn1cc(CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c2ccccc21 120131353 OQVUVSDMRJUXBU-IBGZPJMESA-N 385.492 5.111 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc2ccccc2c1 129688770 AKLDCCRJKCYMPV-INIZCTEOSA-N 383.234 5.108 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 153199299 OJEQBXDSVVWKOQ-FPOVZHCZSA-N 386.495 5.198 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 160444508 KCYZULUUIZNMOV-UHFFFAOYSA-N 398.425 5.759 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](c1ccccc1OC(F)F)C(F)(F)F 179903855 FRXPAQLRLHJTSX-QGZVFWFLSA-N 398.375 5.482 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nnc(-c2ccccc2)o1 181059141 KXKWBHUTQZVRNB-LLVKDONJSA-N 375.375 5.480 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](C(=O)N[C@@H](C)CCC)C1 191458823 IQRQBLMHVJKEEL-AZUAARDMSA-N 399.579 5.087 30 20 GKED C=CCOc1ccc(/C=C(/Cl)c2nc3sc4c(c3c(=O)[nH]2)CCCC4)cc1 229910446 SICOMFVIYKIQNT-FOWTUZBSSA-N 398.915 5.165 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@]2(C)[C@@H](C1)C2(F)F 292720388 UMUVBRPQCRSCJP-CTNGQTDRSA-N 397.425 5.168 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1cccs1 303756692 GPXKLRGABOBRMA-AWEZNQCLSA-N 396.899 5.594 30 20 GKED C[C@H]1CC(=O)CC[C@@H]1C(O)=Nc1nc(-c2ccc(Br)s2)cs1 329188519 BQNAHNKEPMECOT-WPRPVWTQSA-N 399.335 5.227 30 20 GKED OC(=Nc1cccc(-c2cnco2)c1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329418344 DSTVRFJEPADPJX-SFHVURJKSA-N 390.487 5.436 30 20 GKED C=CCCc1ccccc1NC(=O)c1cnn(-c2ccc(C)cc2)c1C(F)(F)F 410367298 SVZPCFOODAMPOV-UHFFFAOYSA-N 399.416 5.570 30 20 GKED N#Cc1c(F)cccc1CNc1ccc(-c2csc(C(F)(F)F)n2)cc1 427436375 SPNSYTVZOBSYMC-UHFFFAOYSA-N 377.366 5.452 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cc12 430612888 UPHODUACUDFZTI-LBPRGKRZSA-N 386.546 5.002 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCCC(F)(F)C1 433121300 RDXGDNVICWMVCN-CABCVRRESA-N 381.492 5.275 30 20 GKED C[C@@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(Br)cc1C(F)(F)F 453285552 BMGMGIHUYBQKSW-MDZLAQPJSA-N 375.232 5.201 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1C 458793860 ABUGJRGWCFVPSB-GOTSBHOMSA-N 375.516 5.585 30 20 GKED Cc1csc(N(C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C2CC2)n1 460374637 WQKNLQOVCYWIAR-UHFFFAOYSA-N 393.443 5.064 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 463747566 SKJGBRUYPRYACW-HNNXBMFYSA-N 394.327 5.411 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3ncc(-c4ccccc4F)o3)c2)cc1 467268742 NGBQTAPDKNBPAC-UHFFFAOYSA-N 385.398 5.757 30 20 GKED C=C[C@](C)(CC)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 467972199 XKOJBRREJKUOCV-OAQYLSRUSA-N 381.863 5.616 30 20 GKED C=C[C@@](C)(CC)C(=O)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1 468010003 SIYHTHSJFYEAIH-IBGZPJMESA-N 392.286 5.182 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 470204229 URMZGTSENXIMDS-FQEVSTJZSA-N 386.417 5.263 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)c1ccccc1Sc1ccccc1C#N 470621969 RTTWEACNTXVWAP-CZUORRHYSA-N 390.430 5.122 30 20 GKED O=C(c1ccc(F)c(C(F)(F)F)c1)N(Cc1cccs1)CC(F)(F)F 470784877 RLZDCYGTCULTJA-UHFFFAOYSA-N 385.304 5.111 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@H]3CCC[C@H]3c3ccc(C(F)(F)F)cc3)CC2)cc1 474160802 VQFZMKGOLKFQEN-PMACEKPBSA-N 398.428 5.061 30 20 GKED Cc1sc(NC(=O)c2ccc(C(C)(C)C#N)cc2)nc1-c1ccc(F)cc1 475103541 LUWMQVVLDLJQBW-UHFFFAOYSA-N 379.460 5.311 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 475554627 YLFJFSLNNDJDTD-NRFANRHFSA-N 380.507 5.917 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Br)c(Cl)c1)c1ccccc1 476401306 ZJFVLZABDSALIS-CYBMUJFWSA-N 377.669 5.129 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(c3cccc4ccccc34)CC2)cc1 476415306 ZPVHVKLMNBZJDI-UHFFFAOYSA-N 397.522 6.052 30 20 GKED CCCc1c(NC(=O)c2c(Cl)ccc(F)c2C)cnn1-c1cccc(C#N)c1 476935067 YICRQZWWPXJKEJ-UHFFFAOYSA-N 396.853 5.050 30 20 GKED CCCOC1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CCCCC1 483638010 IVSHSFWXGQKLIF-QGZVFWFLSA-N 389.565 5.332 30 20 GKED C[C@H](NC(=O)Nc1ccnn1C(C)(C)C)c1ccc(-c2cccc(C#N)c2)cc1 484766292 IDFMSBHVCWDQHF-INIZCTEOSA-N 387.487 5.059 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN(C)Cc1ccc(C#N)cc1 484988164 QMSWTXLLBOHDMN-UHFFFAOYSA-N 397.950 5.187 30 20 GKED CC(C)c1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)nn1-c1ccccc1 487622896 ZXQIOXMKKRVNKB-NRFANRHFSA-N 386.499 5.161 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1ccc(Oc2ccc(C(C)=O)cc2)cc1 496654478 ZSOWTSVZXNQVCR-UHFFFAOYSA-N 389.451 5.145 30 20 GKED Cc1cccc2c(CCC(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)c[nH]c12 505922679 KJIZIDMPOXJHTO-SFHVURJKSA-N 386.282 5.097 30 20 GKED C=C(C)[C@@H](NC(=O)[C@@H](C)Cc1cncc2ccccc12)c1ccc(F)c(F)c1 505965456 URMUXUGKJRWXSE-OYHNWAKOSA-N 380.438 5.125 30 20 GKED C=CCn1c(SCCCn2ccnc2C)nnc1-c1ccc(C(C)(C)C)cc1 511051652 LMXRSVRCNOMIGK-UHFFFAOYSA-N 395.576 5.116 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)CCc2ccc(C#N)cc2)cc1F 511564724 RAMDARIDHXINES-UHFFFAOYSA-N 390.414 5.070 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 517789920 LKECKLQEDOAQNS-QUCCMNQESA-N 392.396 5.068 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl 518239266 SVRGAPXHUBWSJI-CQSZACIVSA-N 391.298 5.070 30 20 GKED CC(C)Cc1ccc([C@@H](C)NC(=O)CNc2ccccc2SCCC#N)cc1 518661247 VNEFECGOMXMIAW-GOSISDBHSA-N 395.572 5.180 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520601929 IRINNADDCPTRHX-HNNXBMFYSA-N 377.469 5.165 30 20 GKED CSc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 521259681 UCGZKMOTMATKLO-GFCCVEGCSA-N 386.448 5.300 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 521599197 YMJSQDIWHIQQBP-UHFFFAOYSA-N 394.471 5.602 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCCC[C@@H]3c3ccco3)cc2)nc1 522947603 NNUFCKKTNQGZDG-HXUWFJFHSA-N 387.439 5.096 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 525521124 HJOIQAXFGUWPGM-FUHWJXTLSA-N 396.462 5.411 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(-n2cccn2)cc1 537012025 AWFCVAKQWUUUSO-IBGZPJMESA-N 378.479 5.262 30 20 GKED COc1ccc(C[C@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2)cc1OC 540594628 CSFXIQHNMXGWAB-JPYJTQIMSA-N 386.495 5.210 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)nn1C1CCCCC1 540638984 BKJQYRYMIRWHBW-OAHLLOKOSA-N 382.533 5.201 30 20 GKED CC[C@@H](C)Oc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccn1 540777392 PSUSOVKVUCHDLE-BXUZGUMPSA-N 385.876 5.012 30 20 GKED CCO[C@@H](c1ccccc1)c1noc(-c2cn(CCCC#N)c3ccccc23)n1 572045412 RSRRSOSHCMSQOO-NRFANRHFSA-N 386.455 5.121 30 20 GKED Cc1csc(NC(=O)c2nc(-c3cccc(C(F)(F)F)c3)oc2C)c1C#N 578674832 HBHPARFRROBZDE-UHFFFAOYSA-N 391.374 5.163 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)s3)cn2)cc1 586386263 NFPLRQHGWSEHTJ-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CN(C(=O)CSCc1ccc(C#N)cc1)c1ccc(Cl)c(C(F)(F)F)c1 589094347 UGWXNTVFICLHIO-UHFFFAOYSA-N 398.837 5.127 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(O)ccc1Cl 589335119 QPZUBVXXCVUYQL-UHFFFAOYSA-N 378.815 5.270 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 604485589 UMCUTONUEOOUES-UHFFFAOYSA-N 398.466 5.008 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)CSCc2ccc(C#N)cc2)o1 610050522 OADHEACCUSOKHY-FQEVSTJZSA-N 382.529 5.091 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N[C@@H](CC3CC3)c3ccccc3)o2)cc1 610236374 SENYDFBLSGXVNT-QFIPXVFZSA-N 386.451 5.001 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2Br)s1)c1cccc(C#N)c1 610345123 SKRFMQDITOFOQK-CQSZACIVSA-N 397.341 5.900 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 610778435 YFTCIGAVWOVLBS-HTAPYJJXSA-N 380.451 5.048 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(c4cccnc4)CC3)cc2)cc1 611261145 AOLGDIAGTSWDMF-UHFFFAOYSA-N 398.466 5.157 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 611395012 DMVYRMLXPUNOSC-UPVQGACJSA-N 387.914 5.558 30 20 GKED CSc1ccc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 642281937 STNFXERSYDQHLT-KRWDZBQOSA-N 398.940 5.984 30 20 GKED CC(C)c1cccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)n1 675555983 FWGUSWQNAXWCFG-GFCCVEGCSA-N 389.402 5.324 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(Cl)c(C(F)(F)F)c1 727256794 PFTIMJFQRSVQSN-UHFFFAOYSA-N 396.825 5.097 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccccc2SCc2ccccc2)c(F)c1 729876623 PXJYHSKXOROOBA-UHFFFAOYSA-N 391.471 5.311 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 730917682 OUKVSWSCHFZHBO-OAQYLSRUSA-N 386.495 5.424 30 20 GKED N#Cc1ccc(-c2ccn(CN3CCCC[C@H]3c3cc4ccccc4[nH]3)n2)cc1 731027759 OVCDHZIOSTYYDX-DEOSSOPVSA-N 381.483 5.088 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCc4ccccc4C3)n2)cc1 732596100 KJZNUHVHWBLRNE-DYESRHJHSA-N 386.520 5.490 30 20 GKED O=C1/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)CSc2c(F)cccc21 733084019 UZNGKRGNMHONSO-KPKJPENVSA-N 398.440 5.229 30 20 GKED CCOc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc1OCC 740010371 BQHFHOCVHNHAFO-UHFFFAOYSA-N 392.524 5.374 30 20 GKED CN1CCC[C@H](C/N=C\c2cc(Cl)cc(Cl)c2O)[C@H]1c1cccs1 741464995 RWXGLYJGGYQAAO-SVRLNSLFSA-N 383.344 5.263 30 20 GKED Cc1c(C(=O)/C=C/c2csc(-c3ccccc3)n2)cnn1-c1ccc(C#N)cc1 741845462 WYDLTSHJWSIYFZ-FMIVXFBMSA-N 396.475 5.072 30 20 GKED COCc1cccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)c1 742429399 PSBJKZXLDJHDPC-HMMYKYKNSA-N 385.488 5.866 30 20 GKED Cc1ccc(-c2noc([C@H](C)ON=Cc3cccc(Cl)c3Cl)n2)cc1F 744442261 AYAFISWVZORZHP-NSHDSACASA-N 394.233 5.603 30 20 GKED COc1ccc2c(-c3ccccc3)cc(=S)n(CN(C)C[C@@H](C)C#N)c2c1 746705289 AGCUKIUOXAPAGI-INIZCTEOSA-N 377.513 5.095 30 20 GKED N#C[C@@H](C(=O)CCCOCc1ccccc1)c1nc2cc(Cl)ccc2s1 748009328 FYNBPFYDPWDHAU-INIZCTEOSA-N 384.888 5.123 30 20 GKED Cc1cc(C#N)ccc1C(=O)O[C@@H](C)c1ccccc1NC(=O)c1ccccc1 748839581 PBNPNGBJMNNWJA-KRWDZBQOSA-N 384.435 5.037 30 20 GKED C[C@@H](OC(=O)CSc1ccc(C#N)cc1)c1ncc(-c2ccc(Cl)cc2)o1 751708890 UJFIPBDGWPWYIS-CYBMUJFWSA-N 398.871 5.263 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cs1)c1nc(-c2ccc(Cl)cc2)cs1 759435648 HTCLGPQRTCTNBJ-LBPRGKRZSA-N 379.293 5.668 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCC[C@@H]3c3ccccc3)cn2)cc1 762812077 ORGRAPCHPBGAHU-JOCHJYFZSA-N 398.466 5.505 30 20 GKED CCc1c(C)sc(NC(=O)Cc2cccc(NC(=O)OC(C)(C)C)c2)c1C#N 772251540 MSAIQHCLQIHUFI-UHFFFAOYSA-N 399.516 5.019 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(Br)s2)cc(OC)c1OC 772953537 JUSQJPMCYIMOHB-LBPRGKRZSA-N 396.350 5.107 30 20 GKED C#CC[C@H](N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 773117247 USZDIZSOAQCIEZ-GUYCJALGSA-N 381.369 5.305 30 20 GKED C=CC[C@H](OC(=O)CCc1nnc(-c2cc3ccccc3o2)o1)c1ccccc1 778738837 JEWAISJFNBSSCC-SFHVURJKSA-N 388.423 5.276 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1 780393644 ZAGRKSBOZUEBKU-INIZCTEOSA-N 388.311 5.001 30 20 GKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(OC[C@H]2CCCCO2)c(F)c1 782346836 DXZRMPIZNBPTJW-WKOQKXSESA-N 391.442 5.218 30 20 GKED Cc1sc2ncn(N=Cc3ccc(Cl)cc3F)c(=O)c2c1-c1ccccc1 783512282 YJSDAIGWPVXWGY-UHFFFAOYSA-N 397.862 5.108 30 20 GKED CC(C)(C)OCCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 795253437 VSAJJZBWOYYSGX-LJQANCHMSA-N 384.907 5.529 30 20 GKED C#C[C@H](NC(=O)Nc1cccc(COCc2ccco2)c1)c1ccc(Cl)cc1 810163971 PFGBLOKRTAZZQR-NRFANRHFSA-N 394.858 5.146 30 20 GKED CC(=NNc1ccnc(Br)c1)c1sc(-c2ccccc2)nc1C 814904292 CCHBMOFMNOPUFJ-UHFFFAOYSA-N 387.306 5.112 30 20 GKED FC(F)Oc1ccc(NN=Cc2cn(C3CCCC3)nc2-c2ccccn2)cc1 841625013 RLVILCQVVCDABA-UHFFFAOYSA-N 397.429 5.108 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1ccc(NC(=O)NC2CC2)cc1 915049449 VRMXXCZYZZVQAK-UHFFFAOYSA-N 377.275 5.113 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@@H](C#N)c3ccc4ccccc4n3)ccc2c1 916849129 PNEYHOSUZDFSID-NVTFYQKDSA-N 378.431 5.286 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccc(Cl)cc3)n2)cc1 916975056 VITHGSDRWAGPKV-IBGZPJMESA-N 394.927 5.971 30 20 GKED C[C@@H](Cc1ccccc1F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919773622 VDALMDLUGJRQLF-JTSKRJEESA-N 387.458 5.234 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3cccs3)n2)cc1 920139301 QSIHTQSCIOKHJV-KRWDZBQOSA-N 382.510 5.079 30 20 GKED CCC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140601 ALPLBVXRHDVLDV-PMACEKPBSA-N 390.508 5.579 30 20 GKED Cc1c(NN=Cc2cc(F)ccc2Oc2ccc(Cl)cc2)cccc1C(=O)O 1776088707 CZQBVNLRNIPZPX-UHFFFAOYSA-N 398.821 5.724 30 20 GKED O=C(/C=C/c1cccc(C(=O)O)c1Cl)c1ccc(OCc2ccccc2)cc1 1776127464 UCGATXRNYWEWQG-SDNWHVSQSA-N 392.838 5.513 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776470820 JEGHYIGTGVGWFX-RBJHHQRMSA-N 396.439 5.302 30 20 GKED Cc1cc(/C=C/c2nc3cc(C(=O)O)ccc3n2-c2ccccc2)ccc1C#N 1777421039 GNPDXJJLCCCMSP-XYOKQWHBSA-N 379.419 5.074 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCc4c(Cl)cccc4C3=O)o2)cc1 1777671052 XEEBPFAHYOEHEL-NTCAYCPXSA-N 378.811 5.511 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)C3(F)CCCCC3)CCC2)cc1 1791250523 SYHJJQDZUXDYRJ-KRWDZBQOSA-N 386.511 5.005 30 20 GKED CC(C)c1ccc(C(=O)/C(=C(/S)Nc2ccccc2)[n+]2ccccc2)cc1 10170721 XMSMMJFYECUPAH-UHFFFAOYSA-O 375.517 5.148 30 20 GKED CCc1cc(C#N)c(NC(=O)[C@@H](C)Oc2ccc(-c3ccccc3)cc2)s1 59829182 VTKQUMUFOGMUIE-OAHLLOKOSA-N 376.481 5.255 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(Cl)cc(Cl)c3)n2)cc1 66544959 CZBMLXUUIFCXFT-INIZCTEOSA-N 398.274 5.479 30 20 GKED CC(C)c1noc([C@H](C)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)n1 102778533 MFHHCYYFSCVHHQ-AWEZNQCLSA-N 396.878 5.470 30 20 GKED COc1ccc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 107736986 OBOGYKJAHWCCFN-UHFFFAOYSA-N 381.247 5.124 30 20 GKED N#C[C@H](C(=O)CCCOCCc1ccccc1)c1nc2cc(Cl)ccc2s1 120055500 LGPFLGSIUGBPAA-QGZVFWFLSA-N 398.915 5.165 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1ccc(C#N)cc1 123266478 QCMRMBXHUOOJGE-VGSWGCGISA-N 380.451 5.048 30 20 GKED COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 133588914 OHPNXPSOZDHWEW-HNNXBMFYSA-N 384.888 5.112 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 155673475 WROIPLMQPVJSGN-ZDUSSCGKSA-N 388.279 5.363 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@H](C)c1ccccc1 183333474 XSGBIKMZGLFCPE-IRXDYDNUSA-N 384.570 5.556 30 20 GKED Cc1cc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)ccc1Oc1cccnc1 183819098 DCLDJSQNQBMFLW-INIZCTEOSA-N 388.427 5.117 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl)c1ccccc1 186942341 LSEGYEGTIGSGQN-GOSISDBHSA-N 384.907 5.167 30 20 GKED C[C@H](Nc1cccc(Oc2ncc(Br)cn2)c1)c1cccc(C#N)c1 190718160 VVTBEPATMVQSTO-ZDUSSCGKSA-N 395.260 5.076 30 20 GKED C[C@H]1CCSCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 192090198 UCSBQOXTYIKECQ-HNAYVOBHSA-N 399.947 5.355 30 20 GKED O=C(/C=C\c1cnc2ccc(Br)cn12)c1cccc(C(F)(F)F)c1 210212665 LZMFOAGSHUYNIE-WAYWQWQTSA-N 395.178 5.012 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(NC(=O)CCCCC)CC1 276461322 WNVDMGKOWOLLCM-UHFFFAOYSA-N 399.579 5.231 30 20 GKED CC1(C)C(O)=Nc2cc(/C(O)=N/C3(c4ccc(Cl)cc4)CCOCC3)ccc21 328773270 BMTHYOURGVIEAV-UHFFFAOYSA-N 398.890 5.230 30 20 GKED O/C(=N/[C@H]1c2ccccc2CC12CCOCC2)c1scnc1C1CCCC1 329772487 KQBPCKJSQGFYEY-FQEVSTJZSA-N 382.529 5.200 30 20 GKED N=C(O)c1ccc(N2CCCCC2)c(N=C(O)c2coc(C3CCCCC3)n2)c1 330110732 ALUFBJVATYDXPX-UHFFFAOYSA-N 396.491 5.232 30 20 GKED Cc1cc(C)c(N/C(O)=N/[C@@H]2CCOC3(CCCCC3)C2)c(Br)c1 330354912 PZMHXNCFOLVIQW-OAHLLOKOSA-N 395.341 5.274 30 20 GKED Cc1ccc(-c2csc3nc(S[C@H]4CC[C@@H](C#N)C4)n(C)c(=O)c23)cc1C 430094255 JEYFUULLASWAQW-ZBFHGGJFSA-N 395.553 5.063 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N(C)C[C@@H](C)C#N 431705390 QPFIHVWIWNRUEN-NSHDSACASA-N 380.275 5.003 30 20 GKED CC(C)c1ccc(-c2ncc(CN[C@@H](CCCC#N)c3ccccc3)s2)cc1 433011018 MGLOHUZXUOPVFV-QHCPKHFHSA-N 389.568 6.458 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2Cc3ccccc3S2)cc1F 437493161 SNYSNSPHZCNYIW-OAQYLSRUSA-N 390.439 5.145 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3ccco3)c3ccc(Cl)cc3)o2)c1 440325087 JVOWTDVJDZNSSO-UHFFFAOYSA-N 390.830 5.061 30 20 GKED C=CCN(C(=O)[C@@H]1SCCc2sccc21)c1nc(-c2ccccc2)cs1 443819624 ZYNGXJXTXLGHOK-GOSISDBHSA-N 398.578 5.421 30 20 GKED C=C(C)COc1cc(CN[C@@H](CC(F)(F)F)c2ccccc2C)ccc1OC 444019819 YOCXKNOPLBPRPJ-IBGZPJMESA-N 393.449 5.742 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc3c2CN(c2nccs2)C3)CCCC1(C)C 444927697 ZLWFBFFACVJPND-IBGZPJMESA-N 396.560 5.262 30 20 GKED C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 452649483 KCOZFDYDFXOGEY-RHSMWYFYSA-N 388.389 5.154 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccco2)cc1C#N 455782291 YGLQBZKGMBYVBA-LJQANCHMSA-N 379.460 5.088 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1cccc(Br)c1 462050985 CKWXQZXMMNFQHO-CYBMUJFWSA-N 389.318 5.197 30 20 GKED N#Cc1ccc(CNC(=O)c2c(Cl)cccc2Oc2ccccc2Cl)cc1 463317834 DEHLQWNUIPNHAM-UHFFFAOYSA-N 397.261 5.587 30 20 GKED COc1cccc([C@H](C)CCCC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 468998578 LIVNQHRBANPWNK-YGOYIFOWSA-N 390.527 5.267 30 20 GKED Cc1cccc(CC[C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c1 469201021 IDKNTZCQGILOOX-IBGZPJMESA-N 375.516 5.011 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NCc1nc2cc(Cl)ccc2s1 471731340 IXPSSRADKLSNEJ-UHFFFAOYSA-N 385.920 5.238 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCOC)[C@H](C)c1ccccc1 475576258 VMCAPVKZCLGOTQ-LJQANCHMSA-N 380.532 5.780 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc2ccccc2[nH]1 480380517 RFBNXSSJVYFDLN-HNNXBMFYSA-N 397.438 5.110 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc(Cc2ccc(F)cc2)no1)c1ccc(F)c(F)c1 481579721 HVORKHNLRKCRCX-ZUOKHONESA-N 387.405 5.046 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cccc(NC(=O)c2ccccc2)c1 481679514 UBIMURSHPUFPDU-RUZDIDTESA-N 395.506 5.368 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 484997239 RFCYJBJOAQURAJ-UHFFFAOYSA-N 390.270 5.070 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccccc1 487357391 REEAAENDPFZJKA-JOCHJYFZSA-N 389.886 5.567 30 20 GKED Cc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1Oc1ccncc1 487576718 RMVJQGHNPDDKET-JOCHJYFZSA-N 385.467 5.347 30 20 GKED C=CCn1c(SC[C@@H](OC(C)C)c2ccccc2)nnc1-c1ccoc1C 488287786 RDVHBGRXJLNFKS-LJQANCHMSA-N 383.517 5.291 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(COc2ccccc2)c1C 493833418 CYOSSGVBNVLELS-UHFFFAOYSA-N 390.483 5.430 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)CCCOc1cccc(Cl)c1Cl 500618503 SLYAIXWZEUDQMP-UHFFFAOYSA-N 393.270 5.061 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@H]1c1ccccc1Cl 501017105 HNUCTMNBCUBCQL-RBUKOAKNSA-N 376.843 5.142 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1 503471429 GYZYGPWBDFSUBH-NRFANRHFSA-N 390.874 5.021 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccc(Sc2ccccn2)cc1 505608813 ORMPSZHGNHGIIG-UHFFFAOYSA-N 390.508 5.070 30 20 GKED CCN(Cc1csc(COc2ccc(C)cc2)n1)[C@H](C)c1ccc(C#N)cc1 507688466 QMZRQUARWGAXSR-GOSISDBHSA-N 391.540 5.485 30 20 GKED N#CC1(F)CCN(Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)CC1 510946279 KNKZNHCQJIGHMY-UHFFFAOYSA-N 394.881 5.020 30 20 GKED CCCOc1ccc(NC(=O)N(CCC)Cc2ccc(C#N)cc2)cc1Cl 511435994 AXVCHPYKCJFOGM-UHFFFAOYSA-N 385.895 5.445 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cnc(-c2ccccc2)s1 514559103 CBSDBLZRACJHGR-UHFFFAOYSA-N 385.448 5.122 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(Cl)c3Cl)cc2)nc1 517656006 JCVHXKVZYUAYLD-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COc1ccc(Cl)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 518524251 SZDPNIRCRWDIAR-UHFFFAOYSA-N 396.805 5.404 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1oc2ccc(CCC(C)=O)cc2c1C 519378117 OMWBQKCGPRPGGH-UHFFFAOYSA-N 389.495 5.134 30 20 GKED N#CCCn1cc(/C=C\c2nc(Cc3ccccc3Cl)no2)c2ccccc21 520300607 PNVGEIRXZUOOFU-KHPPLWFESA-N 388.858 5.353 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 524019266 BFTKIJCRXVQWFL-MRXNPFEDSA-N 388.492 5.669 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccoc1C 525110642 ADIFTHWBTDEZCZ-MRXNPFEDSA-N 395.528 5.519 30 20 GKED Cc1cccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c1Cl 525310270 YNRMAHGAESEIHS-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#CCC[C@H](NC(=O)c1cc2ccccc2cc1OC(F)F)c1ccccc1 535597909 JCSMHUTWKYKHLB-IBGZPJMESA-N 380.394 5.216 30 20 GKED C=CCC[C@H](NC(=O)NC[C@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 542536220 DLAJMNDQRIQRBI-BBRMVZONSA-N 397.466 5.272 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)c(F)cc1Cl 559649561 GXSZZAXMUXBTLN-SNVBAGLBSA-N 383.275 5.637 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccccc1 562167193 IMBFFUNYBKOVBF-DLBZAZTESA-N 379.529 5.696 30 20 GKED Cc1c(Cl)cccc1-n1c(SCC2(C#N)CCC2)nnc1-c1ccncc1 569795222 RYBRGNYXRNFCOT-UHFFFAOYSA-N 395.919 5.077 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc2sccc2c1 576195801 TVQBVXGSCRMVAV-AWEZNQCLSA-N 381.526 5.475 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 589791060 GUNCHNTUZAELJU-UQBPGWFLSA-N 395.506 5.519 30 20 GKED CC(C)(C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1 590663269 BPAARVONUNSMRS-RYUDHWBXSA-N 399.350 5.129 30 20 GKED CCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@H](C)c1cccc(C(F)(F)F)c1 604495636 UWLZJCQOGFWGJH-HUUCEWRRSA-N 389.421 5.431 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)C(C)C)cc1OCCCC#N 604512453 SXFCVLNJQVZPFC-QFIPXVFZSA-N 386.923 5.518 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609209954 XKMRCFXJVADFDC-MRXNPFEDSA-N 387.439 5.242 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1Cc1ccccc1 609378037 PQVQRVLVOSKIGQ-GOSISDBHSA-N 386.520 5.781 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1C(C)C 609427554 JGJTUSHFWIHGNT-ZWKOTPCHSA-N 396.556 5.919 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609436365 JUHJJNJUASEGCV-IAGOWNOFSA-N 397.544 5.751 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cccc(F)c1 609693746 FTAMQAHCDOYBRN-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CN(Cc1cc2ccccc2o1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610454176 CJYSRLCOWQPLCT-UHFFFAOYSA-N 398.422 5.156 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)c(Cl)c1 611567055 RPRZMGRHWGOIDM-UHFFFAOYSA-N 391.588 5.372 30 20 GKED CC(C)(C#N)CNC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 611621086 WQXWXMVKYCQEID-UHFFFAOYSA-N 377.366 5.169 30 20 GKED COc1ccc2cc(-c3cc(C(=O)N[C@H](C)CC#N)c4ccccc4n3)ccc2c1 725893919 YONZBLAJGQKVEN-MRXNPFEDSA-N 395.462 5.096 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726485078 UKYXCCDZMZRRGI-NSHDSACASA-N 397.853 5.620 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 727784214 BYDNHHLHTNPVQQ-RYUDHWBXSA-N 396.657 5.236 30 20 GKED C#Cc1cccc(N(C(=O)Cc2sc(C)nc2-c2cccs2)C(C)C)c1 728248464 UOGYUNUQZLYPQK-UHFFFAOYSA-N 380.538 5.145 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(OCc2ccccc2)cc1 728439307 HDZKCJXGGZDJMQ-QXMHVHEDSA-N 387.266 5.202 30 20 GKED CC(C)[C@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 728764461 AVYJPTHPEMDDEO-DLBZAZTESA-N 382.916 5.956 30 20 GKED CCOCc1cc(/C=C/C(=O)c2oc3ccc(OC)cc3c2C)ccc1OC 729150506 KSTDIWGULPHZLF-RMKNXTFCSA-N 380.440 5.191 30 20 GKED Cc1ccc(C2CC(=Nn3c(C)nc4scc(-c5ccccc5)c4c3=O)C2)cc1 729816607 LFBGKFPQWXVIFL-UHFFFAOYSA-N 399.519 5.524 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc(O)cc1F 729932337 JGAMFRSITCSDBQ-UHFFFAOYSA-N 378.432 5.039 30 20 GKED COc1ccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)cc1[N+](=O)[O-] 730150262 QMJFIXLKIGZYBH-CLFYSBASSA-N 398.415 5.071 30 20 GKED C#CCOc1ccc(CN[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 733328606 WDEJRUJEGKLWJF-FQEVSTJZSA-N 392.499 5.128 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(Cc2ccccc2)CC(C)(C)C)c1 733805460 CFDJOCUFZCHICK-NRFANRHFSA-N 393.531 5.125 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1nc2ccccc2s1 734164097 JRGQIKMYYKROEH-QGZVFWFLSA-N 399.519 5.598 30 20 GKED Oc1nc2ccccc2cc1C=Nc1cccc(CSC2CCOCC2)c1 734752224 BPXLWHGMDIWOQY-UHFFFAOYSA-N 378.497 5.103 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 742537242 JHKZGAHAQRWFJQ-HOYKHHGWSA-N 386.470 5.689 30 20 GKED CC(=NNc1ncccc1Cl)c1cnn(-c2ccc(Cl)cc2Cl)c1C 743439490 YIYGJUBATRIKTH-UHFFFAOYSA-N 394.693 5.372 30 20 GKED O=C(/C=C\c1cnn(-c2ccc(Cl)cc2)c1)c1ccc(-c2ccncc2)cc1 745990100 JSUQLWVINCVTNJ-LAFDYMOFSA-N 385.854 5.484 30 20 GKED COc1cccc(C=NO[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)c1OC 752764187 PJPVHOQMDFPUSB-CYBMUJFWSA-N 386.835 5.124 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CC[C@H]2CCCC[C@H]2C1 756515248 LEIPNDSDVGTIBW-CTASWTNQSA-N 393.314 5.247 30 20 GKED C[C@@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1cccc(C#N)c1 762058888 NOKVKPPPULAVRH-GFCCVEGCSA-N 384.407 5.537 30 20 GKED C=C[C@H](CC(=O)N(c1ccc(N(C)C)cc1)[C@H](C)c1ccccn1)c1ccccc1 766589576 ZGEIQLDDXFUINI-NHCUHLMSSA-N 399.538 5.602 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 772093458 MOLNUTUVPNLGEB-UHFFFAOYSA-N 399.454 5.301 30 20 GKED Cc1cc(-c2cc(C(=O)O[C@H](C#N)C3CCCCC3)c3c(C)noc3n2)c(C)o1 776371174 OJCMJDGGXQYDKN-LJQANCHMSA-N 393.443 5.037 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2cc(OC)c(OC)cc2OC)cc1 777701422 FSIVQNPCTLHVCQ-AWEZNQCLSA-N 377.868 5.017 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)ccc1Cl 777856214 YFVMICZNPLWDBB-UHFFFAOYSA-N 393.899 5.088 30 20 GKED N#C[C@H](C(=O)COc1ccc(Oc2ccccc2)cc1)c1nccc2ccccc12 792092178 AEXSKHXZBPRGAC-HSZRJFAPSA-N 394.430 5.282 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCN(C)C(=O)OCc1ccccc1 793948363 KDNIQJLDDFAOEX-UHFFFAOYSA-N 394.515 5.136 30 20 GKED CC(F)(F)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 796744405 IRQFVYCPANWMFS-ZDUSSCGKSA-N 397.208 5.066 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)sc2ccc(C#N)cc12 796861132 OMRXCFBGRPJDDP-AWEZNQCLSA-N 391.452 5.320 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)OCCCC2(C#N)CCOCC2)cc1F 800169388 CGYDWVMKZOBHSE-UHFFFAOYSA-N 399.437 5.198 30 20 GKED N#Cc1cccc(COc2cccc(/C=C3/Cc4nc(Cl)ccc4C3=O)c2)c1 806578512 UDBSRAPSRSPCLH-ZDLGFXPLSA-N 386.838 5.008 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)ccc2c1 813216888 HLSPVSBKUVXXID-VXJUPVOZSA-N 396.368 5.152 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2csc(-c3ccc(Cl)cc3)n2)SC1=S 814291971 ICPDNODNXCWJGG-VGOFMYFVSA-N 392.958 5.241 30 20 GKED N#Cc1cc(CSC2=NC(=O)/C(=C/c3csc4ccccc34)S2)ccn1 814771109 LJDPFNOZNAXYBV-IUXPMGMMSA-N 393.518 5.072 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@](C#N)(c2ccccn2)C1 852332823 WAABGEHPCGDZQA-KSFYIVLOSA-N 392.890 5.008 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 857436582 DQJDDNKOHVPLCL-CQSZACIVSA-N 397.265 5.190 30 20 GKED C=C(CNC(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 861394374 LDQIQSHQCVACRT-UHFFFAOYSA-N 381.476 5.177 30 20 GKED Cc1ccccc1-c1noc(C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)n1 904564660 MOZGZLRXSALOKD-UHFFFAOYSA-N 392.890 5.128 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\Sc3ccccc3)n2)cc1 920138852 LAJLQPMFFWXECI-YUIUBULTSA-N 392.505 5.301 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1oc2cc(C)ccc2c1CC(=O)O 1776033195 LFYSVYDOBMFUHE-UHFFFAOYSA-N 390.361 5.223 30 20 GKED CC(=NNc1ccc(-c2ccccc2)cc1)c1cccc(OCCCC(=O)O)c1 1776059904 QBWCXCRMTFYRJG-UHFFFAOYSA-N 388.467 5.433 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NOC1CCCC1 1776112150 XNGKHIMSPPBRKN-UHFFFAOYSA-N 381.472 5.232 30 20 GKED CCCCCCCCOc1ccc(/C=C2/CCc3occ(C(=O)O)c3C2=O)cc1 1776785473 DCKZWSLNVGQMIE-SDXDJHTJSA-N 396.483 5.930 30 20 GKED CCCCCCCSc1ccc(C(=O)NC2(C(=O)O)CCCCC2)cc1 1776787545 VOONBPPAUZAUBU-UHFFFAOYSA-N 377.550 5.266 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1C 1777275244 UJGGFFGIZIMBJE-CLFYSBASSA-N 392.476 5.635 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1cc(Cl)ccc1Cl 56199854 POJPWBPQCQAAEQ-CYBMUJFWSA-N 392.286 5.115 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1sc2c(c1C#N)CCCCC2 61047373 QWPDHYNLSXBTQV-UHFFFAOYSA-N 393.537 5.573 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2 63389341 XHLBFOKLRXZHCR-UHFFFAOYSA-N 399.450 5.386 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 108529538 GIXAMEJFCANJLH-CVEARBPZSA-N 383.517 5.220 30 20 GKED C=CCn1c(SCc2nc(C)c(-c3ccc(Cl)cc3)o2)nnc1C1CC1 119501822 LDMQMCPRKMIYRN-UHFFFAOYSA-N 386.908 5.251 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2OCC#N)sc1-c1ccc(F)cc1 120127098 PZLDAXQLVPCGQB-UHFFFAOYSA-N 384.407 5.156 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)c(F)c1 127914591 DAIOTLFYUXPNDO-UHFFFAOYSA-N 393.777 5.005 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)ccc1NC(=O)OC(C)(C)C 132184638 MJCQYYXLOAMGOZ-HNNXBMFYSA-N 399.516 5.412 30 20 GKED C[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccsc1 152226756 DBTYRIFGPAABQV-MRXNPFEDSA-N 376.481 5.135 30 20 GKED Cc1cc(C)c(NC(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)c(C)c1 180391278 YMUKYGJFJYIAJQ-UHFFFAOYSA-N 378.419 5.233 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCSc3cc(C)c(C)cc32)ccc1OC 187338196 OPQZSLKXKOGTDX-AZUAARDMSA-N 396.556 5.320 30 20 GKED CCCn1c(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc2ccccc21 191508045 MZISUSICONFCAT-QGZVFWFLSA-N 386.480 5.060 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccccc3Cl)n2)cc1 193666068 GEOPAHBNSROLIV-FVNWOWOISA-N 389.867 5.225 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Br)cs3)cc2)cc1 195715663 CXHBGVYWUHIRSR-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(OC(F)F)cc2)ccc1OC(F)F 210056712 UNZYEIRPWPLDGN-OQFOIZHKSA-N 384.325 5.184 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(OCc3ccccc3)cc2)c1 237022736 GTOAGEKDPCEWQR-QHCPKHFHSA-N 386.495 5.236 30 20 GKED N#CC1(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)CCCCC1 302944216 AVCKXQBKUZIKFK-UHFFFAOYSA-N 394.327 5.453 30 20 GKED OC1=NCCc2c1ccc(N=C(O)C1(c3cccc(F)c3)CCCCC1)c2F 328903582 IBHSIUDUDANHNP-UHFFFAOYSA-N 384.426 5.316 30 20 GKED COc1ccc([C@H](C)/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)cc1F 329425247 GRKXPMMWNVQGCP-YJBOKZPZSA-N 399.510 5.359 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)CCO1 329684173 ZKVDTWZWXOVBEP-QFSBIZTOSA-N 391.309 5.079 30 20 GKED Cc1nn(C(C)(C)C)cc1C(O)=Nc1ccc(N2CCCCC2)c2ncccc12 329969315 ULJPSDLARLEXGB-UHFFFAOYSA-N 391.519 5.121 30 20 GKED CC[C@@H]1OCCC[C@@H]1C(O)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 330245272 KPFVWONLTQDCDC-LPHOPBHVSA-N 376.472 5.787 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCC[C@@H](c1ccccc1)C(F)(F)F 432461651 ISEFJQMMMFPKAQ-KRWDZBQOSA-N 382.451 5.182 30 20 GKED C=CCC(C)(C)CNC(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 432673385 XDXSKQDTPMIFRO-UHFFFAOYSA-N 380.492 5.363 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N(C)CC(C)(C)C#N)c(C(F)(F)F)c1 432825580 WLDLFDZNXWKGEQ-LBPRGKRZSA-N 387.471 5.609 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)[C@H](C#N)CCc1ccccc1 433377176 VMUIDDMBYHJXLR-NRFANRHFSA-N 383.495 5.318 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 433489478 RQZUHHIJLCJZOA-UZLBHIALSA-N 393.918 5.792 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc2sc(C)nc2cc1Cl 435187598 JNVPIMPEVGFJQT-UHFFFAOYSA-N 398.919 5.574 30 20 GKED C[C@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438069577 CIIQRAYEWBYLPJ-UUOWRZLLSA-N 399.469 5.236 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1 438451215 QQTAVIAKFPWOBV-HYVJGQCMSA-N 378.516 5.056 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1[N+](=O)[O-] 439119163 PNQZTGXEKYTLSJ-CQSZACIVSA-N 383.473 5.365 30 20 GKED CN(C(=O)C[C@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1Cl 439125051 SWPXRKDGUPHEDG-AWEZNQCLSA-N 380.797 5.409 30 20 GKED CCCc1c(NC(=O)Nc2ccc3[nH]c(C)cc3c2)cnn1-c1cccc(C#N)c1 439227368 CKYTYUQPEVLWAO-UHFFFAOYSA-N 398.470 5.130 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)N[C@@H](CCC#N)c2ccccc2)c(C(C)C)c1 439445226 WIGSHBPJJVMQGD-NRFANRHFSA-N 391.515 5.033 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)ccc(C(F)(F)F)c1F 443535489 WMXABYGKFKZCFE-NSHDSACASA-N 390.258 5.057 30 20 GKED CC(F)(F)c1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 444312090 BGSMCPOQUQHHQB-UHFFFAOYSA-N 379.366 5.110 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccccc2-n2ccc(C3CC3)n2)no1)c1ccccc1 453203390 BPFOBXYJQLLQMV-IBGZPJMESA-N 395.466 5.040 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F 454750837 CAOXVNLXMPIQRF-ILXRZTDVSA-N 399.482 5.714 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)C1 456046555 JFUOKPHDRORWCE-YIBWVLRXSA-N 397.478 5.127 30 20 GKED C[C@H](SCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)c(Cl)c1 463195080 VORWMLOHZFFEIC-NSHDSACASA-N 390.295 5.909 30 20 GKED CSc1ccc(F)cc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 467703731 FDGNJTSOFQZQRB-CYBMUJFWSA-N 389.521 5.121 30 20 GKED C=CCCN(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 468188243 VBPCPSWERBJKAD-UHFFFAOYSA-N 399.497 5.004 30 20 GKED C[C@H]1CCc2c(F)cccc2[C@H]1Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468878948 GLANEUQPDLBPPR-FYSMJZIKSA-N 391.490 5.144 30 20 GKED Cc1ccc(CC[C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469183410 XTNRCWNLCMJPGC-LJQANCHMSA-N 375.516 5.011 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)ccc1-c1ccoc1)c1cccc(Cl)c1Cl 471088028 CQWBATUTVKZNQK-QGZVFWFLSA-N 389.213 5.387 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1 475570902 DIYUJWAVYWNZEW-RBBKRZOGSA-N 398.934 5.844 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(OC)c(OC)cc2[nH]1 476810611 ZDNXKHXCRQGHNB-UHFFFAOYSA-N 378.472 5.289 30 20 GKED CC[C@H](N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc(C#N)cc1 479528732 JSOXWMOIZVGVOC-ZWKOTPCHSA-N 382.813 5.005 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2c(F)cccc2F)n1)c1nccc2ccccc12 483191174 BAMPVOXKCWIBJQ-CQSZACIVSA-N 391.402 5.127 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1 483628487 YTFAHTKDZKBCJS-UZLBHIALSA-N 397.519 5.979 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc[nH]c2C2CCC2)cc1 485973582 FENHUPQNTFCBBY-UHFFFAOYSA-N 385.467 5.180 30 20 GKED C[C@@H]1CCN(CCCC2(C#N)CCOCC2)[C@H]1c1ccc(C(F)(F)F)cc1 499569628 CCDLDUJGEMJMCH-VQIMIIECSA-N 380.454 5.189 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)c1ccc(Cl)cc1 499842397 VXMANQNXCAKDFW-OAHLLOKOSA-N 378.646 5.123 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2ccco2)Cc2ccc(C)s2)c1 502648312 OHOAFVJQULISEI-UHFFFAOYSA-N 382.485 5.449 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@@H](C)CC)cc2)nnc1-c1cccnc1 503711269 HIOWEQVDDDEFNE-INIZCTEOSA-N 392.528 5.015 30 20 GKED CCOc1cccc2cc([C@H](C)NC3CCN(c4ccc(C#N)cc4)CC3)oc12 513762093 QDDWSSCFHLAUAG-KRWDZBQOSA-N 389.499 5.023 30 20 GKED N#Cc1cccc(CSCc2csc(COc3ccc(Cl)cc3)n2)c1 517295735 QHLBGZSHZPNHBL-UHFFFAOYSA-N 386.929 5.681 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 517933888 LZLYBBTXPQXEDK-IBGZPJMESA-N 399.494 5.118 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccc2c(c1)CCC2 519413417 UZCGOJFIHJGZOL-OAHLLOKOSA-N 382.554 5.158 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 521800505 OGDIMZALPKUXQO-CQSZACIVSA-N 396.512 6.201 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2c(F)cccc2F)n1 523167756 QXOFILIMWDJTQF-UHFFFAOYSA-N 397.450 5.011 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)N[C@H](c1ccccc1)C(F)(F)F 523766529 MWXCFZCZIYIPDW-CYBMUJFWSA-N 380.263 5.270 30 20 GKED C[C@H](Nc1ccc(COc2ccccc2)cc1)C(=O)N(CCC#N)c1ccccc1 536882972 SYQMPUQCQPBPLF-FQEVSTJZSA-N 399.494 5.013 30 20 GKED COc1cc([C@H](C)NC2CCC(Oc3ccccc3C#N)CC2)ccc1SC 539077312 AHTAZVYODPDPEC-DZIBYMRMSA-N 396.556 5.330 30 20 GKED Cc1sc(CN[C@@H](C)c2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 540706829 UDQHPGHHGHUTBW-LBPRGKRZSA-N 385.895 5.634 30 20 GKED N#Cc1cc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)ccc1Cl 544405522 PJPMWPXOYJPBCR-UHFFFAOYSA-N 395.827 5.440 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1oc(C2CC2)nc1C 544717202 SBJLOXBAEXJZID-UHFFFAOYSA-N 389.430 5.027 30 20 GKED CCOC(=O)[C@@H]1CC[C@H](N[C@H](CCCC#N)c2ccccc2)c2ccccc21 550827135 KOIQZDKDRZLMQT-ZLNRFVROSA-N 376.500 5.193 30 20 GKED N#C[C@@H](C(=O)c1cccc2cccc(Br)c12)c1nc2ccccc2o1 552071178 TURHMKFUEHULJQ-AWEZNQCLSA-N 391.224 5.234 30 20 GKED N#C[C@H](C(=O)c1ccn(C2CCCCC2)n1)c1nc2cc(Cl)ccc2s1 558832409 WAJSXYSCYJFBKN-CQSZACIVSA-N 384.892 5.141 30 20 GKED CC(C)(C)n1nccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 565736517 HPOBTEOZESGZSQ-UHFFFAOYSA-N 394.862 5.208 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N2CCC(CCC#N)CC2)c1 568982070 DHDAELXYHRMSCY-UHFFFAOYSA-N 385.455 5.197 30 20 GKED CSc1ccc(C)c(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 570735454 LJVVRWQMFCZABI-UHFFFAOYSA-N 375.453 5.028 30 20 GKED C=CCC(C)(C)c1noc(-c2c(-c3cccc(Cl)c3Cl)noc2C)n1 573940792 PGEDMQVZWFVFGV-UHFFFAOYSA-N 378.259 5.861 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(OC)c(O)c1)c1ccc(C(F)(F)F)cc1 575873795 CNNKAYIBJYSHBH-KBXCAEBGSA-N 379.422 5.778 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cncnc3-c3ccccc3)c2C#N)[C@H](C)C1 584515778 FAQHCLZORFOLLZ-UONOGXRCSA-N 388.496 5.015 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1 590075193 JCNWZPWOSKMGEJ-UHFFFAOYSA-N 379.435 5.318 30 20 GKED N#Cc1cc(NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)ccc1Oc1ccccc1 599783618 FDDULPLXTIREEA-IRXDYDNUSA-N 383.398 5.145 30 20 GKED C=CC1CCN(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CC1 601092076 AVFLWBBZVMKGDD-UHFFFAOYSA-N 395.450 5.183 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccccc2O)cc1Cl 603758930 PCQIPNLVTJGNDF-FQEVSTJZSA-N 390.870 5.272 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)cc1 609033011 JLINGXGRBWYIMO-UHFFFAOYSA-N 383.382 5.290 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056204 DXSCBQJJISISQR-OAHLLOKOSA-N 394.858 5.217 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609731995 SLNJEUAVEUHVFH-UHFFFAOYSA-N 395.890 5.406 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)C1 612371114 YVDLIEXJDJRDLE-MIWMXLOXSA-N 397.478 5.080 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)c(Cl)c1 619458693 YKUKVNUWFCLGBA-MQMHXKEQSA-N 379.674 5.194 30 20 GKED C=CCN(C(=O)CCOc1cccc(C)c1)c1nc(-c2ccccc2)cs1 641900804 URPMRYDTUBMHCS-UHFFFAOYSA-N 378.497 5.107 30 20 GKED O=C(Nc1ccccc1SCC(F)(F)F)c1c(F)c(F)cc(F)c1F 673986464 OIKCLSYEFHBKIJ-UHFFFAOYSA-N 383.288 5.150 30 20 GKED N#CCOc1ccc(CNCc2ccc(-c3ccc(Cl)c(Cl)c3)o2)cc1 729685340 KDRSPUKXBALRGG-UHFFFAOYSA-N 387.266 5.446 30 20 GKED Cn1c(CC(=NOCc2ccc(Cl)cc2)c2ccccc2)nc2ccccc21 730100725 ULRPOCMMJNHNDU-UHFFFAOYSA-N 389.886 5.390 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccncc1 734657738 LERKSAUBLRUPGC-YWZLYKJASA-N 392.528 5.191 30 20 GKED C[C@@H](N[C@H](C)c1csc2ccccc12)C(=O)N(CCC#N)c1ccc(F)cc1 743475151 NYSQOXZBFJHTBN-HZPDHXFCSA-N 395.503 5.026 30 20 GKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1ccc([S@](C)=O)cc1 746367500 MPGKNZRPJNSCFM-QFIPXVFZSA-N 375.708 5.220 30 20 GKED CCN(C(=O)Nc1cccc(OCC#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 746663258 OKYGLMRVMKKEIZ-CQSZACIVSA-N 391.393 5.223 30 20 GKED CC1(C)CCCC[C@H]1CC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 752473877 MTXGERRVGYSQPK-ZFWWWQNUSA-N 397.544 5.058 30 20 GKED O[C@H](CN[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 775191988 NQYQBEHEGWUKHI-JKSUJKDBSA-N 395.318 5.161 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl 780682410 VSOINMCQJQPTRT-WDEREUQCSA-N 396.249 5.306 30 20 GKED O=C(/C=C\c1sccc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 782341855 LZEGXOKDNOFRLE-KTKRTIGZSA-N 380.918 5.014 30 20 GKED O=C(/C=C\c1scnc1C1CC1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 782346780 CEYLCWXFHNKXRO-GQSKFBFOSA-N 387.476 5.004 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1 782833959 YYCSZEIVYBQCBN-UHFFFAOYSA-N 397.519 5.464 30 20 GKED N#CCOc1ccc(CNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 792433963 WYAYXCVLXMHPOI-UHFFFAOYSA-N 380.797 5.040 30 20 GKED N#CC[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796653062 XLIAPCUJOJTBOM-GOEBONIOSA-N 379.872 5.214 30 20 GKED CCC(CC)(C(=O)OCCCC1(C#N)CCOCC1)c1ccc(Cl)cc1 800158729 CNZSJNOWEDXVNA-UHFFFAOYSA-N 377.912 5.042 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)OC[C@H]2CC[C@@H](C#N)CC2)c(Cl)c1 809089001 LRJDIBJTEZMKJZ-OKILXGFUSA-N 392.883 5.174 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/C(=O)c3ccccc3[C@H]2C)cs1 809157184 QWNQHFCLGBCGLI-VRCTWVPOSA-N 388.492 5.520 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(N2CCCCC2)cc1)c1ccccc1 814484605 VHOPSAPONGCUGV-QFIPXVFZSA-N 376.504 5.234 30 20 GKED C[C@H](C[C@@H]1CCCN1C(=O)OC(C)(C)C)N[C@H](CCCC#N)c1ccccc1 816627286 KEIFQDJFRRKOJQ-HLAWJBBLSA-N 385.552 5.189 30 20 GKED CC[C@H](Cc1ccccc1C)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 819947841 RFXOEGWHWXZWCC-NVXWUHKLSA-N 381.426 5.185 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 842939914 UTNYCYIIZPKVJC-GOSISDBHSA-N 380.513 5.058 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@@H]1CCCc2c(OC)ccc(Cl)c21)c1ccncc1 844990956 ZSEGWKRYDCMEHS-RTBURBONSA-N 399.922 5.080 30 20 GKED C[C@@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)cc(F)c1O 850545999 GGLXHBXNACTTGG-MRVPVSSYSA-N 379.291 5.375 30 20 GKED O=C1/C(=C\c2ccc(OCc3ccncc3)cc2)CSc2c(F)cccc21 915987935 NCUPQSOAQRDNPH-ATVHPVEESA-N 377.440 5.172 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccc(OC)c(OC)c2)cc1OC 916545408 HMQZVPOEPLPJBH-VURMDHGXSA-N 390.863 5.051 30 20 GKED Cc1cc(OCCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)ccc1Cl 916848282 IWLQBJPZWRZUDT-SFHVURJKSA-N 378.859 5.232 30 20 GKED CCCCc1ccc(CC(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 916911238 ZVLFRZOSYWMMNI-QFIPXVFZSA-N 390.527 5.044 30 20 GKED Cc1cc(C)c(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 917043622 LBSKSWRSDDDBCP-OAHLLOKOSA-N 384.888 5.130 30 20 GKED O=C(O)c1cccc(NN=C2CCCCC[C@@H]2c2ccccc2C(F)(F)F)c1 1776036957 ATHAMLBFNAUHDG-QGZVFWFLSA-N 390.405 5.919 30 20 GKED CC(C)c1ccccc1NC(=S)NN=Cc1csc2ccc(C(=O)O)cc12 1776040914 FWJMRRLZYYGEKA-UHFFFAOYSA-N 397.525 5.043 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(Oc2ccc(F)cc2)cc1 1776051041 RCVROLPILJJAEE-UHFFFAOYSA-N 394.402 5.161 30 20 GKED COc1ccc2c(c1)CC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1776127457 UATQDUXWMVIBGE-GHRIWEEISA-N 390.460 5.334 30 20 GKED CC(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776370523 WHLXUMICFGGGNI-NVNXTCNLSA-N 384.475 6.000 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)CO2 1776374724 VPHVVZCRNFOFDX-LPYMAVHISA-N 398.458 5.834 30 20 GKED O=C(/C=C/c1ccc2ccccc2c1F)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569982 VMKSWULRIYBJJE-VAWYXSNFSA-N 386.378 5.833 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3ccc(Cl)c(Cl)c3)o2)c1 1777686217 YKXRPHCVLHIKIO-VMPITWQZSA-N 387.218 5.848 30 20 GKED CC1(C)CCC(CC(=O)NC2(c3ccc(NC(=O)CCC#N)cc3)CCC2)CC1 1787889036 BKSRLBSVALPDQJ-UHFFFAOYSA-N 395.547 5.031 30 20 GKED CC(C)c1ccc(C(=O)Nc2nnc(SCc3ccc(C#N)cc3)s2)cc1 14621458 SCWQHFUWDBSZQS-UHFFFAOYSA-N 394.525 5.078 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)Oc1cccc(Cl)c1Cl 58136071 SVRGAPXHUBWSJI-AWEZNQCLSA-N 391.298 5.070 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1scnc1C1CC1 124951768 HRGCMUKLQSZGIL-UHFFFAOYSA-N 397.447 5.297 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@H](C)c3cccc([N+](=O)[O-])c3)o2)cc1 126278231 YHDXHALJJHWSIK-CYBMUJFWSA-N 383.429 5.063 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2sc(C(C)C)nc2C)ccc1OC 180813853 TVYIRQWFHTZEQA-WMLDXEAASA-N 387.549 5.115 30 20 GKED Cc1ccc(C(=O)CCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 183819551 KUZLJQCVEBNKMV-KRWDZBQOSA-N 380.513 5.381 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1cnn(-c2ccccc2)c1 191415724 LMURQGWWBPXIDO-UHFFFAOYSA-N 388.515 5.088 30 20 GKED CC1CCC(Oc2cc(CNCc3cccc(OCCCC#N)c3)ccn2)CC1 236832023 ADMHOLFNSQGLAP-UHFFFAOYSA-N 393.531 5.011 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2csc(-c3ccc(Cl)s3)n2)cc1 302942858 AOGYBAGINVJNRR-UHFFFAOYSA-N 387.917 5.578 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccnc3)cc2)c1 365161636 XAJNYLRRZJDQER-JOCHJYFZSA-N 384.439 5.115 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cccc(OC(F)F)c2)cc1 409853279 DTHVDYLMVLFARZ-UHFFFAOYSA-N 394.377 5.133 30 20 GKED C[C@@H](CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)CC(F)(F)F 412660763 RSMTVJMGGVNFSF-CQSZACIVSA-N 392.446 5.169 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(COC2CCCC2)cc1 425646563 BWSQUYRYNYUSGZ-QGZVFWFLSA-N 377.488 5.242 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 425660388 XGFFOJLKVRBNMX-CVEARBPZSA-N 378.501 5.035 30 20 GKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](C)Cc1ccccc1C(F)(F)F 431582069 HJMDAMVKSFUZPS-HNNXBMFYSA-N 389.421 5.256 30 20 GKED CCc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 432680770 VWGFZXDLAOTKKH-UHFFFAOYSA-N 378.419 5.526 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)c1nc2ccccc2o1 433121337 NIGUOXDURCLFDB-FQEVSTJZSA-N 391.430 5.321 30 20 GKED CC(C)(C)[C@@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)c2ccccc21 434989680 BVLVSXOQWFABGD-OAQYLSRUSA-N 385.515 5.009 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 435595970 DQAVIGAPJZTPNF-IEBWSBKVSA-N 379.529 5.767 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1c[nH]c2cccc(OCC)c12 437628729 JRVGNZJEZRHDSO-UHFFFAOYSA-N 388.920 5.039 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 437846962 LRBODPGBWXSKRC-HSQYWUDLSA-N 377.488 5.168 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1nc(-c2cc(Cl)sc2Cl)cs1 439145507 DWAWQJZEQBWWBI-UHFFFAOYSA-N 384.269 5.204 30 20 GKED CN(C(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccc(C#N)cc1 440048057 FUFOFQKWPKPIMV-UHFFFAOYSA-N 375.478 5.173 30 20 GKED C=CCC[C@@H](NC(=O)Nc1nc(COC)cs1)c1ccc(C(F)(F)F)cc1 442211405 XCHLAJIGIZLQAU-OAHLLOKOSA-N 399.438 5.137 30 20 GKED C[C@H](NCc1cncn1Cc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 445807381 IPISRORHHQORNC-FQEVSTJZSA-N 392.506 5.321 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2 460468586 JOVCXXLPIBXOFX-UHFFFAOYSA-N 391.490 5.007 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CC[C@@H]2CCC[C@H]2C1 460563571 JNFWPZWZSXTJIS-JENIJYKNSA-N 376.525 5.408 30 20 GKED CCC(CC)N(C(=O)[C@H](C)c1cccc(C#N)c1)[C@@H]1CCCc2cccnc21 464479557 IUFKNPFLDRSFPU-VGOFRKELSA-N 375.516 5.152 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 465593547 GJZCLGYDLKCKTA-NMNUPHIUSA-N 391.515 5.016 30 20 GKED COc1cccc([C@H](C)CCCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 469247136 PWZQSNOYDAXEMI-QZTJIDSGSA-N 396.556 5.859 30 20 GKED COCCC1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCC1 471230156 LXXFCIVHRRMLIN-LJQANCHMSA-N 382.891 5.141 30 20 GKED CN(C(=O)c1ccc(Cl)c(NCc2ccc(C#N)c(F)c2)c1)c1ccccc1 479487458 KLSFLUIPXKTGEN-UHFFFAOYSA-N 393.849 5.239 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](C)c1cccc2ccccc12 492662803 YEFHSNAOKPGXGL-MSOLQXFVSA-N 378.541 5.155 30 20 GKED CC(C)CN(C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1ccc(C#N)cc1 499318559 HXHYOINLRSUXMD-UHFFFAOYSA-N 395.915 5.638 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)Oc1cccc(F)c1 500744360 PBMUQHXJMCHUAP-MRXNPFEDSA-N 390.414 5.204 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N[C@H](C#N)c2ccc(Cl)cc2)cc1 505789626 HTAVZUZOESKQBG-GOSISDBHSA-N 395.915 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(F)c1Br 506046336 UZBZFOGREXSJQQ-UHFFFAOYSA-N 376.269 5.692 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1nc2ccccc2[nH]1 507021648 FXDUYENZDCAZGH-GOSISDBHSA-N 387.826 5.499 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cc(C#N)ccc3Cl)c(C)c2)n1 509229331 YMBRTPVPXICTHH-UHFFFAOYSA-N 399.928 5.689 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 513731033 QOMMROXELIZIOC-GCJKJVERSA-N 378.472 5.130 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)Nc3sccc3C#N)cc12 514613260 AZOJZFMVMUDOGM-UHFFFAOYSA-N 398.900 5.234 30 20 GKED CCO[C@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1 516340261 ODOWUNKTMVTXCK-NRFANRHFSA-N 388.492 5.102 30 20 GKED Cc1sc(NC(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)c(C#N)c1C 517807922 WTAFQGHWLMKUDI-UHFFFAOYSA-N 378.501 5.107 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)C(C)(C)c1ccccc1 520856632 LNRXVMHWQCOTIZ-IRXDYDNUSA-N 381.545 5.426 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cc(Cl)ccc3F)c2)c1 522307338 OPWYGOTVNWNWFA-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cc1Oc1ccncc1 522480552 DDCYKFHJSYXRDP-KRWDZBQOSA-N 397.356 5.086 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)CCCCC1 524456706 HYHREQAVBWMMOP-UHFFFAOYSA-N 389.430 5.579 30 20 GKED N#Cc1cc(NC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)ccc1F 524460097 ZPTPAHBHJAFWGK-UHFFFAOYSA-N 389.411 5.333 30 20 GKED Cc1ccc(C)c(N(C(=O)c2ccc(COc3ccccc3C#N)o2)C(C)C)c1 524468707 CCLJNRORPIGBHT-UHFFFAOYSA-N 388.467 5.402 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCOc1ccc(F)c(Cl)c1 530402245 VWHSROHDLKJDNY-UHFFFAOYSA-N 375.871 5.739 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cs2)n1C 536186746 JARUIRLMJKODQJ-CQSZACIVSA-N 396.541 5.104 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C1CCC(F)(F)CC1 537245754 IREYUGAIYBLHAD-GFCCVEGCSA-N 389.286 5.251 30 20 GKED N#Cc1ccc(Cc2cnc(NCc3cnc(-c4cccs4)s3)s2)cc1 543681433 DBIPFZVYPVZXEL-UHFFFAOYSA-N 394.550 5.403 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1cc(C#N)ccc1F 544489769 DVKZCJOOYTVNJV-LBPRGKRZSA-N 385.895 5.634 30 20 GKED COc1ccc(OC(C)C)c(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 550385274 SHGGSXIICJXNAD-UHFFFAOYSA-N 380.469 5.130 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 558504877 ZOCSLXSNYWOXBZ-UZUQRXQVSA-N 398.466 5.361 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F)C(F)(F)F 567949907 WFKFEIXXSRNEEX-SECBINFHSA-N 395.274 5.426 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1C 570251436 QBKYSXXBCVMDHP-UHFFFAOYSA-N 388.427 5.015 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCCc3occc3C2)cc1 573051215 GXXGLEKBVKKPRX-UHFFFAOYSA-N 388.492 5.032 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC4(CCCCC4)C3)cc2F)c1 577668620 OQUUYPCFYJRRLJ-UHFFFAOYSA-N 393.462 5.074 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(NC4CCCCC4)cc3)CC2)c1 586762428 HOOLMCMHPWOEHP-UHFFFAOYSA-N 377.463 5.112 30 20 GKED Cc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1Br 590477903 FASHYJYKTCOFHJ-GOSISDBHSA-N 385.305 5.231 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2Cl)on1)c1nc2cc(F)ccc2s1 592973810 IASNFRDIWFOMTB-LBPRGKRZSA-N 397.818 5.234 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccncc1 596733815 KQIIYFGLFKCPBV-OXJNMPFZSA-N 392.528 5.092 30 20 GKED N#Cc1ccc(Sc2nnc(-c3ccccc3)n2-c2ccc(Cl)cc2)nc1 602371571 GORDXWRTGKTQPO-UHFFFAOYSA-N 389.871 5.006 30 20 GKED N#Cc1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CC3)cc1 603460042 YITJGEKTXZOJPD-VKAVYKQESA-N 391.430 5.439 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)Nc3ccc(C(C)(C)C#N)cc3)oc12 603658148 PPENFHNUZDCFPY-HNNXBMFYSA-N 391.471 5.515 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3)no2)sc2c1-c1ccccc1CC2 603991893 FWLBCBABONTIJS-UHFFFAOYSA-N 397.459 5.293 30 20 GKED C=CCCCN(C)C(=O)c1cc(-c2ccc(C)cc2)nc2c1cnn2C(C)C 605645485 KLXMLIBTHBHFPN-UHFFFAOYSA-N 376.504 5.026 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)c2)cc1 609177115 KCBUPTCCAXFKQF-HOTGVXAUSA-N 388.389 5.658 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)sc2cccc(F)c12 609377809 NGWKOVZWMIIOIA-LBPRGKRZSA-N 384.501 5.853 30 20 GKED CC[C@@H](CNC(=O)c1c(Cl)cc(C#N)cc1Cl)Oc1ccccc1Cl 611094884 DEKVEUBMNPKRFZ-LBPRGKRZSA-N 397.689 5.106 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CCc4cc(C#N)ccc43)cc2)cc1 618751361 HIFUOJGJEOUOEH-QHCPKHFHSA-N 394.434 5.031 30 20 GKED C[C@H](C1CC1)N(C)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646437357 PYZSIXZCNUHLQE-SECBINFHSA-N 386.311 5.238 30 20 GKED CCCc1occc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 684948412 GKRRFSZLHNOCQI-GFCCVEGCSA-N 378.375 5.351 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Oc2ccccc2)cc1 726073360 IMVODJSZOVEDOL-KRWDZBQOSA-N 387.439 5.264 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1sccc1Br 727263811 ITKPOWUYKNWNCS-VOTSOKGWSA-N 376.300 5.530 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)Nc1ccc(F)cc1 727978191 BJEKYFSOUNIXMI-UHFFFAOYSA-N 391.471 5.394 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1C 728062871 XRRIQBFWCDVSKV-IBGZPJMESA-N 399.494 5.193 30 20 GKED CCn1cc(/C=C2\CC(C(C)(C)CC)C/C(=C\c3cnn(CC)c3)C2=O)cn1 732528825 ACHWERALXPFHCR-LQGKIZFRSA-N 380.536 5.002 30 20 GKED COCCOc1ccc(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)cc1 732714637 WOKCWZGPWQEQOZ-VZUCSPMQSA-N 389.451 5.104 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)C2CCCC2)c1 733805129 NSUZMRULZKITMP-FYYLOGMGSA-N 391.515 5.098 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(C(C)C)cc2C(C)C)c1 733843733 UYNYDABFXXWUAP-FQEVSTJZSA-N 393.531 5.936 30 20 GKED N#Cc1ccc(NC(=S)N[C@H](Cc2ccccc2)c2cccs2)cc1Cl 734982417 DBEIPCAFOPLEAL-GOSISDBHSA-N 397.956 5.544 30 20 GKED Cc1ncc(COC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 735004110 UHWBNRUPALAFAD-UHFFFAOYSA-N 384.844 5.126 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1ccc(OC)c(OCCCC#N)c1 735978721 KAPZPCLZQQUFKJ-TWGQIWQCSA-N 399.874 5.326 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@]12CCCc1ccccc12)c1nc(-c2ccccc2)cs1 744037514 XJXYHWJTTPWPPL-FPGHNAPASA-N 384.504 5.281 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3c4ccccc4n(C)c3s2)n1 747197519 GQCKSCNJIDGWAN-AWEZNQCLSA-N 379.510 5.463 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2)nc1 748606992 OBWBURMNJJIOAJ-OAQYLSRUSA-N 386.455 5.349 30 20 GKED CC(C)C[C@@H](C)OCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 756241799 LITVYMSIEANACD-OCCSQVGLSA-N 398.450 5.333 30 20 GKED CN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1ccccc1C#N 764394746 BVSVPGXSODFXCV-UHFFFAOYSA-N 381.410 5.189 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 765909474 OCHIQBGYXGILKP-VWNXMTODSA-N 396.494 5.415 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1C(=O)/C=C\c1cncs1 767727887 CVYLLTZTGHYRIZ-SREVYHEPSA-N 391.315 5.234 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2cccc(Br)c2)cc1 768420238 ACSQYFJCBVPTCT-FOIQADDNSA-N 385.305 5.077 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2cccc(Cl)c2)cc1 780165305 OMQJCOMNUNDKPF-HNNXBMFYSA-N 392.842 5.675 30 20 GKED CCOc1cc(/C=C/C(=O)c2cnn(C(C)C)c2C)ccc1OCC(F)(F)F 787185988 DWEGXAOWFOBVLZ-SOFGYWHQSA-N 396.409 5.008 30 20 GKED COc1cccc(Cl)c1CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 790766702 DFNBDLPBDKQGFF-MRXNPFEDSA-N 396.899 5.200 30 20 GKED CC1(C)C[C@]1(C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 813300582 HHQYZDKFZKNWJX-OAQYLSRUSA-N 393.537 5.011 30 20 GKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)n1[C@H](C)c1ccccc1 817318545 CLFKNPWLSDPEIO-CJFMBICVSA-N 399.538 5.879 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2cc(Cl)sc2Cl)ccc1OC 823845137 AXEBNPZSSGHZGL-CYBMUJFWSA-N 385.316 5.034 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)C1CC(F)(F)C1 863073381 RMBHKEUZSIVDBG-UHFFFAOYSA-N 376.407 5.331 30 20 GKED COCCc1nc(C)c(C(C)=NNc2ccc(OCc3ccccc3)cc2)s1 863160691 OXWHARIWSVDYNI-UHFFFAOYSA-N 395.528 5.056 30 20 GKED CC(C)(c1cc(F)cc(C#N)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 904314087 BOMBPNMOBDBGHK-UHFFFAOYSA-N 375.325 5.092 30 20 GKED COc1cc(/C=C\C(=O)c2sccc2Br)ccc1OC(F)F 915113043 MICJWXQGCPTHQP-RQOWECAXSA-N 389.217 5.017 30 20 GKED CCc1cccc(C)c1NN=Cc1cccc(O[C@@H](C(=O)O)c2ccccc2)c1 1776056746 MPGPYIBRBJUNGW-HSZRJFAPSA-N 388.467 5.208 30 20 GKED Cc1c(NN=Cc2cc(Cl)c(OC(C)C)cc2Cl)cccc1C(=O)O 1776088918 QQCMRUWBIIRQOU-UHFFFAOYSA-N 381.259 5.233 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)CC1 1776161798 DIDLMDCPROMTQP-UHFFFAOYSA-N 387.426 5.000 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](CC(=O)O)Cc2ccccc2)c1 1776788707 PVYFAUUVQWXWHG-HSZRJFAPSA-N 397.559 5.459 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)/C=C\c1csc2ccc(C(=O)O)cc12 1777489960 LIUFIKUCMDPKLN-ALCCZGGFSA-N 385.510 5.558 30 20 GKED O=C(/C=C\c1ccc(Cl)cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570058 IYHNXWVFFZFRKI-VURMDHGXSA-N 387.218 5.848 30 20 GKED O=C(O)c1ccc(Br)c(/C=C2/CCc3ccc(Cl)cc3C2=O)c1 1777672894 JKVGGPJVFMVKBE-XFFZJAGNSA-N 391.648 5.013 30 20 GKED CC(C)CCSCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 56415474 ZMZRYLHTYDRGEY-UHFFFAOYSA-N 382.529 5.049 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C1CCC1 108372862 UBPQPOYPICZTEZ-SBUREZEXSA-N 393.556 5.150 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 112738204 DUZZAISTMHAHFF-LAUBAEHRSA-N 381.545 5.799 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N(CCC#N)c2ccc(C)cc2)cc1 116101390 WDWJVWHUSGIGTH-UHFFFAOYSA-N 389.524 5.225 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccccc1C 124122871 WZSQCXZXAMXDEM-HNNXBMFYSA-N 382.533 5.578 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1cccs1 133953327 KKNYUQQFZAMRKR-UONOGXRCSA-N 376.572 5.433 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CCC#N)c1ccccc1 151446387 TXYVOQRZHFKSQJ-SFHVURJKSA-N 376.287 5.180 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c2)n1 151832774 JJTRXAPJBSVJDY-CQSZACIVSA-N 393.537 5.623 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 171797168 SSNFBFQJJQPBIZ-PBHICJAKSA-N 385.439 5.179 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21 180015021 KRVATYCKYASRIT-HRAATJIYSA-N 375.472 5.051 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 180173095 NHYBDPAOQLTQRH-UHFFFAOYSA-N 382.769 5.270 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-c2cccc(F)c2)n1 189898155 NSVFMPKPRQBCJI-UHFFFAOYSA-N 394.515 5.982 30 20 GKED C=CCn1c(SCc2csc(C(C)(C)C)n2)nnc1-c1ccccc1F 195548931 JDODBQIHZBRISD-UHFFFAOYSA-N 388.537 5.317 30 20 GKED CCS[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)C(C)C 303144522 LKQODSMWKXJFET-FQEVSTJZSA-N 384.501 5.075 30 20 GKED COc1ccccc1C(C)(C)/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329472399 OHHIEJUIENOVMP-GOSISDBHSA-N 395.547 5.394 30 20 GKED Cc1csc(-c2cccc(N=C(O)N3CCC[C@H]3c3noc(C(C)C)n3)c2)n1 330250709 NCHDMVVIINIXCF-INIZCTEOSA-N 397.504 5.008 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H]2Cc2cc(F)ccc2F)cc1 416752784 DSAGINIBEDDYQB-LJQANCHMSA-N 383.442 5.005 30 20 GKED Cc1c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cccc1OCC(F)(F)F 425650153 LADSVZBAJAYTOR-AWEZNQCLSA-N 391.393 5.033 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(CCC(F)(F)F)cc1 425657587 IOYAOFHQSJEVIG-CQSZACIVSA-N 375.394 5.278 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(OCC(F)(F)F)c1 431929691 ZJSMQGPQFPYVQQ-ZDUSSCGKSA-N 394.418 5.132 30 20 GKED N#CC1(c2ccc(C(=O)N[C@@H](c3ccc(F)c(Cl)c3)C(F)(F)F)cc2)CC1 436467329 BJEGPKJFLQHIHN-INIZCTEOSA-N 396.771 5.068 30 20 GKED CCS[C@@H]1CC[C@H](N(C)C(=O)c2ccccc2Sc2ccccc2C#N)C1 437113872 CEOXDZQMONPTMN-ZWKOTPCHSA-N 396.581 5.456 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cc(Cl)c(Cl)cn3)c2)c1 443957698 FMRXDYVURAGKTI-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c(OC(C)C)c1 446854744 BQPJJLFCSHUWDE-QGZVFWFLSA-N 397.544 5.356 30 20 GKED CCN(C(=O)CC(C)(C)C#N)[C@@H](c1cccnc1)c1csc2ccccc12 447334499 LNTHBQGTQZFDSQ-NRFANRHFSA-N 377.513 5.174 30 20 GKED COC[C@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 454477901 DROCDKBDOANBST-QUCCMNQESA-N 397.906 5.028 30 20 GKED CCOc1ccccc1C1=CCN(C(=O)Nc2ccc(CC#N)cc2Cl)CC1 455695938 BPLCHRQRDGUPTR-UHFFFAOYSA-N 395.890 5.126 30 20 GKED COc1ccc([C@H](N[C@H]2CCC[C@@H](C#N)C2)c2ccccc2Cl)c(OC)c1 463241807 FEOZMECIBDUCQN-ZMPRRUGASA-N 384.907 5.119 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCN1c2ccccc2CC[C@H]1C 469197237 ZDIJQINENINRQZ-QZTJIDSGSA-N 393.556 5.251 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)OCc1ccccc1 469507050 QZIRBFCDUNJKNW-SFHVURJKSA-N 386.451 5.203 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCCC(=O)c1ccc(F)cc1 476791044 HOWUXQYDJYIWEH-UHFFFAOYSA-N 381.491 6.059 30 20 GKED C=CCN(C(=O)c1cc(C(C)C)nc2c1c(C)nn2C(C)(C)C)c1ccccc1 477231912 HVKWJNRYDNJLBE-UHFFFAOYSA-N 390.531 5.451 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccc2c(c1)CCC2 481794498 KFLNTLCNEQHJMB-KRWDZBQOSA-N 394.540 5.367 30 20 GKED CC[C@@H](C)n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 482561500 RYTXRDDVGFXGKV-MLGOLLRUSA-N 398.919 5.430 30 20 GKED C=CCN(C(=O)c1cc(-c2cc(C)oc2C)nc2onc(C)c12)c1ccccc1 484264081 NGXMWWWBQBDGIQ-UHFFFAOYSA-N 387.439 5.241 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc[nH]c3C3CCC3)c2)cc1 485792220 TYNKXAHFFWQOFD-UHFFFAOYSA-N 385.467 5.180 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3nc(C(C)(C)C)cs3)o2)cc1 489818487 XWUKXGASEVLONJ-UHFFFAOYSA-N 387.530 5.348 30 20 GKED N#CCCN(Cc1ccco1)C(=O)CCCc1ccc2c(c1)-c1ccccc1C2 490627836 ORMZDABFYYBXIU-UHFFFAOYSA-N 384.479 5.116 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2CC(F)(F)C2)cc1Cl 490861200 WCIQBXWFQYNZOY-KRWDZBQOSA-N 389.833 5.162 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2nc3ccccc3s2)s1 498486511 KZQPYVIFSAYNJD-UHFFFAOYSA-N 389.505 5.169 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cc(F)cc(F)c1 502672165 VKEWMXCTQDTAQE-UHFFFAOYSA-N 399.210 5.087 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)CSCc2ccc(C#N)cc2)cc1 504695038 MCRYUUXIFOYUPI-INIZCTEOSA-N 384.570 5.169 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)NCCCCC#N 508387747 QLZWFMGBVGMLJB-UHFFFAOYSA-N 393.409 5.191 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 509697844 LWLKDNWPBNAOCK-NRFANRHFSA-N 393.849 5.456 30 20 GKED CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)C(=O)c1cccc(CC#N)c1 510129682 DELFYURJURWCME-UHFFFAOYSA-N 392.499 5.671 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cccc(C(F)F)c3)c2)c1 511504903 CETMPMKBDWRGIX-UHFFFAOYSA-N 378.378 5.327 30 20 GKED N#CC1CCN(C(=O)NCc2ccc(Oc3cccc4ccccc34)cc2)CC1 512365597 AYGPDFJXEVYMEZ-UHFFFAOYSA-N 385.467 5.077 30 20 GKED C[C@@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)cc1F 512655664 WEOAWSRANTVTEI-IVZQSRNASA-N 379.866 5.380 30 20 GKED CCOc1ccc(Oc2cc(CN[C@@H](C)c3ccc(C#N)cc3F)ccn2)cc1 512661614 SZQUSTBSXJZBHH-INIZCTEOSA-N 391.446 5.134 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2cccs2)c1 513968049 VLABFEPWHPTESN-UHFFFAOYSA-N 375.497 5.731 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1Cl 518239676 KIEGVZYIEZCKLJ-GJZGRUSLSA-N 388.920 5.449 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)sc2cccc(F)c12 521326792 HBGATKQADKRMPT-GFCCVEGCSA-N 384.501 5.995 30 20 GKED C[C@@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccc(F)c(F)c1 525145820 UVFZRIKSKLWJAA-GFCCVEGCSA-N 394.446 5.406 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1OC1CCCCC1 525566788 FJMBPBZJLCHXGI-KRWDZBQOSA-N 394.540 5.902 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc([C@H]4CCOC4)c3)c2)cc1 536378192 KXKIOARMBPSEOC-FQEVSTJZSA-N 384.435 5.107 30 20 GKED CS[C@@H](C)CCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 538034735 NASWFXUZMPNDNX-NSHDSACASA-N 376.469 5.181 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1c(Cl)cccc1Cl 539006249 VQEGODCMLFTUJS-UHFFFAOYSA-N 398.249 5.329 30 20 GKED Cc1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2ccccc12 542947729 LIDRCDVYEVQUBN-KRWDZBQOSA-N 378.479 5.328 30 20 GKED CN(C(=O)c1ccc(F)c(C#N)c1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 551610170 OAUMYHIHZFIPHR-PKOBYXMFSA-N 390.380 5.124 30 20 GKED COc1cc(Cl)c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1C 558215154 ZLNSWQNPCKFOTE-UHFFFAOYSA-N 385.895 5.219 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cnccc3Oc3ccccc3)n2)cc1 573549151 NWYSBLFHJMBSDX-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@@H]1c1cccs1 578513249 PVGPBSDFQNBFEH-OAHLLOKOSA-N 379.407 5.254 30 20 GKED N#CCCCCCC(=O)N[C@@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 588162884 OKRTWRZPUXDFSD-PKOBYXMFSA-N 380.454 5.712 30 20 GKED N#Cc1cc(NC(=O)c2sc3cc(F)ccc3c2Cl)nc2ccccc12 589042557 DVTZRYUPOXHGOJ-UHFFFAOYSA-N 381.819 5.366 30 20 GKED CC[C@@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 600002800 XNPQQIYUUVDOMF-CVEARBPZSA-N 395.528 5.172 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N(Cc3cccs3)C3CC3)cn2)c1 603692413 UOWLUDQZEACMMH-UHFFFAOYSA-N 390.468 5.004 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)CCC2)c1 603763450 AEDKAYHVUBJPLJ-UHFFFAOYSA-N 383.451 5.114 30 20 GKED COc1ccc(Cl)cc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 603991876 VTRYPIBDQINTLU-UHFFFAOYSA-N 394.883 5.300 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)COc1ccc(C#N)cc1 609066256 AJTJVPAWSPOUTM-GOSISDBHSA-N 386.451 5.024 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609082748 XFGHIQPLGNVTNU-NSHDSACASA-N 379.794 5.038 30 20 GKED CCN(C(=O)[C@@H](C)c1c(Cl)cccc1Cl)[C@@H](C)c1ccc(C#N)cc1 609581112 JHDAKMQAWXUMLU-KBPBESRZSA-N 375.299 5.578 30 20 GKED CC(C)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1ccc(F)cc1 609647877 WSLXFGSFAQOTGW-UHFFFAOYSA-N 388.442 5.332 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCOc3ccccc32)c1 609723254 XRXXAJXBADWVBA-UHFFFAOYSA-N 390.826 5.043 30 20 GKED CC(C)Cn1c(S[C@@H](C)c2ccc(C#N)cc2)nnc1-c1ccccc1F 609813665 ZFKLIQZETIHXCQ-HNNXBMFYSA-N 380.492 5.465 30 20 GKED N#Cc1ccsc1C(=O)N(c1cccc(Br)c1)C1CCCCC1 610046786 SOCCGJDXUYVQJM-UHFFFAOYSA-N 389.318 5.362 30 20 GKED COc1cc([C@@H](C)Nc2c(C#N)nnc3ccccc23)ccc1OCCC(C)C 610129657 YTHUBRYGZZJPFT-MRXNPFEDSA-N 390.487 5.108 30 20 GKED CCC[C@]1(C)CCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 610321117 HMRHMCKJYRYGPB-JOCHJYFZSA-N 378.476 5.180 30 20 GKED CN(Cc1cc2ccccc2o1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610455046 WIUOVWSHAXYAPA-UHFFFAOYSA-N 398.422 5.156 30 20 GKED N#Cc1cc2c(nc1NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CCCC2 611227006 QUKKZAVWYKQZAW-CHWSQXEVSA-N 391.359 5.153 30 20 GKED C=CC[C@@H]1CCCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 617787511 QAEMDGKWNNDMHE-CQSZACIVSA-N 393.314 5.396 30 20 GKED FC(F)(F)[C@@H]1C[C@@H](N[C@H](c2ccccc2)C(F)(F)F)C[C@H](C(F)(F)F)C1 643307154 ZZNZIGUIMHWELP-MROQNXINSA-N 393.293 5.789 30 20 GKED C=CCC[C@H](NCc1nnc(C(F)(F)F)s1)c1ccc(C(F)(F)F)cc1 660203531 DOWXLUXMLNFKPA-LBPRGKRZSA-N 395.372 5.373 30 20 GKED FC(F)Oc1ccc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1Cl 678298872 ZFURCGLZBJQFCM-RKDXNWHRSA-N 397.693 5.114 30 20 GKED N#Cc1ccc(NC(=S)N[C@H]2CCSc3ccc(Cl)cc32)cc1Cl 726452797 ZFDFZBZKYQPBAR-HNNXBMFYSA-N 394.352 5.389 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@@H](C)c1nc(C(C)(C)C)no1 728062921 REFNFUMZVCSCEJ-INIZCTEOSA-N 390.487 5.299 30 20 GKED N#CCOc1cccc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)c1 730151864 RTMFVTZKCPQRCX-DHZHZOJOSA-N 379.362 5.240 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CCC1)c1nc2cc(F)ccc2s1 730416091 AIQBPSQNOIYCGZ-HNNXBMFYSA-N 384.863 5.387 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN(C)c1ccc2ccccc2c1 731029137 WONZVMRCFBECOZ-QGZVFWFLSA-N 389.524 5.309 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1nccn1Cc1ccccc1 734094854 HXKNNUBOVASDFH-SEYXRHQNSA-N 385.492 5.259 30 20 GKED C[C@H](SCc1cc(Cl)ccc1OCC#N)C(=O)Nc1cccc(Cl)c1 735320532 WTAXREPBCJAGQT-LBPRGKRZSA-N 395.311 5.156 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cc(Cl)cs2)cc1 737321801 BFTMUUWIJHKXCS-SCLBCKFNSA-N 388.920 5.195 30 20 GKED C/C(=C\C(=O)Nc1c(C)c(C)nn1-c1ccc(C#N)cc1)c1ccccc1Cl 739669008 MTMVCEFYKMTBRG-WYMLVPIESA-N 390.874 5.056 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccccc2SCC=C(C)C)c1 741188449 QHBXZDPCAAOVPL-LJQANCHMSA-N 394.540 5.356 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccccc3)n2C)cc1 744033486 RSTISYKTOCNVOE-DYESRHJHSA-N 399.494 5.167 30 20 GKED N#CCOc1ccccc1C(=O)N(C1CC1)[C@@H]1CCCC[C@H]1C1CCCCC1 744374030 JFIJTHVBIVJTBO-RBBKRZOGSA-N 380.532 5.333 30 20 GKED CCC(C)(C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 745947740 LHSQQSOXPWNIGK-ZDUSSCGKSA-N 381.328 6.119 30 20 GKED C#Cc1cccc(NC(=S)N(C)[C@H](c2ccncc2)c2ccc(Cl)cc2)c1 749013245 NQCFQFGZXHXQRI-NRFANRHFSA-N 391.927 5.135 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)OCc2ccc(-c3ccccc3C#N)cc2)s1 750438909 GRFRQARJSURBGJ-OAHLLOKOSA-N 392.480 5.055 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(F)c(Br)c1 753143586 WZCQAPHYFQWEBO-DUXPYHPUSA-N 389.249 5.003 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1csc(-c2ccccc2F)n1 768012871 JKQWYOKEHZWCJH-UHFFFAOYSA-N 380.444 5.107 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 772981744 ADYUIVPOEPIAPD-NQIIRXRSSA-N 399.332 5.297 30 20 GKED O=C(/C=C\c1nc2ccc(Br)cc2s1)c1cc(F)ccc1F 773122827 AEDSUAQZPBTYOR-WAYWQWQTSA-N 380.213 5.233 30 20 GKED C[C@H](N[C@H](COCc1ccccc1)c1ccccc1)c1ccc(OCC#N)cc1 776164427 TXMUVZUSHFGVHV-NBGIEHNGSA-N 386.495 5.198 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(C#N)c(F)c1 777221275 FVRGJPURWDHGHF-CQSZACIVSA-N 381.451 5.168 30 20 GKED CC(C)(C)[C@H]1CCc2nc(NC(=O)c3ccccc3SCC#N)sc2C1 778505864 XPULQUAPISFSQS-ZDUSSCGKSA-N 385.558 5.162 30 20 GKED Cc1cc(Br)cc2c1C(=O)/C(=C/c1cnc(-c3ccncc3)s1)C2 782368439 GQDRFIOCGKSSOU-NTEUORMPSA-N 397.297 5.098 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)NCCCCC(F)(F)F)cc1 794974730 SYMALRSRPFWIKW-GOSISDBHSA-N 391.462 5.361 30 20 GKED CN(Cc1ccccc1)c1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1 795399173 YHCDNNNYLAJNEQ-UHFFFAOYSA-N 375.859 5.100 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C(Cc1ccccc1)Cc1ccccc1 798493530 VQRRAUYJCVZNKI-IBGZPJMESA-N 384.479 5.018 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2ccc(C(F)(F)F)s2)C(=O)c2ccccc21 802707039 CVNHFQQJSYCKGD-SLZMIMFISA-N 380.387 5.084 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C\c3ccc(-c4ccncc4)cc3F)cc12 806577453 RANXCASHYDCOGE-WAYWQWQTSA-N 377.444 5.040 30 20 GKED C[C@H](N[C@H]1c2cccc(Br)c2CC1(C)C)c1ccc(OCC#N)cc1 813885099 QCTPZTHHRHUPLP-XOBRGWDASA-N 399.332 5.326 30 20 GKED Fc1cccc(C=NOCc2ccc(CON=Cc3cccc(F)c3)cc2)c1 824205367 APZUOYXJLTZPKN-UHFFFAOYSA-N 380.394 5.066 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)C(=O)c2sccc2Br)sc1C 845847751 XTUBMEBDWMUHAN-LLVKDONJSA-N 396.331 5.038 30 20 GKED O[C@@H](CC(F)(F)F)c1ccc(-c2cc(F)ccc2OCC(F)(F)F)cc1 854195685 JADRHYXGJZOGOL-AWEZNQCLSA-N 382.275 5.420 30 20 GKED C=CC[C@@H](OC(=O)CCc1nnc(C(F)F)o1)c1ccc(Cl)c(Cl)c1 870338652 AKLIWUGFCNMMOZ-GFCCVEGCSA-N 391.201 5.107 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(-n2cccn2)cc1 912859021 QNCDVBYKKBOEAM-FLIBITNWSA-N 375.428 5.031 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2nc3ccccc3s2)cc1 915180644 QOKIERZBIRWNRQ-KYFVDPIZSA-N 395.487 5.604 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)NCc2ccc(C#N)cc2)cc1 916410348 ZYVNTPFXDCBTGM-UHFFFAOYSA-N 387.439 5.071 30 20 GKED CCCC(=O)Nc1ccc(O)c(C(C)=NNc2nc(-c3ccccc3)cs2)c1 916545515 LNAWXSXSFJJYNP-UHFFFAOYSA-N 394.500 5.090 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCc3cc(F)ccc32)cc1 919904265 CQJXUUKZUPHMOG-PKTZIBPZSA-N 385.442 5.290 30 20 GKED CCC(=NNc1nc(Cl)c(Cl)cc1Cl)c1cc(C(=O)O)ccc1F 1776022121 RFVXELSLHNJTSU-UHFFFAOYSA-N 390.629 5.105 30 20 GKED C=C(Cl)C[C@@H](NCc1cc(Cl)ccc1Oc1ccccc1CC)C(=O)O 1776142317 LWJMYSHSKQEFHO-QGZVFWFLSA-N 394.298 5.380 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)cc1 1776144296 PUJXZTQFCLIFOS-TWGQIWQCSA-N 377.223 5.066 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1c1ccc(C(=O)O)n1C 1776786878 YOBKTGMKCLVPIP-IEBWSBKVSA-N 376.541 5.164 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2ccsc2)c1 1776788059 NDDYPMBWMGCESO-FQEVSTJZSA-N 375.534 5.403 30 20 GKED COc1c(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cccc1C(C)(C)C 1777254553 OXJHPDFWGBVQFJ-ZRDIBKRKSA-N 396.483 5.374 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 24434072 QUGMMMLUABSRGW-UHFFFAOYSA-N 387.439 5.148 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)NC2CCCCC2)cc1 27462179 ZLLKEDZZWQAKPU-UHFFFAOYSA-O 395.592 5.014 30 20 GKED CCN/C(S)=C(/C(=O)c1cc(C)c(C)cc1C)[n+]1ccc(C(CC)CC)cc1 32813722 NQRJISBDINYUSD-UHFFFAOYSA-O 397.608 5.351 30 20 GKED N#CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccccc2)CC3)CC1 61584837 ULXVAQZSERVZQI-SILNSSARSA-N 393.490 5.097 30 20 GKED CCc1cc(C#N)c(NC(=O)c2oc3ccc(Br)cc3c2C)s1 108398619 QHCBYYCAVZSCHU-UHFFFAOYSA-N 389.274 5.252 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cnc(C(C)(C)C)s1 108983088 IJINFMDXMFHPIF-UHFFFAOYSA-N 392.484 5.060 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 120523354 ABLYSEIDZUAPGS-VIFPVBQESA-N 399.360 5.126 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 123096067 GJUBUAMPXDRZCL-DYVFJYSZSA-N 388.920 5.425 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)c(Cl)c2)nnc1-c1cnccn1 124065481 LHBSVLVLCKGNFW-NSHDSACASA-N 392.315 5.081 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C 124898261 KOXIIZJKJXMATN-MRXNPFEDSA-N 387.549 5.042 30 20 GKED COc1ccc(CCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 127904633 PNJSOQGYOXVWON-INIZCTEOSA-N 384.888 5.157 30 20 GKED CCSc1cc(Cl)ccc1C(=O)Nc1nc(C)c(SCC#N)s1 158895094 SHHHIGUXMUFNEW-UHFFFAOYSA-N 383.951 5.085 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(SC(=O)N(C)C)c1 176880976 XGKBZGOASNADSG-OAHLLOKOSA-N 385.558 5.467 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 181572451 JMNFKOTYYANMQF-YWZLYKJASA-N 379.504 5.953 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2csc(-c3ccc(F)c(F)c3)n2)n1 183380458 VBKNHCSNVJJWHK-LLVKDONJSA-N 389.452 5.158 30 20 GKED COc1cccc(NCc2nnc(S[C@@H](C)CCC#N)n2C2CCCCC2)c1 188266293 OVPQHQKCEWWDKY-INIZCTEOSA-N 399.564 5.188 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCN(C)C)Cc1cccs1 191420551 JVDSUTIVGJDWST-UHFFFAOYSA-N 385.577 5.196 30 20 GKED C=CCn1c(Sc2nc(C(F)(F)F)cs2)nnc1-c1ccccc1C 301765220 NGJZCRPCOFIQCD-UHFFFAOYSA-N 382.436 5.066 30 20 GKED OC(=Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)[C@H]1CCCCS1 329356064 ZEAPXQXODCFIRF-MRXNPFEDSA-N 390.940 5.199 30 20 GKED OC(=Nc1nc(C/C(O)=N/[C@H]2CCCCC23CCCC3)cs1)c1ccccc1 329618640 LZJNJKDEZHADQG-SFHVURJKSA-N 397.544 5.781 30 20 GKED OC(C[C@H]1CCOC1)=Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 329730700 DGJQPHWCYIKQMP-CYBMUJFWSA-N 381.501 5.185 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)N1CCOC2(CCCCCC2)C1 330337833 UMYKSNWHYMGIGM-UHFFFAOYSA-N 379.504 5.028 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc2c(c1)C(=O)CCCC2)c1ccccc1 421149384 FSRIZJSQWNGVFC-OAQYLSRUSA-N 375.472 5.152 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](C)c1ccccc1 428849157 HQUGZLDTZNUFAG-OALUTQOASA-N 395.572 5.491 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c(OC2CCCC2)c1 430582233 JXMDUMFXPBHBND-KRWDZBQOSA-N 398.528 5.261 30 20 GKED Cc1cc(C)c(NC(=O)CCCN[C@@H](CCCC#N)c2ccccc2)c(C)c1 433019611 OWNBPSIKWWIZCA-QFIPXVFZSA-N 377.532 5.355 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)NCC2CCC(C#N)CC2)cc1F 440935255 VDFUZOQUAUWZIC-UHFFFAOYSA-N 397.450 5.078 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1c(Br)sc(C)c1C 442717137 OUVWFVARWYKRBK-UHFFFAOYSA-N 392.322 5.073 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1cc(C)ccc1C 453462799 IPYKWGRISHAQCK-RTWAWAEBSA-N 380.536 5.054 30 20 GKED C[C@@H](c1cccc(C#N)c1)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 463050138 AWQGOJLIVJSSCL-MEDUHNTESA-N 375.325 5.171 30 20 GKED Cn1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc2cc(C(F)(F)F)ccc21 463415660 QRDIHWOZAVSEHX-UHFFFAOYSA-N 385.389 5.251 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(COC(C)(C)C)c1C 467955558 ABFNMTHAFSVSGZ-UHFFFAOYSA-N 380.532 5.920 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 475183074 MYJJZBVSTDDQDJ-UHFFFAOYSA-N 395.462 5.712 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(Cc2cccc(F)c2)CC1 475546020 KNAFABZCWGIMQW-UHFFFAOYSA-N 395.522 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CN1CCCC1)c1ccccc1 475578180 MUZZFIKCXPEYRW-HSZRJFAPSA-N 391.559 5.497 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)C[C@@H](CC#N)c3ccccc3)c(C)c2c1 475647713 MELZUMBAFZALNC-FUHWJXTLSA-N 376.456 5.015 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cc3sccc3[nH]2)cc1 477271655 IOTZJAIDOBMZME-UHFFFAOYSA-N 389.455 5.083 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 479068031 VRLHFIXAYQQRDD-UHFFFAOYSA-N 397.297 5.610 30 20 GKED Cc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1-c1ncco1 481891088 PFPBWCLCLFVPHU-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1S[C@H](C)CC#N 482526518 CABVYSWKAKBUQZ-PBHICJAKSA-N 388.920 5.530 30 20 GKED CCCOc1c(Cl)cc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1OC 483195346 KCJATVZONMBJSQ-QGZVFWFLSA-N 394.858 5.176 30 20 GKED C[C@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(Br)c1 487157414 PEODNLSXCLQSBN-KXBFYZLASA-N 385.305 5.104 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1oc2ccccc2c1CSCc1ccccc1 497426050 BRNFWZWUWVOAEO-UHFFFAOYSA-N 392.524 5.488 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Sc2ccccn2)cc1 499150690 JMXDXGJYRNEYSF-UHFFFAOYSA-N 387.508 5.157 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1c(F)cccc1F 502661077 HWIYGYUEIJGUBN-UHFFFAOYSA-N 399.210 5.087 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@@H](c1c(F)cccc1F)C(F)(F)F 504478481 WOETVAMRGPBTAT-ZDUSSCGKSA-N 398.253 5.409 30 20 GKED Cc1ccc2oc(SCC(=O)Nc3ccccc3SC[C@@H](C)C#N)nc2c1 504528772 YUCMKVXIFTYNFD-AWEZNQCLSA-N 397.525 5.119 30 20 GKED C=CCCc1ccccc1NC(=O)N(CCCO)[C@H]1CCCc2ccccc21 505017787 ZFCZNPDXRHXOIT-QHCPKHFHSA-N 378.516 5.099 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 505047038 BLQCHSWXPNIFRE-HTXNQAPBSA-N 381.479 5.145 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)s2)CC1 507830956 SOGJFJTZPVQYSZ-UHFFFAOYSA-N 394.418 5.080 30 20 GKED CC(C)CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 510046731 XIABPMRUJXQORF-HXUWFJFHSA-N 381.907 5.648 30 20 GKED Cc1cc(C)c(C#N)c(S[C@@H](C)C(=O)N[C@H](C)c2ccc3ccccc3c2)n1 514360302 GAXBNAVTPQDOHF-SJORKVTESA-N 389.524 5.081 30 20 GKED COc1cccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 515130452 SMANXSNVHIWHAT-NRFANRHFSA-N 390.870 5.185 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2Cl)c1 518372927 GHLJEJYXIMBLGQ-DLBZAZTESA-N 389.282 5.418 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCc2c(Cl)cccc21 518753710 YYJBPDDLQWUTBN-SUMWQHHRSA-N 385.920 5.543 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(-c2ccccc2)o1 520159879 KLMMLKKFCZMLED-UHFFFAOYSA-N 387.483 5.186 30 20 GKED Cc1ccc(NCc2ccccc2C#N)cc1Oc1ncccc1Br 521537382 LYTHYGOZHVVUAM-UHFFFAOYSA-N 394.272 5.429 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](C)c1ccc(C#N)cc1 523205069 KUZLKVBCCQKUBS-AWEZNQCLSA-N 390.314 5.546 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(Cl)cc2[nH]1)c1cccc(Cl)c1Cl 524572694 NXODGDYLZFOCBZ-HNNXBMFYSA-N 378.646 5.123 30 20 GKED CCN(C(=O)Cc1cccc(C#N)c1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 530914636 IVGFAROUNYZYMK-AREMUKBSSA-N 397.522 5.257 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](c2ccccc2)c2cccs2)c(Cl)c1 532844148 MEOYOKDOMMKYAI-FQEVSTJZSA-N 398.940 5.271 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3nccs3)n2)o1 533009691 RBLTVNPNGHYEAG-UHFFFAOYSA-N 381.404 5.289 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccccc1 533880110 PUMGPUPGVVVZNZ-JOCHJYFZSA-N 398.510 5.431 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)OCC 535138708 QXYNMLNHDHZENI-PZJWPPBQSA-N 382.891 5.305 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(OC3CCC3)cc2Cl)cc1 536133049 DFAKCJUXBXUPIT-UHFFFAOYSA-N 398.890 5.230 30 20 GKED C=C[C@H](CC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1)c1ccccc1 536246212 XYAHAEMXZJIPJP-LJQANCHMSA-N 394.584 5.196 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)c1 536767876 KXECAVJPZFKYQO-IBGZPJMESA-N 381.435 5.119 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5[nH]4)cc3)cc2)CC1 538493169 QVULPHCYKFKYDC-UHFFFAOYSA-N 378.435 5.037 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)ccc1Cl 539370408 ULGYRGXZILXBAI-UHFFFAOYSA-N 389.867 5.741 30 20 GKED Cc1c(C(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)sc2ccc(C#N)cc12 552651346 LLOYFIRTJXZVEV-OKILXGFUSA-N 380.435 5.275 30 20 GKED CCc1cccc2c1OCC[C@H]2NCc1cccc(OCc2ccccc2C#N)c1 553299386 WVOGVMVYAGIXDD-RUZDIDTESA-N 398.506 5.313 30 20 GKED C=CCC[C@H](NCc1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccco1 556866114 QGSLKTDOBGMYSD-NRFANRHFSA-N 378.447 5.468 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C4CCCC4)cc3)n2)cc1 568113943 XFABUOHIKVPZQH-OAQYLSRUSA-N 397.503 5.829 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN1CCCC[C@H]1c1ccccc1 571013605 WGOWCGZKSMHRCV-RXVVDRJESA-N 393.556 5.104 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(F)(F)[C@@H](C)C1 577106179 OMZRZKAVRXLAEL-HNNXBMFYSA-N 385.414 5.168 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CC(C)(C)[C@@H]1c1cccs1 580454030 PLKLDDLJNDNXMO-QRWLVFNGSA-N 399.585 5.164 30 20 GKED COc1cc([C@H](C)N[C@H]2CCc3ccc(C#N)cc32)ccc1OC1CCCC1 581518267 UFIZHJUAEPYFMW-AOMKIAJQSA-N 376.500 5.226 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccc(Sc2ccccn2)o1 582920755 WIEVDNUJUQUJOF-UHFFFAOYSA-N 382.533 5.182 30 20 GKED Cc1c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)sc2cc(F)ccc12 584374535 KAQXDPVWPIQBBK-UHFFFAOYSA-N 387.320 5.306 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 588343450 RQLHMWZGRPANPI-UHFFFAOYSA-N 377.419 5.579 30 20 GKED COc1ccc2c(c1)c(C(=O)Nc1ccccc1S[C@@H](C)CC#N)c(C)n2C 592593633 ZCAYQZNQUDRIEJ-AWEZNQCLSA-N 393.512 5.142 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(CCC(F)(F)F)CCC(F)(F)F 595088351 AVGGXLFGEPTNRI-INIZCTEOSA-N 378.360 5.579 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)C3(c4ccc(Cl)cc4)CC3)n2)cc1 602739203 KWQQPUGZASFRMH-UHFFFAOYSA-N 379.872 5.005 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)c1 603972442 NVKKXWQDHNIPHW-UHFFFAOYSA-N 399.372 5.188 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(-n2cccn2)c(Cl)c1 608945951 SDWPXXYLSMEJJP-UHFFFAOYSA-N 398.853 5.317 30 20 GKED C[C@H]1C[C@H](C)CN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 609079728 HHFQKULHYWDJTO-HOTGVXAUSA-N 397.906 5.300 30 20 GKED N#CCn1c(C(=O)Nc2nc3c(ccc4ccccc43)s2)cc2ccccc21 609215430 FVCKAAUSSLZDPV-UHFFFAOYSA-N 382.448 5.180 30 20 GKED CCN(C(=O)CCc1nc2cc(Cl)ccc2s1)[C@@H](C)c1ccc(C#N)cc1 609326642 CXBBUGNUIUBJMF-AWEZNQCLSA-N 397.931 5.364 30 20 GKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@H]1CCc2ccccc21 609434566 YLRQSSWKBYNZOZ-QHCPKHFHSA-N 383.451 5.502 30 20 GKED C[C@@H](Cc1ccccc1F)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609970554 QNFMKWXLJJVLNA-KRWDZBQOSA-N 388.442 5.094 30 20 GKED Fc1cccc2ncnc(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)c12 614305660 KKEYDHMXBVZFNS-IUCAKERBSA-N 381.295 5.090 30 20 GKED Cc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc(C)c1Br 617419187 PTWCETBVEQEZJF-UHFFFAOYSA-N 398.087 5.497 30 20 GKED CSC[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(C(F)(F)F)cc1 618805300 NKQWCNZZTIPBDO-RBUKOAKNSA-N 376.447 5.258 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)NCc1ccc(C#N)c(Cl)c1 619755788 STDFUKTUWQOWDD-CQSZACIVSA-N 381.932 5.418 30 20 GKED N#Cc1ccc(CN[C@@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)cc1Cl 669829206 IZCDRQDUZQYAAB-HSZRJFAPSA-N 399.881 5.407 30 20 GKED N#Cc1ccccc1NC(=S)N1CCC[C@@H]1c1ccccc1C(F)(F)F 727980473 MZBQDSZGVGIFNH-QGZVFWFLSA-N 375.419 5.111 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)cc1 728696422 QZNYQBPSAVNZPY-VPEZWSJASA-N 383.447 5.453 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)N(CCC#N)Cc1ccccn1 728871522 VZGIWGNOVNFSGX-YPKPFQOOSA-N 387.483 5.126 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 730982171 KAFKJPVERBGWAL-UHFFFAOYSA-N 382.432 5.557 30 20 GKED COc1ccc(OC)c(C(=O)/C=C/c2ccc(Oc3cccnc3)c(C)c2)c1 732713459 DYVSIGBVCFDZRN-RMKNXTFCSA-N 375.424 5.096 30 20 GKED C[C@@H]1CCC[C@@H](OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 733052914 UIIUDQLPRWZMOE-KBRIMQKVSA-N 388.920 5.235 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccncc1 734459052 FGTORYCOLQZBGF-JOCHJYFZSA-N 392.886 5.361 30 20 GKED Clc1ccc(NN=Cc2sc(N3CCCC3)nc2Cl)c(Cl)c1 735972942 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O=C(Nc1ccc(OC(F)F)cc1F)[C@H](F)c1ccc(C(F)(F)F)cc1 801709590 RKARPVXBGHTXEL-CYBMUJFWSA-N 381.247 5.095 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1coc2ccc(C(C)C)cc12 805844345 IJDBFKLLCLLHOP-SFHVURJKSA-N 384.435 5.551 30 20 GKED N#CCOc1ccc(CN[C@@H](Cc2ccccc2Cl)c2cccs2)cc1 813859044 FLPAGTDPQQXFPM-FQEVSTJZSA-N 382.916 5.377 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1sc(-c2ccc(F)cc2)nc1C 814801524 MHEGUWYNUVDEAG-UHFFFAOYSA-N 394.397 5.508 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3ccco3)CC2)cc1 854302547 LUTOTKKOXZMFSP-JOCHJYFZSA-N 385.467 5.347 30 20 GKED O=C(/C=C\c1csc(C(F)(F)F)c1)N(CCC(F)(F)F)CC(F)(F)F 861409295 ANHAUEJHHOPPFR-UPHRSURJSA-N 399.278 5.123 30 20 GKED N#CC1(CCCC[S@](=O)Cc2cc(-c3ccccc3Cl)on2)CCC1 899415886 SZKWAODGYPWDMB-VWLOTQADSA-N 376.909 5.108 30 20 GKED C=CCn1c(Sc2ccc(C(F)(F)F)c(Cl)n2)nnc1-c1ccccc1 913409066 SYNABDBDQOZQLD-UHFFFAOYSA-N 396.825 5.350 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043658 LYUKIFRPOFVTSU-OAHLLOKOSA-N 382.872 5.098 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cc(Cl)ccc1Sc1ccccc1 919978212 GSCDPDAMDRMOED-UHFFFAOYSA-N 394.883 5.646 30 20 GKED Cc1ccc2c(c1)C/C(=C/c1cccc(NC(=O)c3ccccc3Cl)c1)C2=O 921264489 UWXJFXFMKHKCDD-PDGQHHTCSA-N 387.866 5.723 30 20 GKED O=C(O)CCOc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cc1 1776126252 HGEXGMLCTYXWHD-OVCLIPMQSA-N 388.419 5.229 30 20 GKED Cc1cc(C)c(C(=O)O)cc1/C=C\C(=O)c1ccccc1OCc1ccccc1 1776126626 ROCAMYXBRIDKJZ-SEYXRHQNSA-N 386.447 5.477 30 20 GKED O=C(/C=C\c1cc(F)c(C(=O)O)cc1F)c1ccc(Oc2ccccc2)cc1 1776126717 VFVVOXGZHRRXDW-FLIBITNWSA-N 380.346 5.351 30 20 GKED CCCCCCCOc1cccc(CNC[C@@]2(C(=O)O)CC3CCC2CC3)c1 1776788653 GWQKWRMHDXQWOB-HQOBLLPJSA-N 387.564 5.407 30 20 GKED C[C@H](NC(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1)c1ccc(C#N)cc1 45407175 JFZXGPQSLAMJBH-IPELMVKDSA-N 387.508 5.095 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Nc1cccc(OCc2cccc(C#N)c2)c1 56153479 KANWZCBEOBPCRN-IBGZPJMESA-N 399.494 5.193 30 20 GKED CCc1ccsc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 60351454 RBRLXMWPRNRYLG-UHFFFAOYSA-N 378.453 5.235 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccc(F)cc1F 66801029 CECIHKVJWGDQQS-CQSZACIVSA-N 390.455 5.157 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1)C(C)C 66801902 KGZYLLCUBLFDMP-SFHVURJKSA-N 395.572 5.563 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)CCCOc1ccccc1 66954845 MZXWSVVNBGULNF-KRWDZBQOSA-N 383.517 5.014 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(Cc1ccco1)C1CCCC1 108359867 LGNCZPBJZJEKEN-KRWDZBQOSA-N 397.544 5.057 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1sc2cccc(F)c2c1COC 108426874 SVCQCMHZCLSRHC-UHFFFAOYSA-N 399.487 5.024 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 111781872 DWJNWTSADPNKTB-UHFFFAOYSA-N 379.504 5.200 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccccc2Br)o1)C1CCCCC1 115185751 NFTXJIYXLWTLIQ-CQSZACIVSA-N 378.295 5.064 30 20 GKED Cc1ccc(SC2(C(=O)Nc3ccc(F)cc3OCC#N)CCCC2)cc1 120158078 URQAQOZKBUIWEQ-UHFFFAOYSA-N 384.476 5.080 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(SC(=O)N(C)C)cc1 176880723 DXGUOMAYOPDVMT-OAHLLOKOSA-N 385.558 5.324 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1cc(F)c(F)c(F)c1 182338800 OUWVLFBVVPYGBV-LBPRGKRZSA-N 393.434 5.020 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2csc(-c3cccs3)n2)cc1 195120639 XKUUAOGHFFVDKT-UHFFFAOYSA-N 395.553 5.298 30 20 GKED CC(C)CCn1c(SCCC(=O)Nc2ccccc2C#N)nc2ccccc21 248292080 UNAWCJXUORFRPU-UHFFFAOYSA-N 392.528 5.075 30 20 GKED Cc1ncc(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 255679965 SITRRMNLEPANSL-XHPSBEMXSA-N 385.901 5.118 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@@H]1CCC[C@H](C)C1 303134608 CQYODKSKLFHLCW-OXJNMPFZSA-N 377.488 5.146 30 20 GKED N#CCCCOc1cccc(NC(=O)/C=C/c2cccc(OC3CCCC3)c2)c1 303227590 XCMFJZZEFDWAGT-BUHFOSPRSA-N 390.483 5.342 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 303236594 ZSISRPYKVNBRGV-MRXNPFEDSA-N 397.906 5.445 30 20 GKED CC1(C)C(O)=Nc2cc(/C(O)=N/[C@H]3CCCc4cn(C5CCCC5)nc43)ccc21 329053457 RXTWUUGZLSJPMY-SFHVURJKSA-N 392.503 5.260 30 20 GKED OC(C[C@H]1Oc2ccccc2N=C1O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 329193564 UFQNSZZVOQFGPS-LJQANCHMSA-N 394.427 5.146 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cccc(OCc3cscn3)c2)c1C#N 410932896 ZPXABOYQQICMMU-UHFFFAOYSA-N 397.525 5.205 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC[C@H]4CCC[C@H]43)cc2Cl)c1 429428817 JPLQSOMJEYQYEX-YLJYHZDGSA-N 395.890 5.197 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 431780576 GFISZBRXHVDEBO-DNVCBOLYSA-N 389.421 5.501 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCc2ccc(F)cc21 432081230 QZRXKVXMFKAQRT-KBXCAEBGSA-N 383.492 5.419 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1ncc(Br)s1 432551975 BHVCMFRDABAQGL-UHFFFAOYSA-N 388.315 5.132 30 20 GKED Cc1ccc(C#N)cc1NC(=O)C(C)(C)c1csc(-c2ccccc2F)n1 433245112 IHSUBLSPSJPXAY-UHFFFAOYSA-N 379.460 5.046 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 435353808 NPKOZXHXPXUCEA-UHFFFAOYSA-N 383.498 5.091 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)C2(Cc3ccccc3)CC2)cc1 437674456 LZKOHDMXUHHUQQ-UHFFFAOYSA-N 396.490 5.293 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(-c2ccnn2C)ccc1C 439376671 GDACNHXDMMLJFN-UHFFFAOYSA-N 388.515 5.891 30 20 GKED C=CCC[C@@H](NC(=O)Cc1ccc(C(C)=O)cc1)c1ccc(C(F)(F)F)cc1 441565740 MVYHPRVCESFIMX-HXUWFJFHSA-N 389.417 5.274 30 20 GKED C=CCC[C@H](NC(=O)Cc1c(C)noc1Cl)c1ccc(C(F)(F)F)cc1 441569277 IHQRDXPHQNMGCS-HNNXBMFYSA-N 386.801 5.021 30 20 GKED CC(C)[C@H]1C[C@@H](NCc2cn(CCC#N)nc2-c2ccccc2)c2ccccc21 447985152 DGIRCTFSXCMFCZ-DNQXCXABSA-N 384.527 5.438 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CNc1c(C)cccc1C 460960820 SVEMYPODBBRKGA-UHFFFAOYSA-N 385.467 5.326 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)N(C)[C@@H](C)CC#N)cc1 467256150 OECWLSCSOQHUEJ-KRWDZBQOSA-N 389.524 5.089 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1)c1ccccc1 469405856 LVXCVGLEIUYLNM-JOCHJYFZSA-N 395.453 5.199 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(C(=O)C(C)C)cc1 473764924 XTHPRIKOZGJOFA-UHFFFAOYSA-N 385.529 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H]1CCCN(c2ccccc2)C1 475568918 HGQSFNMQGKPRAL-JOCHJYFZSA-N 391.559 5.671 30 20 GKED Cc1c(NC(=O)c2ccccc2Oc2ccccc2C#N)cnn1-c1ccccc1 479183773 AKSXVMTYKFZLPP-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C=CCn1c(SCc2ccccc2OC(F)F)nnc1-c1cccs1 481394323 UUNJKELHJSDGNU-UHFFFAOYSA-N 379.457 5.086 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C 486239544 LIVXXXKWHOSFLA-INIZCTEOSA-N 382.529 5.054 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccccc1 487302935 WOVGPWGHDFPSKL-HBFSDRIKSA-N 386.417 5.360 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 487945661 KLOBNDJGSYHZTI-UHFFFAOYSA-N 399.450 5.227 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1ccc(Br)cc1 489140584 QQMVBPINKLELLZ-KBPBESRZSA-N 375.335 5.874 30 20 GKED CC(C)n1ncc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1-c1ccccc1 489883160 IMXIAQONBJCJAY-UHFFFAOYSA-N 398.388 5.274 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc3c(c2)oc2ccccc23)c1 502289259 KTTDAXZLNLWYSP-UHFFFAOYSA-N 385.423 5.913 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@H](C#N)c3cc(C)nc(C)n3)c3ccccc3n2)cc1 505313857 WHKDTYGDBHJLPO-OAQYLSRUSA-N 392.462 5.107 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508047259 ABNATZOBZDRCAW-UWJYYQICSA-N 395.572 5.686 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)CC1 508479802 XQMYCQODUDGBJI-MRXNPFEDSA-N 381.442 5.128 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCc3sccc3C2)cc1 516846006 WIQJMARYZVJXMJ-UHFFFAOYSA-N 390.533 5.111 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1Cl 517473262 MAHGJFPCRYPTQS-HUUCEWRRSA-N 387.936 5.817 30 20 GKED CCOc1ccc(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 517962147 FUIARBLDUWAZDK-UHFFFAOYSA-N 387.439 5.071 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccs1 518681982 OBKQQYQGYVMKNC-NVXWUHKLSA-N 387.574 5.909 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 518683212 MQLUDPAQBVLPDK-INIZCTEOSA-N 383.517 5.049 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(F)c(F)cc3F)cc2)cc1 521361911 RCONJZCKHQBQOP-UHFFFAOYSA-N 382.341 5.215 30 20 GKED N#CCCCCNC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 521596048 WLHIXEGGJSZWIA-GOSISDBHSA-N 393.339 5.637 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H](c3cccs3)C3CC3)cc2)c1 521808494 HSYDEHNQVIGAEX-NRFANRHFSA-N 389.480 5.685 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1C1CC1 534967368 OFSWBSIVQDQQGT-HUUCEWRRSA-N 397.548 5.627 30 20 GKED C=CCC[C@H](NC(=O)c1cnn(C(C)C)c1C)c1ccc(C(F)(F)F)cc1 538866485 QDMRKQQTMMFOSL-SFHVURJKSA-N 379.426 5.229 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)s2)c2ccccc2Cl)c(C)c1 539513227 QVMGDPJUJLZEKZ-NRFANRHFSA-N 382.916 5.469 30 20 GKED CN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 540759552 XCJXVQQGXABHBX-QGZVFWFLSA-N 392.808 5.271 30 20 GKED CCC[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(F)cc1F 542410281 IMNBXIJGAJEVAZ-OAQYLSRUSA-N 383.442 5.052 30 20 GKED N#CCCC[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1 552313018 HQRDJRWJLWFHOT-OAQYLSRUSA-N 375.428 5.380 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 554262178 AFBZCFSUGAWQPB-KRWDZBQOSA-N 391.393 5.201 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1ccc(C#N)c(F)c1 558500457 QVJTVFGVVFQRBV-CQSZACIVSA-N 394.475 5.354 30 20 GKED CCC(CC)N(CC)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 572917702 WTUDMKAWTYKRPR-UHFFFAOYSA-N 379.504 5.374 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2oc3ccccc3c2CSc2cccs2)C1 597910867 BSJQYLMQNNWZSE-HNNXBMFYSA-N 396.537 5.552 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1Cl)c1ccccc1 599970645 VNBGCNVKSGFECD-QGZVFWFLSA-N 380.797 5.524 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC2(CCSCC2)CC1 602840174 JTXUSAOKMNFDLI-MRXNPFEDSA-N 389.590 5.079 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)cc1 604083773 XYOUWRVAJMGCJV-LJQANCHMSA-N 398.304 5.178 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2cccs2)c1 608916679 NEJHWSMYEBEHRZ-UHFFFAOYSA-N 375.497 5.729 30 20 GKED Cc1ccccc1N(C(=O)c1ccc(OCc2ccccc2C#N)cc1)C(C)C 609227959 HYKILFSOKSADHG-UHFFFAOYSA-N 384.479 5.501 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1c(Cl)cccc1Cl 609580184 DTEASGBNGGKYHB-LBPRGKRZSA-N 379.312 5.741 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)c1 610324620 KVQLJAQXCFDVKI-GOSISDBHSA-N 385.467 5.328 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(Cn2cnc3ccccc32)c1 611391952 CHIRXRIFDAQCQW-DEOSSOPVSA-N 392.506 5.123 30 20 GKED N#C[C@H](C(=O)c1cc(Br)c2ccccc2c1)c1nc2ccccc2o1 645955836 LKGVSOBIAJECQK-OAHLLOKOSA-N 391.224 5.234 30 20 GKED CC[C@H](C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)cc1 680851057 LIWADBTWILFQJI-HUBLWGQQSA-N 399.350 5.345 30 20 GKED O=C(CCC(F)F)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 684446694 LSZRNOAWPWGFBA-UHFFFAOYSA-N 381.288 5.344 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](Oc2cccc(C(C)C)c2)c2ccccc2)n1 730684981 DUMXGGRTQONMAK-IFMALSPDSA-N 390.508 5.572 30 20 GKED N#CCOc1ccc(COC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)cc1 733379222 BAQSWYZSUPXNJZ-XSFVSMFZSA-N 393.439 5.074 30 20 GKED O=C(/C=C\c1cc(Cl)c2c(c1)OCCO2)c1cccc(-c2ccncc2)c1 741473142 MIZDWBODJXLCNP-PLNGDYQASA-N 377.827 5.069 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)C(=O)Nc3ccc(Cl)cc3)o2)cc1 744025409 LCRAYQJFOYKDOF-SFHVURJKSA-N 392.842 5.124 30 20 GKED Cc1ccc2c(CCC(=O)NCc3cccc(-c4ccc(C#N)s4)c3)c[nH]c2c1 744589532 RIRPIAGEUBXLFY-UHFFFAOYSA-N 399.519 5.326 30 20 GKED CCN(C(=S)Nc1ccccc1C#N)[C@@H](C)c1cccc(C(F)(F)F)c1 745689193 VPVJFBOKMXVWEC-ZDUSSCGKSA-N 377.435 5.357 30 20 GKED Cc1c(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccccc2)oc2ccccc12 747140408 RZPBUWRBSSJODH-SEYXRHQNSA-N 381.435 5.415 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C\c2cccc(OC3CCCC3)c2)n1 747197349 YDFIKQMCVMFYBX-GDWUOILNSA-N 380.513 5.478 30 20 GKED O=C(Nc1cccc(/C=C2/Oc3ccc(F)cc3C2=O)c1)c1ccccc1Cl 749746686 OXXJZJOVWYVALI-RGVLZGJSSA-N 393.801 5.348 30 20 GKED N#C[C@@H](C(=O)CC(Cc1ccccc1)Cc1ccccc1)c1nc2ccccc2o1 753400890 XFQKWOMLSUDAJG-QFIPXVFZSA-N 394.474 5.496 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl)OCC 755586188 ZVDLJVBEAVWKGM-UKRRQHHQSA-N 388.360 5.282 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(F)cc1F)c1nc2cc(C(F)(F)F)ccc2s1 756244530 UWIXETQWKCYEFO-LBPRGKRZSA-N 396.340 5.012 30 20 GKED Cc1cccnc1/C=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 758951421 DTWKIEUKZBWNEO-SGWGQVFISA-N 387.870 5.351 30 20 GKED N#Cc1ccc([C@@H](O)Cn2c(-c3c(F)cccc3Cl)nc3ccccc32)cc1 763242187 SRPCAQLFZLFEDZ-FQEVSTJZSA-N 391.833 5.101 30 20 GKED N#C[C@H](C(=O)CCc1cncc2ccccc12)c1nc(-c2ccccc2)cs1 765591753 ZTESSORRJMMZHB-HXUWFJFHSA-N 383.476 5.167 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(CC(C)C)cc2)ccc1OC 772979012 JZJUQRPBBNKMOK-AVRDEDQJSA-N 380.532 5.425 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1 777838005 KNYCKNCPYDUVEX-UHFFFAOYSA-N 398.528 5.242 30 20 GKED N#Cc1ccc(C(=O)Nc2c(O)c(Cl)cc(Cl)c2Cl)cc1Cl 779048685 IKNRNZBIPOZPNF-UHFFFAOYSA-N 376.026 5.130 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 786308421 QGEVKJCSBGGSAH-BZUAXINKSA-N 394.883 5.006 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1ccc(Cl)nc1C(F)(F)F 786733573 CUEWHIZQTQVVHU-UHFFFAOYSA-N 382.691 5.323 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792093289 WIJSWRZWBMMGKD-IBGZPJMESA-N 396.412 5.699 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@H](C#N)c2nccc3ccccc23)C1 792102796 JLXCBSJTAGEYRU-CBQOVEMMSA-N 378.516 5.567 30 20 GKED C[C@@H](CC#N)OC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 797014683 CKRHACUQOAHYET-JTQLQIEISA-N 383.300 5.240 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C#N 799603882 OCKZKSUVEJDRLO-KRWDZBQOSA-N 377.856 5.134 30 20 GKED C=CCCc1ccccc1NC(=O)c1cc(NC(=O)OC)cc(C(F)(F)F)c1 800153809 BAHSBAMDXCAOBV-UHFFFAOYSA-N 392.377 5.255 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 806635643 UFROLTFQHNVRRB-SFHVURJKSA-N 392.503 5.310 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NS(=O)(=O)c2ccc(C(F)F)cc2)cc1 808076100 MWHWBZUXWAVQJC-FQEVSTJZSA-N 398.434 5.080 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 808817471 GYKCUDFMWDZQFY-XHDPSFHLSA-N 381.785 5.068 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@H]1c1ccccc1)c1nc2ccccc2n1C(F)F 835072033 ADWLTRBBVHWLAX-YESZJQIVSA-N 379.410 5.192 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](CCCCC#N)NC(=O)OC(C)(C)C 846765425 PPCRZOCRJHJFKZ-GOSISDBHSA-N 387.524 5.034 30 20 GKED C=CC(C)(C)CC(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 884651905 CTHZOPAAIYKKFX-UHFFFAOYSA-N 386.517 5.090 30 20 GKED C=C[C@H](CC)CC(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 909529592 MIXKPKASOGTMOE-QGZVFWFLSA-N 386.517 5.090 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915861618 DFWFTNXFFGWKFG-QHCPKHFHSA-N 397.503 5.086 30 20 GKED C[C@H]1CCCC[C@H]1NC(=S)Nc1cccc(COc2ccc(CC#N)cc2)c1 916026314 XERBEZQJVLJOOV-HTAPYJJXSA-N 393.556 5.197 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cn1nc(-c2ccco2)n(CC)c1=S 916567717 VNXGDFVNXCRHQF-UHFFFAOYSA-N 394.953 5.055 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cn(CC(C)C)c2ccccc12 920101805 JIHRBPYLIBFSGT-LJQANCHMSA-N 397.478 5.292 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(F)c(C(F)(F)F)c1 1776354292 BBEUENVOZFCYKQ-QPJJXVBHSA-N 396.336 5.226 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)cc3)o2)c1)C(=O)O 1776470991 XBIGJKILRYVHGQ-FPAJZGIOSA-N 396.826 5.348 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776697938 YNIZWLFFSPCPCM-LMRWQKIVSA-N 390.435 5.760 30 20 GKED O=C(/C=C\c1ccc2ccccc2c1F)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569981 VMKSWULRIYBJJE-QXMHVHEDSA-N 386.378 5.833 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)CC(C)(C)C)cc2)CCC1 1787658368 PKFCMJMTIBKBME-FQEVSTJZSA-N 382.548 5.325 30 20 GKED C=CCN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](CCCC)C(=O)O 1857791340 UFMYLDKMSCYLMV-QFIPXVFZSA-N 393.483 5.067 30 20 GKED N#Cc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 7265404 DCEWFGAXTFNGTL-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1ccc(-c2csc3ncnc(N/N=C4\C(O)=Nc5c(C)cccc54)c23)cc1 7861994 HILINCUPLSIDKR-UHFFFAOYSA-N 399.479 5.393 30 20 GKED N#Cc1ccc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)cc1Cl 8331397 WYRLHTFCCQGKEM-UHFFFAOYSA-N 388.279 5.170 30 20 GKED C=CCN(Cc1csc(-c2ccc(OC)cc2OC)n1)Cc1cccs1 60942823 MIPYJLYUHLWWHW-UHFFFAOYSA-N 386.542 5.077 30 20 GKED Cc1cc(C)c(C#N)c(SCc2nnc(-c3ccc(Cl)cc3Cl)o2)n1 63414630 FVKNVGXGXLYGNV-UHFFFAOYSA-N 391.283 5.219 30 20 GKED N#C[C@H](C(=O)[C@@H](Oc1cc(Cl)ccc1Cl)c1ccccc1)c1ccccn1 106983640 ZHFUOWCDRGMTRL-KKSFZXQISA-N 397.261 5.385 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(OC2CCCC2)CC1 109029658 IHXUYYSSKWIQEI-MRXNPFEDSA-N 387.549 5.036 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 113539892 ZEARTBOPAAXHMX-UHFFFAOYSA-N 398.510 5.426 30 20 GKED C[C@@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccc(C#N)cc1 154331104 UWXULYZVKXNHBT-AUUYWEPGSA-N 377.488 5.549 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccccc1 160674635 JAGLUJQWFIGVRD-QFIPXVFZSA-N 391.515 5.282 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN([C@@H](C)c2ccsc2)CC1 191465611 WPMSMMCFUWRXLB-SFHVURJKSA-N 397.588 5.511 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 192216493 UFTCOAGVQPRHLC-CZUORRHYSA-N 399.482 5.381 30 20 GKED CCO[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 194485181 CRSVEYBYWFRYBV-YLJYHZDGSA-N 396.899 5.418 30 20 GKED COc1c(C)ccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c1C 195619707 ZOQZEVOWTMQCAV-UHFFFAOYSA-N 386.451 5.015 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)nc2onc(C(C)C)c12 195690912 UBAQTHJNUISVOL-UHFFFAOYSA-N 389.908 5.198 30 20 GKED C[C@@H]1CCCCN1Cc1ccccc1CNCc1cccc(OCCCC#N)c1 237345819 BFNUMPYTUICRIO-OAQYLSRUSA-N 391.559 5.033 30 20 GKED CCN(C(=O)CCOc1ccccc1-c1ccccc1)[C@H](C)c1ccc(C#N)cc1 302935853 IADZRRDCHMPTKT-HXUWFJFHSA-N 398.506 5.604 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C[C@H]3CCOc4ccccc43)cc2)cc1 303731693 ZKMWRSAOEFBCGO-GOSISDBHSA-N 384.435 5.245 30 20 GKED Cc1cc(Br)cc2cc(/C(O)=N/[C@H]3CCCC34CCOCC4)oc12 328641611 FQYBZDLDTFPYIV-INIZCTEOSA-N 392.293 5.158 30 20 GKED OC(=Nc1cccc(N2CCCC2)c1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329478979 QICKQWIIKDVMOC-IBGZPJMESA-N 392.547 5.382 30 20 GKED O/C(CC/N=C(/O)C12CC3CC(CC(C3)C1)C2)=N/[C@@H]1C[C@H]1c1ccc(F)cc1 329875980 HHKUKMDTXUKQRK-ZJJNMPENSA-N 384.495 5.201 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c(Cl)c1 426130348 VWVAKVAQKLBUGM-MRXNPFEDSA-N 382.876 5.190 30 20 GKED Cc1cnccc1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 429351942 GUKSEFRNKNVQOY-UHFFFAOYSA-N 392.846 5.029 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc1NC(=O)CC(C)C 430587099 YGRSRSWMMWCRSN-INIZCTEOSA-N 397.544 5.224 30 20 GKED CN(Cc1ccccc1NC(=O)[C@@H](C#N)CCc1ccccc1)C1CCCCC1 433234737 TVYWLLLWFZAWJY-OAQYLSRUSA-N 389.543 5.162 30 20 GKED N#CCSc1cccc(C(=O)N2CCCCC[C@H]2/C=C/c2ccccc2)c1 440873479 SXLJUYYITCXKEB-ARKBFRDHSA-N 376.525 5.400 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)cc2)cs1 442557304 XZLYNSADHUBZJT-OAHLLOKOSA-N 381.526 5.363 30 20 GKED N#C[C@H](C(=O)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1)c1ccccn1 442656982 SMHMVKBYSXOBBI-INIZCTEOSA-N 385.225 5.685 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cn(CCCC#N)c2ccccc12 443975600 AHTZTLZEOTYOAU-UHFFFAOYSA-N 387.527 6.444 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(F)c1 445632411 QOCCKUXHQUCMMK-UHFFFAOYSA-N 394.221 5.126 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3nc(/C=C\c4ccccc4)cs3)on2)c1 447511785 VNWXVXDKEMPQPD-KTKRTIGZSA-N 398.447 5.092 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N[C@H]3CC[C@@H](CC#N)C3)c(C)c2)n1 454674164 RHNVRBNDOPZRQT-GJZGRUSLSA-N 386.546 5.115 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccccc1 455302569 MNGGZDASMOFHBL-QZTJIDSGSA-N 393.384 5.005 30 20 GKED N#Cc1ccc(CSc2nnc(NC(=O)CCCC3CCCC3)s2)cc1 463172637 SULKCJVPRUORRS-UHFFFAOYSA-N 386.546 5.001 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)cs2)cc1 464412242 TYJYYUZUMUBLHJ-CQSZACIVSA-N 387.386 5.022 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 466392578 NQKPIAVGXWDKHZ-IAGOWNOFSA-N 399.560 5.062 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)o2)c(C)c1 474429128 CIIQMCILESHAMM-QGZVFWFLSA-N 394.496 5.545 30 20 GKED N#CCSc1ccccc1NC(=O)CSCc1ccc(C(F)(F)F)cc1 475898398 PKHCPBAAHZYHCO-UHFFFAOYSA-N 396.459 5.193 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccccc1CCC(F)(F)F 476124896 ZBKLYIFMPUPSNT-UHFFFAOYSA-N 375.434 6.286 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccc(C(=O)N2CCCCC2)c(Cl)c1 478394671 XTYZCAXOZLYMHW-UHFFFAOYSA-N 388.298 5.103 30 20 GKED CCC(CC)[C@@H]1C[C@H](NC(=O)c2ccccc2Oc2ccccc2C#N)CCO1 479790740 UAMRSYGIMXWSTD-XXBNENTESA-N 392.499 5.064 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1cccc(C)c1)C(F)(F)F 482029205 BTXGNVRXRLSYRZ-IBGZPJMESA-N 389.421 5.092 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 485464774 KHYANMYMUURSAT-UHFFFAOYSA-N 399.943 5.353 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)[C@@H](OC)c1ccc(Cl)cc1 486236260 XFKHTQFACIZFPH-AUUYWEPGSA-N 375.921 5.124 30 20 GKED CCN(Cc1cccc(NCc2ccc(-c3ccccc3C#N)cc2)c1)C(C)=O 486414801 FRBWJMFXTACOPH-UHFFFAOYSA-N 383.495 5.206 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)[C@@H]3CCCC(F)(F)C3)c2)cc1 500871695 BRXXHDSMSWGFRM-GOSISDBHSA-N 384.426 5.096 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 503153568 SFNZMKFFEVYKBQ-BJKOFHAPSA-N 392.458 5.641 30 20 GKED CN(Cc1ccccc1NC(=O)c1cc(C#N)ccc1Cl)C1CCCCC1 505108348 KQAJNYCVNHUDEC-UHFFFAOYSA-N 381.907 5.228 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 505683483 JUOWKMVGHPQWEN-MRXNPFEDSA-N 381.476 5.015 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2cccnc2)cc1)c1ccc(Cl)c(Cl)c1 505934225 VYYIOLXYOFRPKS-IBGZPJMESA-N 398.249 5.175 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1ccc(C#N)c(Cl)c1 506581563 YZCSOZWAMMAKRY-CYBMUJFWSA-N 396.903 5.526 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)c1C#N 510836466 LLIRVYNYVNRPGE-UHFFFAOYSA-N 397.887 5.584 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2oc3ccccc3c2C)cc1 512544638 IYAOUDJUKCECLE-UHFFFAOYSA-N 398.418 5.666 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518751175 ISKSHGLADSOTJO-UHFFFAOYSA-N 391.496 5.855 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 520056340 RNVWGICFTZNYJD-SFHVURJKSA-N 390.911 5.414 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1cccc(CSC2CCCC2)c1 524869018 VUQZCLRGFOZEAW-MRXNPFEDSA-N 380.513 5.140 30 20 GKED N#CCc1ccnc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)c1 532434657 PRPYYVUAVCTKAE-UHFFFAOYSA-N 387.405 5.007 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(F)cc3C(F)(F)F)n2)cc1 532874165 MLUQSDVMUNCSLB-UHFFFAOYSA-N 391.349 5.092 30 20 GKED CCN(C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)[C@H](C)c1ccc(C#N)cc1 533919458 FFGRLLDJWYLIGN-GOSISDBHSA-N 397.478 5.034 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)cc1 536188714 OCFMHWBJTFETJP-UHFFFAOYSA-N 387.439 5.421 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 540821534 JRAYTXSLCDXTJZ-RBUKOAKNSA-N 387.405 5.229 30 20 GKED N#CCc1ccc(C[S@@](=O)Cc2ccc(Oc3ccccc3)c(F)c2)cc1 542189362 KIRQNQIBOVDMHQ-HHHXNRCGSA-N 379.456 5.133 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543863115 JFPACYGHQOXOAJ-WOJBJXKFSA-N 397.522 5.520 30 20 GKED CN(C(=O)c1ccc(F)c(C#N)c1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 551610167 OAUMYHIHZFIPHR-HKUYNNGSSA-N 390.380 5.124 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1)c1ccccc1 554024663 GNDMSWAVULXWBD-YADHBBJMSA-N 397.469 5.303 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 554750576 OFDNTSRVRGHJCS-UHFFFAOYSA-N 386.329 5.164 30 20 GKED C=CCn1c(SCc2ccc(C(F)(F)F)cn2)nnc1-c1ccccc1C 556336989 HCRJUFFRVMUKFC-UHFFFAOYSA-N 390.434 5.146 30 20 GKED N#CCCCn1cc(-c2nc(CSCc3ccccc3)no2)c2ccccc21 558350897 ILYVIGURUUELLT-UHFFFAOYSA-N 388.496 5.428 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 562228532 CHTDATNMKKEZPD-OAQYLSRUSA-N 375.403 5.017 30 20 GKED CCSc1ccc(-c2nn(-c3ccccc3)cc2CNCC2(C#N)CC2)cc1 562391572 ZLAVZRXDVOYGQY-UHFFFAOYSA-N 388.540 5.045 30 20 GKED N#CCCCn1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c2ccccc21 581231186 WWCDTNFVYJIDKT-INIZCTEOSA-N 384.464 5.045 30 20 GKED CCN(C(=O)CCCCCC#N)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 588647537 CQAUTHUBOBUZDO-IBGZPJMESA-N 378.516 5.746 30 20 GKED N#Cc1cccc(-c2nnc(CN(CC3CC3)c3cccc(C(F)(F)F)c3)o2)c1 589290886 IVKMIPLUTXFTGN-UHFFFAOYSA-N 398.388 5.044 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)c1ccccc1 602107863 IZCFOTYFKPKTPZ-KRWDZBQOSA-N 384.435 5.198 30 20 GKED Cc1ccc(-c2noc([C@H](C)Nc3cccc(OCCCC#N)c3)n2)cc1F 604044325 IIQNVFYNTQTTBY-HNNXBMFYSA-N 380.423 5.040 30 20 GKED N#CCn1c(C(=O)N(Cc2ccc(F)cc2)C2CCCCC2)cc2ccccc21 609215610 GMPCCLCLVQKQLA-UHFFFAOYSA-N 389.474 5.279 30 20 GKED CN(C(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(C#N)cc1F 609217454 GIAWYUUTZRIULY-UHFFFAOYSA-N 376.456 5.266 30 20 GKED COc1ccccc1CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434214 DVJMXXSSAKIUOJ-UHFFFAOYSA-N 387.439 5.023 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)ccc1C(C)(C)C 619804085 ZIWPIFYJLLQWIZ-UHFFFAOYSA-N 381.907 5.729 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C[C@H]1CCCO1)C(F)(F)F 654046944 HCFZMBFQNBIMKA-WBVHZDCISA-N 384.442 5.160 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccccc2OC)n1 661116274 ICXZFHNMBOOSMH-IEBWSBKVSA-N 399.560 5.061 30 20 GKED CCCCn1nc(C)c(C=NNc2ccc(OCC(F)(F)F)cc2)c1Cl 727262703 VDLKMCHPYXHXLT-UHFFFAOYSA-N 388.821 5.032 30 20 GKED CCn1nc(C)c(/C=C/C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1C 727975873 XGNFFPGXSMZQQS-AATRIKPKSA-N 390.327 5.454 30 20 GKED C=CCc1cc(CNCc2cccc(OC3CCCC3)c2)cc(OC)c1OC 729683513 VNPUGJHAEJXGKI-UHFFFAOYSA-N 381.516 5.044 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3cc(C)cc(C)c3)cs2)cc1 730435769 BFSMDJOUDAAHFL-WTKPLQERSA-N 379.481 5.244 30 20 GKED O=C1/C(=C/c2cccnc2)CCc2nc(-c3ccccc3Br)sc21 730436015 JNZNZTCQCHDRMW-JLHYYAGUSA-N 397.297 5.180 30 20 GKED N#C[C@@H](NC(=O)Cc1c(Cl)cccc1Cl)c1cccc(Cl)c1Cl 731195699 MJYKYVHYLQQSEU-CQSZACIVSA-N 388.081 5.224 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1csc2ccccc12 731400050 KQYRQHIMPGWCCW-CABCVRRESA-N 395.553 6.178 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(OC3CCCC3)cc2)c1 733843010 INLPXUMIFRHONT-IBGZPJMESA-N 393.487 5.011 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(Oc3cccc(Cl)c3)cc2)c1 749793227 GWJWKLNICKCWTF-UHFFFAOYSA-N 378.815 5.287 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)C2)c1 752485944 UPDSELPAOMHSSH-ILBGXUMGSA-N 395.506 5.672 30 20 GKED Cc1cnc([C@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 755755233 CTBJLKIEAJMHII-FOIQADDNSA-N 390.512 5.032 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(F)c1O 756380404 UGHJUFKVNHOJES-DJLDLDEBSA-N 391.302 5.231 30 20 GKED CC(CC1CCOCC1)=NNc1ccc(Br)cc1C(F)(F)F 757574878 MSGQENVRNYYQHW-UHFFFAOYSA-N 379.220 5.072 30 20 GKED N#Cc1cc(NC(=O)C2(c3cccs3)CCCCC2)c(Cl)c([N+](=O)[O-])c1 764301125 CWECDHCTKUWGGW-UHFFFAOYSA-N 389.864 5.022 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 764755682 HTFVXJQEWFMPAX-OALUTQOASA-N 378.472 5.628 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(F)c(SC)c2)cc1 766623444 QXZWXSWTELVXHU-DYVFJYSZSA-N 384.476 5.022 30 20 GKED C[C@H]1C(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C[C@@H]1c1ccccc1 767783094 TZHNNJKYCOLIOO-CJNGLKHVSA-N 397.404 5.149 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](F)c1ccccc1 769375907 LSPKGJRYBYWZAN-INIZCTEOSA-N 382.382 5.360 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cnccc1C 771549663 ICGYCLSLFCMMPM-UHFFFAOYSA-N 377.448 5.037 30 20 GKED O=C(/C=C/c1nc2ccc(Br)cc2s1)c1ccc(F)cc1F 773125348 OCCSIXLKPQGZGH-AATRIKPKSA-N 380.213 5.233 30 20 GKED CCCCCOc1ccc(C=NOCc2nc(C)c3ccccc3n2)cc1OC 774790938 MGHVQJXFNPOHJO-UHFFFAOYSA-N 393.487 5.067 30 20 GKED C[C@H](N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccc(OCC#N)cc1 776164794 UMWQRNWGTJVEIH-QMHKHESXSA-N 394.877 5.822 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 776813749 KQNAIPRYXOFEDX-HSZRJFAPSA-N 377.447 5.150 30 20 GKED CC(C)(C#N)CCCOC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 783265353 XHTMIJWWRRGDAH-UHFFFAOYSA-N 383.300 5.604 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)c1ccccc1SC(C)(C)C 788441370 RIFUAOOLIKSXBU-UHFFFAOYSA-N 383.546 5.327 30 20 GKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc(Br)cc1F 789143681 QFLGUZBQLIXMJT-XQRVVYSFSA-N 378.222 5.201 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797568847 WZABGZJBFWMVHE-PINLSGDHSA-N 392.446 5.739 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1 800154185 KZKHVIVNSYFVCB-UHFFFAOYSA-N 380.488 5.333 30 20 GKED N#Cc1sc(N[C@H](Cc2ccc(Cl)cc2)c2ccccn2)nc1Cl 804586846 CJUBJSFZDPEXSQ-CQSZACIVSA-N 375.284 5.112 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)/C=C/c3ccc(Cl)s3)cc2)ccn1 810821576 HGLXBAGTMYAFFL-SOFGYWHQSA-N 381.844 5.112 30 20 GKED C(=NNc1nc(-c2ccccc2)cs1)c1ccccc1OCc1ccccn1 819841502 ZBNXPBQBWINLQG-UHFFFAOYSA-N 386.480 5.230 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C1CC2(C1)CC2(F)F 826877218 DJKKQCUJZBCUKT-UHFFFAOYSA-N 390.377 5.085 30 20 GKED N#Cc1c(NC(=O)c2c(Cl)cccc2C(F)(F)F)sc2c1CCCC2 887632643 WPTPUPBDOKMSOL-UHFFFAOYSA-N 384.810 5.423 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915353550 VCYYSSKFWSYREV-QHCPKHFHSA-N 385.467 5.015 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(Cl)cc2)cc(Br)c1O 916135209 JQBSGFIVYGLWMC-BAQGIRSFSA-N 381.653 5.103 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)n1Cc1ccccc1 916846486 WSHICHXJRMAHQV-IBGZPJMESA-N 385.492 5.253 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 916849168 SQEHGHSCNJWUDY-QFIPXVFZSA-N 398.506 5.807 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 918548225 QBJHYTHMTDVXRR-HRAATJIYSA-N 375.497 5.156 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNc1cccc(F)c1 920383311 DDODFFYTBFHKQX-UHFFFAOYSA-N 377.250 5.132 30 20 GKED N#CC1(CCN(Cc2ccccc2F)c2ccc3nc(O)[nH]c3c2)CCCCC1 1307536599 YHLCDHXVRHBNQW-UHFFFAOYSA-N 392.478 5.278 30 20 GKED C=CCOc1cccc(CN[C@@H](CC(=O)O)c2ccc(-c3ccccc3)cc2)c1 1776185205 OMRXDBKLJSSLFI-DEOSSOPVSA-N 387.479 5.224 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C)c2nc(C(=O)O)c(C)s2)cc1 1776787840 ALDLSNDXFXPXEP-OAHLLOKOSA-N 390.549 5.350 30 20 GKED COc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1C(C)(C)C 1777359880 AXRPPQGMTFHACO-ATVHPVEESA-N 378.468 5.294 30 20 GKED O=C(O)c1cc(Br)cc(/C=C2\CCc3ccc(Cl)cc3C2=O)c1 1777663775 SMWAAIKQAIJQFT-LFYBBSHMSA-N 391.648 5.013 30 20 GKED C=CCn1c(SCc2csc(-c3cccs3)n2)nnc1-c1ccncc1 18779589 QBIXCYKJWQPTBB-UHFFFAOYSA-N 397.554 5.003 30 20 GKED N#CCCN(C(=O)CSCc1ccc(Cl)cc1)c1cccc(Cl)c1 22353950 FDRHCNMYNCOHSK-UHFFFAOYSA-N 379.312 5.173 30 20 GKED C=CCNC(=O)c1ccccc1NCc1cc2ccc(SC)cc2nc1Cl 25721869 JQPOPDMFZZGOJB-UHFFFAOYSA-N 397.931 5.138 30 20 GKED COc1ccc(C(=O)/C=C\c2csc(N(C(C)=O)c3ccc(C)cc3)n2)cc1 54895647 SOXKIHHWBHPWSP-JYRVWZFOSA-N 392.480 5.041 30 20 GKED COCc1c(C(=O)Nc2cccc(OCCCC#N)c2)sc2cccc(F)c12 55569466 LHKXEANFNIVXEG-UHFFFAOYSA-N 398.459 5.122 30 20 GKED CCCN(CCC(=O)Nc1sccc1C#N)[C@@H](C)c1cc2ccccc2o1 64941037 PKINEVSKNGNGSO-HNNXBMFYSA-N 381.501 5.168 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2cccnc2)cc1 66801577 KFHRJBFFCHAKBM-MRXNPFEDSA-N 389.480 5.520 30 20 GKED CC(C)COC1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 66953471 KFSFRPFESSXPIS-UHFFFAOYSA-N 393.487 5.019 30 20 GKED CCN(CCC(=O)Nc1c(Cl)cccc1Cl)[C@H](C)c1ccc(C#N)cc1 103468810 CQTBKBNADVAHQK-CQSZACIVSA-N 390.314 5.277 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc(Cl)c2)cc1 108013610 FOFDQIBFEIFTNV-UHFFFAOYSA-N 378.834 5.193 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)COC3)cc1Cl 146911094 XTDPUBJDKCLSOV-NRFANRHFSA-N 388.854 5.278 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(CN(C(C)=O)C2CC2)cc1)c1ccccc1 155813299 WMMYNQQPZVYXPB-HSZRJFAPSA-N 391.515 5.027 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4ccccc4C)CC3)n2)cc1 170733521 SJUIQNMQCBCJIQ-GOSISDBHSA-N 388.492 5.035 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 174000857 NQUARCKKDQYMKP-BBRMVZONSA-N 385.389 5.016 30 20 GKED COc1ccc(-c2cnc(CNc3ccccc3S[C@H](C)CC#N)o2)cc1 174310636 BCKUZSKLSSVRPV-OAHLLOKOSA-N 379.485 5.357 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1)c1ccccc1 187039319 ZIFLLIZSOZHTOC-FQEVSTJZSA-N 388.467 5.529 30 20 GKED C=CCc1cc(CN[C@@H](C)c2sc(-c3ccccc3)nc2C)cc(OC)c1O 237331387 LCMARYKOKPFCGP-HNNXBMFYSA-N 394.540 5.412 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C/C=C\c1cccc(F)c1 255077289 QQBLDPILRGNBTN-UTCJRWHESA-N 387.414 5.235 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1cccnc1C)C(=O)c1ccccc1 255547684 OUTWKFLSICNBEV-HAVVHWLPSA-N 398.506 5.420 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1sccc1C#N 303330371 UBRMNDQUSSWYHM-JTQLQIEISA-N 387.917 5.196 30 20 GKED C[C@@H]1Sc2ccc(/C(O)=N/[C@@H]3CC[C@H](c4ccc(F)cc4)C3)cc2N=C1O 329930080 ZIDZPBPFDOLVLL-RVSPLBMKSA-N 384.476 5.549 30 20 GKED O/C(Cc1cn2cc(Cl)cc(Cl)c2n1)=N/[C@H]1CCOC2(CCCCC2)C1 330189509 LUUWNOPIYQHCIP-AWEZNQCLSA-N 396.318 5.022 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1 368576917 SYRGEDXSBHYRQG-YCRPNKLZSA-N 399.441 5.071 30 20 GKED CC(=O)c1cccc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 419512246 WVFLLPGGHRQQNG-HNNXBMFYSA-N 398.553 5.013 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)c2ncc(C#N)cc2Cl)c2cccs2)cc1 431580026 UIVWCFOFKMBTOR-LJQANCHMSA-N 395.915 5.311 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc2nc(C3CC3)sc2c1)c1ccccc1 432762122 CUDDEEJPQNAYTA-SFHVURJKSA-N 390.512 5.730 30 20 GKED COc1cccc([C@@H](NCc2cc(C#N)ccc2OC)c2ccccc2Cl)c1 434886977 LIRAXDYINJZVPI-HSZRJFAPSA-N 392.886 5.108 30 20 GKED Cc1cc(C(=O)CS[C@H](C)c2cccc(C#N)c2)c(C)n1-c1nccs1 443157450 YWUPOANQEWTJMN-OAHLLOKOSA-N 381.526 5.099 30 20 GKED Cc1ccccc1Cc1nc(CNc2cccc(Oc3ccc(C#N)cc3)c2)no1 444399572 OJPPEUDDCVWIQM-UHFFFAOYSA-N 396.450 5.245 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(OCc3ccncc3)cc2)CCCC1(C)C 444908017 QKJQBRQMEBBFFV-NRFANRHFSA-N 379.504 5.259 30 20 GKED C=CCn1c([C@H]2CCCCO2)nnc1N1CCCC[C@H]1c1ccc(Cl)cc1 453433355 CYEHJAVIVATUAE-RBUKOAKNSA-N 386.927 5.091 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455695978 BQSZXXDQLUSKIM-LBPRGKRZSA-N 395.812 5.650 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)o1 458798836 ISIIGYGDWGIFMP-QMMLZNLJSA-N 379.504 5.506 30 20 GKED CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccccc1SC[C@@H](C)C#N 462232283 ZGVKDDLKUGMZDT-HNNXBMFYSA-N 385.489 5.246 30 20 GKED Cc1cccc(Br)c1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 464406856 QTWMVOKMPPOHCJ-CQSZACIVSA-N 398.087 5.059 30 20 GKED C=CCC(CC=C)C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 467748927 XWFTUCAQYKKXAV-UHFFFAOYSA-N 384.911 5.032 30 20 GKED CC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(C)ccc1OC 469342832 HSGHJCKWPTXPAF-OAQYLSRUSA-N 391.515 5.150 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(C(C)(C)C#N)cc1 474898129 GDJJFNPEPRVVST-UHFFFAOYSA-N 397.478 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccc(C)cc1)N(C)C 475560047 RGDYNYXUWIZHBB-QFIPXVFZSA-N 379.548 5.271 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(-n2cccn2)ccc1C 475636422 HNJCBECGRGYJFJ-UHFFFAOYSA-N 386.908 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1 476172687 WZZDIGWIVOXDEX-UXHICEINSA-N 398.344 6.043 30 20 GKED Cc1ccc([C@@H](Cn2ccnc2)N[C@H]2CCCCc3cc(C#N)ccc32)c(C)c1 481649415 FAILGIFDLYHHPY-LOSJGSFVSA-N 384.527 5.170 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)N(CCC#N)CC(F)(F)F)o2)cc1 482661952 XLBYMILHEHNVSV-UHFFFAOYSA-N 378.394 5.162 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)c1 483198149 MRIVDDMBVGQOIT-FQEVSTJZSA-N 393.446 5.186 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 483342846 PVWVHUZEQWBHJG-UHFFFAOYSA-N 397.503 5.439 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1 485460239 CMOVRFQHKDJIJF-DENIHFKCSA-N 381.541 5.171 30 20 GKED N#CCCC[C@H](NC(=O)c1cc2cc(Br)ccc2o1)c1ccccc1 487407128 RGXKTORMHZXJCW-KRWDZBQOSA-N 397.272 5.360 30 20 GKED N#CCCC[C@H](NC(=O)CCOc1cccc(Cl)c1Cl)c1ccccc1 487430958 SFRAYINUOFRAAS-KRWDZBQOSA-N 391.298 5.314 30 20 GKED Cc1cccc2cc(C(=O)Nc3cccc(C(=O)Nc4cccc(C#N)c4)c3)oc12 488648679 YJKVVXISLSJYKM-UHFFFAOYSA-N 395.418 5.118 30 20 GKED C=CCC(C)(C)C(=O)NC[C@]1(C)C[C@H](NC(=O)C(C)(C)CC=C)CC(C)(C)C1 493954658 KEMQZSJPVNRVHY-HOYKHHGWSA-N 390.612 5.008 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(Br)cc1)[C@@H](C)c1ccc(C#N)cc1 499284833 DTSMYAHIYZOJMO-CABCVRRESA-N 385.305 5.034 30 20 GKED CC(C)(C)n1cc(CN(CCC#N)Cc2ccco2)c(-c2ccccc2Cl)n1 505739539 ILCDHGPLQHUNNP-UHFFFAOYSA-N 396.922 5.467 30 20 GKED C=CCOc1ccc(CN(Cc2cnc([C@@H]3CCCO3)s2)C(C)(C)C)cc1 506051628 PJPIVFIAUCMXPM-FQEVSTJZSA-N 386.561 5.360 30 20 GKED CC(C)N(Cc1ccc(F)cc1)Cc1cn(CCC#N)nc1-c1ccccc1 507171057 RZXIMADOXZAVFZ-UHFFFAOYSA-N 376.479 5.013 30 20 GKED O=C(Cc1ccc(C(F)(F)F)cc1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 509258989 CCKRNIUFEVJXPV-OAHLLOKOSA-N 393.302 5.197 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 509570222 HYMVZGHDXFEZNN-UHFFFAOYSA-N 380.444 5.465 30 20 GKED Cn1c([C@H](C#N)C(=O)c2ccc(SCc3ccccc3)cc2)nc2ccccc21 513677394 VTRQFHDKMIPLGG-HXUWFJFHSA-N 397.503 5.356 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)C1 515101292 RQZFPJHDPNOBKL-HTAPYJJXSA-N 394.544 5.038 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CC2(CC(=O)O)CCCCC2)cc1 516736270 BEUMMKJVIWNTQN-UHFFFAOYSA-N 392.455 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(OC(F)F)c(F)c1 517070929 TZYCRGLPPSTHMN-UHFFFAOYSA-N 399.434 5.080 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1cccc(OC)c1 518537741 GOVSZDLXIBFSJC-UHFFFAOYSA-N 390.414 5.165 30 20 GKED C=CCn1c(CCN2CCCCC2)nnc1S[C@@H](C)c1c(C)cc(C)cc1C 518841938 QEGHFTMMAPBSEK-FQEVSTJZSA-N 398.620 5.271 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)nn1C(C)(C)C 519422869 RHSIXEWHQBZODF-HNNXBMFYSA-N 384.549 5.266 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)CC(C)(C)c1ccccc1 520144455 IIIXLJWQFGDAKH-IBGZPJMESA-N 375.516 5.012 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C3CCCC3)cc2)cc1 521366567 OLOKIRXCMIQEFT-QFIPXVFZSA-N 375.472 5.537 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccc(Cl)cc2)C2CCCC2)c1 521829516 GNYMYCOGICARFK-HSZRJFAPSA-N 382.935 6.044 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 523818814 UWWCAGAPPQXVHL-GOSISDBHSA-N 397.478 5.251 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1C[C@@H]1c1c(F)cccc1Cl 525394488 STGZBKRLXWEZIS-FXAWDEMLSA-N 399.897 5.074 30 20 GKED CC(C)OC1CCN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CC1 534150975 QSBDJHLODNCONU-UHFFFAOYSA-N 398.890 5.034 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(NCCc4ccccc4)cc3)cc2)CC1 537518195 FJUTYCUEKJRWBV-UHFFFAOYSA-N 381.479 5.149 30 20 GKED CC(C)(C)[S@](=O)Cc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 539931660 LPTNYQLLMWYOSD-KNFYQODVSA-N 394.584 5.550 30 20 GKED C[C@H](NC(=O)c1ccc(-c2cnco2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542932591 DTMUHAVRXIPWCE-KRWDZBQOSA-N 393.446 5.371 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543113321 RMTXYAYVIBHFRY-KRWDZBQOSA-N 386.543 5.644 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(Cc3cscn3)no2)cc1Cl 545593952 KSBLBHLKWICBPD-UHFFFAOYSA-N 394.843 5.101 30 20 GKED C=CCSc1ccccc1C(=O)NCc1cccc(COCc2ccco2)c1 548599533 SRMBNULIUCJCCU-UHFFFAOYSA-N 393.508 5.205 30 20 GKED Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1ccccc1CC#N 550086550 SRKWBJNBKMTRQO-UHFFFAOYSA-N 397.887 5.002 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(c4ccc(Cl)cc4Cl)CC3)cc2)CC1 552610367 MAUFUIZQCNPGJS-UHFFFAOYSA-N 399.321 5.568 30 20 GKED N#CCCC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 556907888 DOWYKKDGTOIWIF-OAQYLSRUSA-N 391.496 5.848 30 20 GKED C=C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)CC1 557637937 GPOJIMBMTQRZPO-VLGSPTGOSA-N 384.479 5.497 30 20 GKED N#Cc1ccc2ncc(CN[C@@H](c3ccccc3)c3cccc4ccccc34)n2c1 560259329 XGCSHIOLMZRFCW-SANMLTNESA-N 388.474 5.238 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F)C(F)(F)F 582326831 XASLTFMXZJPZPH-SECBINFHSA-N 395.274 5.426 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)CCCCCC#N)c2)cc1 588647581 KRLCWXIIPFGKNA-HXUWFJFHSA-N 392.543 6.134 30 20 GKED C[C@@H](NCc1cc(C(F)(F)F)ccc1Br)c1cccc(C#N)c1 589314237 UNNITAMFGILGTE-LLVKDONJSA-N 383.211 5.190 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 591724109 WGVUOEYISABKRR-OAHLLOKOSA-N 382.504 5.673 30 20 GKED Cc1cc(C)cc(Oc2cccc(F)c2NC(=O)N2CCC(CC#N)CC2)c1 593254395 BMTHJVUWHLKQSA-UHFFFAOYSA-N 381.451 5.392 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3c(Cl)cccc3Cl)cn2)c1 603622150 MFDUXKYNKSXOLF-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#C[C@@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(Cl)cc1 609589623 ZFPOFZMMHHMMJL-GFCCVEGCSA-N 395.698 5.856 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1cc2ccccc2n1CC#N 610721507 RYOBOXBLLIGKKQ-SFHVURJKSA-N 386.499 5.104 30 20 GKED CC(C)(CC(F)(F)F)C(=O)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1 614528553 KXYGSYCRTQWBKX-OAHLLOKOSA-N 385.323 5.081 30 20 GKED CC(C)(NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C(F)(F)F 616205447 SJUDVPBBHQAAGG-UHFFFAOYSA-N 399.228 5.047 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccccc2CC(F)(F)F)cc1 630068570 XQBMGIXZJAVZTQ-UHFFFAOYSA-N 388.433 5.218 30 20 GKED C=CCC[C@@H](NC(=O)C[C@@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 676731466 ZVRWOVMCBWLMII-DNVCBOLYSA-N 376.422 5.418 30 20 GKED CC(C)(C)c1noc(-c2ccccc2C(=O)[C@@H](C#N)c2ccc3ccccc3n2)n1 679536140 AKTYOFPFNHDJFP-SFHVURJKSA-N 396.450 5.072 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1sc(-c2ccc(C)cc2)nc1C 727650967 DDGFMAIDBIZPAN-UHFFFAOYSA-N 390.434 5.677 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1N[C@@H](C)C(=O)Nc1ccccc1C#N 728066916 VWIFXAQWRPYMNG-RBUKOAKNSA-N 399.494 5.446 30 20 GKED CC[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 729082566 UOBCOGYPOLJXTI-UZLBHIALSA-N 390.508 5.579 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(-c2ccc3ccccc3c2)n1 729360165 NZCQLHDPJCJJRD-UHFFFAOYSA-N 395.487 5.770 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)/C=C/c3ccccc3C#N)s2)cc1 730761099 GUPLJSJGWRMURE-CJTWTEFWSA-N 387.508 5.189 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)NCc1ccc(OCC#N)cc1 731542286 XWJHHIGMAHNXII-UHFFFAOYSA-N 387.439 5.011 30 20 GKED CN(CCc1ccccc1F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 731752758 OKZGQPRMAGTBAZ-UHFFFAOYSA-N 389.430 5.196 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(Nc2ccc(F)cc2)c2ccncc12 731883877 ONYKNEZHWIZDCN-OAHLLOKOSA-N 379.435 5.037 30 20 GKED CC(=NNc1cc(C)ncn1)c1ccc(-c2ccccc2Br)s1 731935808 SJMRGHUYTXIFSU-UHFFFAOYSA-N 387.306 5.112 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(OC3CCC3)cc2)cc1 744033105 MVXVKDRDBCRVMF-KSFYIVLOSA-N 390.483 5.093 30 20 GKED CC(=NNc1ccc(Br)c(C)c1)c1c(C)nn(-c2ccccc2)c1C 746494862 VFZSJRSHEDSXNP-UHFFFAOYSA-N 397.320 5.396 30 20 GKED CC[C@@H](Oc1cccc(C)c1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 750688496 DNYZDDCEGZDATQ-NVXWUHKLSA-N 384.888 5.292 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 752159469 HIHOFLBNAHKCLW-ZWKOTPCHSA-N 382.385 5.624 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(N2CCCCC2)cc1 753133859 FFDHUUKEFCLOJI-HJWRWDBZSA-N 375.497 5.092 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(SCC(F)F)cc1 753144970 SGDJXNCOXJAHEC-AATRIKPKSA-N 388.464 5.458 30 20 GKED C#CC[C@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 757761035 MDPLHDKMHWQYSQ-VWLOTQADSA-N 395.506 5.187 30 20 GKED C=C[C@@H](CC(=O)O[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 758909414 BYOLAFGZPLZTJI-MOPGFXCFSA-N 379.500 5.349 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759184024 OUIJRQKSONABQA-IYPOZPNPSA-N 376.843 5.125 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccc(F)cc2)c2nccn2C)cc1 764815527 QULJSVVKUSRGFT-IIBYNOLFSA-N 399.897 5.131 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc4[nH]ccc4c3)n2)cc1 765938771 ZAESEDXJWLVENC-RRGNZLCHSA-N 394.459 5.053 30 20 GKED CC(=NNc1ccnc(Br)c1)[C@H](C)c1nc2ccccc2s1 769813692 MLRLZKSRTWWXSY-JTQLQIEISA-N 375.295 5.045 30 20 GKED COc1cc(Cl)ccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 772914404 WCIHNHVIZOUNPE-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CCSc1ccc([C@H](C)NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)cc1 772984960 HIJLFKCBMZTULB-QFBILLFUSA-N 384.545 5.339 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2)c1 778037786 YWGHLCUANOKKJE-UHFFFAOYSA-N 396.805 5.426 30 20 GKED N#C[C@@H](C(=O)CCOc1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 780359303 SRMDWBOWJULUOI-SFHVURJKSA-N 390.439 5.234 30 20 GKED C#CC[C@H](N[C@H]1C[C@H](NC(=O)OC(C)(C)C)c2ccccc21)c1ccccc1 780732155 LKQDRSGZRCZNMB-FKBYEOEOSA-N 376.500 5.051 30 20 GKED CC(C)(C#N)CCCOC(=O)c1[nH]c2ccc(Br)cc2c1Cl 783030167 WISAIQVTTIPQQP-UHFFFAOYSA-N 383.673 5.071 30 20 GKED C=CCCC(=O)Nc1cc(Br)cc(C)c1NC(=O)OC(C)(C)C 784690285 ITPCKQOZSPGSNC-UHFFFAOYSA-N 383.286 5.009 30 20 GKED N#CCCn1cc(C=NN(c2ccccc2)c2ccccc2)c(-c2ccncc2)n1 788407641 HEZHMTIRLIAAPC-UHFFFAOYSA-N 392.466 5.031 30 20 GKED C[C@@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(OCC#N)cc1 797040867 MPLZQLNTTZKZKX-VLIAUNLRSA-N 390.405 5.289 30 20 GKED Cc1cc(Cl)nc(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 800538136 QYTRNBCQHVSKTN-UHFFFAOYSA-N 392.846 5.029 30 20 GKED C=CCC[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 801531936 SOYVNRVAJPGXKW-KRWDZBQOSA-N 375.266 5.154 30 20 GKED C[C@H](OC(=O)CCCCCC#N)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 805695046 GPNVPMSJYHTERU-NSHDSACASA-N 382.247 5.122 30 20 GKED N#Cc1ccc(CNc2cc3c(cc2Cl)OCCCO3)c(C(F)(F)F)c1 810151671 DUCLZGKZBLYNOT-UHFFFAOYSA-N 382.769 5.004 30 20 GKED N#Cc1cc(Oc2ccc(NC(=S)Nc3cccc(Cl)c3)cc2)ccn1 811708209 SSLMUQXUIWOUMZ-UHFFFAOYSA-N 380.860 5.208 30 20 GKED C[C@H](OC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(C(F)(F)F)nc1 813249504 ALJOGIIQVQGATG-ZETCQYMHSA-N 399.237 5.315 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cnn(CC(F)F)c1 814188660 QHUIWBFOPBNHTA-UQCOIBPSSA-N 393.846 5.130 30 20 GKED COCc1nc(Cl)cc(NN=C(C)c2cc3c(ccc4ccccc43)o2)n1 814977593 UNAIUAIOMIDEEG-UHFFFAOYSA-N 380.835 5.012 30 20 GKED CC(C)N(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)[C@@H](C)c1ccsc1 817287148 KUEGFEWGAYWEJO-GOEBONIOSA-N 383.542 5.006 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 835069233 YJVONJNIKYEKLT-GWCFXTLKSA-N 386.826 5.618 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2csc(-c3ccc(Cl)cc3)n2)CCC1 899384344 JIROWDOKVAPMHC-RUZDIDTESA-N 392.977 5.576 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccc3ccccc3n2)cc1 915181334 YXUBTUXTVLNWDT-JOPBRCQMSA-N 389.458 5.542 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccc(F)cc2)C2CC2)cc1 915352583 MLKJDKKXVDAQMB-XMMPIXPASA-N 399.469 5.678 30 20 GKED CC(C)[C@H]1/C(=C\c2cc(C(=O)O)ccc2Br)C(=O)c2ccccc21 1776308919 YPMQZTYOFHLYPG-GANRHZMWSA-N 385.257 5.167 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(F)c(C(=O)O)c2)cc1)c1ccccc1 1776469386 DHIMTPSQPXXLHU-VCHSTOLQSA-N 390.410 5.560 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3Cl)s2)cc1C(=O)O 1777360831 UXWKODJFFVZBEK-VURMDHGXSA-N 398.867 5.671 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CC4(CC4)c4ccccc4C3=O)o2)cc1O 1777670982 MLZPEQZMWZUPQJ-PTNGSMBKSA-N 386.403 5.052 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)CC(F)(F)F)cc2)CCC1 1787873787 PVUSKQVBFYHCNZ-UHFFFAOYSA-N 396.453 5.065 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1 24449666 FAVNWDAIVRNKDM-UHFFFAOYSA-N 387.439 5.148 30 20 GKED N#CC1CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)CC1 61584144 NJPUULNSIWWGAS-UHFFFAOYSA-N 382.510 5.162 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccco1 66954674 RLEUQZVKCCIMLM-HRAATJIYSA-N 391.496 5.585 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1cccc(Cl)c1 72098934 LUVZHQNGOIBXGH-UHFFFAOYSA-N 389.883 5.128 30 20 GKED CCCCc1noc([C@H](C)Nc2cc(C(F)(F)F)ccc2SCCC#N)n1 108408673 BVAIRWXCGDVGEY-LBPRGKRZSA-N 398.454 5.610 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCOc2ccccc21)c1nc2cc(Cl)ccc2s1 118143510 VAYSCTBIIZZKFX-WFASDCNBSA-N 382.872 5.082 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 120938193 RFQZYVZJIFFTSS-UHFFFAOYSA-N 388.471 5.274 30 20 GKED Cc1cccc(C2=CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)CC2)c1 179382566 FSEDVJYMOFYKSI-GOSISDBHSA-N 391.540 5.568 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 184578388 SFNJNEXNNMDBQU-VGSWGCGISA-N 398.466 5.361 30 20 GKED COc1ccccc1-c1csc(C2CCN(c3ccc(C#N)cc3)CC2)n1 302722753 MBIRJOYWGKVFQQ-UHFFFAOYSA-N 375.497 5.074 30 20 GKED N#CCCCOc1cccc(NCc2cc(Br)ccc2Cl)c1 318688908 OBASNJYOXFWYHP-UHFFFAOYSA-N 379.685 5.397 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@@H]1CCCC(F)(F)C1 409996750 HBAFUIWWWJQPTI-PWSUYJOCSA-N 389.286 5.251 30 20 GKED C=C(C)CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 428111893 UAGNHKZBHCWPRZ-UHFFFAOYSA-N 396.390 5.071 30 20 GKED Cc1cc(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)ccc1C(F)(F)F 428640718 VGJXCPHEQZRBOP-UHFFFAOYSA-N 398.388 5.043 30 20 GKED Cc1c(Br)cccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430578296 ARILRGLRTCHKJX-GFCCVEGCSA-N 377.307 5.002 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 431369886 OQPITVSWNLSIHO-DNVCBOLYSA-N 389.421 5.501 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)on1 432625841 DAZOCAMFEPYRDT-IBGZPJMESA-N 388.427 5.016 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)c(C(F)(F)F)c1)c1ccccc1 432770484 GXHGIEJKNBVOLS-QGZVFWFLSA-N 379.357 5.401 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(-c2ccccc2)ns1)c1ccccc1 432965315 MJJYPZIVFLXEDW-SFHVURJKSA-N 376.485 5.367 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(F)c(Cl)c1 433507004 QFWMUOGEOILVRF-CYBMUJFWSA-N 391.899 5.395 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccc(O)c1 438653704 DFZJQKCMIUEXKL-AWEZNQCLSA-N 391.402 5.078 30 20 GKED C=CC[C@H]1N(C(=O)c2ccc(C(=O)N(C)c3ccccc3)cc2)CCCC1(C)C 443872244 ZACRDUWOIZVUAC-JOCHJYFZSA-N 390.527 5.170 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 444445057 BVAWZJNLPOQZKQ-UHFFFAOYSA-N 383.476 5.752 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC3(CCCCC3)C2)cc1 461137292 BAHFGFAAKUGDRS-UHFFFAOYSA-N 390.552 5.647 30 20 GKED Cc1nc(Nc2cccc(C[S@](=O)Cc3ccccc3)c2)c(Cl)cc1C#N 461955793 IPQHRVMSNQIZGN-HHHXNRCGSA-N 395.915 5.108 30 20 GKED C=CCC[C@H](NC(=O)Nc1cn(C)nc1C1CC1)c1ccc(C(F)(F)F)cc1 463846011 AUJMSLSZTBPPJA-INIZCTEOSA-N 392.425 5.145 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccc2)ns1)c1c(Cl)cccc1Cl 469048568 OZEJFZXGDXHLGM-OAHLLOKOSA-N 388.279 5.112 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(OC[C@H]2CCCO2)cc1 475555839 YTZNSKWDPRDZGQ-OAQYLSRUSA-N 394.515 5.740 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)[C@H](C)C(F)(F)F 477980096 NTUWIEMASSBZJW-CYBMUJFWSA-N 378.419 5.122 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@@H](c4ccc(F)cc4)C3)c2)cc1 478243278 USJLFFKJAMMKFN-HXUWFJFHSA-N 386.426 5.119 30 20 GKED CC[C@H](CN(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 480564796 SBRDFRUWYAIXHT-RBUKOAKNSA-N 395.572 6.128 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc2ccc(Cl)cc2n1C)c1ccc(F)c(F)c1 480692015 FDACYZIDYAAQJQ-CWTRNNRKSA-N 375.850 5.473 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(OC2CCC2)c(F)c1 483518603 MRMUXOLOOKKVDH-FPOVZHCZSA-N 393.462 5.061 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2sc(C3CC3)nc2-c2ccccc2)n1 483840511 LXUZAXQVLYOQJL-HNNXBMFYSA-N 393.537 5.757 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1)c1c[nH]c2ccccc12 486429681 GEDGBOKWPAWDAG-CWTRNNRKSA-N 386.282 5.349 30 20 GKED CCn1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1cccc(Cl)c1 494584721 PLNCRSQIHDUNTL-SFHVURJKSA-N 382.920 5.154 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cccc2[nH]ccc12 494752872 VKUNHWRJFVOKLJ-OAHLLOKOSA-N 378.501 5.226 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 495102014 PFCYQTBJGVCALZ-OAHLLOKOSA-N 390.405 5.396 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)N[C@@H](C#N)c2ccccc2Cl)C1 501728257 UBWUVTGNBMDQAL-HLIPFELVSA-N 376.928 5.177 30 20 GKED N#CC1(CCCSCc2ccc(Cl)cc2Br)CCOCC1 507697283 IBXFUIDSRIZFBZ-UHFFFAOYSA-N 388.758 5.436 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2c(ccn2CCC)c1 509871229 PEKYWUWSDJTQQA-UHFFFAOYSA-N 377.488 5.280 30 20 GKED CN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CCCC1 522309907 NEECGGXZXZPMGD-UHFFFAOYSA-N 383.879 5.197 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1ccc(C#N)cc1 523004762 WAZFNCKCNIWKLH-KRWDZBQOSA-N 375.497 5.093 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 533900378 HOQYELAMPJOUHV-LJQANCHMSA-N 384.479 5.262 30 20 GKED Cc1cncc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 535535405 MEOIXDUJTCWCMQ-UHFFFAOYSA-N 392.846 5.029 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)C2CC2)cc1 542378739 UZVFUJASLFFFHO-OAQYLSRUSA-N 379.891 5.037 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(CC#N)CC2)cc1 542901872 MGLRFJDZNMYXNZ-KRWDZBQOSA-N 379.529 5.697 30 20 GKED COc1cccc([C@H]2C[C@H](C)CN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 544236244 FZTNSXSNKMEEKG-HRAATJIYSA-N 377.488 5.111 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(-n2cccn2)c(F)c1 550858319 RHKKUIWJCGCDOB-ZGYBWILLSA-N 388.490 5.066 30 20 GKED COc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1F 553284479 WVCRSKFCFQRZRU-HNNXBMFYSA-N 381.291 5.246 30 20 GKED COCC(C)(C)CCCNC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 554341679 YLSKEZRWWSJGDP-SFHVURJKSA-N 393.531 5.038 30 20 GKED Cc1sc([C@H](C)NC(=O)c2cscc2C#N)nc1-c1ccc(Cl)cc1 556602351 SEHRHDNOPUSHIH-JTQLQIEISA-N 387.917 5.196 30 20 GKED C=CCC(C)(C)c1noc(-c2ccc(C)c(NC(=O)c3ccccc3F)c2)n1 568610578 ROVLDWCBMDRORK-UHFFFAOYSA-N 379.435 5.290 30 20 GKED C[C@H](NC(=O)N1CCC(CCC#N)CC1)c1cccc(OCc2ccccc2)c1 571519663 VZPGOLLYXXNMQH-IBGZPJMESA-N 391.515 5.052 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3cccc(NC(=O)c4ccco4)c3)no2)cc1 576191796 AEVXGRNXGAHQQA-UHFFFAOYSA-N 398.422 5.050 30 20 GKED Cc1cc(NC(=O)N(C)CCOCc2ccc(C#N)cc2)ccc1-c1ccccc1 581967388 PZVZFJGDYIMTED-UHFFFAOYSA-N 399.494 5.214 30 20 GKED N#Cc1ccncc1C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 588154023 KQZDGTDZHSUSQA-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1ccc(C(C)(C)CNC(=O)c2c(Cl)cc(C#N)cc2Cl)c(C)c1 590447822 DDPRXLVMXZFCTG-UHFFFAOYSA-N 375.299 5.190 30 20 GKED Cc1ccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C#N 600648628 PXHAHVPQXKHHMU-MRXNPFEDSA-N 395.553 5.133 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603689940 UWVKFONEXLUKRZ-KRWDZBQOSA-N 386.455 5.279 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CC1 609079435 CIERULYNSSWAPX-UHFFFAOYSA-N 397.906 5.445 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c2ccccc21 609163802 AFLILFLMYVSYOB-FQEVSTJZSA-N 399.881 5.739 30 20 GKED CC(C)COc1cccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 609398466 UUMUHZOLVPNAFV-KRWDZBQOSA-N 397.544 5.295 30 20 GKED CCCN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609435093 OXKXWCMUCMODCQ-INIZCTEOSA-N 385.508 5.664 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccc(OC)c1 609499248 ZIPMFZUDDQMSPY-UHFFFAOYSA-N 386.451 5.220 30 20 GKED COc1ccc(-c2nnc(SCCC(C)(C)C#N)n2-c2ccc(C)cc2)cc1 610165667 ZCHODKBMIIFFJD-UHFFFAOYSA-N 392.528 5.283 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)c1sc2cccc(Cl)c2c1Cl 610504068 ULIMYFNYRNBQJL-UHFFFAOYSA-N 381.206 5.126 30 20 GKED C[C@H](N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1cccc(C#N)c1 610829732 HCSRIVHZTVKGDB-OALUTQOASA-N 396.494 5.197 30 20 GKED Cc1sc(CN[C@H]2CCCc3cc(C#N)ccc32)nc1-c1ccc(Cl)cc1 611392481 XUSVCEBDVWGSKB-FQEVSTJZSA-N 393.943 5.811 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N3CCC[C@@](C)(C#N)C3)c(C)c2)c1 612306614 YOVDVRALEGTHIZ-QHCPKHFHSA-N 377.488 5.040 30 20 GKED N#C[C@@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1nc2ccccc2[nH]1 613287400 NKEPWMNUJAFRCZ-VIFPVBQESA-N 386.263 5.574 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)CCCCc1nc2ccccc2s1 615969552 CIHDQDPTIWOYBZ-UHFFFAOYSA-N 382.504 5.363 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N[C@H]2CCc3cc(C#N)ccc32)cc1 618810728 FGMZPOVEKBVEQP-BTYIYWSLSA-N 379.529 5.106 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(COCc2ccc(OC)cc2)c1 665878655 ONBMXYMXDSQONS-SZPZYZBQSA-N 392.499 5.127 30 20 GKED C=CCN(C(=O)c1ccc(C(F)(F)F)s1)c1nc(-c2ccccc2)cs1 673433244 QBKKZYXPBRVTBG-UHFFFAOYSA-N 394.443 5.723 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 682099922 UOGPENSLJCRNMP-LLVKDONJSA-N 392.290 5.439 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)Cc2ccccc2Br)c1 726484409 LKIOQEUFFNMYDI-UHFFFAOYSA-N 387.346 5.039 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 730688450 XEZJAPOLCVESHJ-QFBILLFUSA-N 390.508 5.264 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N1CCC(c2nc(-c3ccccc3)cs2)CC1 732094663 RQGVZXGPFRLDPI-ZHACJKMWSA-N 399.519 5.101 30 20 GKED O=C1/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)CSc2ccc(F)cc21 733083188 DRXPXXAYELOXLU-SDQBBNPISA-N 398.440 5.229 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1ccccc1Oc1ccccc1)c1ccncc1 734665979 VOXLBJWSYKYHSI-GCJKJVERSA-N 387.483 5.552 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C/C(=O)c1cccc(-c2ccncc2)c1 741473890 UJQANNUYQJUYKB-ZHACJKMWSA-N 397.453 5.586 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]cc2-c2ccc(F)cc2)cc1 742046811 DJZZMTWPTKTBRA-QFIPXVFZSA-N 395.437 5.729 30 20 GKED COc1ccc(-c2cc(C(=O)N(C)c3ccc(C#N)cc3)c3ccccc3n2)cc1 742223003 DLCCTILSENEZEM-UHFFFAOYSA-N 393.446 5.059 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)n1 747199117 PBTRNVVIIHNRGC-YIALFULDSA-N 398.837 5.828 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2cc(Cl)ccc2OC(F)F)cc1 748440480 LPDUSTUORFJOHF-GXWOQWCDSA-N 377.774 5.128 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc2ccccc2c1 753395576 OKLMNZVANQPYKG-GAJHUEQPSA-N 392.458 5.444 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)/C=C\c2ccnc(Cl)c2)cc1 757932595 GGWISQCVEOHONE-YHYXMXQVSA-N 375.815 5.051 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cc(Br)ccc1F 763122243 OXYRSRVAZDOOEN-RQOWECAXSA-N 394.290 5.669 30 20 GKED N#CC1(COC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)CCC1 768097467 ZNDRADLMHZSKOT-UHFFFAOYSA-N 377.227 5.031 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1nc(-c2ccccc2)no1 768498720 DWJJXXHNZTUFLM-KRWDZBQOSA-N 396.450 5.360 30 20 GKED CC[C@@H](Nc1ccc(OCC(=O)N(CC)CC)c(Cl)c1)c1ccc(C#N)cc1 774282990 RMVSIOPDIFPQFJ-HXUWFJFHSA-N 399.922 5.022 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@H](C#N)C3CCCCC3)c12 776374805 UDSVKYYQYDSPGT-LJQANCHMSA-N 394.519 5.001 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccccc1O[C@H](C)C#N 780675407 WPOVFSCFOLUHGD-KGLIPLIRSA-N 391.393 5.221 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780679019 STHMJJKLKLRDSI-UWJYYQICSA-N 377.488 5.470 30 20 GKED Cc1nc(Cl)sc1C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782484669 CUTPGJBMHXORSU-LBPRGKRZSA-N 381.888 5.135 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1Cc1ccc(Cl)nc1C(F)(F)F 787254679 IEUXJDZGBJHSSV-JKSUJKDBSA-N 379.813 5.026 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(CNC(=O)OC(C)(C)C)cc1 800153897 DZVZLPITMQUBST-UHFFFAOYSA-N 380.488 5.082 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2csc(-c3ccccc3)n2)C(=O)c2ccccc21 802708974 MTLIFUOWAZSGHK-ZRNYNZGJSA-N 389.476 5.127 30 20 GKED Clc1ccccc1COc1cccc(Cl)c1C=NN[C@@H]1CCSC1 808001865 HSBWLZAXWZAMIL-CQSZACIVSA-N 381.328 5.001 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(N2CCCCC2)c1)c1ccccc1 814621724 MWEZXDBLFJFCHL-QFIPXVFZSA-N 376.504 5.234 30 20 GKED CCCC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccccn1 814926804 KQADBZBCXJYNOV-UHFFFAOYSA-N 385.393 5.174 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 862720699 ZIELZJJXUQHZEU-QGZVFWFLSA-N 380.488 5.640 30 20 GKED C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[S@](=O)CCCCC1(C#N)CCC1 899394026 CDDOSYGUHIEFOJ-IYJVBRSBSA-N 391.924 5.064 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351824 HASYSASJMAMFHQ-RUZDIDTESA-N 397.522 6.095 30 20 GKED Cc1sc2ncn(N=Cc3c(F)cccc3Cl)c(=O)c2c1-c1ccccc1 916283603 JWTNQHDEZMEGKG-UHFFFAOYSA-N 397.862 5.108 30 20 GKED O=C(/C=C\c1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605568 WUCWZXJIRXDYKU-YFHOEESVSA-N 380.381 5.128 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)ccc1Cl 1776033851 PTCHRCRLBAIHSO-AWEZNQCLSA-N 396.796 5.793 30 20 GKED O=C(O)c1cccc(NN=Cc2ccccc2Oc2ccc(F)cc2Cl)c1 1776037127 ZNMCXKDLYSEUEK-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(C)(C)CC(=NNc1cccc(C(=O)O)c1)c1ccc(Br)cc1 1776037388 FDRPILCFAQTRKV-UHFFFAOYSA-N 389.293 5.400 30 20 GKED CCC(=NNc1cccc(C)c1Cl)c1ccc(OCCCCC(=O)O)cc1 1776106843 YLHFMKWUSKGTDF-UHFFFAOYSA-N 388.895 5.508 30 20 GKED CC(C)c1ccc(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)cc1 1776370448 GRNGFHUBRSNPJD-XGICHPGQSA-N 390.435 5.576 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CSC(C)(C)C)C(=O)O)cc1 1776789070 NYIMLPUIFULERM-LJQANCHMSA-N 381.582 5.110 30 20 GKED COc1cc(C)ccc1C(=O)/C=C\c1ccc(-c2cccc(C(=O)O)c2)s1 1777280640 HPKLSYZTSLGFAQ-YFHOEESVSA-N 378.449 5.326 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3[nH]ccc3C)CCC2)cc1 1789624240 OLNJRZFBQXYVMQ-UHFFFAOYSA-N 393.531 5.063 30 20 GKED C=CCn1c(SCc2ccc(SC)cc2)nnc1-c1ccc(OC)cc1 5855825 UUDJTYYDURWKFO-UHFFFAOYSA-N 383.542 5.154 30 20 GKED COc1cc(C(=O)Nc2cccc(C#N)c2)ccc1OCc1ccccc1Cl 15738989 LBNHOIQIJJZKHJ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cnc(-c2ccccc2Cl)s1 50341319 BMZXNUYEORMFHR-UHFFFAOYSA-N 397.887 5.375 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(C)cc2C)n1 63927671 MAZKKGYAVYVXPB-UHFFFAOYSA-N 389.524 5.351 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 67798927 PLEXXADKBNTKNI-MRXNPFEDSA-N 398.434 5.124 30 20 GKED CCc1ccccc1O[C@@H](C(=O)[C@H](C#N)c1nc(C)cs1)c1ccccc1 107407929 OLMSAZBYDHDEPI-GHTZIAJQSA-N 376.481 5.011 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1Cl 108356551 YWIKKAAHZLMNRS-CABCVRRESA-N 387.936 5.024 30 20 GKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1C(F)(F)F 118445083 IIKXHYZAKKATNK-OLZOCXBDSA-N 378.419 5.398 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1cccnc1 123336183 UHYDEYGOFLCADZ-OAHLLOKOSA-N 389.484 5.034 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1c(F)cc(C#N)cc1F 132235380 OOBUODILXCCVIU-UHFFFAOYSA-N 396.368 5.115 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccccc1 155011686 RIQJGAGHPHEVNH-HXUWFJFHSA-N 389.455 5.361 30 20 GKED COc1ccccc1-c1nc(CN(Cc2ccc(C#N)cc2)C(C)C)cs1 157665283 BQPUHNYHEHABDB-UHFFFAOYSA-N 377.513 5.101 30 20 GKED N#CCCN(Cc1cccc(NC(=O)c2ccccc2Cl)c1)Cc1ccco1 159555695 PNCCZCWAUBVVLI-UHFFFAOYSA-N 393.874 5.101 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCSc2ccccc21 171839131 PUNLHNDQGBDOSU-GOEBONIOSA-N 383.542 5.439 30 20 GKED CC[C@H](C)Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 175119712 NJLRPCDBAYPGDD-XJKSGUPXSA-N 383.398 5.099 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H](C)c1ccccc1 183337484 ZLEJGFRFWOLDQK-DLBZAZTESA-N 384.570 5.414 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 187330397 AMPSNMHFHJTGKH-LJQANCHMSA-N 376.481 5.299 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(C)cc(C)c2)cs1 255063539 SIGJERYMXNWODE-YFHOEESVSA-N 390.508 5.649 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cnc(-c4ccccn4)s3)c2C#N)[C@@H](C)C1 410977952 LBQUUKZQOPDHGV-RYUDHWBXSA-N 394.525 5.076 30 20 GKED COc1ccc2cc(CN(C)C(=O)Nc3ccc(C#N)cc3Cl)ccc2c1 426126164 IUMMXYOSWNUBEC-UHFFFAOYSA-N 379.847 5.037 30 20 GKED COc1ccc2oc([C@H](C)NC(=O)Nc3ccc(C#N)cc3Cl)c(C)c2c1 426134748 WWRITAGGFRBOOO-LBPRGKRZSA-N 383.835 5.158 30 20 GKED C[C@@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccc(Cl)s1 426163918 BJLGASFWFUJEQT-LLVKDONJSA-N 387.917 5.063 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)c3ncc(C#N)cc3Cl)cc2)cc1 427933039 ZRNFLINLSICSMA-UHFFFAOYSA-N 393.830 5.050 30 20 GKED Cc1c(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)cccc1C(F)(F)F 428502132 HIPMDXCVQIVPHQ-UHFFFAOYSA-N 398.388 5.043 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N(CCC#N)CCC(C)C)cc1F 429055617 NSOPTSASHNMFDM-UHFFFAOYSA-N 399.466 5.420 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2c[nH]nc2-c2cc3ccccc3o2)s1 430609711 IMZPNMXZSBXDBH-CYBMUJFWSA-N 390.468 5.067 30 20 GKED N#CCSc1cccc(C(=O)NCC2(Sc3ccccc3)CCCC2)c1 430701517 OYYVXVVAOYAMNT-UHFFFAOYSA-N 382.554 5.137 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1c1ccncc1 432799147 AKJIYZQNFKMYET-JOCHJYFZSA-N 398.466 5.361 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccc(Br)s2)ccc1OC 436420952 VBAAMXCNPODHES-ZDUSSCGKSA-N 396.350 5.325 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccccc2-c2cn[nH]c2)cc1 439761613 YYVSVWHWYVVAGE-UHFFFAOYSA-N 394.434 5.301 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1scnc1C)c1ccc(C(F)(F)F)cc1 441539613 ZBBVZZIKGFIWMB-INIZCTEOSA-N 397.466 5.319 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 444172291 QTOBLMMAEGYQON-QFIPXVFZSA-N 398.510 5.237 30 20 GKED N#C[C@@H]1CCC[C@@H](N[C@@H](CC(F)(F)F)c2ccc(Br)cc2)C1 446764916 AOYJFTQZYOQXCJ-DFBGVHRSSA-N 375.232 5.115 30 20 GKED Cc1ccc(N[C@@H]2CCC[C@@H](C#N)C2)cc1Oc1ncccc1Br 448355600 OKZLYQRRGJJCPV-HUUCEWRRSA-N 386.293 5.439 30 20 GKED CC(C)(c1ccc(C(=O)Nc2ccc(CC#N)cc2Cl)cc1)C(F)(F)F 452643808 BAKAJLSYYURCHN-UHFFFAOYSA-N 380.797 5.498 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccco1 454755763 HVJLFFORWJGIIJ-DNVCBOLYSA-N 381.501 5.433 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H]1CCCN(c2ccccc2Cl)C1=O 463925448 MSLOWCDKZJFKEB-YJBOKZPZSA-N 399.947 5.199 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(CC(F)(F)F)c3)cc2)nc1 464424013 FLUMIJKHWAOEID-UHFFFAOYSA-N 397.356 5.103 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)s1 469121113 VMAWTBBNFAATNP-INIZCTEOSA-N 387.936 5.548 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Oc1cccc2ccccc12 469407425 FRNUGDHYFHZAAW-DLBZAZTESA-N 390.508 5.498 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2cccc3cc[nH]c23)cc1 469529667 SVTPOOWWDZCRCJ-UHFFFAOYSA-N 397.503 5.262 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1OCCC 474441655 PPKNYKIAKARCFC-MRXNPFEDSA-N 386.517 5.334 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccc(F)cc2)CC1 475554926 ZSYPZGAIUWQWIT-UHFFFAOYSA-N 378.491 5.999 30 20 GKED C[C@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccccc2)cs1 475753433 HCCLJKATRQQHHL-HNNXBMFYSA-N 375.497 5.102 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](CC)c1ccc(Cl)cc1 477832506 YAMJZPCVSHWLFM-HXUWFJFHSA-N 388.943 5.356 30 20 GKED CC[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1nc(C(F)(F)F)cs1 481665123 ZNYFFHADTIDVRV-HZPDHXFCSA-N 379.451 5.542 30 20 GKED N#CC[C@H](Cc1nc(-c2ccc(COc3ccccc3)cc2)no1)c1ccccc1 481901647 FTMSQXOXMDWFHA-JOCHJYFZSA-N 395.462 5.556 30 20 GKED CN(C(=O)CSc1ccc(C#N)cc1)[C@@H](c1ccccc1)c1ccc(F)cc1 482041093 QRNGUXGOWTWXJV-QHCPKHFHSA-N 390.483 5.037 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2ccccc2F)s1 484509119 YZFCQDPFJUEHED-SNVBAGLBSA-N 375.881 5.723 30 20 GKED CC(C)CCn1ncc(NC(=O)Nc2cccc(OCCCC#N)c2)c1C(C)C 486240373 AWCUYSHIRUBJMS-UHFFFAOYSA-N 397.523 5.379 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccccc1CN1CCCCCC1 494504772 QPLJUIBYQOAQRH-UHFFFAOYSA-N 397.588 5.022 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1)[C@@H](C)c1ccc(C#N)cc1 499369187 AYPBTIRKXDWKPS-VHKYSDTDSA-N 397.316 5.034 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCCC[C@H]2C(F)F)cc1Cl 500566582 KARUDMAXSNODAT-INIZCTEOSA-N 390.817 5.264 30 20 GKED COc1ccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500766952 CXJLSGQWDKOGMK-UHFFFAOYSA-N 386.451 5.239 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1 505299684 YYKDFOMQJPWHAX-YWZLYKJASA-N 385.508 5.596 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N2CCC(C)(C#N)CC2)cc1 506282580 HSDOAQBNHMSYBU-UHFFFAOYSA-N 379.460 5.035 30 20 GKED COc1ccccc1COc1cccc(NC(=O)c2cccc(C#N)c2C)c1C 509298107 JNTKGEGJGZMPFA-UHFFFAOYSA-N 386.451 5.015 30 20 GKED N#Cc1cccc(F)c1CC(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 511465131 RCCNDUYDWVUDHN-LJQANCHMSA-N 390.380 5.012 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](c2ccccc2)[C@H](C)CC)cc1 511747982 FPONHJUGJOVZGV-XXBNENTESA-N 390.527 5.269 30 20 GKED CCN(CC)c1nc2sc(C(=O)Nc3sc(C)c(C)c3C#N)cc2s1 512374981 JTTPDWWNZFILFG-UHFFFAOYSA-N 390.559 5.006 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4sccc4s3)n2)cc1 517305687 DSXLFWILLMSVLI-ZDUSSCGKSA-N 380.519 5.885 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517656583 KSRAVGDLFMPJMV-KRWDZBQOSA-N 388.442 5.517 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1 517684645 QPXVXIQAERAJMP-FQEVSTJZSA-N 395.459 5.069 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1C 518907274 VNILNWQODUBZAX-HSZRJFAPSA-N 376.500 5.088 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(C)(C)C)cc1 519451330 ZBYKYAGWPKWOBM-INIZCTEOSA-N 381.545 5.558 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@@H](c2ccccc2)c2ccccc2C)n1 521098480 UXIAYFVOKLHVDR-NRFANRHFSA-N 388.492 5.320 30 20 GKED Cc1ccnc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 524508043 ZPGLKAGJGFVOMJ-UHFFFAOYSA-N 390.446 5.243 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)c1ccccc1C(F)(F)F 525575358 YAIYALLPKQQGOV-SJCJKPOMSA-N 380.797 5.233 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 531456537 GDXOEKMOUNTSAO-IFMALSPDSA-N 377.488 5.086 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc(-c3cccnc3)s2)cc1 534874432 BBKXGXVGPYEDNO-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC=C(C(F)(F)F)CC2)cc1 536058303 XMWSRICDEITOPU-UHFFFAOYSA-N 387.361 5.077 30 20 GKED N#CC1(CCCNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCOCC1 537508181 AGRWCHDPYMVMBW-UHFFFAOYSA-N 380.332 5.237 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CC2(C(F)(F)F)CC2)cc1 553934772 UNHVWEJZRXHQJF-UHFFFAOYSA-N 390.361 5.030 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ocnc3C3CC3)cc2Cl)cc1 564077281 RICQNSQQQVFIIY-UHFFFAOYSA-N 379.803 5.122 30 20 GKED N#Cc1c(NC(=O)CCN2[C@H]3CC[C@H]2c2ccccc23)sc2c1CCCCC2 572374493 VZGDXEFXBCJKPL-PMACEKPBSA-N 391.540 5.109 30 20 GKED CC(C)SCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 583162321 XMROSPVHTHLUCD-SFHVURJKSA-N 387.936 5.259 30 20 GKED N#CCCCCCC(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 588630192 YLVSQRAPEGEIOP-UHFFFAOYSA-N 398.894 5.074 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(OC2CCC2)cc1 596306568 GIJMMYNKKBGEGS-INIZCTEOSA-N 396.512 5.030 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N3CCC[C@@H](CC#N)C3)o2)cc1 597916339 MBUOJGJQLYGNEB-SFHVURJKSA-N 385.467 5.083 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cscc3C(F)(F)F)c(C#N)c2[C@@H]1C 598839443 RITORFLKFQQSCQ-DTWKUNHWSA-N 384.448 5.638 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3c[nH]cc3-c3ccccc3)c2)c1 603891735 QHUVNNYJYPSXDJ-UHFFFAOYSA-N 393.446 5.385 30 20 GKED N#CCn1c(C(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc2ccccc21 609167229 YJSSUYWBCQLMJE-HSZRJFAPSA-N 379.463 5.295 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N(C)Cc1ccc(C#N)cc1 609936553 LMPXTADHBXKBBM-OAQYLSRUSA-N 389.524 5.054 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)C1 612295211 QHWAYPCZFQZFTM-JOCHJYFZSA-N 390.512 5.045 30 20 GKED N#C[C@H]1CCC[C@@H](N[C@H](CC(F)(F)F)c2ccc(Br)cc2)C1 618578487 AOYJFTQZYOQXCJ-NILFDRSVSA-N 375.232 5.115 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 619726854 UYRARAIHJMUVNJ-USWWRNFRSA-N 391.302 5.412 30 20 GKED CC[C@H](C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 680851060 LIWADBTWILFQJI-MXYBEHONSA-N 399.350 5.345 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(OCc3ccc(F)cc3)cc2)ccc1O 727685184 CNWHFAPBIPTGDU-QCDXTXTGSA-N 378.399 5.015 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)c1 727981594 OUBZKXRCUSVABZ-SFHVURJKSA-N 386.520 5.925 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc(Cl)nc3)c2)cc1 729158034 IDNGRELJBFUBNE-UHFFFAOYSA-N 380.860 5.208 30 20 GKED Cc1c(O)ccc2c(CNc3cccc(Oc4ccc(C#N)cc4)c3)cc(=O)oc12 729676574 OJFVYXPXGYBVFT-UHFFFAOYSA-N 398.418 5.083 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)/C=C\c1ccccc1O[C@H](C)CC 729827614 QAZWIUOAMWISDI-OAXWQBPPSA-N 399.494 5.013 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](Oc2ccc(Cl)cc2C)c2ccccc2)n1 730395789 XZAOFQVXXVIMMO-FXAWDEMLSA-N 396.899 5.410 30 20 GKED COc1ccc(C=NNc2nc(Cl)c(Cl)cc2Cl)c(Cl)c1OC 730430070 BQQCDJSTZFGZGB-UHFFFAOYSA-N 395.073 5.158 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1cnn(-c2cccc(Cl)c2)c1C 731559218 VFLJZFFYEHHJHY-UHFFFAOYSA-N 393.800 5.084 30 20 GKED N#C[C@@H](NC(=O)Cc1cc(Cl)ccc1Cl)c1ccc(Cl)c(Cl)c1 731646028 WECOHHJVAIUATG-OAHLLOKOSA-N 388.081 5.224 30 20 GKED C=CC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1ccncc1 734457540 LHRJYTSWGGNDOH-GVAUOCQISA-N 398.506 5.198 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CSc3cc(Cl)ccc3Cl)[nH]c12 735792793 OARTTYBUHCCZFP-LBPRGKRZSA-N 390.295 5.147 30 20 GKED CCCCc1nc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)no1 742262084 VBWOHNUFQLUZEB-UHFFFAOYSA-N 396.878 5.128 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@]23CCc2ccccc23)cc1 743312720 UPVXVBXFWIXWTA-CWDLOFLHSA-N 378.475 5.185 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745989874 DYHOYPLKZKRYFU-SEYXRHQNSA-N 393.490 5.506 30 20 GKED CCCN(CC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)[C@H](CC)c1ccccc1 746144529 APYTXYJYJABLGA-RBBKRZOGSA-N 398.510 5.087 30 20 GKED N#CCOc1cc(F)ccc1NC(=S)Nc1ccc(Oc2ccccc2)cc1 760281216 FPPNGCRILCVEDS-UHFFFAOYSA-N 393.443 5.329 30 20 GKED N#Cc1cc(NC(=O)CCCc2csc3ccccc23)c(Cl)c([N+](=O)[O-])c1 764312859 WJENWMCYTSBEIH-UHFFFAOYSA-N 399.859 5.296 30 20 GKED CCCC(=CC(=O)[C@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)CCC 771259037 PVSHBYMYCUNZTL-INIZCTEOSA-N 380.460 5.175 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)C[C@H](CC)c2ccccc2)c1 773295949 YXIPJAWREBXTGD-UNMCSNQZSA-N 393.531 5.093 30 20 GKED Cc1cccc(COc2ccc(CN[C@@H](C)c3ccc(OCC#N)cc3)cc2)c1 776154115 NHLKFXLUZHTBLE-FQEVSTJZSA-N 386.495 5.327 30 20 GKED N#Cc1cc(NC(=S)Nc2ccc(Cl)nc2)ccc1Oc1ccccc1 777476361 KQVBPDCHNKIESX-UHFFFAOYSA-N 380.860 5.208 30 20 GKED CCOc1ccccc1[C@H](CC(C)C)NC(=O)Nc1ccccc1O[C@H](C)C#N 780682733 XJOSFFXRMACVPI-XLIONFOSSA-N 395.503 5.285 30 20 GKED C[C@@H](Nc1ccc(N2CCSCC2)c(Cl)c1)c1ccc(C#N)cc1F 781420248 AJONAZPCDOFNEG-CYBMUJFWSA-N 375.900 5.077 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3cnc4ccccc4n3)c2cc1C(C)C 792115241 VQSCSBCXNTWTJH-IBGZPJMESA-N 383.451 5.227 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@@H](CC#N)c2ccccc2)c1 793479977 VYDUYQLEVNMALB-OAQYLSRUSA-N 384.504 5.350 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(CC[C@H](O)c2ccccc2)c1)c1ccccc1 793629851 SQLBSZJXGPXXAV-NOZRDPDXSA-N 398.506 5.379 30 20 GKED CCC(CC)[C@H](c1ccc(Cl)cc1)N(C)C(=S)Nc1ccccc1C#N 794998183 DMVCHVRISHFIIR-HXUWFJFHSA-N 385.964 6.018 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 796813757 ZLENBKJWQWFYGF-ZNMIVQPWSA-N 386.398 5.295 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)c1 797087764 JAWFVAKHXJRWBK-JOCHJYFZSA-N 390.870 5.130 30 20 GKED C/C(C=Nn1cnc2sc(C)c(C)c2c1=O)=C/c1cccc(C(F)(F)F)c1 807949177 XGYBWEPSMVVDDG-KILGHTHOSA-N 391.418 5.031 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)N(Cc1ccco1)c1ccccc1C#N 808161652 WXBWQMGZIGTGTB-UHFFFAOYSA-N 386.238 5.009 30 20 GKED N#CCCC[C@H](NC(=S)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1 814209804 GCPJASLWEQEQDK-KRWDZBQOSA-N 393.434 5.307 30 20 GKED CCN(c1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1)C(C)C 814310358 SYSYAYKACRNTRN-JOCHJYFZSA-N 378.520 5.478 30 20 GKED CC(=NNc1nccc2sccc12)c1sc(Cc2ccccc2)nc1C 814808571 BZSRFQMRVSYTTH-UHFFFAOYSA-N 378.526 5.488 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)OCC[C@@H](c3ccccc3)C(F)(F)F)CC2)c1 816476664 FVPFLOWBCKVPKJ-SFHVURJKSA-N 391.364 5.008 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2csnc2-c2ccccc2)cc1OC 821629288 GDYDSMZDGMBYEB-BENRWUELSA-N 392.480 5.035 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccccc3CCC(F)(F)F)CCCC2)cc1 859999115 JGWZAIYRVZGJSE-UHFFFAOYSA-N 386.417 5.504 30 20 GKED Cc1c(COC(C)(C)C)cccc1NCc1cc(C#N)ccc1Br 864017185 XEGBHVNLQZVZRC-UHFFFAOYSA-N 387.321 5.556 30 20 GKED COc1cc2ccc(C(=O)N(O)Cc3cccc4ccccc34)cc2cc1OC 901371396 TUWUOQKZBHQHSE-UHFFFAOYSA-N 387.435 5.042 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@@H](C#N)c3nc4ccccc4s3)cs2)cc1 915099414 UWSDQYJNXSSZGV-MRXNPFEDSA-N 389.505 5.147 30 20 GKED N#C[C@@H](C(=O)CCc1ccc2ccccc2c1)c1nc2cc(Cl)ccc2s1 917430655 RCPIYCSLWCFWKF-SFHVURJKSA-N 390.895 5.912 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1Cl 929084784 KRYVTZVIZIXTPB-UHFFFAOYSA-N 384.826 5.074 30 20 GKED O=C(O)c1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c(Cl)c1 1776126141 CZFXNEOZVIONLB-RAXLEYEMSA-N 378.811 5.727 30 20 GKED CCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776127817 GKPCLEYZSQUYJO-QBFSEMIESA-N 378.449 5.408 30 20 GKED C=CCc1cc(C)c(OCCCN(CCCC(=O)O)Cc2ccccc2)cc1C 1776188996 UCOXVAGEKVRMCL-UHFFFAOYSA-N 395.543 5.168 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC)c(OCCCC)c1 1776783955 NKELCJRFRLWJQT-LJQANCHMSA-N 379.541 5.168 30 20 GKED CCCCCCCOc1ccc(CNc2ccc([C@H](C)CC(=O)O)cc2)cc1 1776789081 OSJMDUONBFKIHS-LJQANCHMSA-N 383.532 6.226 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1C 1777275167 CTTNIHUTIHRFRX-MLPAPPSSSA-N 386.447 5.573 30 20 GKED Cc1ccc(-c2ncc(/C=C3\CCCc4cc(C(=O)O)ccc4C3=O)s2)cc1 1777431428 HZAWCFFWWBYDSU-SFQUDFHCSA-N 389.476 5.419 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCOc4cc(F)ccc4C3=O)s2)cc1 1777671014 RUBVJYJLKHTFCP-PTNGSMBKSA-N 394.423 5.301 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(Br)c3ccccc3c2)c1 1777684884 MQFQTNWOSFSFQL-CMDGGOBGSA-N 381.225 5.197 30 20 GKED N#Cc1ccc(CCC(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc1 10411051 BOZMMUFDXMHHFY-UHFFFAOYSA-N 389.452 5.054 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)N(c1ccccc1)c1nc2ccccc2s1 21907836 RFMXJWHEKMCTMT-MRXNPFEDSA-N 399.475 5.300 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(Cl)c1)c1nc2ccccc2n1C(F)F 41559024 ZCHBPIPNHDDYRX-SNVBAGLBSA-N 380.181 5.228 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NC(=O)c1cccs1)c1ccc2ccccc2n1 48856201 WCCFIHZLTDHKIY-QGZVFWFLSA-N 397.459 5.039 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)c(C)c(C)c2C)=C(/S)NC(C)(C)C)cc1 55014155 DHOFRGSHAMGSTD-UHFFFAOYSA-O 397.608 5.097 30 20 GKED CC(=O)c1cccc(OCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66800313 PCNFOOKEYROVJX-MRXNPFEDSA-N 396.512 5.081 30 20 GKED CCN(C[C@H]1CCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 69032059 VJIMIGCVKOBTEQ-UYAOXDASSA-N 397.906 5.028 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 71873634 SSUJYUKNCJMICW-UHFFFAOYSA-N 376.525 5.184 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 131337961 WXUXOIICEDVZCY-KSSFIOAISA-N 375.394 5.111 30 20 GKED Cc1cc(-c2noc(CNc3ccccc3S[C@@H](C)CC#N)n2)ccc1F 157834209 YKCVBFKZDDJCDJ-AWEZNQCLSA-N 382.464 5.191 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-n2cc[nH]c2=S)cc1 170999613 LPSMLFFVPGLFCT-AWEZNQCLSA-N 394.525 5.181 30 20 GKED N#C[C@H](C(=O)[C@@H]1SCCc2ccccc21)c1nc2cc(Cl)ccc2s1 174002472 AQDKPRWKOUBMDP-RDTXWAMCSA-N 384.913 5.157 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1[N+](=O)[O-] 176989830 GUXULERBJBYNML-HIFRSBDPSA-N 398.488 5.038 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccc(O[C@@H](C)C#N)cc1 237499891 DNBWTSFMWQHVRH-HOTGVXAUSA-N 377.513 5.260 30 20 GKED Cc1ccc(-c2csc(NC(=O)CSCc3ccc(C#N)cc3)n2)c(C)c1 302932279 HEDDAHXHZXKABO-UHFFFAOYSA-N 393.537 5.171 30 20 GKED Cc1cccc(Cc2cnc(N=C(O)[C@H]3CCC(=O)[C@@H](C)C3)s2)c1Cl 328942344 UAXIVVFNMNYIPV-JSGCOSHPSA-N 376.909 5.289 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(O)ccc2Cl)cc1Cl 432004883 CXVIXPJWMPERHQ-GOSISDBHSA-N 397.261 5.607 30 20 GKED CC(C)Oc1nnc(SCCC(C#N)(c2ccccc2)c2ccccc2)s1 434651389 WAZJAOJFOPSKFZ-UHFFFAOYSA-N 395.553 5.317 30 20 GKED CCC[C@H]1[C@H](C)CCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 437535871 MBQGVHIKXWDQHB-BEFAXECRSA-N 382.533 5.038 30 20 GKED COc1ccccc1[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 438864155 NXDPATYIDRLYJQ-UPVQGACJSA-N 399.494 5.129 30 20 GKED CN1CCC[C@@H](CNC2CCC(C)(C#N)CC2)[C@H]1c1ccc(C(F)(F)F)cc1 449153739 FUTPSPPMKHCSBS-RCKXYERXSA-N 393.497 5.150 30 20 GKED C[C@H](N[C@@H]1CCC[C@@H](C#N)C1)c1nc(-c2ccc(Br)cc2)cs1 463241096 CBEZVUZTGDRONG-WOSRLPQWSA-N 390.350 5.306 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 467342751 KXSBNZDJEPGFGT-MRXNPFEDSA-N 380.463 5.024 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 467750399 YMCBHTZUQQFLPX-GZMMTYOYSA-N 386.336 5.645 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 470394770 SPZVJGYDXSUGDB-GOSISDBHSA-N 396.556 5.293 30 20 GKED CCC(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 471209484 AWYRYXRNEAUPPU-UHFFFAOYSA-N 386.476 5.230 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C(F)(F)F)ccc1C 473077194 VNIPRXQNATYKIW-UHFFFAOYSA-N 393.365 5.142 30 20 GKED CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H](c1ccc(C)cc1)c1cccnc1 475908602 WTQRNWLFBNAIDL-DEOSSOPVSA-N 397.522 5.443 30 20 GKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 476662590 FKYQMQBKJIQBKQ-KBMIEXCESA-N 393.490 5.490 30 20 GKED C=C(C)[C@@H](NCc1nc(-c2cccc(Cl)c2)no1)c1ccc(F)c(F)c1 481606310 QPFLRWMDCDANCY-GOSISDBHSA-N 375.806 5.075 30 20 GKED N#C[C@@H](C(=O)c1ccccc1C(=O)c1cccs1)c1nccc2ccccc12 483206444 UVYFUKOJFLZBCI-LJQANCHMSA-N 382.444 5.017 30 20 GKED Cc1c(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)sc2ccc(C#N)cc12 490899154 CLQCZDKRWGNKQF-UHFFFAOYSA-N 382.395 5.148 30 20 GKED N#Cc1ccc(SCc2nc3cc(Cl)ccc3n2Cc2ccccc2)nc1 498143209 BXOBMJVAXOASGX-UHFFFAOYSA-N 390.899 5.297 30 20 GKED CN(CC(F)(F)F)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 503158527 MSPWZEDFRBVINN-UHFFFAOYSA-N 383.757 5.030 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)s1 510748742 KPEVMUYIIYNPSA-MRXNPFEDSA-N 397.887 5.342 30 20 GKED COc1ccc2oc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c(C)c2c1 515539116 KPGHWIIDORSASY-CQSZACIVSA-N 396.855 5.503 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1csc(-c2cccs2)n1 518660857 DBZXYRIDMAVUTG-CYBMUJFWSA-N 399.566 5.305 30 20 GKED N#Cc1c(NC(=O)CCCOc2cccc(Cl)c2Cl)sc2c1CCC2 519070662 VDGKQKJAUWTYNE-UHFFFAOYSA-N 395.311 5.213 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(Cl)c3Cl)cc2)cc1 519977330 CJAGIJMMAWFZEE-UHFFFAOYSA-N 383.234 5.910 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)cs2)c(C)c1 520809601 CIZJKAMHOSWOHF-UHFFFAOYSA-N 378.501 5.107 30 20 GKED CCOc1ccc(OC(C)(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 520837300 QEWDIAOUNRYYDY-INIZCTEOSA-N 398.528 5.133 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc3ncccc3c2)cc1 521605929 FGSZQLPWUBTVRW-UHFFFAOYSA-N 383.382 5.290 30 20 GKED Cc1ccc2cccc(C(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)c2n1 525454096 LAMSDWXUPDEKQQ-UHFFFAOYSA-N 393.446 5.246 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2c1 525563609 AGJRKNFVBTWDLL-OAHLLOKOSA-N 391.496 5.198 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@H]1COc2ccccc21 533630719 WPCHFDVWMGPRJM-KSFYIVLOSA-N 399.450 5.037 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(COc2ccccc2)cc1)c1ccccc1 536925408 PBTUHTOISKVOKY-QHCPKHFHSA-N 385.467 5.432 30 20 GKED C[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1Oc1ccccc1 540353265 DRCDJSZLZGXXEM-QGZVFWFLSA-N 396.450 5.251 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(Oc4ccncc4)c(Cl)c3)cc2)CC1 540732209 DHWYDKQEGXNLQP-UHFFFAOYSA-N 389.842 5.335 30 20 GKED CSC[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 540992043 QFISRUOIMLEAKF-OALUTQOASA-N 378.463 5.744 30 20 GKED CSc1cccc([C@H](NCc2ccc(CC#N)cc2)c2ccc(F)c(F)c2)c1 544083564 LVPBGDQBVXHSIE-QHCPKHFHSA-N 394.490 5.632 30 20 GKED COc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)c(Br)c1 565882748 FZZUWZGMKJHWCD-YWZLYKJASA-N 387.321 5.543 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCc3c([nH]c4c(F)cccc34)C2)cc1 567182173 WLQPWVHAZCMDJR-UHFFFAOYSA-N 390.462 5.088 30 20 GKED Cc1sc(CNc2ccc(C#N)c([N+](=O)[O-])c2)nc1-c1ccc(Cl)cc1 576629613 KRSSWTJRYGPHJX-UHFFFAOYSA-N 384.848 5.164 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N2CCC(CCC#N)CC2)cc1 578744067 ZYEKCLGLCTXSPL-SFHVURJKSA-N 391.515 5.149 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc2nc(C(C)C)sc2c1 580229949 VVSIKSIBNVTYEM-UHFFFAOYSA-N 399.516 5.115 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCc1nsc2ccccc12 596735576 OPUKIELRTZTVTF-AWEZNQCLSA-N 396.541 5.055 30 20 GKED CCCN(C(=O)c1ccc([C@H]2CCCOC2)cc1)c1cc(Cl)ccc1C#N 598808037 CBURTPMLSDYUDI-IBGZPJMESA-N 382.891 5.162 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)cn2)cc1 604510945 SSSKXUVCDNGQQE-VQTJNVASSA-N 389.842 5.141 30 20 GKED CCC(CC)CN(CCC#N)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 609186989 LEWLCIARRHPZTB-UHFFFAOYSA-N 383.561 5.148 30 20 GKED CCCN(C(=O)c1cnc(-c2ccccc2)s1)c1cc(Cl)ccc1C#N 609286557 YHUUQZKYGCUPSA-UHFFFAOYSA-N 381.888 5.392 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCCc3cccc(F)c32)cc1 609297275 AGLZVKHCSRBDDF-UHFFFAOYSA-N 390.389 5.222 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1CC(F)(F)F 609430764 WZGIMMRNKZOFOW-CYBMUJFWSA-N 395.450 5.314 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCc3cc(OCc4ccccc4)ccc32)cc1 609645628 NINQXXKFTAMYTD-UHFFFAOYSA-N 396.490 5.049 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N(C)Cc1ccc(C#N)cc1 609936552 LMPXTADHBXKBBM-NRFANRHFSA-N 389.524 5.054 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(COC(C)(C)C)cc1 610632480 BBNVIABDIPQJDM-MRXNPFEDSA-N 397.544 6.040 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1nc(-c3ccccc3)oc1-c1ccccc1)CC2 611139247 HLVPIBPWAZNULZ-UHFFFAOYSA-N 391.430 5.083 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@H]1CCc2cc(C#N)ccc21 618804846 MNIFIPXJBZZGKT-XCLFUZPHSA-N 377.488 5.467 30 20 GKED C=CCn1c(S[C@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccc(OC)cc1 619864021 ZOYDEAQVNDYPBR-GOSISDBHSA-N 396.903 5.150 30 20 GKED C[C@@H](c1ccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)cc1)C(F)(F)F 622308638 NIBXSKWMPAUWFR-JTQLQIEISA-N 393.302 5.440 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 662087676 HQJGKBXERIQNJK-KDURUIRLSA-N 387.936 5.164 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@H](c2nc3ccccc3o2)C1)c1ccccc1 676423300 NOVBZANQDASAJV-WOJBJXKFSA-N 389.499 5.424 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(-c2ccc(F)cc2)s1 728698053 BTWZAMMASCPRRO-YVMONPNESA-N 380.366 5.209 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](c3ccccc3F)C2)cc1 730665185 STUGXORDMSLZEH-NFBKMPQASA-N 399.469 5.503 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2ccc(C3SCCS3)cc2)cc1 731199417 XYZLHEHGGDHZQD-IBGZPJMESA-N 396.581 5.457 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)OCc1ccc(OCC#N)cc1 733455408 CEUGSIYWAITPOJ-LBPRGKRZSA-N 396.295 5.120 30 20 GKED CC[C@H](CC1CCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 734082463 BURHIVJSBUDDKF-VQIMIIECSA-N 382.529 5.601 30 20 GKED C=CC[C@H](NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccncc1 734459053 FGTORYCOLQZBGF-QFIPXVFZSA-N 392.886 5.361 30 20 GKED N#CCOc1cccc(NC(=O)N(Cc2ccc(F)cc2)C2CCCCC2)c1 735862343 NXQXBTMOEHKVMN-UHFFFAOYSA-N 381.451 5.095 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 743204060 VSMRYVFUGTYQEZ-CYBMUJFWSA-N 394.368 5.081 30 20 GKED Cc1cccc2c(CCC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c12 744034550 BEDVWCDTDQNYMA-INIZCTEOSA-N 393.899 5.549 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2cccc3ccccc23)cc1 746658899 HUZDRPGOCYJCSK-VWLOTQADSA-N 391.474 5.817 30 20 GKED C[C@H](C(=O)[C@@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc2ccccc2c1 753392421 BAKQIIHTOVZGAU-SCLBCKFNSA-N 394.833 5.083 30 20 GKED O=C1/C(=C/c2nc(Cl)cs2)CC[C@H](C2CC2)/C1=C\c1nc(Cl)cs1 759083224 IJWVBGGNNZEJRF-FRONEAOUSA-N 397.352 5.763 30 20 GKED COc1ccc(/C=C2/CCOc3c(C)cc(C)cc3C2=O)cc1OCCCC#N 763116720 MLADTXYFDDUMEF-RGEXLXHISA-N 391.467 5.043 30 20 GKED O=C(/C=C/c1cncc2ccccc12)c1ccc(OC[C@H]2CCCCO2)c(F)c1 772803679 WGASEUODWVJAMZ-CSNYQSHPSA-N 391.442 5.218 30 20 GKED C[C@@H](N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1ccc(OCC#N)cc1 772961099 XPEVWWONIQDESN-SJKOYZFVSA-N 377.271 5.070 30 20 GKED CCCCC[C@H](NCC1=CC(=O)n2c(nc3ccccc32)[C@@H]1C#N)c1ccccc1 775318107 SQQJIQZSNAPVQP-RTWAWAEBSA-N 398.510 5.135 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779071766 DYKAPZAYQPGORR-QVKFZJNVSA-N 377.488 5.243 30 20 GKED N#CCOc1ccc(CC(=O)Nc2cccc(-c3cccc(Cl)c3)c2)cc1 791206948 KNAVLQJGHBBCDE-UHFFFAOYSA-N 376.843 5.091 30 20 GKED CCSc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3OC)nc2)cc1 792883823 BAZSQFIKCJNDGT-JYRVWZFOSA-N 376.481 5.160 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570107 DGBHIAKGHAVQIM-DOMZBBRYSA-N 376.522 5.184 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801894820 BKVUKUFXAUUIKU-QGZVFWFLSA-N 379.353 5.261 30 20 GKED O=C(/C=C\c1cncc(F)c1)O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809127762 LAHNFCSFLQKNDT-ALLUHVBJSA-N 393.258 5.100 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(SC)ccc2Cl)c1 824478972 PXDJKEZNOYNLEJ-CQSZACIVSA-N 389.908 5.065 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c2C#N)CC[C@H]1C 839391391 YOJWHIUSOIVLPR-SFYZADRCSA-N 398.290 5.399 30 20 GKED C[C@]1(CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@]1(F)Cl 844816308 LCAQSQJHPLTXAW-VQTJNVASSA-N 388.895 5.144 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2occc2-c2ccccc2)cc1 915086335 TYIXEEUPPCDDQO-QHCPKHFHSA-N 378.431 5.854 30 20 GKED C/C(C=Nn1c(C)nc2scc(-c3ccccc3)c2c1=O)=C/c1ccccc1 916310358 XYTARSCLPBSBAK-HEVZOGSJSA-N 385.492 5.371 30 20 GKED N#C[C@@H](C(=O)COc1ccc2oc3c(c2c1)CCCC3)c1ccc2ccccc2n1 916849120 SBNMDQUJKPVNLH-HXUWFJFHSA-N 396.446 5.115 30 20 GKED N#C[C@H](C(=O)Cc1csc2ccccc12)c1nc2ccccc2n1C(F)F 917041228 RIBJOXVFUVTCKK-CQSZACIVSA-N 381.407 5.065 30 20 GKED N#C[C@H](C(=O)CCc1ccc2ccccc2c1)C(=O)Nc1cccc2ccccc12 917426800 QJOBDQSQXYVWAA-HSZRJFAPSA-N 392.458 5.273 30 20 GKED O=C(/C=C/c1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605567 WUCWZXJIRXDYKU-JXMROGBWSA-N 380.381 5.128 30 20 GKED O=C(O)Cc1ccc(NN=Cc2ccccc2Oc2ccc(F)c(Cl)c2)cc1 1776085766 JLLACUPHWXFUSB-UHFFFAOYSA-N 398.821 5.345 30 20 GKED CC1(C)CCc2cc(/C=C3\CCCc4cc(C(=O)O)ccc4C3=O)ccc2O1 1776558145 OVIVAYZNAJPAKN-QGOAFFKASA-N 376.452 5.091 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2cccc(C(=O)O)c2)cc1 1776785599 QIADXHZGVNEHCI-SSZFMOIBSA-N 380.484 6.020 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)c2c[nH]c3ccccc23)cc1 1776788037 NLBGWJCKYJGYCR-QHCPKHFHSA-N 394.515 5.433 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777455810 BSKMAUDBFDUWMD-PGECNJAHSA-N 382.459 5.673 30 20 GKED O=C(/C=C\c1cc2cc(F)ccc2o1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569345 GSDNFLOOIHUYBP-SREVYHEPSA-N 376.339 5.426 30 20 GKED O=C(/C=C/c1ccc(Cl)cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570057 IYHNXWVFFZFRKI-SOFGYWHQSA-N 387.218 5.848 30 20 GKED C=CCN(CC(=O)Nc1cc(Cl)c(Cl)cc1Cl)Cc1cccs1 19540388 PCQDKKCSCVHZFA-UHFFFAOYSA-N 389.735 5.335 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc1 30612193 DJKRGSXXDKSXKC-UHFFFAOYSA-N 376.481 5.191 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(COc3ccc4ccccc4c3)o2)n1 47358478 OGXUOIQGVHGTNK-IBGZPJMESA-N 388.448 5.267 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)[C@H](C#N)c3ccccn3)o2)cc1 69952356 NDXMRNTYIXKCGA-HXUWFJFHSA-N 379.419 5.202 30 20 GKED Cc1cccc(COc2ccc(NC(=O)c3ccccc3OCC#N)c(C)c2)c1 105582019 NKHXEGJXPWDBLN-UHFFFAOYSA-N 386.451 5.037 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1)c1ccccn1 106983700 ZDRSKPZCOAMHQI-CQSZACIVSA-N 388.370 5.199 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(F)c(F)c1 108409216 RULHOOCOQFVVGL-CYBMUJFWSA-N 392.496 5.231 30 20 GKED CCCN(C(=O)c1ccc(C#N)cc1C)[C@H](c1ccc(F)cc1)c1cccnc1 121722409 ZWQBGJHBGLWTKW-HSZRJFAPSA-N 387.458 5.043 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1OCCCC#N 125564594 OMBCWTFOXJIYSN-VQHVLOKHSA-N 398.462 5.336 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2cccc(F)c2)c2nccn2C)cc1 128558714 JNQRSSQPGWLEQQ-IERDGZPVSA-N 399.897 5.131 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)CC(F)F 130047636 JGYFUODSIXDEEL-OAHLLOKOSA-N 389.471 5.238 30 20 GKED C[C@H](Sc1cccc(C#N)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 158740325 UCHWIMDSPBZOSU-JTQLQIEISA-N 376.268 5.768 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3ccccc3F)n2)cc1 170673815 OEHZTLKGCFCVIM-KBXCAEBGSA-N 394.471 5.328 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 173980822 OVQWJLLLTNWDBI-SJORKVTESA-N 387.458 5.361 30 20 GKED CC[C@@H](Cc1ccccc1Br)C(=O)[C@@H](C#N)c1nc2ccccc2o1 177137080 ZVEKWUOEGGIDFR-DZGCQCFKSA-N 397.272 5.035 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 181428295 VHSBSERVDDANDM-CQSZACIVSA-N 393.855 5.403 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 181571649 DQMVCELKPBMSQL-YWZLYKJASA-N 379.504 5.953 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccc(F)cc2)c1C 189910421 OAQCIRJCTZZIMN-UHFFFAOYSA-N 377.463 5.424 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccccc1NC(=O)c1cccc(C)c1 216651368 DTTHOOCDXSYZSG-UHFFFAOYSA-N 390.508 5.137 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cs1)C1CC1 255302863 RMFGTNSRJJXOST-KAMYIIQDSA-N 388.492 5.222 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cc(F)ccc2Oc2ccccc2)cc1 303138825 CMZGHHOKZLRKKN-UHFFFAOYSA-N 378.428 5.220 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 303291335 KSZLENQDYMPNPJ-KRWDZBQOSA-N 377.513 5.269 30 20 GKED O/C(=N/C1CCC2(CCOCC2)CC1)c1cc(-c2ccccn2)ccc1Cl 328741408 IYPPTMXUJCASRB-UHFFFAOYSA-N 384.907 5.446 30 20 GKED N#CCCCn1cc(C(=O)N[C@H](CC(F)F)c2ccccc2)c2ccccc21 422028537 SLCOWZPBGXBFMB-LJQANCHMSA-N 381.426 5.071 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 429077260 PDBQDZYZVIYFSU-UHFFFAOYSA-N 385.430 5.286 30 20 GKED N#Cc1ccc(NC(=O)c2sc(C3CC3)nc2-c2ccccc2)c(Cl)c1 430369769 KFEZIMGDIFKHMZ-UHFFFAOYSA-N 379.872 5.465 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(F)c(O)c(Cl)c2)cc1 436931967 LWTLDKCYFCILRX-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C[C@H](S[C@H](C)c1ccc(C#N)cc1)c1nc(Cc2ccc(Cl)cc2)no1 437274479 ICLJKZYGLDQBEZ-KGLIPLIRSA-N 383.904 5.741 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 440615796 CNGMVKWYJBKBEY-OAHLLOKOSA-N 386.492 5.093 30 20 GKED CC(C)Nc1ccc(F)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444291290 QARRSDBPWPBZJD-UHFFFAOYSA-N 378.451 5.157 30 20 GKED C[C@@]1(Cc2ccccc2)CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458796633 FBBQTLSEKBPNSF-VWNXMTODSA-N 375.516 5.228 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1cc(C(F)(F)F)ccn1 464468861 QZJDTNQCCMJLHV-LBPRGKRZSA-N 392.686 5.263 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 473860394 YKQPCEDIKOJMRP-UHFFFAOYSA-N 386.329 5.278 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474690328 CXQDBLMWABKIJO-PBHICJAKSA-N 375.299 5.600 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccccc1 475167786 DDJGUWJMFUWZDY-GCJKJVERSA-N 394.927 5.695 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(COC2CCOCC2)c1 476171045 YLZDWSPSHFXNKK-UHFFFAOYSA-N 393.527 5.486 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C[C@H](CC#N)c2ccccc2)c1C 476248819 MOTZELFLEMYYRR-FQEVSTJZSA-N 378.516 5.726 30 20 GKED C=C(C)[C@H](N[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)c(F)c1 481604920 MZKQEUNHZYCZDR-KUHUBIRLSA-N 392.877 5.469 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)cc1 481616947 ZKVFXPDXYYDCLQ-QGZVFWFLSA-N 379.479 5.428 30 20 GKED C[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 481915152 BRYMAPOZMZMESL-NIYFSFCBSA-N 397.522 5.651 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1 483070249 GAGNWMLNVRDYKZ-UHFFFAOYSA-N 383.423 5.142 30 20 GKED Cn1c(SCc2ccc(F)cc2C#N)nnc1-c1ccc(C(C)(C)C)cc1 483128517 GQERGSQGNFRJEX-UHFFFAOYSA-N 380.492 5.083 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C#N)cc2Cl)cnn1-c1ccccc1Cl 485716536 FLJKPSATCOLZBL-UHFFFAOYSA-N 399.281 5.426 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C)c1ccccc1 488709304 BOOOXLVBNBWWDR-XMSQKQJNSA-N 390.527 5.166 30 20 GKED CCN(C(=O)COc1ccccc1-c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 509607608 IALUCERFTLNYCM-IBGZPJMESA-N 384.479 5.214 30 20 GKED Cc1ccc(Cl)cc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 510628643 PLCURJVDBMNMRT-UHFFFAOYSA-N 390.870 5.546 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1csc(-c2ccccc2OC)n1 512506205 IJXFSQJIXAWVMP-UHFFFAOYSA-N 396.560 5.174 30 20 GKED N#CC1(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)CCCCC1 512988254 HPZWXFGCYIGVOF-UHFFFAOYSA-N 386.329 5.591 30 20 GKED CCc1nc2ccccc2c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1C 514607660 YPUQEISKJBWTGC-UHFFFAOYSA-N 398.491 5.353 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3)on2)sc2c1CCCCCC2 515676268 ALFPKTGQHNWKGM-UHFFFAOYSA-N 377.469 5.186 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2ccc(F)cc2F)cc1 517307456 XBHHJBCYJNMDQX-UHFFFAOYSA-N 394.446 5.059 30 20 GKED CCOC(=O)c1oc2ccccc2c1CNc1ccccc1SC[C@@H](C)C#N 518660011 CWQACBUTGJTGBB-HNNXBMFYSA-N 394.496 5.473 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)CCCC2)c1nc(-c2c(F)cccc2F)cs1 521260572 FQGOEXCAIQXQGP-MRXNPFEDSA-N 394.446 5.457 30 20 GKED CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 521957759 WKPWYVJEMCPZGE-UHFFFAOYSA-N 399.450 5.064 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1cccc(-c2nc(C)cs2)c1 522094337 RUFODNBLCRLOCP-UHFFFAOYSA-N 379.485 5.005 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H]2CSc3ccccc32)cc1 524560206 YRYFDGNXRIYGJH-IBGZPJMESA-N 387.464 5.319 30 20 GKED C[C@@H](Nc1ccc2oc3ccccc3c2c1)C(=O)N(CCC#N)c1ccccc1 525761554 AUFWSHSWZGNRPM-QGZVFWFLSA-N 383.451 5.333 30 20 GKED CC1CC(C#N)(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)C1 532327929 ARELOWRDKCYSNA-UHFFFAOYSA-N 375.403 5.045 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 534976348 QAXHCAFVFHWEIZ-UHFFFAOYSA-N 384.332 5.460 30 20 GKED Cn1c([C@@H](C#N)C(=O)c2cccc(-c3c(F)cccc3F)c2)nc2ccccc21 535316180 YWRBJRHSOIRSQQ-INIZCTEOSA-N 387.389 5.009 30 20 GKED CC[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1c(C)noc1C 535318390 SBHIKUUFRPCXAF-IBGZPJMESA-N 391.496 5.195 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc1 535455371 MQJQZRPMEHVVEW-UHFFFAOYSA-N 396.368 5.816 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(Br)s1)c1ccc(C#N)c(Cl)c1 539173320 PTKZTCLXBMSXAY-JTQLQIEISA-N 397.725 5.192 30 20 GKED Cc1ccc(CCCSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 543151742 YOPAMMVPUKKOLO-SFHVURJKSA-N 398.597 5.551 30 20 GKED C=C(C)Cn1c(-c2sccc2C)nnc1N1CCC[C@@H](c2nc(C)cs2)C1 549270881 SYDUHELGJXHUFA-MRXNPFEDSA-N 399.589 5.040 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 549386520 OODGWQGGQCAWNO-UHFFFAOYSA-N 375.447 5.416 30 20 GKED CCOC1(C)CCN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CC1 552979472 AVDIYSAXHQZCCV-UHFFFAOYSA-N 398.890 5.035 30 20 GKED COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554119852 FVPHZIBUJOFNTC-UWJYYQICSA-N 391.515 5.501 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC=C(c4ccncc4)C3)cc2)c1 558340379 PUQJMRDWSPFMTO-UHFFFAOYSA-N 396.450 5.067 30 20 GKED Cc1cc(C#N)cnc1C(=O)N(Cc1ccc(-c2ccc(F)cc2)s1)C(C)C 559184521 BBVZAYORUDYQHR-UHFFFAOYSA-N 393.487 5.180 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1 562228531 CHTDATNMKKEZPD-NRFANRHFSA-N 375.403 5.017 30 20 GKED CCc1cc(C2CC2)nc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)n1 564150502 AVVNWZUBUDGNMR-UHFFFAOYSA-N 398.466 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCc2sc(Cl)cc21 566647693 JAFLGUYMAFTXRW-YPMHNXCESA-N 391.949 5.605 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C 571322738 IEZVWJRZJXSDJH-UHFFFAOYSA-N 380.879 5.054 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Sc1nc2c(cc1C#N)CCCC2 585688507 QHWHJAKQJIPLBL-HOTGVXAUSA-N 393.556 5.465 30 20 GKED N#CCCC1CCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1 592821092 JYMKBIOSBTUAQR-UHFFFAOYSA-N 389.524 5.007 30 20 GKED COc1cccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C(C)(C)C#N)cc2)c1 602757130 FHUOJMDENRSLAV-HSZRJFAPSA-N 397.478 5.267 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H](c3ccccc3)C3CC3)cn2)cc1 603690619 NFQROYVDUBOKDB-QFIPXVFZSA-N 384.439 5.018 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1cccc(C(F)(F)F)c1 603968567 BRAGSVPKCWRBBE-UHFFFAOYSA-N 386.398 5.487 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604089900 RIKLIMNGBFOQPJ-UHFFFAOYSA-N 397.887 5.729 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 604099018 DMHDALASJFKGMF-RUZDIDTESA-N 395.506 5.029 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)c1occc1COc1cccc(C#N)c1 608804048 LMJNOHSQVYAJKB-UHFFFAOYSA-N 388.467 5.029 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccc(Cl)c(Cl)c1 609463529 CICXKXSPHMCKQT-INIZCTEOSA-N 378.646 5.123 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(Cl)c2SCC(F)F)c(F)c1 609932954 SWWQTILPLQEOHB-UHFFFAOYSA-N 399.825 5.030 30 20 GKED Cc1nc(NC(=O)C[C@H](C)c2cccc(C(F)(F)F)c2)sc1SCC#N 609968499 KZMJOKWMWHPQRS-JTQLQIEISA-N 399.463 5.218 30 20 GKED Cc1ccccc1C1CC(N(C(=O)c2cc3ccccc3n2CC#N)C2CC2)C1 610194527 YKGRZKPRXLINKE-UHFFFAOYSA-N 383.495 5.024 30 20 GKED CC(C)[C@@H](Sc1ccc(C#N)cc1F)C(=O)Nc1cccc2ncccc12 610218706 KKIABYUYHPUVMI-HXUWFJFHSA-N 379.460 5.001 30 20 GKED CCCCOc1ccc(-c2nnc(CSc3ccc(C#N)cc3F)o2)cc1 610218754 PHGFYDNQXRQAFE-UHFFFAOYSA-N 383.448 5.219 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610290589 GHFZZWKDMSHOBF-MRXNPFEDSA-N 389.430 5.092 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)CCCCOc2cccc(C#N)c2)cc1 610624574 HPBXQCBPEPKYSW-UHFFFAOYSA-N 380.488 5.061 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 611250924 OSVJWVATAFXUFX-AWEZNQCLSA-N 384.526 5.455 30 20 GKED C=CCOc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320184 WEHBWORZBBTZFC-QGZVFWFLSA-N 394.883 5.518 30 20 GKED CN(C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccc(C#N)cc1F 616161866 WPKDHUNTLOOPOZ-UHFFFAOYSA-N 388.320 5.253 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(CC(C)C)cc3)n2)cc1 619756475 YRHXRNQJMDMFJM-FQEVSTJZSA-N 390.508 5.507 30 20 GKED C=CCc1cc(C(=O)Nc2cc(C)ccc2C(F)(F)F)cc(OC)c1OC 622955097 SIUWPZXRFIOYAC-UHFFFAOYSA-N 379.378 5.012 30 20 GKED O=C(NC[C@@H]1CCCC(F)(F)C1)Nc1ccc(C(F)(F)C(F)(F)F)cc1 669718060 ZNIPYAISMVJTDL-SNVBAGLBSA-N 386.311 5.288 30 20 GKED COc1ccc2cc(-c3cc(C(=O)N[C@@H](C)CC#N)c4ccccc4n3)ccc2c1 725893916 YONZBLAJGQKVEN-INIZCTEOSA-N 395.462 5.096 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12)c1ccccc1Cl 727628113 HRKJBVGTHUKUIV-HVJHFUJKSA-N 376.843 5.125 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1 727980000 AOJWWUHTPKZUGN-IIBYNOLFSA-N 379.529 5.002 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)/C=C\c2nc3ccccc3s2)c1 728186302 WWEBJNLEMNWHLM-SEYXRHQNSA-N 384.460 5.117 30 20 GKED C/C(=C\C(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 729369547 HNVIZPGPPCODKT-LULQDDRCSA-N 382.463 5.050 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)c(Cl)c1OC 730433256 DYHXIVTZLFSUIE-HWKANZROSA-N 377.676 5.622 30 20 GKED CC(=O)Nc1ccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 733620921 FNBYWXOZOLFQOJ-JOCHJYFZSA-N 398.466 5.253 30 20 GKED CCOCc1cc(/C=C/C(=O)c2ccc(SCC(F)F)cc2)ccc1OC 741841348 GAJQQGVCMXDCTH-ONNFQVAWSA-N 392.467 5.485 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1ccc2c(c1)COC2 742437044 QHVCJYKKUMVZDL-MDZDMXLPSA-N 378.859 5.069 30 20 GKED C#CCN(C(=O)c1cccc2c(=O)c(C)c(-c3ccccc3)oc12)C1CCCCC1 743692438 WSZIIGWERMLPOM-UHFFFAOYSA-N 399.490 5.177 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@]12CCCc1ccccc12)c1nc2cc(Cl)ccc2s1 744035126 HUTFTRAWHYZDSV-ZWWNWMABSA-N 392.911 5.420 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1)c1ccccc1C(F)(F)F 744161409 UOPABRKXNIFHBM-VOMSXAGXSA-N 383.373 5.170 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2ccc(OC)cc2)cc1 750688490 UQXRIFMVGKHQGY-GSHUGGBRSA-N 392.499 5.050 30 20 GKED Cc1c(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)oc2ccc(F)cc12 752375585 CUVLXFOBOXUYQB-UHFFFAOYSA-N 377.400 5.128 30 20 GKED N#CCCCOc1cccc(NCc2ccc(OCc3ccccc3)cc2O)c1 753551080 YBPAQAGQEQTSGZ-UHFFFAOYSA-N 388.467 5.266 30 20 GKED CC(C)(C)O[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 754530266 DXBXCMRKBSLKHL-KXBFYZLASA-N 398.915 5.682 30 20 GKED C[C@@H](c1ccco1)N(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)C1CC1 754917312 BHCHKBGYWHOFLZ-HNNXBMFYSA-N 391.496 5.315 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)c3cccc([N+](=O)[O-])c3)n2)cc1 763944888 OSMRRHZYSZYGIA-KDOFPFPSSA-N 391.452 5.007 30 20 GKED C#CCC(C)(C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 767101215 RZQSKBQHJNEYEB-UHFFFAOYSA-N 379.847 5.064 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1coc2cc(C)c(C)cc12 770839102 MYKJQWLKJILXLZ-IBGZPJMESA-N 388.467 5.136 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCc3cc(Cl)cc(Cl)c32)c1 772986771 YNZALFYQMXYJQR-LPHOPBHVSA-N 375.299 5.451 30 20 GKED CC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cc(F)cc(Br)c1 776163261 GUNOPHDSKXHFPZ-YJYMSZOUSA-N 391.284 5.292 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc3oc(CCOC)nc3c2)cc1 777122714 JCNDSOYPGPHYPB-HNNXBMFYSA-N 386.879 5.321 30 20 GKED N#C[C@@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1nccc2ccccc12 792097599 XWTAWUPSBHYICW-JCZXDDDQSA-N 398.462 5.852 30 20 GKED CC(C)CCn1ncc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1C(C)C 792697542 CQVJMSWUNGSIGW-UHFFFAOYSA-N 389.956 5.387 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1SC(F)F 806152060 UIAYQHISYXITRR-UHFFFAOYSA-N 394.491 5.389 30 20 GKED COc1ccc2cc(NC(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)ccc2c1 806614117 LADILJVZMNCZHH-XZOQPEGZSA-N 385.467 5.152 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Oc2cccnc2)cc1 808762384 BRDOUPKWLFBXHM-INIZCTEOSA-N 393.874 5.280 30 20 GKED C[C@@H](N[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1ccc(C#N)cc1 810264255 ZQYMWIRWNLGFQQ-GCJKJVERSA-N 393.531 5.255 30 20 GKED CC[C@@H](CC#N)OC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 810710874 SKKUGZRFRBHSME-NSHDSACASA-N 380.872 5.116 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842946170 VTRRMUVBFBESHB-YWZLYKJASA-N 388.492 5.331 30 20 GKED CC(C)(C)c1cccc(C(=O)[C@H](C#N)C(=O)c2sccc2Br)c1 847736778 DDJVWOHLIDEXDD-ZDUSSCGKSA-N 390.302 5.013 30 20 GKED N#CCCCC[C@@H](N)c1nc(-c2ccc(Sc3ccc(Cl)cc3)cc2)no1 848626931 UVTONVPOSDODMC-GOSISDBHSA-N 398.919 5.625 30 20 GKED CN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(NC(=O)OC(C)(C)C)cc1 863471325 QXBRKBSGMRMMCY-UHFFFAOYSA-N 393.487 5.111 30 20 GKED N#C[C@H](C(=O)CSCc1ccccc1Cl)c1nc(-c2ccccc2)cs1 915102234 PVGAXHZIJNUJIB-MRXNPFEDSA-N 398.940 5.573 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1C=NNc1ncc(Cl)cc1Cl 916317080 YKCIHPBRVURMES-UHFFFAOYSA-N 398.656 5.121 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(Oc2ccccc2)cc1 916880579 CHKPPKLNURLZQT-HXUWFJFHSA-N 390.826 5.093 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3c(F)cccc3s2)cc1 916955688 SXCPJIGGLDXAQA-CXAGYDPISA-N 394.471 5.515 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 917047082 QRQREDJTMZPOJX-FWEMWIAWSA-N 379.293 5.554 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(F)(F)c2ccc(F)cc2)cc1 920843818 LLWXVBAUPBRZFY-HXUWFJFHSA-N 380.369 5.212 30 20 GKED CC(=NNc1ccc(C(=O)O)nc1)c1cc(F)ccc1Oc1ccc(Cl)cc1 1776072316 RTUGRUKGSGRDSL-UHFFFAOYSA-N 399.809 5.201 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2cccc(F)c2Cl)c1 1776093561 YAQVUJQCHAMDTC-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(C)COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776126663 SSADKEGDKWVNGG-QBFSEMIESA-N 390.435 5.576 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1Cl 1776353569 CBENEFOMSVOQHA-ARJAWSKDSA-N 385.268 5.436 30 20 GKED CCCCCCCOc1cccc(CN[C@@]2(C(=O)O)CCCC(C)(C)C2)c1 1776787351 UGXTZGOBXFLMRQ-QHCPKHFHSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](CC(=O)O)c2ccccc2)c1 1776788691 MOKKVUIUIUPUEB-JOCHJYFZSA-N 383.532 5.384 30 20 GKED CCCCCCCOc1cccc(/C=C2\CCc3ncc(C(=O)O)cc3C2=O)c1 1776789256 YOMVPIAQRVKZFU-QGOAFFKASA-N 393.483 5.342 30 20 GKED CCc1c(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)oc2ccccc12 1776956332 YFVHOQUMMHRXOO-VQHVLOKHSA-N 394.423 5.943 30 20 GKED CSc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1F 1777403150 BMLSVILKGYLAIT-HYXAFXHYSA-N 390.432 5.496 30 20 GKED CC(C)(C)c1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccccc2)cc1 15244198 TYWULOIJFQNBOU-UHFFFAOYSA-O 389.544 5.323 30 20 GKED N#CCc1ccc(NC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)cc1 65719847 USCZUFSEWKNFIH-UHFFFAOYSA-N 388.279 5.435 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H](C)c1ccco1 102796515 UMAMZZCTXRYKJX-KRWDZBQOSA-N 389.455 5.264 30 20 GKED CCCCCCCC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 107887517 KWEGOADTOFRWIQ-UHFFFAOYSA-N 396.409 5.850 30 20 GKED CCO[C@H](C)c1nc(CC(=O)Nc2sc(-c3ccccc3)cc2C#N)cs1 117132894 IXQLAZGCINKUIR-CYBMUJFWSA-N 397.525 5.022 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2cc(-c3ccc(F)cc3)c(C)s2)c1 119995486 SGMBWAMWQHYBEN-LJQANCHMSA-N 392.455 5.132 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1)c1ccccc1 135042894 HULVQHZQOCQHQQ-NGOKVRLYSA-N 395.568 5.566 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2)=C(/S)N[C@H](C)CC)cc1 154521096 KXUYKRZWWILZHU-QGZVFWFLSA-O 383.581 5.205 30 20 GKED CN(C(=O)c1cnc(-c2ccccc2Cl)s1)c1cc(Cl)ccc1C#N 156806867 BKSOKXIRSDEDME-UHFFFAOYSA-N 388.279 5.265 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)N[C@H](CCC#N)c1ccccc1 160679352 CRMYXHYDSXEHAW-XMMPIXPASA-N 398.510 5.147 30 20 GKED CC(C)(C#N)CCCSc1nnc(COc2ccc(Cl)cc2Cl)o1 177216002 XFUXBZXGKXBIHJ-UHFFFAOYSA-N 386.304 5.377 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(OCCCC#N)c1 180166155 DTKXSMDUTMKAMC-UHFFFAOYSA-N 399.472 5.030 30 20 GKED COc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1NC(C)=O 180220980 UEKALTFUUGGKKX-KRWDZBQOSA-N 399.494 5.043 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc(F)c(F)c(F)c1 182342255 VIXNIZYXILLNFN-LBPRGKRZSA-N 393.434 5.162 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CCO1 183387181 AYCRYXQEJUQBSE-AZUAARDMSA-N 378.472 5.193 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CNC(=O)c1ccc(C(C)(C)C)cc1 188067871 OLFVOKGMMSDKQP-UHFFFAOYSA-N 392.543 5.205 30 20 GKED COc1ccc(/C=C2/CCCc3c2nc2ccccc2c3C(=O)O[C@@H](C)C#N)cc1 207146090 CJYSQSWORBYDJY-IYWFSZBXSA-N 398.462 5.189 30 20 GKED O=C(/C=C\c1ccc(OCc2ccccc2)cc1)c1cccc(N2CCOC2=O)c1 207667652 UJXIJEDODUXMQV-KAMYIIQDSA-N 399.446 5.118 30 20 GKED N#Cc1ccc(NCc2ccc(OCc3ccccn3)cc2)cc1C(F)(F)F 301171037 KCEGHBUFJDIXRJ-UHFFFAOYSA-N 383.373 5.163 30 20 GKED CC[C@@H]1Oc2cc([C@H](C)/N=C(/O)N3CCC[C@H]3c3ccsc3)ccc2N=C1O 329787096 YKAACFOQHVSYRV-KKXDTOCCSA-N 399.516 5.319 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ncoc1-c1ccccc1 371993717 HCATTWHLIFNUCC-HNNXBMFYSA-N 392.484 5.058 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N[C@@H]2CC[C@H](C#N)C2)c(C(F)(F)F)c1 425642370 WEXPASDBNABEDF-RWMBFGLXSA-N 385.455 5.410 30 20 GKED Fc1ccc(CN[C@H]2CCCc3ncc(C(F)(F)F)cc32)c(C(F)(F)F)c1 427617511 HRTCQVXYOGBDNW-HNNXBMFYSA-N 392.318 5.426 30 20 GKED CCCc1c(NC(=O)c2cccc(SCC#N)c2)cnn1-c1ccccc1C 429265094 OUTRHLBSXXIQDR-UHFFFAOYSA-N 390.512 5.001 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1 431161447 YDKUFMQJKFLGKW-GOSISDBHSA-N 398.316 5.015 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2sccc2C2CC2)cc1 432742217 RAYNZYTYPRAFDW-UHFFFAOYSA-N 388.492 5.523 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 433117802 OQQJIZXIBGNDFM-YLJYHZDGSA-N 393.556 5.522 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3ccc(Oc4ccncc4)c(Cl)c3)CC2)c1 435073216 JKZPTAZATNHRMD-UHFFFAOYSA-N 389.842 5.069 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 437643844 CYBNDVALMMKLSJ-HXOBKFHXSA-N 388.515 5.609 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C1CCN(CC(F)(F)F)CC1 455252324 UGRPIYSUGFEAJP-UHFFFAOYSA-N 397.485 5.029 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cc(F)ccc1SC 466820090 WXOZCCWUPYGDQC-UHFFFAOYSA-N 384.929 5.160 30 20 GKED C[C@@H](CCC#N)Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1Cc1ccco1 470450974 GVENEMHEWWMVTH-INIZCTEOSA-N 394.544 5.668 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 471280463 UKVZGQGCWDFJBX-SZVBFZGTSA-N 397.519 5.678 30 20 GKED N#C[C@@H](C(=O)c1ncoc1-c1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 473479352 BKUBVXSSEIHNLP-ZDUSSCGKSA-N 397.818 5.234 30 20 GKED CCOc1ccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c(C)c1 490065323 VYYSAOGXCMDSJF-UHFFFAOYSA-N 386.451 5.097 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 492170102 UJWOTTWEBNNBHO-HTXNQAPBSA-N 381.479 5.097 30 20 GKED N#CCCCOc1cccnc1NC(=O)CC1(CCc2ccccc2)CCCC1 498102154 PIRFVCFGMAWBND-UHFFFAOYSA-N 391.515 5.286 30 20 GKED Cc1ccccc1C1(C(=O)Nc2nc(C)c(SCC#N)s2)CCCCC1 503299990 PMBVWGKVULLDHH-UHFFFAOYSA-N 385.558 5.216 30 20 GKED CSc1ccc(Cl)cc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503465265 DUJKCQKPKMBHHP-UHFFFAOYSA-N 383.904 5.255 30 20 GKED N#Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)ccc1F 506458521 CONHOSZOFCBHLR-IBGZPJMESA-N 389.817 5.259 30 20 GKED N#CC1CCC(CNC(=O)[C@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)CC1 508367382 KNAVNUJHXMXFER-UVEDLQPMSA-N 384.951 5.135 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 509259066 CVXCKZNJFAWDHJ-LBPRGKRZSA-N 395.356 5.260 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)Cc3ccc(Cl)s3)c2)c1 509622204 BFNBOSPJSVTYRB-UHFFFAOYSA-N 382.872 5.033 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1cccc2ccccc12 510871512 HXKPRXPWTLGUDK-QFIPXVFZSA-N 385.467 5.479 30 20 GKED N#Cc1ccc(CNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c(F)c1 511737353 XDEJTZRXWNZOIS-UHFFFAOYSA-N 387.336 5.516 30 20 GKED C[C@@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)cc1F 512661045 PSBHQKBGRDZGFC-OPAMFIHVSA-N 378.422 5.307 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@H]3c3ccsc3)c2)cc1 517905497 GABLTVIIUSUIBO-OAQYLSRUSA-N 389.480 5.781 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 519030332 KYYSUYWCHNZIAD-UHFFFAOYSA-N 393.786 5.164 30 20 GKED CCc1sc(-c2nnc(CN(Cc3ccc(C#N)cc3)CC(C)C)o2)cc1C 520173351 GSNOZISEYMPRCK-UHFFFAOYSA-N 394.544 5.199 30 20 GKED C[C@@H](C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccsc1 523103453 PBUZYMDKSRHQOT-MRXNPFEDSA-N 378.472 5.091 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1 524253869 IMMQLFFYQZWUIB-FQEVSTJZSA-N 398.940 5.271 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCc2nc3cc(Cl)ccc3s2)cc1 532030940 SNKHCVICKPXLCO-UHFFFAOYSA-N 398.919 5.115 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnc4ccc(F)cc4c3)n2)cc1 533954987 YUYOEYYJVCDNLH-SFHVURJKSA-N 387.439 5.296 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)nc(C)n1 536933639 HHQMZAJBNVZVNS-IBGZPJMESA-N 393.899 5.388 30 20 GKED N#Cc1ccc(CN2CCC(N[C@H](c3ccccc3)c3cccc(F)c3)CC2)cc1 537288587 JKGAHOLQAFAKNG-AREMUKBSSA-N 399.513 5.041 30 20 GKED Cc1sc(C2(NCc3ccc(C#N)s3)CCC2)nc1-c1ccccc1F 550325046 PLZUNAUIQDRDPS-UHFFFAOYSA-N 383.517 5.360 30 20 GKED N#Cc1ccc(NC(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)cc1Cl 550757024 TZBYUGBKSHOGMA-UHFFFAOYSA-N 379.769 5.041 30 20 GKED C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)N[C@@H](CCCC#N)c1ccccc1 551204192 AUJQHGYQYPIXGP-GCJKJVERSA-N 397.950 5.102 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2nccc(C#N)c2Cl)nc1-c1ccccc1 553068060 RNWXUPPXLMFYSC-QGZVFWFLSA-N 392.890 5.727 30 20 GKED Cc1cc(C(=O)N(CCC#N)c2ccc(F)cc2)sc1-c1ccc(F)cc1 553944589 MUWUXOGCFXLDKE-UHFFFAOYSA-N 382.435 5.562 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccnc(Oc3ccccc3)c2)s1 559319159 HQJMEEPJPVDWDG-MRXNPFEDSA-N 377.469 5.118 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2cccc(F)c2)C1 563719537 TUDGQNPTRIHZQI-NVXWUHKLSA-N 383.492 5.099 30 20 GKED CC[C@@H](c1ccccc1)N(CC(C)C)C(=O)c1cnc(C(F)(F)F)c(C#N)c1 565112519 MIPJEGXANLSYEX-SFHVURJKSA-N 389.421 5.222 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Cc1cncc2ccccc12 565678535 OJYCTXXXAVSLCH-IRXDYDNUSA-N 389.524 5.304 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)C12CC3(C)CC(C)(CC(C)(C3)C1)C2 566981226 JKXRLQBNNKOFDX-UHFFFAOYSA-N 385.548 5.063 30 20 GKED COc1ccc(NC(=O)[C@@H](Sc2cccc(F)c2C#N)c2ccccc2)cc1 567565682 XVKCJKWINXXDLO-NRFANRHFSA-N 392.455 5.178 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2occc2CSc2ccccc2)cc1 567962003 ROCFXNZGVGFZIF-FQEVSTJZSA-N 376.481 5.129 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2)c1 583908505 ODAYHYPLEGLAOK-SFHVURJKSA-N 375.497 5.301 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)cc1F 586788646 QBQIBHNVMLXAAO-ZDUSSCGKSA-N 375.285 5.240 30 20 GKED CCNc1ccc(C#N)cc1NC(=O)c1sc(-c2ccccc2)nc1C(F)F 586796967 XFHWEJHMYMSHRZ-UHFFFAOYSA-N 398.438 5.303 30 20 GKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 596606077 KFHWEPYOBXDSOE-VXKWHMMOSA-N 375.516 5.585 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1c(F)cccc1Cl 603601401 ZJRYRSKNYSYNIN-UHFFFAOYSA-N 395.821 5.028 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 609501225 AZYGRZOXENZRKJ-KBPBESRZSA-N 375.255 5.006 30 20 GKED Cc1cc(F)cc2c(N(C)C[C@@H]3CCCO[C@H]3c3ccccc3)c(C#N)cnc12 610275070 ZKQGOJGNIVOTBD-UUOWRZLLSA-N 389.474 5.158 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)NCc2ccc(C#N)cc2F)c1C 610570265 MKGKMTGJLMYNNB-UHFFFAOYSA-N 383.467 5.033 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCCc2nc(-c3ccccc3F)sc21 618805405 HITAGMJLBPPGMU-PMACEKPBSA-N 389.499 5.475 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)NCc1ccc(C#N)c(Cl)c1 619755787 STDFUKTUWQOWDD-AWEZNQCLSA-N 381.932 5.418 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(F)cc1OCCC(F)(F)F 669729211 PJOKTKVWPYXMMV-UHFFFAOYSA-N 390.299 5.009 30 20 GKED C=CCC[C@H](NCc1cn2cccc(F)c2n1)c1ccc(C(F)(F)F)cc1 677322759 LDAAHEDCQLSXBM-SFHVURJKSA-N 377.385 5.289 30 20 GKED FC(F)Oc1cccc(Cl)c1CN1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 678299110 VAMCJZKNOODHRC-DTORHVGOSA-N 397.693 5.114 30 20 GKED N#C[C@@H](C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1ccc2ccccc2n1 679237441 IRWKQBXAOWJCPM-HXUWFJFHSA-N 388.430 5.064 30 20 GKED COc1cc(C=NOCc2nc(-c3ccsc3)oc2C)ccc1OC(C)C 726787040 GCJQABGFXHQUOB-UHFFFAOYSA-N 386.473 5.058 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CCc2ccc(OC)c(F)c2)c1 728181612 SEDMLPNOTVVIMO-UHFFFAOYSA-N 393.483 5.043 30 20 GKED C#Cc1cccc(N(C(=O)c2cc(C3CC3)nc3onc(CCC)c23)C(C)C)c1 728246611 AGEUUUYUDHQXDD-UHFFFAOYSA-N 387.483 5.089 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2C[C@@H]2c2cccc(OC)c2)c1 730180798 KTKUAQGQAXTGPH-DHIUTWEWSA-N 387.504 5.075 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(Cl)s1 730988730 BXJCHDMBUYGLAW-LBPRGKRZSA-N 396.990 5.525 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)c2c1 731195578 LRFNAECCGBHXFI-OAHLLOKOSA-N 389.238 5.051 30 20 GKED CCc1ccc(C(C)=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)s1 733080022 PLESEMPSGOKZBZ-UHFFFAOYSA-N 391.422 5.017 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccc(C)c(C)c1 733080679 WHQVYTBCMFIFBK-UHFFFAOYSA-N 385.393 5.010 30 20 GKED CC(C)c1ccccc1N=C1SCCCN1C(=O)CCCc1ccccn1 733085807 IGPBCISMXIRYGR-UHFFFAOYSA-N 381.545 5.181 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)NCc2cccc(O[C@H](C#N)CC)c2)cc1 733801765 WZRJLSCYTUJSNQ-APWZRJJASA-N 397.544 5.040 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccncc1 734657012 UOAOKKIBZSGFIQ-QPPBQGQZSA-N 397.478 5.534 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 734965169 IICUPUMTPSFDGX-BEFAXECRSA-N 394.927 6.142 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc(F)cc3Cl)c2)s1 740427391 JWWXWDUMJXBSCD-UHFFFAOYSA-N 385.851 5.401 30 20 GKED Cc1c(C(=O)/C=C/c2cnc(-c3ccccc3)s2)cnn1-c1ccc(C#N)cc1 741845509 XLLKWVTVJGJJGH-VAWYXSNFSA-N 396.475 5.072 30 20 GKED Cc1c(C(=O)/C=C/c2cnc3ccccn23)cnn1-c1ccc(Cl)cc1Cl 743056504 WPEVPGKQOVUCQY-SOFGYWHQSA-N 397.265 5.031 30 20 GKED FC(F)(F)c1cccnc1NN=C(Cc1ccccn1)c1ccc(Cl)cc1 745198259 BDLLESOCGRSUCK-UHFFFAOYSA-N 390.796 5.208 30 20 GKED CCN(C(=S)Nc1ccccc1C#N)[C@H](C)c1cccc(C(F)(F)F)c1 745689190 VPVJFBOKMXVWEC-CYBMUJFWSA-N 377.435 5.357 30 20 GKED N#CCSc1ccccc1C(=O)N1CCC[C@@H](CCCc2ccccc2)C1 749051564 ZZVZQLYAOGUZSC-HXUWFJFHSA-N 378.541 5.177 30 20 GKED COc1cc(/C=C/C(=O)c2c[nH]c3cc(F)ccc23)ccc1OCC(F)(F)F 750910329 QTHXYWNDJAEXNP-QHHAFSJGSA-N 393.336 5.153 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)cc1 751518806 ZOCPOGLUIBDQMC-CMDGGOBGSA-N 377.494 5.262 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(C2SCCS2)cc1 752038205 GFPDBMHFFQNSMU-UXHICEINSA-N 394.565 5.077 30 20 GKED CC1(C)CCCC[C@H]1CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 752483321 MLDPEZUQNMKBAQ-ROUUACIJSA-N 377.513 5.465 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1c(C)nn(CC(C)C)c1Cl)c1ccccc1 759374498 QLQSCQVVAQQKPD-UYAOXDASSA-N 399.966 5.524 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C#N)s2)ccc1OCc1ccccc1 762443710 QVUVRXJDYFYTDQ-JXMROGBWSA-N 375.449 5.103 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Br)cc2F)ccc1SC 767738305 SFNYLUGBJPNBNU-CLTKARDFSA-N 381.266 5.215 30 20 GKED C[C@@H](C#N)Oc1ccc(CN(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1 768914120 AOWQORJHEHWPJN-IBGZPJMESA-N 399.469 5.191 30 20 GKED Cc1sc2ncn(N=Cc3cc(F)cc(Cl)c3)c(=O)c2c1-c1ccccc1 776723536 IUXMIPUBGPKBTJ-UHFFFAOYSA-N 397.862 5.108 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 780154729 ZIHRVSTXAZSWKO-CQSZACIVSA-N 393.830 5.070 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1O[C@H](C)C#N 780170417 UJLKJGOAEFUIFC-CQSZACIVSA-N 399.472 5.030 30 20 GKED FC(F)(F)[C@@H]1C[C@@H](N[C@H]2CCC[C@@H](C(F)(F)F)C2)C[C@H](C(F)(F)F)C1 782526251 MCSNMEVANMVMFY-GCHJQGSQSA-N 385.314 5.607 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)cs2)cc1 797568702 VBWNZINLKLGAMY-INIZCTEOSA-N 395.553 5.292 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=C4CCC45CCOCC5)c23)cc1 799873334 PLHYDTMFXBFBHG-UHFFFAOYSA-N 378.501 5.025 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 802250012 KUCPJAFFNHOGJX-YOEHRIQHSA-N 382.529 5.259 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)cs1 812243599 PHCJRVMOPZSFNW-VMPITWQZSA-N 397.452 5.033 30 20 GKED O=C(c1cccc(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)c1)C(F)(F)F 839537804 ACEHJSXGAJBHOM-OAHLLOKOSA-N 393.302 5.354 30 20 GKED N#CCOc1ccc(Cl)cc1CNC1(c2ccc(C(F)(F)F)cc2)CC1 844463164 UAIYHFFIQJFAPZ-UHFFFAOYSA-N 380.797 5.040 30 20 GKED CC(C)Cc1ccccc1-c1noc([C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1 858811459 AMEISZRRRIBMJN-GOSISDBHSA-N 398.507 5.195 30 20 GKED Cc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cccc1NC(=O)OC(C)(C)C 862718954 NETGMUUMAWIHOZ-GOSISDBHSA-N 393.487 5.368 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cnc(CCC(F)(F)F)s1 903116703 NBKDAUNQLUUQLW-UHFFFAOYSA-N 386.292 5.048 30 20 GKED Cc1ccc(C)c(OCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915181013 WGVAKGVSWAXHAS-QHCPKHFHSA-N 384.479 5.367 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(SC(F)F)cc3)cn2)cc1 916073747 GJAAYDGNSKXUAQ-UHFFFAOYSA-N 397.406 5.313 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(Cl)s1)c1nc2cc(Cl)ccc2s1 917047081 QRQREDJTMZPOJX-CJHWANRJSA-N 379.293 5.554 30 20 GKED CC(C)c1cccc(NC(=S)N(Cc2ccc(C#N)cc2)CC(F)(F)F)c1 917577766 KHRDHUAWLXQGJF-UHFFFAOYSA-N 391.462 5.443 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc4c(O)nccc34)cc2)cc1 1157889897 SGUCVRPHRCIYJS-UHFFFAOYSA-N 395.418 5.051 30 20 GKED O=C(O)c1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c(Cl)c1 1776126140 CZFXNEOZVIONLB-JLHYYAGUSA-N 378.811 5.727 30 20 GKED CCOc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776128379 YPHSTYDZFONLJQ-OVCLIPMQSA-N 386.447 5.276 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2csc(C(=O)O)c2)cc1 1776785483 DOCLLPNLKWPPPH-JLHYYAGUSA-N 386.513 6.082 30 20 GKED CCCCOc1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)cc1OCC 1776801324 KANHZRDVEITFFH-XMJIKXADSA-N 394.467 5.102 30 20 GKED CCc1ccc(-c2ccc(/C=C\C(=O)c3cccc(O[C@@H](C)C(=O)O)c3)o2)cc1 1776964248 YMRKTDAEVCTXFS-KVNDZABWSA-N 390.435 5.257 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cc(C(=O)O)ccc3OC(C)C)s2)o1 1777431414 CVVTZYYHJZHNHE-VOTSOKGWSA-N 397.452 5.093 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4ccc(C(=O)O)cc4)s3)coc12 1777449091 SWRPYMWPHNKYOI-LUAWRHEFSA-N 388.444 6.064 30 20 GKED N#CCCCOc1cccc(NC(=O)CCOc2ccc(Cl)cc2Cl)c1 58535054 OYBNLXXKAKJFSZ-UHFFFAOYSA-N 393.270 5.084 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(SCc2cn3ccccc3n2)cc1 63961731 WAGRNDUIBFXYGB-UHFFFAOYSA-N 398.491 5.059 30 20 GKED COc1c(Cl)cccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 65863740 CGKJKWKQNGVYRA-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 66840815 UVJQLAMKTPLTKD-UHFFFAOYSA-N 388.471 5.171 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)cc1 66954237 JTKNVGMUKRRMBE-QAPCUYQASA-N 383.517 5.362 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)C2CCC(F)(F)CC2)cc1 155741978 BHPOFDSTKMRZTD-UHFFFAOYSA-N 386.417 5.052 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2ccccc2Br)n1 155813181 GXXMNSICSLRSAP-CQSZACIVSA-N 391.334 5.228 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1cccc(C#N)c1C 178575857 FQGZJIQZZZJQNU-MRXNPFEDSA-N 390.512 5.524 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)cc1 181145318 KXNAXRVOHZCCHR-UHFFFAOYSA-N 387.405 5.183 30 20 GKED CC(C)CCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 193771791 ACIXYJIWWRYPKN-UHFFFAOYSA-N 391.515 5.374 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccccc2SCCC#N)cc1 282779531 FSEIACHQIWVKNU-INIZCTEOSA-N 380.513 5.273 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2c2cccnc2)cc1 362654415 YRHLPQNYJLRQHE-OAQYLSRUSA-N 384.439 5.115 30 20 GKED C=CCC[C@H](C(=O)N[C@H](C)c1nc(-c2ccncc2)cs1)c1ccccc1 426990012 FTYJPDLCQSHUCI-APWZRJJASA-N 377.513 5.132 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ncc(-c3ccccc3)s2)cc1 437261338 UFLKCNLFXNGOCN-UHFFFAOYSA-N 389.524 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](CO)c1cccc(Cl)c1F 439375380 DFMFZLTXSFNTBZ-GOSISDBHSA-N 390.886 5.186 30 20 GKED CCOc1ccc(CN(C(=O)N[C@H](CCC#N)c2ccccc2)C(C)C)cc1 440259374 UAARODBESNRCFF-JOCHJYFZSA-N 379.504 5.050 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@]12CCCc1ccccc12 440634956 JIEPHZTVISNHHI-ICPLQIHGSA-N 376.525 5.171 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Cc3ccncc3)cc2)c2ccccc21 443919972 JMDWCCRYBRKHDK-UHFFFAOYSA-N 394.478 5.183 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)c2ccccc21 444243510 IMYLLMOHTLJDHY-BEFAXECRSA-N 395.865 5.023 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)CS[C@H](C)c2cccc(C#N)c2)cc1 446708679 SEBRGRRVLPRZCB-VGSWGCGISA-N 394.540 5.115 30 20 GKED CN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 459020526 VZIYULCZWYNPEH-WQANXHIZSA-N 393.453 5.065 30 20 GKED C=CCOc1cccc([C@H]2Nc3ccc(Cl)cc3C(=O)N2c2ccncc2)c1 463013645 SICDUCVMFBLDQC-NRFANRHFSA-N 391.858 5.071 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)s1 464472899 GAZRLBAHLFPKNQ-CQSZACIVSA-N 387.386 5.022 30 20 GKED CCCN(C(=O)NCCc1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 466808111 WXTCHPBIYAJUJU-KRWDZBQOSA-N 375.472 5.030 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccccc2)ns1)c1ccc(Cl)c(Cl)c1 468974204 OFQZYUGUXKUJOB-MRXNPFEDSA-N 388.279 5.112 30 20 GKED Cc1cccc(CC[C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c1 469201025 IDKNTZCQGILOOX-LJQANCHMSA-N 375.516 5.011 30 20 GKED CC(C)[C@@H](CC1CCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 470771971 IIZJWHGTMBSEFX-OAQYLSRUSA-N 395.547 5.061 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)c1 474618788 CGWNHPZEAMVEJZ-SFHVURJKSA-N 385.414 5.146 30 20 GKED CC(C)c1cccc2c1CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)C2 474706063 GOOYBUNZYXPYSQ-QGZVFWFLSA-N 393.556 5.652 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 474739019 UUZZPQOWGQPKPU-ZDUSSCGKSA-N 396.368 5.049 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2COCc2ccccc2)cc1 474903779 YIXCMTPPQQNRTF-UHFFFAOYSA-N 384.479 5.457 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccccc1 475167785 DDJGUWJMFUWZDY-AVRDEDQJSA-N 394.927 5.695 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)C[C@H](CC#N)c2ccccc2)o1 477916037 PZNFBCSPFLCFMG-KRWDZBQOSA-N 378.859 5.935 30 20 GKED CSc1ccc(CS[C@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1 478734750 FXNUPOAZCMEXAZ-GFCCVEGCSA-N 388.583 5.091 30 20 GKED N#Cc1cc(Cl)ccc1CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 478918492 WPHBCEFTMRAODO-UHFFFAOYSA-N 385.832 5.208 30 20 GKED CCOc1c(Cl)cc(CN[C@H]2CCCCc3cc(C#N)ccc32)cc1OC 481929331 TZNPNMXETVQHHC-FQEVSTJZSA-N 384.907 5.176 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)N[C@H](c1ccc(F)cc1)C(F)(F)F 482485959 WLSLIQSJOYMKTO-MBRGGSNBSA-N 385.323 5.304 30 20 GKED Cc1ccc(N(C(=O)c2ccnc(C#N)c2)c2nc3ccccc3s2)c(C)c1 483384278 NDTGTQWMKZXPGI-UHFFFAOYSA-N 384.464 5.158 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnc(Cc3ccccc3F)s2)c(C#N)s1 484135309 RLNIDOYYOIFREV-UHFFFAOYSA-N 399.516 5.356 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(CN2CCSCC2)c1C 486240276 PYNHXGYZMIHOEJ-UHFFFAOYSA-N 398.597 5.074 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 486426549 GFJQRZYAHAWXLE-OAHLLOKOSA-N 377.296 5.266 30 20 GKED N#CCCn1cc(CN[C@H]2CCC[C@@H](c3ccccc3)C2)c(-c2ccccc2)n1 486853996 AOECWNHRRAWZEB-VWNXMTODSA-N 384.527 5.280 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 502653960 KPXYJJFLIOYEKC-UHFFFAOYSA-N 387.483 5.108 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 505060505 GFERFABSVNOBBR-REWPJTCUSA-N 391.559 5.322 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CSc2ccccc2)cc1 505618286 FYTAPVNVVHFWQR-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CSc1cccc(C(F)(F)F)c1 509604472 WJCMDIYRBZJFDK-UHFFFAOYSA-N 394.418 5.095 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 513113342 MTDBFUDXJPACIV-QGZVFWFLSA-N 388.442 5.110 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1cccc(Cl)c1 518129915 FLFDUUDPVGFKDP-CYBMUJFWSA-N 376.934 5.465 30 20 GKED Cc1ccc(OCCCCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 518256988 VQYJWKSKZPLUGE-SFHVURJKSA-N 397.544 5.370 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc3sccc3s2)cc1 518476376 ZOFAZRLJDRLKFY-UHFFFAOYSA-N 382.510 5.029 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H](c3ccccc3)[C@@H]3CCCO3)c2)c1 520962589 JCAWCAMGUMGGHE-IZZNHLLZSA-N 398.506 5.147 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](c1ccccc1)C(C)(C)C 521082646 OSJFWZHNVYSZRR-HXUWFJFHSA-N 381.476 5.080 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCc2c(Cl)cccc21 521257035 BJHMBJMKEQLFLG-CXAGYDPISA-N 385.920 5.401 30 20 GKED N#Cc1ccc(NCc2cccc(NC(=O)C3CCCC3)c2)cc1C(F)(F)F 521856820 MJTGATBSMCXIGA-UHFFFAOYSA-N 387.405 5.318 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3COc4ccccc43)cc2Cl)cc1 522202209 BHMLGPXMKAQJRB-GOSISDBHSA-N 390.826 5.119 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(F)cc(F)cc1F 525521224 NGUQSFOOUSCLTL-UHFFFAOYSA-N 387.201 5.394 30 20 GKED CCN(C(=O)c1sc(-c2ccccc2)nc1C)c1ccc(C#N)c(Cl)c1 534383999 JXUQLTDHTZMOHO-UHFFFAOYSA-N 381.888 5.310 30 20 GKED C[C@@H](NC(=O)c1cccc([C@@H]2CCOC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 542929080 QGZIVQHHZSMUIS-IQGLISFBSA-N 396.490 5.220 30 20 GKED C=C(C)[C@H](NCc1ccc(Br)cc1C#N)c1ccc(F)c(F)c1 553909489 LWBCAVGZDYVRME-SFHVURJKSA-N 377.232 5.006 30 20 GKED C[C@H]1C[C@H](c2cccnc2)N(CCC(C#N)(c2ccccc2)c2ccccc2)C1 554265659 UJVGNXMQVJZXMR-SQJMNOBHSA-N 381.523 5.364 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 558805882 RHLGLTWMRYBQBZ-DLBZAZTESA-N 394.540 5.662 30 20 GKED N#Cc1nc(N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)ccc1C(F)(F)F 561308126 LBVLUVMZELLFRJ-SFHVURJKSA-N 397.404 5.094 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 588239067 VAWFEUJGBMUZFI-UHFFFAOYSA-N 390.443 5.012 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1c(Cl)cc(C#N)cc1Cl 589833292 YDDUUALSHALNGV-GFCCVEGCSA-N 377.271 5.143 30 20 GKED CCSc1cccc(-c2noc([C@H]3CCCN3c3ccc(C#N)cc3)n2)c1 589952192 QLAIYDOFRCIAKV-LJQANCHMSA-N 376.485 5.062 30 20 GKED CC(C)Cn1cc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c2ccccc21 592973935 LIDPXMICRRTEMP-MRXNPFEDSA-N 391.471 5.536 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1CCC(C(C)(C)O)CC1 593417192 AOBFUHQXLCGCHE-UHFFFAOYSA-N 392.499 5.175 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(Cl)cc2OCc2ccccc2)C1 596926650 UOHPRGSELATTOI-INIZCTEOSA-N 383.879 5.077 30 20 GKED CC(C)(C#N)CCC[S@@](=O)Cc1coc(-c2cc(Cl)cc(Cl)c2)n1 600929782 LAMOAHGVTMJEHD-XMMPIXPASA-N 385.316 5.227 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2ccccc2s1 603600864 IBHQNVXFSGKUFL-UHFFFAOYSA-N 385.448 5.521 30 20 GKED Cc1nc(C)c(C#N)c(S[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)n1 603910392 BHSHUZHNBKFXPB-OAHLLOKOSA-N 388.496 5.071 30 20 GKED C=CCOc1ccc(CNC(c2cccs2)c2cccs2)cc1Cl 606471037 NPLBWNYWZZCRAV-UHFFFAOYSA-N 375.946 5.907 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1ccc(Oc2ccccc2)cc1 608861140 WQVHFXOYXYENOA-HXUWFJFHSA-N 386.495 6.012 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1 608916167 MJLGGNCWBDUFET-UHFFFAOYSA-N 379.357 5.159 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccccc2F)n1 609377795 MZBVMUNRLXBJKO-ZDUSSCGKSA-N 397.500 5.453 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2Cc3ccccc3-c3ccccc3C2)c1 609517233 UVQHIRWOFNPEJN-UHFFFAOYSA-N 396.490 5.317 30 20 GKED N#CCCn1cc(CNCc2ccc(-c3ccccc3)o2)c(-c2ccccc2)n1 609598770 MKJKWGQVMIJKIO-UHFFFAOYSA-N 382.467 5.014 30 20 GKED COc1ccccc1N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 611183559 OVTQBNXVBXZINI-UHFFFAOYSA-N 392.842 5.289 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sc2nccc(C)c2c1C 642129601 HVNUVDJIELKQIB-UHFFFAOYSA-N 376.934 5.456 30 20 GKED Nc1cccc(C[P+](C2CCCCC2)(C2CCCCC2)C2CCCCC2)c1 642813894 CTPPJSKFOYXWNM-UHFFFAOYSA-N 386.584 7.785 30 20 GKED CC(F)(F)CCC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494235 FIYQBNZXTYJLKI-UHFFFAOYSA-N 381.238 5.350 30 20 GKED FC(F)(F)Oc1cccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 678207839 FPRILTDLFKKABI-PHIMTYICSA-N 395.265 5.148 30 20 GKED N#Cc1ccc(NC(=S)N(CCc2ccccc2)C2CCCC2)cc1Cl 726485053 UHMVLTHNOVRTNF-UHFFFAOYSA-N 383.948 5.396 30 20 GKED CC(C)(C)CN(CCC#N)Cn1c(=S)sc2ccc(C(F)(F)F)cc21 729468490 VJDCIVRDKCGFJR-UHFFFAOYSA-N 387.496 5.670 30 20 GKED N#C[C@H](NC(=O)c1ccc(SC(F)F)cc1)c1c(Cl)cccc1Cl 730093104 YJBUFXJHYQQGGE-ZDUSSCGKSA-N 387.238 5.303 30 20 GKED CCc1ccccc1O[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2o1)c1ccccc1 730690271 QZZIZPSJBSUWKT-YADARESESA-N 396.446 5.387 30 20 GKED CC(C)c1cnc(COC(=O)c2ccccc2SCc2ccc(C#N)cc2)o1 733376001 MBGPZKWYYNTEJM-UHFFFAOYSA-N 392.480 5.319 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2oc3ccc(Cl)cc3c2C)c1 733771968 UOKAYGWDFJCSGV-INIZCTEOSA-N 382.847 5.006 30 20 GKED C=CCCCCCN(C)C(=O)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 740510452 PWAVUVAKUNSPGW-UHFFFAOYSA-N 378.476 5.245 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)/C=C/c2ccccc2C#N)cc1 741639894 IVMQJOYQEIECPB-WXWBBQJKSA-N 382.463 5.124 30 20 GKED N#Cc1cccc(-c2nnc(CSc3nc(-c4ccccc4)cs3)o2)c1 741853784 KTXPVORPANXUAL-UHFFFAOYSA-N 376.466 5.024 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 745828822 WCXYXMUILMGDQD-CYFREDJKSA-N 385.511 5.768 30 20 GKED CC(C)OC1CCC(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 752183250 DNUWUDZIIQDWGT-XPPIMPSXSA-N 391.515 5.200 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)C2)c1 752485946 UPDSELPAOMHSSH-UKILVPOCSA-N 395.506 5.672 30 20 GKED CCCCSc1ccc(Cl)cc1C(=O)NCc1ccc(OCC#N)cc1 755236611 QUEKFNOZDMDWNH-UHFFFAOYSA-N 388.920 5.065 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cs1)c1nc2cc(C(F)(F)F)ccc2s1 759441988 WIMJJJYHBXOVPA-SECBINFHSA-N 386.807 5.520 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(Cl)c1 766385313 VLESBRJWOOVTHD-AWEZNQCLSA-N 376.909 5.264 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ccc(Cl)cn2)cc1OCC 767535960 TTYVYCOJPHMSNL-UHFFFAOYSA-N 383.275 5.127 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)c1 772982660 DSCVJSKAVWCBPO-IFXJQAMLSA-N 375.299 5.451 30 20 GKED COc1cc(NCc2ccc(C(C)(C)C#N)cc2)ccc1NC(=O)OC(C)(C)C 774283173 YGUCAFYKTXZXPT-UHFFFAOYSA-N 395.503 5.455 30 20 GKED CCc1ccccc1CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 785880492 LMIPJASHIWJFOA-OAHLLOKOSA-N 388.414 5.296 30 20 GKED C#CCC1(C(=O)N2CCC[C@@H](c3nc4ccccc4n3C(C)C)C2)CCCCC1 788511655 CZHAMGNSSAHLCS-HXUWFJFHSA-N 391.559 5.297 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)ccc1Cl 789903214 PORJNMRFDWMERO-QFIPXVFZSA-N 390.870 5.130 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCc2[nH]c3ccc(Cl)cc3c21 790603035 IOLBZZAISZJVMP-UKTHLTGXSA-N 391.883 5.552 30 20 GKED C[C@H](OC(=O)c1csc(C(F)(F)F)n1)c1ccc(F)c(C(F)(F)F)c1 790875413 DSPLDFWWAHLYMC-LURJTMIESA-N 387.276 5.238 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C2(c3c(Cl)cccc3Cl)CC2)s1 797570936 MCNYOZNWJQXURB-NSHDSACASA-N 393.339 5.655 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cn(C(C)C)nc2C)CC3)cc1 798370215 GLNLPYUTIRNTMQ-LFIBNONCSA-N 393.512 5.117 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc2c(c1)CCN2C(=O)OC(C)(C)C 800153224 ZVLGMJDHYCPLIR-UHFFFAOYSA-N 392.499 5.355 30 20 GKED C=CCCCCCCCNC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 812493259 CHPFLEDGVIKSNP-NHCUHLMSSA-N 376.516 5.214 30 20 GKED C#CC[C@@H]1CCCN(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)C1 831759639 JINGXZQFSSJAOV-CYBMUJFWSA-N 393.434 5.096 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(C4CC4)c3)n2)cc1 842296520 YOVCVKXFVUJPSV-FQEVSTJZSA-N 388.492 5.115 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1C[C@H]2[C@@H](C1)C2(F)F 902590949 UEHHYFBYSHNGMC-XQLPTFJDSA-N 396.528 5.044 30 20 GKED Cc1c(/C=C(/C(=O)C(=O)O)c2ccc3ccccc3n2)sc2cc(F)ccc12 1776116943 LENQRDJHVQKUKQ-LFIBNONCSA-N 391.423 5.091 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2ccc(O[C@@H](C)C(=O)O)cc2)cc1 1776125993 ZBVJTQJDGSIWHJ-BXUGYJKXSA-N 382.456 5.004 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C)c(Br)c1C 1776784347 YDHFWUXMHRQMRB-KRWDZBQOSA-N 384.358 5.359 30 20 GKED CN(Cc1cccs1)c1ccc(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1 1777077213 KBUSLNODBSYVLB-TWGQIWQCSA-N 383.494 5.040 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cnccc3C(F)(F)F)cc2)cc1 1777671126 GJAPFLWGWWYWHA-KMKOMSMNSA-N 397.352 5.362 30 20 GKED CCOCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 51285578 AIASLGFBFKRNBY-CYBMUJFWSA-N 383.300 5.110 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2nc(-c3ccccc3)no2)n1 53064586 JYJLYIRTDPELOL-LLVKDONJSA-N 390.390 5.184 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cccc(C)c2)cs1 54897114 ZHAMSRSHOFGARC-FMIVXFBMSA-N 376.481 5.341 30 20 GKED CCc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 66544739 JNYMAXDJLDGYMC-HXUWFJFHSA-N 385.492 5.053 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 110185738 MWFFYWIPCOOOHG-UHFFFAOYSA-N 392.842 5.216 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1cncc(F)c1 150954270 SEJAQLGZMPLBFU-CMDGGOBGSA-N 380.806 5.023 30 20 GKED CC(C)(C#N)CCCNc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 153531418 JRGAMHGMTQPVPL-UHFFFAOYSA-N 379.382 5.293 30 20 GKED COc1ccccc1SCC(=O)Nc1sc(-c2ccccc2)cc1C#N 154424740 JBUISPCUSCVLFY-UHFFFAOYSA-N 380.494 5.026 30 20 GKED CC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1C 155470264 SAXTWGQSPCNBSU-UHFFFAOYSA-N 399.450 5.178 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c2c1 182036883 GMACNENRXOHNQU-INIZCTEOSA-N 385.467 5.272 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)n1 183379798 CNMJEXXPHKMJMQ-AWEZNQCLSA-N 394.500 5.294 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(-c2ccccc2)on1 191503769 SSLBIIHOLALNBI-UHFFFAOYSA-N 375.472 5.515 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2Cl)C(C)C)cc1OCCCC#N 237154797 MTVVHYPZOBTEGO-JOCHJYFZSA-N 386.923 5.518 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 303507161 SGFGYALIHKJQMJ-ZIAGYGMSSA-N 391.323 5.741 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@@H](C)C[C@@H](C)C2 410994852 BQZFDGSKIMIREE-NEPJUHHUSA-N 395.484 5.043 30 20 GKED N#CCCC[C@@H](NC(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1)c1ccccc1 413573518 JEIPECWQJGEEBC-XZOQPEGZSA-N 387.527 5.401 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(CCC(F)(F)F)c1 425659155 KJYALOXIVKIELT-AWEZNQCLSA-N 375.394 5.278 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(C3CC3)nc3ccc(F)cc23)s1 430589156 CLRAUXATRBCVLH-MRXNPFEDSA-N 393.487 5.495 30 20 GKED N#CCSc1cccc(C(=O)N2Cc3ccccc3C[C@H]2c2ccccc2)c1 430626127 RFGYDSXTWJFVQG-QHCPKHFHSA-N 384.504 5.242 30 20 GKED CCCOc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1OCC 430645732 OFFFJCSMDXEIIZ-HNNXBMFYSA-N 386.517 5.118 30 20 GKED Cc1c(C#N)cccc1NC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12 432325779 MKMLCXCXJYWTGH-ZDUSSCGKSA-N 381.888 5.188 30 20 GKED O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)C1CCC(C(F)(F)F)CC1 436034304 NNMISJUKYCNXOB-KJHLLKJSSA-N 389.286 5.053 30 20 GKED CCN(C(=O)c1cc(C#N)cs1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 437569754 OQRIGUWKJHUKHZ-JOCHJYFZSA-N 389.524 5.390 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)c1ccc(C#N)cc1 439599875 YKNJMVMNIBOYAN-CQSZACIVSA-N 383.373 5.937 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)O1 440372835 DSBBNDGVJGXEJB-BPAFIMBUSA-N 382.891 5.282 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Sc1ccccc1)c1ccc(C(F)(F)F)cn1 442613679 DOFIMUSZWOJZKC-QGZVFWFLSA-N 398.409 5.742 30 20 GKED CC[C@H](CC#N)NC(=O)c1c(Cl)cccc1Oc1ccc(F)c(Cl)c1 444322851 JZNHZSHPFXFTKD-LLVKDONJSA-N 381.234 5.347 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@@H]1C[C@@H](C)O)c1ccc(C(F)(F)F)cc1 448153984 GVUOXLZBRAHQHH-LZQZEXGQSA-N 398.469 5.048 30 20 GKED Cc1c(Cl)cccc1-n1c(S[C@@H]2CC[C@@H](C#N)C2)nnc1-c1ccncc1 450632221 MHPWFWSHMQVCIF-GDBMZVCRSA-N 395.919 5.076 30 20 GKED Cc1c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cccc1-c1ncco1 455488161 KPLWFIVDMVRKCD-UHFFFAOYSA-N 388.471 5.212 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCCc2c(F)cc(F)cc21)c1ccccc1 458835175 JVZOPCSPFYNCSZ-RTWAWAEBSA-N 383.442 5.077 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCCCCc4ccccc43)o2)cc1 460482892 JQRINAOETJOZMW-UHFFFAOYSA-N 386.451 5.103 30 20 GKED C[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)c2ccccc12 462453280 BYLRAWVKIYQNAC-CQSZACIVSA-N 388.858 5.266 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 464163200 HUALIKDTKBXLKC-OAQYLSRUSA-N 381.863 5.062 30 20 GKED N#Cc1ccc(CNC(=O)N(Cc2cccc3ccccc23)C2CCCC2)cc1 465528685 PSHPCRQNDFHZHS-UHFFFAOYSA-N 383.495 5.366 30 20 GKED C=CCCN(C)C(=O)C/C(=C\c1cccc(OC)c1)c1nc2ccccc2s1 468180443 QVCLDVVERQIFLM-NBVRZTHBSA-N 392.524 5.270 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c(C)c1 471280584 WFBNAKAKTLRQLO-MOPGFXCFSA-N 393.556 5.719 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)C[C@H](CC#N)c4ccccc4)CC3)c[nH]c2c1 474904008 CTFHGZGYNQJDHC-NRFANRHFSA-N 383.495 5.180 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(-c2ccccc2)ns1 475795325 QSDRGRLJLZCFNJ-UYAOXDASSA-N 388.496 5.114 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)[C@H](C)c1ccccc1C(F)(F)F 476503045 AXKIBXYYAIPNOM-BQFCYCMXSA-N 388.433 5.401 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1OCC 483218262 GPOOXEIMIMUSRB-HXUWFJFHSA-N 388.467 5.302 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487545556 TYJUXKGAGIWYIB-LIRRHRJNSA-N 391.298 5.312 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)ccc1C(F)(F)F 489682140 VGMPFDOOBGRDAL-UHFFFAOYSA-N 395.812 5.673 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)c1 490477911 GCKUXUNVBMHMIG-UHFFFAOYSA-N 385.448 5.219 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)CC(C)(C)C#N 498997969 VAILYXGLJRQHOR-UHFFFAOYSA-N 392.478 5.610 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc2ncccc2c1 500736236 CDHIISRULJBLAH-UHFFFAOYSA-N 379.419 5.460 30 20 GKED CC(C)Cn1ccc2cc(NC(=O)Nc3cccc(OCCCC#N)c3)ccc21 502496392 IQOPNONLIXAGLR-UHFFFAOYSA-N 390.487 5.624 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1ccco1)c1ccccc1OC 505061964 NWYXQLCNDAGXPP-JOCHJYFZSA-N 376.456 5.318 30 20 GKED CN(Cc1ccc(C#N)cc1)Cc1csc(-c2cccc(Br)c2)n1 507202694 KNRCGZYZERFWRV-UHFFFAOYSA-N 398.329 5.076 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)n1 507830506 MHVPYKHHXCXQQL-HNNXBMFYSA-N 392.459 5.258 30 20 GKED C=CCn1c(SC[C@H](OC)c2ccc(Cl)cc2)nnc1-c1ccoc1C 509098794 LMTZOGXPWRUOPE-KRWDZBQOSA-N 389.908 5.166 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccc(C(F)(F)F)c1 517605417 CMQVNAHUQJDGQW-HBMCJLEFSA-N 394.396 5.343 30 20 GKED N#CCc1ccc(NC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)cc1 518038436 DIURTLAONKJQFE-OAQYLSRUSA-N 376.456 5.364 30 20 GKED C=C(C)CN1CCC(NC(=O)C(CC)(CC)c2ccc(Cl)c(Cl)c2)CC1 521573882 VYGLGDNZIHXMCH-UHFFFAOYSA-N 397.390 5.208 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccccc1SCCC#N 523087180 SPLQDJMAWARGCR-AWEZNQCLSA-N 392.446 5.528 30 20 GKED CCc1c(C)sc(NC(=O)C(C)(C)c2cccc(Br)c2)c1C#N 524329798 BWTTXEVRIROEAJ-UHFFFAOYSA-N 391.334 5.169 30 20 GKED Cc1ccc(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)c(Br)c1 533647985 GMYFARRRJFVAJT-AWEZNQCLSA-N 398.087 5.059 30 20 GKED C[C@@H](N[C@H]1CCc2c(Br)cc(Cl)cc21)c1ccc(C#N)cc1 534793392 NALMCTRODRXHMI-ZMZPIMSZSA-N 375.697 5.312 30 20 GKED Cc1sc(NC(=O)c2ccc(CC#N)cc2)nc1-c1ccc(OC(F)F)cc1 535353225 DIHOAVJJNDPQBJ-UHFFFAOYSA-N 399.422 5.038 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 535535899 VPISNVNQYFKBJF-VWNXMTODSA-N 396.494 5.361 30 20 GKED C=CCC[C@H](NCc1nc(-c2ccccc2)no1)c1ccc(C(F)(F)F)cc1 538229299 GIDBUENXEJDPSU-SFHVURJKSA-N 387.405 5.553 30 20 GKED COc1cc(C)c([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1OC 539214402 JXIPLWRHJMAVHT-GOSISDBHSA-N 386.495 5.402 30 20 GKED COCCOc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1 540314670 UBVXBKXVPQLIJO-IBGZPJMESA-N 386.495 5.101 30 20 GKED CC[C@H]1C[C@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 541007219 IOUJVILJYPZOAQ-GCJKJVERSA-N 396.918 5.340 30 20 GKED N#CCC1CCN(C(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)CC1 541984362 XCGCSADUVHRCQA-UHFFFAOYSA-N 378.438 5.060 30 20 GKED COC(=O)c1cc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)s1 542942857 WUMHWPNJSOFBAQ-OAHLLOKOSA-N 390.508 5.233 30 20 GKED CC(C)c1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 543821543 YXEZFPLJRHJRBU-NRFANRHFSA-N 381.545 5.296 30 20 GKED C=CCOc1cccc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 553384177 BZNBIXFZFZETQL-JOCHJYFZSA-N 375.472 5.492 30 20 GKED Cc1cc2cc(CNC(=O)Nc3ccccc3S[C@H](C)CC#N)ccc2[nH]1 562166216 BJIIQEGXLKLWQY-OAHLLOKOSA-N 378.501 5.192 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 568353324 YAGDQTAZQZHLCZ-ZWKOTPCHSA-N 396.556 6.002 30 20 GKED COc1cc(Cl)c(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1C 573602870 TUEAXQUFTRIAKU-UHFFFAOYSA-N 381.863 5.168 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C2CC2)[C@@H]1C1CC1 574886478 NRNCPWAYUJOSEB-GGAORHGYSA-N 387.483 5.311 30 20 GKED C=CCCC1(c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)CC1 577560901 SCWYKMLUEZJCCU-UHFFFAOYSA-N 375.350 5.408 30 20 GKED C=CCCCCCNC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 581615757 RXTKPIYVQPOOMO-UHFFFAOYSA-N 375.856 5.053 30 20 GKED N#Cc1ccc2ncc(CN[C@@H](c3ccccc3)c3ccc4ccccc4c3)n2c1 582077960 SYJRRMKSZSANIJ-SANMLTNESA-N 388.474 5.238 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)CCCCCC#N 588157327 FIRWZCCHUMDGGX-CYBMUJFWSA-N 375.925 5.423 30 20 GKED N#CCCCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 588756796 VMEBNRHXKIHSCA-UHFFFAOYSA-N 380.382 5.475 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC(C3CC3)CC2)cc1 590430218 WMBZXURCPQDDNU-UHFFFAOYSA-N 376.525 5.113 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc(-c2ccccc2)cs1 595869377 LPBFEEJKHXRGGO-FQEVSTJZSA-N 388.492 5.622 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC[C@@H](CCF)C2)cc1 598219324 HIQFPLSUJWXPJA-SFHVURJKSA-N 382.504 5.062 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C3(C#N)CC3)cc2)c1 602760660 QDMPOZUWBWCOTF-HSZRJFAPSA-N 379.463 5.321 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc4c[nH]nc34)cc2Cl)cc1 604193376 LOCSYJLMSAARQE-UHFFFAOYSA-N 388.814 5.133 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1cccc(C#Cc2cccs2)c1 606938994 VWUNQQBRJWBLSA-QFIPXVFZSA-N 389.524 5.548 30 20 GKED CCc1c(C)sc(NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)c1C#N 609031729 URRUCTXJUGSACB-UHFFFAOYSA-N 394.500 5.090 30 20 GKED CC(C)C[C@H](NC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccs1 609059719 LLCDUDWLPNRRRY-IBGZPJMESA-N 394.496 5.309 30 20 GKED Cc1ccc(Oc2ccccc2CNC(=O)N(C)Cc2cccc(C#N)c2)cc1 609293651 SAWLAZCKMOJPDV-UHFFFAOYSA-N 385.467 5.001 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 609432429 NRBYLWWEGXFEMC-QGZVFWFLSA-N 385.467 5.352 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609682257 FMVOHMZOXDBDPI-WIYYLYMNSA-N 397.478 5.760 30 20 GKED CCN(C(=O)C[C@H](C)c1ccccc1C(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 610171621 XQAZPRYOSCTAAT-HOTGVXAUSA-N 388.433 5.680 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@@H]3c3cccc(F)c3)cc2)cc1 610304873 VWCHWRDFIHCJCP-HSZRJFAPSA-N 386.426 5.271 30 20 GKED C=CCN(C(=O)c1oc2c(F)cccc2c1C)c1nc(-c2ccccc2)cs1 613676952 OESWZBMQDCUDGG-UHFFFAOYSA-N 392.455 5.837 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccccc1COCc1ccccc1 618751194 UGGRHMJWHPHJHS-DEOSSOPVSA-N 397.478 5.084 30 20 GKED Fc1ccccc1-c1csc(N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 645033544 QNPLCVLRDAOENS-NXEZZACHSA-N 398.347 5.516 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 683634655 DOUDDELNYBAIND-SNVBAGLBSA-N 394.718 5.113 30 20 GKED COc1cc2c(cc1F)CC[C@@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 684953210 DPHYXUXYFZKTRH-YFCNSXCBSA-N 399.350 5.321 30 20 GKED Cc1oc(-c2ccsc2)nc1CON=Cc1ccccc1Br 726786809 BQDNJALJPBXMEA-UHFFFAOYSA-N 377.263 5.025 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728464973 DUEKBXQCVDCRQZ-MBSDFSHPSA-N 384.479 5.483 30 20 GKED C#Cc1cccc(N(C)C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)c1 728481819 OIFIZVCJOLYYKP-UHFFFAOYSA-N 387.291 5.375 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2ccco2)nc2ccccc12)c1ccc(Cl)cc1 730092207 DFITZYPOZQCNIL-HXUWFJFHSA-N 387.826 5.143 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417785 SOCCOMABHNMDGR-SUMWQHHRSA-N 396.487 5.377 30 20 GKED N#Cc1ccc(-c2cccc(CNc3nc(C(F)(F)F)ccc3C#N)c2)s1 739890497 PCAVDPMWWGGCEH-UHFFFAOYSA-N 384.386 5.184 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740449345 XOKHJFUMPJRZPQ-HNNXBMFYSA-N 391.496 5.316 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2c(Cl)nc3ccccn23)cc1 741468245 DPSUGDDMCIAVMM-BUHFOSPRSA-N 388.854 5.559 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(Cl)ccc2OC2CCCC2)c1 742709755 PKAFESKCCWNHJC-FQEVSTJZSA-N 398.934 5.632 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@]12CCCc1ccccc12)c1nc(-c2ccccc2)cs1 744037516 XJXYHWJTTPWPPL-WWEVIYMKSA-N 384.504 5.281 30 20 GKED O=C(/C=C\c1c(Cl)ccc(Cl)c1Cl)c1cccc(N2CCOC2=O)c1 745626914 VNWWRADBOVXFFD-DAXSKMNVSA-N 396.657 5.500 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CSc2cc(Cl)ccc2Cl)n1 747197385 FVLAIBIPLUMTEI-LLVKDONJSA-N 385.341 5.542 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(N(C)CCC#N)cc3)cc2)cs1 754823072 ZJIMYHHKIVIOGY-KRWDZBQOSA-N 390.556 5.319 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccccc2F)c2nccn2C)cc1 764814666 OBYGNZJQCWPWDE-IIBYNOLFSA-N 399.897 5.131 30 20 GKED C=CC[C@@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 766018242 GTSQQEYDIRADFS-SJKOYZFVSA-N 388.355 6.087 30 20 GKED N#C[C@H](COC(=O)c1cncc(-c2ccc(Cl)cc2)c1)Cc1cccs1 772735307 RJVIBKBKWDHLJK-CQSZACIVSA-N 382.872 5.003 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(CC(C)C)cc2)ccc1OC 772979026 JZJUQRPBBNKMOK-XMSQKQJNSA-N 380.532 5.425 30 20 GKED CC[C@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1OC(F)F 775052785 XYNNBMPPQCHXOQ-INIZCTEOSA-N 380.822 5.085 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@H](c2ccco2)C1 775487081 HSTJMLFBKCHOKU-LEOXJPRUSA-N 399.494 5.940 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C\C(=O)c1ccc(N2CCOC2=O)cc1 781111718 QFPGMNKJZPNDMD-KAMYIIQDSA-N 399.446 5.215 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cccc(CC(C)C)c2)ccc1OC 796827375 UACURMQZHCTLTJ-AVRDEDQJSA-N 380.532 5.425 30 20 GKED COC[C@H](C)[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 813060475 ASPOQYPTCVHNDP-COPLHBTASA-N 397.327 5.212 30 20 GKED CC(C)(C#N)c1ccc(C(=O)O[C@@H](c2nc3ccccc3o2)C(F)(F)F)cc1 816063515 MTBVOMOXSZRRFF-INIZCTEOSA-N 388.345 5.089 30 20 GKED Cc1sc(C2(N[C@H](C)c3cc(C#N)ccn3)CCC2)nc1-c1ccccc1F 903000113 HUOFWGJXUVVBHP-CQSZACIVSA-N 392.503 5.254 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)c1nc(-c2ccccc2OCc2ccccc2)no1 904467015 TZEWBPHFGLMETH-GOSISDBHSA-N 395.462 5.533 30 20 GKED CC(C)n1ncc2cc(/C=C3/CSc4c(F)cccc4C3=O)c(Cl)nc21 913617843 VYJJLCWUHUUNMN-QPEQYQDCSA-N 387.867 5.177 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1ccc(NC(=O)NC(C)C)cc1 915049002 OZRVRHPRXOSKBY-UHFFFAOYSA-N 378.398 5.071 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1sccc1Br 915049638 XYNOMOWPYGWZMO-UHFFFAOYSA-N 398.635 5.414 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352188 ILZDSXDSNBZSRG-QFIPXVFZSA-N 387.508 5.624 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(-c2nc3ccccc3s2)cc1 915997421 XNWQYEAGSVNLGJ-UHFFFAOYSA-N 386.505 5.644 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1ccc2ccccc2n1 916286512 JEXNLTNEMQAWQJ-UHFFFAOYSA-N 393.853 5.027 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1sc2cccc(Cl)c2c1Cl 916900603 SCLNDQSQVPSWRF-LLVKDONJSA-N 389.263 5.169 30 20 GKED CCCCC1CCC(C(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)CC1 916902340 DXVHPWXISGHHMY-JITJBCMDSA-N 382.548 5.455 30 20 GKED CCCCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 916903901 UHAANNUVPRSQJP-NRFANRHFSA-N 376.500 5.115 30 20 GKED Cc1cccc(CSCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917047091 QUUDOKSQDYIXEF-HNNXBMFYSA-N 386.929 5.368 30 20 GKED CCCOc1ccc(C=NOCc2c(Cl)ccc3cccnc23)cc1OC 917395587 SPVPNWOJXXGOOI-UHFFFAOYSA-N 384.863 5.236 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1sc2c(C)cc(C)cc2c1C 1776034790 YTGLMKTYLMLEBG-UHFFFAOYSA-N 386.904 6.014 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3ccc(F)cc3Cl)c2)c1 1776106825 XMHGAGKWZCFFTN-UHFFFAOYSA-N 398.821 5.202 30 20 GKED O=C(O)c1cccc(-c2ccc(C=Nn3c4ccccc4c4ccccc43)s2)c1 1776112706 HEBPJKOLXHHMOB-UHFFFAOYSA-N 396.471 6.103 30 20 GKED CC(C)[C@H]1/C(=C/c2cc(Br)cc(C(=O)O)c2)C(=O)c2ccccc21 1776308803 QEAMFRRQNIESDD-ZTXRYZOMSA-N 385.257 5.167 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(F)c(Cl)c1Cl 1776354400 KVMOSLISOQFGKX-DAXSKMNVSA-N 397.229 5.514 30 20 GKED CCCCCCCCOCCCN=c1c(C(=O)O)c[nH]c2c(C)c(C)ccc12 1776785392 NUQOZHMCNIYWPB-UHFFFAOYSA-N 386.536 5.151 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCC(F)(F)C[C@@H]2C(=O)O)cc1 1776787540 SGQYARWVGUUJMU-QGZVFWFLSA-N 399.503 5.074 30 20 GKED CCCCCCCSc1ccc(C(=O)N[C@@H](CC(=O)O)c2ccccc2)cc1 1776787546 VRCVWBCUXVRGRI-NRFANRHFSA-N 399.556 5.695 30 20 GKED CCCCCCOc1ccc(/C=C2/CCc3occ(C(=O)O)c3C2=O)cc1OC 1776788930 JACXBLKTKJOMLF-VBKFSLOCSA-N 398.455 5.158 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccccc2CC)[n+]2ccccc2)cc1 14871922 PLQMQJABGGXHJJ-UHFFFAOYSA-O 389.544 5.150 30 20 GKED Cc1cc(SCC(=O)N(CCC#N)c2cccc(Cl)c2)nc2ccccc12 22354086 KELAUHVTSXOALD-UHFFFAOYSA-N 395.915 5.236 30 20 GKED Cc1cccc(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)c1 22729145 CHNDVGIEIAZWPK-UHFFFAOYSA-O 381.546 5.012 30 20 GKED COCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)sc2cccc(F)c12 25438790 AVEGTEMKHOAMIM-UHFFFAOYSA-N 382.460 5.240 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(-c4cnco4)cc3)c2)c1 47833497 QTCZFSYEVBNRKJ-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1c(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)cccc1-c1ccccn1 119396540 AXLSSRXKBIBHCU-UHFFFAOYSA-N 396.475 5.305 30 20 GKED C#CCCOc1ccc(CNc2ccc(NC(=O)N3CCCCCC3)cc2)cc1 126220730 QHHXKAZQZDADMP-UHFFFAOYSA-N 391.515 5.109 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 132820070 JIRXWBVIOLHRFL-LPHOPBHVSA-N 390.512 5.215 30 20 GKED Cc1ccnc(Oc2cc(NCc3nnc(-c4ccc(C#N)cc4)o3)ccc2C)c1 134007613 KMWHKEUEOPXQFU-UHFFFAOYSA-N 397.438 5.025 30 20 GKED CCOCCC1(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)CCCC1 134971414 BSKZZWHHCFLFPZ-QGZVFWFLSA-N 389.565 5.047 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 163108869 MXTNKDFDFUEQNZ-AZUAARDMSA-N 398.528 5.123 30 20 GKED Cc1cnc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)s1 173122430 PMSPRSLVBGBEQP-SJKOYZFVSA-N 386.546 5.119 30 20 GKED C=CCC[C@H](NCc1csc(N(C(C)=O)c2ccccc2)n1)c1ccccc1 180040981 NFPNZSDEKWPMLF-QFIPXVFZSA-N 391.540 5.625 30 20 GKED Cc1cc(Cl)c(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1C 180458773 LEAYOWNIARZCNP-UHFFFAOYSA-N 391.858 5.577 30 20 GKED OC(=Nc1c[nH]nc1-c1ccccc1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329437067 JYRLMPNDQGTYRR-SFHVURJKSA-N 389.503 5.172 30 20 GKED CC(C)c1nc([C@@H]2CCCN2C(O)=Nc2ncc(C3CCCCC3)s2)no1 329442406 KGAFBMPAICJUST-AWEZNQCLSA-N 389.525 5.080 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(Cl)c1OCC(F)F 425669168 BDLOWDMPYLWZQR-GFCCVEGCSA-N 393.821 5.080 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@@H](CCCC#N)c1ccccc1 431845424 OIMLMWAEMWRALG-PMACEKPBSA-N 379.504 5.336 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1(c2cccc(C#N)c2)CC1 435361469 LIZKCFCSOABIIW-IBGZPJMESA-N 396.490 5.677 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccnc(Oc2ccccc2)c1 438481135 CLUUWSDPEOHTKK-FGZHOGPDSA-N 398.466 5.178 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(Oc2ccccn2)c1 438655433 KDOICJYPOAIQAD-FGZHOGPDSA-N 398.466 5.178 30 20 GKED N#CC1CCC(CNCc2cn(-c3ccccc3)nc2-c2ccc(F)cc2)CC1 441386220 UGHNNOQSEVRHRO-UHFFFAOYSA-N 388.490 5.098 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1cscn1)c1ccc(C(F)(F)F)cc1 441529490 LGUFYBORVRYUDI-MRXNPFEDSA-N 383.439 5.011 30 20 GKED C[C@H](C(=O)Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1cccc(C#N)c1 461898909 CCKBPAKHSASZLI-LBPRGKRZSA-N 399.422 5.025 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCc3cncc4ccccc34)cc2)c1 462479447 LQVOUOBNAFTCGF-UHFFFAOYSA-N 393.446 5.470 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464474309 KAXWAESEYJFAKL-IBGZPJMESA-N 391.352 5.129 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 464715487 YALFYHFISJHOJB-LJQANCHMSA-N 396.487 5.532 30 20 GKED CCS(=O)(=O)c1ccc(N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 466448633 LGMOUNXFZLGNLR-KRWDZBQOSA-N 390.508 5.192 30 20 GKED N#CCCn1cc(C(=O)CN(Cc2ccco2)c2ccccc2)c2ccccc21 472242929 QDRVFSUQDLUUAJ-UHFFFAOYSA-N 383.451 5.037 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1cc2cccc(F)c2o1 473875082 JUZILPQIZSTBFT-CVAIRZPRSA-N 391.446 5.114 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C[C@H]1COc2ccccc2O1 475558450 JMCRJYKHXMHMBR-IBGZPJMESA-N 394.515 5.232 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(CC(C)C)c1C(C)C 475569548 JLLYXEPEIXEVFF-UHFFFAOYSA-N 382.552 6.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(Cl)c(Cl)c1 476127979 BGFBTZMFPBRYRR-UHFFFAOYSA-N 378.299 5.863 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(Br)ccc2NC2CC2)cc1 476193761 JVBRKHHYNHJSSP-UHFFFAOYSA-N 398.304 5.077 30 20 GKED Cc1ccccc1NC(=O)c1cc2ccccc2cc1OCCCC(C)(C)C#N 476496586 SPKIKUYUECHLQT-UHFFFAOYSA-N 386.495 6.109 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccc(F)c(F)c1 480929033 PUSWZOUQCFLWKX-YJYMSZOUSA-N 388.462 5.449 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(OC2CCC2)cc1Cl)c1ccccc1 487362609 WEFCWBIBJBVIGK-NRFANRHFSA-N 382.891 5.436 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)c(C)c2)ccc1OCc1ccccc1 488132883 YAUXYVLLYVYOHN-LJQANCHMSA-N 386.495 5.305 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1cccc(OCc2cccc(Cl)c2)c1 497490879 YFDKAYBNTOMNBR-UHFFFAOYSA-N 390.870 5.063 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)c1ccc(C(F)(F)F)cc1 499958790 PRQMXOFEACVNJM-SJCJKPOMSA-N 380.797 5.233 30 20 GKED N#CCCCOc1cccc(CNCc2ccccc2Sc2ccccc2)c1 501353269 XFBYTIUGLOQMFP-UHFFFAOYSA-N 388.536 5.810 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3ccc(Cl)cc3)c2)cc1 501453151 SADNVNRYFKDDPM-UHFFFAOYSA-N 390.870 5.166 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 505000763 JTPOSEFYOPXKJA-HXUWFJFHSA-N 394.906 5.704 30 20 GKED Fc1cccc(F)c1[C@@H](NCc1ccccc1OCC(F)(F)F)C(F)(F)F 506307675 NZYZMFWYGAEFMH-OAHLLOKOSA-N 399.281 5.299 30 20 GKED COc1ccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)c2c1 507917461 ACVZMFVCAFYJHM-UHFFFAOYSA-N 397.434 5.022 30 20 GKED C[C@@H]1C[C@@H](C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 510023640 NXWWKCBTQULAQZ-JXXFODFXSA-N 381.907 5.505 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2C2CCCC2)cc1 510694682 ZKKTYWOHTLUVNA-OAQYLSRUSA-N 375.472 5.537 30 20 GKED N#Cc1ccc(N2CCC(N[C@@H]3CCSc4ccc(Cl)cc43)CC2)cc1 513690186 HXJURGLATQUXTI-HXUWFJFHSA-N 383.948 5.007 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)CC1 516764695 JNFBARCHFLRBHR-NRFANRHFSA-N 381.907 5.155 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1cccc(Cl)c1Cl 518207192 BCVHEELCIRYRGW-OAHLLOKOSA-N 389.213 5.387 30 20 GKED CCSc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 518516687 SEIFDMVKYCANJJ-QGZVFWFLSA-N 394.521 5.421 30 20 GKED Cc1c([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)oc2ccccc12 519888998 QLUCGYRFHIKDRD-GOSISDBHSA-N 389.499 5.542 30 20 GKED CCN(C(=O)c1ccc(C)c(Oc2ccncc2)c1)[C@H](C)c1ccc(C#N)cc1 522305139 VPNRWWRXXCMFQZ-GOSISDBHSA-N 385.467 5.277 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1 525285860 HQTWSIPVIMAFRB-GFCCVEGCSA-N 395.311 5.263 30 20 GKED N#CCC[C@@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccccc1 536832651 KGROVZRHICCFGC-WOJBJXKFSA-N 391.515 5.961 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)N1CC=C(c2ccc(C#N)cc2)CC1 539320579 RAIVTQRNCVSNGO-UHFFFAOYSA-N 391.540 5.300 30 20 GKED CC(C)C[C@@H](NC(=O)N1CCC(CC#N)CC1)c1cccc(C(F)(F)F)c1 542894927 IIJPTGRAUVGBRW-GOSISDBHSA-N 381.442 5.128 30 20 GKED CCO[C@@H](C)c1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 543873898 PDEPYWLEUNWSPC-SJORKVTESA-N 391.540 5.630 30 20 GKED CSCc1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 554213493 XOWNVOPYZNJYIV-HNNXBMFYSA-N 385.558 5.123 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 554735842 YDYNODNZDMSGJI-DJJJIMSYSA-N 398.293 5.101 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCC2(F)CCC2)cc1Cl 558286828 KAMLUNPUKFZHBQ-GOSISDBHSA-N 385.870 5.399 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCN(C)c2ccccc21 560400093 OKNHHTBVKKLNBW-FUHWJXTLSA-N 394.544 5.174 30 20 GKED CC(C)Sc1ccccc1NC(=O)C1CCN(c2ccc(C#N)cc2F)CC1 560589059 XOPKMJUUWRXRSJ-UHFFFAOYSA-N 397.519 5.053 30 20 GKED N#Cc1cc(NC(=O)c2sc3ccccc3c2Br)ccc1Cl 567317604 ZBZJTFUEEDEHFI-UHFFFAOYSA-N 391.677 5.441 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 568804866 GDOPQIJPKDZEJS-LJQANCHMSA-N 380.492 5.215 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CC12CCSCC2 568837831 QCPWAGASGOROSR-LJQANCHMSA-N 378.497 5.131 30 20 GKED COc1ccc(C(=O)CC(C)(C)CC(=O)Nc2ccc(Cl)cc2CC#N)cc1 576290176 AKBJRPXSKAQBOE-UHFFFAOYSA-N 398.890 5.042 30 20 GKED N#CCCn1cc(CNc2ccc(Oc3cccnc3)cc2)c(-c2ccccc2)n1 588934552 YSJQIRJTJDOEKW-UHFFFAOYSA-N 395.466 5.263 30 20 GKED CCN(C(=O)[C@H](C)Cc1ccc(C#N)cc1)[C@H](c1ccc(C)cc1)c1cccnc1 593972405 CBYKGACTHYRHHF-CJFMBICVSA-N 397.522 5.078 30 20 GKED Cc1sc(C2(N[C@@H](C#N)c3ccccc3)CCC2)nc1-c1ccccc1F 595504467 CXTVYSNOHMGPCD-IBGZPJMESA-N 377.488 5.491 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ncoc3-c3ccccc3)n2)cc1 601618231 VWWWLFLPGGEWKE-KRWDZBQOSA-N 385.448 5.264 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 603800896 VYEXEFGJFRHCGX-VWLOTQADSA-N 397.522 5.464 30 20 GKED CCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 604495634 UWLZJCQOGFWGJH-CABCVRRESA-N 389.421 5.431 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)c1cccc(SC)c1 606776686 JBMZTESAVKIOLS-UHFFFAOYSA-N 381.419 5.269 30 20 GKED CCCc1ncc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 608552893 MPCGGJZBHIDFCF-JTQLQIEISA-N 395.431 5.214 30 20 GKED CCN(Cc1ccc2ccccc2c1)C(=O)Nc1cc(C#N)ccc1OC(F)F 609083079 PVPZGXGCCXHGPC-UHFFFAOYSA-N 395.409 5.367 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@H]1CCc2ccccc21 609371288 GJHXFZSTOBYTDS-BEFAXECRSA-N 382.554 5.440 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2oc3ccccc3c2CSC)cc1 609413492 FRHMNWHUFOAHTB-UHFFFAOYSA-N 394.496 5.255 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccc(Cl)c1 609438056 AJUBNLZDLRQKPP-YOEHRIQHSA-N 387.936 6.007 30 20 GKED CC(C)[C@@H](CC1CCCCC1)C(=O)N1CCC(Oc2cccc(C#N)c2)CC1 609644182 PBVYRKMWLBEFIK-HSZRJFAPSA-N 382.548 5.171 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Cl)c1SCC(F)F)c1cccc(C#N)c1 610326274 HSSROYMIGYPHDO-LLVKDONJSA-N 395.862 5.452 30 20 GKED C[C@@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccc(C#N)c1 610406989 OMXQSTWMUBIYAW-CQSZACIVSA-N 387.405 5.017 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1csc(COc2ccc(F)cc2)n1 614352837 MTNHCUTXMZVBFZ-UHFFFAOYSA-N 398.503 5.058 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](CC)c1ccccc1OC(F)F 615674867 KROMDAKEXYJRBG-GOSISDBHSA-N 392.421 5.276 30 20 GKED C[C@@H](CC(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1c[nH]c2ccccc12 618623673 NPZHNPKYYNHEJW-AWEZNQCLSA-N 386.480 5.295 30 20 GKED N#C[C@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)c1ccc(Cl)cc1 619863778 CVHMMHNAJBVLNJ-AWEZNQCLSA-N 393.802 5.348 30 20 GKED C=CCC1(NC(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)CCOCC1 665966547 IOBUALAMFHDLST-IBGZPJMESA-N 394.515 5.382 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1F 675737561 HTGDCNUDSSCCNR-UXCLJVHYSA-N 375.303 5.525 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)c1c(F)cc(C(F)(F)F)cc1F 685756697 UPZZTOVLCAMGSY-UHFFFAOYSA-N 383.238 5.341 30 20 GKED C#Cc1cccc(NC(=S)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)c1 726474855 KNPKNBKLBRZEGB-UHFFFAOYSA-N 397.956 5.240 30 20 GKED C=CCOc1ccccc1/C=C1/SC(=S)N([C@@H](C)c2cccs2)C1=O 726630835 XSWHIUDZEKYHMR-VLURKWGBSA-N 387.551 5.275 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2cc(-c3ccc(OC)cc3)c(C)s2)c1 728481144 KXAUNEGLPYQPNS-UHFFFAOYSA-N 375.493 5.380 30 20 GKED CC(C)N(CC(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Cl)cc1 728927648 WMKGSNGQLLZBOI-INIZCTEOSA-N 383.904 5.041 30 20 GKED N#C[C@H](C(=O)Cc1ccccc1C(F)(F)F)c1nc2cc(Cl)ccc2s1 729891670 LWMJJQYRBXKSGH-GFCCVEGCSA-N 394.805 5.387 30 20 GKED CC(C)(C)Cc1nc2cc(NC(=O)c3ccccc3SCC#N)ccc2o1 731198903 KXFOCLHVLFDSNR-UHFFFAOYSA-N 379.485 5.284 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741471577 BKUVKANHYOCDPW-QXMHVHEDSA-N 379.463 5.447 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SCC(F)F)cc2)ccc1SC 741842397 LDNOKDCSAGKEJQ-OQFOIZHKSA-N 380.481 5.670 30 20 GKED COc1ccc(CN[C@@H](CC(C)C)c2cccc(C(F)(F)F)c2)cc1C#N 742369608 OFKPOEGHGXFHCB-IBGZPJMESA-N 376.422 5.463 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 743475015 PNQHTBNVTHZJPT-GOSISDBHSA-N 395.462 5.965 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CSc2cc(Cl)ccc2Cl)n1 747197389 FVLAIBIPLUMTEI-NSHDSACASA-N 385.341 5.542 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2ccc(F)cc2OCC#N)c1Cl 760281865 JOGWYTZEBZHKHX-UHFFFAOYSA-N 384.263 5.152 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccc(F)cc1OCC#N 761669558 VHQXSBWFKSDCII-LLVKDONJSA-N 396.249 5.260 30 20 GKED N#CCCCn1cc(C(=O)OCc2ncc(Cl)cc2Cl)c2ccccc21 769543777 SOERBMMOBRMOCD-UHFFFAOYSA-N 388.254 5.004 30 20 GKED O=C(Nc1cccc(/C=C2/Cc3cc(O)ccc3C2=O)c1)c1ccccc1Cl 780188156 KBGQGPBEVYIUQM-YBEGLDIGSA-N 389.838 5.120 30 20 GKED CC(C)(C#N)CCCOC(=O)c1ccccc1SCc1ccc(C#N)cc1 781847583 VECCFKILYJPGGD-UHFFFAOYSA-N 378.497 5.337 30 20 GKED FC(F)(F)c1cccc(CCCC=NNc2nnc(-c3ccccn3)s2)c1 788031096 VGIVHUXGAVZONN-UHFFFAOYSA-N 391.422 5.040 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)[C@@H](C#N)c3nccc4ccccc34)o2)cc1 792102586 IQLZARGIHFQSNM-HXUWFJFHSA-N 381.435 5.007 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 793362057 RJLWGGGXJQYKEW-MRXNPFEDSA-N 397.450 5.199 30 20 GKED Cc1noc(C2CCC(=NNc3nc4cc(C(F)(F)F)ccc4s3)CC2)n1 797401183 DNYNVQCLVVBTSV-UHFFFAOYSA-N 395.410 5.132 30 20 GKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccn1 810531077 FPOTWWDEKNPVRH-SJORKVTESA-N 395.915 5.619 30 20 GKED Cc1cc(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)ccc1NC(=O)OC(C)(C)C 819736293 HALIZXLXMSMHAL-INIZCTEOSA-N 393.487 5.047 30 20 GKED N#C[C@@H]1CCC[C@@H](OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)C1 839048241 CMYATEBYFSBJTD-BXUZGUMPSA-N 380.391 5.068 30 20 GKED N#C[C@H](C(=O)CCc1ncc(-c2ccccc2Cl)o1)c1nc(C2CC2)cs1 842938575 LBOJTINHVDPORJ-CQSZACIVSA-N 397.887 5.138 30 20 GKED O=C(N[C@H](c1ccccc1)C(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 857441580 QWZFFGFXEFKHKB-ZIAGYGMSSA-N 379.275 5.136 30 20 GKED CCO[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)C 860475934 WNDHKKVGYZDKHQ-GUYCJALGSA-N 397.327 5.354 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)c1nc(-c2cccnc2Oc2ccccc2)no1 904454430 ONWBRQDUQIFMPS-UHFFFAOYSA-N 398.422 5.110 30 20 GKED COc1ccc(-c2cc(CON=Cc3cccc(Cl)c3Cl)on2)cc1 913029345 FVUBYOUTFGFZMI-UHFFFAOYSA-N 377.227 5.208 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCOc2ccc(F)cc2)cc1 915085188 IGCBPKIWVDOPFH-HSZRJFAPSA-N 388.442 5.279 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916050594 CYJCRCWDGVTSQT-QGZVFWFLSA-N 395.256 5.258 30 20 GKED COc1cc(/C=C\C(=O)c2ccncc2)ccc1OCc1ccc(Cl)cc1 916136483 PFGLNZFJVHGJQW-YWEYNIOJSA-N 379.843 5.219 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1ccc2ccccc2n1 916848814 IHATZGHSIYUWNI-INIZCTEOSA-N 399.277 5.577 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2cc(C)n(-c3ccc(C(C)C)cc3)c2C)nc(C)n1 916880751 WRCQOEPUFBEFFS-QFIPXVFZSA-N 386.499 5.114 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 919904665 RONYCIHPKTZTET-QHCPKHFHSA-N 387.458 5.188 30 20 GKED C#Cc1cccc(NC(=O)[C@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)c1 920022179 AEIUYSHOMVATPI-AWEZNQCLSA-N 396.899 5.237 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3[C@H](C=C(C)C)C3(C)C)n2)cc1 920139383 SQKIDSNZYLXOIJ-AOIWGVFYSA-N 380.513 5.233 30 20 GKED O=C(O)c1ccc2scc(C=NN=C3c4ccccc4-c4ccccc43)c2c1 1776027762 DSKWFOYXMYDKIG-UHFFFAOYSA-N 382.444 5.451 30 20 GKED CC[C@H](NN=C1CC[C@H](c2ccc(Cl)c(Cl)c2)c2ccccc21)C(=O)O 1776067572 DXSAKOWDOFHGKQ-ACJLOTCBSA-N 391.298 5.076 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2C(=O)O)c1)c1cc(F)ccc1F 1776113214 BNWGVWBLLXPDGU-FLIBITNWSA-N 394.373 5.138 30 20 GKED C=C(C)C[C@@H](NCc1cc(Cl)ccc1Oc1ccc(Cl)cc1)C(=O)O 1776137449 MKZNJZKODSJHHK-QGZVFWFLSA-N 380.271 5.295 30 20 GKED C=CCc1cc(C)c(OCCCN2CCC([C@H]3CCC[C@H]3C(=O)O)CC2)cc1C 1776188875 LGJZFLRYCLITMC-DHIUTWEWSA-N 399.575 5.014 30 20 GKED CC(C)(C#N)c1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776231039 VPCWRRXRQRGLMQ-LFYBBSHMSA-N 385.419 5.342 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C)c2nc(C(=O)O)cs2)c1 1776788093 RIFXGVHXZJZOBN-HNNXBMFYSA-N 376.522 5.041 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2ccc(CC(=O)O)cc2)cc1OC 1776789333 UHXNBWMESTVHMZ-UKTHLTGXSA-N 396.483 5.178 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H](Oc2ccccc2)c2ccccc2)c1 55570468 KXMPFBHBWGGZLS-HSZRJFAPSA-N 386.451 5.128 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cccc(CC#N)c1 57407655 KUICQTHLRGQSMC-UHFFFAOYSA-N 390.414 5.253 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)Cc1coc(-c2cccc(Cl)c2)n1 63381191 KCVKYAAAKMNURC-UHFFFAOYSA-N 383.835 5.091 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(-c2cccs2)no1 72030811 GJGYANMTVVPKIQ-CQSZACIVSA-N 388.452 5.635 30 20 GKED N#C[C@@H](NC(=O)[C@H]1CCCc2ccccc21)c1ccc(OCc2ccccc2)cc1 72096708 XMZRMCFRAZHMHQ-LOSJGSFVSA-N 396.490 5.067 30 20 GKED COc1ccccc1CC(C)(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 112582352 JMEHFLNFBCRYGQ-INIZCTEOSA-N 382.529 5.154 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccccc3C(F)(F)F)c2)c1 114996085 SRTIVXAVOOLHLT-UHFFFAOYSA-N 396.368 5.408 30 20 GKED C=C[C@H](CC(=O)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1)c1ccccc1 126755720 SIZKHDDQBCBDQG-WIYYLYMNSA-N 387.483 5.150 30 20 GKED CC[C@@H](C#N)Sc1nnc(-c2cccnc2)n1-c1ccc(Cl)c(Cl)c1 127090295 YZTYTNZAKVKGNW-ZDUSSCGKSA-N 390.299 5.030 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(Cl)cc1C 131901797 LEVPFIMUPZKBIM-UHFFFAOYSA-N 377.831 5.268 30 20 GKED COc1ccc(C[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 136902809 XFWLUOTWUBRCSZ-MLGOLLRUSA-N 384.888 5.013 30 20 GKED CC(C)n1nccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 151637239 XQPQVGHTOGBYLD-SFHVURJKSA-N 378.863 5.025 30 20 GKED C[C@H](Cc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 179224429 MTHJLHSKUQCYMC-TZMCWYRMSA-N 387.817 5.140 30 20 GKED Cc1cc(Br)cc2cc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)oc12 187579228 DSWOPKYHIXPKPQ-CYBMUJFWSA-N 395.212 5.135 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3)o2)cc1OC 206983756 REEUNLCYHPCDAY-NTMALXAHSA-N 396.414 5.016 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 303493714 WOSQAXLYKMMMGC-HXUWFJFHSA-N 395.528 5.490 30 20 GKED N#CCCCOc1cccc(N[C@H]2CCc3sc(Br)cc32)c1 319886262 JORMDOMOYRMCEG-HNNXBMFYSA-N 377.307 5.293 30 20 GKED O/C(=N\C1CCC(/C(O)=N\Cc2ccccc2N2CCCCC2)CC1)C1CC1 330008977 HBSFHRLUQJOAKF-UHFFFAOYSA-N 383.536 5.059 30 20 GKED Cc1ccc(C2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)CC2)cn1 371682280 XHZUMVORJKUNGG-MRXNPFEDSA-N 394.544 5.053 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@H](C)CCC#N 411545362 XAXZONAFJOIYQI-NEPJUHHUSA-N 378.339 5.224 30 20 GKED Cn1c(COc2ccccc2Cl)nnc1SCCC1(C#N)CCCCC1 412980036 BQQBPEJKYLKDIQ-UHFFFAOYSA-N 390.940 5.004 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2cccc(N)c2)CC1 415152130 BKHLPWCRMPGIFD-MRXNPFEDSA-N 394.544 5.075 30 20 GKED CC(C)c1ccc(CSc2nnc(S[C@@H]3CC[C@H](C#N)C3)s2)cc1 430141055 PUUBLDCSVPHWGV-GOEBONIOSA-N 375.588 5.738 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(Cc2ccccc2)CC1 435595309 BISJZMYOCJXJBV-QGZVFWFLSA-N 379.529 5.083 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C)c(Oc2cc(C)ccn2)c1 438671647 HFMXMQINOKDJSV-UHFFFAOYSA-N 393.512 5.772 30 20 GKED C[C@@H](SCc1ccc(C#N)cc1OC(F)F)C(=O)Nc1ccccc1Cl 439553767 ZFLLJQZNLSFCSY-LLVKDONJSA-N 396.846 5.073 30 20 GKED Cc1cnc(-c2cccc(NC(=O)c3cn(CCCC#N)c4ccccc34)c2)o1 444172367 AEPBKMGAIXGBAO-UHFFFAOYSA-N 384.439 5.161 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3CCCC[C@@H]3c3cc4ccccc4[nH]3)on2)c1 447458506 HTWOZAYHPWCTSC-JOCHJYFZSA-N 396.450 5.062 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](c1ccccc1)C(C)C 463103863 JIHSKWKCPXLNMK-QFIPXVFZSA-N 385.467 5.432 30 20 GKED Cn1ccc([C@@H](Nc2ccc(C(F)(F)F)c(C#N)c2)c2ccc(Cl)cc2)n1 463487011 ONIWPYXJTRLREU-SFHVURJKSA-N 390.796 5.165 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCc1cc(C#N)ccc1F 466198152 SMJHSXWDWGYHRO-QGZVFWFLSA-N 387.458 5.267 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(F)cc1F 467307458 GDEBZGMMLJYTAW-CYBMUJFWSA-N 392.496 5.088 30 20 GKED CCN(Cc1nc(C)c(-c2ccc(Cl)cc2)o1)[C@H](C)c1ccc(C#N)cc1 468282330 QFJIPLIZSWLDFN-MRXNPFEDSA-N 379.891 5.758 30 20 GKED Cc1ccc(C(C)(C)CN(C)C(=O)c2cn(CCCC#N)c3ccccc23)cc1 469502048 SIOQPCHHPQLOMP-UHFFFAOYSA-N 387.527 5.303 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1F 469753953 UGUQVLNDLFYIRP-UHFFFAOYSA-N 397.425 5.263 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 471904471 DHYXZTUQTOOWON-CHWSQXEVSA-N 393.339 5.987 30 20 GKED CN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C1CCCCC1 481572067 KMGBHVDZTHLRFB-UHFFFAOYSA-N 381.451 5.073 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@H](C)C#N 482537730 SYWJHWJDIWKETJ-RHSMWYFYSA-N 388.920 5.388 30 20 GKED C=CCN(C(=O)c1ccc(OCc2cn3cccc(C)c3n2)cc1)c1ccccc1 484261817 JAANYQFBKQLRQQ-UHFFFAOYSA-N 397.478 5.055 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3ccc(Cl)c(Cl)c3)s2)cc1 487416945 DDWQTOMVAULGQI-UHFFFAOYSA-N 388.279 5.165 30 20 GKED CC[C@@H](NCc1cc(C#N)ccc1Br)c1ccccc1OC(F)F 492747195 KWCOLAHHLKESHS-MRXNPFEDSA-N 395.247 5.163 30 20 GKED CSc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1F 500458326 UOYBJUXHFXKKOZ-NSHDSACASA-N 376.865 5.301 30 20 GKED O=C(CC1(C(F)(F)F)CC1)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 503952629 OIRGKOHGCIAHOT-LLVKDONJSA-N 393.249 5.158 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)cc1F 512611341 KHVSHKLBKJPALO-CHWSQXEVSA-N 383.467 5.680 30 20 GKED C=C(CNC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 512660724 ORVHHFYMHJFMSX-UHFFFAOYSA-N 395.890 5.084 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3cnc4ccccc4c3)cc2)cc1 518386060 MCSAWAUKXHCHII-UHFFFAOYSA-N 393.446 5.023 30 20 GKED N#Cc1cccc(CNCc2ccc(-c3cccc(Br)c3)s2)c1 521818929 GNDMPAULZJTBDQ-UHFFFAOYSA-N 383.314 5.339 30 20 GKED N#Cc1c(NC(=O)C[C@@H]2CCOc3ccccc32)sc2c1CCCCCC2 522748012 KJCKVQLYSSDEBA-HNNXBMFYSA-N 380.513 5.174 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 524441741 ZBJMABSOXVHGGS-UHFFFAOYSA-N 393.384 5.406 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)c1nnc(-c2cccc(Cl)c2)o1 533177020 MXDKXTMKQOYXJR-JTQLQIEISA-N 376.268 5.768 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc3c2CN(c2ccccn2)C3)CC1 538427809 VBGRKDDGMJAKHZ-UHFFFAOYSA-N 394.522 5.418 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H](c2nc3ccccc3n2C(C)C)C1 539401346 QYRFQBJCLMJNHS-FQEVSTJZSA-N 397.563 5.086 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)c1 543302994 HFKFDBAZQJDYOK-HKUYNNGSSA-N 379.529 5.268 30 20 GKED CCC[C@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccn1 555549703 MXWNMWIMHIUSSH-QFIPXVFZSA-N 385.467 5.055 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(c2cccc(F)c2)CCCC1 561238376 QFBJTGWAPPIJNT-UHFFFAOYSA-N 383.511 5.020 30 20 GKED N#Cc1c(NC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)sc2c1-c1ccccc1CC2 564313944 OFFJVMOQXFONNI-QWHCGFSZSA-N 390.430 5.302 30 20 GKED C=CCn1c(SCc2cccc(N)c2)nnc1-c1ccc(C(C)(C)C)cc1 566001923 XPLZLBLHYWWOFE-UHFFFAOYSA-N 378.545 5.303 30 20 GKED Cc1cccc([C@@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 573489769 OUUMDFYMGYGCMD-CQSZACIVSA-N 392.446 5.762 30 20 GKED N#CCCn1cc(CN2CC[C@@H]2c2ccc(Cl)cc2)c(-c2ccccc2)n1 583922933 KEMGTLUBHPRWDU-OAQYLSRUSA-N 376.891 5.064 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)Nc1cc(Cl)ccc1C(F)(F)F 588326897 MSXKBJKIVMOGIT-OAHLLOKOSA-N 379.769 5.039 30 20 GKED COc1ccc([C@@H](Cc2ccccc2)NCc2ccc(C#N)c(Cl)c2)cc1 589344252 VRZOWYYSMINPAJ-HSZRJFAPSA-N 376.887 5.294 30 20 GKED Cc1ccc(CCCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)s1 589470689 JCYICKQHTDDZBG-UHFFFAOYSA-N 377.469 5.077 30 20 GKED N#Cc1ccc(C[S@](=O)Cc2nc(C3CCCCC3)cs2)c(Cl)c1 593195867 CNQGHFPBGMXDNH-DEOSSOPVSA-N 378.950 5.165 30 20 GKED N#Cc1ccc2c(c1)CN(C(=O)Nc1ccc(OC3CCCC3)c(Cl)c1)C2 594066491 WNJDKBMEFZAZPO-UHFFFAOYSA-N 381.863 5.081 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1F 595689908 FOWFMBXVJRTJMD-OPAMFIHVSA-N 399.535 5.003 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(F)cc1Cl 603600825 BUAQXZUUOQVAFU-UHFFFAOYSA-N 381.794 5.099 30 20 GKED CCCCc1ccc(CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 603601407 ZZJCSUFAFGVHAS-UHFFFAOYSA-N 399.494 5.578 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3ccc(Cl)s3)cn2)cc1 603764256 JRDUEKBOPMCHPL-UHFFFAOYSA-N 383.860 5.032 30 20 GKED CCCOc1ccccc1NC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 604454823 LUTZPOQTRXIGIB-UHFFFAOYSA-N 392.484 5.038 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CC/C=C\c3ccccc3)c2)cc1 609968663 XSXQHEBUNSOODN-WTKPLQERSA-N 396.490 5.764 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)Cc2c[nH]c3ccc(Cl)cc23)cc1 610064348 ARDRXWZXFYJLBJ-FQEVSTJZSA-N 379.891 5.042 30 20 GKED C[C@@H](NC(=O)Nc1ccnc(Oc2ccccc2Cl)c1)c1cccc(C#N)c1 610328736 PVMJGRIZYCRULB-CQSZACIVSA-N 392.846 5.282 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)c(Cl)c1 611505663 LCYXVFAQEFDDNN-MRXNPFEDSA-N 389.257 5.370 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3coc(C4CC4)n3)cc2Cl)cc1 614400863 LOSWSHZTZPFTKT-UHFFFAOYSA-N 379.803 5.122 30 20 GKED Cc1[nH]c2ccc(-c3noc([C@@H]4CCCN4c4ccc(C#N)cc4)n3)cc2c1C 615132111 ZLQAIRAPTUGCLD-NRFANRHFSA-N 383.455 5.048 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)c(Cl)cc1F 619127051 QQJVKGQICZXVQF-UHFFFAOYSA-N 397.693 5.402 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1 619144396 RMIASWJBMSHICR-UHFFFAOYSA-N 375.859 5.100 30 20 GKED Fc1cc(Cl)cc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 681594673 HBFYNQJCPVYIES-UWVGGRQHSA-N 377.731 5.478 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1Oc1cccnc1 726479418 ZCJYYNQNJOSFHG-UHFFFAOYSA-N 394.887 5.516 30 20 GKED CC(=NNc1cnc2ccccc2n1)c1sc(-c2ccc(Cl)cc2)nc1C 727651447 YYLRYWPLMIAJBZ-UHFFFAOYSA-N 393.903 5.551 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OCc2cccnc2)cc1 728691700 IPESSHRQLZZTCG-UHFFFAOYSA-N 391.446 5.020 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NCc2ccccc2C#N)c(C(F)(F)F)c1 729675976 YRKFHLNRYNWGSS-UHFFFAOYSA-N 391.393 5.536 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 729948152 DIXDHALEUGXCQR-UHFFFAOYSA-N 392.405 5.543 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1OC 731400380 OBCOUGMKLKFVBS-NVXWUHKLSA-N 383.517 5.362 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 732495993 LFYHHCGSVXCGKD-GWCFYCIZSA-N 396.874 5.882 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 732496365 SHAZIANCWYOXBO-HKUYNNGSSA-N 378.522 5.557 30 20 GKED COc1ccc(/C=C2/CCOc3cc(C)c(C)cc3C2=O)cc1OCCCC#N 733748876 MEWHCCHPRBXQIQ-RGEXLXHISA-N 391.467 5.043 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1ccccc1OCc1ccccc1 734095882 IVOJXXVKTWSPPI-NXVVXOECSA-N 394.474 5.407 30 20 GKED C=CC[C@H](NC(=O)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccncc1 734456008 QINQHTUJSPWXNY-KRWDZBQOSA-N 383.904 5.214 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4cccc(F)c4)CC3)n2)cc1 734706357 DZXVTJUHIRRDCP-SFHVURJKSA-N 376.456 5.166 30 20 GKED CCCCOc1ccc(C=NOCc2csc(C3CCCC3)n2)cc1OC 746352615 ASTYWRDHEOEHBT-UHFFFAOYSA-N 388.533 5.539 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1nc2ccccc2[nH]1 754700761 NAPBZUNCTHMZCV-UHFFFAOYSA-N 392.894 5.031 30 20 GKED CCCCn1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1CC 758036045 XJHQRYHCYKTRGR-OAQYLSRUSA-N 386.499 5.153 30 20 GKED Cc1ccc(CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)s1 764752400 OCYKIYLQZVUNHT-UHFFFAOYSA-N 398.315 5.093 30 20 GKED N#CCOc1ccc(-c2cc(-c3cccnc3)c3c4c(sc3n2)CCC4)cc1 768759097 XQVPQYMISXUCJD-UHFFFAOYSA-N 383.476 5.416 30 20 GKED CCSc1cccc(C=Nn2cnnc2SCc2ccc(Cl)cc2)c1 769778738 WGSAOOYMYHZWBV-UHFFFAOYSA-N 388.949 5.218 30 20 GKED C[C@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccc(OCC#N)cc1 776159596 JWICKADGKKRZQA-MHECFPHRSA-N 390.914 5.877 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCCc1ccc(-c2ccccc2)cc1 780668675 XPAYIEZRWOBUNZ-GOSISDBHSA-N 385.467 5.009 30 20 GKED Cc1cc(/C=C\C(=O)[C@H](C#N)c2cnc3ccccc3n2)c(C)n1C1CCCCC1 792105906 YYLVRHNZKRCSJG-BIGNBACZSA-N 398.510 5.443 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2ccc(OCc3cccc(F)c3)cc2)c1 796990942 IUOHQRDGGQIBFS-JLHYYAGUSA-N 389.426 5.259 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 797942749 IFFOMMGRAWANPY-BXUZGUMPSA-N 380.847 5.465 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)ccc2C(C)(C)C)c1 801832235 IFVJIWRURLJDMI-QGZVFWFLSA-N 399.922 5.640 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2csc(-c3cccs3)n2)C(=O)c2ccccc21 802707124 FVAZVPOIESTFOY-RTGRKSDTSA-N 395.505 5.188 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 814630060 SMRAVJJORVXKIB-FQEVSTJZSA-N 381.545 6.134 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2ccc(CSc3nc4ccccc4s3)cc2)C1 819631738 RYCPOJFJPBLOGS-DOTOQJQBSA-N 393.537 5.011 30 20 GKED CC(C)(C)C(=O)CCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 835068202 OFAOZHMVKKHMQB-OAHLLOKOSA-N 388.920 5.425 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N(CCC#N)Cc2ccccn2)cc1F 836722503 WUMVAXDUCJGDOS-UHFFFAOYSA-N 386.496 5.059 30 20 GKED O=C(O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)C1CC2(C1)CC2(F)F 851029691 ZOLZLKSNPZFYBA-DMLGSKKGSA-N 388.254 5.287 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(COc2ccc(F)cc2)no1 904665041 FTYPGFOXMFMDFB-UHFFFAOYSA-N 394.324 5.038 30 20 GKED N#Cc1c(NC(=O)/C=C/c2ccc3ccc(Cl)cc3n2)sc2c1CCCC2 912895785 QJERVBNRWHLZNP-MDZDMXLPSA-N 393.899 5.352 30 20 GKED CN(CCCOc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915350507 WVYJINLRPKLOTF-XMMPIXPASA-N 399.494 5.275 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc4ccccc34)n2)cc1 916627301 LSDKMWOKGSKYST-OAQYLSRUSA-N 382.488 5.691 30 20 GKED CCCc1sc(C(=O)[C@H](C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc1CC 916936600 QFDOOCLVXZEFKE-ZDUSSCGKSA-N 392.883 5.017 30 20 GKED O=C(c1cc2c(F)cccc2s1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 918670571 JUNTYUWJUVTEMP-IUCAKERBSA-N 399.331 5.243 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NNc1ccc(Cl)c(Cl)c1 1776032668 IQPHPBCVGSSGPT-CYBMUJFWSA-N 395.286 5.266 30 20 GKED CCCC(=NNc1ccc(C(=O)O)cc1OC)c1ccc(Cl)cc1Cl 1776050250 VGPPMIGJYLDDOM-UHFFFAOYSA-N 381.259 5.317 30 20 GKED O=C(/C=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccc(F)c(F)c1 1776125339 FIKDHBYTMWVXKX-RYGYDFEPSA-N 394.373 5.066 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1Cl 1776388620 UCVZLJPNCDPXMM-PLNGDYQASA-N 385.268 5.436 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(SC(F)(F)F)cc2)c1)C(=O)O 1776471373 NWDWEHOYFOGVHX-PMDBQALLSA-N 396.386 5.047 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Br)c(Cl)s1 1776783780 KMPXCTDIMXMSGR-LLVKDONJSA-N 396.778 5.457 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCCC[C@H]1c1ccc(C(=O)O)n1C 1776786879 YOBKTGMKCLVPIP-MJGOQNOKSA-N 376.541 5.164 30 20 GKED CCCCCCCOc1cccc(/C=C2\CCc3occ(C(=O)O)c3C2=O)c1 1776788977 HYSZUYJVBDENGE-GHRIWEEISA-N 382.456 5.540 30 20 GKED CCc1nc(COC(=O)c2ccccc2SCc2ccc(C#N)cc2)cs1 21849217 DNETWQFMZODWJA-UHFFFAOYSA-N 394.521 5.226 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(C)o3)n2)nnc1-c1ccco1 32330512 PAMIKDIWEAMMEJ-UHFFFAOYSA-N 384.486 5.041 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Br)s1 40214818 SEUPFQJHPUQEBD-UHFFFAOYSA-N 376.728 5.054 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21 60603543 MKTRMEHEODDFKN-SFHVURJKSA-N 392.471 5.125 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1csc(-c2ccccc2)n1 66800370 VVANMPDYXJHLBL-HNNXBMFYSA-N 393.537 5.386 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66801293 VERFBJPXEXVCLT-GFCCVEGCSA-N 376.934 5.708 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2ccc(Oc3cccnc3)cc2)cc1 78719003 YECRCKSUPCIXDH-QFIPXVFZSA-N 385.467 5.166 30 20 GKED Cc1ccccc1[C@@H]1CCCN1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 108360031 FNCPHDFAGPBEEK-RXVVDRJESA-N 393.556 5.165 30 20 GKED Cc1noc(C)c1[C@H](C)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116646265 MUROMZZZQIHEOO-LBPRGKRZSA-N 395.846 5.100 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 153460031 PGPVQPBGMREUAX-FQEVSTJZSA-N 389.524 5.131 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C 178843100 KOLCLRSOHRKZAU-AWEZNQCLSA-N 387.553 5.228 30 20 GKED C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(SCC(F)(F)F)cc1 180551789 SKFQDZFDYPCXOC-AWEZNQCLSA-N 380.435 5.094 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccccc1-c1nc2ccccc2s1 194113707 JLINCBVZMVIRHS-UHFFFAOYSA-N 385.448 5.118 30 20 GKED COc1cccc(F)c1[C@H](C)NCc1cccc(OCc2cccc(C#N)c2)c1 237291464 LZLKFDSQPGTOOA-KRWDZBQOSA-N 390.458 5.136 30 20 GKED CC(=NOCc1nnc(-c2ccccc2)o1)c1ccc(-c2ccc(F)cc2)s1 254839954 QZLXATFEFYLHGK-UHFFFAOYSA-N 393.443 5.545 30 20 GKED N#Cc1ccc([C@@H](S[C@@H](c2ccccc2)c2ccc(Cl)cc2)C(N)=O)cc1 261440565 BOQIMYXORDIDDX-LEWJYISDSA-N 392.911 5.261 30 20 GKED N#Cc1nc(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)ccc1Cl 301591359 QUJVSHOKLGBDJK-UHFFFAOYSA-N 394.809 5.361 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1csc(-c2ccc(Cl)s2)n1 303070180 OOXZYHYJIBZQIG-UHFFFAOYSA-N 388.945 5.396 30 20 GKED N#Cc1cc(Br)ccc1CNC(c1ccccc1)c1ccccc1 326541564 KSVNAESPJPSTIU-UHFFFAOYSA-N 377.285 5.200 30 20 GKED C[C@@H](/C(O)=N/[C@H]1CCCC[C@H]1C)N1CCC([C@H]2C(O)=Nc3ccccc32)CC1 328679445 BPMCQJWVCMTFGJ-KPYYAMLLSA-N 383.536 5.008 30 20 GKED Cc1oc(-c2ccccc2)nc1/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329354531 VLDWDVFDDYEHBU-IBGZPJMESA-N 390.487 5.344 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccccc1N1CCCCCC1 330245112 DOYZZITZULBCJQ-KRWDZBQOSA-N 399.560 5.362 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cn1 429442310 BDQJRSKWDZSEKR-HNNXBMFYSA-N 387.443 5.162 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1c(C)cc(C)cc1Br 431962701 AUNWLKUCJJQKEB-UHFFFAOYSA-N 391.284 5.425 30 20 GKED N#Cc1cccc(COc2cccc(CNc3cccc(-c4cnco4)c3)c2)c1 432672095 SCGIGWVAFNKSCK-UHFFFAOYSA-N 381.435 5.404 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)C1 433130362 HNOCERISGJOJQK-PKOBYXMFSA-N 379.529 5.350 30 20 GKED CN(Cc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1 433762253 MLDAXHLQPLXLQN-QHCPKHFHSA-N 398.510 5.490 30 20 GKED CC1(C)CCCN(C(=O)c2csc(-c3cccc4ccccc34)n2)[C@@H]1C#N 434014221 FOJGJMZGKMGGJV-LJQANCHMSA-N 375.497 5.118 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)C1CC1 437946699 KHJPSSVIMHNMCE-HNNXBMFYSA-N 393.462 5.071 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2csc(C)n2)cc1 440748888 FLZYUGJKPHEGJO-UHFFFAOYSA-N 375.497 5.043 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 448145026 AOYQTMUUQCYHIL-GFCCVEGCSA-N 384.892 5.240 30 20 GKED COc1cccc(C2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)CC2)c1 458810046 AKURZEPAFZWRJD-HSZRJFAPSA-N 391.515 5.019 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)cc1 458836830 KYIVIAUUXRBHPM-PKTZIBPZSA-N 375.516 5.183 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(C1CC1)[C@@H](C)c1ccccc1Cl 460560843 DHSKTTVXBVXEOL-HNAYVOBHSA-N 386.927 5.089 30 20 GKED C=CCOc1ccc(OCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1 462653190 ARFFTSJAWXKSHR-UHFFFAOYSA-N 377.227 5.187 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nc(-c3ccccc3)no2)cc1F 463219862 AXXGHQBCLLQQIZ-UHFFFAOYSA-N 386.386 5.152 30 20 GKED Cc1ccc2c(CCC(=O)Nc3sc4c(c3C#N)CCCCC4)c[nH]c2c1 467106245 IZXNUHPSCWUOLL-UHFFFAOYSA-N 377.513 5.250 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C4CCC4)c3)n2)cc1 467203401 XTWWKQBKXLFPIC-HXUWFJFHSA-N 388.492 5.576 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCC3(CCC3)C2)cc1F 467930087 OXSDRYCBSJPTIL-UHFFFAOYSA-N 379.435 5.288 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc(C(F)(F)F)c1F 468028833 JEVJAYOLVGLIME-LLVKDONJSA-N 396.409 5.657 30 20 GKED Cc1cc(C)c([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1C 469274904 WCUGTRPNOPDLTJ-IBGZPJMESA-N 375.516 5.368 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(Cl)cc1Br 472233910 ZIOGGESJRLIBDW-UHFFFAOYSA-N 392.684 5.048 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(CCc2ccc(F)cc2)C2CCCC2)cc1 475370865 ROLFGBIXYAWEGY-UHFFFAOYSA-N 378.491 5.254 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1 475555043 UXECLPUUDHOWKL-NFBKMPQASA-N 378.516 5.438 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccccc1C(F)(F)F 476086532 QJYFXBOKEWYWSE-OAHLLOKOSA-N 391.433 5.963 30 20 GKED COc1ccc(-c2csc(CNC(=O)C[C@H](CC#N)c3ccccc3)c2)cc1 476246991 PQRXMOMHFRUODK-IBGZPJMESA-N 390.508 5.127 30 20 GKED C[C@H](c1cccc(Cl)c1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 480339436 UCLPSXAHHZQUQI-MRXNPFEDSA-N 395.911 5.555 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(Cc3ccco3)c3ccccn3)c2)cc1 482839468 KNRKBEPXZWQLAO-UHFFFAOYSA-N 395.418 5.186 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)s2)c(C)c1 483194691 JJSYVMNRTMIVGW-KRWDZBQOSA-N 398.491 5.169 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)[C@@H](C#N)c2cnc3ccccc3n2)c1 483218901 QUPAUSSCQXOBCP-SFHVURJKSA-N 387.508 5.463 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(C)nc1C 486245303 QSDHLTGUCFOEQQ-UHFFFAOYSA-N 399.450 5.126 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(Br)ccc1Cl)c1ccccc1 487373306 PEHTYLNHSPJYNS-KRWDZBQOSA-N 391.696 5.267 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(Sc2ncccn2)cc1C)c1ccccc1 488718675 YCQRXAWWZBDKSI-HXUWFJFHSA-N 389.524 5.625 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cc(OC)c(C)c1C 494990371 WLERDNVTZNQFPK-UHFFFAOYSA-N 378.925 5.555 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 496286982 VNYDZXURIWDUOK-HSZRJFAPSA-N 385.467 5.215 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1csc(-c2cccs2)n1 501019187 IHHPTPLNXYAHMY-UHFFFAOYSA-N 391.477 5.183 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)NCc2sccc2C)cc1 508272207 GLPBBVPZDVRIEQ-UHFFFAOYSA-N 393.468 5.051 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cc(F)cc(F)c1 510539429 QCSKQKHZKRAXOZ-UHFFFAOYSA-N 393.393 5.259 30 20 GKED N#C[C@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1nc2ccccc2s1 518480105 JGXPRZJRBIKMAK-MRXNPFEDSA-N 387.489 5.333 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)N(C)Cc3cccc(C#N)c3)c2)C1 520133414 LGAVJUFBXPRUIC-FDDCHVKYSA-N 391.515 5.317 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@H](C)O1 522088416 XGTPFLFQIPNROZ-WMLDXEAASA-N 399.878 5.035 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@@H]1CCC[C@H](C)C1 522150963 ILHPDYWSFXIZEI-OXJNMPFZSA-N 378.472 5.193 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NC3(c4cccc(F)c4)CC3)c2)cc1 524827412 UIGSVUFFENPZLP-UHFFFAOYSA-N 387.414 5.300 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccccc12 530725779 ZRFORXNSJPLIGS-QPPBQGQZSA-N 381.479 5.024 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1Br 536076988 WKWCLQFLYBBHOU-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1nc2ccccc2s1 536178874 KCNFWDHYAPRIFZ-SFHVURJKSA-N 397.459 5.039 30 20 GKED C[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc(-c2cccc(C#N)c2)cc1 543877260 TWGQIIDKICSHNH-LJQANCHMSA-N 382.511 5.071 30 20 GKED CCOCc1ccccc1-c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 544206065 CAZTVPNGAKANEH-OUKQBFOZSA-N 398.466 5.312 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc(F)cc1 553944953 HYNHBVIFNUMPBJ-IRXDYDNUSA-N 377.246 5.183 30 20 GKED CCC(C)(C)C1CCC(CC(=O)N2CCC(C#N)(c3ccccn3)CC2)CC1 554716701 OWIPIWSPYJIXLB-UHFFFAOYSA-N 381.564 5.098 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)c(F)cc1Cl 559649545 GXSZZAXMUXBTLN-JTQLQIEISA-N 383.275 5.637 30 20 GKED N#CCCCn1cc(-c2nc(Cc3c[nH]c4ccc(F)cc34)no2)c2ccccc21 575365020 KKAFYEBJWYDPHL-UHFFFAOYSA-N 399.429 5.206 30 20 GKED C=CCOc1ccc(CN(C(=O)c2ncsc2C(F)(F)F)C(C)(C)C)cc1 580219988 MPKHDADIESNXNX-UHFFFAOYSA-N 398.450 5.168 30 20 GKED Cc1csc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)c1C#N 589034529 OSENZDFPVGIJJC-UHFFFAOYSA-N 375.425 5.242 30 20 GKED N#CCc1ccc(-c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)cc1 589155158 OINFSJKZMHUHMD-UHFFFAOYSA-N 396.328 5.143 30 20 GKED Cc1nn(-c2ccccc2Cl)cc1CN[C@H](CCCC#N)c1ccccc1 594518489 IQPIOCMXDGLDQW-OAQYLSRUSA-N 378.907 5.359 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 596691881 PYSDBCMFBHPMKH-UZLBHIALSA-N 392.890 5.153 30 20 GKED CC(C)c1cc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)nn1C(C)(C)C 603749856 CXZPQIIPHLYVKS-CYBMUJFWSA-N 384.549 5.072 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Br)c1C 608893629 UDQBSVMACPRPPW-UHFFFAOYSA-N 386.293 5.073 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609436609 PMXRGJCHBXOEDS-KRWDZBQOSA-N 397.544 5.534 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)cc1F 612305114 UHYYVSQTYODGMR-QFIPXVFZSA-N 397.450 5.093 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)cc1 612313961 NKYMHJUGDKWMIA-VGOFRKELSA-N 379.529 5.697 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)N(Cc1ccc2ccccc2c1)C1CC1 618840993 NRSLYJXVRYPVTQ-XMMPIXPASA-N 381.479 5.073 30 20 GKED Cc1coc(C)c1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494478 SXRUQDSLFFUUJC-UHFFFAOYSA-N 383.263 5.438 30 20 GKED CCCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](C)c1ccc(C)o1 726484928 GAYXMAJQOFSLIL-AWEZNQCLSA-N 375.925 5.673 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C/c1nc(-c3ccccc3)cs1)CC2 727974501 LCKRIJDAIUEUHU-RVDMUPIBSA-N 393.464 5.101 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(N=Cc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 729150679 WVKRZZUQGRDDEY-UHFFFAOYSA-N 391.811 5.051 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)sc2ccc(F)cc12 730417725 QHQMQHXWUCNFNH-CYBMUJFWSA-N 384.432 5.588 30 20 GKED N#CCOc1ccc(COC(=O)c2cc(-c3ccccc3)nc3ccccc23)cc1 733389394 SPDROYMLGMLDMN-UHFFFAOYSA-N 394.430 5.161 30 20 GKED N#C[C@H](C(=O)Cc1ccc(-c2ccccc2)cc1)c1nc(-c2ccncc2)cs1 734081364 JRLPGDAGCFJXMW-OAQYLSRUSA-N 395.487 5.291 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 735569643 DPZIJYQMLGUHHR-UHFFFAOYSA-N 399.922 5.169 30 20 GKED N#C[C@H](C(=O)CC/C=C/c1ccccc1)c1nc(-c2c(F)cccc2F)cs1 739159610 HQEKQKMJTQWNQY-VCIFKONDSA-N 394.446 5.758 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2C[C@@H](C)[C@@H]2c2ccccc2)c1=S 743392655 STGDOPRZPBRHRF-OXQOHEQNSA-N 394.519 5.057 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1Cl)C1CCCC1)c1ccncc1 745826953 ZENBUROWWAYARY-OAQYLSRUSA-N 383.923 5.507 30 20 GKED CC(=NNc1nc(C)nc2sc3c(c12)CCCC3)c1c(C)nn(C(C)C)c1C 746486747 GTZNAKRLQFYKQU-UHFFFAOYSA-N 396.564 5.109 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc3cc(O)ccc3c2)cc1OCCCC#N 749003975 RPPWKVAJSSPWQA-ONNFQVAWSA-N 387.435 5.133 30 20 GKED Cc1nn(C)c(Cl)c1/C=C\C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750915261 CUIZHXBXSUBSEQ-ARJAWSKDSA-N 396.718 5.316 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1ccccc1-c1ccccc1 751007534 RGVGIROACMQCKY-UHFFFAOYSA-N 399.563 6.080 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1sc(C(C)C)nc1C 751131273 OHTBCABIUKQQQR-UHFFFAOYSA-N 376.835 5.478 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(F)c(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 756245916 ZJTKUOZVOZCBDL-NSHDSACASA-N 396.340 5.012 30 20 GKED Clc1cccc(Oc2ccccc2)c1C=NNc1nc(-c2ccncc2)no1 769573406 CPTMBVQXVMOMRE-UHFFFAOYSA-N 391.818 5.023 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1c(C)nn(-c2ccccc2)c1C 782683653 QWFMCMMBYVIJML-UHFFFAOYSA-N 390.487 5.031 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 785696090 BWLVWPFAJNKDSI-KBPBESRZSA-N 385.360 5.545 30 20 GKED COc1ccc(Cl)cc1NC(=S)N(Cc1ccccc1C#N)C1CCCC1 792683384 IFUAGNPJCVLCOJ-UHFFFAOYSA-N 399.947 5.362 30 20 GKED N#C[C@@H](C(=O)/C=C\Sc1cc(F)ccc1F)c1nc2cc(F)ccc2s1 797947205 ACGHTWSHGVTYFR-FJOGCWAESA-N 390.411 5.196 30 20 GKED C=CCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCOCC1 819944503 ALPIULGEGIURBZ-INIZCTEOSA-N 386.904 5.013 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3CC2)cc1 836269795 JBNUABJFRRGNNW-VMYYHUPOSA-N 383.495 5.018 30 20 GKED Fc1ccccc1NC(=S)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914706791 JDSKLXTVRMPXQX-MYJAWHEDSA-N 388.352 5.022 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)cc1 915086683 MBHRFYOACCGHLE-NRFANRHFSA-N 394.396 5.542 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c(C)s1 915353599 PFHXRJRGOOUGIO-OPAMFIHVSA-N 389.524 5.903 30 20 GKED C=CC[C@H]1CCN1Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 934458850 BNAARBOGCBEWHB-AWEZNQCLSA-N 396.343 5.285 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1c(F)cccc1O[C@H](C)c1ccccc1 1776030142 GTHFARIMGHFOFB-MRXNPFEDSA-N 392.430 5.500 30 20 GKED CC(=NN[C@@H](C)c1ccc(C(C)C)cc1)c1cccc(OCCCC(=O)O)c1 1776105693 ASZUAEONXBTHLR-KRWDZBQOSA-N 382.504 5.128 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(F)cc(C(F)(F)F)c1 1776354427 HEWMPAIXPZXYQL-HWKANZROSA-N 396.336 5.226 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1ccc(-c2cccc(CC(=O)O)c2)cc1 1776665793 CVFYHOAGAFVIEI-WMWHPZEKSA-N 382.459 5.439 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1ccc(Cl)c(Cl)c1 1776785354 ZHIMMZGRUPKZSY-LJQANCHMSA-N 388.379 6.582 30 20 GKED CCCCCCCOc1cccc(/C=C\C(=O)c2cc(C(=O)O)ccc2O)c1 1776789095 PTTNXQDSKYTLIL-BENRWUELSA-N 382.456 5.336 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2ccccc2)c1 10174684 OLAXNDPCMBNXHB-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2ccc(Cl)s2)cc1 25910189 WVFPKTBDQRLKFS-UHFFFAOYSA-N 398.940 5.495 30 20 GKED Cc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 65651465 QWRHFAVUCSLPOR-INIZCTEOSA-N 397.843 5.170 30 20 GKED Cc1c(C(=O)Nc2ccc(C#N)c(Cl)c2)sc2nc(C(F)(F)F)ccc12 71873231 FLOQGDWKNVWQAX-UHFFFAOYSA-N 395.793 5.401 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)Cc1ccccc1F 108241718 MRXPXYGTIOVGMC-UHFFFAOYSA-N 382.382 5.031 30 20 GKED CC[C@H](C#N)Oc1cc(CNC(=O)Nc2c(C)cccc2C(C)C)ccc1OC 113525111 JOAAMOPRYOTGNK-GOSISDBHSA-N 395.503 5.130 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 118446284 HJEVNKAIBJJOKS-JKSUJKDBSA-N 395.553 5.385 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)n1 119065876 IHXAZEOMVXCMSZ-HSZRJFAPSA-N 383.451 5.031 30 20 GKED Cc1ccsc1CCCC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 129434605 QJABNFLTVLLPSI-CYBMUJFWSA-N 395.311 5.034 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(F)c(NC(=O)c2ccoc2C)c1 158178899 HFBMHWBPHPQNIM-UHFFFAOYSA-N 387.455 5.190 30 20 GKED CC(C)(C#N)CCCSCc1nc(-c2ccc(Br)s2)no1 161796683 GXUWSKRQQUVRBB-UHFFFAOYSA-N 386.340 5.124 30 20 GKED COc1ccc(CSc2nnc(SCCCC(C)(C)C#N)s2)cc1 177198607 XHEODEYIZLSNPE-UHFFFAOYSA-N 379.576 5.261 30 20 GKED COc1cc2c(cc1NC(=O)c1ccc(C3(C#N)CC3)cc1)oc1ccccc12 182269393 TWBXSLRAXZBCNF-UHFFFAOYSA-N 382.419 5.402 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@H](c2ccccc2)O1 246239662 IWPOPUFMXTYWPT-MBOZVWFJSA-N 395.528 5.075 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 246618962 SOMZCBWZHDEIRL-USXIJHARSA-N 380.419 5.068 30 20 GKED C=CCn1c(SCCOc2ccc(C(C)C)c(C)c2)nnc1-c1ccncc1 255930000 SJDLSNYHBGJMFC-UHFFFAOYSA-N 394.544 5.129 30 20 GKED COc1cc2c(cc1N=C(O)N1CCCC3(CCCCC3)CC1)N=C(O)CC2 329972188 XYJPKZQNRWVZIT-UHFFFAOYSA-N 385.508 5.211 30 20 GKED C=CCC1(C(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)CCOCC1 424670650 FIEORJPPUJRMSV-UHFFFAOYSA-N 388.467 5.339 30 20 GKED C=CCC[C@H](C(=O)N[C@@H](C)c1nc(-c2ccncc2)cs1)c1ccccc1 426990013 FTYJPDLCQSHUCI-LPHOPBHVSA-N 377.513 5.132 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)c1ccccc1 428027991 CZBAPAWAFUBHKS-JOCHJYFZSA-N 395.462 5.721 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc1Br 430614974 ASWMLAQIKYFATG-LBPRGKRZSA-N 377.307 5.002 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(-c2cccnc2)ccc1C 432815511 HIRUSHNXSZSKLI-UHFFFAOYSA-N 387.483 5.286 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCSC(C)(C)CC1 433249475 WYLYCQSUEILFPX-UHFFFAOYSA-N 395.528 5.408 30 20 GKED CC(C)(C)OC(=O)CCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 433600881 WBCZABBVHCFMHH-SFHVURJKSA-N 398.890 5.056 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Cc2cc(Cl)ccc2Br)cc1 433667868 UNCYZMNSQJTWSK-UHFFFAOYSA-N 391.696 5.085 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2c1 437366182 VNKQFUFHZYVWHY-SFHVURJKSA-N 389.524 5.799 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C(C)C)s1 438657630 SMNHGTHYAIKJIU-UHFFFAOYSA-N 381.423 5.390 30 20 GKED Cc1ccc(-c2nnc(Sc3c(C#N)cnc4c(F)c(F)c(F)cc34)o2)cc1 439099317 PYWHRQMQKAOUGV-UHFFFAOYSA-N 398.369 5.033 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ncccc2Oc2ccccc2)s1 442546016 NSLWLRMOLFHYSY-HNNXBMFYSA-N 377.469 5.118 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cc2ccccc2o1 443170129 KEZLKKCVTFAGOW-QGZVFWFLSA-N 375.472 5.233 30 20 GKED N#CC(CCN[C@H](c1ccccc1)[C@@H]1CCOC1)(c1ccccc1)c1ccccc1 444672072 FCAFPNZUNDZEAN-ZEQKJWHPSA-N 396.534 5.254 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)c2c(F)cc(C#N)cc2F)cc1 446038931 JDEYQWONGYLTIC-AWEZNQCLSA-N 392.405 5.003 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](C)(c2ccccc2)C1 447057099 BVCPHRXDVGXNKE-VGSWGCGISA-N 379.529 5.276 30 20 GKED CCCn1ncc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1C1CC1 452468044 RWSWTVITWGHBPX-UHFFFAOYSA-N 386.455 5.087 30 20 GKED COc1ccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1SC 459405710 SUGNQWKRAFAARE-ZDUSSCGKSA-N 387.530 5.313 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1cccc(C#N)c1 462219730 OGAQJVCNPONZMA-AWEZNQCLSA-N 377.831 5.141 30 20 GKED N#Cc1ccccc1CNc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 464070257 AOSMMVCNVHMZFO-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1ccc(C(=O)CCCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 467516637 NLEYRONBXOYFQH-QGZVFWFLSA-N 389.282 5.036 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 470581356 FGXPSKBUUQHIBQ-PZJWPPBQSA-N 385.511 5.272 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NC[C@@H]1CCCO[C@@H]1c1ccc(C)cc1 471977836 JLQBHSGLSPIMRP-BJKOFHAPSA-N 392.543 5.251 30 20 GKED O=C(Cc1ccc(F)cc1)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474265123 HUXLLZAVKVYGDO-HNNXBMFYSA-N 393.302 5.197 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 475757828 VMGMIGDYUJAAJZ-LPHOPBHVSA-N 375.497 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(C)c(Br)c1 476088158 BFCIOZJXJOLWJX-UHFFFAOYSA-N 386.333 5.791 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H](COc2ccccc2Cl)C1)c1ccccc1 476508036 OVWGHICGAOFNIU-ICSRJNTNSA-N 396.918 5.045 30 20 GKED N#Cc1cc(NC(=O)c2cc(O)ccc2C(F)(F)F)ccc1Oc1ccccc1 476845070 AEZLPZYODQBVGS-UHFFFAOYSA-N 398.340 5.327 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)[C@@H]1c1ccccc1 480553645 LDPJCOUIGHKNNK-SBUREZEXSA-N 383.451 5.575 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 482831444 ZHDWDUUTSHAVNW-UHFFFAOYSA-N 390.527 5.456 30 20 GKED C=C(C)[C@H](NC(=O)N1CCCCC[C@@H]1c1ccncc1)c1ccc(F)c(F)c1 483312208 GZXCBOMGZMVBRE-RTWAWAEBSA-N 385.458 5.304 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N(CC(F)F)c3ccccc3)c2)cc1 485250925 KHRUCQMMERDDJR-UHFFFAOYSA-N 392.405 5.049 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 485707218 NRBPJHRWVUHNRB-UWJYYQICSA-N 394.540 5.033 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(CSC2CCOCC2)c1 486244341 TUKJMFDXOSADLB-UHFFFAOYSA-N 399.581 5.629 30 20 GKED C=CCOc1ccc(-c2nnc(SC[C@H](OC(C)C)c3ccccc3)o2)cc1 488253557 UFRKEFUBENCEDE-FQEVSTJZSA-N 396.512 5.560 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)c1c(F)cccc1F 489676267 GXXPJGQWXZKFLM-AWEZNQCLSA-N 387.455 5.175 30 20 GKED Cc1c(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cnn1CC(C)C 499588992 JHSZYUAHPBEHSJ-UHFFFAOYSA-N 389.459 5.156 30 20 GKED CC(C)[C@](C)(NCCCC1(C#N)CCOCC1)c1ccc(Br)cc1 499718411 KSPUMMZOUCLERW-IBGZPJMESA-N 393.369 5.010 30 20 GKED N#C[C@@H](NC(=O)CCCOc1cccc(Cl)c1Cl)c1ccc(Cl)cc1 499811563 KTLQEUUPMLLFSC-OAHLLOKOSA-N 397.689 5.187 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)COCc1ccccc1 505309685 FILQNPZZXHQOOB-KRWDZBQOSA-N 397.544 5.055 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCc3ccccc32)cc1Cl 510023281 LSMSZAAPXOVGCG-FQEVSTJZSA-N 387.870 5.590 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCCC1=CCCC1 510882565 LSNWIONYEQGBNB-UHFFFAOYSA-N 375.472 5.068 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)C2(C#N)CCCCC2)cc1F 512811156 BOKFQVFCIILUKV-UHFFFAOYSA-N 382.435 5.348 30 20 GKED C=CCOc1cccc(N[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)c1 513187484 BGZMODLCIFQUSV-QFIPXVFZSA-N 376.431 5.182 30 20 GKED Cc1occc1-c1nnc(SCc2cccc(C#N)c2F)n1-c1ccccc1 513252923 QLRVMQCYLDWQKW-UHFFFAOYSA-N 390.443 5.139 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2ccc(OC)cc2)[C@@H](C)C2CC2)c1 518723612 JFOHQEVOHHLLKX-KRWDZBQOSA-N 380.488 5.093 30 20 GKED COc1cc(C(=O)N(CCC#N)CC(C)(C)C)cc(Cl)c1OCCC(C)C 519113375 AACPEZDMVDOTAW-UHFFFAOYSA-N 394.943 5.175 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(F)c(C(F)(F)F)c1 520924176 MEQOGDADGJGIDM-NSHDSACASA-N 382.382 5.491 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(OC(F)F)c2)cc1 521607122 OMHVGTSPZZZFLU-UHFFFAOYSA-N 398.340 5.343 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(Oc4cccnc4)cc3)CC2)cc1 521939541 WLMNJZRCZRPDOB-UHFFFAOYSA-N 396.450 5.067 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1OC1CCCCC1 525566789 FJMBPBZJLCHXGI-QGZVFWFLSA-N 394.540 5.902 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2Sc2ccccc2)c1 525654025 NIQOBPOFXXCTDB-UHFFFAOYSA-N 388.492 5.773 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2cnn(Cc3ccc(Cl)cc3)c2)cc1 525735160 ZMZNKKLVFXMUJL-UHFFFAOYSA-N 393.878 5.030 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)c1cc2ccccc2s1 526944636 IELVUWLQUXVDCH-QWHCGFSZSA-N 395.553 5.001 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1cccc(O)c1)c1ccc(C(F)(F)F)cc1 533546770 OSCRLYXGSNALFX-IBGZPJMESA-N 392.421 5.260 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N(C[C@@H](C)C#N)C1CC1 533599308 OTRKIAMKOOYVHL-WMZOPIPTSA-N 377.488 5.291 30 20 GKED C=CCCC[C@H](C)NC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 537262441 FCHAPHGHEGGMPI-AWEZNQCLSA-N 375.900 5.115 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N1CCC(CC#N)CC1 541971462 YMIIBKRMTVOTAX-UHFFFAOYSA-N 397.906 5.385 30 20 GKED N#CCCN(C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1ccc(F)cc1 554376382 KJTDHJKQRJXOAE-UHFFFAOYSA-N 396.368 5.457 30 20 GKED Cc1c(C(=O)N2CCC(OCC3CCCCC3)CC2)sc2ccc(C#N)cc12 556356167 XDZMHQMZZUREGN-UHFFFAOYSA-N 396.556 5.283 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C3(c4cccnc4)CCCC3)c2)cc1 566701494 RHGLILQDMNZOJZ-UHFFFAOYSA-N 383.451 5.196 30 20 GKED C=CCc1cc(C(=O)Nc2cc(C(F)F)ccc2Cl)cc(OC)c1OC 582265497 CLRVPIYKDFQFSU-UHFFFAOYSA-N 381.806 5.276 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccc2)cc1 589503190 SYWJKZLYTSSKJW-QFIPXVFZSA-N 396.412 5.465 30 20 GKED CCCc1c(NC(=O)c2cc(C3CC3)[nH]c2C2CC2)cnn1-c1cccc(C#N)c1 599799991 OQGSYSOGEDPJQH-UHFFFAOYSA-N 399.498 5.032 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccnc3ccccc23)cc1Cl 603766784 YPUIWPGZOWJZKI-OAQYLSRUSA-N 397.865 5.796 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3ccc(F)cc3)s2)cc1 604068533 YXPZABNZKQARRM-UHFFFAOYSA-N 381.476 5.474 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1cc2ccccc2n1CC#N 609168494 VIWLUZOHXPYNML-UHFFFAOYSA-N 399.416 5.234 30 20 GKED N#CCn1c(C(=O)N(Cc2cccs2)c2ccc(F)cc2)cc2ccccc21 609216243 GWZPKUJTEVTUII-UHFFFAOYSA-N 389.455 5.212 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(Cl)nc2)cc1 727074683 NTFMOMQTMCCPDE-SFHVURJKSA-N 378.888 5.199 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2cccc(NC(C)=O)c2)c1 728227271 FDCQNLKUIKJJSU-UHFFFAOYSA-N 399.519 5.030 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)cc1 728698462 JYRHCZRDPKCVFR-VQIMKDEXSA-N 385.250 6.023 30 20 GKED CCc1cc(NN=C(C)c2cc(Cl)ccc2Cl)nc(-c2ccccn2)n1 730464614 WCHYDZHNJBNYID-UHFFFAOYSA-N 386.286 5.244 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1 733083186 DROKFUUVEWCRGT-KTKRTIGZSA-N 389.436 5.404 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 734966272 XCROHYMPEVBBPX-UGSOOPFHSA-N 398.890 5.973 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1C=NNc1cccc2ncccc12 740761156 WIELXTJZWQTQCD-UHFFFAOYSA-N 389.890 5.196 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1c[nH]c2cc(Br)ccc12 742434680 MRPURAJVKTVOHT-CLFYSBASSA-N 392.256 5.217 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 742960321 CVUFYZNEKTXABI-FMIVXFBMSA-N 383.382 5.013 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc3c4c(cccc24)CC3)cc1OCCCC#N 747361432 MNSPRWBFRHLURA-QPEQYQDCSA-N 397.474 5.526 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4ccsc4)c23)cc1 749100010 YBUXJPXJSTZERZ-UHFFFAOYSA-N 380.498 5.265 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 752235177 IGBVIOFEQQNRHC-KSSFIOAISA-N 385.920 5.571 30 20 GKED CC(C)C[C@@H](C)OCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 756231466 MOKBOFZMPWZXCX-PBHICJAKSA-N 390.936 5.481 30 20 GKED CC1(C)CCC[C@@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1 756530268 UNEYEYKMLGRRBF-FUHWJXTLSA-N 377.513 5.465 30 20 GKED C=C(Cl)COc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CC)cc1 760889131 VKRKIINPYQOCKS-INIZCTEOSA-N 384.907 5.290 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 772983865 MNSVOVJPTOCVOM-WIYYLYMNSA-N 395.522 5.348 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc(Cl)cc(Cl)c2)ccc1OC 772985023 IMGULKASQVCGQP-UGSOOPFHSA-N 393.314 5.534 30 20 GKED C#CC[C@H](NCc1cccc(CN[C@@H](CC#C)c2ccccc2)c1)c1ccccc1 775402942 DNWDASFNHWAFIL-NSOVKSMOSA-N 392.546 5.395 30 20 GKED N#C[C@H](C(=O)C1=CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 783069694 KPSUYCVSBDWGNB-CQSZACIVSA-N 377.296 5.794 30 20 GKED N#CCCn1cc(/C=C2\CCc3[nH]c4ccccc4c3C2=O)c(-c2ccccc2)n1 788353207 DWOKXRJAQNFSSC-OBGWFSINSA-N 392.462 5.158 30 20 GKED N#Cc1ccc(CN[C@H](c2sccc2Br)C2CCCCC2)nc1 793558319 ROWLPSHYDQBWAD-KRWDZBQOSA-N 390.350 5.188 30 20 GKED C[C@@H]1C[C@@H](C=NOc2ccccc2C(F)(F)F)CCN1C(=O)OC(C)(C)C 807981290 GKTMKGOUDMPWDK-KGLIPLIRSA-N 386.414 5.106 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1csc(-c2ccccc2F)n1 812226574 PFVDRCDMJAYCAD-UHFFFAOYSA-N 380.370 5.199 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)(F)F 815911459 BYVNVDRDVNDYAX-LDYMZIIASA-N 389.254 5.584 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1ccc(Cl)s1 839399278 PBAAKUICPIBROV-UHFFFAOYSA-N 389.720 5.138 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@H](C#N)c3ccc4ccccc4n3)cs2)c1 916848381 JZSUBHNUAXVLMJ-LJQANCHMSA-N 383.476 5.086 30 20 GKED C=CCCCCCCCCCNc1nc(C)nc2sc(C(=O)O)c(C)c12 1776172509 SMOPOKROKWZUSL-UHFFFAOYSA-N 375.538 5.725 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)cc2)cc1)c1ccccc1 1776469397 GPQUOWGJFGWYOL-OUONJDMISA-N 398.458 5.821 30 20 GKED COc1cc(Cl)c(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1Cl 1777313029 AOLLNDPWWPFHCV-XYOKQWHBSA-N 391.250 5.303 30 20 GKED N#CCCSc1nnc(-c2cc(-c3ccc(Cl)cc3)nc3ccccc23)o1 4325764 JREIRHHSMDYNDX-UHFFFAOYSA-N 392.871 5.611 30 20 GKED C=CCn1c(SCc2nc3ccccc3c3ccccc23)nnc1-c1ccco1 23202108 WUOWZIKJNYYQBT-UHFFFAOYSA-N 398.491 5.718 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1cccc(F)c1 28495513 NYLMKNIZLRTFJG-VAWYXSNFSA-N 379.818 5.628 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)C(=O)c1cc(C)ccc1C 32788532 KNHFTLALKPGSSW-SFHVURJKSA-N 391.540 5.035 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc(Cl)c1OCC(C)C 41547218 MTUOWCONPAPPAW-CQSZACIVSA-N 398.846 5.015 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 59994574 FGGQXUROUQNWLB-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1cccc2ccccc12 66861020 NURDNTQENADMFR-MRXNPFEDSA-N 375.497 5.285 30 20 GKED COc1c(C)cc(CN(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 66956041 FPBUFDFLOVAMAG-QGZVFWFLSA-N 397.544 5.370 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)CCCCc1ccccc1 109028398 LJIUHPGDHJWQQD-SFHVURJKSA-N 381.545 5.567 30 20 GKED C[C@H](c1cccnc1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116635166 YUVFKTSPZWCNHU-OAHLLOKOSA-N 391.858 5.232 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1 135417017 JRDQXOMMSYFQQO-UHFFFAOYSA-N 395.528 5.134 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 153465371 RSWZNECOTRQIIE-CYBMUJFWSA-N 389.318 5.262 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 153717206 HCRIGNQGJQCAMO-JOCHJYFZSA-N 386.455 5.361 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)c1ccccc1 155762697 RYQAKSZDBPEHEC-PIKZIKFNSA-N 398.572 5.563 30 20 GKED C[C@@H]1CCN(C(=O)CNc2ccccc2SCCC#N)c2ccccc2S1 170982957 XDYPWMCTGRFBLP-MRXNPFEDSA-N 397.569 5.022 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(OCC(F)(F)F)cc1 180971523 GAKWOZOIWPBMOW-HNNXBMFYSA-N 376.422 5.280 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cc(F)ccc1SCC(F)F 184032880 WVKQURSOOQZTEY-NSHDSACASA-N 395.406 5.118 30 20 GKED CCC(C)(C)N/C(S)=C(\C(=O)c1cc(C)c(C)c(C)c1C)[n+]1cccc(C)c1 186980802 OGOQXWWQAQYBBK-UHFFFAOYSA-O 397.608 5.233 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)c(C)n1[C@H](C)c1ccccc1 195659015 KLCFEHBDCKBLBV-OXQOHEQNSA-N 382.467 5.081 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(Oc3ccc(F)cc3)cc2)cc1 237599581 QPTALNQHYMYVRN-QGZVFWFLSA-N 376.431 5.199 30 20 GKED C(=NOCc1csc(C2CCCC2)n1)c1cccc(OCc2ccncc2)c1 255151705 XYIFTGSVEWYBJS-UHFFFAOYSA-N 393.512 5.325 30 20 GKED CCCc1ccc(C(=O)/C(=C(\S)N[C@H]2CCCC[C@@H]2C)[n+]2ccccc2)cc1 280503684 CYEBDQLZFWYAGO-RXVVDRJESA-O 395.592 5.034 30 20 GKED Cc1csc(Sc2c(Cl)cccc2N=C(O)[C@H]2C[C@]23CCOC3)n1 329659370 NTFSVUPEROPUFM-DIFFPNOSSA-N 380.922 5.271 30 20 GKED O/C(=N/[C@@H]1CCCc2c[nH]nc21)C1(c2cccc(C(F)(F)F)c2)CCCC1 330164439 WAGPWFOZSSFDES-MRXNPFEDSA-N 377.410 5.274 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@H](C)C[C@@H](C)C2 410994862 BQZFDGSKIMIREE-VXGBXAGGSA-N 395.484 5.043 30 20 GKED COC(=O)[C@H](C)c1cccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 416822624 XKGZJYQFTOQZKT-LSDHHAIUSA-N 397.500 5.001 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 425645384 CFXWIJOYSHFMGN-HNNXBMFYSA-N 381.524 5.032 30 20 GKED C=CCC[C@H](NC(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 429085545 ZTAPMGNLHPQMCO-XPWALMASSA-N 378.516 5.161 30 20 GKED Fc1ccc(F)c([C@H](NCc2nc3cc(C(F)(F)F)ccc3o2)C(F)F)c1 434667543 WGTYRZNEUBSJIG-HNNXBMFYSA-N 392.274 5.221 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 435171451 QFIKVEULTNBQGO-YADHBBJMSA-N 375.516 5.424 30 20 GKED Cc1cc(Br)ccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 437567514 LWWPYIGEQBQKSB-PKOBYXMFSA-N 398.304 5.061 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)NCc1ccc(Sc2ccccc2)cc1 438165549 LGVZPOSTDQOAGM-UHFFFAOYSA-N 387.508 5.051 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccccn2)c1 438655436 KDOICJYPOAIQAD-YADHBBJMSA-N 398.466 5.178 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 443850655 BAKLODFFTORWDZ-GFCCVEGCSA-N 383.498 5.093 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1c(F)cccc1F 446249717 SQIIABGFWVOXBM-ZDUSSCGKSA-N 397.265 5.407 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccccc1 455028077 WPGAIIHOOOIMPX-HNNXBMFYSA-N 383.402 5.057 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)o1 458794224 AOOKVLJYOQEVIZ-RTWAWAEBSA-N 379.504 5.650 30 20 GKED CC1(C)CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C[C@H]1c1ccccc1 458804823 SZSIBEOGDYOBPF-VXKWHMMOSA-N 375.516 5.257 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2cc(F)ccc2F)c2ccccc2Cl)c1 460555869 UDJGURQGOSNVMI-OAQYLSRUSA-N 396.824 5.204 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(C#N)c(F)c3)cc2)cs1 464647777 KVWGYEWUTNPTCH-UHFFFAOYSA-N 383.473 5.007 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)c(Cl)c1 469285418 UOUSOGDUUGKRSG-AWEZNQCLSA-N 385.870 5.235 30 20 GKED CC(C)COC1CCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1 472758264 XAPWLZLTTQIODW-UHFFFAOYSA-N 376.544 5.023 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 474902468 VCJZKGCUTKEQNO-OAQYLSRUSA-N 397.478 5.273 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@H](c1ccc(F)cc1)C(F)(F)F 479570204 UWZOZWMZHABMJC-CYBMUJFWSA-N 380.263 5.270 30 20 GKED CCO[C@@H](C)c1nc(COc2ccc(Oc3ccc(C#N)cc3)cc2)cs1 480337479 SEOOJIBPTQHEKW-HNNXBMFYSA-N 380.469 5.484 30 20 GKED C=C(C)[C@H](N[C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480659728 DMJMZSZKCATIHX-XCLFUZPHSA-N 376.403 5.240 30 20 GKED CCCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@@H]1CCCc2cccnc21 480819638 RWZOXJRCGYIBAC-HXUWFJFHSA-N 392.503 5.062 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H](c1cccc(Cl)c1)c1ccccn1 481654475 VKFCNDSATOFPJD-VWNXMTODSA-N 387.914 5.753 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(OCc2cccnc2)c1 485334233 WVXCJOWXCQIDIS-UHFFFAOYSA-N 379.504 5.261 30 20 GKED O=C(NC[C@@H](c1ccccc1)C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 486538133 VNVXEHARONEPPQ-ZDUSSCGKSA-N 394.290 5.312 30 20 GKED N#Cc1ccc(C(=O)Nc2nc(-c3ccccc3C(F)(F)F)cs2)s1 487044100 KZHOYFNXNBWPHT-UHFFFAOYSA-N 379.388 5.014 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(CN2CCSCC2)cc1C)c1ccccc1 488705155 UHWOYUSLQCAVHL-QFIPXVFZSA-N 394.584 5.232 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1cc(-c2ccc(F)cc2)no1 488784655 QUDPTWRBBPJKLE-UHFFFAOYSA-N 379.338 5.058 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)C1 501094413 MSTHXBVQFYXWOU-ONTLXTELSA-N 396.575 5.440 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC[C@@H](c2ccccc2F)C1 504123872 WUAONBMCWNNDAC-WOJBJXKFSA-N 398.526 5.027 30 20 GKED N#CCCCn1cc(C(=O)N2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)c2ccccc21 504124978 MFGSLGJLMZVYAQ-FGZHOGPDSA-N 395.506 5.406 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C1CCC(F)(F)CC1 505366112 KDFJARGPKCMIMS-LBPRGKRZSA-N 389.286 5.251 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 509639950 NOSSTSZKHZCHNT-QGZVFWFLSA-N 388.492 5.257 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCCC2CCCCC2)cc1 511320634 ICYHZUBLOVMOHK-UHFFFAOYSA-N 391.515 5.424 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)o1 520829844 UUCQCVRHDYEFBP-KRWDZBQOSA-N 390.508 5.770 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)cc1 520855236 FMHWJTXNHJMGDT-YOEHRIQHSA-N 387.936 5.865 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2oc3ccc(OC)cc3c2C)ccc1OC 521337395 WTLQBXPJVOQVLU-KRWDZBQOSA-N 395.499 5.564 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)Cc1ncc(-c2ccc(Cl)cc2)o1 521710952 HOAUNWZPBZTRAR-UHFFFAOYSA-N 383.835 5.091 30 20 GKED Cc1cccc(C)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 522575190 QTFUAUQCFIMCCM-UHFFFAOYSA-N 376.843 5.873 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2ccco2)nc2onc(CCC)c12 523511374 CTVJBVIADGIVDS-UHFFFAOYSA-N 381.476 5.254 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 527229204 DKZIAPMRJPCKIK-PGRDOPGGSA-N 378.472 5.180 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](N[C@H](C)c2cccc(C#N)c2)CCC3)cc1 539495147 FSVZRJYAYIQCFF-FOIQADDNSA-N 389.524 5.419 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](N[C@@H](C)c2cccc(C#N)c2)CCC3)cc1 539495150 FSVZRJYAYIQCFF-YWZLYKJASA-N 389.524 5.419 30 20 GKED COc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Br 551211546 JGYXOHIIEWIHGE-HNAYVOBHSA-N 387.321 5.543 30 20 GKED CC(C)C[C@@H](NCc1cnc2ccc(C#N)cn12)c1cccc(C(F)(F)F)c1 551530724 VWUDWCQMIWVFLG-LJQANCHMSA-N 386.421 5.102 30 20 GKED N#CCCC[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 552083615 POCJFITYNCZUFD-SANMLTNESA-N 395.506 5.662 30 20 GKED Cc1c(C#N)cccc1NC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 558608188 KITUCLVKJCRMRW-UHFFFAOYSA-N 397.450 5.185 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 561712675 QXGWNFUAGFBZFR-UHFFFAOYSA-N 381.863 5.064 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(Cl)c1 562189854 MMYKVAYYCVXRQK-CQSZACIVSA-N 377.831 5.141 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cn1 573065956 RYFOGVXYLWTPDV-MRXNPFEDSA-N 389.480 5.520 30 20 GKED CCCCC[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 579695910 CNIMOPUMFIBPOV-LJQANCHMSA-N 378.476 5.322 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C\c1cccc(Cl)c1 588482892 ZUCWATOXAKYJPI-CFYYFVFUSA-N 392.933 5.004 30 20 GKED N#CCCCCCC(=O)N[C@@H](Cc1ccccc1)c1nc2ccccc2s1 590880602 HGLJQUUASPMLNI-IBGZPJMESA-N 377.513 5.170 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12 606814469 HPOPEWROEPVQSY-UHFFFAOYSA-N 381.476 5.425 30 20 GKED Cc1ccc(Sc2ccc(CNCc3cccc(C#N)c3)cc2[N+](=O)[O-])cc1 608982256 IJEOSZMMXYQSIV-UHFFFAOYSA-N 389.480 5.216 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CCc3ccc(F)cc32)cc1 609296833 YONPSIRBLUJODH-OAQYLSRUSA-N 387.414 5.299 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3sccc3OC(F)F)cc2)c1 609426952 BNCQXMZLJCWNAE-UHFFFAOYSA-N 386.379 5.266 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 609682754 AWGHHAYWXHJDOW-NQIIRXRSSA-N 397.478 5.760 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc(C(C)C)nc2c1 609810026 FAIUANWTQADDAV-UHFFFAOYSA-N 390.487 5.513 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)Cc2c[nH]c3ccc(Cl)cc23)cc1 610064349 ARDRXWZXFYJLBJ-HXUWFJFHSA-N 379.891 5.042 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)N[C@H](C)c3cccc(C#N)c3)cc2)cs1 610347396 IUFWUHQROSJNGB-LSDHHAIUSA-N 390.512 5.112 30 20 GKED C[C@@H](NC(=O)NCCSCc1cccc2ccccc12)c1cccc(C#N)c1 610348988 MONPUULPQZESGV-QGZVFWFLSA-N 389.524 5.005 30 20 GKED C=CCN(Cc1ccccc1)C(=O)NCCc1ccc(-c2csc(C)n2)s1 612256549 NIMUAWFMDSQXGG-UHFFFAOYSA-N 397.569 5.120 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N2CCC[C@@](C)(C#N)C2)cc1 612293712 TZMFLBLFPFUJAC-QFIPXVFZSA-N 379.460 5.035 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc2ccccc2n1C(F)F 613401995 WNFFJQXYWXLQES-SFHVURJKSA-N 393.437 5.969 30 20 GKED CCOC(=O)c1ccc(-c2ccc(CN[C@@H](CCC#N)c3ccccc3)o2)cc1 614245881 ZHQSKHFXNJHEOH-QFIPXVFZSA-N 388.467 5.258 30 20 GKED C#Cc1cccc(NC(=S)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1 726439118 KLXFGGXGUMKEMN-JOCHJYFZSA-N 395.531 5.268 30 20 GKED CC(C)C(=O)Nc1ccc(C2=NNC(=Nc3ccccc3C(C)C)SC2)cc1 727173372 WLCFAQWYEMEVSZ-UHFFFAOYSA-N 394.544 5.133 30 20 GKED Cc1sc(CNCc2ccc(O[C@H](C)C#N)cc2)nc1-c1ccc(Cl)cc1 729680523 TXJMZRIQXCVZBK-CQSZACIVSA-N 397.931 5.353 30 20 GKED N#C[C@H](C(=O)c1ccccc1SC(F)(F)F)c1nc2cc(F)ccc2s1 730417802 QZBILPAVZNDZJW-LLVKDONJSA-N 396.390 5.537 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(CCc1ccccc1)C1CC1 731114026 CDXPRDAYMFELGA-QGZVFWFLSA-N 379.529 5.177 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2SC(F)F)c1 733842417 UNUDYBIPVYLMRH-AWEZNQCLSA-N 391.443 5.004 30 20 GKED C=CC[C@H](NC(=O)N(CCCCC)Cc1ccc(Cl)cc1)c1ccncc1 734683871 RFMASBSXHQEPPJ-NRFANRHFSA-N 385.939 5.754 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CSc3ccccc32)cc1 735568004 ZZGAJUSFOBEALC-RTWAWAEBSA-N 385.492 5.311 30 20 GKED C=CCN(C(=O)c1c(C)n(Cc2ccccc2)c2ccc(OC)cc12)C(C)C 737494791 BZBZYMTXFZTQPS-UHFFFAOYSA-N 376.500 5.043 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3ccc(Cl)cc23)cc1 739511744 MNFFMIDVYQCSQW-JOCHJYFZSA-N 399.881 5.658 30 20 GKED C[C@H](CC#N)N(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 740743841 FJUBVHGPRPEEID-MRXNPFEDSA-N 382.463 5.307 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 740783553 SBLABALTYHNTPT-UHFFFAOYSA-N 385.851 5.119 30 20 GKED COc1cccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1OC(F)F 741473223 OMFAKPQILNXCIC-CMDGGOBGSA-N 381.378 5.255 30 20 GKED Cc1cc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)ccc1-n1cncn1 742434838 OIDYERXJSRSGKJ-SXGWCWSVSA-N 397.450 5.103 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 743200522 HCBALJTWKKGXQA-CYBMUJFWSA-N 394.368 5.081 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 744034756 LEIMNVJDFWVQNI-YVEFUNNKSA-N 384.863 5.583 30 20 GKED CCCN(C)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 746365460 WQRAZZZBMBUVTL-DEOSSOPVSA-N 383.495 5.441 30 20 GKED C=CCN(C(=O)c1cccc(Cl)c1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 750159804 AJDYSMSHDDDWQP-UHFFFAOYSA-N 399.859 5.205 30 20 GKED C=C(C)[C@H](CC(=O)O[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1)OCC 756475573 CRYOXZTVCUSBCS-YOEHRIQHSA-N 377.868 5.279 30 20 GKED C[C@H]1Cc2cc(-c3ccc(CNCc4ccc(O[C@H](C)C#N)cc4)cc3)ccc2O1 756991787 WLJXBYDYUTYTHR-RBUKOAKNSA-N 398.506 5.258 30 20 GKED C=CCn1c(SCc2cc(Cl)nc(Cl)c2)nnc1-c1cccs1 768415636 QDTXUBLSIXUIRW-UHFFFAOYSA-N 383.329 5.187 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1)c1ccco1 769771574 QSBPDSSPVMJLTC-RMKNXTFCSA-N 386.234 5.735 30 20 GKED CC[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccccc1OC(F)F 775052808 XYNNBMPPQCHXOQ-MRXNPFEDSA-N 380.822 5.085 30 20 GKED COc1cc2c(cc1NC(=O)c1ccc(Cl)c(C#N)c1)oc1ccccc12 775611553 WPCYCUMFPFTQLO-UHFFFAOYSA-N 376.799 5.372 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c(C)cc(C)cc3C)n2)cc1 784497485 CZNRWZCAEIFJPE-HXUWFJFHSA-N 390.508 5.163 30 20 GKED N#C[C@H](C(=O)Cc1coc2ccc3ccccc3c12)c1nccc2ccccc12 792095920 YGERSZIIXHSJED-OAQYLSRUSA-N 376.415 5.553 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2csc(-c3ccc(Cl)cc3)c2)c1 796746438 KRGMGYISLOBKEF-GOSISDBHSA-N 394.883 5.338 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1 800578931 WGFHJSXYGZTKFY-RBBKRZOGSA-N 382.479 5.064 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801686927 CNORBEYACOINTH-OAHLLOKOSA-N 395.274 5.138 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1coc2ccc(C(C)C)cc12 805844344 IJDBFKLLCLLHOP-GOSISDBHSA-N 384.435 5.551 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccnc(C(F)(F)F)c1 808300510 PANQQNGTWSSASA-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(N2CCCCC2)cc1)c1ccccc1 814484604 VHOPSAPONGCUGV-JOCHJYFZSA-N 376.504 5.234 30 20 GKED C[C@@H](c1cccs1)N1C(=O)/C(=C\c2ccc(C(C)(C)C#N)cc2)SC1=S 846756871 NQOZDZBXFFNCTO-HNEYUBDGSA-N 398.578 5.512 30 20 GKED Cc1cc(C(F)(F)F)c(NC(CCC(F)(F)F)CCC(F)(F)F)nn1 853871930 JFDUPFVWBDACJI-UHFFFAOYSA-N 383.258 5.269 30 20 GKED C[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 878217590 AWGXXWQMWFULNJ-QUCCMNQESA-N 387.405 5.148 30 20 GKED N#C[C@H](C(=O)CCc1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 915102251 UPDYFMLSMYCVCG-QGZVFWFLSA-N 384.863 5.412 30 20 GKED COc1ccc(/C=C/C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1OC 915179340 CFYVDUKGDYMVPK-OZOJFGJPSA-N 398.462 5.011 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2nc3ccccc3s2)cc1 915180634 QOKIERZBIRWNRQ-DAMWEWLOSA-N 395.487 5.604 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1cc(Cl)nc2ccccc12 916559840 XHAADCCENCPGLC-UHFFFAOYSA-N 387.222 5.031 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)Cc2coc3ccc4ccccc4c23)cc1 916914137 WHUJPGGCELFLIN-OAQYLSRUSA-N 396.446 5.038 30 20 GKED Cc1ccc(CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1C 917044606 TVYGIWVPWHZSNE-HNNXBMFYSA-N 388.414 5.351 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(Oc2ccccc2)c(F)c1 1776049850 PLOZVCQCAZAVMB-UHFFFAOYSA-N 394.402 5.161 30 20 GKED CCC(=NNc1ccc(Cl)cc1C)c1ccc(OCCCCC(=O)O)cc1 1776104685 UTTDYLXPLLCCIB-UHFFFAOYSA-N 388.895 5.508 30 20 GKED C=C(C)C[C@@H](NCc1ccc(Cl)cc1Oc1ccc(Cl)c(F)c1)C(=O)O 1776137596 WLJOKKPSBIVOMX-QGZVFWFLSA-N 398.261 5.434 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1OCC 1776801248 FMYNNLNAYIZJNG-FLIBITNWSA-N 382.456 5.167 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\COc4ccc(Cl)cc4C3=O)s2)c1 1777684309 LTHHFLOXBGAWFG-NTEUORMPSA-N 396.851 5.425 30 20 GKED N#CCCCSc1nnc(-c2ccc(Cl)cc2Cl)n1-c1ccccc1 5360752 MNNZSAAMFFGJGM-UHFFFAOYSA-N 389.311 5.637 30 20 GKED Cc1ccc(S(=O)(=O)Nc2ccc(/N=C(O)/C=C\c3ccccc3)cc2)cc1 5764283 AWMUPDPFDIRGCS-SXGWCWSVSA-N 392.480 5.097 30 20 GKED COc1ccc(CSc2nnc(SCc3cccc(C#N)c3)s2)cc1 5871656 CYZWSNHAANRPTA-UHFFFAOYSA-N 385.539 5.003 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1ccc(Cl)cc1 28173967 RQICXFQYNWSQRE-UHFFFAOYSA-N 389.883 5.128 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Br)ccc2o1)c1nc2ccccc2s1 41498207 NWORSTISESGSII-GFCCVEGCSA-N 397.253 5.295 30 20 GKED CN(Cc1ccsc1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 61083869 LHDBJDVSPUDZNN-UHFFFAOYSA-N 378.522 5.184 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 65743770 GULZNBHLKACCFM-UHFFFAOYSA-N 395.233 5.307 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(O)c(Cl)c1 102791419 KARVEJQRIOEPDC-UHFFFAOYSA-N 392.842 5.057 30 20 GKED N#C[C@@H](C(=O)c1cccn1Cc1ccccc1)c1nc2cc(Cl)ccc2s1 120032087 FXSHGIZNIPQHOR-INIZCTEOSA-N 391.883 5.290 30 20 GKED C[C@@H](Sc1cc(C#N)ccn1)C(=O)N1c2ccccc2Sc2ccccc21 125679194 BLPIRFCBEXJOOT-CQSZACIVSA-N 389.505 5.263 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cncc(-c3ccc(Cl)cc3)c2)n1 126115468 IVHSNSYMJJJMPJ-QGZVFWFLSA-N 381.888 5.472 30 20 GKED CC(C)CC(=O)Nc1ccc(Cl)c(C(=O)N[C@H](CCC#N)c2ccccc2)c1 153182143 HVLAZSSWZWXFDU-HXUWFJFHSA-N 397.906 5.099 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccccc1OC(F)(F)F 180203000 OWAYCSHVQCXAIH-LBPRGKRZSA-N 380.391 5.232 30 20 GKED COc1cccc(F)c1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 184439647 SKOSMEVQIWOKCT-UHFFFAOYSA-N 376.387 5.059 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2c(Cl)cccc2Cl)cc1 207055008 DKKIAUNVCZCUBW-KTKRTIGZSA-N 387.266 5.202 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C\c2cccs2)C(=O)c2ccccc2)c(Cl)c1 213691115 HKMYGECPQGQVPO-AQTBWJFISA-N 395.911 5.923 30 20 GKED CCOc1c(Cl)cc(C=NOCc2cc(-c3cccs3)on2)cc1OC 255912043 HFIZEDBTULJISK-UHFFFAOYSA-N 392.864 5.015 30 20 GKED O=C(Nc1ccc(N=C(O)c2ccc3c(c2)CCC3)cc1)N1CCCCCC1 329294513 RXJCXLDYJPXBCN-UHFFFAOYSA-N 377.488 5.220 30 20 GKED O/C(CCc1nnc(-c2ccc(Cl)cc2)o1)=N/[C@H]1CCCCC12CCCC2 329603048 GEINPIALZSXNSJ-KRWDZBQOSA-N 387.911 5.782 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 432100942 WHPMWPRHTPNOPS-KSFYIVLOSA-N 397.519 5.273 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)C1 433148160 FYPQUGZMSMAKDX-HKUYNNGSSA-N 379.529 5.492 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638509 XXIXAADFIHRQIW-NSHDSACASA-N 381.785 5.455 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc([C@@H]3CCC(F)(F)C3)no2)cc1 439570136 LKHSBZBQMRAEHF-CYBMUJFWSA-N 385.345 5.442 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H]2Cc2ccccc2)cc1 443850396 FUNXWBAVXXRSEQ-OAQYLSRUSA-N 383.451 5.199 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 444861963 RZRCDLZIBDZLNS-SFHVURJKSA-N 389.421 5.611 30 20 GKED CN(CCC#N)C(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 444936481 LCQDDJYIXBYYLT-UHFFFAOYSA-N 386.864 5.119 30 20 GKED C[C@@H](NCc1cncn1Cc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 445807382 IPISRORHHQORNC-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CCCC#N)c1ccccc1 455238027 BAWHSQWSAWNXGQ-QFIPXVFZSA-N 375.516 6.095 30 20 GKED Cc1ccccc1[C@@]1(F)CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458855110 XWYJPMPOVIZFRL-FYYLOGMGSA-N 379.479 5.010 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)CCCC#N 462151908 QDARKUUTKVEGCL-UHFFFAOYSA-N 378.451 5.364 30 20 GKED Cc1cc2cc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)oc2cc1C 463101788 LJCKQOHAFKXMLU-UHFFFAOYSA-N 397.434 5.669 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(OC)c(OCc2ccc3ccccc3n2)c1 464448375 WATSHSRPOFTLTA-KRWDZBQOSA-N 390.483 5.363 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 471248839 FIKOYUMYWAOCAG-UGSOOPFHSA-N 389.377 5.155 30 20 GKED C=CCCCCNC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 471686165 RUQYCIGXLKSQCR-UHFFFAOYSA-N 376.909 5.048 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(Br)cc1 476121563 OJOJFRPVKSMKKF-UHFFFAOYSA-N 386.333 5.872 30 20 GKED CN(C)Cc1ccc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cc1 479536134 BVSLCONXRVVOGN-UHFFFAOYSA-N 387.508 5.023 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 483470631 OGCVWOHKHVSSRP-QGZVFWFLSA-N 386.451 5.491 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@H](c3ccccc3)[C@@H]3CCCO3)c2)cc1 483668863 NZAWEKFOLUECJW-BJKOFHAPSA-N 398.462 5.001 30 20 GKED CC1(C)C[C@@]1(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 484907956 JCJRZDPHUUFNJA-QFIPXVFZSA-N 394.471 5.286 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cnn(C(CC)CC)c1CC 485184698 UBRXNGXFZKLTCC-UHFFFAOYSA-N 381.524 5.122 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nc(-c2ccccc2OC)cs1 485728625 FMVHRKRGDXBDIV-UHFFFAOYSA-N 382.510 5.349 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487393128 TYBIOXKFHHLELM-OXQOHEQNSA-N 399.332 5.179 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 503352765 DZJXOEUCJJXTJY-GOTSBHOMSA-N 386.451 5.066 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)Cc1cn(CCC#N)nc1-c1ccccc1 510461360 YOKVFNKDCVJZCZ-UHFFFAOYSA-N 398.432 5.115 30 20 GKED COc1cccc(SCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 511621432 DBDJVNASGUUWHH-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CC(C)(C(=O)Nc1ccc(COC2CCCC2)cc1)c1cc(F)cc(C#N)c1 513281630 SIWAHUBOKJWYFP-UHFFFAOYSA-N 380.463 5.073 30 20 GKED Cc1cc(=NC(=O)Nc2ccccc2S[C@@H](C)CC#N)[nH]n1C1CCCCC1 515493364 UOEWXBNUCLKMHJ-INIZCTEOSA-N 397.548 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(-c2ccccc2)cc1 518140265 JDNUXOPEUPBJMY-SFHVURJKSA-N 386.520 5.787 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1 523142205 ZLBRMCDREMYOMG-NLFFAJNJSA-N 390.527 5.416 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC[C@@H]2c2ccccn2)cc1 532049686 BJMRRDYGQLFVCT-JOCHJYFZSA-N 383.451 5.031 30 20 GKED C[C@H](NCC#Cc1cccc(Cl)c1)c1cccc(OCc2ccccn2)c1 537052356 CHICWXMZJWNDFC-SFHVURJKSA-N 376.887 5.016 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 539506587 CGANBLIPBFXNOL-KDOFPFPSSA-N 383.289 5.891 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)CC1 540296484 SHKZYUCAWQDNTL-HPYQEZSOSA-N 398.909 5.303 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCO[C@@H](c2ccc(C(F)(F)F)cc2)C1 542015025 FCXKEHWSEMXCAM-HXUWFJFHSA-N 388.433 5.080 30 20 GKED C[C@@H](NCc1coc(-c2cccc(F)c2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542945024 JNCDOUXOJCKWCA-QGZVFWFLSA-N 397.453 5.870 30 20 GKED COc1ccc([C@@H](NCc2cccc(C#N)c2F)c2ccccc2Cl)cc1 544084793 JVBNMDBBZUVWKI-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CC(C)Sc1cc(Br)ccc1CNc1cc(CC#N)ccn1 547340200 MXDHDRZCVKAYCG-UHFFFAOYSA-N 376.323 5.023 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 551204929 HLOOHOLDJKFCMB-XMSQKQJNSA-N 389.568 6.128 30 20 GKED C=CCn1c(S[C@H](C)CCC#N)nc2sc(-c3ccccc3)cc2c1=O 551391087 QMOLCMVDGSPXHQ-CQSZACIVSA-N 381.526 5.095 30 20 GKED N#Cc1ccc(C[C@@H](C#N)c2nc(-c3ccc(OC4CCCCC4)cc3)no2)cc1 563568428 QEMRLAMQLATQAA-FQEVSTJZSA-N 398.466 5.170 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)NCC1CCC(C#N)CC1 565871928 BPBUXTJDMAKNNX-UHFFFAOYSA-N 397.522 5.199 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(N2CCC(C)CC2)c1 576152694 TYPWPHNNJVKNDE-UHFFFAOYSA-N 377.532 5.186 30 20 GKED C[C@H](C(=O)N(Cc1ccccc1)c1ccccc1C#N)c1ccc(F)c(F)c1 576274801 VHKZLHUPSBHSOX-INIZCTEOSA-N 376.406 5.173 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@@H]1CCOC(C)(C)C1 589243751 OZXGNTZHTYZSKM-LJQANCHMSA-N 393.487 5.162 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603831252 YNMAYALVXCOJCM-QFIPXVFZSA-N 398.466 5.423 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3csc(-c4ccccc4Cl)n3)[nH]c12 605363110 JJTQIOWMOYVMKW-ZDUSSCGKSA-N 392.871 5.138 30 20 GKED CC(C)(C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1 605452862 JZWPXYIDUOTMJO-VXGBXAGGSA-N 399.350 5.129 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2COc3ccccc32)cc1Cl 609587057 UDIRAWMZAITFKV-PMACEKPBSA-N 388.854 5.110 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609682254 FMVOHMZOXDBDPI-GHTZIAJQSA-N 397.478 5.760 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc3[nH]ccc3c2)c1 609729753 OYIUHOHNLUNSKD-UHFFFAOYSA-N 387.826 5.738 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3occc3s2)cc1Cl 609856794 LTYPNPZFQDBYLV-MRXNPFEDSA-N 392.867 6.055 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccccc2F)CC1 609930300 ZMAOEILJITZAMK-MRXNPFEDSA-N 397.519 5.489 30 20 GKED CC(C)(C)c1ccc(OCc2ccc(C(=O)[C@H](C#N)c3ccccn3)cc2)cc1 612893403 CPFUFZOCBPBJHB-JOCHJYFZSA-N 384.479 5.448 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2 613515405 ZIFSSZPBXOYOMK-UGKGYDQZSA-N 399.563 5.454 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1SCC(F)(F)F)c1ccccc1 619425955 QSEIQYPJWSKFAV-HNNXBMFYSA-N 378.419 5.367 30 20 GKED COc1cc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 622541443 QUWZAKRNXROTMN-UHFFFAOYSA-N 381.247 5.124 30 20 GKED C[C@H](CC(=O)N1CCC2(CC1)C(F)(F)C2(F)F)c1ccc(C(F)(F)F)cc1 650351656 PCPKILLEPRHNMN-LLVKDONJSA-N 397.334 5.092 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2)n1 657528484 BYKZBEWNCAFXQU-NQIIRXRSSA-N 383.561 5.361 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3ccccc3CC)n2)C1 661378917 OLYKWYVJPGLCFY-GOSISDBHSA-N 383.561 5.178 30 20 GKED O=C(C/C=C\c1cccc(F)c1)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 674080663 MKNKDMKKNWUTOZ-AAVOCRIGSA-N 397.334 5.255 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2cccc(C#Cc3cccs3)c2)C1 680450962 XUTJBPGVVJJKKQ-VGOFRKELSA-N 387.508 5.158 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1csc(COc2ccc(F)cc2)n1 732644534 VSAFDEYMXKBLOL-UHFFFAOYSA-N 388.508 5.070 30 20 GKED O=C(/C=C/c1ccc(-c2c(F)cccc2F)o1)c1ccc(N2CCOC2=O)cc1 734368930 ZUEKVVJSMJXGKI-CSKARUKUSA-N 395.361 5.078 30 20 GKED C#CCN(C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C)C1CCCCC1 734389604 JLODCLIJUKLYOB-UHFFFAOYSA-N 391.437 5.044 30 20 GKED O=C(/C=C/c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)c1cnccn1 734751247 KLGPGNVRZUQBOT-XBXARRHUSA-N 385.250 5.259 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)ccc1OC(F)F 734979308 BPLCANQWSMETOP-KRXBUXKQSA-N 386.366 5.507 30 20 GKED O=C(/C=C/c1nccs1)c1ccc(-c2ccc(Br)cc2)s1 735228905 KWBHDBLQRGFRLT-VMPITWQZSA-N 376.300 5.530 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)OCc1cc(Cl)ccc1OCC#N 735343580 BISHZQUAVZRKSC-GFCCVEGCSA-N 396.295 5.120 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 740037553 YPYCSUGQEREETM-AUUYWEPGSA-N 391.496 5.003 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 740435549 PVFSWQSVIQHLEF-DNQXCXABSA-N 398.510 5.742 30 20 GKED CN(CCC#N)c1ccc(CN[C@@H](c2ccc(F)cc2)c2cccs2)cc1 743763956 YUNXGVCSTWMLHR-QFIPXVFZSA-N 379.504 5.116 30 20 GKED CCOCc1cc(/C=C\C(=O)c2cc(Br)ccc2F)ccc1OC 763120566 AHWNCQWOLSIYFW-YWEYNIOJSA-N 393.252 5.029 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccccc2F)c2nccn2C)cc1 764814664 OBYGNZJQCWPWDE-HRAATJIYSA-N 399.897 5.131 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(COc3cccc(F)c3)c2)cc1 770527412 IQACGDQKELTQQJ-KRWDZBQOSA-N 376.431 5.308 30 20 GKED C#CC[C@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccccc1 773115216 NBCZFLDETZGDLO-NLFFAJNJSA-N 395.506 5.329 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc(N2CCCCC2)c(F)c1 788351864 ZMPFKDLFDCIPAP-VOTSOKGWSA-N 384.398 5.187 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)cc1 796747949 SCPBPGMIWQZTHZ-IBGZPJMESA-N 384.426 5.102 30 20 GKED CC[C@@H](NC(=O)[C@H](C#N)C(=O)c1coc2ccc(C(C)C)cc12)c1ccccc1 805928911 RQJACSCFFRQKBE-TZIWHRDSSA-N 388.467 5.146 30 20 GKED C=CCCCCCCCNC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1 812493261 CHPFLEDGVIKSNP-SFTDATJTSA-N 376.516 5.214 30 20 GKED CC(C)(C)OC(=O)N1CCC[C@@H](CCN[C@H](CCCC#N)c2ccccc2)C1 814661111 VPUIFPFNSXXLQI-PZJWPPBQSA-N 385.552 5.048 30 20 GKED C[C@@H](NCc1cc(C#N)cc(CN[C@H](C)c2ccsc2)c1)c1ccsc1 878560764 GAOBWJLGHLJTCK-HZPDHXFCSA-N 381.570 5.383 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3csc(-c4ccccn4)n3)oc12 915985466 LDFYONYBQOHNKE-KTKRTIGZSA-N 376.437 5.246 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Oc1ccc(C#N)cc1 916851937 LNQRYEJBVQFRRW-UHFFFAOYSA-N 396.855 5.053 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1)C(=O)Nc1ccccc1Oc1ccccc1 916911668 XGZGOXPYUVSRRN-NRFANRHFSA-N 398.462 5.149 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Oc3cccc(Cl)c3)n2)cc1 916972338 NGKNJGDTECOCPJ-KDOFPFPSSA-N 396.899 5.416 30 20 GKED N#C[C@H](C(=O)CCc1cccc(Cl)c1)c1nc2cc(Cl)ccc2s1 917046155 GMQRWHGUYJRZJV-CQSZACIVSA-N 375.280 5.412 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3ccccc3Cl)cc2)c1 1776115030 KFIAKFZLUYQQFC-RAXLEYEMSA-N 376.839 5.530 30 20 GKED CC(C)(C)c1cncc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776278123 INRXHNBGXUPAOX-WTKPLQERSA-N 375.424 5.233 30 20 GKED CCCCCCCOc1ccc(/C=C\c2ncc([N+](=O)[O-])cc2C(=O)O)cc1 1776788287 XCPXWPXEFAIKGD-XFXZXTDPSA-N 384.432 5.208 30 20 GKED Cc1ccc(-n2c(SCc3cccc(C#N)c3)nnc2-c2ccncc2)cc1C 4491042 JXXQUSJCHZMPBA-UHFFFAOYSA-N 397.507 5.110 30 20 GKED C=CCN(CCC(=O)Nc1ccccc1SC)Cc1ccc(Cl)s1 71818046 ZATUFJUKQFTZBW-UHFFFAOYSA-N 380.966 5.140 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1nnc(-c2ccccc2)o1 97543277 JCPYBSGVAAZVRV-KRWDZBQOSA-N 396.450 5.360 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(F)cc1)CC1CC1 115769545 FVFRLZSEOLSEGR-MRXNPFEDSA-N 397.519 5.522 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(-c2ccc(Cl)s2)o1 120972871 PDCCWEVJROKWHP-UHFFFAOYSA-N 375.906 5.545 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)N[C@@H](CCC#N)c3ccccc3)c(C)c2c1 132807217 GPVNHXRYIPEHIX-UZLBHIALSA-N 391.471 5.155 30 20 GKED CC[C@@H](C)OCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 152410133 DWZCDBWFICKDBX-MFKMUULPSA-N 383.300 5.108 30 20 GKED N#CCC[C@@H](NC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccccc1 153664807 KFFTZMFNSRSIHV-LJQANCHMSA-N 393.874 5.089 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N(CCC#N)Cc2ccco2)c1 156157234 GGULITPPYBUQET-UHFFFAOYSA-N 397.422 5.190 30 20 GKED CC(C)c1ccc(-c2ncc(CS(=O)(=O)CCCC(C)(C)C#N)s2)cc1 160620696 NESXMUHPWHFRPZ-UHFFFAOYSA-N 390.574 5.178 30 20 GKED Cc1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C(C)C)n1 172239360 HTOKFDMDSWQHLZ-OAHLLOKOSA-N 396.903 5.175 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cc2sc3ccccc3c2s1 178013229 XMJXCHUCWDKGQB-UHFFFAOYSA-N 382.441 5.410 30 20 GKED CCOc1c(Cl)cc(C=NOCc2coc(-c3cccs3)n2)cc1OC 255869048 BAEDKDROFPONGS-UHFFFAOYSA-N 392.864 5.015 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2noc(C(C)C)n2)CC1 297724165 ITMAPVQVQIBNIO-UHFFFAOYSA-N 396.535 5.456 30 20 GKED C[C@@H]1Oc2c(cccc2C(O)=Nc2ccc3c(c2)OC2(CCCCC2)O3)N=C1O 329170173 JZHKQIKUTJBELA-ZDUSSCGKSA-N 394.427 5.123 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N(C)CC(C)(C)C#N)c(C(F)(F)F)c1 432825579 WLDLFDZNXWKGEQ-GFCCVEGCSA-N 387.471 5.609 30 20 GKED N#Cc1ccc(CSc2nnc(C3CC3)n2Cc2ccccc2)c(Cl)c1 438886825 OAXUNGJOUYMVKO-UHFFFAOYSA-N 380.904 5.021 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccccc2-c2nc3ccccc3s2)C1 454297175 NXPPHGJDXCJZCC-GJZGRUSLSA-N 376.485 5.167 30 20 GKED Cc1c(F)ccc(Cl)c1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 464676913 KASWOZGALPDFFL-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](c1cc(F)ccc1F)c1ccccc1Cl 466229962 LFBLWJQDTWYYGN-IBGZPJMESA-N 376.834 5.091 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)N(C)[C@H](C)CC#N)cc1 467256151 OECWLSCSOQHUEJ-QGZVFWFLSA-N 389.524 5.089 30 20 GKED C=CCCOCCCCC(=O)N1CCC(CC)(c2ccc(Cl)cc2)CC1 470690409 XBEJQEBSKFVQLR-UHFFFAOYSA-N 377.956 5.373 30 20 GKED FC(F)c1cccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 470859828 MGWJSSLXFVAAEA-HNNXBMFYSA-N 397.309 6.426 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccccc1)c1cc(C(F)(F)F)ccc1F 471216441 PUVDKWGDRNTPML-AWEZNQCLSA-N 379.275 5.268 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccc(OC)cc2CC1 475553578 YRGZCUGRKUJNIK-UHFFFAOYSA-N 378.516 5.180 30 20 GKED Cc1nc(CNC(=O)C[C@@H](CC#N)c2ccccc2)oc1-c1ccc(Cl)cc1 476282272 VLYBJKOGODCWJF-GOSISDBHSA-N 393.874 5.007 30 20 GKED CC[C@@H](N[C@H](CO)c1ccc(Cl)cc1C(F)(F)F)c1ccc(C#N)cc1 479528727 JSOXWMOIZVGVOC-QZTJIDSGSA-N 382.813 5.005 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(-c2ccccc2)c(C)c1 480205846 KTYILQVTIJJCQF-UHFFFAOYSA-N 390.483 5.358 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1 482056146 YEOCGDLQFKKKDH-JOCHJYFZSA-N 392.911 5.210 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1nccc2ccccc12 483217370 XHJCLFFNQHFLCK-OAHLLOKOSA-N 375.478 5.218 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(OCC(F)F)cc1 483617236 CHDAQJORSHTNKO-ZDUSSCGKSA-N 391.443 5.226 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCc1ccc(-c2ccccc2)o1 484342698 QEJRBMNTOKSLRJ-UHFFFAOYSA-N 392.503 5.012 30 20 GKED CC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cc(F)cc(Br)c1 486083475 CXPQDFOENPBPFC-ZMZPIMSZSA-N 379.248 5.401 30 20 GKED CC(C)(C)n1ncc(C(=O)[C@H](C#N)c2nccc3ccccc23)c1-c1ccccc1 488714835 VAJMRBQGQYPQAL-HXUWFJFHSA-N 394.478 5.343 30 20 GKED N#C[C@H](C(=O)c1cccn1C1CCCC1)c1nc(-c2c(F)cccc2F)cs1 496590370 GSHLPPWYYQIGPG-CQSZACIVSA-N 397.450 5.495 30 20 GKED CCc1cc(C#N)c(NC(=O)c2csc(-c3ccc(OC(C)C)cc3)n2)s1 501915332 NOGSOPIZLSCAFT-UHFFFAOYSA-N 397.525 5.345 30 20 GKED C[C@H](c1nc2ccccc2n1C(F)F)N1CC=C(c2ccc(C#N)cc2)CC1 502523514 QXIIVQKCSBVXHU-OAHLLOKOSA-N 378.426 5.153 30 20 GKED C[C@@H](NC(=O)Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccc(C#N)cc1 505311541 RISRMZDHTFFTKX-LLVKDONJSA-N 397.784 5.035 30 20 GKED COCCSc1ccc([C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 509541360 KULJPNDNSWCUBD-INIZCTEOSA-N 397.544 5.109 30 20 GKED N#CCCN(Cc1ccco1)C(=O)CCCCc1ccc(Cl)c(Cl)c1 509878495 GOOBSNIKHLEUMY-UHFFFAOYSA-N 379.287 5.242 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Sc1nc(-c2ccccc2)ccc1C#N 510173735 VRUWPJAXSFOBHC-INIZCTEOSA-N 387.508 5.302 30 20 GKED C=C(C)CN(CC)C(=O)[C@@H](C)SCc1coc(-c2cccc(Cl)c2)n1 511013718 KTWTWOUXBZQZRS-CQSZACIVSA-N 378.925 5.041 30 20 GKED CCCCOc1cccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 518681952 NCHDAAGKTABNBY-KRWDZBQOSA-N 397.544 5.439 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)Nc1ccccc1S[C@H](C)CC#N 520195944 RMKJGHNMOHRYLO-OAHLLOKOSA-N 387.936 5.788 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1N1CCCCCC1 521710501 AIRMSEIZNWPWKD-UHFFFAOYSA-N 388.515 5.159 30 20 GKED Cc1cc(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cc(C)c1OC(F)F 523653740 WSNJOODBGOAHFV-UHFFFAOYSA-N 399.422 5.152 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 524832234 SLXKZMHMVKMJJR-UHFFFAOYSA-N 377.488 5.869 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccccc2Cl)c1 530454539 OMCFTDPXBYXLES-UHFFFAOYSA-N 379.891 5.630 30 20 GKED CSc1cc(Br)ccc1CN[C@@H](CCC#N)c1ccccc1 533037756 CABXTYANNADVMI-KRWDZBQOSA-N 375.335 5.306 30 20 GKED C=C[C@@H](CC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 535499545 KIDFYWYLJVJIRI-GAJHUEQPSA-N 376.887 5.301 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3C)o2)nnc1-c1ccoc1C 536017759 KUKLGEPFZFOIMF-UHFFFAOYSA-N 392.484 5.288 30 20 GKED N#Cc1c(NC(=O)c2cc3ccccc3cc2OC(F)F)sc2c1CCC2 536425639 FSOBCWRBKDWBMM-UHFFFAOYSA-N 384.407 5.115 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)c(C#N)s1 537151714 CGJDCEWQFWTJPO-UHFFFAOYSA-N 386.826 5.842 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](C)c1cccc(C(F)(F)F)c1 539621407 PCZNGPLZNSLSEV-HNNXBMFYSA-N 386.417 5.484 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158044 SVTZEBJQDKUYHK-LJQANCHMSA-N 398.510 5.301 30 20 GKED C=CCC[C@@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccccc1 541464145 OCHZGCPWKWGBRH-JTHBVZDNSA-N 391.559 5.317 30 20 GKED CCO[C@H](C)c1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 543873896 PDEPYWLEUNWSPC-IAGOWNOFSA-N 391.540 5.630 30 20 GKED C[C@@H](Nc1ccc2c(c1)N(CC(F)F)CCS2)c1ccc(C#N)c(F)c1 551572121 PUBGGWNLAIGIAE-GFCCVEGCSA-N 377.435 5.048 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cncc(-c4ccccc4)c3)cc2)ccn1 558558324 TWRMUWXPTWIABJ-UHFFFAOYSA-N 392.418 5.060 30 20 GKED N#Cc1nc(N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)ccc1C(F)(F)F 561308124 LBVLUVMZELLFRJ-GOSISDBHSA-N 397.404 5.094 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cc2ccccc2o1 574371389 ABJWZJJSBMYKDN-HNNXBMFYSA-N 383.407 5.234 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)COc1cccc2ccccc12 576936995 UFMPIJARSYABQX-PKOBYXMFSA-N 392.524 5.086 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)c1 580143203 KBDZKCHFXPJIPM-UHFFFAOYSA-N 381.262 5.713 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2ccccc2SCc2ccco2)cc1 589077516 ADSOZQLBJFUSLN-HXUWFJFHSA-N 376.481 5.129 30 20 GKED CC(C)(C#N)c1ccc(CN2CCC(c3noc4cc(F)ccc34)CC2)cc1 589278810 UXHYIWMOSFFNOE-UHFFFAOYSA-N 377.463 5.148 30 20 GKED Cc1ccc(-c2ncc(C(=O)N[C@@H](CCCC#N)c3ccccc3)s2)c(C)c1 590476053 GCHFHWHETPKAFA-FQEVSTJZSA-N 389.524 5.592 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1ccccc1)c1ccccc1OC 594999353 VQOWPHNJHGOVOG-QFIPXVFZSA-N 392.524 5.244 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCN(c2ccsc2C#N)CC1 596628229 JFUMLGLOGQWQGO-UHFFFAOYSA-N 396.560 5.221 30 20 GKED N#Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)cc1 603940404 BJDNQVZSIQKSAE-FQEVSTJZSA-N 377.806 5.122 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cn1ccc2ccccc21 609061285 YRHXNCBGTVMQGB-UHFFFAOYSA-N 395.462 5.039 30 20 GKED N#CCn1c(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)cc2ccccc21 609161512 IPEWBQRLUBPZJB-UHFFFAOYSA-N 392.418 5.225 30 20 GKED CN(C(=O)c1cccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1)c1ccccc1 609162830 VNTWEMBPGBPNEE-UHFFFAOYSA-N 397.478 5.017 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1 609460846 BRPCNBRFUACNNA-ZBEGNZNMSA-N 397.689 5.104 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 609682753 AWGHHAYWXHJDOW-GHTZIAJQSA-N 397.478 5.760 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NC(=O)N(C)Cc1ccc(C#N)cc1 610027128 TVCCRRZWZQGGEB-HXUWFJFHSA-N 399.922 5.149 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196206 RVCLQCKJBTYDOI-ZDUSSCGKSA-N 393.339 5.517 30 20 GKED C[C@H](NC(=O)CCSc1ccnc2cc(Cl)ccc12)c1cccc(C#N)c1 610577577 VNBGUJDSYVVPOH-AWEZNQCLSA-N 395.915 5.119 30 20 GKED C=CCN(C(=O)c1ccc(COC(C)C)cc1)c1nc(-c2ccccc2)cs1 612756076 FNBXRSKUZDNQRF-UHFFFAOYSA-N 392.524 5.568 30 20 GKED COc1ccc2[nH]c(NC(=O)c3ccccc3Oc3ccccc3C#N)cc2c1 617862737 MDNXCQNIUIWGCX-UHFFFAOYSA-N 383.407 5.093 30 20 GKED C[C@H](CC(=O)NCc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 619763227 XSDWMBXCZGHFRQ-GFCCVEGCSA-N 380.797 5.040 30 20 GKED C=C(C)[C@@H](N[C@@H](CC)c1cc(OC)c(OC)c(OC)c1)c1ccc(F)c(F)c1 652190509 QEKCNIRZTURRED-GHTZIAJQSA-N 391.458 5.349 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)C(=O)Nc1c(C)cccc1C(C)C 674866502 MJYYGAQPHGGLTB-MRXNPFEDSA-N 390.980 5.849 30 20 GKED C=C[C@@H](CC(=O)N(C)CCCc1cc(-c2ccc(F)cc2)no1)c1ccccc1 677533554 RUWZGAGJHVNDFI-SFHVURJKSA-N 392.474 5.232 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1 726847983 QHVHOHHPYNMBQC-UHFFFAOYSA-N 384.545 5.806 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)c1 728536692 XYBHTNZXJGYCQU-UHFFFAOYSA-N 397.503 5.113 30 20 GKED Cn1c(SCc2cc(Cl)ccc2OCC#N)nc2cc(Cl)ccc21 735233444 XEGQNTJJCXELMG-UHFFFAOYSA-N 378.284 5.075 30 20 GKED N#CCOc1ccc(Cl)cc1COc1cccc(C(=O)Nc2ccccc2)c1 735302588 ALIKCXIRLHXIKS-UHFFFAOYSA-N 392.842 5.074 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](Cc2ccccc2)C2CC2)cc1 736955101 FCWTWEKQQUWKHH-DQEYMECFSA-N 395.506 5.485 30 20 GKED CC(=NNc1ccc(Br)cc1Cl)c1c(C)nn(C(C)C)c1C 750937598 LOQNZRUCHHGGRZ-UHFFFAOYSA-N 383.721 5.333 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 752159468 HIHOFLBNAHKCLW-ROUUACIJSA-N 382.385 5.624 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)C2)c1 752485947 UPDSELPAOMHSSH-ZCYQVOJMSA-N 395.506 5.672 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc2ccccc2c1 753395612 OKLMNZVANQPYKG-UZUQRXQVSA-N 392.458 5.444 30 20 GKED Cc1nc2ccc(CNCc3cccc(-c4ccc(C#N)s4)c3)cc2s1 755199879 RFIGDTCVQULCLR-UHFFFAOYSA-N 375.522 5.495 30 20 GKED CCn1c(NC(=O)c2sccc2-c2ccc(F)cc2)nc2cc(C#N)ccc21 764512580 HAADZHJLIADDQC-UHFFFAOYSA-N 390.443 5.048 30 20 GKED Cc1csc(SCc2ccccc2C(=O)Nc2ccc(C#N)cc2Cl)n1 769732026 XPXYTLXHBOTJSO-UHFFFAOYSA-N 399.928 5.521 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)cc1 769791568 YBQJLSRDJQEWSV-KBXCAEBGSA-N 393.284 5.367 30 20 GKED C#CC[C@@H](N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 773117248 USZDIZSOAQCIEZ-SUMWQHHRSA-N 381.369 5.305 30 20 GKED Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(C3(C#N)CC3)cc2)c1 776742770 KAMWAAVBUAFUGJ-UHFFFAOYSA-N 395.462 5.055 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@@H]2NC(=O)C1(C#N)CCCCC1 778263169 OARIHLYOYIAJIG-IBGZPJMESA-N 397.519 5.001 30 20 GKED N#C[C@@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1nccc2ccccc12 792106440 QRMILFNXAQFCAP-OAHLLOKOSA-N 381.262 5.450 30 20 GKED N#C[C@H](C(=O)[C@H](Oc1cc(Cl)cc(Cl)c1)c1ccccc1)c1ccccn1 802040973 VLQKTACKYWFMTQ-GHTZIAJQSA-N 397.261 5.385 30 20 GKED N#C[C@H](C(=O)C1(C(F)F)CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 808980191 WDNDOMMVXDYBMB-CYBMUJFWSA-N 380.847 5.465 30 20 GKED CC(/C=C\C(=O)c1ccc2c(c1)CCC(=O)N2)=C/c1ccccc1OC(F)F 811688952 VVPFRLOOVCAWDA-FWNMTXRZSA-N 383.394 5.015 30 20 GKED Cc1ccccc1[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)C1CCCC1 813862918 YSCFSNYKVROCOC-VWLOTQADSA-N 389.543 5.171 30 20 GKED N#C[C@@H](C(=O)CC[C@@H]1CC1(Cl)Cl)c1nc(-c2ccc(Cl)cc2)cs1 850763258 XMBYBDVGOGYMEK-YPMHNXCESA-N 399.730 5.614 30 20 GKED C[C@@H](c1nc(-c2ccc(Cl)cc2)no1)[S@@](=O)CCCCC1(C#N)CCC1 899394049 CDDOSYGUHIEFOJ-RXBISOJRSA-N 391.924 5.064 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 915087555 VXCPDQAMJUDFQT-NLSFWIRASA-N 384.479 5.630 30 20 GKED Cc1cccc(OCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 915181049 WKJGKOKSQAQLPV-HSZRJFAPSA-N 384.479 5.367 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3cccc(OC)c3OC(F)F)oc12 916129885 AZVIKECGYCEYPT-ZHACJKMWSA-N 388.366 5.338 30 20 GKED COc1cccc2cc(C(=O)/C=C/c3cn(CCC#N)nc3-c3ccccc3)oc12 916130622 YYNSXMPNTYMHCY-VAWYXSNFSA-N 397.434 5.115 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C2CC2)o1 916679607 UENMAYAHTVMIQJ-HSZRJFAPSA-N 385.467 5.440 30 20 GKED COc1c(Cl)cc(Cl)cc1/C=C\C(=O)c1ccc(N2CCCC2=O)cc1 921265734 RCWJNOKSFOJRSV-TWGQIWQCSA-N 390.266 5.025 30 20 GKED C[C@@H]1[C@@H](C)N(CCCCC2(C#N)CCC2)CCN1CCCCC1(C#N)CCC1 931069827 ISCNWWDLSRGUJA-FGZHOGPDSA-N 384.612 5.109 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccccc3C(F)(F)F)cc2)cc1 1776033145 DPWSNQNIOJLXMD-UHFFFAOYSA-N 384.357 5.517 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C/C(=O)c2csc(C(=O)O)c2)cc1Cl 1776353733 XTRZSANIDLRUBG-ONEGZZNKSA-N 385.268 5.436 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(F)c(Br)c1F 1776784086 JKQHVNYABIMMHG-CYBMUJFWSA-N 392.284 5.021 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1cccc(O)c1)C(=O)c1ccccc1 7912923 WXXLRKDIFFGGEE-HAVVHWLPSA-N 399.490 5.422 30 20 GKED CC(C)c1ccc(C(=O)/C(=C(/S)Nc2ccccc2F)[n+]2ccccc2)cc1 11171031 GUEGNCZXGVPEKH-UHFFFAOYSA-O 393.507 5.288 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COC(c2ccccc2)c2ccccc2)cc1 25438534 SSDHLBUSERYIHM-UHFFFAOYSA-N 384.479 5.232 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nc2ccccc2n1C(F)F 41558876 BSOOEHYGLUUJEV-GFCCVEGCSA-N 380.181 5.228 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccccc2-c2ccccc2)o1 54864985 BBRSDVIAEPJJJT-UHFFFAOYSA-N 394.430 5.650 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H](CC)c1ccccc1 64367872 USKZFKCOBNFKJH-LJQANCHMSA-N 383.492 5.426 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccc(F)cc1F)c1nc(-c2ccccc2)cs1 65651799 PLEXXADKBNTKNI-INIZCTEOSA-N 398.434 5.124 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1sc2c(c1C#N)CCCC2 104906660 OMYHUKUOLJKCHM-UHFFFAOYSA-N 397.500 5.322 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCCC[C@H]2c2cc3ccccc3[nH]2)c1=S 108349297 JJRJPHWHUPAQBF-FQEVSTJZSA-N 393.560 5.143 30 20 GKED C[C@H](N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccc(C#N)cc1 123873807 UDIBIVWIGINPEC-NWDGAFQWSA-N 387.270 5.327 30 20 GKED N#Cc1cc(F)ccc1CSc1nnc(-c2ccncc2)n1C1CCCCC1 124479594 PWWSOOBEUVPPSU-UHFFFAOYSA-N 393.491 5.148 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)c1 127458581 ZRDATGWRCOOSGW-NTKDMRAZSA-N 383.495 5.206 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1ccccc1O[C@H](C)C#N 180027831 WJHBXSQEBHEKMV-UKRRQHHQSA-N 386.521 5.091 30 20 GKED C[C@@H](NCc1ccccc1C(C)(C)C#N)c1ccc(OCC(F)(F)F)cc1 180971542 GAKWOZOIWPBMOW-OAHLLOKOSA-N 376.422 5.280 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 189025710 HYAWNBUMUCDTIO-UHFFFAOYSA-N 381.479 5.149 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cccc(NC(C)=O)c1 191455162 DPKSGQOKNVJBFK-INIZCTEOSA-N 379.504 5.380 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1 192861359 JQQPMVNCOLNESL-UHFFFAOYSA-N 399.928 5.233 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(F)c(Br)c1 195656680 SLTZTURJFMTZPF-CYBMUJFWSA-N 377.257 5.444 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@H]1C 246537604 SNWPMYXVFWIXQM-LMMKCTJWSA-N 379.529 5.348 30 20 GKED Cn1ncc2c1CCC[C@@H]2/N=C(/O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 328908256 CUEGCKCNZBPITB-INMHGKMJSA-N 392.528 5.114 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1cccc(C(F)(F)F)c1C 328938872 RTSOQKOVFRCFNX-GFCCVEGCSA-N 384.423 5.309 30 20 GKED CC(C)[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1nc(-c2ccncc2)no1 328985877 GUDVYHZMEYIZFZ-KANFNMMFSA-N 382.508 5.392 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCCO2)N1CC2(CCC2)[C@H]1c1ccccc1 330341296 ZBKSRKUIOKZGAP-HXUWFJFHSA-N 398.890 5.274 30 20 GKED N#C[C@@H]1CC[C@@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)C1 430096142 DKAKOIOQJLOTKV-CXAGYDPISA-N 384.892 5.024 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639423 BJCAURBXDAOHQG-UHFFFAOYSA-N 387.814 5.346 30 20 GKED CC(C)[C@H]1C[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc21 447597076 FCCPOIJHWCJJRF-PKTZIBPZSA-N 387.527 5.566 30 20 GKED C[C@@H]1CCSCCN1C(=O)Nc1ccc(Sc2ccccc2C#N)cc1 455937205 DKYRASPNUFLTCV-OAHLLOKOSA-N 383.542 5.069 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458799689 JSFXBILHVZDDIY-WTNAPCKOSA-N 379.479 5.353 30 20 GKED CN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 459020522 VZIYULCZWYNPEH-FZDIXFNVSA-N 393.453 5.065 30 20 GKED CC(C)=CCOc1cccc(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)c1 461105601 YPDFHWUGEDYFNB-LJQANCHMSA-N 388.389 5.045 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)c1F 464400250 UEXCUFULKOEQPW-UHFFFAOYSA-N 385.666 5.476 30 20 GKED C[C@@H]1CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@@H]1c1ccccc1 464540886 NQGXRVWMJMQUAF-KOSHJBKYSA-N 382.463 5.378 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 473676967 PLCBLJPUNRTGMA-SJORKVTESA-N 399.585 5.549 30 20 GKED C[C@@H](NC(=O)Cc1cnc2ccccc2c1)c1ccc(-c2cccc(C#N)c2)cc1 475815936 KVMAQOGNEMHANU-GOSISDBHSA-N 391.474 5.193 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Br)ccc1NC1CC1)c1ccccc1 476194881 KZRVOTHONFXBNB-HNNXBMFYSA-N 398.304 5.049 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCCC[C@H]2CC(=O)c2ccccc2)cc1 476236918 KYQHTEDVIYBMTG-QFIPXVFZSA-N 388.511 5.146 30 20 GKED C=C(C)[C@@H](NCc1csc(-c2ccc(OC)cc2)n1)c1ccc(F)c(F)c1 479405962 FZADMVAILSLCEN-HXUWFJFHSA-N 386.467 5.504 30 20 GKED N#Cc1c(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)sc2c1CCCC2 482162960 JDWWZJVPPVWCNE-HNNXBMFYSA-N 378.419 5.173 30 20 GKED O=C(C[C@@H](c1ccccc1)C(F)(F)F)N[C@H](c1ccc(F)cc1)C(F)(F)F 482503920 VSOIGAMTTXSJRM-GOEBONIOSA-N 393.302 5.282 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)oc12 488330052 OWIIYVNAJWVPEQ-MRXNPFEDSA-N 392.867 6.008 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Sc2nc(C(F)(F)F)ccc2C#N)c(C)c1 488802443 RETDNXVUWMVFGB-CYBMUJFWSA-N 393.434 5.017 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)Nc3cccc(-c4ccccc4)c3)CC2)cc1 495464947 GKNPDVPQOIHUAC-UHFFFAOYSA-N 397.478 5.301 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)[C@@H]1C[C@H]1c1cccc2ccccc12 503081178 ATWMJUPTSGXUCT-FCHUYYIVSA-N 393.408 5.130 30 20 GKED N#Cc1c(NC(=O)c2cccc(OCc3cccs3)c2)sc2c1CCCC2 512146905 MMSXYWMWWAKUKT-UHFFFAOYSA-N 394.521 5.391 30 20 GKED C=CCOc1ccccc1CNCc1ccccc1-c1ccc(CN(C)C)cc1 518270140 WTDLNJVQVGHIML-UHFFFAOYSA-N 386.539 5.270 30 20 GKED COc1ccc(-c2nc(CS[C@H](C)c3ccc(C#N)cc3)cs2)cc1OC 522839801 KZYDZYYSLZMMHT-CQSZACIVSA-N 396.537 5.693 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccnc(Oc2ccccc2)c1 522872035 OQWGMXPESPYGBH-UHFFFAOYSA-N 384.888 5.417 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NC3(c4cccc(F)c4)CC3)cc2)cc1 524830656 GSYPTLADAPJRJR-UHFFFAOYSA-N 387.414 5.300 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1)c1ccccc1 533950029 PPCMRKSXFDXSJB-QGZVFWFLSA-N 376.475 5.373 30 20 GKED CN(CCc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1)C1CC1 538228710 DHGGODQWPNHFDF-UHFFFAOYSA-N 395.506 5.114 30 20 GKED CCN(C(=O)c1ccc(C2(C#N)CC2)cc1)[C@@H](Cc1ccc(F)cc1)C(C)C 539657609 PZBVLBVIXHLBKI-QFIPXVFZSA-N 378.491 5.110 30 20 GKED Cn1ncc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1-c1ccccc1 540452727 FBZVIWZDKLXPOJ-UHFFFAOYSA-N 394.434 5.003 30 20 GKED N#CCC1CCN(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)CC1 541969626 PIIUGWRUIQCIEL-UHFFFAOYSA-N 385.920 5.649 30 20 GKED CCCn1ncc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C1CC1 543919036 URGAXNCQPUPVRL-QGZVFWFLSA-N 398.510 5.200 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543944545 PBPRAKOKVYFASF-LJQANCHMSA-N 398.510 5.301 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(Br)cc1 544165529 DBCUHNQCKMZBJO-OAHLLOKOSA-N 397.316 5.006 30 20 GKED C[C@@H](NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1ccc(C#N)cc1F 545943968 YHTKRZZWWMKNJI-CRAIPNDOSA-N 391.515 5.277 30 20 GKED C[C@H]1CC(CCNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C[C@H](C)O1 548974215 LNURUHCGCYZPBS-IRXDYDNUSA-N 393.487 5.066 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1nc(C)sc1-c1ccccc1 553447829 GMTSBMVOCIIVTC-UHFFFAOYSA-N 394.544 5.114 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 554790000 JQSQYHYQOFKJIT-OAQYLSRUSA-N 397.503 5.267 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(OCc2ccccc2)c1 564458080 LSYIOSQOKBIBDY-RLWLMLJZSA-N 384.523 6.351 30 20 GKED Cc1sc(NC(=O)c2oc3c(Br)cccc3c2C)c(C#N)c1C 566934609 LXDDRRNTSMAUAO-UHFFFAOYSA-N 389.274 5.306 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)cc2)ccn1 567433809 CDLAAMNDYMGTHL-KBPBESRZSA-N 389.377 5.053 30 20 GKED C[C@@H](N[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccccc1 570415175 VGFBOTPJLBIMHZ-QZTJIDSGSA-N 385.467 5.028 30 20 GKED Cc1cc(C#N)cnc1C(=O)N1CCCCC[C@@H]1c1ccc(C(F)(F)F)cc1 570832853 PVXMHGWQSSZGNQ-GOSISDBHSA-N 387.405 5.038 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1Cl 571964597 CYGXYDXUGROFHY-HNNXBMFYSA-N 395.915 5.646 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Cl)cc2OCC(F)F)cc1 578974331 KZOGLVIDNVCIHJ-UHFFFAOYSA-N 378.806 5.037 30 20 GKED COc1ncc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1Cl 585765048 CXHUCCRXPGRHSZ-HNNXBMFYSA-N 377.875 5.133 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)NCC(C)(C)CCC#N 588177517 JNEVJRWSWWQESM-UHFFFAOYSA-N 395.450 5.197 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)CCCCCC#N 588676486 WPZRTUYWEMOUDT-UHFFFAOYSA-N 381.476 5.823 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1cccc(Br)c1)c1ccccc1 590477536 KFJZLZQJOBFHSV-HXUWFJFHSA-N 399.332 5.323 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H](c1ccc(O)cc1)C1CC1 597180922 WUYYVRVFAPSIIW-KXBFYZLASA-N 380.513 5.166 30 20 GKED C[C@@H](Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1)c1cccc(C#N)c1 600848441 RWZHVGOKDLKJRC-MRXNPFEDSA-N 395.934 5.789 30 20 GKED N#C[C@H](NC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc(F)cc1 603486944 MENUJZXJAHGSAP-LBPRGKRZSA-N 379.243 5.342 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)cn2)cc1 603764809 NCANYQQXZJWNER-GJZGRUSLSA-N 389.377 5.053 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1 603982678 PLCVWAKYXXUQMN-OAQYLSRUSA-N 394.503 5.433 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCCn2cnc3ccccc32)cc1 604331265 WQJDBYFIPXABAJ-UHFFFAOYSA-N 396.450 5.119 30 20 GKED Cc1ccc(C)c(SCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1 609461019 NYHOLIHMBIARKJ-INIZCTEOSA-N 379.312 5.083 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)sc2c1CCCC2 609496348 MPWPQLIUNVOSCK-CABCVRRESA-N 390.430 5.260 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3c3cccs3)cc2)cc1 609497436 UPJHLNPDGJHDJX-OAQYLSRUSA-N 388.492 5.584 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 609773519 IOVXIIPPLAWQFN-MJGOQNOKSA-N 381.501 5.146 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3cccc(-c4cnco4)c3)c2)cc1 609987714 UMRRIQLYJYXQQN-UHFFFAOYSA-N 380.407 5.209 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)Nc3cccc(C#N)c3)cc2c1 610089086 IFZCZQUHLJQOLD-UHFFFAOYSA-N 385.423 5.440 30 20 GKED C[C@@H](NCc1cc(Br)cc(C(F)(F)F)c1)c1cccc(C#N)c1 611146263 FWEYQBRBSVHDAI-LLVKDONJSA-N 383.211 5.190 30 20 GKED N#CCSCc1nc(-c2ccc(Oc3ccc(F)c(Cl)c3)c(F)c2)no1 612957154 YMLYHFYMMCOETO-UHFFFAOYSA-N 393.802 5.217 30 20 GKED CCc1ccncc1NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 616551772 QWLVWMTXAWIEKV-UHFFFAOYSA-N 394.290 5.186 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)ccc1OC 622266299 FBTSZZBTDHZPPH-HNNXBMFYSA-N 379.422 5.520 30 20 GKED COc1ccc(F)cc1NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 666504773 OATVKQSUHYSENG-UHFFFAOYSA-N 390.299 5.009 30 20 GKED CC(C)(C)n1ncc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c1-c1ccccc1 683106032 OYZGWAHWTCKBOP-LJQANCHMSA-N 394.478 5.343 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2cc(F)ccc2s1 685788232 YAYDIXMOHPNXCU-VIFPVBQESA-N 375.837 5.122 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc(-c3ccccc3)cc2)c1 726495515 OKWMCKACHUMXFT-UHFFFAOYSA-N 394.430 5.650 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)c1 726917645 JMOIJBDUSBBTCY-QFIPXVFZSA-N 378.472 5.008 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 727629183 PBCPXNIJFMRTMN-OXQOHEQNSA-N 380.538 5.431 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3sccc3SC(F)F)n2)cc1 730468922 LEILLBTZSYLVCK-UHFFFAOYSA-N 393.465 5.310 30 20 GKED N#C[C@H](NC(=O)Cc1cc(Cl)ccc1Cl)c1cccc(Cl)c1Cl 731196040 VEUSJIHVQJQZSO-AWEZNQCLSA-N 388.081 5.224 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc(F)cc3F)cc2)c1 731319261 QKSODTVQDDSMAO-UHFFFAOYSA-N 381.407 5.438 30 20 GKED C#CC[C@H](OC(=O)c1cc(-c2ccc(OC)cc2)c(C)s1)c1ccccn1 733692421 FEGOZSMPLAGFID-FQEVSTJZSA-N 377.465 5.049 30 20 GKED CC(=NNc1cnnc2ccccc12)c1ccc2c(c1)Nc1ccccc1S2 733748189 KTECPFRWECWCCB-UHFFFAOYSA-N 383.480 5.674 30 20 GKED COc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)c(SC)cc1OC 741165890 SHRKRZXNOYDNOG-PLNGDYQASA-N 389.325 5.690 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cnccc1-c1ccc(C(F)(F)F)cc1 741511205 WTIOICHNXYNCQI-UHFFFAOYSA-N 398.413 5.448 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)s1 742656222 DDHOEVIYKZEPLM-PKYBCLHXSA-N 394.327 5.142 30 20 GKED C=CC[C@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccncc1 745827261 IMNVGEXHLLQWHL-SFHVURJKSA-N 389.421 5.096 30 20 GKED O=C(/C=C\c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(-c2ccncc2)cc1 745989897 FXONTHZECBWHOL-ALCCZGGFSA-N 396.349 5.154 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc3nc(S)oc3c2)cc1 746158165 RWLQQLKLRNPAEV-UHFFFAOYSA-N 387.420 5.033 30 20 GKED COc1cc(Br)c(C=NNc2cccc3ccccc23)cc1OC 747059990 FMCLKSLBLCBSCA-UHFFFAOYSA-N 385.261 5.066 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)O[C@@H](C)c3ccc(C#N)cc3)c(C)c2c1 748679598 LRFPICAPJIJLKX-INIZCTEOSA-N 375.424 5.053 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 751544626 ZAWIHAOZMGXGIB-BTZRARBUSA-N 395.506 5.752 30 20 GKED C[C@@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1F 753763394 PWWOVZWLXZBMHK-SZNDQCEHSA-N 395.478 5.382 30 20 GKED C[C@@H](OC(=O)Cc1ccc(OCC#N)cc1)c1ccc(Cl)c(C(F)(F)F)c1 759592045 VTJOGYOKNFHWCG-GFCCVEGCSA-N 397.780 5.108 30 20 GKED N#Cc1ccc([C@H](O)CSc2nc(-c3cccs3)nc3ccccc23)cc1 763226182 XDAAVVXWKXOCRE-GOSISDBHSA-N 389.505 5.056 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)Cc2cccc(OCC#N)c2)cc1 764281856 JNGXWDQQSIFRLR-QHCPKHFHSA-N 376.500 5.009 30 20 GKED N#C[C@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)C1CCCCC1 776355773 WYHKZNOUIAYYNT-QMMMGPOBSA-N 382.074 5.324 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC[C@H]3c3ccccc3C(F)(F)F)cc2)CC1 777383870 BNSKKPHFEVZHII-IBGZPJMESA-N 384.401 5.238 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC[C@@H]3c3ccccc3C(F)(F)F)cc2)CC1 777383871 BNSKKPHFEVZHII-LJQANCHMSA-N 384.401 5.238 30 20 GKED Cc1ccc(/C=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 779472154 SKDWPFFTMNEBLY-ZAGZISDZSA-N 387.870 5.351 30 20 GKED COc1ccc(-c2cc(NCc3ccccc3C#N)ccc2OC(F)F)cc1 779557168 MGNRBASQXVQBQE-UHFFFAOYSA-N 380.394 5.447 30 20 GKED CC[C@H](CC#N)OC(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 787084717 RFANDIKWSIVGLK-OAHLLOKOSA-N 396.516 5.207 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)c(F)c1)c1nc2cc(Cl)ccc2s1 791106868 DIJZIMGDQZAGOI-NSHDSACASA-N 379.243 5.161 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3cnc4ccccc4c3)c2)s1 791604863 AHEZIZAFQCHXGR-UHFFFAOYSA-N 397.503 5.084 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 797566993 WZRGSDLSCPNWME-WBVHZDCISA-N 384.545 5.516 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CC2(CSc3ccccc3)CC2)s1 797571409 OQJKFTVXTDVVTO-MRXNPFEDSA-N 384.570 5.579 30 20 GKED CCc1ccc(CC(Cc2ccc(Cl)cc2)=NOCc2cccnc2)nc1 807979199 ODPBGBTYGZZPPT-UHFFFAOYSA-N 379.891 5.050 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)nc2)nnc1N1CCc2sccc2[C@@H]1CC 812188000 HZNNUXJQIGITHL-INIZCTEOSA-N 399.951 5.145 30 20 GKED C#C[C@@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccc(F)cc1 812933677 KBGKJHFIZQWRCH-LJQANCHMSA-N 384.501 5.035 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)sc2cccc(F)c12 813210909 BAMZDPOULNKQRZ-NSHDSACASA-N 378.350 5.253 30 20 GKED CC(C)[C@@H](CCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 815913635 XJSIGQAIJZXIDM-MSOLQXFVSA-N 395.453 5.513 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1nc(C2CC2)cs1 842940995 MFUBSHCEMSWRKC-QLFBSQMISA-N 377.296 5.307 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)on2)cc1 915180261 NBMHBSIWWQLJCJ-QFIPXVFZSA-N 393.446 5.558 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccc3ccccc3n2)cc1 915181336 YXUBTUXTVLNWDT-WIJSZAOYSA-N 389.458 5.542 30 20 GKED Cc1nc(NC(=O)c2cc3c4ccccc4n(C)c3s2)sc1SCC#N 916088286 CTGPNSRVWPKHER-UHFFFAOYSA-N 398.538 5.026 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2c(O)nccc12 1297847251 OKNZBDKZZVCJBQ-UHFFFAOYSA-N 397.459 5.216 30 20 GKED N#Cc1ccc(CN(Cc2ccc(Cl)cc2)c2ccc3nc(O)[nH]c3c2)s1 1644835338 NHVFUFVDKUDUCH-UHFFFAOYSA-N 394.887 5.062 30 20 GKED CCc1cccc(C)c1NN=Cc1ccc(OCc2cc(C)c(C(=O)O)o2)cc1 1776056867 VEJNOMYAKAXOHP-UHFFFAOYSA-N 392.455 5.182 30 20 GKED CC(C)COc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776126692 UNFVQRLRPMAQPU-CLFYSBASSA-N 398.455 5.670 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)cc1 1776801727 PGZUQZYERFABJQ-YPKPFQOOSA-N 389.451 5.316 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)ccc1Cl 1777263583 YQEZOICOCMAFOW-RMKNXTFCSA-N 398.867 5.671 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1777372466 CFTUAEZQTLFYMP-SGMWPGOQSA-N 398.458 5.519 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCCc2ccc(Br)s2)cc1 29151138 RSBQBSSCKBBNNS-UHFFFAOYSA-N 391.334 5.273 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1OCc1ccccc1Cl 32615237 PBMAUHVJIGWBCX-UHFFFAOYSA-N 390.870 5.063 30 20 GKED N#C[C@@H](C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)c1ccccn1 41492794 LJBXEYBRLIOHFG-HXUWFJFHSA-N 383.426 5.178 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C(C)(C)C)cc2)=C(/S)NC(C)(C)C)cc1 55014773 KYJYONFFVAVLLM-UHFFFAOYSA-O 397.608 5.161 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2sc(CC)cc2C#N)cc1OCC 59829137 QZOZLEXHXGZOJJ-UHFFFAOYSA-N 392.908 5.275 30 20 GKED CC(C)Oc1ccccc1-c1nc(-c2cn(CCC#N)c3ccccc23)cs1 60511068 CIOHQFKGRBGMGZ-UHFFFAOYSA-N 387.508 6.133 30 20 GKED CC(C)c1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)on1 70859344 BMFOXPZDKKZKLO-UHFFFAOYSA-N 383.395 5.075 30 20 GKED Cc1ccc(C)c(NC2=NC(=O)/C(=C/c3cccc(OCCCC#N)c3)S2)c1 110418816 FSFSSJUPKRRABV-ZHZULCJRSA-N 391.496 5.068 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)c1cccc(O)c1 118821957 ZHNSAOMHDYBHMZ-CVEARBPZSA-N 383.517 5.401 30 20 GKED Cn1ccc2c(C(=O)[C@@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cccc21 119005701 NQHDOHISWGIDIM-CQSZACIVSA-N 393.418 5.070 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 123750435 RLZQOMDQTKXDAW-GJZGRUSLSA-N 399.564 5.224 30 20 GKED Cc1sc([C@H](C)NC(=O)Cc2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 176242743 CSUBFCQARSFSAL-ZDUSSCGKSA-N 395.915 5.064 30 20 GKED Cc1nc(/C=C/c2cc(C#N)cs2)sc1C(=O)/C=C/c1cc(C#N)cs1 176842913 INMMBMDUZCZUOV-ZUVMSYQZSA-N 393.518 5.384 30 20 GKED COc1cc(C(=O)/C=C\c2csc(Br)c2)ccc1OC(F)F 213314714 SIQUSRJAXROCKF-RQOWECAXSA-N 389.217 5.017 30 20 GKED N#CCN(C(=O)CCN1c2ccccc2Sc2ccccc21)c1ccccc1 215739775 ZOGAODGHVAXFAZ-UHFFFAOYSA-N 385.492 5.236 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@@H]3CCC[C@H]3C2)cc1Cl 246394600 KUTIZTNUPIAOJP-ABSDTBQOSA-N 379.891 5.259 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 303302239 MVPUFAWJXSRVRK-UHFFFAOYSA-N 391.471 5.044 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3C3CCCC3)cc2)c1 303310109 FJVVMAIAZOIXSO-JOCHJYFZSA-N 375.472 5.537 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCC[C@@H]1[C@H]1CCCC[C@@H]1O 328851189 WQDCWBVSCXFUJF-VSKRKVRLSA-N 398.547 5.011 30 20 GKED O/C(CC12C[C@@H]3C[C@H](C1)CC(/C(O)=N/[C@@H]1C=CCCC1)(C3)C2)=N\[C@@H]1C=CCCC1 329809209 PYSFIQNGWXUEQE-OTKRSDGRSA-N 396.575 6.094 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3cccc(OC(F)F)c3)cc2)cc1 409882396 KBOJFNHNZMTXKH-UHFFFAOYSA-N 394.377 5.133 30 20 GKED CN(C(=O)c1cscc1C#N)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 410671388 IKXCEZHYOALUQT-DOTOQJQBSA-N 378.419 5.047 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C1CC1)[C@H](C)C(=O)OC(C)(C)C 417043291 OSSVNTLJWYBIED-MRXNPFEDSA-N 386.536 5.265 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1 430100167 NJZMBWZLZYBNAB-APWZRJJASA-N 394.931 5.431 30 20 GKED CC(C)c1ccc(CSc2nnc(S[C@H]3CC[C@H](C#N)C3)s2)cc1 430141058 PUUBLDCSVPHWGV-HOCLYGCPSA-N 375.588 5.738 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)N[C@@H](CCCC#N)c1ccccc1 431947452 ZSRJMPVSEVYCQU-NDXORKPFSA-N 399.922 5.150 30 20 GKED Cc1ccccc1-n1c(SCCCCC(C)(C)C#N)nnc1-c1ccncc1 436119799 DAAVORMNNXYQGD-UHFFFAOYSA-N 391.544 5.450 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1nc2ccc(Oc3ccccc3)cc2s1 437339469 AZRAXLIRGSDJCJ-UHFFFAOYSA-N 375.409 5.114 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 437826544 CHLVLAJVADIBRJ-NRFANRHFSA-N 377.488 5.413 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)N[C@H](CCC#N)c1ccccc1 438860368 QHBCKZRSZZXMSD-AUSIDOKSSA-N 375.516 5.604 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)no2)cc1Cl 440757684 IHIUUPKGILEFRG-KRWDZBQOSA-N 377.831 5.113 30 20 GKED N#Cc1cc(F)ccc1CN[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444740781 XVZMYBBNBRQEAG-INIZCTEOSA-N 390.302 5.499 30 20 GKED C=CC[C@@H]1N(CC(=O)Nc2c(Cl)cccc2C(F)(F)F)CCCC1(C)C 444776737 CXAZNMKEFQQRFQ-HNNXBMFYSA-N 388.861 5.364 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458798205 HPOVWIMASSJQKC-XKCSPQBFSA-N 375.516 5.318 30 20 GKED C[C@H](N[C@@H](C)c1ccc(Cl)c2ccccc12)C(=O)Nc1ccccc1C#N 462354820 WFLJLMYQQGYGRC-GJZGRUSLSA-N 377.875 5.043 30 20 GKED Cc1cccc(NC2CCN(c3c(C#N)cnc4ccc(Cl)cc34)CC2)c1 462868012 XTOSHJIHHSNZJT-UHFFFAOYSA-N 376.891 5.149 30 20 GKED C[C@@H](C(=O)N(C1CC1)[C@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 463384675 MCAARVQIONXJQJ-HUUCEWRRSA-N 386.417 5.433 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCCC[C@@H]3c3ccccc3)ccc21 469001692 NIPLEPKGSVMGGF-DHIUTWEWSA-N 387.527 5.408 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 470183211 BEUOXYBPUZLIDN-LJQANCHMSA-N 383.454 5.522 30 20 GKED Cc1nc(NC(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)sc1SCC#N 471339944 HPSAYAOAQJTFBO-MRVPVSSYSA-N 386.329 5.116 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)NCCCCC#N)c2)cc1 471554769 IZGXYRJPBCTXEI-LJQANCHMSA-N 393.531 5.537 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)cc1)c1ccccc1 472501678 ODRGAKLCEUKLOG-LAUBAEHRSA-N 395.462 5.203 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(F)(F)F)c(F)c1 473584962 ZWTZWPTYXUKRIU-NSHDSACASA-N 382.382 5.349 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 475964011 HNKLNVDRTWCOIV-UHFFFAOYSA-N 393.531 5.624 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 476082559 XVHGLGMVYOPJHZ-UHFFFAOYSA-N 392.377 5.718 30 20 GKED CCCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1cccc(F)c1 476648936 PMGAYRVNVGVLEK-UHFFFAOYSA-N 390.462 5.017 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 477712754 SUJUNSHCJFZROW-INIZCTEOSA-N 387.439 5.242 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1oc2ccccc2c1C 479236940 UMKLALBQNFNFKF-QGZVFWFLSA-N 375.472 5.296 30 20 GKED C=CCSc1ccccc1C(=O)NCc1cc(Oc2ccc(F)cc2)ccn1 485470838 ZFEKMMRQLYCUOU-UHFFFAOYSA-N 394.471 5.221 30 20 GKED C=CCn1c(SCc2coc(-c3cccs3)n2)nnc1-c1ccccc1C 488888922 YXRBQUAABGXRQJ-UHFFFAOYSA-N 394.525 5.448 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](C)c1cccc2ccccc12 492662805 YEFHSNAOKPGXGL-ROUUACIJSA-N 378.541 5.155 30 20 GKED CSc1ccc(N(C)C(=O)c2ccc(OCc3ccccc3C#N)cc2)cc1 496265756 MDMVCLTULHPEHW-UHFFFAOYSA-N 388.492 5.136 30 20 GKED C=CCC[C@@H](NC(=O)N(CC(=C)C)Cc1cnn(C(C)C)c1)c1ccccc1 500179719 GLKPOGCTRYTXTJ-JOCHJYFZSA-N 380.536 5.259 30 20 GKED C=CCN(Cc1ccccc1)[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 502469259 OPBUFAKGENNEHU-CQSZACIVSA-N 396.840 5.374 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCC(=O)c3cccc(F)c3)cc2)c1 502819571 IROAZQOYICRNIN-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1ccccc1SC 504014745 DQRVGTCHXWRHMK-QGZVFWFLSA-N 386.565 5.035 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1 504137607 AJBQYWBNRDBLQI-RBBKRZOGSA-N 398.526 5.027 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)N3CCC(C)(C#N)CC3)cc2)c(C)c1 506287124 WAWANDKPJYZTIZ-UHFFFAOYSA-N 379.529 5.612 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)CC2)c1 506758594 MTCFPLQANDEBFJ-UHFFFAOYSA-N 397.409 5.032 30 20 GKED C[C@H]1CCCC[C@H]1N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509906423 YRLCDLVODRQJFZ-FDDCHVKYSA-N 391.515 5.374 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc2ccccc2n1C(F)F 510182505 CEFMSJZBZUCFSQ-UHFFFAOYSA-N 392.434 5.657 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc4ccccc34)n2)cc1 512488503 JBKCVERUVQSTDW-HXUWFJFHSA-N 384.460 5.462 30 20 GKED CCSCc1ccc(C(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 515701561 PLHJSAQXGNWAQE-UHFFFAOYSA-N 392.446 5.016 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(Cl)cc1)C(C)C 520131607 JBQZSLJEIVYGIJ-NRFANRHFSA-N 381.907 5.307 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cnn1-c1ccccc1 520620898 MWZFLYGZLUEOIE-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3Cc4ccccc4C3)cc2Cl)cc1 520697999 AXKKNBMHIBJGEH-UHFFFAOYSA-N 389.842 5.552 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 524278869 GRYASLAWVROKGI-IBGZPJMESA-N 378.834 5.695 30 20 GKED Cc1cc(F)cc2c(N3CCC(OCC4CCCCC4)CC3)c(C#N)cnc12 525191378 JZABTWQNECSXEX-UHFFFAOYSA-N 381.495 5.120 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)cc2)c2ccc(F)c(F)c2)c1 525689053 DFMUWFIWNYOXEX-QFIPXVFZSA-N 380.463 5.438 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1)c1ccccc1 527215545 KVJLLCIYRIIBHE-RBUKOAKNSA-N 389.524 5.090 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 531456538 GDXOEKMOUNTSAO-IRLDBZIGSA-N 377.488 5.086 30 20 GKED C=C(C)CN1CCC(N[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 532231200 SZGHUORWVOKVLN-MRXNPFEDSA-N 385.533 5.014 30 20 GKED C=CCC[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc(C(F)(F)F)cc1 533528740 JXIFLWIRZCFFOI-FQEVSTJZSA-N 389.465 5.498 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1)OCC 534397046 PZJMDTOUVKBGEU-MRXNPFEDSA-N 394.393 5.203 30 20 GKED C=CCCO[C@@H](C)c1nc(-c2ccc(NC(=O)Nc3ccccc3)cc2)no1 546333087 QVHBYVXQAOUSSY-HNNXBMFYSA-N 378.432 5.034 30 20 GKED CC(C)Oc1ccc(Br)cc1NC(=O)c1cc(C#N)ccc1Cl 560597974 OALCOORTYXNBEB-UHFFFAOYSA-N 393.668 5.014 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)c2ccc(-c3ccc(Br)s3)s2)C1 562753089 RIOYOEWSXIOCQV-QWRGUYRKSA-N 395.347 5.051 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)cc1F 586788645 QBQIBHNVMLXAAO-CYBMUJFWSA-N 375.285 5.240 30 20 GKED N#Cc1ccc(-c2nc(-c3ccc(COCC(F)(F)F)cc3)no2)cc1Cl 589079317 KBQSYHDJZKEBHK-UHFFFAOYSA-N 393.752 5.008 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccccc1S[C@@H](C)CC#N)CCC2 593975166 OCIRULLHAUBIOH-MAUKXSAKSA-N 380.513 5.148 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](CCO)c1cc(Cl)cc(Cl)c1 599669139 WVADLCMJDYBYJL-IBGZPJMESA-N 377.315 5.008 30 20 GKED Cn1cc(Cl)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 609163943 DEJPBIJXEJYMQD-QGZVFWFLSA-N 384.266 5.240 30 20 GKED CN(c1ccccc1)c1ccc(C(=O)Nc2ccccc2SCCC#N)cn1 609378762 NKRFIZXMOLZTMK-UHFFFAOYSA-N 388.496 5.108 30 20 GKED CC(C)C[C@@H]1CCCCCN1C(=O)c1ccc(COc2ccc(C#N)cc2)o1 610121239 PDSCGHXYJLZGGD-IBGZPJMESA-N 380.488 5.161 30 20 GKED C[C@H]1CCc2c(sc3nc([C@@H](C)Sc4ccc(C#N)cc4F)nc(O)c23)C1 610218741 NXLDBXDHXHUGDP-WDEREUQCSA-N 399.516 5.386 30 20 GKED C[C@@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 610224794 RVRFKFITCHLFRF-CQSZACIVSA-N 376.378 5.130 30 20 GKED Cc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1Oc1ccncc1 618885850 SQKXMRVMGSOVHH-UHFFFAOYSA-N 398.249 5.613 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1sccc1OC(F)F 619125920 YQUZWSATUZPKAL-UHFFFAOYSA-N 399.303 5.133 30 20 GKED O=C(Nc1cc(F)cc(F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 664405033 HNYCETNCXHXHDP-UHFFFAOYSA-N 378.263 5.140 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2CCC[C@H](c3ccccc3)CC2)c1=S 727431242 QZCADFJCWTUGDQ-IBGZPJMESA-N 394.544 5.087 30 20 GKED C#CCCOc1ccc(CN[C@@H](c2ccccc2)c2ccc(OCC)cc2)cc1 733324873 HZJULGNTJCKODK-SANMLTNESA-N 385.507 5.367 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1nc2ccccc2s1 734175851 VPKYMHACEKBBAS-INIZCTEOSA-N 392.528 5.097 30 20 GKED C=CC[C@H](NCc1ccc(-c2ccccc2Br)s1)c1ccncc1 734510470 VVIRLMLXNQSTMT-IBGZPJMESA-N 399.357 5.980 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(Oc2ccc(C(C)C)cc2)CC1)c1ccncc1 734679289 LIMYBIWQYKHSMF-HSZRJFAPSA-N 393.531 5.075 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 734711366 VOKDUVYPHRHILN-GOEBONIOSA-N 394.446 5.385 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](Cc1ccccc1)c1ccccc1F)c1ccncc1 741088673 AHQGTMFYABAETJ-DHIUTWEWSA-N 389.474 5.121 30 20 GKED COc1cc(C=NOCc2csc(C3CCCCC3)n2)cc(Cl)c1OC 744179844 IUYNPNLAQGDWFS-UHFFFAOYSA-N 394.924 5.412 30 20 GKED N#CCOc1ccccc1C(=O)N(C1CC1)[C@@H]1CCCC[C@@H]1C1CCCCC1 744374028 JFIJTHVBIVJTBO-IFMALSPDSA-N 380.532 5.333 30 20 GKED CC(=NOCc1csc(C2CCCC2)n1)c1nc2ccccc2n1C(F)F 746353335 YHLQXXUXESMJNY-UHFFFAOYSA-N 390.459 5.486 30 20 GKED C=CCOc1cccc(NC(=O)NCc2ccc(-c3csc(C)n3)cc2)c1 749209989 AMBAMWFWHBLGTD-UHFFFAOYSA-N 379.485 5.005 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2nc3ccccc3cc2C#N)cn1 750017235 BOFSAAFOQTWVQD-UHFFFAOYSA-N 396.450 5.305 30 20 GKED C[C@@H]1CCC[C@H](CC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 750668188 PAQPEZMXKVHYFX-MBNYWOFBSA-N 380.435 5.708 30 20 GKED CCN(CC)[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 755610379 NJOZSAUIGMMJLA-APWZRJJASA-N 397.931 5.209 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 755754901 BXDUYNBOHIRGPU-PUZWTLIVSA-N 396.494 5.352 30 20 GKED CCC(=O)c1cc(C(=O)N(Cc2ccccc2)c2ccccc2C#N)ccc1F 757932273 XDUHIGQXTPPOSJ-UHFFFAOYSA-N 386.426 5.137 30 20 GKED N#CCCCn1cc(C(=O)OCc2cnc(-c3cccs3)o2)c2ccccc21 774119660 PQBGPPMKTZLEIJ-UHFFFAOYSA-N 391.452 5.019 30 20 GKED C[C@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccc(OCC#N)cc1 775562739 JTCXQGOBIVVBOW-HNNXBMFYSA-N 389.480 5.309 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=S)Nc1ccccc1Oc1ccccc1 779726018 HMVZYECJCFUHKZ-MRXNPFEDSA-N 389.480 5.579 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 780668672 DTIJXSYJAXZZRX-QVKFZJNVSA-N 381.451 5.170 30 20 GKED C[C@H](OC(=O)CC(C)(C)C#N)c1nc2cc(Cl)ccc2n1Cc1ccccc1 785091258 SRHCIWDZTTXYMW-HNNXBMFYSA-N 395.890 5.282 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCCc3c(O)cccc32)cc1 789739176 SRKLVNPOLMWEPX-PKTZIBPZSA-N 382.463 5.106 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)[C@@H]3CC[C@H](C(F)(F)F)C3)cc2)cc1 797097645 ACMAEKIVEVXJEK-CABCVRRESA-N 375.346 5.235 30 20 GKED N#CC1CCC(CNCc2sc(Sc3ccccc3)nc2Cl)CC1 799344249 VEHAGYZSMFWHKE-UHFFFAOYSA-N 377.966 5.367 30 20 GKED C[C@@H]1CCCN(c2ccc(CNCc3ccc(O[C@H](C)C#N)cc3)cc2Cl)C1 800277769 ZGUSXNFTCVBNGL-QZTJIDSGSA-N 397.950 5.157 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 800578115 MJKAKDXOLABMCD-JOCHJYFZSA-N 398.934 5.436 30 20 GKED C=CC[C@H](OC(=O)Cc1ccc([S@@](C)=O)cc1)c1ccc(Cl)c(Cl)c1 805947401 NGVLZQAQCKBHPX-AVRWGWEMSA-N 397.323 5.134 30 20 GKED N#Cc1csc(CNc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)n1 811488235 PPOHCZYQQJOXLO-UHFFFAOYSA-N 389.402 5.225 30 20 GKED CON(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 812933940 NVKYXLYPFNZXSW-AWEZNQCLSA-N 389.908 5.187 30 20 GKED CC(=NNc1ccc(C(F)(F)F)nn1)c1ccc2ccccc2c1OC(F)F 814887567 KQAOBQDJZJRGIP-UHFFFAOYSA-N 396.319 5.086 30 20 GKED C=C(C)COc1cc(CNc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)ccc1OC 815166137 ZHSOLEUCHQQCFZ-HTAPYJJXSA-N 394.515 5.024 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)C1 821470514 VVBFMSUIECGWJU-IAGOWNOFSA-N 387.524 5.092 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)[C@H](C)[C@H](C)CC2 839390997 PGBWEQLNXYAXSK-GHMZBOCLSA-N 390.940 5.068 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)nc1Cl 856777487 CEXADLYPWXDYIV-LBPRGKRZSA-N 381.829 5.406 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1c1cnc(CC)nc1C2 879352579 WNULXGZIZCWJFX-UWJYYQICSA-N 390.531 5.185 30 20 GKED Cc1nc(C2CCC2)sc1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 888870492 WJUVVTREYBINIU-ZDUSSCGKSA-N 385.558 5.295 30 20 GKED C=CC[C@@H](c1ccccc1)c1nc(C2(NC(=O)OC(C)(C)C)CCCC2)no1 904419804 PTSRKPBEKCHKPJ-KRWDZBQOSA-N 383.492 5.072 30 20 GKED COC1(c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCCC1 904835239 UXOINDLPSGLWFM-UHFFFAOYSA-N 395.846 5.470 30 20 GKED CCOc1cccc(/C=N\[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)c1O 915271333 UGQMMZPOBDQSCC-GGMUZDTOSA-N 388.467 5.223 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1OC(F)(F)F)c1ccc2ccccc2n1 916849618 YHPAMQAFDAQTHS-UILAEWCASA-N 382.341 5.023 30 20 GKED COc1ccc2oc(C)c(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 917046895 VNWUJPMEJHRXRJ-CQSZACIVSA-N 396.855 5.503 30 20 GKED O=C(O)c1ccc(-c2ccc(C=Nn3c4ccccc4c4ccccc43)s2)cc1 1776113091 WYCUGHNUMCBURP-UHFFFAOYSA-N 396.471 6.103 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(C(=O)O)c(O)c2)c2c(c1)C(C)(C)CC2 1776269268 YMWVIEVPBNPGAO-CLFYSBASSA-N 392.495 5.508 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1OC 1776801306 KEUQZCRECUBKOK-CLFYSBASSA-N 382.456 5.085 30 20 GKED N#C[C@H](C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1ccc2ccccc2n1 48857351 QTZCLAJCNBHTIX-NRFANRHFSA-N 397.478 5.244 30 20 GKED CC(C)Cc1ccc(C(=O)/C(=C(\S)Nc2ccccc2)[n+]2ccccc2)cc1 55011877 QAGSXXMQOMJNOT-UHFFFAOYSA-O 389.544 5.224 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66800429 BGWPNRRPVCKXSJ-CYBMUJFWSA-N 389.318 5.404 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)[C@@H](C#N)c3nc(C)cs3)oc2c1 68335900 NTROBOTXGODUOX-QGZVFWFLSA-N 388.448 5.363 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)cc1 105011433 ILSYRWHNANFQGW-UHFFFAOYSA-N 379.419 5.327 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 106594436 YZJONDGMJCUVQO-UHFFFAOYSA-N 376.409 5.202 30 20 GKED C=CC1CCN(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)CC1 111726850 UPTHSAGMYSZBIT-UHFFFAOYSA-N 378.476 5.069 30 20 GKED Cc1ccc(NC(=O)CS[C@H](C)c2ccc(C#N)cc2)c(Br)c1 118445283 DXXLNOSNKFVNJM-CYBMUJFWSA-N 389.318 5.062 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(COc2ccc(Cl)cc2)o1 128061873 LWWIYBWVFSDKQP-UHFFFAOYSA-N 399.903 5.395 30 20 GKED C=CCC(CC=C)C(=O)Nc1cc(C(=O)N(C)c2ccccc2)ccc1Cl 150791335 IWZZVFPZWADAPA-UHFFFAOYSA-N 382.891 5.324 30 20 GKED CC(C)Sc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 171530060 BAJYNMQZMANBPT-CQSZACIVSA-N 385.439 5.422 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccncc2Cl)cc1Cl 174227699 PPOSRTZVALTDMN-KRWDZBQOSA-N 382.250 5.296 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)cc1 174649406 DHCODQFQPHYRSV-DLBZAZTESA-N 395.503 5.175 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nn(-c2ccccc2)c2c1CCC2 180589059 MRLDWSRILVADEY-QGZVFWFLSA-N 388.540 5.225 30 20 GKED CCCc1ccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)c2cccs2)cc1 236966988 AVCADWHFUVNHPH-KOSHJBKYSA-N 390.552 5.871 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](COc2ccccc2F)c2ccccc2)cc1 237603674 YCGDNIFZCCFUIX-JPYJTQIMSA-N 390.458 5.026 30 20 GKED N#Cc1c(NC(=O)c2ccc(Br)cc2F)sc2c1CCCCC2 320588125 BWYMJBSLIKBANH-UHFFFAOYSA-N 393.281 5.043 30 20 GKED O=C1CC[C@@H](C(O)=Nc2sc3c(c2C(=O)C2CC2)CCC3)c2ccccc21 328855548 CRTMLAVLTKZFHE-OAHLLOKOSA-N 379.481 5.178 30 20 GKED CSc1cccc(N=C(O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1C 329342932 PUNXFRYYKHBHAR-GOSISDBHSA-N 384.549 5.241 30 20 GKED COC1(C/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)CCC(C)CC1 330061170 NWWCESMOOCNEHP-ZUZNIGHFSA-N 387.568 5.045 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCC1CCC(F)(F)CC1 419598128 BXKMRBXEBMTRHC-AWEZNQCLSA-N 398.544 5.436 30 20 GKED Cc1cc(C)c(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)c(Br)c1 425647806 AKIBOUOXGUTTET-CQSZACIVSA-N 386.293 5.163 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](c1ccc(F)c(Cl)c1)C1CC1 425769746 PBDWJUUOESFUEY-RBZFPXEDSA-N 385.870 5.204 30 20 GKED Cc1nc(CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)c(C)s1 429538830 UERLYZZQIGTJCE-UHFFFAOYSA-N 395.915 5.061 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2occc2COc2ccccc2)s1 430599574 WFOPZDDZUYOFPZ-MRXNPFEDSA-N 380.469 5.103 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(C)C 432838739 GVVNLCTUQDJLAM-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C[C@H](SCc1ncc(-c2ccccc2Br)o1)c1ccc(C#N)cc1 437278870 VKUFONZKEQXYMK-ZDUSSCGKSA-N 399.313 5.970 30 20 GKED N#CCCCn1cc(C(=O)Nc2ncc(-c3ccccc3)s2)c2ccccc21 444035610 XEJIDMQYZYNRJU-UHFFFAOYSA-N 386.480 5.321 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccc(Cl)c1 460174132 NUROWYPPEIPRAF-INIZCTEOSA-N 390.870 5.533 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Br)c(F)c1 460389558 SYHGLNNHHRPSAH-UHFFFAOYSA-N 395.231 5.379 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1-c1ccccc1 464416042 DZKKVBVYVLLOLI-INIZCTEOSA-N 398.388 5.035 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cccc(NCC(C)(C)C)c2C)cc1 465394072 DUMQUBFORRQPAF-UHFFFAOYSA-N 394.519 5.013 30 20 GKED COc1ccc(C#N)cc1N[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471384365 YKQJMSUUYZPQBD-SNVBAGLBSA-N 389.242 5.097 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1cccc(Br)c1)CC1CC1 474483439 WPZBFQPOAIGELJ-UHFFFAOYSA-N 398.304 5.073 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 476165431 UCTUQYKUEONNTG-OXJNMPFZSA-N 382.529 5.019 30 20 GKED COc1ccc(-c2nnc(SCCCC(C)(C)C#N)n2Cc2ccco2)cc1 476480656 JVXNFWFZVUOEHB-UHFFFAOYSA-N 396.516 5.017 30 20 GKED Cc1c([C@H](C)NCc2cccc(C#N)c2)cnn1-c1ccc(Cl)cc1Cl 480805364 YNBMNDMDEAIAIV-ZDUSSCGKSA-N 385.298 5.210 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccc(F)c(F)c1 480911127 SLXCCDDYBRMNAZ-INIZCTEOSA-N 392.356 5.218 30 20 GKED C=C(C)[C@H](NCc1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)c(F)c1 481608024 VHCZWEYSOIKRGF-SFHVURJKSA-N 375.806 5.075 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3c(Cl)ccc4c3CCO4)c2)cc1 484599848 CKZUOMRBAJKGRH-UHFFFAOYSA-N 390.826 5.191 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 485474921 LHCKNXCDFRRNDZ-UHFFFAOYSA-N 382.529 5.510 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(NC(=O)C(C)(C)C)ccc1C)c1ccccc1 488885818 FPXSWJQDSLJSLA-FQEVSTJZSA-N 378.516 5.668 30 20 GKED C=C(C)CN(C)C(=O)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 498660954 IJDSLTIDBJWEAN-LJQANCHMSA-N 392.421 5.021 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccccc2c1Cl)c1c(Cl)cccc1Cl 499846052 IDBUINCYGLTNRI-CYBMUJFWSA-N 378.646 5.123 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1 503356639 GVEQQNADDROYGV-UHFFFAOYSA-N 394.450 5.219 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C(C)(C)c2ccccc2)cc1 508459770 VYSGLROIITUYIT-UHFFFAOYSA-N 386.451 5.275 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1Oc1ccccc1 510343403 SSDIGWIRZVCRDV-GOSISDBHSA-N 385.467 5.253 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)cc1 514431858 POKBMHJBRKXRIZ-UHFFFAOYSA-N 399.475 5.238 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1C(C)C 517455433 IDKNCYUZXZVDSM-WMZOPIPTSA-N 396.556 5.776 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 520535854 YUUWKHCRPKRLBI-UHFFFAOYSA-N 386.451 5.528 30 20 GKED COc1c(Cl)cccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520705242 PPLXFEQHTZUBJI-UHFFFAOYSA-N 396.805 5.404 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1ccc(Cl)c2ccccc12 520805829 ZXLOCISFNXCUEP-UHFFFAOYSA-N 396.899 5.516 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)C1CCCC1 520825964 XBDZUNCKSBGIIE-HSZRJFAPSA-N 375.516 5.411 30 20 GKED C=CCn1c(S[C@@H](CC)C(=O)c2ccccc2)nnc1-c1cccc(C)c1 523111856 XLROXWZGYUWPLV-IBGZPJMESA-N 377.513 5.193 30 20 GKED CC(C)(C(=O)Nc1sc2c(c1C#N)CCCCCC2)c1ccc([N+](=O)[O-])cc1 523509027 CKUXYWYJSPCSDM-UHFFFAOYSA-N 397.500 5.103 30 20 GKED CCn1c(SCCC(C)(C)C#N)nc2scc(-c3cccs3)c2c1=O 525703780 VFRQIXVTSSJXOX-UHFFFAOYSA-N 389.571 5.238 30 20 GKED N#Cc1c(NC(=O)c2ccccc2CCC(F)(F)F)sc2c1CCCC2 535414160 ZLYDHMMFVCREJO-UHFFFAOYSA-N 378.419 5.246 30 20 GKED N#Cc1cccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1F 538322970 IBLBQOSIJBXRTE-OAHLLOKOSA-N 376.275 5.109 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](C)c1ccc(C#N)c(F)c1 538508574 TVLAUEIMRMHCKL-OLZOCXBDSA-N 383.467 5.680 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](C)c1cccc(C#N)c1 540594404 UAQVFPDYPIWYOU-UONOGXRCSA-N 381.932 6.055 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 541254188 WVPSXNNCUZUYGO-ZDUSSCGKSA-N 392.324 5.014 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(Br)c(Cl)c1Cl 543489891 JUGVJENZWLBXEQ-UHFFFAOYSA-N 395.124 5.457 30 20 GKED CC(C)N(Cc1ccc(NCc2ccc(C#N)cc2F)cc1)C[C@H]1CCCCO1 544926694 HZMSQZMBIDGSMR-HSZRJFAPSA-N 395.522 5.089 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cc(Cc3ccccn3)ccc2C)CCCC1(C)C 549065328 RIHTZSXIDZRWQA-JOCHJYFZSA-N 377.532 5.579 30 20 GKED CC(C)CN(Cc1nnc(-c2ccc(C#N)cc2)o1)[C@H](C)c1ccccc1Cl 551421689 KJELZCDJSKXFGM-MRXNPFEDSA-N 394.906 5.481 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 552923354 GRLVOMUYPIJMKB-UHFFFAOYSA-N 392.311 5.889 30 20 GKED CC(C)c1c(NC(=O)c2ccc(C#N)c(Cl)c2)cnn1-c1ccc(Cl)cc1 558806154 BWZKNSJGLJHYGH-UHFFFAOYSA-N 399.281 5.426 30 20 GKED N#Cc1cc(C(=O)N2CCC(c3c(Cl)cccc3Cl)CC2)ccc1F 561885846 JNWBFUHVIBOTAG-UHFFFAOYSA-N 377.246 5.024 30 20 GKED CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1cccc(C#N)n1 589755394 BDTMZIZWLBRCPA-JOCHJYFZSA-N 391.421 5.025 30 20 GKED C[C@H](c1ccc(CNC2(c3cccc(C#N)c3)CCOCC2)cc1)C(F)(F)F 595769327 PETNMAFHTDJJSX-MRXNPFEDSA-N 388.433 5.020 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@H]1CCc2ccccc21 596735344 YDBKRJLVIUMDKJ-SJLPKXTDSA-N 379.529 5.132 30 20 GKED N#Cc1csc([C@H]2Nc3ccccc3C(=O)N2c2cccc(C(F)(F)F)c2)c1 602761706 SUOMSSSQDJVFJD-SFHVURJKSA-N 399.397 5.410 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc(COc2ccccc2C#N)o1 603872013 MOQFUZPEYUDIPZ-HNNXBMFYSA-N 394.858 5.217 30 20 GKED C[C@@H](C(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 607793546 UQEUFFDXTYNZSI-SNVBAGLBSA-N 393.302 5.283 30 20 GKED N#CCn1c(C(=O)N(Cc2ccccc2Cl)C2CCCC2)cc2ccccc21 609175562 LMBLUJNSNCSMSV-UHFFFAOYSA-N 391.902 5.403 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1ccc(F)cc1 609371383 IRUSJSSJEOCPFP-LSDHHAIUSA-N 388.533 5.653 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 609822945 YAJCUVRFDRALRV-AWEZNQCLSA-N 381.932 5.762 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(C#N)c1 610829960 UFKYXSXWQNOEKS-HUUCEWRRSA-N 377.469 5.607 30 20 GKED N#CCn1c(C(=O)Nc2ccc(SCc3ccccc3)cn2)cc2ccccc21 611087116 YQZQSNOKURZHMG-UHFFFAOYSA-N 398.491 5.104 30 20 GKED Cc1cc(Br)ccc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 611092947 VYTHKOYKTNXTBO-UHFFFAOYSA-N 384.060 5.188 30 20 GKED Cc1c([C@H](C)N[C@@H]2CCc3cc(C#N)ccc32)cnn1-c1cccc(Cl)c1 618803281 HRZNRWFIRPSTFS-RCDICMHDSA-N 376.891 5.044 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@H](C#N)CC(C)C 619530204 KPNJVCKPXAOVCT-LBPRGKRZSA-N 394.302 5.269 30 20 GKED O=C(Nc1cccc(F)c1F)NC(CCC(F)(F)F)CCC(F)(F)F 665885625 MEWNFRTXMWBJHC-UHFFFAOYSA-N 378.263 5.140 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c(-c2ccccc2)s1 680450577 GFNQFHSPUAIIKZ-AWEZNQCLSA-N 393.468 5.357 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 682089729 CIJUNKCIVALEQF-WDEREUQCSA-N 397.334 5.066 30 20 GKED O=C(Cc1cccc(C(F)F)c1)Nc1ccc(C(F)(F)C(F)(F)F)cc1 684124626 OLSZEVFKVILTCZ-UHFFFAOYSA-N 379.275 5.460 30 20 GKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 728764471 AVYJPTHPEMDDEO-IAGOWNOFSA-N 382.916 5.956 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc2ccccc2n1CC#N 729358136 GQKMYDGPVNXNSR-UHFFFAOYSA-N 377.513 5.616 30 20 GKED C#CCOc1cccc(NC(=O)N(CC)[C@H](C)c2cccc(C(F)(F)F)c2)c1 731110896 ITQGURBAHQXNKV-OAHLLOKOSA-N 390.405 5.332 30 20 GKED Cc1ccc(Oc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2)nc1 733213060 QRBYTSXNUKEOQO-UHFFFAOYSA-N 394.887 5.516 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1nc2ccccc2s1 734209700 FEQJWWVOIRFSBG-KGLIPLIRSA-N 396.541 5.431 30 20 GKED Cc1cccc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 734644575 RXTPSRRURBNXDG-CYFREDJKSA-N 383.495 5.842 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CSc3ccccc32)cc1 735568005 ZZGAJUSFOBEALC-SFTDATJTSA-N 385.492 5.311 30 20 GKED Cc1cn2c(/C=C\C(=O)c3ccc(SCC(F)F)cc3)c(C)nc2s1 741841273 FGQJOUUZAYHGLY-FPLPWBNLSA-N 378.469 5.266 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(SC(F)F)cc1 743056205 QZRAQHYLFZNLQV-KMKOMSMNSA-N 384.407 5.480 30 20 GKED Cc1ccc(NC(=S)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)cc1 745724135 KNEPVPRPFGBMPP-UHFFFAOYSA-N 389.499 5.718 30 20 GKED Cc1ccccc1NC(=S)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 745724517 SFTWUKJYFBIFCE-UHFFFAOYSA-N 389.499 5.718 30 20 GKED C=CCN(C(=O)c1ncccn1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 748792104 NSPQNVZTIWYHKT-UHFFFAOYSA-N 398.491 5.100 30 20 GKED Cc1ccc(OCCCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 750691987 VGXLNHRZQSAOBO-XMMPIXPASA-N 399.494 5.241 30 20 GKED CC(C)CN(CCC#N)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 751374623 ORJNANVOVQYWFD-UHFFFAOYSA-N 375.447 5.053 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc2nc(C3CCCCC3)[nH]c2c1 755438734 MVBYCGDPODJREO-UHFFFAOYSA-N 390.512 5.479 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2cc3ccccc3s2)cc1 758372014 OCCUXMHHSYKSPY-UHFFFAOYSA-N 384.917 5.321 30 20 GKED O=C1/C(=C\c2ccc(-c3ccc(Br)cc3)o2)CCc2nc(O)ccc21 769611165 WNNKVBRWKIHKPW-QBFSEMIESA-N 396.240 5.022 30 20 GKED CCC[C@@]1(COC)CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 772230021 KTSQBLOGGXUWFA-VWNXMTODSA-N 391.515 5.155 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2oc3ccc(OC)cc3c2C)c1 772982273 BKOVKGSLAAAZAY-AEFFLSMTSA-N 378.472 5.282 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(OCC(F)(F)F)cc2)c1 772982691 FITXWYLQKDYAKK-MAUKXSAKSA-N 392.421 5.159 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2sc(-c3cccnc3)nc2C)c1 772984258 PGERKHFJEPNLKO-BEFAXECRSA-N 392.528 5.045 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)[C@H](C)c2ccc(Cl)s2)cc1 774570835 INTPGWWHZUBYMQ-CYBMUJFWSA-N 377.893 5.153 30 20 GKED CC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cc(F)cc(Br)c1 776808829 LDTYEDRGLLIXRM-YJYMSZOUSA-N 391.284 5.120 30 20 GKED Cn1c(-c2ccccc2)c(C=NNc2ccc3c(=O)[nH]ccc3c2)c2ccccc21 789059428 BYZTUCWBCPOPJQ-UHFFFAOYSA-N 392.462 5.133 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1N(C(=O)OC(C)(C)C)CC1(C)C 793948357 KAISRNCJAGEKFW-IBGZPJMESA-N 386.536 5.123 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1)c1ccc2ccccc2n1 796627465 AYDYRUNGPOXFCA-KSZLIROESA-N 396.368 5.113 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 797942752 IFFOMMGRAWANPY-SMDDNHRTSA-N 380.847 5.465 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 800828583 HHYSPIDCJYJHBU-UHFFFAOYSA-N 396.878 5.530 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2c(Cl)cc(Cl)cc2N(C)C)c1 810145345 ZSHDXSWNSINDHY-MRXNPFEDSA-N 392.330 5.030 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)sc21 813218482 WHFIPGOETIKHRN-CQSZACIVSA-N 399.397 5.297 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c(C#N)c2[C@@H]1C 839390772 KLFJSANOIJUXTD-VHSXEESVSA-N 389.864 5.119 30 20 GKED COC(=O)c1cccc(NN=C(CCC(F)(F)F)CCC(F)(F)F)c1F 853355450 DHRAKOPAHHPDOZ-UHFFFAOYSA-N 388.283 5.065 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921132360 QATCJXRJTVUXKT-ACJLOTCBSA-N 398.890 5.658 30 20 GKED O=C(O)c1ccc2[nH]cc(C=NNc3c(Cl)cc(Cl)cc3Cl)c2c1 1776014297 BRJNMJBXPCMTMM-UHFFFAOYSA-N 382.634 5.272 30 20 GKED C[C@H]1C(=NNc2c(Cl)cccc2Br)CC[C@@H](C(=O)O)C1(C)C 1776083402 DCIREVMGTVXZJE-UWVGGRQHSA-N 387.705 5.027 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2c(F)ccc3sc(C(=O)O)cc23)cc1 1776105885 IFDVHUPRLRXIKB-ZDUSSCGKSA-N 384.476 5.547 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2cccc(C(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269212 HNYSTOGCGQTJCI-MDZDMXLPSA-N 376.496 5.802 30 20 GKED CC(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776370480 NBTUPSKFQZNECV-ZRDIBKRKSA-N 376.477 6.133 30 20 GKED C[C@@H]1/C(=C\c2cc(C(=O)O)c(Cl)s2)C(=O)c2cccc(Br)c21 1776586650 JTICKSAYNNFUFQ-SYNIEDPSSA-N 397.677 5.246 30 20 GKED C=CC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)CCCCC)CC1 1831376304 LTUFVWTYTURMFF-TUNNFDKTSA-N 390.612 5.035 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1Oc1ccccc1Cl 29780392 PQEAFNDTOPUJLD-OAHLLOKOSA-N 392.842 5.410 30 20 GKED Cc1ccsc1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161803 JIUNPCWCHRYNNQ-UHFFFAOYSA-N 391.496 5.023 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1cccnc1 56750760 BFOPOAGBEDGYKY-CQSZACIVSA-N 392.846 5.282 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3cccc(OC)c3o2)cc1OCCCC#N 64367409 MPJDSDFNDKFOQB-CSKARUKUSA-N 391.423 5.029 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1)C1CC1 108237289 XJROOURGTCICCC-KRWDZBQOSA-N 393.556 5.175 30 20 GKED Cc1cc(-n2c(C)cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2C)no1 108998762 ZGLHAMSAQRZGIV-HNNXBMFYSA-N 394.500 5.037 30 20 GKED CCc1nc([C@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)cs1 111407068 JEXDHYZXCZCNJN-INIZCTEOSA-N 377.513 5.007 30 20 GKED N#C[C@@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccc(Cl)cc1 113178569 ZISWBVDVKKSJSA-QGZVFWFLSA-N 388.945 5.203 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1Br 119738220 UHXIYVBOLSTSEN-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H]2CCC[C@H]21 120346429 NFDUXUBKYYGBMA-NFBKMPQASA-N 389.499 5.242 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccncc1 133491963 AJFTUUKCIUKEJV-INIZCTEOSA-N 392.528 5.013 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 174002899 SSRLIKLRXAAQAC-KWCYVHTRSA-N 388.826 5.208 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1nccs1 174493996 ADHNAAIOPYIRMU-INIZCTEOSA-N 396.447 5.219 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)c1 177048965 GYVNZQALVOOIKB-UHFFFAOYSA-N 379.441 5.288 30 20 GKED CC(C)n1ncc2ccc(NCc3cn(CCC#N)nc3-c3ccccc3)cc21 178207241 POJIEBMQBYCUEW-UHFFFAOYSA-N 384.487 5.006 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@H](CCC#N)c1ccccc1 181572982 RICCHVZFAUWVPF-MAUKXSAKSA-N 389.421 5.057 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(OC)c(NC(C)=O)c1 191513468 YRNXJCADYKLBDC-UHFFFAOYSA-N 381.476 5.150 30 20 GKED CCOc1cc(CN[C@@H](C)c2cccc(C#N)c2)ccc1OCc1ccccc1 236993029 VTEPVBCGFXUVIG-IBGZPJMESA-N 386.495 5.387 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C1(C)C 276366045 MIYSODJGGOISQH-SWLSCSKDSA-N 385.455 5.276 30 20 GKED CCS[C@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 303431790 DXDYFXKLFYABOP-NRFANRHFSA-N 395.528 5.490 30 20 GKED O/C(=N/C1CCN(/C(O)=N\[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)CC1)C1CCCCC1 328879810 VKTRCJCBOKTHCI-FBBABVLZSA-N 389.584 5.261 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)c3sc(C(C)(C)C)nc3C)n2)s1 329173366 AMZTWVLUIBSRJO-UHFFFAOYSA-N 392.575 5.582 30 20 GKED C[C@@H](/N=C(/O)Nc1ccc2c(c1)CC(C)(C)O2)c1ccc2c(c1)CCC(O)=N2 329967262 VLRIMVCYQYIYNI-CYBMUJFWSA-N 379.460 5.021 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@@H]3C)c1C1CC1 410973284 IANQFJYSZINIRI-STQMWFEESA-N 382.533 5.213 30 20 GKED CCC(=O)Nc1cccc(-c2noc(-c3sc4ccc(C#N)cc4c3C)n2)c1 426398908 ZRMNCCAGVKJQQS-UHFFFAOYSA-N 388.452 5.147 30 20 GKED N#CCC1(CNC(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1 431176781 DHYDUPDVLFRFIW-UHFFFAOYSA-N 377.246 5.223 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)o1 431395542 DQTTTYFPSAKXCH-UHFFFAOYSA-N 381.819 5.115 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C 432759206 IJCMXHWYUVJCAW-NRFANRHFSA-N 392.503 5.290 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1C#N 435564020 OANJNOJSQDVDIM-QGZVFWFLSA-N 391.393 5.161 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(-c2nccs2)cc1 437563364 XEWGIBOQHBUGTR-PMACEKPBSA-N 388.496 5.114 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438664081 KONSBUZLOPGCOE-CQSZACIVSA-N 395.459 5.776 30 20 GKED Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)CC(C)(C)C#N)sc2c1 447197770 BOLCQETXLVKWCP-UHFFFAOYSA-N 377.513 5.386 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)Nc3ccc(C#N)c(C#N)c3)oc2c1 460105132 IKPOVMXQVCTRPL-UHFFFAOYSA-N 393.402 5.104 30 20 GKED C[C@H]1C[C@@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCN1Cc1ccccc1 463255331 KXTOCTMPUWVLHQ-UGKGYDQZSA-N 398.510 5.211 30 20 GKED CCC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(OC)cc1 469203609 ZTYXZFHZEHJCCK-JOCHJYFZSA-N 391.515 5.231 30 20 GKED C[C@@H](CC(=O)N(Cc1ccco1)c1ccccc1C#N)Cc1cccc(F)c1 470834227 ZXUXDTNBMRPCEY-QGZVFWFLSA-N 376.431 5.092 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccccc1 474414012 UTBHBDAXWLFYNP-LJQANCHMSA-N 381.435 5.521 30 20 GKED C=C(C)[C@H](NC(=O)N(C)Cc1ccccc1N1CCCC1)c1ccc(F)c(F)c1 477739165 GTQXXGACVZOYON-QFIPXVFZSA-N 399.485 5.024 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@@H](C#N)c1cnc2ccccc2n1 483194898 AKCNJASXWLUSPM-FQEVSTJZSA-N 393.446 5.007 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@@H](c1cccs1)C(CC)CC 483258611 NHTOJRLTCQUGIT-HXUWFJFHSA-N 390.549 5.099 30 20 GKED N#C[C@H](C(=O)c1cc(F)ccc1-c1ccoc1)c1nc2ccccc2n1C(F)F 483485402 CNKQDUGQTIPRDZ-MRXNPFEDSA-N 395.340 5.321 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(OCCc3ccccc3)c2)c1 501690146 NVQFNNSZUVFNRK-UHFFFAOYSA-N 388.492 5.176 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ccc(OC)cc1)C1CC1 504003280 RCNCXWCIMFYYBR-IBGZPJMESA-N 390.936 5.259 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3cccc(COC4CCCCC4)c3)CC2)c1 508149973 URTMJHBDVVCDTM-UHFFFAOYSA-N 392.474 5.217 30 20 GKED COc1cccc(C2(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)CC2)c1 508171850 JOFPYVKFKGDSKR-UHFFFAOYSA-N 384.435 5.029 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C3CCC(OC(F)F)CC3)c2)cc1 511192104 PRZUUDAOZDSKEU-UHFFFAOYSA-N 386.398 5.087 30 20 GKED N#Cc1c(NC(=O)CCCc2nc3ccccc3s2)sc2c1CCCC2 515317949 JLGOMULCESVFEP-UHFFFAOYSA-N 381.526 5.070 30 20 GKED COCc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)oc2ccccc12 519058036 CDIALDOUQRSQQB-UHFFFAOYSA-N 398.418 5.495 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C 520197865 ROWUQQMDBARSCB-JXFKEZNVSA-N 381.545 5.990 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccc(C(F)(F)F)cc3)c2)c1 521821402 PGTIXUOACKXOJH-UHFFFAOYSA-N 396.412 5.446 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 524461182 MIXRADPBXBNZEZ-UHFFFAOYSA-N 389.411 5.352 30 20 GKED COc1cccc([C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2Cl)c1 540595864 GWVWAZATJFSHLR-HJPURHCSSA-N 376.887 5.660 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](c2ccc(F)cc2)c2ccccn2)cc1 541564850 FUIMMFXYDRFEIJ-AREMUKBSSA-N 393.465 5.639 30 20 GKED N#Cc1ccc(Cc2cnc(NCc3nc(-c4ccccc4)cs3)s2)cc1 544678050 VWKHYHNCEDGNHF-UHFFFAOYSA-N 388.521 5.341 30 20 GKED N#CC1(c2ccc(-c3nc(-c4ccc(COCC(F)(F)F)cc4)no3)cc2)CC1 547043215 POCGIONLVMHJNL-UHFFFAOYSA-N 399.372 5.038 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cc(Cc3ccccn3)ccc2C)CCCC1(C)C 549065329 RIHTZSXIDZRWQA-QFIPXVFZSA-N 377.532 5.579 30 20 GKED CCC[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 549401194 PVEULFNKRLSFTP-SFHVURJKSA-N 375.394 5.434 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 553945092 STJGHUXOLBKUMO-JKSUJKDBSA-N 377.246 5.183 30 20 GKED Cc1cc(CNC[C@@H](C#N)CCC#N)ccc1Oc1ccc(Cl)cc1Cl 554552278 PVRUEESIIQEXBK-MRXNPFEDSA-N 388.298 5.627 30 20 GKED CCC(CC)(CCO)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 558746672 OBEUGOWDNUAUEC-IBGZPJMESA-N 399.922 5.058 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccoc2C(F)(F)F)n1 564616402 IKKDHNAVZUFUNB-SNVBAGLBSA-N 380.219 5.426 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](NC2CCC(C)(C#N)CC2)CCC3)cc1 570640593 NNFDBCBWKNSBAG-ASNBIDDJSA-N 381.545 5.258 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N3Cc4ccc(C#N)cc4C3)c2)C1 594070960 KIRUFSIIHLHZEI-UZUQRXQVSA-N 389.499 5.201 30 20 GKED CC(C)(C#N)c1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 594496043 XYQWXMDLYRLXEL-HUUCEWRRSA-N 392.387 5.487 30 20 GKED Cc1nnc(Sc2ccc(NC(=O)CC3(C#N)CCCCC3)c(C)c2)s1 597058525 MOUINPCTRHVYTE-UHFFFAOYSA-N 386.546 5.109 30 20 GKED C=CCCCN(C)C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 605644619 SQACVIANPXPYSK-UHFFFAOYSA-N 391.298 5.284 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCc2ccccc2C1 609773127 YFPJEECRFKCCFV-IAGOWNOFSA-N 379.529 5.007 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)c1 609863273 AYNOAYWFVYSWKN-UHFFFAOYSA-N 376.843 5.237 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2cc(C#N)ccc2OC(C)C)C1 610016242 KDDJFLVLTLLHKQ-IEBWSBKVSA-N 377.488 5.064 30 20 GKED N#CC1(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CCCC1 610196966 NLGBVRWFLNQATA-UHFFFAOYSA-N 375.255 5.352 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2C3CCCC2CCC3)c1 610235776 CGPFJHAUJBVFLJ-UHFFFAOYSA-N 380.875 5.551 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)c[nH]c2c1 610396185 HSQUTWUTWOWFCI-UHFFFAOYSA-N 396.450 5.107 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cc2ccccc2s1 615494771 JEZZVMQKLRTOTI-JTQLQIEISA-N 375.280 5.571 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccccc1SCc1cccs1 618783124 RFTQOHMKLFKZOX-FQEVSTJZSA-N 390.533 5.329 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)o1 626369633 JYPGKIIRENLZAH-NSHDSACASA-N 387.226 5.269 30 20 GKED O=C(Nc1c(F)cccc1Cl)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 646345143 LWOSTQHWJVIWJS-OCAPTIKFSA-N 392.702 5.074 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2sccc2Br)c1 726744256 YQKQHWDWDJPJQG-VOTSOKGWSA-N 376.275 5.089 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c[nH]c4cccc(C)c34)n2)cc1 729069793 HYXIGQSTALWUSU-GOSISDBHSA-N 385.492 5.327 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3ccc(OC(F)F)c(OC)c3)c(C)c2c1 729149870 GIZQLTNXARIWHS-DAXSKMNVSA-N 388.366 5.256 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](c3ccccc3F)C2)cc1 730665188 STUGXORDMSLZEH-REWPJTCUSA-N 399.469 5.503 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1csc2ccccc12 731113968 AOTBWLLSYLCUMY-HUUCEWRRSA-N 395.553 6.036 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3C#N)c2)c(F)c1 731318093 GIVZSRSBZXVOTH-XFXZXTDPSA-N 387.410 5.181 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(O)c(Cl)c3)cc2)cc1 732306674 MYFFANZAGMBKJX-UHFFFAOYSA-N 378.815 5.156 30 20 GKED CCCCCOc1ccc(C(=O)/C=C\c2csc(N(C(C)=O)C3CC3)n2)cc1 734306432 OLGRMPOIJISENF-JYRVWZFOSA-N 398.528 5.124 30 20 GKED CN(c1ccc(CNC(=O)c2ccccc2SCC#N)cc1)C1CCCCC1 742416524 APFMWVSGROMOQI-UHFFFAOYSA-N 393.556 5.001 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)N[C@H]3CCc4ccccc4C3)cc2)c1 742996703 CDHHBXOICVIEDD-NRFANRHFSA-N 399.519 5.194 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1 743200158 WPBMPZKSEIYAEE-OAHLLOKOSA-N 380.419 5.199 30 20 GKED CCOc1cc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc(Cl)c1O 744866411 UVWMCKRTCFHVPD-ONEGZZNKSA-N 377.676 5.709 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)/C=C\c1ccc(-c2ccccc2Cl)s1 746006333 FYGNJEKMUUXAPV-CLFYSBASSA-N 398.837 5.386 30 20 GKED COc1cc(/C=C2/CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)ccc1SC 746341683 GPRNAVIDVZMMAC-APGQMXJTSA-N 381.453 5.155 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2O)cc1Cl 748447043 JKSFDOXQFCTIKK-IBGZPJMESA-N 391.858 5.023 30 20 GKED Cc1nc(Cl)ccc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 752030123 XMTJRMAVPABWTM-UHFFFAOYSA-N 381.794 5.099 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3)o2)cc1OCCCC#N 761804154 KMTNUUQVFGKNKY-PKNBQFBNSA-N 387.435 5.534 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1cc(F)cc(C#N)c1 796813051 VOZMPYRIQRNAIW-HNNXBMFYSA-N 397.862 5.115 30 20 GKED N#Cc1ccc(N2CCC(Nc3cccc(C4SCCS4)c3)CC2)cc1 796886130 MTOKWSQVAJVWJU-UHFFFAOYSA-N 381.570 5.118 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 802077168 KTHDLYSVWJOZLG-CXAGYDPISA-N 394.471 5.254 30 20 GKED C[C@@H](OC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1 803066683 OZFGRYBRDPYBBH-OTYXRUKQSA-N 395.274 5.434 30 20 GKED Cc1ccc(-c2cc(C(=O)OC3(CC#N)CCC3)c3cnn(C(C)C)c3n2)s1 810854290 SFWAAVBOLQOOFQ-UHFFFAOYSA-N 394.500 5.042 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1 814575008 VGYAHOQISDHZGF-DEOSSOPVSA-N 383.495 6.219 30 20 GKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)nc1Cl 817867026 RAJQHUJHPUMREN-OCCSQVGLSA-N 395.812 5.019 30 20 GKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1ccc(Br)s1 916134736 YABFIGDCXFIYFE-SREVYHEPSA-N 376.300 5.530 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 916681793 YVEIGDQITOTJCS-XGRCMKMKSA-N 385.467 5.380 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1sc2cccc(Cl)c2c1Cl 916900604 SCLNDQSQVPSWRF-NSHDSACASA-N 389.263 5.169 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccc(Cl)s2)cc1 916915863 QMVBNQVFSWSZQQ-QXLXQBSBSA-N 386.904 5.105 30 20 GKED O=C(O)c1ccccc1NN=Cc1cccc(OCc2ccccc2Cl)c1 1776030072 TZLUEPGCBRTYDT-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1sc(-c2ccc(Cl)cc2)nc1C 1776030159 JGECNSPZFIJARC-UHFFFAOYSA-N 385.876 5.306 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(CCCc1ccccc1)c1ccccc1 1776049594 HPIRJGQDKHCVPL-UHFFFAOYSA-N 388.467 5.233 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)ccc1F 1776061866 RZGAQWAHCOQPKA-UHFFFAOYSA-N 393.201 5.537 30 20 GKED C=CCOc1cccc(/C=C(\CCCC(=O)O)c2nc3ccccc3s2)c1 1776184821 ZPURRHUVQUUSER-SAPNQHFASA-N 379.481 5.657 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(-c2ccccc2)o1 1776354391 CZSQGZVJRWNKHY-LUAWRHEFSA-N 376.408 5.328 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3)s2)c1)C(=O)O 1776470922 NOIOJNFAPRFEBV-GDAGCXPBSA-N 396.439 5.302 30 20 GKED C=CCN(C(=O)c1ccc(C(F)(F)F)nc1)c1nc(-c2ccccc2)cs1 26370227 FGSRYYQMNRYNKB-UHFFFAOYSA-N 389.402 5.057 30 20 GKED C=CCN(CC(=O)Nc1c(Cl)cc(Cl)cc1Cl)Cc1ccccc1 27775235 FIDJAANEUCVAGI-UHFFFAOYSA-N 383.706 5.274 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)cc1 66954236 JTKNVGMUKRRMBE-MAUKXSAKSA-N 383.517 5.362 30 20 GKED Cc1[nH]c2ccc(CNC(=O)Nc3ccccc3S[C@@H](C)CC#N)cc2c1C 66955589 AICVLRAIKCWUNB-AWEZNQCLSA-N 392.528 5.501 30 20 GKED C[C@@H]1CC(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 93971067 GAFMCFXHAFINGN-SXGZJXTBSA-N 382.891 5.138 30 20 GKED C=C(C)CN(CC)Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 102681345 NJXSHTMUEZRZQI-UHFFFAOYSA-N 398.359 5.533 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CSc2nc3cc(Cl)ccc3o2)cc1C 105349570 AWNAFLXFLNNMJS-UHFFFAOYSA-N 399.903 5.137 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1ccc(F)cc1 108146387 NRDYYYOHOUFIQD-UHFFFAOYSA-N 398.488 5.279 30 20 GKED C=C(Br)CSc1ncc(-c2ccccc2)n1CC(F)(F)F 109625017 UTEJKGINIPCDAO-UHFFFAOYSA-N 377.229 5.113 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(-c2ncco2)ccc1C 120341687 FMPYQEJBHMRKLZ-UHFFFAOYSA-N 387.892 5.585 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cccc(-c2ccoc2)c1 127841962 MJWFTLTVKHDARJ-NRFANRHFSA-N 386.451 5.033 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1cn(C)c2ccccc12 150921664 KFCQCQJVANZFRN-INIZCTEOSA-N 377.513 5.001 30 20 GKED N#Cc1ccc(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)s1 176979424 YBWHDGOKHARAES-UHFFFAOYSA-N 379.432 5.052 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc2nc(-c3ccccn3)oc2c1)c1ccccc1 180289659 XAMOJZNVVREVOP-GOSISDBHSA-N 397.438 5.056 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc(Cl)sc2Cl)ccc1OC 180812049 VUFRKMRBGVCRCE-YPMHNXCESA-N 399.343 5.595 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cnn1C(C)C 181255363 NLGUTLMEJHTUMM-OAHLLOKOSA-N 384.892 5.039 30 20 GKED C[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)c1cccc(C#N)c1 189791213 VGQHBPNLDJKIEN-KRWDZBQOSA-N 397.507 5.113 30 20 GKED C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)c1cccc(C#N)c1 189791912 WSLIVNVCBKGALR-INIZCTEOSA-N 386.480 5.311 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)sc2C)cc1 190909052 FNSPSAFFWMIUPE-SFHVURJKSA-N 399.475 5.165 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1snnc1C(C)(C)C 191388194 BZGVDGRHGHXEST-UHFFFAOYSA-N 392.484 5.060 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2)CCCC1)c1nc2ccccc2n1C(F)F 193769432 UARGDOKHUYOFER-MRXNPFEDSA-N 379.410 5.120 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3snc(Cl)c3C#N)s2)cc1 301271470 JSZLPDIOVRMEGL-SNVBAGLBSA-N 390.921 5.282 30 20 GKED N=C(O)C1CCN(c2ccccc2N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 329007034 NGLRMJNAZYUCKB-YTQUADARSA-N 383.536 5.633 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)[C@H]1CCCC[C@H]1C(=O)N1CCCC1 330080488 JJANLEPNFQZTQY-LEWJYISDSA-N 391.515 5.074 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2C/C(O)=N/C1(c2noc(C3CC3)n2)CCCC1 330093129 RHXVCRWORUNDED-QGZVFWFLSA-N 395.503 5.192 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(OC(C)C)cc1 410214938 JUYAISRFEGPBHM-UHFFFAOYSA-N 378.925 5.087 30 20 GKED C=CCC1(c2nc(C(F)(F)c3ccc(Cl)c(Cl)c3)no2)CCOCC1 424347537 LPGQBEHPJCKYFZ-UHFFFAOYSA-N 389.229 5.141 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc2c(cc1Br)CCC2 425681587 KNNUWOOBSLMMKA-CYBMUJFWSA-N 398.304 5.034 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(F)c3SC)n2)cc1 435778818 UEXWTCCIGDAECP-HNNXBMFYSA-N 398.484 5.170 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)c(Cl)cc1F 439980354 PNXLBMSXAFRUHH-UHFFFAOYSA-N 380.250 5.448 30 20 GKED C=CCC1(C(=O)Nc2ccc(C(=O)Nc3cccnc3)c(Cl)c2)CCCC1 449829178 SDFBJEBECCDEMQ-UHFFFAOYSA-N 383.879 5.062 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1ccc(Cl)cc1 459784192 ASLAFMLHASRFRD-LSDHHAIUSA-N 387.936 5.024 30 20 GKED C=CCN(C(=O)c1ccoc1C(F)(F)F)c1nc(-c2ccccc2)cs1 463105746 IBUVPIAKBUPHQK-UHFFFAOYSA-N 378.375 5.255 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)[C@@H](C)c1cccc(C#N)c1 463588593 INYXVETXIIVDAT-NSHDSACASA-N 377.669 5.025 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)Nc1sc(-c2ccccc2)cc1C#N 466990863 BACLDORVQKFOCV-MRXNPFEDSA-N 376.481 5.330 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@]1(C)Cc1ccccc1 467340075 BYNOILXCSAKUFJ-JPYJTQIMSA-N 393.556 5.567 30 20 GKED Cc1cccnc1[C@H]1CCC[C@H](NC2CCC(Oc3ccccc3C#N)CC2)C1 467342764 LBYQVEUUIGPBDJ-XXDDBKGRSA-N 389.543 5.268 30 20 GKED Cc1cc([C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CC2)ccc1F 469212943 JNSZMGSMFYDLAK-XMMPIXPASA-N 391.490 5.280 30 20 GKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 470414656 LKTBRVZXUSISLX-SJORKVTESA-N 384.545 5.127 30 20 GKED C=C(C)[C@H](NC(=O)[C@H]1C[C@H]1c1ccccc1OC(F)F)c1ccc(F)c(F)c1 475702801 NNYAYUUCZLGLMK-DOXZYTNZSA-N 393.380 5.103 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)c2cccc(O)c2)cc1 476769870 DBNOGUNTNAVJHP-UHFFFAOYSA-N 399.490 5.727 30 20 GKED Cc1csc(-c2cccc(NCc3cn(C)nc3-c3ccc(C#N)cc3)c2)n1 478382526 HMVRLAJHNXNQLK-UHFFFAOYSA-N 385.496 5.003 30 20 GKED C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1ccccc1Sc1ccccc1C#N 481382546 IGMPRXLETVCFIH-XLIONFOSSA-N 394.540 5.035 30 20 GKED Cc1ccc(CN2CCCC2)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 481509770 ZNUPIXRPMLMXMQ-UHFFFAOYSA-N 389.524 5.238 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N(CC(F)F)c2ccccc2)c1 485250222 ZFEXSFNGTYQXJK-UHFFFAOYSA-N 392.405 5.049 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N[C@H](CCCC#N)c2ccccc2)c1 487239265 JHMTYOREMPMMLN-DENIHFKCSA-N 378.516 5.437 30 20 GKED C=CCC(C)(C)CNC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 489700418 DZURANTYYWYWKX-UHFFFAOYSA-N 382.451 5.090 30 20 GKED O=C(NCC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(F)cc1C(F)(F)F 490928076 QHRLNDTUKDBUOI-AWEZNQCLSA-N 393.302 5.311 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1 493638172 NQPXOFBVTLWXMI-UHFFFAOYSA-N 398.553 5.487 30 20 GKED Cc1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc2n[nH]cc12 501754869 ZCDUJFSACAVKGR-UHFFFAOYSA-N 384.464 5.147 30 20 GKED CCCOc1ccc(Cl)cc1NC(=O)Nc1cccc(OCCCC#N)c1 502226661 ASMTXWCPLYXMPZ-UHFFFAOYSA-N 387.867 5.455 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1oc2ccccc2c1CSC1CCCCC1 509723723 ZEPFGPFWMOMIEK-INIZCTEOSA-N 384.545 5.620 30 20 GKED CC[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 518133507 MSWPFKZJOUDRBJ-APWZRJJASA-N 384.570 5.761 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518385912 GKQRQYCYEQKRDC-JOCHJYFZSA-N 383.451 5.031 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(-c4ccco4)s3)cc2)c1 518730805 AAPWRROOFFVFIY-UHFFFAOYSA-N 387.420 5.319 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc4c(c3)CCCO4)cc2)cc1 518910092 XUTIHBCTYCOQOJ-UHFFFAOYSA-N 384.435 5.122 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)sc2ccc(F)cc12 520827628 QVQYIAONGCVRMR-GFCCVEGCSA-N 384.501 5.853 30 20 GKED N#Cc1ccc(N2CCC(C(=O)c3ccc(Cl)cc3)CC2)c(C(F)(F)F)c1 523085322 SLHFQUKIJAJYHR-UHFFFAOYSA-N 392.808 5.330 30 20 GKED Cc1ccnc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)CC(C)C)cc2)n1 523787634 ODJMBSPXRMFHEQ-UHFFFAOYSA-N 399.498 5.014 30 20 GKED CCCN1Cc2cccc(NC(=O)c3cccc(Nc4ccc(C#N)cc4)c3)c2C1 524112798 CUXZBBAKKPXADH-UHFFFAOYSA-N 396.494 5.280 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1cccc(F)c1 525650505 AFCNJKBWFGOBFA-LBPRGKRZSA-N 396.409 5.592 30 20 GKED Cc1csc([C@@H](NCc2cccc(OCc3ccccc3C#N)c2)C2CC2)n1 525709328 QJJOLIXFGZQPBB-QFIPXVFZSA-N 389.524 5.143 30 20 GKED C[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)c1cc2ccccc2s1 527485533 LGTGQAJFWRMEGT-JKSUJKDBSA-N 395.503 5.026 30 20 GKED N#Cc1cc(NC(=O)c2c(Cl)cccc2Cl)ccc1OCC(F)(F)F 531091986 CGKIWDYHGPOLJC-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(OC(C)C)CC1)c1ccc(C(F)(F)F)cc1 533546818 WCBCBBIKGFZYFM-LJQANCHMSA-N 398.469 5.312 30 20 GKED CCN(Cc1cccs1)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 537008823 RQZQLWHKMXOAGZ-UHFFFAOYSA-N 375.497 5.018 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(OCCN(C)C)c1 538113471 HIEPAURAUSLPMV-FQEVSTJZSA-N 399.538 5.016 30 20 GKED COc1cc([C@H](C)NCc2ccccc2C(C)(C)C#N)ccc1OCC(C)C 538167395 DMGMZZOHAMIHFH-SFHVURJKSA-N 380.532 5.382 30 20 GKED N#Cc1ccc(F)c(CNC2(c3noc(C4CCCC4)n3)CCCCCC2)c1 543554483 DIBRQQSAUMOQHC-UHFFFAOYSA-N 382.483 5.077 30 20 GKED C=CCOc1ccc(CN[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1Cl 543642427 PMTXFJUJRXZJQF-NQIIRXRSSA-N 375.871 5.054 30 20 GKED Cc1c(C#N)c(NC(=O)CNC(C)(C)c2cccs2)n(C2CCCCC2)c1C 544471082 KTNNVDMNLKBWDC-UHFFFAOYSA-N 398.576 5.007 30 20 GKED N#Cc1ccccc1Sc1ccc(-c2nc(CCC(F)(F)F)no2)cc1 545618007 SUMNQLFMAHSVJM-UHFFFAOYSA-N 375.375 5.254 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 549299373 CWVFZTVEFXRXEL-IRXDYDNUSA-N 394.540 5.519 30 20 GKED N#CC[C@@H](CC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1)c1ccccc1 552271340 CNATZJADEVZSQA-WMZHIEFXSA-N 382.454 5.162 30 20 GKED N#CCCC[C@@H](N[C@H]1CCc2sc(Br)cc21)c1ccccc1 566576514 YPXXRMHQHOIWDP-CVEARBPZSA-N 375.335 5.523 30 20 GKED Cc1nsc(Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1C#N 571629550 FTLRQGXMNMMJLT-UHFFFAOYSA-N 386.839 5.112 30 20 GKED CCO[C@@H](c1noc([C@@H](C)C(F)(F)F)n1)c1ccc(F)cc1C(F)(F)F 573733752 KERXOFAABUPSCC-RDDDGLTNSA-N 386.267 5.019 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@@H]1Cc1ccccc1 577013202 IWBVYIHEEARBMT-UYAOXDASSA-N 393.556 5.710 30 20 GKED N#Cc1ccc2c(c1)[C@H](NC1(c3cc(C(F)(F)F)ccc3Cl)CC1)CC2 577787402 OLOSZYGUCZVTTH-GOSISDBHSA-N 376.809 5.497 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3ccc(C#N)cc3C(F)(F)F)oc12 583784090 MWDSQGMMXIGCOJ-ZDUSSCGKSA-N 388.389 5.573 30 20 GKED COc1cc(CN[C@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1C#N 584261437 CUSYBPAZRAUDAL-CQSZACIVSA-N 393.468 5.054 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCc2ccc(OC3CCCC3)cc2)c(Cl)c1 586840143 HQXZVBJTAQIYIU-UHFFFAOYSA-N 389.282 5.116 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc2n[nH]cc2c1 588244316 ZECXJQCCTKNPGR-OAHLLOKOSA-N 397.438 5.110 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CCc2ccccc21 593157968 PWBLBJIBFUYYJI-IAGOWNOFSA-N 379.529 5.275 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)N3Cc4ccc(C#N)cc4C3)c2)C1 594070957 KIRUFSIIHLHZEI-SBUREZEXSA-N 389.499 5.201 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1 598229631 FDSWFPSISRYHPI-JOCHJYFZSA-N 391.515 5.094 30 20 GKED C[C@@H](Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1cccc(C#N)c1 600851057 WKASRFXTADVUBC-CYBMUJFWSA-N 384.266 6.225 30 20 GKED Cc1nn(-c2ccccc2Cl)c2sc(C(=O)Nc3sccc3C#N)cc12 603451843 AHLDYUCDHBOXET-UHFFFAOYSA-N 398.900 5.234 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCCCC[C@H]1c1ccco1 605925535 XVYXMIJNOUEBAQ-QFIPXVFZSA-N 385.467 5.224 30 20 GKED N#C[C@H](NC(=O)CCCc1cccs1)c1ccc(OCc2ccccc2)cc1 609028580 HDLLTUOQLARHSP-QFIPXVFZSA-N 390.508 5.031 30 20 GKED N#C[C@H](NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccc(F)cc1 609043883 CUOZJFVNMJVNTM-NRFANRHFSA-N 394.833 5.053 30 20 GKED CCCCOc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 609059834 NLLQCCIQEXSFLU-UHFFFAOYSA-N 390.439 5.161 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](CC)c1ccccc1 609435020 KURKXRVWXHHLLI-WIYYLYMNSA-N 395.572 6.476 30 20 GKED CCN(CC)C(=O)[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 609709248 KQEQYEBZXHFAEQ-DEOSSOPVSA-N 399.494 5.372 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccc(F)c(F)c1 610226324 ZCOOANBWZOBYKP-CQSZACIVSA-N 378.378 5.371 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)Nc2ccc(OC(C)C)c(C#N)c2)s1 610934152 LASULOWECSQZOE-UHFFFAOYSA-N 397.525 5.020 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 620457145 WSZKKRJDMASJQL-RAIGVLPGSA-N 399.350 5.030 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)ccc1Cl 644890330 GKFNHEZKMHXSSA-MBTKJCJQSA-N 391.714 5.118 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1OC1CCCC1 680169736 PSGQKNILCFKVSR-LJQANCHMSA-N 386.451 5.055 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCc2cccnc2)cc1 682803888 XJOCRQYWZNCFBG-UHFFFAOYSA-N 386.495 5.765 30 20 GKED O=C(Nc1cccc(/C=C2\CCc3sccc3C2=O)c1)c1ccccc1Cl 726891210 HIUKPSAJUBOSFJ-NTCAYCPXSA-N 393.895 5.866 30 20 GKED FC(F)(F)c1ccccc1CON=Cc1cccc(OCc2ccncc2)c1 727435559 RRESEPTXBNHWFX-UHFFFAOYSA-N 386.373 5.230 30 20 GKED N#CCOc1ccccc1C(=O)O[C@@H]1CCc2c(OCc3ccccc3)cccc21 730426621 ASXKREJPQDANQK-XMMPIXPASA-N 399.446 5.012 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(F)cccc2s1)c1ccc(Cl)c(Cl)c1 731643597 IVAGAQUFXQFVJG-CQSZACIVSA-N 379.243 5.342 30 20 GKED Cn1c(CC(=NOC/C=C\c2ccccc2)c2ccccc2)nc2ccccc21 731664196 BLMSLOSWZRILOM-VKTPNMGZSA-N 381.479 5.250 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)CC2CCC(c3ccccc3)CC2)c1 733771753 UKILAMONYRKBIE-ZUEZHPSSSA-N 390.527 5.348 30 20 GKED CC(C)OC(=O)NCc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1 734979057 JDOIQIOITLLGQQ-UHFFFAOYSA-N 381.259 5.084 30 20 GKED C#CCOc1ccc(CN[C@H](C)c2sc(-c3ccccc3F)nc2C)cc1 736641920 OSMMFXSUZAYAGX-OAHLLOKOSA-N 380.488 5.120 30 20 GKED CCc1ccccc1NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1 739436377 AFKUSIDRFYPWOS-UHFFFAOYSA-N 377.538 5.336 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SCC(F)F)cc2)cc(Cl)c1O 741841179 DUQWRNKYRUYXTQ-FARCUNLSSA-N 384.831 5.308 30 20 GKED C[C@@]1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCc2ccccc2C1 742536625 BHFQUMGJXCVOOP-AZGAKELHSA-N 380.491 5.476 30 20 GKED FC(F)(F)c1ccc(CON=Cc2ccccc2OCc2cccnc2)cc1 746576908 OGIGSYABQPPSQT-UHFFFAOYSA-N 386.373 5.230 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@@H](CCC#N)c1ccccc1 747709980 QPQTYIQFSXHMQX-NRFANRHFSA-N 379.573 6.265 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCC1CCC(C#N)CC1 755965373 FUQKKHZAOHDZDW-UHFFFAOYSA-N 393.270 5.444 30 20 GKED C[C@@H](Cc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 756515798 FPUYYMDCVOUXGN-SWLSCSKDSA-N 387.817 5.140 30 20 GKED Cc1oc2ccccc2c1C=Nn1c(C)nc2scc(-c3ccccc3)c2c1=O 758094568 DTPWXYUAXKPLJK-UHFFFAOYSA-N 399.475 5.370 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3sccc3c2)cc1 761035920 IACAFDVGJJRNJP-LIRRHRJNSA-N 376.481 5.376 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccc3[nH]ccc3c2)cc1 765622483 CNXSNSXALZALGR-ZFLSFVSKSA-N 377.447 5.475 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccnc(Cl)c2)cs1 782193827 JEANIRJTVXQPEX-YVMONPNESA-N 397.887 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1 789450631 FIIIQVQXLFQIID-HXUWFJFHSA-N 391.515 5.541 30 20 GKED N#CCOc1ccc(Cl)cc1COc1ccc(-c2ncc3n2CCCC3)cc1 789669137 SMTGHOYEBIOEIJ-UHFFFAOYSA-N 393.874 5.021 30 20 GKED C=CCOc1ccc(CNc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)cc1Cl 815166152 ZJFQGOJKFQIAMQ-YCRPNKLZSA-N 384.907 5.278 30 20 GKED CN(C)c1ccc(CN[C@H](CCCC#N)c2ccccc2)c(C(F)(F)F)c1 816627715 VEKQHBITNJEVDF-HXUWFJFHSA-N 375.438 5.296 30 20 GKED CC[C@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842280266 AKBKZPLBHCSCCS-ZBFHGGJFSA-N 397.544 5.058 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)CCCCC#N)c(C(F)(F)F)c1 846863222 VJIQALKLPXZISW-UHFFFAOYSA-N 385.386 5.075 30 20 GKED N#CCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 847626747 RKGWLGSPFMTHIL-ZDUSSCGKSA-N 378.284 5.377 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1sccc1C(F)F 873985474 NHDIZUYYFFYACP-RNFRBKRXSA-N 395.315 5.325 30 20 GKED C[C@@H](CCc1ccc(O)cc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354037 TUIXMEBYAWVINP-MHECFPHRSA-N 399.494 5.190 30 20 GKED CCCCCOc1ccc([C@@H](C)NC(=S)Nc2ccccc2C#N)cc1OC 916019305 JYGKOAMPAFJUBL-MRXNPFEDSA-N 397.544 5.183 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C\C(=O)c1cccc(OC(F)F)c1 916128832 FLXGTYMVZBHYRM-QXMHVHEDSA-N 382.410 5.046 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc(Cl)cc3)n2)cc1 916627348 NRPAPNJLZLHBCS-SNMSSPIJSA-N 378.884 5.662 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(CSC)cc2)cc1 916947220 HARNCCUKJJJVKC-FOIQADDNSA-N 380.513 5.024 30 20 GKED CC(C)c1ccc(SCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 920267423 IQOMWWNRLVZQMY-SFHVURJKSA-N 393.537 5.297 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)C1 1776155562 BEGWLNHZWDHEKC-QFIPXVFZSA-N 385.891 5.375 30 20 GKED CC(/C=C1/CCc2occ(C(=O)O)c2C1=O)=C\c1ccccc1C(F)(F)F 1776199795 AKOUVOXVHQDBCP-YGOOLXEZSA-N 376.330 5.155 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776388673 ZXIBKIDHDKWNJL-ZRDIBKRKSA-N 392.476 5.797 30 20 GKED CC(=C/c1cc(F)cc(F)c1)/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776398732 FUZOINADDWBLAL-QHOJYGHMSA-N 386.394 5.293 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C/c1cccc(OCc2cccc(C(=O)O)c2)c1 1776665996 RBAQNAOYZKMNCS-SYXCRGJESA-N 398.458 5.422 30 20 GKED CCCCCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1 1776785935 UKXKBBCJPKEZMB-PTNGSMBKSA-N 380.484 5.939 30 20 GKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc(N2CCCCC2)c(C(=O)O)c1 1776786116 MPKBZSAFYZHDCP-GOSISDBHSA-N 388.552 5.700 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(C(=O)O)c(O)c1 1777487709 HNFOSPDTHFVZEI-YCRREMRBSA-N 399.855 5.072 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccc(/C=C\C(=O)O)cc1 1777488306 ZPXHDZNYRCMMER-KPGXXQICSA-N 375.449 5.112 30 20 GKED N#Cc1ccccc1OCC(=O)Nc1ccccc1Oc1ccccc1Cl 15710530 QFCLCHBTCRCBEB-UHFFFAOYSA-N 378.815 5.021 30 20 GKED CN(C)Cc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 47452837 LNPHSBNIIKIVQS-UHFFFAOYSA-N 387.508 5.023 30 20 GKED N#CCCCOc1cccc(NCC(=O)Nc2ccccc2-c2ccccc2)c1 55876971 QOYFXGVCTJSWHC-UHFFFAOYSA-N 385.467 5.087 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccc(OC(F)F)cc2)ccc1OC 60946763 CCHHIVMJWZTDJT-HNNXBMFYSA-N 377.431 5.102 30 20 GKED C=CCN(C(=O)c1cccnc1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 61204816 QZVJFIGGDPUXJC-UHFFFAOYSA-N 390.295 5.345 30 20 GKED COc1ccccc1CN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 66953951 DWOBCKUGIWHUES-INIZCTEOSA-N 395.528 5.286 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(C(=O)N2CCCCC2)c1 108353953 OVFABDFXXQDVSO-SFHVURJKSA-N 393.556 5.177 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109016667 DABKVVYYHMFUFJ-LLVKDONJSA-N 390.852 5.286 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F 120244035 QCKGZONJAZZLBP-UHFFFAOYSA-N 398.796 5.440 30 20 GKED CSC[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 122953159 HCPIGKKPYNVFCE-QGZVFWFLSA-N 381.501 5.018 30 20 GKED CCN(Cc1csc(-c2ccccc2OC)n1)[C@H](C)c1ccc(C#N)cc1 172651008 WNCCQJVXPHYILB-MRXNPFEDSA-N 377.513 5.273 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 172881878 NXAXZRWBHNQTEK-JOCHJYFZSA-N 380.850 5.261 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cccc(CSc2ccccn2)c1 176949881 JKRSRDVGQKWZHI-UHFFFAOYSA-N 382.533 5.168 30 20 GKED CC(C)OCCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 182047215 OYFRAKWZDCEJTB-HXUWFJFHSA-N 399.922 5.322 30 20 GKED C[C@H](S[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1C(F)(F)F 190876288 AEUGIPRHMXFSBM-STQMWFEESA-N 378.419 5.398 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCc1ccccc1)[C@@H]1CCOC1 191420118 DQDUDYSOYIOASF-JOCHJYFZSA-N 392.543 5.404 30 20 GKED CC(C)c1c(NC(=O)N[C@@H](CCC#N)c2ccccc2)cnn1-c1ccccc1 192329827 XXOOVDLDENWCAT-FQEVSTJZSA-N 387.487 5.162 30 20 GKED O=C1/C(=C/c2ccc(O)c(Cl)c2)CSC/C1=C\c1ccc(O)c(Cl)c1 207714620 IHWKEBBNXPFHHN-ACFHMISVSA-N 393.291 5.188 30 20 GKED COc1ccc(C(=O)N2CCCC2)cc1N=C(O)[C@@H]1CCC[C@H]2CCCC[C@H]21 328983964 FWCZCAAEYYZYGU-BHIYHBOVSA-N 384.520 5.126 30 20 GKED CC1(C)Oc2ccc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)cc2O1 329501827 YSZIAAGXKNDOPX-MRXNPFEDSA-N 395.503 5.289 30 20 GKED Cc1[nH]nc(C(C)C)c1C(O)=Nc1ccc(N2CCCCC2)c2ncccc12 329916417 DRAZWLLTNMEQOG-UHFFFAOYSA-N 377.492 5.016 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(CCC(F)(F)F)cc1 425657577 IOYAOFHQSJEVIG-AWEZNQCLSA-N 375.394 5.278 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@H](c1cc(F)ccc1F)C(F)F 432916150 NCRQTASTTODYTL-CYBMUJFWSA-N 380.263 5.112 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2)ns1)c1nc(-c2ccccc2)cs1 437389971 JWHRQXRRQJSKCU-INIZCTEOSA-N 387.489 5.424 30 20 GKED COc1ccc(CCC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 437460400 GXJVUDPOJSOCPE-UHFFFAOYSA-N 390.414 5.070 30 20 GKED CN(CCc1cccs1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 438220818 VBKHYRACVPUZDE-UHFFFAOYSA-N 377.469 5.118 30 20 GKED N#Cc1ccsc1C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444433891 JMDVGTNRHKSMKV-LBPRGKRZSA-N 392.324 5.062 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 444808655 ULOCTLXOKOYQIM-KRWDZBQOSA-N 384.804 5.673 30 20 GKED CSc1nn(-c2ccccc2)c(NC(=O)c2ccc(C(C)(C)C)s2)c1C#N 445565079 JMLRPCKWXPGHFP-UHFFFAOYSA-N 396.541 5.077 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(Cc3cc(C#N)cs3)C2)n1 447061681 XURRCOZCHRXSCA-MRXNPFEDSA-N 395.553 5.131 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CCCC#N)c1ccccc1 458807292 XNQAIKXJMXTFPD-GOSISDBHSA-N 387.936 5.534 30 20 GKED N#Cc1ccc(NCc2ncc(-c3cccc(Cl)c3)o2)cc1C(F)(F)F 462181683 LRNYIHZCAMTYIP-UHFFFAOYSA-N 377.753 5.498 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)NCc1ccc(C(F)F)cc1 463105912 OEMWPPVCTUFCLP-UHFFFAOYSA-N 378.378 5.218 30 20 GKED C=CCOCCCC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 464074809 NFWVUOWLNHGWMX-LJQANCHMSA-N 382.504 5.111 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(C2CCC2)cc1 466358810 GAPALQVATAAMLF-MRXNPFEDSA-N 380.513 5.366 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1Cl 467277742 JGUYRUUPGJDWCD-AWEZNQCLSA-N 387.817 5.698 30 20 GKED Cc1ccc([C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CCC2)cc1 468825616 CVZZPFTXALSNBT-VWLOTQADSA-N 387.527 5.531 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c2ccccc21 469541343 BLJUZOFAJODJTJ-UHFFFAOYSA-N 399.416 5.692 30 20 GKED CCn1c2ccccc2c2cc(NC(=O)[C@H](C#N)Cc3ccc(C#N)cc3)ccc21 470712610 BJSNMLCXNFLUFN-IBGZPJMESA-N 392.462 5.007 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 477679218 IQODQZNVYKPUFM-UHFFFAOYSA-N 387.386 5.261 30 20 GKED CN(CCc1cccs1)C(=O)c1ccc(Sc2ccccc2C#N)cc1 479998968 YGEQBNINMBMYME-UHFFFAOYSA-N 378.522 5.086 30 20 GKED CCCN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@H]1CCCc2cccnc21 482280288 YTEQADZASIMUKK-QHCPKHFHSA-N 399.542 5.148 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)ccc1OC(F)F 482527575 FBIDYTHCWPAYBK-LLVKDONJSA-N 396.846 5.588 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccccc1Oc1ccccc1C#N 484609311 WORVIUXHMBWKIL-YOEHRIQHSA-N 388.389 5.154 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc[nH]c2C2CCC2)cc1 486043590 SXUAQAWUUPYUFT-UHFFFAOYSA-N 387.439 5.207 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cccc(OCc2cccc(OC)c2)c1C 488942220 AZUYZWGOKALVFM-LJQANCHMSA-N 380.488 5.155 30 20 GKED Cc1ccc(-c2nc(C(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)cs2)o1 499845955 YPRDPBBDTKURSW-LBPRGKRZSA-N 392.267 5.013 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc([N+](=O)[O-])c1C 500738436 DVRZWXLWDBEIFU-UHFFFAOYSA-N 387.395 5.128 30 20 GKED Cc1cc(Cl)c(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1Cl 503736218 CFNXMUUOHBDLMM-UHFFFAOYSA-N 386.282 5.495 30 20 GKED CCN(Cc1nc2cc(C(F)(F)F)ccc2n1C)[C@@H](C)c1ccc(C#N)cc1 508605746 SJJJTJWZOVLAIS-AWEZNQCLSA-N 386.421 5.047 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Br)cc1Cl 515230762 AKSQQALMHMGFRL-UHFFFAOYSA-N 385.714 5.384 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)cc2Cl)nnc1-c1ccncc1 517785153 NNMIRGXTKAKRFA-LBPRGKRZSA-N 391.327 5.686 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519052689 APIAHFSOBLBOCX-DEOSSOPVSA-N 397.478 6.028 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1csc(-c2ccccc2)n1 520015481 GLTXZQAOVOGNPZ-UHFFFAOYSA-N 395.487 5.279 30 20 GKED COc1ccc(S[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 520824881 GFIUJFFRCMEAPA-HUUCEWRRSA-N 386.542 5.066 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H]2C[C@H]2c2ccc3ccccc3c2)cc1 521752607 BIAIYOHRKLDDMF-ZEQRLZLVSA-N 384.479 5.289 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3ccc(F)cc3)cc2Cl)c1 524390903 JDYUSLLTWYKTES-UHFFFAOYSA-N 394.833 5.111 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 524711196 HSPJWQRIKVFZEP-UHFFFAOYSA-N 382.508 5.016 30 20 GKED CC(C)[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc2nc(O)oc2c1 537013717 PIASAWDBAZZZHU-XMMPIXPASA-N 397.478 5.559 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(COCCc4ccccc4)c3)cc2)CC1 538529377 CNNPAOFRWCRPHB-UHFFFAOYSA-N 396.490 5.253 30 20 GKED Cc1c([C@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)oc2ccccc12 539261597 QMEBTQIRFWMTMU-OAQYLSRUSA-N 386.455 5.150 30 20 GKED COCCOc1ccc(C#N)cc1NC(=O)Nc1c(C(C)C)cccc1C(C)C 543288243 IORILFIGQHVKDS-UHFFFAOYSA-N 395.503 5.474 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C#N)c(Cl)c3)n2)cc1 547647305 NSBYJDCAEUBQOQ-MRXNPFEDSA-N 377.856 5.134 30 20 GKED CC(C)(c1noc([C@@H](C#N)Cc2ccc(C#N)cc2)n1)c1cccc2ccccc12 551119383 COLPZBAFLIOXOF-HXUWFJFHSA-N 392.462 5.270 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](C)c1ccc2ccccc2c1 553115911 HRZNVOQKACBPFK-LJQANCHMSA-N 375.516 5.326 30 20 GKED C[C@@H](C1CCCCC1)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555005003 DAZULWFKMULNLM-INIZCTEOSA-N 378.476 5.178 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1 562168812 LLGSDXUJFZPYII-LQWHRVPQSA-N 393.556 6.086 30 20 GKED Cc1cc(Br)c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)s1 563121111 HEXRGIUCPYXKAH-QMMMGPOBSA-N 395.347 5.129 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)NCC2(C#N)CCC2)nc1-c1ccccc1 569094511 NPYAEAOJDZPJTF-GOSISDBHSA-N 392.503 5.005 30 20 GKED CS(=O)(=O)c1ccc(CSCc2ccc(-c3ccccc3C#N)cc2)cc1 576830072 OETKQOCFNNGIOQ-UHFFFAOYSA-N 393.533 5.062 30 20 GKED C[C@H](CC(=O)N(C)Cc1ccccc1Cl)N[C@H](CCCC#N)c1ccccc1 577881472 AMZLOHKHQDVUFO-XMSQKQJNSA-N 397.950 5.102 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCc2c(CC#N)cccc2C1 599798240 IYGJOQXYHARSFO-UHFFFAOYSA-N 381.907 5.294 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N 600038274 OYECWPKHUSRCKP-NSHDSACASA-N 386.320 5.099 30 20 GKED C=CCOc1ccccc1CN[C@H](C(=O)Nc1ccc(C)cc1)c1ccccc1 600796961 KDTQDNANBJDQHA-DEOSSOPVSA-N 386.495 5.029 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CSc2ccccc2)cc1Cl 603673446 YVMNPNOTWHSPMN-FQEVSTJZSA-N 392.911 5.726 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)[C@H](C)c1ccc(F)cc1 603964620 YISADKZJGZEKGP-MRXNPFEDSA-N 392.430 5.093 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1C 604500332 ZPEQBZOZXHUZGE-UHFFFAOYSA-N 399.494 5.214 30 20 GKED C[C@@H](NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 608481925 AYXATEVBYNOPOZ-GOSISDBHSA-N 382.463 5.066 30 20 GKED CCCOc1cc(C)ccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 609058449 TYFQBVYOXNMWIJ-UHFFFAOYSA-N 390.439 5.080 30 20 GKED Cc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609063022 QCSWEVDKIZOKJI-UHFFFAOYSA-N 376.843 5.351 30 20 GKED COc1ccc(C)cc1NC(=O)[C@H](Sc1ccccc1C#N)c1ccccc1 610206774 NCJKMEASAYESPU-JOCHJYFZSA-N 388.492 5.347 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1cccc(C#N)c1 610361830 LDZRODHPFRXFDM-NWDGAFQWSA-N 379.312 5.223 30 20 GKED N#Cc1ccc(SCc2nnc(-c3c(Cl)cccc3Cl)o2)c(Cl)c1 611102526 SOGYIUZHPDPCGA-UHFFFAOYSA-N 396.686 5.861 30 20 GKED C=CCC[C@H](C(=O)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 681719460 CHMHYMHLOOIWLJ-KMDXXIMOSA-N 377.528 5.363 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1c(Cl)cccc1Cl 730416658 HAVTXXDQANRHOI-MWLCHTKSSA-N 393.270 5.722 30 20 GKED Cc1ccc(C(C)C)c(OCc2nnc(S)n2N=C/C=C/c2ccccc2)c1 730550861 MHJUERVKMALWIE-LLIHPHHJSA-N 392.528 5.125 30 20 GKED CCC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)C1CCCCC1 733080009 PANNLCLLWHPRFB-UHFFFAOYSA-N 377.414 5.316 30 20 GKED C#CCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 733328413 QQZWDGAWMJVVAW-HNNXBMFYSA-N 380.488 5.120 30 20 GKED CCOc1cc(/C=C2\CCOc3c(Cl)cccc3C2=O)cc(Cl)c1O 733749491 XZGPZQWPXFGNLK-XYOKQWHBSA-N 379.239 5.147 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1)c1ccncc1 734681086 XZNOWYOYQPQKDZ-IBGZPJMESA-N 390.314 5.380 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 735366172 MJKLVTJZVPMLCS-NJYVYQBISA-N 379.529 5.138 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cc(Cl)cs2)cc1 737321802 BFTMUUWIJHKXCS-UGSOOPFHSA-N 388.920 5.195 30 20 GKED Cc1cccc([C@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 741396741 RWJCDEBSTOYFOV-NTKDMRAZSA-N 383.495 5.576 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(F)c(Cl)c1)C(=O)C1CCC(c2ccccc2)CC1 744032940 PEZIXXQNFHZCGN-LEOMRAHMSA-N 398.865 5.100 30 20 GKED N#CCC1(COC(=O)[C@@H](Oc2cccc(Cl)c2Cl)c2ccccc2)CC1 744275379 DEOSHUJYUOYWJP-SFHVURJKSA-N 390.266 5.351 30 20 GKED CON=Cc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)cc1 745949630 FYOGJMCEAYTCOA-QGZVFWFLSA-N 378.497 5.132 30 20 GKED O=C(/C=C/c1ccc(-c2cccs2)cc1F)c1ccc(N2CCOC2=O)cc1 748584972 XXGNENZLYXLGTI-JXMROGBWSA-N 393.439 5.407 30 20 GKED N#Cc1csc(/C=C2\SC(=S)N(c3ccccc3C(F)(F)F)C2=O)c1 748662854 XBFZAPSEZBKVES-MLPAPPSSSA-N 396.440 5.044 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\SCc1ccco1 754223209 FTEJBBASJFNFDP-BENRWUELSA-N 390.464 5.638 30 20 GKED C=CC[C@H](NC(=O)N1CC[C@@H](Cc2ccc(C(C)C)cc2)C1)c1ccncc1 764725708 MWJAUNWZCPORNO-REWPJTCUSA-N 377.532 5.096 30 20 GKED C#CCCN(CC(F)(F)F)C(=O)c1ccc(SCc2ccccc2)cc1 767152305 MKFKYSSSNRNEGA-UHFFFAOYSA-N 377.431 5.007 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(O)c(F)c2)cc1Cl 767296988 MHYWKUMCPDSQER-QGZVFWFLSA-N 380.806 5.092 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1ccc(F)c(F)c1 773290784 OHQLJPSSLNRZPM-KPZWWZAWSA-N 387.455 5.252 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(Cl)nn2)cc1 776839044 LYPPKEVQRFRAEC-UHFFFAOYSA-N 397.887 5.453 30 20 GKED C=CC[C@H](C(=O)O[C@H](C)C(=O)Nc1c(CC)cccc1CC)c1ccccc1 778417502 HPAKIPZPMWULNQ-UTKZUKDTSA-N 379.500 5.042 30 20 GKED CCCCCCCCc1nnc(NC(=O)Nc2c(C)noc2C2CC2)s1 782011949 OJRMXVQJULZJRL-UHFFFAOYSA-N 377.514 5.259 30 20 GKED C#CCOc1ccccc1NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 799722214 KXWVQAKWHHSSDI-UHFFFAOYSA-N 385.250 5.253 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(NC(=O)OC(C)(C)C)c(C)c1 800158122 NQWQQDGQBONRPY-UHFFFAOYSA-N 380.488 5.713 30 20 GKED C#C[C@H](NC(=O)c1oc2ccc(CCC(C)=O)cc2c1C)c1ccc(Cl)cc1 812352355 LINGLLPHHDOJKB-FQEVSTJZSA-N 393.870 5.021 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)c(F)c1)c1ccc(-c2cccs2)cc1 844256403 UDRJSLPQOCNWDP-ONNFQVAWSA-N 375.428 5.031 30 20 GKED CC(C)(C)OC(=O)CCCCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 847625889 WLFVUOXHKRIYPJ-ZDUSSCGKSA-N 392.908 5.028 30 20 GKED Cc1ccc(NCc2cc(C#N)ccc2Br)c(OCC(F)(F)F)c1 864006554 JJCCVNVOUDNIQU-UHFFFAOYSA-N 399.210 5.182 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(-c2noc(-c3ccc(C#N)c(Cl)c3)n2)c1 904632807 DPGOYWGNWAVRGU-UHFFFAOYSA-N 396.834 5.276 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccsc2)cc1 915359647 WBKJAJRBKUCDDW-FCHUYYIVSA-N 387.508 5.773 30 20 GKED C=CCc1ccccc1OC(=O)COc1ccc(C2SCCCS2)cc1 916858775 BMEBRCOVEVQLSO-UHFFFAOYSA-N 386.538 5.268 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(C(F)(F)F)c(Cl)c2Cl)ccc1F 1776064677 ZAVIUVWPHGNMSW-UHFFFAOYSA-N 395.139 5.296 30 20 GKED C[C@@H]1C/C(=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776589759 WFLHKILMDDXWBP-YGUCAPNUSA-N 398.458 5.665 30 20 GKED CCCCCCCOc1cccc(CNCC[C@@H](Cc2ccccc2)C(=O)O)c1 1776788696 MUIAVSIPCCSHQU-QHCPKHFHSA-N 397.559 5.459 30 20 GKED Cc1ccc(Br)cc1/C=C1/CCCc2cc(C(=O)O)ccc2C1=O 1777433121 DAQJJWOVUOUSOM-UVTDQMKNSA-N 385.257 5.058 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)c(F)c2)cc1 1777472296 JYUZXJZOJSBMHW-QPEQYQDCSA-N 390.410 5.307 30 20 GKED C[C@@H](Sc1nc2ccc(Cl)cc2o1)C(=O)Nc1ccc(C#N)c(Cl)c1 7769083 GEHZUSMCYQSTPW-SECBINFHSA-N 392.267 5.126 30 20 GKED N#Cc1cccc(NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)c1 18184279 BFRRNMDOSFZQRX-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#C[C@H](C(=O)CCc1ncc(-c2ccccc2)o1)c1nc(-c2ccccc2)cs1 41522692 NCNXKNMNFQHWNT-GOSISDBHSA-N 399.475 5.274 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Cc1ccccc1)c1ccc(C(F)(F)F)cn1 41555061 WHGRWHQNAPQKDF-LJQANCHMSA-N 380.369 5.181 30 20 GKED CSc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66954149 SAJPBCURWRCYQM-LSDHHAIUSA-N 385.558 5.685 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1nc2ccccc2s1 66955230 ROOKPDNEKNFGQM-ZDUSSCGKSA-N 382.514 5.012 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 117317920 XTKUBDAGDDYJDV-RBUKOAKNSA-N 396.581 5.255 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1ccc(C2SCCCS2)cc1 122469419 FOXBTYYMGZHKNW-UHFFFAOYSA-N 385.558 5.236 30 20 GKED C=CCn1c(SCc2nnc(-c3ccccc3)s2)nnc1-c1cccs1 125842926 FFLMVMIZAXACSG-UHFFFAOYSA-N 397.554 5.003 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccccc1 151447503 XBUOSBHQJXJVEQ-HXUWFJFHSA-N 379.485 5.098 30 20 GKED CC[C@H](SC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156556567 CTCQKXCTZLIRIY-RISCZKNCSA-N 385.341 5.435 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccccc1OC(F)(F)F 180201662 ANLNURQFFDGIJN-LBPRGKRZSA-N 380.391 5.089 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 186026006 RZGSPRHMHUZDPK-MRXNPFEDSA-N 376.422 5.232 30 20 GKED COc1cccc([C@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 195633886 XQMHXTQYLWOLEQ-KRWDZBQOSA-N 386.451 5.410 30 20 GKED C[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 246520035 UPSWLNLGVDXRGM-AVCGJXAMSA-N 396.506 5.469 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)CC1 272563298 QYPVTEKUHVWQOX-UHFFFAOYSA-N 390.512 5.045 30 20 GKED N#Cc1c(F)cccc1NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 301172833 FNJFTEHPIJDSLW-UHFFFAOYSA-N 382.442 5.221 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@@H](C)C3)c(C(F)(F)F)o1 411012526 NDNWUGXGLCJJNU-RKDXNWHRSA-N 382.407 5.478 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 425667395 CXOTVLFIHFZKFT-SJCJKPOMSA-N 395.812 5.218 30 20 GKED N#CCCC[C@@H](NCc1nc2cc(Br)ccc2o1)c1ccccc1 433027749 MNGOBURIXMSARY-MRXNPFEDSA-N 384.277 5.115 30 20 GKED CCSCC[C@H](C)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 434287430 KBWGZOXYFSTCCP-KRWDZBQOSA-N 382.529 5.149 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2cc(Cl)cc(C(F)(F)F)c2)cc1 436239507 GVKCWBJCRYKRAD-UHFFFAOYSA-N 383.801 5.278 30 20 GKED CCOc1ccccc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437460684 HOVZYWKYXHSVQG-UHFFFAOYSA-N 376.387 5.141 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1Cl 441384801 YEEAXURCCXVMQD-OAHLLOKOSA-N 387.936 5.057 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 444020736 GGRPQAZZBXYZNV-UHFFFAOYSA-N 382.463 5.116 30 20 GKED N#CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 452139005 LUYDNPRTTCWUET-XUVXKRRUSA-N 386.417 5.360 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(C#N)c1 463592928 SNZPBMZDNZCHSY-AOMKIAJQSA-N 399.881 5.609 30 20 GKED CCS(=O)(=O)c1ccccc1Oc1ccc(Nc2cccc(F)c2C#N)cc1 467005163 IISORYUUROVXQK-UHFFFAOYSA-N 396.443 5.027 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CC[C@H](Cc4ccccc4)C3)ccc21 468970099 LJHZVBFXQJGICD-IFMALSPDSA-N 387.527 5.093 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1)Cc1cccc(F)c1 469003547 QQBBVNXNZZVQTM-XIKOKIGWSA-N 379.262 5.082 30 20 GKED Cc1c([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cnn1C(C)(C)C 469202125 TUBQTPVFNOPAAQ-MSOLQXFVSA-N 386.543 5.897 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1cnccc1C)c1ccc(C(F)(F)F)cc1 474545898 FYJKJSPQYXZIED-IBGZPJMESA-N 391.437 5.258 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(c2cccc3ccccc23)CC1)c1ccccc1 475365329 COOZFXSFNGVUKB-QHCPKHFHSA-N 382.507 5.633 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F 482230433 XLPLHUPNINKXOI-OXJNMPFZSA-N 386.417 5.324 30 20 GKED C=CCN(CC1CCCCC1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 482913850 ZRNPWQDXLUEQBB-UHFFFAOYSA-N 386.923 5.523 30 20 GKED COc1ccc(CN[C@H]2CCC[C@H](c3ccccc3)C2)cc1OCCCC#N 486904104 SCTRFHCPPKPCJA-VXKWHMMOSA-N 378.516 5.194 30 20 GKED N#CCCC[C@@H](NC(=O)Cc1nc(-c2ccc(F)cc2)cs1)c1ccccc1 487202589 AZOIGUDNVWFBFH-LJQANCHMSA-N 393.487 5.043 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccccc1 487452768 AOVXCGLSHSUXJZ-HXUWFJFHSA-N 389.326 5.867 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)c[nH]1 487753318 MMDRUIFKSMJWAC-UHFFFAOYSA-N 389.308 5.089 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)on2)nnc1-c1cccs1 489384343 CHBILKYLLLMSPS-UHFFFAOYSA-N 380.498 5.140 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c(C)n1C 491027086 IKOXGCVKCIQISF-UHFFFAOYSA-N 379.847 5.212 30 20 GKED CCN(CC#N)C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 492179027 AILQHRXIHCTVFH-UHFFFAOYSA-N 384.888 5.364 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1 494020679 ODCSVAYHISQDSP-WOJBJXKFSA-N 376.843 5.142 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1)[C@H](C)c1ccccc1C(F)(F)F 499238393 ZOIASJUHCVUDBX-KBPBESRZSA-N 375.394 5.085 30 20 GKED CC(C)(CNCc1cn(CCC#N)nc1-c1ccccc1)c1cccc(Cl)c1 500113506 VRBKEHYEMIVOJG-UHFFFAOYSA-N 392.934 5.185 30 20 GKED C=CCc1cc(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)cc(OC)c1O 500266927 NMFZOYBARWMONT-LLVKDONJSA-N 384.278 5.426 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@@H]3c3ccc4ccccc4c3)CC2)cc1 503843786 TXPZDLAIWQIAMR-RPBOFIJWSA-N 378.475 5.131 30 20 GKED CC(C)N(C)Cc1cccc(CNC2CCC(C#N)(c3ccccc3)CC2)c1 507661876 XJVCFPJKRZXJBI-UHFFFAOYSA-N 375.560 5.021 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2Cl)o1 509007451 RPJAUGHUFIKIIJ-UHFFFAOYSA-N 391.641 6.031 30 20 GKED Cc1ccc(-c2nc(CCNc3c(C#N)cnc4c(F)cc(F)cc34)co2)cc1 513635880 SKXQKKUOLJPRLG-UHFFFAOYSA-N 390.393 5.003 30 20 GKED CCOc1cccc2cc([C@@H](C)NC3CCN(c4ccc(C#N)cc4)CC3)oc12 513762094 QDDWSSCFHLAUAG-QGZVFWFLSA-N 389.499 5.023 30 20 GKED Cn1c(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c(Cl)c2ccccc21 518709441 XXGGXQCMEZQJKZ-KRWDZBQOSA-N 379.891 5.124 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(Cl)ccc3O)cc2)cc1 518989986 GNCWOAAHSRHXPR-UHFFFAOYSA-N 378.815 5.156 30 20 GKED CN(CC(F)(F)F)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 519049068 SKVOALDJVZOQNO-UHFFFAOYSA-N 379.275 5.146 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3SC[C@@H](C)C#N)s2)o1 519427439 GWAFVMACNZOMMZ-LBPRGKRZSA-N 397.525 5.524 30 20 GKED Cc1cccc(C)c1OC[C@@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 520197571 HKHMGCQTVAARAC-QZTJIDSGSA-N 397.544 5.287 30 20 GKED N#Cc1cc(NC(=O)c2csc(-c3ccccc3Cl)n2)nc2ccccc12 520883996 GOOQVGMWQMRVFC-UHFFFAOYSA-N 390.855 5.136 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N(CC2CC2)CC2CC2)c1 522583524 FBNSEGKUXOXBKF-UHFFFAOYSA-N 380.875 5.266 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c(C)n1 522640364 DLECJBMXMLXQJX-UHFFFAOYSA-N 391.858 5.577 30 20 GKED CC(C)c1ccc(CN(C)C(=O)c2occc2COc2cccc(C#N)c2)cc1 523227540 YNYJUFOGSMZKBQ-UHFFFAOYSA-N 388.467 5.126 30 20 GKED Cc1nc(NC(=O)c2ccccc2OC2CCCCC2)sc1SCC#N 525559758 HTSXRLCUWDCPKR-UHFFFAOYSA-N 387.530 5.031 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2s1 526957530 JGNNYNRJZURNHV-LSDHHAIUSA-N 395.553 6.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccccc2C)C1 530447174 JFYTVKRYYXHPKQ-QFIPXVFZSA-N 378.516 5.452 30 20 GKED C[C@@H](N[C@H](CO)c1cccc(F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 536867411 DECOZUVAALGANX-QLJPJBMISA-N 395.318 5.248 30 20 GKED N#Cc1ccccc1OC1CCC(N[C@H](C[C@H]2CCOC2)c2ccccc2)CC1 537977429 HNFFIMNQMMSSHO-DLQXEOFGSA-N 390.527 5.006 30 20 GKED CCOc1ccc([C@@H](NCc2ccc(C#N)s2)c2cccc(Cl)c2)cc1 538426374 FPSIZSGZBAZCPV-OAQYLSRUSA-N 382.916 5.551 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(COc4cccc(F)c4)c3)cc2)CC1 540736190 SKYNLSKEVKFDTB-UHFFFAOYSA-N 386.426 5.212 30 20 GKED C[C@@H](NC(=O)Cc1c[nH]c2ccccc12)c1ccc(-c2cccc(C#N)c2)cc1 541072443 BFNRBYYZCSMOIQ-QGZVFWFLSA-N 379.463 5.126 30 20 GKED C[C@H](NC(=O)CCC(=O)c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 542100010 VKCBKBNOASDTFD-SFHVURJKSA-N 382.463 5.066 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2C[C@H]3CCC[C@@H](C3)C2)cc1F 554260595 PROQJPFCSNAERZ-HOTGVXAUSA-N 379.435 5.144 30 20 GKED N#CCCC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1 556907887 DOWYKKDGTOIWIF-NRFANRHFSA-N 391.496 5.848 30 20 GKED C[C@@H](NCc1ccc(C#N)cn1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 561349570 WGTCRZPBPPUOMN-CYBMUJFWSA-N 387.430 5.551 30 20 GKED N#Cc1ccc(CNc2ccc(-c3cnc(C4CC4)o3)cc2)c(C(F)(F)F)c1 564410842 WBENWYIDIGTSFL-UHFFFAOYSA-N 383.373 5.722 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCC2(CCCCC2)O1 577562381 LWNIAWYLEMTLFV-SJORKVTESA-N 387.549 5.084 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)Nc2cccc(C#Cc3cccs3)c2)s1 592897910 YDMUFBUPBAKSNT-HNNXBMFYSA-N 395.553 5.446 30 20 GKED N#CC[C@H]1CCCN(C(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)C1 597915772 QPWBAYAWJVTLEN-GOSISDBHSA-N 395.572 5.332 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSc2ccc(F)c(Cl)c2)c1C 603905656 WMRNBZHLFDEBOB-UHFFFAOYSA-N 376.884 5.135 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609499326 JHWRRTRXJRSQES-UHFFFAOYSA-N 390.508 5.657 30 20 GKED C[C@@H](Nc1cccc(CSC2CCCCC2)c1)C(=O)Nc1ccccc1C#N 609741060 YEBSGIZCFXFHMJ-QGZVFWFLSA-N 393.556 5.563 30 20 GKED COc1cccc(-c2nc(CS[C@@H](C)c3ccc(C#N)cc3)cs2)c1OC 609825361 SWILJTZVRMADEG-AWEZNQCLSA-N 396.537 5.693 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](CC1CC1)c1ccccc1 610325859 XBRJPKYEAHSAEN-OXQOHEQNSA-N 379.529 5.601 30 20 GKED C[C@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1cccc(C#N)c1 610586499 RCNNFOLGFIZAHI-HNNXBMFYSA-N 383.442 5.052 30 20 GKED C[C@H](Sc1ccc(Cl)cc1C#N)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 610654780 CSNVLECUQMIQPB-JTQLQIEISA-N 386.820 5.023 30 20 GKED N#Cc1cc2c(nc1N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CCCC2 611227008 QUKKZAVWYKQZAW-WDNDVIMCSA-N 391.359 5.153 30 20 GKED C=CC[C@H]1CCCN(C(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 617789317 FLBNXTKSZGEHDR-AWEZNQCLSA-N 388.920 5.082 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)c2ccncc12 619128593 JYBUBBRSWBOQLN-UHFFFAOYSA-N 396.306 5.157 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)c(Cl)c1 619423372 FMALPYBVDSPUGY-HIFRSBDPSA-N 377.246 5.070 30 20 GKED CC(C)(C)c1nc2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cc2[nH]1 619434527 INOSJYFIWMUNGZ-UHFFFAOYSA-N 387.270 5.291 30 20 GKED C=CCn1c([C@H]2CC[C@@H](C)O2)nnc1N1CCCC[C@H]1c1ccc(Cl)cc1 624841680 JEARTLHJIXBTGB-AYOQOUSVSA-N 386.927 5.089 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(-c2ccccc2OC)n1 682803619 HLEQBPZKPNUTCC-UHFFFAOYSA-N 392.524 5.923 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1c(C)nn(-c2ccccc2)c1C 726425825 JEQPLOPBSZQZHW-UHFFFAOYSA-N 397.404 5.216 30 20 GKED C[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1C(F)(F)F 726476935 NXQSHXZFJNWNOP-SNVBAGLBSA-N 383.826 5.278 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(-n3nc(C)c(Cl)c3C)cc2)cc1 726942521 ZSWKHOBPBHATFM-UHFFFAOYSA-N 392.890 5.011 30 20 GKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 727952935 XWLBGBGBCUPPLJ-ZBFHGGJFSA-N 399.560 5.449 30 20 GKED CCn1nc(C)c(/C=C/C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1C 727974430 KMBRRNUYKKQPNW-MDZDMXLPSA-N 381.457 5.053 30 20 GKED C[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1nc(-c2ccccc2)cs1 730439113 XLDJAZJVLUJAOG-GFCCVEGCSA-N 398.944 5.383 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 730742069 SREOLIAOEXUXND-QZTJIDSGSA-N 377.827 5.083 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)nc2ccccc12 730990149 TVTWSXZAKDVKAV-CYBMUJFWSA-N 381.888 5.392 30 20 GKED O=C1/C(=C\c2ccc3ncccc3c2)CCOc2c(Br)cccc21 733748850 KSYDXQREEAIYCI-QINSGFPZSA-N 380.241 5.046 30 20 GKED C=CC[C@@H](NCc1ccc(-c2ccc(Br)cc2)o1)c1ccncc1 734510607 XYYAIFYWBRYOPG-LJQANCHMSA-N 383.289 5.511 30 20 GKED COc1ccc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)cc1C#N 741849333 WIZDDFFIMHAJEF-SXGWCWSVSA-N 399.219 5.254 30 20 GKED CCOc1cccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 742999874 VKOWAMXSYSFSGN-UHFFFAOYSA-N 389.480 5.558 30 20 GKED N#C[C@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 744010944 UAQDIKXKRXMETE-LEWJYISDSA-N 379.463 5.156 30 20 GKED C=CC[C@@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1ccncc1 762220032 FPQKIYLYZQFXNA-TXQCQQFXSA-N 380.797 5.114 30 20 GKED CC(C)c1ccc([C@H](NC[C@@H](O)c2ccc(C#N)cc2)c2cccs2)cc1 763233812 OQNPTNGHVFOFRQ-GGAORHGYSA-N 376.525 5.156 30 20 GKED C=CCOc1ccccc1CN[C@@H](C)c1ccc(SC(F)F)c(OC)c1 765908460 NJVJWCUGHKFWRQ-AWEZNQCLSA-N 379.472 5.426 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(Br)c(F)c1 767738211 XEGXCJGFNBDWAZ-RQOWECAXSA-N 389.249 5.003 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCCCc3ccc(Cl)cc32)ccc1OC 772984930 GPOOLGMKTCULIN-PZJWPPBQSA-N 398.934 5.587 30 20 GKED COc1ccc(C(=O)/C=C/c2nc3ccc(Br)cc3s2)c(F)c1 773125944 QCVWXRXBCJIJQK-VOTSOKGWSA-N 392.249 5.103 30 20 GKED N#CC1(COC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CCOCC1 780548252 VRLHRYVYDCCDRY-UHFFFAOYSA-N 396.295 5.199 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cnc3ccccc3c2)cc1 784345629 GFALNVVMCFQHKL-QHCPKHFHSA-N 377.447 5.071 30 20 GKED N#C[C@H](C(=O)C1c2ccccc2Oc2ccccc21)c1nccc2ccccc12 792100389 DTSMTYAHNDDOEJ-FQEVSTJZSA-N 376.415 5.349 30 20 GKED CC[C@H](C)n1ncc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1C 792484236 ZKCFNZNULVUBDQ-AWEZNQCLSA-N 393.516 5.084 30 20 GKED CC(C)CN(CCC#N)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 792526138 MZGJPJGPDSNNSQ-UHFFFAOYSA-N 391.490 5.305 30 20 GKED CCc1cccc(C)c1NN=Cc1csc(N(C(C)=O)c2ccc(F)cc2)n1 799495954 YAYRXBMOXULOFK-UHFFFAOYSA-N 396.491 5.284 30 20 GKED Cc1occc1-c1nnc(SCC2(C#N)CCCC2)n1Cc1ccccc1 806584626 NWPIDVFLRIQNAV-UHFFFAOYSA-N 378.501 5.071 30 20 GKED C#Cc1ccc(CNC2(c3ccc(OCc4ccccc4)cc3)CCOCC2)cc1 809620515 RHDRWMAEGIDFOA-UHFFFAOYSA-N 397.518 5.042 30 20 GKED N#CCCCC(=O)Nc1ccc(Nc2ccc(F)cc2F)c(Br)c1 812538484 PSAPLGLVYUAFGE-UHFFFAOYSA-N 394.219 5.103 30 20 GKED Cc1cc(NCc2ccc(C(C)(C)C#N)cc2)ccc1NC(=O)OC(C)(C)C 850415970 AWDCNBWFJSSQEG-UHFFFAOYSA-N 379.504 5.755 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccncc2)n(C2CCCCC2)c1=S 853598018 IBNLKANYQMZPSS-BGYRXZFFSA-N 395.576 5.122 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=C1C(=O)c2ccccc2C1=O 916136603 WABGPJDFDLODCF-UHFFFAOYSA-N 397.261 5.009 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=C[C@@H]1CC=CCC1 916272849 LETLSCHLJFQXKG-CQSZACIVSA-N 383.904 5.277 30 20 GKED COc1ccc(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916627932 DMHIFDZEAGIAKP-VZCJILNPSA-N 394.883 5.362 30 20 GKED Cn1c([C@H](C#N)C(=O)CCCc2ccc(Cl)c(Cl)c2)nc2ccccc21 916844872 HTYCKBCLXJHTSY-CQSZACIVSA-N 386.282 5.079 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)SCc2ccccc2)cc1 916948384 GJFOKMBMKYMMAR-CSODHUTKSA-N 394.540 5.169 30 20 GKED Cc1cccc(C2(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)CCC2)c1 917046188 HFCFYJDHWBFZPG-INIZCTEOSA-N 380.900 5.556 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccc(F)cc1F 918713693 TXOAYQGBUCRHSK-YWEYNIOJSA-N 391.826 5.550 30 20 GKED N#CCCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(CC(F)F)C2)c1ccccc1 922603973 VUKXONBCNRUSPC-GBESFXJTSA-N 375.463 5.029 30 20 GKED CC(C)CC(Cc1ccc(Cl)cc1Cl)=NNc1cccc(C(=O)O)c1 1776036892 MAWUCJZTHAMZDT-UHFFFAOYSA-N 379.287 5.748 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776113173 AMRULKXNDXMYIE-LUAWRHEFSA-N 380.490 5.731 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C/c1ccc(-c2cccc(CC(=O)O)c2)cc1 1776665792 CVFYHOAGAFVIEI-SYXCRGJESA-N 382.459 5.439 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Oc2cccc(OC)c2)cc1 1776784709 LKAHTLOTMZRNIL-HXUWFJFHSA-N 399.531 5.781 30 20 GKED CCCCCCCC[C@@H](C)C(=O)Nc1ccc(C(=O)O)c(Br)c1 1776786016 CAUAMJUZMNPVHW-CYBMUJFWSA-N 384.314 5.473 30 20 GKED C=C(C)CSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 12016218 XAMZPIUKRRJJLA-UHFFFAOYSA-N 380.300 5.561 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Oc1ccc(-c2ccc(C#N)cc2)cc1 15336604 DEELOKHKMSIDQM-GOSISDBHSA-N 384.479 5.755 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)cc1 18229681 MESIQAIOAGNGBY-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1ccc(CCC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)cc1 41136587 HUXGVLSHTRQIFU-OAQYLSRUSA-N 380.900 5.112 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 105017547 JKDYYQYCFFCFLF-UHFFFAOYSA-N 385.895 5.047 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)c1ccc(F)cc1 108359802 DJRANVGVHUTICA-SJORKVTESA-N 399.535 5.099 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nc(-c2ccncc2)cs1 114619707 GSGUVVVBMPYARL-FQEVSTJZSA-N 381.460 5.362 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 116594583 BOIQDQJOBLAVEB-LIRRHRJNSA-N 389.455 5.191 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc(NC(=O)C4CC4)cc3)c2)c1 121736390 DLWKWDNJCVEYEL-UHFFFAOYSA-N 397.478 5.098 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N[C@@H]1CCO[C@@H](c2ccccc2)C1 131197375 FALUPMWRVSRKJA-HYBUGGRVSA-N 398.462 5.001 30 20 GKED CN(C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12)C1(C#N)CCC1 174128747 DFBQSDQYTXNVRD-UHFFFAOYSA-N 398.491 5.030 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(CCC#N)CC3CC3)c(C)c2)n1 176950270 SUNGQZFMBABVJV-UHFFFAOYSA-N 386.546 5.069 30 20 GKED N#CCSc1cccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c1 177445842 SUDIAJCHJNGLAL-UHFFFAOYSA-N 386.436 5.207 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 194089269 DJUFOVJFTCMTEG-UHFFFAOYSA-N 399.475 5.042 30 20 GKED CCn1ncc2ccc(NC(=O)c3ccccc3Sc3ccccc3C#N)cc21 195730928 AZFAMSKVCYIJSN-UHFFFAOYSA-N 398.491 5.331 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3ccc(F)cc3C)o2)cc1 237655002 ASKYHIMHDDELIA-UHFFFAOYSA-N 379.435 5.314 30 20 GKED C=CCN(CC(=O)c1cn(CCC#N)c2ccccc12)Cc1ccc(Cl)s1 302808684 GLFKLXQVKOLAQP-UHFFFAOYSA-N 397.931 5.141 30 20 GKED Cc1cc(C)cc(N=C(O)[C@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c1 328717966 UVJUCZNJHZZCJB-JTSKRJEESA-N 391.515 5.377 30 20 GKED CCS[C@@H]1CCC[C@H](/N=C(/O)c2cc(NC(=O)C(C)(C)C)ccc2F)C1 331103175 DGIDKVRHRLMUTM-DZGCQCFKSA-N 380.529 5.179 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Sc2ccc(OC)cc2)c(Cl)c1 429053989 GPJACJPKWYFGPA-UHFFFAOYSA-N 389.908 5.267 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cncc(F)c1 437042519 IJLOSFWVXXAZDN-MEBBXXQBSA-N 380.307 5.584 30 20 GKED CCCc1c(NC(=O)N2CCC[C@@H]2c2ccccc2)cnn1-c1cccc(C#N)c1 439682606 MQBBZPAOQLGJTM-JOCHJYFZSA-N 399.498 5.065 30 20 GKED C[C@@H](c1cc(F)ccc1F)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443949182 OHUJWPLMZLXVJG-HNNXBMFYSA-N 381.426 5.056 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c(Cl)c1 445008749 QYTIWEJZGYPYBY-RXVVDRJESA-N 397.906 5.431 30 20 GKED C=CCN(CCc1ccco1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1C 446860070 FBUUGEJEPVVURF-GOSISDBHSA-N 380.410 5.022 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 448147952 RVDJIJMTWVQFGC-UHFFFAOYSA-N 384.892 5.384 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](C)c1cccc(C2CC2)c1 451116785 RYTWOFJTHIPSDF-IRXDYDNUSA-N 393.556 5.105 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 455565953 AVTTVPMOSQESAY-UONOGXRCSA-N 392.446 5.999 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCC[C@H]1Cc1ccccc1)c1ccccc1 458804640 SRLGGQKUNGZKPY-XZOQPEGZSA-N 375.516 5.228 30 20 GKED CN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H]1CCC[C@H]1c1ccccc1 458855474 YGNSVRKRGLZNOE-ZRBLBEILSA-N 375.516 5.399 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)[C@H](C)c2cccc(C#N)c2)cc1F 461920171 HSFPEHWSBIPBBQ-OAHLLOKOSA-N 390.414 5.240 30 20 GKED COc1ccccc1[C@H](C)S[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1 463201076 ICPVSRZFBVMHTK-RBUKOAKNSA-N 396.556 5.442 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 464260405 XOGHTYFMRDCSFS-NSHDSACASA-N 382.769 5.075 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@H](C)c2cccc(C#N)c2)C(C)(C)C)cc1 464427348 PSXFTZUSHPGRGT-GOSISDBHSA-N 376.500 5.054 30 20 GKED CCSc1ccc(Cl)cc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464467700 NVHXGABRRZAYCC-CYBMUJFWSA-N 384.810 5.356 30 20 GKED COc1ccc2sc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)c(C)c2c1 464937695 FNEVEEMHTHMFRT-UXHICEINSA-N 390.508 5.130 30 20 GKED C[C@H](NC1CCC(Oc2ccccc2C#N)CC1)c1nc(C(F)(F)F)cs1 467740599 NTJZOZOIXPZYJR-GRTSSRMGSA-N 395.450 5.074 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1ccccc1 474410738 GFURQSDASFJOER-IBGZPJMESA-N 380.451 5.256 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(COC2CCCCC2)c1)c1ccccc1 475253981 HNYHSNQZUZXHTQ-OAQYLSRUSA-N 376.500 5.562 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1cccc(Br)c1 476158565 RUDSFELHXNGJPX-UHFFFAOYSA-N 386.333 5.872 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477539637 HFFGSYLMXVVURZ-AWEZNQCLSA-N 389.421 5.731 30 20 GKED N#CCCC[C@H](NC(=O)CCc1ccc(OC(F)(F)F)cc1)c1ccccc1 487506907 WPKLDCFDKLGHOR-IBGZPJMESA-N 390.405 5.069 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1C#N)c1cccc(Br)c1 487903510 DLUMHCXPHBJCOX-QWHCGFSZSA-N 389.318 5.142 30 20 GKED C=CCN(C(=O)C/C=C/c1ccc(C(C)C)cc1)c1nc(C(=O)OCC)cs1 488284066 VUJPDONUSRHXEU-BQYQJAHWSA-N 398.528 5.066 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccccc1 489024055 KJNIRVLOLMLARP-HSZRJFAPSA-N 379.500 5.181 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1 494379673 WXCYFQKFVZWUEW-UHFFFAOYSA-N 379.435 5.036 30 20 GKED N#Cc1cc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)ccc1Cl 494946935 KSHLXWDDCQLXGO-UHFFFAOYSA-N 388.279 5.170 30 20 GKED C=CCCO[C@@H](C)C(=O)N(CC)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496453861 YMKYHFDBAGNTMP-WMZHIEFXSA-N 380.532 5.124 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2cc(Cl)ccc12)c1c(Cl)cccc1Cl 499797614 IKLRVKIKCROGLM-INIZCTEOSA-N 392.673 5.052 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1ccccc1C 502661758 KOPYENNZBYLTPJ-UHFFFAOYSA-N 377.257 5.117 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1 509549996 RWPUJOUAKOTWIR-GFCCVEGCSA-N 378.259 5.409 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N(C[C@@H](C)C#N)C1CC1 513760366 HVXOHNBXMJCKKH-LBPRGKRZSA-N 386.293 5.067 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 515542763 CVCJFECLWAKXEW-AWEZNQCLSA-N 391.477 5.325 30 20 GKED N#Cc1ccc(NC(=O)[C@H](Sc2cc(F)ccc2F)c2ccccc2)cc1 517355714 QGTKVMJTRVESON-HXUWFJFHSA-N 380.419 5.309 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C)C(=O)N(C(C)C)C(C)C 518009680 IEMYEJOHGOQVJP-SFHVURJKSA-N 379.504 5.105 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCCC[C@@H]1c1ccccc1 518634205 ZBBYUCCYFICCQW-WIYYLYMNSA-N 393.556 5.247 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1c(Cl)cccc1Cl 521808923 QOWHTFKAWCIADF-GFCCVEGCSA-N 394.327 5.709 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccsc3)cc2)c1 521810658 YFJJILLWDNPDRD-NRFANRHFSA-N 389.480 5.781 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C[C@@H]2CCOc3ccccc32)cc1 522744694 IOMCCBVATHFMDZ-KRWDZBQOSA-N 384.435 5.245 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 523091923 DXCVVRFGDPBFML-QHCPKHFHSA-N 385.467 5.163 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3nccc4ccccc34)cc2F)c1 524497702 WLRJEHOIKOFFGJ-UHFFFAOYSA-N 397.409 5.077 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 537584116 BTUSDAXWDCVBRP-UHFFFAOYSA-N 397.478 5.512 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](CCC#N)c1ccccc1 540146779 LPUFVBOPEZQLSR-YWZLYKJASA-N 395.959 6.468 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)c1c(F)cc(F)cc1F 542004336 FLALEIQCJZSYCM-MRVPVSSYSA-N 389.320 5.358 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 553373971 WSGDYMJOACAGMS-UHFFFAOYSA-N 391.474 5.572 30 20 GKED CC(C)NC(=O)Nc1ccc([C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 559867805 VMGNENGVDNXDSR-PGRDOPGGSA-N 378.520 5.302 30 20 GKED C[C@@H]1C[C@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCC1=O 562638405 CKAOBUMDJLUEJL-ZIAGYGMSSA-N 398.915 5.307 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 564441108 NDGMUQSFZQDKPK-CQSZACIVSA-N 378.457 5.032 30 20 GKED N#CC1(CNC(=O)c2ccc(Cl)cc2Sc2ccc(Cl)cc2)CC1 570001613 JXWNWKLDUJQYEG-UHFFFAOYSA-N 377.296 5.178 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)CC2)cc1 583700584 NBAVJMBIYYOUEF-PMACEKPBSA-N 398.428 5.061 30 20 GKED CC1CCC(N(C(=O)CCCCCC#N)c2cccc(N3CCCC3)c2)CC1 588930358 PDNMEGFNWHEHRW-UHFFFAOYSA-N 381.564 5.673 30 20 GKED N#CC1(Cc2nc(-c3ccc(Oc4cccc(Cl)c4Cl)nc3)no2)CC1 590271729 DRLRZXUXIJCEQV-UHFFFAOYSA-N 387.226 5.077 30 20 GKED N#Cc1cccc2c1CN(C(=O)Nc1ccc(OC3CCCC3)c(Cl)c1)C2 593149156 HZSKJYYRVJIOHE-UHFFFAOYSA-N 381.863 5.081 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@]12CCCC[C@@H]1C2(F)F 596790873 SJNJVRHSMPCPPM-GHTZIAJQSA-N 397.425 5.208 30 20 GKED CCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@H]1CCc2ccccc21 609499153 ABRZGOIKLLTSGH-QHCPKHFHSA-N 397.478 5.285 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609641090 QECFCKHDNRNEBT-UHFFFAOYSA-N 396.899 5.124 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)(F)F 609682391 ISGZRSHHGFTHJJ-DYVFJYSZSA-N 393.434 5.363 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2nc3ccsc3s2)cc1 609795428 VVTOZYKNWIISPF-UHFFFAOYSA-N 395.440 5.413 30 20 GKED C[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1cccc(C#N)c1 610360792 GVXYXOSLMWKIPD-SNVBAGLBSA-N 375.280 5.571 30 20 GKED CC(C)n1cccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 677912811 VFNTYNOLBDHQKU-LBPRGKRZSA-N 377.391 5.188 30 20 GKED C=CCOc1ccc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1Cl 678296536 FTNQQDMWVFJLBO-VXGBXAGGSA-N 387.751 5.077 30 20 GKED C=CCN(C(=O)c1cncs1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 685497190 HBYADXHFQJOEPQ-UHFFFAOYSA-N 396.324 5.406 30 20 GKED Cc1ccc(-c2ccncc2)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726492383 SEHVSOFOIALGKT-UHFFFAOYSA-N 378.888 5.391 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3ccc(Cl)cc3)SC2=S)cc1Cl 726626240 BOZINFMRNXYBFN-CHHVJCJISA-N 391.304 5.271 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 729070852 ZLBLOWHDRQMTQY-FZKQIMNGSA-N 389.282 5.225 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\Cc3c(C)cccc3C2=O)cs1 729148798 BCKRNYGSGMENSA-GZTJUZNOSA-N 388.492 5.267 30 20 GKED Cc1ccc(C2CC(=Nn3cnnc3SCc3ccc(Cl)cc3)C2)cc1 729816775 SJQNPWBCJOECCY-UHFFFAOYSA-N 382.920 5.314 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1OC 731113983 BCXWEKNXFRENIC-NVXWUHKLSA-N 383.517 5.220 30 20 GKED COc1cc(Cl)c(-c2csc(NN=C(C)c3ccccc3)n2)cc1OC 731496768 VOWUBBHQQIZTRB-UHFFFAOYSA-N 387.892 5.317 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 732596301 PDNLTSLIJBNXBA-IUODEOHRSA-N 388.414 5.370 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)[C@H](C)Oc1ccc(C#N)cc1 733070403 CSEHGKLEHUFKMO-HOTGVXAUSA-N 392.480 5.062 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](CC)c2ccccc2)c1 733806191 IDNKBGKLWRPUEL-IFMALSPDSA-N 379.504 5.050 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)c2cc3ccccc3s2)c1 733848599 ZCNWEHHAOADFAK-YJBOKZPZSA-N 393.512 5.143 30 20 GKED CC(C)[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 734206411 ZNSAAVMYUWBMNN-XXBNENTESA-N 375.516 5.632 30 20 GKED O=C(/C=C\c1cnc2ccc(Br)cn12)c1ccc(C(F)(F)F)cc1 736409037 BFQWNSOMXKXCDV-SREVYHEPSA-N 395.178 5.012 30 20 GKED Cc1ccc([C@H](C)NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)s1 740058212 UDMISUUTRBCKTM-AWEZNQCLSA-N 381.526 5.217 30 20 GKED C#CCN(C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C)C1CCCCC1 744857755 UVGVAKQBFZPMRG-KRWDZBQOSA-N 381.545 5.157 30 20 GKED Cc1sc(Cl)nc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 764403890 AIRBOUTXKPAVNG-UHFFFAOYSA-N 397.887 5.002 30 20 GKED CC(C)c1cccc2c1OCC/C(=C/c1cnc(-c3ccncc3)s1)C2=O 768489735 GENCHDUXZLBTCT-VBKFSLOCSA-N 376.481 5.377 30 20 GKED C[C@@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1ncc(C(C)(C)C)o1 769547113 SYPWEOISAVUCNF-OAHLLOKOSA-N 379.460 5.149 30 20 GKED O=C1/C(=C/c2cccc(OCCCc3ccccc3)c2)CCc2nc(O)ccc21 769611068 VKQAWKWRSVDGNV-CAPFRKAQSA-N 385.463 5.011 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCCCc3ccc(Cl)cc32)ccc1OC 772984922 GPOOLGMKTCULIN-CTNGQTDRSA-N 398.934 5.587 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)c3ccc(-c4cncnc4)cc3F)cc2)cc1 773977302 XCNZFPXHOVNQJQ-UHFFFAOYSA-N 395.393 5.041 30 20 GKED CC(=O)N1C/C(=C\c2cccc(-c3ccccc3C)c2)C(=O)c2ccccc2C1 778520412 WKSKMVQWZXAUAZ-HZHRSRAPSA-N 381.475 5.290 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1O[C@@H](C)C#N 790927229 RUHLJLWFSKKBCY-HOCLYGCPSA-N 390.405 5.204 30 20 GKED CC(C)[C@H](C=Nn1c(S)nnc1CSc1ccccc1)c1ccccc1 794530623 OOLRQCVIJNLFBO-SFHVURJKSA-N 382.558 5.133 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2ccc(Br)cn2)cc1 794835469 KCQXIXRYMVKYKD-ZIAGYGMSSA-N 395.728 5.387 30 20 GKED CC(C)n1nccc1/C=C\C(=O)c1ccc(Br)cc1C(F)(F)F 794943509 LOZYOWQKHRBLAA-XQRVVYSFSA-N 387.199 5.141 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccc2Cl)CC2CC2)cc1Cl 795114907 GWAFXLRZEXSLRK-UHFFFAOYSA-N 390.339 5.474 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccccc1SCc1cc(C)no1 800156447 QCQFGINHDHASSH-UHFFFAOYSA-N 378.497 5.646 30 20 GKED N#Cc1c(F)cccc1/C=C(/Cl)c1nc2cc(Br)ccc2o1 811694894 VCOTVSNWIIYCGQ-WUXMJOGZSA-N 377.600 5.338 30 20 GKED C=CCCCC(=O)N[C@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21 811952817 FTNIYZZFCXARCE-KRWDZBQOSA-N 388.508 5.108 30 20 GKED N#C[C@H](C(=O)c1sccc1-c1ccc(F)cc1)c1cc(C(F)(F)F)ccn1 813211775 PYCMQACVZGTRLS-HNNXBMFYSA-N 390.361 5.458 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813213613 OMDZQGPGQSSNPZ-MAUKXSAKSA-N 378.419 5.094 30 20 GKED C[C@]1(CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@@]1(F)Cl 844816274 LCAQSQJHPLTXAW-PMACEKPBSA-N 388.895 5.144 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(C(F)(F)F)nc1Cl 856779324 WQMRDPBOEXENBB-LBPRGKRZSA-N 381.829 5.406 30 20 GKED Cc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cccc1NC(=O)OC(C)(C)C 862718957 NETGMUUMAWIHOZ-SFHVURJKSA-N 393.487 5.368 30 20 GKED CC(C)c1noc([C@H](C)OC(=O)c2ccccc2Sc2ccccc2C#N)n1 914886083 LSAZULAEOWAPOE-AWEZNQCLSA-N 393.468 5.134 30 20 GKED N#C[C@H](C(=O)COc1cccc2ccccc12)c1nc(-c2ccccc2)cs1 915102210 OLVHRLDQMCRTMP-LJQANCHMSA-N 384.460 5.219 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2C(F)(F)F)cc1 915180978 UVMRLDCTCLGLAQ-IBGZPJMESA-N 380.369 5.613 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)SCc2ccccc2)cc1 916948396 GJFOKMBMKYMMAR-FIKGOQFSSA-N 394.540 5.169 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccc(Cl)s2)cc1 916950152 RKUOLVGQJLBYCT-DYVFJYSZSA-N 388.920 5.195 30 20 GKED Cc1ccc(OCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 917046711 MLYOBERAGMWECA-OAHLLOKOSA-N 384.888 5.212 30 20 GKED Cc1cc2ccccc2n1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047002 OIRXDBOFLODBSR-OAHLLOKOSA-N 379.872 5.089 30 20 GKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1cc(C(=O)O)c(C)nc1C 1776014739 VKZDVJPPCDWFAO-UHFFFAOYSA-N 386.666 5.193 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Oc2ccc(F)cc2)cc1 1776034582 NNUIVAVSSHZQLK-UHFFFAOYSA-N 398.821 5.806 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)cc2)cc1 1776125590 MPBLWJHSVGBRFQ-VUZIPCMWSA-N 380.484 5.876 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3ccc(-c4ccccc4)cc3)c2c1 1776131435 QVFWLFAKVXBZQL-BENRWUELSA-N 384.456 6.163 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(C)c(Br)s1 1776784031 OPHYHENFYRUCPB-CYBMUJFWSA-N 376.360 5.112 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2cncc(C(=O)O)c2)cc1 1776785618 TXCGVTCWLWGVRG-JLHYYAGUSA-N 381.472 5.415 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4nc(Cl)ccc4C3=O)s2)c1 1777684350 USADUHHOOVFMPM-ACCUITESSA-N 395.867 5.374 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Br)cc1F 25721612 CFZUFXAZCNLDCW-UHFFFAOYSA-N 395.231 5.379 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccccc3SCC#N)cc2)cs1 29104037 HKGDTVMSCYYBGA-AWEZNQCLSA-N 393.537 5.225 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(-c3ccc(C)o3)n2)n1 32327797 QPRCOAPBBCDFMN-UHFFFAOYSA-N 395.431 5.598 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(SCc2cccnc2)cc1 32468168 KGUXBEKYCQCESV-UHFFFAOYSA-N 376.481 5.191 30 20 GKED CN(Cc1ccco1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 47565567 JNVDZQVHKRXIIR-LJQANCHMSA-N 379.847 5.252 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccnc2ccccc12 68054037 VUXNGADSHSURFU-OAHLLOKOSA-N 393.537 5.217 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(Cl)cc1Cl 78714758 YYQBEOGAYJLMJQ-GFCCVEGCSA-N 394.327 5.567 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(C)cc(C)c2)cs1 107066873 SIGJERYMXNWODE-JXMROGBWSA-N 390.508 5.649 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(-c3cccc(Cl)c3)nc2C)s1 108399215 KGTLTNGCDGLOBN-UHFFFAOYSA-N 387.917 5.520 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 109160208 CHMOALUCQOTAFY-INIZCTEOSA-N 387.439 5.281 30 20 GKED N#C[C@@H](C(=O)c1nccc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 113656878 VHJQFHOJDKZZDD-AWEZNQCLSA-N 391.402 5.127 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(Br)cc1F 130202861 GIPMTXBFFZBMQZ-FNORWQNLSA-N 389.249 5.003 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 161973576 BAFZNRMVDXCVIA-CYBMUJFWSA-N 384.892 5.095 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)CCc1ccc(Cl)cc1 172226338 ZBZLGZHADRGJOA-OAHLLOKOSA-N 387.936 5.441 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C[C@H](C)c2cccc(C(F)(F)F)c2)n1 177765108 CKANHGGQAGLZCO-SWLSCSKDSA-N 380.435 5.655 30 20 GKED N#C[C@H](C(=O)c1ccc2cc(Br)ccc2c1)c1nc2ccccc2o1 178845553 ZIUGRHWLMVREMA-MRXNPFEDSA-N 391.224 5.234 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 180559262 QEQHHYHBSCKRKK-OAHLLOKOSA-N 393.468 5.076 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1cccc(N(C)C)c1 191515812 IERNNNUJHBNGMB-QHCPKHFHSA-N 391.559 5.974 30 20 GKED COc1ccc(-c2nc(CSCCCC3(C#N)CCOCC3)cs2)cc1 281833757 LBWUOLDOSZCLJV-UHFFFAOYSA-N 388.558 5.152 30 20 GKED Cc1ccc(N(CC(=O)Nc2ccccc2SC[C@H](C)C#N)C(C)C)cc1 303420019 YBRMYFQEOHCALI-GOSISDBHSA-N 381.545 5.100 30 20 GKED C[C@H](NC(=O)Nc1ccccc1CN(C)c1ccccc1)c1ccc(C#N)cc1 433768276 ZDKIOKRIIFRKRI-SFHVURJKSA-N 384.483 5.077 30 20 GKED Cc1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1C 434028011 OYPXFCWHXXQYDQ-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C[C@H](S[C@@H](C)c1nc(Cc2ccc(Cl)cc2)no1)c1ccc(C#N)cc1 437274469 ICLJKZYGLDQBEZ-KBPBESRZSA-N 383.904 5.741 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1 438826967 HFRXZSRYFJUFHA-UHFFFAOYSA-N 399.281 5.228 30 20 GKED C/C=C\COc1cccc(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 448936378 FZVAULRSUGTFGD-LIMHQNJXSA-N 380.513 5.074 30 20 GKED C=CCC1(C(=O)Nc2cccc(C[S@@](=O)Cc3ccccc3)c2)CCCC1 449880886 QEVDHZYRMNJTBD-MHZLTWQESA-N 381.541 5.211 30 20 GKED O=C(CC1CC(F)(F)C1)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 450970742 NGZGWYTVJPWZCU-GFCCVEGCSA-N 389.286 5.251 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N[C@H]5CC[C@@H](CC#N)C5)(C4)C2)C3)cc1 452561479 BBEAZWIINMRERV-IZBXZDELSA-N 376.544 5.032 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 464944443 OTAPKEUACLRIJM-HDAAZOAOSA-N 398.428 5.107 30 20 GKED CC(C)C[C@@H]1CCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 465317975 OVOQJPNIRRIOMS-FQEVSTJZSA-N 378.541 5.359 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 467826044 JTFDCPGOEDAACU-KRWDZBQOSA-N 377.488 5.276 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCSc4ccc(F)cc43)ccc21 468845850 DWVFTHZEDLXIMA-LJQANCHMSA-N 395.503 5.058 30 20 GKED CCC[C@H](CNc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 468893080 IBGZXMQFHPIGSX-OAQYLSRUSA-N 375.516 5.265 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 470532004 IEBQPDQJBDWPSS-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)nn1C 471260664 QTOPWJUJEDWSTK-UHFFFAOYSA-N 394.862 5.113 30 20 GKED Cc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cccc1NC(=O)c1ccccc1 475016511 KPDTUIVMLYTSKB-OAQYLSRUSA-N 397.478 5.273 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2cccnc2)cc1 475736872 BCROOPPDGVCMGQ-AWEZNQCLSA-N 376.847 5.156 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)cc1F 484092224 KLUISVBTKFPJEA-HNNXBMFYSA-N 376.275 5.109 30 20 GKED COc1ccc(Cn2ccnc2SCc2ccccc2C(C)(C)C#N)cc1 488784109 LEQWAFWAVDXZMG-UHFFFAOYSA-N 377.513 5.033 30 20 GKED CC(C)(C)c1cc(NC(=O)Nc2cccc(OCCCC#N)c2)n(C(C)(C)C)n1 502494732 ORBTVKWMHGUTEV-UHFFFAOYSA-N 397.523 5.262 30 20 GKED N#C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1F)c1ccc(Cl)c(Cl)c1 505922308 GDIQIOYOARPGMN-CQSZACIVSA-N 391.151 5.146 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3coc4ccccc34)cc2)cc1 510419732 LERNIDOXCCSEHD-UHFFFAOYSA-N 382.419 5.221 30 20 GKED N#CCCCOc1cccc(NC(=O)C2c3ccccc3Oc3ccccc32)c1 518058716 ALRSNEGQIBPULL-UHFFFAOYSA-N 384.435 5.245 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1Cl 518677456 PCFZVLNLSVRINX-HXUWFJFHSA-N 378.863 5.452 30 20 GKED CCN(Cc1cccc(Cl)c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 518756760 HURACTOQYRUIPS-OAHLLOKOSA-N 387.936 5.788 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)C[C@@H](C)C2 520113547 PFKXKEBMEBWDKB-KHFMLZDKSA-N 399.494 5.182 30 20 GKED Cc1cc(C)c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c(C)c1 522575323 VYJIENVQRBZMHF-UHFFFAOYSA-N 390.870 6.182 30 20 GKED CSc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 524456762 LIGAPMTUICTDIR-UHFFFAOYSA-N 392.455 5.251 30 20 GKED C=CCN(C(=O)c1cc(C(CC)CC)no1)c1nc(-c2ccccc2)cs1 525006280 MTQCIAIWUKNRNK-UHFFFAOYSA-N 381.501 5.535 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccc(OC)c(Cl)c1 535689521 JPARLIDKOVDHDK-UHFFFAOYSA-N 385.920 5.009 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 537947539 YFYWPKDWFWEXML-IIBYNOLFSA-N 380.438 6.137 30 20 GKED COC(=O)c1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)c1 548423063 SNUMIWLTIMTSMT-INIZCTEOSA-N 388.442 5.002 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCC(C)(C)CCC#N)c(C)c2)n1 554423310 BMTNXJXIMAJDSC-UHFFFAOYSA-N 388.562 5.363 30 20 GKED COc1cccc(C(=O)CCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 555994708 XHSZVGNTQGTCBV-INIZCTEOSA-N 396.512 5.081 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1cccc(Cl)c1SCC(F)F 563877774 JOJYYPXSFWBGOX-UHFFFAOYSA-N 375.872 5.149 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1ccc(F)c2ccccc12 565414106 BEICIFHFBSJFRM-KRWDZBQOSA-N 387.458 5.309 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)N(Cc1ccccc1)c1ccccc1C#N 573711101 DGEZCGTUNDPEIO-UHFFFAOYSA-N 393.446 5.369 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)s1 576023569 VZLDXLILOOKUAA-KRWDZBQOSA-N 386.318 5.031 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc([C@@H]2CCOC2)cc1 579557975 GTPBCHKZSRTBMA-NVXWUHKLSA-N 381.501 5.229 30 20 GKED CCC[C@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 602229698 ROIQUUCNZKTXCV-FQEVSTJZSA-N 375.497 5.128 30 20 GKED C[C@H]1CCCC[C@@H]1CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 604441504 HUOHUGPAAZSQRW-AZUAARDMSA-N 376.500 5.487 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H](C)Oc2cccc(Cl)c2Cl)c1C#N 609032534 MMSDGUCJHMSIEH-SECBINFHSA-N 383.300 5.203 30 20 GKED N#CCn1c(C(=O)Nc2nc(-c3cc4ccccc4o3)cs2)cc2ccccc21 609200741 YXUDJWXFLZPTMW-UHFFFAOYSA-N 398.447 5.287 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 609634132 JQDKHGVYIYHXQB-UHFFFAOYSA-N 377.400 5.149 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccc(F)c(F)c1 609642052 XKMZQWDDCSLNBH-UHFFFAOYSA-N 392.405 5.082 30 20 GKED N#Cc1c(NC(=O)Cc2c[nH]c3ccc(F)cc23)sc2c1CCCCCC2 609642443 WMGPNBFQPZHJHK-UHFFFAOYSA-N 381.476 5.080 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCC3CCOCC3)n2)o1 609782900 UGIYHTVLCWOXFV-UHFFFAOYSA-N 382.407 5.059 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(F)c1 610224535 WZXKUVFHLABSAE-BTYIYWSLSA-N 392.861 5.877 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)ccc1OCCC(C)C 613290359 DEUUCJZUANZBKY-LJQANCHMSA-N 388.467 5.158 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(OC(C)C)c(Cl)c1 615497407 KIXNKYFRZNLFDT-UHFFFAOYSA-N 388.895 5.356 30 20 GKED CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622851952 PCHBPCOLRHSFDD-NSHDSACASA-N 389.286 5.144 30 20 GKED C=CCN(C(=O)[C@H](C)Oc1cccc(C)c1)c1nc(-c2ccccc2)cs1 641900483 PQCCZRWNXYNWBH-KRWDZBQOSA-N 378.497 5.105 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2sc3cccc(Cl)c3c2Cl)nc(C)n1 642282565 GHGSIPUTEPXGBU-SNVBAGLBSA-N 376.268 5.105 30 20 GKED Cc1cccc2sc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)c(Cl)c12 643779407 TVDLTQPCXHNXEX-LLVKDONJSA-N 394.805 5.767 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)c1ccc2ccccc2n1 727629538 SQTZTSCDZKEJAE-KRWDZBQOSA-N 380.369 5.162 30 20 GKED CCc1c(C)sc(NC(=O)c2cc3c4ccccc4n(C)c3s2)c1C#N 727790769 QXPJHPHIPRLQMA-UHFFFAOYSA-N 379.510 5.449 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2C)n1 728062535 MECQYNZECUOCGO-KRWDZBQOSA-N 390.487 5.344 30 20 GKED N#Cc1cccc(OCC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)c1 728485820 ZPYBZNQRRTVBJL-UHFFFAOYSA-N 380.806 5.035 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 730193531 KXZNWYFPNUTKOP-XFXZXTDPSA-N 399.450 5.626 30 20 GKED Cc1ccc(C2=CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)CC2)cc1 731400155 LJONGCNOXHWWQV-SFHVURJKSA-N 391.540 5.711 30 20 GKED N#CCSc1ccccc1C(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1 732134180 OWVJFROYZIDWME-UHFFFAOYSA-N 394.496 5.040 30 20 GKED C/C(=C\C(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 733259096 RBWYKPLVJYAQRM-DPCFLFMUSA-N 378.781 5.143 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@H](C)c1ccccc1 733808052 YMZZACIJEDTQLN-KNQAVFIVSA-N 393.531 5.440 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(C)c(C(F)(F)F)c2)c1 733843663 TYCJMQCPKYRCBB-INIZCTEOSA-N 391.393 5.017 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 737479527 WPHIGJLDAFKUJN-NSHDSACASA-N 397.780 5.023 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C 740449275 VTCRRULBELCKON-UHFFFAOYSA-N 387.524 5.194 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cn3cc(Cl)ccc3n2)cc1 741469036 JHKHNVXYJSVGSF-VAWYXSNFSA-N 388.854 5.559 30 20 GKED C[C@H](NC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1cccc(C#N)c1 743776780 HAVMNGJRKSCKTG-NPRIEWAGSA-N 376.456 5.177 30 20 GKED N#CCCn1cc(C=NOCc2ccc(C(F)(F)F)cc2)c(-c2ccccc2)n1 746576611 LRBDJAXQUDYJRZ-UHFFFAOYSA-N 398.388 5.033 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747198479 XNEYPZRCVIJQRG-GOSISDBHSA-N 382.529 5.448 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cc(C)c(Cl)cc2OC)cc1 756234533 VRPHPHGRPPHNIL-DYVFJYSZSA-N 398.890 5.132 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(OCc2ccc(F)cc2)cc1 773367446 KFHMFMHSGTUBMF-KRWDZBQOSA-N 376.431 5.308 30 20 GKED C[C@H](NCc1ccc(COCc2ccccc2)cc1)c1ccc(OCC#N)cc1 776153764 HOANVBHNSXBUOM-FQEVSTJZSA-N 386.495 5.157 30 20 GKED Cc1cccc(Cl)c1CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 790766409 BAMAJOKITKRMLL-QGZVFWFLSA-N 391.883 5.063 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Nc2ccc(O)c(Cl)c2)cc1 792733342 VAXNIXBHRHUOCS-SFHVURJKSA-N 377.831 5.345 30 20 GKED N#CC1(CCCOC(=O)c2ccc(-c3ccc(Cl)cc3)s2)CCOCC1 800110624 MWZMLBIOPLZIBD-UHFFFAOYSA-N 389.904 5.326 30 20 GKED C[C@@H](NCc1cccc2c1CCCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1 806181060 KLBZPJUMIVSLHD-QGZVFWFLSA-N 391.515 5.097 30 20 GKED Cc1ccc(-n2c(SCC3(C#N)CCCC3)nnc2-c2ccncc2)cc1C 806582551 QLDAGBNZVPQZOG-UHFFFAOYSA-N 389.528 5.122 30 20 GKED Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1CNCC(C)(C)CCC#N 808429984 RQWLEKKXFNUWKQ-UHFFFAOYSA-N 398.860 5.273 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)/C=C/c3nc4ccccc4s3)cc2)ccn1 810822774 SXWMGAPTNBGYIB-MDZDMXLPSA-N 398.447 5.007 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1 846958517 UBNOEZHODHFEJP-CQSZACIVSA-N 388.389 5.057 30 20 GKED Cc1ccc(-c2cc(C(=O)N3CCC[C@@H](CC#N)C3)c3ccccc3n2)c(C)c1 855260294 VUJVCHDVXUULDB-IBGZPJMESA-N 383.495 5.285 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(N3CCCC3)c(Cl)c2)c1 864011830 FXOLFCSIGVKXHA-UHFFFAOYSA-N 390.712 5.186 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1cc(-c2ccco2)nc2ccccc12 917404881 NZHGZGRCCKACMR-UHFFFAOYSA-N 384.439 5.175 30 20 GKED C=CCn1c(C2CC2)nn(CN(C2CC2)[C@@H](C)c2ccc(Cl)cc2)c1=S 920306383 ZDARDCQLUCGHNS-AWEZNQCLSA-N 388.968 5.314 30 20 GKED CCC(=NNc1nc2ccccc2s1)c1ccc(OCCCCC(=O)O)cc1 1776015045 CLCCHOOPICQKCM-UHFFFAOYSA-N 397.500 5.156 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cs1 1776280396 DVTNKEBLITWMGK-VMPITWQZSA-N 397.452 5.001 30 20 GKED CSc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c(Cl)c1 1777403293 LNXFXCHKKGTMHY-QHHAFSJGSA-N 388.897 5.871 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccc2oc(C(=O)O)cc2c1 1777488285 UWFRMGUKFLPYNQ-CLFYSBASSA-N 389.432 5.459 30 20 GKED C=CCn1c(SCc2cn3cc(C)ccc3n2)nnc1-c1ccc(Cl)cc1 5692043 PHYFZPXGAHZVEF-UHFFFAOYSA-N 395.919 5.033 30 20 GKED COc1cc(Br)c(/C=C/C(=O)c2ccc(Cl)s2)cc1OC 7741719 REKCDBOHHTXXCG-ONEGZZNKSA-N 387.682 5.077 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1/C(O)=N/c1nnc(C2CC2)s1 26362581 WSDGRAMZMKOPCK-UHFFFAOYSA-N 376.894 5.137 30 20 GKED COCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 41514884 YXGMHLJXYXIQKQ-QGZVFWFLSA-N 382.872 5.100 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)cc1)c1nc(-c2ccccc2)cs1 41536293 WWKRJPFIDDAHAX-HNNXBMFYSA-N 383.270 5.063 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 105763812 AFPYVERHHVWWII-UHFFFAOYSA-N 397.265 5.275 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cc(F)ccc1F 108529444 MCJHBEIIZILQFS-UONOGXRCSA-N 389.471 5.441 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)cc1 110251933 IGXOKYLNOOYIDS-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#C[C@H](C(=O)c1cccn1Cc1ccccc1)c1nc2cc(Cl)ccc2s1 120031942 FXSHGIZNIPQHOR-MRXNPFEDSA-N 391.883 5.290 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(F)cc1F)c1nc(-c2ccc(Cl)cc2)cs1 120112426 NBSWAPSCPCJNPK-HNNXBMFYSA-N 388.826 5.161 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CC/C=C/c3ccccc3)n2)cc1 122013481 WHVZNIZXTJIRSG-MRSBXDGLSA-N 388.492 5.489 30 20 GKED CCCC(=O)Nc1cccc(NCc2ccc(OC)c(OCCCC#N)c2)c1C 157551898 ZJSMAMMKXDXBKP-UHFFFAOYSA-N 395.503 5.037 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](CC)c2ccc(Cl)s2)ccc1OC 180812459 AEHVZZASDSLWIY-GJZGRUSLSA-N 378.925 5.332 30 20 GKED N#Cc1cc(NC(=O)c2ncccc2C(F)(F)F)ccc1Oc1ccccc1 187155868 VYGBDELLHUMGBS-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cc(F)c(F)c(F)c1 191495924 BFPFYAVGSOWHSC-UHFFFAOYSA-N 376.422 5.620 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)cc1F 211155489 NUKHKUYFJPEFKS-FLIBITNWSA-N 397.808 5.767 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2sc(-c3ccccc3)nc2C)cc1OC 237331772 UZXHWEQMPQXAEX-INIZCTEOSA-N 394.540 5.543 30 20 GKED COc1ccc(CNC2(c3ccccc3)CCCCC2)cc1OCCCC#N 237346387 AZRNKJVTCFNIEQ-UHFFFAOYSA-N 378.516 5.327 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC[C@@H]1c1ccccc1 246626992 AOBRUPKXFLWELY-GGPKGHCWSA-N 393.556 5.596 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(Oc2ccccc2)c(F)c1 255597297 QYKYTECGOMAKEW-CLFYSBASSA-N 390.336 5.273 30 20 GKED O/C(COc1ccsc1Cl)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329079228 BYESPTQCUDIBDO-CQSZACIVSA-N 379.913 5.126 30 20 GKED O/C(=N\C1CCC(/C(O)=N\CC2CCC(c3ccccc3)CC2)CC1)C1CC1 330025286 KJVYBFTZRMPXDA-UHFFFAOYSA-N 382.548 5.842 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@H](C)C3)c(C(F)(F)F)o1 411012524 NDNWUGXGLCJJNU-DTWKUNHWSA-N 382.407 5.478 30 20 GKED C=CCC[C@H](NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1)c1ccccc1 426114919 WETYMKROVVJPSB-QHCPKHFHSA-N 396.506 5.224 30 20 GKED N#CCCn1cc(/C=C/c2ccc3ccc(Cl)cc3n2)c(-c2ccncc2)n1 432709228 RMTOQMFHZPFQBO-QPJJXVBHSA-N 385.858 5.231 30 20 GKED N#Cc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)c(Cl)c1 439453076 NRXXUKWCSZGLNV-OAQYLSRUSA-N 382.294 5.334 30 20 GKED C[C@H](Sc1ccccc1C#N)c1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 439698503 XOCSRHSUTAUIKG-NEPJUHHUSA-N 381.526 5.247 30 20 GKED C[C@H]1CCc2c(sc3nc([C@H](C)Sc4ccccc4C#N)nc(O)c23)C1 439698510 XOCSRHSUTAUIKG-RYUDHWBXSA-N 381.526 5.247 30 20 GKED C[C@H](NCCCCC(C)(C)C#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1 444680433 OVNQBCZECAICGA-KRWDZBQOSA-N 381.495 5.449 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)CCCc2csc3ccccc23)cc1 445677673 AFJXIQLKYNCOPD-UHFFFAOYSA-N 393.512 5.170 30 20 GKED C=CCOc1ccc(CNc2ccc(C(=O)Nc3ccccc3)cc2)cc1OC 446885625 AESSFOPUJIXECJ-UHFFFAOYSA-N 388.467 5.124 30 20 GKED C[C@@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(Oc2ccccc2)c(F)c1 454285750 HFFRUAQDWSKNOW-RYRKJORJSA-N 381.451 5.061 30 20 GKED N#Cc1cccc(-c2nnc(COc3ccc(Cl)cc3C3CCCCC3)o2)c1 462570216 WVNCXWXMVWXWGZ-UHFFFAOYSA-N 393.874 5.888 30 20 GKED COc1ccc([C@H](N[C@@H]2CCC[C@H](C#N)C2)c2ccccc2Cl)c(OC)c1 463241805 FEOZMECIBDUCQN-WJONJSRFSA-N 384.907 5.119 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1CC2)c1cc(C(F)(F)F)ccn1 464407179 PBRDRHRTXMRWHO-MRXNPFEDSA-N 398.409 5.418 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 470646507 KVQINMAHOKIBDI-UHFFFAOYSA-N 394.902 5.533 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(-c2ccc3c(c2)CCO3)c1 476148794 MXJNZMARMMMLAN-UHFFFAOYSA-N 398.506 5.788 30 20 GKED C=CCOc1ccccc1CNC(=O)N(Cc1cccc(C)c1)Cc1ccco1 477592523 XVWVXAXXDMKWBP-UHFFFAOYSA-N 390.483 5.065 30 20 GKED C=CCCC1(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)CC1 483167661 JSEWSXAYDOZCJD-UHFFFAOYSA-N 384.911 5.010 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1nccc2ccccc12 483218941 RGXTYNNIJHROBY-QGZVFWFLSA-N 389.867 5.502 30 20 GKED C[C@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487457487 ZSWQFTACRDYBFM-KXBFYZLASA-N 385.305 5.104 30 20 GKED C=CCOc1ccc(-c2nnc(SC[C@@H](OC(C)C)c3ccccc3)o2)cc1 488253559 UFRKEFUBENCEDE-HXUWFJFHSA-N 396.512 5.560 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)NCC(C)C)c(Cl)c1)c1ccccc1 488684591 JVBWQKPEQVSWNW-SFHVURJKSA-N 384.907 5.024 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)CSc1nc(C(F)(F)F)ccc1C#N 488734452 NTBSIWZIUADJRI-UHFFFAOYSA-N 393.434 5.135 30 20 GKED Cc1ccc2nc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)ccc2c1 496406422 GDFIADZASXQICK-CQSZACIVSA-N 377.856 5.296 30 20 GKED C=CCN(CCc1ccco1)C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 498160633 DFTFFBCZVHGAPC-MRXNPFEDSA-N 395.528 5.213 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCc4ccccc4C3)cc2)c1 499876010 XSRCXOZACZMHCA-UHFFFAOYSA-N 383.451 5.331 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)CCCc3c[nH]c4ccccc34)n2)c1 501116169 JGBOBNAZXIMDJQ-UHFFFAOYSA-N 386.480 5.124 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2csc(Br)c2)CC1 507657272 BOMVRTAOMDTMAQ-UHFFFAOYSA-N 375.335 5.004 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 509668414 TXVJPQHSOILJKG-ZBFHGGJFSA-N 388.389 5.658 30 20 GKED N#C[C@@H](NC(=O)c1cccc(COc2cccc(F)c2)c1)c1ccccc1Cl 510277454 QLZVRGWYVSVQMH-OAQYLSRUSA-N 394.833 5.053 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 510583150 WIALBTNDUMNATA-UHFFFAOYSA-N 383.476 5.704 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 510644678 KKOCOEQWZKZCHA-GOSISDBHSA-N 377.469 5.685 30 20 GKED CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510659074 BQWXNRXFNAEAMZ-UHFFFAOYSA-N 377.469 5.466 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1oc2ccccc2c1COc1ccccc1 517645938 NUTJJPMFIKOBAC-UHFFFAOYSA-N 390.483 5.414 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 517652420 SCIYWQBPWKWUEH-IBGZPJMESA-N 393.537 5.115 30 20 GKED Cc1nc(-c2ccc(NC(=O)CCCCOc3cccc(C#N)c3)cc2)cs1 518373421 VNFXVYVNTFNVOJ-UHFFFAOYSA-N 391.496 5.178 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1c(C)cc(Br)cc1C 521215440 GSJVBAMNJGFFMP-UHFFFAOYSA-N 393.350 5.025 30 20 GKED COc1ccc2c(c1)c(C(=O)Nc1cccc(C#N)c1)c(C)n2Cc1ccccc1 524250295 QCASJBYEMUYDMH-UHFFFAOYSA-N 395.462 5.131 30 20 GKED C[C@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524441103 RYPILRWHDOPDNT-HNNXBMFYSA-N 383.879 5.197 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2cccc(CSC3CCCC3)c2)CC1 525448355 ZBVIDBJKYOLHAQ-UHFFFAOYSA-N 387.593 5.024 30 20 GKED C=C[C@@H](CC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 535370056 KBILPRIXHSMWBA-KSFYIVLOSA-N 379.550 5.644 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1c(F)cccc1Br 538939092 OSBYARQXAQKNAO-UHFFFAOYSA-N 398.235 5.259 30 20 GKED N#CC1CCN(C(=O)N[C@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)CC1 538972505 FYHNUWNDQGGPBY-MJGOQNOKSA-N 393.453 5.067 30 20 GKED CCCN(C(=O)c1ccc(C#N)s1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 539657615 QFNYFTXTWPSJHB-NRFANRHFSA-N 393.487 5.104 30 20 GKED COc1ccccc1CN(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543016168 BECNNSVDVLDGAW-SFHVURJKSA-N 399.494 5.136 30 20 GKED Cc1ccc(C(C)(C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cn1 545423611 KMWDHWJYLFFNIZ-UHFFFAOYSA-N 386.455 5.111 30 20 GKED N#CCc1cccc(-c2nc(-c3ccc(NC(=O)Nc4ccccc4)cc3)no2)c1 547039153 FWZQXZMJXHLOLE-UHFFFAOYSA-N 395.422 5.114 30 20 GKED CN(Cc1ccccc1NC(=O)c1cc(C#N)ccc1Cl)c1ccccc1 560692313 WTBLOJLFWDGKPU-UHFFFAOYSA-N 375.859 5.100 30 20 GKED Cc1ccccc1-n1c(SCC2(C#N)CC2)nnc1-c1c[nH]c2ccccc12 562140661 FDIGNLBTSMKFGZ-UHFFFAOYSA-N 385.496 5.120 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCSC4(CCC4)CC3)cc2)cc1 572704443 MLGWYAWZFAEBLB-UHFFFAOYSA-N 393.512 5.244 30 20 GKED C=C[C@](C)(CCOC)c1nc(-c2ccnc(Oc3ccc(C)c(C)c3)c2)no1 572800422 YWSDIYQDOAAXRJ-JOCHJYFZSA-N 379.460 5.021 30 20 GKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)cc2c1 573969812 BAZDCBNPQUHWFL-HNNXBMFYSA-N 375.478 5.218 30 20 GKED N#Cc1ccc(Oc2cc(C(F)(F)F)nc(-c3ccncc3)n2)c2ccccc12 574645534 WXSJVBJCZKKCFU-UHFFFAOYSA-N 392.340 5.375 30 20 GKED C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 588438933 RQVJMBISXBMLDD-PLFFATQSSA-N 381.457 5.031 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1 603900327 CALMSFOJPXOJMX-KKSFZXQISA-N 386.948 5.171 30 20 GKED Cc1sc(NC(=O)[C@H](C)Sc2ccc(Br)cc2)c(C#N)c1C 603946836 DKXCONSVKHTZAC-NSHDSACASA-N 395.347 5.118 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)CC(C)(C)C 604005317 XAGLHCWQUJQMCZ-SFHVURJKSA-N 378.516 5.733 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC[C@@H](C(C)(C)C)CC2)cc1 604798733 RTZUTTVDUUYXIH-HXUWFJFHSA-N 397.563 5.181 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(Oc4ccc(F)cc4)cc3)[nH]c12 605363559 JTYWRWSUIIQWAI-IBGZPJMESA-N 385.398 5.293 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(C(=O)N(CC)CC)c(Cl)c1 606937814 OWZGFHLWCRVHTQ-UHFFFAOYSA-N 379.932 5.032 30 20 GKED C=CCN(Cc1ncc(-c2ccccc2Br)o1)Cc1cccs1 607725549 HWADQUJPPZSLGZ-UHFFFAOYSA-N 389.318 5.354 30 20 GKED Cc1ccc(CN(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)C(C)C)s1 609058690 KYNZLENBFGRIMD-UHFFFAOYSA-N 394.496 5.151 30 20 GKED COc1ccc(Cl)cc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609064397 SWKNIXHOBVJRNY-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CN(C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)c1ccc(C#N)cc1F 609298639 NIXRFXLPJYCCFX-UHFFFAOYSA-N 382.797 5.433 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCOc1ccc(Cl)cc1 609428629 YDBUQFNAIILZNK-HNNXBMFYSA-N 388.920 5.532 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609682684 WDEMLKGEGCTBBJ-FXAWDEMLSA-N 398.466 5.155 30 20 GKED CC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1cc(F)ccc1F 610137627 QLNUCIIILXTAQI-XMMPIXPASA-N 392.449 5.656 30 20 GKED CC(C)(C#N)CCCNc1ccc(Oc2nncc3ccccc23)c(Cl)c1 611028583 DKIWOFKEEHPMNT-UHFFFAOYSA-N 380.879 5.817 30 20 GKED Cn1c([C@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccccc2)nc2ccccc21 611392628 ZSILOISMWMNZAU-RCZVLFRGSA-N 392.506 5.202 30 20 GKED CCc1onc(C)c1NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 613075713 YSUODSCGCKHGJS-UHFFFAOYSA-N 398.278 5.087 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cn1)c1ccccc1 613292321 HJLHEFZPNULTEC-UTKZUKDTSA-N 393.446 5.260 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1SCC(F)(F)F 642476536 QNTOQSRGHGTDOB-UHFFFAOYSA-N 386.464 5.623 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(C(F)(F)F)c1 678208119 LNODBCLMGVBOCT-AOOOYVTPSA-N 397.256 5.407 30 20 GKED C#Cc1cccc(N(C)C(=O)c2sc(-c3ccco3)nc2-c2ccccc2)c1 728482497 UHZCONZWIZRVAZ-UHFFFAOYSA-N 384.460 5.328 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1ccccc1Cl 733079798 KWOJABBXPDYGRE-UHFFFAOYSA-N 391.784 5.047 30 20 GKED CCCCCCCCCC(=O)Nc1ccc2c(c1)CCN2C(=O)c1cccnc1 733764382 PKKDQIKHNBIUSX-UHFFFAOYSA-N 393.531 5.364 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)NCc1cccc(O[C@@H](C#N)CC)c1 733806038 VZBCBXXZNNZFBZ-HXUWFJFHSA-N 397.494 5.019 30 20 GKED CCC(CC)[C@H](NC(=O)NCc1cccc(O[C@H](C#N)CC)c1)c1ccccc1 733845599 GAUXEVIWHIKPAW-GMAHTHKFSA-N 393.531 5.344 30 20 GKED Cc1ccc(-c2nc(CSCc3cc(Cl)ccc3OCC#N)co2)cc1 735318966 SYSPRXPNKQMCEZ-UHFFFAOYSA-N 384.888 5.639 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1 737477253 DMMZCJNOOWPNDL-LLVKDONJSA-N 397.780 5.023 30 20 GKED N#Cc1cc(NC(=O)C2=COCCC2)ccc1Oc1ccc(C(F)(F)F)cc1 742783235 BVJIJEWYVZYTHD-UHFFFAOYSA-N 388.345 5.002 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)CSc2c(Cl)cccc21 743055607 GWSIJVJGEMUAQM-UVTDQMKNSA-N 380.856 5.294 30 20 GKED COc1cc2c(cc1NC(=O)N[C@@H](C)c1cccc(C#N)c1)oc1ccccc12 743068922 PTIMIYKFXQRJKE-AWEZNQCLSA-N 385.423 5.349 30 20 GKED FC(F)Sc1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 747447475 KFOGAPGIOAMWON-PHIMTYICSA-N 393.343 5.564 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1SC(F)(F)F)c1ccccc1 748570077 ALTBELRKROMBNI-CQSZACIVSA-N 379.407 5.465 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)c(N)c(Cl)c1 753081042 QPYVCYXBNYLLRR-UHFFFAOYSA-N 391.302 5.137 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)OCC 756472259 VDHHLRBORJFRKG-IAQYHMDHSA-N 399.274 5.019 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C/C(=O)c1ccc(N2CCOC2=O)cc1 756789369 XEWFIGFOGPDNSN-UKTHLTGXSA-N 399.446 5.215 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc2sccc2c1 761035639 GRFBAPKACSDZBI-CYBMUJFWSA-N 389.263 5.169 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3csc(Cl)c3Cl)cc2N1 761486520 PPVZNQVHEZODBC-UPHRSURJSA-N 376.311 5.057 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc([N+](=O)[O-])c(Cl)c3)c2)s1 761525441 KAIDUZXTCYZWIR-UHFFFAOYSA-N 383.860 5.138 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 767697131 VARINKADSNEUMY-MRXNPFEDSA-N 386.517 5.090 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1nnc(-c2ccccc2)s1 767868480 WMZYQDYRXSGREM-UHFFFAOYSA-N 387.917 5.194 30 20 GKED C[C@@H](N[C@H](C)c1ccccc1OCc1ccccc1)c1ccc(OCC#N)cc1 776163272 GYYUNCNXBQSZEI-WOJBJXKFSA-N 386.495 5.580 30 20 GKED C=CC[C@@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 778619304 LNEDUNPNFCVGIN-CVEARBPZSA-N 394.446 5.624 30 20 GKED COCc1ccc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cc1 779595252 GOYJEOIVAVNCEK-UHFFFAOYSA-N 376.431 5.035 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)CCc2c(Br)cccc21 782890829 TXXYIHLQLFNHIO-BENRWUELSA-N 397.297 5.180 30 20 GKED C[C@@H](Cc1ccccc1)NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 786059015 XFOWMQMIRYDMIO-MBSDFSHPSA-N 385.536 5.260 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](NC(=O)OC(C)(C)C)C1CC1 789890411 QNTVQNJDFJTAJD-IBGZPJMESA-N 386.536 5.170 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(F)c3F)o2)c1 790965609 TWQUJCRBQVXVSQ-INIZCTEOSA-N 382.410 5.196 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cc3cc(C)c(C)cc3o2)cn1 792882817 AZDOLRCNNAEAML-HJWRWDBZSA-N 384.435 5.411 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(CC)cc2)n1 796474504 RHJIUCXHHSFQPO-UHFFFAOYSA-N 386.517 5.036 30 20 GKED C[C@H](N[C@H]1CCCc2c1[nH]c1ccc(Cl)cc21)c1ccc(OCC#N)cc1 858376436 LBYYDDVVEUGXNI-QKKBWIMNSA-N 379.891 5.452 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc3c(Cl)nccc3o2)ccc1OC 866297363 VBVLLZCGFVRIBT-DZGCQCFKSA-N 399.878 5.022 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2)cc1 915352338 GYVSXDJHWOUJQZ-DNQXCXABSA-N 381.479 5.711 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc(Cl)s2)cc1 916051600 RUSCCGOMSIJRMF-IBGZPJMESA-N 380.900 5.628 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 916849350 PMNFIOBJLHIKIX-OAQYLSRUSA-N 384.479 5.417 30 20 GKED Cc1ccc(C)c(OCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046776 MPPIHIDZHYSPLD-OAHLLOKOSA-N 384.888 5.212 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)CC(C)(C)C 920805639 DXJWIFBHRYDWMP-STQMWFEESA-N 376.472 5.727 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(C(F)(F)C(F)(F)F)c2)ccc1Cl 1776034700 UQSFLRNTWPFEJQ-UHFFFAOYSA-N 392.711 5.138 30 20 GKED CC(Cc1ccc(Cl)c(C(F)(F)F)c1)=NNc1ccc(C(=O)O)c(F)c1 1776075789 DVEUOYGPGJZJBB-UHFFFAOYSA-N 388.748 5.227 30 20 GKED C=C(Cl)C[C@H](NCc1ccc(Cl)cc1Oc1ccc(C)cc1C)C(=O)O 1776143161 SINDGRJJECHBAV-KRWDZBQOSA-N 394.298 5.435 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)s1 1776339875 IRVZKBGFWUPVLC-LCYFTJDESA-N 390.504 6.208 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2cccc(F)c2F)o1 1776782953 SAQPCHJBLALFFW-HNNXBMFYSA-N 379.447 5.518 30 20 GKED CCCOc1ccc2c(c1)C(=O)/C(=C/c1csc3ccc(C(=O)O)cc13)CO2 1776824618 UHEJDQZGNJQVTH-RIYZIHGNSA-N 394.448 5.047 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)s2)cc1 1777472282 GLANAVWGKFUQDN-ZRDIBKRKSA-N 378.449 5.230 30 20 GKED N#Cc1ccc(-c2ccc(OCC(=O)Nc3ccccc3C(F)(F)F)cc2)cc1 5407263 JOSXZJULLCCWPW-UHFFFAOYSA-N 396.368 5.262 30 20 GKED COc1ccc(-c2nc(CSCCOc3ccc(C#N)cc3)cs2)cc1 31413408 BARRVLVARCPBMU-UHFFFAOYSA-N 382.510 5.003 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1c(C)[nH]c2ccccc12 49723756 ZJZQAUKEIQXJHM-UHFFFAOYSA-N 396.450 5.025 30 20 GKED C[C@@H](c1ccccc1)n1c(SC[C@@H](C#N)CCC#N)nnc1-c1ccccc1 51423557 CQYZCBQTRKFTHG-ZWKOTPCHSA-N 387.512 5.090 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1-c1ccccc1 63388979 LQFVESUCKRRBGM-UHFFFAOYSA-N 387.439 5.482 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1ccccc1Cl 66956268 GLUCLZGVCJTYFF-HUUCEWRRSA-N 387.936 5.959 30 20 GKED CN(C(=O)c1cc(-c2ccccn2)ccc1Cl)c1cc(Cl)ccc1C#N 119269638 WXIKYKRMVRYXNY-UHFFFAOYSA-N 382.250 5.204 30 20 GKED CC(C)c1nccn1Cc1cccc(NCc2ccc(N(C)CCC#N)cc2)c1 123275148 FYPDORXBBWEWQJ-UHFFFAOYSA-N 387.531 5.017 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(C)noc1C 124358315 ODVLQSWFHXIQNE-FQEVSTJZSA-N 390.443 5.228 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(Cl)cc2Cl)cc1OCCCC#N 147119725 FAKGEVZSTIVKSH-CQSZACIVSA-N 393.314 5.535 30 20 GKED C=C[C@H](CC(=O)N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 156085578 JACJXDWJOGHGBA-WOJBJXKFSA-N 386.495 5.198 30 20 GKED N#CCCCOc1cccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3o2)c1 177618718 JYQGGUONSPCFHK-WJDWOHSUSA-N 383.791 5.155 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(CCc1ccc(F)cc1)C1CCCC1 180029331 CIPVTMULWUSWPH-QGZVFWFLSA-N 395.478 5.136 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nnc(-c2ccccc2)o1 181059123 KXKWBHUTQZVRNB-NSHDSACASA-N 375.375 5.480 30 20 GKED Cc1csc([C@@H](C)CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 184633870 XGQXTLUUDDOWBE-AWEZNQCLSA-N 392.484 5.041 30 20 GKED Cc1cc(F)c(Br)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 190889189 FVOKJNROSIJTKT-INIZCTEOSA-N 390.256 5.063 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](Cc2ccccc2)C1 191434870 PVMDEYDFHGMNGX-OAQYLSRUSA-N 378.516 5.014 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccccc1C(F)(F)F 192762656 WVBWBTYGSAVGSM-UHFFFAOYSA-N 381.247 5.038 30 20 GKED O=C(/C=C\c1sc2ccccc2c1Cl)c1ccc(N2CCC(O)CC2)cc1 210161080 WDVICIRREJAMTK-KTKRTIGZSA-N 397.927 5.412 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)Cc2csc(C(C)(C)C)n2)c1 303167911 IUDOFAPFNYKSMX-UHFFFAOYSA-N 394.565 5.259 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 303346226 MNXCTNOTLMLHGD-SFHVURJKSA-N 399.494 5.913 30 20 GKED CCc1cccc2c(CCNC(=O)c3ccccc3-c3ccccc3C#N)c[nH]c12 303578867 ZVEREJGUTOVBID-UHFFFAOYSA-N 393.490 5.241 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)cc1 303586799 QSBHZNUEPZTQGA-UHFFFAOYSA-N 395.462 5.191 30 20 GKED C=CCN(C(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 303621804 DERVOXYRUALYKV-CVEARBPZSA-N 396.462 5.411 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccn(-c3cccc(C#N)c3)n2)c(C)c1 409624591 VVUJGVPZSTYOQP-MRXNPFEDSA-N 390.512 5.195 30 20 GKED N#CC[C@H](CC(=O)N1CCC(F)(c2ccc(Cl)cc2)CC1)c1ccccc1 410189990 ASKJGDDKWNNRRD-GOSISDBHSA-N 384.882 5.215 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@H](C)C3)c1C1CC1 411008837 IRJSCOMUXDYESX-QWHCGFSZSA-N 382.533 5.213 30 20 GKED N#CCSc1cccc(C(=O)NCCC(c2ccccc2)c2ccccc2)c1 429957387 YUFPGLDLZGKFJK-UHFFFAOYSA-N 386.520 5.254 30 20 GKED CC(C)n1cc(Br)cc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430612905 UTXJNNDPJCCNQV-LBPRGKRZSA-N 394.338 5.076 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cncc(-c3ccc(Cl)cc3)c2)s1 430616102 DQGMAYYQODXOGV-KRWDZBQOSA-N 395.915 5.646 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1 433130566 AMGSJBWCVBCKFJ-DOTOQJQBSA-N 399.947 5.613 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1 436193654 YLWPEJJMVNSAOB-UHFFFAOYSA-N 389.524 5.417 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](c1ccc(F)cc1)c1cnc2ccccc2c1 436303538 CVXMZPIYAHIBPV-YGOYIFOWSA-N 376.475 5.034 30 20 GKED N#CC[C@H](CC(=O)N[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 437413351 QUNJJLTZXONXQQ-QWFCFKBJSA-N 386.417 5.155 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2nccc3ccccc23)cc1F 437472470 MQUWTOJLFNTVHB-UHFFFAOYSA-N 383.382 5.290 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 438035686 ZOIYDFGIKLZQQM-UHFFFAOYSA-N 379.382 5.323 30 20 GKED N#CC1CCC(CNCc2cn(Cc3ccccc3)nc2-c2cccs2)CC1 441376247 DCLWMQGRORLVLK-UHFFFAOYSA-N 390.556 5.079 30 20 GKED C=CC[C@H]1N(Cc2csc(N(C(C)=O)c3ccccc3)n2)CCCC1(C)C 444784462 VSXUMFIKFIUUNI-HXUWFJFHSA-N 383.561 5.394 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1C 458795925 DJXUCAACQOQELK-DHIUTWEWSA-N 375.516 5.585 30 20 GKED C=CCC[C@@H](NCc1cncc(C(F)(F)F)c1)c1ccc(C(F)(F)F)cc1 463144093 JXRSHLIDCSHOBA-QGZVFWFLSA-N 388.355 5.916 30 20 GKED CSc1cccc([C@@H](NC(=O)c2ccc(C#N)cc2)c2ccc(F)c(F)c2)c1 464125180 CRHFNZQIUXXJQP-OAQYLSRUSA-N 394.446 5.078 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464469951 UPZXMMFWKBGUKO-CYBMUJFWSA-N 379.407 5.013 30 20 GKED C[C@@H](CCNC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 470468821 UKVQUYNEUPPPJP-GJZGRUSLSA-N 389.421 5.131 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)N2CCC(F)(C#N)CC2)c2cccs2)cc1 476839786 ATIQZQCSQOSKBH-UZLBHIALSA-N 399.535 5.388 30 20 GKED N#CCCCOc1cccc(CNc2ccc(Oc3ccccc3F)nc2)c1 485955327 KLLUKYXNHRZLLZ-UHFFFAOYSA-N 377.419 5.308 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc4[nH]ncc34)cc2Cl)cc1 491030593 WXLGWAYJPZTUJX-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 499864888 UKAXTZGMRCDTKV-YVEFUNNKSA-N 380.797 5.233 30 20 GKED CCCN(C(=O)[C@H](C)Oc1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 501624064 CQEIHEKVNFDERL-SJORKVTESA-N 376.456 5.072 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc([C@@H]2CCCOC2)cc1 503142595 WXNNQNXPTSMDJV-QFBILLFUSA-N 380.513 5.227 30 20 GKED C[C@H]1C/C(=C/c2ccco2)c2nc3ccccc3c(C(=O)NCCCCC#N)c2C1 505501988 URRLQDTZEQSSED-HMNTXPNISA-N 399.494 5.374 30 20 GKED Cc1ccc(Br)c(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1 505933722 MBTZYALIKZZFMW-OAHLLOKOSA-N 398.087 5.059 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(-c2cccs2)no1 510171950 FGKZGPDIJALDQO-CYBMUJFWSA-N 390.493 5.585 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cccc(C(F)F)c2)c1 513233071 KKLBJPHHCKTZFC-UHFFFAOYSA-N 378.378 5.327 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 516986239 GHDLPFUZYXUOQI-UHFFFAOYSA-N 398.491 5.016 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 520131925 RKDIVSXATVCTEK-HXUWFJFHSA-N 399.466 5.219 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cc1Cl 520786443 MJTZWCBMFZNHBD-OAHLLOKOSA-N 378.284 5.224 30 20 GKED CO[C@H](C)c1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 521644659 NZZHFHBFNVJNRU-OAHLLOKOSA-N 390.414 5.449 30 20 GKED Cc1nc(NC(=O)c2cccc(OC3CCCCC3)c2)sc1SCC#N 523111016 SMDJLDSFWUUSPF-UHFFFAOYSA-N 387.530 5.031 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)c2)c1 524153620 MBHCHCVVWPZXFN-SFHVURJKSA-N 385.467 5.328 30 20 GKED Cc1nc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 524387507 IQTRAJYLZBUDMB-UHFFFAOYSA-N 397.887 5.116 30 20 GKED C[C@H](NCC1(c2ccc(Cl)cc2Cl)CCOCC1)c1cccc(C#N)c1 527485297 WPWQNNAEOSFEBV-HNNXBMFYSA-N 389.326 5.264 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)c1 531147121 HPISGHJDDKPTFC-UHFFFAOYSA-N 379.419 5.080 30 20 GKED C[C@@H](Sc1cccc(Cl)c1C#N)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 536724564 MTBLCTNVHXRGKP-SNVBAGLBSA-N 386.820 5.023 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)nn1-c1ccc(Cl)cc1 537553926 OATDICQDMKRFTJ-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1OC(F)F)c1ccc(-c2ccncc2)cc1 539342425 NMHRLUPCWUIQRT-OAHLLOKOSA-N 379.410 5.072 30 20 GKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 540129023 SQPASRADZDPHPC-XLIONFOSSA-N 377.488 5.126 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccccc1 540147415 UMGRGGQKNKBBLV-YADARESESA-N 397.584 5.761 30 20 GKED N#Cc1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)ccc1F 540519223 FSMVVXXZFRDEGW-HNNXBMFYSA-N 376.275 5.109 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)Nc1ccccc1Br 541173993 WIVBRRFNBBQLEP-JTQLQIEISA-N 395.709 5.093 30 20 GKED CC(=O)Nc1cccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541994416 TVFUEWBOWYBDAP-INIZCTEOSA-N 398.466 5.066 30 20 GKED N#C[C@@H](C(=O)c1ccc([C@@H]2CCCOC2)cc1)c1nc2cc(Cl)ccc2s1 543734493 HPBVEZIBXJHDBV-WBVHZDCISA-N 396.899 5.334 30 20 GKED COCC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1ccc(Cl)c(Cl)c1 551818048 SMNVTVBOPKCMRR-CWTRNNRKSA-N 381.278 5.433 30 20 GKED CCN(C(=O)c1ncc(C#N)cc1C)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 560287106 AIYPGVRRUFZRLR-SFHVURJKSA-N 399.494 5.161 30 20 GKED C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 562168811 LLGSDXUJFZPYII-DBXWQHBBSA-N 393.556 6.086 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)c(O)c1)c1ccc(C(F)(F)F)cc1 575873798 CNNKAYIBJYSHBH-RDTXWAMCSA-N 379.422 5.778 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(CN2CCCCC2)cc1 576420259 YALSOBLOZFFRTA-SFHVURJKSA-N 393.556 5.177 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccnc1Oc1ccccc1)c1ccccc1 590106601 GQPPJRCTTWNRCA-HXUWFJFHSA-N 386.455 5.431 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591843150 LXNDVZMOCOOSFZ-UHFFFAOYSA-N 394.290 5.283 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)N(c3ccc(C#N)cc3)C3CCC3)o2)cc1 598883825 BOHSGOZUYTXBAZ-UHFFFAOYSA-N 385.467 5.040 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2cccc(F)c2)cc1Cl 603758807 IZLLVEJITPPVJP-FQEVSTJZSA-N 394.833 5.152 30 20 GKED CC(C)(C)c1ccc([C@@H](NC(=O)Nc2ccc(CC#N)cc2)C(F)(F)F)cc1 604290949 VFEMSFPJQYXDFJ-GOSISDBHSA-N 389.421 5.475 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cc3ccccc3n2CC#N)c(C)c1 609168843 IDNGIHOUJKAGJX-INIZCTEOSA-N 377.513 5.616 30 20 GKED CCN(CCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 609435294 DKINQUFAEXBBQJ-SFHVURJKSA-N 396.560 5.119 30 20 GKED CCN(C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 609967919 QIPSHYGBUIZCMX-HOTGVXAUSA-N 388.433 5.680 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(N2CCCCCC2)c1 610144029 OVYNXXQYVBEAIV-UHFFFAOYSA-N 390.531 5.383 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N[C@H](CC3CC3)c3ccccc3)o2)cc1 610236373 SENYDFBLSGXVNT-JOCHJYFZSA-N 386.451 5.001 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 610357258 JODSARQIKKRYSU-OPAMFIHVSA-N 389.886 5.361 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)c(Cl)c2)nnc1-c1cccnc1 615346646 RHTJSMZCRZKAEV-GFCCVEGCSA-N 391.327 5.686 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(C(=O)Nc3ccccc3)c2)n1 671769354 XWZAIQMMYWFAJA-GOSISDBHSA-N 389.480 5.009 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1ccc(Br)s1 725841601 IPDXFOUGXAVMEZ-UHFFFAOYSA-N 387.262 5.036 30 20 GKED COc1ccc(-c2cc(C(=O)N(CCC#N)c3ccc(C)cc3)sc2C)cc1 726940399 IZTPRWZBFHAECH-UHFFFAOYSA-N 390.508 5.601 30 20 GKED CCCCCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 727955672 MVHJTZOZIAJCCB-APWZRJJASA-N 379.529 5.855 30 20 GKED Cc1nc(CSc2ccccc2C(=O)OCc2ccc(F)cc2C#N)cs1 728618192 RMYSRCJAGWSHON-UHFFFAOYSA-N 398.484 5.112 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc1 728698801 PDSCLHAFONQJJF-BXUGYJKXSA-N 377.509 5.908 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1ccc(Cl)c(Cl)c1 730954791 KQPOUXIGUBQVOE-NSHDSACASA-N 396.368 6.054 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 731319899 QPAULDQAKASQSP-UHFFFAOYSA-N 375.453 5.168 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccncc1 734657735 LERKSAUBLRUPGC-FOIQADDNSA-N 392.528 5.191 30 20 GKED O=C(/C=C\c1cc(Cl)c2c(c1)OCCCO2)c1cccc(-c2ccncc2)c1 741473959 VIUJUUXUGLXECO-WAYWQWQTSA-N 391.854 5.459 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1ccc2c(c1)COC2 742434324 FSNYAKPPCHUNGI-YVMONPNESA-N 397.883 5.302 30 20 GKED C/C(=C\C(=O)Nc1ccccc1SCCC#N)c1cccc(C(F)(F)F)c1 742648845 DPJMUJRUAABQQL-WYMLVPIESA-N 390.430 5.753 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)s1 742650680 BNCLJRQTBHMOAF-DANTVBBOSA-N 394.327 5.142 30 20 GKED CCCCCC[C@](C)(CC)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 744038666 YSIIKYRNEAGRJM-VFNWGFHPSA-N 375.463 5.994 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)N[C@@H]2CCCC[C@@H]2C)cc1 751013601 IZRYRTSMOGJCQL-HNAYVOBHSA-N 395.528 5.224 30 20 GKED N#CCOc1cccc(NC(=O)c2cc(Cl)ccc2Sc2ccccc2)c1 758952486 WVAQRKYBHOHPON-UHFFFAOYSA-N 394.883 5.646 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1ccncc1 768949624 ZNTKFJDGKRPGNO-HSZRJFAPSA-N 389.474 5.250 30 20 GKED Cn1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)c(-c2cccs2)n1 769688832 DUHHTJQCUKAKPB-UHFFFAOYSA-N 390.537 5.039 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc3c(ccc4ccccc43)o2)c1 776165677 UUFMGBZHHNONOM-FXAWDEMLSA-N 384.479 6.118 30 20 GKED C#CCCCCCC(=O)N[C@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 778024248 TYLBJNUQTWGYON-FQEVSTJZSA-N 384.520 5.111 30 20 GKED CC(C)(C)c1nn(Cc2cccc(SC(F)(F)F)c2)c(O)c1CCC#N 781156516 PQOOARBKQRSJQI-UHFFFAOYSA-N 383.439 5.003 30 20 GKED N#CC[C@@H](CC(=O)N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1ccccc1 793961764 FKHGXQLLYBGBTE-YOEHRIQHSA-N 389.282 5.021 30 20 GKED N#C[C@H](C(=O)Cc1coc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 796800968 XITSYQRSCSRHSC-QGZVFWFLSA-N 392.867 5.629 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)COc2ccc(Cl)c(Cl)c2)s1 797567687 AHOIDGAULDCMPD-NSHDSACASA-N 383.300 5.003 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccnc(C(F)(F)F)c1 808372089 INRQIMPFQAJETF-UHFFFAOYSA-N 384.226 5.007 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)cc1 810160358 DSDCTULZWRBHOH-RBZFPXEDSA-N 375.299 5.525 30 20 GKED Cc1cc(OCCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)ccc1Cl 813211508 LLWXCHJZEAQAHD-OAHLLOKOSA-N 396.796 5.098 30 20 GKED COCc1ccccc1/C=C(C)/C=C\C(=O)c1ccc(N2CCCOC2=O)cc1 834444980 ZLYLMPGWNDBLSP-ROMCCWAQSA-N 391.467 5.022 30 20 GKED C[C@H](Nc1ccc2c(c1F)CCN(C(=O)OC(C)(C)C)C2)c1cccc(C#N)c1 864011713 ABTZKVMTNONMBN-HNNXBMFYSA-N 395.478 5.164 30 20 GKED N#CCCN(C(=O)c1cc(-c2ccco2)nc2ccccc12)c1ccc(F)cc1 864238699 OQNZJXOZKKETLR-UHFFFAOYSA-N 385.398 5.194 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccccc3Cl)n2)cc1 916650547 XKXJKFMWXUSTLY-KRWDZBQOSA-N 380.900 5.581 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCCCCC2)cc1Cl 916683644 BLQXVZSPLILZHA-HXUWFJFHSA-N 381.907 5.793 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 917026881 RLFQITAIUFRBAA-RRFJBIMHSA-N 378.419 5.355 30 20 GKED CCCCCC/C(C=NNc1ccc(Cl)c(C(=O)O)c1)=C\c1ccccc1 1776033336 JNWGFQWWTZANCL-LUPGDZJLSA-N 384.907 6.490 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)nc2)cc1 1776125342 FIUZUYDXDXBIJT-QHIITQONSA-N 381.472 5.271 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776697645 LULIPAPXHHZLGX-HELGNCAXSA-N 384.475 6.461 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 1776782789 JXJJNEVMXXFNET-QGZVFWFLSA-N 388.464 5.148 30 20 GKED CCCCCCCOc1ccc(/C=C2\CCc3ncc(C(=O)O)cc3C2=O)cc1 1776785877 GSHHNLSSMAIONM-NBVRZTHBSA-N 393.483 5.342 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl)c1ccccn1 60477028 KZVNVKTYICHHQM-SECBINFHSA-N 381.671 5.747 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CSc2ccc(F)cc2)cc1 65680184 HWPYESJDUKWMIO-UHFFFAOYSA-N 378.428 5.220 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1cccc(OCc2ccccc2C#N)c1)C1CC1 65833276 KCLNRRKPUWWGSO-KRWDZBQOSA-N 386.451 5.096 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc(Cl)c1Cl 120003418 BJUXQUNBROEKLM-QMMMGPOBSA-N 384.675 5.085 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC[C@H]3CCC[C@@H]32)cc1 120156220 SFGBCUFQFVEWPD-XXBNENTESA-N 389.499 5.128 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1 121298098 FRFPSNSZWJKIFK-GOSISDBHSA-N 375.394 5.348 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1ccc(CC#N)cc1 127869230 GDTYERUUEPZUSW-INIZCTEOSA-N 390.512 5.410 30 20 GKED O=C(Nc1cccc(CCC(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 132145600 IEQPPFGNZFXPQF-UHFFFAOYSA-N 379.275 5.592 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 184076680 CZNOLQJYUYAVKJ-ROUUACIJSA-N 392.503 5.309 30 20 GKED CC1(C)CCC[C@H]1/N=C(/O)C1CCN(c2noc3ccc(Cl)cc23)CC1 328873028 FBZDDGZAPPAAGU-QGZVFWFLSA-N 375.900 5.233 30 20 GKED O/C(=N/[C@@H]1CCOc2c(F)cccc21)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329483860 SCMCGCGYTOAUHZ-OXQOHEQNSA-N 397.494 5.113 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@H]3C[C@H]3c3ccccc3)c2)cc1 409779550 LJCARNGWFQJJLT-ZEQRLZLVSA-N 397.478 5.009 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1csc(Cc2ccc(F)cc2)n1 410346643 WYIMLMRVAUVFPP-UHFFFAOYSA-N 380.488 5.173 30 20 GKED CSc1ccc(Cl)cc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 438079704 KOIJNFSFPHZGBD-AEFFLSMTSA-N 385.920 5.366 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H]1CCC[C@@H](C(F)(F)F)C1 438465542 KSXDQDJOTRKNQF-DOTOQJQBSA-N 386.417 5.324 30 20 GKED C=CC[C@H]1N(Cc2nnc(-c3c(-c4ccccc4)noc3C)o2)CCCC1(C)C 444779716 LERXUZOYPMGSFE-GOSISDBHSA-N 392.503 5.267 30 20 GKED CCOc1ccc2nc(N(Cc3ccccc3)C(=O)CC(C)(C)C#N)sc2c1 447130258 AJXRGMZCNQFPLE-UHFFFAOYSA-N 393.512 5.168 30 20 GKED CC(F)(F)c1ccccc1NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 455800630 GDIDUEICMGQEMI-UHFFFAOYSA-N 390.274 5.147 30 20 GKED C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458799691 JSFXBILHVZDDIY-ZPMCFJSWSA-N 379.479 5.353 30 20 GKED N#Cc1cc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)ccc1F 464083944 WAMBITSRZUXVJB-UHFFFAOYSA-N 397.812 5.354 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3C[C@H]4CCC[C@@H]4C3)cc2Cl)cc1 465159726 SRKAAMBCBSGIKO-HZPDHXFCSA-N 381.863 5.268 30 20 GKED N#CC[C@H](CC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1)c1ccccc1 466871083 FDKUAMCJGHWRSB-GOSISDBHSA-N 384.882 5.215 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)CSCc1ccc(C#N)cc1 468163907 IVFPRXKHXIDIJU-SFHVURJKSA-N 393.556 5.117 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Cc1coc(-c2ccc(Cl)cc2)n1 470644847 RIBZSGXBQREPSD-UHFFFAOYSA-N 380.875 5.142 30 20 GKED CCCCOc1ccc(C(=O)Nc2cccc(OCCCC#N)c2)c(Cl)c1 471743584 GYTPBWXQSKQQQP-UHFFFAOYSA-N 386.879 5.454 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc2onc(C(C)(C)C)c2c1 476148273 MKFMZOBZERGZFF-UHFFFAOYSA-N 377.488 5.625 30 20 GKED Cc1csc(C(C)(C)NC(=O)c2ccc(Sc3ccccc3C#N)cc2)n1 480844286 WMECFRHZCXHOQL-UHFFFAOYSA-N 393.537 5.140 30 20 GKED N#Cc1cc(F)ccc1CSc1nnc(-c2ccco2)n1C1CCCCC1 483178866 FIUWMGOGDVXUKD-UHFFFAOYSA-N 382.464 5.346 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(COCc2ccco2)c1)c1ccccc1 488622752 DYEPAWUFEDCWJW-HSZRJFAPSA-N 375.468 5.685 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccc(Cl)cc1 499814101 QGNXAXVCOWUYLQ-LZWOXQAQSA-N 379.674 5.131 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(Br)o1 500741736 ZUBLSRBOIJYXOZ-UHFFFAOYSA-N 397.228 5.267 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc3c(s2)C[C@H](c2ccccc2)CC3)c1 508687424 DYGWGSSCCJAASG-OAHLLOKOSA-N 393.899 5.193 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 509668411 TXVJPQHSOILJKG-GDBMZVCRSA-N 388.389 5.658 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccc(Cl)s1 510740107 VIQHJBFVCXONRP-UHFFFAOYSA-N 397.887 5.696 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@]3(CC=CCC3)C2)cc1 512528873 LYDWMTQMDROKMA-XMMPIXPASA-N 387.483 5.705 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1 517901472 GKARRGAAWCXTBE-UHFFFAOYSA-N 376.481 5.199 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 518849974 IUVVCQPMONLIKU-CYBMUJFWSA-N 392.267 5.013 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519028239 FLCKJPXOTKRDQK-UHFFFAOYSA-N 381.435 5.322 30 20 GKED COc1ccc(SCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 520915243 JHGVLXPJQKGJAL-UHFFFAOYSA-N 390.464 5.090 30 20 GKED C[C@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 521021525 ZEIAFVLUGKPDLH-CABCVRRESA-N 390.911 5.609 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccccc1SCCC#N 521716535 KZXYIUASWVAWDD-UHFFFAOYSA-N 379.510 5.377 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(OCC(F)(F)F)c1C 524371389 FJNYMBWBSLAKEX-UHFFFAOYSA-N 392.421 5.199 30 20 GKED CCCOc1ccccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 524493950 KRWCSUGNHABXHU-UHFFFAOYSA-N 386.451 5.178 30 20 GKED C[C@H](NCc1ncc(-c2ccccc2F)o1)c1ccc(-c2cccc(C#N)c2)cc1 542942906 XKMAUJGWYOKBDB-KRWDZBQOSA-N 397.453 5.870 30 20 GKED N#Cc1ccc(SCc2nc(-c3cccc(-c4cscn4)c3)no2)cc1 545143639 DCBCKAZYYRSVGD-UHFFFAOYSA-N 376.466 5.024 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1Cl 547951343 BRRYUYAPXBXGNN-UHFFFAOYSA-N 390.855 5.136 30 20 GKED Cc1cc(Br)c(C(=O)N[C@H](C#N)c2ccccc2Cl)cc1Cl 553320860 UEXVYUXPBOQENV-OAHLLOKOSA-N 398.087 5.059 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1ccc(-c2nc3ccccc3s2)s1 560711393 PCCMYYARUMTOKT-UHFFFAOYSA-N 390.493 5.190 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 560935080 PDJKIVCFXSDINN-GFCCVEGCSA-N 382.316 5.051 30 20 GKED C[C@@H]1Cc2sc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c(C#N)c2[C@@H](C)C1 569685834 XCMOZOFOKGBFIX-HEHGZKQESA-N 378.497 5.004 30 20 GKED N#CCCN(C(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccc(F)cc1 569722130 YCQKOHFWRUEUHU-UHFFFAOYSA-N 397.837 5.014 30 20 GKED CSc1ccc([C@H](CNC2CCC(C#N)(c3ccccc3)CC2)N(C)C)cc1 580338113 IZCYBCDUGSIUST-RZMWZJFBSA-N 393.600 5.005 30 20 GKED CSc1nc(C2CC2)cc(-c2nc([C@@H](C)c3c(F)cccc3F)no2)c1C#N 583110169 PXZMASCADOFXSC-JTQLQIEISA-N 398.438 5.033 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H](C3CC3)C2)cc1 589000032 ZVUFGBUKMOBRKU-SFHVURJKSA-N 391.471 5.013 30 20 GKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 596733761 VGSWQBCLZCYMTA-ICSRJNTNSA-N 393.556 6.067 30 20 GKED Cc1ccccc1Oc1cc(F)cc(F)c1NC(=O)N1CCC[C@H](CC#N)C1 598658786 QMJYEWNIQSIDPP-OAHLLOKOSA-N 385.414 5.223 30 20 GKED C=CC1CCN(C(=O)c2cc3c(C)nn(-c4ccccc4Cl)c3s2)CC1 599687652 LCDVLMFTIBIWSV-UHFFFAOYSA-N 385.920 5.087 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3csc(-c4ccc(Cl)cc4)n3)[nH]c12 605363160 LYOALENBZHOJRD-CQSZACIVSA-N 392.871 5.138 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N(C3CC3)[C@@H]3CCc4ccccc43)o2)cc1 609058361 NFOMTNJSYKKZQB-HSZRJFAPSA-N 398.462 5.022 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(C)(C)c1ccccc1C 609060395 CQDXKWATSZNMBZ-UHFFFAOYSA-N 398.506 5.670 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Sc2ccccc2F)c2ccccc2)cc1 609261076 LDROFOBTTREQBU-NRFANRHFSA-N 376.456 5.364 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 609377810 NMGYTVDGMWMTTG-HNNXBMFYSA-N 376.481 5.352 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609426899 VSXHQOUAXZYILE-UHFFFAOYSA-N 395.418 5.566 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccccc12 609682866 VNBKYNLMQBKJJU-CQSZACIVSA-N 379.485 5.457 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4ncc[nH]4)c3)cc2)cc1 609875835 DLIPOUPTPARRAQ-UHFFFAOYSA-N 394.434 5.187 30 20 GKED C[C@H](NC(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1)c1cccc(C#N)c1 610324178 GFKUZTGXLKJNAU-AWEZNQCLSA-N 376.460 5.171 30 20 GKED C[C@H](N[C@@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(C#N)c1 610343401 FTFWAJHXUZAJST-RYUDHWBXSA-N 386.339 6.008 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 610400452 QGADUJSRCXGSTF-MZNJEOGPSA-N 395.462 5.454 30 20 GKED C[C@@H](NC1CCN(CC#N)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 610812851 NELGLLVWULHDDF-CQSZACIVSA-N 393.478 5.072 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cn1)c1ccccc1 613289597 SSXSKVBCXJWSHG-MAUKXSAKSA-N 399.475 5.321 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 615620682 GZVUCLTVWKORNU-CQSZACIVSA-N 380.385 5.303 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)C[C@H]1CCCO[C@H]1c1ccccc1 669727565 OAZDVXPKERZZRV-GGAORHGYSA-N 378.516 5.437 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccco2)s1)c1nc(-c2ccccc2)cs1 675908515 QMPNSZNFHWTVIG-CQSZACIVSA-N 376.462 5.622 30 20 GKED N#C[C@@H](C(=O)c1sc(-c2ccccc2)nc1C(F)F)c1nc2ccccc2[nH]1 677793365 TVDUMNJIFQBORB-LBPRGKRZSA-N 394.406 5.114 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(SC(F)(F)F)cc2)cc1NC(C)=O 726430013 WYRYJVUOGBMGDY-UITAMQMPSA-N 395.402 5.162 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccco2)nc2ccccc12)c1ccc(Cl)cc1 730092206 DFITZYPOZQCNIL-FQEVSTJZSA-N 387.826 5.143 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(N(C)CCCC)cc1 730667907 JOAYZTZVPBQKKF-UHFFFAOYSA-N 376.504 5.015 30 20 GKED C#CCOc1ccc(NC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1 731114927 SRRRWESXDUWCMB-IBGZPJMESA-N 389.282 5.374 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 732496368 SHAZIANCWYOXBO-PKOBYXMFSA-N 378.522 5.557 30 20 GKED CCCCCCCC(=O)N1CCC[C@@H]1c1ccccc1I 733779926 BAWKOPFTMMHHFO-QGZVFWFLSA-N 399.316 5.315 30 20 GKED COc1ccc(-c2nc(SCc3ccc4ccccc4c3)nc(O)c2C#N)cc1 739431644 FNQWKCNRADKBIZ-UHFFFAOYSA-N 399.475 5.175 30 20 GKED Cc1ccc(Cl)c(NC(=S)N[C@@H](CCC#N)c2ccccc2)c1Cl 747711187 YELVWQGANHIPBW-HNNXBMFYSA-N 378.328 5.633 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2ccnc(Cl)c2)cc1 750639055 JWSMAIPGMHABRX-UHFFFAOYSA-N 394.883 5.256 30 20 GKED CCOC(=O)Nc1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1C#N 752765435 OAXCDXLMYQAOGT-UHFFFAOYSA-N 390.468 5.089 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc3cccc(Cl)c3o2)cc1 753196361 ICKPCXUAAFZUSO-UHFFFAOYSA-N 392.764 5.163 30 20 GKED N#Cc1c(NC(=O)/C=C/SCc2ccco2)sc2c1-c1ccccc1CC2 760152349 QSQVESVJIMTIDX-PKNBQFBNSA-N 392.505 5.364 30 20 GKED C[C@H](NC(=S)Nc1ccc(F)cc1OCC#N)c1ccc(Cl)cc1Cl 760282576 PHOLOUFGRJQXRZ-JTQLQIEISA-N 398.290 5.082 30 20 GKED CCc1cnccc1C(C)=NNc1ncnc2scc(-c3ccc(F)cc3)c12 765570662 VCRXQCIUZDSHSA-UHFFFAOYSA-N 391.475 5.291 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(SC)c(OC)c2)cc(OC)c1OC 772947401 RSJIUVUCRNUGIX-OAHLLOKOSA-N 387.545 5.014 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCc3ccc(OC(F)(F)F)cc32)c1 772984184 MTILYYQIQINGJQ-OXJNMPFZSA-N 390.405 5.043 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)OC[C@@H](C#N)Cc2cccs2)s1 774277291 HIQVZHCKVYHYGC-OAHLLOKOSA-N 382.510 5.028 30 20 GKED CC1(C)[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C[C@@H]1c1ccccc1 786961120 SFBYOSCFSSRYLL-GGAORHGYSA-N 387.527 5.264 30 20 GKED CC(=NNc1nnc(-c2ccccn2)s1)c1ccc(Cl)c(Cl)c1Cl 788030131 KQASLLWLQFXUIT-UHFFFAOYSA-N 398.706 5.396 30 20 GKED COc1cc2c(cc1NC(=O)c1ccc(C(C)(C)C#N)cc1)oc1ccccc12 792877155 UONWDUYNECDDNE-UHFFFAOYSA-N 384.435 5.648 30 20 GKED C[C@@H](OC(=O)c1ccc(C(C)(C)C#N)cc1)c1nc2ccccc2n1C(F)F 796039821 RRXIKEIHPYJZFH-CYBMUJFWSA-N 383.398 5.151 30 20 GKED C[C@@H](N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(OCC#N)cc1 797040865 MPLZQLNTTZKZKX-JLTOFOAXSA-N 390.405 5.289 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813211841 ROHXDFSLMQRSOV-HZMBPMFUSA-N 384.810 5.111 30 20 GKED N#C[C@@H](C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1cc(C(F)(F)F)ccn1 813217707 NZAJLCKZHYJLSU-ZIAGYGMSSA-N 386.295 5.013 30 20 GKED N#Cc1cc(Cl)ccc1SCc1nc(O)c2ccc(C(F)(F)F)cc2n1 1656332178 SPEHKZOPDZITBA-UHFFFAOYSA-N 395.793 5.172 30 20 GKED CC(=NNc1ccc([N+](=O)[O-])cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776042177 REYIFHGOTUNPRE-UHFFFAOYSA-N 399.790 5.043 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)cc(Br)c1 1776782827 FLDZEJNCSGFPMD-MRXNPFEDSA-N 390.749 5.396 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(-c2ccccc2F)s1 1777640979 LGMQOOMLRQWGKU-MDZDMXLPSA-N 396.439 5.304 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@H](C)c3ccc(Cl)cc3)CCC2)cc1 1791586444 ZMUOGUIDWUCQBJ-MRXNPFEDSA-N 396.918 5.154 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C/c2cccnc2)C(=O)c2ccccc2)c(Cl)c1 26764083 NMCJMBSRIVKRJQ-CPNJWEJPSA-N 390.870 5.257 30 20 GKED CN(Cc1ccsc1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 47570359 NFYPGKYBRNRUAG-UHFFFAOYSA-N 391.496 5.057 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cccc3cccnc23)cc1 56248394 BGFHHTRYGKWHCO-UHFFFAOYSA-N 379.419 5.080 30 20 GKED C=CCn1c(SCCOc2cccc3ccccc23)nnc1-c1ccco1 64927493 BIUZYIFLLVTSGM-UHFFFAOYSA-N 377.469 5.048 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1Cc1cccc(F)c1 66955101 BFWSZKJXICCWCZ-LPHOPBHVSA-N 397.519 5.459 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H](C)c1cccnc1 68547066 UFEHNXRJZXOIRV-QGZVFWFLSA-N 386.455 5.279 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccco1)C1CCCC1 69343932 OHLRGNIVIDARCU-INIZCTEOSA-N 383.517 5.508 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 104664742 OFSLTWKYWBLWHP-UHFFFAOYSA-N 379.275 5.136 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC(C#N)CC3)cc2Cl)n1 105032549 CBVJMCLQZQFISP-UHFFFAOYSA-N 392.937 5.024 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1 107737834 AXNFLDHJMJGCII-UHFFFAOYSA-N 388.492 5.749 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cc(F)ccc1F 108529440 MCJHBEIIZILQFS-ZIAGYGMSSA-N 389.471 5.441 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1 115850159 ZKIZBVIVTVSTGI-JOCHJYFZSA-N 391.540 5.133 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)cc1 151040865 LYTJSALHHCHTHR-LJQANCHMSA-N 392.418 5.025 30 20 GKED C[C@@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1cccc(C#N)c1 162760476 JAHZVHVERFWITJ-LBPRGKRZSA-N 387.270 5.108 30 20 GKED CC(C)Sc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 171530065 BAJYNMQZMANBPT-AWEZNQCLSA-N 385.439 5.422 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(OCC(F)(F)F)c1 172907164 UCPKTDCKYHYGOB-CQSZACIVSA-N 380.435 5.634 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N(C)Cc3cccc(C#N)c3)ccc2C)c1 174038410 HYCONKQTDDLBQO-UHFFFAOYSA-N 386.455 5.026 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 180149100 IDDRIOSPDZGPNX-UHFFFAOYSA-N 383.473 5.149 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 181211492 DUUOBNQJPVAHLM-CQSZACIVSA-N 389.502 5.165 30 20 GKED CCS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 303431792 DXDYFXKLFYABOP-OAQYLSRUSA-N 395.528 5.490 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 303487161 PJQNCGKULHNSLC-VHKYSDTDSA-N 386.417 5.290 30 20 GKED OC(=Nc1scnc1C1CC1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1 328907822 CJZGRKRLWSTJHC-UHFFFAOYSA-N 384.480 5.066 30 20 GKED CCc1nc2cc(N=C(O)N3CCCCC[C@@H]3c3noc(C(C)C)n3)ccc2o1 329528173 ICNOLBUBKVEVNC-MRXNPFEDSA-N 397.479 5.059 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 409471129 QDZWUICLDMJJJX-PMACEKPBSA-N 386.417 5.118 30 20 GKED C[C@H](CC(F)F)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 412276451 YUIQMRWWESTLKZ-LDYMZIIASA-N 377.275 5.106 30 20 GKED COc1ccccc1[C@H](NCc1cccc(F)c1C#N)c1ccccc1Cl 427433815 GMMSNZIZMPTMLY-JOCHJYFZSA-N 380.850 5.239 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 435687731 IKSDHCYLLQAMMT-UHFFFAOYSA-N 387.370 5.192 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(Br)s1 436417813 ONYHAEFZRLPZSY-ZDUSSCGKSA-N 379.323 5.044 30 20 GKED CSc1ccccc1[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 441633215 ITXYQBNZNQMODE-GJZGRUSLSA-N 385.558 5.543 30 20 GKED N#CC1CCC(CNC(=O)NC2(c3ccc(C(F)(F)F)cc3)CCCC2)CC1 442723685 SWFGSZFMIVCMGO-UHFFFAOYSA-N 393.453 5.104 30 20 GKED C=CCC(CC=C)c1nc(CC(=O)N[C@H](C)c2ccc(Cl)cc2Cl)no1 445745800 YYBKJTFYLMXQGW-GFCCVEGCSA-N 394.302 5.032 30 20 GKED C[C@@H](NCC1(CF)CCOCC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 453306849 JPRJWIXKSYVPBH-LLVKDONJSA-N 387.339 5.141 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC4(CCC4)[C@H]3c3ccco3)c2)cc1 454734550 XMPVIAABANDNEA-JOCHJYFZSA-N 399.450 5.703 30 20 GKED N#CCCC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)c1ccccc1 458809377 AIQAMDUPEKTNNX-KIHHCIJBSA-N 387.527 5.399 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 459867230 SUWIUTJOKOOIJQ-UHFFFAOYSA-N 381.785 5.003 30 20 GKED CCN(C(=O)NCc1cc(C#N)ccc1F)[C@@H](C)c1cccc(C(F)(F)F)c1 466193383 JBLZVTPHOXCZHG-ZDUSSCGKSA-N 393.384 5.009 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3csc(Cl)c3)c2)cc1 468112455 ZVOVEMMTYHCKKA-UHFFFAOYSA-N 382.872 5.299 30 20 GKED Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)c(OCc2ccccc2)c1 475031005 MLXWLUBGFHLSKK-QFIPXVFZSA-N 384.479 5.600 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 475260908 WRHIJOVPWPNQMI-HXUWFJFHSA-N 381.435 5.377 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)C[C@@H](CC#N)c3ccccc3)ccc2C)c1 476104828 NWMUUIUUEFVYMM-HXUWFJFHSA-N 385.467 5.517 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H](COc3ccccc3Cl)C2)cc1 476509692 QVAYJKKMDQBCMV-KRWDZBQOSA-N 396.918 5.072 30 20 GKED COC(=O)[C@@H](Nc1ccc(C(C)(C)C#N)cc1)c1cc(Cl)cc(Cl)c1 477531196 ZOMHZPAPPCBQOI-KRWDZBQOSA-N 377.271 5.121 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CCCc3c(O)cccc32)c1 480469802 DOYBATYCHMTZHC-DEOSSOPVSA-N 384.479 5.010 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(C)c(-c2ncco2)c1)c1ccc(F)c(F)c1 480963284 RNMOVPSDTNONRY-IBGZPJMESA-N 383.398 5.367 30 20 GKED C=CCn1c(SCc2sc(C)nc2C)nnc1-c1cccc(Cl)c1 481394778 XJOZTJUZYWWVHI-UHFFFAOYSA-N 376.938 5.150 30 20 GKED CCS[C@@H](C)c1noc(CN(C)Cc2ccc(-c3ccccc3C#N)cc2)n1 485979417 YTYWDTJUAISPAC-INIZCTEOSA-N 392.528 5.054 30 20 GKED N#CCCC[C@H](NC(=O)c1[nH]c2ccccc2c1Br)c1ccccc1 487212714 SQISAIUPSIKKKM-INIZCTEOSA-N 396.288 5.095 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496574058 PMXIVEXOGYPHHV-DEOSSOPVSA-N 383.495 5.328 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(Cl)c(C#N)c2)cnn1-c1ccc(Cl)cc1 498432971 KRLNBGNHIHCOJK-UHFFFAOYSA-N 399.281 5.426 30 20 GKED CC[C@H](CC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)cc1 502052454 YCHWFXDRENQYKH-DLBZAZTESA-N 382.529 5.469 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCC[C@H]2C(F)F)cc1F 505351026 OQLVCQWBKMPIHA-INIZCTEOSA-N 389.377 5.141 30 20 GKED C=CCc1cc(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)cc(OC)c1OC 506099031 YBRYPAITKXYORW-UHFFFAOYSA-N 394.496 5.117 30 20 GKED CCOc1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C(C)C)cc1 509550109 STHRBUINDLWPMK-UHFFFAOYSA-N 379.504 5.329 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c2[C@@H]1C 515795592 ITWFIEMNBGYYQH-ZIAGYGMSSA-N 388.496 5.015 30 20 GKED C[C@@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 519367922 LNILSQZOSZADSZ-JORMNFRLSA-N 387.508 5.015 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccccc2F)o1 520827732 ZAORLCQYDQTVLH-CQSZACIVSA-N 380.444 5.590 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)Nc1ccc(C(C)(C)C#N)cc1 522711725 MSHLYRGVCFIPHW-UHFFFAOYSA-N 399.494 6.019 30 20 GKED C[C@@H](NC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 525734268 KGJBVOIEGILCEV-SECBINFHSA-N 394.290 5.746 30 20 GKED N#Cc1cccc(CN[C@H](c2cccc(F)c2)c2cccc(Br)c2)c1 532092449 HAHKGGDUGXSCLF-NRFANRHFSA-N 395.275 5.339 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(N2CCc3ccccc3C2)cc1)c1ccccc1 532699961 OXLHCYMLCJOVQE-VWLOTQADSA-N 395.506 5.024 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCOc3ccccc32)cc1Cl 536427382 WQWPCUKDXYNTJM-UHFFFAOYSA-N 390.826 5.043 30 20 GKED CC[C@@H](C)n1ncc(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1C1CC1 536885858 NPJWEKVIEFBEKD-QGZVFWFLSA-N 398.510 5.200 30 20 GKED N#CCc1ccc(NC(=O)N[C@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 540821532 JRAYTXSLCDXTJZ-MOPGFXCFSA-N 387.405 5.229 30 20 GKED CC(C)(C)[C@@H]1CCc2nc3ccccc3c(C(=O)N3CCC(CC#N)CC3)c2C1 541981386 ADDPMCKYPVBUNP-GOSISDBHSA-N 389.543 5.152 30 20 GKED N#CCC1CCN(C(=O)c2ccc(-c3ccc(Br)s3)s2)CC1 543012117 GZLVLUYAZMMOPR-UHFFFAOYSA-N 395.347 5.005 30 20 GKED N#CCC1CCN(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)CC1 543821650 PPDOHNYLRYVOMY-HSZRJFAPSA-N 375.516 5.086 30 20 GKED Cc1ccc(C2CCN(C(=O)c3cccc(Nc4ccc(C#N)cc4)c3)CC2)cn1 544038239 PFWHUSAFCQOCRF-UHFFFAOYSA-N 396.494 5.025 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1cccc(CSCc2ccccc2)c1 554260319 KGKLZDYQBUNXLJ-UHFFFAOYSA-N 381.545 5.571 30 20 GKED CCc1nc2cc(CN[C@H](C)c3ccc(C#N)cc3Cl)ccc2n1C1CC1 558968631 RPSNVWGHANSZDT-CQSZACIVSA-N 378.907 5.309 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCCc3sc(-c4ccc(F)cc4)nc31)CC2 568453022 YIBZCNOCIRZEEY-VQTJNVASSA-N 389.499 5.475 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCc1ccc(C#N)cc1F 589787126 DWHLCMUDMAQENR-GOSISDBHSA-N 387.458 5.170 30 20 GKED N#Cc1ccc(C2(NCc3nnc(-c4c(Cl)cccc4Cl)o3)CCC2)cc1 594032643 YTSMOZFYXTUWGC-UHFFFAOYSA-N 399.281 5.084 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccsc1 609968257 RMWVYVYPSXMWIF-LIRRHRJNSA-N 380.900 5.799 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)c2cccc(C#N)c2)nc1-c1ccccc1 610112886 NQVSFXJPJKNYHB-FQEVSTJZSA-N 385.467 5.314 30 20 GKED CCN(C(=O)c1cc(NC(=O)C(C)C)ccc1Cl)[C@@H](C)c1ccc(C#N)cc1 610171359 PBSMTESOMUNLQJ-HNNXBMFYSA-N 397.906 5.029 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H](C)c1cccc(C#N)c1 610543461 WCGYMDPROKMGPU-ZIAGYGMSSA-N 395.915 5.118 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)C1 612308029 NLAQUUDPUAHZDX-JOCHJYFZSA-N 379.529 5.278 30 20 GKED C=C(C)CN(CC)C(=O)CNc1ccccc1Oc1ncc(Cl)cc1Cl 615051504 SCNHLSMWLIJAHH-UHFFFAOYSA-N 394.302 5.017 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1 619429853 HRJJBUIMCIDXDZ-UHFFFAOYSA-N 397.450 5.066 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 620304152 RGDSJHVPJUDEBP-OKILXGFUSA-N 377.362 5.168 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccc(F)cc1C(F)(F)F 622314871 GXKHODAGEPGDSS-UHFFFAOYSA-N 379.275 5.136 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3nc(C4CC4)cs3)s2)c(C)c1 647377351 FOTZOXQMYGSIJG-HNNXBMFYSA-N 379.510 5.251 30 20 GKED COc1cc2c(cc1F)CC[C@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 684953208 DPHYXUXYFZKTRH-OXJKWZBOSA-N 399.350 5.321 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccc(O)c(F)c1 728438986 SOELWYDWYHXXLI-WMZJFQQLSA-N 395.817 5.333 30 20 GKED CCCCCCCC(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 731649367 LUEWYJCTFPBRGD-UHFFFAOYSA-N 393.531 5.576 30 20 GKED CCCCCCCCC(=O)N1CCC(c2nc(-c3ccncc3)cs2)CC1 732121032 IIILKJLBZSVHOZ-UHFFFAOYSA-N 385.577 5.662 30 20 GKED CCCCc1ccc(NC(=S)NCc2cccc(O[C@H](C#N)CC)c2)cc1 733755593 WEQKCUMJRJRRIB-FQEVSTJZSA-N 381.545 5.197 30 20 GKED C=CC[C@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccncc1 734510658 YJZGOMLBESHJHC-QFIPXVFZSA-N 391.902 5.394 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1cc(-c2ccc(F)cc2)no1 735317554 CKJIONZEYIIOCT-UHFFFAOYSA-N 388.851 5.470 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1/C=C/C(=O)c1cnn(C(C)C)c1 746686667 INWNENDRTQOFCC-CMDGGOBGSA-N 389.286 5.161 30 20 GKED CC(C)CCCCCC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 749022949 LNVLEDANRUFOMN-HNNXBMFYSA-N 385.533 5.058 30 20 GKED CC[C@@H](Oc1ccccc1F)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 749025589 PVHXPXKNYAOOFW-IUODEOHRSA-N 388.851 5.123 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)CCc1c(C)nc(O)c(C#N)c1C 751256280 BIXAJZKHAGEFSX-UHFFFAOYSA-N 397.544 5.046 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3ccccn3)CC2)cc1 754404913 DHMNNFPEMFSNCR-QHCPKHFHSA-N 396.494 5.149 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 755755240 CTBJLKIEAJMHII-YWZLYKJASA-N 390.512 5.032 30 20 GKED C[C@H](OC(=O)c1c(F)cc(C#N)cc1F)c1ccc(Cl)c(C(F)(F)F)c1 759587550 LOHNCUVRVGMKNL-QMMMGPOBSA-N 389.707 5.427 30 20 GKED O=C(/C=C\c1cncc(Br)c1)c1ccc(SCC(F)F)cc1 767359423 GJWUGLOGTFZKGU-BHQIHCQQSA-N 384.245 5.097 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c(Cl)c1 780230305 NJAAYVLOWHTRES-UHFFFAOYSA-N 380.300 5.461 30 20 GKED C#CCCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 780313915 UCKNRCWWYRKKSJ-OAHLLOKOSA-N 391.323 5.877 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 783070797 XCFTVWURDXIICW-BXUZGUMPSA-N 396.434 5.277 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cncnc2-c2ccccc2)cc1 783422717 XTEIMJDXHDKXSM-QFIPXVFZSA-N 390.446 5.051 30 20 GKED C=CC[C@H](C(=O)O[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784832177 JVUSXJAWTUUGOG-KDOFPFPSSA-N 382.847 5.354 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1COC2(CCCCCC2)O1 789450291 MRVRENGGTABQLX-LJQANCHMSA-N 386.536 5.126 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(-c3cccc(F)c3F)o2)cnn1-c1ccccn1 790219906 OITBXFUHCFIDBB-CSKARUKUSA-N 391.377 5.010 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)cn1 792886511 UXJZOWFMXKXWKL-TWGQIWQCSA-N 389.842 5.183 30 20 GKED C/C(C=Nn1cnc2sc(C)c(C)c2c1=O)=C\c1ccccc1C(F)(F)F 799866967 BNVUPXXJSYDJMX-UMIKJDJESA-N 391.418 5.031 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccc(F)c2)CCCCC1)c1nc2ccccc2o1 805862155 ZUXULJQGKHZKHJ-GOSISDBHSA-N 376.431 5.336 30 20 GKED CCC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccn1 810530687 CORHWSDNVYXSEY-MSOLQXFVSA-N 375.497 5.274 30 20 GKED CN(C)Cc1cnc(/C=C\C(=O)c2ccc(-c3c(F)cccc3F)cc2)s1 811697719 MKFLOLFHRQMSIW-KHPPLWFESA-N 384.451 5.046 30 20 GKED C=CCCCCCCCNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 811927935 UCUHIMSHVUBKQU-UHFFFAOYSA-N 392.490 5.096 30 20 GKED O=C(/C=C/c1cnc(-c2ccc(Cl)cc2)s1)c1cc([N+](=O)[O-])ccc1F 814192115 YEIICJDTKNTNGT-SOFGYWHQSA-N 388.807 5.407 30 20 GKED COc1cccc(NC(=O)/C(=C\c2ccc(Cl)s2)C(=O)c2ccccc2)c1 834755427 GHGSMWNSBPYSTA-AQTBWJFISA-N 397.883 5.315 30 20 GKED CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 838604713 WHTPHFFDKALXSQ-QHCPKHFHSA-N 392.547 5.108 30 20 GKED CSCCCCCCC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 858445473 KRLVFFHIKMQRJS-UHFFFAOYSA-N 383.517 5.306 30 20 GKED CCC[C@H](C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Cl)c1cccc(Cl)c1 860468952 GRNVGNDIOVNCJU-JKSUJKDBSA-N 389.282 5.225 30 20 GKED CCN(C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)[C@@H](C)c1ccc(C#N)cc1 914509699 XZQKBMRGRYNIMQ-AHKFDXCISA-N 389.886 5.383 30 20 GKED CCOc1ccc(O)c(/C=N/C2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 914703087 ODGMGFGHNHIZBH-TZPQHZNJSA-N 383.332 5.119 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1ccccc1Cl 916262533 PMAYYVQXPUDQNX-UHFFFAOYSA-N 377.250 5.132 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccc2ccccc2n1 916848893 KHBKIRDWBULPHU-INIZCTEOSA-N 383.278 5.741 30 20 GKED Sc1nnc(-c2cccc(Cl)c2)n1N=Cc1ccc(-c2ccccc2)o1 917539627 DDWGLPJNCAVDGW-UHFFFAOYSA-N 380.860 5.029 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920804819 ZWLZJRZILUBFBM-HUUCEWRRSA-N 382.435 5.458 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2ccc(OC)c(OCc3ccccc3)c2)c1C 920927845 VUAINWMIBSUQOO-QBFSEMIESA-N 390.483 5.004 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 921164697 OHTUDOCFDFFXSM-UHFFFAOYSA-N 388.364 5.231 30 20 GKED O=C(O)c1cccc(C=NN(Cc2ccccc2)Cc2ccccc2)c1Cl 1776023134 LNUXKIINTCRHQA-UHFFFAOYSA-N 378.859 5.075 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2C(=O)O)cc1)c1ccc2ccccc2c1 1776131145 IXPUEYBVHAKEMT-LFIBNONCSA-N 378.427 6.101 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)c1ccc(OC)c(CC(=O)O)c1 1776131909 VGURQRBGIURXOS-VAWYXSNFSA-N 392.451 5.307 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2csc(-c3ccc(C(C)C)cc3)n2)CC1 1776169961 ZYWIIDXJFKUNNP-UHFFFAOYSA-N 398.572 5.567 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)cc(Br)c1 1776782825 FLDZEJNCSGFPMD-INIZCTEOSA-N 390.749 5.396 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C)cc1)=C(/S)Nc1ccc(C)cc1 22730889 RLQYNRMKFTWQIZ-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCn1c(SCc2csc(Cc3ccccc3)n2)nnc1-c1ccco1 31654698 FJFCCJKBYOZXIL-UHFFFAOYSA-N 394.525 5.064 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1cccc(OCCCC#N)c1 55569468 WRCAOPRMHDYADR-UHFFFAOYSA-N 383.498 5.115 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 66037373 RLLZTSWVZQENKE-UHFFFAOYSA-N 399.450 5.197 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CSc3ccccc3C)n2)cc1 66543912 BGAAAAKSWGCTLV-KRWDZBQOSA-N 394.521 5.096 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(F)cc2)o1)[C@H](C)c1ccc(C#N)cc1 105907776 YTVMZUNEAPJKGE-MRXNPFEDSA-N 392.430 5.093 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC=C(c2ccc(F)cc2)CC1 108530621 PGJJZUGGLCKMPL-INIZCTEOSA-N 395.503 5.399 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](Cc2ccccc2)C1 173123948 UBBHZMDWHSSNPT-HKUYNNGSSA-N 379.529 5.177 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(C(F)(F)F)c1F 175778655 LBNXJKIZZGFWTR-LLVKDONJSA-N 382.382 5.349 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 184012365 IPOGSPNCNBZEIZ-INIZCTEOSA-N 398.422 5.285 30 20 GKED C[C@@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1 185019268 PGFGQUGDQPFEGK-KUHUBIRLSA-N 377.488 5.549 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1C1CCN(C(=O)[C@@H](C)CC(=C)C)CC1 192990047 VBFBYIGVGRUMHQ-PMACEKPBSA-N 396.575 5.536 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1ccc([N+](=O)[O-])cc1 211368463 VHVOHDFCPYZOFQ-QXMHVHEDSA-N 395.846 5.006 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 303507160 SGFGYALIHKJQMJ-UONOGXRCSA-N 391.323 5.741 30 20 GKED OC1=NCCc2c1ccc(N=C(O)C1(c3cccc(Cl)c3)CCCC1)c2F 328930947 ZJTAOHPIDHMVDI-UHFFFAOYSA-N 386.854 5.440 30 20 GKED CC(C)(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 329207949 YNGDPWYTHXQURF-YSIASYRMSA-N 391.577 5.594 30 20 GKED Cc1cnc([C@H](/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)C2CC2)s1 329439079 KMCFYNIBNAGWLR-IEBWSBKVSA-N 398.576 5.366 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1sc2c(c1C#N)CCCCC2 390217789 ZOBVJFVUGRSMRX-UHFFFAOYSA-N 389.318 5.212 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@H]2C 410980790 NFLYEIKZVVAFEU-NWDGAFQWSA-N 395.484 5.043 30 20 GKED C=CCC[C@@H](NC(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1)c1ccccc1 413392736 DHFMOUYEAGXIDO-PKTZIBPZSA-N 390.527 5.257 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1nc(C(C)(C)C)cs1 431939793 TYNSZFNQAICTNX-RDJZCZTQSA-N 384.549 5.236 30 20 GKED Cc1c(C#N)cccc1NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12 432325774 MKMLCXCXJYWTGH-CYBMUJFWSA-N 381.888 5.188 30 20 GKED N#CCCC[C@H](NCc1coc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 433026459 FKLAXSPSEPOOJU-FQEVSTJZSA-N 399.416 5.885 30 20 GKED Cc1ccccc1CCCSCC(=O)Nc1ccccc1SC[C@@H](C)C#N 439877563 XTQOTBHSYHUJSG-KRWDZBQOSA-N 398.597 5.551 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nc(C3CCCC3)no2)cc1F 443464344 WAPPEACTQMSAMS-UHFFFAOYSA-N 378.407 5.142 30 20 GKED CC(C)(C#N)CCCCN1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 444664416 QSHHZDPQPGTVSV-QGZVFWFLSA-N 386.927 5.289 30 20 GKED FC(F)(F)Cn1ccc(CNc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 453059720 NAGIYOVWEAGGKS-UHFFFAOYSA-N 391.237 5.095 30 20 GKED C=CCC1(NC(=O)Nc2cccc(C[S@@](=O)C(C)(C)C)c2)CCCCC1 454800318 PZLWBOQYGVVLOD-AREMUKBSSA-N 376.566 5.134 30 20 GKED COc1ccc(-c2csc(NC(=O)[C@H](C)c3cccc(C#N)c3)n2)cc1Cl 461794986 JNJNTPANCONHDV-GFCCVEGCSA-N 397.887 5.086 30 20 GKED C[C@@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1ccccc1OCc1ccccc1 461934314 QIMQDQWBKKROBN-RTBURBONSA-N 384.479 5.118 30 20 GKED CCN(C(=O)[C@@H](C)c1cccc(Br)c1)[C@H](C)c1ccc(C#N)cc1 462143685 ZJZHKSIAOJEIEQ-LSDHHAIUSA-N 385.305 5.034 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 470621718 CZDAOEBLSDCUCL-HQJQHLMTSA-N 393.249 5.137 30 20 GKED Cc1nc(CNC(=O)c2ccc(C(C)(C)C#N)cc2)oc1-c1ccc(Cl)cc1 476274649 FJKFHEDVOGDMGU-UHFFFAOYSA-N 393.874 5.035 30 20 GKED C=C(C)[C@H](NC(=O)NCc1csc(-c2ccccc2)n1)c1ccc(F)c(F)c1 477204597 KMOJJAJSDFIKHK-IBGZPJMESA-N 399.466 5.205 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](CC)c1ccccc1OC 482078253 QDCAHAWTPPIJQT-OAQYLSRUSA-N 380.532 6.162 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)N(C)Cc1ccc(C#N)cc1 482103785 WTDKOTZBNNIKHH-UHFFFAOYSA-N 386.451 5.021 30 20 GKED C=C[C@@H]1CCCCN1C(=O)c1cc(-c2ccccc2C)nc2c1cnn2C(C)C 488847609 BITXIXFCEAWWGW-GOSISDBHSA-N 388.515 5.168 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C)c(OCC2CCOCC2)c1)c1ccccc1 489006661 DCAAMLCXCPSILA-JOCHJYFZSA-N 379.500 5.099 30 20 GKED C=C(C)Cn1c(S[C@@H](C)c2ccc(F)c(Cl)c2)nnc1-c1ccncc1 489431679 HCCWPIUORLWQKE-ZDUSSCGKSA-N 388.899 5.562 30 20 GKED Cc1nn(-c2ccccc2)c2sc(C(=O)Nc3ccc(C#N)cc3Cl)cc12 494631658 MOFXICIWVAERFM-UHFFFAOYSA-N 392.871 5.173 30 20 GKED C[C@@H](NC(=O)N1CCC(F)(C#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 500898306 YGRYWMPSDIWVHV-CYBMUJFWSA-N 391.899 5.167 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC(c3ccccc3)CC2)c1 502435234 BDZVNMJVHYXMOG-UHFFFAOYSA-N 396.490 5.157 30 20 GKED CCSCc1cccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 503486611 JPOLOMQYNUONJZ-UHFFFAOYSA-N 377.513 5.133 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N[C@H](c1c(F)cccc1F)C(F)(F)F 506924048 YEYADISEIIXINB-CYBMUJFWSA-N 380.263 5.328 30 20 GKED CCN(Cc1cn(C)nc1-c1ccccc1Cl)[C@H](C)c1ccc(C#N)cc1 508602397 DDDAXBSJQVQOGT-MRXNPFEDSA-N 378.907 5.195 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc(Cl)cc(Cl)c2)cc1 510965344 FADGALSMGWUJKG-UHFFFAOYSA-N 387.188 5.070 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](c2ccccc2)[C@H](C)CC)cc1 511747979 FPONHJUGJOVZGV-AUSIDOKSSA-N 390.527 5.269 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc([C@H]2CCC[C@@H](C(F)(F)F)C2)n1 512034107 ZLTKHXLHVKNQEO-CYZMBNFOSA-N 396.306 5.983 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccc(Cl)c2)n1)c1nc2ccccc2s1 513676712 JLEUYOUYJCBGSG-CYBMUJFWSA-N 395.896 5.563 30 20 GKED CC(C)(C)c1ncc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)s1 517879039 GBQQLOTXKGQEEQ-UHFFFAOYSA-N 391.496 5.144 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 518398816 HOLGALLIBOYBTK-QFIPXVFZSA-N 383.451 5.031 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)(C)c1ccccc1 520197925 UEWFSIPEVUYLRM-SJORKVTESA-N 381.545 5.569 30 20 GKED C[C@@H](NC(=O)Nc1ncc(Cc2ccccc2Cl)s1)c1ccc(C#N)cc1 520385967 FJSOUUVPAUDTTQ-CYBMUJFWSA-N 396.903 5.142 30 20 GKED C=C1CCN(C(=O)c2ccccc2Sc2ncnc3sc(C)c(C)c23)CC1 520822721 DWZHDLFCKPEQNB-UHFFFAOYSA-N 395.553 5.252 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(C#N)cc2)ccc1OCc1cccs1 520960703 KTQWTSQXOPNLSE-INIZCTEOSA-N 378.497 5.058 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2c(F)cccc2F)n1)c1nc2ccccc2s1 522527922 DDUMVAXPDABRBB-JTQLQIEISA-N 397.431 5.188 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)c2ccccc2Sc2ccccc2C#N)C1 522669712 DOSGTUSFBJQBOD-IRXDYDNUSA-N 382.554 5.113 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)c1ccccc1 527215544 KVJLLCIYRIIBHE-OALUTQOASA-N 389.524 5.090 30 20 GKED CC[C@](C)(C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 532072688 FZSBKYINRMBTQQ-HSZRJFAPSA-N 389.524 5.137 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCC(F)(F)F)cc1Cl 537743807 ADNLTIZYWQDTSC-MRXNPFEDSA-N 380.797 5.667 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)NCCC(C)(C)C#N 541642229 JSVFLFOVDXDWSQ-LBPRGKRZSA-N 392.366 5.472 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2CCO[C@H](c3ccc(F)cc3)C2)CC1 543618757 VUNHFOHAVOYKJU-XZZNXKJUSA-N 378.491 5.040 30 20 GKED Cc1sc([C@H](C)NCc2ccc(F)cc2C#N)nc1-c1ccc(Cl)cc1 544471334 YCMCWJMUBFULPJ-LBPRGKRZSA-N 385.895 5.634 30 20 GKED C=C[C@@H](Cc1nc([C@H](OC)c2ccc(Br)cc2)no1)c1ccccc1 545103764 CRXOAESDYIJFSY-IFXJQAMLSA-N 399.288 5.080 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 546219903 NXANPMDECRUSIV-MRXNPFEDSA-N 392.446 5.311 30 20 GKED C=CC[C@H](C(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 547954276 FLGMTGOBPYDTNM-DVECYGJZSA-N 386.495 5.198 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCc2cc(Br)ccc21)c1ccccc1 556203382 MBDMBDGGQHSVQH-NHCUHLMSSA-N 383.333 5.851 30 20 GKED CCN(Cc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1)C(C)C 558195896 JCEMIGVTLWSCLV-GOSISDBHSA-N 383.561 5.161 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ocnc3-c3ccccc3)c2C#N)[C@H](C)C1 562700016 XIMBJNPZGDACEV-QWHCGFSZSA-N 377.469 5.213 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 566526634 MQRHDGJTSXUXHB-OXJNMPFZSA-N 397.544 5.562 30 20 GKED COc1cccc([C@@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)c1 566827306 VSTMMVVWNFPWHJ-BJKOFHAPSA-N 388.898 5.587 30 20 GKED N#CCCCn1cc(-c2nc(CSCc3ccco3)no2)c2ccccc21 571718211 MWIFHFIHLMGCDT-UHFFFAOYSA-N 378.457 5.021 30 20 GKED CCC(CC)N(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@H]1CCCc2cccnc21 580762198 RABRWSCCWJJRBV-ZRBLBEILSA-N 387.527 5.152 30 20 GKED N#Cc1nnc2ccccc2c1Oc1cc(Br)cc(C(F)(F)F)c1 581033541 MNVZUWYHJDOGNR-UHFFFAOYSA-N 394.150 5.075 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(Cl)c2ncccc12)c1ccccc1 590104793 YXAIXWYDCBIGFG-GOSISDBHSA-N 378.863 5.445 30 20 GKED COCC[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 594947516 APHYGNZYHZALFQ-FQEVSTJZSA-N 388.433 5.128 30 20 GKED COc1cccc(SCC(=O)Nc2sc3c(c2C#N)CCCCCC3)c1 603996127 BDMOUVARPLHWJQ-UHFFFAOYSA-N 386.542 5.018 30 20 GKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1nnc(-c2ccccc2)o1 604044390 KACOETAUJCNZEN-QGZVFWFLSA-N 396.450 5.360 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)c1C#N 609032608 UABDKKFJAJSDLV-ZIAGYGMSSA-N 378.419 5.252 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccccc2c1Cl)c1cccc(Cl)c1Cl 609414105 KMSSEAQYIYBMDL-CYBMUJFWSA-N 378.646 5.123 30 20 GKED CCCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)c1ccc(C)o1 609436624 BVLLRNKKLFNGDC-MSOLQXFVSA-N 399.560 6.378 30 20 GKED Cc1sc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(C#N)c1C 609496464 ZFOVKZZKXNHFGP-UHFFFAOYSA-N 387.464 5.347 30 20 GKED N#Cc1c(NC(=O)CCc2ccnc3ccccc23)sc2c1CCCCC2 609910916 SPMDXVHCIFXSCT-UHFFFAOYSA-N 375.497 5.008 30 20 GKED C[C@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 610224793 RVRFKFITCHLFRF-AWEZNQCLSA-N 376.378 5.130 30 20 GKED C[C@H](NC(=O)Nc1cc(Cl)ccc1N1CCCCC1)c1cccc(C#N)c1 610317763 QXJZSRVUUCMNNP-HNNXBMFYSA-N 382.895 5.085 30 20 GKED C[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1cccc(C#N)c1 610496932 PBGVEOPMNBXCHX-MRXNPFEDSA-N 383.476 5.072 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccccc1 610973314 UAZIPGUHMKILSC-INIZCTEOSA-N 397.347 5.507 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 614897760 ZKCTXWFXHMXTQS-UHFFFAOYSA-N 396.796 5.465 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc2cc(F)ccc2s1 670118785 SURBOEHAQTXECX-ZDUSSCGKSA-N 381.819 5.127 30 20 GKED C=CCC[C@H](NC(=O)N(C)CCC(F)(F)F)c1ccc(C(F)(F)F)cc1 676727629 XRDVVBYOXKBTII-AWEZNQCLSA-N 382.348 5.307 30 20 GKED C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 682089727 CIJUNKCIVALEQF-MNOVXSKESA-N 397.334 5.066 30 20 GKED Cc1cc(C(=O)Nc2ccc(Cl)cc2Cl)c(C)n1-c1ccc(C#N)cc1 728266432 TXKMHXSLCFVGGI-UHFFFAOYSA-N 384.266 5.525 30 20 GKED CC(=NNc1ccc(Br)cc1F)c1[nH]c(-c2ccccc2)nc1C 728432102 IUALXTBOSZZJLS-UHFFFAOYSA-N 387.256 5.123 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(N(C)CCCC)cc1 730667980 NOGZXCSHAKQUOV-UHFFFAOYSA-N 381.520 5.152 30 20 GKED CCN(CC)c1ccc(C=Nc2ccc(Oc3ccc(Cl)nn3)cc2)c(O)c1 733204956 FNFGAUZRZVWPEY-UHFFFAOYSA-N 396.878 5.225 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc3c(Cl)cccc3s2)c1 733773011 LJNZOMVMOPDFOS-CQSZACIVSA-N 384.888 5.166 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2c(OC(F)F)ccc3ccccc23)c1 733800084 GVOVEPRUCPPJQI-SFHVURJKSA-N 396.437 5.412 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCOc3ccc(C(C)(C)C)cc3)[nH]c12 735792402 LGSCMBWYUNFFOZ-LJQANCHMSA-N 389.499 5.204 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 739143930 TYTYRWMVEMBISE-KDOFPFPSSA-N 382.385 5.309 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3c(F)cc(F)cc3F)c2)s1 743220373 KXZWIFMZLNRPGM-UHFFFAOYSA-N 387.386 5.026 30 20 GKED O=C(/C=C\c1cncc(F)c1)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750207442 SPCMQVZVBLOYQT-XVWMLYKFSA-N 393.258 5.100 30 20 GKED COc1cc(/C=C2/CSc3c(F)cccc3C2=O)ccc1OCC(F)(F)F 750903388 BVLFGADYPCHIBI-GHXNOFRVSA-N 398.377 5.147 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCCc1cc(C)sc1C 753392874 FMLSYCPSUDEWNY-HXUWFJFHSA-N 396.556 5.160 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)c1cccc(N2CCOC2=O)c1 753712837 VBKVUNWQEWYYIJ-QPJJXVBHSA-N 395.764 5.212 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc3[nH]c(-c4cccs4)nc23)cc1 759636007 KLXZPHSVQKCZRT-UHFFFAOYSA-N 386.480 5.160 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)c1nc(-c2ccc(SC(C)(C)C)cn2)no1 762391261 QUQYLRNWBYFUTP-ZDUSSCGKSA-N 380.473 5.034 30 20 GKED C[C@@H](NCc1ccc2c(c1)COC(C)(C)O2)c1ccc(-c2cccc(C#N)c2)cc1 769550120 AJGQQMGNVWPNLG-GOSISDBHSA-N 398.506 5.721 30 20 GKED Cc1scc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1C 773772575 WSXKJVHGSDFAEL-KRWDZBQOSA-N 390.464 5.118 30 20 GKED CC[C@H](Nc1ccc(OCC(=O)N(CC)CC)c(Cl)c1)c1ccc(C#N)cc1 774282987 RMVSIOPDIFPQFJ-FQEVSTJZSA-N 399.922 5.022 30 20 GKED Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(C)(C)C#N)c3cnn(C(C)C)c3n2)s1 777333196 GWHVNFFPLRIGTN-AWEZNQCLSA-N 396.516 5.144 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(OC(F)F)cc3)cs2)cc1 796992529 WMGGCNLTOCSSQI-WDZFZDKYSA-N 387.407 5.316 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccc(OC(=O)CCCCCC#N)cc2)cc1 805855856 RBDARYZZUOISBR-UHFFFAOYSA-N 392.499 5.616 30 20 GKED N#C[C@H](C(=O)CCSc1cccc(Cl)c1)c1nc(-c2ccncc2)cs1 808980395 APAKHEMZEJTUJN-MRXNPFEDSA-N 399.928 5.217 30 20 GKED C#C[C@@H](NC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C)c1ccc(Cl)cc1 811961935 HPFTUTDIUNKPKB-WMLDXEAASA-N 389.952 5.305 30 20 GKED CC(C)c1noc2ncc(C(=O)OCc3ccc(-c4ccccc4C#N)cc3)cc12 818102039 HZHGKIDLOKHPDB-UHFFFAOYSA-N 397.434 5.242 30 20 GKED CC[C@@H](c1ccc(F)cc1F)[S@](=O)Cc1c(F)c(F)c(F)c(F)c1F 841720100 GFOPQUDGCQHNNJ-JPQMIFPKSA-N 384.316 5.060 30 20 GKED N#C[C@@H](NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccc(F)cc1 841740757 KVJLHUXXIRIOAC-LEVJEWGPSA-N 380.419 5.088 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cnc(Cl)c(C(F)(F)F)c1)c1ccccc1 841796853 QKWOBALSOFBPIR-HNNXBMFYSA-N 396.800 5.310 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2SCCCS2)cc1)c1nc(C2CC2)cs1 842939974 ZKPSCDNVHLQRSJ-HNNXBMFYSA-N 386.567 5.379 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)sc2[nH]1)C(=O)c1cc2c(s1)CCCC2 845835090 YGCAPKLNNCMOOL-LLVKDONJSA-N 388.901 5.028 30 20 GKED O=[N+]([O-])c1cc(NN=C(CCC(F)(F)F)CCC(F)(F)F)ccc1F 853334449 FPEYVZONTBPBES-UHFFFAOYSA-N 375.244 5.187 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(-n2cccn2)cc1 874066479 HVFROKLMGWREDQ-UHFFFAOYSA-N 380.666 5.064 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3c[nH]c4ccccc34)c2)cc1 915271462 WIIDMCVZTDRABL-ZROIWOOFSA-N 396.446 5.325 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 915353209 RPVCWESVUDABCZ-SGIRGMQISA-N 387.527 5.775 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1cccc(Cl)c1 916333738 SNKNTWRNTWMPSK-UHFFFAOYSA-N 383.691 5.076 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCOc2cccc(C)c2)cc1 916956008 WSLUROKUMJJCKC-AVRDEDQJSA-N 392.499 5.015 30 20 GKED CC(=NNc1ccc2ccccc2n1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776018941 NHIQBBWOFBWABW-UHFFFAOYSA-N 397.434 5.561 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(OCc3ccc(F)cc3)cc2)ccc1Cl 1776033481 OLKGXAJFUAGDTD-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(=NNc1cc(Cl)cc(Cl)c1)c1cccc(OCCCC(=O)O)c1 1776058447 GMMIECJQSFDDJR-UHFFFAOYSA-N 381.259 5.073 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(O)c(C(=O)O)c2)cc1 1776125501 KEUKNNVENABIEH-KYTCBBFDSA-N 396.483 5.582 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)cc1 1776699918 GRGPWFWDSALRCA-QGQQYVBWSA-N 387.273 5.557 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C)c2nc(C(=O)O)c(C)s2)c1 1776787864 AJBNVKMGUZBNIO-HNNXBMFYSA-N 390.549 5.350 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1777372614 OBESNOWCLTWDLS-DTHVTWRFSA-N 388.419 5.112 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(F)cc2F)cs1 54897406 LPSJJOBLEWXYPM-UXBLZVDNSA-N 398.434 5.310 30 20 GKED N#CCSCC(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 56461067 FBGDRCVJCGJVAA-UHFFFAOYSA-N 385.247 5.120 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CC1 115770743 RRCVHHOGPZERLX-UHFFFAOYSA-N 383.879 5.022 30 20 GKED C=C[C@H](CC(=O)Nc1c(C)cccc1-c1nc(C(C)C)no1)c1ccccc1 124699625 SRVLBGVYERMCGI-QGZVFWFLSA-N 375.472 5.467 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1)c1ccccc1 135042916 HULVQHZQOCQHQQ-WTYVLRPYSA-N 395.568 5.566 30 20 GKED Cc1nc(C(C)(C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)sc1C 150968211 FLOANRACAGWGJA-GFCCVEGCSA-N 388.562 5.069 30 20 GKED CC[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 151795937 UPIZPKKRXUMRTQ-OAQYLSRUSA-N 382.460 5.286 30 20 GKED CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 175362963 LXOKCIWQJBLTLR-ARFHVFGLSA-N 377.579 5.267 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCSCC[C@@H]1C 192137889 UVFOAOLMJXQXQE-INIZCTEOSA-N 381.501 5.018 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)cs1)C1CC1 217202941 NVEDTOWAJOSKER-SDNWHVSQSA-N 394.540 5.602 30 20 GKED N#CC1(CCCN[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CCOCC1 281208909 CZJUZZIAIHFIMA-PKOBYXMFSA-N 380.454 5.032 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 303023930 MIVGXBGTWDIDFC-SFHVURJKSA-N 385.467 5.884 30 20 GKED Cc1cccc([C@H]2CCCN2C(O)=Nc2nc(C3CCOCC3)cs2)c1C 329464414 UXYAEOMTLSACSC-LJQANCHMSA-N 385.533 5.037 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1c1nc2ccccc2s1)c1ccccc1 375682249 FCEMEXYAMKRZGV-HKUYNNGSSA-N 375.497 5.047 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1CCC[C@H]1c1ccc(F)cc1F 424258823 XERAOHKPQSVZHP-ROUUACIJSA-N 390.503 5.042 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c(Cl)c1 426133625 MBOSCHVIXAUEBN-HXUWFJFHSA-N 378.863 5.452 30 20 GKED N#Cc1ccccc1SCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 439687985 DXXCUHAGRSCSIA-KRWDZBQOSA-N 391.323 5.321 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)S[C@H](C)c1cccc(C#N)c1 443158788 PTMZFEKJCXZXKI-ZIAGYGMSSA-N 388.920 5.350 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H](c2ccccc2)CC1)c1ccccc1 458799709 JUASYSJXEWQNGT-GMAHTHKFSA-N 375.516 5.401 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 459784187 ASLAFMLHASRFRD-CABCVRRESA-N 387.936 5.024 30 20 GKED COCCN(C(=O)c1oc2c(ccc3ccccc32)c1C)c1ccc(C#N)cc1 460367749 WMWWFKORNUEZRO-UHFFFAOYSA-N 384.435 5.059 30 20 GKED N#CC[C@H](CC(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1ccccc1 467840948 SRYWJPQSOZLSKX-KZNAEPCWSA-N 387.310 5.443 30 20 GKED CC(C)N(Cc1cccc(F)c1)C(=O)c1cn(CCCC#N)c2ccccc12 468943525 KAJQWCBTOUWHSD-UHFFFAOYSA-N 377.463 5.135 30 20 GKED CCC[C@H](Cc1ccccc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468988784 MRZOOMXWPMWLQY-OAQYLSRUSA-N 375.516 5.093 30 20 GKED Cc1ccc(-c2cccnc2)cc1N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1 479822670 FTDSSNKPXJWWEC-HNNXBMFYSA-N 390.874 5.021 30 20 GKED Cc1ccccc1[C@H](C)SCC(=O)Nc1ccccc1S[C@H](C)CC#N 480380078 AYHRGCHVPWTBTE-SJORKVTESA-N 384.570 5.822 30 20 GKED C[C@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)c(F)c1 480750415 RPRKWNFSKIPMAZ-WLRWDXFRSA-N 391.259 5.401 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1cc(Cl)cc(Cl)c1 481823191 WTUDFLKYBQVWTG-UHFFFAOYSA-N 379.312 5.570 30 20 GKED CC(C)Cn1c(SCc2ccc(F)cc2C#N)nnc1-c1ccccc1F 483122560 POSJWPBKYHEDGO-UHFFFAOYSA-N 384.455 5.043 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccco1)c1ccc(F)cc1F)c1ccccc1 483354192 GMGSKUSXXFJOPV-KRWDZBQOSA-N 380.394 5.179 30 20 GKED Cc1c([C@@H](NC(=O)N[C@@H](C)c2ccc(C#N)cc2)C(C)C)oc2ccccc12 483778032 XZSHAJTZZKXIBT-KKSFZXQISA-N 375.472 5.370 30 20 GKED Cc1ccc(NCc2ccccc2C(C)(C)C#N)cc1OCC1CCOCC1 486570793 ABIWYHJWDKBRNG-UHFFFAOYSA-N 378.516 5.214 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC(C(=O)c2ccc(Cl)cc2)CC1 487394859 KNIKYYMROQPORO-UHFFFAOYSA-N 380.919 5.236 30 20 GKED Cc1ccc(C(C)(C)CC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1 487884273 LGAKGVFPBFNRFE-UHFFFAOYSA-N 388.433 5.126 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cc(Cl)cc(C(F)(F)F)c1 488391652 ZDVIJGDZFVVETI-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccccc1C(C)(C)C#N 488674350 KGDYCNCJPOECMP-UHFFFAOYSA-N 388.540 5.148 30 20 GKED Cc1ccccc1-c1noc([C@H](C)Sc2nc(C(F)(F)F)ccc2C#N)n1 488771593 XSZHAQYIPKBCHJ-NSHDSACASA-N 390.390 5.184 30 20 GKED C=CCn1cccc1C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 488974532 JJMUCRCGTMCVCQ-IBGZPJMESA-N 389.499 5.430 30 20 GKED C=CCC[C@H](C(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1 490200720 IWDJCDXCEXKYDL-RJGXRXQPSA-N 381.491 5.254 30 20 GKED CCc1c(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1CCC(C)C 494753578 PGVARVHBYDCFIW-INIZCTEOSA-N 399.564 5.387 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)CSCc1ccc(Cl)cc1Cl 500613053 SWKDLTWMTLSUNT-UHFFFAOYSA-N 395.311 5.136 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(F)c1 500741170 GNOLYVFCVKQHSS-UHFFFAOYSA-N 376.387 5.059 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N(Cc1ccco1)c1ccccc1C#N 500995334 IXNLPRQFBFWKKJ-UHFFFAOYSA-N 389.436 5.023 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cc(C)ccc1C 502659295 BFXIZMKVVQSZQE-UHFFFAOYSA-N 391.284 5.425 30 20 GKED N#Cc1c(NC(=O)c2nc(-c3ccccc3)cs2)sc2c1CCCCC2 504556180 SEERFYVAJCUHHW-UHFFFAOYSA-N 379.510 5.264 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2ccsc2)c2ccccc2)cc1 505308680 TWUPERBLOUSERV-UHFFFAOYSA-N 378.522 5.086 30 20 GKED Cc1ccc(Br)cc1-c1noc(-c2cccc(SCC#N)c2)n1 508678064 JBTGOGONLWICOK-UHFFFAOYSA-N 386.274 5.090 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)c2ncccc12 509477203 GERBMPJFELKFON-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC(=Cc2cccc(F)c2)CC1 515593688 LMGQBFHYVJWRSP-UHFFFAOYSA-N 396.465 5.684 30 20 GKED N#Cc1c(NC(=O)Cc2ccccc2Cl)sc2c1-c1ccccc1CC2 515625480 UBQNGHGFJNJUOQ-UHFFFAOYSA-N 378.884 5.220 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)oc2c(Cl)cccc12 516767721 QXTYMZUQTNGJNH-AWEZNQCLSA-N 393.855 5.403 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 518256157 NWSLNXCMGZDBTP-XOBRGWDASA-N 399.947 6.007 30 20 GKED CCOc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(C)c1 520323641 OYKIJMCLRGBMGX-UHFFFAOYSA-N 386.451 5.504 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 524147196 YHLKARLLQWTHPS-DEOSSOPVSA-N 399.494 5.146 30 20 GKED C[C@H](N[C@H](C)c1cc2ccccc2s1)C(=O)Nc1sc2c(c1C#N)CCC2 526944635 IELVUWLQUXVDCH-OLZOCXBDSA-N 395.553 5.001 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 531456539 GDXOEKMOUNTSAO-RBBKRZOGSA-N 377.488 5.086 30 20 GKED N#CCc1ccnc(NC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)c1 531670261 ZKZVUICHOINMRY-HXUWFJFHSA-N 393.899 5.273 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 533993756 DBFQIKWIWHYFBT-QRWLVFNGSA-N 379.891 5.240 30 20 GKED CCN(C(=O)c1cc(Br)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 535211972 UQAMZUUJPUXAMX-UHFFFAOYSA-N 397.194 5.006 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 539098141 GTUNQGXGLNTNQE-SFHVURJKSA-N 392.808 5.306 30 20 GKED N#CC1(c2ccc(C(=O)N[C@H](c3ccc(Cl)cc3)c3cccs3)cc2)CC1 539636057 HDAIFADACUCFLW-HXUWFJFHSA-N 392.911 5.476 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(COc3ccccc3)cc2)C2CC2)cc1 542381484 BEQHOOJOVZROTQ-UHFFFAOYSA-N 397.478 5.334 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 543668038 LKEAABWJYWFWHL-VABKMULXSA-N 396.506 5.395 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@@H]3/C=C/c3cccs3)o2)c1 543988657 VDJVUAIQGZKEST-GNISGLHKSA-N 390.512 5.128 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@H]3/C=C/c3cccs3)o2)c1 543988659 VDJVUAIQGZKEST-VYENPZKTSA-N 390.512 5.128 30 20 GKED N#CCCn1cc(/C=C\c2nc([C@H]3CCOc4ccccc43)no2)c2ccccc21 545691222 RGDKSQOTPMZEGG-PISNEZEASA-N 396.450 5.023 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cc(C#N)cc(N(C)C)c2)cc1)c1ccccc1 555696976 IMFGBHNRCSPCCK-QGZVFWFLSA-N 384.483 5.050 30 20 GKED CC(C)(CCC#N)CNc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 560289788 XKVKUHXODDBESO-QFIPXVFZSA-N 375.516 5.406 30 20 GKED CC(C)[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1ccc(C(F)(F)F)cc1 563041878 JNMOJZCWZHLTGW-GOSISDBHSA-N 381.442 5.128 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2cccs2)n1)c1ccc(Cl)c(Cl)c1 565307462 KVLGLRWCMBXZJE-LBPRGKRZSA-N 394.308 5.173 30 20 GKED N#Cc1cc(C(=O)N2CCCCC[C@@H]2/C=C/c2ccccc2)cnc1C(F)(F)F 578032546 FYCLDPOQVGWCMA-GNISGLHKSA-N 399.416 5.070 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@H]3C[C@@H]3c3ccccc3Cl)n2)cc1 581386887 SXKSHQYTGPEGHE-CVEARBPZSA-N 379.872 5.077 30 20 GKED Cc1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)c(OC2CCCC2)c1 589133807 GLTVFIIHPHIHJO-IBGZPJMESA-N 387.483 5.606 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c(C)n1C1CCCCC1 592974400 RRDVYNPUWDPDOE-SFHVURJKSA-N 395.503 5.849 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)c(C(F)(F)F)c1 596710715 FCQFRAGCFSFISW-KBPBESRZSA-N 399.482 5.754 30 20 GKED N#Cc1c(NC(=O)c2c(Cl)cccc2Br)sc2c1CCCC2 598799414 FPUVXGAUWHLRSM-UHFFFAOYSA-N 395.709 5.167 30 20 GKED N#Cc1ccccc1CSCc1nc(-c2cccc(C(F)(F)F)c2)no1 603498248 HVLMGKBZPULJHW-UHFFFAOYSA-N 375.375 5.060 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccccc1F 608847535 OSMJWHSOPQGRCA-OAHLLOKOSA-N 375.403 5.017 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 609398317 UKLBGDYRJDRIGQ-QGZVFWFLSA-N 397.544 5.391 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 609439065 VWIJDPLLBQHGGT-QZTJIDSGSA-N 381.545 5.450 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(C)c1 609499353 MJORBDCMLAANPS-SFHVURJKSA-N 385.467 5.196 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)C1(C#N)CCC1 609874467 AZMNTBUAPRIEFD-UHFFFAOYSA-N 376.378 5.008 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CC[C@H](CSc3ccccc3)C2)c(Cl)c1 611094866 BEICOIQAOXBXSJ-ZDUSSCGKSA-N 391.323 5.119 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccccc1OCc1cccc(Cl)c1)C1CC1 611095580 RXIRYQMWJLHPTB-HNNXBMFYSA-N 383.879 5.075 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1 680409102 ZNIKMXZMYBHXKL-HNNXBMFYSA-N 390.243 5.327 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc2cc(F)ccc2c1Cl 682803907 ZIRMUZZSKIBFKX-UHFFFAOYSA-N 387.907 6.798 30 20 GKED FC(F)(F)COc1ccc(NN=Cc2csc(-c3ccsc3)n2)cc1 727257756 BMIVEVGVXOUGBL-UHFFFAOYSA-N 383.420 5.259 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 727267155 OJOOGBSQLBMBBZ-IOCXFXADSA-N 398.764 5.107 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1C(=O)/C=C/c1cccnc1 727779876 ALHHOOIEQXCMLK-RUDMXATFSA-N 385.286 5.172 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)Cc2csc(-c3ccccc3)n2)c1 728186290 WVZHTJJCPREVIN-UHFFFAOYSA-N 398.487 5.160 30 20 GKED CC(CSC(C)(C)C)=NNc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1 729635773 LWFRLPBKFVTYQG-UHFFFAOYSA-N 390.574 5.147 30 20 GKED COc1ccc(-c2ccc(C(=O)N(CCC#N)c3ccc(C)cc3)c(F)c2)cc1 730214642 MIRHUZWAUPNFLY-UHFFFAOYSA-N 388.442 5.370 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3ccc(F)cc23)cc1 734318412 UQYORHUAVVOHLG-JOCHJYFZSA-N 383.426 5.144 30 20 GKED COC(=O)[C@@H](Nc1cccc(CSC2CCCC2)c1)c1ccc(C#N)cc1 740898362 OWENXWXBWDFKPK-NRFANRHFSA-N 380.513 5.060 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cc3cccc(OCC)c3o2)cc1OC 750901325 DSAUIPMRHZBEFG-KHPPLWFESA-N 396.439 5.144 30 20 GKED C=CCC[C@@H](NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1)C(=O)O 756384980 CUSFKSFYSZVEGK-GOSISDBHSA-N 379.378 5.007 30 20 GKED C#CCCCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 759417425 CHEHEDRCSLHDDE-UHFFFAOYSA-N 376.506 5.411 30 20 GKED Cc1nc(O)c(C#N)c(C)c1CCC(=O)O[C@@H](C)c1sc2ccccc2c1C 767579454 QWOYLDNJJZYOCP-HNNXBMFYSA-N 394.496 5.036 30 20 GKED CC1(c2ccccc2)C/C(=C/c2nccs2)C(=O)/C(=C/c2nccs2)C1 767886225 FVWWAOUAHQUQIW-UKVBVZPVSA-N 378.522 5.387 30 20 GKED O=C1/C(=C/c2csc(-c3ccsc3)n2)CCc2ncc(C(F)(F)F)cc21 777469386 DDMKGZQLPLXYLI-BJMVGYQFSA-N 392.427 5.498 30 20 GKED CCCOc1c(Cl)cc(CNc2ccccc2O[C@@H](C)C#N)cc1OCC 779989744 ZAQOLFSSBMUFAZ-HNNXBMFYSA-N 388.895 5.430 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cc(-c2ncco2)ccc1C 782793622 CZEAYFDRPYEZSO-UHFFFAOYSA-N 377.444 5.192 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1ccc(C#N)cc1Cl 788422544 HHLFKNXISVOSTL-UHFFFAOYSA-N 389.768 5.010 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1sc(SC(F)F)nc1C 793947178 FOIVOHUIDNMFAQ-UHFFFAOYSA-N 396.528 5.799 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 806200245 BFJQCWBQBOQKHU-XMMPIXPASA-N 379.463 5.009 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CCOC(C)(C)C1 809872631 JIGKCQLQDWSXQR-FGZHOGPDSA-N 391.515 5.153 30 20 GKED N#C[C@H](C(=O)C1(F)CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810532750 SYMGCQAXCOEXGP-CYBMUJFWSA-N 397.302 5.966 30 20 GKED N#Cc1c(F)cccc1/C=C(\Cl)c1nc2cc(Br)ccc2o1 811694890 VCOTVSNWIIYCGQ-SDQBBNPISA-N 377.600 5.338 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 857435814 LCBNZJHCQMISRQ-OAHLLOKOSA-N 393.302 5.393 30 20 GKED CC(C)n1ncc2cc(C=NNc3nc(-c4ccccc4)cs3)c(Cl)nc21 874092328 OSYDYGGJAZIFCV-UHFFFAOYSA-N 396.907 5.235 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC(F)F)cc2)cc1 915087927 CKBDUJXZKHTKIQ-HXUWFJFHSA-N 378.378 5.196 30 20 GKED COc1ccc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)cc1O 916133940 VEGOSUIQRADQRR-LGMDPLHJSA-N 387.460 5.434 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776388570 HKWUWZUTUOEROD-CXUHLZMHSA-N 386.447 5.735 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2cccc(CC(=O)O)c2)cc1)c1ccccc1 1776469378 BOUDTSKPPZPORK-QWSHFYNQSA-N 386.447 5.350 30 20 GKED CCc1cccc2c1OC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1776977647 VOLVIWRAKVVESB-SFQUDFHCSA-N 390.460 5.334 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3nc(Cl)ccc3F)cc2)c1 1777651085 VFYWSGWCJOCLTC-UXBLZVDNSA-N 395.817 5.064 30 20 GKED Cc1ccccc1N(C(=O)COc1ccc(C#N)cc1)c1nc2ccccc2s1 7486118 QLMJFDVHVJABNA-UHFFFAOYSA-N 399.475 5.220 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(Cl)ccc1F 33196184 SHIBEKJVSDORFY-YUMQZZPRSA-N 391.714 5.118 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 65911998 LQDFAEOFSJBWFC-UHFFFAOYSA-N 399.494 5.202 30 20 GKED Cc1nc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)oc1C 66160865 ORRNIFZCXLGROH-UHFFFAOYSA-N 388.471 5.273 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1csc(-c2ccccc2)n1 66800371 VVANMPDYXJHLBL-OAHLLOKOSA-N 393.537 5.386 30 20 GKED CCOc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1OCC 66800702 CIZKXJQZUBKNGX-HNNXBMFYSA-N 384.501 5.131 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66955982 KLBPXBYQAUCZRA-XLIONFOSSA-N 379.529 5.758 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccn(-c2ccccc2Cl)n1 108239466 JNUFQQXUGDAUDR-AWEZNQCLSA-N 396.903 5.030 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1Cl 108532508 WVXYWMOWGFLMIX-HNAYVOBHSA-N 399.947 5.961 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H](C)c2ccco2)cc1 123524618 PUXXIVUUMLDJIX-OAHLLOKOSA-N 391.427 5.177 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C1CC1 124948018 GCAQVPCOPLVAIA-HUUCEWRRSA-N 382.533 5.236 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)n1 125450015 WTKWWALXABWFGM-VQIMIIECSA-N 380.517 5.153 30 20 GKED C=CCn1c(SCc2csc([C@H](C)OCC)n2)nnc1-c1cccs1 155882018 BOVCNGCPWDQBPX-LBPRGKRZSA-N 392.575 5.039 30 20 GKED COc1cccc([C@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)c1 172921208 PNWCDFDGAKJKSL-QHCPKHFHSA-N 392.886 5.130 30 20 GKED Cc1noc(Cl)c1CCC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 173537412 NMGOVZYQQYSBSW-UHFFFAOYSA-N 399.809 5.011 30 20 GKED C[C@H](CN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nccs1 183659077 ATCLNGDCZKQMLJ-OAHLLOKOSA-N 392.484 5.074 30 20 GKED CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 185351397 YUIOHKRQBCTXTH-WBVHZDCISA-N 397.500 5.196 30 20 GKED COc1ccc(-n2c(SCCCCC#N)nnc2-c2cccc(C)c2)cc1 195561890 HJYCTQCGIYEXAH-UHFFFAOYSA-N 378.501 5.037 30 20 GKED O=C1/C(=C\c2ccc3ncccc3c2)CSC/C1=C/c1ccc2ncccc2c1 212895673 XPHDECRJKHNVCO-JZTLMNBPSA-N 394.499 5.566 30 20 GKED COc1cc(C(=O)/C=C\c2cc([N+](=O)[O-])ccc2Cl)ccc1SC(F)F 214928067 PXTMFQDNVXKQFN-KXFIGUGUSA-N 399.802 5.468 30 20 GKED N#CCCCOc1cccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)c1 237829890 QPUFSOUZUTYCSV-IBGZPJMESA-N 375.299 5.453 30 20 GKED C/C(=C/c1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 255136469 QRNIXPVETXSYSG-LMICACPXSA-N 387.439 5.101 30 20 GKED COc1ccccc1-c1noc([C@H](C)/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)n1 329183541 OXIWWGHUZCZGOY-LUKYLMHMSA-N 383.492 5.369 30 20 GKED O/C(Cc1c[nH]c2cc(Cl)ccc12)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329524988 SKMYHABELHFZBY-LJQANCHMSA-N 396.922 5.710 30 20 GKED OC(=Nc1cccc(CSC2CCCC2)c1)N1CCC(c2ncc[nH]2)CC1 330259440 SBGJQOMNIMFVAP-UHFFFAOYSA-N 384.549 5.011 30 20 GKED CC[C@H](C#N)Sc1nnc(-c2cc(-c3ccc(C)cc3)nc3ccccc23)o1 436050367 JZYCGGDXFANWFJ-MRXNPFEDSA-N 386.480 5.655 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(F)c(C(F)(F)F)c1 438078839 IIKHSHCPGVRXKW-MAUKXSAKSA-N 391.368 5.148 30 20 GKED C[C@H](SCc1cccc(C(=O)NCc2ccco2)c1)c1cccc(C#N)c1 443150076 ZWWVHGDLYGFVCO-INIZCTEOSA-N 376.481 5.076 30 20 GKED C[C@@H](NCCCCC(C)(C)C#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1 444680434 OVNQBCZECAICGA-QGZVFWFLSA-N 381.495 5.449 30 20 GKED N#Cc1ccsc1C(=O)N(c1cccc(N2CCCC2)c1)C1CCCCCC1 460114164 RSKKIQMHQVEIIP-UHFFFAOYSA-N 393.556 5.590 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(C(F)(F)F)cc1 462160563 VXVLTOSXZYKRLE-OAHLLOKOSA-N 389.421 5.258 30 20 GKED C=CCC(CC=C)C(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 467526277 BVKKHYMRDBNYHC-UHFFFAOYSA-N 380.435 5.214 30 20 GKED N#CCCCN1C(=O)CCc2cc(NC3c4ccccc4-c4ccccc43)ccc21 468879522 GLSIKULMUPVXHX-UHFFFAOYSA-N 393.490 5.451 30 20 GKED CC[C@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 469689666 HUFPFKKUUISIBZ-AZUAARDMSA-N 395.572 5.956 30 20 GKED C=CCC[C@@H](NC(=O)c1cc2c(C(F)F)nn(C)c2s1)c1ccccc1 471049483 ZCCOXLOYIXNUGB-CQSZACIVSA-N 375.444 5.010 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cc2cccc(F)c2o1 473873050 DRJGANAHLOVFBW-OAHLLOKOSA-N 379.435 5.125 30 20 GKED CSCc1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1F 473935655 CFMPUHNQQUZSGP-CYBMUJFWSA-N 390.892 5.442 30 20 GKED Cc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cccc1C(=O)Nc1ccccc1 475463343 IQWWGDMBSURMLE-HXUWFJFHSA-N 397.478 5.273 30 20 GKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 494750716 AAPHGCVMGRXYPF-VJSYINPZSA-N 379.529 5.506 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cc(Cl)cc(Cl)c1 499533554 ZWGMJWLAAJACRN-UHFFFAOYSA-N 398.249 5.329 30 20 GKED N#Cc1ccc(C2=CCN(Cc3cccc(C(=O)Nc4ccccc4)c3)CC2)cc1 502544449 OFUCIEBIYKERKU-UHFFFAOYSA-N 393.490 5.100 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(c2nc3ccccc3s2)CC1 505001097 OIOZCKCQBAYNMR-UHFFFAOYSA-N 391.540 5.826 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnc(-c3ccc(F)c(F)c3)s2)n1 506003131 RPLMYRDFGFTZHB-NSHDSACASA-N 389.452 5.158 30 20 GKED N#CCC[C@H](NC(=O)N1CC=C(c2ccccc2Cl)CC1)c1ccccc1 509208029 CNGYPGQZPGFWHE-NRFANRHFSA-N 379.891 5.184 30 20 GKED COc1ccc([C@H](NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c2ccc(C)cc2)cc1 518005551 WCMIGBSHVUYICA-MHECFPHRSA-N 399.494 5.025 30 20 GKED CC[C@@H](SCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 518133509 MSWPFKZJOUDRBJ-QFBILLFUSA-N 384.570 5.761 30 20 GKED Cc1cccc(C)c1OC[C@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520197572 HKHMGCQTVAARAC-ROUUACIJSA-N 397.544 5.287 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 521963240 NRWBONCBLUJLNK-UHFFFAOYSA-N 376.843 5.759 30 20 GKED CC(C)(C)c1nc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cs1 522569462 PSJXAOYKHQLNCH-UHFFFAOYSA-N 393.537 5.392 30 20 GKED N#CCCCOc1cccc(N[C@@H]2CCc3c(F)cc(Br)cc32)c1 538526412 GTZAJGUIEYUVHT-LJQANCHMSA-N 389.268 5.370 30 20 GKED C=CCC[C@H](NCc1csc([C@H](C)OC)n1)c1ccc(C(F)(F)F)cc1 539335577 HJDLXCVKUDDGDW-GUYCJALGSA-N 384.467 5.666 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC(CC#N)CC3)cc2)cc1 541042885 FNGIGSHEMVRIIV-UHFFFAOYSA-N 381.501 5.004 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)cc1 552267954 QEMLJAFVZHAPCE-OAQYLSRUSA-N 382.454 5.190 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cc(C#N)ccn2)cc1Cl)c1ccccc1 555587592 AHKSXCCZTWHCLF-CQSZACIVSA-N 376.847 5.032 30 20 GKED Cc1nc(-c2cccc(-c3noc(C4(c5ccc(C#N)cc5)CC4)n3)c2)cs1 569527845 QYYXJTJTRVFBNU-UHFFFAOYSA-N 384.464 5.120 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1O[C@H](C)C(F)(F)F 572520882 RMSFJYNSQSJOIK-CYBMUJFWSA-N 384.423 5.298 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@@H](C)C[C@@H](C)C4)ccc12 574617915 DTSKFQVLLRMXBG-YPMHNXCESA-N 391.496 5.120 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc2nc(O)oc2c1 586792959 DFARYWAXBQPHFA-CVEARBPZSA-N 383.451 5.484 30 20 GKED C=CCCn1cc(CS[C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)nn1 594564860 JBYLTFAICYKNTO-AWEZNQCLSA-N 388.924 5.465 30 20 GKED Cc1cccc(Oc2ccc(Cl)cc2NC(=O)CC2(C#N)CCOCC2)c1 596653019 YPFGKZACVOHBCV-UHFFFAOYSA-N 384.863 5.090 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccc3)cn2)cc1 603690084 HSAINWRKBWCRAA-NRFANRHFSA-N 384.439 5.115 30 20 GKED Cc1cccc(Cc2cnc(NC(=O)c3cccc(CC#N)c3)s2)c1Cl 603737527 MKJANIORCKIAHA-UHFFFAOYSA-N 381.888 5.014 30 20 GKED Cc1cccc(CCC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 603814308 ISGHZHXBZASSPY-UHFFFAOYSA-N 384.479 5.211 30 20 GKED CCc1ccc(CCC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 604003633 JHTAKNCYXVNGET-UHFFFAOYSA-N 398.506 5.465 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2c(Cl)ccc(Cl)c2Cl)cc1 604068329 DDNGMVHFXHJSRF-UHFFFAOYSA-N 384.694 5.566 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4ccsc4[nH]3)c2)cc1 604242867 ASKKXGTZKPTGTM-UHFFFAOYSA-N 387.464 5.127 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cccc(Oc4ccc(C#N)cc4)c3)[nH]c12 605363075 GMYQGLJXQYQHEN-FQEVSTJZSA-N 392.418 5.025 30 20 GKED Cc1cccc(-c2nnc(S[C@@H](C#N)C3CCCCC3)n2Cc2ccco2)c1 609649067 VQISRRZHKNEVKM-FQEVSTJZSA-N 392.528 5.459 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1cccs1 609967858 LTDPFFSDYLQTHB-MRXNPFEDSA-N 378.472 5.404 30 20 GKED Cc1cccc2sc(C(=O)N[C@@]3(C#N)CCc4ccccc4C3)c(Cl)c12 613677710 IBLXJMSNFVIMMK-NRFANRHFSA-N 380.900 5.044 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 618805791 LAGNDRANDZZQKT-WOJBJXKFSA-N 389.499 5.475 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1OCC 647374918 OFSWJDNGOGONSP-INIZCTEOSA-N 384.501 5.088 30 20 GKED O=C(NC[C@H]1CCCC(F)(F)C1)NC(CCC(F)(F)F)CCC(F)(F)F 661125461 RSCWXONBRZNKDO-JTQLQIEISA-N 398.338 5.165 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1 727267989 XYHZMQAAPFUPMY-LFYBBSHMSA-N 380.444 5.112 30 20 GKED C#Cc1ccc(C(=O)N(Cc2cccc(F)c2)[C@@H](CC)c2ccc(F)cc2)nc1 728815762 QDXVKSGQNYPYOW-QHCPKHFHSA-N 390.433 5.135 30 20 GKED N#CCn1c(C(=O)Nc2ccccc2SCc2ccccc2)cc2ccccc21 729305003 FEQVSHFJECPIBC-UHFFFAOYSA-N 397.503 5.709 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)Nc1cc(Cl)cc(Cl)c1 730955092 UAVBEOTZOBJIEO-NSHDSACASA-N 396.368 6.054 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)cc1OC 731320796 ZCHCOHNFCHTGHN-KTKRTIGZSA-N 379.481 5.340 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C(F)(F)c1cccc(Cl)c1 731332393 KMLYOILPPCAMPZ-GFCCVEGCSA-N 380.847 5.465 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3ccccc3OCc3cccnc3)c2c1 734306225 CCMIWTIFKSVQGR-FLIBITNWSA-N 384.435 5.047 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc1Br 741469754 MNXWTWBONKYCTE-FNORWQNLSA-N 394.268 5.416 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)cc1 741540825 ZJUBCUJOQLTVEY-KSEOMHKRSA-N 388.417 5.362 30 20 GKED COCc1ccc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1 741842061 REXBBZISVZODHZ-ATVHPVEESA-N 379.456 5.308 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3cc4cc(F)ccc4o3)cc2c1C 741849021 SKJZLNBBEZDBMK-PLNGDYQASA-N 395.411 5.173 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cccc(CSC(C)C)c1C 741962220 IMQOWMAFZWXEHP-UHFFFAOYSA-N 393.512 5.453 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)N[C@H]3CCc4ccccc4C3)c2)cc1 742996090 WJGQYVRVWHXSKP-NRFANRHFSA-N 399.519 5.194 30 20 GKED CC/C(=C\C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)cc1 746892090 PHATZHUEGQDBQG-UYTDBDHRSA-N 380.513 5.522 30 20 GKED COc1cc(Br)c(/C=C/C(=O)c2oc3ccccc3c2C)cc1O 747137834 AUAQZTKLGYOFSR-BQYQJAHWSA-N 387.229 5.114 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Oc2ccc(Cl)c(Cl)c2)n1 747194110 SKIIWWOGSDYZAB-ZYHUDNBSSA-N 383.300 5.217 30 20 GKED C#CCCCCCC(=O)N1CC[C@@H](c2ccccc2)[C@@H]1c1cccc(OC)c1 752913201 ATPKZEKOBXWJDN-ZCYQVOJMSA-N 375.512 5.336 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cc([N+](=O)[O-])ccc1O 757660044 ZECRCTGWJQDXGM-CVEARBPZSA-N 387.439 5.251 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccc[nH]1 760743881 VVBDCHHLZHCTJP-KBXCAEBGSA-N 378.863 5.206 30 20 GKED Cc1cc(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c(C(F)(F)F)o1 769957451 JMXMMWRFFKYTDJ-UHFFFAOYSA-N 390.386 5.137 30 20 GKED CCCC(=CC(=O)[C@@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)CCC 771259045 PVSHBYMYCUNZTL-MRXNPFEDSA-N 380.460 5.175 30 20 GKED C[C@@H](N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1)c1ccc(OCC#N)cc1 776164796 UMWQRNWGTJVEIH-WAIKUNEKSA-N 394.877 5.822 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 780583926 IUBXUUHWUTVEMJ-OAHLLOKOSA-N 381.476 5.245 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccccc1O[C@H](C)C#N 780667053 FQKBRNZKFABGSQ-UYAOXDASSA-N 379.504 5.161 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCC(=O)c3ccccc32)cc1 785852742 VFDMPGITIBLWLA-PKTZIBPZSA-N 380.447 5.041 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1ccc(SCC(F)(F)F)cc1 788356838 WHIIFBAHPBSIIC-WAYWQWQTSA-N 397.365 5.712 30 20 GKED CC(C)O[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 794219706 BBYKWOANKYCDKB-BJKOFHAPSA-N 384.479 5.447 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2CC(c3ccc(F)cc3)C2)cc1 794220586 HCTLDIJUJPVION-VUNKPPBISA-N 384.454 5.613 30 20 GKED CC(C)[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccnc1 797943059 MWYCVYJNXVYYOW-MJGOQNOKSA-N 395.915 5.475 30 20 GKED N#CC1(CCCSCc2cccc(SC(F)(F)F)c2)CCOCC1 798400852 DTVQVBWATQXQDV-UHFFFAOYSA-N 375.481 5.632 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC(C)(C)CCC#N 798876956 WUVJJNINIWRWHI-UHFFFAOYSA-N 381.259 5.444 30 20 GKED Cc1nc(-c2ccc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)cc2)cs1 799601419 YEISLIHIGHRPGV-SFHVURJKSA-N 399.475 5.114 30 20 GKED Cc1csc([C@@H](C#N)C(=O)CS[C@@H](c2ccccc2)c2ccc(F)cc2)n1 801660869 JFAKYAYCOVPKJS-ICSRJNTNSA-N 396.512 5.290 30 20 GKED COc1cc([C@@H](C)Nc2nc(Cl)c(C#N)s2)ccc1OC1CCCC1 804351915 LORLWCLZNAKQBB-LLVKDONJSA-N 377.897 5.171 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)c1ccc(Cl)cc1F 806308149 MLFRFKQPNQRCLQ-HNNXBMFYSA-N 384.760 5.080 30 20 GKED Fc1ccc(-c2nc3c(s2)C(=NNc2nccnc2C2CCC2)CCC3)cc1 807991175 ISQDACOFXNGQHZ-UHFFFAOYSA-N 393.491 5.159 30 20 GKED N#C[C@H](C(=O)C1(c2c(Cl)cccc2Cl)CC1)c1cc(C(F)(F)F)ccn1 813216824 ZZMFETJIZCBSLX-NSHDSACASA-N 399.199 5.315 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Oc3ccccc3)cn2)c1 834650114 GMZYELBBFSIICS-AZUAARDMSA-N 387.483 5.406 30 20 GKED COCc1csc(/C=C2/CC(C#N)C/C(=C\c3cc(COC)cs3)C2=O)c1 899381047 LTDWVWRQHIKTCT-ZZDPWUPLSA-N 399.537 5.072 30 20 GKED N#Cc1ccc(Oc2cccc(-c3nc(COc4ccccc4F)no3)c2)cc1 904729164 ALJKLVYMCJGIEI-UHFFFAOYSA-N 387.370 5.119 30 20 GKED COc1cc(/C=C\C(=O)c2sccc2Br)cc(Cl)c1OC 915113860 XFPHKIHYPZLJOO-ARJAWSKDSA-N 387.682 5.077 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)n1[C@H](C)c1ccccc1 916847621 MZBRQPKXUYSNRS-OXQOHEQNSA-N 399.519 5.814 30 20 GKED N#C[C@@H](C(=O)CC(c1ccccc1)c1ccccc1)c1ccc2ccccc2n1 916849490 SNMRUQSLSPSYER-HSZRJFAPSA-N 376.459 5.633 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 917025141 FFHDVGMQIMUTSF-GOSISDBHSA-N 378.522 5.477 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1c[nH]c2cc(Cl)ccc12 920067894 DXZLEOFBLIGVJF-DAXSKMNVSA-N 392.764 5.218 30 20 GKED CC(=NNc1ncnc(Cl)c1C(C)C)c1sc2ccccc2c1C(=O)O 1776056669 HNHXZIHTLDHCJQ-UHFFFAOYSA-N 388.880 5.002 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(-c2ccccc2Cl)s1 1776084167 XOPIACZNEZNTMW-UHFFFAOYSA-N 384.888 5.532 30 20 GKED Cc1c(NN=Cc2ccccc2Cc2ccc(Cl)cc2)cccc1C(=O)O 1776089776 HBYIUJKQAFTAFL-UHFFFAOYSA-N 378.859 5.383 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc(Cl)cc2)s1 1776783134 ZWGPRGNFAXETCK-GOSISDBHSA-N 393.980 6.362 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2ccccc2C)c1 1776787908 DTGMYEQKMIBZTQ-QHCPKHFHSA-N 383.532 5.650 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1777260629 NGTGDLHFRIRAKM-JJEHFPDLSA-N 384.431 5.200 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)o1 1777424592 VSNOKURCEWBIBY-QKQONQEDSA-N 376.383 5.232 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)CCC3CCCC3)cc2)CCC1 1787619500 MBSCFFFUSGNFIZ-UHFFFAOYSA-N 394.559 5.285 30 20 GKED C=CCCC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(C)C)cc1 1799708857 MZMAWLCXBVIDAZ-KOUNCHBCSA-N 396.575 5.054 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccccc2)[n+]2ccc(CC)cc2)cc1 10173453 SWWXIJORMMHHRJ-UHFFFAOYSA-O 389.544 5.150 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)cc1 25439542 NMGZXCGGOBNACB-UHFFFAOYSA-N 396.450 5.186 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1 32054900 SKFOPUIQGFJGTI-QGZVFWFLSA-N 388.442 5.110 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cccc(C)c2C)[n+]2ccccc2)cc1C 41466026 KVGQAOPGAQBCPN-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cc1occc1CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 56661243 OYWSECORXSVHRC-HXUWFJFHSA-N 393.874 5.561 30 20 GKED CN(C(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1)c1cccc(C#N)c1 63327150 DZZQMANWKCRAOR-UHFFFAOYSA-N 387.291 5.870 30 20 GKED CC[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1nc(C)cs1 66905990 AQPUKMHAYIUKAW-NRFANRHFSA-N 377.513 5.143 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SCCC#N)c1nc2ccccc2[nH]1 108200188 YOFYFAWANHSLHS-AWEZNQCLSA-N 396.541 5.002 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(F)cc1Cl 108529890 DQUVLNDJCJSSMC-CYBMUJFWSA-N 391.899 5.395 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1 108900432 ZZJIBNYWPACPIN-KRWDZBQOSA-N 386.451 5.030 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1 110961976 SYPIQQCJZXBJEE-UHFFFAOYSA-N 376.460 5.080 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nnc(-c2ccccc2Cl)o1 133849935 GSZRBYSCSBCGBK-ZDUSSCGKSA-N 384.892 5.396 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1cccs1 133953109 KKNYUQQFZAMRKR-ZIAGYGMSSA-N 376.572 5.433 30 20 GKED C=CCn1c(SCc2csc(-c3ccoc3)n2)nnc1-c1cccs1 155796306 PQSGWZUSTHUCQE-UHFFFAOYSA-N 386.527 5.201 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(NC(=O)CC)ccc1C 155910293 MLWSWWGUIAYHCQ-UHFFFAOYSA-N 391.924 5.279 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)N[C@@H](CCC#N)c1ccccc1 160970668 FHBFIEVOQXGPSF-KRWDZBQOSA-N 386.293 5.233 30 20 GKED N#C[C@@H](C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)c1nc2ccccc2o1 178763579 FAAFAIFBHWOISK-KRWDZBQOSA-N 397.365 5.265 30 20 GKED CC(C)(C)O[C@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 179224537 KKVABRSKINJSGO-KXBFYZLASA-N 397.425 5.164 30 20 GKED COc1cccc([C@@H](N[C@H](C)c2cccc(C#N)c2)c2cc(F)ccc2OC)c1 181847741 XHOKBPSGNLSFFZ-VOIUYBSRSA-N 390.458 5.155 30 20 GKED Cc1c(NCc2ccc(Cl)cc2C#N)cccc1NC(=O)c1ccccc1 187723801 OTTLPPNPDLXMBI-UHFFFAOYSA-N 375.859 5.385 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 248526890 CZNOLQJYUYAVKJ-MSOLQXFVSA-N 392.503 5.309 30 20 GKED N#Cc1c(Cl)nsc1Oc1ccc2c(=O)c(-c3ccccc3)coc2c1 301933432 QLEPJVGSECDVCR-UHFFFAOYSA-N 380.812 5.234 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)CCCCOc3cccc(C#N)c3)ccc2o1 303557006 WXJWKMHMVIGLSU-UHFFFAOYSA-N 391.471 5.185 30 20 GKED COc1cccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1 303715601 ZUUOWOBQJIKVQE-UHFFFAOYSA-N 378.815 5.265 30 20 GKED OC(=Nc1ccc2nc(C3CC3)oc2c1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 328712767 BTOFDGSCDOEYGF-INIZCTEOSA-N 393.409 5.305 30 20 GKED O/C(CCc1nnc(-c2ccc(Cl)cc2)o1)=N/[C@@H]1CCCCC12CCCC2 329603049 GEINPIALZSXNSJ-QGZVFWFLSA-N 387.911 5.782 30 20 GKED Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1N=C(O)[C@@H](C)c1ncccc1F 329902121 PEGHXXWKTFYRPU-UXLLHSPISA-N 397.494 5.039 30 20 GKED OC(=Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ncsc1C(F)(F)F 330307363 SAVBVEUFJWIYJJ-UHFFFAOYSA-N 384.379 5.230 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 410352515 JPTCVSCMLHNUAP-UHFFFAOYSA-N 380.875 5.685 30 20 GKED Cc1ccc(CCN(Cc2ccco2)C(=O)c2cccc(SCC#N)c2)cc1 430597678 MMTQHJCFRUWRHX-UHFFFAOYSA-N 390.508 5.089 30 20 GKED CCc1cccc2c(C3CCN(C(=O)Nc4cccc(C#N)c4C)CC3)c[nH]c12 431939232 PBDXCLBJBQXRRS-UHFFFAOYSA-N 386.499 5.322 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H](c1ccccc1)C1CC1 433135119 MTOUKDZCDMPNAB-QFBILLFUSA-N 379.529 5.254 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1cc(Cl)ccc1C#N 435999637 JJQQIRHQGHNVIK-UHFFFAOYSA-N 388.279 5.265 30 20 GKED Cc1ccc(NC(=O)[C@H](C)SCc2ccc(C#N)cc2OC(F)F)c(C)c1 439543072 QNLFTIOLZKBION-AWEZNQCLSA-N 390.455 5.037 30 20 GKED N#CCC[C@@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1 440081400 SQFWMBCDEHCRPI-GOSISDBHSA-N 387.405 5.039 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 441282936 AJVNKMRFVAHWPA-LBPRGKRZSA-N 387.270 5.108 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)[C@@]1(C#N)C[C@H]1C 450005122 UVDKTQZBCBOVQW-IQMFZBJNSA-N 390.462 5.220 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)c(F)c1 463719735 BFBSCHUIWLCDSG-SFHVURJKSA-N 381.451 5.127 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 463747528 UYYKUFHTGGPZID-SJCJKPOMSA-N 379.262 5.082 30 20 GKED CC[C@]1(C)CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)C1 467853410 SSLNGKZTASAMAH-HSZRJFAPSA-N 377.488 5.100 30 20 GKED COc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2ccccc2Cl)cc1 470460409 YSNPNEPHOVOWEZ-CQSZACIVSA-N 398.919 5.381 30 20 GKED C[C@H](c1ccccc1Br)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474693468 IPHMISVUYJXHDY-WBVHZDCISA-N 385.305 5.056 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCC)[C@@H]1CCCc2cccnc21 475571213 VDLIGPJZGMLOJE-JOCHJYFZSA-N 391.559 6.255 30 20 GKED Cc1ccccc1-c1nnc(SCC#Cc2ccccc2)n1Cc1ccco1 478544796 XZQDVGRULUUGDG-UHFFFAOYSA-N 385.492 5.039 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C(=O)NC2CCCC2)cc1C)c1ccccc1 488683296 FAXKVMGNLYTPQY-JOCHJYFZSA-N 390.527 5.356 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2cccc(F)c2F)nc1 489268230 MROVJBHHHUAAFW-UHFFFAOYSA-N 399.397 5.008 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2ccccc2Cl)n1)c1ccc(Cl)cc1 499851243 WLRCHHJEOBZCDF-HNNXBMFYSA-N 388.279 5.112 30 20 GKED CCN(C(=O)c1ccc(-c2cccs2)nc1C)[C@H](C)c1ccc(C#N)cc1 500142574 FRTBLGCTCHHNNK-MRXNPFEDSA-N 375.497 5.214 30 20 GKED Cc1ccc(-c2ccc(C(=O)N(CCC#N)Cc3ccco3)c(F)c2)cc1C 500351262 VDQFZADAZNFHEP-UHFFFAOYSA-N 376.431 5.259 30 20 GKED CC[C@@H]1C[C@]1(NCc1ccc(OC)c(OCCCC#N)c1)c1cccc(C)c1 500526691 FNTKTLOMTIXARI-HYBUGGRVSA-N 378.516 5.101 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 505002035 ZRHNYFWEUQFKPV-OAQYLSRUSA-N 378.520 5.316 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](c2ccccc2)[C@@H](C)CC)cc1 511747980 FPONHJUGJOVZGV-CVDCTZTESA-N 390.527 5.269 30 20 GKED COc1ccc(CCCCC(=O)N(Cc2ccco2)c2ccccc2C#N)cc1 512227396 LQZXSRCWDPYLHU-UHFFFAOYSA-N 388.467 5.106 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3coc4ccccc34)cc2)cc1 512524173 QZBXCHIDNFUWKK-UHFFFAOYSA-N 383.407 5.418 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 517775685 AQUICIWGGZTONA-UHFFFAOYSA-N 388.383 5.211 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1 518165720 QALDWTMMEJVRMA-KKSFZXQISA-N 379.529 5.520 30 20 GKED Cc1ccc(-c2nc(C(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)cs2)o1 518709910 FBXURELHYWPASX-LBPRGKRZSA-N 392.267 5.013 30 20 GKED C=C(C)C[C@H](C)c1nc(CC(=O)Nc2nc(-c3cc(C)ccc3C)cs2)no1 521941024 UXVRTHBTSOVHKS-HNNXBMFYSA-N 396.516 5.061 30 20 GKED CC(C)OCc1cccc(NCc2cccc(OCc3ccccc3C#N)c2)c1 522282847 UGVUYJOCPDUGRB-UHFFFAOYSA-N 386.495 5.674 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1nc2cc(Cl)ccc2s1 530507808 AVSMMCPDXYTZHR-UHFFFAOYSA-N 398.959 6.373 30 20 GKED Cc1ncc(-c2ccc(NCc3cccc(OCc4cccc(C#N)c4)c3)cc2)o1 532725708 MLBPFECURPYJEL-UHFFFAOYSA-N 395.462 5.713 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc(OC[C@H]3CCCO3)cc2)cc1 538003085 VZZHBVWOIDMMTO-RUZDIDTESA-N 398.506 5.073 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)s2)c2ccccc2Cl)c(OC)c1 539515938 SNSNZUWDTHAPSE-NRFANRHFSA-N 398.915 5.170 30 20 GKED CC[C@H](c1ccncc1)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541156570 JPHXKDALENVQEJ-MHECFPHRSA-N 398.510 5.474 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC(CC#N)CC3)c(C)c2)n1 543827498 HJCKKDLQAXWJMP-UHFFFAOYSA-N 386.546 5.069 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)c1ccc(Sc2ccccc2C#N)cc1 546168179 CFRWVEMDCMCQOV-OAHLLOKOSA-N 378.419 5.170 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(Br)c1 559865361 SLYPKEYKPNTVRD-LIRRHRJNSA-N 375.285 5.674 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 564148505 UBQKYYWKPIYNSZ-UHFFFAOYSA-N 382.479 5.319 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN1CCCC[C@@H]1c1ccccc1 571013606 WGOWCGZKSMHRCV-WIYYLYMNSA-N 393.556 5.104 30 20 GKED CCN(CCC(C#N)(c1ccccc1)c1ccccc1)[C@@H]1CCOC(C)(C)C1 574441469 OYDSAFNOAYYSSD-HSZRJFAPSA-N 376.544 5.166 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC2(CCC2)[C@H]1C1CC1 576952153 SHIVAACPXYYNHT-JOCHJYFZSA-N 387.483 5.455 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccccc3OCC(F)(F)F)cc2)ccn1 577786570 BYKUCQFYSOUFSZ-UHFFFAOYSA-N 399.372 5.299 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@@H](Sc1cc(F)ccc1F)c1ccccc1 581844294 DPZNNPPVJCAOBR-IBGZPJMESA-N 388.483 5.244 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1ccc(C(F)(F)F)s1 588862932 LQUNDBMTUSCUKJ-UHFFFAOYSA-N 376.359 5.079 30 20 GKED C[C@H](Oc1ccc([C@@H](C)NC(=O)N2CCC(C)(C#N)CC2)cc1)c1ccccc1 595751787 HIPSOVFQMQKANU-MOPGFXCFSA-N 391.515 5.223 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CC3(CCCC3)[C@H]2c2ccco2)cc1C#N 596800966 MTRAPMTVCNZEII-HXUWFJFHSA-N 379.460 5.088 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(C(F)F)cc2)cc1 608804753 KIFBNCYJQHFZCY-UHFFFAOYSA-N 392.405 5.522 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609377177 QKWMTMAWDUNZDA-JXFKEZNVSA-N 384.570 5.694 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 609439064 VWIJDPLLBQHGGT-MSOLQXFVSA-N 381.545 5.450 30 20 GKED Cc1nc(CSc2ccc(C(=O)N[C@H](C)c3cccc(C#N)c3)cc2)cs1 610362982 SPCNQHXHFUOJHM-CQSZACIVSA-N 393.537 5.107 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](C)c3cccc(C#N)c3)s2)c(C)c1 610364841 YRIYGERSGKXONY-HNNXBMFYSA-N 375.497 5.098 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCC(F)(F)C3)cc2Cl)cc1 610791994 UYCNVOLISZYAQA-CQSZACIVSA-N 391.805 5.313 30 20 GKED COc1ccc(CNc2ccc3oc(C(C)C)nc3c2)cc1OCCCC#N 610909737 WVJQVMSMURISCV-UHFFFAOYSA-N 379.460 5.254 30 20 GKED CSc1cc(C(=O)N[C@@H]2CCc3cc(C#N)ccc32)c(Cl)cc1Cl 618785548 KDUROOJXIPMUAF-MRXNPFEDSA-N 377.296 5.004 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(Cl)ccc1F 642158526 SHIBEKJVSDORFY-MBTKJCJQSA-N 391.714 5.118 30 20 GKED Fc1ccc(-c2csc(N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)n2)cc1 674931568 QYVSPLMFFSNGHG-GHMZBOCLSA-N 398.347 5.516 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2nc(-c3ccccc3)cs2)CC1 678835147 MRCOEPLJUXOQJB-UHFFFAOYSA-N 398.572 5.279 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(O)c(F)c2)cc(C)c1OCc1ccccn1 728438706 LRJCEEVWZZLZFB-SOFGYWHQSA-N 377.415 5.018 30 20 GKED N#CCOc1ccc(CNC(=O)Nc2cccc(Sc3ccccc3)c2)cc1 731107302 BORYZWZNRQGQQK-UHFFFAOYSA-N 389.480 5.062 30 20 GKED CCCN(Cc1ccc(OCC#N)cc1)[C@H](C)c1ccccc1Br 731211263 DGFVMGUZMCQJTE-MRXNPFEDSA-N 387.321 5.325 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3c(F)cccc3F)n2)cc1 734964860 DOZMYGPCWRTTDB-HRCADAONSA-N 394.446 5.377 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740059458 IMKZDKLWIWYDIR-UHFFFAOYSA-N 393.537 5.246 30 20 GKED O=C(/C=C/c1cc(Cl)c2c(c1)OCCCO2)c1cccc(-c2ccncc2)c1 741473955 VIUJUUXUGLXECO-AATRIKPKSA-N 391.854 5.459 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)N[C@@H]2CCOc3ccccc32)c1 741484232 IZNOYIAUNWIIFS-HSZRJFAPSA-N 398.531 5.073 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C\c2ccccc2)C(=O)c2ccccc2)c(Cl)c1 747155161 QLYOWAPJPKEBQA-HKWRFOASSA-N 389.882 5.862 30 20 GKED CN(C)C(=O)Sc1ccc(CON=Cc2cccc(Cl)c2Cl)cc1 753119110 ZIQOSBYYOIDSKH-UHFFFAOYSA-N 383.300 5.318 30 20 GKED Cc1cc(F)ccc1[C@H](O)COc1ccccc1Oc1ccc(C#N)cc1F 755358999 IILHDGXTIJHCQI-LJQANCHMSA-N 381.378 5.050 30 20 GKED C#CC[C@@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccccc1 757777691 VAXOYGLOFGMEQW-HSZRJFAPSA-N 384.479 5.290 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3cccc(OC4CCCC4)c3)cc2N1 758025741 NPCLIFGGUHWKMY-HJWRWDBZSA-N 385.510 5.010 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COC/C=C\c2ccccc2)cc1 763259405 JHCOMGSEUORCEL-VWTHGPEQSA-N 382.463 5.011 30 20 GKED Cc1cc(CN[C@@H]2CCCc3cc(NC(=O)OC(C)(C)C)ccc32)ccc1C#N 767686007 YBPYICNSAYTHKJ-JOCHJYFZSA-N 391.515 5.381 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@H]2c2ccccc2Br)cc1 769534254 UJCHQYNFRXTQOD-QRWLVFNGSA-N 385.305 5.077 30 20 GKED C[C@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1ncc(C(C)(C)C)o1 769547112 SYPWEOISAVUCNF-HNNXBMFYSA-N 379.460 5.149 30 20 GKED C=C(C)[C@H]1CC=C(COC(=O)[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)CC1 778312233 GUDVOKCMTXYVTG-DYVFJYSZSA-N 384.442 5.012 30 20 GKED N#Cc1ccc(C(=O)Nc2cccc(CC[C@@H](O)c3ccccc3)c2)cc1Cl 778972130 QHVAALZWMVUCRY-JOCHJYFZSA-N 390.870 5.130 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(=O)/C=C/c3scnc3C3CC3)c12 782324026 WSPAPHXHAQBDSD-ZHACJKMWSA-N 388.496 5.013 30 20 GKED C=C[C@@](C)(CCOC)COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 784620157 YSXHXRNLDKDKLG-SFHVURJKSA-N 399.434 5.215 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(-c2ccccc2F)oc1C 789717935 BAMHFCFYBFFADX-UHFFFAOYSA-N 378.447 5.893 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 798864415 JJTKCJFHYJPIGP-RISCZKNCSA-N 380.435 5.439 30 20 GKED N#Cc1ccc(CN2CCCCC[C@@H]2C[C@H](O)c2ccco2)c(C(F)(F)F)c1 811467161 GWMHNISNIROSIV-MJGOQNOKSA-N 392.421 5.038 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cscc2C(F)(F)F)S1 811626110 BYTJFCWIPRNQJS-MLPAPPSSSA-N 382.432 5.275 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(Br)nc1 811697445 SQBKCDJFBDTZLX-SREVYHEPSA-N 389.249 5.003 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CCCC1)c1cc(C(F)(F)F)ccn1 813213090 HRCJKAKHVBFPIG-INIZCTEOSA-N 392.808 5.442 30 20 GKED CSc1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3oc2=O)cc1 817343187 LAAAZJHUHIOJLD-XDJHFCHBSA-N 399.471 5.333 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)[C@]1(C#N)CC2CCC1CC2 912997661 ISJRVQLKIMNEQC-LGHDPPOTSA-N 383.492 5.001 30 20 GKED C[C@@H](NC(=O)CCN1c2ccccc2Sc2ccccc21)c1ccc(C#N)cc1 914445884 IPSYANJRAHRYSQ-QGZVFWFLSA-N 399.519 5.428 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc3cc(Br)ccc3o2)ccc1O 916129999 DTVAXIXURHQKSP-DAXSKMNVSA-N 387.229 5.196 30 20 GKED CC(C)(Oc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917046004 FFFISTVBBJKVNS-AWEZNQCLSA-N 388.851 5.123 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 917428177 ORRDCULJYAHLAE-BJRSVTDJSA-N 378.884 5.743 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2cc(Cl)cc(Cl)c2)SC1=S 917644157 AJJDQBKNFXABHQ-VIZOYTHASA-N 391.304 5.271 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(-c3cccc(Cl)c3)nc2O)c1C#N 1125717577 LSOFWMAXELMFAX-UHFFFAOYSA-N 397.887 5.164 30 20 GKED CCC(=NNc1c(F)cccc1Cl)c1ccc(OCCCCC(=O)O)cc1 1776055815 UUGSTQIRGHTYGI-UHFFFAOYSA-N 392.858 5.339 30 20 GKED CCCCCCCOc1ccc(/C=C\c2cc(C(=O)O)c3ccccc3n2)cc1 1776785854 CEKWSJXGAAAMIQ-KAMYIIQDSA-N 389.495 6.453 30 20 GKED CCCCCCCOc1cccc(CNCc2ccccc2CCC(=O)O)c1 1776787713 YKDXJRAOHBGMSO-UHFFFAOYSA-N 383.532 5.343 30 20 GKED CCCCCCCOc1cccc(CNC[C@]2(CC(=O)O)CC[C@@H](C)C2)c1 1776788726 UEAADUKVDHOQSX-AUSIDOKSSA-N 375.553 5.407 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776805938 GWAHZPCIAQTASH-PKNBQFBNSA-N 382.456 5.977 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776817313 UKIPQNROCZNBLX-FZSIALSZSA-N 386.447 5.737 30 20 GKED CCOc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776937469 XERBZRNZIKDQBC-BENRWUELSA-N 378.449 5.408 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)c(Cl)c1 1777352366 VQCBSBNJNWSBPG-PQMHYQBVSA-N 392.838 5.610 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(/C=C/C(=O)O)o3)s2)cc1 1777430558 CKAPEPRCDINBKC-DSOJMZEYSA-N 379.437 5.014 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1ccc(-c2cccs2)cc1 1777640956 HNOYBFRYCWKONA-QXMHVHEDSA-N 378.449 5.165 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCc4c(Cl)cccc4C3=O)o2)cc1O 1777670994 PHAWXWUTTDKSPM-JLHYYAGUSA-N 394.810 5.216 30 20 GKED C=CCn1c(SCc2cn3cccc(C)c3n2)nnc1-c1ccc(Cl)cc1 5692047 BUEGVDOVDWVTOS-UHFFFAOYSA-N 395.919 5.033 30 20 GKED Cc1ccc[n+](/C(C(=O)c2cc(C)sc2C)=C(\S)Nc2ccccc2)c1 10170833 INAPFCPMBUDHQI-UHFFFAOYSA-O 381.546 5.012 30 20 GKED COc1c(O)cccc1/C=C(/C(=O)c1ccccc1)c1nc2ccccc2s1 11289662 BYBLYKKFDRIGMJ-VKAVYKQESA-N 387.460 5.434 30 20 GKED N#Cc1cccc(CSc2nnc(Cc3ccccc3)n2-c2ccccc2)c1 12105746 QFDNRCYIFMJHGF-UHFFFAOYSA-N 382.492 5.022 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCCc1cccc(Cl)c1 36709456 JIXXEJJLYHJWDW-UHFFFAOYSA-N 392.911 5.335 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 41500188 HFESERGMRJKARW-LJQANCHMSA-N 379.444 5.325 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 51533191 YZVRWFAHDHBAIY-KRWDZBQOSA-N 394.883 5.303 30 20 GKED CCc1ccc(-c2nc(CC(=O)Nc3ccc(C#N)c(Cl)c3)cs2)cc1 57633593 WATKYQOOOYIHEN-UHFFFAOYSA-N 381.888 5.079 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 61058808 HXSOKKFLQBLVFP-UHFFFAOYSA-N 383.476 5.169 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1cccc2ccccc12 108351560 XWSIVHJCYIKJCS-MRXNPFEDSA-N 376.481 5.252 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC/C=C/c1ccccc1 108409010 ZNJFPSGIISDLBG-PYUISTEWSA-N 382.554 5.323 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(C(F)(F)F)cc2)ccc1OC 113308874 OXECDSILXZYQNE-RDTXWAMCSA-N 392.421 5.246 30 20 GKED COc1ccc(CN[C@@H](C)c2cccc(Cl)c2Cl)cc1OCCCC#N 117951355 APARBNWXRNPJEO-AWEZNQCLSA-N 393.314 5.535 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)c1 124025403 LCNQDDOUJXUGME-WIYYLYMNSA-N 398.462 5.238 30 20 GKED N#C[C@@H](C(=O)CCc1ccc2ccccc2c1)c1nc(-c2ccncc2)cs1 194182414 FAYAGANGMWPEBD-FQEVSTJZSA-N 383.476 5.167 30 20 GKED C[C@H](OCCCNC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1 248290137 KQEWBLPZTCCECT-IBGZPJMESA-N 384.479 5.123 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 303238224 ZTJBMBZJFJOORZ-QGZVFWFLSA-N 398.890 5.757 30 20 GKED CC1(CC(O)=Nc2cccc(N3C(=O)[C@@](C)(C4CC4)N=C3O)c2)CCCCC1 328886779 OZWDFXUZRVHRLM-JOCHJYFZSA-N 383.492 5.064 30 20 GKED O/C(=N/C[C@H](/N=C(/O)C1CCSCC1)C1CCCCC1)C1CCSCC1 329432420 KNNAXTXTJLEQNT-SFHVURJKSA-N 398.638 5.135 30 20 GKED Cc1ccc(N=C(O)N2[C@H]3CC[C@H]2c2ccccc23)cc1OCC1CCOCC1 329601996 XVODVRUNJFWMAE-VXKWHMMOSA-N 392.499 5.238 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@@H](C)CC3)s1 410990424 WMMVSSHPTIPXRP-SDDRHHMPSA-N 389.546 5.112 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H](CC(F)(F)F)C3)c2)cc1 421934293 BZELXAQDNZEEKI-MRXNPFEDSA-N 388.389 5.155 30 20 GKED N#CCCC[C@H](NCc1ccc(OCc2ccc(F)cc2)cc1)c1ccccc1 433021271 QDAYTJJXLDGBIN-VWLOTQADSA-N 388.486 5.929 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 435697829 ZMOVONQURZBQKW-UHFFFAOYSA-N 392.455 5.251 30 20 GKED CCCCOc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c(C)c1 437899465 VFDGUAGWCTUEEB-GGAORHGYSA-N 391.515 5.478 30 20 GKED CCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H](Cc1ccc(F)cc1)C(C)C 437919424 VPGJVTFCBICXAZ-JOCHJYFZSA-N 395.522 5.748 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 438033247 XQSYEURZXFPISW-MRXNPFEDSA-N 383.517 5.346 30 20 GKED Cc1cc(O)ccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 443567865 CYGVOHNQTWGHRI-LJQANCHMSA-N 391.858 5.654 30 20 GKED N#CCc1cccc(NC(=O)N2CCC(c3ccccc3C(F)(F)F)CC2)c1 455925858 YGNOKIRMOYMFOP-UHFFFAOYSA-N 387.405 5.183 30 20 GKED C=CCN(C(=O)CCCC#N)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 463294820 WGCZZMJYCANJRW-UHFFFAOYSA-N 380.300 5.330 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cc(F)ccc2F)cc1Cl 463388608 BUUIENQOMFFQIK-LJQANCHMSA-N 396.824 5.455 30 20 GKED Cc1sc2nc([C@@H](C)Sc3ccc(C#N)cc3Cl)nc(O)c2c1C 465389900 VGGVXJFIPTUWBY-SNVBAGLBSA-N 375.906 5.392 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2SCc2cccs2)n1 474445730 NFLUHZLPQUXKSM-INIZCTEOSA-N 398.578 6.110 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3ccccc3C(F)(F)F)CC2)cc1 474698471 WBEKFKQCCCYMPN-UHFFFAOYSA-N 387.405 5.183 30 20 GKED C=C(CNC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 478899074 JLBRVJGGCCHEHE-LJQANCHMSA-N 399.494 5.013 30 20 GKED N#C[C@H](C(=O)c1cccc(OCc2cccs2)c1)c1nccc2ccccc12 483244413 NYAZQWHJCFJJTQ-NRFANRHFSA-N 384.460 5.365 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(CC)cc(C)cc1CC 483412392 FFTZUPQIYPXXOA-UHFFFAOYSA-N 382.552 5.507 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N(C)c2cc(Cl)ccc2C#N)s1 484322292 OKCQVJZJPUEXKM-UHFFFAOYSA-N 381.888 5.229 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(F)cc2)n1 500299022 PORASGWHVMMAOP-UHFFFAOYSA-N 393.487 5.119 30 20 GKED Cc1ccc([C@H]2CCCN2Cc2cn(CCC#N)nc2-c2ccccc2)s1 513472411 DWBQUPQHRFVWRW-HXUWFJFHSA-N 376.529 5.171 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1cccc(COc2ccccc2C#N)c1 513476233 MZNJHHDQFWJOIR-UHFFFAOYSA-N 390.508 5.250 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 518719445 XZGXCYNALMOGGX-SJLPKXTDSA-N 381.545 5.308 30 20 GKED CCc1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)sc1C 521264007 TUBYKNCCVZIWGC-GFCCVEGCSA-N 388.464 5.511 30 20 GKED CC[C@@H](C)Oc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)cc1 522575542 UCRZDCMBEYIVNV-MRXNPFEDSA-N 390.439 5.160 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 523955004 PUQMCROSUUAVMF-UHFFFAOYSA-N 394.780 5.194 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)Nc3ccc(C#N)cc3Cl)CC2)cc1 532860402 GNUBDYBTAUKQTL-UHFFFAOYSA-N 397.906 5.410 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 538577775 WUWDPOUDUSZQOL-LJQANCHMSA-N 396.490 5.943 30 20 GKED Cc1cccc([C@@H](NC2CCC(C#N)(c3ccccc3)CC2)c2ccccn2)c1 539042050 CETMZZLOLOUODT-CNWYCCFASA-N 381.523 5.473 30 20 GKED N#Cc1cccc(OCc2cccc(-c3nc([C@H]4CCCCS4)no3)c2)c1 546517974 JKUWTQGGBHZVSU-LJQANCHMSA-N 377.469 5.145 30 20 GKED CC(C)(CNC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C(F)(F)F 549185243 WARLBEPXFJHSRL-UHFFFAOYSA-N 377.366 5.061 30 20 GKED C=CCCC1(C(=O)Nc2ccc(NC(=O)C3(CCC=C)CC3)c(C)c2C)CC1 557293610 APISGNIGDKYQBR-UHFFFAOYSA-N 380.532 5.673 30 20 GKED N#CCCC[C@@H](NCc1cc2cc(Br)ccc2o1)c1ccccc1 582371532 BUPXOGXGIIFTLD-LJQANCHMSA-N 383.289 5.720 30 20 GKED CC(=O)N(c1nc(COc2cc(F)cc(C#N)c2)cs1)c1cccc(C)c1C 584432067 OELJECIIRGGCRH-UHFFFAOYSA-N 395.459 5.034 30 20 GKED N#CCC[C@H](NC(=O)NC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1 593382485 NCKUMRAWZYXXIA-SFHVURJKSA-N 387.405 5.039 30 20 GKED N#CC1(Cc2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)CCCCC1 594732100 OKOUEYMTHSPNRW-UHFFFAOYSA-N 397.482 5.151 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)N2CCC[C@H](CC#N)C2)c2cccs2)cc1 596106323 OHWKZTNKOHLKSZ-DYESRHJHSA-N 381.545 5.296 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2ccccc2F)C1 598414790 GJUCSHMXTYLJLA-QFIPXVFZSA-N 394.471 5.240 30 20 GKED CC(C)(C)N(CCCC1(C#N)CCOCC1)Cc1ccc(Br)cc1 599527791 VPVOJDYZJNANNC-UHFFFAOYSA-N 393.369 5.150 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)NC1(c2nccs2)CCCC1 604795799 UQKJOPHKTDZIHH-UHFFFAOYSA-N 393.537 5.195 30 20 GKED Cc1cccc2c(CC(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)c[nH]c12 610153049 NTSHUFACPNGNGI-UHFFFAOYSA-N 395.462 5.108 30 20 GKED C[C@@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1ccccc1C(F)(F)F 610197552 NYKQMEQLZYIWOL-AWEZNQCLSA-N 378.369 5.285 30 20 GKED N#Cc1ccc(SCc2nc(O)c3ccc(C(F)(F)F)cc3n2)c(Cl)c1 611102418 IJEMPFPFDMPRBI-UHFFFAOYSA-N 395.793 5.172 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccnc(Oc3ccccc3)c2)CC1 611255118 JSQULEXVKWJADK-UHFFFAOYSA-N 383.495 5.368 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@](C)(C#N)C1 612305162 JXWRAPMPNAGWRR-FDDCHVKYSA-N 377.488 5.293 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1 615975749 YIGXYGBEQQFGIX-UHFFFAOYSA-N 396.830 5.002 30 20 GKED O=C(Nc1ccc(OCC(F)F)c(C(F)(F)F)c1)c1ccc(C(F)F)o1 626674334 UTZKWEWLXLHRSU-UHFFFAOYSA-N 385.235 5.132 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C\c1ccccc1 730994607 KLFXYFNJFGFFCS-YFHOEESVSA-N 376.403 5.363 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1 731317517 HJVBHEGOBJOFLE-UHFFFAOYSA-N 393.899 6.121 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccccc2SCc2ccccc2)cc1 731963895 UCMFOOQYQPTEHX-UHFFFAOYSA-N 388.492 5.062 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 734966020 STNKLRBEWSHIOC-BBRMVZONSA-N 389.282 5.143 30 20 GKED CC(CCC1CCCC1)=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1 740762685 BVERZOKQTCNJIS-UHFFFAOYSA-N 377.414 5.316 30 20 GKED Cc1cc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)ccc1-n1cncn1 742434837 OIDYERXJSRSGKJ-CXUHLZMHSA-N 397.450 5.103 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744034542 AZGZNMKMEQJPFE-LRDDRELGSA-N 386.879 5.534 30 20 GKED CC(=NNCc1ccc(Cl)cc1Cl)c1sc(-c2cccnc2)nc1C 747610500 FAQOOEWQGIIEEM-UHFFFAOYSA-N 391.327 5.334 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ncc(C(C)(C)C)o1 747815057 AHSFPAMFVRVMJE-HNNXBMFYSA-N 393.462 5.735 30 20 GKED O=C1/C(=C/c2coc(-c3ccccc3)n2)CC/C1=C\c1coc(-c2ccccc2)n1 749886860 QYOAXVKQRKVYQS-IWGRKNQJSA-N 394.430 5.827 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 752159222 DOGSPNZKFIYLRG-CABCVRRESA-N 388.414 5.685 30 20 GKED CCN(c1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1)C(C)C 752620584 SHAIDFDOOZAMBS-GOTSBHOMSA-N 390.531 5.225 30 20 GKED N#Cc1cc(/C=C(\Cl)c2nc(O)c3c4c(sc3n2)CCCC4)ccc1F 756263703 VSUKOGCTIABSAO-JYRVWZFOSA-N 385.851 5.023 30 20 GKED C=C[C@@H](CC(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1)c1ccccc1 759333192 GIDDUGJQFCTARE-IBGZPJMESA-N 394.515 5.052 30 20 GKED C=C(C)COc1cc(CNc2ccc(OC3CCOCC3)c(C)c2)ccc1OC 770582611 VJWPKKIKNJUDND-UHFFFAOYSA-N 397.515 5.128 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(SCC(F)F)cc2)c1 772986016 YYSHXFWBNNMAHV-QAPCUYQASA-N 390.499 5.576 30 20 GKED N#Cc1ccc([C@@H](O)CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 776033430 HESIJKLBLGZILF-RBUKOAKNSA-N 394.824 5.005 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(C#N)cc2F)cc(C)c1OCc1ccccn1 781108359 PNKQKPULRVHXPQ-VQHVLOKHSA-N 386.426 5.184 30 20 GKED N#C[C@H](C(=O)c1nc(Cl)cs1)c1nc(-c2ccc(Cl)cc2)cs1 789405784 MOLSEPWJZHPQIX-SNVBAGLBSA-N 380.281 5.063 30 20 GKED O=C(/C=C/c1cnc(-c2ccc(Br)cc2)s1)c1ccnc(F)c1 794720246 FKADFTQCAWIJRG-AATRIKPKSA-N 389.249 5.003 30 20 GKED COc1ccsc1C(C)=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 794982229 URKXYGAJBWYVKB-UHFFFAOYSA-N 392.406 5.069 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(C(C)(C)C#N)cc1 796041235 PPRXTNJPHIDUPU-DLBZAZTESA-N 392.499 5.185 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2ccccc2o1)c1csc(-c2cccs2)n1 800387666 QUKREUMRAOMHMI-GFCCVEGCSA-N 393.493 5.167 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801677745 WJWJZATVNPUKPL-CQSZACIVSA-N 379.275 5.460 30 20 GKED C[C@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)nc1Cl 817867025 RAJQHUJHPUMREN-JSGCOSHPSA-N 395.812 5.019 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1 820125671 MZLWTDIGIXPWSC-KGLIPLIRSA-N 398.359 5.130 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1 836497819 XFGFPLKKLSEWJY-KXBFYZLASA-N 383.879 5.390 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(SC(F)F)cc2)cc1 915084998 CSXVYMMMDHJIKD-FQEVSTJZSA-N 394.446 5.909 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](CC)c1ccccc1OC 916496788 RLRNVKAQOUZVKT-MRXNPFEDSA-N 378.925 5.259 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)nc(C)n1 916880381 QAHPVHAOEKDDRZ-JOCHJYFZSA-N 386.499 5.114 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CSc3ccc(C)cc3C)n2)cc1 916971552 BTGUBKMSBVKZJK-GOSISDBHSA-N 392.549 5.704 30 20 GKED Cc1c(NN=C2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cccc1C(=O)O 1776087426 BGMXDGVGOUWDNI-AWEZNQCLSA-N 377.271 5.736 30 20 GKED CCCCCCCOc1ccc(CN[C@](C)(COc2ccccc2)C(=O)O)cc1 1776787836 ACUQJGZWNIPTEB-XMMPIXPASA-N 399.531 5.048 30 20 GKED N#Cc1c(NC(=O)Cc2cccc(C(F)(F)F)c2)sc2c1CCCCC2 14500537 ULUKNXHBXCGYFI-UHFFFAOYSA-N 378.419 5.089 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1cccc(OCc2cccc(C#N)c2)c1 56153472 TYVFXXVKIDPEBG-GOSISDBHSA-N 399.494 5.139 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 56739385 LCULGFOCTOYRJR-UHFFFAOYSA-N 391.471 5.187 30 20 GKED C=CCc1cc(CNC(=O)Nc2cc(Cl)ccc2Cl)cc(OC)c1OC 65353684 MWPAATJDIAWGMJ-UHFFFAOYSA-N 395.286 5.061 30 20 GKED Cc1cccc(-c2nnc(SC[C@H](C#N)CCC#N)n2[C@H]2CCCC[C@@H]2C)c1 66237890 MBDKJXWEFFQGNH-BJLQDIEVSA-N 393.560 5.540 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 123693131 ZLOLXGJJPUXVOX-HUUCEWRRSA-N 399.564 5.081 30 20 GKED COc1cc(F)c(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1F 124574431 CNQWQYWFALNVRD-UHFFFAOYSA-N 396.418 5.249 30 20 GKED CC(C)n1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C1CC1 126515275 XOJSYRAKTBCXHP-UHFFFAOYSA-N 386.455 5.258 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@H](C#N)c3nc(C(C)C)cs3)ccc2c1 177767369 MHPSPTROMVQBCQ-LIRRHRJNSA-N 378.497 5.408 30 20 GKED C[C@@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(OCC#N)cc1 181622490 JXTVXUBCBXOCBJ-JPYJTQIMSA-N 390.458 5.199 30 20 GKED N#CCCCCNC(=O)N[C@H](c1ccccc1)c1cc(Cl)ccc1Cl 182482930 YRBVGJRWXWNFAI-GOSISDBHSA-N 376.287 5.076 30 20 GKED Cc1cc(OCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1C(C)C 197577212 PUECPWROOGXSKL-FQEVSTJZSA-N 390.508 5.497 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(C(C)C)cs1)c1ccccc1OC(F)F 255181764 HHEGQYSCZXUVTN-ICDLMJIXSA-N 376.428 5.148 30 20 GKED Cc1nn(C)c(C)c1N=C(O)CC1(Cc2nc3ccccc3s2)CCCCC1 328930577 HNLCZHQOAFVYLH-UHFFFAOYSA-N 396.560 5.818 30 20 GKED CC(C)[C@H](C/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1cccnc1 329411123 BRMUUGXGSDTXGR-KNQAVFIVSA-N 394.563 5.285 30 20 GKED OC(=Nc1ccc(Br)cc1F)C1CCC(/N=C(/O)C2CC2)CC1 329990624 JDNPYABFVQJCQT-UHFFFAOYSA-N 383.261 5.102 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)CC1 332537234 VCCOJCKHJQNHMT-UHFFFAOYSA-N 385.920 5.649 30 20 GKED C=CCC1(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)CCOCC1 424659998 CHMPFSSEWHXSKD-UHFFFAOYSA-N 388.467 5.339 30 20 GKED C=CC[C@H](C)NC(=O)C/C(=C\c1cccc(OC)c1)c1nc2ccccc2s1 426875211 MZCYCPAKAASRGH-HZGBGQKMSA-N 392.524 5.316 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430614385 YYCNTAAVVGKTLI-CQSZACIVSA-N 399.516 5.502 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc2ncsc2c1 431916460 MNGHYFHHBAVEFR-MAUKXSAKSA-N 378.501 5.092 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@H](c2ccccc2F)C1 432073519 WYWQSWOWADLYAZ-IKGGRYGDSA-N 397.519 5.678 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)c1ccccc1SCc1ccc(C#N)cc1 432626869 NCGKKHMCDCSJMU-QGZVFWFLSA-N 376.525 5.255 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 438494694 UCMJINVKYFYOTL-YLJYHZDGSA-N 397.906 5.431 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1 438836107 FBGFRESRRJFPSJ-UWJYYQICSA-N 381.545 5.592 30 20 GKED C=CCOCCCC(=O)N(Cc1ccccc1)c1nc2c(C)cccc2s1 443805673 GMUUXGSGGXRXCF-UHFFFAOYSA-N 380.513 5.121 30 20 GKED N#Cc1c(NC(=O)[C@H]2SCCc3ccccc32)sc2c1CCCCCC2 443873696 DSKCJDVSWUNTJL-IBGZPJMESA-N 382.554 5.248 30 20 GKED COc1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)[C@H](C)C2CC2)cc1 455702882 LOHNGPRKWWQFDM-OAHLLOKOSA-N 397.906 5.247 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1ccccc1OC1CCCC1 457550213 MSKUWSJDLDHZDR-UHFFFAOYSA-N 380.513 5.195 30 20 GKED Cc1ccc(-c2nc(Cc3noc([C@@H](C)c4cccc(C#N)c4)n3)cs2)cc1 462829684 KIFIFDFBOKNRIH-HNNXBMFYSA-N 386.480 5.116 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc2c1OCC2)c1nc2cc(Cl)ccc2s1 463072818 WSVXPMBQPKELSE-ZDUSSCGKSA-N 389.263 5.028 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c(-c2ccccc2)s1 464411221 LVHMWYMTEFNAGW-AWEZNQCLSA-N 387.386 5.022 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2sc3ccccc3c2Br)cc1 464570521 MAVAWYFGGAKXOR-OAHLLOKOSA-N 399.313 5.221 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)Nc1ccccc1SC[C@H](C)C#N 469975636 TUBXJMQHCQLFOG-MRXNPFEDSA-N 398.528 5.378 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 470268506 YYSUIFHYUMGASD-CXAGYDPISA-N 389.377 5.155 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CC1(CSc2ccccc2)CC1 471821433 LGVFSODIJPFHBW-QGZVFWFLSA-N 396.581 5.839 30 20 GKED N#C[C@H](C(=O)c1ccc2sccc2c1)c1nc(-c2c(F)cccc2F)cs1 473137440 FCLODBAXMBEXFJ-CYBMUJFWSA-N 396.443 5.793 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccccc2SC(C)C)cc1 473847281 DENMYYPDPNOBAW-UHFFFAOYSA-N 384.505 5.139 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCc1ccc(OC)c(OC)c1 475546997 MMAMUIHSJSPDOC-UHFFFAOYSA-N 396.531 5.310 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)cc1 476337773 QNFDMKAEADODED-UHFFFAOYSA-N 398.428 5.436 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc2ncsc2c1 478729379 XZCSCGRHPRYSHC-UHFFFAOYSA-N 387.489 5.571 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1cccnc1Oc1cccc(F)c1 481925104 UZGRLNOKLAIGND-QHCPKHFHSA-N 387.458 5.442 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(Sc2ncccn2)cc1C 485288659 PBNMNMVOVGAMDI-UHFFFAOYSA-N 396.560 5.536 30 20 GKED Cc1ccc(CCC(=O)N[C@H](CCCC#N)c2ccccc2)c(Br)c1 487499392 HMKNFCVKKUNQHK-HXUWFJFHSA-N 399.332 5.242 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1OC 487788535 HBZACLFNXJTFIR-UHFFFAOYSA-N 395.405 5.458 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Sc3nc(C(F)(F)F)ccc3C#N)o2)cc1 488727871 BNCILXNZPVJLPE-NSHDSACASA-N 390.390 5.184 30 20 GKED C[C@@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1nc(-c2ccccc2)no1 489713312 WYCVYSXRJUWZHQ-QGZVFWFLSA-N 396.450 5.360 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CC4(CCC4)[C@H]3c3ccccc3)cc2)nc1 495354509 RVXLNYLHSQGCFT-HSZRJFAPSA-N 395.462 5.113 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(C)c1-c1ccccc1 496732911 AMCXESPRWAUUFP-UHFFFAOYSA-N 386.908 5.022 30 20 GKED N#CC1(CCCN[C@@H](Cc2ccccc2Cl)c2ccccc2)CCOCC1 499599326 CFYGRSJRZQHLCF-QFIPXVFZSA-N 382.935 5.314 30 20 GKED Cc1ccc(OCc2nc(CSCCOc3cccc(C#N)c3)cs2)cc1 504436079 WBMXEYUVSYVTBL-UHFFFAOYSA-N 396.537 5.214 30 20 GKED COCCC[C@@H](c1ccc(Cl)cc1)c1noc(-c2ccc(C#N)cc2C)n1 508668493 YNCNYKUZPYIJKL-IBGZPJMESA-N 381.863 5.129 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)c1ccc(C#N)cc1 510261835 ZVAUCUOKNAEHOQ-UHFFFAOYSA-N 398.249 5.329 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 514575116 JKAJCSKPFAWYFC-UHFFFAOYSA-N 396.462 5.162 30 20 GKED Cc1ccc(CCCC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 515448990 FYRYGXJUOUEYGS-UHFFFAOYSA-N 397.478 5.080 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccnc3C(F)(F)F)c2)cc1 516511556 RGYZMBWSTZMOHI-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)cc1 520947875 APSBFGZUYJARPA-SFHVURJKSA-N 381.516 5.432 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)cc2cccnc12 521715577 SPHSVWYHIKQBST-UHFFFAOYSA-N 396.834 5.017 30 20 GKED CCN(C(=O)Cc1csc(-c2ccc(C)cc2)n1)c1ccc(C#N)c(Cl)c1 534385084 YEGWFQAAIWLGLP-UHFFFAOYSA-N 395.915 5.239 30 20 GKED CCN(CC)c1ncc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 543070931 MARAVVQSSYNMNS-QGZVFWFLSA-N 390.556 5.379 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(Cc3ccccn3)no2)c1 544922499 RGTLPLZRMZLXGP-UHFFFAOYSA-N 388.814 5.040 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)n1cnc2ccccc21 552156816 ZDZZMWNONSDUFG-KRWDZBQOSA-N 396.450 5.208 30 20 GKED C=CCCO[C@H](C)c1nc(-c2ncoc2-c2cccc(C(F)(F)F)c2)no1 554839023 KGTAMYCSCTWPSY-LLVKDONJSA-N 379.338 5.064 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)N[C@@](C)(C#N)C3CCCCC3)s2)cc1 561602289 ZRSSQIOEAKYHFN-QFIPXVFZSA-N 397.544 5.110 30 20 GKED Cc1c(Cl)cccc1-n1c(S[C@H](C)CCC#N)nnc1-c1ccncc1 568302763 RHGMGXOHBHCNIR-CYBMUJFWSA-N 383.908 5.076 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)C1CCC(F)(F)CC1 569254574 QIIFGQDBHALGBH-UHFFFAOYSA-N 385.414 5.392 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(N2CCc3cc(F)ccc32)CC1 584219829 LRPRYHJBGJFXCM-UHFFFAOYSA-N 393.506 5.003 30 20 GKED N#CCCCCCC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 588156489 VGBFITBHNFNJCN-UHFFFAOYSA-N 390.405 5.697 30 20 GKED Cc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)nnn1-c1ccc(Cl)cc1 590257336 NEJKHWVEUAGMOG-HRAATJIYSA-N 393.922 5.315 30 20 GKED C[C@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(O[C@H](C)c2ccccc2)cc1 595640858 VOUZZFHVWKDYCL-WEMPKCCASA-N 391.515 5.269 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1CCC2(CC1)CC2(F)F 596735482 NYYWWXUOCKNVHX-WRSVWVKZSA-N 379.476 5.170 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCC(F)(F)CC2)cc1F 599757454 PGCKREHXQGXRLW-UHFFFAOYSA-N 389.377 5.143 30 20 GKED C[C@H](Sc1ccc(Cl)cn1)C(=O)Nc1sc2c(c1C#N)CCCCC2 603503427 QZOWKUMZRUWYOQ-NSHDSACASA-N 391.949 5.056 30 20 GKED Cc1ccc2cc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)[nH]c2c1 604103139 UHNWCCCVUUDWKD-UHFFFAOYSA-N 382.423 5.096 30 20 GKED CCc1nc(C)c(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)s1 604517365 RZHRSKCHMHBENE-UHFFFAOYSA-N 393.487 5.180 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(Cl)cc3)cc2F)c1 609107296 YKSXWPJXSGWAMV-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 609433711 CTTZKTUYUCQCBL-FQEVSTJZSA-N 397.478 5.680 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)NC[C@H](C)c1ccccc1 609466149 MGTAJYKWBRNPMU-OALUTQOASA-N 399.494 5.071 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2cccc(COc3ccc(C#N)cc3)c2)c1 609643836 VEKBOXPLNXSQJB-KRWDZBQOSA-N 386.451 5.097 30 20 GKED CCCN(CC(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609724446 OGCPAMHHHBCBRK-UHFFFAOYSA-N 378.806 5.121 30 20 GKED COc1cc(CN(C)Cc2sccc2C)ccc1OCc1cccc(C#N)c1 609739459 ODQRHLDERVNCPQ-UHFFFAOYSA-N 392.524 5.148 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)CCCCOc2cccc(C#N)c2)o1 610050285 FGNIFJJSVGTYOC-JOCHJYFZSA-N 394.515 5.407 30 20 GKED CC(C)=CCSc1ccccc1C(=O)Nc1sc2c(c1C#N)CCCC2 610151474 SNAYLOCLLWXSCV-UHFFFAOYSA-N 382.554 5.809 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3n[nH]cc3c2)cc1Cl 610436205 GVRREYQTFHJPSA-LJQANCHMSA-N 386.842 5.124 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)C1 612307356 AIPFNZNZUVIRGT-NRFANRHFSA-N 383.879 5.077 30 20 GKED Fc1cc(-c2noc([C@@H](C[C@H]3CCCO3)C(F)(F)F)n2)ccc1C(F)(F)F 650533138 MJTHYCYXZZOFNO-MWLCHTKSSA-N 398.278 5.110 30 20 GKED COc1ccc([C@@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 675737161 AYLGCRRICLKLFO-WYUUTHIRSA-N 387.339 5.394 30 20 GKED FC(F)Oc1ccc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)nc1 678310682 KXNNDZMSJDDYEP-YUMQZZPRSA-N 378.263 5.004 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc2ccccc2n1 679536478 LCMBNVZXUPVWFG-CQSZACIVSA-N 391.402 5.127 30 20 GKED Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 726501502 CAFPKPDPXGJGBR-HSZRJFAPSA-N 392.462 5.089 30 20 GKED C=CCc1cc(/C=C(/Cl)c2nc3cc(F)ccc3n2CC)cc(OC)c1O 727267379 IZJZEYCBVQPIOD-MHWRWJLKSA-N 386.854 5.375 30 20 GKED C#CC[C@H](OC(=O)[C@H](C)Sc1cc(Cl)ccc1Cl)c1ccccn1 727776071 RHYKOVZJJNQRGI-LRDDRELGSA-N 380.296 5.177 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/CCOc3c(ccc(Cl)c3Cl)C2=O)cc1 728697870 YIUFTCQNNDBBNU-XTCQQWIJSA-N 388.250 5.333 30 20 GKED N#C[C@@H](C(=O)CC1CCC(c2ccccc2)CC1)C(=O)Nc1ccccc1Cl 731135602 FQBUXBAROHMRAU-KVZIAJEVSA-N 394.902 5.351 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)Nc1cccc(OCC#N)c1 735367237 YDCRTFONVQWQSI-UHFFFAOYSA-N 387.439 5.120 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3OC)cc2)cc1 741467541 NZJYXSLKTBVJOX-SXGWCWSVSA-N 388.463 5.284 30 20 GKED CCN(c1ccccc1)c1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1 742370143 HQCIHJYNMVZPSY-HXUWFJFHSA-N 385.511 5.598 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 742538268 WKNCDLUNRYYCRB-LKDDOFHYSA-N 390.527 5.654 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](c3ccccc3)C(C)C)n2)cc1 744061750 OBIHTRADLNRXOU-CTNGQTDRSA-N 390.508 5.435 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(OCC2CCCCC2)cc1 748285248 SXRVCUCQEBHBAU-UHFFFAOYSA-N 380.513 5.514 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cnc(-c3cccs3)s2)S1 751511827 BKHQNUNJDPPHJF-OQLLNIDSSA-N 397.550 5.380 30 20 GKED N#Cc1ccc(-c2ccn(Cc3coc(-c4ccc(C(F)(F)F)cc4)n3)n2)cc1 755814668 USPNYDAOSFZTLJ-UHFFFAOYSA-N 394.356 5.144 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)COc2cc(Cl)cc(Cl)c21 758912133 LNDBRPUIBJUOMH-YHYXMXQVSA-N 389.263 5.171 30 20 GKED C=CC[C@H](NC(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1)c1ccncc1 761704094 ZSBFIKUKYMXFLB-LOSJGSFVSA-N 397.522 5.251 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3ccc(C#N)cc3Cl)c(F)c2)c(F)c1 769737248 MPWPUSVQTMXBJI-UHFFFAOYSA-N 398.796 5.418 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](CC(C)(C)C)c2ccccc2)ccc1OC 776165887 YCEYFJBDTZUDLM-SFTDATJTSA-N 380.532 5.643 30 20 GKED N#CC1(c2ccc(COC(=O)c3csc(-c4ccccc4Cl)n3)cc2)CC1 777140524 SFCMXZOEEHWERR-UHFFFAOYSA-N 394.883 5.376 30 20 GKED CC(C)n1ncc2cc(/C=C3\CCc4[nH]c5ccccc5c4C3=O)c(Cl)nc21 781551328 GZMBTQXGDPWAKK-UKTHLTGXSA-N 390.874 5.359 30 20 GKED C[C@H](NC(=O)Nc1cccnc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 782252017 NVJKSKSWWVCJMW-AWEZNQCLSA-N 376.847 5.156 30 20 GKED C=C[C@H](CC(=O)O[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784402891 OUTKNYKYVIUYQR-LSDHHAIUSA-N 382.847 5.354 30 20 GKED COc1ccc(CC(=NOC[C@@H]2CCOC2)c2cc(Cl)ccc2Cl)cc1 788033688 KMXMFGMFVLBGJB-OAHLLOKOSA-N 394.298 5.002 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CC(=O)c2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 789349460 YRYKWFNTMVLNGE-SJORKVTESA-N 392.867 5.010 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccnc(F)c1 794720616 GVPYGQBUJCULLS-RUDMXATFSA-N 380.806 5.023 30 20 GKED COc1cccc2cc(C(=O)/C=C/c3csc(-c4ccc(F)cc4)n3)oc12 797152740 VBJSCOYMUGSEQQ-MDZDMXLPSA-N 379.412 5.600 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(Oc2nc(Cl)c(C#N)s2)cc1 804431708 WAIZCAKXZBHMGF-UHFFFAOYSA-N 375.862 5.083 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)C(=O)Nc3ccc(F)c(Cl)c3)c2c1 805856530 XGCJRRNCZBWCNE-HNNXBMFYSA-N 398.821 5.310 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2nc3ccc(Br)cc3s2)co1 806557596 FCAGDZUXLULHGO-WAYWQWQTSA-N 377.263 5.066 30 20 GKED N#Cc1csc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)n1 811689539 GJHGVWCMGCZTRB-XFFZJAGNSA-N 383.885 5.004 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211227 GIOGMWSKSUOCGY-AEFFLSMTSA-N 390.405 5.258 30 20 GKED C[C@@H](Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1)c1cccc(C#N)c1 864006831 MHPXJQQPWPFGDE-SNVBAGLBSA-N 389.204 5.979 30 20 GKED C[C@]1(C(F)(F)F)CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 878217589 AWGXXWQMWFULNJ-ICSRJNTNSA-N 387.405 5.148 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)NCc2ccc(SC)c(C#N)c2)cc1 886688587 VSEMVMVQJSMCSC-MRXNPFEDSA-N 396.560 5.005 30 20 GKED CC(C)c1ccccc1N=C1SCCCN1C(=O)CSCc1cccnc1 915133711 VVTJTPKTCKYRRN-UHFFFAOYSA-N 399.585 5.091 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(OCc2ccccc2Cl)cc1 917590790 FZHSEDLNSRMFFV-UHFFFAOYSA-N 393.899 5.600 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 919773341 FGTRKWIHRHPFHV-OXJNMPFZSA-N 375.497 5.595 30 20 GKED O=C(O)c1ccc(NN=Cc2cc(F)ccc2Oc2ccc(Cl)cc2)cc1 1776012336 PDGBIXDRYJEKQI-UHFFFAOYSA-N 384.794 5.416 30 20 GKED O=C(O)c1cc(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)ccc1Cl 1776033690 RZFRJXVUISPLQH-GFCCVEGCSA-N 396.796 5.793 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C/C(=O)c2ccc(C(=O)O)cc2O)cc1Cl 1776353617 LMDIGQOYKGLQMI-GQCTYLIASA-N 395.238 5.081 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2cccs2)cc1 1776354615 PBCIHYRTNLTSOC-YRNVUSSQSA-N 392.476 5.797 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(OC(F)F)ccc2ccccc12 1776784087 QEOSKCJQUGCQHL-KRWDZBQOSA-N 393.474 5.735 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(C(C)(C)C(=O)O)cc2)c1 1776787409 DGQHBPUZVVSUGC-UHFFFAOYSA-N 383.532 6.010 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776817271 IVGWRXOZEKCRMR-ZRDIBKRKSA-N 392.476 5.798 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2ccc(CC(=O)O)cc2)cc1 1776869275 ZYWFWAGBOGYEOT-SFQUDFHCSA-N 399.490 5.236 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2ccc(C(=O)O)cc2Cl)s1 1777462897 JOCIIGJMLDXHOA-CMDGGOBGSA-N 383.856 5.366 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(F)ccc2Oc2cccc(Cl)c2)c1 1777684980 RDQBYUFAWXFKQK-CLFYSBASSA-N 396.801 5.866 30 20 GKED Cc1sc2nc3n(c(=O)c2c1-c1ccccc1)CC/C3=C\c1cccc(C#N)c1 14179216 ZTXQYFDAMLJDIV-CPNJWEJPSA-N 395.487 5.249 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCC1(c2ccccc2)CC1 26675548 REXKDUYHUWIWHD-UHFFFAOYSA-N 384.504 5.171 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(-c3ccsc3)n2)n1 28139308 NTGMDDMNKQHALY-UHFFFAOYSA-N 397.472 5.758 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 69606913 KBDUIJFRNSYUGO-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1cc(F)ccc1F)c1ccccc1)c1ccccn1 106983671 HRORRMVBVLYFLU-KKSFZXQISA-N 380.419 5.070 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1ccc(F)cc1F 108533508 NDWOEKURAIIPGB-QWHCGFSZSA-N 375.444 5.099 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccoc1C 118610024 VFPSNXFOCVEMOU-HNNXBMFYSA-N 392.484 5.541 30 20 GKED CCN(Cc1cc2cnn(C(C)C)c2nc1Cl)[C@H](C)c1ccc(C#N)cc1 119852415 IWIVYOUYEBEFQH-OAHLLOKOSA-N 381.911 5.120 30 20 GKED Cc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1Br 120607427 IWPYOIRSKQHMDT-UHFFFAOYSA-N 386.293 5.072 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)c2)n1 120985573 UYPCZEAKCPIKHJ-UHFFFAOYSA-N 388.471 5.273 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Cl)cc2Br)c1 124517122 JMKIZZVVLASBRL-UHFFFAOYSA-N 393.668 5.037 30 20 GKED CCCn1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1C1CC1 126515024 RFEPQKFEZCKDCO-UHFFFAOYSA-N 386.455 5.087 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccccc1NC(=O)Cc1cccs1 131697630 XJUKUPCNHRUYJJ-UHFFFAOYSA-N 389.524 5.343 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1c(Cl)ccc(Cl)c1Cl 133313999 SNVHEBFVESGEPH-JTQLQIEISA-N 399.730 6.151 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCCCCC(F)(F)F 156124850 WBOVDAIPPGVKMI-ZDUSSCGKSA-N 390.496 5.485 30 20 GKED COc1ccc(N[C@@H](C)c2ccc(C#N)cc2)cc1NC(=O)C1CCCCC1 174103962 JIVQIIAHLLMAMX-INIZCTEOSA-N 377.488 5.259 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(Cl)s1 175120233 BOQUHPZHOHYDDC-PSASIEDQSA-N 381.309 5.645 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2cccc(CC#N)c2)nc1-c1ccc(Cl)cc1 176334999 DUHYXRGXCFGOPQ-CYBMUJFWSA-N 395.915 5.329 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(C)cc2)C2CCC2)ccc1OC 187338309 DAWNUJBSJFWQFA-QPPBQGQZSA-N 378.516 5.316 30 20 GKED C[C@H](Nc1ccc(F)cc1C#N)c1cccc(NC(=O)Cc2ccccc2F)c1 301376584 RQAMIFNNGHLHAY-HNNXBMFYSA-N 391.421 5.191 30 20 GKED C[C@@H](/N=C(/O)C1CCCCC1)C(O)=Nc1cccc2c1CN(CC(F)(F)F)C2 328641452 DHAXHXMCZSWZGC-CYBMUJFWSA-N 397.441 5.078 30 20 GKED Cc1ncsc1CCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 413402984 KGHIOJQCWGCSNU-UHFFFAOYSA-N 399.463 5.047 30 20 GKED CC(C)C1(c2ccccc2)CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 416802002 APTHDYZFQAWTDT-SFHVURJKSA-N 393.556 5.522 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F 429256077 OYPNJJXULYSMOC-UHFFFAOYSA-N 391.821 5.075 30 20 GKED C[C@H](NC(=O)Nc1cnn([C@H](C)C2CC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 429663907 VFZTZKSZUXKOLD-DLBZAZTESA-N 399.498 5.275 30 20 GKED CCOc1c(F)cccc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 442668516 AXJSCICQHKBVQZ-INIZCTEOSA-N 380.444 5.146 30 20 GKED Cc1cc(C)cc([C@@H]2CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)c1 444271231 XQJSUSXQKYCKGJ-HXUWFJFHSA-N 385.511 5.192 30 20 GKED C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 445637152 RIBTZYAGNJEMLO-VIFPVBQESA-N 395.274 5.269 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(Cl)c2ccccc12 463267120 PPZUQVBUZFZFSK-HNNXBMFYSA-N 377.875 5.267 30 20 GKED C=CC[C@@H](CC)NC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 466323875 BQKKOSYQTLIXEG-MRXNPFEDSA-N 392.330 5.455 30 20 GKED C[C@H]1C[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccsc2S1 469317983 GIBYIIBGXZKHJB-KSSFIOAISA-N 397.569 5.369 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCC[C@H]1c1nc2ccccc2o1 474361826 ZRSGUNQJEPXSOH-KRWDZBQOSA-N 391.475 5.015 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2ccccc2Cl)n1 476139036 IDHFQOXDPQYEPU-UHFFFAOYSA-N 393.918 5.938 30 20 GKED C=CCn1c(SCc2ncc(-c3cccc(F)c3)o2)nnc1-c1ccccc1 476468496 DFGYMRSDGHENHN-UHFFFAOYSA-N 392.459 5.218 30 20 GKED C=C(C)Cn1c(SCc2ccc(Cl)c(Cl)c2)nnc1-c1ccncc1 481374070 PKSCISSGNOAKHO-UHFFFAOYSA-N 391.327 5.515 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(OC(F)F)c2cccnc12)c1ccccc1 482063835 ACPHWMXHQLIODB-MRXNPFEDSA-N 396.397 5.003 30 20 GKED Cc1nc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)ccc2o1 483459795 IVXMCQJJKGFGJO-HNNXBMFYSA-N 393.855 5.403 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnn(-c2cccc(F)c2)c1CCC 485472422 CBXBFZVKTKSWGM-UHFFFAOYSA-N 395.503 5.494 30 20 GKED C=CCn1c(SCC(=O)c2cc(F)c(C)cc2F)nnc1-c1ccccc1C 488881801 OJJOLDGBUAMIDO-UHFFFAOYSA-N 399.466 5.001 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(Cc2nnc3ccccn23)cc1)c1ccccc1 488902182 VAXWLVDZQNBOPP-JOCHJYFZSA-N 396.494 5.009 30 20 GKED COc1ccc([C@@H](NCc2cc(C#N)ccc2F)c2ccccc2Cl)cc1 494020073 KXLIVMIATMYHOO-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 494546472 JIYFECYOUDSFDN-UHFFFAOYSA-N 396.450 5.496 30 20 GKED N#C[C@@H](C(=O)c1cccn1C1CCCC1)c1nc(-c2ccc(Cl)cc2)cs1 496571412 KLYNKOWUGSFAPZ-KRWDZBQOSA-N 395.915 5.870 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N(C)CC(C)(C)C#N 497337587 FUMKJXFQFUWKBS-UHFFFAOYSA-N 394.302 5.223 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1CC(C)C 501133627 KUMRSRRAEJZWCX-IBGZPJMESA-N 377.488 5.701 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cccc(C(F)(F)F)c1 502415983 IFABNMZSRSSNEA-OAHLLOKOSA-N 399.416 5.137 30 20 GKED Cc1ccc(Br)c(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c1 505933721 MBTZYALIKZZFMW-HNNXBMFYSA-N 398.087 5.059 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(COc3ccccc3C#N)o2)c1 515980623 TUPGZLVYMMEUQZ-NRFANRHFSA-N 386.451 5.016 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)Nc1ccccc1S[C@H](C)CC#N 517517629 FKABMSTVSLPHKZ-SOAMZJECSA-N 388.577 5.497 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1nc(C(C)(C)C)cs1 518030653 RWZSNYIDJCIWFM-AWEZNQCLSA-N 375.513 5.039 30 20 GKED CSc1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 518870124 UMOHDQKSDLPQSM-ZDUSSCGKSA-N 386.448 5.300 30 20 GKED C=CCN(C(=O)C[C@@H](C)c1cccc(F)c1)c1nc(-c2ccccc2)cs1 522540844 JLAVMUFKYDQODH-MRXNPFEDSA-N 380.488 5.662 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 522702585 TWLNLMZCLPXTRL-YLJYHZDGSA-N 381.501 5.146 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1c(C)cccc1C 523110762 CFVRAFZTYABWCY-UHFFFAOYSA-N 383.492 5.091 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nnc(Cc3cccs3)o2)cc1 524291039 UZSSSOCRRLJRLJ-UHFFFAOYSA-N 389.505 5.553 30 20 GKED CC[C@@H]1CCCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 525345472 PAFYTDPLYRKZHE-HXUWFJFHSA-N 395.478 5.463 30 20 GKED N#CC[C@@H](CC(=O)N1CCCC[C@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 526011209 YUWUEJSMWIOJPD-GMAHTHKFSA-N 398.510 5.218 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc([C@H]2CCOC2)c1 534138588 YDYLWCOSCGQUOA-NRFANRHFSA-N 398.462 5.415 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Cl)cc2-c2nc3ccccc3[nH]2)cc1 534755144 ILRAVNQFSSSIKY-UHFFFAOYSA-N 386.842 5.202 30 20 GKED CCc1cccnc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 536396174 RJJJBHDFHQDCOM-UHFFFAOYSA-N 377.831 5.214 30 20 GKED COc1cc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)ccc1OCc1ccccc1 537294225 ARMHQZZMNSSVNU-RTBURBONSA-N 386.495 5.558 30 20 GKED CC(C)C[C@@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 539296156 ZNSPXULBRVPFAE-LJQANCHMSA-N 380.879 5.139 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN[C@@H](C)c2ccc(C#N)cc2)on1 542775542 WPJCVFRLDRKNSW-INIZCTEOSA-N 383.451 5.226 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN[C@H](C)c2ccc(C#N)cc2)on1 542775543 WPJCVFRLDRKNSW-MRXNPFEDSA-N 383.451 5.226 30 20 GKED C[C@H](NCc1nc(C(C)(C)C)cs1)c1ccc(-c2cccc(C#N)c2)cc1 543871219 XUTLZQVLIUENGD-INIZCTEOSA-N 375.541 5.830 30 20 GKED N#C[C@@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1cccc(C(F)(F)F)c1 544005854 YVEOPPVHGBEEFZ-ABIUDSBCSA-N 392.343 5.145 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 552241460 QLWAPNSRUITCRN-LBPRGKRZSA-N 394.327 5.854 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CSc1nnc(C(F)(F)F)s1 553431915 GXQCYSNJMBORPW-UHFFFAOYSA-N 380.285 5.146 30 20 GKED N#Cc1cnc2c(F)c(F)c(F)cc2c1N1CC[C@H](C(F)(F)F)C2(CCC2)C1 557688448 FVFQTKGOPSTGFL-ZDUSSCGKSA-N 399.338 5.083 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1[C@@H]1CCCO1)c1ccc(C(F)(F)F)cc1 560107465 QJHCZHFGDXOPGJ-OTWHNJEPSA-N 396.453 5.066 30 20 GKED C=CCN(CC=C)C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 563754586 MPKHXWLBAYJJLN-UHFFFAOYSA-N 378.900 5.081 30 20 GKED Cc1cc(Br)c(NC(=O)c2cc(C#N)ccc2Cl)cc1Cl 565675166 YXGQHFGVXAUTAD-UHFFFAOYSA-N 384.060 5.188 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(CC#N)cc2)CCC3)cc1 571045883 NDYHAKVNEJFJML-HXUWFJFHSA-N 389.524 5.052 30 20 GKED N#CCc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1 572879272 XWNKNDSLFBXVKX-QFIPXVFZSA-N 378.422 5.233 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cncc(Cl)c1Br 573760564 YSPUMYIHYPBVAQ-UHFFFAOYSA-N 383.698 5.028 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 584000599 OGIWCRJGSJYDSH-UHFFFAOYSA-N 396.450 5.213 30 20 GKED Cc1nc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(Cl)cc1C#N 589685013 OSJRFICFONTTQQ-URLYPYJESA-N 385.739 5.237 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCc3[nH]c4ccc(C)cc4c3C2)c1 589741428 ZLLMMSGQMIWYRZ-UHFFFAOYSA-N 375.472 5.021 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)N(CC#N)c3ccc(Cl)cc3)c12 592649967 GNMYHZINKXRBLH-UHFFFAOYSA-N 394.862 5.047 30 20 GKED COc1cc(NC(=O)Nc2cccc(OCCCC#N)c2)c(C2CC2)cc1Cl 594205664 CXMMHNDOJJOYTD-UHFFFAOYSA-N 399.878 5.553 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccncc1 596736964 XTRPOCIMHDZEHP-JXFKEZNVSA-N 392.528 5.235 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ncc(-c2ccccc2)s1 603595532 OWWXVCCDHUGDDY-UHFFFAOYSA-N 381.460 5.601 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1cncc2ccccc12 603958191 KDHFAVBMMKXIEP-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 605965730 ZAGOBOGOQPJISR-IBGZPJMESA-N 387.321 5.146 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccccc1C(C)(C)C 609428195 CNOIGNMDOIFGKM-MRXNPFEDSA-N 382.529 5.396 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H]2CSCc3ccccc32)c1 609433241 NMOJDWIJMILJLD-DEOSSOPVSA-N 386.520 5.215 30 20 GKED C[C@@H](c1ccccc1)n1c(SCCC(C)(C)C#N)nnc1-c1ccccc1 610286033 LEROTXCTKMXLEJ-KRWDZBQOSA-N 376.529 5.586 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)N[C@H](C)c1cccc(C#N)c1 610407291 UQJCFHGWUKCRQP-QGZVFWFLSA-N 389.499 5.550 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1coc(-c2ccc(Cl)cc2)n1 610528370 SSSLURNAPQNFMP-UHFFFAOYSA-N 375.211 5.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCN(C)c2ccccc21 611014373 LJEWKNMCPFZCEG-QFIPXVFZSA-N 397.478 5.221 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(NC(=O)c2ccc(F)cc2)cc1 611392534 SWNYAMSNVWZINI-XMMPIXPASA-N 399.469 5.117 30 20 GKED CCc1ccsc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 619753823 RGJWNFHZFGMUJV-NSHDSACASA-N 380.416 5.429 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)NCc1ccc(C#N)c(Cl)c1 619788920 AAVWMRMJECQOQM-UHFFFAOYSA-N 387.936 5.483 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(C(F)F)ccc1F 650380425 RDTLQKIIOBNTMI-UHFFFAOYSA-N 380.414 5.151 30 20 GKED O=C(NC[C@@H]1CCCC[C@H]1C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 685772856 GUSSBQXHXFXJRU-WCBMZHEXSA-N 389.286 5.082 30 20 GKED CCN(C(=S)NCc1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 726480907 OGKSZJSQAZQITM-AWEZNQCLSA-N 391.462 5.035 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2cnc(-c3ccccc3)s2)cc1Cl 727264840 YEKIKGJYTLBWGM-CMDGGOBGSA-N 385.872 5.377 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccccc1SC(F)(F)F 727998521 KCYLEWDIJMLRMM-UHFFFAOYSA-N 383.288 5.709 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3csc(-c4ccccn4)n3)c(C)c2c1 729151922 YGCVATUXYDYIJQ-SOFGYWHQSA-N 376.437 5.164 30 20 GKED Cc1ccc(S[C@H](C(=O)[C@H](C#N)c2nc(C)cs2)c2ccccc2)c(C)c1 730071051 KQSGHRLFSHDFOA-RXVVDRJESA-N 392.549 5.778 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730417008 KQRQLQCQIKMPIN-AAEUAGOBSA-N 388.851 5.041 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc3c(c2)-c2ccccc2C3)cc1 731192931 VIWUBGRALWBSIF-UHFFFAOYSA-N 382.463 5.217 30 20 GKED Cc1cccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(O[C@@H](C)C#N)cc2)c1 731298249 DVCKRGGEEJLQKZ-GAJHUEQPSA-N 383.451 5.057 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(N3CCCC3=O)cc2)ccc1Oc1cccnc1 732713957 JMYHVORNQKEMFB-SDQBBNPISA-N 398.462 5.205 30 20 GKED O=[S@@](Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1)c1ccccc1 734366100 FEQDNMOVQDUPKI-NDEPHWFRSA-N 385.488 5.604 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 734706316 CHKHCTMOBHZQCO-VQIMIIECSA-N 392.911 5.760 30 20 GKED Cc1c(C#N)c(NC(=O)CS[C@@H](C)c2cccs2)n(C2CCCC2)c1C 737405366 NIWFHFJOAFXRPB-HNNXBMFYSA-N 387.574 5.586 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2SCCc3sccc32)cc1 742537755 PGKZEFYNVUZLFR-CTNGQTDRSA-N 390.533 5.373 30 20 GKED CC(C)(C)C[C@H](NC(=O)NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 743583256 PGMWEGWGOZFOQC-FQEVSTJZSA-N 399.922 5.219 30 20 GKED CC(C)c1ccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)cc1 745724803 XMIZVUJSIOZACH-UHFFFAOYSA-N 385.536 6.085 30 20 GKED N#C[C@@H](C(=O)Cc1coc2cc(F)ccc12)c1nc2cc(Cl)ccc2s1 749025547 PENDFFWGLRYJJC-AWEZNQCLSA-N 384.819 5.254 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)c2ccc(Cl)s2)cc1 750686657 ILQOKLVGSOJSFP-XEZPLFJOSA-N 388.920 5.366 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@H](C)c1ccc2ccccc2c1 753389787 JAMZVTISCWDNOH-VFNWGFHPSA-N 380.447 5.325 30 20 GKED N#Cc1cccc(COc2ccc(NCc3coc(-c4ccccc4)n3)cc2F)c1 755426726 SMYQMWQCFNFHFL-UHFFFAOYSA-N 399.425 5.543 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C\c1ccc2[nH]ccc2c1 765624511 NCFBSOAKNRVPJM-UITAMQMPSA-N 394.434 5.187 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3cccc(F)c3F)cc2)oc1C(=O)O 776268486 QTHZFIZXEKBMBX-YFHOEESVSA-N 398.361 5.040 30 20 GKED N#CC1(c2ccc(COC(=O)c3ccc(C4SCCCS4)cc3)cc2)CC1 777145772 GEPYWCVJYQKLMY-UHFFFAOYSA-N 395.549 5.467 30 20 GKED C/C=C\C(=O)N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 783557730 HXHGGOUXBHFVBZ-OTDNITJGSA-N 379.222 5.020 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)c1 789430933 OLNDSYWQUFVMAK-KXBFYZLASA-N 375.472 5.030 30 20 GKED CO/C(=C/c1ccccc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 791348936 LIXXPABQECVMMI-BUVRLJJBSA-N 398.462 5.072 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@H](C#N)Cc1ccc(C#N)cc1 791556716 LRGMHABVHYIAIP-SFHVURJKSA-N 377.513 5.078 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797571936 SAKMFWFISBIHOV-WCQYABFASA-N 380.435 5.439 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(Oc2cccnc2)cc1 808762385 BRDOUPKWLFBXHM-MRXNPFEDSA-N 393.874 5.280 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)[C@@H]2CC=CC[C@H]2c2nc3ccccc3s2)CC1 809089444 CWLJSSRCKHJKEK-XMTFNYHQSA-N 380.513 5.219 30 20 GKED O=C(Nc1cccc(NCC(F)(F)F)c1)[C@H](F)c1ccc(C(F)(F)F)cc1 819569234 JHNHIKMVPRLSBQ-CQSZACIVSA-N 394.290 5.329 30 20 GKED CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](N[C@@H](CCCC#N)c3ccccc3)C[C@H]2C1 842874609 DUMZWZXOIUGMBQ-CMOCDZPBSA-N 397.563 5.047 30 20 GKED N#C[C@H](C(=O)C1CC2(CC2)C1)c1nc(-c2ccc(Cl)cc2Cl)cs1 850765562 YKPWMLOCLVEBHW-CYBMUJFWSA-N 377.296 5.483 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1OC 915086552 LBWTZJKIYRMSTP-JOCHJYFZSA-N 398.462 5.168 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc4ccccc4c(Cl)n3)n2)cc1 915133086 KXZDEJVIWWBUCS-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 916708043 GYMMQNUUGWSGFA-KXBFYZLASA-N 391.421 5.503 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 916849346 PMNFIOBJLHIKIX-NRFANRHFSA-N 384.479 5.417 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2)c(C)n1C1CCCCC1 916885222 PUIGYSMJVIMPOU-HXUWFJFHSA-N 397.906 5.225 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc([C@H](C)CC)cc2)cc1 918486994 NTZRSKFSRQLOIV-IIBYNOLFSA-N 394.540 5.414 30 20 GKED N#CCCC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(CC(F)F)C2)c1ccccc1 922603972 VUKXONBCNRUSPC-FHWLQOOXSA-N 375.463 5.029 30 20 GKED Cc1ccc2c(C)cc(NN=Cc3c(O)c(C(=O)O)cc4ccccc34)nc2c1C 1776022249 BOODELYBXRPTNL-UHFFFAOYSA-N 399.450 5.163 30 20 GKED Cc1c(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)cccc1C(=O)O 1776086498 XTNDATIMJOEDHS-UHFFFAOYSA-N 389.238 5.706 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776697907 XYVMAYHAXNSNCH-RBJHHQRMSA-N 378.424 5.549 30 20 GKED CCc1c(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)oc2ccc(C)cc12 1776956261 OBIIPWLWUVBFSB-FNORWQNLSA-N 390.460 6.113 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(Cl)c1 1777360810 RGGLMEODXGJLGW-CLFYSBASSA-N 382.799 5.203 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)CC3CCC3)CCC2)cc1 1789454775 AJWZBSMLOPYMFR-NRFANRHFSA-N 380.532 5.079 30 20 GKED CCCCOc1ccc(/C=C2\S/C(=N\c3c(C)cccc3C)NC2=O)cc1 7165046 DTDGYIBNXRAWCU-RGEXLXHISA-N 380.513 5.374 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1ccc(C(F)(F)F)cn1 26108273 OKRGWGFUACRGOA-UHFFFAOYSA-N 384.448 5.109 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1Cl 58989311 IIIYVVVMDVRRTH-NRFANRHFSA-N 399.881 5.658 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 66178165 NOGDHTIOQHAJMP-GOSISDBHSA-N 379.504 5.027 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)cc2cccnc12 108240561 CAILAXJDDNLERN-CYBMUJFWSA-N 381.888 5.392 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2)cc1 110298667 RQVQBEPTFXHROM-UHFFFAOYSA-N 393.786 5.164 30 20 GKED C[C@@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccc(C#N)cc1 113380826 FDBMYMBXJOCYIR-OAHLLOKOSA-N 381.526 5.154 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3CCc4ccccc43)n2)cc1 115909006 XASNWQNVNIVEAO-XLIONFOSSA-N 388.492 5.115 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2C[C@H]3CCC[C@@H]3C2)cc1Cl 120440076 KUTIZTNUPIAOJP-MBOZVWFJSA-N 379.891 5.259 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(CSc3ccccn3)c2)cc1 125082576 NBFFVCMIMSZCCU-QGZVFWFLSA-N 375.497 5.277 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(F)c(Cl)cc1F 153984288 IGXDZIKBAWWSKH-UHFFFAOYSA-N 399.784 5.238 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCO[C@@H](c4ccccc4)C3)c2)c1 157261972 IXXQWALOTACEIS-AZGAKELHSA-N 398.506 5.147 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nccs1 159292953 XTXUQCRXMAUMEV-NRFANRHFSA-N 392.484 5.254 30 20 GKED N#C[C@H](C(=O)CCc1cccc(F)c1F)c1nc2cc(Cl)ccc2s1 159835961 JWYNZZCSAKVLDY-GFCCVEGCSA-N 376.815 5.037 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1c(F)cccc1F)C1CCCC1 180071650 DVVNLSQWKIMNMH-OAHLLOKOSA-N 399.441 5.232 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 185433592 YBURINNEAIGZBT-ZJUUUORDSA-N 377.259 5.004 30 20 GKED C=CCSCCNC(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 195729838 UBPZQYULVOKFMA-GFCCVEGCSA-N 391.389 5.013 30 20 GKED Cc1nsc(C)c1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 292956900 ACSRMPMCNOMNFE-UHFFFAOYSA-N 385.436 5.037 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)N(CCC#N)Cc1cccnc1 302812390 FPAMCMAXPQVCHA-OUKQBFOZSA-N 387.483 5.126 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC2(c3cccc(Br)c3)CC2)cc1 303852509 KXXPFIYAEBDWLE-UHFFFAOYSA-N 398.304 5.061 30 20 GKED CCC/C(O)=N/C[C@@H]1CCCN(C(O)=Nc2ncc(C3CCCCC3)s2)C1 329460103 PCOKQQMYPFPWGP-HNNXBMFYSA-N 392.569 5.205 30 20 GKED OC(=Nc1cc(Cl)ccc1OC[C@H]1CCCO1)N1[C@H]2CC[C@H]1c1ccccc12 329792062 UXVNAAFHTIQVEH-XPGWFJOJSA-N 398.890 5.335 30 20 GKED Cc1ccc(NC(O)=Nc2ccccc2)cc1N=C(O)N1CC[C@@H]2CCC[C@@H]21 330279912 RTFBVYBXSNCYPP-JXFKEZNVSA-N 378.476 5.073 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)Cc3csc(-c4ccoc4)n3)c2C#N)[C@H](C)C1 410983312 PQEMCYONEICRGB-NWDGAFQWSA-N 397.525 5.203 30 20 GKED C[C@@H](CC(F)F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 412276449 YUIQMRWWESTLKZ-KWQFWETISA-N 377.275 5.106 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc2nc(C3CC3)oc2c1 430471944 AAHJRRSCEUQZDB-UHFFFAOYSA-N 379.419 5.496 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1nc(C(C)(C)C)cs1 431939795 TYNSZFNQAICTNX-WBVHZDCISA-N 384.549 5.236 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccccc1 435095414 QNAASMOQSNORCU-PXNSSMCTSA-N 375.472 5.409 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cc(NC(=O)C(C)C)ccc1C)c1ccccc1 435652482 BXPDEXFBHHEQRZ-HXUWFJFHSA-N 379.504 5.419 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(F)c(F)cc2F)cc1 437157811 XULZTLIXNIHBHE-UHFFFAOYSA-N 398.340 5.029 30 20 GKED CC[C@H](C)n1c(C(F)(F)F)nc2cc(NC(=O)c3cc(C#N)oc3C)ccc21 452581732 DCKWFHGBXUZMDN-JTQLQIEISA-N 390.365 5.052 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC2CC(c3ccc(F)c(Cl)c3)C2)cc1 466878243 QROAJKPDNCUAJS-UHFFFAOYSA-N 385.870 5.348 30 20 GKED N#Cc1c(NC(=O)c2cccc3cnccc23)sc2c1-c1ccccc1CC2 466991071 CXJTWOHIVLLOKN-UHFFFAOYSA-N 381.460 5.186 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 474898244 GSUREOSQSMZGIL-QFIPXVFZSA-N 395.462 5.163 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(-c2ccccn2)c1 475574079 NOZAJCDWZLWSBL-UHFFFAOYSA-N 385.511 5.922 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)[C@@H](COC)Cc1ccccc1 475576261 VNNJHUOMSOSYHW-JOCHJYFZSA-N 394.559 5.650 30 20 GKED N#CC[C@@H](CC(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 476652943 BNJQCIXTVHAGGV-OALUTQOASA-N 386.417 5.109 30 20 GKED Cc1ccccc1[C@H](C)SCC(=O)Nc1ccccc1SC[C@@H](C)C#N 480369028 FSOKGWGTIYKKAF-RDJZCZTQSA-N 384.570 5.680 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2cccc(Oc3ccc(Cl)cc3)c2)nc(C)n1 481032902 JCRKIYFXIYCQFV-IBGZPJMESA-N 377.831 5.029 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(OC2CCCC2)c1 482549923 DULQIPVWVVSLGX-KRWDZBQOSA-N 392.480 5.116 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cccc(C(=O)N2CCc3ccccc32)c1 486464125 UOGYJLCYJFNJRI-UHFFFAOYSA-N 395.506 5.303 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc2ncsc2c1 486535243 RKCXGLUQFPMSMR-JTQLQIEISA-N 390.390 5.069 30 20 GKED Cc1nc(-c2ccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)cc2)cs1 487367225 BLPATKPOUXAYKG-FQEVSTJZSA-N 375.497 5.284 30 20 GKED N#Cc1cc(C(=O)Nc2c(Oc3ccc(Cl)cc3)ccc3ncccc23)c[nH]1 489958712 SVKMPEKSAWVPIE-UHFFFAOYSA-N 388.814 5.133 30 20 GKED Cc1cc([C@@H](C)NC(=O)c2ccccc2Sc2ccccc2C#N)c(C)s1 498040704 YPLVVSOENZAHAO-OAHLLOKOSA-N 392.549 5.879 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 499303832 YHGHYZFMSIUJSR-UHFFFAOYSA-N 393.487 5.432 30 20 GKED N#CCCn1cc(CNCCc2cc(Cl)cc(Cl)c2)c(-c2ccccc2)n1 500157423 NZHNPWHOEVEYEH-UHFFFAOYSA-N 399.325 5.103 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc2ncsc2c1 502747197 MRQMDTBZXXFJAF-UHFFFAOYSA-N 385.448 5.521 30 20 GKED CC[C@@H](C)Oc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 503631134 UENFYHDYZOZBBZ-QGZVFWFLSA-N 375.472 5.057 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1Cn1c(C)nc2ccccc21 505028838 JANARDQVMJZMKV-FQEVSTJZSA-N 388.515 5.160 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(Cl)s2)cc1 512529868 CTLYNVQNXQBHMH-UHFFFAOYSA-N 384.844 5.326 30 20 GKED N#Cc1cccc(NC(=O)[C@@H](Sc2ccc(F)cc2F)c2ccccc2)c1 518491809 FLHYHVSOHVYHNJ-FQEVSTJZSA-N 380.419 5.309 30 20 GKED CCCOc1ccc(Cl)cc1NC(=O)CCCCOc1cccc(C#N)c1 520331984 RNXOAQVCYBSPJF-UHFFFAOYSA-N 386.879 5.188 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)NCC(C)(C)CCC#N 521849902 APYRFPXSZGGEMF-UHFFFAOYSA-N 385.511 5.199 30 20 GKED C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1cccc(C#N)c1 538407012 DJENBEVKLMGWBB-GOSISDBHSA-N 396.469 5.401 30 20 GKED CSc1ccsc1C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541073506 XEFYXUWUYGSDCI-CQSZACIVSA-N 378.522 5.500 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(CC#N)cc3)s2)cc1 543502984 DCUVYSFUQDUAFD-OAHLLOKOSA-N 377.513 5.044 30 20 GKED C=CCC[C@@H](NC(=O)C[C@H]1C[C@@H](C(C)=O)C1(C)C)c1ccc(C(F)(F)F)cc1 546122965 FXHRWQMQDHUMEU-CEXWTWQISA-N 395.465 5.470 30 20 GKED CC(C)(C)n1cc(CNc2ccc(CC#N)cc2)c(-c2ccccc2Cl)n1 546963147 FHUSFMNXWQAQOE-UHFFFAOYSA-N 378.907 5.637 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCC[C@H]1c1nc2ccccc2o1 548883978 VYNJBGJPWJIFKL-FQEVSTJZSA-N 375.472 5.706 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 558304602 PNAZEPKNYIXRTE-NRFANRHFSA-N 385.511 5.137 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2N2CCCC2)c(Cl)c1 571240041 KQDKWLMRGDYOFW-UHFFFAOYSA-N 393.796 5.083 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(-c4nc5ccccc5s4)o3)[nH]c12 571599483 JOWWNPHVPNIBRS-ZDUSSCGKSA-N 398.447 5.231 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)C1CC1 576535609 VRWOXIULRSWKBV-KRWDZBQOSA-N 386.451 5.096 30 20 GKED C[C@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(O[C@@H](C)c2ccccc2)cc1 595640857 VOUZZFHVWKDYCL-OZIGNCPNSA-N 391.515 5.269 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@@H]2c2cccc(Cl)c2)c1C 603853691 HJQTWCHSOSEZNR-JOCHJYFZSA-N 395.934 5.041 30 20 GKED COc1cccc(SCC(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 603968689 IRHDCNKCJOWRSQ-UHFFFAOYSA-N 380.494 5.026 30 20 GKED CC(C)C[C@@H](NC(=O)NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608860976 TXYRAHLDVJOPCV-LJQANCHMSA-N 389.421 5.164 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1sc2cccc(Cl)c2c1Cl 609142820 LHUXKURCYKYZBR-UHFFFAOYSA-N 390.295 5.159 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3cccc4cccnc34)c2)cc1 609209508 AEXSBOBGFZOCAN-UHFFFAOYSA-N 394.434 5.220 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)[C@@H](C)C1CC1 609422053 FRYYJZBEPNFTTQ-KRWDZBQOSA-N 377.488 5.178 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609647651 XGBXKYAJWRNUPN-CVDCTZTESA-N 396.490 5.563 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 610358010 XGSQFIGIYRXXNC-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccn3Cc3ccccc3)n2)cc1 613318048 KEJOIUJARKKLTE-FQEVSTJZSA-N 397.503 5.458 30 20 GKED FC(F)(F)c1ccccc1CN1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618448789 BQVGNEDTZYBRKO-PHIMTYICSA-N 379.266 5.268 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H](C#N)CC(C)C 619530203 KPNJVCKPXAOVCT-GFCCVEGCSA-N 394.302 5.269 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(COc2cccc(F)c2)c1 642511322 OPKIOLLSAUGVGV-UHFFFAOYSA-N 396.487 5.686 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCOCC2)[C@@H]1c1ccco1 666866234 JWKWAPWEDQJCNO-QFIPXVFZSA-N 394.515 5.517 30 20 GKED C=CCSc1ccccc1C(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 681594221 WQRURFAZPXTVNJ-VXGBXAGGSA-N 397.384 5.168 30 20 GKED CN(C(=O)c1occc1COc1cccc(C#N)c1)c1ccc(C(C)(C)C)cc1 726502518 GJQVKRAEFNTKKD-UHFFFAOYSA-N 388.467 5.304 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@@H](C#N)C(=O)Nc2ccc([C@H](C)CC)cc2)cc1 727954729 SZGKGKQWQDCYQV-HYFFOGBASA-N 376.500 5.214 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1cccc(OCC#N)c1 730150658 WIYUUKSLXGJDMV-YHYXMXQVSA-N 378.428 5.056 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F 730177876 WCKVHIPKGRXCAI-UHFFFAOYSA-N 380.806 5.279 30 20 GKED CC(C)c1ocnc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 731901837 FQRBWEOCGBECII-QGZVFWFLSA-N 379.847 5.359 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 732596144 LGQHKGSDYDIYNL-WIYYLYMNSA-N 398.462 5.005 30 20 GKED O=C(/C=C/c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cncc(F)c1 737444615 RTXGWTVZIMIXGR-FNORWQNLSA-N 398.777 5.471 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)cc1 741073186 WNRGYZLETLIVPX-UHFFFAOYSA-N 399.825 5.188 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1sc2cc(F)ccc2c1Cl 741636607 QAQMKTGRTOVBFW-UHFFFAOYSA-N 377.799 5.097 30 20 GKED Cc1ncsc1/C=C\C(=O)c1ccc(-c2ccccc2Br)s1 742432156 UCUOEDTWHCYDFQ-SREVYHEPSA-N 390.327 5.839 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)c1 744017224 ZUUTVPURPFGQBM-HXUWFJFHSA-N 386.451 5.027 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc(F)cc2F)cc1 751602398 KZBVPPRWCVBPGH-OAQYLSRUSA-N 376.406 5.192 30 20 GKED N#CCCCOc1cccc(CN[C@H]2CCOc3c2ccc(Cl)c3Cl)c1 752978439 DRPRRBPJZDXBPZ-SFHVURJKSA-N 391.298 5.289 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2scnc2C2CCCC2)cc1 758946456 SFTJLFSXRIAOCT-FQEVSTJZSA-N 387.508 5.708 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccccc2SCc2ccccc2)c1 760367676 DMKKJIXEOFEIMP-UHFFFAOYSA-N 388.492 5.062 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2cc(OC)c(OC)cc2F)cc1 766000640 FOFQDWSVFLXAHR-GJZGRUSLSA-N 393.886 5.386 30 20 GKED CCc1cnccc1C(=O)/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1 766772751 YTDPMRMFFMVHNR-ZHACJKMWSA-N 390.870 5.446 30 20 GKED COc1cccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1F 770065667 IXSVCUBJHFAIRX-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CC(C)CN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCCc2cccnc21 774238738 UYHVOYVOWKXWNC-IBGZPJMESA-N 398.963 5.339 30 20 GKED CC(C)[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776171599 UKXFCYLBWKGNTM-FOIQADDNSA-N 376.422 5.656 30 20 GKED N#CC1(COC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)CCCC1 780534280 IPOWLEXAVROCNA-UHFFFAOYSA-N 380.391 5.070 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccccc1F)C1CCCC1 780674542 OZLZDHOTTVCLTC-VFNWGFHPSA-N 381.451 5.170 30 20 GKED Cc1ccc([C@H](Nc2ccc(N3CCC(O)CC3)c(C#N)c2)C2CCCC2)cc1 783275839 MIFGNDYIUDGREA-RUZDIDTESA-N 389.543 5.171 30 20 GKED CCN(C(=O)c1ccc(C)c(C#N)c1)[C@@H](c1ccc(Cl)cc1)c1ccccn1 799337094 BPOOXCUWZCMPST-QFIPXVFZSA-N 389.886 5.167 30 20 GKED C=C(C)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 804860881 RHYARKFCCZXHAO-LFIBNONCSA-N 394.452 5.255 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1n[nH]c(C2CC2)c1C 806230850 YQNAQFVHFVXHFA-UHFFFAOYSA-N 387.443 5.212 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 806259073 LTOUQLHFOLGMER-UHFFFAOYSA-N 382.332 5.008 30 20 GKED Cc1ccccc1C1(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)CCCC1 810537328 RZKBOGKLHSASDO-MRXNPFEDSA-N 393.437 5.428 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1 842945434 QRXSYOTVCZPDRO-QGZVFWFLSA-N 380.513 5.195 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc3oc(C(F)(F)F)nc3c2)c1 864007514 JEXRYWJVZXDARB-UHFFFAOYSA-N 396.166 5.093 30 20 GKED CNC(=O)c1ccc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)cc1 912859218 HGSPEUGRKXURCJ-XDJHFCHBSA-N 398.487 5.079 30 20 GKED CCOc1ccc(/C=N/C2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(O)c1 914702555 ITMPWVLSRQPBCU-TZPQHZNJSA-N 383.332 5.119 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=Cc1ccccc1F 916272649 GFYVFMPYAGWUKM-UHFFFAOYSA-N 397.862 5.108 30 20 GKED C=CCN(C(=O)c1ccc(COc2ccccc2Br)cc1)C(C)C 916383204 NAFCOYBZNBREKL-UHFFFAOYSA-N 388.305 5.065 30 20 GKED CCCc1sc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc1CC 916936599 QFDOOCLVXZEFKE-CYBMUJFWSA-N 392.883 5.017 30 20 GKED CC(=NNc1nc(-c2ccccc2)cs1)c1sc2ccccc2c1C(=O)O 1776022588 XKHAGTGMRLUOLW-UHFFFAOYSA-N 393.493 5.559 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3nccc4sccc34)s2)cc1 1776036216 NXMTVHWLSBCCRZ-UHFFFAOYSA-N 379.466 5.169 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccc4ccccc4c3)s2)cc1 1776130956 CGNOIGHFPWHTHB-QBFSEMIESA-N 384.456 6.163 30 20 GKED C=CCOc1ccc(/C=C\c2cc(C(=O)O)c3cnn(C(C)C)c3n2)cc1Cl 1776183977 YBMRUZQXAVPWRE-ALCCZGGFSA-N 397.862 5.099 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)CO2 1776374616 HGZTXKMNBSUJPB-DEDYPNTBSA-N 398.458 5.834 30 20 GKED C[C@H]1/C(=C/c2c[nH]c3ccc(C(=O)O)cc23)C(=O)c2cccc(Br)c21 1776586502 AADCPPDTSGIUHZ-WULZRQGASA-N 396.240 5.012 30 20 GKED CCCCCCCOc1cccc(/C=C\C(=O)c2ccc(C(=O)O)cc2O)c1 1776788952 DNJUHFPEZAFEBR-RAXLEYEMSA-N 382.456 5.336 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCOc4ccc(F)cc4C3=O)s2)cc1 1777670973 LONFGJKLXLRRGG-RVDMUPIBSA-N 394.423 5.301 30 20 GKED Cc1cc(C)c(N/C(S)=C(/C(=O)c2ccccc2)[n+]2ccccc2)c(Cl)c1 15248326 MLISSTDXTAHNSL-UHFFFAOYSA-O 395.935 5.295 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1cccc(OC(F)F)c1 25198606 OANJFQVNWHHNIM-VAWYXSNFSA-N 381.378 5.158 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(C#Cc2ccccn2)c1 42622080 RBEDAZUNQPFVHR-UHFFFAOYSA-N 399.453 5.272 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 56712907 RNOCJUGRYRBBOG-QGZVFWFLSA-N 396.450 5.413 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N(C)Cc3cccc(C#N)c3)cn2)cc1C 57711002 FFCKOJJUCXWTQG-UHFFFAOYSA-N 386.455 5.026 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)s1 60722084 ZNRFXWADHIERBD-IBGZPJMESA-N 380.900 5.926 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2oc3c(C)cccc3c2C)cc1 65870232 VIPBXJKDEMXFGT-UHFFFAOYSA-N 388.467 5.116 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66800436 IDRMURPTLIMHIV-KRWDZBQOSA-N 381.545 5.175 30 20 GKED Cc1cncc(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 122013750 IEUNKXHMCANSEK-OIYOBHNRSA-N 379.872 5.057 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccccn1 124872780 APTRTWUATGVASO-OAHLLOKOSA-N 389.484 5.034 30 20 GKED CN(CCC#N)C(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 126327861 YDEDGGHOPMEFJX-UHFFFAOYSA-N 398.825 5.197 30 20 GKED CCSc1ccccc1OCC(=O)Nc1ccccc1S[C@H](C)CC#N 133847388 FLDPSPDQJMYDHX-OAHLLOKOSA-N 386.542 5.210 30 20 GKED COc1ccc(CCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(OC)c1 153801356 MJAMTIIMKQLNQT-MRXNPFEDSA-N 398.528 5.059 30 20 GKED COc1ccc(CN[C@@H](c2cccc(F)c2)C(C)(C)C)cc1OCCCC#N 178614618 RSXNZNBXVNGOMN-QFIPXVFZSA-N 384.495 5.394 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H](C)c1ccc(OCC#N)cc1 180538270 LDNMNPYNSYMLFR-CVEARBPZSA-N 377.513 5.433 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(OCC#N)cc1 180549529 NMUCIZNFSWFTGY-AWEZNQCLSA-N 381.476 5.011 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@](O)(c1ccc(C)o1)C(F)(F)F 188062648 IWFWBAVVEDKIDV-FQEVSTJZSA-N 395.421 5.219 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1nc(C(F)(F)F)cs1 191477158 AIPJPTKUQDMSQI-UHFFFAOYSA-N 397.466 5.678 30 20 GKED CCO[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 194485214 CRSVEYBYWFRYBV-FXAWDEMLSA-N 396.899 5.418 30 20 GKED FC(F)(F)c1cnc(N2CCC(C(F)(F)F)(C(F)(F)F)C2)c(Cl)c1 301269559 GOAFOZYONPIGLZ-UHFFFAOYSA-N 386.645 5.075 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/[C@H](C)c1oc2ccccc2c1C 328982517 FFAUESQYOLTEDI-HIFRSBDPSA-N 384.501 5.466 30 20 GKED OC(=Nc1ccc2nc(C3CC3)sc2c1)C1CCC(/N=C(/O)C2CC2)CC1 330009598 GIHRXRDYPRORPO-UHFFFAOYSA-N 383.517 5.687 30 20 GKED Cc1ccc(Sc2ccc(NC(=O)N3CCC(C)(C#N)CC3)cc2)cc1C 332511488 DWKBENJRKNZENS-UHFFFAOYSA-N 379.529 5.612 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3c[nH]c4cc(F)ccc34)CC2)c(Cl)c1 426151398 CWNWSISEYMMVCM-UHFFFAOYSA-N 396.853 5.244 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(OC2CCCC2)c(F)c1)c1ccccc1 432962178 VSSQVCODSLYQIV-NRFANRHFSA-N 395.478 5.704 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)NC1CCC(F)(F)CC1 433216358 WXTOJGBQOIUOKI-UHFFFAOYSA-N 388.283 5.006 30 20 GKED Cc1cc(C)cc(C[C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 438078182 WRSFPLDBDKKPSD-ZWKOTPCHSA-N 381.545 5.308 30 20 GKED CC(C)(C)Oc1ccccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 438484594 RLBDOURDEFRBBJ-AZUAARDMSA-N 377.488 5.168 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)Nc1ccccc1CC(F)(F)F 438617947 CDHSHCFXVWEKBT-UHFFFAOYSA-N 394.290 5.271 30 20 GKED N#CCC[C@@H](NC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccccc1 439670055 GOPBADVTMDEBJI-LJQANCHMSA-N 395.915 5.167 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2cc(Cl)c(Cl)cc2F)cc1 439956802 JMBIRMZKIBPSRS-UHFFFAOYSA-N 397.237 5.084 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3nc(/C=C/c4ccccc4)cs3)on2)c1 447511786 VNWXVXDKEMPQPD-MDZDMXLPSA-N 398.447 5.092 30 20 GKED CCSCc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)cc1 449603435 QTHUJPSASFJGSO-UHFFFAOYSA-N 376.529 5.329 30 20 GKED CC(C)(NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCC1 454528557 PDUJSZAEEDBDFZ-UHFFFAOYSA-N 377.488 5.032 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccccc1NCc1ccc(Cl)cc1 462852292 KZZOJYWFPWCNSX-UHFFFAOYSA-N 375.859 5.385 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)oc2c(Cl)cccc12 464464641 FFFYDMRQOFANNX-LBPRGKRZSA-N 378.737 5.299 30 20 GKED COc1ccccc1-c1nc(CN2CCC[C@@H]2[C@H](C#N)c2ccccc2)cs1 464824155 ULQMFWDUXCDXGJ-NHCUHLMSSA-N 389.524 5.090 30 20 GKED CN(Cc1cc(Cl)cn1C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 467112256 YGNOAIJERXCITO-UHFFFAOYSA-N 394.862 5.006 30 20 GKED Cc1ccc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 468647753 LIKDXXZWDGNTKE-QGZVFWFLSA-N 384.570 5.570 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)cc1Cl 473685821 KCPGFNAPAVJEKI-LJQANCHMSA-N 397.265 5.171 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc3cccc(Br)c3n2)cc1 476277406 WIYJHBIHPRUTET-UHFFFAOYSA-N 394.272 5.051 30 20 GKED C=C(C)[C@H](NCc1ccc(C#N)cc1Br)c1ccc(F)c(F)c1 481591019 FEOWPAQEBOBMGT-SFHVURJKSA-N 377.232 5.006 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 481996139 AONGCUHZZRVHPD-LJQANCHMSA-N 389.377 5.043 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1ncc(-c2ccccc2)o1)c1ccccc1 487511463 FBMXWTVTUJDKPC-NRFANRHFSA-N 387.483 5.216 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1csc(Br)c1 488737090 RRBZRBRUPLFZHS-UHFFFAOYSA-N 379.226 5.088 30 20 GKED CSc1ccc(C(=O)[C@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)o1 491980624 RFOQWBBHRPSNIO-BPQCLDNESA-N 398.553 5.416 30 20 GKED N#CC1(CCCN2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)CCOCC1 499634710 WFKNERMTABQCEO-LJQANCHMSA-N 380.454 5.333 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@H](C#N)c3ccccc3Cl)s2)c(C)c1 499947995 VADRSPGGQGLIDJ-GOSISDBHSA-N 395.915 5.383 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Cc1cc(Cl)ccc1Cl 500297442 AWDYYCQHUSMKRQ-UHFFFAOYSA-N 375.299 5.092 30 20 GKED N#CC1(CCCS[C@@H](c2ccccc2)c2ccc(F)c(F)c2)CCOCC1 507704449 SKLJUUPVSMKIKA-NRFANRHFSA-N 387.495 5.888 30 20 GKED Cc1cccc(-c2nn(Cc3ccccc3)cc2CN2CCC(C)(C#N)CC2)c1 507707680 KURJJEIZOJYJSX-UHFFFAOYSA-N 384.527 5.033 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc(C)c(C)cc2Cl)cc1 510212611 VDVMBJDTLITGPI-UHFFFAOYSA-N 382.891 5.023 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)cc1 510769819 XJYZKPNRKSNZLB-QHCPKHFHSA-N 383.495 6.010 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2cccc(OCCCC#N)c2)ccc1C(C)C 515616486 JMXZPMCDNFNNCG-GOSISDBHSA-N 380.488 5.207 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 515796627 YAHJGSVXRFPIAC-UHFFFAOYSA-N 399.494 5.304 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 517461237 GCAPGZLULLFRCF-SFHVURJKSA-N 382.529 5.435 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCC[C@H](c2ccccc2)CC1 522071735 BLRLKMWIDWAWIF-QHCPKHFHSA-N 395.506 5.283 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@H](c1ccc(Cl)cc1)c1ccsc1 522408562 GIDBMOFHNKXEQP-MRXNPFEDSA-N 393.821 5.888 30 20 GKED C=CCCC(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 522598499 GWVUSRMCAMCPAO-UHFFFAOYSA-N 379.891 5.117 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCCCC[C@H]2c2cccc(C)c2)cc1 522790514 AYVPMOLIVOMGHG-QFIPXVFZSA-N 391.515 5.060 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1OC(F)F)[C@H](C)c1cc2ccccc2o1 524435871 RTXVBZPRQJMPSL-CYBMUJFWSA-N 399.397 5.521 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2ccc(O)cc2)cs1 525333937 LAKHKNDGPZCEEW-UHFFFAOYSA-N 397.459 5.307 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@@H]1COc2ccccc21 532849682 RDZIHFCIFMUSBS-KKSFZXQISA-N 399.450 5.037 30 20 GKED C=C[C@H](CC(=O)N[C@@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1ccccc1 536182964 SSRGEYLKRYUHDF-CJAUYULYSA-N 381.479 5.128 30 20 GKED Cc1cc(C)cc(C2=CCN(C(=O)CCCCOc3cccc(C#N)c3)CC2)c1 539903317 CAJNCKMCDVDDEQ-UHFFFAOYSA-N 388.511 5.040 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542968364 XDKNWYRVEMQTEJ-JKSUJKDBSA-N 387.483 5.201 30 20 GKED C[C@H](NCc1cnc(-c2ccccc2)[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543873676 ARCXXZQVJPHHQY-SFHVURJKSA-N 378.479 5.466 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCN[C@H](C)c1ccc(C#N)cc1 549165771 KUVIUPYXGJCXRT-MRXNPFEDSA-N 397.950 5.406 30 20 GKED COc1ccc(CN2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)cc1OCCCC#N 549805386 GHRYGONHFMMURJ-NUNAXRQHSA-N 390.527 5.288 30 20 GKED N#CCC[C@H](Nc1cncc(N[C@H](CCC#N)c2ccccc2)n1)c1ccccc1 553161222 FDDSSKDSFJMYNZ-SZPZYZBQSA-N 396.498 5.391 30 20 GKED COc1ccc([C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)c(C)c1OC 554402841 BLSAKQKLTGAZTN-ZGIGLSJSSA-N 378.516 5.067 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)c2cc(C#N)ccc2Cl)c1 560579749 RMCVSAVUXHWSED-UHFFFAOYSA-N 378.863 5.128 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)c2ccccc21 561938606 SKMMOJRBFWXZAC-UHFFFAOYSA-N 397.360 5.076 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1Cl 574835532 YFIOGUOWLIAPKR-XXBNENTESA-N 389.886 5.408 30 20 GKED FC(F)(F)c1cccc(C2(NCC#Cc3ccccc3Cl)CCOCC2)c1 579699779 CDTKILZNISVIJK-UHFFFAOYSA-N 393.836 5.006 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c2ccccc12 592975559 IYUZFYZAOGNWJK-MRXNPFEDSA-N 376.412 5.087 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC1CCC2(CC1)CC2(F)F 598317517 JIXCAYTWBGVBAO-UHFFFAOYSA-N 398.478 5.407 30 20 GKED C=CCCCN(C)C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 605645107 FZTAGYZLKJPDGV-UHFFFAOYSA-N 396.560 5.396 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc2cccc(F)c2o1 607789458 OYSSBYNSYZAYCX-URLYPYJESA-N 397.290 5.211 30 20 GKED CC(C)(Oc1cccc(Cl)c1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 609575820 FZMLVBUMNFCSSX-UHFFFAOYSA-N 397.887 5.131 30 20 GKED C[C@@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1cccc(C#N)c1 610830096 CYHFHUFHXCOANX-VXGBXAGGSA-N 382.357 5.173 30 20 GKED O=[N+]([O-])c1cc(F)c(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 610988144 IYSXFXUJBSJYHE-RNFRBKRXSA-N 392.246 5.194 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(-c2csc(C)n2)cc1 615487485 XKMQUTWRUCXFQU-UHFFFAOYSA-N 381.476 5.478 30 20 GKED C=CCN(C(=O)c1cccc(Cl)c1Cl)c1nc(-c2ccccc2)cs1 641902246 OIJXBEHQJMHDTB-UHFFFAOYSA-N 389.307 5.950 30 20 GKED CC[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccn(C)n1 647323511 SOKPRDRPPDCWRE-LBPRGKRZSA-N 383.311 5.273 30 20 GKED Fc1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(F)c1F 657300907 WHOTWXLGJUARBK-IUCAKERBSA-N 379.266 5.103 30 20 GKED C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 728411934 PSLQAHNQPDJGGQ-YLJYHZDGSA-N 396.446 5.062 30 20 GKED CC(=O)c1ccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 729160503 UBDPNROFJBPTPE-UHFFFAOYSA-N 387.464 5.362 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2C[C@H]2c2cccc(OC)c2)c1 730180801 KTKUAQGQAXTGPH-GOTSBHOMSA-N 387.504 5.075 30 20 GKED C#CCOc1cccc(NC(=O)c2ccc(CSc3nc(C)cs3)cc2)c1 731013010 OQLORKZFQIQXBW-UHFFFAOYSA-N 394.521 5.008 30 20 GKED CCCCCCc1ccc(-c2csc(NC(=O)C3(C#N)CCOCC3)n2)cc1 731487268 IORMPEGGONHLIU-UHFFFAOYSA-N 397.544 5.192 30 20 GKED C=CC[C@H](NC(=O)NCC(C)(C)c1c(Cl)cccc1Cl)c1ccncc1 734667581 INRAMNYSOLLCKW-KRWDZBQOSA-N 392.330 5.283 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccc(SC(F)F)cc1 734981752 STNSMVHCFOAHDJ-KMKOMSMNSA-N 397.446 5.871 30 20 GKED CCN(CC)c1ccc(/C=C2\SC(=Nc3c(C)cccc3C)NC2=O)cc1F 739426477 MNMZQCSEILOCAM-UYRXBGFRSA-N 397.519 5.180 30 20 GKED Cc1ccc(CC[C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)o1 743096271 PQILZUYBJCHEMT-SBUREZEXSA-N 387.483 5.386 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc4nc(S)oc4c3)cc2)cc1 746170252 KIJPHFONGSNAPY-UHFFFAOYSA-N 387.420 5.033 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1sc(-c2cccnc2)nc1C 747609884 CHXGFIXMSPHXDL-UHFFFAOYSA-N 377.300 5.656 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccn3)s2)COc2c(Cl)ccc(Cl)c21 753145173 WMNKWORCMQCPPC-JXMROGBWSA-N 389.263 5.171 30 20 GKED C[C@@H](ON=C(N)c1cccs1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753821679 KAXQLQITYKTVTQ-SECBINFHSA-N 382.272 5.108 30 20 GKED N#CCOc1ccc(COC(=O)CCCc2cc(Cl)sc2Cl)cc1 756513002 WTBNQMGJJGXBAA-UHFFFAOYSA-N 384.284 5.023 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(F)c1F 766337121 RDLWCCRMSUTDDS-MGPUTAFESA-N 391.421 5.503 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cn(C)c2ccccc12 772161768 MECQMJSYKKYOMX-FDDCHVKYSA-N 393.490 5.576 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(F)cc2)C2CCCC2)ccc1OC 774450632 VDUKYOPXJSJEGT-URXFXBBRSA-N 396.506 5.536 30 20 GKED CC1(C)CC[C@@H]2C[C@H](NC(=O)Nc3cccc(OCC#N)c3)c3cccc1c32 776467593 PKFYKXZVAYZXBT-QRWLVFNGSA-N 375.472 5.010 30 20 GKED C=CCC[C@@H](C(=O)OCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 777640604 PUWONCDCQDKZCB-GOSISDBHSA-N 382.847 5.183 30 20 GKED CC(=O)N1C/C(=C/c2ccc(Sc3ccccc3)cc2)C(=O)c2ccccc2C1 778520194 PQTJNLMTEBZNOU-QNGOZBTKSA-N 399.515 5.466 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CNc1cccc(OCC#N)c1 779588164 HZOCYKDVNSJRGZ-UHFFFAOYSA-N 394.478 5.362 30 20 GKED C[C@@H](Nc1nccc2c1C(=O)OC2(C)C)c1ccc(-c2cccc(C#N)c2)cc1 782379793 ZPQLRDYVBLCHBD-OAHLLOKOSA-N 383.451 5.199 30 20 GKED C=CCn1c(SCOCC(F)(F)F)nnc1-c1ccc(C(C)(C)C)cc1 788100046 SEBMVPYTEZFDJD-UHFFFAOYSA-N 385.455 5.057 30 20 GKED C#CCC1(C(=O)Nc2ccc(OC)c(NC(=O)C3CCCCC3)c2)CCCCC1 788447816 FUPGVOPIMHMVHX-UHFFFAOYSA-N 396.531 5.126 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1nccc2ccccc12 792095136 JRTAKYUPAVCOAS-DHLKQENFSA-N 394.499 5.945 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 795114680 QXDFZQLIQIAESK-UHFFFAOYSA-N 398.963 5.709 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571262 PBABWQKSCMOHMO-JQWIXIFHSA-N 397.327 5.391 30 20 GKED C[C@@H](Oc1ccc(C(=O)OCCCC2(C#N)CCOCC2)cc1)c1ccccc1 800213789 ZTYXUICWBKWZGU-LJQANCHMSA-N 393.483 5.084 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccc(Cl)cc1F 806344720 KVIIVVWHSJWAPB-MRXNPFEDSA-N 398.787 5.470 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)c2c1N(C(=O)CCCCCC#N)CCC2 808723468 OJCFOQLYBGZSRH-UHFFFAOYSA-N 385.508 5.095 30 20 GKED N#C[C@@H](C(=O)COc1ccc(-c2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 813214272 QEIXVVCAJGWEMW-LJQANCHMSA-N 396.368 5.023 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3c(c2)CCCC3=O)cc1 815011064 YXAIFHLDNWTKII-QHCPKHFHSA-N 380.447 5.113 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@@](C#N)(c2ccccn2)C1 852332825 WAABGEHPCGDZQA-ZHRRBRCNSA-N 392.890 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCOc2ccc(F)cc2)cc1 915085189 IGCBPKIWVDOPFH-QHCPKHFHSA-N 388.442 5.279 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)COc2ccccc2C(C)C)cc1 916948463 VSWWJAUSVXONGH-UTKZUKDTSA-N 392.499 5.050 30 20 GKED CSc1ccc(Oc2ccc(F)cc2C=NNc2ccccc2C(=O)O)cc1 1776031769 WHJCWUQJDLWCIN-UHFFFAOYSA-N 396.443 5.484 30 20 GKED O=C(O)c1ccc2scc(C=NNc3ccc(Cl)c(C(F)(F)F)c3)c2c1 1776090828 CACPSUXRQSVXRF-UHFFFAOYSA-N 398.793 5.718 30 20 GKED CC(=Nn1c2ccccc2c2ccccc21)c1oc2cc(C)ccc2c1CC(=O)O 1776113152 ZLSYAHLGBQVZFM-UHFFFAOYSA-N 396.446 5.749 30 20 GKED O=C(/C=C\c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccc(F)cc1F 1776125482 JUTFNQRUIFXBDY-REBWPMHBSA-N 394.373 5.066 30 20 GKED CC(C)(C#N)c1ncc(CNCCCCCCCCCCCC(=O)O)s1 1776231104 VUUPFBVFCNERHV-UHFFFAOYSA-N 379.570 5.019 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Oc2cccc(F)c2)cc1 1776784718 MJNHQBRYMZGNEP-FQEVSTJZSA-N 387.495 5.911 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cn(-c2ccccc2)nc1C(C)(C)C 1776786921 AZHJBLLVLZZDRE-HXUWFJFHSA-N 399.579 5.463 30 20 GKED C=CCn1c(SCc2csc(-c3ccsc3)n2)nnc1-c1ccccc1 7735077 RNYCZZKFRSTRDG-UHFFFAOYSA-N 396.566 5.608 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(Br)cc2)s1)c1ccccn1 49458415 WPHKBULMFYYABC-AWEZNQCLSA-N 383.270 5.063 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3ncsc3c2)cc1 55823635 DXUFFLZHCCZORR-UHFFFAOYSA-N 399.475 5.194 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1csc(-c2ccc(Cl)s2)n1 62905454 WTBJKYCBPPNGQG-UHFFFAOYSA-N 399.928 5.225 30 20 GKED C[C@H](SCc1cccc(C#N)c1)c1nc2scc(-c3ccco3)c2c(=O)[nH]1 105623706 IFZVEHSZFVWYST-LBPRGKRZSA-N 393.493 5.111 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108529526 GIXAMEJFCANJLH-JKSUJKDBSA-N 383.517 5.220 30 20 GKED Cc1ccc(NC2=NC(=O)/C(=C/c3cccc(OCCCC#N)c3)S2)c(C)c1 110418820 ZPQDTJRIQCTPMB-ZHZULCJRSA-N 391.496 5.068 30 20 GKED N#Cc1c(NC(=O)c2ccccc2C(F)(F)F)sc2c1-c1ccccc1CC2 122606449 BQPGOQHIMQBQEO-UHFFFAOYSA-N 398.409 5.656 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@@H]3CCO[C@@H](c4ccccc4)C3)c2)cc1 133215163 CMDQMORWQYDTIS-ZJSXRUAMSA-N 398.462 5.001 30 20 GKED COc1ccc2cccc(CC(=O)Nc3ccccc3SC[C@@H](C)C#N)c2c1 153660783 RVMWIZLVHAYTEO-INIZCTEOSA-N 390.508 5.281 30 20 GKED N#Cc1cc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)ccc1F 158332215 ZWXLUUMQAHERQJ-UHFFFAOYSA-N 389.459 5.064 30 20 GKED Cc1ncc(CN(C)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 172230927 AFDMCXDMDIIPSO-UHFFFAOYSA-N 397.887 5.041 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(OCC#N)cc1)c1ccccc1Cl 172920541 MJJHXCUCYWNHIP-QHCPKHFHSA-N 392.886 5.130 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2)cs1 173265707 YNCWBHRIIQBEBI-AWEZNQCLSA-N 393.537 5.765 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 176211394 YTIFPQKRCJQERG-AWEZNQCLSA-N 393.468 5.075 30 20 GKED N#Cc1ccc(CNCc2nc(-c3cc(Cl)ccc3Cl)cs2)c(F)c1 179303343 JGBAHDRPEYKWCO-UHFFFAOYSA-N 392.286 5.417 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(CSc4ccccn4)c3)cc2)CC1 180065412 BFFOWQKQZGQMET-UHFFFAOYSA-N 385.492 5.181 30 20 GKED CCC(C)(C)N/C(S)=C(/C(=O)c1ccc(C(C)(C)C)cc1)[n+]1ccc(C)cc1 186969122 HTUFTFRBDGIJLQ-UHFFFAOYSA-O 397.608 5.297 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cccc(Cl)c1 303417459 XAMWWVSUXAMJLD-PBHICJAKSA-N 387.936 5.865 30 20 GKED CC1(C)C(O)=Nc2cc(C(O)=Nc3ccccc3N3CCCCCC3)ccc21 328725646 ZFJCBKXISXKWSH-UHFFFAOYSA-N 377.488 5.583 30 20 GKED O=C1CCOc2c(N=C(O)C34C[C@@H]5C[C@H](C3)CC(C(F)(F)F)(C5)C4)cccc21 329480669 DBFXSIWBKZQWJZ-BRRVFRNMSA-N 393.405 5.389 30 20 GKED CC(C)Oc1ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c(Cl)c1 330083128 KORLAQADPMSGBK-UHFFFAOYSA-N 378.900 5.641 30 20 GKED Cc1ccc(N=C(O)c2sc([C@H]3CCCOC3)nc2C)cc1C(F)(F)F 330323987 TYHKEIUCYXGDGM-LBPRGKRZSA-N 384.423 5.309 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1csc(-c2ccccc2Cl)n1 410353835 NBGVCNVKDIRGRM-UHFFFAOYSA-N 382.916 5.763 30 20 GKED CC(C)[C@H]1CCc2c(sc(NC(=O)c3ncccc3C(F)(F)F)c2C#N)C1 411008947 VFLCEWGUQCACSG-NSHDSACASA-N 393.434 5.047 30 20 GKED Cc1ccc(SC[C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431463345 HAQWIRODRPZCIJ-GHTZIAJQSA-N 381.545 5.210 30 20 GKED N#CCCC[C@H](NCc1nc(-c2ccccc2Cl)cs1)c1ccccc1 433030305 VUPJADQMJNOSIU-IBGZPJMESA-N 381.932 5.988 30 20 GKED C[C@@H](Nc1ccc(NC(=O)[C@@H](C#N)CCc2ccccc2)cc1)c1ccccc1 433357397 XIXDZMWZXOVNKA-DENIHFKCSA-N 383.495 5.571 30 20 GKED CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)Nc1ccc(C(C)(C)C#N)cc1 437906722 HTDBSGCEXBUUJL-QFIPXVFZSA-N 377.532 5.671 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)CC[C@H]1c1ccccc1 438067850 QOQVVRYQANQRIT-NBGIEHNGSA-N 395.506 5.139 30 20 GKED CO[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)[C@H](C)C1 440911575 ATMJVVWVEQFDRA-RDTXWAMCSA-N 399.878 5.035 30 20 GKED CC1(C#N)CCC(Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)CC1 449253148 UOJVMQVFFCZTPM-UHFFFAOYSA-N 385.870 5.616 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F)c1ccccc1 458803411 REYZXIGUTKSDQX-VXKWHMMOSA-N 397.469 5.637 30 20 GKED COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458835755 KHWOYHJYFJRIGS-LEWJYISDSA-N 399.922 5.104 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc(-c3ncsc3Cl)no2)cc1 463181085 OIXMIKOLOVFNNM-UHFFFAOYSA-N 398.806 5.317 30 20 GKED Cc1ccc(C)c(NC(=O)CNc2ccc(Oc3ccccc3C#N)c(F)c2)c1 463233771 DXAPWBNWBROGAO-UHFFFAOYSA-N 389.430 5.157 30 20 GKED N#Cc1ccc(CN(C(=O)c2cc(-c3ccc(Cl)cc3)c[nH]2)C2CC2)cc1 469021394 QEDCBGOCNDQZOU-UHFFFAOYSA-N 375.859 5.012 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469157151 YKIISRQTBTVOCG-CYBMUJFWSA-N 399.372 5.065 30 20 GKED N#Cc1ccc(Cl)cc1OCc1nnc(-c2c(Cl)cccc2Cl)o1 474362801 KXLVPKPJZCQCIK-UHFFFAOYSA-N 380.618 5.147 30 20 GKED COc1cccc(-c2ccc(CNC(=O)C[C@@H](CC#N)c3ccccc3)cc2)c1 476136184 FJLVYFMCMWBBIU-HSZRJFAPSA-N 384.479 5.066 30 20 GKED CC(C)(C)OC(=O)CCc1cccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1 477164085 NGCADROXBDYSEK-UHFFFAOYSA-N 392.499 5.014 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cncc(Cl)c3Cl)c2)cc1 480832210 SFNVKVIPURGWSS-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CCSc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 480939349 IUIOZAMWDLOCIC-GOSISDBHSA-N 394.521 5.421 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@@H]1CCC(F)(F)C1 481069773 KTLNJNZVOPRLQT-PWSUYJOCSA-N 389.286 5.251 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccccc2)c(Br)c1 481284874 MCNOTOHCENNLQZ-INIZCTEOSA-N 383.211 5.104 30 20 GKED Cc1[nH]c2ccccc2c1CCNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 486280223 JZAGQDRVPWFHML-UHFFFAOYSA-N 395.462 5.113 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SC[C@H](OC(C)C)c1ccccc1 488221005 LVPCYEUCAOSLCS-NRFANRHFSA-N 393.556 5.313 30 20 GKED Cc1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc(C)c1F 488247696 HQJOZKJHPSTWNU-UHFFFAOYSA-N 388.442 5.340 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)c3cc(C#N)ccn3)c2)cc1 500975783 LLOXMMREYKJFIM-GOSISDBHSA-N 399.494 5.241 30 20 GKED N#Cc1ccc(OCc2ccc(-c3nc(-c4ccccc4Cl)no3)o2)cc1 505023974 KQEDGBVFZPUOMS-UHFFFAOYSA-N 377.787 5.101 30 20 GKED N#Cc1ccc(CN(C(=O)Cc2cc3c(ccc4ccccc43)o2)C2CC2)cc1 509885527 YUWOZMQNNWGTES-UHFFFAOYSA-N 380.447 5.191 30 20 GKED C[C@@H]1CCCC[C@@H]1N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511373535 PNJHOOVOBKFNAP-JPYJTQIMSA-N 391.515 5.374 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3ccc(F)cc3)CCCCC2)c1 516751111 HOYHFBWSNJDNGH-UHFFFAOYSA-N 380.463 5.349 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1OC 520923163 BQCAADBGOFBDFM-INIZCTEOSA-N 398.528 5.521 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520940129 FSZYNWZHEJDWRK-MRXNPFEDSA-N 389.430 5.715 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 521328736 FWJGGAOMUMVGFV-OAHLLOKOSA-N 389.524 5.693 30 20 GKED CC(C)Cc1ccc([C@H](NC(=O)N(C)Cc2ccc(C#N)cc2)C2CC2)cc1 523220334 KTUNGIOGWXVVOP-QHCPKHFHSA-N 375.516 5.049 30 20 GKED C[C@@H](C#N)CNC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525059357 FMVSKJNFMLNIMY-LBPRGKRZSA-N 379.312 5.175 30 20 GKED O=C(Cc1cccs1)Nc1ccccc1NCC#Cc1ccccc1Cl 532612444 ZKWZGRZWBCJFIW-UHFFFAOYSA-N 380.900 5.046 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1c(C)noc1C 533833225 UQQADLODBBOLPU-HXUWFJFHSA-N 389.455 5.145 30 20 GKED CCN(C(=O)c1ccc(-c2cccs2)nc1C)c1ccc(C#N)c(Cl)c1 539174979 UUCSWNOPGKLZSK-UHFFFAOYSA-N 381.888 5.310 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1OC(F)F)c1nc(-c2ccccc2)cs1 544490523 VSDZHSCXHHQUPB-CYBMUJFWSA-N 385.439 5.134 30 20 GKED C=C(C)[C@@H](Cc1nc(-c2ccnc(Oc3ccc(C)c(C)c3)c2)no1)OCC 547115205 WOBOQBCFFLYTML-LJQANCHMSA-N 379.460 5.064 30 20 GKED COc1cc2c(cc1F)CC[C@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 549204401 KDDHGCUOMLIAKE-SUMWQHHRSA-N 399.491 5.038 30 20 GKED C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)CCCCOc2cccc(C#N)c2)C1 561276203 RRXRIKCDWRUXQR-XXBNENTESA-N 376.500 5.107 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)SCc1ccc(OC)c(C#N)c1 573836241 CHSVROSPQBBAFH-CVEARBPZSA-N 382.529 5.341 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)N1CCC(CCC#N)CC1 581252851 NCXVWUFCGPDANU-UHFFFAOYSA-N 392.286 5.113 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1noc(-c2ccccc2)n1 585753903 MKKLHYCIPDQDLB-MSOLQXFVSA-N 394.478 5.687 30 20 GKED COc1cccc(CN(C(=O)CCCCCC#N)C23CC4CC(CC(C4)C2)C3)c1 588939581 XGTYBUJMUVXIMQ-UHFFFAOYSA-N 394.559 5.467 30 20 GKED CCOCCOCc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1C 589504283 MWDZENPOKMHFRW-UHFFFAOYSA-N 392.421 5.051 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1ccccc1)c1ccccc1OC 594999352 VQOWPHNJHGOVOG-JOCHJYFZSA-N 392.524 5.244 30 20 GKED COc1ccc(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c2ccccc12 602230544 YCUYMAVPWCJSNV-UHFFFAOYSA-N 399.475 5.020 30 20 GKED N#C[C@@H](C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1nc2cc(Cl)ccc2s1 603846711 NCOKTQISBVRXPD-LBPRGKRZSA-N 397.799 5.094 30 20 GKED CCc1cc(C#N)c(NC(=O)CCCOc2ccc(Cl)cc2Cl)s1 604030326 QAFXHLORHQPNHT-UHFFFAOYSA-N 383.300 5.287 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1nc(C(C)(C)C)no1 604046692 KZYOSGYAQWXJEM-CYBMUJFWSA-N 396.878 5.858 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(-c4ccccc4)on3)cc2)c1 609064907 NXQHVJWUJZBAJA-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1cccc(C#N)c1 610344925 MVVWKFUDNZJTPT-CYBMUJFWSA-N 381.819 5.231 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 610355326 OAVOWMNHYXSUMZ-CHWSQXEVSA-N 376.287 5.329 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](C)c1cccc(C#N)c1 610406496 BXRWMLBRNAATHS-AWEZNQCLSA-N 390.314 5.546 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CCC(=O)OCC)CC1 616123462 OJWFRCRORVFNFI-UHFFFAOYSA-N 386.536 5.126 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc4ccccc4[nH]3)c3ccccc3n2)o1 642280814 ABDBSNNKSKIGAM-QGZVFWFLSA-N 392.418 5.170 30 20 GKED N#C[C@H](C(=O)c1cc2cc(F)ccc2s1)c1nc(-c2ccccc2)cs1 642281918 YODDCMFHPZIJFM-OAHLLOKOSA-N 378.453 5.654 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cnccc1C(F)(F)F 666866629 WPKCYZGXSNEQRT-UHFFFAOYSA-N 377.410 5.274 30 20 GKED COc1ccc(C(C)=NN(Cc2ccccc2)c2ccccc2)cc1NC(C)=O 726418102 QTFURYHBCYOAEW-UHFFFAOYSA-N 387.483 5.084 30 20 GKED FC(F)Oc1ccc(NN=Cc2sc(Oc3ccccc3)nc2Cl)cc1 726427291 UTXDDQIRQLYFAA-UHFFFAOYSA-N 395.818 5.636 30 20 GKED COc1cc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)ccc1OC(F)F 727264641 UONSJZVNCZPZRX-HJWRWDBZSA-N 387.407 5.316 30 20 GKED O=C1CCc2cc(C(=O)/C=C\c3ccc(Cl)c(C(F)(F)F)c3)ccc2N1 727266621 BABYYVAOSFYDAH-UQCOIBPSSA-N 379.765 5.140 30 20 GKED N#CCOc1cccc(/C=C\c2cc(Cl)n3c(nc4ccccc43)c2C#N)c1 730151263 JAAUZXBMRUUYLF-HJWRWDBZSA-N 384.826 5.085 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(OCC(C)C)cc2)S1 730151299 JWNWOPKCBBZRDM-UNOMPAQXSA-N 380.513 5.230 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(C)[C@@H](c2ccccc2)C(C)C)c1=S 732980179 UUAYJMMVKYRNBU-LJQANCHMSA-N 382.533 5.147 30 20 GKED O=[S@](Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1)C1CCCCC1 734979656 SSFLMROMSXRMOW-MUUNZHRXSA-N 391.536 5.877 30 20 GKED Cc1ccc(-c2nnc(SCc3cc(Cl)ccc3OCC#N)o2)c(C)c1 735232765 BVDRPBDXIKYTQL-UHFFFAOYSA-N 385.876 5.202 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Br)cc2)c(SC)cc1OC 741164798 ADMVJQWUDQXKIG-TWGQIWQCSA-N 393.302 5.084 30 20 GKED CC(=NNc1nc(-c2ccccn2)nc2c1CCC2)c1cc(Cl)ccc1Cl 741810588 YJMOGYIFXPVTAJ-UHFFFAOYSA-N 398.297 5.170 30 20 GKED Cc1ncsc1/C=C/C(=O)c1ccc(-c2ccccc2Br)s1 742432163 UCUOEDTWHCYDFQ-VOTSOKGWSA-N 390.327 5.839 30 20 GKED CCCCCCOCc1cccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c1 743128251 VUHJGYUEROYJCW-SFHVURJKSA-N 379.504 5.538 30 20 GKED Cn1c([C@H](C#N)C(=O)C2(Cc3cccc(Cl)c3)CCCC2)nc2ccccc21 744010922 SYIRWUXXMBVIKO-GOSISDBHSA-N 391.902 5.206 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc1Br 745990244 PDVBSXHNVRRPAO-KRXBUXKQSA-N 394.268 5.416 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 746346538 RJWYCXDAYJADMK-LUAWRHEFSA-N 379.416 5.145 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1coc2ccccc12 747750155 JLYZEPREHAZPJA-UHFFFAOYSA-N 397.360 5.140 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)Nc1ccccc1F 749102349 LAHNUDPXJWJHTG-UHFFFAOYSA-N 397.288 5.112 30 20 GKED C=CC[C@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccncc1 751800198 RZAPCMCUSHIXPZ-NRFANRHFSA-N 385.458 5.131 30 20 GKED Clc1cc(Br)ccc1NN=Cc1c(C2CC2)nc2sccn12 755813673 GDPHLWCHAIDGLR-UHFFFAOYSA-N 395.713 5.135 30 20 GKED COc1ccc(C[C@H](C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 758409796 MQAUVSKUKJAGBV-UUOWRZLLSA-N 384.479 5.168 30 20 GKED C=C[C@@H](CC(=O)Oc1ccc(-c2noc(-c3cccnc3)n2)cc1)c1ccccc1 759314636 GUVKORSEWXCXTO-KRWDZBQOSA-N 397.434 5.064 30 20 GKED O=C(Nc1cccc(C=NOCC(F)(F)F)c1)c1ccc(Cl)cc1Cl 764846340 GNDKHASNLXHKJW-UHFFFAOYSA-N 391.176 5.159 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccco2)s1 766254037 GIAKVBUQAZEFKV-MRXNPFEDSA-N 386.432 5.122 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 774025086 ZEQZOKAUVYLJMU-GAJHUEQPSA-N 384.483 5.182 30 20 GKED Cc1cccc(C)c1OC[C@@H](NCc1ccc(OCC#N)cc1)c1ccccc1 775536325 OHNZZYMFSIYGBS-XMMPIXPASA-N 386.495 5.116 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(Cl)c(Br)c2)c1 776186730 YDTPDYSIJSYMBB-OAHLLOKOSA-N 393.712 5.073 30 20 GKED C=CC[C@@H](C(=O)OCc1nnc(-c2cc(C)c(CC)s2)o1)c1ccccc1 784831680 FANSJHQZUXPVLN-MRXNPFEDSA-N 382.485 5.072 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C\c1ncc(-c2ccccc2)s1 787178140 KPIBWGYCIICTGX-KTKRTIGZSA-N 383.856 5.146 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ncc(C(F)(F)F)s1 788357300 XVBAANXQCJQKFW-VOTSOKGWSA-N 398.406 5.629 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)c1ccc(C(C)(C)C#N)cc1 793732433 LNFQYUOBYYKLHZ-UHFFFAOYSA-N 393.487 5.396 30 20 GKED COc1cccc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1F 795205118 NQMRYMRDMONHOA-NRFANRHFSA-N 388.442 5.061 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813216842 GDQPTCRDKPFRAC-KOTGUFOOSA-N 398.306 5.399 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCOCC2)cc1Cl 815636158 QKKHSJYJUONAIW-FDDCHVKYSA-N 397.950 5.262 30 20 GKED CCN(C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)[C@@H](C)c1ccc(C#N)cc1 914509702 XZQKBMRGRYNIMQ-DBTPVHCXSA-N 389.886 5.383 30 20 GKED CCCCCCCCC(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 914744643 YEGNJJFCFTYPPE-STQMWFEESA-N 375.397 5.763 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3ccc(F)cc3s2)cc1 916955270 NVQQUTYBFVFJQB-FZKQIMNGSA-N 394.471 5.515 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1 917605483 VNQULIQIUSLFEJ-FLIBITNWSA-N 392.436 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccc(C#N)cc2)C1 931060846 XKJPAYBPMQVSAY-QFIPXVFZSA-N 389.499 5.016 30 20 GKED O=C(O)c1ccc(NN=Cc2cccc(OCc3ccc(Cl)cc3)c2)cc1F 1776076714 CZAVIDFPJTVTAK-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(-c2ccc(Cl)cc2)c1 1776784762 RWJFDNSACSBDPL-JOCHJYFZSA-N 387.951 6.300 30 20 GKED CCCCCCCOc1ccc(/C=C/C(=O)c2cccc(OCC(=O)O)c2)cc1 1776785871 GJTPMMSSMPGIBH-NTCAYCPXSA-N 396.483 5.395 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1F 1777403151 BRQAUCQIZMGSSY-CLFYSBASSA-N 398.480 5.870 30 20 GKED Cc1ccc(N2C(=O)/C(=C/c3ccc(C(C)C)cc3)N=C2SCCC#N)cc1 4462816 GQCGJFUOMCFIGJ-QNGOZBTKSA-N 389.524 5.509 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 41543881 GYSFBBHHXPVNFX-CQSZACIVSA-N 393.855 5.403 30 20 GKED COc1ccc(SCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 51533539 PYFHIILLVAMJGK-GOSISDBHSA-N 394.521 5.177 30 20 GKED CC(C)(CCC#N)CN1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 93317967 CKHPAMWJIYKXGD-UHFFFAOYSA-N 376.504 5.019 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1cccc(O)c1 97993489 UYHNHWIKUJGCFN-QXMHVHEDSA-N 377.827 5.194 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)cc2)C2CCC2)cc1OCCCC#N 105431101 DBKYKTIPYCGWLM-QHCPKHFHSA-N 382.479 5.148 30 20 GKED CCSCc1ccc(C(=O)Nc2ccc(OCC(F)(F)F)c(C#N)c2)cc1 108269018 DMTZGAAQQGSIFF-UHFFFAOYSA-N 394.418 5.005 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(-c3nc4ccccc4[nH]3)cc2)c1 113355731 BNUWJQGUDOYYSV-UHFFFAOYSA-N 396.494 5.202 30 20 GKED N#C[C@@H](C(=O)CCSc1ccc(Cl)cc1)c1nc(-c2ccncc2)cs1 114621129 QMOJOPVOXLBHLT-INIZCTEOSA-N 399.928 5.217 30 20 GKED N#C[C@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)C1CCCCC1 124445918 HIQHQXXZIXXVBQ-IBGZPJMESA-N 381.549 5.410 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2SCCS2)cc1 124463913 UXTNOSFQLKXZEP-UHFFFAOYSA-N 382.554 5.088 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3c(F)ccc(F)c3F)c2)cc1 131600888 WRHPFPHPQWKHRB-UHFFFAOYSA-N 396.368 5.001 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(F)cc2OCC#N)o1 135316273 PFKHJIWHTJTBGG-GOSISDBHSA-N 385.439 5.033 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(-c2ccncc2)s1 172782997 VCKUBCHPGMVXKH-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1CCC(F)(F)F 184073628 OYDMAHGPPSLIDB-CYBMUJFWSA-N 377.366 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C[C@H](O)c1cccs1 191420354 XSHGAGFDYZNFKL-ICSRJNTNSA-N 398.572 5.720 30 20 GKED N#CCCCOc1cccc(CNC2(c3cccc(Br)c3)CCC2)c1 236779977 KHNTYVIMKWZDRL-UHFFFAOYSA-N 399.332 5.301 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1 303369060 RYHZNUJUQTWMQZ-IAGOWNOFSA-N 396.556 5.784 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/Cc5noc(C6CC6)n5)(C4)C2)C3)cc1 329017849 KTOFKXWUZACCSC-WADIDORASA-N 391.515 5.250 30 20 GKED Cc1sc2nc(CC/C(O)=N/[C@H]3CCCCC34CCCC4)nc(O)c2c1C 329624166 OEBMWTJGWRFRSF-HNNXBMFYSA-N 387.549 5.406 30 20 GKED CC1(C)CCC[C@H]1N(Cc1ccccc1)Cc1nnc(-c2ccc(C#N)cc2)o1 426829481 ZRHQPIQUDITWFC-OAQYLSRUSA-N 386.499 5.189 30 20 GKED CCOc1ccc(-c2csc(NC(=O)c3cccc(SCC#N)c3)n2)cc1 430033024 DZUYNUIXEKSWPW-UHFFFAOYSA-N 395.509 5.077 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2C)ccc1Br 432009372 VCICMSWULNWOHN-IBGZPJMESA-N 398.304 5.307 30 20 GKED C[C@@H](NC(=O)C1(c2ccc(C#N)cc2)CC1)c1cccc(OCc2ccccc2)c1 434034154 BGNPDCQFBMQEMA-LJQANCHMSA-N 396.490 5.046 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1F 437461113 PKVMXUBNUWEUFW-CQSZACIVSA-N 378.378 5.371 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@H]1c1cccc2ccccc12)c1ccccc1 438869521 SFYDZRQNFJUEIJ-ZEQRLZLVSA-N 383.495 5.731 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)SCc2ccc(C#N)cc2OC(F)F)c1 439541561 NFRUOGIEXDYABP-AWEZNQCLSA-N 390.455 5.037 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)NCC1CCC(C#N)CC1 440972198 KQWMDDRPMDXENL-HDYDNRTBSA-N 391.515 5.587 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(C#N)c(C)c2)CCC3)cc1 443990645 ULHPECXXYKAJDO-FQEVSTJZSA-N 389.524 5.166 30 20 GKED CC[C@@H](N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C)c1ccc(C#N)cc1 447562564 MGYKZIFAHDHXNO-JLTOFOAXSA-N 379.504 5.931 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c(Cl)c1 455694650 AGAPPQIYQUZJIR-NRFANRHFSA-N 392.890 5.646 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H](C)CC(F)(F)F 457561174 QNMRWTDBGDXNKB-CQSZACIVSA-N 378.369 5.128 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)s1 464071012 BWDSMFJODXIQHS-UHFFFAOYSA-N 385.851 5.277 30 20 GKED C=CCC(CC=C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474274812 TZFLLDFOCOGCOC-HNNXBMFYSA-N 379.344 5.584 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cnn(-c2ccccc2Cl)c1C(C)C 476248812 MGPVIOSCTXKULA-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477191074 JUGYNDUQMZRGNW-LBPRGKRZSA-N 377.271 5.201 30 20 GKED CN(C(=O)CCCCc1nc2ccccc2s1)c1cc(Cl)ccc1C#N 479575509 PONWQCGRBACARW-UHFFFAOYSA-N 383.904 5.197 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(OCc3ccccc3)cc2)cc1 480270285 XRDYBHFLRSCTHS-DNQXCXABSA-N 382.463 5.074 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H]1CCc2ccccc2C1 480303233 VYWDIRSCYPRSCJ-GOSISDBHSA-N 397.478 5.188 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1c1ccccc1 480590705 ZLLCAUNDOJIYPI-HXOBKFHXSA-N 383.451 5.575 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC(=C)C)Cc1ccc(CO)o1 482248372 YEOGTASUNVDWOF-UHFFFAOYSA-N 382.504 5.234 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC(C)(C)Cc2oc(C)cc21 482723986 OPQRFEQLHFNYSV-FQEVSTJZSA-N 398.551 5.167 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)[C@@H](C#N)c1nccc2ccccc12 483987830 PRYPTPYDEPDAOR-SFHVURJKSA-N 387.826 5.342 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@@H](CC)C(=O)c3ccccc3)o2)cc1 489759516 PAQIQYNQIZOZEG-SFHVURJKSA-N 380.469 5.055 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 497322596 MPILXHGAOJTHDM-UHFFFAOYSA-N 376.378 5.119 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@H](C#N)c3ccccc3Cl)o2)c(C)c1 499946473 QIVMNMFRCHFABA-LJQANCHMSA-N 394.858 5.124 30 20 GKED Cc1cc(C(=O)Nc2ccccc2-c2cccs2)nn1-c1cccc(C#N)c1 502556720 YBOUTSINTGDTFJ-UHFFFAOYSA-N 384.464 5.033 30 20 GKED Cc1ccc(-c2csc(CNc3ccccc3S[C@H](C)CC#N)n2)cc1 506248317 WUUVVURUODZWTR-MRXNPFEDSA-N 379.554 6.125 30 20 GKED CC(C)Cn1ncc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)c1C(F)F 515562001 GWGSNEOVTQSLOO-UHFFFAOYSA-N 397.294 5.026 30 20 GKED Cc1ccc(-c2ncc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)s2)cc1 516120588 NHUAEMJVNFHTCD-UHFFFAOYSA-N 398.491 5.790 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(Cc3csc(-c4ccccc4)n3)no2)cc1 518253863 NXGLJIBMESAVDD-UHFFFAOYSA-N 386.480 5.252 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCc2c(Cl)cccc21 520154007 HQZJLWGNNLBPCI-NRFANRHFSA-N 381.907 5.067 30 20 GKED COc1cccc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 520597860 HXLRQDVKSCXFQS-INIZCTEOSA-N 387.439 5.242 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](Sc2ccc(F)cc2F)c2ccccc2)cc1 520679496 HPWWTLHVGXTPJA-FQEVSTJZSA-N 380.419 5.309 30 20 GKED C=C(C)CN1CCC(NC(=O)N(CCCCC)Cc2ccc(Cl)cc2)CC1 520697026 YHBXZVJHZUHNCW-UHFFFAOYSA-N 391.987 5.082 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)sc2c1CCC2 521955732 VXJQJNZPOFOYQQ-VXGBXAGGSA-N 377.296 5.157 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)cc2F)c2cc(F)ccc2F)c1 525689164 CRPGUVBSWRYKNE-JOCHJYFZSA-N 398.453 5.577 30 20 GKED Cc1cccc(N(CC(=O)Nc2ccccc2SC[C@H](C)C#N)C(C)C)c1 533043624 YAHOHORVBGYPRU-GOSISDBHSA-N 381.545 5.100 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C)c1ccccc1 533915426 RSNDZKCSFFXKLZ-IBGZPJMESA-N 384.479 5.546 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2ccc(CC#N)cc2)C(C)C)cc1 534672832 SJLQKQMVLXEERQ-UHFFFAOYSA-N 398.506 5.479 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CCCC(F)(F)F)c1 537759111 JSBZLYHJYXXDSW-UHFFFAOYSA-N 380.797 5.477 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3ccc(C4(C#N)CC4)cc3)sc2C)s1 538518043 IGFLGKGBCXHLFZ-UHFFFAOYSA-N 379.510 5.296 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(Cc2ccc(Cl)cc2)CC1 538840641 ZZNLKPAGBAEUHX-HNNXBMFYSA-N 384.932 5.553 30 20 GKED Cc1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)nn1[C@@H](C)C1CC1 539631038 JPEYTVVLYRUMDJ-AWEZNQCLSA-N 376.485 5.015 30 20 GKED COc1cccc([C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2Cl)c1 540595873 GWVWAZATJFSHLR-QMHKHESXSA-N 376.887 5.660 30 20 GKED CC(C)(CNC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C(F)(F)F 548942578 HHDMECSSRFRKBJ-UHFFFAOYSA-N 377.366 5.061 30 20 GKED Cc1cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)sc1Br 551211485 ITVZKRXXIRMEIE-GDBMZVCRSA-N 377.351 5.905 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1ccc(-c2ccncc2)cc1 554229650 CNIJAMZMFORDCJ-HNNXBMFYSA-N 392.300 5.234 30 20 GKED CCCn1c(SCc2ccc(C#N)cn2)nc2ccc(C(F)(F)F)cc21 580269792 HKOSMWPTBRGIPM-UHFFFAOYSA-N 376.407 5.024 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1 585755054 DSKCBYILJZDIFR-OAQYLSRUSA-N 388.433 5.143 30 20 GKED CC(C)n1ncc2cc(NC(=O)N[C@H](CCCC#N)c3ccccc3)ccc21 590118657 NKGNPZOWBUZREH-HXUWFJFHSA-N 375.476 5.174 30 20 GKED CC(C)(C)Oc1ccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 590915882 SJDLTGUDTZHUBY-OAQYLSRUSA-N 379.504 5.098 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](c1ccc(O)cc1)C1CC1 591059573 FGBIDQZIXFUUGE-DNVCBOLYSA-N 380.513 5.309 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@H]1OCc2cc(Cl)ccc21 593975627 POJFVGIPZMUALF-SCLBCKFNSA-N 386.904 5.192 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(F)(F)C3)cc1 599726107 RETKMOZWRLUKDQ-IRXDYDNUSA-N 383.398 5.145 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(F)c1 603759216 YHGNPTHXPWVFDX-LJQANCHMSA-N 394.833 5.395 30 20 GKED CC[C@@](C)(C#N)NC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 609071932 VLRBZLFYRPFYJG-QHCPKHFHSA-N 393.918 5.084 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC[C@@H]2c2ccccc2Cl)c1 609082669 UJKAINZGTCKQLY-MRXNPFEDSA-N 391.805 5.182 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H]1CCc2ccccc21 609371395 IYPSLCVIMGUVOF-BEFAXECRSA-N 382.554 5.298 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1ccc(OCc2ccccc2C#N)cc1 609647419 NAFLIKFXJSJVJU-NTKDMRAZSA-N 396.490 5.155 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@@H]2C[C@@H]2C2CCCCC2)cc1 610205622 RNXCSTKMEZTZPC-FGZHOGPDSA-N 390.552 5.549 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 610226897 OZBNRNDYIHNOAR-CJMONDIMSA-N 387.310 5.578 30 20 GKED C[C@H](NC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1)c1cccc(C#N)c1 610400920 SNFKLAOOHDNHSK-OALUTQOASA-N 383.495 5.139 30 20 GKED C[C@H](N[C@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1)c1cccc(C#N)c1 610914551 DLPGQJKGCTUWNC-CSODHUTKSA-N 382.479 5.057 30 20 GKED Cc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1Oc1cccnc1 611097254 ZPALCWUMSGFTMX-UHFFFAOYSA-N 398.249 5.613 30 20 GKED COc1ccc(C(C)(C)C)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 618172996 ZYUURYKOOZQWCL-UHFFFAOYSA-N 389.499 5.503 30 20 GKED N#Cc1cc(F)ccc1CSc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1 728441220 CEQIBYQXKVOWHJ-FQEVSTJZSA-N 393.487 5.032 30 20 GKED Cc1ccc(Nc2nn(CN(CCC#N)CC(C)(C)C)c(=S)s2)cc1C 729468729 YHUHSMGYAAZSJV-UHFFFAOYSA-N 389.594 5.254 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C(\C)Cc1ccccc1OC 730162945 OBWFJKNHDJIJDF-FYWRMAATSA-N 375.921 5.114 30 20 GKED O=C1/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)Cc2c(Cl)cccc21 733083810 QVTBLXHDCGXTIA-KPKJPENVSA-N 382.828 5.194 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1nc2ccccc2s1 734117928 UJXCRFJNVBFFOZ-OAHLLOKOSA-N 383.476 5.326 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)n1cccc1 735207184 OVGHWEQFHLVIFW-ZLCDGRSFSA-N 393.556 5.240 30 20 GKED CC(C)(NCc1cc(Cl)ccc1OCC#N)c1ccc(Cl)c(Cl)c1 735309320 CQBDZQCGIITHBN-UHFFFAOYSA-N 383.706 5.574 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc(Cl)c1OC 741474671 YBBCAKGEWJUOGS-BQYQJAHWSA-N 393.870 5.705 30 20 GKED COc1ccc(CN[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)cc1C#N 742372001 MAPPBGLBJHVVMK-INIZCTEOSA-N 376.887 5.738 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744016552 OLYPRUPQXZUANP-HCYCVZQXSA-N 386.398 5.595 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(=O)oc2ccccc12 750599596 CJZFQAQQSYCZAK-NRFANRHFSA-N 394.430 5.009 30 20 GKED COc1cccc(NN=Cc2c(C(C)C)nn(Cc3ccccc3)c2Cl)c1 754713344 HLTCSNSCFMYTAC-UHFFFAOYSA-N 382.895 5.163 30 20 GKED C=CCn1c(SCc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1cccs1 768415820 UNIXUBQBVSGVFG-UHFFFAOYSA-N 392.893 5.047 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ncoc1-c1cccc(C(F)(F)F)c1 768859689 NOUYXNLGEHUARS-UHFFFAOYSA-N 380.366 5.237 30 20 GKED C#CCCCCCC(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 779933985 OSJSXHPPADDYFK-XMMPIXPASA-N 390.552 5.818 30 20 GKED CC1(C)C[C@@H](NN=Cc2ccccc2Oc2ccc(F)cc2Cl)CCO1 780250967 RUMGSCLHCNCNIL-INIZCTEOSA-N 376.859 5.153 30 20 GKED C=CCC[C@@H](C(=O)O[C@H](C)c1nnc(-c2ccc(F)cc2)o1)c1ccccc1 784824607 JLJNQDDVVKEHOR-DNVCBOLYSA-N 380.419 5.230 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc(-c2ccccc2)cs1 786319719 UCWSNWGLGQRLEM-MGPQQGTHSA-N 384.913 5.505 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Br)cs2)c1 786851364 CNNALTFXXWFDJH-DOMZBBRYSA-N 379.323 5.042 30 20 GKED COc1ccc2nc(/C=C/C(=O)c3sccc3Br)sc2c1 788733023 MDCOYMUVMYCJGA-SNAWJCMRSA-N 380.288 5.025 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccc(C)cc2)CC1 789460878 XCTNGZZLHRENFW-UHFFFAOYSA-N 377.532 5.201 30 20 GKED COc1ccc(F)c2[nH]c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc12 793045242 YBIKJNUSYAGFAH-IBGZPJMESA-N 399.425 5.223 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCCc2cccc(C(F)(F)F)c2)s1 797571755 PPCVZLZHOVDLIC-OAHLLOKOSA-N 394.462 5.659 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)sc2cc(F)ccc12 805859107 YDQGBWPRZZNWKP-ZDUSSCGKSA-N 399.397 5.584 30 20 GKED O=C1/C(=C/c2cnc(-c3ccc(Cl)cc3)s2)C[C@@H](C(=O)O)c2ccccc21 806560606 MUCDNZQLSPPEDU-FHLIRTJZSA-N 395.867 5.302 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)c2ccccc2C(=O)c2ccc(Cl)cc2)CC1 809091192 OSYBUEIQZIQNKB-IYBDPMFKSA-N 381.859 5.058 30 20 GKED O=C(/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1nccc2ccccc12 811698906 MZXQRTHTRZAQLQ-CMDGGOBGSA-N 387.420 5.163 30 20 GKED CCOP(=O)(CCC=NNc1nc(Cl)c(Cl)cc1Cl)OCC 834928284 VXOIMOUZWOFNRL-UHFFFAOYSA-N 388.619 5.096 30 20 GKED C=CCOc1ccc(CNc2cccc3oc(C(F)(F)F)nc23)cc1OC 864009698 ZQNLFYNKPBUICT-UHFFFAOYSA-N 378.350 5.032 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cc2c(F)cccc2s1 914522343 UDRQSFCUVZKDCW-UHFFFAOYSA-N 376.412 5.352 30 20 GKED CCCCCCCC(=O)Nc1nc(-c2ccc(CNC(C)=O)s2)c(C)s1 914607401 WFNUGFYSGCDXLU-UHFFFAOYSA-N 393.578 5.115 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1ccc(NC(=O)NC(C)C)cc1 915048878 MCMUPHHRFXPNDK-UHFFFAOYSA-N 379.291 5.359 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)Cc2coc3cc(C)c(C(C)C)cc23)c1 916898090 TVIPFKFYHFWSPD-NRFANRHFSA-N 388.467 5.063 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(Cl)cc(Cl)c2)cc1 916947382 ISXJEFMPGBVVMX-XIKOKIGWSA-N 389.282 5.468 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)CCc4ccco4)c23)cc1 917027997 KZCPUXWBLCTQBN-UHFFFAOYSA-N 392.484 5.381 30 20 GKED COc1ccc(C(=O)/C=C\c2c(C)nn(-c3ccc(Cl)cc3)c2C)cc1OC 917143945 YVOAOOLWFNSWGK-KHPPLWFESA-N 396.874 5.056 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(-c2ccco2)nc2ccccc12 920017297 LVDLVEHQXXQWQN-UHFFFAOYSA-N 383.407 5.017 30 20 GKED Cc1cc(C)cc(-c2ccc(C=NNc3ccc(Cl)c(C(=O)O)c3)cc2)c1 1776033508 SCMPSKLKEWGUAP-UHFFFAOYSA-N 378.859 5.768 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(C[C@H](C)C(=O)O)cc2)c1 1776787626 XPFYDRUTDRQTMJ-IBGZPJMESA-N 383.532 5.911 30 20 GKED CC(C)c1ccc([C@H](NC(=O)COc2ccccc2C#N)c2cccs2)cc1 9982917 WGOBXGQVVXYEML-QHCPKHFHSA-N 390.508 5.028 30 20 GKED CCc1cc[n+](/C(C(=O)c2cccc(Cl)c2)=C(/S)Nc2ccccc2)cc1 10170355 YHRWVBFHEPWGFI-UHFFFAOYSA-O 395.935 5.241 30 20 GKED CCCCN/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1cccc(C)c1 27322172 WEEYGLKIODZCFH-UHFFFAOYSA-O 397.589 5.134 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc(F)c(Cl)cc3Cl)c2C#N)C1 61047383 PYHXWILPIKNJCJ-QMMMGPOBSA-N 383.275 5.443 30 20 GKED C=CCN(C(=O)c1cnc(-c2ccccc2)nc1)c1nc(-c2ccccc2)cs1 67658097 KYTAHDYPBFCZTN-UHFFFAOYSA-N 398.491 5.100 30 20 GKED O=C1C(Cl)=C([C@H]2CC[C@H](c3ccc(Cl)cc3)CC2)C(=O)c2ccccc21 100222538 QUUMPHYEOKHOOW-OTVXOJSOSA-N 385.290 6.186 30 20 GKED CCN(Cc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1)C(C)C 108199243 CZXLOUIWXWSVRT-UHFFFAOYSA-N 381.545 5.175 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1 108237367 ATRXDMFNHCYECY-CQSZACIVSA-N 396.903 5.030 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4ccccc4s3)n2)cc1 108978590 VMSBVQHFFLYGLC-MRXNPFEDSA-N 390.489 5.523 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1c[nH]c2ncccc12 123742645 KYVMCQLIDSOCHP-VMPITWQZSA-N 395.871 5.148 30 20 GKED Cc1nc(C(C)(C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)sc1C 150975078 XKWVMXVVXVXQFX-GFCCVEGCSA-N 388.562 5.211 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(F)cc(F)cc1F 154172384 QYICYYZUHSBMLF-UHFFFAOYSA-N 396.368 5.115 30 20 GKED CC[C@@H](CC#N)NC(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 158645692 PPMFJSXINURQJI-FQEVSTJZSA-N 376.504 5.144 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 176942718 ZUDZKPUCYIGVEV-UHFFFAOYSA-N 396.560 5.104 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2c(F)cccc21 181714799 PHOMMIVNNSQOSQ-WMLDXEAASA-N 399.491 5.255 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(F)ccc(F)c2F)cc1 184696786 CEMVDTWOZWAMQD-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1cn(C)c2ccccc12 185352066 FEORJPALZHJRCP-JKSUJKDBSA-N 377.513 5.172 30 20 GKED CCC(C)(C)N/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1ccccc1 186977582 LBLDWIGWKRONKV-UHFFFAOYSA-O 397.589 5.214 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](COC)Cc1ccccc1 191518825 PLYJGTMSLFRKPC-OAQYLSRUSA-N 380.532 5.260 30 20 GKED N#C[C@@H](C(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2o1 255050138 YRIJDDZVGIAKEE-FYQHACEVSA-N 390.748 5.303 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC/C=C\c1ccccc1 255895612 JHLBCTHJJATREK-CGQZWFTASA-N 382.554 5.466 30 20 GKED CC(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 329159794 DYXCPDJRVYSRKF-MISYRCLQSA-N 377.550 5.204 30 20 GKED CCn1ncc2ccc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)cc21 329500490 YKGCKNWDLSZOFB-KRWDZBQOSA-N 391.519 5.151 30 20 GKED C[C@@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1Cl 330059380 KVXKXEDTFRQXSC-NUYPLMSZSA-N 383.319 5.936 30 20 GKED Cc1nc2cc(Cl)c(N=C(O)c3cnc([C@@H]4CCCO4)s3)cc2s1 330141624 XVBBGZRZNWSNAV-LBPRGKRZSA-N 379.894 5.202 30 20 GKED COc1cc(C2(/C(O)=N/[C@@H]3CCc4cnn(C(C)C)c4C3)CCCC2)ccc1C 330147537 LVWWJIZQQNYRGB-HXUWFJFHSA-N 395.547 5.107 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@H](C)C3)s1 411021913 XEZCTVSQYWFYIX-HOSYDEDBSA-N 389.546 5.030 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 425729003 VNKOMJPDJPSPDD-ACJLOTCBSA-N 393.384 5.093 30 20 GKED N#C[C@@H]1CC[C@H](Sc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)C1 430152721 XGVIBCYAQCZLAV-SJORKVTESA-N 394.931 5.431 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(F)c(Br)c1)c1ccccc1 432978886 UZVHNNSKVBLNQM-KRWDZBQOSA-N 390.256 5.145 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2ccc(C#N)c(C)c2)cs1 434647180 FNJWHQHNLNZJOT-UHFFFAOYSA-N 391.496 5.204 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 437663909 SXSSKAJAXPNXRO-UHFFFAOYSA-N 396.796 5.318 30 20 GKED C[C@H](NC(=O)Nc1ccnc(Oc2ccccc2Cl)c1)c1ccc(C#N)cc1 438375865 KJCMUYWHOCOZLN-AWEZNQCLSA-N 392.846 5.282 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cnn(CCC(C)C)c1C 441545763 SJFPUSMMGZGWDY-UHFFFAOYSA-N 395.425 5.074 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 441546630 YIPLHCPGDXREKM-LJQANCHMSA-N 390.405 5.101 30 20 GKED N#CCc1cccc(NC(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)c1 455900229 BUHXHJCXGLDRLQ-UHFFFAOYSA-N 388.298 5.471 30 20 GKED CC1CCC(N(C(=O)c2sccc2C#N)c2cccc(N3CCCC3)c2)CC1 460116820 QINBVSJOTFXGFU-UHFFFAOYSA-N 393.556 5.445 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 460178274 VUPWSOZXRZMPKS-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)c2ccccc12 462453276 BYLRAWVKIYQNAC-AWEZNQCLSA-N 388.858 5.266 30 20 GKED Cc1ccc(-c2ccsc2C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 464420986 KWJQPWKTFDXMAV-MRXNPFEDSA-N 386.398 5.627 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Oc1ccc2ccccc2c1 470890219 HZSNUTVFASPJLK-IRXDYDNUSA-N 390.508 5.640 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1oc2c(Br)cccc2c1C 471171046 XWYMNVSWPGTZKY-UHFFFAOYSA-N 377.282 5.048 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 471186559 MFCSZXFUSFSBNJ-UHFFFAOYSA-N 389.455 5.142 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1c1ccc(Br)cc1)c1ccccc1 475022407 JFGGYXZBWTYHHN-ICSRJNTNSA-N 397.316 5.200 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccc(-c2cccnc2)cc1 475736873 BCROOPPDGVCMGQ-CQSZACIVSA-N 376.847 5.156 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1)c1ccc(F)c(F)c1 481589677 AREXBIBLUFSBON-BFUOFWGJSA-N 387.405 5.430 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](CCc2ccccc2)C(F)(F)F)cc1 481614918 SDSKMBLWRSZJAP-GOSISDBHSA-N 389.421 5.173 30 20 GKED N#C[C@@H](C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1nccc2ccccc12 483203074 QSAYHRQTCMONQG-OAQYLSRUSA-N 388.430 5.064 30 20 GKED N#CCCC[C@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccccc1 487485360 MIEBZLFKPIAOFS-IBGZPJMESA-N 375.299 5.477 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3csc(C(C)(C)C)n3)o2)cc1 489736681 AUMOJXXOBWWHTI-UHFFFAOYSA-N 387.530 5.348 30 20 GKED N#CCc1ccc(NC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)cc1 493926430 COINHXGPRGOXBG-UHFFFAOYSA-N 398.359 5.830 30 20 GKED N#Cc1cc(NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)ccc1Cl 494710140 UFNJZMMVCIOEDZ-UHFFFAOYSA-N 390.830 5.108 30 20 GKED Cn1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1C1CCC1 497446281 XTQBZERZLCJCBK-AWEZNQCLSA-N 397.450 5.184 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Cc1c(Cl)cccc1Cl 500307585 USCQXLASSSOGGH-UHFFFAOYSA-N 375.299 5.092 30 20 GKED Cc1cc(Br)ccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 501130104 WONOLWIVVACIHQ-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 505060504 GFERFABSVNOBBR-OFNKIYASSA-N 391.559 5.322 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 514868988 FVLBFODSUOJDSS-VQIMIIECSA-N 397.544 5.562 30 20 GKED COc1ccc(-c2ccc(C(=O)N(CCC#N)c3ccc(F)cc3)c(F)c2)cc1 517768454 DRAGCZXCAXXJBP-UHFFFAOYSA-N 392.405 5.201 30 20 GKED CC(C)CN(CCc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 519451162 RTWUOMBSWWYYQS-LJQANCHMSA-N 395.572 5.671 30 20 GKED C[C@@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 521710949 PTYUIPHSGMOTQF-OXQOHEQNSA-N 381.907 5.649 30 20 GKED C[C@H](C[C@H]1CCCO1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 524200523 RNEWUKXNIJPEMP-RDTXWAMCSA-N 399.878 5.083 30 20 GKED Cc1ccc(NC(=O)Nc2cccc3c2CCN(Cc2ccccc2C#N)C3)cc1 524682940 ZLTQZTGSZHPKMY-UHFFFAOYSA-N 396.494 5.069 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3ccc(CC#N)cc3)s2)cc1 533948369 USHOWKWQNLWMNN-KRWDZBQOSA-N 389.524 5.326 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(C(C)(C)c3ccccc3)nc2C)s1 539912533 WOYQNTNOCKCJDG-UHFFFAOYSA-N 395.553 5.525 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)nc1)c1nc(-c2ccccc2)cs1 541017897 ATMHQPFRNRFVKQ-SFHVURJKSA-N 389.480 5.017 30 20 GKED COCCOc1ccc(C#N)cc1N[C@@H](C)c1sc(-c2ccccc2)nc1C 541558576 FJGUKWDJTVXHOW-HNNXBMFYSA-N 393.512 5.189 30 20 GKED N#CCC1CCN(C(=O)c2oc3ccccc3c2CSC2CCCCC2)CC1 543838637 QKHAIYUNJFSSTC-UHFFFAOYSA-N 396.556 5.765 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 543861579 RLDRZWQMAHMZDQ-MOPGFXCFSA-N 393.490 6.292 30 20 GKED CCCCSc1ccc(C(=O)[C@@H](C#N)c2ccccn2)cc1C(F)(F)F 546903876 HJHQSLKXLGHZMC-AWEZNQCLSA-N 378.419 5.483 30 20 GKED COc1ccc(CN2CC3(CCC3)[C@H]2c2ccccc2)cc1OCCCC#N 552316492 BUYDSDFTLMCWHF-HSZRJFAPSA-N 376.500 5.105 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1nc(-c2ccccc2)cs1 558756310 ADRWJBCGAHNSPF-UHFFFAOYSA-N 391.883 5.007 30 20 GKED O=C(Nc1ccc(OC(F)(F)F)cc1)c1c(F)cc(C(F)(F)F)cc1F 567202418 NSVXDDLPFCRYKO-UHFFFAOYSA-N 385.210 5.135 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(O)ccc1Cl 570131411 DSZIGSALNPFBAV-UHFFFAOYSA-N 392.842 5.057 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NC2CC(C(F)(F)F)C2)cc1Cl 570239321 GLXGBFHVNIGYMV-UHFFFAOYSA-N 394.780 5.075 30 20 GKED Cc1sc(CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)nc1C(C)C 570359656 JDIARPQWGBJLEA-UHFFFAOYSA-N 391.496 5.420 30 20 GKED COc1ccccc1[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 571724749 ARPXBJAUNPVJAL-LADGPHEKSA-N 388.898 5.587 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1sccc1F 582113545 JEHGAERJWCYFMU-UHFFFAOYSA-N 387.276 5.099 30 20 GKED CCCC[C@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 584202043 YTCRNZZVBDQNRP-SFHVURJKSA-N 379.504 5.488 30 20 GKED CC[C@@H](C#N)C(=O)Nc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1C 593487191 OKAJCFAUFMJJKO-HNNXBMFYSA-N 378.451 5.220 30 20 GKED CCc1cccc2cc(CNc3ccc4c(c3)CCC(=O)N4CCCC#N)oc12 594941386 ZWDOBTXUMXPRFZ-UHFFFAOYSA-N 387.483 5.190 30 20 GKED N#Cc1c(NC(=O)c2ccc(CSc3ccccc3)cc2)sc2c1CCC2 602754912 PVCILEJWHWGGST-UHFFFAOYSA-N 390.533 5.653 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604459681 CHPMFIQUVDUIJG-INIZCTEOSA-N 389.430 5.237 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc2occc2s1 609855137 IXJPRNYYSOCSEW-UHFFFAOYSA-N 375.409 5.114 30 20 GKED Cc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1Br 611093209 JWCIAGDOGYPZQT-UHFFFAOYSA-N 384.060 5.188 30 20 GKED N#Cc1ccsc1NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 611966904 FYLPZBPOFMNRHH-UHFFFAOYSA-N 388.370 5.683 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(-c3ccc(Cl)cc3Cl)no2)cc1 618417230 XQZHVODEPPTGMA-QGZVFWFLSA-N 385.254 5.257 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)C1 665430467 NNUWYSZEVLQWMU-QGZVFWFLSA-N 378.476 5.151 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(CC2CCC(OC)CC2)no1 685351359 RZOOWEOOEFNGND-UHFFFAOYSA-N 396.409 5.068 30 20 GKED CC[C@H](C)Sc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c(C)c1 726487602 GTWJVBZNCFUASI-ZDUSSCGKSA-N 389.977 6.220 30 20 GKED CC(C)[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1cccc(C(F)(F)F)c1 726694697 HNZXNWPIXJPTOR-GOSISDBHSA-N 391.393 5.127 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1cccc(OCc2ccccc2)c1 728439939 HRHDUTGXWIHHBG-ZHACJKMWSA-N 387.266 5.202 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccccc1OC(F)F 728695436 XEGGHRBJXJEKFC-KTKRTIGZSA-N 375.371 5.447 30 20 GKED C[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 734080691 ZTYLVGLPHUHYKZ-FZMZJTMJSA-N 380.435 5.708 30 20 GKED COc1cc(/C=C\C(=O)c2cc3cccc(OC)c3o2)c(SC)cc1OC 741165060 FKLFFKTXSKOBTM-HJWRWDBZSA-N 384.453 5.077 30 20 GKED C#CCCCNC(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 743205687 PNIOMCHGSXRNFY-UHFFFAOYSA-N 392.478 5.267 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 743448818 BQVPWBFIEABXGI-QGZVFWFLSA-N 389.282 5.009 30 20 GKED N#CCc1cccc(C(=O)O[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c1 746438325 WDTGLYOACOVQSC-HNNXBMFYSA-N 387.279 5.232 30 20 GKED CC[C@H](C#N)Oc1cc(CNC/C(C)=C\c2ccc(Cl)cc2)ccc1OC 753852687 FFLWFATTXBNWDY-TUOAVLBBSA-N 384.907 5.223 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 757943729 UASUBLCUNRYMDR-UHFFFAOYSA-N 387.936 5.726 30 20 GKED C[C@@]1(c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCCO1 763339183 MDUPBVJYABBXHZ-FQEVSTJZSA-N 381.819 5.080 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 765521342 RWBMAVQHKFPXGE-UHFFFAOYSA-N 377.872 5.337 30 20 GKED COc1ccc(NCc2ccc(C#N)c(C)c2)cc1NC(=O)C1CCCCC1 767685919 LVUXJYFKGWJWNC-UHFFFAOYSA-N 377.488 5.006 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3oc(C)c(C)c3c2)c1 775884636 PJPIFTBFUAWWCR-GOSISDBHSA-N 377.444 5.052 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)Nc3ccccc3O[C@H](C)C#N)cs2)cc1 780163472 AYPGSNNGCVDKJL-OAHLLOKOSA-N 391.496 5.477 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C\C(=O)c1cccc(N2CCOC2=O)c1 781110084 FDNNMAYNIVVPDA-SEYXRHQNSA-N 399.446 5.215 30 20 GKED C=CCC[C@H](NC(=O)NC(C)(C)C1CCOCC1)c1ccc(C(F)(F)F)cc1 787296323 QZFBCTLWXGZSMN-SFHVURJKSA-N 398.469 5.217 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@H](C#N)c2nc3cccc(C)c3[nH]2)c1 789430930 OLNDSYWQUFVMAK-BEFAXECRSA-N 375.472 5.030 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2 789887882 GJXTYHMTBJNLKX-CYFREDJKSA-N 398.547 5.124 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2csc(-c3ccc(Cl)cc3)n2)cc1 792924686 OIHOKASNJXGLEW-QXMHVHEDSA-N 396.899 5.061 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C 793118696 VIXIOPRBURMKRD-NVXWUHKLSA-N 399.416 5.037 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(F)(F)F 796636179 YGOKSQVJACVOOS-LBPRGKRZSA-N 386.826 5.618 30 20 GKED C[C@@H](Cn1ccc2ccccc21)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 796809462 AJTDZBMYDUCAIE-XJKSGUPXSA-N 393.899 5.417 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCC(C)(C)CCC#N 798878622 GKIMZJMEKMGDKH-CYBMUJFWSA-N 376.909 5.242 30 20 GKED CC(=NNc1nccnc1C1CCC1)c1sc(-c2ccc(F)cc2)nc1C 814931976 JDSZGCOBGOHIBX-UHFFFAOYSA-N 381.480 5.151 30 20 GKED CC1(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCOCC1 835067899 KTMVKUZIWLZAPK-WLMCBFPDSA-N 386.904 5.013 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC[C@@H](O)CC(C)(C)C#N)cc3C2)cc1 857242368 BGANFYAPIPYWDM-QHCPKHFHSA-N 377.532 5.043 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccncc2)cc1 915352437 IIDZKDRCUQHFJR-XZOQPEGZSA-N 382.467 5.106 30 20 GKED Sc1nnc(SCc2ccccc2)n1N=Cc1ccc(Cl)c(Cl)c1 916368565 HKFNLOQALUIEKL-UHFFFAOYSA-N 395.340 5.048 30 20 GKED CCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 916907611 ZDLGDWPLPGPOKF-FQEVSTJZSA-N 384.435 5.002 30 20 GKED COc1cc(/C=C\C(=O)c2cccs2)cc(Br)c1OC(F)F 917143070 AAVIYNZUXYTQLJ-PLNGDYQASA-N 389.217 5.017 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)ccc1F 1776062167 HRVFUWFAPKCZEU-CQSZACIVSA-N 380.341 5.278 30 20 GKED C[C@H]1C(=NNc2c(Cl)cccc2Br)CC[C@H](C(=O)O)C1(C)C 1776083403 DCIREVMGTVXZJE-VHSXEESVSA-N 387.705 5.027 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2c(F)ccc3sc(C(=O)O)cc23)cc1 1776105884 IFDVHUPRLRXIKB-CYBMUJFWSA-N 384.476 5.547 30 20 GKED CCCCc1oc2ccccc2c1/C=C1/CCc2ncc(C(=O)O)cc2C1=O 1776807968 KKGCFIFMFZRTPG-KAMYIIQDSA-N 375.424 5.081 30 20 GKED COc1ccc(/C=C\C(=O)c2csc3ccccc23)c2cc(C(=O)O)oc12 1777361582 UKMQMVVUEXAKCY-VURMDHGXSA-N 378.405 5.250 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cc(F)c(C(=O)O)cc3F)s2)cc1 1777430586 LVOUPCGJOWPSOX-BQYQJAHWSA-N 399.418 5.299 30 20 GKED Cc1cccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(CC#N)cc2)c1 8126527 SLNANPCZGJKKSN-UHFFFAOYSA-N 392.462 5.166 30 20 GKED COc1ccc(-c2cc(NC(=O)c3ccc(C#N)cc3)ccc2OC(F)F)cc1 21797360 PPIFJCMFYMZSDJ-UHFFFAOYSA-N 394.377 5.088 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)C(=O)Nc2ccc(C)c(C)c2)n1 26142513 PYEQSWGMJSEJMU-ZDUSSCGKSA-N 393.434 5.017 30 20 GKED C[C@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 55823509 HXCSYTDLEHXPLY-LJQANCHMSA-N 384.479 5.464 30 20 GKED CC[C@@H](C)n1c(SCCCC#N)nc2sc3c(c2c1=O)CCCCC3 57500845 KQEFSFTYWXSBCO-CYBMUJFWSA-N 375.563 5.094 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1cc2ccccc2o1 57514513 ULVCYRCXPKYSFC-UHFFFAOYSA-N 384.460 5.386 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(-c2nc(C)c(C)o2)c1 63394184 PBVYECJFUAYOFL-UHFFFAOYSA-N 386.455 5.050 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccccc1 158178241 DXTPSKYMHWOIEN-HNNXBMFYSA-N 394.858 5.484 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)cc1 159327056 NHAASAHMJZEZKN-UHFFFAOYSA-N 375.501 5.009 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)S2 189880166 QXJONEJBBDYOPM-CQSZACIVSA-N 380.513 5.224 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@]2(C1)OCc1ccccc12 191451059 OUYSCHBPSKSZAW-XMMPIXPASA-N 376.500 5.202 30 20 GKED CN(CC(F)(F)F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 191874655 SOXNFJAOOGGJEH-OAHLLOKOSA-N 381.785 5.021 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1cccc([N+](=O)[O-])c1 211722642 AOPQUECFGXGQTK-KHPPLWFESA-N 395.846 5.006 30 20 GKED CCOc1ccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2ccccc2)cc1 237113497 TXOQUXNJXHOJNP-DFBJGRDBSA-N 386.495 5.255 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 247063003 BPWVMINZBLPICY-SCTDSRPQSA-N 379.529 5.491 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(Cl)c(/C(O)=N/C2CCC(F)(F)CC2)c1 330549860 WSGOALYLGNUBKN-UHFFFAOYSA-N 386.870 5.597 30 20 GKED C=CCC[C@@H](NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)c1ccccc1 378102732 SEYFHVIBZPQEIW-UXHICEINSA-N 394.519 5.281 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nc(-c2ccco2)nc1SC 410366200 LQDKUBVPYTTYMZ-UHFFFAOYSA-N 379.485 5.138 30 20 GKED CC(C)c1ccc([C@@H](N)CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 415159525 JROAHMVDCCYZIE-APWZRJJASA-N 396.560 5.026 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430597044 YFNPFYFICFITTJ-NSHDSACASA-N 387.555 5.424 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCCC[C@H]2c2ccc(F)cc2F)c1 432839875 AORGIEJGUMFIBJ-QFIPXVFZSA-N 398.453 5.139 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccccc2-c2cn[nH]c2)cc1 439731964 OXXYUSFUPMPATD-UHFFFAOYSA-N 398.397 5.132 30 20 GKED CCc1ncsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 440775468 ACALDJUHHYSGKK-UHFFFAOYSA-N 397.887 5.062 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@@H](CSc2ccccc2)C1)c1ccccc1 458799905 KJAZYSVTXAONCN-DENIHFKCSA-N 393.556 5.245 30 20 GKED N#C[C@@H](C(=O)c1ccc(CCC(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 464472799 PTNGIBKKTJUIQM-CQSZACIVSA-N 386.295 5.085 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc2ccccc12 469041523 QMRIIPDUKMQKLT-GOSISDBHSA-N 383.495 5.596 30 20 GKED C=CC[C@H]1N(C(=O)CCc2ncc(-c3ccccc3Cl)o2)CCCC1(C)C 470303673 OVALHIFCWIOKQH-LJQANCHMSA-N 386.923 5.521 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1ccc(C)cc1)c1ccccn1 472468594 GBHFKFGNIGDXRM-XMMPIXPASA-N 385.511 5.267 30 20 GKED C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N(C)Cc1ccc(C#N)cc1 472767245 HKOGOWACAAKBOA-LBPRGKRZSA-N 387.270 5.108 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2cccc(F)c2o1 474717969 VVUNCKVDKVOTBP-ZIAGYGMSSA-N 397.475 5.849 30 20 GKED C[C@H](Nc1cc(C#N)ccc1C(F)(F)F)c1nc2ccccc2n1C(F)F 475448303 WKZAOXKESJNXAR-JTQLQIEISA-N 380.320 5.495 30 20 GKED C[C@H](Nc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1)c1ccccc1 475469436 IWIXUYGAAXKTOZ-UGKGYDQZSA-N 383.495 5.886 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(SC)c(Cl)c2)cc1 475970558 DKXMARGATSAXSA-UHFFFAOYSA-N 390.896 5.013 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)s1 478629852 HQJFYLWZLQZAMU-HNNXBMFYSA-N 381.526 5.497 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C(F)(F)F)c1ccc(C#N)cc1 479226047 ZMTZRIOVPRJEJR-LLVKDONJSA-N 383.211 5.190 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC(Nc2cccc(C)c2)CC1)c1ccc(F)c(F)c1 483312790 IRKUTOHLIQHUKQ-QFIPXVFZSA-N 399.485 5.177 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 484981222 REAFABGGXVXUTA-OAHLLOKOSA-N 378.259 5.169 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487322355 GNICWOFIYKYBRJ-JXFKEZNVSA-N 388.433 5.435 30 20 GKED CCc1cc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)o1 487354649 KSQJAXSSWDANEC-UHFFFAOYSA-N 376.412 5.075 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(CSC2CCCCC2)c1 494136998 NJJXYCRSULZJQM-UHFFFAOYSA-N 397.544 5.793 30 20 GKED C[C@@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(Oc2ccccc2)c(F)c1 503987052 MPXZMUJZGKLIPD-MRXNPFEDSA-N 381.451 5.014 30 20 GKED C=C(C)[C@H](NC(=O)C[C@H](c1cccs1)n1cccc1)c1ccc(F)c(F)c1 505965483 VDNPEIANROGUOD-NQIIRXRSSA-N 386.467 5.241 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC[C@H]2CCCCO2)cc1Cl 506365835 XSUYVGSNROSRSL-QUCCMNQESA-N 397.906 5.076 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2Oc2ccncc2)cc1C(F)(F)F 510057806 SXBURYVJAVDXOD-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC(C)[C@@H](C)N(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 510892963 IRGFQAVBPBILLJ-OAHLLOKOSA-N 390.405 5.400 30 20 GKED C[C@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1F 512617992 HHLQSZAKHQSSDC-INIZCTEOSA-N 379.479 5.067 30 20 GKED C=CCn1c(S[C@H](C)c2ccccc2Br)nnc1-c1ccco1 513329454 NFVUITFCKOUAES-GFCCVEGCSA-N 390.306 5.340 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1cccc2cccnc12 518130740 XTZMDBMTQMQDLH-HNNXBMFYSA-N 393.537 5.360 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1 519027661 YTCMJRZIPXFSDQ-UHFFFAOYSA-N 386.451 5.528 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc2ccccc2n1 521720091 MDSFMFTYXVOTIG-OAHLLOKOSA-N 393.537 5.360 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)c1C#N 524962710 NQYZNHLWPCPKCY-ZIAGYGMSSA-N 394.418 5.131 30 20 GKED COc1ccc(CNCc2ccc(-c3ccccc3)s2)cc1OCCCC#N 527734542 JWUZAHAVGSBPCU-UHFFFAOYSA-N 392.524 5.396 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(OCc2ccccc2Cl)cc1)C1CC1 532810432 CJKLYHNSYQPWGV-HNNXBMFYSA-N 383.879 5.075 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 538320273 KNQLPVSKBVVSTR-GOSISDBHSA-N 382.788 5.610 30 20 GKED FC(F)Oc1ccc(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)cc1Cl 538737543 LNNMJCYWUIPOQY-UHFFFAOYSA-N 397.693 5.258 30 20 GKED CCN(C(=O)c1cc2cc(C)cc(Br)c2o1)c1ccc(C#N)cc1 542931930 JJFDJGJEXJVCMN-UHFFFAOYSA-N 383.245 5.042 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccc(F)cc2)c2cccnc2)cc1 543424234 OOTIHROMURUBCV-SANMLTNESA-N 393.465 5.639 30 20 GKED C[C@](NC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)(c1ccc(F)cc1)C(F)(F)F 543797221 UONJNEFGZWGTFM-HCKVZZMMSA-N 385.323 5.088 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 553754518 OBOSXHHPUAJVLD-UHFFFAOYSA-N 378.444 5.076 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 556815818 RFCYVNKJXIAGQJ-UHFFFAOYSA-N 399.237 5.008 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCn3c(cc4c(Cl)cccc43)C2)cc1 559847546 HJGKVLJTMDGKTO-UHFFFAOYSA-N 392.890 5.144 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ncc(-c4cccnc4)s3)c2)cc1 561015660 AIAYVXZHAUBFIE-UHFFFAOYSA-N 397.463 5.073 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 561828355 QKOSSXAOBVSEAN-INIZCTEOSA-N 387.439 5.175 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)[C@@H]1c1ccccc1 604362117 JTXRQPCFXHEVEE-JOCHJYFZSA-N 398.466 5.361 30 20 GKED C=CCn1c(SCc2ccc(Oc3ccccc3F)c(F)c2)nnc1C1CC1 605446528 VEQFYHHYOMRXJE-UHFFFAOYSA-N 399.466 5.704 30 20 GKED Fc1cc2ncc(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)nc2cc1F 605568742 UBRYMNROEXULIH-BRPSZJMVSA-N 399.285 5.229 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(C(F)F)cc1 609061218 VZXPWPWVPMLTPK-UHFFFAOYSA-N 392.405 5.636 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)CCc1ccc(C#N)cc1 609066432 FXVSVPVFGVQSKV-LJQANCHMSA-N 384.479 5.578 30 20 GKED N#CCn1c(C(=O)N(Cc2ccc3ccccc3c2)C2CC2)cc2ccccc21 609166581 GWXDGMISLMLEMV-UHFFFAOYSA-N 379.463 5.123 30 20 GKED CSc1ccsc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 609323877 BFTGKKGSWMIUEJ-NSHDSACASA-N 390.599 5.806 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1NCc1ccnc(Oc2ccccc2)c1 609570829 PBLBJRCADJSOSU-UHFFFAOYSA-N 388.377 5.184 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CC/C=C/c3ccccc3)c2)cc1 609968662 XSXQHEBUNSOODN-RUDMXATFSA-N 396.490 5.764 30 20 GKED C[C@@H](NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1)c1cccc(C#N)c1 610664084 OWOIVQABDCEBAC-QZTJIDSGSA-N 383.495 5.708 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(OC2CCCC2)c1 615496155 OBXIVUACMOOUKI-UHFFFAOYSA-N 380.488 5.237 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(Br)cc1C(F)(F)F 619431076 VKGXFQMOUBQBKL-KRWDZBQOSA-N 395.222 5.117 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2ccccc2)nc2c1cnn2C(C)C 620313974 MHYCVXQOUZUPSN-KDURUIRLSA-N 386.499 5.002 30 20 GKED C[C@H](CC(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)C(F)(F)F 626405021 VOKSCNGOCGXUPA-HQJQHLMTSA-N 381.238 5.014 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)o2)c(C)c1 647377482 NIMFXQMAHTZFIC-QGZVFWFLSA-N 392.480 5.299 30 20 GKED CC(C)c1ccoc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 671278905 JPXWDUUPCHDVLF-GFCCVEGCSA-N 378.375 5.522 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@H](c2nc3ccccc3o2)C1)c1ccccc1 676423299 NOVBZANQDASAJV-VQTJNVASSA-N 389.499 5.424 30 20 GKED Fc1ccc2ccnc(NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)c2c1 678310179 ALQXXLRLBLKLGD-QWRGUYRKSA-N 380.307 5.695 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(O)c(Cl)c3)s2)cc1 727975984 ZOHYVEDZQHVJGX-WMZJFQQLSA-N 385.872 5.382 30 20 GKED Cc1cc(/C=C2\SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)ccc1F 729688025 RPFXMNRQNQULNY-APSNUPSMSA-N 388.876 5.065 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C/C(=O)c2cccc(N3CCOC3=O)c2)o1 734304827 XODKJWQDSAYCOY-RMKNXTFCSA-N 391.398 5.247 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)c1ccncc1 734461205 XCDJWWRHQKZARD-NRFANRHFSA-N 380.850 5.588 30 20 GKED C[C@@H](NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccs1 739438564 ZPXDABQJPCPALS-CYBMUJFWSA-N 383.567 5.074 30 20 GKED N#Cc1ccc(F)c(CNCc2ccc(-c3ccc(Cl)c(Cl)c3)o2)c1 742381928 SRICCHUYXPHRLD-UHFFFAOYSA-N 375.230 5.554 30 20 GKED CCc1nc(C)c(C(C)=NNc2nc3cc(C(F)(F)F)ccc3s2)s1 743444947 ZTVJZKZCUZIXET-UHFFFAOYSA-N 384.452 5.479 30 20 GKED O=C(C=C1CCC1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 756225707 VEDBYCQDKKGQNO-UHFFFAOYSA-N 376.506 5.717 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C 757867204 RRSSBBKMYYHKQL-OAQYLSRUSA-N 395.503 5.157 30 20 GKED Cn1nc(C(F)(F)F)c(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)c1Cl 758932105 RCOVIDUOLMECGG-VOTSOKGWSA-N 391.780 5.050 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1 764192482 MCYQDCNKEPPKPJ-SFHVURJKSA-N 391.814 5.156 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cncc4ccccc34)n2)cc1 765591041 QTXVILUIZSXYDY-NRFANRHFSA-N 397.503 5.476 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccc3[nH]ccc3c2)cc1 765622481 CNXSNSXALZALGR-UJVXJIJDSA-N 377.447 5.475 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1O[C@@H](C)C#N 766596828 MMFXHYIDGMAUFZ-XSNHNAGMSA-N 375.255 5.326 30 20 GKED CCOC(=O)N(C)c1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1 770405316 AFQNWPMQXXBKNA-UHFFFAOYSA-N 377.488 5.095 30 20 GKED C=CC[C@@H](NC(=O)c1ccc2cc(Br)ccc2c1)c1ccncc1 773057878 DGNXOLHYEHVDRV-LJQANCHMSA-N 381.273 5.045 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@@H](CC(F)(F)F)c1ccc(F)cc1 775201891 HVDFDBIMJKBYSM-INIZCTEOSA-N 386.776 5.165 30 20 GKED N#C[C@H](C(=O)[C@@H](F)Cc1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 778295883 XIJNYPXAPPAITL-KGLIPLIRSA-N 392.377 5.072 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1cc(Cl)ccc1Cl 779215352 MCXRXJBWVDBYLV-MRVPVSSYSA-N 388.081 5.663 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1 793388739 IHIRVGQRNQBGKL-IBGZPJMESA-N 386.417 5.484 30 20 GKED C=CCCC[C@@H](C)Sc1nnc([C@H]2CCCN(C(=O)OC(C)(C)C)C2)o1 795257905 HNPBWDRVDYJLEP-CABCVRRESA-N 381.542 5.021 30 20 GKED CCCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797567077 CWXWRIHLYPMINL-QGZVFWFLSA-N 382.529 5.232 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C\Sc1cc(F)ccc1F 797865836 FWRSHBXAZVMWQI-LJTDUEICSA-N 390.480 5.461 30 20 GKED O=C1/C(=C/c2cc(Cl)cc(C(F)(F)F)c2)C[C@@H](C(=O)O)c2ccccc21 806560421 LPGFCWWTDLOYLL-QHQPLOKBSA-N 380.749 5.197 30 20 GKED COc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Cn1cccn1 815635885 LJCOFXRTXVMFSK-XXBNENTESA-N 388.515 5.026 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(-c2cccc3ccccc23)no1 818285842 DUZGBXHNRKZXHL-GOSISDBHSA-N 392.459 5.149 30 20 GKED CC(C)(CCC#N)CN[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](c2ccccc2)C1 824395694 IZGCYDDZVNYWPB-WOJBJXKFSA-N 385.552 5.047 30 20 GKED CC(C)CN(Cc1ccc(F)c(Cl)c1)C(=S)Nc1ccccc1C#N 863206720 JLCTUUVMPIQDPC-UHFFFAOYSA-N 375.900 5.206 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 915353827 YCAPQEQZAKNXJL-BJKOFHAPSA-N 383.495 5.861 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1 915999149 HPKFEBZXXRGUOV-XMMPIXPASA-N 393.515 6.304 30 20 GKED Cc1ccc(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 916134552 YHPUHENMSXBIHU-YPKPFQOOSA-N 379.463 5.198 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 916908714 NUOFBTLITFNQIJ-NRFANRHFSA-N 398.462 5.068 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917026589 IJBTWZVTMUYRGB-VQIMIIECSA-N 390.508 5.579 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)/C=C/c1ccc(C(C)(C)C)cc1 920106472 PJRBLMUMAFKLSJ-IXDOJHRFSA-N 384.479 5.379 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCCSCC2)c1 920873785 SCNHBZSUICHCAK-UHFFFAOYSA-N 378.582 5.535 30 20 GKED CC[C@H](NN=C(CC1CCCC1)c1ccc(Oc2ccccc2)cc1)C(=O)O 1776065944 QUMUGVSXRMYMPV-NRFANRHFSA-N 380.488 5.216 30 20 GKED CC(/C=C\C(=O)c1cccc(OCC(=O)O)c1)=C/c1ccccc1C(F)(F)F 1776398872 MKHKZNWIIXAOTR-WEJYHURQSA-N 390.357 5.011 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2F)cc1)c1ccccc1 1776469373 BFAHDVLECDOPLZ-IRVMHKCDSA-N 390.410 5.560 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(-c2ccccc2)nn(C)c1Cl 1776783306 OFVBOHASUUMCQA-QGZVFWFLSA-N 391.943 5.034 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@H]2Cc3ccc(C(=O)O)cc3C2)cc1 1776785984 VNDPZHIUGXGPAW-QHCPKHFHSA-N 393.527 5.185 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)C2CCCCC2)c1 1776787674 NCSOYXZATDLDCZ-QFIPXVFZSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC2CCCCC2)C(=O)O)cc1 1776788458 RXGDLYOTFBQERX-JOCHJYFZSA-N 375.553 5.549 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(OCC(=O)O)c(Cl)c2)oc2ccccc12 1776956371 WLNHKBAJLHOEIN-CLFYSBASSA-N 384.815 5.008 30 20 GKED C[C@@H](C#N)Sc1nc2scc(-c3cccs3)c2c(=O)n1-c1ccccc1 5583250 LCVOZNZSTYNWKE-LBPRGKRZSA-N 395.534 5.180 30 20 GKED CCN(CC)c1ccc(/C=C2\S/C(=N\c3c(C)cccc3C)NC2=O)cc1 7165021 SCOZKHAFPKSPDR-RGEXLXHISA-N 379.529 5.041 30 20 GKED CCCCN/C(S)=C(/C(=O)c1sc2ccccc2c1C)[n+]1ccc(C)cc1 27322256 MOQWQTORQPSMOU-UHFFFAOYSA-O 397.589 5.134 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1SC1CCCC1 63391064 NNFDNLRVVPRQCR-UHFFFAOYSA-N 391.540 5.813 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4cnco4)cc3)cc2)cc1 66037264 RNBYZOUUWDHTRN-UHFFFAOYSA-N 381.391 5.258 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 66953942 BABHABUMMQQMCU-HUUCEWRRSA-N 387.936 5.959 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc(F)cc1F 66954221 MDQAERLASLBWPT-QWHCGFSZSA-N 375.444 5.242 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 69203081 MOALHUYHPFEPOC-JOCHJYFZSA-N 386.455 5.058 30 20 GKED Cc1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)ccc1Oc1cccnc1 119861652 TWZGUZXZSGLZMA-OAQYLSRUSA-N 386.455 5.349 30 20 GKED COC1CCC(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 136726897 ZNAPXVFVXALPKD-QWFMPGPPSA-N 388.920 5.235 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 151290593 SPLAVRRLSSLMQI-RDJZCZTQSA-N 378.501 5.044 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C3CCC(F)(F)CC3)c2)cc1 155197777 YVDGTSVGPWCSDL-UHFFFAOYSA-N 384.426 5.096 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](c1ccccc1)c1nccs1)c1ccccc1 160510822 ZWWRBEBOFWTSDC-WOJBJXKFSA-N 377.513 5.239 30 20 GKED Cc1ncccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 178317684 SUXOMMJTJCFWEZ-CQSZACIVSA-N 388.279 5.310 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 184329986 WBXJKNKUHBJAHT-SPEDKVCISA-N 377.488 5.291 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)s1 187157678 WLFFUVVFIIKOEQ-CQSZACIVSA-N 393.468 5.075 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)OC2(CCCC2)C1 189967002 QDZVJZPQKHTNQD-INIZCTEOSA-N 387.549 5.036 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)C[C@H](O)c1ccc(F)cc1 191517149 FETZLRMJZNMFHB-KKSFZXQISA-N 384.495 5.311 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(F)c(-c3cccs3)c2)c1 237022706 UFGSMKXLABZENF-SFHVURJKSA-N 380.488 5.525 30 20 GKED Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 247022686 DJSAKHNFLBWTEP-WIYYLYMNSA-N 393.556 5.022 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 303232816 YJFXMFDCPWPGIV-LJQANCHMSA-N 399.494 5.637 30 20 GKED C[C@@H]1CC[C@@H](c2ccccc2)N(C(O)=Nc2nc(C3CCOCC3)cs2)C1 329460468 SCIZEFGJWCNTDF-BEFAXECRSA-N 385.533 5.056 30 20 GKED COc1ccc(N=C(O)C2(/N=C(/O)[C@@H]3CC34CCCC4)CCCC2)cc1OC 329969308 UKQGMGKBPBPCOX-INIZCTEOSA-N 386.492 5.141 30 20 GKED C[C@H]1CCCC[C@@H]1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 409796082 RQVWAFLECXJALJ-AZUAARDMSA-N 391.515 5.279 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](CC(F)F)c1ccccc1 421066318 PQQPQAOGOJMVCF-WMLDXEAASA-N 389.471 5.456 30 20 GKED C=C(C)C(C)(C)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 424816360 ZQYJYKLFORYQEN-MRXNPFEDSA-N 384.545 5.127 30 20 GKED O=C(NC1(c2cccc(C(F)(F)F)c2)CC1)c1ccc(F)cc1C(F)(F)F 429201821 DSINJYNDNBKAFD-UHFFFAOYSA-N 391.286 5.282 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Oc3ccccc3)nc2)s1 430630873 ZHPWULIUGGTVGR-INIZCTEOSA-N 377.469 5.118 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 432794002 SMAQVPZOMJYSFJ-UHFFFAOYSA-N 382.467 5.125 30 20 GKED Cc1cc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)ccc1Br 437658012 WXAPFVDFSPSIJF-HKUYNNGSSA-N 398.304 5.061 30 20 GKED CCOc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1Cl 437756848 IWWGXPIUROHMKR-HKUYNNGSSA-N 383.879 5.042 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@H]3Cc3ccccc3)c2)cc1 443937198 MKZJISNXVHIOKG-NRFANRHFSA-N 383.451 5.199 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 446514898 OMBRWAPXGPHNLD-UHFFFAOYSA-N 399.450 5.051 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCc2c1ccc(F)c2Br)c1ccccc1 449339459 KOLPQBBZFVTPDF-RTBURBONSA-N 387.296 5.600 30 20 GKED COCC[C@@H](NCc1ccccc1C(C)(C)C#N)c1cccc(C(F)(F)F)c1 451696077 RPIFUDULCLIXRB-HXUWFJFHSA-N 390.449 5.374 30 20 GKED C[C@@H]1CCN(C(=O)Nc2cccc(CC#N)c2)[C@@H]1c1ccc(C(F)(F)F)cc1 455907123 OVGXLAASRDTOSJ-KUHUBIRLSA-N 387.405 5.386 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 456070147 ZQIHQIJJWROKPC-MRXNPFEDSA-N 393.453 5.348 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CCCc2c(F)cc(F)cc21)c1ccccc1 458835170 JVZOPCSPFYNCSZ-NHCUHLMSSA-N 383.442 5.077 30 20 GKED N#C[C@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 464465188 FXJWFDXEAGYRFY-IBGZPJMESA-N 396.368 5.169 30 20 GKED CCOc1c(Cl)cc(NC(=O)c2cccc(SCC#N)c2)cc1Cl 466302481 GZVGHBGVDKUJKG-UHFFFAOYSA-N 381.284 5.260 30 20 GKED N#CCSCCCSc1ncnc2scc(-c3ccc(F)cc3)c12 466612246 UJHUARCZJDKVIO-UHFFFAOYSA-N 375.519 5.236 30 20 GKED CCC1(CC)CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CCS1 467340246 FFCKMUUDFICSIZ-HNNXBMFYSA-N 377.579 5.078 30 20 GKED CC(C)c1nc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 469795521 FDPYDOFUUKZGCY-DLBZAZTESA-N 375.541 6.217 30 20 GKED C[C@H](Nc1ccc(NC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)cc1)c1ccccc1 471947495 SAIYKSRLLQACAG-PGRDOPGGSA-N 394.478 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(/C=C\C)cc1OC 476117571 JHZKLRSHJCAZRF-TWGQIWQCSA-N 379.500 5.598 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Sc1ccc(NC(C)=O)cc1 476125434 AFWIMBIALJJYIU-MRXNPFEDSA-N 396.556 5.616 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)cc1 477709070 YGNYVUXSGNLLBV-UHFFFAOYSA-N 387.386 5.147 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H]2C2CCC2)cc1 480400044 ADIMMVGYQKZTBB-FQEVSTJZSA-N 391.471 5.156 30 20 GKED COc1cccc(Oc2ncccc2CN[C@H]2CCCCc3cc(C#N)ccc32)c1 481664167 XYDCKSLQCBITAY-DEOSSOPVSA-N 399.494 5.311 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(Oc2cccnc2)c(F)c1 481919159 JMVQBWLQNKGIDW-QHCPKHFHSA-N 387.458 5.442 30 20 GKED CCCN(Cc1ccc(OC)c(OCCCC#N)c1)[C@@H]1CCCc2cccnc21 482277086 UDGWHBZKGJZSPJ-OAQYLSRUSA-N 393.531 5.062 30 20 GKED N#C[C@H](C(=O)c1ccccc1COc1ccccc1)c1nccc2ccccc12 483234689 MKLKJNGBAZOHSQ-QHCPKHFHSA-N 378.431 5.304 30 20 GKED C[C@H](Nc1c(C#N)cnc2c(F)cc(F)cc12)c1cccc(OC(F)F)c1 488177248 LHQWUFAWVFBIJC-JTQLQIEISA-N 375.325 5.159 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1ccc(C(F)(F)F)c(F)c1 488392332 BOGMLXWPJYKZEV-UHFFFAOYSA-N 383.307 5.230 30 20 GKED CC(C)CN(C(=O)c1csc(-c2cccc(Cl)c2)n1)c1ccc(C#N)cc1 499328977 PPSMRRBNARJXEO-UHFFFAOYSA-N 395.915 5.638 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)CCc2c(C)nn(CCC#N)c2C)c(C)c1 499786592 PLQBSUYQVHSKJM-INIZCTEOSA-N 398.576 5.184 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)Sc2nc3cc(C)ccc3o2)c1 504570545 LAGKNZRYRUQEAW-KRWDZBQOSA-N 393.512 5.181 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1nc(-c2ccccc2)cs1 504775156 MFMDUQYRDZKPKJ-UHFFFAOYSA-N 385.448 5.122 30 20 GKED COc1cc(C)c([C@H](C)NC2CCC(C#N)(c3ccccc3)CC2)cc1OC 507650973 CDNCFEFYLYKJRV-ZGIGLSJSSA-N 378.516 5.067 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1 516368208 RKSYZHRLEBLTHQ-UHFFFAOYSA-N 395.384 5.441 30 20 GKED CCSCc1ccc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 521769708 SVQJTLMTKQSWKN-MRXNPFEDSA-N 379.312 5.241 30 20 GKED C[C@@H](C#N)C(=O)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 522984730 JERUUZZRXZNVGZ-AVRDEDQJSA-N 393.490 5.243 30 20 GKED CCN(C(=O)c1ccc(CC#N)cc1)[C@H](c1ccc(Cl)cc1)c1ccccn1 535397586 DEHFSNGDLVODBV-JOCHJYFZSA-N 389.886 5.053 30 20 GKED C=C[C@@H](CC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1)c1ccccc1 536246199 XYAHAEMXZJIPJP-IBGZPJMESA-N 394.584 5.196 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccccc1F 536380205 YSXRPIJWLQKVBN-UHFFFAOYSA-N 380.806 5.420 30 20 GKED COc1cccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)c1 537295820 RASBATJCHSUEFG-QMHKHESXSA-N 376.887 5.660 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](C)c1ccc(C#N)c(F)c1 538508573 TVLAUEIMRMHCKL-CHWSQXEVSA-N 383.467 5.680 30 20 GKED C[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 558063504 INGJTLBKRYWDJD-LJQANCHMSA-N 384.479 5.149 30 20 GKED CC(C)c1ccoc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 567480373 KMLYZKQLGHYBCH-LJQANCHMSA-N 378.859 5.964 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N1CCC(CCC#N)CC1 581550047 MWXRKVCQKFMGAY-UHFFFAOYSA-N 392.286 5.113 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)cc2)ccn1 583175127 LCMMMOYUXKRLQB-LEWJYISDSA-N 389.842 5.141 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H](c4ccccc4)C3)cn2)c1 590106674 IWFYPUHIONXCMQ-HXUWFJFHSA-N 398.466 5.157 30 20 GKED N#CC1(Cc2nc(-c3ccc(Oc4ccc(F)c(Cl)c4)c(F)c3)no2)CC1 590270859 AHLYPMNPCUEMOJ-UHFFFAOYSA-N 387.773 5.307 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2)n1)c1nc2cc(F)ccc2s1 592973777 KPIAVQAATLGYDT-CYBMUJFWSA-N 379.441 5.049 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCC[C@]1(C)CC1(F)F 596724861 XWDGFGDOLWNRBK-OAQYLSRUSA-N 399.441 5.003 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)CCCc3nc4ccccc4s3)c2C#N)C1 602755061 SWULWQMLTFNKLX-CYBMUJFWSA-N 395.553 5.316 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3occc3-c3ccccc3)cn2)c1 603626622 FQFDVGGZFSWHCT-UHFFFAOYSA-N 381.391 5.258 30 20 GKED C=CCCCN(C)C(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 605645545 VPXYWOWNTHAZAE-UHFFFAOYSA-N 381.863 5.095 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccccc2)n1 609427628 UMVYGQBEWWXQKE-CQSZACIVSA-N 379.510 5.457 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(Cl)c(C#N)c3)cc2)cc1 609498947 YFVCSBYFCMGNTN-UHFFFAOYSA-N 387.826 5.322 30 20 GKED COc1cc(COc2c(F)cccc2F)ccc1OCc1cccc(C#N)c1 609721941 HPFWTIFQRZCCDK-UHFFFAOYSA-N 381.378 5.003 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N(C)Cc1cccc(C#N)c1 609936588 PGTITDZGBNJMOW-NRFANRHFSA-N 389.524 5.054 30 20 GKED Cc1ccc(C(=O)N[C@H](C)c2cccc(C#N)c2)cc1NC(=O)Nc1ccccc1 610359351 IWIHERCODIOHDQ-QGZVFWFLSA-N 398.466 5.002 30 20 GKED C[C@@H](CC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)c1ccncc1 610723013 CRKXLWRDLNIQNI-KRWDZBQOSA-N 389.886 5.334 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646437073 IQRRFHICUGWBQF-UHFFFAOYSA-N 384.295 5.182 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1(C(F)(F)F)CCCC1 666820806 CJCJOXTYKXZRRR-RKDXNWHRSA-N 399.297 5.135 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)c3ccc(C)cc3)n2)cc1 728770200 QQGXYGVXWKWTLW-LJQANCHMSA-N 390.508 5.281 30 20 GKED N#Cc1cccc(C(=O)O[C@H](CC(F)(F)F)c2ccc(Br)cc2)c1 731993161 CJXVMIFOBYZKAW-OAHLLOKOSA-N 398.178 5.171 30 20 GKED CCOc1cc(/C=C\C(=O)c2sccc2C)cc(Br)c1OC 733749059 BIBQFAORODQITC-WAYWQWQTSA-N 381.291 5.122 30 20 GKED CCOC(=O)Cc1ccc(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)cc1 734305485 ALXIOBCFVHROSH-SEYXRHQNSA-N 391.492 5.120 30 20 GKED N#Cc1ccc(C(=O)Oc2ccc(-c3nc4cc(Cl)ccc4s3)cc2)cn1 734706814 YTMWZXDETCWROG-UHFFFAOYSA-N 391.839 5.103 30 20 GKED CCSCC[C@@H](C)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743092809 DQCKZNQZFDCIES-DYESRHJHSA-N 381.545 5.337 30 20 GKED CS[C@@H]1CC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 743103450 BOGLERDFAPNVDF-WDYCEAGBSA-N 399.947 5.401 30 20 GKED CO[C@]1(C)C[C@H](N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1(C)C 752635775 HMESYEVEDMQVIO-AWRGLXIESA-N 391.515 5.009 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1cnc([C@@H]2CCCO2)s1 755588515 COKHDLAQKMVDDY-NRFANRHFSA-N 377.513 5.031 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C[C@@H](O)c3ccc(C#N)cc3)s2)cc1 763412460 XXLYCOVZEQXNDB-LAUBAEHRSA-N 391.540 5.025 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccccc2CN2CCc3ccccc32)cc1 770528388 JFCXZCHEYJGPRP-IBGZPJMESA-N 383.495 5.152 30 20 GKED N#C[C@H](C(=O)CN(Cc1ccccc1)c1ccccc1)c1nc2ccccc2s1 772636215 DZTIXRDFEPCIMT-HXUWFJFHSA-N 397.503 5.179 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)Cc1ccccc1CC#N 776890625 RYTAAYRTPURBIZ-IBGZPJMESA-N 384.479 5.382 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 780162614 KBFBZOARYCYLSY-BMOGTNHUSA-N 392.455 5.497 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(NCC2CCCC2)cc1 780673090 NMJVDZFEENZECE-MRXNPFEDSA-N 378.476 5.224 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1c[nH]c2ccccc12 786401097 IKIUTVRWMWVTDN-WFASDCNBSA-N 377.444 5.287 30 20 GKED CCCn1c(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc2ccccc21 786929579 LMKBPNZNQOZHQJ-FQEVSTJZSA-N 395.462 5.166 30 20 GKED Cc1c(C#N)c(NC(=O)c2cc(C3CC3)cnc2Cl)n(-c2ccccc2)c1C 796577455 GKQCBDPNLIFWDS-UHFFFAOYSA-N 390.874 5.144 30 20 GKED N#CC[C@H](CC(=O)O[C@H](c1ccc(Cl)cc1)c1cccnc1)c1ccccc1 796691182 KBGRYHFEIYQIOQ-AUSIDOKSSA-N 390.870 5.455 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)C2(c3c(Cl)cccc3Cl)CC2)s1 797570934 MCNYOZNWJQXURB-LLVKDONJSA-N 393.339 5.655 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C2(CCOCc3ccccc3)CC2)s1 797572261 WPDTZSPMWOBFGK-KRWDZBQOSA-N 382.529 5.004 30 20 GKED CC(C)(CCC#N)COC(=O)CCSc1ccnc2cc(Cl)ccc12 798875901 FBXKXGIPNMVEFG-UHFFFAOYSA-N 376.909 5.244 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2cccc(-c3cccnc3)c2)C(=O)c2ccccc21 802708913 XTTKZWJPAXBUIJ-CBIIRDDDSA-N 383.447 5.065 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CN[C@H](CCCC#N)c1ccccc1 814656832 ACIAICDUKRZSLW-OAQYLSRUSA-N 378.907 5.359 30 20 GKED C[C@@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)c1ccc(C#N)o1 816768375 ULBCTPSCZHPMMD-AWEZNQCLSA-N 384.888 5.140 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 862718173 HSYLYBNEBAGPLT-GOSISDBHSA-N 391.512 5.252 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2csc(-c3ccccc3)n2)cc1Cl 916154394 GGXLPLMDTGUYRY-CMDGGOBGSA-N 385.872 5.377 30 20 GKED N#C[C@@H](C(=O)CCCOc1ccccc1F)c1nc2cc(Cl)ccc2s1 918492151 OKYCJEXEUDTFEU-ZDUSSCGKSA-N 388.851 5.124 30 20 GKED C[C@H](NC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1ccc(C#N)cc1 919881394 IVVAXLQIKMOGRL-KRWDZBQOSA-N 395.462 5.110 30 20 GKED Cc1cccc(Cl)c1NN=Cc1cccc(OCc2ccccc2C(=O)O)c1 1776060556 AETXJUPUEXAYQN-UHFFFAOYSA-N 394.858 5.372 30 20 GKED C=CCOc1ccc(CNCCCCCCCCCCCC(=O)O)cc1OC 1776184289 UHPAWQQGHRKWKB-UHFFFAOYSA-N 391.552 5.335 30 20 GKED CC(C)[C@@H]1/C(=C\c2c(F)ccc3sc(C(=O)O)cc23)C(=O)c2ccccc21 1776308580 FJELGCTUKHTWEX-ZYEUVFMNSA-N 380.440 5.758 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cc(C(=O)O)cs2)cc1 1777472322 UXLFYINPHJXDPP-ZHACJKMWSA-N 378.449 5.230 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(F)cc1 7736924 IYUJKNWGGSTJLD-ZDUSSCGKSA-N 384.436 5.032 30 20 GKED COc1ccc(-c2nnc(SCCC#N)n2-c2ccccc2C(C)C)cc1 20969477 WSINHLYJKXRSLU-UHFFFAOYSA-N 378.501 5.072 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccc2F)cc1Cl 46861808 LTLYQPWPPFIUFI-SFHVURJKSA-N 399.252 6.040 30 20 GKED CC(C)Cc1nnc(/N=C(\O)c2cnc(-c3ccccc3Cl)s2)s1 50287536 OQDQSDJYCNJAII-UHFFFAOYSA-N 378.910 5.150 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cccc(F)c2)cs1 54895240 FJIWDZJLALPDKP-JXMROGBWSA-N 384.407 5.002 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1c(F)cccc1Cl 66953965 RQSGWUGRIHMJLZ-ZDUSSCGKSA-N 391.899 5.537 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2CCC(F)(F)F)c1 120613237 KCHDCXRQKALXLQ-UHFFFAOYSA-N 391.393 5.508 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 121581555 ASCRGUBCSQBGGD-HXUWFJFHSA-N 397.931 5.284 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122020655 SGWNBOVYHLRILS-JXFKEZNVSA-N 389.524 5.699 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2F)CC1)c1nc(-c2c(F)cccc2F)cs1 131135423 UBBHNGYSHCSNKO-GFCCVEGCSA-N 398.409 5.135 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(OC(F)F)cc2)ccc1OC(F)F 149525504 UNZYEIRPWPLDGN-YCRREMRBSA-N 384.325 5.184 30 20 GKED N#CCC[C@H](NC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1ccccc1 153664915 KFFTZMFNSRSIHV-IBGZPJMESA-N 393.874 5.089 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](Oc2ccccc2)c2ccccc2)n1 177748826 NBINXRQWRSGYCO-WIYYLYMNSA-N 376.481 5.263 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cccc(Cl)c2Cl)ccc1OC 180815732 USOMLSDADXSDGT-DZGCQCFKSA-N 393.314 5.534 30 20 GKED Cc1sc([C@H](C)NCc2cc(C#N)ccc2F)nc1-c1ccc(Cl)cc1 184946323 HNXXPZCHHFIJSY-LBPRGKRZSA-N 385.895 5.634 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccc(F)c(NC(=O)Cc2ccccc2)c1 187721284 HVNPWEBNPUUASV-UHFFFAOYSA-N 393.849 5.144 30 20 GKED COc1cc(Br)ccc1[C@@H](C)NCc1ccccc1C(C)(C)C#N 190458943 DHWOMXKDVNKKTO-CQSZACIVSA-N 387.321 5.110 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCc1nc2ccccc2s1 301752549 WXOVUONNATVDGV-UHFFFAOYSA-N 376.934 5.159 30 20 GKED OC(CCC1CCOCC1)=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1 329605327 HKZJOTLCOYZCFY-UHFFFAOYSA-N 376.472 5.789 30 20 GKED CCC(=O)c1ccc(OCCCCC(=O)Nc2ccc(Cl)cc2CC#N)cc1 410975479 ZJCZSEOLEBDYCO-UHFFFAOYSA-N 398.890 5.187 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1ccc(C(C)(F)F)nc1)c2C#N 410977235 KPUVQECYPOWNBY-MNOVXSKESA-N 375.444 5.065 30 20 GKED C[C@H]1CCc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c2[C@@H]1C 410988962 UBAVULAXZNAPFF-NWDGAFQWSA-N 397.525 5.203 30 20 GKED CC(C)[C@H]1CCc2c(sc(NC(=O)c3ccoc3C(F)(F)F)c2C#N)C1 411006958 LKGVDERSFDTPOI-JTQLQIEISA-N 382.407 5.245 30 20 GKED CC(C)C[C@@H](C)n1nccc1NC(=O)c1cn(CCCC#N)c2ccccc12 426881023 BWUOPTJDTARPJJ-QGZVFWFLSA-N 377.492 5.001 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H]2CC[C@H](C)C2)cc1 429771883 ZBFIKZOGKYMDIL-MAUKXSAKSA-N 379.460 5.011 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 432008180 UCJHEKFWZBOENE-SFHVURJKSA-N 393.874 5.668 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(F)c2Cl)cc1F 437484222 OBHIBYFAKYTKQZ-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1Cc1ccccc1 437596187 VPWMLSMSLMPTHA-ILBGXUMGSA-N 395.506 5.581 30 20 GKED C[C@H](NC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1 437839611 VACDLCVETDHFEK-ROUUACIJSA-N 383.495 5.708 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)c1C 437981123 BFQLZDYOFBPGDV-SFHVURJKSA-N 385.414 5.146 30 20 GKED Cc1cccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 438649446 MPRSSJCKNJWGGQ-UHFFFAOYSA-N 389.430 5.462 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 443103866 CLYKAJPFFAISGV-UHFFFAOYSA-N 380.806 5.704 30 20 GKED Cc1c(Cl)cccc1-n1c(S[C@H]2CC[C@@H](C#N)C2)nnc1-c1ccncc1 450632224 MHPWFWSHMQVCIF-ZBFHGGJFSA-N 395.919 5.076 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798137 HGBHTJISJJBBMP-HKUYNNGSSA-N 398.576 5.713 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1cccc(OCC(F)(F)F)c1 462204708 AWPUFKBQZMWIOK-UHFFFAOYSA-N 399.372 5.299 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F 463029323 RCNXJJRZYNXOBT-UHFFFAOYSA-N 384.455 5.244 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)c1c(Cl)cccc1Oc1ccccc1Cl 464708615 JEGPKEVGMZPFHM-MRXNPFEDSA-N 377.271 5.454 30 20 GKED C[C@@H](Nc1ccccc1CCC(F)(F)F)C(=O)Nc1ccc(C#N)c(Cl)c1 464792432 PEFBGZABFCUAIS-GFCCVEGCSA-N 395.812 5.146 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 466894559 SSSHIJWZFRBKKA-PGRDOPGGSA-N 397.478 5.154 30 20 GKED C[C@H]1CC[C@@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467466346 JEWXLNKJCXFOAB-GASCZTMLSA-N 383.879 5.195 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H](CC#N)c1ccccc1 474778412 AOICVNCDEMRXHN-LJQANCHMSA-N 396.450 5.080 30 20 GKED Cc1ccccc1-n1ncc(C(=O)[C@H](C#N)c2nccc3ccccc23)c1C(C)C 483191311 DVIQUBRYOLFEIF-HXUWFJFHSA-N 394.478 5.342 30 20 GKED CN(C)C(=O)c1ccc(Cl)c(NCc2ccc(-c3ccccc3C#N)cc2)c1 487342602 GCMPNWYWKRDUCM-UHFFFAOYSA-N 389.886 5.193 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCCOc1ccccc1Cl 496281140 FEXCVTSJZVQKTF-UHFFFAOYSA-N 394.858 5.197 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1ccccc1)c1ccc(F)cc1 505950364 JNHVCLGAFHUXHZ-OAQYLSRUSA-N 380.488 5.374 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c(F)c1 510192309 UBDRFBIOIPEPSU-OAHLLOKOSA-N 391.471 5.187 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc2cc(F)ccc2[nH]1 510284752 YBLGWOFJGMFFHX-UHFFFAOYSA-N 385.398 5.532 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC[C@]3(CC=CCC3)C2)cc1 511788409 ADARPJHGEZVPBJ-XMMPIXPASA-N 390.458 5.452 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 513303845 OPWQBBBSXHKOHR-QHCPKHFHSA-N 392.478 5.610 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)c1 514561816 JUYXOOXFDTUAMI-QHCPKHFHSA-N 386.520 5.212 30 20 GKED N#Cc1ccccc1CSCc1nc(-c2ccc(C(F)(F)F)cc2)no1 515719767 RWJWXSARYMNSPY-UHFFFAOYSA-N 375.375 5.060 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cc(Cl)ccc2O)cc1 518572516 TUWKHEAVSILKDB-UHFFFAOYSA-N 382.778 5.101 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 518668829 OQDUUXKSQODWLS-CQSZACIVSA-N 377.469 5.154 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 520555506 ZGFQOVIFNKYXCB-QGZVFWFLSA-N 388.442 5.094 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 521793585 FRGDPYDRMMQOLP-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1ccc(C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1Oc1ccncc1 522311969 WKADMEIPKNUJFD-UHFFFAOYSA-N 387.439 5.094 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)c2ccc(C#N)cn2)c2cccs2)cc1 522677811 WUXMAJJALPUIQG-YCRPNKLZSA-N 375.497 5.048 30 20 GKED N#Cc1cnc2c(F)ccc(Cl)c2c1N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 528101853 NXEXOZJYHBWYRG-RYUDHWBXSA-N 377.797 5.056 30 20 GKED CC[C@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1S[C@H](C)CC#N 533256244 JHWGTOIUQZHKMJ-WIYYLYMNSA-N 395.572 5.493 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cccc(-c3cccnc3)c2)cc1 536888974 FEOAUUUIGKFVFH-UHFFFAOYSA-N 375.475 5.577 30 20 GKED C[C@@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)C(=O)c1c[nH]c2ncccc12 541089172 KXXJIBVUZNVMOM-IAGOWNOFSA-N 394.478 5.024 30 20 GKED Cc1ccc(C)c(Sc2ccc(NC(=O)N3CCC(CC#N)CC3)cc2)c1 541972992 DAWNBVNIYHLWJK-UHFFFAOYSA-N 379.529 5.612 30 20 GKED N#Cc1cccc(OC2CCN(Cc3ccc(-c4ccccc4C#N)cc3)CC2)c1 552514482 DMKDDAQMKQHQHC-UHFFFAOYSA-N 393.490 5.140 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 554757479 OATCQHCNGHLETM-SFHVURJKSA-N 391.393 5.201 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1nc2cc(Cl)ccc2s1)c1ccccc1 558453929 ZHESORXUZMWSMF-QGZVFWFLSA-N 397.931 5.434 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccccc1Cl 566708049 HTGNTEKGAQDMGH-CQSZACIVSA-N 392.846 5.282 30 20 GKED N#Cc1csc(CNC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)n1 573170213 MRCOIAOORBEPBL-KRWDZBQOSA-N 392.915 5.071 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@H]1CCCOC1 593143690 MIMDYGSQMAPVBS-AZUAARDMSA-N 397.906 5.028 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)C1 596651497 UYNYQMCJUKXLDK-OAHLLOKOSA-N 376.485 5.121 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cn2)cc1 603765690 ZJQBNMKEMWAAEG-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)sc2n1 603834686 VRJPEBJFWTYORE-SNVBAGLBSA-N 381.526 5.223 30 20 GKED CSc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604026705 HGRSORWWACVJNI-UHFFFAOYSA-N 394.883 5.978 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3C[C@H]3c3cccc(Cl)c3)cn2)c1 604510892 KLXMYTDRBLRWFV-PMACEKPBSA-N 389.842 5.141 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cccc(CC#N)c2)cc1Cl)c1ccccc1 604512965 IXJSSOOEBMMDAO-INIZCTEOSA-N 389.886 5.831 30 20 GKED N#C[C@@H](NC(=O)CCCc1cccs1)c1ccc(OCc2ccccc2)cc1 609028579 HDLLTUOQLARHSP-JOCHJYFZSA-N 390.508 5.031 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)c(F)c1 609464279 ZSOYXRNHYPNZNT-XMMPIXPASA-N 399.469 5.287 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)c1nc(-c2ccccc2OCc2ccccc2)no1 609475642 QLNSRIODLMGHAX-KRWDZBQOSA-N 397.434 5.327 30 20 GKED N#C[C@@H](NC(=O)C[C@H]1CCc2ccccc21)c1ccc(OCc2ccccc2)cc1 609661952 NFTKKQZMOBUTRY-RCZVLFRGSA-N 396.490 5.067 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)cc1 609779106 DTWMENJLUHWOSI-OAQYLSRUSA-N 395.934 6.290 30 20 GKED C[C@H](c1ccccc1)c1ccc(OCc2nnc(-c3ccc(C#N)cc3)o2)cc1 610270478 BHQUZEBHPHSZTE-QGZVFWFLSA-N 381.435 5.339 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 610634673 BDZRMMDYZIFXCF-FCHUYYIVSA-N 391.515 5.305 30 20 GKED O=C(NCCCC(F)(F)F)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 611703695 LAKJJDXEISIGPK-UHFFFAOYSA-N 399.228 5.048 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)oc2c(F)cccc12 618297413 HYCKQFMCMFZNGN-UWVGGRQHSA-N 397.290 5.083 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2)cc1 675130362 NJQIGNYFJSNBJB-GOSISDBHSA-N 387.439 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(=NCc2ccccc2)cc[nH]1 682803687 MNFYWFRIDFRISB-UHFFFAOYSA-N 385.511 5.220 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1c(Cl)nc(Cl)n1C 728440968 BBNVFYLJWYAJMA-BQYQJAHWSA-N 396.274 5.194 30 20 GKED N#C[C@H](C(=O)CSc1ccccc1Cl)c1nc2cc(F)ccc2s1 730417012 JVAGZBYBTGLBDY-LLVKDONJSA-N 376.865 5.057 30 20 GKED N#C[C@H](NC(=O)Cc1c(Cl)cccc1Cl)c1cccc(Cl)c1Cl 731195698 MJYKYVHYLQQSEU-AWEZNQCLSA-N 388.081 5.224 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1cccc(OCc2ccccc2C#N)c1 731320842 ZUZMJGWKWYQTLF-OUKQBFOZSA-N 399.494 5.428 30 20 GKED Cc1ccc(COc2cccc(NC(=O)N(C)Cc3cccc(C#N)c3)c2)cc1 732438474 UKBQJTVGPXWMEX-UHFFFAOYSA-N 385.467 5.110 30 20 GKED N#CCOc1ccc(Cl)cc1CSCC(=O)Nc1cccc2ccccc12 735319782 BLBYZHVZKUAFHI-UHFFFAOYSA-N 396.899 5.267 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2cc3ccccc3o2)cc1 740434871 IXUHIHYFXDRWRW-HSZRJFAPSA-N 395.462 5.452 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(SCC(F)F)cc1 743056146 QGTZTCLVVVLHQJ-KMKOMSMNSA-N 398.434 5.522 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 743709013 PYHWANIVHCEHMW-AUUYWEPGSA-N 387.405 5.185 30 20 GKED Cc1ccc2c(CCC(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c[nH]c2c1 745947814 OCRRQFKDAGPMPX-LJQANCHMSA-N 385.492 5.409 30 20 GKED Cc1ccc(CCCCC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 746416580 NYUOHTRSZMYPDJ-JOCHJYFZSA-N 384.479 5.209 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2c(F)cccc2Cl)cc1 746660206 NYHHAYWIEYFAAY-SFHVURJKSA-N 393.849 5.456 30 20 GKED CC(=NN[C@@H](C)c1ccc(C(C)C)cc1)c1sc(-c2cccnc2)nc1C 747611734 VUGWLVBMNQBTAT-HNNXBMFYSA-N 378.545 5.712 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1coc2ccccc12 747750766 XMBUJKROODORGW-UHFFFAOYSA-N 397.360 5.140 30 20 GKED CC(=NN(Cc1ccccc1)Cc1ccccc1)c1cnn(-c2ccccn2)c1C 748244853 SSZBIMSSAMXGOR-UHFFFAOYSA-N 395.510 5.002 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)COc2c(Cl)cc(Cl)cc21 753143521 UZBXHBBVTNQQAP-VZUCSPMQSA-N 389.263 5.171 30 20 GKED N#Cc1ccccc1/C=C1\CC2(CCOCC2)C/C(=C\c2ccccc2C#N)C1=O 755598910 LPHTWGKKWZTEJO-RNIAWFEPSA-N 394.474 5.057 30 20 GKED CC[C@H](SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 757749426 IZTPOHAYKPBCGL-RXVVDRJESA-N 392.549 5.871 30 20 GKED N#Cc1csc(CNc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)c1 762628085 MMDUZHPTLKZYJM-UHFFFAOYSA-N 381.206 5.480 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(/Cl)c2nc3cc(C(F)(F)F)ccc3o2)cc1 764434757 ZBHDTAHMTBMZPX-UXYFDLPDSA-N 392.764 5.874 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2nccn2CCc2ccccc2)cc1 766529618 QTEDIVDCBRATKN-IBGZPJMESA-N 395.934 5.108 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2ccc(Cl)nc2C(F)(F)F)cc1 766855095 NAQJQADCBHREDN-AWEZNQCLSA-N 395.812 5.046 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3ccc(C(C)C)cc32)c1 772982307 CRJIIUQTYNLIIP-NFBKMPQASA-N 378.516 5.494 30 20 GKED C[C@@H](C#N)Oc1ccc(CNC2(c3c(Cl)cccc3Cl)CCC2)cc1 775041970 WITOLCUVTJTEBN-AWEZNQCLSA-N 375.299 5.453 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(OCC(F)(F)F)cc1 775220055 AWPSMXPGIMWVAG-CYBMUJFWSA-N 398.812 5.034 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(COc2ccccc2)cc1 780636056 HVSMAOBUQLEZLO-KRWDZBQOSA-N 387.439 5.200 30 20 GKED CC(C)(C#N)CCCOC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 783348610 CCNBRTCMDSVOPY-UHFFFAOYSA-N 396.434 5.245 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)c(Cl)c1 783607623 JFJPOICXKXUHSW-UHFFFAOYSA-N 390.270 5.124 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2ccccc2n1C(F)F 786325749 VMBUUYKAZKGLBI-GMTAPVOTSA-N 391.830 5.126 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2c(Cl)ccc(Cl)c2Cl)cc1 792926881 YVZAOSRLNBVPKL-JXMROGBWSA-N 382.674 5.245 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797571035 LIAYCRDVTXPFNE-LSDHHAIUSA-N 394.462 5.829 30 20 GKED N#Cc1ccccc1/C=C/C(=O)Nc1nc(-c2ccco2)c(-c2ccco2)s1 799733005 AEUIZSZGZRGKPK-MDZDMXLPSA-N 387.420 5.187 30 20 GKED N#CCCCCCC(=O)O[C@@H](c1cc(Br)ccc1F)C(F)(F)F 805874545 HGMXWAPDEUKEAV-AWEZNQCLSA-N 396.178 5.209 30 20 GKED C=CCc1cc(CN[C@H]2CCCc3c2[nH]c2ccccc32)cc(OC)c1OC 808705197 BFMSDOOJWHQMII-NRFANRHFSA-N 376.500 5.081 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(C2SCCS2)cc1)c1ccccc1 817319410 OLEZJWLXKDLEJS-LJQANCHMSA-N 382.554 5.330 30 20 GKED N#CCCC[C@H](NC(=O)/C=C\c1csc(C(F)(F)F)c1)c1ccccc1 861824044 PEDYTOFULJCXGH-YDZSZYSISA-N 378.419 5.331 30 20 GKED Fc1ccccc1-c1ccc(C=Nn2c(S)nnc2-c2cccs2)s1 912794608 AMNCZMUAEWENHW-UHFFFAOYSA-N 386.502 5.045 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)[C@@]1(C#N)CC2CCC1CC2 912997662 ISJRVQLKIMNEQC-WTOQYCPUSA-N 383.492 5.001 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc3cccnc23)cc1 915200091 UQRHGWMWPLLYDA-QHCPKHFHSA-N 377.447 5.071 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(Cl)cc2)cc(Br)c1O 916135210 JQBSGFIVYGLWMC-FPYGCLRLSA-N 381.653 5.103 30 20 GKED Cc1ccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916976488 POYNSLBOZAZDPG-KSSFIOAISA-N 396.899 5.416 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=C/C=C/c1ccco1 920362750 JWTDHUJVKWHZNI-NQILBMTPSA-N 395.871 5.227 30 20 GKED CC[C@H](C)c1nnc(N2CCC(C)(C#N)CC2)n1Cc1ccc(C)cc1SC 1495386129 UOHQJSAMCPJKLS-KRWDZBQOSA-N 397.592 5.000 30 20 GKED Cc1cc(C=NNc2ccc(CC(=O)O)cc2)c(C)n1-c1ccc(C(C)C)cc1 1776084393 MJGRKMSAKPHQNP-UHFFFAOYSA-N 389.499 5.291 30 20 GKED CC(=Nn1c2ccccc2c2ccccc21)c1cnc2ccccc2c1C(=O)O 1776112755 JVIDIOBBUBDAJQ-UHFFFAOYSA-N 379.419 5.313 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2ccccc21 1776526515 NAUWIOGMJMEQNS-XDJHFCHBSA-N 382.459 5.999 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)c(OC)cc1Cl 1776783046 SQKBUSPUARKIRT-CQSZACIVSA-N 376.324 5.295 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4c(Cl)cccc4C3=O)s2)c1 1777684302 JPJVOTUHKPNJEZ-WYMLVPIESA-N 394.879 5.979 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)C3(C)CCC3)CCC2)cc1 1789448860 JIPYRLVTFGWOSX-HXUWFJFHSA-N 380.532 5.079 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3C3CC3)CCC2)cc1 1789622284 HVTSJFGZACLWMW-RTWAWAEBSA-N 394.559 5.159 30 20 GKED C[C@H](c1ccccc1)n1c(SCc2ccc(C#N)cc2)nc2ccccc2c1=O 6587466 HSWQBGBJQGXKDK-QGZVFWFLSA-N 397.503 5.170 30 20 GKED CCCn1c(S[C@@H](C#N)Cc2ccc(C)cc2)nnc1-c1cccc(C)c1 24730286 WLFNECDEKSMBMN-HXUWFJFHSA-N 376.529 5.199 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3ccccc3n2)cc1 55823582 ZZIDHWOFWCIZJG-UHFFFAOYSA-N 393.446 5.132 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)s1)c1nc(-c2ccc(Cl)cc2)cs1 60488319 ZKUGCTRHCAQGKZ-NSHDSACASA-N 379.293 5.668 30 20 GKED N#CC1CCN(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)CC1 105022918 GXLGIGBXKAFMFH-UHFFFAOYSA-N 389.377 5.265 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CC(c1ccccc1)c1ccccc1 105917430 QADPHMHUJXAJPO-UHFFFAOYSA-N 382.507 5.519 30 20 GKED N#Cc1nc(NCc2cn(-c3ccccc3)nc2-c2ccccc2)ccc1Cl 110084224 HQKGQZHGXJZLKH-UHFFFAOYSA-N 385.858 5.071 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ncc(-c2ccc(Cl)cc2)o1 154611902 PKCITRHHHPKPET-HNNXBMFYSA-N 381.863 5.851 30 20 GKED C[C@H](CCC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 160576658 XEHSGHVBVUGMCT-UZLBHIALSA-N 385.492 5.442 30 20 GKED CC(C)(C#N)CCCSCc1nc(-c2cc(Br)cs2)no1 161580519 MGEQVDNEKUXOQS-UHFFFAOYSA-N 386.340 5.124 30 20 GKED C#Cc1cccc(N(C)Cc2csc(N(C(C)=O)c3ccccc3CC)n2)c1 165450657 ULJPOQCFASDNAY-UHFFFAOYSA-N 389.524 5.008 30 20 GKED CCCOc1ccc(Oc2ncccc2CN[C@@H](C)c2cccc(C#N)c2)cc1 181527604 KGPHKKYAJZMFKY-SFHVURJKSA-N 387.483 5.385 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)ccc1OCC(C)C 181599260 YJKHLQMGLSJSBR-ROUUACIJSA-N 382.504 5.044 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(NC(=O)[C@@H](C)OC)c1 191426612 VHORWLSMMJBURY-MRXNPFEDSA-N 395.503 5.156 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1nc(C2CC2)no1)C(C)C 191514718 OERDXEHQOQRNQI-SFHVURJKSA-N 382.508 5.318 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 217227257 ILHBCGCNAWGYDD-ZWKOTPCHSA-N 381.545 5.913 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cn1ccc2ccc(Cl)cc21 303346378 ZPMWYXZFMJNGEW-AWEZNQCLSA-N 383.904 5.185 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1sc2c(c1C)CCCC2 328841792 PSHGPYUEYZJQOM-ZDUSSCGKSA-N 376.547 5.231 30 20 GKED C[C@@H]1CCCN(C(O)=Nc2cccc(C(O)=Nc3ccc(Cl)cn3)c2)CC1 329217055 PNDOXIBLENQJJM-CQSZACIVSA-N 386.883 5.039 30 20 GKED OC1=N[C@@H](/C(O)=N/C2(c3noc(C4CCCC4)n3)CCCCCC2)CCCC1 329875498 GQRZNUBOVYZVIE-MRXNPFEDSA-N 388.512 5.132 30 20 GKED N#C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(Cl)c1Cl 329996751 PJVFRKBGCGHOLD-ZUEPYMLJSA-N 394.302 5.440 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OC2CCCC2)c(Cl)c1)c1ccc(C#N)cc1 409510254 ZDPIONFRKNYUQF-CQSZACIVSA-N 383.879 5.416 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Oc2ccccc2Cl)c1 429961775 LPMKTDDGUQWKOV-UHFFFAOYSA-N 394.883 6.000 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCC[C@H]1Cc1ccccc1)c1ccccc1 431984937 HKXBIQZRKRSMJJ-VABKMULXSA-N 375.516 5.132 30 20 GKED CC[C@@H](C)n1c(SCc2cc(C#N)ccc2OC)nnc1-c1ccccc1 435141440 OQEYEGNSAIPSCU-OAHLLOKOSA-N 378.501 5.089 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccccc1NC12CC3CC(CC(C3)C1)C2 436133617 CDNSJASJGBBPFF-UHFFFAOYSA-N 375.472 5.093 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 436365845 NCNKDKPVMFWDQB-IFMALSPDSA-N 387.508 5.031 30 20 GKED Cc1cc(O)c(C(C)C)cc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 436797660 OVVJIPTTZIRALL-UHFFFAOYSA-N 387.439 5.135 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CC(F)(F)F)c1 438528116 LVKWDOBRTRZDKF-UHFFFAOYSA-N 389.421 5.353 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ncc(-c2ccccc2)o1 439674837 QKTLLKANNOHAAO-INIZCTEOSA-N 399.425 6.318 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccccc1 439675103 YZGQGNIHLQCEEU-XMMPIXPASA-N 395.462 5.320 30 20 GKED COc1ccc2occ(C(=O)[C@H](C#N)c3nc(-c4ccc(C)cc4)cs3)c2c1 442511260 HMSSPMSUXFJHAU-KRWDZBQOSA-N 388.448 5.363 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F)c1ccccc1 455302562 MNGGZDASMOFHBL-MSOLQXFVSA-N 393.384 5.005 30 20 GKED O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 456563245 ADCYPSMAIYTQMK-VPOLOUISSA-N 399.297 5.087 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)N[C@H](CCCC#N)c2ccccc2)o1 458798840 ISIIGYGDWGIFMP-UIFIKXQLSA-N 379.504 5.506 30 20 GKED C[C@@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)CCCC#N 463254255 DWGARJYOHQQOTQ-QAPCUYQASA-N 391.902 5.550 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 464949997 FZVUXWWGNNVRFV-NCYKPQTJSA-N 398.428 5.107 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 469473974 GTUKMGJRPDTBKC-LJQANCHMSA-N 387.405 5.531 30 20 GKED CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 470057338 PVAAVNCFEFDVEI-SFHVURJKSA-N 388.389 5.154 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](c2ccc(F)cc2)C[C@H]1C 475545815 BZWKHTBJDCBPJM-XLIONFOSSA-N 380.507 6.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cc(OC)cc(OC)c1 475555779 OFXMFSPULXAXKV-UHFFFAOYSA-N 382.504 5.220 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2ccccc2CCC(F)(F)F)cc1 477186588 JSRXTCZMZWPEFZ-UHFFFAOYSA-N 378.394 5.068 30 20 GKED C[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(Br)s1 481990991 GOIHAMJUSURCFD-MLGOLLRUSA-N 375.335 5.501 30 20 GKED C[C@@H](SCc1nc(-c2cc(F)c(F)c(F)c2)no1)c1ccc(C#N)cc1 486731472 AEEKFQKBQZEFCU-SNVBAGLBSA-N 375.375 5.020 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(F)cc1-c1ccc(F)cc1 491432396 KZSDUYRMTJTTHH-UHFFFAOYSA-N 377.394 5.167 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1c[nH]nc1-c1ccccc1 492177425 FWRCLBPXINWCCG-CQSZACIVSA-N 377.473 5.115 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)[C@@H](C)c1ccc(C#N)cc1 493976473 IBGIKHBMQRCPKD-PNHOKKKMSA-N 397.316 5.034 30 20 GKED CC(C)(C)c1ccc(CCNCc2cn(CCC#N)nc2-c2ccccc2)cc1 500284683 ZUDZVCCBDIWCAI-UHFFFAOYSA-N 386.543 5.094 30 20 GKED Cc1oc(C2CC2)nc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 507774715 XTRLUWPBULOUDS-UHFFFAOYSA-N 393.830 5.430 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510049955 UEMAGRMSFGHQDQ-UHFFFAOYSA-N 378.859 5.356 30 20 GKED O=C(N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)c1cccc(C(F)F)c1 511743318 XAZBRGYPZSBEIG-CYBMUJFWSA-N 395.274 5.259 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)CSCc1ccc(C#N)cc1)C1CC1 512082416 FERLNRIQSGJUFJ-HNNXBMFYSA-N 384.932 5.197 30 20 GKED CC(C)(C)n1nc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1C1CC1 515691451 HCFQGFVFHSDMQS-UHFFFAOYSA-N 390.512 5.368 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3ccccc3O)cc2Cl)cc1 516005705 JAZZWHLULBWCGL-UHFFFAOYSA-N 392.842 5.281 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Cl)c1Cl 520170426 UEDNSIYHCDVZRL-UHFFFAOYSA-N 376.287 5.555 30 20 GKED CCCCN(CC(F)(F)F)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 523162033 BVBKGQNJAADCLW-UHFFFAOYSA-N 375.394 5.106 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(CC1CC1)C1CCCCC1 533277562 ZLFWSLIBEHREON-KRWDZBQOSA-N 385.577 5.064 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCn1ccc2cc(Cl)ccc21 533944290 VRNDPNXXZCFFBV-OAHLLOKOSA-N 397.931 5.718 30 20 GKED C[C@@H]1c2cc(Cl)c(Cl)cc2CCN1Cc1nnc(-c2ccc(C#N)cc2)o1 536743404 BSJQXNDFDLSJJR-GFCCVEGCSA-N 399.281 5.034 30 20 GKED COc1ccc([C@@H](NCCCC2(C#N)CCOCC2)c2ccccc2Cl)cc1 538610098 OQPACSRHNHZQBP-JOCHJYFZSA-N 398.934 5.128 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(Br)s1)c1ccccc1 541367151 HSKONZXZGCDPGP-GOEBONIOSA-N 390.346 5.534 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(C#N)c(Cl)c1)C1CCCCC1 548279056 BPELYKDJTRHXST-UHFFFAOYSA-N 381.907 5.228 30 20 GKED C=CCC(C)(C)c1noc([C@H]2CCCN2C(=O)c2cc(Cl)ccc2Cl)n1 560008480 OLUXIRPZHGVSLB-OAHLLOKOSA-N 394.302 5.207 30 20 GKED N#CCCCCCC(=O)N(Cc1ccc(Cl)cc1)c1ccccc1Cl 588888089 DFZBUNFTCXXSAE-UHFFFAOYSA-N 375.299 6.001 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 596714928 VNMDVGKFOFCOMM-KDURUIRLSA-N 389.455 5.074 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)CC1CCC(F)(F)CC1 600038103 NTOGUFFNOATYAN-ZDUSSCGKSA-N 388.380 5.162 30 20 GKED CC[C@@H](C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccccc1 609384854 KCCSECXQICYMHJ-MOPGFXCFSA-N 395.572 5.320 30 20 GKED C[C@@H](CC(=O)Nc1sc2c(c1C#N)CCC2)c1cccc(C(F)(F)F)c1 609965633 CIEFBKPQJUVRES-NSHDSACASA-N 378.419 5.260 30 20 GKED Cc1cccc2c(CCC(=O)N(Cc3ccco3)c3ccccc3C#N)c[nH]c12 610171103 IZEOROYXDKWFAL-UHFFFAOYSA-N 383.451 5.107 30 20 GKED C[C@H](SCc1ccnc(C#N)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 610954403 TWVKXQOMRIKGAT-NSHDSACASA-N 390.390 5.016 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 613292450 KLJIPBPYNPQLME-GOSISDBHSA-N 398.487 5.852 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C(F)F)nc1 657826529 HWWZTXXAFJQMOF-OHBODLIOSA-N 390.318 5.579 30 20 GKED O=C(Nc1cc(F)c(F)cc1F)NC(CCC(F)(F)F)CCC(F)(F)F 666003404 GBTFRHWFLMHRGS-UHFFFAOYSA-N 396.253 5.279 30 20 GKED FC(F)(F)CCN1CCC(Nc2ccc(C(F)(F)C(F)(F)F)cc2)CC1 681140671 BSWAACPDEJSSDO-UHFFFAOYSA-N 390.318 5.169 30 20 GKED CC(C)(Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420811 GZLMAOJAFJUQOJ-AWEZNQCLSA-N 388.851 5.123 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1cccc(Cl)c1 730950243 BHRWLOXGBNAKFO-TWGQIWQCSA-N 382.799 5.106 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)cc1 731030099 CKYVHCZAZQSKSP-HNNXBMFYSA-N 387.936 5.057 30 20 GKED C[C@@H](OC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccc(C#N)cc1 735675363 GGJYHNCEGLPFBV-MRXNPFEDSA-N 379.419 5.086 30 20 GKED CC(=NNc1cc(Cl)nc(C)n1)c1ccc2c(c1)Nc1ccccc1S2 741766204 PBUDVBYVQNHJFX-UHFFFAOYSA-N 381.892 5.483 30 20 GKED N#Cc1ccccc1NC(=S)NCc1ccc(Oc2ccccc2F)c(F)c1 741861254 DHCJCSIETCXMKE-UHFFFAOYSA-N 395.434 5.115 30 20 GKED Cc1ccc([C@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)cc1 742260513 LMMYSSDZGNZUJI-QHCPKHFHSA-N 376.887 5.430 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2SCCc3ccccc32)cc1 742537632 MVEWUHHIPUJXDR-DHIUTWEWSA-N 384.504 5.311 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2SCCc3ccccc32)cc1 742537635 MVEWUHHIPUJXDR-XZOQPEGZSA-N 384.504 5.311 30 20 GKED Cc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1 743127383 IDJQTXJAVPGHPD-OAHLLOKOSA-N 394.475 5.096 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2scnc2-c2ccccc2)cc1OC 749359688 SWLWEDIPBRENBS-BENRWUELSA-N 392.480 5.035 30 20 GKED Cn1cc(CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc21 756239578 BRXZIFBZPXYNOI-INIZCTEOSA-N 393.899 5.250 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)c3c(F)cccc3F)n2)cc1 764567337 OOOJDDUFWXIPMD-UKRRQHHQSA-N 382.435 5.377 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1nc2ccccc2s1 767926433 ZFXNLTVVOZHZAL-HNNXBMFYSA-N 388.496 5.046 30 20 GKED CCC[C@@H](NCc1ccc(OC)c(O[C@H](C#N)CC)c1)c1ccc(Cl)cc1 772987928 ZRYIKMUVFCLRQJ-VQTJNVASSA-N 386.923 5.661 30 20 GKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(OCc2ccccc2)c1 774381286 AZBYAVAXFGTRKX-UXHICEINSA-N 386.495 5.580 30 20 GKED C[C@@H](NC(=O)Cc1ccccc1CC#N)c1ccc(Oc2ccccc2)c(F)c1 776837768 RVJJYBHRTKQCKH-QGZVFWFLSA-N 388.442 5.104 30 20 GKED N#C[C@@H](C(=O)[C@@H](F)Cc1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 778295882 XIJNYPXAPPAITL-KBPBESRZSA-N 392.377 5.072 30 20 GKED C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(-c2cccc(C#N)c2)cc1 782522521 CQTVJLHRFCRDJG-OAHLLOKOSA-N 375.403 5.123 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 786446706 DNKUGRAPFRAUSZ-GOSISDBHSA-N 396.412 5.699 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc(N4CCCCC4)c(Cl)c3)CC2)c1 795403699 CZVWTWUZHXEFOJ-UHFFFAOYSA-N 397.881 5.011 30 20 GKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)Cc2ccc(OCC#N)cc2)c1 797363408 FPKDNASROQEZHV-UHFFFAOYSA-N 390.870 5.399 30 20 GKED COc1ccc2cccc(CC(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2c1 797567225 DSWBRZUKGDNXHO-SFHVURJKSA-N 378.497 5.021 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 813214196 UKODHAGUGMCBGR-GFCCVEGCSA-N 390.308 5.202 30 20 GKED C[C@H](OC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(C(F)(F)F)cn1 813241881 MVAWZNHPYNNXOV-ZETCQYMHSA-N 399.237 5.315 30 20 GKED C[C@H](C[C@H]1CCCN1C(=O)OC(C)(C)C)N[C@H](CCCC#N)c1ccccc1 816627287 KEIFQDJFRRKOJQ-HMXCVIKNSA-N 385.552 5.189 30 20 GKED CC1(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCOCC1 835067895 KTMVKUZIWLZAPK-MOEXGYKKSA-N 386.904 5.013 30 20 GKED Fc1ccc([C@H](CC(F)(F)F)NCc2cnc(CC(F)(F)F)s2)cc1 893229885 MIRJNMWXOZXWBL-LBPRGKRZSA-N 386.336 5.170 30 20 GKED COc1ccc(SCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915087388 TUMLXQTZXCFIHW-JOCHJYFZSA-N 388.492 5.081 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 915087552 VXCPDQAMJUDFQT-MQNAVGNWSA-N 384.479 5.630 30 20 GKED O=C(/C=C/c1cc(Br)ccc1OC(F)F)c1cc(F)ccc1F 916134984 VNEJZEHQTPVACF-ORCRQEGFSA-N 389.142 5.225 30 20 GKED N#C[C@H](C(=O)Cc1csc2ccccc12)c1nc2cc(Cl)ccc2s1 917047185 SXPDGEWTWMWGKO-CQSZACIVSA-N 382.897 5.583 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)cs2)cc1 920101740 HOLAGKUWDRVTCO-KRWDZBQOSA-N 399.475 5.114 30 20 GKED CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)Nc1ccc(C#N)cc1C1CC1 933843060 VXFRFKSLNFQATJ-NZQKXSOJSA-N 389.499 5.067 30 20 GKED CC(=NOCc1ccc(C(F)(F)F)cc1)c1sc2ccccc2c1C(=O)O 1776112239 PIPATASOQHAYBU-UHFFFAOYSA-N 393.386 5.559 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C\C(=O)c3ccc(Cl)cc3)c2)c1 1776115009 JDFFCCWHOSXWIQ-GHXNOFRVSA-N 392.838 5.513 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(OC(C)(C)C)c1 1776355354 BOVVGJMUCOVYSM-PKNBQFBNSA-N 382.456 5.245 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc(Cl)cc2)o1 1776783111 YPOLMSYMHOJRFG-GOSISDBHSA-N 377.912 5.893 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Oc2cccnc2)c(C)c1 1776784712 LRVXDUVGKACGRY-FQEVSTJZSA-N 384.520 5.476 30 20 GKED CCCCCCOc1cccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)c1 1776790354 QSYXDIDUTXSJDK-HKWRFOASSA-N 392.495 5.947 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(Cl)cc2)nnc1-c1ccccc1 4563090 WWZITDFDTZRXQX-AWEZNQCLSA-N 383.904 5.148 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@H](C)C(C)C 65412208 BUWCCNRCPUVHPG-OXQOHEQNSA-N 383.923 5.894 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccccc1Cl 108241889 KBNKPRQWOOWWJS-UHFFFAOYSA-N 384.810 5.617 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCC(=O)c1ccc(Cl)cc1 108324164 HLDDUOSPFFIEOD-CQSZACIVSA-N 386.904 5.193 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(C(=O)N2CCCCC2)c1 109002476 FIXZBVQSYCWQRV-SFHVURJKSA-N 393.556 5.319 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)oc2ccc(Cl)cc12 114619197 SOQKZVMLPLSJOU-OAHLLOKOSA-N 393.855 5.403 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 116594567 AQMLLKREYJPOBW-OXJNMPFZSA-N 385.492 5.360 30 20 GKED C[C@@H](C#N)Oc1ccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc1 171563343 SSABMVXJAZPCGY-INIZCTEOSA-N 378.422 5.135 30 20 GKED CCN(Cc1ccccn1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 175965191 LYDXHJTYBVKPDH-UHFFFAOYSA-N 386.455 5.108 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 176808834 GIXWFNMQKSVDJG-UHFFFAOYSA-N 376.485 5.121 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H]2CCCC[C@@H]2C1 176966768 YMJDVULPHHJRTO-NHCUHLMSSA-N 389.499 5.100 30 20 GKED Cc1csc([C@H](C)CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 184633890 XGQXTLUUDDOWBE-CQSZACIVSA-N 392.484 5.041 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)co1 187255698 YCYNXNASUDQHSG-CYBMUJFWSA-N 377.252 5.508 30 20 GKED C=CCC1(C(=O)Nc2ccccc2[C@H](C)NC(=O)C2(CC=C)CCC2)CCC1 189858407 BVVJJFUEDLTQRL-SFHVURJKSA-N 380.532 5.295 30 20 GKED C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 296540830 FDGZLLZUGHQTFX-MJBXVCDLSA-N 385.455 5.276 30 20 GKED O/C(=N/[C@H]1CCCC(F)(F)C1)C1CCN(c2noc3ccc(Cl)cc23)CC1 328925609 OHLHFXSTCZUGTC-AWEZNQCLSA-N 397.853 5.232 30 20 GKED CC(C)n1c([C@H]2CCCN2c2ccc(C(F)(F)F)c(C#N)n2)nc2ccccc21 409724082 ZXDZJZXTWNPYCX-GOSISDBHSA-N 399.420 5.244 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@@H](C)CC3)c1C1CC1 410980688 GIGPOXGXJXOUOK-STQMWFEESA-N 382.533 5.213 30 20 GKED C[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)[C@@H]1c1ccc(C(F)(F)F)cc1 412208227 WMGNJJPOQKMQPQ-ZQEFQCJFSA-N 398.428 5.290 30 20 GKED N#CC1(CC[S@@](=O)Cc2cc(F)c(C(F)(F)F)cc2F)CCCCC1 417179921 NZIPGEYWALNRCW-RUZDIDTESA-N 379.394 5.096 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(-c2c(C)nsc2C)no1 426632182 TVVKVOXJDZCKBT-UHFFFAOYSA-N 381.379 5.061 30 20 GKED C=CCn1c(S[C@H](C)CCSc2ccccc2)nnc1-c1cccnc1 431241983 INSHIYROBMKRJP-MRXNPFEDSA-N 382.558 5.189 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1csc(C)n1 433800815 XFLNVHPBYIPAQW-UHFFFAOYSA-N 390.512 5.434 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H](C)CCC[C@H]2C)cc1 438219453 YIGPYYPDTWZPHR-IAGOWNOFSA-N 393.487 5.402 30 20 GKED CC(C)(C)n1cc(C(=O)NCC2CCC(C#N)CC2)c(-c2ccccc2Cl)n1 441138000 UEUIHJWJODCLPZ-UHFFFAOYSA-N 398.938 5.018 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1ncnc2sc(C)cc12 447331479 RVSQLNGTAFOIDW-UHFFFAOYSA-N 387.555 5.009 30 20 GKED CC[C@H](N[C@H](C)c1ccc(OC2CCCC2)c(OC)c1)c1ccc(C#N)cc1 447533821 SVLHHQJRJSHZSN-VGSWGCGISA-N 378.516 5.690 30 20 GKED CC(C)c1csc([C@H]2CCCN(C(=O)C(C)(C)Cc3ccc(C#N)cc3)C2)n1 455761158 XTWBOALFVQPYFO-IBGZPJMESA-N 395.572 5.113 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 457740156 GQSNNOLWIRLTHG-KCJUWKMLSA-N 395.265 5.404 30 20 GKED N#Cc1c(F)cccc1C(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 462407886 FSAJUWZENQARLS-UHFFFAOYSA-N 377.246 5.024 30 20 GKED Cc1cc(C(F)(F)F)ncc1NC(=O)c1ccccc1Oc1ccccc1C#N 464661768 FVASMUUPMZKKPW-UHFFFAOYSA-N 397.356 5.325 30 20 GKED COc1cccc(-c2nc(CN3CCC[C@H]3[C@H](C#N)c3ccccc3)cs2)c1 464823353 QCFJOCHETHSRSS-YADHBBJMSA-N 389.524 5.090 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 465593549 GJZCLGYDLKCKTA-OFAXGOBFSA-N 391.515 5.016 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)Nc1sc(-c2ccccc2)cc1C#N 466990862 BACLDORVQKFOCV-INIZCTEOSA-N 376.481 5.330 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476226850 PQRRHPXHQNBQNS-UHFFFAOYSA-N 384.479 5.628 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2cc(C#N)cs2)nc1-c1ccc(Cl)cc1 479214126 WJUQMOVBVBWERH-SNVBAGLBSA-N 387.917 5.196 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Br)cn1 479413473 JZWBZAPTQLSFCB-OAHLLOKOSA-N 392.300 5.234 30 20 GKED N#Cc1nnc2ccccc2c1Sc1nc2c(Br)cccc2s1 480582875 RFQGOVSPDLMUQV-UHFFFAOYSA-N 399.298 5.025 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 482339399 UWHGJLYWUDCGRY-SJORKVTESA-N 395.812 5.288 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 482928203 CXJFACSHVSLYBK-NQIIRXRSSA-N 393.487 5.066 30 20 GKED CCc1cc(O)ccc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 483850450 BLFDWSLMKQOUFR-UHFFFAOYSA-N 387.439 5.571 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@H](C)c3cc([N+](=O)[O-])ccc3C)o2)cc1 484604177 ZLECEMPESZCVOQ-CQSZACIVSA-N 397.456 5.371 30 20 GKED CCc1c(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cnn1C(CC)CC 485174186 BUMTXNBXEDPQNK-KNQAVFIVSA-N 393.535 5.110 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 485790653 HPXADIXXIJKAAE-UHFFFAOYSA-N 378.472 5.273 30 20 GKED Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 485946819 LYSHFQJFZCKEJP-LJQANCHMSA-N 389.480 5.174 30 20 GKED N#CCCC[C@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccccc1 487211048 OKDNBYZUTXGLDA-IBGZPJMESA-N 391.540 5.560 30 20 GKED C=CCC[C@H](C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F)c1ccccc1 487762774 QXJKCOJDOCOVRX-WBVHZDCISA-N 383.442 5.359 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c1-c1ccccc1 488234429 QYDDAGYTKILHBP-INIZCTEOSA-N 398.388 5.035 30 20 GKED Cc1c(COC(C)(C)C)cccc1NCc1cn(C)nc1-c1ccc(C#N)cc1 490363670 GYMINVWUQIDBGX-UHFFFAOYSA-N 388.515 5.194 30 20 GKED Cc1ccccc1[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)C1CC1 491108726 HIKFNVYDALZUOZ-QHCPKHFHSA-N 375.516 5.186 30 20 GKED Cc1ccnc2sc(C(=O)Nc3nc(-c4cccc(C#N)c4)cs3)c(C)c12 502379229 XELOKRHOAUQEFL-UHFFFAOYSA-N 390.493 5.161 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cnn(C2CCCC2)c1 502412770 GZRQDIGLORCAQK-MOPGFXCFSA-N 384.527 5.949 30 20 GKED Cc1cc(C(=O)Nc2c(C(C)C)cccc2C(C)C)nn1-c1cccc(C#N)c1 502544727 GJUPWLVQOXDYFH-UHFFFAOYSA-N 386.499 5.552 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 517625991 RMUQPYOHSPGGLS-UHFFFAOYSA-N 393.393 5.464 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 518740253 RDWHYFIBXJQSEZ-XLIONFOSSA-N 396.556 6.000 30 20 GKED N#CCCn1cc(/C=C/c2nc(CCCc3ccccc3)no2)c2ccccc21 518876776 CIQUUSILABRSRM-CCEZHUSRSA-N 382.467 5.284 30 20 GKED C=CCn1c(SCc2ccc(Br)s2)nnc1-c1ccoc1C 519105104 VRKNQYDYVDKKDK-UHFFFAOYSA-N 396.335 5.149 30 20 GKED N#CCN(C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1)C1CC1 520112758 QKTUBKNFEFPDFF-UHFFFAOYSA-N 391.323 5.414 30 20 GKED COc1ccc2oc(C(=O)N[C@@H](C#N)c3cccc(Cl)c3Cl)c(C)c2c1 521292407 NRJCSCSQGRQBQR-HNNXBMFYSA-N 389.238 5.051 30 20 GKED COc1ccc(CNCc2cc(C)cc3c(C)c(C)[nH]c23)cc1OCCCC#N 521827381 CKFQRPKSGQVNKM-UHFFFAOYSA-N 391.515 5.074 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 523105014 XVMXRXARNZEOKE-CYBMUJFWSA-N 376.378 5.108 30 20 GKED Cc1ccc2cc(C(=O)N[C@@H](C#N)c3ccc(OCc4ccccc4)cc3)[nH]c2c1 524332419 DGVGKPXMILYEEC-DEOSSOPVSA-N 395.462 5.050 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)Cc2cccc(C#N)c2)nc1-c1ccccc1 530675230 JKSCHQIFBGHSDH-OAQYLSRUSA-N 399.494 5.243 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)s2)cc1 530854362 SNTKWJGNXRAMQO-HNNXBMFYSA-N 397.525 5.197 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)s2)cc1 530854366 SNTKWJGNXRAMQO-OAHLLOKOSA-N 397.525 5.197 30 20 GKED COc1ccc(CNc2ccccc2N(C)C2CCCC2)cc1OCCCC#N 532895204 ZJPWJGZVDUHBNP-UHFFFAOYSA-N 393.531 5.369 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@@H]1COc2ccccc21 533170795 WHXGNNDHZDYWCU-ZHRRBRCNSA-N 399.450 5.037 30 20 GKED CCN(C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1)[C@@H](C)c1ccc(C#N)cc1 538745123 UCTPIEVTLBLJBE-ZDUSSCGKSA-N 385.389 5.282 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(Cn2cccn2)cc1)c1cccc(C#N)c1 539494389 FHKQVXVMTCAMIL-FQEVSTJZSA-N 392.506 5.321 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 541158417 APHUJJZNKIXVCT-ZWKOTPCHSA-N 384.483 5.084 30 20 GKED C[C@H](NC(=O)C[C@@H]1OCCc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 542927625 KXFIRQVXGHOCMP-BVZFJXPGSA-N 396.490 5.107 30 20 GKED C[C@@H](NCc1nc2cc([N+](=O)[O-])ccc2o1)c1ccc(-c2cccc(C#N)c2)cc1 542941874 GZCFLPOWKWOOAE-OAHLLOKOSA-N 398.422 5.125 30 20 GKED N#CCc1cccc(-c2nc(-c3cc(Cl)ccc3OCC(F)(F)F)no2)c1 546470923 IDROGXHVJLOGSA-UHFFFAOYSA-N 393.752 5.064 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC3(CCCC3)C2)cc1Cl 547996536 FAOQIYOGFJHPKN-LJQANCHMSA-N 379.891 5.403 30 20 GKED Cc1c([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 556198702 WBOICCOKSSRPSB-HXOBKFHXSA-N 392.934 5.920 30 20 GKED COc1cc([C@@H](C)N[C@@H]2CCc3ccc(C#N)cc32)ccc1OCc1ccccc1 558503967 KBHAIVZBLBCBSO-HOYKHHGWSA-N 398.506 5.484 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1(C)C 558511039 GEMYDFFYJDEQSP-SFHVURJKSA-N 391.515 5.232 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@@H]2CCC(=O)c3ccccc32)C(C)(C)C)cc1 560115964 JJNXTLZHNOZXHF-JOCHJYFZSA-N 391.511 5.139 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)ccc12 561738997 UXDQBWYBWVEYQP-UHFFFAOYSA-N 395.418 5.165 30 20 GKED CC(C)(C)n1cc(C(=O)N2CCC(CCC#N)CC2)c(-c2ccccc2Cl)n1 566276827 RIXLSNTWZGTTEZ-UHFFFAOYSA-N 398.938 5.114 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)CC2 573048842 WZNIOJCIPKOZKG-ROUUACIJSA-N 398.350 5.848 30 20 GKED CC(C)c1c(NC(=O)c2ccc(Cl)c(C#N)c2)cnn1-c1ccc(Cl)cc1 579423923 PYHLTNJQYVTJGE-UHFFFAOYSA-N 399.281 5.426 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)C1 597908810 BVQJKRADBREZLB-CQSZACIVSA-N 389.282 5.552 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CC[C@H]3CC[C@@H](C2)S3)c1 600272507 WJKJXZMDQVTBIL-SJORKVTESA-N 398.915 5.114 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)cs2)c(C)c1 605363063 FWLXURZNWHQGEJ-INIZCTEOSA-N 386.480 5.102 30 20 GKED COc1ccc(SCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609378183 ZNFAKPDSEGNJLO-HNNXBMFYSA-N 386.542 5.068 30 20 GKED CC(C)c1ccc(CN(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609403003 IZGBGBNMFDXRAB-KRWDZBQOSA-N 381.545 5.726 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 609439067 VWIJDPLLBQHGGT-ZWKOTPCHSA-N 381.545 5.450 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 609462407 DATZZVFEDMKRNC-ABAIWWIYSA-N 398.837 5.220 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)CCc2ccc3ccccc3c2)CC1 609508689 JDVOFWQMMBKLSY-UHFFFAOYSA-N 398.506 5.150 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cccc(F)c1 609693745 FTAMQAHCDOYBRN-HNNXBMFYSA-N 375.403 5.017 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3CCS[C@@H](c4ccccc4)C3)c2)cc1 609991822 VJKKSOKFOMFCBB-HSZRJFAPSA-N 399.519 5.232 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 611390947 WXEOCEFLZRBZRE-ZQIUZPCESA-N 390.371 5.435 30 20 GKED Fc1ccc(C(F)(F)F)c(-c2noc([C@H](C[C@@H]3CCCO3)C(F)(F)F)n2)c1 650535536 YALLXGNQVVVZCO-CABZTGNLSA-N 398.278 5.110 30 20 GKED CC(=NNc1cncc(Cl)n1)c1sc(-c2ccc(Cl)cc2)nc1C 727651364 VVFAZVJPFKTSOF-UHFFFAOYSA-N 378.288 5.051 30 20 GKED CCSc1ccc(Cl)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 729161403 AZWQFOZKYALLOT-UHFFFAOYSA-N 382.341 5.786 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccc(F)c1 732499434 QFROHFMQOYBFEC-INDWDQIESA-N 398.409 5.507 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cnnc2ccccc12 733748308 QGIUNAYFHNZWOD-UHFFFAOYSA-N 390.878 5.038 30 20 GKED COc1ccc(CN(Cc2cc(Cl)ccc2OCC#N)[C@@H](C)C2CC2)cc1 735307957 BCIFAATYDZEUOJ-INIZCTEOSA-N 384.907 5.052 30 20 GKED Cc1cc2cc(NC(=O)NCc3cccc(-c4ccc(C#N)s4)c3)ccc2[nH]1 740448230 CFDQSFHTCAGFFX-UHFFFAOYSA-N 386.480 5.398 30 20 GKED N#Cc1cnc2c(F)ccc(F)c2c1N1CCC(c2cc3ccccc3[nH]2)CC1 742398477 ZZEMTFLGBIHOJL-UHFFFAOYSA-N 388.421 5.250 30 20 GKED Cn1cc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2ccccc21 743830678 UKWJVTUOPRHSQR-HSZRJFAPSA-N 379.463 5.015 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc3cccc(Cl)c3o2)cc1 753213272 XBTZMUVVLCRKBQ-UHFFFAOYSA-N 394.858 5.153 30 20 GKED CC(C)(C)c1cnc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 754306435 GKYTWUHRYGQFJU-UHFFFAOYSA-N 395.890 5.688 30 20 GKED C[C@@H]1C[C@H](NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c2c(O)ccc(F)c21 756380557 VTXUZMQRAUGZOD-QYTUQVAYSA-N 399.350 5.579 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1cnn(Cc2ccccc2)c1 760268847 CNPROXCYJLKBGP-CMDGGOBGSA-N 377.494 5.013 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 761047730 OULHRFVKPNGRGO-HOCLYGCPSA-N 376.909 5.254 30 20 GKED CC(C)c1ccc(N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 763636142 SVGHNKAQRAONCP-QGZVFWFLSA-N 381.545 5.279 30 20 GKED Cc1cc(Cl)ncc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 766805473 KFQBQUVYTUUGDE-UHFFFAOYSA-N 381.794 5.099 30 20 GKED O=C1/C(=C\c2ccc(-c3cccc(Br)c3)o2)CCc2nc(O)ccc21 769614779 MQJQKQRIDNYJKH-QBFSEMIESA-N 396.240 5.022 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C[C@H](O)c3ccc(Cl)cc3)c2)cc1 772644182 GNKZOJKMZOUFQD-NRFANRHFSA-N 392.842 5.066 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3CCC(C(F)(F)F)CC3)n2)cc1 774052989 GTWNKPBMKJSMMP-GPANFISMSA-N 392.446 5.664 30 20 GKED N#CCOc1ccc(CN[C@H](c2ccccc2)c2cc(Cl)ccc2Cl)cc1 783892476 GYCKZBQIVYAPDZ-JOCHJYFZSA-N 397.305 5.775 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Cl)cc1-c1ccc(Cl)cc1 791945840 GVNIAOUIUOVNIR-UHFFFAOYSA-N 397.261 5.815 30 20 GKED C=CC[C@@H](OC(=O)c1coc(C2CCOCC2)n1)c1ccc(Cl)c(Cl)c1 800971661 SFQKCHSAWQEHJH-QGZVFWFLSA-N 396.270 5.350 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC([C@@H](O)c2ccccc2C)CC1 806518688 GAQCTELJYZTTJC-HSZRJFAPSA-N 378.516 5.091 30 20 GKED O=C1/C(=C/c2ccc(Cl)c(C(F)(F)F)c2)C[C@@H](C(=O)O)c2ccccc21 806560908 PXVHEGDEAJGPPP-DPQIITEBSA-N 380.749 5.197 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cc(Cl)ccc1C(F)(F)F 806667990 DRTWMXABYJVTNS-JTQLQIEISA-N 383.757 5.294 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1Cl 814305117 DMDQHNBVAZNQPB-IBGZPJMESA-N 376.843 5.256 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1 814635305 WNVBSDUPJKAOPD-FQEVSTJZSA-N 396.922 5.497 30 20 GKED C=CCC(F)(F)C(=O)N(C)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 815622119 MBNRUAGCBCNAOI-UHFFFAOYSA-N 386.320 5.067 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1nc2ccccc2n1C(F)F 842291755 NPWGNHOHPRWQOU-ZNMIVQPWSA-N 385.801 5.065 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C(F)(F)c1ccccc1F 853850419 JPMPNYSVNKBUAK-UHFFFAOYSA-N 395.265 5.087 30 20 GKED N#CC[C@@H](CC(=O)Nc1c(-c2cccc(F)c2)n[nH]c1C1CC1)c1ccccc1 909718387 NUEPGRIDJZPXLY-KRWDZBQOSA-N 388.446 5.119 30 20 GKED CCOC(=O)Nc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915086282 ISUKFSFHPOBMFJ-JOCHJYFZSA-N 399.450 5.163 30 20 GKED Cc1ccccc1SCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 916628686 YWXBINFIMOWGIF-MRXNPFEDSA-N 398.940 5.741 30 20 GKED CCCCC[C@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 916720850 RBUFRWREXUQOCJ-SFHVURJKSA-N 379.504 5.422 30 20 GKED CC(C)c1cccc(N2C(=O)/C(=C\c3ccc(OCC#N)cc3)SC2=S)c1 917644601 JBBBLLSEXUOZRE-XDHOZWIPSA-N 394.521 5.118 30 20 GKED CC(C)Cc1ccc(-c2csc(NC(=O)c3ccccc3OCC#N)n2)cc1 920004156 WOCTUSBFOGKBHK-UHFFFAOYSA-N 391.496 5.163 30 20 GKED CC(C)COC(=O)Nc1cccc(N=Cc2cc(Br)ccc2O)c1 920387505 QIPMSCZODAAJTP-UHFFFAOYSA-N 391.265 5.110 30 20 GKED CCOc1ccc(C(CC)=NNc2ncccc2C(F)(F)F)cc1OCC 920829797 UDKZDJXYFUUSIN-UHFFFAOYSA-N 381.398 5.124 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)s1 1777559874 RGZLYXFCGUBGJJ-BENRWUELSA-N 388.444 6.064 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1ccc(-c2ccc(Cl)cc2)s1 27122014 PPULOWIHBRWBSD-BOPFTXTBSA-N 388.945 5.571 30 20 GKED N#C[C@@H](C(=O)Cc1csc(-c2ccccc2Cl)n1)c1nc2ccccc2o1 41543995 GLYYBCYHGVUAFM-AWEZNQCLSA-N 393.855 5.024 30 20 GKED CC(C)c1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cnn1-c1ccc(F)cc1 48858458 LODAZYFISHWWKP-LJQANCHMSA-N 398.441 5.173 30 20 GKED C=CCn1c(SCc2nc3ccccc3n2C(F)F)nnc1-c1ccccc1 55527440 UMFXCFJNPOVJLO-UHFFFAOYSA-N 397.454 5.168 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C2(c3ccccc3)CCOCC2)cc1 56248625 LVVZRTHOBCSOLF-UHFFFAOYSA-N 398.462 5.037 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 56469689 BRSOVRKLXKJDFY-UHFFFAOYSA-N 387.439 5.059 30 20 GKED COc1cc(C(=O)Nc2ccccc2SCCC#N)ccc1OC1CCCC1 108199308 WYDKHYWJAOKWQA-UHFFFAOYSA-N 396.512 5.275 30 20 GKED C=CCN(C(=O)c1sc(C(C)(C)C)nc1C)c1nc(-c2ccccc2)cs1 109477203 FESSDVDVLOPRFV-UHFFFAOYSA-N 397.569 5.705 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@@H]1CCc2ccccc21 115208792 RGNZVGKKMYVYHY-SFHVURJKSA-N 383.451 5.113 30 20 GKED Cc1csc(N(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 116629911 DBZCBGBYLOVCQD-UHFFFAOYSA-N 383.860 5.046 30 20 GKED CCc1nc(NC(=O)c2ccccc2Sc2ccccc2C#N)sc1C 117266102 RCYKERSMOHLWBE-UHFFFAOYSA-N 379.510 5.289 30 20 GKED CCc1onc(C)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 120495727 ISRGADDOFIFNKH-UHFFFAOYSA-N 381.819 5.115 30 20 GKED COc1cc(C#N)ccc1O[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 122537042 MHFITPHVBDHWKG-JTQLQIEISA-N 390.226 5.064 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CCCSC(C)(C)C)n2)cc1 155262634 FADMTGAXWXAVIP-MRXNPFEDSA-N 388.558 5.307 30 20 GKED CCc1nnc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)o1 175388998 UWSOBJOHBMPTRJ-UHFFFAOYSA-N 394.434 5.090 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)C1c2ccccc2-c2ccccc21 180014424 OTBCMAYILMITDH-INIZCTEOSA-N 383.451 5.211 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C)c1ccccc1 186975790 VOSWVNWARDSHBR-OAQYLSRUSA-N 384.479 5.546 30 20 GKED Cc1csc([C@H](C#N)C(=O)CSC(c2ccccc2)c2ccccc2)n1 194844886 SOEBYWRXCXEEJO-GOSISDBHSA-N 378.522 5.151 30 20 GKED CC[C@@H]1c2ccsc2CCN1CC(=O)Nc1ccccc1S[C@H](C)CC#N 247218804 SJDJUGBYFUORLI-CRAIPNDOSA-N 399.585 5.090 30 20 GKED N#CCC[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccccc1 301785599 LLBWBLVWZUIFMA-HXUWFJFHSA-N 390.874 5.444 30 20 GKED Cc1ccc(C)c(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 303202299 OODJQTOPWFGXML-SFHVURJKSA-N 380.900 5.499 30 20 GKED Cc1ccc(C)c(N=C(O)[C@@H](C)N2CCC([C@H]3C(O)=Nc4ccccc43)CC2)c1 328682075 CVOMWQADQXVECB-VGOFRKELSA-N 391.515 5.377 30 20 GKED CC1(C)SC[C@@H]1/N=C(/O)C12CCC(/C(O)=N/[C@@H]3CSC3(C)C)(CC1)CC2 328748991 PWLHESBNTVWLAK-LWYUSKRHSA-N 396.622 5.028 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1CCC(F)(F)F 425664696 ULWVHIZEFCMOBH-CQSZACIVSA-N 375.394 5.278 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431811178 QMCHQHDASLNZKT-GCJKJVERSA-N 379.504 5.269 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432631995 LFNAONVAEABHCH-JOCHJYFZSA-N 376.504 5.152 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(F)c(Cl)cc1Cl 436341812 PCGINNDVXGYTLR-KSSFIOAISA-N 377.246 5.044 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CC[C@@H](CSc3ccccc3)C2)c1 438139609 LXBXJGOBAKGNSY-GOSISDBHSA-N 382.529 5.288 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Nc2ccc(O)cc2)cc1Cl 443556263 DUZPTAAEZBCEIK-IBGZPJMESA-N 377.831 5.345 30 20 GKED COCC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 453336957 GEFORHMVSPCDKG-YJYMSZOUSA-N 380.385 5.145 30 20 GKED Cc1ccc([C@H]2OCCC[C@H]2CNC(=O)Nc2ccc(CC#N)cc2Cl)cc1 455706773 QRJBSRFXJADBOK-GHTZIAJQSA-N 397.906 5.004 30 20 GKED CCN(C(=O)Nc1cccc(CC#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 455909341 BCFOHRZXZSSBDO-AWEZNQCLSA-N 375.394 5.386 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c1 458802001 OLELBLWYZHKFIF-GMAHTHKFSA-N 375.516 5.238 30 20 GKED CC(=O)c1csc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)c1 460151545 PMKYPDAKYGKOSH-UHFFFAOYSA-N 394.883 5.323 30 20 GKED Cc1cccc(Br)c1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 464399869 SIORGTAEPQCWML-CYBMUJFWSA-N 398.087 5.059 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1 476658334 IISPCJAHAAUGDX-QGZVFWFLSA-N 386.417 5.136 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1-c1c(F)cccc1F)c1ccccc1 476874564 YPWWWSVSWTZMKE-QGZVFWFLSA-N 376.406 5.658 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nnn(-c2ccc(C)cc2)c1C)c1ccc(F)c(F)c1 480658255 BDWHZOXDQBHLOU-BTYIYWSLSA-N 382.458 5.130 30 20 GKED CCN(C(=O)c1cc(C)n(-c2ccc(Cl)cc2)n1)c1ccc(C#N)c(Cl)c1 480859333 XRWXFYBAFMQHER-UHFFFAOYSA-N 399.281 5.026 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cnc4ccccc4c3C)n2)cc1 484555161 HJUPZPNGGHPEKG-GOSISDBHSA-N 383.476 5.465 30 20 GKED O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)[C@H]1CCC[C@H](C(F)(F)F)C1 505445604 KHMMMJKGUOEZOQ-MWODSPESSA-N 389.286 5.053 30 20 GKED N#C[C@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccc(Cl)cc1 505816342 WKBGKZYBPSKBBF-KRWDZBQOSA-N 383.904 5.044 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NCCCc3ccccc3)c2)cc1 509891622 VFFLIEPUAKRIDA-UHFFFAOYSA-N 399.494 5.086 30 20 GKED CC[C@H]1CCCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511398746 OGWKAWSQZJNEPI-SIKLNZKXSA-N 391.515 5.422 30 20 GKED CN(C(=O)NCC(C)(C)CCC#N)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 513113846 STKZDMRYKDALNR-MSOLQXFVSA-N 395.469 5.313 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)c1ccc(COc2ccccc2C#N)o1 515638449 OIZDLGSJAGVNCQ-UHFFFAOYSA-N 388.467 5.091 30 20 GKED CCO[C@@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1 516340262 ODOWUNKTMVTXCK-OAQYLSRUSA-N 388.492 5.102 30 20 GKED C[C@@H](NC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccc(C#N)cc1 516603395 HBIKZIYXDOPCQR-GOSISDBHSA-N 379.463 5.052 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c(C)s1 518207621 PUMOYPGVHVOHOY-IBGZPJMESA-N 382.529 5.006 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2F)o1)c1ccc(Cl)c(Cl)c1 518849184 RHCASROOLHZOCG-MRXNPFEDSA-N 389.213 5.387 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccs1 520197892 SKKKOHYSJSIBSB-DOTOQJQBSA-N 387.574 6.051 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc2c1CN(c1nccs1)C2 534026357 KYFHFSRFPYYJCR-UHFFFAOYSA-N 396.560 5.264 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)c1ccccc1 534647677 SGFMAUFKXRYJNW-HKUYNNGSSA-N 376.525 5.362 30 20 GKED Cc1csc([C@H](C)NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 535588221 LUNDPZVCMZZOKW-ZDUSSCGKSA-N 397.887 5.260 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(-c2ccc(F)cc2)cc1 535851243 NUDILKQDFKOQHK-KRWDZBQOSA-N 387.458 5.267 30 20 GKED C[C@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(C#N)c(F)c1 537404860 QMPIFSZRCJFJSB-ZDUSSCGKSA-N 377.444 5.418 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(c4ccccc4C(F)(F)F)CC3)cc2)CC1 538559193 BOPBWMSEKBKDRF-UHFFFAOYSA-N 398.428 5.280 30 20 GKED CC(C)(C)c1cc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)n(C(C)(C)C)n1 541447069 NNLAMWOERUOYJV-UHFFFAOYSA-N 393.535 5.004 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccs2)o1)c1nc2cc(Cl)ccc2s1 543057657 LGELBZSZYHOXKA-LLVKDONJSA-N 384.869 5.761 30 20 GKED COc1cc(-c2noc(-c3ccc(C#N)cc3C)n2)cc(Cl)c1OC(C)C 545525860 BBDKJTVETQHIQR-UHFFFAOYSA-N 383.835 5.033 30 20 GKED N#Cc1cc(C(=O)Nc2cc(F)c(Br)cc2Cl)ccc1Cl 547374923 MISWUAHHCGUAKB-UHFFFAOYSA-N 388.023 5.019 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCC[C@H]3c3ccccc3)cc2)nc1 547382157 BDTIARWKDADLRU-QFIPXVFZSA-N 383.451 5.113 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Br)cc1Cl 547607246 LBQKIOTYSRWAAA-UHFFFAOYSA-N 382.710 5.633 30 20 GKED CC(C)Oc1ccc(Br)cc1NC(=O)c1ccc(C#N)c(Cl)c1 548615950 GUZQLFOSOYAONZ-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C=CCN(CCC#N)C(=O)c1oc2ccccc2c1CSc1ccccc1F 557387107 OGMVVXYOGJTTBU-UHFFFAOYSA-N 394.471 5.406 30 20 GKED C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)CCCCOc2cccc(C#N)c2)C1 561276199 RRXRIKCDWRUXQR-CVDCTZTESA-N 376.500 5.107 30 20 GKED C[C@H](NCc1ccc(C#N)cn1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 561349571 WGTCRZPBPPUOMN-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED N#CCCN(C(=O)c1ccc2cc(Br)ccc2c1)c1ccc(F)cc1 562626440 DLFASSRQKOITRQ-UHFFFAOYSA-N 397.247 5.302 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CCc2cccc(O)c21 565753104 MANXUFRSCKXQFF-HXUWFJFHSA-N 384.435 5.033 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@H]1c1cccs1 574945208 WXIXUNZXLNDKPI-SFHVURJKSA-N 387.512 5.082 30 20 GKED Cc1ccc(-c2nnc(-c3ccc(C(=O)Nc4ccccc4CC#N)cc3)o2)cc1 581442647 PCAZQILMLCWXBG-UHFFFAOYSA-N 394.434 5.030 30 20 GKED C=C(C)COc1cccc(NC(=O)c2[nH]c3ccccc3c2Br)c1 589553097 UUSHAXPWQQXDNT-UHFFFAOYSA-N 385.261 5.138 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1oc2ccc(OC)cc2c1C 592537345 LICSDFNTTXDYLM-INIZCTEOSA-N 396.462 5.348 30 20 GKED Cc1ccc([C@H](C)N(C(=O)CC2(C#N)CCOCC2)c2cc(C)ccc2F)cc1 598827915 KTGUULZCZYPDFM-IBGZPJMESA-N 394.490 5.247 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3nc(-c4ccccc4)cs3)c2C#N)C1 603727109 COEATTFKKJJVOX-GFCCVEGCSA-N 379.510 5.120 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)sc1-c1ccc(F)cc1 605363164 MJLWEHCBGOOOIG-MRXNPFEDSA-N 389.455 5.537 30 20 GKED CC(C)C[C@H](NC(=O)NCc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608860975 TXYRAHLDVJOPCV-IBGZPJMESA-N 389.421 5.164 30 20 GKED Cc1oc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1C 609110818 UBGTYPOIFYDSIH-UHFFFAOYSA-N 378.403 5.047 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1O[C@H](C)c1ccccc1 609652330 OPXBKLWPDJOLJS-QZTJIDSGSA-N 386.451 5.104 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609725207 NJEIUJXWWZLEMO-UHFFFAOYSA-N 394.780 5.194 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1cccc(COc2ccccc2)c1 615879357 FCDRHOBHLWUBMX-UHFFFAOYSA-N 392.524 5.225 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)cc1CO 615894206 QBNKINGOTCLSCE-UHFFFAOYSA-N 386.451 5.020 30 20 GKED C[C@@H](c1ccc(C(=O)N[C@@H](c2cc(F)ccc2F)C(F)F)cc1)C(F)(F)F 622566708 WATRRGYQHXDSFE-VFZGTOFNSA-N 393.302 5.367 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c2ccccc2n1 677973756 HLNIAXVIHXSPFQ-INIZCTEOSA-N 389.455 5.597 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2cccc(C#Cc3cccs3)c2)C1 680450960 XUTJBPGVVJJKKQ-JTSKRJEESA-N 387.508 5.158 30 20 GKED C=CCSc1ccccc1C(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 681594220 WQRURFAZPXTVNJ-TXEJJXNPSA-N 397.384 5.168 30 20 GKED COc1ccccc1/C(C)=C\C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 727627244 DHLNBJOUTWJKQQ-LMRWQKIVSA-N 382.872 5.238 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCc2ccc(OC(F)F)cc2)c1 728182525 VULBPQLAVAXIIB-UHFFFAOYSA-N 395.405 5.028 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416243 BYYLHPIZXZSRRT-CQSZACIVSA-N 395.390 5.028 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416532 FLGCSYXSJYECKA-RHSMWYFYSA-N 396.487 5.511 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2cc1C 730421695 NLFBKWMTXJVGFF-MRXNPFEDSA-N 378.428 5.217 30 20 GKED COc1ccccc1C[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 730688449 XEZJAPOLCVESHJ-LPHOPBHVSA-N 390.508 5.264 30 20 GKED CC(C)Oc1ccc(/C=C/C(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 741447077 GWHVGLWOTFMIQM-CXUHLZMHSA-N 398.524 5.086 30 20 GKED C=CCOc1ccc(CNc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)cc1 742388070 KLSINCPQAOJXBM-QGZVFWFLSA-N 382.504 5.449 30 20 GKED COc1cc(/C=C2\CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)ccc1SC 746341684 GPRNAVIDVZMMAC-OTYYAQKOSA-N 381.453 5.155 30 20 GKED Cc1ccccc1[C@H](OC(=O)[C@@H](C)Oc1ccc(C#N)cc1)c1cccs1 748501827 FLEPAGOBRDJOGQ-IERDGZPVSA-N 377.465 5.028 30 20 GKED C[C@H](N[C@@H](C)c1cc(Br)cc(Cl)c1O)c1ccc(C#N)cc1 756456473 MXZKVBKIYOYBRP-QWRGUYRKSA-N 379.685 5.092 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccncc1 759223428 UKADTUDRPTYDFH-FZMZJTMJSA-N 389.402 5.080 30 20 GKED C[C@H](ON=Cc1cccc(F)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 760417034 QIUXVMDTRIMXQB-JTQLQIEISA-N 380.206 5.294 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@H](C)c2cc(F)cc(F)c2)c1C(F)F 769699851 PSBKURRJBXZPEB-SSDOTTSWSA-N 398.278 5.056 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2NCc2ccccc2)n1 776092542 FOVIHLDPTBNFEP-GOSISDBHSA-N 375.497 5.369 30 20 GKED C[C@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(OCC#N)cc1 777555145 MBHZRKXBUJWTON-INIZCTEOSA-N 395.478 5.420 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 782771983 DUAPPUABWCBDDO-GOSISDBHSA-N 395.528 5.623 30 20 GKED C=CCC[C@@H](C(=O)N1CCC([C@@H](O)c2ccccc2C)CC1)c1ccccc1 804515455 JWZRNTOJVDAWDK-DNQXCXABSA-N 377.528 5.017 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Oc3cccnc3)cc2)cc1Cl 809164693 ZCUCFYXASFBKIR-UHFFFAOYSA-N 380.860 5.208 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc(C)nc1C 814765786 SWTUTGUHDPGMGQ-UHFFFAOYSA-N 391.475 5.345 30 20 GKED N#CCn1c(C(=O)OCC[C@H](c2ccccc2)C(F)(F)F)cc2ccccc21 816473885 UDHRCLSQHMZFBE-QGZVFWFLSA-N 386.373 5.058 30 20 GKED C#CCCOc1ccc(CNc2cc(OC)ccc2NC(=O)OC(C)(C)C)cc1 816664651 YVXDLUHWBAVPIW-UHFFFAOYSA-N 396.487 5.056 30 20 GKED COc1ccc(/C=C/C(=O)c2sccc2Br)cc1OC(F)F 915112651 GSIZXLVCHLRFNS-DUXPYHPUSA-N 389.217 5.017 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351564 FHRGOISFYRSCOF-JOCHJYFZSA-N 389.886 5.659 30 20 GKED N#Cc1cccc(C(=O)/C=C/c2csc(-c3cccc(Br)c3)n2)c1 915992368 YZSLJZUWXXJEGW-BQYQJAHWSA-N 395.281 5.340 30 20 GKED COc1cc(/C=C/C(=O)c2ccccc2F)ccc1OCc1ccc(F)cc1 916136250 CUAGPHXUNCNYMU-XYOKQWHBSA-N 380.390 5.449 30 20 GKED Cc1cccc(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)c1 916153505 RYOBPYWYLTZMPQ-OUKQBFOZSA-N 379.463 5.198 30 20 GKED Cc1cccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916977194 MKJMDOCUJYUNKO-SFHVURJKSA-N 380.900 5.581 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CCCC1)c1nc2cc(Cl)ccc2s1 917046331 JHEDYIHSACUTRP-INIZCTEOSA-N 398.890 5.777 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C/C(=O)c2cc(Cl)sc2Cl)cc1 920064005 OOIOECKWWWSQHQ-QPJJXVBHSA-N 379.268 5.350 30 20 GKED CCOc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 920112696 HHHXHUHZSQEJNI-MRXNPFEDSA-N 384.888 5.157 30 20 GKED N#C[C@H](COC(=O)c1ccccc1SCc1ccco1)Cc1ccc(F)cc1 920876428 JWSFJVZLMGRECN-QGZVFWFLSA-N 395.455 5.250 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(COC2CCCCC2)c1 921167604 CRTCCSDZXFEXFI-UHFFFAOYSA-N 380.513 5.404 30 20 GKED C=CCCC1(C(=O)O)CCN([C@@H](C)c2ccc(Oc3ccccc3)cc2)CC1 1776168109 WHFJQAOSMJGTHC-IBGZPJMESA-N 379.500 5.673 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2sc3ccccc3c2Cl)c1)C(=O)O 1776472557 DZUYCNHIMXLTMT-BZYZDCJZSA-N 386.856 5.303 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2cccc(Cl)c2)s1 1776782971 STIUJBPJHIRDPM-SFHVURJKSA-N 393.980 6.362 30 20 GKED CCSc1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)cc1 1776950945 URVQDMQQYDUTPD-FPYGCLRLSA-N 391.286 5.155 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc4cc(Cl)ccc4o3)n2)cc1 19200783 GCOCXGIGJFBXIX-UHFFFAOYSA-N 379.828 5.334 30 20 GKED C[C@H](Sc1ccc2ccccc2c1)C(=O)Nc1sc2c(c1C#N)CCC2 22249607 QIJKMHGNFFMBOG-ZDUSSCGKSA-N 378.522 5.381 30 20 GKED CN(Cc1cccs1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 47565861 DCNQNBYZUAMCTA-LJQANCHMSA-N 395.915 5.721 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1C 47956370 BTWPUHWRNHFPKW-UHFFFAOYSA-N 399.494 5.467 30 20 GKED CC1CCN(c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)CC1 61077279 AYNDQJCOPIEJJP-UHFFFAOYSA-N 395.506 5.714 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc2c(s1)-c1ccccc1OC2 65839366 DZUHVMYXEWCPKB-UHFFFAOYSA-N 390.464 5.219 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1Cl 66954769 GBWAHNFKXIYYRR-BEFAXECRSA-N 399.947 6.103 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccccc2)n1)Cc1cccs1 102695028 DAXATRQFIFRVSG-UHFFFAOYSA-N 383.542 5.077 30 20 GKED O=C(Nc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(C(F)(F)F)c1 109273858 OUHNBRNQKUHGCO-UHFFFAOYSA-N 381.247 5.038 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(OC(F)(F)F)cc2)c1 113952509 SVYDTIFCYNKEHT-RHSMWYFYSA-N 378.394 5.117 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(-c2ccncc2)cs1 114621172 DFUKWYVJKQYLMS-FQEVSTJZSA-N 397.459 5.487 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(C[S@@](=O)C2CCCCC2)c1 116685931 ADEWFSWBFKGYBM-NDEPHWFRSA-N 397.540 5.085 30 20 GKED CCOc1ccccc1C(F)(F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 131862664 FVYDRUJIBSJSER-AWEZNQCLSA-N 390.455 5.210 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CC1CCSCC1 136942264 UTWMINMVOTZYAE-UHFFFAOYSA-N 388.480 5.183 30 20 GKED CC(C)c1cnc(NC(=O)c2ccccc2Sc2ccccc2C#N)s1 145381024 BWFKOGIKWMYILW-UHFFFAOYSA-N 379.510 5.542 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 171369757 CWRZEWYFKYLDIX-UHFFFAOYSA-N 394.862 5.073 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](C)C(=O)c1cccc(F)c1 174730069 JZWXNXQOLLNMGV-CABCVRRESA-N 384.476 5.068 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2ccoc2)c1)c1nc2ccccc2n1C(F)F 179356804 PTJYKQGBSYJJFL-INIZCTEOSA-N 377.350 5.181 30 20 GKED CC[C@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 183841221 NYWXFMOEZZLVRV-OAHLLOKOSA-N 382.460 5.286 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1 193052446 HNKBOILKDQUIJV-UHFFFAOYSA-N 386.499 5.381 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1cccc(Br)c1 210112094 OAQKLKZZSQBKHN-QXMHVHEDSA-N 394.268 5.319 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1c1nccn1CC 281022154 MMTRBPVVGPJELG-HXUWFJFHSA-N 380.536 5.514 30 20 GKED C[C@@H]1CCC[C@H](/N=C(/O)C2CCN(c3noc4ccc(Cl)cc34)CC2)C1 328712498 RSXXLXRIIXYZRP-CJNGLKHVSA-N 375.900 5.233 30 20 GKED Cc1csc([C@H](/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)C2CC2)n1 329414862 CRDQONXMVZIJNZ-IEBWSBKVSA-N 398.576 5.366 30 20 GKED Cc1c(Br)cccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330009536 GHILBGSRLUYNDQ-UHFFFAOYSA-N 379.298 5.271 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccc2nc(C3CC3)sc2c1 330299017 HTKXPPFRQLYSRL-CYBMUJFWSA-N 399.541 5.469 30 20 GKED CC(C)c1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)c(C(C)C)c1 424061475 FIOOVPIKOBQOIV-SFHVURJKSA-N 384.549 5.017 30 20 GKED CC[C@@](C)(C#N)c1nc(C2(c3ccc(Br)c(Cl)c3)CCC2)no1 426593985 BUCOELMKDUSKRT-INIZCTEOSA-N 394.700 5.147 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(C)c1C(=O)N1CCCC1)c1ccccc1 435664022 QMTFBPQREUFTTL-HXUWFJFHSA-N 391.515 5.060 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc(CCc2ccccc2)no1 439270379 GWLHLFNBGSPSNX-UHFFFAOYSA-N 398.491 5.081 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1sc2cccc(F)c2c1COC 461673854 LUNHXTZJDVMLBB-UHFFFAOYSA-N 397.475 5.133 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@@H](OC)c1ccc(Cl)cc1 466088285 ZWCXHCWBTPMHMR-MRXNPFEDSA-N 399.343 5.140 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2cc(Br)ccc2[nH]1 476803533 YNWZXYZKMYGYON-UHFFFAOYSA-N 397.316 6.035 30 20 GKED CCCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1ccc(C)cc1 477092214 SRAZMFJCDHZDJH-UHFFFAOYSA-N 386.499 5.187 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC[C@@H](C)C1 480603607 SQVAPACMJZFMJW-QGZVFWFLSA-N 377.488 5.100 30 20 GKED Cc1ccc(C#N)cc1NC(=O)NCc1nc(-c2cc3ccccc3o2)cs1 480622286 GFFGLTULFFIBEZ-UHFFFAOYSA-N 388.452 5.058 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2ccc(-c3ncon3)cc2)cc1 480875310 MEKCTZCZRHYUMA-UHFFFAOYSA-N 398.447 5.012 30 20 GKED N#Cc1ccc(CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C2CC2)cc1 482542342 GLJDVJSFNXBARB-UHFFFAOYSA-N 393.446 5.027 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)C2CC2)cc1 498356429 SLTXOMZXIKNFTG-QFIPXVFZSA-N 389.474 5.007 30 20 GKED C=CCOc1ccccc1CNc1ccc(F)c(NC(=O)Cc2ccccc2)c1 501002411 NHUULHGWYTURHV-UHFFFAOYSA-N 390.458 5.184 30 20 GKED Cc1c(C#N)c(S[C@H](C)c2nnc(-c3cccc(Cl)c3)o2)nc2c1CCC2 501393882 CVKHITFECQVRBS-GFCCVEGCSA-N 396.903 5.307 30 20 GKED C[C@H](NC(=O)Nc1cccc(C#N)c1)c1ccc(NC(=O)Nc2ccccc2)cc1 502670634 PZJHQULKKGNAND-INIZCTEOSA-N 399.454 5.085 30 20 GKED O=C(CC1(C(F)(F)F)CC1)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 504337197 RXENBYACRPZVJL-NSHDSACASA-N 393.249 5.158 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2ccc(F)cc2C(F)(F)F)cc1 505797052 RZIGYUNAPBYHEP-QGZVFWFLSA-N 378.369 5.137 30 20 GKED COc1cc(CN2CCC(C)(C#N)CC2)ccc1OCc1ccc(Cl)cc1 507710917 VYLUOYUWZMWSKC-UHFFFAOYSA-N 384.907 5.053 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Cc2cc3c(ccc4ccccc43)o2)cc1 510008947 AYQYCICQYJGOIJ-UHFFFAOYSA-N 399.450 5.075 30 20 GKED O=C(Nc1cc(F)c(F)c(F)c1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 510049250 LFIVTIIEPUYVES-CYBMUJFWSA-N 380.263 5.058 30 20 GKED COc1ccc(CN(C2CC2)[C@H]2CCc3ccccc32)cc1OCCCC#N 510660836 HXVSYHQQSHXJRA-QFIPXVFZSA-N 376.500 5.030 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(F)c(F)cc1Cl 511571193 AOTABZPHVULCEZ-UHFFFAOYSA-N 398.796 5.843 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cscc3Br)cc2)c1 511728696 ZYQRGOYSRKEJPR-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(-c2ccccc2)[nH]1 513556942 QAEWIESXWKLXPX-UHFFFAOYSA-N 385.511 5.171 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)c1 515615499 XIGRGAVHTOERIK-RBUKOAKNSA-N 388.389 5.130 30 20 GKED N#C[C@H](NC(=O)Cc1csc2ccccc12)c1cccc(Cl)c1Cl 517494428 ZWYPSJPWTAOJGE-HNNXBMFYSA-N 375.280 5.132 30 20 GKED COc1cccc(Oc2ccc(CNc3ccc(C#N)c(C(F)(F)F)c3)cn2)c1 518815408 ULYSLRQWSCGNLR-UHFFFAOYSA-N 399.372 5.385 30 20 GKED N#Cc1ccsc1NC(=O)Cc1cccc(OCc2cccc(Cl)c2)c1 520724306 KQJWRJPJMVYVOU-UHFFFAOYSA-N 382.872 5.033 30 20 GKED N#Cc1ccc(/C=C(/CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)cc1 520764416 XEKFNAWCOSHDBH-QPEQYQDCSA-N 388.370 5.202 30 20 GKED C[C@@H](SCCC(=O)Nc1sc2c(c1C#N)CCC2)c1ccc(Cl)cc1 521019332 ACGBRZIIFYEWHT-GFCCVEGCSA-N 390.961 5.585 30 20 GKED C[C@@H](SCC(=O)Nc1ccccc1SCC#N)c1ccc(Cl)cc1 521025438 XJKUAMFWVOKROM-CYBMUJFWSA-N 376.934 5.389 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 524380785 YGHIWDODCNUHTK-UHFFFAOYSA-N 390.439 5.078 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(NCc2cccc(OCCCC#N)c2)cc1 533211830 RBOCGMNVILZMAV-HXUWFJFHSA-N 377.532 5.356 30 20 GKED C=CCC[C@@H](NCc1cccc(C(=O)N(C)C)c1)c1ccc(C(F)(F)F)cc1 539334123 NYOYFYLQILAOFH-HXUWFJFHSA-N 390.449 5.204 30 20 GKED CC[C@@H]1C[C@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 541002239 FQANBMHJOJDJTK-WIYYLYMNSA-N 396.918 5.340 30 20 GKED CCCCSc1ccc(C(=O)N2CCC(C)(C#N)CC2)cc1C(F)(F)F 545493227 NSYJLVSHEOSUMD-UHFFFAOYSA-N 384.467 5.363 30 20 GKED N#Cc1ccc(CSCc2nc(-c3cccc(-c4cscn4)c3)no2)cc1 546558961 JOUSSQOYKYFYNK-UHFFFAOYSA-N 390.493 5.165 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)NC1(c2cccc(C#N)c2)CC1 551574058 CETPISDEHZFBDR-HNNXBMFYSA-N 377.488 5.469 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)CCOCc1ccccc1 554440593 ALVLVSWYDMGIRD-QZTJIDSGSA-N 397.544 5.055 30 20 GKED N#Cc1ccc(CNCc2nc3cc(Cl)ccc3s2)c(C(F)(F)F)c1 558483148 BJTCDOZGFGKAMW-UHFFFAOYSA-N 381.810 5.130 30 20 GKED N#CCCC[C@@H](NCc1ccc(Cl)c(Br)c1)c1ccccc1 560563539 ADFBOKNIWDRYCN-GOSISDBHSA-N 377.713 5.627 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)c2c1 565381278 WRAQYSKFPYMWJY-QGZVFWFLSA-N 387.464 5.565 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)Nc1cc(C#N)ccn1 565969123 REFSTYPEWMYZID-LLVKDONJSA-N 399.317 5.321 30 20 GKED N#CC1(c2ccccn2)CCN(C(=O)Nc2ccc3c(c2)oc2ccccc23)CC1 566725724 QPETXKCYBBUMHM-UHFFFAOYSA-N 396.450 5.070 30 20 GKED CC(C)(C)Cc1nc(-c2cccc(C(=O)Nc3ccc(Cl)c(C#N)c3)c2)no1 568702342 FHZQJXBGMPAHIG-UHFFFAOYSA-N 394.862 5.103 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@H](CC3CC3)C2)cc1 572395811 ZHSBHRPTVXMRMK-HXUWFJFHSA-N 376.525 5.113 30 20 GKED N#CCCN(C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccc(F)cc1 574496463 ATCIAMSCZCTVEA-UHFFFAOYSA-N 379.822 5.102 30 20 GKED Cc1ncsc1/C=C\C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 588518295 BKAPTHCPVYCTCH-WAYWQWQTSA-N 397.447 5.128 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)c1 589739568 VCQOINURIAYSGY-UHFFFAOYSA-N 395.890 5.366 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2cc(Cl)ccc2SC(C)C)CC1 592338985 YOXJWUOFJUSLNV-UHFFFAOYSA-N 381.973 5.003 30 20 GKED N#Cc1ccc(C[S@](=O)Cc2csc(C3CCCCC3)n2)c(Cl)c1 593201885 GOEVWDUPHVTDKW-DEOSSOPVSA-N 378.950 5.165 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N1CCC[C@@H](CC#N)C1 596793891 QLCWRFALQJJVIC-AWEZNQCLSA-N 386.293 5.068 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 601161058 LBQVSEFSKMODTA-UHFFFAOYSA-N 398.551 5.164 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H]1CCCc2ccccc21 609399234 JDHUIJMCCMLQPW-OXQOHEQNSA-N 379.529 5.480 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1S[C@@H](C#N)C1CCCCC1 609648776 ZXMXEBKFSWDXNW-FQEVSTJZSA-N 398.576 5.468 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@H]2C2CCCCC2)cc1 610205624 RNXCSTKMEZTZPC-VXKWHMMOSA-N 390.552 5.549 30 20 GKED N#Cc1cccc(C2(NCc3cn(Cc4ccccc4)c4ccccc34)CC2)c1 610971947 BTUDZKCRSRZLPW-UHFFFAOYSA-N 377.491 5.340 30 20 GKED CCCOc1c(Cl)cc(CNCc2ccc(C#N)c(Cl)c2)cc1OCC 619748468 LWVNIXDGXQQXEB-UHFFFAOYSA-N 393.314 5.342 30 20 GKED Cc1c([C@H](C)NCc2ccc(C#N)c(Cl)c2)cnn1-c1cccc(Cl)c1 619754975 PTCWVYXJZZCBNQ-ZDUSSCGKSA-N 385.298 5.210 30 20 GKED N#C[C@@H](C(=O)c1cc[nH]c1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 672581934 ZMYPFCNRMWXLTQ-LBPRGKRZSA-N 375.375 5.011 30 20 GKED C#CCOc1cccc([C@@H](C)OC(=O)Cc2sc(C)nc2-c2cccs2)c1 730700275 QLVOLFOVIVWSKR-CQSZACIVSA-N 397.521 5.039 30 20 GKED C[C@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)c1cccc(C#N)c1 730923952 IWJNITQUEKCGAT-LBPRGKRZSA-N 386.329 5.150 30 20 GKED Cc1sc2ncnc(NN=Cc3c(Cl)cccc3OC(F)F)c2c1C 732924560 YFIFSHZVRTVUKP-UHFFFAOYSA-N 382.823 5.009 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cc2ccccc2o1 733080566 QNMOBOVXVRJLKZ-UHFFFAOYSA-N 397.360 5.140 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc3c(c2)c2ccccc2n3CC)c1 733800743 HUNHPWRCNNTKJP-OAQYLSRUSA-N 397.522 5.785 30 20 GKED C=CC[C@@H](NC(=O)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccncc1 734456009 QINQHTUJSPWXNY-QGZVFWFLSA-N 383.904 5.214 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](CCc1ccccc1)c1ccccc1)c1ccncc1 734659458 CNXMWDMDFCXEOL-DNQXCXABSA-N 385.511 5.372 30 20 GKED CCc1ccc(NC(=O)[C@H](C)SCc2cc(Cl)ccc2OCC#N)cc1 735320282 PEYAVNQLDSCOTA-AWEZNQCLSA-N 388.920 5.065 30 20 GKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1c(Cl)nc2ccccn12 737450295 RLLWDPXXBGDJPX-CSKARUKUSA-N 393.786 5.052 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1ccc2c(c1)COC2 743445500 XMEOOFWFJXWVIV-UHFFFAOYSA-N 377.391 5.181 30 20 GKED C#CCN(C(=O)c1ccc(CSc2nc(C)cs2)cc1)C1CCCCC1 744001540 VMCLDRMZQCJJGU-UHFFFAOYSA-N 384.570 5.152 30 20 GKED Cc1ccc(N(Cc2nnc(-c3ccc(C#N)cc3)o2)Cc2cccs2)cc1 744396680 PLEXHJZDIOXSMI-UHFFFAOYSA-N 386.480 5.185 30 20 GKED N#Cc1ccc(CN(Cc2ccccc2Cl)c2ccc3nc(O)[nH]c3c2)cc1 744406520 JXQOFHGAEBCPNW-UHFFFAOYSA-N 388.858 5.000 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1cccc(OCC#N)c1 746662875 ITLYBJBTPKMDAC-KRWDZBQOSA-N 391.496 5.446 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Br)s1)c1ccc2ccccc2n1 747103597 CITOZLKOQUNJII-HNNXBMFYSA-N 399.313 5.258 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 747105626 UFQOZZYNCBLBEV-XHDPSFHLSA-N 399.277 5.478 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cc3cccc(OCC)c3o2)cc1OC 750901327 DSAUIPMRHZBEFG-ZHACJKMWSA-N 396.439 5.144 30 20 GKED CC(CCc1ccc(OC(F)F)cc1)=NNc1nc(C(F)(F)F)cs1 755901599 XIJORTQYNSXSEU-UHFFFAOYSA-N 379.354 5.184 30 20 GKED CC(C)c1ccc(N(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 763636698 ZWENWWSVHYBXSI-KRWDZBQOSA-N 381.545 5.137 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2ccc(Sc3ccc(F)cc3)cc2)cc1 773428486 ZHZPCPDQXPCECD-KRWDZBQOSA-N 392.499 5.558 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)[C@@H](O)c2ccc(C#N)cc2)cc1 780966271 YLOYADLTFAVBPR-ZHRRBRCNSA-N 388.492 5.084 30 20 GKED C[C@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1cccc(C#N)c1 781873503 QDQXOVSKVHXIIJ-ZETCQYMHSA-N 390.053 5.485 30 20 GKED N#Cc1ccc(OCCCn2ccc(=O)c3cc(Oc4ccccc4)ccc32)cc1 786878445 XIHHRTDRDDWOLV-UHFFFAOYSA-N 396.446 5.135 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Br)s1)c1nccc2ccccc12 792092208 PEVLMKQTNWPAAS-MRXNPFEDSA-N 399.313 5.258 30 20 GKED CC(C)[C@H]1CCCN1c1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1F 803042431 DBPCMLNNFVWCSC-LJQANCHMSA-N 385.870 5.228 30 20 GKED Oc1ccc(Br)cc1C=Nc1ccc(SCc2cccnc2)cc1 812413429 RIXZRXMCUHTBLF-UHFFFAOYSA-N 399.313 5.593 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccc(C(F)(F)F)c1 819440316 QGWYIRISWDTKOF-CXAGYDPISA-N 380.435 5.245 30 20 GKED N#C[C@H](CCc1ccccc1)c1nc(-c2ccccc2OCc2ccccc2)no1 904465544 UQEKPADCCAQQKO-NRFANRHFSA-N 395.462 5.556 30 20 GKED CCCCCCCCOc1ccc(C=Nn2cnc3ccccc3c2=O)cc1 916369747 LGOYDOXATKGVNI-UHFFFAOYSA-N 377.488 5.018 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc(OC)c1O 917144821 PBZRQTWBPGFRAZ-CSKARUKUSA-N 394.398 5.237 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OC)c(OC2CCCC2)c1 918035098 DFCLWUVIXIWTNG-UHFFFAOYSA-N 398.478 5.376 30 20 GKED CCCCCCCCCC(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 918672875 UTXKVJBDESOVTJ-OKILXGFUSA-N 375.397 5.716 30 20 GKED Cc1ccc(CN(C(=O)c2ccccc2OCC#N)[C@@H]2CCc3ccccc32)cc1 920003743 NBKBPXZEJYJPQK-XMMPIXPASA-N 396.490 5.227 30 20 GKED CC(CCCCCCC(=O)O)=NNc1nc(C)nc2sc3c(c12)CCCC3 1776021141 CIYSMEWOOWKYRY-UHFFFAOYSA-N 388.537 5.092 30 20 GKED Cc1c(NN=Cc2cccc(OCc3ccc(Cl)cc3)c2)cccc1C(=O)O 1776090123 VLBGOMDSUYHMBF-UHFFFAOYSA-N 394.858 5.372 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2cnc(-c3ccc(C(C)C)cc3)s2)C1 1776155388 ZLAOHWNPBPOLMC-QFIPXVFZSA-N 384.545 5.176 30 20 GKED C=CCCC[C@@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 1776171109 OWLNMDYWGVBMAY-LJQANCHMSA-N 391.870 5.479 30 20 GKED C=CC[C@@H](NCc1ccc(Cl)cc1Oc1ccc(Cl)c(F)c1)C(=O)O 1776185899 XGAVNOKVYMDFLD-MRXNPFEDSA-N 384.234 5.044 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C/C(=O)c2cccc(C(=O)O)c2)cc1Cl 1776353659 SGXSOMQCQBJSJX-VOTSOKGWSA-N 379.239 5.375 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)CO2 1776374726 VPHVVZCRNFOFDX-XKZIYDEJSA-N 398.458 5.834 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cs1 1776380474 GCAZJTDAGREBHU-DHZHZOJOSA-N 391.492 5.457 30 20 GKED C[C@@H]1/C(=C/c2cc(C(=O)O)c(Cl)s2)C(=O)c2cccc(Br)c21 1776586649 JTICKSAYNNFUFQ-SUKXWOPLSA-N 397.677 5.246 30 20 GKED CCCCCCCCCCCN(C)[C@@H](C(=O)O)c1cccc(Br)c1 1776785158 GNDCPSPLQWWSCC-LJQANCHMSA-N 398.385 6.037 30 20 GKED CCCCCCCOc1ccc(/C=C\C(=O)c2cccc(OCC(=O)O)c2)cc1 1776785873 GJTPMMSSMPGIBH-QINSGFPZSA-N 396.483 5.395 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)oc2ccccc12 1776956365 VIXRQCNJWQYKIF-ACCUITESSA-N 386.403 5.850 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)ccc1SC(F)F 1777263354 ITPBBYFFPWJTSD-STGKXFFCSA-N 390.407 5.004 30 20 GKED Cc1oc(/C=C/C(=O)c2ccccc2Oc2cccc(Cl)c2)cc1C(=O)O 1777559582 QTQHSGJJFPCUFR-MDZDMXLPSA-N 382.799 5.628 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1nc2ccccc2o1 51899920 ZIZJCJHTDWUIDR-GFCCVEGCSA-N 379.828 5.095 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2cccc(C)c2)cs1)c1ccc(F)cc1F 52733575 MVVKDHZUJNYRNM-VQHVLOKHSA-N 398.434 5.310 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1cccc(Cl)c1Cl 56199966 KBPYGCPJQBCAGQ-ZDUSSCGKSA-N 392.286 5.115 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCOc3ccccc3C#N)o2)cc1 60427484 VMJIGICBOOZNLH-UHFFFAOYSA-N 379.485 5.077 30 20 GKED C[C@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 62698156 INGZHKXYWSQMHR-NEPJUHHUSA-N 390.961 5.583 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)CCc2ccc3ccccc3c2)cc1 65870214 XFKJUKQJHGQDJO-UHFFFAOYSA-N 398.506 5.225 30 20 GKED N#C[C@@H](C(=O)[C@H](Sc1ccc(F)c(F)c1)c1ccccc1)c1ccccn1 106353749 CFEVEPGLLZKHJV-IIBYNOLFSA-N 380.419 5.070 30 20 GKED CCc1cccc2c(CC(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c[nH]c12 109413344 LCYXEPNXGGQINE-IBGZPJMESA-N 385.492 5.273 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 121624490 QVIXPBMTJITTMR-JOCHJYFZSA-N 391.902 5.222 30 20 GKED Cc1c(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1CCC(C)C 160209279 CIHYSCSCPCINFK-OAHLLOKOSA-N 385.537 5.133 30 20 GKED CC[C@@H](C)Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 175119731 NJLRPCDBAYPGDD-CJNGLKHVSA-N 383.398 5.099 30 20 GKED COc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 175120150 PQFQOGMQZCJZEO-LRDDRELGSA-N 384.888 5.328 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 180075535 JCUYBJKIRKLHES-HOTGVXAUSA-N 383.517 5.361 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1ccc(-c2cccnc2)cc1 181231187 ACBUODPJGHBOCA-HNNXBMFYSA-N 392.300 5.234 30 20 GKED COC(=O)[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 190528317 ASKHFKDESXKZQI-SFHVURJKSA-N 393.270 5.002 30 20 GKED C[C@@H]1CSCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 192203253 QKKDKMXFCMZZJO-HNAYVOBHSA-N 399.947 5.212 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(C3CC3)n2)cc1Cl 195748026 SNTBXFFNYQPTFV-QGZVFWFLSA-N 393.899 5.582 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)Nc3ccc(Cl)c(C#N)n3)s2)cc1 301246711 BOTOPYGZOGMDIK-LLVKDONJSA-N 384.892 5.220 30 20 GKED CSc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 303461478 OKDPVYKESCHXNA-UHFFFAOYSA-N 398.871 5.358 30 20 GKED CC(C)(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1 329207948 YNGDPWYTHXQURF-MISYRCLQSA-N 391.577 5.594 30 20 GKED CC[C@@H]1C[C@@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329406400 CUPSUEPKKAPCIH-GTZGYLERSA-N 395.547 5.800 30 20 GKED CO[C@H](C)c1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 369987898 UEYXXDGKZGZNGS-HZPDHXFCSA-N 377.513 5.240 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC(F)(c2ccccc2)CC1 432866681 PBEVIFLRIWLPGO-KRWDZBQOSA-N 397.519 5.574 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1F 437461112 PKVMXUBNUWEUFW-AWEZNQCLSA-N 378.378 5.371 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438646035 FEQHFBKOLRRSEV-AWEZNQCLSA-N 395.459 5.304 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1SCc1ccc(C#N)c(C)c1 447307852 XWQFHWOPFVJLRA-UHFFFAOYSA-N 398.919 5.003 30 20 GKED N#Cc1ccc(NC(=O)N2Cc3ccccc3C[C@@H]2c2ccccc2)c(Cl)c1 448153334 FOXMPFNTEXSCSB-JOCHJYFZSA-N 387.870 5.543 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C)nc3C(C)C)n2)cc1 453631176 SJHKWGVNTPKIMS-GOSISDBHSA-N 391.496 5.136 30 20 GKED CCOc1ccc(Cl)c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 455773671 MWLPWUALXLOPAQ-PXNSSMCTSA-N 383.879 5.042 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 457777933 DDKKTNOIDQYRKQ-QMMMGPOBSA-N 395.265 5.271 30 20 GKED Cc1cc(C)cc([C@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c1 458802005 OLELBLWYZHKFIF-JTHBVZDNSA-N 375.516 5.238 30 20 GKED N#CCCN(C(=O)c1ccccc1C(F)(F)F)C12CC3CC(CC(C3)C1)C2 460472875 SJXKQCXPOWMQCW-UHFFFAOYSA-N 376.422 5.030 30 20 GKED N#Cc1ccc(C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)cc1 460504561 PQQRTFUIUKOCSQ-UHFFFAOYSA-N 376.456 5.136 30 20 GKED C=CCOCCCC(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 463110445 BVIZSEZMJKXASW-UHFFFAOYSA-N 381.259 5.102 30 20 GKED C[C@@H]1C[C@@H]1[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 466133152 UKVMYOLXYONADD-VOBQZIQPSA-N 381.907 5.660 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)NCc2cc(C#N)ccc2F)cc1 466202206 QQIYSJPOKMMUJS-NRFANRHFSA-N 379.479 5.042 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1CC(=O)OC(C)(C)C 467398921 CCOKCLYLUKGEPF-UHFFFAOYSA-N 386.536 5.171 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(-c2cccc(C#N)c2)no1 469329214 PECIZBIWGOWBPU-CYBMUJFWSA-N 399.372 5.065 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)Nc1cccc(OCCCC#N)c1 471908126 WDQMRODGAIZXCC-UHFFFAOYSA-N 379.504 6.089 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)c3ccc(C(C)(C)C#N)cc3)oc12 474289516 FDOSDSFWNLZSER-OAHLLOKOSA-N 376.456 5.124 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 474712340 UWGQCDHGRLSCJL-INIZCTEOSA-N 397.544 5.357 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1NC(=O)c1cccs1)c1ccccc1 475538088 QPELFKVSRQCYGO-KRWDZBQOSA-N 389.480 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1 475548828 OVEJOPIKWJWAEC-GGAORHGYSA-N 396.506 5.719 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(OC(C)(C)C)nc1 475559040 BOPWDDKTSLJARC-UHFFFAOYSA-N 381.520 5.433 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Br)ccc1Cl)c1ccccc1 475590882 SPVLBXFJXZTFDV-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 475974095 HEFRBYUDTKDBMC-UHFFFAOYSA-N 395.384 5.306 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(c3ccc(Cl)cc3)CC2)cc1 480476173 NZJIGCKAZDVFGJ-UHFFFAOYSA-N 381.907 5.553 30 20 GKED C=CCN1CCC(N[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)CC1 482617861 KZXGRJUFQOFCGB-SFHVURJKSA-N 387.980 5.081 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(Cc2nnc3ccccn23)cc1)c1ccccc1 488902186 VAXWLVDZQNBOPP-QFIPXVFZSA-N 396.494 5.009 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCCCCO[C@@H]1CCC[C@@H](C)C1 499297366 YGACTBNNUKUJHM-NFBKMPQASA-N 384.564 5.451 30 20 GKED N#CC1(CCCOc2c(Cl)cc(Br)cc2Cl)CCOCC1 499965067 WIESGOZYROWHJS-UHFFFAOYSA-N 393.108 5.235 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)NCc2cccc(C#N)c2)cc1 500242816 BLCIDMIKEWLHQO-UHFFFAOYSA-N 387.439 5.071 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Cc1ccc(Cl)s1 509512158 QNNWLNFECHDRAV-UHFFFAOYSA-N 396.899 5.342 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H]1CCCC[C@H]1C 510856625 HLDFEUGRULYLPE-OPAMFIHVSA-N 377.488 5.701 30 20 GKED N#Cc1ccc(N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c([N+](=O)[O-])c1 511394418 AHQYOPUAAGQFFC-INIZCTEOSA-N 394.431 5.219 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1ncc(-c2cccc(Cl)c2)o1 511414420 LFBJGNAFVOEEAB-UHFFFAOYSA-N 375.211 5.108 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c(C)n1C(C)C 515213477 PWPNNODCBHNUSI-UHFFFAOYSA-N 387.483 5.389 30 20 GKED CN(Cc1ccoc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 518183677 SAFYLLFGEKHRBE-LJQANCHMSA-N 379.847 5.252 30 20 GKED Cc1cc(C(=O)N(CCC#N)c2ccc(F)cc2)cc(Cl)c1Br 519006052 FGLJPAXCXICVBW-UHFFFAOYSA-N 395.659 5.111 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3c3ccccn3)c2)cc1 519198872 APZVTSVPPPIIKE-QFIPXVFZSA-N 384.439 5.115 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1csc(C2CC2)n1 519938937 DBJYJEJBPKFIBP-UHFFFAOYSA-N 391.471 5.187 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1cccc(CC#N)c1 521631842 WIZRTQPXGLEUFZ-ZDUSSCGKSA-N 395.915 5.329 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)NCCCCOCc3ccccc3)c2)cc1 523122950 FMFJZKMRWJVQLC-UHFFFAOYSA-N 399.494 5.029 30 20 GKED C[C@H](NC(=O)NC[C@H](C)c1c(Cl)cccc1Cl)c1ccc(C#N)cc1 523820655 WLMPBIGHVUZRGB-STQMWFEESA-N 376.287 5.029 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCCc1ccccc1 524388048 FXDYKXMNUOPPFO-UHFFFAOYSA-N 384.479 5.407 30 20 GKED CSc1cccc([C@@H](NCc2cccc(C#N)c2)c2cc(F)ccc2F)c1 525182379 OZIFISNCUPJHLE-JOCHJYFZSA-N 380.463 5.438 30 20 GKED COc1ccc(-c2nc(CN3CCC[C@@H]3[C@H](C#N)c3ccccc3)cs2)cc1 530970908 SGACSTVTVPCBCP-FGZHOGPDSA-N 389.524 5.090 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(OC2CCC2)cc1Cl 533939243 HWJSIKPAPYOKNN-UHFFFAOYSA-N 383.879 5.217 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 535348494 BYYRLPWLWSMZMG-LJQANCHMSA-N 384.479 5.546 30 20 GKED C[C@H](NCc1noc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541086370 OJDFWTMIQSYXGC-KRWDZBQOSA-N 380.451 5.126 30 20 GKED Cc1c(Cl)cnc(N2CCC[C@H]2c2nc3ccccc3n2C(C)C)c1C#N 543133762 IGVRFTZEQSHAEQ-IBGZPJMESA-N 379.895 5.187 30 20 GKED C=CCCO[C@H](C)c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 546295314 NRVGEKRXKFSVNB-SECBINFHSA-N 380.288 5.428 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 549212822 AXQNXSCPVHKYIS-OAHLLOKOSA-N 389.948 5.559 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2NCc2ccccc2)c1 552072837 AFKSTOKBPMNNQN-UHFFFAOYSA-N 396.277 5.729 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC1CC1)c1nc(-c2c(F)cccc2F)cs1 554007734 KBVNVUQLEZWEIF-AWEZNQCLSA-N 396.418 5.120 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 554860889 RZNWYYXNDYTQQY-KRWDZBQOSA-N 382.426 5.228 30 20 GKED COCc1c(Br)cccc1NCc1ccc(C#N)cc1C(F)(F)F 555092798 UOLYBMKONLDIBF-UHFFFAOYSA-N 399.210 5.098 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 557895593 WBBRNWGOBKSNGR-HBMCJLEFSA-N 394.396 5.343 30 20 GKED Cc1csc(NC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)c1C#N 562895586 NTJPRIUPXAJLMY-UHFFFAOYSA-N 393.415 5.323 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC([C@H](F)c3ccccc3F)CC2)cc1 564578467 VBWXIUVFAJEEQU-NRFANRHFSA-N 397.469 5.582 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F 566887932 VPNNRSNJAQNJSQ-FPOVZHCZSA-N 388.417 5.173 30 20 GKED COc1ccc(-c2cnc(CNc3ccc(Oc4ccnc(C#N)c4)cc3)o2)cc1 567974775 AYZBSTIYIFHGSY-UHFFFAOYSA-N 398.422 5.021 30 20 GKED Fc1cc(-c2noc(-c3ncsc3C(F)(F)F)n2)ccc1C(F)(F)F 570853700 NFYKYNDYPWVSNM-UHFFFAOYSA-N 383.248 5.037 30 20 GKED COc1ccc(CS[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1C#N 577243438 OQBNGTSPEVJXPR-INIZCTEOSA-N 382.529 5.259 30 20 GKED CN(C(=O)Nc1ccc(F)cc1C(F)(F)F)[C@H]1CC[C@@H](C(F)(F)F)CC1 578915284 MLGVFVJXFMXKIO-JGZJWPJOSA-N 386.311 5.429 30 20 GKED CC(C)(C)[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 580508997 HMCSPAHAOPGHNC-NWDGAFQWSA-N 388.327 5.095 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccccc1SC[C@@H](C)C#N)CCC2 593975092 LYWVJIFQJZTTBT-MAUKXSAKSA-N 380.513 5.006 30 20 GKED N#Cc1ccc(C2(NC(=O)c3ccc(Cl)cc3C(F)(F)F)CCC2)cc1 594142760 KJGQLQGCPGZNTG-UHFFFAOYSA-N 378.781 5.040 30 20 GKED CSc1ccc(Cl)c(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 596983563 FSEWRCLJWWDZPJ-QFBILLFUSA-N 385.920 5.366 30 20 GKED Cc1cc(C(=O)N(c2ccc(C#N)cc2)C2CCC2)ccc1NC(=O)CC(C)C 598886042 CBVKZRIGMWIQRC-UHFFFAOYSA-N 389.499 5.051 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2SCc2ccco2)c1 603972073 MKYFPYUSBYZPQQ-UHFFFAOYSA-N 392.480 5.507 30 20 GKED N#CCCCOc1cccc(NC(=O)CCOc2ccc(Cl)c(Cl)c2)c1 603972300 INKCOVKZSAOXSR-UHFFFAOYSA-N 393.270 5.084 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccccc1C(=O)N1C[C@H](C)C[C@@H](C)C1 606940768 ZUNGEHOHHCKJGY-RTBURBONSA-N 385.552 5.015 30 20 GKED Cc1c([C@@H](C)NC(=O)Nc2cc(C#N)ccc2OC(F)F)oc2ccccc12 609082469 LMOYCCOTPHJTED-GFCCVEGCSA-N 385.370 5.097 30 20 GKED CCCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](C)c1ccc(C)o1 609436631 BVLLRNKKLFNGDC-ZWKOTPCHSA-N 399.560 6.378 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 609773534 JPVOVJRNSPEKKI-PXNSSMCTSA-N 395.528 5.455 30 20 GKED C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1ccccc1-c1ccccc1C#N 609909296 AVYUWSJSYQNRII-FXAWDEMLSA-N 384.454 5.383 30 20 GKED C[C@@H](C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1cccs1 609968342 ABDVEIYWCYBLHP-MRXNPFEDSA-N 378.472 5.091 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OC2CCCCC2)c1 609970720 DLTJSZDWLIPPGR-QGZVFWFLSA-N 394.540 6.045 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 610225654 VIBUALKXTMPFJZ-JKSUJKDBSA-N 375.255 5.006 30 20 GKED COc1ccc(-c2nnc(SCCC(C)(C)C#N)n2C2CCCCC2)cc1 610285558 BWDDWNNGBYESKV-UHFFFAOYSA-N 384.549 5.491 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCCn3ccnc32)cc1)C(F)(F)F 655779644 PSMCDEYZQLRUMB-LBPRGKRZSA-N 381.295 5.120 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCc2sc(Br)cc2C1 669727264 BNRGMUAOHRVYIN-UHFFFAOYSA-N 391.334 5.219 30 20 GKED FC(F)(F)Oc1cccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 678207840 FPRILTDLFKKABI-QWRGUYRKSA-N 395.265 5.148 30 20 GKED CN(C(=O)CCC(C)(F)F)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 679994334 SPHBUAMOQIIYIT-LBPRGKRZSA-N 377.275 5.203 30 20 GKED C=C(C)COc1cccc(NC(=S)Nc2c(Cl)ccc(C)c2Cl)c1 728444341 IBPYEMQTTNGLPA-UHFFFAOYSA-N 381.328 6.066 30 20 GKED COc1cc(C#N)ccc1OC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1 730163371 MFDBPLNGOVNXQY-NRFANRHFSA-N 393.439 5.145 30 20 GKED CCc1cc(NN=C(C)c2ccc3cc(OC)ccc3c2)nc(-c2ccccn2)n1 730463727 NGVITOUKRSXXSQ-UHFFFAOYSA-N 397.482 5.099 30 20 GKED CCCCOc1ccc(C(C)=NNc2cccc(C(F)(F)F)n2)cc1OC 739422851 ZBLJGBASVSONLF-UHFFFAOYSA-N 381.398 5.124 30 20 GKED CC(C)OCc1ccc(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 739598673 IWGXQKKBTQWYLQ-UHFFFAOYSA-N 390.508 5.142 30 20 GKED CCCN(C(=S)Nc1ccccc1C#N)[C@@H]1C[C@H](OCC)C12CCCCC2 741513521 QOBSFZYFZHDPEA-UXHICEINSA-N 385.577 5.095 30 20 GKED Cc1ccccc1[C@@H](OC(=O)[C@@H](C)Oc1ccccc1C#N)c1cccs1 748501223 AMTGOZXIBVGFDF-IIBYNOLFSA-N 377.465 5.028 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)nc2)COc2c(Cl)ccc(Cl)c21 748584302 PWZZFRZXZHXBIF-RIYZIHGNSA-N 383.234 5.109 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2ccc(F)cc2)c2nccn2C)cc1 764815531 QULJSVVKUSRGFT-KKSFZXQISA-N 399.897 5.131 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 768701929 WNCYFCKGVMSPSS-UHFFFAOYSA-N 378.444 5.050 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775304005 ADOICFSHNWJZBY-FCHUYYIVSA-N 399.498 5.051 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccccc2OC)on1 789718026 DNLVXIILRFMSFJ-UHFFFAOYSA-N 376.456 5.454 30 20 GKED CCC1(c2ccc(Cl)cc2)CCN(C(=O)Nc2cccc(OCC#N)c2)CC1 791767124 DMIVUNWDHJLXSK-UHFFFAOYSA-N 397.906 5.218 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1F 811708447 YJUCEZSLGOWFRB-UHFFFAOYSA-N 378.432 5.002 30 20 GKED N#Cc1sc(NC(=O)c2cc3sc4ccccc4c3s2)nc1Cl 813368904 CEXJNYVKHDXQFD-UHFFFAOYSA-N 375.887 5.350 30 20 GKED C[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(N2CCCOC2=O)cc1 814263357 BTXKGQJBYSRJGN-CYBMUJFWSA-N 389.377 5.097 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(F)c3ccccc23)ccc1OC 815592460 JDBLQGBDDSZYQV-FUHWJXTLSA-N 392.474 5.519 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(C2CCCCCCC2)no1 848611885 SPKAQXPYOPOWMF-KRWDZBQOSA-N 390.528 5.547 30 20 GKED O=C(c1ccc(COc2ccc(F)cc2)o1)N(O)Cc1cccc2ccccc12 901367913 OLINVZAMDVIIDQ-UHFFFAOYSA-N 391.398 5.183 30 20 GKED N#C[C@H](C(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)c1nc2cc(C(F)(F)F)ccc2s1 915103843 GNGBDYXVYVQXJZ-ZJQBRPOHSA-N 378.419 5.318 30 20 GKED O=C(O)c1cc(NN=C2CC(c3ccc(Br)cc3)C2)ccc1Cl 1776033872 RYRIGFOEMLYMPC-UHFFFAOYSA-N 393.668 5.146 30 20 GKED O=C(O)Cc1ccc(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 1776084814 QLYAFHXWBUIGTB-QGZVFWFLSA-N 376.378 5.068 30 20 GKED Cc1c(NN=Cc2cc(F)ccc2Oc2cncc(Cl)c2)cccc1C(=O)O 1776088879 OGNXVRWMKGMVCR-UHFFFAOYSA-N 399.809 5.119 30 20 GKED C=C(C)COc1cc(CNCCCCCCCCCCC(=O)O)ccc1OC 1776140662 QCYARGUZZPAEJS-UHFFFAOYSA-N 391.552 5.335 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776470884 JMDWITROQAPGNY-MARXPDLDSA-N 396.439 5.302 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3cc(C(=O)O)ccc3O)ccc21 1777002788 HABORLRPUPEMPT-DHZHZOJOSA-N 385.419 5.114 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)cc2)CCC1 1789192854 ITHJCLFTGJKYGR-YUXAGFNASA-N 394.559 5.303 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cc(Cl)c(Cl)cc1Cl 24107374 TVDHIVDIPVKNBX-UHFFFAOYSA-N 394.645 5.463 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 25838295 XTTDXXXYKAGOBX-UHFFFAOYSA-N 389.524 5.409 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccnc(Oc2ccccc2)c1 66800931 KZGWBMIWXXAEQW-MRXNPFEDSA-N 389.480 5.520 30 20 GKED C=CCCO[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67798827 PKKCZBBWPFDSKI-FZMZJTMJSA-N 395.311 5.274 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1CCCc2ccccc21 107807205 HZSQESOUSAMYDD-OAQYLSRUSA-N 383.451 5.113 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)CCc2ccc(C#N)cc2)cc1 112641633 NDTQYPRBSWUOFM-AREMUKBSSA-N 397.522 5.086 30 20 GKED COc1ccc(CSc2nnc(S[C@H](C)c3ccc(C#N)cc3)s2)cc1 118173229 HTTKENUYGNZXEQ-CYBMUJFWSA-N 399.566 5.564 30 20 GKED N#C[C@H](C(=O)c1cncc(-c2ccccc2)c1)c1nc2cc(Cl)ccc2s1 124603315 ZOOQESCMUUROJY-QGZVFWFLSA-N 389.867 5.502 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C)(C)c1cccc(F)c1 129391235 WXDCDDGQLVWWQD-UHFFFAOYSA-N 389.430 5.109 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3sccc3C)n2)cc1 129592549 CAZGJTUSYNCHQN-KRWDZBQOSA-N 396.537 5.388 30 20 GKED CCOCCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC1 132673099 SLLYHYZJLQIEDD-INIZCTEOSA-N 388.920 5.237 30 20 GKED C[C@@H](SCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1cccs1 133964067 LBSFETLEEDADBG-UKRRQHHQSA-N 384.551 5.542 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1csc(C2CCCC2)n1 153566581 JOURALDXFIJEQC-UHFFFAOYSA-N 376.485 5.472 30 20 GKED CC(C)C[C@H](C)N(C(=O)c1ccccc1OCC#N)c1ccc2[nH]ccc2c1 170707290 MUEVSXQGBXRXTP-KRWDZBQOSA-N 375.472 5.152 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C 173115560 NFLIKRLQZKSBSP-KKSFZXQISA-N 393.556 5.924 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1ccc(OC)c(OC)c1OC 189888561 PHSPXUHYIUXXIB-UHFFFAOYSA-N 397.515 5.136 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N[C@H](C)c2ccccc2)cc1 303184713 YXRFZYMSUJKWSO-MRXNPFEDSA-N 387.439 5.242 30 20 GKED CC(C)CCN(CCC(C)C)C(=O)Nc1ccccc1SC[C@H](C)C#N 303381813 MSNQVCRHGDFBPX-GOSISDBHSA-N 375.582 5.864 30 20 GKED OC(=Nc1ccc(F)c(N=C(O)C2CCCCC2)c1)C1CCN(C2CC2)CC1 328687453 GZYPHJWFLSWMMW-UHFFFAOYSA-N 387.499 5.456 30 20 GKED Cc1cnc([C@H](C)C/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)s1 329406271 CTBSEKKEVIVLGD-PBHICJAKSA-N 386.565 5.018 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 428184473 MZEADWBEINDSGV-UHFFFAOYSA-N 389.455 5.004 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC[C@@H]4CCC[C@@H]43)cc2Cl)c1 429428815 JPLQSOMJEYQYEX-PXNSSMCTSA-N 395.890 5.197 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 431931050 MBDWECSXBNUELD-AVRDEDQJSA-N 395.572 5.982 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(N[C@@H](C(N)=O)c2ccc(C#N)cc2)cc1 437152180 SEVQJYGFKIYCOP-OPAMFIHVSA-N 387.508 5.050 30 20 GKED N#Cc1ccccc1SCC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 439704724 CGBKERNNDAVHGP-JOCHJYFZSA-N 392.911 5.210 30 20 GKED C[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccc(C#N)cc1 442257317 NFRBYUHYHBZQDG-LBPRGKRZSA-N 384.266 5.351 30 20 GKED C[C@H](C1CC1)N(C(=O)c1c(F)cc(C#N)cc1F)c1cccc(C(F)(F)F)c1 445810721 NBGUKWIDLSSKPY-LLVKDONJSA-N 394.343 5.301 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1CCc1ccccc1)c1ccccc1 458795666 CVABKUUDQAJXKQ-DHIUTWEWSA-N 375.516 5.228 30 20 GKED Cc1cc(-c2nnc(N(CCC#N)CCC(C)C)n2Cc2cccs2)c(C)o1 461018089 URGQABBGJNXQRN-UHFFFAOYSA-N 397.548 5.031 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 466523704 AIAMQPTZKGEQKG-AWEZNQCLSA-N 381.863 5.616 30 20 GKED Cc1cccc([C@H]2CCCCCN2C(=O)Nc2ncccc2OCCCC#N)c1 466610666 QQNGOEAGCIUEEO-HXUWFJFHSA-N 392.503 5.222 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1c(F)cc(Br)cc1F 467951823 JEYCLRXCVXDVBK-UHFFFAOYSA-N 395.247 5.338 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCOc1ccccc1Cl 475567342 WLMVRJCOXQZQDM-UHFFFAOYSA-N 386.923 5.735 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccccc1 475640349 QPWBDGJEPSEFBM-SFHVURJKSA-N 382.454 5.324 30 20 GKED Cc1nc(CNC(=O)C[C@H](CC#N)c2ccccc2)oc1-c1ccc(Cl)cc1 476282274 VLYBJKOGODCWJF-SFHVURJKSA-N 393.874 5.007 30 20 GKED CC(C)(C)[C@H]1C[C@H](NC(=O)c2ccc(Sc3ccccc3C#N)cc2)CCO1 480944878 IFFBESCCJJUQGT-WIYYLYMNSA-N 394.540 5.033 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(OCC(F)F)cc1 483654879 WTQAFYNDNDEWHS-ZDUSSCGKSA-N 391.443 5.369 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OC2CCOCC2)c(C)c1 485469874 VLTWZVAYOOUZJK-UHFFFAOYSA-N 383.513 5.083 30 20 GKED N#CCCSc1ccccc1NC(=O)Nc1cccc(Br)c1 485991815 RKJCZKLEWSDVLJ-UHFFFAOYSA-N 376.279 5.099 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cccc(OCc2cccnc2)c1 494055663 WAQZBUIBHKIXJT-UHFFFAOYSA-N 398.915 5.204 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 495438836 JAZYQFBQPQMMJB-INIZCTEOSA-N 391.496 5.424 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCCC[C@@H]2C(F)F)cc1Cl 500566583 KARUDMAXSNODAT-MRXNPFEDSA-N 390.817 5.264 30 20 GKED C=CCCc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CCOCC1 505010971 OIBZXFCEOHDBRI-UHFFFAOYSA-N 384.907 5.286 30 20 GKED C=CCCc1ccccc1NC(=O)N(CCc1ccccc1)Cc1ccncc1 505025260 ZRVBKTQWVMDUCR-UHFFFAOYSA-N 385.511 5.477 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC[C@H]2CCCCO2)cc1Cl 506365836 XSUYVGSNROSRSL-UYAOXDASSA-N 397.906 5.076 30 20 GKED Cc1cccn2cc(-c3ccc(NC(=O)c4cc(C#N)ccc4Cl)cc3)nc12 506686756 IDUKGJQLOFRVRD-UHFFFAOYSA-N 386.842 5.087 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC(C2CC2)C2CC2)cc1Cl 510023163 JHHYQQGMTBXLGU-LJQANCHMSA-N 379.891 5.306 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN(C1CC1)[C@H](C)c1ccccc1 512291243 GLVWAQPADFUMQR-ZWKOTPCHSA-N 393.556 5.102 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)cc2)ccn1 514636369 AYKIUZLSCRJTTL-WOJBJXKFSA-N 389.842 5.141 30 20 GKED Cn1ccc2c(NC(=O)c3ccc(Oc4cccc(F)c4C#N)cc3)cccc21 518016615 QBPMEYFETWSGOQ-UHFFFAOYSA-N 385.398 5.234 30 20 GKED N#Cc1ccncc1C(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 519843588 IZIPOHFNUKTQNO-UHFFFAOYSA-N 390.855 5.136 30 20 GKED CCc1cccc(C)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 520647682 ZXPNSLSAQITXME-UHFFFAOYSA-N 390.870 6.127 30 20 GKED COc1cc(CNc2ccccc2S[C@@H](C)CC#N)ccc1OC(F)F 521813286 DNOSIJCTHNOMSU-ZDUSSCGKSA-N 378.444 5.303 30 20 GKED CCC1CCC(N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C2CC2)CC1 521950883 HBCHCTMFERQPHR-UHFFFAOYSA-N 389.499 5.319 30 20 GKED C=CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)CC1 521957304 ALYUVHMEFIARLA-FBMGVBCBSA-N 384.479 5.353 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 522768830 NQZRMCQAUGXVGB-AWEZNQCLSA-N 388.298 5.324 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N(CC2CC2)CC2CC2)c1 523889428 MMBGTCYNHLSKKP-UHFFFAOYSA-N 380.875 5.266 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 524164437 NQZCYBXOXHNGKO-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)Nc1cccc(C#N)c1 524248627 GESVJJOSXDDUHX-UHFFFAOYSA-N 375.403 5.229 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccc(C#N)cc1F)c1cccc2ccccc12 525116912 WCWMTTQZHTVEQS-LSDHHAIUSA-N 378.472 5.209 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc4ccncc34)cc2)cc1 530797838 FVXYSZQVMVYGGN-UHFFFAOYSA-N 379.419 5.345 30 20 GKED COc1cc(CSCc2ncccc2C)ccc1OCc1cccc(C#N)c1 538524715 POPIVYPNBGCIEI-UHFFFAOYSA-N 390.508 5.283 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(C(F)F)c3Cl)cc2)nc1 541650446 MYGUTDLMDFFCOI-UHFFFAOYSA-N 399.784 5.589 30 20 GKED CC[C@@H](CC#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 545156375 QEMAGJUDMJKJIN-KRWDZBQOSA-N 378.497 5.288 30 20 GKED CC(C)(C#N)CCN1CCO[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 545983937 BITYXDBSBUDKJW-HNNXBMFYSA-N 394.359 5.037 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CC(=O)c1ccc(C(C)(C)C)cc1 548952120 GLCWUKAGQSRPNE-UHFFFAOYSA-N 392.886 5.015 30 20 GKED Cc1sc(NC(=O)COc2c(Cl)cc(Cl)cc2Cl)c(C#N)c1C 550149240 BPHAFTYKODDEEB-UHFFFAOYSA-N 389.691 5.214 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c2c1 561978647 LJWXQQCNWWJOKI-HNNXBMFYSA-N 393.393 5.791 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@@H]3CCC[C@H]3c3cccc(C(F)(F)F)c3)CC2)cc1 583700586 NBAVJMBIYYOUEF-VQTJNVASSA-N 398.428 5.061 30 20 GKED N#Cc1ccc(NC(=O)c2c(Cl)cc(F)cc2Cl)cc1Br 584773255 SBXCYSJLIZRLON-UHFFFAOYSA-N 388.023 5.019 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H](C3CC3)C2)cc1F 589000381 HVDASNJOPKCQRF-KRWDZBQOSA-N 379.435 5.144 30 20 GKED CCS[C@H](C)c1noc(CSCc2ccc(C#N)cc2C(F)(F)F)n1 596348028 BMHMPFPCHUUGPT-SNVBAGLBSA-N 387.452 5.208 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)C1 596752996 NQIXLZKTQGXZGK-NSHDSACASA-N 391.846 5.152 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CSc1ccc(C#N)cc1 603917076 RUZVFUMKRPPCOL-GFCCVEGCSA-N 379.312 5.177 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2cscn2)c1)c1nc2cc(F)ccc2s1 608552976 FOGYLLRYCWTCLJ-CQSZACIVSA-N 379.441 5.049 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCC1(Sc2ccccc2)CC1 609471650 OIWBKDKVELRXSK-UHFFFAOYSA-N 393.556 5.051 30 20 GKED CC(C)CCN(CCC(C)C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609498582 NXYHBPYOOGWSNW-UHFFFAOYSA-N 379.504 5.280 30 20 GKED COc1cc(F)ccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609723255 XSVRFMAGLFBQRK-UHFFFAOYSA-N 396.805 5.404 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)CC/C=C/c2ccccc2)cc1 609968497 KYYSOTPXUMWYCF-RUDMXATFSA-N 398.481 5.720 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)cc1C 610142701 KKLKQNIXCZORBG-MRXNPFEDSA-N 393.556 5.752 30 20 GKED Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NCc1ccc(C(C)(C)C#N)cc1 614056376 SEQGQRWVVNPEDG-LJQANCHMSA-N 389.543 5.423 30 20 GKED N#C[C@H](C(=O)c1cccc(OCc2cccs2)c1)c1nc(C2CC2)cs1 647377144 RYHRPHGEGRQCQF-QGZVFWFLSA-N 380.494 5.151 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](CC1CC1)c1ccccc1 672900696 LGLSSWUYJNDXGY-JOCHJYFZSA-N 380.536 5.093 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2ccc(C(F)(F)C(F)(F)F)cc2)s1 680532248 DKBCJUBCLFBOLG-UHFFFAOYSA-N 390.299 5.737 30 20 GKED O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1cc(F)c(C(F)(F)F)c(F)c1 683211693 JLPSLUYIHIELSH-UHFFFAOYSA-N 391.246 5.050 30 20 GKED Cc1cccc(C2(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)CCCC2)c1 726857919 CIGJOKCACAPBGH-KRWDZBQOSA-N 393.437 5.428 30 20 GKED N#C[C@@H](NC(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccc(F)cc1 727850068 QVTNYGZNEFEZJB-HXUWFJFHSA-N 387.439 5.097 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cc(C)sc1C 733081088 MYRGMEBONRGLAT-UHFFFAOYSA-N 391.422 5.072 30 20 GKED Cc1cc(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)c(C)n1[C@H](C)c1ccccc1 733258570 FGJWKDQTTREIPB-ZHRRBRCNSA-N 391.902 5.362 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 739143024 NKTRICAPVLQGQL-WFASDCNBSA-N 388.414 5.370 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3cccc(F)c3)CC2)cc1 740435583 RFUXAMFSXLBGNJ-HSZRJFAPSA-N 399.469 5.334 30 20 GKED CSCc1cccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740453514 GIKWWJOZMDVPQO-UHFFFAOYSA-N 393.537 5.471 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2cccc(C(F)(F)F)n2)cc1 741459988 IEMMRVJZXNPOOU-UHFFFAOYSA-N 385.389 5.612 30 20 GKED N#Cc1cccc(/C=C(/Cl)c2ncc(-c3ccccc3Br)o2)c1 741840837 AEDJAZWZKVOBEC-CXUHLZMHSA-N 385.648 5.713 30 20 GKED O=C(/C=C\c1c(Cl)nc2ccccn12)c1ccc(SCC(F)F)cc1 741843837 QYRJHKQMXFADIN-HJWRWDBZSA-N 378.831 5.241 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccccc1C(F)(F)F 744117895 DNQSAVOIIKCBFS-ZWNOBZJWSA-N 392.377 5.434 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)nc1 753538245 JBNISHVAQVTPFI-CYBMUJFWSA-N 388.279 5.310 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1C(=O)OCc1csc(-c2ccsc2)n1 758120076 KPNQOTYONCUUHZ-UHFFFAOYSA-N 394.399 5.119 30 20 GKED C=C[C@H](CC(=O)O[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 758909429 BYOLAFGZPLZTJI-RBUKOAKNSA-N 379.500 5.349 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N(Cc1ccccc1F)C1CCCCC1 761663618 LKICGQXGHHAMPO-UHFFFAOYSA-N 399.441 5.234 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 765910201 KBEONDBHZHJQRG-RDTXWAMCSA-N 393.284 5.052 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCc3cccc(C(F)(F)F)c3)[nH]c12 770870463 LDOJSHCWYPCWLJ-MRXNPFEDSA-N 385.389 5.089 30 20 GKED C#CCCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 773361561 AEUDNBQJBPERQE-UHFFFAOYSA-N 380.538 5.646 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@@H](c2ccco2)C1 775487083 HSTJMLFBKCHOKU-SXSPYAJSSA-N 399.494 5.940 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1ccc(Cl)cc1F 781911768 NUUVXWWOKDJXTK-YJYMSZOUSA-N 389.858 5.289 30 20 GKED Cc1nnc([C@@H](C)OC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 784424678 BBFLROZIZXMAOB-LLVKDONJSA-N 399.859 5.082 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1cnn(C(C)C)c1C 787158794 YNTKBWCKXFJIJU-UHFFFAOYSA-N 381.427 5.237 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(OC(F)(F)F)cc1 789337743 YFVXYTRSGJHQAY-QGZVFWFLSA-N 398.384 5.287 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 790635531 LSKDZVVEKMZHOO-CQSZACIVSA-N 383.904 5.044 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CO[C@H]2CCCc3ccccc32)cc1 797433477 DZUMESOFQHHUCC-DQEYMECFSA-N 396.490 5.375 30 20 GKED N#C[C@@H](C(=O)CO[C@@H]1CCCc2ccccc21)c1nc2cc(Cl)ccc2s1 797549631 OVQVYGPVJVHFFI-QFBILLFUSA-N 396.899 5.220 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCn2ccc3cc(Cl)ccc32)s1 797569158 BCUUGHWSCBSSFT-OAHLLOKOSA-N 385.920 5.315 30 20 GKED C#C[C@@H](N[C@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccc(Cl)cc1 811516578 QCMAQASBAXXJMQ-CXAGYDPISA-N 394.824 5.040 30 20 GKED C[C@H](Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1)c1cccc(C#N)c1 864006830 MHPXJQQPWPFGDE-JTQLQIEISA-N 389.204 5.979 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3c[nH]c4ccccc34)n2)cc1 915101112 CWNPERXLKLEORN-HXUWFJFHSA-N 399.519 5.799 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915352512 LOFCWAFVTPDAPN-NRFANRHFSA-N 389.886 5.659 30 20 GKED CCOCc1ccccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354184 WRWPMGKHQOWUEX-XMMPIXPASA-N 399.494 5.200 30 20 GKED CC(=O)Nc1ccc(O)c(C(C)=NNc2c(Cl)cc(Cl)cc2Cl)c1 915933572 BXFRZNQMXNVSFC-UHFFFAOYSA-N 386.666 5.147 30 20 GKED O=C(Nc1cccc(C=NNCc2ccccc2)c1)c1ccc(Cl)cc1Cl 916344141 OLFKFQNMNJUEAJ-UHFFFAOYSA-N 398.293 5.369 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccccc1Cc1ccc(Cl)cc1 1776051557 PKELOSJJOIOHSP-UHFFFAOYSA-N 394.858 5.084 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(CC(=O)O)cc2)cc1 1776125601 NAWPIMDROXGVGP-LFIBNONCSA-N 380.484 5.559 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1ccc(F)c(Cl)c1)C(=O)O 1776170964 UNIKNLILQAUKRH-SFHVURJKSA-N 395.833 5.310 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1-c1ccccc1 1776355472 QFFVMJCEMJVXPO-WYMLVPIESA-N 386.447 5.735 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cs1 1776380559 XSFSEYODUAMUEW-LFYBBSHMSA-N 377.465 5.528 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(CCCC(=O)O)cc2)cc1 1776789205 VCXZAJGRJGLVJE-UHFFFAOYSA-N 383.532 6.055 30 20 GKED C[C@H](OC(=O)c1ccccc1-c1ccccc1C#N)c1nnc(-c2ccccc2)o1 5354055 MMBFLOONWWIUHT-INIZCTEOSA-N 395.418 5.193 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3ccc(CC#N)cc3)o2)cc1 22357806 QUYOSDOENJRXRO-UHFFFAOYSA-N 393.446 5.635 30 20 GKED CCCCC[C@H](C)n1c(SC[C@H](C#N)CCC#N)nc2ccccc2c1=O 66400048 DBILMCKESRXKOE-IRXDYDNUSA-N 382.533 5.073 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cc1 110965905 DWWOICFMTHHIKF-VUODPORTSA-N 386.476 5.313 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2c([nH]c3ccccc23)C1 129444644 QPNPIYGXPAQBHS-HNNXBMFYSA-N 390.512 5.010 30 20 GKED C[C@@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccc(C#N)cc1 154342661 HCXMYBQYXBKEQT-VXGBXAGGSA-N 382.357 5.173 30 20 GKED C#CCOc1ccc([C@H](C)N[C@@H](C)c2cccc(OCc3ccccn3)c2)cc1 165805833 HXYFBUBMOCIPME-PMACEKPBSA-N 386.495 5.084 30 20 GKED Cc1cnc([C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)s1 173122438 PMSPRSLVBGBEQP-PXAZEXFGSA-N 386.546 5.119 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3cc(C#N)ccc3OC(C)C)c2)cs1 173770619 KPHKPYLDBZLCKY-UHFFFAOYSA-N 377.469 5.030 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 176574992 HZCDSVINGRTNFQ-CQSZACIVSA-N 393.468 5.075 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc4ccccc34)n2)cc1 193667345 FKRPXKNXGZQLQH-MRXNPFEDSA-N 385.473 5.387 30 20 GKED C[C@H](CNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)Cc1cccs1 303961128 WRKUDRNZYQNUAG-INIZCTEOSA-N 376.481 5.021 30 20 GKED Cc1ccc2c(c1)CC[C@H](/C(O)=N/[C@H]1CCCc3cn(C4CCCC4)nc31)O2 330017255 QULKYBLRBFZHHE-PZJWPPBQSA-N 379.504 5.034 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Cl)cc1C(F)(F)F)c1ccccc1 410958189 VMYFPAWOVUCTKL-KRWDZBQOSA-N 380.797 5.524 30 20 GKED C=CCC[C@@H](NCc1nc(O)c2sccc2n1)c1ccc(C(F)(F)F)cc1 411488024 XNTKFAVSUFOCAT-CQSZACIVSA-N 393.434 5.213 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](c1ccc(F)c(Cl)c1)C1CC1 425769752 PBDWJUUOESFUEY-XCLFUZPHSA-N 385.870 5.204 30 20 GKED C=CCN(CCC#N)Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 430095461 BFBXBYCYTANBMP-UHFFFAOYSA-N 388.298 5.147 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430610634 LSIOIYGXVDDNHE-CQSZACIVSA-N 379.485 5.148 30 20 GKED N#Cc1ccc(NC(=O)N2CC3(CCC3)[C@H]2c2ccccc2)cc1C(F)(F)F 432961031 QRSDMHYCNHWJSP-GOSISDBHSA-N 385.389 5.336 30 20 GKED N#C[C@@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1ccc(Cl)c(Cl)c1 436021228 OAEMSBDRQQTFJK-PFMWSLTASA-N 379.209 5.043 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccc(Cl)c3cccnc23)cc1 437251960 DBLBUVVOAPYGHN-UHFFFAOYSA-N 391.902 5.315 30 20 GKED CCSc1ccc(Cl)cc1C(=O)Nc1sc2c(c1C#N)CCCC2 437328443 MNSHSHPLVBPFGL-UHFFFAOYSA-N 376.934 5.516 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Cl)cc(Br)c1 437358176 XJJUFLYNFQKJRI-UHFFFAOYSA-N 395.709 5.361 30 20 GKED Cc1cnc(NC(=O)c2ccccc2-c2ccccc2C#N)nc1-c1ccccc1 439306642 MXHWBIVAHXIIGV-UHFFFAOYSA-N 390.446 5.243 30 20 GKED Cc1ccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)s1 440587780 JNTHXGOIUHKULA-UHFFFAOYSA-N 381.432 5.290 30 20 GKED C=CCC[C@H](NC(=O)CCc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 441583006 UANQARKRSXZHKS-SFHVURJKSA-N 380.410 5.067 30 20 GKED N#C[C@@H](C(=O)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1)c1ccccn1 442656998 SMHMVKBYSXOBBI-MRXNPFEDSA-N 385.225 5.685 30 20 GKED N#C[C@H]1CC[C@H](NCCc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1 442774464 AJQOPHGNNHLQHD-UWJYYQICSA-N 390.918 5.017 30 20 GKED N#CCc1ccc(NC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c(Cl)c1 452644302 LJZDFAVWSMLAPW-GJZGRUSLSA-N 378.781 5.167 30 20 GKED CC(C)Oc1ccc([N+](=O)[O-])cc1CNc1ccccc1SC[C@H](C)C#N 462232284 ZGVKDDLKUGMZDT-OAHLLOKOSA-N 385.489 5.246 30 20 GKED C[C@H](C(=O)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 462543563 AKYDUZXGMCADSG-DCPHZVHLSA-N 386.417 5.133 30 20 GKED Cc1cc(Br)c(NC(=O)CSc2ccc(C#N)cc2)cc1Cl 463364930 CAYLEQXRIYSICH-UHFFFAOYSA-N 395.709 5.013 30 20 GKED C[C@@H](C#N)N[C@@H](Cc1c(F)cccc1Cl)c1ccccc1Br 463910772 NQHPLSICUDXSQN-GTNSWQLSSA-N 381.676 5.027 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 471274073 UCDSJZUPIKSTNI-FZKQIMNGSA-N 389.377 5.155 30 20 GKED CSCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1F 473927466 ISSCBCIZVOUYIQ-QGZVFWFLSA-N 396.512 5.611 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 483326297 UGIBEFGUWAUFRS-UHFFFAOYSA-N 391.696 5.464 30 20 GKED C=CCn1c(S[C@H](C)c2cnc(C)cn2)nnc1-c1ccc(C(C)(C)C)cc1 488260894 WNDPYVZWVUOANO-MRXNPFEDSA-N 393.560 5.380 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 488307097 JXVMTGHDAGVNRE-QWFCFKBJSA-N 393.556 5.657 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@@H]2CCCC(F)(F)C2)cc1 494237093 ILOKOYXDEJPNFD-GOSISDBHSA-N 399.441 5.031 30 20 GKED CC(C)(C)c1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(O)c1 501983873 ZMNJZIIJKRZNGD-UHFFFAOYSA-N 387.439 5.001 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(CC(C)C)[C@H](C)c1ccccc1Cl 504129273 SXMPOCPSNZDDKV-HLIPFELVSA-N 378.944 5.050 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)COCc1ccccc1 505338363 FNWNHFKJBQUWRZ-QGZVFWFLSA-N 397.544 5.198 30 20 GKED N#CCCn1cc(CN(Cc2ccccc2)Cc2ccco2)c(-c2ccccc2)n1 506084978 DZFVTAPOIQQYQN-UHFFFAOYSA-N 396.494 5.259 30 20 GKED C=CCC(C)(C)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 506768564 YGTSDEFKPMKUMR-UHFFFAOYSA-N 384.545 5.127 30 20 GKED CCc1cccc2c1OCC[C@H]2NC(=O)c1ccccc1-c1ccccc1C#N 506981402 JEIXPVVVILIERE-HSZRJFAPSA-N 382.463 5.041 30 20 GKED C[C@H](N[C@H](C)c1c(F)cncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 513237281 XIKPENQGBFBMCO-DTWKUNHWSA-N 398.297 5.809 30 20 GKED CC(C)c1ccsc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 513278047 BGAIQRJGZIRMCA-GFCCVEGCSA-N 388.464 5.763 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CCCC2)c1 517461148 APBAULAWKMZUTI-SFHVURJKSA-N 378.541 5.697 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1csc(Cc2ccccc2)n1 517518182 YCLANXLVEMYKCT-HNNXBMFYSA-N 393.537 5.380 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(Cl)cc1)C(C)C 520131608 JBQZSLJEIVYGIJ-OAQYLSRUSA-N 381.907 5.307 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC(F)(F)F)cc1 520827735 ZDFUGBMLBUUEBL-GFCCVEGCSA-N 380.391 5.089 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 520832413 JIXHOZINFDNGAJ-OALUTQOASA-N 395.572 5.176 30 20 GKED Cc1cccc(COc2c(C)cc(CN(C)C(=O)NCCCCC#N)cc2C)c1 522445850 XBCUQGHDRREJHN-UHFFFAOYSA-N 393.531 5.026 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cccc(OC3CCCCC3)c2)cc1 523152849 BCWZJVULBQXILR-UHFFFAOYSA-N 392.499 5.357 30 20 GKED Cc1nc(-c2ccc([C@H](C)Nc3nc(C(F)(F)F)ccc3C#N)cc2)cs1 523754921 DOXFULFSZWBCRT-NSHDSACASA-N 388.418 5.577 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1c(Cl)cccc1Cl 524252965 NGORZWGKFKGHKX-MRXNPFEDSA-N 392.673 5.052 30 20 GKED C[C@@H](C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)c1cccc(Cl)c1 525145327 GWWVNMMZDKCAMH-MRXNPFEDSA-N 390.870 5.533 30 20 GKED CCc1ocnc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 525327281 GHOFQRLZEURRKM-LLVKDONJSA-N 392.267 5.157 30 20 GKED N#Cc1cccc(-c2nnc(CN(Cc3ccco3)c3cccc(Cl)c3)o2)c1 532700128 JREOZXRXTAELJJ-UHFFFAOYSA-N 390.830 5.061 30 20 GKED N#Cc1ccsc1NC(=O)CCN[C@H](c1ccc(Cl)cc1)C1CCCC1 537105857 CEOGPPCOMDYCKZ-IBGZPJMESA-N 387.936 5.123 30 20 GKED N#CC1(c2ccc(C(=O)Nc3nc(-c4ccc(Cl)s4)cs3)cc2)CC1 539596208 SCJLKIPLWXWNKP-UHFFFAOYSA-N 385.901 5.332 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccc(Br)c(Cl)c1Cl)OCC 541634769 VKKZGEVBYBKCJU-LLVKDONJSA-N 381.097 5.066 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ncccc3C(F)(F)F)n2)cc1 542648302 JQUVFKCOWDTQJY-ZDUSSCGKSA-N 387.386 5.022 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccccc1OCc1cccc(Cl)c1 554259953 HOVYZJWOJQVTPW-UHFFFAOYSA-N 385.895 5.370 30 20 GKED C=CCN(C(=O)c1sc2ccc(C#N)cc2c1C)c1nc2c(s1)CCCC2 556450717 WZTUZESGSHYCRX-UHFFFAOYSA-N 393.537 5.250 30 20 GKED COc1cc(CN[C@H](C)c2ccc3ccccc3c2OC(F)F)ccc1C#N 558508183 DKDSWRYHXBUHBL-CQSZACIVSA-N 382.410 5.172 30 20 GKED C=CCC(C)(C)c1noc([C@H](CCOC)Cc2cccc(Br)c2)n1 560008379 MNQBFLASFJZMFR-OAHLLOKOSA-N 393.325 5.049 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC=C(c2cccnc2)C1 576613730 OICIOIGLGJDXCO-UHFFFAOYSA-N 397.503 5.034 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccccc1)c1ccccc1C#N)c1ccccc1 578191644 YFLOYJKDQAROPC-QFIPXVFZSA-N 379.463 5.179 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 579999623 WRFGVKGJBVOCST-XMMPIXPASA-N 399.494 5.105 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2csc(-c3ccccc3)n2)c1 588337886 VAHDOCSVWWIXGN-UHFFFAOYSA-N 378.457 5.137 30 20 GKED CCC(CC)(C(=O)Nc1ccccc1SC[C@H](C)C#N)C(=O)OC(C)(C)C 593059183 SMGKIHLVMIIFGE-OAHLLOKOSA-N 390.549 5.025 30 20 GKED C[C@@H](CSc1ccccc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 593406646 KFAGOGLTUCPOKD-GHTZIAJQSA-N 381.545 5.244 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)CCCCC#N 593984135 JTPKDXNYXPAMIQ-UHFFFAOYSA-N 392.478 5.754 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)C[C@@H]1CCc2ccccc21 596734194 CPNNZBKLJJFZCM-AEFFLSMTSA-N 379.529 5.275 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CC1(C#N)CCCCC1 596821087 YPHVULJXINGYSX-UHFFFAOYSA-N 375.472 5.050 30 20 GKED C[C@H](NC(=O)NCc1cccc(C#N)c1)c1ccc(Oc2ccccc2)c(F)c1 604077719 YDFRCCKOVJPMDL-INIZCTEOSA-N 389.430 5.050 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609177447 VFZHMNVCXGGMCM-UHFFFAOYSA-N 388.471 5.171 30 20 GKED C=CCN(C(=O)c1cc2ccccc2n1CC#N)c1nc(-c2ccccc2)cs1 609215834 ZOZSOLWEZJHKKS-UHFFFAOYSA-N 398.491 5.121 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3cc(Cl)ccc3Cl)c(F)c2)CCC1 609856530 FTDYHNBYOWGXAH-UHFFFAOYSA-N 379.218 5.557 30 20 GKED CCCc1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 611622763 AQLFYDBJQFMZFK-OAQYLSRUSA-N 381.545 5.125 30 20 GKED Cc1ccc2c(Cl)c(C(=O)N[C@]3(C#N)CCc4ccccc4C3)sc2c1 613677733 WACNIUQEMFNWCP-OAQYLSRUSA-N 380.900 5.044 30 20 GKED CCCN(C(=O)N[C@H]1CCc2cc(C#N)ccc21)[C@H](C)c1cc2ccccc2o1 618842520 NEJIXKLISQKDAC-IERDGZPVSA-N 387.483 5.475 30 20 GKED O=C(NCc1c(F)c(F)cc(F)c1F)Nc1ccc(CCC(F)(F)F)cc1 674679615 HQMOSNCVIPZLGW-UHFFFAOYSA-N 394.290 5.060 30 20 GKED N#C[C@H](C(=O)c1sc(-c2ccccc2)nc1C(F)F)c1nc2ccccc2o1 677790999 JMOWPURKULJSTD-GFCCVEGCSA-N 395.390 5.379 30 20 GKED C=CCN(Cc1cccs1)[C@@H](C(=O)Nc1ccc(OC)cc1)c1ccccc1 680898283 CMUHUFGWEGGUQV-JOCHJYFZSA-N 392.524 5.125 30 20 GKED C[C@]1(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)CCCc2ccccc21 726323031 WLVNMYAUNISFMH-BTYIYWSLSA-N 380.900 5.420 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 733031120 NJTYEFDCXYYUTC-JWQCQUIFSA-N 397.522 6.203 30 20 GKED CCC[C@@H](C#N)NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 733895701 UJBPBKZRRUGOQM-IBGZPJMESA-N 382.463 5.355 30 20 GKED C=CC[C@@H](NC(=O)c1sc2cc(C(C)C)ccc2c1Cl)c1ccncc1 734457552 LNWPTZBWCIKORB-QGZVFWFLSA-N 384.932 6.120 30 20 GKED C=CC[C@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccncc1 734508606 BARXCSHZOZQHIL-QFIPXVFZSA-N 391.902 5.394 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 734965987 RXLBXHNEGLOREB-ZBFHGGJFSA-N 396.462 5.767 30 20 GKED O=C(/C=C\c1nccs1)c1ccc(Oc2ccc(Br)cc2)cc1 735232056 HURLUQGLQQSCMU-KTKRTIGZSA-N 386.270 5.594 30 20 GKED CCOc1ccc(N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1 739622128 MNDMCEQXGHPBEJ-UHFFFAOYSA-N 390.414 5.165 30 20 GKED Cc1ccc([C@H](C)C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)o1 742658714 CCCZTZJMFRWQSJ-KRWDZBQOSA-N 376.431 5.244 30 20 GKED CC[C@@H](NC(=S)N(Cc1ccccc1C#N)C1CCCC1)c1cccs1 747706920 SPCXDHKFQXUXQY-LJQANCHMSA-N 383.586 5.390 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(-c4ccccc4Cl)s3)cc12 750906115 PWWOBSCFDCLWBA-BQYQJAHWSA-N 393.899 5.555 30 20 GKED CC(/C=C/C(=O)c1ccc(N2CCC(O)CC2)cc1)=C\c1ccc(Cl)cc1 753718305 WLKNBEMXHMBAJP-MASZBAQNSA-N 381.903 5.144 30 20 GKED Cn1cc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2ccccc21 755167846 WRVPTJXOMSNQDH-XMMPIXPASA-N 393.490 5.405 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C(F)(F)c1c(F)cccc1F 756983512 LKHCXRBDTJXPMV-LLVKDONJSA-N 382.382 5.090 30 20 GKED Cc1nc([C@@H](C)OC(=O)c2ccc(CC#N)cc2)oc1-c1ccc(Cl)cc1 758689122 UWQSVHWWFSLTRB-CQSZACIVSA-N 380.831 5.288 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)[C@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 763939628 BIRYYOVQPBAFBI-QUCCMNQESA-N 388.492 5.033 30 20 GKED CC[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 764755626 HTFVXJQEWFMPAX-MOPGFXCFSA-N 378.472 5.628 30 20 GKED CC(=NNc1ccnc(Br)c1)c1csc(-c2csc(C)n2)c1 769804671 SWWKYRWXPRCEBP-UHFFFAOYSA-N 393.335 5.174 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1Cc2ccccc2C[C@@H]1c1nnc(C)o1 775488727 LTQRIKUYAQDQJA-XMSQKQJNSA-N 397.563 5.781 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=S)Nc1ccc(OC(F)F)c(Cl)c1 779726785 JWVIUYULDNAJSL-JTQLQIEISA-N 397.834 5.041 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(C(C)C)c(Cl)c1 786446976 GNQFFPOICWAMAG-LJQANCHMSA-N 396.918 5.549 30 20 GKED CCCNc1ccc(C#N)cc1NCC(=O)Nc1ccccc1-c1ccccc1 795265863 DPBXHSMPAXAGEO-UHFFFAOYSA-N 384.483 5.098 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2coc3cc(F)ccc23)cc1 796630213 OIHKPOVWDVNUFO-SCLBCKFNSA-N 378.403 5.047 30 20 GKED Cc1ccc(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)cc1C#N 799309822 LQGNLIDRMSEZKS-UHFFFAOYSA-N 384.439 5.071 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nn(Cc2ccc(C)cc2)c1Cl 800155087 SWDJZYPKPTUAGX-UHFFFAOYSA-N 393.918 5.573 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCO[C@H](c2cccc(C#N)c2)C1 801827868 WRSHCUKAPHIZAH-FQEVSTJZSA-N 397.906 5.115 30 20 GKED N#Cc1ccc(/C=C/C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 811685046 IDPBIUVZQJFWKN-GQCTYLIASA-N 380.709 5.035 30 20 GKED CSc1ccc(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)s1 814736333 PDKOQUQOVXFQHI-UHFFFAOYSA-N 397.550 5.099 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(N)c([N+](=O)[O-])c1 815615375 OPJXJOYCWPSZQB-CVEARBPZSA-N 386.455 5.127 30 20 GKED C/C(=C\C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 817318728 HARNWJBTCVQRBW-CLHDZIPGSA-N 384.426 5.243 30 20 GKED O=C(COc1ccc(C(=O)/C=C\c2ccc(Cl)s2)cc1)Nc1ccccc1 834756495 ROQFUWJWTLNEEB-BENRWUELSA-N 397.883 5.315 30 20 GKED Cc1cc(C)c(NC(=O)CON=Cc2cccc(Cl)c2Cl)c(Cl)c1 836706547 SCJQFAKHBVGZJL-UHFFFAOYSA-N 385.678 5.253 30 20 GKED COc1ccc([C@@H]2C[C@H]2CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 850766965 YTHDJSBQGSJIGN-YSIASYRMSA-N 388.492 5.189 30 20 GKED CCOc1ccc(S[C@H](C)C(=O)N(CCC#N)c2cc(C)cc(C)c2)cc1 857841361 SSNPPEOFQNQNOS-GOSISDBHSA-N 382.529 5.130 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)/C=C/c1ccc2ccc(Cl)cc2n1 912899291 KQUWTAMOVSPXOH-VOTSOKGWSA-N 399.233 5.041 30 20 GKED CC(=NNc1ccc(F)cc1Br)c1[nH]c(-c2ccccc2)nc1C 915112144 VYVJYXKYDMMVQE-UHFFFAOYSA-N 387.256 5.123 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CCC1)c1nc2cc(Cl)ccc2s1 917047101 QZXRKQHVPUTITH-HNNXBMFYSA-N 384.863 5.387 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3c[nH]c4ccccc34)cs2)cc1 920068047 HXOZKTBRKVOVLV-WDZFZDKYSA-N 390.464 5.108 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCc1ccc(Cl)cc1Cl 920105287 ACPSVMMOYJRZCK-INIZCTEOSA-N 399.277 5.308 30 20 GKED Cc1c(NN=Cc2c(C(C)C)nn(-c3ccccc3)c2Cl)cccc1C(=O)O 1776086955 ZLLYOWWDVGBBIU-UHFFFAOYSA-N 396.878 5.102 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2cccc(SC(F)(F)F)c2)cc1)C(=O)O 1776470390 MIIIFFYUVARKNZ-OFFHKIPUSA-N 396.386 5.047 30 20 GKED CCCCCCCOc1ccc(CNC[C@@H](CCC(=O)O)C(F)(F)F)cc1 1776786318 PJIPFFDEHHINOS-QGZVFWFLSA-N 389.458 5.169 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cccc(CC(=O)O)c1 1777487734 MBEHQXCFMNBFTI-BJMVGYQFSA-N 397.883 5.295 30 20 GKED C=CCc1ccc(OCC(=O)Nc2ccccc2Cc2ccccc2)c(OC)c1 15960160 DRYFGMRQPHUXQR-UHFFFAOYSA-N 387.479 5.032 30 20 GKED Cc1noc(C(C)C)c1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 41548622 XKBJUNGRCIUEMF-NSHDSACASA-N 393.390 5.225 30 20 GKED COc1cc(C#N)ccc1OCCCC(=O)Nc1ccccc1-c1ccccc1 46763759 NYDKZSOAIKHDDU-UHFFFAOYSA-N 386.451 5.032 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1OCC 60488234 QKZHZGBAMHTSNL-INIZCTEOSA-N 394.496 5.364 30 20 GKED Cc1cccc(C2(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)CC2)c1 65785670 BCIZBEDAYSNFSN-UHFFFAOYSA-N 396.490 5.310 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccccc1C(C)(C)C 66861272 CBOWXNLHTXUNPK-MRXNPFEDSA-N 381.545 5.429 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(OC(F)F)c1 66956050 UNZXFWMRONSAHB-ZDUSSCGKSA-N 391.443 5.004 30 20 GKED N#C[C@@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1ccc(C(F)(F)F)cn1 105754798 PMTRGDVYQDEVIO-MRXNPFEDSA-N 399.397 5.137 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc2ccccc2c1 108355311 UKBVFMONLWDDQT-MRXNPFEDSA-N 375.497 5.142 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cn1 122156985 OFIAYFKJAOBIIB-CYBMUJFWSA-N 383.423 5.097 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(Oc2ncccn2)cc1C)c1ccccc1 155422181 DNVVQYXDFYBOEK-OAQYLSRUSA-N 388.471 5.406 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)N[C@H](C)CC#N 160932354 ZCOWTSSUIHIEMG-OAHLLOKOSA-N 393.466 5.155 30 20 GKED Cc1ncsc1CN(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 179138109 ANASTYRDWVJIMW-UHFFFAOYSA-N 397.887 5.041 30 20 GKED CCc1nc(CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)cs1 216877656 FQUZFVLQNJNXQH-UHFFFAOYSA-N 395.915 5.006 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccccc2)[C@@H](C)C1 246766036 QYSUQUJGTOGCCV-NSHGMRRFSA-N 393.556 5.738 30 20 GKED CCCCS[C@@H](C)C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 303048734 XQYXPUBEGJKPAF-KRWDZBQOSA-N 384.520 5.148 30 20 GKED CC(C)C1(c2ccccc2)CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 413573671 JTERLGFUFDFQQG-QFIPXVFZSA-N 375.516 5.041 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H]3CCCC[C@@H]3C2)cc1 429076330 HNTLQZVLZBCDNV-QZTJIDSGSA-N 391.471 5.013 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1 433752166 VSHCTKBEWJLSHG-UHFFFAOYSA-N 399.397 5.008 30 20 GKED Cc1oc(NC(=O)CN(Cc2ccccc2)[C@H](C)c2cccs2)c(C#N)c1C 435191942 FYMUJXNEURWELY-MRXNPFEDSA-N 393.512 5.032 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(F)c(Cl)cc1Cl 436341810 PCGINNDVXGYTLR-KBXCAEBGSA-N 377.246 5.044 30 20 GKED CC(C)Nc1cc(F)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444259811 OIRALCGJGJYQDO-UHFFFAOYSA-N 378.451 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CSc1ccc(F)cc1 445795782 RDNQWTLVTXLFDY-GJZGRUSLSA-N 388.533 5.444 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)Cc1ccc(Cl)c(F)c1 446776044 LPRUAHJRQSOPDV-UHFFFAOYSA-N 381.900 5.273 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)C1 452563383 SAHDWYMZNIMFTP-BUKVSMQUSA-N 398.959 5.361 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc([C@@H](C)C(F)(F)F)cc2)cc1 455435262 XRAHGZHXMRBFQD-OAHLLOKOSA-N 390.405 5.312 30 20 GKED C[C@@H](CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)c1cccc(F)c1 456588055 ZRBWXFWECXPODT-VZJVUDMVSA-N 385.323 5.051 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1cccc(F)c1 460148274 FSZDUWXVSGOXLE-OAHLLOKOSA-N 392.405 5.158 30 20 GKED CC(C)Cn1c(SCCC(C)(C)C#N)nnc1-c1ccc(Cl)cc1Cl 463049795 VVNIMPQNQQHVQF-UHFFFAOYSA-N 397.375 5.940 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 467910960 NOWFELGDFYQQDF-NDEPHWFRSA-N 398.572 5.344 30 20 GKED CCSc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469333622 CMLKLCAKBZMRFM-KRWDZBQOSA-N 393.556 5.555 30 20 GKED CCOc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H](C)c1ccc(C#N)cc1 470023148 WYOMMKUNYZANSO-UTKZUKDTSA-N 379.504 5.105 30 20 GKED C[C@H](NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)c1cc2cccc(F)c2o1 473872511 DCNNKRBJJZCLJZ-HNNXBMFYSA-N 389.430 5.003 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 475260907 WRHIJOVPWPNQMI-FQEVSTJZSA-N 381.435 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCN(C)C)Cc1ccc(F)cc1 475561579 BVSXRFYZQXFGAR-UHFFFAOYSA-N 397.538 5.273 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 475782238 QZFOTHFSGYMSOE-FQEVSTJZSA-N 381.435 5.377 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2nn(C(C)C)cc2c1 475812786 JWBCPWBLVLWFNE-UHFFFAOYSA-N 389.503 5.179 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCSC[C@@H]2c2ccc(Cl)cc2)cc1 476053241 QICDIZTZRORQJE-LJQANCHMSA-N 384.932 5.071 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 478564714 ANWUITFLZUGPGL-OEMFJLHTSA-N 395.462 5.119 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)s1 486739198 SHKDEYWXHGMFBK-UHFFFAOYSA-N 390.251 5.366 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1Cl 499943248 HYSUBOFIUITPED-AHIWAGSCSA-N 379.674 5.131 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 500084278 PTASVMRDAQVJHJ-QUCCMNQESA-N 395.478 5.307 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 505047039 BLQCHSWXPNIFRE-ZPHPHTNESA-N 381.479 5.145 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)cc1 509911495 MKFJODJDMNOZGY-IBGZPJMESA-N 399.494 5.523 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccc(OCC(F)(F)F)cc1 516757594 XDZYKXPADJSKMG-NSHDSACASA-N 397.784 5.035 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2CCC3(CC2)CC3)cc1 517115185 GNOBNCBXKJGCEL-UHFFFAOYSA-N 389.499 5.176 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 517905446 CSFTUDFLOVCYDI-HXUWFJFHSA-N 397.478 5.680 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccc(F)cc1 518684399 DNYHMHWAXGDIRB-VQIMIIECSA-N 397.519 5.316 30 20 GKED CCOc1ccccc1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520600929 VLIGJKSHVHVZMV-UHFFFAOYSA-N 387.439 5.071 30 20 GKED CC[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 524455499 YAYGURBDKAWSHT-OAQYLSRUSA-N 388.442 5.409 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccn(-c2ccc(Cl)cc2)n1 536055834 SHRDIPWUCFILBB-CQSZACIVSA-N 396.903 5.172 30 20 GKED COc1ccc(CNCc2ccc(-c3ccccc3C#N)cc2)cc1OC(F)F 538003388 WJQVACZNZNAQLD-UHFFFAOYSA-N 394.421 5.125 30 20 GKED C[C@@](NC(=O)c1ccccc1C(F)(F)F)(c1ccc(F)cc1)C(F)(F)F 541009674 FBODAXCCPQTCNS-OAHLLOKOSA-N 379.275 5.052 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1OC1CCCC1 542285476 VPXUTERVGICMKK-INIZCTEOSA-N 392.480 5.116 30 20 GKED N#C[C@H](C(=O)c1cncc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 543058918 ZXXSSMPPALXEFA-QGZVFWFLSA-N 389.867 5.502 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N[C@H](c1cccc(F)c1F)C(F)(F)F 544250502 YNCQZEHOMSEBIY-CYBMUJFWSA-N 380.263 5.328 30 20 GKED C=C(C)[C@@H](NC(=O)CCn1c(C2CC2)nc2ccccc21)c1ccc(F)c(F)c1 547492028 DGYHSXOGUAOTQQ-JOCHJYFZSA-N 395.453 5.016 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 552612312 QMEAIJOYBGAXDG-SFHVURJKSA-N 383.454 5.174 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3ccc(Br)cc3C#N)oc12 558117291 PCOSFIFRAFSKQM-CYBMUJFWSA-N 399.288 5.316 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(Oc3ccccc3)c(F)c2)CC1 558628205 SYHQISCJIQYOIV-UHFFFAOYSA-N 387.458 5.070 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c2C#N)[C@@H](C)C1 562699421 WYVYLEFGHWHASP-XEZPLFJOSA-N 378.497 5.004 30 20 GKED CC(C)Cn1ccc2c(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)cccc21 569468926 NKVBYHDUANSLHR-QGZVFWFLSA-N 385.389 5.201 30 20 GKED Cc1nsc(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1C#N 573238339 BZIOFKDRLWEDGU-UHFFFAOYSA-N 380.420 5.078 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)ccc12 577653433 XADGFAMSSQWEPB-UHFFFAOYSA-N 395.418 5.165 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CCC(C)(C)CC1 577905578 AVIBCOJHFNKEFQ-UHFFFAOYSA-N 378.476 5.178 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2c(F)cccc2F)n1)c1ccc2ccccc2n1 587988664 ATPRYWVABALIKC-CYBMUJFWSA-N 391.402 5.127 30 20 GKED CCN(C(=O)[C@H](C)Cc1ccc(C#N)cc1)[C@@H](c1ccc(C)cc1)c1cccnc1 593972408 CBYKGACTHYRHHF-NLFFAJNJSA-N 397.522 5.078 30 20 GKED C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccccc1-c1ccc(Cl)cc1 595527579 VNEVJCKGODRZDF-DLBZAZTESA-N 381.907 5.403 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccc(C(F)(F)F)cc1 595570427 ZOSKURPUHUMUNQ-MAUKXSAKSA-N 379.426 5.048 30 20 GKED COc1ccc([C@H](NC(=O)Nc2ccc(C#N)c(Cl)c2)c2ccccc2)cc1 603647201 UHSILGKEFZIVTA-OAQYLSRUSA-N 391.858 5.131 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 603656465 ZVTKHMNLSUMQTP-QFIPXVFZSA-N 391.515 5.646 30 20 GKED Cc1cccc(Oc2ccccc2NC(=O)CSCc2ccc(C#N)cc2)c1 603730520 HCJUAEAUOBGGBK-UHFFFAOYSA-N 388.492 5.531 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2ccc(COc3ccccc3C#N)o2)c1 603872047 ZETYZCZSKYFCOV-GOSISDBHSA-N 388.467 5.180 30 20 GKED N#Cc1cccc(CNC(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)c1 609471323 RHHPMIULJYOIEY-VWLOTQADSA-N 391.474 5.300 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@H](c2ccco2)C1 609553224 UCOZVRFEZDHILI-GOSISDBHSA-N 387.439 5.273 30 20 GKED CC(C)[C@H](CC1CCCCC1)C(=O)N1CCC(Oc2cccc(C#N)c2)CC1 609644183 PBVYRKMWLBEFIK-QHCPKHFHSA-N 382.548 5.171 30 20 GKED Cc1sc2nc(S[C@@H](C)c3ccc(C#N)cc3)n(C(C)C)c(=O)c2c1C 609813563 LMHSWMXGBRJIFW-AWEZNQCLSA-N 383.542 5.381 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(-c4csnn4)cc3)c2)cc1 609987766 ZZDDJQBMELJPNP-UHFFFAOYSA-N 397.463 5.073 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1F 610019168 GAOVACJGCFXPJD-DYVFJYSZSA-N 389.471 5.489 30 20 GKED C[C@H](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(C#N)c1 610359282 HGNRTIGFBHPZHD-JTQLQIEISA-N 386.295 5.087 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1SCc1ccco1)c1ccc(Cl)cc1 611251917 NDQXCWMOQWGNCI-GOSISDBHSA-N 382.872 5.220 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1sc(-c2ccccc2)nc1C(F)F 618740400 YJVXFVXEKWEMKG-INIZCTEOSA-N 395.434 5.037 30 20 GKED CCCN(CC(F)F)C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 667673528 DBKCAFULCUISFO-UHFFFAOYSA-N 395.265 5.093 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1ccc(OC(F)F)cc1 725831847 ZYKBWVITHPVTEF-UHFFFAOYSA-N 396.319 5.086 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2oc3ccc(OC)cc3c2C)cc1OC 729149369 DJMRAJSEOSZETG-CLFYSBASSA-N 396.439 5.062 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417780 SOCCOMABHNMDGR-CXAGYDPISA-N 396.487 5.377 30 20 GKED CC(C)n1cc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 732878986 VNYGMSJTMFMIAJ-HTAPYJJXSA-N 387.487 5.002 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1cccc(Cl)c1 733081035 KOQYURZCERIUFX-UHFFFAOYSA-N 391.784 5.047 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)c1 733799740 DVNHEPCHDQIOCZ-PZJWPPBQSA-N 399.922 5.217 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1Cl)c1ccncc1 734679389 LRYSXRQFGMDZNH-UGSOOPFHSA-N 378.303 5.408 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1cnn(-c2cc(C)ccc2C)c1C 741761260 KTSLTBQYYLGZNC-UHFFFAOYSA-N 387.409 5.047 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)o2)cc1 744016816 UMFIOKZEIZSXOG-LJQANCHMSA-N 396.446 5.504 30 20 GKED N#C[C@@H](C(=O)c1cccc2cc[nH]c12)c1nc(-c2c(F)cccc2F)cs1 744073271 CEVJFDKLGDDLON-ZDUSSCGKSA-N 379.391 5.060 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(-c4ccc(F)cc4)s3)cc12 750906497 RYZFWUBSIVZVQT-BAQGIRSFSA-N 377.444 5.040 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ncc(C#N)s3)c3ccccc3n2)c(C)c1 759632275 PCVAPIGCZPQAIV-UHFFFAOYSA-N 384.464 5.099 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2cccnc2)C2CC2)cc1 759685623 YFRZWDMMJAMQMW-GOTSBHOMSA-N 382.467 5.010 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@@H](C#N)C(C)(C)C 765633030 HOSYVVVDSOJOLA-WBMJQRKESA-N 392.908 5.098 30 20 GKED C[C@H](N[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1ccc(OCC#N)cc1 772958927 ISHLZQIZQMWZGE-ROUUACIJSA-N 390.458 5.932 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCc3c2ccc(Cl)c3Cl)c1 772982661 DSCVJSKAVWCBPO-KUHUBIRLSA-N 375.299 5.451 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1ccc(N2CCOCC2)cc1Cl 776841813 PXQVRNTZPZGHSL-QGZVFWFLSA-N 399.922 5.032 30 20 GKED Cc1ccc(-c2c[nH]cc2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 778469681 YNQHESFCVOOFIK-FQEVSTJZSA-N 397.503 5.959 30 20 GKED Cc1nc(F)ccc1/C=C/C(=O)c1sc(/C=C/c2ccc(F)nc2C)nc1C 782331282 VRKUHHJONVTWGX-RIALUSDFSA-N 397.450 5.203 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1csc(Cl)c1 787158304 TTZYLWWRAZKKSP-UHFFFAOYSA-N 397.813 5.108 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2ccc(OC(F)(F)F)cc2)c1 796817027 OHGIQWZSEILLIX-PXNSSMCTSA-N 392.421 5.507 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1nc(Cl)c(C#N)s1 804432053 OTTFNHKQJFMYOT-VIFPVBQESA-N 378.885 5.412 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)o1 806561382 UWKNRNMWJROTEH-VUVZNRFTSA-N 376.383 5.232 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Br)c(Cl)c1)c1ccc2ccccc2n1 810521791 ROENSFVRLJTLGC-CQSZACIVSA-N 399.675 5.070 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Oc3ccccc3)cn2)c1 834650116 GMZYELBBFSIICS-QUCCMNQESA-N 387.483 5.406 30 20 GKED N#C[C@@H](C(=O)COC(c1ccccc1)c1ccccc1)c1nc(C2CC2)cs1 842937915 HJZBYHCPSWOKAV-IBGZPJMESA-N 388.492 5.003 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(C(C)C)nc2C)cc1 916951438 YIWXSUNUSIHXJP-DYVFJYSZSA-N 383.517 5.050 30 20 GKED Fc1ccc(-c2nc(CON=Cc3ccccc3C(F)(F)F)cs2)cc1 920760101 SWYACNOBDSILDE-UHFFFAOYSA-N 380.366 5.519 30 20 GKED O=C(O)Cc1ccc(NN=C2CCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 1776085255 ZGWDMCMBNKGTBN-KRWDZBQOSA-N 376.378 5.068 30 20 GKED O=C(O)C1(c2cccc(Cl)c2)CC(=NOCc2ccc(C(F)(F)F)cc2)C1 1776112180 FVSNWEOJWISLDH-UHFFFAOYSA-N 397.780 5.048 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(C)cc2C)cc1OCCC 1776125938 XEHKKQUNSLIJBQ-VQHVLOKHSA-N 396.483 5.475 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(F)ccc1N(C)C[C@@H](C)CC 1776782909 LUHIJZOSUBCWJD-RXVVDRJESA-N 394.575 5.601 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1C 1776819025 DZWYMSBVIJROPC-ONNFQVAWSA-N 390.435 5.638 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)CC2 1777371043 CNTVQKNJPPJHEK-STZFKDTASA-N 384.431 5.273 30 20 GKED C[C@](Cc1nc2ccccc2s1)(C(=O)Nc1cccc(C#N)c1)c1ccccc1 19199726 RKTKDFKTCPUBAX-XMMPIXPASA-N 397.503 5.307 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCCC2CCCCC2)cc1 33120771 HCAPHRPQSHKINR-UHFFFAOYSA-N 378.541 5.551 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C 44759239 CDEFKSOXRZRXJA-UHFFFAOYSA-N 386.451 5.064 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc3ccccc3n2Cc2ccccc2F)n1 48788948 ZPWPUNZCMLQSDM-QGZVFWFLSA-N 389.455 5.084 30 20 GKED C[C@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 51534128 QIYZELJUOZYJIN-MAUKXSAKSA-N 378.522 5.308 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cc3c(s2)CCCCC3)cc1 58498844 DIZGXUCDDVFFDV-UHFFFAOYSA-N 392.446 5.093 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccccc3)CC2)cc1Cl 59281283 VZYZWXQANMSLPU-OAQYLSRUSA-N 386.882 5.666 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(N(C)C)c(F)c1 65856263 PSNJXABMMSPOSS-UHFFFAOYSA-N 389.430 5.116 30 20 GKED N#C[C@@H](C(=O)c1cscn1)c1nc(-c2ccc(Cl)cc2Cl)cs1 103330506 PHSQWGLFBHMBMC-JTQLQIEISA-N 380.281 5.063 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc(-c2ccncc2)cs1 114620893 HQSKNULGUHAYAU-LJQANCHMSA-N 389.480 5.017 30 20 GKED N#C[C@H](C(=O)c1cccc(OC(F)F)c1)c1nc2cc(Cl)ccc2s1 120005953 PCTYCRTYKOCODM-GFCCVEGCSA-N 378.787 5.041 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C 124898566 KOXIIZJKJXMATN-INIZCTEOSA-N 387.549 5.042 30 20 GKED COc1ccc(CN[C@H](c2ccccc2)C2CCCC2)cc1OCCCC#N 147228752 GWXHNEZJIVEJDB-XMMPIXPASA-N 378.516 5.399 30 20 GKED CCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCCC1 176900353 FONHFXVTGHYSNS-UHFFFAOYSA-N 377.488 5.128 30 20 GKED N#C[C@@H](C(=O)c1ccc2ncccc2c1)c1nc(-c2ccc(Cl)cc2)cs1 179621426 LPAJBVMJIQVHON-KRWDZBQOSA-N 389.867 5.502 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1ccc(OCC#N)cc1 180557973 UYXRWUQLRQSDLQ-AWEZNQCLSA-N 397.931 5.525 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccccc2)c2ccccn2)cc1 181055639 VCUWLCCVETUTDH-SANMLTNESA-N 375.475 5.499 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1ccc(COC)o1 191518598 IUEWGADXPXXGFW-HXUWFJFHSA-N 382.504 5.647 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(C#N)ccc1Br 191696869 RLPGDKLMMLKRGI-CYBMUJFWSA-N 386.318 5.327 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(-c3nc4ccccc4s3)o2)c1 207010072 FGPLCRJNIHVXOB-LUAWRHEFSA-N 388.448 5.411 30 20 GKED CSCc1ccc(N/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)cc1 329408547 ZWLSVFJTEAVMHR-IBGZPJMESA-N 384.549 5.265 30 20 GKED C[C@@H](N[C@H](C)c1nc(O)c2ccccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 376865768 AOSMRWBFFYCLHW-IAGOWNOFSA-N 394.478 5.286 30 20 GKED CN(Cc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccccc1 433762252 MLDAXHLQPLXLQN-HSZRJFAPSA-N 398.510 5.490 30 20 GKED C=CCC[C@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccccc1 435113092 HAXSMBLHMXGKLR-NRFANRHFSA-N 380.513 5.760 30 20 GKED C=CCn1c(SCc2nc(-c3ccccc3)cs2)nc2sccc2c1=O 436125576 CFFWFVGXNATXED-UHFFFAOYSA-N 397.550 5.060 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1N1CCCCCC1)c1ccccc1 439300745 VNPIJHXGCSHGML-HXUWFJFHSA-N 376.504 5.234 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441533320 MONFGHOHAFLAOC-HNAYVOBHSA-N 391.437 5.510 30 20 GKED CC(C)Oc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c(Cl)c1 445035682 BGSOCXMZVVNREB-UHFFFAOYSA-N 383.879 5.195 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc3cc(Br)ccc3c2)n1 448330290 ZZVMLJRZZDBFEX-MRXNPFEDSA-N 399.313 5.672 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 448742532 WOGWJIMVKJIDPE-LLVKDONJSA-N 389.311 5.021 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(OC)c(OC)c1Cl 451333096 QSQSRWCHBIIZIH-UHFFFAOYSA-N 387.907 5.390 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(C1CC1)[C@H](C)c1ccccc1Cl 460560841 DHSKTTVXBVXEOL-BEFAXECRSA-N 386.927 5.089 30 20 GKED COc1cc(CNC(=O)N(C2CC2)[C@@H](C)c2ccc3ccccc3c2)ccc1C#N 462472195 HJQNCINZLQWGEZ-KRWDZBQOSA-N 399.494 5.155 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 464158280 MXHRCMAGCCFUMN-IBGZPJMESA-N 394.302 5.026 30 20 GKED N#C[C@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccccc1Cl 464395622 BFGVVIOKHLVFOX-SFHVURJKSA-N 396.874 5.625 30 20 GKED Cc1cccc([C@H]2CCCCN2C(=O)CCCCOc2cccc(C#N)c2)c1C 464585045 LDZIVZSYGWGCNZ-XMMPIXPASA-N 390.527 5.478 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCc1ccc(Cl)c(Cl)c1 464943307 LQPYVNVQGKPVKM-XLIONFOSSA-N 387.310 5.224 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1c(-c2ccc(Cl)cc2)c(C(F)(F)F)nn1C 466867843 NUOGOBIYTNQYED-LLVKDONJSA-N 385.817 5.300 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3sccc3c2)cc1 471189958 BFTVBONRFOXGAC-UHFFFAOYSA-N 398.487 5.799 30 20 GKED C=CCC[C@@H](C(=O)N1CCC(n2c(C)nc3ccccc32)CC1)c1ccccc1 477418688 NKLZLMJSDVRCTP-JOCHJYFZSA-N 387.527 5.258 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccc(F)c(F)c1 481004100 JVNKDJGETNLMQA-HXUWFJFHSA-N 397.425 5.676 30 20 GKED C=CCn1c(COc2ccc(C)cc2)nnc1S[C@@H](C)c1ccc(C#N)cc1 481366860 GMASMGAQVMCVSZ-KRWDZBQOSA-N 390.512 5.077 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](c1cccc(F)c1F)C(F)(F)F 482421662 ZNWAUQPEDCLEFD-OAHLLOKOSA-N 390.377 5.028 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Sc2nc(C(F)(F)F)ccc2C#N)c(Cl)c1 488784354 PVRAQXCFMHKIMR-SNVBAGLBSA-N 399.825 5.053 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(-c2ccccc2)nn1C(C)C 506860306 SYWLASMFMFZTFZ-UHFFFAOYSA-N 392.478 5.490 30 20 GKED CC(C)(C)c1cccc(OCCCSCCCC2(C#N)CCOCC2)c1 507697576 JOZUJPSNRTUNHD-UHFFFAOYSA-N 375.578 5.587 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1 509720737 UDEGTJITBYKRRQ-IEBWSBKVSA-N 387.405 5.229 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)s1 513681814 JVXMHFOOCOVAHO-CQSZACIVSA-N 375.478 5.218 30 20 GKED CCCCOc1cccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 517530066 XTLBLMQJLDBBPC-KRWDZBQOSA-N 397.544 5.581 30 20 GKED N#C[C@@H](C(=O)c1ccc(Sc2ccccn2)cc1)c1nc2ccccc2s1 518480104 JGXPRZJRBIKMAK-INIZCTEOSA-N 387.489 5.333 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519053017 UDMOUKPHADHKKP-OAHLLOKOSA-N 377.469 5.637 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ncc(-c2ccccc2)s1 521764212 JQKQXQUSNZDCLD-UHFFFAOYSA-N 390.512 5.372 30 20 GKED N#CCC[C@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccccc1 536832649 KGROVZRHICCFGC-VQTJNVASSA-N 391.515 5.961 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)NCc2ccc(-c3ccccc3C#N)cc2)cc1 538111102 WIUZLHLTIUYBLA-GOSISDBHSA-N 399.494 5.136 30 20 GKED C=CCCOCCCCC(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 540486974 KHVQUPZGNKSDDW-UHFFFAOYSA-N 377.406 5.472 30 20 GKED C[C@H](NCc1cccc2c1OCCCO2)c1ccc(-c2cccc(C#N)c2)cc1 542017283 VNVFYGLEDOHKGI-SFHVURJKSA-N 384.479 5.237 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Cc1nc2ccccc2[nH]1 543066536 IYXHDCIZEAGMCO-OAHLLOKOSA-N 392.528 5.022 30 20 GKED CCC(C)(C)[C@@H]1CCc2nc3ccccc3c(C(=O)[C@@H](C#N)c3ccncn3)c2C1 546152488 BXCATDWFOHALKY-APWZRJJASA-N 398.510 5.056 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1sc2c(c1C#N)CCCCC2 554862282 DBXCBGLUEBSNCF-UHFFFAOYSA-N 377.469 5.104 30 20 GKED COC1CCC(CCNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 554896517 QJBFITVYDNNDJV-UHFFFAOYSA-N 393.487 5.067 30 20 GKED CCCc1nc(C)c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)o1 555958102 DVXXFGHZLOAXBC-UHFFFAOYSA-N 397.422 5.212 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H]3CCc4ccc(C#N)cc43)s2)cc1 580680085 FGGDTUUIGZYXLG-LHSJRXKWSA-N 389.524 5.337 30 20 GKED CCOc1ccc(N(C(=O)CCCCCC#N)c2nc3ccccc3s2)cc1 588816589 ZSJYEJKNJUCAIC-UHFFFAOYSA-N 393.512 5.834 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CC4(CCCC4)[C@H]3c3ccco3)cc2)nc1 598040259 OBFVHBNXFZYWGO-JOCHJYFZSA-N 399.450 5.096 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(SCc3ccccc3)cc2)s1 604029044 FVDJWPRXVGACMV-UHFFFAOYSA-N 378.522 5.727 30 20 GKED CC(F)(F)CCC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 607064360 PMILLHXWJZOECX-UHFFFAOYSA-N 395.315 5.734 30 20 GKED N#Cc1cccc(CSCc2nc(-c3cccc(C(F)(F)F)c3)no2)c1 609236225 MHKNHBZXNYELPC-UHFFFAOYSA-N 375.375 5.060 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609261900 JKABGQUGLDNJBA-QGZVFWFLSA-N 388.414 5.079 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1 609398061 AWCIFTZKUXSQAX-BTYIYWSLSA-N 397.519 5.740 30 20 GKED N#CCn1c(-c2nc(-c3cccnc3Oc3ccccc3)no2)cc2ccccc21 609475341 NLXKANUEWWJAFI-UHFFFAOYSA-N 393.406 5.069 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2c(F)cccc2F)c1 609722705 WXHUDQZPORBUPU-UHFFFAOYSA-N 384.769 5.534 30 20 GKED COc1cc(OC)cc(Oc2ccc(CN[C@@H](C)c3cccc(C#N)c3)cc2)c1 610344742 GVZQBZNQTRGTGM-KRWDZBQOSA-N 388.467 5.219 30 20 GKED C[C@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1cccc(C#N)c1 610830094 CYHFHUFHXCOANX-NWDGAFQWSA-N 382.357 5.173 30 20 GKED COc1ccc([C@@H](N[C@H]2CCCc3cc(C#N)ccc32)c2ccccc2OC)cc1 611394727 ZCFHJVBMHKXWHR-AZGAKELHSA-N 398.506 5.332 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N[C@H](C)c1cccc(C#N)c1 611752572 HACAMOIFYWPVGO-GFCCVEGCSA-N 399.372 5.032 30 20 GKED C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622879340 MDKIQXHUCXTETH-BXKDBHETSA-N 389.286 5.144 30 20 GKED CCCCOc1ccc(/C=C(\C(=O)c2cccc(OC)c2)c2ncc[nH]2)cc1 729240340 HNNGIHVMDLZRCT-RCCKNPSSSA-N 376.456 5.021 30 20 GKED N#CCOc1cccc(/C=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 730149318 GENZBLXIHIEAKV-PLNGDYQASA-N 399.290 5.523 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)OCc1csc(-c2ccoc2)n1 731062618 FWRVMZPLDYNJOX-UHFFFAOYSA-N 386.432 5.299 30 20 GKED C#CCOc1cccc(NC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 731111460 QFQMWEOKUFHDFA-IBGZPJMESA-N 389.282 5.374 30 20 GKED CC(C)c1ccc(C2(C(=O)[C@H](C#N)c3nc4ccccc4n3C)CCCC2)cc1 731136608 VLJDMJLLLMWUOU-FQEVSTJZSA-N 385.511 5.385 30 20 GKED COc1ccc(/C=C2/CCOc3ccc(Cl)cc3C2=O)cc1OCCCC#N 733749240 UDHPTRFQTOKRJC-VBKFSLOCSA-N 397.858 5.080 30 20 GKED CC(C)c1ccc(NC(=O)CSCc2cc(Cl)ccc2OCC#N)cc1 735318337 LGZCDCBOILGFGJ-UHFFFAOYSA-N 388.920 5.238 30 20 GKED N#Cc1ccc(/C=C2\SC(=S)N(c3ccccc3-c3ccccc3)C2=O)o1 743281448 ACZCNWJAFBIJIJ-UNOMPAQXSA-N 388.473 5.224 30 20 GKED C[C@H](NC(=O)CCN1c2ccccc2Sc2ccccc21)c1cccc(C#N)c1 743778650 NUEXUPGXTVWIDP-KRWDZBQOSA-N 399.519 5.428 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@@H](C)c3cccc(C#N)c3)c(F)c2)c(F)c1 743779520 XOVBPGZNOCXBMC-AWEZNQCLSA-N 392.405 5.003 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)ON=C(c1ccccc1)C(F)(F)F 751957275 XKNNXHBBBICKDQ-CQSZACIVSA-N 378.394 5.120 30 20 GKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 753935892 BHIFPYZDLBNNSN-SZVBFZGTSA-N 387.508 5.371 30 20 GKED Cc1cccc2c1CN(C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 760050510 YJAKMZUPJOBBKO-HSZRJFAPSA-N 381.479 5.241 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccccc2C(C)(C)C#N)cc1 767806131 GMYGLNJPAYBRHP-QGZVFWFLSA-N 393.531 5.686 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(SC(F)F)c2)c2ccccc21 767842831 NXWMJBNXUUQTGO-UHFFFAOYSA-N 385.439 5.512 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@H]2NC(=O)C1(C#N)CCCCC1 778263170 OARIHLYOYIAJIG-LJQANCHMSA-N 397.519 5.001 30 20 GKED N#C[C@H](C(=O)[C@H](F)Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 778297073 GCYWPTHLZRAYGW-IAGOWNOFSA-N 384.863 5.221 30 20 GKED CC(=NNc1ccc2c(=O)[nH]ccc2c1)c1ccc(Cl)c(C(F)(F)F)c1 789070769 MCUGQGSHOQMYEM-UHFFFAOYSA-N 379.769 5.036 30 20 GKED CCC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](O)c1ccccc1 791816914 CIXBVNPSXLDDNH-LRQRDZAKSA-N 397.544 5.105 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1nc(Br)ccc1F 794968350 BQOLSTPRFSSHGE-HYXAFXHYSA-N 395.278 5.064 30 20 GKED C=CCC(C)(C)C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 796463101 MZEVYTKAPBDYSC-UHFFFAOYSA-N 399.101 5.384 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 800578933 WGFHJSXYGZTKFY-UNMCSNQZSA-N 382.479 5.064 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)sc2cc(F)ccc12 808604852 LYSCCELKWKCVFI-UHFFFAOYSA-N 389.795 5.034 30 20 GKED CC(C)(C#N)[C@H]1CCCC1=NNc1ncnc2scc(-c3ccc(F)cc3)c12 814765710 PZBFZTSWAISCPD-INIZCTEOSA-N 393.491 5.615 30 20 GKED C[C@@H](OC(=O)CC1(C#N)CC1)c1nc2cc(Cl)ccc2n1Cc1ccccc1 815413953 LKXAHKVRSHHBLO-OAHLLOKOSA-N 393.874 5.036 30 20 GKED Cc1c(NCc2ccc(C(C)(C)C#N)cc2)cccc1NC(=O)OC(C)(C)C 858234012 WKURJLIGZDCNLX-UHFFFAOYSA-N 379.504 5.755 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NCc2cnn(C)c2)cc1 907676017 GSNABROKHAZXNB-UHFFFAOYSA-N 388.515 5.136 30 20 GKED C[C@@H](Cc1ccco1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 916510036 ZOPZAYINDGIIFA-MGPUTAFESA-N 393.874 5.341 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2cc(Cl)cc(Cl)c2)cc1 917542324 ADXKBUYWHPNSFH-UHFFFAOYSA-N 397.718 5.413 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(OCC(F)(F)F)cc2)cnn1-c1ccccc1 921265842 STGMFFUUSAKKKN-XFXZXTDPSA-N 386.373 5.018 30 20 GKED O=C(O)c1cc(NN=C(CCc2ccccc2)CCc2ccccc2)ccc1F 1776062177 IFBRYOCOYPDZGS-UHFFFAOYSA-N 390.458 5.557 30 20 GKED Cc1cccc(NN=Cc2ccc(-c3cccc(CC(=O)O)c3)cc2)c1Cl 1776106632 NYMZTBZOOWNUEN-UHFFFAOYSA-N 378.859 5.389 30 20 GKED O=C(/C=C/c1c(F)ccc(C(=O)O)c1F)c1ccc(Oc2ccccc2)cc1 1776126577 PTCOTYOLKDQBPV-ACCUITESSA-N 380.346 5.351 30 20 GKED CCCCCCCOc1ccc(CN[C@@](C)(CCCCCC)C(=O)O)cc1 1776788028 MJVRDXDJQCWOFX-QHCPKHFHSA-N 377.569 5.939 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776817225 DOVQIJXLXPJBNN-FLIBITNWSA-N 392.407 5.035 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)C3(C)CCC3)cc2)CCC1 1785812693 DZYOZLKKNKJLDQ-FQEVSTJZSA-N 380.532 5.079 30 20 GKED N#C[C@H](C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)c1ccccn1 41482401 GXIPOWGHYUEWOT-FQEVSTJZSA-N 383.426 5.178 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1ccc(Cl)s1 49583772 VFZLHTSCBFEVJV-UHFFFAOYSA-N 395.912 5.189 30 20 GKED C=CCN(C(=O)[C@H](CC)OC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 65720173 BHRZHCJNVWHKIB-HNNXBMFYSA-N 385.316 5.061 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)n1C(C)C 66544800 WQPADQWTPSQSFN-IBGZPJMESA-N 388.496 5.171 30 20 GKED Cc1nc(/C=C/c2cccc(C#N)c2)sc1C(=O)/C=C\c1cccc(C#N)c1 96402177 WFJGFTZVNVGONM-PNQPDEHRSA-N 381.460 5.261 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC(C#N)CC2)c(C(F)(F)F)c1 105027315 HOWKHOANOADUKQ-LBPRGKRZSA-N 385.455 5.363 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCO[C@H](C)c1ccccc1 108531611 CMUNQGPWMGLFHW-QZTJIDSGSA-N 397.544 5.228 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1coc(-c2ccc(F)cc2)n1 113053336 IRRVRGMLUKBUJH-CQSZACIVSA-N 395.459 5.056 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nnc(-c2ccccc2C)o1 120795590 ACDFOQSAWJWPRU-UHFFFAOYSA-N 397.525 5.054 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc(C)cc1 122024248 RVPHTPWHJKUSHF-VQIMIIECSA-N 375.497 5.274 30 20 GKED CC(C)[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1CCC(F)(F)F 155337380 OZUSKIYXDKCNSA-IBGZPJMESA-N 390.405 5.095 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2c(Cl)cccc2C1 159296021 YHQGKLLWVQEYSA-CQSZACIVSA-N 385.920 5.324 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 159985377 CAHMRRBALYQTNT-OXJNMPFZSA-N 379.529 5.480 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc(C(F)F)c2)cc1 171547860 RIUAIFOPJOVQPI-UHFFFAOYSA-N 392.405 5.522 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(OCC#N)cc1 181942330 MHMMDQGRIXFFOH-AFMDSPMNSA-N 398.506 5.354 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cc(OC)c(OC)cc2C1 191466972 GDABKAPCVDWLEJ-UHFFFAOYSA-N 394.515 5.146 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccco1)C[C@H]1CCCO1 191516693 UTURIIQJTRQFSK-HXUWFJFHSA-N 382.504 5.345 30 20 GKED Cc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)s1 211709648 WLQUMILRYQQKTE-KHPPLWFESA-N 381.884 5.858 30 20 GKED COc1cc(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)ccc1SC 214949342 MOGGOWQLMDYNIG-HJWRWDBZSA-N 385.485 5.576 30 20 GKED C=CCN(CC=C)C(=O)c1oc2ccccc2c1CSc1nc(C)cs1 216454189 TWWQHVKDELHMJD-UHFFFAOYSA-N 384.526 5.304 30 20 GKED CC(C)(CCC#N)CNC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 236818364 CZUMXUWIKYBVLS-IBGZPJMESA-N 379.935 5.873 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)[C@H]1c1cccc(F)c1 245407817 DAFJTRIOLXMZTN-GCKMJXCFSA-N 397.519 5.835 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c2[C@H]1C 297916777 RUDIDNVDADZZBC-YUMQZZPRSA-N 385.436 5.033 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC(c4ccccc4)CC3)c2)cc1 303224773 WKUGZNKYNQBAGY-UHFFFAOYSA-N 382.463 5.370 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 303955870 UXOJGFCTFULCJW-UHFFFAOYSA-N 381.353 5.035 30 20 GKED C[C@H]1CCCCN1C(=O)c1ccc(N=C(O)c2ccnc(C3CC3)c2)cc1Cl 329432655 IAUDZWVXBDPZCX-AWEZNQCLSA-N 397.906 5.263 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(OCc2ccccc2)cc1 410386659 ZYJZGOYYVNOIBN-UHFFFAOYSA-N 392.524 5.225 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)c1ccc(C2CC2)cc1 419331762 HFBFGEHUJHDMQW-IRXDYDNUSA-N 393.556 5.248 30 20 GKED CCCN(C(=O)c1cccc(SCC#N)c1)[C@@H](C)c1cc2ccccc2o1 429835072 ZBBUSOYWBFBRSM-INIZCTEOSA-N 378.497 5.662 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2cccc(CC#N)c2)ccc1Br 455907721 PNLNJWRNDCFBJN-LJQANCHMSA-N 398.304 5.193 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1cccs1)C1(CO)CCC1 459516768 CQCHGFOLZKWWDD-NRFANRHFSA-N 398.572 5.625 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)[C@@H](C)c3cccc(C#N)c3)s2)cc1 462052405 RDYQQZLCGGAWMD-JKSUJKDBSA-N 389.524 5.280 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(C)oc2ccccc12 464442154 CLYHPRNYPRFNRK-UHFFFAOYSA-N 396.446 5.753 30 20 GKED C=C(C)C[C@@H](C)C(=O)N[C@H](C)c1nc(-c2ccc(Br)cc2)cs1 466545125 MKHUTHPCLALXHK-CHWSQXEVSA-N 393.350 5.352 30 20 GKED C=CCCCNC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@H](F)C(F)(F)F)(C3)C2 468391749 GKGMFOGCLRFAEQ-HHUWHTLVSA-N 397.403 5.191 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCSc4ccc(F)cc43)ccc21 468845794 DWVFTHZEDLXIMA-IBGZPJMESA-N 395.503 5.058 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(C3CC3)nc3ccc(C)cc23)cc1 473720811 QHQOWWKNQIXVFS-UHFFFAOYSA-N 399.494 5.380 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(COC2CCCCC2)c1)c1ccccc1 475253980 HNYHSNQZUZXHTQ-NRFANRHFSA-N 376.500 5.562 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccc(F)c(F)c1 481004099 JVNKDJGETNLMQA-FQEVSTJZSA-N 397.425 5.676 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(OCCCOC)c1 481039430 PYNPSAJYWAQPGU-UHFFFAOYSA-N 394.924 5.037 30 20 GKED C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(OC(F)(F)F)c1 488180498 IKGTXJCLSVIBAN-VIFPVBQESA-N 395.274 5.234 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)c(C(F)(F)F)o1 494006678 KROMISSDPIBLPO-UHFFFAOYSA-N 386.329 5.523 30 20 GKED C=CCN(CCc1ccco1)C(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C 497365195 JQICFCAHKVGPAH-QGZVFWFLSA-N 395.528 5.213 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C)o1 499914601 UWHZATUKASHBQZ-NASSWSRMSA-N 376.500 5.063 30 20 GKED C=CCOc1ccc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)cc1OC 500903436 YYWWIILFSUGXMF-QGZVFWFLSA-N 378.299 5.344 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1 505024740 VZXDWRZFULFTCD-UHFFFAOYSA-N 388.515 5.292 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC[C@@H]2CCCCO2)cc1Cl 506365833 XSUYVGSNROSRSL-AZUAARDMSA-N 397.906 5.076 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1ccccc1Cl 510209156 OIBGCFYSBGETLH-AWEZNQCLSA-N 393.899 5.393 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)c1 512950784 GWBGBBPZLZBRQF-UHFFFAOYSA-N 399.837 5.804 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)CCc2c(C)nc(O)c(C#N)c2C)c(C)c1 513373825 YRIOVVWVPKOUQD-CQSZACIVSA-N 397.544 5.046 30 20 GKED N#C[C@H](C(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1nc2ccccc2s1 513737015 RRHTZTQZTQTWNP-GOSISDBHSA-N 397.459 5.039 30 20 GKED Cc1cccc(CN(Cc2cccc(OCCCC#N)c2)Cc2ccccn2)c1 513741801 QDCISXWAVGGUMK-UHFFFAOYSA-N 385.511 5.275 30 20 GKED CC(C)(C)O[C@H](C(=O)Nc1nc(-c2cccc(C#N)c2)cs1)c1ccccc1 514037982 MZPOUFMWAXFYAX-IBGZPJMESA-N 391.496 5.177 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1sc2c(c1C#N)CCCCC2 514338846 BTXXWEPUSFAKDN-UHFFFAOYSA-N 391.496 5.033 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(F)c(C(F)(F)F)cc1F 516995124 TUSOVMABYDIKNG-NSHDSACASA-N 386.389 5.847 30 20 GKED C=CCN1CCC(NC(=O)N(CCC)[C@@H](C)c2ccc(Cl)c(Cl)c2)CC1 518531281 SBDSRDNFFFIJKD-HNNXBMFYSA-N 398.378 5.126 30 20 GKED C=CCN(C(=O)c1ccc(F)c(C(F)(F)F)c1)c1nc2c(s1)CCCC2 520015391 TXFVOPSLUJAVSV-UHFFFAOYSA-N 384.398 5.013 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](Nc4ccccc4)C3)cc2)c1 520195754 KEOHXXUQSROBPF-OAQYLSRUSA-N 398.466 5.069 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 521327125 SMUDPDVMAJBYPN-QZTJIDSGSA-N 396.556 5.919 30 20 GKED Cc1ccc(CN(C(=O)NCc2ccc(C#N)cc2)[C@H]2CCc3ccccc32)cc1 523003052 GAAJFJJVXRRWSA-VWLOTQADSA-N 395.506 5.266 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc2ccccc2n1 525661131 OIYKSLCRHKMQPP-UHFFFAOYSA-N 397.409 5.314 30 20 GKED C[C@H](C#N)CN(C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)C1CC1 533141892 QRZHWDZBGITWHE-CQSZACIVSA-N 388.389 5.262 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCC(F)(F)F)c(C#N)c2)c(Cl)c1C 541235756 VIFIOKMLCCNAGX-UHFFFAOYSA-N 382.769 5.022 30 20 GKED N#CCc1ccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)cc1 544096831 PARRZNNAAQBVIC-QFIPXVFZSA-N 391.312 5.394 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cccc4[nH]ccc34)no2)c2ccccc21 545563141 QMLKIEFSZVEHAJ-MDZDMXLPSA-N 379.423 5.257 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCCCC(=O)c1ccc(C)cc1 546806119 KXKPFIUEAIPDOG-UHFFFAOYSA-N 376.500 5.049 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 549007813 XOUJLEKAULECCN-GOSISDBHSA-N 377.528 6.119 30 20 GKED COCCCC[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 564537479 VUBAYTGPUHZYRU-FQEVSTJZSA-N 376.422 5.225 30 20 GKED C=CCCCN(C)C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 573171461 KRGQVCQOHUWVME-UHFFFAOYSA-N 380.916 5.305 30 20 GKED Cc1ccccc1-c1cc(NC(=O)c2sc3ccc(C#N)cc3c2C)n(C)n1 582852579 MGOYOVXOMVBKLT-UHFFFAOYSA-N 386.480 5.043 30 20 GKED N#Cc1ccc(Cl)c(C(=O)NC2(c3cccc(C(F)(F)F)c3)CCC2)c1 584670906 YDPBSPIPUFZOOX-UHFFFAOYSA-N 378.781 5.040 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CNC(C)(C)c1cccc(C#N)c1 595634924 ILVMPHGGJPTFSO-UHFFFAOYSA-N 377.532 5.268 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)CC1(C#N)CCCCC1 596802613 RSWRDCFFBCWRFR-UHFFFAOYSA-N 390.487 5.442 30 20 GKED COc1ccc2c(c1)c(C(=O)N1CCC[C@H](CC#N)C1)c(C)n2C1CCCCC1 597912750 JRAQMJARDZAAAH-GOSISDBHSA-N 393.531 5.229 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccccc3CC(F)(F)F)cc2)ccn1 600860779 PXKFVUOHFNKLHO-UHFFFAOYSA-N 383.373 5.462 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 609426999 GEMICUQJHJFANA-UHFFFAOYSA-N 392.846 5.170 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@@H]3CCCC[C@H]3c3ccccc3)cc2)nc1 609502195 SSXFLBRDZOZRCP-XZOQPEGZSA-N 397.478 5.202 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1cccc(C#N)c1 618471941 RMOIDPIHOBELLM-QLJPJBMISA-N 399.775 5.015 30 20 GKED COc1cc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c(C)cc1C 619536059 DXJVXCFLCYPYJO-UHFFFAOYSA-N 388.427 5.015 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 622515064 JIMFOGSONRNNBL-SNVBAGLBSA-N 393.302 5.582 30 20 GKED C=C(CNC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccccc1 672481306 OJJOOXYRLKWYCY-UHFFFAOYSA-N 384.907 5.158 30 20 GKED N#C[C@H](C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1ccc2ccccc2n1 683221510 QGOBYYYOUIFIFS-LBPRGKRZSA-N 376.284 5.022 30 20 GKED C=CCNc1nnc(SCCOC(c2ccccc2)c2ccccc2)s1 684169215 PAGBPBXDIAXXKV-UHFFFAOYSA-N 383.542 5.034 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2cncc(F)c2)cc1Cl 729318764 CBKMBDUHZVBIIG-NSDNCLLMSA-N 391.833 5.181 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)/C=C\c1ccccc1C#N 729419446 LATMSNIATIXROK-UQTJOTSZSA-N 391.471 5.020 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(SC(C)(C)C)cc2C)CC1 730065300 FLWWITSHKYPAGK-UHFFFAOYSA-N 375.582 5.048 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1csc2ccccc12 730069048 VIFXLLOPEDWUSL-MRXNPFEDSA-N 375.497 5.232 30 20 GKED C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 730380358 UMPLNCNTVWCYKC-KOSHJBKYSA-N 381.479 5.493 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C/c1ccsc1 730995457 RPDFFMUFCPLEDN-GORDUTHDSA-N 382.432 5.425 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3c(c2)Cc2ccccc2-3)c1 733842163 QJJZBWLYWUQNGU-NRFANRHFSA-N 397.478 5.260 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3cccc(OCC(F)(F)F)c3)c2c1 734306614 HKWUZFBIDYVNJX-YVMONPNESA-N 375.346 5.014 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1ncnc2sc3c(c12)CCC3 735230701 GYVJDFXVQSQZPC-UHFFFAOYSA-N 387.917 5.028 30 20 GKED COc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c(SC)cc1OC 741471542 BHDJBIYJMFRDBP-BQYQJAHWSA-N 391.492 5.384 30 20 GKED CCC(CC)(CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)SC 742842381 MKRRKXWVMLKDCD-UHFFFAOYSA-N 382.529 5.197 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@H](C)c1ccccc1 746372482 OWWKASCMACWVNF-ZDUSSCGKSA-N 385.393 5.149 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(Cl)s1 749910935 IRUWNICRHPSZOR-KDOFPFPSSA-N 380.900 5.799 30 20 GKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1c(Cl)nc2ccccn12 751535627 OOXLCIQQCDTNLK-SREVYHEPSA-N 377.806 5.085 30 20 GKED CSCCCCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 752484665 IOCSXRFEUBTSQY-OAQYLSRUSA-N 381.545 5.387 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2SC(C)C)c1 761676804 FJRMOLUWMACJMZ-QGZVFWFLSA-N 383.517 5.190 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](c2ccccc2)c2ccccn2)cc1 764568443 JKZXCEGIFXZFLJ-WZONZLPQSA-N 378.903 5.653 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 764930850 VSGDFWDIPLCJJF-WOJBJXKFSA-N 398.506 5.363 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCC23CCOCC3)c1 765256740 DYHCBRMTJJNKCP-UHFFFAOYSA-N 388.552 5.351 30 20 GKED CCc1noc(C)c1C(C)=NNc1c(Cl)cc(Br)cc1Cl 769820460 GBZNLFRLKKURLP-UHFFFAOYSA-N 391.096 5.451 30 20 GKED N#C[C@H](C(=O)C1CCC(C(F)(F)F)CC1)c1nc2cc(Cl)ccc2s1 774056442 SJBATKLTSNPWFN-RTYFJBAXSA-N 386.826 5.495 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1ccc(Cl)c(Br)c1 776187167 AZRDJXITYLVTHK-UHFFFAOYSA-N 378.575 5.534 30 20 GKED Cn1cc(CNc2ccc(OC3CCCC3)c(F)c2)c(-c2ccc(C#N)cc2)n1 778093836 WVPCMLYEBQWDIG-UHFFFAOYSA-N 390.462 5.031 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)c1 780593756 XWUYRJSQPNXCKM-UHFFFAOYSA-N 385.341 5.103 30 20 GKED CCCN(C(=O)c1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)C(C)C 793699023 LRAKGNUCRUMIOS-UHFFFAOYSA-N 391.515 5.001 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCCOc2ccc(Cl)cc2)s1 797566373 IDCDDHWBJZNLEB-HNNXBMFYSA-N 376.909 5.129 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2cc(Br)cs2)s1 797570241 FKCFHDDOTZGENU-LBPRGKRZSA-N 397.363 5.074 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1sc2cc(F)ccc2c1C 805844332 IBQWYNXYLUORST-INIZCTEOSA-N 390.439 5.344 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Br)nc1 810229090 RQLBFKBURTYRPA-OAHLLOKOSA-N 392.300 5.234 30 20 GKED CO[C@](C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 813060559 DGARTPBCSAASIP-UGSOOPFHSA-N 395.311 5.108 30 20 GKED C[C@]1(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C[C@]1(F)Cl 844501328 BIGIBPLJWPTYIR-HLAWJBBLSA-N 385.870 5.168 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)[C@H](C#N)c1nc(-c3ccccc3)cs1)CCC2 847625095 BXJNTCWFILNWHN-QUCCMNQESA-N 388.492 5.115 30 20 GKED C=CC[C@H](c1ccccc1)c1nc(C2(NC(=O)OC(C)(C)C)CCCC2)no1 904419805 PTSRKPBEKCHKPJ-QGZVFWFLSA-N 383.492 5.072 30 20 GKED FC(F)Oc1ccccc1C=NOCc1coc(-c2cccc(Cl)c2)n1 914571725 DBENXJKXHGXMMO-UHFFFAOYSA-N 378.762 5.147 30 20 GKED O=C(/C=C/c1cc(Br)cs1)c1sccc1Br 915113386 OLQDRXQVPXQJOS-OWOJBTEDSA-N 378.110 5.231 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(F)c(F)c2F)cc1 915180036 KOBATTVRZANCLN-INIZCTEOSA-N 384.332 5.151 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(C)cc1 915353530 VASLNONAULNBHW-DNQXCXABSA-N 383.495 5.923 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3ccc(OC(F)F)c(OC)c3)oc12 916130260 MAOXRDWVNALGHQ-CLFYSBASSA-N 388.366 5.338 30 20 GKED COc1ccc(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916627931 DMHIFDZEAGIAKP-NHOBBCMMSA-N 394.883 5.362 30 20 GKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917144111 ZEDZZZKSMUVTQU-WAYWQWQTSA-N 386.410 5.189 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)[C@H](C#N)c1nc2ccccc2s1 917420595 ULUIIAHCOCPJSZ-AWEZNQCLSA-N 377.494 5.255 30 20 GKED N#Cc1ccc(F)c(COC(=O)c2c(Cl)cc(C(F)(F)F)cc2Cl)c1 919298027 VUSGCRBGOSTVKZ-UHFFFAOYSA-N 392.135 5.380 30 20 GKED C[C@H]1CCc2c(sc3nc([C@@H](C)Sc4ccc(C#N)cc4)nc(O)c23)C1 1652612671 KOBNFIRJCANJEB-NWDGAFQWSA-N 381.526 5.247 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776032650 HCDKPWDRZPBXIC-UHFFFAOYSA-N 389.238 5.788 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2ccc(Cl)cc2)c1 1776032721 NBOLVDPNNJNOTL-UHFFFAOYSA-N 380.831 5.063 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3c(F)cccc3Cl)cc2)c1 1776055803 SRYQHXONLRBUKP-UHFFFAOYSA-N 382.822 5.219 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776119947 QLRBJYRSTMZZRV-CSKARUKUSA-N 382.456 5.932 30 20 GKED CC(C)c1cccc2c1OC/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776378005 LGMJBOVRQNXBJD-XMHGGMMESA-N 398.458 5.834 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)cc3)o2)c1)C(=O)O 1776470993 XBIGJKILRYVHGQ-RBJHHQRMSA-N 396.826 5.348 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2cccc(OCC(=O)O)c2)cc1 1776789299 RKYKUPVWAWZREI-KAMYIIQDSA-N 382.456 5.005 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1Cl 1777360726 FBAWETULBYKLJM-KRXBUXKQSA-N 382.799 5.203 30 20 GKED Cc1cccc2c1C/C(=C\c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777456053 DOUYVWJZTMFZSV-KGEPOTPBSA-N 384.431 5.022 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)C3CCCC3)cc2)CCC1 1787611673 STTGMFOCQDSBIW-OAQYLSRUSA-N 380.532 5.079 30 20 GKED Cc1cc(C)c(C#N)c(SCc2csc(COc3ccc(F)cc3)n2)n1 7188059 WXYFCCGRQXVDBO-UHFFFAOYSA-N 385.489 5.037 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC(c3ccccc3)CC2)cc1 32367825 RVDDMUFJQPRQNB-UHFFFAOYSA-N 396.490 5.157 30 20 GKED CCC(CC)c1nnc(/N=C(\O)[C@@H](C)Sc2ccc(NC(C)=O)cc2)s1 51118577 JJOMBNZPZMWYHN-LLVKDONJSA-N 392.550 5.169 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1c(C)cc(Br)cc1C 63391842 WMEKPJSIGPMYTF-UHFFFAOYSA-N 398.304 5.158 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1sc(C)c(C)c1C#N 66014699 UHDJABYYBDTCSA-UHFFFAOYSA-N 393.946 5.636 30 20 GKED Cc1cc(Br)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 66158243 BIPOIIQCMATMRK-UHFFFAOYSA-N 386.293 5.072 30 20 GKED C=CCN(C(=O)C[C@H]1OCCc2ccccc21)c1nc(-c2ccccc2)cs1 79356182 WKCWPVWCMXLFDB-OAQYLSRUSA-N 390.508 5.033 30 20 GKED COc1ccc(CN(C)[C@H](c2ccccc2)C(F)(F)F)cc1OCCCC#N 93052307 FZQROWUGGHSVTD-HXUWFJFHSA-N 392.421 5.113 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCc1ccccc1Cl 107805508 HWOYIHVLDDZCHB-UHFFFAOYSA-N 391.858 5.279 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1cccc(F)c1F 108409306 ARHUSCNMEFHHNT-CYBMUJFWSA-N 392.496 5.088 30 20 GKED CC[C@H](N/C(S)=C(/C(=O)c1ccccc1)[n+]1ccc(C)cc1)c1cccs1 115511077 RQYOPYYHAALFTH-SFHVURJKSA-O 395.573 5.024 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccncc1 120714305 MILIJHZUEWJRQR-IIBYNOLFSA-N 389.886 5.523 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)CCCCc1ccc(Cl)c(Cl)c1 121013128 YJZOXCFMCTVCEK-UHFFFAOYSA-N 390.314 5.044 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc2ccccc2c1 129688541 AKLDCCRJKCYMPV-MRXNPFEDSA-N 383.234 5.108 30 20 GKED COc1cc2c(cc1NCc1nnc(-c3ccc(C#N)cc3)o1)oc1ccccc12 132923793 KYBDBDJQJWOTHQ-UHFFFAOYSA-N 396.406 5.128 30 20 GKED CCC[C@@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 135507407 NOGWAERGKBTYNN-HXUWFJFHSA-N 391.515 5.376 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C(C)=C/c1cccc(Cl)c1 136601713 HJAOYEXUSHJJQH-IZLCOFNUSA-N 394.902 5.216 30 20 GKED CC(=O)N(c1ccccc1)c1nc(CSc2ccc(C#N)cc2Cl)cs1 154179505 FQVJLPABVQHQHS-UHFFFAOYSA-N 399.928 5.645 30 20 GKED COc1ccc2c(c1)c(C(=O)[C@H](C#N)c1nc(C)cs1)c(C)n2C1CCCC1 155904468 ZEBWCYXQJNKLGJ-SFHVURJKSA-N 393.512 5.328 30 20 GKED N#CCCCCNC(=O)c1oc2ccccc2c1CSc1ccccc1F 171500418 JPEHCUJEANSHRF-UHFFFAOYSA-N 382.460 5.288 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1C 173122715 JPJGLQBGCOSUBN-DYESRHJHSA-N 393.556 6.067 30 20 GKED O=C(Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1c(F)c(F)cc(F)c1F 175751754 ZUKBWDFYRAIRRJ-UHFFFAOYSA-N 399.265 5.580 30 20 GKED Cc1c(N=Cc2cc3ccccc3nc2O)cccc1NC(=O)c1ccccc1 255780326 YMRPSUAUCMHYAI-UHFFFAOYSA-N 381.435 5.252 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C\c2ccccc2OC(F)(F)F)n1 255870794 ZPXKMPYEXSODMC-MEJMFZKBSA-N 380.391 5.055 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C(C)(C)Cc1ccc(C#N)cc1 410628197 WPDSWJOOKKOBKG-MRXNPFEDSA-N 383.561 5.235 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(F)c(C#N)c2)c(C(F)(F)F)c1 430691516 MHLBKFLVAMUAQP-LLVKDONJSA-N 396.409 5.859 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCc2ccc(F)cc21 432098564 YOUYRLAWEFUEGK-KSSFIOAISA-N 383.492 5.277 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1ccc(-c2nc3ccccc3s2)s1 433970094 DEZFAFBANSQABF-UHFFFAOYSA-N 379.441 5.288 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(Cl)c(C(F)(F)F)c3)[nH]c12 437380163 MNCDVFSMTTWCBS-LLVKDONJSA-N 377.753 5.034 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638921 ZVHKCTGMXVIHTH-AWEZNQCLSA-N 387.405 5.410 30 20 GKED CCCc1c(NC(=O)Nc2cccc(C(F)F)c2)cnn1-c1cccc(C#N)c1 439229300 LRGWRSODWHVOFR-UHFFFAOYSA-N 395.413 5.278 30 20 GKED CCCc1c(NC(=O)CC/C=C/c2ccccc2)cnn1-c1cccc(C#N)c1 440090477 HBSXDJWATNSEET-WUXMJOGZSA-N 384.483 5.129 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC2CCC(C#N)CC2)C1 441006565 UYSYLZHARGGGMV-GKSFYBEXSA-N 393.453 5.128 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 442296848 NQUZCNZFMPHTRC-RDTXWAMCSA-N 377.410 5.168 30 20 GKED C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1C(=O)N[C@@H](CCCC#N)c1ccccc1 458838203 LWKQMNAKAFSSJJ-MVJTYMMSSA-N 381.442 5.182 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1c(C)cccc1F 461916502 JWPZBXMIDDQEIF-UHFFFAOYSA-N 395.247 5.256 30 20 GKED CSCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464303301 ZLXIUSPVNDTHSA-UHFFFAOYSA-N 380.391 5.061 30 20 GKED CN(Cc1cc(Cl)cn1C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 467456691 IGTCRRWSJMXEFL-UHFFFAOYSA-N 394.862 5.006 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CC[C@H]3Cc3ccccc3)cc2)cc1 472195200 VJOIPXXGPSRWLZ-QFIPXVFZSA-N 382.463 5.002 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](c2cccc(Cl)c2)c2ccccn2)c1 473791137 HYYJICUAWZEVIG-NRFANRHFSA-N 393.874 5.211 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN(Cc1ccccc1)C(C)(C)C 474264067 HMCGWDONFFVQAZ-GOSISDBHSA-N 395.572 5.178 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC(n2c(C)nc3ccccc32)CC1 477406090 PSDFMQBFHSGQCV-UHFFFAOYSA-N 391.540 5.100 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 483190095 AJFKXRUYZJQOCX-DJJJIMSYSA-N 387.405 5.501 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@H](C#N)c3nccc4ccccc34)cs2)cc1 483191712 GAPSTLXAWACGIE-LJQANCHMSA-N 383.476 5.081 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CCOCC1 483297855 UJZCRPCRWAQNRC-HXUWFJFHSA-N 396.918 5.387 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 485756426 GAVWLTKRPSAXHR-UHFFFAOYSA-N 388.492 5.469 30 20 GKED Cc1c(C(=O)Nc2cc(F)c(OC(F)F)cc2F)ccc(C(F)(F)F)c1F 490284094 JUOTYRPOVZDWLZ-UHFFFAOYSA-N 399.237 5.285 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(C)c(NC(=O)NC(C)(C)C)c1 504264016 GMOXHXXJTZIGRF-UHFFFAOYSA-N 379.504 5.286 30 20 GKED CSc1cc(C(=O)N[C@@H](C#N)c2ccccc2Cl)c(Cl)cc1Cl 505632368 JHCIIBATVXWIFP-AWEZNQCLSA-N 385.703 5.363 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccccc1-n1cccn1 512859196 ATBNTIWQOSZLKR-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 513200931 KSULMNVFJYXQOL-MRXNPFEDSA-N 389.430 5.237 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)Nc1ccccc1S[C@@H](C)CC#N 520195943 RMKJGHNMOHRYLO-HNNXBMFYSA-N 387.936 5.788 30 20 GKED N#Cc1ccccc1CNc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 521884955 GBXXIKOJOVDUJW-DEOSSOPVSA-N 381.479 5.148 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 521954812 AYJPDBNHQRQXRJ-QZTJIDSGSA-N 387.310 5.407 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3csc(-c4cccc(Cl)c4)n3)[nH]c12 522830538 CVMAZHHLOXNLES-AWEZNQCLSA-N 392.871 5.138 30 20 GKED COc1cc(CSCCc2ccccn2)ccc1OCc1cccc(C#N)c1 523938030 SCHKGVVQMYSLHT-UHFFFAOYSA-N 390.508 5.017 30 20 GKED CC[C@@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 525345701 WKPWTKHPGYPWSI-LJQANCHMSA-N 393.487 5.546 30 20 GKED N#C[C@H](C(=O)c1ncsc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 527101679 IGZDUXRWFDSADI-CYBMUJFWSA-N 395.896 5.563 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](c1cccnc1)C1CC1 534777132 QPRGASRHQKEVPL-HSZRJFAPSA-N 398.466 5.327 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(OC[C@H]3CCCO3)c2)CC1 537734474 QOHRWAWNBKLIMK-SDPJGKNGSA-N 376.500 5.060 30 20 GKED COc1ccc(-c2cncc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)c2)cc1 538073950 PONBGTZMWBWMSR-UHFFFAOYSA-N 391.496 5.240 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@H](C)c3ccc(C#N)c(F)c3)c2)cc1 538510801 LYNLBQGNUQXUAS-QGZVFWFLSA-N 387.458 5.109 30 20 GKED Cc1nc(CCC(=O)Nc2cc(C(C)(C)C)sc2C#N)oc1-c1ccccc1 539175389 OKDCMEFFLKGAJZ-UHFFFAOYSA-N 393.512 5.452 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cnn(-c2ccccc2)c1CCC 541188879 QLBQNFULZNFAEJ-UHFFFAOYSA-N 380.517 5.106 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1ccc(F)c(C#N)c1 544487195 WWQUOORCVRHKNE-GFCCVEGCSA-N 385.895 5.634 30 20 GKED CC1(C#N)CCN(C(=O)c2cc(F)ccc2Sc2ccc(Cl)cc2)CC1 545425404 BVFURXJQJCQWSL-UHFFFAOYSA-N 388.895 5.396 30 20 GKED CC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC(F)(F)F)cc1 550826444 FYILBAVAHRNWIV-PMACEKPBSA-N 376.422 6.061 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cc(Cl)ccc1SCC 554441136 PCWMAQKMHNAZBQ-UHFFFAOYSA-N 394.924 5.148 30 20 GKED N#CCCCn1cc(-c2nc(C(F)(F)c3ccc(F)cc3)no2)c2ccccc21 571922669 QOHRFAANSOKNTC-UHFFFAOYSA-N 396.372 5.274 30 20 GKED N#Cc1cc(C(=O)N(CC2CC2)c2cccc(C(F)(F)F)c2)ccc1Cl 580986283 RJSYBZHPHLDNAF-UHFFFAOYSA-N 378.781 5.287 30 20 GKED CSCC1(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)CC1 593059814 YDZFPPHXSYUAPL-UHFFFAOYSA-N 388.480 5.183 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 609222200 YJATUMCJPYQCPD-GOSISDBHSA-N 385.467 5.407 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1cccc(C(F)(F)F)c1 609377508 HOOCTNQNIHNFEH-ZDUSSCGKSA-N 378.419 5.138 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccc(Cl)c(Cl)c1 609463585 LSHQMANAHJQIRN-MRXNPFEDSA-N 389.213 5.387 30 20 GKED COc1ccccc1N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609723669 SCQNQPKALLSJCW-UHFFFAOYSA-N 392.842 5.289 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3oc4ccc(F)cc4c3C)n2)cc1 613315262 JGQFCCXTTQLUJO-KRWDZBQOSA-N 390.439 5.802 30 20 GKED COc1ccc2cc(-c3noc([C@@H]4CCCN4c4ccc(C#N)cc4)n3)ccc2c1 615131476 OEZDEIAEFTZWJE-QFIPXVFZSA-N 396.450 5.112 30 20 GKED C=CCN(Cc1csc(-c2cccc(OC)c2OC)n1)Cc1ccccc1F 615354042 WUBPFYDLQBDRNI-UHFFFAOYSA-N 398.503 5.155 30 20 GKED C=CCOc1ccc(/C=C\C(=O)O[C@@H](C)c2cnc3ccccc3c2)cc1OC 726333468 YFPBFSRDDVONEF-LUJNMSEFSA-N 389.451 5.126 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1nc2ccccc2n1C(F)F 727261850 HSUSXUICMRNLTQ-UHFFFAOYSA-N 398.335 5.209 30 20 GKED Cc1cc(C(=O)N2CCCCC[C@H]2c2ccncc2)c(C)n1-c1ccc(C#N)cc1 728267434 KOSQNBDJXPNRQF-DEOSSOPVSA-N 398.510 5.118 30 20 GKED COc1cc(C(=O)/C=C/c2csc(-c3cccs3)n2)ccc1OC(F)F 728440441 XXFWIAHWRIVWEF-AATRIKPKSA-N 393.436 5.378 30 20 GKED Cc1c(C(=O)/C=C/c2csc(-c3cccs3)n2)cnn1-c1ccccc1 728440741 TUFURJNLEZKUTC-MDZDMXLPSA-N 377.494 5.262 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1csc2ccccc12 731400055 KQYRQHIMPGWCCW-HUUCEWRRSA-N 395.553 6.178 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1cccc(C(F)(F)F)c1 731646202 ZNNWXISIXSBBIK-FQEVSTJZSA-N 380.369 5.367 30 20 GKED O=C1/C(=C/c2ccnc3ccccc23)CSC/C1=C\c1ccnc2ccccc12 731836026 ZMUHJTVHVMGJKJ-IWGRKNQJSA-N 394.499 5.566 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 732495991 LFYHHCGSVXCGKD-FUNAXGEOSA-N 396.874 5.882 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733680823 IZLKYHGYHACETO-DZGCQCFKSA-N 396.434 5.229 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2c(Cl)nc3ccccn23)cc1 741468182 URIQTSKMIZWOTR-KAMYIIQDSA-N 388.854 5.559 30 20 GKED O=C(Cc1cccc(F)c1)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 746437128 KEEMXOMQFOATJU-OAHLLOKOSA-N 380.259 5.234 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=C(c3ccccc3)C(F)(F)F)o2)cc1 751955086 OWVZMXAABBATLE-CYBMUJFWSA-N 375.350 5.089 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(OC)cc1 752495996 PINGQDXZQLXSIW-GUYCJALGSA-N 382.460 5.204 30 20 GKED CC(C)c1ccc(Nc2nn(CN(C[C@H](C)C#N)C3CC3)c(=S)s2)cc1 753988320 PGFCTGKNLKZHJO-CQSZACIVSA-N 387.578 5.123 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 755754890 BXDUYNBOHIRGPU-DKLXNKCPSA-N 396.494 5.352 30 20 GKED CCOc1c(Cl)cc(C=NOCc2nc(C(C)(C)C)cs2)cc1OC 755938819 CFDVECWXESZIMI-UHFFFAOYSA-N 382.913 5.052 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(C(F)(F)F)ccc2F)cc1 760365606 MKCGVWVDZYEETD-LJQANCHMSA-N 398.359 5.752 30 20 GKED C=CC[C@@H](NC(=O)N1CC[C@H](Cc2ccc(C(C)C)cc2)C1)c1ccncc1 764725681 MWJAUNWZCPORNO-NFBKMPQASA-N 377.532 5.096 30 20 GKED C=C(C)COc1cc(CNc2cccc(C3SCCS3)c2)ccc1OC 770512379 JVDDBOZYFDKZGE-UHFFFAOYSA-N 387.570 5.741 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)CCc2ccc(Cl)s2)ccc1OC 772980528 RBWBTROMPPOXKN-HOCLYGCPSA-N 392.952 5.202 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc3c(c2)CCC(=O)N3C)cc1 774131957 UDZWRILMXHMJKF-OVCLIPMQSA-N 397.474 5.167 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccnc(Cl)c1 779459813 HLMUALJBEPTABU-HJWRWDBZSA-N 397.261 5.537 30 20 GKED C/C=C/C(=O)N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 783557729 HXHGGOUXBHFVBZ-KXMPLOMGSA-N 379.222 5.020 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1 790966002 VDGFNEZHJOPKTI-OAHLLOKOSA-N 395.812 5.046 30 20 GKED C=CC[C@@H](OC(=O)c1cccc(C[S@](C)=O)c1)c1ccc(Cl)c(Cl)c1 797566411 JFZKNGFSWDBXDP-CJAUYULYSA-N 397.323 5.346 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797567288 GACLKHIHWUUYTN-CRAIPNDOSA-N 384.545 5.599 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc1-c1ccc(F)cc1 797569584 SOQDRAUCBSKUFU-HNNXBMFYSA-N 381.476 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC1(CNC(=O)OC(C)(C)C)CC1 841197198 HXIZJLOEMRQART-UHFFFAOYSA-N 386.536 5.172 30 20 GKED N#C[C@H](C(=O)C1CC2(C1)CC2(F)F)c1nc(-c2ccc(Cl)cc2)cs1 850762943 RMXDOIYNZUTQFE-OFKYTCTHSA-N 378.831 5.075 30 20 GKED Cc1cc(NC(=O)c2ccc(C(C)(C)C#N)cc2)ccc1NC(=O)OC(C)(C)C 856371785 AHFBRSKMILKTTQ-UHFFFAOYSA-N 393.487 5.396 30 20 GKED C#Cc1cccc(NC(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1 915340219 ORLHXMOVORPPTA-JOCHJYFZSA-N 379.463 5.103 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 915353210 RPVCWESVUDABCZ-WRALFONMSA-N 387.527 5.775 30 20 GKED CC(C)(C)c1ccc(CCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917039717 CECGPOUFWICWTR-KRWDZBQOSA-N 395.453 5.538 30 20 GKED N#Cc1cccc(NC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c1 917667231 LDOPTSGVAOHWOJ-ZDUSSCGKSA-N 392.311 5.488 30 20 GKED C=CCC[C@H](CC(C)C)C(=O)Nc1cc2c(c(C(=O)O)c1)Oc1ccccc1O2 1776166329 RGCTXJQNVXZSKA-OAHLLOKOSA-N 395.455 5.850 30 20 GKED CCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776676240 JXJGMUYMRQAOFB-FZSIALSZSA-N 399.446 5.296 30 20 GKED CCCCCCCCOc1ccc(/C=C(\CC(=O)O)c2ccc(C=O)o2)cc1 1776785536 KOENQWBGHVUYQE-XDJHFCHBSA-N 384.472 5.847 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1 1776785635 YNYZKCGJZCEICY-JLHYYAGUSA-N 386.513 6.082 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2cccc(C)c2)c1 1776788103 SBSGVTYJQQTBNN-HSZRJFAPSA-N 383.532 5.650 30 20 GKED N#Cc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1 7765033 OABXZVGBMOKWHF-FQEVSTJZSA-N 399.881 5.255 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCC(=O)Nc2ccc(C(C)C)cc2)n1 21514441 CHHDVRKYCXUGNN-UHFFFAOYSA-N 393.434 5.135 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@@H](C)c3ccc(C#N)cc3)sc2C)cc1 31436965 PSGBKKZBKHSIOM-AWEZNQCLSA-N 376.481 5.095 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)F)cc1)c1nc2ccccc2n1C(F)F 41557248 YJCQZYXVCPJMRH-GFCCVEGCSA-N 393.365 5.236 30 20 GKED COc1ccccc1CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 56744502 JAEHOVUJRCSZKX-UHFFFAOYSA-N 387.439 5.023 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccccc1C(F)(F)F 66861036 IERZQINHTDUIBY-CYBMUJFWSA-N 393.434 5.150 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccc(C(F)(F)F)cc1 66861192 OJLINNPJTNFQTH-CYBMUJFWSA-N 393.434 5.150 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1 107320420 GZMOAEYIXIDZLD-NIYFSFCBSA-N 398.506 5.182 30 20 GKED Cc1cccnc1[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 115769765 TZZZKLACWYYJIA-VQIMIIECSA-N 382.533 5.303 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1COc1ccccc1)c1ccccc1 119486570 PLWZAXICWAQOPB-QFIPXVFZSA-N 385.467 5.432 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccncc3)cc2)cc1 124198196 ZQBZCBDIESPBTG-JOCHJYFZSA-N 384.439 5.115 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cn2)c1C 125514510 XCYJNFAKJDYHIX-UHFFFAOYSA-N 390.443 5.032 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Br)c(Cl)c2)n1 126041621 VHYMSCGXYRUFCH-JTQLQIEISA-N 383.698 5.172 30 20 GKED Cc1sc2nc3n(c(=O)c2c1-c1ccccc1)CC/C3=C/c1ccc(C#N)cc1 136323044 BRMBTXFFKYFIQO-UYRXBGFRSA-N 395.487 5.249 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc2ccccc2n1C(F)F 170998921 SJYSYHJPLSQWSZ-KRWDZBQOSA-N 395.409 5.243 30 20 GKED COc1cc([C@@H](C)Nc2cccc(OCCCC#N)c2)ccc1OC(F)F 179821483 NTYPPTHYUHLUOG-CQSZACIVSA-N 376.403 5.152 30 20 GKED C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)c1cccc(C#N)c1 189815538 VYKSYGPDTHBOKE-AWEZNQCLSA-N 385.496 5.486 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 195629371 ZOVHVEOGEMQBCM-IRXDYDNUSA-N 388.389 5.106 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1csc(C2CC2)n1 195748387 XTZGGPXIMYMOCB-UHFFFAOYSA-N 375.453 5.245 30 20 GKED COc1ccc2cc([C@@H](C)C(=O)Nc3sc4c(c3C#N)CCCC4)ccc2c1 208967322 ZOWJMAFAMNNZGU-CQSZACIVSA-N 390.508 5.403 30 20 GKED Cc1ccccc1O[C@@H]1CCCC[C@@H]1/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330021193 XKPVRAFHIXKYAP-PEVXEQIPSA-N 398.547 5.567 30 20 GKED Cc1ccc(N=C(O)N2CC[C@@]3(C)[C@H](C2)C3(F)F)cc1N=C(O)C(C)(C)C 330335862 RXULSNCPWGROCE-KXBFYZLASA-N 379.451 5.152 30 20 GKED CC(C)(C)C(=O)Nc1ccc(F)c(/C(O)=N/[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 330929578 YURFCFQQWVONDG-VXGBXAGGSA-N 388.405 5.236 30 20 GKED Cn1nc(C(F)F)c2cc(C(=O)Nc3sc(C(C)(C)C)cc3C#N)sc21 411005472 FZPNBOYSNMUXSI-UHFFFAOYSA-N 394.472 5.055 30 20 GKED CC[C@@H]1C[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 421044508 IBZYIZSNKPFCHF-QWFCFKBJSA-N 397.906 5.075 30 20 GKED CCCOc1cc(C)ccc1CNC(=O)N[C@@H](CCCC#N)c1ccccc1 431286921 HZLSLMLNMDPQQN-NRFANRHFSA-N 379.504 5.018 30 20 GKED N#Cc1csc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c1 437333090 PRULTLWYTVIAMN-UHFFFAOYSA-N 380.281 5.302 30 20 GKED C[C@H](OCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437503530 RXHCYEOJOCYOCA-INIZCTEOSA-N 390.414 5.033 30 20 GKED CCOc1ccc(-c2nc(CN3CCC[C@@H]3[C@@H](C#N)c3ccccc3)co2)cc1 437575731 AWMJKCUPLXDWAR-XZOQPEGZSA-N 387.483 5.012 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2cc(Cl)ccc2s1 439655390 ZDGHADFTUXBKDF-JTQLQIEISA-N 398.768 5.598 30 20 GKED N#CCC[C@@H](NC(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccccc1 439674112 OYWOJXOSUBPPNN-OAQYLSRUSA-N 375.859 5.177 30 20 GKED CC(=O)c1ccc2cc(Oc3cc(C#N)c4cc([N+](=O)[O-])ccc4n3)ccc2c1 443518604 LZRGQVLKEHNBPW-UHFFFAOYSA-N 383.363 5.163 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)[C@H]1CCCC(F)(F)C1 443526931 AZBLULGAJGJICM-INIZCTEOSA-N 388.845 5.570 30 20 GKED N#CCCCn1cc(C(=O)N2CCCCC[C@@H]2c2ccncc2)c2ccccc21 444038586 ZBZRRWJDIPPFRD-JOCHJYFZSA-N 386.499 5.098 30 20 GKED Cc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 444911380 ZGYBNJDQZYLXCO-ZWKOTPCHSA-N 381.545 5.484 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)[C@H](C#N)c2nc3c(C)ccnc3[nH]2)cc1 448327547 LCLKIUZJJJSKGO-SFHVURJKSA-N 398.491 5.216 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1cc(C)ccc1C 453462800 IPYKWGRISHAQCK-SFTDATJTSA-N 380.536 5.054 30 20 GKED C=CCN(C(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1)C1CC1 464303280 SUFSVKWYTGQOQG-UHFFFAOYSA-N 378.900 5.057 30 20 GKED COc1ccccc1[C@@H](NC(=O)Nc1cccc(C#N)c1)c1ccccc1Cl 466073483 FFZVTCXEIZXGME-NRFANRHFSA-N 391.858 5.131 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NC1CC(c2ccc(F)c(Cl)c2)C1 466848501 ZBRZDYIIZRTFGC-UHFFFAOYSA-N 399.897 5.217 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3c(C)oc4ccccc34)n2)cc1 467841372 ZUIDRPOFOMDNEJ-QGZVFWFLSA-N 388.448 5.363 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc(-n2ncc3ccccc32)cc1Cl 469686397 WTWYAOORCKIHCQ-UHFFFAOYSA-N 386.842 5.111 30 20 GKED C=CCn1c(SCC2CCC(C(F)(F)F)CC2)nnc1-c1ccoc1C 471447091 OOFHPQYLSYSDAO-UHFFFAOYSA-N 385.455 5.493 30 20 GKED Cc1ccc(Oc2ccccc2)c(NCc2nnc(-c3cccc(C#N)c3)o2)c1 471657801 ZVGSCEAIVGOKEQ-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(OCC(F)F)c1 475581499 GDGXFRNUMFEXHP-UHFFFAOYSA-N 388.458 5.504 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)ccc1F 481592255 APSHDKBXPUNBMB-QGZVFWFLSA-N 378.234 5.373 30 20 GKED N#Cc1cc(NC(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)ccc1F 481623229 JFESFZIZCLBJRQ-SFHVURJKSA-N 391.368 5.475 30 20 GKED CC(C)CC(=O)Nc1cccc(CN[C@H]2CCCCc3cc(C#N)ccc32)c1 481922687 MQCJZPOYNZMMTJ-QHCPKHFHSA-N 375.516 5.100 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 483000273 ZTCSUDRLBYRWDP-NQIIRXRSSA-N 393.487 5.066 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CC(C)(C)C(F)(F)F 483261607 HRUNVFTYHHEXBM-UHFFFAOYSA-N 392.396 5.518 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(Br)c(F)c1 484751276 JRTPKHPOGOSDET-GFCCVEGCSA-N 379.298 5.452 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cccc2c1C[C@@H](C)N(C(=O)[C@H](C)CC(=C)C)C2 486110652 NUKILSSINGZKPH-IPMKNSEASA-N 382.548 5.103 30 20 GKED N#CCCC[C@H](NC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccccc1 487531883 FFRXRLMOTOIXDI-FQEVSTJZSA-N 393.874 5.089 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cccc(-c2ccccc2)c1 495546548 IVEUMVPIURZHMM-UHFFFAOYSA-N 376.456 5.049 30 20 GKED C=CCC[C@H](NC(=O)CC1(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1 502019781 SPTDUPZYBLWVNF-AWEZNQCLSA-N 379.344 5.562 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)cc1 507285394 SCMOVPVTSXKJAQ-JOCHJYFZSA-N 398.510 5.245 30 20 GKED CCc1c(C)sc(NC(=O)c2cccc(COc3ccc(C)nc3)c2)c1C#N 510836598 MUKWQOBQJSEAEO-UHFFFAOYSA-N 391.496 5.025 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)cc1 511168956 JIDIICHDRUAQQL-HNNXBMFYSA-N 382.504 5.107 30 20 GKED CN(C(=O)c1cccc(C#N)c1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 513425744 AQVUIHDONXBYDG-UHFFFAOYSA-N 397.356 5.041 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4c(c3)CCCC4)n2)cc1 516713650 DYQFAPUYKVJZEN-HXUWFJFHSA-N 388.492 5.188 30 20 GKED N#Cc1ccccc1COc1cccc(CNCCc2cccc3cccnc23)c1 520207441 YMVAAVSQXDWNSA-UHFFFAOYSA-N 393.490 5.018 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520280537 GUFRIWZGGVGXIA-SJORKVTESA-N 397.544 5.751 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(OC(F)F)c3)cc2)c1 520913498 GKXLABJCBLEPCZ-UHFFFAOYSA-N 380.350 5.204 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@H](C)O1 523628428 NCNYTIIANFMLBH-QKYXUNIQSA-N 397.906 5.027 30 20 GKED Cc1cc(C)c(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 524614568 FZIDRNFIAQRJSS-GOSISDBHSA-N 398.597 5.878 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccccc1 524916884 IGQNNDCEXZPPRK-INIZCTEOSA-N 388.496 5.639 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(C[C@H](C)C#N)C3CC3)cc2)cc1 533138912 ASHAZWVUMBVLJV-OAHLLOKOSA-N 381.501 5.002 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSCC(F)(F)F)cc1Cl 534170495 HOPCNXCIFHVSJT-OAHLLOKOSA-N 398.837 5.229 30 20 GKED C=CCCOCCCCC(=O)N1CCc2sccc2[C@@H]1c1cccs1 539366169 BROFKNHGDFQVRV-HXUWFJFHSA-N 375.559 5.047 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(SCc3ccccc3Cl)cn2)c1 546921480 QZERWXLMQZEFMB-UHFFFAOYSA-N 385.901 5.213 30 20 GKED N#CCCC[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1 552313017 HQRDJRWJLWFHOT-NRFANRHFSA-N 375.428 5.380 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1 558308565 YNWLKFIBBRBKHO-NRFANRHFSA-N 399.441 5.051 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccoc2C(F)(F)F)n1 564616400 IKKDHNAVZUFUNB-JTQLQIEISA-N 380.219 5.426 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2scc(C)c2C#N)cc1OC 566585711 SZMBLEQNEZPNAH-UHFFFAOYSA-N 378.881 5.021 30 20 GKED CSC[C@@](C)(C#N)NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 566624986 SSBCVNQMXHUJQT-MRXNPFEDSA-N 385.341 5.097 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2cccnc2)cc1 567197649 DSGQPCAUPBDKHF-UHFFFAOYSA-N 386.455 5.190 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1ccccc1CC#N 571240592 MGTPEONVEBNNNI-UHFFFAOYSA-N 375.497 5.096 30 20 GKED CN(C(=O)Nc1cc(C(F)(F)F)ccc1F)[C@H]1CC[C@@H](C(F)(F)F)CC1 572319814 GKRKGAFMKNNCSC-JGZJWPJOSA-N 386.311 5.429 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC(C)(C)[C@@H]2C2CC2)cc1 573007851 MBUZMHWIMGEQTO-NRFANRHFSA-N 391.471 5.011 30 20 GKED Cc1ccc(NC(=O)C[C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1Cl 574588773 AWHGRFBAMMCZIA-DYESRHJHSA-N 383.923 5.390 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(C#N)cc1OC(F)F 577146027 SKKXFIMNHWUYNK-CYBMUJFWSA-N 399.466 5.442 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1C#N 584261436 CUSYBPAZRAUDAL-AWEZNQCLSA-N 393.468 5.054 30 20 GKED CN(C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(C#N)cc1F 588907408 DZCLVNLDYOCWDG-UHFFFAOYSA-N 381.410 5.189 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(F)c(Br)c1 590194999 PYHDNDMNFXNRIC-CYBMUJFWSA-N 375.285 5.240 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(-c3ccc(Br)s3)s2)C1 597905569 GCNHGNVYXQVOMF-LLVKDONJSA-N 395.347 5.005 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3c(F)ccc4ccncc34)c(C#N)c2[C@@H]1C 598845816 IZROZTUAFBASBI-VXGBXAGGSA-N 379.460 5.245 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4cc(F)ccc4s3)cn2)cc1 604241884 UJDKDRBOVNNHHY-UHFFFAOYSA-N 389.411 5.352 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)Nc1ccccc1SC[C@@H](C)C#N 609377329 TUACAHKMGTWXEK-IRXDYDNUSA-N 382.529 5.469 30 20 GKED CCCCn1nccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609727578 MAAKJXIRLGJBAQ-UHFFFAOYSA-N 394.862 5.253 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cccc(Oc2nccs2)c1 609907008 HPQMFUKNKVOCMY-UHFFFAOYSA-N 391.496 5.105 30 20 GKED C[C@]1(C#N)CCCN(C(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)C1 612243346 RRUJBGBJDILTRH-XMMPIXPASA-N 389.474 5.059 30 20 GKED CCN(CC)c1ccc(-c2nnc(SCc3ccc(C#N)cc3C)o2)cc1 614400889 MSPZXNAKXQQXFF-UHFFFAOYSA-N 378.501 5.055 30 20 GKED N#C[C@H](C(=O)c1ccccc1SCc1ccco1)c1nccc2ccccc12 682994899 KQUINFCWWLCQPD-FQEVSTJZSA-N 384.460 5.610 30 20 GKED C#Cc1cccc(N(C(=O)c2cccc(NC(=O)OC(C)(C)C)c2)C(C)C)c1 728247450 DZKOVUDDLFWGOE-UHFFFAOYSA-N 378.472 5.070 30 20 GKED CCN(C(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C)[C@@H](C)c1ccc(C#N)cc1 728269470 NRCOGTAVZWVQCW-SFHVURJKSA-N 396.494 5.061 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420167 AOHDXOFPPQWRBL-IINYFYTJSA-N 390.892 5.446 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](c3ccccc3F)C2)cc1 730665187 STUGXORDMSLZEH-OFNKIYASSA-N 399.469 5.503 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(Nc2ccc(F)cc2)c2ccncc12 731883876 ONYKNEZHWIZDCN-HNNXBMFYSA-N 379.435 5.037 30 20 GKED C=CC[C@@H](NC(=O)c1cc2ccccc2n1Cc1ccccc1F)c1ccncc1 734234248 KFOGYRSRYQVZIS-JOCHJYFZSA-N 399.469 5.271 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(NC(=O)CC(C)C)c(C)c2)C(C)C)c1 741918335 BSNYQRRSLXERDY-UHFFFAOYSA-N 376.500 5.016 30 20 GKED CCc1ccc(C=NOCc2ncc(-c3ccccc3Br)o2)cc1 742350811 KNMWZIWKGJLTCG-UHFFFAOYSA-N 385.261 5.217 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccccc3OC)cc2)c1 742370988 CWWYZBZXBASSPX-QFIPXVFZSA-N 386.495 5.333 30 20 GKED N#Cc1ccccc1COc1cccc(/C=C/C(=O)c2ccc3c(c2)COC3)c1 742437833 XYIKTWVLTBCLJY-DHZHZOJOSA-N 381.431 5.064 30 20 GKED Cc1cccc(F)c1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 742724161 UBCDKTNARSADMJ-UHFFFAOYSA-N 390.483 5.228 30 20 GKED CCOc1cccc(C(=O)/C=C\c2csc(COc3ccc(OC)cc3)n2)c1 743539146 UTNZNMRJZBGGBP-GHXNOFRVSA-N 395.480 5.026 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C/C(=O)c2coc3ccccc23)cc1 747705678 QLEBEUPDNLQSGB-JXMROGBWSA-N 388.375 5.199 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc1OC 750904545 XFDXKTNDFLEYRC-AATRIKPKSA-N 387.284 5.367 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 751336906 MHURLLIJVUUDTE-HNNXBMFYSA-N 377.875 5.177 30 20 GKED C[C@@H](OC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1)C(C)(C)C#N 753607865 IHLYLAKVOSLXMR-LLVKDONJSA-N 379.243 5.276 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2sccc2Br)S1 764889135 WPLIRAMWDDXCIF-JYRVWZFOSA-N 393.331 5.019 30 20 GKED C=C(C)C[C@@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 767700401 RLYGKCNGIWLOMP-MRXNPFEDSA-N 386.517 5.090 30 20 GKED N#CCC[C@@H](NCc1nc2ccc(Br)cc2s1)c1ccccc1 774995298 AJLPOYXUQVCUAT-OAHLLOKOSA-N 386.318 5.193 30 20 GKED CC[C@H](C)n1nc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 775489693 XQLGBIMEFKLMLH-KKSFZXQISA-N 387.487 5.462 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccc(C)cc2)cc1 776161395 VTNNFXMWSTXREP-DFBJGRDBSA-N 386.495 5.346 30 20 GKED C[C@@H](N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 777655663 HPPRIFLSXCDFBZ-OPAMFIHVSA-N 391.515 5.633 30 20 GKED C[C@H](OC(=O)c1ccncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 783827141 HGWIFBYZXMALTC-QMMMGPOBSA-N 381.247 5.176 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2cnc(-c3ccc(Cl)cc3)s2)cc1 789130491 OVCQUSKTFDCKHW-KTKRTIGZSA-N 380.856 5.262 30 20 GKED N#CC[C@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796653054 XLIAPCUJOJTBOM-GDBMZVCRSA-N 379.872 5.214 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3[C@@H](c4ccccc4)[C@H]3C)n2)cc1 797551282 NBWVHVPTKFRXMV-CVDLLHPYSA-N 388.492 5.045 30 20 GKED N#C[C@H](C(=O)C(Cc1ccccc1)Cc1ccccc1)c1nccc2ccccc12 798861891 SUHMSPDPQWRPJK-VWLOTQADSA-N 390.486 5.513 30 20 GKED N#Cc1c(F)cccc1/C=C(/Cl)c1nc(O)c2c3c(sc2n1)CCCC3 811685885 FZHOWVOJPCGWLL-MDWZMJQESA-N 385.851 5.023 30 20 GKED CC(/C=C\C(=O)c1cccc(N2CCOC2=O)c1)=C/c1ccccc1OC(F)F 811689407 CNGOGXKYTLQZBY-WQJRBICESA-N 399.393 5.087 30 20 GKED N#Cc1cc(Oc2ccc(NCc3c(F)c(F)c(F)c(F)c3F)cc2)ccn1 811780509 YOBYTRBOHUPVAG-UHFFFAOYSA-N 391.299 5.053 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1c(Cl)cccc1Cl 813216048 FKFBMQGXYQMJEX-GXSJLCMTSA-N 387.188 5.387 30 20 GKED N#C[C@H](C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1cc(C(F)(F)F)ccn1 813217705 NZAJLCKZHYJLSU-UONOGXRCSA-N 386.295 5.013 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813218824 ZQOBUFUFJUCDPL-OTWHNJEPSA-N 380.369 5.234 30 20 GKED CC(=NNc1nc(-c2cccnc2)no1)c1ccc(SC2CCCC2)cc1 814947656 CMKUBIVWSTYTHI-UHFFFAOYSA-N 379.489 5.002 30 20 GKED C=C[C@H](CC(=O)N[C@@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817861022 BGCSGLITNKUZPS-QWHCGFSZSA-N 382.813 5.291 30 20 GKED CCc1oc2ccccc2c1C=NO[C@H](C)C(=O)Nc1c(C)cc(C)cc1C 818618324 TYSFZMSZVYICMA-QGZVFWFLSA-N 378.472 5.298 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)[C@@H](C)[C@@H](C)CC2 839390999 PGBWEQLNXYAXSK-QWRGUYRKSA-N 390.940 5.068 30 20 GKED N#C[C@@H](C(=O)COc1ccc(Cl)c2ccccc12)c1nc(C2CC2)cs1 842937022 BIDSTDQKFKKMAO-HNNXBMFYSA-N 382.872 5.082 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942170 NOOPFDLYVZXRCJ-ABAIWWIYSA-N 378.419 5.094 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2cnc(Cl)s2)cc1)C(F)(F)F 843301047 RYNKBRKLBRLZEG-UHFFFAOYSA-N 392.727 5.698 30 20 GKED N#C[C@H](C(=O)[C@H]1[C@H]2c3ccccc3C[C@H]21)c1nc2cc(C(F)(F)F)ccc2s1 860478305 VCMZULOFHUTWLP-KJWYOANISA-N 398.409 5.077 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 916911955 WDHFLNCNUXWUBF-SFHVURJKSA-N 392.455 5.078 30 20 GKED C[C@H]1CN(CCCCC2(C#N)CCC2)C[C@@H](C)N1CCCCC1(C#N)CCC1 930263401 ICKPJWBFPNIUFX-SZPZYZBQSA-N 384.612 5.109 30 20 GKED CCCC(=NNc1ccc(C(=O)O)cc1OC)c1ccc(Cl)c(Cl)c1 1776050068 VMWDBMQXJRPRCJ-UHFFFAOYSA-N 381.259 5.317 30 20 GKED CC(C)(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776265709 VLDPMCJFTGNFQU-WYMLVPIESA-N 390.435 5.718 30 20 GKED CC(C)COc1ccccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776333767 UKJCCWSLGNUQCL-QXMHVHEDSA-N 390.435 5.576 30 20 GKED COc1ccccc1Oc1ccc(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1 1777388486 MXSIEZDASBIVCW-FLIBITNWSA-N 380.421 5.143 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccc(C(=O)O)c3Cl)s2)cc1 1777430566 DYVYWHGNXLZNCI-KHPPLWFESA-N 397.883 5.675 30 20 GKED N#CCCn1cc(C(=O)CSC2=Nc3ccccc3CS2)c2ccccc21 5325640 FUMMNEZNZJXQKC-UHFFFAOYSA-N 391.521 5.405 30 20 GKED C=CCc1cc(C(=O)Nc2c(CC)ccc(Cl)c2CC)cc(OC)c1OC 18185029 LWVQQHCCKOADCP-UHFFFAOYSA-N 387.907 5.463 30 20 GKED C=CCn1c(SCc2csc(C(C)C)n2)nnc1-c1ccc(OC)cc1 31651182 DGTSRTYXRAUNSY-UHFFFAOYSA-N 386.546 5.012 30 20 GKED CC(=O)Nc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccc1C 56470288 GGYTZJFQQDAJRV-UHFFFAOYSA-N 399.450 5.178 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(OC(F)F)cc2)nnc1-c1ccoc1C 63415631 QNKWNCZKZDKRSC-CYBMUJFWSA-N 391.443 5.487 30 20 GKED COc1ccc(CSc2nnc(S[C@H](C#N)C3CCCCC3)s2)cc1 115185924 PGJXLRRWLKAHKA-MRXNPFEDSA-N 391.587 5.404 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CCc2ccc(F)cc2)cc1 116525052 WHEDKZUJPZTSMT-UHFFFAOYSA-N 390.414 5.070 30 20 GKED COc1cc(C#N)ccc1O[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 122537252 MHFITPHVBDHWKG-SNVBAGLBSA-N 390.226 5.064 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1 123095335 LFJFQHXVFWKAIP-UHFFFAOYSA-N 396.834 5.068 30 20 GKED CSc1ccc(O[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 131855120 USZXFSXCEZSWRZ-HUUCEWRRSA-N 386.542 5.209 30 20 GKED C#CCCOc1ccc(CNc2cccc(C[S@@](=O)C3CCCCC3)c2)cc1 133317447 MSEJIOCNRJMMNB-NDEPHWFRSA-N 395.568 5.282 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H](C)c2ccc(Br)cc2)n1 153549825 HGNRCYPXFNWSHE-DOMZBBRYSA-N 391.334 5.399 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 159516945 ZVSNJJPIYHPYPG-LBPRGKRZSA-N 376.913 5.325 30 20 GKED CC(C)(C)c1noc(-c2ccccc2C(=O)Nc2ccc(C(C)(C)C#N)cc2)n1 170791345 MZAMMKJMNUNQFW-UHFFFAOYSA-N 388.471 5.088 30 20 GKED CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 175359608 JPVGIJGXUXXFNV-ARFHVFGLSA-N 377.579 5.124 30 20 GKED N#C[C@H](C(=O)CCc1ccoc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 175946215 XLNSMYFTEDTTCJ-CQSZACIVSA-N 391.279 5.519 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2C(=O)c2cccs2)n1 177744073 QNHYGHCCZBOIPK-OAHLLOKOSA-N 380.494 5.049 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)sc2c1CCCC2 253614369 ONIURCYEEAXGTE-CABCVRRESA-N 390.430 5.260 30 20 GKED Clc1cccc(-c2nnc(CON=Cc3cccc(Cl)c3Cl)o2)c1 255072105 LFHXBHJWIPBABQ-UHFFFAOYSA-N 382.634 5.248 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)CC1 328731144 GJRQCKOWCYXPGA-JVDDPLHJSA-N 384.442 5.133 30 20 GKED O/C(=N/CCc1nc(C2CCCCC2)cs1)[C@@H]1C[C@]12CCOc1ccccc12 329721699 NDEWZLHWUWVXQT-MBSDFSHPSA-N 396.556 5.430 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC(c2nc(C)no2)CC1 365122904 FGOMIDHNBGIMAJ-UHFFFAOYSA-N 382.508 5.078 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)C3CCC(OC(F)F)CC3)c2C#N)[C@@H](C)C1 410991500 VHGULLMIYXIQJL-ZSVAQUKISA-N 382.476 5.042 30 20 GKED C=CC[C@@H](Cc1ccccc1)NC(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 416848833 XAEARYHJGYCGQI-MMTVBGGISA-N 398.572 5.043 30 20 GKED CCO[C@H](C)c1nc(CN(Cc2cccc(C(F)(F)F)c2)[C@H](C)C#N)cs1 425541843 XKADDFUQJXOHNC-ZIAGYGMSSA-N 397.466 5.174 30 20 GKED Cc1ccc(C(=O)N[C@@H](C#N)c2ccc(OCc3ccccc3)cc2)c(Cl)c1 427387098 NTWSRNMSSCMEOG-QFIPXVFZSA-N 390.870 5.222 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 429048849 SXZQWEUJVWJCRI-UHFFFAOYSA-N 395.356 5.404 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430597043 YFNPFYFICFITTJ-LLVKDONJSA-N 387.555 5.424 30 20 GKED N#CCCC[C@@H](NCC(=O)N(c1ccccc1)C1CCCCC1)c1ccccc1 433012756 LTURQDZFFRYRNU-XMMPIXPASA-N 389.543 5.377 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)N[C@H](c1cc(F)ccc1F)C(F)F 433081566 GKWXCRIDIMTNIS-CQSZACIVSA-N 394.290 5.198 30 20 GKED C[C@H]1CC[C@H](CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)O1 439212278 FWVIIRCDAZGNOK-HNAYVOBHSA-N 398.890 5.077 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1Cl 440631969 BEAQVIAPRCWAAE-HNNXBMFYSA-N 387.936 5.199 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c(F)cccc1F 445924646 NQFHRFVRZATKNZ-UHFFFAOYSA-N 378.378 5.118 30 20 GKED C=C(C)Cn1c([C@@H]2CCCO2)nnc1N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 460565704 PCSPJWVNKYGILK-DYVFJYSZSA-N 395.334 5.210 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2cccc(Cl)c2Cl)CC1 462415852 HXDXSIRSYKJCRF-UHFFFAOYSA-N 384.347 5.462 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)[C@@H](C)c2cccc(C#N)c2)cc1 463817043 VOLORQGXDHDLIU-UQBPGWFLSA-N 397.522 5.257 30 20 GKED N#C[C@@H](NC(=O)c1nc2ccccc2cc1Cl)c1cccc(Cl)c1Cl 464396517 IMAQNSKSUMLSJQ-OAHLLOKOSA-N 390.657 5.190 30 20 GKED Cc1nc(CN2CCC[C@H]2[C@H](C#N)c2ccccc2)oc1-c1ccc(Cl)cc1 468281208 WPHXUFWISGDMBB-RTWAWAEBSA-N 391.902 5.575 30 20 GKED COc1cccc([C@H](C)CCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 468974960 LJEDNKYNGYASHM-LJQANCHMSA-N 388.511 5.157 30 20 GKED CCN(C(=O)c1coc2c(C)cc(Br)cc12)c1ccc(C#N)cc1 472348213 ZKHLKAGKGQHOHY-UHFFFAOYSA-N 383.245 5.042 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)c2c1 473586962 DXTPUCFKNUUZLT-WIOPSUGQSA-N 395.506 5.333 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2cccc(OC)c2)CC1 475544339 AZXWJYIAHALTIK-UHFFFAOYSA-N 392.543 5.959 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCSCc1ccccc1C#N 475556903 UTMRHUJHIIJUCF-UHFFFAOYSA-N 393.556 5.465 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cc(OC)ccc1OC 475557075 WJDNRDHADHBDJP-MRXNPFEDSA-N 382.504 5.438 30 20 GKED CCS[C@H]1CC[C@H](N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)C1 475652309 FWEHRSNHILKDFZ-UGKGYDQZSA-N 394.540 5.291 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1scc(C)c1Cl 478686474 JOKQLHQHDFCWCX-UHFFFAOYSA-N 383.860 5.330 30 20 GKED C[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1 480208992 XZXCOXOAQNMTSR-WDNCENIBSA-N 396.490 5.118 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 488062570 GWSFCMTVSSRUCN-HNNXBMFYSA-N 391.393 5.465 30 20 GKED CCN(C(=O)c1cccc(CC#N)c1)[C@H](c1ccc(Cl)cc1)c1ccccn1 497900093 QSOVIMMQDFFXSE-JOCHJYFZSA-N 389.886 5.053 30 20 GKED C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)c1ccc(F)cc1C(F)(F)F 504891655 KVWGEVDKQVSFOR-SNVBAGLBSA-N 393.302 5.224 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510666246 MGRXOEZYYRXIQX-QHCPKHFHSA-N 397.478 6.028 30 20 GKED C=CCN(C(=O)c1cc(Cl)ccc1OC(C)C)c1nc2c(s1)CCCC2 512595945 YUQSIUMOKSYUGG-UHFFFAOYSA-N 390.936 5.295 30 20 GKED CC(C)N(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(F)cc1 520327982 DHHNNACLIDDZLE-UHFFFAOYSA-N 388.442 5.739 30 20 GKED Cc1cc(Br)ccc1NC(=O)CS[C@H](C)c1ccc(C#N)cc1 522840533 PQCZPOILDUOVQW-CYBMUJFWSA-N 389.318 5.062 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnn(-c3ccccc3)c2C(C)C)n1 530614125 IJZXQBRCFZSURJ-INIZCTEOSA-N 378.501 5.066 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 531444298 KOHHAKVKNLGJBG-YUXAGFNASA-N 391.515 5.016 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cccc(-c3ccoc3)c2)cc1 535534629 ZPIGPELHOWQODE-UHFFFAOYSA-N 386.451 5.013 30 20 GKED N#CC1(c2ccc(C(=O)N[C@H]3CCOc4c(-c5ccccc5)cccc43)cc2)CC1 537435843 XSHGCESRHZKUJS-QHCPKHFHSA-N 394.474 5.162 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccn(-c3cccc(Cl)c3)n2)c(C#N)s1 538071606 DGDKSSJLMVKPSY-UHFFFAOYSA-N 384.892 5.009 30 20 GKED COc1cccc(C=C2CCN(Cc3cccc(OCCCC#N)c3)CC2)c1 539903430 NEVIHXGIOPAFBQ-UHFFFAOYSA-N 376.500 5.057 30 20 GKED COc1cccc([C@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2Cl)c1 540595872 GWVWAZATJFSHLR-MWTRTKDXSA-N 376.887 5.660 30 20 GKED C[C@H](NC(=O)Nc1ccc2[nH]ccc2c1)c1ccc(-c2cccc(C#N)c2)cc1 541092891 PLAGMICHAONDSJ-INIZCTEOSA-N 380.451 5.589 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(Cc3cccnc3)no2)c1 551398723 BQSYUHMODGGREQ-UHFFFAOYSA-N 388.814 5.040 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cnn(Cc2ccccc2)c1 553104024 HYKQETSKVRSQHH-FQEVSTJZSA-N 392.506 5.321 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@H]1CCCc2cc(C#N)ccc21 564113541 VJNUYNKZLNHEGK-SZNDQCEHSA-N 391.515 5.858 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccccc1Cl 566578274 JJTPLEMCYSUCSS-AWEZNQCLSA-N 390.961 5.606 30 20 GKED CC(C)[C@H](Oc1ccccc1C#N)C(=O)Nc1cc(C(F)F)ccc1Cl 571087191 VPCUJMJCVZJXSR-KRWDZBQOSA-N 378.806 5.191 30 20 GKED N#Cc1c(F)cccc1SCc1nc(O)c2c(-c3ccccc3)csc2n1 574830888 XKMRSOFZNCOIQP-UHFFFAOYSA-N 393.468 5.367 30 20 GKED N#C[C@H](NC(=O)c1ccc(C(F)(F)F)s1)c1ccc(Cl)c(Cl)c1 586778535 SZGPIGDOUQWBHA-JTQLQIEISA-N 379.190 5.068 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCSc1ccncc1C#N 594911435 RSQOGYQQAOLLKJ-UHFFFAOYSA-N 387.936 5.242 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CC1CCC(F)(F)CC1 599059424 XGGQSOBELXTDDV-UHFFFAOYSA-N 385.414 5.208 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)c1ccc(COc2ccccc2C#N)o1 603955423 SZBTZMQLDUUVMW-UHFFFAOYSA-N 388.467 5.029 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 604913335 HKLOUWWSFVJFKT-KRWDZBQOSA-N 388.433 5.067 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(N2CCCCCC2)c1 607218634 WJYMMEWLVBOIDW-UHFFFAOYSA-N 381.495 5.426 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC[C@H]1c1cccc(F)c1 608213016 CIIWWXXBFRBUSI-HNNXBMFYSA-N 391.286 5.451 30 20 GKED COc1c(Cl)cccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 609643117 QMZZCAUVMPNBBS-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCSc4ccccc43)cc2)cc1 610225991 NKEORWFIWOVBPX-OAQYLSRUSA-N 386.476 5.569 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc([C@H]3CCCS3)no2)cc1Cl 612949652 ZCHHAWNUWMXIDI-QGZVFWFLSA-N 383.860 5.622 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 615971624 PBOHQNYQRSGERH-IRXDYDNUSA-N 377.381 5.163 30 20 GKED O=C(C/C=C\c1ccc(F)cc1)NC(CCC(F)(F)F)CCC(F)(F)F 619125843 WZNSUGMSHVOYNX-UPHRSURJSA-N 385.323 5.399 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)c(Cl)c1F 619127334 YMXDHVLAVPSOTB-UHFFFAOYSA-N 397.693 5.402 30 20 GKED N#Cc1ccc(CNC(=O)N(Cc2cccc(F)c2)C2CCCC2)cc1Cl 619826527 AUGAQGVVBBCKDJ-UHFFFAOYSA-N 385.870 5.005 30 20 GKED CC(C)n1ccc(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 648494265 GNBUJBNHUDTTJJ-UHFFFAOYSA-N 397.294 5.006 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 678642340 MYJVHKGSKPMXGC-MRXNPFEDSA-N 382.460 5.241 30 20 GKED CCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](C)c1ccccc1OC 726484215 HPXBFNOUWBFYOJ-CQSZACIVSA-N 387.936 5.390 30 20 GKED CC(=O)Nc1ccc(/C=C\C(=O)c2sc(-c3ccc(C)cc3)nc2C)cc1 727655502 XJYMOFAFDHTTEX-JYRVWZFOSA-N 376.481 5.281 30 20 GKED C[C@H](C#N)Oc1ccc(C=NNc2ncnc3sc(-c4ccccc4)cc23)cc1 727683315 FZRVDXNQWLGNMM-OAHLLOKOSA-N 399.479 5.095 30 20 GKED C#CCOc1ccc(NC(=O)N(CC)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 731113523 BMCRXPJOSLFRBK-HNNXBMFYSA-N 390.405 5.332 30 20 GKED CNc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc(Cl)n1 732277547 KKMBFYQAVCJRMQ-UHFFFAOYSA-N 392.846 5.001 30 20 GKED COCCCOc1cccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)c1 734980231 IQVXXXUCQWIKGD-WDZFZDKYSA-N 378.440 5.313 30 20 GKED C#CCN(Cc1ccc(F)cc1)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 735517737 GIQKFMLSDIECDK-CYBMUJFWSA-N 379.262 5.039 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccccc3F)CC2)cc1 736955560 MSLXNEVUQHIGLW-HXUWFJFHSA-N 385.442 5.292 30 20 GKED O=C(/C=C/c1ccc(OCC(F)(F)F)cc1)c1cccc(-c2ccncc2)c1 741472790 KFEHIPOOKBFYHY-RMKNXTFCSA-N 383.369 5.586 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)CCc3ccccc3F)n2)cc1 744035378 QZAURUJDOBQSMO-QFBILLFUSA-N 392.499 5.703 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2csc(-c3ccc(Cl)cc3)n2)cc1 745406955 XQGYBCMRWVRYKP-UHFFFAOYSA-N 381.888 5.332 30 20 GKED CCC[C@H](NC(=O)c1ccccc1OCC#N)c1ccc(Cl)c(Cl)c1 746383906 VAQONCIIGMHUBD-KRWDZBQOSA-N 377.271 5.167 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C2)cc1 746763294 ASBWERHTHOTYSN-ISKFKSNPSA-N 381.479 5.363 30 20 GKED C=CCc1cc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)cc(OC)c1O 747063427 KALOYPIAOLKEAG-MDWZMJQESA-N 377.484 5.016 30 20 GKED N#C[C@H](COC(=O)c1cc(-c2ccccn2)ccc1Cl)Cc1ccc(F)cc1 755055063 VJKCEXDEGXNLTI-MRXNPFEDSA-N 394.833 5.080 30 20 GKED CCOc1ccccc1C=NOCc1coc(-c2ccc(C(F)(F)F)cc2)n1 755800419 ARLZTLYQLDJJDH-UHFFFAOYSA-N 390.361 5.310 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cs1)c1nc(-c2ccc(Cl)cc2)cs1 759435631 HTCLGPQRTCTNBJ-GFCCVEGCSA-N 379.293 5.668 30 20 GKED C#CC[C@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccccn1 762057512 FYZZLPJLPSOZSC-HNNXBMFYSA-N 384.407 5.064 30 20 GKED CC(C)n1ncc2cc(/C=C3/C(=O)c4cccc5c4[C@@H]3CCC5)c(Cl)nc21 763287645 CLQAVBDYKGLTKV-VHWUNXFSSA-N 377.875 5.365 30 20 GKED N#C[C@@H](C(=O)CCCCC(=O)c1ccc(F)cc1)c1nc2ccccc2s1 778598176 IXHINIATTQTRPG-INIZCTEOSA-N 380.444 5.055 30 20 GKED CC1(C)C[C@H](NN=Cc2ccccc2Oc2ccc(F)cc2Cl)CCO1 780250968 RUMGSCLHCNCNIL-MRXNPFEDSA-N 376.859 5.153 30 20 GKED C=C(Cl)CSCCCC(=O)Nc1c(C)cc(Br)cc1C 781598972 CULPCDJVXKVWGI-UHFFFAOYSA-N 376.747 5.270 30 20 GKED CCC1=C(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 790314237 KKASKUHGVRMBFL-IBGZPJMESA-N 380.875 5.408 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 791751857 QLJHJNXQYXJXEY-VWLOTQADSA-N 395.506 5.952 30 20 GKED N#CC[C@@H](CC(=O)O[C@H](C(=O)c1ccccc1)c1ccccc1)c1ccccc1 795988233 FXWYIJHRMADPGU-DHLKQENFSA-N 383.447 5.241 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1 799087212 PRGNAJMIWXWGOI-HDJSIYSDSA-N 391.323 5.285 30 20 GKED O=[N+]([O-])c1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1F 801539315 WOWKQBSJVQRVGF-CQSZACIVSA-N 396.262 5.146 30 20 GKED Clc1cc(CON=Cc2ccccc2Br)c2ncccc2c1 914786265 BABXDUTTXRRNSS-UHFFFAOYSA-N 375.653 5.201 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccccc3)s2)cc1 915597845 INUVZAYGSYTLTE-NRFANRHFSA-N 395.487 5.718 30 20 GKED Cc1cccc(Br)c1NN=Cc1csc2ccc(C(=O)O)cc12 1776090882 GWDAQHZIXQEXHL-UHFFFAOYSA-N 389.274 5.116 30 20 GKED C=CCC1(C(=O)O)CCN([C@@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 1776157975 FILJAHYIXTZHPI-HNNXBMFYSA-N 388.895 5.107 30 20 GKED CCCCCCCSc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1 1776787558 WRRDCZHWNBMCIY-NRFANRHFSA-N 399.556 5.175 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)s1 1777316249 KNSZGYPYNHVEMD-JXMROGBWSA-N 398.867 5.671 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/C(=O)c4cccc5c4[C@@H]3CCC5)s2)c1 1777684381 ZFAQNWNTJRLLJE-JZQBQCRLSA-N 386.472 5.813 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(C(F)(F)F)cc1 16301940 XBAPHGXQWYQJEZ-UHFFFAOYSA-N 380.369 5.174 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N[C@@H](C)c1ccc(C#N)cc1 26131946 RBIMBNXKGSRVNY-INIZCTEOSA-N 391.540 5.394 30 20 GKED C=CCn1c(S[C@@H](CC)c2ccccc2)nnc1[C@H]1COc2ccccc2O1 64367870 KFIVVGCZDVWDAR-UXHICEINSA-N 393.512 5.220 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)cc1 66954235 JTKNVGMUKRRMBE-YJBOKZPZSA-N 383.517 5.362 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H](C)c1ccccn1 68547067 RSKHNNYAYYGAAC-KRWDZBQOSA-N 386.455 5.279 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccccc1OC(F)(F)F 108199564 ITZUGIHICOBRCD-UHFFFAOYSA-N 394.418 5.162 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc(-c2ccncc2)cs1 114620562 NGHYOSRTTUMRDR-AWEZNQCLSA-N 379.828 5.095 30 20 GKED Cc1ccc(C[C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccn2)cc1 115851410 OKKUFHJUAIEHHF-HSZRJFAPSA-N 398.510 5.297 30 20 GKED Cc1ccccc1COc1cccc(NCc2nnc(-c3ccc(C#N)cc3)o2)c1 133869876 ZLSJLPCLRDOJDY-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=C(C)COc1cc(CN[C@@H](c2cccc(C)c2)c2ccccn2)ccc1OC 153512629 SUVKAXWABCQLPK-VWLOTQADSA-N 388.511 5.233 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)sc1-c1ccc(F)cc1 171146619 MDNQDYIKRJZDCX-HNNXBMFYSA-N 376.412 5.494 30 20 GKED CCCOc1ccc(Oc2ncccc2CN[C@H](C)c2ccc(C#N)cc2)cc1 173952983 GOBDNQDSEOXOQW-GOSISDBHSA-N 387.483 5.385 30 20 GKED N#C[C@@H](C(=O)CCc1ccoc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 175946198 XLNSMYFTEDTTCJ-AWEZNQCLSA-N 391.279 5.519 30 20 GKED CSc1cc(C(=O)Nc2sc3c(c2C#N)CCC3)c(Cl)cc1Cl 177692174 VTFQUJJCGFFCMQ-UHFFFAOYSA-N 383.325 5.389 30 20 GKED C[C@H](N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 181687704 VXPZUANWJNTTTP-GAJHUEQPSA-N 384.458 5.139 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)cc(F)c1Br 190637239 QAKFOPNAIPCRMK-UHFFFAOYSA-N 387.249 5.009 30 20 GKED CC(C)c1ccccc1N(C(=O)CSCC#N)c1nc2ccccc2s1 192498561 OZENKTWSEKALNO-UHFFFAOYSA-N 381.526 5.341 30 20 GKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 194182287 HJXPJTUJQXRKFW-QGZVFWFLSA-N 379.510 5.196 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(c2nc3ccccc3[nH]2)CC1 301352749 NLHZEVKAQGYDRX-UHFFFAOYSA-N 387.874 5.020 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)cc1 303604335 VNBLIUFSTUJWIM-VWLOTQADSA-N 386.495 5.100 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 303637783 HBDCIDIMEWAEQF-UHFFFAOYSA-N 395.890 5.406 30 20 GKED Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1N=C(O)[C@@H](C)c1ncccc1F 329902120 PEGHXXWKTFYRPU-INMHGKMJSA-N 397.494 5.039 30 20 GKED Cc1c(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)sc2ccc(C#N)cc12 429863666 XOQIYVNQCCNSBK-MRXNPFEDSA-N 388.414 5.505 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cccc(SCC#N)c1 429926982 AZMOQVHJWJWPRY-CYBMUJFWSA-N 378.419 5.154 30 20 GKED N#CCCC[C@@H](NS(=O)(=O)c1c(Cl)ccc2ccccc12)c1ccccc1 431627916 KZFGEPKHKLQIFH-HXUWFJFHSA-N 398.915 5.207 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 432800074 KBTUKVVKGAIMOD-UHFFFAOYSA-N 390.418 5.100 30 20 GKED N#CCCC[C@H](NCc1nc2ccc(Br)cc2o1)c1ccccc1 433025394 KFQOJWSKLAIOPE-INIZCTEOSA-N 384.277 5.115 30 20 GKED CC(C)[C@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccnc1 436113248 UREYEHGHNHHCSA-UUOWRZLLSA-N 383.495 5.237 30 20 GKED CC[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(Cl)s1 437095955 YBSQFWWRLRABEI-UYSNPLJNSA-N 375.925 5.099 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)[C@@H]1CC[C@H](SCC)C1 437104250 OATPLAQSWNTAJZ-CABCVRRESA-N 387.467 5.016 30 20 GKED N#CCCCOc1cccc(N[C@@H](c2ccc(Br)s2)C2CC2)c1 439133082 KYGPECLIXGHBBW-GOSISDBHSA-N 391.334 5.756 30 20 GKED Cc1[nH]c2ccccc2c1C1=CCN(C(=O)N[C@@H](CCC#N)c2ccccc2)CC1 440244117 RFYFJKAAKCHOIE-QFIPXVFZSA-N 398.510 5.320 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1 442195058 FCBZUFHAXRBXSW-JOCHJYFZSA-N 384.479 5.600 30 20 GKED C=CCOCCCC(=O)N(c1ccc(C(C)C)cc1)c1nc2ccccc2s1 443817846 QOZXIXTYIQLQRO-UHFFFAOYSA-N 394.540 6.067 30 20 GKED C=CCC[C@@H](N[C@H](C)c1cc(C(=O)OC)co1)c1ccc(C(F)(F)F)cc1 447588348 UVVVKMKTSAHBAE-CXAGYDPISA-N 381.394 5.443 30 20 GKED C=CCCCN(C)C(=O)N[C@@H](c1cc(F)ccc1F)c1ccccc1Cl 466228519 VVHSZJXBRLTEPG-LJQANCHMSA-N 378.850 5.315 30 20 GKED CN(C(=O)CSc1cccc(C#N)c1)[C@H](c1ccccc1)c1ccc(F)cc1 468637345 IHNKLROTGAIUPU-HSZRJFAPSA-N 390.483 5.037 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1)Cc1cccc(F)c1 469003384 QQBBVNXNZZVQTM-SGTLLEGYSA-N 379.262 5.082 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C[C@H](CC#N)c1ccccc1 474902467 VCJZKGCUTKEQNO-NRFANRHFSA-N 397.478 5.273 30 20 GKED Cc1nc(NC(=O)C[C@H](CC#N)c2ccccc2)sc1Cc1cccc(F)c1 474953959 OLRDOGMZZWWLGZ-SFHVURJKSA-N 393.487 5.208 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)cc(C)c1Br 476081414 SOVPWWURTNOYQF-UHFFFAOYSA-N 386.333 6.170 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccnc(OCc2ccccc2)c1 476788896 CCYLXMQBTGKKBM-UHFFFAOYSA-N 386.495 5.765 30 20 GKED N#Cc1ccc(SCC(=O)Nc2nc(-c3cc4ccccc4o3)cs2)cc1 481900046 KQTWQWINUHPXPK-UHFFFAOYSA-N 391.477 5.159 30 20 GKED C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(C#N)c(Cl)c1 482381200 NIZMNZWAYXZBPR-AWEZNQCLSA-N 391.858 5.008 30 20 GKED C[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1c(F)cccc1F 482440239 WVGUCJCAIVNHCY-AWEZNQCLSA-N 378.378 5.120 30 20 GKED CC[C@H](C)n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 482561491 RYTXRDDVGFXGKV-BLLLJJGKSA-N 398.919 5.430 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1oc2ccc(Br)cc2c1C 484460410 XPFVETHDPJEBHK-UHFFFAOYSA-N 377.282 5.048 30 20 GKED C=CCSc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 487002724 WDMHYMAEKZHZDJ-AWEZNQCLSA-N 383.423 5.200 30 20 GKED N#CCCC[C@@H](NC(=O)CSc1cc(Cl)ccc1Cl)c1ccccc1 487485349 MFGFMSZELYTRHQ-QGZVFWFLSA-N 393.339 5.637 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)NC(C)(C)CC)c(Cl)c1)c1ccccc1 488661813 VZZJUKJNBVQCGW-GOSISDBHSA-N 398.934 5.557 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1Br 495284908 DINHONAGDMCSLA-SECBINFHSA-N 391.315 5.173 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(F)ccc(C)c2F)cc1 499633592 HIZJKCPLHBCRFN-UHFFFAOYSA-N 394.377 5.198 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccccc2OCc2cccs2)cc1 499817200 KZUMYCYKCWKDDM-UHFFFAOYSA-N 376.481 5.381 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCSc2c(F)cccc21 503974840 TVRBQJLMRCOPEH-OAHLLOKOSA-N 396.940 5.475 30 20 GKED CC(C)(C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1Cl 504389658 YUQCWCPNUNMOSR-UHFFFAOYSA-N 395.915 5.175 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccccc2)CCCC1 506839375 NRWFMPDEZAEMJV-KRWDZBQOSA-N 379.529 5.529 30 20 GKED CCCN(C(=O)c1cccc(C#N)c1C)[C@H](c1ccc(F)cc1)c1cccnc1 509429189 HLGCDXCPWZBQJM-HSZRJFAPSA-N 387.458 5.043 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 510667543 PORZUZZZNFEWDI-SFHVURJKSA-N 385.467 5.884 30 20 GKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccc(NC(=O)c2ccccc2)c1 512616354 AKLFFZNYCWKWQX-IRXDYDNUSA-N 387.458 5.361 30 20 GKED Cc1cc(C)cc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1 513961033 UABZAUBEZGNTPF-UHFFFAOYSA-N 387.458 5.549 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Nc1cccc(C#N)c1 517865960 YSLKICAWZAXCSL-ZDUSSCGKSA-N 380.448 5.012 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1SCCC#N 518121143 STUQXQDZNHHIGE-LBPRGKRZSA-N 395.311 5.405 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21 520056242 LGYISSCJUZHPOX-MRXNPFEDSA-N 378.950 5.336 30 20 GKED N#C[C@H](C(=O)c1ncsc1-c1ccccc1)c1nc2ccccc2n1C(F)F 527100760 JZVOTAXUCYQXJB-CYBMUJFWSA-N 394.406 5.045 30 20 GKED Cc1ccc([C@@H](C)N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 532931182 VGCYBKIMQBELLI-RBUKOAKNSA-N 395.572 5.329 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)nn1[C@@H](C)C1CC1 538530979 FXRGUDMFZIGCOL-INIZCTEOSA-N 386.455 5.079 30 20 GKED CC[C@H]1C[C@@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 541007218 IOUJVILJYPZOAQ-AVRDEDQJSA-N 396.918 5.340 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccs2)o1)c1nc2ccccc2n1C(F)F 542130708 KYVKFFUWHHRWDS-LLVKDONJSA-N 383.379 5.243 30 20 GKED C[C@H]1COc2ccccc2CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 542952921 JKHNRDCKSILJGS-KRWDZBQOSA-N 399.450 5.166 30 20 GKED COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)c2ccc(CC#N)cc2)c1 544253203 FEYBNKNKKVNKOF-JWQCQUIFSA-N 396.490 5.132 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1)c1ccccc1 554024658 GNDMSWAVULXWBD-FGZHOGPDSA-N 397.469 5.303 30 20 GKED Cc1csc(NC(=O)c2sc(C(C)(C)c3ccccc3)nc2C)c1C#N 564186677 AEABKNKEFKRBFV-UHFFFAOYSA-N 381.526 5.271 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCc2cccc(O)c21 565753103 MANXUFRSCKXQFF-FQEVSTJZSA-N 384.435 5.033 30 20 GKED Cc1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)c(Br)c1 566939946 JJZLSPSVDQCUGO-OAHLLOKOSA-N 382.261 5.048 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)CC2 573048840 WZNIOJCIPKOZKG-MSOLQXFVSA-N 398.350 5.848 30 20 GKED COc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C(F)(F)F)c1 573343222 JBYNZYIHBIBKDQ-UHFFFAOYSA-N 391.393 5.028 30 20 GKED CCCCn1c(S[C@H](C#N)c2ccc(Cl)cc2)nnc1[C@H](CC)N(C)C 594884556 ZYDYRQXRTSGFBU-DLBZAZTESA-N 391.972 5.101 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1 603754864 FIRFYEAUYWSFLS-ZBFHGGJFSA-N 376.378 5.053 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)cn2)c1 603756024 CSMORURXHYBESH-GJZGRUSLSA-N 389.377 5.053 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(Oc3ccccc3)cc2)c1 609067675 NNTPBTPXZWJBIZ-UHFFFAOYSA-N 380.350 5.204 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208892 OYMIQUJPUCQBMY-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 609377092 OJOQKSQSYNOSJR-GDBMZVCRSA-N 392.446 5.613 30 20 GKED Cc1cccc(CCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 609378637 ZSBHCXOMQVUDGU-UHFFFAOYSA-N 392.446 5.591 30 20 GKED CCC[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 609439023 SNRYWOJJEDMEPX-IEBWSBKVSA-N 381.545 5.614 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609499740 YUFADPLRRSFMSM-QFIPXVFZSA-N 385.467 5.359 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CNc1cccc(C(F)(F)F)c1 609582827 CITKOECLRUCPHO-CYBMUJFWSA-N 393.434 5.008 30 20 GKED Cc1ccc(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cc1Oc1ccncc1 609641870 GRBTYQRQBLCCMI-UHFFFAOYSA-N 385.467 5.357 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccccc1C(F)(F)F 610173203 UVZOAUOPAGDZFA-ZDUSSCGKSA-N 376.378 5.108 30 20 GKED CC(C)(C)[C@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361872 JHFPTFJIKWVOCA-APWZRJJASA-N 381.442 5.128 30 20 GKED C=C(C)CN(CC)C(=O)[C@@H](C)Sc1nnc(-c2ccccc2)c2ccccc12 617466017 LQPXQBSMQCWCEU-QGZVFWFLSA-N 391.540 5.202 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@H]1c1ccncc1 666866004 FRUWRHLTPGRVNN-JOCHJYFZSA-N 375.516 5.693 30 20 GKED C#CC[C@@H](OC(=O)CSc1cccc2cccc(Cl)c12)c1ccccn1 727776208 VUWGVOBIINXHHV-GOSISDBHSA-N 381.884 5.288 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 728067909 FFYBZHSTYPEGEI-LIRRHRJNSA-N 387.405 5.185 30 20 GKED Cc1cc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)ccc1O 728230304 CXLNMRGSVQVLSD-UITAMQMPSA-N 385.872 5.286 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)c1 728481382 BEMLTEOMINGBNW-UHFFFAOYSA-N 397.261 5.439 30 20 GKED Cc1ccc(Nc2nn(CN(CCC#N)CCC(C)C)c(=S)s2)cc1C 728901573 MRZJKCCOYPORPX-UHFFFAOYSA-N 389.594 5.254 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416448 DDRATZUVGXPPTQ-CJNGLKHVSA-N 382.460 5.204 30 20 GKED C=CC[C@H](NC(=O)N1CCC(c2cccc3ccccc23)CC1)c1ccncc1 734681779 ZDDUOZUJKHKIJP-DEOSSOPVSA-N 385.511 5.441 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c[nH]c4ccc(F)cc34)n2)cc1 734706642 POIPBIXKKLEQIV-GOSISDBHSA-N 389.455 5.158 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(SCc2cc(Cl)ccc2OCC#N)o1 735233103 JNLBKJZURSPVRU-KRWDZBQOSA-N 399.903 5.460 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCSC[C@@H]1c1ccc(Cl)cc1 735311628 SZGLOLHVUJMEJV-GOSISDBHSA-N 393.339 5.186 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 739181517 SJACYQNDZBDGFW-CYBMUJFWSA-N 395.390 5.028 30 20 GKED O=C(/C=C/c1cnc2ccc(Br)cn12)c1cccc(Cl)c1Cl 740765693 NQCRBWBBBJDMHS-AATRIKPKSA-N 396.071 5.300 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1cccc(-c2ccncc2)c1 741468131 CKFAGTCGLLFZQE-HJWRWDBZSA-N 386.451 5.907 30 20 GKED O=C(/C=C/c1ccc(OC(F)F)c(Cl)c1)c1c(Cl)nc2sccn12 741843343 FHCPQRYDSBMLDE-HNQUOIGGSA-N 389.210 5.200 30 20 GKED CCOc1cccc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 742990953 SQVDBMQKADDHTR-UHFFFAOYSA-N 389.480 5.558 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)c2oc3ccc(Cl)cc3c2C)cc1C#N 752199027 SRKFXALTZSUKPU-UHFFFAOYSA-N 397.818 5.087 30 20 GKED C[C@@H](OC(=O)CCC(=O)c1cc(Cl)sc1Cl)c1cccc(C#N)c1 756272518 LDFXSAAVLDUEJD-SNVBAGLBSA-N 382.268 5.194 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(-c3ccccc3)ccc2OC)c1 756898136 AZSCAUMIRLFEPP-QHCPKHFHSA-N 386.495 5.333 30 20 GKED N#CCCCn1cc(C(=O)N2CCC(c3cccc(F)c3)CC2)c2ccccc21 767951533 UQJPJPAFDSLHJB-UHFFFAOYSA-N 389.474 5.104 30 20 GKED Cc1ccccc1Cn1c(NC(=S)Nc2ccccc2C#N)nc2ccccc21 770588885 KAABSQMFUYRBAC-UHFFFAOYSA-N 397.507 5.074 30 20 GKED Oc1nncc(NN=C2CCCCC[C@H]2c2ccccc2C(F)(F)F)c1Cl 770595352 DGDWQZOENOBQRX-LBPRGKRZSA-N 398.816 5.370 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc4cccnc34)n2)cc1 772637925 BBTJOBXHVVTTQR-LJQANCHMSA-N 383.476 5.086 30 20 GKED CCCC[C@H](NC(=O)Nc1ccccc1O[C@@H](C)C#N)c1ccc(OC)cc1 780669504 LFASPBJSFCFCDS-LPHOPBHVSA-N 381.476 5.039 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1c[nH]c2ccccc12 786318887 LPROHKXDXLARKG-YJBOKZPZSA-N 385.492 5.661 30 20 GKED CC(C)[C@@H](C=Nn1cnnc1SCc1ccc(Cl)cc1)c1ccccc1 794485328 VCAQIYARLDDUAH-LJQANCHMSA-N 384.936 5.498 30 20 GKED Cc1ccc(NC(=O)c2cccc(OC(=O)C[C@@H](CC#N)c3ccccc3)c2)cc1 796630024 CRMDGEWJLUAIND-HXUWFJFHSA-N 398.462 5.240 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)C(F)(F)F 796669960 JOUSERFMTFRIPX-SECBINFHSA-N 388.361 5.243 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C/Sc1cc(F)ccc1F 797867715 RXMQMAHGENBUJC-YGNAEDSMSA-N 390.480 5.604 30 20 GKED Cc1ccccc1N(C(=O)/C=C\c1ccccc1C#N)c1nc2ccccc2s1 799696242 QHDJWYJTPDGAOI-PFONDFGASA-N 395.487 5.855 30 20 GKED COCC[C@H](Nc1snc(Cl)c1C#N)c1ccc(Cl)c(Cl)c1 804708604 RRRMFOXBCOBASI-LBPRGKRZSA-N 376.696 5.165 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC/C(C)=C/c2ccccc2OC(F)F)c1 810145191 VMQIRUYNLDWQPA-KZIRBZLESA-N 386.442 5.162 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)cc1 810184460 REGFZHXCVXOYGK-RHSMWYFYSA-N 383.904 5.088 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2cscc2C(F)(F)F)C(=O)c2ccccc21 811691294 NHGANWWCQUXXME-USYSOWRXSA-N 380.387 5.084 30 20 GKED C#CC[C@@H]1CCCN(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)C1 831406081 HYMBZBWVHVDVEN-MRXNPFEDSA-N 385.558 5.178 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842940951 GENRCWVQUMRZCC-XHDPSFHLSA-N 378.419 5.094 30 20 GKED N#CC[C@H]1CCCN(C(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)C1 855258692 BWKDQWAUXCNZKB-AQRZYSDFSA-N 382.866 5.172 30 20 GKED C=CCCC[C@@H](NCc1ccc(-c2cccc(Br)c2)s1)C(=O)O 900068193 AXPUWWYQQAEQCZ-MRXNPFEDSA-N 394.334 5.077 30 20 GKED CCN(CC)Cc1cc(C(C)=NNc2nc(-c3ccccc3)cs2)ccc1O 916545682 UFJSYBIBTAYXDD-UHFFFAOYSA-N 394.544 5.194 30 20 GKED N#CCOc1cccc(NC(=O)N[C@@H](CCc2ccccc2)c2ccccc2)c1 916680712 JJXVTIJCAQUGQD-QHCPKHFHSA-N 385.467 5.085 30 20 GKED O=C(Nc1cccc(C=NNc2ncccc2Cl)c1)c1ccccc1Cl 917549664 YPCWPYWPLWOGMV-UHFFFAOYSA-N 385.254 5.087 30 20 GKED O=C(O)c1ccc(NN=Cc2c(Cl)cccc2Oc2ccccc2)cc1F 1776074722 PWQUWGPAHSEJJM-UHFFFAOYSA-N 384.794 5.416 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(Oc3cccc(Cl)c3)cc2)cc1F 1776076763 GDPZKUHCAUIELN-UHFFFAOYSA-N 384.794 5.416 30 20 GKED O=C(O)CCOc1cccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c1 1776126296 INUZIAWVBXOXMP-ZROIWOOFSA-N 388.419 5.229 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)c1 1776127939 JYVUNHMPYFWSIG-HJWRWDBZSA-N 397.377 5.047 30 20 GKED C=CCCC[C@H](NCc1cc(Cl)ccc1Oc1ccc(Cl)cc1)C(=O)O 1776174234 FBKDJBSSDCPNDG-SFHVURJKSA-N 394.298 5.685 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C2CCCCC2)cc1 1776354626 UKOZFOGDIJMZSJ-GXDHUFHOSA-N 392.495 6.116 30 20 GKED CCCCCCCOc1ccc(CNC2(C(=O)O)CCC(C(F)F)CC2)cc1 1776786592 YSXMCIMESLDNIV-UHFFFAOYSA-N 397.506 5.404 30 20 GKED CCCCCCCOc1cccc(CNC[C@@]2(CC(=O)O)CC[C@@H](C)C2)c1 1776788729 UEAADUKVDHOQSX-XXBNENTESA-N 375.553 5.407 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCc3ccsc3)cc2)CCC1 1788186874 KIBKHGOZAXLQCL-QGZVFWFLSA-N 396.556 5.027 30 20 GKED C=CCn1c(SCc2cccc3ccccc23)nnc1-c1ccccc1OC 6076719 YPWZUZJZORGLSX-UHFFFAOYSA-N 387.508 5.585 30 20 GKED COc1ccc(S[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 15028482 DGRZRSUHKDKKBF-CYBMUJFWSA-N 386.542 5.017 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(F)c(Cl)c2)[n+]2ccccc2)cc1 22799766 BYNRCQRORRJKDJ-UHFFFAOYSA-O 399.898 5.126 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3occc3-c3ccccc3)s2)cc1 30989524 XUWBKWCCASRRNO-UHFFFAOYSA-N 385.448 5.118 30 20 GKED CC(C)(C)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1C1CC1 51534817 WSHJOFJIGIWHPS-INIZCTEOSA-N 390.512 5.129 30 20 GKED N#C[C@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1nc2ccccc2o1 54736757 ULOZSKWZIQCZDM-LJQANCHMSA-N 384.460 5.610 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2c2ccsc2)cc1 56745122 PUVPJCSJXGJZLT-HXUWFJFHSA-N 389.480 5.781 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCOc1cccc(F)c1 65011262 LQSZVGBZYUUYDA-UHFFFAOYSA-N 380.444 5.224 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66856113 MGRHIKDZBOHFBO-KRWDZBQOSA-N 380.513 5.299 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2occc2C)cs1 119046344 JSWBWUCRUMWQMA-VMPITWQZSA-N 386.860 5.279 30 20 GKED COCc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 129782984 OUJFXARJRRZPGN-NRFANRHFSA-N 390.870 5.394 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1c(C)cc(Br)cc1OC 144768666 GOHSHYLYBOWDJM-UHFFFAOYSA-N 395.322 5.048 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccccc2F)cs1 156588018 ZKFSSLFHCBBUQX-FMIVXFBMSA-N 380.444 5.171 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2cccc(F)c2)CC1 159296183 PTJUNAIZMJNZRH-HNNXBMFYSA-N 383.492 5.073 30 20 GKED CCCN(Cc1ccccc1O)C(=O)Nc1ccccc1SC[C@H](C)C#N 173114495 OURVXNCNVGAYEA-MRXNPFEDSA-N 383.517 5.088 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 173474774 JMSKSZBJYFAUPL-GFCCVEGCSA-N 387.270 5.108 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C 178843091 KOLCLRSOHRKZAU-CQSZACIVSA-N 387.553 5.228 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)c1 180672025 QRCFLEKWQRBOLD-HXUWFJFHSA-N 382.508 5.131 30 20 GKED C=CCn1c(SCc2nc(-c3ccccc3Cl)cs2)nnc1C1CC1 187274424 PTOAMWJODZAJOI-UHFFFAOYSA-N 388.949 5.411 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 189994703 MPDHRXDHXUUXAG-DLBZAZTESA-N 387.458 5.361 30 20 GKED CCOc1ccc(-n2c(SCCCCC#N)nnc2-c2cccc(C)c2)cc1 195536464 FSXVRAVIYIAJDQ-UHFFFAOYSA-N 392.528 5.427 30 20 GKED CC(C)(/C(O)=N/[C@@H]1CCC[C@@H]2OCC[C@@H]21)c1csc(-c2cccs2)n1 328810990 MSNHNFYGKJSWDI-MCIONIFRSA-N 376.547 5.063 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(C)sc1Br 410753555 KQHQQJNMJBCHKD-UHFFFAOYSA-N 379.323 5.318 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cn1 429420976 DPTIKFVBQKAZSA-HNNXBMFYSA-N 387.443 5.162 30 20 GKED C[C@@H](c1c(F)cccc1F)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438637622 UIJSFWLVVGWBTI-JTQLQIEISA-N 383.320 5.080 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)c2ccc(C#N)cc2C)cc1 438829708 DCBOLEYCPWPKQK-XMMPIXPASA-N 383.495 5.076 30 20 GKED N#Cc1ccc(CNc2ccccc2NC(=O)c2ccccc2)c(OC(F)F)c1 439561647 OQLMLBFESILILQ-UHFFFAOYSA-N 393.393 5.024 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1)c1ccccc1 458842357 PHBVKXWDBUTOKN-QZTJIDSGSA-N 393.453 5.186 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1ccc(Cl)cn1 460151844 QOTRHKBUEDSGLF-UHFFFAOYSA-N 382.250 5.107 30 20 GKED C[C@H]1CCN(C)c2ccccc2N1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 460207502 VDSOZDDAWHEXGY-SFHVURJKSA-N 397.478 5.226 30 20 GKED Cc1ccc(-c2nc(CNc3cccc(Oc4ccc(C#N)cc4)c3)cs2)o1 462232894 MXXOMTPCEYEBTA-UHFFFAOYSA-N 387.464 5.988 30 20 GKED N#CCCCC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 463066375 GVVIAQFDKRMZLS-UHFFFAOYSA-N 390.295 5.962 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)Nc1ccccc1-c1ccccc1 464819157 RJAXLBGSVXLTAK-ZCYQVOJMSA-N 395.506 5.064 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NCC#Cc2ccccc2)cc1 465574268 PDOJYESONJREDA-FQEVSTJZSA-N 398.506 5.116 30 20 GKED CCC1(CC)CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CCS1 467340247 FFCKMUUDFICSIZ-OAHLLOKOSA-N 377.579 5.078 30 20 GKED O=C(Nc1cccc(NCC(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 468114045 VJGFKRTUCWRSFR-UHFFFAOYSA-N 380.263 5.071 30 20 GKED C=CC[C@H]1N(C(=O)CCc2nnc(-c3cc4ccccc4o3)o2)CCCC1(C)C 470281342 XAELNWUNTMOFGJ-LJQANCHMSA-N 393.487 5.009 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1-c1cnn(C)c1 475566036 GJLYTQLMRBCMFN-UHFFFAOYSA-N 388.515 5.261 30 20 GKED C=C(C)CN(C)C(=O)C/C(=C\c1cccc(OC)c1)c1nc2ccccc2s1 479212647 IAWHXMJRIILLMX-LDADJPATSA-N 392.524 5.270 30 20 GKED COc1cc(C)c(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)cc1F 481703143 KAKKLMZUMUMCBR-UHFFFAOYSA-N 389.430 5.003 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(Cc2cccc(F)c2)n1)c1ccccc1 487174503 FASMWKRGWIKPTP-IBGZPJMESA-N 393.487 5.038 30 20 GKED CCCCCC(=O)Nc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1 487323739 SCCGSJWANQELGW-UHFFFAOYSA-N 381.423 5.143 30 20 GKED Cc1cccc([C@H](NC(=O)c2sc3ccc(C#N)cc3c2C)c2ccccn2)c1 494414212 SPKCNWDUOQXPKC-QFIPXVFZSA-N 397.503 5.304 30 20 GKED CC[C@@H](C)Oc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 501461145 HVGQMEOVSBTGQN-MRXNPFEDSA-N 390.439 5.160 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCCC(F)(F)C2)cc1Cl 503993590 PTOQYNPUJKODSM-MAUKXSAKSA-N 388.845 5.759 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)CC1 508367974 JLCFTSBGLBTOSS-INIZCTEOSA-N 399.844 5.145 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1CCc2ccccc21 510522557 QNYRMGLZTXPWFA-HSZRJFAPSA-N 383.451 5.468 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@@H]2c2ccsc2)c1 513463594 OHGPEGDLIRXJPQ-OAQYLSRUSA-N 388.492 5.176 30 20 GKED C=CCCO[C@H](C)C(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 520635693 NXYMCTWFCKGBLH-QGZVFWFLSA-N 394.540 6.066 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(C)CCC(F)(F)CC1 527930118 PVAZICWZPKPKDH-UHFFFAOYSA-N 385.414 5.208 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1ncc(-c2ccc(Cl)cc2)o1 530733435 CZTBRKPYSFCRAD-PMACEKPBSA-N 377.875 5.267 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)Nc2cc(C#N)ccc2C)cc1 530842679 BOEVICNXFIQNTO-UHFFFAOYSA-N 385.467 5.110 30 20 GKED Cc1nc(C)c(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 534149569 WHJLZRZOLUGMHE-UHFFFAOYSA-N 383.860 5.330 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](CCC#N)c3ccccc3)s2)cc1 536835485 ZGRAPVWKIWWYIS-LAUBAEHRSA-N 375.541 6.123 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2c(F)cc(C#N)cc2F)on1 540872004 HFFMPYFAKNDEEO-UHFFFAOYSA-N 391.377 5.265 30 20 GKED CCN(C(=O)c1ccccc1Oc1ccccc1C#N)c1nc2ccccc2s1 540888615 ICIJTJWDZLMWJS-UHFFFAOYSA-N 399.475 5.627 30 20 GKED N#Cc1ccc(Oc2cccc(-c3nc([C@@H]4OCCc5ccccc54)no3)c2)cc1 547132998 ZWBCAEYVVGAQKR-JOCHJYFZSA-N 395.418 5.063 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1F 550835049 GFIAVJANLDBLSZ-KUHUBIRLSA-N 375.285 5.674 30 20 GKED C[C@H](N[C@H](C)c1cccc(-n2ccnn2)c1)c1ccc(-c2cccc(C#N)c2)cc1 554386449 YNFFRCCVMRMRTI-RBUKOAKNSA-N 393.494 5.218 30 20 GKED CCCc1ccc([C@H](NCc2cnc3ccc(C#N)cn23)c2cccs2)cc1 556582379 LPGHOBJGKULGAW-QHCPKHFHSA-N 386.524 5.099 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)Nc1ccccc1CC#N 558190473 OOGMNGUQLCOKIL-ZDUSSCGKSA-N 381.888 5.074 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2nn(C(C)C)cc2c1 562221297 PSBOQOTWXJYDCP-UHFFFAOYSA-N 394.523 5.005 30 20 GKED Cc1onc(C2CC2)c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 562808331 COAXRFISQSYJPW-CQSZACIVSA-N 383.860 5.127 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1 571636435 IPALKCURAAZAOJ-XLIONFOSSA-N 392.524 5.086 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1Cl 574835531 YFIOGUOWLIAPKR-WMZHIEFXSA-N 389.886 5.408 30 20 GKED CCCN(C(=O)CC1(C#N)CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 590974733 KAHKBKOLWLCJAG-UHFFFAOYSA-N 394.327 5.554 30 20 GKED CCN(C(=O)CC1(C#N)CCCCC1)[C@@H](c1ccc(C)cc1)c1cccnc1 597217217 MWLCXNOKMHFTCG-QHCPKHFHSA-N 375.516 5.192 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)c1 609081283 KDJPSXJESMFTMB-KRWDZBQOSA-N 391.805 5.086 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609724318 JPDDZHWDQMPKCD-UHFFFAOYSA-N 396.796 5.418 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)CCc3ccc(C#N)cc3)cc2c1 610066988 PTLQOMWUENKTBC-UHFFFAOYSA-N 398.462 5.368 30 20 GKED CN(CCCCC#N)Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 611546703 AYSWIHPLSSFGFV-UHFFFAOYSA-N 392.934 5.377 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(OCc3ccccc3C#N)cc2)cc1 726940731 PXNKQHSSYCZZDA-UHFFFAOYSA-N 395.462 5.006 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2cc(-c3ccco3)nc3onc(C(C)C)c23)c1 728480545 XBRVMDDNNDKGEV-UHFFFAOYSA-N 399.450 5.254 30 20 GKED CCc1cc(NN=C(C)c2ccc(OC)c3ccccc23)nc(-c2ccccn2)n1 730463687 LQMZIIGLZDLRBB-UHFFFAOYSA-N 397.482 5.099 30 20 GKED COc1ccc(C2(NC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)cc1 731752560 JNLQXDFQUSLQOO-QHCPKHFHSA-N 397.478 5.161 30 20 GKED Clc1ccc(-c2noc(NN=Cc3cc4ccccc4nc3Cl)n2)cc1 732925938 WAVDACPZUSYDSE-UHFFFAOYSA-N 384.226 5.038 30 20 GKED N#C[C@H](NC(=O)/C=C\c1cccc(OC2CCCC2)c1)c1ccc(Cl)cc1 733258995 OLMWOICZGDDRLK-LUTRRODMSA-N 380.875 5.056 30 20 GKED C[C@@H](OC(=O)CCC(C)(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733708858 CAGUGEBMGWOCQT-MRVPVSSYSA-N 378.259 5.764 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)OCc1cc(Cl)ccc1OCC#N 735339310 QUKLKJNXXPSEPL-LBPRGKRZSA-N 396.295 5.120 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(-n3cncn3)c(C)c2)cc1 742433821 AQOSFMDELOPUGI-ZSOIEALJSA-N 395.462 5.147 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)N1c2ccccc2Sc2ccccc21 743454827 QFLCFCKYIQMVPR-HNNXBMFYSA-N 388.517 5.868 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1c(Cl)cccc1Cl)C1CC1 745669537 OAHSZIWZBUBROG-UHFFFAOYSA-N 376.312 5.226 30 20 GKED O=C(/C=C/c1cncc(F)c1)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750207438 SPCMQVZVBLOYQT-MBVDDHJVSA-N 393.258 5.100 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H]2c2cccc(F)c2)cc1 752185129 NECIGQUKIWCIEG-XZOQPEGZSA-N 385.442 5.460 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1CCOc2c1ccc(Cl)c2Cl 753318088 NVTJQCJRQHXJTN-HNNXBMFYSA-N 397.327 5.276 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)C1CC1 754423421 CCLOCTHSEJSSNR-STQMWFEESA-N 398.359 5.128 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN[C@H](C)c2csc3ccccc23)c1C 754732902 CAFHYRMOJAGIAI-GOSISDBHSA-N 391.540 5.116 30 20 GKED C=CCn1c(SCc2ccc(OC(C)=O)cc2)nnc1-c1ccc(Cl)cc1 760379732 STCPAGDSXIAINO-UHFFFAOYSA-N 399.903 5.002 30 20 GKED C[C@H](NC1CCN(c2ccc(C(C)(C)C)cc2)CC1)c1ccc(OCC#N)cc1 772958452 GYTHJPJZJOJHGC-IBGZPJMESA-N 391.559 5.206 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 779021503 SZBKKWFXNFPGKW-QHCPKHFHSA-N 385.467 5.198 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2ccc(C(C)(C)C)cc2)cs1 779824459 BODYQBUNKWTJAZ-UHFFFAOYSA-N 392.528 5.571 30 20 GKED C=CC[C@@H](N[C@H](CC)c1ccc(Br)cc1Cl)c1ccncc1 783247489 YTAUUKSXSHCYQD-QZTJIDSGSA-N 379.729 5.856 30 20 GKED C=CC[C@@H](NC(=O)[C@@H](CC)Cc1ccc(C(F)(F)F)cc1)c1ccncc1 786185352 MYMNTVRBMSWFQK-QFBILLFUSA-N 376.422 5.103 30 20 GKED CC(C)(C)c1cnc(CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)o1 788180030 LFQBQTVSUNGLBO-LBPRGKRZSA-N 387.892 5.044 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)[C@H](Oc2ccccc2)c2ccccc2)s1 797571365 OCAGPVDZGJBEFY-GHTZIAJQSA-N 390.508 5.437 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 798288549 YFOYOWMLXHHYPP-KSZLIROESA-N 396.874 5.583 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@@H](C#N)C(=O)Nc3ccc(F)c(Cl)c3)c2c1 805856531 XGCJRRNCZBWCNE-OAHLLOKOSA-N 398.821 5.310 30 20 GKED CC(C)CC1CCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 810282900 CLYQXNLKBORGSD-UHFFFAOYSA-N 378.476 5.036 30 20 GKED CC(/C=C\C(=O)c1ccc2c(c1)CCC(=O)N2)=C\c1ccccc1OC(F)F 811688954 VVPFRLOOVCAWDA-NVWBTOBJSA-N 383.394 5.015 30 20 GKED O=C(COc1ccc(C(=O)/C=C/c2ccc(Cl)s2)cc1)Nc1ccccc1 834756496 ROQFUWJWTLNEEB-ZRDIBKRKSA-N 397.883 5.315 30 20 GKED CC(C)c1ccc(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915088141 ZYIXLHJLPIVRDM-DEOSSOPVSA-N 384.479 5.483 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 915747260 YFSMUJKFXQUJGW-ZDKIGPTLSA-N 378.884 5.192 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 916057726 VQZJSJXHIUDZNN-VPAPRSNLSA-N 397.865 5.519 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2cccc3ccccc23)cc1 916546479 TVKWSKXQAZQMJO-UHFFFAOYSA-N 378.888 5.259 30 20 GKED N#C[C@H](C(=O)CCSc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 917024917 CJQRADCTQCKZMB-QGZVFWFLSA-N 398.940 5.822 30 20 GKED COc1ccc2oc(C)c(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 917046890 VNWUJPMEJHRXRJ-AWEZNQCLSA-N 396.855 5.503 30 20 GKED Cc1cccc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 917600201 NKPPWGNTWQIUIL-UHFFFAOYSA-N 393.899 6.121 30 20 GKED N#Cc1cccc(NC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c1 917667220 LDOPTSGVAOHWOJ-CYBMUJFWSA-N 392.311 5.488 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N[C@H](c1ccc(Cl)cc1)c1ccsc1 919936242 HUCALDABPKHAGJ-PWYGHMFVSA-N 378.884 5.192 30 20 GKED CCCc1sc(C(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc1CC 920101846 KYHBDQBUELVSRO-INIZCTEOSA-N 378.497 5.258 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NNc1ccccc1 1776032657 HULTYJHLJPFUJL-UHFFFAOYSA-N 388.467 5.384 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1ccccc1C(F)(F)F 1776180231 HNJZQHUROHCKGC-HNNXBMFYSA-N 389.826 5.234 30 20 GKED C=CCOc1ccc(CNc2cc(C(=O)O)ccc2OCCC)cc1Cl 1776184592 QDGKQKWYOONIAV-UHFFFAOYSA-N 375.852 5.004 30 20 GKED CC(/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C)=C\c1cc(F)cc(F)c1 1776398731 FUZOINADDWBLAL-FGDQGFBNSA-N 386.394 5.293 30 20 GKED CCCCCCCOc1ccc(CNCCC2(CC(=O)O)CCCCC2)cc1 1776787124 WGIPAKIZEROWQK-UHFFFAOYSA-N 389.580 5.941 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(F)c(C(F)(F)F)c1Cl 1777436174 OXLIRVLIRXHLDG-FNORWQNLSA-N 386.728 5.401 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc(OCC3CCC3)c1)C2=O 1777682911 DYCWEZOJYRUQSV-XDHOZWIPSA-N 376.452 5.166 30 20 GKED Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)s1 41534623 COCGNGQYHLAYHL-HNNXBMFYSA-N 380.494 5.019 30 20 GKED C[C@H](NC(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1)c1ccc(C#N)cc1 45407179 JFZXGPQSLAMJBH-SNRMKQJTSA-N 387.508 5.095 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cccc1[N+](=O)[O-] 46443751 LXVQJWCIRAUXAJ-HNNXBMFYSA-N 397.843 5.170 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c(Cl)c2ccccc21 51656386 JXNRDOCPGZUSHL-LBPRGKRZSA-N 398.800 5.067 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1CCc1ccccc1 66954609 WZWQBYOXTBEAIS-QUCCMNQESA-N 393.556 5.710 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CC1 66954837 GFHDCEMCEHANBC-HNNXBMFYSA-N 383.492 5.416 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccc(F)cc2)CC1 66955461 UMPVYFBQYDPZMT-HNNXBMFYSA-N 383.492 5.073 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1 91859527 GELDOYWABYDDJA-OAHLLOKOSA-N 395.890 5.152 30 20 GKED CCN(C(=O)c1cc(-c2ccco2)nc2ccccc12)[C@H](C)c1ccc(C#N)cc1 105904009 VKUDBUTVMOAESS-QGZVFWFLSA-N 395.462 5.590 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cc(C(C)C)no1 114574109 SOPYWXGWJBQVAR-UHFFFAOYSA-N 390.443 5.092 30 20 GKED Cc1ccc(C[C@H](NCc2cccc(OCCCC#N)c2)c2ccccn2)cc1 115627360 GWIHCVVOVIDHNH-VWLOTQADSA-N 385.511 5.146 30 20 GKED CSc1cc(C(=O)Nc2ncccc2OCCCC#N)c(Cl)cc1Cl 153290714 NCATXFZYTNSCJA-UHFFFAOYSA-N 396.299 5.045 30 20 GKED N#CCCN(CCC#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 161489817 YDRSILNQUTWTBK-UHFFFAOYSA-N 388.254 5.055 30 20 GKED CC(=O)N(c1nc(CN(CCC#N)CCC(C)C)cs1)c1cccc(C)c1C 166248668 AWZNITJXVKZMAA-UHFFFAOYSA-N 398.576 5.206 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl 172907292 UDWQTJGFHMOMCG-UHFFFAOYSA-N 383.879 5.147 30 20 GKED C[C@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174492942 BTZVRAXNZFTFAR-OAHLLOKOSA-N 390.418 5.110 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Sc1ccc(C#N)c(C(F)(F)F)c1 180392128 ATXPBZVLJISXJY-ZDUSSCGKSA-N 378.419 5.313 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1cn(-c2ccccc2)nn1 191463063 XNOBFEIZCSLDMZ-KRWDZBQOSA-N 389.503 5.002 30 20 GKED Cc1nc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)ccc1C#N 192668129 HEZVWCMHYNDGLA-UHFFFAOYSA-N 399.237 5.008 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cccc(OCc3ccccc3)c2)c1 236899568 PVSPCVUYZQKQIM-HSZRJFAPSA-N 386.495 5.236 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)[C@H](C)c1ccc(C#N)cc1 303545994 ZHXJCYJDUAHUAP-JEBQAFNWSA-N 387.310 5.578 30 20 GKED Cc1cccc(N=C(O)[C@@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c1C 328700838 MYIINGLNLOJPHE-VGSWGCGISA-N 391.515 5.377 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1 432075137 IUZHFHINPXCXEX-HHXXYDBFSA-N 397.519 5.678 30 20 GKED CCCN(Cc1cn(CCC#N)nc1-c1ccncc1)[C@H](CC)c1ccccc1 435139241 WCCPXJQYIVJTCQ-HSZRJFAPSA-N 387.531 5.222 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(OC)cc2)nc1 438435330 CKCKQKLYHWGWAT-UHFFFAOYSA-N 389.455 5.103 30 20 GKED CC1(C#N)CCC(N[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)CC1 449316507 ZJRXSORSNHKMJU-GPJFCIFZSA-N 380.454 5.235 30 20 GKED C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458797222 GBOJHROPKNVDFR-PTUXOGIPSA-N 375.516 5.084 30 20 GKED C=CCC[C@@H](CCC)N[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 461883560 JZMTZNFHSUKTFV-IRLDBZIGSA-N 389.536 5.043 30 20 GKED CCC[C@]1(C)CCCN(C(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)C1 464948839 BEGIMACDRBMRAC-XMMPIXPASA-N 392.547 5.123 30 20 GKED C=CCCCNC(=O)C/C(=C\c1cccc(OC)c1)c1nc2ccccc2s1 468366624 CSRVWLMSQKZTBL-NBVRZTHBSA-N 392.524 5.318 30 20 GKED N#CCSc1cccc(C(=O)N(CCc2ccccc2F)C2CCCC2)c1 475657719 BINNRTVRZGWJQC-UHFFFAOYSA-N 382.504 5.069 30 20 GKED Cc1ccc(-c2nnc(SCc3cccc(C#N)c3)n2Cc2ccco2)cc1 481359747 QMKCSCWWUNPUBP-UHFFFAOYSA-N 386.480 5.059 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H](c1cccc(Cl)c1)c1ccccn1 481654473 VKFCNDSATOFPJD-UPVQGACJSA-N 387.914 5.753 30 20 GKED CCSc1cccc(Br)c1NC(=O)[C@H](C)c1cccc(C#N)c1 484895785 UAJUXBQUJLBVEO-GFCCVEGCSA-N 389.318 5.175 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1ccc(Oc2ccccc2)nn1 498020502 MXSRCSUKWYJGPL-UHFFFAOYSA-N 396.475 5.495 30 20 GKED COc1ccccc1[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccccc1Cl 498155686 DMHPERNQZURPGL-HXUWFJFHSA-N 399.922 5.067 30 20 GKED CC(C)[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(F)cc1 501628912 PVTZQWWUQFUMAE-QFIPXVFZSA-N 389.430 5.012 30 20 GKED Cc1cc(F)cc([C@@]2(F)CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)c1 503821691 IBGZTWCAOQSVGY-JOCHJYFZSA-N 383.442 5.038 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)c12 504333927 DPNMOGWCFASHFF-UHFFFAOYSA-N 381.435 5.322 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(C#N)cc1 505317574 JNHJNFAZMJHXLD-XDHUDOTRSA-N 395.462 5.454 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2ccccc2OCc2ccccc2)cc1 506251886 DNOKCZZMFGFTOU-UHFFFAOYSA-N 399.494 5.388 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1 506343843 YUAQRRRJYYVQHL-KRWDZBQOSA-N 391.393 5.161 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)cc1 510584510 NQRFTQROLUFADV-UHFFFAOYSA-N 392.890 5.213 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cc2)cc1 519992085 JOXCFBKYEMCERE-UHFFFAOYSA-N 398.462 5.732 30 20 GKED C[C@H](Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)C(=O)Nc1cccc(C#N)c1 521726442 NLXVOILEHJFCKD-IEGUWTFLSA-N 391.515 5.093 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CC/C=C\c2ccccc2)cc1 523100852 HZOJOWFIBQBDLB-WMZJFQQLSA-N 396.490 5.764 30 20 GKED CC(C)C(=O)Nc1cccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 523123386 CQTSLFMCFXCZDH-UHFFFAOYSA-N 398.466 5.149 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@H](C)S[C@@H]1CCCc2ccccc21 523227494 WUFBBGXDFXFXSS-HTAPYJJXSA-N 394.540 5.141 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(-c3ccccc3Cl)o2)c1 524379717 TWCSBUUIEZETJX-UHFFFAOYSA-N 388.757 5.325 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)[C@@H]3C[C@@H]3c3c(F)cccc3Cl)n2)cc1 524824334 JPRZVZCQQXYAPN-UONOGXRCSA-N 397.862 5.216 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COc2ccccc2)cc1 536922482 YDQOLPLIQQQDDG-UHFFFAOYSA-N 399.494 5.580 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)ccc1OCc1ccccc1 537294219 ARMHQZZMNSSVNU-OALUTQOASA-N 386.495 5.558 30 20 GKED C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1cccc(C#N)c1 537295105 LJUNEXJVWYATMB-IBGZPJMESA-N 378.479 5.262 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(C#N)c2)CC1)c1ccc(-c2cccc(C#N)c2)cc1 541998522 SVAGJMDOJDEYRX-GOSISDBHSA-N 391.474 5.006 30 20 GKED CC(C)n1ncc2cc(CSc3ccc(C#N)c(C(F)(F)F)c3)cnc21 542932735 MNXTYWVYHRSHEY-UHFFFAOYSA-N 376.407 5.195 30 20 GKED N#CCCCOc1cccc(N[C@@H](c2cccnc2)c2ccc(F)cc2F)c1 543424920 JBYVWBFMADIJQI-QFIPXVFZSA-N 379.410 5.244 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cnn1-c1ccc(F)cc1 543879196 SOWSCJYONAKWKV-MRXNPFEDSA-N 396.491 5.034 30 20 GKED CCN(C(=O)c1ccc(C#N)c(Cl)c1)[C@@H](c1ccc(C)cc1)c1cccnc1 548283957 JBFYPCGLYBYZQJ-QFIPXVFZSA-N 389.886 5.167 30 20 GKED COc1ccc(-n2c(S[C@H](C)CCC#N)nnc2-c2cccc(C)c2)cc1 551413104 FHZVGMBJLAGKCH-MRXNPFEDSA-N 378.501 5.036 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)cc1CN[C@H](CCCC#N)c1ccccc1 552311783 ACATXAOWQSQUAB-JOCHJYFZSA-N 378.907 5.359 30 20 GKED COc1ccc(-c2cc(C(=O)N(CCC#N)c3ccc(F)cc3)sc2C)cc1 554283079 IUWWXVANPGHQEH-UHFFFAOYSA-N 394.471 5.432 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C2(c3cccnc3)CCCC2)cc1 561723893 VBWCKZZLCFNVSD-UHFFFAOYSA-N 383.451 5.196 30 20 GKED N#CC(CCSc1nc(O)cc(C(F)F)n1)(c1ccccc1)c1ccccc1 568802338 BJPICFHOXMZHOK-UHFFFAOYSA-N 397.450 5.112 30 20 GKED CC(C)O[C@@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 584778756 XULAGXGMQOOMOG-QUCCMNQESA-N 397.906 5.027 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1ccccc1)c1nc2cc(F)ccc2s1 592974477 YXYHQJBUHZEULX-QGZVFWFLSA-N 388.423 5.718 30 20 GKED C[C@H](NC(=O)Nc1cccc(C#Cc2ccccn2)c1)c1cc2ccccc2o1 601187617 YCCAQEVGOOHQMW-KRWDZBQOSA-N 381.435 5.110 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c1 603622758 YEVDLPZITBIIOP-UHFFFAOYSA-N 395.871 5.373 30 20 GKED N#C[C@H](C(=O)c1cccc(COc2cccc(F)c2)c1)c1ccc2ccccc2n1 604005438 LWOFYSZWBZUWJF-QFIPXVFZSA-N 396.421 5.443 30 20 GKED Fc1cc2ncc(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)nc2cc1F 605568747 UBRYMNROEXULIH-HTQZYQBOSA-N 399.285 5.229 30 20 GKED C[C@H](N[C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1)c1cccc(C#N)c1 608381783 MYJPYWSAJSSSKH-XDHUDOTRSA-N 379.463 5.314 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(Cl)c3Cl)cc2)c1 609064426 VTMODNGZXMEOJN-UHFFFAOYSA-N 397.261 5.696 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc4cccnc34)cc2F)c1 609103980 LXVXSABAYNEHDQ-UHFFFAOYSA-N 397.409 5.077 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccccc2F)o1 609431471 OSFJGWSKSUSZAJ-AWEZNQCLSA-N 380.444 5.732 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609498610 QJTMYZZYDONPDL-UHFFFAOYSA-N 393.446 5.171 30 20 GKED CC(C)(NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1cccs1 609726556 JVQIPQDLVYPIDN-UHFFFAOYSA-N 380.444 5.216 30 20 GKED C[C@H](NC(=O)CS[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 609825565 FQUWYLBKKMYAON-STQMWFEESA-N 393.339 5.537 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1 609981752 ZNMNNUBBLLEHSI-FQEVSTJZSA-N 398.506 5.149 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 610355328 OAVOWMNHYXSUMZ-QWHCGFSZSA-N 376.287 5.329 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(Cl)c(Cl)c3)n2)cc1 612894684 IDCNJQQXZVCNLO-CQSZACIVSA-N 387.291 5.915 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 615081464 JAYXJUFYSDWNTJ-OALUTQOASA-N 389.417 5.032 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 618891713 CSXFYXJAESBEGX-AQNXPRMDSA-N 399.519 5.021 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cccc(OCc2ccccn2)c1 619508194 LREOGYAACOYUMM-RUZDIDTESA-N 383.495 5.090 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 620457144 WSZKKRJDMASJQL-PBOSXPJTSA-N 399.350 5.030 30 20 GKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1ccc(Br)s1 727972969 NKEQHYMJPZOJSI-TWGQIWQCSA-N 376.300 5.530 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1Cl 728439253 GBSAGVOMCZHWSR-AATRIKPKSA-N 391.901 5.438 30 20 GKED N#C[C@H](C(=O)c1cccc2c3c([nH]c12)CCCC3)c1nc2cc(F)ccc2s1 730418700 YFRQGDXJHAAEFA-MRXNPFEDSA-N 389.455 5.286 30 20 GKED CC(=NNc1nccc2sccc12)c1cnn(-c2cccc(Cl)c2)c1C 731557941 DSMSBVDPHYWYIS-UHFFFAOYSA-N 381.892 5.280 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2SC(F)(F)F)c1 731971576 DVTPIPQPWHZNGH-UHFFFAOYSA-N 394.418 5.358 30 20 GKED COc1ccccc1CC(C)(C)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 733052884 SQYXMDZCRADXTK-OAHLLOKOSA-N 398.915 5.403 30 20 GKED CC1(C)CC(=NNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)c2ccccc21 733080077 CYAYLVXXEONUMC-UHFFFAOYSA-N 397.404 5.055 30 20 GKED C#CCCOc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccc(OC)cc2)cc1 733326252 RNRCEPMUQHOQQV-VWLOTQADSA-N 389.470 5.116 30 20 GKED CCCCc1ccc(NC(=S)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 733755594 WEQKCUMJRJRRIB-HXUWFJFHSA-N 381.545 5.197 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1C#N 741847399 GFQGATVYZVSUKO-SOFGYWHQSA-N 390.420 5.100 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)[nH]2)CC/C1=C\c1cnc(-c2ccccc2)[nH]1 742428967 APQMEVRGGQPGAL-IWGRKNQJSA-N 392.462 5.297 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(N2CCCCC2)cc1 743057127 QETCVLHOWWKJRH-AWNIVKPZSA-N 385.467 5.155 30 20 GKED COc1cc2c(cc1NC(=O)N[C@H](C)c1cccc(C#N)c1)oc1ccccc12 743068925 PTIMIYKFXQRJKE-CQSZACIVSA-N 385.423 5.349 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 744462909 SACGSXZWAVDEFA-YADARESESA-N 384.479 5.386 30 20 GKED CCC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc2cc(OC)ccc2c1 746497338 FZHMGZCONCUGDY-UHFFFAOYSA-N 376.460 5.232 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 750391216 DQPJHTRZJZHTDW-FQEVSTJZSA-N 390.826 5.093 30 20 GKED N#C[C@H](COC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)Cc1ccccc1 750783626 IMXQHCSZNLIOQK-QGZVFWFLSA-N 392.842 5.067 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)C34C[C@H]5C[C@@H](CC(F)(C5)C3)C4)c2)s1 765623773 OFZCGOZYCMIOAR-TWVWUCKLSA-N 394.515 5.211 30 20 GKED CCCN(Cc1ccccc1O)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 774318728 GOVKQWNFVPBYEL-UHFFFAOYSA-N 399.494 5.053 30 20 GKED CC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1cc(F)cc(Br)c1 776163259 GUNOPHDSKXHFPZ-DJJJIMSYSA-N 391.284 5.292 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1OCc1cccc(Cl)c1 776935065 LSONLQSIXLWYKP-UHFFFAOYSA-N 390.870 5.166 30 20 GKED CC(C)(C)C[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccc(F)cc1 777116752 IDZGYZGOZGSRCA-JOCHJYFZSA-N 395.522 5.248 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCOCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 786310869 FCTPEBURCNIKBY-RISCZKNCSA-N 395.311 5.110 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nccc2ccccc12)Cc1ccc(Cl)cc1 792098012 ZUMYRIAXNWQRAE-FQEVSTJZSA-N 376.887 5.723 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CCc3cc(SC)ccc3C2=O)cn1 792884935 MNRPODOJSXRGDZ-BOPFTXTBSA-N 388.492 5.087 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(CC[C@@H](O)c2ccccc2)c1)c1ccccc1 793629850 SQLBSZJXGPXXAV-ILBGXUMGSA-N 398.506 5.379 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC([C@H](O)c2ccccc2C)CC1)c1ccccc1 805223273 HMCMOANVCUNEFG-RPWUZVMVSA-N 392.543 5.158 30 20 GKED C=CC[C@H](N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccncc1 808697112 WFBZPLAYSPJRQS-AZUAARDMSA-N 396.332 5.610 30 20 GKED COCC1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCCC1 810158444 MWQDUUKWHDOTQI-JOCHJYFZSA-N 391.515 5.060 30 20 GKED Cn1cc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)c(C(F)F)n1 812241669 LAEXIKDREILJFA-PTNGSMBKSA-N 395.434 5.391 30 20 GKED CC(C)(C)OC(=O)Nc1ncc(CN[C@H](CCCC#N)c2ccccc2)s1 814304283 JNPYVOHZXSCVBR-QGZVFWFLSA-N 386.521 5.015 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 815239597 RZNDBUBJTHGBLO-UHFFFAOYSA-N 393.434 5.423 30 20 GKED CC1(/C=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 822528660 HRNUMGMUXPQCDH-GDCKJWNLSA-N 394.902 5.307 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccc[nH]1 831920999 GOPYYBJJUKVYGD-VIFPVBQESA-N 397.294 5.187 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC[C@]1(C)CC1(Cl)Cl 836385546 HNQMXHZEQGUXQP-BLLLJJGKSA-N 386.348 5.034 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 836490788 LVKOUTAWJHEAEH-UHFFFAOYSA-N 388.515 5.264 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(N(C)C(=O)OC(C)(C)C)cc1 862830428 KPKLVDCOVNDPJI-UHFFFAOYSA-N 398.528 5.588 30 20 GKED N#Cc1ccc(Br)c(CNc2cccc3oc(C(F)(F)F)nc23)c1 864020072 VEMCUVFUAYPSLA-UHFFFAOYSA-N 396.166 5.093 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)oc2ccc(F)cc12 915088048 ZPVMIXJCFUKHHV-NRFANRHFSA-N 384.410 5.788 30 20 GKED CCc1nc2ccccc2n1N=Cc1cc(C)c(OCc2ccccn2)c(C)c1 915958569 KXBZTPTZUNKBEX-UHFFFAOYSA-N 384.483 5.072 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](c1ccc(Cl)cc1)c1cccs1 916025015 YULQNLNIAZKCIM-SFHVURJKSA-N 383.929 5.349 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2csc3ccccc23)cc1 916051018 JQZHFKHGKHTXKI-QFIPXVFZSA-N 382.488 5.738 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1cccc(Cl)c1 916906197 RJLKOYRIALXNMI-GOSISDBHSA-N 390.826 5.093 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(Cl)cc2)CC1)c1nc2cc(Cl)ccc2s1 917047329 WWTZRWDGVDWDGB-CQSZACIVSA-N 387.291 5.511 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3c(Cl)cccc3Cl)cc2)c1 1776048878 IBVVHMHZWQUMPP-UHFFFAOYSA-N 399.277 5.734 30 20 GKED C=CCOc1ccc(/C=C/c2cc(C(=O)O)c3cc(C)ccc3n2)cc1Cl 1776183955 PHWWSTOUXKRHJN-FNORWQNLSA-N 379.843 5.630 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C\C(=O)c1cccc(OCC(=O)O)c1 1776365047 NGCHZKUCVICTSV-KTKRTIGZSA-N 390.888 5.200 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@H](CC(=O)O)C2CCCCC2)cc1 1776786652 QYEXJQPGXLVEHI-JOCHJYFZSA-N 387.564 5.743 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 25438810 PGBIFGGKEBNJDG-UHFFFAOYSA-N 379.460 5.311 30 20 GKED Cc1cccc(C)c1/N=C1/NC(=O)/C(=C/c2ccc(C(C)C)c([N+](=O)[O-])c2)S1 35582339 MELXTJRAPBKEOP-WQRHYEAKSA-N 395.484 5.227 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@H](C#N)c1nc2ccccc2s1 41502569 JCLBXCGYQXZCIA-NSHDSACASA-N 381.507 5.280 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1SCC(F)(F)F 62383195 ZNCKGEABIOKWQE-UHFFFAOYSA-N 394.462 5.604 30 20 GKED C=CCN(C(=O)CCC(=O)c1ccc(C)s1)c1nc(-c2ccccc2)cs1 69572320 DOGFNRUGLACKIS-UHFFFAOYSA-N 396.537 5.362 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1nc2ccccc2s1 78714741 HGSJVZVVAKPXHT-AWEZNQCLSA-N 396.541 5.212 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC(OCc2ccccc2)CC1 105358363 KMSAGRLEQUVUNZ-UHFFFAOYSA-N 396.490 5.047 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109016666 DABKVVYYHMFUFJ-NSHDSACASA-N 390.852 5.286 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)s1 126810472 JKLZKTMHECXEPE-UHFFFAOYSA-N 395.431 5.371 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)c(F)c1 159358183 NWXYVMYGAUCDBP-UHFFFAOYSA-N 393.491 5.148 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(CCC(F)(F)F)CC1CC1 175997759 IDAGNQRHBPMUPA-ZDUSSCGKSA-N 385.455 5.277 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC2(CCCC2)C1 176051036 CZZFNQDUKXQSRS-UHFFFAOYSA-N 389.499 5.244 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccccc1OC 182235849 BKHXJXBIWUFUKB-CQSZACIVSA-N 392.484 5.134 30 20 GKED CCC(C)(C)N/C(S)=C(/C(=O)c1ccc(C(C)(C)C)cc1)[n+]1cccc(C)c1 186976918 JDCNZXHKYMPQAM-UHFFFAOYSA-O 397.608 5.297 30 20 GKED Cc1ccc(F)cc1CSCC(=O)Nc1ccccc1S[C@H](C)CC#N 187535062 TVHNWKPRFVIGNM-OAHLLOKOSA-N 388.533 5.400 30 20 GKED FC(F)(F)c1ccc(C#CCNCc2csc(-c3cccs3)n2)cc1 237871111 GSMVJBORRAVYSO-UHFFFAOYSA-N 378.444 5.032 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3nccn3CC(F)(F)F)s2)cc1 255623710 NXRSWCKQLBPSNE-FPLPWBNLSA-N 391.418 5.082 30 20 GKED Cc1ccsc1CNc1cc(C#N)c([N+](=O)[O-])c(NCc2sccc2C)c1 301387979 YEAXUZJVOCORTP-UHFFFAOYSA-N 398.513 5.431 30 20 GKED Cc1c(/C(O)=N/C2(c3noc(C4CCCC4)n3)CCCCCC2)cnn1C(C)C 329129769 WKHSVSPIFOCPED-UHFFFAOYSA-N 399.539 5.367 30 20 GKED Cc1cccc(N=C(O)N2CCC[C@H](c3nc([C@@H]4CCCC[C@@H]4C)no3)C2)c1 329547105 AYMWZCFADOAUIM-JENIJYKNSA-N 382.508 5.097 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@@H](c4ccccc4F)C3)c2)cc1 410330885 YSQJIUOYQUETBB-LJQANCHMSA-N 386.426 5.119 30 20 GKED Cc1cscc1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 427606657 MPLFKBBDHGFQAL-UHFFFAOYSA-N 378.522 5.151 30 20 GKED N#Cc1c(F)ccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1Cl 431581618 BXKMFKUQBXSBCM-BOPFTXTBSA-N 379.778 5.243 30 20 GKED N#CCCC[C@H](NS(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1 431637183 RREORMWSRUZSIE-QHCPKHFHSA-N 390.508 5.067 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](c2ccc(F)cc2)C1 432073812 DZRMWMNFPVCBOS-NVXWUHKLSA-N 383.492 5.241 30 20 GKED N#Cc1ccccc1NC(=O)CCCC(=O)Nc1ccc(Oc2ccccc2)cc1 432591502 IKIIEKKKJOEOSB-UHFFFAOYSA-N 399.450 5.098 30 20 GKED CC1CCN(c2cccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2)CC1 432953787 CRPHGJVDTOKENV-QHCPKHFHSA-N 390.531 5.480 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1)c1ccccc1 435100273 DVKLOMHFJIMIHV-VGSWGCGISA-N 391.515 5.103 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 437736941 XSELAUYCABQOGB-VFNWGFHPSA-N 393.918 5.790 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)Nc1cccc(CC(F)(F)F)c1 438552777 JDXCMYPHWCWKDI-UHFFFAOYSA-N 394.290 5.271 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)Cc1ccncc1)c1ccc(C(F)(F)F)cc1 440858565 WZTXLJCUJGIESF-BEFAXECRSA-N 391.437 5.038 30 20 GKED N#CC1CCC(CNC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)CC1 440989750 OJUVUCCONATMGK-JRSKDTKFSA-N 380.319 5.170 30 20 GKED O=C(Nc1ccccc1F)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444026336 TWZWTERVANLTOT-AWEZNQCLSA-N 394.290 5.660 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccnc1-c1csc(C)c1 446432315 VQCKUXGJSZYRTP-UHFFFAOYSA-N 388.496 5.210 30 20 GKED Cc1cccc(OC(F)F)c1NC(=O)c1c(F)cc(C(F)(F)F)cc1F 463604240 HIYQZFXDVYFKAS-UHFFFAOYSA-N 381.247 5.146 30 20 GKED CC[C@@H](C)C[C@@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 466162940 KCRWWFKGRYGGQB-QZTJIDSGSA-N 379.504 5.278 30 20 GKED N#CCc1cccc(C(=O)Nc2cc(Cl)ccc2NCc2ccccc2)c1 466449807 VDLGEENUABKCHK-UHFFFAOYSA-N 375.859 5.270 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nnnn1C1CCCCC1 468961531 LIYUBVKDABCXBS-MRXNPFEDSA-N 388.475 5.015 30 20 GKED Cc1c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cccc1C(F)(F)F 473806342 LTGAAWVYYLCUTE-UHFFFAOYSA-N 375.394 5.328 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cccc(OCC(C)C)c1 476092164 VTUGHXFQJCRQJY-UHFFFAOYSA-N 381.516 5.591 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(F)c(C(F)(F)F)cc1F)c1ccccc1 487406337 PXNJWENDKBSTJU-KRWDZBQOSA-N 382.332 5.149 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SC[C@@H](OC(C)C)c1ccccc1 488221006 LVPCYEUCAOSLCS-OAQYLSRUSA-N 393.556 5.313 30 20 GKED COc1cc(C#N)ccc1Oc1nc(C2CC2)nc2sc3c(c12)CCCC3 489273500 ALAHFYIAFMOMDS-UHFFFAOYSA-N 377.469 5.120 30 20 GKED COc1ccccc1C1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 501905316 JDHNEGURLMHEJQ-UHFFFAOYSA-N 384.435 5.029 30 20 GKED CCC[C@H]1C[C@@H](C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 502799525 RZULCDBMUSBWTH-UNMCSNQZSA-N 394.490 5.134 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Br)cc2nc[nH]c12 505123600 NXPURHZURNOGER-UHFFFAOYSA-N 398.304 5.430 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 509529568 VSRWICKCOXAHLT-INIZCTEOSA-N 381.545 5.871 30 20 GKED N#Cc1c(NC(=O)c2cccc(C(F)F)c2)sc2c1-c1ccccc1CC2 511785884 KXQWDQYHZOAPAI-UHFFFAOYSA-N 380.419 5.575 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c1 513239095 UHCBTAZWMGLWLR-KRWDZBQOSA-N 386.451 5.097 30 20 GKED Cc1ccnc2sc(C(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)c(C)c12 514903658 CSAWBCPURRWPQP-UHFFFAOYSA-N 390.493 5.161 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N(C)[C@@H](C)c1cc2ccccc2o1 517012016 UOLBMOMNTKVUBV-QFBILLFUSA-N 380.492 5.039 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 521328734 FWJGGAOMUMVGFV-HNNXBMFYSA-N 389.524 5.693 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C2(C#N)CCCCC2)cc1Cl)c1ccccc1 524422566 VCSCLBJDNYPSQQ-MRXNPFEDSA-N 381.907 5.926 30 20 GKED CC(C)c1csc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)n1 525113707 DHNQILHBXWUSNS-UHFFFAOYSA-N 377.469 5.377 30 20 GKED CC(C)OCCOCc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 536101746 BODYDGCCUWDICB-UHFFFAOYSA-N 392.543 5.444 30 20 GKED C=CCCOCCCCC(=O)N1Cc2cc(OC)ccc2C[C@@H]1C1CCCCC1 537188577 KTBHYJVSZJGTEY-XMMPIXPASA-N 399.575 5.292 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@@H](C)c3ccc(C#N)c(F)c3)c2)cc1 538510800 LYNLBQGNUQXUAS-KRWDZBQOSA-N 387.458 5.109 30 20 GKED N#CC1(CN[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C(F)(F)F)CC1 542124895 WXCKOBJGPADPCV-NSHDSACASA-N 390.249 5.221 30 20 GKED C[C@H](CC#N)NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 543586196 ZABVZWISRVVAJE-LLVKDONJSA-N 382.382 5.028 30 20 GKED N#Cc1ccc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1Cl 548607371 GGDWAEPCEOMCJJ-GOSISDBHSA-N 384.913 5.123 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CSCc1ccc(Cl)cc1 549199020 UEFNSQHCAGYQQQ-UHFFFAOYSA-N 389.307 5.379 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCSc2ccc(Br)cc21 552956737 NYEPXXUXUGDYMT-OALUTQOASA-N 399.357 5.525 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cscc3Br)cc2)ccn1 562081997 ASZIMAVRLQOHNG-UHFFFAOYSA-N 386.274 5.182 30 20 GKED N#CC1(CNC(=O)c2cc(C(F)(F)F)ccc2Sc2cccc(F)c2)CC1 562437041 NZMLKMUVIHSXIG-UHFFFAOYSA-N 394.393 5.029 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Cc1cncc2ccccc12 565678534 OJYCTXXXAVSLCH-IAGOWNOFSA-N 389.524 5.304 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(Cl)cc1F 571935326 JXFXPVVVULZDMN-UHFFFAOYSA-N 381.794 5.099 30 20 GKED Cc1csc(Sc2ccc(NC(=O)[C@@]3(C#N)CC34CCCC4)c(C)c2)n1 572580324 NFHBSDDRRUCLRT-FQEVSTJZSA-N 383.542 5.324 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 594496044 XYQWXMDLYRLXEL-ZSHCYNCHSA-N 392.387 5.487 30 20 GKED Cc1sc(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)nc1-c1ccco1 602097298 MLRRSTMRIYTSGW-ZDUSSCGKSA-N 397.525 5.287 30 20 GKED C=CCCO[C@@H](C)C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 607040551 XACNNAOPWBIYQW-PKOBYXMFSA-N 382.504 5.110 30 20 GKED COc1ccc([C@@H](NCc2cccc(OCCCC#N)c2)c2ccccc2)cc1 608860631 VYZFFMUQPFJICE-VWLOTQADSA-N 386.495 5.257 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(Cl)ccc1F 609061755 XQDREYJGPVCSEJ-UHFFFAOYSA-N 394.833 5.491 30 20 GKED Cc1cccc2c1CCCN2C(=O)c1cccc(COc2cccc(C#N)c2)c1 609648358 VQPLQFKGAMWLCO-UHFFFAOYSA-N 382.463 5.039 30 20 GKED Cc1ccc(CN(Cc2ccco2)c2nc(C(F)(F)F)ccc2C#N)s1 609669878 ZYBWTPVXBLSOOX-UHFFFAOYSA-N 377.391 5.142 30 20 GKED CCc1ncc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)s1 610231084 RKGZJRAVGWHXRQ-UHFFFAOYSA-N 381.888 5.078 30 20 GKED C[C@@](C#N)(NC(=O)c1sc(-c2ccccc2)nc1C(F)F)C1CCCCC1 611186273 IAAJBXBJYWDDJA-FQEVSTJZSA-N 389.471 5.340 30 20 GKED C[C@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 611803685 XQCGMJCYBMZITD-ROUUACIJSA-N 394.478 5.218 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ncc(C3CCCCC3)s2)c(Cl)c1 611899233 BVQJHNYRAWNYDG-UHFFFAOYSA-N 380.300 5.622 30 20 GKED Cc1c(Cl)cnc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1C#N 612070337 ZNRSDKNCTWEKGW-RKDXNWHRSA-N 385.739 5.237 30 20 GKED N#C[C@@H](C(=O)c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 613346478 KOVKISKZKWUJJI-AWEZNQCLSA-N 391.254 5.746 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@H]2CCc3cc(C#N)ccc32)c1C 618758521 ITYSPSAOHWTXPP-QFIPXVFZSA-N 391.515 5.381 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(Cl)cc1F 619126516 XETHHQVLFBRHFQ-UHFFFAOYSA-N 379.703 5.263 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1C[C@H]1c1ccc(F)cc1 619126573 ZEHHFAKUVKPCTO-KBPBESRZSA-N 385.323 5.099 30 20 GKED O=C(C[C@@]12CCCC[C@@H]1C2(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 619129968 VMOKSLXNKMQXNA-AAEUAGOBSA-N 395.334 5.372 30 20 GKED C=CCN(C(=O)[C@@H](C)Oc1cccc(C)c1)c1nc(-c2ccccc2)cs1 641900484 PQCCZRWNXYNWBH-QGZVFWFLSA-N 378.497 5.105 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cn1)c1ccccc1 647377290 ATSSZLBCIGTJJS-RDTXWAMCSA-N 389.480 5.046 30 20 GKED C#Cc1cccc(NC(=S)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1 726474042 SDHJPLDVHSDNOG-UHFFFAOYSA-N 395.915 5.039 30 20 GKED CC(C)(C)c1cc(CNCc2ccc(OCC#N)cc2)c(O)c(C(C)(C)C)c1 729685290 DWJUGEFELHPKDZ-UHFFFAOYSA-N 380.532 5.179 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@@H]2CCc3ccccc3C2)cc1 732536214 FGIQQIGXADFKLV-CLOONOSVSA-N 380.491 5.476 30 20 GKED CC[C@@H](OC(=O)CCC(=O)N(CCC#N)c1ccccc1)c1ccc(Cl)cc1 733492738 CWJADBLYOHRDTA-HXUWFJFHSA-N 398.890 5.061 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3cccc(C)c3)CCCCC2)c1 733772654 BZRPPHOPKNKQKY-JOCHJYFZSA-N 390.527 5.194 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)c1 733805250 PJDSJTHVYFYPOQ-FYYLOGMGSA-N 391.515 5.031 30 20 GKED Cc1cc(N(CCC#N)C(=O)CS[C@H](C)c2cccs2)ccc1Cl 737406579 XCHDZGAUPSWARL-CQSZACIVSA-N 378.950 5.451 30 20 GKED Cc1ccc(Cn2nc(C)c(/C=C/C(=O)c3ccc4c(c3)COC4)c2Cl)cc1 742437081 RFYSGSOOSLMBAO-MDZDMXLPSA-N 392.886 5.128 30 20 GKED COc1cc2c(cc1NC(=O)CSc1ccccc1C#N)oc1ccccc12 743454809 PUQQAIIBBGRMQQ-UHFFFAOYSA-N 388.448 5.197 30 20 GKED N#CCSCC(=O)OCc1ccc(Oc2cccc(Cl)c2Cl)cc1 744695562 MWBHURCUAPIQIY-UHFFFAOYSA-N 382.268 5.086 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=S)Nc3ccccc3C#N)c2)C1 745036304 YPTWPFGQFRQYNL-OXQOHEQNSA-N 379.529 5.462 30 20 GKED C[C@H](OC(=O)Cc1ccc(OCC#N)cc1)c1ccc(Cl)c(C(F)(F)F)c1 759592049 VTJOGYOKNFHWCG-LBPRGKRZSA-N 397.780 5.108 30 20 GKED CC(=O)N(c1nc(/C=C2/CCc3c(sc4ccccc34)C2=O)cs1)C1CC1 763102621 YVAIYRVLJOMLLO-RAXLEYEMSA-N 394.521 5.086 30 20 GKED N#Cc1cc(NC(=O)c2ccc(OC3CCCCC3)cc2)c(Cl)c([N+](=O)[O-])c1 764307565 STMIJLUOANEKQK-UHFFFAOYSA-N 399.834 5.084 30 20 GKED CC(=NNc1cc(C#N)cc(Cl)n1)c1ccc(SCC(F)(F)F)cc1 768376258 RXENPECWUODPKX-UHFFFAOYSA-N 384.814 5.097 30 20 GKED COCc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 772611254 CDWANYFYOCXUKN-KRWDZBQOSA-N 385.467 5.254 30 20 GKED CC1(C)C[C@@H](N(Cc2ccccc2)C(=S)Nc2ccccc2C#N)C(C)(C)O1 776737265 ZPHUFMNINGFGCL-HXUWFJFHSA-N 393.556 5.103 30 20 GKED Oc1nc(NN=C2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)nc2ccccc12 776778226 QUAVLFKHTGRTRP-CQSZACIVSA-N 386.377 5.090 30 20 GKED C=CC[C@@H](C(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1)c1ccccc1 777734711 DUZOHIOTELJWFY-OAQYLSRUSA-N 394.515 5.052 30 20 GKED C=CCC[C@@H](C(=O)O[C@@H](C)c1nnc(-c2ccc(C)cc2)o1)c1ccccc1 778550901 FCBMCNJXVPAAHR-FXAWDEMLSA-N 376.456 5.399 30 20 GKED N#C[C@@H](C(=O)C1(c2cccs2)CCCCC1)c1nc2cc(F)ccc2s1 779207213 YYXZIMZNDSMBAB-AWEZNQCLSA-N 384.501 5.575 30 20 GKED CC(C)n1cc2c(n1)[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)CCC2 780422114 GZEIVTVDEHQVSL-QAPCUYQASA-N 397.548 5.057 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2scnc2C2CC2)CC3)cc1 782329107 XYSXXDXDRVSPIJ-UVTDQMKNSA-N 394.521 5.365 30 20 GKED N#C[C@H](C(=O)c1cc2cccc(Cl)c2o1)c1nc(-c2ccncc2)cs1 783071083 DZYYUOOFEPKRQX-CYBMUJFWSA-N 379.828 5.095 30 20 GKED C=CC[C@H](NC(=O)N1CCC(C)(c2ccc(Cl)cc2)CC1)c1ccncc1 792091949 KYDCQVYFWWLBBZ-FQEVSTJZSA-N 383.923 5.116 30 20 GKED N#C[C@H](C(=O)CSc1cc(Cl)ccc1Cl)c1nccc2ccccc12 792095201 UXHQFEXOCARWBX-OAHLLOKOSA-N 387.291 5.510 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)C(F)(F)c1ccccc1F 800356870 YPBQILHGRHNWKM-UHFFFAOYSA-N 395.274 5.027 30 20 GKED COCCOCc1ccc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc1 809153701 CBHGBTDEXWGRIJ-WDZFZDKYSA-N 378.440 5.060 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)cc(F)c1O 815635960 MRUFQQHGQXSKFQ-SCLBCKFNSA-N 391.284 5.380 30 20 GKED C[C@H](OC(=O)CCCCC#N)c1cnc(-c2ccc(Br)cc2)s1 846931413 XIEUDVOQMNWCMD-LBPRGKRZSA-N 393.306 5.261 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCC(NC(=O)c2oc(C)cc2C)CC1 857816690 FPCIHSANOXKNRA-QGZVFWFLSA-N 390.568 5.004 30 20 GKED CCO[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 860475876 VUKGRHPPWKYFBD-DYVFJYSZSA-N 395.311 5.108 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(C#N)cc1 915350540 XTXUBVRNRSWMNB-HXOBKFHXSA-N 380.451 5.096 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)CCSc1ccc(C)cc1 916559710 FGNZVKYLDMSIEU-UHFFFAOYSA-N 375.877 5.007 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)n2)cc1 916974397 KICLGYHJDNUBLE-BZUAXINKSA-N 392.446 5.664 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1cnc(-c2ccccc2)nc1 917543290 HBSWTUVXRDBXKY-UHFFFAOYSA-N 378.479 5.180 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NN[C@@H](C)c2ccccc2)cs1 920383867 ZJOUDCOISHIZJX-AWEZNQCLSA-N 398.919 5.166 30 20 GKED Cc1cc(C=NNc2ccc(F)c(C(=O)O)c2)c(C)n1-c1ccc(Cl)cc1 1776061470 YAWWLODMTWDCQP-UHFFFAOYSA-N 385.826 5.031 30 20 GKED O=C(/C=C\c1cccc(C(=O)O)c1Cl)c1ccc(OCc2ccccc2)cc1 1776127463 UCGATXRNYWEWQG-KAMYIIQDSA-N 392.838 5.513 30 20 GKED CC(C)(C)c1cnc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)s1 1776277079 PQHLSYSCVQGZMK-DHZHZOJOSA-N 381.453 5.295 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cc1)C(=O)O 1776469811 NVGQIVPLCHOTHQ-PINLSGDHSA-N 386.403 5.334 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2)c1)C(=O)O 1776470793 IQQTVOWKRJWEMT-HMVFGEFZSA-N 378.449 5.163 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2)c1)C(=O)O 1776470795 IQQTVOWKRJWEMT-RZXPCSSPSA-N 378.449 5.163 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc(C(C)(C)C)cc2)o1 1776782933 POWSEOOOGORCQK-NRFANRHFSA-N 399.575 6.538 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(OCC(=O)O)c(Cl)c2)oc2ccccc12 1776956372 WLNHKBAJLHOEIN-VQHVLOKHSA-N 384.815 5.008 30 20 GKED Cc1ccc(-c2ncc(/C=C3\C[C@H](C(=O)O)c4ccccc4C3=O)s2)cc1C 1777431448 LLANPBWGSYODOP-QGRTWZNFSA-N 389.476 5.265 30 20 GKED N#CCOc1ccc(-c2cc(-c3ccccc3)c3cc([N+](=O)[O-])ccc3n2)cc1 15454017 ZCDABJOEXVUGPB-UHFFFAOYSA-N 381.391 5.379 30 20 GKED Cc1cccc(-c2nc(CC(=O)Nc3ccc(C(C)(C)C#N)cc3)cs2)c1 29151152 BTAWLHVAGRKLBE-UHFFFAOYSA-N 375.497 5.101 30 20 GKED CCCCOc1ccc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1OCC 29152302 YJFYUCFSNNSWLB-UHFFFAOYSA-N 380.488 5.318 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)no2)nnc1-c1cccc(C)c1 29830903 VPRQNAHGTWUTBS-UHFFFAOYSA-N 388.496 5.387 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1Cl 63388622 VXFLNMHDDNTWRZ-UHFFFAOYSA-N 380.231 5.122 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 66680346 GRKDFWXOVFAPPX-QZTJIDSGSA-N 393.556 5.771 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1ccccc1Cl 66954766 GBWAHNFKXIYYRR-HNAYVOBHSA-N 399.947 6.103 30 20 GKED CCCCc1noc([C@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)n1 102778584 GJJDVENWAQLEJU-INIZCTEOSA-N 376.460 5.036 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CC1 175213644 FLISFRMHNLUMHM-QGZVFWFLSA-N 389.499 5.126 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C[C@@H](C)O)c1ccccc1 191478731 XTSVJPKDZCXQLV-WIYYLYMNSA-N 380.532 5.215 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 191500864 XDWOIDNOWYJBEH-UHFFFAOYSA-N 393.487 5.643 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1 282462639 KIYMRJHBMCOZKF-MRXNPFEDSA-N 379.426 5.074 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 303427936 BCWSJCBVPBIVSD-UHFFFAOYSA-N 395.551 5.251 30 20 GKED CC[C@H](/N=C(/O)C1CCC(c2ccccc2)CC1)c1nnc2n1CCCCC2 329619654 MILGKXOHMMHULR-MHJFOBGBSA-N 380.536 5.386 30 20 GKED CC1CCN(c2cccc(NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)c2)CC1 425646556 BVGSEJAHMFHHCX-GOSISDBHSA-N 376.504 5.019 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N(CCC#N)CC2CC2)cc1 429209948 QVXJPDUJUXPRHQ-UHFFFAOYSA-N 379.460 5.035 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC[C@@H]4CCC[C@H]43)cc2Cl)c1 429428814 JPLQSOMJEYQYEX-FXAWDEMLSA-N 395.890 5.197 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2ccc(C#N)cc2Cl)cc1 430356284 MWRKOWCDYYHQHY-UHFFFAOYSA-N 381.888 5.133 30 20 GKED N#CCCC[C@@H](NC(=O)NCC1(c2ccccc2Cl)CC1)c1ccccc1 431457526 JEZJXORTAIGDOI-HXUWFJFHSA-N 381.907 5.106 30 20 GKED Cc1cccc([C@@H](C)SCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 437437223 DIRNKFUWRMSTPM-IAGOWNOFSA-N 384.570 5.680 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2cc(F)cc(F)c2)cc1F 438654115 ZPBSUJJLTDHUJA-UHFFFAOYSA-N 397.356 5.090 30 20 GKED N#CCSc1cccc(C(=O)N2CCCCC[C@H]2/C=C\c2ccccc2)c1 440873483 SXLJUYYITCXKEB-HJBMFWNLSA-N 376.525 5.400 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)Cc1nnc(-c2ccc(C#N)cc2)o1 441273253 BUIPXZRXPOPLHA-IBGZPJMESA-N 394.478 5.372 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1[C@@H](NCCCCC(C)(C)C#N)C(F)(F)F 444686268 CMAVCSDYKFGRQX-LJQANCHMSA-N 392.469 5.402 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)o1 446023982 LTLPEOXMKCKJDC-UHFFFAOYSA-N 380.787 5.052 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2sc3ccccc3c2Br)cc1 464570518 MAVAWYFGGAKXOR-HNNXBMFYSA-N 399.313 5.221 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(OC(F)F)cc1 468982763 MSWZYMQLNTZVDP-OAHLLOKOSA-N 399.441 5.044 30 20 GKED C[C@@H](C(=O)N[C@](C)(C#N)CCc1ccccc1)c1ccc(Cl)c(Cl)c1 471969537 JIMLIKFSLOVXQM-VLIAUNLRSA-N 375.299 5.128 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 476119483 QLELFYCCLGBMAZ-VQTJNVASSA-N 387.445 6.300 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c(F)cc1F 482538289 WXUZBRKIEFFELV-UHFFFAOYSA-N 396.368 5.115 30 20 GKED N#Cc1cc(F)ccc1CSc1nc2c(c(-c3ccco3)c1C#N)CCC2 483071856 PKYYOLANVWAWOI-UHFFFAOYSA-N 375.428 5.005 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@H](C#N)c1nccc2ccccc12 483234774 MVNFUYWDYUYPQX-LJQANCHMSA-N 383.476 5.081 30 20 GKED C=CCN(C(=O)CSc1ccccc1OC)c1nc(-c2ccccc2)cs1 484732535 SQBWMRUTANPNPB-UHFFFAOYSA-N 396.537 5.130 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Br)cc1Cl)c1ccccc1 487486624 PHINUEYBNLKMSC-KRWDZBQOSA-N 391.696 5.267 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 487545552 TYJUXKGAGIWYIB-IFXJQAMLSA-N 391.298 5.312 30 20 GKED Cc1cc(CN[C@@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)ccc1C#N 488287998 DKRNBGWGGSDISA-AWEZNQCLSA-N 381.932 5.803 30 20 GKED CC[C@H](c1ccc(F)cc1F)[S@@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488805633 MTOTWZSPAHBFIN-DXPJPUQTSA-N 398.343 5.662 30 20 GKED C=CCn1c(SCC(=O)c2ccc(Cl)s2)nnc1-c1ccccc1C 488906890 DBBPLLYPSJZVBG-UHFFFAOYSA-N 389.933 5.129 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1c(Cl)cccc1Cl 505481348 RJKAHIONQFGHBV-KWBADKCTSA-N 379.209 5.043 30 20 GKED N#C[C@@H](NC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)c1ccccc1F 505942513 IYKMHLMOZHDKKF-CTNGQTDRSA-N 394.446 5.179 30 20 GKED C[C@@H](NC(=O)CC(C)(C)C#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 508458799 SAUVUFBKUXQKLS-GFCCVEGCSA-N 380.435 5.551 30 20 GKED C=CCn1c(SCc2ccc(SC(C)C)cc2)nnc1-c1ccccn1 510253243 ZPQSYMGGPZMFCK-UHFFFAOYSA-N 382.558 5.319 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)C3(c4cc(F)cc(C#N)c4)CC3)cc2)o1 512709945 JQEIUNYFVRBYKA-UHFFFAOYSA-N 389.430 5.146 30 20 GKED N#Cc1ccsc1NC(=O)Cc1cccc(OCc2ccccc2Cl)c1 517301587 VMIDHLUHMMOFRE-UHFFFAOYSA-N 382.872 5.033 30 20 GKED Cc1c(Cl)cccc1NC(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1 517933810 HINJDONLSIGAOB-UHFFFAOYSA-N 391.858 5.363 30 20 GKED N#Cc1cccc(CNC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)c1 517981227 RPXSZUZERQIKTP-OAQYLSRUSA-N 392.911 5.361 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 524505852 OQIASCBPTOPWIQ-UHFFFAOYSA-N 386.451 5.097 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccccc1Oc1ccccc1 524680630 LBVRRVYQNOMJDM-FQEVSTJZSA-N 386.495 6.012 30 20 GKED CC(C)C[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 537517666 RBCSZQCYMJVRMQ-KNQAVFIVSA-N 393.487 5.066 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 539126504 BRWSOAHNPPWMHG-MRXNPFEDSA-N 386.455 5.191 30 20 GKED C[C@H]1C[C@H](C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@@H](C)O1 539841958 MGYCYGPLOXMCTR-MIFYACCESA-N 384.863 5.146 30 20 GKED Cc1cccc(-c2noc(CN[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)n2)c1 542941804 GQPBVTZBLBDURB-SFHVURJKSA-N 394.478 5.435 30 20 GKED Cc1nc(C2CC2)oc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 545355023 IPACSOYREQBJSJ-UHFFFAOYSA-N 393.830 5.430 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cnc4ccsc4c3)no2)c2ccccc21 545713316 AHQXVGDIEUNWEI-SREVYHEPSA-N 397.463 5.385 30 20 GKED Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NCc1ccc(F)c(C#N)c1Cl 556337351 YISKAJWBNOOSDW-HNNXBMFYSA-N 399.897 5.286 30 20 GKED Cc1oc(C(C)C)cc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 560544083 NWBMFWRUBFYPRQ-ZDUSSCGKSA-N 386.423 5.603 30 20 GKED N#CCCC[C@H](NCc1ccc(Br)cc1Cl)c1ccccc1 560562479 QVPGTIFOHBKSHE-SFHVURJKSA-N 377.713 5.627 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)sc12 564124034 CEHQEKCLDCTWJJ-OAHLLOKOSA-N 375.478 5.218 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC4(CCCC4)CC3)cc2)c1 566766186 ZOHWVAWVWRPUHG-UHFFFAOYSA-N 375.472 5.539 30 20 GKED C=C[C@](C)(CCOC)c1nc(-c2ccc(OC(C)C)cc2C(F)(F)F)no1 584258067 YQTOIQUWOUATHZ-GOSISDBHSA-N 384.398 5.023 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)/C=C\c1cccc(Cl)c1 588482818 UPSQPFPQDUBVPU-GAJOTYCWSA-N 392.933 5.147 30 20 GKED C=CCOc1ccc(CNCc2ccc(Oc3cccc(F)c3)nc2)cc1Cl 589647906 NRRZAVDJDOCIQV-UHFFFAOYSA-N 398.865 5.521 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cc(C(F)(F)F)ccc1F 590328260 UGMJORSUKPTKNY-UHFFFAOYSA-N 394.290 5.527 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc3cnncc23)cc1 590537019 XMGGFRWAQLUUCJ-UHFFFAOYSA-N 396.475 5.046 30 20 GKED COc1cc2ccccc2cc1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 602227650 PVYLRUMBLXZYKA-UHFFFAOYSA-N 399.475 5.020 30 20 GKED Cc1ncc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 604399901 XPDXNIUOBHDEJJ-UHFFFAOYSA-N 398.875 5.091 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCCC2)cc1)c1nc2ccccc2s1 605257628 WDEYZBWCWPGYCC-SFHVURJKSA-N 376.481 5.498 30 20 GKED CC(F)(F)CCC(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1 605478986 BUTSAMLREBPIEE-UHFFFAOYSA-N 379.247 5.020 30 20 GKED Cc1ccccc1C1(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 608870244 FPKPTHYDCSMZEY-UHFFFAOYSA-N 396.490 5.310 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H]3c3ccc(O)cc3)c2)cc1 609136005 ZXZTYBXTTYNSOL-QHCPKHFHSA-N 384.435 5.033 30 20 GKED CC(C)N(C(=O)c1cc2ccccc2n1CC#N)c1ccc(Cl)c(Cl)c1 609216836 UEZCTNCFDOJNCU-UHFFFAOYSA-N 386.282 5.527 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1CCc2ccc(F)cc21 609303765 FTRRZMFQLLUDJJ-FQEVSTJZSA-N 388.467 5.266 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 609414953 FFJBIGVEYLKGHY-HSZRJFAPSA-N 385.511 5.073 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3c3ccc(O)cc3)cc2)cc1 609548585 MAZUEWGWKMRWCG-DEOSSOPVSA-N 398.462 5.228 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@@H](c1ccc(Cl)cc1)c1cccs1 609669658 RBQGBIWXVZGGGQ-INIZCTEOSA-N 393.821 5.888 30 20 GKED Cc1csc(-c2cccc(C(=O)N(Cc3ccc(C#N)cc3)CC(C)C)c2)n1 610038760 DPDNZZJNPPRWFE-UHFFFAOYSA-N 389.524 5.289 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)n1cccc1 610234855 VOBWOMURLPOYFR-KRWDZBQOSA-N 377.875 5.198 30 20 GKED Cc1cc2sc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)nc2cc1F 619456592 QGBBOLQGESZDJB-UHFFFAOYSA-N 380.231 5.175 30 20 GKED C=CCOc1ccc(/C=C/C(=O)O[C@H](C)c2cnc3ccccc3c2)cc1OC 726333466 YFPBFSRDDVONEF-DPCFLFMUSA-N 389.451 5.126 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(N3CCCC3=O)cc2)ccc1Oc1cccnc1 732713962 JMYHVORNQKEMFB-WUXMJOGZSA-N 398.462 5.205 30 20 GKED CC[C@@H](NC(=S)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccs1 734376396 HTLRASAXRYCTNB-LJQANCHMSA-N 393.537 5.850 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1ccc(OC)c(OCCCC#N)c1 735978720 KAPZPCLZQQUFKJ-RMKNXTFCSA-N 399.874 5.326 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc2[nH]ccc2c1)c1nc2cc(Cl)ccc2s1 765917162 ZARJKBQGRQPSSW-ZSQCLPQSSA-N 377.856 5.321 30 20 GKED CCCc1ccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776153642 BRQGSWURKBKYKN-MHECFPHRSA-N 390.552 6.043 30 20 GKED C[C@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(C#N)c(F)c1 777221266 FVRGJPURWDHGHF-AWEZNQCLSA-N 381.451 5.168 30 20 GKED N#CC1(COC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)CCCC1 780529326 FFYLLMRWUKWPKI-UHFFFAOYSA-N 381.284 5.358 30 20 GKED Fc1ccc(Br)c(F)c1C=NOc1ccccc1C(F)(F)F 799885246 SBXVIELQJSHHPM-UHFFFAOYSA-N 380.110 5.159 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2ccc(C(F)(F)F)s2)C(=O)c2ccccc21 802707040 CVNHFQQJSYCKGD-ZHUYAKLQSA-N 380.387 5.084 30 20 GKED N#CCCCCCC(=O)O[C@H](c1cccc(Br)c1)C(F)(F)F 805892446 FBHMPJRQLDANJZ-CQSZACIVSA-N 378.188 5.070 30 20 GKED C#C[C@@H](NC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C)c1ccc(Cl)cc1 811961934 HPFTUTDIUNKPKB-RHSMWYFYSA-N 389.952 5.305 30 20 GKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)n1Cc1ccccc1 817318682 GJWRPDZGLBHYJO-XMMPIXPASA-N 385.511 5.318 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@@H]1c1ccccc1 841681586 IMTWPYBTEATCKJ-QFUCXCTJSA-N 377.488 5.168 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942365 XSDBKMNPASCRMS-MAUKXSAKSA-N 375.497 5.116 30 20 GKED O=C1/C(=C/c2ccc(C(F)F)nc2)CCC/C1=C\c1ccc(C(F)F)nc1 865214235 POJSJHWCIMNQNK-VOMDNODZSA-N 376.353 5.572 30 20 GKED CCCCCCCC(=O)N1CCc2[nH]c3ccc(Br)cc3c2C1 914500772 ZHMDDKHYPTUURJ-UHFFFAOYSA-N 377.326 5.176 30 20 GKED COc1ccc2oc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)c(C)c2c1 916074720 XUQCBKUOCQOLSO-UHFFFAOYSA-N 399.406 5.061 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1sc(-c2ccc(C)cc2)nc1C 1776086840 RMIHSWKDZCICDK-UHFFFAOYSA-N 379.485 5.270 30 20 GKED O=C(O)/C=C/c1ccc(/C=C\C(=O)c2ccc(OCc3ccccc3)cc2)cc1 1776127045 GJDGWJHNSFZNPP-VRNBXGKJSA-N 384.431 5.260 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl 1776149228 XQAWSNAVOFPSPO-HNNXBMFYSA-N 377.843 5.089 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C\C(=O)c3cncc(C(=O)O)c3)o2)cc1 1776271510 VOSHXCQKHSYSAM-NTMALXAHSA-N 375.424 5.233 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccc(F)cc2)o1 1776354576 NYXZKKKDROFJHN-CSKARUKUSA-N 394.398 5.467 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCCC(F)(F)F)cc2)CCC1 1786621057 IUVHMBSBZCAWSF-HNNXBMFYSA-N 396.453 5.065 30 20 GKED COc1cc(/C=C/C(=O)c2cccs2)ccc1OCc1ccc([N+](=O)[O-])cc1 7740236 BGWXXCNBPZKIHD-UXBLZVDNSA-N 395.436 5.140 30 20 GKED N#Cc1ccc(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c(F)c1 11627048 QLWPHHHBWWPOKY-UHFFFAOYSA-N 394.016 5.063 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2CCC[C@@H]2c2ccccc2)c1=S 14308362 JXYUAPLLAWMTPQ-HXUWFJFHSA-N 394.519 5.201 30 20 GKED COc1cc(/C=C/C(=O)c2ccccc2OCc2ccccc2)ccc1OCC#N 21274580 VECNAZWCISCARG-ACCUITESSA-N 399.446 5.073 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)CSCc1ccc(C#N)cc1 61869823 HYUBFVBMMDHZHE-CYBMUJFWSA-N 393.339 5.318 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)c(F)c1 66800809 PAGBMSQOAJSKRB-LLVKDONJSA-N 393.281 5.235 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1cccc(C(F)(F)F)c1 108354145 FWNSFVXSFYBEIV-ZDUSSCGKSA-N 393.434 5.008 30 20 GKED CC(C)c1noc([C@H](C)Nc2cc(C(F)(F)F)ccc2SCCC#N)n1 108408576 XFCSPUCQYGAKCW-NSHDSACASA-N 384.427 5.391 30 20 GKED C=C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 120030937 CEUSBZJEYOKMOY-FXAWDEMLSA-N 383.476 5.218 30 20 GKED Cc1nn(-c2ccc(F)cc2F)c(C)c1CNc1cccc(OCCCC#N)c1 122835585 CPUYBRAGLHZENC-UHFFFAOYSA-N 396.441 5.062 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)nc(-c2ccc(Cl)cc2)n1 131179737 MVNJHEMLQGEJIG-HNNXBMFYSA-N 396.903 5.175 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)cc1Cl 155534374 MUAHDIZBRWHEKI-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C 158284943 RRTIGJWLQVVBEK-UHFFFAOYSA-N 379.504 5.457 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H](C)c2cccc(C(F)(F)F)c2)n1 177765094 CKANHGGQAGLZCO-WFASDCNBSA-N 380.435 5.655 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 182168384 RYTXZYVADFVQDD-UHFFFAOYSA-N 384.435 5.295 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(CCc1ccccc1)Cc1ccccc1 184342785 SGJZOLRZTVTCJS-FQEVSTJZSA-N 399.494 5.254 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccnc1C(F)(F)F 188676089 PCIKGQGGXPZOHK-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)cc1F 191012906 NWYQBXGAUDVTSI-UHFFFAOYSA-N 393.491 5.148 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc2c(c1)CCN2C(C)=O 191455961 QDKYRASDHSAVSB-UHFFFAOYSA-N 377.488 5.092 30 20 GKED N#C[C@]1(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CC12CCCC2 295885899 PVRCCQNPCHSMQR-QFIPXVFZSA-N 393.874 5.005 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)CC1CCCCC1 303537859 IZCOCQQEBZHZGK-QGZVFWFLSA-N 377.488 5.599 30 20 GKED OC(=Nc1ccccc1N=C(O)N1CCCC1)[C@@H]1CCSc2ccccc21 329545360 GOXCVNDTEDJYNF-MRXNPFEDSA-N 381.501 5.196 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2C/N=C(/O)c2cn(C)nc2C2CCCCC2)cc1 329787885 ZBZQWYNWPDCYTC-OFNKIYASSA-N 395.547 5.249 30 20 GKED C[C@@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CCC2 410886167 FNXWXYCARIPEAY-WSTOHFRZSA-N 387.508 5.157 30 20 GKED N#CCCC[C@@H](NCc1cccc(Br)c1Cl)c1ccccc1 411756356 JZJQMKUPUSPATQ-QGZVFWFLSA-N 377.713 5.627 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2cccc3ccccc23)c(Cl)c1 426154112 RLWKSHJFQRDIKO-NRFANRHFSA-N 375.859 5.734 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccnc(Oc2ccccc2)c1 438504836 LGCUTGZNSKDJHR-UHFFFAOYSA-N 377.419 5.233 30 20 GKED N#CCC[C@H](NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F)c1ccccc1 440261759 UTJWCPZFMVZCNN-SFTDATJTSA-N 383.442 5.246 30 20 GKED Cc1ccc([C@H]2OCCC[C@@H]2CNC(=O)Nc2ccc(CC#N)cc2Cl)cc1 455706785 QRJBSRFXJADBOK-WIYYLYMNSA-N 397.906 5.004 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(CSC(C)C)c2C)cc1OC 461017124 ZDTXOLWWHCLJAA-UHFFFAOYSA-N 385.529 5.462 30 20 GKED Cc1noc(C)c1CNc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 462187387 IAAGWLCEWHILRT-UHFFFAOYSA-N 387.361 5.586 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc3cnccc23)cc1F 465154307 WPPCLYGBDQITHU-UHFFFAOYSA-N 383.382 5.290 30 20 GKED CCC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)cc1 469174877 FXSGSRXSRZVQSM-NRFANRHFSA-N 395.934 5.876 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(F)cc2)c(Br)c1 481089566 HPKMZZFDLOPVBJ-NRFANRHFSA-N 395.275 5.339 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1nc(-c2cccs2)no1 482054278 VWFOCXGYPNZOFJ-UHFFFAOYSA-N 396.516 5.314 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1)c1c[nH]c2ccccc12 486429679 GEDGBOKWPAWDAG-BUXKBTBVSA-N 386.282 5.349 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2ccccc2C(=O)N2CCCC2)cc1 486540500 ZXDBDOUBJOJSDJ-UHFFFAOYSA-N 381.479 5.073 30 20 GKED Cc1c(Br)ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c1F 487482074 FHBBWZFJYPPUAE-QGZVFWFLSA-N 389.268 5.062 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CC3(CCC3)[C@H]2c2ccccc2)o1 495335039 DNYDFKDIWHBLJE-HSZRJFAPSA-N 398.462 5.098 30 20 GKED Cc1ccc2oc(SCC(=O)N(CCC#N)c3ccc(Cl)c(C)c3)nc2c1 504579232 WFJAQECATLRADM-UHFFFAOYSA-N 399.903 5.137 30 20 GKED Cc1nc(NC(=O)c2cc3c(s2)-c2ccccc2CC3)sc1SCC#N 504753682 FVSBXWCIJNMNOU-UHFFFAOYSA-N 397.550 5.147 30 20 GKED N#CCCN(CC1CC1)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 505192663 AWUQBYVZQISRHJ-UHFFFAOYSA-N 389.474 5.059 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccsc2)s1)c1c(Cl)cccc1Cl 505508238 WGOJYABMQOZDJW-LBPRGKRZSA-N 394.308 5.173 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)cc1 506280222 AXHVTZISNICRGA-INIZCTEOSA-N 394.540 5.543 30 20 GKED CCc1cccc(CC)c1NC(=O)c1cccc(COc2ccccc2C#N)c1 513463365 LVULROHZCZGBLN-UHFFFAOYSA-N 384.479 5.514 30 20 GKED C=CCN(C(=O)C[C@@H]1CCO[C@H](C(C)C)C1)c1nc(-c2ccccc2)cs1 514152026 QTPNUONIUJLQLH-XLIONFOSSA-N 384.545 5.170 30 20 GKED CCC(CC)CN(CCC#N)C(=O)Cc1csc(-c2ccccc2Cl)n1 517873563 FDVKNQMVALLRSG-UHFFFAOYSA-N 389.952 5.184 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 519913437 YNXGSRKZHZZCCQ-LBPRGKRZSA-N 392.286 5.489 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 520148349 HVWMEQUHXILFCO-IBGZPJMESA-N 399.494 5.144 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 521327126 SMUDPDVMAJBYPN-ROUUACIJSA-N 396.556 5.919 30 20 GKED CC(C)(C)[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(F)cc1 521935889 JPEBODYZIWPLAP-QFIPXVFZSA-N 382.479 5.150 30 20 GKED N#Cc1ccc(CNC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)cc1 522943558 QRABMXMJQSRJGD-UHFFFAOYSA-N 398.359 5.313 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc(F)ccc1F 525417167 VPKGHMXVVDJOOK-DYVFJYSZSA-N 389.471 5.632 30 20 GKED CCc1cnc(CSCc2ccc(OCc3cccc(C#N)c3)c(OC)c2)o1 532114669 QHDHZUCUCQNNFO-UHFFFAOYSA-N 394.496 5.130 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H](c2cccnc2)C2CC2)cc1 535489112 QFJXRWFHPNKPRR-JOCHJYFZSA-N 384.439 5.018 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2cccc3ccccc23)n1 539773868 GBBPHEILMSXSFT-UHFFFAOYSA-N 383.476 5.107 30 20 GKED CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543943125 FFLFBCPGYDWTCK-QGZVFWFLSA-N 389.524 5.579 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(Oc4cccnc4)cc3)no2)cc1 546391836 XCRTURBPPFNXED-UHFFFAOYSA-N 386.436 5.088 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc2ncsc2c1 547943521 NKTFOWHJQWAWDD-KGLIPLIRSA-N 396.541 5.573 30 20 GKED N#CC1(c2ccccn2)CCN(CCSc2cc(Cl)ccc2Cl)CC1 548797950 BAJPRXQQAAKDAQ-UHFFFAOYSA-N 392.355 5.038 30 20 GKED CCC(CC)N(C(=O)c1ccc(Cl)c(C#N)c1)[C@H]1CCCc2cccnc21 549047709 ZWGJNQUSPUUJSC-FQEVSTJZSA-N 381.907 5.315 30 20 GKED CN(Cc1ccccc1)C1CCC(N[C@H](CCCC#N)c2ccccc2)CC1 551206989 YVURTYKVSRZSGU-DDJHWDJXSA-N 375.560 5.454 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCc1cccc(Cl)c1 553404011 KMIQJDGSRUJMKZ-HNNXBMFYSA-N 387.936 5.346 30 20 GKED CCc1nc2c(s1)[C@H](N(C)Cc1ccc(C#N)cc1C(F)(F)F)CCC2 555092278 NHKLQRRUCUIGSB-MRXNPFEDSA-N 379.451 5.105 30 20 GKED Cc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)nnn1-c1cccc(Cl)c1 556201131 PXKWSIMSOZAOEZ-KKSFZXQISA-N 393.922 5.315 30 20 GKED CC(C)Oc1ccc2ccccc2c1CN1CCC(C#N)(c2ccccn2)CC1 558621215 WMOUFFKMNSNQSW-UHFFFAOYSA-N 385.511 5.079 30 20 GKED O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1C(F)(F)F 563501963 VVIPXUOKALPYTB-UHFFFAOYSA-N 396.218 5.024 30 20 GKED CC(C)Oc1ccc(N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 564737188 XDKAFMNUXMGIAX-MRXNPFEDSA-N 383.517 5.536 30 20 GKED CC(F)(F)c1ccc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 571628168 FTRXVUJDCZWCKS-UHFFFAOYSA-N 379.366 5.110 30 20 GKED O=C(Nc1cccc(OCC(F)(F)F)c1)c1c(F)cc(C(F)(F)F)cc1F 578053163 FWPKWQJDBJHFMO-UHFFFAOYSA-N 399.237 5.177 30 20 GKED CCOc1ccc(-c2noc([C@@H]3CCCN3c3ccc(C#N)cc3)n2)cc1Cl 585731313 WTIFUPVAKYURIY-SFHVURJKSA-N 394.862 5.002 30 20 GKED COc1ccc(/C=C(/C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1F 588438340 JHALGWNYFVKOSW-MKRLJBPISA-N 384.476 5.128 30 20 GKED C=CCOc1ccc(CNCc2cccnc2Oc2cccc(F)c2)cc1Cl 589641183 WFIZDHBBNDAZKB-UHFFFAOYSA-N 398.865 5.521 30 20 GKED N#CCCC[C@@H](NCc1ccc(OCC(F)(F)F)c(F)c1)c1ccccc1 590068598 DSKKDUHSBJVYOW-GOSISDBHSA-N 380.385 5.292 30 20 GKED N#CC1(CC(=O)NCc2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1 590271734 CANPMUSDBNYUBU-UHFFFAOYSA-N 375.255 5.096 30 20 GKED Cc1ccc(-c2ncc(CN[C@H](CCCC#N)c3ccccc3)s2)cc1C 594521807 VDKBMJWNBWHZQF-JOCHJYFZSA-N 375.541 5.952 30 20 GKED C[C@@H](N[C@@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)c(F)c1 595077264 QFCZPSZMKSNGKA-ADLMAVQZSA-N 391.309 5.099 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(O[C@@H]2CC2(F)F)cc1)c1ccccc1 597115725 CAYDRCWTQGFFIC-RTBURBONSA-N 385.414 5.030 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(SCc3ccccc3)cc2)cc1 603872809 QDKNVLMOIWMSDA-UHFFFAOYSA-N 386.520 6.032 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)sc2c1CCCCCC2 603996117 AADMBMRIHCLEEH-CHWSQXEVSA-N 384.467 5.586 30 20 GKED N#C[C@@H](NC(=O)c1ccc(SCc2ccccc2)cc1)c1ccc(F)cc1 604074673 FZOVPNJFJPPDMU-OAQYLSRUSA-N 376.456 5.113 30 20 GKED CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604461852 HQAGDZZNXWXCQO-UHFFFAOYSA-N 389.430 5.544 30 20 GKED CCC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccn1 609207713 HBBJWONBSBHMST-JOCHJYFZSA-N 386.455 5.408 30 20 GKED Cc1ccc(-c2ccc(C(=O)N(C)c3ccc(C#N)cc3F)c(F)c2)cc1C 609327064 LSDHCOVPZONGHF-UHFFFAOYSA-N 376.406 5.397 30 20 GKED CCC[C@H](NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 609387657 AYLOPPACDRZNLO-NSHGMRRFSA-N 395.572 5.396 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 609462410 DATZZVFEDMKRNC-XHDPSFHLSA-N 398.837 5.220 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 609501907 JDUFWIRZSRNNKF-CABCVRRESA-N 389.282 5.394 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 609773506 HXSCAMVKQXFSNG-GOSISDBHSA-N 385.467 5.328 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCc2ccccc2F)cc1)c1cccc(C#N)c1 610323092 YYCBRKXGTJINCA-INIZCTEOSA-N 389.430 5.159 30 20 GKED N#CCc1ccc(C(=O)N[C@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 611153587 AKHAOEZHWOTMIU-NRFANRHFSA-N 378.834 5.065 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)cc2Cl)nnc1-c1cccnc1 614510252 YIPALFWJGIHYKV-GFCCVEGCSA-N 391.327 5.686 30 20 GKED Cn1c(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc2c(F)cccc21 684888139 FVVDCZIGPVGKQV-MYJAWHEDSA-N 383.311 5.034 30 20 GKED CCCCCCCCC(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl 726924064 FACZXYTXSAKCQW-UHFFFAOYSA-N 378.944 5.655 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(C)n([C@@H](C)c3ccccc3)c2C)cc1 726940779 RUKBLCVQYIDPAD-FQEVSTJZSA-N 385.511 5.583 30 20 GKED CC(C)c1ccc(CSc2nn(CN(C)[C@H](C)CC#N)c(=S)s2)cc1 728902951 YYYAPIHUFUNPIU-CQSZACIVSA-N 392.619 5.281 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)NCc1ccc(OCC#N)cc1 729574970 CMTLBRPUJTXQJI-UHFFFAOYSA-N 389.908 5.065 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731536670 JNPIXPPKTLKKGL-HXOBKFHXSA-N 385.467 5.273 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N/CCc1nc(-c2ccc(Cl)cc2)no1 731562441 ZEPOZCWLBQWMHP-ZVBGSRNCSA-N 396.661 5.064 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@@H](C)c2c(Cl)cccc2Cl)c1 733775162 RFPBVAMSNSHBDU-ZFWWWQNUSA-N 391.298 5.094 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2ncnc3sc4c(c23)CC[C@H](C)C4)c1 733793159 KSSQTEHIJAEVDX-GOEBONIOSA-N 392.528 5.109 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 738896335 OCBOJWCOCNWBOJ-NBGIEHNGSA-N 397.522 5.745 30 20 GKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 744073924 IRICFSOXSVACDL-DNVCBOLYSA-N 396.462 5.704 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3c[nH]c4cc(C)ccc34)n2)cc1 745947681 IXYGJGBVSHCPMW-FQEVSTJZSA-N 399.519 5.717 30 20 GKED CC(C)(C)n1cc(C#N)c(NC(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)n1 746438935 HJBRQKOJZFQWAU-PKNBQFBNSA-N 394.475 5.029 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2ncc(-c3ccccc3Br)o2)s1 749005631 MLDSVHDCWYTTRT-AUWJEWJLSA-N 391.677 5.774 30 20 GKED C=CC[C@@H](NC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccncc1 750002269 DMCZFDKDQOJCFK-KBXCAEBGSA-N 397.931 5.197 30 20 GKED Clc1ccc(CSc2nncn2N=Cc2cc(Cl)ccc2Cl)cc1 753695704 REARXJHCWBTLAE-UHFFFAOYSA-N 397.718 5.413 30 20 GKED CC(C)[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1 756516214 GCNCHUWDHSUALS-MAUKXSAKSA-N 385.389 5.187 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CCCCO1 758536807 XZFXGYYJAZIIRE-FGZHOGPDSA-N 391.515 5.059 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 759677246 DGFBIZLUQZIKKF-KRWDZBQOSA-N 380.488 5.640 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2ccccc2Cl)s1 772958885 MBDRXLBTHSZDES-OAHLLOKOSA-N 382.916 5.822 30 20 GKED N#C[C@@H](Cc1ccc(F)cc1F)OC(=O)c1occc1CSc1ccccc1 774343864 MFTZTDDCAHXFHL-QGZVFWFLSA-N 399.418 5.142 30 20 GKED C=CCC[C@H](C(=O)OCc1ccccc1NC(=O)c1ccco1)c1ccccc1 778654218 IYDJTEYWWDLNSX-FQEVSTJZSA-N 389.451 5.325 30 20 GKED C=C[C@@](C)(CC)C(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 785761054 HGZGKVWVXXLJOG-FVMDXXJSSA-N 378.683 5.119 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(Br)cc1 792091596 LTRQMQOJUPTVKX-IFXJQAMLSA-N 393.284 5.367 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)c2ccc(C3SCCCS3)cc2)cc1 813377250 IFYJPAZQMFMFEG-HXUWFJFHSA-N 396.581 5.455 30 20 GKED Cc1cccc2cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c(Cl)nc12 813400282 ZDWDVZYYVYQHFO-CYBMUJFWSA-N 395.915 5.701 30 20 GKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)cc(C)c1OCc1ccccn1 814304488 MNPKUPPWYAIAGP-RUZDIDTESA-N 399.538 5.802 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N[C@@H](CCCC#N)c3ccccc3)sc21 817320046 WHSNZYBBSLFXCH-IBGZPJMESA-N 387.508 5.558 30 20 GKED CCCCCCCC(=O)N(Cc1nnc(-c2ccccc2Cl)o1)C(C)C 832232573 KYXNVEBYHOKKNX-UHFFFAOYSA-N 377.916 5.488 30 20 GKED CCOc1c(Cl)cc(C=NOCc2cccc(Br)c2)cc1OC 836737775 WXZZHZCMEJJKKO-UHFFFAOYSA-N 398.684 5.061 30 20 GKED N#CCCCCC(=O)O[C@H](CC(F)(F)F)c1ccc(Br)cc1 846870131 YFLZTWLPNVZVMY-CYBMUJFWSA-N 378.188 5.070 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3CCC(F)(F)CC3)n2)cc1 860503089 UANUJCVENNOTKX-INIZCTEOSA-N 385.439 5.074 30 20 GKED CCCOc1ccc(C(C)=NNc2c(F)c(F)nc(F)c2F)cc1OCCC 916325364 JZZPHIHGAXYTBK-UHFFFAOYSA-N 399.388 5.052 30 20 GKED O=C(/C=C/c1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2[N+](=O)[O-])s1 917605535 WKCJQIZQWIWIDB-MDZDMXLPSA-N 380.381 5.128 30 20 GKED CCC(=NNc1ccc2ccccc2n1)c1ccc(OCCCCC(=O)O)cc1 1776018893 JQWUOXPYZMXBLF-UHFFFAOYSA-N 391.471 5.095 30 20 GKED Cc1ccc(-n2c(C)cc(C=NNc3ccc(Cl)c(C(=O)O)c3)c2C)cc1 1776033272 WNDHYNOPPJSUQB-UHFFFAOYSA-N 381.863 5.200 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(OCc3ccc(Cl)cc3)cc2)ccc1F 1776061599 FCNIPBFGGVSHOS-UHFFFAOYSA-N 398.821 5.202 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2cc(-c3cccc(F)c3F)ccc2F)C1 1776160879 WSWLXZZLLCEXDP-QFIPXVFZSA-N 389.417 5.014 30 20 GKED N#CCSc1ccccc1NC(=O)CSc1nc(-c2ccccc2)cs1 5971937 LXPHOSLQNLEOQW-UHFFFAOYSA-N 397.550 5.157 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)Nc2ccccc2)cc1 10170636 VKTLSNNBTQHQJC-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1ccc(SCc2cccc(C(=O)Nc3sccc3C#N)c2)c(C)c1 22918999 HQKJIQHQLKGFNJ-UHFFFAOYSA-N 378.522 5.781 30 20 GKED Cc1nc(C(=O)Nc2sc3c(c2C#N)CCCC3)c(-c2ccccc2)s1 40326490 KBSLJCBTQBVYHO-UHFFFAOYSA-N 379.510 5.183 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccc(F)cc2)o1)c1nc2ccccc2s1 46442130 JBAINEXQXKPQFJ-INIZCTEOSA-N 392.411 5.097 30 20 GKED Cc1c(C#N)c(NC(=O)CCSCC2CCCCC2)n(Cc2ccco2)c1C 58486905 WUIANGBBQUSOLL-UHFFFAOYSA-N 399.560 5.260 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC(F)(F)F)cc1 66802086 LKPJKQGGMQDAIO-LBPRGKRZSA-N 380.391 5.232 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3[nH]ccc3c2)cc1 112863027 COENCRCHFWREPB-UHFFFAOYSA-N 383.476 5.584 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(N3CCCCC3)cc2)c1 113522750 BFHHGWOMPMVRPT-UHFFFAOYSA-N 378.476 5.003 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 121231220 VCKSBNHAXUXYPA-UHFFFAOYSA-N 386.455 5.050 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2cccc(-c3cccnc3)c2)SC1=S 127845741 JQKVHELYZZTGHU-NDENLUEZSA-N 399.500 5.026 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H]1C[C@@H]1c1sccc1C 161422830 MMNLMNWVAVKMRL-ROUUACIJSA-N 389.480 5.166 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)c(C)n1-c1cccc(Cl)c1 195652734 YOVSZHZVOOXWNV-SFHVURJKSA-N 388.858 5.114 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC/C=C\c3ccccc3)n2)cc1 255895437 WHVZNIZXTJIRSG-FMSOUQGNSA-N 388.492 5.489 30 20 GKED C[C@H](Nc1ccc2cc(C#N)ccc2n1)c1cccc(NC(=O)c2ccccc2)c1 301992298 YTDOUJBGFNLXSV-KRWDZBQOSA-N 392.462 5.532 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2cccc(Br)c2)cc1 303097875 BEDQFRVVNGKNKN-UHFFFAOYSA-N 385.305 5.167 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)cc1 303888545 PGWDTTIFTOOZJP-IRXDYDNUSA-N 388.389 5.129 30 20 GKED Cc1cccc([C@H](/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)C(F)(F)F)c1 330034134 WDZZLTGCRNUSMN-PREGVCBESA-N 382.426 5.480 30 20 GKED Cc1cc(C(=O)Nc2scc(C(C)(C)C)c2C#N)c(Br)s1 410929687 NYJMOKDXALQDGC-UHFFFAOYSA-N 383.336 5.302 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1cccc(F)c1C#N 428321957 GAIGRXVDUGMSFD-LBPRGKRZSA-N 385.895 5.634 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431931053 MBDWECSXBNUELD-XMSQKQJNSA-N 395.572 5.982 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)NCC1(CC#N)CC1 432433558 WIVWCPDUOATXQJ-UHFFFAOYSA-N 394.475 5.226 30 20 GKED Fc1ccc(F)c([C@H](NCc2cccc(OCC(F)(F)F)c2)C(F)F)c1 434683067 YVTGGVZHSKDRHI-HNNXBMFYSA-N 381.291 5.002 30 20 GKED CCSc1ccc(Cl)cc1NCc1cn(CCC#N)nc1-c1ccncc1 435124337 OFXNHADVYFQUHZ-UHFFFAOYSA-N 397.935 5.236 30 20 GKED C=CCn1c(SCc2nc(C3CCCCC3)cs2)nnc1-c1ccccn1 435702096 XLKWHGQGRBWEMI-UHFFFAOYSA-N 397.573 5.323 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(N[C@@H](C(N)=O)c2ccc(C#N)cc2)cc1 437152178 SEVQJYGFKIYCOP-KSFYIVLOSA-N 387.508 5.050 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(OC(F)F)cc2)cc1F 437463046 PVISFQNNADEWET-UHFFFAOYSA-N 398.340 5.343 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 439363347 FSWOLBJZYKASEU-QHCPKHFHSA-N 396.450 5.517 30 20 GKED C[C@@H](c1ccccc1)N(CC(=O)Nc1ccccc1SCC#N)CC1CCC1 444223126 GYBNFCANNHBSRH-SFHVURJKSA-N 393.556 5.104 30 20 GKED N#CCc1ccc(NC(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)c(Cl)c1 452643355 JGEAXIDQGLFVTF-KBPBESRZSA-N 394.780 5.047 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@H](CSc2ccccc2)C1)c1ccccc1 458799907 KJAZYSVTXAONCN-SIKLNZKXSA-N 393.556 5.245 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(Cc2ccc(F)cc2)CC1)c1ccccc1 458808754 ZNEIMWAUEPXPCN-QHCPKHFHSA-N 393.506 5.225 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)N[C@@H](CCCC#N)c1ccccc1 458846676 RETLYLHSTXRCEQ-VKGYTVAMSA-N 375.516 5.398 30 20 GKED C=CCOc1ccc(CNC[C@@H]2CCCN(C)[C@@H]2c2cccs2)cc1Cl 462729517 QYURJWHCLWQQPF-UWJYYQICSA-N 390.980 5.139 30 20 GKED N#Cc1ccc(NC(=O)c2sc3ccccc3c2Br)c(Cl)c1 464129547 FTRBSAQOXAUTSJ-UHFFFAOYSA-N 391.677 5.441 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 464942222 IIGQNVMWSLEQPG-MHTWAQMVSA-N 398.428 5.107 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474690330 CXQDBLMWABKIJO-WMLDXEAASA-N 375.299 5.600 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 475640272 DASMGNHNHNLICR-UHFFFAOYSA-N 381.435 5.404 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@H]1C1CCC1 480256838 RXQFOTHLKRJFPV-QFIPXVFZSA-N 375.472 5.455 30 20 GKED CC[C@H](C)C(=O)Nc1cccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)c1 481663615 BUTILYYPBQVJDT-GAJHUEQPSA-N 375.516 5.100 30 20 GKED CCC[C@H](NC(=O)CSc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 483671227 SNRAKGNWOVZGIG-SFHVURJKSA-N 392.446 5.327 30 20 GKED C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487518895 YFQLJZOFIGSTHV-LIRRHRJNSA-N 391.298 5.312 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1csc(Cc2ccccc2)n1 488763399 INONVJCVANJEIV-UHFFFAOYSA-N 391.443 5.312 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC2CC(F)(F)C2)cc1Cl 490861211 WCIQBXWFQYNZOY-QGZVFWFLSA-N 389.833 5.162 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 498851798 FUWCLPSMCIGOSC-GOSISDBHSA-N 395.572 6.201 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)CCCOc1ccc(Cl)cc1Cl 500613328 CJSFNLFRCKBYQG-UHFFFAOYSA-N 393.270 5.061 30 20 GKED Cc1cccc(O[C@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 500771499 OHTKVHMHDANHAU-GOSISDBHSA-N 386.451 5.373 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccccc3Cc3ccccc3)CC2)cc1 503647464 ZPXKOYBFBXVXQV-UHFFFAOYSA-N 393.490 5.470 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1c(C)nn(CC(F)(F)F)c1C 505016628 KBGUOZPIZXHSAR-ZDUSSCGKSA-N 394.441 5.064 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H](C)c1ccccc1 510856926 MLHFCUDGMVOIFH-GOSISDBHSA-N 385.467 5.884 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H](c2cccs2)C2CC2)cc1 512801382 FMAHJNFMHBWBQS-NRFANRHFSA-N 389.480 5.685 30 20 GKED Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1OC(F)F 513332309 ZKQYMANDDZXKTM-UHFFFAOYSA-N 378.378 5.387 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cnc(-c4ccccc4)s3)cc2)ccn1 514832795 RHWQSNJZEFLHJR-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#C[C@H](C(=O)c1csc(C2CCCCC2)n1)c1ccc(C(F)(F)F)cn1 515375817 JOTFWRVFPBJAID-ZDUSSCGKSA-N 379.407 5.095 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 517529585 HHLATZRIKMUDQR-OAHLLOKOSA-N 377.469 5.165 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H]2C[C@H]2c2cccc3ccccc23)cc1 519456281 FUFCOCAWZGXTEI-ZEQRLZLVSA-N 384.479 5.289 30 20 GKED COc1ccccc1[C@@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 521742295 RJYQRURCRACLGA-NRFANRHFSA-N 391.858 5.131 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c2)c1 522086446 CKVHHKRINHUZSD-UHFFFAOYSA-N 385.467 5.110 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)CC1 523822132 HWGUKEDDKWVUOX-SFHVURJKSA-N 380.488 5.019 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 529656030 ROEGIKMGZUOYRK-IRXDYDNUSA-N 378.422 5.018 30 20 GKED CCOc1cc(Cl)ccc1NCc1cn(CCC#N)nc1-c1ccccc1 535834585 JAQOMECTJFQNMZ-UHFFFAOYSA-N 380.879 5.128 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Sc3ccc(C#N)c(C(F)(F)F)c3)o2)cc1 541074329 TUEBJUJAJCNZTM-GFCCVEGCSA-N 389.402 5.789 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccc(Cl)s2)nc2ccccc12)c1ccccn1 543733326 WDCLXACFCFDIGX-OAHLLOKOSA-N 389.867 5.502 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 544272779 LSGSGESUUGXXPB-UHFFFAOYSA-N 391.515 5.378 30 20 GKED C=CCCO[C@H](C)c1nc(-c2cc(Br)cc(C(F)(F)F)c2)no1 546487258 IUROFQZDPWTLRM-SECBINFHSA-N 391.187 5.172 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc2ncsc2c1 547943523 NKTFOWHJQWAWDD-ZIAGYGMSSA-N 396.541 5.573 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1csc(-c3ccc(C(F)(F)F)cc3)n1)CC2 554982102 IIDDGVCUIHMKCK-LJQANCHMSA-N 399.441 5.478 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)[C@@H](C)c1ccc(C#N)cc1 558764301 CYNLDSQFSGRFGC-MSOLQXFVSA-N 376.500 5.110 30 20 GKED N#Cc1ccnc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c1Cl 561101520 XWTKKDBERYMXIN-UHFFFAOYSA-N 389.311 5.254 30 20 GKED N#CCCCn1cc(C(=O)Nc2cnc(-c3ccccc3)s2)c2ccccc21 562538932 HAKGXEAARJSXEX-UHFFFAOYSA-N 386.480 5.321 30 20 GKED COc1ccc2c(c1)[C@H](N(Cc1ccccc1)C(=O)CCCCCC#N)CCO2 588755453 JAXBAXRHWSTOTM-JOCHJYFZSA-N 392.499 5.022 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 590829312 CJSYHXPTMFPALH-MSOLQXFVSA-N 375.394 5.024 30 20 GKED CSCCCC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 592679175 KJSUSRJZNFLCNP-UHFFFAOYSA-N 377.325 5.058 30 20 GKED C[C@@H](NCc1ccc(C2(C#N)CC2)cc1)c1cccc(OCc2ccccn2)c1 594926712 VQABGQHUKQYZRC-LJQANCHMSA-N 383.495 5.067 30 20 GKED N#CC1(c2ccc([C@@H]3Nc4ccccc4C(=O)N3CCc3ccccc3)cc2)CC1 602758147 IYMCJFAAIUAWQJ-XMMPIXPASA-N 393.490 5.051 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc(OCCCC#N)c1 603972473 UVWPMQXJTBCDAM-QGZVFWFLSA-N 380.488 5.073 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCCC2)cc1)c1ccc(C(F)(F)F)cn1 605257486 GBDQPPKUWNMDIX-GOSISDBHSA-N 388.389 5.302 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3sccc3OC(F)F)cc2)cc1 609167705 RDZTZCLTRDFCFK-UHFFFAOYSA-N 386.379 5.266 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1c[nH]c2ccc(F)cc12 609642445 WRKRXSGSHPESLK-UHFFFAOYSA-N 375.428 5.088 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N[C@@H](C)c3cccc(C#N)c3)oc2c1 610363221 UZFOEKRDFSWZKF-INIZCTEOSA-N 396.446 5.471 30 20 GKED C=CCn1c(S[C@H](C)c2c(F)cccc2F)nnc1-c1ccccc1OC 613932045 AREVETFOLMSLRF-CYBMUJFWSA-N 387.455 5.271 30 20 GKED C=CCC1(NC(=O)c2ccc(C)c(NC(=O)c3ccccc3F)c2)CCCC1 619112943 ASESOKOARDEXLY-UHFFFAOYSA-N 380.463 5.005 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CC[C@H](c3cccc(F)c3)C2)c(Cl)c1 619457101 RCLXZMCWAWETCM-ZFWWWQNUSA-N 377.246 5.070 30 20 GKED C[C@@H](CC(=O)NCc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 619763229 XSDWMBXCZGHFRQ-LBPRGKRZSA-N 380.797 5.040 30 20 GKED Fc1ccc(/C=C/CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 671706741 OVKJSHMDNQRMJI-NUYITTKVSA-N 387.314 5.477 30 20 GKED N#Cc1ccccc1COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 725994833 NKBLSSCZHCDSPN-UHFFFAOYSA-N 388.370 5.058 30 20 GKED CC[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1OC(F)F 726458244 WWDIEFVKAZPTOU-HNNXBMFYSA-N 395.862 5.251 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 726757910 QKHFXXUPMNKKIW-YPNIWSFNSA-N 384.401 5.344 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(SC(C)(C)C)cc1 726848837 ZZNPDUGMJAPZCY-UHFFFAOYSA-N 379.529 5.669 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(-c2nnc3n2CCCC3)cc1 731320241 XJFLXSBYPUKWEA-UHFFFAOYSA-N 387.270 5.044 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc(F)cc3C)o2)cc(OC)c1OC 734303567 UYZZYHOJEIJTSJ-TWGQIWQCSA-N 396.414 5.316 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccncc1 734661504 KOLLRVHTOSTAKP-YADHBBJMSA-N 391.902 5.441 30 20 GKED Cc1ccc([C@@H](NCc2ccc(OCC#N)cc2)c2ccccc2Cl)cc1 742260492 LMMYSSDZGNZUJI-HSZRJFAPSA-N 376.887 5.430 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(Br)cc2Cl)c1 742371106 HTLUADCJQZQJPR-INIZCTEOSA-N 393.712 5.073 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)N[C@H](C)c2csc3ccccc23)cc1 743474402 HWCJVZVUKOCNCH-MSOLQXFVSA-N 391.540 5.196 30 20 GKED O=C(/C=C/c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(-c2ccncc2)cc1 745989898 FXONTHZECBWHOL-FNORWQNLSA-N 396.349 5.154 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 747124098 RFWQCUFJEINRRT-IBGZPJMESA-N 389.524 5.657 30 20 GKED CSc1nc2ccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)cc2s1 748499923 CZMHQHBUVVDFOR-HNNXBMFYSA-N 382.514 5.185 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)cc1)c1ccc(SC2CCCC2)cc1 750904250 HFLVZLWSVIHJGV-AUWJEWJLSA-N 375.497 5.198 30 20 GKED CC1(C)CCC(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC1 752484353 SRUOLIQHUDMEEG-GOSISDBHSA-N 377.513 5.465 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccc(Oc2ccccc2Cl)cc1 760801147 OZCBCXJCGGPRAC-UHFFFAOYSA-N 396.805 5.426 30 20 GKED O=C(/C=C\c1nc2ccc(F)cc2s1)c1cc(Br)ccc1F 761480156 OZPLFUJBYJZWFR-WAYWQWQTSA-N 380.213 5.233 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccccc2)c2ccncc2)cc1 765337750 UAFZTKKUUNLVRE-FDDCHVKYSA-N 378.903 5.653 30 20 GKED N#CC(CCOC(=O)c1c(F)ccc(F)c1F)(c1ccccc1)c1ccccc1 772738764 ZPCWUCSEFRXEDB-UHFFFAOYSA-N 395.380 5.161 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1 780670110 JRHQAJQCGGPHEA-RBUKOAKNSA-N 399.494 5.320 30 20 GKED CC(C)(SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 783631646 GLZDPGSQKSFBSJ-SFHVURJKSA-N 392.549 5.655 30 20 GKED Cc1noc(C2CC2)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 783905839 BQVUOEUAYXWMON-SFHVURJKSA-N 391.858 5.422 30 20 GKED C=C[C@](C)(CCOC)COC(=O)c1sc2nc(C(F)(F)F)ccc2c1C 784635529 SSTQJNIZCGDCBG-QGZVFWFLSA-N 387.423 5.009 30 20 GKED N#Cc1cccc(COc2ccc(NCc3scnc3C3CC3)cc2F)c1 787266839 HLXXVFGNOBMNFO-UHFFFAOYSA-N 379.460 5.222 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3ccc(C#N)cc3Cl)c(Cl)nc21 788359730 CWMNMHHINSSRFT-XQRVVYSFSA-N 385.254 5.087 30 20 GKED N#CC[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 796653063 XLIAPCUJOJTBOM-HOCLYGCPSA-N 379.872 5.214 30 20 GKED C/C(C=Nn1cnc2sc(C)c(C)c2c1=O)=C/c1ccccc1C(F)(F)F 799866966 BNVUPXXJSYDJMX-KBNJCJCJSA-N 391.418 5.031 30 20 GKED Cc1cc(Cl)nc(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 800535572 DHOALJNHTUFGJD-UHFFFAOYSA-N 392.846 5.029 30 20 GKED Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)OCCCSCC#N 805335655 WQCSMONVTCAFAY-UHFFFAOYSA-N 376.481 5.014 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813218582 XVLBDCMKCPCSRO-CRAIPNDOSA-N 396.796 5.034 30 20 GKED C=C(CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl)c1ccccc1 813625727 JOSCPNCRPKBKFL-UHFFFAOYSA-N 396.899 5.097 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)(F)F)o1 814115420 FLOFHSDCPZWIMA-UHFFFAOYSA-N 394.296 5.077 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCCOC2=O)cc1 815636664 YQMCLRBVEBYENX-XMSQKQJNSA-N 377.488 5.119 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@H](C#N)c3nc(C4CC4)cs3)ccc2c1 842941415 ASWVUEZVDNBVPR-DJJJIMSYSA-N 376.481 5.162 30 20 GKED N#Cc1c(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)[nH]c2ccccc12 904506187 WKDSPHKRSFBPTA-UHFFFAOYSA-N 397.369 5.083 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CSCc3cccc(C)c3)n2)cc1 916973976 BQEPMWJSBMNERF-LJQANCHMSA-N 392.549 5.537 30 20 GKED O=C(/C=C/c1csc([N+](=O)[O-])c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 917144110 ZEDZZZKSMUVTQU-AATRIKPKSA-N 386.410 5.189 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2csc(-c3ccccn3)n2)cc1 917560587 RXQTUNYLRMONCQ-JXMROGBWSA-N 382.872 5.233 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccccn2)cc1 919904975 YGDINAKISADPSZ-FYYLOGMGSA-N 382.467 5.106 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCSc1ccc(Cl)cc1 920102540 URQSXAFUMLFVGD-KRWDZBQOSA-N 396.899 5.204 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1oc2c(C)ccc(C)c2c1C 920104457 TWZSEAFTGOESLS-QGZVFWFLSA-N 384.435 5.353 30 20 GKED CC(C)CCSCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 920112750 JVWNMOPFJBUSDM-GFCCVEGCSA-N 386.464 5.271 30 20 GKED CC(C)(C)OCc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 932536892 KDNDJEGNONEYEI-HXUWFJFHSA-N 379.504 5.558 30 20 GKED Cc1ccc(C(=O)/C=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c(C)c1 1776133408 WGZVMSZBSURWBT-SWDTZWKESA-N 386.447 5.404 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(Cc3ccccc3)cc2)c1)C(=O)O 1776471129 BEQVBYMEPSCOKS-OUFNUQFJSA-N 386.447 5.025 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(C(=O)O)c(O)c1 1777487708 HNFOSPDTHFVZEI-OQFOIZHKSA-N 399.855 5.072 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@H](C)c3ccc(C#N)cc3)sc2C)cc1 31436968 PSGBKKZBKHSIOM-CQSZACIVSA-N 376.481 5.095 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(Cl)cc3)n2)nnc1C1CC1 39968188 ULEHNTRXJFWBIG-UHFFFAOYSA-N 388.949 5.411 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 47052230 WTDDSRRFYGNTEU-OLZOCXBDSA-N 376.287 5.329 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C 48372673 ZDAXNTGURQGEAJ-UHFFFAOYSA-N 399.494 5.467 30 20 GKED CCc1ccc(CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 60648509 MZTIUULZOMNFMP-UHFFFAOYSA-N 392.549 5.404 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccccc3)n2)sc2c1CCCCC2 61047421 BALCEFFDHIQIMX-UHFFFAOYSA-N 379.510 5.264 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C)c1 63661888 HWVSREKQAUUUKD-UHFFFAOYSA-N 390.527 5.274 30 20 GKED CCN(Cc1c(F)cccc1F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66956036 GJTZVFIHLRVDOR-AWEZNQCLSA-N 389.471 5.413 30 20 GKED C[C@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)c1ccc(C#N)cc1 118172528 UFDWHSBRVGDMAJ-KRWDZBQOSA-N 397.507 5.113 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 125547991 LFGGALNMIVXWRD-FQEVSTJZSA-N 388.492 5.054 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c1 138669957 RKNDVKKQXAZSQW-KRWDZBQOSA-N 387.508 5.356 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 179028596 GBZUPSQYNAVBQA-VEMDQMBVSA-N 379.872 5.138 30 20 GKED COCc1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 180501054 FIDMQRJNBKJVPU-GOSISDBHSA-N 396.899 5.456 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1nn(-c2ccccc2)c2c1CCC2 180589078 MRLDWSRILVADEY-KRWDZBQOSA-N 388.540 5.225 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1ccc(OC)c(OC)c1 189879724 VENYNDMYSXVRLK-QGZVFWFLSA-N 381.516 5.373 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1cc(OC)ccc1OC 189908405 NSGBCIVCPCBLIG-PZJWPPBQSA-N 379.500 5.298 30 20 GKED C[C@@H]1CCCC[C@H]1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 195667238 CBLQSILQLUOULW-XLIONFOSSA-N 378.541 5.407 30 20 GKED COc1ccc(/C=C2/CCCc3c2nc2ccccc2c3C(=O)O[C@H](C)C#N)cc1 207146139 CJYSQSWORBYDJY-VVZNPABPSA-N 398.462 5.189 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Oc2ccccc2)c1 303399482 ZQUNHSOTNCNCMB-KRWDZBQOSA-N 388.492 6.125 30 20 GKED N#CCN(C(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C1CCCC1 303811424 ZAOCLHUQAVJNQI-AATRIKPKSA-N 390.327 5.032 30 20 GKED OC(=Nc1nc(-c2cc(Cl)sc2Cl)cs1)[C@@H]1C[C@]12CCOC2 329543751 FPBKNLCNSDKEMB-RTHLEPHNSA-N 375.302 5.193 30 20 GKED C[C@@H]1CC(C/N=C(/O)c2cc(NC(=O)CC(C)(C)C)ccc2Cl)C[C@@H](C)O1 330518338 OPIFLMPXGOQQKA-ZIAGYGMSSA-N 394.943 5.223 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(CCCC2(C#N)CCOCC2)C1 410413321 KHFIUNXGWKPEEC-LPHOPBHVSA-N 380.454 5.189 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 431849140 ZWJGBEWYDDSOKG-UHFFFAOYSA-N 386.377 5.068 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1csc([C@H](C)OCC)n1)c1ccccc1 435104159 DPSGHOIACCUDOE-LPHOPBHVSA-N 387.549 5.090 30 20 GKED Cc1csc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 435569723 YGLQFOAMMLWMEB-GOSISDBHSA-N 395.915 5.332 30 20 GKED COc1ccc([C@@H](C)CCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 438080855 QNQXGNAOPCRUAI-IRXDYDNUSA-N 397.544 5.262 30 20 GKED FC(F)C(F)(F)COCc1cccc(N[C@H]2CCC[C@H](C(F)(F)F)C2)c1 438109575 OVGIJAWCHHRMAK-JSGCOSHPSA-N 387.339 5.637 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(Cl)c(Cl)cc1F 439967888 PLEHLSOZCFWVIA-ACJLOTCBSA-N 392.261 5.436 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1F 440743854 BXCBXMQRVREBSV-UHFFFAOYSA-N 392.346 5.042 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC1CCCCC1)c1nc2ccccc2s1 442624607 YTHYIHDTTDKNBX-KRWDZBQOSA-N 376.481 5.498 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)c1 455906864 OIGNOYQWUZVPEB-LJQANCHMSA-N 387.405 5.531 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 464712377 QBOYRXFBOVTNDB-QGZVFWFLSA-N 395.553 5.136 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1cccc(SCC#N)c1 470296894 GPTGDDIFFSFVHQ-KRWDZBQOSA-N 378.419 5.034 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 470621705 CZDAOEBLSDCUCL-CPCISQLKSA-N 393.249 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1 475553141 YGGURXRXWNOHCT-DYESRHJHSA-N 380.532 6.445 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C[C@@](C)(O)CC 475571115 DSYUKBIJAXILCC-VWLOTQADSA-N 394.559 5.734 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 476397023 KDBBPOAVXPEEOJ-IBGZPJMESA-N 386.451 5.514 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CC=C(c3cccc(Cl)c3)CC2)c1 477347096 FMQHJTYCFMMNAS-UHFFFAOYSA-N 394.902 5.077 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 477961156 DRBAOLVIUFMDOY-UHFFFAOYSA-N 375.472 5.221 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnn(-c2cc(C)ccn2)c1CCC 486792729 GADGHULUUOKVNM-UHFFFAOYSA-N 392.528 5.059 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2ccc(Br)cc2[nH]1)c1ccccc1 487174368 DIQUWMOLOKQHDP-QGZVFWFLSA-N 396.288 5.095 30 20 GKED C[C@@H](S[C@H](C)c1cccc(Br)c1)C(=O)Nc1ccccc1C#N 487903508 DLUMHCXPHBJCOX-CHWSQXEVSA-N 389.318 5.142 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(OCc2ccccn2)c(F)c1)c1ccccc1 489723812 VJOYBKDBICGCKE-HXUWFJFHSA-N 376.431 5.098 30 20 GKED CCCn1ccc2cc(NC(=O)Nc3cccc(OCCCC#N)c3)ccc21 502271434 RMWHPXPIGRPLAR-UHFFFAOYSA-N 376.460 5.378 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H]1CCc2ccccc21 510887487 OKECYFVXVVSSIV-XMMPIXPASA-N 397.478 5.810 30 20 GKED Cc1nc(C(F)(F)F)ccc1NC(=O)c1ccccc1Oc1ccccc1C#N 512417683 FDHFQIHGKCJMOE-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C=CCC[C@H](NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)c1ccco1 513678056 HQJSOQXFEIKITO-NRFANRHFSA-N 378.447 5.468 30 20 GKED N#CCCN(Cc1ccccn1)Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1 513737061 SUXDVRAPEYDVQG-UHFFFAOYSA-N 385.389 5.276 30 20 GKED C=CCC[C@@H](NC(=O)C[C@@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 514060712 ROLMTQFKFIQMIQ-FZKQIMNGSA-N 394.437 5.628 30 20 GKED N#CC1(NC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)CCCCC1 514923631 AULMEVVUEJSXAT-UHFFFAOYSA-N 389.474 5.249 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 518027639 SEIUCSXLUOGDBE-OAHLLOKOSA-N 392.405 5.462 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCCc3c[nH]c4ccccc34)c2)cc1 519195471 DFUCZRAIVGCDHJ-UHFFFAOYSA-N 396.450 5.196 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 519888502 AFTIXCNDBJOSQQ-ZIAGYGMSSA-N 375.394 5.041 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)cc1 520198875 JFHRVTPQTJNOSH-WMLDXEAASA-N 387.936 6.007 30 20 GKED N#CCCCOc1cccnc1NC(=O)CC1CCC(c2ccccc2)CC1 520835355 KWSFCVNPBYLGHN-UHFFFAOYSA-N 377.488 5.067 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@@H](C)CC#N 521811582 MLXPTINWYUQKAS-KRWDZBQOSA-N 399.535 5.910 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 523974999 UDQQYWYYSHRAPO-UHFFFAOYSA-N 395.890 5.406 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccccc1 534622177 UDBNWQADLFSVHF-MRXNPFEDSA-N 395.396 5.402 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c(F)c1 538005531 WYCHODNSWYOSEN-GOSISDBHSA-N 382.788 5.610 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H](c3ccccc3)[C@@H]3CCOC3)c2)c1 540068875 VHKXMKGGELNXSH-AOYPEHQESA-N 398.506 5.005 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)Nc2cccc(OCCCC#N)c2)cc1 546798164 DRLBAAYKOBQHHT-UHFFFAOYSA-N 392.499 5.305 30 20 GKED C=CCn1c(S[C@@H](C)CCC#N)nc2sc(-c3ccccc3)cc2c1=O 551391086 QMOLCMVDGSPXHQ-AWEZNQCLSA-N 381.526 5.095 30 20 GKED CCOc1ccc([C@H](N[C@H]2CCc3ccc(C#N)cc32)C(C)C)cc1OCC 554997202 JJDPDLBBAVDULB-XUZZJYLKSA-N 378.516 5.330 30 20 GKED N#Cc1cnc2c(F)c(F)c(F)cc2c1N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 557688446 FVFQTKGOPSTGFL-CYBMUJFWSA-N 399.338 5.083 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccccc3OC(F)F)cc2)cc1 558073612 MJNNGFPAFNJOGX-UHFFFAOYSA-N 394.377 5.399 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 559861120 WDODBKOEKBWQKR-HRAATJIYSA-N 393.531 6.343 30 20 GKED CCCN(C(=O)NCc1ccc(CC#N)cc1)[C@H](C)c1cc2ccccc2o1 567893840 BFCGTOYYOGNEII-QGZVFWFLSA-N 375.472 5.182 30 20 GKED CCSc1ccccc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 580608320 ISDGWRJCMRZSAC-UHFFFAOYSA-N 375.453 5.110 30 20 GKED C[C@H](NCc1ccc(O[C@H]2CCOC2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 594942517 IFXNBJUKVIXXBU-SIBVEZHUSA-N 398.506 5.244 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc(-c4ccoc4)n3)n2)cc1 595127561 YYDJDZJYLLEFNN-OAHLLOKOSA-N 391.477 5.325 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N(Cc1ccco1)c1ccccc1C#N 603531204 KRNZYKMHQZULLM-UHFFFAOYSA-N 395.462 5.092 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CSc1ccc(F)cc1 603532601 FLHNRLJGERPYBV-UHFFFAOYSA-N 376.456 5.023 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)Nc3ccc(C#N)c(Cl)c3)c12 603728769 YNBYQLRCZQZGDN-UHFFFAOYSA-N 380.835 5.001 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(c4ccc(Cl)cc4)CC3)cn2)cc1 603765351 VRPAPRLMBDCKFA-UHFFFAOYSA-N 389.842 5.069 30 20 GKED Cc1nc2ccccc2nc1CSc1nc2c(c(-c3ccco3)c1C#N)CCC2 603818370 FHAWBYRKUWIWDY-UHFFFAOYSA-N 398.491 5.246 30 20 GKED C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 609079675 GUYUTUJYIPIBPT-OAHLLOKOSA-N 383.879 5.054 30 20 GKED CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1cc2ccccc2n1CC#N 609587674 ZUAZELDVCKEOJR-NRFANRHFSA-N 379.891 5.288 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2c[nH]c3ccc(F)cc23)cc1 609643159 WRKWJAVURFOWDD-UHFFFAOYSA-N 385.398 5.152 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)c2occc2COc2cccc(C#N)c2)CC1 609696462 FPTMMJNBVHLGKX-LJQANCHMSA-N 380.488 5.019 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1 610019141 DRFQZALTAGDWII-MISYRCLQSA-N 393.556 5.614 30 20 GKED C[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1cccc(C#N)c1 610360791 GVXYXOSLMWKIPD-JTQLQIEISA-N 375.280 5.571 30 20 GKED CN(CC(=O)Nc1ccccc1SCC#N)c1ccccc1-c1ccccc1 610390203 CNRHCIGWPBEJEW-UHFFFAOYSA-N 387.508 5.044 30 20 GKED FC(F)(F)c1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 618452120 QQGIDMHXVWFLTO-RYUDHWBXSA-N 379.266 5.268 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C)nc1)CC1CC1 646375033 RQQQSYHLCDPZRL-UHFFFAOYSA-N 377.532 5.686 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 648494279 HHTPQDXPEUPUCL-UHFFFAOYSA-N 398.278 5.087 30 20 GKED C=CCC[C@H](NC(=O)N(C)C[C@@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 676423443 VKSSDUSWOYWMCE-HJOGWXRNSA-N 392.543 5.503 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCN(c2ccc(F)cc2F)C1 682777360 NZIBTOAGQRCDAT-SFHVURJKSA-N 399.485 5.217 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2CCC[C@@H](c3ccccc3)CC2)c1=S 727431244 QZCADFJCWTUGDQ-LJQANCHMSA-N 394.544 5.087 30 20 GKED Cc1ccc2c(c1C)OC[C@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728392379 ZTTKMEWEBBLKIH-XZOQPEGZSA-N 397.478 5.214 30 20 GKED C#Cc1cccc(N(CC)C(=O)Cc2csc(-c3ccccc3Cl)n2)c1 728480567 BTWQJFYSVGHFCL-UHFFFAOYSA-N 380.900 5.040 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccnc3SC(F)F)cc2)c1 731345200 GCOGEEJYNMRBTM-UHFFFAOYSA-N 397.406 5.313 30 20 GKED N#Cc1cccc(OCCCCC(=O)Oc2ccccc2SC(F)(F)F)c1 731982473 VXSPQVGZBOEORY-UHFFFAOYSA-N 395.402 5.325 30 20 GKED C=CC1CCN(C(=O)c2oc3ccccc3c2CSc2nc(C)cs2)CC1 732002740 DGKFAMYAFHXLFV-UHFFFAOYSA-N 398.553 5.528 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(-c3c(F)cccc3F)o2)c(C#N)c2n1CCC2 734368940 ZZCJGKLZSCXCJK-VQHVLOKHSA-N 378.378 5.049 30 20 GKED O=C(Nc1cccc(C=NNc2cccc(F)c2F)c1)c1ccccc1Cl 743442850 JJSLISTZVNFSLH-UHFFFAOYSA-N 385.801 5.317 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)(C)C 744029294 SLUDBAJXRYNGTN-HRYDCMBCSA-N 376.456 5.119 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)c1 746518045 JPKFOWSIXRJBSN-UHFFFAOYSA-N 386.398 5.087 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C/c3ccc(-c4c(F)cccc4F)o3)ccc21 754690057 NUARSTQGLKYEKK-JXMROGBWSA-N 393.389 5.030 30 20 GKED COc1ccc(C[C@@H](C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 758409787 MQAUVSKUKJAGBV-HOYKHHGWSA-N 384.479 5.168 30 20 GKED C=C[C@@H](CC(=O)N(Cc1ccc(N(C)C)cc1)CC(F)(F)F)c1ccccc1 759862054 NMDCUEXEKJRKMF-SFHVURJKSA-N 390.449 5.003 30 20 GKED N#C[C@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nc2ccccc2s1 760963246 GONSYXSQNPTIOU-MRXNPFEDSA-N 393.899 5.561 30 20 GKED C#CCCOc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 767422275 QAGCXCNMHWZNFN-DEOSSOPVSA-N 390.914 5.211 30 20 GKED N#C[C@H](C(=O)Nc1ccc(-c2ccccc2)cc1)c1nc2cc(F)ccc2s1 768125771 HUBBOWUTQHIPTQ-GOSISDBHSA-N 387.439 5.348 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)CCc2ccc(Cl)s2)ccc1OC 772980529 RBWBTROMPPOXKN-ZBFHGGJFSA-N 392.952 5.202 30 20 GKED CC(C)[C@@H]1C[C@@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773982690 LKHZPZTVLNYTSB-IHRRRGAJSA-N 379.312 5.585 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776168245 HVRBCKIMUDDHDE-KKSFZXQISA-N 388.433 5.966 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)OCc2ccc(C3(C#N)CC3)cc2)s1 777144142 IYFJQOIKJJVIIB-UHFFFAOYSA-N 394.521 5.021 30 20 GKED O=C(OCc1ccc(C(F)(F)C(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 777800563 JJWRLXVWSDTIKX-UHFFFAOYSA-N 399.237 5.112 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCn1c2ccccc2c2ccccc21 780158926 AVONVCDWDBTTCE-QGZVFWFLSA-N 383.451 5.114 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1Cl)C1CCCC1 780680680 GXJWXZPEIMEPMS-MRXNPFEDSA-N 397.906 5.608 30 20 GKED Cc1ccc2c(CN[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)cc(=O)oc2c1 782230898 JCYIMHXPPBKVNA-GOSISDBHSA-N 394.474 5.491 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 783070801 XCFTVWURDXIICW-RISCZKNCSA-N 396.434 5.277 30 20 GKED CC1(C)CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCS1 788572881 UPVZKGWRALIVDE-HXUWFJFHSA-N 379.529 5.091 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2C(F)(F)F)cc1 788583648 VWTZJHHMIWOJKY-SFHVURJKSA-N 381.357 5.008 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C(C)=C1CN(C(=O)OC(C)(C)C)C1 789887351 BUTXMNSXBVBWBD-UHFFFAOYSA-N 384.520 5.044 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nccc2ccccc12)Cc1ccc(Cl)cc1 792098014 ZUMYRIAXNWQRAE-HXUWFJFHSA-N 376.887 5.723 30 20 GKED C=CCC1(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)CCC1 792525955 TZUDQXVMMMTKOJ-UHFFFAOYSA-N 384.911 5.010 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1Br 798814799 WEXXZVVXBQJXHR-GFCCVEGCSA-N 399.313 5.213 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801670973 SYWARHCBQSCSHK-SJCJKPOMSA-N 396.409 5.606 30 20 GKED N#C[C@H](C(=O)CCSc1cccc(Cl)c1)c1nc2cc(F)ccc2s1 808984656 ZANRVAIJWCAFHF-CQSZACIVSA-N 390.892 5.447 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1ccccn1)c1csc(-c2c(F)cccc2Cl)n1 810527660 KDLQUHPFIHNADG-LBPRGKRZSA-N 399.878 5.152 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1C#N 836819283 OPTGAZCYXVAWAW-UHFFFAOYSA-N 397.784 5.055 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1)c1ccccc1 838604674 UYCPVESDNDWYEH-LEWJYISDSA-N 383.442 5.246 30 20 GKED COc1cc([N+](=O)[O-])ccc1NN=C(CCC(F)(F)F)CCC(F)(F)F 853298064 QQSYIYNOEWLCDO-UHFFFAOYSA-N 387.280 5.056 30 20 GKED Cc1c(NCc2cn3ccccc3c2C#N)cccc1NC(=O)OC(C)(C)C 863356997 LLSYNCRUWPLLIB-UHFFFAOYSA-N 376.460 5.079 30 20 GKED C[C@H](NC(=O)Nc1ccccc1SCc1ccccc1)c1ccc(C#N)cc1 915329924 MUNCXYNEMAIPJG-KRWDZBQOSA-N 387.508 5.733 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 916392076 CQFZCWSLNZPGMB-DEOSSOPVSA-N 399.494 5.453 30 20 GKED COc1ccc(O)c(C=Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 920942268 UZPMONYTPGWFQK-FQEVSTJZSA-N 376.843 5.460 30 20 GKED Cc1c(NN=Cc2cnn(C3CCCC3)c2-c2ccccc2)cccc1C(=O)O 1776088620 YOQYXDSYFQACHW-UHFFFAOYSA-N 388.471 5.118 30 20 GKED O=C(O)c1cc2c(/C=C\C(=O)c3ccccc3OC(F)F)c(F)ccc2s1 1776119462 BPOVWCDDKSUFRE-ALCCZGGFSA-N 392.354 5.236 30 20 GKED C[C@@H]1Oc2ccc(/C=C/C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)cc2[C@@H]1C 1776669733 SJQJHKZIEXDORF-VGTDGHPOSA-N 388.419 5.425 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2cccc(O[C@H](C)C(=O)O)c2)c1 1777461676 AQFPDIIRVAYJSQ-SWNWVQGVSA-N 386.447 5.410 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1777566873 QAIFQSVTBIFIJO-MOSHPQCFSA-N 379.415 5.136 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1nc(-c2ccco2)sc1C 29299783 GOHJBYGTCJTMHG-UHFFFAOYSA-N 378.906 5.255 30 20 GKED CC(C)Oc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 51157217 QACWBUFACXHLMI-INIZCTEOSA-N 397.887 5.136 30 20 GKED Cc1nc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cs1 56750690 BFZLBRJOLOQGCJ-UHFFFAOYSA-N 398.875 5.091 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(OC(F)F)cc2)nnc1-c1ccoc1C 72031383 QNKWNCZKZDKRSC-ZDUSSCGKSA-N 391.443 5.487 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cccc(C#N)c1 116634206 OTAAYCVIHNSJAB-UHFFFAOYSA-N 387.826 5.152 30 20 GKED N#C[C@H](C(=O)c1cncc(-c2ccccc2)c1)c1nc(-c2ccccc2)cs1 124592411 DNCZHJPUQLEJBG-HXUWFJFHSA-N 381.460 5.362 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 129457627 FGOVXGIXZURDOZ-OAHLLOKOSA-N 392.484 5.688 30 20 GKED C=CCC[C@@H](C(=O)NCCCc1nc(-c2ccncc2)cs1)c1ccccc1 189031926 JCNPMQODAIYHDN-HXUWFJFHSA-N 391.540 5.004 30 20 GKED Cc1cc(F)c(Br)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 190889207 FVOKJNROSIJTKT-MRXNPFEDSA-N 390.256 5.063 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(Br)o1 191417126 AZZKHJQQMRWZBJ-UHFFFAOYSA-N 391.309 5.558 30 20 GKED C=CCn1c(S[C@@H](C)c2c(F)cccc2F)nnc1-c1ccccc1F 195677364 UJRQWRTZTLXCEX-LBPRGKRZSA-N 375.419 5.402 30 20 GKED FC(F)(F)c1ccc(C#CCNCc2cnc(-c3cccs3)s2)cc1 237870903 OZBJGYUCWHKMCQ-UHFFFAOYSA-N 378.444 5.032 30 20 GKED N#CCCN(Cc1ccco1)Cc1c(-c2ccc(Cl)cc2)nc2sccn12 302817788 SBXLOISNHHRSRG-UHFFFAOYSA-N 396.903 5.225 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2)cc1)c1ccc(N2CCC(O)CC2)cc1 303375109 WGEJDFJYZKZGSA-OVCLIPMQSA-N 383.491 5.211 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)[C@@H](C)c1ccc(C#N)cc1 303545996 ZHXJCYJDUAHUAP-MORSLUCNSA-N 387.310 5.578 30 20 GKED O/C(C[C@@H]1OCCc2ccccc21)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329527931 UKJKUEXNNQDMCN-RTWAWAEBSA-N 379.504 5.036 30 20 GKED Cc1cc(SC2CCCCC2)ccc1N/C(O)=N/[C@H]1CCc2c[nH]nc2C1 329845612 QISBUPOLNBGADH-INIZCTEOSA-N 384.549 5.026 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1 409923623 QFRGZPGPSOPYOC-STQMWFEESA-N 397.208 5.209 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1c(Cl)ccc2c1OC(C)(C)C2 425669534 CPZUCXZWCVIFDW-ZDUSSCGKSA-N 383.879 5.150 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1cc(F)ccc1F)C(F)F 433851160 AEMSNORATSMAAH-IBGZPJMESA-N 394.412 5.945 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1ccc(F)cc1C#N 435162205 IRCGKQODWSOYSE-ZDUSSCGKSA-N 380.448 5.012 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 436196608 VPURYJNPFXFIEK-UHFFFAOYSA-N 379.533 5.573 30 20 GKED CN(C(=O)CSc1ccccc1C#N)[C@H](c1ccccc1)c1ccc(F)cc1 439704592 KPZJDMIPOUCPLA-HSZRJFAPSA-N 390.483 5.037 30 20 GKED CC1(C)CCCN(C(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)[C@H]1C#N 442798876 HNMBHPYWLRUQNG-HNNXBMFYSA-N 376.287 5.143 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]2CCC[C@@H]21 444380426 DJMYEMLHCWCTJP-AVRDEDQJSA-N 375.472 5.455 30 20 GKED COc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)ccc1C(F)(F)F 448081441 RWGIUWWZMMECQM-UHFFFAOYSA-N 391.393 5.028 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)[C@]1(C#N)C[C@H]1C 450006903 WKATYPYGGWTOMQ-CMJOXMDJSA-N 390.462 5.220 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1 455200561 KPMLTFDRDVMAFC-MSOLQXFVSA-N 393.384 5.163 30 20 GKED Cc1csc(NC(=O)c2sc3ccccc3c2Br)c1C#N 464581761 RDDTVSBBEXUOHG-UHFFFAOYSA-N 377.288 5.158 30 20 GKED CC(C)(C)C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 468882639 FMEHAMAHJRIEMY-JOCHJYFZSA-N 389.543 5.859 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 471254975 PCLLNNRXBINKEU-UHFFFAOYSA-N 389.455 5.142 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccccc3Oc3cccc(F)c3)o2)c1 471632214 FEPWMAPDVQVQLG-UHFFFAOYSA-N 386.386 5.152 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cccc(C(F)(F)F)c1 476148348 MMDAMLUODNNJMP-UHFFFAOYSA-N 377.406 5.575 30 20 GKED CO[C@@]1(C)CCCN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CC1 477861578 LPUCIVUXYQDTNP-QFIPXVFZSA-N 398.890 5.035 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCCOc2c(F)cccc21 480078477 WNZCRIZPMWXTHJ-QFIPXVFZSA-N 386.426 5.008 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 482023422 ZVMRINXPUSWNAY-IFXJQAMLSA-N 387.405 5.105 30 20 GKED Cc1ccc(C)c(NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c1 483869414 OSFXTXMGKQWNPY-UHFFFAOYSA-N 384.439 5.071 30 20 GKED CC(C)(C)CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 486603664 MPBPLYSJJSBIFR-UHFFFAOYSA-N 385.467 5.438 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N[C@H](CCCC#N)c1ccccc1 487271449 RRSOFYAPFAKMKA-RHSMWYFYSA-N 391.298 5.312 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 495353525 JZZASCVICZLVGB-UHFFFAOYSA-N 382.504 5.090 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N[C@@H](c1cccc(F)c1)c1ccccn1 497548986 MLKBWJXUQRMOEY-NRFANRHFSA-N 390.368 5.120 30 20 GKED C[C@@H](NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 498407996 IHESGSZXCWALHK-GOSISDBHSA-N 382.463 5.066 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 505169872 VYNHLGVGFDKFSU-UHFFFAOYSA-N 379.312 5.488 30 20 GKED N#Cc1ccsc1NC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 509866780 DTSUACJCALKODU-UHFFFAOYSA-N 390.251 5.366 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)Nc1cccc(C#N)c1 510055006 KOCZDUQVZDRGHQ-UHFFFAOYSA-N 388.471 5.090 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)CCCCc1ccc(Cl)c(Cl)c1 510373648 FGZBOASBRFWGGX-UHFFFAOYSA-N 381.225 5.011 30 20 GKED N#C[C@@H](C(=O)c1cccc(C(F)F)c1)c1nc(-c2c(F)cccc2F)cs1 511748917 WOCUUNHUAGBNJY-LBPRGKRZSA-N 390.361 5.516 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)CCc2c(C)nc(O)c(C#N)c2C)c(C)c1 513373824 YRIOVVWVPKOUQD-AWEZNQCLSA-N 397.544 5.046 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(COc2ccccc2C#N)o1 515499262 RIBOJMRNAQUYNT-OAHLLOKOSA-N 394.858 5.217 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520940128 FSZYNWZHEJDWRK-INIZCTEOSA-N 389.430 5.715 30 20 GKED Cn1c(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c(Cl)c2ccccc21 521352673 GQIACBMBNFXUOP-CQSZACIVSA-N 392.673 5.133 30 20 GKED C=CCN(Cc1ccccc1)C(=O)NCc1ccc(-c2csc(C)n2)cc1 522174250 PMNRYSSLYVENTC-UHFFFAOYSA-N 377.513 5.016 30 20 GKED CCn1c(S[C@H](C)c2ccc(C#N)cc2)nc2sc3c(c2c1=O)CCCC3 522822251 NOEJUMGEGINJNB-CYBMUJFWSA-N 395.553 5.082 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2sc(C)c(CC)c2C#N)cc1OC 524330170 YMFIIBSDVXGRRJ-UHFFFAOYSA-N 392.908 5.194 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(OCc2ccccc2C#N)c1 524512293 NUOTULZYDBLEQD-YADARESESA-N 396.490 5.155 30 20 GKED Cc1ccc(NC(=O)[C@H](Sc2ccc(C#N)cc2F)c2ccccc2)cc1 525503935 NTOBJQBDXCRLBP-OAQYLSRUSA-N 376.456 5.478 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 537254036 PJZKPUCBAQCPPV-SFHVURJKSA-N 377.488 5.198 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 538362713 GUBDECSEKBUCBN-SFHVURJKSA-N 392.528 5.475 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)C1CCCCC1 542533692 XGLVMVKCBSAGHM-KURKYZTESA-N 387.593 5.214 30 20 GKED CC[C@H](NCC#Cc1ccc(C(F)(F)F)cc1)c1nc(C(F)(F)F)cs1 543492329 HKGGUTCOAKDPOW-ZDUSSCGKSA-N 392.368 5.273 30 20 GKED CC(C)c1ccc(-c2nc(C[S@](=O)Cc3ccc(CC#N)cc3)cs2)cc1 544044632 GBAXZWMXCTYCLY-HHHXNRCGSA-N 394.565 5.448 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 549389955 QWLBLMDCTHGCID-UHFFFAOYSA-N 381.476 5.478 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2C(C)(C)C1 551192982 MMLFYTSJWJNYGC-INIZCTEOSA-N 379.529 5.406 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1 552871526 GQOAMLMFJTXFRE-SFHVURJKSA-N 393.506 5.409 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1 568804865 GDOPQIJPKDZEJS-IBGZPJMESA-N 380.492 5.215 30 20 GKED COc1ccc(N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Cl 578784844 XFSLGKKNLANFKL-ZDUSSCGKSA-N 389.908 5.411 30 20 GKED Cc1cccc(C)c1[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 596606078 KFHWEPYOBXDSOE-YADHBBJMSA-N 375.516 5.585 30 20 GKED Cc1cccc(N[C@H](C)c2cccc(C#N)c2)c1C(=O)NCCc1ccccc1 600849505 OJSWAOPISGRTDW-LJQANCHMSA-N 383.495 5.012 30 20 GKED N#Cc1c(NC(=O)c2cc(F)cc(Br)c2)sc2c1CCCCC2 603727166 FJUKYQLHPKAQKP-UHFFFAOYSA-N 393.281 5.043 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC(F)(F)F)c1ccccc1 608918610 OAWRNUQOAFLNDN-IBGZPJMESA-N 389.421 5.172 30 20 GKED CCOc1ccccc1CNC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209108 AOXOEIHKKYKYHH-UHFFFAOYSA-N 387.439 5.071 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(C(F)F)c2)cc1 609298895 YKWDDGPVYJIYLG-UHFFFAOYSA-N 382.341 5.680 30 20 GKED COc1cccc(C2(C(=O)Nc3ccccc3SC[C@H](C)C#N)CCCC2)c1 609408355 VKECCTKIJHNQFB-QGZVFWFLSA-N 394.540 5.397 30 20 GKED N#CCc1cccc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)c1 610108324 RXOLDIPVWMXUDN-UHFFFAOYSA-N 385.854 5.125 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)Nc1ccccc1S[C@H](C)CC#N 611557355 LUPLXEPXXUCSHL-BFHYXJOUSA-N 385.455 5.276 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)ccc1Cl 644890325 GKFNHEZKMHXSSA-HTQZYQBOSA-N 391.714 5.118 30 20 GKED C[C@H](NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)C1CCC(F)CC1 661896940 AKWXLSRIKYNXSR-UNXYVOJBSA-N 394.375 5.256 30 20 GKED Fc1ccc(F)c2c1CC[C@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 677129544 MPRVFKMVZOKKQR-MAGOMRGPSA-N 387.314 5.451 30 20 GKED N#Cc1ccc(NC(=S)N[C@@H]2CCSc3ccc(Cl)cc32)cc1Cl 726452798 ZFDFZBZKYQPBAR-OAHLLOKOSA-N 394.352 5.389 30 20 GKED C[C@@H](OC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cnc2ccccc2c1 728147770 ZYUPUUGMASWFGK-MRXNPFEDSA-N 398.418 5.196 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)Nc3ccc(F)c(C#N)c3)cccc2c1=O 728180197 MJJIBMJAIZAUIV-UHFFFAOYSA-N 398.393 5.032 30 20 GKED N#Cc1cc(F)ccc1CSc1ncc(-c2ccccc2)n1C[C@H]1CCCO1 728441224 CEQIBYQXKVOWHJ-HXUWFJFHSA-N 393.487 5.032 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3ccc(OC)c(OC(F)F)c3)c(C)c2c1 729150536 KXHSGGYJCQBRRZ-QPJJXVBHSA-N 388.366 5.256 30 20 GKED Cc1cc(/C=C2/SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)ccc1F 729688026 RPFXMNRQNQULNY-FRKPEAEDSA-N 388.876 5.065 30 20 GKED N#CCOc1ccc(CSc2nc3cc(C(F)(F)F)ccc3s2)cc1 731158182 VLQVMNJKUHMELN-UHFFFAOYSA-N 380.416 5.510 30 20 GKED CC(=NNc1ncc(Cl)cc1Cl)c1cnn(-c2cccc(Cl)c2)c1C 731557197 DRDJAJZVQICPPY-UHFFFAOYSA-N 394.693 5.372 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(=O)c1ccccc1 732753564 SSWCWYLTSLPZDT-JPYJTQIMSA-N 382.463 5.190 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccccc1Sc1ccccc1)c1ccncc1 734668591 FBFPBVBLLZBCOV-OAQYLSRUSA-N 389.524 5.349 30 20 GKED C=CCCCN(C)Cn1nc(Nc2cccc(Br)c2)sc1=S 736589204 DLBIWOJZFCBVIF-UHFFFAOYSA-N 399.383 5.036 30 20 GKED C#Cc1cccc(N(C(=O)[C@H]2C[C@H]2c2ccccc2OC(F)(F)F)C(C)C)c1 741186199 RFKOYUUQHQTELV-OALUTQOASA-N 387.401 5.112 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 747135874 DESYZLDKYZEZTL-UHFFFAOYSA-N 378.815 5.287 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2cccc(F)c2)CC1 752678002 LMOUCYCYPAMCEM-INIZCTEOSA-N 397.519 5.489 30 20 GKED C#CC[C@@H](NC(=O)N(Cc1ccco1)Cc1ccc(C)s1)c1ccccc1 757058799 IYDBVEUGTUUMED-OAQYLSRUSA-N 378.497 5.126 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)s1 763476523 KKNSOXOVJABQFE-MRXNPFEDSA-N 376.481 5.160 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(F)(F)c2ccccc2F)cc1 765622372 AYMBXVOQIBGTEM-GOSISDBHSA-N 380.369 5.212 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)N(C)c2cccc(C#N)c2)cc1 772079806 LPTBKBPYHLCZQG-UHFFFAOYSA-N 383.455 5.316 30 20 GKED N#Cc1cc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])ccc1Oc1ccccc1 777973949 WOFNWTFKWNMVSP-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1nc(/C=C\c2ccnn2C(C)C)sc1C(=O)/C=C\c1ccnn1C(C)C 794938433 PIWGHBJFNBKNOJ-VRHVFUOLSA-N 395.532 5.073 30 20 GKED COCCCC[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 795002640 PCXONIBLYCTSJW-LJQANCHMSA-N 387.936 5.056 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1 800577352 MVOAPKXJZFCQTN-IHXXNJTDSA-N 378.431 5.223 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H]1CCOC(C)(C)C1 809872633 JIGKCQLQDWSXQR-YADHBBJMSA-N 391.515 5.153 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1cc(C(F)(F)F)ccn1 813215414 XZQOXJVGELDCFP-RDBSUJKOSA-N 399.199 5.387 30 20 GKED N#C[C@H](C(=O)C1(c2cccs2)CCCCC1)c1cc(C(F)(F)F)ccn1 813218241 MWLWWCBGAOXHDF-AWEZNQCLSA-N 378.419 5.240 30 20 GKED N#Cc1ccc(C(=O)N(CC2(c3ccc(Cl)c(Cl)c3)CCC2)C2CC2)o1 814119367 HKRUTISNOLEFRP-UHFFFAOYSA-N 389.282 5.185 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCOCC2)cc1Cl 815636161 QKKHSJYJUONAIW-WZONZLPQSA-N 397.950 5.262 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2CCC(OC(F)F)CC2)cc1 836272697 FLLXKHCAOSDUKC-SOAGJPPSSA-N 399.441 5.014 30 20 GKED CC(C)COc1ccc(C2(c3noc([C@H](N)CCCCC#N)n3)CCCC2)cc1 848632642 VOYGUKDRUXBFKC-HXUWFJFHSA-N 396.535 5.048 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C\c2csc(C(F)(F)F)c2)s1 860732816 OSAIXTPDSNQHSB-DOGVGXBMSA-N 384.448 5.411 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1sc(C(C)(C)C)nc1C 915110391 UJJYPPVLDWACKZ-UHFFFAOYSA-N 390.862 5.652 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(F)ccc3s2)cc1 916954681 JWOZIXWVNKSJRH-UGSOOPFHSA-N 394.471 5.515 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3scnc3Cl)c2C#N)C1 920081110 XRRAFDHMHKNVRQ-VIFPVBQESA-N 379.938 5.133 30 20 GKED CCc1ccccc1Oc1ccc(Cl)cc1C=NNc1ccc(C(=O)O)cc1 1776012378 QWELSBMJHCLAMV-UHFFFAOYSA-N 394.858 5.839 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(C)c(C(=O)O)c2)cc1OCCC 1776125441 JCVXYLJAFNKJGW-NTMALXAHSA-N 382.456 5.167 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(-c3ccccc3C)c2)cc1CC(=O)O 1776131750 FAUICSOIIIRRAQ-ZRDIBKRKSA-N 386.447 5.194 30 20 GKED C=CCc1ccccc1/C=C1/CN(CC)Cc2c1nc1ccccc1c2C(=O)O 1776187694 HWAQADCJNGCRDZ-RGEXLXHISA-N 384.479 5.038 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)C(=O)c2ccccc21 1776308875 ULLVQDNTGXSEOK-GSERBOKHSA-N 388.419 5.370 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776700109 ZIOUIOMRNQDRKP-CHOZFAJLSA-N 382.456 6.148 30 20 GKED Cc1ccoc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538126 ZULWKQNHGPREAN-LBPRGKRZSA-N 377.252 5.508 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 43931978 XMAPGXPQIJXITP-UHFFFAOYSA-N 382.423 5.030 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OC)cc1C(F)(F)F 56627848 NAXZKBQIIPRUJA-UHFFFAOYSA-N 382.357 5.073 30 20 GKED COCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(C)C)cc1C(C)C 58421058 VEARMSDROSYKLE-UHFFFAOYSA-N 393.531 5.486 30 20 GKED C[C@@H](SCC(=O)Nc1ccccc1SCCC#N)c1nc2ccccc2[nH]1 108200191 YOFYFAWANHSLHS-CQSZACIVSA-N 396.541 5.002 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccccc1C(F)(F)F 108355051 APPZEKUTLLMCHY-CYBMUJFWSA-N 393.434 5.008 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(NC(=O)c2cccs2)c(C)c1 130318218 LAOWXTRFZNLLQK-UHFFFAOYSA-N 397.544 5.101 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 155159588 VGZGMHHYNSOSTQ-BZNIZROVSA-N 399.903 5.438 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1nc(C)cs1)C1CC1 175843873 UDLRDGUZRUXDOU-HNNXBMFYSA-N 381.954 5.015 30 20 GKED C=C(C)CN(C)C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 180429823 PFXBXSOGTKUCDN-UHFFFAOYSA-N 382.533 5.006 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-n3cccn3)cc2)ccc1SC(F)F 195733656 LTJWRLHNLGZJIG-WEVVVXLNSA-N 386.423 5.092 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(Cl)c([N+](=O)[O-])c1 210112295 HZZRWQQJURWTCA-LUAWRHEFSA-N 394.814 5.118 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2sc(-c3ccccc3)nc2C)cc1 237479598 BFYKECHTANXVET-KRWDZBQOSA-N 376.525 5.371 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)[C@H]1c1cccc(F)c1 245410115 PMCZBTLGKGIUCZ-VWKPWSFCSA-N 397.519 5.692 30 20 GKED CC(C)(C)n1nc(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)cc1C1CC1 329520080 QGAGIMLYJKZVGG-GOSISDBHSA-N 395.551 5.209 30 20 GKED CC[C@@H](/N=C(/O)C1CCC(c2ccccc2)CC1)c1nnc2n1CCCCC2 329619656 MILGKXOHMMHULR-SOAGJPPSSA-N 380.536 5.386 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)C[C@H](C)C[C@@H]2C 410980789 NFLYEIKZVVAFEU-NEPJUHHUSA-N 395.484 5.043 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3sc(C(C)(C)C)cc3C#N)cs2)o1 411009040 VWVPXEYKGAPGPI-UHFFFAOYSA-N 385.514 5.123 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1cccc(Cl)c1Cl 425454795 SAYMGHKQELOBBI-CHWSQXEVSA-N 376.287 5.329 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cccc(SCC#N)c1 429926983 AZMOQVHJWJWPRY-ZDUSSCGKSA-N 378.419 5.154 30 20 GKED Cc1c(C(=O)Nc2cc3c(cc2Cl)OCCCO3)sc2ccc(C#N)cc12 431660849 YCSKDLLNAWZNRI-UHFFFAOYSA-N 398.871 5.148 30 20 GKED Cc1csc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 435569724 YGLQFOAMMLWMEB-SFHVURJKSA-N 395.915 5.332 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c1 437555830 GOVNUJLZWFXGMH-UHFFFAOYSA-N 389.411 5.352 30 20 GKED CN(c1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1)C1CCCC1 439470427 DFHGDFJEAKHDKT-FQEVSTJZSA-N 376.504 5.232 30 20 GKED N#CC(CCN1CC[C@]2(C1)OCc1ccccc12)(c1ccccc1)c1ccccc1 444689726 OQQIWFUNLAFHSW-HHHXNRCGSA-N 394.518 5.018 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](CO)c1ccc(Cl)cc1 455248633 PFXMKCITLKQQAM-FQEVSTJZSA-N 386.923 5.389 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)CC(F)(F)F 457557203 MVQIEBCYHDASDA-AWEZNQCLSA-N 378.369 5.128 30 20 GKED C[C@H](C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)c1ccsc1 460152770 VFJDIRMIPUVOAI-HNNXBMFYSA-N 380.900 5.610 30 20 GKED C[C@@H](c1ccccc1)N(Cc1nnc(-c2ccc(C#N)cc2)o1)c1ccccc1 468504818 HXFJPMYWYMOJNV-SFHVURJKSA-N 380.451 5.376 30 20 GKED CSCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1F 473927465 ISSCBCIZVOUYIQ-KRWDZBQOSA-N 396.512 5.611 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccccc1Cl 475574922 MOMIYUXYDFPWGL-NRFANRHFSA-N 382.935 6.561 30 20 GKED C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)C[C@@H](CC#N)c1ccccc1 476307871 UGTBVPAOZHVQPO-GOEBONIOSA-N 387.310 5.527 30 20 GKED C=CCOCCCOc1cc2ccccc2cc1C(=O)Nc1ccccc1OC 478779316 IUKTYEDZQBOSBJ-UHFFFAOYSA-N 391.467 5.072 30 20 GKED CC[C@H](C)n1ncc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1C 485339345 WOSCXGJLDZMPIA-INIZCTEOSA-N 387.487 5.023 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@H]2CCCc3sc(C)nc32)C(C)(C)C)cc1 485680370 FMOQMMKSEGOITG-IBGZPJMESA-N 398.572 5.264 30 20 GKED COc1ccccc1[C@@H](NCc1cc(C#N)ccc1F)c1ccccc1Cl 494020700 OHTXDRWCACADBB-QFIPXVFZSA-N 380.850 5.239 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)c2ccccc2CCN1CCCC1(C#N)CCOCC1 499560373 FUXGYHOKSRYRDN-BWKNWUBXSA-N 388.555 5.166 30 20 GKED Cc1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)nc(C(C)C)n1 502761930 DXZUFNMURQSWQE-UHFFFAOYSA-N 388.496 5.184 30 20 GKED CCCCn1ncc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1C(C)C 506651909 CJHXCGZEXLXVSQ-UHFFFAOYSA-N 380.517 5.454 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)Nc2cccc(SCC)c2)cc1 506743274 NFIWPRMDWNJYEE-UHFFFAOYSA-N 395.528 5.257 30 20 GKED CSC[C@](C)(C#N)NC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 517199792 BVUVZSXLDUZOMU-IBGZPJMESA-N 390.961 5.007 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)n(C(C)C)c3C)n2)cc1 517800758 GLETVBIKPIOZLZ-IBGZPJMESA-N 393.512 5.308 30 20 GKED CC(C)c1nc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cs1 523274940 CNEMEALNRZSKDP-UHFFFAOYSA-N 393.487 5.120 30 20 GKED CC[C@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1SC[C@H](C)C#N 533256206 DTLRLAPMDWDFTM-WIYYLYMNSA-N 395.572 5.350 30 20 GKED CCC[C@@]1(C(F)(F)F)CCCN1Cc1ccc(OC)c(OCCCC#N)c1 539859182 UPGRZAPMTUSGMO-IBGZPJMESA-N 384.442 5.075 30 20 GKED N#C[C@@H](C(=O)c1ccccc1C(=O)c1ccccc1)c1nc2ccccc2s1 541199049 IXJFKICHKHAGJF-SFHVURJKSA-N 382.444 5.017 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccoc1)C1CCCCC1 542900414 XAQCJDRUSBKEHG-QGZVFWFLSA-N 397.544 6.041 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)s1 544854000 LQPDMUDGKBYKAF-UHFFFAOYSA-N 390.508 5.769 30 20 GKED N#CCCC[C@H](N[C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 556205766 MQUSHLLVLYNHCL-BAGYTPMASA-N 377.488 5.331 30 20 GKED C=CCN(CCC(=O)Nc1ccccc1-c1ccccc1)Cc1cccs1 557577557 UGRSPUBEEOHIDC-UHFFFAOYSA-N 376.525 5.432 30 20 GKED CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 558511515 PONWXFSFTARNQP-HRAATJIYSA-N 378.476 5.178 30 20 GKED C=CCC(C)(C)C(=O)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1 559882469 XZJMUZMKAQVEND-UHFFFAOYSA-N 392.286 5.182 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1cccs1 570539878 WJZWYQMAEXJAFG-KBXCAEBGSA-N 385.558 5.615 30 20 GKED C=CCCO[C@H](C)c1nc([C@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 577680846 WYHSFOWMISQTOB-IAQYHMDHSA-N 388.361 5.007 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc(C#N)c(Br)c2)s1 583717275 KUKUZJGELCEGIY-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c1 589741145 ULZHTBZQJQAXBO-HXUWFJFHSA-N 378.476 5.037 30 20 GKED O=C(Nc1cc(F)ccc1Cl)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 590338800 LPOIQVURFOMEJN-HTQZYQBOSA-N 392.702 5.074 30 20 GKED N#CCCC[C@@H](NC(=O)c1cccc(Oc2nccs2)c1)c1ccccc1 590477674 GPUSIHMCBJQQGT-LJQANCHMSA-N 377.469 5.100 30 20 GKED CCOc1ccc(N(C(=O)CCCCC#N)c2nc3ccccc3s2)cc1 593941982 QOIRSWAJGOUKKF-UHFFFAOYSA-N 379.485 5.444 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCCc1c[nH]c2ccccc12 594317483 SOIPRWVVJUSVED-UHFFFAOYSA-N 387.936 5.213 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)C1 596663127 ZHPSCAWDSJXCSB-KRWDZBQOSA-N 399.441 5.036 30 20 GKED Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1N[C@@H](C)c1cccc(C#N)c1 600847260 BERWZSLQDOXPDZ-SCTDSRPQSA-N 375.516 5.158 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Cl)c2ncccc12 603447474 UNNCZGLSRGIPJG-UHFFFAOYSA-N 383.838 5.679 30 20 GKED CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610015347 FZEJMIBZFRKAOE-JXFKEZNVSA-N 378.476 5.178 30 20 GKED Cc1nc(CSc2ccc(C(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)cs1 610362976 SPCNQHXHFUOJHM-AWEZNQCLSA-N 393.537 5.107 30 20 GKED C[C@@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 611803684 XQCGMJCYBMZITD-QZTJIDSGSA-N 394.478 5.218 30 20 GKED COc1ccc(Cl)cc1-c1nc(S[C@@H](C#N)c2ccc(Cl)cc2)n[nH]1 619864083 PGGOMWBALBCJBU-HNNXBMFYSA-N 391.283 5.144 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1(C(F)(F)F)CCCC1 666820805 CJCJOXTYKXZRRR-MYJAWHEDSA-N 399.297 5.135 30 20 GKED N#C[C@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1ccc2ccccc2n1 684629636 ATRLFSFTPKDDQO-IBGZPJMESA-N 389.414 5.533 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)C 729888864 JWZGSCGKJONODJ-HKUYNNGSSA-N 378.472 5.199 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 736448788 VXBFRALVXRVXAO-LBPRGKRZSA-N 378.328 5.125 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)cc1 739156591 ZJMMKMCLCPXHJO-MAUKXSAKSA-N 382.891 5.305 30 20 GKED CCOc1cc(/C=C\C(=O)c2scnc2C)ccc1OCc1ccccc1 745625575 BTDCKSLPIFQBKP-LUAWRHEFSA-N 379.481 5.325 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746126352 XDBQUMSNJUPEER-QFIPXVFZSA-N 393.446 5.558 30 20 GKED O=C(/C=C/c1cncc(F)c1)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 750215410 GUYSKJKUEAFMMF-LLYBFZRZSA-N 393.258 5.100 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2cc(Cl)ccc2Cl)cc1OC 750896510 QQOHNBLKBCWXGB-VMPITWQZSA-N 381.255 5.305 30 20 GKED CC(C)CN(CCC#N)C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 751374768 RJPJYYGIHPWMRN-UHFFFAOYSA-N 396.343 5.058 30 20 GKED O=C(/C=C/c1cnc(-c2ccccn2)s1)c1ccc(SCC(F)F)cc1 753144713 RDNLVKVCNPLCRM-CMDGGOBGSA-N 388.464 5.458 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1cnn(Cc2ccccc2)c1 760272819 KCJJHWAUEWBDCE-CMDGGOBGSA-N 377.494 5.013 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2csc(Cl)c2Cl)SC1=S 760989636 NJTXCONMLSANLS-WZUFQYTHSA-N 397.333 5.332 30 20 GKED N#Cc1ccc([C@@H](O)CSc2nc(-c3cccs3)nc3ccccc23)cc1 763226184 XDAAVVXWKXOCRE-SFHVURJKSA-N 389.505 5.056 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc2[nH]ccc2c1)c1nc2cc(Cl)ccc2s1 765917161 ZARJKBQGRQPSSW-PRSOIBJXSA-N 377.856 5.321 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 768396089 ZAQMMUCMHIBMFM-OAQYLSRUSA-N 391.467 5.018 30 20 GKED C[C@H]1CSc2ccc(Br)cc2[C@@H]1NCc1cc(C#N)ccc1F 775413133 WZPRIXMDOIXGPP-BBATYDOGSA-N 391.309 5.033 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)Nc3ccccc3O[C@@H](C)C#N)sc2c1 780152308 SRTDKOXQBAZJQJ-ZDUSSCGKSA-N 398.915 6.221 30 20 GKED Cc1cc(C)cc(-n2c(C)cc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c2C)c1 781034657 MUVDCDDWLVCCCH-SFHVURJKSA-N 387.483 5.254 30 20 GKED CCC(=NNc1nnc(-c2ccccn2)s1)c1ccc(Cl)c(Cl)c1 788030630 QAZDSIWGSQSCKX-UHFFFAOYSA-N 378.288 5.133 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2F)cc1 792925520 SGLYIBDDIPMNFL-VAWYXSNFSA-N 379.456 5.152 30 20 GKED CC(/C=C\C(=O)c1ccc(C(=O)N(C)C)cc1)=C\c1ccccc1C(F)(F)F 792926364 QDGXUMVJLBRVCC-GVFKXKCCSA-N 387.401 5.250 30 20 GKED CC(C)n1nccc1/C=C1\CC[C@H](C2CC2)/C(=C\c2ccnn2C(C)C)C1=O 794942600 PIKUOWLEMLXSPB-QWDMSHHASA-N 378.520 5.098 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)C[C@@H]2CCC(F)(F)C2)cc1 797850777 WGNMCCFULSQSKY-AWEZNQCLSA-N 386.398 5.123 30 20 GKED N#C[C@@H](C(=O)CC1CC(c2ccccc2)C1)c1nc2cc(Cl)ccc2s1 798816303 KGFWRSKFTAAXEG-PGEKIEPBSA-N 380.900 5.710 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccco1)Cc1ccccc1O 800576679 UKBWGZPDZBDTGJ-UHFFFAOYSA-N 376.456 5.338 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3cccnc3)CCCC2)cc1 808238608 ABTJTOPKJVVKEM-HSZRJFAPSA-N 381.479 5.188 30 20 GKED C[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCOC2=O)cc1 815634233 GQMLTSCZJGJACH-SBUREZEXSA-N 389.499 5.023 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCCOC2=O)cc1 815636663 YQMCLRBVEBYENX-PGRDOPGGSA-N 377.488 5.119 30 20 GKED CC(C)(C)OC(=O)N1Cc2ccc(NCc3ccc(C4(C#N)CC4)cc3)cc2C1 850315567 FOVLBFYRSBYVQL-UHFFFAOYSA-N 389.499 5.105 30 20 GKED C=CCC[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)cc1C)C(=O)O 901691339 WKSLUZSCKVLPDJ-QGZVFWFLSA-N 377.843 5.089 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353984 SKFSBUWYHPTAKP-OAQYLSRUSA-N 391.421 5.284 30 20 GKED Cc1csc([C@H](C#N)C(=O)COc2ccc(C(C)(C)C)cc2C(C)(C)C)n1 916843705 DHRHSZHQGAMUJA-MRXNPFEDSA-N 384.545 5.302 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2csc3ccccc23)cc1 916914654 QCPSMFMGTKERAT-GOSISDBHSA-N 376.481 5.205 30 20 GKED O=C(O)c1cc(NN=CCCCc2cccc(C(F)(F)F)c2)ccc1Cl 1776033616 JACUYBFFWREUMN-UHFFFAOYSA-N 384.785 5.478 30 20 GKED CC(C)Sc1cc(Br)ccc1C=NNc1cccc(C(=O)O)c1 1776037109 WZNRRIPPJXMGBU-UHFFFAOYSA-N 393.306 5.094 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1ccccc1C(F)(F)F 1776180537 HYVRTSXNUGPPLL-QGZVFWFLSA-N 383.797 5.173 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2ccccc21 1776308642 JCXFNMWTKBYMQN-WLJFKGHSSA-N 388.488 6.133 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(-c2ccccc2C)ccc1OC 1776783773 JOTBXGJDVAIDKL-QFIPXVFZSA-N 397.559 5.964 30 20 GKED CCOc1cc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)ccc1OCC(C)C 1776914588 DEXOZBDIEJLGKS-JXMROGBWSA-N 382.456 5.023 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1F 1777403203 OWDBMHFZYBSPMM-VQHVLOKHSA-N 382.412 5.402 30 20 GKED Cc1ccc(-c2cccc(/C=C3\CCCc4cc(C(=O)O)ccc4C3=O)c2)cc1 1777429765 SWWOZAMJULRDLW-PXLXIMEGSA-N 382.459 5.963 30 20 GKED O=C(/C=C\c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2Cl)s1 1777570036 FGLYPAVJVPFVCF-VURMDHGXSA-N 386.831 5.802 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(C#N)cc1 26127928 YVYAXNAFVRWVJS-INIZCTEOSA-N 383.476 5.072 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2cccnc2)c(C)c1 63394431 WBIRTCHLIJTDGQ-UHFFFAOYSA-N 398.466 5.274 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cc(C#N)ccc2OC(C)C)c1 65839509 SFUQRIFEZLQSMM-QGZVFWFLSA-N 380.488 5.183 30 20 GKED CC[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1nc(C)cs1 66905991 AQPUKMHAYIUKAW-OAQYLSRUSA-N 377.513 5.143 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(COc3ccccc3)cc2)c1 71975037 KOUUTQNEQXLGEZ-UHFFFAOYSA-N 386.451 5.200 30 20 GKED N#CCCCOc1cccc(NC(=O)c2sccc2-c2ccc(F)cc2)c1 116061589 WQFVCGYZQIZGQV-UHFFFAOYSA-N 380.444 5.489 30 20 GKED Cc1cncc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 130756497 HEMQSKYWNCQRNR-HXUWFJFHSA-N 390.874 5.021 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 150872867 RPHSMYRYTWANLB-NEPJUHHUSA-N 387.270 5.327 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCOC2(CCCCCC2)C1 151062690 MTPOUPBJARMOGI-KRWDZBQOSA-N 387.549 5.038 30 20 GKED C[C@H](N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccc(C#N)cc1 154342337 HCXMYBQYXBKEQT-RYUDHWBXSA-N 382.357 5.173 30 20 GKED N#C[C@@H](C(=O)c1ccnc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 161962201 SPNGIFZVTDNORI-KRWDZBQOSA-N 389.867 5.502 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)Nc2ccccc2O[C@@H](C)C#N)s1 180076311 SXLMOBQGYXEQOW-HNNXBMFYSA-N 395.484 5.175 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(OCC#N)cc1 181598202 LEVZIRIDXMHXOL-CJAUYULYSA-N 382.463 5.775 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCOc1ccc(OC)cc1 191415624 KVTWCMMQRKXTCM-UHFFFAOYSA-N 382.504 5.090 30 20 GKED CC(O)=Nc1cccc([C@@H](C)/N=C(/O)N2Cc3ccccc3C3(CCC3)C2)c1 329224595 ZYYYEVQEAVIJRM-MRXNPFEDSA-N 377.488 5.207 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)CC(O)=N1 329398383 AIRYZNZNELRPRQ-YQYZPQCESA-N 396.453 5.833 30 20 GKED Cc1cc(N2CCCCCC2)ccc1N/C(O)=N/[C@H]1CCCC12CCOCC2 329422192 HKMOSIUASOHLPG-NRFANRHFSA-N 385.552 5.051 30 20 GKED COc1ccc(F)cc1[C@H](C)/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329430861 IHVKIFJXSNNWDG-DOTOQJQBSA-N 399.510 5.359 30 20 GKED C[C@@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CCC2 410886170 FNXWXYCARIPEAY-XERWBJCMSA-N 387.508 5.157 30 20 GKED Cc1cn(-c2ccccc2Cl)nc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430607645 CQKJCCJFXMGXHD-ZDUSSCGKSA-N 398.919 5.078 30 20 GKED N#CCC1(CN[C@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 430747281 LLNMWKKGLCKMLS-GOSISDBHSA-N 376.834 5.314 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)c1nc2ccccc2[nH]1 433106647 SFLBHCGNBDBENB-FQEVSTJZSA-N 390.446 5.056 30 20 GKED Cc1cc(C)cc(C[C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 438078177 WRSFPLDBDKKPSD-MSOLQXFVSA-N 381.545 5.308 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)c1 442688849 QAUJGJSQUFGKKK-KRWDZBQOSA-N 382.872 5.271 30 20 GKED C=CCN(C(=O)[C@H]1SCCc2sccc21)c1nc(-c2ccccc2)cs1 443819625 ZYNGXJXTXLGHOK-SFHVURJKSA-N 398.578 5.421 30 20 GKED CC(C)Oc1ccc(N(C)C(=O)c2cn(CCCC#N)c3ccccc23)cc1 444407825 PZHZQBFMTSXQCW-UHFFFAOYSA-N 375.472 5.009 30 20 GKED COc1ccc(C)cc1[C@@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 459403419 QJYPXRXPWBWJND-HZPDHXFCSA-N 383.517 5.138 30 20 GKED C=C(C)Cn1c(-c2ccc(C#N)cc2)nnc1N1CCC[C@H]1c1ccc(C)s1 460372268 DTCZPRPCGUSYKP-IBGZPJMESA-N 389.528 5.104 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 461688946 PGVKLIMCSKLLNJ-MRXNPFEDSA-N 375.394 5.055 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 463148368 SCLYPKOCOAWHBQ-AWEZNQCLSA-N 393.468 5.157 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCC(F)(F)F)cc1Cl 466455494 ZELYFBZRZSFACM-HNNXBMFYSA-N 381.785 5.069 30 20 GKED CCO[C@@H](CCNC(=O)Nc1ccccc1SC[C@H](C)C#N)C1CCCC1 473631781 ZLOIPLYVZSPSOD-APWZRJJASA-N 389.565 5.045 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)c3ccc(C(C)(C)C#N)cc3)oc12 474289512 FDOSDSFWNLZSER-HNNXBMFYSA-N 376.456 5.124 30 20 GKED COc1ccc2oc([C@@H](C)NC(=O)C[C@@H](CC#N)c3ccccc3)c(C)c2c1 475647714 MELZUMBAFZALNC-SJLPKXTDSA-N 376.456 5.015 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 475732109 GIZWNHJFCBDTKZ-UHFFFAOYSA-N 375.472 5.137 30 20 GKED CO[C@@H](C)c1nc(CN(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)cs1 476825080 IAXRWVVWXVIVGZ-INIZCTEOSA-N 395.503 5.377 30 20 GKED CC(C)CN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@@H]1CCCc2cccnc21 479721932 XZIAJVSIBHZENP-LJQANCHMSA-N 393.535 5.077 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3ccc(C#N)c(F)c3)C2)nc2ccccc21 484073947 PWOLYVKGCAMCJK-IBGZPJMESA-N 376.479 5.008 30 20 GKED Cc1ccc([C@H]2C[C@H](C)N(C(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)C2)cc1 486640343 NMUFYDKYCNTIRR-AVRDEDQJSA-N 397.478 5.072 30 20 GKED Cc1cc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)ccc1F 487921937 WYBNVPFEBMWITB-UHFFFAOYSA-N 376.456 5.550 30 20 GKED Cc1cc(CN[C@@H](c2c(C)nn(-c3ccccc3)c2C)C(F)(F)F)ccc1C#N 488166766 VJSHXXBCJNAFIX-NRFANRHFSA-N 398.432 5.062 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c(C)o1 496094341 RIFFNBPZPPDFAK-LBPRGKRZSA-N 392.267 5.212 30 20 GKED N#Cc1ccc(C(=O)Nc2c(Oc3ccc(Cl)cc3)ccc3ncccc23)[nH]1 497458283 HTBDFASSKGRWRF-UHFFFAOYSA-N 388.814 5.133 30 20 GKED COc1ccc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(OC)c1 503196173 GBCQYZBLVPJQCN-UHFFFAOYSA-N 389.411 5.012 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC[C@H](c2ccccc2F)C1 504123871 WUAONBMCWNNDAC-VQTJNVASSA-N 398.526 5.027 30 20 GKED N#C[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccc1F 505942223 HIGCKXKIGMILPP-CYBMUJFWSA-N 379.243 5.342 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2F)cc1Cl 510006339 PKRYGOBUGGMBKX-IBGZPJMESA-N 393.849 5.456 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)c2cc(C#N)ccc2Cl)cc1 513466507 GUPPENBGWQSWSP-OAHLLOKOSA-N 390.870 5.378 30 20 GKED Cc1ccc(SCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 515157465 RCYIAONWRUKQEA-UHFFFAOYSA-N 389.480 5.093 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1c(Cl)cccc1Cl 517343641 LKDFEPBDKZCRFR-ZDUSSCGKSA-N 379.630 5.388 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1ccccc1Cl 517708088 AWKDGHADXMYGQG-UHFFFAOYSA-N 377.831 5.956 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)sc1C 518516797 YZTOPTMDYJTWGU-QGZVFWFLSA-N 396.537 5.631 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCc1ccc(Cl)cc1 518683156 KKSOCQOHRJYBMS-OAHLLOKOSA-N 387.936 5.346 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1 518754606 TVTZOOROFKONQO-BTYIYWSLSA-N 397.519 5.883 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 518754609 TVTZOOROFKONQO-YCRPNKLZSA-N 397.519 5.883 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)cc2)c1 519507447 YKKBBZPLKIMUKH-RTBURBONSA-N 388.389 5.658 30 20 GKED CCC1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 522090207 WZPZNBCPLHPUMQ-FQEVSTJZSA-N 381.907 5.649 30 20 GKED CC[C@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1nc2ccccc2[nH]1 524113545 VXZFCESLLXXXNT-FQEVSTJZSA-N 395.466 5.059 30 20 GKED Cc1c([C@H](C)Nc2cccc(OCCCC#N)c2)cnn1-c1cccc(Cl)c1 537428421 ZCSUVVZATNGBCU-INIZCTEOSA-N 394.906 5.690 30 20 GKED CCOc1ccc([C@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc2)cc1 537434154 ZADGBCWSSZDINZ-XMMPIXPASA-N 396.490 5.160 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1 539627855 NLDKTVGFYXGBPG-SFHVURJKSA-N 394.519 5.416 30 20 GKED C[C@@H](NCc1ncc(-c2ccc(F)cc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 541086612 YLVLYHWRBIRROU-QGZVFWFLSA-N 397.453 5.870 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542060192 BDUPLQZANPLXEM-ROUUACIJSA-N 376.500 5.188 30 20 GKED N#Cc1ccc(CN(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)C2CC2)cc1 542378735 UZVFUJASLFFFHO-NRFANRHFSA-N 379.891 5.037 30 20 GKED C=CCC[C@H](NC(=O)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1 542535465 PYVWXCHMKAFBBR-FDFHNCONSA-N 382.479 5.053 30 20 GKED CNc1ccc(Cl)c(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 553314795 ZPTQUFUQBBYRGC-UHFFFAOYSA-N 391.858 5.085 30 20 GKED C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555005095 GYYLRUCVJMKZKP-HXOBKFHXSA-N 398.466 5.155 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1sccc1-c1ccc(C)cc1 557587374 CLEZKTMVQWOUSW-UHFFFAOYSA-N 381.497 5.027 30 20 GKED CC(C)(C)c1ncsc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2 573184444 NNMCYXDHYTZFPH-UHFFFAOYSA-N 395.509 5.185 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc(C(F)(F)F)n3)n2)cc1 576257638 SDNVTQIFOFDENK-LLVKDONJSA-N 393.415 5.084 30 20 GKED N#C[C@H](C(=O)c1csc(-c2c(F)cccc2F)n1)c1ccc2ccccc2n1 587988665 ATPRYWVABALIKC-ZDUSSCGKSA-N 391.402 5.127 30 20 GKED C[C@@H](c1ccccc1)n1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cn1 592025097 IGRMTCXNZCBACX-AVRDEDQJSA-N 387.487 5.049 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)CCCCC#N 593985551 CXSOFECZZLGETG-UHFFFAOYSA-N 392.478 5.754 30 20 GKED N#CCC1CN(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)C1 596703853 AVWBORROJYJOGR-UHFFFAOYSA-N 393.340 5.014 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)C(F)(F)F 599431867 RMQZMJYFDQFUEO-CQSZACIVSA-N 378.369 5.128 30 20 GKED COc1cccc(N2C(=O)c3ccccc3N[C@H]2c2ccc(C3(C#N)CC3)cc2)c1 602759574 MSHOIEPYRBNSKR-HSZRJFAPSA-N 395.462 5.021 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2sc(C)c(C)c2C#N)cc1OC 603445164 NYCQUECYXYXUKK-UHFFFAOYSA-N 392.908 5.330 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCc1cccs1 603533221 UCEDXQWBQBNSBF-UHFFFAOYSA-N 378.472 5.233 30 20 GKED C[C@H](S[C@H]1CCCc2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2 608801719 JWGMNGOLCOUWFR-UGSOOPFHSA-N 382.554 5.246 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCC[C@@H]1c1ccccc1 609555978 PAXVNMAMXVVTPV-QRQLOZEOSA-N 379.529 5.539 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)o1 609589225 QRUQMYLWPAEVTG-PVXIVEMSSA-N 377.271 5.023 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609640452 ODVNUMNGUCSJTH-UHFFFAOYSA-N 390.870 5.063 30 20 GKED CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 610121421 SUHOEAHGGJIUDI-HXUWFJFHSA-N 377.488 5.176 30 20 GKED N#Cc1nnc2ccccc2c1Sc1nc2cc(C(F)(F)F)ccc2s1 610129284 WSNICYXXSWFOCV-UHFFFAOYSA-N 388.399 5.281 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCC2(c3cccs3)CCCCC2)c(Cl)c1 611094757 WKHDAOVKNQDDLS-UHFFFAOYSA-N 393.339 5.558 30 20 GKED Cc1cc(Oc2ncccn2)ccc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 611096753 DXUXTCFOGUITPG-UHFFFAOYSA-N 399.237 5.008 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc2ccccc2n1 613290824 NHWSNPGWCCFIEH-CQSZACIVSA-N 397.286 6.246 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccccc3)cc2)cc1 626583441 LTXYLKXDJLDFDE-UHFFFAOYSA-N 387.439 5.039 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3cccs3)c2)[C@@H]1c1cccnc1 644980450 SVPQOSMGAQQRTI-OAQYLSRUSA-N 387.508 5.158 30 20 GKED COc1ccc2ccc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)cc2c1 645959991 VOVFEAACRAIYJL-KRWDZBQOSA-N 376.412 5.087 30 20 GKED CC(C)c1ccc(C=NOCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1 726595224 ZZBRXQFVWOYBMD-UHFFFAOYSA-N 390.270 5.718 30 20 GKED N#CCCCOC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 728112580 PSWLNSPIDKKAEH-UHFFFAOYSA-N 380.875 5.123 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(-c2ccccc2F)no1 729270137 JABBIURIVMKCEB-UHFFFAOYSA-N 383.382 5.272 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)cc1Cl)c1nc2cc(F)ccc2s1 730418421 VFXMUGNSKAZKOR-CYBMUJFWSA-N 393.270 5.551 30 20 GKED C#CCOc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 733328609 WDEJRUJEGKLWJF-HXUWFJFHSA-N 392.499 5.128 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(N2CCCCC2)c1 746666248 AHGMHSQQSYOWJD-UHFFFAOYSA-N 390.531 5.239 30 20 GKED C#CCCCC(=O)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 758063745 WQHJANNXOICZQF-UHFFFAOYSA-N 377.897 5.023 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCc2cccc(Br)c2)n1 761242103 YIFNXMPZHMKBNA-HNNXBMFYSA-N 391.334 5.228 30 20 GKED CC[C@H](C)n1c(Sc2snc(Cl)c2C#N)nnc1-c1ccccc1 771192134 QQCIGBAOKWINCS-JTQLQIEISA-N 375.910 5.049 30 20 GKED N#Cc1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c(F)c1 772804585 CTBBVQZZJNRZQO-AQTBWJFISA-N 384.435 5.731 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H](C)CCCc1ccccc1 776076504 HAIOOYKOBULNKK-PGRDOPGGSA-N 390.527 5.118 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCCC(C)(C)C#N 776378541 KHICKSOKBQJHLL-CYBMUJFWSA-N 392.908 5.100 30 20 GKED O=C1/C(=C/c2cccc(Br)n2)CCc2nc(-c3ccccc3)sc21 777916876 RXAUJJALOWJXGQ-ACCUITESSA-N 397.297 5.180 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1CNc1ccc(OCc2cccc(C#N)c2)cc1 779594108 FITSTPSPNSLMLP-UHFFFAOYSA-N 388.515 5.318 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(Cl)ncc3Cl)cc2)cc1 780485023 OUODDIMWKAIRQT-UHFFFAOYSA-N 384.222 5.305 30 20 GKED FC(F)(F)c1nc(Cl)ccc1CON=Cc1ccc(Br)cc1 786737635 FPLZQBWLNIRJLT-UHFFFAOYSA-N 393.590 5.067 30 20 GKED N#C[C@@H](C(=O)CCCc1ncc(-c2ccccc2)o1)c1nccc2ccccc12 792092069 ORKZFGJKJXKEGG-FQEVSTJZSA-N 381.435 5.089 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccccc1-c1nc2ccccc2s1 800248794 YIYYXJMKVSSCDC-YPKPFQOOSA-N 381.460 5.487 30 20 GKED CC1CCN(c2ccc(CNCc3ccc(C#N)cc3C(F)(F)F)cc2)CC1 810143465 HJDAIJBFJHPWRR-UHFFFAOYSA-N 387.449 5.103 30 20 GKED C[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCCC2=O)cc1 810262667 VJMZKRHBMFBJRJ-KOSHJBKYSA-N 387.527 5.193 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C34CC(C(F)(F)F)(C3)C4)n2)cc1 810532240 PQSSDJBFFOYOEJ-NLNFPOJYSA-N 376.403 5.027 30 20 GKED CC(C)(Cc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813214232 UWUZUFRPBXZBTR-HNNXBMFYSA-N 380.797 5.199 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1COC(=O)CCCCC#N 848865825 COWNCBHYVDAAGY-UHFFFAOYSA-N 382.407 5.265 30 20 GKED CCC(=O)N(C)c1ccc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 878675895 MCSLBIPGYWBNRB-HNNXBMFYSA-N 396.516 5.098 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2cccc(Cl)c2)cc1 916948527 HOTHFNFOMQYDKS-YWZLYKJASA-N 382.891 5.134 30 20 GKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1cc2cc(Br)ccc2o1 917143389 ZYEAFNMGYREUSP-IWQZZHSRSA-N 378.203 5.061 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Cc3cccc(F)c3)n2)cc1 921132356 PYUHSOKOJDJCDS-HNAYVOBHSA-N 378.472 5.313 30 20 GKED O=C(O)c1ccc(NN=Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 1776074480 CUGDXBDKTVBTHY-UHFFFAOYSA-N 394.246 5.008 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776119820 MRJJRJSKCDWPPI-WYMLVPIESA-N 390.504 6.307 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(C2CCCC2)cc1 1776354712 XIMRSEWXDNWNCI-LCYFTJDESA-N 378.468 5.726 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1776365008 HXMODIITJXYYRF-BYIUCRAPSA-N 386.900 5.679 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-n2cc(Cl)c(C)n2)cc1 1776783102 XYZFIYNURYXDOM-SFHVURJKSA-N 391.943 5.128 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)nn(-c2ccccc2C)c1C 1776783337 RBGBRKODCLHBLK-FQEVSTJZSA-N 385.552 5.091 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C3(F)CCC3)CCC2)cc1 1789625756 XSEWFHGWGGNAJT-UHFFFAOYSA-N 386.511 5.005 30 20 GKED Cc1ccc(-n2c(SCc3ccccc3C#N)nnc2-c2ccncc2)cc1C 5231080 XYAXOSWVRLNYEA-UHFFFAOYSA-N 397.507 5.110 30 20 GKED COc1cc(C#N)ccc1OCc1csc(-c2ccc(C(F)(F)F)cc2)n1 25183166 ZTMUGIFGMYWCKF-UHFFFAOYSA-N 390.386 5.288 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nc2ccccc2c1=O 31648545 MVTCJQJBCOIRPW-UHFFFAOYSA-N 393.899 5.076 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(F)c(F)cc3Cl)c2)c1 31777079 ANVQRNDZZZCKHZ-UHFFFAOYSA-N 398.796 5.321 30 20 GKED Cc1ccc(-c2nc(CSc3nc(C)cc(C(F)(F)F)c3C#N)co2)cc1 45901664 AQGJYQJAOJVDEB-UHFFFAOYSA-N 389.402 5.536 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1[nH]c2ccc(Br)cc2c1Cl 58287618 STKSTBZUSPJVSE-UHFFFAOYSA-N 388.652 5.016 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(Br)c1 66800147 STKIHGQXVGHMNE-CYBMUJFWSA-N 389.318 5.025 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(OC(F)(F)F)cc1 66801047 PRONTGYRLQPFBI-CYBMUJFWSA-N 394.418 5.161 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)C(=O)Nc1c(F)cccc1F 66903742 OLOGLCULYYWLLN-CQSZACIVSA-N 393.393 5.068 30 20 GKED CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 69032053 VJIMIGCVKOBTEQ-AZUAARDMSA-N 397.906 5.028 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccn3)cc2)cc1 69202946 JWNUZXREEBTKKN-QFIPXVFZSA-N 384.439 5.115 30 20 GKED N#CCSc1ccccc1NC(=O)CSc1ccc(-c2ccccc2)cc1 71962631 HZBOOUSYSIFYEJ-UHFFFAOYSA-N 390.533 5.700 30 20 GKED CCN(Cc1ccc(C(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc1)C(C)C 110123270 UVVBMWPIVIKVRL-LJQANCHMSA-N 377.532 5.012 30 20 GKED N#C[C@H](C(=O)C1CCC(F)(F)CC1)c1nc(-c2ccc(Cl)cc2)cs1 136725642 YALGKGLQAPMYES-CQSZACIVSA-N 380.847 5.465 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 159985694 CAHMRRBALYQTNT-OXQOHEQNSA-N 379.529 5.480 30 20 GKED CC[C@@H](CC#N)NC(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 162613215 LSLKBHLIBSKHAT-HNNXBMFYSA-N 382.464 5.225 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 167851151 QUUODEIENPDNQP-QHCPKHFHSA-N 398.466 5.423 30 20 GKED CC(C)c1csc([C@@H]2CCCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)n1 174905801 DWQSRSYWOFBTMT-MRXNPFEDSA-N 396.560 5.479 30 20 GKED COc1cc([C@H](C)NCc2ccc(C#N)cc2F)ccc1OCc1ccccc1 178782938 GIDNFPXHACZWDA-KRWDZBQOSA-N 390.458 5.136 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)Nc3ccccc3O[C@@H](C)C#N)oc12 180026055 PBRDWSMOEWNYEW-GJZGRUSLSA-N 393.443 5.005 30 20 GKED Cc1ccc(F)cc1CSCC(=O)Nc1ccccc1SC[C@H](C)C#N 187533480 NHRBTTBJPJPKRN-CQSZACIVSA-N 388.533 5.258 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)Nc2ccccc2)cc1 189873302 XZCOLOWHONSKIF-UHFFFAOYSA-N 398.506 6.043 30 20 GKED C=CCn1c(SCc2cnc(C)s2)nnc1-c1ccc(C(C)(C)C)cc1 195595267 WOWNVSXIHCTTGZ-UHFFFAOYSA-N 384.574 5.486 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2cc(-c3ccccc3)on2)c1 237838694 GAEKNOQBHKZLFD-UHFFFAOYSA-N 395.462 5.082 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2cccc(OC(F)F)c2)c1 237909182 KXYQFWRVKAEYKM-UHFFFAOYSA-N 394.421 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@H]1c1nccn1CC 281022150 MMTRBPVVGPJELG-FQEVSTJZSA-N 380.536 5.514 30 20 GKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(OCc2cccnc2)cc1 301247952 BFKIVJTXCVOAFV-CQSZACIVSA-N 398.388 5.119 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3Cc3ccccc3)cc2)c1 303400768 ZZIBJWZFJZMYBO-QFIPXVFZSA-N 397.478 5.590 30 20 GKED COc1c(N=C(O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)cc(Cl)cc1C(=O)N(C)C 329150354 RMHWIHPNVAWXNC-QLFBSQMISA-N 392.927 5.245 30 20 GKED CCc1cccc(C)c1N=C(O)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 329431780 INALORSITPFTJW-IBGZPJMESA-N 395.551 5.148 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2C/N=C(/O)c2cn(C)nc2C2CCCCC2)cc1 329787886 ZBZQWYNWPDCYTC-REWPJTCUSA-N 395.547 5.249 30 20 GKED N#CCCC[C@H](NCCC(=O)Nc1c(Cl)cccc1Cl)c1ccccc1 411759031 PKQAPRABLZJRSZ-SFHVURJKSA-N 390.314 5.347 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425660397 XGFFOJLKVRBNMX-HZPDHXFCSA-N 378.501 5.035 30 20 GKED CC1(C)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)[C@@H]1c1cccnc1 430105703 VHKBWEIMBCZZRA-XMMPIXPASA-N 383.495 5.115 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)o1 431399134 ZOCFUMAWUMAZRC-UHFFFAOYSA-N 395.846 5.505 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(N2CCCCCC2)c1)c1ccccc1 432950831 SFSMVEPBALBLQE-HSZRJFAPSA-N 390.531 5.624 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OC2CCC2)c(F)c1)c1ccccc1 432995879 RZWLBYAYICLNNK-HXUWFJFHSA-N 381.451 5.314 30 20 GKED C=CC1CCN(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)CC1 433790137 UDSPHMALLILOND-UHFFFAOYSA-N 381.423 5.259 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)Nc2ccc(F)c(C#N)c2)cc1 437974802 DSJIQQKUKGZZDQ-OAHLLOKOSA-N 389.430 5.256 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 438200858 KHSBQWZKXNBMSO-MRXNPFEDSA-N 385.467 5.478 30 20 GKED N#CCC[C@@H](NC(=O)N1CCc2c(ccc(Cl)c2Cl)C1)c1ccccc1 438846731 KQJUSWVOPRRHKP-GOSISDBHSA-N 388.298 5.106 30 20 GKED C[C@@H]1CC[C@H](CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)O1 439212276 FWVIIRCDAZGNOK-DNVCBOLYSA-N 398.890 5.077 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C#N)cc3Cl)s2)cc1 439461284 ZPYSDVGQQCJOMZ-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED CN(Cc1nnc(-c2cccc(C#N)c2)o1)c1ccccc1Oc1ccccc1 439966194 SNJUBXGUMKFQJM-UHFFFAOYSA-N 382.423 5.037 30 20 GKED N#CCC[C@@H](NC(=O)N1CCSC[C@@H]1c1ccc(Cl)cc1)c1ccccc1 440245549 QTYHZMQAXZIXEF-WOJBJXKFSA-N 399.947 5.185 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)c1cccc(C#N)c1 442777611 DLVHYQMUZOHXIL-OAHLLOKOSA-N 375.859 5.637 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)N(C)CCC#N 443923904 ZTGYAZPGXNQDCO-UHFFFAOYSA-N 393.466 5.109 30 20 GKED Cc1cc(CN[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)ccc1C#N 443987207 KHPPBVPLJSFWQA-LJQANCHMSA-N 377.488 5.297 30 20 GKED C=CCCCC[C@@H](C)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 449249387 LWKKBIJPFWFWIJ-MRXNPFEDSA-N 382.470 5.035 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(Cc1ccc2ccccc2c1)C1CC1 460566795 TYQODPPUNJJTKT-JOCHJYFZSA-N 388.515 5.028 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 464954023 SNUIAYDDUOPKQJ-RCTAOEEJSA-N 380.491 5.242 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1cnc2ccccc2c1 470888448 MNTFUVQXTVUTQU-MRXNPFEDSA-N 375.497 5.058 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccc4ncccc4c3)cc2)cc1 471253580 XVJQLDOPEHZIQK-UHFFFAOYSA-N 394.434 5.220 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 475664430 YNYLQULZOSFMKU-CVEARBPZSA-N 383.923 5.797 30 20 GKED C=CCC1(C(=O)NC[C@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)CCC1 478587253 PDOYDWAOFWWQKU-OAQYLSRUSA-N 388.511 5.171 30 20 GKED C[C@@H](c1cc(F)ccc1F)N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482638431 SJOKYJWNQSJOSC-HNNXBMFYSA-N 392.405 5.462 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1cnc2ccccc2n1 483191677 BQELHFPGDWWKRZ-OAHLLOKOSA-N 389.867 5.502 30 20 GKED C[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 487384650 AZRLLAQRWFHLDY-OXJNMPFZSA-N 388.433 5.750 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)no1 488583009 AEOGCVQGDUEFLN-QGZVFWFLSA-N 379.847 5.359 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(-c4ncco4)cc3)cc2)cc1 500378663 ABROCRJXDOZQHG-UHFFFAOYSA-N 395.418 5.452 30 20 GKED C[C@@H](NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1)c1ccc(C#N)cc1 505285635 QCPDJACWPLYEAN-RTBURBONSA-N 383.495 5.139 30 20 GKED O=[N+]([O-])c1ccc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)c(F)c1 505901109 MSRUAAKGUKRHOS-CQSZACIVSA-N 396.262 5.146 30 20 GKED N#CCCN(Cc1cccnc1)Cc1ccc(-c2cccc(Br)c2)o1 505913919 XUAUDPHXLRIONU-UHFFFAOYSA-N 396.288 5.020 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)c2ncccc12 509477202 GERBMPJFELKFON-CYBMUJFWSA-N 381.888 5.392 30 20 GKED N#Cc1cc(NC(=O)[C@H]2C[C@@H]2C(F)F)ccc1Oc1ccc(C(F)(F)F)cc1 510052873 CXYWKXSCGIZDII-GJZGRUSLSA-N 396.315 5.209 30 20 GKED C[C@H]1CCN(C(=O)NCC(C)(C)CCC#N)[C@H]1c1ccc(C(F)(F)F)cc1 513118409 KKENNLYEZGRXSQ-WMLDXEAASA-N 381.442 5.128 30 20 GKED Cc1ccc(Cc2cnc(NC(=O)c3cccc(CC#N)c3)s2)cc1Cl 514031590 VGXQEQQAQOXVOV-UHFFFAOYSA-N 381.888 5.014 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)n1 516075091 USGCIMDVCAZOLR-LLVKDONJSA-N 393.320 5.977 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cs2)cc1 517457109 UPUDLMDNQZMUOI-HNNXBMFYSA-N 393.537 5.623 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCc3c[nH]c4ccccc34)c2)cc1 517844170 KTZHOJKHZLPWRV-UHFFFAOYSA-N 381.435 5.403 30 20 GKED Cc1cccc(C)c1OC[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 520197573 HKHMGCQTVAARAC-ZWKOTPCHSA-N 397.544 5.287 30 20 GKED N#Cc1ccsc1C(=O)Nc1nc(-c2ccccc2C(F)(F)F)cs1 522734548 WUCKWWZNYGFSPS-UHFFFAOYSA-N 379.388 5.014 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2nc3ccsc3s2)cc1 524006139 TWGXMISQPFMSBA-UHFFFAOYSA-N 391.477 5.061 30 20 GKED COc1ccc2c(c1)[C@H](N(Cc1ccccc1)Cc1cccc(C#N)c1)CCO2 525121600 VALYBOOHOUSZFK-XMMPIXPASA-N 384.479 5.093 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CC2CCC(=O)CC2)cc1Cl 530558172 BPICBBDRRIZXLC-HXUWFJFHSA-N 380.875 5.083 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1ccc(COc2ccc3ccccc3c2)o1 536079588 FSGKFEVEQRIGNL-QHCPKHFHSA-N 376.456 5.070 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)CCc2nc3ccccc3s2)cc1 540201297 CJHVQKPHQZPMLO-UHFFFAOYSA-N 397.503 5.084 30 20 GKED C=CCC(C)(C)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 551119022 MPDGNLWAGIJBTG-UHFFFAOYSA-N 378.394 5.111 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC1(c2cccc(C#N)c2)CC1 551812544 UZBWUCVWMZYNJN-HNNXBMFYSA-N 393.943 5.984 30 20 GKED C=CCN(CCC#N)C(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 557384069 OMYGQVWQNWHKGJ-UHFFFAOYSA-N 399.450 5.208 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3s2)ccc1NC(=O)NCCCCC#N 565446105 GTXMGVQACHRLJP-UHFFFAOYSA-N 382.464 5.226 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@H](Sc1ccccc1Cl)c1ccccc1 567385228 VQKDYRXJRNKTSX-LJQANCHMSA-N 386.948 5.620 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(-c4cccs4)o3)cc2)ccn1 570791585 FZDVRFWZBSTBME-UHFFFAOYSA-N 387.420 5.319 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)SCCOc1cccc(C#N)c1 575212316 QDGWVZOWGUSYGY-IRXDYDNUSA-N 382.529 5.211 30 20 GKED C[C@H](c1ccccc1)N(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)C1CC1 576535610 VRWOXIULRSWKBV-QGZVFWFLSA-N 386.451 5.096 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccccc2[C@@H](C)C1 593159109 JPSCNEZURDRCHI-IRXDYDNUSA-N 379.529 5.132 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1Oc1ccncc1 604691051 YOFDOQZBGNEFKW-FQEVSTJZSA-N 379.419 5.221 30 20 GKED C[C@@H](N[C@@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1)c1cccc(C#N)c1 608381777 MYJPYWSAJSSSKH-MZNJEOGPSA-N 379.463 5.314 30 20 GKED CN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1F 608798351 RLJZFVKNSBLAFQ-UHFFFAOYSA-N 390.258 5.012 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1coc2cc3c(cc12)CCC3 609377269 SSWWJVOUNRMWAQ-OAHLLOKOSA-N 390.508 5.354 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 609378524 RMBCVTZZOGJGKH-AWEZNQCLSA-N 392.446 5.843 30 20 GKED N#Cc1ccc(NCc2cccc(OCc3ccccn3)c2)c(C(F)(F)F)c1 609964629 NZJQAPIMFAIWMS-UHFFFAOYSA-N 383.373 5.163 30 20 GKED C[C@H](Nc1cccc(CSC2CCCC2)c1)C(=O)NC1(C#N)CCCCC1 610140358 XMBROACMWFVVSI-KRWDZBQOSA-N 385.577 5.005 30 20 GKED COc1ccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)cc1Cc1ccccc1 610318118 MPKDHJAIKQZRHQ-QGZVFWFLSA-N 385.467 5.040 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 610829958 UFKYXSXWQNOEKS-CABCVRRESA-N 377.469 5.607 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c2ccccc12 613318187 OWDHDGFQPJMEHF-HXUWFJFHSA-N 398.487 5.770 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 618742761 RJZZEFCDEJIAKQ-LJQANCHMSA-N 399.441 5.478 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N[C@H]2CCc3cc(C#N)ccc32)cc1 618745256 HHQIUHVTUSPINR-NRFANRHFSA-N 399.450 5.168 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)Nc1ccc(C(F)(F)F)cc1Cl 618754329 RVYQFRMSZIYUKT-HNNXBMFYSA-N 379.769 5.039 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 647373527 JTFCYXGOTFNDRY-CQSZACIVSA-N 399.928 5.596 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(C(F)F)nc1 657826528 HWWZTXXAFJQMOF-LSJOCFKGSA-N 390.318 5.579 30 20 GKED CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726488421 VBPDGXADYMBDQD-FXAWDEMLSA-N 399.947 5.008 30 20 GKED C=CCc1cc(CNCc2ccc(-c3ccc(F)cc3)o2)cc(OC)c1OC 729683414 NMDKTANKFWWNFJ-UHFFFAOYSA-N 381.447 5.121 30 20 GKED Cc1nn(C)c(C)c1C(=O)/C=C/c1cn(C(C)(C)C)nc1-c1ccccc1Cl 731159996 ZWTKLNMJIKBXDD-VAWYXSNFSA-N 396.922 5.205 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2sc3cccc(C)c3c2Cl)c1 733770323 GKBRKGKBRRACFS-OAHLLOKOSA-N 398.915 5.474 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3Cl)[nH]c12 735793798 ZABXMZZTUQFLEU-RBSFLKMASA-N 384.266 5.158 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)ccc1OC(F)F 741474644 XVNJRKSUYQHTBT-SOFGYWHQSA-N 395.405 5.645 30 20 GKED COc1cc(C(=O)/C=C/C=C/c2ccccc2[N+](=O)[O-])ccc1SC(F)F 750908741 GQOILCLRQSIRQZ-DLYLGUBQSA-N 391.395 5.370 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1nc2ccccc2s1 759184176 QXTLVUBIPJJJRZ-YDZSZYSISA-N 389.867 5.388 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(OCc3cccc(F)c3)c2)cc1 770497036 PFTKRSLSSOXGHS-KRWDZBQOSA-N 376.431 5.308 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2nc3ccccc3cc2C)cc1 776782942 OYZXUZZJBHRUTA-UHFFFAOYSA-N 389.503 5.253 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1 780670419 PWERTRYSKVIRCU-ZDUSSCGKSA-N 391.393 5.053 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(C)n1Cc1ccccc1 792098079 BAPDAFZVNVHVBP-HSZRJFAPSA-N 379.463 5.192 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(-c2ccc(OC(C)C)cc2)cc1F 795142866 LYBBTWPHXPHPEV-UHFFFAOYSA-N 378.403 5.305 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c(C)c1 797568396 HZXBACCRFRTNBM-QGZVFWFLSA-N 396.556 5.595 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)c2ccc(C)c(C#N)c2)cc1 799337710 NMUSGNYUUJMREP-DEOSSOPVSA-N 383.495 5.076 30 20 GKED N#C[C@H](C(=O)C1(CCF)CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810531030 FENCRSUNSPGTAI-GFCCVEGCSA-N 383.275 5.433 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@@H]1c1ccccc1)c1nc2ccccc2n1C(F)F 835072031 ADWLTRBBVHWLAX-IXDOHACOSA-N 379.410 5.192 30 20 GKED Cc1cc([N+](=O)[O-])c(C(=O)Nc2scc(C(C)(C)C)c2C#N)cc1Cl 839369324 KOXSJWPDUYABHS-UHFFFAOYSA-N 377.853 5.040 30 20 GKED CC[C@H](c1ccc(F)cc1F)[S@](=O)Cc1c(F)c(F)c(F)c(F)c1F 841720104 GFOPQUDGCQHNNJ-SSINHNECSA-N 384.316 5.060 30 20 GKED Cc1cc(NC(=O)C[C@@H](CC#N)c2ccccc2)ccc1NC(=O)OC(C)(C)C 856372234 JFWGZMKSFCKTPT-GOSISDBHSA-N 393.487 5.368 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 915354083 UZAUSUDHSMRNLD-HSZRJFAPSA-N 383.495 5.441 30 20 GKED CC(C)c1cccc(N2C(=O)/C(=C/c3cccc(OCC#N)c3)SC2=S)c1 917645375 XQUKLJKYWDANCB-UNOMPAQXSA-N 394.521 5.118 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cs1 1776380469 DIQKTYMOPHQGDI-SOFGYWHQSA-N 383.494 5.589 30 20 GKED COCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1777232521 TXDOYEQVJKPNHP-ZRDIBKRKSA-N 378.449 5.156 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1791243213 FQUZDXCWFYKWSH-DYESRHJHSA-N 394.490 5.044 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)sc1C)=C(/S)Nc1ccccc1 10170861 PBELSPNHOIYTHX-UHFFFAOYSA-O 395.573 5.266 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)CCc2ccc(C#N)cc2)cc1 10445401 OOUDLNNTGMVKBJ-UHFFFAOYSA-N 386.451 5.321 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)C(=O)c1cccc(Cl)c1 32789149 ITVWOYAEXWOEON-OAHLLOKOSA-N 397.931 5.072 30 20 GKED Cc1ccccc1CN(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161476 DCXKFRGKBXZMNW-UHFFFAOYSA-N 399.494 5.304 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 55429476 TWSNGRFFHVHJSK-UHFFFAOYSA-N 388.471 5.171 30 20 GKED C=CCN(C(=O)C[C@H](C)c1ccc(F)cc1)c1nc(-c2ccccc2)cs1 59850978 ABEOUKCRZZUQQM-INIZCTEOSA-N 380.488 5.662 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1Cl 66392869 WXAPIXIUBRFSIJ-KWBADKCTSA-N 379.209 5.043 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(Cl)s3)n2)cc1 66544649 GOMKYGZPXDLRKK-HNNXBMFYSA-N 397.912 5.206 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCO[C@H](C)c1ccccc1 66955137 YKWXCHUMHQFKIT-ZWKOTPCHSA-N 397.544 5.370 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C(=O)N1CCCCC1)c1ccccc1 108407399 NWUDCIOWUFNOGR-GCJKJVERSA-N 393.556 5.104 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1 120787417 PHSSOHVIYAKYCW-FUHWJXTLSA-N 378.501 5.247 30 20 GKED C[C@H](NC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccc(C#N)cc1 125818978 SHDPBKMZDQKVJS-INIZCTEOSA-N 399.454 5.085 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(F)ccc2Br)c(C#N)s1 154286552 DGZHYEYYAMZCHN-UHFFFAOYSA-N 381.270 5.071 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1nc(C)cs1 173116847 NLKNFZQMZBUWLQ-BFUOFWGJSA-N 388.562 5.150 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 176764096 DRWYCWAMCOIOQJ-IBGZPJMESA-N 393.402 5.290 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COC(c2ccccc2)c2ccccc2)n1 177767287 XNACNLYGQLRHKC-LJQANCHMSA-N 390.508 5.249 30 20 GKED C=C[C@@H](CC(=O)N[C@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 178960321 NJXVUOBLMBNDRC-MOPGFXCFSA-N 393.531 5.097 30 20 GKED CCSc1ccccc1[C@H](C)NCc1ccc(OC)c(O[C@H](C#N)CC)c1 180810062 PIOSWOSSPLUOTL-WMZOPIPTSA-N 384.545 5.339 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(SCc2ccccc2)cc1 182049420 VWKIKLBFAVFAQL-QGZVFWFLSA-N 388.492 5.522 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c2ccccc2n1 185264308 QRYXLOOFCGOOJF-IBGZPJMESA-N 394.459 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCN(Cc2csc(C)n2)CC1 188063024 ZBKNKVSEDYCVCN-UHFFFAOYSA-N 397.588 5.154 30 20 GKED C[C@@H](SCc1nc2scc(-c3ccco3)c2c(=O)[nH]1)c1cccc(C#N)c1 190780721 LTMJFYZQOJZTHE-GFCCVEGCSA-N 393.493 5.111 30 20 GKED CC(=O)Nc1cccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1C 190995564 NYHFXRPXGHATAB-UHFFFAOYSA-N 399.450 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)c1sc(C(C)C)nc1C 191433197 BEXXZCKJQOUNLH-QGZVFWFLSA-N 399.604 6.652 30 20 GKED COc1ccc2nc(/C=C\c3cn(CCC#N)nc3-c3ccccc3)sc2c1 213686271 YXZYRODTOCNHIE-FLIBITNWSA-N 386.480 5.252 30 20 GKED Cc1ccc(SCCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 303363799 IAAIBNDWJCYLCO-INIZCTEOSA-N 385.558 5.161 30 20 GKED O=C1CC[C@H](/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c2ccccc21 329124203 XLKSRNHLXRRFTM-VQTJNVASSA-N 377.488 5.092 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](c1ccc(F)c(Cl)c1)C1CC1 425769750 PBDWJUUOESFUEY-RNODOKPDSA-N 385.870 5.204 30 20 GKED CC(C)C[C@H](C)n1nccc1NC(=O)c1cn(CCCC#N)c2ccccc12 426881022 BWUOPTJDTARPJJ-KRWDZBQOSA-N 377.492 5.001 30 20 GKED N#CCCC[C@H](NC(=O)NCCCCc1ccc(Cl)s1)c1ccccc1 431298045 AAAYLIWIYBKOGX-SFHVURJKSA-N 389.952 5.459 30 20 GKED N#CCCC[C@@H](NC(=O)NCCn1ccc2cc(Cl)ccc21)c1ccccc1 431305933 AYRTYJRPYRLPHN-HXUWFJFHSA-N 394.906 5.029 30 20 GKED CC(C)COc1ccccc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 437825040 WAUBSTSKUIGSEI-PZJWPPBQSA-N 377.488 5.025 30 20 GKED C[C@@H](C1CC1)N(C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)C1CC1 438667510 UHPXGRXZCDTBPT-AWEZNQCLSA-N 379.435 5.284 30 20 GKED Cc1sc(Br)c(C(=O)Nc2cc(C#N)ccc2OC(C)C)c1C 440686378 CEHDKYHPTROBIS-UHFFFAOYSA-N 393.306 5.039 30 20 GKED N#CCSc1cccc(C(=O)N2CCCCC[C@@H]2/C=C\c2ccccc2)c1 440873481 SXLJUYYITCXKEB-DZFTYQQFSA-N 376.525 5.400 30 20 GKED C[C@@H](Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)c1cccc(C#N)c1 442782633 LNBWBIWJHBFRAU-GOSISDBHSA-N 379.467 5.038 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1F 455046798 PEKFJOZYGNKXAP-INIZCTEOSA-N 377.822 5.483 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Cc1ccccc1)c1cc(C(F)(F)F)ccn1 464430577 ZUPPJXZRGFDNOV-LJQANCHMSA-N 380.369 5.181 30 20 GKED CC(C)(C#N)CCCN1CCCC[C@H]1C(=O)Nc1cc(Cl)ccc1Cl 472237623 ITQHSMAYDWPKCC-KRWDZBQOSA-N 382.335 5.116 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1ccc(Br)cc1C(F)(F)F 479251119 JHAWRQKYKNQGTG-NEPJUHHUSA-N 397.238 5.751 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3cccc(F)c3F)o2)cc1 480358584 PTMHOEBGPMEBKQ-UHFFFAOYSA-N 383.398 5.144 30 20 GKED Cc1c(NC(=O)c2ccccc2Oc2ccccc2C#N)cnn1CCC(C)C 481169711 QOBQGLRWUWNQJJ-UHFFFAOYSA-N 388.471 5.154 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1)c1ccccc1 483125421 ZFEDNIILSQVYIJ-KRWDZBQOSA-N 398.491 5.384 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cn(C)c4ccc(F)cc34)n2)cc1 483447297 DYTQCZJAFZXMPP-QGZVFWFLSA-N 389.455 5.239 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2cc(C#N)cn2C(C)(C)C)s1 484080381 WQLLGZRMHIWSAV-UHFFFAOYSA-N 378.501 5.107 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c1 487487889 SWMCJTRRRJIDCH-XMMPIXPASA-N 398.506 5.917 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cnn(CCC(C)C)c1C(C)C 487617418 ADXPUFOUEUUALD-UHFFFAOYSA-N 393.535 5.144 30 20 GKED COc1cccc(Cn2ccc3ccc(NC(=O)c4ccc(CC#N)cc4)cc32)c1 490246042 MMLBKEMIQLKQSK-UHFFFAOYSA-N 395.462 5.017 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)cc2F)nnc1-c1ccc(F)cc1 497685814 GWKYVMAFNYLHNU-GFCCVEGCSA-N 375.419 5.402 30 20 GKED N#CCCCOc1cccc(N[C@H](c2cccnc2)c2cc3ccccc3o2)c1 498752795 CQIHPZXJAALIOX-XMMPIXPASA-N 383.451 5.712 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)N[C@H](C)c1ccc(C#N)cc1 505339333 NEIYYAWSIFNJPI-QGZVFWFLSA-N 389.499 5.550 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)c2cccc(C#N)c2C)cc1 509448447 NHNOVLMWJCZFCU-DEOSSOPVSA-N 383.495 5.076 30 20 GKED C=CCn1c(S[C@@H](C)c2ccccc2Br)nnc1-c1ccco1 513329455 NFVUITFCKOUAES-LBPRGKRZSA-N 390.306 5.340 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C#N)c(Cl)c2)cc1 514508789 ZNSYKLYVFSZAFK-FQEVSTJZSA-N 383.879 5.369 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1ccc(Oc2cccnc2)cc1 516366791 SXIZWKLXBAMFOQ-UHFFFAOYSA-N 395.418 5.186 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)CC1CCC1 519449014 QZIAGAJGWXXUHR-GOSISDBHSA-N 393.556 5.773 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3C3CCCC3)cc2)cc1 521366562 OLOKIRXCMIQEFT-JOCHJYFZSA-N 375.472 5.537 30 20 GKED C=CCCC(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 522538467 HXGOGVAVJAJSQM-UHFFFAOYSA-N 377.366 5.254 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cccc(OCCCC#N)c1 523823050 ZLTDAAWPSKHBRT-UHFFFAOYSA-N 377.469 5.053 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC1(C)CCCCC1 523929206 NOTPVHWBKUDXRU-UHFFFAOYSA-N 377.488 5.290 30 20 GKED N#Cc1ccc(CC(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)cc1 525367867 DMUAVMYJFUEFRW-UHFFFAOYSA-N 384.810 5.047 30 20 GKED CCC[C@@H](CCc1ccccc1)NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 525573073 UPRUJDIBMSWFKD-QFIPXVFZSA-N 399.494 5.277 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2cccc(OCc3cscn3)c2)CC1 536102395 GPVCZTQIIZAEKL-UHFFFAOYSA-N 389.524 5.538 30 20 GKED CCCN(CC(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 536378294 MQRIWCLLTRQHAH-UHFFFAOYSA-N 378.806 5.121 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1cccc(C#N)c1F 543519117 VPNJWVPPNAHBAZ-GFCCVEGCSA-N 385.895 5.634 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543863114 JFPACYGHQOXOAJ-VQTJNVASSA-N 397.522 5.520 30 20 GKED C[C@@H](NCc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)cc1F 545942696 JMQKWPAGDNCDHV-MRXNPFEDSA-N 378.422 5.266 30 20 GKED C[C@@H](NCc1csc(-c2ccc(Br)cc2)n1)c1ccc(C#N)cc1 548936536 HCEJWRYPCVIZOF-CYBMUJFWSA-N 398.329 5.295 30 20 GKED C[C@@H](N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccc(C#N)cc1 551563491 HNHJZOOPSDGZHS-VFNWGFHPSA-N 388.433 5.396 30 20 GKED Cc1nc(SCC(=O)Nc2cc(C(F)F)ccc2Cl)c(C#N)c(C)c1C 580798714 JSEGKWQGRVTLFC-UHFFFAOYSA-N 395.862 5.200 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc3c(s2)-c2ccccc2C(C)(C)C3)n1 588739195 YOUAFTOITCAKOV-HNNXBMFYSA-N 378.522 5.504 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 590252687 INYOBUJGTSEKOW-STQMWFEESA-N 391.286 5.606 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CCC(F)(F)CC1 594070575 KFTKIHYTFMATIM-KGLIPLIRSA-N 381.492 5.416 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)CC2(C#N)CCOCC2)cc1 597363547 YCMLFPNVCTUOIX-QGZVFWFLSA-N 380.513 5.189 30 20 GKED N#CC1(CC(=O)N(c2ccccc2)c2nc3ccccc3s2)CCCCC1 598803711 SNUVGUACRSGQDP-UHFFFAOYSA-N 375.497 5.825 30 20 GKED CC[C@](C)(NC(=O)Nc1cccc(C#Cc2cccs2)c1)c1nccs1 606937991 APQHURJEAPSXKC-FQEVSTJZSA-N 381.526 5.051 30 20 GKED C=CCCCCCN(C)C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 606971796 NTLNXLQHHBVYBH-STQMWFEESA-N 388.396 5.284 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F 610171132 GUFZBOMZQDQBNX-WBVHZDCISA-N 380.419 5.307 30 20 GKED N#CCn1c(C(=O)Nc2ccc(CNc3ccccc3)cc2)cc2ccccc21 610494222 YSNVOUMXGSUMPC-UHFFFAOYSA-N 380.451 5.029 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1F 612335737 SVLXFFCZDXXABK-UHFFFAOYSA-N 385.197 5.183 30 20 GKED N#C[C@H](C(=O)c1scnc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 677709295 GFKFXNRMKKNKEX-SNVBAGLBSA-N 393.415 5.139 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccccc1C(F)(F)F 682803903 YZZVKNRBDRBXPI-OAHLLOKOSA-N 375.434 6.300 30 20 GKED COc1ccccc1-c1nc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cs1 684675076 IIVMHWCSPKJHKG-CYBMUJFWSA-N 397.525 5.063 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccc(C)cc4)sc3C2=O)cc1O 727655306 VGDQDKSRAZJUSQ-LFIBNONCSA-N 377.465 5.045 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)COc1cccc(C#N)c1 728013087 WGMWPNDAYPKOJQ-GOSISDBHSA-N 386.451 5.024 30 20 GKED CC(=O)CCc1ccc(OC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 728763651 VOKCVZFQALANNH-UHFFFAOYSA-N 385.419 5.091 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 732496390 UCYAIXRQYOOZPF-GOEBONIOSA-N 386.929 5.697 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2nc(-c3ccccc3)cs2)cc1OC 732571589 SXMHVYUFGFTLOH-KHPPLWFESA-N 395.480 5.122 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC)c2ccc(Cl)s2)c1 734013120 MJNHTJPLRRGOCO-HOCLYGCPSA-N 391.924 5.033 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@@H](C)/N=C/c1cc(Br)ccc1O 735978748 KSEZKHOKACXWLF-XQKIYHOTSA-N 382.685 5.003 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c1ccc(C(C)C)cc1 739154303 ITILRILQSSGEKN-XLIONFOSSA-N 392.499 5.050 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2c(Cl)nc3ccccn23)cc1 741468185 URIQTSKMIZWOTR-SDNWHVSQSA-N 388.854 5.559 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3c[nH]c4cc(C)ccc34)n2)cc1 745947682 IXYGJGBVSHCPMW-HXUWFJFHSA-N 399.519 5.717 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)CCSc2ccc(Cl)cc21 748440856 HUWLVBYQWSHPIW-XFXZXTDPSA-N 384.913 5.621 30 20 GKED COc1ccc([C@H](C)CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 749910513 FOVYZGIYZMAJTH-KOSHJBKYSA-N 384.479 5.483 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2cccnc2)c2ccc(F)c(C)c2)c1 753678030 FCJQEHKQUOPRGV-XUZZJYLKSA-N 389.474 5.089 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2csc(Cl)c2Cl)cc1 761479166 XFXMZJDYXQOOKI-DAXSKMNVSA-N 393.295 5.264 30 20 GKED Cc1[nH]c2ccc(Br)cc2c1CC(=O)OCCCCC(C)(C)C#N 768581401 QAVJOZLHCDYLOO-UHFFFAOYSA-N 391.309 5.045 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3cccc(C(C)C)c3)o2)c1 776517246 PLRIWXUKYWQNTC-HXUWFJFHSA-N 386.451 5.340 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780679002 ZXIVVISNTIJSGJ-AVRDEDQJSA-N 391.515 5.860 30 20 GKED COc1cccc(NC(=S)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 782206880 YTPCLJXBQSVYJR-INIZCTEOSA-N 387.508 5.281 30 20 GKED CC(C)n1ncc2c(C(=O)OCCCC(C)(C)C#N)cc(-c3cccs3)nc21 782232236 LWAJLPJILQAXJD-UHFFFAOYSA-N 396.516 5.227 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC(F)(F)Cl)cc1 783356066 NXKYOKYZZBKMDG-LBPRGKRZSA-N 396.846 5.359 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792095929 YJWBXPNFAHEYSJ-MJGOQNOKSA-N 382.385 5.624 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CC(C)(C)C1CCCCC1 796633280 NPDHRCNCTQMEOT-FQEVSTJZSA-N 382.548 5.455 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2csc(-c3ccc(Cl)cc3)c2)c1 796746449 KRGMGYISLOBKEF-SFHVURJKSA-N 394.883 5.338 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)s1)c1nc(-c2ccc(Cl)cc2)cs1 802043464 BZBIMARUSNUXIC-CYBMUJFWSA-N 393.320 5.597 30 20 GKED c1ccc(-c2nc3c(s2)C(=NNc2nccnc2C2CCC2)CCC3)cc1 807991485 NCXYCTOQJCTBAZ-UHFFFAOYSA-N 375.501 5.020 30 20 GKED C#Cc1cccc(NC(=O)C(C)(C)c2csc(-c3ccc(F)cc3C)n2)c1 810013537 GPEWYYNLCAYCKC-UHFFFAOYSA-N 378.472 5.155 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1)c1ccccc1 838604676 UYCPVESDNDWYEH-RTWAWAEBSA-N 383.442 5.246 30 20 GKED COc1cc([C@@H](C)NC2(c3ccc(C#N)cc3)CCC2)ccc1SC(F)F 848566715 GISBIWORLDYJQA-CQSZACIVSA-N 388.483 5.612 30 20 GKED Cc1nc(SCC(C)C)sc1CC(=O)[C@@H](C#N)c1nccc2ccccc12 850987230 XHZBJBQHVLJAIE-QGZVFWFLSA-N 395.553 5.167 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cscc1C(F)F 888129259 AKRYBGFSMZBLCC-BQBZGAKWSA-N 395.315 5.325 30 20 GKED O=C(c1ccccc1COCc1ccccc1)N(O)Cc1cccc2ccccc12 901370622 BHZIPTHIAOCJGP-UHFFFAOYSA-N 397.474 5.588 30 20 GKED CC(C)(C)SCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 915102837 IOERBMLNNBDPGI-LBPRGKRZSA-N 399.368 5.825 30 20 GKED CCOc1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915352545 MAJBLQCDSMAZDP-DEOSSOPVSA-N 399.494 5.405 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 916976954 YFOYOWMLXHHYPP-FGTMMUONSA-N 396.874 5.583 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCc1ccc2ccccc2c1 917424145 DOFBPOXYWKIAQL-QHCPKHFHSA-N 398.506 5.245 30 20 GKED CCCc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776112764 JZZOPGNYBOFICI-WJDWOHSUSA-N 384.475 5.829 30 20 GKED C=CCOc1ccc(/C=C(/CC(=O)O)c2nc3ccccc3s2)cc1Cl 1776118588 ZBVWAXRUVRCVKK-UVTDQMKNSA-N 385.872 5.530 30 20 GKED CC(C)Oc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1F 1776355936 BQQQTRLEKYUBFE-YCRREMRBSA-N 394.398 5.467 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](Cc2cc(C)cc(C)c2)C(=O)O)cc1 1776786419 GLBIGTWUHXTLME-DEOSSOPVSA-N 397.559 5.438 30 20 GKED CCCOc1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)c(OCCC)c1 1776818221 WDJRNFUMTQDJFA-ZDJZVTAXSA-N 394.467 5.102 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1sc(-c2ccc(C)cc2)nc1C 1777269627 VMIMEYOBEVDAKZ-ZHACJKMWSA-N 393.464 5.030 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cccc(C(=O)O)c1Cl 1777488296 XRQFEXMOFQAUCI-ZHACJKMWSA-N 383.856 5.366 30 20 GKED Cc1c(-c2ccccc2)sc2nc(SCC#N)n(-c3ccccc3)c(=O)c12 7427847 JPBGUJGKXHDQPC-UHFFFAOYSA-N 389.505 5.038 30 20 GKED O=C(O)c1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1 33725728 TYPSIOJRJPUDHA-NBVRZTHBSA-N 385.444 5.418 30 20 GKED COc1ccccc1SCC(=O)Nc1c(C#N)c(C)c(C)n1C1CCCCC1 60133534 QVNFOIUYLAVBKG-UHFFFAOYSA-N 397.544 5.221 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2ccc(Br)cc2)c1 62258770 BLQSLVSVCOLKSR-NRFANRHFSA-N 377.285 5.200 30 20 GKED COCCSc1ccc([C@H](C)Nc2ccc(C#N)cc2C(F)(F)F)cc1 112667697 YWRXENNQTIQRPW-ZDUSSCGKSA-N 380.435 5.489 30 20 GKED N#Cc1ccsc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116618372 VFTQJLJTZMKERV-UHFFFAOYSA-N 379.828 5.189 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1cccc(COc2ccccc2C#N)c1 129284008 UAJINOQXSSXGDI-UHFFFAOYSA-N 399.494 5.072 30 20 GKED N#CC1(C(=O)Nc2ccc(O)c(-c3nc4ccccc4s3)c2)CCCCC1 129486117 QMNWCACXTRXCNH-UHFFFAOYSA-N 377.469 5.081 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(F)cc1C(F)(F)F 151137145 VBKPHEYIJIJLRQ-UHFFFAOYSA-N 390.361 5.697 30 20 GKED Cc1cccc(NC2CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)c1 151876952 ZIGHTAKYDUHTJJ-UHFFFAOYSA-N 395.506 5.250 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)OC3CCCCCC3)n2)cc1 163111044 IJXSVSXZAAORQA-DNVCBOLYSA-N 398.528 5.123 30 20 GKED Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 173553426 HECGRNLHJXCBMA-LAUBAEHRSA-N 380.488 5.009 30 20 GKED Cc1ncsc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 173989718 AIPMCVJDAVMDIS-NSHDSACASA-N 394.308 5.372 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 176764078 DRWYCWAMCOIOQJ-LJQANCHMSA-N 393.402 5.290 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CN(C)CCCC)CC1 191439257 WNYDKLNFUHUGHE-UHFFFAOYSA-N 385.596 5.514 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1scnc1C(F)(F)F)c2C#N 297938901 UBRSZVRERVKWAQ-SFYZADRCSA-N 385.436 5.033 30 20 GKED COc1cc([C@H](C)Nc2snc(Cl)c2C#N)ccc1OC1CCCC1 301062414 BJDAKUMLGFFSQZ-NSHDSACASA-N 377.897 5.171 30 20 GKED Cc1ccc(CN(CCc2ccccc2)C(=O)CCc2ccc(C#N)cc2)s1 302890210 DLWAIUOHDAFEQW-UHFFFAOYSA-N 388.536 5.132 30 20 GKED CC(C)(/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(Cl)c1F 330023996 JKTIOAUVNOZIQT-UHFFFAOYSA-N 380.891 5.596 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1ccc(C#N)cc1Cl 430369942 QKFUPZOVNYNQOP-UHFFFAOYSA-N 394.308 5.611 30 20 GKED N#CCSc1cccc(C(=O)N2CCc3cc(-c4cccc(F)c4)ccc32)c1 430590491 CPCMUZZHAKHYML-UHFFFAOYSA-N 388.467 5.311 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(CCC(F)(F)F)cc2)s1 430612383 RBAYBXOEQOAODA-AWEZNQCLSA-N 380.435 5.426 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1sc2c(c1C#N)CCCCC2 439211765 OGKRKNQTGQWNFE-UHFFFAOYSA-N 389.864 5.011 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 440251030 ANAXTWWRMXKZRZ-VXKWHMMOSA-N 381.495 5.079 30 20 GKED N#CCC[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccccc1 442632682 ADIRHQNKECMDAQ-SFHVURJKSA-N 398.293 5.763 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H]3CCC[C@@H]32)cc1 444386286 DLGNMUOSRWIWHS-XLIONFOSSA-N 391.471 5.156 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(F)(Cc4ccc(Cl)cc4)CC3)cc2)CC1 452822790 QVLMUUFSLFDDRY-UHFFFAOYSA-N 396.893 5.082 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1cccc(Cl)c1 453470130 ZMXHJFNSLKFZND-RTBURBONSA-N 386.927 5.091 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1cccc2cc[nH]c12 466632429 HPKIKPKNOROYSH-UHFFFAOYSA-N 383.476 5.121 30 20 GKED Cc1ccc(-c2cnc(CNc3cccc(OCc4cccc(C#N)c4)c3)o2)cc1 467269298 RRVRADAGYPYJEF-UHFFFAOYSA-N 395.462 5.713 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3C[C@@H]4CCC(=O)c5cccc3c54)c2)cc1 468634831 IUTAWAQBHYZHCV-SFHVURJKSA-N 393.446 5.022 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3ccc(Cl)c(Cl)c3)ccc21 468969211 MIUUWPSIGRPYMB-UHFFFAOYSA-N 388.298 5.188 30 20 GKED C=CCC[C@H](NC(=O)c1cc2c(C(F)F)nn(C)c2s1)c1ccccc1 471049482 ZCCOXLOYIXNUGB-AWEZNQCLSA-N 375.444 5.010 30 20 GKED CC(C)N(Cc1cccc(Br)c1)C(=O)C[C@H](CC#N)c1ccccc1 475171453 DLYNROVTXFUAFR-IBGZPJMESA-N 399.332 5.274 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 475245180 IYFREKZICBDPNH-UHFFFAOYSA-N 377.284 5.156 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1cc(Cl)ccc1OC 475558440 JISDJPABYJLAMH-UHFFFAOYSA-N 386.923 5.864 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1ccc2c(c1)CCC(=O)N2CC1CC1 482000408 OWBMZJKMDWCJMT-HSZRJFAPSA-N 385.511 5.127 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1cc(Cl)cc(Cl)c1)c1ccccc1 487536190 LPDAPBXKOYKPKT-LJQANCHMSA-N 375.299 5.477 30 20 GKED COc1ccc(-n2c(SCCCCC#N)nnc2-c2ccc(C)cc2)cc1 489433921 JPIFEEMDWKTMAO-UHFFFAOYSA-N 378.501 5.037 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1 494020677 ODCSVAYHISQDSP-UXHICEINSA-N 376.843 5.142 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1CN[C@H](C)c1ccc(C#N)cc1 498116708 HWKGQFQMYHGSRJ-HXUWFJFHSA-N 392.506 5.570 30 20 GKED Cc1sc(NC(=O)c2csc(-c3ccc(OC(C)C)cc3)n2)c(C#N)c1C 501945733 OQDOPCBZUVGDKY-UHFFFAOYSA-N 397.525 5.400 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)Nc1cccc(C)c1C 502495609 DXNWYNREQVOSTP-UHFFFAOYSA-N 385.467 5.707 30 20 GKED CCCN(CCc1cccc(F)c1)C(=O)Nc1ccccc1SC[C@H](C)C#N 503227578 WNQOOEUWEIKTEB-QGZVFWFLSA-N 399.535 5.564 30 20 GKED CCN(Cc1cccc(Cl)c1)Cc1cn(CCC#N)nc1-c1ccccc1 507117647 QUOJAZOIBGJYEN-UHFFFAOYSA-N 378.907 5.139 30 20 GKED N#CCCCCNC(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1 510021173 XKXPJHSQHPRZLJ-UHFFFAOYSA-N 388.265 5.057 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2cccs2)cc1Cl 510024323 UQMXQXVKUFSNBR-LJQANCHMSA-N 395.915 5.421 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)c1cc(C#N)ccc1Cl 512745196 WJRRJMMAFQPVNH-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#Cc1c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)sc2c1CCCCCC2 515675145 YOIGHZISXRETCR-UHFFFAOYSA-N 395.440 5.185 30 20 GKED COc1ccc(-c2nc3cc(Cl)ccc3n2C(C)C)cc1OCCCC#N 519940254 BJZBJOBSJVOPME-UHFFFAOYSA-N 383.879 5.629 30 20 GKED CC(C)c1cnc(S[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)n1C(C)C 523497567 QLSMFLMPXDFQKV-ZDUSSCGKSA-N 390.940 5.232 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccc(Cl)c1 533026294 CVMPORLTKFQFHV-HNNXBMFYSA-N 387.936 5.199 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cnn(CC(C)C)c1C(F)F)c1ccccc1 534824708 JTYRXEGKYNUYLZ-MRXNPFEDSA-N 376.451 5.306 30 20 GKED Cc1csc([C@@H](C)NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 535588216 LUNDPZVCMZZOKW-CYBMUJFWSA-N 397.887 5.260 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2)nc1)c1ccc(C#N)c(Cl)c1 540274033 GFTVSSAOAVVLPB-UHFFFAOYSA-N 377.831 5.066 30 20 GKED C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1cccc(Cl)c1Cl 540595334 ZMKGEGAKSRMMFX-HNNXBMFYSA-N 388.342 5.180 30 20 GKED CCC(=O)Nc1ccc(C)c(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 540875559 ZPHPOEXSOPIBIG-UHFFFAOYSA-N 399.450 5.260 30 20 GKED COc1ccc(C#N)cc1CN[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 541660837 TXYNYSDBZHAOTD-CYBMUJFWSA-N 397.931 5.503 30 20 GKED COc1ccc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543034542 OBMLEPSBRGNFDK-QZTJIDSGSA-N 386.495 5.654 30 20 GKED N#CC[C@H](CC(=O)N1CCC([C@H](F)c2ccccc2F)CC1)c1ccccc1 552271341 CNATZJADEVZSQA-XXBNENTESA-N 382.454 5.162 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)C(CC)(CC)c1ccc(Cl)cc1 553416375 HOZNWOQDKBXCIO-UHFFFAOYSA-N 389.923 5.088 30 20 GKED N#Cc1ccc(CNCC[C@@H](c2ccccc2)C(F)(F)F)c(C(F)(F)F)c1 559308573 YYLGSYWENONEML-INIZCTEOSA-N 386.339 5.403 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(-c2nc3ccccc3s2)s1 565681276 YXZLLABKZBMDDR-UHFFFAOYSA-N 375.478 5.343 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CN(C)c1nc2ccccc2s1 570460300 QTJOMIVCIGCOTE-UHFFFAOYSA-N 379.529 5.223 30 20 GKED N#CCc1ccc(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 572761759 DSSBYTXZQHXOOR-LJQANCHMSA-N 377.488 5.182 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@]4(CCSC4)C3)cc2)cc1 577352428 REFIJAGSRJOQOP-JOCHJYFZSA-N 393.512 5.102 30 20 GKED O=C(Nc1cc(Cl)ccc1C(F)(F)F)c1ccc(C(F)(F)F)c(F)c1 577678311 PGIRGQHGLSINPW-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc([C@H]2CCOC2)cc1 579557976 GTPBCHKZSRTBMA-RDJZCZTQSA-N 381.501 5.229 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F)C(F)(F)F 582326832 XASLTFMXZJPZPH-VIFPVBQESA-N 395.274 5.426 30 20 GKED C=CCC(CC=C)c1nc([C@@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 583110414 DOOQOOADBXJZOK-INIZCTEOSA-N 384.373 5.589 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1N1CCC(c2nc(-c3ccccc3)no2)CC1 589572171 YFBHLNZLZPRORI-UHFFFAOYSA-N 398.388 5.011 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccc(Br)cc2)c1 589739383 MSLPKGSLCXORAW-UHFFFAOYSA-N 389.293 5.068 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@@]4(CCSC4)C3)c2)cc1 590815256 MGGSBEXXMHGNBN-JOCHJYFZSA-N 393.512 5.102 30 20 GKED Cc1ccc(-c2nc(C(=O)N(Cc3ccc(C#N)cc3)C(C)C)cs2)cc1 603527615 WRUAHUFSEHZHLW-UHFFFAOYSA-N 375.497 5.041 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603690768 PZCJHMZRYJPKIK-OAHLLOKOSA-N 390.418 5.110 30 20 GKED C[C@H](C(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 607822940 RQXITKHGCYBULX-VIFPVBQESA-N 379.275 5.606 30 20 GKED CCc1c(C)sc(NC(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)c1C#N 609033161 SRNCRHPFNFBUMD-UHFFFAOYSA-N 395.532 5.192 30 20 GKED C[C@@H](Cc1cccc(F)c1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609063795 LEMMCOLPFLZORV-KRWDZBQOSA-N 388.442 5.094 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)oc2ccccc12 609682863 VNBKYNLMQBKJJU-AWEZNQCLSA-N 379.485 5.457 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2nc3ccsc3s2)c1 609794905 AHXVOOJULLLIFZ-UHFFFAOYSA-N 391.477 5.061 30 20 GKED C[C@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)Cc1cccs1 610191129 HTBPYOGKGDDBRL-INIZCTEOSA-N 392.549 5.380 30 20 GKED CCOc1ccc2nc(-c3ccc(NCc4ccnc(C#N)c4)cc3)sc2c1 610956675 PIJZQQLAPIXMKL-UHFFFAOYSA-N 386.480 5.241 30 20 GKED N#C[C@H](C(=O)c1ccccc1SCc1ccco1)c1nc2ccccc2s1 613289641 XUDRQZNDPQQCPM-MRXNPFEDSA-N 390.489 5.672 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2ccco2)n1Cc1ccccc1 614396856 SJLDWBMDBHIGHI-UHFFFAOYSA-N 386.480 5.059 30 20 GKED CC(C)N(CC(F)(F)F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 614663591 JWFCFGWKPSMWIO-UHFFFAOYSA-N 381.238 5.137 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccsc1 619787982 QQLHESISGLLFLD-AWEZNQCLSA-N 395.459 5.221 30 20 GKED C=CCC1(NCc2csc(CC(=O)Nc3ccccc3C)n2)CCCCC1 625936038 XXHGIAPNTQVUFP-UHFFFAOYSA-N 383.561 5.001 30 20 GKED Fc1cc(-c2noc([C@@H](C[C@@H]3CCCO3)C(F)(F)F)n2)ccc1C(F)(F)F 650533136 MJTHYCYXZZOFNO-GXSJLCMTSA-N 398.278 5.110 30 20 GKED COc1ccc([C@@H](C)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 675737983 LCZMKUSGQCOCLQ-XEZLXBQYSA-N 387.339 5.394 30 20 GKED C=CCC[C@H](NC(=O)C[C@@H](C)c1ccncc1)c1ccc(C(F)(F)F)cc1 676731463 ZVRWOVMCBWLMII-BEFAXECRSA-N 376.422 5.418 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCOc1ccccc1OC 682777387 RFCRODAQWAGRLS-UHFFFAOYSA-N 382.504 5.138 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=S)Nc1ccc(C#N)c(Cl)c1 726484412 LOCVSHMDMNMXOE-UHFFFAOYSA-N 384.719 5.347 30 20 GKED COc1cc(C(=O)/C=C/c2cccc(OC(F)(F)F)c2)ccc1OC(F)F 727975637 GKIMCNPWFTYRQU-FNORWQNLSA-N 388.288 5.091 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2C[C@@H]2c2cccc(OC)c2)c1 730180802 KTKUAQGQAXTGPH-PKTZIBPZSA-N 387.504 5.075 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3C#N)c2)c(F)c1 731318089 GIVZSRSBZXVOTH-FMIVXFBMSA-N 387.410 5.181 30 20 GKED C[C@H](CC#N)Sc1ccccc1NS(=O)(=O)/C=C\c1ccc(Cl)cc1 731341037 YSZQDSXETWIRSZ-YBEMTRGBSA-N 392.933 5.147 30 20 GKED CCc1cc(NN=C(C)c2ccc(SC(F)F)cc2)nc(-c2ccccn2)n1 734978833 DMZHYMKYKKXOCS-UHFFFAOYSA-N 399.470 5.252 30 20 GKED C[C@@H](CC#N)OC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 735600898 WASOMSBEMURCEU-NSHDSACASA-N 392.242 5.096 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)cc1C#N 742369132 MQLLACDQPONQSN-QFIPXVFZSA-N 397.305 5.753 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)ccc1-n1cncn1 742429160 JGPRQPPJMFPREE-CLTKARDFSA-N 392.673 5.432 30 20 GKED O=C(/C=C\c1ccc(O)c(Br)c1)c1ccc(-c2ccncc2)cc1 745989851 CQFKJWSTYGISBV-XFSBKJJWSA-N 380.241 5.113 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1c(F)cccc1F 746438609 YIJOZEDSWSNEFS-ZDUSSCGKSA-N 384.222 5.444 30 20 GKED CC(=O)Nc1ccc(C(C)=NO[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)cc1 752765152 SCARWGKRQNHMEX-CQSZACIVSA-N 397.862 5.455 30 20 GKED CC(C)[C@H]1CC[C@H](C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC1 753540650 WWSHWNVAZJGFME-WDSOQIARSA-N 377.513 5.320 30 20 GKED N#Cc1ccc(C(=O)CSc2nc3cc(C(F)(F)F)ccc3s2)cc1 753853738 HRQSNVUJJUVQPI-UHFFFAOYSA-N 378.400 5.162 30 20 GKED C[C@H](OC1CCCCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760366169 UTBLMERAXFDHEC-MBSDFSHPSA-N 376.500 5.408 30 20 GKED C=CC[C@H](NC(=O)N1CC[C@H](Cc2ccc(C(C)C)cc2)C1)c1ccncc1 764725701 MWJAUNWZCPORNO-OFNKIYASSA-N 377.532 5.096 30 20 GKED COc1ccc(/C=C\C(=O)c2coc3ccccc23)c(OCc2cccnc2)c1 766492105 VBXDNFJARUVAEF-LUAWRHEFSA-N 385.419 5.312 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1nc2ccccc2s1 770843712 VFUMFOACUQLUDW-OAHLLOKOSA-N 388.414 5.514 30 20 GKED COc1ccc(OCc2nc(/C=C3\CCc4ccc(F)cc4C3=O)cs2)cc1 776192096 HZFRAAQMSZJQMG-XNTDXEJSSA-N 395.455 5.082 30 20 GKED Cc1ccc(-c2c[nH]cc2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 778469682 YNQHESFCVOOFIK-HXUWFJFHSA-N 397.503 5.959 30 20 GKED Cc1ccc(C[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 779197760 ICTKKXURGVGIDX-ZBFHGGJFSA-N 396.462 5.452 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)Nc1ccccc1O[C@H](C)C#N 780675298 PLCDLHMHPIXXNI-UXHICEINSA-N 399.494 5.773 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2Cl)nnc1-c1ccccc1 788097552 KWSFNMODFKURBZ-UHFFFAOYSA-N 377.300 5.125 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc3nc(-c4ccccc4)oc3c2)cc1 793254996 NQRDWEPBHBNALB-UHFFFAOYSA-N 381.435 5.364 30 20 GKED C[C@H](Cn1ccc2ccccc21)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 796809460 AJTDZBMYDUCAIE-CJNGLKHVSA-N 393.899 5.417 30 20 GKED C#CC(=O)N(CCC)[C@H](CCc1cccs1)c1ccc(Br)cc1 797771026 XUHMVSRENIGAIR-GOSISDBHSA-N 390.346 5.056 30 20 GKED N#CCOc1ccc(CN[C@H](CCCc2ccccc2)c2ccc(F)cc2)cc1 813860328 PXBDMMDQJMKRGO-RUZDIDTESA-N 388.486 5.582 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1 831617792 JSYFNFWNBFONAL-RTWAWAEBSA-N 390.612 5.014 30 20 GKED CC(C)(C)Oc1ccc(NCc2nnc(-c3ccccc3Cl)o2)cc1C#N 834635516 MWXXYCTZVZXRPQ-UHFFFAOYSA-N 382.851 5.051 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)[C@@H](C)Cc1ccc(C#N)cc1 846935401 YHJPOTOQQRCGFA-INIZCTEOSA-N 393.487 5.031 30 20 GKED C[C@H](CC(C)(C)C#N)OC(=O)c1csc(-c2cc(Br)cs2)n1 851210107 NZAHYSYWIPSYQH-SECBINFHSA-N 399.335 5.119 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@@H](C#N)c3nc4ccccc4s3)ccc2c1 916846072 GNNKKSHYVFPXGI-KOTDBNOLSA-N 384.460 5.348 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc([C@@H](C)CC)cc2)cc1 918486991 NTZRSKFSRQLOIV-HRAATJIYSA-N 394.540 5.414 30 20 GKED Cc1ccc(CN(C(=O)c2ccccc2OCC#N)[C@H]2CCc3ccccc32)cc1 920003741 NBKBPXZEJYJPQK-DEOSSOPVSA-N 396.490 5.227 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(-c2ccccc2Cl)s1 1776049822 LHHJHRPWCORUCK-UHFFFAOYSA-N 386.860 5.221 30 20 GKED CCCCCCCCOc1ccc(C=NNc2ccc(C(=O)O)c(F)c2)cc1 1776073476 WRWOGZXQSRNBKK-UHFFFAOYSA-N 386.467 5.709 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3cccc(Cl)c3Cl)s2)cc1 1776081128 ZGVCHEDWPBNXKZ-UHFFFAOYSA-N 391.279 5.866 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cccc(OCC(=O)O)c2)cc1 1776125699 QQEALBWMYMBBHJ-GDNBJRDFSA-N 396.483 5.395 30 20 GKED C=CCC[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)O)c1)c1ccc(C(F)(F)F)cc1 1776167876 OOURHNRLJFNCAM-INIZCTEOSA-N 394.349 5.431 30 20 GKED CCCCCCCOc1cccc(/C=C/c2nc3c(s2)CCC[C@@H]3C(=O)O)c1 1776789198 UNRDMGOMNUMDDD-KQDNUWKFSA-N 399.556 6.167 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3cccs3)CCC2)cc1 1789453041 GZGKLBZUUGUZOC-LJQANCHMSA-N 394.540 5.264 30 20 GKED CCn1c2ccccc2c2cc(N[C@H](C)C(=O)Nc3ccccc3C#N)ccc21 7239129 RZHCWCQVPSWJOV-MRXNPFEDSA-N 382.467 5.125 30 20 GKED CCN(CC)c1ccc(-c2nnc(S[C@@H](C#N)Cc3ccc(C)cc3)o2)cc1 24721796 JQMUGQQCRQEOPY-HXUWFJFHSA-N 392.528 5.118 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nnc1-c1ccoc1C 31649714 SQQPTHFIASEHMN-UHFFFAOYSA-N 396.903 5.526 30 20 GKED Cc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c(F)c1 49910308 ATAUDHQSJKBUIK-UHFFFAOYSA-N 376.456 5.550 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1c(C)noc1C 66334940 DDRAASPLOUJBKT-FQEVSTJZSA-N 389.455 5.396 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1ccccc1C(F)(F)F 66861035 IERZQINHTDUIBY-ZDUSSCGKSA-N 393.434 5.150 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 69572853 INOVSOTVOZCUEK-QGZVFWFLSA-N 389.455 5.150 30 20 GKED N#Cc1c(CSc2nn(-c3ccccc3)c(=S)s2)cn2ccccc12 126810579 CFCSYPBPYXSLFW-UHFFFAOYSA-N 380.523 5.080 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3sccc3C)n2)cc1 129592991 CHZNARZHIVFHFV-YESZJQIVSA-N 394.521 5.169 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 156113204 QBTZABUGHRDTEP-UHFFFAOYSA-N 379.391 5.159 30 20 GKED N#CCCCOc1cccnc1NC(=O)CCCc1ccc(Cl)c(Cl)c1 170694221 ZALVLHNAKBKYCW-UHFFFAOYSA-N 392.286 5.032 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](Cc2ccccc2)C1 173123941 UBBHZMDWHSSNPT-IEBWSBKVSA-N 379.529 5.177 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N(CCC#N)CC2CC2)cc1F 176921379 YYTIUQFTCSKJKB-UHFFFAOYSA-N 397.450 5.093 30 20 GKED C[C@@H](N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 181687724 VXPZUANWJNTTTP-UZUQRXQVSA-N 384.458 5.139 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccc(OC)cc1 182236467 CDOWPUXSYBTCRS-AWEZNQCLSA-N 392.484 5.134 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3o2)c(C)n1[C@H](C)c1ccccc1 193536986 XXPLFEXOEOQODK-UZLBHIALSA-N 383.451 5.346 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccccc2O)cs1 255165379 HDWOLYAFNZNUKF-FLIBITNWSA-N 398.871 5.083 30 20 GKED CCCOc1c(Cl)cc(C=NO[C@@H](C)c2nc(C(C)C)no2)cc1OCC 255624109 WQNPUANUZPNYQS-ZDUSSCGKSA-N 395.887 5.146 30 20 GKED C=C1CCN(Cc2csc(N(C(C)=O)c3ccc(Cl)c(Cl)c3)n2)CC1 270282451 YKDYXIMJSPGHSV-UHFFFAOYSA-N 396.343 5.287 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1ncsc1C(F)(F)F)c2C#N 297901751 QZVUTMUQJSJOKJ-SFYZADRCSA-N 385.436 5.033 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](C)c1cc2cccc(F)c2o1 329002938 LQIUYCMFBJMZJD-BXUZGUMPSA-N 388.464 5.297 30 20 GKED CC(C)S(=O)(=O)Cc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1 329159793 DYXCPDJRVYSRKF-DFQSSKMNSA-N 377.550 5.204 30 20 GKED Cc1ccccc1C1(C/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)CCCCC1 329993235 LEONOBZINKMPNE-UHFFFAOYSA-N 396.575 6.079 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccccc1CN1CCCC[C@H]1C 410354201 NSLPBOSBMIIUQC-LJQANCHMSA-N 397.588 5.020 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1cncc(C(F)(F)F)c1 425534527 MERBWCAMFYGHFN-GFCCVEGCSA-N 387.327 5.033 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cscc3C#N)cc2Cl)cc1 432394190 IPOSZAKVFUVXHA-UHFFFAOYSA-N 379.828 5.189 30 20 GKED N#CCCSc1ccccc1NCC#Cc1ccc(OC(F)(F)F)cc1 433499745 DRKBEVNLUIIKFZ-UHFFFAOYSA-N 376.403 5.055 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](c1ccccc1)c1cccc(F)c1)c1ccccc1 438850844 NIUFRWZBYBSUIN-XZOQPEGZSA-N 387.458 5.259 30 20 GKED CCCc1c(NC(=O)[C@@H](C)c2cc3ccccc3o2)cnn1-c1cccc(C#N)c1 440072882 CZFSRUNOMZZLCG-INIZCTEOSA-N 398.466 5.185 30 20 GKED C=CCC[C@H](NC(=O)Cc1csc(CC)n1)c1ccc(C(F)(F)F)cc1 441562923 DPKIUMKQWLQQNC-INIZCTEOSA-N 382.451 5.091 30 20 GKED CC1(C#N)CCC(NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)CC1 449140140 MJFZKDJYWZQMDP-UHFFFAOYSA-N 380.363 5.020 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)N[C@H](CCCC#N)c1ccccc1 458800953 MEZPVRZQMDOTHX-LJQANCHMSA-N 389.421 5.282 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3cccc(C#Cc4ccccn4)c3)c2)cs1 463349078 PHFNDKOCVZEKFT-UHFFFAOYSA-N 395.487 5.166 30 20 GKED C=CCC(CC=C)C(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 467528207 SFONWQNWRXCPIJ-UHFFFAOYSA-N 397.906 5.369 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1 469255035 KYVXGFLQXHHEGO-VQTJNVASSA-N 388.467 5.134 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC(C(F)F)CC2)c1 484772368 USRWQZFUSJYWOG-UHFFFAOYSA-N 390.817 5.121 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 485487286 FREABYJEXRWDEK-AREMUKBSSA-N 387.570 5.264 30 20 GKED N#Cc1ccc(NC(=O)c2csc(-c3ccc(Cl)s3)n2)c(Cl)c1 494639035 XMGZQXYSWYDJEL-UHFFFAOYSA-N 380.281 5.302 30 20 GKED C=CCn1c(S[C@@H](Cc2ccccc2)c2ccccc2)nnc1-c1ccncc1 496566122 BEWIZFKXOLAJEX-QFIPXVFZSA-N 398.535 5.602 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 508595733 PJAUZHITEZRANC-GOSISDBHSA-N 395.572 5.599 30 20 GKED Cc1csc(Sc2ccc(NC(=O)Cc3c(F)cccc3C#N)c(C)c2)n1 509224310 DNTQYAMOCWYTMQ-UHFFFAOYSA-N 397.500 5.103 30 20 GKED C=CCOc1cccc(NC(=O)N2Cc3ccccc3[C@H](c3ccccc3)C2)c1 510982915 MLDPTRLUYFDXRT-DEOSSOPVSA-N 384.479 5.431 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](Nc2ncc(C#N)cc2Cl)CCC3)cc1 513735140 JYEFILSLOVEZEN-MRXNPFEDSA-N 396.903 5.228 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCCCc1ccccc1 517458782 AIRQDIFMTOFBLF-QGZVFWFLSA-N 384.570 5.385 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccccc1 518755835 OPDIBUZPBDTFBC-WIYYLYMNSA-N 393.556 6.230 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nccc4ccccc34)c12 519575239 BQQNMQNTCIXISP-GOSISDBHSA-N 396.450 5.091 30 20 GKED C=CCOc1ccccc1CNCc1ccc(-c2nc3ccccc3s2)o1 520203072 FIEUFQJCMSYZGZ-UHFFFAOYSA-N 376.481 5.411 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(c3ccccc3)C3CCCCC3)cc2)nc1 521089260 GHYZGOTYVUTNJU-UHFFFAOYSA-N 397.478 5.725 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)Oc1ccc(Cl)cc1 521734759 RVFRPHGFNZRHGC-AWEZNQCLSA-N 388.920 5.388 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CSC2CCCCC2)c1 523986489 FELLXYQJQBURTF-UHFFFAOYSA-N 393.556 5.788 30 20 GKED C[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccccc1C(F)(F)F 527349503 HLNNCIWZUHCRSL-OOHWJJMZSA-N 389.421 5.013 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2cccc(N3CCCC3)c2)ccc1OC 531529845 JGVBKHXSCHSXGH-IBGZPJMESA-N 380.532 5.101 30 20 GKED C=C[C@@H](CC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 535374043 LJQXBKGMPQNCRZ-UXHICEINSA-N 398.506 5.476 30 20 GKED CN(C(=O)c1ccc(Cl)c(C#N)c1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 538266640 DCIJICSQKMWAOJ-OAHLLOKOSA-N 387.188 5.241 30 20 GKED N#CC1(c2ccc(C(=O)N[C@@H](c3ccc(Cl)cc3)c3ccsc3)cc2)CC1 540730728 XINBLVZKQKHDJT-FQEVSTJZSA-N 392.911 5.476 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)n([C@H](C)C4CC4)n3)n2)cc1 540778152 DILYOOVECYUEIZ-QAPCUYQASA-N 390.512 5.085 30 20 GKED N#CC1(c2ccc(C(=O)N3CCCCC[C@H]3/C=C/c3cccs3)cc2)CC1 543110624 HVFCLDYTILDYHB-SGWGQVFISA-N 376.525 5.401 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(SC)c(Cl)c1 558355165 ZWIDYUDOZYOESL-UHFFFAOYSA-N 392.956 5.450 30 20 GKED CC(C)n1cc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)cn1 564231671 FSDDDKFNMTWESO-UHFFFAOYSA-N 380.835 5.034 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(OC[C@H]3CCCCO3)c(F)c2)cc1 580730945 WJLUPYIVCLCBTP-XMSQKQJNSA-N 399.506 5.189 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(F)F)cc3)n2)cc1 588349030 PQYFWVVKIGYHHX-INIZCTEOSA-N 379.391 5.109 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1)c1ccccc1 596605557 FQYOWKYTDSDNNW-TZIWHRDSSA-N 377.488 5.341 30 20 GKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)CCOCC1 597578865 SNYXGHUKGQYJSA-UHFFFAOYSA-N 389.282 5.309 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cccc(COc4cccc(F)c4)c3)[nH]c12 605362646 OBRKXNVZCFAYIK-HXUWFJFHSA-N 399.425 5.080 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cc4c(s3)-c3ccccc3CC4)[nH]c12 605363352 VMBCEUYROUOONN-QGZVFWFLSA-N 383.476 5.189 30 20 GKED Cc1ccccc1CNC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609078630 DHTBEWYMSNMGDM-UHFFFAOYSA-N 385.467 5.076 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccccc3OC3CCC3)c2)c1 609814715 BHKWCDURQUJLFS-UHFFFAOYSA-N 398.462 5.321 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610290476 MLWXCSYGKMULCN-MRXNPFEDSA-N 389.430 5.092 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610290519 XLADFXWTJNPKIJ-INIZCTEOSA-N 389.430 5.092 30 20 GKED CC(C)N(CC(F)(F)F)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 611184906 JGZVZSIWJWFBII-UHFFFAOYSA-N 396.796 5.417 30 20 GKED CCN(C(=O)c1oc2ccccc2c1CSC)c1ccc(C#N)c(Cl)c1 611359631 RYNULTQLMSPNIB-UHFFFAOYSA-N 384.888 5.488 30 20 GKED CC(C)c1ccccc1NC(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 611727860 GSMCYPYEYDJDGD-UHFFFAOYSA-N 378.419 5.431 30 20 GKED Fc1ccc(-c2cc(CN3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)on2)cc1 618450401 KTXMQVIGSSJKCD-RYUDHWBXSA-N 396.306 5.043 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618810729 FGMZPOVEKBVEQP-QVKFZJNVSA-N 379.529 5.106 30 20 GKED C=CCc1cc(CNC(=O)Nc2c(C)cc(C)cc2Cl)cc(OC)c1OC 622914012 ULWKIDGNWIFHCP-UHFFFAOYSA-N 388.895 5.024 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(C[C@@H]2CCCOC2)c1C 626633764 KPRNNDVTEMUWMA-FQEVSTJZSA-N 394.559 5.636 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)c2)c1 642281589 QERXUTMNESHSFQ-HXUWFJFHSA-N 382.419 5.205 30 20 GKED C=CCN(CC=C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 651590887 RUCPVRLDJXVTDA-ZCXUNETKSA-N 384.479 5.519 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c(-c2ccccc2)s1 680450578 GFNQFHSPUAIIKZ-CQSZACIVSA-N 393.468 5.357 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(NC(=O)c3ccccc3)c2C)c1 726471179 BWNTXJJIECRBDL-UHFFFAOYSA-N 385.492 5.038 30 20 GKED C#CC[C@@H](OC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccccn1 727776202 VQTUBNYLGVIJHF-CQSZACIVSA-N 376.264 5.525 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)NCc3ccc(OCC#N)cc3)cc2)c1 727934483 AMSUPQOVIILCJE-UHFFFAOYSA-N 387.439 5.011 30 20 GKED C#CCOc1cccc(NC(=O)N(Cc2cccc(C(F)(F)F)c2)C(C)C)c1 731112973 QLTDMKRLOGSOHY-UHFFFAOYSA-N 390.405 5.160 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1F 731410348 ICYAWXNVTGMREP-LRDDRELGSA-N 384.863 5.583 30 20 GKED Cc1cc(/C=C\C(=O)c2c(C#N)c3n(c2C)CCC3)ccc1Oc1cccnc1 732713506 AXJORRPZENCTKE-CLFYSBASSA-N 383.451 5.006 30 20 GKED N#CC1(c2ccccc2)CCC(=NNc2nc(-c3ccc(Cl)cc3)no2)CC1 732925791 SHFNQDWSHUIYHE-UHFFFAOYSA-N 391.862 5.193 30 20 GKED N#C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C1CCCCC1 734367316 HWFLUHRFXNOZEC-AWEZNQCLSA-N 381.979 5.881 30 20 GKED C=C(C)COc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)ccc1OC 741473178 NSGJPFQTLSMNTL-CLFYSBASSA-N 385.463 5.608 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=S)Nc2ccccc2C#N)cc1 741500926 BFDMFNPIFAPGLA-MRXNPFEDSA-N 387.508 5.281 30 20 GKED Cc1nc2sccc2c(=O)n1N=Cc1ccc(-c2ccc(C(C)(C)C)cc2)o1 743430901 QJOVDMVITCISJW-UHFFFAOYSA-N 391.496 5.206 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SC(F)F)c(OC)c2)ccc1O 746346569 RRRGHGHDFBUSEZ-QPJJXVBHSA-N 380.412 5.010 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Oc2ccc(Cl)c(Cl)c2)n1 747194107 SKIIWWOGSDYZAB-CMPLNLGQSA-N 383.300 5.217 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 748535564 FHSXBSYHOJFGPF-BJKOFHAPSA-N 394.478 5.509 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 750692926 IWUWWWJNBSTLKX-SAAWKEMMSA-N 398.409 5.507 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1)C(C)C 752308471 JEUVZRMKDDXLSX-UHFFFAOYSA-N 396.878 5.504 30 20 GKED C[C@H](c1ccco1)N(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)C1CC1 754917335 BHCHKBGYWHOFLZ-OAHLLOKOSA-N 391.496 5.315 30 20 GKED C=CCC[C@@H](NCc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O 756378386 FIXNBTQKOYSDGJ-XMMPIXPASA-N 386.495 5.665 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2ccccc2Br)cc1 769534250 UJCHQYNFRXTQOD-FOIQADDNSA-N 385.305 5.077 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccccc2-c2cnn(C)c2)cc1 773113291 CZRDAQQVDBRFHO-QGZVFWFLSA-N 381.907 5.069 30 20 GKED C[C@@H](ON=C(c1ccccc1)C(F)(F)F)c1nnc(-c2cccc(Cl)c2)o1 784670531 FVPZTRUIADDSPF-LLVKDONJSA-N 395.768 5.434 30 20 GKED CC(C)(CCC#N)COC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 797219743 MIJYUSDPWHQZRO-UHFFFAOYSA-N 392.471 5.239 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1 802250011 KUCPJAFFNHOGJX-WMLDXEAASA-N 382.529 5.259 30 20 GKED N#Cc1sc(N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)nc1Cl 804432266 XBYJMYCLPCXHBW-LBPRGKRZSA-N 390.896 5.420 30 20 GKED O=C(/C=C/c1cccc(Br)n1)c1csc(-c2ccccc2F)n1 812244874 NESVCAZNUGRTAR-CMDGGOBGSA-N 389.249 5.003 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccc(C(F)(F)F)c1 819440317 QGWYIRISWDTKOF-DYVFJYSZSA-N 380.435 5.245 30 20 GKED COCC1(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 842687945 DKMLPDIASSAEPG-ZDUSSCGKSA-N 395.311 5.110 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCCc3ccc(SC)cc32)ccc1OC 842852099 JRCQJUYBSMVXGA-NQIIRXRSSA-N 396.556 5.265 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)n2)cc1 860501548 CKLNVKLGOXBBGQ-NJDAHSKKSA-N 397.503 5.442 30 20 GKED COCc1ccc(NCc2cc(C#N)ccc2Br)cc1C(F)(F)F 864034077 UJWULXJYMDVJCJ-UHFFFAOYSA-N 399.210 5.098 30 20 GKED Cc1nc2sccc2c(=O)n1N=Cc1ccc(-c2cccc(Cl)c2)s1 914693949 VJIXNPUZDSOTTD-UHFFFAOYSA-N 385.901 5.031 30 20 GKED O=C(/C=C\c1ccc(Br)s1)c1sccc1Br 915113934 YLFYOANIICQQBC-IWQZZHSRSA-N 378.110 5.231 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2ccccc2)C2CC2)cc1 915352740 KAEXNOGPZKUZCU-BJKOFHAPSA-N 381.479 5.615 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(-c3cccc(Br)c3)n2)cc1 916134221 HKNSKGJOFBOEFU-HJWRWDBZSA-N 395.281 5.340 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1nc(C)c(-c2ccccc2)s1 918029434 YKZWNHJKBAWVEH-UHFFFAOYSA-N 393.512 5.347 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2oc3c(C)cccc3c2C)cc1 920110343 DEIFJWOYQGTVKJ-JLTOFOAXSA-N 388.467 5.524 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)cs2)cc1 1776125629 OEOZQELNKZDGLH-PCUGXKRQSA-N 386.513 5.938 30 20 GKED COc1ccc(C(=O)/C=C/c2c(Cl)ccc(Cl)c2Cl)cc1CC(=O)O 1776131759 FQFNONNGXVNMAE-ZZXKWVIFSA-N 399.657 5.179 30 20 GKED C=C1C[C@@H](C(=O)O)N(Cc2cc(F)ccc2Oc2ccc(Cl)c(CC)c2)C1 1776146185 FABPHBUQZPLOTL-IBGZPJMESA-N 389.854 5.049 30 20 GKED C=CCc1cc(C)c(OCCCN2CCC([C@@H]3CCC[C@@H]3C(=O)O)CC2)cc1C 1776188876 LGJZFLRYCLITMC-GOTSBHOMSA-N 399.575 5.014 30 20 GKED CC(C)(C#N)c1ccc(/C=C(/CCCC(=O)O)c2nc3ccccc3s2)cc1 1776230892 OMCTYHJGFDMQHV-VKAVYKQESA-N 390.508 5.893 30 20 GKED CC1(C)C/C(=C/c2cc(Br)cc(C(=O)O)c2)C(=O)c2ccccc21 1776526698 WTKFHCBXSZNZTJ-ZSOIEALJSA-N 385.257 5.095 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C/c1cccc(OCc2ccccc2C(=O)O)c1 1776665812 DGTGXMHYRQKWHG-SYXCRGJESA-N 398.458 5.422 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)sc(C)c1Br 1776783310 OLALUUOCXJEOQI-CQSZACIVSA-N 390.387 5.421 30 20 GKED CCCCCCCCc1ccc(C(=O)Nc2ccc(OCC(=O)O)cc2C)cc1 1776786608 BOXIWIHOPMUOHJ-UHFFFAOYSA-N 397.515 5.614 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC2CCCCC2)C(=O)O)c1 1776787471 XUCJFLXJCQKICL-JOCHJYFZSA-N 375.553 5.549 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(OCCC(=O)O)cc2)oc2ccc(C)cc12 1776956138 FVDPYNSIDLUAJX-YFHOEESVSA-N 378.424 5.053 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1csc(C(=O)O)c1 1777487789 UXJLWTVLUNUPKZ-FARCUNLSSA-N 389.885 5.428 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3ccc(Br)cc3C2=O)c(Cl)c1 1777673228 IJSQLNYFJJXVNF-KPKJPENVSA-N 391.648 5.013 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(C)c(C)c2)[n+]2ccccc2)s1 22695553 VSFOJFLTZLGKMJ-UHFFFAOYSA-O 381.546 5.012 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(Cl)cc1Cl 46668133 JMYFWMYWYWPLDP-UHFFFAOYSA-N 398.249 5.613 30 20 GKED CCOc1ccc(-c2nc(/N=C(\O)c3ccc(C(C)=O)s3)sc2C)cc1 51206790 CTLIJKSBTZICBN-UHFFFAOYSA-N 386.498 5.418 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2cccc(Cl)c2)n1 63667533 NXWJNVJVSAMLAT-UHFFFAOYSA-N 395.915 5.386 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Cc3cccc(F)c3)n2)cc1 69286483 SWZDIOLOITYJOS-LIRRHRJNSA-N 394.471 5.013 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2nc(-c3ccccc3)cs2)cc1Cl 97529525 WTGWUJOQHBHPKC-CMDGGOBGSA-N 385.872 5.377 30 20 GKED Cc1ncc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 98118710 HEWDAZYXGUWJDX-SFHVURJKSA-N 396.903 5.082 30 20 GKED COc1ccc(CCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(OC)c1 153801252 MJAMTIIMKQLNQT-INIZCTEOSA-N 398.528 5.059 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(-c2ccncc2)cc1 174344512 INYSUCBKQGAVOA-QGZVFWFLSA-N 384.483 5.432 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1Br)c1ccc(-c2ccncc2)cc1 181230818 NHPSGMJXMODUJT-OAHLLOKOSA-N 392.300 5.234 30 20 GKED CC(=O)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 182872023 UFTGZKWYIGNSRO-KRWDZBQOSA-N 380.856 5.156 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](O)c1ccc(OC(C)C)cc1 191491351 CXSJWIRMZJKLQY-JOCHJYFZSA-N 396.531 5.181 30 20 GKED CC(C)(CCC#N)COC(=O)c1oc2ccccc2c1CSc1ncccn1 195047948 NHBMLNCCUICLPY-UHFFFAOYSA-N 395.484 5.002 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1Cl)C(=O)Nc1ccc(Cl)cc1Cl 255771801 LDMDONYDOUPJDS-DMTLFAOVSA-N 393.657 5.008 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)CC1 272460497 CGYZQXMCFAFHPL-ZDUSSCGKSA-N 398.359 5.130 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H]1OCCc2sccc21 294196724 VHSPYJXQFHKDRW-BIENJYKASA-N 386.542 5.031 30 20 GKED CC(C)(Cc1ccccc1Cl)/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330028313 OHMQXIKRRNRHTO-UHFFFAOYSA-N 376.928 5.543 30 20 GKED CO[C@H](C)c1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 369987899 UEYXXDGKZGZNGS-JKSUJKDBSA-N 377.513 5.240 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(Cl)cc(Br)c2)c1 391516542 QQGVEDBHVJLFSS-UHFFFAOYSA-N 393.668 5.037 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c2[C@@H]1C 410988910 TWPSDBQSHRQPNE-VXGBXAGGSA-N 394.525 5.076 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc2c(c1C#N)[C@H](C)C[C@H](C)C2 410994855 BQZFDGSKIMIREE-NWDGAFQWSA-N 395.484 5.043 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](C)c1ccc(C2CC2)cc1 419341196 NYJDSJARVIKOMD-IRXDYDNUSA-N 393.556 5.105 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c(Cl)c1 430354557 NSYMPGUHDJZQEQ-UHFFFAOYSA-N 389.867 5.487 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H](c1ccc(F)cc1)C1CCC1)c1ccccc1 431922918 BUKLOCQEOJICEK-VXKWHMMOSA-N 379.479 5.401 30 20 GKED COc1cccc(C)c1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 436222387 RQKGKQNQBCKTNI-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1 438065426 MXDXYAWZEYJVAW-LEOXJPRUSA-N 378.516 5.037 30 20 GKED CS[C@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 438660751 NPPKVTVXFNZROK-RDJZCZTQSA-N 399.491 5.285 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(Cc2ccccc2Cl)CC1 439103992 XXMICAJQNRIKHB-OAHLLOKOSA-N 384.932 5.553 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N(C)c2ccc(C#N)cc2)cc1OCC 440061268 KDFDIWRNLXMTLA-UHFFFAOYSA-N 386.879 5.066 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@H]3c3ccc(Cl)cc3)o2)c1 441407830 VDCIKFDKZPUBON-FQEVSTJZSA-N 392.890 5.379 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)o2)cc1 443881277 QGXMSQKSHGKUFF-UHFFFAOYSA-N 399.372 5.112 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)C1CC1 444389925 RFLUSZQIDVYJIY-INIZCTEOSA-N 387.439 5.701 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 448511154 SBMLPLWIJJTJFN-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 460171907 MRGFHVJUWYQRRP-HOTGVXAUSA-N 391.323 5.741 30 20 GKED N#Cc1cc(N2Cc3ccccc3-c3ccccc3C2)nc2ccc([N+](=O)[O-])cc12 462807916 TXUDCBNFAWTFNU-UHFFFAOYSA-N 392.418 5.202 30 20 GKED N#CC1(CCCN2CCC(c3cccc(Cl)c3Cl)CC2)CCOCC1 463363921 CWJGJMWUUHOGAU-UHFFFAOYSA-N 381.347 5.273 30 20 GKED CCCOc1ccc(CCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 463752545 CMYZYRLFQQTUEX-QGZVFWFLSA-N 382.529 5.441 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)[C@@H](C)c2cccc(C#N)c2)c1 464491310 VHPPSAJFTHMEMJ-KRWDZBQOSA-N 389.886 5.252 30 20 GKED N#Cc1cn(C/C=C\c2ccc(Cl)cc2)c2ccc(Br)cc2c1=O 468468011 OJMUSJINNGBWQV-UPHRSURJSA-N 399.675 5.002 30 20 GKED Cc1nc2cc(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)ccc2o1 470848745 NKPXOIXWMDFTHJ-UHFFFAOYSA-N 397.434 5.034 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)CCCCOc2cccc(C#N)c2)c1 474977972 QHPCEWCNMALSEP-HSZRJFAPSA-N 376.500 5.088 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cnc3ccccc3c2)cc1F 475960485 XAZRVILRXVWPFQ-UHFFFAOYSA-N 397.409 5.219 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccccc1 476289470 GTTDVSIAOXFRBJ-SFHVURJKSA-N 382.454 5.324 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1 476812713 FZCIMHWLZREERN-NRFANRHFSA-N 375.472 5.151 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1cccc(Br)c1 479770916 UCWVDSJRMDFTRY-KBPBESRZSA-N 375.335 5.874 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1 483620615 IMIQEJLTTXSVGQ-JXFKEZNVSA-N 397.519 5.837 30 20 GKED C=CCCC1(C(=O)Nc2c(Br)cc(F)cc2Br)CC1 484046788 DIUWEMMVRDQMDD-UHFFFAOYSA-N 391.078 5.036 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1 486414492 ZMSUWBAIOHQFAH-UHFFFAOYSA-N 387.464 5.420 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(-c2ccccc2Cl)o1)c1ccccc1 487209544 LJBNRWHVADFABQ-IBGZPJMESA-N 378.859 5.765 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cc(Cl)ccc3OC3CCCC3)o2)c1 488140333 PJRJFTYPPAMJFC-UHFFFAOYSA-N 394.862 5.195 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 488672018 INESVQBWLCYSCX-HSZRJFAPSA-N 395.462 5.109 30 20 GKED CSc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1Cl 503477995 FSXJEECBKYZQBO-UHFFFAOYSA-N 383.904 5.255 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1/C=C/c1ccccc1 506683892 UFFDSWWBRHXFEK-UJEKTLITSA-N 391.540 5.648 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)Nc3ccccc3-c3ccccc3)CC2)cc1 509086913 WFIAUUUSUPDVFA-UHFFFAOYSA-N 397.478 5.301 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1C 513303844 OPWQBBBSXHKOHR-HSZRJFAPSA-N 392.478 5.610 30 20 GKED CCCN(C(=O)[C@H](C)Oc1ccccc1C#N)[C@@H](C)c1cc2ccccc2o1 516623175 QPSIKUXGGZNAEA-IRXDYDNUSA-N 376.456 5.072 30 20 GKED COc1ccc(CCCCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 518207385 HFUWZJPNLGEXHO-GOSISDBHSA-N 391.298 5.096 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2 518668688 LWVOGJARGQHZOS-LDPKQNHRSA-N 382.573 5.873 30 20 GKED CC(C)Cn1nccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523881564 GQFGOPCLQHHWEB-UHFFFAOYSA-N 394.862 5.109 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)Nc1cccc(C#N)n1 532070076 LOLWLSGEIRMLQA-LLVKDONJSA-N 399.317 5.321 30 20 GKED N#CC1(c2nc(-c3ccc(-c4csc(-c5ccncc5)n4)cc3)no2)CCCC1 533740869 REBOSXWSJTWSBC-UHFFFAOYSA-N 399.479 5.257 30 20 GKED CC(C)(C)NC(=O)c1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 537736848 YAPCDQWUJWOIHG-UHFFFAOYSA-N 375.516 5.031 30 20 GKED N#Cc1cccc(-c2cnc(CNc3ccnc4cc(C(F)(F)F)ccc34)[nH]2)c1 538494288 KQAGEPZREFVBTD-UHFFFAOYSA-N 393.372 5.127 30 20 GKED Cc1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)nn1[C@H](C)C1CC1 539631039 JPEYTVVLYRUMDJ-CQSZACIVSA-N 376.485 5.015 30 20 GKED COc1cc(C#N)ccc1CN[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 544471656 XXYPXYHQWNFQLG-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 545919177 HFSYFRVFDPGRTO-INIZCTEOSA-N 388.842 5.632 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1)c1ccccc1 547977344 CNTBOLQJPDBSMN-OAHLLOKOSA-N 375.859 5.637 30 20 GKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(OC(F)F)cc1OC(F)F 551571175 KNTJYZRGOYYEGQ-GFCCVEGCSA-N 394.368 5.101 30 20 GKED CC(C)(C)n1nc(C(=O)N(Cc2ccccc2)c2ccccc2C#N)cc1C1CC1 556054860 IQMQNUFQGQKJNK-UHFFFAOYSA-N 398.510 5.234 30 20 GKED N#CCCCCCC(=O)N(c1cc2c(cc1Cl)OCO2)C1CCCCC1 588950794 SAMIAAWJXFLGOU-UHFFFAOYSA-N 376.884 5.208 30 20 GKED Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2F)c(C)n1CC(F)(F)F 596574144 CMKJSPASOVGTFZ-UHFFFAOYSA-N 382.279 5.077 30 20 GKED CC(C)N(Cc1ccc(NCc2cccc(F)c2C#N)cc1)C[C@H]1CCCCO1 600853086 VCEBAJYEMVJLJB-JOCHJYFZSA-N 395.522 5.089 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)CCCc3c[nH]c4ccccc34)c2C#N)C1 602755016 DWGVNRRJCQEBEP-CQSZACIVSA-N 377.513 5.187 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCc1ncc(-c2ccccc2)o1 603968560 BGAUFLDBUXDEFL-UHFFFAOYSA-N 399.475 5.513 30 20 GKED Cc1cc(-c2ccccc2)ccc1NCC(=O)Nc1cc(Cl)ccc1C#N 604005883 GHQRRKPIBFGLLQ-UHFFFAOYSA-N 375.859 5.238 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)NC3(c4nccs4)CCCC3)c2)cc1 609698829 HCHIFNJINIUJGL-UHFFFAOYSA-N 389.480 5.006 30 20 GKED C[C@@H](NC(=O)[C@H](Oc1ccc(Cl)cc1)c1ccccc1)c1cccc(C#N)c1 610359422 IYTUHFHDAYZCDV-OPAMFIHVSA-N 390.870 5.209 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2Nc1ccc(NC(=O)N2CCCCCC2)cc1 611476045 HMBDFUYDIOGRMJ-HSZRJFAPSA-N 388.515 5.456 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)N[C@@H](c1c[nH]c2cccc(F)c12)C(F)(F)F 648583021 QDOOTLLQAZECPN-SDBXPKJASA-N 384.295 5.005 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1 666865928 CKJXZQHCIBDAAF-JTHBVZDNSA-N 392.543 5.168 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726448363 PBOWIBPSWIXDCV-NSHDSACASA-N 386.933 5.211 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2cccc(OCc3ccccc3)c2)cc1 728698089 CJDGLWZSCSVHRS-RYBIEJRYSA-N 383.447 5.453 30 20 GKED C#CCOc1cccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 731012948 DPQOQXCABFEHSS-UHFFFAOYSA-N 398.487 5.115 30 20 GKED O=C(/C=C\c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccc(F)c(F)c1 732714762 XMFHGPAXQPORMD-FPLPWBNLSA-N 389.199 5.014 30 20 GKED C[C@@H]1CCCC[C@H]1OCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733681695 YQIUDFKMXQUOMW-AXAPSJFSSA-N 396.434 5.087 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3oc4ccccc4c3c2)c1 733842176 RBEHJTDJROQFQB-GOSISDBHSA-N 399.450 5.589 30 20 GKED N#CCOc1ccc(Cl)cc1CN[C@H](c1ccccc1)c1ccc(F)cc1 735309032 CTPONCPCTSHPBX-JOCHJYFZSA-N 380.850 5.261 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)SCc2cc(Cl)ccc2OCC#N)c1C 735318328 LELMIZFIFQBBRL-OAHLLOKOSA-N 388.920 5.120 30 20 GKED Cc1cc2cc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)oc2cc1C 742536584 AUKKASMSZFPOKO-JOCHJYFZSA-N 380.447 5.957 30 20 GKED Cc1ccc2c(CCC(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c[nH]c2c1 745947813 OCRRQFKDAGPMPX-IBGZPJMESA-N 385.492 5.409 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(F)cc1F 752482382 UNXYWHYVBVYQDD-QMTHXVAHSA-N 390.842 5.598 30 20 GKED C=CCN(C(=O)c1ccc(F)c(C(=O)CC)c1)c1nc(-c2ccccc2)cs1 757929265 TYDNOOPFNDNDHD-UHFFFAOYSA-N 394.471 5.375 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1nc2ccccc2s1 759184181 QXTLVUBIPJJJRZ-ZNFPLGDCSA-N 389.867 5.388 30 20 GKED Cc1cc(Cl)c2c(c1)C(=O)/C(=C\c1cnc(-c3ccccn3)s1)CCO2 767735732 HZSQKWHVCVCCMN-RAXLEYEMSA-N 382.872 5.216 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1cccc(Oc2nccs2)c1 768028502 NJNNOIHAYGJQTH-UHFFFAOYSA-N 378.453 5.094 30 20 GKED Cc1ccccc1-c1cnc(COC(=O)c2cn(CCCC#N)c3ccccc23)o1 769543251 QWZWGAIRIIGZDC-UHFFFAOYSA-N 399.450 5.266 30 20 GKED C[C@H](C#N)Oc1ccc(CN(C)[C@@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 770323245 FZWGJDCNWVROII-ACJLOTCBSA-N 382.813 5.366 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NCc2ccc(O[C@H](C)C#N)cc2)c1 770586790 VVLNEGKMIXATOR-CQSZACIVSA-N 380.435 5.552 30 20 GKED COc1cc(CSCc2ncc(C)s2)ccc1OCc1cccc(C#N)c1 771686085 WKEJCTNKLANGCE-UHFFFAOYSA-N 396.537 5.344 30 20 GKED C[C@H](NCc1cc(C#N)ccc1F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 773029925 IHLNOBZRAVLCBX-ZDUSSCGKSA-N 381.432 5.185 30 20 GKED N#CCCCn1cc(C(=O)O[C@H](c2ccccc2)c2ccncc2)c2ccccc21 774068339 HDNTZYUCKAHXGU-XMMPIXPASA-N 395.462 5.286 30 20 GKED C=C(C)[C@H](NC(=S)Nc1ccc(OC(F)F)cc1)c1ccc(F)c(F)c1 774205673 MGYGLMIPHSUJRI-INIZCTEOSA-N 384.398 5.170 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(F)c(C)c2)C2CC2)ccc1OC 774451521 YPIHUZZLIAJGFP-WMZHIEFXSA-N 382.479 5.065 30 20 GKED C[C@@H](NCc1cccc(COCc2ccccc2)c1)c1ccc(OCC#N)cc1 776153573 FIKSGIZSDPFPRX-HXUWFJFHSA-N 386.495 5.157 30 20 GKED CCC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776154884 CPHJFSXQWXBDQA-FOIQADDNSA-N 376.422 5.800 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccccc1Oc1ccc(Cl)cc1 776854909 JXCUDEIEAMWLSH-UHFFFAOYSA-N 376.843 5.380 30 20 GKED Cc1cc2ccc(Cl)cc2nc1NN=Cc1c(C(C)C)nn(C)c1Cl 778553003 YTJWTYOHSZHXHX-UHFFFAOYSA-N 376.291 5.153 30 20 GKED Cc1ccncc1/C=C/C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784832795 AMEPXRDWEMLTIP-PFWMLDTASA-N 379.872 5.057 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@@H](F)C(F)(F)F)c(C(F)(F)F)c1 788126218 GRDNAFLBYNXGNZ-RDDDGLTNSA-N 377.325 5.435 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC1(NC(=O)OC(C)(C)C)CCC1 789718290 FYDSNGWJRGWUHA-UHFFFAOYSA-N 386.536 5.315 30 20 GKED C=C(C)[C@H](NC(=O)c1cc(C(F)(F)F)cnc1Cl)c1ccc(F)c(F)c1 791000889 SHPBRRUFBRKSIR-AWEZNQCLSA-N 390.739 5.079 30 20 GKED N#C[C@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 792089868 AVZHFPGTQNDPKC-UKILVPOCSA-N 390.486 5.828 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1cnc2ccccc2n1 792099467 BJEFTQMKZUDRKS-SXAWMYDMSA-N 399.450 5.387 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 793444866 WZNTWCWLFACAKV-QGZVFWFLSA-N 379.460 5.060 30 20 GKED CC(C)c1c(Cl)ncnc1NN=C1CCC(N(C)Cc2ccccc2)CC1 797788153 KMLKHRBBPBEVIC-UHFFFAOYSA-N 385.943 5.096 30 20 GKED Cc1cc(Cl)nc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 800529478 AGXZOEZQLJUENK-UHFFFAOYSA-N 392.846 5.029 30 20 GKED Cc1oc(C(C)C)nc1C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1 803911767 WBLHKNUSYOIKFW-UHFFFAOYSA-N 388.467 5.163 30 20 GKED C=CCC[C@H](NC(=O)c1ccc(C(OC)OC)o1)c1ccc(C(F)(F)F)cc1 807133332 PHPSUZPATJKQCG-HNNXBMFYSA-N 397.393 5.027 30 20 GKED COc1ccc([C@H](Cc2ccccc2)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 810255060 VHKKELSHPXZAFV-DFBJGRDBSA-N 386.495 5.232 30 20 GKED O=C(/C=C\c1ccc(-n2cncn2)c(F)c1)c1ccc(-c2ccccc2)s1 844255362 PWAUVJRPOALDQA-CLFYSBASSA-N 375.428 5.031 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)c1c(F)cccc1F 857478753 PDYKJSAXCKTDCZ-ZDUSSCGKSA-N 397.265 5.006 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2cccc(NC(C)=O)c2C1 879353090 BGFHLQZGVNGWHM-UHFFFAOYSA-N 391.515 5.087 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)CC(F)(F)F 892606574 IFRGJYBVADPFSQ-AWEZNQCLSA-N 391.418 5.227 30 20 GKED C=CCCC[C@H](NCc1cc(F)ccc1Oc1ccc(F)cc1Cl)C(=O)O 900068330 FFBMMYHWTOCPRY-KRWDZBQOSA-N 395.833 5.310 30 20 GKED CN(C)c1ccc(CN(C(=O)c2ccccc2-c2ccccc2C#N)C2CC2)cc1 914484365 HPHXNUGZEAELAZ-UHFFFAOYSA-N 395.506 5.096 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C/c1ccccc1C#N 914519740 CAIFGTGGJCWSDF-JLHYYAGUSA-N 395.437 5.124 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C\c3ccc(Cl)s3)cn2)c1 915175325 XLPVJQYYZIHZEK-VURMDHGXSA-N 381.844 5.112 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H](CCCc2ccccc2)c2ccccc2)c1 915711216 BMXAAIJDXCGKTE-XMMPIXPASA-N 399.494 5.475 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccc(Cl)cc3Cl)cc2)c1 1776029749 SDFDIDHKPIQYDH-UHFFFAOYSA-N 399.277 5.734 30 20 GKED O=C(O)c1ccccc1NN=C1CCCCC[C@@H]1c1ccccc1C(F)(F)F 1776030277 FJIXEYXPRVYXHY-OAHLLOKOSA-N 390.405 5.919 30 20 GKED O=C(/C=C\c1c(F)ccc2sc(C(=O)O)cc12)c1ccc2c(c1)CCCC2 1776113476 KZIILVNGKOQNDT-CLFYSBASSA-N 380.440 5.514 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccccc2Cl)o1 1776782943 QJLFOMFNHKNOKM-MRXNPFEDSA-N 377.912 5.893 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(Oc2ccc(F)cc2)c1 1776783815 NKEUYKFRJBRHLK-HXUWFJFHSA-N 387.495 5.911 30 20 GKED Cc1cc(Br)sc1/C=C1/CCCc2cc(C(=O)O)ccc2C1=O 1777418135 KUUSJGWQECNGPB-XFXZXTDPSA-N 391.286 5.120 30 20 GKED COc1ccc(/C=C2\CCCc3c2nc2ccccc2c3C(=O)O[C@@H](C)C#N)cc1 6034672 CJYSQSWORBYDJY-KXGFGANYSA-N 398.462 5.189 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cccc(C)c2)[n+]2cccc(C)c2)cc1 28779781 WKURHYXEMKBLSW-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCN(C(=O)CCc1ccc(-c2ccccc2)[nH]1)c1nc2c(s1)CCCC2 60551045 FMMHDOORQIOHMW-UHFFFAOYSA-N 391.540 5.169 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCC(c1ccccc1)c1ccccc1 63400508 FIXSJMYGBWBMEX-UHFFFAOYSA-N 395.506 5.088 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cs1 67600704 WXKXYMHIKHLNJQ-AWEZNQCLSA-N 375.478 5.218 30 20 GKED N#CCCCOc1cccc(NC(=O)CSc2ccc3ccccc3c2)c1 108292687 QSYANDWJFOJTLL-UHFFFAOYSA-N 376.481 5.253 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(Br)c(F)c1 130217400 BGWIAHCDJVSGQX-FNORWQNLSA-N 389.249 5.003 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2ccc(CC#N)cc2)C1 157093787 DHOIDAIKKRRSMK-KUHUBIRLSA-N 387.405 5.386 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](c3ccccc3)C3CC3)n2)cc1 162081399 YMAHARLELYOHMU-TZIWHRDSSA-N 388.492 5.189 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCc1ccc(Cl)s1 171740846 CDROQCKMALPPRJ-LBPRGKRZSA-N 379.938 5.017 30 20 GKED N#C[C@H](C(=O)CCCCCc1cccs1)c1nc2ccccc2n1C(F)F 171782866 QCEHCJBNXZTWBV-OAHLLOKOSA-N 387.455 5.472 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cccc(OCC(F)(F)F)c1 172905849 JHKNLROOPQGYID-AWEZNQCLSA-N 380.435 5.492 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2cccc(-c3nnco3)c2)cc1 175398920 FXUFKQPWOHZAPW-UHFFFAOYSA-N 398.447 5.012 30 20 GKED N#Cc1ccc(SCc2csc(-c3ccccn3)n2)cc1C(F)(F)F 180391156 XNPMJDZEJYMOFV-UHFFFAOYSA-N 377.416 5.388 30 20 GKED Cc1nc(CCC(=O)NC2(C#N)CCC(C(C)(C)C)CC2)oc1-c1ccccc1 187285700 GQOXRDMDEZKPKU-UHFFFAOYSA-N 393.531 5.198 30 20 GKED C=C(C)[C@H](NCc1nnc(-c2cccc(Cl)c2)o1)c1ccc(F)c(F)c1 187783063 PVDFBHGLSSHLSZ-SFHVURJKSA-N 375.806 5.075 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)Nc1ncccc1OCCCC#N)C1CC1 188775155 GEPLEMMXCIBZLJ-OAHLLOKOSA-N 398.894 5.175 30 20 GKED CSc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 195595245 NLTSKZKHMVTLBS-LJQANCHMSA-N 392.911 5.970 30 20 GKED Fc1ccc([C@@H](NCc2cccc(OCC(F)(F)F)c2)C(F)(F)F)cc1 237780477 YHWDSUOINVMIOP-OAHLLOKOSA-N 381.291 5.160 30 20 GKED Cc1nc(C)c(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)s1 266343409 MVXYYNVIKXHCHS-LBPRGKRZSA-N 391.587 5.026 30 20 GKED O/C(Cc1csc2ccccc12)=N/C1CCN(/C(O)=N\C2CCCCC2)CC1 328950892 XCGSEGWFRMMJPL-UHFFFAOYSA-N 399.560 5.111 30 20 GKED N#Cc1c(N=C(O)CCN2CCC[C@H]2c2cccnc2)sc2c1CCCCC2 329484145 QJNDGGGDHYELIV-IBGZPJMESA-N 394.544 5.099 30 20 GKED N#CCCC[C@@H](NC(=O)N1C[C@H](c2ccccc2)C2(CCC2)C1)c1ccccc1 413573513 JEIPECWQJGEEBC-DHIUTWEWSA-N 387.527 5.401 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 426063264 SHYSDYBZLXIVGE-QGZVFWFLSA-N 387.936 5.272 30 20 GKED Cc1c([C@@H](C)NC(=O)N[C@@H](CCCC#N)c2ccccc2)oc2ccccc12 431857354 LGPIASYNIULPAB-XLIONFOSSA-N 375.472 5.537 30 20 GKED CC(C)(c1ccc(NCc2nnc(-c3cccc(C#N)c3)o2)cc1)C(F)(F)F 432324916 IMFPFOCRTZSEFD-UHFFFAOYSA-N 386.377 5.060 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C(C)(C)C1 434211989 PSVQMPISAKOQNQ-PKOBYXMFSA-N 393.556 5.738 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)C1(c2cccc(C#N)c2)CC1 435352012 YSCDRCQNVQYFGY-UHFFFAOYSA-N 382.463 5.116 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC(C)(C)CC1 437966608 WXMILLXSWLHWJX-UHFFFAOYSA-N 391.515 5.490 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 438072839 LJUULBSGHJCWMR-OXJNMPFZSA-N 399.535 5.466 30 20 GKED CCSCc1cccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1 438375872 IKHINTXAVNUQPS-LEWJYISDSA-N 379.529 5.243 30 20 GKED C=CC[C@H](C)NC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 443948112 UXHINIAQYNICJN-ZDUSSCGKSA-N 382.851 5.162 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 447123580 YVHOEDRWUXFWIQ-ZDUSSCGKSA-N 377.941 5.441 30 20 GKED C[C@H]1CCN(C(=O)Nc2cccc(CC#N)c2)[C@H]1c1ccc(C(F)(F)F)cc1 455907121 OVGXLAASRDTOSJ-IFXJQAMLSA-N 387.405 5.386 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)Cc1cccc(F)c1 459399417 LUUPWMDAGXSIFR-HOTGVXAUSA-N 385.508 5.172 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccncc2)c(Cl)c1)c1cccc(C#N)c1 463604696 SYSFYSCVLPRMFJ-AWEZNQCLSA-N 377.831 5.141 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)c1ccc(C#N)s1 464241230 WFQIHZUJDHSJKP-UHFFFAOYSA-N 395.871 5.086 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cn(-c2ccccc2)nn1 471667283 JKSHZJPBARZZDD-KRWDZBQOSA-N 381.439 5.104 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1)c1ccccc1 472505896 SNAKUIYXCNHLED-OXJNMPFZSA-N 382.419 5.458 30 20 GKED CSc1cccc(C)c1NC(=O)NC1CCC(Oc2ccccc2C#N)CC1 473973573 FBSPFRPLVCUSIC-UHFFFAOYSA-N 395.528 5.100 30 20 GKED C=CCN(C(=O)[C@@H](C)SC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 476130166 CHXFIZFSNZMPPM-SNVBAGLBSA-N 387.357 5.387 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC(C)(C)[C@H]2c2ccncc2)cc1 476206215 HREQPUAILCEXFK-HSZRJFAPSA-N 397.478 5.277 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 480245102 AYIXERYQXRTAFB-UHFFFAOYSA-N 395.503 5.328 30 20 GKED C=C(C)[C@H](NCc1nc2ccc(Br)cc2[nH]1)c1ccc(F)c(F)c1 481612358 TYTUHFALYMXAGR-SFHVURJKSA-N 392.247 5.011 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1c(-c2ccccc2Cl)noc1CC 483370776 ULBJBGCJEYNNIN-UHFFFAOYSA-N 395.846 5.080 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 487239527 JHMTYOREMPMMLN-UGKGYDQZSA-N 378.516 5.437 30 20 GKED N#Cc1c(F)cccc1CSc1nnc(-c2ccncc2)n1C1CCCCC1 488270491 XWBOJHCCKGJQEC-UHFFFAOYSA-N 393.491 5.148 30 20 GKED N#Cc1cc(F)ccc1CSCc1nc(-c2ccc(C(F)(F)F)cc2)no1 488542304 WUZNKXYDJXTEBQ-UHFFFAOYSA-N 393.365 5.200 30 20 GKED C=CCc1cc(CN[C@H](c2ccc(Cl)cc2)c2ccsc2)cc(OC)c1O 500138557 BVAZGTPSPLXMAD-OAQYLSRUSA-N 399.943 5.723 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1 503491343 PYEXSLINNLYSTE-IFMALSPDSA-N 398.526 5.027 30 20 GKED CCOc1ccc(Oc2cc(CN[C@H](C)c3ccc(C#N)cc3F)ccn2)cc1 512661615 SZQUSTBSXJZBHH-MRXNPFEDSA-N 391.446 5.134 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 520475618 VZCDHYJEXTXLBU-HSZRJFAPSA-N 393.506 5.549 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 521887133 BVKWJZVBFBTYIL-HXUWFJFHSA-N 396.277 5.359 30 20 GKED CN(Cc1ccccc1NCC(C)(C)CCC#N)C(=O)c1cc2ccccc2o1 537729691 CQDWUVITVQBLMR-UHFFFAOYSA-N 389.499 5.447 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(CN2CCCCC2)cc1 553273462 MVKCGLMBFYSROS-SFHVURJKSA-N 393.556 5.319 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCc2cc(F)c(OC)cc21 558800127 CHZNJKKJHWETQH-FQEVSTJZSA-N 382.479 5.495 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1c[nH]c2ccccc12 561506892 MQICECSETSBHGL-UHFFFAOYSA-N 379.463 5.206 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)c(C(F)(F)F)c1 570015558 WROGJFVHWSUOFS-MRXNPFEDSA-N 390.302 5.499 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCC1 577202016 JZYBYVOAPOBQFS-IIBYNOLFSA-N 379.529 5.601 30 20 GKED COc1ccc(/C=C(/C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1F 588438964 ZBPLGDNHCWTNJP-ZSMUJPCHSA-N 384.476 5.271 30 20 GKED N#C[C@@H](C(=O)c1cnc(C2CC2)s1)c1nc2cc(C(F)(F)F)ccc2s1 591862575 WOJSAWLDXATEAZ-JTQLQIEISA-N 393.415 5.139 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(OC)c(Cl)cc1C1CC1 594205727 FCFQDDORJWLYDW-UHFFFAOYSA-N 395.890 5.318 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCC[C@]1(C)CC1(F)F 596703976 WNPRTZLUASMXFE-HXUWFJFHSA-N 385.414 5.216 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)C1 597923086 RHBLNNRTMIFRSB-MRXNPFEDSA-N 384.932 5.398 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 603637788 ZYKCSJPZAYPBCH-UHFFFAOYSA-N 384.479 5.821 30 20 GKED Cc1ccc(S[C@H](C)C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cc1 603834531 POLZAHYKSCMHRU-CQSZACIVSA-N 379.510 5.110 30 20 GKED Cc1oc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1C 604193277 APYPKCMEXNIWHA-UHFFFAOYSA-N 380.831 5.775 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@H](C#N)c1ccc(C(F)(F)F)cn1 607433302 PTPCTQUJWHFQHV-MRXNPFEDSA-N 390.430 5.649 30 20 GKED CC(C)N(CCC#N)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 608814026 SQNOXINLLZPYMP-UHFFFAOYSA-N 395.453 5.196 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609031139 BJRAUKUISSXOMQ-GJZGRUSLSA-N 389.282 5.394 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3ccc(F)c(C#N)c3)o2)cc1 609110678 UMVZAVUCHOBBFO-UHFFFAOYSA-N 397.409 5.580 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC1CC1)c1ccccc1 610405131 WXZQBWVLGXXXTF-HSZRJFAPSA-N 375.516 5.267 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)cc1C(F)(F)F 678296544 FYVGHCZMPBSTKT-NXEZZACHSA-N 383.229 5.017 30 20 GKED N#Cc1cccc(COC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)c1 725996501 VREHJBHDOZPZRV-UHFFFAOYSA-N 388.370 5.058 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)c1cccc(C#N)c1 727640605 LVFHJZYRUXHQFQ-CYBMUJFWSA-N 382.872 5.182 30 20 GKED C[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730380355 UMPLNCNTVWCYKC-HOYKHHGWSA-N 381.479 5.493 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 732696469 JMQKDBJOXMFZQF-XMMPIXPASA-N 387.527 5.942 30 20 GKED CC(=NNc1nccnc1Cl)c1sc(-c2ccc(Cl)cc2)nc1C 733080025 APVGVGXMHZMUQT-UHFFFAOYSA-N 378.288 5.051 30 20 GKED C=CC[C@H](NC(=O)NCC1(c2cccc(F)c2)CCCCC1)c1ccncc1 734662558 ABPGZYCBJNVCCP-NRFANRHFSA-N 381.495 5.039 30 20 GKED C[C@H](OC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cccnc1 735163695 NXJVSDDTJQWIOT-AWEZNQCLSA-N 378.815 5.317 30 20 GKED O=C(/C=C/c1cnc2ccc(Cl)cn12)c1ccc(N2CCCCC2)c(F)c1 737443655 KCLDKOCKOBVXJF-SOFGYWHQSA-N 383.854 5.013 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=S)Nc3ccc(F)cc3F)c2)s1 739437648 OXZPDKSZGWLBTJ-UHFFFAOYSA-N 385.464 5.052 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3cc(Br)cs3)c2)s1 740010770 HWUWAZZVXDHLBZ-UHFFFAOYSA-N 389.343 5.401 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1 740444198 MSAZTHVAYQOXNX-UHFFFAOYSA-N 385.552 5.301 30 20 GKED CC(C)(NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 740480225 PXYXBYBTTBRHBH-UHFFFAOYSA-N 375.497 5.021 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccnc4ccccc34)n2)cc1 741111430 NRENDIFRUVSSFU-CTDFXDFQSA-N 395.487 5.556 30 20 GKED O=C(/C=C\c1ccc(O)c(Br)c1)c1cccc(-c2ccncc2)c1 741473473 QLYUNEPKBMPFDL-XQRVVYSFSA-N 380.241 5.113 30 20 GKED C[C@@H]1/C(=C/c2cccc(OCCCC#N)c2)C(=O)c2cccc(Br)c21 742435740 XRLNEVQTAMMZKC-VVTMIQRTSA-N 396.284 5.515 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccc2c(c1)COC2 742435918 BQHDXLZMXFOEDD-CLFYSBASSA-N 377.421 5.250 30 20 GKED O=C1/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)Cc2cc(Cl)ccc21 742436012 DPQBUKMLEPHCIZ-JYRVWZFOSA-N 382.828 5.194 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)/C=C\c3cnc(C(C)(C)C)s3)c2C#N)C1 744351100 KJDHZEVBGQPVAN-VFFGBVLKSA-N 385.558 5.150 30 20 GKED C[C@H](ON=Cc1ccccc1F)c1nc(-c2cccc(C(F)(F)F)c2)no1 744445722 TYOGAKMLOOZZQS-NSHDSACASA-N 379.313 5.006 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-n3cccn3)cc2)ccc1SC(F)F 746346167 LTJWRLHNLGZJIG-UITAMQMPSA-N 386.423 5.092 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCCCC2)cc1 746661347 OKYATMSQGKEJRL-UHFFFAOYSA-N 390.531 5.239 30 20 GKED Cc1cc(C#N)ccc1NC1CCC(OC(=O)CC2CC(OC(C)(C)C)C2)CC1 753993884 CIHSVFJTGFOMCW-UHFFFAOYSA-N 398.547 5.117 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 758220321 FXOLBZWTDCBHLR-VSKRKVRLSA-N 393.556 5.480 30 20 GKED C=CCc1cc(CN[C@@H](C)c2cccc(-c3ccncc3)c2)cc(OC)c1OC 772947504 TWMWHCNHEAERGW-SFHVURJKSA-N 388.511 5.345 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1cc(Br)ncc1F)c1ccc(F)c(F)c1 775559144 WBKJNLJFUOCZLN-DYZYQPBXSA-N 385.227 5.229 30 20 GKED CCOc1cccc2cc([C@@H](C)NCc3cccc(O[C@@H](C#N)CC)c3)oc12 776163383 AGFHCWQFDBABSY-VQIMIIECSA-N 378.472 5.363 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC=C(c3ccccc3)C2)cc1 782561914 BSMXTNLVPYDUEW-UHFFFAOYSA-N 381.435 5.282 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 783070803 XCFTVWURDXIICW-SMDDNHRTSA-N 396.434 5.277 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792100651 LXBQJMIGELOIKQ-IFXJQAMLSA-N 382.385 5.309 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(OC(F)(F)F)cc1 792103644 LNJRRHSTUIMTNT-GOSISDBHSA-N 398.384 5.287 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797572875 KBVUDQNHTNJSJH-DOMZBBRYSA-N 394.462 5.829 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C/Sc1cc(F)ccc1F 797865840 FWRSHBXAZVMWQI-XEHSLEBBSA-N 390.480 5.461 30 20 GKED N#Cc1ccc(C2(NC(=O)c3ccc(C4SCCCS4)cc3)CCC2)cc1 847206837 TULMWXBLPUQZRB-UHFFFAOYSA-N 394.565 5.236 30 20 GKED C=CCN(C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1)C(C)C 915155518 UNCIYCIVEIBLSF-UHFFFAOYSA-N 391.298 5.282 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 916847819 QXFDIZAFYOUIFQ-ZDUSSCGKSA-N 389.307 5.802 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)CC(C)(C)C 916887130 LBNHYNBWNHDFJG-SWLSCSKDSA-N 382.476 5.111 30 20 GKED N#C[C@H](C(=O)Cc1ccsc1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 917030229 GJXQKRDLLHZKTO-JRQWYPPZSA-N 382.554 5.091 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCOc3cccc(F)c3)n2)cc1 918490766 VUZKJWGPTCCVQE-IBGZPJMESA-N 394.471 5.293 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2cccc(CC(=O)O)c2)cc1)c1ccccc1 1776469377 BOUDTSKPPZPORK-KAPURRDVSA-N 386.447 5.350 30 20 GKED CCCCCCCOc1cccc(/C=C/C(=O)c2cccc(OCC(=O)O)c2)c1 1776788989 HZHNPNAZDLNXKI-BUHFOSPRSA-N 396.483 5.395 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1F 1777353269 JTHKPLSYOUPBSC-SOFGYWHQSA-N 382.412 5.157 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3cnn(-c4ccccc4)c3)cc2)cc1 1777671207 SVWMVEVMGZUFFM-OVCLIPMQSA-N 394.430 5.134 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325586 NRMHKZVXHDRVHS-ZGXWSNOMSA-N 394.559 5.159 30 20 GKED N#Cc1ccccc1CSCCNC(=S)Nc1ccc(Cl)cc1Cl 18163375 ASZXHBUMJLTZJG-UHFFFAOYSA-N 396.368 5.085 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2ccc(C)cc2Cl)nc2ccccc21 22351387 SZZKEDXDIDHVRJ-CQSZACIVSA-N 385.920 5.303 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N(C)Cc2cccc(C#N)c2)cc1 43900276 CBSGWOPEYFMMRU-UHFFFAOYSA-N 387.439 5.023 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\Cc3ccc(C)cc3C2=O)cs1 108145322 NZNVSMMVSHQWNX-LFIBNONCSA-N 392.455 5.098 30 20 GKED C=C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 120018137 WFBSRSHVJUPFNI-OXJNMPFZSA-N 388.492 5.355 30 20 GKED N#C[C@H](C(=O)c1sccc1Br)c1nc2cc(Cl)ccc2s1 120034786 XFJHUGVAJNBGHC-MRVPVSSYSA-N 397.706 5.264 30 20 GKED Cc1cccc2c(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c12 122334233 IUQVOZPRIWAHOA-HNNXBMFYSA-N 379.872 5.158 30 20 GKED Cc1ccc2[nH]c(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)c(C)c2c1 131898490 OBTZDWVAEDDRFX-UHFFFAOYSA-N 396.450 5.404 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1 183109652 FMILDCVDOKGCSW-GOSISDBHSA-N 398.462 5.246 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)cc1F 189881331 OXCFIPWPORIGLP-UHFFFAOYSA-N 376.269 5.692 30 20 GKED N#CCN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1ccccc1 302364887 IGGTXFRYHOLOLP-UHFFFAOYSA-N 381.410 5.211 30 20 GKED COc1cc(C)cc(N=C(O)N2CCC[C@H](c3nc4c(s3)CCCC4)C2)c1C 330209158 HHOPYJNASODOAY-INIZCTEOSA-N 399.560 5.072 30 20 GKED C=CCOc1ccc(/C=C2\CCn3c2nc2cc(Cl)ccc2c3=O)cc1Cl 409709298 ADJXWKJSTCSQSZ-GXDHUFHOSA-N 399.277 5.212 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(c2ncccc2Cl)CC1)c1ccccc1 429001508 YKVKQCKMNMQTEJ-HXUWFJFHSA-N 383.923 5.332 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(CCC#N)CCC(C)C)cc2)n1 429046969 NTUNYCNROZDNGC-UHFFFAOYSA-N 388.562 5.396 30 20 GKED CCOc1ccc(-c2nc(CN3CCC[C@@H]3[C@H](C#N)c3ccccc3)co2)cc1 437575707 AWMJKCUPLXDWAR-DHIUTWEWSA-N 387.483 5.012 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1csc(C)n1)c1ccc(C(F)(F)F)cc1 441535900 VVFHOQPTENMQRA-KRWDZBQOSA-N 397.466 5.319 30 20 GKED C[C@@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1cccc(C#N)c1 442909643 WBLYKZGTJQQYOO-SECBINFHSA-N 382.798 5.126 30 20 GKED N#CC(CCN1CCO[C@H](c2cccs2)C1)(c1ccccc1)c1ccccc1 444655111 RCJSZKRREOCDLA-QFIPXVFZSA-N 388.536 5.021 30 20 GKED C[C@@H]1c2cc(F)cc(F)c2CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458808021 YQGOTSKJVRTENM-VFNWGFHPSA-N 383.442 5.029 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458832403 HTHXHXCVORYACT-WTIAFYNJSA-N 375.516 5.399 30 20 GKED N#CCc1cccc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)c1 460338726 LNRFBJSOAZOMIF-UHFFFAOYSA-N 385.854 5.125 30 20 GKED CC(C)c1ccc(C[C@@H]2CCN(C(=O)c3cccc(SCC#N)c3)C2)cc1 461199999 FBVAFTDDUMQYPU-IBGZPJMESA-N 378.541 5.130 30 20 GKED C[C@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1nc2ccccc2n1C(F)F 463437115 CYTIKJZXZHFKCU-JTQLQIEISA-N 380.320 5.495 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)Nc2ccc(CC#N)cc2)cc1 466078123 SQVYQVGENLBTQX-QGZVFWFLSA-N 385.467 5.311 30 20 GKED N#Cc1cc(CNc2cc(C(=O)Nc3ccccc3)ccc2Cl)ccc1F 467763175 HBZXEIUYWLQUQU-UHFFFAOYSA-N 379.822 5.215 30 20 GKED Cc1ccc([C@@H]2CCC[C@H]2Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469273571 VUJFDVPDEIGGPP-XZOQPEGZSA-N 387.527 5.326 30 20 GKED N#CC[C@@H](CC(=O)NCCc1ccc(OCc2ccccc2)cc1)c1ccccc1 474907536 UKEXRKAHIYNSGA-DEOSSOPVSA-N 398.506 5.012 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)C[C@H](CC#N)c2ccccc2)cc1 476120201 KJMBZCJFRIGETE-CVDCTZTESA-N 398.506 5.627 30 20 GKED Cc1c([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)oc2ccccc12 479346259 NPDTZXPXVVTVSK-KRWDZBQOSA-N 375.472 5.294 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1cccc(OC(C)C)c1 479757725 JNAWTVPMCXJSRQ-LJQANCHMSA-N 398.551 5.100 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N=c1[nH]n(C2CCCCC2)cc1C 481442116 VURYLIIYQMUDBO-UHFFFAOYSA-N 392.956 5.054 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1)c1ccccc1 494534966 ZXPRXSNYSPZJDL-FXAWDEMLSA-N 399.918 5.444 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 495108780 CLLLKAOBNQANBE-CQSZACIVSA-N 376.378 5.201 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccc3Cl)on2)sc2c1CCCCC2 506566563 OICYTLBBSKKESX-UHFFFAOYSA-N 397.887 5.449 30 20 GKED CCN(C(=O)c1csc(-c2cccc(Cl)c2)n1)[C@H](C)c1ccc(C#N)cc1 509563246 FAHSFFOMNBHXCQ-CQSZACIVSA-N 395.915 5.558 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 516224517 WCPHFHCWGVUKQW-HNNXBMFYSA-N 377.469 5.165 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1occc1COc1ccccc1 518668918 TYKZMJNWFGKIGR-MRXNPFEDSA-N 392.480 5.363 30 20 GKED CCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCCCC1 523620466 ZORYOOBZKNXOQK-UHFFFAOYSA-N 391.515 5.518 30 20 GKED CC[C@@H](NCc1ccc(OC)c(OCCCC#N)c1)c1ccc(Cl)s1 523691567 PZGYUZPPPYPEGK-OAHLLOKOSA-N 378.925 5.334 30 20 GKED Cc1cccc2c(CCC(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)c[nH]c12 525576337 YCVJOJWMDWWJDA-QGZVFWFLSA-N 386.282 5.097 30 20 GKED CN(C(=O)c1cc2ccccc2cc1OC(F)F)c1cc(Cl)ccc1C#N 534885113 GYFDFVXXSYCKHP-UHFFFAOYSA-N 386.785 5.243 30 20 GKED Cc1ccn2cc(-c3ccc(NC(=O)c4ccc(C5(C#N)CC5)cc4)cc3)nc2c1 537398052 HTYARXHUSDIYMP-UHFFFAOYSA-N 392.462 5.117 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)Nc1cccc(OCCCC#N)c1 538526342 CVRWEBXBSFEGLL-OAHLLOKOSA-N 395.503 6.113 30 20 GKED N#CCC1CCN(C(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1 541989308 QOUJZXSXLNSUPB-UHFFFAOYSA-N 391.273 5.565 30 20 GKED CCn1c(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2c(F)cccc21 542947497 DVXCIELGTLOEPX-QGZVFWFLSA-N 398.485 5.585 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCC[C@H]2c2ccc(Br)s2)c1 552441693 SBSLXNJJYSVIMP-ZDUSSCGKSA-N 395.709 5.013 30 20 GKED C=CCN(C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1)C1CC1 552825565 LCVQWEHDETWCBR-UHFFFAOYSA-N 388.414 5.146 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H]1CCc2ccc(C#N)cc21 558504730 XKYHZVLBCFFUJR-RNODOKPDSA-N 377.488 5.467 30 20 GKED CSC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 573271379 JAABTPSWAUHDQR-PMACEKPBSA-N 392.490 6.134 30 20 GKED CCOc1ccc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)cc1OCC 583235381 BUSPWYLFCFIAPU-CQSZACIVSA-N 392.421 5.225 30 20 GKED N#CCCCCCC(=O)N(Cc1ccsc1)c1ccc(Br)cc1 588887611 HWFYSLKXTGJZGY-UHFFFAOYSA-N 391.334 5.518 30 20 GKED CN(C(=O)CSc1cccc(F)c1C#N)C(c1ccccc1)c1ccccc1 590596222 BWCUGWPBNNSCQU-UHFFFAOYSA-N 390.483 5.037 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccccc3C(F)(F)F)cn2)cc1 603763735 CJKUECUEMDODHR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 603978513 PXAAZMQOKXGLHH-UHFFFAOYSA-N 386.451 5.097 30 20 GKED CN(CCCOc1ccc(Cl)cc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 604084827 AUKOYEZSCQAJBC-UHFFFAOYSA-N 385.895 5.074 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)NCc3ccc(C#N)cc3F)c2)C1 609252235 HNIIKRULGDQCOB-IERDGZPVSA-N 395.478 5.114 30 20 GKED CCC[C@H](NC(=O)NCc1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 609253092 SBBTVDKRZBVQMG-SFHVURJKSA-N 393.384 5.057 30 20 GKED CCC[C@@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccn1 609299499 ZWHBIDFTPIFQKZ-OAQYLSRUSA-N 389.430 5.156 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@H](c1ccc(Cl)cc1)c1cccs1 609669659 RBQGBIWXVZGGGQ-MRXNPFEDSA-N 393.821 5.888 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C(C)(C)c1ccccc1 610177292 AYDBKZBLKVFAAS-QFIPXVFZSA-N 399.494 5.232 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1ccccc1C(F)(F)F 610227833 MQOFCZALEMWFSG-ZDUSSCGKSA-N 378.419 5.453 30 20 GKED CC(C)[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 610792648 SLHZFPRQSPYWSJ-JTSKRJEESA-N 393.556 5.868 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(OC3CCCC3)cc2)c(Cl)c1 611096199 VZPNGUGLZWFGKJ-UHFFFAOYSA-N 375.255 5.439 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 613407605 ZGBFQDKTCVZUIZ-CYBMUJFWSA-N 386.908 5.008 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(Cl)c1F 619125157 KBMGDHBXRTYTNS-UHFFFAOYSA-N 379.703 5.263 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619768112 IVDOWXOGHQXAPI-KBPBESRZSA-N 390.314 5.199 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1ccncc1)c1nc2cc(F)ccc2s1 670118758 MGFGBWSIWSTHGS-INIZCTEOSA-N 389.411 5.113 30 20 GKED C=C(CNC(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 672636410 IOMXYDITANOYQN-UHFFFAOYSA-N 385.467 5.082 30 20 GKED C=CCN(C(=O)Cc1c[nH]c2cc(C)ccc12)c1nc(-c2ccccc2)cs1 726138034 VIRFKGKQROTLDG-UHFFFAOYSA-N 387.508 5.362 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(NC(=O)c3ccccc3)ccc2C)c1 726466460 HVUPASRMDNSYLK-UHFFFAOYSA-N 385.492 5.038 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 728687449 GSEIFLCPMBZIPJ-QFIPXVFZSA-N 387.458 5.538 30 20 GKED C#CCOc1ccc(CNCc2nc(-c3ccc(Cl)cc3)c(C)s2)cc1 733327069 NCYTUXBFOARHFR-UHFFFAOYSA-N 382.916 5.074 30 20 GKED CCSc1ccccc1OC(=O)c1ccc(COc2ccc(C#N)cc2)o1 734790293 YZHQADBWCHDIIL-UHFFFAOYSA-N 379.437 5.061 30 20 GKED Cc1cc(Cl)c([N+](=O)[O-])cc1NC(=O)c1ccccc1-c1ccccc1C#N 735803180 ZPYFQUVGMSQZOS-UHFFFAOYSA-N 391.814 5.348 30 20 GKED O=C(/C=C\c1nccc2ccccc12)c1ccc(OC(F)F)cc1OC(F)F 740764359 SPCWNEWDRRLZMW-FPLPWBNLSA-N 391.320 5.334 30 20 GKED COCc1cccc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)c1 742433831 AXYUESXGTHDYIB-VBKFSLOCSA-N 379.456 5.308 30 20 GKED CC(C)NC(=S)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 743010476 DDQWHDLRYDZRDL-UHFFFAOYSA-N 379.407 5.064 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(C(F)(F)F)c(C)c2)c1 743222817 ROHNOPZHVOXNSO-INIZCTEOSA-N 391.393 5.017 30 20 GKED N#C[C@@H](COC(=O)c1csc(-c2cccc(Cl)c2)n1)Cc1ccccc1 750788492 MCORVNPNGMZQNK-HNNXBMFYSA-N 382.872 5.003 30 20 GKED C=CCc1cc(OCC)cc(CN(C)[C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1O 758257821 HLPBOCWNFQOOFB-GMAHTHKFSA-N 399.506 5.011 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(C)nc3ccccc23)cc1 760182820 IIEPRQXAHWHQDU-BTYIYWSLSA-N 385.467 5.018 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N1CCO[C@@H](c2cccc(C#N)c2)C1 761837941 DRKFBRMPSSNFQO-XMMPIXPASA-N 397.478 5.139 30 20 GKED CC(C)c1ccc([C@H](NC[C@H](O)c2ccc(C#N)cc2)c2cccs2)cc1 763233814 OQNPTNGHVFOFRQ-GMAHTHKFSA-N 376.525 5.156 30 20 GKED N#C[C@H](C(=O)C12CCC(CC1)C2)c1nc(-c2ccc(Cl)cc2Cl)cs1 784834218 ZVOGSOCWVWQZQF-OTBSTLSISA-N 391.323 5.873 30 20 GKED O=C(/C=C\c1cnc(-c2ccco2)s1)c1ccc(OCC(F)(F)F)cc1 789126459 FHTABSAZUAPZMV-FPLPWBNLSA-N 379.359 5.240 30 20 GKED CCc1cc(O)ccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 791157871 SFMNDBCLCRFAPZ-UHFFFAOYSA-N 392.842 5.524 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(C)(F)F)cc2)cc1 796749665 ZZLQJMJTPCKUIH-LIRRHRJNSA-N 384.426 5.273 30 20 GKED C=C(CNC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 806367532 QRGGCDHHQTZYKS-UHFFFAOYSA-N 381.476 5.177 30 20 GKED N#CCOc1ccccc1-c1nc(C2(c3ccc(F)cc3)CCCCC2)no1 809497322 JLFZCOGZKGCSRQ-UHFFFAOYSA-N 377.419 5.028 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(SC(F)(F)F)cc1)c1ccccc1 817320084 XBTITRFPOMUFHD-KRWDZBQOSA-N 378.419 5.463 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCC#N)c1nc(C(C)(C)C2CCCCC2)no1 818421573 GBEYKYOXGBQCDT-MRXNPFEDSA-N 390.528 5.187 30 20 GKED Cc1ncoc1-c1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 820917316 CNZCTMMTESFKJP-UHFFFAOYSA-N 378.775 5.017 30 20 GKED CC[C@H](C)c1ccc(C(=O)[C@@H](C#N)C(=O)c2sccc2Br)cc1 845846575 HWNGXQJJHSGYTG-SMDDNHRTSA-N 390.302 5.229 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)[C@H](O)c1ccccc1 878676274 PBRRPIQPINMNOT-WWMYMODYSA-N 397.544 5.057 30 20 GKED C=CCCC[C@H](NCc1ccccc1Oc1ccc(F)c(Cl)c1)C(=O)O 900068395 GZVYAKDGVPDRTB-SFHVURJKSA-N 377.843 5.171 30 20 GKED C=CC[C@@H](c1ccccc1)c1nc(Cc2coc(-c3ccc(OC)cc3)n2)no1 904327529 MBNLPNQOGDDPLQ-FQEVSTJZSA-N 387.439 5.032 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 920142592 LNIUKDQDVVFLOV-KUHUBIRLSA-N 389.455 5.191 30 20 GKED CCC(=NNc1ccccc1C(=O)O)c1ccc(Br)cc1Cl 1776030445 AGCMIXIKBMUFST-UHFFFAOYSA-N 381.657 5.027 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(Oc3cccc(F)c3)cc2)ccc1Cl 1776033860 QLHQOLLSTQOMHO-UHFFFAOYSA-N 384.794 5.416 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCCCC[C@H]1c1ccc(Cl)cc1 1776050406 QOSYCEOWEKKQMN-KRWDZBQOSA-N 386.879 5.563 30 20 GKED C[C@H]1/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2c(O)ccc(F)c21 1776586676 MCXFOYRCOVOWLD-CYUIRQCWSA-N 388.394 5.280 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(C)cc(C)c(Br)c1C 1776783379 WXTICRJJINXNLH-KRWDZBQOSA-N 398.385 5.668 30 20 GKED CCCCCCCSc1ccc(C(=O)NCCc2ccccc2C(=O)O)cc1 1776787510 ISGYCUKCLRPHNR-UHFFFAOYSA-N 399.556 5.420 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)c4ccc(Cl)cc4)CCC3)cc2)C1 1785808199 ZOODRBJDAYVSCI-UHFFFAOYSA-N 394.902 5.054 30 20 GKED N#CCOC(=O)c1cc(-c2ccc(Cl)c(Cl)c2Cl)nc2ccccc12 5894085 CTDVYYOZACVOAK-UHFFFAOYSA-N 391.641 5.542 30 20 GKED CCc1cccc2c(C(=O)[C@@H](Nc3ccc(CC#N)cc3)c3ccccc3)c[nH]c12 25692429 GWBIXOXIUUQTKK-VWLOTQADSA-N 393.490 5.832 30 20 GKED COc1ccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)cc1Cl 31816850 IAGJMKSLLYXCIR-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C 55803769 UXYDSPJATXCBFL-UHFFFAOYSA-N 386.451 5.064 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2o1)c1nc(-c2ccc(Cl)cc2)cs1 60477692 UEFNLKHRNCWNMV-HNNXBMFYSA-N 378.840 5.700 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1cccs1)C(CC)CC 63403141 JZZOCIZDWSVVKB-NRFANRHFSA-N 381.545 5.495 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1nc(C(C)(C)C)no1 108408667 YGBWXGYFXPPWIR-LLVKDONJSA-N 398.454 5.565 30 20 GKED CCCCCCCC(=O)N1CCc2[nH]c3c(Br)cccc3c2C1 108870858 SFPCVUINKQWOIC-UHFFFAOYSA-N 377.326 5.176 30 20 GKED Cc1csc(N(C(=O)CCCCOc2cccc(C#N)c2)c2ccccc2)n1 110165759 AAXHJJASTMOQBG-UHFFFAOYSA-N 391.496 5.237 30 20 GKED CCCCSCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 124413900 VLFHZPAURFHUIT-GFCCVEGCSA-N 380.485 5.188 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(Cl)c(Cl)c1 128667137 CXMMETCIHJMGDV-HNNXBMFYSA-N 383.234 5.108 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 171797170 SSNFBFQJJQPBIZ-RHSMWYFYSA-N 385.439 5.179 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1[N+](=O)[O-] 176992922 IMRBJBMXXQKFAK-HUUCEWRRSA-N 398.488 5.180 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1cccc(CC#N)c1 177126951 YQGDRVILEWSUTI-INIZCTEOSA-N 375.497 5.018 30 20 GKED Cn1cc(CNc2cccc(C3SCCS3)c2)c(-c2ccc(C#N)cc2)n1 180310809 HJRLXMPZMDPLTN-UHFFFAOYSA-N 392.553 5.049 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCOc2cc(F)ccc21 182338399 IZNIVCCYZANFEP-PBHICJAKSA-N 399.491 5.113 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C1CCCC1)C(F)(F)F 184010059 PVMHSUNQCZPMBH-BLLLJJGKSA-N 385.455 5.181 30 20 GKED COc1ccc(CNC(C)(C)c2cccc(Cl)c2F)cc1OCCCC#N 185848829 KZWMABDIGATJJE-UHFFFAOYSA-N 390.886 5.195 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCN(C)C)Cc1ccccc1 191425512 PHRIBWOIWJLWPT-UHFFFAOYSA-N 379.548 5.134 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1occc1CSc1ccccc1 194275625 OXILVNOVEMQIHE-UHFFFAOYSA-N 378.453 5.095 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CC(=O)c1ccccc1F 266358836 PJXFUOHYULWQKM-GJZGRUSLSA-N 384.476 5.068 30 20 GKED CC(C)c1nc([C@H]2CCCN2C(O)=Nc2ccc3c(c2)oc2ccccc23)no1 330264928 YMRZZIFNKIETCU-QGZVFWFLSA-N 390.443 5.475 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c2[C@H](C)C1 411015036 PZQBQFIUDUSPIO-JGVFFNPUSA-N 385.436 5.033 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1SCCc2ccccc21 428877752 AATSWTLADICSPO-MGPUTAFESA-N 397.569 5.090 30 20 GKED CCCCn1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1CC 429112199 GKFMNNYNEFEWBI-QGZVFWFLSA-N 392.528 5.168 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 432587140 IKWNHRPRPIAHPV-XMMPIXPASA-N 380.507 5.873 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 433136325 XKXRXUFLYWTHGI-QHCPKHFHSA-N 399.494 5.919 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)nn1C(C)(C)C 437471423 KSEHRPYTNRDBBM-UHFFFAOYSA-N 392.434 5.002 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2cccc(Cl)c2SC(C)C)CC1 438251000 USUDFJZMFYQOAB-UHFFFAOYSA-N 381.973 5.003 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 438507259 SQYFLEQCGHYLJM-UHFFFAOYSA-N 375.472 5.685 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)CC2)cc1 445561273 YVFGFXOQQZNYIH-UHFFFAOYSA-N 379.419 5.037 30 20 GKED C/C(=C\c1nc(COCC(F)(F)C(F)F)no1)c1ccccc1C(F)(F)F 445757852 IIBPIIUPMNJRBZ-RMKNXTFCSA-N 398.278 5.066 30 20 GKED Cc1ccc(N[C@H]2CCC[C@H](C#N)C2)cc1Oc1ncccc1Br 448355599 OKZLYQRRGJJCPV-GJZGRUSLSA-N 386.293 5.439 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1C1CC1 455058616 RSONXGUORJNBCI-APWZRJJASA-N 379.508 5.288 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1c(-c2ccc(Cl)cc2)c(C(F)(F)F)nn1C 466867844 NUOGOBIYTNQYED-NSHDSACASA-N 385.817 5.300 30 20 GKED CCN(CC)Cc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1 470120381 DNOHTCJVYLCOBB-UHFFFAOYSA-N 383.495 5.319 30 20 GKED CCOc1ccc(-n2c(Cc3ccccc3)nnc2S[C@@H](C)CCC#N)cc1 470453051 STWCNMYHCXLIPM-KRWDZBQOSA-N 392.528 5.041 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 474712633 UWGQCDHGRLSCJL-MRXNPFEDSA-N 397.544 5.357 30 20 GKED N#Cc1c(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)sc2c1CCC2 481986158 SGNUJKDXAQYJHJ-UHFFFAOYSA-N 396.418 5.431 30 20 GKED N#CCCCCN[C@@H](Cc1ccccc1F)c1ccccc1Br 482441211 SGVOVXCIIKJDHG-IBGZPJMESA-N 375.285 5.155 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1cnn(-c2ccc(F)cc2)c1C 485735130 QJEILCRTOQBWCV-OAHLLOKOSA-N 395.503 5.089 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3ccc(-c4ccco4)cc3F)CC2)cc1 490528944 VFAFYTMXPMBSNZ-UHFFFAOYSA-N 387.414 5.279 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 503202925 SMDCFUUDUHMQHR-ZDUSSCGKSA-N 389.908 5.695 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1 505052548 UZQWJBGRKDDRJE-HNNXBMFYSA-N 394.450 5.185 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3coc(C4CCCC4)n3)cc2)c1 509499961 JOYNYICYJFLLKN-UHFFFAOYSA-N 387.439 5.035 30 20 GKED CCn1c([C@H]2CCCN2Cc2cccc(OCCCC#N)c2)nc2ccccc21 512589828 CFKJDKABWWTWQX-HSZRJFAPSA-N 388.515 5.076 30 20 GKED N#Cc1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)c(OC(F)F)c1 513145336 RGADCNUDECKHOE-KRWDZBQOSA-N 395.331 5.034 30 20 GKED COc1cccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 515130453 SMANXSNVHIWHAT-OAQYLSRUSA-N 390.870 5.185 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 515547421 XNEGNAWTZVILSN-AWEZNQCLSA-N 393.855 5.403 30 20 GKED N#CCCCn1cc(-c2nc(-c3cccc(C(F)(F)F)n3)no2)c2ccccc21 519030200 BUMPYNYJMJXCDH-UHFFFAOYSA-N 397.360 5.076 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(C)(C)C)cc1 519451331 ZBYKYAGWPKWOBM-MRXNPFEDSA-N 381.545 5.558 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 530502116 FKBSCOWLLAFVAD-UHFFFAOYSA-N 386.329 5.098 30 20 GKED C[C@@H](C(=O)Nc1ccc(C#N)cc1Cl)c1cccc(C(=O)c2ccccc2)c1 535605220 ZIQKCEHRHQLXIA-OAHLLOKOSA-N 388.854 5.185 30 20 GKED C=CCCOCCCCC(=O)Nc1c(-c2ccccc2)nc2c(C)cccn12 537314261 KGEDYDYASPFSSK-UHFFFAOYSA-N 377.488 5.011 30 20 GKED Cc1ccccc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541076019 WESBITIUZJSWAA-RTBURBONSA-N 383.495 5.212 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 542086824 WTXDTRHKEDQDNW-HOYKHHGWSA-N 396.494 5.228 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@H]3/C=C\c3cccs3)o2)cc1 542131260 AMXFFQVYALGMJV-JZHDPFOFSA-N 390.512 5.128 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3cc(C#N)ccc3OC(F)F)ccc2c1 547432855 MEVXWVHIDOIACH-ZDUSSCGKSA-N 396.393 5.064 30 20 GKED CC(C)CN(C(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(C#N)cc1 549213811 NSSOCAFOGZKEEB-GOSISDBHSA-N 376.500 5.190 30 20 GKED CSc1cc(Br)ccc1CN[C@@H](CCCC#N)c1ccccc1 552311957 JTUQJGYYJHHDTE-SFHVURJKSA-N 389.362 5.696 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 564113539 VJNUYNKZLNHEGK-SPLOXXLWSA-N 391.515 5.858 30 20 GKED CC(C)c1scnc1NC(=O)NCc1ccc(-c2ccccc2C#N)cc1 565685748 ZNDSAZMIVNGYIL-UHFFFAOYSA-N 376.485 5.127 30 20 GKED C[C@@H](CCOCc1ccccc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 569018743 OMCHCSOTPCPWLS-ROUUACIJSA-N 397.544 5.198 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)CCCCC2=O 572811178 QXKNHFRRUQMUGC-OAHLLOKOSA-N 378.497 5.100 30 20 GKED Cc1c(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)ccn1C(C)C 577498009 GJZZTPLAHLOJRC-UHFFFAOYSA-N 387.483 5.275 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)NCC(C)(C)CCC#N 577784799 FRJHXAXNPCCWLD-UHFFFAOYSA-N 399.922 5.679 30 20 GKED N#CC1(c2ccc(CN[C@@H]3CSCc4ccc(Br)cc43)cc2)CC1 594973312 PZLGLTJNJLLKHR-LJQANCHMSA-N 399.357 5.082 30 20 GKED COC(=O)CCSc1cc(Cl)ccc1N[C@H](C)c1ccc(C#N)cc1F 600854417 OULJPNCDWLVKFQ-GFCCVEGCSA-N 392.883 5.179 30 20 GKED CC(C)(C#N)CCCC[S@@](=O)Cc1coc(-c2ccccc2C(F)(F)F)n1 600935039 WZPBPIGTGILYNP-HHHXNRCGSA-N 398.450 5.329 30 20 GKED CC(=O)N(c1nc(CSc2cc(C#N)ccn2)cs1)c1cccc(C)c1C 603726858 COXPOCZAQNFKJT-UHFFFAOYSA-N 394.525 5.004 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)n1C 609164895 ZQDPVEVJKMKPEW-HXUWFJFHSA-N 377.875 5.203 30 20 GKED CCOc1ccc(-c2nc(C(=O)N(CCC#N)CC(CC)CC)cs2)cc1 609188318 IJXOCEXMIXYSOF-UHFFFAOYSA-N 385.533 5.001 30 20 GKED CCc1ccc([C@@H](C)CC(=O)Nc2c(C)c(C)nn2-c2ccc(C#N)cc2)cc1 610053800 XBKXLCKUOXFRND-INIZCTEOSA-N 386.499 5.056 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2ccccc2)C(F)(F)F)cc1C(F)(F)F 610330937 IFPPCGBKMMVOSG-AWEZNQCLSA-N 387.283 5.002 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(Cl)c2ncccc12 610628362 DUGUTJJBTIYLDU-YLJYHZDGSA-N 390.874 5.192 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 611561771 LBMNEFZDKKVQIE-YOEHRIQHSA-N 387.405 5.105 30 20 GKED N#C[C@H](C(=O)c1ccc2c3c(cccc13)CC2)c1nc2cc(Cl)ccc2s1 613407053 FWTXRORNKCMCQG-QGZVFWFLSA-N 388.879 5.692 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)nn1-c1ccccc1 676458996 PQFBHDMMMWZRPD-LJQANCHMSA-N 380.451 5.034 30 20 GKED Cc1cc(C(F)(F)F)nc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 680372128 VIEVTOXKMZUGKN-HTQZYQBOSA-N 395.269 5.125 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(Cl)c1SC(F)F 726079451 WPJXEONFHRAFFR-UHFFFAOYSA-N 381.835 5.190 30 20 GKED COc1ccccc1C/C(C)=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 730170383 DDBFLUIJUSLIBW-HJMGBZSKSA-N 396.490 5.478 30 20 GKED C#CCOc1ccc(NC(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 731113684 LGUBFKSCNVLPOF-HNNXBMFYSA-N 391.496 5.013 30 20 GKED CCCCCCOc1cccc(/C=C\C(=O)c2ccc(C(F)(F)F)nc2O)c1 731564776 SYGRXWPJVYJNPJ-LUAWRHEFSA-N 393.405 5.661 30 20 GKED O=C1/C(=C/c2ncc(-c3cccc(Br)c3)[nH]2)CCc2ccccc21 731938799 SEPYMIMUEYDLBJ-RVDMUPIBSA-N 379.257 5.052 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC(C)(C)C)c2ccccc2)c1 733808029 YKHNZAPHRMBGTP-IRLDBZIGSA-N 393.531 5.344 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2ncc(C(C)C)n2C(C)C)cc1 739435003 CISUMWHEFKCUML-GOSISDBHSA-N 398.576 5.323 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccncc3)s2)cc1 741537882 JTMGFCVKTRUJOJ-FQEVSTJZSA-N 396.475 5.113 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccc(F)cc1 743462079 FAPWRGYAQHVPJE-SAAWKEMMSA-N 398.409 5.507 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)s1 744117131 UNRFBXWKZSVGEL-URWSZGRFSA-N 385.489 5.079 30 20 GKED CCn1c(-c2ccc(Br)cc2)cnc1SCCCSCC#N 745974208 MIRRVFLLKDNEHH-UHFFFAOYSA-N 396.379 5.071 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2c(C)nn(C(C)C)c2C)cc1OC 746346588 RXSTUNZBZCXQNS-HJWRWDBZSA-N 376.884 5.038 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)[C@@H](C)c1ccccc1 746372481 OWWKASCMACWVNF-CYBMUJFWSA-N 385.393 5.149 30 20 GKED CC/C(=C\C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)cc1 746847035 OPFHLZFRWZDCEZ-YKBBIGDRSA-N 380.513 5.379 30 20 GKED COc1cc(C(=O)/C=C\c2coc(-c3ccccc3)n2)ccc1SC(F)F 749891407 JIKJUFUQTIPETK-HJWRWDBZSA-N 387.407 5.561 30 20 GKED C[C@@H](OC(=O)C1(C#N)CCCCC1)c1nnc(-c2ccc(Cl)cc2Cl)o1 758001892 JSNZJGTXCLRDTO-LLVKDONJSA-N 394.258 5.122 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3nc(C)ccc3c2)cc1 759207541 CYDDWZMGIZVDFN-BTYIYWSLSA-N 385.467 5.018 30 20 GKED CCC[C@@H](NC(=O)Cc1cccc(OCC#N)c1)c1ccc(Cl)c(Cl)c1 760380232 TXLDIKCLKSAERT-LJQANCHMSA-N 391.298 5.096 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C#N)s2)ccc1OCc1ccccc1 762443716 QVUVRXJDYFYTDQ-YFHOEESVSA-N 375.449 5.103 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC([C@@H](O)c2ccc(Cl)cc2)CC1 767901735 VAQIAAGRUCGJGA-QFIPXVFZSA-N 382.935 5.087 30 20 GKED COc1cc(Cl)ccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 772908326 OISPBBWGVMGJED-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2cccc(F)c2)c2ccccn2)cc1 773133692 RKYAWVJSIKZPOM-HXOBKFHXSA-N 396.893 5.792 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c(F)c1 781111882 QZUIKPWFHXVNOA-YVMONPNESA-N 378.384 5.230 30 20 GKED Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)OCCCC(C)(C)C#N 782564684 HRRRYCIUSDQHII-UHFFFAOYSA-N 392.908 5.171 30 20 GKED O=C(/C=C\c1ccc(-c2cccc(F)c2F)o1)c1ccc(N2CCOC2=O)cc1 790218141 IEFNIVUMIMYVMD-NTMALXAHSA-N 395.361 5.078 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\C(=O)c3ccccc3[C@H]2C)cs1 809157180 QWNQHFCLGBCGLI-OFNOZLENSA-N 388.492 5.520 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccc(SC(F)(F)F)cc2)SC1=S 814292080 MNARGVJDIGWSCW-GHXNOFRVSA-N 375.462 5.076 30 20 GKED N#CCSCCCSC1=NC(=O)/C(=C\c2csc3ccccc23)S1 814771692 CKOSHZJCRIINLK-XNTDXEJSSA-N 390.580 5.252 30 20 GKED C/C(=C\c1ccc(OC(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942828 NYVRASDTEVUFLS-KUCQQTCKSA-N 392.402 5.199 30 20 GKED Cc1ccccc1[C@@H](C)c1noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n1 848610083 JJKSUVVCHCHNGD-SJLPKXTDSA-N 398.507 5.180 30 20 GKED N#CC1C/C(=C\c2scnc2C2CC2)C(=O)/C(=C/c2scnc2C2CC2)C1 899379399 HRXWUUNTKIRECU-BGPOSVGRSA-N 393.537 5.324 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc(C2(NC(=O)OC(C)(C)C)CCC2)no1 904553141 ZZSSMKOZECNCHX-GOSISDBHSA-N 397.519 5.462 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(-c2ccccc2F)s1 912797952 UHBIGRQEYGIIPF-UHFFFAOYSA-N 394.500 5.292 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccccc3F)o2)cc(OC)c1OC 917030908 OYUUBKVZRGGKHB-NTMALXAHSA-N 382.387 5.008 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 917714012 QCVAKVXYULWMAI-UHFFFAOYSA-N 383.816 5.101 30 20 GKED CCc1cccc2c(C3CCN(C(=O)/C=C/c4ccccc4C#N)CC3)c[nH]c12 918678311 WBYPRYPNMLKEGV-ZHACJKMWSA-N 383.495 5.021 30 20 GKED O=C(O)c1cc(NN=Cc2c(OC(F)F)ccc3ccccc23)ccc1Cl 1776033172 HVENXUNMQOJXHF-UHFFFAOYSA-N 390.773 5.239 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2c(F)cccc2Cl)c1 1776055642 DTILWSIPJSPVAJ-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CCCCCCCOc1ccc(/C=C/c2cc(C(=O)O)c3ccccc3n2)cc1 1776785857 CEKWSJXGAAAMIQ-SDNWHVSQSA-N 389.495 6.453 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776950925 PZVMNFZBRTZJLD-IZZDOVSWSA-N 394.448 5.359 30 20 GKED CCc1cccc2c1OC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776977608 JSPNSIJAYFBCJS-KGENOOAVSA-N 384.431 5.273 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4ccc(C(=O)O)cc4)s3)coc12 1777449092 SWRPYMWPHNKYOI-PKNBQFBNSA-N 388.444 6.064 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1cc(C)cc(C)c1 10172513 MPUGPMDLXJZHGJ-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1cc(Cl)cc(Cl)c1 15150977 HXZOGGWAGPCDOB-UHFFFAOYSA-N 391.776 6.093 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)c(C)cc2C)=C(/S)NC2CCCCC2)cc1 27461931 RILVFGAWLFVNPY-UHFFFAOYSA-O 395.592 5.069 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c(C)s1 41548789 MFKVENZJWUBADM-GFCCVEGCSA-N 380.416 5.484 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(C)c1 66545498 DYJWGBPMABABHM-FQEVSTJZSA-N 385.492 5.108 30 20 GKED CCOc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66954301 HALWDPXUVHEDOG-JKSUJKDBSA-N 383.517 5.362 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCCc1ccccn1 112817969 JHRDLUYPMKXKPB-UHFFFAOYSA-N 393.434 5.068 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 113570211 SCLVZJGPHNZUQE-MRXNPFEDSA-N 383.517 5.507 30 20 GKED C=CCn1c(SCc2nc3cc(F)ccc3o2)nnc1-c1ccccc1C 124119237 LOVHQOMKFKHLNC-UHFFFAOYSA-N 380.448 5.012 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)c(F)c1 126769467 GJKACVNZSVZHAD-UHFFFAOYSA-N 386.304 5.159 30 20 GKED CSCC[C@@H](C)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 134108313 BYMHTUQVMJWHGD-MRXNPFEDSA-N 383.517 5.264 30 20 GKED N#CCCCOc1cccc(CNc2cccc(NC(=O)c3cccs3)c2)c1 155908492 QNPBVKBDZNHKKW-UHFFFAOYSA-N 391.496 5.295 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(Br)s1)[C@@H](C)c1ccc(C#N)cc1 173773170 FBIMQYAFAYWDNN-OLZOCXBDSA-N 391.334 5.095 30 20 GKED C[C@@H](N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1cccc(C#N)c1 181687767 BXUAAILAUXERDV-HXOBKFHXSA-N 384.458 5.139 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](c2ccc(F)c(F)c2)C(C)C)ccc1OC 182136535 VBHZFKBWNUXLNZ-VGSWGCGISA-N 388.458 5.141 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3cc4c(s3)SCC(=O)N4)s2)cc1 184340578 WQOHZUTWTWLMEC-VOTSOKGWSA-N 398.534 5.120 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C(=O)NCCCC)CC[C@@H]1C 191488271 YEHOYYJWFCFHAB-AZUAARDMSA-N 399.579 5.087 30 20 GKED CC(C)Sc1ccc(C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 193455160 IMXWNHJFWJQTFO-FQEVSTJZSA-N 388.492 5.301 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2csc(C3CC3)n2)cc1Cl 195748025 SNTBXFFNYQPTFV-KRWDZBQOSA-N 393.899 5.582 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=O)CCCCOc1cccc(C#N)c1 303440413 HQLDTAIPSFQHMJ-UHFFFAOYSA-N 391.298 5.073 30 20 GKED CC(C)CC[C@H](NC(=O)Cc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 303485353 PDTAOSWKVSZYIR-NRFANRHFSA-N 384.907 5.079 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1sc2c(c1C#N)CCCCC2 320825775 XXVAFLLHCXOEPW-UHFFFAOYSA-N 389.318 5.212 30 20 GKED CC[C@@H]1C[C@@H](C(O)=Nc2cc(Cl)ccc2OC[C@@H]2CCCCO2)CC(O)=N1 330271547 WCHVGTSRXCMVPL-BMFZPTHFSA-N 394.899 5.021 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1ccc(C2CC2)cc1 419331760 HFBFGEHUJHDMQW-IAGOWNOFSA-N 393.556 5.248 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(-c2cccs2)c1)c1ccccc1 432860894 UWCGEGIVDJJIPF-HXUWFJFHSA-N 375.497 5.972 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 433368822 YZDGFYNQZQFTGY-KRWDZBQOSA-N 392.405 5.468 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@@](C)(CCc3ccccc3)C2)cc1 435137157 BNTMHULCJXIAOO-XMMPIXPASA-N 375.516 5.364 30 20 GKED N#Cc1csc(C(=O)N(Cc2cccs2)C23CC4CC(CC(C4)C2)C3)c1 437568416 NPWZZJZKAGDTQP-UHFFFAOYSA-N 382.554 5.292 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)N[C@H](c1ccc(F)cc1)C(F)(F)F 438257721 QVCFJXKUWCIUAF-CQSZACIVSA-N 394.290 5.356 30 20 GKED N#CCC[C@H](NC(=O)Nc1ncc(Cc2cccc(F)c2)s1)c1ccccc1 439130557 KOZHICBWBYVNKL-IBGZPJMESA-N 394.475 5.040 30 20 GKED CC[C@@H](NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1ccc(C#N)cc1 447595928 BABUIBHGKBBUEB-NHCUHLMSSA-N 387.552 5.528 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nn1 460376533 PLCUIUOZKJNADN-UHFFFAOYSA-N 394.302 5.394 30 20 GKED CCCCc1ccc(N(C(=O)CCCC#N)c2nc3ccccc3s2)cc1 463067909 JPMYBEIFCVIXHI-UHFFFAOYSA-N 377.513 5.997 30 20 GKED C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1nc2ccccc2n1C(F)F 463437116 CYTIKJZXZHFKCU-SNVBAGLBSA-N 380.320 5.495 30 20 GKED C=CCC[C@H](NC(=O)c1ccoc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 464205025 MKAJVLNWNJIFSF-AWEZNQCLSA-N 391.311 5.755 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCC1CCC(C(F)(F)F)CC1 471925295 QWVZJNLCTJHYQE-UHFFFAOYSA-N 390.858 5.252 30 20 GKED C=CCCCCNC(=O)N1CCC(OCc2ccc(Cl)c(Cl)c2)CC1 472849033 IWOJXGGLWUPJCB-UHFFFAOYSA-N 385.335 5.040 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccco1)N(CC)CC 475554485 NIXYPQGXUKUMKA-FQEVSTJZSA-N 383.536 5.336 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CN(Cc1cccnc1)c1ccccc1 476770625 GKLHBTZRZPRYGT-UHFFFAOYSA-N 399.538 5.579 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccn(C2CCCC2)n1 477467157 NXIQGAUSPLRASP-UHFFFAOYSA-N 386.455 5.223 30 20 GKED C=C(C)[C@@H](NC(=O)N(CCOC)[C@H](C)c1ccccc1)c1ccc(F)c(F)c1 477733110 ZEDCGFGMPLQLSQ-IIBYNOLFSA-N 388.458 5.001 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)c2ccccc21 478261235 ORPPMNJXUTZYRJ-UYAOXDASSA-N 389.474 5.150 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cccc(-c2ncco2)c1 480805467 PNFWRNVJJVWHSG-UHFFFAOYSA-N 381.391 5.258 30 20 GKED CCc1c(C)sc(NC(=O)c2c(-c3cccc(Cl)c3)noc2C)c1C#N 483458425 XXBFMRZYQRRJHD-UHFFFAOYSA-N 385.876 5.360 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccccc1OC[C@@H]1CCCCO1 486260828 QXKCIWHRTRZUFM-KRWDZBQOSA-N 383.513 5.165 30 20 GKED N#Cc1ccc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)s1 487199834 NVRFIJXBKZSLDD-UHFFFAOYSA-N 389.505 5.119 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@H]3C[C@@H]3c3ccccc3Cl)s2)cc1 487392138 ZHLRVIKXVYEQFS-MSOLQXFVSA-N 393.899 5.001 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cn(C)c2ccccc12 500743484 MSZJKTUOZYDTHY-UHFFFAOYSA-N 381.435 5.403 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1 504688530 ZKGPICCIVWRTLF-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1ccc(SCc2cccc(C(=O)N(CCC#N)CC3CC3)c2)c(C)c1 505182573 UDVDBHMQLWQRKD-UHFFFAOYSA-N 378.541 5.362 30 20 GKED Cc1nn(-c2ccccc2)cc1CCCNC1CCC(C#N)(c2ccccc2)CC1 507654191 RUDSZWAAZXILNO-UHFFFAOYSA-N 398.554 5.107 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@H]2Cc2c(F)cccc2Cl)cc1 510608119 ZPPVORNYMCMAST-KRWDZBQOSA-N 399.897 5.519 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)CC2)c1 512842846 DINMONARDVJMOO-UHFFFAOYSA-N 382.463 5.638 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccc(C#N)c(Cl)c3)c2C(C)C)cc1 514487700 DAFPDXSLUQNVRQ-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C=CCn1c(SCc2csc(C3CCCCC3)n2)nnc1-c1ccco1 514562866 CXYJYAPHVQQNFC-UHFFFAOYSA-N 386.546 5.521 30 20 GKED CCc1cc(C#N)c(NC(=O)[C@H](C)Sc2ccc(Br)cc2)s1 515710876 BPSCXUVVWKDHOE-JTQLQIEISA-N 395.347 5.064 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N3CCC(CCC#N)CC3)c2)c1 516925114 HXSQEJLNTJBETB-UHFFFAOYSA-N 377.488 5.122 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccc(Cl)cc1Cl 517444415 ZXDAKHXNCLJWFU-UHFFFAOYSA-N 379.312 5.570 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 518648393 CGNAUFLYCKCPAJ-UHFFFAOYSA-N 382.485 5.812 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)CCc1ccccc1 518655256 HOSMZEIBAVDIPU-MSOLQXFVSA-N 398.597 5.774 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(Br)ccc1F 520828767 XTFPTCFEXWGQBP-LBPRGKRZSA-N 379.298 5.452 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 520877416 ABFJEVKEWWXQNA-DHIUTWEWSA-N 386.451 5.066 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CC3(CC(=O)O)CCCCC3)c2)cc1 521535829 LZGMUOVIQWTIGS-UHFFFAOYSA-N 392.455 5.104 30 20 GKED C=CCN(C(=O)c1ccnc(Oc2ccccc2)c1)c1nc2c(s1)CCCC2 523183053 OKXHBTGJDZDESP-UHFFFAOYSA-N 391.496 5.042 30 20 GKED C=CCCC[C@H](C)NC(=O)Nc1ccc(OC)c(NC(=O)C2CCCCC2)c1 537253184 DBORXPORAUVREC-INIZCTEOSA-N 387.524 5.080 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(OCc2cccc(C#N)c2)cc1 538843397 COGAVADUJLAQLB-UHFFFAOYSA-N 376.843 5.067 30 20 GKED N#CCC[C@H](NC1CCN(Cc2c(F)cccc2Cl)CC1)c1ccccc1 540148667 YIVDZRNEJMMLNU-QFIPXVFZSA-N 385.914 5.078 30 20 GKED C=CCC[C@H](NCc1csc(-c2ccc(OC)cc2OC)n1)c1ccccc1 540392933 CXYNPFBZOPIBOH-NRFANRHFSA-N 394.540 5.624 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)[C@H](C#N)c2nc3ccccc3o2)c1 540681193 FSJORHPXACARBT-KRWDZBQOSA-N 376.481 5.661 30 20 GKED C[C@H](NCc1ccc(-n2ccnc2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542942368 PTHIHXZIWFXICV-IBGZPJMESA-N 378.479 5.262 30 20 GKED C[C@@H](NCc1cc(-c2ccccc2)n[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543876885 IHSXAPRFBNUANY-GOSISDBHSA-N 378.479 5.466 30 20 GKED CC(C)(C#N)CCCCS(=O)(=O)[C@H](c1ccccc1)c1ccc(Cl)cc1 550001926 COFXHYLJELKDHT-HXUWFJFHSA-N 389.948 5.564 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCCc2ccc(Br)cc21)c1ccccc1 551210665 IBEOXSYYZGZAFO-NHCUHLMSSA-N 383.333 5.851 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl 554242342 BBKKLPCQQYNMOD-AWEZNQCLSA-N 397.371 5.687 30 20 GKED COc1ccc([C@H](Cc2ccccc2)NC(=O)C[C@H](CC#N)c2ccccc2)cc1 555172123 UHHUEWXOKFPJBQ-ZCYQVOJMSA-N 398.506 5.183 30 20 GKED O=C(Nc1cc(F)ccc1Cl)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 590338802 LPOIQVURFOMEJN-YUMQZZPRSA-N 392.702 5.074 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccc(O[C@H](C)c2ccccc2)cc1 595750570 COLPFQXWNQPDHB-ZCNNSNEGSA-N 391.515 5.223 30 20 GKED CSc1ccccc1NC(=O)c1ccccc1Sc1ccccc1C#N 597930676 FBMFYZVJHGBLEB-UHFFFAOYSA-N 376.506 5.684 30 20 GKED COc1ccc(S[C@@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603969745 BJTDZSZBVDFTTI-AWEZNQCLSA-N 394.521 5.415 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCCCC[C@@H]2CC(C)C)cc1 607201931 GQJFRJGUQCOJTO-JOCHJYFZSA-N 397.563 5.323 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Sc1ccccc1)c1ccc2ccccc2n1 608552735 BTQDRVFPMZKFSV-HXUWFJFHSA-N 380.472 5.876 30 20 GKED CCC1(C)CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)CC1 609207496 AASLZZUCCPPLTJ-UHFFFAOYSA-N 391.515 5.490 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cc(-c2ccccc2)no1 609438159 DGECFDACOHPDDX-OAHLLOKOSA-N 392.484 5.058 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N(CC2CC2)CC2CC2)cc1 609666915 NRYKQTZPEPNXNF-UHFFFAOYSA-N 376.525 5.113 30 20 GKED N#Cc1ccc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(C(F)(F)F)c1 609962579 PJVIENMWYOIVPN-UWVGGRQHSA-N 390.249 5.144 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1cccc(C#N)c1 610355283 NBZAHYVRFMNIBD-XOBRGWDASA-N 395.915 5.423 30 20 GKED C[C@H](NC(=O)NCc1ccc(Oc2ccc(F)cc2)cc1)c1cccc(C#N)c1 610400449 PVSHSVDIUOUTID-INIZCTEOSA-N 389.430 5.050 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 610683466 NFIQSUZVKXISRC-UHFFFAOYSA-N 376.378 5.074 30 20 GKED C[C@@H](NC(=O)N1CC[C@@H](c2ccco2)C1)c1ccc(-c2cccc(C#N)c2)cc1 611854959 FBUUHJLOOTXFIC-VGOFRKELSA-N 385.467 5.078 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)C[C@H]1CCCO[C@H]1c1ccccc1 674249806 KCUSKEHUHHSISJ-IRLDBZIGSA-N 387.445 5.157 30 20 GKED Clc1ccccc1-c1nnc(CNc2cccc(C#Cc3cccs3)c2)o1 675444501 XFUGHZXNERTXER-UHFFFAOYSA-N 391.883 5.463 30 20 GKED COc1ccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1F 729159712 DJLNVLMBIGZQSL-UHFFFAOYSA-N 393.443 5.307 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(N4CCCC4)c3)cc2)cc1 731975719 OMBQSEFNIWDOAQ-UHFFFAOYSA-N 397.478 5.397 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C(C)(C)Cc3ccccc3)n2)cc1 735595455 DTUSADVPLWIGTE-IBGZPJMESA-N 390.508 5.264 30 20 GKED CCCN(C)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 735911893 WIFBOLKFAHVNMM-MRXNPFEDSA-N 383.904 5.286 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCCC[C@@H]2c2ccco2)cc1 736955099 FAGMBFZCNSFSGL-XZOQPEGZSA-N 399.494 6.084 30 20 GKED C=CCOc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)cc1OC 740011697 REUDZNFVBMYUSA-UHFFFAOYSA-N 390.508 5.150 30 20 GKED Cc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1 743036484 MTLVLMTXNZFZEF-UHFFFAOYSA-N 377.444 5.607 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2C[C@@H](C)[C@H]2c2ccccc2)c1=S 743395852 UQRZAXZHQDQNIL-UZLBHIALSA-N 394.519 5.057 30 20 GKED COc1cc(C=NOCc2csc(-c3ccc(C)o3)n2)ccc1OC(C)C 744180718 YKMIOZJURQPDIK-UHFFFAOYSA-N 386.473 5.058 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)NCc1cccs1 745724653 UCZDYBHMKFPLRS-UHFFFAOYSA-N 395.528 5.149 30 20 GKED Cc1c(Cl)cccc1N=C1SCCN1C(=O)c1cccc2cnccc12 745977761 XVMCKKFSKXMEDA-UHFFFAOYSA-N 381.888 5.073 30 20 GKED CC(C)c1ccc(CSc2nn(CN(C)C[C@H](C)C#N)c(=S)s2)cc1 746705983 NDWLELUEPWPGID-CQSZACIVSA-N 392.619 5.139 30 20 GKED COc1ccc(CCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 747123991 OCGSXTHLVBFDLW-XMMPIXPASA-N 384.479 5.312 30 20 GKED Cc1ccc(/C=C\C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(Br)c1 747198504 XZCPCZXGVGEFPR-AFNCTOJWSA-N 389.318 5.227 30 20 GKED CC(C)c1ccc(Nc2nn(CN(C[C@@H](C)C#N)C3CC3)c(=S)s2)cc1 753988319 PGFCTGKNLKZHJO-AWEZNQCLSA-N 387.578 5.123 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c(C)noc1C 757781537 RGKNCNJUEMDMPS-LEWJYISDSA-N 388.471 5.220 30 20 GKED COCCC1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCCC1 761617348 CPDOVBVETIWWFX-QFIPXVFZSA-N 391.515 5.060 30 20 GKED N#CCCn1cc(CNc2ccc(OC3CCCC3)cc2)c(-c2ccccc2)n1 770488835 KFMAWKMDXAMPMK-UHFFFAOYSA-N 386.499 5.397 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COc2ccc(Oc3ccccc3)cc2)n1 780402776 MAGASRGGFJFZGB-LJQANCHMSA-N 392.480 5.314 30 20 GKED CC(C)c1nc2ccc(NC(=O)Nc3ccccc3O[C@@H](C)C#N)cc2s1 780529783 BZAVQLOVUMJFBD-ZDUSSCGKSA-N 380.473 5.355 30 20 GKED N#CCC1CCN(C(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)CC1 782054385 AWOJOZLUJHMROR-QNGOZBTKSA-N 382.866 5.172 30 20 GKED Cc1c(C(=O)Nc2ccccc2[C@@H](O)C(F)(F)F)ccc(C(F)(F)F)c1F 785626838 YDPWRIQAVHSSQM-CQSZACIVSA-N 395.274 5.001 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)cc1Cl 786446594 AGUXNTPRTIOYQS-CQSZACIVSA-N 375.255 5.078 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)N[C@@H]4CC[C@H](C#N)C4)cc3C2)cc1 824259074 CQDQBZJDBOFSFP-LAUBAEHRSA-N 388.515 5.144 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCCCC1 831617794 JSYFNFWNBFONAL-SFTDATJTSA-N 390.612 5.014 30 20 GKED N#C[C@@H](C(=O)[C@H]1CC12CCSCC2)c1nc(-c2ccc(Cl)cc2)cs1 835068868 UBXKFFDGYITHBF-LSDHHAIUSA-N 388.945 5.173 30 20 GKED CCCn1ncc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C1CC1 836270435 SUYGCRVFZSAAKT-OAQYLSRUSA-N 399.498 5.470 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@]4(C3)CC4(F)F)cc2)c1 844533854 DUQIGRZUWBHBAO-HXUWFJFHSA-N 383.398 5.004 30 20 GKED N#CCCCC[C@H](N)c1nc(-c2ccc(Nc3ccc(Cl)cc3)cc2)no1 848624337 AISPKDIBKKXQRF-SFHVURJKSA-N 381.867 5.217 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C/c2csc(C(F)(F)F)c2)s1 860732820 OSAIXTPDSNQHSB-SGUJLRQBSA-N 384.448 5.411 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C\c1ccccc1C#N 914519741 CAIFGTGGJCWSDF-RAXLEYEMSA-N 395.437 5.124 30 20 GKED COc1cc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)cc([N+](=O)[O-])c1O 916131367 BIXUVJWCZNRIFO-SOFGYWHQSA-N 389.363 5.105 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 916915445 JMROVEILGOOFAM-LZLYRXPVSA-N 394.437 5.045 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 917027233 ZJHZZKHBBDVORI-DZGCQCFKSA-N 398.940 5.821 30 20 GKED CCOC(=O)Nc1ccc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 917784567 WQLAKXCVTXLTNY-UHFFFAOYSA-N 397.500 5.099 30 20 GKED N#C[C@@H](C(=O)Cn1ccc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 918490570 UBERJYSCKCGSFE-KRWDZBQOSA-N 391.883 5.295 30 20 GKED Cc1ccc([C@@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 919763968 QJUUEELFEVHODG-MRXNPFEDSA-N 392.549 5.712 30 20 GKED C=CC[C@H]1CCN1Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 934473084 WWMVVVDXODITIJ-KRWDZBQOSA-N 389.952 5.248 30 20 GKED Cc1ccc2c(C)cc(NN=C3CCCCc4cc(C(=O)O)ccc43)nc2c1C 1776022518 SYUOGCOILYWVNL-UHFFFAOYSA-N 387.483 5.401 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(SCc3ccccc3)cc2)ccc1Cl 1776033712 VVDVPZHKCXBDDU-UHFFFAOYSA-N 396.899 5.777 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3nc(C(F)(F)F)cs3)s2)cc1 1776049217 SLMVPAGMOJKARB-UHFFFAOYSA-N 397.403 5.035 30 20 GKED O=C(O)c1ccc(NN=C2CCCCC[C@@H]2c2ccccc2C(F)(F)F)cn1 1776070624 YSOKAGYFRLLEAP-OAHLLOKOSA-N 391.393 5.314 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)c1 1776127892 ILWOHHDJBKGUSX-HWKANZROSA-N 388.391 5.405 30 20 GKED C=CCC[C@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)c1ccc(-c2ccccc2)cc1 1776165912 GZUVEMHAKGIKLM-PKTZIBPZSA-N 393.527 5.614 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)ccc1Cl 1777263585 YQEZOICOCMAFOW-TWGQIWQCSA-N 398.867 5.671 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(-c3ccc(Br)cc3)s2)cc1 32712331 VKEQYSOOTWPXBJ-UHFFFAOYSA-N 397.297 5.496 30 20 GKED C=CCc1cc(CN2CCC[C@@H](c3nc4ccccc4s3)C2)c(O)c(OC)c1 38390203 KRGKFJQYWGOYNL-QGZVFWFLSA-N 394.540 5.119 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nc2ccccc2n1C(F)F 41558848 ZUPNCXXZQWJBLM-SFHVURJKSA-N 387.389 5.588 30 20 GKED COc1cc(/C=C\C(=O)c2cccc3ccccc23)cc(Br)c1O 98053747 OBFVIIRXVKCJEY-KTKRTIGZSA-N 383.241 5.213 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCN(c2ccccc2C#N)CC1 122679816 CCQNEJRBQQKVSR-UHFFFAOYSA-N 390.531 5.159 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(Cl)cc1Br 126369401 CJYPKJAECGDANF-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1 157178178 RSFDZHRROFVANW-AWEZNQCLSA-N 395.846 5.088 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CC[C@@H]3CCCC[C@@H]32)cc1 160732567 RGRNSDPMZVSFDX-CVDCTZTESA-N 389.499 5.128 30 20 GKED Cc1cnc([C@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 177919845 QJJXFPDCWWTSSA-HNNXBMFYSA-N 393.537 5.107 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(OCC#N)cc1 180549509 NMUCIZNFSWFTGY-CQSZACIVSA-N 381.476 5.011 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(F)cc2Cl)ccc1OC 180814596 FFQUZNJXEDIQMM-XJKSGUPXSA-N 376.859 5.019 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(N(C)C3CCCCC3)cc2)cc1 237598846 HNOPTWOCIBSGGR-LJQANCHMSA-N 377.532 5.036 30 20 GKED Cc1cccc([C@@H]2CCCN2CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 247210601 RUGFNVDYWHRUGR-NQIIRXRSSA-N 393.556 5.165 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 255948570 PHELMTKZXVXBBJ-UHFFFAOYSA-N 392.911 6.065 30 20 GKED CCOc1ccc(-c2nc(CSCCCC3(C#N)CCOCC3)co2)cc1 281876250 NUNWGTYUGTUOPO-UHFFFAOYSA-N 386.517 5.074 30 20 GKED CC(C)(C)/C(O)=N/[C@H]1CCCN(C(O)=Nc2ncc(C3CCCCC3)s2)C1 329325388 IPGDDADKEUHVBR-HNNXBMFYSA-N 392.569 5.203 30 20 GKED Cc1ccc(N=C(O)[C@H]2CCC(F)(F)C2)cc1N=C(O)CN1CCCCC1 330039878 BYJJABUZELQUJR-HNNXBMFYSA-N 379.451 5.092 30 20 GKED OC(=Nc1ccccc1)N1CCC[C@H](/C(O)=N/[C@H]2CCCc3ccc(F)cc32)C1 330089581 OVGSCTXVYZIGDS-UWJYYQICSA-N 395.478 5.117 30 20 GKED CC(C)CCn1ncc(N=C(O)N2CC[C@H](C(F)(F)F)C2(C)C)c1C(C)C 331151084 ZZDQTPFFRIMOCO-HNNXBMFYSA-N 388.478 5.261 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@@H]2C 410973992 IOFUIHYOIPDHOL-YUMQZZPRSA-N 399.463 5.342 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)c1 412264079 CMQCFWZKCQETOR-HBMCJLEFSA-N 398.428 5.434 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)Nc1cccc(C#N)c1C 432271053 NKDVJJSCHDTSAT-CQSZACIVSA-N 394.475 5.320 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433658612 CGRIZORBGAUHGU-CQSZACIVSA-N 393.274 5.148 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2sccc2C2CC2)cc1F 437497262 RGWDNQJIOPRURM-UHFFFAOYSA-N 378.428 5.681 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c1 442671679 HESARFWZNYVOHU-QGZVFWFLSA-N 395.409 5.266 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C)c2cccc(C#N)c2)nnc1-c1cccnc1 442911652 GWQHXOYYMIIBPD-KRWDZBQOSA-N 397.507 5.363 30 20 GKED C[C@@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 443190332 MWPXAPZIWMNOFZ-KXBFYZLASA-N 389.421 5.153 30 20 GKED Cn1cccc1[C@H]1CCCCCN1C(=O)c1cn(CCCC#N)c2ccccc12 443902257 AOCOIIKAKONYNJ-HSZRJFAPSA-N 388.515 5.041 30 20 GKED C[C@H]1CCC[C@](C#N)(NC(=O)c2ccc(-c3ccccc3OC(F)(F)F)o2)C1 444021872 JEPOVDPAFUKTBJ-DJJJIMSYSA-N 392.377 5.047 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sc3ccc(C)cc3c2C)cc1 445255694 UEHQBQQKHIEFPR-UHFFFAOYSA-N 379.485 5.078 30 20 GKED C=CCC1(C(=O)Nc2cccc(C[S@](=O)Cc3ccccc3)c2)CCCC1 449880885 QEVDHZYRMNJTBD-HHHXNRCGSA-N 381.541 5.211 30 20 GKED C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458798730 IKSOBGNVCYRSEI-DYESRHJHSA-N 383.923 5.348 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(=Cc2ccccc2F)CC1)c1ccccc1 458807645 XVLYWWPRFONEPS-HSZRJFAPSA-N 391.490 5.450 30 20 GKED N#CCCC[C@@H](NC(=O)N1CC[C@@](F)(c2cccc(Cl)c2)C1)c1ccccc1 458826626 CVLBITZFUATJKV-IRLDBZIGSA-N 399.897 5.355 30 20 GKED Cc1nc(C)c(CNC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 461025457 RABOIODKBHBQCH-UHFFFAOYSA-N 397.887 5.007 30 20 GKED N#Cc1c(F)cccc1NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 462894457 HVDCMGQTYYDYBJ-UHFFFAOYSA-N 387.336 5.516 30 20 GKED N#CCCCCN[C@@H](Cc1ccccc1Br)c1ccc(F)cc1 467741588 KRIIZGBOKDPOQO-IBGZPJMESA-N 375.285 5.155 30 20 GKED CC(C)N1CCC(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 467978581 JCYKSSWGSLHNJY-UHFFFAOYSA-N 397.906 5.063 30 20 GKED CN(Cc1ccccc1NC(=O)c1cccc(SCC#N)c1)c1ccccc1 469154379 VDGVDDRREUVTPV-UHFFFAOYSA-N 387.508 5.191 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 469665166 MEJXBFCRJMYVLL-HKUYNNGSSA-N 383.879 5.042 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H]2/C=C/c2ccccc2)c2ccccc21 469779014 HAVKOEDNAUTKJF-JLVIMGNISA-N 383.495 5.263 30 20 GKED C=CCCCCNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 473489544 BDIHUUSPGRZXEQ-UHFFFAOYSA-N 395.381 5.029 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Cl)ccc1OC1CCCC1)c1ccccc1 476831848 UKZIDVSEXNQEBW-KRWDZBQOSA-N 382.891 5.687 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cn1 478101236 LAXAHQLRMHJLPF-HNNXBMFYSA-N 398.919 5.071 30 20 GKED N#Cc1csc(C(=O)N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)c1 478111177 JWPYHJMHISJLBE-UHFFFAOYSA-N 377.296 5.246 30 20 GKED COc1ccccc1SCC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 479668443 WQCFMESSRHPVHS-UHFFFAOYSA-N 390.464 5.090 30 20 GKED CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccnc(C#N)c1 483308862 JWAHYQCEYRDXQY-QFIPXVFZSA-N 391.421 5.025 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1ccc(C(F)(F)F)cc1 492608532 PUXYKOQZRABLNV-NSHDSACASA-N 383.211 5.190 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)COc1ccc(C#N)cc1 499748839 FCAFOBNXJCENRG-UHFFFAOYSA-N 380.513 5.309 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1C(F)(F)F 500228177 WSNJIJOVZNMRJO-UHFFFAOYSA-N 395.274 5.428 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@H](C)C(=O)c1c[nH]c2ncccc12 504386987 FKALTGJNNWNKCK-MRXNPFEDSA-N 396.450 5.219 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Sc1nc(-c2ccccc2)ccc1C#N 510189241 KQKGBJPREFMZQL-KRWDZBQOSA-N 387.508 5.356 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1ccc(F)cc1 510873455 SZHATTMMDFBXOB-UHFFFAOYSA-N 389.430 5.462 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Cl)c(Br)c2)n1 511866937 BDALPOCUXPCELA-JTQLQIEISA-N 383.698 5.172 30 20 GKED CC(C)(NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 520818721 ABXIIFKXSCSPIB-UHFFFAOYSA-N 399.494 5.388 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 521257973 ODZJBKXANIFWSI-FUHWJXTLSA-N 379.529 5.268 30 20 GKED CC(C)OC1CCN(C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)CC1 525597803 DZVHFMDOTRSAAZ-UHFFFAOYSA-N 398.890 5.034 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)S1 525739461 YSWZIDRCKBWWDS-CLCXKQKWSA-N 399.947 5.353 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@H]1c1ccc(Br)cc1 531207585 WEEXXCDGMBNQIW-AWEZNQCLSA-N 396.210 5.076 30 20 GKED C=C(C)CN1CCC(N[C@@H](C)c2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 532231195 SZGHUORWVOKVLN-INIZCTEOSA-N 385.533 5.014 30 20 GKED C=C(C)[C@@H](CC(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C)OCC 534469399 LPQJMXXMCIQSPX-HXUWFJFHSA-N 394.540 5.949 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(-c2ccc(F)cc2)cc1 535851244 NUDILKQDFKOQHK-QGZVFWFLSA-N 387.458 5.267 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H](CC(F)(F)F)c2ccc(F)cc2)CC1 540164393 UIQVCYYVBCPGLS-NYLDSWQDSA-N 390.424 5.813 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccc(C2(C#N)CC2)cc1 540784342 RYUICQFJISQSLN-GOSISDBHSA-N 386.520 5.707 30 20 GKED N#Cc1ccc(CN(C(=O)Cc2coc3ccc4ccccc4c23)C2CC2)cc1 543224476 ZLXSGKRUBIGUNT-UHFFFAOYSA-N 380.447 5.191 30 20 GKED C=CCC[C@@H](NCc1cccc(NC(=O)c2cccc(F)c2)c1)c1ccco1 552032979 FWRXIWVNWVINKV-OAQYLSRUSA-N 378.447 5.468 30 20 GKED C[C@H]1CCC[C@](C#N)(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 558121984 IQWDYVXDNCXXRA-NYHFZMIOSA-N 393.874 5.206 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CCC(=O)c3ccccc32)sc2c1-c1ccccc1CC2 560038799 FFAMXHRSJNWAJP-GOSISDBHSA-N 398.487 5.084 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC3(CCCC3)CC2)cc1 564351356 VZLVNOCMWFQAEU-UHFFFAOYSA-N 375.472 5.539 30 20 GKED Cc1ccccc1C1=CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 564680968 JZYRMYVYANOECL-KRWDZBQOSA-N 377.513 5.320 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 571099473 WPJSJBDOFIMKBV-UHFFFAOYSA-N 389.480 5.498 30 20 GKED C[C@@H](N[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1cccc(C#N)c1 571558899 GKCZSIMFYRIQQO-ZUOKHONESA-N 394.316 5.530 30 20 GKED N#Cc1ccnc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c1 573280985 HPKJRYTUNUIQIM-UHFFFAOYSA-N 381.766 5.092 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)cc2s1 583387925 UIMQGEQPWLVAJD-UHFFFAOYSA-N 387.867 5.185 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccccc2)c1 589740334 RFBAEMJXZQFLMA-SFHVURJKSA-N 378.394 5.457 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2cccc(N3CCCC3)c2)sc2ccc(C#N)cc12 589985244 MKFAVIXHCZGKJU-INIZCTEOSA-N 389.524 5.173 30 20 GKED CCOc1ccc(C[C@@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 591059648 KTOPYMCTPWJOCL-SJORKVTESA-N 382.529 5.297 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1ccc2ccccc2n1 603532895 DFLHESUYJVKIRP-UHFFFAOYSA-N 395.437 5.401 30 20 GKED N#Cc1cccc(CNCc2ccc(OCc3c(F)cccc3Cl)cc2)c1 608982502 VWACRPRTCWHPNW-UHFFFAOYSA-N 380.850 5.220 30 20 GKED Cc1cccnc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 609206973 ZOMKZCQJOSNIFE-IBGZPJMESA-N 390.874 5.021 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)c(F)c1 609252772 HOSHTERPXJIRHB-QHCPKHFHSA-N 399.425 5.032 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)NCc1ccc(C#N)cc1F 609252814 UASVKSTTXCBVMG-UHFFFAOYSA-N 391.471 5.479 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1c(F)cccc1F 609387065 IZDIAMAHWORZCU-NSHDSACASA-N 386.389 6.162 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCC[C@H]1Cc1ccccc1 610019140 DRFQZALTAGDWII-HOJAQTOUSA-N 393.556 5.614 30 20 GKED CC(C)n1cc2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2n1 610113825 GFOTUGMMSQUGHJ-UHFFFAOYSA-N 380.451 5.408 30 20 GKED CCCc1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 610224124 CGETZEKLPCKRPD-QGZVFWFLSA-N 395.915 5.657 30 20 GKED COc1ccccc1[C@H](NCc1ccc(C#N)cc1F)c1ccccc1Cl 610258768 WJTGKJYBIRKLAU-JOCHJYFZSA-N 380.850 5.239 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCC(F)(F)C2)cc1Cl 610793227 RYZSAJNIRHLTSO-DOTOQJQBSA-N 389.833 5.305 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 615971633 PIYNCKPWXKFAIR-QZTJIDSGSA-N 377.381 5.163 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Cc1sc(C)nc1-c1ccc(C)cc1 615971702 LRTWVLOBKIZHLR-UHFFFAOYSA-N 394.515 5.323 30 20 GKED COCCN(CCC#N)C(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 619009806 NBKPWSMEIBFADZ-UHFFFAOYSA-N 392.286 5.054 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(COC(C)(C)C)cc1 672701308 UXIVMHSNGAKDTQ-UHFFFAOYSA-N 398.551 5.389 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC(F)(F)F 727225254 RYGUFWQZLVCCGP-UHFFFAOYSA-N 393.434 5.613 30 20 GKED N#CCCCCNC(=O)c1cc(-c2cccc3ccccc23)nc2ccccc12 728851778 FBWKRLOQWIFDBN-UHFFFAOYSA-N 379.463 5.479 30 20 GKED CC[C@@H](C)n1c(-c2ccccc2)nn(CN(CCC#N)CCC(C)C)c1=S 728901800 YRDUNVRGKHSDCI-GOSISDBHSA-N 385.581 5.271 30 20 GKED C#CCOc1cccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c1 730976420 MXZKBULKJQSEML-UHFFFAOYSA-N 394.430 5.273 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C\c1ccccc1Cl 730997404 GMLCZPVXXFCUMW-BMSUMIBZSA-N 392.933 5.004 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1csc(-c2cccc([N+](=O)[O-])c2)n1 733083834 RFIGKFRFCHQBMA-CMDGGOBGSA-N 396.472 5.009 30 20 GKED CCCCSc1nnc(SCc2cc(Cl)ccc2OCC#N)s1 735230854 SHFNECJATSNTEP-UHFFFAOYSA-N 385.967 5.278 30 20 GKED CCC[C@@]1(COC)CCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 772230018 KTSQBLOGGXUWFA-UPVQGACJSA-N 391.515 5.155 30 20 GKED CCCCCCCOc1ccc([C@H](C)N[C@@H]2CCO[C@@]3(CCOC3)C2)cc1 773154120 XENNMDWAOSIANI-WPYKKVEZSA-N 375.553 5.025 30 20 GKED C=CC[C@@H](C(=O)OCCCC(=O)Nc1c(C)cc(C)cc1C)c1ccccc1 778426906 JKVMUKBPUZGOSX-OAQYLSRUSA-N 379.500 5.234 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 782727990 JVVXWAXITVQFSL-UUOWRZLLSA-N 396.494 5.298 30 20 GKED CO/C(=C\c1ccccc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 791348939 LIXXPABQECVMMI-IWIPYMOSSA-N 398.462 5.072 30 20 GKED N#C[C@H](C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1nc2ccccc2s1 802036110 PZPVESBLEMLDIZ-IUODEOHRSA-N 378.350 5.202 30 20 GKED N#Cc1ccc(COC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)c(F)c1 805005107 JKQRNXNVNINCPY-UHFFFAOYSA-N 387.410 5.071 30 20 GKED Cc1cc2cc(CNC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)ccc2[nH]1 806200741 MFLKUYNGOPXJRY-HSZRJFAPSA-N 394.478 5.454 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N1CCc2c(CC#N)cccc2C1 860569673 PQTBHZXJTXNSIN-UHFFFAOYSA-N 393.556 5.542 30 20 GKED CC1=NN(c2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2)CC1 915863183 UVMWZOGUMDRFMF-DEOSSOPVSA-N 394.478 5.180 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=CCCc1ccccc1 916277038 QOARUHXGZDJJLG-UHFFFAOYSA-N 377.300 5.007 30 20 GKED Cc1sc2ncn(N=Cc3c4ccccc4cc4ccccc34)c(=O)c2c1C 916310914 QBZFUWJHKYHPTI-UHFFFAOYSA-N 383.476 5.263 30 20 GKED C=CCC[C@@H]1CCCN1Cc1nc2ccccc2c(-c2ccccc2)c1C(=O)O 1776170876 XFGLSNNHBWTKDL-LJQANCHMSA-N 386.495 5.531 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C/C(=O)c1cc(C(=O)O)ccc1O 1776365019 JCARQGSAZPGLCJ-VQHVLOKHSA-N 376.861 5.140 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCc2ccc(C)cc2)cc1 1776784809 ZFMMRCQNQJVMQE-QHCPKHFHSA-N 397.559 5.867 30 20 GKED CCCCCCCOc1cccc(CN[C@H]2CCCC[C@@H]2CCC(=O)O)c1 1776787276 KJZGBRPDBHPOJK-IRLDBZIGSA-N 375.553 5.549 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2(C)C)cc1 1776787495 DVDXWBAKSKKJFS-SFHVURJKSA-N 377.550 5.074 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)[C@@H]3CC=CCC3)cc2)CCC1 1786075547 KEKUDPDWDQZFMO-DENIHFKCSA-N 392.543 5.245 30 20 GKED COc1ccc(-c2nnc(S[C@@H](C)C#N)n2-c2ccccc2C(C)C)cc1 3484210 FNISAYUNHBMPAD-HNNXBMFYSA-N 378.501 5.070 30 20 GKED C=CCN(CC(=O)Nc1c(C)cc(C)cc1Cl)Cc1ccc(Cl)s1 8163274 JREXWFMANJTQPF-UHFFFAOYSA-N 383.344 5.298 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1SCc1cccc(F)c1 14088255 YUQYOLMCTHERNT-UHFFFAOYSA-N 389.883 5.128 30 20 GKED Cc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)oc2ccc(Br)cc12 29150976 UCFBKBSOYSIESI-UHFFFAOYSA-N 397.272 5.557 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(-c2nc3ccccc3s2)o1 56476904 GXIVFEDRWLXEDG-UHFFFAOYSA-N 389.436 5.079 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)Cc1ccco1 65473440 COJYIIFUWKSAAQ-UHFFFAOYSA-N 389.455 5.173 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(COc2ccccc2)cc1 78668568 ILWKUHUHUFSKJG-UHFFFAOYSA-N 388.492 5.524 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1 110175586 YMNOUEXWDPSMAA-UHFFFAOYSA-N 399.475 5.047 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2ccc(F)cc2)C(F)(F)F)cc1 118538396 GRNKIBKGFSPQGK-INIZCTEOSA-N 379.357 5.052 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1C)[C@@H](c1ccc(Cl)cc1)c1cccnc1 122652172 RQKLTWUZNJWPOC-QFIPXVFZSA-N 389.886 5.167 30 20 GKED Cc1cncc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 130756278 HEMQSKYWNCQRNR-FQEVSTJZSA-N 390.874 5.021 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2F)CC1)c1nc(-c2c(F)cccc2F)cs1 131135674 UBBHNGYSHCSNKO-LBPRGKRZSA-N 398.409 5.135 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)c1nc(-c2ccccc2)cs1 155441600 NRQJZOWRMXQNBM-ZDUSSCGKSA-N 387.386 5.075 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCC[C@@H]3c3cccc4ccccc34)o2)cc1 173566498 PSBUYNZWUZBXEB-JOCHJYFZSA-N 380.451 5.099 30 20 GKED C[C@H](c1ccc([S@@](C)=O)cc1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 177731149 WPARLZWWGKQOJC-KWMCUTETSA-N 388.536 5.156 30 20 GKED COc1ccc(C(=O)CCCCCC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 189780043 NLOIFAABDIXQRT-UHFFFAOYSA-N 392.499 5.268 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2)[C@H]1C 246537615 SNWPMYXVFWIXQM-ZHALLVOQSA-N 379.529 5.348 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1cc(Br)ccc1F 255301397 ILOIACDGNAYAIB-ALCCZGGFSA-N 389.249 5.003 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(Oc2c(C#N)cccc2C#N)cc1 302886702 NFCWOANHXRTPKU-UHFFFAOYSA-N 387.826 5.152 30 20 GKED N#CCCCOc1cccc(NCc2ccc(Br)cc2Cl)c1 318390081 DCLWWFBRGMAKCY-UHFFFAOYSA-N 379.685 5.397 30 20 GKED COc1c(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)cc(Cl)cc1C(=O)N(C)C 329151217 SGMZHYYZFWYBEM-VNQPRFMTSA-N 392.927 5.245 30 20 GKED C/C(O)=N/[C@H](C/C(O)=N/[C@@H]1CCCCC12CCCC2)c1ccc(F)cc1F 329757196 ZFMXLPPDPCDVOM-RTBURBONSA-N 378.463 5.832 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3o2)cc1 364373855 SSMUODGSIBQOIC-IBGZPJMESA-N 388.471 5.388 30 20 GKED C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[S@@](=O)CCC1(C#N)CCCCC1 417149988 PHBOBSVKHRDHGB-PTFIGZPYSA-N 391.924 5.064 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(-c3ccc(Cl)cc3)c[nH]2)cc1 426455655 BOAJLNYVWDGRRX-UHFFFAOYSA-N 393.874 5.294 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1cccc(Oc2cccc(C(F)(F)F)c2)c1 429643224 DATWRHKTMCEOIG-ZDUSSCGKSA-N 377.366 5.264 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)c1ccc(C#N)s1 432109888 GYQLJXOLMSAIEX-UHFFFAOYSA-N 380.494 5.173 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 433144505 MNFADGUROKRQFY-PXNSSMCTSA-N 393.556 5.665 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H](C)c1ccc(F)cc1F 438046141 WNHDFBDRZJBZFS-KGLIPLIRSA-N 389.471 5.142 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(Cc1nnc(-c2cccc(C#N)c2)o1)C1CC1 438813051 KHNXAZHPRWDMJA-QGZVFWFLSA-N 394.478 5.487 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(CSc2ccccc2C#N)cs1 439713264 YWHOKZDFZMXFOD-UHFFFAOYSA-N 399.928 5.645 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441533317 MONFGHOHAFLAOC-DNVCBOLYSA-N 391.437 5.510 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@H](C)c1ccco1)c1ccc(C(F)(F)F)cc1 441534976 RYCVTQVTXFWWKK-RHSMWYFYSA-N 380.410 5.708 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(OCC3CCOCC3)cc2)CCCC1(C)C 444902676 WSCWJGZJYPQRAZ-NRFANRHFSA-N 386.536 5.091 30 20 GKED C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCC[C@@H]1c1cccc(Cl)c1 453462970 PPQPFXZSLICTPB-IPELMVKDSA-N 386.927 5.089 30 20 GKED Cc1cc(C#N)cc(NC(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c1 456001792 MDNBIRYBTLUOBP-UHFFFAOYSA-N 394.862 5.073 30 20 GKED CCN(C(=O)c1cc(C)c(C#N)cn1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 457551899 GIPKERUTRJFBQZ-DEOSSOPVSA-N 398.510 5.032 30 20 GKED C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458794660 BNZAVOHRPZJWSZ-WTNAPCKOSA-N 379.479 5.353 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccc(CC)cc3)o2)cc1 463500282 LEKUUZPWBQNXTH-UHFFFAOYSA-N 388.467 5.468 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1c(F)cccc1OC 466124095 PQBYJGFZYFCASR-LBPRGKRZSA-N 382.888 5.008 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(F)ccc1F 469145900 UDTRYWFSRBJZSS-FQEVSTJZSA-N 383.442 5.111 30 20 GKED CC(C)(C)OC1CC(CCNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 470009148 MNCYTHSVNDBSNL-UHFFFAOYSA-N 392.499 5.064 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(Br)s1 471271837 GEOWSUGXSCRTRL-SNVBAGLBSA-N 395.347 5.323 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1c1cccc(Br)c1)c1ccccc1 475031694 ODZGPMAQCRXASP-XLIONFOSSA-N 397.316 5.200 30 20 GKED COc1cc([C@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)ccc1OC(C)C 481913355 NCOAWVSSMYGOHQ-HTAPYJJXSA-N 378.516 5.472 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)N(C)Cc1cccc(C#N)c1 482123769 ICLSKEBHXAHODF-UHFFFAOYSA-N 386.451 5.021 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 483498748 KUTBCWDRUOAGRL-NRFANRHFSA-N 382.463 5.289 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1C 485339346 WOSCXGJLDZMPIA-MRXNPFEDSA-N 387.487 5.023 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H]1CCCc2cn(C3CCCC3)nc21 485520500 VCNUSWWBGZYILD-LJQANCHMSA-N 381.545 5.084 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1 504123869 WUAONBMCWNNDAC-UXHICEINSA-N 398.526 5.027 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 508296488 DBDVHGZVMSXGJJ-FQEVSTJZSA-N 397.478 5.680 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H](C)[C@@H]1C 510104860 MNPABERNPIEXRN-AEFFLSMTSA-N 377.488 5.098 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCC[C@@H](Cc2csc3ccccc23)C1 513118989 RXDYZYJOFOSKCD-KRWDZBQOSA-N 383.561 5.195 30 20 GKED Cn1c([C@H](C#N)C(=O)c2ccc(CSc3ccccc3)cc2)nc2ccccc21 513672404 RGKYEPMCYJXVQA-HXUWFJFHSA-N 397.503 5.356 30 20 GKED N#Cc1c(NC(=O)c2ccccc2OCc2cccs2)sc2c1CCCC2 521677970 RIZMSXUJAXBVRX-UHFFFAOYSA-N 394.521 5.391 30 20 GKED C=CCOc1ccc(CNCc2cc(F)ccc2Br)cc1Cl 521814651 MVRPTSVHMXUJMK-UHFFFAOYSA-N 384.676 5.096 30 20 GKED N#Cc1ccc(OCC(=O)Nc2cccc(CSCc3ccccc3)c2)cc1 522505008 KZIYZVWXVURUHV-UHFFFAOYSA-N 388.492 5.009 30 20 GKED CC(C)Cn1ccnc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522633634 XIJXFOSMEIMJJB-UHFFFAOYSA-N 394.862 5.109 30 20 GKED Cc1ccc(C)n1C1CCN(C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CC1 523156013 AJFYWTQMFMXOCE-UHFFFAOYSA-N 398.510 5.198 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 523355551 DJJXFPLCTCEHPB-QHCPKHFHSA-N 387.439 5.088 30 20 GKED N#CCCCOc1cccc(NCc2csc(-c3ccc(Cl)cc3)n2)c1 524459857 CSNCOTCWAOKRGC-UHFFFAOYSA-N 383.904 5.758 30 20 GKED CN(C)Cc1cccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 524539694 OKGZUNUGPPUHCZ-UHFFFAOYSA-N 386.455 5.056 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1cccc(CSC2CCCC2)c1 524869017 VUQZCLRGFOZEAW-INIZCTEOSA-N 380.513 5.140 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1Cc1cccc(OC)c1 530553082 HNIDREMEEOCJKP-OAQYLSRUSA-N 392.543 5.786 30 20 GKED C[C@@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccc(C#N)cc1 532207024 IXRPFUJTHBWWSZ-RTBURBONSA-N 396.494 5.197 30 20 GKED C=CCCC[C@@H](C)NC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 538333393 YAORMULFBDTEBY-CYBMUJFWSA-N 382.451 5.232 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(OC3CCC3)cc2Cl)c(C#N)s1 540274765 XBTQDSKVCGZAEA-UHFFFAOYSA-N 388.920 5.754 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 540314610 RIXDWXBQSWIGKU-HFZDXXHNSA-N 382.507 5.483 30 20 GKED CC[C@@H]1C[C@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 541007221 IOUJVILJYPZOAQ-XMSQKQJNSA-N 396.918 5.340 30 20 GKED CC(=O)c1cccc(NC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541074510 DHUIZJIQLYEACW-INIZCTEOSA-N 383.451 5.311 30 20 GKED C=CCC[C@H](NC(=O)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 542535466 PYVWXCHMKAFBBR-FKBYEOEOSA-N 382.479 5.053 30 20 GKED Cn1cc(CNCc2ccc(-c3ccccc3C#N)cc2)c(C2CCCCC2)n1 543239669 NBSRQHFKXXQMPU-UHFFFAOYSA-N 384.527 5.296 30 20 GKED N#CC[C@H](CC(=O)NC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1ccccc1 552244046 NLBMOBRPECJHOX-IRLDBZIGSA-N 396.918 5.011 30 20 GKED CCCN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)CC1CCCCC1 553026562 RYCVKMLZSPPODL-SFHVURJKSA-N 387.593 5.169 30 20 GKED N#Cc1cccc(C2(N[C@@H]3CCc4c(Cl)cc(Br)cc43)CC2)c1 556600621 HURVEQJOSXVOQI-GOSISDBHSA-N 387.708 5.240 30 20 GKED COc1ccccc1[C@H]1C[C@@H](C)CCN1C(=O)C[C@H](CC#N)c1ccccc1 557816761 KOMFUIYIHSHNKH-RCZSKKKRSA-N 376.500 5.082 30 20 GKED Cc1nc(-c2cccc(-c3noc(C[C@H](CC#N)c4ccccc4)n3)c2)cs1 558326564 ZFQWZKGORGKTFJ-KRWDZBQOSA-N 386.480 5.409 30 20 GKED Cc1sc([C@H](C)NC(=O)[C@]2(C#N)CC23CCCC3)nc1-c1ccc(Cl)cc1 562684101 HJKKWOJFWIKGTH-YEJXKQKISA-N 399.947 5.423 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN[C@@H]2CCc3ccc(C#N)cc32)on1 576474346 UDJRSWBDMZWVLT-JOCHJYFZSA-N 395.462 5.152 30 20 GKED Cc1cn(C2CCCCC2)[nH]c1=NC(=O)Nc1ccccc1S[C@@H](C)CC#N 584507383 DAZYAWXRRVIAGK-INIZCTEOSA-N 397.548 5.157 30 20 GKED N#CCCC[C@@H](NC(=O)NCCc1c[nH]c2cc(Cl)ccc12)c1ccccc1 590918729 SBPZIUIQFJTIPO-HXUWFJFHSA-N 394.906 5.098 30 20 GKED COc1ccccc1[C@H]1CCCCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 590942343 LXPZQPAFGCUKPR-FCHUYYIVSA-N 391.515 5.367 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(-c4ccc(F)cc4)o3)cn2)cc1 603765263 SFIBHPAJFFEMQF-UHFFFAOYSA-N 399.381 5.397 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603829139 JWRIVROCJCRIDJ-HNNXBMFYSA-N 390.418 5.110 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 609377103 OJOQKSQSYNOSJR-HOCLYGCPSA-N 392.446 5.613 30 20 GKED CSCc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccccc12 609377195 QMEHOHUHPJBCOF-AWEZNQCLSA-N 396.537 5.800 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC(C)(C)c1ccccc1 609435368 KDFTWRAWBTYPQD-QGZVFWFLSA-N 381.545 5.570 30 20 GKED Cc1cccc(COc2cccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)c2)c1 610324776 NXVUMWKCRBEVOI-GOSISDBHSA-N 385.467 5.328 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1NCc1cccc(OCc2ccccn2)c1 610714997 WIYRRDAXCLZGJI-UHFFFAOYSA-N 383.373 5.163 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1C(F)(F)F 678207851 GBCBVTNIBWUDEO-AOOOYVTPSA-N 397.256 5.407 30 20 GKED C=CCC[C@@H](NCc1nc(O)c2ccc(C(F)(F)F)cc2n1)c1ccccc1 678785367 AVNGUWLZJFABCH-QGZVFWFLSA-N 387.405 5.151 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1cnc2ccccc2n1 682995067 NZXIQNYTOADQOE-LJQANCHMSA-N 383.382 5.051 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3)s2)cc1NC(C)=O 726429902 WLHIFZPZPDUEPB-CSKARUKUSA-N 395.455 5.417 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 729375680 QICRGRWAOHNDAL-UHFFFAOYSA-N 385.448 5.219 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](c3cccc(F)c3)C2)cc1 729553762 UHSIXGDDQWRWJJ-ZJSXRUAMSA-N 399.469 5.503 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2cc(F)ccc2s1 730418041 WWLSPZGXCVWDKA-LLVKDONJSA-N 379.243 5.161 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1cccc(Cl)c1 730950242 BHRWLOXGBNAKFO-RMKNXTFCSA-N 382.799 5.106 30 20 GKED Cc1sc2ncn(N=Cc3ccc([C@H]4C[C@@H]4C)o3)c(=O)c2c1-c1ccccc1 732764130 PYUMDAAUMUYBCS-GUYCJALGSA-N 389.480 5.032 30 20 GKED CCOc1cccc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 733083435 JGUIDGNOMLEWGE-KTKRTIGZSA-N 380.425 5.013 30 20 GKED CC[C@H](OC1CCCC1)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733680896 IZLKYHGYHACETO-ZFWWWQNUSA-N 396.434 5.229 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3ccccc3C)CCCCC2)c1 733774796 KVAZKKNVMLDYRU-OAQYLSRUSA-N 390.527 5.194 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2c(Cl)ccc(Cl)c2Cl)c1 733800531 YDNQDCQSJHFZKL-ZDUSSCGKSA-N 383.706 5.618 30 20 GKED N#CCCn1cc(C2=NN=C(Nc3ccc(Cl)cc3)SC2)c2ccccc21 733807184 SUXIQSXORCFJMS-UHFFFAOYSA-N 393.903 5.127 30 20 GKED CCN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccc(C)cc1C 734101043 BXUOSIHQYNICGZ-UHFFFAOYSA-N 384.479 5.421 30 20 GKED N#CCOc1ccc(Cl)cc1CN(Cc1ccc(C(F)(F)F)cc1)C1CC1 735306089 HZXKUBBRISYRNJ-UHFFFAOYSA-N 394.824 5.426 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccs1)c1cncc(F)c1 737442440 AYYKHNPVBAIGSK-HJWRWDBZSA-N 375.428 5.031 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1sc(-c2ccc(C)cc2)nc1C 739420966 BKAGZVFYDNKLMQ-UHFFFAOYSA-N 390.434 5.677 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1ccc(F)cc1F 740764197 NVNYQVGVSPHVCR-KTKRTIGZSA-N 386.829 5.376 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(C)c(NC(=O)OC(C)(C)C)c2)cc1 742594212 WTXBQYDBFZCPBR-UHFFFAOYSA-N 393.487 5.211 30 20 GKED Cc1csc(SCc2c(C(=O)OCC3(CC#N)CC3)oc3ccccc23)n1 744278394 CGVFMODBJGXGGN-UHFFFAOYSA-N 398.509 5.341 30 20 GKED C=C(C)[C@H](CC(=O)O[C@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1)OCC 756475565 CRYOXZTVCUSBCS-PBHICJAKSA-N 377.868 5.279 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCn3ccc4cc(Cl)ccc43)[nH]c12 760995555 XHMFNAKJQDHKBK-QGZVFWFLSA-N 390.874 5.136 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3nc(C)sc3c2)cc1 763944012 LUIDKOZFQDRBBU-ACJLOTCBSA-N 391.496 5.079 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(OCc3cccnc3)cc2)CCCC1(C)C 770419513 OIHNHQXLZUFGQB-NRFANRHFSA-N 379.504 5.259 30 20 GKED C=CCC[C@@H](NC(=O)N1CC=C(c2ccc(Cl)nc2)CC1)c1ccccc1 773641580 ROZTYVIMBNWEFV-HXUWFJFHSA-N 381.907 5.241 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cc(C)cc(C)c3)n2)cc1 777311056 WRDLJKJKEXDVCR-FQEVSTJZSA-N 390.508 5.245 30 20 GKED C=CCCN(OCc1ccccc1)[C@@H](C)c1nc(O)c2c(C)c(C)sc2n1 782669686 QXGSYCRIZAEXAS-HNNXBMFYSA-N 383.517 5.085 30 20 GKED C=CCCN(C)Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12 786102396 XBEVONZCCUQJJT-UHFFFAOYSA-N 383.875 5.135 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc(Br)ccc1F)c1ccc(F)c(F)c1 788754552 PXSLBSUUOAZDFC-HWPZZCPQSA-N 385.227 5.229 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(-c2ccc(Cl)cc2Cl)nc1 789696255 XREIBJAGAQXJFD-UHFFFAOYSA-N 398.249 5.210 30 20 GKED C#CCCOc1ccc(CNc2ccc(C(=O)NC(C)(C)CC)c(Cl)c2)cc1 789889854 NONKTTQCAZORDC-UHFFFAOYSA-N 398.934 5.273 30 20 GKED CCC1=C(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 790314238 KKASKUHGVRMBFL-LJQANCHMSA-N 380.875 5.408 30 20 GKED C#CC[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1COCc1ccccc1 806209079 OOUCNCFNWSYSRX-XMMPIXPASA-N 398.506 5.160 30 20 GKED CN(Cc1ccccc1N(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 808816093 LEWYOXKJEVXBQF-HSZRJFAPSA-N 398.510 5.072 30 20 GKED CC(C)[C@H](Oc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813213901 QTNOKHZKTARPHP-YJBOKZPZSA-N 396.796 5.034 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942174 NOOPFDLYVZXRCJ-NHYWBVRUSA-N 378.419 5.094 30 20 GKED C=CCCC[C@@H](NC(=O)Nc1ccc(C)c(NC(C)=O)c1C)c1ccccc1 878381978 XLRZIEXCWIZEAZ-OAQYLSRUSA-N 379.504 5.481 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2ccccc2)C2CC2)cc1 915352754 KAEXNOGPZKUZCU-RPWUZVMVSA-N 381.479 5.615 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 916708040 GYMMQNUUGWSGFA-BEFAXECRSA-N 391.421 5.503 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(C)n(C(C)C)c2C)cc1 916955557 RPIVOOKNQWLKJX-YCRPNKLZSA-N 379.504 5.161 30 20 GKED C[C@@H](OC(=O)c1ccccc1SCC#N)c1ccc(F)c(Br)c1 920800701 RTYGOAPMXIJXGS-LLVKDONJSA-N 394.265 5.122 30 20 GKED Cc1cccc(CCC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 920804089 KWOTXBYGELTNGI-HNNXBMFYSA-N 382.435 5.206 30 20 GKED O=C(O)c1ccc2scc(C=NNc3cc(C(F)(F)F)ccc3F)c2c1 1776053657 MRBBXXYGUZAVTO-UHFFFAOYSA-N 382.338 5.203 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776364794 HEQCSJRWNSZYKC-UITAMQMPSA-N 382.506 5.996 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1ccccc1C(F)(F)F 1776785356 ZTWJYYNFSICTNH-IBGZPJMESA-N 387.486 6.294 30 20 GKED CCCCCCCOc1ccc(/C=C\c2cc(C(=O)O)c3cnn(C)c3n2)cc1 1776785897 LMJBDQOMLNWXRE-FLIBITNWSA-N 393.487 5.186 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3C(=O)O)c2)o1 1776965936 IGFHRUDKSIHHPP-BENRWUELSA-N 376.408 5.015 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cc(C(=O)O)cs2)cc1 1777472321 UXLFYINPHJXDPP-KHPPLWFESA-N 378.449 5.230 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(F)c(Cl)c1 1777569371 JUTWBIIFIGQCEU-CLTKARDFSA-N 386.762 5.039 30 20 GKED C=CCCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(C)C)CC1 1831378117 SMUNEKQSFOUWDU-NRFANRHFSA-N 390.612 5.035 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 6793504 DOFPNSMYDGILOO-FQEVSTJZSA-N 376.843 5.256 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(OCc2ccccc2C#N)cc1 33219785 HSHJQTSVKYWZKH-UHFFFAOYSA-N 388.492 5.027 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(F)cc2)s1)c1cccc(N2CCOC2=O)c1 60097803 VQODGCWHICGKKE-CSKARUKUSA-N 393.439 5.407 30 20 GKED CC(C)[C@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 66861004 ZCVIOEKTMUDETR-JTSKRJEESA-N 381.545 5.006 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)n1 68721811 SYFUGJMFFCYBNY-JTQLQIEISA-N 394.308 5.372 30 20 GKED C[C@H]1C/C(=C/c2ccccc2)c2nc3ccccc3c(C(=O)N(C)CCC#N)c2C1 71837095 PACOASVYJBTAEX-CIJMEZBMSA-N 395.506 5.343 30 20 GKED Cc1cc(Cl)ccc1Oc1ccc(CS(=O)(=O)CCCCC#N)cc1 116473501 FLGGRPUNOYSCHF-UHFFFAOYSA-N 377.893 5.049 30 20 GKED Cc1ccc(N(C(=O)Cc2ccc(C#N)cc2)c2nc3ccccc3s2)c(C)c1 116546127 LUQJTOPJBSFFLG-UHFFFAOYSA-N 397.503 5.692 30 20 GKED N#CCCn1cc(CNc2ccc(OC3CCC3)c(F)c2)c(-c2ccccc2)n1 152307541 ITTGERLTGHYNOA-UHFFFAOYSA-N 390.462 5.146 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1ccc(C#N)cc1C 161637738 VPDMMPLQAMHKRR-UHFFFAOYSA-N 384.439 5.071 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] 175187043 PQGRTDJDTZZFKD-UHFFFAOYSA-N 396.218 5.024 30 20 GKED CN(C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1)C1(C#N)CCC1 181591941 HSQWVPYUSXYUGN-UHFFFAOYSA-N 394.471 5.382 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1)c1ccccc1 188036733 ZFASPPVVGBEEFP-FIPFOOKPSA-N 389.520 5.293 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccnc(C#N)c2)c(C(F)(F)F)c1 193506347 NHAJRBXOEOMGSZ-NSHDSACASA-N 379.407 5.115 30 20 GKED C=CCn1c(SCc2nc(-c3cccs3)oc2C)nnc1-c1ccoc1C 248040040 SJQJAVRLDBXDOU-UHFFFAOYSA-N 398.513 5.350 30 20 GKED CC(C)(C)c1nc2ccc(N=C(O)c3coc(C4CCOCC4)n3)cc2s1 328840346 ZADFCWAYZKJTKR-UHFFFAOYSA-N 385.489 5.112 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@H]2CCCCN2C2CCCC2)c1)C1CCC1 330351987 MXRSTVZRHQLRRJ-OAQYLSRUSA-N 383.536 5.328 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c21 410995168 CEFLMUCMYKPUSQ-NEPJUHHUSA-N 397.525 5.203 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1cccc(OC(F)F)c1 424654911 AOIXPZRSIKZSAF-CQSZACIVSA-N 390.455 5.111 30 20 GKED N#CCCC[C@@H](NC(=O)NCC1(c2ccc(Cl)cc2)CC1)c1ccccc1 431892168 QDUSJHDZCTXTOV-HXUWFJFHSA-N 381.907 5.106 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1 432076703 DNGCRVMDJKDNCJ-QGPMSJSTSA-N 399.947 5.802 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2s1 435183010 VYABBGACOCNLAU-UHFFFAOYSA-N 398.919 5.572 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(C3CC3)nc3ccc(Cl)cc23)n1 435592894 JVUZFBDSOQMXBK-MRXNPFEDSA-N 395.915 5.836 30 20 GKED N#Cc1ccnc(NC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)c1 436007044 MIZORMBYAHBDMI-LJQANCHMSA-N 379.872 5.079 30 20 GKED C[C@@H](Oc1ccc(C#N)c(Cl)c1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 438907904 RBENNHBFHRLDQT-SECBINFHSA-N 394.645 5.708 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@@H](C)c2ccc3cc(OC)ccc3c2)n1 439276845 PXTRCTLNPPMNNB-AWEZNQCLSA-N 392.480 5.145 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N[C@H](CCC#N)c1ccccc1 439662985 DMNSTKDHLBEIGX-GOSISDBHSA-N 379.460 5.033 30 20 GKED COc1cc(CSc2ccccc2C#N)ccc1OCc1cccc(C#N)c1 439694175 BGBBYLMXSSVTKC-UHFFFAOYSA-N 386.476 5.310 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3sc4c(c3C#N)CCCC4)cc2)cs1 440445062 OJWSHCGFRFYVQI-UHFFFAOYSA-N 379.510 5.183 30 20 GKED N#C[C@@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)C1CCCCC1 442681668 NQXNPAPVCMNRQA-MRXNPFEDSA-N 376.287 5.191 30 20 GKED Cc1ccc(CS(=O)(=O)Cc2ccc(-c3ccccc3C#N)cc2)c(Cl)c1 447352334 ZMEHWANBFSJPNY-UHFFFAOYSA-N 395.911 5.302 30 20 GKED CC[C@H](NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1ccc(C#N)cc1 447595933 BABUIBHGKBBUEB-RTWAWAEBSA-N 387.552 5.528 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)c1C1CC1 456108561 IWYILUCGHNELOC-CQSZACIVSA-N 380.492 5.033 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798743 IKSOBGNVCYRSEI-UWJYYQICSA-N 383.923 5.348 30 20 GKED C[C@@H]1CN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC[C@H]1c1ccccc1 458799937 KMULUVSDEQAKCT-UEVCKROQSA-N 375.516 5.257 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 464938038 GRVPVNJEPYNTEG-VPBXCIAMSA-N 380.491 5.242 30 20 GKED C=CCC[C@H](NC(=O)NCCc1csc(C)n1)c1ccc(C(F)(F)F)cc1 467758895 MPOWTKMUHOKKOB-KRWDZBQOSA-N 397.466 5.020 30 20 GKED CCOc1cc(Cl)ccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 469324938 RDAAMSWCBHLFPX-UHFFFAOYSA-N 393.830 5.050 30 20 GKED C=CC[C@@H]1N(C(=O)CCc2nnc(-c3cc4ccccc4o3)o2)CCCC1(C)C 470281341 XAELNWUNTMOFGJ-IBGZPJMESA-N 393.487 5.009 30 20 GKED CO[C@H](C)c1nc(CSCc2ccc(-c3ccccc3C#N)cc2)cs1 476941988 DUBGAVJGCLSLFC-OAHLLOKOSA-N 380.538 5.823 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@H]1c1ccc(OC)cc1)c1ccc(F)c(F)c1 477730497 XAIYJCQIFPIVKN-SFTDATJTSA-N 386.442 5.137 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H]1C[C@H]1c1ccc(Br)s1 477988510 HQTRCRGLBPZOGD-CHWSQXEVSA-N 394.359 5.075 30 20 GKED C[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481662654 YAJCCUFBHQVSSB-HRAATJIYSA-N 395.478 5.319 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 485865967 XBHVUNCUKLKVFD-UHFFFAOYSA-N 396.462 5.412 30 20 GKED C[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)C(=O)c1ccc(Cl)cc1 487455319 NFEMTOCMFVSXFH-OXQOHEQNSA-N 382.891 5.100 30 20 GKED Cc1ccc(C#N)cc1NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12 495090902 IQDBDSCZOWNNPE-CYBMUJFWSA-N 381.888 5.188 30 20 GKED CCc1cnccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 499405717 NMXLYIQYNADQLH-FQEVSTJZSA-N 375.859 5.205 30 20 GKED N#CC1(CCCN2CCCCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 499773430 OPQKUPKUSBKNNM-HXUWFJFHSA-N 394.481 5.723 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 501145941 ZIIQIZVMLPGZBW-UHFFFAOYSA-N 396.475 5.305 30 20 GKED C[C@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(F)cc1 502021628 DKSNNHYZPBMJQT-MRXNPFEDSA-N 390.483 5.382 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)[C@H]3CC[C@H](C(F)(F)F)C3)c2)c1 506443678 HBWOWNCOWMAGFS-IRXDYDNUSA-N 388.389 5.054 30 20 GKED C=CCOc1cccc(NC(=O)N2CCCCC[C@H]2c2ccc(OC)cc2)c1 510986652 XDAHHJQLNQQMTJ-QFIPXVFZSA-N 380.488 5.409 30 20 GKED N#C[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(F)cc1 511721876 ITQYJYZHTFBILM-CYBMUJFWSA-N 379.243 5.342 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)NCC(C)(C)C#N 512927512 PKQMCEHDANEBAW-UHFFFAOYSA-N 393.409 5.047 30 20 GKED N#CCCn1cc(CN[C@H]2CCCc3sc(Cl)cc32)c(-c2ccccc2)n1 515954493 UYXFUFITNIYECT-SFHVURJKSA-N 396.947 5.346 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-n2cccc2)c(F)c1 517521963 IOYFMJFIOIMWLR-OAHLLOKOSA-N 379.460 5.263 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(-n4cccc4)c3)n2)cc1 517801017 VYHPJDGLDQQXFR-FQEVSTJZSA-N 399.475 5.099 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 518755834 OPDIBUZPBDTFBC-RXVVDRJESA-N 393.556 6.230 30 20 GKED CC(C)c1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)nn1C(C)(C)C 519422870 RHSIXEWHQBZODF-OAHLLOKOSA-N 384.549 5.266 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ncc(-c2ccccc2)s1 519512692 GVWLXXBXWRGIJW-CQSZACIVSA-N 394.525 5.848 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc(Cl)cc3Cl)o2)cc1 524382943 DQDWGVILBOPPSE-UHFFFAOYSA-N 387.222 5.289 30 20 GKED CCN(C(=O)Nc1cc(C#N)ccc1OC(F)F)[C@@H](C)c1cc2ccccc2o1 524435872 RTXVBZPRQJMPSL-ZDUSSCGKSA-N 399.397 5.521 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(Cl)c3)cc2F)c1 524455362 RWDAXWPPKAIXER-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NC3(c4cccc(F)c4)CC3)cc2)c1 524831078 PVKNJXBLQBVCSX-UHFFFAOYSA-N 387.414 5.300 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)c2sccc2C#N)nc1-c1ccccc1 525207300 KPWZRPGSRQVDNQ-QGZVFWFLSA-N 391.496 5.375 30 20 GKED CCC(C#N)(CC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 528925256 UKQKBQIEPPZFJC-CYBMUJFWSA-N 392.311 5.623 30 20 GKED C=CCCc1ccccc1NC(=O)N1[C@H]2CC[C@H]1c1cnc(C(C)(C)C)nc1C2 529088721 CROHHKXHBCGVPO-UWJYYQICSA-N 390.531 5.186 30 20 GKED CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)Nc1ccc(CC#N)cc1Cl 529108947 RAZUHUULRUVMQU-QGZVFWFLSA-N 385.870 5.345 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 533959323 DXKDIVUEEOYLNQ-MRXNPFEDSA-N 376.481 5.299 30 20 GKED C[C@H](N[C@@H]1CCc2c(Cl)cc(Br)cc21)c1ccc(C#N)cc1 535509381 XLYWGONBPHHNBY-BBATYDOGSA-N 375.697 5.312 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccnc(C2CC2)c1 542150188 RDYJOGUZYPQWBL-UHFFFAOYSA-N 391.418 5.236 30 20 GKED CN(C[C@H]1CC=CCC1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 544236571 VLTJNSZHHQPOSZ-FQEVSTJZSA-N 389.499 5.152 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cccc(Oc2ccccc2)c1 558306604 FVWRXQNXBLCSMD-UHFFFAOYSA-N 392.455 5.174 30 20 GKED CCCN(CC)Cc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 564435927 QAAJWXRDLDJJON-GOSISDBHSA-N 377.513 5.018 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1 565852141 XXCUFUJILMFKQQ-QGZVFWFLSA-N 387.405 5.183 30 20 GKED Cc1oc(C#N)cc1-c1nc(-c2cccc(Oc3ccc(Cl)cc3)n2)no1 569621409 QACHOYMAHSHIQQ-UHFFFAOYSA-N 378.775 5.017 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccccc2F)C1 569719164 DPQWSFXNRBLMOU-HZPDHXFCSA-N 383.492 5.099 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(OC2CCCCC2)cc1 571716569 AFWLWSGPTRLQLN-UHFFFAOYSA-N 380.513 5.656 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)[C@H]1C1CC1 579897828 MAFZMMGKHPCMKI-FQEVSTJZSA-N 379.435 5.142 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NC3(c4cccc(C#N)c4)CC3)s2)cc1 583445754 ZRDSOSIUDXTIEJ-MRXNPFEDSA-N 389.524 5.339 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@H]1CCc2ccc(C#N)cc21 589339164 URCAUIYREYDVOI-XCLFUZPHSA-N 393.943 5.982 30 20 GKED N#Cc1cc(C(=O)N2CCC[C@@H]2c2cccc3ccccc23)cnc1C(F)(F)F 590177163 SAXBJOQELIPSET-LJQANCHMSA-N 395.384 5.103 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)N[C@H](CCCC#N)c2ccccc2)s1 590477832 BQIRUUIYIONJCV-QGZVFWFLSA-N 395.553 5.274 30 20 GKED N#CC1(c2ccc(-c3cc(F)ccc3OCc3ccccn3)cc2)CCOCC1 592987396 RJYFCPWJJZFMFV-UHFFFAOYSA-N 388.442 5.038 30 20 GKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(OCc2cccnc2)cc1 594925169 LVNBJHMJDDYMKD-IBGZPJMESA-N 383.495 5.067 30 20 GKED N#CC[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)c2cccc3ccccc23)C1 596297600 RTRIUOMLQVBMNS-NTKDMRAZSA-N 383.495 5.264 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)C1 596651496 UYNYQMCJUKXLDK-HNNXBMFYSA-N 376.485 5.121 30 20 GKED Cc1ccc(CCC2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2)cc1 603656321 KXHNNNIRZNRCPX-UHFFFAOYSA-N 389.543 5.673 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H](c3ccccc3)C3CC3)cn2)c1 603692547 KMCXKKPYXPICFJ-JOCHJYFZSA-N 384.439 5.018 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nnc(-c2cccs2)n1-c1ccccc1 603990778 ORSQUTFKPXYENP-GOSISDBHSA-N 388.521 5.223 30 20 GKED C=CCCCCCN(C)C(=O)NCCc1ccc(-c2csc(C)n2)s1 606968342 TUBXFDQKAXFLOM-UHFFFAOYSA-N 377.579 5.110 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl 609501917 JDUFWIRZSRNNKF-HUUCEWRRSA-N 389.282 5.394 30 20 GKED N#C[C@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1ccc(F)cc1 609600599 OSNAIUJXZUOBGH-KRWDZBQOSA-N 384.863 5.105 30 20 GKED C=CCCC(C)(C)NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 620864130 RGELWOOMCIMHLA-UHFFFAOYSA-N 376.909 5.128 30 20 GKED CN(C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1cccc(OC(F)(F)F)c1 622353385 LSDQDYQGSGVBET-UHFFFAOYSA-N 399.237 5.159 30 20 GKED Fc1cc(C(F)(F)F)c(F)cc1CNc1ccc2c(cnn2C(F)F)c1 685199255 FTJRHZJVIXXSFP-UHFFFAOYSA-N 377.263 5.341 30 20 GKED CN(CC#N)Cn1nc(-c2ccc(C(C)(C)C)cc2)n(C2CCCCC2)c1=S 725772868 ZXWIOMWPZNGTPR-UHFFFAOYSA-N 397.592 5.297 30 20 GKED C#Cc1cccc(N(C(=O)c2csc(-c3ccc(OCC)cc3)n2)C(C)C)c1 728247781 QWGRGZOSZHNDGZ-UHFFFAOYSA-N 390.508 5.245 30 20 GKED N#CCOc1ccc(CC(=O)N(c2ccccc2)c2nc3ccccc3s2)cc1 731962780 AVRLIZDXWRTXEI-UHFFFAOYSA-N 399.475 5.106 30 20 GKED C=CC1CCN(C(=O)c2cc(-c3nc4ccccc4s3)nc3ccccc23)CC1 732003421 XYPFLGMRSRSUTI-UHFFFAOYSA-N 399.519 5.550 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)OC(=O)[C@@H](C)Oc1ccc(C#N)cc1 733070409 CSEHGKLEHUFKMO-JKSUJKDBSA-N 392.480 5.062 30 20 GKED COc1cc(/C=C\C(=O)c2cncc(F)c2)ccc1OCc1ccc(Cl)cc1 737446631 YVQZFRUIMGHDLT-YWEYNIOJSA-N 397.833 5.358 30 20 GKED O=C(/C=C/c1cc(Cl)ccc1OC(F)F)c1c(Cl)nc2sccn12 741847069 FRYKLWQCFGIMCI-HNQUOIGGSA-N 389.210 5.200 30 20 GKED C/C(=C/C(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 742068373 MMVDZWYVWZVAMT-LUJNMSEFSA-N 378.781 5.143 30 20 GKED O=C(/C=C/C1CC1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 744009982 BFUGWXBMCKPXGS-VAWYXSNFSA-N 376.506 5.573 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 744766379 PIJHHMOCAVXKPR-VWLOTQADSA-N 395.506 5.605 30 20 GKED CC(=NN=C(CCSc1ccccc1)c1ccc(F)cc1)c1cnccn1 745204146 UTVSPSOMQXHVJL-UHFFFAOYSA-N 378.476 5.011 30 20 GKED N#Cc1ccc(CN(C(=S)Nc2ccccc2-c2ccccc2)C2CC2)cc1 751008100 SRDNTBYGUXJCIJ-UHFFFAOYSA-N 383.520 5.587 30 20 GKED N#C[C@H](C(=O)CCCCc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1 753531045 DPPMJVGTTFOIJB-MRXNPFEDSA-N 389.282 5.054 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)OCC2CCC(C#N)CC2)c(Cl)c1 755963968 LRJDIBJTEZMKJZ-UHFFFAOYSA-N 392.883 5.174 30 20 GKED N#C[C@H](C(=O)CCCc1cc(Cl)sc1Cl)c1ccc2ccccc2n1 756225752 MHTJWDVPNFEDJZ-AWEZNQCLSA-N 389.307 5.802 30 20 GKED CCOC(=O)/C(=C\c1cccc(OCCCC#N)c1)c1nc(C(C)C)c(C)s1 763292522 PFMZWCIRJLSVJX-RGEXLXHISA-N 398.528 5.361 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2nc(-c3ccccc3)co2)cc1 767108589 IVBKETQFJYFWTI-QGZVFWFLSA-N 391.496 5.078 30 20 GKED CCO[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 770180534 TYVIQDYQIDZEFH-BJKOFHAPSA-N 399.494 5.241 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CC=C(c2ccc(Cl)nc2)CC1 773247881 NRBVXUGKLWKZAY-UHFFFAOYSA-N 381.266 5.102 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(F)c2F)ccc1OCC(F)(F)F 776268523 RPWJYMCVGPHVMG-SOFGYWHQSA-N 386.316 5.201 30 20 GKED C=CCOc1ccccc1CN[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21 779059471 XMVIQIWMQHTBBC-NRFANRHFSA-N 394.515 5.376 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1ccc(CSc2nc(C)cs2)cc1 779147521 ZCQVGVAKGNCZSY-UHFFFAOYSA-N 398.553 5.208 30 20 GKED CC(C)c1ccc(C2(C(=O)Nc3ccccc3O[C@H](C)C#N)CCCC2)cc1 780154704 YMAXOPATABGUFU-GOSISDBHSA-N 376.500 5.551 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 780576120 JBQGXDQFAQKFGJ-LLVKDONJSA-N 399.319 5.276 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(F)cc1OC1CCCC1 780599915 MZYXIRXRNBFMAV-AWEZNQCLSA-N 383.423 5.082 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(C(F)F)c3)n2)cc1 790766529 CAVZIJYPCLZSDA-QGZVFWFLSA-N 393.418 5.038 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)n2)cc1 796890228 SYJRGAHGMZGDFB-GSEOLPGOSA-N 389.524 5.465 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1sccc1SC(F)F 804558750 JMCBVQIFGCABDB-UHFFFAOYSA-N 385.505 5.059 30 20 GKED C=CC[C@H](NC(=O)N(CC(C)C)[C@H](C)c1ccccc1Cl)c1ccncc1 806820201 UMXSADCGZUZJPR-UTKZUKDTSA-N 385.939 5.781 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(N4CCCCC4)cc3)cc2)ccn1 810166589 LLWNMDCRSZQSBX-UHFFFAOYSA-N 384.483 5.348 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 810532221 PLNDYFGZJSSIDO-INIZCTEOSA-N 386.929 5.643 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 813057637 OBPJMNIVPCAKPU-XMSQKQJNSA-N 378.859 5.168 30 20 GKED CC(=NNc1nc(C(F)(F)F)cs1)c1sc(-c2ccccc2)nc1C 814867438 DPFSAZGVDJNGFE-UHFFFAOYSA-N 382.436 5.430 30 20 GKED N#CC[C@H](CC(=O)O[C@@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 816066203 WDXWRUPZBYPEGQ-KDOFPFPSSA-N 388.345 5.062 30 20 GKED CS(=O)(=O)c1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)s1 840715114 OEDQEAMZNNBOIC-ZRDIBKRKSA-N 392.567 5.082 30 20 GKED C=CCN(Cc1ccccc1)Cn1nc(Nc2ccc(OC)cc2)sc1=S 914570568 QAOWXMPQDBKFGV-UHFFFAOYSA-N 398.557 5.072 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(Cl)cc2)cc1 915085618 DDXBJFHJNHUTLI-OAQYLSRUSA-N 376.843 5.013 30 20 GKED C/C(=C/C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1)C1CC1 916845466 XVSZWOWODMTFGF-SEYXRHQNSA-N 390.533 5.963 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3ccccc3s2)cc1 916914533 MXRYHEHZWDWQSG-SFHVURJKSA-N 376.481 5.205 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)cc1 916915503 KPGBMUVFVWOXDB-SFHVURJKSA-N 394.858 5.390 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2ccc(Cl)cc2Cl)SC1=S 917644633 JPALFGZVOFOQOF-VIZOYTHASA-N 391.304 5.271 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 918486846 GOWHZENYHDLPGP-FQEVSTJZSA-N 394.540 5.026 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc(CCC(F)(F)F)s1 932305676 FPVHSMXASJPHNV-LLVKDONJSA-N 399.463 5.142 30 20 GKED C[C@@H]1C(=NNc2c(Cl)cc(Cl)cc2Cl)CC[C@@H](C(=O)O)C1(C)C 1776014722 TWYNTSUGBCLQKQ-SCZZXKLOSA-N 377.699 5.572 30 20 GKED C[C@@H]1/C(=C\c2cccc(C(=O)O)c2Cl)C(=O)c2cccc(Br)c21 1776587103 QEGYLAQDSMBOAX-TVNQGELYSA-N 391.648 5.184 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2cccc(C(=O)O)c2)s1 1777559784 AJJZDDHFEOAZTO-PKNBQFBNSA-N 388.444 6.064 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2Cl)cc1)C(=O)Nc1ccccc1C#N 22016853 LFEOJUKFIWGULG-HNNXBMFYSA-N 391.858 5.443 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)sc1C 41549267 IZFPSNBLGNJNRY-LLVKDONJSA-N 380.416 5.484 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cc2ccccc2[nH]1 58643685 XQWDJPDSEXEMRZ-UHFFFAOYSA-N 396.450 5.462 30 20 GKED C=CCN(C(=O)c1ccc(Cl)nc1Cl)c1nc(-c2ccccc2)cs1 64363930 SHNZYPBBSSIHDY-UHFFFAOYSA-N 390.295 5.345 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1 65473308 XGMXVLOSFFSKAM-OAQYLSRUSA-N 393.487 5.113 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccnc1SC(F)(F)F 108241056 ZRGJXKCKJJASQD-LLVKDONJSA-N 397.447 5.198 30 20 GKED COc1cc(Cl)ccc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 109274962 SVVBBWYAOFNVGY-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)[nH]c(C)c1C(C)=O 120060885 WZBXNPNWSLAYSY-AWEZNQCLSA-N 399.903 5.231 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cc(Cl)cs3)n2)cc1 131115685 DMXVIOLNNAGTMQ-MRXNPFEDSA-N 397.912 5.206 30 20 GKED N#C[C@H](NC(=O)c1ccccc1Oc1cccnc1)c1cccc(Cl)c1Cl 157894076 MCTINTMDYXFVIV-KRWDZBQOSA-N 398.249 5.175 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)c1ccc(F)cc1 170986135 WCBLYLQITSIGNP-GJZGRUSLSA-N 388.533 5.510 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2c(F)cccc2F)cc1 171357464 MNMNFVBDGZGSMD-UHFFFAOYSA-N 395.384 5.210 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N(C)Cc1cccc(C#N)c1 175005810 FVFCOTQAKUEKLZ-UHFFFAOYSA-N 385.467 5.110 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1sc(-c2cccnc2)nc1C)c1ccc(F)c(F)c1 186452087 XYTAPNFYOGXTFO-ORAYPTAESA-N 385.483 5.760 30 20 GKED CN(CCC#N)c1ccc(CN[C@@H](Cc2ccccc2)c2ccccc2F)cc1 237208162 LCQYPDOOXJKGGE-VWLOTQADSA-N 387.502 5.249 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1cc(Br)ccc1F 255606755 BAJHVFLPGRHASV-BAQGIRSFSA-N 399.219 5.067 30 20 GKED C[C@@H]1CC[C@H](c2ccccc2)N(C(O)=Nc2nc(C3CCOCC3)cs2)C1 329460469 SCIZEFGJWCNTDF-DNVCBOLYSA-N 385.533 5.056 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2CCCC[C@@H]2Cc2ccccc2)CC1)C1CC1 330030992 SKGRLSQYQJGZPG-JYAXOCDNSA-N 382.548 5.670 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1cccc(C(F)(F)F)c1F 429931110 VSOOFPRBPRQFAI-UHFFFAOYSA-N 381.247 5.038 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(Br)c(F)c1)c1ccccc1 432974146 UEALYJCFJIQKSY-QGZVFWFLSA-N 390.256 5.145 30 20 GKED N#CCCC[C@H](NCc1c(F)ccc(Br)c1F)c1ccccc1 433022511 VUWXIBQWHDOFIR-KRWDZBQOSA-N 379.248 5.252 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(c2nc3ccccc3[nH]2)CC1)c1ccccc1 435096116 UWERBSLOGINFQQ-HXUWFJFHSA-N 388.515 5.159 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)Nc1ccc(O[C@H](C)c2ccccc2)cc1C 436364956 LVRUBUFEIKIMIN-RFWXGWTQSA-N 394.515 5.238 30 20 GKED CCCCOC1CCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CC1 437828192 KVOACDVTECXBEM-UHFFFAOYSA-N 393.487 5.164 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2Cl)c2ccc(F)cc2)cc1 439444922 BYBFEMKNIJOWED-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CCCCSc1nnc(SCc2ccc(C#N)cc2OC(F)F)s1 439543246 DGTHLMDPAIUFBT-UHFFFAOYSA-N 387.502 5.196 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 440251026 ANAXTWWRMXKZRZ-FCHUYYIVSA-N 381.495 5.079 30 20 GKED C=CCC[C@H](NC(=O)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 441593618 TVFJGEJVOCJYHV-IBGZPJMESA-N 390.405 5.101 30 20 GKED C[C@H]1COCC[C@H]1c1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 442686190 VBGDUNPCGVTWOQ-SCLBCKFNSA-N 395.846 5.194 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1[C@@H](C)C[C@@H](CC(F)(F)F)[C@H]1C 454748044 APBKPIPAAGLVGO-XQLPTFJDSA-N 399.482 5.664 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(OC2CCC2)cc1 463109679 ZMHRROJDXBBBFG-UHFFFAOYSA-N 399.450 5.238 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)Cc1cc(F)ccc1F 463758274 YILNOGDDYDAYLM-UHFFFAOYSA-N 394.396 5.060 30 20 GKED N#C[C@@H](NC(=O)C1CCC(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 463766904 KIIXJRXRDFZVSR-LBXVMSDZSA-N 386.417 5.360 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)N(C)c3cc(Cl)ccc3C#N)c12 464275466 YOYJVUJIMRIPJA-UHFFFAOYSA-N 394.862 5.025 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)Nc1ccc(C#N)c(F)c1 464645217 BPJZXXWDMHJBQX-UHFFFAOYSA-N 390.201 5.220 30 20 GKED C=C[C@](C)(CC)C(=O)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1 468010004 SIYHTHSJFYEAIH-LJQANCHMSA-N 392.286 5.182 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N2CCCC[C@H]2C)cc1C 468313911 ACYNWRMAFGROPK-GOSISDBHSA-N 383.561 5.655 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468879352 GEMZLZGKOXVFRP-JOCHJYFZSA-N 393.506 5.088 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1N1C[C@H]2CC[C@H]1C2 470140964 IQRKYHHGQJFYFP-SFTDATJTSA-N 375.516 5.286 30 20 GKED C[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)c(Cl)c1 471904472 DHYXZTUQTOOWON-OLZOCXBDSA-N 393.339 5.987 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 471904700 GKOSKHIWSAKUAD-CHWSQXEVSA-N 393.339 6.130 30 20 GKED C[C@@H](Nc1ccc(NC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)cc1)c1ccccc1 471947494 SAIYKSRLLQACAG-GCJKJVERSA-N 394.478 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Br)cc1OC 476149700 KWHFLNRPKLYTTD-UHFFFAOYSA-N 388.305 5.562 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(Cc2cccc(F)c2)CCC1 480585623 YVKUDOPDWLREDR-MRXNPFEDSA-N 397.519 5.507 30 20 GKED COc1ccc(Cl)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 483403509 BMQZZMOPTSPYKS-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C=CCN(Cc1csc(CC(=O)Nc2ccccc2C)n1)CC1CCCCC1 485053072 FZMKHBVFBCNDEY-UHFFFAOYSA-N 397.588 5.201 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](C)c1ccc2ncsc2c1)c1ccc(F)c(F)c1 486255717 KRBVXXHXRQUASU-BLVKFPJESA-N 387.455 5.252 30 20 GKED N#CCCn1cc(-c2csc(-c3ccnc(C(F)(F)F)c3)n2)c2ccccc21 487483395 HVBFBBKMXUEICI-UHFFFAOYSA-N 398.413 5.759 30 20 GKED C=CCOc1ccc(-c2nnc(S[C@@H](C)c3ccccc3[N+](=O)[O-])o2)cc1 489777213 MFMGTVDAGVRCSP-ZDUSSCGKSA-N 383.429 5.063 30 20 GKED Cc1nnc(Oc2ccc(-c3nc4ccccc4s3)cc2Cl)c(C#N)c1C 492181064 STLXOTOCUYUMCI-UHFFFAOYSA-N 392.871 5.688 30 20 GKED COc1ccccc1CCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 500733927 QUHSSQSZJXTPOB-UHFFFAOYSA-N 386.451 5.239 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 503471431 GYZYGPWBDFSUBH-OAQYLSRUSA-N 390.874 5.021 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc4ccccc4c4cccnc34)CC2)cc1 504014548 WKLAORATBVXRBA-UHFFFAOYSA-N 389.458 5.189 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)C[C@H](CC)c2ccccc2)cc1 504319154 VZSUPJWPKLXIBB-IBGZPJMESA-N 376.500 5.023 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 505926665 KIWKGAMCVXGHOL-QFIPXVFZSA-N 387.458 5.538 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@@H](C)Sc1nc(-c2ccccc2)ccc1C#N 510224543 WFIXSAJYPKXALZ-OAHLLOKOSA-N 391.471 5.187 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 513731032 QOMMROXELIZIOC-AVRDEDQJSA-N 378.472 5.130 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1nc(C(C)(C)C)cs1 517349033 JKFFQCVWZWECET-MRXNPFEDSA-N 398.576 5.241 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)cc1 518372195 GVXFRQLCPICINO-UHFFFAOYSA-N 386.426 5.055 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)s1 520827681 WBIGIDUPGIQMGL-CQSZACIVSA-N 396.512 6.058 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1nc2ccccc2s1 521657413 CTTUMNVICOFYJH-UHFFFAOYSA-N 397.503 5.334 30 20 GKED CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521712709 OUHWTCCZNOHKAX-HZPDHXFCSA-N 388.558 5.253 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(NC3CCCC3)c2)c1 524233993 MWACBFBECPTWAM-UHFFFAOYSA-N 377.488 5.101 30 20 GKED Cc1ccc2c(CCC(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)c[nH]c2c1 524793360 FGPKBHCVSQITTJ-AWEZNQCLSA-N 377.513 5.106 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N3[C@H]4CC[C@H]3CC3(C4)CC3(F)F)c2)cc1 529652356 JXDTXLYDQMRUQP-PMACEKPBSA-N 393.437 5.094 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)Cc3cccc(C#N)c3)s2)cc1 531152894 QHQWEIAILMQJRH-KRWDZBQOSA-N 389.524 5.061 30 20 GKED CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C#N)ccc1OCC 538531207 IJZWAMIWRLJJIG-UHFFFAOYSA-N 399.472 5.010 30 20 GKED CCC[C@]1(C(F)(F)F)CCCN1Cc1ccc(OC)c(OCCCC#N)c1 539859187 UPGRZAPMTUSGMO-LJQANCHMSA-N 384.442 5.075 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)Nc2cccc(C(F)F)c2)cc1 540226876 GLZRGVHTYFUQIP-UHFFFAOYSA-N 377.394 5.485 30 20 GKED Cc1ccc(-c2ccc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)s2)o1 541035918 HRVUKORLBHAAEX-QZTJIDSGSA-N 376.481 5.229 30 20 GKED CCSc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccn1 542650372 VPXUTISVIGLIPA-INIZCTEOSA-N 379.510 5.116 30 20 GKED C[C@@H](NC(=O)N1CCc2sccc2C1)c1ccc(-c2cccc(C#N)c2)cc1 543016035 DJFIWVNPMSXGKW-MRXNPFEDSA-N 387.508 5.116 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 543017936 QPTXLGGGXNRSOW-ZWKOTPCHSA-N 384.483 5.084 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-c4ccccc4)o3)n2)cc1 544154429 JXPFZWKSHCZKEK-SFHVURJKSA-N 395.443 5.432 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc2c(c1)oc1ccccc12 554146339 VEDMZZQSXCMOJK-UHFFFAOYSA-N 390.439 5.282 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)CC[C@H]1c1ccccc1 554204671 HPPSQXXYHFDASD-OPYAIIAOSA-N 393.556 5.943 30 20 GKED N#CCCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc(F)cc1 554283810 YAAFVNPGQZFYNE-UHFFFAOYSA-N 399.425 5.245 30 20 GKED N#Cc1ccc(CNCc2cc(Cl)ccc2OC(F)F)c(C(F)(F)F)c1 554972424 YCSXNDULARUUSB-UHFFFAOYSA-N 390.739 5.122 30 20 GKED C[C@H](NC(=O)C1(c2cccnc2)CCCC1)c1ccc(-c2cccc(C#N)c2)cc1 571200992 GBLMNBHDHBTHHZ-IBGZPJMESA-N 395.506 5.309 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccc(-c2ccccn2)cc1 571727852 APRIHTFSJSZLCW-UHFFFAOYSA-N 375.497 5.077 30 20 GKED C/C(=C/c1cccc(C(F)(F)F)c1)CN1CCC(C#N)(c2ccccn2)CC1 576432391 DEVTUYJXJNPLHM-LGMDPLHJSA-N 385.433 5.061 30 20 GKED COc1cc([C@H](C)N[C@@H]2CCc3ccc(C#N)cc32)ccc1OC1CCCC1 581518268 UFIZHJUAEPYFMW-KSFYIVLOSA-N 376.500 5.226 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(F)c(Br)c1 595015655 SMAGJDNAOHYBLA-CQSZACIVSA-N 391.284 5.047 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 600848786 KEPNSLLKHJRJTK-UHFFFAOYSA-N 393.796 5.191 30 20 GKED C=CCOc1ccc(CNC2CCN([C@@H](C)c3ccccc3)CC2)cc1Cl 604769946 OKUZRBPIKGXEBR-SFHVURJKSA-N 384.951 5.220 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)c1cccc(F)c1F 607535537 MBWPISPJQXNEPI-UHFFFAOYSA-N 397.315 5.593 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)c12 609176517 NZJIULFJMJVXTG-UHFFFAOYSA-N 381.435 5.322 30 20 GKED CCC1(C)CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 609207022 DSYJYTYTLQPQHX-UHFFFAOYSA-N 391.515 5.376 30 20 GKED C[C@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1cccc(C#N)c1 610359627 NJAQJXTXCBIYKZ-AWEZNQCLSA-N 397.906 5.077 30 20 GKED CN(CCOC(C)(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 610876028 OXNRHDSTVUQFNS-IBGZPJMESA-N 399.922 5.274 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(NC(=O)c2ccccc2)c1 614179831 OFNZSMRXEHUJHA-LJQANCHMSA-N 397.522 5.591 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(Br)ccc1C 615511223 DTCOYJMEWNKJKQ-UHFFFAOYSA-N 377.257 5.117 30 20 GKED COc1cccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(C)cc4)cs3)oc12 642281258 UAEXZSPCWMCXAR-INIZCTEOSA-N 388.448 5.363 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)C[C@@H]1CCCO[C@@H]1c1ccccc1 669727567 OAZDVXPKERZZRV-JTHBVZDNSA-N 378.516 5.437 30 20 GKED CC[C@@H](C)Oc1ccccc1/C=C/C(=O)Nc1ccccc1SCCC#N 730981961 FTVOCZHFCJGITK-TUQDCPSNSA-N 380.513 5.522 30 20 GKED C=CC[C@H](NCc1ccc(OCc2ccc(F)cc2)c(OC)c1)c1ccncc1 734509654 NWGHNAKHWZQVRQ-QFIPXVFZSA-N 392.474 5.215 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccncc1 734679515 HWTUYHGQTLCKCI-YLJYHZDGSA-N 395.553 5.179 30 20 GKED N#C[C@@H](C(=O)CC/C=C/c1ccccc1)C(=O)Nc1cc(Cl)cc(Cl)c1 739156418 WZOLSPPQVXXOJG-PYJQOMOHSA-N 387.266 5.134 30 20 GKED Cc1ccc([C@@H](C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 742542045 CGUIQMXMGYYJCD-BEFAXECRSA-N 378.859 5.639 30 20 GKED CC[C@@H](C(=O)Oc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(C)noc1C 748688508 ZIZCJOOPYPPDKV-HXUWFJFHSA-N 376.412 5.055 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(C2SCCS2)cc1 752038199 GFPDBMHFFQNSMU-PMACEKPBSA-N 394.565 5.077 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2csc(Cl)c2Cl)SC1=S 760989632 NJTXCONMLSANLS-VZUCSPMQSA-N 397.333 5.332 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N(CCC#N)c3ccc(C)cc3)cc2)cc1 761151300 ZCEGETBESHMJQV-UHFFFAOYSA-N 398.462 5.550 30 20 GKED C=CC[C@@H](N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccncc1 766020033 OGXFRUPTLSNADH-MGPUTAFESA-N 379.529 5.490 30 20 GKED Cc1cc2c(cc1C)[C@H](C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CO2 769862678 OWHDYWGHSAQQDS-DHIUTWEWSA-N 382.463 5.074 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(CN3CCc4ccccc43)cc2)cc1 770541925 IXLFLOPTNKQMRX-IBGZPJMESA-N 383.495 5.152 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)cc1 772421698 GEPNUFWNSKSQDQ-ZKGSSEMHSA-N 393.490 5.192 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc3c(c2)CCC(=O)N3C)cc1 774131952 UDZWRILMXHMJKF-NVNXTCNLSA-N 397.474 5.167 30 20 GKED C[C@@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)c(F)c1 777552244 BXAKAMVVXVSTMS-CQSZACIVSA-N 383.442 5.528 30 20 GKED Cc1csc([C@@H](C#N)C(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)n1 779189454 RDEWVAUKLVGQMH-INIZCTEOSA-N 392.446 5.549 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 796463866 WAZWKHRAFWESBC-UHFFFAOYSA-N 386.517 5.090 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)ccc2c1 797571330 QLZYMVQWZRWPKY-ZAOIQFLMSA-N 390.508 5.492 30 20 GKED Cc1ccc2snc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2c1 815010405 LFBJWSGMRWVZCM-HXUWFJFHSA-N 383.476 5.513 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1NCc1ccc(C#N)cc1C(F)(F)F 816601702 PZKMHGBHOMMPMG-UHFFFAOYSA-N 391.393 5.536 30 20 GKED C[C@@H](CC(C)(C)C#N)OC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 851202751 LNFPETRXCNNKRC-ZDUSSCGKSA-N 394.899 5.101 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)sc2Cl)cc1 915087240 QWVZLQSNMAYTRV-MRXNPFEDSA-N 387.291 5.963 30 20 GKED COc1ccc(/C=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1OC 915179339 CFYVDUKGDYMVPK-JBOCTPFWSA-N 398.462 5.011 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCSc3ccccc32)cc1 915350528 XPJAPCSMGPPMNP-VXKWHMMOSA-N 399.519 5.701 30 20 GKED O=C(/C=C\c1csc([N+](=O)[O-])c1)c1ccc2ccccc2c1OC(F)F 917144569 GULKONNYCQRNQU-YVMONPNESA-N 375.352 5.307 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCOc2ccccc2F)cc1 918323041 RDWNWDCKSVNQGK-NRFANRHFSA-N 388.442 5.279 30 20 GKED CCCC(=NNc1cccc(C(=O)O)c1C)c1ccc(Oc2ccccc2)cc1 1776087855 BCBRBHBTOTXKPI-UHFFFAOYSA-N 388.467 6.102 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776119735 KFVCHUYKJKXSSP-ACCUITESSA-N 390.504 6.307 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3ccccc3Cl)o2)c1)C(=O)O 1776470902 LPFGBHWPCMMZGU-CFRMROPGSA-N 396.826 5.348 30 20 GKED CSc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1F 1777403149 BMLSVILKGYLAIT-HWKANZROSA-N 390.432 5.496 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(C(=O)Nc3ccccc3)CC2)cc1 14855861 MGGFKUPGYFPFRJ-UHFFFAOYSA-N 395.506 5.076 30 20 GKED N#C[C@@H](C(=O)c1sccc1-c1ccccc1)c1nc2ccccc2n1C(F)F 41559639 YZSITRVJYLPDHL-HNNXBMFYSA-N 393.418 5.650 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1 44847261 VTKIGOADSCRGCN-NRFANRHFSA-N 398.462 5.035 30 20 GKED C=CCN(C(=O)C[C@@H](C)c1ccc(F)cc1)c1nc(-c2ccccc2)cs1 59850979 ABEOUKCRZZUQQM-MRXNPFEDSA-N 380.488 5.662 30 20 GKED C=CCOc1cccc(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)c1 65749449 YRUGMBBEDJAPCB-UHFFFAOYSA-N 392.402 5.441 30 20 GKED CSC[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67001711 VSPDCYGDPKNVNO-CABZTGNLSA-N 385.341 5.292 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccnc1SC(F)(F)F 108241059 ZRGJXKCKJJASQD-NSHDSACASA-N 397.447 5.198 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1ccc(SC(F)F)cc1 108352214 BTWPJYHETYIALG-UHFFFAOYSA-N 393.484 5.058 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2SCCC#N)c(Br)c1 118968010 RDOOGKXXCOODQM-UHFFFAOYSA-N 375.291 5.016 30 20 GKED N#C[C@@H](C(=O)c1ccn(C2CCCC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 121696506 LQKCNYLAYQNTQU-INIZCTEOSA-N 396.903 5.265 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(F)cc2Cl)cc1OCCCC#N 130334009 SPNWVINVUKNVPW-AWEZNQCLSA-N 376.859 5.021 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1N1CCCC1 153819955 WHWJLPUXDINMGR-UHFFFAOYSA-N 375.925 5.222 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1 159480913 CWFGTPNRROCCFA-HHHXNRCGSA-N 384.545 5.205 30 20 GKED Cc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)ccc1Oc1cccnc1 171259504 XYQZUWLEYHEBED-UHFFFAOYSA-N 398.466 5.251 30 20 GKED C[C@H](Nc1cccc(OCc2cccc(C#N)c2)c1)c1ncc(C(C)(C)C)o1 177425295 YKBNAKZXQYJOFD-INIZCTEOSA-N 375.472 5.596 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)C(=O)c1cccc(F)c1 177603705 WKNLSMYOEIKKNI-KBXCAEBGSA-N 392.455 5.035 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@H](C)c2ccc(C(F)(F)F)cc2)n1 177768608 WPHUIRKBZDOUFX-WFASDCNBSA-N 380.435 5.655 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)NCCCCC#N 178641893 ZVJFOZWTRHSSKJ-GFCCVEGCSA-N 378.339 5.226 30 20 GKED C=CCC[C@H](NCc1csc(CC(=O)Nc2ccccc2)n1)c1ccccc1 180042736 RJHQUHHMYGPCQB-NRFANRHFSA-N 391.540 5.121 30 20 GKED Cc1csc([C@H](C)CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 184578572 MLVSPJNJTLQIET-CQSZACIVSA-N 392.484 5.041 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccccc1 188853543 SVUKKZRSEBTPOZ-JOCHJYFZSA-N 391.515 5.393 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 264587599 ZQPPHGGZCDYWQM-OXQOHEQNSA-N 395.528 5.316 30 20 GKED CC(C)c1ccc(SCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 303342422 YWRSBQWXPUETFS-MRXNPFEDSA-N 384.570 5.935 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 303571252 BNKAPUQBDSSXOR-UHFFFAOYSA-N 376.843 5.351 30 20 GKED O/C(=N/C[C@@H]1CCOc2ccccc21)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329354874 GNNCDPVKWGSHBE-OALUTQOASA-N 393.531 5.016 30 20 GKED Cc1c(Cl)cccc1N=C(O)[C@H](C)N[C@H]1c2ccccc2CC12CCOCC2 329778796 LKHOUVAFNGPHPS-KKSFZXQISA-N 398.934 5.309 30 20 GKED N#Cc1ccc(Cl)cc1N1CCC[C@@H](c2n[nH]cc2N=C(O)C2CCCC2)C1 330058172 YOMVPOAUUOSKTG-MRXNPFEDSA-N 397.910 5.097 30 20 GKED Cc1sc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1Br 424667716 VSRCONRGMRUOTO-SNVBAGLBSA-N 395.347 5.323 30 20 GKED Cc1ccc2c(c1)CN(C(=O)Nc1cccc(COc3ccc(CC#N)cc3)c1)C2 431878868 CUFIIPHBZDBVBK-UHFFFAOYSA-N 397.478 5.188 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CC[C@H](c2cccc(F)c2)C1 432095637 QMKKWQLXHOPTLC-HHXXYDBFSA-N 397.519 5.535 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1cc(C(F)(F)F)ccc1Br 432738265 QBMYDHGIVYSCEP-UHFFFAOYSA-N 391.231 5.060 30 20 GKED CN(C(=O)c1c(F)c(F)cc(F)c1F)c1ccc(C(F)(F)F)cc1Cl 439125991 YLHOWWQKPZNMJU-UHFFFAOYSA-N 385.666 5.192 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1Cl)c1ccccc1 439399804 YOPYYGHESGAGSR-OAHLLOKOSA-N 381.785 5.525 30 20 GKED Cc1ccccc1CCCSCC(=O)Nc1ccccc1S[C@H](C)CC#N 439883759 QHRVZHWXOPEVPV-GOSISDBHSA-N 398.597 5.694 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(C[S@](=O)C(C)(C)C)c2)CCCC1(C)C 444903956 ZIZKQGLMLHHJOG-PPHZAIPVSA-N 390.593 5.332 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1ccccc1Cl 453469916 YTCRJKOYCBSZBQ-RBUKOAKNSA-N 386.927 5.091 30 20 GKED COc1cccc([C@@H]2C[C@@H](C)CN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458799704 JTSYJDDNHILJAL-YSZBQJHXSA-N 391.515 5.223 30 20 GKED C=CCn1c(SC[C@@H]2C[C@H]2c2ccccc2)nnc1-c1ccccc1OC 460877800 GICNDGSRNSNBTQ-HKUYNNGSSA-N 377.513 5.036 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1C 464424470 XLUBHOMAQWHLQH-MRXNPFEDSA-N 384.357 5.467 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3cnccc23)cc1Cl 465031836 LOLMVZMAEVRKEE-JOCHJYFZSA-N 397.865 5.796 30 20 GKED COC(C)(C)C[C@@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 466104273 FRMZDZMPKSABRC-BEFAXECRSA-N 399.922 5.321 30 20 GKED CC#CCCCC(=O)Nc1ccc(C)c(Oc2ncccc2Br)c1 468623762 ZNPMUPLERJYDTK-UHFFFAOYSA-N 387.277 5.077 30 20 GKED C=CCN(C(=O)c1ccc(CC)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 471367203 SVJVKHQUVRRDIR-UHFFFAOYSA-N 393.468 5.114 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C)Oc1ccc(OC)cc1 475571557 VRXXVTSSGPLVAA-KRWDZBQOSA-N 382.504 5.136 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(C)c(NC(=O)N2CCCC[C@@H]2C=C)c1 485571710 RTEOFRKQAQZTQX-UXHICEINSA-N 396.535 5.140 30 20 GKED C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 486432527 KVFIBHPMOGPPKY-VIFPVBQESA-N 379.275 5.354 30 20 GKED CN(Cc1ccccc1C(C)(C)C#N)[C@@H](c1ccc(Cl)cc1)c1cnccn1 486784530 ZAUHYVDVGORYSO-QFIPXVFZSA-N 390.918 5.153 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1ccccc1 487517334 TYHUSGXEULUHBB-GOSISDBHSA-N 397.450 5.253 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 488797883 JVSCZIAMAVGHFS-LJQANCHMSA-N 397.906 5.473 30 20 GKED Cn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1cccc(Cl)c1 489816598 KHTMSGRMPVGORB-UHFFFAOYSA-N 382.920 5.229 30 20 GKED Cc1ccc(NC2CCC(C#N)(c3ccccc3)CC2)cc1C(=O)N(C)C(C)C 494493416 JVNGNJMLANIXKO-UHFFFAOYSA-N 389.543 5.292 30 20 GKED N#CCc1ccc(CN[C@@H](CC2CC2)c2cc(F)cc(Br)c2)cc1 495258561 CSKRCCSBXWYPNJ-FQEVSTJZSA-N 387.296 5.285 30 20 GKED CCN(C(=O)c1cc(Cl)ccc1Br)[C@@H](C)c1ccc(C#N)cc1 498140232 ATGWRYWXAWIBCE-LBPRGKRZSA-N 391.696 5.197 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1c(F)cccc1Cl 499071825 NCKMMEYWHDTLGJ-UHFFFAOYSA-N 396.874 5.432 30 20 GKED Cc1ccc(OCc2nc3ccccc3n2CCCC2(C#N)CCOCC2)cc1 499914335 SRLBVHRUHQRDKL-UHFFFAOYSA-N 389.499 5.024 30 20 GKED COCCSc1ccc([C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 509541380 KULJPNDNSWCUBD-MRXNPFEDSA-N 397.544 5.109 30 20 GKED COc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc(OC)c1C(C)C 511027995 MAVRKCKWPHYFDI-OAHLLOKOSA-N 398.528 5.474 30 20 GKED CC(C)Oc1ccccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 512350344 MHHSHNKFCFWYOV-UHFFFAOYSA-N 386.451 5.177 30 20 GKED C=CCC[C@@H](NCc1cnc([C@H]2CCCO2)s1)c1ccc(C(F)(F)F)cc1 535184979 ITCXOEBZGAPHII-QZTJIDSGSA-N 396.478 5.811 30 20 GKED N#CC1(CCCNc2c(Cl)cc(Br)cc2Cl)CCOCC1 539710074 FYZXJQJGEILXCY-UHFFFAOYSA-N 392.124 5.268 30 20 GKED N#Cc1ccc(CN(C(=O)CCc2cccc(OC3CCCC3)c2)C2CC2)cc1 542297235 WQXMGQFCBGWYHJ-UHFFFAOYSA-N 388.511 5.003 30 20 GKED COCCCCc1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 544605732 VBZTUYSTGUQRRU-UHFFFAOYSA-N 383.835 5.023 30 20 GKED Cc1c(NC(=O)c2cn(CCCC#N)c3ccccc23)cccc1-c1ncco1 552568217 ILCJZKWQIAHWTA-UHFFFAOYSA-N 384.439 5.161 30 20 GKED CCCN(CCC(=O)Nc1ccccc1C#N)[C@H](C)c1cc2ccccc2o1 557217655 CDCFJEOAJNSZLQ-QGZVFWFLSA-N 375.472 5.106 30 20 GKED N#CC[C@H](Cc1nc(-c2cc(F)ccc2C(F)(F)F)no1)c1ccccc1 558301555 LJOFGTMQAQLEBR-CYBMUJFWSA-N 375.325 5.134 30 20 GKED C[C@@H](NC(=O)NCC(C)(C)C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 558710964 DOGDIYQNLJZRLB-CQSZACIVSA-N 389.421 5.174 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1 561240215 JUICMGRYALHNQF-IBGZPJMESA-N 395.547 5.011 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@H](O)Cc1ccccc1C(F)(F)F 582356004 POIVBUITHMQIQT-GDBMZVCRSA-N 394.462 5.115 30 20 GKED Cc1sc(CNCc2ccc(C3(C#N)CC3)cc2)nc1-c1ccc(Cl)cc1 594919222 GEYYOQOWCMAKQL-UHFFFAOYSA-N 393.943 5.617 30 20 GKED Cc1cc(Cl)cc(C)c1Oc1ccc(Cl)cc1NC(=O)CSCC#N 603616253 DRMZCDMDSBETGS-UHFFFAOYSA-N 395.311 5.598 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)o1 603624273 YDIVIRLUZNIIMB-YWZLYKJASA-N 387.439 5.033 30 20 GKED C[C@H](CC(=O)Nc1sc2c(c1C#N)CCC2)c1cccc(C(F)(F)F)c1 609965632 CIEFBKPQJUVRES-LLVKDONJSA-N 378.419 5.260 30 20 GKED C[C@@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(C#N)c1 610343402 FTFWAJHXUZAJST-VXGBXAGGSA-N 386.339 6.008 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1)c1cccc(C#N)c1 610355457 REGSCSGJFVLVMF-RTBURBONSA-N 383.495 5.689 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(C#N)cc1F 611586385 QHLVHXLHEJZRAB-DLOVCJGASA-N 382.323 5.257 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)c(C(F)(F)F)c1 612303392 GDTZAASBMMTUHI-FZKQIMNGSA-N 399.482 5.754 30 20 GKED CC(C)Oc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 612894725 LGYRJXQCQIXTLQ-SFHVURJKSA-N 396.899 5.741 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cnn1-c1cccc(F)c1 680169872 QRCKBARYSMDYHH-IBGZPJMESA-N 398.441 5.002 30 20 GKED CCCCCCCCCC(=O)N1CCC(C(=O)Nc2ccc(F)cc2)CC1 726151831 KBDIBIDXAUOUGL-UHFFFAOYSA-N 376.516 5.144 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C\c1ccccc1OC(F)(F)F 731014785 KHPMGOASYLKAKH-KHPPLWFESA-N 392.402 5.243 30 20 GKED CCOC(=O)c1ccc(NC(=S)Nc2ccccc2S[C@H](C)CC#N)cc1 731322393 YQFDWKAZGFTIJC-CQSZACIVSA-N 399.541 5.066 30 20 GKED Oc1cccc(C=Nc2ccc(Oc3ccc(C(F)(F)F)cn3)c(F)c2)c1O 733205026 IBUWHBFFSRUALK-UHFFFAOYSA-N 392.308 5.194 30 20 GKED COc1cc(/C=C/C(=O)c2sccc2Br)c(SC)cc1OC 741165549 NZDQWYWFCFRQEP-SNAWJCMRSA-N 399.331 5.146 30 20 GKED Cc1ccc(NN=C(CCSc2ccc(F)cc2)c2ccc(F)cc2)nn1 741464131 MOOHWFNXFNVQNT-UHFFFAOYSA-N 384.455 5.062 30 20 GKED CCCCn1nc(C)c(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c1Cl 741473474 QMHXSVOTIUTQBF-CMDGGOBGSA-N 379.891 5.603 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2nc(C(C)C)ncc2Cl)s1 743621995 JULGVAVQTAKOCW-UHFFFAOYSA-N 395.960 5.260 30 20 GKED CC(C)[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 744034231 DHXXISPDMNRVLE-QUCCMNQESA-N 394.927 6.080 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744035992 VCEVWKJAPUZHSX-MMTVNHQJSA-N 390.936 5.500 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)cc1OC 750911971 BDQHJWCMBSBDSX-YVMONPNESA-N 385.847 5.133 30 20 GKED Cc1cc(/C=C2/CSC/C(=C/c3cnc(Cl)c(C)c3)C2=O)cnc1Cl 760263652 OYVLBJSWWAQVEM-KNBRTIFXSA-N 391.323 5.183 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(Br)c(F)c2)c1 767736207 PNXLLJMZWWXBFP-TWGQIWQCSA-N 388.236 5.167 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(-c2ccccc2)cc1F 780479753 MBZMHUSOPXUBGO-OAHLLOKOSA-N 375.403 5.428 30 20 GKED CCCCCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780677425 JLDJTQYKPOTOHK-KRWDZBQOSA-N 383.467 5.341 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccccc1O[C@@H](C)C#N)c1ccc(Cl)cc1F 781911753 NUUVXWWOKDJXTK-DJJJIMSYSA-N 389.858 5.289 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1c[nH]c2ccccc12 786305545 GUSCVVTXDWVYLU-OXJNMPFZSA-N 395.462 5.162 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccncc2)cc1 788351197 VLBYNFHQXHPCFP-JXMROGBWSA-N 384.483 5.052 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cc1 788570318 DOYSMCKMEMQNDN-RJGXRXQPSA-N 385.442 5.159 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)CCc2cc(Br)ccc21 794956702 IWHNMPZFSQAOBE-RAXLEYEMSA-N 397.297 5.180 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570941 MDAXVNCWHRWNKS-GXTWGEPZSA-N 376.909 5.046 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1)c1ccc(C(F)(F)F)cc1 798827439 HGEYCERSCMNBHN-QMTHXVAHSA-N 392.377 5.434 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Cl)c(SC(=O)N(C)C)c1)c1ccccc1 805431830 KVCVQPYPUDGYNE-CQSZACIVSA-N 388.920 5.412 30 20 GKED Cc1cc(Cl)cc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c1O 808716466 XHGPNMIAPOQCIM-OAHLLOKOSA-N 397.906 5.110 30 20 GKED N#C[C@@H](C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1cc(C(F)(F)F)ccn1 813217703 NZAJLCKZHYJLSU-KGLIPLIRSA-N 386.295 5.013 30 20 GKED C[C@@H](N[C@@H]1c2cccc(Br)c2CC1(C)C)c1ccc(OCC#N)cc1 813885086 QCTPZTHHRHUPLP-JLTOFOAXSA-N 399.332 5.326 30 20 GKED Cc1c(C(=O)N[C@H](C)c2nc3ccc(Cl)cc3[nH]2)sc2ccc(C#N)cc12 815569860 KIBITTQZNVCOAW-LLVKDONJSA-N 394.887 5.102 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccc(C(F)F)nc2)cc1OC 853009422 KKHWZQPMYRKRCJ-DAXSKMNVSA-N 381.806 5.366 30 20 GKED Cc1cc(C#N)cc(C)c1Cc1nc(-c2ccc(Oc3ccccc3)nc2)no1 904448693 AKHFOSZOGKTMPI-UHFFFAOYSA-N 382.423 5.003 30 20 GKED CC(C)(c1ccc(C#N)cc1)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904450891 RBJDKYXXPQENIL-UHFFFAOYSA-N 382.423 5.121 30 20 GKED COc1ccc(Cl)cc1CC(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 915100392 PSILYKLPYVBXGB-QGZVFWFLSA-N 396.899 5.200 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2cn(CCC#N)nc2-c2ccccc2)cc1 917552192 OLVYFGNSWGLDHY-LJQANCHMSA-N 385.515 5.272 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)C=C3CCCC3)s2)c(C(F)(F)F)c1 917672560 HFFJABYDFCOGCS-UHFFFAOYSA-N 391.418 5.063 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)c(-c2ccncc2)n1 920066170 SWCXGYJXGOBOMM-FLIBITNWSA-N 389.524 5.413 30 20 GKED Cc1cc(COc2ccc(C=NNc3c(C)cccc3Cl)cc2)oc1C(=O)O 1776060791 OGAGPAIRTUIEDL-UHFFFAOYSA-N 398.846 5.273 30 20 GKED C=C(C)C[C@H](NCc1ccc(Cl)cc1Oc1ccc(Cl)c(F)c1)C(=O)O 1776137595 WLJOKKPSBIVOMX-KRWDZBQOSA-N 398.261 5.434 30 20 GKED CC(C)(C)COc1cccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)c1 1776250455 WFRRKIVPZKLQQU-ZROIWOOFSA-N 396.483 5.251 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cc1)C(=O)O 1776469810 NVGQIVPLCHOTHQ-LDCOFTPGSA-N 386.403 5.334 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)c(C)c1 1777353305 WJBFLVYYHQXBBA-JYRVWZFOSA-N 386.447 5.194 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3cc(C(=O)O)ccc3Br)coc12 1777449051 IRCTUZWKLODECK-SOFGYWHQSA-N 385.213 5.098 30 20 GKED O=C(O)CCOc1ccccc1/C=C/C(=O)c1ccc(C2CCCCC2)cc1 1777640966 IVGRNQRBICUZAE-CCEZHUSRSA-N 378.468 5.484 30 20 GKED C=CCSC1=N/C(=C\c2cccs2)C(=O)N1c1ccc(OC)c(Cl)c1 4882975 JDQDQXGYNMGYGH-PTNGSMBKSA-N 390.917 5.073 30 20 GKED C[C@@H](Sc1c(Cl)cccc1Cl)C(=O)N(CCC#N)c1ccccc1 14789288 FBOOUTXNOKEGQW-CYBMUJFWSA-N 379.312 5.421 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1cccc(OCCCC#N)c1 55569467 SSNPUVKJBRRODD-UHFFFAOYSA-N 377.469 5.053 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CSc2ccccc2)cc1 55823534 CZAIXNBPOXNYDX-UHFFFAOYSA-N 388.492 5.062 30 20 GKED Cc1noc(C)c1CCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 56036918 MLMCOHJFDGLQCH-UHFFFAOYSA-N 395.846 5.180 30 20 GKED COc1ccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)cc1Cl 59994054 ZTKOFGATIXWPHB-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1cc(Cl)ccc1Cl 66861393 DTNIBSUNVVFKIY-LBPRGKRZSA-N 394.327 5.438 30 20 GKED Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 66953581 WUMOLHCQYCGXQL-JOCHJYFZSA-N 386.455 5.058 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 102800642 CSJNWQOMUWFPJI-UHFFFAOYSA-N 379.357 5.159 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 108408312 SMCQIOVENIMFLI-MAUKXSAKSA-N 381.545 5.303 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](CCC#N)c1ccccc1 151446443 TXYVOQRZHFKSQJ-GOSISDBHSA-N 376.287 5.180 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Cc2ccc(Br)cc2)n1 162460945 SILSDLHQEXXOOJ-IUODEOHRSA-N 391.334 5.084 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-n2cc[nH]c2=S)cc1 170999614 LPSMLFFVPGLFCT-CQSZACIVSA-N 394.525 5.181 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 175119577 ICWBJBIUMFVBRF-UWVGGRQHSA-N 379.819 5.126 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)ccc1NC(=O)CC(C)C 177765293 NDLZSGZONIIXJY-MRXNPFEDSA-N 383.517 5.050 30 20 GKED CC(C)(CCC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 179224502 RQGHHNYIGMQHOT-INIZCTEOSA-N 381.426 5.366 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2ccc(OC)cc2)C1 191516821 MGPDCWMVSMUZHJ-HXUWFJFHSA-N 378.516 5.569 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccnc(C#N)c2)c(C(F)(F)F)c1 193506334 NHAJRBXOEOMGSZ-LLVKDONJSA-N 379.407 5.115 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1 272602769 XURPAKQGVAPXBL-UHFFFAOYSA-N 376.485 5.121 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C1(C)C 276373274 NXFTWQJEKYARCX-SWLSCSKDSA-N 385.455 5.133 30 20 GKED CC(=O)c1ccc(C#N)c(NCc2nc3c(s2)C[C@@H](c2ccccc2)CC3)c1 302192973 CJDCFEZSOFGXAU-SFHVURJKSA-N 387.508 5.102 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 303450264 JJMORSNUIGCSGR-MSOLQXFVSA-N 377.381 5.163 30 20 GKED OC1=NCCN(C(O)=Nc2ncc(C3CCCCC3)s2)[C@@H](c2ccccc2)C1 329484839 WYBYXXQHRYSPHB-QGZVFWFLSA-N 398.532 5.140 30 20 GKED CCC(=O)Nc1ccc(Cl)c(N/C(O)=N/C2CCC(C(F)(F)F)CC2)c1 330407405 GNAGYOBSQSFVCY-UHFFFAOYSA-N 391.821 5.136 30 20 GKED N#CCCCOc1cccc(CNCc2cc(Cl)cc(Br)c2)c1 414508746 YFJGUHVWOYYMIR-UHFFFAOYSA-N 393.712 5.075 30 20 GKED Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)N[C@@H]1CC[C@H](C#N)C1 425655530 RLMRWSDBUYGGAE-MAUKXSAKSA-N 383.879 5.041 30 20 GKED N#CCC1(CNC(=O)c2oc3ccccc3c2CSc2ccccc2F)CC1 431140575 SOODELQTCIMYDX-UHFFFAOYSA-N 394.471 5.288 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@@H](c1cc(F)ccc1F)C(F)F 432916151 NCRQTASTTODYTL-ZDUSSCGKSA-N 380.263 5.112 30 20 GKED C=CCc1cc(CNC(=O)Nc2c(Cl)ccc(C)c2C)cc(OC)c1OC 434494047 WNOIOVKKSDOHNT-UHFFFAOYSA-N 388.895 5.024 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1nc(C2CCCCC2)no1)c1ccccc1 435761351 FNWLQHWVMBAXDB-VQIMIIECSA-N 382.508 5.185 30 20 GKED COc1cc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)ccc1O 436980690 OOHLIKYVUTZUHY-LJQANCHMSA-N 393.512 5.049 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 438050196 CXPDEYSOAUVWTP-LMNJBCLMSA-N 384.545 5.002 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439376722 GMGGMRJVWJKSDN-NRFANRHFSA-N 381.545 5.803 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)N[C@H](CCC#N)c1ccccc1 440244143 RHKADPGXIFQZMQ-XMMPIXPASA-N 398.510 5.325 30 20 GKED Cc1c(Br)cccc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 442671196 KTIMJGSSNUAWIU-HNNXBMFYSA-N 397.297 5.371 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F 446362567 JHSRPIINWBURPV-GZMMTYOYSA-N 394.718 5.113 30 20 GKED CC(C)N(C(=O)c1cc(-c2cccc(C#N)c2)no1)c1ccc(F)cc1Cl 448216574 DPVOQPZKYPLMQK-UHFFFAOYSA-N 383.810 5.061 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2cccc(CC#N)c2)c1 456722173 CHZOABZQNJBQAP-UHFFFAOYSA-N 383.879 5.033 30 20 GKED N#CCCC[C@H](NC(=O)N1[C@H]2CC[C@@H]1C[C@H](c1ccccc1)C2)c1ccccc1 458840886 OCBXGKXSFHHKMX-KIHHCIJBSA-N 387.527 5.542 30 20 GKED FC(F)CSc1ccc(C(F)(F)F)cc1NCCOCC(F)(F)F 462243977 DQVWKVSPAQVQAC-UHFFFAOYSA-N 383.304 5.053 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1cccc(C#N)c1 463343276 DBPWTCMRAJKBJQ-SFHVURJKSA-N 397.453 5.214 30 20 GKED CC[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)c1ccc(Cl)s1 465921108 JTFWVYLASDUJQT-YESZJQIVSA-N 387.936 5.334 30 20 GKED C[C@@H](C#N)CN(C)C(=O)NCc1ccc(Oc2cccc(Cl)c2Cl)cc1 465963424 AZCYQTQKJTZSOQ-ZDUSSCGKSA-N 392.286 5.087 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 466434302 KFTBBWRYYQWVLR-VGSWGCGISA-N 378.541 5.837 30 20 GKED N#C[C@H](C(=O)c1cccc2cnccc12)c1nc(-c2ccc(Cl)cc2)cs1 466984463 ZZPRALNORPTLOT-GOSISDBHSA-N 389.867 5.502 30 20 GKED CC(C)C[C@H]1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 467715245 QPGYSYUVSQSQPO-GOSISDBHSA-N 395.478 5.176 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)C[C@H](CC#N)c2ccccc2)c1C 475032827 YFBPXFPWMMGWRY-FQEVSTJZSA-N 385.467 5.517 30 20 GKED C=C(C)[C@H](N[C@@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)c(F)c1 481604923 MZKQEUNHZYCZDR-LIRRHRJNSA-N 392.877 5.469 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483223394 BMOLSPUQFDKIIF-QFIPXVFZSA-N 377.447 5.493 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnn(-c4ccccc4C)c3)n2)cc1 483278603 WJXZEFXOPLZMHL-IBGZPJMESA-N 398.491 5.103 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N[C@H](C)c2cccc(Cl)c2)cc1 486119533 KVIUYHVIYGZHDH-MRXNPFEDSA-N 397.906 5.037 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3noc4c3CCCC4)cc2Cl)cc1 491022537 SGIHFZSBOUJZLN-UHFFFAOYSA-N 393.830 5.123 30 20 GKED N#Cc1ccc(Br)c(CN[C@@H](Cc2ccccc2)c2cccs2)c1 491612461 JMXFJSZYWYEREM-IBGZPJMESA-N 397.341 5.456 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Cc1cncc2ccccc12 497577735 HTSWSIKRCAFXAA-IAGOWNOFSA-N 389.524 5.446 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1ccc(NC(=O)C2CC2)cc1 505058070 PGEOACOBGRZOJC-MRXNPFEDSA-N 377.488 5.036 30 20 GKED N#C[C@@H](NC(=O)c1sccc1C1CC1)c1ccc(OCc2ccccc2)cc1 505355944 OULSVHVQFSQANG-OAQYLSRUSA-N 388.492 5.199 30 20 GKED CCCc1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508055142 UTXRROZYAGRDHD-HXUWFJFHSA-N 381.545 5.125 30 20 GKED Cc1nc(SCC(=O)N2CCCCC[C@H]2c2ccccc2)c(C#N)c(C)c1C 520016559 FOTXOTYOBWNXGR-NRFANRHFSA-N 393.556 5.115 30 20 GKED CCc1ccc(CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1 520941637 VKVJBHBGYMQLHP-QGZVFWFLSA-N 393.556 5.840 30 20 GKED CC[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccc(OC)cc1 521821030 UJPCFQDFJNHOII-RUZDIDTESA-N 386.495 5.387 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(Cl)c3O)cc2)cc1 522975547 DIOUFOZJAIUPGT-UHFFFAOYSA-N 378.815 5.156 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)CCc1ccccc1 524613842 JSYGXCKCFRLLOP-QZTJIDSGSA-N 398.597 5.631 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(C(=O)OC(C)(C)C)c1 536690274 QSMHNXMKVFIBDB-OAHLLOKOSA-N 396.512 5.146 30 20 GKED N#CCC[C@@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccccc1 536832647 KGROVZRHICCFGC-UXHICEINSA-N 391.515 5.961 30 20 GKED Cc1cccnc1[C@H](NC(=O)NCc1ccc(-c2ccccc2C#N)cc1)C(C)C 540266108 RQYXZQRGAIWAQI-HSZRJFAPSA-N 398.510 5.125 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2cnc3cnccc3c2)c1 543113339 SJWATDLGHZVLEQ-UHFFFAOYSA-N 398.853 5.002 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 543668039 LKEAABWJYWFWHL-VJBWXMMDSA-N 396.506 5.395 30 20 GKED N#CCCC[C@H](NC(=O)Cc1coc2ccc3ccccc3c12)c1ccccc1 554519110 RXPNFCRHVKYAHW-QFIPXVFZSA-N 382.463 5.680 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(F)c2ccccc12 554621248 ZXOBFJFXSMFBGL-MRXNPFEDSA-N 387.458 5.286 30 20 GKED COc1ccc([C@H](CCC#N)NCC[C@@H](c2ccccc2)C(F)(F)F)cc1 556221288 LPNVCBDRWQHRHH-PMACEKPBSA-N 376.422 5.366 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C4=CCCC4)cc3)n2)cc1 558546382 PNGSDBNKONRHAY-NRFANRHFSA-N 395.487 5.739 30 20 GKED C=CCn1c(S[C@@H](c2ccc(Cl)cc2)C2CCOCC2)nnc1C1CC1 559189251 HPJPJLNPVMQBAR-SFHVURJKSA-N 389.952 5.255 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1c(Cl)cccc1Cl)c1ccccc1 559379923 CCAKNONXBUDWQQ-GOSISDBHSA-N 376.287 5.228 30 20 GKED N#Cc1cccc(C2(NCc3csc(-c4ccc(C(F)(F)F)cc4)n3)CC2)c1 560073648 YGTIHXVZNFMFTJ-UHFFFAOYSA-N 399.441 5.479 30 20 GKED COc1ccc2oc([C@@H](C)NCc3ccc(Br)cc3C#N)c(C)c2c1 561884840 BMHSLECGPHUECN-CYBMUJFWSA-N 399.288 5.235 30 20 GKED CC(C)c1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1ccccc1 579427330 DDGORGMOOUOKAV-INIZCTEOSA-N 392.528 5.240 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)s1 582876897 ZZZZBXAIKZVACG-IBGZPJMESA-N 390.405 5.657 30 20 GKED CC(C)c1ccc(N(C(=O)CCCCCC#N)c2nc3ccccc3s2)cc1 588814730 YSSIYVFUHOMECJ-UHFFFAOYSA-N 391.540 6.558 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2ccccc2OCC2CC2)c1 610122539 CQILGDIAUKTVCQ-UHFFFAOYSA-N 398.462 5.178 30 20 GKED CC1(C)CCC(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1 610200353 GLXYVNYVQGCDSF-UHFFFAOYSA-N 378.541 5.549 30 20 GKED Cc1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1Cl 610399705 ZUTYPFAOOLBLSD-UHFFFAOYSA-N 376.843 5.759 30 20 GKED C[C@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1cccc(C#N)c1 610408421 WSQOBLKDBIKJKL-VBKZILBWSA-N 393.537 5.100 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1c(-c2ccccc2Cl)noc1C 615081498 NFIUVBHIWKCDIC-UHFFFAOYSA-N 396.874 5.140 30 20 GKED COc1ccc(CNc2cccnc2Oc2ccccc2)cc1OCCCC#N 615134555 GGHPFOKUNZYIKN-UHFFFAOYSA-N 389.455 5.177 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccccc1F 645077397 VHUWTRXKKNIXBX-INIZCTEOSA-N 395.503 5.251 30 20 GKED N#C[C@@H](C(=O)c1cc(Br)c2ccccc2c1)c1nc2ccccc2o1 645955835 LKGVSOBIAJECQK-HNNXBMFYSA-N 391.224 5.234 30 20 GKED CSc1cc(Br)ccc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 654982477 NPYUPKUHKCHTFU-GFCCVEGCSA-N 395.347 5.241 30 20 GKED O=C(c1cc(F)c(C(F)(F)F)c(F)c1)N(CC(F)F)c1ccc(F)cc1 683811255 ZHZHEUQWCQFIFU-UHFFFAOYSA-N 383.238 5.035 30 20 GKED Cc1c(Cl)cccc1N=C1SCCN1C(=O)c1csc(C(C)C)n1 726498102 GOCKDTLDKFPCTQ-UHFFFAOYSA-N 379.938 5.105 30 20 GKED CCc1cc(NN=C(C)c2ccc(Cl)cc2Cl)nc(-c2ccccn2)n1 730463936 YBHMRJBCALJVFH-UHFFFAOYSA-N 386.286 5.244 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C\c1cccs1 730993839 DCPSKPRYKZBUMA-ALCCZGGFSA-N 382.432 5.425 30 20 GKED C[C@@H](NC(=O)CCCCOc1cccc(C#N)c1)c1csc2ccccc12 731989966 CZRCPFCSELJAFY-MRXNPFEDSA-N 378.497 5.199 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)C2CCC(C(C)(C)C)CC2)c1 733851599 DUSYRTLNRQDXPN-MHJFOBGBSA-N 385.552 5.114 30 20 GKED C=CC[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1C)c1ccncc1 734509204 IWCQDOAELQBYCA-RUZDIDTESA-N 394.522 5.650 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@H](c3ccccc3C)C[C@H]2C)c1=S 738054314 NMCXKOPVXSCVAS-QZTJIDSGSA-N 394.544 5.004 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCC[C@@H]3c3ccsc3)c2)s1 740063581 BIWZZOKHOLPXME-LJQANCHMSA-N 393.537 5.395 30 20 GKED COc1cc(C2(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)CCCC2)ccc1C 747198711 KKOGWWBJANXPSB-QGZVFWFLSA-N 382.529 5.272 30 20 GKED C=C(C)COc1cc(/C=C\C(=O)c2ccc(SC)c(OC)c2)ccc1OC 747614411 GZANYNLAOUFIGG-TWGQIWQCSA-N 384.497 5.277 30 20 GKED C#CC[C@@H](OC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccccn1 750695770 BRAWZAFSNMOLSE-IFXJQAMLSA-N 396.899 5.072 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cc(Cl)c(N)c(Cl)c1 753103418 XWCAGPIIAHRFGY-UHFFFAOYSA-N 390.723 5.511 30 20 GKED CCOc1ccc(C=NOCc2coc(-c3ccc(C(F)(F)F)cc3)n2)cc1 755800618 CYEHZEUVGKKVTH-UHFFFAOYSA-N 390.361 5.310 30 20 GKED C=CCc1cc(OCC)cc(CN(C)[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1O 758257822 HLPBOCWNFQOOFB-JTHBVZDNSA-N 399.506 5.011 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CCCCO1 758536811 XZFXGYYJAZIIRE-YADHBBJMSA-N 391.515 5.059 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12 759213482 BMYHWSDLADTBHH-LFDGNKEFSA-N 388.854 5.244 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)s1)c1cc(Br)ncc1F 762427511 VEJLXIHLFOXOMU-VOTSOKGWSA-N 389.249 5.003 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1 770559792 PHUKBLLBXKNVRQ-CLOONOSVSA-N 386.495 5.256 30 20 GKED Cc1nc(Cl)ccc1CC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782484153 DDGQRKKQIMLQCE-OAHLLOKOSA-N 389.886 5.002 30 20 GKED CC1(c2cccc(Cl)c2)CCN(C(=O)c2ccccc2SCC#N)CC1 794341711 NADIHVOHYWKXAK-UHFFFAOYSA-N 384.932 5.150 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(C(F)(F)F)ccc2Br)c1 795034685 PPNKJHGLRJFOMJ-UHFFFAOYSA-N 399.235 5.258 30 20 GKED C[C@@H](OC(=O)[C@H]1C[C@@H]1C(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 801478171 GKVNBAMMIXROKJ-DADVEIPYSA-N 376.243 5.230 30 20 GKED CC(=O)N1C/C(=C/C(C)=C\c2cccc(C(F)(F)F)c2)C(=O)c2ccccc2C1 806573354 ZNLWXGPUGODLSK-ZAESSLRESA-N 399.412 5.280 30 20 GKED COCCOCc1ccc(/C=C\C(=O)c2ccc(SC)cc2Cl)cc1 809157944 PFDWOGRJTRNNIH-YFHOEESVSA-N 376.905 5.121 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccc(Cl)c(F)c3)n2)cc1 810531834 MJHDDIYZBJYDIL-OAHLLOKOSA-N 384.863 5.330 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(Br)c1 813096423 LTBLXOXENPFHLM-SMDDNHRTSA-N 391.334 5.183 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc(Cl)c(Cl)c1 813211463 KTTALXCCLFFLLG-SKDRFNHKSA-N 387.188 5.387 30 20 GKED C=CCC(C)(C)c1noc([C@@H](C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 815706463 KBQPMHKQCPROFI-RDJZCZTQSA-N 385.508 5.293 30 20 GKED Cc1ccccc1-c1cc(C(=O)Oc2ccc(C#N)cc2)c2cnn(C(C)C)c2n1 821687379 HBOJLHFJUQGWNK-UHFFFAOYSA-N 396.450 5.079 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(Oc3ccccc3)cn2)c1 834650117 GMZYELBBFSIICS-UYAOXDASSA-N 387.483 5.406 30 20 GKED Cc1cc(CN[C@@H](C)c2ccc(C#N)c(F)c2)cc(NC(=O)OC(C)(C)C)c1 834893853 HJQSHGZZHOVDME-HNNXBMFYSA-N 383.467 5.204 30 20 GKED CC(C)CN(Cc1ccc(F)c(Cl)c1)C(=O)Nc1cccc(OCC#N)c1 860461819 PEYYRJUDOZSXDS-UHFFFAOYSA-N 389.858 5.072 30 20 GKED CCO[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 860475881 VUKGRHPPWKYFBD-SUMWQHHRSA-N 395.311 5.108 30 20 GKED N#C[C@H](CCc1ccccc1)c1nc(-c2ccc(COc3ccccc3)cc2)no1 904446478 OETYGSNAQOPNSV-QFIPXVFZSA-N 395.462 5.556 30 20 GKED CC(C)CC[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)cc1 916680352 HZXVEYHNNMTCAG-FQEVSTJZSA-N 385.895 5.541 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCOc3cc(C)cc(C)c3)n2)cc1 916974763 PLXDAYRJIDZZBG-FQEVSTJZSA-N 390.508 5.381 30 20 GKED CCc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cnn1C(C)(C)C 918126459 BQDJSTUILVLWCU-FQEVSTJZSA-N 386.499 5.108 30 20 GKED N#C[C@H](C(=O)c1ccccc1C(=O)c1cccs1)c1ccc2ccccc2n1 48854379 COXAGCMZCJLPJF-SFHVURJKSA-N 382.444 5.017 30 20 GKED C=C(C)COc1cc(/C=C(/Cl)c2nc(O)c3cccc(C)c3n2)ccc1OC 60822168 XQDRBUHHURQWLR-LICLKQGHSA-N 396.874 5.344 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H](C)c1ccsc1 119526252 AHKZFJMKLDLDCA-MRXNPFEDSA-N 376.481 5.249 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 171742198 HDNOHEXWJZHZNU-QFBILLFUSA-N 397.519 5.316 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 180189325 HCSBAVUZGSYVJW-LLVKDONJSA-N 398.837 5.863 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(F)c1F)c1nc(-c2ccc(Cl)cc2)cs1 181013396 LIZKRJQDKBRADD-AWEZNQCLSA-N 388.826 5.161 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CN2CCCC[C@H]2C)C1 191504094 JDWOAFFBXQDJQK-RTWAWAEBSA-N 397.607 5.657 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H]1CCCC[C@H]1C(C)(C)C 303412095 VAGRPSYXTYGJTE-KURKYZTESA-N 387.593 5.071 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1SC[C@H](C)C#N 303453146 DEOISRPVLHBCDY-JPYJTQIMSA-N 395.572 5.206 30 20 GKED Cc1cc(C)c(N=C(O)[C@H](C)Sc2nnc(C3CCC3)n2C)c(Cl)c1 329324075 VKSXSCCRZVAAEH-LBPRGKRZSA-N 378.929 5.122 30 20 GKED OC(=Nc1ncc(C2CCCCC2)s1)N1CCC(OC2CCCC2)CC1 329346440 VCSMMFXUKFYCKM-UHFFFAOYSA-N 377.554 5.160 30 20 GKED CCc1ccc2c(c1)[C@H](CC/N=C(/O)[C@@H]1CCCC[C@@H]1C(F)(F)F)C(O)=N2 329399602 YJSISNPWRCJLGS-LZWOXQAQSA-N 382.426 5.650 30 20 GKED Cc1c(N=C(O)CC/N=C(/O)C23CC4CC(CC(C4)C2)C3)cnn1C1CCCC1 329932394 AZOIVKDKXVWMLS-UHFFFAOYSA-N 398.551 5.458 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@](CO)(c2ccccc2)C1 374673078 HFEIYKPBXKLYJB-VWLOTQADSA-N 392.543 5.097 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CCSc2ccc(F)cc21)c1ccccc1 431769465 IMWQMYNLBDFHSC-RTBURBONSA-N 383.492 5.097 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 432956966 BWJRWYJMAYOYSN-UHFFFAOYSA-N 395.397 5.076 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2c1 437366178 VNKQFUFHZYVWHY-GOSISDBHSA-N 389.524 5.799 30 20 GKED CCCCOc1ccccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 437884717 XFIQZJRAMPOLQE-FPOVZHCZSA-N 377.488 5.169 30 20 GKED CC1(C)CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)CC1 438002192 TUJAKRVUNFIWMP-UHFFFAOYSA-N 395.478 5.320 30 20 GKED Cc1ccc(C)c(OCc2nnc(SCc3ccc(C#N)cc3Cl)o2)c1 438895724 KVURYHAIUANDPV-UHFFFAOYSA-N 385.876 5.083 30 20 GKED N#CCCCn1cc(C(=O)Nc2nc3cc(F)c(F)cc3s2)c2ccccc21 444142120 JZGYJJWVXBBWOO-UHFFFAOYSA-N 396.422 5.085 30 20 GKED C=CCOCCCC(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 463481441 DESQETNKOZTHFT-UHFFFAOYSA-N 380.419 5.088 30 20 GKED C=CCOCCCC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 464074808 NFWVUOWLNHGWMX-IBGZPJMESA-N 382.504 5.111 30 20 GKED C=C[C@H](C)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 465145572 LNLQXIZOSPYTTL-NSHDSACASA-N 396.390 5.069 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ncccc2OCCCC#N)cc1 466599916 IFGKOIQCZCVKOK-RXVVDRJESA-N 392.503 5.078 30 20 GKED Cc1ccccc1CN(Cc1cccnc1)C(=O)c1ccc(C(C)(C)C#N)cc1 475116826 GKENKPASMXFYHE-UHFFFAOYSA-N 383.495 5.034 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)Cc1ccccc1OC 475557536 YSJSAXKMVGAMKS-SFHVURJKSA-N 380.532 5.642 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@H]1c1cccc(F)c1 475574278 VODNYBTXYIWVGZ-JTSKRJEESA-N 380.507 6.293 30 20 GKED CCS[C@@H]1CCC[C@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 475967453 MNUMUFDYHZTTGQ-YLJYHZDGSA-N 382.554 5.113 30 20 GKED N#CC[C@@H](CC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccccc1 476135452 GNMZUZBXLRRGSO-KRWDZBQOSA-N 386.417 5.288 30 20 GKED CC(C)CN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@@H]1CCCc2cccnc21 476814248 IGCALKPPTAXWIQ-OAQYLSRUSA-N 375.516 5.059 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2C(C)C)cc1 477013128 NZIKQXWOBHROCE-UHFFFAOYSA-N 386.499 5.358 30 20 GKED C=CCCCC(=O)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 479554653 MIQQULJYFIMYER-UHFFFAOYSA-N 382.891 5.114 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccnc(OCc2ccccc2)c1 481923056 ZHBZLUOMIDAHBR-XMMPIXPASA-N 383.495 5.090 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1c(CCC)cccc1C(C)C 482172204 XIKVCOOFJBMYCT-UHFFFAOYSA-N 396.579 6.150 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](N[C@H](C)CC)c1ccco1 482183899 IDMSUGBCRRDIDX-XLIONFOSSA-N 383.536 5.382 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(OC(C)C)c1 482858795 LOFAKSYWSGZNQX-QGZVFWFLSA-N 386.517 5.333 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(F)c(F)cc2N2CCCCC2)cc1 484888202 PHAJQDISQXWAND-UHFFFAOYSA-N 383.442 5.009 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(c2ccccc2)[C@H]2CCOC2)cc1 485809540 HQDJPYPUWFAUPM-QFIPXVFZSA-N 398.462 5.095 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc2c(c1)CCC2 486223662 PMNONVSAMAZBMU-INIZCTEOSA-N 396.581 5.299 30 20 GKED C[C@@H](N=c1c(C#N)c[nH]c2ccc(Cl)cc12)c1nc2ccccc2n1C(F)F 486453090 SDHCPKODIBDKIA-LLVKDONJSA-N 397.816 5.100 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(F)ccc1OCC1CC1 486856428 OGOJGXUXVOCXNW-UHFFFAOYSA-N 386.426 5.405 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 492177417 FUZSWEVEDVLPQM-UHFFFAOYSA-N 387.439 5.206 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2sccc2C#N)C(C)C)s1 498397113 OZLGONLOQPWHHK-UHFFFAOYSA-N 380.538 5.708 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccc(NC(=O)c3ccco3)cc2)CC1 507629955 MPHPSZCYBZNMQW-UHFFFAOYSA-N 399.494 5.026 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)CSCc3cccnc3)c2C#N)C1 512181456 MZYIXSNXSMTMFM-HNNXBMFYSA-N 399.585 5.038 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-n3cnc4ccccc43)cc2)c1 513207391 YFZJNHBIMSOXFY-UHFFFAOYSA-N 382.467 5.320 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@@H]2c2cccs2)c1 513443426 OHCUMWUYYCMHFY-HXUWFJFHSA-N 388.492 5.176 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 513709642 JMCRJRSCGGCNTR-AVRDEDQJSA-N 378.472 5.130 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1)C1CC1 513767156 FHDUDGSHYKTXKL-OAHLLOKOSA-N 390.512 5.043 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@@H]1Cc1ccccc1 518166107 VMFKMLJUWJGVJB-AZUAARDMSA-N 393.556 5.567 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1cc(Cl)ccc1Cl 519412244 WGRNBRWHTBSSRP-GFCCVEGCSA-N 395.311 5.263 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nccc4ccccc34)c12 519575240 BQQNMQNTCIXISP-SFHVURJKSA-N 396.450 5.091 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1OC(F)(F)F 520172088 SHMHLKVRQUCQSO-UHFFFAOYSA-N 391.393 5.147 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccccc2)s1)c1cccc(Cl)c1Cl 520888848 WROGNHXONPPJRO-AWEZNQCLSA-N 388.279 5.112 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cccc4cccnc34)cc2)c1 521801028 SIGURCVVLJGMIM-UHFFFAOYSA-N 379.419 5.080 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)CCCc3ccc4ccccc4c3)CC2)cc1 527477745 DQJCUWJWLQKGSZ-UHFFFAOYSA-N 398.506 5.104 30 20 GKED N#Cc1c(NC(=O)c2ccc(OC3CCC3)cc2Cl)sc2c1CCCC2 535414083 SDIRIUWWXRXWPD-UHFFFAOYSA-N 386.904 5.336 30 20 GKED Cn1ccnc1-c1cccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 540876347 ZOGFATDWIYCUCP-UHFFFAOYSA-N 394.434 5.003 30 20 GKED CCc1nc(C)c([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542996268 XKHQMYPAPAROQP-CVEARBPZSA-N 375.541 5.964 30 20 GKED N#C[C@@H](C(=O)c1ccc([C@H]2CCCOC2)cc1)c1nc2cc(Cl)ccc2s1 543734492 HPBVEZIBXJHDBV-RDJZCZTQSA-N 396.899 5.334 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C)c(C)c1Cl 543974168 YLFJABWTNGRXBN-UHFFFAOYSA-N 391.858 5.577 30 20 GKED Cc1nc(C2CC2)oc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 545449118 MPKJUGHWPBGLBJ-CQSZACIVSA-N 383.860 5.127 30 20 GKED N#CCCC[C@H](NCc1cccc(OCc2ccc(F)cc2)c1)c1ccccc1 552313002 GZZRZGRFSBTHRI-VWLOTQADSA-N 388.486 5.929 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 552612311 QMEAIJOYBGAXDG-GOSISDBHSA-N 383.454 5.174 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1sc(-c2ccc(C)o2)nc1C 553119387 JRVZAQGZQJAMEG-UHFFFAOYSA-N 398.532 5.016 30 20 GKED CC(C)C[C@H](Cc1cccc(Br)c1)C(=O)NCC(C)(C)CCC#N 554662712 VWNDJUCXBAXJEA-QGZVFWFLSA-N 393.369 5.100 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H]2CCC[C@@H](C2)C1 574354160 NMIARYXCMXBCDM-PMACEKPBSA-N 389.499 5.100 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2ccc(Cl)o2)cc1 591722974 YPRKTMGDWKZRAP-UHFFFAOYSA-N 382.872 5.027 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC[C@@H](CC#N)C3)cc2)cc1 596726451 OQTRPBKZIQHZSA-INIZCTEOSA-N 381.501 5.004 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c1 604006345 DTWPRXDZYSVXCT-OAQYLSRUSA-N 395.289 5.579 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c(C)n1 604027033 XSVPCBCKNDGFLO-UHFFFAOYSA-N 377.831 5.268 30 20 GKED CCN(C(=O)CCc1nc2cc(Cl)ccc2s1)[C@H](C)c1ccc(C#N)cc1 609326647 CXBBUGNUIUBJMF-CQSZACIVSA-N 397.931 5.364 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1 609434555 XSWAIVDLGNWNKZ-XMMPIXPASA-N 397.478 6.028 30 20 GKED C[C@H](NC(=O)CS[C@@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 609825864 XSUJKAWZXDAWHP-STQMWFEESA-N 393.339 5.537 30 20 GKED CSCCCCC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 610047561 GBPAOESTSUTYSC-UHFFFAOYSA-N 388.920 5.262 30 20 GKED CC(C)(C)[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C(F)(F)F 610247469 RBYURWWYRXFHLI-GOSISDBHSA-N 376.378 5.057 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COC(C)(C)C)cc1 610634867 WHCJJAYNDDSTBZ-UHFFFAOYSA-N 393.531 5.563 30 20 GKED CCC(CC)n1nc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1C 611445671 NDVGVLXZFCCDEW-UHFFFAOYSA-N 378.501 5.405 30 20 GKED Fc1ccc(-c2noc([C@@H](C[C@H]3CCCO3)C(F)(F)F)n2)c(C(F)(F)F)c1 650219307 AAMBFFGRJMTUFX-BXKDBHETSA-N 398.278 5.110 30 20 GKED CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 675160075 RLEVNXMXJFCZDF-LJQANCHMSA-N 394.478 5.208 30 20 GKED CC[C@H](C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 680851059 LIWADBTWILFQJI-JMSVASOKSA-N 399.350 5.345 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(Cl)c2SC(F)F)cc1OC 725746424 IAPJFMOIXXPOHU-UHFFFAOYSA-N 399.846 5.480 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(CCCc2ccccc2)cc1 726558777 MWIJRDAKGZLJAX-UHFFFAOYSA-N 386.520 5.730 30 20 GKED COC(=O)C[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(SC)cc1 728174718 YYXVILZGNDUEEJ-PPAWOMOGSA-N 398.311 5.144 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)cc1 728695421 WQOCRYGNSPWWNC-JEMSNHSXSA-N 393.389 5.628 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 733635484 ZDRFFSFNDOYCFD-UHFFFAOYSA-N 391.446 5.542 30 20 GKED Cc1cccc(-c2nnc([C@H](C)Sc3nc(-c4ccccc4)ccc3C#N)o2)c1 733902456 FQYMJJOCKHFUEE-INIZCTEOSA-N 398.491 5.832 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)N[C@@H](CC)c2cccs2)c1 734378957 SNQFIMLWAKYRKJ-NRFANRHFSA-N 390.577 5.762 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)N[C@H](CC)c2cccs2)c1 734378962 SNQFIMLWAKYRKJ-OAQYLSRUSA-N 390.577 5.762 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(SC(F)F)cc2)cc(Cl)c1OC 734979313 BSVBOAFBJLXXNH-FPYGCLRLSA-N 384.831 5.568 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)NCc3ccc(OCC#N)cc3)o2)cc1 742627019 DPVKJNYKUARPOQ-UHFFFAOYSA-N 388.467 5.076 30 20 GKED C#CCN(C(=O)c1ccc(SCc2csc(C)n2)cc1)C1CCCCC1 743689953 RGLAKQAXWXOBDF-UHFFFAOYSA-N 384.570 5.152 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Oc2ccc(Cl)c(Cl)c2)n1 747194108 SKIIWWOGSDYZAB-JQWIXIFHSA-N 383.300 5.217 30 20 GKED Cc1ccc(OC(F)F)c(/C=C2\SC(=Nc3c(C)cccc3C)NC2=O)c1 756783776 LUQSKSUERJJDKW-YBEGLDIGSA-N 388.439 5.105 30 20 GKED C#CC[C@@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccccc1 756998491 WXTPEXIXNVEHQT-HSZRJFAPSA-N 388.898 5.447 30 20 GKED CC(C)(C)OC(=O)N1CCc2cccc(/C=C/C(=O)c3cc(F)ccc3F)c21 757530154 SGHZUBKSIHFNJC-JXMROGBWSA-N 385.410 5.159 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3nc(Cl)cs3)s2)cc1 759086034 YUOLLDUHMQJGGT-BQYQJAHWSA-N 376.890 5.133 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ncc(C(C)(C)C)o2)cc1OCC 760432759 KDQUVMBWBYJZSO-UHFFFAOYSA-N 394.899 5.364 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cncc(Br)c2)cc1 767359656 HJOOXBDBCIPIKG-WDZFZDKYSA-N 394.268 5.416 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@H](C)CCCc1ccccc1 776076506 HAIOOYKOBULNKK-XMSQKQJNSA-N 390.527 5.118 30 20 GKED C[C@@H]1C[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCO1 776513921 BTNIWTLXTGNVHW-UHIISALHSA-N 395.311 5.108 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 776813750 KQNAIPRYXOFEDX-QHCPKHFHSA-N 377.447 5.150 30 20 GKED C=CC[C@H](C(=O)O[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 778416180 DXCHTCYFQYSEPB-NQIIRXRSSA-N 379.500 5.349 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(C4CCC4)s3)cc2)c1 779595314 XUFJXAWIVDGMKC-UHFFFAOYSA-N 375.497 5.473 30 20 GKED C#CCCCCCC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 780540810 OACLHIFAKCEDHT-FQEVSTJZSA-N 378.516 5.712 30 20 GKED CC(C)[C@@H](C=Nn1c(S)nnc1CSc1ccccc1)c1ccccc1 794530621 OOLRQCVIJNLFBO-GOSISDBHSA-N 382.558 5.133 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3ccccc3OC(F)F)cs2)cc1 797029328 ZNFDMDCDZRFLCQ-DHZHZOJOSA-N 387.407 5.316 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2cccc(C(F)(F)F)c2)s1 797570079 CIDNNGVICMVJQI-AWEZNQCLSA-N 380.435 5.268 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801669673 BUAHTBCUVSYQNH-MRXNPFEDSA-N 382.382 5.360 30 20 GKED Cc1cc([C@H]2CCCN2c2nc(Cl)c(C#N)s2)ccc1Br 804682160 LKDICYGBCJQNOD-GFCCVEGCSA-N 382.714 5.081 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2cn(C)nc2C(F)F)cc1 812241151 DOEWFSMHQBSKNM-FMIVXFBMSA-N 382.410 5.141 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)ccc2c1 813216887 HLSPVSBKUVXXID-SXQCNTSWSA-N 396.368 5.152 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1csc2ccccc12 814298219 FVEZHNHKEKXFJG-UZLBHIALSA-N 377.513 5.697 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086254 IXLHUEQBJZOIHZ-JOCHJYFZSA-N 393.446 5.558 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1C[C@H]2CC[C@H]1C2)c1nc2cc(C(F)(F)F)ccc2s1 915103842 GNGBDYXVYVQXJZ-MNXVOIDGSA-N 378.419 5.318 30 20 GKED Cc1ccsc1C=Nn1c(C)nc2scc(-c3ccc(Cl)cc3)c2c1=O 916272610 DVOCRBVVGJDKMF-UHFFFAOYSA-N 399.928 5.339 30 20 GKED CCCCn1nc(C)c(C=NNc2nc(Cl)c(Cl)cc2Cl)c1Cl 916317447 AKIPUZNGFAWDIM-UHFFFAOYSA-N 395.121 5.446 30 20 GKED CN(CCC#N)c1ccc(CNc2ccccc2COCc2ccccc2)cc1 916839019 PLUCKKUYTAGMCK-UHFFFAOYSA-N 385.511 5.365 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C=C\c1cc(C)c(C)cc1C 916906629 IIKJYUDEDAHZSD-GJCOWUBNSA-N 388.511 5.097 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4cccc(F)c4)CCC3)n2)cc1 916974592 NHULTNNEXVOCMB-IBGZPJMESA-N 390.483 5.556 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2cc(Cl)ccc2s1 917047142 RTNCNNLAVBMUMZ-LLVKDONJSA-N 395.698 5.675 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 920140845 CJWDWQSSNVJZPI-OALUTQOASA-N 376.481 5.189 30 20 GKED Cc1ccc(NN=Cc2cccc(O[C@H](C(=O)O)c3ccccc3)c2)cc1Cl 1776034908 KNLOLALVEVDMAQ-NRFANRHFSA-N 394.858 5.299 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)ccc1F 1776062243 KPBZNVIKIJFWNW-GFCCVEGCSA-N 381.234 5.566 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cc1cc2sc(C(=O)O)cc2s1 1776180492 XZGPOTVUNUWUMV-UHFFFAOYSA-N 383.947 5.564 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1 1776785462 CPXAOUPDLDTCKJ-FOWTUZBSSA-N 394.511 6.329 30 20 GKED CCCCCCCOc1ccc(CNc2cc(C(=O)O)ccc2OCCC)cc1 1776789186 UGDMCRQPQAROJK-UHFFFAOYSA-N 399.531 6.135 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3cc(Cl)ccc3o2)c2cc(C(=O)O)oc12 1777360802 QJPDJMQXUOBNLV-DJWKRKHSSA-N 396.782 5.435 30 20 GKED C[C@H](NC(=O)Nc1cccc(COc2cccc(F)c2)c1)c1ccc(C#N)cc1 58152286 AMQYEWNQHMEMAX-INIZCTEOSA-N 389.430 5.159 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(OCC)cc1C(F)(F)F 62411702 GJVKXXWHQIYWNP-UHFFFAOYSA-N 392.421 5.367 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1Cc1ccccc1 63389032 FOUXAFWVQJHILU-UHFFFAOYSA-N 381.479 5.369 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1nc2ccccc2o1 66516414 GTNPEGUBIGEGAK-VIFPVBQESA-N 385.857 5.156 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(Cl)c(OCCC)c(OC)c1 104835590 FIAJTWKWNNBGII-UHFFFAOYSA-N 379.909 5.027 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1 107320414 GZMOAEYIXIDZLD-BCHFMIIMSA-N 398.506 5.182 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCCCc1ccccc1 108238950 GTUHJIVDAIYHJZ-QGZVFWFLSA-N 384.570 5.243 30 20 GKED N#C[C@H](C(=O)c1ccc2ncccc2c1)c1nc(-c2c(F)cccc2F)cs1 120917300 DWWYGXBIUBSAOL-CQSZACIVSA-N 391.402 5.127 30 20 GKED Cc1ccc(-c2nnc(CNc3cccc(OCc4cccc(C#N)c4)c3)o2)cc1 133222818 JCEBQHJWUKCEHT-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 134074662 LIEHZPSAPKEBHK-UHFFFAOYSA-N 385.895 5.047 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 173123867 OOXTYVKBPVKAGB-GQIGUUNPSA-N 397.519 5.835 30 20 GKED C[C@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(OCC#N)cc1 174044901 WAXOGDVUUNYNLV-OALUTQOASA-N 399.494 5.253 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)s1 176404929 DFPDTBLOJSGFHX-NVNXTCNLSA-N 395.896 5.322 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1nc(C2CCCCC2)no1 191462357 LSZJQUCNUYQXHE-MRXNPFEDSA-N 396.535 5.852 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccccc4)sc3C2=O)cc1OC 207732101 YXVKKZXYZVZZDX-VBKFSLOCSA-N 377.465 5.040 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1cc(F)ccc1F 303859654 MGDAPWNPEVVQNH-CXAGYDPISA-N 389.471 5.489 30 20 GKED COc1cccc(C2(/N=C(/O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)CC2)c1 329282195 KTNTXCPUKIWXPV-GOSISDBHSA-N 393.531 5.148 30 20 GKED N#CC1(/N=C(/O)[C@H]2CC[C@H](/C(O)=N\C3(C#N)CCCCC3)CC2)CCCCC1 329441783 KZRAJXWXOGDNJJ-IYARVYRRSA-N 384.524 5.159 30 20 GKED C[C@@H]1CCCCN1C(=O)c1ccc(N=C(O)c2cccnc2C2CC2)cc1Cl 329623485 GBCKYLOWRGKUQB-CQSZACIVSA-N 397.906 5.263 30 20 GKED CC(C)(C/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1cccc(Cl)c1 330030332 RKXBZFMUCMHWLX-UHFFFAOYSA-N 376.928 5.499 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccccc1 410409422 UZKHXCISRPLGHW-AWEZNQCLSA-N 396.796 5.307 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N[C@H]3CCCc4cc(C#N)ccc43)c2)n1 416903617 CMLBAVKOIGMMES-FQEVSTJZSA-N 386.455 5.029 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)cc2)c1)c1cnc2ccccc2n1 429571787 YIDJZFSJOKBDTE-MRXNPFEDSA-N 389.867 5.502 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cccc(OCc3cccs3)c2)s1 430603225 JFELSISVPHBLEO-QGZVFWFLSA-N 396.537 5.571 30 20 GKED Cc1ccc(-n2cc(C)cn2)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 433263654 WQDNYZXMOJZFMQ-FQEVSTJZSA-N 387.487 5.046 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)cc1C#N 435359384 WYIGSYYPUTUYOX-UHFFFAOYSA-N 381.435 5.136 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 435595969 DQAVIGAPJZTPNF-HKUYNNGSSA-N 379.529 5.767 30 20 GKED Cc1ccc(-c2nnc(SCc3ccc(C#N)cc3OC(F)F)o2)cc1C 439544992 UQESBYKTMNZTJO-UHFFFAOYSA-N 387.411 5.119 30 20 GKED CCCc1c(NC(=O)Cc2ccc3ccccc3c2)cnn1-c1cccc(C#N)c1 440086125 FQFLDWGPUPUBKO-UHFFFAOYSA-N 394.478 5.031 30 20 GKED N#CC(CCN1CCC(c2ccncc2)CC1)(c1ccccc1)c1ccccc1 444719596 YVEOMUXMYLVVJQ-UHFFFAOYSA-N 381.523 5.161 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)NCc1ccc(-c2ccccc2C#N)cc1 444977091 SKVFEZWLKNNHOU-UHFFFAOYSA-N 380.451 5.337 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(CC#Cc3ccccc3)C2)n1 447399811 XJQYCOPAUHHAGZ-HXUWFJFHSA-N 388.536 5.050 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)NCc2ccc(C(F)F)cc2)cc1 463217981 HSLTTZZWRYRJHI-UHFFFAOYSA-N 391.421 5.162 30 20 GKED C[C@@H](Nc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 463442166 UEZRPGFUVXKCQL-SNVBAGLBSA-N 380.320 5.495 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2c(C(C)C)nn(C)c2s1 463460066 DOPDOKLSTLCBQU-UHFFFAOYSA-N 393.965 5.302 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccoc1C(F)(F)F 463576943 KFFOVYGLYWTIQI-UHFFFAOYSA-N 386.329 5.523 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@H](OC)c1ccc(Cl)cc1 466088284 ZWCXHCWBTPMHMR-INIZCTEOSA-N 399.343 5.140 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc(-c2cccc(Cl)c2)nc1C 471166591 YOBIZCUZDOHJCH-UHFFFAOYSA-N 375.925 5.316 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1 473873049 DRJGANAHLOVFBW-HNNXBMFYSA-N 379.435 5.125 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1Br 473928268 NPGSGLKGUTUBOT-OAHLLOKOSA-N 397.297 5.371 30 20 GKED N#Cc1c(NC(=O)c2ccc3nc(-c4ccccc4)oc3c2)sc2c1CCC2 483090100 OQCBPTDBBWMVSW-UHFFFAOYSA-N 385.448 5.169 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 483198469 QMVKAPRZIXZHBG-QHCPKHFHSA-N 390.442 5.264 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccc(OCc3cccc(F)c3)c2)cc1 483433649 CEVATYLVBDSBCM-UHFFFAOYSA-N 392.455 5.007 30 20 GKED Cc1cc(C)c(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1Br 486345494 XLKRMTJGBBPIKO-UHFFFAOYSA-N 398.304 5.134 30 20 GKED N#C[C@H](C(=O)c1ccc([C@@H]2CCCOC2)cc1)c1nc(-c2ccccc2)cs1 505435269 UHJZVNFXOIZWLL-WOJBJXKFSA-N 388.492 5.194 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)cc1 506223799 MSBYFWPWJCFXQC-NRFANRHFSA-N 375.859 5.317 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2cccc(Cl)c2)cc1)c1nc2ccccc2[nH]1 507021649 FXDUYENZDCAZGH-SFHVURJKSA-N 387.826 5.499 30 20 GKED CCc1c(NC(=O)c2sc3ccc(C#N)cc3c2C)cnn1CCC(C)C 507099079 YRVJYORCJBEOQT-UHFFFAOYSA-N 380.517 5.139 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 509213587 WTZPBHWYHSAOQA-NSHDSACASA-N 396.249 5.548 30 20 GKED COc1ccc(Sc2ccc(NC(=O)NCCCCC#N)cc2Cl)cc1 509225715 IZILGJRZCDUEMJ-UHFFFAOYSA-N 389.908 5.315 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(O)nc2ccccc12 511579305 UUAKQDCOEXANTF-UHFFFAOYSA-N 395.418 5.165 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c[nH]c2cc(F)ccc12 512141224 VGHOKOLRWFNKEL-UHFFFAOYSA-N 399.425 5.461 30 20 GKED N#Cc1ccccc1COc1cccc(CN2CCC(OC3CCCC3)CC2)c1 512633868 PWRZNDNZLXJXGU-UHFFFAOYSA-N 390.527 5.061 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl 512937342 MAVORZMTZODGHQ-GFCCVEGCSA-N 392.286 5.091 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)Nc1cc(C#N)cn1C(C)(C)C 513518375 DTXWZWTZWJVJMJ-APWZRJJASA-N 394.519 5.128 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3csc(-c4ccccc4)n3)c2C#N)C1 514670319 RVVMKTVBPQSRJB-GFCCVEGCSA-N 379.510 5.120 30 20 GKED Cc1csc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1C#N 516873164 HCLALIBXVFBOTI-UHFFFAOYSA-N 393.855 5.498 30 20 GKED C=CCCCN(C)C(=O)[C@](C)(Cc1nc2ccccc2s1)c1ccccc1 522945990 FLQKFMFGSYGDNT-HSZRJFAPSA-N 378.541 5.221 30 20 GKED C=CCCCN(C)C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2 523020935 KISOVGPITNCJBI-UHFFFAOYSA-N 384.501 5.039 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H](c2ccccn2)C2CCC2)c1 527774379 UAGDORRUGKHDDR-RUZDIDTESA-N 383.495 5.163 30 20 GKED C[C@@H](C#N)CN(C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1)C1CC1 533141891 QRZHWDZBGITWHE-AWEZNQCLSA-N 388.389 5.262 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)cc1 536190870 GIAGQZMUBQCUJF-UHFFFAOYSA-N 397.356 5.211 30 20 GKED Cc1cc2ncc([C@H](C)N[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)c(C)n2n1 542106334 KQPQTSUBZIZFOO-ROUUACIJSA-N 395.510 5.297 30 20 GKED CSCc1ccccc1NC(=O)NCc1ccc(-c2ccccc2C#N)cc1 546133304 FVARQVGZYYKBPL-UHFFFAOYSA-N 387.508 5.410 30 20 GKED C[C@H](NC(=O)Nc1cccc2cc[nH]c12)c1ccc(-c2cccc(C#N)c2)cc1 547850113 JPUVEBIYGMULLB-INIZCTEOSA-N 380.451 5.589 30 20 GKED C=CC[C@H](C(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 547954275 FLGMTGOBPYDTNM-CYFREDJKSA-N 386.495 5.198 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 556874952 HIWBLFCITPLLKG-QHCPKHFHSA-N 392.478 5.610 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OC(F)F)cc1F 558838918 MZPPKOMPTDFKBG-UHFFFAOYSA-N 390.814 5.362 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3coc(C4CCCC4)n3)n2)cc1 581204209 PQTHPHGWYNWEKA-MRXNPFEDSA-N 377.469 5.254 30 20 GKED N#C[C@@H](C(=O)c1ccc(C2=CCCC2)cc1)c1nc2ccccc2n1C(F)F 582936806 NBEGMPNDQZMRGK-KRWDZBQOSA-N 377.394 5.489 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3csc(C(C)(C)C)n3)n2)cc1 588348879 CLTFZZCMPFMNMY-CQSZACIVSA-N 381.526 5.363 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N1CCC(CCC#N)CC1 591965895 UKTYEBFSORMKPW-HXUWFJFHSA-N 381.545 5.066 30 20 GKED C[C@H](NC1CCC(Oc2ccc(C#N)cn2)CC1)c1ccc(-c2ccccc2)cn1 593608641 OFZOADREQRRUBC-NWLLBJEDSA-N 398.510 5.056 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CSc3ccc(Cl)cc3)cn2)cc1 603765011 RIAFBTLNBFVKJH-UHFFFAOYSA-N 395.871 5.130 30 20 GKED N#Cc1c(NC(=O)c2cccc(Cl)c2Cl)sc2c1-c1ccccc1CC2 603992370 SSVXVFLWJMXLCL-UHFFFAOYSA-N 399.302 5.944 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3csc([N+](=O)[O-])c3)cc2Cl)cc1 604027215 OFQJSDWURDFDDB-UHFFFAOYSA-N 399.815 5.226 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 609660144 NCJLXXDLDWSOEQ-IIBYNOLFSA-N 389.886 5.523 30 20 GKED CC(C)N(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609727647 RAIANULUWRJITQ-UHFFFAOYSA-N 396.796 5.417 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3coc(-c4ccccc4)n3)c2)c1 609968089 FBNIUFHPKZLPTD-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 610106675 DCZQATRNQRDSMQ-AWEZNQCLSA-N 394.521 5.415 30 20 GKED CSCc1c(C(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)oc2ccccc12 610599153 NWYGTKUDFLZVRO-AZUAARDMSA-N 390.508 5.208 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(COC(C)(C)C)cc1 610632479 BBNVIABDIPQJDM-INIZCTEOSA-N 397.544 6.040 30 20 GKED N#C[C@@H](C(=O)c1ccc(Br)c(Cl)c1)c1ccc2ccccc2n1 675644202 XSQXWIIUOLEUKX-CYBMUJFWSA-N 385.648 5.141 30 20 GKED N#Cc1ccc(NC(=S)NN(c2ccccc2)c2ccccc2)cc1Cl 726435952 ZTKIRQAZBNTFOI-UHFFFAOYSA-N 378.888 5.251 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 726757905 QKHFXXUPMNKKIW-XEDBTPMOSA-N 384.401 5.344 30 20 GKED COc1ccccc1C(C)(C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728687499 IMSPGFZCKXJDFE-NRFANRHFSA-N 399.494 5.407 30 20 GKED C[C@H](C#N)Oc1ccc(CNC2(c3ccc(Br)cc3)CCCC2)cc1 728714984 FWWXNOQKOHEJEL-MRXNPFEDSA-N 399.332 5.299 30 20 GKED C#CCOc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)cc1 730979221 QDZJNCOQOIHRFD-UHFFFAOYSA-N 394.430 5.273 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1cccc(C2SCCS2)c1 732414959 DYORSHNOSVVXKA-UHFFFAOYSA-N 386.542 5.052 30 20 GKED C[C@@H]1CCCC[C@@H]1OCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 733681697 YQIUDFKMXQUOMW-KFNAQCHYSA-N 396.434 5.087 30 20 GKED Cc1cc(F)ccc1-c1ccc(C=Nn2c(S)nnc2-c2ccccc2C)o1 734294729 HYAURMKDOIVIPB-UHFFFAOYSA-N 392.459 5.132 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(CC)C(=S)Nc1ccc(C#N)c(Cl)c1 741876653 QDQUWVDJKSVAHN-LJQANCHMSA-N 385.964 5.560 30 20 GKED Cc1cc(C)cc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743036985 PUMQJGVVZXBADK-UHFFFAOYSA-N 391.471 5.915 30 20 GKED C[C@@H](N[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 743490546 HUOPQLXSQBYABQ-QZTJIDSGSA-N 385.467 5.028 30 20 GKED COc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc(Cl)c1OC 744866395 UERRSHWWPLUYNF-ARJAWSKDSA-N 377.676 5.622 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)ccc1OC(F)F 745990157 MAGHLMQSMOGIPV-KRXBUXKQSA-N 381.378 5.255 30 20 GKED Cc1nc(-c2ccccc2)oc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 746290074 WNIJNBAWFVUATB-UHFFFAOYSA-N 399.475 5.180 30 20 GKED COc1cc(C(=O)/C=C\c2cn3cc(Cl)ccc3n2)ccc1SC(F)F 746347322 YUEZZPBBYGSZRN-PLNGDYQASA-N 394.830 5.207 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)n1 747198865 MGCSGVUSMFYNGK-OAHLLOKOSA-N 385.489 5.104 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(Br)cc(Cl)c1O 756456469 MXZKVBKIYOYBRP-MNOVXSKESA-N 379.685 5.092 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3ccc(-c4ccc(F)cc4)o3)cc2N1 758025429 LGCNCBFEWYRFEU-FNORWQNLSA-N 385.441 5.088 30 20 GKED C=C[C@@H](CC(=O)N(Cc1ccccc1)C[C@H](O)c1ccsc1)c1ccccc1 759349892 UFVZREVEJGVPPJ-REWPJTCUSA-N 391.536 5.170 30 20 GKED C=CCn1c(SCc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1cccs1 768415778 SKGKZEYPOLVXOH-UHFFFAOYSA-N 392.893 5.047 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1ccccc1O[C@@H](C)C#N 770652849 MDCQKGQVAYBFKH-WMLDXEAASA-N 391.393 5.101 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(Cl)c(F)c2)ccc1OC 772987886 YYLSHPPODFBOHV-CJNGLKHVSA-N 376.859 5.019 30 20 GKED CC[C@H](C)n1nc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1C 775489690 XQLGBIMEFKLMLH-HRAATJIYSA-N 387.487 5.462 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)c(F)c1 776743565 PCZYEXQAAVJUAE-SSOJOUAXSA-N 386.470 5.463 30 20 GKED N#CCOc1cccc(NCc2ccc(-c3ccc(Br)cc3)o2)c1 779586097 NUKZXEQTULYZKC-UHFFFAOYSA-N 383.245 5.224 30 20 GKED N#C[C@H](C(=O)CCCc1ccsc1)c1nc2cc(C(F)(F)F)ccc2s1 783359954 WWJQWMYVBBLJLD-CYBMUJFWSA-N 394.443 5.576 30 20 GKED CN(CCC(F)(F)F)[C@H](C/N=C/c1ccccc1O)c1ccc(Cl)cc1 790572697 BCVNEGIEESUQNW-FQIOEHTJSA-N 384.829 5.090 30 20 GKED CN(C)c1ccc(N=Nc2ccccc2C(=O)NCC2CCC(C#N)CC2)cc1 799387368 KDHLQJGZDNHFPB-UHFFFAOYSA-N 389.503 5.228 30 20 GKED Cc1sc(C(C)(C)NCc2ccc(OCC#N)cc2)nc1-c1ccccc1F 830390715 CIZOKICWICUNFO-UHFFFAOYSA-N 395.503 5.185 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cc(Cl)ncc3Cl)c2C#N)CC[C@H]1C 839391266 WMACHHJUDYLJQP-BDAKNGLRSA-N 380.300 5.260 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(Cl)cc2OC(F)F)c1 864026101 PWZSKWURVKHHTA-UHFFFAOYSA-N 387.611 5.188 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2ccc(C(F)(F)F)cc2)cc1 915043929 FALRTPCMWFFIQR-XGICHPGQSA-N 376.378 5.131 30 20 GKED N#C[C@@H](C(=O)CSc1cccc(C(F)(F)F)c1)c1ccc2ccccc2n1 916849663 YLYNFXLQFDEYRA-MRXNPFEDSA-N 386.398 5.222 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(COC(C)C)cc2)cc1 916954753 KCCAYJGAHPNANL-JTSKRJEESA-N 392.499 5.086 30 20 GKED N#C[C@H](C(=O)CCn1c2ccccc2c2ccccc21)c1nc2ccccc2o1 920112800 JNOIWBLGLAKRFO-GOSISDBHSA-N 379.419 5.202 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(F)c1)c1nc(-c2c(F)cccc2F)cs1 920803924 GREZAFKPBJUCOB-WBTMPAOCSA-N 384.382 5.117 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1 14898650 WDDVEDVMFGMJMT-UHFFFAOYSA-N 394.430 5.337 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCc2ccc(F)cc2)cc1 55823754 KMJCIDADYRDABL-UHFFFAOYSA-N 388.442 5.042 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3csc(-c4ccccc4)n3)c2C#N)C1 61047229 RVVMKTVBPQSRJB-LBPRGKRZSA-N 379.510 5.120 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)Cc1csc(COc2ccc(F)cc2)n1 63750719 NUPUUJPILKFWBF-UHFFFAOYSA-N 395.503 5.143 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCCc1c(Cl)cccc1Cl 65518728 LAKPFEWGFRNSLR-UHFFFAOYSA-N 390.314 5.029 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2o1 66955176 YPLXOAVKBFGELY-LSDHHAIUSA-N 379.485 5.710 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)n1 106982215 QTFXAZLFJQKWNS-PKOBYXMFSA-N 382.485 5.301 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 108528751 OBIBZNOZUUAUFQ-UZLBHIALSA-N 379.529 5.616 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)[C@@H](Sc1ccccc1)c1ccccc1 120271547 XZQGPCHGPDQEMQ-NRFANRHFSA-N 392.455 5.200 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCCCC2)c1nc(-c2ccncc2)cs1 128850143 ZZZYWMOUUCQHCU-OAHLLOKOSA-N 379.510 5.026 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1ccccc1 132742719 YLGQDAAQNCEFSR-KRWDZBQOSA-N 396.918 5.265 30 20 GKED COc1ccc(CNc2cccc(N3CCCCCC3)c2)cc1OCCCC#N 151497528 RMIKESIHRNVVFJ-UHFFFAOYSA-N 393.531 5.370 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(OC(C)(C)C)cc2)ccc1OC 157252614 CXBFBWFZOMWVNO-PXNSSMCTSA-N 396.531 5.404 30 20 GKED CN(C(=O)N[C@H](CCC#N)c1ccccc1)C1c2ccccc2-c2ccccc21 160630494 XUYGVFUCLIDPEA-HSZRJFAPSA-N 381.479 5.443 30 20 GKED COc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 173116611 ARFLQOPLRJRDPE-SJORKVTESA-N 397.544 5.042 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1 174499239 ZPEWMYSLEILSAB-UHFFFAOYSA-N 386.455 5.190 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)c1cc2ccccc2o1 176056382 XMOJRBXJXCWEDF-MRXNPFEDSA-N 397.434 5.542 30 20 GKED CSCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1F 177603919 WBDINDZOCIUTHR-INIZCTEOSA-N 382.485 5.302 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(OCC#N)cc1 181942287 MHMMDQGRIXFFOH-SIBVEZHUSA-N 398.506 5.354 30 20 GKED C[C@H](SCC(=O)Nc1c(Cl)cccc1C(F)(F)F)c1cccc(C#N)c1 190907162 BCDYAWCZTZXNBJ-NSHDSACASA-N 398.837 5.663 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccc(OC)cc1OC 191454640 SNJCBAZXFVGILG-UHFFFAOYSA-N 382.504 5.220 30 20 GKED C[C@@H]1CC(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 245559262 BLSUWNJTXLNJFY-STXHMFSFSA-N 397.906 5.073 30 20 GKED C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 247084405 ZPLMVHKFKAHUAZ-RYRKJORJSA-N 397.519 5.487 30 20 GKED N#Cc1cnc2ccccc2c1N1CCC(c2nc3cc(Cl)ccc3o2)CC1 301979976 HREXSHIWDSVJGP-UHFFFAOYSA-N 388.858 5.285 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1Cl 303278334 JJLGSKMEHICRGV-DZGCQCFKSA-N 388.920 5.306 30 20 GKED OC(=Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)[C@@H]1CCCCS1 329261688 BGNWYUKOFQWZPR-INIZCTEOSA-N 390.940 5.199 30 20 GKED C[C@H]1C[C@H](/N=C(/O)C[C@@H]2C[C@@H](C)CC(C)(C)C2)c2ccsc2S1(=O)=O 329624898 HTSKGWASXHTMSM-HOSILWTGSA-N 383.579 5.164 30 20 GKED Cc1cc(Br)c(C(=O)Nc2scc(C(C)(C)C)c2C#N)s1 410931105 PVHQABSARNRKNV-UHFFFAOYSA-N 383.336 5.302 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@@H]3C)n1 410974750 JFDFKDJTAJMBKU-MNOVXSKESA-N 388.924 5.125 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(CN2CCCCC2)c1 412094175 RLDWXOYCXUMBBL-GOSISDBHSA-N 393.556 5.319 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](CC(F)(F)F)C1 421064773 OAHYWMKECPSSLB-ZIAGYGMSSA-N 385.455 5.135 30 20 GKED Cc1cc(NCc2ccc(Br)cc2C#N)ccc1-c1ccncc1 427414439 MSSBZZLCBQCNBF-UHFFFAOYSA-N 378.273 5.303 30 20 GKED CCC[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431290648 NHASPJPCTBTSJO-NHCUHLMSSA-N 385.458 5.540 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1 432075136 IUZHFHINPXCXEX-AYBZRNKSSA-N 397.519 5.678 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)c2cn(CCCC#N)c3ccccc23)c1 436038185 WIZSYNNTYCPPCR-GOSISDBHSA-N 389.499 5.223 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)c1ccc(F)cc1C(F)(F)F 436353638 SWLWTWOKNPIEOG-HNNXBMFYSA-N 393.302 5.576 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccc(F)cc2)C2CCCCC2)cc1 437915299 FJPVCJZIPLEPEI-UHFFFAOYSA-N 393.506 5.994 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(F)c(C(F)(F)F)c1 438078844 IIKHSHCPGVRXKW-QAPCUYQASA-N 391.368 5.148 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2ccc(C#N)cc2C)cc1F 438904493 ZGGJHSNTNBJQGM-UHFFFAOYSA-N 376.387 5.059 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)c1ccc(C#N)cc1 439925594 BJHOXQAOQIOKLU-UHFFFAOYSA-N 397.356 5.041 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)CCCC1(C)C 444912010 LDKIOUFFQIPSQC-IBGZPJMESA-N 380.492 5.176 30 20 GKED CCCCn1ncc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1C 448419679 XQUCOFXCTYWMLR-UHFFFAOYSA-N 390.512 5.267 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 448748271 CDBLMSLPGFQQHP-INIZCTEOSA-N 390.405 5.249 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)N[C@H]3CC[C@@H](CC#N)C3)cc2c1 455279770 YZUQTGKJARSNSR-HKUYNNGSSA-N 391.471 5.128 30 20 GKED CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](c1ccccc1)c1ccc(F)cc1 463952037 QQZLADLXDHWDFS-MHECFPHRSA-N 386.470 5.439 30 20 GKED Cc1c(C(=O)N(C)[C@H]2CCCC[C@H]2C(F)(F)F)ccc(C(F)(F)F)c1F 464604862 YJLHKPDAQRRRKJ-YPMHNXCESA-N 385.323 5.346 30 20 GKED CCCn1ccc2ccc(NC(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)cc21 465149894 JJNPGFUQILWPGR-UHFFFAOYSA-N 396.450 5.363 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(F)ccc2OCC2CC2)c2ccccc21 469836268 KLWNWXXMJNOUHV-UHFFFAOYSA-N 391.446 5.125 30 20 GKED CC(C)[C@H](CNc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 475200805 CAXRZALCOZQBJR-QFIPXVFZSA-N 375.516 5.121 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1cccc(F)c1)N(C)C 475565939 RKPXPJRIULDOED-NRFANRHFSA-N 383.511 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2cccc(C)c2)CC1 475581888 QTIHZQSSODIGHV-UHFFFAOYSA-N 377.532 5.201 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cccs1)c1ccc(F)cc1)c1ccccc1 475908183 AHJMWOKOFBECOP-GOSISDBHSA-N 378.472 5.508 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)sc1Br 476088572 CZRSNCJPHHVPGR-UHFFFAOYSA-N 378.335 5.923 30 20 GKED N#Cc1ccsc1C(=O)N1CCC(Cc2cc(Cl)ccc2Cl)CC1 480417281 GAMYMCXXDZCXDE-UHFFFAOYSA-N 379.312 5.021 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1cccc(OCc2cscn2)c1 482000340 JTDQLJREKOALSM-JOCHJYFZSA-N 375.497 5.473 30 20 GKED CC(C)(C)[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 482936035 WSBBBODXLRUUHA-WIYYLYMNSA-N 393.487 5.066 30 20 GKED CC(C)c1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1ccc(F)cc1 483241159 RVMZEMFPSJZFPH-HXUWFJFHSA-N 398.441 5.173 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N1CCC[C@@H](C(F)(F)F)[C@@H]1C 484605973 NAIIKEAPISBWPN-SMDDNHRTSA-N 395.343 5.073 30 20 GKED Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NCc1ccccc1C(C)(C)C#N 486450279 WDJZBFCJTHLZKC-GOSISDBHSA-N 389.543 5.280 30 20 GKED N#C[C@H](C(=O)c1cc(F)c2ccccc2c1)c1nc2ccccc2n1C(F)F 496359757 UGXMDQMLEFZKQF-OAHLLOKOSA-N 379.341 5.214 30 20 GKED C=CCn1c(SCCCC(C)=O)nc2sc(-c3ccccc3)c(C)c2c1=O 498093045 YQTVKQAPEQJZLJ-UHFFFAOYSA-N 398.553 5.081 30 20 GKED COc1ccc(CNc2ccc(F)cc2OC(C)(C)C)cc1OCCCC#N 498364059 NBFNDGHFILEMSR-UHFFFAOYSA-N 386.467 5.306 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Br)c1 500406738 UKUWCPQEBQZQKQ-ZDUSSCGKSA-N 386.293 5.133 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC[C@H](c2ccc(F)cc2)C1 503491346 PYEXSLINNLYSTE-UNMCSNQZSA-N 398.526 5.027 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1)c1ccccc1 505686535 QZVAUBTXXMBWBH-OAQYLSRUSA-N 386.451 5.491 30 20 GKED C[C@@H](NCc1cc(Cl)cc(Cl)c1OC(F)F)c1ccc(C#N)cc1F 512629650 JSRMZKDQBPWQEO-SECBINFHSA-N 389.204 5.456 30 20 GKED CCN(C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 512796743 JBQKIQXAYNWIHS-HZPDHXFCSA-N 388.433 5.680 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)NC[C@@H](C)c1ccccc1 513209644 KNLPNWRPAHUPSA-MOPGFXCFSA-N 399.494 5.071 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1sc2c(c1C#N)CCCC2 514499689 GHZJVTRDTWAVMY-JTQLQIEISA-N 395.311 5.211 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 518683213 MQLUDPAQBVLPDK-MRXNPFEDSA-N 383.517 5.049 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCC2)cc1 520176505 ADTHJEPNLJQXHW-UHFFFAOYSA-N 391.515 5.570 30 20 GKED N#CCCn1cc(/C=C/c2nc(Cc3ccccc3Cl)no2)c2ccccc21 520300608 PNVGEIRXZUOOFU-ZHACJKMWSA-N 388.858 5.353 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1csc(C(C)C)n1 522474220 KZLXBHFPZHOSJQ-UHFFFAOYSA-N 393.487 5.433 30 20 GKED CO[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 535880852 WUILYUXDVYPZAQ-IRLDBZIGSA-N 390.870 5.322 30 20 GKED Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C 537059946 HIVAEZJUHAKXTR-FDDCHVKYSA-N 395.572 5.315 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(CN2CCCC2)cc1)c1ccc(C#N)cc1 538398378 KQMGYOREYZXNQO-OAQYLSRUSA-N 395.550 5.672 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCCOc2c(Cl)cccc21 540487161 NLVWMQITNSCMFW-QGZVFWFLSA-N 376.909 5.013 30 20 GKED CCOc1ccc(C(C)=O)cc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541084595 MWRUMLHBVOOSBI-SFHVURJKSA-N 398.506 5.677 30 20 GKED N#Cc1ccc(Cc2cnc(NCc3cnc(-c4ccsc4)s3)s2)cc1 542753716 ZBOZIKNOYTYSHZ-UHFFFAOYSA-N 394.550 5.403 30 20 GKED CC(C)c1ccc(SCC(=O)Nc2cc(C#N)ccc2OC(F)F)cc1 556473543 LNCSJSGASDJIAM-UHFFFAOYSA-N 376.428 5.014 30 20 GKED Cc1csc(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)c1C#N 563650526 NVKDXCBEUGOBID-UHFFFAOYSA-N 381.404 5.117 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 573641172 FEIKVFDDMMYVML-OXQOHEQNSA-N 397.544 5.704 30 20 GKED C=CCc1cc(CNc2ccccc2O[C@@H](C)C(F)(F)F)cc(OC)c1O 579996548 BKKKEPJEWCHUSQ-ZDUSSCGKSA-N 381.394 5.071 30 20 GKED Cc1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2ccc(F)cc2Cl)cc1 580972036 NHUHSFDPAQREAE-OAQYLSRUSA-N 399.897 5.212 30 20 GKED COc1cc(CN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)ccc1C#N 582389767 BPBYYHFIZPMYGP-RUZDIDTESA-N 397.453 5.133 30 20 GKED CCC(CC)(C(=O)Nc1ccccc1SC[C@@H](C)C#N)C(=O)OC(C)(C)C 593059182 SMGKIHLVMIIFGE-HNNXBMFYSA-N 390.549 5.025 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CNc2cccc3c2ccn3C(F)F)c1C 594715880 JCKRZZNWTZRZON-UHFFFAOYSA-N 396.441 5.012 30 20 GKED CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 596694179 GDBLLLLETSURFZ-PRJVBOEPSA-N 389.499 5.126 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCSc1ccccc1F 603967980 DBBSOACUSLIBLE-UHFFFAOYSA-N 382.485 5.547 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)c2ncccc12 604468609 HSMQYVVWSUNNQF-UHFFFAOYSA-N 378.863 5.204 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1 606944075 NMPXHYQPZKMVDX-UHFFFAOYSA-N 387.911 5.524 30 20 GKED CC(C)C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 608862479 DCLNPTRAERKBAA-IBGZPJMESA-N 389.421 5.680 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1cccc(C(F)(F)F)c1 608862482 DCLNPTRAERKBAA-LJQANCHMSA-N 389.421 5.680 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1 609064280 NIDNIJGWTKJFTC-UHFFFAOYSA-N 386.451 5.177 30 20 GKED C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)CC1 609080216 SYHYPWSTAYXEAJ-MRXNPFEDSA-N 397.906 5.445 30 20 GKED CC(C)(C)c1ccc(-c2ccc(NC(=O)N3CCC(C#N)CC3)c(Cl)c2)cc1 609205186 IQXJMXUVODWDIC-UHFFFAOYSA-N 395.934 6.072 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H]1CCc2ccccc21 609398018 BKNGMLWDEAATHB-LAUBAEHRSA-N 393.556 5.870 30 20 GKED CCC(C)(C)c1ccc(Oc2ccc(NC(=O)C3(C#N)CCOCC3)cc2)cc1 609449201 FETYPWYNOWTZJV-UHFFFAOYSA-N 392.499 5.425 30 20 GKED N#CCn1c(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc2ccccc21 609475311 HIJVGVKPHXBBKR-UHFFFAOYSA-N 393.406 5.069 30 20 GKED CCCn1c(C)c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c2cc(OC)ccc21 613292484 LZNFOSYEYPODAK-FQEVSTJZSA-N 397.478 5.407 30 20 GKED COCc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)oc2ccccc12 613407476 URLKWDBLZFABTL-CYBMUJFWSA-N 396.855 5.332 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1coc(C2CCC2)n1 618080393 DGKBDHWLYDDRJJ-UHFFFAOYSA-N 389.430 5.108 30 20 GKED CN(C(=O)c1cc2ccccc2n1CC#N)c1ccc(C(F)(F)F)cc1Cl 619569949 VKDCNOCZOYPMFC-UHFFFAOYSA-N 391.780 5.114 30 20 GKED C=CCN(C(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1)C(C)(C)C 622944990 NSJCVCKTMCTBPG-UHFFFAOYSA-N 396.318 5.179 30 20 GKED C[C@@H]1CC[C@@H](c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)O1 624688508 XNSKGCOFZIJNCE-KCJUWKMLSA-N 398.278 5.266 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2c(F)ccc(F)c2Cl)cc1 630068017 PXORHTXMMZHPTP-UHFFFAOYSA-N 376.834 5.045 30 20 GKED C=C(C)[C@H](N[C@H](CC)c1cc(OC)c(OC)c(OC)c1)c1ccc(F)c(F)c1 652190510 QEKCNIRZTURRED-NQIIRXRSSA-N 391.458 5.349 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc1OC(C)C 656394022 WOSDRGLWYDYPQO-HNNXBMFYSA-N 396.512 5.323 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccco2)s1)c1nc2cc(Cl)ccc2s1 675908254 ICYNFTWSAHCGCT-LLVKDONJSA-N 384.869 5.761 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1F 726480587 KMNVKGOGSSCJDW-UHFFFAOYSA-N 393.443 5.307 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccccc1Oc1cccc(F)c1)c1ccncc1 734668897 NHTPBXXFOVLISB-OAQYLSRUSA-N 391.446 5.130 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)c1ccco1 744037738 ZTCVIJJFIOHLDE-AMOGXQHSSA-N 380.513 5.184 30 20 GKED C[C@H](OC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 744336869 ZIUBLOYTCDTFNV-XDVGHUOJSA-N 380.206 5.231 30 20 GKED N#C[C@H](COC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)Cc1ccccc1 751866717 JLWCABZEXJSURY-GMWOYJHMSA-N 391.433 5.061 30 20 GKED CC1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCC(F)(F)CC1 752484660 IOBAWDINOZOTTL-IBGZPJMESA-N 383.442 5.432 30 20 GKED CO[C@]1(C)C[C@@H](N(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1(C)C 752635777 HMESYEVEDMQVIO-YZUZCNPQSA-N 391.515 5.009 30 20 GKED COc1cccc(Cc2cnc(NCc3cccc(OCCCC#N)c3)s2)c1 758442666 AYHOYPDAUDUSDK-UHFFFAOYSA-N 393.512 5.037 30 20 GKED N#Cc1cc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc23)c(Cl)c([N+](=O)[O-])c1 764302229 GJIIKGQQBWKTBW-IRXDYDNUSA-N 391.814 5.015 30 20 GKED C=CC[C@@H](N[C@@H]1CCSc2ccc(Br)cc21)c1ccncc1 766018187 GFJNLWUPAANGIH-IAGOWNOFSA-N 375.335 5.288 30 20 GKED N#C[C@H](NC(=O)c1sccc1SC(F)F)c1cccc(C(F)(F)F)c1 768175563 UDMBHLKEWUUBGV-JTQLQIEISA-N 392.374 5.076 30 20 GKED N#C[C@H](C(=O)[C@H](F)c1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 769294626 RPGYWBMZDFSXDL-IUODEOHRSA-N 378.350 5.202 30 20 GKED C#CCCCCC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 773333783 OOCUYNYTAGKSSE-UHFFFAOYSA-N 388.389 5.090 30 20 GKED Sc1nnc(-c2cc(Cl)ccc2Cl)n1N=Cc1cc(Cl)cs1 782151310 CGWKFPVZDXWYIC-UHFFFAOYSA-N 389.720 5.138 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCc3c(Br)cccc32)c1 783521902 JVKZLNFYGHAAKN-IIBYNOLFSA-N 399.332 5.297 30 20 GKED C=CCC[C@H](NC(=O)c1c(C)noc1C1CC1)c1ccc(C(F)(F)F)cc1 784083095 LJPUATFKWVVGLX-INIZCTEOSA-N 378.394 5.317 30 20 GKED CCOc1c(Cl)cccc1CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 791778249 TUDXOMBZCFZTAX-INIZCTEOSA-N 396.899 5.281 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 792230239 VMLWTQYVMZHMPH-KKSFZXQISA-N 387.487 5.462 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 793122607 STJDSPHIAFCKIP-GOEBONIOSA-N 386.373 5.292 30 20 GKED CCc1ccc2occ(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)c2c1 796796929 FXFHWJPDOMZAHR-LJQANCHMSA-N 382.419 5.110 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)sc2ccc(C#N)cc12 797219674 KNJGZLWUVQGRMD-AWEZNQCLSA-N 379.510 5.325 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(F)(F)CC2)cc1Cl 797615822 ONPGNRYHFXMZQK-KRWDZBQOSA-N 389.833 5.258 30 20 GKED Cc1ccc(C(=O)O[C@H](C)c2ccccc2NC(=O)c2ccccc2)cc1C#N 799606092 RCNRBDZBKMDLBD-QGZVFWFLSA-N 384.435 5.037 30 20 GKED C[C@@H](OC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)nc1 803066684 OZFGRYBRDPYBBH-YMTOWFKASA-N 395.274 5.434 30 20 GKED CSc1nc2ccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)cc2s1 814489404 AIJGDLJDOQOLPT-INIZCTEOSA-N 396.541 5.575 30 20 GKED Cc1cccc(OCCN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915353448 UDNRWQBLNUSJEW-XMMPIXPASA-N 399.494 5.193 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)n1[C@H](C)c1ccccc1 916847622 MZBRQPKXUYSNRS-UZLBHIALSA-N 399.519 5.814 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1C 916905895 QEVNWNYAAWEJLC-HXUWFJFHSA-N 384.435 5.057 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 920019821 VDGRGIJJPOLIEI-ZDUSSCGKSA-N 377.362 5.075 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 920055896 WCSPKNFZHJGZNA-HXOBKFHXSA-N 387.458 5.406 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cccc(Oc2ccccc2)c1 920106098 RJWVBWRBIJDBMV-NRFANRHFSA-N 394.430 5.474 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C(C)C)nc1O 1291990381 IIAONCOVCMVDPK-UHFFFAOYSA-N 387.439 5.135 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(-c2ccccc2)c(Cl)c1 1776051205 ZZVPVVXXSPKOIV-UHFFFAOYSA-N 380.831 5.160 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(F)c2)cc1 1776125611 NKLIODJWOLXPOH-AAKUMTKESA-N 398.474 6.015 30 20 GKED Cc1ccc(OC(F)F)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)c1 1776128186 RFFPTYKHOZHNMA-CLFYSBASSA-N 398.361 5.451 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccsc3)cc2)c1)C(=O)O 1776470735 FUJSYFPYVKFUJL-XMELGKRDSA-N 378.449 5.163 30 20 GKED CCCCCCCOc1ccc(CNC[C@]2(CC(=O)O)CC[C@H](C)C2)cc1 1776786380 TYUYBBMEYLXOQV-WMZHIEFXSA-N 375.553 5.407 30 20 GKED CCCCCCCOc1cccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)c1 1776789017 KOSYHTXSTVANKX-OWBHPGMISA-N 380.484 5.939 30 20 GKED Cc1ccc(NC(=O)[C@H](Sc2nc(C)cc(C)c2C#N)c2ccccc2)cc1 10266903 BORUFOHKASLTNK-OAQYLSRUSA-N 387.508 5.351 30 20 GKED Cc1ccsc1CNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 46987684 HTWCJYJQLLUOHY-UHFFFAOYSA-N 391.496 5.023 30 20 GKED C[C@H](SCCC(=O)Nc1sc2c(c1C#N)CCC2)c1ccc(Cl)cc1 62698250 ACGBRZIIFYEWHT-LBPRGKRZSA-N 390.961 5.585 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 66954285 RXRSZKUSXBHZDR-INIZCTEOSA-N 383.517 5.062 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H](C)Cc1cccc(F)c1 68789716 WIHXNLMVAIXNBV-INIZCTEOSA-N 389.430 5.010 30 20 GKED Cc1csc(C(C)(C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 116491331 YKNWZVPVEXXIRZ-UHFFFAOYSA-N 392.484 5.172 30 20 GKED C#CCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 120625219 UZDCAZXKSJEIGV-UHFFFAOYSA-N 388.389 5.090 30 20 GKED N#C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccco1)C1CCCCC1 123832305 OZJAPMULQZDCAX-KRWDZBQOSA-N 384.530 5.212 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)c1nc2scc(-c3cccs3)c2c(=O)[nH]1 158765106 ZWCAFWIPWNLEHK-LLVKDONJSA-N 395.534 5.438 30 20 GKED COc1ccc(CN(C(=O)N[C@H](CCC#N)c2ccccc2)[C@@H](C)C2CC2)cc1 160619699 JXGCVVXSMMVELQ-FDDCHVKYSA-N 391.515 5.050 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2nc(C(F)(F)F)cs2)n1 162248782 JZGLRYSURZNXEK-UHFFFAOYSA-N 383.342 5.048 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 175119560 ICWBJBIUMFVBRF-NXEZZACHSA-N 379.819 5.126 30 20 GKED N#CCSc1cccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)c1 177445934 HPLDYEDGXRMDDW-UHFFFAOYSA-N 386.436 5.207 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)o1 184303479 SZTSZUHKOAIXMH-QFBILLFUSA-N 381.476 5.282 30 20 GKED C[C@@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1 185019224 PGFGQUGDQPFEGK-AUUYWEPGSA-N 377.488 5.549 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C#N)cc3C)s2)cc1 186329933 MGUWCRWOQFZKOC-OAHLLOKOSA-N 377.513 5.158 30 20 GKED FC(F)(F)c1ccc(C#CCNCc2csc(-c3ccsc3)n2)cc1 237871153 CIHQQBAWRNFOCM-UHFFFAOYSA-N 378.444 5.032 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 264587595 ZQPPHGGZCDYWQM-JXFKEZNVSA-N 395.528 5.316 30 20 GKED COc1ccccc1[C@H](Nc1c(C#N)cnc2c(C)cc(C)cc12)c1ccccn1 301870898 KDIKGHZELZXMKY-VWLOTQADSA-N 394.478 5.328 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ccn(-c3cccc(C#N)c3)n2)c(C)c1 409624590 VVUJGVPZSTYOQP-INIZCTEOSA-N 390.512 5.195 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c2[C@@H]1C 410988862 SZLWIFMDCHLVEB-CHWSQXEVSA-N 381.526 5.174 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@@H](C)C3)c1C1CC1 411008835 IRJSCOMUXDYESX-CHWSQXEVSA-N 382.533 5.213 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cnccc1C(C)(C)C 416804485 DAJZORMUBPTHNZ-OAHLLOKOSA-N 382.533 5.095 30 20 GKED C=C(C)[C@@H](N[C@@H]1CCCc2ncc(C(F)(F)F)cc21)c1ccc(F)c(F)c1 427877845 PHVCGHINUXGUFD-RTBURBONSA-N 382.376 5.663 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)cc2C(F)(F)F)sc2c1CCCCCC2 429012346 UHDNPVAWXYAQDG-UHFFFAOYSA-N 396.409 5.689 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1-c1ccccc1 430596500 OPTKSIAWJZWRKH-MRXNPFEDSA-N 392.528 5.375 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)CCCC1(C)C 434086035 YQAOQSLLGRVEEN-SFHVURJKSA-N 380.492 5.213 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(C(F)(F)F)ccc1F 437946458 ILOOXSDVYYCPKQ-CRAIPNDOSA-N 391.368 5.148 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1)C1CCCCC1 444099469 IYTIGHKBSQBNPO-HNNXBMFYSA-N 392.377 5.047 30 20 GKED C=CC[C@H]1N(Cc2nnc(-c3ccccc3Br)o2)CCCC1(C)C 444789819 GBRPIIYSHCCOSC-MRXNPFEDSA-N 390.325 5.066 30 20 GKED CCOc1ccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c(C(F)(F)F)c1 446022610 XISJKVQRTRCYNO-UHFFFAOYSA-N 395.274 5.514 30 20 GKED CC[C@@H](N[C@H](C)c1ccc(OC2CCCC2)c(OC)c1)c1ccc(C#N)cc1 447533820 SVLHHQJRJSHZSN-VGOFRKELSA-N 378.516 5.690 30 20 GKED CC(C)[C@@H]1C[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc21 447597073 FCCPOIJHWCJJRF-GOTSBHOMSA-N 387.527 5.566 30 20 GKED CC[C@H](CC(F)F)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457708076 MWMRBCUKIRICOX-PELKAZGASA-N 377.275 5.106 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@H](C)c1cccc(C#N)c1 461902203 LXUKNJOCRZSZFC-QGZVFWFLSA-N 398.466 5.253 30 20 GKED CCN(Cc1nc2ccc(Br)cc2o1)[C@H](C)c1ccc(C#N)cc1 463076168 HKFRCDZFCRWQLJ-CYBMUJFWSA-N 384.277 5.045 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)o2)cc1 463752516 CDLWEGLSVASXBE-MRXNPFEDSA-N 390.508 6.156 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(F)c(Br)cc1Cl)c1ccccc1 466454381 JFNGKBDKILJAGD-GFCCVEGCSA-N 395.659 5.268 30 20 GKED N#CCCCOc1cccnc1NC(=O)N(Cc1ccccc1)C1CCCCC1 466601481 NIUUOPUMUHLKDH-UHFFFAOYSA-N 392.503 5.131 30 20 GKED Cc1ccc([C@H]2C[C@@H](C)N(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 470581352 FGXPSKBUUQHIBQ-CTNGQTDRSA-N 385.511 5.272 30 20 GKED CCO[C@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)C(C)C 471274260 VJMQPVNEXGECPB-OAHLLOKOSA-N 388.455 5.101 30 20 GKED C[C@H](C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(F)(F)F 474259963 QEMCYUAHWAXBLB-GMSGAONNSA-N 381.238 5.014 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)cc1 474908480 CGMAXNJYWYMTFV-UHFFFAOYSA-N 375.403 5.066 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)[C@@H](C)Cc1ccc(OC)cc1 475564654 NHHVDJAJNWBSHW-IBGZPJMESA-N 394.559 6.032 30 20 GKED Cc1ccc(CN(C(=O)C[C@@H](CC#N)c2ccccc2)c2ccc(F)cc2)o1 475771603 LUMBVTVMFIEVIE-LJQANCHMSA-N 376.431 5.348 30 20 GKED CC(C)(C#N)CCC[S@](=O)Cc1ccc(Oc2ccccc2F)c(F)c1 476891507 PDNUYIAFNOQMES-SANMLTNESA-N 377.456 5.336 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2cccc(CCC(F)(F)F)c2)cc1 477089179 LGSWAUZPQVOSIE-UHFFFAOYSA-N 378.394 5.068 30 20 GKED COc1cc(C)c(NC(=O)c2ccccc2Oc2ccccc2C#N)cc1F 478786972 ZWDWJLUPFXRMMR-UHFFFAOYSA-N 376.387 5.059 30 20 GKED Cc1ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)cc1C(=O)N(C)C(C)C 481998313 KFGWQXXFNJKWCU-HSZRJFAPSA-N 375.516 5.227 30 20 GKED C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482068827 QJRWKKMLFNXGEF-OAHLLOKOSA-N 392.405 5.462 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 485473629 ZYRIGWBQKBFWTG-IEBWSBKVSA-N 391.895 5.017 30 20 GKED CC(C)(c1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1)C(F)(F)F 487174671 FLCHAXHXYVFKDI-IBGZPJMESA-N 388.433 5.691 30 20 GKED C[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 487299398 ORDAWANATRNSGK-UZLBHIALSA-N 388.433 5.750 30 20 GKED N#Cc1ccc(NCC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 487726918 QSQDVJMOIBVNJZ-UHFFFAOYSA-N 379.822 5.068 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1C)c1ccccc1 488695916 AVKAJSWMZSGAPG-KNQAVFIVSA-N 390.527 5.308 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(CN2CCSCC2)c1C)c1ccccc1 488713158 QYDXLGFLUOYVMY-QFIPXVFZSA-N 394.584 5.232 30 20 GKED C=C[C@@H]1CCCCN1Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 489442198 SKCYKBNKIRBZTG-HXUWFJFHSA-N 383.561 5.293 30 20 GKED CC(C)CN(C(=O)c1csc(CCc2ccccc2)n1)c1ccc(C#N)cc1 499956460 QSKVCSBWNJWKFG-UHFFFAOYSA-N 389.524 5.103 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(COCC(F)(F)F)c1 505006692 VUMAZUHMWKMFCR-UHFFFAOYSA-N 392.421 5.206 30 20 GKED C=CCSCCNC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 509188786 ZSBVVWHRRLETMT-SFHVURJKSA-N 399.560 5.231 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 509886477 OAUOZJUWZXQMIJ-WBVHZDCISA-N 380.435 5.021 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)nc(C(C)C)n1 517655576 JEXWFAVHFNSXIU-UHFFFAOYSA-N 386.455 5.019 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 518487723 PQXXUFYSFIGWDA-INIZCTEOSA-N 388.433 5.508 30 20 GKED C[C@@H](CN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 519199272 VQJZMFFKWMSREA-SFHVURJKSA-N 385.467 5.618 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@H](c4ccccc4)CC3)cc2)nc1 521109428 SBOQTNXMBDEGSH-NRFANRHFSA-N 397.478 5.155 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521259706 QAWNCWIFBXEZJQ-FXAWDEMLSA-N 379.529 5.616 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(F)ccc1Br 521725377 AUYGSOPECQCDSD-LLVKDONJSA-N 393.281 5.092 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3cccc(-c4ncco4)c3)c2)cc1 533137699 ZHXBWPLKTYPRGC-UHFFFAOYSA-N 380.407 5.209 30 20 GKED C=C(C)[C@H](CC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1)OCC 533684306 YUCFFRGONRSLAY-PMACEKPBSA-N 396.531 5.500 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C1CC1 534229829 OPQCVJRNBBMPOB-LSDHHAIUSA-N 397.548 5.770 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cccc(-c4ccoc4)c3)s2)cc1 535504125 QANHQBZMJGKPNN-UHFFFAOYSA-N 385.448 5.118 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3c(F)cc(Cl)cc3F)cc2)cc1 537145995 KCSRULHGUVISKU-UHFFFAOYSA-N 398.796 5.729 30 20 GKED COc1ccc([C@H](NCCC(C)(C)C#N)c2ccccc2)cc1Br 537361850 AKDCJJNKEVETHJ-LJQANCHMSA-N 387.321 5.077 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3cncc(F)c3)cc2Cl)cc1 538237020 GSJDXWAASWESRG-UHFFFAOYSA-N 395.821 5.109 30 20 GKED Cc1ccc(NC(=O)CSc2cccc(Cl)c2C#N)c(Br)c1 538943837 XNFIFNHZZDKXGJ-UHFFFAOYSA-N 395.709 5.013 30 20 GKED CC(C)(C)c1cc(NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)c(C#N)s1 539175663 YDBAVDOIUFTOLD-UHFFFAOYSA-N 399.903 5.407 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 540556214 YCRAGFQZQGYXER-OAHLLOKOSA-N 385.895 5.459 30 20 GKED FC(F)(F)CCc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 545587025 VFQZIPZSRPLDTH-UHFFFAOYSA-N 378.194 5.269 30 20 GKED C=CCOc1ccc(CN2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1Cl 554877646 OMYRSZCFACOOND-GOSISDBHSA-N 387.911 5.283 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N(C)[C@H](C)c1cccs1 554925027 PGORGZAHIARMQU-HUUCEWRRSA-N 386.496 5.002 30 20 GKED C=C(C)Cn1c(-c2ccc(C)s2)nnc1N1CCC(c2ncc(C)s2)CC1 555258802 LLOODSUCVHRLBZ-UHFFFAOYSA-N 399.589 5.040 30 20 GKED N#Cc1cccc(C2(N[C@H]3CCc4c(Cl)cc(Br)cc43)CC2)c1 556600632 HURVEQJOSXVOQI-SFHVURJKSA-N 387.708 5.240 30 20 GKED C[C@H]1C[C@H](C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCC1=O 562638404 CKAOBUMDJLUEJL-UONOGXRCSA-N 398.915 5.307 30 20 GKED CCCC(=O)Nc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1C 564528641 ITYDUYVKRMDSGX-UHFFFAOYSA-N 375.394 5.236 30 20 GKED COCCCC[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1 564537481 VUBAYTGPUHZYRU-HXUWFJFHSA-N 376.422 5.225 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1c(F)cc(F)cc1F 581029213 SPBDXDCOBPRNMT-NSHDSACASA-N 396.459 5.086 30 20 GKED Cc1csc(NC(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)c1C#N 581393832 JOCBPRBXMQQUPR-UHFFFAOYSA-N 392.267 5.451 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1csc(-c2ccccc2)n1 588337921 XKUZITKBRBFOEI-MOPGFXCFSA-N 388.496 5.114 30 20 GKED N#CC1(CC(=O)N2CCCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)CCCCC1 597758960 YFSRMMHEHQULPH-GOSISDBHSA-N 384.911 5.134 30 20 GKED C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1)c1cccc(C#N)c1 600847940 ZXDIHDIRPPLYJL-UQBPGWFLSA-N 395.506 5.709 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1cc(C#N)cn1C(C)(C)C 609358631 LDMNJVFDTVEGQO-UHFFFAOYSA-N 398.919 5.452 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3)cc2)c1 609429554 MPJBSKQVQBHDJE-UHFFFAOYSA-N 379.419 5.598 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1F 610019169 GAOVACJGCFXPJD-GUYCJALGSA-N 389.471 5.489 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@H](C)c2ccccc2C(F)(F)F)cc1 610239825 LCPCOHQYYUCFOZ-OAHLLOKOSA-N 390.405 5.154 30 20 GKED CCCN(CC(F)(F)F)C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 610683474 QLCAKPBQJSGEHY-UHFFFAOYSA-N 376.378 5.074 30 20 GKED N#CCn1c(C(=O)N2CCc3c(-c4ccccc4)cccc32)cc2ccccc21 613374634 NFHDCTFYJJYRNX-UHFFFAOYSA-N 377.447 5.035 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619126406 RAAIFDNVQKFVNW-LLVKDONJSA-N 387.339 5.174 30 20 GKED CC(C)n1cncc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647229834 KZWRQJQSKWBXDC-UHFFFAOYSA-N 383.311 5.366 30 20 GKED Cc1nc(Cc2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 647377157 TVLIZJHZMJNTAZ-OAHLLOKOSA-N 397.500 5.005 30 20 GKED FC(F)(F)c1cscc1CNC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 685612723 YLCRPHFLXNCVTO-RKDXNWHRSA-N 399.322 5.766 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 726478463 LORPSMWMHKSHNL-IBGZPJMESA-N 382.941 5.459 30 20 GKED Cc1cc(C)c(-c2nnc(SCCCOc3ccc(C#N)cc3)o2)c(C)c1 728442467 XOTJZGIGAFOSSG-UHFFFAOYSA-N 379.485 5.095 30 20 GKED CC(=NNc1cnnc2ccccc12)c1ccc(-c2ccccc2[N+](=O)[O-])s1 733750227 QKSOIKSUBSMFKP-UHFFFAOYSA-N 389.440 5.103 30 20 GKED Cc1ccc(N2CCCC2)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 734998082 MHCVQCADLASYLP-XMMPIXPASA-N 395.506 5.503 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)n1cccc1 735207186 OVGHWEQFHLVIFW-ZTBAGEHQSA-N 393.556 5.240 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cccc(OC(F)F)c3)c2)s1 740435984 ZAGDSDCITALJQD-UHFFFAOYSA-N 399.422 5.210 30 20 GKED CC(C)(C)c1nc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)no1 742261549 MGRCWHCNGJMBQJ-UHFFFAOYSA-N 396.878 5.083 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=S)Nc1ccccc1C#N 745709002 JKMJEFOERXFPDJ-MRXNPFEDSA-N 377.538 5.580 30 20 GKED N#C[C@H](C(=O)CCCc1ccc2c(c1)-c1ccccc1C2)c1nc2ccccc2[nH]1 747561128 HYMVOVQDTBDDMY-JOCHJYFZSA-N 391.474 5.333 30 20 GKED CC(C)[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 747930113 YAADZTKZIMZGEF-MGPUTAFESA-N 376.422 5.483 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2coc3cc(F)ccc23)cc1 748296808 RZOXSWFAKZGDEG-JOCHJYFZSA-N 384.410 5.409 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccc(C#N)cc1 748681628 MCOBSYRXSNGNBL-CYBMUJFWSA-N 382.872 5.182 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1cc(-c2ccc(Cl)s2)nc2ccccc12 751335487 DUDJNUILWCHPNK-ZDUSSCGKSA-N 383.904 5.238 30 20 GKED O=C(Oc1c(F)c(F)cc(F)c1F)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 751826012 PHALUDYCDOAEIL-NAOULOEMSA-N 396.302 5.297 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2cnc(-c3ccccn3)s2)cc1 753142514 CZTHLUCHMFVMFS-KTKRTIGZSA-N 382.872 5.233 30 20 GKED COc1ccccc1-c1ccc(/C=C/C(=O)c2ccc3c(c2)CCC(=O)N3C)cc1 754686626 KFWWWEKMKBFKJK-OQLLNIDSSA-N 397.474 5.167 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3c(s2)CCCC3)cc1OCCCC#N 764434408 WTOFZUXBQFSWNS-CSKARUKUSA-N 381.497 5.214 30 20 GKED CC(=NNc1ccnc(Br)c1)[C@@H](C)c1nc2ccccc2s1 769813698 MLRLZKSRTWWXSY-SNVBAGLBSA-N 375.295 5.045 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)ccc1OC1CCCC1 776154804 WDVQLSPMZHZKOK-ROUUACIJSA-N 394.515 5.331 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CN[C@H](C)c1cccc(C#N)c1 776219299 MIFJWRMEPNXCQD-QGZVFWFLSA-N 392.934 5.431 30 20 GKED C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)c1cccc(C#N)c1 785442616 QYXGWUNYAHWRFD-LLVKDONJSA-N 389.958 6.042 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2c(Br)cccc21 788355360 QBYLGMPZXTVKDV-VURMDHGXSA-N 388.208 5.137 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570857 JZUPICDNSBYTNO-UQTJOTSZSA-N 392.446 5.739 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1 810134980 GQRSQKYNEQZNSA-QFIPXVFZSA-N 393.531 5.003 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813215208 UGJDQSYYLHUMBC-KRWDZBQOSA-N 390.405 5.178 30 20 GKED N#C[C@H](C(=O)Cc1csc(-c2ccccc2Cl)n1)c1nc(C2CC2)cs1 842937801 IZWGGUODIDDVKR-CQSZACIVSA-N 399.928 5.216 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc(C2(NC(=O)OC(C)(C)C)CC2)no1 904986205 LCZMGRFEQNGEPT-QGZVFWFLSA-N 383.492 5.072 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1ccc(O)cc1 916134907 WUHVEGPFVJYIGM-PQMHYQBVSA-N 377.827 5.194 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCc1ccc2ccccc2c1 917424144 DOFBPOXYWKIAQL-HSZRJFAPSA-N 398.506 5.245 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COc2ccccc2)c1 918051495 MHPORCDKWTXUPA-UHFFFAOYSA-N 399.494 5.581 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1sc2ccccc2c1C(=O)O 1776011655 CXVAHDHWKIGMPG-UHFFFAOYSA-N 395.871 5.637 30 20 GKED C[C@H]1C(=NNc2c(Cl)cc(Cl)cc2Cl)CC[C@H](C(=O)O)C1(C)C 1776014723 TWYNTSUGBCLQKQ-WCBMZHEXSA-N 377.699 5.572 30 20 GKED C=CCc1cc(C)c(OCCCN2CC[C@@H]3C[C@H](CC(=O)O)CC[C@H]3C2)cc1C 1776186202 PKZYIWGYAJGCKA-MZYLBHOOSA-N 399.575 5.014 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](CC(=O)O)c2ccccc2)cc1 1776786223 CDYBSUCBWZTJMT-QFIPXVFZSA-N 383.532 5.384 30 20 GKED CCCCCCCCCCCN(C)Cc1oc(-c2ccccc2)nc1C(=O)O 1776787745 JTCONNQMGUVQDV-UHFFFAOYSA-N 386.536 6.002 30 20 GKED CCCCCCCSc1ccc(C(=O)N(C)c2ccccc2C(=O)O)cc1 1776787792 CUBTVSGJMVTZEL-UHFFFAOYSA-N 385.529 5.724 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)s1 1777462985 YZUQNIGMTOQRJV-PJABCKPXSA-N 375.449 5.112 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)[C@H](CC=C)C(=C)C)cc2)CCC1 1789458310 WAJCQEVMUXSCTQ-JOCHJYFZSA-N 392.543 5.083 30 20 GKED Cc1ccc(SCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 51655907 GWXLHBUOKFIXNW-MRXNPFEDSA-N 399.466 5.407 30 20 GKED Cc1sc(/N=C(\O)c2sccc2C#N)nc1-c1ccc(OC(F)F)cc1 52029299 DJJLOFBISJOYIN-UHFFFAOYSA-N 391.424 5.289 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccncc1 66955763 FWUQOQYPBLXFMT-PXNSSMCTSA-N 394.544 5.625 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2sc(-c3ccc(Cl)s3)nc2C)n1 69283723 FQXQMXFJTJIOKO-VIFPVBQESA-N 379.919 5.088 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cccc(OCc2cccs2)c1 108200792 KRAVWDDGBUKQQF-UHFFFAOYSA-N 394.521 5.585 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2ccsc2)ns1 109108864 BZESOFCBXFHREV-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C=CCc1cc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc(OC)c1O 113339590 ZDPQLXLDTRCTEB-HNNXBMFYSA-N 380.513 5.104 30 20 GKED CC(C)(C#N)CCCNc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1 153617395 WTBVLMWMTCVHDO-UHFFFAOYSA-N 381.907 5.171 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cccc(C#N)c1 181682154 LJKNETUZSONVEL-FQEVSTJZSA-N 392.506 5.321 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccc(C(C)C)cc1)=C(/S)NC(C)(C)CC 186980205 CZLRAIOETHTKBE-UHFFFAOYSA-O 397.608 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc(C(F)(F)F)cs1 191419837 DKLMLENFLXHMIY-UHFFFAOYSA-N 383.439 5.336 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 193054329 VSGZPMZORFDKJG-NRFANRHFSA-N 377.488 5.255 30 20 GKED N#Cc1c(Cl)nsc1NCc1nc2c(s1)C[C@H](c1ccccc1)CC2 302192932 CFQRIXBXGFVKPT-GFCCVEGCSA-N 386.933 5.009 30 20 GKED O/C(CC/N=C(/O)C1CCCCC1)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329524416 SDWGRYKKSAFFQA-LJQANCHMSA-N 386.540 5.259 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)CCO1 329684172 ZKVDTWZWXOVBEP-PSTGCABASA-N 391.309 5.079 30 20 GKED C[C@H](N[C@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1cccc(Cl)c1 329802877 ZHTAFXSJLVRABM-YWZLYKJASA-N 384.907 5.000 30 20 GKED CCn1ccnc1[C@@H]1CCCCN1C(O)=Nc1ccccc1N(C)C1CCCC1 330286177 AGFNPKUAYRNPHS-NRFANRHFSA-N 395.551 5.055 30 20 GKED C=CCn1c(Sc2nc(C(F)F)nc3ccc(Cl)cc23)nnc1C1CC1 413039419 UPBKLCSGMFMGOK-UHFFFAOYSA-N 393.850 5.027 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1ccc(C(F)(F)F)cc1 425423012 NNFYFBSBRABFJJ-UONOGXRCSA-N 375.394 5.041 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(-c3ccc(Cl)s3)cs2)c1 429966590 DRHZBQWGADPHKZ-UHFFFAOYSA-N 391.930 5.393 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430603119 MTPFRSGPQWWOCN-CYBMUJFWSA-N 399.903 5.548 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 435526325 NGBSJCZHPDBUCM-GFCCVEGCSA-N 394.302 5.394 30 20 GKED N#Cc1ccc(NC(=O)c2csc(-c3ccccc3F)n2)cc1C(F)(F)F 443891531 HXRHTXYELFOMCQ-UHFFFAOYSA-N 391.349 5.092 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c[nH]nc3-c3ccsc3)cc2)c1 444004807 MUCLPZBSVKGREC-UHFFFAOYSA-N 386.436 5.054 30 20 GKED Cc1cnc([C@@H](NCCC(C#N)(c2ccccc2)c2ccccc2)C2CC2)s1 444690381 SGPFIWPSJOXHJU-QFIPXVFZSA-N 387.552 5.392 30 20 GKED N#CCCC[C@H](NC(=O)N1CC=C(c2c(F)cccc2F)CC1)c1ccccc1 458856938 ZDAXYODBDQXWSJ-NRFANRHFSA-N 395.453 5.199 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)[C@@H](C)c2cccc(C#N)c2)cc1 462135245 PJFWGHSMIKDARG-OALUTQOASA-N 398.506 5.557 30 20 GKED CCc1cccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 468647175 CQEDBHCDJWAURY-INIZCTEOSA-N 384.570 5.515 30 20 GKED CCCOc1ccccc1[C@@H](CC(C)C)NC(=O)N(C)Cc1ccc(C#N)cc1 470031889 KRPVAWDVZSXBJE-JOCHJYFZSA-N 393.531 5.276 30 20 GKED CCCOc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 474718858 ZPBXYUYADGNDPR-QGZVFWFLSA-N 397.544 5.500 30 20 GKED Cc1sc([C@H](C)NC(=O)c2cc(C#N)cs2)nc1-c1ccc(Cl)cc1 479214124 WJUQMOVBVBWERH-JTQLQIEISA-N 387.917 5.196 30 20 GKED N#Cc1ccccc1COc1ccc(-c2nc([C@@H]3CCC(F)(F)C3)no2)cc1 482625803 XMNOGNFVSVDHIV-OAHLLOKOSA-N 381.382 5.090 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1nc2ccccc2o1 483480722 ORTQRCDGAXBWRB-CYBMUJFWSA-N 391.814 5.189 30 20 GKED CCCOC1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCCCC1 483638009 IVSHSFWXGQKLIF-KRWDZBQOSA-N 389.565 5.332 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1 490228093 YSDKYHADPRRXTI-KKSFZXQISA-N 379.529 5.662 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)[C@@H](C)c1ccc(C#N)cc1 499369185 AYPBTIRKXDWKPS-PNHOKKKMSA-N 397.316 5.034 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C)o1 499914600 UWHZATUKASHBQZ-MBPVOVBZSA-N 376.500 5.063 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 500102342 CDFXIBJGUFXRKJ-CYBMUJFWSA-N 395.381 5.027 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1sc2nc(C(F)(F)F)ccc2c1C 502736676 HYZSAVSRKVAHFK-UHFFFAOYSA-N 396.459 5.513 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1ccc(F)c(F)c1 510204732 AIJLEKRBTIHAJU-ZDUSSCGKSA-N 395.434 5.018 30 20 GKED CCn1nc(C(C)C)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 512851912 QVTIVNHWZWGGMW-UHFFFAOYSA-N 388.471 5.251 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)CNc2ccccc2SC[C@@H](C)C#N)cc1 519425154 VZMVLLPFFRQHTF-DLBZAZTESA-N 381.545 5.502 30 20 GKED C[C@@H](SCC(=O)Nc1ccccc1Cc1ccccc1)c1ccc(C#N)cc1 522840057 ZUIJBORXSUPBIK-GOSISDBHSA-N 386.520 5.582 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1 531669472 QCUBGGOQTISIFL-UHFFFAOYSA-N 398.285 5.005 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1 534622136 QAOGRRCIPWKQHM-UHFFFAOYSA-N 375.859 5.270 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 540220328 YTZQCCSWPPYPOQ-FGCOXFRFSA-N 397.522 5.204 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 540792776 AJAGIFWNHOLEOE-UHFFFAOYSA-N 393.443 5.167 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(F)c(Br)c(Cl)c3)cc2)CC1 560809090 LXTSMCJBVVMPLZ-UHFFFAOYSA-N 393.643 5.049 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N(Cc3cccs3)C3CC3)cc2)ccn1 573647263 JMAYKVMEKXPMLG-UHFFFAOYSA-N 390.468 5.004 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3nc4ccccc4s3)sc2c1 591020086 PZWWXCRUHLUBLX-LBPRGKRZSA-N 382.897 5.963 30 20 GKED CCOc1ccc(C[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 591059643 KTOPYMCTPWJOCL-DLBZAZTESA-N 382.529 5.297 30 20 GKED N#CCc1ccc(NC(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)cc1 604083772 XYOUWRVAJMGCJV-IBGZPJMESA-N 398.304 5.178 30 20 GKED Cc1cc(C(=O)[C@H](C)Sc2ccc(C#N)cc2F)c(C)n1Cc1ccco1 607760985 SZNMQLDNOBDLDZ-HNNXBMFYSA-N 382.460 5.121 30 20 GKED C[C@@H](S[C@H]1CCCc2ccccc21)C(=O)N(CCC#N)c1ccc(F)cc1 608801741 MIKFFMRPKSCBTK-IERDGZPVSA-N 382.504 5.272 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 609682756 AWGHHAYWXHJDOW-RXVVDRJESA-N 397.478 5.760 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(OC(F)F)cc3)c2)cc1 609985906 PNRZNGOSKPEQPH-UHFFFAOYSA-N 379.366 5.156 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1cccc(C#N)c1 610543460 WCGYMDPROKMGPU-UONOGXRCSA-N 395.915 5.118 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H]2c2cccc(F)c2)cc1 611042197 JKTHYHIBAKYGTG-OAQYLSRUSA-N 387.414 5.469 30 20 GKED CN(Cc1ccccc1N[C@H]1CCC[C@H](C#N)C1)C(=O)c1cc2ccccc2o1 613255273 WBVMYSLPHOFPKJ-PXNSSMCTSA-N 387.483 5.199 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 613292718 ROHLUNYALSHJLN-NRFANRHFSA-N 377.447 5.493 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1C[C@]1(F)c1ccccc1 619130093 XPECDNAKJLCIJM-ZFWWWQNUSA-N 385.323 5.041 30 20 GKED FC(F)(F)c1ccc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc1 642186724 VBZLVWFNKQPNKY-MYJAWHEDSA-N 380.254 5.422 30 20 GKED CC(C)Cc1noc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 647633775 BUSXWBWJPCAGNM-UHFFFAOYSA-N 399.310 5.170 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CCC(C)(F)F 671290300 GNNHTKDJTVSONQ-UHFFFAOYSA-N 377.275 5.118 30 20 GKED Clc1ccc(-c2nc3c(s2)C(=NNc2ccc(Cl)nn2)CCC3)cc1 728427348 NZNCNERHTILZFR-UHFFFAOYSA-N 390.299 5.059 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)c1 733805252 PJDSJTHVYFYPOQ-GMAHTHKFSA-N 391.515 5.031 30 20 GKED O=C(/C=C\c1ccc(OCC(F)(F)F)cc1)c1cccc(-c2ccncc2)c1 741472791 KFEHIPOOKBFYHY-TWGQIWQCSA-N 383.369 5.586 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)c2ccccc12 743056761 LGKJGSSZOOZEOD-XYOKQWHBSA-N 382.419 5.327 30 20 GKED CC(=NNc1oc(C(C)C)nc1C#N)c1ccc2c(c1)Nc1ccccc1S2 745612270 VHGXPDMWYQHLPA-UHFFFAOYSA-N 389.484 5.714 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3cc4ccccc4o3)cc2c1C 750905598 OICWFVPQBPUVLI-BQYQJAHWSA-N 377.421 5.034 30 20 GKED CC[C@@H]1CC[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)O1 757305211 NOMOZACQHVTDPC-KFNAQCHYSA-N 395.311 5.251 30 20 GKED N#Cc1c(NC(=O)/C=C\SCc2ccco2)sc2c1-c1ccccc1CC2 760152348 QSQVESVJIMTIDX-LUAWRHEFSA-N 392.505 5.364 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccnc(N3CCCCC3)c2)cc1 765058429 GNJSMRZVKSZTNM-GOSISDBHSA-N 385.939 5.054 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(Br)c(F)c1 767733997 BGWIAHCDJVSGQX-ALCCZGGFSA-N 389.249 5.003 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NCc3ccc(OCC#N)cc3)cc2)c1 772959375 KZTCQOTYRJLBJA-FQEVSTJZSA-N 386.495 5.327 30 20 GKED CN1C(=O)CCc2cc(/C=C3\CCSc4ccc(Cl)cc4C3=O)ccc21 774129276 DQQQBZAMZTUYIY-RVDMUPIBSA-N 383.900 5.011 30 20 GKED CC(C)CCn1ccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 775488722 ROYYKVDNEOWGCR-NRFANRHFSA-N 387.487 5.229 30 20 GKED N#Cc1ccc(SCc2nnc(-c3cccc(F)c3)o2)cc1C(F)(F)F 779462704 QMNGYAWYKUIOSQ-UHFFFAOYSA-N 379.338 5.058 30 20 GKED CCC[C@H]1C[C@@H](C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)CCO1 780167567 WCIVYNYHGLRPDZ-REWPJTCUSA-N 391.511 5.025 30 20 GKED O=C(/C(=C\c1scnc1C1CC1)c1nc2ccccc2s1)c1ccccc1 782303484 ZZMJXLVYHSFCAZ-FOWTUZBSSA-N 388.517 6.054 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CC(c3ccc(F)cc3)C2)cc1 794220581 HCTLDIJUJPVION-SLXFGWRHSA-N 384.454 5.613 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1)c1nccc2ccccc12 796898331 GBZOJXGSSYYSJJ-OTWHNJEPSA-N 396.368 5.113 30 20 GKED CC(C)[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccnc1 797944251 AXBHIULQBUVZEV-KSSFIOAISA-N 397.450 5.099 30 20 GKED Cc1cccnc1[C@@H]1CCCC(=NNc2nc(C(F)(F)F)nc3ccccc23)C1 799106283 ARBCHXMGZGHQRY-CQSZACIVSA-N 399.420 5.478 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCC[C@@H]([C@@H]4CCOC4)C3)nc2c1 799111576 TZLOHCHCBKWGQQ-VXGBXAGGSA-N 383.439 5.310 30 20 GKED COc1cc([C@@H](C)N[C@H](CCCC#N)c2ccccc2)ccc1SC(F)F 815636044 NYOMTNUERGPYBG-CRAIPNDOSA-N 390.499 6.096 30 20 GKED C[C@@H](NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl)c1ccc(C#N)cc1 863857429 OKLNYCZSBCDFPW-CYBMUJFWSA-N 399.878 5.050 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3cccc(OC(F)F)c3)c(Cl)nc21 913617544 IVHOSNYPASLPLQ-VOTSOKGWSA-N 391.805 5.163 30 20 GKED CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)[C@@H]1CCc2ccccc21 915351638 AMNNOUBUPXTULQ-BJKOFHAPSA-N 381.479 5.493 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=Cc1ccc(F)cc1 916273138 TVAIJHFVYSXJJP-UHFFFAOYSA-N 397.862 5.108 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(C(F)(F)F)c2)cc1 916946947 BQCKAOSPUUQAPM-ACJLOTCBSA-N 388.389 5.180 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NNc1cccc2ncccc12 917548741 RCPXTOIVGMWGHW-UHFFFAOYSA-N 375.863 5.137 30 20 GKED COc1cccc(NN=C(C)c2ccc(Oc3ccc(C(=O)O)cc3)cc2)c1 1776027831 KKDCJTSZYGWGFE-UHFFFAOYSA-N 376.412 5.022 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(O)c(C(=O)O)c2)cc1 1776125499 KEUKNNVENABIEH-BNXPMYBGSA-N 396.483 5.582 30 20 GKED CC(C)[C@@H]1/C(=C/c2ccc(-c3cccc(C(=O)O)c3)s2)C(=O)c2ccccc21 1776308692 KNALKDSRUHQQCO-WLJFKGHSSA-N 388.488 6.133 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2cccc(C(=O)O)c2Cl)cc1Cl 1776354573 MKFYJPLNRKFYIJ-SOFGYWHQSA-N 379.239 5.375 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)Cc2ccccc2)cc1 1776788033 NCEXRJLUMMWSSZ-QFIPXVFZSA-N 383.532 5.211 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)[C@H](C)c2ccccc2)c1 1776789042 MPYGWLPAMVTVLU-AUSIDOKSSA-N 383.532 5.382 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccccc3C(=O)O)cc1)CC2 1777371127 OJZOISSDOQEHHK-XMHGGMMESA-N 384.431 5.273 30 20 GKED COc1cc(/C=C2\CC/C(=C\c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1OC 23609167 HAYKVTYSKIQRQV-BVXMOGEKSA-N 399.830 5.095 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccc(Cl)s1)c1nc2ccccc2n1C(F)F 51655975 DXMPZGQQPVASPY-ZRQQLDRUSA-N 377.803 5.036 30 20 GKED COc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1F 53819679 OJMSAWSRQQMCSY-UHFFFAOYSA-N 392.455 5.251 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc(C(C)C)nc2c1c(C)nn2C(C)(C)C 63962208 YCAGGCVOWHJOLD-UHFFFAOYSA-N 389.503 5.051 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1F 66955182 VPVNYBXSSCGVKO-UONOGXRCSA-N 387.480 5.111 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@@H]2c2ccc(OC)cc2OC)c1 72093575 PFXCNKZSTVCMFC-OAQYLSRUSA-N 396.487 5.028 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1csc(-c2ccccc2)n1 108237719 ZRYOFJRARGTKGY-OAHLLOKOSA-N 393.537 5.243 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1 117011451 DNVMKSXLCUOTIS-UHFFFAOYSA-N 385.552 5.044 30 20 GKED C[C@H](Sc1nnc(-c2ccccc2Br)o1)c1ccc(C#N)cc1 118172836 JGIPBDWGBRGBBT-NSHDSACASA-N 386.274 5.224 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1cccc2ncccc12 128672934 YQJRGRFGSBYHKJ-UHFFFAOYSA-N 397.409 5.314 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2c[nH]c3ccc(OC)cc23)CC1)c1ccccc1 159332148 WGMXPMDRABEQKC-GOSISDBHSA-N 388.511 5.242 30 20 GKED C[C@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cccc(C#N)c1 174431384 LOOKXKSEGROOFE-ZDUSSCGKSA-N 387.430 5.551 30 20 GKED Cc1cc(CCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c(C)s1 175947531 MJCIUVZHPBHLEM-OAHLLOKOSA-N 387.455 5.309 30 20 GKED N#C[C@@H](COC(=O)c1cc(-c2ccccn2)ccc1Cl)Cc1cccs1 180085456 BNFJXUJRGFTPCY-AWEZNQCLSA-N 382.872 5.003 30 20 GKED Cc1cc(C#N)ccc1CSc1nnc(-c2ccncc2)n1C1CCCCC1 186294726 QSYVHOPYMGIWNG-UHFFFAOYSA-N 389.528 5.318 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C2SCCS2)cc1 189873968 AABZQOGZTJUMAQ-UHFFFAOYSA-N 383.582 6.269 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(F)c(Br)c1 189893572 LAYXNBYCUDXRQJ-UHFFFAOYSA-N 390.296 5.621 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)[C@H]1OCCc2sccc21 294196738 VHSPYJXQFHKDRW-PJIJBLCYSA-N 386.542 5.031 30 20 GKED Cc1ccc2oc(SCC(=O)Nc3sc4c(c3C#N)CCCCC4)nc2c1 303681465 YYSAYWBTHSWRDQ-UHFFFAOYSA-N 397.525 5.069 30 20 GKED Cc1cccc([C@@H]2CCCCN2C(O)=Nc2ccc3c(c2F)CCN=C3O)c1C 329134223 QAHHWTSYIFTLTH-FQEVSTJZSA-N 395.478 5.076 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(F)(F)F 361442891 UBYUNGSBSPZTJE-HKUYNNGSSA-N 387.405 5.095 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)c1ccc(F)cc1C(F)(F)F 410411546 QMWOOEJRVULPSD-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1cccc(OC(F)F)c1 424662930 MOSNAMBTSXASRD-CQSZACIVSA-N 390.455 5.254 30 20 GKED CCCc1ccc(-c2nc(NC(=O)c3ncc(C#N)cc3Cl)sc2C)cc1 427925956 PIXJPRWROFMZAZ-UHFFFAOYSA-N 396.903 5.243 30 20 GKED CCCc1ccc(OC)c(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 432298802 ZEFVUIHCZDCWDD-MRXNPFEDSA-N 398.528 5.059 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC(C)(C)[C@@H]1C(C)C 432852745 RNBZGRDRMRPAJQ-QFIPXVFZSA-N 391.515 5.344 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](c2ccccc2)C(C)(C)C1 434223608 VXBFZVKFAWOXEK-IEBWSBKVSA-N 393.556 5.596 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(OCc3ccncc3)cc2)CCCC1(C)C 444908018 QKJQBRQMEBBFFV-OAQYLSRUSA-N 379.504 5.259 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)CCCC1(C)C 444912011 LDKIOUFFQIPSQC-LJQANCHMSA-N 380.492 5.176 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)[C@@H](C)c3cccc(C#N)c3)s2)cc1 462052403 RDYQQZLCGGAWMD-HOTGVXAUSA-N 389.524 5.280 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3cc[nH]c23)cc1 463614049 REEYLBFCQQGFKH-UHFFFAOYSA-N 383.407 5.093 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ncccc1C 466517138 HXXYKOOQJWZERA-UHFFFAOYSA-N 391.858 5.374 30 20 GKED N#C[C@H](C(=O)c1cccc2ccsc12)c1nc(-c2c(F)cccc2F)cs1 467838962 MJFHGPFUANDMFO-CYBMUJFWSA-N 396.443 5.793 30 20 GKED C=CCCN(C)C(=O)C/C(=C/c1cccc(OC)c1)c1nc2ccccc2s1 468180442 QVCLDVVERQIFLM-JXAWBTAJSA-N 392.524 5.270 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 468814053 DEEQMNZIXXACKL-UHFFFAOYSA-N 376.378 5.049 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)Nc2cc(C#N)ccc2C)cc1 473334306 OOYQYUYJKLQXBB-QGZVFWFLSA-N 385.467 5.425 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2OCc2ccc(F)cc2)n1 474436667 VKLJXMGHHVQLEM-SFHVURJKSA-N 394.471 5.475 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 477042453 ILFRMCWPWBHGFP-JLTOFOAXSA-N 397.425 5.297 30 20 GKED CN(Cc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1 477153636 VZBLSXIFNMHGRR-OAQYLSRUSA-N 383.495 5.349 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc(C#N)cc1 480381433 SOETTXQPTYXNIU-INIZCTEOSA-N 382.423 5.105 30 20 GKED C[C@@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)c(F)c1 480750414 RPRKWNFSKIPMAZ-NSPYISDASA-N 391.259 5.401 30 20 GKED Cc1ccc([C@@H](Cn2ccnc2)N[C@@H]2CCCCc3cc(C#N)ccc32)c(C)c1 481649414 FAILGIFDLYHHPY-JWQCQUIFSA-N 384.527 5.170 30 20 GKED Cc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cc1C(=O)N(C)C(C)C 481998314 KFGWQXXFNJKWCU-QHCPKHFHSA-N 375.516 5.227 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)c1noc(C)n1 483114863 FINSTKUKLLDCKU-LJQANCHMSA-N 396.878 5.061 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)c2C(C)C)cc1 483835552 CHCWZAIBSBQDAV-QGZVFWFLSA-N 387.487 5.059 30 20 GKED Cc1ccccc1Cc1nnc(CNc2ccc(Oc3ccccc3)c(C#N)c2)o1 488135751 FRBUXLFSEMDHQG-UHFFFAOYSA-N 396.450 5.245 30 20 GKED COCc1ccsc1C(=O)N(Cc1ccc(C#N)cc1)c1ccc(F)cc1C 489385356 JRMDYKCSSREGPK-UHFFFAOYSA-N 394.471 5.061 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cnn(CC(C)C)c1C1CC1)c1ccc(F)c(F)c1 497672873 QLVQZAKSINRDDW-IBGZPJMESA-N 388.462 5.134 30 20 GKED CC(C)c1ccc(-c2nc(Cn3cc(C#N)c(=O)c4ccccc43)cs2)cc1 502598619 DYQQZEAVOGGBDR-UHFFFAOYSA-N 385.492 5.168 30 20 GKED N#Cc1cnccc1/C=C/c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 504711572 JYBUGIRDKIDIQZ-SNAWJCMRSA-N 394.261 5.683 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccnc3ccccc23)cc1 505623105 VLIBBARRBZSJHY-UHFFFAOYSA-N 395.418 5.160 30 20 GKED CCN(C(=O)c1sc(-c2ccc(C)cc2C)nc1C)c1ccc(C#N)cc1 510375930 RJAUFNCZIGLGEE-UHFFFAOYSA-N 375.497 5.274 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)sc2cc(F)ccc12 513198396 CWPDOBJHDFOVGL-LBPRGKRZSA-N 384.501 5.853 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 517428971 VXNVSTBTOQWVDP-DJJJIMSYSA-N 398.293 5.101 30 20 GKED N#Cc1cccc(F)c1CC(=O)N(c1ccccc1)c1nc2ccccc2s1 521669589 CPOXIHVNSBOXEK-UHFFFAOYSA-N 387.439 5.214 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H](c2ccccc2)[C@@H]2CCCO2)c1 521831518 ZNKSMRSWVHLZOC-IZZNHLLZSA-N 398.506 5.147 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)c1 525143781 CQDKBSUNNBSWQV-NRFANRHFSA-N 390.870 5.565 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)CCc2ccc(C#N)cc2)cc1 525529008 MMZIPRKRIWAQHB-LJQANCHMSA-N 398.506 5.386 30 20 GKED CC(C)(C)c1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)no1 525658450 YYLUATJMNPIFRF-QGZVFWFLSA-N 393.874 5.533 30 20 GKED CC(C)c1nc2cc(NC(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)ccc2o1 531221184 LTUUKXPFOPJZSF-AZUAARDMSA-N 388.471 5.255 30 20 GKED Cc1cc([C@@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)ccc1F 534036675 RCXLORBNFLASBN-SZNDQCEHSA-N 397.519 5.659 30 20 GKED C=CCn1c(S[C@@H](CCOC)c2ccccc2)nnc1-c1ccc(OC)cc1 534057124 VHVIQCQXCGESRP-FQEVSTJZSA-N 395.528 5.010 30 20 GKED Cc1cccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c1Br 538071063 AFQGNHDSVBXLJV-UHFFFAOYSA-N 377.307 5.241 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(C#N)c(F)c2)c2ccccc2OC)cc1 540706467 JWAYDQRKYUQKRZ-VOIUYBSRSA-N 390.458 5.155 30 20 GKED C[C@@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)c(F)c1 540710421 SMOCRJZVBHVPMY-IVZQSRNASA-N 379.866 5.380 30 20 GKED N#CCc1ccc(NCc2cnc(-c3ccc(Br)cc3)s2)cc1 544725585 MQZJWIOUQVSAIZ-UHFFFAOYSA-N 384.302 5.251 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N(Cc3ccc(C#N)cc3)C(C)C)ccc2c1 546731381 UBYWTTDRARANTB-SFHVURJKSA-N 386.495 5.261 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(-c2ccccc2)o1 546864094 TUDKEBVQJISTDA-AWEZNQCLSA-N 393.855 5.403 30 20 GKED COCCCCc1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 547087006 QWMNKXYZTIMIFT-UHFFFAOYSA-N 383.835 5.023 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC([C@H](F)c3ccccc3F)CC2)c1 554426328 PBFAABQNTDQXHU-NRFANRHFSA-N 386.442 5.345 30 20 GKED N#CC[C@H](Cc1nc(Cc2c[nH]c3ccc(Cl)cc23)no1)c1ccccc1 554807757 QTQVYLNPXRZSID-OAHLLOKOSA-N 376.847 5.035 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1csc(-c2ccccc2F)n1 556201639 HMMOLKWIHGATKE-JXFKEZNVSA-N 379.504 6.035 30 20 GKED COc1ccc([C@@H](CCC#N)NCc2cnc(-c3ccc(Cl)cc3)s2)cc1 556606130 UHMKQXQTTFVRIM-HXUWFJFHSA-N 397.931 5.607 30 20 GKED C[C@H](N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1Cl 560584783 JQXNKHUJZJIGGH-BBATYDOGSA-N 383.706 5.293 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCc2sc(Cl)cc21 566647690 JAFLGUYMAFTXRW-AAEUAGOBSA-N 391.949 5.605 30 20 GKED C=CCc1cc(C(=O)Nc2cc(Cl)ccc2C(F)(F)F)cc(OC)c1OC 567198067 WJJLYDHZFDNIIU-UHFFFAOYSA-N 399.796 5.357 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cncc(C(F)(F)F)c3)n2)cc1 570759012 WPCXZDUEHLJXPW-HNNXBMFYSA-N 387.386 5.022 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)Nc1sc(-c2ccccc2)cc1C#N 575156022 AMZLQBTXHAATRY-MRXNPFEDSA-N 397.503 5.652 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2c(C)noc2C)nc1C 575754566 NZRZWLRMASCKKH-UHFFFAOYSA-N 395.528 5.828 30 20 GKED O=C(Nc1cccnc1C(F)(F)F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 577896443 IBZPXUOWMCNXQL-GFCCVEGCSA-N 395.278 5.055 30 20 GKED Cc1cc(Cl)cc2cc(-c3noc([C@@H](C#N)Cc4ccc(C#N)cc4)n3)oc12 579458187 AXQGHHHJYWALBL-MRXNPFEDSA-N 388.814 5.166 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1oc2ccccc2c1CSC 588001572 AQJDXELHFLVRQU-UHFFFAOYSA-N 397.544 5.292 30 20 GKED N#CCCCn1cc(-c2nc(-c3cccc4ncccc34)no2)c2ccccc21 589153351 VCRLBKHDFDAOFL-UHFFFAOYSA-N 379.423 5.210 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)C1(c2cccc(C(F)(F)F)c2)CC1 589322695 NGECURRTLDRJAR-UHFFFAOYSA-N 377.381 5.091 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)[C@@H]1c1ccccc1 589363272 IMNNSBDODWNBGD-JOCHJYFZSA-N 398.466 5.361 30 20 GKED COc1ccc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)cc1F 603532705 LTBISCXGUGKOJE-UHFFFAOYSA-N 392.405 5.001 30 20 GKED Cc1ccc2cccc(NC(=O)c3ccccc3Sc3ccccc3C#N)c2n1 608947243 SQFZMOBKYMBKMY-UHFFFAOYSA-N 395.487 5.818 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Cc2cccc(Cl)c2)cc1 609012141 PGQVIDFUXYFWFB-UHFFFAOYSA-N 392.842 5.194 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)sc2n1 609376372 ACJBIBGODLROAQ-GFCCVEGCSA-N 381.526 5.417 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)c1 609407717 ITZXOXSHLSMYHC-MSOLQXFVSA-N 378.378 5.055 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 610163142 MMPRWNVDPAXDPD-MRXNPFEDSA-N 395.812 5.566 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)ccc2o1 611094192 SXKMXOLVEPWEHW-UHFFFAOYSA-N 388.254 5.556 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)c(Cl)c1 619423374 FMALPYBVDSPUGY-ZFWWWQNUSA-N 377.246 5.070 30 20 GKED C=CCn1c([C@H]2CC[C@@H](C)O2)nnc1N1CCCC[C@@H]1c1ccc(Cl)cc1 624841679 JEARTLHJIXBTGB-ATZDWAIDSA-N 386.927 5.089 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 678451757 PFWGIRRCUVYADS-DNVCBOLYSA-N 391.437 5.477 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(OC)cc3OC)s2)cc1 727974562 KKUPAIXQFCBISY-XYOKQWHBSA-N 395.480 5.040 30 20 GKED N#Cc1cc(F)ccc1COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 728613145 SQOAWBJUMZQZBO-UHFFFAOYSA-N 394.016 5.063 30 20 GKED CC(C)CCO[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 729069945 JIZXRJFEBMIJCY-CJNGLKHVSA-N 376.909 5.091 30 20 GKED COc1cc(C#N)ccc1OC(=O)[C@H](Sc1ccc(F)cc1)c1ccccc1 730163372 MFDBPLNGOVNXQY-OAQYLSRUSA-N 393.439 5.145 30 20 GKED O=C1/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)CSc2ccccc21 733084196 XPWJCTKFRJNELP-MDWZMJQESA-N 380.450 5.090 30 20 GKED CC[C@@H](NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 734374052 OZAYXNUGTYETHB-WOJBJXKFSA-N 391.565 5.841 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)/C=C/c3cccc(OC4CCCC4)c3)[nH]c12 735788016 BDFLFQIEWVJESE-DRUFCSCSSA-N 385.467 5.082 30 20 GKED N#CCCCOc1cccc(/C=C2/Cc3ccc(OC(F)(F)F)cc3C2=O)c1 737451256 XRLVNODBRVFONR-YBEGLDIGSA-N 387.357 5.090 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 744031333 KRZVPJZVJCBXGA-SFFNPBHPSA-N 396.556 5.669 30 20 GKED Fc1ccc(C2OCCO2)c(Cl)c1C=NNc1ccc(Cl)c(Cl)c1 761782438 UFKPDPSRBVBAQC-UHFFFAOYSA-N 389.641 5.277 30 20 GKED O=C(/C=C\c1cc(C(F)(F)F)ccc1F)c1cc(Br)ncc1F 762422886 NADKZCCLISPGHC-RJRFIUFISA-N 392.121 5.037 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(C(F)F)cc2)cc1 765138912 RVHWCHJGHQWWQT-OAQYLSRUSA-N 391.421 5.601 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N[C@H](C)c2ccc(OCC#N)cc2)cc1 772958800 IADTZSPMYRDRRW-RBUKOAKNSA-N 386.495 5.676 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)c3cnc(Oc4ccccc4)cn3)cc2)cc1 773211571 PHAXVNSCCBUISK-UHFFFAOYSA-N 393.402 5.027 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1 777832443 MMBKKFCYOVLYFE-SFHVURJKSA-N 380.488 5.010 30 20 GKED CCOc1cc(/C=C\C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1O 780886672 CNLMJSOZGZXARU-JBOCTPFWSA-N 398.462 5.098 30 20 GKED C=CCC[C@@H](C(=O)O[C@@H](C)c1nnc(-c2ccc(F)cc2)o1)c1ccccc1 784824609 JLJNQDDVVKEHOR-HNAYVOBHSA-N 380.419 5.230 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc2ccccc2c1O 786960766 VZADANRIGNBNAW-KRWDZBQOSA-N 399.494 5.301 30 20 GKED CC[C@H](NC(=O)[C@@H](C#N)C(=O)c1sc2ccccc2c1Cl)c1ccccc1 787034151 ZOFYNBZPHBNDMH-HOTGVXAUSA-N 396.899 5.145 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3csc(Cl)c3)cs2)cc1 787186611 PRZYEPKGMYSYIL-UQCOIBPSSA-N 391.901 5.342 30 20 GKED Cc1cc(C(=O)/C=C\c2nc(-c3cc(Cl)ccc3Cl)cs2)n(C)n1 789160850 YWBVXMNSMSRHBN-WAYWQWQTSA-N 378.284 5.055 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@H](C#N)c3nccc4ccccc34)ccc2c1 792092267 PGKIHRBAJQLSQP-QMHKHESXSA-N 380.447 5.377 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc(C)c3Cl)n2)cc1 810549786 PVXOQXROGSZKMY-KRWDZBQOSA-N 396.899 5.200 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1Cl 814305118 DMDQHNBVAZNQPB-LJQANCHMSA-N 376.843 5.256 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2csnc2-c2ccccc2)cc1OC 821629289 GDYDSMZDGMBYEB-ZRDIBKRKSA-N 392.480 5.035 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)c2sccc2Br)s1 845846695 YJPOMOUFPMBANO-VIFPVBQESA-N 396.331 5.075 30 20 GKED N#C[C@H](C(=O)[C@H]1CCC[C@@H]1Cc1ccccc1)c1nc2ccccc2n1C(F)F 850768893 AVKANZCGDDRSFC-FGTMMUONSA-N 393.437 5.267 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2cc(-c3ccccc3Cl)on2)CCC1 899415885 SZKWAODGYPWDMB-RUZDIDTESA-N 376.909 5.108 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)/C=C\c1ccc2ccc(Cl)cc2n1 914500240 XAAPSFVVGFGUPP-QXMHVHEDSA-N 389.886 5.212 30 20 GKED CC(C)c1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915351847 CMFKSFARWIEZIY-RUZDIDTESA-N 397.522 6.129 30 20 GKED N#C[C@@H](C(=O)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1)c1ccccn1 916626995 MOBMMSMQKYSHTQ-QRRJMBGHSA-N 376.818 5.291 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc2cc(Cl)ccc2s1 917047143 RTNCNNLAVBMUMZ-NSHDSACASA-N 395.698 5.675 30 20 GKED CCC/C(C)=C\C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 920324803 VADQXOUJIPCIPP-JOHMGYAOSA-N 379.312 6.040 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)ccc1F 1776061773 NFWGFCRQDNHAHX-UHFFFAOYSA-N 393.201 5.537 30 20 GKED CCOc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776127782 FIILJHLMQSVLOW-BENRWUELSA-N 378.449 5.408 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C/C(=O)c1ccc(C(=O)O)cc1O 1776365041 LXNRVHLCRREVNR-CMDGGOBGSA-N 376.861 5.140 30 20 GKED CC(C)c1cccc2c1OC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776377821 HGNVIANNYUDCRK-STZFKDTASA-N 398.458 5.834 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2ccsc2C(=O)O)cc1 1776787498 FYJXOWRMNHHBPK-UHFFFAOYSA-N 377.531 5.761 30 20 GKED COc1cc(C)ccc1Oc1ccccc1/C=C/C(=O)c1cccc(C(=O)O)c1 1777281623 DELHNHMWMQMHNT-VAWYXSNFSA-N 388.419 5.390 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)cc2)CCC1 1789192850 ITHJCLFTGJKYGR-BVYCBKJFSA-N 394.559 5.303 30 20 GKED C=CCn1c(SCC(=O)Nc2cccc(Cl)c2Cl)nc2ccccc21 5619106 YFQRBXZKEMHWFM-UHFFFAOYSA-N 392.311 5.260 30 20 GKED Cc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 25840782 TYJRQCRLXXFCQX-UHFFFAOYSA-N 382.463 5.280 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccccc2)cc1)c1ccc2ccccc2n1 47375309 IIKMJDBGRHZOQI-JOCHJYFZSA-N 378.431 5.304 30 20 GKED C=CCN(CCC(=O)Nc1cc(Cl)ccc1OC)Cc1ccc(Cl)s1 58490896 MIGQDUMABJPYDE-UHFFFAOYSA-N 399.343 5.080 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(F)c(F)c(F)c2F)cc1 65852597 OWVIROLZKDFEOD-UHFFFAOYSA-N 386.304 5.159 30 20 GKED Cc1ccc(-c2cc(NC(=O)c3ccccc3-c3ccccc3C#N)[nH]n2)s1 111112599 IHCXEGHOEPOLKT-UHFFFAOYSA-N 384.464 5.238 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(OC(F)(F)F)cc2)c1 113952503 SVYDTIFCYNKEHT-YOEHRIQHSA-N 378.394 5.117 30 20 GKED CC(C)OC1CCC(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 121938414 LLTMFWSYQQPADL-UHFFFAOYSA-N 393.487 5.208 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cccc(-c3ccccn3)c2C)cc1 122243299 ISLSNWMJFQJWEB-UHFFFAOYSA-N 385.467 5.016 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(F)c(F)c1 138293857 XVLXRDDNBHOKSO-VQHVLOKHSA-N 387.389 5.109 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1c(F)cccc1F 153463000 XSQBTXFFZSBVDW-GXSJLCMTSA-N 376.815 5.208 30 20 GKED COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)ccc1F 153466615 FRFBZKDIMQFONM-UHFFFAOYSA-N 398.381 5.111 30 20 GKED Cc1noc(C)c1[C@@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 155159276 VGZGMHHYNSOSTQ-MEDUHNTESA-N 399.903 5.438 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 174104404 FIEVGTDAIPBKIY-HNNXBMFYSA-N 394.525 5.118 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc2ccccc2c1 175956457 ZYBWTYOFQUYXDG-MGPUTAFESA-N 383.476 5.338 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Br)c(F)c1 189879160 SWCSJCWIXSYCQC-UHFFFAOYSA-N 390.296 5.621 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1csc2ccccc12 193466022 SJACISUGCKCFAC-LBPRGKRZSA-N 389.263 5.169 30 20 GKED N#Cc1ccc(NCc2ccc(OCc3ccccn3)cc2)c(C(F)(F)F)c1 301339708 PNRUNNJLIMYVSA-UHFFFAOYSA-N 383.373 5.163 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303372952 KNAJMWANPVJBLU-DLBZAZTESA-N 397.544 5.608 30 20 GKED Cc1ccc(-n2c(S[C@H](C)c3ccc(C#N)cc3)nnc2-c2ccncc2)cc1 303682518 JMALEFMORFBDJN-QGZVFWFLSA-N 397.507 5.363 30 20 GKED CCc1onc(C)c1N=C(O)N1Cc2cc(OC)ccc2C[C@@H]1C1CCCCC1 329936763 DIKLRJWLOCWVTK-HXUWFJFHSA-N 397.519 5.107 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1C(O)=Nc1ccc2oc(C(C)(C)C)nc2c1 330261939 UPJUPZOYPCBKMK-CYBMUJFWSA-N 399.516 5.421 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1 409923622 QFRGZPGPSOPYOC-QWHCGFSZSA-N 397.208 5.209 30 20 GKED C=CCCc1ccccc1NC(=O)CSCc1cc(-c2cccs2)on1 410371698 GNLBSBQSWODMJQ-UHFFFAOYSA-N 384.526 5.394 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c21 411019487 UXPVVVJQUIBJLL-IALDZJHCSA-N 382.476 5.042 30 20 GKED CCCOc1cccnc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 429116114 QFKBDGXBIASGMQ-OAHLLOKOSA-N 397.887 5.137 30 20 GKED CC(C)(C)c1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)n(C(C)(C)C)n1 432785273 KRBQGCCYPROWQR-GOSISDBHSA-N 395.551 5.492 30 20 GKED CC[C@H](C)c1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)on1 437458779 GMQHSYOFLPDGFD-ZDUSSCGKSA-N 379.391 5.243 30 20 GKED CCC[C@@H]1[C@H](C)CCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 437535878 MBQGVHIKXWDQHB-DNVCBOLYSA-N 382.533 5.038 30 20 GKED O=[S@@](Cc1cccc(NCC#Cc2cccc(Cl)c2)c1)c1ccccc1 442083604 FLQQFDWRJRRJBX-SANMLTNESA-N 379.912 5.111 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCC2)cc1)c1nc2cc(Cl)ccc2s1 442693558 POSSQYJPQWINSX-MRXNPFEDSA-N 382.872 5.371 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1F 454581227 OVUMKUBRWUQICL-HOTGVXAUSA-N 397.450 5.139 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(-c2ccc(OC)cc2)cc1 466251766 MXMDAOYBPGFYBO-UHFFFAOYSA-N 392.524 5.322 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 466406433 WWBMQONTTZXOHV-GFCCVEGCSA-N 395.381 5.027 30 20 GKED CC[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 467606329 GDIJJUKGACWKKB-QAPCUYQASA-N 379.460 5.011 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 470183210 BEUOXYBPUZLIDN-IBGZPJMESA-N 383.454 5.522 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 475256611 WERMNSNIFTZCIX-UHFFFAOYSA-N 391.496 5.133 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 475549900 QBXCQDXBCUYDEC-IRLDBZIGSA-N 396.506 5.719 30 20 GKED N#Cc1ccsc1C(=O)N1CCC(=Cc2cc(Cl)ccc2Cl)CC1 478100791 JKASEBSVXKQTER-UHFFFAOYSA-N 377.296 5.246 30 20 GKED Cc1ccccc1[C@@H](C)SCC(=O)Nc1ccccc1SC[C@@H](C)C#N 480369026 FSOKGWGTIYKKAF-DOTOQJQBSA-N 384.570 5.680 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccc(SCCOC)cc1 486223407 JCAIQITXXZMQAO-INIZCTEOSA-N 387.570 5.194 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2cccc(C(=O)N3CCCC3)c2)cc1 486542395 UFIGVCUWBQKAQS-UHFFFAOYSA-N 381.479 5.073 30 20 GKED Cc1c(C(=O)N[C@H](CCCC#N)c2ccccc2)ccc(C(F)(F)F)c1F 487408784 UZQVYYRRRDQTTN-QGZVFWFLSA-N 378.369 5.318 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N(CC)CC)c(Cl)c1)c1ccccc1 488613628 NYAUXAPPFJSINF-SFHVURJKSA-N 384.907 5.120 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(N2CCSCC2)cc1C)c1ccccc1 488716740 RJGVUDGKKFCPRS-OAQYLSRUSA-N 380.557 5.237 30 20 GKED C=CCC(C)(C)CNC(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C 489741843 YTZLWRCFHJOZSN-UHFFFAOYSA-N 390.936 5.294 30 20 GKED N#Cc1cccc(CN[C@H](c2ccccc2)c2ccccc2Br)c1 490138380 UUICQKOFZJZCIM-OAQYLSRUSA-N 377.285 5.200 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)c(F)c2)nnc1-c1ccccc1OC 497662507 BGKUQNNGFGSAOI-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1c(Cl)cccc1Cl 499818915 QYIFLYONPOUQCR-ZDUSSCGKSA-N 396.636 5.262 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@](C)(c2ccccc2)C1 503225382 KIAMCESMGHBPSO-MBSDFSHPSA-N 393.556 5.666 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc3c2CN(CC(F)(F)F)C3)CCCC1(C)C 504848510 HFOUFYOCCYHALQ-GOSISDBHSA-N 395.469 5.163 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H]1CC[C@H](C(F)(F)F)C1 506788613 HHOKDGNRIISVAR-CVEARBPZSA-N 388.389 5.576 30 20 GKED N#CC1CCC(CNC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)CC1 508378215 WQXWBCNEOANIJJ-BPZDKFOGSA-N 382.504 5.105 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(C(F)F)c2)cc1Cl 511554153 LVWLCTVQOZIMFS-LJQANCHMSA-N 396.824 6.185 30 20 GKED C[C@@H](CC#N)NC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 512012043 XFLXTQUNPPUOMI-LBPRGKRZSA-N 379.312 5.318 30 20 GKED CC(C)CN(C(=O)c1cc(-c2ccccc2Cl)on1)c1ccc(C#N)cc1 513562383 JSJVGBCJUJOGOT-UHFFFAOYSA-N 379.847 5.169 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccc(C#N)c2)cc1C 514664757 SSNDCJCNFMOBHX-UHFFFAOYSA-N 392.506 5.318 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(C#N)cn2)cc1Cl)c1ccccc1 518072813 LYMQIOJJYDDIHV-AWEZNQCLSA-N 376.847 5.032 30 20 GKED Cc1cc(N2CCCC2)ccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 519909011 CJNBFQNNLOHFFG-UHFFFAOYSA-N 390.531 5.157 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)Nc3cccc(C#N)c3)s2)cc1 520771187 ACBOARBINJXYJR-HNNXBMFYSA-N 376.485 5.181 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1ccc(Cl)c(Cl)c1 521016131 KFHQVMLLJJAZRP-CQSZACIVSA-N 396.636 5.262 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H](c3cccs3)C3CC3)cc2)c1 521808495 HSYDEHNQVIGAEX-OAQYLSRUSA-N 389.480 5.685 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C[C@H]3CCOc4ccccc43)cc2)c1 522718197 HNONWWMKZOVXNJ-HXUWFJFHSA-N 398.462 5.032 30 20 GKED C=CC1CCN(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)CC1 524153793 XDZMRZMPUJNULK-UHFFFAOYSA-N 381.423 5.259 30 20 GKED C[C@@H]1CCN(C(=O)c2ccc(CC#N)cc2)c2cc(C(F)(F)F)ccc2S1 535449582 FGFIAKVGWBLTIW-CYBMUJFWSA-N 390.430 5.303 30 20 GKED C[C@@H](NC(=O)Nc1ccc2[nH]ccc2c1)c1ccc(-c2cccc(C#N)c2)cc1 541092892 PLAGMICHAONDSJ-MRXNPFEDSA-N 380.451 5.589 30 20 GKED C[C@H](Sc1cccc(Cl)c1C#N)C(=O)N[C@H](C)c1cc2ccccc2o1 542102709 NFDJXPYZBYBLDB-OLZOCXBDSA-N 384.888 5.316 30 20 GKED C[C@@H](N[C@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccc(-c2cccc(C#N)c2)cc1 542106411 MQCCJJGBYWJQGI-QZTJIDSGSA-N 395.506 5.522 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNC2(c3cccc(C#N)c3)CC2)on1 551713587 FCLIPNBQVPYDSA-UHFFFAOYSA-N 395.462 5.154 30 20 GKED C[C@@H]1CN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CCC1(F)F 557542596 JLNVTDDITGFEAP-CYBMUJFWSA-N 390.817 5.121 30 20 GKED CC(C)(C#N)CCCN[C@@H]1CCN(C(C)(C)C)[C@@H]1c1ccc(Cl)c(F)c1 558896013 JZKASQSQZBRYQA-RTBURBONSA-N 379.951 5.313 30 20 GKED N#CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(Cc1ccccc1)C2)c1ccccc1 561658331 PGYZGBGCKAEPHI-HJOGWXRNSA-N 387.527 5.227 30 20 GKED N#CC1(N(C(=O)c2oc3ccccc3c2COc2ccccc2)C2CC2)CCC1 565071286 WHHNUDZQZCTAAH-UHFFFAOYSA-N 386.451 5.063 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 569639651 JUIXCIRLCHEJEX-JHJVBQTASA-N 376.934 5.395 30 20 GKED N#CCC[C@@H](C#N)CNc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 570388350 KVWJVGYZVWAMLP-ZDUSSCGKSA-N 382.876 5.597 30 20 GKED N#Cc1c(C(F)F)cccc1N1CCC(c2nc(C(F)(F)F)cs2)CC1 583214473 PWPUXJMFYLDNPG-UHFFFAOYSA-N 387.377 5.355 30 20 GKED N#CCc1ccccc1NC(=O)CCCSc1ccc(Br)cc1 588986607 XMTJMHMHILVPFM-UHFFFAOYSA-N 389.318 5.026 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2ccc(F)c(F)c2)CC1)c1ccccc1 590942126 SDBVDJWJWGTWSG-QFIPXVFZSA-N 397.469 5.289 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN2CCC(CCC#N)CC2)on1 592135189 UWCHULNMGQRIJN-UHFFFAOYSA-N 375.472 5.019 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc2cc(F)ccc2s1 592974469 YOODQYGYEJKUGR-CQSZACIVSA-N 380.375 5.325 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2C)cc1 593291807 JQGPCTCOCGIQHL-NRFANRHFSA-N 387.487 5.046 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2)cc1 607274717 OLXJYRHINHBPKR-JOCHJYFZSA-N 388.430 5.340 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1ccc(OCc2ccccc2C#N)cc1 610056016 VCSRBZCMQAFPBJ-XMMPIXPASA-N 399.494 5.146 30 20 GKED CCCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@@H](C)c1cc2ccccc2o1 610357022 FPYUDUSPTPCZRH-IRXDYDNUSA-N 375.472 5.548 30 20 GKED Cc1ccccc1-c1noc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 611807229 XJTSQSJBAMLFLZ-SFHVURJKSA-N 394.478 5.435 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N2CC[C@@](F)(C#N)C2)c(C(F)(F)F)c1 615528826 KBKKHQBAXMURRW-BDJLRTHQSA-N 389.418 5.065 30 20 GKED CC(C)CCOc1ccccc1CNC(=O)c1c(Cl)cc(C#N)cc1Cl 616489434 VPENUTRHVAVAAA-UHFFFAOYSA-N 391.298 5.220 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)N(Cc1ccc2ccccc2c1)C1CC1 618840992 NRSLYJXVRYPVTQ-DEOSSOPVSA-N 381.479 5.073 30 20 GKED CC[C@H](CC(F)F)C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494263 GLEICVXAZNWQKZ-MRVPVSSYSA-N 395.265 5.596 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)c[nH]c2c1 726148226 RSHCOWILKOMUDJ-UHFFFAOYSA-N 381.435 5.322 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 728539326 HJSCMJYQOPKYKN-UHFFFAOYSA-N 382.822 5.379 30 20 GKED C#CCOc1cccc(NC(=O)c2ccccc2CSc2nc(C)cs2)c1 730976435 NSAOAYLPXKYNCH-UHFFFAOYSA-N 394.521 5.008 30 20 GKED C=CC[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccncc1 734460599 RDOLGYCPRYSSEF-AWEZNQCLSA-N 377.296 5.650 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@]2(Cc3ccc(Cl)cc3)C[C@H]3CC[C@H]2C3)n1 735765948 XHRONNMOMCLBQE-OAZVVGOESA-N 384.932 5.330 30 20 GKED CCCCCCc1ccc(C(=O)Cn2c(C)nnc2-c2cccc(C#N)c2)cc1 739437807 RRSDDSSWBROWFX-UHFFFAOYSA-N 386.499 5.131 30 20 GKED N#Cc1ccc(CCC(=O)O[C@@H]2CCCc3nc(-c4ccccc4)sc32)cc1 741196371 YYIWNMIKIKTCFI-HXUWFJFHSA-N 388.492 5.235 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SCC(F)(F)F)cc2)cc1C#N 741840901 BGBLEJSDHZFOMV-WAPJZHGLSA-N 377.387 5.117 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3c(Cl)nc4sccn34)s2)cc1 741847736 KULNQLOUMUTETC-VOTSOKGWSA-N 385.901 5.377 30 20 GKED C=CCOc1cccc(CNc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c1 742388650 QIJYLKCCZNHRDM-QGZVFWFLSA-N 382.504 5.449 30 20 GKED Cc1c(C(=O)/C=C/c2cccnc2Cl)cnn1-c1ccc(Cl)cc1Cl 743055960 OVPOOZYABFMKFS-QPJJXVBHSA-N 392.673 5.432 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)C1CCC(c2ccccc2)CC1 744016066 IKUXZWJWXNCTOY-GZNCHQMQSA-N 384.479 5.342 30 20 GKED C[C@H]1CN(c2ccc(N=Cc3cc(Cl)cc(Cl)c3O)cc2)C[C@H](C)O1 747361974 GUIAGRVHZVYATE-STQMWFEESA-N 379.287 5.063 30 20 GKED CC(=NO[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1cc2ccccc2o1 747828209 VLVUNPOBINBNDU-ZDUSSCGKSA-N 381.819 5.638 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1ncc(-c2ccccc2)n1CC(F)(F)F 748031697 CXKWPARSNGQIIG-KRWDZBQOSA-N 387.430 5.339 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@H](CCC#N)c3ccccc3)c(F)c2)cc1 749033594 DUCGZIRPTCOETK-HSZRJFAPSA-N 388.442 5.276 30 20 GKED CC[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 752159228 DOGSPNZKFIYLRG-HUUCEWRRSA-N 388.414 5.685 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)CC2CC(OC(C)(C)C)C2)c1 754547516 LNOHXHYOAKSSFF-UHFFFAOYSA-N 375.512 5.185 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2csc(Cl)c2Cl)ccc1OC 762443061 OGTBXRMHQCPDTO-ZDUSSCGKSA-N 385.316 5.034 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cncc(Br)c2)cc1 767359641 HJOOXBDBCIPIKG-IZZDOVSWSA-N 394.268 5.416 30 20 GKED CCc1nc(C)c([C@@H](C)OC(=O)c2cn(CCCC#N)c3ccccc23)s1 774111969 VYQKEJAXSINXFA-OAHLLOKOSA-N 381.501 5.190 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](CC)c2cccc3ccccc23)ccc1OC 783252355 PFHIRKFTXWHOOB-REWPJTCUSA-N 388.511 5.770 30 20 GKED CCN(C(=S)Nc1ccc(Br)cc1)[C@H](C)c1ccc(C#N)cc1 783728210 AZTMJYYKQMFARR-CYBMUJFWSA-N 388.334 5.101 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)C[C@@H](C)c1c[nH]c2ccccc12 786277609 SNIMYOWXESFVEU-RDTXWAMCSA-N 383.451 5.043 30 20 GKED CC(C)(C)c1cnc(CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)o1 788180025 LFQBQTVSUNGLBO-GFCCVEGCSA-N 387.892 5.044 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3F)o2)cc1NC(C)=O 790216344 RQNRQUACNWTNGM-CLFYSBASSA-N 397.377 5.088 30 20 GKED CCNc1ccc(Cl)cc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 793123625 ZXACLBANUVYBED-ZDUSSCGKSA-N 388.805 5.007 30 20 GKED O=C1/C(=C\c2ccc(C(F)F)cc2)COC/C1=C\c1ccc(C(F)F)cc1 794943380 YFYQFIPHFAQUDE-BUOZRGFLSA-N 376.349 5.628 30 20 GKED CC[C@H](C)[C@H](OC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 796644675 XXRYCFDFOCHVQD-GDKCJGSASA-N 397.327 5.354 30 20 GKED Cc1ccccc1N(C(=O)/C=C/c1ccccc1C#N)c1nc2ccccc2s1 799696241 QHDJWYJTPDGAOI-CCEZHUSRSA-N 395.487 5.855 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1Cc2ccc(Cl)cc2C1 800537743 HXIQCFOMABALEX-SUMWQHHRSA-N 385.920 5.023 30 20 GKED C[C@H](OC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cn1 801706480 HQYVNTPSJRDAFF-LKFCYVNXSA-N 395.274 5.434 30 20 GKED Cc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)c(-c2ccnn2C)c1 801723064 NSPPYHOFEUSKOY-UHFFFAOYSA-N 398.535 5.286 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccc(Cl)cc1 810193291 FZIIQWTWYQAYFJ-INIZCTEOSA-N 380.797 5.331 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)OC1(CC#N)CCC1 810856492 UKZUTIJBFUGFHG-UHFFFAOYSA-N 380.391 5.131 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1)c1nccc2ccccc12 847694610 KTAHOBLCFDJUIB-IBGZPJMESA-N 394.396 5.552 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3ccccc3OC(F)F)c(Cl)nc21 913615387 SAUHDAWSEBPTEZ-FPLPWBNLSA-N 391.805 5.163 30 20 GKED Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(Cl)n1 916057125 LNUHLHPNPZLDFE-SFHVURJKSA-N 396.277 5.605 30 20 GKED COc1cc(/C=C/C(=O)c2cc(F)ccc2F)ccc1OCc1ccccc1 916135029 ZCKRPNPKEHKFEA-YRNVUSSQSA-N 380.390 5.449 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)cc1 916941898 BGPQEPYSOAEGJG-KRWDZBQOSA-N 375.255 5.078 30 20 GKED CCCN(C(=O)c1ccccc1OCC#N)[C@H](C)c1ccc(Cl)c(Cl)c1 920003398 KPSAULFTPADZSZ-CQSZACIVSA-N 391.298 5.509 30 20 GKED CSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1F 1777403171 GPMPIEHBUQDODY-QPJJXVBHSA-N 398.411 5.108 30 20 GKED N#CCc1ccc(NC(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)cc1 16495918 QFOKMFDVSWFGQE-UHFFFAOYSA-N 395.487 5.795 30 20 GKED N#CCc1ccc(NC(=O)c2oc3ccccc3c2COc2ccccc2)cc1 17368390 INDICTDVIRWHRD-UHFFFAOYSA-N 382.419 5.330 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1cc(C)ccc1C 22729623 CQMYBLWZGFYCGS-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCOc2ccccc2-c2ccccc2)cc1 24924510 PTVCQDDNXVWMLF-UHFFFAOYSA-N 384.479 5.562 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cn(-c3ccccc3)nc2-c2ccccc2C)n1 41521034 BAPFBJIKZATPJL-IBGZPJMESA-N 398.491 5.103 30 20 GKED N#C[C@@H](C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nc2ccccc2o1 54734011 AROQFGRIRMPBOD-KRWDZBQOSA-N 399.362 5.018 30 20 GKED CCCOc1ccc(CN(CCC)C(=O)Nc2cc(C#N)ccc2C)cc1OC 58451506 YFLYZSBCFQBNLT-UHFFFAOYSA-N 395.503 5.108 30 20 GKED Cc1ccccc1C1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1 66954631 YIDAALNOZSLJLL-GOSISDBHSA-N 393.556 5.801 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1c(F)cccc1F 69057528 QCUNYUYJWDBVHT-AWEZNQCLSA-N 393.393 5.068 30 20 GKED COc1cc(CSc2nc(C)c(C)o2)ccc1OCc1cccc(C#N)c1 116611529 SASHVCHOKWNGCE-UHFFFAOYSA-N 380.469 5.043 30 20 GKED CC(C)Oc1ccc(NC(=O)N(CCC#N)Cc2ccco2)c(C(F)(F)F)c1 124531751 ISLWRHYQHYEHIQ-UHFFFAOYSA-N 395.381 5.033 30 20 GKED CSc1ccc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 131803617 RKNINQAXRMOZMO-CABCVRRESA-N 386.542 5.066 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 150968443 CNVXHCOBAOAVDZ-SJLPKXTDSA-N 397.519 5.174 30 20 GKED Cc1noc(C)c1N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 158178233 LKKZPYDKCKYCLL-GOSISDBHSA-N 394.862 5.269 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-c4ccccc4)[nH]3)n2)cc1 171797793 SUMFOKDDKLZHLS-GOSISDBHSA-N 394.459 5.167 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](Cc2ccccc2)C1 173116758 WJYFTQWTKZTRKG-HKUYNNGSSA-N 379.529 5.035 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccncc1 174493143 OADHEWPJMLBADP-IBGZPJMESA-N 390.418 5.157 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)c2ccc(Br)s2)n1 177765458 QSMJYVSEXZDYBL-VHSXEESVSA-N 383.336 5.070 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 184579141 PGQIRFWIUMHLPQ-AWEZNQCLSA-N 392.484 5.041 30 20 GKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 189994671 MPDHRXDHXUUXAG-IRXDYDNUSA-N 387.458 5.361 30 20 GKED N#CC(CCSc1nnc(-c2ccncc2)o1)(c1ccccc1)c1ccccc1 193066549 NBWGJLKFQVHOEH-UHFFFAOYSA-N 398.491 5.124 30 20 GKED O=C(CCCCCc1cccs1)NCC#Cc1cccc(C(F)(F)F)c1 303327093 BAYGFRZQPYYDOI-UHFFFAOYSA-N 379.447 5.038 30 20 GKED O=C(c1cccc(N=C(O)C2CCCCC2)c1)N1CCC(c2nccs2)CC1 328784151 VNPOYLNBFSQKCF-UHFFFAOYSA-N 397.544 5.331 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1nc(CC(C)(C)C)cs1 328963960 LPUNNQKGCXTKFR-LBPRGKRZSA-N 379.551 5.027 30 20 GKED Cc1cnc([C@@H](C)NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 427070160 RPZSEWARHSADDQ-CYBMUJFWSA-N 397.887 5.260 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1 432289336 OCMSKHKARIKBRY-QGZVFWFLSA-N 375.497 5.724 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 432714263 RDLNXHQWPUAXJE-QGZVFWFLSA-N 377.856 5.181 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CN[C@H](CCCC#N)c1ccccc1 433019599 OTYCATVWKXSELM-HSZRJFAPSA-N 391.559 5.897 30 20 GKED Cc1c(Br)cccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 438139501 YJZOZBJBCDTMED-LPHOPBHVSA-N 398.304 5.061 30 20 GKED CCc1ccc([C@H](NC(=O)CSc2ccccc2C#N)c2cccs2)cc1 439707524 XNVYZKVZGHZRDI-QFIPXVFZSA-N 392.549 5.180 30 20 GKED N#C[C@@H]1CC[C@H](NCCc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)C1 442774460 AJQOPHGNNHLQHD-UTKZUKDTSA-N 390.918 5.017 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCC(=O)c1csc2ccccc12 446002613 MWVZNJCWBXSUBP-UHFFFAOYSA-N 392.480 5.162 30 20 GKED COC[C@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 454477902 DROCDKBDOANBST-UYAOXDASSA-N 397.906 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc([C@H](C)C(F)(F)F)cc1 456027583 OMUZMZZIHXWCGF-HNNXBMFYSA-N 375.434 6.457 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)cc1 458850454 UMWCNUJZNRACOR-ISKFKSNPSA-N 375.516 5.103 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)[C@H](C)c1cccc(C#N)c1 463588592 INYXVETXIIVDAT-LLVKDONJSA-N 377.669 5.025 30 20 GKED C[C@@H](C(=O)N1CCCC[C@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 463722626 BHCDVMGJMRCFOE-QRWLVFNGSA-N 386.417 5.434 30 20 GKED Cc1cccc(Br)c1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 464409009 WXNZWRZOWVENMG-KRWDZBQOSA-N 385.305 5.050 30 20 GKED COc1ccc2sc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)c(C)c2c1 464937696 FNEVEEMHTHMFRT-VQTJNVASSA-N 390.508 5.130 30 20 GKED COc1ccccc1[C@H](NC(=O)Nc1cccc(C#N)c1)c1ccccc1Cl 466073486 FFZVTCXEIZXGME-OAQYLSRUSA-N 391.858 5.131 30 20 GKED N#C[C@H]1N(C(=O)c2cc(-c3ccccc3)ccc2Cl)CCC[C@@]12CCCCO2 468119973 JTTDXOWEROKNHA-GGAORHGYSA-N 394.902 5.074 30 20 GKED Cc1nc2cc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)ccc2o1 470877582 LRPBFTRZMPXQDD-UHFFFAOYSA-N 397.434 5.148 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@@H]1c1cccc(Br)c1)c1ccccc1 475031687 ODZGPMAQCRXASP-FXAWDEMLSA-N 397.316 5.200 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COC(C)(C)C)c1C 475972739 FFBPKGHTCSNNFF-UHFFFAOYSA-N 393.531 5.626 30 20 GKED N#Cc1ccc(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)cc1Cl 483519326 LZDBDCAXLAGBLD-UHFFFAOYSA-N 381.785 5.198 30 20 GKED N#Cc1ccc(CNC2(c3noc(C4CCCC4)n3)CCCCCC2)cc1F 483708078 CWHXUQMOUFAKKP-UHFFFAOYSA-N 382.483 5.077 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c1 485302438 MQNMJYJUPTVFIM-SFHVURJKSA-N 385.467 5.328 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1nc(-c2ccc(CC)cc2)no1 486403061 FRCQMBWPPSACJQ-HNNXBMFYSA-N 393.512 5.068 30 20 GKED C[C@@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)C(=O)c1ccc(Cl)cc1 487455317 NFEMTOCMFVSXFH-JXFKEZNVSA-N 382.891 5.100 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccccc1 488009373 AMZCAMFQBOSCPJ-LJQANCHMSA-N 386.470 5.420 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)CC(=O)N(CCC#N)c1cccc(Cl)c1 497049214 QGXXDDFATHJKMA-MRXNPFEDSA-N 395.890 5.026 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(OC(F)F)c(Cl)c2)c1 502385606 LNPZKNATGJRXHF-UHFFFAOYSA-N 395.793 5.268 30 20 GKED C=CCN(C(=O)CCCC(C)(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 504474859 XRSXBZZIAVLIPD-UHFFFAOYSA-N 387.505 5.454 30 20 GKED C=C(C)Cn1c(SCc2ccccc2C(F)(F)F)nnc1-c1ccncc1 506416455 NKYMSQFACBLQRJ-UHFFFAOYSA-N 390.434 5.227 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(CC#N)cc1 510031203 SZTNUSXLBVDCQT-UHFFFAOYSA-N 375.394 5.214 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 511992882 DQVPRQAFQPYROV-BZNIZROVSA-N 391.324 5.159 30 20 GKED Cc1c(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)ccc(C(F)(F)F)c1F 513524978 IVYZXKKXDBLDPG-CYBMUJFWSA-N 397.334 5.348 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](C)c1ccc(C#N)cc1 518009521 WVDUOSGLCXCFHV-ZDUSSCGKSA-N 376.287 5.158 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccc(F)c(C(F)(F)F)c3)n2)cc1 519108893 OFSGMJAFZRJVEI-UHFFFAOYSA-N 391.349 5.092 30 20 GKED Cc1ccc(O)c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1 522635910 CHUMPVISZJTAOI-UHFFFAOYSA-N 378.815 5.270 30 20 GKED COc1cccc(Oc2ncccc2CNc2ccc(C#N)c(C(F)(F)F)c2)c1 524945929 GHEGQRFIUBREIZ-UHFFFAOYSA-N 399.372 5.385 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)c1ccccc1CCC(F)(F)F 533926965 URJGVXMSWBCCBV-UHFFFAOYSA-N 393.302 5.269 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)Nc1ccccc1-c1ccccc1 537845949 IGHHDMHLUGBABO-UHFFFAOYSA-N 378.884 5.609 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H](c2ccccc2)[C@H]2CCOC2)c1 537865412 ZUSMKDILVLJDID-AZGAKELHSA-N 398.506 5.005 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 537945846 AMNYRRUNEXNWKN-WMZHIEFXSA-N 379.548 5.918 30 20 GKED C=CCN(C(=O)c1cc(C)nn1C(CC)CC)c1nc(-c2ccccc2)cs1 539517168 MBHRNSOBCSSHAH-UHFFFAOYSA-N 394.544 5.509 30 20 GKED C[C@H](NCc1cc(Cl)cc(Cl)c1OC(F)F)c1ccc(C#N)c(F)c1 540707636 AUYQYYUZAHKQHQ-VIFPVBQESA-N 389.204 5.456 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1 542674592 HTPYJZCOIWPLMU-IFMALSPDSA-N 398.478 5.165 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(C(C)(C)C)cc1 553665351 VMWSAERRJRTAAP-QGZVFWFLSA-N 395.572 6.042 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(F)ccc3Cl)cc2)cc1 553865528 PHRBYJNZNJDDJH-UHFFFAOYSA-N 380.806 5.590 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cccc(F)c2)c(C(F)(F)F)c1 555093596 WWVQHSMBLAXKKY-OAQYLSRUSA-N 384.376 5.595 30 20 GKED C=CCC[C@@H](NCc1cnc(C(C)(C)C)nc1)c1ccc(C(F)(F)F)cc1 560258662 RNWZMISWVRYEQA-GOSISDBHSA-N 377.454 5.590 30 20 GKED C=CCN(C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)c1nc2c(s1)CCCC2 567524733 DUFJLZKQGWUHLU-INIZCTEOSA-N 396.556 5.183 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccnc3)cc2)sc2ccc(C#N)cc12 568544151 NSYKQFUFSZTRLF-UHFFFAOYSA-N 385.448 5.521 30 20 GKED C=C[C@](C)(CCOC)c1nc(-c2cccc(Oc3ccc(Cl)cc3)n2)no1 573362696 JJPFWBCRPYEGDF-HXUWFJFHSA-N 385.851 5.058 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C2CC2)[C@H]1C1CC1 574886481 NRNCPWAYUJOSEB-JTHBVZDNSA-N 387.483 5.311 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1cn(C)nc1C1CCCCC1 590815363 IVOGYHKNCAGUNW-HNNXBMFYSA-N 397.548 5.364 30 20 GKED N#CCCCCC(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 593944929 AXVHZMYJHNJGAT-SFHVURJKSA-N 379.891 5.153 30 20 GKED N#Cc1c(NC(=O)c2ccccc2OC(F)F)sc2c1-c1ccccc1CC2 603991513 LCSHGLNUEMBZGQ-UHFFFAOYSA-N 396.418 5.239 30 20 GKED CC(C)Cn1ccc2cc(NC(=O)CSCc3ccc(C#N)cc3)ccc21 604530783 DUUYHJKPGCLZHD-UHFFFAOYSA-N 377.513 5.041 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)c1 609080481 ICOKHWBSIIUBHM-MRXNPFEDSA-N 391.805 5.182 30 20 GKED Cc1ccc(CCCNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 609403111 UATRZQZPICKDQE-KRWDZBQOSA-N 381.545 5.310 30 20 GKED N#CCCn1cc(/C=C\c2nc(Cc3ccc(Cl)cc3)no2)c2ccccc21 609476316 XLAHSBAZECOESP-FLIBITNWSA-N 388.858 5.353 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccccc2OC2CCC2)c1 609825996 HTJYVUJVUDOJBL-UHFFFAOYSA-N 398.506 5.358 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610290520 XLADFXWTJNPKIJ-MRXNPFEDSA-N 389.430 5.092 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c(Cl)c1 611092797 IPUNTMMOJKZSNE-UHFFFAOYSA-N 398.293 5.366 30 20 GKED CCCN(C(=O)N[C@@H]1CCc2cc(C#N)ccc21)[C@@H](C)c1cc2ccccc2o1 618842519 NEJIXKLISQKDAC-HRAATJIYSA-N 387.483 5.475 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CC[C@@H](C2CC2)C1 646439093 YAIMWWGWZWQMFL-LLVKDONJSA-N 398.322 5.240 30 20 GKED N#C[C@@H](C(=O)c1cccc(OCc2cccs2)c1)c1nc(C2CC2)cs1 647377143 RYHRPHGEGRQCQF-KRWDZBQOSA-N 380.494 5.151 30 20 GKED CCCN(CCC)c1ccc(/C=C\C(=O)c2ccc(OC)c(NC(C)=O)c2)cc1 726430466 YWYRQNAKBNQUGM-LCYFTJDESA-N 394.515 5.176 30 20 GKED CC(C)N(C(=S)NCCc1ccc(Cl)cc1Cl)c1cccc(C#N)c1 726491017 VLAJWKFVAGVZSV-UHFFFAOYSA-N 392.355 5.197 30 20 GKED CCCCCC[C@H](C)CC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 727952934 XWLBGBGBCUPPLJ-HOCLYGCPSA-N 399.560 5.449 30 20 GKED CN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1ccc(C(C)(C)C)cc1 727991304 KDGGCASLWFXBDK-UHFFFAOYSA-N 388.467 5.304 30 20 GKED Cc1ccccc1CCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 729069100 CRXYESXKPHOAHE-HNNXBMFYSA-N 388.414 5.433 30 20 GKED N#C[C@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)c1c(Cl)cccc1Cl 730092387 HGXGUYCBXIPZIX-AWEZNQCLSA-N 388.081 5.224 30 20 GKED C#CCOc1cccc(NC(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)c1 731111048 NLANAFKQEKQTND-SFHVURJKSA-N 390.508 5.555 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCCCc3cccs3)n2)cc1 731546406 NPASKJPIHVYGQV-LJQANCHMSA-N 394.565 6.159 30 20 GKED C=CCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 731964901 PSLGDZJBTMCATE-UHFFFAOYSA-N 390.870 5.175 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 732496134 NWOJQKDHUBCZAZ-ZFWWWQNUSA-N 385.439 5.036 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1nc(-c2ccccc2)cs1 732571535 RGTURIJOFUDBSJ-MDZDMXLPSA-N 375.478 5.225 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ccc(C(F)(F)F)c(Cl)n2)ccc1OC 733303143 GYKXMIDRIXXAGX-GFCCVEGCSA-N 399.800 5.055 30 20 GKED C=CC[C@H](NC(=O)NC[C@H](C)c1c(Cl)cccc1Cl)c1ccncc1 734666757 JTAVOIDFLQJLFC-GUYCJALGSA-N 378.303 5.109 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1 734966007 SOLKGKPISFGCHE-SCLBCKFNSA-N 389.282 5.143 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2csc(-c3ccoc3)n2)cc1 737502892 JVMFACWNCPGHQT-NRFANRHFSA-N 399.475 5.240 30 20 GKED C[C@@H](SC1=Nc2ccccc2C1)C(=O)Nc1sc2c(c1C#N)CCCCC2 740767218 PFMCZJMHMJFOQW-CYBMUJFWSA-N 395.553 5.235 30 20 GKED Cc1ccc2cccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c2n1 741179119 ZYROMCORNFCEKV-HSZRJFAPSA-N 377.447 5.451 30 20 GKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccc2c(c1)COC2 742437368 UCPAUTFXOULVIO-CLFYSBASSA-N 377.421 5.250 30 20 GKED N#C[C@@H](C(=O)C1CCCCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 744038318 QEALURRXLJARJF-AWEZNQCLSA-N 380.435 5.852 30 20 GKED Cc1ccc(F)c(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)c1 745724327 ORMWTPZLNNADKD-UHFFFAOYSA-N 375.472 5.409 30 20 GKED CCOc1c(Cl)cc(C=NOCc2csc(C3CCCC3)n2)cc1OC 746352634 BPIXHQSVEAHEJP-UHFFFAOYSA-N 394.924 5.412 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](Cc2nc(C)no2)c2ccccc2)cc1 760052934 UGXJXCKSVPBKOR-IERDGZPVSA-N 397.906 5.144 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)ccc1F)c1cc(Br)ncc1F 762422883 NADKZCCLISPGHC-DAFODLJHSA-N 392.121 5.037 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(F)c2F)ccc1OCC(F)(F)F 776268524 RPWJYMCVGPHVMG-VURMDHGXSA-N 386.316 5.201 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(CC[C@@H](O)c4ccccc4)cc3)cc2)CC1 777409865 PFUSGHGFIYOCRO-XMMPIXPASA-N 396.490 5.160 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1 780672704 IELJWZLTYIULNV-JLTOFOAXSA-N 383.879 5.294 30 20 GKED C=CCn1c(SCc2cc3ccccc3c(Cl)n2)nnc1-c1ccccn1 789956306 UUXSPGRXNDUEOB-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CC[C@H](C)[C@H](OC)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 796644689 XXRYCFDFOCHVQD-SVKFGRERSA-N 397.327 5.354 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C(C3CCC3)C3CCC3)n2)cc1 796886523 BDISGJUERWFMKF-SFHVURJKSA-N 380.513 5.211 30 20 GKED N#C[C@@H](C(=O)C(Cc1ccccc1)Cc1ccccc1)c1nc2ccccc2o1 798818082 LZKOZXYFSLSZIA-NRFANRHFSA-N 380.447 5.106 30 20 GKED CCC[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccn1 810530689 CORHWSDNVYXSEY-ROUUACIJSA-N 375.497 5.274 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1csc(-c2ccccc2F)n1 812244683 MFQGSFOGKKJCDD-ZHACJKMWSA-N 389.455 5.090 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 845842124 RHLHHWKHZMGPTF-RYBIEJRYSA-N 397.396 5.118 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ccc(Cl)cc3[N+](=O)[O-])c2)c1 864004143 KZNVWFMVIMESSV-UHFFFAOYSA-N 393.830 5.311 30 20 GKED C[C@H](NC(=O)CCN1c2ccccc2Sc2ccccc21)c1ccc(C#N)cc1 914445878 IPSYANJRAHRYSQ-KRWDZBQOSA-N 399.519 5.428 30 20 GKED COc1cc([C@@H](C)Nc2snc(Cl)c2C#N)ccc1OCCC(C)C 917083570 SZTBQMBBFYSLEX-GFCCVEGCSA-N 379.913 5.275 30 20 GKED Clc1ccc(CON=Cc2ccc(Br)cc2)c2ncccc12 917395410 NBHYKNGVHPMJSW-UHFFFAOYSA-N 375.653 5.201 30 20 GKED CCc1cccc2c(C3CCN(C(=S)Nc4ccccc4C#N)CC3)c[nH]c12 917602992 VQQUQAJDUVRQLD-UHFFFAOYSA-N 388.540 5.178 30 20 GKED CCCCc1ccc(NC(=S)NN=C(C)CCCCCCC(=O)O)cc1 1776018482 USHDJKNVTOMBEN-UHFFFAOYSA-N 377.554 5.117 30 20 GKED O=C(O)c1cc(-c2ccc(C=NNc3ccc(Cl)c(Cl)c3)o2)ccc1O 1776032795 TWPBFRDVBYPRDN-UHFFFAOYSA-N 391.210 5.103 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1sc2c(Cl)cccc2c1C 1776034354 BRTQXTQPQHYJKP-UHFFFAOYSA-N 393.295 6.051 30 20 GKED CC(C)c1cccc2c1OC/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1776377820 HGNVIANNYUDCRK-KGENOOAVSA-N 398.458 5.834 30 20 GKED CN(c1ccccc1)c1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cn1 1777084756 NEFAYMIRMHNQKV-XMHGGMMESA-N 398.462 5.150 30 20 GKED COc1ccc(/C=C\C(=O)c2csc(C(F)(F)F)c2)c2cc(C(=O)O)oc12 1777361540 LFNFZDRLBBNGET-RQOWECAXSA-N 396.342 5.116 30 20 GKED O=C(O)COc1ccc(/C=C2/CCCc3ccc(Cl)cc3C2=O)cc1Cl 1777645842 STRPWSSZPBOESM-ZSOIEALJSA-N 391.250 5.059 30 20 GKED O=C(O)c1ccc2scc(/C=C3/Cc4c(Br)cccc4C3=O)c2c1 1777685779 WVDRCPAWZUNEOL-WDZFZDKYSA-N 399.265 5.184 30 20 GKED C=CC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)CCCCC)CC1 1831466941 MOBLIOQNQKLKIS-TUNNFDKTSA-N 390.612 5.035 30 20 GKED Cc1c(C#N)c(S[C@@H](C(=O)Nc2ccccc2)c2ccccc2)nc2c1CCC2 25041644 KGKBWEWBQPVSJL-JOCHJYFZSA-N 399.519 5.223 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnn(C(C)(C)C)c1C 56470328 SJASSUBKEPNWBR-UHFFFAOYSA-N 388.471 5.171 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Br)cc1 66801819 IYVJTOHYDMJDSX-CYBMUJFWSA-N 389.318 5.025 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccn3)cc2)c1 66953302 SWUBRFKHUGVBAL-JOCHJYFZSA-N 384.439 5.115 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 66954810 NHNJVKHAMZEVJQ-UONOGXRCSA-N 389.471 5.584 30 20 GKED C=CCCC(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 102230162 DGZQVFUBPITLEE-UHFFFAOYSA-N 380.341 5.002 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCOc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 102967405 AOLLHLAHGYCEGF-IAGOWNOFSA-N 394.883 5.206 30 20 GKED CCc1c(C(=O)/C=C/c2csc(N(C(C)=O)C3CC3)n2)oc2ccc(C)cc12 114991390 DBRTWMOZWIFLHL-RMKNXTFCSA-N 394.496 5.172 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccc(SC(C)C)cc2)cs1)C1CC1 114991690 SDHKTGOYDCKLDG-IZZDOVSWSA-N 386.542 5.055 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1 121298277 FRFPSNSZWJKIFK-SFHVURJKSA-N 375.394 5.348 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(Cl)cc2Br)c1 127306380 CTNSBTIFDSYNOT-MRXNPFEDSA-N 393.712 5.073 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 154016223 JYUQWGXJUXRSSB-UHFFFAOYSA-N 391.858 5.083 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)C(=O)N1CCC[C@@H]1c1cccs1 163310310 SZZHQTLPRHSEKB-SWLSCSKDSA-N 376.934 5.117 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccccc1F 177183914 SFTDAKOAJBDQDS-CYBMUJFWSA-N 386.496 5.409 30 20 GKED CC#CCCCC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 185565386 DHVUALCKEXBOEZ-UHFFFAOYSA-N 375.299 5.111 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 189891735 GSSHSDBDZKJPMT-HNNXBMFYSA-N 384.501 5.566 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(NC(=O)[C@H](C)OC)c1 191426626 VHORWLSMMJBURY-INIZCTEOSA-N 395.503 5.156 30 20 GKED C=C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccccc2)CC3)CC1 208849056 PAVIXERAFDBUHK-LVZFUZTISA-N 380.491 5.514 30 20 GKED Fc1ccc([C@H](NCc2cccc(OCC(F)(F)F)c2)C(F)(F)F)cc1 237781319 YHWDSUOINVMIOP-HNNXBMFYSA-N 381.291 5.160 30 20 GKED N#CCCCOc1cccc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)c1 237788560 CXXIKJGHLIEYOC-JOCHJYFZSA-N 396.943 5.963 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 303622333 DERVOXYRUALYKV-HZPDHXFCSA-N 396.462 5.411 30 20 GKED OC(=Nc1scnc1C1CC1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 328926227 ORVANHRIHRTESC-LBPRGKRZSA-N 398.315 5.026 30 20 GKED CCc1nc2cc(N=C(O)N3CCCCC[C@H]3c3noc(C(C)C)n3)ccc2o1 329528172 ICNOLBUBKVEVNC-INIZCTEOSA-N 397.479 5.059 30 20 GKED N#CC1(/C(O)=N/[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)CCCC1 329751585 IZJCHFKHSWVNMF-INIZCTEOSA-N 386.293 5.348 30 20 GKED CC(C)CC(O)=Nc1ccc(Cl)c(/C(O)=N/[C@@H]2CCOC3(CCC3)C2)c1 330199532 VOAFOJPTGMPPRU-OAHLLOKOSA-N 378.900 5.380 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC=C(c3cccc(Cl)c3)CC2)cc1 431816767 ZDZXSJQTPBYPRC-UHFFFAOYSA-N 379.891 5.462 30 20 GKED Cc1ccncc1CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 431978151 UJQMAGUTTRWQFB-UHFFFAOYSA-N 386.455 5.026 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)F 433116790 LXSYCJOZRWBWQE-SUMWQHHRSA-N 375.444 5.066 30 20 GKED CC(C)[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCS1 438672356 QFPBHMRHJVAEAV-FQEVSTJZSA-N 399.491 5.095 30 20 GKED CC(C)[C@@H](NC(=O)NCC1CCC(C#N)CC1)c1ccc(C(F)(F)F)cc1 440997039 DFJAIAHQGQXQCW-JTTJXQCZSA-N 381.442 5.032 30 20 GKED C=CCC[C@@H](NCc1nncn1-c1ccccc1)c1ccc(C(F)(F)F)cc1 444685425 RMZGCRRHSYLEFK-LJQANCHMSA-N 386.421 5.083 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cc(-c3nc(CC)no3)ccc2C)CCCC1(C)C 444906301 WFLRBNNPRNIXIL-GOSISDBHSA-N 382.508 5.206 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 460171909 MRGFHVJUWYQRRP-HZPDHXFCSA-N 391.323 5.741 30 20 GKED FC(F)Oc1ccc([C@@H](NCc2ccc(C(F)F)cc2)C(F)(F)F)cc1 461367909 DRBUZQBYADRFSS-CQSZACIVSA-N 381.291 5.619 30 20 GKED CC(C)Sc1ccc(Cl)cc1NCc1nnc(-c2cccc(C#N)c2)o1 471632947 DNBRQWHTBGSXMC-UHFFFAOYSA-N 384.892 5.374 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN(c2c(F)cccc2F)C1 475554685 ZCGTYSULVFSDJU-QGZVFWFLSA-N 399.485 5.217 30 20 GKED C[C@@H]1C[C@H]1[C@H](NCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccc(Cl)cc1 478388691 UGSOYHDMQXJXIQ-YCASGBEESA-N 390.918 5.099 30 20 GKED CC(C)CN(C(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCCc2cccnc21 479956102 JOLGJAITFHFDSY-LJQANCHMSA-N 382.895 5.174 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccccc1Oc1ccccc1C#N 484609310 WORVIUXHMBWKIL-WMLDXEAASA-N 388.389 5.154 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(C(=O)NC(C)(C)CC)cc1 485737087 WEMLJLZNUNOEBE-UHFFFAOYSA-N 382.529 5.135 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccsc2)s1 486883277 FSVAAEFLMFLSEK-UHFFFAOYSA-N 381.526 5.042 30 20 GKED Cc1cscc1CNC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 488277648 KUVWFQKJWIAPTE-UHFFFAOYSA-N 391.496 5.137 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 488384541 AUGFZACJOUWPNQ-QUCCMNQESA-N 379.891 5.568 30 20 GKED O=C(C[C@H](c1ccccc1)C(F)(F)F)N[C@@H](c1ccc(F)cc1)C(F)(F)F 489554303 VSOIGAMTTXSJRM-ZBFHGGJFSA-N 393.302 5.282 30 20 GKED COc1cccc2c1CCCN2C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 497452825 BZOQMTQSGNMGCN-UHFFFAOYSA-N 398.462 5.147 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2c2ccsc2)c1 498346853 YBQYGYAMVLBSLP-JOCHJYFZSA-N 388.492 5.176 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)C1 501094411 MSTHXBVQFYXWOU-KAMZKSLDSA-N 396.575 5.440 30 20 GKED C[C@H]1CCN(C(=O)Cc2ccc(C#N)cc2)c2cc(C(F)(F)F)ccc2S1 504056260 SNOQFDQMSWOWIO-ZDUSSCGKSA-N 390.430 5.037 30 20 GKED C[C@@H]1C/C(=C/c2ccco2)c2nc3ccccc3c(C(=O)NCCCCC#N)c2C1 505501986 URRLQDTZEQSSED-FXBHHXAOSA-N 399.494 5.374 30 20 GKED C[C@H](NC(=O)c1ccncc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 506998168 WJDFJFCTHZUQLS-AWEZNQCLSA-N 395.384 5.130 30 20 GKED CC(C)N(Cc1ccc(-c2ccccc2F)s1)C(=O)c1cccc(CC#N)c1 510319007 LFUDOUWOUMYTMP-UHFFFAOYSA-N 392.499 5.671 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc3ncccc23)cc1 512330795 YBAHOXYOKITORM-UHFFFAOYSA-N 395.437 5.088 30 20 GKED CCn1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc2ccccc21 517306637 SYXCFLKJWBACNS-GOSISDBHSA-N 385.492 5.583 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 520178584 QHSCEQGPPFUDJD-ZDUSSCGKSA-N 391.393 5.201 30 20 GKED CCCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 520196887 HUHSTOJTEOBIDD-MRXNPFEDSA-N 385.508 5.664 30 20 GKED C[C@H](C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccsc1 523103452 PBUZYMDKSRHQOT-INIZCTEOSA-N 378.472 5.091 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N(Cc1ccc(C#N)cc1)CC(C)C 523183639 FRJZQCUYJAQMCN-UHFFFAOYSA-N 389.524 5.289 30 20 GKED Cc1csc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)n1 524408292 SSFZZCWCGUOIRK-UHFFFAOYSA-N 398.875 5.200 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 532654725 XPWNIESJFQRKBH-TZIWHRDSSA-N 393.487 5.321 30 20 GKED N#C[C@@H](C(=O)c1ccnc(C2CC2)c1)c1nc(-c2ccc(Cl)cc2)cs1 541200699 URCISQPTSUSZOA-INIZCTEOSA-N 379.872 5.226 30 20 GKED C=CCC[C@@H](NC(=O)NC[C@@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 542536222 DLAJMNDQRIQRBI-CZUORRHYSA-N 397.466 5.272 30 20 GKED C[C@@H](NC(=O)NC1CCC(F)(F)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543007504 UTJFQMNAJKCWFO-OAHLLOKOSA-N 383.442 5.163 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@H](C#N)c3ccccn3)c3ccccc3n2)c(C)c1 543733445 YKPPCMNPCAOQKO-OAQYLSRUSA-N 377.447 5.404 30 20 GKED N#CCCCN[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 543980432 FKOCUUDAIVDJPW-LLVKDONJSA-N 378.238 5.221 30 20 GKED COC1CCC(CCNC(=O)c2ccccc2Sc2ccccc2C#N)CC1 544455628 UAZFAKYYDAKUEU-UHFFFAOYSA-N 394.540 5.035 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCC[C@H]1c1ccccc1 553071719 WSCDSULOLANKQC-YZGWKJHDSA-N 393.556 5.786 30 20 GKED N#CC1(CCCOc2c(Cl)cc(Cl)cc2Br)CCOCC1 554694108 COXFEINIVHFLNH-UHFFFAOYSA-N 393.108 5.235 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)sc12 554772985 SQTICVRKKXZZNT-KRWDZBQOSA-N 399.500 5.695 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CS[C@H](C)c1ccccc1F 561138593 SARRGERJPZZBJT-LSDHHAIUSA-N 388.533 5.653 30 20 GKED COc1ccc([C@@H](CCC#N)NC[C@@H](Cc2ccccc2)C(F)(F)F)cc1 563654505 DXDVSIGAVVTCPD-UYAOXDASSA-N 376.422 5.051 30 20 GKED CC1(C)CN(C(=O)c2ccc(COc3ccccc3C#N)o2)[C@H]1c1cccs1 563910963 UMIQBNJQLOVKDD-FQEVSTJZSA-N 392.480 5.015 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cc(F)c(F)cc1N1CCCCC1)c1ccccc1 567404451 CXQZUSGLIMSRIL-LJQANCHMSA-N 398.457 5.122 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)CC1 567466913 IMHIPTWGIQKCME-LJQANCHMSA-N 387.936 5.216 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1CC(c2ccccc2)C1 572493393 XBJJANNZTFPRQN-MUYFXNHWSA-N 379.529 5.396 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 581376541 LABBFMGAXGOYBJ-NRFANRHFSA-N 389.499 5.177 30 20 GKED CC(C)(C)c1cc(NC(=O)c2sccc2Cl)n(-c2ccc(C#N)cc2)n1 583345606 LEZCHDWZEUGSGY-UHFFFAOYSA-N 384.892 5.009 30 20 GKED N#Cc1ccc(/C=C(/CC(=O)O)c2nc3ccccc3s2)c(C(F)(F)F)c1 583844661 VEWIYNFLCLHAFI-JYRVWZFOSA-N 388.370 5.202 30 20 GKED Cc1cn(C2CCCCC2)[nH]c1=NC(=O)Nc1ccccc1S[C@H](C)CC#N 584507384 DAZYAWXRRVIAGK-MRXNPFEDSA-N 397.548 5.157 30 20 GKED COc1ccc(CNc2cc(Cl)ccc2OC(C)C)cc1OCCCC#N 589325173 PSRGDEPNTWMZNR-UHFFFAOYSA-N 388.895 5.430 30 20 GKED CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)N1CCC(C)(C#N)CC1 597053620 BTMLSGCHIDNODP-UHFFFAOYSA-N 391.846 5.238 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@H]1CCC(F)(F)C1 601059745 KCESEXIKQOGSNX-KBPBESRZSA-N 384.517 5.188 30 20 GKED N#Cc1ccc(CSCc2cccc(C(=O)Nc3ccccc3)c2)c(F)c1 604068677 AHCIFKTYMWVENO-UHFFFAOYSA-N 376.456 5.383 30 20 GKED CCc1c(C)sc(NC(=O)c2ccccc2COc2ccccc2)c1C#N 609033509 ZFNJMNBDCBVBJO-UHFFFAOYSA-N 376.481 5.322 30 20 GKED CSc1cccc([C@H](NCc2ccccc2C#N)c2ccc(F)c(F)c2)c1 610258967 WTDYIFKPCZJSOG-QFIPXVFZSA-N 380.463 5.438 30 20 GKED Cc1[nH]ccc(=NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c1Cl 611909493 GJXCLYHFAKAZHT-UHFFFAOYSA-N 398.249 5.035 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1nc2ccccc2[nH]1 612893531 VSUNSIRMPWKLSI-LJQANCHMSA-N 388.430 5.268 30 20 GKED CCSc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 613318181 OMYLCHHSQPANQD-QGZVFWFLSA-N 378.522 5.721 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N[C@@H](C)c2ccsc2)cc1 619787866 MXVDKTCGJWSKFV-AWEZNQCLSA-N 393.468 5.303 30 20 GKED CCC1(C(=O)NCc2cc(F)c(C(F)(F)F)cc2F)CCC(F)(F)CC1 622601238 VFUBIMIYUVUXAJ-UHFFFAOYSA-N 385.323 5.206 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1ncc(-c2ccccc2)[nH]1 641883440 RACMTLMLGSHFCT-UHFFFAOYSA-N 381.526 5.086 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2SCc2ccco2)n1 673815159 VDHJOQMESYOSOV-INIZCTEOSA-N 382.510 5.642 30 20 GKED Fc1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1C(F)(F)F 678207853 GBCBVTNIBWUDEO-UWVGGRQHSA-N 397.256 5.407 30 20 GKED COc1ccc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)cc1OC(F)F 681135127 DHCBLKVZAWTUGC-UHFFFAOYSA-N 397.290 5.563 30 20 GKED C=CCC[C@H](C(=O)N(C)C[C@@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 681719456 CHMHYMHLOOIWLJ-HJOGWXRNSA-N 377.528 5.363 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccccc1C(F)(F)F 682803902 YZZVKNRBDRBXPI-HNNXBMFYSA-N 375.434 6.300 30 20 GKED COc1ccc(Nc2nc(Cl)c(C=NNc3cccc(OC)c3)s2)cc1 725854620 ATNHFEQZPQZETM-UHFFFAOYSA-N 388.880 5.003 30 20 GKED CCC[C@H](C)N1Cc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2C1 726494821 NJOFDCVNOYZCBD-AWEZNQCLSA-N 398.963 5.525 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 729091206 YQQBJSSLQLZOJI-GOEBONIOSA-N 396.462 5.848 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc(Cl)cc3)c2)cc1 729159649 AXKUIMBYBSLTAO-UHFFFAOYSA-N 379.872 5.813 30 20 GKED Cc1ccc(S[C@@H](C(=O)[C@H](C#N)c2nc(C)cs2)c2ccccc2)c(C)c1 730071049 KQSGHRLFSHDFOA-GHTZIAJQSA-N 392.549 5.778 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)c1 730437261 GAFHJRYEWWPDSY-XMMPIXPASA-N 398.531 5.069 30 20 GKED C#CCOc1ccc(NC(=O)N(Cc2cccc(C(F)(F)F)c2)C(C)C)cc1 731113265 NACNAFARFKIOEF-UHFFFAOYSA-N 390.405 5.160 30 20 GKED O=C(/C=C\c1ncc(-c2ccc(Br)cc2)[nH]1)c1c[nH]c2ccccc12 732714294 PKOPTSHWXKEOCV-KTKRTIGZSA-N 392.256 5.217 30 20 GKED O=C(O)COc1cccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)c1 733206054 BWTUKTFBAJCLBB-MDWZMJQESA-N 382.481 5.081 30 20 GKED C[C@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 734116987 ORMUUWDUNRFZAD-HNNXBMFYSA-N 399.475 5.451 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)/C=C/c3cccc(OC4CCCC4)c3)[nH]c12 735788020 BDFLFQIEWVJESE-SJFMBGHLSA-N 385.467 5.082 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC3(CCCCCC3)C2)c1 743612037 RWJJOZKCBNEGSO-HXUWFJFHSA-N 383.536 5.014 30 20 GKED CCCCN(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)[C@@H](C)c1ccc(C)o1 746164823 CJZYFHIBAUASBI-DLBZAZTESA-N 395.528 5.237 30 20 GKED N#Cc1ccc(CSCC(=O)Oc2ccccc2SC(F)(F)F)cc1 748050700 FTRHJHRBDUGVBI-UHFFFAOYSA-N 383.416 5.009 30 20 GKED COc1cc(Cl)cc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1O 761216874 SJASISWGDXBCIN-OAHLLOKOSA-N 392.886 5.444 30 20 GKED CC(=O)N1C/C(=C/c2cccc(-c3ccccc3C)c2)C(=O)c2ccccc2C1 778520411 WKSKMVQWZXAUAZ-HAHDFKILSA-N 381.475 5.290 30 20 GKED O=C(/C=C/c1sccc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 782341857 LZEGXOKDNOFRLE-MDZDMXLPSA-N 380.918 5.014 30 20 GKED N#C[C@@H](C(=O)c1cc2cccc(Cl)c2o1)c1nc2ccccc2n1C(F)F 783070736 WDJSJMDJRRMADO-NSHDSACASA-N 385.757 5.321 30 20 GKED O=c1[nH]ccc2cc(NN=C3CCC[C@H]3c3cccc(C(F)(F)F)c3)ccc12 789062356 OZZMUZSNPRXGFD-KRWDZBQOSA-N 385.389 5.283 30 20 GKED COCC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(Cl)c(Cl)c1 790614348 QJTSCZFPTTXMCS-VLIAUNLRSA-N 393.314 5.152 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@](F)(c3ccccc3)C2)cc1 801611034 AFXMMKCSUDQMPM-ILBGXUMGSA-N 399.469 5.445 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)Nc1ccccc1S[C@@H](C)CC#N 801629420 YWWLTYOSFXQQDZ-KRWDZBQOSA-N 397.544 5.621 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc(Cl)c3F)n2)cc1 810531844 MNWIKGGBWNMFTD-OAHLLOKOSA-N 384.863 5.330 30 20 GKED Cc1cc(C#N)cnc1C(=O)O[C@H](c1cccc(F)c1)c1cccc(Cl)c1 815980526 ONAJTRDCRYNSHL-FQEVSTJZSA-N 380.806 5.001 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2ccc(OC(C)(C)C)c(C#N)c2)c1 840798334 VTAIAQFTNXGBIF-UHFFFAOYSA-N 389.908 5.206 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C=C/C(=O)c1cc(F)ccc1F 916134722 PUXNVFFGNZKLDT-VQHVLOKHSA-N 390.792 5.207 30 20 GKED Cc1nnc(C)n1N=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12 916607783 QLARPKFHOQKCJV-UHFFFAOYSA-N 391.478 5.388 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(-c2ccccc2)cc1 920105372 DHQDCTDAPRRSMA-NRFANRHFSA-N 378.431 5.349 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccccc3Cl)n2)cc1 920138859 LGZOBGZKUQJKQM-NLZINVLXSA-N 394.883 5.362 30 20 GKED C[C@@H]1CC(=NNc2ccc(Cl)c(C(=O)O)c2)c2cccc(Br)c21 1776033538 XHSHPFWGMIWAGI-SECBINFHSA-N 393.668 5.124 30 20 GKED CCOc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1F 1776925921 CRNINJYOZPORCX-YCRREMRBSA-N 380.371 5.079 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C34CC(F)(C3)C4)CCC2)cc1 1789624101 JHJHDCCEOZZVFS-UHFFFAOYSA-N 398.522 5.005 30 20 GKED CCCn1c(SCc2ccc(C#N)cc2F)nnc1-c1ccc(Cl)cc1 10539025 AYKOLFBPFRVDSZ-UHFFFAOYSA-N 386.883 5.312 30 20 GKED C=CCn1c(S[C@@H](c2ccccc2)c2ccc(Cl)cc2)nnc1C1CC1 36800609 BREMXEHOIQHFRI-IBGZPJMESA-N 381.932 5.877 30 20 GKED N#C[C@@H](C(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccc2ccccc2n1 47375515 NTRDYMKKVIGXCJ-GOSISDBHSA-N 397.459 5.039 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 57612177 RZBIVZLVZPEFGO-UHFFFAOYSA-N 380.538 5.403 30 20 GKED Cc1ccc2c(CCNC(=O)Nc3ccccc3S[C@@H](C)CC#N)c[nH]c2c1 66953839 NEUNMYBSIUYTJO-INIZCTEOSA-N 392.528 5.235 30 20 GKED C=CCn1c(SCc2ccc(SC)c(OC)c2)nnc1-c1ccoc1C 68043652 HHXARLVCUBSJHY-UHFFFAOYSA-N 387.530 5.055 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)[C@@H](C#N)c3nc(C)cs3)o2)cc1 69832064 BFLRLVZJOSNMKO-LJQANCHMSA-N 399.475 5.572 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C1CCC1 108372866 UBPQPOYPICZTEZ-HXOBKFHXSA-N 393.556 5.150 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 161141391 DLKOHYQLGFTNLH-MSUUIHNZSA-N 385.467 5.080 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 180063075 FLLZKXBGGRSROY-UWJYYQICSA-N 393.487 5.135 30 20 GKED COc1cccc([C@@H](N[C@H](C)c2ccc(C#N)cc2)c2cc(F)ccc2OC)c1 181847653 OYKBSOKHHMOWHQ-VOIUYBSRSA-N 390.458 5.155 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)c1cccc(C#N)c1 190879291 IXRRZEZCFZLLJE-HOTGVXAUSA-N 395.553 5.243 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccccc1OC 191418586 DYIDFIGMPONFCE-NRFANRHFSA-N 378.516 5.916 30 20 GKED CCCn1c(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc2ccccc21 191508061 MZISUSICONFCAT-KRWDZBQOSA-N 386.480 5.060 30 20 GKED C[C@H]1CCN(C(=O)c2sccc2C#N)c2cc(C(F)(F)F)ccc2S1 194597325 ZWKCSYFJDUKUPK-JTQLQIEISA-N 382.432 5.170 30 20 GKED O=C(/C=C\c1ccc(SC(F)(F)F)cc1)c1cccc(N2CCOC2=O)c1 208087425 YOZNSRACAXXDFR-TWGQIWQCSA-N 393.386 5.151 30 20 GKED OC1=NCCc2c1ccc(N=C(O)[C@]1(Cc3ccccc3)C[C@H]3CC[C@H]1C3)c2F 328907940 LVTAUBJNBOHVLE-WOGXIUBCSA-N 392.474 5.324 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc2c(cc1Br)CCC2 425681593 KNNUWOOBSLMMKA-ZDUSSCGKSA-N 398.304 5.034 30 20 GKED CN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)[C@@H]1CCC(C)(C)C1 431975583 XVJDVJBGKWFLAD-HXUWFJFHSA-N 391.515 5.374 30 20 GKED N#CCCn1cc(/C=C/c2nc3cc(Cl)ccc3s2)c(-c2ccncc2)n1 432701138 XDUASTCRJPEMBU-GORDUTHDSA-N 391.887 5.292 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccc(OC(F)F)cc1 434230779 JECFRMHEUFCIDY-OAHLLOKOSA-N 397.425 5.037 30 20 GKED Cc1sc(Br)c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c1C 442024522 DFABAWXMLSMHFN-SNVBAGLBSA-N 391.315 5.227 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)Nc2ccc(CC#N)cc2Cl)C1 452646340 QCTUFYHWXMTRTK-SJLPKXTDSA-N 376.928 5.500 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@@H]3CCSc4ccccc43)c2)cc1 460167418 WUMCRXOQMISAPY-OAQYLSRUSA-N 386.476 5.569 30 20 GKED C=CCn1c(S[C@@H](C)c2cccc(C)c2)nnc1[C@@H]1COc2ccccc2O1 463036299 QRQLQBSOVOSTMQ-JXFKEZNVSA-N 393.512 5.138 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC4(CCC4)C3)cc2Cl)c1 467851604 CJTRLFQULVNFOF-UHFFFAOYSA-N 395.890 5.199 30 20 GKED O=C(c1cc(F)c(Cl)cc1Cl)N(CCC(F)(F)F)CC(F)(F)F 468520374 XOISRVULIJVAON-UHFFFAOYSA-N 386.094 5.089 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 471663716 QZVDOKKFBHIZES-LJQANCHMSA-N 376.422 5.468 30 20 GKED Cc1sc(NC(=O)C[C@@H](CC#N)c2ccccc2)nc1-c1ccc(F)cc1 475104004 OJTQLAXKVFXTMH-QGZVFWFLSA-N 379.460 5.284 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1 475461200 XNDLJZNGJXKSHN-UHFFFAOYSA-N 391.858 5.581 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](c2ccccc2OC)C1 475567545 CXHNEKNFBYDROH-LJQANCHMSA-N 378.516 5.569 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCO[C@@H]1c1ccc(C)cc1 475571535 GFZLCNLPOVHFLR-LADGPHEKSA-N 392.543 5.889 30 20 GKED C=C(C)CN(C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 477546294 YMQDMXFXTYUGFF-UHFFFAOYSA-N 382.851 5.115 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1Cl 477778335 ZTICDRBAWFONDO-CHWSQXEVSA-N 391.899 5.756 30 20 GKED Cc1cc(F)ccc1N(Cc1ccco1)C(=O)C[C@H](CC#N)c1ccccc1 483287252 RSJODEZOKWALIP-IBGZPJMESA-N 376.431 5.348 30 20 GKED N#CC1(F)CCN(C(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2)CC1 483745675 MSJKMHMZRTZAGA-UHFFFAOYSA-N 392.261 5.520 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1cccc(CC(F)(F)F)c1 487347879 VTSWOFGIDUVAGX-UHFFFAOYSA-N 380.435 5.120 30 20 GKED N#Cc1cccc(CNC(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)c1 487565444 AWWAFZBNPXHLPD-UHFFFAOYSA-N 395.698 5.663 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1)c1ccccc1 487935765 OLQPBFCSYMAUCW-FCHUYYIVSA-N 377.463 5.106 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1cc2ccccc2s1 495440499 SZOUZHLDKISUBR-QGZVFWFLSA-N 396.560 5.528 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1 499170051 OXMLBUKKRLMJCE-IEGUWTFLSA-N 392.499 5.060 30 20 GKED Cc1nc(COc2ccc(CN(Cc3ccc(C#N)cc3)C3CC3)cc2)cs1 506554055 GDYOQAAVUZABKG-UHFFFAOYSA-N 389.524 5.067 30 20 GKED C[C@@H]1CCC[C@@H](N(C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 509920363 RMPOZJPQEYEZPC-XMSQKQJNSA-N 391.515 5.374 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H](C)CC[C@H]1C 510103236 IIEMDXHSYGEPQD-SJLPKXTDSA-N 377.488 5.098 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(c3c(C)[nH]c4ccccc34)CC2)c1 511010928 CDOVFLXDMJITOT-UHFFFAOYSA-N 389.499 5.453 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CC=C(c2ccc(Cl)c(Cl)c2)CC1 513141547 RYGRHEGOSNKFKD-UHFFFAOYSA-N 380.319 5.122 30 20 GKED Cc1ccccc1N(C(=O)c1cccc(COc2ccccc2C#N)c1)C(C)C 513293840 KQSBPQWFGUMXAI-UHFFFAOYSA-N 384.479 5.501 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCc2sc(Cl)cc21 521947886 LDFRCXQHXWRGOZ-QGZVFWFLSA-N 387.936 5.128 30 20 GKED C=CCCC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 523228697 SMYFAVBWHKAFOR-UHFFFAOYSA-N 377.296 6.234 30 20 GKED CN(Cc1cccs1)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523879289 AWJICVGAHPSGTB-UHFFFAOYSA-N 382.872 5.338 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc2c1CN(c1ccccn1)C2)c1ccccc1 533880111 PUMGPUPGVVVZNZ-QFIPXVFZSA-N 398.510 5.431 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(Br)cc1)c1ccccc1 533929143 ANQOHMDOANRNNS-JXFKEZNVSA-N 384.317 5.473 30 20 GKED CCC[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 535851380 WJEZXPCYOHHQEC-CQSZACIVSA-N 382.460 5.286 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@H]2CC23CCCCC3)cc1 540043120 ZVDXLGIOJPWKSX-QFIPXVFZSA-N 389.499 5.176 30 20 GKED C=C[C@](C)(CCOC)c1nc([C@@H](c2ccc(Br)cc2)C(C)C)no1 561902974 SAWQMFQQMUQGKG-VQIMIIECSA-N 393.325 5.100 30 20 GKED N#CC[C@H](Cc1nc(C2(c3ccccc3F)CCCC2)no1)c1ccccc1 573139760 JPSLUMNXHQRMGO-GOSISDBHSA-N 375.447 5.309 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@@H](COCc1ccccc1)c1ccccc1 573590685 ALDXGVCKGWCOMZ-IBGZPJMESA-N 397.400 5.342 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)sc2c1CCCC2 589191029 AZANWHFDMRSNIO-UONOGXRCSA-N 390.430 5.260 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(-c4ccco4)s3)cc2)ccn1 589470633 YVMZZELGUWYXPL-UHFFFAOYSA-N 387.420 5.319 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 590253146 SZFVSCUUWLWIPM-RYUDHWBXSA-N 391.286 5.606 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(C(F)(F)F)CCCC1 599737742 PAPFJUXZSUUINP-ZDUSSCGKSA-N 385.455 5.325 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184890 VSBHNHYLLMXJEA-QGZVFWFLSA-N 389.886 5.360 30 20 GKED C=CCCCN(C)C(=O)c1cc2ccccc2cc1OCc1c(C)noc1C 605677281 GAWYXMSXJYNUHF-UHFFFAOYSA-N 378.472 5.062 30 20 GKED COc1ccccc1C(C)(C)CNC(=O)Nc1ccccc1S[C@H](C)CC#N 609436610 BMJSNKJTKCQZAS-MRXNPFEDSA-N 397.544 5.189 30 20 GKED N#CCCn1cc(/C=C/c2nc(Cc3ccc(Cl)cc3)no2)c2ccccc21 609476308 XLAHSBAZECOESP-DHZHZOJOSA-N 388.858 5.353 30 20 GKED CC[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1ccc(C)cc1 609968565 QWIMCDURBAFDLK-IBGZPJMESA-N 388.433 5.342 30 20 GKED Cc1ccc(C[C@H](C)N(C)C(=O)c2cccc(COc3ccccc3C#N)c2)cc1 609982273 MQEGWAQHCQIJOM-FQEVSTJZSA-N 398.506 5.149 30 20 GKED CC(C)(C#N)CCSc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1 610166823 NHXBCJUFLYYDND-UHFFFAOYSA-N 388.440 5.212 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccccc2SCc2ccco2)cc1C#N 610934220 NHESHXMBTXJUIO-UHFFFAOYSA-N 392.480 5.483 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1cccc(C#N)c1 618471940 RMOIDPIHOBELLM-QFYYESIMSA-N 399.775 5.015 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1occc1COc1ccccc1 654790997 BANIHDIKEOOQOC-UHFFFAOYSA-N 387.888 5.402 30 20 GKED N#C[C@H](NC(=O)c1cc2c(F)cccc2s1)c1cccc(Cl)c1Cl 731196075 WPBVDHDHIIVPED-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)OC(=O)c1cccc(CC#N)c1 734739138 XHOYWWXGSWWPTC-CQSZACIVSA-N 380.444 5.242 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cc(Cl)cs3)n2)cc1 737323535 TWQONVKZQYFQQV-MRXNPFEDSA-N 386.929 5.643 30 20 GKED C[C@H](c1ccccc1)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740064709 QYJZPORPTJZXFB-MRXNPFEDSA-N 375.497 5.189 30 20 GKED C#Cc1cccc(NC(=S)Nc2cnccc2-c2ccc(C(F)(F)F)cc2)c1 741510030 QNLSBMWYFXJCSO-UHFFFAOYSA-N 397.425 5.558 30 20 GKED COCc1cccc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)c1 742433830 AXYUESXGTHDYIB-FOWTUZBSSA-N 379.456 5.308 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743093056 KZRVWSBIFCDSOI-JWQCQUIFSA-N 397.522 5.827 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(SC)c(OC)c2)cc1OCCCC#N 747615418 XMZJXKZAWHXILQ-TWGQIWQCSA-N 397.496 5.004 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 749874016 ZFLQBRNOLZIJSE-SFHVURJKSA-N 395.425 5.159 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)Cc2ccccc21 759912957 WKNZSDXRGQSNKV-QHCPKHFHSA-N 395.506 5.667 30 20 GKED Cc1nc([C@@H](C)OC(=O)c2cccc(CC#N)c2)oc1-c1ccc(Cl)cc1 763933765 QLJFKGAZNXTYCO-CQSZACIVSA-N 380.831 5.288 30 20 GKED CC(C)c1csc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 764049474 GCBGCMLYKYBNEW-LJQANCHMSA-N 390.512 5.244 30 20 GKED C#CCOc1ccc([C@H](C)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 764930845 VSGDFWDIPLCJJF-VQTJNVASSA-N 398.506 5.363 30 20 GKED COc1cccc(Cl)c1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 764997128 BVMRYQYEUPZQHT-HXUWFJFHSA-N 390.870 5.185 30 20 GKED N#C[C@H](C(=O)[C@@H](c1ccccc1)C1CC1)c1nc(-c2c(F)cccc2F)cs1 765932439 ZDEYACHMNBQNPH-BEFAXECRSA-N 394.446 5.458 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)Nc1ncccc1OCCCC#N 766482012 NXCJLKBTRDMDIC-SEYXRHQNSA-N 390.270 5.113 30 20 GKED CCOCCC1(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCC1 769945340 JILQULQYSRESAN-CYBMUJFWSA-N 396.434 5.088 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(OC[C@H]3CCCO3)cc2)CC1 770404935 UJDYWKLNOHSLBK-SHSGKGFPSA-N 376.500 5.060 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(COCCc3ccccc3)c2)cc1 770502608 AHEHLHHJUXSJDW-FQEVSTJZSA-N 386.495 5.349 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)cc1F 781423545 RQYRFCWNYCZNFJ-NSYGIPOTSA-N 386.470 5.463 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1cc(F)c(F)cc1C(=O)c1ccccc1 796130895 XZSZUHKPJVLTSS-UHFFFAOYSA-N 385.410 5.073 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](F)CC3CCCCC3)n2)cc1 796662973 UHULMOCYNDUQCC-QZTJIDSGSA-N 381.476 5.167 30 20 GKED C=CC[C@H](OC(=O)[C@H](C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 797552633 GNFZBEAQYCMMMJ-PXNSSMCTSA-N 399.277 5.408 30 20 GKED CCOC(=O)[C@@H]1C/C(=C\c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 802708918 XUHVTBKSCQBQBY-MOVXZBDNSA-N 395.505 5.188 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@@H]2NC(=O)CCCCCC#N 805199886 HNIJMAIFUMSHCW-IBGZPJMESA-N 385.508 5.001 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)c(C(F)F)n1 812240320 LJARSSXNYVZYOF-CLFYSBASSA-N 378.325 5.008 30 20 GKED Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCCN1C(=O)CC1(C#N)CCCCC1 830132505 TXZAIPOUPDSDDK-QGZVFWFLSA-N 390.959 5.029 30 20 GKED O=C(c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCCC12CCC2 834552416 KGOSBBRMZGJMNL-UHFFFAOYSA-N 383.307 5.135 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CN[C@@H]2CCCc3cc(C#N)ccc32)c1 850483790 URRZWZWMNDZAAV-OAQYLSRUSA-N 377.488 5.072 30 20 GKED CCCCOc1ccc(C=NOCc2coc(-c3cccs3)n2)cc1OC 852905791 CNOSHIRPANINCI-UHFFFAOYSA-N 386.473 5.141 30 20 GKED CC1(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)CCC(F)(F)CC1 860507378 TZBXCAMVLMZXJV-NSHDSACASA-N 396.409 5.480 30 20 GKED CC(C)n1cc(Br)cc1C(=O)N(O)Cc1cccc2ccccc12 901370054 PPARQPOIRYCNCW-UHFFFAOYSA-N 387.277 5.016 30 20 GKED COc1ccc(Cl)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915088442 RYBZJLWVUWBUQH-FQEVSTJZSA-N 376.843 5.256 30 20 GKED CC(=O)N(c1ccccc1)c1nc(C=NNc2c(C)cc(C)cc2C)cs1 916339755 WCTYZASFVQAQOR-UHFFFAOYSA-N 378.501 5.199 30 20 GKED C=CCN(C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1)C(C)C 916706934 IWQMUMXRMQZVRQ-UHFFFAOYSA-N 390.430 5.392 30 20 GKED O=C(Nc1ccc(CCC(F)(F)F)cc1)N1CC[C@]2(C1)CC(F)(F)C2(F)F 930304797 MANQCJGKLMBNFJ-CQSZACIVSA-N 398.322 5.080 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)s1 1776339918 QLMMEWSWMFMLNO-JXMROGBWSA-N 380.465 5.801 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCCCCC)cc1 1776784792 WQQXIWJLHRZNBZ-NRFANRHFSA-N 377.569 5.939 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1C 1776819000 CXZSUUHNTYHOEF-RMKNXTFCSA-N 382.456 5.165 30 20 GKED CCN(CC)c1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1F 1776860345 DEUXFGGRFFZXFT-FLIBITNWSA-N 399.462 5.053 30 20 GKED Cc1c(/C=C2\COc3c(cccc3C(C)C)C2=O)nc2ccccc2c1C(=O)O 1777414128 ARMLXUDSFJXFKW-RVDMUPIBSA-N 387.435 5.024 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCOc4ccc(F)cc4C3=O)cc2)cc1 1777670989 ONGLLJKTVTXSCK-CPNJWEJPSA-N 388.394 5.240 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCc4c(Cl)cccc4C3=O)o2)cc1 1777671053 XEEBPFAHYOEHEL-QINSGFPZSA-N 378.811 5.511 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccoc3C)CCC2)cc1 1789624319 WWQQGNXZRZRQPR-UHFFFAOYSA-N 394.515 5.328 30 20 GKED Cc1cccc(C)c1/N=C1/NC(=O)/C(=C/c2cc(C)n(CC(C)C)c2C)S1 7165124 YGPHIPVPNRHUOK-ODLFYWEKSA-N 381.545 5.269 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)cc1 25439696 QUCJBHYINNTIBT-UHFFFAOYSA-N 393.874 5.367 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1ccccc1)c1ccc(C(F)(F)F)cn1 41555298 RULWOKNMJJBLHL-KRWDZBQOSA-N 382.341 5.383 30 20 GKED N#CCN(C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1)C1CC1 65895427 BNCUIVRHZMMGEO-UHFFFAOYSA-N 391.323 5.414 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66801154 QNAPQGWLQYUGTO-AWEZNQCLSA-N 393.537 5.765 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(OCc2nccn2C)cc1)c1ccccc1 90580884 VEUCOOCSXYLWCY-AUSIDOKSSA-N 375.516 5.357 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1ccc(-c2ccc(Cl)cc2)cc1F 106754650 ORIZBQLQFBQBDM-UHFFFAOYSA-N 393.849 5.097 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C(=O)[C@H](C#N)c1ccccn1)c1ccccc1 106983778 PJHRUDUIINSNQR-GCJKJVERSA-N 376.843 5.040 30 20 GKED Cc1ccc(N2C(=O)/C(=C/c3cccc(OCCCC#N)c3)SC2=S)cc1 110420871 OILUXSJWURAQQA-RGEXLXHISA-N 394.521 5.083 30 20 GKED C=C(C)COc1cc(CNc2cccc(NC(=O)c3ccoc3)c2)ccc1OC 126293204 QYMQLFFWXPGDDM-UHFFFAOYSA-N 392.455 5.108 30 20 GKED Cc1c(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1CCC(C)C 160209156 CIHYSCSCPCINFK-HNNXBMFYSA-N 385.537 5.133 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 160970156 ZIBJXVICZWHFMF-AEFFLSMTSA-N 390.936 5.019 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 174340987 REXFXKYJCGNUEH-IBGZPJMESA-N 398.510 5.301 30 20 GKED Cc1csc([C@@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C2CC2)n1 174541614 RTMMJEHPJLIUCT-QFIPXVFZSA-N 389.524 5.143 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3c(Cl)cccc3Cl)c2)c1 174993222 FZLOGNVBKYLUGC-UHFFFAOYSA-N 397.261 5.696 30 20 GKED O=C(/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(Cl)nc1 179412763 KANDBXHPYPTVSH-CSKARUKUSA-N 397.261 5.537 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(COC2CCCC2)cc1 184034195 DUCYSEDKJQTZMD-MRXNPFEDSA-N 379.460 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@]1(O)CCC[C@@H](C(F)(F)F)C1 191511895 XLOIHPNIOZLZKK-OXQOHEQNSA-N 398.469 5.144 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)cc1 236745255 SQIPKBMYVVYUAI-OAQYLSRUSA-N 377.285 5.200 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CC[C@H]3CCCC[C@@H]3C2)C1 328748984 BKXNIGDDZVDRCM-ANTGDGSKSA-N 397.563 5.628 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cnc(-c4ccncc4)s3)c2C#N)[C@@H](C)C1 410977780 KWBMPDMFRBTMAX-RYUDHWBXSA-N 394.525 5.076 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1CN(C)c1ccccc1 433771654 SLSYPICOUFMBCK-UHFFFAOYSA-N 378.520 5.117 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2ccco2)nn1C(C)C 433917058 CLKHVVIRVVDQPN-UHFFFAOYSA-N 391.475 5.040 30 20 GKED COC(=O)c1cccc(-c2nc(CSCc3ccc(C#N)cc3F)cs2)c1 437422267 YYUVDKHKQOPKBD-UHFFFAOYSA-N 398.484 5.041 30 20 GKED C[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 438078203 WVGYFCJOSXASMN-KRWDZBQOSA-N 383.451 5.329 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccnc(Oc2ccccc2)c1 438481146 CLUUWSDPEOHTKK-YADHBBJMSA-N 398.466 5.178 30 20 GKED N#Cc1ccc(OCc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1Cl 438895380 NIDOXODMAOYVLV-UHFFFAOYSA-N 380.618 5.147 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)N[C@H](CCC#N)c2ccccc2)cc1 440251946 FFDROUXILSIVNC-DHIUTWEWSA-N 391.515 5.367 30 20 GKED C=CCC1(c2nc(CC(=O)Nc3c(Cl)cccc3Cl)no2)CCCCC1 453170377 GLFUQJRYSIJKMU-UHFFFAOYSA-N 394.302 5.336 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1conc1CC)c1ccc(C(F)(F)F)cc1 454717514 XXGJUMIKHCSPGQ-GOSISDBHSA-N 395.425 5.105 30 20 GKED Cc1ccsc1C(=O)Nc1ccc(Oc2nc(C)c(C#N)cc2Cl)cc1 461768562 PIQSLTOHZOXNKF-UHFFFAOYSA-N 383.860 5.330 30 20 GKED C=CCOc1ccc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2c2ccncc2)cc1 463005022 CEIQOBATNOZHHF-OAQYLSRUSA-N 391.858 5.071 30 20 GKED N#C[C@@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccccc1Cl 464395621 BFGVVIOKHLVFOX-GOSISDBHSA-N 396.874 5.625 30 20 GKED C=CCC(CC=C)C(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 467738039 QTTIZWLIUFHWFM-QFIPXVFZSA-N 388.511 5.193 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)c1 469048443 RBJFVQATYXPVQD-UHFFFAOYSA-N 396.418 5.625 30 20 GKED COc1ccc2cc(CNc3ccc4c(c3)CCC(=O)N4CCCC#N)ccc2c1 469296278 VCWRDSLTWDVHBY-UHFFFAOYSA-N 399.494 5.043 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1 474697437 LOEGFYPYVCURKT-UHFFFAOYSA-N 386.417 5.311 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2cccs2)nc1C 476160808 SSGUJTHBTFUXDI-UHFFFAOYSA-N 382.554 6.284 30 20 GKED CCOc1c(Cl)cc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1Cl 476700501 PQJGKKGTTDVXMY-CQSZACIVSA-N 377.271 5.418 30 20 GKED N#Cc1cc(NC(=O)c2ccc(Cl)cc2Cl)ccc1OCC(F)(F)F 481880258 GGNYUQLZKSYEFI-UHFFFAOYSA-N 389.160 5.058 30 20 GKED Cc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c(-c2nc3ccccc3[nH]2)c1 483340571 LATILQYXORNBIY-UHFFFAOYSA-N 394.478 5.592 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)s1 487313150 ZALXNKNPOYHLKK-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#CC1(CCCN2CC=C(c3ccc(Cl)c(Cl)c3)CC2)CCOCC1 499620324 SABBKKCTBGPVES-UHFFFAOYSA-N 379.331 5.183 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1cc(F)ccc1OC 504726907 WXSHSODORYDFAW-GFCCVEGCSA-N 382.888 5.008 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN(C1CC1)[C@@H](C)c1ccccc1 512291242 GLVWAQPADFUMQR-ROUUACIJSA-N 393.556 5.102 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1F 512661055 PSCQDZNJKSLWLR-QWHCGFSZSA-N 399.922 6.195 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccccc2COc2ccccc2)cc1OC 516141620 XXCDWPNJZXYIOU-UHFFFAOYSA-N 389.451 5.091 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 517530217 LLADSCBPOOKTSN-INIZCTEOSA-N 387.439 5.242 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)c1cccs1 522683988 IVZRJCZBLPEMNG-NRFANRHFSA-N 376.525 5.430 30 20 GKED N#Cc1ccc(C2(NCc3ccc(Cl)c4ccccc34)CCOCC2)cc1 528786066 UZPYDNQQVWQREU-UHFFFAOYSA-N 376.887 5.160 30 20 GKED C[C@H](C(=O)Nc1ccc(C#N)cc1Cl)c1cccc(C(=O)c2ccccc2)c1 535605217 ZIQKCEHRHQLXIA-HNNXBMFYSA-N 388.854 5.185 30 20 GKED CC(C)CSCCCNC(=O)c1ccccc1SCc1ccc(C#N)cc1 535953169 HSBGOTUUWUEOEU-UHFFFAOYSA-N 398.597 5.360 30 20 GKED COc1cc(C#N)ccc1NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 547415708 DVNYGKUUMTUORK-NSHDSACASA-N 378.259 5.099 30 20 GKED Cc1c(C(=O)NCc2ccc(-c3ccncc3)cc2)sc2ccc(C#N)cc12 551364817 FRKZUGYFJACBPN-UHFFFAOYSA-N 383.476 5.073 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cc(F)ccc1Sc1ccc(Cl)cc1 561866382 FBAAXHAPFHXMRW-UHFFFAOYSA-N 390.911 5.690 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)SCc1ccc(OC)c(C#N)c1 573836252 CHSVROSPQBBAFH-JKSUJKDBSA-N 382.529 5.341 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)c1nc(C2(c3cccc(C(F)(F)F)c3)CC2)no1 580635233 ZEFHGGDZSOCJMD-CYBMUJFWSA-N 399.372 5.180 30 20 GKED C[C@H](NC(=O)[C@@H]1CC[C@H](C(F)(F)F)C1)c1ccc(-c2cccc(C#N)c2)cc1 586806318 SXMDZCDAVZFECA-KPOBHBOGSA-N 386.417 5.381 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)CCCCCC#N 588166698 IBMNWPVFZPXZMD-UHFFFAOYSA-N 380.332 5.157 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@@H](C2CCC2)C1 591337237 UCYPGZIKLMXQAI-OAQYLSRUSA-N 389.499 5.100 30 20 GKED COc1cc2nc(/C=C\c3cccc(OCCCC#N)c3)sc2cc1OC 608845854 JJJFGRNDDPTCKJ-HJWRWDBZSA-N 380.469 5.166 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3cc(C#N)ccc3OC(F)F)cs2)c(C)c1 609066300 BULFUIQAVSLOND-UHFFFAOYSA-N 399.422 5.152 30 20 GKED Cc1cnc(-c2cccc(NC(=O)N(Cc3ccc(C#N)cc3)CC(C)C)c2)o1 609435998 DQLYCCSTWAGAAC-UHFFFAOYSA-N 388.471 5.212 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)c1cccc(F)c1 609826943 PLTOMEPOQIDSLA-HNNXBMFYSA-N 385.508 5.319 30 20 GKED CCCc1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 610224122 CGETZEKLPCKRPD-KRWDZBQOSA-N 395.915 5.657 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@@H](C)c1cccc(C#N)c1 610363078 WVCSIUJVKKFATK-JTQLQIEISA-N 387.917 5.196 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 611548667 DQBHLNNWXCIVJT-WMLDXEAASA-N 388.389 5.154 30 20 GKED N#C[C@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1ccc2ccccc2n1 613291259 XIPJEAIHSYPWNV-QFIPXVFZSA-N 394.499 6.017 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619769227 KENFYGARUDLRJT-NSHDSACASA-N 396.705 5.421 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(C)n(C)c2ccc(OC)cc12 648368143 AAELLISFJKKAMY-UHFFFAOYSA-N 376.500 5.600 30 20 GKED COc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2c1 676997611 CWDRHQPTWLZCCR-HXUWFJFHSA-N 393.446 5.159 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1 680523734 XRCUUNOCGBSCMJ-AWEZNQCLSA-N 393.247 5.050 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)c(F)cc1N1CCCCC1 685689154 FKFJIMSDYWOLHE-UHFFFAOYSA-N 391.487 5.237 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(SC(F)(F)F)cc1 728006897 VQACKTWHYNUMKD-UHFFFAOYSA-N 383.288 5.709 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)c(F)c2)cc1 730936255 CVWYVXNLRVZUOM-UHFFFAOYSA-N 391.446 5.182 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](C)c1csc2ccccc12 732918570 OLPOKPKVCHHLFO-CVEARBPZSA-N 384.570 5.217 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(Sc3ccccc3)CCCC2)c1 733771263 MEZPKOUUTAQJJV-IBGZPJMESA-N 394.540 5.089 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H](CC)c2ccccc2)c1 733806201 IDNKBGKLWRPUEL-UNMCSNQZSA-N 379.504 5.050 30 20 GKED Cc1cccnc1[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(C)C 734643865 JDNLNPGXGHHVEF-GOTSBHOMSA-N 398.510 5.564 30 20 GKED Cc1ccc(CN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)C2CC2)o1 740483116 MYPWTXFPTLSYPD-UHFFFAOYSA-N 391.496 5.062 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3ccc(Oc4cnccn4)cc3)c(C)c2c1 743055635 HQFYZQPNFSOMTH-UITAMQMPSA-N 386.407 5.228 30 20 GKED Cc1ccc(CC[C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 743096272 PQILZUYBJCHEMT-UZUQRXQVSA-N 387.483 5.386 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(OCc3ccncc3)cc2)ccc1SC 747615026 RGAHZBBJVXQBPE-WEVVVXLNSA-N 391.492 5.287 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C\c3ccc(Cl)c(C(F)(F)F)c3)ccc21 754688899 BITDXHVCKIMJCA-BAQGIRSFSA-N 393.792 5.164 30 20 GKED C=C(C)[C@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)OCC 756472260 VDHHLRBORJFRKG-NHYWBVRUSA-N 399.274 5.019 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 767420699 LDRQAPQGTPEDQY-UZUQRXQVSA-N 391.902 5.099 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 767585811 MEXDIKDDVKROJD-LOSJGSFVSA-N 395.506 5.711 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cnc(C3CCCC3)s2)S1 767718287 SROJUHFFQSPHJP-MHWRWJLKSA-N 383.542 5.309 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(Br)s2)cc(OC)c1OC 772953534 JUSQJPMCYIMOHB-GFCCVEGCSA-N 396.350 5.107 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(SCC(F)F)cc2)c1 772986012 YYSHXFWBNNMAHV-CRAIPNDOSA-N 390.499 5.576 30 20 GKED C=CC[C@H](N[C@@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccncc1 775392622 HVBUGAZZMABDQA-CVDCTZTESA-N 379.548 5.044 30 20 GKED CC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cc(F)cc(Br)c1 776808827 LDTYEDRGLLIXRM-DJJJIMSYSA-N 391.284 5.120 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1 777834048 OSVUEPXCOMWLKZ-FQEVSTJZSA-N 380.488 5.010 30 20 GKED O=C(/C=C\c1cccc(Br)n1)c1ccc(SCC(F)F)cc1 777918493 MIEQOTVATGTVQD-TWGQIWQCSA-N 384.245 5.097 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C#N)cc1F 778218159 PVCUTJDIAFWNNL-NRFANRHFSA-N 395.478 5.212 30 20 GKED C[C@H](NCc1occc1Br)c1ccc(-c2cccc(C#N)c2)cc1 782379677 BCNWRFZLAPLRQK-AWEZNQCLSA-N 381.273 5.432 30 20 GKED CC(C)(C#N)CCCOC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 784350081 ILIANYNQIDCEJS-UHFFFAOYSA-N 393.270 5.667 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C\c1cccc(-c2cccnc2)c1 787179868 RXYLAVXBCOFAHJ-YFHOEESVSA-N 377.827 5.085 30 20 GKED O=C(/C=C/c1cnc(-c2ccco2)s1)c1ccc(Br)cc1F 789143679 QFLGUZBQLIXMJT-GQCTYLIASA-N 378.222 5.201 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C/c3ccc(-c4cccc(F)c4F)o3)ccc21 790225164 KCBRMUWQFPTOJT-JXMROGBWSA-N 393.389 5.030 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792095671 WQVTWQDKHYXHGF-JOCHJYFZSA-N 384.479 5.273 30 20 GKED COc1ccc(OCc2nc(/C=C3\C(=O)c4ccccc4[C@H]3C)cs2)cc1 809159319 NJGVUJDYFVTPGY-LPKQHDGYSA-N 377.465 5.114 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC/C(C)=C\c2ccccc2OC(F)F)c1 810145192 VMQIRUYNLDWQPA-QMDZLVRISA-N 386.442 5.162 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1csc(-c2ccccc2F)n1 812245633 WFQLIYHUJFNQHZ-CMDGGOBGSA-N 393.468 5.364 30 20 GKED CCN(CC)c1ccc(C=Nc2cccc(NC(=O)c3cccs3)c2)c(O)c1 819839573 LULUGYKLZYMXPP-UHFFFAOYSA-N 393.512 5.303 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 835069241 YJVONJNIKYEKLT-ZWNOBZJWSA-N 386.826 5.618 30 20 GKED CC(=NOCc1cc(-c2cccs2)on1)c1nc2ccccc2n1C(F)F 836978686 USLAYOMSMHOADZ-UHFFFAOYSA-N 388.399 5.089 30 20 GKED COc1cc(OC)cc(Oc2ccc(/C=C\C(=O)c3scnc3C)cc2)c1 920864291 QYTKFALMUZTURP-TWGQIWQCSA-N 381.453 5.157 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1sc(-c2ccc(C)cc2)nc1C 1776074204 NOLSKTRRTOUWSD-UHFFFAOYSA-N 383.448 5.100 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1cc(C(C)(C)C)cc2c1CCC2(C)C 1776090052 RUAQKWSDSJVMPB-UHFFFAOYSA-N 392.543 6.051 30 20 GKED O=C(/C=C\c1ccc(OC(F)(F)C(=O)O)cc1)c1ccc(-c2ccccc2)cc1 1776131265 MVQNCHZPOCRGHT-NVNXTCNLSA-N 394.373 5.306 30 20 GKED CCN(CC)c1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776860390 MGTYPPVOHUCYCM-AUWJEWJLSA-N 389.451 5.387 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1c(F)ccc2sc(C(=O)O)cc12 1777559837 JRXIUCVEWAGPKC-SOFGYWHQSA-N 380.396 5.689 30 20 GKED O=C(O)c1ccc(/C=C2\CCc3cc(Br)ccc3C2=O)c(Cl)c1 1777673295 KXAJMECUXCREGA-KPKJPENVSA-N 391.648 5.013 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)c3oc4ccccc4c3C)cc2)CCC1 1788967523 LAWPITTWRSTYGL-UHFFFAOYSA-N 388.467 5.065 30 20 GKED N#Cc1ccc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)cc1Cl 12832431 CCMOZLDWILIFRF-UHFFFAOYSA-N 386.238 5.091 30 20 GKED CCCN/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccc(C(CC)CC)cc1 22804201 MCVCGFWCJLNDLG-UHFFFAOYSA-O 397.608 5.433 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccn1 43181764 MLYDBENZAPBHQQ-DNVCBOLYSA-N 390.874 5.273 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2sccc2C1 56800304 GGGLNWKQBMTOQS-UHFFFAOYSA-N 389.480 5.311 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccc(Oc4ccccc4C#N)cc3)o2)cc1 72030867 DWVLQQRZWJZTMI-KRWDZBQOSA-N 396.450 5.882 30 20 GKED C=CCn1c(S[C@H](C)c2ccncc2)nc2sc3c(c2c1=O)CC[C@@H](C)C3 72033791 ABFJURVEOZOMAK-ZIAGYGMSSA-N 397.569 5.017 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1ccccc1Br 108199661 UDXQSVAHEOFYKS-UHFFFAOYSA-N 389.318 5.026 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)n1 108624240 HJHWNGMSKPQPFO-AWEZNQCLSA-N 398.919 5.214 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(C(F)(F)F)cc2)ccc1OC 113308870 OXECDSILXZYQNE-KBXCAEBGSA-N 392.421 5.246 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(Br)c1 118980200 VARWDMYZHSGXFZ-CYBMUJFWSA-N 389.318 5.404 30 20 GKED C=C[C@H](CC(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1)c1ccccc1 124914090 CTSOJPOSHQHDLK-MRXNPFEDSA-N 380.875 5.280 30 20 GKED CC[C@@H](C#N)Sc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 127012981 AZFBPQIPFRIYAT-ZDUSSCGKSA-N 393.299 5.287 30 20 GKED Cc1ccc(C)c([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 137447068 OTRIIXKZGJEDSL-UTKZUKDTSA-N 393.556 5.924 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3cc(Cl)ccc3C)n2)cc1 160125582 HWDZJTYCFZQKJD-INIZCTEOSA-N 397.887 5.026 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1cccc(F)c1F 161576482 NZSKPLLHNNYMEO-STQMWFEESA-N 375.444 5.242 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2SC(F)F)c1 172207055 IYVKWYJZZPBYFB-UHFFFAOYSA-N 377.416 5.328 30 20 GKED N#CCSc1ccccc1NC(=O)CN(Cc1ccsc1)c1ccccc1 173283446 FQVUOKKYSPJPRV-UHFFFAOYSA-N 393.537 5.009 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccc(OC)cc1 177197921 FXNFEDPRONSPEY-AWEZNQCLSA-N 398.532 5.279 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(OCc3cccs3)c2)n1 177759648 LNPWAORMALIRHX-KRWDZBQOSA-N 382.510 5.397 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc3cc(C)c(C)cc3o2)ccc1OC 180815089 REVJQUVWFAJNSO-XLIONFOSSA-N 392.499 5.590 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2nc(C3CCCCC3)no2)cc1Cl 237511943 ZCPGBIHJYRQBMV-CQSZACIVSA-N 375.900 5.186 30 20 GKED CC[C@@H]1C[C@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 245743494 SAWMXVGWXIHSOJ-YVWKXTFCSA-N 382.891 5.139 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/Cc1ccc(Cl)cc1Cl 330231172 DWIWUXJUXDWMJH-LBPRGKRZSA-N 385.316 5.157 30 20 GKED N#CCSc1cccc(C(=O)NCCSCc2cccc3ccccc23)c1 430725389 QVEOHETXXGATQJ-UHFFFAOYSA-N 392.549 5.119 30 20 GKED N#CCCC[C@H](NCC(=O)N[C@H](c1ccccc1)C1CCCC1)c1ccccc1 433020663 OIZJXWGJFPEXLJ-UKILVPOCSA-N 389.543 5.059 30 20 GKED N#CCCC[C@@H](NCc1ccc(OCc2ccc(F)cc2)cc1)c1ccccc1 433021268 QDAYTJJXLDGBIN-RUZDIDTESA-N 388.486 5.929 30 20 GKED CCc1ccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)cc1 433021924 SFLLULIFCRIBEY-QFIPXVFZSA-N 375.541 5.897 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc2sc(C)nc2cc1Cl 435176898 JSKGWAYUEPLXOP-UHFFFAOYSA-N 377.922 5.540 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc2c3c(cccc13)CC2 437614710 MRJQFEUKVVWCIK-JTHBVZDNSA-N 381.479 5.242 30 20 GKED CC(C)[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 438861643 JIHQPVLDUXSKJU-LJQANCHMSA-N 389.421 5.116 30 20 GKED CCn1c2ccccc2c2cc(NC(=O)c3c(F)cc(C#N)cc3F)ccc21 445639553 HKWVTNMMODWRAV-UHFFFAOYSA-N 375.378 5.217 30 20 GKED CCc1c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cnn1CCC(C)C 455272133 RSDDVBFBDXQGII-IBGZPJMESA-N 381.524 5.048 30 20 GKED C[C@@H]1CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC[C@H]1c1ccccc1 460644775 XVHCMOAMFOVAHR-WZONZLPQSA-N 397.478 5.011 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)CCCC#N 462144585 YVODVLODXYTXID-UHFFFAOYSA-N 378.451 5.364 30 20 GKED C=CCC(CC=C)C(=O)N(CCC)[C@@H](c1cccnc1)c1ccc(F)cc1F 467528641 HIDUWOVRXZTXDE-QFIPXVFZSA-N 384.470 5.456 30 20 GKED C[C@@H](S[C@@H](c1ccccc1)c1ccc(Cl)cc1)C(=O)NC1(C#N)CCC1 468474962 LCKPJQIJBSMFCH-BEFAXECRSA-N 384.932 5.114 30 20 GKED Cc1ccc([C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CCCC2)o1 469163718 YDVYVDBGIMYPCJ-XMMPIXPASA-N 391.515 5.514 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1ccc(F)c(C#N)c1 469693243 YGRDSAOYGVJVGC-CQSZACIVSA-N 394.475 5.354 30 20 GKED CC[C@H](CN(CC)C(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 480537181 FVBFUNZLOSEZOG-RBUKOAKNSA-N 395.572 5.986 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H](C)c1ccc(C#N)cc1 481334754 DUXCOCPWHPRDOU-AWEZNQCLSA-N 398.919 5.255 30 20 GKED Cc1c([C@H](C)N[C@H]2CCCCc3cc(C#N)ccc32)cnn1-c1ccc(F)cc1 481659072 ILCKXILDERXCGQ-FYSMJZIKSA-N 388.490 5.310 30 20 GKED Cc1c([C@@H](C)NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)oc2ccccc12 481668092 LUVFKGJJWVBCPN-MRXNPFEDSA-N 397.434 5.291 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)ccc1NC(=O)CC(C)C 483192858 HPTHQYYFENJXIX-FQEVSTJZSA-N 385.467 5.018 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC(n2c(C)ccc2C)CC1)c1ccc(F)c(F)c1 483309225 OFKIARCEMGULEA-OAQYLSRUSA-N 387.474 5.047 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2c(-c3cccs3)nc3ccccn23)cc1 483460883 LRRASHFSGMNKPS-UHFFFAOYSA-N 386.480 5.116 30 20 GKED Cc1ccc2c(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)csc2c1 483529783 GKXQJZUGXMWDFF-OAHLLOKOSA-N 375.478 5.218 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc2ccccc2n1 486233316 WDUQQQAVYBYMMT-INIZCTEOSA-N 375.497 5.200 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)N[C@@H](CCCC#N)c1ccccc1 487467676 BNFGTRHQKJCXPP-FQEVSTJZSA-N 389.524 5.207 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1cccs1 489430133 GJCFBEWBHNNUQH-AWEZNQCLSA-N 394.525 5.701 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 490228091 YSDKYHADPRRXTI-IERDGZPVSA-N 379.529 5.662 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1C(C)C 496027238 GFGLCVCXXCPQFK-KRWDZBQOSA-N 383.904 5.644 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1 497991645 ZCPMKUZHZXUHEL-UHFFFAOYSA-N 375.478 5.073 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@H]2c2ccc(Cl)cc2)c1C 501848504 IHFOEDGMHNESRW-QFIPXVFZSA-N 395.934 5.041 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cccc(Oc4ccncc4)c3)n2)c1 502393728 QOABPOGJTRJZCE-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H]1CCC[C@H](N(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 511391532 POYORTDTHNAAFG-RXVVDRJESA-N 391.515 5.374 30 20 GKED CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511398745 OGWKAWSQZJNEPI-KNQAVFIVSA-N 391.515 5.422 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 513118374 KCLKQKUMFOFWMT-QGZVFWFLSA-N 381.442 5.272 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(Oc2cccnc2)cc1 514177448 DIZJLSQXFTVTFE-QGZVFWFLSA-N 393.512 5.394 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 517905445 CSFTUDFLOVCYDI-FQEVSTJZSA-N 397.478 5.680 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCCn1ccc2ccccc21 518168480 IDUXBIYNROPIHS-KRWDZBQOSA-N 392.528 5.105 30 20 GKED Cc1ccc(CSCCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520939142 LJTDRHFKMDYQDC-KRWDZBQOSA-N 399.585 5.444 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(-c2ccc(Cl)s2)on1 521142300 ABMUGRKBDJWCSW-UHFFFAOYSA-N 399.903 5.227 30 20 GKED N#C[C@H](NC(=O)CSc1ccc(Cl)cc1)c1cccc(Cl)c1Cl 521293577 ZWERZQIGOGZMEP-AWEZNQCLSA-N 385.703 5.120 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cnc(-c4ccccn4)s3)c2)cc1 521493876 RFTJRVAQABZDHH-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1CCC(c2ccccc2)CC1 524565107 HROCKNUHRAJYHY-KKXNLOMOSA-N 393.556 5.786 30 20 GKED C=CCn1c(SCc2cc(Cl)ccc2Cl)nnc1-c1ccncc1 525623026 XQSIZWCHZZCTNM-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C=C[C@@H](CC(=O)NCc1cccc(NC(=O)c2ccc(C)cc2)c1)c1ccccc1 535350394 PJWONXJLEBVEFZ-NRFANRHFSA-N 398.506 5.223 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(C(F)(F)F)cc1Br 540764569 NRSWFIUZZQZJJR-UHFFFAOYSA-N 394.231 5.169 30 20 GKED Cc1ccc(C(C)(C)NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cn1 544717465 FNVDXKLGNDYSLR-UHFFFAOYSA-N 387.508 5.078 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)c1cc(C#N)ccc1Cl 556929552 DQFYGZNPAWTVFQ-AWEZNQCLSA-N 395.915 5.477 30 20 GKED Cc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c(Br)s1 557356496 XRNUVYHDNOMQJJ-UHFFFAOYSA-N 383.336 5.302 30 20 GKED CC(C)c1ccc2occ(C(=O)N3CCC(Oc4ccc(C#N)cc4)CC3)c2c1 557503841 TXXNWIGUEAFIDF-UHFFFAOYSA-N 388.467 5.111 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 576892018 AKLBWDFHDKKFJI-HNAYVOBHSA-N 397.316 6.281 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 578582167 YUWVDKLQRPZKKA-POAQFYNOSA-N 395.528 5.123 30 20 GKED COc1ccc(/C=C(/C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1F 588447772 XZVSDSISYRDLFX-OOXMNIKJSA-N 392.455 5.238 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CCc2ccc(F)cc21 593160887 ZWHBNDBNKDXQCJ-HZPDHXFCSA-N 397.519 5.271 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N 600038273 OYECWPKHUSRCKP-LLVKDONJSA-N 386.320 5.099 30 20 GKED Cc1cccc(-n2ncc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)c2C)c1 603968582 CXLHYUQACVDMKP-UHFFFAOYSA-N 398.491 5.342 30 20 GKED O=C(CC(F)(F)F)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 607064178 JPPFNCQLEULXGE-UHFFFAOYSA-N 385.251 5.251 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056113 AFHMLPLACCJAPF-HNNXBMFYSA-N 394.858 5.217 30 20 GKED CC(C)CCN(CCC#N)C(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1 609518063 AJDMNWGYGURQKT-UHFFFAOYSA-N 383.561 5.264 30 20 GKED N#Cc1cccc(-c2nnc(CSC(c3ccccc3)c3ccccc3)o2)c1 610216849 CGLMWAPXZULGHN-UHFFFAOYSA-N 383.476 5.631 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCCOc3ccccc32)cc1 611526778 LPVNVCVBPWTNKF-UHFFFAOYSA-N 386.476 5.139 30 20 GKED CC(C)(c1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1)C(F)(F)F 617554350 ZSBFHQNKGSNZIG-UHFFFAOYSA-N 385.389 5.257 30 20 GKED C=CCOc1ccc(CNC(C)(C)c2ccc(Br)cc2)cc1OC 620626970 BDPHTKSCDYBDNR-UHFFFAOYSA-N 390.321 5.047 30 20 GKED Fc1cc(CNc2cccc(NCC(F)(F)F)c2)ccc1OCC(F)(F)F 630068663 WXIRETGJNIWIFE-UHFFFAOYSA-N 396.306 5.353 30 20 GKED C=CCN(C(=O)c1cc2c(s1)CCCC2)c1nc(-c2ccccc2)cs1 641900257 BCALWGYANYJDGG-UHFFFAOYSA-N 380.538 5.583 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c1-c1ccccc1 683105836 FZIBQZSZASHARX-LJQANCHMSA-N 380.451 5.169 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)s2)c(C)c1 684674931 HOKJUNQQVWNDEZ-HNNXBMFYSA-N 395.553 5.671 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)s2)c(C)c1 684674932 HOKJUNQQVWNDEZ-OAHLLOKOSA-N 395.553 5.671 30 20 GKED C#CC[C@H](OC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1ccccn1 727775378 GDKHSSNOGLCVOE-DEOSSOPVSA-N 383.447 5.019 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@H](C#N)C(=O)Nc2ccc([C@@H](C)CC)cc2)cc1 727954728 SZGKGKQWQDCYQV-HOIFWPIMSA-N 376.500 5.214 30 20 GKED CC(=NNc1nc(-c2ccccc2)no1)c1csc(-c2csc(C)n2)c1 729145190 JQPMBKJLLPJRMY-UHFFFAOYSA-N 381.486 5.066 30 20 GKED Cc1ccccc1-c1cccc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)c1 729643591 CEOWLDBPPWWOGR-ZROIWOOFSA-N 383.447 5.515 30 20 GKED C#CCOc1ccc(NC(=O)N(CC)[C@H](C)c2cccc(C(F)(F)F)c2)cc1 731113524 BMCRXPJOSLFRBK-OAHLLOKOSA-N 390.405 5.332 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 731293466 ZSPUSVTZDBAOAF-IPMKNSEASA-N 386.451 5.569 30 20 GKED C[C@@H]1CCC[C@H](OCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 733052913 UIIUDQLPRWZMOE-COXVUDFISA-N 388.920 5.235 30 20 GKED C=CC[C@@H](NC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1ccncc1 734360010 FFBHPIMYEOVLDZ-MLGOLLRUSA-N 381.328 5.303 30 20 GKED CCN(CC)C(=O)[C@@H](Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 734850229 YFACEXSKQDNVNE-DQEYMECFSA-N 397.522 5.364 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3c(Cl)nc4ccccn34)s2)cc1 737448022 CDLFNLBLQXZUEQ-KTKRTIGZSA-N 379.872 5.316 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3csc(Br)c3)c2)s1 740014903 ZIQPSDFTEPHVAQ-UHFFFAOYSA-N 389.343 5.401 30 20 GKED O=C(/C=C\c1ccccc1OCC(F)(F)F)c1cccc(-c2ccncc2)c1 741840852 GFUSGMONCRXSNS-HJWRWDBZSA-N 383.369 5.586 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)Nc1ccccc1 745723703 FJLWGUNVURDTCI-UHFFFAOYSA-N 375.472 5.409 30 20 GKED CC1(CC(=O)[C@@H](C#N)C(=O)Nc2ccc(SC(F)F)cc2)CCCCC1 753531848 GSQZBCHNVSOXLD-OAHLLOKOSA-N 380.460 5.009 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1Cl 754829453 MGMALAZXEPMISR-UGSOOPFHSA-N 382.920 5.009 30 20 GKED O=C(/C=C\c1c(C2CC2)nc2sccn12)c1cc(Br)ccc1F 774555662 UGNAMDNAZMZYGD-WAYWQWQTSA-N 391.265 5.071 30 20 GKED C#CCCCCCC(=O)N(c1ccc(OCC)cc1)c1nc2ccccc2s1 779719498 WBKPJBYBRQXJEM-UHFFFAOYSA-N 392.524 5.943 30 20 GKED Cc1ccc(Cl)c(NC(=S)Nc2ccccc2O[C@H](C)C#N)c1Cl 779727029 JHCABSNYMPYXIK-LLVKDONJSA-N 380.300 5.402 30 20 GKED CC(C)Sc1cccc(Cl)c1C=NNc1oc(C(C)(C)C)nc1C#N 786040159 LTGXOYOKZAEMSH-UHFFFAOYSA-N 376.913 5.444 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ncc(C(F)(F)F)s1 788355738 PKJIHSRHIPLKDY-BQYQJAHWSA-N 380.416 5.490 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)NCCCCC(F)(F)F)cc1 794974733 SYMALRSRPFWIKW-SFHVURJKSA-N 391.462 5.361 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(F)c3ccccc23)ccc1OC 815592459 JDBLQGBDDSZYQV-AEFFLSMTSA-N 392.474 5.519 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)C1CC2(CCCCC2)C1 850758420 FFZNFZMDQOLMRK-AWEZNQCLSA-N 379.287 5.001 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(Br)c2)cc1 915085271 JSWUUNXNWVGFEO-QGZVFWFLSA-N 397.297 5.418 30 20 GKED O=C1Nc2ccc(-c3ccccc3)cc2C1=NNc1nc(-c2ccccc2)cs1 915956055 NTXBTWBPCKSCDC-UHFFFAOYSA-N 396.475 5.245 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(-c2ccc(F)cc2)s1 916907543 BTWFZZGNVVASHN-CQSZACIVSA-N 398.846 5.169 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3)o2)cc1 917518085 UCMHCLNJZPKIOR-QBFSEMIESA-N 384.435 5.155 30 20 GKED CCOC(=O)c1oc2c(c1C)C(=O)/C(=C\c1csc(-c3ccsc3)n1)CC2 920066297 WTTXYYULVLJUAD-WQLSENKSSA-N 399.493 5.162 30 20 GKED C=CCCC[C@@H](NCc1cc(Cl)ccc1Oc1ccccc1CC)C(=O)O 1776174254 JBBGTHIQBMKKFZ-LJQANCHMSA-N 387.907 5.594 30 20 GKED CCCCCC[C@@](C)(NCc1cccc(OCc2ccccc2C#N)c1)C(=O)O 1776803973 HMDQQHKALNFQMC-XMMPIXPASA-N 394.515 5.041 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)n(C2CCCC2)n1 1777420931 QFOPDASKZLBLJQ-ZHACJKMWSA-N 390.439 5.161 30 20 GKED C=CCNc1nnc(SCc2csc(-c3ccc(Cl)cc3)n2)s1 5784688 IWMKWVCNVISKSY-UHFFFAOYSA-N 380.951 5.205 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2c(C)cccc2C)cc1 11153238 UXGJMWWOQXIUPN-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc(Br)ccc1Cl 56212336 AXXMEUIGBQZULG-UHFFFAOYSA-N 393.668 5.014 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 66917451 IGQXDTLYOKHHTJ-CQSZACIVSA-N 382.460 5.096 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)/C=C/c2cccc(F)c2)cc1 108373876 JPBDCOFUXVZCON-JLHYYAGUSA-N 386.426 5.123 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cnoc1-c1ccc(Cl)s1 135575958 KJDRICVTASYVOH-GFCCVEGCSA-N 389.933 6.063 30 20 GKED CCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)[C@@H](C)c1ccc(F)cc1 216751974 POGGYLXVYGWJBW-INIZCTEOSA-N 392.430 5.093 30 20 GKED N#Cc1csc(CNCc2ccc(OCCOc3ccc(Cl)cc3)cc2)c1 237758592 QZCCKHSSLAEQGN-UHFFFAOYSA-N 398.915 5.021 30 20 GKED CC(C)c1ccc(N=C(O)N2CCC(C(=O)OC(C)(C)C)CC2)c(C(C)C)c1 330633948 KUAHNVZSDQLJMR-UHFFFAOYSA-N 388.552 5.533 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(CNC(=O)c2cccs2)cc1 410375676 PTHNPTQJIPRLQR-UHFFFAOYSA-N 390.508 5.049 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(CN)nc1C)c1ccc(C(F)(F)F)cc1 423001077 HNZQTHWBOKFTGJ-MGPUTAFESA-N 377.454 5.226 30 20 GKED N#C[C@@H](C(=O)c1c[nH]c(C(F)(F)F)c1)c1nc(-c2ccc(Cl)cc2)cs1 429685179 VTBPQNHISHBSPG-LBPRGKRZSA-N 395.793 5.300 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@@H]1CC[C@H](C)C1 429735428 FLCMDEAKRAZDQP-OXJNMPFZSA-N 377.488 5.098 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 431810512 NLEBQPLHQMPHDZ-XMSQKQJNSA-N 379.504 5.269 30 20 GKED N#CCCC[C@@H](NC(=O)NC(c1cccs1)c1cccs1)c1ccccc1 431979836 GGLRPTDGABDOBT-QGZVFWFLSA-N 395.553 5.633 30 20 GKED CC(C)CC(=O)Nc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 432687923 BEJSAYWZOVRAHV-NRFANRHFSA-N 392.503 5.228 30 20 GKED Cc1c(Br)ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1F 433734979 GWQASTLOSYGLSV-HNNXBMFYSA-N 390.256 5.063 30 20 GKED N#CCCn1cc(CN[C@H]2C[C@H](c3cccc(Cl)c3)C2)c(-c2ccccc2)n1 435733417 BPMYFELLHJHRTG-XYWHTSSQSA-N 390.918 5.153 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1c(C#N)cccc1C#N 436304116 FWCJBIIESGUAAG-UHFFFAOYSA-N 384.439 5.018 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(O)c(-c2nc3ccccc3s2)c1 436662733 JSSSJIXZJSDSTN-UHFFFAOYSA-N 396.512 5.370 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438860120 QPUVXYNROWZRHA-FVJLSDCUSA-N 383.923 5.518 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2Cc2nnc(-c3ccc(C#N)cc3)o2)cc1 441220501 AOKYJDOVCHKVGY-NRFANRHFSA-N 386.499 5.243 30 20 GKED Cc1cc(Br)c(NC(=O)N(CCC#N)CCC(C)C)cc1Cl 444925520 SPACOFIUFIWLSW-UHFFFAOYSA-N 386.721 5.205 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3c[nH]c4ccccc34)no2)c2ccccc21 445451522 GUXVSLZDVFHCLG-KHPPLWFESA-N 379.423 5.257 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c(F)c1 445664739 MOZOQGJZMSIPGP-UHFFFAOYSA-N 384.769 5.534 30 20 GKED N#CCc1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc(C(F)(F)F)c2)c(Cl)c1 452644301 LJZDFAVWSMLAPW-CABCVRRESA-N 378.781 5.167 30 20 GKED C[C@@H]1C[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)c2ccccc2O1 454755166 HBOCMZCAHDXLGC-IIDMSEBBSA-N 381.501 5.115 30 20 GKED C=C(C)C[C@H](C)C(=O)N(CC)Cc1ccc(OCc2cccs2)c(OC)c1 464535954 ROGCMPKEKXPWFF-KRWDZBQOSA-N 387.545 5.287 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3C[C@H](c4ccccc4)[C@H]4CCCC[C@H]43)on2)c1 469335178 ORJHLGNWLKKRDB-MQSCRBSSSA-N 397.478 5.012 30 20 GKED CC(C)(C)C1CCC(C#N)(NC(=O)CCCc2ncc(-c3ccccc3)o2)CC1 470195437 TXIOGXFNHFRYRQ-UHFFFAOYSA-N 393.531 5.279 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(C1CC1)[C@H](C)c1cccc(C(F)(F)F)c1 473354061 IRPLHBVNJQLCRI-CQSZACIVSA-N 387.405 5.643 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1NCc1ccccc1Cl 482494714 SWLYMFUSTGTLEF-UHFFFAOYSA-N 389.886 5.096 30 20 GKED N#Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)s1 484435051 QTNHLHIPJWJCGQ-SFHVURJKSA-N 383.835 5.183 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N[C@@H](CCCC#N)c3ccccc3)ccc2c1 487300871 RHJCCRZVVFRZSS-UUOWRZLLSA-N 386.495 5.503 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2cccc(Cl)c2)on1)c1ccccc1 487543484 XDRMXRLETNDVHK-GOSISDBHSA-N 379.847 5.160 30 20 GKED CC[C@@H](c1ccc(F)cc1F)[S@@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488805634 MTOTWZSPAHBFIN-QMTYFTJSSA-N 398.343 5.662 30 20 GKED O=[S@@](Cc1ccc(C(F)F)cc1)Cc1cc(F)c(C(F)(F)F)cc1F 488829819 NRIJLDJJWZYNPZ-VWLOTQADSA-N 384.316 5.370 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1nc2ccccc2[nH]1 492072540 WYSVTKPGHKWATQ-INIZCTEOSA-N 389.361 5.123 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(Cl)c(C#N)c3)cc2)cs1 494997973 UXMMEXXZMMKITD-UHFFFAOYSA-N 399.928 5.521 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cc1cn(CCC#N)nc1-c1ccccc1 506113913 PRAJXGZVSSCGAT-UHFFFAOYSA-N 396.947 5.367 30 20 GKED C=CCCO[C@H](C)c1nc([C@H](Oc2ccc(Br)cc2)C(C)C)no1 508682045 VOJQORBOSGRDQR-CZUORRHYSA-N 395.297 5.262 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 512315396 SYJJLHJRVDWSIX-UHFFFAOYSA-N 396.943 5.145 30 20 GKED CCOc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)cc1 512539321 CCOLDSUNJRQYOG-UHFFFAOYSA-N 388.423 5.010 30 20 GKED C[C@@H](CN(C)C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccccc1 513299177 CWQHTZWUQAHNEH-IBGZPJMESA-N 384.479 5.013 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2cccnc2)c(C)c1 513369572 DHBVLFCTWFCLAT-UHFFFAOYSA-N 379.485 5.464 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)N(C)Cc1cccc(C#N)c1 515497962 FEDZLOPVEDIEKN-LBPRGKRZSA-N 379.312 5.004 30 20 GKED CCc1c(C)sc(NC(=O)c2ccccc2OCc2csc(C)n2)c1C#N 524330219 ACQRZJSFKZGYGV-UHFFFAOYSA-N 397.525 5.087 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@H](c2ccccn2)C2CCC2)c1 527774380 UAGDORRUGKHDDR-VWLOTQADSA-N 383.495 5.163 30 20 GKED C[C@@H](NCc1cc(Br)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 533909846 OJTXEIFRRWKVSR-LLVKDONJSA-N 383.211 5.190 30 20 GKED C[C@H]1c2cc(Cl)c(Cl)cc2CCN1Cc1nnc(-c2ccc(C#N)cc2)o1 536743405 BSJQXNDFDLSJJR-LBPRGKRZSA-N 399.281 5.034 30 20 GKED CC(C)(C)C[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 537114496 UKCNUHZHCBMSJE-IBGZPJMESA-N 394.906 5.529 30 20 GKED N#Cc1ccc(CNC2(c3noc(C4CCCCC4)n3)CCCCCC2)cc1 541696689 NGDFRIFQUXVWAQ-UHFFFAOYSA-N 378.520 5.328 30 20 GKED C[C@@H](NC(=O)c1c(F)c(F)cc(F)c1F)c1ccc(-c2cccc(C#N)c2)cc1 542000137 CTDAAHNZFFHWRS-GFCCVEGCSA-N 398.359 5.273 30 20 GKED CC(=O)c1ccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542933327 JTBVBOMBNNVZKV-MRXNPFEDSA-N 383.451 5.311 30 20 GKED C[C@H](NC(=O)CCc1nc2ccccc2o1)c1ccc(-c2cccc(C#N)c2)cc1 542990307 PYQAGZMAWCAKQW-KRWDZBQOSA-N 395.462 5.176 30 20 GKED N#Cc1cc(C(=O)N2CCC[C@H]2c2ccc(Br)s2)ccc1Cl 543346951 JDGDBNPNZSKTIO-ZDUSSCGKSA-N 395.709 5.013 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 559865631 SDVNOJIKYPMLPK-CPJSRVTESA-N 384.523 6.448 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c1 560712207 KAVQELHBFJVASV-QGZVFWFLSA-N 378.781 5.112 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 560935084 PDJKIVCFXSDINN-LBPRGKRZSA-N 382.316 5.051 30 20 GKED Fc1ccc(F)c([C@H](NCc2cc(F)c(C(F)(F)F)cc2F)C(F)F)c1 561885430 YMQMUPMOMRHTTD-AWEZNQCLSA-N 387.245 5.358 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1cc(-c2ccc(F)cc2)c(C)s1 577641148 WHIAFRMBXVLXBY-UHFFFAOYSA-N 399.487 5.166 30 20 GKED Cc1ccc(NC(=O)C(C)C)cc1NCc1ccc(C#N)cc1C(F)(F)F 580019950 ZIPQIXBXLBIZSW-UHFFFAOYSA-N 375.394 5.092 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1cscc1C#N 582919200 VVCJZZJEWOFOCG-JTQLQIEISA-N 387.917 5.196 30 20 GKED N#CCCCCCC(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 588981211 SSZCMCJHRKCFLZ-UHFFFAOYSA-N 378.259 5.593 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2)n1)c1nc2cc(F)ccc2s1 592973778 KPIAVQAATLGYDT-ZDUSSCGKSA-N 379.441 5.049 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(C(F)(F)F)CCCC1 599737272 LUTSFCZCRZWGNL-CYBMUJFWSA-N 385.455 5.183 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(F)c(C(=O)OC(C)(C)C)c1Cl 599921061 UPGGYAXRJLYRQW-LBPRGKRZSA-N 382.863 5.007 30 20 GKED C[C@H](C1CC1)N(C(=O)CCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 603964418 KTCJNHUHDXABRB-OAHLLOKOSA-N 386.417 5.341 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)C[C@H](c3ccccc3)C(F)(F)F)c2C#N)C1 609125466 ROSUXZBKADKZNZ-MLGOLLRUSA-N 392.446 5.419 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 609414164 PWYBRSUDIHMDCY-IBGZPJMESA-N 398.293 5.082 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl 610106901 KUEJXBVXOGQVTI-DLBZAZTESA-N 394.833 5.281 30 20 GKED C[C@H](NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610401764 KBLFCGGZGJMHPL-LBPRGKRZSA-N 376.287 5.161 30 20 GKED N#CCc1ccc(NC(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)cc1 610434047 QFAITPDDVNJZBV-UHFFFAOYSA-N 387.386 5.147 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)cc1 612313962 NKYMHJUGDKWMIA-VGSWGCGISA-N 379.529 5.697 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H](C)c1cccc(F)c1 615346383 DFPJIWLZNMREGK-CQSZACIVSA-N 387.455 5.175 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2Br)cc1 619439268 LASOLJRAIFLKHQ-LJQANCHMSA-N 397.316 5.228 30 20 GKED C=CCC[C@H](NCc1ncccc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 678938691 HMHCBFKGIKQDSM-INIZCTEOSA-N 388.355 5.916 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccccc2)c2cc3ccccc3o2)c1 726449772 KHGAEXXTKQUWBX-HSZRJFAPSA-N 382.488 5.490 30 20 GKED CCn1nc(C)c(/C=C\C(=O)c2ccc(OCc3ccc(F)cc3)cc2)c1C 727974917 OBNOWXVAYXSOCU-YPKPFQOOSA-N 378.447 5.134 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(-c2ccc(F)cc2)s1 728698051 BTWZAMMASCPRRO-VMPITWQZSA-N 380.366 5.209 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCCCN2CCCC2)cc1Cl 729320440 XOKJXBUWUJAPAO-NRFANRHFSA-N 395.934 5.200 30 20 GKED CC(C)COc1ccc(C(C)(C)CNC(=O)c2ccccc2SCC#N)cc1 730245717 DBGMYOIAJMVCHT-UHFFFAOYSA-N 396.556 5.045 30 20 GKED CCCCc1ccc(NC(=S)Nc2ccccc2SC[C@@H](C)C#N)cc1 730954743 JJLAZDNELQUMCJ-INIZCTEOSA-N 383.586 6.090 30 20 GKED CCCOc1nc2ccccc2cc1/C=C/C(=O)[C@@H](C#N)c1nc2ccccc2o1 731768037 YIHXXRKQSRGRIW-IENJSVCTSA-N 397.434 5.054 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2CCC(C)C)c1 733843906 DNILILHPSBKAHY-FQEVSTJZSA-N 379.504 5.278 30 20 GKED CC[C@H](NC(=S)Nc1ccccc1SC[C@@H](C)C#N)c1cccs1 734378419 AKWDVOICXXWHFX-KBPBESRZSA-N 375.588 5.438 30 20 GKED C=CC[C@@H](NC(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccncc1 735798281 CLQIPKLGIQSKPC-LJQANCHMSA-N 385.492 5.406 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 738897490 VFJZNWZSEGBGQJ-AOMKIAJQSA-N 389.524 5.465 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2c(Cl)nc3sccn23)cc1OC 741843373 FRUWWFYFTJANCS-FNORWQNLSA-N 390.892 5.133 30 20 GKED Cc1ccc(C)c(-n2ncc(C(=O)/C=C/c3cccc(OCCCC#N)c3)c2C)c1 741845392 ZUWNEXHONBORKQ-VAWYXSNFSA-N 399.494 5.376 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)N(Cc1ccco1)Cc1ccc(C)s1 743198239 BOGHMYKETAXWOA-UHFFFAOYSA-N 398.459 5.035 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cc1c(-c2ccccc2)nc2sccn12 745179707 UTRPGYNILGMXOP-UHFFFAOYSA-N 384.508 5.123 30 20 GKED CCCCOCCOCc1cccc(N=Cc2cc3ccccc3nc2O)c1 745625460 ANIGJOXYXJXXNC-UHFFFAOYSA-N 378.472 5.024 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1 745990779 XZVRJXIKNGBIGI-FLIBITNWSA-N 381.435 5.043 30 20 GKED Cc1ccc(-c2ccsc2C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)cc1 746481934 LCPATLJGDCGSNP-UHFFFAOYSA-N 397.843 5.409 30 20 GKED CC(=NNc1nc(-c2ccncc2)no1)c1ccc(-c2ccc(Cl)cc2)s1 750949699 YKTKDTGKIQNOJN-UHFFFAOYSA-N 395.875 5.350 30 20 GKED N#Cc1cccc(/C=C2/CC3(CCOCC3)C/C(=C/c3cccc(C#N)c3)C2=O)c1 751517871 OYAKDZUPBDIJOV-GACBQCINSA-N 394.474 5.057 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1nc(-c2ccccc2)cs1 754776752 IXLXMFOKTJOSAR-CQSZACIVSA-N 383.904 5.217 30 20 GKED C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cc(Br)cc(Cl)c1O 756770411 VQBCHYQMRRHUJB-SJKOYZFVSA-N 393.712 5.504 30 20 GKED N#CCCn1ncc(C(=O)Nc2ccc(-c3ccccc3)cc2)c1-c1ccccc1 757761723 YNRAKELGRKQZCJ-UHFFFAOYSA-N 392.462 5.383 30 20 GKED Cc1cccnc1/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 758951419 DTWKIEUKZBWNEO-DUQGCJEPSA-N 387.870 5.351 30 20 GKED CC(C)CN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(Cl)cc1 761823542 FDQZTCUSQPMZSH-UHFFFAOYSA-N 378.328 5.724 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cccc(OCc2ccccc2)c1 766227239 YLGHETDLBQRHGH-OAQYLSRUSA-N 399.538 5.466 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](Cc2nccn2C)c2ccccc2)cc1 766298548 CCVRSBGVFGNPIF-PGRDOPGGSA-N 395.934 5.186 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1csc(Cc2ccc(F)cc2)n1 768017603 JGRQVKWIPWMXFE-UHFFFAOYSA-N 394.471 5.031 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@@H](C)c3ccc(Br)cc3)[nH]c12 770542292 MOEXHAJVXNQSRV-CZUORRHYSA-N 396.288 5.004 30 20 GKED CC(C)(c1ccc(C(=O)OC[C@H](C#N)Cc2cccs2)cc1)C(F)(F)F 774170109 QGIJYNSBBQBBDK-ZDUSSCGKSA-N 381.419 5.127 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCCOc1ccc(C(C)(C)C)cc1 780151264 KLNWIFMORHWCOG-QGZVFWFLSA-N 380.488 5.073 30 20 GKED C=C(C)CNC(=S)Nc1ccc(Oc2nc(C(C)(C)C)ns2)c(Cl)c1 780232830 BNXHETGDKKLDCM-UHFFFAOYSA-N 396.969 5.144 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nccc2ccccc12)c1ccc(OC(F)(F)F)cc1 792103651 LNJRRHSTUIMTNT-SFHVURJKSA-N 398.384 5.287 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792105407 MGUGBHJVCNFWRT-OAGJVSPASA-N 382.341 5.023 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2cccc(C)c2)c2cccc(F)c2)c1 800973831 AHXHSMWFXHNCPO-ZCYQVOJMSA-N 388.486 5.694 30 20 GKED C[C@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccc(OCC#N)cc1 810243942 NMZWDNRZZLDJRQ-RBZFPXEDSA-N 375.299 5.698 30 20 GKED O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)Cc2c(O)cccc21 810250923 SVVRSTBZGAMLIF-FLIBITNWSA-N 381.771 5.036 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1 814305480 JKHSUTHSJPMPSS-INIZCTEOSA-N 382.250 5.296 30 20 GKED CSc1ccc(NC(=O)[C@@H](C)ON=Cc2cccc(Cl)c2Cl)cc1 852120702 XMFZNUMWANNEFC-LLVKDONJSA-N 383.300 5.093 30 20 GKED FC(F)(F)C(F)(c1ccc(-c2nc(-c3ccco3)no2)cc1)C(F)(F)F 904760591 MRNHPJUQVVEODX-UHFFFAOYSA-N 380.219 5.286 30 20 GKED N#Cc1cccc(-c2cc(-c3nc(-c4ccsc4C(F)(F)F)no3)on2)c1 904921594 AFRUERWLHLEERZ-UHFFFAOYSA-N 388.330 5.011 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3ccc(OCc4ccncc4)cc3)oc12 915041268 MPVWHMVZVIKQSF-YFHOEESVSA-N 385.419 5.312 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2OC(F)F)cc1 915087358 SRVRAFTUWVOIBC-LJQANCHMSA-N 378.378 5.196 30 20 GKED COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C=NNc2ccccc2)c1 916247336 QIOAGQMZVMVRID-UHFFFAOYSA-N 398.466 5.003 30 20 GKED Cn1c([C@@H](C#N)C(=O)CCCc2ccc(Cl)c(Cl)c2)nc2ccccc21 916844871 HTYCKBCLXJHTSY-AWEZNQCLSA-N 386.282 5.079 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917047321 WVHKXKXMYBSFKQ-CJNGLKHVSA-N 398.915 5.718 30 20 GKED N#Cc1ccc(CSCC(=O)OCc2csc(C3CCCCC3)n2)cc1 917263290 LYYIZGSZHCXYKV-UHFFFAOYSA-N 386.542 5.039 30 20 GKED C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Oc1ccc(C#N)cc1 920021006 ZBBMHWWUXDOUOC-ZDUSSCGKSA-N 398.871 5.094 30 20 GKED CC(=NNc1cc(Cl)cc(Cl)c1)c1oc2cc(C)ccc2c1CC(=O)O 1776058378 ALNUWRCMPWLIFA-UHFFFAOYSA-N 391.254 5.511 30 20 GKED O=C(O)c1cc(NN=C2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)ccc1F 1776062320 ODZIOWOEIWKUSH-OAHLLOKOSA-N 394.368 5.668 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776697800 PABHZCRKXKJJAF-GRNBYLDVSA-N 390.504 6.523 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(F)cccc1OCC(F)(F)F 1776784223 XFFPUPMKCCXTRG-CQSZACIVSA-N 393.421 5.060 30 20 GKED COc1cc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)ccc1SC(F)F 1777263430 QPQUDOOQUCUJLR-XQRVVYSFSA-N 392.423 5.221 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)c(Cl)c1 1777352367 VQCBSBNJNWSBPG-YIXHJXPBSA-N 392.838 5.610 30 20 GKED Cc1cccc(-c2nnc(SCc3cccc(C#N)c3)n2Cc2ccco2)c1 22046745 IRBCEDNHBJAHRZ-UHFFFAOYSA-N 386.480 5.059 30 20 GKED C=CCn1c(SCC(=O)c2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 25403755 OWYGNYKNWPPHIG-UHFFFAOYSA-N 383.904 5.068 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(C)s2)[n+]2ccc(C)cc2)cc1 27205008 RWSUIFIXUMOFHJ-UHFFFAOYSA-O 395.573 5.266 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCC2)c1nc2ccccc2n1C(F)F 41558501 AANOYOVRXNCCMI-ZDUSSCGKSA-N 385.439 5.252 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 56712906 RNOCJUGRYRBBOG-KRWDZBQOSA-N 396.450 5.413 30 20 GKED CSc1ccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 97392295 WRJSYBDDBARZNO-UHFFFAOYSA-N 375.453 5.028 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1F 108147817 IGRJKQKQJRKGDX-CABCVRRESA-N 388.533 5.510 30 20 GKED CCN(Cc1ccc(C(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc1)C(C)C 110123267 UVVBMWPIVIKVRL-IBGZPJMESA-N 377.532 5.012 30 20 GKED C=CC1CCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)CC1 110368512 GLQRRIKZVPMKTA-UHFFFAOYSA-N 379.287 5.006 30 20 GKED CC[C@@H](C#N)Oc1cc(CNCc2ccc(-c3ccc(C)cc3)o2)ccc1OC 113347694 KZFHWTYHBXPFAD-FQEVSTJZSA-N 390.483 5.234 30 20 GKED COc1cc(CSCc2c(C)noc2C)ccc1OCc1cccc(C#N)c1 116910422 GVYIPLHCNVZBHM-UHFFFAOYSA-N 394.496 5.184 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)n1 125031243 CTNQSMXJXDYCAT-HNAYVOBHSA-N 380.517 5.011 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)c(F)c1 152226938 SIJXIEDBVQRIRX-UHFFFAOYSA-N 398.796 5.321 30 20 GKED N#Cc1c(NC(=O)c2ccc(F)c(F)c2F)sc2c1-c1ccccc1CC2 153182116 RJKVVKHZQJVVFU-UHFFFAOYSA-N 384.382 5.055 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CSc2cccc(C#N)c2)cs1 177097283 GMKVWYNWWULWAL-UHFFFAOYSA-N 393.537 5.609 30 20 GKED CCN(C(=O)c1cccc(-c2ccccn2)c1C)c1ccc(C#N)c(Cl)c1 179527273 GRCXACBGXIBZRQ-UHFFFAOYSA-N 375.859 5.249 30 20 GKED C=CCC[C@H](NCc1csc(-c2cccc(OC)c2OC)n1)c1ccccc1 180037613 JWHOGOWYWPGXIY-FQEVSTJZSA-N 394.540 5.624 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1c(F)ccc(F)c1F 185026907 OHQGXGJLLNPZPB-UHFFFAOYSA-N 396.368 5.115 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccc(NC(C)=O)c1 185110167 IHAKNQZCYFTHCS-OALUTQOASA-N 378.516 5.337 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCC1([C@H](O)c2ccccc2)CC1 191448243 YCPVATQMVHFMMF-JOCHJYFZSA-N 378.516 5.174 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(OCC#N)cc2)cc(C)c1OCc1ccccn1 213022453 TVVGXFIGDVSTON-WDZFZDKYSA-N 398.462 5.076 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(/C(O)=N/[C@H]1CCC(O)=NC12CCC2)C1CC1 328701226 NGAYXLJZIULWMZ-IERDGZPVSA-N 391.515 5.321 30 20 GKED OC1=Nc2cc(N=C(O)[C@@]34CCC[C@@H]3CN(Cc3ccccc3)C4)ccc2CC1 329333102 NFOJTOUJFLDVFE-NTKDMRAZSA-N 389.499 5.111 30 20 GKED Cc1nc2c(c(C(F)(F)F)n1)C[C@@H](/C(O)=N/CC(C)(C)C1=CCCCC1)CC2 330010984 HMGLAIICALDEEY-AWEZNQCLSA-N 395.469 5.392 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(NC(=O)c2cccs2)c1 410356484 WDTQHSHRYKXJCZ-UHFFFAOYSA-N 376.481 5.371 30 20 GKED C[C@H](CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)CC(F)(F)F 412660762 RSMTVJMGGVNFSF-AWEZNQCLSA-N 392.446 5.169 30 20 GKED N#CC1(CNC(=O)c2oc3ccccc3c2CSc2cccs2)CCC1 416360627 UPCZRAAPGUZXRB-UHFFFAOYSA-N 382.510 5.210 30 20 GKED Cc1ccnc2[nH]c([C@@H](C#N)C(=O)c3csc(-c4ccc(Cl)cc4)c3)nc12 429669702 VHVVEUJCBCLURF-HNNXBMFYSA-N 392.871 5.138 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H](c1ccccc1)C1CC1 433135117 MTOUKDZCDMPNAB-LPHOPBHVSA-N 379.529 5.254 30 20 GKED CSc1ccc(CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 436342736 VHTNPGHENDHEIV-HNNXBMFYSA-N 385.558 5.167 30 20 GKED C=CCn1c(SCc2oc(C(C)C)nc2C)nnc1-c1ccc(Cl)cc1 436473809 IKOYOIKFMFTMLT-UHFFFAOYSA-N 388.924 5.497 30 20 GKED CCS[C@H]1CC[C@@H](N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1 437108949 PMMXMFMFVZMABG-RTWAWAEBSA-N 379.529 5.048 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1Cc2ccccc2C[C@H]1C 437823237 QXKJHXWAUNDACU-GOSISDBHSA-N 397.478 5.638 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Cl)cc2-c2nc(C3CCCC3)no2)s1 439665328 WQPWTVZHRLPTPY-UHFFFAOYSA-N 398.875 5.233 30 20 GKED FC(F)(F)CCCCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444738753 DGNYBVQAVVLGQS-GFCCVEGCSA-N 381.282 6.021 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F)c1ccccc1 458531747 ZOOSFAQNJMMIBI-SQNIBIBYSA-N 381.442 5.089 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cscc1-c1ccccc1 463948884 JXQXPYMJEMDIHG-HNNXBMFYSA-N 378.522 5.919 30 20 GKED C[C@@H]1CCc2c(F)cccc2[C@@H]1Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468879266 GLANEUQPDLBPPR-VOIUYBSRSA-N 391.490 5.144 30 20 GKED N#CCCCn1cc(C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)c2ccccc21 469534249 YBMQGPCJJWRYEG-CVEARBPZSA-N 391.437 5.044 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cc(-c2ccccc2)ccc1Cl 471405265 GGESIOJCSPHTDC-UHFFFAOYSA-N 379.847 5.548 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)cc1 474415951 YCCBYTXWCRIHCJ-UHFFFAOYSA-N 381.435 5.548 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)CSCc1ccc(C#N)cc1 474777608 XGPCLIBDGIOFOK-UHFFFAOYSA-N 382.529 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1 475550039 MZCWUPXMVOUUBQ-QFIPXVFZSA-N 391.559 5.277 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 476074238 XUPUMDRVAPUJQB-HXUWFJFHSA-N 394.540 5.125 30 20 GKED Cc1cc(Cl)cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 477342412 ODWQXGPCUWXFJS-UHFFFAOYSA-N 377.831 5.268 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1)c1ccccc1 477612270 ULJSJGBJDFPXTC-CYBMUJFWSA-N 398.331 5.333 30 20 GKED CCn1c(COc2ccc(C)cc2)nnc1SCc1ccc(Cl)cc1C#N 479115638 LYJHYZGPRJQQGG-UHFFFAOYSA-N 398.919 5.003 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Nc1ccc(F)c(C#N)c1 481656727 KPAQMWNZUFKHHS-CYBMUJFWSA-N 380.448 5.012 30 20 GKED Cc1nn(CC(F)(F)F)c(C)c1[C@@H](C)N[C@H]1CCCCc2cc(C#N)ccc21 482010348 XEFHBLYRFNGDBN-YJYMSZOUSA-N 390.453 5.052 30 20 GKED N#C[C@H](C(=O)c1cc2sc3ccccc3c2s1)c1cnc2ccccc2n1 483228594 NDXRGOIMSCFNLM-ZDUSSCGKSA-N 385.473 5.549 30 20 GKED N#Cc1cccc(CNc2ccc(Oc3ccc(C(F)(F)F)cn3)c(F)c2)c1 487380719 RPMQDVFTCYWGJG-UHFFFAOYSA-N 387.336 5.516 30 20 GKED Cc1cc(CN[C@H](c2c(C)nn(-c3ccccc3)c2C)C(F)(F)F)ccc1C#N 488166777 VJSHXXBCJNAFIX-OAQYLSRUSA-N 398.432 5.062 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1NCc1nc2cc(Cl)ccc2s1 488179235 PFGGCOOUIBDTNJ-UHFFFAOYSA-N 386.814 5.260 30 20 GKED CC(C)CN(C(=O)c1csc(-c2ccccc2F)n1)c1ccc(C#N)cc1 499302812 VOYKLOPFJSXTLM-UHFFFAOYSA-N 379.460 5.124 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCOc1ccccc1F 500742984 KDRXKUIQGOOQDR-UHFFFAOYSA-N 390.414 5.206 30 20 GKED N#Cc1ccsc1NC(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1 509563717 KGIYAKBABKTPLB-LJQANCHMSA-N 398.940 5.734 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 509651716 JDNHVISPNPQBOS-JTQLQIEISA-N 384.810 5.350 30 20 GKED C[C@@H]1CCCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 512719322 BKMHULDBTRSHDR-GOSISDBHSA-N 377.488 5.128 30 20 GKED CCN(C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 512796744 JBQKIQXAYNWIHS-JKSUJKDBSA-N 388.433 5.680 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1c(F)cccc1F 517533616 YGUZVBORUIHPDL-ZIAGYGMSSA-N 389.471 5.584 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)c1ccc(C(C)(C)C)cc1 518113141 MIEJEZLSTCMDFM-OAHLLOKOSA-N 388.558 5.037 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1cccc(F)c1 518169155 HRJIGQDQNJVNFK-UHFFFAOYSA-N 375.403 5.154 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)C[C@H](c2ccccc2)C(F)(F)F)cc1 519485118 FZJOHUFVZRMEPU-MOPGFXCFSA-N 388.433 5.401 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccc(F)cc1 519799850 ILWSMWPUCFYCCS-MSOLQXFVSA-N 377.246 5.183 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc4oc(C5CC5)nc4c3)cc2)nc1 521110541 MSBWDCVIHJZAGU-UHFFFAOYSA-N 396.406 5.016 30 20 GKED Cc1cccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1Cl 534359664 SQJHWEZRVJCPAL-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1nc2ccccc2s1 534925321 GHDARXQYJCDHIS-OAHLLOKOSA-N 394.402 5.541 30 20 GKED C=CCC[C@H](NCc1nc(C)c2ccccc2n1)c1ccc(C(F)(F)F)cc1 537131868 FECYMZLWNQNUNO-IBGZPJMESA-N 385.433 5.754 30 20 GKED COc1cc(C#N)ccc1NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 546708365 CSGWIPYIYSOJGP-INIZCTEOSA-N 391.496 5.424 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1c(F)c(F)cc(F)c1F 554990207 JWKVKZRQUWQWJZ-MRXNPFEDSA-N 391.286 5.143 30 20 GKED CC[C@H](Nc1ccc2c(c1)N(C(=O)Cc1ccccc1)CC2)c1ccc(C#N)cc1 556239908 GOWCSPRZOJNSNU-DEOSSOPVSA-N 395.506 5.253 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccccc1 562413283 IHJCBXLVLDDOLO-LAUBAEHRSA-N 391.540 5.697 30 20 GKED N#CCCC1CCN(C(=O)Nc2cccc(Cl)c2SCC(F)F)CC1 566677110 LFIHSYHTMGOBND-UHFFFAOYSA-N 387.883 5.245 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 578582166 YUWVDKLQRPZKKA-HQRMLTQVSA-N 395.528 5.123 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(OCC2CCCCC2)CC1)c1ccccc1 579443916 NOZLQSSOSKAEAI-HSZRJFAPSA-N 397.563 5.192 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NC3(c4cccc(C#N)c4)CC3)s2)cc1 583445753 ZRDSOSIUDXTIEJ-INIZCTEOSA-N 389.524 5.339 30 20 GKED COc1cccc(OC)c1Oc1ccc(CNc2cc(Cl)ccc2C#N)cn1 583465810 BJUYEPJZTYKFGY-UHFFFAOYSA-N 395.846 5.028 30 20 GKED CC(C)[C@@H](Oc1ccc(Br)cc1)c1noc(CCCCCC#N)n1 589152292 CDKFJYDJTQQRKG-QGZVFWFLSA-N 392.297 5.235 30 20 GKED C=CCN(C(=O)c1csc(-c2ccccc2C)n1)c1nc2c(s1)CCCC2 589289964 VKZIZTJTRBQNGL-UHFFFAOYSA-N 395.553 5.287 30 20 GKED C[C@]1(Cc2ccccc2C(F)(F)F)CCCN1CCCC1(C#N)CCOCC1 595866821 LZXLDOXVUJEZGO-HXUWFJFHSA-N 394.481 5.203 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1cccc(C#N)c1 596734045 WOQYPGYBGBSCDZ-HNNXBMFYSA-N 378.501 5.009 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(-c3cccc(OC(F)(F)F)c3)s2)C1 597906891 SPSYWIHJYIKSGV-CYBMUJFWSA-N 394.418 5.080 30 20 GKED CC(C)[C@@H](Sc1cc(C#N)ccn1)C(=O)Nc1cc(Cl)ccc1Cl 603724915 OOSCLAKMXLWNDO-MRXNPFEDSA-N 380.300 5.015 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 608820268 BHBCBASJPLLVDH-SFHVURJKSA-N 395.453 5.100 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC#N)C(c1ccccc1)c1ccccc1 609215991 WBICRJYLAOWDGP-UHFFFAOYSA-N 393.490 5.417 30 20 GKED Cc1cc(C)c(C)c(OCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609427617 RZRPFQDQKSWGSI-KRWDZBQOSA-N 382.529 5.414 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 609501851 GHTGPMUKUSSRDS-IAGOWNOFSA-N 388.389 5.106 30 20 GKED CCn1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c2ccccc21 613314251 GJYAJDVVHLDCQW-SFHVURJKSA-N 385.492 5.583 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CC[C@](F)(C#N)C2)c(C(F)(F)F)c1 615528829 KBKKHQBAXMURRW-ZBEGNZNMSA-N 389.418 5.065 30 20 GKED O=C(Nc1ccc(Cl)c(F)c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618543365 OYSWJKWVFCMTBF-HTQZYQBOSA-N 392.702 5.074 30 20 GKED C[C@H](CC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C(F)(F)F 630009233 LCEWIHBSFFEGJC-SSDOTTSWSA-N 399.228 5.503 30 20 GKED C=C(C)Cn1c(CSc2ccc(C)cc2)nnc1N1CC[C@@H](c2ccco2)C1 670200525 SNBZEQNJNRBDAW-GOSISDBHSA-N 394.544 5.042 30 20 GKED Fc1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1C(F)(F)F 678207852 GBCBVTNIBWUDEO-NXEZZACHSA-N 397.256 5.407 30 20 GKED C=CCc1cc(OC)cc(CN2CCC[C@H]2c2nc3ccccc3s2)c1O 732456197 SZAUZBCMXHFSLG-IBGZPJMESA-N 380.513 5.076 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 732496392 UCYAIXRQYOOZPF-ZBFHGGJFSA-N 386.929 5.697 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(C)C)c1ccncc1 734666883 NMUMGEMSISNMGZ-RBUKOAKNSA-N 391.437 5.414 30 20 GKED COCCCOc1cccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)c1 734980220 IQVXXXUCQWIKGD-IZZDOVSWSA-N 378.440 5.313 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1cc(Cl)ccc1OCC#N 735318988 UHIVPAZPPIWBHA-UHFFFAOYSA-N 393.295 5.232 30 20 GKED COc1ccccc1Nc1nc(Cl)c(C=NNc2ccc(Cl)nc2)s1 743451573 INXNQIQSYOPZJM-UHFFFAOYSA-N 394.287 5.043 30 20 GKED COc1cc(/C=C2/CCSc3ccc(Cl)cc3C2=O)cc(OC)c1OC 748440486 DCGMOCISWHQXQH-JYRVWZFOSA-N 390.888 5.128 30 20 GKED C#CC[C@H](OC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccccn1 750695771 BRAWZAFSNMOLSE-KUHUBIRLSA-N 396.899 5.072 30 20 GKED C=CCOCCCC(=O)O[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753375549 UHIOJXRVMOUFHP-LBPRGKRZSA-N 384.259 5.235 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C 754434933 WDLNKVILQOWUOE-UHFFFAOYSA-N 382.460 5.159 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cccc(NCC(C)(C)C)c2C)c1 757382643 QTVQZYDGDDKGHD-IBGZPJMESA-N 393.531 5.064 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@H]1/C=C\c1ccccc1 761674452 TUENAMKXVZFSGF-ZZLBYYGFSA-N 393.462 5.218 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)c2ccccc2SCC#N)c1 763764333 VQMPWPAEDMYVJR-UHFFFAOYSA-N 390.512 5.218 30 20 GKED N#CCOc1cccc(/C=C(\Cl)c2nc3cc(C(F)(F)F)ccc3o2)c1 764432371 MDZAYAZPWYTKPL-ZROIWOOFSA-N 378.737 5.486 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)O[C@H](C)c1nc2ccccc2n1C(F)F 767738069 DMZSSEZKODXYFY-CJNGLKHVSA-N 381.423 5.007 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 768159673 GMCZZANRQFXDGJ-IBGZPJMESA-N 391.446 5.081 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2ccc(OC)c(Cl)c2)cc1 782230311 LTUQWBWSMVVBQH-UHFFFAOYSA-N 388.899 5.058 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(Cl)cc1F 783512169 UWMSXZIUBCTQOV-UHFFFAOYSA-N 397.862 5.108 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc(F)c(Cl)c2)c(-c2ccccc2)n1 788347521 BKKXKYNLWJTATR-NTMALXAHSA-N 379.822 5.152 30 20 GKED CC1CCC(OCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 796635961 VYRTUYPBQXKDSZ-IMRCBTMISA-N 388.920 5.235 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Cl)c(SC(=O)N(C)C)c1)c1ccccc1 805431829 KVCVQPYPUDGYNE-AWEZNQCLSA-N 388.920 5.412 30 20 GKED CC[C@H](CC#N)OC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 810710869 SKKUGZRFRBHSME-LLVKDONJSA-N 380.872 5.116 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1 915087760 XHLZZRUCWVNCOG-IBGZPJMESA-N 395.289 5.830 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3cccc(OC(F)F)c3)cs2)c1 916129029 QLEKGNUUBCYEOQ-CMDGGOBGSA-N 387.407 5.316 30 20 GKED Cc1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)oc2c(C)cccc12 919713834 IGVSMNLPICALID-QFIPXVFZSA-N 380.447 5.957 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1 920082223 VVPUMLBSWIQUGR-RUZDIDTESA-N 395.506 5.190 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cnn1-c1ccccc1 1776113293 FCSRREJPUYGDQV-ACCUITESSA-N 398.418 5.035 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H](CC(=O)O)c2ccc(-c3ccccc3)cc2)cc1 1776230582 NQJXISUZTPKNDM-DEOSSOPVSA-N 398.506 5.460 30 20 GKED CC(/C=C/C(=O)c1cccc(OCC(=O)O)c1)=C\c1ccccc1C(F)(F)F 1776398868 MKHKZNWIIXAOTR-QDCWQMMGSA-N 390.357 5.011 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2ccccc21 1776526590 UDDLKWZDRYLCPZ-LGMDPLHJSA-N 388.488 6.061 30 20 GKED CCc1c(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)oc2ccccc12 1776956328 YFVHOQUMMHRXOO-CLFYSBASSA-N 394.423 5.943 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Br)cs3)c2c1 1777685660 SNQAXNGNOYUYHW-IWQZZHSRSA-N 393.283 5.320 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)/C=C/C3CCCC3)cc2)CCC1 1790514641 UCLDCOBVDJJRPR-SFQUDFHCSA-N 392.543 5.061 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 47052229 WTDDSRRFYGNTEU-STQMWFEESA-N 376.287 5.329 30 20 GKED CC(C)c1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cnn1-c1ccccc1 48858393 OCMPYXADKXVTGM-LJQANCHMSA-N 380.451 5.034 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 65680288 VCHSREKPOMSYAV-UHFFFAOYSA-N 393.786 5.164 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2nnc(-c3cccs3)o2)n1 79317002 QLJDOGKSVODSOQ-VIFPVBQESA-N 396.419 5.245 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 108199410 TZZVUTIEUYJLSN-HUUCEWRRSA-N 390.430 5.453 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1CNc1ccc(C#N)c(C(F)(F)F)c1 111105657 JJHXZJBMCWZVCQ-UHFFFAOYSA-N 384.405 5.051 30 20 GKED CCOc1ccccc1C(F)(F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 131826706 WESRDDSTKQJJTP-AWEZNQCLSA-N 390.455 5.068 30 20 GKED N#Cc1ccc(-c2nnc(CSc3ccc(Cl)c(C(F)(F)F)c3)o2)cc1 133078955 DZACRLYCIURQOW-UHFFFAOYSA-N 395.793 5.573 30 20 GKED C=CCCCN(C)Cc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 165977257 RMRKNHFWPOBWHC-UHFFFAOYSA-N 397.466 5.245 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccncc2Cl)cc1Cl 174227688 PPOSRTZVALTDMN-QGZVFWFLSA-N 382.250 5.296 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 177330739 DDWZZPHBVSHZPN-UHFFFAOYSA-N 397.544 5.487 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C)c(-c2nc(C)co2)c1 178390292 JYIRKNNXRAHUJC-UHFFFAOYSA-N 379.435 5.318 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1)c1ccccc1 188820988 AGPPSGXOXJBEPP-IRXDYDNUSA-N 385.891 5.054 30 20 GKED Cc1ccccc1-c1nnc(Sc2cc(C)c(C#N)c3nc4ccccc4n23)o1 301070402 KYGITWKKZIHXSX-UHFFFAOYSA-N 397.463 5.177 30 20 GKED Cc1ccc2[nH]cc(CC/C(O)=N/[C@H]3CCCc4cn(C5CCCC5)nc43)c2c1 329479424 CPTFMTFRPUCZLH-QFIPXVFZSA-N 390.531 5.755 30 20 GKED N#CC1(CCCN[C@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 375621709 WIZVJRXQBVEAMV-OALUTQOASA-N 380.454 5.032 30 20 GKED C=CCCc1ccccc1NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1 410374900 ONCSOAUOUXLYBK-UHFFFAOYSA-N 381.863 5.080 30 20 GKED CC[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)c1ccccc1OC(F)F 425427365 SMTJJGVVYDCZPQ-KSSFIOAISA-N 387.430 5.013 30 20 GKED C[C@H](C1CC1)n1cc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cn1 429420977 DPTIKFVBQKAZSA-OAHLLOKOSA-N 387.443 5.162 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1C 429905630 VKJUSFMPHTYORC-UHFFFAOYSA-N 391.496 5.381 30 20 GKED Cc1noc(C)c1-c1ccc(OCc2cc(C#N)ccc2Br)cc1 432293266 FTTVSFRGOMXLSB-UHFFFAOYSA-N 383.245 5.172 30 20 GKED Cc1oc(C#N)cc1C(=O)N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 436153079 JISKMOSVXWNXNJ-MRXNPFEDSA-N 382.769 5.013 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(c2ccc(Cl)cc2)C1 454762263 XVSDVGIWXPNFCY-CQSZACIVSA-N 385.920 5.223 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 464471344 YGCLXODHPJPPQB-IBGZPJMESA-N 396.368 5.169 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)Cc1nnc(-c2ccc(C#N)cc2)o1 464764736 XQJKOEXFVCVBIC-GOSISDBHSA-N 394.478 5.468 30 20 GKED Cc1nc(-c2cccc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)c2)cs1 464944926 ZAZVPWJOKYCOHU-RBBKRZOGSA-N 387.508 5.031 30 20 GKED CN(CC[C@H]1CCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 466372827 CMQFMKJEGWKORC-QUCCMNQESA-N 397.906 5.028 30 20 GKED C=CCCN(C)Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 467290515 ITESWFIPARDOAG-UHFFFAOYSA-N 384.332 5.142 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccc(CCCc4ccccc4)cc3)o2)c1 471685061 NJTIEYBHJXEIFC-UHFFFAOYSA-N 394.478 5.396 30 20 GKED COc1ccc(Br)cc1CNc1ccccc1SC[C@@H](C)C#N 474435814 UBUBLAIJNLDSQO-ZDUSSCGKSA-N 391.334 5.322 30 20 GKED CN(Cc1ccccc1NC(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCCC1 474571951 CJYLVNOVAULKCK-UHFFFAOYSA-N 389.543 5.505 30 20 GKED Cc1ccc(-c2ccc(C)c(NCC(=O)Nc3ccccc3SCC#N)c2)o1 480147663 VVGYGOYDQNCRMC-UHFFFAOYSA-N 391.496 5.230 30 20 GKED C[C@@H](NC(=O)Nc1ccnn1[C@H](C)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 482461515 SVCVKNDNCIVXTL-IAGOWNOFSA-N 399.498 5.275 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@H](C#N)c2nccc3ccccc23)c1 483200685 OGUZSPQUWZBUNT-HSZRJFAPSA-N 392.458 5.791 30 20 GKED C=C(C)[C@H](NC(=O)N(CCC)[C@H]1CCCc2cccnc21)c1ccc(F)c(F)c1 483311213 SGBXDBXKBCNLSY-SFTDATJTSA-N 399.485 5.476 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(F)c2ccccc12 483317032 WRCXOHNDTMBSFE-UHFFFAOYSA-N 397.409 5.599 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1oc2ccccc2c1C 484763454 ODSMRRRGRKVEFU-GOSISDBHSA-N 394.519 5.368 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)C1 485779441 BMSDWLBIPZODEY-UHFFFAOYSA-N 392.499 5.060 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccccc1 487564172 IRQOUONLBSBACL-OAQYLSRUSA-N 392.430 5.163 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)NC12CCC(C(F)(F)F)(CC1)CC2 488268050 RPITWTOPQIAOCN-UHFFFAOYSA-N 398.322 5.621 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccn(C)c3C3CCC3)n2)cc1 496028004 JXRZQJYKEMCJTI-GOSISDBHSA-N 375.497 5.215 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 503723514 QSTHTGXKCCLLLY-QFIPXVFZSA-N 376.525 5.544 30 20 GKED CCC[C@@H]1C[C@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 504077473 SFHZUYDBSYYTCT-QFUCXCTJSA-N 396.918 5.529 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)N(CC(C)C)[C@@H](C)c1ccccc1Cl 504129276 SXMPOCPSNZDDKV-ZWOKBUDYSA-N 378.944 5.050 30 20 GKED CCOc1ccc([C@@H](NC(=O)N[C@H](C)c2ccc(C#N)cc2)c2ccccc2)cc1 505319354 QNJVAJRQLGVVMS-KOSHJBKYSA-N 399.494 5.107 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2)nc2ccccc12)c1nc2ccccc2o1 505459147 XKHPWDYAUATRLP-IBGZPJMESA-N 389.414 5.533 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(Oc2ccccn2)cc1 506839829 DTAMSNCLEQCVRU-UHFFFAOYSA-N 389.455 5.103 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)Nc2cc(C#N)cn2C(C)(C)C)C2CC2)o1 508053284 JRJAXJFKBDMRIK-RDTXWAMCSA-N 380.492 5.028 30 20 GKED CC[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)C1 508243831 SSBDGTFFNKVUKJ-INIZCTEOSA-N 379.460 5.013 30 20 GKED N#CCSc1cccc(-c2nc(-c3ccc(F)cc3C(F)(F)F)no2)c1 508247784 JJJIGYDQGCJFHG-UHFFFAOYSA-N 379.338 5.177 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(Cl)s1 512545812 XHCIIQSSVFMRKH-OLZOCXBDSA-N 393.965 5.926 30 20 GKED CCCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 515540065 GSOIPUKJBAQEGZ-QGZVFWFLSA-N 397.425 5.490 30 20 GKED C=C1CCN(C(=O)CCc2cn(Cc3ccc(Cl)cc3)c3ccccc23)CC1 520821858 YJIUHVDTMJQZQX-UHFFFAOYSA-N 392.930 5.454 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)n1 531732839 RRUKFGAFQYNJAW-QHCPKHFHSA-N 397.478 5.340 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)N[C@@H](CCC#N)c3ccccc3)c(C)c2c1 533051207 BQVZKBJKBMKZMQ-NRFANRHFSA-N 388.467 5.038 30 20 GKED C=C[C@@H](CC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccccc1 534662121 GTJHUWDLTYQTSV-NRFANRHFSA-N 382.507 5.600 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C#N)s1 536972191 DJTGOXSSAUOYBQ-UHFFFAOYSA-N 385.470 5.292 30 20 GKED C[C@@H](NCc1ccc(F)c(C#N)c1)c1ccc(OCc2ccc(F)cc2)cc1 540404786 XKOJCJFVDKZWLF-MRXNPFEDSA-N 378.422 5.266 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl 540470750 GPSMELWQDGCAAN-SJLPKXTDSA-N 392.808 5.271 30 20 GKED CC[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1c(C)noc1C 541071983 DZGMLRMVJZVXHE-QRQCRPRQSA-N 387.483 5.201 30 20 GKED Cc1oc(-c2cccs2)nc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543869981 LMCFWNFVTSVUIM-INIZCTEOSA-N 399.519 6.101 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(-n2cncn2)cc1 543961434 JQSOYNFHVHMQRZ-MOPGFXCFSA-N 393.494 5.218 30 20 GKED N#C[C@@H](C(=O)c1coc(-c2ccccc2Cl)n1)c1nc2ccccc2s1 553663898 JYSPOFIAULTAHB-LBPRGKRZSA-N 379.828 5.095 30 20 GKED Cc1sc(CN[C@@H]2CCc3ccc(C#N)cc32)nc1-c1ccc(Cl)cc1 572050642 NBHLDBFRPWVKHH-LJQANCHMSA-N 379.916 5.421 30 20 GKED N#Cc1ccc(C(=O)N(CC2CC2)c2cccc(C(F)(F)F)c2)cc1Cl 574009766 SEFDRYKNLNFFRM-UHFFFAOYSA-N 378.781 5.287 30 20 GKED CCN(CCC(C#N)(c1ccccc1)c1ccccc1)[C@H]1CCOC(C)(C)C1 574441470 OYDSAFNOAYYSSD-QHCPKHFHSA-N 376.544 5.166 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCCC[C@H]2c2nnc(C3CCC3)o2)cc1 574978500 XQXIPNWDZPWMBT-QHCPKHFHSA-N 398.510 5.603 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1 582962091 CEQUKNKZHMJVFW-UHFFFAOYSA-N 390.512 5.511 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)N1CCC(CCC#N)CC1)c1ccccc1 583562966 VGPIIJQCEJPAHX-GOSISDBHSA-N 377.488 5.374 30 20 GKED C[C@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(O[C@H](C)c2ccccc2)cc1 595750946 DKHGVVQEWOMAHR-RBUKOAKNSA-N 391.515 5.223 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@@H](CC#N)C1 596723664 LTNWGPMPYDAOPN-OALUTQOASA-N 377.488 5.293 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1-c1nc2ccccc2s1 603648876 TZVYTMXUFPWZHD-UHFFFAOYSA-N 398.491 5.499 30 20 GKED C[C@H](c1ccccc1)n1cnnc1SCc1ccc(-c2ccccc2C#N)cc1 603917778 AAYBVVZHRXQXSS-GOSISDBHSA-N 396.519 5.718 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cn2)c1 604100731 NONCQAIQRMXKDQ-UHFFFAOYSA-N 388.814 5.133 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)cc2)c1 609427195 UDBNIXUMYYOFSZ-HOTGVXAUSA-N 388.389 5.658 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(OC3CCCCC3)cc2)c1 609785225 ROJIYINIWMBDPA-UHFFFAOYSA-N 386.398 5.123 30 20 GKED COc1ccc([C@H](C)CCNC(=O)c2ccccc2-c2ccccc2C#N)cc1 610185707 OWKDGZWMBNORFJ-GOSISDBHSA-N 384.479 5.157 30 20 GKED C[C@@H](NC(=O)Nc1ncc(Cc2ccccc2Cl)s1)c1cccc(C#N)c1 610317920 FAZIJQLMPGAXIW-CYBMUJFWSA-N 396.903 5.142 30 20 GKED Cc1cccc(COc2ccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)c(C)c2)c1 610324060 LABMEWWWNSUBSQ-LJQANCHMSA-N 399.494 5.637 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 613407280 OMYBCVOCWNLEAR-MRXNPFEDSA-N 392.867 5.602 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(Cc3cccc4ccccc34)no2)cc1 615131477 OGWXGVJOLYGQQQ-JOCHJYFZSA-N 380.451 5.027 30 20 GKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1OC(F)F 618804454 ADDMXCUYKYYGRS-LHSJRXKWSA-N 378.422 5.651 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cc(F)ccc1F 622484973 AKWWCDBZZUPJDR-CYBMUJFWSA-N 383.238 5.017 30 20 GKED C=C(C)CN1C(=O)/C(=C\c2ccc(Cl)c(C(F)(F)F)c2)SC1=S 727490717 WZHUEXDUSARDMW-WUXMJOGZSA-N 377.840 5.136 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1Cl 727627482 GQORCZOJEJTHRE-WKOYGUFESA-N 378.884 5.743 30 20 GKED Cc1nc(NC(=O)/C=C\c2cccc(OC3CCCC3)c2)sc1SCC#N 727662879 BIZRGFWCNOWQHX-KTKRTIGZSA-N 399.541 5.041 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)cc1 728697887 YWJHPZRFIIDUGF-YDRQLGOLSA-N 385.435 5.505 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc4c(c3)CCC4)cc2)c1 731317283 BNZKLQGBBLYNQU-UHFFFAOYSA-N 385.492 5.648 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cc2)c1 731317519 HKHLXXBAGDTVRC-UHFFFAOYSA-N 390.424 5.068 30 20 GKED C=CC1CCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)CC1 732421544 PMZODPBXPGSRQV-AWEZNQCLSA-N 385.360 5.402 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(C)[C@H](c2ccccc2)C(C)C)c1=S 732980178 UUAYJMMVKYRNBU-IBGZPJMESA-N 382.533 5.147 30 20 GKED C#CCCOc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1 733325203 DHNANNFXBCQGJJ-QFIPXVFZSA-N 381.928 5.683 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC3(CCCC3)C2)cc1 742877243 ZPRXFCMHQHPXEJ-UHFFFAOYSA-N 376.525 5.257 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cc(Cl)ccc2Cl)cc1 748174173 BQQTXZCAFBPCME-HXUWFJFHSA-N 395.289 5.830 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(N2CCCCCC2)cc1)c1ccccc1 749221739 OZMRNHOKZVGNJG-JOCHJYFZSA-N 376.504 5.234 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 750692924 IWUWWWJNBSTLKX-RZXPCSSPSA-N 398.409 5.507 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 756232780 XOWXHWIMRZQAJH-WBMJQRKESA-N 389.282 5.468 30 20 GKED COC1CCC(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 758437782 YVMFSZNOGKCWBO-VFIGECHUSA-N 396.918 5.529 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@@H](C)c2ccc(F)cc2F)c1C(F)F 768150773 PDPZKYPZDHASIK-ZETCQYMHSA-N 398.278 5.056 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(Cl)c2SCC(F)F)cc1 770585146 IAYGVEIXPSPBFW-LBPRGKRZSA-N 382.863 5.600 30 20 GKED CC(C)c1ncc(/C=C/C(=O)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)s1 771095377 ALPSSIHDROSXPC-WAVCKPEOSA-N 389.492 5.250 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc3c(c2)CCCC3)ccc1OC 772979766 MECMJBBKKVUNSZ-VGSWGCGISA-N 378.516 5.106 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12 780151885 BWZQLSVXESZVKX-QGZVFWFLSA-N 393.446 5.445 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCO1 781763516 JNDNBGVFCBAMNW-IAOVAPTHSA-N 388.920 5.235 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C(F)(F)F 787398830 CLPDKBUTAMJFOK-ROUUACIJSA-N 375.394 5.050 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1ccc(Oc2ccccc2)cn1 799296979 KRISXJMVDYHOAR-UHFFFAOYSA-N 394.814 5.017 30 20 GKED N#CC1(CCCOC(=O)/C=C\c2ccc(-c3ccc(F)cc3)s2)CCOCC1 800106261 DKZHAYBGVHWNSL-CLFYSBASSA-N 399.487 5.211 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccc(Cl)s2)cc1 916950154 RKUOLVGQJLBYCT-SUMWQHHRSA-N 388.920 5.195 30 20 GKED Cc1c(NN=Cc2ccc(Oc3cccc(Cl)c3)cc2)cccc1C(=O)O 1776089218 HYTDGJHIGOCFKX-UHFFFAOYSA-N 380.831 5.585 30 20 GKED CC(C)CCOc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776327006 OXWJRZLRYCHWTR-RGEXLXHISA-N 378.468 5.412 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776697892 XEMURNQOAWJMAO-KVNDZABWSA-N 390.504 6.523 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)ccc1OCC1CC1 1776782777 AGYHQXQRFXAKFN-IBGZPJMESA-N 381.944 5.422 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2ncc(/C=C\C(=O)O)s2)cc1 1776785559 LKTANOOLRHOBQZ-GWYZPJRWSA-N 385.529 6.151 30 20 GKED CCCCCCCOc1ccc(/C=C2/C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 1776785954 ZOJFUFMATFYOCY-SSZMPNMXSA-N 392.495 5.874 30 20 GKED CCCCCCCOc1cccc(CNC2(C(=O)O)CCC(C(F)F)CC2)c1 1776787190 ABQZWHDJCAOIQO-UHFFFAOYSA-N 397.506 5.404 30 20 GKED CCN(CC)c1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776860391 MGTYPPVOHUCYCM-VGOFMYFVSA-N 389.451 5.387 30 20 GKED CC(C)c1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cnn1-c1ccccc1 48858390 OCMPYXADKXVTGM-IBGZPJMESA-N 380.451 5.034 30 20 GKED N#C[C@H](C(=O)c1cscn1)c1nc(-c2ccc(Cl)cc2Cl)cs1 103330508 PHSQWGLFBHMBMC-SNVBAGLBSA-N 380.281 5.063 30 20 GKED CC(C)[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1 114620443 YRPZLUGPZCPAGF-MOPGFXCFSA-N 375.497 5.211 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3c(F)cc(C#N)cc3F)s2)cc1 150866353 WDPLZISZGPMALE-GFCCVEGCSA-N 397.450 5.068 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C 154970652 SHUMILPUCOICDR-UHFFFAOYSA-N 399.494 5.467 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nccs1 159293076 XTXUQCRXMAUMEV-OAQYLSRUSA-N 392.484 5.254 30 20 GKED CN(C(=O)c1cccc(SCC#N)c1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 163255567 UOJKKAOPLPORLL-MRXNPFEDSA-N 398.837 5.331 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(CC(=O)Nc1ccccc1SCC#N)C1CC1 173236175 WTAGVFMLSFNTTN-OAHLLOKOSA-N 399.947 5.120 30 20 GKED COc1ccc(CNc2ccccc2O[C@H](C)C#N)cc1SC(F)(F)F 182570218 BDZPRDDHOOVRFR-GFCCVEGCSA-N 382.407 5.210 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2nccs2)c1C 188069393 REAPGBWURKBQCC-UHFFFAOYSA-N 379.529 5.655 30 20 GKED COc1cc(Br)c(/C=C\C(=O)c2ccc(Cl)s2)cc1OC 211743716 REKCDBOHHTXXCG-ARJAWSKDSA-N 387.682 5.077 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1 237498959 GJGVQCQZMDLDRO-ROUUACIJSA-N 390.458 5.760 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(Cl)c(C(F)(F)F)c1 255576096 AEIYDWWBWYOFBV-ARJAWSKDSA-N 382.691 5.014 30 20 GKED C=CCn1c(SCc2cnc(-c3ccc(C(C)C)cc3)s2)nnc1C1CC1 255930188 ZJNYKCVRBMDEFP-UHFFFAOYSA-N 396.585 5.881 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(CO)(c2ccccc2)CC1 297948720 WVOOSXSRSQVGBB-UHFFFAOYSA-N 392.543 5.097 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 303618804 MSOXTTVZQXOZHA-MRXNPFEDSA-N 376.481 5.032 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(N3CCCCCC3)c2)cc(OC)c1OC 303803521 HFRSOXJVQPIASF-UHFFFAOYSA-N 394.515 5.065 30 20 GKED CC(C)[C@H](/N=C(/O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1)c1nc(-c2ccncc2)no1 328796764 VDRIAVWKJRUZLJ-KANFNMMFSA-N 382.508 5.392 30 20 GKED Cc1nc([C@@H]2CCCCCN2C(O)=Nc2ccc3nc(C4CC4)sc3c2)no1 329393061 ULGFKBCHQNYIPQ-INIZCTEOSA-N 397.504 5.028 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 332521736 KUXKRTPTSZXOKK-LJQANCHMSA-N 392.890 5.153 30 20 GKED CCCN(C(=O)c1cccc(SCC#N)c1)[C@H](C)c1cc2ccccc2o1 429835073 ZBBUSOYWBFBRSM-MRXNPFEDSA-N 378.497 5.662 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(N2CCCC2)c1 431282889 MUZVKOCQVIJQLM-WMZHIEFXSA-N 390.531 5.082 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCSc2ccc(F)cc21)c1ccccc1 431769462 IMWQMYNLBDFHSC-MOPGFXCFSA-N 383.492 5.097 30 20 GKED CC1(C)CN(C(=O)Nc2ccccc2C#Cc2ccccc2)[C@@H]1c1cccnc1 433004225 DIXVCJXSTPZLMA-HSZRJFAPSA-N 381.479 5.096 30 20 GKED C[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1cccc(C(F)(F)F)c1 437109038 GSYLOSGGABWYPB-FTXHTYHOSA-N 389.421 5.013 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)C(=O)N[C@@H](CCC#N)c1ccccc1 439424546 RVFNSMKBMFUFFS-NRFANRHFSA-N 391.515 5.033 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 439588616 SLASMEVICFBTHV-OALUTQOASA-N 395.469 5.095 30 20 GKED C[C@H]1COCC[C@@H]1c1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 442693056 YKOCKMDMRKJNDJ-BBRMVZONSA-N 395.846 5.194 30 20 GKED CC[C@@H](NCc1ccc(OCc2ccccc2)c(OC)c1)c1ccc(C#N)cc1 447519418 YKPAJAWNMBSIOR-HSZRJFAPSA-N 386.495 5.387 30 20 GKED CCOc1ccc(C(=O)N2CCCCC2)cc1N[C@H](CC)c1ccc(C#N)cc1 447592103 JXBVQBZQHKSLIF-OAQYLSRUSA-N 391.515 5.146 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)N[C@H]3CC[C@@H](CC#N)C3)o2)cc1 456047971 LGYSNFVPPIXFKU-HKUYNNGSSA-N 385.467 5.129 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC(c2c(F)cccc2F)CC1)c1ccccc1 458829678 FUGYWSRICPLJKS-NRFANRHFSA-N 397.469 5.289 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1cc(C(F)(F)F)ccn1 464410361 IWDPGARVABQARZ-LJQANCHMSA-N 378.353 5.162 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)s2)o1 464463469 QZFGIRDNYFGOKR-GFCCVEGCSA-N 376.359 5.220 30 20 GKED Cc1ccc(-n2c(SCCCSCC#N)nnc2-c2ccccc2)cc1C 466608599 PKHAJDLTSNLHFQ-UHFFFAOYSA-N 394.569 5.290 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ncccc2OCCCC#N)cc1 466612960 APCZTVNAUBNRAU-FQEVSTJZSA-N 392.503 5.257 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3c(C)oc4ccccc34)n2)cc1 467841371 ZUIDRPOFOMDNEJ-KRWDZBQOSA-N 388.448 5.363 30 20 GKED CC[C@H]1CN(C(=O)CCCCOc2cccc(C#N)c2)CC[C@H]1c1ccccc1 470014234 WYHWYXJHKRKFED-XUZZJYLKSA-N 390.527 5.150 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)Nc1cc(C#N)ccc1OCCOC 471873579 TWTFKVJYDOKIBG-UHFFFAOYSA-N 395.503 5.303 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCCC4(CC4)C3)cc2Cl)c1 473662787 ISHVKBCCZLAFEB-UHFFFAOYSA-N 395.890 5.199 30 20 GKED N#CC[C@@H](CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 476652944 BNJQCIXTVHAGGV-RBUKOAKNSA-N 386.417 5.109 30 20 GKED Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1cccc(OCCCC#N)c1 479748303 OVBRRDPTZSZVSB-UHFFFAOYSA-N 395.846 5.238 30 20 GKED C=CCSc1ccccc1C(=O)NCc1cccc(NC(=O)C2CCCC2)c1 485766223 JFBWHTHQVSUMTK-UHFFFAOYSA-N 394.540 5.023 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 487603037 LVWWMACSRRGBES-ZCNNSNEGSA-N 386.417 5.360 30 20 GKED Cc1cccc2cc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)oc12 488330044 OWIIYVNAJWVPEQ-INIZCTEOSA-N 392.867 6.008 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccccc2-c2c(F)cccc2F)cc1 494542776 PPZDPHCGTUYNQG-UHFFFAOYSA-N 394.446 5.375 30 20 GKED Cc1ccc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c(Cl)c1 494669347 UQRYNWAOZSTVDD-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc(F)c(Cl)c2)cc1 495041540 FKFQJRTWNUXAMT-UHFFFAOYSA-N 394.833 5.376 30 20 GKED C=CCC[C@H](NCc1ncnn1-c1ccccc1)c1ccc(C(F)(F)F)cc1 499606017 MXFGZDUALLVJPR-IBGZPJMESA-N 386.421 5.083 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)s2)c(C)c1 499863118 PJZZXGWOHZIESE-SFHVURJKSA-N 395.915 5.383 30 20 GKED N#C[C@H](NC(=O)CCCOc1cccc2ccccc12)c1ccccc1Cl 499934849 ZBTZXGMTAYHEQG-FQEVSTJZSA-N 378.859 5.033 30 20 GKED N#C[C@@H](NC(=O)CCCOc1cccc(Cl)c1Cl)c1ccccc1Cl 499973619 PBBXFHVSHIIDJD-OAHLLOKOSA-N 397.689 5.187 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCC(c1ccccc1)c1ccccc1 505593513 KZSPHSRUTSDUNB-UHFFFAOYSA-N 376.525 5.278 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1COCCC 505754282 GLVTVHINIWDUEK-UHFFFAOYSA-N 392.952 5.226 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 506483079 WVQPFNJGPXQTAA-GOSISDBHSA-N 393.874 5.668 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCCOc1ccccc1Br 507596369 NZQSBKVNCKPPCJ-AWEZNQCLSA-N 391.334 5.334 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 510059131 XMHRFJSNBLVRFL-UZLBHIALSA-N 381.907 5.649 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CC[C@H](c2ccccc2)O1 515328689 JCRFJANQLVTVRG-IFMALSPDSA-N 378.516 5.580 30 20 GKED C=CCCCNC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 515443803 PJUYLXXVDJALSU-UHFFFAOYSA-N 383.344 5.477 30 20 GKED N#CCCSc1ccccc1NC(=O)Cc1coc2ccc3ccccc3c12 518120649 SWUZHUZQISLDRE-UHFFFAOYSA-N 386.476 5.773 30 20 GKED Cc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 520835366 LBVCDIUAMQKYFC-UHFFFAOYSA-N 378.419 5.201 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccccc2)CCC1 521258887 FVDVJZUSDZJFNL-KRWDZBQOSA-N 379.529 5.182 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1ccc2ncccc2c1 522143771 OBLAURSEMGPINZ-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C[C@@H](SCc1csc(COc2ccc(F)cc2)n1)c1ccc(C#N)cc1 522841268 QAYLOYFRMUXHGP-CQSZACIVSA-N 384.501 5.727 30 20 GKED N#CCN(C(=O)Cc1cccc(OCc2cccc(Cl)c2)c1)c1ccccc1 524672636 KYRNIOXRBUPXRW-UHFFFAOYSA-N 390.870 5.018 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccccc2C(F)(F)F)ccc1OC 525194827 BDOWFJGKLGNCHW-OAHLLOKOSA-N 379.422 5.520 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc([C@H]2CCCOC2)c1 534300926 JWTNSRWATBHDED-LPHOPBHVSA-N 380.513 5.085 30 20 GKED C[C@@H](CCNC(=O)c1ccc(C2(C#N)CC2)cc1)c1cccc(C(F)(F)F)c1 538556806 PUWMSRZLZSOCIX-HNNXBMFYSA-N 386.417 5.184 30 20 GKED C[C@@H](NCc1cnc(C(C)(C)C)s1)c1ccc(-c2cccc(C#N)c2)cc1 542946852 AMQSWJQDRFEZTI-MRXNPFEDSA-N 375.541 5.830 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(-c2nc(CCCOC(C)C)no2)cc1 546465559 HWTAAAHOLJYBLJ-UHFFFAOYSA-N 377.444 5.067 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 551212026 PTAISIFBRFETEF-JTSKRJEESA-N 394.465 6.527 30 20 GKED C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)C[C@H](CC#N)c1ccccc1 558001858 JEBGMDGTJHFKHS-WMZOPIPTSA-N 388.433 5.182 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 559146561 OIYRXHGAFSEJBD-UHFFFAOYSA-N 375.394 5.471 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCCc3sc(-c4ccc(F)cc4)nc31)CC2 568453023 YIBZCNOCIRZEEY-WOJBJXKFSA-N 389.499 5.475 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)n1 589760364 MVVFTBXFFCXMLR-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)[C@H](C)Cc1ccc(C#N)cc1 593967266 PHYKCYNBZPHZHR-HZPDHXFCSA-N 389.524 5.046 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)sc2n1 603968435 ROXCZQNAMZPYPL-UHFFFAOYSA-N 389.505 5.766 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CSCc1ccc(F)cc1 603969130 FLUXPWPFQBDKFC-UHFFFAOYSA-N 382.485 5.298 30 20 GKED C=CCCOCC(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 607858610 MJRLXJQUVFBEMH-UHFFFAOYSA-N 395.478 5.263 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccccc2)s1)c1c(Cl)cccc1Cl 609287107 PTKDRORKJITVND-AWEZNQCLSA-N 388.279 5.112 30 20 GKED Cc1ccc(C)c(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609371625 OVBPMPXZMLPCOV-QGZVFWFLSA-N 384.570 5.570 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3ccccc3SC[C@@H](C)C#N)cs2)o1 609376769 JQKAUQPCZMLGSF-ZDUSSCGKSA-N 397.525 5.145 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[C@H]1CCc2ccccc21 609498287 OEGWEIHOJIVXPY-DEOSSOPVSA-N 382.463 5.304 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1SCCC#N 609971387 ZGIVDUJZQHBPIN-CQSZACIVSA-N 392.446 5.528 30 20 GKED C[C@]1(c2ccccc2)C[C@@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 610190112 DWMMLRWFZDHDMO-LADGPHEKSA-N 384.504 5.169 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(Cl)c1 610313497 ZSBFPUGQBALHRB-UHFFFAOYSA-N 396.805 5.404 30 20 GKED Cc1c(NCC(C)(C)C)cccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 610704316 SQGQMHAXWPEVRQ-MRXNPFEDSA-N 395.572 6.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1c(C)nn(COCC)c1C 632750624 LQRWXIXHMVSKNE-KRWDZBQOSA-N 397.563 5.163 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2cccs2)nc2ccccc12)c1ccc(F)cc1 727850064 QVTNYGZNEFEZJB-FQEVSTJZSA-N 387.439 5.097 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731972791 NPXCAGXNGIBDCX-PKTZIBPZSA-N 386.520 5.851 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)c1 733807028 QAZHUNXHZCXRDK-PZJWPPBQSA-N 397.906 5.068 30 20 GKED CC(C)(Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 735595994 KMCOSUCHMOMQFJ-HNNXBMFYSA-N 396.462 5.533 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCn3c4ccccc4c4ccccc43)[nH]c12 735789343 LEOYNEVLRIJKJA-LJQANCHMSA-N 392.462 5.246 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccsc1 739155630 JPSGJFFNYGNVHA-SKDRFNHKSA-N 380.416 5.357 30 20 GKED CCn1cc(CC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c2ccccc21 739595071 VMVGSVOOINSVBD-UHFFFAOYSA-N 399.519 5.120 30 20 GKED CSc1ccc(C(=O)/C=C/c2csc(-c3ccc4c(c3)OCO4)n2)cc1F 741848315 XVYNAJFWNQPRIX-SNAWJCMRSA-N 399.468 5.296 30 20 GKED CS[C@@H]1CC[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 743103449 BOGLERDFAPNVDF-SZVBFZGTSA-N 399.947 5.401 30 20 GKED O=C(/C=C\c1cccc(OCC(F)(F)F)c1)c1ccc(-c2ccncc2)cc1 745990209 NQDFXIRFTMSOBO-WTKPLQERSA-N 383.369 5.586 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(F)c(CSC)c2)cc1 747109318 OZGCUCJMGGWGIG-LIRRHRJNSA-N 398.503 5.163 30 20 GKED CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 748942412 PJVHBIFZXUGVBG-VSKRKVRLSA-N 393.556 5.528 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 749034294 ZONRPMLIKIWMAW-SWLSCSKDSA-N 388.851 5.123 30 20 GKED COc1cc(/C=C\C(=O)c2ccsc2)ccc1OCc1ccc([N+](=O)[O-])cc1 749102341 QYNYRDBCHVUFGN-YWEYNIOJSA-N 395.436 5.140 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)C2)cc1 752484988 KMBOESHJGNRJIY-NOZRDPDXSA-N 395.506 5.672 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(OCC(F)(F)F)cc1 753144036 XDRHNRHOWKIXRT-AATRIKPKSA-N 390.386 5.042 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2cccc(OC(F)(F)F)c2)cc1OC 754047325 RTSFDPRQUCDOBZ-AWEZNQCLSA-N 381.394 5.009 30 20 GKED C[C@@H](CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 776083826 CILMSLOKIAVSPK-LAUBAEHRSA-N 399.519 5.517 30 20 GKED C[C@@H](NCc1ccc(N(C)C2CCCCC2)cc1)c1ccc(OCC#N)cc1 776158520 GEGWNTLZPLUFER-LJQANCHMSA-N 377.532 5.209 30 20 GKED O=c1[nH]ccc2cc(NN=Cc3c(-c4ccccc4)[nH]c4ccccc34)ccc12 789073381 KHKAHGMQVMAQHQ-UHFFFAOYSA-N 378.435 5.122 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1ccnc(F)c1 794870810 SAWXZHPJPQWVCC-UHFFFAOYSA-N 377.448 5.037 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2coc3cc(F)ccc23)cc1 796630212 OIHKPOVWDVNUFO-FZKQIMNGSA-N 378.403 5.047 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570812 KQRLTRNSGXVDSE-MNOVXSKESA-N 397.327 5.391 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C\c2ccccc2OC(F)(F)F)s1 797571077 NIUOELCHQBRSJY-LJTDUEICSA-N 394.418 5.229 30 20 GKED CC(C)c1ccc2occ(C(=O)Nc3cc(C#N)cc([N+](=O)[O-])c3Cl)c2c1 808605194 MOJWZAFOMBDRBZ-UHFFFAOYSA-N 383.791 5.242 30 20 GKED CCc1nn(C)c(Cl)c1C=NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 814948717 BHQHCHUJCGTLFL-UHFFFAOYSA-N 398.738 5.120 30 20 GKED CC(C)=CCC[C@H](C)CC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842682363 WVFISDBJAWCWHY-HOCLYGCPSA-N 397.544 5.225 30 20 GKED C[C@@H](Nc1ccc2c(c1F)CCN(C(=O)OC(C)(C)C)C2)c1cccc(C#N)c1 864011714 ABTZKVMTNONMBN-OAHLLOKOSA-N 395.478 5.164 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(Cl)cc2)cc1 915353249 RVKDXRCCWLAOFR-OAQYLSRUSA-N 375.859 5.317 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)COc2c(Cl)cc(Cl)cc21 915986953 KLTFXHNVIVSLNM-BJMVGYQFSA-N 389.263 5.171 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)(F)F)cc2)cc1 916948372 URFULDSNQBXPQI-UGSOOPFHSA-N 388.389 5.180 30 20 GKED N#C[C@H](C(=O)/C=C/Sc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 916977279 OXCXMBAWMJOQHZ-SXSDINLZSA-N 396.924 5.946 30 20 GKED CCCc1ccc(-c2nc(NC(=O)c3ccccc3OCC#N)sc2C)cc1 919809564 XAOJJFWAGMRNES-UHFFFAOYSA-N 391.496 5.226 30 20 GKED CC(C)c1ccccc1N=C1SCCCN1C(=O)c1scnc1Cl 920078432 IULVBZKWASRJIA-UHFFFAOYSA-N 379.938 5.187 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(OCc2ccccc2)cc1 1776033276 XFVQICAUKZCPRJ-UHFFFAOYSA-N 394.858 5.453 30 20 GKED CC(=NNc1ccc(CC(=O)O)cc1)c1ccc(-c2c(F)cccc2F)cc1 1776085459 OCROOZKUBYMQHM-UHFFFAOYSA-N 380.394 5.095 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NN[C@@H](C)c1ccc(C(C)C)cc1 1776106319 ZWFCGKVBOOIBNO-OALUTQOASA-N 396.531 5.321 30 20 GKED O=C(/C=C/c1cc(F)c(C(=O)O)cc1F)c1ccc(Oc2ccccc2)cc1 1776126716 VFVVOXGZHRRXDW-DHZHZOJOSA-N 380.346 5.351 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)C(=O)c2ccccc21 1776308921 YSYHNXQDAQEDAB-GSERBOKHSA-N 388.419 5.370 30 20 GKED CCc1c(C(=O)/C=C\c2ccccc2OCCC(=O)O)oc2ccc(C)cc12 1776956115 DVYVLUMRTKMCEN-KTKRTIGZSA-N 378.424 5.053 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc2ccccc12 1777263379 KPJAFLRKLJUMAI-ZRDIBKRKSA-N 398.414 5.703 30 20 GKED COc1cc(/C=C/C(=O)c2sc3c(C)cc(C)cc3c2C)ccc1C(=O)O 1777290472 OJOZQOADWHZPNP-SOFGYWHQSA-N 380.465 5.429 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1777372659 RUERYYQDQNVRQD-HIPMGEKLSA-N 378.449 5.067 30 20 GKED C=CCCC(C)(C)C(=O)NC1(c2ccc(NC(=O)C3CC(=C)C3)cc2)CCC1 1785803622 PGXKWCNLJIOAKU-UHFFFAOYSA-N 380.532 5.079 30 20 GKED CC(=O)N(c1ccccc1)c1nc(CSc2nc(C)cc(C)c2C#N)cs1 5641376 YYMBWOXGRVQFBB-UHFFFAOYSA-N 394.525 5.004 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1ccccc1Sc1ccccc1C#N 14493122 UAECPTWDOVBRRK-UHFFFAOYSA-N 378.884 5.924 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(C(F)(F)F)cc1 30114597 XMCCPSGZLRJEKM-OAHLLOKOSA-N 394.396 5.735 30 20 GKED C[C@@H](Oc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 46443768 VKFAWUJGDJTUJJ-DYVFJYSZSA-N 382.872 5.107 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 63251416 WMMIEEAACDZGOR-UHFFFAOYSA-N 399.475 5.256 30 20 GKED N#CCc1ccc(NC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)cc1 65537608 LOYQJVKZLLHNGE-UHFFFAOYSA-N 398.249 5.499 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)cc(C)c1OC(F)F 108199344 DSNAVFNMEXKLOX-UHFFFAOYSA-N 376.428 5.163 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3cccc(OCCCC#N)c3)cs2)cc1 108298719 BCGKMDVBUFDRPV-UHFFFAOYSA-N 377.469 5.053 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CCOc1ccc(Cl)c(Cl)c1 115762731 OJMKVVRRCVFILY-UHFFFAOYSA-N 393.270 5.060 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)c1ccncc1F 127443757 BULUOTMSCRTQJG-UHFFFAOYSA-N 398.303 5.146 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2ccc(C)cc2C)cc1 127589726 FTGSLGROLDEILP-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(SC(F)F)cc1 128755562 SYTPDLPWIWUUFF-KRWDZBQOSA-N 396.418 5.116 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)CC(F)F 130047865 JGYFUODSIXDEEL-HNNXBMFYSA-N 389.471 5.238 30 20 GKED COc1cc(CN[C@@H](CCC#N)c2ccccc2)ccc1OCc1ccccc1 130407468 KVYHKRUAQVIFGO-QHCPKHFHSA-N 386.495 5.409 30 20 GKED N#Cc1csc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c1 176992164 FRODWYACTIOAGM-UHFFFAOYSA-N 388.370 5.683 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C 179315137 CNUQSYPVVWJEQG-AWEZNQCLSA-N 386.521 5.070 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1ccccc1)C(C)(C)CO 191517466 DLYGIQGDWICWFR-JOCHJYFZSA-N 394.559 5.462 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 195629365 ZOVHVEOGEMQBCM-IAGOWNOFSA-N 388.389 5.106 30 20 GKED CN(C)c1ccc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2n1 195742864 UBOBXBVLUQEVGU-UHFFFAOYSA-N 392.462 5.092 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3cc(-c4ccccc4)on3)c2)c1 237854417 FRYPUPQDMNJGBF-UHFFFAOYSA-N 395.462 5.082 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2cc(C)cc(C)c2)cs1 255309568 KAXDXTPAZJCTQP-TWGQIWQCSA-N 394.471 5.480 30 20 GKED CCN(CC)c1ccc(C=Nc2ccc(NC(=O)c3ccco3)c(C)c2)c(O)c1 255838818 RPRFDRFXMQPWIJ-UHFFFAOYSA-N 391.471 5.143 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H](C)c1ccccc1 255930417 HZFIILDILJZAHB-HNNXBMFYSA-N 385.920 5.550 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1 287137140 ZBFUHCUXBSZJSV-UHFFFAOYSA-N 395.478 5.205 30 20 GKED C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 303228727 XTVFVNDRKWDKHW-QGZVFWFLSA-N 399.494 5.284 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccc3)cc2)c1 303362056 QCSQTZPHSSCKCD-HSZRJFAPSA-N 383.451 5.720 30 20 GKED O/C(=N\C1(C/N=C(/O)[C@@H]2CCCC(F)(F)C2)CC1)[C@@H]1CCCC(F)(F)C1 328655867 NFGNASBRTIRDFZ-CHWSQXEVSA-N 378.410 5.083 30 20 GKED Cc1sc(N=C(O)CN2CCCC[C@@H]2c2nnc(C3CCC3)o2)c(C)c1C 329344033 CJPGICJBAHEVFP-MRXNPFEDSA-N 388.537 5.139 30 20 GKED CC[C@H](C)n1ncc(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1C1CC1 329508821 MCKBTANIXUZRSA-MGPUTAFESA-N 395.551 5.425 30 20 GKED O=C(c1ccncc1)N1CCC(/N=C(/O)C2(C3CCCCC3)CCCCC2)CC1 329902456 HRXLDVTTZXXGOS-UHFFFAOYSA-N 397.563 5.174 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1ncccc1C(F)(F)F 425368422 WSOLCPZEKVLJIJ-LBPRGKRZSA-N 387.327 5.033 30 20 GKED C=CCC[C@H](Nc1cccc(NS(=O)(=O)Cc2ccccc2)c1)c1ccco1 426314918 RZAAZJCOROZXHY-NRFANRHFSA-N 396.512 5.341 30 20 GKED C=CCN(C)C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 429386006 OHVWPACNTHMBDN-UHFFFAOYSA-N 397.862 5.224 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)Cc2ccccc2O1 433131788 LFGVZMMBXMQMGX-QGZVFWFLSA-N 399.450 5.166 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 433489475 RQZUHHIJLCJZOA-JXFKEZNVSA-N 393.918 5.792 30 20 GKED C=CCC[C@H](NC(=O)Nc1cn(C)nc1C(C)C)c1ccc(C(F)(F)F)cc1 435168007 HBYGMBWTVWOMMX-INIZCTEOSA-N 394.441 5.391 30 20 GKED CC(C)c1ccc(-c2nc(C[S@@](=O)CCCCC(C)(C)C#N)cs2)cc1 436108630 JHOKKPQRRQUDHF-SANMLTNESA-N 388.602 5.902 30 20 GKED C[C@@H](S[C@H](C)c1nc(Cc2ccc(Cl)cc2)no1)c1ccc(C#N)cc1 437274482 ICLJKZYGLDQBEZ-ZIAGYGMSSA-N 383.904 5.741 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(C[S@@](=O)C(C)(C)C)c2)CCCC1(C)C 444903960 ZIZKQGLMLHHJOG-UZTOHYMASA-N 390.593 5.332 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)[C@]1(C#N)C[C@@H]1C 450006906 WKATYPYGGWTOMQ-WNSKOXEYSA-N 390.462 5.220 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(CC#N)cc1Cl 452648851 VZRHSNWBBZTCNF-LBPRGKRZSA-N 380.797 5.242 30 20 GKED C[C@H](c1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1)C(F)(F)F 453797175 ZVTRFMZLDNZDTM-YGRLFVJLSA-N 386.295 5.256 30 20 GKED C=CCn1c(COc2ccccc2)nnc1SCc1ccc(C(F)F)cc1 460681384 WDDMEBQROOGYLR-UHFFFAOYSA-N 387.455 5.273 30 20 GKED CC(C)(C)c1cc(NC(=O)[C@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c(C#N)s1 464402106 XHFHWBPVRXHKRC-QWRGUYRKSA-N 378.419 5.077 30 20 GKED C[C@H](NC(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1)c1ccc(C#N)cc1 465650575 APFONFAGZCSKKL-AWEZNQCLSA-N 387.405 5.017 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)N[C@H](C)c2ccc(C#N)cc2)cc1 465669842 QMZQGDJCATYUSH-QZTJIDSGSA-N 399.494 5.355 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ncccc2OCCCC#N)cc1 466599915 IFGKOIQCZCVKOK-NQIIRXRSSA-N 392.503 5.078 30 20 GKED Cc1ccc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1C 468642084 OZUJVCCJIGYGSA-HNNXBMFYSA-N 384.570 5.427 30 20 GKED CC[C@@H](Cc1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 469689672 HUFPFKKUUISIBZ-QUCCMNQESA-N 395.572 5.956 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 474778411 AOICVNCDEMRXHN-IBGZPJMESA-N 396.450 5.080 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cnn1C1CCCC1 474970387 NVKHKIWZIGUCMJ-AWEZNQCLSA-N 398.919 5.314 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCO[C@H]1c1ccc(C)cc1 475571539 GFZLCNLPOVHFLR-VWNXMTODSA-N 392.543 5.889 30 20 GKED CCOCCC1(CNC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCC1 483329688 ZMNRRHAVYOKWDI-UHFFFAOYSA-N 393.487 5.069 30 20 GKED N#Cc1ccc(Br)c(CN[C@@H](c2ccc(Cl)cc2)C2CC2)c1 492581557 IIYBUJNQRORIRZ-GOSISDBHSA-N 375.697 5.215 30 20 GKED Cc1ccc(C#N)c(NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)n1 500298137 ZSTXYQZBEAUXNZ-UHFFFAOYSA-N 384.361 5.080 30 20 GKED COc1cc(CSCc2cnc(C)s2)ccc1OCc1cccc(C#N)c1 500876575 POZZYJVOONEZJW-UHFFFAOYSA-N 396.537 5.344 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(-c2cccc3cccnc23)cc1 509557127 LRCMUSFTYSAOGY-UHFFFAOYSA-N 381.435 5.051 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 516224520 WCPHFHCWGVUKQW-OAHLLOKOSA-N 377.469 5.165 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cs1 518229463 GUALSCIKPNCCPL-UHFFFAOYSA-N 391.496 5.286 30 20 GKED CC(C)CCn1nccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 520322068 ZFCVZSVNSLKDFA-UHFFFAOYSA-N 388.471 5.040 30 20 GKED CC(C)COc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 521840599 CJGZKEAZVUHXIP-UHFFFAOYSA-N 379.504 5.283 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc([C@H]4CCOC4)c3)n2)cc1 534926783 PZCSCSOWLUCPHD-PMACEKPBSA-N 388.492 5.113 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2c(F)cccc2F)cc1Cl 535624088 HBIFEXVSMMDMKU-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CSCC[C@@H](C)N(C)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542084980 IDKBMPQZEHORHC-SJORKVTESA-N 381.545 5.069 30 20 GKED COc1cc(C[S@](=O)CCCC(C)(C)C)ccc1OCc1cccc(C#N)c1 542857710 CEQDBUFOXVFANM-MUUNZHRXSA-N 399.556 5.221 30 20 GKED Cc1sc([C@@H](C)NCc2ccc(F)cc2C#N)nc1-c1ccc(Cl)cc1 544471333 YCMCWJMUBFULPJ-GFCCVEGCSA-N 385.895 5.634 30 20 GKED CCC(C)(C)[C@@H]1CCc2nc3ccccc3c(C(=O)[C@H](C#N)c3ccncn3)c2C1 546152491 BXCATDWFOHALKY-VQIMIIECSA-N 398.510 5.056 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OC(C)C)c(C)c1 554241243 ZEKXKXSETFRBLL-UHFFFAOYSA-N 384.524 5.170 30 20 GKED CC1(C(=O)Nc2ccsc2Cl)CCN(c2ccc(Cl)cc2C#N)CC1 561290888 HECKIUOIJMTJNJ-UHFFFAOYSA-N 394.327 5.172 30 20 GKED Cc1nc(-c2ccc(CNCc3ccc(C#N)cc3C(F)(F)F)cc2)cs1 570206117 YQKBJOUGIAOKOA-UHFFFAOYSA-N 387.430 5.299 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCC1 576607076 ZOYRWDUCXNXMNK-JOCHJYFZSA-N 379.479 5.159 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3csc(-c4ccccc4)n3)cc2)nc1 588079285 JARHRWBCZRFRIY-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3n2C)sc1-c1ccc(F)cc1 588348503 OZDBOYUDHWRRRF-INIZCTEOSA-N 389.455 5.239 30 20 GKED N#Cc1ccc(C(F)(F)F)c(N2CCC(c3nc(-c4ccccc4)no3)CC2)c1 589571957 RGXKGILYMXBEIM-UHFFFAOYSA-N 398.388 5.011 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1sccc1OC(F)F 591780793 VBEQNSUUSDYQMD-UHFFFAOYSA-N 387.276 5.256 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(C)c1ccc(C#N)cc1F 608798401 SRRVSJSEYVARDP-UHFFFAOYSA-N 385.851 5.059 30 20 GKED CCc1ccc([C@@H](C)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 609020232 IWBPNMCUFZRGSP-QGZVFWFLSA-N 385.467 5.359 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609063950 NQUUNILYFLJFEB-UHFFFAOYSA-N 391.496 5.278 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ncoc3-c3ccccc3)c2)c1 609558660 WJQRGPYOPWEMLG-UHFFFAOYSA-N 395.418 5.045 30 20 GKED COCc1cccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1 609722957 GRMPVKHPARYWSD-UHFFFAOYSA-N 392.842 5.403 30 20 GKED C[C@H](SCC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 609825563 FQUWYLBKKMYAON-OLZOCXBDSA-N 393.339 5.537 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 609968713 AONFMWRWVDCXGY-CQSZACIVSA-N 390.405 5.497 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4cccc(F)c4o3)cc2)c1 610227255 UKYHSMLMXWCXRQ-UHFFFAOYSA-N 386.382 5.275 30 20 GKED Cc1sc(CN[C@@H]2CCCc3cc(C#N)ccc32)nc1-c1ccc(Cl)cc1 611392482 XUSVCEBDVWGSKB-HXUWFJFHSA-N 393.943 5.811 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1cc2c(ccc3ccccc32)o1 611438291 HELFAQOXBYFIJV-QGZVFWFLSA-N 396.494 5.172 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nc2cc(Cl)ccc2s1 613402912 KIXLQCFDLXJLHB-GFCCVEGCSA-N 381.671 5.747 30 20 GKED CCOc1c(Cl)cc(NC(=O)c2cc3ccccc3n2CC#N)cc1Cl 613407950 IUOOAKNVSLYNCK-UHFFFAOYSA-N 388.254 5.123 30 20 GKED CC(C)(C)c1ccc(C#N)c(NCc2cccc(COCc3ccco3)c2)n1 613411813 PUUZTBDRLCXFPF-UHFFFAOYSA-N 375.472 5.173 30 20 GKED O=C(C/C=C\c1ccc(F)cc1)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 673829618 AAVFNJSWZPIRFG-IKGCNYHESA-N 397.334 5.255 30 20 GKED N#CCOc1ccc(CNC(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 727931920 UEBDCQXYYZWQFF-UHFFFAOYSA-N 385.427 5.326 30 20 GKED N#CCOc1cccc(NC(=O)c2cccc(OCc3ccc(Cl)cc3)c2)c1 728814575 DXOVKTIJVSBZKV-UHFFFAOYSA-N 392.842 5.074 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3cccc(OC)c3OC(F)F)c(C)c2c1 729151514 SSJGFXHVTSUBBK-CLFYSBASSA-N 388.366 5.256 30 20 GKED N#C[C@H](NC(=O)c1sc2ccccc2c1Cl)c1c(Cl)cccc1Cl 730092355 GNFDDSSRBKLRGO-LBPRGKRZSA-N 395.698 5.856 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(C)c1ccc2ccccc2c1 731029136 WONZVMRCFBECOZ-KRWDZBQOSA-N 389.524 5.309 30 20 GKED C[C@@H](CNc1snc(Cl)c1C#N)Sc1ccc(Br)cc1 731663668 NMCHJQLMPOPLHZ-QMMMGPOBSA-N 388.743 5.023 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(CCC#N)CC(C)(C)C)cs2)cc1 732073704 CVPHDQVUIFJKQE-UHFFFAOYSA-N 383.561 5.264 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 732496367 SHAZIANCWYOXBO-MJGOQNOKSA-N 378.522 5.557 30 20 GKED O=C1/C(=C\c2nccn2Cc2ccccc2)CCc2cc(SC(F)F)ccc21 734094388 CSYVCMPMSMSFOY-LGMDPLHJSA-N 396.462 5.459 30 20 GKED CCO[C@H](C)c1nc(CSCc2cc(Cl)ccc2OCC#N)cs1 736640412 CQIYSASPSOWWSW-GFCCVEGCSA-N 382.938 5.230 30 20 GKED C/C(=C\C(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 742068368 MMVDZWYVWZVAMT-DPCFLFMUSA-N 378.781 5.143 30 20 GKED CC(C)[C@H](C#N)NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 746240098 VOWJGUMSBLIUAH-NRFANRHFSA-N 382.463 5.211 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)s1 749322907 DWRXXJRYWYGCBE-SNVBAGLBSA-N 383.325 5.158 30 20 GKED C[C@H](OC1CCCCCC1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 761045587 CUODZJLHNRHLRI-WFASDCNBSA-N 376.909 5.254 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12 766646201 VPYGIKFLXSJIES-UHFFFAOYSA-N 379.419 5.034 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cc(C#N)cc(Cl)n1 768377038 WBLFXOOTXUCYGE-UHFFFAOYSA-N 399.285 5.015 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3CCC(C(F)(F)F)CC3)n2)cc1 774052990 GTWNKPBMKJSMMP-UYSNPLJNSA-N 392.446 5.664 30 20 GKED C=CC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21)c1ccncc1 777242897 JVPYGVJAUKMORX-BJESRGMDSA-N 375.516 5.067 30 20 GKED N#C[C@H](C(=O)[C@@H](F)Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 778297075 GCYWPTHLZRAYGW-SJORKVTESA-N 384.863 5.221 30 20 GKED CC(C)(C)n1cc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cn1 779596413 VIUGPKWYVWCKAP-UHFFFAOYSA-N 394.906 5.354 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)COc2ccc(-c3ccccc3)cc2)n1 780401650 GFQVYISAGDOCTR-LJQANCHMSA-N 376.481 5.189 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(Cl)cn2)cc1Cl 785863290 GYFRLJHHBYEMEN-LJQANCHMSA-N 396.277 5.225 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)Cc2cccc(C(F)F)c2)cc1 790767555 NGHKOKLYTGDPAF-IFXJQAMLSA-N 384.426 5.028 30 20 GKED COc1cc2c(cc1NC(=O)c1cc(C#N)ccc1Cl)oc1ccccc12 794844086 FIOWOODMBAHLNA-UHFFFAOYSA-N 376.799 5.372 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C/Sc2cc(F)ccc2F)s1 797964255 FPRJWJQNTODNES-NNNHXZLVSA-N 378.469 5.201 30 20 GKED N#CC1(CCCOC(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)CCOCC1 800177888 PMYIXSCQULLLFY-UHFFFAOYSA-N 396.314 5.059 30 20 GKED Fc1ccc(CCNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(Cl)c1 811472915 MCVLGMLMOVNPQN-GHMZBOCLSA-N 391.758 5.521 30 20 GKED Cc1ccc(-c2cc(C(=O)N(C)c3ccc(C#N)cc3F)c3ccccc3n2)o1 812962858 XTBWXWHHNIRYOV-UHFFFAOYSA-N 385.398 5.091 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)OC(C)(C)C)cn1 830896932 JKDVUESEKUJSJQ-UHFFFAOYSA-N 395.503 5.533 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1nc2ccc(Br)cc2s1 841893366 DOYBRJSQSCBPCG-INIZCTEOSA-N 398.329 5.098 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(C(F)(F)F)cc2)cc1 915086687 MBHRFYOACCGHLE-OAQYLSRUSA-N 394.396 5.542 30 20 GKED C#Cc1cccc(NC(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c1 915340220 ORLHXMOVORPPTA-QFIPXVFZSA-N 379.463 5.103 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@@H](C#N)c3nc4ccccc4s3)ccc2c1 916846071 GNNKKSHYVFPXGI-BQHJZSHBSA-N 384.460 5.348 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)N(C)c3cccc(C#N)c3)c2c1 920346259 RLDMEZSQZNQUNA-UHFFFAOYSA-N 377.447 5.359 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2Cc2ccc(Cl)cc2)ccc1Cl 1776033781 GQGVQBFYPFNXPX-ZDUSSCGKSA-N 377.271 5.502 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2F)c1)C(=O)O 1776470775 HLQNOYGQBMWHAF-HBWSCVEGSA-N 396.439 5.302 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3occc3C)CCC2)cc1 1789453674 FDFVMIYYKUFQMW-HXUWFJFHSA-N 392.499 5.104 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCCC#N)n2Cc2ccccc2)cc1 4287579 LRRADMGEJVCPTN-UHFFFAOYSA-N 390.556 5.687 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cnc2ccccc2c1 26748030 ZREUJIXOORRAOO-UHFFFAOYSA-N 381.460 5.510 30 20 GKED CCCCOc1ccc(-c2nnc(COc3ccc(C#N)cc3Cl)o2)cc1 42153982 FMMQQSRSJCKJRO-UHFFFAOYSA-N 383.835 5.020 30 20 GKED CC(C)Cn1cc(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)c2ccccc21 48829810 PJAVNXDLLFROIW-MRXNPFEDSA-N 385.389 5.201 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccccc1OCc1ccccc1Cl 64456628 BGRYHOYVAQRPRL-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 102534102 VFRVYPOOICHZJG-UHFFFAOYSA-N 375.428 5.306 30 20 GKED N#Cc1cc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)ccc1F 124455688 GXPALBLJHLBHFJ-UHFFFAOYSA-N 393.491 5.148 30 20 GKED Cc1coc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 154778696 WCCCTLZEDQZBIU-UHFFFAOYSA-N 379.419 5.441 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 173265489 XUCIWSKMQAZPKD-GFCCVEGCSA-N 389.318 5.404 30 20 GKED C[C@@H](Sc1ccccc1C#N)c1nc2scc(-c3cccs3)c2c(=O)[nH]1 173720962 YTDPAHBXADYOMT-LLVKDONJSA-N 395.534 5.438 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(-c3nc(C4CC4)no3)cc2)c(C#N)s1 179546394 ZODZVPASONOZLM-UHFFFAOYSA-N 392.484 5.097 30 20 GKED CC(C)C(=O)Nc1cccc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1 182450768 BULBIZGTHDJKFU-UHFFFAOYSA-N 399.450 5.197 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 185578243 IYULZJVWTYPSGL-MRVWCRGKSA-N 390.430 5.240 30 20 GKED C=C[C@@](C)(CCOC)COC(=O)c1nc(-c2cccc(C(F)(F)F)c2)oc1C 191162545 TZVJFQJRWRUGRJ-IBGZPJMESA-N 397.393 5.054 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C(C)(C)C1 192216483 UFTCOAGVQPRHLC-CJNGLKHVSA-N 399.482 5.381 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(F)cc2F)cc(C)c1OCc1ccccn1 206737958 HQJXDEWIKXWROR-TWGQIWQCSA-N 379.406 5.452 30 20 GKED Cc1sc(Br)c(C(=O)Nc2ccccc2SCCC#N)c1C 281704840 NYLQBYKDWSRAAZ-UHFFFAOYSA-N 395.347 5.386 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 303453145 DEOISRPVLHBCDY-FDDCHVKYSA-N 395.572 5.206 30 20 GKED Cc1ccc(N=C(O)[C@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c(C)c1 328712095 RPPZTIAUPDUKOC-JTSKRJEESA-N 391.515 5.377 30 20 GKED Cc1csc(C2(/N=C(/O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)CCC2)n1 329408846 BCAGTYOFSVHLJS-KRWDZBQOSA-N 398.576 5.294 30 20 GKED OC(=Nc1cccc(CSC2CCCCC2)c1)N1CCCC[C@@H]1c1nc[nH]n1 329807830 BNEHZVORQDRWSW-LJQANCHMSA-N 399.564 5.143 30 20 GKED Cc1sccc1C/C(O)=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1 329894329 JXMQYHLDLWLZBD-MRXNPFEDSA-N 389.521 5.040 30 20 GKED OC(=Nc1ccc2c(c1)OC1(CCCC1)O2)C1CCC(/N=C(/O)C2CC2)CC1 329989835 IMLJGRXHHMSDJX-UHFFFAOYSA-N 384.476 5.241 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C1CCC(/N=C(/O)C2CC2)CC1 330006593 CXSIMBNUUKKENL-KKXNLOMOSA-N 397.563 5.238 30 20 GKED CC(C)c1ccc2c(c1)[C@H](NC(=O)c1cnn(CCC#N)c1-c1ccccc1)CC2 428940080 BRZLAZZXDWIHHJ-HSZRJFAPSA-N 398.510 5.004 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)c1cccc(C(F)(F)F)c1F 429924006 LBKDMUFGLOCOOM-UHFFFAOYSA-N 381.247 5.038 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1csc(-c2ccncc2)n1 431369411 MAADEFVZZFGJHK-UHFFFAOYSA-N 398.447 5.121 30 20 GKED Cc1cc(C#N)ccc1C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 439052113 CBEMIXWPVDADJO-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#CCCCOc1cccc(CNc2cccc(-c3ncc4n3CCCC4)c2)c1 444008887 AJDIYGJPQCKTPK-UHFFFAOYSA-N 386.499 5.181 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC[C@H]1CCCC1(F)F 454699912 YBCQGGAOJSCFBE-GOSISDBHSA-N 399.441 5.003 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@H](C)c1cccc(C#N)c1 462039374 OCAISYRTMYSLMR-MOPGFXCFSA-N 384.479 5.749 30 20 GKED N#Cc1cnc(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)c(Cl)c1 462846457 VEBMMZRIJNARMG-UHFFFAOYSA-N 397.265 5.124 30 20 GKED N#Cc1ccc(F)c(CNc2ncnc3scc(-c4ccc(F)cc4)c23)c1 463073328 YNMXPXGCMOQQLA-UHFFFAOYSA-N 378.407 5.120 30 20 GKED CC(C)(C)c1cc(NC(=O)[C@@H]2C[C@H]2c2cc(F)c(F)c(F)c2)c(C#N)s1 464402107 XHFHWBPVRXHKRC-WDEREUQCSA-N 378.419 5.077 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N2CCCC3(CCCCCC3)C2)o1 464677123 LMYWFYGWRVLJGR-UHFFFAOYSA-N 392.499 5.307 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3C[C@H]4CCC[C@H]4C3)cc2Cl)cc1 465159727 SRKAAMBCBSGIKO-IYBDPMFKSA-N 381.863 5.268 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3cccc(C(F)F)c3)cc2)c1 468298874 DNTLZEXYXDGEDZ-UHFFFAOYSA-N 392.405 5.256 30 20 GKED CCc1c(NC(=O)Nc2cccc(OCCCC#N)c2)cnn1C(CC)CC 484175927 DWVAHOCLOBGSLT-UHFFFAOYSA-N 383.496 5.133 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Br)cc1)c1ccccc1 487241656 NSWKTPHNRDSQRR-AABGKKOBSA-N 397.316 5.104 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 497358661 UVHZFHUGACBNON-MBSDFSHPSA-N 395.572 5.348 30 20 GKED CC[C@@H](CC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)cc1 502052456 YCHWFXDRENQYKH-IRXDYDNUSA-N 382.529 5.469 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)Nc3ncc(C#N)cc3Cl)s2)cc1 505769810 XIAXQEZDKHZKSK-NSHDSACASA-N 384.892 5.220 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H]2CC(C)C)cc1 508286326 IEEXGEWRVCLFFT-IBGZPJMESA-N 393.487 5.402 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)Nc4ccc(C(C)(C)C#N)cc4)CC3)c[nH]c2c1 515253020 PLRCUMXROZXHNY-UHFFFAOYSA-N 398.510 5.599 30 20 GKED C[C@H](c1ccccc1)N(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CC1 516820048 QTFFVYQICSGLIQ-QGZVFWFLSA-N 398.466 5.503 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](Nc3ccccc3)C2)cc1 517111853 UTWAJESKUXCPGY-NRFANRHFSA-N 398.466 5.069 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccc(OCc3ccccc3Cl)cc2)c1 517517374 KRGLLPPNPRCCRR-UHFFFAOYSA-N 391.858 5.112 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCOc2ccc(F)cc21 518168824 LSIHHWJYWMDPAB-PBHICJAKSA-N 399.491 5.113 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)N(Cc1ccccc1)C(C)(C)C 518263104 RTZLFIVCTPKCPW-GOSISDBHSA-N 395.572 5.320 30 20 GKED C[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(OCc2cccnc2)cc1 518814682 GCWIQPWIADHSRI-HNNXBMFYSA-N 397.400 5.724 30 20 GKED CC(C)c1scnc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 519732919 IRNYBIPYCTZPBG-UHFFFAOYSA-N 381.432 5.322 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 520271963 XDAZNYRSAOLLJJ-FQEVSTJZSA-N 395.384 5.071 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3ccc(Cl)s3)cc2)cc1 521365838 CPPSVTRITZBKFZ-UHFFFAOYSA-N 383.860 5.387 30 20 GKED N#CCc1ccc(NC(=O)Cc2cccc(OCc3ccc(Cl)cc3)c2)cc1 521570538 JSGYUUUIGGTYHV-UHFFFAOYSA-N 390.870 5.166 30 20 GKED C[C@@H](Nc1cccc(CSC2CCCC2)c1)C(=O)Nc1cccc(C#N)c1 525405310 CVYUSIPEFVXLHS-MRXNPFEDSA-N 379.529 5.173 30 20 GKED CC(C)(C#N)CCCNc1ccc(C(=O)N2CCC[C@H]2c2ccccc2)cc1 532159082 VSKVFMKLUGSZHP-QFIPXVFZSA-N 375.516 5.406 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Br)cc3cccnc23)cc1 533887346 IXMRPRSEDNIQKU-UHFFFAOYSA-N 394.272 5.051 30 20 GKED COc1cc([C@H](C)N[C@H](C)c2cccc(C#N)c2)ccc1OCc1ccccc1 537294210 ARMHQZZMNSSVNU-MOPGFXCFSA-N 386.495 5.558 30 20 GKED COc1c(Cl)cc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1Cl 543331528 HCBSCEGYJYKBDE-UHFFFAOYSA-N 390.270 5.070 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)ccc1F 550835047 GFIAVJANLDBLSZ-AUUYWEPGSA-N 375.285 5.674 30 20 GKED Cc1cc(Oc2ccc(NC(=O)c3sc4ccc(C#N)cc4c3C)cc2)n[nH]1 551590936 AXNCWXIBRBMGMT-UHFFFAOYSA-N 388.452 5.158 30 20 GKED C[C@@H](N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1cccc(C#N)c1 569462242 KNSCLTGZYOGUSV-VFNWGFHPSA-N 388.433 5.396 30 20 GKED Cc1sc(C2(NCc3cc(C#N)cs3)CCC2)nc1-c1ccccc1F 578861522 MGOSHLZRJOHNMD-UHFFFAOYSA-N 383.517 5.360 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 588164861 VWPFZDGBCLCDIO-UHFFFAOYSA-N 399.903 6.155 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3c(Cl)cccc3Cl)cn2)cc1 603763965 DWOHDNORIXXRGK-UHFFFAOYSA-N 398.249 5.234 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)sc2c1 605363337 VAEIRCIURFKKQO-CYBMUJFWSA-N 379.872 5.538 30 20 GKED CN(CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 609164662 UALTUHMDRVJWHX-OAQYLSRUSA-N 389.886 5.070 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)nc1 609343024 HGHTUHCTCGIKHL-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(-c2ccc(F)cc2)n1 609428537 TUUCNMXMKYCNJJ-CYBMUJFWSA-N 397.500 5.596 30 20 GKED Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)c3ccc(C#N)nc3)sc2c1 609640744 SECQFDVRLZNEKU-UHFFFAOYSA-N 398.491 5.027 30 20 GKED CC(C)n1nccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609729842 WGPZLJRLZRCFAW-UHFFFAOYSA-N 380.835 5.034 30 20 GKED CCCn1c(S[C@H](C)c2ccc(C#N)cc2)nc2sc3c(c2c1=O)CCC3 609813662 YJECDTXLDGMNKJ-CYBMUJFWSA-N 395.553 5.082 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC(C4CCCC4)CC3)s2)cc1 610317983 RTWFLICJUATQTQ-UHFFFAOYSA-N 394.544 5.040 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(Br)cc1)c1cccc(C#N)c1 612574919 YDGFYVVFDHALKX-YVEFUNNKSA-N 397.238 5.665 30 20 GKED CCCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 613319702 JTWDCZPJXJOAIB-SFHVURJKSA-N 396.899 5.742 30 20 GKED CCCc1sc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1CC 613401582 GAAKIRMGDVIXKA-CYBMUJFWSA-N 387.455 5.498 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Cc1coc2cc(C)c(C(C)C)cc12 672218446 IIXLJQJPTWHFGK-UHFFFAOYSA-N 395.499 5.097 30 20 GKED C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1cccc(C#N)c1 727640772 SRDWNVYXESEZAI-CQSZACIVSA-N 380.831 5.104 30 20 GKED COc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 728766682 GCDXPSCLDMWVBT-APWZRJJASA-N 390.508 5.497 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)OCc1ncc(-c2cccs2)o1 731506201 ZZJKIUQRINACST-UHFFFAOYSA-N 386.432 5.299 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](C)c1csc2ccccc12 732918571 OLPOKPKVCHHLFO-HOTGVXAUSA-N 384.570 5.217 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ncc(C(F)(F)F)cc2Cl)ccc1OC 733302433 UJHUTADXZOVRNC-ZDUSSCGKSA-N 399.800 5.055 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3C)o2)cc1NC(C)=O 734304813 XFSSFZSLVFVRCM-RMKNXTFCSA-N 393.414 5.257 30 20 GKED CCOc1cc(/C=C\C(=O)c2c[nH]c3ccc(OC)cc23)ccc1OC(F)F 734307876 VKKBARSDKBJNCS-YWEYNIOJSA-N 387.382 5.073 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2c(Cl)nc3ccccn23)cc1OCC 737445817 GOMFXFUPPFGFPA-CSKARUKUSA-N 384.863 5.071 30 20 GKED COCCOc1cccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)c1 741842091 JYHQUDOWJSBXGD-BJMVGYQFSA-N 396.430 5.262 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)nc2ccccc12 747405391 CSTIHTBPOQIQPX-UHFFFAOYSA-N 379.419 5.034 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(=O)oc2ccccc12 750611619 MPIOHQRKONNGRF-UHFFFAOYSA-N 396.402 5.018 30 20 GKED N#Cc1ccc(/C=C2\CC3(CCOCC3)C/C(=C\c3ccc(C#N)cc3)C2=O)cc1 751517247 KDPPXGOZHQBTAE-RNIAWFEPSA-N 394.474 5.057 30 20 GKED Cc1nn(C)cc1C(=O)/C=C/c1nc(-c2cc(Cl)ccc2Cl)cs1 753901080 VMVVAACKKINWFF-AATRIKPKSA-N 378.284 5.055 30 20 GKED C=C[C@@H](CC(=O)O[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 758909975 DRYRWSVWCXDKQK-SJORKVTESA-N 385.891 5.187 30 20 GKED COc1ccc(C[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 759214086 XZSIMMIGXGKDQR-UZLBHIALSA-N 390.508 5.182 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@@H]1C)c1ccncc1 759580890 IXYNIQZBMIABHU-ORAYPTAESA-N 390.314 5.335 30 20 GKED Cc1cccc(C(=O)OCCCCC(C)(C)C#N)c1NC(=O)c1ccoc1C 768635063 BPTOHOOXZUNXPL-UHFFFAOYSA-N 382.460 5.026 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)nn1C1CCCCC1 776299751 ABSQFTKXCFMPFK-HSZRJFAPSA-N 398.510 5.605 30 20 GKED CC(C)(C)C[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccccc1 777114784 MUMWPMBXBJNQEJ-JOCHJYFZSA-N 377.532 5.109 30 20 GKED N#CCc1ccc(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cc1 783714043 CNAGFWAWOLQTPL-OAQYLSRUSA-N 389.524 5.087 30 20 GKED CC(/C=C\C(=O)c1ccc(C(=O)N(C)C)cc1)=C/c1cccc(C(F)(F)F)c1 792924506 DAWIMWIKEDHXCC-LAKAAKMVSA-N 387.401 5.250 30 20 GKED C[C@@H](C(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 798426604 GIGZZPSQZLWHDI-SECBINFHSA-N 379.275 5.606 30 20 GKED N#Cc1ccccc1/C=C\C(=O)N(c1ccccc1)c1nc2ccccc2s1 800401362 PYFRHBRGRLOKJM-PFONDFGASA-N 381.460 5.546 30 20 GKED C[C@@H](OC(=O)CCCCCC#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 805695994 RTDNGUBZIZHZDC-GFCCVEGCSA-N 381.259 5.727 30 20 GKED N#Cc1c(F)cccc1/C=C(/Cl)c1nc2ccc(Br)cc2o1 812249085 WGPOWSRXZSUHOP-WUXMJOGZSA-N 377.600 5.338 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2cccc(F)c2)CC1)c1ccccc1 838603548 JHGYVCLEDLRRCG-JOCHJYFZSA-N 379.479 5.150 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 915103676 BIBJSAUXWCWGJE-LSDHHAIUSA-N 388.414 5.685 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3cc(C)ccc3Cl)n2)cc1 916650405 LWPAYPNVJXKPMG-MRXNPFEDSA-N 396.899 5.336 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1C=NNc1ncccc1C(F)(F)F 917548825 ZIMGHERPODNNLG-UHFFFAOYSA-N 393.800 5.002 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2c(s1)CCCCC2 920102158 QTZRUZKCQCBWCC-INIZCTEOSA-N 376.481 5.012 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc2c(ccc3ccccc32)o1 1776033325 HGSIHTUSVZGSDU-UHFFFAOYSA-N 378.815 5.774 30 20 GKED O=C(O)c1cc(NN=Cc2csc(-c3ccc(Cl)cc3)n2)ccc1Cl 1776033358 PKLSWABDOACMGZ-UHFFFAOYSA-N 392.267 5.261 30 20 GKED O=C(O)c1cccc(NN=Cc2nc(-c3cc(Cl)ccc3Cl)cs2)c1 1776037044 MQSUJZJSBUHEBE-UHFFFAOYSA-N 392.267 5.261 30 20 GKED Cc1c(/C=C2/Oc3c(cccc3C(C)(C)C)C2=O)nc2ccccc2c1C(=O)O 1776113946 CRVYPQAFGQMBDK-XDHOZWIPSA-N 387.435 5.155 30 20 GKED Cc1cc(C)c(C(=O)/C=C\c2ccc(OCc3occc3C(=O)O)cc2)cc1C 1776132897 IVAFUCMDADCVHC-TWGQIWQCSA-N 390.435 5.378 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(F)cc1C(F)(F)F 1776354709 XAKRKOHXOFRMTG-QPJJXVBHSA-N 396.336 5.226 30 20 GKED COc1cc(/C=C/C(=O)c2ccc3ccccc3c2OC(F)F)ccc1C(=O)O 1777289249 ZYYMONWKBJTTAP-YRNVUSSQSA-N 398.361 5.044 30 20 GKED Cc1cccc(C)c1/N=C1\NC(=O)/C(=C\c2ccccc2OC(F)(F)F)S1 24717736 BHWFOIUHKOZFNP-XNTDXEJSSA-N 392.402 5.094 30 20 GKED Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1Sc1ccccc1C#N 60515149 HZRJPWYTUWOTGX-UHFFFAOYSA-N 389.436 5.178 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954999 NYRPIGMLJKBBQX-KRWDZBQOSA-N 395.528 5.310 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 120116882 ZBAIKJLDMYINQK-TZMCWYRMSA-N 395.311 5.252 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N(CCC#N)Cc1ccco1 126095604 IPJZOBRADWNTGZ-UHFFFAOYSA-N 389.455 5.115 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 127422039 SAXOJQOOUQQINH-FQEVSTJZSA-N 384.526 5.455 30 20 GKED N#CCC[C@@H](NC(=O)CCC(=O)c1cc(Cl)sc1Cl)c1ccccc1 153580611 FARVLMBAUCHBIY-CQSZACIVSA-N 395.311 5.179 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2csc(-c3ccccc3Cl)n2)n1 177764571 WGGDNNSFYWOCKU-LBPRGKRZSA-N 387.917 5.533 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)c1 180672004 QRCFLEKWQRBOLD-FQEVSTJZSA-N 382.508 5.131 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(OC(F)F)cc1OC(F)F 181575303 BLKPCRXQZGIVRI-DYVFJYSZSA-N 396.384 5.585 30 20 GKED CC(C)(C)n1cc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)nn1 191212849 XZJBBSSVSLFZFH-LGMDPLHJSA-N 388.496 5.066 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2ccc(-c3ccccc3)cc2)cs1 214259256 IEKIWEJKEIYLID-YPKPFQOOSA-N 376.481 5.079 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)s1 255554203 HYSNEJGAPJKVCD-CLTKARDFSA-N 386.885 5.205 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1csc(COc2ccccc2)n1 277492332 XFOAOQPMWGZQOS-QGZVFWFLSA-N 390.549 5.016 30 20 GKED CC(C)C[C@@H](C)N(C(=O)Cc1ccc(OCC#N)cc1)c1ccc2[nH]ccc2c1 303470213 NAWGQOJTEUFFII-GOSISDBHSA-N 389.499 5.081 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c2[C@H](C)C1 411010951 LIFHXCMIAYUSKE-NXEZZACHSA-N 389.864 5.119 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)C1 433148165 FYPQUGZMSMAKDX-MJGOQNOKSA-N 379.529 5.492 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CC[C@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 437793910 BZSMZMZYYBNFDH-DJJJIMSYSA-N 387.405 5.501 30 20 GKED N#Cc1ccc(CSc2nnc(-c3cccc(Cl)c3)o2)c(OC(F)F)c1 439540781 JBTWMMWCBCKJPE-UHFFFAOYSA-N 393.802 5.155 30 20 GKED CC(C)(C)c1ccc([C@H]2CCCN2Cc2nnc(-c3cccc(C#N)c3)o2)cc1 441221079 CMEBDUKEGBZKIN-OAQYLSRUSA-N 386.499 5.243 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2Cc3ccccc3C[C@@H]2c2ccccc2)cc1 448383988 CQUYTDRWBQCMPZ-XMMPIXPASA-N 395.506 5.819 30 20 GKED CC[C@@H](CNc1ccccc1)NC(=O)Nc1ccccc1S[C@H](C)CC#N 454747945 ALMZMMXMHYXQMQ-SJORKVTESA-N 382.533 5.093 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1[C@@H](C)C[C@@H](CC(F)(F)F)[C@H]1C 454762998 YFJVAYQKUSZNCQ-XQLPTFJDSA-N 399.482 5.522 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 464160141 VNUMJWCTKZVEDK-GOSISDBHSA-N 396.343 5.104 30 20 GKED C=CC[C@H](CC)NC(=O)C(C)(C)c1csc(-c2c(F)cccc2Cl)n1 464501950 OVXOLMNGODSFNE-LBPRGKRZSA-N 380.916 5.351 30 20 GKED C=CCn1c(SCc2nc3cc(F)ccc3o2)nnc1-c1cccc(C)c1 464909790 MMKZQDAHNJVGCT-UHFFFAOYSA-N 380.448 5.012 30 20 GKED C=C(C)C[C@H](C)C(=O)N(C)c1ccc(Cl)c(N(C)C(=O)[C@@H](C)CC(=C)C)c1 466441175 JDCYUCFIWJBZEM-IRXDYDNUSA-N 390.955 5.470 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3cccc4cc[nH]c34)c2)cc1 466560872 CSDXQYQREZXAGI-UHFFFAOYSA-N 382.423 5.154 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 467147748 KDRFQKYYTXETER-LLVKDONJSA-N 397.784 5.466 30 20 GKED Cc1c(COc2ccccc2)cccc1NCc1nnc(-c2cccc(C#N)c2)o1 471678090 INUFHZNLBTXGRH-UHFFFAOYSA-N 396.450 5.108 30 20 GKED CSc1cccc(C)c1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 472239858 MOWGTKKWCAAPCA-UHFFFAOYSA-N 388.492 5.420 30 20 GKED CSc1cccc(C)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 472247272 DFJMXONQPVVHSS-UHFFFAOYSA-N 375.453 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C)[C@H]1c1cccc(F)c1 475550465 TWOMJSNFYWJEFD-HXOBKFHXSA-N 380.507 6.293 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 477419617 BASKPSCQVAFSQI-IFXJQAMLSA-N 388.389 5.154 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC(OC2CCCCC2)CC1)c1ccc(F)c(F)c1 477746169 SHZDFGBSGDEPBW-OAQYLSRUSA-N 392.490 5.105 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cnn(CC(C)C)c1C1CC1 482203715 AEWIBJKEAIAGHS-UHFFFAOYSA-N 380.536 5.912 30 20 GKED C=CCN(CC1CCCCC1)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 482828095 RVRUYFWUIGMVQA-UHFFFAOYSA-N 386.923 5.523 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1 499838043 NCNFETXCAKDWKC-CPUCHLNUSA-N 379.674 5.131 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CCCc1nc2ccccc2s1 500302528 KNKYDFQHQMGUOI-UHFFFAOYSA-N 391.540 5.175 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)N(Cc1ccco1)c1ccccc1C#N 501019524 QEBQXFVZAMCWST-OAHLLOKOSA-N 396.899 5.519 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)c1 507702414 CEWQEXNQRBPOPR-UHFFFAOYSA-N 388.279 5.165 30 20 GKED O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 509258987 CCKRNIUFEVJXPV-HNNXBMFYSA-N 393.302 5.197 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(F)c(C#N)c1 510015852 UVQGZJPNLGCSQB-UHFFFAOYSA-N 379.357 5.159 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc2ncccc12 511567205 YXVSDIUNJCGJNZ-UHFFFAOYSA-N 379.419 5.460 30 20 GKED N#CC1(CCCSCc2cc(Cl)ccc2OCC2CC2)CCOCC1 512382572 JSEHRFQELLXJCE-UHFFFAOYSA-N 379.953 5.463 30 20 GKED CCN(c1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1)C(C)C 517518047 PHUIUKJRJCZYPJ-KRWDZBQOSA-N 381.545 5.568 30 20 GKED Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518733610 KEQLBMRJQMAQKJ-UHFFFAOYSA-N 394.434 5.097 30 20 GKED CCN(Cc1cccc(Br)c1)C(=O)Nc1ccc(C#N)c(Cl)c1 520170916 XILIPQOKADIUAY-UHFFFAOYSA-N 392.684 5.028 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)N(C)Cc3ccc(C#N)cc3)c2)C1 521081703 MHPGLBJKMMUQFS-MBSDFSHPSA-N 391.515 5.317 30 20 GKED CCOc1ccccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 521617229 VWJBMIOXDQQUSM-UHFFFAOYSA-N 376.387 5.141 30 20 GKED C[C@H](CC(=O)Nc1ccccc1SCCC#N)c1ccccc1C(F)(F)F 525048672 BJVCSRMFMFKYNX-CQSZACIVSA-N 392.446 5.843 30 20 GKED Cc1ccc(-c2c(C)sc3nc(CSCC4(C#N)CC4)nc(O)c23)cc1 539521179 RCHQPTZPDNTWPD-UHFFFAOYSA-N 381.526 5.218 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(C#N)c(F)c2)c2ccccc2OC)cc1 540706464 JWAYDQRKYUQKRZ-GYCJOSAFSA-N 390.458 5.155 30 20 GKED CC(C)c1cc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)n(-c2ccccc2)n1 570090250 JMKPTHZUCYMXCG-UHFFFAOYSA-N 399.498 5.064 30 20 GKED N#Cc1cccc(C2(N[C@H]3CCCc4nc(-c5ccccc5F)sc43)CC2)c1 582501952 MCJAZGIMEZXRSB-FQEVSTJZSA-N 389.499 5.477 30 20 GKED Cc1cc(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1F 590827931 XWKBNONTTWQRDF-IAZYJMLFSA-N 386.311 5.165 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](CCc2ccccc2)c2ccccc2)cc1 603918223 FRCFJSFJMFXWTE-QHCPKHFHSA-N 386.520 5.141 30 20 GKED CCCN(C(=O)CCc1ccc(C#N)cc1)[C@@H](C)c1ccccc1Br 603962646 NUYBZXSDMJLNHU-INIZCTEOSA-N 399.332 5.253 30 20 GKED Cc1nc(NC(=O)[C@@H](C)c2c(Cl)cccc2Cl)sc1SCC#N 604566996 CBMDMSWOONELEX-QMMMGPOBSA-N 386.329 5.116 30 20 GKED CC(C)(C)[C@@H](NC(=O)NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608918970 XNPIDZPQHGODQW-SFHVURJKSA-N 389.421 5.164 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)CC1CCCCC1 609078473 SLSBVBNDEWJIDQ-UHFFFAOYSA-N 391.515 5.490 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 609435219 YZKUFGBKNPXVOX-JAZQRGJZSA-N 397.588 5.903 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1Cl 609556082 YERDCVRAVWDRSX-UHFFFAOYSA-N 395.812 5.675 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609647409 MSGFRTGZMPLKIH-GCJKJVERSA-N 382.463 5.369 30 20 GKED Cc1occc1-c1nnc(S[C@@H](C#N)C2CCCCC2)n1Cc1ccccc1 609648709 RIYOUOAQMCHQNG-FQEVSTJZSA-N 392.528 5.459 30 20 GKED C[C@@H](SCC(=O)Nc1cc(Cl)c(Cl)cc1Cl)c1ccc(C#N)cc1 609825762 SBENLNNCWZOXFT-SNVBAGLBSA-N 399.730 5.951 30 20 GKED N#C[C@@H](C(=O)c1cc2ccc(F)cc2s1)c1nc2cc(Cl)ccc2s1 613403289 NDTXOZXXRPCQBA-LBPRGKRZSA-N 386.860 5.794 30 20 GKED CCCc1nc(C)c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)s1 613407151 JUSJRTJSVJPFAN-NSHDSACASA-N 375.906 5.157 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)cc1 618810732 FGMZPOVEKBVEQP-YCRPNKLZSA-N 379.529 5.106 30 20 GKED C[C@H](C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1c(F)cccc1F 619126761 MOYUGZOZMCUKLZ-VIFPVBQESA-N 391.302 5.238 30 20 GKED CSc1ccc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 642281938 STNFXERSYDQHLT-QGZVFWFLSA-N 398.940 5.984 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C1(C(F)(F)F)CC1 648494496 UKSGRLVDFUEGRL-UHFFFAOYSA-N 397.212 5.257 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1ccncc1)c1nc2cc(F)ccc2s1 670118759 MGFGBWSIWSTHGS-MRXNPFEDSA-N 389.411 5.113 30 20 GKED COc1ccccc1/C(C)=C\C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 727628673 VXAGNNUXGCRIMA-UIRWJGRMSA-N 388.492 5.407 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 731400249 MJILUHUNACHFQE-OAHLLOKOSA-N 377.469 5.603 30 20 GKED O=C1/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)CSc2ccccc21 733084190 XPWJCTKFRJNELP-JYRVWZFOSA-N 380.450 5.090 30 20 GKED C=CC[C@H](NC(=O)CCCc1ccc2c(c1)-c1ccccc1C2)c1ccncc1 734461012 UCZUZBUKEFVQDS-VWLOTQADSA-N 382.507 5.409 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743036988 PUSPOJZLTLGBKG-UHFFFAOYSA-N 387.439 5.280 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)Nc1cc(N2CCOC2=O)ccc1C 743240820 PNXLSOUKFHRRHL-MRXNPFEDSA-N 375.513 5.070 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3c(C(C)C)nn(C)c3Cl)n2)cc1 744030391 ANBIHGVLYWBQSD-AWEZNQCLSA-N 398.919 5.119 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1ccc(-c2ccncc2)cc1 745989961 IFVGBSNQRMXONW-KTKRTIGZSA-N 386.451 5.907 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1cccc(C(F)(F)F)c1 747194273 VWDZEZWZOZNGFY-BLMSOEDDSA-N 378.419 5.565 30 20 GKED CC(=NNCc1ccc(C(F)(F)F)cc1)c1sc(-c2cccnc2)nc1C 747611174 QCLXSWLPVHWMDN-UHFFFAOYSA-N 390.434 5.046 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C\C(=O)c2coc3ccccc23)cc1 747705757 QLEBEUPDNLQSGB-YFHOEESVSA-N 388.375 5.199 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc4ccccc4n3)n2)cc1 752165813 ZIKMTADDJHBUMK-DRUFCSCSSA-N 395.487 5.556 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3cc(F)ccc3F)cc2)oc1C(=O)O 757475310 RLPMITKHNTTYLT-WTKPLQERSA-N 398.361 5.040 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C 757852312 TURNEWWAFDPVDV-OAQYLSRUSA-N 395.503 5.157 30 20 GKED COc1cc(F)c(C(=O)/C=C\c2cnc(-c3ccc(C)cc3)s2)cc1OC 760269962 KOJLNFLOSOWPOS-HJWRWDBZSA-N 383.444 5.171 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C[C@@H](O)c3ccc(C#N)cc3)s2)cc1 763412453 XXLYCOVZEQXNDB-DYESRHJHSA-N 391.540 5.025 30 20 GKED N#C[C@@H](C(=O)C1Cc2ccccc2C1)c1nc(-c2ccc(Cl)cc2)cs1 763944111 NFMBAGHNSFWJSK-SFHVURJKSA-N 378.884 5.055 30 20 GKED C#CC[C@H](N[C@@H]1C[C@H](NC(=O)OC(C)(C)C)c2ccccc21)c1ccccc1 780732152 LKQDRSGZRCZNMB-BDTNDASRSA-N 376.500 5.051 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)[C@H](O)c2ccc(C#N)cc2)cc1 780966269 YLOYADLTFAVBPR-KSFYIVLOSA-N 388.492 5.084 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)cc1 781419721 DGDHVTCDFZVZFF-OAQYLSRUSA-N 384.376 5.595 30 20 GKED C=CC[C@H](N[C@@H](CC)c1ccc(Br)cc1Cl)c1ccncc1 783247490 YTAUUKSXSHCYQD-ROUUACIJSA-N 379.729 5.856 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](c1ccccc1)N1CCOC1=O 789721306 ZOCRXCZPSPNTLD-NRFANRHFSA-N 392.499 5.061 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C34CC(c5ccccc5)(C3)C4)n2)cc1 791772969 GXETWYHBZOIKHA-HLJPNSHOSA-N 384.504 5.417 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 793281848 NRVHMSRVAWKVIR-MHECFPHRSA-N 392.458 5.546 30 20 GKED Cc1c(C(=O)Nc2ccc(N3CCCC3)c(F)c2)sc2ccc(C#N)cc12 794241484 HPMVTHXHNHRBFS-UHFFFAOYSA-N 379.460 5.073 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cscc2C(F)(F)F)S1 811626106 BYTJFCWIPRNQJS-AWNIVKPZSA-N 382.432 5.275 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Nc3nc(C)cs3)cc2)cc1 813427852 NCPUOWFMDNHTJD-UHFFFAOYSA-N 376.485 5.064 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1nc2ccccc2s1 814301688 BIBUPNNFTNVTFR-RDJZCZTQSA-N 378.501 5.092 30 20 GKED CC(C)N(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)[C@H](C)c1ccsc1 817287146 KUEGFEWGAYWEJO-GDBMZVCRSA-N 383.542 5.006 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccc(C(F)(F)F)cc1 819439491 GLTGPBPBWKOPQZ-SUMWQHHRSA-N 380.435 5.245 30 20 GKED COc1cc(C(=O)/C=C/c2ncc(CSC)s2)ccc1SC(F)F 834420651 JPZLCNOMEXMKRU-GQCTYLIASA-N 387.498 5.226 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCC[C@@H]1CC1(Cl)Cl 844533418 ABMIRVRDKJEYDT-CHWSQXEVSA-N 386.348 5.034 30 20 GKED N#CC1(C(=O)Nc2cc3ccc(Br)cc3nc2Cl)CCCCC1 857667531 ZUWSWZYJEFYMLD-UHFFFAOYSA-N 392.684 5.063 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F 878676257 OZXLFGZZFYBAAV-MGPQQGTHSA-N 383.439 5.099 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3SCC#N)n2)c(C)c1 906059404 MWPCMGYHNFZQRG-UHFFFAOYSA-N 393.537 5.603 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)ccc1OCC#N 916141516 FHZMJLLCOVAWTO-QPEQYQDCSA-N 385.419 5.286 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc(Cl)cc3)n2)cc1 916627346 NRPAPNJLZLHBCS-PMQIGOLDSA-N 378.884 5.662 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2oc3c(ccc4ccccc43)c2C)c1 916897571 KMLQDYBVGKGPMS-FQEVSTJZSA-N 382.419 5.164 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2coc3ccc4ccccc4c23)cc1 916914135 WHUJPGGCELFLIN-NRFANRHFSA-N 396.446 5.038 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(CSC)cc2)cc1 916947222 HARNCCUKJJJVKC-QRWLVFNGSA-N 380.513 5.024 30 20 GKED Cc1c(NN=CC(c2ccc(F)cc2)c2ccc(F)cc2)cccc1C(=O)O 1776088117 QNQJMGXWNRDOGE-UHFFFAOYSA-N 380.394 5.201 30 20 GKED Cc1cccc(NN=Cc2cccc(OCc3ccccc3C(=O)O)c2)c1Cl 1776106848 YVNVFPQYGBREII-UHFFFAOYSA-N 394.858 5.372 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(Cc2ccc(Oc3ccccc3F)c(F)c2)C1 1776155504 SAPFMEHXFIFIOZ-QFIPXVFZSA-N 387.426 5.000 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccccc2)s1 1776354366 BOMCVRKBSOFUKV-PKNBQFBNSA-N 392.476 5.797 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)CC2 1776374780 ZHTKKFAJJIMQNF-DEDYPNTBSA-N 386.447 5.981 30 20 GKED CCCCCCCC/C=C\CCCCCCCC(=O)N1CCCC[C@@H]1C(=O)O 1776785238 JARCNTJKQPPSSM-MZMPXXGTSA-N 393.612 6.490 30 20 GKED CCCCCCCOc1ccc(CNCc2ccc(C(=O)O)c(C3CC3)n2)cc1 1776787037 NLWJOEJYLNALLO-UHFFFAOYSA-N 396.531 5.296 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2cccs2)c1 1776788110 SCQVTVDPCHJIID-LJQANCHMSA-N 375.534 5.403 30 20 GKED COc1cccc(Cl)c1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777380752 XUGMGBWQKCQGRH-KTKRTIGZSA-N 382.799 5.203 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CC4(CC4)c4ccccc4C3=O)s2)c1 1777684328 QWGLQKMKGWZEAM-LGMDPLHJSA-N 386.472 5.815 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)C3(F)CCCCC3)CCC2)cc1 1791250524 SYHJJQDZUXDYRJ-QGZVFWFLSA-N 386.511 5.005 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2ccc(C#N)c(Cl)c2)cc1 14685986 SMZJAZYTLYNJES-UHFFFAOYSA-N 381.888 5.133 30 20 GKED N#Cc1ccccc1NC(=O)c1oc2ccccc2c1CSCc1ccccc1 15311745 IEBNBEIMJOQZLC-UHFFFAOYSA-N 398.487 5.990 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)C(=O)c1ccc(C)c(C)c1 32788521 SJVOETFXIOWARR-SFHVURJKSA-N 391.540 5.035 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc(C)cs2)cc(Cl)c1OCCC(C)C 41520997 PHLYSJMDBUQFDC-AWEZNQCLSA-N 392.908 5.029 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 47375997 QSBBIYUEZGWIPB-AWEZNQCLSA-N 375.478 5.218 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccsc2)cc1Cl 58989382 OKCCPXCNKSJIJS-IBGZPJMESA-N 380.900 5.628 30 20 GKED COc1ccc2cc(/C=C/C(=O)c3ccc(OCc4nccn4C)cc3)ccc2c1 59324426 RPNGBUQZJZMAEE-UUILKARUSA-N 398.462 5.057 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc(-c2ccccc2F)s1 66802132 MYPKESVTDFTKPE-ZDUSSCGKSA-N 397.500 5.596 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1nccc2ccccc12 120341655 XSGAUXOFUSHREG-OAHLLOKOSA-N 393.537 5.217 30 20 GKED C[C@@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccc(C#N)cc1 154345125 SCTSXTBIGVQOFC-AUUYWEPGSA-N 377.488 5.549 30 20 GKED CCC(CC)n1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1C 156384443 HYPHHNMKCIOKPG-QGZVFWFLSA-N 378.501 5.166 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cncc(-c3cccc(C)c3)c2)cc1 158348068 IEIBKFUEMVNRHA-UHFFFAOYSA-N 385.467 5.016 30 20 GKED C[C@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc(C#N)cc1 173980836 OVQWJLLLTNWDBI-DLBZAZTESA-N 387.458 5.361 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(c4ccc(C(F)(F)F)cc4)CC3)cc2)CC1 181585410 ZDRVVTMGIWPOPB-UHFFFAOYSA-N 398.428 5.280 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H]2[C@H](CCCN2C2CC2)C1 191433570 MHFXQRWZWMYLLJ-KNQAVFIVSA-N 381.564 5.019 30 20 GKED CC1(C)OB(c2cccc(-c3cc4ccccc4c4ccccc34)c2)OC1(C)C 261507031 DPXMVZCIBKAXSS-UHFFFAOYSA-N 380.296 5.959 30 20 GKED N#CCCCOc1cccc(Nc2nc(-c3cccnc3)nc3ccccc23)c1 301120030 ZUBXWZALPJCQOC-UHFFFAOYSA-N 381.439 5.118 30 20 GKED COc1ccc2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2n1 303174472 JRZIMZWFWIVNFZ-UHFFFAOYSA-N 379.419 5.034 30 20 GKED Cc1ccccc1[C@H]1C[C@H](/N=C(/O)N2CCC(/N=C(/O)C3CCCCC3)CC2)C1 329787742 YZXTVVJCCWGIMF-XUTJKUGGSA-N 397.563 5.156 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2CCSc3ccc(F)cc32)CC1)C1CC1 329987902 GNOKHKLOHLBTHP-PUJMQQBBSA-N 376.497 5.244 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c2[C@@H]1C 410983737 KOHLAEFYTQSDNE-VHSXEESVSA-N 389.864 5.119 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@H](C)C3)c1C1CC1 411008838 IRJSCOMUXDYESX-STQMWFEESA-N 382.533 5.213 30 20 GKED CC(C)Cn1ncc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1-c1ccccc1 429197724 BNNNKZNCXJUYAE-NRFANRHFSA-N 394.478 5.244 30 20 GKED Cc1c(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)sc2ccc(C#N)cc12 429863495 CXKWEISRIMMVGO-CYBMUJFWSA-N 391.521 5.524 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1 431927886 VUNWJOIWSQSAOV-FCEUIQTBSA-N 379.479 5.196 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 432007474 NIINZAFFYGMIFM-GOSISDBHSA-N 393.874 5.497 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cnn(-c2cccc(Cl)c2)c1C(C)C 432838502 DZKJGXRLCOCBKB-UHFFFAOYSA-N 378.863 5.082 30 20 GKED N#CCCC[C@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 433021605 RMLXGPKUTPXUJF-BVZFJXPGSA-N 395.355 5.126 30 20 GKED CC(C)[C@H](CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccnc1 434172687 KDSOSORWYSWWEY-DEOSSOPVSA-N 399.494 5.110 30 20 GKED COc1ccc(C#N)cc1CN[C@H](c1ccccc1Cl)c1ccccc1OC 434886753 LGCFFSKPTGPFIY-HSZRJFAPSA-N 392.886 5.108 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1 435194386 SIYIFQYWLKRRRE-UHFFFAOYSA-N 391.515 5.067 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cc(Br)ccc2Cl)cc1C#N 435352767 HJEYWSMWEDMVKX-UHFFFAOYSA-N 393.668 5.014 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)[C@H](C)c2ccc3ccccc3c2)c1C 439748771 VFZKWVWEGRCCLD-QGZVFWFLSA-N 394.478 5.256 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@H]4CCC[C@H]43)cc2F)c1 444389908 QYVDWUNLJAUCCM-WIYYLYMNSA-N 393.462 5.073 30 20 GKED Cc1nnc(Oc2cccc(OCc3cccc(C(F)(F)F)c3)c2)c(C#N)c1C 462893994 HTIRMQZXFYXVAR-UHFFFAOYSA-N 399.372 5.355 30 20 GKED O=C(c1c(F)cc(C(F)(F)F)cc1F)N(CC(F)F)c1ccc(F)cc1 464521846 PFOFLORZJRJAEH-UHFFFAOYSA-N 383.238 5.035 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 464985959 MQWBHRWFTIHOCO-QFIPXVFZSA-N 385.467 5.277 30 20 GKED CN(Cc1cc(Cl)cn1C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 467117150 PJKLCRBLPOGJAO-UHFFFAOYSA-N 394.862 5.006 30 20 GKED C[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(Cl)cn1 471152254 SEVNOFZEFJWMAY-CQSZACIVSA-N 393.899 5.249 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1ncc(-c2ccccc2)o1 471919976 QYQYSBREDZQZHB-GOSISDBHSA-N 375.472 5.191 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 473054392 CWMMHAXPGBVDGI-IEBWSBKVSA-N 387.405 5.318 30 20 GKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cc(F)c(Cl)cc1Cl 474188331 GYCBDWPLSKAZEK-TZMCWYRMSA-N 379.262 5.397 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1ccccc1C(F)(F)F 475554141 RAVBAUYPTZMBTN-UHFFFAOYSA-N 390.449 6.221 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCOc2c(Cl)cccc21 475555859 ZDFWPOJGHXJERK-LJQANCHMSA-N 384.907 5.837 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2c(F)cccc2F)CC1 475566983 VNJGGDOMQAVSIL-UHFFFAOYSA-N 398.497 6.228 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2ccc(F)cc2)nc1C 476122202 PXXVYUCLBQAYFC-UHFFFAOYSA-N 394.515 6.362 30 20 GKED CC[C@@H](CN(CC)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 482250933 AUDAGTNCBSCKCE-FQEVSTJZSA-N 399.494 5.401 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)C(C)(C)Oc1ccc(C#N)cc1 482376082 LKCQIIJHCXKQDF-UHFFFAOYSA-N 382.529 5.304 30 20 GKED N#C[C@H](C(=O)c1cccc(F)c1Sc1ccccc1)c1cnc2ccccc2n1 483235483 WZBVPMGSLOXDQF-KRWDZBQOSA-N 399.450 5.410 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc3cc(F)ccc3c2C)cc1 486197579 WVAWDQNUYRKQBQ-UHFFFAOYSA-N 382.460 5.308 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(Oc2cccc(Br)c2)cc1 486295577 WVPVKJYTTVCPKM-UHFFFAOYSA-N 399.288 5.007 30 20 GKED C=CCSc1ccccc1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1 486414705 XEZXDHOMJZFVEA-PZJWPPBQSA-N 394.584 5.090 30 20 GKED C=CCSc1ccccc1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 486414707 XEZXDHOMJZFVEA-TZIWHRDSSA-N 394.584 5.090 30 20 GKED C[C@@H](C(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 487455069 LYDJTGOBIYEYTR-KUHUBIRLSA-N 375.299 5.648 30 20 GKED N#Cc1ccsc1C(=O)Nc1nc(-c2cc(Cl)ccc2Cl)cs1 497989130 HHCLDEVSZRDXDN-UHFFFAOYSA-N 380.281 5.302 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 498143125 BIHHEQLMYOPGMM-MRVPVSSYSA-N 386.691 5.033 30 20 GKED C=CCC[C@H](NCCCC1(C#N)CCOCC1)c1ccc(C(F)(F)F)cc1 499609903 ZBSZJYHZVKDXCE-IBGZPJMESA-N 380.454 5.403 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C3(c4ccccc4)CC3)c2)cc1 501454641 YOSSMAPRQPHMDC-UHFFFAOYSA-N 382.463 5.002 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 504134717 GOBOOKIMHDUJRM-AOMKIAJQSA-N 389.886 5.361 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)Nc3ccc(CC#N)cc3)cc2)cs1 504166106 RJCZRWBSTRTIAR-CQSZACIVSA-N 376.485 5.067 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1ccc(OCC2CCOCC2)cc1 505017504 WXNMFUHMMWQHSY-UHFFFAOYSA-N 380.488 5.255 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H]3CCCOc4ccccc43)cc2)cc1 506631355 FJGVJEKHTJASAB-JOCHJYFZSA-N 399.450 5.386 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCc1cccc(F)c1 510535800 CKSSCCYVBFLALP-UHFFFAOYSA-N 389.430 5.162 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 513355767 XTPHYJJVSWWSTA-HSZRJFAPSA-N 392.478 5.610 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2OC)cc1 515102601 BAARFLAOCQCTKZ-UHFFFAOYSA-N 394.496 5.769 30 20 GKED C=CCOCC(=O)N(CC=C)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 520624645 SDRMKLJOJKADAD-UHFFFAOYSA-N 390.508 5.199 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2Cc2ccccc2)c(F)c1 525630137 ZUOVRVLQTZXXJS-UHFFFAOYSA-N 376.456 5.019 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3oc(CC(C)C)nc3C)n2)cc1 530549430 LZYJGQUKADDCIB-MRXNPFEDSA-N 379.485 5.104 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1Br 535293268 PLJJMQFTQNVAPN-GFCCVEGCSA-N 389.318 5.262 30 20 GKED N#CCC[C@@H](NC(=O)c1cc2ccccc2cc1OC(F)F)c1ccccc1 535597918 JCSMHUTWKYKHLB-LJQANCHMSA-N 380.394 5.216 30 20 GKED C=CCC[C@@H](NCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccccc1 538256225 GJNUYLKRUOJMHK-GOSISDBHSA-N 387.405 5.553 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 543017934 QPTXLGGGXNRSOW-QZTJIDSGSA-N 384.483 5.084 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)c1 552116121 AKSHNPGWMBPIBQ-UHFFFAOYSA-N 391.323 5.262 30 20 GKED CCN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@H]1CCOC(C)(C)C1 558451660 ANWMELFQEYRNAJ-IBGZPJMESA-N 393.487 5.162 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 558504875 ZOCSLXSNYWOXBZ-HXOBKFHXSA-N 398.466 5.361 30 20 GKED COc1ccccc1[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccccn1 564809756 WJHZVEXCYLHYEQ-DHLKQENFSA-N 383.495 5.109 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2sc(Cl)cc2C1 567586294 PLLKNBGMYBWKOK-LBPRGKRZSA-N 391.949 5.243 30 20 GKED N#Cc1csc(/C=C(\c2nc3ccccc3[nH]2)c2nc3ccccc3s2)n1 578567061 YFEHKQZWFJYETE-UKTHLTGXSA-N 385.477 5.090 30 20 GKED N#Cc1ccc(CNC23CCC(C(F)(F)F)(CC2)CC3)c(C(F)(F)F)c1 581916234 NTDRQYTYSRNEGK-UHFFFAOYSA-N 376.344 5.322 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(C4CC4)[nH]c3C3CC3)cn2)cc1 599073443 DGSFGMBASBKUED-UHFFFAOYSA-N 384.439 5.081 30 20 GKED N#C[C@H](C(=O)c1cnc2ccsc2c1)c1nc(-c2c(F)cccc2F)cs1 608553030 KWDAPPRALOCZDM-LLVKDONJSA-N 397.431 5.188 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)NCc3ccc(C#N)cc3)cc2)c1 609042879 DVPSGNRSBHFYEP-IBGZPJMESA-N 399.494 5.006 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1sc2cccc(Cl)c2c1Cl 609359221 CVMQOSMPGNVLIE-UHFFFAOYSA-N 392.311 5.889 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(Br)cc1)c1cccc(C#N)c1 612574918 YDGFYVVFDHALKX-SJKOYZFVSA-N 397.238 5.665 30 20 GKED Cc1ccsc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 613346927 SKRHVUOLRXPAHG-GFCCVEGCSA-N 393.320 5.977 30 20 GKED CC(F)(F)c1ccc(C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 644792308 RIUXDVYSTWPDHH-VXGBXAGGSA-N 389.286 5.001 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(CCC)[C@@H]2CCc3ccccc32)c1=S 726588254 GVPHVPCSKLBXTN-LJQANCHMSA-N 394.544 5.217 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(N=Cc2cc(Br)ccc2O)cc1 729149590 LVSGOJBPDJROMK-UHFFFAOYSA-N 391.265 5.252 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)Nc1cccc(OCC#N)c1 729557128 XMQBDAFTCJBOLM-UHFFFAOYSA-N 385.467 5.132 30 20 GKED COc1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)cc1[N+](=O)[O-] 730149206 CTTWFASMOBJKMF-JYRVWZFOSA-N 391.395 5.131 30 20 GKED C/C(=C/C(=O)Nc1c(C)c(C)nn1-c1ccc(C#N)cc1)c1ccccc1Cl 739669006 MTMVCEFYKMTBRG-OWBHPGMISA-N 390.874 5.056 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=NNc2cc(Cl)nc(C)n2)CCC3)cc1 741765222 AHAUQJHSIOYMGJ-UHFFFAOYSA-N 383.908 5.023 30 20 GKED C[C@H](Oc1ccc(F)c(F)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743629446 QHYPAYITWWAHQH-YWZLYKJASA-N 392.405 5.026 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(Cl)c1 744061345 KDZFAEZNVVDVQL-FZKQIMNGSA-N 391.883 5.315 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2c(F)cccc2Cl)cc1 746660205 NYHHAYWIEYFAAY-GOSISDBHSA-N 393.849 5.456 30 20 GKED C#CC[C@H](NCc1csc(-c2cccc(Br)c2)n1)c1ccccc1 756995406 HSPIXTDGEHAFTQ-IBGZPJMESA-N 397.341 5.427 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCOc3ccc(C(C)C)cc32)c1 772982320 CRJIIUQTYNLIIP-OFNKIYASSA-N 378.516 5.494 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccc(C)o2)C2CCCC2)ccc1OC 775631704 KUWDISUXXZWWFC-AUSIDOKSSA-N 382.504 5.299 30 20 GKED Cc1ccc(-c2n[nH]cc2CNc2ccc(OCc3cccc(C#N)c3)cc2)o1 779594644 LVZOAXNZSXPVIB-UHFFFAOYSA-N 384.439 5.041 30 20 GKED C=CCN(Cc1ccccc1)C(=O)CCc1ccccc1NC(=O)OC(C)(C)C 790616687 CKLYZZBAPXLADS-UHFFFAOYSA-N 394.515 5.181 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)c1ccc(C(C)(C)C#N)cc1 793770367 ADHBYUIJPDOQGQ-LJQANCHMSA-N 398.506 5.597 30 20 GKED CCOC(=O)/C(=C\c1ccc(C#N)s1)c1nc(-c2ccc(C)cc2)cs1 797405550 ACDPHPMEILRDQE-YVLHZVERSA-N 380.494 5.155 30 20 GKED N#C[C@H](C(=O)C1(Cc2cccs2)CCCCC1)c1cc(C(F)(F)F)ccn1 813213363 LBSQCNGNHIXPLH-INIZCTEOSA-N 392.446 5.531 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21)c1ccccc1 814311679 IGFXBTIRLSTMCR-RTWAWAEBSA-N 389.499 5.167 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1cc(Cl)sc1Cl 819842283 MHVNPOLOZRSLKR-CMDGGOBGSA-N 390.291 5.925 30 20 GKED CN(C(=O)c1cccs1)c1ccccc1C(=O)OCCC1(C#N)CCCCC1 840069055 YRIUNJAAKSIQSZ-UHFFFAOYSA-N 396.512 5.046 30 20 GKED CC(C)c1ccc(NC(=O)N(C)C[C@H](O)c2cccc(C#N)c2)c(C(C)C)c1 844499209 LMAXGNLUXMDIOY-QFIPXVFZSA-N 379.504 5.002 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(C2CCCCCC2)no1 848705294 OGXPMBXLQBBWAA-INIZCTEOSA-N 376.501 5.157 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)c3ccccc3SCC#N)n2)cc1C 900845265 ZKQVOVDYGZJGDJ-UHFFFAOYSA-N 393.537 5.603 30 20 GKED CC(C)c1ccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915124580 QHKBPPACXROOQN-QHCPKHFHSA-N 385.536 6.274 30 20 GKED COc1cc(/C=C\C(=O)c2cc(F)ccc2F)ccc1OCc1ccccc1 916135028 ZCKRPNPKEHKFEA-XFFZJAGNSA-N 380.390 5.449 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2csc(-c3ccc(C)cc3)n2)cc1 918714264 REVXBLMYCZPPKQ-XFXZXTDPSA-N 379.481 5.040 30 20 GKED Cn1c(-c2ccccc2)c(C=NNc2ccc(F)c(C(=O)O)c2)c2ccccc21 1776061832 QCNCUFRPDOAIQA-UHFFFAOYSA-N 387.414 5.129 30 20 GKED C=C(C)COc1cc(/C=C/c2nc3ccccc3c(C(=O)O)c2C)ccc1OC 1776140118 VQKOGTVJSOSGSA-PKNBQFBNSA-N 389.451 5.375 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776950909 NHYZBGLCMVGQOR-BNCCVWRVSA-N 388.488 6.060 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@H]3CCC5)s2)c1 1777684383 ZFAQNWNTJRLLJE-YNGKYYQNSA-N 386.472 5.813 30 20 GKED Cc1sc2nc(SCc3cccc(C#N)c3)n(C3CCCC3)c(=O)c2c1C 24967937 MDSGUWFAJWZMTL-UHFFFAOYSA-N 395.553 5.354 30 20 GKED C=CCn1c(SCCCC(=O)c2ccc(F)cc2)nnc1-c1ccccc1 57508706 AMLBAVXBWQUPBB-UHFFFAOYSA-N 381.476 5.025 30 20 GKED O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 60190731 RIUOWRPTZXWVAO-UHFFFAOYSA-N 396.218 5.024 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(COCc2ccco2)c1 62400295 JMCQWNAQQPYTMX-UHFFFAOYSA-N 390.483 5.259 30 20 GKED C=CCOc1c(Br)cc(CNC(C)(C)c2ccccc2)cc1OC 65275162 YHOGGJRUPPNLFN-UHFFFAOYSA-N 390.321 5.047 30 20 GKED C[C@H](C/C(O)=N/S(=O)(=O)/C=C/c1ccccc1)c1ccc(C(F)(F)F)cc1 66504046 NGFYXSLZYIXKAJ-GCZGRYASSA-N 397.418 5.156 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)Nc3ccc(CC#N)cc3)s2)cc1 107806276 GKCNJUFTXKBRFZ-MRXNPFEDSA-N 390.512 5.376 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1cccs1 115910015 HZYDGFNFIWENLZ-NSHDSACASA-N 388.464 5.304 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1cc(C(F)(F)F)ccc1F 127314962 GEPRXCDIPXHUTI-UHFFFAOYSA-N 379.275 5.592 30 20 GKED Cc1cccc(CN(Cc2cccc(C)n2)Cc2ccccc2C(C)(C)C#N)n1 135277940 RIVFUQMPBZNPAD-UHFFFAOYSA-N 384.527 5.097 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1oc2ccccc2c1CSc1nc(C)cs1 160447632 LFQNWVWSKKLGND-CYBMUJFWSA-N 399.541 5.112 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 175563705 WFSFENABAISOQJ-ZDUSSCGKSA-N 396.368 5.049 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)Nc2ccc(F)cc2OCC#N)c1 179738767 IDDMKMJPYXGESI-UHFFFAOYSA-N 384.476 5.324 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(-n2cncn2)cc1 191415397 RASKTPIICGXHEQ-KRWDZBQOSA-N 389.503 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1Cn1cccn1 191438003 QEPPRWKOCSVDAX-UHFFFAOYSA-N 388.515 5.105 30 20 GKED N#Cc1cc(F)ccc1NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 301424620 TUMCEEVTGITHSB-UHFFFAOYSA-N 382.442 5.221 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(Br)cc2Cl)c1 303189587 MGRZHZFRFHJFLE-UHFFFAOYSA-N 380.669 5.310 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(c2cccc(Cl)c2)CC1 303877350 OBXHJFUWDFDOAO-AWEZNQCLSA-N 385.920 5.403 30 20 GKED OC1=Nc2ccccc2[C@@H]1C1CCN(C/C(O)=N/CCC2CCCCC2)CC1 328701798 NMOTURLLZZHAKH-QFIPXVFZSA-N 383.536 5.011 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H](c1ccc(F)cc1)C1CCC1 328808062 LSPAEFBFJNYMBQ-AEFFLSMTSA-N 388.508 5.331 30 20 GKED CC(C)[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1nc(-c2ccncc2)no1 328985875 GUDVYHZMEYIZFZ-AITUJVMLSA-N 382.508 5.392 30 20 GKED Cc1nc2c(c(C(F)(F)F)n1)C[C@H](/C(O)=N/CC(C)(C)C1=CCCCC1)CC2 330010985 HMGLAIICALDEEY-CQSZACIVSA-N 395.469 5.392 30 20 GKED Cc1nc2c(s1)[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)CCC2 371618636 JSHYJCFGJXSKNO-WBMJQRKESA-N 386.546 5.045 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 410390194 HFDWLFBYEAGTHB-UHFFFAOYSA-N 385.382 5.297 30 20 GKED C[C@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1ccc(C#N)cc1 425999635 DPVIANDJWDPRFT-SFHVURJKSA-N 396.494 5.055 30 20 GKED N#CCCC[C@@H](NCC(=O)N[C@H](c1ccccc1)C1CCCC1)c1ccccc1 433020657 OIZJXWGJFPEXLJ-ILBGXUMGSA-N 389.543 5.059 30 20 GKED CCOc1ccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)co2)cc1 433027481 LFTAIPXOHVBBTR-JOCHJYFZSA-N 375.472 5.265 30 20 GKED CN(Cc1csc2ccccc12)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639344 WCFCEUIPTQTVBL-UHFFFAOYSA-N 389.402 5.456 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cccc(Cl)c1Cl 438860259 RYHOGMBLGLVZBD-GUYCJALGSA-N 376.287 5.399 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCC(c4cccc5ccccc45)CC3)o2)c1 441522793 HGHCWJLANCACQP-UHFFFAOYSA-N 394.478 5.141 30 20 GKED C=CCC[C@@H](NC(=O)N(C)[C@@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 441533552 IGDPMQVGJIPCEN-HNAYVOBHSA-N 391.437 5.510 30 20 GKED N#C[C@H](C(=O)c1noc2c1CCCCC2)c1nc(-c2ccc(Cl)cc2)cs1 444456950 HKPWNMIVJAIJOC-OAHLLOKOSA-N 397.887 5.210 30 20 GKED N#Cc1ccc(CN(C(=O)C2(Cc3ccc(C(F)(F)F)cc3)CC2)C2CC2)cc1 445549528 NYCMFBBNJODQSF-UHFFFAOYSA-N 398.428 5.091 30 20 GKED CC[C@H](NCc1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccc(C#N)cc1 447531271 QODYNYVONIOJOL-QHCPKHFHSA-N 387.458 5.191 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N1CCC[C@H]1c1ccc(C(C)C)cc1 460957686 ITAIKVGQWPWPNU-LEWJYISDSA-N 380.536 5.171 30 20 GKED Cc1oc2ccccc2c1CCNC(=O)Nc1ccccc1S[C@H](C)CC#N 467335275 KCEQRYLBVXPQCN-OAHLLOKOSA-N 393.512 5.500 30 20 GKED CC(C)c1nc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cs1 469267809 UIQPYZMELLZBCJ-OAHLLOKOSA-N 382.533 5.023 30 20 GKED CSc1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469274283 RMKOVPULDFCSRM-MRXNPFEDSA-N 379.529 5.165 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)Nc1cccc(OCCCC#N)c1 473083539 TUFFXOMCONNWNC-UHFFFAOYSA-N 377.366 5.340 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)c2c1 473586952 DXTPUCFKNUUZLT-DHLKQENFSA-N 395.506 5.333 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccc(F)cc1 476040127 IIWHSDJYIFAVOD-MRXNPFEDSA-N 388.320 5.099 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)cc1 476410570 PAVVGIDNDISAGF-LJQANCHMSA-N 399.441 5.288 30 20 GKED C=C(C)[C@@H](NCc1cc(OC)c(OC)cc1SC)c1ccc(F)c(F)c1 479404636 DLEVJVNZGIRABU-HXUWFJFHSA-N 379.472 5.111 30 20 GKED Cc1c([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccccc12 484148561 UOSBHPJDSQRISI-ZBFHGGJFSA-N 393.512 6.018 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(F)cc(Br)c1 484747965 BKMRFLMFJSCQSF-LBPRGKRZSA-N 379.298 5.452 30 20 GKED C=CCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 487022401 ASRVPHXKPQPJLF-UHFFFAOYSA-N 399.516 5.060 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@@H]3C[C@H]3c3ccccc3Cl)s2)cc1 487392145 ZHLRVIKXVYEQFS-ZWKOTPCHSA-N 393.899 5.001 30 20 GKED N#Cc1cccc(NC(=O)c2oc3ccccc3c2CSc2cccs2)c1 493576389 GBUDVIYTBKEPSV-UHFFFAOYSA-N 390.489 5.911 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccccc1Cl 499951496 DTBCAUYHDOHMQS-IOASZLSFSA-N 379.674 5.131 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)Nc1cccc(OCCCC#N)c1 502663645 XATGRKOBSOVVGM-UHFFFAOYSA-N 385.895 5.791 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@H]2CCCC[C@H]2C(F)(F)F)cc1 509657087 ICXJOWYIXZGOII-ZWKOTPCHSA-N 388.389 5.658 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1 510268291 FSPVVZDPALZDGA-VJBMBRPKSA-N 378.516 5.161 30 20 GKED COc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc(OC)c1C(C)C 511034038 ZLYQLVGJNOPXBU-HNNXBMFYSA-N 398.528 5.331 30 20 GKED C=CCOc1c(Br)cc(CNc2cccc(SC)c2)cc1OC 513568217 QMGKGWIGSBCAHL-UHFFFAOYSA-N 394.334 5.357 30 20 GKED C=CCC[C@@H](NC(=O)C[C@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 514060713 ROLMTQFKFIQMIQ-SCLBCKFNSA-N 394.437 5.628 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Sc1nc2ccc(Cl)cc2o1 514525058 QIXJATDMLQTHLX-LBPRGKRZSA-N 392.933 5.238 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NCc3cccc(O)c3)cc2Cl)cc1 515795739 DTEBZNOCNHYMGF-UHFFFAOYSA-N 393.830 5.031 30 20 GKED CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518256510 YKFZFPYGRVQBRE-UHFFFAOYSA-N 389.430 5.544 30 20 GKED C[C@H](c1ccccc1)N(C)C(=O)C1(C)CCN(c2ccc(Cl)cc2C#N)CC1 519728282 PAHRKOWJABKTDG-QGZVFWFLSA-N 395.934 5.038 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(F)cc2)CCCCC1 521733284 DIUWPPNRUMXROM-QGZVFWFLSA-N 396.531 5.918 30 20 GKED C[C@H](C#N)CN(C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)C1CC1 533601770 TXANNPYCXXHBGT-MRXNPFEDSA-N 389.474 5.057 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C)c1ccccc1 534640261 DTDASTWLMODYMZ-VQTJNVASSA-N 390.527 5.308 30 20 GKED CCN(C(=O)c1coc(-c2ccccc2Cl)n1)c1ccc(C#N)c(Cl)c1 537359344 WNBZPYUGWDWGMU-UHFFFAOYSA-N 386.238 5.187 30 20 GKED Cc1ccc(-c2noc(CN[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)n2)cc1 542016866 LALSYKLWAOXHCN-GOSISDBHSA-N 394.478 5.435 30 20 GKED C[C@H]1COc2ccccc2CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 543852288 NXSKJHFUBYFPRW-KRWDZBQOSA-N 399.450 5.166 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N(C2CC2)C2(C#N)CCC2)cc1Cl 551307071 AMUSCKUJDIHRFS-UHFFFAOYSA-N 391.858 5.055 30 20 GKED CC1(C(=O)N2CCC3(CCCC3)CC2)CCN(c2ccc(Cl)cc2C#N)CC1 557557560 LYBQDNLRROOTGS-UHFFFAOYSA-N 399.966 5.001 30 20 GKED N#CCC1CCN(C(=O)Nc2cccc(-c3ccc(Br)cc3)c2)CC1 562284730 HXNVIARYCKJCQD-UHFFFAOYSA-N 398.304 5.274 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1F 577184571 DYUCUSLQMYUHIK-QFIPXVFZSA-N 380.419 5.039 30 20 GKED Cc1ccc2sc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1 581163698 VBPDGSPHEHDPBD-ZDUSSCGKSA-N 381.407 5.445 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N(Cc1ccco1)c1ccccc1C#N 582568000 KQESTZYMNAJVJL-GOSISDBHSA-N 395.462 5.111 30 20 GKED N#C[C@H](NC(=O)c1ccc(C(F)(F)F)s1)c1cccc(Cl)c1Cl 586776752 MTPMHFWBWXYHGQ-VIFPVBQESA-N 379.190 5.068 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1Cl 586794310 WJNIXKDAJHBLTR-GOSISDBHSA-N 380.797 5.351 30 20 GKED C[C@H](NC(=O)CCCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 588165215 HAORIGVHUIVMQL-AWEZNQCLSA-N 394.462 6.085 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc(C(C)(C)C)n3)n2)cc1 588348878 CLTFZZCMPFMNMY-AWEZNQCLSA-N 381.526 5.363 30 20 GKED CC1(C(=O)Nc2ccc(Sc3ccc(Cl)cc3C#N)cc2)CCOCC1 590887431 WNFVOBDURNQKAD-UHFFFAOYSA-N 386.904 5.118 30 20 GKED Cc1ccc(CN(CC2CC2)C(=O)Nc2ccccc2S[C@H](C)CC#N)cn1 592228696 DUMWRXLUKPQKIL-QGZVFWFLSA-N 394.544 5.228 30 20 GKED CCC(O)(CC)CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 599731443 HGNKQLVZYZLGDI-IBGZPJMESA-N 399.922 5.010 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 603968374 NAHXHMLJEPCBNB-UHFFFAOYSA-N 384.913 5.914 30 20 GKED C=CCCCCCN(C)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606971799 NTLNXLQHHBVYBH-WDNDVIMCSA-N 388.396 5.284 30 20 GKED Cc1ccc(COc2ccc(C[C@@H](C)NC(=O)c3cccc(CC#N)c3)cc2)cc1 608901504 YCLPENMBVVEBIM-HXUWFJFHSA-N 398.506 5.001 30 20 GKED Cc1cc(CNC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c2[nH]c(C)c(C)c2c1 608920174 CDGANELTNAIDOJ-UHFFFAOYSA-N 388.515 5.085 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(Br)cc2Cl)c1C#N 609031422 MMTOBGJXZGKGRH-UHFFFAOYSA-N 383.698 5.159 30 20 GKED CCCN(C(=O)c1csc(Br)c1)c1cc(Cl)ccc1C#N 609286518 NGFGVGHHZJTYHB-UHFFFAOYSA-N 383.698 5.092 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(-c2ccccc2)o1 609398851 YRJTYUGYVASLQV-INIZCTEOSA-N 391.496 5.520 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434344 WUFYTSNSGHHSMB-HNNXBMFYSA-N 377.469 5.165 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](CC)c1ccccc1 609435018 KURKXRVWXHHLLI-NQIIRXRSSA-N 395.572 6.476 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](C)c2ccsc2)cc1 609970089 UNDQUQQKEYKQSL-AWEZNQCLSA-N 378.453 5.163 30 20 GKED C[C@@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1cccc(C#N)c1 610408422 WSQOBLKDBIKJKL-VLIAUNLRSA-N 393.537 5.100 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)oc2c(F)cccc12 613403788 TZHVJJUEHLFVMJ-GFCCVEGCSA-N 384.819 5.634 30 20 GKED O=C(CCc1cccc(F)c1F)NC(CCC(F)(F)F)CCC(F)(F)F 619124927 HYLOPWRACZZUNL-UHFFFAOYSA-N 391.302 5.067 30 20 GKED C=CCN(C(=O)[C@@H](C)Oc1ccc(C)cc1)c1nc(-c2ccccc2)cs1 641900254 AYZIDICYELMZTB-QGZVFWFLSA-N 378.497 5.105 30 20 GKED C[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cc2n(n1)CCC2 647323435 IXYUMPMEPRKCDF-JTQLQIEISA-N 395.322 5.292 30 20 GKED O=C(/C=C/c1ccccc1-n1cncn1)c1ccc(Oc2ccccc2)c(F)c1 726743430 GYIULVUNBAOLHF-ZRDIBKRKSA-N 385.398 5.095 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@@H]1C[C@H](C)CC(C)(C)C1 727627743 QHHBNAKJWWWBJT-ABSDTBQOSA-N 382.548 5.311 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730422028 SBGKVCMAUHZOMI-DYVFJYSZSA-N 382.460 5.203 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC(C)(C)C)c2ccccc2)c1 733808027 YKHNZAPHRMBGTP-IFMALSPDSA-N 393.531 5.344 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)OCc1cc(Cl)ccc1OCC#N 735343581 BISHZQUAVZRKSC-LBPRGKRZSA-N 396.295 5.120 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccccc3N3CCCCC3)c2)s1 740013746 KJVPQTRUJCVCLQ-UHFFFAOYSA-N 387.552 5.567 30 20 GKED CCc1ccc(-c2ccc(C(=O)NCc3cccc(O[C@H](C#N)CC)c3)o2)cc1 742675356 BOVCJWNTGGIUHG-FQEVSTJZSA-N 388.467 5.120 30 20 GKED CSC(C)(C)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 743103938 DJMUEOSMVIQIRA-KRWDZBQOSA-N 387.936 5.259 30 20 GKED O=C(O)CCOc1cccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)c1 746683777 GBMSCTGZMDTQFD-WDZFZDKYSA-N 378.449 5.165 30 20 GKED COc1ccc(C=NN(Cc2ccccc2)c2ccccc2)cc1OCCCC#N 747357123 KINTTYBFICHTOP-UHFFFAOYSA-N 399.494 5.418 30 20 GKED Cc1nc2sccn2c1C=NO[C@H](C)c1ncc(-c2ccc(Cl)cc2)o1 752781404 IOYXLECFNRDVFU-GFCCVEGCSA-N 386.864 5.124 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(C(F)(F)F)ccc2Cl)c1 753853684 KSXUEVDBOIUMPF-MRXNPFEDSA-N 382.813 5.330 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1c[nH]c2ccc(Br)cc12 754711929 DFQPUDUPTVGENC-UHFFFAOYSA-N 383.167 5.362 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](Cc2nccn2C)c2ccccc2)cc1 766297680 CCVRSBGVFGNPIF-GCJKJVERSA-N 395.934 5.186 30 20 GKED N#CCCCOc1cccc(CN2CCCCC[C@H]2C[C@@H](O)c2cccs2)c1 770291014 GMJZUTKMBPEGJF-RBBKRZOGSA-N 398.572 5.299 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(Br)ccc2OC(C)C)c1 771107567 CWJQBCPOWCZWHI-UHFFFAOYSA-N 389.318 5.027 30 20 GKED N#Cc1ccc(F)c(CN[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c1 773022181 BSKUQVUKVPBULK-GOSISDBHSA-N 381.451 5.127 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3c(C4CC4)nc4sccn34)c2)s1 774816572 RCOFGEHFZSYZOD-UHFFFAOYSA-N 390.537 5.163 30 20 GKED C#CC[C@@H](NCc1cc(-c2c(OC)ccc3ccccc23)no1)c1ccccc1 778236974 PCVNWXCAWHWVDJ-JOCHJYFZSA-N 382.463 5.358 30 20 GKED Cc1ccc(C(F)(F)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 779838664 GKQCLYDKWXLSJZ-UHFFFAOYSA-N 393.393 5.093 30 20 GKED CC(CCc1n[nH]c2ccccc12)=NNc1ncc(C(F)(F)F)cc1Cl 782220084 XWGDMHCFKBDUTM-UHFFFAOYSA-N 381.789 5.051 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(-c2cccc(C#N)c2)cc1 782556962 WEJHBJVCHSRJKO-QGZVFWFLSA-N 396.450 5.010 30 20 GKED CC(C)(C#N)CCCCN1CCC(O)(c2ccc(-c3ccccc3)cc2)CC1 785970125 SILVVVILPGMVGA-UHFFFAOYSA-N 376.544 5.357 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1c[nH]c2ccccc12 786305546 GUSCVVTXDWVYLU-OXQOHEQNSA-N 395.462 5.162 30 20 GKED COc1ccc(-c2cc(NCc3ccc(C#N)s3)ccc2OC(F)F)cc1 798089586 LIRWNWNTZWDRDY-UHFFFAOYSA-N 386.423 5.509 30 20 GKED C[C@@H](NCc1cccc2c1CCCN2C(=O)OC(C)(C)C)c1cccc(C#N)c1 806180261 ALIPVADUMUMQLW-QGZVFWFLSA-N 391.515 5.097 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(-c3ccccc3)c2)c1 806761207 BPESAEYODPJYMQ-JOCHJYFZSA-N 385.467 5.356 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccnc(C(F)(F)F)c3)c2)cc1 808371288 LGQFOYRFZFLXBM-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC(C)n1c(C(F)(F)F)nc2cc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)ccc21 809085939 RZVXKCKODJEJIR-OKILXGFUSA-N 393.409 5.123 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1cc(C(F)(F)F)ccn1 813211647 NTTDOGNJXRXWJA-ZNMIVQPWSA-N 399.199 5.387 30 20 GKED COCc1ccccc1/C=C(C)/C=C1/SC(=Nc2c(C)cccc2C)NC1=O 814188110 WGGOQUKCJPPUAD-HIBZGYDWSA-N 392.524 5.288 30 20 GKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1O 815635588 GDXHXAKJKGWGQI-MSOLQXFVSA-N 377.315 6.175 30 20 GKED CC(C)[C@H]1N(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC12CC=CC2 831230093 CSYAORVGQXWAOZ-XZOQPEGZSA-N 385.511 5.551 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@]3(C2)CC3(F)F)cc1 844524730 ZYVSHUDSDVROER-HXUWFJFHSA-N 383.398 5.004 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](Cc2ccccc2)c2nccn2C)cc1 846207215 LUZHLIMTILFABY-AVRDEDQJSA-N 395.934 5.186 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC[C@@H]3CC3(Cl)Cl)n2)cc1 850763271 XTBQBOYRKYHOPP-ZIAGYGMSSA-N 379.312 5.269 30 20 GKED CCCCCCCCC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914744641 YEGNJJFCFTYPPE-CHWSQXEVSA-N 375.397 5.763 30 20 GKED O=C(/C=C\c1csc(Br)c1)c1sccc1Br 915115087 WCIGHRMFABDMFM-UPHRSURJSA-N 378.110 5.231 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915351819 GZLKKBIWIHTYCQ-LJQANCHMSA-N 395.915 5.721 30 20 GKED N#C[C@H](C(=O)CCSc1ccccc1F)c1nc2cc(Cl)ccc2s1 917046125 FXSPHZHEGXOCMJ-GFCCVEGCSA-N 390.892 5.447 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc4ccccc34)n2)cc1 920138035 ACNIRPXRPJWTCI-NRFANRHFSA-N 398.487 5.391 30 20 GKED CCc1ccccc1Oc1ccc(C=NNc2ccc(C(=O)O)nc2)c(Cl)c1 1776071683 NVQRARXLYNSMIR-UHFFFAOYSA-N 395.846 5.234 30 20 GKED O=C(/C=C/c1cc(F)c(C(=O)O)c(F)c1)c1ccccc1OCc1ccccc1 1776126272 HWKWUQLMIOIDTH-ZHACJKMWSA-N 394.373 5.138 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN([C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 1776154589 MFQGWAFRPVBRSL-RBBKRZOGSA-N 387.882 5.311 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C(=O)O)c1ccc(Cl)c(Cl)c1 1776180260 MAIWUVPYAFUCFW-OAHLLOKOSA-N 390.719 5.522 30 20 GKED C[C@H]1C/C(=C/c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2sccc21 1776589747 SRSCTQQZPKJRHU-WZMONFQBSA-N 394.448 5.392 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2cccc(CCC(=O)O)c2)cc1 1776787567 YFFLOQJYFOMQDA-UHFFFAOYSA-N 399.556 6.019 30 20 GKED CCc1cc(OC)ccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776963400 RQJUKLODNHEXHW-PKNBQFBNSA-N 376.408 5.112 30 20 GKED COc1c(C)cc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1Cl 1777252748 MSLUIUNZEHRPQC-HYXAFXHYSA-N 386.856 5.466 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)cc1 1777472333 YTSCBUQDNRFZIJ-OTYYAQKOSA-N 398.458 5.568 30 20 GKED O=C1/C(=C/c2cccc(OCc3ccccc3)c2)C[C@H](C(=O)O)c2ccccc21 1777698378 KCEWMACXPYSJOI-FOYGFLCZSA-N 384.431 5.104 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cc(OC)c1OC 23611743 BTOMAARFIXVWKT-IZZDOVSWSA-N 380.465 5.337 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 29779976 PSDRVJITUIZLFG-HNNXBMFYSA-N 399.475 5.241 30 20 GKED CCCCCc1nnc(/N=C(\O)c2sc(Cc3ccccc3)nc2C)s1 30597364 QXBRNIWJDPRYAI-UHFFFAOYSA-N 386.546 5.263 30 20 GKED COc1ccc(Cl)c(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 64832081 IPKVBPNNNHHFSH-UHFFFAOYSA-N 394.883 5.624 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1S[C@H](C)CC#N 66801961 SRYXLPJQUYEFBE-OAHLLOKOSA-N 391.496 5.226 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)n1 106982333 GCDCNIGLENVBAR-ZDUSSCGKSA-N 390.436 5.272 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)CCC)ccc1Cl 119805100 VOANYPDWSKPVSG-UHFFFAOYSA-N 385.895 5.299 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 120252198 RWHYQKXHDHNULJ-ZDUSSCGKSA-N 377.366 5.264 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2ccc(O)cc2F)cc1Cl 124456702 SPSJSVOYEZOBCY-UHFFFAOYSA-N 382.778 5.101 30 20 GKED Cc1cncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 132021532 CJRXENONIJQJAA-CQSZACIVSA-N 388.279 5.310 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C4CCC4)cc3)n2)cc1 192209560 IPHVDXVFMXNERM-FQEVSTJZSA-N 383.476 5.439 30 20 GKED C[C@@H](ON=Cc1ccccc1F)c1nnc(-c2ccc(Cl)cc2Cl)o1 255545371 SVLZWEDYPIXFDB-SNVBAGLBSA-N 380.206 5.294 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)CCCCOc2cccc(C#N)c2)c1C 303846810 DYHLZPAGRUDWKJ-QHCPKHFHSA-N 376.500 5.088 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 429060601 BAUUXJHJHRAAJI-SCLBCKFNSA-N 376.287 5.399 30 20 GKED C[C@@H](CNC(=O)c1cccc(SCC#N)c1)c1c(Cl)cccc1Cl 429786998 VYIMSYOTADKFLX-LBPRGKRZSA-N 379.312 5.143 30 20 GKED C=CCN(CCC#N)C(=O)Nc1cc(Cl)ccc1Oc1ccc(OC)cc1 432746695 JSXPFOXXADSGDP-UHFFFAOYSA-N 385.851 5.074 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H]2c2ccc(F)cc2)c2ccccc21 434354225 DNBBVRYPOWVKNO-NRFANRHFSA-N 375.447 5.061 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(OC2CCCC2)cc1 437861020 SUGPRFIZUQQAMX-XZOQPEGZSA-N 389.499 5.312 30 20 GKED Cc1nsc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c1C#N 439290469 XUVWFLRYUZBRLA-UHFFFAOYSA-N 387.386 5.261 30 20 GKED N#Cc1cc(Cl)ccc1CNc1cccc(C[S@](=O)c2ccccc2)c1 442133978 WBCGCYVYGDUSKY-SANMLTNESA-N 380.900 5.132 30 20 GKED C=CCC[C@H](NC(=O)N(CC)Cc1ccncc1)c1ccc(C(F)(F)F)cc1 442284451 MRQSDGIYQVMSHZ-IBGZPJMESA-N 391.437 5.339 30 20 GKED Cc1c(C(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)ccc(C(F)(F)F)c1F 442934653 JAPBENXTWBDHRJ-SJLPKXTDSA-N 390.380 5.065 30 20 GKED O=C(O)c1cc(NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 448550132 QKLZBNMDQYZHJE-UHFFFAOYSA-N 381.247 5.174 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccco1 454755766 HVJLFFORWJGIIJ-HNAYVOBHSA-N 381.501 5.433 30 20 GKED CC(C)Cn1cc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c2ccccc21 464422118 PLLFUVISMFTAFR-INIZCTEOSA-N 385.389 5.201 30 20 GKED C=CCC(CC=C)C(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 467841513 UUXSKQUFVSJBLA-MRXNPFEDSA-N 380.351 5.213 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc2c(c1)CCCC2 469089847 QBAVFDZJRSZDBV-SFHVURJKSA-N 387.527 5.321 30 20 GKED C[C@@H](NC(=O)C1(c2ccc(C#N)cc2)CC1)c1ccccc1OCc1ccccc1 473618394 HLKMMGKMILQIBF-LJQANCHMSA-N 396.490 5.046 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(-c2ccc(OC)cc2)n1 476119128 GRUUZXNTPOJOGC-UHFFFAOYSA-N 392.524 5.923 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)Nc3ccc(CC#N)cc3)cc2c1 479898480 DDBMJKHPNRMPHF-UHFFFAOYSA-N 399.450 5.635 30 20 GKED Cc1cc(Cl)ccc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 480506222 NHXDCWKGUUUSMW-UHFFFAOYSA-N 390.870 5.546 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccc(F)c(F)c1 481063672 XOKMPPGHTRHLIC-GOSISDBHSA-N 398.375 5.899 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)Nc2ccccc2SCCC#N)s1 481864933 PCBOOIYRXBEMCR-UHFFFAOYSA-N 393.537 5.685 30 20 GKED N#CC[C@H](CC(=O)Nc1c(C(=O)c2ccco2)oc2ccccc12)c1ccccc1 483107806 XKYYBDWBYVXBNH-QGZVFWFLSA-N 398.418 5.283 30 20 GKED C[C@H](c1cccc(NCc2ccc(-c3ccccc3C#N)cc2)c1)N1CCOCC1 487351054 DVIWBOVGJJKMKG-HXUWFJFHSA-N 397.522 5.231 30 20 GKED C=CCC[C@H](C(=O)Nc1ccccc1OC[C@H]1CCCCO1)c1ccccc1 488688634 JBQDRVHRCUIBOH-RTWAWAEBSA-N 379.500 5.323 30 20 GKED O=C(Nc1cccc2oc(C(F)(F)F)nc12)c1cc(C(F)(F)F)ccc1F 499511931 CFGDJGSDDQHEER-UHFFFAOYSA-N 392.230 5.257 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(C(C)C)oc1C 505327080 RDRYKMREDZUULP-UHFFFAOYSA-N 375.428 5.331 30 20 GKED N#Cc1cccc(F)c1CC(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 509143577 XVFJMOVEEXSCHU-LJQANCHMSA-N 390.380 5.012 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 509631921 GCAGKNLEBLXZDK-NEPJUHHUSA-N 379.312 5.223 30 20 GKED Fc1ccccc1C(F)(F)c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 512014905 JGFOHAWYAQYLTF-CYBMUJFWSA-N 390.258 5.427 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(NC(=O)CC(F)(F)F)cc1 513039348 ZYXMHXYWRUBPJL-UHFFFAOYSA-N 394.418 5.108 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F 517104250 OROVTXFAGVJBQP-UHFFFAOYSA-N 392.421 5.713 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 517138098 MSFQYJVTFZPYJJ-QFIPXVFZSA-N 395.934 5.673 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](Nc4ccccc4)C3)cc2)c1 520195753 KEOHXXUQSROBPF-NRFANRHFSA-N 398.466 5.069 30 20 GKED CC1CCC(OC2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2)CC1 524678407 RLAZKEYNYQVKAD-UHFFFAOYSA-N 383.536 5.079 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccco1 525110880 SSRQOXXGEUEIKV-OAHLLOKOSA-N 381.501 5.211 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Br)cc1C(C)C 536320020 MOAVVFDEMHSUIY-UHFFFAOYSA-N 380.330 5.366 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)nn1[C@H](C)C1CC1 538536283 VKHUFQVQNDLTGU-MRXNPFEDSA-N 386.455 5.079 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1F 539424400 MDKNEHBCLDULMB-GOSISDBHSA-N 382.788 5.610 30 20 GKED Cc1cc(NC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)n(CCC#N)n1 540212479 MJMMGMGOIBAXEA-UHFFFAOYSA-N 396.903 5.162 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 542927069 DSJWTIQCEBRNAS-CQSZACIVSA-N 395.289 6.023 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1)c1ccccc1 547977343 CNTBOLQJPDBSMN-HNNXBMFYSA-N 375.859 5.637 30 20 GKED CC(C)c1c(NC(=O)c2cc(C#N)ccc2Cl)cnn1-c1ccccc1Cl 552471967 ZFOOQFRGQLIDIT-UHFFFAOYSA-N 399.281 5.426 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(C1CC1)C1(C#N)CCC1 556439198 IGVSOGQBPITGIY-UHFFFAOYSA-N 390.270 5.008 30 20 GKED C=C(C)COc1cc(CNc2cccc(-c3noc(C4CC4)n3)c2)ccc1OC 557031500 XQJAHOCEDWLJIN-UHFFFAOYSA-N 391.471 5.190 30 20 GKED CC(C)NC(=O)Nc1ccc([C@@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 559867803 VMGNENGVDNXDSR-GCJKJVERSA-N 378.520 5.302 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@H](C)C3)c1C1CC1 569553163 BCVMPNGZJQYZCQ-QWHCGFSZSA-N 382.533 5.042 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(C)s1 574727675 FGVFZXPTQCFTEH-CQSZACIVSA-N 392.484 5.307 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(OCC2CC2)c(F)c1 578687810 SIDZVGWVLWBRAJ-CYBMUJFWSA-N 392.396 5.356 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H]1CCCCC1(F)F 596393308 JVVZVBJLBIVVTQ-CABCVRRESA-N 398.544 5.436 30 20 GKED Cc1ccc(CC2CN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 596735551 OKHHNSWOIUXPRG-KRWDZBQOSA-N 379.529 5.096 30 20 GKED CSCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 603836610 NEIFVZDVSXZHMH-KRWDZBQOSA-N 398.940 5.817 30 20 GKED CSCc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cc1 603991750 PBOIXALGNRVMRQ-UHFFFAOYSA-N 390.533 5.501 30 20 GKED CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 604509987 SMKRYBMBNDROPN-GOSISDBHSA-N 378.476 5.178 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCCCCC3)cc2Cl)c1 609080637 QKQRUXVVFYXKKY-UHFFFAOYSA-N 383.879 5.199 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 609209010 PFJAHGFZGNJHFN-GOSISDBHSA-N 385.467 5.884 30 20 GKED COc1ccc(CNC(C)(C)c2ccc(C(C)C)cc2)cc1OCCCC#N 609223764 WRUWKJNEHZGEDQ-UHFFFAOYSA-N 380.532 5.526 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc3[nH]ccc3c2)cc1 609345743 NSTPCLPKEDGZPH-UHFFFAOYSA-N 383.407 5.093 30 20 GKED N#Cc1ccccc1/C=C\c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 609475475 LDEZSKAVYFMQAQ-XGICHPGQSA-N 384.370 5.105 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 609555976 PAXVNMAMXVVTPV-BHIYHBOVSA-N 379.529 5.539 30 20 GKED C[C@H](C(=O)Nc1ccccc1S[C@H](C)CC#N)c1c(Cl)cccc1Cl 609580247 PLGULMHESLQUPO-OLZOCXBDSA-N 393.339 6.130 30 20 GKED Cc1cnn(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2F)c1 609864475 NMTCWLOEVPPYDN-UHFFFAOYSA-N 396.425 5.111 30 20 GKED C[C@@H](NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1)c1cccc(C#N)c1 610788211 USCZJLQTQSUBIU-OAHLLOKOSA-N 399.416 5.137 30 20 GKED CCSc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 613320233 VBMZGLDMBREQNR-MRXNPFEDSA-N 398.940 6.066 30 20 GKED Fc1ccc(-c2nc(CN3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)co2)cc1 618455150 YOXWRLXKCGHBGP-VXGBXAGGSA-N 396.306 5.043 30 20 GKED Cc1[nH]nc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c1-c1cccc(Cl)c1 619489394 ATVUGBFTUNBHFQ-UHFFFAOYSA-N 378.863 5.092 30 20 GKED C[C@H](NC(=O)N[C@@H](C)c1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 619762447 FLCSADITSYPWLI-HOTGVXAUSA-N 375.497 5.408 30 20 GKED C[C@H]1C[C@H]1c1ccc(CN(C(=S)Nc2ccc(C#N)c(Cl)c2)C2CC2)o1 726457247 LASUOJNRTQJNBY-YVEFUNNKSA-N 385.920 5.289 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccccc3OC)c(F)c2)c1 726477537 WTASTPSVRYJOGY-UHFFFAOYSA-N 392.455 5.417 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(N3CCc4sccc4C3)cc2)c1 726487551 GKVFQXJZOSCBCX-UHFFFAOYSA-N 389.549 5.101 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2c(c1)-c1ccccc1C2 730990040 REOWIQIYHZWKFO-MRXNPFEDSA-N 384.504 5.762 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc2cc(F)ccc2s1 731293463 ZSPUSVTZDBAOAF-CEXWTWQISA-N 386.451 5.569 30 20 GKED CCCOc1nc2ccccc2cc1/C=C/C(=O)[C@H](C#N)c1nc2ccccc2o1 731768036 YIHXXRKQSRGRIW-DXRVJIQQSA-N 397.434 5.054 30 20 GKED N#C[C@H](C(=O)CC[C@H]1CCCCO1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 732496211 QFMGSZDJXNLWIU-HXNATXLZSA-N 398.572 5.136 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc3c(c2)c2ccccc2n3CC)c1 733800742 HUNHPWRCNNTKJP-NRFANRHFSA-N 397.522 5.785 30 20 GKED C#Cc1cccc(N(Cc2csc([C@H](C)OCC)n2)Cc2cccs2)c1 736620410 UFVCDJIVAGFZFV-INIZCTEOSA-N 382.554 5.490 30 20 GKED C[C@H]1c2c(F)cccc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738897974 YGTWIWMVPDNKRI-HTAPYJJXSA-N 399.469 5.632 30 20 GKED O=C(/C=C\c1cc(Cl)ccc1OC(F)F)c1c(Cl)nc2sccn12 741847070 FRYKLWQCFGIMCI-IWQZZHSRSA-N 389.210 5.200 30 20 GKED N#C[C@@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc2cc(Cl)ccc2s1 744035766 RBFMCHAJXRLBOP-HTWSVDAQSA-N 394.927 6.100 30 20 GKED Cc1cccc(COc2ccc(CNC(=O)N[C@H](C)c3cccc(C#N)c3)cc2)c1 745462672 LWTZECAWPOIPFK-LJQANCHMSA-N 399.494 5.006 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3)ns2)cc1 746126374 YGFWUQDGCQOFED-OAQYLSRUSA-N 395.487 5.718 30 20 GKED CC(CCc1cccc(C(F)(F)F)c1)=NNc1oc(C(C)(C)C)nc1C#N 746498543 UIIQKTGGERFKRH-UHFFFAOYSA-N 378.398 5.283 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3cc(F)ccc23)cc1 751084716 OYLRJDWUPXKGRZ-QFIPXVFZSA-N 383.426 5.144 30 20 GKED C=CCCO[C@H](C)C(=O)O[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 753355965 SKCAYXPJBGYLIG-NWDGAFQWSA-N 384.259 5.234 30 20 GKED C#CC[C@@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccccn1 762057514 FYZZLPJLPSOZSC-OAHLLOKOSA-N 384.407 5.064 30 20 GKED N#Cc1ccc(CN[C@H]2CCCc3nc(-c4ccc(Cl)cc4)sc32)cc1 765015132 PRBKBENQKQPDJM-SFHVURJKSA-N 379.916 5.502 30 20 GKED C=CC[C@H](N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccncc1 766017331 ABGITQBGKHLCCP-LIRRHRJNSA-N 383.948 6.135 30 20 GKED C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)Cc1cc(C#N)cs1 768227706 VQMDVPOUZFOEQR-MRXNPFEDSA-N 375.497 5.065 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)cc1 769791579 YBQJLSRDJQEWSV-RDTXWAMCSA-N 393.284 5.367 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2)cc1 772971362 MFGOHJDGTQDYNK-HXUWFJFHSA-N 386.476 5.107 30 20 GKED CCN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)c(Cl)c1 774150201 SBGIDKRLEHVSEZ-UHFFFAOYSA-N 399.878 5.225 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccccc2NCc2ccccc2Cl)n1 776075121 SGGRSUVMXQWPQX-MRXNPFEDSA-N 381.888 5.207 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(OC)c1)c1ccccc1 777552126 NYKYPHBRLPZTBJ-SFHVURJKSA-N 396.487 5.341 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@H](C)C#N)c1cc(F)c(Cl)cc1Cl 780682407 VSOINMCQJQPTRT-MNOVXSKESA-N 396.249 5.306 30 20 GKED COc1cc(/C=C\C(=O)c2cncs2)ccc1OCc1ccc(Cl)cc1 787170505 WUWITFISRJEAKP-YWEYNIOJSA-N 385.872 5.280 30 20 GKED CCCCC[C@@H](C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C(C)C 787514390 BEVWNDLOKZLMIV-HXUWFJFHSA-N 383.536 5.061 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1 793628714 NKRVRMNPUVUBPF-XMMPIXPASA-N 398.506 5.406 30 20 GKED N#CC[C@H](CC(=O)OCc1csc(-c2ccc(F)cc2)n1)c1ccccc1 795979639 BKDFEXOSHXRXHI-QGZVFWFLSA-N 380.444 5.080 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1CNc1ccccc1O[C@@H](C)C#N 797850506 SQKBWQYRQDBBEW-HNNXBMFYSA-N 394.906 5.105 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C[C@@H]1CCC(F)(F)C1 797866483 TUTJOJFWBUXJBT-NSHDSACASA-N 392.393 5.475 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2cnc(-c3cccs3)s2)C(=O)c2ccccc21 802706945 BOSIQGUEDKKXMH-OJNOIJSXSA-N 395.505 5.188 30 20 GKED Cc1cc(NC(=O)N(CCC#N)CCC(C)C)ccc1NC(=O)OC(C)(C)C 825975008 JEEWPUKESNUNCJ-UHFFFAOYSA-N 388.512 5.136 30 20 GKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1ccc2nc(O)[nH]c2c1 834835647 IGORMONONIFUSF-RMKNXTFCSA-N 387.420 5.034 30 20 GKED C[C@H](NC(=O)c1cc(NC(=O)OC(C)(C)C)ccc1Cl)c1cccc(C#N)c1 863892618 CIMAFCZVJPRFAA-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)c(OC)c1OC 916131456 DSAHKZABFMJSQS-FLIBITNWSA-N 388.419 5.508 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1ccc(Cl)cc1 916247044 WTJKMMBNYKWRPT-UHFFFAOYSA-N 377.250 5.132 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccccc3Cl)o2)cc1 916911166 RKVQJEVCKYHXOZ-KRWDZBQOSA-N 392.842 5.124 30 20 GKED CCc1ccc(C(=O)CCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043567 JRZWLKJWHXDRLU-MRXNPFEDSA-N 396.899 5.351 30 20 GKED CCO[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 920324811 VDSRAGDTJNYRGB-RXVVDRJESA-N 376.481 5.073 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\Cc3c(F)cccc3C2=O)cs1 921264308 QQOHWKCQAXFNCM-XNTDXEJSSA-N 392.455 5.098 30 20 GKED CC[C@H](C)CON=C(C)CCc1ccc(OCc2cccc(C(=O)O)c2)cc1 1776077895 KMADTHBYGZCXOP-KRWDZBQOSA-N 383.488 5.335 30 20 GKED CCCCCCCCCC[C@@H](C)N=c1nc[nH]c2sc(C(=O)O)c(C)c12 1776785183 HAPQNAYKLYFXOM-CQSZACIVSA-N 377.554 5.451 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc4cc(Cl)ccc4o3)c2c1 1777685729 VBMOHRXIIYWXNA-RJRFIUFISA-N 382.824 5.895 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccc(C)cc2)[n+]2ccc(C)cc2)cc1 27205193 GVGWWUBHJDSLGT-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1OC 46706793 QROYGANBMAWNRO-QGZVFWFLSA-N 392.480 5.016 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1 47159465 RFFVJHAFERUSPZ-JOCHJYFZSA-N 389.886 5.143 30 20 GKED O=C1/C(=C/c2ccc(O)c(Cl)c2)CSC/C1=C/c1ccc(O)c(Cl)c1 60132682 IHWKEBBNXPFHHN-FUJGBLOQSA-N 393.291 5.188 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)NCc1ccccc1Oc1ccccc1 63404262 RAVIBSXZJFKAOU-UHFFFAOYSA-N 397.478 5.248 30 20 GKED C=CCCO[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 65651564 PKKCZBBWPFDSKI-RISCZKNCSA-N 395.311 5.274 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2SCc2cscn2)c1 66463344 DLFOBSZFIMFFHN-UHFFFAOYSA-N 396.537 5.643 30 20 GKED CCOc1cccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66954727 KCISPPUCLGMBAG-HOTGVXAUSA-N 383.517 5.362 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 71922913 OTJCNFORBDSEOJ-JTSKRJEESA-N 377.488 5.032 30 20 GKED Cc1c(C(=O)/C=C\c2ccccc2OCc2ccccn2)cnn1-c1ccccc1 96942853 VJOMNANIVXGAMG-PFONDFGASA-N 395.462 5.051 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSc1ccc2ccccc2n1 108145823 NCXHFKIRDFTPOE-OAHLLOKOSA-N 393.537 5.217 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](C)c1cccc(O)c1 118821954 ZHNSAOMHDYBHMZ-JKSUJKDBSA-N 383.517 5.401 30 20 GKED N#C[C@@H](C(=O)CC/C=C/c1ccccc1)C(=O)Nc1ccc(Cl)cc1Cl 121743195 YRZAGJDUZRIYAE-YCOJEUHLSA-N 387.266 5.134 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)s1 123262755 HXDHMEBXNPNPMZ-HNNXBMFYSA-N 391.521 5.531 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1c(F)cccc1F 153463177 XSQBTXFFZSBVDW-ONGXEEELSA-N 376.815 5.208 30 20 GKED Cc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c(Br)n1 166956133 QTOJXKNDBHHVKB-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@@H](C)c1sc(C)nc1C)c1ccc(F)c(F)c1 185482461 LTEZTIGEQHESBA-SJCJKPOMSA-N 379.476 5.058 30 20 GKED Cc1cc2cc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)oc2cc1C 187574821 IHVHYNXOPBMGPW-AWEZNQCLSA-N 379.366 5.285 30 20 GKED C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccco1)c1cccc(C#N)c1 189858920 WIQWJAJNTWGEDP-CQSZACIVSA-N 392.509 5.373 30 20 GKED Cc1nc2ccc(N=C(O)N3CCCCC[C@H]3c3noc(C(C)C)n3)cc2s1 329585962 YHUSIRDPAJJSOE-INIZCTEOSA-N 399.520 5.274 30 20 GKED Cc1sc(N=C(O)CN2CCCC[C@@H]2c2nc3ccccc3o2)c(C)c1C 329992843 KTNNPQFDRVNIMM-QGZVFWFLSA-N 383.517 5.630 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H]1CC(C)(C)Oc2ccccc21 413418441 XYXQMWZTXJDMBG-RDJZCZTQSA-N 380.513 5.222 30 20 GKED N#CC1(CCCSCc2ccc(Cl)c(Br)c2)CCOCC1 419584211 IMFRFXPNIDGELZ-UHFFFAOYSA-N 388.758 5.436 30 20 GKED CC[C@@H](NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)c1ccccc1OC(F)F 425427363 SMTJJGVVYDCZPQ-KBXCAEBGSA-N 387.430 5.013 30 20 GKED Cc1c(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)sc2ccc(C#N)cc12 428175223 HHNDGAKLQQMCMW-UHFFFAOYSA-N 399.475 5.866 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2csc(-c3ccccc3F)n2)s1 430618272 SHKJIDSMFHLGDK-GFCCVEGCSA-N 385.489 5.193 30 20 GKED Cc1sc(Br)c(C(=O)Nc2sc3c(c2C#N)CCCC3)c1C 440445497 PKENNWCGTWJNEV-UHFFFAOYSA-N 395.347 5.192 30 20 GKED C=CCN(C(=O)c1cc(-c2ccc(Cl)cc2)on1)c1nc2c(s1)CCCC2 444453959 LACDUZLIUSKJMA-UHFFFAOYSA-N 399.903 5.163 30 20 GKED Cc1ccccc1C[C@@H](C)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 444902302 WJQDBTTVWNYVPR-SJLPKXTDSA-N 381.545 5.342 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 448352571 DNOGESNZOFFHCZ-UHFFFAOYSA-N 389.459 5.300 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(C)[C@@H](C)c1ccc(Cl)cc1Cl 460376183 RWPCSPPYJYPVOB-SUMWQHHRSA-N 395.334 5.210 30 20 GKED CCN(C(=O)c1oc2ccc(Br)cc2c1C)c1ccc(C#N)cc1 461522406 SPIIULHDFVSZMX-UHFFFAOYSA-N 383.245 5.042 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cccc(-c3cscn3)c2)cc1 463761703 WBWWQNZUFBDXIM-IBGZPJMESA-N 375.497 5.102 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 463768735 MAVDNQGNUDLIBB-CQSZACIVSA-N 394.327 5.411 30 20 GKED COc1cccc([C@H](NC(=O)Nc2cccc(C#N)c2)c2ccccc2Cl)c1 466043540 SEJJJQRNCCFNOJ-NRFANRHFSA-N 391.858 5.131 30 20 GKED CCN(CCC#N)C(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 467607391 JPUDOFRVIIBMON-UHFFFAOYSA-N 389.524 5.090 30 20 GKED CSc1cccc([C@H](NCc2ccc(F)c(C#N)c2)c2cc(F)ccc2F)c1 467767456 DSTNUZSNLIUHTM-QFIPXVFZSA-N 398.453 5.577 30 20 GKED Cc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1OCC(F)F 468829728 DPMWCRLZLVLNGT-UHFFFAOYSA-N 397.425 5.150 30 20 GKED CCCn1c(C(=O)N(CCC#N)c2ccc(OCC)cc2)cc2ccccc21 469188421 SDWRIIRWCZTYET-UHFFFAOYSA-N 375.472 5.010 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc2ccccc2s1 469212629 JMVUBFYGVQUWME-INIZCTEOSA-N 389.524 5.657 30 20 GKED Cc1nc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)ccc1C#N 469900277 VSZMGYWJXGRXKR-UHFFFAOYSA-N 399.237 5.008 30 20 GKED Cc1cccc2c1OCC[C@H]2NCc1cccc(OCc2cccc(C#N)c2)c1 474000666 ODAZVKXIOJZPSV-XMMPIXPASA-N 384.479 5.059 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(c2cccc(Cl)c2)CC1)c1ccccc1 474542764 SNFVZXDFJHIMIQ-NRFANRHFSA-N 381.907 5.274 30 20 GKED CC(C)(CC(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1)C(F)(F)F 481537412 VNADUHKJLGTEIF-UHFFFAOYSA-N 379.247 5.224 30 20 GKED CC(C)(NC(=O)CSc1ccc(C#N)cc1)c1ccc(Cl)c(Cl)c1 483553642 OZVAGROSCQFVRX-UHFFFAOYSA-N 379.312 5.009 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(-c2ccccc2Cl)o1)c1ccccc1 487209545 LJBNRWHVADFABQ-LJQANCHMSA-N 378.859 5.765 30 20 GKED N#CCCC[C@H](NC(=O)c1cccc(OCc2cccs2)c1)c1ccccc1 487320509 AJPPAYWXNUUSIN-QFIPXVFZSA-N 390.508 5.492 30 20 GKED Cc1c(C(=O)Nc2ccnn2-c2ccc(C#N)cc2)oc2c1ccc1ccccc12 497960880 SHCDICSPFXKQAP-UHFFFAOYSA-N 392.418 5.204 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1 498370976 CWUVXBVQFZXSAT-HSZRJFAPSA-N 389.474 5.031 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)COc1ccccc1-c1ccccc1 498447066 DTYHIMUIGABECJ-UHFFFAOYSA-N 384.479 5.043 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccccc1Cl 499946801 IJVYDVKEFUCNNS-AWEZNQCLSA-N 378.646 5.123 30 20 GKED C[C@H](N[C@H](C)c1cnn(C2CCCC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 502412772 GZRQDIGLORCAQK-RBUKOAKNSA-N 384.527 5.949 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3cc4c(Cl)c(Cl)ccc4[nH]3)CC2)cc1 503902217 QFVHBJNSOTWBFD-UHFFFAOYSA-N 396.277 5.276 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1c(Cl)cccc1Cl 505481347 RJKAHIONQFGHBV-CWSCBRNRSA-N 379.209 5.043 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccsc2Br)CC1 511011313 KWECVYRXGJYKSW-UHFFFAOYSA-N 375.335 5.004 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCOc2c(Cl)cccc21 513085890 IWRLUNKRUOORQV-NRFANRHFSA-N 388.854 5.132 30 20 GKED CC(C)(CNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)C(F)(F)F 518221666 KZXRWHGRQWXCFN-UHFFFAOYSA-N 396.796 5.322 30 20 GKED CN(Cc1c(Cl)cccc1Cl)C(=O)CCCCOc1cccc(C#N)c1 520325513 VDLKFXRUSCGGFD-UHFFFAOYSA-N 391.298 5.073 30 20 GKED C=CCCO[C@@H](C)C(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 520635692 NXYMCTWFCKGBLH-KRWDZBQOSA-N 394.540 6.066 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@@H](c4ccccc4)CC3)cc2)nc1 521109429 SBOQTNXMBDEGSH-OAQYLSRUSA-N 397.478 5.155 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)s1 521646359 PRVHHKYLAQVVFF-OAHLLOKOSA-N 391.496 5.257 30 20 GKED N#C[C@H](NC(=O)c1ccnc(Oc2ccccc2)c1)c1ccc(Cl)c(Cl)c1 521886390 VGAGGKZUFXGUNE-SFHVURJKSA-N 398.249 5.175 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CO[C@H]1CCC[C@@H](C)C1 522151487 XJUXYHRTZSVYAN-VGSWGCGISA-N 394.490 5.134 30 20 GKED CC(C)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccc(F)cc1 522313259 XVOWDHRVWMNVHW-UHFFFAOYSA-N 388.442 5.332 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCOc3ccccc32)c1 523878444 SHDAEXHQFHQVPO-UHFFFAOYSA-N 390.826 5.043 30 20 GKED N#Cc1ccc(C2(NCc3ccc(Cl)c(C(F)(F)F)c3)CCOCC2)cc1 527812760 UGXRODOSSMBKJY-UHFFFAOYSA-N 394.824 5.026 30 20 GKED CCS[C@H]1CC[C@@H](N(C)C(=O)c2ccccc2Oc2ccccc2C#N)C1 538663310 ZTWUDBHROGKLIL-MSOLQXFVSA-N 380.513 5.097 30 20 GKED C=CCC(C)(C)c1noc([C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccccc2)n1 551140881 UUCJDOCIMMAVOP-QYZOEREBSA-N 379.504 5.069 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)c1ccc(C#N)c(Cl)c1 562750401 PLBGDZQQERYPCH-HNNXBMFYSA-N 382.891 5.207 30 20 GKED Cc1ccsc1CCCC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 568456052 NHKDNDCKUVENKV-UHFFFAOYSA-N 377.469 5.077 30 20 GKED CC(C)CN(C(=O)Nc1ccc(CC#N)cc1Cl)[C@H]1CCCc2cccnc21 574494995 YYGQBHFXUYEGRX-FQEVSTJZSA-N 396.922 5.369 30 20 GKED COc1ccc(C[S@@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1C#N 584041455 HIULPCBWKHWCOI-AJTFRIOCSA-N 395.911 5.259 30 20 GKED CN(C(=O)c1cccc(C#N)n1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 589615084 NJWRWYUMXUNPII-UHFFFAOYSA-N 396.277 5.122 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 606173815 AARHHMUSIUMMET-WXHSDQCUSA-N 399.350 5.030 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1 606940766 ZUNGEHOHHCKJGY-KDURUIRLSA-N 385.552 5.015 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(Oc2ccc(C)nn2)cc1 608325736 XMHORDLCFIVMRQ-UHFFFAOYSA-N 380.492 5.178 30 20 GKED Cc1nc(NC(=O)CCCc2ccc(C(C)(C)C)cc2)sc1SCC#N 608939171 TYHJLBMJYYDMTF-UHFFFAOYSA-N 387.574 5.326 30 20 GKED COc1ccc(-c2cc(C(=O)N(C)c3ccc(C#N)cc3F)sc2C)cc1 609217968 ZCOTYCKSIZEBGC-UHFFFAOYSA-N 380.444 5.020 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(OC2CCCC2)cc1 609376681 HYKFKTDMUPZAET-INIZCTEOSA-N 380.513 5.512 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCSc4ccccc43)cc2)cc1 609496558 NLYGKMUYRWYJTJ-UHFFFAOYSA-N 386.476 5.297 30 20 GKED CCN(CCc1ccccc1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609499201 BINSYOWMDGBIOI-UHFFFAOYSA-N 384.479 5.250 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1 609499281 FCAKOBIGFMJRPN-SFHVURJKSA-N 385.467 5.196 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 609501925 JGSZUVOVYAHGSK-UHFFFAOYSA-N 390.870 5.918 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2ccccc2)c2cccc3ccccc23)c1 609507419 IOYNPKOJVJFYJQ-VWLOTQADSA-N 376.459 5.425 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(cnn2C(C)C)c1 609774947 XLSIJZKMOWAXAY-UHFFFAOYSA-N 389.503 5.179 30 20 GKED N#Cc1c(NC(=O)c2ccccc2SCc2ccco2)sc2c1CCCC2 612511634 XOQBWIOYCMKGIO-UHFFFAOYSA-N 394.521 5.636 30 20 GKED COc1cc([C@H](C)NCc2ccc(C(C)(C)C#N)cc2)ccc1OC1CCCC1 614179177 HCZXUXFPCSVCGJ-SFHVURJKSA-N 392.543 5.669 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nc2sccc2c1=O 643092392 GXXHMQQGCPHTAL-UHFFFAOYSA-N 399.928 5.138 30 20 GKED COc1ccc(C(=O)/C=C/c2sc3ccccc3c2Cl)cc1NC(C)=O 726430541 ZDSLKMPOWLVUGI-CSKARUKUSA-N 385.872 5.418 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)c2ccc(CC)cc2)cc1 727953925 RECKCTHAEPGVKW-HTAPYJJXSA-N 376.500 5.043 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1 728439715 DYJBQYQEKYPAKO-KTKRTIGZSA-N 397.525 5.298 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=S)Nc1c(Cl)ccc(C)c1Cl 728446507 WRPBZVHFBYLDCY-UHFFFAOYSA-N 392.355 5.783 30 20 GKED C[C@@H](N[C@H](C)c1csc2ccccc12)C(=O)Nc1ccc(C#N)c(Cl)c1 730022447 OUYUHQDBCNMMQC-CHWSQXEVSA-N 383.904 5.104 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccncc1 734679512 HWTUYHGQTLCKCI-XLIONFOSSA-N 395.553 5.179 30 20 GKED C[C@@H](Nc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)c1ccc(C#N)cc1 743477824 QKGULOATXQNISD-MRXNPFEDSA-N 377.488 5.025 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@H](C)c3ccccc3C(F)(F)F)[nH]c12 744161929 WZDRHSHCYBCBFN-ZFWWWQNUSA-N 385.389 5.260 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)/C=C/c3cnc(C(C)(C)C)s3)c2C#N)C1 744351102 KJDHZEVBGQPVAN-WMADIVHISA-N 385.558 5.150 30 20 GKED Cc1sc2ncn(N=C/C=C\c3ccc(F)cc3)c(=O)c2c1-c1ccccc1 747746429 IRVQEKNILRSFIN-BVQJZAOSSA-N 389.455 5.120 30 20 GKED CC[C@@H](Oc1ccccc1F)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 749025591 PVHXPXKNYAOOFW-SWLSCSKDSA-N 388.851 5.123 30 20 GKED CCn1nc(C)c(C(=O)/C=C\c2ccc(OCc3cccc(F)c3)cc2)c1C 750909476 LWYGCVMMMINHFT-RAXLEYEMSA-N 378.447 5.134 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccn3)s2)COc2c1ccc(Cl)c2Cl 753142464 CGUYRBHVIBGUJA-YFHOEESVSA-N 389.263 5.171 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc(Cl)cs3)c2)cc1 757853907 LHRHOHHIYVFIGE-UHFFFAOYSA-N 382.872 5.299 30 20 GKED C=CCn1c(SCc2ccnc(Cl)c2)nnc1-c1cccc(Cl)c1 765335102 USXMYNQABUGVEM-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@@H](C)c2cc(F)cc(F)c2)c1C(F)F 769699853 PSBKURRJBXZPEB-ZETCQYMHSA-N 398.278 5.056 30 20 GKED Cc1cc2c(cc1C)[C@@H](C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CO2 769863056 OWHDYWGHSAQQDS-PKTZIBPZSA-N 382.463 5.074 30 20 GKED CCCCCCCC[C@H](C)CC(=O)N1CCC(C(=O)N2CCCCC2)CC1 774806844 SWUFQSOVHWXIBW-FQEVSTJZSA-N 378.601 5.014 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775615354 VPXJZZISUKMALF-HZPDHXFCSA-N 382.533 5.030 30 20 GKED CCSc1ccc(Cl)cc1NC(=O)Nc1ccccc1O[C@@H](C)C#N 780558395 BFJGOAOPNPGQAG-LBPRGKRZSA-N 375.881 5.387 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=Cc4scnc4C4CC4)c23)cc1 782170846 NEHSXIMSRNOVSI-UHFFFAOYSA-N 391.525 5.447 30 20 GKED CC(=O)c1ccc(NC(=S)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782203143 CKFPBKWDGJMZHF-MRXNPFEDSA-N 399.519 5.475 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C 793118702 VIXIOPRBURMKRD-WBVHZDCISA-N 399.416 5.037 30 20 GKED COc1ccc(CCCCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797571195 MXUNUOAKTHPTBL-SFHVURJKSA-N 384.545 5.429 30 20 GKED CC(CCc1ccc(C(F)(F)F)cc1)=NNc1nnc(-c2ccccn2)s1 800817188 WAJPQZZYVZOAOG-UHFFFAOYSA-N 391.422 5.040 30 20 GKED Cc1nc(CSc2ccc(C(=O)OC[C@H]3CC[C@@H](C#N)CC3)cc2)cs1 809090190 FSNWZJNQXKKAJP-IYBDPMFKSA-N 386.542 5.231 30 20 GKED C=CCCCCCCCNC(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 811927086 HZBHATXWVYAWHU-ZIAGYGMSSA-N 388.396 5.285 30 20 GKED N#C[C@H](C(=O)CCCSc1ccc(Cl)cc1)c1nc(C2CC2)cs1 842936961 AXGTUVNTCKESII-OAHLLOKOSA-N 376.934 5.423 30 20 GKED CC(C)c1ccc(NC(=O)N(C)C[C@@H](O)c2cccc(C#N)c2)c(C(C)C)c1 844499208 LMAXGNLUXMDIOY-JOCHJYFZSA-N 379.504 5.002 30 20 GKED O=C(c1cc2ccccc2cc1F)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 883985950 HHFDSHKXKDVRPJ-DZGCQCFKSA-N 393.302 5.324 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3sc4c(c3C#N)CCCCC4)c2c1 916093687 OEKSKTWRYXYONF-UHFFFAOYSA-N 380.469 5.204 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(Cl)c2)cc(Br)c1O 916137577 OWAOJDNZNBZTMM-SREVYHEPSA-N 381.653 5.103 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2cccc(OC)c2OC(C)C)cc1Cl 916154330 BHMBEAUKDNVTHH-MDZDMXLPSA-N 390.863 5.049 30 20 GKED N#C[C@@H](C(=O)CCn1c2ccccc2c2ccccc21)c1ccc2ccccc2n1 916848338 CABPUWCQOCIYRZ-OAQYLSRUSA-N 389.458 5.609 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)c2sccc2Br)cc1 916870301 FQHPLWSDJWFFEA-ZDUSSCGKSA-N 390.302 5.013 30 20 GKED COc1ccc(C(=O)/C=C\c2c(Cl)nc(Cl)n2-c2ccccc2)c(F)c1 920065178 WRWYPOIYRNBHPV-KTKRTIGZSA-N 391.229 5.223 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc3ccccc3c2)cc1C 920848049 NWJASBCMUGBVTC-UHFFFAOYSA-N 394.478 5.486 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 1776050251 VKDBNBIKDFPTEL-CYBMUJFWSA-N 393.270 5.436 30 20 GKED O=C(O)[C@H](Oc1cccc(C=NNc2cc(F)cc(Cl)c2)c1)c1ccccc1 1776091460 OAMPXUBXVOFVRI-HXUWFJFHSA-N 398.821 5.130 30 20 GKED CC(/C=C1/CCc2oc(C(=O)O)c(C)c2C1=O)=C\c1ccccc1C(F)(F)F 1776200026 RKCMLJHNJWTCBZ-VDVFTDKOSA-N 390.357 5.464 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2cccs2)cc1 1776787963 FSQOIIFDOSHHHS-IBGZPJMESA-N 375.534 5.403 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)COc2ccccc2C#N)c2cccs2)cc1 9982921 WGOBXGQVVXYEML-HSZRJFAPSA-N 390.508 5.028 30 20 GKED Cc1cc(C)c(Nc2nnc(SC[C@@H](C#N)CCC#N)s2)c(Cl)c1 25696460 FQEFITQNJHSYQL-GFCCVEGCSA-N 377.926 5.088 30 20 GKED CCN(C(=O)CCc1ncc(-c2ccc(C)cc2)o1)[C@@H](C)c1ccc(C#N)cc1 45500776 MEIXPZPJKLVPGE-SFHVURJKSA-N 387.483 5.064 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 57129501 BNLKYFJPCDZPTD-LJQANCHMSA-N 392.421 5.087 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4c(s3)CCCC4)n2)cc1 66544867 RENOANHFUKEOBT-INIZCTEOSA-N 389.505 5.112 30 20 GKED Cc1cccc(-n2ncc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2C)c1 66801992 FMPPMCYCIAWMPC-INIZCTEOSA-N 390.512 5.136 30 20 GKED CCN(C(=O)NCc1ccc(C#N)cc1F)[C@H](C)c1cccc(C(F)(F)F)c1 105722160 BQRHXQYGXXBFEQ-CYBMUJFWSA-N 393.384 5.009 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 109578157 LQAYYZZIMVLPHD-QGZVFWFLSA-N 395.915 5.575 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1cccc(Cl)c1 175119674 NPQCUVVHEBJOJS-RZXPCSSPSA-N 385.801 5.365 30 20 GKED N#CCCCCN[C@@H]1CCCc2nc(-c3ccc(Br)cc3)sc21 178641841 OPRRUHBYGXXZGY-OAHLLOKOSA-N 390.350 5.233 30 20 GKED Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cc(C(C)(C)C)sc1C#N 179546214 TWCQRSJIKIRQHC-UHFFFAOYSA-N 385.514 5.123 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)c(F)c1 183338624 TVXJIASKTGQTRE-HNNXBMFYSA-N 376.275 5.109 30 20 GKED CN(CC(F)(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 191874643 SOXNFJAOOGGJEH-HNNXBMFYSA-N 381.785 5.021 30 20 GKED CCn1c(SCCC(C#N)(c2ccccc2)c2ccccc2)nnc1C1CC1 193066852 YPHACEOPVFCEJC-UHFFFAOYSA-N 388.540 5.167 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)cc1 209990583 OLHLOMIDYUVCTP-RAXLEYEMSA-N 386.838 5.360 30 20 GKED Cc1nc(C2(/N=C(/O)[C@@H]3C[C@@H]3c3ccc4ccccc4c3)CCCCC2)no1 329348182 CQTRXMSLWRMFIK-WOJBJXKFSA-N 375.472 5.451 30 20 GKED Cn1cc(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c(C2CCCCC2)n1 329348549 SFZNDUYMXSIXOR-HXUWFJFHSA-N 395.551 5.162 30 20 GKED OC1=Nc2cc(N=C(O)N3C[C@H](c4ccccc4)[C@H]4CCCC[C@H]43)ccc2CC1 330147922 UJMFDJZSAYXHPO-KCZVDYSFSA-N 389.499 5.425 30 20 GKED CSc1ccsc1C(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 409817895 PVQHTYDQMOVSGM-UHFFFAOYSA-N 396.512 5.323 30 20 GKED COc1ccc2c(c1)CN(CCCC1(C#N)CCOCC1)[C@@H](C1CCCCC1)C2 410404647 AXWKVMCKWYDRLO-XMMPIXPASA-N 396.575 5.103 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c2[C@@H]1C 410983735 KOHLAEFYTQSDNE-NXEZZACHSA-N 389.864 5.119 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(OCC2CCCCC2)cc1 426115423 BEXVPRZITXBKOE-UHFFFAOYSA-N 381.476 5.186 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c1 429868223 NPWLUPLYGVVQLK-IBGZPJMESA-N 398.940 5.537 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c1 429961066 JMZNENVCJCGGBN-UHFFFAOYSA-N 375.453 5.087 30 20 GKED N#CCCC[C@@H](NC(=O)NCCc1c(Cl)cccc1Cl)c1ccccc1 431858385 NXBLHVYTSYXVJE-LJQANCHMSA-N 390.314 5.270 30 20 GKED C[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ncc(-c2ccccc2)o1 431977324 LPDBOLXQFHGUIW-FXAWDEMLSA-N 388.471 5.137 30 20 GKED N#Cc1cn(Cc2nc(C3CCCCC3)cs2)c2ccc(Cl)cc2c1=O 436196774 JVFGADBRALYGMJ-UHFFFAOYSA-N 383.904 5.079 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(CC3CCC3)c3ccccc3)cc2)nc1 438022877 YNCLDTDMWALKHM-UHFFFAOYSA-N 383.451 5.192 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 438060166 PMOREFNJZVDJCL-GHTZIAJQSA-N 393.556 6.006 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@H](CCC#N)c1ccccc1 439394416 ICFVQPJZNNALLX-XMMPIXPASA-N 399.494 5.741 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ncc(-c2ccccc2)o1 439605048 VULQSBSVQNAUTL-KRWDZBQOSA-N 381.435 6.179 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)[C@@H](c2ccco2)C1 442054212 JFQGXSYTJXVZID-IUODEOHRSA-N 393.365 5.055 30 20 GKED CC(C)(C#N)CCCCN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444671803 IQBCSZXREARLCM-OAHLLOKOSA-N 380.376 6.009 30 20 GKED CC[C@H](NCc1cc(-c2c(OC)ccc3ccccc23)no1)c1ccc(C#N)cc1 447594075 WUTRUKGURRUWDH-QFIPXVFZSA-N 397.478 5.616 30 20 GKED C=C[C@H](CC(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1)c1ccccc1 452529880 HUTNVBLEBLYFFH-CQSZACIVSA-N 394.462 5.228 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1 455010559 ZLIMNMYGFNWBPM-LJQANCHMSA-N 393.878 5.156 30 20 GKED N#CCc1ccc(NC(=O)N2CC[C@H](CSc3ccccc3)C2)c(Cl)c1 455699687 HQECRECDHBDPBX-INIZCTEOSA-N 385.920 5.052 30 20 GKED N#CCCC[C@H](NC(=O)N(C1CC1)[C@H]1CCCc2ccccc21)c1ccccc1 458798376 HYXDOGGPPCUWJX-ZEQRLZLVSA-N 387.527 5.673 30 20 GKED C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1C(=O)N[C@@H](CCCC#N)c1ccccc1 458846672 RETLYLHSTXRCEQ-FUKQBSRTSA-N 375.516 5.398 30 20 GKED C[C@H](C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)c1cccs1 460166162 GCFIHOSDRBRUFU-HNNXBMFYSA-N 380.900 5.610 30 20 GKED C[C@H](NCc1nnc(-c2ccccc2)s1)c1ccc(-c2cccc(C#N)c2)cc1 464480474 LVSCVJKGFCQSKO-KRWDZBQOSA-N 396.519 5.595 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(OC)cc1)c1ccc2nc(C)[nH]c2c1 466443408 GITUYFOKPCWDNU-MRXNPFEDSA-N 377.488 5.015 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc(C(F)(F)F)cc1C 466792829 YNXAMBAUCYOQEA-UHFFFAOYSA-N 389.421 5.007 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(N2CCCC2)c1 475554743 JNBODOMZWFGMPE-LJQANCHMSA-N 391.559 6.021 30 20 GKED CSc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1Cl 475973297 AMUOWFBYIFXABJ-WMZOPIPTSA-N 385.920 5.366 30 20 GKED C=CCCCC(=O)N(CC)[C@@H](c1ccc(Br)cc1)c1cccnc1 480829787 OPSQHXJNTISEBB-FQEVSTJZSA-N 387.321 5.138 30 20 GKED C=C(C)[C@H](NC(=O)NCc1ccc(-c2cccnc2)cc1)c1ccc(F)c(F)c1 483117839 PJUJTTDEVYQMBF-QFIPXVFZSA-N 393.437 5.143 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@@H](C#N)c3nccc4ccccc34)cs2)cc1 483191706 GAPSTLXAWACGIE-IBGZPJMESA-N 383.476 5.081 30 20 GKED C=CCN(Cc1nnc(-c2ccccc2Br)o1)CC1CCCCC1 484630106 NMPQGBBSWOYIDH-UHFFFAOYSA-N 390.325 5.067 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)s1 487312096 VQFREZPRVPVLDN-UHFFFAOYSA-N 389.411 5.352 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@H](C)c1cc(F)ccc1F 489654979 CQAVVTBJQBEYAO-CQSZACIVSA-N 387.455 5.175 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 490481061 RLCVYEQPEXSLEO-UHFFFAOYSA-N 399.406 5.088 30 20 GKED COc1ccc(CCCCC(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)cc1 499796873 IBHKBJRUIMLZPW-SFHVURJKSA-N 391.298 5.096 30 20 GKED C=CCC(CC=C)C(=O)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1 501790849 RVGKFDMQDMZKSP-IBGZPJMESA-N 383.467 5.088 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)Cc2csc(-c3ccccc3)n2)cc1 505815321 LLKOXYYHCHGYLO-HXUWFJFHSA-N 389.524 5.031 30 20 GKED N#C[C@H](NC(=O)c1ccc(SCc2ccccc2)cc1)c1ccccc1F 505982156 PSUYDFJRZLFKOE-NRFANRHFSA-N 376.456 5.113 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2ccc(Oc3cccc(Cl)c3)cc2)nc(C)n1 507032201 UBWDZTQTIIWDJK-IBGZPJMESA-N 377.831 5.029 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1 509510093 RRUHSYVDXMZLEH-GOSISDBHSA-N 395.572 5.740 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F 509886476 OAUOZJUWZXQMIJ-RDJZCZTQSA-N 380.435 5.021 30 20 GKED CC(C)CCN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CC1 509904409 IIZKAEBHRXLKMX-UHFFFAOYSA-N 391.515 5.374 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 516380482 ONXAUKSILOLDEU-DJJJIMSYSA-N 388.298 5.473 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@@H]3CCc4cc(F)ccc43)cc2)cc1 518375195 FHNFOPGNDARWOZ-HSZRJFAPSA-N 386.426 5.101 30 20 GKED C=C(C)CCc1noc(CCCc2nnc(-c3ccc(Cl)cc3Cl)o2)n1 518835238 JIUVXDVSXWIOPV-UHFFFAOYSA-N 393.274 5.110 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCCc4cc(F)ccc43)cc2)cc1 518903055 SHLVPNQLRQAVAQ-UHFFFAOYSA-N 386.426 5.277 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521034011 SBHLOWUGGODXIO-DLBZAZTESA-N 397.544 5.608 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)CCCCOc2cccc(C#N)c2)c1 522731034 VMAUYCMCDMGMSZ-DEOSSOPVSA-N 390.527 5.560 30 20 GKED C[C@@H](C#N)C(=O)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 522984732 JERUUZZRXZNVGZ-PGRDOPGGSA-N 393.490 5.243 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 533502781 QTSGICNMLISWRE-BEFAXECRSA-N 392.890 5.202 30 20 GKED C=C(C)[C@H](CC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1)OCC 533684307 YUCFFRGONRSLAY-UXHICEINSA-N 396.531 5.500 30 20 GKED C[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(C#N)c(F)c1 537404859 QMPIFSZRCJFJSB-CYBMUJFWSA-N 377.444 5.418 30 20 GKED C=CCC[C@@H](NCc1cnc2nc(C)cc(C)n12)c1ccc(C(F)(F)F)cc1 539524143 XTQZYBYBQBATIW-LJQANCHMSA-N 388.437 5.162 30 20 GKED N#C[C@@H](NC(=O)c1cc(F)ccc1Cl)c1ccc(OCc2ccccc2)cc1 550217846 KQVFQRGKTGVDGQ-OAQYLSRUSA-N 394.833 5.053 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)ccn1 567433810 CDLAAMNDYMGTHL-KGLIPLIRSA-N 389.377 5.053 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCC[C@H]1C(F)(F)F 578241329 COGDDNMREODJJL-RRFJBIMHSA-N 399.482 5.429 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(Cl)c1OCC(F)F)c1ccccc1 579048025 YQNUGFSQPAUMNM-CQSZACIVSA-N 378.806 5.010 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(-c2nc(C)cs2)c1 588261464 XJZVGWCIIYOMPN-UHFFFAOYSA-N 393.512 5.347 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccc(C(F)(F)F)cc2)c1 589740815 AZODZIZAVOMHKZ-UHFFFAOYSA-N 378.394 5.324 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N(Cc1ccc(C#N)cc1)C(C)C 603527572 QZPAGMPOJWJYQP-UHFFFAOYSA-N 381.526 5.103 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1Cl 603647134 LZDKSGOIUQDSFJ-UHFFFAOYSA-N 396.903 5.233 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Br)cc1Cl 603872520 VQHCYOGWXNSRTA-UHFFFAOYSA-N 391.696 5.027 30 20 GKED CCc1cc(C#N)c(NC(=O)CCOc2ccccc2-c2ccccc2)s1 604028842 ULGKOIXIBUGFOV-UHFFFAOYSA-N 376.481 5.257 30 20 GKED C[C@@H](NC(=O)NCc1cccc(C#N)c1)c1ccc(Oc2ccccc2)c(F)c1 604077721 YDFRCCKOVJPMDL-MRXNPFEDSA-N 389.430 5.050 30 20 GKED CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 604509043 WAUIDZULWFJQKZ-QGZVFWFLSA-N 382.533 5.038 30 20 GKED CCC[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608864181 BGWHCKGUQMASNZ-LJQANCHMSA-N 389.421 5.260 30 20 GKED CCCCOc1ccccc1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 609059778 MCTCNWMUBBDIGI-UHFFFAOYSA-N 390.439 5.161 30 20 GKED Cc1ccc2nc(C)c(C(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)cc2c1 609287089 LOQFMAWBSFOLMD-GOSISDBHSA-N 384.266 5.153 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609641849 BTXKQYIIACLDTO-UHFFFAOYSA-N 390.508 5.250 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1Cc1csc(-c2ccc(C(C)C)cc2)n1 610035143 LNSVAZWABBESOP-UHFFFAOYSA-N 399.523 5.420 30 20 GKED Cc1n[nH]c(C)c1[C@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 612280460 MHMKCJVOXYTREW-ORAYPTAESA-N 392.890 5.078 30 20 GKED CCCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 613318165 MSAUZFBHIMXPLS-LJQANCHMSA-N 376.481 5.397 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(OCc2ccc(F)cc2)CC1)c1ccccc1 678165056 JPBCGIBEUJPGLJ-HSZRJFAPSA-N 396.506 5.224 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 684631846 MXOXJQZQFSMGKZ-OAHLLOKOSA-N 391.427 5.197 30 20 GKED CSc1ccc(C(C)=NNc2nc(C(F)(F)F)nc3ccccc23)cc1 725832915 PKCWGHHDCOFTOH-UHFFFAOYSA-N 376.407 5.207 30 20 GKED C[C@H](OC(=O)c1ccc(COc2ccccc2C#N)o1)c1cnc2ccccc2c1 726333502 XWVDMIRRFJAWIK-INIZCTEOSA-N 398.418 5.196 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1cnc(-c2ccccc2)s1 727264398 QKKQJOPNUVWSJC-YIMYCEAYSA-N 388.448 5.548 30 20 GKED Cc1ncccc1/C=C1/CC(c2ccccc2)C/C(=C/c2cccnc2C)C1=O 728785655 MYLYNVRMAHRLSW-MQDDAKQZSA-N 380.491 5.707 30 20 GKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1csc(C(=O)O)c1 730150709 XDIXGPYAHFYTIG-WAYWQWQTSA-N 375.858 5.119 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2ccccc2c(Cl)n1 731332670 PPWPTEJZDMPCPV-CYBMUJFWSA-N 381.888 5.535 30 20 GKED CCc1c(C)sc(NC(=O)Cc2ccc(Cl)cc2Br)c1C#N 733220454 SPOUEMFPMYOQIF-UHFFFAOYSA-N 397.725 5.088 30 20 GKED C[C@H](OC(=O)CCC(C)(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 733708859 CAGUGEBMGWOCQT-QMMMGPOBSA-N 378.259 5.764 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccc(C)cc1C 734316957 GRTDDTUGACACAF-UHFFFAOYSA-N 384.479 5.421 30 20 GKED Cc1ccccc1COc1c(C)cc(C=Nn2cnnc2-c2ccccc2)cc1C 734746478 LWTCQDBBMUBMTF-UHFFFAOYSA-N 396.494 5.332 30 20 GKED CC(C)Oc1ccc(/C=C\C(=O)c2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 741447079 GWHVGLWOTFMIQM-SXGWCWSVSA-N 398.524 5.086 30 20 GKED Cn1cc(-c2cccc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)c2)cn1 741563164 QCFKIOGINFYLCE-UHFFFAOYSA-N 394.434 5.003 30 20 GKED COc1ccc(OCc2nc(/C=C3\Cc4cc(Cl)ccc4C3=O)cs2)cc1 742436904 GSYUUHPGRTZOOA-GXDHUFHOSA-N 397.883 5.207 30 20 GKED C[C@]1(c2ccccc2)C[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093863 YTYSHLQBMCGERW-SONWIMMPSA-N 381.479 5.194 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1[N+](=O)[O-] 743473578 DFDTUICJEHNVJM-HNNXBMFYSA-N 391.402 5.358 30 20 GKED N#C[C@@H](C(=O)CCCC1CCCC1)c1nc2cc(C(F)(F)F)ccc2s1 744038112 MLSXOLGBATWPHL-AWEZNQCLSA-N 380.435 5.852 30 20 GKED Cc1nn(C)cc1C(=O)/C=C\c1nc(-c2cc(Cl)ccc2Cl)cs1 753901081 VMVVAACKKINWFF-WAYWQWQTSA-N 378.284 5.055 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 756514788 HKOYWLRVWILGRJ-UWHLTILDSA-N 380.532 5.065 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)CCCc1ncc(-c2ccccc2)o1 768006069 SSOHVLISNCFLGY-UHFFFAOYSA-N 388.467 5.209 30 20 GKED C=C(C)[C@H](NCC(=O)Nc1ccccc1SC(F)F)c1ccc(F)c(F)c1 775722886 DNWHAWQCYPYNOD-SFHVURJKSA-N 398.425 5.125 30 20 GKED C[C@H](NCCCOc1ccc(Cl)cc1Cl)c1ccc(OCC#N)cc1 776157387 ANTLOKSFNFOAAG-AWEZNQCLSA-N 379.287 5.015 30 20 GKED Cc1csc([C@H](C#N)C(=O)C2(c3cccc(C(F)(F)F)c3)CCCCC2)n1 779189455 RDEWVAUKLVGQMH-MRXNPFEDSA-N 392.446 5.549 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1 780165006 PCSKJGOMVWGILQ-DENIHFKCSA-N 384.479 5.333 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)nc1 780646110 GWWMDOPVVGPJQK-UHFFFAOYSA-N 397.265 5.249 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)cc1 781419720 DGDHVTCDFZVZFF-NRFANRHFSA-N 384.376 5.595 30 20 GKED N#C[C@@H](C(=O)CCCCC(=O)c1ccccc1)c1nc2ccccc2n1C(F)F 783359314 VAPRXVISDKRNCL-INIZCTEOSA-N 395.409 5.051 30 20 GKED CCCc1c(NC(=S)Nc2ccc(C)cc2C)cnn1-c1cccc(C#N)c1 783951029 BKJNOHRPJRCGCI-UHFFFAOYSA-N 389.528 5.122 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(OC(F)F)c(Br)c2)cnn1C(C)C 787186722 GEYFIWGTLQVPBI-XQRVVYSFSA-N 399.235 5.032 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)NCCCCC(F)(F)F 794977723 IOHDGWZPTARTPY-LBPRGKRZSA-N 375.485 5.100 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)C(=O)c1ccc(Cl)cc1 797568018 NIOFGIBREYHAJS-SWLSCSKDSA-N 388.920 5.179 30 20 GKED C[C@@H](OC(=O)C(C)(C)c1csc(-c2cccs2)n1)c1ccc(C#N)cc1 799960467 WHGNVQRFOPWUIR-CYBMUJFWSA-N 382.510 5.325 30 20 GKED C[C@@H](N[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 810264243 ZHZQGOSTNQWQHS-GCJKJVERSA-N 393.531 5.255 30 20 GKED CC(C)OCCON=Cc1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 812240435 PXGFONUIBOQYJG-UHFFFAOYSA-N 395.286 5.021 30 20 GKED CC1(/C=C/C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 822528663 HRNUMGMUXPQCDH-XTXLJPNXSA-N 394.902 5.307 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(N(C)C(=O)OC(C)(C)C)c2)n1 892804036 ZAEXHUNSFOEJBK-MRXNPFEDSA-N 399.516 5.128 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccc3ccccc3c2)cc1 915085328 ALAZJFKGUBWWRH-RUZDIDTESA-N 392.458 5.513 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 915179164 AQRHWJWVSLGZNS-IBGZPJMESA-N 391.814 5.156 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c1 915992344 XHCKPRRCNWDNOD-YVMONPNESA-N 378.771 5.276 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CC12CC3CC(CC(C3)C1)C2 916901112 YVGVDMKQDGEASN-ZNWBTVJYSA-N 392.543 5.065 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)/C=C\c1ccc(OCc2ccncc2)cc1 917144625 AWVFNDHKYDSMJP-XFXZXTDPSA-N 395.462 5.255 30 20 GKED C=CCn1c(C)nn(CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1=S 917476348 DQNPTUZTJRPNMO-MRXNPFEDSA-N 383.348 5.010 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 920142593 LNIUKDQDVVFLOV-LIRRHRJNSA-N 389.455 5.191 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(C(F)(F)F)cc3)cc2)cc1 1776052191 NTEJUSSPIUXJJA-UHFFFAOYSA-N 384.357 5.517 30 20 GKED CC(C)Oc1ccccc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776362202 NXISTECEQXRELV-VAWYXSNFSA-N 376.408 5.328 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)c2c[nH]c3ccccc23)c1 1776787895 CIZAVHAVZSNIDK-HSZRJFAPSA-N 394.515 5.433 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(Cl)cc1Br 1777436140 KZYFBCQUJFMPMG-FNORWQNLSA-N 379.637 5.005 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(C(=O)O)cc1 1777487816 ZQISVDVNJYYSSC-WCIBSUBMSA-N 383.856 5.366 30 20 GKED N#Cc1ccc(-c2ccc3nc4cc(-c5ccc(C#N)cc5)ccc4nc3c2)cc1 1857791471 BAFWWHWPPLNBKP-UHFFFAOYSA-N 382.426 5.860 30 20 GKED C=CCN(C(=O)c1sc(-c2ccccc2)nc1C)c1nc2c(s1)CCCC2 17365507 HTSSHLQSPYYBPR-UHFFFAOYSA-N 395.553 5.287 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1nc2ccccc2o1 41544978 MFWSZFCPIKJTSR-AVRDEDQJSA-N 384.460 5.538 30 20 GKED CSc1cccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 42163347 BDZKXUPVCQDCJD-UHFFFAOYSA-N 390.533 5.825 30 20 GKED Cc1ccsc1CN(C)C(=O)c1ccccc1SCc1ccc(C#N)cc1 60533701 OYFSJVCQXWFPTJ-UHFFFAOYSA-N 392.549 5.493 30 20 GKED N#CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)CC1 61585034 WNZRQWVHXUFVEL-SDXDJHTJSA-N 397.478 5.080 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 104260636 WTIQMFIMOCZYGD-IBGZPJMESA-N 392.890 5.199 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 108199404 TZZVUTIEUYJLSN-CABCVRRESA-N 390.430 5.453 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 108407557 CETNJMPGFMMWDP-HIFRSBDPSA-N 387.936 5.339 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(F)cc1)CC1CC1 115769771 DDPJOAWJSLZIID-MRXNPFEDSA-N 397.519 5.664 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](Cc2ccc(F)cc2)C1 150975400 LBGXZLHYGKNNDQ-WMZOPIPTSA-N 397.519 5.316 30 20 GKED N#C[C@H](C(=O)CCc1ccc(F)cc1F)c1nc2cc(Cl)ccc2s1 152466942 XDIPYHLYXRJXRH-CYBMUJFWSA-N 376.815 5.037 30 20 GKED COc1cccc([C@H](C)CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 175947742 XZIWWRILLDNNBT-WBMJQRKESA-N 384.888 5.328 30 20 GKED Cc1sc([C@@H](C)NCc2cc(C#N)ccc2F)nc1-c1ccc(Cl)cc1 184946303 HNXXPZCHHFIJSY-GFCCVEGCSA-N 385.895 5.634 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(OCc2nccn2C)cc1)c1ccc(F)c(F)c1 186447482 MFXFCWGPNWXCAW-WAIKUNEKSA-N 397.469 5.245 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H]1c2ccccc2C=CN1C(C)=O 189875164 ISZATWUVZMCUOO-HSZRJFAPSA-N 388.511 5.441 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(Cl)c1Br)c1ccccc1 191716564 XUTFZAMLHAVBNT-AWEZNQCLSA-N 392.684 5.269 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3cc4cnn(C(C)C)c4nc3Cl)c2c1 255115781 SSWQRBNQDNINHC-DAXSKMNVSA-N 394.862 5.052 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 255547530 HXNKASMOPWTONE-SDQPKGBYSA-N 389.263 5.600 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC(C)(C#N)CC3)cc2)cc1 272601395 XNTXMCGWUYKUHP-UHFFFAOYSA-N 381.501 5.004 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 302758409 VHRAUGKEUBZVFY-INIZCTEOSA-N 382.872 5.271 30 20 GKED Cc1ccccc1CSCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 303449784 JGVVQPCHDMSUJY-SFHVURJKSA-N 378.522 5.228 30 20 GKED N#Cc1cccc(OCCCCC(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)c1 303493173 QEGDFWCPORQNBY-JOCHJYFZSA-N 382.891 5.028 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)s1 303800060 WPSYAUZHDVSABJ-HNNXBMFYSA-N 376.481 5.082 30 20 GKED COc1ccccc1C1(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)CC1 329338783 NHGNCIPXUCSLHA-LJQANCHMSA-N 379.504 5.073 30 20 GKED N#Cc1c(F)ccc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)c1Cl 431581389 ZOCZFBXAEMDQQC-FMIVXFBMSA-N 386.835 5.366 30 20 GKED C[C@@H](Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)c1ccc(C#N)cc1 432512576 HNYMYYKDPZANPQ-GFCCVEGCSA-N 385.254 5.620 30 20 GKED COc1ccc([C@H](C)CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 438048640 KCQOWLKKAWPMQA-IAGOWNOFSA-N 397.544 5.405 30 20 GKED N#Cc1ccc(CNc2ccccc2NC(=O)C[C@@H]2C=CCC2)c(OC(F)F)c1 439558932 ZDVCXONFEWRUNA-OAHLLOKOSA-N 397.425 5.067 30 20 GKED CC(C)(NC(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 440086547 HNVXNICROHCYJN-GOSISDBHSA-N 389.421 5.285 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H]1CCOC2(CCC2)C1)c1ccc(C(F)(F)F)cc1 441537594 XNYQMHNLKSHDBP-ZWKOTPCHSA-N 396.453 5.114 30 20 GKED COCCC[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(F)cc1 442863973 FGKHLLICSWLWOV-RUZDIDTESA-N 388.486 5.622 30 20 GKED Cc1nc(C#N)c(C#N)n1Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 442897698 JIXIQRVVRIYRBR-UHFFFAOYSA-N 383.238 5.082 30 20 GKED C=C[C@](C)(CC)C(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 442902603 WRRSEMACHUEJHV-GBXCKJPGSA-N 376.500 5.027 30 20 GKED N#Cc1c(NC(=O)[C@@H]2SCCc3sccc32)sc2c1CCCCCC2 443873084 CFOAKQNJRGRVOB-QGZVFWFLSA-N 388.583 5.309 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 443953563 VUTDFUIVDWQNEO-UHFFFAOYSA-N 396.878 5.505 30 20 GKED O=C(Cc1ccc(NCC#Cc2cccc(Cl)c2)cc1)Nc1ccccc1F 448058008 HWZIJBQFGRXRCX-UHFFFAOYSA-N 392.861 5.124 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)Cc1cccc(F)c1 459401453 NXGAGPIJTZTSKI-CVEARBPZSA-N 385.508 5.315 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H]1CCCN(c2ccccc2Cl)C1=O 463925446 MSLOWCDKZJFKEB-MAUKXSAKSA-N 399.947 5.199 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 465021809 AHZLQVNDHGZHKM-CYBMUJFWSA-N 377.271 5.407 30 20 GKED CCN(C(=O)NCc1cc(C#N)ccc1F)[C@H](C)c1cccc(C(F)(F)F)c1 466192953 JBLZVTPHOXCZHG-CYBMUJFWSA-N 393.384 5.009 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)cc1)c1cc(C(F)(F)F)ccc1F 471152867 WKUNFOGKJSRUNB-UHFFFAOYSA-N 381.247 5.038 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1ccco1)c1ccccc1OC 472049386 QUVBREGHDZVFMC-QHCPKHFHSA-N 390.483 5.166 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1[N+](=O)[O-] 473582154 KERFREHKGKVUEB-CQSZACIVSA-N 383.473 5.222 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NCc2ccccc2COCc2ccccc2)cc1 474889438 HFKLIFFLAKGINE-UHFFFAOYSA-N 398.506 5.135 30 20 GKED N#CC[C@H](CC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1ccccc1 476401042 YGNPNGNXQSIHJN-GOSISDBHSA-N 398.959 5.511 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)cc1 476537711 RVMRNNVMUIBIDE-KRWDZBQOSA-N 378.369 5.050 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 477555507 FAVYBBNTNASEJJ-UHFFFAOYSA-N 389.458 5.848 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@@H]3C3CCC3)cc2F)c1 481683929 IQBOEIUCHAHLSL-OAQYLSRUSA-N 393.462 5.073 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(-c2ccc(Cl)cc2)no1 487376234 ITSAVOPTFXSWFG-AWEZNQCLSA-N 383.904 6.001 30 20 GKED N#CCCC[C@H](NC(=O)c1cnc(-c2ccccc2F)s1)c1ccccc1 487410373 XSYBYOCVOQRGMT-SFHVURJKSA-N 379.460 5.114 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCc2nc(-c3ccccc3F)cs2)cc1 487873997 OVLXDVSZRGZISF-UHFFFAOYSA-N 394.475 5.072 30 20 GKED N#Cc1cccc(NC(=O)[C@H](Oc2ccc(F)cc2Cl)c2ccccc2)c1 499623388 CPQWLPVXPBQRGT-HXUWFJFHSA-N 380.806 5.110 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1c(Cl)cccc1Cl 499845114 MCFBALSGBKXMHX-IOASZLSFSA-N 379.674 5.131 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1nc2ccccc2o1 500748982 WRRTUSHCASUPPT-UHFFFAOYSA-N 397.434 5.372 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc(Cl)cc3F)c2)cc1 501438383 TVXNFGOTSJKINM-UHFFFAOYSA-N 394.833 5.376 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(C)c1 502516399 DKBJYKWLYWQBBE-QGZVFWFLSA-N 397.544 6.212 30 20 GKED C[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccccc1-c1ccc(Cl)cc1 504428285 XYHTWHSQSFJDBI-INIZCTEOSA-N 381.907 5.403 30 20 GKED N#Cc1ccc(Cl)c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c1 505995776 KPLJCPKRDVDUSZ-HXUWFJFHSA-N 399.881 5.255 30 20 GKED C=CCN(Cc1csc(-c2ccccc2OC)n1)Cc1ccc(Cl)s1 510122919 DNQFSSHGFCOBEQ-UHFFFAOYSA-N 390.961 5.722 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(-c2ccccc2)s1 511135324 OGKVHJUVKPEFSJ-UHFFFAOYSA-N 387.489 5.663 30 20 GKED CC(C)c1cc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)nn1C(C)(C)C 511154297 IUSICBHIAVIPSK-UHFFFAOYSA-N 392.528 5.614 30 20 GKED C[C@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1c(F)cncc1F 513237280 XIKPENQGBFBMCO-BDAKNGLRSA-N 398.297 5.809 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 513665058 BNROUDWOAVCCQH-CQSZACIVSA-N 390.489 5.523 30 20 GKED COc1ccc2oc(C(=O)N[C@H](C#N)c3ccc(C(C)(C)C)cc3)c(C)c2c1 517492240 PIFUFBAKLKOMEA-LJQANCHMSA-N 376.456 5.042 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)oc2ccc(Cl)cc12 521886442 XIEYWTGWHFXUEB-HNNXBMFYSA-N 392.764 5.408 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)cc1 522945231 WPALQVXJDNHZKS-UHFFFAOYSA-N 386.426 5.055 30 20 GKED C=CCc1ccc(OCC(=O)N2Cc3ccccc3-c3ccccc3C2)c(OC)c1 523621569 JJZULXLNEJQCMT-UHFFFAOYSA-N 399.490 5.012 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1cccnc1 523716225 MDIAKRFKGWFYIR-KRWDZBQOSA-N 387.458 5.128 30 20 GKED CC[C@@H]1CCC[C@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 524724630 GMYXSAFMVKZGKC-XLIONFOSSA-N 378.541 5.549 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C)c1ccccc1 533904091 DGVLCHABGWZCBW-FQEVSTJZSA-N 390.527 5.166 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2c[nH]c3cc(F)ccc23)CC1)c1ccccc1 533950023 PPCMRKSXFDXSJB-KRWDZBQOSA-N 376.475 5.373 30 20 GKED C=C[C@H](CC(=O)Nc1nnc(SCc2cccs2)s1)c1ccccc1 536308924 USLSXEGDZKNDSO-CYBMUJFWSA-N 387.555 5.190 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)Nc2cccc(OCCCC#N)c2)cc1 539627854 NLDKTVGFYXGBPG-GOSISDBHSA-N 394.519 5.416 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 552059866 NXQOLDJYZZTDJN-UHFFFAOYSA-N 382.250 5.488 30 20 GKED N#CC1CCC(CN[C@H](c2ccc(F)cc2)c2ccc(Br)o2)CC1 556177891 PWOWJCFKLVRBTE-SVGDTCPJSA-N 391.284 5.190 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc2c(F)ccc(F)c2c1 559650891 KDBJKTOJOIADLP-GFCCVEGCSA-N 383.423 5.017 30 20 GKED CC(C)Oc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nc1 559988977 JWCFAWFLXGCFFL-INIZCTEOSA-N 397.887 5.136 30 20 GKED N#CC1(Cc2nc(-c3ccccc3Nc3ccccc3C(F)(F)F)no2)CC1 590270956 PDNAUAWFMQQXTC-UHFFFAOYSA-N 384.361 5.345 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c1 603765446 VAMUFDFXTLGKHE-UHFFFAOYSA-N 395.871 5.373 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCC(c1ccccc1)c1ccccc1 608917588 KLMNJXALERGRCJ-UHFFFAOYSA-N 397.522 5.310 30 20 GKED CCCN(C(=O)NCc1ccc(C#N)cc1F)[C@@H](C)c1cc2ccccc2o1 609253078 RLBQUNIADCLCPX-HNNXBMFYSA-N 379.435 5.126 30 20 GKED C=CCc1cc(C(=O)N(CCC)c2cc(Cl)ccc2C#N)cc(OC)c1OC 609286585 SSLWAIRQIUTBNY-UHFFFAOYSA-N 398.890 5.014 30 20 GKED COc1cccc(Cl)c1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 610226293 VEPKQSIBPFVFOK-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)C1 612294351 LFQTZEVAIROPCP-NRFANRHFSA-N 376.485 5.121 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1 727595477 SERWDWGTMLJWLF-UHFFFAOYSA-N 379.529 5.645 30 20 GKED C=CC[C@H](NC(=O)NCc1ccccc1Oc1cccc(F)c1)c1ccncc1 734668896 NHTPBXXFOVLISB-NRFANRHFSA-N 391.446 5.130 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)NC(C1CC1)C1CC1 734760635 PZNXKSMACZPRIA-UHFFFAOYSA-N 399.507 5.186 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(OC3CCCCC3)cc2)cc1Cl 734762642 HCAUWKPINDJORR-UHFFFAOYSA-N 385.920 5.732 30 20 GKED C[C@@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1nc2ccccc2s1 737855819 XCPXVTGCIONQRQ-OAHLLOKOSA-N 398.491 5.403 30 20 GKED COc1cc(/C=C\C(=O)c2ccsc2)cc(Br)c1OC(F)F 749105732 XPYZAWWCPNAGLZ-IHWYPQMZSA-N 389.217 5.017 30 20 GKED O=C1/C(=C\c2coc(-c3ccccc3)n2)Cc2c(F)cc(Br)cc21 749891408 JIPVTOKFVFHQNL-SDQBBNPISA-N 384.204 5.066 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)CCc1ccc(Cl)c(Cl)c1 751059830 RKAXHWQGYBPHAB-UHFFFAOYSA-N 384.646 5.065 30 20 GKED N#Cc1ccc(Br)c(CSC2=Nc3ccccc3CS2)c1 754886491 HDJMYXOJHOOFLD-UHFFFAOYSA-N 375.316 5.488 30 20 GKED C=C(C)[C@H](CC(=O)O[C@@H](c1cccnc1)c1cccc(C(F)(F)F)c1)OCC 759594429 GNYMHOYRDILZRF-AZUAARDMSA-N 393.405 5.104 30 20 GKED C=C(C)[C@@H](CC(=O)O[C@H](c1cccnc1)c1cccc(C(F)(F)F)c1)OCC 759594433 GNYMHOYRDILZRF-QUCCMNQESA-N 393.405 5.104 30 20 GKED O=C(/C=C/c1cc(F)cc(C(F)(F)F)c1)c1cc(Br)ncc1F 762428521 ZJBUJTBXCADOOC-OWOJBTEDSA-N 392.121 5.037 30 20 GKED CC(C)Oc1cc(O)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 762700548 AJAJGXHOBVXGID-UHFFFAOYSA-N 388.423 5.096 30 20 GKED Cc1ccc(F)c(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)c1 763288646 INRXTOIBMBQLFG-BENRWUELSA-N 393.845 5.936 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cc(C(F)F)ccc2Cl)c1 769007000 ACUPIHOQZTZQQW-CQSZACIVSA-N 393.821 5.280 30 20 GKED N#Cc1ccc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c(Cl)c1 769727189 AFBNPSMCVGVRPS-UHFFFAOYSA-N 395.460 5.473 30 20 GKED CC(C)(C)Sc1cc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccn1 779207236 ZHQFFZIWBYQKQC-CYBMUJFWSA-N 385.489 5.211 30 20 GKED Fc1ccc(C(C[C@H]2CCOC2)=NNc2ccc(OCC(F)(F)F)cc2)cc1 793004879 QFQOJNRODVYMDN-CQSZACIVSA-N 396.384 5.010 30 20 GKED CCCNc1ccc(C#N)cc1NCc1ccc(C(=O)Nc2ccccc2)cc1 795267488 YZEKJPGHRBJHAT-UHFFFAOYSA-N 384.483 5.245 30 20 GKED N#CC[C@H](CC(=O)OCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 795991930 PQAMAPQVPFMTLE-JOCHJYFZSA-N 398.462 5.070 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570945 MDAXVNCWHRWNKS-TZMCWYRMSA-N 376.909 5.046 30 20 GKED N#CC1(CCCOC(=O)c2ccccc2Sc2ccccc2)CCOCC1 800175262 LMHZEJFJRBRGBN-UHFFFAOYSA-N 381.497 5.095 30 20 GKED N#C[C@@H](C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1nc2cc(F)ccc2s1 802077339 RCSZBOJWKNPAON-SWLSCSKDSA-N 396.340 5.341 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 804560226 WXZDLQCFXMDPBN-INIZCTEOSA-N 393.453 5.191 30 20 GKED C#CC[C@@H](NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1)c1ccccc1 805234872 SHGQYATUOIIGSA-FGZHOGPDSA-N 382.454 5.023 30 20 GKED C#C[C@@H](NC(=O)N(CCC(F)(F)F)Cc1ccccc1)c1ccc(Cl)cc1 811960876 ARCXURFSZUGDPZ-GOSISDBHSA-N 394.824 5.179 30 20 GKED CC(=NNc1cncc(Br)c1)c1sc(-c2ccccc2)nc1C 814887607 UOPGGFUWRGMDIL-UHFFFAOYSA-N 387.306 5.112 30 20 GKED CC1(C)C[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c2ccccc2O1 842291762 NUMKVGCZLVJGHD-MSOLQXFVSA-N 388.492 5.331 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC=CC[C@H]1C(F)(F)F 878676203 OZXLFGZZFYBAAV-BFHYXJOUSA-N 383.439 5.099 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1sccc1Br 915049720 ZYGJYWRKZLOUSD-UHFFFAOYSA-N 380.698 5.548 30 20 GKED Cc1ccccc1OCCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915085285 KGVKBMZLMHNEQS-HSZRJFAPSA-N 384.479 5.448 30 20 GKED CC(=NNC(=S)Nc1cccnc1)c1ccc(-c2ccccc2Cl)s1 915109905 JMBHIWBDXPAQIP-UHFFFAOYSA-N 386.933 5.174 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)cc1OC 917146304 JFDHUFKXDYIEMQ-BENRWUELSA-N 388.467 5.227 30 20 GKED Cn1c2ccccc2c2cc(C(=O)Nc3cccc(OCCCC#N)c3)sc21 917726719 NHNQWNQKIRSBCH-UHFFFAOYSA-N 389.480 5.328 30 20 GKED N#C[C@@H](C(=O)Cn1ccc2ccc(Cl)cc21)c1nc(-c2ccccc2)cs1 920113232 CLYGKLZUEVXFGZ-KRWDZBQOSA-N 391.883 5.295 30 20 GKED CC(=NNc1cccc(Cl)c1F)c1ccc(S(=O)(=O)C2CCCC2)cc1 921137909 SYAZYZXCMBAEDK-UHFFFAOYSA-N 394.899 5.032 30 20 GKED CCCCCC/C(C=NNc1ccc(C(=O)O)cc1OC)=C\c1ccccc1 1776049766 ACTQYBZUHJBVOO-ZOUBAHHOSA-N 380.488 5.845 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(Cc1ccccc1)CC1CCCCC1 1776051442 KZTFQEWWJKAQNS-UHFFFAOYSA-N 380.488 5.374 30 20 GKED Cc1c(NN=C(CC(C)C)c2cccc(Br)c2)cccc1C(=O)O 1776088035 LTHMVXIFYWDIDA-UHFFFAOYSA-N 389.293 5.318 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2cccc(Oc3ccc(Cl)cc3)c2)CC1 1776162221 HVPQMFWYMBENTL-UHFFFAOYSA-N 385.891 5.375 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1Cl 1776354574 MKFYJPLNRKFYIJ-VURMDHGXSA-N 379.239 5.375 30 20 GKED CCCCCCCOc1ccc(CN[C@H](Cc2cc(C)cc(C)c2)C(=O)O)cc1 1776786422 GLBIGTWUHXTLME-XMMPIXPASA-N 397.559 5.438 30 20 GKED CCCCCCCOc1ccc(CN[C@@H]2CCCCCC[C@@H]2C(=O)O)cc1 1776788433 FENRGTHUYNQCML-FCHUYYIVSA-N 375.553 5.549 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)c(Cl)c3)o2)c1 1777686218 YKXRPHCVLHIKIO-YVMONPNESA-N 387.218 5.848 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1791243216 FQUZDXCWFYKWSH-UWJYYQICSA-N 394.490 5.044 30 20 GKED O=C(/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1)c1cccc(F)c1 23986789 JJKCPPKTAOVLEP-VAWYXSNFSA-N 383.426 5.029 30 20 GKED N#Cc1ccc(F)c(CN2CCC(c3nc4cc(Cl)ccc4s3)CC2)c1 25037214 ZAKQITSKFNYAPR-UHFFFAOYSA-N 385.895 5.340 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc(OC(F)F)cc1 25174870 PKCLJFSSCDSGMK-JLHYYAGUSA-N 381.378 5.158 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CSc3ccncc3)cc2Cl)cc1 56036917 WGGRDKXVBVKCGH-UHFFFAOYSA-N 395.871 5.130 30 20 GKED C=CCN(C(=O)c1cccc(OCCC)c1)c1nc(-c2ccccc2)cs1 59273077 FHUTZIOTDNCNPC-UHFFFAOYSA-N 378.497 5.432 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)(F)F)cc3)n2)cc1 60477244 GWTAEXWHHLMXTK-MRXNPFEDSA-N 386.398 5.627 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1ccccc1C(F)(F)F 66907345 HOHAWYVFHACLLB-GFCCVEGCSA-N 379.407 5.744 30 20 GKED C[C@H](Nc1ccc(NC(=O)[C@@H](C)Oc2ccc(C#N)cc2)cc1)c1ccccc1 68360863 UKBVXUXJZISQOJ-ZWKOTPCHSA-N 385.467 5.137 30 20 GKED N#CCOc1ccccc1C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1 115125591 CCVJZZNJZISUSO-UHFFFAOYSA-N 395.418 5.182 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3ccc(F)cc3OCC#N)sc2C)cc1 120500848 PAMCUZBPEBUBMW-UHFFFAOYSA-N 396.443 5.026 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122026262 POGHHTMLXADCOJ-KXBFYZLASA-N 375.497 5.138 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 131948739 GFISSKZQWRDMOQ-RDTXWAMCSA-N 375.394 5.111 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)c1 180090774 ZWACDJNOCBLCBW-RXVVDRJESA-N 377.488 5.435 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1ccccc1C(C)(C)C#N 183743947 ZDKLCPHNUXAFEA-INIZCTEOSA-N 375.541 5.771 30 20 GKED C=C(C)[C@H](NCc1ccc(SC(=O)N(C)C)cc1)c1ccc(F)c(F)c1 187777753 UGECMZOPVDGECA-IBGZPJMESA-N 376.472 5.146 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)c1ccccc1 188774123 ZCUCRDSCYWKJQQ-VQIMIIECSA-N 385.891 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CC(=O)Nc1cccc(C)c1C 191424625 BILJOYVRLVGMLH-UHFFFAOYSA-N 393.531 5.258 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C\c2ccccc2OC(F)(F)F)n1 255870795 ZPXKMPYEXSODMC-WSROAFLRSA-N 380.391 5.055 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl)[C@@H](C)c1ccc(C#N)cc1 303545990 ZHXJCYJDUAHUAP-DOPJRALCSA-N 387.310 5.578 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccc(F)c1 303791032 QHHMVKJUZWKLHV-UHFFFAOYSA-N 388.442 5.193 30 20 GKED COc1ccc2c(c1)c(C(=O)Nc1ccc(CC#N)cc1)c(C)n2C1CCCC1 303866290 HWDUKIZRRHVIOC-UHFFFAOYSA-N 387.483 5.392 30 20 GKED Cc1c(C(=O)Nc2ccc(OC(F)F)c(F)c2)sc2ccc(C#N)cc12 428143817 WTCIDWCVPBGVBY-UHFFFAOYSA-N 376.359 5.074 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(CCC#N)CC1CC1 429060426 LWDLGTHPFZXMHW-GOSISDBHSA-N 377.488 5.293 30 20 GKED C=CCC[C@@H](NCc1ncc(C(F)(F)F)s1)c1ccc(C(F)(F)F)cc1 433337422 YWGUXBHVKIZITQ-CYBMUJFWSA-N 394.384 5.978 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Oc1cccc2ccccc12 435856379 NIZVYIJAFAZLGM-IRXDYDNUSA-N 390.508 5.640 30 20 GKED CC(C)(C#N)CCCCOc1c([N+](=O)[O-])cnc2ccc(Br)cc12 436209942 MHYXLPMXCJYOIS-UHFFFAOYSA-N 392.253 5.004 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)NCC1CCC(C#N)CC1 441624913 LDGYNHJNGINPLS-UHFFFAOYSA-N 377.488 5.026 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)c2ccccc21 444243523 IMYLLMOHTLJDHY-HNAYVOBHSA-N 395.865 5.023 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 455131491 BUPDHZHPYCPUBJ-OAQYLSRUSA-N 393.531 5.948 30 20 GKED Cc1nc(C)c(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)s1 460339376 NVELNLHTHBIGKU-UHFFFAOYSA-N 381.888 5.132 30 20 GKED C=CCC(CC=C)C(=O)Nc1c(-c2ccc(Cl)cc2)c(C(F)(F)F)nn1C 468718963 VLLHNKLRUBZAER-UHFFFAOYSA-N 397.828 5.466 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccc(F)cc3-c3ccc(F)cc3)o2)c1 471658404 LMTWXWIMUBXQMS-UHFFFAOYSA-N 388.377 5.166 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)c(C(F)(F)F)o1 471722389 CFCWBJVHKWTXGU-UHFFFAOYSA-N 382.407 5.451 30 20 GKED C=CCN(C(=O)c1csc(C(F)(F)F)n1)c1nc(-c2ccccc2)cs1 472910914 ZKEWWGPCPWFAIQ-UHFFFAOYSA-N 395.431 5.118 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)C[C@H](CC#N)c1ccccc1 476529212 DZDUJEUQAODSPC-INIZCTEOSA-N 385.305 5.599 30 20 GKED C=C(C)[C@@H](NC(=O)NCc1coc(-c2ccc(C)cc2)n1)c1ccc(F)c(F)c1 477732186 RLVFGTXBHONEEC-HXUWFJFHSA-N 397.425 5.045 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC[C@@H]1c1cccc(OC)c1)c1ccc(F)c(F)c1 477736463 ANAJJTYGIGDQAP-RTWAWAEBSA-N 386.442 5.137 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(Cl)ccc1Br)c1ccccc1 483866149 ZRJPAQWTPOQTPG-ZDUSSCGKSA-N 377.669 5.129 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N2CCCCCC2)cc1C 489479413 JHGKZYYDCHMESQ-UHFFFAOYSA-N 383.561 5.657 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3csc(C4CCCC4)n3)o2)cc1 489797754 OQRSFRFULVQHIP-UHFFFAOYSA-N 399.541 5.708 30 20 GKED CCCN(Cc1ccccc1C(C)(C)C#N)[C@H](C)C(=O)Nc1ccccc1C 490046231 UFJSALUECSKRTP-LJQANCHMSA-N 377.532 5.035 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)CC1 507581568 TVTSBBGEYCTKPV-JULQRDMDSA-N 378.491 5.040 30 20 GKED C[C@@H](NCc1ccc(-c2cnn(C)c2)s1)c1ccc(-c2cccc(C#N)c2)cc1 509469836 JTPLPJDIEIPDTG-QGZVFWFLSA-N 398.535 5.538 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1coc(-c2ccc(Cl)cc2)n1 512521220 AYDRDSBJZDEWLO-UHFFFAOYSA-N 384.911 5.351 30 20 GKED CC(C)(C)CN(CCC#N)Cc1cccc(NC(=O)c2ccccc2Cl)c1 513745686 DRTFYFTUPVMTNM-UHFFFAOYSA-N 383.923 5.354 30 20 GKED N#Cc1cccc(OCCSCc2ccc(C(=O)Nc3ccccc3)cc2)c1 515721763 MUUOJFHXSNXWDH-UHFFFAOYSA-N 388.492 5.123 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)cc1 518165714 QALDWTMMEJVRMA-HRAATJIYSA-N 379.529 5.520 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1C(F)(F)F 518756009 VJANWJZQDQGKGV-ZDUSSCGKSA-N 393.434 5.421 30 20 GKED CCC(CC)CN(CCC#N)C(=O)CCCc1ccc(Br)s1 519155038 LHOXMHDBRCLSCT-UHFFFAOYSA-N 385.371 5.012 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 521075460 QTECIFLYLISUTA-OAQYLSRUSA-N 379.479 5.182 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@]1(C#N)CCC[C@H](C)C1 524197686 VDQHTTHAEQVSPL-DYZYQPBXSA-N 379.938 5.036 30 20 GKED C=CCC[C@@H](NCCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1 537157329 AAJQDAQIAIALPM-HXUWFJFHSA-N 377.444 5.089 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1CCCOc2c(Cl)cccc21 540487160 NLVWMQITNSCMFW-KRWDZBQOSA-N 376.909 5.013 30 20 GKED Fc1cccc([C@H](NCc2cccc(OCC(F)(F)F)c2)C(F)(F)F)c1F 542262476 XORKCZPGKVEHQK-HNNXBMFYSA-N 399.281 5.299 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3cnc4ccsc4c3)no2)c2ccccc21 545713317 AHQXVGDIEUNWEI-VOTSOKGWSA-N 397.463 5.385 30 20 GKED N#Cc1ccc(OCc2cccc(-c3nc([C@@H]4CCCCS4)no3)c2)cc1 545813969 PMKNRNKKOTWCCP-IBGZPJMESA-N 377.469 5.145 30 20 GKED CCN(CC)C(=O)c1ccc(NCc2ccc(F)c(C#N)c2Cl)cc1Cl 556332833 LGYROTMWTFPCDM-UHFFFAOYSA-N 394.277 5.098 30 20 GKED COc1ccccc1[C@@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccco1 576676392 LGCJJBQCFQCIQJ-HXUWFJFHSA-N 386.373 5.058 30 20 GKED N#Cc1cccc(OCCCn2ccc(=O)c3cc(Oc4ccccc4)ccc32)c1 576743285 LJGYHBSLIJKHLV-UHFFFAOYSA-N 396.446 5.135 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(Cl)c1C 579298069 HDJXCZBGLYUSGR-UHFFFAOYSA-N 377.831 5.268 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)CCCCCC#N 588381023 LEYRXKNOBYAASZ-UHFFFAOYSA-N 378.451 5.100 30 20 GKED C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)CCCCCC#N 588869415 OWNDSSGLZVBKNQ-HOTGVXAUSA-N 389.927 5.156 30 20 GKED CSCc1cccnc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 589450907 VATYQOSSGARKNO-OAHLLOKOSA-N 399.928 5.212 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@H]1OCc2cc(Cl)ccc21 593976755 XZWSFEKXESHHLE-FZKQIMNGSA-N 386.904 5.334 30 20 GKED N#CCCN(C(=O)c1ccc(C(F)F)cc1F)C12CC3CC(CC(C3)C1)C2 594006014 OQWLIYGGDFFXLV-UHFFFAOYSA-N 376.422 5.088 30 20 GKED C[C@H](NC(=O)CCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 594012722 NCWCLAMMIOPEIW-ZDUSSCGKSA-N 380.435 5.695 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596241671 VWWZKWRMHFYXBJ-QAPCUYQASA-N 381.442 5.128 30 20 GKED C=CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@@H](C)COC 596691125 IQFQXNGCALWWTI-OXJNMPFZSA-N 397.906 5.050 30 20 GKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)CCOCC1 597578866 SUJCSDXCEYAAOL-UHFFFAOYSA-N 389.282 5.309 30 20 GKED C[C@@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@H](CCCC#N)c1ccccc1 599048694 PQDWCBSJUZFGIH-KBXCAEBGSA-N 395.856 5.710 30 20 GKED C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1)c1cccc(C#N)c1 600847939 ZXDIHDIRPPLYJL-KBMIEXCESA-N 395.506 5.709 30 20 GKED COC(=O)CCSc1cc(Cl)ccc1NCc1ccc(Cl)cc1C#N 600857207 XIAWEJCYGVIODH-UHFFFAOYSA-N 395.311 5.132 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C2CCOCC2)cc1 601134228 CEONDGNQWHXEAT-INIZCTEOSA-N 380.513 5.227 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Nc1ccc2oc(C(C)C)nc2c1 602562142 DNNSSQCULQPMQD-OAHLLOKOSA-N 383.517 5.028 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1sc2c(c1C#N)CCCCC2 602774219 CDXRCHOWLXJVSX-UHFFFAOYSA-N 389.524 5.235 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)COC(c1ccccc1)c1ccccc1 603527005 DNNLGXQBVYTVEB-UHFFFAOYSA-N 398.506 5.101 30 20 GKED Cc1sc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)c(C#N)c1C 603819225 MNYCXEJQRSFHCP-UHFFFAOYSA-N 387.917 5.195 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@@H](C)CC#N 609435171 WESXETRGQBBWFI-FXAWDEMLSA-N 381.545 6.086 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ncoc3-c3ccccc3)cc2)c1 609558717 JMGNRFGBGNLOFI-UHFFFAOYSA-N 381.391 5.258 30 20 GKED C[C@H](N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)c1cccc2ccccc12 610158676 GZVBVJSWARHESQ-LSDHHAIUSA-N 377.875 5.043 30 20 GKED CCN(C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)[C@H](C)c1ccc(C#N)cc1 610226896 OZBNRNDYIHNOAR-CAYVGHNUSA-N 387.310 5.578 30 20 GKED C[C@@H](NC(=O)Nc1cccc(CSc2ccccn2)c1)c1cccc(C#N)c1 610323515 ZDKSZVOIXPYUFY-MRXNPFEDSA-N 388.496 5.128 30 20 GKED COc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c2ccccc12 613407057 GEOZQQZRCIMGFZ-MRXNPFEDSA-N 392.867 5.602 30 20 GKED N#Cc1cc(Cl)ccc1CNC1(c2cccc(C(F)(F)F)c2)CCOCC1 618546525 GJMVLEQZPXOTDV-UHFFFAOYSA-N 394.824 5.026 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(Cl)cc1F 642158558 SVSLUAVFTMQJQF-MBTKJCJQSA-N 391.714 5.118 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 642282385 MMHVHHCGEDHHHZ-MRXNPFEDSA-N 391.377 5.083 30 20 GKED O=C(Nc1cc(F)cc(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 675696350 ZSCIPRQKHAJJNC-OCAPTIKFSA-N 392.702 5.074 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(Oc2ccc(C)nn2)cc1)c1ccccc1 676445887 NUZBDTGEGWTEBS-OAQYLSRUSA-N 388.471 5.406 30 20 GKED FC(F)(F)c1ccc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)s1 683352456 CZFSPPORVYUVQR-YUMQZZPRSA-N 385.295 5.330 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1 727979998 AOJWWUHTPKZUGN-IERDGZPVSA-N 379.529 5.002 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1ccc(OCc2ccccc2)cc1 734096178 KRLGYJHRVUOOHT-FOCLMDBBSA-N 394.474 5.407 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(F)cc3C)o2)cc(OC)c1OC 734303566 UYZZYHOJEIJTSJ-RMKNXTFCSA-N 396.414 5.316 30 20 GKED O=C(/C=C\c1ccc(-c2c(F)cccc2F)o1)c1ccc(N2CCOC2=O)cc1 734368931 ZUEKVVJSMJXGKI-NTMALXAHSA-N 395.361 5.078 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccncc1 734661503 KOLLRVHTOSTAKP-VXKWHMMOSA-N 391.902 5.441 30 20 GKED C[C@H](CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccc(F)cc1 739591252 VDHXGCHYSRXZNZ-OAHLLOKOSA-N 378.472 5.236 30 20 GKED CC/C(=C\C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1cccc(Cl)c1 744512390 DJKWWYIQWUXWSR-XMJIKXADSA-N 382.891 5.131 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)c1 747198937 OMYUSZWKHAVIBI-QGZVFWFLSA-N 382.529 5.421 30 20 GKED N#Cc1csc(/C=C2\SC(=S)N(c3cccc4ccccc34)C2=O)c1 748660355 FYRLIZVDKRJDKW-MFOYZWKCSA-N 378.503 5.179 30 20 GKED COc1cccc(O)c1C=Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 766009745 NPJYTMKPPSQRMR-UHFFFAOYSA-N 398.821 5.196 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1cc(-c2cccs2)nc2ccccc12 766643383 HPHLBWAZFOTVRO-UHFFFAOYSA-N 385.448 5.096 30 20 GKED CC(C)C[C@H](NCc1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 772960016 POLQFILUOLAONB-FQEVSTJZSA-N 376.422 5.485 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(-c4ccccc4)[nH]3)cc2F)c1 779595679 LBGUJQWRCLWBQJ-UHFFFAOYSA-N 398.441 5.279 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)N3CCC(C)(C#N)CC3)c2cc1C 780779268 VIAYVZLEYYAMCV-UHFFFAOYSA-N 383.495 5.285 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c(F)c1 781107164 GAUFHFGAVVFNQN-TWGQIWQCSA-N 378.384 5.230 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1c[nH]c2ccccc12 786320617 CBCOLUKENVKTSJ-SWLSCSKDSA-N 393.899 5.801 30 20 GKED N#CCCn1cc(/C=C2/C(=O)c3cccc4c3[C@@H]2CCC4)c(-c2ccccc2)n1 788355982 SRROXORIYGLYRN-INKLHFNDSA-N 379.463 5.164 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 791104966 ZIQAGYXLWJRFDU-MSUUIHNZSA-N 386.451 5.555 30 20 GKED C#CCOc1cccc(-c2noc(-c3c(-c4ccccc4Cl)noc3C)n2)c1 809342845 WRHDSERZNZSGHC-UHFFFAOYSA-N 391.814 5.032 30 20 GKED N#Cc1cc(Oc2ccc(NC(=S)Nc3ccc(Cl)cc3)cc2)ccn1 811707465 CDCJOSNCPBQSCG-UHFFFAOYSA-N 380.860 5.208 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1 845840780 FOSAJDNTBXCXDH-CZUORRHYSA-N 386.278 5.107 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2Cc2ccccc2)cc1 915352382 HCKQWCDJRCFZAU-RPBOFIJWSA-N 395.506 5.581 30 20 GKED O=C(/C=C\c1c(Cl)nc2sccn12)c1ccc(N2CCCCC2)c(F)c1 916128932 KNGSCDZMBHOOGE-SREVYHEPSA-N 389.883 5.075 30 20 GKED N#C[C@H](C(=O)CCc1ccccc1Cl)c1nc2cc(Cl)ccc2s1 917043568 JSIWPRSBVVWVFL-CYBMUJFWSA-N 375.280 5.412 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(Cl)cc1 917430843 VIVBGMQMNWJHQY-CQSZACIVSA-N 389.307 5.757 30 20 GKED C=CCOc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)O)cc1Cl 1776120830 WLZUYPYBKIBFKT-NTCAYCPXSA-N 391.854 5.638 30 20 GKED Cc1c(/C=C/C(=O)c2ccc(OCC(C)C)cc2)nc2ccccc2c1C(=O)O 1776126331 JCZGYSAGLOZINL-OUKQBFOZSA-N 389.451 5.172 30 20 GKED C=C[C@H](CCC(=O)O)NCc1cc(Cl)ccc1Oc1ccc(Cl)cc1 1776148355 BBKLBPFZNROPDJ-MRXNPFEDSA-N 380.271 5.295 30 20 GKED CCCCCCCCCCCN(C)c1c(C(=O)O)cnc2ccc(OC)cc12 1776787762 QJAKKFLHWGEYIW-UHFFFAOYSA-N 386.536 5.909 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1OCC 1776814662 LYFRSIORQQFRBP-WAYWQWQTSA-N 394.876 5.183 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(Cl)cc1Br 1777436139 KZYFBCQUJFMPMG-ALCCZGGFSA-N 379.637 5.005 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Cl)ccc3Cl)c2c1 1777685808 ZMIAFKXXRIMXQD-KTAJNNJTSA-N 377.248 5.802 30 20 GKED COc1ccc([C@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)cc1F 47698348 CRNALWLJKKFDSY-KRWDZBQOSA-N 390.458 5.136 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1[nH]c2c(c1C)C(=O)CCC2 56469913 BCVRADLZPZMXHG-UHFFFAOYSA-N 399.450 5.067 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 60101226 GHJFHELKEFQJNV-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1N[C@@H](C)c1nnc(-c2ccccc2)o1 63641508 WXGTTWMOHQANGQ-KRWDZBQOSA-N 396.450 5.882 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(C(F)(F)F)c3)n2)cc1 66545023 GSONKUFWDZWTLW-MRXNPFEDSA-N 397.381 5.191 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1csc(-c2cccs2)n1 66802334 FXYHJRWBPBFNOU-ZDUSSCGKSA-N 399.566 5.447 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 66955099 BFWSZKJXICCWCZ-QFBILLFUSA-N 397.519 5.459 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)CC)nc2scc(-c3ccc(C)cc3)c2c1=O 71958170 ABLOWMAHKORDNA-AWEZNQCLSA-N 398.553 5.079 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1 121581408 ASCRGUBCSQBGGD-FQEVSTJZSA-N 397.931 5.284 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(F)c(Cl)c2)=C(/S)Nc2ccccc2)cc1 122081091 RMXYDASMVFLADE-UHFFFAOYSA-O 399.898 5.126 30 20 GKED CCCSCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 125669066 CJCOMRHXFBQFMJ-GFCCVEGCSA-N 385.341 5.436 30 20 GKED Cc1ccsc1CCCC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 129434807 QJABNFLTVLLPSI-ZDUSSCGKSA-N 395.311 5.034 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccnc2ccccc12)c1nc2cc(Cl)ccc2s1 158786581 BRXSZEMRLRLEGL-BIENSFFJSA-N 389.867 5.388 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)cc1C(F)(F)F 185731581 IIOALSHXLRDADP-LLVKDONJSA-N 398.837 5.863 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc3ccccc3c2O)ccc1OC 186029092 IWACXCPRPCBKNO-VQIMIIECSA-N 390.483 5.086 30 20 GKED N#Cc1ccc(SCC(=O)Nc2cccnc2-c2ccc(Cl)s2)cc1 187133834 WTBTZVRLBSUOMQ-UHFFFAOYSA-N 385.901 5.066 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H]1CCCN(C2CCC2)C1 191435272 JLYZTIDYVIDVLM-UYAOXDASSA-N 383.580 5.313 30 20 GKED COc1cc(C=NO[C@H](C)c2ncc(-c3ccccc3)o2)ccc1OC(C)C 255920831 IASPVFAMOGNYHJ-MRXNPFEDSA-N 380.444 5.249 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 303507158 SGFGYALIHKJQMJ-KBPBESRZSA-N 391.323 5.741 30 20 GKED CC(O)=Nc1ccc(F)c(N/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 329364286 FXRDHLVLZXNFCK-GOSISDBHSA-N 399.470 5.149 30 20 GKED O/C(CC1(Cc2nc3ccccc3s2)CCCCC1)=N/CC1CCOCC1 329553624 PUDFWZMVHSCIBX-UHFFFAOYSA-N 386.561 5.563 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1scc(C(C)(C)C)c1C#N 410931052 SGCUUIPJFBBMIQ-UHFFFAOYSA-N 379.485 5.062 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccccc1CNC)c1ccc(C(F)(F)F)cc1 415913884 SAQDUJRVAMFHMM-SFHVURJKSA-N 391.437 5.254 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1csc(-c2ccoc2)n1 425528943 ABIQYFRDGGDYGJ-CYBMUJFWSA-N 391.418 5.336 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 425915154 GYBHNSNCRHBLRG-JSGCOSHPSA-N 383.439 5.230 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430592974 OADHEEMXELQZQJ-SJLPKXTDSA-N 391.540 5.536 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)N[C@@H](CCC#N)c1ccccc1 438860371 QHBCKZRSZZXMSD-XXBNENTESA-N 375.516 5.604 30 20 GKED C[C@H]1CC[C@@H](CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)O1 439212280 FWVIIRCDAZGNOK-KXBFYZLASA-N 398.890 5.077 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)C1CC(F)(F)C1 440545326 CPXAGCJREZXJEJ-UHFFFAOYSA-N 375.309 5.046 30 20 GKED C[C@@H]1COCC[C@@H]1c1noc(-c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 442691857 YSCRLWSUEWBVLC-CJNGLKHVSA-N 395.846 5.194 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ncsc1-c1ccccc1 445829759 LETKZIMILVJPEI-CQSZACIVSA-N 379.510 5.314 30 20 GKED C=CCNC(=O)c1ccc(NCc2ccc(-c3nc4ccccc4s3)o2)cc1 446888305 GMVHZJBGPXWSCQ-UHFFFAOYSA-N 389.480 5.084 30 20 GKED CCCn1ncc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1C1CC1 454761469 NAPQEVPCDWXNDN-AWEZNQCLSA-N 383.521 5.209 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)[C@@H](C)c1cccc(C#N)c1 462215645 RJOYIPKKFHEWJL-RDJZCZTQSA-N 389.524 5.313 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(Oc2cccc(F)c2C#N)cc1 463084452 WCDFOIULAQEMLK-UHFFFAOYSA-N 380.806 5.420 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)c1cc(-c2cccc(C#N)c2)no1 469134391 TYAMDYDRGZZYMT-UHFFFAOYSA-N 393.446 5.152 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 470268509 YYSUIFHYUMGASD-SUMWQHHRSA-N 389.377 5.155 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(N2CCCCC2)cc1 471906121 PAMNJIZJAWGMHS-QGZVFWFLSA-N 379.529 5.323 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2csc(-c3cccc(Cl)c3)n2)n1 474449826 VYBNTXDQVKEWIB-ZDUSSCGKSA-N 387.917 5.533 30 20 GKED CCCc1c(NC(=O)C[C@H](CC#N)c2ccccc2)cnn1-c1ccccc1C 477130303 YGVZXRCUYCSRPZ-FQEVSTJZSA-N 386.499 5.159 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)c1ccco1 480482127 KNVDSXUALYXWSL-QHCPKHFHSA-N 387.483 5.108 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc2nc(C(F)F)[nH]c2c1)c1ccc(F)c(F)c1 480911136 SLXCCDDYBRMNAZ-MRXNPFEDSA-N 392.356 5.218 30 20 GKED CC[C@@H](C)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C 480922175 TXZSSDXXMYUMHL-PBHICJAKSA-N 378.501 5.085 30 20 GKED CCc1c(NC(=O)c2ccccc2-c2ccccc2C#N)cnn1C(CC)CC 482710097 ZIVPEXCPURWDER-UHFFFAOYSA-N 386.499 5.598 30 20 GKED CC(C)(C)C[C@H](O)CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 485707482 FOAHALUQJCOFDF-IEBWSBKVSA-N 384.907 5.121 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)on2)nnc1-c1ccccc1C 488920971 RWLNLZAHYSOHKG-UHFFFAOYSA-N 388.496 5.387 30 20 GKED C[C@H](CC1CC1)NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 497772071 WZWQYXDIFUFCBH-CQSZACIVSA-N 383.879 5.101 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2sccc2Cl)cc1Cl 506479302 FHFOSGLMXIXBPB-OAHLLOKOSA-N 387.291 5.963 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2ccc(Cl)cc2C#N)cn1 511444422 MYCGXJWWXOJPRN-UHFFFAOYSA-N 379.847 5.410 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2c(s1)-c1ccccc1OC2 514534103 SGDCFAOACIDHNV-UHFFFAOYSA-N 388.492 5.230 30 20 GKED CC(C)(C)[C@@H]1CCc2sc(C(=O)[C@H](C#N)c3nc4ccccc4o3)cc2C1 515597256 DMTHKMLMRCHHES-CABCVRRESA-N 378.497 5.530 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 520476001 WOXPFHSZPJSFHV-HXUWFJFHSA-N 379.504 5.093 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NC[C@@H]1CCc2ccccc21 521957107 QXYPCNMHSSALCR-IBGZPJMESA-N 384.504 5.169 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccc(F)c(F)c1 523955938 QVPJCOVAVXVQJR-UHFFFAOYSA-N 398.796 5.559 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524381148 OWMZSVDRPHZDAT-UHFFFAOYSA-N 394.858 5.046 30 20 GKED C[C@@H]1O[C@H](C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@@H]1C 525841979 ANGQERBQDSNAKS-IHSNIMORSA-N 397.906 5.025 30 20 GKED C[C@H](CC(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)Cc1cccc(F)c1 530589389 SKNFQHGOYMKABP-AWEZNQCLSA-N 379.460 5.028 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 533509441 XZFXYESTEKCUEK-JOCHJYFZSA-N 396.874 5.333 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(Br)cc2F)c(C#N)s1 534520007 PAZONLZOHVUVPH-UHFFFAOYSA-N 381.270 5.071 30 20 GKED Cc1cc(C#N)cnc1-c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 550966461 YXZJEDSRYSDEKC-UHFFFAOYSA-N 398.266 5.016 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)N1CCC(CCC#N)CC1 564450548 QBDVEYPRJOSVEE-UHFFFAOYSA-N 379.460 5.035 30 20 GKED Cc1cc(C#N)ccc1-c1nc(-c2ncoc2-c2cccc(C(F)(F)F)c2)no1 566706014 WECMYBHTQDWIMH-UHFFFAOYSA-N 396.328 5.258 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567203586 WEJNWXXYSAOFLV-IEBWSBKVSA-N 398.466 5.155 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N[C@@H](c3ccccc3)C3CC3)cc2)ccn1 569041709 XAZZQHNPAZKZPW-QFIPXVFZSA-N 384.439 5.018 30 20 GKED Cc1cc(C)cc(C2(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)CC2)c1 573615313 GZAJFRIGZZGKKN-UHFFFAOYSA-N 383.451 5.033 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H]3CSc4ccccc43)cc2)c1 580494441 DCFDUBRCERBPRA-HXUWFJFHSA-N 387.464 5.319 30 20 GKED N#CC1(CC(=O)Nc2ccc(Cl)cc2-c2cccc(Cl)c2Cl)CC1 590353719 SOOMSRQZTMHLAJ-UHFFFAOYSA-N 379.674 5.946 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609082747 XFGHIQPLGNVTNU-LLVKDONJSA-N 379.794 5.038 30 20 GKED CCC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccn1 609206833 HABJFQHIMKQMCA-NRFANRHFSA-N 386.455 5.408 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 609501914 JDUFWIRZSRNNKF-GJZGRUSLSA-N 389.282 5.394 30 20 GKED C[C@@H](C(=O)Nc1cc(C#N)ccc1OC(F)F)c1c(Cl)cccc1Cl 609579799 OPGLXSCKFUZHAK-SECBINFHSA-N 385.197 5.209 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc(Cl)cn2)c1 609722254 NJAZBQCEDYULME-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(CN3CCCCC3)c2)c(Cl)c1 611093389 MRNIWZAPPSZZLX-UHFFFAOYSA-N 388.298 5.103 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1 614176657 KALWDALKSUYWRI-QFIPXVFZSA-N 375.903 5.415 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2nc([C@H]3C[C@H]4CC[C@H]3C4)cs2)c(Cl)c1 616658908 QSCSGJSZWRZGNF-DLOVCJGASA-N 392.311 5.477 30 20 GKED N#C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)c1ccc(Cl)cc1 619863420 AQAHYPOMAYIHKV-KRWDZBQOSA-N 384.867 5.429 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nnc(-c2cccc(C)c2)o1 620676215 WIKWUSFJTCEQCF-UHFFFAOYSA-N 397.525 5.054 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1c(F)c(F)cc(F)c1F 673986721 TXLCJPVQWSGZLN-UHFFFAOYSA-N 387.201 5.149 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccccc1Oc1ccccc1 726074716 XVHRJWJGQXLPQV-QGZVFWFLSA-N 387.439 5.264 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1Br 726434553 LYVXXEYOUFAEQG-UHFFFAOYSA-N 380.698 5.092 30 20 GKED CC(C)N(Cc1cccc(Cl)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 726467336 UMSCIPQUVVGXAZ-UHFFFAOYSA-N 378.328 5.472 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(SCc3ccccc3)cc2)cc1 726940626 ZMQIWLPNYBAFNH-UHFFFAOYSA-N 386.520 5.848 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1O 727653845 AQCGEAMLPCWJHT-YCRREMRBSA-N 385.872 5.382 30 20 GKED O=C1/C(=C/c2cccc([N+](=O)[O-])c2)CCc2nc(-c3ccc(F)cc3)sc21 727685507 PPHHCMXMDGGSLW-GXDHUFHOSA-N 380.400 5.070 30 20 GKED CCn1nc(C)c(/C=C/C(=O)c2ccc(OCc3ccc(F)cc3)cc2)c1C 727974914 OBNOWXVAYXSOCU-BUHFOSPRSA-N 378.447 5.134 30 20 GKED CC(=NOCc1cccc(C(=O)N(C)C)c1)c1ccc(-c2ccc(F)cc2)s1 729674522 OZZSTCSSEATBSJ-UHFFFAOYSA-N 396.487 5.197 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730422096 TYMFEFALBWGTKT-RGPZOAQRSA-N 388.508 5.089 30 20 GKED CC(C)c1ccc(C=NOCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 731029400 ASHMCWRSIJVMEC-QGZVFWFLSA-N 395.528 5.193 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc3ccc(C(C)C)cc3[nH]2)cc1 731193003 YHSQJUQSNZHQOQ-UHFFFAOYSA-N 375.472 5.250 30 20 GKED C[C@H](CSc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 732496132 NWOJQKDHUBCZAZ-HIFRSBDPSA-N 385.439 5.036 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)cc2)nc1 733635546 AMOMCKKNBQOIID-UHFFFAOYSA-N 398.466 5.251 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)/N=C/c3cccc(OC)c3O)s2)cc1 733750441 ZFZMVJJDZXDHJS-UMYHVIPVSA-N 382.485 5.021 30 20 GKED O=C(/C=C/c1csc(-c2cccc(Br)c2)n1)c1cncc(F)c1 737444819 UBDKHECSDOOVOA-SNAWJCMRSA-N 389.249 5.003 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cnc(-c2ccccn2)s1 753145368 ZDDZLCQMSVEKHF-KHPPLWFESA-N 389.505 5.533 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc2ccccc2c1 753395606 OKLMNZVANQPYKG-SBUREZEXSA-N 392.458 5.444 30 20 GKED Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)O[C@H](C)C(C)(C)C#N 753620293 BYHXKHQVXZHDOB-LLVKDONJSA-N 382.407 5.232 30 20 GKED Cc1ccc(OCc2nc(C=NOc3ccccc3C(F)(F)F)cs2)cc1 754724043 MGLRWMQYNOPZBT-UHFFFAOYSA-N 392.402 5.462 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 762067507 HVANUMSUJKQWOA-CABZTGNLSA-N 383.325 5.046 30 20 GKED CCCCCCCCC(=O)N1[C@H]2CC[C@H]1CC(O)(Cc1ccc(F)cc1F)C2 765283852 HIBFMVIXCRSXKS-PMACEKPBSA-N 393.518 5.142 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccc3[nH]ccc3c2)cc1 765914575 CVRLMDQEYYCTHI-XAZJGODSSA-N 385.467 5.042 30 20 GKED Cc1oc2ccccc2c1CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 767956622 DXBRSADMEJYMPK-IBGZPJMESA-N 397.459 5.155 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@H](C)CCCc1ccccc1 776076502 HAIOOYKOBULNKK-GCJKJVERSA-N 390.527 5.118 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1 777384110 OMSFLEOKPCIYHK-UHFFFAOYSA-N 389.886 5.199 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(Br)cs2)cc1OC(F)F 782369653 NCMORFHUWWKIBC-DUXPYHPUSA-N 389.217 5.017 30 20 GKED N#CCSc1ccccc1C(=O)NCc1cnc(-c2ccc(Cl)cc2)s1 793485885 ORYJFZIKWJCIFD-UHFFFAOYSA-N 399.928 5.009 30 20 GKED CC(C)(C)c1ccc([C@H](O)CCC(=O)Nc2cccc(OCCCC#N)c2)cc1 798282006 UPFFBEHTVLZLFR-JOCHJYFZSA-N 394.515 5.119 30 20 GKED COc1cc(/C=C2/C(=O)c3cccc(C)c3[C@@H]2C)cc(OC)c1OCC(F)F 809157281 JEUNECNBRUQQMH-WJHGTXIHSA-N 388.410 5.040 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/C(=O)c3ccccc3[C@H]2C)cs1 809159627 STZTUEURYHKSNJ-AYPRBGQRSA-N 392.455 5.350 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813217029 ATEWDRPRPZAHGS-SUMWQHHRSA-N 390.405 5.042 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@@H]1c1ccccc1)c1nc2ccccc2n1C(F)F 835072020 ADWLTRBBVHWLAX-BRWVUGGUSA-N 379.410 5.192 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)F)cc2F)cc1 847625900 ANIJDFHGHZEFMD-YVEFUNNKSA-N 388.389 5.238 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1cccc(C(F)(F)F)n1 853310645 RJAMBGGXHVUPEX-UHFFFAOYSA-N 381.242 5.553 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 857439335 KCNOQTCZALRJOI-OAHLLOKOSA-N 393.302 5.393 30 20 GKED Cc1c(NC(=O)N[C@H](C)c2ccc(C#N)cc2)cccc1NC(=O)OC(C)(C)C 861401544 ZDFFPPJJAMEMFH-OAHLLOKOSA-N 394.475 5.096 30 20 GKED C[C@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)NC2CC2)cc1 915978982 KYUDFDRJOZNQES-ZOCVZFIWSA-N 392.286 5.163 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917045989 FDVAAWYWRUFXMH-DYVFJYSZSA-N 398.915 5.717 30 20 GKED CCOc1ccc2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)[nH]c2c1 917119470 HDAHFWFIHRTTQD-QFIPXVFZSA-N 395.462 5.474 30 20 GKED O=C(c1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1)N1CCCCC1 917559124 GZCHZXTXFUIUBO-UHFFFAOYSA-N 377.271 5.076 30 20 GKED CC(C)CN(CCC#N)Cn1nc(Nc2ccc(C(C)C)cc2)sc1=S 919944839 QHDWNSZDEWMJGB-UHFFFAOYSA-N 389.594 5.370 30 20 GKED COc1cccc2c1OC/C(=C/c1csc(-c3ccc(Cl)cc3)n1)C2=O 920067320 VLBNKOWPWDGLQT-LCYFTJDESA-N 383.856 5.131 30 20 GKED Cc1ccc(C)c(C(=O)/C=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c1 1776133761 QEKJFOISPZKSEE-XWDDPXMASA-N 386.447 5.404 30 20 GKED C=CCOc1ccc(/C=C\c2nc(C(=O)O)c(-c3ccccc3)s2)cc1OC 1776183928 JYIVWOAAUGDZRS-BENRWUELSA-N 393.464 5.252 30 20 GKED CCCCCCCCOc1ccc(CN2CCC[C@@](CC)(C(=O)O)C2)cc1 1776785570 MWZWJRAYXUZFDH-HSZRJFAPSA-N 375.553 5.503 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O 1777260631 NGTGDLHFRIRAKM-QUYTYNJFSA-N 384.431 5.200 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)ccc1Cl 1777263496 QPJBMGZFTRXWDK-MDWZMJQESA-N 392.838 5.610 30 20 GKED O=C(/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1)c1ccc(F)cc1 6339642 GBFHMIJOYWPDLM-JLHYYAGUSA-N 383.426 5.029 30 20 GKED Cc1ccccc1NC(=O)c1cc2ccccc2cc1OC[C@@H](C#N)CCC#N 30533312 IBGHETRFTPSNAJ-GOSISDBHSA-N 383.451 5.223 30 20 GKED Cc1ccc(-c2nc(C)c(/C(O)=N/c3nnc(-c4ccccc4)s3)s2)o1 31274547 JORAILGOVCKYRW-UHFFFAOYSA-N 382.470 5.175 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1[N+](=O)[O-] 46706885 GIWJVRGGQOEBQJ-HNNXBMFYSA-N 397.843 5.170 30 20 GKED C[C@H]1CCC[C@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 48161846 QGFBCHOMDHCNOG-PXNSSMCTSA-N 377.488 5.032 30 20 GKED N#C[C@H](C(=O)CCSc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 51533370 VHLSLYRTPRWMEP-QGZVFWFLSA-N 382.485 5.308 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(-c2nc3ccccc3s2)s1 64456459 HCOZFDCUCRVCCK-UHFFFAOYSA-N 391.477 5.157 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CC2(Cl)Cl)cc1Cl 97404277 LKEMMRFJQGIPDJ-CABCVRRESA-N 379.674 5.128 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1coc(-c2cccs2)n1 105952593 KIGZXAZVQXNCHJ-UHFFFAOYSA-N 391.477 5.184 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2cnc(-c3ccccc3)nc2)cc1 108314162 KRPGEMDEOOAKMF-KPKJPENVSA-N 376.843 5.171 30 20 GKED CCN(C(=O)CCC(=O)c1ccc2ccccc2c1)[C@@H](C)c1ccc(C#N)cc1 115763123 WQBWOICZQSURJS-SFHVURJKSA-N 384.479 5.284 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 129445807 LHDLTOXQZAGIFO-AWEZNQCLSA-N 392.484 5.546 30 20 GKED C=CCOc1ccccc1CNc1cccc(CS(=O)(=O)C2CCCCC2)c1 132497865 KINQWSOXWBRYRP-UHFFFAOYSA-N 399.556 5.111 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(Oc2nccs2)c1 134717648 HFLFZVXKSWURMY-CQSZACIVSA-N 395.509 5.439 30 20 GKED N#CCCCCNC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 171500412 YSVNCNXYVDTARC-UHFFFAOYSA-N 382.460 5.288 30 20 GKED Cc1nc(/C=C/c2cnn(C(C)C)c2)sc1C(=O)/C=C/c1cnn(C(C)C)c1 171981846 GMFKXJKNIKUDSV-CDJQDVQCSA-N 395.532 5.073 30 20 GKED N#CCc1ccc(NC(=O)CCSc2ccnc3cc(Cl)ccc23)cc1 176564192 KBWTYVKUZSQLSW-UHFFFAOYSA-N 381.888 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C2CC2)nc2c1c(C)nn2C 189881784 AMNGZBLMQWLGTA-UHFFFAOYSA-N 388.515 5.258 30 20 GKED Cc1cccc2nc(C3CCN(C(=O)Nc4ccc(C#N)c(Cl)c4)CC3)oc12 190049816 RXNGLCLDGXQXNW-UHFFFAOYSA-N 394.862 5.073 30 20 GKED C=C[C@@](C)(CC)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 190427716 KYXLGJPTGBSHKZ-QFIPXVFZSA-N 384.545 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCCO)[C@@H]1CCc2ccccc21 191460889 XFCXFJSHKYDWPE-HSZRJFAPSA-N 392.543 5.442 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(C#N)ccc1Br 191696791 WLTQXBCXDODBER-ZDUSSCGKSA-N 386.318 5.185 30 20 GKED COc1cc(/C=C\C(=O)c2cccc([N+](=O)[O-])c2)ccc1OCc1ccccc1 212543859 DXENPCPDGJUBEK-BENRWUELSA-N 389.407 5.079 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)cc1OC 248124507 DRTMGYQEIXZCMF-UHFFFAOYSA-N 399.450 5.056 30 20 GKED CC(C)[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Nc1ccccc1 248250261 IQQNZAKDAZALOR-DEOSSOPVSA-N 383.495 5.092 30 20 GKED CN(Cc1ccccc1F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 255940723 IXNUTHOELWSSGH-UHFFFAOYSA-N 379.275 5.136 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC(C(F)(F)F)(C(F)(F)F)C1 301389868 FZRFJTSEQOJKII-UHFFFAOYSA-N 393.718 5.081 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(NC3CCCC3)c2)cc(OC)c1OC 409564915 FQECXQSPJFVYKG-UHFFFAOYSA-N 380.488 5.039 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@H]1CCCC(F)(F)C1 409961946 GGKGRQQSBDZSQI-CABZTGNLSA-N 389.286 5.251 30 20 GKED C=CCC[C@H](NC(=O)N1CC2(CCOCC2)[C@@H]1c1ccccc1)c1ccccc1 413392734 DHFMOUYEAGXIDO-GOTSBHOMSA-N 390.527 5.257 30 20 GKED CSc1ccc(-c2csc(NC(=O)c3cccc(SCC#N)c3)n2)cc1 429955087 WUVVMSBCCABAPP-UHFFFAOYSA-N 397.550 5.400 30 20 GKED N#CCCC[C@H](NC(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccccc1 431816242 UZTYOPBZUDICBU-SFHVURJKSA-N 393.384 5.079 30 20 GKED CC(C)(C)C(C)(C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 432915172 DEJIBZWUERZLQP-UHFFFAOYSA-N 379.504 5.278 30 20 GKED N#CCCC[C@@H](NC[C@@H](O)Cn1c2ccccc2c2ccccc21)c1ccccc1 433019109 LPGQKFXWDFYDEF-ZJSXRUAMSA-N 397.522 5.180 30 20 GKED C[C@H]1CC2(CCC2)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 433522990 YLJYSLKVWUFDCP-INIZCTEOSA-N 393.462 5.073 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccccc1 435093561 FQHDLYRUJVZQPS-XMMPIXPASA-N 392.543 5.127 30 20 GKED CCCc1c(NC(=O)c2cccc3ccccc23)cnn1-c1cccc(C#N)c1 440086479 GYSZIRSVUBYUEF-UHFFFAOYSA-N 380.451 5.102 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])ccc1F 440479119 QHGXXFGDNXNIQQ-UHFFFAOYSA-N 393.399 5.009 30 20 GKED CC(C)(C#N)CCCCN(Cc1ccccc1F)c1ccc2nc(O)[nH]c2c1 444665729 PSSSLKXTSDNTHK-UHFFFAOYSA-N 380.467 5.134 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)CSc1ccc(F)cc1 445795781 RDNQWTLVTXLFDY-CABCVRRESA-N 388.533 5.444 30 20 GKED N#Cc1ccc(/C=C2/CCn3c2nc2scc(-c4ccccc4)c2c3=O)c(F)c1 448113903 OBRBPQWJYJBGJE-BOPFTXTBSA-N 399.450 5.080 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F 451690676 RDQFYWFTURTUFJ-VIFPVBQESA-N 375.284 5.074 30 20 GKED CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CCC([C@@H](F)c2ccccc2F)CC1 456045225 FRHDBCSINIOOQB-JOCHJYFZSA-N 396.481 5.215 30 20 GKED CN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 458853662 WXXAJBMJVMWREP-KSZLIROESA-N 381.442 5.184 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 463140959 AFZUSKNWFSRFTC-UHFFFAOYSA-N 376.387 5.141 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)o2)cc1 463752515 CDLWEGLSVASXBE-INIZCTEOSA-N 390.508 6.156 30 20 GKED N#Cc1csc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1 464071228 PCVVCIHDOXUFEV-UHFFFAOYSA-N 385.851 5.277 30 20 GKED C=CC1CCN(C(=O)N[C@@H](c2cccc(OC)c2)c2ccccc2Cl)CC1 466051648 PTOOWPICFZXBPN-NRFANRHFSA-N 384.907 5.046 30 20 GKED CO[C@@]1(C)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 471252709 WWCRWGKSFJUWGF-NRFANRHFSA-N 399.878 5.037 30 20 GKED CN(Cc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1)C1CCCCC1 474579765 SQQPRHJVWFCGDR-NRFANRHFSA-N 389.543 5.477 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)c1 474618787 CGWNHPZEAMVEJZ-GOSISDBHSA-N 385.414 5.146 30 20 GKED CC(C)c1cccc2c1CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C2 474717504 VAKOHJZBYJGAGJ-QGZVFWFLSA-N 393.556 5.794 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1coc(-c2ccc(C)cc2)n1 475571335 LPULXYIDTSPKTH-UHFFFAOYSA-N 389.499 5.824 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@H]2CCCc3nc(CC)sc32)c1 478643704 CHVZATGSXYGGRO-SFHVURJKSA-N 385.533 5.202 30 20 GKED C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482068826 QJRWKKMLFNXGEF-HNNXBMFYSA-N 392.405 5.462 30 20 GKED CN(C(=O)c1cccc(CC#N)c1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 482763822 AAUPKSXOGWPCQU-QFIPXVFZSA-N 392.861 5.407 30 20 GKED Cc1nc(COc2ccccc2C(=O)[C@H](C#N)c2nccc3ccccc23)cs1 483233477 IHLQUVRPGSOZLT-HXUWFJFHSA-N 399.475 5.069 30 20 GKED CCc1nc2cc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)ccc2o1 486985123 NCAWZSZJIUVRGW-UHFFFAOYSA-N 383.407 5.306 30 20 GKED CC(C)C[C@@H](NC(=O)CNc1ccccc1SCCC#N)c1ccccc1 487361149 GQJGAEARYKCXOC-HXUWFJFHSA-N 381.545 5.008 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1NCc1ccc(Oc2ccccc2)nc1 488239427 BWCKDTLAIGHQTD-UHFFFAOYSA-N 388.377 5.184 30 20 GKED COc1ccc(C#N)cc1NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 495391516 PQFOIQGLQNPNSO-IBGZPJMESA-N 397.887 5.193 30 20 GKED Cc1cccc(OCCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 500767536 FINVPDFPCQEMKE-UHFFFAOYSA-N 386.451 5.375 30 20 GKED Cc1ccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c(OCC(F)(F)F)c1 500907749 WLDZCCVQMMTVDB-UHFFFAOYSA-N 395.274 5.346 30 20 GKED Cc1cc(C)cc(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 502622391 MTLSXYWPPAZESD-UHFFFAOYSA-N 385.467 5.593 30 20 GKED COc1cc(C)sc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 504755720 KCEVOFPNBXMYJP-QGZVFWFLSA-N 396.899 5.626 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]2c2ccccc2)cc1 510673956 GFLBIOQQSLDTBK-JOCHJYFZSA-N 383.451 5.720 30 20 GKED Cc1ccccc1CN(C)C(=O)[C@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 517518025 ZLPKUURRTBCONY-IBGZPJMESA-N 399.494 5.118 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccccc3C(F)(F)F)cc2)nc1 517656313 DLKPSJLJCPKPOJ-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCCCN(CCOC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 518838298 BKDZQJZMKPQNAT-HXUWFJFHSA-N 399.922 5.276 30 20 GKED Cc1noc(C2CCC(N[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)CC2)n1 518873967 IDQQYQPQARMUPY-SGZOKEPCSA-N 386.499 5.294 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCCc2ccccc21 520194380 RLNHSWJVIFOCAG-JXFKEZNVSA-N 379.529 5.622 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(F)ccc2s1)c1ccc(Cl)c(Cl)c1 521886009 FHVHTXHQEKSEKW-AWEZNQCLSA-N 379.243 5.342 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 530843866 ZNLWDKOUFUBUNH-LJQANCHMSA-N 387.405 5.645 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c(C)n1 534874519 HTVHNPGHPBKJCK-UHFFFAOYSA-N 391.858 5.577 30 20 GKED N#CCc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)cc1 535330846 WTIOGYXKHFIKDG-UHFFFAOYSA-N 387.405 5.014 30 20 GKED CC(C)(C#N)c1ccccc1CSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 535506828 HKDBCQBFFAOIHT-UHFFFAOYSA-N 393.468 5.484 30 20 GKED CCN(C(=O)c1ccnc(Oc2ccccc2)c1)c1ccc(C#N)c(Cl)c1 536972133 AHEYRFPMFLNYGN-UHFFFAOYSA-N 377.831 5.066 30 20 GKED N#C[C@@H](C(=O)c1cccnc1Nc1ccc(Cl)c(Cl)c1)c1ccccn1 538365660 SASPRUMMKPIIBB-CQSZACIVSA-N 383.238 5.017 30 20 GKED CCN(C(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccc(C#N)c(Cl)c1 540274085 BCSFFSRRUKPFIW-UHFFFAOYSA-N 396.277 5.594 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccncc1)c1ccc(-c2cccc(C#N)c2)cc1 542090961 RMTOENYABGELIW-QZTJIDSGSA-N 384.483 5.084 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC=C(c3ccccc3F)C2)cc1 543852135 JLXQPTOUWDMIGM-UHFFFAOYSA-N 399.425 5.421 30 20 GKED N#Cc1ccc(Oc2cccc(-c3nc(-c4ccc5nccnc5c4)no3)c2)cc1 547141122 WRCGPCISBGZBNZ-UHFFFAOYSA-N 391.390 5.011 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(C(C)(C)C)cc1 553665350 VMWSAERRJRTAAP-KRWDZBQOSA-N 395.572 6.042 30 20 GKED C[C@H](NCc1cnc(-c2ccncc2)s1)c1ccc(-c2cccc(C#N)c2)cc1 554644389 JHVFSCGQHLVGFB-KRWDZBQOSA-N 396.519 5.595 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2ccc([C@@H]3CCOC3)cc2)c1 559341660 RIBNXEIHBFOERH-HSZRJFAPSA-N 384.479 5.253 30 20 GKED C=C[C@@](C)(CCOC)c1nc(-c2cccc(Oc3ccc(Cl)cc3)n2)no1 573362694 JJPFWBCRPYEGDF-FQEVSTJZSA-N 385.851 5.058 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cc2ccccc2o1 574371390 ABJWZJJSBMYKDN-OAHLLOKOSA-N 383.407 5.234 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2cccc(C(F)(F)F)c2)c1 576364797 JKDREHZRWMOEKL-UHFFFAOYSA-N 378.394 5.324 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1cc2c(s1)-c1ccccc1C(C)(C)C2 576548574 WKXGTWPNGGUWNL-NRFANRHFSA-N 384.570 5.014 30 20 GKED CC[C@H](N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(C#N)cc1 576695860 HIAXCTQBTAZASR-UUOWRZLLSA-N 383.495 5.612 30 20 GKED N#CCCC[C@H](NCc1cccc(OCc2ccccc2F)c1)c1ccccc1 577898261 CMPOIASXUPAMGV-VWLOTQADSA-N 388.486 5.929 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1cc(C#N)cc(N(C)C)c1)c1ccccc1 578676874 GWHQZTGQHPFYLG-KRWDZBQOSA-N 385.467 5.017 30 20 GKED Cc1csc(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)c1C#N 584137775 DRALDEXEDHSRCH-UHFFFAOYSA-N 388.448 5.506 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1 589739574 VQTNTZADRUJKKQ-IBGZPJMESA-N 389.499 5.534 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 590156503 QVEYTTQOCAUPCU-UHFFFAOYSA-N 386.455 5.079 30 20 GKED CC(C)Oc1ccc(-c2cccc([C@@H](C)N(C)C(=O)CC3(C#N)CC3)c2)cc1 590301158 YIELVEKXUIMGKG-GOSISDBHSA-N 376.500 5.354 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)[C@@H](C)Cc1ccc(C#N)cc1 593967267 PHYKCYNBZPHZHR-JKSUJKDBSA-N 389.524 5.046 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CSc1ccccc1C 603600857 GPUGTNVNEKSFSB-UHFFFAOYSA-N 389.480 5.093 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3(c4cccc(Cl)c4)CC3)cn2)c1 603623420 VZDDDBUZKBRWCU-UHFFFAOYSA-N 389.842 5.069 30 20 GKED N#Cc1ccnc(SCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 603725068 KUSXQKHZALWVED-UHFFFAOYSA-N 377.416 5.388 30 20 GKED Cc1sc(NC(=O)c2ccc(SCc3ccccc3)cc2)c(C#N)c1C 603947913 UKWPSYPSQBKCQV-UHFFFAOYSA-N 378.522 5.781 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)on2)cc1 603968568 BTYDAIRIAJUYQX-UHFFFAOYSA-N 385.448 5.503 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2cccs2)c2ccc(F)cc2)cc1 603991097 VQQBCWHRMWDFOE-UHFFFAOYSA-N 396.512 5.225 30 20 GKED CCC[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608864417 IMCOVBNMAQWIOB-IBGZPJMESA-N 389.421 5.260 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3C3CC3)cc2Cl)cc1 609137812 FMIZCHWTEQKOQJ-LJQANCHMSA-N 381.863 5.410 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(Cl)c1 609496520 HABVXYUADQENFX-UHFFFAOYSA-N 390.870 6.068 30 20 GKED COCCN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)C1CCCC1 609722860 BMDZATIHKOUTIG-UHFFFAOYSA-N 398.890 5.035 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)c1C 610569863 DKZMOZLVMRUPRR-KRWDZBQOSA-N 379.504 5.455 30 20 GKED CN1CC[C@H](CN[C@H]2CCCc3cc(C#N)ccc32)[C@H]1c1ccc(Cl)c(F)c1 611395225 VGPBRBKAISWPHC-YFXJRYMSSA-N 397.925 5.011 30 20 GKED COc1ccc([C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 619425491 SFBCYOQGEOHUDE-QHCPKHFHSA-N 384.479 5.016 30 20 GKED CC(C)OC1CCC(Nc2c(C#N)cnc3c(Br)cccc23)CC1 619651486 VZBFJDRIZBCMKS-UHFFFAOYSA-N 388.309 5.017 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622847629 APSRBOFZRGEEHW-BXKDBHETSA-N 389.286 5.144 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)COc1cccc(C#N)c1 726762326 CRDUULXEGPCOCJ-UHFFFAOYSA-N 376.843 5.205 30 20 GKED C#CC[C@H](OC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1ccccn1 727775770 ORYHIKCEIVKDJU-WXFJXSOESA-N 377.440 5.270 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCCSC(C)(C)C 728118666 AGXQATHHBHJAHR-UHFFFAOYSA-N 397.544 5.099 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730418622 XYDZLQQUCFUPMA-INIZCTEOSA-N 382.460 5.123 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@H](C)c3ccc(C#N)cc3)c(F)c2)c(F)c1 730475104 KSQXMPFZJRICTJ-CQSZACIVSA-N 392.405 5.003 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1 731475870 NTIVOJTWROHCCL-UHFFFAOYSA-N 393.874 5.185 30 20 GKED Fc1ccccc1-c1nc2c(s1)C(=NNc1nncc3ccccc13)CCC2 731923334 GABXAUYYYNFEIL-UHFFFAOYSA-N 389.459 5.045 30 20 GKED CC[C@@H](NC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccs1 734379899 JYRQZFIIUPREDA-LJQANCHMSA-N 393.537 5.850 30 20 GKED Cc1cc(C)c(-c2nnc(SCc3cc(Cl)ccc3OCC#N)o2)c(C)c1 735233258 ODCBRGSAFBRLOX-UHFFFAOYSA-N 399.903 5.510 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2coc(-c3ccccc3)n2)cc1 738843685 XZUQDSBKGATHQT-UHFFFAOYSA-N 380.403 5.237 30 20 GKED C[C@@H](CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccc(F)c1 739589535 AYFDTTNTXZQQOW-HNNXBMFYSA-N 378.472 5.236 30 20 GKED C=CCCCCCN(C)Cn1nc(-c2cccnc2)n(-c2ccccc2)c1=S 739883876 FISSBOKTFDGBRS-UHFFFAOYSA-N 393.560 5.101 30 20 GKED CCCn1c(CNCc2cccc(-c3ccc(C#N)s3)c2)nc2ccccc21 740010757 GXTRLLZBEURPTH-UHFFFAOYSA-N 386.524 5.336 30 20 GKED Cc1ncsc1/C=C1\CC(c2ccccc2)C/C(=C\c2scnc2C)C1=O 742429357 NBMGIHYSRFZKLV-XOBNHNQQSA-N 392.549 5.830 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1c[nH]c2cc(Cl)ccc12 743056046 BDIZUGPMIXGVEZ-FPYGCLRLSA-N 375.815 5.300 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cccc(N[C@H](C)C(C)C)c2C)c1 743409802 CQAHQPQRNQVFQH-QUCCMNQESA-N 393.531 5.062 30 20 GKED CCCCC/C(C=Nn1c(S)nnc1[C@H]1CCCCO1)=C\c1ccccc1 743451372 FCBQRZXTTCCTGL-WSEWATAISA-N 384.549 5.306 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)c1)C(=O)O 745021405 NTJQQNFLHLWIHK-JQPIKURYSA-N 378.449 5.163 30 20 GKED CC(=NNc1nc(-c2ccncc2)no1)c1ccc(SC2CCCC2)cc1 750949632 WYPFIIDGVLKBBZ-UHFFFAOYSA-N 379.489 5.002 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)ON=C(c1ccccc1)C(F)(F)F 751965513 NTTDMWPQLLYACZ-AWEZNQCLSA-N 392.421 5.122 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 754479341 NWNPRJPJPBYTHD-HNNXBMFYSA-N 394.475 5.096 30 20 GKED C=C(C)C[C@@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 767959943 NHMPTSWYMFXARW-BXUZGUMPSA-N 379.312 5.895 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)N[C@H](C#N)c1ccc(C(C)(C)C)cc1 768159675 GMCZZANRQFXDGJ-LJQANCHMSA-N 391.446 5.081 30 20 GKED N#Cc1ccc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)c(F)c1 772798780 YHCABWNLHLWADE-NVNXTCNLSA-N 387.183 5.384 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2nc(C(F)(F)F)cs2)cc1 787017700 JEDZDDIHKNZDCW-NEPJUHHUSA-N 390.858 5.705 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccnc2C(F)(F)F)cc1 788583647 VWTZJHHMIWOJKY-GOSISDBHSA-N 381.357 5.008 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)c1 795015436 RBTYMVXYBJSFES-UHFFFAOYSA-N 386.345 5.097 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)c1 795203499 CKTDVHKOUKGWKR-HSZRJFAPSA-N 395.437 5.023 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797567175 ZGMJBAZDPMLCOY-NEPJUHHUSA-N 378.950 5.451 30 20 GKED C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797573767 WIMNEORQKXGAJQ-RISCZKNCSA-N 396.434 5.103 30 20 GKED N#C[C@H](C(=O)c1ccccc1NCc1ccccc1)c1cc(C(F)(F)F)ccn1 813217071 BGMRQDWOKWIHEM-SFHVURJKSA-N 395.384 5.203 30 20 GKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1O 815635591 GDXHXAKJKGWGQI-ZWKOTPCHSA-N 377.315 6.175 30 20 GKED Cc1cc(Br)cc([C@H](C)N[C@H](CCCC#N)c2ccccc2)c1O 815635895 LPTPMHQHFWQFGI-HNAYVOBHSA-N 387.321 5.549 30 20 GKED C[C@@]1(CCNC(=O)c2ccccc2Sc2ccccc2C#N)C[C@]1(F)Cl 844816314 LCAQSQJHPLTXAW-WOJBJXKFSA-N 388.895 5.144 30 20 GKED CCCCC/C(C=Nn1c(SC)nnc(C(C)(C)C)c1=O)=C/c1ccccc1 912828522 VXKIGFISPRKTLR-IKMRVOFFSA-N 398.576 5.156 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917045994 FDVAAWYWRUFXMH-SUMWQHHRSA-N 398.915 5.717 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cn2ccc3ccc(Cl)cc32)cc1 919714248 XOMGBFHEBCMTTJ-JOCHJYFZSA-N 399.881 5.589 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc2[nH]c3c(c2c1)CCCC3 920102529 UJSKSAAKVJHNHT-IBGZPJMESA-N 395.462 5.042 30 20 GKED COc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 920109991 ITWWVENSRAUPKO-DNVCBOLYSA-N 376.481 5.107 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3ccccc3C(F)(F)F)cc2)c1 1776033250 SSEMPIXBJPNGKP-UHFFFAOYSA-N 398.384 5.446 30 20 GKED CCCCC(=NNc1ccc(C(=O)O)cc1OC)c1ccc(Cl)cc1Cl 1776050162 JMQUDTUWXNEHHJ-UHFFFAOYSA-N 395.286 5.707 30 20 GKED COc1ccc2c(c1)CC/C(=C\c1ccc(-c3ccccc3C(=O)O)cc1)C2=O 1776126961 CKDFULDREANZOZ-XMHGGMMESA-N 384.431 5.273 30 20 GKED C=CCCC1(C(=O)O)CCN([C@@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CC1 1776168405 JZIBSRQSZNNOJI-HNNXBMFYSA-N 388.895 5.189 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)o2)c2c(c1)C(C)(C)CC2 1776269181 AFUPWWIPYYQNII-WGEIWTTOSA-N 392.495 5.795 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1ccc(OCC(=O)O)c(Cl)c1)CC2 1776374858 ZMJXQONJHZYKFL-RQZCQDPDSA-N 384.859 5.139 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C\c1ccc(OCc2occc2C(=O)O)cc1 1776665960 PHAODDFMAUBHIK-MNAFEPAFSA-N 388.419 5.015 30 20 GKED Cc1cccc2c1N=C(O)/C2=N\Nc1ncnc2sc(-c3ccccc3)cc12 8284978 JICDSQGLJYMSGX-UHFFFAOYSA-N 385.452 5.085 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc(Br)cc1 22503998 MJGILOQKHINSDE-JLHYYAGUSA-N 394.268 5.319 30 20 GKED CCCCN/C(S)=C(/C(=O)c1ccc(C(C)(C)C)cc1)[n+]1ccccc1CC 27327749 SIQBPGJKYWTTCQ-UHFFFAOYSA-O 397.608 5.163 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)CCCC1 46065662 IMDXOMIXCYZWHT-UHFFFAOYSA-N 376.243 5.203 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66955980 KLBPXBYQAUCZRA-PXNSSMCTSA-N 379.529 5.758 30 20 GKED CCN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 104316855 FCEASTJYJQPXAS-HNNXBMFYSA-N 393.874 5.019 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(O[C@@H](C)C#N)cc1 105494651 WEZMPHIFYMTIPT-LSDHHAIUSA-N 395.503 5.399 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)Nc3ccc(CC#N)cc3)s2)cc1 107806280 GKCNJUFTXKBRFZ-INIZCTEOSA-N 390.512 5.376 30 20 GKED Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c12 108240864 VWFAOPBJLNLZPK-CYBMUJFWSA-N 394.500 5.159 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc2oc(C(F)(F)F)nc2c1)c1ccccc1 120453013 PVBSPKIIHXYRNN-AWEZNQCLSA-N 388.349 5.013 30 20 GKED Cc1c(NC(=O)N[C@H](CCC#N)c2ccccc2)cccc1OCC(F)(F)F 120599622 LSRURXCDKLZQIF-QGZVFWFLSA-N 391.393 5.103 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(Cl)c1SCC(F)F 125237330 CRDNLYDHNRCXHO-UHFFFAOYSA-N 399.850 5.238 30 20 GKED N#CCCn1cc(CNc2ccc(CC(F)(F)F)cc2)c(-c2ccccc2)n1 174448918 RBKHDETWSHSOTA-UHFFFAOYSA-N 384.405 5.181 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(Oc2ccccc2)o1 176532409 XAIIAFOGFQFUJE-IBGZPJMESA-N 396.402 5.186 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)n1 177749989 UAZYKHOBCAXYHX-LJQANCHMSA-N 387.464 5.421 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 185109397 DMNNUQDJMLDABS-GFCCVEGCSA-N 380.366 5.092 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc(OC)c1O 210163630 CBMUTNLFEZMRRR-BAQGIRSFSA-N 384.428 5.173 30 20 GKED Sc1nnc(-c2ccccc2)n1N=Cc1ccc(-c2ccccc2Cl)o1 252629047 TXOUIODOMUXUDR-UHFFFAOYSA-N 380.860 5.029 30 20 GKED aggregator CCOc1cc(/C=C/C(=O)c2c(C)nn(-c3ccccc3)c2C)cc(Cl)c1O 302959154 GDTODXPWZQINQS-ZHACJKMWSA-N 396.874 5.143 30 20 GKED CC(=O)c1cccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c1 303646986 JKEFPWWDFNXQOQ-UHFFFAOYSA-N 390.826 5.459 30 20 GKED COc1ccccc1[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1noc(C)n1 329161333 FNIHVWLNCKDMCI-LJCCNALRSA-N 383.492 5.039 30 20 GKED CC(C)c1nc([C@H]2CCCCCN2C(O)=Nc2cccc3ccsc23)no1 329525956 HIEJJTPPCDMUDD-MRXNPFEDSA-N 384.505 5.571 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 428363503 QOINCBFSROLTCO-UHFFFAOYSA-N 382.769 5.027 30 20 GKED CO[C@@H]1CCC[C@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 432713054 GZDRRXBIYPWYIK-ILZDJORESA-N 382.891 5.139 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2CSc2ccc(Cl)cc2)CCC1 440720313 UJOBBYFFCJXXEQ-UHFFFAOYSA-N 396.899 5.555 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(F)cc(F)c1Br 443536241 XOUDTZOWJDMPRN-UHFFFAOYSA-N 399.210 5.087 30 20 GKED C[C@H]1CC[C@@H](CCC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)O1 443876935 HQQZKOGFLKBMPL-KKSFZXQISA-N 382.891 5.093 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)c1cn(CCCC#N)c2ccccc12 444286978 CEDQSXLDNNFSJQ-UHFFFAOYSA-N 384.483 5.089 30 20 GKED N#Cc1c(NC(=O)Cc2cccc(C(F)F)c2)sc2c1-c1ccccc1CC2 448195861 GJLNSMCEPVMQRX-UHFFFAOYSA-N 394.446 5.504 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(Cc3ccccc3F)CC2)c(Cl)c1 455701648 KFHHQRLRBPKHKJ-UHFFFAOYSA-N 385.870 5.032 30 20 GKED C=C(C)Cn1c(-c2ncccc2C)nnc1N1CCC[C@H]1c1ccccc1Cl 460776865 DNJPSZHUQDDJGT-IBGZPJMESA-N 393.922 5.220 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccccc1)c1c(F)cc(C(F)(F)F)cc1F 463467770 DGJHTDWWHGPSCY-CYBMUJFWSA-N 397.265 5.407 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@@H](OC)c1cccc(Cl)c1 466345542 ZGFYXTWBLDYURJ-MRXNPFEDSA-N 399.343 5.140 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1 475022439 JRJVIKILSFFWCI-NRFANRHFSA-N 385.511 5.270 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](Oc2ccccc2Cl)C1 475566163 RTHUMCKQDDWVDW-SFHVURJKSA-N 398.934 5.877 30 20 GKED Cc1cccc(CCCSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 481939925 DARMGVLWKKDAJN-GOSISDBHSA-N 398.597 5.694 30 20 GKED COc1c(C)ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1C 482557579 TVJMZCHJELRNRI-UHFFFAOYSA-N 388.492 5.587 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2COCc2ccccc2)cc1 482984663 AVGYYLJYXYBKSB-UHFFFAOYSA-N 388.492 5.006 30 20 GKED N#Cc1cc(F)ccc1CSCc1cccc(C(=O)Nc2ccccc2)c1 488583006 ADTVJBXMMLQQQT-UHFFFAOYSA-N 376.456 5.383 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Sc2nc(C(F)(F)F)ccc2C#N)c(Cl)c1 488784353 PVRAQXCFMHKIMR-JTQLQIEISA-N 399.825 5.053 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)F)ccc1Cl 497233667 YKPCXZIWJQHYJW-UHFFFAOYSA-N 377.822 5.592 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(F)cc2F)nnc1-c1ccc(OC)cc1 498745575 VBIYIVHMRVMCOS-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED CC(C)(C)n1ncc(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)c1C(F)(F)F 498796190 LGXKGDUMAXGTCY-UHFFFAOYSA-N 397.294 5.067 30 20 GKED N#Cc1ccc(SCc2nc3ccccc3n2C(F)F)cc1C(F)(F)F 499470778 PEARNSWTTMZXMR-UHFFFAOYSA-N 383.345 5.614 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cnn1CC(C)C 500453330 VMNKSMNZZSDSKX-MRXNPFEDSA-N 398.919 5.115 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccc(C#N)cc1 504134724 GOBOOKIMHDUJRM-OPAMFIHVSA-N 389.886 5.361 30 20 GKED C=CCN(C(=O)Cc1c[nH]c2cccc(C)c12)c1nc(-c2ccccc2)cs1 504467615 NWPHEBDASWVNIH-UHFFFAOYSA-N 387.508 5.362 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(Cc4ccccc4Cl)no3)cc2)nc1 504797286 SBZJHOQJQYIMFJ-UHFFFAOYSA-N 388.814 5.040 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1ccc(-c2nc3ccccc3s2)s1 505164139 LMGXYDGWNKHRTM-UHFFFAOYSA-N 383.542 5.427 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(CSc3ccccn3)c2)c1 509530502 ZIGTYNQMZZPPGN-UHFFFAOYSA-N 379.872 5.151 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1coc(-c2cccs2)n1 510206691 BOQKQBASLSDLLF-UHFFFAOYSA-N 375.478 5.629 30 20 GKED CCOc1ccc(CN(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 518169085 NANHOHQOPSJEIP-INIZCTEOSA-N 383.517 5.001 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccc(F)cc2)CCC1 520855442 NGDFEETXGBMBTH-INIZCTEOSA-N 397.519 5.321 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 523122611 MGQQNKHOKUPDRK-UHFFFAOYSA-N 394.478 5.224 30 20 GKED CO[C@H]1CCC[C@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)C1 527244465 LUQMHACKSXWAJO-UNMCSNQZSA-N 394.490 5.134 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Sc3ccccc3C#N)cc2)n1 532243057 OYCWIEVYIXTTPF-JOCHJYFZSA-N 399.519 5.390 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)CC1 541972620 NIRSYVUXDVIBOZ-UHFFFAOYSA-N 390.512 5.045 30 20 GKED N#CCCCCN[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 542122894 ILTATXZYAVLVPC-GFCCVEGCSA-N 392.265 5.611 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N2CCC(CC#N)CC2)cc1 542902276 QNPMMFWMDQVUIF-UHFFFAOYSA-N 379.460 5.035 30 20 GKED N#CCCC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 552083614 POCJFITYNCZUFD-AREMUKBSSA-N 395.506 5.662 30 20 GKED Cc1cc(-c2csc(NC(=O)c3cc(C#N)ccc3Cl)n2)c(F)cc1F 560536797 YGIRYRVAZKCQJF-UHFFFAOYSA-N 389.814 5.174 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1cccs1 570539880 WJZWYQMAEXJAFG-KSSFIOAISA-N 385.558 5.615 30 20 GKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(Oc2cccnc2)cc1 575354039 MTTDZJHJZLQNOW-CYBMUJFWSA-N 384.361 5.332 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3Cl)cn2)c1 603623658 LEXJSTXHBZELMB-MOPGFXCFSA-N 389.842 5.141 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(F)cc1Br 604007708 UMNCRTUOBWGTHT-UHFFFAOYSA-N 398.235 5.259 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3ccc(OC(F)F)cc3)cc2)cc1 604456984 HPQDZSQGZWFUMA-UHFFFAOYSA-N 394.377 5.133 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccccc1 609398414 ZXZJEYAKJUPEAA-HKUYNNGSSA-N 379.529 5.177 30 20 GKED N#C[C@@H](NC(=O)c1ccnc(Oc2ccccc2)c1)c1c(Cl)cccc1Cl 609589346 VIOQDFOVKOVPRF-QGZVFWFLSA-N 398.249 5.175 30 20 GKED COc1ccc([C@H](NC(=O)N[C@@H](C)c2cccc(C#N)c2)c2ccc(C)cc2)cc1 610355548 USGLMKVHTQTRRH-MHECFPHRSA-N 399.494 5.025 30 20 GKED COc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc(OC)c1C(C)C 611520968 VLFOZLUJOMYMCB-UHFFFAOYSA-N 393.270 5.258 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ccccc1)c1ccco1 612203062 QEACHHGROIZLPS-LJQANCHMSA-N 386.904 5.482 30 20 GKED CCCc1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 613319218 WFUPCAJHMVMDMV-OAHLLOKOSA-N 381.526 5.326 30 20 GKED CN(C(=O)Cc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1)c1ccccc1 614056180 QDYJZQRPIDWLGR-UHFFFAOYSA-N 397.522 5.305 30 20 GKED CC(=O)c1cccc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 679980380 XDLFHKZEEMJYCD-CQSZACIVSA-N 388.370 5.008 30 20 GKED N#C[C@@H](C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1nccc2ccccc12 683225176 FFYCXWJFVGYYQU-CYBMUJFWSA-N 376.284 5.022 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccccc2)c2cccc(Cl)c2)c1 726467742 AIYAUXXEIVMISN-OAQYLSRUSA-N 376.912 5.397 30 20 GKED Clc1ccc(CON=Cc2cccc(OCc3ccncc3)c2)cc1Cl 727434194 IWVCFISQRQYNSP-UHFFFAOYSA-N 387.266 5.518 30 20 GKED C#Cc1cccc(N(CC)C(=O)Cc2csc(-c3ccc(Cl)s3)n2)c1 728480566 YDLZDLOTUMUJTN-UHFFFAOYSA-N 386.929 5.102 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(-c3ccccc3)[nH]2)cc1 731973259 UIUKCZDOXHGLHI-QFIPXVFZSA-N 377.447 5.589 30 20 GKED C=CC[C@H](NC(=O)Cc1cc(C)n(-c2ccc(Cl)cc2)c1C)c1ccncc1 734458028 RZKVRWNADJBAGY-QFIPXVFZSA-N 393.918 5.119 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3coc4cc(F)ccc34)n2)cc1 749026344 OJVLFHZVXVZZAB-SFHVURJKSA-N 390.439 5.423 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CC2CC(OC(C)(C)C)C2)c1 754548897 VOTUWBIBWSPWLM-UHFFFAOYSA-N 381.541 5.246 30 20 GKED COc1cccc2c1CC[C@H]2NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760010536 XAVHVPDECUAESH-DHIUTWEWSA-N 397.478 5.160 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cnn(Cc2ccccc2)c1 760269259 FNUJUSRQXXDSIB-SREVYHEPSA-N 377.494 5.013 30 20 GKED C=CCn1c(SCc2nc(Cl)ccc2Cl)nnc1-c1ccccc1F 762469524 NRWCQIHAOJOSJX-UHFFFAOYSA-N 395.290 5.264 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(-c2cn3c(n2)CCCC3)c1 776790774 IUIDAKWIESHUDL-UHFFFAOYSA-N 389.524 5.417 30 20 GKED Cc1cccn2cc(-c3ccc(N[C@@H](C)c4ccc(OCC#N)cc4)cc3)nc12 777641958 SZSIBDCWOHZWAI-SFHVURJKSA-N 382.467 5.385 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3cnn(C4CCCC4)c3)cs2)c1 799895418 GPVSXSDTMMUOJA-MDZDMXLPSA-N 379.485 5.026 30 20 GKED C#C[C@H](NC(=O)Nc1cc(Cc2ccccn2)ccc1C)c1ccc(Cl)cc1 810235315 PICNKSJDLPDQQT-NRFANRHFSA-N 389.886 5.130 30 20 GKED C=CCn1c(SCCSc2ccccc2F)nnc1-c1ccoc1C 825135411 YCGBRIJEJXAJAT-UHFFFAOYSA-N 375.494 5.056 30 20 GKED Cc1[nH]c(C#N)cc1C(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 827761721 XCOHGQIPWKBGRQ-UHFFFAOYSA-N 384.483 5.091 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(=O)Nc2ccc(C#N)cc2Cl)cc1 841155829 YEGCGTOMFJQTMV-CYBMUJFWSA-N 399.878 5.050 30 20 GKED CC(=NOCc1cc(-c2ccccc2)no1)c1nc2ccccc2n1C(F)F 913033386 LWXAFJFTZSOLRQ-UHFFFAOYSA-N 382.370 5.027 30 20 GKED CCOc1cccc(/C=N/C2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1O 914703691 XFFMUELOZDDMSD-JJKDVNPGSA-N 383.332 5.119 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(SC(C)C)cc1 916904391 BTPRATNDOWJIOT-FQEVSTJZSA-N 394.540 5.273 30 20 GKED CCOc1ccc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 919815255 UWZONZZTPCJFBH-DEOSSOPVSA-N 384.479 5.312 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccc1)c1ccc(N2CCOC2=O)cc1 920750203 YINCYBHOUXVLNJ-QINSGFPZSA-N 399.446 5.118 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 1776036024 WKWSUZXTBHFKEU-UHFFFAOYSA-N 395.802 5.059 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)CCCOc1ccc(Cl)c(C)c1 1776050393 POFIAMUEJXXZOL-UHFFFAOYSA-N 390.867 5.002 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C1\CCc2oc(C(=O)O)c(C)c2C1=O 1776199931 AYDLFYSTQNRSDQ-JIYPUEFQSA-N 388.366 5.046 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)c1)C(=O)O 1776470903 LPFGBHWPCMMZGU-FPAJZGIOSA-N 396.826 5.348 30 20 GKED CC1(C)Sc2ccccc2C(=O)/C1=C/c1csc2ccc(C(=O)O)cc12 1776573007 KCCLBEKRNIBBRD-YBEGLDIGSA-N 380.490 5.750 30 20 GKED CCCCCCCCNc1c(C(=O)O)cnc2c(OC)cc(Cl)c(OC)c12 1776785396 QJIYWTUMFWSXPD-UHFFFAOYSA-N 394.899 5.376 30 20 GKED O=C(O)c1cc(Br)cc(/C=C2/CCc3c(Cl)cccc3C2=O)c1 1777663538 GNJJZSCXSFNTEC-WDZFZDKYSA-N 391.648 5.013 30 20 GKED C=CC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)CCCCC)CC1 1831466923 MOBLIOQNQKLKIS-JAXLGGSGSA-N 390.612 5.035 30 20 GKED Cc1cc(C(=O)/C(=C(/S)Nc2ccccc2)[n+]2ccccc2)c(C)c(C)c1C 27182665 RWFPEWOEBMAGDR-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C[C@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1ccc(C#N)cc1 31436404 VPKQOSVMMSUWFE-AWEZNQCLSA-N 380.900 5.334 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1csc(C(C)(C)C)n1 48053736 DELUTHMWBULXRG-UHFFFAOYSA-N 384.574 5.101 30 20 GKED Cc1ccc(-c2ccsc2C(=O)Nc2sc3c(c2C#N)CCCC3)cc1 61046237 JGQQRRKGFIFQKE-UHFFFAOYSA-N 378.522 5.788 30 20 GKED COc1ccc(C(=O)CCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66856017 VJYQGXIGZVGWEA-INIZCTEOSA-N 396.512 5.081 30 20 GKED CCC[C@@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 66861214 RBDBOPDCRPJOKH-PKOBYXMFSA-N 381.545 5.150 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 66954298 ORPFPLOXOWGUAO-MRXNPFEDSA-N 383.492 5.440 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1nc(C2CC2)cs1 71869114 YBWZLCBUGQMSKZ-UHFFFAOYSA-N 377.494 5.296 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2sc3ccccc3c2Cl)c1 102746685 JVNOCOYWTAHGHL-UHFFFAOYSA-N 378.787 5.280 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sc(-c2ccccn2)nc1C 105002210 ANPMGNKJDQLHDW-UHFFFAOYSA-N 389.933 5.057 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCc1ccc(O[C@@H](C)C#N)cc1 105494653 WEZMPHIFYMTIPT-GJZGRUSLSA-N 395.503 5.399 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc(-c2ccncc2)cs1 114619271 NXPQBAIRTSVSCC-INIZCTEOSA-N 389.411 5.094 30 20 GKED CSc1ccsc1C(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1 157696976 OQPZGHPIOCSEKQ-GOSISDBHSA-N 394.521 5.044 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4ccccc4C)CC3)n2)cc1 170733524 SJUIQNMQCBCJIQ-SFHVURJKSA-N 388.492 5.035 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(SC)c(Cl)cc1Cl 177953939 KWVSVACDTCPZAT-UHFFFAOYSA-N 381.284 5.238 30 20 GKED CCCN(C(=O)Nc1ccc(F)cc1OCC#N)[C@@H](C)c1cc2ccccc2o1 178148922 CKYHIABLNIWTGD-HNNXBMFYSA-N 395.434 5.479 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(F)(F)F)cc1Cl 180189341 HCSBAVUZGSYVJW-NSHDSACASA-N 398.837 5.863 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)N[C@H](C)c1ccc(OCC#N)cc1 181777665 SWYKMULFBGKBNO-GCJKJVERSA-N 376.525 5.594 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)[C@H](C#N)c1nc2ccccc2o1 182081814 KMKOLANNTASKHY-LBPRGKRZSA-N 395.390 5.028 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3CN3CCc4ccccc43)cc2)CC1 183201965 BGCZDYMHRCZGDT-UHFFFAOYSA-N 393.490 5.057 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCn1cnc2ccccc21 191470783 ZRBQDLMNYLCIKM-UHFFFAOYSA-N 376.504 5.100 30 20 GKED COc1cc(C(=O)/C=C\c2c(C)nn(-c3ccccc3)c2C)ccc1SC 212272715 SIFKFMODOXUUAU-QXMHVHEDSA-N 378.497 5.116 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1OC 237165723 YOTKXESPIHYLKW-AWEZNQCLSA-N 381.394 5.009 30 20 GKED Cc1ccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c(Cl)c1 303585531 QIELEHVBFGNOQQ-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CC(C)c1ccccc1N=C(O)[C@@H](C)N1CCC[C@H](c2ncc3n2CCCC3)C1 328665568 ZGLGXCYQBBIAFV-MOPGFXCFSA-N 394.563 5.199 30 20 GKED Cc1c([C@H](/N=C(/O)N2CCCC[C@@H]2[C@@H]2CN=C(O)C2)C(C)C)oc2ccccc12 329002439 WFAKHWFLEIASRQ-YRISNDGFSA-N 397.519 5.183 30 20 GKED OC1=NC[C@@H]([C@H]2CCCCN2C(O)=Nc2cccc(-c3cccc(Cl)c3)c2)C1 329140351 SZGFQZADVATKBM-FXAWDEMLSA-N 397.906 5.383 30 20 GKED O/C(=N/Cc1cnc2ccccc2c1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329255616 AQIVHCPASXEKMK-HXUWFJFHSA-N 388.515 5.198 30 20 GKED CCOc1ccc(-n2c(S[C@H]3CC[C@H](C#N)C3)nnc2-c2ccccc2)cc1 430138977 ZXAURQMNMVAFHA-JXFKEZNVSA-N 390.512 5.117 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 431369885 OQPITVSWNLSIHO-BEFAXECRSA-N 389.421 5.501 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1cccc(Br)c1)C(C)C 432258122 MMTOVGUPHIWEOK-UHFFFAOYSA-N 386.293 5.072 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc4ccccc4n3C)c2c1 437375186 IULXGYKUVXYZGA-IBGZPJMESA-N 394.478 5.106 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N[C@H](CCC#N)c2ccccc2)cc1 438836105 FBGFRESRRJFPSJ-LAUBAEHRSA-N 381.545 5.592 30 20 GKED Cc1ccc(CC[C@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 460541197 ZYQFISQENUVZLL-KRWDZBQOSA-N 388.467 5.198 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NCc1cc(C#N)cs1 463702223 FAVZCGQSVJIWFF-UHFFFAOYSA-N 381.888 5.446 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2nc3cc(F)ccc3o2)cc1 464864816 ALGBIVMEDPTUQZ-UHFFFAOYSA-N 389.405 5.180 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 466955818 UWHCCCYWUYEDBN-KNQAVFIVSA-N 391.515 5.086 30 20 GKED N#CCCCn1cc(C(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)c2ccccc21 469553564 FCBRZBMJYLGZOC-QAPCUYQASA-N 391.437 5.044 30 20 GKED N#Cc1csc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c1 479656107 AHEILXDKRQOTRK-GOSISDBHSA-N 383.835 5.183 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(Cl)cc3C#N)s2)cc1 481028897 VRSLCDRDAYHCPD-CYBMUJFWSA-N 397.931 5.503 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(Cl)cc1C#N 481064871 WGXRTGUCYMOGAG-GFCCVEGCSA-N 385.895 5.634 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)cc1 481997673 JQSARVRAXJSEBX-UHFFFAOYSA-N 385.448 5.097 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 482464138 OQJXSESJLXRXOZ-IBGZPJMESA-N 398.384 5.421 30 20 GKED CC(C)(C)n1ncc(C(=O)Nc2ccc(C#N)cc2Cl)c1-c1ccccc1 489715996 HKQIMGUFXFMSIU-UHFFFAOYSA-N 378.863 5.082 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)Oc1ccccc1F 500740790 DFSLCXKSSKWGOW-MRXNPFEDSA-N 390.414 5.204 30 20 GKED Cc1ccccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 502317036 LCQJMSALQRMTAU-IBGZPJMESA-N 375.859 5.948 30 20 GKED CCC[C@@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 504258105 NJTVSBBERJUEHV-WZONZLPQSA-N 383.495 5.381 30 20 GKED CSc1ccc(Cl)c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)c1 505912548 MZMUGDRBBWZMIS-HNNXBMFYSA-N 384.810 5.075 30 20 GKED Cc1cccc2c(CCC(=O)N[C@H](C#N)c3ccc(Cl)c(Cl)c3)c[nH]c12 505922678 KJIZIDMPOXJHTO-GOSISDBHSA-N 386.282 5.097 30 20 GKED Cc1nc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)s1 507578711 QTHIRCQDLGLDBP-KRWDZBQOSA-N 381.888 5.321 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCCCC(F)(F)F)c1 508347996 HEWXATMVWNOQFW-UHFFFAOYSA-N 382.769 5.076 30 20 GKED Cc1csc(Sc2c(Cl)cccc2NC(=O)c2sccc2C#N)n1 509210276 TVMXPHSQVZBWKJ-UHFFFAOYSA-N 391.930 5.442 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCc3cc(F)ccc3C2)cc1 509704272 LQNDRLXEYOPGRV-UHFFFAOYSA-N 387.414 5.080 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)on1 510656737 GSSALDZOBCANLP-IBGZPJMESA-N 388.427 5.016 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4c(c3)CCCC4)n2)cc1 516713649 DYQFAPUYKVJZEN-FQEVSTJZSA-N 388.492 5.188 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4sccc4s3)n2)cc1 516714088 OYKCUMKMWRTGAH-CYBMUJFWSA-N 396.518 5.585 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](Nc4ccccc4)C3)cc2)cc1 517111671 DPENREJOHAKFJP-NRFANRHFSA-N 398.466 5.069 30 20 GKED CCCCOc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 517654108 KZTMAXBHFNNDRJ-UHFFFAOYSA-N 387.439 5.177 30 20 GKED COc1cccc(COc2cccc(Cl)c2CNCc2cccc(C#N)c2)c1 518766331 WSROEYOMZIOYJF-UHFFFAOYSA-N 392.886 5.089 30 20 GKED Cc1nc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)ccc1C#N 520003972 HPVPXJASPSABQP-UHFFFAOYSA-N 397.356 5.325 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)sc2c1CCC2 525628369 CSQXXDDRXQWAOO-KBPBESRZSA-N 377.296 5.157 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)c1ccccc1 534625003 DBJHQROBLJKIGR-NRFANRHFSA-N 398.506 5.191 30 20 GKED C[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(C(=O)c2ccccc2)c1 534869534 WLPUVSOGEZBDAR-SFHVURJKSA-N 396.490 5.461 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1cccc2ncccc12 535552424 AZBTYDBATYAUFA-UHFFFAOYSA-N 395.487 5.534 30 20 GKED Cc1c(Cl)cc(F)c(NC(=O)Nc2cccc(OCCCC#N)c2)c1F 535624994 TUTMRTKWLUMTNC-UHFFFAOYSA-N 379.794 5.253 30 20 GKED N#CCc1ccc(CN2CCC[C@@H]2c2ncc(-c3ccc(Cl)cc3)[nH]2)cc1 544071262 QUWDXGRCSVGUOM-OAQYLSRUSA-N 376.891 5.133 30 20 GKED C[C@@H]1CCCC[C@H]1OCc1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 544336503 POQQLMXSNPNTQW-NDLUBXDGSA-N 390.487 5.204 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 545506521 KOAKULYTSCTNJE-HNNXBMFYSA-N 391.393 5.512 30 20 GKED CN1CC[C@H](NCc2ccc(-c3ccccc3C#N)cc2)C[C@H]1c1ccccc1 551087211 NDPQEJHVBQMAJH-AHWVRZQESA-N 381.523 5.150 30 20 GKED Cc1ccc(OCc2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)cc1 552082872 HJUOBQUTDSTRTM-JOCHJYFZSA-N 391.540 5.555 30 20 GKED Cc1c(CNC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)oc2ccccc12 555008128 PRHFXZYSSFYMDJ-UHFFFAOYSA-N 398.422 5.122 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)c(F)cc1Cl 555994460 RWAVRZCPQFXVGB-JTQLQIEISA-N 383.275 5.779 30 20 GKED CC(C)(C(=O)Nc1ccc(Br)cc1Cl)c1cc(F)cc(C#N)c1 579014511 ZAKBCVCRVSIXQN-UHFFFAOYSA-N 395.659 5.030 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@H](Sc1ccc(F)cc1F)c1ccccc1 580113866 AGRQRQZHOWVRRA-LJQANCHMSA-N 388.483 5.244 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2-c2nc(C(C)C)no2)c1 589913526 UHNQENDQDABYTR-UHFFFAOYSA-N 377.444 5.067 30 20 GKED CC[C@@H](OCCNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 593158039 SDEMQLQFRQOUOQ-YLJYHZDGSA-N 397.544 5.370 30 20 GKED N#Cc1ccc2c(c1)CN(C(=O)Nc1cccc(CSC3CCCC3)c1)C2 594070176 ANMKJIFPAHRSLS-UHFFFAOYSA-N 377.513 5.282 30 20 GKED N#C[C@H](C(=O)c1cc2ccc(F)cc2s1)c1nc(-c2ccncc2)cs1 604005420 GCWBYILJTJREBZ-CQSZACIVSA-N 379.441 5.049 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 608553032 LBGPKJXBABCPSZ-KRWDZBQOSA-N 380.444 5.270 30 20 GKED Cc1ccc2c(c1)[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)CC2 609309383 BIORSPMHYNTZJZ-QHCPKHFHSA-N 398.531 5.576 30 20 GKED Cc1ccnc2sc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c(C)c12 609431680 TWZYLQJCDADINH-CYBMUJFWSA-N 381.526 5.560 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cc(-c2ccccc2)no1 609438156 DGECFDACOHPDDX-HNNXBMFYSA-N 392.484 5.058 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1c(F)cccc1F 609438586 LGRWFEIQTZYHFE-STQMWFEESA-N 375.444 5.242 30 20 GKED Cc1c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)sc2cccc(F)c12 609460573 AVWJTHNBIWRKDJ-CQSZACIVSA-N 392.377 5.362 30 20 GKED Cc1ccccc1C[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 609636236 GZCNHCMYTPIJMD-YLJYHZDGSA-N 393.556 5.486 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1c(F)cccc1F 609725212 NVYHBERCDHWHTL-UHFFFAOYSA-N 398.796 5.559 30 20 GKED CSc1ccc(O[C@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 610106676 DCZQATRNQRDSMQ-CQSZACIVSA-N 394.521 5.415 30 20 GKED CCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@@H](C)c1cccc(C(F)(F)F)c1 610355385 PFRLLOMLOAXDQP-GJZGRUSLSA-N 389.421 5.431 30 20 GKED CCOc1ccc2nc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)sc2c1 611093813 GCEXQLQJBZYMJN-UHFFFAOYSA-N 392.267 5.126 30 20 GKED C[C@@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccc(C#N)cc1 611182649 ICILWZBHGHHFCS-GFCCVEGCSA-N 383.423 5.110 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 618891714 CSXFYXJAESBEGX-UFYCRDLUSA-N 399.519 5.021 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1c1ccccc1Br)c1ccccc1 619439294 VYACEKZBXZMNDN-YLJYHZDGSA-N 397.316 5.200 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NCc2ccc(C#N)c(Cl)c2)cc1 619754903 OGSTYLLJJQKOCK-MRXNPFEDSA-N 376.887 5.738 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1Cl 619755559 ZRHBYFRQBBUQPX-NRFANRHFSA-N 398.840 5.692 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(OC)cc3)n2)CCCCC1 639246734 IHDISQIWSIYHOF-UHFFFAOYSA-N 399.560 5.205 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](Cc1ccccc1)c1ncco1 654047434 PKOQTINYLPIPGX-NRFANRHFSA-N 389.499 5.632 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(CC[C@@H](O)c3ccccc3)c2)cc1 727763993 SLYIYBYHOIPAHS-XMMPIXPASA-N 387.479 5.170 30 20 GKED C[C@H](NC(=S)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1cccs1 727980853 SIGSFEPBTNCYNO-HNNXBMFYSA-N 393.537 5.246 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)nc1 728865919 UOQKJVGOMURMTL-OAHLLOKOSA-N 375.859 5.142 30 20 GKED COc1cc(C2(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)CCC2)ccc1C 730417029 KVQDJAIWRQDGQD-MRXNPFEDSA-N 394.471 5.051 30 20 GKED C#CCOc1ccc(NC(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)cc1 731113800 RWMSAMRFEFSEPG-GOSISDBHSA-N 390.508 5.555 30 20 GKED N#Cc1ccccc1COc1cccc(/C=C\C(=O)c2ccc(F)cc2F)c1 731319874 RWLFYMIPLYPEJS-FLIBITNWSA-N 375.374 5.312 30 20 GKED N#Cc1ccc(NC(=S)N2CC[C@@H](c3ccc(Cl)cc3)C2)cc1Cl 731949726 LBQILQBCYLOVAX-CQSZACIVSA-N 376.312 5.051 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCc1ccc(OCC#N)cc1 733401432 AUGHTIGUZIREJJ-UHFFFAOYSA-N 398.871 5.031 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc(C)n(C3CCCCC3)c2C)c1 733789913 YZBZNEQFVNLLCE-NRFANRHFSA-N 393.531 5.221 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)Cc2ccc(C(C)(C)C)cc2)c1 733804622 GJILFPCQUVCUFO-NRFANRHFSA-N 393.531 5.007 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)Nc1cccc(N2CCOC2=O)c1C 743243188 BYALURSHKYYHOE-MRXNPFEDSA-N 375.513 5.070 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1sc(-c2cccnc2)nc1C 747603091 VOFVGPPSHOZVHW-UHFFFAOYSA-N 376.407 5.368 30 20 GKED N#Cc1cc2ccccc2nc1NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 750014643 BVSXMBFLOAVQRK-STQMWFEESA-N 387.327 5.428 30 20 GKED Cc1ccc(OCCCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 750691960 VGXLNHRZQSAOBO-DEOSSOPVSA-N 399.494 5.241 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(Cl)c(C(F)(F)F)c1 754690652 XVPYGBUYPXHXFO-ALCCZGGFSA-N 394.805 5.773 30 20 GKED C#CCN(Cc1csc(N(C(C)=O)c2cccc(C)c2C)n1)C1CCCCC1 756502254 RYZYQPQNNNNOFY-UHFFFAOYSA-N 395.572 5.212 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=S)Nc1ccccc1C#N 759127938 KIYGPADCELVYHV-OAHLLOKOSA-N 392.553 5.380 30 20 GKED Cc1cccn2cc(-c3ccc(NCc4ccc(O[C@@H](C)C#N)cc4)cc3)nc12 770529262 SNQROCGVZUPAOQ-SFHVURJKSA-N 382.467 5.213 30 20 GKED Cc1cnc([C@@H](C)OC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)o1 770983797 RMZLBMHKVZDMTF-CYBMUJFWSA-N 382.803 5.218 30 20 GKED C/C(=C\C(C)(C)C)C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 773980264 PRAJVTKOTBBCSC-QRURKXGXSA-N 376.456 5.119 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cc(Cl)ccc2Sc2ccccc2)nc1 780645642 CXALUKRAIQCQBA-UHFFFAOYSA-N 394.887 5.080 30 20 GKED N#CCc1ccc(CSc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cc1 783714037 CNAGFWAWOLQTPL-NRFANRHFSA-N 389.524 5.087 30 20 GKED Cc1ccncc1/C=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784832792 AMEPXRDWEMLTIP-BBOMDTFKSA-N 379.872 5.057 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(O)cc1)CC2 791104796 ABECZIVOLJRCAI-VLGSPTGOSA-N 398.462 5.278 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)C[C@H]1CCC(F)(F)C1 798213346 XCLNFCGDRGYGEJ-MRXNPFEDSA-N 388.845 5.570 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc(Oc2cccnc2)cc1 808436002 HJNUHHDPRURODP-LJQANCHMSA-N 386.499 5.075 30 20 GKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1O 815636083 OGCYBEAAVVXSGE-RTBURBONSA-N 376.422 5.887 30 20 GKED C=CCCC[C@@H](NCc1ccc(-c2ccccc2Br)cc1)C(=O)O 900068201 BHBZFUAEQAMPGP-LJQANCHMSA-N 388.305 5.015 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2ccc(F)cc2s1 916915975 MGWQKDLMUIJKBD-QGZVFWFLSA-N 388.423 5.155 30 20 GKED N#CCOc1cccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(Cl)cc2)c1 917499546 JRBXQXWDJHGPEJ-NRFANRHFSA-N 389.842 5.013 30 20 GKED CON=Cc1ccc(C(=O)N(C2CC2)[C@H](C)c2cccc(C(F)(F)F)c2)cc1 919862159 HPHXHRALCMWYSB-CQSZACIVSA-N 390.405 5.052 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776339946 SGWRGKRHWDQZMZ-DHZHZOJOSA-N 390.435 5.445 30 20 GKED CC1(C)/C(=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776515379 ZFOBRKILCLXZRT-GOOXQAOHSA-N 398.458 5.449 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)cc2)ccc1SC(F)F 1777263343 ITPBBYFFPWJTSD-MLJWIXNLSA-N 390.407 5.004 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4c(Cl)cccc4C3=O)s2)c1 1777684301 JPJVOTUHKPNJEZ-OWBHPGMISA-N 394.879 5.979 30 20 GKED COC(=O)c1ccc(/C=C(\C(=O)c2ccccc2)c2nc3ccccc3s2)cc1 6169680 GREHWMOWVWJNIA-XDJHFCHBSA-N 399.471 5.506 30 20 GKED CN(Cc1cccs1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 47580605 AOXJYYDFZNGLPL-UHFFFAOYSA-N 391.496 5.057 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1sccc1Br 66802237 TUUIRDBLCHTANL-SNVBAGLBSA-N 381.320 5.157 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(F)c(Cl)c1 66956185 CHVVWLQCDAMXBJ-LBPRGKRZSA-N 377.872 5.195 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@@H](Oc2ccc(Cl)cc2)c2ccccc2)n1 68721866 FCAGSMVPHNDHOT-MJGOQNOKSA-N 382.872 5.102 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C#N)c(Cl)c2)cnn1-c1cccc(Cl)c1 71860957 LAKOZAPIIFLWDL-UHFFFAOYSA-N 399.281 5.426 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(F)cc2F)cc(C)c1OCc1ccccn1 106193174 HQJXDEWIKXWROR-RMKNXTFCSA-N 379.406 5.452 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc1 107623561 GYLBYXFAUVVUMA-UHFFFAOYSA-N 396.462 5.162 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 112738250 NKYJBBZMYMBTRQ-LAUBAEHRSA-N 381.545 5.942 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)Nc2cc(C#N)ccc2OC(C)C)c1 115825435 SXUYFARCCHALTG-UHFFFAOYSA-N 380.488 5.150 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cnc2ccccc2c1 130081042 XRQBTSQFSQIBCZ-UHFFFAOYSA-N 393.446 5.388 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccccc3S[C@H](C)CC#N)c2c1 174729952 DXCOISKATAPTBG-MRXNPFEDSA-N 377.513 5.442 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ncc(C(=O)OC)s1)c1ccc(C(F)(F)F)cc1 414101886 MIFRRXFDBMOWNO-WFASDCNBSA-N 398.450 5.307 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H](CC(F)F)c2ccccc2)c2ccccc21 422028530 SLCOWZPBGXBFMB-IBGZPJMESA-N 381.426 5.071 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)c3cccc(SCC#N)c3)cc2)cs1 429916432 AMPJMVATUALFGF-CQSZACIVSA-N 393.537 5.225 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)c2cccc(SCC#N)c2)cc1 429950609 PQYQVRLJJDOSFG-NRFANRHFSA-N 380.513 5.068 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CO[C@H]1CCCc2ccccc21 430547071 DTDGDCCTFAPHJA-JXFKEZNVSA-N 380.513 5.114 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(-c2cccs2)c1)c1ccccc1 432860892 UWCGEGIVDJJIPF-FQEVSTJZSA-N 375.497 5.972 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccc4ccccc4c3)o2)c(Cl)c1 438898672 XKYWIQHLODALLH-UHFFFAOYSA-N 377.856 5.707 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccc(CCC(F)(F)F)cc1 439535877 RKCJRHYGXKJRGS-UHFFFAOYSA-N 394.462 5.510 30 20 GKED Cc1cccc(C2=CCN(C(=O)c3cn(CCCC#N)c4ccccc34)CC2)c1 444262509 BCVSTJCOLJIFOV-UHFFFAOYSA-N 383.495 5.183 30 20 GKED COc1cccc(F)c1C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 462055622 IPAZRUQBSMHOSU-UHFFFAOYSA-N 381.247 5.124 30 20 GKED C=C(C)C[C@H](C)C(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)cs1 466545128 MKHUTHPCLALXHK-STQMWFEESA-N 393.350 5.352 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cc(Oc2ccccc2)ccn1 466993550 NALRCVULBISDGI-UHFFFAOYSA-N 395.418 5.186 30 20 GKED CC(C)(C)C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 468882867 FMEHAMAHJRIEMY-QFIPXVFZSA-N 389.543 5.859 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 470204232 URMZGTSENXIMDS-HXUWFJFHSA-N 386.417 5.263 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1)c1ccccc1 470438152 KTYHTVKTSCTMFN-OAQYLSRUSA-N 378.516 5.164 30 20 GKED N#CC[C@H](CC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 474394562 ZCAXQKYGDFCCFT-VGSWGCGISA-N 392.549 5.371 30 20 GKED COc1ccc(-c2ccc(CNC(=O)C[C@@H](CC#N)c3ccccc3)s2)cc1 476245650 KCQLISUWSNXVPX-LJQANCHMSA-N 390.508 5.127 30 20 GKED COc1ccc(CN[C@@H]2CCCc3sc(Cl)cc32)cc1OCCCC#N 492125449 ALMFNSQYDFOJBH-MRXNPFEDSA-N 390.936 5.260 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OC(C)(C)C)cn3)n2)cc1 496026728 DWFZIUWJQTUTCR-KRWDZBQOSA-N 391.496 5.181 30 20 GKED C=CCCc1ccccc1NC(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1 505000565 GYLRJEDEXHODSQ-UHFFFAOYSA-N 379.504 5.206 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(F)(c2cccc(OC)c2)CC1 505023559 MYWBEXMRLNVBHW-UHFFFAOYSA-N 382.479 5.307 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(OC(F)(F)F)c(C#N)c2)c1 508200333 DTPXSTLTZBGGKT-UHFFFAOYSA-N 386.782 5.084 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(O)c2ccccc2n1 510206116 AOJLJPWMWPTITC-AWEZNQCLSA-N 384.464 5.122 30 20 GKED N#CC1(c2ccc(C(=O)N3CCc4ccccc4[C@H]3c3ccccc3)cc2)CC1 512616283 AAMCJWPLAFQAEZ-XMMPIXPASA-N 378.475 5.030 30 20 GKED CCOc1ccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)c(C)c1 513477607 UAJZWZKFOYPNPR-UHFFFAOYSA-N 386.451 5.097 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(OC3CCC(C)CC3)CC2)c1 517474304 ZSQWWZUVSMBIID-UHFFFAOYSA-N 386.536 5.233 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Nc2ccc(C(F)(F)F)cn2)cc1 517543655 OKJDTUWVDPGLKB-UHFFFAOYSA-N 388.374 5.029 30 20 GKED COc1cccc([C@H]2C[C@H]2C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1 518028918 ASLNPGTUENIZGT-QZTJIDSGSA-N 380.513 5.030 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](Cc1ccccc1)c1cccs1 522686217 PKZNNLIBPILTFW-LJQANCHMSA-N 382.554 5.491 30 20 GKED CC(C)(C)n1cc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cn1 523944937 OZASKFCVCOZNFR-UHFFFAOYSA-N 394.862 5.208 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H](c2nc3ccccc3s2)C1)c1ccccc1 527215543 KVJLLCIYRIIBHE-MOPGFXCFSA-N 389.524 5.090 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(C(F)F)c2F)cc1 528921798 VSGYOASISIBCMC-QGZVFWFLSA-N 388.389 5.067 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1scnc1C1CC1 535598079 KGAFGWBCYGCFFI-UHFFFAOYSA-N 391.471 5.187 30 20 GKED COc1cccc([C@@H]2[C@H](c3ccccc3)CCN2C(=O)Nc2cccc(C#N)c2)c1 541260932 AFGHTAZYPJWPPA-BJKOFHAPSA-N 397.478 5.330 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)o1)c1nc2ccccc2n1C(F)F 542282147 OCOJRDMDZVXMFZ-AWEZNQCLSA-N 377.350 5.181 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 543304819 PMDZUJPEFFWKCP-MJGOQNOKSA-N 379.529 5.411 30 20 GKED N#CCSCc1nc(-c2ccccc2Nc2ccccc2C(F)(F)F)no1 545785133 BLSFXESTTBWBKO-UHFFFAOYSA-N 390.390 5.256 30 20 GKED C=C(C)[C@@H](Cc1nc(CC2(SCc3ccccc3)CCCC2)no1)OCC 545838728 VPHKCSJDQKEWOD-LJQANCHMSA-N 386.561 5.382 30 20 GKED Cc1ccc(C(C)(C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cn1 546833976 MOUPGMYHZMKZHC-UHFFFAOYSA-N 386.455 5.111 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cnn(C)c1-c1ccccc1 554445303 HPBKTJFHJBVSBE-HNNXBMFYSA-N 391.500 5.125 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1c(F)cccc1F 557084849 IRKRRVCKUVWXDG-CQSZACIVSA-N 393.393 5.511 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 557508675 UKOVIICBIVNDIE-UHFFFAOYSA-N 391.490 5.057 30 20 GKED Cc1cc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)s1 557560795 HKGIKQLGRKRUPJ-CYBMUJFWSA-N 390.599 5.631 30 20 GKED CC(C)(c1cccc(C(F)(F)F)c1)c1noc(C[C@@H](CC#N)c2ccccc2)n1 560048835 LHBNCQYGFXQTKJ-MRXNPFEDSA-N 399.416 5.654 30 20 GKED Cc1oc(C(C)C)cc1C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 560544079 NWBMFWRUBFYPRQ-CYBMUJFWSA-N 386.423 5.603 30 20 GKED COc1cccc([C@H](C)CCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 568353321 YAGDQTAZQZHLCZ-MSOLQXFVSA-N 396.556 6.002 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)C[C@H](C)C[C@H]4C)ccc12 577597993 FMGSJIXEFSZRJB-DGCLKSJQSA-N 391.496 5.120 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@@H](Sc1ccc(F)cc1F)c1ccccc1 580113865 AGRQRQZHOWVRRA-IBGZPJMESA-N 388.483 5.244 30 20 GKED N#Cc1cccc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c1 603564026 AKICFZJHBZOELB-UHFFFAOYSA-N 380.778 5.697 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(OCc2ccccc2C#N)cc1 603638050 HOUGVXQOWSQKDS-QGZVFWFLSA-N 388.442 5.110 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1Cl 603673419 UNBIJNSLCCCJCV-LJQANCHMSA-N 382.797 5.526 30 20 GKED Cc1ccc(-c2cc(CSCC(=O)Nc3cc(Cl)ccc3C#N)on2)cc1 609236645 RCWLSNZGZVPZGE-UHFFFAOYSA-N 397.887 5.047 30 20 GKED CCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@@H](CC)c1ccccc1 609499344 LVELDXXQEGJRFQ-QHCPKHFHSA-N 399.494 5.749 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccc(Cl)cc3F)c2)c1 609642904 IIMJYFAQEBOOFH-UHFFFAOYSA-N 380.806 5.182 30 20 GKED C[C@H](NC(=O)Nc1cccc(COC2CCCCC2)c1)c1cccc(C#N)c1 610325238 NRDWEDZOLYGKNI-KRWDZBQOSA-N 377.488 5.290 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CC1CC1)c1ccccc1 610325857 XBRJPKYEAHSAEN-JXFKEZNVSA-N 379.529 5.601 30 20 GKED COc1ccc(CNc2cc(Br)ccc2C)cc1OCCCC#N 610909630 JTRVXRZDEYKKKW-UHFFFAOYSA-N 389.293 5.061 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H]3CCc4cc(C#N)ccc43)c2)cc1 618753506 UGPQNZYFIIAAMF-HSZRJFAPSA-N 394.434 5.031 30 20 GKED C=CCn1c(SCc2csc(Br)c2)nnc1-c1ccccc1 643090126 ZQYVSUZFWMTKEG-UHFFFAOYSA-N 392.347 5.247 30 20 GKED N#C[C@H](C(=O)c1ccc2ccc(Cl)cc2n1)c1nc2cc(F)ccc2s1 674486157 SBQFMSJKFOGZIQ-CYBMUJFWSA-N 381.819 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(OC)cc1Cl 675254475 TVXOBOZRILAPAB-UHFFFAOYSA-N 379.909 5.001 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(F)c(Cl)c1 676036803 CHJVRITZRSJVHN-IUCAKERBSA-N 391.714 5.118 30 20 GKED N#C[C@@H](C(=O)c1cc2cccc(F)c2o1)c1nc(-c2ccc(Cl)cc2)cs1 682127131 HGJQIKVHRGJTBI-AWEZNQCLSA-N 396.830 5.839 30 20 GKED COc1ccc(NC(=O)c2cc(F)c(C(F)(F)F)c(F)c2)c(C(F)(F)F)c1 683194549 PNWBIEQWYZEDEY-UHFFFAOYSA-N 399.237 5.263 30 20 GKED C[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(Br)cc1 726439926 BJIKVAYYWMIFLK-JTQLQIEISA-N 394.725 5.022 30 20 GKED COc1cc(/C=C\C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)ccc1O 727654391 MBUJNUGZGPFFJO-WMZJFQQLSA-N 385.872 5.382 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 728687703 JVJHDAMWLGUMNY-QHCPKHFHSA-N 399.494 5.323 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)CCc1cccc(OC2CCCC2)c1 729169366 SGBKHAJQZXSAFM-UHFFFAOYSA-N 399.874 5.080 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cnn(-c2ccccc2Cl)c1 730187978 SBTATIPCVPRNTB-UHFFFAOYSA-N 398.853 5.317 30 20 GKED CC(C)[C@H](SCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417796 SOXMRIBQLLSAPL-UZLBHIALSA-N 398.528 5.570 30 20 GKED CC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCC1 731767719 GULPVQLESGMICN-CYBMUJFWSA-N 379.312 5.873 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732901694 ZZOFROCIHSIFRR-VQIMIIECSA-N 394.927 5.909 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(N(C)c3ccccc3)cc2)c1 733800729 GWBVRZTWJSUDMV-DEOSSOPVSA-N 385.511 5.425 30 20 GKED CSc1nc2ncnc(NCc3cccc(-c4ccc(C#N)s4)c3)c2s1 739890691 RGRKFDZFBWJXBO-UHFFFAOYSA-N 395.538 5.020 30 20 GKED C[C@@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1c(F)cccc1F 740034741 XGIFNHDDCLDFQB-CYBMUJFWSA-N 397.450 5.125 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 740535865 PNBJXQQREGBOHS-KSSFIOAISA-N 380.900 5.752 30 20 GKED N#Cc1ccc(CCC(=O)O[C@H]2CCCc3nc(-c4ccccc4)sc32)cc1 741196369 YYIWNMIKIKTCFI-FQEVSTJZSA-N 388.492 5.235 30 20 GKED Cc1ccc(F)c(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 743034719 BPXSYURSDLLCLD-UHFFFAOYSA-N 395.434 5.746 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(Cl)c(Cl)c1Cl 746498010 PSLUJFQKCXNFQV-UHFFFAOYSA-N 385.682 5.640 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 747672571 KHBJBMXWRVAWGS-UHFFFAOYSA-N 387.936 5.644 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CCCCCCC1 748988905 NQRBKLXVJVSJLJ-HSZRJFAPSA-N 375.516 5.919 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)N[C@@H]1CCCC[C@@H]1C 749101092 AOVNHZSOKSFNKM-SUMWQHHRSA-N 399.373 5.029 30 20 GKED CCn1nc(C)c(C(=O)/C=C/c2ccc(OCc3cccc(F)c3)cc2)c1C 750909469 LWYGCVMMMINHFT-JLHYYAGUSA-N 378.447 5.134 30 20 GKED CC(=NNc1nc(-c2ccc(Cl)cc2)no1)c1sc(C(C)C)nc1C 751132300 ALEWGUUQUUXWCU-UHFFFAOYSA-N 375.885 5.114 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1F 752635928 IYZWVHNPEXQZQY-BTYIYWSLSA-N 391.421 5.503 30 20 GKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 753920117 DRFOIUYQEFFJHU-INMHGKMJSA-N 393.437 5.597 30 20 GKED C#CC[C@@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1ccccc1 761783292 PXMKIELDVKNOMO-MRXNPFEDSA-N 382.435 5.242 30 20 GKED Cc1ccccc1-c1noc([C@@H](C)SCc2cc(Cl)ccc2OCC#N)n1 762810715 BTNKPWPUBTXDQZ-CQSZACIVSA-N 399.903 5.595 30 20 GKED C=CC[C@@H](NC(=O)N1CC[C@@H](Cc2ccc(C(C)C)cc2)C1)c1ccncc1 764725693 MWJAUNWZCPORNO-NZQKXSOJSA-N 377.532 5.096 30 20 GKED CCOc1ccc(C(=O)/C=C/c2csc(-c3cccs3)n2)cc1[N+](=O)[O-] 765615993 KPLYMINJYVZZOE-VOTSOKGWSA-N 386.454 5.075 30 20 GKED COc1cc(C(=O)/C=C/c2cccc(-c3cccnc3)c2)ccc1OC(F)F 768497397 UYYJVSWNAIKQBF-VQHVLOKHSA-N 381.378 5.255 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(-c3ccccc3F)o2)c2ncc[nH]2)c1 776434605 XVJYPVYMHMYYSI-XMHGGMMESA-N 388.398 5.241 30 20 GKED C=CCC[C@H](C(=O)O[C@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 778554041 ZJFLNTJGKGNVNO-XLIONFOSSA-N 376.456 5.015 30 20 GKED Cc1ccc(/C=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 779472152 SKDWPFFTMNEBLY-VZOQVYJPSA-N 387.870 5.351 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC=C(c2ccccc2)C1 782562102 FGTYVZQBMPRWBP-UHFFFAOYSA-N 395.462 5.590 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1cnc(-c2ccccc2OC)nc1 792882705 HVYRRQHKJASKGB-NTMALXAHSA-N 394.858 5.100 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797572876 KBVUDQNHTNJSJH-IUODEOHRSA-N 394.462 5.829 30 20 GKED CN1CCC[C@H](COC(=O)CCCCCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1 805886000 XLQVBVACDRBCCB-XLIONFOSSA-N 396.453 5.106 30 20 GKED C=CCn1c(SCc2csc(Cl)n2)nnc1-c1ccc(Cl)cc1 806585277 PDMLIORUNHFYOP-UHFFFAOYSA-N 383.329 5.187 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1Cl)c1nc2ccccc2n1C(F)F 810537548 WRMCYSPZAAYZBJ-AWEZNQCLSA-N 387.817 5.284 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)C1 813217332 KNPHBYFZITYEAT-KBAYOESNSA-N 396.453 5.432 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1 815635702 HVUWEWHTZDZKAA-NQIIRXRSSA-N 385.552 5.047 30 20 GKED COc1ccc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1OC1CCCC1 824031486 MMMBQGXDQZJKKL-MRXNPFEDSA-N 393.487 5.113 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1sc2c(c1C#N)C[C@@H](C)C[C@H]2C 839388601 KKZKEBIMSCPVLJ-WDEREUQCSA-N 390.940 5.068 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@H]1CCCc2c(OC)ccc(Cl)c21)c1ccncc1 844990954 ZSEGWKRYDCMEHS-OALUTQOASA-N 399.922 5.080 30 20 GKED COc1cc(NCc2ccc(C3(C#N)CC3)cc2)ccc1NC(=O)OC(C)(C)C 850206571 ODVZCSJCLXBOBD-UHFFFAOYSA-N 393.487 5.209 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cccc(C2CCCC2)c1 850758806 DTLFPUCACNEZJR-JOCHJYFZSA-N 388.511 5.430 30 20 GKED Cc1sc(C2(N[C@@H](C)c3cc(C#N)ccn3)CCC2)nc1-c1ccccc1F 903000112 HUOFWGJXUVVBHP-AWEZNQCLSA-N 392.503 5.254 30 20 GKED Cc1cccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916977272 OTCZHDVAXBBFBD-RDTXWAMCSA-N 396.899 5.416 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc(-c2ccccc2)cs1 917027023 TXNJIIHDWKOYFK-JOCHJYFZSA-N 392.483 5.871 30 20 GKED COc1ccc(C(=O)/C=C/c2c(C)nn(-c3ccc(Cl)cc3)c2C)cc1OC 917143946 YVOAOOLWFNSWGK-ZHACJKMWSA-N 396.874 5.056 30 20 GKED CCCCS[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 918488982 IMKAJFKWAXVLAJ-WFASDCNBSA-N 378.950 5.562 30 20 GKED CCOc1ccc(C(=O)/C=C\c2csc(COc3ccc(OC)cc3)n2)cc1 920064929 NYWMINJPXKBNNP-MLPAPPSSSA-N 395.480 5.026 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NNc1nc(Cl)c(Cl)cc1Cl 1776022201 ZAPBEBZFLRVLNW-UHFFFAOYSA-N 398.677 5.283 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)cc1 1776125602 NAWPIMDROXGVGP-WJDWOHSUSA-N 380.484 5.559 30 20 GKED C=CCOc1ccc(/C=C/c2nc(C(=O)O)c(-c3ccccc3)s2)cc1OC 1776183929 JYIVWOAAUGDZRS-ZRDIBKRKSA-N 393.464 5.252 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C\C(=O)c3ccc(C(=O)O)cc3O)o2)cc1 1776271465 MJULNTWSJIDJRC-XFXZXTDPSA-N 390.435 5.544 30 20 GKED C[C@H]1C/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776589690 RQRVVHOQQCMHFK-NIZGNDASSA-N 382.459 5.754 30 20 GKED CCCCCCC[C@H](C)CNc1c(C(=O)O)cnc2c(OC)cc(OC)cc12 1776782281 BLEUCESPDNXQLJ-HNNXBMFYSA-N 388.508 5.359 30 20 GKED CCn1c2ccccc2c2cc(/C=C3/C[C@H](C(=O)O)c4ccccc4C3=O)ccc21 1777002914 PGHNLHHGVMWKTC-GBKYUFMXSA-N 395.458 5.653 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(Br)cc2C(F)(F)F)c1 1777686136 OELCJKYRIOXWFW-FNORWQNLSA-N 399.162 5.062 30 20 GKED C=CCOc1ccc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)cc1OC 6581015 LZADKCHHVUQXKP-DTQAZKPQSA-N 395.480 5.275 30 20 GKED CC(C)Oc1ccccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 32287735 ZNFDDRLPGKRZOH-UHFFFAOYSA-N 386.451 5.177 30 20 GKED CN(Cc1cccs1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161483 ACTMIHJQNMUGIC-UHFFFAOYSA-N 391.496 5.057 30 20 GKED O/C(=N\c1nc(C(F)(F)F)cs1)c1cnc(-c2ccccc2Cl)s1 50313785 DRCZOFDMHHDTKL-UHFFFAOYSA-N 389.811 5.575 30 20 GKED C[C@H](NC(=O)Nc1ccccc1N1CCc2ccccc21)c1ccc(C#N)cc1 58118265 SJLYVYCPBVZGCL-KRWDZBQOSA-N 382.467 5.135 30 20 GKED CCn1c(C)cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1C 65654713 NQPHTOUBUFIBGP-UHFFFAOYSA-N 387.483 5.022 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c(F)cccc2Cl)cc1Cl 107879634 KMMAHOPFEUUUIC-MRXNPFEDSA-N 399.252 6.040 30 20 GKED Cc1cccc2[nH]cc(CCNC(=O)Nc3ccccc3SC[C@@H](C)C#N)c12 108528388 FXDNNENANDGTPG-HNNXBMFYSA-N 392.528 5.092 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2ccccc2S[C@H](C)CC#N)s1 114273206 KGEDSSNTYPKRFN-SNVBAGLBSA-N 382.457 5.305 30 20 GKED Cc1ccc(C(=O)Nc2cccc(OCCCC#N)c2)cc1Oc1ccncc1 115035736 MINIWNMZVPUZEE-UHFFFAOYSA-N 387.439 5.117 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)[C@H](C)c1cccnc1 115230575 MBWAHYCPTKOFSQ-MRXNPFEDSA-N 389.430 5.108 30 20 GKED COCc1ccccc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116628959 ABNCUUURRBBARY-UHFFFAOYSA-N 392.842 5.403 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)c1cccc(O)c1 118821960 ZHNSAOMHDYBHMZ-HZPDHXFCSA-N 383.517 5.401 30 20 GKED Cc1cc(Cl)cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1 123258673 VMDCFYCWRUFZDH-KRWDZBQOSA-N 377.856 5.134 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NCc1nnc(-c2ccc(C#N)cc2)o1 133519243 FIYLGACGEUPYKV-UHFFFAOYSA-N 398.491 5.680 30 20 GKED N#CCCN(C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)C12CC3CC(CC(C3)C1)C2 133742590 AQQRVAJQBMJDPZ-XOUIXPDISA-N 382.470 5.066 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cnoc1-c1ccc(Cl)s1 135574523 GHRJUJJNUWYVFL-LBPRGKRZSA-N 389.933 5.920 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)o1 153969112 CTUGONUCFUEMCG-APWZRJJASA-N 397.544 5.989 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3nn(C(C)C)cc3C#N)c(F)c2)cc1C 161029405 XRMZMWFFYUCFHS-UHFFFAOYSA-N 376.435 5.011 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 171552174 YWIKEVYPXIPYDF-QFIPXVFZSA-N 386.455 5.058 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 177103712 RLSJCOORWLHIHK-SECBINFHSA-N 385.703 5.638 30 20 GKED CCCN(C(=O)Nc1ccc(F)cc1OCC#N)[C@H](C)c1cc2ccccc2o1 178148938 CKYHIABLNIWTGD-OAHLLOKOSA-N 395.434 5.479 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(OCc2ccc(F)cc2)cc1 180550893 SRKPXDBCONUMEX-GOSISDBHSA-N 390.458 5.158 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccc(OC(F)F)cc2)ccc1OC 237169889 CCHHIVMJWZTDJT-OAHLLOKOSA-N 377.431 5.102 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)ON=Cc2ccccc2OC(C)C)c(Cl)c1 255712770 LEAXBBBNWOLMDF-MRXNPFEDSA-N 388.895 5.122 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccc2ccc(Cl)cc2n1 329173023 LFJOUKISPVKUHV-ZDUSSCGKSA-N 387.892 5.183 30 20 GKED Cc1c(-c2nc(Cc3nccc4ccccc34)no2)sc2ccc(C#N)cc12 426633990 KCYSDSBPDRXDIM-UHFFFAOYSA-N 382.448 5.270 30 20 GKED CC(C)c1ccc(CN(Cc2cn(CCC#N)nc2-c2ccncc2)C2CC2)cc1 435137271 KSFQVXNGYIBLBV-UHFFFAOYSA-N 399.542 5.147 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCOCc2ccccc2)cc1F 437500315 XBAAQSOVYOCBMU-UHFFFAOYSA-N 390.414 5.035 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)N[C@@H](CCC#N)c3ccccc3)oc12 438849026 RBNYNJHLOLQXHJ-LPHOPBHVSA-N 391.471 5.237 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1 439128552 FLKYTKDTOWMQOY-QGZVFWFLSA-N 397.404 5.094 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1 439691862 IENAXMWBKRUTPP-UHFFFAOYSA-N 398.875 5.233 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](CC)c1nccs1)c1ccc(C(F)(F)F)cc1 441522871 SABGMSXZRJFVJL-JKSUJKDBSA-N 397.466 5.620 30 20 GKED Cc1c(Br)cccc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 442671198 KTIMJGSSNUAWIU-OAHLLOKOSA-N 397.297 5.371 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)c2)cs1 443892107 QERVHWYCRDAEAP-UHFFFAOYSA-N 387.386 5.261 30 20 GKED N#CCc1cccc(NC(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)c1 455903000 HVOOFBXABLIOSE-UHFFFAOYSA-N 385.920 5.195 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H](Cc2ccccc2)C1)c1ccccc1 458795355 CKYHTVBGGRJFCS-GGAORHGYSA-N 375.516 5.086 30 20 GKED CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@H](CCCC#N)c2ccccc2)s1 458808245 YRQYWXWGFVEFIZ-SJLPKXTDSA-N 384.549 5.152 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)[C@H](C)c1cccc(C#N)c1 462215647 RJOYIPKKFHEWJL-WBVHZDCISA-N 389.524 5.313 30 20 GKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 467609738 BNTGBTDNQADCSX-CVAIRZPRSA-N 381.907 5.648 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(F)ccc1-c1ccoc1 470887515 FNRWBHRWURYNSA-AWEZNQCLSA-N 380.444 5.590 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1c2ccccc2SC[C@@H]1C 472584882 YCKFPHOIUWVRDA-HOTGVXAUSA-N 397.569 5.020 30 20 GKED CC(C)c1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 474821511 LHDOLWRCHOUQNW-HNNXBMFYSA-N 381.888 5.472 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccccc1C(F)(F)F 476086529 QJYFXBOKEWYWSE-HNNXBMFYSA-N 391.433 5.963 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC[C@@H]2c2cccnc2)cc1 479516343 MUANFQYUUHRQNW-OAQYLSRUSA-N 385.492 5.082 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@@H]1c1ccccc1 480590708 ZLLCAUNDOJIYPI-SBUREZEXSA-N 383.451 5.575 30 20 GKED COc1ccc(-c2ccncc2)cc1CN1CCC[C@H]1[C@@H](C#N)c1ccccc1 481997973 JXFRMVUTBQMHKM-ZEQRLZLVSA-N 383.495 5.029 30 20 GKED N#CCCN(C(=O)c1cccc(C(F)(F)F)c1F)C12CC3CC(CC(C3)C1)C2 486591151 QWXBVMFYNSADCL-UHFFFAOYSA-N 394.412 5.169 30 20 GKED CC(C)(c1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1)C(F)(F)F 487174672 FLCHAXHXYVFKDI-LJQANCHMSA-N 388.433 5.691 30 20 GKED C=CCn1c(SCC(=O)c2cc(C)c(F)cc2F)nnc1-c1ccccc1C 488908381 HOYPTDNVAZEHCF-UHFFFAOYSA-N 399.466 5.001 30 20 GKED C=CCOc1ccc(-c2nnc(SCCCC(=O)c3ccc(F)cc3)o2)cc1 489799496 DYFUIVQFMVVCTP-UHFFFAOYSA-N 398.459 5.196 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N[C@H](C)c1ccc(C#N)cc1 495168048 POIZGYRZBISHJP-ZIAGYGMSSA-N 395.915 5.118 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 497358659 UVHZFHUGACBNON-FDDCHVKYSA-N 395.572 5.348 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@H](C)Cc1ccccc1OC 499702510 DRRGPZZSZZQVGH-OAHLLOKOSA-N 377.937 5.194 30 20 GKED CCC(CC)CN(CC)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509911000 LRDSTDOSOIXJNV-UHFFFAOYSA-N 393.531 5.622 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(C#N)c(Cl)c2)cc1 514508791 ZNSYKLYVFSZAFK-HXUWFJFHSA-N 383.879 5.369 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1Cl 517821497 QXEMIRCLQYYOQV-GOSISDBHSA-N 386.842 5.124 30 20 GKED C=CCN(C(=O)C1CC(c2cccc(F)c2)C1)c1nc(-c2ccccc2)cs1 523353681 LNGGFSGBGPXCIG-UHFFFAOYSA-N 392.499 5.662 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H](c3ccccn3)C3CCC3)c2)c1 527774372 SZRDLLQXNCZEJF-VWLOTQADSA-N 383.495 5.163 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)N[C@H](CCC#N)c3ccccc3)c(C)c2c1 533051212 BQVZKBJKBMKZMQ-OAQYLSRUSA-N 388.467 5.038 30 20 GKED C=C[C@H](CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 534001743 YWFOZQLUFAVBEJ-OAQYLSRUSA-N 396.490 5.630 30 20 GKED COc1cccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1F 534170141 DHTSYDWMDQVWQC-SFHVURJKSA-N 394.833 5.395 30 20 GKED N#Cc1ccc(SCc2nc(O)c3ccc(Cl)cc3n2)cc1C(F)(F)F 542004133 DFYCRRXIPCDVRA-UHFFFAOYSA-N 395.793 5.172 30 20 GKED CSc1cccc([C@@H](NCc2ccc(CC#N)cc2)c2ccc(F)c(F)c2)c1 544083563 LVPBGDQBVXHSIE-HSZRJFAPSA-N 394.490 5.632 30 20 GKED COc1cccc([C@H]2[C@H](c3ccccc3)CCN2C(=O)c2ccc(CC#N)cc2)c1 544253202 FEYBNKNKKVNKOF-DQEYMECFSA-N 396.490 5.132 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@H]1c1ccc(Br)s1 544281673 YQSAQYWYVBFLIL-AWEZNQCLSA-N 390.306 5.060 30 20 GKED CC1(C#N)CCN(c2nnc(CCC3CCCCC3)n2Cc2cccs2)CC1 549948740 YWBLZBNDWNRAEL-UHFFFAOYSA-N 397.592 5.031 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC=C(c2ccco2)C1 552692978 TUXXSTDXJBZILD-UHFFFAOYSA-N 386.476 5.232 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3ccc(C#N)c(F)c3)s2)cc1 553790925 IELFRMSVXWPHCJ-KBPBESRZSA-N 395.503 5.550 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(-c3ccc(Cl)cc3)s2)CC1 554560298 JEROULCCVDLAQV-UHFFFAOYSA-N 393.943 5.521 30 20 GKED N#CC1(c2ccccn2)CCN(c2cc(C(F)F)nc3ccc(Cl)cc23)CC1 573239290 HSRQSAIUNWEGIQ-UHFFFAOYSA-N 398.844 5.283 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@@H](C)[C@H](C)CC4)ccc12 574286689 ABFLQRDYWAXHEK-YPMHNXCESA-N 391.496 5.120 30 20 GKED N#CCCCCCC(=O)Nc1cc(-c2ccco2)nn1-c1ccc(Cl)cc1 588928674 DJNDJLLJFWUZQC-UHFFFAOYSA-N 382.851 5.198 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C(F)(F)F)o1 594072592 UNHLWKFFXDBUCF-WBMJQRKESA-N 397.422 5.407 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(COCC(F)(F)C(F)F)c2)cc1 594494740 DTKDGZFSTWYQMK-UHFFFAOYSA-N 394.412 5.517 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692343 HSSWNEIYHKAKPC-UHFFFAOYSA-N 390.468 5.027 30 20 GKED Cc1ccnc2sc(C(=O)Nc3sc4c(c3C#N)CCCCCC4)c(C)c12 603996717 SPRNVAZLUQZOAG-UHFFFAOYSA-N 395.553 5.758 30 20 GKED C=CCCCN(C)C(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12 605645124 IGOWSEIHRQAWNU-UHFFFAOYSA-N 376.500 5.201 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)C1(c2cccs2)CCCCC1 606168895 WNCXCGRNZHEDTM-UHFFFAOYSA-N 391.458 5.137 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccnc2ccccc12 609061551 PGFGEDAEDWCAIB-UHFFFAOYSA-N 393.446 5.246 30 20 GKED COc1cccc(Oc2ccc(NC(=O)c3cc4ccccc4n3CC#N)cc2)c1 609165649 XCBHIXIQVHLIIC-UHFFFAOYSA-N 397.434 5.218 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)Nc1ccc(C#N)cc1 609288583 HVAZIKHIBDQPLQ-ZDUSSCGKSA-N 396.903 5.526 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)on2)cc1 609427537 IIAMOUJBDCTGAU-HNNXBMFYSA-N 377.469 5.297 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)c(F)c1 609464278 ZSOYXRNHYPNZNT-DEOSSOPVSA-N 399.469 5.287 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1ccccc1OC(F)F 609814892 HTLKYWMMEDQTSD-UHFFFAOYSA-N 384.407 5.069 30 20 GKED COc1ccc(CS[C@H](C)c2ccc(C#N)cc2)c(Br)c1OC 609825699 NUCJSOZVLMUPCC-GFCCVEGCSA-N 392.318 5.332 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)N[C@H](C)c1ccc(C#N)cc1 609919555 FTTAXKAEGHLRBP-DYESRHJHSA-N 389.524 5.272 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)N[C@H](C)c1cccc(C#N)c1 610358008 XGSQFIGIYRXXNC-KGLIPLIRSA-N 375.394 5.041 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(COCC3CC3)c2)c(Cl)c1 611096914 RYYQJNJTDNFKTK-UHFFFAOYSA-N 375.255 5.044 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)o2)cc1 613290947 PQFYGGAUZDSWBZ-IBGZPJMESA-N 380.403 5.187 30 20 GKED C=CC[C@@H]1CCCN(C(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)C1 617789318 FLBNXTKSZGEHDR-CQSZACIVSA-N 388.920 5.082 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CSc2ccc(Br)cc21 618807996 DLOMYRQDMSRTBK-ROUUACIJSA-N 385.330 5.135 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(F)c1Cl 619125406 PYEQDHSFSUBVRJ-UHFFFAOYSA-N 379.703 5.263 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCOC3(CCC3)C2)cc1)C(F)(F)F 647229781 CHOJDQUNCMDAGX-ZDUSSCGKSA-N 385.323 5.490 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)N1CC2(CCC2)[C@@H]1c1ccncc1 665437017 UEPAKGMAARBGBN-QFIPXVFZSA-N 399.519 5.302 30 20 GKED CCN(Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1)C(C)C 672583879 FMMWCJWQHAUCAM-GOSISDBHSA-N 395.503 5.156 30 20 GKED FC(F)(F)c1csc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 676307710 ZIVMLCKBXQDQLR-PHDIDXHHSA-N 386.283 5.483 30 20 GKED Cc1nc(NC(=O)/C=C/c2cccc(OC3CCCC3)c2)sc1SCC#N 727662880 BIZRGFWCNOWQHX-MDZDMXLPSA-N 399.541 5.041 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1cn2cc(Cl)ccc2n1 727781533 PHNLJAGSNGORBZ-CMDGGOBGSA-N 379.872 5.316 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)NCc2ccc(OCC#N)cc2)C(C)C)cc1 727938237 HQCPIWDVGFNURB-FDDCHVKYSA-N 393.531 5.299 30 20 GKED Cc1nc(SCC(=O)N[C@H](C)c2csc3ccccc23)c(C#N)c(C)c1C 729959904 LHLZLKPAVGXMOT-OAHLLOKOSA-N 395.553 5.063 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2Cl)o1)c1ccc(C(F)(F)F)nc1O 731563437 QGEVPODCWPVTCQ-VMPITWQZSA-N 393.748 5.616 30 20 GKED C#CCOc1cccc(NC(=O)N(Cc2cccs2)Cc2cccs2)c1 733633086 QKJVPEYSNAFVJW-UHFFFAOYSA-N 382.510 5.056 30 20 GKED C=CC[C@@H](NC(=O)NCCC(c1ccccc1)c1ccccc1)c1ccncc1 734515446 KPSZXGUPMBRNMM-XMMPIXPASA-N 385.511 5.220 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3c[nH]c4c(C)cccc34)n2)cc1 744034160 BIBIRUCKUZJAEU-FQEVSTJZSA-N 399.519 5.717 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)CCc3ccccc3F)n2)cc1 744035377 QZAURUJDOBQSMO-LPHOPBHVSA-N 392.499 5.703 30 20 GKED COc1ccc(C=NN=C2c3ccccc3-c3ccccc32)cc1OCCCC#N 747357312 NAJVPXZWZYOLFK-UHFFFAOYSA-N 395.462 5.230 30 20 GKED N#Cc1ccc(C(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)s1 750398210 WFOXCNGNMCJJPS-UHFFFAOYSA-N 394.399 5.119 30 20 GKED CC[C@@H](Oc1ccccc1C)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 750689900 NDZCENJMXGKSAC-GOEBONIOSA-N 384.888 5.292 30 20 GKED C/C(=C/C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1OC(F)F 753201455 UAIGHQMWGSFLMM-SQFISAMPSA-N 386.398 5.013 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2cccc(OC)c2)cc1 753392806 DXRSKJPXYFRVDU-JKSBSHDWSA-N 392.499 5.050 30 20 GKED C=CCC[C@H](NCc1cccc(Oc2cccc(C(F)(F)F)c2)c1)C(=O)O 756385037 CUSFKSFYSZVEGK-SFHVURJKSA-N 379.378 5.007 30 20 GKED CCCCCCN(C(=O)c1ccc(CC#N)cc1)c1nc2ccccc2s1 759752302 IGZQSAHMQSQFTQ-UHFFFAOYSA-N 377.513 5.589 30 20 GKED C[C@@H](OC1CCCCCC1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 761045578 CUODZJLHNRHLRI-DOMZBBRYSA-N 376.909 5.254 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(CC3CCOCC3)no2)c1 761988092 WNPBPQMNHBAAKI-UHFFFAOYSA-N 395.846 5.023 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1 764755026 LQNFDPAHDXJVFJ-SJORKVTESA-N 398.934 5.578 30 20 GKED C=C(C)C[C@H](C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 767697113 VARINKADSNEUMY-INIZCTEOSA-N 386.517 5.090 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3cccc(C#N)c3C)c2c1 770727509 FLIRFNVLRWBLGT-UHFFFAOYSA-N 378.435 5.038 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Br)ccc2F)c1 772986494 XPZFCOXYLVYEAU-BBRMVZONSA-N 391.284 5.120 30 20 GKED Cc1ncsc1/C=C/C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 776782558 KUWLNTAOKSUQCZ-BBVFFXRHSA-N 393.899 5.412 30 20 GKED N#C[C@H](C(=O)COc1ccc(-c2ccccc2)cc1)c1ccc2ccccc2n1 780302244 NCEHFRUZDFZURV-QFIPXVFZSA-N 378.431 5.157 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Cl)c(Br)c1 780587611 XNQDVWOKDNCMPN-JTQLQIEISA-N 394.656 5.037 30 20 GKED CC[C@@H]1C[C@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCO1 781763534 JNDNBGVFCBAMNW-XYPHTWIQSA-N 388.920 5.235 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccccc1CC(C)C 790292806 FASMHQLJVQJJPJ-UHFFFAOYSA-N 385.467 5.505 30 20 GKED FC(F)(F)c1cccc(-c2ccc(NN=C3CCC[C@@H]3c3ccccn3)nn2)c1 794981705 OISJZKXFZLRYOO-MRXNPFEDSA-N 397.404 5.293 30 20 GKED O=C(O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H]1CCC(F)(F)C1 796745755 RFYUUXMYRBLNCT-KCJUWKMLSA-N 376.243 5.287 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)cc1C#N 799337254 VSAONTBMRHIOQV-UHFFFAOYSA-N 389.842 5.025 30 20 GKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccn1 810556022 WYXVCSJEXQRJGL-ZIAGYGMSSA-N 397.450 5.243 30 20 GKED CC(C)Oc1cccc([C@H](OC(=O)C[C@H](CC#N)c2ccccc2)C(F)F)c1 810804481 COOWRUJVWJOQBI-UWJYYQICSA-N 387.426 5.411 30 20 GKED Cc1c(-c2noc([C@H](CCCC#N)NC(=O)OC(C)(C)C)n2)oc2ccccc12 818418326 SVYDEUYFDRLFRV-HNNXBMFYSA-N 396.447 5.051 30 20 GKED O=C(c1cc2ccccc2c(Cl)n1)N1CCCSC1=Nc1ccccc1 915133675 UZPZBJRHAKBPTG-UHFFFAOYSA-N 381.888 5.155 30 20 GKED FC(F)(F)c1cccnc1NN=Cc1sc(Oc2ccccc2)nc1Cl 915960589 KQZWSQWDPKWTHJ-UHFFFAOYSA-N 398.797 5.449 30 20 GKED CCCCCOc1ccc([C@H](C)NC(=S)Nc2ccccc2C#N)cc1OC 916019304 JYGKOAMPAFJUBL-INIZCTEOSA-N 397.544 5.183 30 20 GKED Cc1ccccc1C=Nn1c(C)nc2scc(-c3ccc(Cl)cc3)c2c1=O 916273382 ZWXZNPYIPQYRQG-UHFFFAOYSA-N 393.899 5.277 30 20 GKED CN(CCC#N)c1ccc(-c2nc3cc(Br)ccc3n2C2CC2)cc1 916854706 OGVRQAJCRSEDHZ-UHFFFAOYSA-N 395.304 5.151 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1ccc(Cl)cc1 916907220 XCYYCSWWTNCVCA-SFHVURJKSA-N 390.826 5.093 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccc(Cl)cc2)cc1 916947637 PBAAJTIAFKZAGJ-RYQCFHQQSA-N 380.875 5.214 30 20 GKED N#C[C@H](C(=O)COc1ccc2ccccc2c1)c1nc2cc(Cl)ccc2s1 917047325 WVYTUIVLXGIGNW-QGZVFWFLSA-N 392.867 5.358 30 20 GKED CCN(CC(F)(F)F)C(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 918595399 RXIZYNRWYNBFIO-ONEGZZNKSA-N 393.249 5.148 30 20 GKED CCN(CC)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 921201938 OHCMXCMGVYBWGQ-XMMPIXPASA-N 383.495 5.441 30 20 GKED CCc1cc(C(=O)O)c(C=NNc2c(Cl)cc(Cl)cc2Cl)s1 1776014406 GWDRECYANAGVRP-UHFFFAOYSA-N 377.680 5.415 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776119663 IFNGHZQATUVJPZ-XFXZXTDPSA-N 390.435 5.544 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(SC)c(C(=O)O)c2)c1 1776787621 WKOIZBSBPWLVOH-UHFFFAOYSA-N 387.545 6.068 30 20 GKED CCCCCCCOc1cccc(CNCC[C@H](Cc2ccccc2)C(=O)O)c1 1776788695 MUIAVSIPCCSHQU-HSZRJFAPSA-N 397.559 5.459 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(O[C@H](C)C(=O)O)cc2)oc2ccc(C)cc12 1776956295 QMUZLGAUVQOSDB-KUCQQTCKSA-N 378.424 5.052 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Cl)ccc3Cl)c2c1 1777685809 ZMIAFKXXRIMXQD-ORCRQEGFSA-N 377.248 5.802 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C3=CCCS3)CCC2)cc1 1789624279 TXWSYQGNXHCXDL-UHFFFAOYSA-N 398.572 5.134 30 20 GKED C#CCCCCC(=O)NC1(c2ccc(NC(=O)[C@]3(C)CC=CCC3)cc2)CCC1 1791994110 MNAUTJDIDJPMNX-XMMPIXPASA-N 392.543 5.061 30 20 GKED CC(C)CCSc1ccc(C(=O)Nc2ccc(CC#N)cc2)cc1[N+](=O)[O-] 8126359 WSPGHZIVUPSNMW-UHFFFAOYSA-N 383.473 5.051 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 14576725 DDTRNQRUFGDNSS-HNNXBMFYSA-N 399.475 5.241 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)Nc1ccccc1SC1CCCC1 25267242 RMFRNMWKMRFYID-UHFFFAOYSA-N 396.560 5.020 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(Cl)ccc2F)cc1 60347601 ZSZHOJFQLAVGEZ-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CC(C)c1nc(CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cs1 66954661 XUUUKGXHPXCCCQ-CQSZACIVSA-N 388.562 5.025 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1nc2ccccc2s1 108145837 VFPMPACPFMDKJP-ZDUSSCGKSA-N 399.566 5.279 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(Cl)cc1Cl 108354382 DCZORZOIUNRKLF-LBPRGKRZSA-N 394.327 5.296 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 116594578 BOIQDQJOBLAVEB-IFXJQAMLSA-N 389.455 5.191 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(F)c(F)cc1F 129523340 FDRIDYQVZRYPON-UHFFFAOYSA-N 396.368 5.115 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@@H](C)c1cccs1 133952927 KKNYUQQFZAMRKR-KBPBESRZSA-N 376.572 5.433 30 20 GKED C[C@H](SCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1cccs1 133964241 LBSFETLEEDADBG-ZFWWWQNUSA-N 384.551 5.542 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C(C)=C/c1cccc(Cl)c1 136601670 HJAOYEXUSHJJQH-IURSYISVSA-N 394.902 5.216 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCC[C@@H]3c3ccc(Cl)c(Cl)c3)o2)cc1 173546083 BIWSFSMXCCBTOL-GOSISDBHSA-N 399.281 5.252 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccccc2CC(F)(F)F)c1 174003384 HHODYIJMVKGCCG-UHFFFAOYSA-N 377.366 5.118 30 20 GKED N#Cc1csc(/C=C(/Cl)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)c1 176841001 RNUSHCMGUQOAKC-VIZOYTHASA-N 395.896 5.322 30 20 GKED C[C@@H](CSCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 178844086 HRABVNGPKSLNSE-HOCLYGCPSA-N 399.466 5.177 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c(C)n1[C@@H](C)c1ccccc1 183110494 PRQJYKVTEBYMNY-ROUUACIJSA-N 387.483 5.257 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@H](C)c1nccs1 184597637 VQUMJJAUDVEIEU-HNNXBMFYSA-N 392.484 5.041 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c2ccccc2n1 185264290 QRYXLOOFCGOOJF-LJQANCHMSA-N 394.459 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1cc(OC)ccc1OC 189908369 NSGBCIVCPCBLIG-TZIWHRDSSA-N 379.500 5.298 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(c2ccc(C)cn2)CC1 191418166 NOLWCXAXTRMGQQ-UHFFFAOYSA-N 392.547 5.032 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccccc1)C(C)(C)CO 191517452 DLYGIQGDWICWFR-QFIPXVFZSA-N 394.559 5.462 30 20 GKED Cc1cc(C)c(NC(=O)/C(=C\c2cccnc2)C(=O)c2ccccc2)c(Cl)c1 195388611 NMCJMBSRIVKRJQ-UYRXBGFRSA-N 390.870 5.257 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(Cl)s2)cc(Br)c1O 206089135 JAWTZVLAQYXWBH-ARJAWSKDSA-N 387.682 5.164 30 20 GKED COc1cccc(-c2ccc(CNCc3cccc(OCCCC#N)c3)cc2)c1 237343299 OZNZZANPSUOAIE-UHFFFAOYSA-N 386.495 5.335 30 20 GKED O/C(=N/C[C@@H]1CCC2(CCOCC2)[C@@H]1O)C1(C2CCCCC2)CCCCC1 328699473 MGMVSUAHYJIRIL-AZUAARDMSA-N 377.569 5.041 30 20 GKED Cc1nc2ccc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)cc2o1 329452582 NJWBPWHJEHTZFQ-MRXNPFEDSA-N 378.476 5.231 30 20 GKED OC(=Nc1cccc(-c2ncco2)c1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329503666 ZCFJMBGXAAOVKV-KRWDZBQOSA-N 390.487 5.436 30 20 GKED Cc1c([C@H]2OCC[C@@H]2/C(O)=N/CC2(c3ccccc3)CCCCCC2)cnn1C 329916925 ZBUCHUSAUGQDTG-UNMCSNQZSA-N 395.547 5.055 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 409820218 IUDGUAQHSSECIJ-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CC(C)c1ccc2c(c1)[C@@H](NCc1cn(CCC#N)nc1-c1ccncc1)CCC2 433331597 NMFPWZLPNNFDMK-DEOSSOPVSA-N 399.542 5.149 30 20 GKED CC(C)(C)c1nc(SCCC(C#N)(c2ccccc2)c2ccccc2)n[nH]1 434642109 DBGAOAFDVLBYSU-UHFFFAOYSA-N 376.529 5.094 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC(c2ccccc2Br)CC1 439230762 ASWLIDCZEWSRQY-UHFFFAOYSA-N 398.304 5.041 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC1CCCCC1)c1ccc(C(F)(F)F)cn1 442613599 CVNFHQZWKYEREE-QGZVFWFLSA-N 388.389 5.302 30 20 GKED CC(F)(F)c1ccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C(F)(F)F)cc1 456577212 OLQKPPOLMBIISA-NWDGAFQWSA-N 389.286 5.144 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2csc([N+](=O)[O-])c2)c1 460331736 QWPDMTBYLWSCBI-UHFFFAOYSA-N 397.843 5.028 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 460565706 PCSPJWVNKYGILK-SUMWQHHRSA-N 395.334 5.210 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ccc(OC(F)F)cc3)c2)c1 462206438 BZSPRBBTBCOTKD-UHFFFAOYSA-N 380.394 5.351 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 463746675 OEGGJPKDPCWLEZ-CQSZACIVSA-N 394.327 5.411 30 20 GKED COc1cccc(-c2nc(CN3CCC[C@@H]3[C@H](C#N)c3ccccc3)cs2)c1 464823351 QCFJOCHETHSRSS-FGZHOGPDSA-N 389.524 5.090 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3c(Cl)cccc3Cl)CC2)c1 468912029 KEDMYAXHPNSZOB-UHFFFAOYSA-N 389.282 5.346 30 20 GKED C/C(=C\c1ccc(Cl)cc1)CNc1ccc2c(c1)CCC(=O)N2CCCC#N 469027392 RATITTGSOGFNNW-SAPNQHFASA-N 393.918 5.438 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(C)ccc1OC 469342823 HSGHJCKWPTXPAF-NRFANRHFSA-N 391.515 5.150 30 20 GKED C[C@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)CC[C@@H]1c1ccccc1 469454570 LQZWDIFJKXRWOT-FPOVZHCZSA-N 385.511 5.211 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F 471519778 LGYMCMHLCPPNMN-MRXNPFEDSA-N 398.457 5.280 30 20 GKED N#CC[C@H](CC(=O)NCc1ccc(OC2CCCCC2)cc1)c1ccccc1 475443326 FGNSVVSUOJJKJV-OAQYLSRUSA-N 376.500 5.102 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 475664432 YNYLQULZOSFMKU-HZPDHXFCSA-N 383.923 5.797 30 20 GKED CCN(CC)C(=O)c1ccccc1NCc1ccc(-c2ccccc2C#N)cc1 486140053 WDUBBJRCYBGHEI-UHFFFAOYSA-N 383.495 5.319 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(-c2nc3cc(F)ccc3n2C)cc1C 488453807 BVFPEPDYIFVJLL-GOSISDBHSA-N 392.478 5.260 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(F)cc(Br)c1F 489392989 SJCBVADJGUZCQE-UHFFFAOYSA-N 384.245 5.258 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(-c3ccco3)cc2F)C2CC2)cc1 490513462 LBNSKLDRNUJICK-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1 500404953 QORUMJXJKIHRGL-HNNXBMFYSA-N 392.952 5.648 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccccc1)c1ccc(C)cc1 503723880 AHDZSEWDPNSUII-VWLOTQADSA-N 397.522 5.578 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(CN(CC)C2CC2)cc1 508782926 FJPXZORRKTYFJS-UHFFFAOYSA-N 388.964 5.214 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 509476007 CEQQNODEZZITPP-UHFFFAOYSA-N 389.402 5.144 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H](C)[C@H]1C 510104862 MNPABERNPIEXRN-FUHWJXTLSA-N 377.488 5.098 30 20 GKED CCOc1ccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1OCC 511773257 NOSTZLPAGCIOGC-UHFFFAOYSA-N 392.480 5.336 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1nc2ccccc2o1 512952144 BTCADKWEURGELJ-HNNXBMFYSA-N 389.798 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1nc2ccccc2cc1Cl 516218948 KXQYNUCHRBSBIX-ZDUSSCGKSA-N 381.888 5.535 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCCc3nc4ccccc4[nH]3)c2)cc1 517879261 KJQNBTDOLZFDBB-UHFFFAOYSA-N 396.450 5.188 30 20 GKED Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 518143606 OHRADXLBELMBTN-ZDUSSCGKSA-N 379.460 5.186 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)[C@H](C)c1ccc(F)cc1 520324861 PWNPNEOANFPRBC-MRXNPFEDSA-N 389.430 5.108 30 20 GKED C=C(C)COc1cccc(NC(=O)N(CC)[C@@H](C)Cc2ccc(OC)cc2)c1 521808535 JIQYZPRCWHQWOK-SFHVURJKSA-N 382.504 5.135 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C(C)(C)c1ccccc1F 523378696 OETSWWVEAQNCMA-UHFFFAOYSA-N 389.430 5.109 30 20 GKED Cc1nc(-c2ccc([C@@H](C)Nc3nc(C(F)(F)F)ccc3C#N)cc2)cs1 523754920 DOXFULFSZWBCRT-LLVKDONJSA-N 388.418 5.577 30 20 GKED N#Cc1ccc(NC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)cc1Cl 523900521 PSRDEXFKWGVZKV-UHFFFAOYSA-N 380.662 5.109 30 20 GKED COc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)c(C)c1 523949208 OYPQDULRYKMXNS-UHFFFAOYSA-N 392.842 5.573 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 524147197 YHLKARLLQWTHPS-XMMPIXPASA-N 399.494 5.146 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(COc3ccc(F)cc3)o2)c1C#N 524331376 HYXSVFDFRXAUHK-UHFFFAOYSA-N 384.432 5.054 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC[C@H]2c2ccccn2)cc1 532049687 BJMRRDYGQLFVCT-QFIPXVFZSA-N 383.451 5.031 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 535324634 GNFJRUAGMWIXDW-NRFANRHFSA-N 381.863 5.062 30 20 GKED N#CC1(CCCSC(c2ccc(F)cc2)c2ccc(F)cc2)CCOCC1 540953920 WYBQMMQWSZOFHH-UHFFFAOYSA-N 387.495 5.888 30 20 GKED Cc1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2ccccc12 542947731 LIDRCDVYEVQUBN-QGZVFWFLSA-N 378.479 5.328 30 20 GKED C=CCCO[C@H](C)c1nc(-c2ccc(NC(=O)Nc3ccccc3)cc2)no1 546333088 QVHBYVXQAOUSSY-OAHLLOKOSA-N 378.432 5.034 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)[C@@H]1CC[C@@H](C(F)(F)F)C1 552250584 QHZONJOPPQMWHO-NXEZZACHSA-N 387.295 5.074 30 20 GKED Cc1c([C@H](C)N[C@H](CCCC#N)c2ccccc2)nnn1-c1cccc(Cl)c1 556201121 PXKWSIMSOZAOEZ-HRAATJIYSA-N 393.922 5.315 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2sc(Cl)cc2C1 567586293 PLLKNBGMYBWKOK-GFCCVEGCSA-N 391.949 5.243 30 20 GKED CCc1ccc(C[C@@H](Cc2ccc(Cl)cc2)NCC2CCC(C#N)CC2)nc1 568438225 LLZYZUKBYHHVIA-SLXFGWRHSA-N 395.978 5.371 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1ccc(C#N)cc1C(F)(F)F 584204678 WDCCCCHDZLMCLV-KRWDZBQOSA-N 386.339 5.669 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c1 589741143 ULZHTBZQJQAXBO-FQEVSTJZSA-N 378.476 5.037 30 20 GKED Cc1nc(-c2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2)oc1C 590070560 IQIGZXFKNLKIEG-OAQYLSRUSA-N 388.471 5.515 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)C1 596745593 CBSFEORRGVCZJK-SFHVURJKSA-N 379.529 5.278 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)C1 597909995 SRAPBJBEDANGFQ-CQSZACIVSA-N 389.282 5.552 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3ccsc3[nH]2)cc1 604254777 IRNCOZRWRPRXRL-UHFFFAOYSA-N 387.464 5.127 30 20 GKED Cc1ccccc1C1(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)CC1 609064594 HBFXAVFITRHXJO-UHFFFAOYSA-N 382.463 5.116 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@@H](Nc4ccccc4)C3)c2)cc1 609209082 WJLLZMAGSQLFOS-OAQYLSRUSA-N 398.466 5.069 30 20 GKED CC(C)c1ccc(OCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609377382 DHDQTUIBOKBTRE-QGZVFWFLSA-N 382.529 5.469 30 20 GKED COCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)c1ccccc1 609438906 NUZHBUFYWMZQIA-MSOLQXFVSA-N 397.544 5.322 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccccc3OC3CCC3)c2)c1 609825999 IECTXXRWVDVAHU-UHFFFAOYSA-N 398.506 5.358 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)c3ccc(C#N)nc3)cc2)c1 609978133 GSKLEOSHXZLSNS-UHFFFAOYSA-N 385.467 5.216 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(Cn2cccn2)cc1)c1ccc(C#N)cc1 610341300 QRBUQYWIEGZWDJ-HXUWFJFHSA-N 392.506 5.321 30 20 GKED C[C@@H](NCc1ccc(OCCN(C)C)cc1)c1ccc(-c2cccc(C#N)c2)cc1 611764590 HTODWYWVOBBFRV-HXUWFJFHSA-N 399.538 5.016 30 20 GKED CCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)sc1C 612941621 DJXRFYKLCLNMQY-OAHLLOKOSA-N 386.929 5.886 30 20 GKED CC(C)C[C@@H](C#N)NC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 613189662 RCRVUHVPGQXQSY-AWEZNQCLSA-N 376.884 5.298 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2)c1 613291204 WDGFHOAEUQVMEB-QHCPKHFHSA-N 392.458 5.612 30 20 GKED CCSc1ccc(-c2noc([C@@H]3CCCN3c3ccc(C#N)cc3)n2)cc1 618432501 ULHHBKHTDVODSY-IBGZPJMESA-N 376.485 5.062 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)CNc2ccc(C#N)cc2)c2cccs2)cc1 619724259 JSDLTLKKTPQHGF-HSZRJFAPSA-N 389.524 5.061 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(C#N)c(Cl)c3)s2)cc1 619755380 GVVZFZBQZATQRC-CYBMUJFWSA-N 397.931 5.503 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1CC[C@@H]1c1ccc(F)cc1 628112872 BWLPGCSWRDWCFP-CABCVRRESA-N 399.350 5.489 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nc(C2CC2)cs1 647372490 NLRBSKLFQXWMCE-CQSZACIVSA-N 378.478 5.131 30 20 GKED CC[C@H](C)n1c(SCc2ccc(OCC#N)cc2)nnc1-c1ccccc1 731158836 VHPXAUHNRSDSBG-INIZCTEOSA-N 378.501 5.111 30 20 GKED Cc1sc2ncnc(SCc3cc(Cl)ccc3OCC#N)c2c1C 735230816 JJXXAYMYXNLPEJ-UHFFFAOYSA-N 375.906 5.156 30 20 GKED C/C(=C/C(=O)N[C@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 742646388 NMWUMEMWPAWKEQ-QJWNTBNXSA-N 378.781 5.143 30 20 GKED CC(C)(C)n1cc(C=NNc2ccc(Cl)nc2)c(-c2ccccc2Cl)n1 743450223 NKJLJRRNRATHHN-UHFFFAOYSA-N 388.302 5.453 30 20 GKED CCC[C@@H](NC(=O)c1ccccc1OCC#N)c1ccc(Cl)c(Cl)c1 746383912 VAQONCIIGMHUBD-QGZVFWFLSA-N 377.271 5.167 30 20 GKED C=CCc1cc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)cc(OC)c1O 747063426 KALOYPIAOLKEAG-JYRVWZFOSA-N 377.484 5.016 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)c2ccc(Cl)s2)cc1 750686656 ILQOKLVGSOJSFP-WOSRLPQWSA-N 388.920 5.366 30 20 GKED C#CC[C@H](NC(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F)c1ccccc1 757887073 RMZIEVVAIYBNIN-SFHVURJKSA-N 397.450 5.059 30 20 GKED Cc1cc(Cl)cc2c1OCC/C(=C\c1csc(-c3ccccn3)n1)C2=O 768497642 DKKJBYKOWFDRRF-UKTHLTGXSA-N 382.872 5.216 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)C[C@@H](O)c3ccc(Cl)cc3)c2)cc1 772644183 GNKZOJKMZOUFQD-OAQYLSRUSA-N 392.842 5.066 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCOc3c(Cl)cc(C)cc32)c1 772982287 BPWIBVOZHWAVPJ-UTKZUKDTSA-N 384.907 5.333 30 20 GKED C=CCN(C(=O)N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21)C(C)C 779698746 OPICYFXRPKRIOU-LJQANCHMSA-N 387.524 5.017 30 20 GKED Cc1ccncc1/C=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 784832793 AMEPXRDWEMLTIP-DANOYGIBSA-N 379.872 5.057 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 789621647 SOBUTKBGICMAOG-FQEVSTJZSA-N 387.508 5.312 30 20 GKED CC1(c2ccc(Cl)cc2)CCN(C(=O)c2ccccc2SCC#N)CC1 792493150 GISROOIVLZMESV-UHFFFAOYSA-N 384.932 5.150 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1cccc(Cl)n1 793173612 BRKCLKPTXMRFSV-UHFFFAOYSA-N 388.302 5.203 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@H](c1ccccc1)C1CCCCC1 806447520 ZRYQZCFEOWEZRW-HSZRJFAPSA-N 396.531 5.181 30 20 GKED O[C@@H](c1ccccc1NCc1cc(F)c(C(F)(F)F)cc1F)C(F)(F)F 809190650 PFFPBLLTTPTCMQ-AWEZNQCLSA-N 385.254 5.191 30 20 GKED CC(C)(CC(F)(F)F)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 850762083 FLRLZQSXLZYCSN-GFCCVEGCSA-N 386.826 5.618 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2cccs2)C2CC2)cc1 915354094 VAZQSKWTVFEJAD-UNMCSNQZSA-N 387.508 5.676 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1cc2c(ccc3ccccc32)o1 915985733 PHNHFMAXEDPLFJ-KTKRTIGZSA-N 382.444 6.001 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C3\CCc4ccccc4C3=O)c2)cc1 916135645 BYLWURFPCSAYTF-HMMYKYKNSA-N 383.447 5.160 30 20 GKED C=CCN(Cn1nc(-c2cccs2)n(Cc2ccccc2)c1=S)C(C)C 917481724 XGGASFNKCAFBCR-UHFFFAOYSA-N 384.574 5.045 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C\c1ccc2ccccc2n1 917712543 HKJMYVCLZUCZEI-SEYXRHQNSA-N 381.460 5.487 30 20 GKED CSc1ccc(Oc2ccc(F)cc2C=NNc2ccc(C(=O)O)cc2)cc1 1776012562 WEFDIIUNIKCTNV-UHFFFAOYSA-N 396.443 5.484 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)c(F)c1 1776127975 KVDCBLYQEIXRPT-KPKJPENVSA-N 390.410 5.025 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)c(C)s1 1776133152 ORUFMMASJSGXLC-KTKRTIGZSA-N 392.476 5.538 30 20 GKED C=C(C)C[C@@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776137679 QVFBFFZPLSUMQV-QGZVFWFLSA-N 398.261 5.434 30 20 GKED C[C@H](Oc1cccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)c1)C(=O)O 1776473535 OELGDAJWJDDIEI-MBSJSRAVSA-N 396.508 5.469 30 20 GKED CCCCCCCSc1ccc(C(=O)N2C[C@H](C)CC[C@@H]2C(=O)O)cc1 1776787556 WMIDFFPORGVXNA-VQIMIIECSA-N 377.550 5.074 30 20 GKED COc1ccc2c(c1F)C/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)s1)C2=O 1777373695 RZSSSUPIPRXBQW-GXDHUFHOSA-N 394.423 5.083 30 20 GKED Cc1cc2c(s1)C/C(=C/c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777428064 JZHBCCOFOKMGCX-AAKHDSTQSA-N 390.460 5.084 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(/C=C\C(=O)O)o1 1777487702 GLEGCRPDGCNXFC-WGEIWTTOSA-N 399.855 5.359 30 20 GKED O=C(O)CCCOc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc1 1777639380 SBYRHMVHQMMDDX-OUKQBFOZSA-N 392.476 5.555 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCc3ccsc3)cc2)CCC1 1788186872 KIBKHGOZAXLQCL-KRWDZBQOSA-N 396.556 5.027 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H](C)CC)CC1 1824345265 LYSFBLUAUSMWQF-FPOVZHCZSA-N 390.612 5.035 30 20 GKED Cc1csc([C@@H](C#N)C(=O)CSc2ccc(Cl)c(C(F)(F)F)c2)n1 20067066 TUJPZKQCOASLRS-JTQLQIEISA-N 390.839 5.092 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)ccc1OC1CCCC1 48857901 OEPQCSBHPRCATF-LJQANCHMSA-N 386.451 5.055 30 20 GKED C#CC[C@@H](OC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccccn1 68594991 AWGQUXKJEYRDPM-HXUWFJFHSA-N 394.521 5.060 30 20 GKED CCCC(=O)Nc1ccc(Cl)c(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1 119772543 BNVACYVHEZDWJD-SFHVURJKSA-N 398.894 5.245 30 20 GKED N#Cc1ccsc1NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 120219086 DENZBBDOUHLEQI-UHFFFAOYSA-N 392.267 5.153 30 20 GKED CCS[C@@H](C)c1noc(CNc2ccc(Oc3ccccc3C#N)c(F)c2)n1 158252177 NTCGCVFJQQHDHR-ZDUSSCGKSA-N 398.463 5.299 30 20 GKED CC(C)COC1CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 171551636 OQUYZNXWBBXPJM-UHFFFAOYSA-N 393.487 5.019 30 20 GKED CCc1ccc(N(C(C)=O)c2nc(CSc3ccccc3C#N)cs2)cc1 172680353 FFOLQKUGYRBUNJ-UHFFFAOYSA-N 393.537 5.554 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1cccnc1 177847537 UIKHRMSXHDZPQD-FUHWJXTLSA-N 382.533 5.037 30 20 GKED Cc1c(C#N)cccc1NC(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 178564676 IQPIREBRHUXLRA-QGZVFWFLSA-N 398.466 5.002 30 20 GKED COc1ccc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)cc1CN1CCCCC1 183370509 QMHXHBLKOQAFMJ-YKSBVNFPSA-N 391.559 5.377 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H](C)c1sc(CC)nc1C)c1ccc(F)c(F)c1 185481798 SYGMZPADSQTZJV-ACJLOTCBSA-N 393.503 5.312 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ncc(-c2ccccc2)cn1 191423160 FPIDHRGCSXDZND-UHFFFAOYSA-N 386.499 5.317 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 195469722 VTCBKEOXTTUZKZ-UHFFFAOYSA-N 395.484 5.122 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCCCC[C@H]1c1ccco1 246845237 VHPKOAOWZIIFQY-HKUYNNGSSA-N 397.544 5.230 30 20 GKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1c(Cl)nc2sccn12 255507534 VVXFBJCOGBJMFU-ARJAWSKDSA-N 383.835 5.146 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c1 390856044 LKCIQZGLTYKLMC-NSHDSACASA-N 389.318 5.068 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)C(C)(C)c2ccccc2Br)cc1 409708718 AWFLWAXKPKJSCM-UHFFFAOYSA-N 385.305 5.167 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@@H](C)CC3)n1 410988899 TUSAGZPHFSBDOI-QWRGUYRKSA-N 388.924 5.125 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638508 XXIXAADFIHRQIW-LLVKDONJSA-N 381.785 5.455 30 20 GKED N#CCC[C@H](NC(=O)N1CCc2c(ccc(Cl)c2Cl)C1)c1ccccc1 438846734 KQJUSWVOPRRHKP-SFHVURJKSA-N 388.298 5.106 30 20 GKED CCCC(O)(CCC)CC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 439845029 XJOLONUYLUYSOO-UHFFFAOYSA-N 394.515 5.106 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)CC1 440999341 OMYRIHZMBSOERD-CPAJTMIGSA-N 399.897 5.198 30 20 GKED Cc1ccccc1C(NC(=O)NCC1CCC(C#N)CC1)c1ccccc1C 441003043 WSWXEIWFQHFBFY-UHFFFAOYSA-N 375.516 5.022 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 442598481 APLOCILIEBDVES-ZDUSSCGKSA-N 379.407 5.013 30 20 GKED Clc1cccc(C#CCSc2nnc(C3CC3)n2Cc2ccccc2)c1 448106874 GSULRWFIPXURIS-UHFFFAOYSA-N 379.916 5.001 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCc1ccccc1)c1cc(C(F)(F)F)ccn1 464405959 MXHUVABVFZVJPE-FQEVSTJZSA-N 394.396 5.376 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464463765 FXOXBWJBKRWJSF-YJBOKZPZSA-N 397.400 5.196 30 20 GKED C=C(C)COc1cccc(NC(=O)NC(C)(C)c2nc(C(F)(F)F)cs2)c1 467708955 NNRSNSNPHFROLN-UHFFFAOYSA-N 399.438 5.174 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2cn(CCCC#N)c3ccccc23)C1 469451539 CFTVQVDGJLLQQQ-WOJBJXKFSA-N 385.511 5.272 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(SCc3ccccc3)cn2)cc1 476473269 VUKZZTVOVWCEJK-UHFFFAOYSA-N 387.508 5.427 30 20 GKED N#Cc1ccc(NC(=O)CSCc2nc(-c3ccccc3Cl)cs2)cc1 478667688 RYLDZZRIDXAOPD-UHFFFAOYSA-N 399.928 5.207 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1nc2cc(C(F)(F)F)ccc2o1 483223772 WQUNNEVZRWPHEM-SJLPKXTDSA-N 385.389 5.118 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccc2ncsc2c1 485641869 XBJGHCOXHGKVTH-OAHLLOKOSA-N 383.476 5.326 30 20 GKED N#CCCC[C@H](NC(=O)COc1ccccc1-c1ccccc1)c1ccccc1 487410351 XLUFTYXQRXBTSU-QHCPKHFHSA-N 384.479 5.284 30 20 GKED CSc1ccc(C(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)o1 491980625 RFOQWBBHRPSNIO-MJOKBVDLSA-N 398.553 5.416 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C#N)c(Cl)c2)cnn1-c1ccc(Cl)cc1 498296530 RIAIYCXLXMHLOL-UHFFFAOYSA-N 399.281 5.426 30 20 GKED N#CCCN(Cc1cccnc1)C(=O)c1cc2sc3ccccc3c2s1 500074326 PMAYWDFTCYJZNM-UHFFFAOYSA-N 377.494 5.067 30 20 GKED C=CCOc1cccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)c1 503269264 ZWDFBAAAWJBRDC-QHCPKHFHSA-N 378.903 5.373 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc2scnc2c1 505865348 AGTQYWLIQBVUBQ-UHFFFAOYSA-N 387.489 5.571 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F)c1ccc(C#N)cc1 506846137 TVPGLQIPFZGSSH-LLVKDONJSA-N 397.784 5.035 30 20 GKED Cn1cc(CNc2ccc3nc(C(F)F)sc3c2)c(-c2ccc(C#N)cc2)n1 513035958 JQNFPFWFYWLOES-UHFFFAOYSA-N 395.438 5.118 30 20 GKED Cc1c(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)sc2ccc(C#N)cc12 513262971 WLEXLXVLBPWDOR-INIZCTEOSA-N 392.446 5.276 30 20 GKED CN(Cc1ccc(C#N)s1)[C@H]1CCSc2ccc(Br)cc21 513728116 FNXABAQQJKNDDA-HNNXBMFYSA-N 379.348 5.051 30 20 GKED C[C@@H](NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 513808088 NEWBNTWJCACYNP-CYBMUJFWSA-N 389.282 5.095 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2)o1 515479851 VSGMDMVMYCXUDA-UHFFFAOYSA-N 386.329 5.001 30 20 GKED CCN(C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1)[C@H](C)c1ccc(C#N)cc1 516209417 KYXOYCYKZRTSHT-MOPGFXCFSA-N 399.494 5.317 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517654291 LSTMWMCFBJKFNR-UHFFFAOYSA-N 390.414 5.335 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 519367923 LNILSQZOSZADSZ-WMJYUBJYSA-N 387.508 5.015 30 20 GKED COc1ccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)c2c1 519977495 UFMIDJHVIWVKSW-UHFFFAOYSA-N 397.434 5.022 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 520105995 LZNNYEPFXPCJDO-HXUWFJFHSA-N 386.495 5.093 30 20 GKED C=CC1CCN(C(=O)Nc2c(C)c(C)nn2-c2ccc(Cl)c(Cl)c2)CC1 522780688 WFUCFKQISRHMKZ-UHFFFAOYSA-N 393.318 5.226 30 20 GKED COCc1cccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c1 523880689 RHGSIYAUVQYZCZ-UHFFFAOYSA-N 392.842 5.403 30 20 GKED CC(C)n1cc2cc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)ccc2n1 524048878 IDNYNBWZXKFNHV-UHFFFAOYSA-N 396.450 5.533 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C[C@H](C)c1ccccc1 524304679 HUYFWSPUKAIQQB-IBGZPJMESA-N 399.494 5.926 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Cc3ccsc3)cc2Cl)c1 524390841 GDFAPZACISOISK-UHFFFAOYSA-N 382.872 5.033 30 20 GKED N#Cc1ccc(NC(=O)c2ccnc(Oc3ccccc3)c2)cc1C(F)(F)F 524768749 CGMLZRBHAYMPRD-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCN(C(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl)c1nc2c(s1)CCCC2 524824544 YMQNDHDILJJPFJ-OLZOCXBDSA-N 390.911 5.137 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc([C@@H]3CCOC3)c2)cc1 534139124 LETFAGCAUAZZIH-HXUWFJFHSA-N 384.435 5.107 30 20 GKED C[C@@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(C(=O)c2ccccc2)c1 534869530 WLPUVSOGEZBDAR-GOSISDBHSA-N 396.490 5.461 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)N2CCC(C(F)F)CC2)cc1Cl 536437310 AKYMOHYQDVHTRF-UHFFFAOYSA-N 390.817 5.121 30 20 GKED CC(C)(C)[C@H]1CCc2nc3ccccc3c(C(=O)N3CCC(CC#N)CC3)c2C1 541981387 ADDPMCKYPVBUNP-SFHVURJKSA-N 389.543 5.152 30 20 GKED Cc1ccc(NC(=O)C[C@H](C)Nc2cccc(OCCCC#N)c2)c(Cl)c1 542153930 KCFIPWSBPKYMFH-INIZCTEOSA-N 385.895 5.160 30 20 GKED CCC[C@H]1[C@@H](C)CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555007832 UAMXYJUNRSLFAR-KKSFZXQISA-N 378.476 5.178 30 20 GKED C=CCc1ccc(OCC(=O)N(c2ccc(F)cc2Cl)C(C)C)c(OC)c1 555068082 HAPAHCUYHSJOIP-UHFFFAOYSA-N 391.870 5.037 30 20 GKED CCCc1ccc([C@@H](NCc2cnc3ccc(C#N)cn23)c2cccs2)cc1 556582378 LPGHOBJGKULGAW-HSZRJFAPSA-N 386.524 5.099 30 20 GKED C=CCC[C@@H](Nc1ccc(C)c(NC(=O)CN2CCCCC2)c1)c1ccco1 556891260 CVUZMWPAKIHDBH-HXUWFJFHSA-N 381.520 5.132 30 20 GKED C=C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CCC3)CC1 557637933 GPOJIMBMTQRZPO-FBMGVBCBSA-N 384.479 5.497 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2ccc(F)c(C#N)c2)cc1 560077503 RVDNQQNILBNIEO-INIZCTEOSA-N 388.442 5.206 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1OC1CCCC1 578294583 BKGAZIUTAHRYJO-HXUWFJFHSA-N 386.451 5.055 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC(C)(C)[C@H]1C1CC1 583292388 HLXSDHZAQUGLTD-JOCHJYFZSA-N 389.499 5.098 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2cccc(C(F)(F)F)n2)no1 583406418 FXRWSORGFBDSEW-GFCCVEGCSA-N 391.246 5.228 30 20 GKED CCCC[C@@H](C)N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 589321818 APWPGOUZZRTAJV-GOSISDBHSA-N 379.504 5.374 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)Nc1ccc(C#N)cc1 609288582 HVAZIKHIBDQPLQ-CYBMUJFWSA-N 396.903 5.526 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)on1 609382827 UHVCVRKUGIAIAD-CYBMUJFWSA-N 397.887 5.499 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609647410 MSGFRTGZMPLKIH-PGRDOPGGSA-N 382.463 5.369 30 20 GKED CCN(CC)C(=O)[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 609709249 KQEQYEBZXHFAEQ-XMMPIXPASA-N 399.494 5.372 30 20 GKED C[C@H](Sc1ccc(Cl)cc1C#N)C(=O)Nc1ccccc1C(F)(F)F 610655058 OLRMITKEORZMER-JTQLQIEISA-N 384.810 5.350 30 20 GKED C=CCn1c(S[C@H](C)c2cc(F)ccc2F)nnc1-c1ccccc1OC 615346684 VHVFDEABYAGAQJ-CYBMUJFWSA-N 387.455 5.271 30 20 GKED CN(C(=O)c1cc(-c2cccc(C#N)c2)no1)c1ccccc1-c1ccccc1 619216822 HHXHQXJMRVPBNR-UHFFFAOYSA-N 379.419 5.157 30 20 GKED O=C(CC1CCC(F)(F)CC1)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 623982672 CZSRZOJAISGHHV-GHMZBOCLSA-N 395.334 5.228 30 20 GKED CN(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)C1CCC(F)(F)CC1 666801732 LZEBMEHYLMJRLM-UHFFFAOYSA-N 398.338 5.259 30 20 GKED Fc1ccc2c(c1)[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CCCO2 675737610 IJROCXKFEJKXGB-REJLFOLJSA-N 399.350 5.539 30 20 GKED N#C[C@@H](C(=O)c1cncc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 679980502 ZSFAUUYQRFSWLI-AWEZNQCLSA-N 397.381 5.353 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2ccc(CSc3nc(C)cs3)cc2)c1 728536861 IFPKVCBUBKCLKZ-UHFFFAOYSA-N 392.549 5.392 30 20 GKED C[C@@H]1CCC[C@@H](OCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 733052916 UIIUDQLPRWZMOE-XYPHTWIQSA-N 388.920 5.235 30 20 GKED C[C@@H](Nc1ccc(NC(=O)Nc2cccc(OCC#N)c2)cc1)c1ccccc1 733623158 WSHYRBPFBGUJPG-QGZVFWFLSA-N 386.455 5.406 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)C2CCCC2)c1 733805143 NSUZMRULZKITMP-JTHBVZDNSA-N 391.515 5.098 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 734644723 UBPDVEUGCJMWJZ-HFRGRHLUSA-N 395.506 5.752 30 20 GKED N#Cc1ccc(-c2cccc(CNc3ccc([N+](=O)[O-])c4cccnc34)c2)s1 739890696 RHUMYIXDHRTZOG-UHFFFAOYSA-N 386.436 5.355 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cc4cccc(F)c4o3)c2)s1 741948578 NAXIYKKWFMJSKY-UHFFFAOYSA-N 376.412 5.102 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(C)c(NC(=O)OC(C)(C)C)c2)c1 742623021 BPSDEWULAHQECD-UHFFFAOYSA-N 396.487 5.549 30 20 GKED CCOc1cccc(NC(=S)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 742995119 LEGYDMWDUIBYGV-UHFFFAOYSA-N 389.480 5.558 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)[nH]c12 744162368 ZZRJMGQMNOEWMX-OWCLPIDISA-N 384.266 5.158 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)N[C@H]1CCCC[C@@H]1C 749101091 AOVNHZSOKSFNKM-GUYCJALGSA-N 399.373 5.029 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)sc21 752046812 COQLIAYLYVFDQJ-FPOVZHCZSA-N 399.519 5.305 30 20 GKED CC[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 752159227 DOGSPNZKFIYLRG-GJZGRUSLSA-N 388.414 5.685 30 20 GKED CC(C)c1ncc(/C=C2/CSC/C(=C/c3cnc(C(C)C)s3)C2=O)s1 758428219 BGDOTAWMSXNEFZ-GFIWHYBVSA-N 390.599 5.629 30 20 GKED C=C[C@@H](CC(=O)N(Cc1ccccc1)C[C@@H](O)c1ccsc1)c1ccccc1 759349886 UFVZREVEJGVPPJ-NZQKXSOJSA-N 391.536 5.170 30 20 GKED COc1cc(/C=C\C(=O)c2cc(Br)ccc2F)cc(Cl)c1OC 763122345 QDCGVWKLPRTXLG-UTCJRWHESA-N 399.643 5.155 30 20 GKED C=CC[C@@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccncc1 766020439 PMQWDHBNSJQTIG-MLGOLLRUSA-N 384.373 5.252 30 20 GKED FC(F)(F)c1nc(NN=CC2CCC(C(F)(F)F)CC2)c2ccccc2n1 767362457 XPJKPKPSMKYORN-UHFFFAOYSA-N 390.331 5.415 30 20 GKED CC(C)c1ccc([C@H](NC(=O)CNc2ccccc2O[C@@H](C)C#N)C(C)C)cc1 773369260 SPPRCJGSXIOUJK-MHECFPHRSA-N 393.531 5.026 30 20 GKED Cc1c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cccc1N(C)C 775815308 JLWHAUJAZKYLAW-UHFFFAOYSA-N 389.430 5.116 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(C)c(N3CCOC3=O)c2)cc1 777580955 JKXMVSRZVITURE-MRXNPFEDSA-N 386.879 5.256 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccccc2Cl)cc1 780167271 ZKWZMTGPSXJTED-HNNXBMFYSA-N 392.842 5.675 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782383197 MBZXXJNVRUIOSZ-RBUKOAKNSA-N 381.479 5.367 30 20 GKED C[C@@H](Cc1ccccc1)NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1 786059013 XFOWMQMIRYDMIO-FDDCHVKYSA-N 385.536 5.260 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](c2cccc(OC(C)C)c2)C(F)F)c1 788645282 OPQMTGAHTCUUHE-NQIIRXRSSA-N 388.458 5.251 30 20 GKED O=C1CCc2cc(C(=O)/C=C\c3cnc(-c4ccc(Cl)cc4)s3)ccc2N1 789128251 OXBQFJNYWDNTCG-CLFYSBASSA-N 394.883 5.244 30 20 GKED C=CCC[C@@H](Nc1ccc(OC)c(NC(=O)C2CCCCC2)c1)c1ccco1 796927937 XWCITUGKPSTPFM-LJQANCHMSA-N 382.504 5.926 30 20 GKED C[C@@H]1[C@H](C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)[C@@H]1c1ccccc1 797551650 MXEJVLRAWLMKCY-XGHOKTPJSA-N 394.446 5.314 30 20 GKED Cc1ccc(C(=O)N2CCC[C@@H]2c2nc(-c3ccccc3)c(C(C)C)o2)cc1C#N 799636299 KSEOMLSTXLIDID-OAQYLSRUSA-N 399.494 5.622 30 20 GKED C#CCOc1ccccc1-c1noc(-c2c(-c3cccc(Cl)c3)noc2C)n1 809395772 QITCXRCXDKKLJY-UHFFFAOYSA-N 391.814 5.032 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(Cl)cc2)CCCC1)c1cc(C(F)(F)F)ccn1 813214495 YPALIYSFYAJRGP-MRXNPFEDSA-N 392.808 5.442 30 20 GKED CC(C)[C@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1 813216218 PAXXWIYFZOPKDA-WBVHZDCISA-N 380.797 5.370 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C[C@]23CCCC[C@H]2C3(F)F)cc1 821861128 PGYCAZYYNINAOR-KCZVDYSFSA-N 380.438 5.496 30 20 GKED COc1ccc(NN=Cc2cn(C3CCCC3)nc2-c2ccccn2)cc1Cl 841633342 UZLMYKJBTIUXFV-UHFFFAOYSA-N 395.894 5.168 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(SC(F)F)cc1)C(=O)C1CC2(CCCCC2)C1 850756356 POCCIMYOPYGKKJ-MRXNPFEDSA-N 392.471 5.009 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)c1nc(-c2cccnc2Oc2ccccc2)no1 904455282 ZHYVNCVUCKFDSR-MRXNPFEDSA-N 382.423 5.142 30 20 GKED CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086815 NDDXOIOLQUEUPK-QFIPXVFZSA-N 388.442 5.277 30 20 GKED Sc1nnc(SCc2ccccc2)n1N=Cc1ccc(Cl)cc1Cl 916368902 UETJBTIRQNVAKZ-UHFFFAOYSA-N 395.340 5.048 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@@H](C)SCc2ccccc2)cc1 916948398 GJFOKMBMKYMMAR-FVJLSDCUSA-N 394.540 5.169 30 20 GKED C(=NN(Cc1ccccc1)c1ccccc1)c1csc(COc2ccccc2)n1 918708955 SGJQNYRSRFHKBW-UHFFFAOYSA-N 399.519 5.763 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1oc2c(C)cccc2c1C 920109548 QXHAWJMHJVBXJA-IBGZPJMESA-N 388.467 5.136 30 20 GKED N#CC1(C(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCCCC1 920671547 LMGNMDBKJJIUGE-UHFFFAOYSA-N 394.418 5.346 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1cc(F)ccc1SC(C)(C)C 1776050390 OLFYOVWARLDHHV-UHFFFAOYSA-N 390.480 5.259 30 20 GKED O=C(O)c1ccc(NN=C2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1F 1776074577 ILBAEFUMMSUCFJ-LBPRGKRZSA-N 381.234 5.566 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3ccc(Cl)cc3F)c2)c1 1776106511 JCALYWUJFITTOG-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C(F)(F)F)s1 1776354415 GLFJCQFEQLAJGS-GQCTYLIASA-N 384.375 5.148 30 20 GKED CCN(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776855386 ARUBZGVACUOTCG-WYMLVPIESA-N 391.492 5.466 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)Nc2ccccc2F)cc1 27161865 GALRXBNGJPWMRM-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)Nc2ccccc2F)cc1 27162044 CVZXHZABMNKBRX-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)Nc2cccc(C)c2)cc1 27174131 LVQDHBFGDRQGMY-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 60477561 AXHBJCQEYHKVQZ-QGZVFWFLSA-N 382.872 5.352 30 20 GKED N#Cc1c(NC(=O)CCSCc2cccc(Cl)c2)sc2c1CCC2 63128275 YQNTYHFIRNEXKQ-UHFFFAOYSA-N 376.934 5.024 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 65680312 BFLJKVRWMPRJNJ-UHFFFAOYSA-N 399.450 5.197 30 20 GKED Cc1nc(C(C)C)sc1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 66544640 LIVNLYFXKCDZCY-HNNXBMFYSA-N 392.509 5.060 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@H](C)CC)cc2)nnc1-c1ccco1 71833690 XLUJZXOAUXXYOI-OAHLLOKOSA-N 381.501 5.213 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C 158813778 BISBKQXEONBFOE-UHFFFAOYSA-N 379.504 5.457 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(Cl)s1 175132980 FYSSCTZIKSNQNE-RISCZKNCSA-N 397.912 5.377 30 20 GKED N#C[C@@H](C(=O)CC[C@@H]1CCOC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 176098023 ZTNRFNDMRXPYNR-RISCZKNCSA-N 395.311 5.110 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccc(Cl)cc2n1)c1nc2ccccc2n1C(F)F 176462473 ONQJKSLQCNIDSF-ZDUSSCGKSA-N 396.784 5.123 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCSC2(CCCCC2)C1 177088701 HQGJCRTUCPHVLS-INIZCTEOSA-N 389.590 5.222 30 20 GKED COc1ccc(/C=C(\C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1F 183861568 JHALGWNYFVKOSW-GWQWUEFDSA-N 384.476 5.128 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCSc3cc(C)c(C)cc32)ccc1OC 187338241 OPQZSLKXKOGTDX-QUCCMNQESA-N 396.556 5.320 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1nc(-c2ccccc2)cs1 191837808 MFPLKHIOWCKCGK-CYBMUJFWSA-N 398.329 5.295 30 20 GKED Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 193685268 JECWNHNWWPBDNG-NRFANRHFSA-N 386.455 5.058 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3c2CCC3)cc1 195648255 IURPCSREESULOA-UHFFFAOYSA-N 382.463 5.073 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)[C@@H]1c1cccc(F)c1 245407818 DAFJTRIOLXMZTN-MRUHUIDDSA-N 397.519 5.835 30 20 GKED CCN(CC)c1ccc(C=Nc2cccc(C[S@](=O)C(C)(C)C)c2)c(O)c1 254953294 MIGMCSVAAYQEDR-MHZLTWQESA-N 386.561 5.036 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CSc2ccccc21 303741001 ZDJXJPFUPITQAF-FQEVSTJZSA-N 386.476 5.487 30 20 GKED N=C(O)C1CCN(Cc2cccc(N=C(O)[C@@H]3CCC[C@H]4CCCC[C@H]43)c2)CC1 328978979 CRNHPQQLBVBNGX-STZQEDGTSA-N 397.563 5.628 30 20 GKED Cc1cc(N2CCC(/N=C(/O)CC3CCC(c4ccccc4)CC3)CC2)n[nH]1 329996859 POLCLPSJUGZAJW-UHFFFAOYSA-N 380.536 5.008 30 20 GKED N#Cc1ccccc1OC1CCC(/N=C(/O)[C@@H]2CCCc3c(O)cccc32)CC1 330032818 VDHOLHYHZMDBPP-WIXQSORDSA-N 390.483 5.030 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(C(F)(F)F)cc1 409674320 BEDYOCKCHOHXJA-CYBMUJFWSA-N 378.419 5.453 30 20 GKED COc1cc([C@H](C)NCCC2(C#N)CCCCC2)ccc1OCc1ccncc1 411450295 NEPSXTSENFYTOT-IBGZPJMESA-N 393.531 5.184 30 20 GKED CC(C)OCc1c(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)oc2ccccc12 416108560 QFZMGHNCRNPMPI-OAQYLSRUSA-N 388.467 5.037 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(CN)nc1C)c1ccc(C(F)(F)F)cc1 423001079 HNZQTHWBOKFTGJ-QRWLVFNGSA-N 377.454 5.226 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(Cl)cc(C(F)(F)F)c1 427245057 YNYCDKRCQBXJJR-QZTJIDSGSA-N 392.808 5.271 30 20 GKED CC(C)(c1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1)C(F)(F)F 429695139 OCNCOMQAXUJQPF-SFHVURJKSA-N 389.421 5.693 30 20 GKED Cc1sc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1[N+](=O)[O-] 437469568 RSWHNXUYCHHRGR-UHFFFAOYSA-N 397.387 5.020 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 444733005 KSOUZUDWPJPESR-INIZCTEOSA-N 390.302 5.499 30 20 GKED C[C@@H](Cc1ccccc1)N1CCC(N[C@@H](CCCC#N)c2ccccc2)CC1 449342198 ZTDJMVLDIHBTBR-OFVILXPXSA-N 375.560 5.107 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C(C)C)nc3C)n2)cc1 453632524 VYQUIEMKTAPEFU-SFHVURJKSA-N 391.496 5.136 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 455272553 LBIMGFRRSIGKOT-YLVFBTJISA-N 399.844 5.191 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)s2)o1 464463471 QZFGIRDNYFGOKR-LBPRGKRZSA-N 376.359 5.220 30 20 GKED C=C[C@@](C)(CC)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 470396495 FKUBKJSYTPTQKL-AOMKIAJQSA-N 384.545 5.127 30 20 GKED C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 470414654 LKTBRVZXUSISLX-IAGOWNOFSA-N 384.545 5.127 30 20 GKED COC1CCC(C)(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 471251536 PNIALRBIGWUTPT-UHFFFAOYSA-N 393.487 5.067 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccc2[nH]ccc2c1 472301437 SHQCMHDHXNPLBU-UHFFFAOYSA-N 381.435 5.499 30 20 GKED N#CC[C@@H](Cc1nc(-c2cccnc2Oc2ccccc2)no1)c1ccccc1 481915834 DKBPNLBFCDRBMQ-SFHVURJKSA-N 382.423 5.164 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nccc4ccccc34)o2)cc1 483246045 ZKBWLJBRQAMRPX-FQEVSTJZSA-N 380.403 5.187 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(-c2ccco2)cc1F 483463241 YDKJWKFIVQDNDK-UHFFFAOYSA-N 396.466 5.473 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(F)c(C(F)(F)F)c1 500334201 RRXWMXAXZBOUNK-UHFFFAOYSA-N 378.369 5.015 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)[C@@H]2CCCC(F)(F)C2)cc1 503170932 XNJOWJASQZPBOV-LJQANCHMSA-N 386.417 5.052 30 20 GKED N#CC1CCC(CNC(=O)c2oc3ccccc3c2COc2ccccc2)CC1 508367418 LCYKRLRLXXBNMN-UHFFFAOYSA-N 388.467 5.072 30 20 GKED Cc1ccccc1[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510666244 MGRXOEZYYRXIQX-HSZRJFAPSA-N 397.478 6.028 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccc3ccccc3c2)C2CC2)cc1 510768003 SZBMJGQHKMILTP-UHFFFAOYSA-N 383.495 5.837 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]1c1ccccc1 510874230 JORGTLLPOUDYRI-XMMPIXPASA-N 397.478 6.028 30 20 GKED Cc1cccc(Oc2cc(CN[C@@H](C)c3ccc(C#N)cc3F)ccn2)c1C 512641171 DVIACWPOKXLYTM-KRWDZBQOSA-N 375.447 5.352 30 20 GKED C[C@@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)cc1F 512661046 PSBHQKBGRDZGFC-ZHRRBRCNSA-N 378.422 5.307 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)oc2c(C)cccc12 516270333 SMQYTGLQERJONZ-AWEZNQCLSA-N 380.856 5.803 30 20 GKED CCOc1cc(C#N)ccc1OCCC(C#N)(c1ccccc1)c1ccccc1 517256422 VBRZBDWVSXVGTK-UHFFFAOYSA-N 382.463 5.236 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 518905238 LRBDPZODYZWAKX-GOSISDBHSA-N 385.467 5.186 30 20 GKED N#CCCN(C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccc(F)cc1 519799869 ILWSMWPUCFYCCS-QZTJIDSGSA-N 377.246 5.183 30 20 GKED C[C@H](SCC(=O)N(CCC#N)c1cccc(Cl)c1)c1ccc(F)cc1 521023980 DMDACNQDRRVDKK-AWEZNQCLSA-N 376.884 5.220 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCC2)c1nc(-c2c(F)cccc2F)cs1 521261761 ZEPJFYGOJNFKRR-LLVKDONJSA-N 386.448 5.129 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C(F)(F)F)cc2)c1C#N 524106079 WIXQDUALDQUMNK-HUUCEWRRSA-N 378.419 5.252 30 20 GKED COc1ccc(C[C@H](N[C@H](C)c2ccc(C#N)cc2)c2ccc(OC)cc2)cc1 525248042 YGQYAHGFRFWEIE-CJAUYULYSA-N 386.495 5.210 30 20 GKED CC(C)[C@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1C(F)(F)F 525629681 MRPXORVGZQHJJM-KRWDZBQOSA-N 396.409 5.472 30 20 GKED N#Cc1ccc(SCc2coc(-c3ccc(Br)cc3)n2)c(F)c1 525630214 DCHNEYFHNOXSRZ-UHFFFAOYSA-N 389.249 5.407 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)cccc1-c1ccccn1 533649462 NKICXXSECBSVER-IBGZPJMESA-N 396.277 5.359 30 20 GKED N#CCCSc1ccccc1NC(=O)Nc1ccc(OC(F)(F)F)cc1 536136008 MQOBQUKRHPDFPL-UHFFFAOYSA-N 381.379 5.235 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 539211562 OLZARJIJVOGEPD-UHFFFAOYSA-N 395.915 5.282 30 20 GKED CCN(C(=O)c1cc(C)n(-c2ccccc2Cl)n1)c1ccc(C#N)c(Cl)c1 539560245 LPMICOHSBITIOJ-UHFFFAOYSA-N 399.281 5.026 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1ccc(Cl)cc1 540859125 WXOMSCCUXLKFKH-CYBMUJFWSA-N 396.903 5.779 30 20 GKED N#Cc1ccc(CN(C(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)C2CC2)cc1 543224555 CAJOYSLWGAZOOJ-MSOLQXFVSA-N 385.294 5.160 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 544625260 KIUSUYMUGQJOLW-UHFFFAOYSA-N 393.531 5.706 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1ccc2ncsc2c1 547943520 NKTFOWHJQWAWDD-KBPBESRZSA-N 396.541 5.573 30 20 GKED N#CCCC[C@H](N[C@@H]1CCc2c(F)cc(Br)cc21)c1ccccc1 550827139 KTXPTZDZNTUQBF-VQTJNVASSA-N 387.296 5.600 30 20 GKED CCCCc1ccc(NC(=O)N2CCC(Oc3ccc(C#N)cc3F)CC2)cc1 554353092 ZYACOZXSJMBDQK-UHFFFAOYSA-N 395.478 5.115 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C 554806105 VZUBCVYIZALJPH-UHFFFAOYSA-N 383.904 5.365 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCSc1cccc(Cl)c1 564108004 IRAHDEUAXRQHDZ-CQSZACIVSA-N 390.961 5.855 30 20 GKED CC(C)c1ccc(O[C@@H](C)CNC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1 588167445 WZMKUBKEHYWLJS-ZDUSSCGKSA-N 391.298 5.186 30 20 GKED C[C@@]1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1(F)F 596692026 USLUTOXYBKIHBG-APWZRJJASA-N 389.833 5.162 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@H]21 599390677 OOPVXDIYDNKNCI-OXUBRWNRSA-N 382.916 5.116 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCSc2ccc(F)cc21 604495459 STMFMVFFBPBIRX-HXUWFJFHSA-N 397.519 5.102 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1sc2cccc(Cl)c2c1Cl 604538192 GOZBWJWNTPQEGM-UHFFFAOYSA-N 379.268 5.357 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)C[C@H](c3ccccc3)C(F)(F)F)c2C#N)C1 609125464 ROSUXZBKADKZNZ-BLLLJJGKSA-N 392.446 5.419 30 20 GKED Cc1ccc(SCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c(C)c1 609460492 BIYDQHKZLOKKCN-MRXNPFEDSA-N 379.312 5.083 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC2CCCCC2)cc1 609786575 UMHDJKFJTCQBDL-QGZVFWFLSA-N 394.540 6.045 30 20 GKED COc1ccc2nc(C)cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c2c1 610174940 OFVMLQMHCSRTNO-AWEZNQCLSA-N 391.496 5.056 30 20 GKED CC[C@](C)(NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1nc(C)cs1 610201053 RMCWNWYSIPLREM-QFIPXVFZSA-N 390.512 5.122 30 20 GKED COc1ccc([C@@H](NC(=O)N[C@H](C)c2cccc(C#N)c2)c2ccc(C)cc2)cc1 610355547 USGLMKVHTQTRRH-KOSHJBKYSA-N 399.494 5.025 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)c(Cl)c1 611093232 MWGXFJMCLFNPFC-UHFFFAOYSA-N 391.588 5.372 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc2ccccc2c1OC(F)F 618804457 ADDMXCUYKYYGRS-SPLOXXLWSA-N 378.422 5.651 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618844924 AKJMUYGZPFCVPU-BUXKBTBVSA-N 388.298 5.255 30 20 GKED CCN(C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccncc1 668868482 OJUXQFMABDLUAC-UHFFFAOYSA-N 394.290 5.038 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccco2)s1)c1nc2cc(Cl)ccc2s1 675908255 ICYNFTWSAHCGCT-NSHDSACASA-N 384.869 5.761 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccccc2Oc2cccnc2)s1 684676664 YUBASGPOUIAXGH-MRXNPFEDSA-N 377.469 5.118 30 20 GKED CC(=NNc1nc2ccccc2n1C)c1sc(-c2ccc(C)cc2)nc1C 727650858 AWJQMNAVBLWKBO-UHFFFAOYSA-N 375.501 5.150 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=S)Nc1ccccc1F 727979002 SMKNGYSWHPYIRH-UHFFFAOYSA-N 391.471 5.394 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(F)(F)c1ccccc1 727997231 VXEAXFOKJKILTM-UHFFFAOYSA-N 392.405 5.176 30 20 GKED C/C(=C/C(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 729369549 HNVIZPGPPCODKT-PVFXMYQXSA-N 382.463 5.050 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)/C=C\c1ccccc1C#N 729419443 LATMSNIATIXROK-FWLQQBITSA-N 391.471 5.020 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc1C(C)C 730417184 LPUFFEZJUOGFQZ-KBXCAEBGSA-N 396.487 5.511 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)cc1Cl)c1nc2cc(F)ccc2s1 730418424 VFXMUGNSKAZKOR-ZDUSSCGKSA-N 393.270 5.551 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(CC2CC2)C2CCCCC2)cc1 732419212 ZGRWHTIEIIIICN-XMMPIXPASA-N 387.527 5.919 30 20 GKED CC(C)(CCCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 733053509 IPUMAERZMDCLOK-KRWDZBQOSA-N 380.488 5.661 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1)c1ccncc1 734660756 AGQCNEDJLLBKRU-AUSIDOKSSA-N 385.511 5.219 30 20 GKED Cc1c(C(=O)/C=C/c2cnc3ccc(Cl)cn23)cnn1-c1cccc(Cl)c1 737443979 MVZDORPUOCHAAD-VOTSOKGWSA-N 397.265 5.031 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(-c4ccncc4)cc3)cs2)cc1 745989884 FEODDRKODXBQAF-FLIBITNWSA-N 398.487 5.777 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1 749911254 MRRDGJKFKJBKQZ-SFHVURJKSA-N 391.814 5.156 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)ON=C(c2ccccc2)C(F)(F)F)c(Cl)c1 751955031 OAALZFPKJLIRSF-CYBMUJFWSA-N 398.812 5.267 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)C2)c1 752485945 UPDSELPAOMHSSH-NOZRDPDXSA-N 395.506 5.672 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCC#N)c1nc(-c2ccccc2)cs1 754776751 IXLXMFOKTJOSAR-AWEZNQCLSA-N 383.904 5.217 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 760182482 WVZLIPSGNMPAEC-FQEVSTJZSA-N 384.479 5.409 30 20 GKED COc1ccc(C(=O)/C=C/c2cnc(C3CCC3)s2)cc1Br 760263629 ORWBPMMTZUAHGN-VOTSOKGWSA-N 378.291 5.078 30 20 GKED Cc1ccccc1C(NC(=O)Nc1cccc(OCC#N)c1)c1ccccc1C 760926386 TZKFDIWVMHUPPK-UHFFFAOYSA-N 385.467 5.117 30 20 GKED C[C@@H](OC1CCCCCC1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 761045581 CUODZJLHNRHLRI-IUODEOHRSA-N 376.909 5.254 30 20 GKED FC(F)(F)c1ccc2sc(NN=Cc3ncccc3C(F)(F)F)nc2c1 765582258 WAGGULZNXFFHST-UHFFFAOYSA-N 390.312 5.175 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(Br)c(F)c1 767735139 KHMCAJZWDZXXDO-BAQGIRSFSA-N 399.219 5.067 30 20 GKED O=C(CCCC(F)(F)F)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 770738290 GJRJSQCACYNSMZ-NSHDSACASA-N 382.222 5.585 30 20 GKED CC(=O)CCCCCCC(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 772678661 RESVWVFKWYRWJY-UHFFFAOYSA-N 394.490 5.469 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccccc1 773076374 NCBBXRKANPYSJU-WMZHIEFXSA-N 375.516 5.298 30 20 GKED C#CC[C@@H](N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1)c1ccccc1 773115213 NBCZFLDETZGDLO-CJFMBICVSA-N 395.506 5.329 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 773761859 WEANXOYJALDOLF-RXVVDRJESA-N 379.463 5.330 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775487497 IVOXQKNTMKGJCI-JWQCQUIFSA-N 395.506 5.883 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)nn1[C@H](C)C1CC1 776813808 NMLILTJSJQZRDS-VGOFRKELSA-N 384.483 5.070 30 20 GKED N#CCCN(C(=O)c1cc2ccccc2c(Cl)n1)C12CC3CC(CC(C3)C1)C2 776909150 UQYFMGPFQKWPRM-UHFFFAOYSA-N 393.918 5.213 30 20 GKED C=CCN(C(=O)N[C@H](CC(F)(F)F)c1ccc(Br)cc1)C(C)C 779698879 QLAKJRQBBMMXQU-CQSZACIVSA-N 393.247 5.049 30 20 GKED COc1ccc(NC(=S)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782204009 HOMFHXUWCIYCDG-INIZCTEOSA-N 387.508 5.281 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)sc21 797570926 LZBCMALIKJJGFX-CQSZACIVSA-N 393.537 5.637 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cccc(SC(F)F)c1 806253814 WBRLWZNOMSQYNJ-UHFFFAOYSA-N 394.491 5.389 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1cccc(COC(C)(C)CC)c1C 806331518 BBPNXKCULCSNPY-UHFFFAOYSA-N 378.516 5.368 30 20 GKED N#Cc1cccc(C(=O)Oc2ccc(-c3nc4cc(Cl)ccc4s3)cc2)n1 810535430 IBEVBBZDYVRBPP-UHFFFAOYSA-N 391.839 5.103 30 20 GKED C[C@H](NCc1cc(C#N)cc(CN[C@H](C)c2ccsc2)c1)c1ccsc1 878560766 GAOBWJLGHLJTCK-IYBDPMFKSA-N 381.570 5.383 30 20 GKED O=C(c1cc2ccccc2cc1F)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 883978731 UBJKECVLIBTXTL-STQMWFEESA-N 393.302 5.182 30 20 GKED N#Cc1ccc(CSCC(=O)Oc2ccc(Cl)c(C(F)(F)F)c2)cc1 915825550 BENAPDNRNPKLKM-UHFFFAOYSA-N 385.794 5.069 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(-c2ccccc2Cl)o1 916882969 MTNAOXHUUNJCRB-HNNXBMFYSA-N 399.233 5.215 30 20 GKED Cc1cc(C)n([C@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 916975252 AZXAWMASYJTVBI-RHSMWYFYSA-N 398.919 5.104 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917045991 FDVAAWYWRUFXMH-GUYCJALGSA-N 398.915 5.717 30 20 GKED CC(=NNc1ccccc1C(=O)O)c1ccc(Oc2ccc(F)cc2)cc1Cl 1776030457 BVXJJECPCXYTSC-UHFFFAOYSA-N 398.821 5.806 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3nccc4sccc34)s2)c1 1776036232 PRSQXSCCQLICTI-UHFFFAOYSA-N 379.466 5.169 30 20 GKED Cc1c(NN=Cc2ccccc2OCc2ccc(Cl)cc2)cccc1C(=O)O 1776089998 PSPTYIJWLNBIJY-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776697944 YNIZWLFFSPCPCM-SAAWKEMMSA-N 390.435 5.760 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(OC)cc(C(F)(F)F)c1 1776783079 VROXCSAGQXLCGE-MRXNPFEDSA-N 375.431 5.007 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1C(=O)O 1777360995 GADXYZUAGCKXRU-YFHOEESVSA-N 392.382 5.221 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)C45CCC(CC4)CC5)CCC3)cc2)C1 1785809160 WEWQNPABKSAAQK-UHFFFAOYSA-N 392.543 5.057 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(Cc1ccccn1)C1CC1 56800277 MZRCYZWQJBHKGK-UHFFFAOYSA-N 398.466 5.251 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1ccccc1O 56800424 SKLAVHZYNWBHJT-UHFFFAOYSA-N 387.439 5.029 30 20 GKED N#Cc1ccccc1OCCSCc1ccc(C(=O)Nc2ccccc2)cc1 60521721 VJDPPJYKVBIFSJ-UHFFFAOYSA-N 388.492 5.123 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1 65473081 MABMAIJVHKRPJG-LJQANCHMSA-N 383.879 5.368 30 20 GKED COc1ccccc1CN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 66953952 DWOBCKUGIWHUES-MRXNPFEDSA-N 395.528 5.286 30 20 GKED CCN(C(=O)COC(c1ccccc1)c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 105906845 LFULHBAVXFHHSJ-FQEVSTJZSA-N 398.506 5.274 30 20 GKED CN(Cc1ccccc1NCc1ccc(C#N)cc1)C(=O)c1cc2ccccc2o1 120329257 MDAGMZDXEPLRAT-UHFFFAOYSA-N 395.462 5.189 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](Cc2ccc(F)cc2)C1 150975356 LBGXZLHYGKNNDQ-SJLPKXTDSA-N 397.519 5.316 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(CC(C)C)cc2)=C(/S)N[C@@H](C)CC)cc1 154475118 AESMKEWTABYYKC-SFHVURJKSA-O 397.608 5.062 30 20 GKED C[C@@H](Nc1ccc(C#N)cn1)c1nc(-c2ccc(Br)cc2)cs1 155352207 IPLZBJSAWIZZGP-LLVKDONJSA-N 385.290 5.012 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nccs1 158612251 KESGWJPMWZAGIL-OAQYLSRUSA-N 392.484 5.254 30 20 GKED Cc1ccc(-c2ocnc2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 172997455 KQIQUHYIJYXXNG-OAHLLOKOSA-N 377.469 5.154 30 20 GKED C=CCn1c(S[C@H](C)c2cccc(OC)c2)nnc1-c1ccccc1OC 175237029 YRSLALLISCRBCS-OAHLLOKOSA-N 381.501 5.002 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccccc1-c1nc2ccccc2s1 176811234 MVRAKRHQBQUDQJ-UHFFFAOYSA-N 376.485 5.121 30 20 GKED Cc1ccc(C(=O)Nc2ccn(CCC#N)n2)c(Sc2ccc(Cl)cc2)c1 184920613 JIUFEHNILBMYFU-UHFFFAOYSA-N 396.903 5.162 30 20 GKED CC(C)(C)[S@](=O)Cc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 255560904 QYTHKJZMXUQNPI-XMMPIXPASA-N 384.328 5.497 30 20 GKED N#C[C@@H](NC(=O)CCCOc1ccccc1Cl)c1cccc(Cl)c1Cl 303371909 KHHGBYJYRMLUKW-OAHLLOKOSA-N 397.689 5.187 30 20 GKED C=CCN(C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 303622329 DERVOXYRUALYKV-HOTGVXAUSA-N 396.462 5.411 30 20 GKED O/C(=N/CCc1nnc(-c2ccccc2)o1)C1(C2CCCCC2)CCCCC1 329046266 UYTBLQGFQYZWAN-UHFFFAOYSA-N 381.520 5.766 30 20 GKED C[C@@]1(c2ccccc2)CCCN(C(O)=Nc2nc(C3CCOCC3)cs2)CC1 329430726 KFEKBZKBQPWWIX-JOCHJYFZSA-N 399.560 5.026 30 20 GKED Cc1c(/C(O)=N/[C@@H]2CCOC3(CCCCC3)C2)cnn1-c1ccc(Cl)cc1 330199350 VHXUKJASEWGAKO-QGZVFWFLSA-N 387.911 5.021 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)C3CCC(OC(F)F)CC3)c2C#N)[C@H](C)C1 410991498 VHGULLMIYXIQJL-OKZRHMCRSA-N 382.476 5.042 30 20 GKED CCOc1ccc(-n2c(S[C@@H]3CC[C@H](C#N)C3)nnc2-c2ccccc2)cc1 430138978 ZXAURQMNMVAFHA-OXJNMPFZSA-N 390.512 5.117 30 20 GKED Cc1c(C(=O)N2CCCCC[C@@H]2c2ccncc2)sc2ccc(C#N)cc12 432007170 OJHVMDVMACUGED-LJQANCHMSA-N 375.497 5.234 30 20 GKED COc1ccc([C@H](NCc2cc(C#N)ccc2OC)c2ccccc2Cl)cc1 434889126 QLCHDIXHRKPONE-QHCPKHFHSA-N 392.886 5.108 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 436163110 QAEYSRSWWUEIGY-GOSISDBHSA-N 389.499 5.223 30 20 GKED C=C(C)COc1cccc(NC(=O)NC[C@H]2CCCO[C@H]2c2ccc(C)cc2)c1 438126956 ZMLQMZJQSMBFCU-OFNKIYASSA-N 394.515 5.239 30 20 GKED C=CCOc1ccc(CN[C@@H](CC(F)(F)F)c2ccccc2C)cc1OC 444015943 XHHUQFRLOUKWQH-SFHVURJKSA-N 379.422 5.352 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cccc(F)c1F 445920425 VGACYYPAUCYAPM-UHFFFAOYSA-N 378.378 5.118 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)c1 463558531 QRYUGINPIPYTCI-UHFFFAOYSA-N 384.451 5.018 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1cccc(C(=O)Nc2ccccc2)c1 464824851 WJLPHBLXGGSQEU-RPBOFIJWSA-N 395.506 5.211 30 20 GKED CCS[C@H]1CC[C@@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 464881528 UDOURALUBWXWPM-NQIIRXRSSA-N 380.513 5.097 30 20 GKED C=C[C@@H](C)NC(=O)c1ccccc1SCc1ccc(Br)cc1 465143816 FJBMOWKPWBPIMB-CYBMUJFWSA-N 376.319 5.046 30 20 GKED CCC[C@@H](NC(=O)NCc1cc(C#N)ccc1F)c1cccc(C(F)(F)F)c1 465835684 KDXYEGFFAALZLE-GOSISDBHSA-N 393.384 5.057 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(N2CCCCC2)cc1 471904418 CVZNSLNAWONRGS-QGZVFWFLSA-N 379.529 5.181 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2cccc(Br)c2)C2CC2)cc1 474693675 TVZXRYIFRYQTBY-UHFFFAOYSA-N 397.316 5.055 30 20 GKED COc1ccc(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)cc1C#N 475508771 AFRFIYLOWURTMB-UHFFFAOYSA-N 389.402 5.321 30 20 GKED CO[C@@H](C)c1nc(CSc2nc3c(c(-c4ccco4)c2C#N)CCC3)cs1 476479218 DRUBZJJRKMIEGP-LBPRGKRZSA-N 397.525 5.158 30 20 GKED C[C@H](c1nnc(SCCCC(C)(C)C#N)n1-c1ccccc1)N1CCCCC1 476482237 IVJPBMUMFRPWNW-GOSISDBHSA-N 397.592 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC(=C)C)Cc1cnn(C(C)C)c1 482172344 YDUVFWFMZWHZSI-UHFFFAOYSA-N 394.563 5.926 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1 483620617 IMIQEJLTTXSVGQ-OXQOHEQNSA-N 397.519 5.837 30 20 GKED CCCCOc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 487602435 KSSVHNLOJKBZDU-NRFANRHFSA-N 384.907 5.684 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(CN(C[C@H]2CCCCO2)C(C)C)cc1 488562984 SWYRZEDYHOGBML-XZOQPEGZSA-N 399.579 5.039 30 20 GKED C[C@@H](CCCC(F)(F)F)NCc1cccc(OCc2cccc(C#N)c2)c1 494846317 QCZOJZQBXOMMHN-INIZCTEOSA-N 376.422 5.348 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(F)cc2OCCC(F)(F)F)cc1 500216731 GJEKLNDFVLYUFP-UHFFFAOYSA-N 394.368 5.210 30 20 GKED Cc1ccc(-c2ccc(CN(C(=O)c3ccc(C#N)c(C)n3)C(C)C)s2)cc1 501572576 VFSYYVQKZHVXNY-UHFFFAOYSA-N 389.524 5.349 30 20 GKED N#CC1(CCCSCCCOc2cccc(C(F)(F)F)c2)CCOCC1 507695295 RVPKVQUWBSMZAI-UHFFFAOYSA-N 387.467 5.308 30 20 GKED Cc1cc(Cl)c(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1Cl 507981130 LPGVEYIZQYCCJY-UHFFFAOYSA-N 398.249 5.613 30 20 GKED O=C(CC(F)(F)F)Nc1ccc(NCc2cc(F)cc(C(F)(F)F)c2)cc1 509956475 IDRUZGCWKUYGEA-UHFFFAOYSA-N 394.290 5.348 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(CSc2ccccc2)cc1 510259955 SMRFGNNXOUACOL-UHFFFAOYSA-N 388.492 5.502 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@H]2c2ccccc2)c1 513113518 OTJGQNHEZIRDOU-QHCPKHFHSA-N 382.463 5.115 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 516120736 RPCLIYCHBFQNPT-UHFFFAOYSA-N 398.875 5.124 30 20 GKED COc1cc(C2(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)CC2)ccc1C 517513682 YCRNTSFCWOXHFI-UHFFFAOYSA-N 398.462 5.338 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCSc1ccccc1Cl 517522812 ZKMHGHLCZZEITM-CQSZACIVSA-N 390.961 5.855 30 20 GKED CC(C)C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 518265633 ZJEBBFBWOPUTHN-QGZVFWFLSA-N 378.476 5.036 30 20 GKED C=CCOc1ccccc1CNCc1nc(-c2ccc(Cl)cc2)c(C)s1 520214326 VIIIAPJDBUYOFV-UHFFFAOYSA-N 384.932 5.627 30 20 GKED CC[C@H]1CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524154282 WLSFKQQANJVLBC-SFHVURJKSA-N 383.879 5.197 30 20 GKED C=CCn1c(SCc2ncc(CC)o2)nnc1-c1ccc(C(C)(C)C)cc1 525190629 NUGSJMLBPYRHFZ-UHFFFAOYSA-N 382.533 5.271 30 20 GKED Cc1ccnc(C(C)(C)c2noc(-c3cn(CCCC#N)c4ccccc34)n2)c1 528263574 NWMGOEBFULXLBQ-UHFFFAOYSA-N 385.471 5.024 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2csc(C3CC3)n2)cc1 533926541 PUGYARGTWQSYIN-UHFFFAOYSA-N 377.488 5.234 30 20 GKED C[C@@H](NC(=O)Nc1cccc(CN(C)C)c1)c1ccc(-c2cccc(C#N)c2)cc1 543861454 RFJCIJIJBAMVPN-GOSISDBHSA-N 398.510 5.170 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(C(F)F)c3Cl)c2)cc1 544475325 GHMBIFUMICXWBI-UHFFFAOYSA-N 398.796 6.194 30 20 GKED Cc1ccc2c(CCNC(=O)Nc3ccccc3SC[C@H](C)C#N)c[nH]c2c1 553071065 HIEIRWFGUUNMIC-MRXNPFEDSA-N 392.528 5.092 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC=C(c4ccco4)C3)cc2)cc1 554166195 UHLJJQVUORPNSS-UHFFFAOYSA-N 385.423 5.265 30 20 GKED COc1ncc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1Cl 560234628 JWUMFLIPCWZSQW-HOTGVXAUSA-N 391.902 5.694 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 567004637 QMHRBNGZYGLDKB-UHFFFAOYSA-N 392.846 5.063 30 20 GKED COc1ccc([C@@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)cc1 578638038 NKSVNYDEPHORLT-BJKOFHAPSA-N 388.898 5.587 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccccc2OC(F)(F)F)c1 589741275 XYCXKFCTSXEACA-UHFFFAOYSA-N 394.393 5.204 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@H]1CCC[C@@H](C(F)(F)F)C1 591781586 URPGQFPSFXHLLH-GXSJLCMTSA-N 389.286 5.648 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)c1ccc(C(F)(F)F)cc1 595570426 ZOSKURPUHUMUNQ-CRAIPNDOSA-N 379.426 5.048 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@H](CC#N)C1 596723667 LTNWGPMPYDAOPN-RBUKOAKNSA-N 377.488 5.293 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cscc3C(F)(F)F)c2C#N)CC[C@H]1C 598839442 RITORFLKFQQSCQ-BDAKNGLRSA-N 384.448 5.638 30 20 GKED COc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C(C)(C)C#N)cc2)c1 602757131 FHUOJMDENRSLAV-QHCPKHFHSA-N 397.478 5.267 30 20 GKED CCCN(CCC)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079666 GLKSTYGSCPEGNM-UHFFFAOYSA-N 385.895 5.445 30 20 GKED N#CCn1c(C(=O)Nc2cc(F)ccc2Oc2ccccc2)cc2ccccc21 609172896 JLUYDTASSSAOOD-UHFFFAOYSA-N 385.398 5.349 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc3c(ccc4ccccc43)[nH]2)cc1 609413986 KPNGATHITNJTDO-UHFFFAOYSA-N 383.451 5.280 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)(F)F 609682395 ISGZRSHHGFTHJJ-SUMWQHHRSA-N 393.434 5.363 30 20 GKED N#Cc1cccc(CNC(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)c1 610023680 PMXNUCQGZZGSLH-LJQANCHMSA-N 387.405 5.014 30 20 GKED C[C@H](NC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1cccc(C#N)c1 610318295 IJJFPTVGJYUWCF-INIZCTEOSA-N 399.454 5.085 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 613356592 QQZFKBRWQCRWSW-CYBMUJFWSA-N 397.849 5.007 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)n1 673812096 PSOOSFMBGQGRBF-GFCCVEGCSA-N 393.415 5.084 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(C2CCC(C(F)(F)F)CC2)n1 685383451 ZGQDTQLCJYFZEV-KGPNIALWSA-N 396.306 5.983 30 20 GKED CC(=NNc1nc(C(F)(F)F)nc2ccccc12)c1cccc(OC(F)F)c1 725832648 MADCVYHSBRBDDT-UHFFFAOYSA-N 396.319 5.086 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccccc2CSc2nc3ccccc3o2)c1 728482916 QJKXJESUKHMERL-UHFFFAOYSA-N 398.487 5.378 30 20 GKED CCOc1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1Cl 732733698 PJZCOEUTFCSLBF-LJQANCHMSA-N 391.858 5.041 30 20 GKED C#CCCOc1ccc(CNCc2ccccc2CN(C)C2CCCCC2)cc1 733325274 HOTZAJFWJFXTRU-UHFFFAOYSA-N 390.571 5.143 30 20 GKED C[C@@H](CC#N)OC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 733709125 BKXPSBQTAMGREC-INIZCTEOSA-N 380.875 5.121 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2c2ccccc2Cl)c1 733804315 BPHCBBJNDZGYRP-LAUBAEHRSA-N 397.906 5.068 30 20 GKED FC(F)(F)c1cnc(NN=C(CC2CCCCC2)c2ncccn2)c(Cl)c1 733902032 KPWPBQCNXVENJI-UHFFFAOYSA-N 397.832 5.330 30 20 GKED C=CC[C@@H](NC(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680197 NVQBTQDIVCUSPF-DNVCBOLYSA-N 391.437 5.510 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744034541 AZGZNMKMEQJPFE-BLLLJJGKSA-N 386.879 5.534 30 20 GKED COc1ccc(/C=C\C(=O)c2ccccc2C(F)(F)F)cc1OCCCC#N 747361249 JDJVFMBFTAWAJA-NTMALXAHSA-N 389.373 5.293 30 20 GKED C[C@@H](ON=Cc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1C(F)(F)F 749256658 VOLLYZDQEDDXMO-CQSZACIVSA-N 392.421 5.381 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc3ccc(C)cc3o2)ccc1OC 756040280 JBSMYIIEQXCPIE-QFBILLFUSA-N 378.472 5.282 30 20 GKED CC(C)n1ncc2cc(/C=C3/C(=O)c4cccc5c4[C@H]3CCC5)c(Cl)nc21 763287635 CLQAVBDYKGLTKV-HKJBKDEOSA-N 377.875 5.365 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NCc1ccc(N(C)CCC#N)cc1 767737754 IQHUJAJIVJCIDE-HXUWFJFHSA-N 375.438 5.128 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCc3ccc(OC(F)(F)F)cc32)c1 772984160 MTILYYQIQINGJQ-JXFKEZNVSA-N 390.405 5.043 30 20 GKED N#CC1(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)CC1 775832128 WYUPJDNPIXVRCV-NTCAYCPXSA-N 386.476 5.244 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3ccccc3s2)cc1OCCCC#N 780189173 VBJXSMCEEIKRIS-CSKARUKUSA-N 377.465 5.489 30 20 GKED N#C[C@@H](C(=O)C12CC(c3ccccc3)(C1)C2)c1nc2cc(Cl)ccc2s1 791780093 VAABMUFRWAADFU-VUZGARFFSA-N 378.884 5.248 30 20 GKED Cc1c(C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)sc2ccc(C#N)cc12 794273973 CFBXFXJISQRLHU-UHFFFAOYSA-N 397.450 5.212 30 20 GKED FC(F)C1CCC(=NNc2ccc(-c3cccc(C(F)(F)F)c3)nn2)CC1 794979662 NFHBANCZXKSVMM-UHFFFAOYSA-N 384.352 5.386 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571264 PBABWQKSCMOHMO-ZYHUDNBSSA-N 397.327 5.391 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCc2ccc(-c3ccccc3)o2)s1 797572452 ZVKZSIPFPYIBFN-KRWDZBQOSA-N 378.497 5.510 30 20 GKED N#C[C@@H](C(=O)C[C@H]1CCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 797942751 IFFOMMGRAWANPY-RISCZKNCSA-N 380.847 5.465 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCO[C@@H](c2cccc(C#N)c2)C1 801827869 WRSHCUKAPHIZAH-HXUWFJFHSA-N 397.906 5.115 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(Br)c1 813057707 PYSAYBZVNJHEMA-RISCZKNCSA-N 385.286 5.039 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1c(Cl)cccc1Cl 813216049 FKFBMQGXYQMJEX-KOLCDFICSA-N 387.188 5.387 30 20 GKED CC(C)(C(=O)OC[C@H]1CC[C@@H](C#N)CC1)c1csc(-c2ccccc2F)n1 816087091 KNZQMIPPXRCCFF-GASCZTMLSA-N 386.492 5.100 30 20 GKED CC(C)(C)C(=O)CCCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835073040 IXVPMIRNASZQIR-GFCCVEGCSA-N 396.434 5.277 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)Nc1cccc(C2SCCS2)c1 841596607 PAQIOYNQTFHJFX-IBGZPJMESA-N 395.553 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCN(C(=O)OC(C)(C)C)C1CC1 846989922 GWHNYMIYCXZGOA-UHFFFAOYSA-N 386.536 5.267 30 20 GKED Cc1cc(Br)ccc1CNc1ccccc1SC[C@@H](C)C#N 864005553 BEFIRPKZECHWTC-ZDUSSCGKSA-N 375.335 5.621 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(-c3ccsc3C(F)(F)F)no2)cc1 904924294 PIXLXNWOIWGIHA-AWEZNQCLSA-N 390.390 5.030 30 20 GKED N#CC1(c2ccccc2)CCC(=NNC(=S)Nc2cccc(Cl)c2)CC1 916285052 OBACFTHWGRAKFA-UHFFFAOYSA-N 382.920 5.018 30 20 GKED CCCCCCNC(=O)[C@H](C#N)C(=O)c1sc2cc(Cl)ccc2c1Cl 916876310 YDPXBNFRGURQQA-CYBMUJFWSA-N 397.327 5.227 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)Oc3ccccc3Cl)n2)cc1 916974826 RTPALUUNYZLPRD-GDBMZVCRSA-N 396.899 5.416 30 20 GKED O=C(Cc1ccccc1)Nc1cc(N=Cc2cc(Cl)ccc2O)ccc1F 917556900 RATFVMLUVCVVIJ-UHFFFAOYSA-N 382.822 5.117 30 20 GKED Cc1cc(C)cc(Oc2ccc(NC(=O)c3ccccc3SCC#N)cc2)c1 918678052 XDIOQEBWXFEOBM-UHFFFAOYSA-N 388.492 5.964 30 20 GKED CCc1cccc(C)c1NN=Cc1cccc(OCc2ccccc2C(=O)O)c1 1776056914 XREGPNWMWUKKJU-UHFFFAOYSA-N 388.467 5.281 30 20 GKED O=C(/C=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccc(F)c(F)c1 1776125338 FIKDHBYTMWVXKX-RUCTVCJSSA-N 394.373 5.066 30 20 GKED C=CCc1cc(C)c(OCCCN2CCC([C@@H]3CCC[C@H]3C(=O)O)CC2)cc1C 1776188879 LGJZFLRYCLITMC-XZOQPEGZSA-N 399.575 5.014 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776950910 NHYZBGLCMVGQOR-FZSIALSZSA-N 388.488 6.060 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(F)c(C(F)(F)F)c1Cl 1777436173 OXLIRVLIRXHLDG-ALCCZGGFSA-N 386.728 5.401 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@H]3CC[C@H](C(C)C)CC3)CCC2)cc1 1791589690 PFEKWWNUNYVAIS-WGSAOQKQSA-N 382.548 5.159 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1ccccc1 7735068 AARJAFQMRVVAMW-UHFFFAOYSA-N 380.498 5.140 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2Cc2ccccc2)cc(OC)c1OC 18185250 BMRYMHHVBLYOSO-UHFFFAOYSA-N 387.479 5.275 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccoc1C 21925491 LQKJPXOUHCFLDN-MRXNPFEDSA-N 381.501 5.013 30 20 GKED C=C(C)CN/C(S)=C(/C(=O)c1ccccc1C)[n+]1ccc(C(CC)CC)cc1 55012733 MLFMIBBKXXHVMN-UHFFFAOYSA-O 395.592 5.291 30 20 GKED COc1ccccc1C(C)(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 58705837 ICZYGGUYPHPHMG-UHFFFAOYSA-N 386.451 5.275 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(Cl)c(Cl)c1 59251712 QQTFYURMMVDKTJ-UHFFFAOYSA-N 398.249 5.613 30 20 GKED COc1ccccc1[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 103330553 PWQWDQJQTLPSIN-QAPCUYQASA-N 376.481 5.189 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(Cl)ncc1Cl 128036416 RWSZKWYKUKXJBU-UHFFFAOYSA-N 399.237 5.008 30 20 GKED COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 133588675 OHPNXPSOZDHWEW-OAHLLOKOSA-N 384.888 5.112 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc(Cc2ccccc2)s1 151004869 MNXXPAQAVIGGJR-HNNXBMFYSA-N 393.537 5.380 30 20 GKED CC(C)(C#N)CCC[S@](=O)Cc1cn(-c2ccccc2)nc1-c1ccccc1 153532622 KYNZTNJQXFMFFK-MUUNZHRXSA-N 391.540 5.118 30 20 GKED N#C[C@H](C(=O)c1ccnc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 162096226 WXPIGSVOGGAFJX-CQSZACIVSA-N 391.402 5.127 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)C(=O)c1cccc(F)c1 177603723 WKNLSMYOEIKKNI-RDTXWAMCSA-N 392.455 5.035 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2cccs2)C2CCCC2)ccc1OC 180809826 HIPHONGLDQPJRA-AVRDEDQJSA-N 384.545 5.459 30 20 GKED C[C@@H](Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(OCC#N)cc1 183053367 RHWYWPMEEGGVPW-QGZVFWFLSA-N 389.524 5.386 30 20 GKED C[C@H](Cc1cccs1)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 192917412 UFOGBFCVXIQOCZ-MRXNPFEDSA-N 392.549 5.273 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1cccc(OCCCC#N)c1 237794102 KZNFMFAMUZDRAE-QHCPKHFHSA-N 390.552 5.813 30 20 GKED Cc1ccc(C)c(SCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1 303303437 DCWRMTINCDMMND-HNNXBMFYSA-N 379.312 5.083 30 20 GKED Cc1ccc(C)c(N=C(O)[C@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c1 328682074 CVOMWQADQXVECB-JTSKRJEESA-N 391.515 5.377 30 20 GKED C[C@]1(C(O)=Nc2nc(-c3sccc3Br)cs2)CCCOC1 329358650 XDOVBKZZPQNYSJ-AWEZNQCLSA-N 387.324 5.039 30 20 GKED CC(C)Oc1c(Cl)cccc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330015261 NRTAENRVNNCOQI-UHFFFAOYSA-N 378.900 5.641 30 20 GKED CSc1ccsc1C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N 425636426 JWAGLQDCGCAOPC-LLVKDONJSA-N 384.448 5.043 30 20 GKED Cc1c(Cl)cc(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)cc1Cl 428901342 KILRGXUJDGEORR-UHFFFAOYSA-N 399.281 5.331 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1ccc(C)cc1 429196558 GOIZMCJYRKUXFY-NRFANRHFSA-N 394.478 5.172 30 20 GKED CC(C)(c1ccc(C(=O)Nc2cccc(OCCCC#N)c2)cc1)C(F)(F)F 433838352 XYINILVDVXUBNO-UHFFFAOYSA-N 390.405 5.461 30 20 GKED C[C@@H](NC(=O)C1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1ccc(C#N)cc1 436100994 OQCXYEWGEUOWLF-GFCCVEGCSA-N 392.808 5.139 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F 446362569 JHSRPIINWBURPV-KCJUWKMLSA-N 394.718 5.113 30 20 GKED CC[C@@H](Nc1cccc(COCc2ccc(OC)cc2)c1)c1ccc(C#N)cc1 447598801 WCWLXQYXGTVSCA-RUZDIDTESA-N 386.495 5.847 30 20 GKED C[C@]1(F)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 454486911 OUAHQHYHTOMGJB-RXVVDRJESA-N 385.870 5.351 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(Cl)c(OC(F)F)c1)c1ccccc1 455111062 QMSFXKVQMLMTFO-INIZCTEOSA-N 393.821 5.498 30 20 GKED COc1cccc(F)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 462114374 WMLBALDXNYHJEG-KRWDZBQOSA-N 394.833 5.395 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nc(-c3ccsc3)no2)cc1F 463230229 NWVNUPZKHCZIOR-UHFFFAOYSA-N 392.415 5.213 30 20 GKED C[C@H](C(=O)Nc1cccc(Cl)c1SCC(F)F)c1cccc(C#N)c1 463940582 FQMRHCGDXZFUAV-NSHDSACASA-N 380.847 5.311 30 20 GKED CC[C@H](C#N)NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 464119811 CQMRSZOTYGOZEU-CYBMUJFWSA-N 382.382 5.028 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)Nc1ccc(C#N)nc1 466820302 ZKMKHIXNIHAFPP-NSHDSACASA-N 399.317 5.321 30 20 GKED CC[C@@H]1CN(C(=O)CCCCOc2cccc(C#N)c2)CC[C@@H]1c1ccccc1 470014232 WYHWYXJHKRKFED-QPPBQGQZSA-N 390.527 5.150 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(Cc2ccccc2)CCC1 473820613 VWLCJJZLASCBHG-QGZVFWFLSA-N 379.529 5.225 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cc2cccc(F)c2o1 474717967 VVUNCKVDKVOTBP-KGLIPLIRSA-N 397.475 5.849 30 20 GKED C[C@H]1CCCCN1Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1 474898359 GYHQJFPTBQWPJU-UGKGYDQZSA-N 375.516 5.087 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H]1c1cccc(F)c1 475574277 VODNYBTXYIWVGZ-HTAPYJJXSA-N 380.507 6.293 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(-c2ccccc2F)s1 476107727 IEIWATKJJXUQCY-UHFFFAOYSA-N 380.488 6.053 30 20 GKED N#CC[C@H](CC(=O)NCCCc1ccc(Cl)cc1Cl)c1ccccc1 476224249 KKLNAIFGVZMGOU-QGZVFWFLSA-N 375.299 5.130 30 20 GKED C=CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 477584318 CAURCFJJGYFQHA-JOCHJYFZSA-N 389.499 5.170 30 20 GKED CC(C)(C#N)c1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 483488422 CPHQVWAKFCZZOW-OAHLLOKOSA-N 379.872 5.241 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2scnc2C2CC2)cc1 494937207 DLBGGHMLMIUYPZ-UHFFFAOYSA-N 377.488 5.234 30 20 GKED Cc1cccc(-c2nc(CC(=O)N(CC(C)C)c3ccc(C#N)cc3)cs2)c1 499308982 RHCZBSIUWLMJNJ-UHFFFAOYSA-N 389.524 5.222 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 504162261 JVIPTRUROAXRKW-UHFFFAOYSA-N 393.462 5.196 30 20 GKED N#C[C@H](NC(=O)c1sccc1C1CC1)c1ccc(OCc2ccccc2)cc1 505355943 OULSVHVQFSQANG-NRFANRHFSA-N 388.492 5.199 30 20 GKED N#CCCN(Cc1ccco1)Cc1cn(-c2ccccc2)nc1-c1cccs1 505775849 FIDQAZDLAVPELT-UHFFFAOYSA-N 388.496 5.110 30 20 GKED C[C@@H](c1ccccc1)n1c(SCc2cccc(C#N)c2)nnc1-c1ccccc1 515487618 LZHNABHLYHFSIF-SFHVURJKSA-N 396.519 5.718 30 20 GKED COc1ccc2oc(C(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)c(C)c2c1 517605614 NWTXTLNICKNVHA-INIZCTEOSA-N 389.238 5.051 30 20 GKED CC[C@@H](c1ccccc1)N(CC)CC(=O)N(CCC#N)c1cccc(C)c1C 519909695 MXLFTRIGFULSSD-QFIPXVFZSA-N 377.532 5.023 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3csc(Br)c3)cc2)c1 521315569 NMLTZCRBMDNLDN-UHFFFAOYSA-N 399.269 5.427 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(-c2ccccn2)cc1 521320298 NXKKPHILBVWLHB-FYYLOGMGSA-N 382.467 5.052 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(OC3CCCC3)c(OC)c2)c1C#N 524330667 YYYQDOMHLQFYOP-UHFFFAOYSA-N 384.501 5.073 30 20 GKED CCC(CC)c1cc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)on1 525047577 WYUDOZSEPJHOFX-UHFFFAOYSA-N 389.455 5.281 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2Cl)cc1 537306345 UHFJGPPFACFYAO-HJPURHCSSA-N 376.887 5.660 30 20 GKED COc1ccc(N(Cc2cccs2)C(=O)[C@@H](C#N)CCc2ccccc2)cc1 538834843 XYJGQBJHBLXMBL-LJQANCHMSA-N 390.508 5.062 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)NCCCC#N 541468497 LZARHVKBFGWDGY-UHFFFAOYSA-N 393.466 5.157 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 546089825 DAIFCERRHYHOEX-GOTSBHOMSA-N 388.511 5.037 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)[C@H]1CC[C@@H](C(F)(F)F)C1 560686806 WBTYLZGTQAWITK-JGVFFNPUSA-N 391.258 5.224 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C2CC2)[C@H]1C1CC1 574886471 NRNCPWAYUJOSEB-FYYLOGMGSA-N 387.483 5.311 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(Br)cc1F 578059198 CVBTUGXZMPHQJS-GFCCVEGCSA-N 397.313 5.109 30 20 GKED C=CCN(C(=O)c1cc(-c2ccco2)nc2onc(C(C)C)c12)c1ccccc1 589898888 KYGNIBKNADKRCO-UHFFFAOYSA-N 387.439 5.439 30 20 GKED COc1cc(NC(=O)NC(C)(C)c2cccc(C#N)c2)c(C2CC2)cc1Cl 596944343 LBURBZZTSAYMEK-UHFFFAOYSA-N 383.879 5.154 30 20 GKED COC(=O)CCSc1cc(Cl)ccc1NCc1ccc(C#N)cc1Cl 600856920 STNIJDBFWLDLOX-UHFFFAOYSA-N 395.311 5.132 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H](c3ccccc3)C3CC3)cn2)c1 603692548 KMCXKKPYXPICFJ-QFIPXVFZSA-N 384.439 5.018 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(-c4ccccc4)s3)cn2)c1 603739814 GTVSSWYXTPZKCI-UHFFFAOYSA-N 398.447 5.121 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c(C)c1 608552883 KWLBPABFAWEUJN-AWEZNQCLSA-N 390.386 5.122 30 20 GKED CC(C)c1noc2ncc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)cc12 609176516 KTOVYMJQRSQREB-UHFFFAOYSA-N 398.422 5.262 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)NCc3ccc(C#N)cc3F)c2)C1 609252237 HNIIKRULGDQCOB-KKSFZXQISA-N 395.478 5.114 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(-c4ccccc4)ns3)cn2)cc1 610422604 VHUYHXDGRHDYAZ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc2cc(Cl)ccc2s1 613407042 DSLLTZLBAFKOMI-QGZVFWFLSA-N 396.899 5.761 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cnc2ccccc2c1C(F)(F)F 615969714 MEYWJIMZOLACNN-UHFFFAOYSA-N 388.364 5.221 30 20 GKED Fc1ccccc1-c1ncc(CN2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)s1 648381412 YUWBAWRBQVFKIQ-VXGBXAGGSA-N 398.347 5.122 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cccc(F)c4o3)n2)cc1 682126993 DCKLWROKOGCHOQ-OAHLLOKOSA-N 376.412 5.494 30 20 GKED CCCCCCCCCCC(=O)N1CCC(n2cc(Br)cn2)CC1 731588095 DXVVMWUVIUPOFV-UHFFFAOYSA-N 398.389 5.340 30 20 GKED COc1ccc2cc(C(=O)/C=C\c3ccc(Oc4cnccn4)cc3)ccc2c1 743058169 GZQDBILLICWOEJ-WCIBSUBMSA-N 382.419 5.327 30 20 GKED N#Cc1ccc(OCCCNc2ccc(Cl)cc2[C@H](O)c2ccccc2)cc1 746051034 GHDWFVAJYSFVHT-HSZRJFAPSA-N 392.886 5.174 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](c3ccccc3)C2)cc1 746763296 ASBWERHTHOTYSN-UPVQGACJSA-N 381.479 5.363 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Cl)c(Cl)c1 747105209 QOEDHQWXWAWSMO-JQWIXIFHSA-N 375.280 5.583 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)CCSc2ccc(Cl)cc21 748440855 HUWLVBYQWSHPIW-FMIVXFBMSA-N 384.913 5.621 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=S)Nc1ccccc1-c1ccccc1 751003510 QXOWGZQPCGDWGH-UHFFFAOYSA-N 388.536 5.747 30 20 GKED Cc1cc(/C=C/C(=O)c2coc(C(C)C)n2)cc(C)c1OCc1ccccn1 752891295 SZVHNQNYZBSGAY-CMDGGOBGSA-N 376.456 5.285 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccc3[nH]ccc3c2)cc1 765914572 CVRLMDQEYYCTHI-NJVLKRQQSA-N 385.467 5.042 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(N3CCCCC3)cc2)c2ccccc21 767404065 VFDCCCRMDCVUKG-UHFFFAOYSA-N 386.499 5.188 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cccc2ccsc12 767961699 ZCNYBFUVUQDHPT-HNNXBMFYSA-N 389.263 5.169 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1 770559793 PHUKBLLBXKNVRQ-DFBJGRDBSA-N 386.495 5.256 30 20 GKED CCOc1cccc(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 771465204 YSJGKWWSFKXRMI-XMMPIXPASA-N 399.494 5.105 30 20 GKED CC(C)(C#N)CCOC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 776383566 VDWTWCXZNIODHQ-UHFFFAOYSA-N 383.300 5.142 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](c2ccccc2)c2ccc(OC)cc2)c1 779103979 GMFRXHZDOTVWSY-WIOPSUGQSA-N 386.495 5.255 30 20 GKED COCc1cnc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 779594775 AAFHESALZUCTQL-UHFFFAOYSA-N 399.903 5.006 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 780672707 IELJWZLTYIULNV-XOBRGWDASA-N 383.879 5.294 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(F)c3F)o2)c1 790965610 TWQUJCRBQVXVSQ-MRXNPFEDSA-N 382.410 5.196 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CSc3c(Cl)cccc3C2=O)cn1 792882313 FEEYPOVUWGCHOG-ZROIWOOFSA-N 394.883 5.178 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@@H]2CCOc3c2ccc(Cl)c3Cl)cc1 793962846 XXIZZOJHWDKZOA-MRXNPFEDSA-N 389.282 5.048 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(NC(=O)OC(C)(C)C)ccc2C)s1 796593771 PHMZQRVLGGFDMO-UHFFFAOYSA-N 385.489 5.090 30 20 GKED C=CC[C@H](OC(=O)[C@H]1CCC(=O)c2cccn21)c1ccc(Cl)c(Cl)c1 797555212 VYPDEPPVWVOFTG-AEFFLSMTSA-N 378.255 5.173 30 20 GKED O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N(Cc1cccs1)CC(F)(F)F 801678355 HPHVOJBIDUVEKH-CYBMUJFWSA-N 399.331 5.369 30 20 GKED N#C[C@H](C(=O)CCSc1cccc(Cl)c1)c1cc(C(F)(F)F)ccn1 813209932 GNEMRDQDVHYVEK-AWEZNQCLSA-N 384.810 5.112 30 20 GKED COCC1(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 842687944 DKMLPDIASSAEPG-CYBMUJFWSA-N 395.311 5.110 30 20 GKED N#CCCC[C@@H](NC(=O)/C=C/c1csc(C(F)(F)F)c1)c1ccccc1 861824049 PEDYTOFULJCXGH-ZNFPLGDCSA-N 378.419 5.331 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 862831499 KTELNDZLIIMPMV-UHFFFAOYSA-N 393.487 5.111 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2cccnc2)cc1 915351962 FAOAQWZMCCAXPM-DHIUTWEWSA-N 382.467 5.106 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CSc3ccc(C)cc3C)n2)cc1 916971557 BTGUBKMSBVKZJK-SFHVURJKSA-N 392.549 5.704 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916997295 UZUXOACOFBGPLG-HWYHOQROSA-N 399.302 6.007 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1 917026541 GUQIECZLSLENDC-GOSISDBHSA-N 380.900 5.663 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917042925 IZBRQJZEPDQSGK-AWEZNQCLSA-N 388.414 5.469 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 917426450 LRLIOFXCHSPMRA-LAYTVVDLSA-N 396.446 5.230 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3nccc4sccc34)cc2)c1 1776036253 RLKVPDQTMUANNW-UHFFFAOYSA-N 387.464 5.036 30 20 GKED CC(C)(C)[C@H]1C/C(=C\c2ccccc2C#N)c2nc3ccccc3c(C(=O)O)c2C1 1776121938 YGZYGISWVPBJAR-GQEMFKIVSA-N 396.490 5.954 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl 1776149229 XQAWSNAVOFPSPO-OAHLLOKOSA-N 377.843 5.089 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccc(Cl)cc1Oc1ccc(F)c(Cl)c1 1776149434 UILHOXAZTDIKOT-AWEZNQCLSA-N 398.261 5.434 30 20 GKED CC(C)c1cccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)c1 1776375328 FXSNMQHNJFMUAW-SDNWHVSQSA-N 384.475 6.000 30 20 GKED O=C(O)Cc1cccc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)c1 1777650919 CUCNPKHVKUFASP-RGEXLXHISA-N 399.471 5.347 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCOc4ccccc4C3=O)s2)c1 1777684358 VNNNQBVCEGJEOV-FYWRMAATSA-N 376.433 5.162 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)cc1 6340156 KARVXNUOUBBNPD-NTEUORMPSA-N 391.854 5.497 30 20 GKED CCOc1ccc(-n2c(SCCCC#N)nnc2-c2cccc(Cl)c2)cc1 6365749 NGZCIBFMYMVYGW-UHFFFAOYSA-N 398.919 5.382 30 20 GKED CC(C)(C)c1ccc(C(=O)/C(=C(/S)NC2CCCCC2)[n+]2ccccc2)cc1 27462069 HYLVDDONYYOPNX-UHFFFAOYSA-O 395.592 5.133 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1nc2ccccc2[nH]1 41495402 KWQVWLNFTQOQAO-FQEVSTJZSA-N 393.446 5.069 30 20 GKED CSCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 41513706 WCFNOCMDMHRZSP-GOSISDBHSA-N 378.522 5.472 30 20 GKED N#CCc1ccc(NC(=O)CNc2ccccc2Oc2ccc(Cl)cc2)cc1 63479680 TWQJLUHUWGTBAM-UHFFFAOYSA-N 391.858 5.249 30 20 GKED C=CCN(C(=O)CCc1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 64681437 ZDWPUFVLRYYVHA-UHFFFAOYSA-N 384.451 5.240 30 20 GKED COc1ccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1F 66037493 DDPZVUITGDGBQM-UHFFFAOYSA-N 390.414 5.070 30 20 GKED Cc1ccc(F)c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 108241907 MTCZKGBOUYREEI-UHFFFAOYSA-N 382.382 5.411 30 20 GKED CSc1ccc(NC(=O)[C@@H](C)Nc2ccccc2SC[C@@H](C)C#N)cc1 108407611 UZGASDVSYQLYLX-LSDHHAIUSA-N 385.558 5.099 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)n1 108624244 HJHWNGMSKPQPFO-CQSZACIVSA-N 398.919 5.214 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(SC(F)F)c2)c1 114005543 HCAAJJZZIMJGSS-HNNXBMFYSA-N 391.443 5.004 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C/c2ccc3ccc(Cl)cc3n2)n1 131166109 TULKQNGXICOQSU-WAVCKPEOSA-N 381.888 5.358 30 20 GKED Cc1c(COc2ccccc2)cccc1NCc1nnc(-c2ccc(C#N)cc2)o1 134065960 PYCQTDQRCJNWQZ-UHFFFAOYSA-N 396.450 5.108 30 20 GKED CCSc1cccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 153984377 YBXNVERCANYYCG-UHFFFAOYSA-N 389.480 5.418 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(NC(C)=O)cc1Cl 159574351 FZHQBXXUKLKGJH-UHFFFAOYSA-N 398.315 5.233 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cc12 173265357 WANSFWCVEUVVGZ-ZDUSSCGKSA-N 398.557 5.405 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(CCC(F)(F)F)cc2)c1 176261400 FKVKOYBGXVKJBL-UHFFFAOYSA-N 391.393 5.508 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2ccccc2n1C(F)F 176726647 BKHVBNSKNZNHIA-LBPRGKRZSA-N 397.278 5.079 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccccc1Sc1ccccc1C#N 182025619 SECQJWVCZUADRG-INIZCTEOSA-N 399.475 5.253 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1C1CCN(C(=O)[C@H](C)CC(=C)C)CC1 192990066 VBFBYIGVGRUMHQ-VQTJNVASSA-N 396.575 5.536 30 20 GKED CC(=O)Nc1cccc([C@@H](C)NCCC(C#N)(c2ccccc2)c2ccccc2)c1 193084717 WIWUTQCMDPXMMN-HXUWFJFHSA-N 397.522 5.196 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)NCc1ccccc1Sc1ccccc1 303352981 XZFATTJKNJTCNR-UHFFFAOYSA-N 387.508 5.051 30 20 GKED Cc1ccc(Cc2cnc(N=C(O)[C@H]3CCC(=O)[C@H](C)C3)s2)cc1Cl 328915478 QUHOOGURUFGKRO-OCCSQVGLSA-N 376.909 5.289 30 20 GKED OC(=Nc1cccc(/C(O)=N/[C@H]2CCN(C3CCCC3)C2)c1)C1CCCCC1 329134034 BOMGEWIFHZDKES-FQEVSTJZSA-N 383.536 5.176 30 20 GKED C[C@H](N[C@@H](C)c1nc(O)c2ccccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 376865769 AOSMRWBFFYCLHW-IRXDYDNUSA-N 394.478 5.286 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2nc3c(s2)CCCC3)CC1)c1ccccc1 425023792 RYDPEZKALBXJLO-KRWDZBQOSA-N 380.557 5.088 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCCOc2c(Cl)cccc21)c1ccccc1 431468171 CXRYZKZHRYRMBU-VQTJNVASSA-N 397.906 5.288 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N[C@@H](c1cc(F)ccc1F)C(F)F 433221802 RPYULJOIVVMALP-ZDUSSCGKSA-N 398.253 5.251 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 435595111 UEKBXFDJNFZAFU-HXUWFJFHSA-N 381.501 5.100 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(OCc2ccc(F)cc2)cc1 436115047 MRJRJEUKVKPCLH-MHZLTWQESA-N 387.520 5.373 30 20 GKED C[C@H](SCc1ccc(C#N)cc1OC(F)F)c1nc(-c2cccs2)no1 439535930 JUOXZJFCLJLYRH-JTQLQIEISA-N 393.440 5.266 30 20 GKED CC[C@H](N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 447540441 JDBXCCBXCQVMTJ-LADGPHEKSA-N 398.485 5.529 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 463266323 NASOUGSBUJROCO-UHFFFAOYSA-N 399.237 5.177 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc(C2CC2)nc2ccc(F)cc12 463418388 ZWGKDOMPACOMNP-UHFFFAOYSA-N 387.458 5.175 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)[C@H](C)c1cccnc1 464964601 ZDBUBABADIYNFI-GOSISDBHSA-N 385.467 5.277 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1-c1nc2ccccc2s1)c1ccccc1 474430461 IFSUSWXPZZUAOG-GOSISDBHSA-N 397.503 5.989 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 475463956 HBCCHWBOQAODLX-KRWDZBQOSA-N 389.480 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1ccc(NC(C)=O)cc1 476125399 AFWIMBIALJJYIU-INIZCTEOSA-N 396.556 5.616 30 20 GKED N#CC[C@H](CC(=O)Nc1c(O)c(Cl)cc(Cl)c1Cl)c1ccccc1 476570634 JMXDBMGXIXNURC-LLVKDONJSA-N 383.662 5.378 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(-c2ccc[nH]2)cc1 480684768 YUDANVFFIXNWNY-UHFFFAOYSA-N 377.492 5.069 30 20 GKED N#Cc1ccc(/C=C(\CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)s1 484471656 VDZPUWZAAIJOPY-WEVVVXLNSA-N 394.399 5.264 30 20 GKED N#Cc1cccc(OCc2cccc(-c3nc([C@H]4CCC(F)(F)C4)no3)c2)c1 484555248 VNPHCINWFAXHQD-KRWDZBQOSA-N 381.382 5.090 30 20 GKED Cc1cc(CCC(=O)N[C@H](CCCC#N)c2ccccc2)ccc1Br 487175495 JEBNEWJVFNTGMI-HXUWFJFHSA-N 399.332 5.242 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(-c2ccc(F)cc2)n1)c1ccccc1 487252169 PPZQJTTYYHPURF-GOSISDBHSA-N 379.460 5.114 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 497393308 XMHHFRMHIDKECI-SAPNQHFASA-N 399.494 5.326 30 20 GKED C=CCN(C(=O)Cc1cc(Cl)ccc1Cl)c1nc2c(s1)CCCC2 498297742 CBONVMQPHBRZHF-UHFFFAOYSA-N 381.328 5.090 30 20 GKED C[C@@H]1CC[C@@H](NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@H](C)C1 502633426 KCHBULXPYPYWPD-JBYIUTFZSA-N 391.515 5.278 30 20 GKED C=CCCc1ccccc1NC(=O)N(CCCO)[C@@H]1CCCc2ccccc21 505017786 ZFCZNPDXRHXOIT-HSZRJFAPSA-N 378.516 5.099 30 20 GKED N#C[C@@H](C(=O)c1ccc([C@@H]2CCCOC2)cc1)c1nc(-c2ccccc2)cs1 505435267 UHJZVNFXOIZWLL-UXHICEINSA-N 388.492 5.194 30 20 GKED N#Cc1ccc(N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c([N+](=O)[O-])c1 511394419 AHQYOPUAAGQFFC-MRXNPFEDSA-N 394.431 5.219 30 20 GKED C=CCOc1ccc(CNCc2ccccc2OCC(F)(F)F)cc1Cl 518267717 RAKDLTQZPSMPFU-UHFFFAOYSA-N 385.813 5.136 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C(C)(C)C 519450823 KIUQYPVVLZRXRA-OXJNMPFZSA-N 381.545 5.847 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N[C@@H](C)c2ccc(Cl)cn2)cc1 525937109 LZYZHTIZPBBFQH-HNNXBMFYSA-N 391.858 5.198 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)c(OC(F)F)c1 537078226 WYFCVYWTADDNHW-OAHLLOKOSA-N 388.311 5.082 30 20 GKED Cn1c(-c2cccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)c2)nc2ccccc21 539656029 IIVNRPAVRRXENQ-UHFFFAOYSA-N 392.462 5.048 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)Nc1ccc(Cl)c(C#N)c1 540873436 GZVKGBLDLZPEGS-UHFFFAOYSA-N 384.060 5.188 30 20 GKED N#CCCn1cc(/C=C\c2nc([C@@H]3CCOc4ccccc43)no2)c2ccccc21 545691221 RGDKSQOTPMZEGG-JPMGXVIASA-N 396.450 5.023 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 549058907 GTXVLJANELSIOH-UHFFFAOYSA-N 386.864 5.004 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc3nc(Cc4ccccc4)oc3c2)c1 552297048 ZTVVUDDQXHXYNJ-UHFFFAOYSA-N 387.826 5.196 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2nccc(C#N)c2Cl)nc1-c1ccccc1 553068059 RNWXUPPXLMFYSC-KRWDZBQOSA-N 392.890 5.727 30 20 GKED CC(C)(C)[C@@H]1OCC[C@H]1c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 571194825 TUJSYMIQAVVWTC-CYLPXRDMSA-N 390.487 5.027 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(OC2CCCCC2)cc1 576691306 MJXSAFIOAPADQT-UHFFFAOYSA-N 398.503 5.094 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cccc(C#N)n2)cc1Cl)c1ccccc1 589335462 BEKNFTUDKZVEJC-AWEZNQCLSA-N 376.847 5.032 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)OC(C)(C)C)cn1 592624265 AEGDTMWTXSNHPQ-UHFFFAOYSA-N 380.488 5.141 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc2cc(F)ccc2s1 592974729 YEDUQQQZADWBMR-KRWDZBQOSA-N 380.444 5.247 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)C1 596752991 NQIXLZKTQGXZGK-LLVKDONJSA-N 391.846 5.152 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(c4ccccc4)CC3)cn2)c1 603691764 BVAJYRPSUVHJIY-UHFFFAOYSA-N 398.466 5.157 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@H]1Cc2ccccc21 604364106 NYJHQRHFBIHCLS-LJQANCHMSA-N 383.451 5.120 30 20 GKED Cc1c(C#N)c(SCc2ccc(OCc3ccncc3)cc2)nc2c1CCC2 604510805 NLUUCDRZUBRQRZ-UHFFFAOYSA-N 387.508 5.017 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc4cc(F)ccc4o3)c2)c1 609783724 GRVAJAWYYSIXRI-UHFFFAOYSA-N 386.382 5.275 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccccc3OC3CCC3)cc2)c1 609815405 GGHVEUFQWCABSV-UHFFFAOYSA-N 398.462 5.321 30 20 GKED C[C@H](CC#N)N(C)C(=O)c1cccc(CSc2c(Cl)cccc2Cl)c1 610196735 BDSZVTVKANOCKS-CYBMUJFWSA-N 393.339 5.660 30 20 GKED C[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1cccc(C#N)c1 610496931 PBGVEOPMNBXCHX-INIZCTEOSA-N 383.476 5.072 30 20 GKED C[C@H](N[C@@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1)c1cccc(C#N)c1 610914552 DLPGQJKGCTUWNC-FIKGOQFSSA-N 382.479 5.057 30 20 GKED N#CCc1ccc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 612536470 UZHNQETYJMTJFE-QGZVFWFLSA-N 397.238 5.298 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619124647 DSRGNWBGWXUXPW-LLVKDONJSA-N 387.339 5.174 30 20 GKED CN(Cc1ccccc1NC(=O)c1cc2ccccc2n1CC#N)c1ccccc1 619144353 JSXCMZUHMHQLFP-UHFFFAOYSA-N 394.478 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Cc1c(C)nn(COCC)c1C 632750925 LQRWXIXHMVSKNE-QGZVFWFLSA-N 397.563 5.163 30 20 GKED O=C(Nc1c(F)cccc1Cl)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 646345142 LWOSTQHWJVIWJS-HTQZYQBOSA-N 392.702 5.074 30 20 GKED Fc1ccc(/C=C\CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 671706739 OVKJSHMDNQRMJI-JZIZGNRHSA-N 387.314 5.477 30 20 GKED FC(F)Oc1ccc(NN=Cc2c(-c3ccccc3)nc3ccccn23)cc1 726427462 YNLUAOISCXWGEY-UHFFFAOYSA-N 378.382 5.049 30 20 GKED C[C@@H](NC(=S)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccs1 726460435 BPIDXBKPZOLYOH-BEFAXECRSA-N 377.538 5.451 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2c[nH]c3cc(Br)ccc23)cc1 729937530 VEKVUUCNIPTIAO-PRUHKGEBSA-N 395.256 5.117 30 20 GKED C#CCCOc1ccc(CN[C@@H](c2ccc(C)cc2)c2ccc(OC)cc2)cc1 733326061 GSWGHYYCXJNFET-SANMLTNESA-N 385.507 5.285 30 20 GKED CCOC(=O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc4c(c3)COC4)o2)cc1 742437777 XLAAZWUNQBXZOX-PKNBQFBNSA-N 388.419 5.050 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744034543 AZGZNMKMEQJPFE-MLGOLLRUSA-N 386.879 5.534 30 20 GKED C[C@@H](NC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1)c1cccc(C#N)c1 745922959 FYBCXZNNAXFILW-HOYKHHGWSA-N 381.479 5.128 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1ccnc2ccccc12 748736789 ZMEIYQLQWYAAPX-UHFFFAOYSA-N 395.487 5.188 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1csc(-c2ccc(Cl)cc2)n1 754710292 SPSDWMQRKLMJHA-UHFFFAOYSA-N 382.794 5.895 30 20 GKED CC(C)(c1ccc(NC(=O)Nc2ccc(F)cc2OCC#N)cc1)C(F)(F)F 760111159 CLPQCNAUTDHRNM-UHFFFAOYSA-N 395.356 5.212 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2csc(-c3csc(C)n3)c2)c1 772982085 DOQPEMGQDYFYKO-KSSFIOAISA-N 397.569 5.712 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(F)cc2)C2CCCC2)ccc1OC 774450635 VDUKYOPXJSJEGT-XUZZJYLKSA-N 396.506 5.536 30 20 GKED N#C[C@@H](C(=O)c1ccc(N2CCCCC2)cc1)c1nc(-c2ccccc2)cs1 777303498 BHQFIVNKQGSNEV-FQEVSTJZSA-N 387.508 5.290 30 20 GKED Cn1cc(CNc2ccc(SC(C)(C)C)cc2)c(-c2ccc(C#N)cc2)n1 778102239 BESBQGSVLPWEJH-UHFFFAOYSA-N 376.529 5.461 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1sc(-c2ccccc2)nc1C(F)F 780174760 AEBLOFGOQNCMJI-LBPRGKRZSA-N 399.422 5.291 30 20 GKED C[C@H](NCc1ccnc(Cl)c1Cl)c1ccc(-c2cccc(C#N)c2)cc1 811489082 VPFXPGXTPLEWGI-AWEZNQCLSA-N 382.294 5.778 30 20 GKED N#C[C@@H](C(=O)CC[C@H]1CC1(Cl)Cl)c1nc(-c2ccc(Cl)cc2)cs1 850763255 XMBYBDVGOGYMEK-AAEUAGOBSA-N 399.730 5.614 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1=CC[C@H](NC(=O)OC(C)(C)C)C1 861269240 PYLVUXUHIFBOKE-SFHVURJKSA-N 384.520 5.091 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cccc(SC(F)(F)F)c1 863993136 LRLGVURMYNASEN-AWEZNQCLSA-N 380.435 6.154 30 20 GKED CC(=O)Nc1cccc(C(=O)N2CCCSC2=Nc2ccccc2C(C)C)c1 864016447 VLDMQORSKNVTOK-UHFFFAOYSA-N 395.528 5.035 30 20 GKED CC(=NOCc1cc(Cl)cc2cccnc12)c1ccc(NC(=O)C2CC2)cc1 914785718 FIXFYYHIEWBJLT-UHFFFAOYSA-N 393.874 5.178 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCn2ccc3ccccc32)cc1 915086141 HENPSBOEJOFZSP-HSZRJFAPSA-N 379.463 5.326 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C/c3ccc(Cl)s3)cn2)c1 915175324 XLPVJQYYZIHZEK-SOFGYWHQSA-N 381.844 5.112 30 20 GKED CC(C)c1cccc(OCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 917027259 ZTNIEADQEYCNKK-IBGZPJMESA-N 376.481 5.189 30 20 GKED C=CCN(Cn1nc(Nc2cccc(Br)c2)sc1=S)C(C)C 917481583 PYIFVCXVWLYUIA-UHFFFAOYSA-N 399.383 5.034 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3cccc(Cl)c3)cs2)cc1 920062927 GUYMEWZDRNUMEJ-YHYXMXQVSA-N 385.872 5.280 30 20 GKED C#CCC1(NCc2csc(N(C(C)=O)c3ccccc3CC)n2)CCCCC1 933268169 SCEJSVPBJFVJLX-UHFFFAOYSA-N 395.572 5.206 30 20 GKED CC(=NNc1ccc(OC(F)F)cc1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776040662 IGYZPEDJGAZOBR-UHFFFAOYSA-N 386.354 5.082 30 20 GKED C=CC[C@H](CC(C)C)C(=O)Nc1cc2c(c(C(=O)O)c1)Oc1ccccc1O2 1776151951 LGJOJTNERLFHGW-CQSZACIVSA-N 381.428 5.460 30 20 GKED C/C(=C/c1ccc(-c2ccccc2C(=O)O)cc1)c1nc2ccccc2n1CC#N 1776197234 OZNNPHFWAVWCFA-MSUUIHNZSA-N 393.446 5.486 30 20 GKED CCCCCCCCc1ccc(C(=O)N2CC3(CCC3)CC[C@@H]2C(=O)O)cc1 1776785852 JGPVMYULPUOYAY-OAQYLSRUSA-N 385.548 5.449 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3c(F)cc(C(=O)O)cc3F)s2)cc1 1777430594 NNXRZDVBXQPFMJ-FPLPWBNLSA-N 399.418 5.299 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@H]3CCC5)o2)cc1O 1777670950 FZRWOTHLHGGFQZ-JJBLJPBOSA-N 386.403 5.050 30 20 GKED N#CCc1ccccc1C(=O)O[C@@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 22872198 AOSUPSZOOWNVGV-XMMPIXPASA-N 394.430 5.015 30 20 GKED C[C@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 51534130 QIYZELJUOZYJIN-YJBOKZPZSA-N 378.522 5.308 30 20 GKED CC(C)c1cc(C(=O)Nc2sc3c(c2C#N)CCCC3)c2ccccc2n1 61046375 IDGSWBWOFMVJQC-UHFFFAOYSA-N 375.497 5.422 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12 63962170 DZKQOGLQVUGDQZ-UHFFFAOYSA-N 388.471 5.121 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 63962462 FTVGUKAVGCHVTJ-UHFFFAOYSA-N 397.409 5.580 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc(Cl)cc3)n2)cc1 72032270 WXEKFLQJKPPKOO-BIPIYRQYSA-N 394.883 5.362 30 20 GKED COc1ccccc1-c1nc(CSc2nc3c(cc2C#N)CCCC3)cs1 96994989 HQPLTEAYPONKGV-UHFFFAOYSA-N 393.537 5.256 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc(-c3cccs3)nc2C)cc1 108808379 QMDMECCOSSUGON-UHFFFAOYSA-N 397.525 5.139 30 20 GKED CS[C@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 156375011 YMHMZEHYIJUQCT-SKDRFNHKSA-N 385.341 5.435 30 20 GKED C[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 173969494 RQNCBWVXRPSXCL-YWZLYKJASA-N 375.859 5.133 30 20 GKED CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1O[C@@H](C)C#N 184309992 BZBJKSPEJKFXAU-DSKINZAPSA-N 377.488 5.168 30 20 GKED C=C(C)[C@@H](NCc1nnc(-c2ccc(Cl)cc2)o1)c1ccc(F)c(F)c1 187781477 BSYQRPUGGDKZAO-GOSISDBHSA-N 375.806 5.075 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2nnc(-c3ccccc3O)[nH]2)cc1 192952219 NBVDEVALRDYVRU-UHFFFAOYSA-N 384.464 5.008 30 20 GKED N#C[C@H](C(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2[nH]1 255615594 COVKIBRDMKHODW-OZYJXZHSSA-N 389.764 5.038 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ccnn2CC)CC1 278728662 LTMNFARFQLACGY-UHFFFAOYSA-N 380.536 5.166 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cc(F)ccc1F 303859660 MGDAPWNPEVVQNH-SUMWQHHRSA-N 389.471 5.489 30 20 GKED C[C@H]1C(=O)CC[C@H](C(O)=Nc2nc3c(Br)cccc3s2)C1(C)C 329296245 STGIYEDACXNDJS-VHSXEESVSA-N 395.322 5.288 30 20 GKED CC(C)(CC(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2)C(F)(F)F 410985739 OCPGOKJFZDPXQW-UHFFFAOYSA-N 380.391 5.096 30 20 GKED CC(C)(c1ccc(NC(=O)N(CCC#N)Cc2ccco2)cc1)C(F)(F)F 429692858 WUYNUVZAOQDHMF-UHFFFAOYSA-N 379.382 5.067 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1OC1CCCC1 430629428 QGNHXWNPIFBGTC-INIZCTEOSA-N 398.528 5.261 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1 432258483 ZDDQTWDMCFYOAL-UHFFFAOYSA-N 385.389 5.207 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 432399001 ISEFKTRGKBTNDX-UHFFFAOYSA-N 390.251 5.366 30 20 GKED COc1cccc2c1[C@@H](C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)CC2 432880252 NNOLZWIZHPMUFH-NRFANRHFSA-N 398.462 5.336 30 20 GKED C=CCC[C@H](NC(=O)CCc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1 435280509 NUSGOMIZGQNTMT-IBGZPJMESA-N 395.890 5.146 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 438606818 JPDDTDRFNFKGTA-SFHVURJKSA-N 376.378 5.057 30 20 GKED C=CC[C@@H]1N(C(=O)C2CCN(c3nc4ccccc4s3)CC2)CCCC1(C)C 443872136 YICIHOJBWUMLQN-FQEVSTJZSA-N 397.588 5.106 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC[C@@H]4CCC[C@@H]43)cc2F)c1 444389907 QYVDWUNLJAUCCM-RXVVDRJESA-N 393.462 5.073 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1cccc(COc2ccccc2C#N)c1 444450429 PLTNPOJIISIGFK-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CC(C)n1nc(-c2ccco2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 447863766 AWJTYGIQBRSTBU-UHFFFAOYSA-N 396.450 5.515 30 20 GKED N#CCc1cccc(NC(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)c1 455922417 QQCMNODEPJMPAH-IBGZPJMESA-N 387.405 5.531 30 20 GKED C[C@@H]1CN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C[C@@H](c2ccc(F)cc2)O1 462874750 DRPDTKVFJUVGRC-XIKOKIGWSA-N 399.828 5.004 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C4CCC4)c3)n2)cc1 467203400 XTWWKQBKXLFPIC-FQEVSTJZSA-N 388.492 5.576 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(Cl)c(Cl)c1 471931410 CWRGNXXKRFAQKV-LBPRGKRZSA-N 379.312 5.741 30 20 GKED CC(=O)c1sc(NC(=O)c2ccc(C(C)(C)C#N)cc2)nc1-c1ccccc1 474400744 AXENLJRLIIQVHG-UHFFFAOYSA-N 389.480 5.066 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCSc1ccc(OC)cc1 476133621 FVSDBDYSFKZVPK-UHFFFAOYSA-N 383.557 6.058 30 20 GKED COc1ccc(F)cc1-c1csc(NC(=O)c2ccc(C(C)(C)C#N)cc2)n1 476333650 DEVULPOVVWGQDK-UHFFFAOYSA-N 395.459 5.011 30 20 GKED N#CCCN(CC(F)(F)F)C(=O)c1sc2cc(Cl)ccc2c1Cl 482669146 KWQKLXWNVXAJOB-UHFFFAOYSA-N 381.206 5.126 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1F 484102097 YOEPUZUNYQXVJJ-SFHVURJKSA-N 382.788 5.610 30 20 GKED Cc1oc(-c2cccs2)nc1CNc1ccccc1Oc1ncccc1C#N 486453080 DOIFCYHIFOVUNM-UHFFFAOYSA-N 388.452 5.383 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1ccccc1Br)c1ccccc1 487215736 BXGAQCNEBMIXRV-HXUWFJFHSA-N 399.332 5.323 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccccc1CC(F)(F)F 487360518 RONUKAZJQBDFRR-UHFFFAOYSA-N 380.435 5.120 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cc(-c2ccc(Cl)cc2)no1 487386752 BVZBAXHRKTTXIX-AWEZNQCLSA-N 383.904 5.859 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Sc2ccccn2)cc1)c1ccccc1 487578695 XFQCOSLAYLNBSV-OAQYLSRUSA-N 387.508 5.398 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)Nc1cccc(OCCCC#N)c1 488478015 BQSLDYJFWCQAGT-UHFFFAOYSA-N 385.467 5.389 30 20 GKED Cc1cccc(O)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 490673491 SBJWXBRNMSHRGM-UHFFFAOYSA-N 378.815 5.270 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)N(CCC#N)Cc2ccco2)cc1 494200376 DDKVVESOVVVQIA-UHFFFAOYSA-N 375.428 5.328 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)N(CC(C)C)c3ccc(C#N)cc3)o2)cc1 499317649 UNLLUFOFHPZVJB-UHFFFAOYSA-N 387.483 5.144 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1cccc(F)c1F 500245639 WWNDGXQMCQQUJA-INIZCTEOSA-N 378.422 5.266 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1cc(F)ccc1F 500736364 DPRFBSMCJKHKLG-UHFFFAOYSA-N 392.405 5.509 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4ncsc4c3)c2)cc1 501448989 IWQISIPVXPENSC-UHFFFAOYSA-N 399.475 5.194 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c1C 513201792 QQOLXDGVEVXLOK-SFHVURJKSA-N 385.467 5.407 30 20 GKED N#C[C@@H](C(=O)c1csc2ccccc12)c1nc(-c2c(F)cccc2F)cs1 518870184 XGNUFUMIHQIECQ-LBPRGKRZSA-N 396.443 5.793 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)c2cc3cc(F)ccc3s2)CC1 520364717 WPPZWIKLSZKRJF-UHFFFAOYSA-N 394.471 5.032 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc(OCCCC#N)c1 523101410 HVZFCKFMWONXHQ-OAHLLOKOSA-N 390.405 5.205 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(-c3nc(C)cs3)c2)cc(OC)c1OC 523291053 NSOAGELPHCUMLB-UHFFFAOYSA-N 394.496 5.117 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)C[C@@H](C)c1ccccc1 524304680 HUYFWSPUKAIQQB-LJQANCHMSA-N 399.494 5.926 30 20 GKED CC[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 524455498 YAYGURBDKAWSHT-NRFANRHFSA-N 388.442 5.409 30 20 GKED C=CCCC[C@@H](C)NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 537230447 LVLRUAYEJFDWBX-CYBMUJFWSA-N 381.303 5.442 30 20 GKED COc1ccc(CN(C)C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 542084964 MVBKUVQWPPYWSV-GOSISDBHSA-N 399.494 5.136 30 20 GKED N#Cc1ccc(NC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)c(Cl)c1 542227939 ZYATVQXIYZJGIW-UHFFFAOYSA-N 391.736 5.138 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 543820667 CZRAMMUHHDEJNF-JTSKRJEESA-N 395.572 5.686 30 20 GKED C=C(C)Cn1c(-c2ccc3ccccc3c2)nnc1N1CCC(OC(C)C)CC1 549667633 BWURCSXWNJGMTC-UHFFFAOYSA-N 390.531 5.068 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccncc2OCc2ccccc2)CC1 556909933 MZLYDRCCQARWRT-UHFFFAOYSA-N 397.522 5.154 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C[C@H](C)c1c[nH]c2ccccc12 561237587 QSJOYBURIFKWQV-SFHVURJKSA-N 378.520 5.044 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc2nccnc2c1Br)c1ccccc1 571599305 VZDHLUSJMSDPDI-HNNXBMFYSA-N 396.288 5.081 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc2nccnc2c1Br)c1ccccc1 571599308 VZDHLUSJMSDPDI-OAHLLOKOSA-N 396.288 5.081 30 20 GKED N#CC[C@@H](CC(=O)N(c1ccccc1)c1nc2ccccc2s1)c1ccccc1 577810707 QPLGCFOVLQGOJV-IBGZPJMESA-N 397.503 6.049 30 20 GKED N#CCc1cccc(Br)c1OCc1nc(-c2ccccc2)cs1 578372758 CRGDQKZQYLPFIK-UHFFFAOYSA-N 385.286 5.218 30 20 GKED N#CCc1ccccc1NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 583804606 SCVHHTCKPYGDMO-UHFFFAOYSA-N 389.436 5.064 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1ccccc1 590476498 IDIQSWUQHUTKLG-MRXNPFEDSA-N 382.332 5.149 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(CCc2ccccc2)Cc2ccccc2)cc1 603656412 VYXFMMSQZNWMCQ-UHFFFAOYSA-N 397.522 5.765 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)CCc2ccc3ccccc3c2)cc1 603961604 IOWZWVGXCQIAKZ-UHFFFAOYSA-N 396.412 5.235 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)sc2c1CCC2 609033387 KSZAPXVZHPCZAS-VXGBXAGGSA-N 377.296 5.157 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)Cc1ccc(C#N)cc1)C1CCCC1 609064508 AUFLBMSWVCTMHI-UHFFFAOYSA-N 398.506 5.234 30 20 GKED Cc1ccc(-c2csc(NC(=O)c3cc4ccccc4n3CC#N)n2)cc1C 609166227 KUTCUIAXWKPWPQ-UHFFFAOYSA-N 386.480 5.158 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)C[C@H]2CCc3ccccc32)cc1 609651595 ILMHYGNGVCLDND-HSZRJFAPSA-N 398.481 5.346 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 609773507 HXSCAMVKQXFSNG-SFHVURJKSA-N 385.467 5.328 30 20 GKED C[C@@H](NC(=O)Nc1cccc(CSC2CCCC2)c1)c1ccc(C#N)cc1 610143840 TZGJUPJDMBMHID-MRXNPFEDSA-N 379.529 5.617 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)N[C@H](C)c3cccc(C#N)c3)oc2c1 610363225 UZFOEKRDFSWZKF-MRXNPFEDSA-N 396.446 5.471 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](NCc2ccc(C#N)cc2F)CCC3)cc1 610812579 LWMKUYDWNULTBY-IBGZPJMESA-N 377.488 5.297 30 20 GKED N#Cc1c(NC(=O)Cc2ccc(C(F)(F)F)cc2)sc2c1CCCCC2 613258962 UVJAYIVFYKRHQD-UHFFFAOYSA-N 378.419 5.089 30 20 GKED C=CCn1c(S[C@H](C)c2c(F)cccc2F)nnc1-c1ccc(OC)cc1 613932648 IDGUZRMKNFJNSX-CYBMUJFWSA-N 387.455 5.271 30 20 GKED C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cc2cc(Br)ccc2o1 619754864 NEMHVQPDMDZMBC-LLVKDONJSA-N 389.680 5.571 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ncc(Cc2cccc(F)c2)s1 642449958 XBOXIYMFCVFZCY-UHFFFAOYSA-N 381.476 5.093 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)Nc3ccc(Cl)c(C#N)c3)c(C)c2c1 670877360 ZLHLPXLFQZXWHB-UHFFFAOYSA-N 380.831 5.040 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCOc2ccc(OCC)cc21 682776911 AJBNPOVMXYOLSX-OAQYLSRUSA-N 394.515 5.583 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@@H]2c2ccc(Cl)cc2)cc1Cl 726458479 LLCVFOHQOCQSJQ-QGZVFWFLSA-N 376.312 5.399 30 20 GKED C#Cc1cccc(N(C)C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)c1 728482531 WOQWLKIVKNEHAH-UHFFFAOYSA-N 399.277 5.225 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2s1 730685030 GCEYJJULWMNCDR-BXUZGUMPSA-N 389.307 5.658 30 20 GKED CCCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](CC)c1ccccc1 734097658 ARUQGGCPAXIASG-FQEVSTJZSA-N 385.964 6.162 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccnc3ccccc23)cc1 735429305 RPEFQZBTFZWUND-AIIPKAINSA-N 389.458 5.542 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 739594958 BKNGIENZXHYNME-FOIQADDNSA-N 390.508 5.252 30 20 GKED O=C(/C=C/c1cnn(Cc2ccccc2Cl)c1)c1cccc(-c2ccncc2)c1 741472797 KIFUMBRGKRFXSQ-CMDGGOBGSA-N 399.881 5.543 30 20 GKED COCc1ccc(/C=C2\CCc3nc(-c4ccccc4F)sc3C2=O)cc1 741843056 XWEVZKQJMWHJGH-FOWTUZBSSA-N 379.456 5.308 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ccn(-c2ccc(F)cc2)n1 742970257 GYCIIEOCJFCJDF-UHFFFAOYSA-N 387.867 5.001 30 20 GKED O=C(Nc1cccnc1)/C(=C\c1cccc(C(F)(F)F)c1)C(=O)c1ccccc1 747128116 OMMPKMSCKROIIJ-UYRXBGFRSA-N 396.368 5.005 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Cc2csc3ccc(Cl)cc23)c1 751968941 QLXISFDTEOSWNL-KRWDZBQOSA-N 398.915 5.095 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc4ccccc4n3)n2)cc1 752165806 ZIKMTADDJHBUMK-CBUFDYBVSA-N 395.487 5.556 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2cncc(-c3ccccc3)c2)cc1 757875684 TVYUXADESHCNQU-QHCPKHFHSA-N 397.478 5.052 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759181178 AOCLGLBXBHXGKW-GFBZKKKVSA-N 376.843 5.125 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](Cc2ccccc2F)c2ccccc2)c1 760002296 XIJDYGQECUFQPB-DHLKQENFSA-N 388.486 5.580 30 20 GKED CC(C)N(C(=S)Nc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 763139601 LQMSAXBQJJPDKH-UHFFFAOYSA-N 397.853 5.842 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COC/C=C/c3ccccc3)n2)cc1 763479770 XKKAKYADGLCIJU-MUPIXQSSSA-N 388.492 5.025 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(Br)c(F)c1 767735140 KHMCAJZWDZXXDO-FPYGCLRLSA-N 399.219 5.067 30 20 GKED C=CC[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 778619305 LNEDUNPNFCVGIN-HOTGVXAUSA-N 394.446 5.624 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCn1c2ccccc2c2ccccc21 780158925 AVONVCDWDBTTCE-KRWDZBQOSA-N 383.451 5.114 30 20 GKED C=CC[C@@H](C(=O)O[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784832610 UXWCDRSYJOCRMC-GDBMZVCRSA-N 382.460 5.308 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=C4CCC5(CCCO5)CC4)c23)cc1 788015795 OORGUUMIVIBUDW-UHFFFAOYSA-N 392.528 5.558 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@]12CCN(C(=O)OC(C)(C)C)C2 789887883 GJXTYHMTBJNLKX-DVECYGJZSA-N 398.547 5.124 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1nc(Cl)cs1 789937477 CBKBPOIDOWYSIK-UHFFFAOYSA-N 391.827 5.073 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C2CC(c3ccc(F)cc3)C2)cc1 796748212 UXDLVLVDTATXRR-FIHHNCHPSA-N 392.474 5.180 30 20 GKED FC(F)(F)c1cc(Br)ccc1NN=C1CCCC12CCOCC2 799879982 XMJUSNOGSTVVSJ-UHFFFAOYSA-N 391.231 5.217 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ccnc3c(Cl)cccc23)ccc1OC 804456232 VHZLJSLLYKOWDH-OAHLLOKOSA-N 381.863 5.190 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1ncccc1C#N)CC(C)(C)O2 811861945 AIJHTTXWGZXLQF-QGZVFWFLSA-N 394.475 5.015 30 20 GKED FC(F)(F)c1cc(NN=CC2CCC3(CC2)OCCO3)cc(C(F)(F)F)c1 814949064 RVSZOZCKXOYNCA-UHFFFAOYSA-N 396.331 5.055 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1cnn(-c2ccccc2)c1C 818203273 GPHQKWHNPGIWNG-UHFFFAOYSA-N 375.863 5.218 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)c1 825123459 VVGCLYIITDSUPR-NRFANRHFSA-N 382.385 5.178 30 20 GKED C[C@@]1(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1(Cl)Cl 835068618 SHMLHSDUQMJMEC-BLLLJJGKSA-N 399.730 5.614 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2CC[C@H]2c2ccc(Cl)cc2F)n1 835201424 WBFJURDDMPPVTI-AEGPPILISA-N 376.884 5.429 30 20 GKED N#C[C@H](C(=O)C1(c2ccccc2Cl)CCC1)c1nc2ccccc2n1C(F)F 845451705 PDRSGZHFJPMYDN-CYBMUJFWSA-N 399.828 5.383 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCCC(=O)OC(C)(C)C)n2)cc1 847626207 GTZLAWMCOCGQME-QGZVFWFLSA-N 398.528 5.197 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@]23CCCC[C@@H]2C3(F)F)cc1 850762162 VXOCPSPUUVROMT-PJTPKWCPSA-N 388.458 5.063 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916916551 VUWQSWBAEUVGSX-ANCZKMTESA-N 396.490 5.498 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccc(Cl)s3)n2)cc1 916974606 NRVHVJLNJNAYDV-VFADXPBXSA-N 384.913 5.723 30 20 GKED Cc1cccc(O[C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 916977271 OTCZHDVAXBBFBD-KSSFIOAISA-N 396.899 5.416 30 20 GKED CCCN(C(=S)Nc1ccccc1C#N)[C@@H](C)c1ccc(Cl)c(Cl)c1 918725519 FBIFXGFYGZAVQU-ZDUSSCGKSA-N 392.355 6.035 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCC[C@H]2c2cccc3ccccc23)c1=S 919951336 RNSHLHMDYSNTHV-NRFANRHFSA-N 390.556 5.425 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)[C@@H](C)Oc1ccc(Cl)cc1Cl 1776087183 MOXAPGBHSNQEJI-GFCCVEGCSA-N 381.259 5.255 30 20 GKED CC(C)c1cccc2c1OCC/C(=C\c1c[nH]c3ccc(C(=O)O)cc13)C2=O 1776378149 UNGSGLWZBGYPJB-GXDHUFHOSA-N 375.424 5.038 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2cccc(C(=O)O)c2)cc1OCC 1776814626 CDLPDYLGNIPKCS-CMDGGOBGSA-N 388.847 5.122 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)c4csc(C)c4C)cc3)CCC2)C1 1787563147 XFDDZBYXCHZXTJ-UHFFFAOYSA-N 394.540 5.079 30 20 GKED N#Cc1ccc(OCCSCc2ccc(C(=O)Nc3ccccc3)cc2)cc1 9852387 ZYLMPFHNOKYCOV-UHFFFAOYSA-N 388.492 5.123 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1 43714134 DSDQMRTXOATVJV-JOCHJYFZSA-N 389.886 5.143 30 20 GKED Cn1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c2ccccc21 68349042 PPEXZUOBCOBFFN-ZDUSSCGKSA-N 393.418 5.070 30 20 GKED CCN(C(=O)c1ccc(SC(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 105907803 PQFGNBFDSHIVSL-ZDUSSCGKSA-N 378.419 5.393 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](c1ccccc1)C1CCC1 108372872 UBPQPOYPICZTEZ-UZUQRXQVSA-N 393.556 5.150 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1C(=O)/C=C/c1cccc(OCCCC#N)c1 110394843 QFSYMSDXVIPURX-BUHFOSPRSA-N 385.467 5.068 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1sc(-c2ccccc2)cc1C#N 121819618 NZUWGESDQOOXIL-UHFFFAOYSA-N 389.436 5.024 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ncc(C(C)(C)C)o1 130318874 FAWJLTWPANFEKJ-ZDUSSCGKSA-N 389.546 5.097 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)[C@@H]1CCC[C@H](C(F)(F)F)C1 130987385 PMUBXWYWCHVAAP-MBNYWOFBSA-N 385.323 5.304 30 20 GKED CSc1ccc(NC(=O)c2cn(CCC#N)nc2-c2ccc(C)c(C)c2)cc1 149995040 YMYOTNLLEGVUNK-UHFFFAOYSA-N 390.512 5.055 30 20 GKED C[C@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)Sc1ccccc1 173122347 JUMYOBIQFGBJHT-HZPDHXFCSA-N 385.558 5.383 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C#N)cc2F)ccc1OCc1ccccc1 178782952 GIDNFPXHACZWDA-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#C[C@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1cnc2ccccc2n1 190893960 JRNRJYPWIBZDTO-FQEVSTJZSA-N 395.487 5.412 30 20 GKED CCCCC1CCC(C(=O)Nc2ccc(CNCc3ccc(C#N)o3)cc2)CC1 236828744 MBBOOYNDDYEQII-UHFFFAOYSA-N 393.531 5.376 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccc([S@@](C)=O)cc1 276396812 JRRJAWIQECUUOY-CHAGWJKLSA-N 384.545 5.159 30 20 GKED C[C@H](Nc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1)c1ccc(-c2ccncc2)cc1 301418624 DCFAUHLYSSFLDZ-HNNXBMFYSA-N 395.422 5.250 30 20 GKED Cc1ccc(CN(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)o1 303658705 MJVQFGHPECKCTJ-UHFFFAOYSA-N 380.831 5.178 30 20 GKED C=CCC[C@@H](C(=O)NCCc1nc2ccccc2n1C(C)C)c1ccccc1 427454824 DXWQBIUCTZMORK-HXUWFJFHSA-N 375.516 5.026 30 20 GKED Cc1c(CNC(=O)N[C@@H](CCCC#N)c2ccccc2)oc2ccc(F)cc12 431874629 ZWXGOBGFQGNOHU-IBGZPJMESA-N 379.435 5.115 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3c(Cl)cncc3Cl)c2)c1 431989384 AGMYNFIOHPEWBC-UHFFFAOYSA-N 398.249 5.091 30 20 GKED COc1cc(C)ccc1Oc1ccc(NC(=O)c2cscc2C#N)cc1F 432402906 QTSNEONKDMTTKA-UHFFFAOYSA-N 382.416 5.121 30 20 GKED CC(C)c1ccc([C@H]2CCCN2Cc2cn(CCC#N)nc2-c2ccncc2)cc1 435136226 ZPEIRHFRQNDHAU-XMMPIXPASA-N 399.542 5.319 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)c1 436464612 FPVFLFPWWGGZMK-JOCHJYFZSA-N 396.918 5.515 30 20 GKED C[C@@H](C#N)N(C)C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 436724030 MUXRBQKFSMIKME-ZDUSSCGKSA-N 384.888 5.363 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)N[C@H](CCC#N)c2ccccc2)cc1 438836104 FBGFRESRRJFPSJ-DYESRHJHSA-N 381.545 5.592 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c(Cl)c1 444810577 FLJFENXUKKWLLF-HNNXBMFYSA-N 377.168 5.397 30 20 GKED C[C@H](C(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1)c1cccc(C#N)c1 462452401 QFMRKDLBHTUIDM-KXBFYZLASA-N 386.417 5.087 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464463763 FXOXBWJBKRWJSF-MAUKXSAKSA-N 397.400 5.196 30 20 GKED C[C@H](CCC1CC1)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 469446154 LIHBIJBTODSHKI-QGZVFWFLSA-N 377.488 5.032 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 474407641 JAAICZCJFXKAPV-QGZVFWFLSA-N 389.480 5.026 30 20 GKED Cc1ccc(-n2c(SCCCSCC#N)nnc2-c2ccc(F)cc2)cc1 489619184 AHNFCDXZVOUJDC-UHFFFAOYSA-N 398.532 5.121 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cn2)c1 494513892 MLCBDDJVWFPKSE-UHFFFAOYSA-N 395.871 5.395 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COc2ccsc2)cc1Cl 503990916 CVJGLGNKQVGOOI-SFHVURJKSA-N 382.872 5.074 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)c2ccc(OCc3ccccc3C#N)cc2)C1 504937912 XRBKWOAIYNOBCB-QFIPXVFZSA-N 396.490 5.075 30 20 GKED CCSc1ccc([C@H](C)NC(=O)Nc2cc(C#N)ccc2OC(F)F)cc1 509932525 YDJWIHFELUXQCQ-LBPRGKRZSA-N 391.443 5.154 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1CCCc2occc21 510715149 IJEKKNCRQOQCCH-OAQYLSRUSA-N 387.439 5.451 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1sc2c(c1C#N)CCC2 511911007 NVIPYGACTXCRHT-UHFFFAOYSA-N 399.928 5.446 30 20 GKED CCCOc1ccc(CN(CCC)C(=O)C2(C#N)CCCCC2)cc1OCC 512977789 RWVODJMVXVXYTR-UHFFFAOYSA-N 386.536 5.087 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1 514502888 PTIDAZNMQZRCST-UHFFFAOYSA-N 399.466 5.232 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c(F)c1 516399216 GJGCGUQJVVBPDT-UHFFFAOYSA-N 396.805 5.404 30 20 GKED Cc1ccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 518681652 DILWQFVRKHJYTR-QGZVFWFLSA-N 381.545 5.346 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc4[nH]ccc34)cc2F)c1 530622926 VMTPFRQPIHZBCQ-UHFFFAOYSA-N 385.398 5.010 30 20 GKED N#CCCCOc1cccc(CNc2ccc(-c3cn4ccccc4n3)cc2)c1 533211927 ZVHLDJLVVPARKQ-UHFFFAOYSA-N 382.467 5.296 30 20 GKED Cc1ccccc1NC(=O)C[C@@H](C)NCc1ccc(-c2ccccc2C#N)cc1 540314588 QLFOFYMDWVXBHL-LJQANCHMSA-N 383.495 5.041 30 20 GKED CN(Cc1ccccc1)C1CCC(N[C@@H](CCCC#N)c2ccccc2)CC1 551207000 YVURTYKVSRZSGU-STEQJIOHSA-N 375.560 5.454 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 551699797 MYZXKMJDDRQMKY-UHFFFAOYSA-N 397.390 5.060 30 20 GKED Cc1cc(Br)c(C(=O)N(CCC#N)c2ccc(F)cc2)cc1Cl 552951103 VHXSZQSVJZTDSI-UHFFFAOYSA-N 395.659 5.111 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@H](C#N)CCC 562389002 XIXSLHFWQCVNFD-NSHDSACASA-N 380.275 5.023 30 20 GKED N#CCCC1CCN(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)CC1 567466912 IMHIPTWGIQKCME-IBGZPJMESA-N 387.936 5.216 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Oc3ccccc3)cn2)s1 584568617 BGRUKTMLTZMCNF-INIZCTEOSA-N 377.469 5.118 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(c1ccc(C#N)cc1)C1CCC1 598884528 GREVBVNOYDQQHK-UHFFFAOYSA-N 395.528 5.112 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c(C)s1 603690192 YQZHAEYHEIKAOC-CQSZACIVSA-N 392.484 5.307 30 20 GKED CC(C)CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)C1CCCC1 603955447 XLPWCCCJTJLLSA-UHFFFAOYSA-N 380.488 5.161 30 20 GKED CCSc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 609436257 HKFFWVVZIQDYKO-CVEARBPZSA-N 399.585 6.076 30 20 GKED Cc1ccc(CCNC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 609712131 GHQYTKROCVDVDU-UHFFFAOYSA-N 399.494 5.118 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@@H](C)c1ccccc1C(F)(F)F 610226095 FQEPVDXBFUYCLU-ZDUSSCGKSA-N 376.378 5.106 30 20 GKED CN(C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccc(C#N)cc1F 610227142 AFUXGJGRHRXRSG-UHFFFAOYSA-N 384.332 5.058 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H]3CCC(F)(F)C3)cc2Cl)cc1 610791993 UYCNVOLISZYAQA-AWEZNQCLSA-N 391.805 5.313 30 20 GKED C[C@]1(C#N)CCCN(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 612377682 RXDHXCJKMOQRSY-FUHWJXTLSA-N 399.844 5.145 30 20 GKED C=CCN(C(=O)CCSc1ccccc1)c1nc(-c2ccccc2)cs1 641900789 SXFZCAPLAPBVNP-UHFFFAOYSA-N 380.538 5.512 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)C1 661379022 QUGUODQLQJUZDZ-IBGZPJMESA-N 383.561 5.233 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@@H]1CC[C@@H](C(F)(F)F)C1 671817372 HEQRHMPWBYSQBD-PSASIEDQSA-N 375.259 5.258 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCC[C@@H]1c1ccccc1OC 682777344 MQCFKDCTULIXBA-JOCHJYFZSA-N 392.543 6.306 30 20 GKED CCCCCCCCC/C=C\C(=O)N1CCC(C(=O)N2CCC[C@H](C)C2)CC1 727756168 RKACQHLDCZSEMY-SZRHCGQDSA-N 390.612 5.180 30 20 GKED O=C(/C=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccc(O)c(F)c1 728439302 ZJBHFRCSJXZVEE-SOFGYWHQSA-N 393.361 5.570 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@H](c1ccccc1)C(C)C 728766663 FLAXDBWTOODIMQ-FCHUYYIVSA-N 390.527 5.289 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1 730983027 YQRGSVYLNCILBT-UHFFFAOYSA-N 397.500 5.292 30 20 GKED O=C1/C(=C/c2nccn2Cc2ccccc2)CCc2nc(-c3ccccc3)sc21 734095160 LQXZLNUUQIPZCA-XDJHFCHBSA-N 397.503 5.267 30 20 GKED CCCCSCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 740534054 BNOZIXJFMQDRKS-HNNXBMFYSA-N 378.950 5.563 30 20 GKED CC(C)(C)c1ncc(/C=C2\COc3c(F)cc(Br)cc3C2=O)s1 741471335 ZFJKXLSYJSBKOO-RUDMXATFSA-N 396.281 5.001 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)ccc1OC(F)F 741474748 ZDZDAZYNKRLXAD-ALCCZGGFSA-N 381.378 5.255 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CC(C)(C)c2ccccc2)cc1 743447789 SWMLBEIVJNYPDT-LAUBAEHRSA-N 376.500 5.215 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N2CCCCC[C@@H]2c2ccc(Cl)cc2)c1 745893126 NRJLUTYERNUDPC-HXUWFJFHSA-N 385.870 5.178 30 20 GKED C=CCn1c(SCc2cscn2)nc2sc(-c3ccccc3)cc2c1=O 748218852 HCCOZZHEDUKWLH-UHFFFAOYSA-N 397.550 5.060 30 20 GKED COc1cc(/C=C/C(=O)c2c[nH]c3ccccc23)ccc1OCC(F)(F)F 750904890 IYXFGZFXBUOCIY-SOFGYWHQSA-N 375.346 5.014 30 20 GKED Cc1ncsc1C(=O)/C=C\c1nc(-c2cc(Cl)ccc2Cl)cs1 753901042 SYVHEXBFQQVFAA-PLNGDYQASA-N 381.309 5.778 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1ccc2ccccc2n1 760963789 OIUVHQKTOBLSBH-QGZVFWFLSA-N 376.406 5.201 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1CCCc1ccccc1 780671741 UDOBBCKWFGQVAW-PZJWPPBQSA-N 391.515 5.387 30 20 GKED CC[C@@H](NC(=O)[C@@H](C#N)C(=O)c1cc2c(Cl)cccc2s1)c1ccccc1 787044185 FTMJDEAAIWIQBR-DOTOQJQBSA-N 396.899 5.145 30 20 GKED COc1cccc(O)c1C=Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 788319656 WBODLCDLMSBBKT-UHFFFAOYSA-N 390.226 5.041 30 20 GKED Cc1c(Br)ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c1F 788334149 QMZVWWPKBBFQPQ-UHFFFAOYSA-N 398.688 5.231 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCC[C@@](C)(CC)C1OCCO1 789450311 NPNZFDSEERVNOR-HSZRJFAPSA-N 388.552 5.229 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(C)(c2ccc(Cl)cc2)CC1)c1ccncc1 792091953 KYDCQVYFWWLBBZ-HXUWFJFHSA-N 383.923 5.116 30 20 GKED CC(C)COc1ccc(C2(C(=O)[C@H](C#N)c3nccc4ccccc34)CCC2)cc1 792104459 XPYXZDLZXGRHLV-HSZRJFAPSA-N 398.506 5.568 30 20 GKED N#Cc1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)cc1 796472841 YLDBEELXMTVKRL-KRWDZBQOSA-N 378.690 5.241 30 20 GKED N#C[C@H](C(=O)C1CC(c2ccc(F)cc2)C1)c1nc(-c2ccccc2)cs1 796757282 VDMWAEVFSNOVGH-FAFZWHIHSA-N 376.456 5.319 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3ccc(SC)s3)cc2c1C 798232002 NGFQLWPBEPXLMR-XQRVVYSFSA-N 389.523 5.071 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3cnn(C4CCCC4)c3)cs2)cc1 799896419 HKZAKOGIUMUDEY-DHZHZOJOSA-N 379.485 5.026 30 20 GKED N#CC1(CCCOC(=O)C2(c3cccc(Cl)c3)CCCCC2)CCOCC1 800126720 DJMYHZYFUOFHOZ-UHFFFAOYSA-N 389.923 5.186 30 20 GKED Cn1cc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)c(C(F)F)n1 812240969 YSMHATSVWWCIKV-PTNGSMBKSA-N 395.434 5.391 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c2C#N)[C@H](C)C1 839389784 SRZHCCAUOMXAKE-JGVFFNPUSA-N 398.290 5.399 30 20 GKED Cc1cnc([C@@H](C)OC(=O)c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)o1 850225307 BKJFCHVRQVLZNG-SECBINFHSA-N 399.262 5.190 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3ccc(Cl)s3)c2)cc1 916135673 FWLHYKBMRMOBJK-YHYXMXQVSA-N 397.883 5.559 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2cccc(NC(C)=O)c2)cc1OCC 916137838 FQQWHPSRDIWSFD-BENRWUELSA-N 381.472 5.119 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2cccc(NC(C)=O)c2)cc1OCC 916137839 FQQWHPSRDIWSFD-ZRDIBKRKSA-N 381.472 5.119 30 20 GKED Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)[C@@H](C#N)c1nc2ccccc2s1 916847414 GTPDPBCOGZUKRM-NVXWUHKLSA-N 378.497 5.372 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2)CCC1)c1nc2cc(Cl)ccc2s1 917045899 CFXRRBTWACISRU-HNNXBMFYSA-N 384.863 5.387 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccn2Cc2cccs2)cc1 918322616 HSSMMSJZJDWKBV-JOCHJYFZSA-N 397.503 5.506 30 20 GKED Cc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1C 920804434 QMYQQKQPAQZIDR-OAHLLOKOSA-N 382.435 5.124 30 20 GKED C/C(=C/C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 921279320 SMQAGGDSZIPGPN-PIFJCSEESA-N 397.334 5.255 30 20 GKED CCCCCCCOc1ccc(C=NNc2ccc(Cl)c(C(=O)O)c2)cc1 1776033352 NUIWCUWGLSRPIZ-UHFFFAOYSA-N 388.895 5.833 30 20 GKED Cc1c(/C=C2\Oc3c(cccc3C(C)(C)C)C2=O)nc2ccccc2c1C(=O)O 1776113945 CRVYPQAFGQMBDK-UNOMPAQXSA-N 387.435 5.155 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1[N+](=O)[O-] 1776116391 YYNSWDIEIYFFCX-ACAGNQJTSA-N 387.391 5.165 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1)C(=O)O 1776469766 HJSRAKAWMYOSHJ-WXLQGSQKSA-N 399.657 5.395 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C\c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777456000 VZQVMWFAUFLERM-QIWJOQEQSA-N 398.458 5.656 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)c(C)c1 5406970 RHHQDRDMXIJQSR-IBGZPJMESA-N 384.479 5.557 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cccc(Cl)c2)nnc1-c1ccccc1 9447381 XHVRSQDXQMGCFB-CQSZACIVSA-N 383.904 5.148 30 20 GKED N#CCc1ccc(NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)cc1 16495989 GGPQITZNDUDJIM-UHFFFAOYSA-N 397.453 5.611 30 20 GKED CCOC(=O)Cc1csc(SCc2ccc(-c3ccccc3C#N)cc2)n1 23453069 IUQLBGHDLADYSE-UHFFFAOYSA-N 394.521 5.080 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OCC)c(OCC)c1 60451309 BWONNXJAUHOUEZ-UHFFFAOYSA-N 379.909 5.027 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(OCC(F)(F)F)cc1 63845860 XDCGZNQZYAEHDB-RMKNXTFCSA-N 390.386 5.042 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1nc2ccccc2s1 66954588 GVRJBZKOHDBHBO-AWEZNQCLSA-N 396.541 5.354 30 20 GKED Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 108360411 RUGFNVDYWHRUGR-GHTZIAJQSA-N 393.556 5.165 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 108408464 ZGPQWKGDYOFPBG-SJLPKXTDSA-N 395.572 5.809 30 20 GKED COc1ccccc1[C@H](NCc1cccc(OCCCC#N)c1)c1ccccc1 108421441 YGEJRPWFVRDING-RUZDIDTESA-N 386.495 5.257 30 20 GKED C=CCOc1cccc(CNc2cccc(C[S@](=O)Cc3ccccc3)c2)c1 133164070 JHRRKRKBIXDXCG-NDEPHWFRSA-N 391.536 5.312 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1cccc(SCC#N)c1 153819435 FQKJUHJEKHXSAZ-QGZVFWFLSA-N 379.529 5.242 30 20 GKED C[C@H](N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1ccc(C#N)cc1 154345237 SCTSXTBIGVQOFC-LIRRHRJNSA-N 377.488 5.549 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](OC(C)(C)C)c1ccccc1 156695123 FLXCTXGYQLEBTO-OXJNMPFZSA-N 382.529 5.433 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccccc1SCC(F)(F)F)c1ccccc1 160051022 ZOFVBHQSVKJTDK-OAHLLOKOSA-N 393.434 5.508 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1csc2ccccc12 171740703 QSQGXJIEFVHAPT-HNNXBMFYSA-N 395.553 5.817 30 20 GKED N#C[C@H](C(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1nc2ccccc2o1 178257532 YRIJDDZVGIAKEE-CKXDQPNJSA-N 390.748 5.303 30 20 GKED CN(C(=O)c1oc2ccccc2c1COc1ccccc1Cl)C1(C#N)CCC1 181594814 RPMBYSZAKJDFQE-UHFFFAOYSA-N 394.858 5.183 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 185834934 ZOAQOZIXWLRCKD-ZWKOTPCHSA-N 391.487 5.066 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccoc1Br 193458860 BTTDWAJAEVBFPE-UHFFFAOYSA-N 397.228 5.267 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc(Cl)cc3)n2)cc1 198043882 WXEKFLQJKPPKOO-NHOBBCMMSA-N 394.883 5.362 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 303591670 HWSOHFQRZMGXAH-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1ccccc1-n1c(S[C@H](C)c2ccc(C#N)cc2)nnc1-c1cccnc1 303653656 BUGPCGUFBKAAIQ-QGZVFWFLSA-N 397.507 5.363 30 20 GKED OC(=Nc1ccccc1O)C1CCN(/C(O)=N/[C@H]2CCCCC23CCCC3)CC1 329797386 HGMCGKVNDCKFHJ-FQEVSTJZSA-N 399.535 5.109 30 20 GKED CSc1cccc(C)c1N/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329928297 MFBBAYWCMAYZHK-QGZVFWFLSA-N 384.549 5.432 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCC1CCC(F)(F)CC1 419598140 BXKMRBXEBMTRHC-CQSZACIVSA-N 398.544 5.436 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(-c4cc[nH]n4)s3)c2)cc1 431618431 QEWGLOUKIJTHEF-UHFFFAOYSA-N 386.436 5.054 30 20 GKED N#CCCC[C@@H](NCc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1 433019199 IQQYGZURFBFOJR-XMMPIXPASA-N 383.495 5.464 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 435675277 UXYQPHMIVQBEKL-LJQANCHMSA-N 381.501 5.100 30 20 GKED Fc1ccc(F)c(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436406547 IKYSGGXIWFHWGV-OAHLLOKOSA-N 383.282 5.767 30 20 GKED CC(C)COc1ccccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 437825037 WAUBSTSKUIGSEI-CTNGQTDRSA-N 377.488 5.025 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438638887 ZOEBCDBCFWMYLC-GFCCVEGCSA-N 387.361 5.548 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=O)N[C@@H](CCC#N)c1ccccc1 438838189 SACIRHFXBZETTC-SFHVURJKSA-N 376.287 5.180 30 20 GKED Cc1cc(CCCC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)c(C)s1 439798495 YQRMYASMHKFXAJ-UHFFFAOYSA-N 394.462 5.150 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1ccc(O)cc1)c1ccc(C(F)(F)F)cc1 442303896 XWRKDDUFPYYJOT-IBGZPJMESA-N 392.421 5.260 30 20 GKED C[C@H](Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)c1cccc(C#N)c1 442782634 LNBWBIWJHBFRAU-SFHVURJKSA-N 379.467 5.038 30 20 GKED C=C(C)Cn1c(C2CCC2)nnc1N1CCC[C@@H]1c1nc2ccccc2s1 460390708 WSTBMHQWMBGUTM-QGZVFWFLSA-N 379.533 5.073 30 20 GKED Cc1cc(C)c(Br)c(C(=O)Nc2sc3c(c2C#N)CCCC3)c1 460769233 HJMRWVOAJJIROZ-UHFFFAOYSA-N 389.318 5.130 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccc(C#N)cc2F)cc1 462652343 FDJSRXFAHFNOQC-UHFFFAOYSA-N 394.833 5.206 30 20 GKED CC(C)c1cccc2sc(N(Cc3ccccc3)C(=O)CCCC#N)nc12 463149079 VECXYCBRPBOUPW-UHFFFAOYSA-N 377.513 5.647 30 20 GKED C=CC1CCN(C(=O)N[C@H](c2ccccc2Cl)c2ccccc2OC)CC1 466083396 WJTGCPWPOYCBQD-OAQYLSRUSA-N 384.907 5.046 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)C[C@@H](CC#N)c2ccccc2)s1 475253758 FECRRUAROUBVGG-LJQANCHMSA-N 378.497 5.266 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(CSc3ccccn3)c2)cc1 475438644 HPMHEQPZYZILME-UHFFFAOYSA-N 387.508 5.427 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)N1CCc2sccc2C1 475547869 MOXBOVMJSOXKOB-QGZVFWFLSA-N 397.588 5.168 30 20 GKED CCCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CC(C)(C)NC(C)(C)C1 475662945 SBAWFCGFBUOQOT-UHFFFAOYSA-N 383.580 5.039 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC[C@@H]1c1ccccc1OC)c1ccc(F)c(F)c1 477738830 AUMTYZULXBXNNF-TZIWHRDSSA-N 386.442 5.137 30 20 GKED Cc1cc2n[nH]cc2cc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 481323070 SWCNFPPFXSZRKE-UHFFFAOYSA-N 384.464 5.147 30 20 GKED CCCn1c(C)c(C(=O)[C@H](C#N)c2nccc3ccccc23)c2cc(OC)ccc21 483213266 ANDNWQDTFVHKOG-OAQYLSRUSA-N 397.478 5.407 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@H]1CCC(F)(F)C1 483475527 OHIREGVXQOCVOP-JTQLQIEISA-N 378.366 5.085 30 20 GKED C[C@@H](C(=O)Nc1ccccc1NCc1ccc(Cl)cc1)c1cccc(C#N)c1 487165358 QTVVIAUVPWGLDF-MRXNPFEDSA-N 389.886 5.566 30 20 GKED C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)N[C@H](CCCC#N)c1ccccc1 487214969 AKIRTKWGYPWJGC-CRAIPNDOSA-N 390.405 5.024 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)ccn1C(C)C 497445489 SHAQNSYCKOUUAD-CQSZACIVSA-N 385.439 5.269 30 20 GKED C=CCc1cc(CNC(C)(C)c2ccc(OCC(C)C)cc2)cc(OC)c1O 500897215 NKJYJVSSPSQPMV-UHFFFAOYSA-N 383.532 5.189 30 20 GKED C=CCOc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 503247121 RCWRWRMYPDUWGR-QHCPKHFHSA-N 378.903 5.373 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1cc2ccccc2s1 504470599 XMVOAUAMWWXUCV-HNNXBMFYSA-N 395.484 5.268 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 509538833 JBTBQEFJPYIACD-UHFFFAOYSA-N 389.842 5.025 30 20 GKED Cc1cc(OC(F)F)c(C(=O)Nc2sc3c(c2C#N)CCCCC3)s1 510206022 AFHBGDLOQKTTKM-UHFFFAOYSA-N 382.457 5.112 30 20 GKED C[C@@H]1CCC[C@@H](CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 510610402 XNQCJJTYFAUKBE-UYAOXDASSA-N 391.515 5.279 30 20 GKED CCCOc1ccc(CNCc2cccc(OCc3cccc(C#N)c3)c2)cc1 512840086 MNHQKBFGJQPHMK-UHFFFAOYSA-N 386.495 5.216 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(COc3ccc(C#N)cc3)o2)s1 513325015 DXGUGVUBIHRRGD-IBGZPJMESA-N 392.480 5.078 30 20 GKED C[C@@H](CCc1ccccc1)SCC(=O)Nc1ccccc1S[C@H](C)CC#N 518655259 HOSMZEIBAVDIPU-ZWKOTPCHSA-N 398.597 5.774 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1[nH]c2ccc(F)cc2c1Cl 518743045 JWMPQVHUVUJEJP-NSHDSACASA-N 387.867 5.607 30 20 GKED COc1ccc([C@@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 521955438 GQUGHPJJVULJRF-QGZVFWFLSA-N 386.451 5.045 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)CCCCC1 524329618 STNANSSHYOWDIG-UHFFFAOYSA-N 389.430 5.579 30 20 GKED C=CCN(C(=O)C[C@H]1CCOc2ccccc21)c1nc(-c2ccccc2)cs1 524553095 DVPBPSVVTZJMDV-GOSISDBHSA-N 390.508 5.286 30 20 GKED C[C@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccc(F)c(F)c1 525145870 UVFZRIKSKLWJAA-LBPRGKRZSA-N 394.446 5.406 30 20 GKED C=CCN(C(=O)c1sc2ncccc2c1Cl)c1nc2c(s1)CCCC2 528727532 ULGWBXNGBCEHKL-UHFFFAOYSA-N 389.933 5.118 30 20 GKED CC1CC(C#N)(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)C1 531563757 MLEPWLVUPBNNRD-UHFFFAOYSA-N 388.389 5.163 30 20 GKED N#Cc1cccc(-c2nnc(CNC3(c4ccc(Cl)cc4)CCCCC3)o2)c1 532688908 LNFSNHAAOQMFCC-UHFFFAOYSA-N 392.890 5.211 30 20 GKED CC[C@H]1CC[C@@H](C)N1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 539030882 OTMADRSJCSYFBU-UTKZUKDTSA-N 377.488 5.126 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)s2)c2ccccc2Cl)c(C)c1 539513228 QVMGDPJUJLZEKZ-OAQYLSRUSA-N 382.916 5.469 30 20 GKED C=CCC(C)(C)c1noc([C@H]2CCCN2C(=O)c2ccc(Cl)c(Cl)c2)n1 551142316 AAOHMOULPHRDMF-OAHLLOKOSA-N 394.302 5.207 30 20 GKED N#CCc1ccc(OC[C@@H](O)CSC(c2ccccc2)c2ccccc2)cc1 551958227 NQOORRYNLQJDSN-JOCHJYFZSA-N 389.520 5.015 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NCc3cc4ccccc4[nH]3)cc2)c1 561409197 XWNYOLHOFUUPIA-UHFFFAOYSA-N 382.423 5.154 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)C(C)(C)C)cc1 572075292 NKZBGJXLMNWUGK-IAGOWNOFSA-N 383.454 5.357 30 20 GKED CCc1cc(C#N)c(NC(=O)c2cc(Cl)c(C)cc2Br)s1 572915475 WBGGDOIXOAJAMG-UHFFFAOYSA-N 383.698 5.159 30 20 GKED CC(C)c1nccn1Cc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 581913666 URTUERGZFPPNQR-UHFFFAOYSA-N 398.432 5.557 30 20 GKED Cc1cc(NC(=O)CCCCCC#N)n(-c2cc(C(F)(F)F)ccc2Cl)n1 588341543 AMEOHXRJIBBHNH-UHFFFAOYSA-N 398.816 5.266 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NCc1cc(C(F)(F)F)ccc1Br 589317500 PCCLGSDFSULRSQ-QGZVFWFLSA-N 395.222 5.117 30 20 GKED FC(F)(F)Cn1ccnc1COc1cc(C(F)(F)F)cc(C(F)(F)F)c1 589971757 RNIMRZDLTJMKIA-UHFFFAOYSA-N 392.221 5.062 30 20 GKED N#CCCC[C@H](N[C@@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598678980 CAFYWMHSIZTLSW-ROUUACIJSA-N 393.275 5.780 30 20 GKED Cc1noc(-c2ccc(C)c(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 603987688 PGIJEJFUFNEBDT-UHFFFAOYSA-N 394.434 5.144 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1cc(C)nc2ccccc12 605076780 BGEAKWMKGWZDMP-UHFFFAOYSA-N 386.524 5.204 30 20 GKED COCc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccccc12 609377119 PDUXNWBZXORUPW-AWEZNQCLSA-N 380.469 5.083 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(Cc2ccc3ccccc3c2)C2CC2)c1 609500232 XHPGKGUQXURBDQ-UHFFFAOYSA-N 398.506 5.452 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H]3c3cccs3)c2)cc1 609641067 LCVVSUCZQJOXOS-NRFANRHFSA-N 388.492 5.176 30 20 GKED CC[C@@H](CC(=O)N[C@@H](C#N)c1ccc(Br)cc1)c1ccc(C)cc1 609986494 ZHEOWEWVUWGELF-KXBFYZLASA-N 385.305 5.022 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1 611394003 XIXAUZNKUZASCS-XMMPIXPASA-N 399.469 5.117 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)n1C(C)C 613319127 PUCPXRYTMNNLPT-GOSISDBHSA-N 397.931 5.953 30 20 GKED O=C(Nc1cc(Cl)ccc1F)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618538321 IZCRCOVAFAMOIC-YUMQZZPRSA-N 392.702 5.074 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2c2ccccc2Br)cc1 619439267 LASOLJRAIFLKHQ-IBGZPJMESA-N 397.316 5.228 30 20 GKED CC(C)(C)c1nc2cc(NC(=S)Nc3ccc(C#N)c(Cl)c3)ccc2o1 726459114 GBMHBCDKPGKDSQ-UHFFFAOYSA-N 384.892 5.459 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C1\CCc2cc(SC(F)F)ccc2C1=O 728439950 HXWUYJLUKBSRFK-VQHVLOKHSA-N 389.254 5.254 30 20 GKED N#CCOc1cccc(/C=C(/C(=O)c2nc3ccccc3s2)c2ccccc2)c1 730151944 VCUDFULNILFYED-CAPFRKAQSA-N 396.471 5.622 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2s1 730685032 GCEYJJULWMNCDR-RISCZKNCSA-N 389.307 5.658 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C\c1cn(-c3ccccc3)nc1-c1cccnc1)C2 730949680 ZOSXCLRRZFRGCV-ZHZULCJRSA-N 377.447 5.065 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(Cl)c(Cl)c1 731319814 HTTNQPOTEQGZJN-NSHDSACASA-N 396.368 6.197 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 732418345 QLYMYNHCRZBIDG-HSZRJFAPSA-N 397.478 5.229 30 20 GKED C[C@H](N[C@@H](C)c1csc2ccccc12)C(=O)Nc1sc2c(c1C#N)CCC2 732919091 YVRKSHUDQIFZLV-STQMWFEESA-N 395.553 5.001 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 739155790 VRQLMUDAMGOPQQ-VGSWGCGISA-N 390.527 5.215 30 20 GKED C/C(=C\C(=O)Nc1ccccc1SCCC#N)c1ccccc1C(F)(F)F 741924598 HCVIITBJONEULY-BUHFOSPRSA-N 390.430 5.753 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1 744767124 YTZCOQIXYNAZMD-ZEAUABMBSA-N 385.511 5.384 30 20 GKED COc1ccc2cc([C@H](C)OC(=O)c3ccccc3SCC#N)ccc2c1 745955823 QTZFIDVHTWECCY-HNNXBMFYSA-N 377.465 5.382 30 20 GKED CCOc1ccc(C=Nc2ccc(N3CCc4sccc4C3)cc2)c(O)c1 748586606 XJWVAZFSGDEJGF-UHFFFAOYSA-N 378.497 5.166 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1cc(Cl)ccc1OCC#N 754360206 AGDFEOPVAKRVCT-HXUWFJFHSA-N 396.943 5.686 30 20 GKED C#CC[C@@H](NC(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 757017514 ZFHBFUSLKRNMNU-YLJYHZDGSA-N 389.524 5.243 30 20 GKED C=CCC(CC=C)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 759008945 VUSZHACKHUYSCJ-UHFFFAOYSA-N 398.528 5.256 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl 760797554 PZRWRKZGPOSZGH-LZCJLJQNSA-N 398.743 5.052 30 20 GKED N#Cc1cccc(OCCCSc2nn(-c3ccccc3)c(=S)s2)c1 763241287 DGCOOVLJTKMSKG-UHFFFAOYSA-N 385.539 5.096 30 20 GKED CC(C)(C)[C@@H]1C[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCO1 763931900 RULUYTOGQWFPNE-BDTNDASRSA-N 391.515 5.057 30 20 GKED C=C(C)Cn1c(-c2ccncc2)nn(CN(C2CCC(C)CC2)C2CC2)c1=S 764884369 JQXXAQXSIHXZIS-UHFFFAOYSA-N 397.592 5.053 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3cncc4ccccc34)c2)s1 765065014 XSJYTGXSLGERBJ-UHFFFAOYSA-N 397.503 5.084 30 20 GKED Cc1ccc(F)c(CN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 770177875 INFQAQXPGAHUTR-QFIPXVFZSA-N 387.458 5.454 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1C 770181597 WKHKFIMZNWKAKN-NRFANRHFSA-N 385.467 5.612 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CC3(CCCCC3)Oc3ccccc32)c1 772982219 GAPJTWQBJAFNEH-NZQKXSOJSA-N 390.527 5.684 30 20 GKED CCCCCCCCN(Cc1ccccc1)C(=O)Nc1cn(C)c(=O)cc1C 777600410 QIXRZFLQROAZBU-UHFFFAOYSA-N 383.536 5.088 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCCC(c1ccccc1)c1ccccc1 780016231 GBWDCJSDMRYKNU-LJQANCHMSA-N 399.494 5.321 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCCCC(C)(C)C#N 782677743 WALGXICSKNJWTP-UHFFFAOYSA-N 381.259 5.444 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCCSC(C)(C)C 783554815 UQRYWVAYGNTLPF-CQSZACIVSA-N 382.620 5.142 30 20 GKED C=C[C@](C)(CCOC)COC(=O)c1sc(-c2ccccc2)nc1C(F)F 784633043 FJIPYZZEBCTCNJ-LJQANCHMSA-N 381.444 5.133 30 20 GKED CC(CCc1cccc(C(F)(F)F)c1)=NNc1nnc(-c2ccccn2)s1 788028217 ZFMBXIMPHYDSBZ-UHFFFAOYSA-N 391.422 5.040 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 789423917 WGFQQJVVKNJNOO-KBXCAEBGSA-N 396.487 5.594 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCC(C)(C)c3ccccc32)ccc1OC 795803211 ODFMUZHXFGQDJX-NQIIRXRSSA-N 378.516 5.278 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 805164540 YUQYAZJKBLYKFF-UHFFFAOYSA-N 399.237 5.008 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 806207602 UJXYVTOADZBHLT-VGSWGCGISA-N 398.466 5.361 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1ccncc1 806822130 WVHMHAATIDVASU-FQEVSTJZSA-N 387.886 5.113 30 20 GKED CCc1cccc(Oc2cc(-c3noc(-c4ccccc4OCC#N)n3)ccn2)c1 809377675 LQVVRKAUXWNABF-UHFFFAOYSA-N 398.422 5.056 30 20 GKED O=C1/C(=C\c2csc(-c3cccc(Br)c3)n2)Cc2c(O)cccc21 810251487 ZBQHORDFHPKZKP-WQLSENKSSA-N 398.281 5.101 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)OC(=O)CCCC#N 813030467 LEQHSSIJHKCMRF-LBPRGKRZSA-N 393.306 5.179 30 20 GKED C=CCC[C@H](NCc1ccnc(Br)c1)c1ccc(C(F)(F)F)cc1 815085021 HZCLLBNRGVSDSV-INIZCTEOSA-N 399.254 5.660 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2nsc3ccc(C)cc23)cc1 815909970 MFTOTXBSBCANOM-RDTXWAMCSA-N 391.496 5.079 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)N(O)Cc3cccc4ccccc34)o2)cc1 901371992 ZVVHCTKDMCTBRH-UHFFFAOYSA-N 386.451 5.154 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccccc1F)c1nc(-c2ccc(Cl)cc2)cs1 916977034 HHDRKDQTKIONAX-JCVNQNCUSA-N 382.847 5.492 30 20 GKED CCCCCCCCOC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1 918494715 ZXEHEDKESQZRGC-UHFFFAOYSA-N 385.957 5.157 30 20 GKED CN(CCc1ccc(F)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919904664 RONYCIHPKTZTET-HSZRJFAPSA-N 387.458 5.188 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)ccc1Cl 1776033852 PTCHRCRLBAIHSO-CQSZACIVSA-N 396.796 5.793 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(C(F)(F)F)c1 1776355477 QQNNORVJCUDWPU-SOFGYWHQSA-N 378.346 5.087 30 20 GKED CCCCCCC[C@H](CC(=O)O)NC/C(C)=C/c1ccccc1OC(F)F 1776782362 LJDSEHMHJUIVSA-IYICPGQYSA-N 383.479 5.485 30 20 GKED CCCCCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2O)cc1 1776785925 RWCVSFMPZDGNNM-UKTHLTGXSA-N 382.456 5.336 30 20 GKED CCCCCCCOc1cccc(CN[C@H](c2ccccc2)[C@H](C)C(=O)O)c1 1776787304 ODIMZLOZQNFUAM-CVDCTZTESA-N 383.532 5.587 30 20 GKED C=CCc1ccc(OCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)c(OC)c1 5497681 SDVFOFUATRWCJD-UHFFFAOYSA-N 399.796 5.113 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 63388985 WLODCJMJDCGISV-UHFFFAOYSA-N 393.796 5.451 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 65680136 GZPQEYNOQLXHJK-UHFFFAOYSA-N 383.234 5.910 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 108407713 JDABZYICLCLCDI-IAGOWNOFSA-N 395.572 5.502 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2oc3c(Cl)cccc3c2C)cc1 111020652 HNNNUVONWFCODK-UHFFFAOYSA-N 382.847 5.354 30 20 GKED CC(C)c1cnc(S[C@H](C)C(=O)N(CCC#N)c2ccccc2)n1C(C)C 128933960 ZPHXZIZQMTVBGA-QGZVFWFLSA-N 384.549 5.015 30 20 GKED Cc1noc(C2CC2)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 129303778 OPISQINSVNDMGZ-UHFFFAOYSA-N 393.830 5.430 30 20 GKED CCSCc1cccc(NCc2cn(CCC#N)nc2-c2ccccc2)c1 151560672 UFYMSBDBXWXZHE-UHFFFAOYSA-N 376.529 5.329 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 153625921 ZAHKXTUCEJNBMK-CYBMUJFWSA-N 389.318 5.404 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1C 177605369 NYRSHCAFGPELSY-QGZVFWFLSA-N 397.425 5.084 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2C(=O)c2ccc(F)cc2)n1 177759282 QJOITMRFQYUNFD-SFHVURJKSA-N 392.455 5.127 30 20 GKED CC(C)CC[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 180026401 VZXBAFMLLSKYQI-FQEVSTJZSA-N 394.906 5.529 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1 183109634 FMILDCVDOKGCSW-SFHVURJKSA-N 398.462 5.246 30 20 GKED N#CCc1ccc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 237884128 JDXXZZIOIIPVFN-UHFFFAOYSA-N 377.375 5.204 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC)c1nnc2n1CCCCC2 276362547 AVBHNRIPPFPLJQ-IBGZPJMESA-N 395.551 5.129 30 20 GKED CCc1ccccc1OCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 301762855 NMZXYRPCHGFYIJ-QGZVFWFLSA-N 396.899 5.281 30 20 GKED C[C@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(Cl)cn1 328782073 UZKSJQQKBVUPNW-HOCLYGCPSA-N 386.927 5.259 30 20 GKED CCCS(=O)(=O)Nc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c1C 329015773 QGEOXXPGGKLVNY-RCCFBDPRSA-N 392.565 5.341 30 20 GKED CC(C)(C)c1csc(NC(=O)c2cc(F)ccc2Br)c1C#N 410923823 CQJLEOLVUUGCCW-UHFFFAOYSA-N 381.270 5.071 30 20 GKED Cc1cc(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)ccc1OCC(F)(F)F 425647694 FDSJMGDGCHDIPR-CQSZACIVSA-N 391.393 5.033 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1Cl 432707509 XUHRDTCGTCCDHY-IBGZPJMESA-N 385.895 5.684 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 435700723 KGLCISLJTHDDHL-ZDUSSCGKSA-N 379.847 5.539 30 20 GKED COc1ccccc1C[C@@H](C)N(Cc1ccccc1)C(=O)Nc1cccc(C#N)c1 437643773 CPIGRVHWGKLSDD-LJQANCHMSA-N 399.494 5.232 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3c[nH]nc3-c3ccsc3)n2)cc1 444456495 DXCHALRIYUQIOT-OAHLLOKOSA-N 390.493 5.060 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)CCCC1(C)C 444895329 JRIZWRMYGMBTAP-LJQANCHMSA-N 385.552 5.578 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc(C2CC2)nc2ccc(F)cc12 463147983 RWCONAWNOSTCCA-UHFFFAOYSA-N 389.430 5.162 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H](C#N)C(C)(C)C 464712324 PJDDJMHBUYCOEB-AWEZNQCLSA-N 394.302 5.269 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3cc(Cl)cc(Cl)c3)ccc21 468758342 ALZGHGUCSWGVGW-UHFFFAOYSA-N 388.298 5.188 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2cnn(C(C)C)c2c1 476624638 JDGDHXRHVSMEBQ-UHFFFAOYSA-N 389.503 5.179 30 20 GKED Cc1c([C@@H](C)N[C@@H]2CCCCc3cc(C#N)ccc32)cnn1-c1ccc(F)cc1 481659076 ILCKXILDERXCGQ-VOIUYBSRSA-N 388.490 5.310 30 20 GKED Cc1c([C@@H](NCc2cccc(OCCCC#N)c2)C(C)C)oc2ccccc12 482145703 YYALEPYRSNNUBB-QHCPKHFHSA-N 376.500 5.911 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 482339397 UWHGJLYWUDCGRY-IAGOWNOFSA-N 395.812 5.288 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 486241805 LSFUTEQFFRYXLT-UHFFFAOYSA-N 394.521 5.531 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2CCSCC2)cc1Cl 502314385 CZUSNEZNHCEBLM-IBGZPJMESA-N 399.947 5.260 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1ccccn1)c1ccccc1OC 505011073 PPYZKWRVUSWZAG-QHCPKHFHSA-N 387.483 5.120 30 20 GKED C=CCCc1ccccc1NC(=O)N(C)Cc1csc(Br)c1 505046746 YITFGJOJRYPNRS-UHFFFAOYSA-N 379.323 5.293 30 20 GKED N#C[C@H](NC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1ccccc1F 505955440 WSVBKAOPPKXMFI-SFTDATJTSA-N 376.456 5.040 30 20 GKED C[C@H](c1nc2cc(Cl)ccc2n1Cc1ccccc1)N1CCC(C)(C#N)CC1 506040686 DLGIUPWCBLFZBR-QGZVFWFLSA-N 392.934 5.425 30 20 GKED Cc1sc(NC(=O)c2cccc(COc3cccc(F)c3)c2)c(C#N)c1C 510198407 MMDFARWKBDCTBT-UHFFFAOYSA-N 380.444 5.207 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)CCCc1ccc(Br)s1 515871183 GUWOYFCDSVELIL-UHFFFAOYSA-N 396.325 5.187 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)Cc1ccsc1 516640412 QOVNSXYSNOXEEG-MRXNPFEDSA-N 391.496 5.473 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)[C@H]3CCCC[C@H]3C(F)(F)F)c2)cc1 517841306 KEFJVZBQZAXJDQ-RBUKOAKNSA-N 388.389 5.658 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519053016 UDMOUKPHADHKKP-HNNXBMFYSA-N 377.469 5.637 30 20 GKED CC(C)N(C(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 521535997 RCSCZOZJMAPELO-UHFFFAOYSA-N 385.467 5.204 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCCSc1ccccc1 521746490 KVFBRZPIOJPPGW-MRXNPFEDSA-N 385.558 5.242 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 521992381 CESURQIPCYVIHI-LRDDRELGSA-N 379.312 5.103 30 20 GKED CC(C)c1ccc(N(C(=O)c2ccc(C#N)cn2)c2nc3ccccc3s2)cc1 523653612 RYBBNGHSXBUNKW-UHFFFAOYSA-N 398.491 5.665 30 20 GKED CC[C@H](C)[C@H](C)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CC1 524487449 JNPRWEBNMWUSTM-ROUUACIJSA-N 376.500 5.176 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1OCC1CC1 524630251 BDBXUPLMJSOHIN-UHFFFAOYSA-N 377.488 5.037 30 20 GKED C=CCN(C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 525521123 HJOIQAXFGUWPGM-AEFFLSMTSA-N 396.462 5.411 30 20 GKED C=C(C)COc1cc(CNc2cccc(OCc3cccnc3)c2)ccc1OC 532890218 XEKIOFAXUKZAJO-UHFFFAOYSA-N 390.483 5.236 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3cccnc3)s2)sc2c1CCCCCC2 535624527 VRRGOYPYLRAUOW-UHFFFAOYSA-N 394.525 5.050 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 537511927 DPRLWWFGLAITBF-SIKLNZKXSA-N 393.487 5.066 30 20 GKED CC(C)C[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 540343861 NPMBTIGDCNOXRT-WIYYLYMNSA-N 395.572 5.396 30 20 GKED Cc1ccc(NCCCC2(C#N)CCOCC2)cc1OCc1cccc(Cl)c1 540809650 MQCZODDSOZFWRR-UHFFFAOYSA-N 398.934 5.740 30 20 GKED Cc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)c(-c2nc3ccccc3[nH]2)c1 541612994 KZLJTSBRTVRFMJ-UHFFFAOYSA-N 386.842 5.316 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 543304820 PMDZUJPEFFWKCP-PKOBYXMFSA-N 379.529 5.411 30 20 GKED Cc1oc(-c2cccs2)nc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543869982 LMCFWNFVTSVUIM-MRXNPFEDSA-N 399.519 6.101 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc(F)cc1 553944954 HYNHBVIFNUMPBJ-SJORKVTESA-N 377.246 5.183 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 554735840 YDYNODNZDMSGJI-BFUOFWGJSA-N 398.293 5.101 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccc(F)cc3)cc2)ccn1 555120344 RYSKZQMNWZFMKH-UHFFFAOYSA-N 398.397 5.132 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2OC(F)F)sc2ccc(C#N)cc12 556361425 OJBGVJNYKNTWIW-UHFFFAOYSA-N 376.359 5.074 30 20 GKED CC(C)c1ccoc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 559562119 JMIYGBIIHMWSPU-UHFFFAOYSA-N 378.403 5.245 30 20 GKED CCSc1cccc(F)c1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 566650621 VHZSVNBZXZKACU-AEFFLSMTSA-N 383.492 5.241 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 572535886 XHMODPFURUKPCT-QWRGUYRKSA-N 397.302 5.362 30 20 GKED CC(C)Oc1ccccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 576420325 ZLKOIVSTHXABJT-QGZVFWFLSA-N 396.899 5.741 30 20 GKED Fc1cccc([C@H](NCc2ccccc2OCC(F)(F)F)C(F)(F)F)c1F 577417065 ZDRRVKRWJSJYTD-HNNXBMFYSA-N 399.281 5.299 30 20 GKED COc1ccc(N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1Cl 580211579 AHZJJRSPBRTUOM-ZDUSSCGKSA-N 389.908 5.269 30 20 GKED C[C@@H](N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccc(C#N)cc1 584861780 KYLCEVHFQKVTEI-XCLFUZPHSA-N 394.316 5.530 30 20 GKED COc1ccc2nc(N(Cc3ccccc3)C(=O)CCCCCC#N)sc2c1 588821094 SZKXNELKRSJUCR-UHFFFAOYSA-N 393.512 5.312 30 20 GKED N#C[C@H](C(=O)c1cnc2ccccc2c1C(F)(F)F)c1ccc2ccccc2n1 591862010 INRVKHQYLOREOK-HNNXBMFYSA-N 391.352 5.292 30 20 GKED CC(C)CCOc1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c(F)c1 594419266 WBQUGXRLUUNOQR-UHFFFAOYSA-N 395.261 5.681 30 20 GKED Cc1cc([C@H](NC(=O)N2CCC[C@H](CC#N)C2)c2ccccc2Cl)ccc1F 596398633 QWVOCBKFVZLJKZ-IERDGZPVSA-N 399.897 5.212 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(O[C@H]2CC2(F)F)cc1)c1ccccc1 597115722 CAYDRCWTQGFFIC-MOPGFXCFSA-N 385.414 5.030 30 20 GKED C[C@@H]1CCCC[C@@H]1CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 604441509 HUOHUGPAAZSQRW-UYAOXDASSA-N 376.500 5.487 30 20 GKED C=CCCCCCN(C)C(=O)c1cc(C)nc2ccc(Br)cc12 606814677 QKAUIEPDBWSDHV-UHFFFAOYSA-N 375.310 5.124 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccc4c5c(cccc35)CC4)o2)cc1 609055999 YXKVZSOXSDYKKK-UHFFFAOYSA-N 394.430 5.234 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)c1cccc(C#N)c1)C1CCCC1 609065007 WZWUVMJXSWMFEN-UHFFFAOYSA-N 384.479 5.305 30 20 GKED N#Cc1ccc(CNC(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)cc1 609261079 LGNPTOUPVPNAGB-OAQYLSRUSA-N 392.911 5.361 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H]3CCCOc4ccccc43)cc2)c1 609433708 CQBYFQJEVIKQJA-JOCHJYFZSA-N 399.450 5.386 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCc1cccc(Cl)c1 609438079 BCSNJZVCSPPAHX-HNNXBMFYSA-N 387.936 5.489 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)c1c(Cl)cccc1Cl 609579945 KYOPXZPVLGOGIG-GFCCVEGCSA-N 377.271 5.394 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2ccccc2F)CC1 609855843 ITXGZSISXVNTEK-UHFFFAOYSA-N 386.426 5.468 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3noc(CC(C)(C)C)n3)cc2)s1 610172693 WTTOAHHAYKQFKU-UHFFFAOYSA-N 394.500 5.073 30 20 GKED C=CCN(Cc1csc(COc2ccc(F)cc2)n1)Cc1ccccc1F 615464130 YJUMPDKUWQLQBM-UHFFFAOYSA-N 386.467 5.189 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1cc(Br)cc(C(F)(F)F)c1 618742307 MFPIGBPGPDWMJY-KRWDZBQOSA-N 395.222 5.117 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3sc4c(c3C#N)CC[C@@H](C)C4)cc2c1 619564090 PXPPMVBOWZDBLV-CYBMUJFWSA-N 375.497 5.162 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)NCc1ccc(C#N)c(Cl)c1 619770581 BOSKIVAKYCNIME-KRWDZBQOSA-N 395.812 5.013 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1CC[C@H]1c1ccc(F)cc1 628112875 BWLPGCSWRDWCFP-LSDHHAIUSA-N 399.350 5.489 30 20 GKED Fc1ccccc1-c1csc(N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)n1 645033545 QNPLCVLRDAOENS-UWVGGRQHSA-N 398.347 5.516 30 20 GKED C=CCC[C@@H](NC(=O)NCCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 676723663 BKKUZADQQMQYBC-MRXNPFEDSA-N 397.466 5.020 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C)c(NC(C)=O)c1C 681395843 KLNORUULVYZQDR-UHFFFAOYSA-N 391.924 5.197 30 20 GKED COc1cc(C=Nn2cnc3ccccc32)ccc1OCc1ccc(Cl)cc1 725849407 GXEOQFQOOCNRBC-UHFFFAOYSA-N 391.858 5.160 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nc(C)cs1 729553295 NYATZLAFNDTJQP-UXHICEINSA-N 390.512 5.380 30 20 GKED Cc1cccc(Oc2ccccc2CNCc2ccc(N(C)CCC#N)cc2)c1 730107913 XIAOFFMOBRZDBV-UHFFFAOYSA-N 385.511 5.427 30 20 GKED FC(F)(F)c1cc(NN=Cc2csc3ccccc23)nc(-c2cccnc2)n1 733079645 IBMMPYSTZWSCIB-UHFFFAOYSA-N 399.401 5.218 30 20 GKED N#Cc1cccc(OCC(=O)Nc2cccc(CSCc3ccccc3)c2)c1 734784229 YRZPHLITMBOTSG-UHFFFAOYSA-N 388.492 5.009 30 20 GKED C[C@@H](Cc1nnc(SCc2cc(Cl)ccc2OCC#N)o1)c1ccccc1 735231108 VPGPKSFCMIJSQB-AWEZNQCLSA-N 399.903 5.264 30 20 GKED CCCCN(Cc1ccccc1Cl)Cn1c(C)nnc1-c1cccc(C#N)c1 739855287 YITWLBVZKAURSD-UHFFFAOYSA-N 393.922 5.038 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1ccc2c(c1)COC2 742437648 WECHBCRSYIEDBT-KTKRTIGZSA-N 392.886 5.128 30 20 GKED O=C(/C=C\c1coc(-c2ccccc2)n1)c1ccc(-c2ccc(C(=O)O)o2)cc1 749891906 OWZVXYPEGDQQFI-KHPPLWFESA-N 385.375 5.196 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCOc2c1ccc(Cl)c2Cl 753318089 NVTJQCJRQHXJTN-OAHLLOKOSA-N 397.327 5.276 30 20 GKED C#CC[C@@H](OC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1ccccn1 754533131 ACGQCWSKAGLDRO-LJQANCHMSA-N 390.266 5.049 30 20 GKED C=C[C@H](CC(=O)O[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 758907475 JRBJPTRWSCETGN-ZWKOTPCHSA-N 376.456 5.318 30 20 GKED N#Cc1ccc(F)cc1COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 759346441 OVYXNVJIYBIBDP-UHFFFAOYSA-N 394.016 5.063 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2OCC#N)c(C)n1-c1cccc(Cl)c1 760978264 SHUONYPMIJICLV-UHFFFAOYSA-N 397.837 5.041 30 20 GKED O=C(/C=C\c1csc(Cl)c1Cl)c1cc(Br)ncc1F 761484921 BXRDXSNPZJZOLE-UPHRSURJSA-N 381.053 5.248 30 20 GKED CCSc1cc(Cl)ccc1C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl 763524115 XPPDMAYUZWSKQC-UHFFFAOYSA-N 396.255 5.138 30 20 GKED Cc1ccc(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 773982307 DTNBOZUQUGNYHG-QVNOTHCHSA-N 379.872 5.057 30 20 GKED C[C@@H](Nc1ccc(CC[C@@H](O)c2ccccc2)cc1)c1ccc(OCC#N)cc1 777676016 SEAVOBVWXCEXLN-KBMIEXCESA-N 386.495 5.428 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 780176383 LGMNGIDTADQGRZ-KRWDZBQOSA-N 397.434 5.088 30 20 GKED Cc1ccnc2sc(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)c(C)c12 786306028 JMEKDDQKSNEWJE-QGZVFWFLSA-N 399.475 5.028 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1c[nH]c2ccccc12 786325857 WLOIDQGMAIDMEC-ZFWWWQNUSA-N 392.409 5.283 30 20 GKED CC(F)(F)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 794222967 UABDBNKFYWTAGN-OAQYLSRUSA-N 376.406 5.706 30 20 GKED N#CC[C@H](CC(=O)OCc1nc(-c2c(F)cccc2F)cs1)c1ccccc1 795982447 QAUHRXIAONZEJL-OAHLLOKOSA-N 398.434 5.219 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCC(=O)c2ccc3ccccc3c2)s1 797572617 DNLCLGSVIKIHKQ-GOSISDBHSA-N 390.508 5.433 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 800151821 OTFMVYUOZYTBFK-UHFFFAOYSA-N 384.451 5.544 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc(N2CCCC[C@H]2C)cc1C 806347069 DRMQWXIQOQFGAO-HXUWFJFHSA-N 375.516 5.041 30 20 GKED O=C(/C=C\c1cccc(Br)n1)c1csc(-c2ccccc2F)n1 812244875 NESVCAZNUGRTAR-HJWRWDBZSA-N 389.249 5.003 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(COc2ccccc2)c1)c1ccccc1 814619800 UYEQKQZPTNJKPX-XMMPIXPASA-N 399.494 5.822 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cccc(Cl)c3[N+](=O)[O-])c(C#N)c2[C@@H]1C 839390768 KLFJSANOIJUXTD-NXEZZACHSA-N 389.864 5.119 30 20 GKED C[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)cc(F)c1O 850546051 GGLXHBXNACTTGG-QMMMGPOBSA-N 379.291 5.375 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccncc2)cc1 863197624 VHRIHNDSILKTPW-BBVFFXRHSA-N 384.483 5.268 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1ccc(NC(=O)NC2CC2)cc1 915049278 MGYAQZMLFDVOQZ-UHFFFAOYSA-N 377.275 5.113 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)[C@H](C#N)c3nc(C)cs3)c2c1 915102028 MIVIZSHFDRSUMS-IBGZPJMESA-N 383.476 5.465 30 20 GKED N#CCCn1cc(C=NNc2ccc(Cl)cc2Cl)c(-c2ccccc2)n1 916339224 BCTVYTCZUVENOS-UHFFFAOYSA-N 384.270 5.217 30 20 GKED N#C[C@H](C(=O)CSCc1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 917043338 HRBJVSIFYAUCRH-CQSZACIVSA-N 390.892 5.198 30 20 GKED Cc1ccccc1NC(=S)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 917600223 OSCDZZVTGSNRGB-UHFFFAOYSA-N 393.899 6.121 30 20 GKED N#CCOc1ccccc1C(=O)Nc1nc(-c2ccc3ccccc3c2)cs1 919809120 GWYONVRNMJUMIE-UHFFFAOYSA-N 385.448 5.118 30 20 GKED CCOc1cc(C#N)ccc1OC(=O)c1csc(-c2ccc(Cl)s2)n1 920019099 RUYLAFRPHNYMBQ-UHFFFAOYSA-N 390.873 5.015 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@H](C)c1ccccc1 920078316 KZCDMLNGKIPRGU-QGZVFWFLSA-N 387.508 5.707 30 20 GKED Cc1ccc2c(c1)C/C(=C\c1cn(-c3ccccc3)nc1-c1ccncc1)C2=O 921264126 PBYGYTVQVYOKSB-HMMYKYKNSA-N 377.447 5.065 30 20 GKED C#Cc1cccc(NC(=O)c2oc3ccccc3c2CSc2cccs2)c1 921278278 QDZXHZSCNAMJHL-UHFFFAOYSA-N 389.501 6.020 30 20 GKED O=C(O)c1cc(NN=Cc2cccc(Oc3ccc(F)cc3)c2)ccc1Cl 1776034521 KMLFQOXDAWSJPP-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(C)(C)[C@@H]1C/C(=C\c2cccc(C#N)n2)c2nc3ccccc3c(C(=O)O)c2C1 1776121618 PGNQQKFCECWTLV-ASNKMWSDSA-N 397.478 5.349 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(C)c(F)cc1Br 1776784156 UXBIXRFYYHNWHN-OAHLLOKOSA-N 388.321 5.190 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)[C@@H]3CC=C(C)CC3)CCC2)cc1 1791729062 QBSTWMHBRMNNSX-HXUWFJFHSA-N 392.543 5.061 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)Nc3ccc(C#N)c(Cl)c3)c(C)c2c1 14685988 CTIRILDDWLRXGO-UHFFFAOYSA-N 380.831 5.040 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)[C@H](C#N)c2ccccn2)c(C)c1 46706101 CHYAOVZYUUCXOG-OAQYLSRUSA-N 392.462 5.041 30 20 GKED Cc1cccc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 56750678 LGUPYEGRVVYDKP-UHFFFAOYSA-N 392.846 5.029 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 60127424 XGDVIXBHOWYBER-SFHVURJKSA-N 399.494 5.913 30 20 GKED O/C(CSc1cccc2cccc(Cl)c12)=N\c1nc(-c2ccccn2)n[nH]1 60792700 SJIKKUJDHBHWDK-UHFFFAOYSA-N 395.875 5.054 30 20 GKED N#CC1CCN(C(=O)c2oc3ccccc3c2CSc2ccccc2F)CC1 61584189 RJJHUQNJUBFCGT-UHFFFAOYSA-N 394.471 5.240 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCc4c(Cl)cccc43)c2)c1 62258079 TWLXBJZMSAFXKI-DEOSSOPVSA-N 388.898 5.568 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc2cc(Br)ccc2o1 65839498 JSGOWMKDBFOLQS-UHFFFAOYSA-N 399.244 5.106 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 71948249 ULYSIAILXGLAHV-GOSISDBHSA-N 380.900 5.663 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC/C=C/c1ccccc1 108409014 ZNJFPSGIISDLBG-JEJOPICUSA-N 382.554 5.323 30 20 GKED CN(C[C@@H]1CCCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 128427876 FLTWMRWXLWMRLE-AZUAARDMSA-N 397.906 5.028 30 20 GKED Cc1sc(C(=O)Nc2ncccc2OCCCC#N)cc1-c1ccc(F)cc1 150888024 AMJCHFKYKSTPPK-UHFFFAOYSA-N 395.459 5.193 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c2)cs1 173137565 BTGHLVKJZUAKMK-CQSZACIVSA-N 393.537 5.623 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(CC(F)(F)F)cc1 173648280 HAAIRKGTWZFTIZ-UHFFFAOYSA-N 378.394 5.020 30 20 GKED Cc1nn(CC(C)C)c(Cl)c1[C@H]1CCCN1C(=O)Nc1cccc(C#N)c1C 178569264 MCSNBHGWBPUCTO-GOSISDBHSA-N 399.926 5.050 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 186260129 UGBBDBORHPHRSK-CQSZACIVSA-N 375.428 5.088 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2)CCCC1)c1nc2ccccc2n1C(F)F 193769442 UARGDOKHUYOFER-INIZCTEOSA-N 379.410 5.120 30 20 GKED CC(C)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 236789926 LAHFOZJGAQIZIS-QRWLVFNGSA-N 376.422 5.483 30 20 GKED CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)CCO1 245526408 APGZYCGXGWBSHG-SUMDDJOVSA-N 389.565 5.044 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 246249620 LFHXIDFALQSPKY-OZOXKJRCSA-N 395.528 5.123 30 20 GKED CCc1ccc(OCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 301760654 JBVMRUYTEADKNI-GOSISDBHSA-N 396.899 5.281 30 20 GKED CCCCS[C@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 303113424 LHZNVYARADOLMN-OAHLLOKOSA-N 384.501 5.219 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CCC[C@H]1Cc1ccccc1 328833629 LGOMAWVXJFZZHP-IPMKNSEASA-N 384.545 5.062 30 20 GKED Cc1cc(C(C)(C)/C(O)=N/[C@@H]2CCC(O)=NC23CCC3)ccc1Br 329685977 FQHTXBUIRZZVIX-OAHLLOKOSA-N 393.325 5.033 30 20 GKED CC(C)c1nc([C@H]2CCCCN2CC(O)=Nc2cccc(Cl)c2Cl)n[nH]1 329829382 JJPMTRAMXMIVHJ-CQSZACIVSA-N 396.322 5.050 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 410399329 DKGPMJPVABXMOO-NXEZZACHSA-N 387.295 5.074 30 20 GKED N#CCCC[C@@H](NCCC(=O)Nc1c(Cl)cccc1Cl)c1ccccc1 411759030 PKQAPRABLZJRSZ-GOSISDBHSA-N 390.314 5.347 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 425380563 DFIZJXSOGBBKOG-UONOGXRCSA-N 375.394 5.041 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1CN1CCc2ccccc21 429055848 WXDDZRGGCSXNJL-UHFFFAOYSA-N 390.531 5.043 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(Cc2ccccc2)CC1 435609797 CBZHKHVOJDXIOB-KRWDZBQOSA-N 379.529 5.225 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@]12CCCc1ccccc12 439232515 KKNOPCIGWBPLMA-HFXUHXBXSA-N 376.525 5.314 30 20 GKED Cc1ccc(Cl)c(N(Cc2ncc[nH]2)C(=O)c2ccc(C(C)(C)C#N)cc2)c1 440877245 SLRLHBPHIPCNNI-UHFFFAOYSA-N 392.890 5.020 30 20 GKED N#Cc1c[nH]c(C(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)c1 444438603 OOSYGVNSMVXNPF-UHFFFAOYSA-N 394.843 5.194 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)cc1 444854136 DPWZTVOUZVVORI-CYBMUJFWSA-N 386.293 5.133 30 20 GKED C[C@@H](C1CC1)N(C(=O)c1c(F)cc(C#N)cc1F)c1cccc(C(F)(F)F)c1 445810722 NBGUKWIDLSSKPY-NSHDSACASA-N 394.343 5.301 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458804735 SVLIGBIFBSZZAK-AEFFLSMTSA-N 392.528 5.434 30 20 GKED CC[C@H]1CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c2ccccc2O1 460609484 OPXCSNABLWLRQD-IBGZPJMESA-N 384.435 5.168 30 20 GKED CC(C)(C(=O)Nc1ccc(C#N)cc1)c1csc(-c2c(F)cccc2Cl)n1 463066057 ANMRSESAKWSCQH-UHFFFAOYSA-N 399.878 5.391 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F 463729984 QEPOQAVTLFXHHN-MSOLQXFVSA-N 382.470 6.123 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H]1CCCN(c2ccccc2Cl)C1=O 463925447 MSLOWCDKZJFKEB-QAPCUYQASA-N 399.947 5.199 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)nc1 467098404 ZUWSNJBDMXLOAP-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1F 468033100 GNTSGFSIILKOAU-BFUOFWGJSA-N 395.478 5.688 30 20 GKED O=C(c1ccc(CCC(F)(F)F)cc1)N(CCC(F)(F)F)CC(F)(F)F 468518866 YAWAQKBMNWDAOW-UHFFFAOYSA-N 395.265 5.138 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)n1 474423318 YWWMMKFYIMIOJD-OAHLLOKOSA-N 395.532 5.206 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccccc1 474699734 VTDQKDDEDXQBSN-SFHVURJKSA-N 386.417 5.284 30 20 GKED Cc1ccc([C@@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)c2ccccn2)cc1 480581583 OARMBIVWGYFALL-JOCHJYFZSA-N 386.405 5.290 30 20 GKED C=CCn1c(SCc2coc(-c3ccccc3)n2)nnc1-c1ccc(C)cc1 481376776 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COc1ccc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)cc1OCCCC#N 494135553 YUMHVEROQIJUJS-CLFYSBASSA-N 389.411 5.005 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NCCCC3(C#N)CCOCC3)cc2)c1 499602085 JEZBFWUNYWZQNO-NRFANRHFSA-N 392.543 5.325 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)Nc1cccc(OCCCC#N)c1 502543973 CDVKRANGHGBTIG-UHFFFAOYSA-N 379.504 6.260 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)c12 504326077 YHSZCQICTIXPJY-UHFFFAOYSA-N 381.435 5.322 30 20 GKED CCCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 517061041 SRNZKBVFNPKBTI-UHFFFAOYSA-N 386.455 5.190 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)Cc1cccc(Cl)c1 518668622 HTCREPALJWJDDF-UHFFFAOYSA-N 398.837 5.546 30 20 GKED C[C@H](NCc1ccc(-c2cccc(Br)c2)o1)c1ccc(C#N)cc1 518779271 LIZDZTJSDGBJJZ-AWEZNQCLSA-N 381.273 5.432 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2cccc(F)c2)no1 520924314 UEQOMZCQSKXCFF-CYBMUJFWSA-N 381.432 5.127 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCn1ccc2cc(Cl)ccc21 534678014 FTZWVXHETFRQHL-HNNXBMFYSA-N 397.931 5.575 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccc(Cl)c(Cl)c3)C3CC3)cc2)CC1 538532485 XQOZABCCCLTTDW-UHFFFAOYSA-N 385.294 5.353 30 20 GKED C[C@@H](NCCC(C)(C)C#N)c1nc(-c2ccc(Br)cc2)cs1 543494745 DBNWDFKZMRLAON-GFCCVEGCSA-N 378.339 5.163 30 20 GKED C=CC[C@@H](C(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 547954277 FLGMTGOBPYDTNM-NTKDMRAZSA-N 386.495 5.198 30 20 GKED C=C(C)C[C@H](C)c1nc(CC(=O)Nc2ccc(Oc3ccccc3)cc2)no1 565918974 WJYHRYDRPYTYDT-INIZCTEOSA-N 377.444 5.113 30 20 GKED N#CC1CCN(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C2CCCCC2)CC1 572977747 GOGOVEATDUJEIO-IBGZPJMESA-N 393.453 5.272 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c(F)c1Cl 577312469 PVFRJSYTGMGFCI-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#C[C@@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2ccccc2n1C(F)F 577850258 GMPZADVGXKGQAI-VIFPVBQESA-N 390.802 5.118 30 20 GKED N#CCCN(C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1ccc(F)cc1 583890054 NONHIAVUUJMLMR-UHFFFAOYSA-N 385.851 5.163 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(C(C)(C)C#N)cc1 593280257 UEKRUCFBPNJPPV-UHFFFAOYSA-N 382.529 5.140 30 20 GKED CC(C)c1cc(Cl)ccc1NC(=O)NC1(c2ccc(C#N)cc2)CCOCC1 599883859 YDMJTMAVGRUBGP-UHFFFAOYSA-N 397.906 5.162 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)Nc2sc(C)c(C)c2C#N)cc1C 603445016 KDWHEEZPMOOJGX-UHFFFAOYSA-N 393.537 5.652 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 609427587 MOXMMSJXEVRABX-AWEZNQCLSA-N 396.899 6.247 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccc(Cl)cc12 609431870 WOOQGJIYSHIUSS-GFCCVEGCSA-N 384.888 6.041 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(C)c1 609432329 ZTTYRYUBYLFHLB-GOSISDBHSA-N 385.467 5.407 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)oc2c(F)cccc12 609460901 JJUQTEALIVPWRE-HNNXBMFYSA-N 377.202 5.182 30 20 GKED CC(F)(F)CCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 610296178 RNSKROAJKKAAMB-UHFFFAOYSA-N 398.331 5.743 30 20 GKED CC1(C#N)CCN(C(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)CC1 611566574 AYYPHCLWNIDGEI-UHFFFAOYSA-N 395.572 5.332 30 20 GKED CC(C)(C#N)CNC(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 611621144 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Cc1ccc(N(CCC#N)C(=O)CSc2ncc(C(C)C)n2C(C)C)cc1C 739435556 LQECVICUCNMJKG-UHFFFAOYSA-N 398.576 5.243 30 20 GKED CC(=NNc1c(Cl)cc(Br)cc1Cl)c1cc(O)ccc1O 741841523 ASAMJAFXSYXNBH-UHFFFAOYSA-N 390.064 5.003 30 20 GKED O=C(/C=C\c1cnc(-c2ccccc2)[nH]1)c1ccc(N2CCCCC2)c(F)c1 742430796 FFJCJPNBQJHTLT-BENRWUELSA-N 375.447 5.102 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccc(Oc2cnccn2)cc1 743055874 LXQKDOJSVZISQT-XFXZXTDPSA-N 399.475 5.597 30 20 GKED Cn1c([C@@H](C#N)C(=O)C[C@@H](Cc2ccccc2)c2ccccc2)nc2ccccc21 744010264 FFTRZBPTDCRYOJ-YADHBBJMSA-N 393.490 5.166 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3cc(F)ccc3F)n2)cc1 744034372 HGJFRQNTGHJAGP-RYQLBKOJSA-N 394.446 5.377 30 20 GKED N#CCOc1ccccc1C(=O)N(C1CC1)[C@H]1CCCC[C@@H]1C1CCCCC1 744374029 JFIJTHVBIVJTBO-IRLDBZIGSA-N 380.532 5.333 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1cnc(-c2ccncc2)s1 753162013 LKWRVCITYQLYGN-UHFFFAOYSA-N 384.508 5.241 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2cc(OC)c(OC)cc2F)cc1 766000612 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O=C(/C=C/c1cncc(F)c1)O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809127768 LAHNFCSFLQKNDT-KDQAPYGTSA-N 393.258 5.100 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Br)c(Cl)c1)c1nccc2ccccc12 810717339 UZCPBZNVRQGIDY-OAHLLOKOSA-N 399.675 5.070 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813214476 YAVVWIZPIFPOBL-UTSBKAFOSA-N 399.199 5.687 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccccc1C(F)(F)F 842942210 WRQGQKMCLGLDEK-RISCZKNCSA-N 378.419 5.409 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)on1 916680934 MVMKFBPHSBAXSU-SFTDATJTSA-N 386.455 5.008 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4c(F)cccc4s3)n2)cc1 916974012 CVLUMLBCKHDACL-HNNXBMFYSA-N 392.480 5.962 30 20 GKED CCn1cc(C(=O)/C=C\c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cn1 920992004 XNTHEAGBNYCZHW-UITAMQMPSA-N 397.818 5.153 30 20 GKED CCCCCCCOc1cccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)c1 1776788966 HOBNZMMUOLKDCI-PFFSESEHSA-N 392.495 5.874 30 20 GKED COc1cc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)ccc1C(=O)O 1777289246 ZYYMONWKBJTTAP-XFFZJAGNSA-N 398.361 5.044 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1 32291652 GMSWFGNTJSGYNU-UHFFFAOYSA-N 398.462 5.047 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c(Cl)c2ccccc21 51534618 AFWWPFORQAQCBV-HNNXBMFYSA-N 391.883 5.445 30 20 GKED C=CCN(C(=O)c1csc(-c2ccccc2F)n1)c1nc2c(s1)CCCC2 64779860 CULPNUIHEHIFBN-UHFFFAOYSA-N 399.516 5.117 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)C[C@H](C)C2 65880773 PFKXKEBMEBWDKB-CSOOAMHGSA-N 399.494 5.182 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)cc1F 66956342 PSKXDUZLOWPLPE-CYBMUJFWSA-N 375.444 5.023 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 108531188 JFXRSXWTVRMVKS-QGZVFWFLSA-N 395.528 5.167 30 20 GKED Cc1sc(C(=O)Nc2ccc(F)cc2OCC#N)cc1-c1ccc(F)cc1 120820862 IJYHMCRLXWDVOY-UHFFFAOYSA-N 384.407 5.156 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(C2CC2)n1Cc1ccccc1 127634732 PSJNNUGWDNVJAS-UHFFFAOYSA-N 388.540 5.297 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3cccc(C(F)F)c3)c2)c1 171547523 QZMKBFJZBGGBPP-UHFFFAOYSA-N 391.377 5.000 30 20 GKED CC(C)CC(=O)Nc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1F 172996042 QDNJQTJDFDVQJR-UHFFFAOYSA-N 399.491 5.068 30 20 GKED COc1ccc(-c2ccc(CNCc3ccc(O[C@H](C)C#N)cc3)s2)cc1 177584123 TWFLBERAVHPALJ-MRXNPFEDSA-N 378.497 5.004 30 20 GKED Cc1nn(C(C)(C)C)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 181495167 SSHNYJUSDWQJFC-HNNXBMFYSA-N 398.919 5.214 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(NC(=O)NC2CC2)cc1)c1ccc(F)c(F)c1 186449210 FSPUGRYYEUYRAW-SPLOXXLWSA-N 385.458 5.217 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cscn2)cc1Cl 195286474 MSADDWTVMRIUCU-SFHVURJKSA-N 381.888 5.023 30 20 GKED Cc1cc(F)cc2c(N[C@H](c3cccc(F)c3)c3ccccn3)c(C#N)cnc12 301899088 STWJSWGQLNTWLV-HSZRJFAPSA-N 386.405 5.290 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1cccc(F)c1F 303143037 UPHBKYXGJTUNFO-UHFFFAOYSA-N 392.405 5.509 30 20 GKED CC1(C)CCC[C@H](/C(O)=N/C2(c3noc([C@@H]4CCOC4)n3)CCCCCC2)C1 328774239 BTFGIJNVERQKRT-DLBZAZTESA-N 389.540 5.296 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN([C@H]2CCc3ccc(F)cc32)C1)C1CCCC1 329388138 RFSIRKSIFDUKTJ-UTKZUKDTSA-N 396.510 5.194 30 20 GKED O/C(=N/[C@@H]1CCCc2sccc21)Nc1cccc2c1CN(c1nccs1)C2 329831687 KPUPXLZCPLOLDT-MRXNPFEDSA-N 396.541 5.128 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCc2cc(C#N)ccc21 416812145 LNPNNXRRCAOBOX-BEFAXECRSA-N 390.512 5.009 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 425729010 VNKOMJPDJPSPDD-SCLBCKFNSA-N 393.384 5.093 30 20 GKED Cc1c(-c2nc(-c3ccccc3Cn3cccn3)no2)sc2ccc(C#N)cc12 426447556 APHIPLFVYNTMMJ-UHFFFAOYSA-N 397.463 5.043 30 20 GKED CC(C)(CNC(=O)c1cccc(SCC#N)c1)c1cccc(C(F)(F)F)c1 429797664 CJGNDAPRLBDLRT-UHFFFAOYSA-N 392.446 5.029 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1ccccc1 431317578 YWIRCUODCKEGEM-JBACZVJFSA-N 381.907 5.320 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1C[C@@H](C)C[C@@H]1c1ccc(C(F)(F)F)cc1 431947494 AAQWAPZBUXMDHM-ORAYPTAESA-N 387.405 5.501 30 20 GKED Cc1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(Br)c1 432746928 GKXOEBIUOKVQGV-KRWDZBQOSA-N 386.293 5.314 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 433287374 WVUOSYFXEPLQFW-UHFFFAOYSA-N 396.903 5.550 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CC[C@H](C)[C@@H]1c1ccc(C(F)(F)F)cc1 437762803 VZBZHFXERVHDGA-IFXJQAMLSA-N 387.405 5.501 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 438633557 NQUFYNJEZRXJRR-UHFFFAOYSA-N 399.903 5.809 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438842460 PSTFZRGETUWEFX-IFXJQAMLSA-N 390.314 5.741 30 20 GKED N#CCC[C@@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1ccccc1 439667837 LNHQQWPJEMIDSG-HSZRJFAPSA-N 380.451 5.077 30 20 GKED C=CCC[C@H](NC(=O)NCc1nc(C)c(C)s1)c1ccc(C(F)(F)F)cc1 440879686 YPCQTTSYCNMARO-INIZCTEOSA-N 397.466 5.285 30 20 GKED C=C(C)[C@H](NC(=O)N(CC)Cc1c[nH]c2ccccc12)c1ccc(F)c(F)c1 443160628 FNHCQVHPRKVYNX-NRFANRHFSA-N 383.442 5.295 30 20 GKED N#CCCCCNC(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 448149430 XQVQNKARNHUEKQ-UHFFFAOYSA-N 384.892 5.432 30 20 GKED CN(CC(C)(C)C#N)C(=O)N[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 458605702 AKICORLSNPXETF-OAHLLOKOSA-N 387.833 5.001 30 20 GKED CC(C)c1oc([C@@H]2CCCN2c2cccc(F)c2C#N)nc1-c1ccccc1 462112948 QDKFKPGGVDWBLF-FQEVSTJZSA-N 375.447 5.817 30 20 GKED Cc1c(CNc2ccc(Oc3ccccc3C#N)c(F)c2)cccc1[N+](=O)[O-] 463230707 SPTHPKXOVBVECC-UHFFFAOYSA-N 377.375 5.318 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cncc(-c2ccc(Cl)cc2)c1 466352199 JJEFEMOQZLRZKB-UHFFFAOYSA-N 393.899 5.660 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 471170084 SNVIMAODYYJGDX-UHFFFAOYSA-N 396.343 5.661 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 471248836 FIKOYUMYWAOCAG-FZKQIMNGSA-N 389.377 5.155 30 20 GKED C[C@H](Sc1ccc(C#N)cn1)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471260232 YCFNXJPYTCTQOU-VIFPVBQESA-N 377.256 5.163 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1c2ccccc2SC[C@H]1C 472584879 YCKFPHOIUWVRDA-CVEARBPZSA-N 397.569 5.020 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 474418466 YSASEGIUVHFTSN-UHFFFAOYSA-N 386.451 5.541 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccccc1 474435679 SLRICTDTQUOXFI-HFZDXXHNSA-N 394.474 5.726 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCCOc1ccc(OC)cc1 475572764 ZHCARJGEAGQBOG-UHFFFAOYSA-N 382.504 5.138 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1SCCCC(C)(C)C#N 476521024 WYPYNPBIFRLGJY-UHFFFAOYSA-N 390.940 5.119 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)cc1 476537713 RVMRNNVMUIBIDE-QGZVFWFLSA-N 378.369 5.050 30 20 GKED CN(C(=O)CSCc1ccc(C#N)cc1)C1c2ccccc2-c2ccccc21 477558410 UZQXUVQOIMYTQC-UHFFFAOYSA-N 384.504 5.020 30 20 GKED N#CC1(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)CCCCC1 477725751 ZQNKFTJFFCQCAP-UHFFFAOYSA-N 379.407 5.241 30 20 GKED Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1ccccc1Oc1ccccc1C#N 477989414 QXXQRAKCMPUACV-UHFFFAOYSA-N 394.434 5.301 30 20 GKED N#Cc1cc(CNc2ccc(-c3csc(C(F)(F)F)n3)cc2)ccc1F 480165426 ZGMOCDVDYFCLLB-UHFFFAOYSA-N 377.366 5.452 30 20 GKED CC(C)(C#N)c1ccccc1CNc1cc(Cl)ccc1C(=O)N1CCCCC1 486464840 UUWDFIKPLQEHCW-UHFFFAOYSA-N 395.934 5.379 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 497215850 SIGQCUTXJHMUNJ-XDJHFCHBSA-N 395.506 5.343 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCCC(F)(F)C2)cc1Cl 503993589 PTOQYNPUJKODSM-CRAIPNDOSA-N 388.845 5.759 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(C(=O)c2ccc(C)cc2)CC1 505029432 NFOKEPORPKRARU-UHFFFAOYSA-N 376.500 5.240 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3ccc(F)c(Cl)c3)n2)cc1 505772174 RAXJVRUAKZVUGX-AWEZNQCLSA-N 385.851 5.157 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCCCOC2CCCCC2)cc1 510548709 BCZMJLVDNXEMRB-UHFFFAOYSA-N 393.487 5.211 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)cc1 511536940 FPTSGMVJUZYTIF-QGZVFWFLSA-N 398.466 5.002 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c(F)c1 517723134 URDSCDKRPVDMJU-NRFANRHFSA-N 385.269 5.883 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1cc2c(s1)CCCC2 518168934 OBKXKQBRIDFAJW-AWEZNQCLSA-N 385.558 5.200 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 518683218 MQXDKYUUWKXZLH-YLJYHZDGSA-N 381.545 5.847 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 519066387 XCYSGOCHHJBVGN-SFHVURJKSA-N 379.504 5.027 30 20 GKED Cc1[nH]c2ccc(CNC(=O)Nc3ccccc3SC[C@@H](C)C#N)cc2c1C 521748512 UWIPLQGSXUVOQO-AWEZNQCLSA-N 392.528 5.358 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)CC1 526987548 UIPAUUKZRSHHAE-UHFFFAOYSA-N 385.511 5.297 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 533299077 JNIRDRBACVDQPT-HKUYNNGSSA-N 395.572 5.187 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccccc1CCC(F)(F)F 533999724 GDNMMYCGWWDXCZ-UHFFFAOYSA-N 377.406 5.019 30 20 GKED Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)Nc1sc(C)c(C)c1C#N 538811570 VUCXGXFXZZPBCT-UHFFFAOYSA-N 395.553 5.580 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1[C@H]1CCCO1)c1ccc(C(F)(F)F)cc1 560107461 QJHCZHFGDXOPGJ-GBESFXJTSA-N 396.453 5.066 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3sc4c(c3C#N)[C@H](C)C[C@H](C)C4)ccc12 574617914 DTSKFQVLLRMXBG-WCQYABFASA-N 391.496 5.120 30 20 GKED N#CC[C@@H](Cc1nc(Cc2nc3cc(Cl)ccc3s2)no1)c1ccccc1 579772158 QQGOHQGDRVCHAB-AWEZNQCLSA-N 394.887 5.163 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccccc1 581343385 PNQFLBVTHCQHIE-YLJYHZDGSA-N 379.529 5.840 30 20 GKED Cc1cccc(Oc2ccc(NC(=O)N3CCC(CCC#N)CC3)cn2)c1C 582239483 GWSHXENJHPOKKW-UHFFFAOYSA-N 378.476 5.038 30 20 GKED Cc1csc(Nc2ccc(C(=O)Nc3cccc(OCCCC#N)c3)cc2)n1 584023252 CSBHCPXHFPFDGR-UHFFFAOYSA-N 392.484 5.130 30 20 GKED Cc1sc2nc([C@@H](C)Sc3nc4c(cc3C#N)CCCC4)nc(O)c2c1C 585688258 BEXPJQKXCQPSIC-GFCCVEGCSA-N 396.541 5.013 30 20 GKED N#CCC[C@H](NCc1cc(OC(F)F)ccc1Br)c1ccccc1 592365932 LBLOHWDHNNUSOA-KRWDZBQOSA-N 395.247 5.185 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)OC(C)(C)C)nc1 593139959 RPDZTNFHGNZLES-UHFFFAOYSA-N 380.488 5.141 30 20 GKED CC(C)(C)[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1cccc(C(F)(F)F)c1 596243094 GOCMOXLAKJWKLH-YOEHRIQHSA-N 381.442 5.128 30 20 GKED Cc1c(NC(=O)CC2(C#N)CCCCC2)cccc1NC(=O)c1ccccc1 596860978 AIBVLMRQAICGTI-UHFFFAOYSA-N 375.472 5.050 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(C)(C)CC(F)(F)F 597121543 PONBFAGQAKDBBY-UHFFFAOYSA-N 390.405 5.363 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@@H](C)c3ccc(C#N)cc3)cs2)cc1 603521294 RSNBRKUVJLXAJK-INIZCTEOSA-N 389.524 5.225 30 20 GKED CC(C)c1nc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)cs1 609104443 KICWFFDAAAWFGO-UHFFFAOYSA-N 395.459 5.109 30 20 GKED N#CCn1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc2ccccc21 609216215 FSGCGZMTNVLAQH-UHFFFAOYSA-N 382.448 5.017 30 20 GKED N#Cc1ccc(NC(=O)[C@@H](Sc2ccc(F)c(F)c2)c2ccccc2)cc1 609261226 CBJFHUCSPRSXEV-FQEVSTJZSA-N 380.419 5.309 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)c(C(F)(F)F)c1 609377012 MTFPWNWPIBZKLH-LLVKDONJSA-N 382.382 5.349 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)F)cc1 610181062 UTTAZSROTPKSLC-UHFFFAOYSA-N 386.345 5.187 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)c1 610343544 LAGZWFNJLFSXTP-CYFREDJKSA-N 383.495 5.206 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 610400451 QGADUJSRCXGSTF-BXKMTCNYSA-N 395.462 5.454 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cn1)c1ccccc1 613289607 SSXSKVBCXJWSHG-YJBOKZPZSA-N 399.475 5.321 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)s1 613346758 PTYWLUHAWGNAEQ-LBPRGKRZSA-N 393.320 5.977 30 20 GKED CN(CCC1CCCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 726075047 ZQOHATOMUXSEOK-HSZRJFAPSA-N 375.516 5.776 30 20 GKED N#CCCCOc1cccc(/C=C2/COc3c(Cl)ccc(Cl)c3C2=O)c1 726741805 ZZDWZYNPOQAFOJ-UVTDQMKNSA-N 388.250 5.335 30 20 GKED CCOc1c(Br)cc(/C=C2\CCc3sccc3C2=O)cc1OC 726894120 VUJNWLGRHDOYAN-XYOKQWHBSA-N 393.302 5.130 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1c(Cl)ccc(C)c1Cl 728446203 JVZULLXCGUHJBG-UHFFFAOYSA-N 383.319 5.826 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 732903315 UFRDMNHZHHMCCQ-HOTGVXAUSA-N 396.462 5.533 30 20 GKED O=C(/C=C/c1nccn1Cc1ccccc1)c1ccccc1OCc1ccccc1 734095881 IVOJXXVKTWSPPI-FOCLMDBBSA-N 394.474 5.407 30 20 GKED CCOc1ccc(O)c(C=Nc2cccc(C[S@@](=O)C3CCCCC3)c2)c1 734978989 HCRNLBFUTBKUHS-HHHXNRCGSA-N 385.529 5.123 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1cc(-c2cccs2)on1 736347402 BNVNPDLEUYXRLE-UHFFFAOYSA-N 376.890 5.392 30 20 GKED Cc1c(Cl)cccc1NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1 739436470 CVBYPPPDOLWTBL-UHFFFAOYSA-N 397.956 5.735 30 20 GKED O=C(/C=C\c1cnc2ccc(Br)cn12)c1cccc2ccccc12 740764386 UHIROICKHBPWTD-KTKRTIGZSA-N 377.241 5.146 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(OC3CCC3)cc2)cc1 742536888 DELOFSYNOPPZCG-DEOSSOPVSA-N 382.463 5.526 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1ccc2ccccc2n1 743443501 URHFLMOWYIQXIA-HNNXBMFYSA-N 399.277 5.577 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 745947712 KAOJQWSMCIEIPA-CZUORRHYSA-N 384.888 5.231 30 20 GKED CCOc1cc(/C=C/C(=O)c2c[nH]c3cc(F)ccc23)ccc1OC(F)F 749452313 KXHNDKUUKALTFF-XVNBXDOJSA-N 375.346 5.203 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3COc4cc(C)c(C)cc43)n2)cc1 770848148 SGIVWYJLBQBZGR-RBUKOAKNSA-N 388.492 5.088 30 20 GKED CCCCCCCOc1ccc([C@H](C)N[C@@H]2CCOC3(CCOCC3)C2)cc1 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C=CCN(Cc1c(O)ccc2c(=O)c(-c3ccccc3Cl)c(C)oc12)C(C)C 917481643 SURQARUCHOYEMK-UHFFFAOYSA-N 397.902 5.524 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3csc(-c4ccsc4)n3)oc12 920064613 WVMAYGWFCSCQKS-SREVYHEPSA-N 381.478 5.913 30 20 GKED COc1ccc(COCc2cccc(N=Cc3cc4ccccc4nc3O)c2)cc1 921138281 CFKLVLXZNHAWLQ-UHFFFAOYSA-N 398.462 5.416 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2cccc3c(O)nccc23)cc1 1140703871 PPUXLXOJQOGRDT-UHFFFAOYSA-N 397.459 5.216 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C/C(=O)c3ccc4ccccc4c3)s2)c1 1776131688 YXTLTMNBHLGWIU-ZRDIBKRKSA-N 384.456 6.163 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2ccc(-c3cccs3)cc2F)c1)C(=O)O 1776470770 HLQNOYGQBMWHAF-ATWMFIQVSA-N 396.439 5.302 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1)C(=O)O 1776473548 PIMPVYZRCXZYKM-UIJKISKDSA-N 398.764 5.107 30 20 GKED CCSc1cccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776951543 WUNORVXIJGLIBI-IZZDOVSWSA-N 378.449 5.653 30 20 GKED Cc1cccc2c1C/C(=C/c1cccc(OCc3cccc(C(=O)O)c3)c1)C2=O 1777456150 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C=C[C@H](CC(=O)N1CCC[C@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 179440739 OLOZVZGVPIAPDR-ZBFHGGJFSA-N 394.462 5.228 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cccc(C#N)c2)cc1Cl)c1ccccc1 303031670 NZHAPGTWMMNBEP-HNNXBMFYSA-N 375.859 5.637 30 20 GKED COc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1Cl 303207357 QFEPFFXSRNVYDW-UHFFFAOYSA-N 378.815 5.265 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](C)c2cccc(OC(F)F)c2)c1 303217306 TYYYMXPJSWURAV-AWEZNQCLSA-N 376.403 5.126 30 20 GKED CC[C@@H]1Oc2cc([C@H](C)/N=C(/O)N3CCC[C@@H]3c3ccsc3)ccc2N=C1O 329787097 YKAACFOQHVSYRV-VHSSKADRSA-N 399.516 5.319 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1sccc1Cl 419604622 ZWSZTVOYXYXJKT-GFCCVEGCSA-N 396.990 5.668 30 20 GKED C[C@@H](NC(=O)c1cccc(SCC#N)c1)c1cc(F)c(Cl)cc1Cl 429969114 ULUMYLXACLMDQB-SNVBAGLBSA-N 383.275 5.239 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 431465548 OOXBUWWPFOPYEK-RTWAWAEBSA-N 383.442 5.316 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 432834375 BEEGCGDGUFEQCV-UHFFFAOYSA-N 392.937 5.190 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](Cc3ccccc3)C2)cc1 437837280 HSIBJRSOFFRZIJ-FQEVSTJZSA-N 397.478 5.447 30 20 GKED CC(C)C1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)CC1 437957646 QZQZJDVLAIPDRQ-UHFFFAOYSA-N 395.478 5.176 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1SCCc2ccccc21 443853590 ITFIEQBBLCXVHS-IBGZPJMESA-N 376.506 5.256 30 20 GKED N#CCCCn1cc(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c2ccccc21 444232346 QBJUHYHHDUGXIN-SFHVURJKSA-N 391.902 5.228 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 444456212 WCSDJOWKPRATOY-UHFFFAOYSA-N 381.435 5.179 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccnc(Oc4ccccc4Cl)c3)CC2)cc1 445835705 WQYYXIQOIWLSKB-UHFFFAOYSA-N 389.842 5.069 30 20 GKED C=CCOc1ccc(CNc2ccc(C(=O)Nc3ccccc3OC)cc2)cc1 446905558 TYRUXBXTRKNEFV-UHFFFAOYSA-N 388.467 5.124 30 20 GKED Cc1sc(CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)nc1C(C)C 447480243 HHSGBPCVSQULEJ-UHFFFAOYSA-N 391.496 5.420 30 20 GKED C=CC[C@@H](C(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1)c1ccccc1 452533951 WETQUQFXJJRQBO-MRXNPFEDSA-N 394.462 5.228 30 20 GKED CC[C@@H]1CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c2ccccc2O1 460609485 OPXCSNABLWLRQD-LJQANCHMSA-N 384.435 5.168 30 20 GKED C[C@H](Sc1ccc(Cl)c(Cl)c1)C(=O)N(CCC#N)c1ccccc1 463189937 CDWNKRZTBKQJOE-ZDUSSCGKSA-N 379.312 5.421 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1)C(F)(F)F 463805832 NHUUBKLUSCACCK-MRVPVSSYSA-N 396.262 5.169 30 20 GKED C[C@@H]1C[C@H]1[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)cc1 466133150 UKVMYOLXYONADD-JSNMRZPZSA-N 381.907 5.660 30 20 GKED CN(Cc1cc(Cl)cn1C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 467492415 XNMDFZUXBZKXNB-UHFFFAOYSA-N 394.862 5.006 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccccc1-c1nncn1C(C)C 467971933 VWWLMHUOHQTSRI-UHFFFAOYSA-N 389.503 5.136 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 471274075 UCDSJZUPIKSTNI-UGSOOPFHSA-N 389.377 5.155 30 20 GKED CCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cnn1-c1ccc(Cl)cc1 472512821 FBQNNJNZQBMVDM-UHFFFAOYSA-N 392.890 5.142 30 20 GKED 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30 20 GKED COc1cc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)ccc1C#N 554998795 VCKHKSZULXEMIG-QFIPXVFZSA-N 394.421 5.047 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)COc1ccsc1Cl 556396191 OLAPZJHHASCTCV-UHFFFAOYSA-N 398.871 5.391 30 20 GKED C=CCN(C(=O)[C@H]1CC[C@@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 570754433 DSYCHQWLBMYTEI-LSDHHAIUSA-N 380.435 5.308 30 20 GKED COc1ccccc1-c1nc(CON=Cc2ccccc2OC(C)C)cs1 588600158 ROQCCJQALRCABV-UHFFFAOYSA-N 382.485 5.157 30 20 GKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 596606076 KFHWEPYOBXDSOE-FGZHOGPDSA-N 375.516 5.585 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CSc1ccc(F)c(F)c1 603968457 VAQJSWAGJGYISU-UHFFFAOYSA-N 386.448 5.296 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)c1C 604044554 WQSOCUUPEZYNIP-LJQANCHMSA-N 399.494 5.193 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3sccc3C#N)cc2Cl)n1 608874195 DIQCUHVXURTRFC-UHFFFAOYSA-N 391.930 5.442 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)NCc3cccc(C#N)c3)cc2)c1 609042877 DNFAQOIJZHTYKQ-IBGZPJMESA-N 399.494 5.006 30 20 GKED Cc1ccc(CCC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1 609061199 LUTRFDGXFMOETN-UHFFFAOYSA-N 384.479 5.325 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1F 609110223 ARTWJWQHLDUFPY-UHFFFAOYSA-N 383.382 5.272 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccccc2F)o1 609431474 OSFJGWSKSUSZAJ-CQSZACIVSA-N 380.444 5.732 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCCCC[C@H]3c3ccccc3)cc2)nc1 609501342 HGXOYGCSTAKHAF-QHCPKHFHSA-N 397.478 5.503 30 20 GKED C[C@@H](CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)Cc1cccs1 610191440 NQZZWIQIMBJUAG-QGZVFWFLSA-N 390.508 5.215 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)c(Cl)c1 611095030 OEWUDYSDQGPKCI-UHFFFAOYSA-N 393.245 5.578 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3occc3-c3ccccc3)n2)cc1 613317974 BCIXJMREQBKBCP-IBGZPJMESA-N 384.460 5.869 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619769225 KENFYGARUDLRJT-LLVKDONJSA-N 396.705 5.421 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](N(C)Cc2ccccc2)C1 682776981 CIHKNYFRBZIESU-QFIPXVFZSA-N 391.559 5.277 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc(F)c(Cl)c3)c2)cc1 729160407 OZUVWTAGQHFOLA-UHFFFAOYSA-N 397.862 5.952 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c1 729165982 XNLPCRBBFAEOIU-AWEZNQCLSA-N 395.528 5.287 30 20 GKED N#CCOc1ccc(CNCc2c3ccccc3c(Cl)c3ccccc23)cc1 729685424 SYVRUOZJOOLPHJ-UHFFFAOYSA-N 386.882 5.839 30 20 GKED CC(C)(CCCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 733053510 IPUMAERZMDCLOK-QGZVFWFLSA-N 380.488 5.661 30 20 GKED Cc1c(C(=O)/C=C/c2cnn(C(C)C)c2)cnn1-c1ccc(Cl)cc1Cl 743056583 ZQZPMDFKXLVTGC-QPJJXVBHSA-N 389.286 5.161 30 20 GKED C=CCn1c(-c2ccccc2F)nn(CN2C[C@H](C)[C@H]2c2ccccc2)c1=S 743392653 STGDOPRZPBRHRF-JXFKEZNVSA-N 394.519 5.057 30 20 GKED N#C[C@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2s1 744017020 XOJFKTPUCWIPKT-NHCUHLMSSA-N 396.515 5.889 30 20 GKED O=C(/C=C/c1ccc(-n2cncn2)cc1)c1ccc(-c2ccc(F)cc2)s1 750904923 JCDCOKNZIQPFPP-XCVCLJGOSA-N 375.428 5.031 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)NCc2ccc(OCC#N)cc2)cc1 764400960 YHLFKZVUMLBSAO-QHCPKHFHSA-N 391.515 5.149 30 20 GKED CC(C)Oc1ccc2ccccc2c1CNC(=O)c1ccccc1SCC#N 766625654 SVKQXZJNEDWVAK-UHFFFAOYSA-N 390.508 5.173 30 20 GKED CCCCN(C)c1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1 767859025 HYZMJBMTKDCMLB-UHFFFAOYSA-N 388.515 5.116 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cccc(CSC2CCOCC2)c1 768155755 SDZAQCFHHBFGNB-HXUWFJFHSA-N 392.565 5.009 30 20 GKED COCc1ccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 772611255 CDWANYFYOCXUKN-QGZVFWFLSA-N 385.467 5.254 30 20 GKED N#C[C@H](COC(=O)c1ccccc1SCc1ccco1)Cc1cccs1 772734752 QPSIGDMBOYWFNZ-OAHLLOKOSA-N 383.494 5.173 30 20 GKED CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(C=NOC2CCCC2)cs1 774597739 XPDLHWHQVGALQV-UHFFFAOYSA-N 397.422 5.140 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(N2CCc3sccc3C2)cc1 775684606 FAVMQNXMBBGXGF-UHFFFAOYSA-N 384.545 5.012 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](F)Cc1ccccc1 777990913 BCHSXZKFDYEPCS-HNNXBMFYSA-N 396.409 5.230 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NOC2CCCCC2)cc1Cl 779402170 KMJNKGOJLDTUMX-LJQANCHMSA-N 383.879 5.381 30 20 GKED C[C@H](OC(=O)c1ncc(F)cc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 784969481 YYZQSYNBPVYPGI-ZETCQYMHSA-N 399.237 5.315 30 20 GKED FC(F)(F)c1cccc(-c2ccc(NN=C3CCC[C@H]3c3ccccn3)nn2)c1 794981694 OISJZKXFZLRYOO-INIZCTEOSA-N 397.404 5.293 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(Br)c1 794995240 NZPMWVIPYCTART-UHFFFAOYSA-N 375.335 5.224 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccc(OC(F)(F)F)c(C#N)c2)cc1 799511478 LKOHBBRCWXRYDV-UHFFFAOYSA-N 395.406 5.053 30 20 GKED N#CC1(CCCOC(=O)C2(c3c(Cl)cccc3Cl)CCC2)CCOCC1 800216009 XUNRZVYDKXWNLU-UHFFFAOYSA-N 396.314 5.059 30 20 GKED N#C[C@@H](C(=O)C1(C(F)(F)F)CCC1)c1nc2cc(C(F)(F)F)ccc2s1 835074012 QNMYMWNPXXXXFT-VIFPVBQESA-N 392.324 5.224 30 20 GKED N#C[C@H](C(=O)CCc1ccc(C(F)F)cc1)c1nc2ccccc2n1C(F)F 870159238 YLUDOMSSCUPKAA-CQSZACIVSA-N 389.352 5.178 30 20 GKED C=CCOc1ccc(/C=C/C(=O)N(CC)[C@H](C)c2ccc(F)cc2)cc1OC 916486183 BEQZHNAZEQQOFI-LEHPZIBWSA-N 383.463 5.022 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C34CC5CC(CC(C5)C3)C4)n2)cc1 916627456 WGEDIPGSBWNPLU-YLSHDAJPSA-N 376.525 5.511 30 20 GKED C[C@H](Oc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047470 YBNSKJVIMCONOX-CMPLNLGQSA-N 391.279 5.247 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])s1 920970666 LJNDJWQDZRGRDL-UHFFFAOYSA-N 396.900 5.255 30 20 GKED COc1cccc(C2CC(=O)C(=CN[C@H](C)c3cccc4ccccc34)C(=O)C2)c1 920979380 KBPVYJNZWQFHFS-DIAVIDTQSA-N 399.490 5.099 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CCC[C@@H]1c1cccc(C(F)(F)F)c1 1776050304 CIAIWUUGWVAWKW-OAHLLOKOSA-N 392.377 5.148 30 20 GKED CC(C)[C@H]1/C(=C\c2cc(Br)cc(C(=O)O)c2)C(=O)c2ccccc21 1776308798 QEAMFRRQNIESDD-JIARHERNSA-N 385.257 5.167 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C[C@@H](C)c2ccccc2)C(=O)O)cc1 1776786333 AHZBCMWBONMZBB-HYBUGGRVSA-N 397.559 5.772 30 20 GKED CCc1ccc(OCc2nnc(S[C@@H](C)C#N)n2[C@H](C)c2ccccc2)cc1 7196524 YITISRVZZDUSAF-DLBZAZTESA-N 392.528 5.033 30 20 GKED CCc1c(C(=O)Nc2ccc(C(C)(C)C#N)cc2)cnn1-c1cccc(Cl)c1 25440548 XIVOJQOFXNFSKI-UHFFFAOYSA-N 392.890 5.142 30 20 GKED CC(C)(C#N)c1ccc(N[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1 28373761 JCPFVANIMBVJNG-JOCHJYFZSA-N 387.458 5.419 30 20 GKED COc1ccc(-c2nc(C)c(/C(O)=N/c3nc(C(F)(F)F)cs3)s2)cc1 31510755 UEUKVMKPXKWRDZ-UHFFFAOYSA-N 399.419 5.239 30 20 GKED CCN/C(S)=C(/C(=O)c1ccc(CC(C)C)cc1)[n+]1ccc(C(C)(C)C)cc1 55011178 FIFWABDELYVSBF-UHFFFAOYSA-O 397.608 5.018 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H](C)c1ccco1 69592951 WNGPMTJZRWGUAP-MRXNPFEDSA-N 375.428 5.477 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccccc1CN(C)C1CCCCC1 106321238 PWJUYEXBSHBWDA-UHFFFAOYSA-N 391.559 5.671 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2cccnc2)cc1 108239812 QJDOMXZMAPENEV-MRXNPFEDSA-N 389.480 5.378 30 20 GKED C=CCN(C(=O)CCCCOC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 120843360 UYFFVKQGGOLNJV-UHFFFAOYSA-N 399.343 5.453 30 20 GKED N#Cc1c(NC(=O)c2ccc(C(F)(F)F)nc2)sc2c1-c1ccccc1CC2 122605859 PIYHNKKEVHAWAL-UHFFFAOYSA-N 399.397 5.051 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cc(-c2cccs2)nc2ccccc12 182044396 MEBWQKWBIAFAFW-OAHLLOKOSA-N 399.475 5.506 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nccs1 183676277 YZTLBQJHUCRGEE-OAHLLOKOSA-N 392.484 5.074 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(OC2CCCC2)c(F)c1 184044020 SUBJNAKBSJYZPA-CQSZACIVSA-N 383.423 5.082 30 20 GKED C=CCC1(C(=O)N2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CCC1 189382046 HSMVVMCGQWOTKP-UHFFFAOYSA-N 382.331 5.247 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)c1cccnc1 191442911 GDJAAOHKCKVVCL-HSZRJFAPSA-N 385.511 5.845 30 20 GKED Cc1ccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2SCCC#N)cc1 212458677 GQCGJFUOMCFIGJ-RCCKNPSSSA-N 389.524 5.509 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2\CC/C(=C\c3ccc(O[C@H](C)C#N)cc3)C2=O)cc1 255674754 GDNBJFVFRZPWJC-BGSCIDCASA-N 398.462 5.098 30 20 GKED CC(C)Sc1ccccc1N=C(O)N1CCC[C@@H](c2ncc3n2CCCC3)C1 328647014 HDOLUWJBPMWHPB-QGZVFWFLSA-N 398.576 5.145 30 20 GKED Cc1cccc2c(C/C(O)=N/[C@@H]3CCCc4cn(C5CCCC5)nc43)c[nH]c12 329481108 DICGAGKMHLLAII-HXUWFJFHSA-N 376.504 5.365 30 20 GKED N#Cc1cscc1C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 410792364 OKBDVWDGZSQWMK-ZDUSSCGKSA-N 392.324 5.062 30 20 GKED C=C(C)C(C)(C)C(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 424803355 MEJBBESILMJJLY-UHFFFAOYSA-N 384.545 5.127 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F 425667394 CXOTVLFIHFZKFT-PXAZEXFGSA-N 395.812 5.218 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@H]2CC[C@@H](C)C2)cc1 429771886 ZBFIKZOGKYMDIL-QAPCUYQASA-N 379.460 5.011 30 20 GKED N#Cc1ccccc1-c1ccc(CNc2cc(C(N)=O)c(Cl)cc2Cl)cc1 431102427 SJBHJEHNHLGSBN-UHFFFAOYSA-N 396.277 5.243 30 20 GKED O=C(c1c(Cl)cc(F)cc1Cl)N1CCC(C(F)(F)F)(C(F)(F)F)C1 431839099 AWEKLLARBYUNBR-UHFFFAOYSA-N 398.105 5.089 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)cc1F 432244406 BNBOQHIGAYLOER-SFTDATJTSA-N 399.425 5.913 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3ccc(OC(C)C)c(C#N)c3)o2)cc1 435436731 HLYXIVMLLWTMIS-UHFFFAOYSA-N 388.423 5.060 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1 438643945 ADTGEDHINLDAEB-UHFFFAOYSA-N 377.366 5.146 30 20 GKED CN(C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1ccc(C#N)cc1 440054671 PXISXXOJFTVNET-UHFFFAOYSA-N 384.407 5.165 30 20 GKED O=C(N[C@H](c1cc(F)ccc1F)C(F)F)c1ccc(CCC(F)(F)F)cc1 447711359 XBANKPZCNNHXQY-OAHLLOKOSA-N 393.302 5.196 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)cc1 458807132 XEIFTLXZEKLAQD-DHIUTWEWSA-N 391.515 5.367 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@@H]3CCC[C@H]32)c1 460411755 ZVJNAJYBFMYYRK-MGPUTAFESA-N 380.875 5.409 30 20 GKED N#CCc1ccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)cc1 464090693 GRAMYVZVAUQGEC-UHFFFAOYSA-N 393.849 5.410 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(-c3ccco3)cc2F)c1 470554682 AIIOAJQRVUQARN-UHFFFAOYSA-N 378.403 5.145 30 20 GKED COc1c(F)cc(F)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 472506197 TUIKDFYHOAXBPO-UHFFFAOYSA-N 396.418 5.249 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-n2cnc3ccccc32)cc1)c1ccccc1 474429215 UDZXCBFKNDFVDQ-LJQANCHMSA-N 380.451 5.052 30 20 GKED N#CC[C@H](CC(=O)NCc1ccccc1COCc1ccccc1)c1ccccc1 474891066 MJIYKEYBVODZEJ-HSZRJFAPSA-N 398.506 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1COc2ccc(OCC)cc2C1 476131481 BZBGHEVSNZNVNM-IBGZPJMESA-N 379.500 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2cc(C)cc(C)c2)C1=O 476784174 BSYJNPHODGCBAR-JOCHJYFZSA-N 390.527 5.147 30 20 GKED N#CC[C@H](Cc1nc(-c2ccc(Oc3ccccc3)nc2)no1)c1ccccc1 481921571 WTFZPFXJPAYNHF-GOSISDBHSA-N 382.423 5.164 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1cccc(F)c1F)C(F)(F)F 482421660 ZNWAUQPEDCLEFD-HNNXBMFYSA-N 390.377 5.028 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@@H](C)C#N 482537738 SYWJHWJDIWKETJ-YOEHRIQHSA-N 388.920 5.388 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc4cc(Cl)ccc4o3)s2)cc1 487257699 FMUOJSIVFLDYPM-UHFFFAOYSA-N 393.855 5.257 30 20 GKED C[C@@H](CC(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 498779710 DMPWRZSMWCJNDZ-HNNXBMFYSA-N 390.405 5.520 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N(C)C[C@H](C)C#N)cc2Cl)cc1 509226765 LVUONPDQXUUBJS-CYBMUJFWSA-N 389.908 5.123 30 20 GKED CCCCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 510055450 LCISHNWCZAPDLP-HXUWFJFHSA-N 381.907 5.792 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Br)c3cccnc23)cc1 511933256 CWUGEJSTYGAIRZ-UHFFFAOYSA-N 394.272 5.051 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cc1 514575162 AGQPOWJTGGOELT-QFIPXVFZSA-N 399.881 5.438 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1cccc(Cl)c1 515636794 JVAXKRSQKSMIGY-UHFFFAOYSA-N 380.831 5.050 30 20 GKED C=CCN(C(=O)CCCOC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 516072227 AFISNQQMLOTWPB-UHFFFAOYSA-N 392.524 5.423 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 517483341 ZADAGIOGWWFPHO-DNQXCXABSA-N 392.458 5.641 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccc2ccccc2c1 518652830 GADNHXNPUHPPCE-INIZCTEOSA-N 392.549 5.822 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCc1nc2cc(Cl)ccc2s1 519925022 ITYGGAWCXCJNEG-UHFFFAOYSA-N 397.931 5.193 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520941361 LIGSZTLHGXRUHA-FUHWJXTLSA-N 397.544 5.752 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 522283573 QVHGJUIPIYVHNS-UHFFFAOYSA-N 393.468 5.618 30 20 GKED N#Cc1cc(NC(=O)N(CC2CC2)C2CCCCC2)ccc1OCC(F)(F)F 524257808 CNKZZQMNZHTNMU-UHFFFAOYSA-N 395.425 5.076 30 20 GKED CC(C)OCc1cccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 524457058 CDGBBAYUPNSEDK-UHFFFAOYSA-N 386.495 5.674 30 20 GKED CC(C)c1ccccc1-n1c(SCCC(C)(C)C#N)nnc1-c1cccnc1 525504064 ZRXOTUKXMHVVDL-UHFFFAOYSA-N 391.544 5.485 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N(C[C@H](C)C#N)C1CC1 533589876 JIAZVWPYMDWHJR-OAHLLOKOSA-N 397.450 5.091 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccnc(SCC(F)(F)F)c2)c(C#N)s1 536972997 DRCHRLGJOQQOIZ-UHFFFAOYSA-N 399.463 5.219 30 20 GKED C[C@@H](NC(=O)c1cccnc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 541133742 WBLSUPCTGMVDJS-CQSZACIVSA-N 395.384 5.130 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2cnco2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542932592 DTMUHAVRXIPWCE-QGZVFWFLSA-N 393.446 5.371 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc1 552987665 AYZPMVPCRCZSES-UHFFFAOYSA-N 382.341 5.622 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3cc(Cl)ccc3C(F)(F)F)on2)c1 558227292 MBOJVSJREGCMLE-UHFFFAOYSA-N 391.736 5.138 30 20 GKED CC(C)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(Cl)cc1 577128712 GEVORJHXPJEYQJ-NRFANRHFSA-N 381.907 5.283 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1csc(-c2ccccc2)n1 588337922 XKUZITKBRBFOEI-OALUTQOASA-N 388.496 5.114 30 20 GKED C[C@H](NC(=O)Nc1ccc(F)cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 590334871 GXWGZPTZPXVMRL-VIFPVBQESA-N 394.290 5.746 30 20 GKED COc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1C(F)(F)F 597179146 GPRBIYOOIQILQI-LBPRGKRZSA-N 394.418 5.218 30 20 GKED CCn1nc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1C 608877296 YLOBWIHJSLSXGZ-UHFFFAOYSA-N 394.862 5.090 30 20 GKED CCc1c(C)sc(NC(=O)Cc2csc(-c3ccc(C)cc3)n2)c1C#N 609033139 RKFQTYSBZFPXPK-UHFFFAOYSA-N 381.526 5.104 30 20 GKED CCCCN(CC(F)(F)F)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609500328 CFDHQPSFBPXRNB-UHFFFAOYSA-N 390.405 5.350 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@H](c3ccco3)C2)cc1 609529614 ULGLBXFDUXQOCC-IBGZPJMESA-N 388.492 5.073 30 20 GKED N#Cc1cc(C(F)(F)F)ccc1N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 610715099 GVFZETHFPHXEAR-PHIMTYICSA-N 390.249 5.144 30 20 GKED Fc1ccc(-c2noc([C@H](C[C@@H]3CCCO3)C(F)(F)F)n2)c(C(F)(F)F)c1 650219308 AAMBFFGRJMTUFX-CABZTGNLSA-N 398.278 5.110 30 20 GKED O=C(NC[C@@H]1CCCCC1(F)F)NC(CCC(F)(F)F)CCC(F)(F)F 661255478 IHNCJZSKCXZHJL-JTQLQIEISA-N 398.338 5.165 30 20 GKED Cc1noc(C(F)F)c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 673812084 PHWGIAWRHMEMEZ-LLVKDONJSA-N 393.802 5.188 30 20 GKED COc1ccccc1C(C)(C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728687501 IMSPGFZCKXJDFE-OAQYLSRUSA-N 399.494 5.407 30 20 GKED N#CCOc1cccc(/C=C\C(=O)c2ccc(OCc3ccc(F)cc3)cc2)c1 730151013 ZWAQCZOCLPJUGF-MLPAPPSSSA-N 387.410 5.203 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 730421533 LWMSSLLMIOOQHI-KRWDZBQOSA-N 396.487 5.478 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1 730916799 AEHBBGBIOGSXHL-SFHVURJKSA-N 392.524 5.485 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(Oc2ccc(Cl)cn2)cc1 743007600 HROQBPHSZUFHGS-UHFFFAOYSA-N 380.860 5.208 30 20 GKED O=C(Nc1cccc(C=NNc2ccc(Cl)nc2)c1)c1ccccc1Cl 743450663 WCDXEDYMPWCQQS-UHFFFAOYSA-N 385.254 5.087 30 20 GKED C[C@@H]1CN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)[C@H]1c1ccccc1 743626609 YBAKEJSYPQKGKL-OPAMFIHVSA-N 387.508 5.189 30 20 GKED CC(C)CN(C(=S)Nc1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 745687042 GFSVWRARSSPNSK-UHFFFAOYSA-N 378.328 5.724 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(C)c1/C=C\C(=O)c1ccc(-c2ccncc2)cc1 745990109 KFAWPVRHQUIKSI-QXMHVHEDSA-N 397.453 5.586 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746657998 ALLUSSLCAWMESQ-DQEYMECFSA-N 397.522 6.347 30 20 GKED COc1ccccc1C(C)(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746778622 OXNSRYFGQOSWMA-NRFANRHFSA-N 384.479 5.267 30 20 GKED COc1cc(C(=O)/C=C\c2cc(Cl)c3c(c2)OCCCO3)ccc1SC 747614287 ALYIUMHGBPBNLY-XQRVVYSFSA-N 390.888 5.128 30 20 GKED N#Cc1ccc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)s1 748998146 LEMSTDMABKYJQI-AUWJEWJLSA-N 375.222 5.307 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 751336909 MHURLLIJVUUDTE-OAHLLOKOSA-N 377.875 5.177 30 20 GKED C=CCOc1ccc(CN[C@H]2CCOc3c2ccc(Cl)c3Cl)cc1OC 752987394 USOVGNCTJWSAIN-INIZCTEOSA-N 394.298 5.180 30 20 GKED C=C[C@H](CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O)c1ccccc1 759781861 MJFLNEMZJLAJFD-MRXNPFEDSA-N 390.508 5.121 30 20 GKED O=C(/C=C/c1ccc(Cl)nc1Cl)c1cc(Br)ccc1F 761479725 MSQBIPFMXLZRET-ORCRQEGFSA-N 375.024 5.186 30 20 GKED C#CCCOc1ccc(CNc2ccc(OC)c(NC(=O)OC(C)(C)C)c2)cc1 770528678 UYNVXQFAPIBZFF-UHFFFAOYSA-N 396.487 5.056 30 20 GKED Cc1cccc(-c2nnc([C@H](C)Sc3nc4c(cc3C#N)CCCC4)o2)c1 775057040 YDAGCPGVEJNIQA-AWEZNQCLSA-N 376.485 5.044 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OCc2cccnc2)cc1 776826125 LLUUHWRQQZSJBV-UHFFFAOYSA-N 376.481 5.191 30 20 GKED C=C(C)[C@@H]1CC=C(COC(=O)[C@H](C)c2c(C)nn(CC(F)(F)F)c2C)CC1 778312232 GUDVOKCMTXYVTG-CXAGYDPISA-N 384.442 5.012 30 20 GKED CCCn1c(C(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc2ccccc21 786925868 JGYQNIDNUJZRSR-SFHVURJKSA-N 383.451 5.046 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccc(Br)c2)CC2CC2)c1 788678065 NZZMEAZUPGQOHU-UHFFFAOYSA-N 399.357 5.039 30 20 GKED CC(C)(C)n1cc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)nn1 790210153 JHOZGUGTZMGPBO-LGMDPLHJSA-N 388.496 5.066 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(C(F)(F)F)c2)CC1)c1nccc2ccccc12 792094388 NYBBCELDHWELIU-GOSISDBHSA-N 380.369 5.162 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 806207600 UJXYVTOADZBHLT-VGOFRKELSA-N 398.466 5.361 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)Cc1ccc(Cl)cc1 813211081 CXWTWMRLDPUQLL-LRDDRELGSA-N 380.797 5.199 30 20 GKED C[C@H](CCCCNC(=O)OC(C)(C)C)NC1CCC(C#N)(c2ccccc2)CC1 813874202 GCDRADNNWSULQX-JVIIGWRGSA-N 399.579 5.064 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1 819440585 TURFCBKXQURJTK-SUMWQHHRSA-N 396.434 5.125 30 20 GKED COc1cc([C@@H](C)N[C@H]2CCCc3cc(C#N)ccc32)ccc1SC(F)F 841762949 SOZNCTCPNUYFQE-ACJLOTCBSA-N 388.483 5.610 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Br)s1)c1nc(C2CC2)cs1 842941126 ODRCRVQGBXWMRN-LBPRGKRZSA-N 395.347 5.044 30 20 GKED CN(C(=O)OC(C)(C)C)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 858249484 VLFBFQZXXUGLNQ-UHFFFAOYSA-N 379.504 5.471 30 20 GKED CCOc1cc(Br)c(N[C@@H](C)c2cccc(C#N)c2)cc1OCC 864007440 YCDOTKQARRCFEZ-ZDUSSCGKSA-N 389.293 5.291 30 20 GKED CCOC(=O)Nc1ccc(Br)cc1N[C@H](C)c1cccc(C#N)c1 864021157 ICZGJSSTPGPNBS-GFCCVEGCSA-N 388.265 5.062 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1ccccc1SC(F)(F)F 914722333 UPOHVWAWNFWSDR-UHFFFAOYSA-N 398.409 5.346 30 20 GKED O=C1CCc2cc(C(=O)/C=C/c3csc(-c4ccc(Cl)cc4)n3)ccc2N1 915993658 VVEUHEGPSXJZLA-VQHVLOKHSA-N 394.883 5.244 30 20 GKED O=[N+]([O-])c1ccc(-c2ccc(C=NNc3ccccc3)o2)c(Br)c1 916245996 RMDGFGKPAMKDNS-UHFFFAOYSA-N 386.205 5.063 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=Cc1ccsc1 916273250 VQKZBZULSYIOGS-UHFFFAOYSA-N 385.901 5.031 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)Oc3ccccc3Cl)n2)cc1 916974827 RTPALUUNYZLPRD-GOEBONIOSA-N 396.899 5.416 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1oc2ccc(Cl)cc2c1C 920101541 DAGUQUUDOOEWAH-INIZCTEOSA-N 390.826 5.390 30 20 GKED Cc1cc(C)c(C(=O)O)cc1/C=C/C(=O)c1ccccc1OCc1ccccc1 1776126625 ROCAMYXBRIDKJZ-OUKQBFOZSA-N 386.447 5.477 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1nc2cc(Cl)ccc2n1C(C)C 1776786847 TZVPACLMKQNKQQ-KRWDZBQOSA-N 393.959 5.564 30 20 GKED COc1cc(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)cc2ccccc12 1777264290 SPSJRAZSUSDQSI-QXMHVHEDSA-N 397.430 5.299 30 20 GKED C=CCCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC(C)(C)C)CC1 1826331869 YRTFTLUIKMDDEI-FQEVSTJZSA-N 390.612 5.035 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N[C@@H](C)c1ccc(C#N)cc1 26123279 KITNWTRBKMCJAW-LBPRGKRZSA-N 381.888 5.135 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ncc(-c2ccccc2)o1 32787779 PVMCVSGQMSVISB-UHFFFAOYSA-N 388.496 5.002 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)N(C)Cc1cccc(C#N)c1 33045510 VGGWQBARUOTBMY-UHFFFAOYSA-N 391.540 5.175 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc2nc(C3CC3)sc2c1 58454068 SHHNUZDYFJGXPQ-UHFFFAOYSA-N 393.512 5.402 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2cccc(OC(F)F)c2)ccc1OC 60947811 LBEPJHRCSRSIKL-HNNXBMFYSA-N 377.431 5.102 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(Br)cc1 63274627 QARKGXPSRLCTDV-AATRIKPKSA-N 376.300 5.530 30 20 GKED N#Cc1cccc(NC(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)c1 65029143 DZPWEKXNTGWBKP-UHFFFAOYSA-N 390.830 5.108 30 20 GKED CCN(Cc1csc(-c2cccc(OC)c2)n1)[C@H](C)c1ccc(C#N)cc1 108815289 CHNHHRVAKQQUPE-MRXNPFEDSA-N 377.513 5.273 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCc1cccc(C#N)c1)C1CC1 121499872 KMYLXXVKMQIQTK-AWEZNQCLSA-N 387.405 5.012 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(Cl)cc3)n2)cc1 121893713 WXOURNJRIXHFSA-GOSISDBHSA-N 391.883 5.144 30 20 GKED COC1CCC(CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 136726940 ZNAPXVFVXALPKD-IMRCBTMISA-N 388.920 5.235 30 20 GKED CC(C)C[C@@H]1CCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 154204513 LPNHLVVQXZIYBZ-NRFANRHFSA-N 391.515 5.374 30 20 GKED COc1ccccc1-c1nc(CNc2ccccc2S[C@H](C)CC#N)cs1 171000030 OEQKBGRVZQPHJN-OAHLLOKOSA-N 395.553 5.825 30 20 GKED C[C@@H](C#N)CNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 171843513 FENNZBWBGDBXEC-ZDUSSCGKSA-N 384.888 5.268 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(COC3CCCCC3)c2)c1 175695965 DEQAYJVXEMGZME-UHFFFAOYSA-N 380.513 5.404 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)[C@H](C#N)c3nc(C(C)C)cs3)o2)cc1 177771913 GZKSBVMDKHDKHO-INIZCTEOSA-N 379.485 5.039 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 178709811 GEBJYLJYVQPQHF-ZDUSSCGKSA-N 398.800 5.365 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/Sc3ccccc3)n2)cc1 193665114 SKNQSYXBKSRFHD-DOJUMQAQSA-N 387.489 5.164 30 20 GKED CC1(C)OB(c2ccc3cc(-c4ccc5ccccc5c4)ccc3c2)OC1(C)C 200582901 FNSPLMHDWSEQMJ-UHFFFAOYSA-N 380.296 5.959 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2ccc(C3CCCCC3)cc2)cs1 214257490 ZDEXZAAOBKWREE-YPKPFQOOSA-N 382.529 5.460 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2ccc(-c3ccc(F)cc3)s2)c1 237022890 DHJHKCCVQRSIBM-IBGZPJMESA-N 380.488 5.525 30 20 GKED O=C(Nc1ccc(N=Cc2cc3ccccc3nc2O)cc1Cl)c1ccco1 255342827 PQGZYYAIYZFYMC-UHFFFAOYSA-N 391.814 5.190 30 20 GKED Cc1cccc([C@@H]2CCCN2C(O)=Nc2nc(C3CCOCC3)cs2)c1C 329464412 UXYAEOMTLSACSC-IBGZPJMESA-N 385.533 5.037 30 20 GKED CC1(C)CCCC[C@@H]1/C(O)=N/C1(c2noc([C@H]3CCOC3)n2)CCCCCC1 329877212 IYTYNHCEEQCMLU-DLBZAZTESA-N 389.540 5.296 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@H]1CCSc2ccc(F)cc21 330327325 VMQCRAFKHPFBSH-DOMZBBRYSA-N 392.521 5.026 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cc(Cl)cc(C(F)(F)F)c3)[nH]c12 426867315 UCEKLIMMUNRLCN-ZDUSSCGKSA-N 377.753 5.034 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 429074204 GBFAUHDWKUOPLN-UHFFFAOYSA-N 391.393 5.052 30 20 GKED CC(C)n1cc2cc(NC(=O)N[C@H](CCCC#N)c3ccccc3)ccc2n1 432956995 CHGGAHOTZPXOFD-HXUWFJFHSA-N 375.476 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C2CC2)cc1F 433149139 SKXBFHASMAIOFA-CQSZACIVSA-N 383.492 5.419 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1ccc(SCc2cccnc2)cc1 433222833 XOJVETQWTJWRMX-FQEVSTJZSA-N 387.508 5.085 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 437272999 ZLTGGWSWDOTMAY-MAUKXSAKSA-N 392.808 5.271 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(Oc2nccc(C)n2)cc1 441107772 CIHZXIWVHGPOBP-UHFFFAOYSA-N 380.492 5.178 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C2(c3ccc(C#N)cc3)CC2)c1C 444173754 DBUOCLKNCZVXMM-UHFFFAOYSA-N 376.500 5.242 30 20 GKED CC(F)(F)CCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 454486942 OWVNIGBGMPKNBY-INIZCTEOSA-N 377.822 5.162 30 20 GKED Cc1cc(F)ccc1C1CCN(C(=O)Nc2ccc(CC#N)cc2Cl)CC1 455724542 CECFZMJQRNZOLB-UHFFFAOYSA-N 385.870 5.265 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)CCCCOc1cccc(C#N)c1 460251657 DVEZUGZTQIBEHE-UHFFFAOYSA-N 396.556 5.696 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)C1(C#N)CCC1 460327243 FJJBDIQZXNDLAS-UHFFFAOYSA-N 390.462 5.364 30 20 GKED N#CCCCc1nc(-c2ccc(Oc3cccc(Cl)c3Cl)nc2)no1 463047144 FPHZNSIIQAJDQY-UHFFFAOYSA-N 375.215 5.077 30 20 GKED COc1cccc(-c2nc(CN3CCC[C@H]3[C@@H](C#N)c3ccccc3)cs2)c1 464823352 QCFJOCHETHSRSS-VXKWHMMOSA-N 389.524 5.090 30 20 GKED Cc1csc(-c2cccc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)c2)n1 464960949 LRADYWPKOMSHDG-SFTDATJTSA-N 387.508 5.031 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cc(Cl)ccc1OCC1CCC1 466656054 UZTOSCHWBYLVDS-UHFFFAOYSA-N 387.867 5.060 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](CC)c2nc(C(F)(F)F)cs2)c1 467708451 FZUJYOVVZOTXOE-AWEZNQCLSA-N 399.438 5.390 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2OC(F)F)ccc(C(F)(F)F)c1F 468011181 GRFLNTZDGPSRAE-UHFFFAOYSA-N 381.247 5.146 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCCc4c(Cl)cccc43)ccc21 469155646 DDVKJDYYKRMYBL-NRFANRHFSA-N 393.918 5.412 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2)ns1 469255741 OZVRDMJRDMDWFR-AWEZNQCLSA-N 379.510 5.457 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)c1ccc(Sc2ccccc2C#N)cc1 470622285 GAZVPZOUUFRWQU-CXAGYDPISA-N 390.430 5.122 30 20 GKED Cc1c(NC(=O)Nc2cccc(OCCCC#N)c2)cccc1C(F)(F)F 473828425 JWGWNVPLOFGKMC-UHFFFAOYSA-N 377.366 5.340 30 20 GKED Cc1nc(NC(=O)C[C@H](CC#N)c2ccccc2)sc1Cc1ccccc1F 474970753 FODZTQSZGLSRIG-KRWDZBQOSA-N 393.487 5.208 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1Cc1ccc(F)cc1 475555657 XZZBHSJTPDQJCW-NRFANRHFSA-N 380.507 5.917 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)[C@H]1CCC(F)(F)C1 481069770 KTLNJNZVOPRLQT-CMPLNLGQSA-N 389.286 5.251 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccnc(Oc2ccc(F)cc2F)c1)c1ccccc1 484267107 IRSPTDMTCCAOOS-INIZCTEOSA-N 393.393 5.178 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cc(Cl)cc(C(F)(F)F)c2)c1 488670885 CLOBKCFLFRZJIX-UHFFFAOYSA-N 382.769 5.294 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@@H](C)Cc1ccccc1OC 499702501 DRRGPZZSZZQVGH-HNNXBMFYSA-N 377.937 5.194 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(SCc2ccccc2Cl)cn1 499787645 VKNGHGAURCDNJW-UHFFFAOYSA-N 385.901 5.213 30 20 GKED N#C[C@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1F 505982413 SGDBTXPMXDTHIV-NRFANRHFSA-N 376.456 5.113 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)c1 506512973 WPQBBCPWYRQQGX-UHFFFAOYSA-N 399.853 5.122 30 20 GKED CCN(C(=O)CSc1cccc(C(F)(F)F)c1)[C@@H](C)c1ccc(C#N)cc1 509584321 NFHWDIQDEHKFQZ-AWEZNQCLSA-N 392.446 5.279 30 20 GKED C=C(C)CN(Cc1ccc(OCc2ccncc2)cc1)Cc1cnn(C(C)C)c1 512517576 YFXUIQIKAWPEAS-UHFFFAOYSA-N 390.531 5.016 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 513664331 TWRZHXQZKOLWAS-VGSWGCGISA-N 378.472 5.130 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2cccc(OCCCC#N)c2)ccc1C(C)C 515616487 JMXZPMCDNFNNCG-SFHVURJKSA-N 380.488 5.207 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 515769050 UFSBFGSJVKCUSY-UHFFFAOYSA-N 382.435 5.087 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 517842030 XZYULUKTFULJOF-UHFFFAOYSA-N 399.475 5.094 30 20 GKED CC(C)Oc1ccc(NC(=O)CCCCOc2cccc(C#N)c2)cc1Cl 520323052 NTAKLKFHAOHYFJ-UHFFFAOYSA-N 386.879 5.187 30 20 GKED CC(C)Oc1ccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 520856625 LLFJLCMQOWJQTK-INIZCTEOSA-N 383.517 5.047 30 20 GKED CSCc1cccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 521929104 CQJPEWRINYIZFW-UHFFFAOYSA-N 388.492 5.660 30 20 GKED COc1ccc(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)cc1 522573968 JTGQJKZEUJXRSF-UHFFFAOYSA-N 378.815 5.265 30 20 GKED CC[C@H](C)Oc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccn1 539679783 MEOVUPAVVCWIEE-MAUKXSAKSA-N 391.496 5.181 30 20 GKED N#CCC1CCN(C(=O)N[C@H](c2ccccc2)[C@H]2CCCc3ccccc32)CC1 542853559 FZNNCZPVJSBZNX-BJKOFHAPSA-N 387.527 5.183 30 20 GKED N#Cc1ccc(C[S@@](=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1F 549681301 HQDQAANFEDRFKD-QFQXNSOFSA-N 383.875 5.389 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc[nH]c3C3CC3)cc2Cl)c1 550299797 PHYPIOMFSANETR-UHFFFAOYSA-N 391.858 5.248 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(OC(C)C)cc1C(F)(F)F)c1ccccc1 556035002 XVTXUHXHIHTMJY-OAHLLOKOSA-N 377.406 5.791 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1O[C@H](C)c1ccccc1)c1ccc(C#N)cc1 557490753 RGMYYCVKJZMJHT-QZTJIDSGSA-N 385.467 5.581 30 20 GKED CCCN(CCC(=O)Nc1cc(Cl)ccc1Cl)Cc1ccc(C#N)cc1 559187002 JHLOPUFIMZOKSO-UHFFFAOYSA-N 390.314 5.106 30 20 GKED N#CCCC[C@H](NCc1cc([N+](=O)[O-])ccc1C(F)(F)F)c1ccccc1 559266446 CIRCAZDGHBSYCC-SFHVURJKSA-N 377.366 5.138 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC1Cc2ccccc2C1 569477366 JHKPHNFLIVNQEK-MRXNPFEDSA-N 379.529 5.007 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 574972867 PWPBTTHJOIMUSN-SFHVURJKSA-N 394.481 6.125 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 592974239 QFBQLDDWYSNOQX-INIZCTEOSA-N 376.412 5.087 30 20 GKED CC1(C)C[C@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)c2cc(F)ccc2O1 593407710 UUKOICYNPULUGM-PMACEKPBSA-N 395.478 5.162 30 20 GKED N#Cc1cccnc1N[C@H](c1ccccc1)c1ccc(Br)cc1F 603871186 YDDHDDAXHIPMCZ-GOSISDBHSA-N 382.236 5.056 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 609056778 UIEXKJVYQMOUGM-GOSISDBHSA-N 388.467 5.180 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2ccccc2n1C 609061310 ZDHQAZWBDVKVID-UHFFFAOYSA-N 395.462 5.190 30 20 GKED C[C@@H](NC(=O)NCc1ccc(C#N)cc1F)c1ccc(Oc2ccccc2)cc1 609240677 ZBXXAPFNDKPBGS-MRXNPFEDSA-N 389.430 5.050 30 20 GKED C=CCN(C(=O)c1cc(Cl)cc([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 609853569 NCFOOKVZRQMIGJ-UHFFFAOYSA-N 399.859 5.205 30 20 GKED CC1CCC(N(C(=O)c2ccc(C#N)cc2)c2cccc(N3CCCC3)c2)CC1 609905633 JCGGEYNCWXHVDH-UHFFFAOYSA-N 387.527 5.384 30 20 GKED C[C@H](NC(=O)NCc1cccc(C#N)c1)c1ccccc1-c1ccc(Cl)cc1 610090303 ZMLDPOUOYVGUIE-INIZCTEOSA-N 389.886 5.439 30 20 GKED C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCC2)c1ccccc1C(F)(F)F 610223347 SFGOURLWMYZWFQ-LLVKDONJSA-N 378.419 5.260 30 20 GKED C[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc(C#N)c1 610323992 MIWPCNCQURSBBY-MRXNPFEDSA-N 382.423 5.105 30 20 GKED C[C@@H](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(C#N)c1 610359285 HGNRTIGFBHPZHD-SNVBAGLBSA-N 386.295 5.087 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1oc2ccccc2c1C 615707816 OOHOXIXDKSUTMZ-KRWDZBQOSA-N 378.472 5.209 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1C(F)(F)F 619126334 OHPAGUPBRSFZPE-UHFFFAOYSA-N 395.265 5.489 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619770323 PQKQCOVPESFSIN-ZDUSSCGKSA-N 390.940 5.003 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)c1ccc(C(F)(F)F)s1 671828718 WUNZVXDWQJHPON-UHFFFAOYSA-N 387.276 5.099 30 20 GKED COc1ccc([C@H](C)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(F)c1 675737158 AYLGCRRICLKLFO-DCAQKATOSA-N 387.339 5.394 30 20 GKED CC(C)[C@H](C)N1Cc2cccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2C1 727705688 XBWCNASWEZKKLI-AWEZNQCLSA-N 398.963 5.381 30 20 GKED Cc1nc(NCc2ccc(OCC#N)cc2)c2cc(-c3ccccc3)sc2n1 727826506 XLRSKCICCFDNOT-UHFFFAOYSA-N 386.480 5.181 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3ccc(O[C@H](C)C#N)cc3)cc2)cs1 728713172 RMOQGILEMXEUMV-CVEARBPZSA-N 377.513 5.260 30 20 GKED O=C(/C=C/c1ccccc1OC(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 729248048 ZHUSJRIHPKWLRB-VMPITWQZSA-N 393.258 5.395 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3sc4c(c3C#N)CCC4)c(F)c2)cc1 730160104 CXAMMNQHMBRRKH-UHFFFAOYSA-N 392.455 5.175 30 20 GKED N#CCCCCOC(=O)[C@H](Oc1cc(Cl)ccc1Cl)c1ccccc1 730369021 HWVWIRUPSCKXJG-GOSISDBHSA-N 378.255 5.351 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccccc1SC[C@H](C)C#N 730954866 MQVRQIAMCHUGMK-GFCCVEGCSA-N 375.950 5.709 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)NC12CC3CC(CC(C3)C1)C2 731320732 LQXMQNITCPLRDG-HILYYZTDSA-N 385.602 5.336 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H]3CCc4ccccc4C3)n2)cc1 732596590 YFYMJRRHELLLQT-UWJYYQICSA-N 397.503 5.053 30 20 GKED O=C1/C(=C/c2nccn2Cc2ccccc2)CCc2cc(SC(F)F)ccc21 734094386 CSYVCMPMSMSFOY-GHRIWEEISA-N 396.462 5.459 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)OCc1cnc(-c2cccs2)o1 739257552 MGDWLQMEXDEJIF-UHFFFAOYSA-N 386.432 5.299 30 20 GKED Cc1nc2ccc(NC(=O)NCc3cccc(-c4ccc(C#N)s4)c3)cc2o1 740433991 BIPVTMQZDGPZMA-UHFFFAOYSA-N 388.452 5.058 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2[C@H]3CC[C@H]2c2ccccc23)cc1 740435278 NKIXCAMROPXAQS-SGNDLWITSA-N 379.463 5.766 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Cl)c(Cl)c1 747105210 QOEDHQWXWAWSMO-PWSUYJOCSA-N 375.280 5.583 30 20 GKED C[C@H]1/C(=C\c2cnc(-c3ccccn3)s2)C(=O)c2cccc(Br)c21 753143847 IQSIMZUTTCIBBN-LUHPIMIVSA-N 397.297 5.351 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)cc1 754320200 OUZBJNBADCSYKD-ZDUSSCGKSA-N 399.878 5.050 30 20 GKED C=C(C)Cn1c(-c2ccncc2)nn(CN2CC[C@H](C)c3ccccc32)c1=S 766337592 HOJJDGVFNREMOJ-KRWDZBQOSA-N 391.544 5.023 30 20 GKED CN(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1F 770105583 FDAJPBLITREVNA-OAHLLOKOSA-N 399.878 5.159 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCCc2nc(-c3ccccn3)cs2)cc1 773005206 QBRAZDGEIOYFCM-MRXNPFEDSA-N 399.947 5.230 30 20 GKED C[C@H](N[C@@H](C)c1ccccc1-c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 776162173 CLLYVSSQFWYFAY-ROUUACIJSA-N 390.914 6.321 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl 780668668 DLGCZVQAZUBURU-XHDPSFHLSA-N 390.270 5.093 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1F 780682858 YSDZNDRNBAQXMJ-LIRRHRJNSA-N 385.414 5.015 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)Nc1cccc(OC(F)(F)F)c1 783730094 YCUHBENENZVVQU-UHFFFAOYSA-N 384.398 5.109 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1csc(Cl)c1 786447461 KZDDWXVXEZTXMS-HNNXBMFYSA-N 396.855 5.155 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccccc3CC)n2)CCC1 791559526 XPZKIRZXTRJUEN-UHFFFAOYSA-N 398.528 5.180 30 20 GKED CCCCc1nc(-c2ccc(OC(=O)C[C@H](CC#N)c3ccccc3)cc2)no1 796661965 NBCBRLSUOYPOQR-IBGZPJMESA-N 389.455 5.072 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)[nH]c2C2CC2)cc1 858457522 QXCDQQWUPYHHJV-QFIPXVFZSA-N 381.479 5.677 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)CCc1ccc(C(F)F)cc1 870139054 MBCUHXOTKPLMOY-LJQANCHMSA-N 398.453 5.029 30 20 GKED COc1cc(C)c(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1OC 916838919 JOVBWSVLZDGSOW-UHFFFAOYSA-N 388.467 5.075 30 20 GKED N#C[C@@H](C(=O)C=C1CCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 918490660 UWVFNDGARRPQKU-AWEZNQCLSA-N 377.296 5.794 30 20 GKED C=CCn1c(-c2ccncc2)nn(CN(C)C2CCC(C(C)(C)C)CC2)c1=S 921046754 QHEIYRJABDCMPM-UHFFFAOYSA-N 399.608 5.156 30 20 GKED CC(C)c1ccc(NN=Cc2cccc(OCc3cccc(C(=O)O)c3)c2)cc1 1776060322 PCBUCARXORNABN-UHFFFAOYSA-N 388.467 5.533 30 20 GKED O=C(O)c1ccccc1COc1cccc(C=NNc2cc(F)cc(Cl)c2)c1 1776091436 MRCCBIBKDHKXJJ-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(C(=O)O)c(O)c2)c2c(c1)C(C)(C)CC2 1776269269 YMWVIEVPBNPGAO-VQHVLOKHSA-N 392.495 5.508 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccccc2)o1 1776354395 CZSQGZVJRWNKHY-PKNBQFBNSA-N 376.408 5.328 30 20 GKED CC(C)c1cccc(C(=O)/C=C\c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)c1 1776375498 TUDFIXKLZLAEJT-YFHOEESVSA-N 376.408 5.370 30 20 GKED CCCCCCCSc1ccc(C(=O)NCCC2(C(=O)O)CCC2)cc1 1776787550 VWACVNSJGCMKAC-UHFFFAOYSA-N 377.550 5.124 30 20 GKED COc1ccc(OC)c(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)c1 1777368081 HCSRNGWHAHQBEB-CLFYSBASSA-N 394.448 5.027 30 20 GKED C=C(C)CN(CC)C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 23242743 OQKDTAYYUZDAGZ-UHFFFAOYSA-N 396.560 5.396 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 25840341 OBPPUBLVYQNMHV-UHFFFAOYSA-N 383.517 5.095 30 20 GKED N#CCCN(C(=O)CSc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 58033754 FCSBLFSVUABUQM-UHFFFAOYSA-N 398.837 5.398 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3sc(C)c(C)c3C#N)o2)c(C)c1 64680332 ZLHRIUFVJQXNHD-UHFFFAOYSA-N 380.469 5.278 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 65852504 NDEBMOLLCZOYNW-UHFFFAOYSA-N 388.492 6.103 30 20 GKED COc1ccc2c(c1)CCCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)C2 66955949 BETCAQUXUGJCIU-MRXNPFEDSA-N 395.528 5.070 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2nccc3ccccc23)cc1 102335749 MTXOJKUJQONCMG-UHFFFAOYSA-N 393.446 5.132 30 20 GKED COc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 109028513 RXVVPECTQOHKQU-OXJNMPFZSA-N 395.528 5.458 30 20 GKED COc1ccc2c(-c3ccccc3)cc(=S)n(CN3CCC(C#N)CC3)c2c1 140827999 OAIQEWRAAQFTLA-UHFFFAOYSA-N 389.524 5.239 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 152496642 OGPXQQCAVDHGLX-UHFFFAOYSA-N 394.862 5.113 30 20 GKED CSc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)ccc1F 155681858 GVCBWLNNTVKPKE-OAHLLOKOSA-N 393.468 5.033 30 20 GKED Cc1nc(-c2ccc(NC(=O)Nc3ccccc3O[C@@H](C)C#N)cc2)cs1 183607362 WEMFLJLHGBQBSY-ZDUSSCGKSA-N 378.457 5.053 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1 185433572 YBURINNEAIGZBT-NXEZZACHSA-N 377.259 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1sc(CC)nc1C 191516794 GCXQMPJMZGQJLF-INIZCTEOSA-N 385.577 6.091 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3csc4ccccc34)n2)cc1 193667361 FKRPXKNXGZQLQH-INIZCTEOSA-N 385.473 5.387 30 20 GKED CC(C)(CCC#N)COC(=O)c1csc(-c2cc(Br)cs2)n1 195052889 HCXMVEGXDMTDSY-UHFFFAOYSA-N 399.335 5.121 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2c(C#N)cnc3ccc(Cl)cc23)c1 301406398 UZURESZILAJLRH-KRWDZBQOSA-N 376.847 5.053 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303289853 MEBGQHIDDJBPID-MSOLQXFVSA-N 396.556 5.776 30 20 GKED Cc1ccc(C)c(CSCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 303476697 NYYUXMANJSQJSD-IBGZPJMESA-N 392.549 5.537 30 20 GKED Cc1cc(Br)c(C(=O)Nc2ccc(C#N)cc2Cl)cc1Cl 387024636 JBQNTQSXCFVJTR-UHFFFAOYSA-N 384.060 5.188 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3cscc3C#N)s2)cc1 410512062 UKBQVZFAAMGSPO-CQSZACIVSA-N 381.526 5.193 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1SCCc2ccccc21 428886766 KZFBUVAUVPFCFL-YWZLYKJASA-N 397.569 5.233 30 20 GKED Cc1[nH]c2ccccc2c1C1=CCN(C(=O)N[C@H](CCC#N)c2ccccc2)CC1 440244114 RFYFJKAAKCHOIE-JOCHJYFZSA-N 398.510 5.320 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(C(=O)N[C@H](C)CC)cc2C)CCCC1(C)C 445241419 WTRCWGUNMDQQHN-XLIONFOSSA-N 385.552 5.122 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)c3c(F)cc(C#N)cc3F)c2C#N)C1 445676703 RQBUVQGPYKAONT-LBPRGKRZSA-N 399.466 5.173 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 447360926 XNRLSPUDSUMHEV-HZPDHXFCSA-N 382.872 5.203 30 20 GKED C=CCC1(C(=O)N2CCC(c3nc(-c4ccncc4)cs3)CC2)CCCCC1 448955810 ZLAHYKLDHYKHHC-UHFFFAOYSA-N 395.572 5.438 30 20 GKED Cc1cccc([C@@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)C(F)(F)F)c1 455175343 FPERHFIUMHDMHQ-RTBURBONSA-N 389.421 5.333 30 20 GKED C=CCN(C(=O)c1nc2ccccc2cc1Cl)c1nc2c(s1)CCCC2 463147747 IUQVJPDWIPFKRQ-UHFFFAOYSA-N 383.904 5.056 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NCc1ccc(C#N)s1 463708197 SEGMFOBEIPUJML-UHFFFAOYSA-N 381.888 5.446 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 464951199 RLXWCOVLIAPFAY-PMACEKPBSA-N 387.508 5.031 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 468879680 GEMZLZGKOXVFRP-QFIPXVFZSA-N 393.506 5.088 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1 475612995 SKEPSYJIASXGKA-UHFFFAOYSA-N 376.406 5.685 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Sc2ccccn2)cc1 476107587 HOVXTTNVJPHOOG-UHFFFAOYSA-N 388.536 6.337 30 20 GKED COC(=O)[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(Cl)cc(Cl)c1 477572596 GQXVRKOHDILFKP-SFHVURJKSA-N 393.270 5.002 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(Oc2cccnc2)c(F)c1 481919158 JMVQBWLQNKGIDW-HSZRJFAPSA-N 387.458 5.442 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc[nH]c2C2CCC2)cc1Cl 485710815 NPMSYESVHVUKQZ-FQEVSTJZSA-N 389.886 5.843 30 20 GKED C[C@H](C(=O)N(CCC#N)C12CC3CC(CC(C3)C1)C2)c1ccc(Cl)s1 486591133 QUYFLFMGFIJHPQ-IVKJLDKCSA-N 376.953 5.216 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1nc2ccccc2n1C(C)C 486807212 FPJKUOJFCRSDCP-INIZCTEOSA-N 379.529 5.386 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Br)c(Cl)c1)c1ccccc1 487443171 GAXATBQALWAJBQ-KRWDZBQOSA-N 391.696 5.267 30 20 GKED N#CCCC[C@H](NC(=O)CSc1cc(Cl)ccc1Cl)c1ccccc1 487485344 MFGFMSZELYTRHQ-KRWDZBQOSA-N 393.339 5.637 30 20 GKED N#C[C@@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccccc1Cl 499948987 XCSWHVJDAXPKLN-OAQYLSRUSA-N 392.911 5.627 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(F)c(F)c2)n1 502725518 IYDOTAIDWXHXKZ-UHFFFAOYSA-N 397.450 5.012 30 20 GKED N#CCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1Cl)CCC2 503656885 ZPYZFYGTRBZHCX-JQIJEIRASA-N 387.870 5.018 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1 505001212 QAPCZVYINZDGED-AWEZNQCLSA-N 396.878 5.391 30 20 GKED N#CCCCCNC(=O)c1sc(-c2ccccc2)cc1OCc1ccccc1 505092830 LNOPSSYUXZBLFB-UHFFFAOYSA-N 390.508 5.418 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N(C)c2ccccc2C#N)cc1OCC 508089188 QYQRIBKMIHDTPX-UHFFFAOYSA-N 386.879 5.066 30 20 GKED CSc1ccc(NC(=O)CSc2nc(-c3ccccc3)ccc2C#N)cc1 510205135 FFRPPCRBXFDNLQ-UHFFFAOYSA-N 391.521 5.073 30 20 GKED CCCN(CCC)C(=O)c1ccc(NCc2ccc(F)c(C#N)c2Cl)cc1 512586330 IWPXUTHZRIXBCZ-UHFFFAOYSA-N 387.886 5.225 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCCC2 514869530 FNFDJCZSSUTZEB-NSHDSACASA-N 376.934 5.271 30 20 GKED CCc1cc(C#N)c(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)s1 515715259 QGFOZCDJWREBGN-UHFFFAOYSA-N 389.691 5.160 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 515759078 GRDJTTLEWXXJBB-IBGZPJMESA-N 399.494 5.193 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccccc1SCCC#N 518123421 JZKALBXGJDTPQM-UHFFFAOYSA-N 385.539 5.438 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)CNc2ccccc2SC[C@H](C)C#N)cc1 519425155 VZMVLLPFFRQHTF-IAGOWNOFSA-N 381.545 5.502 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccsc3)cc2)cc1 520595282 RSTUHNDEXLCINB-NRFANRHFSA-N 389.480 5.781 30 20 GKED CC(C)Sc1ccccc1C(=O)NC1CCC(Oc2ccccc2C#N)CC1 521111982 YNKNAWDFCRWMQP-UHFFFAOYSA-N 394.540 5.179 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 521796707 FPGRBEQTOXUGCR-SFHVURJKSA-N 382.529 5.577 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](c1ccccc1)C(C)(C)C 533489453 XOEGAXLFZRPPGH-HTAPYJJXSA-N 395.572 5.396 30 20 GKED N#CCc1ccc(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 537995917 PDPSBNKLLPGSNW-GOSISDBHSA-N 392.808 5.306 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 545511937 MDHDWQLDMZDOAN-CQSZACIVSA-N 377.366 5.203 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(c3cccc(OC)c3)CC2)c1 547752863 VMNKBCGAPJXDKT-UHFFFAOYSA-N 380.488 5.062 30 20 GKED N#CCCN(C(=O)c1coc(C2CCCCC2)n1)C12CC3CC(CC(C3)C1)C2 548601917 UAQQSIBBXUXKCC-UHFFFAOYSA-N 381.520 5.047 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c2ncccc12)c1nc2cc(Cl)ccc2s1 549080654 BNJTWGDTXZYDBF-CYBMUJFWSA-N 398.274 5.641 30 20 GKED O=[N+]([O-])c1ccc(C(F)(F)F)c(CN[C@H](c2ccc(F)cc2)C(F)(F)F)c1 549996739 JTBLAGXFAFUGCC-CQSZACIVSA-N 396.262 5.146 30 20 GKED C[C@H](N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1)c1ccc(C#N)cc1 551563487 HNHJZOOPSDGZHS-BTYIYWSLSA-N 388.433 5.396 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1 554442685 OGCZDNZFLWBHKN-FUHIMQAGSA-N 379.529 5.696 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(Br)c1Cl)c1ccccc1 555047010 WKOHUFOFKBNYJT-CQSZACIVSA-N 392.684 5.269 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)NCC2(CC#N)CC2)nc1-c1ccccc1 562386986 CJPHQUJFYUKGJP-SFHVURJKSA-N 392.503 5.005 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C4CCCC4)cc3)n2)cc1 568113942 XFABUOHIKVPZQH-NRFANRHFSA-N 397.503 5.829 30 20 GKED C=CCn1c(SCc2cc(Cl)cc(Cl)c2)nnc1-c1ccncc1 581398405 MPXDXIXIJZCEPA-UHFFFAOYSA-N 377.300 5.125 30 20 GKED CC(C)(CCC#N)CNC(=O)[C@H](Sc1cc(F)ccc1F)c1ccccc1 581844295 DPZNNPPVJCAOBR-LJQANCHMSA-N 388.483 5.244 30 20 GKED N#CCCCCCc1nc(-c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)no1 589136579 AWKSGYGNXHMGAR-UHFFFAOYSA-N 378.388 5.064 30 20 GKED C=C(C)COc1cccc(NC(=O)NCc2ccnc(Oc3ccccc3)c2)c1 589739595 XEVHERKHANXQMU-UHFFFAOYSA-N 389.455 5.151 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1nnc(Cc2ccccc2)n1-c1ccccc1 590742179 DROPRNQOYUVIDG-JOCHJYFZSA-N 396.519 5.085 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Nc1ccc2oc(C(C)C)nc2c1 602562141 DNNSSQCULQPMQD-HNNXBMFYSA-N 383.517 5.028 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N(Cc2cccs2)C2CC2)cc1 603638022 CROXEAFXVWJSCB-UHFFFAOYSA-N 388.492 5.004 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 606944379 PKQOMPAQWWNXQH-UHFFFAOYSA-N 399.922 5.802 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 608917601 LDTKOIAGLXUUKF-OAHLLOKOSA-N 389.421 5.258 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609031073 AEIYTAHCBDHXND-MSOLQXFVSA-N 385.294 5.183 30 20 GKED N#Cc1ccccc1NC(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 609092498 AYSYKMRDSVOJNC-UHFFFAOYSA-N 398.397 5.030 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)C1CCCCC1 609556412 HTPIRNYOVCDXDV-UHFFFAOYSA-N 391.515 5.632 30 20 GKED Cc1cccc([C@H](C)C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 610040716 AXFROTCJGZILHE-IBGZPJMESA-N 384.479 5.382 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 610140763 NNCYQXCIHPJWKF-SFHVURJKSA-N 375.516 5.883 30 20 GKED CC(C)N(CC(F)(F)F)C(=O)c1ccc(Sc2ccccc2C#N)cc1 610501448 BHNXCXLTSAQGFU-UHFFFAOYSA-N 378.419 5.122 30 20 GKED Cc1oc(C(C)C)nc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 671751413 MFOROEOWDTVSEI-LLVKDONJSA-N 393.390 5.225 30 20 GKED C=CCC[C@H](Nc1ccc2nnc(C3CC3)n2n1)c1ccc(C(F)(F)F)cc1 676728871 DUCDSBYAPNRBDH-INIZCTEOSA-N 387.409 5.140 30 20 GKED FC(F)Oc1ccc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)nc1 678310681 KXNNDZMSJDDYEP-HTQZYQBOSA-N 378.263 5.004 30 20 GKED COc1cc(C(C)=NNc2ccc(OC(F)F)cc2)ccc1SC(F)F 726426776 GNQFFPVASXFBTH-UHFFFAOYSA-N 388.386 5.447 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=S)Nc2ccc(C#N)c(Cl)c2)c1 726475771 TXLGDJFNNXEVKB-UHFFFAOYSA-N 395.915 5.512 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)c1 727330842 WJJOXJKVRMRTBO-UHFFFAOYSA-N 382.460 5.241 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(OCc3ccc(F)cc3)cc2)cc1O 727685510 PPQLQPRYCNQPSL-UUILKARUSA-N 378.399 5.015 30 20 GKED Cc1ccccc1-c1cccc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)c1 729643590 CEOWLDBPPWWOGR-NTEUORMPSA-N 383.447 5.515 30 20 GKED O=C(/C=C/c1ccc2ncccc2c1)c1c[nH]c2cc(Br)ccc12 729937027 KUENOJRUFZXFAX-XBXARRHUSA-N 377.241 5.375 30 20 GKED O=C(/C=C/c1cccc(Oc2ccccc2)c1)c1ccc(C(F)(F)F)nc1O 731564807 UCWPOWSRZJOWPO-PKNBQFBNSA-N 385.341 5.494 30 20 GKED O=C(/C=C\c1ncc(-c2cccc(Br)c2)[nH]1)c1c[nH]c2ccccc12 731936652 BWKISVJXSQOCOQ-HJWRWDBZSA-N 392.256 5.217 30 20 GKED COc1ccc([C@@H](C)OC(=O)CCCCOc2cccc(C#N)c2)cc1Cl 732503551 JAYPKJBYFCGUGM-OAHLLOKOSA-N 387.863 5.074 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)c1 733799738 DVNHEPCHDQIOCZ-CTNGQTDRSA-N 399.922 5.217 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cc(C)n([C@@H](C)c4ccccc4)c3C)[nH]c12 735791936 DJECBZHTHHJYIX-UWJYYQICSA-N 396.494 5.389 30 20 GKED N#Cc1ccc(F)c(CNCc2sc(Sc3ccccc3)nc2Cl)c1 742381905 RICHRGZZRMKJSE-UHFFFAOYSA-N 389.908 5.248 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccc(CC)cc3)o2)cc1 744028700 NVNJDZDZQPINKE-HXUWFJFHSA-N 386.451 5.033 30 20 GKED CC(=NNCc1ccc(C(F)(F)F)cc1)c1c(C)nn(-c2ccccc2)c1C 746490107 PVQLHLFTFQEBGL-UHFFFAOYSA-N 386.421 5.022 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)N[C@H]2CCCC[C@H]2C)cc1 751013598 IZRYRTSMOGJCQL-BEFAXECRSA-N 395.528 5.224 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC/C(C)=C/c2ccc(Cl)cc2)ccc1OC 753852684 FFLWFATTXBNWDY-PRDNPTHXSA-N 384.907 5.223 30 20 GKED CC(=NOCc1ncc(-c2ccccc2C)o1)c1nc2ccccc2n1C(F)F 756859927 YGQKWXZEODATKQ-UHFFFAOYSA-N 396.397 5.336 30 20 GKED C#CC[C@@H](NC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 757764664 YIWIMXGHUUBQEA-NQIIRXRSSA-N 392.549 5.231 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3c(F)cccc3F)n2)cc1 764567335 OOOJDDUFWXIPMD-DZGCQCFKSA-N 382.435 5.377 30 20 GKED C[C@H](NC(=O)c1ccccc1SCC#N)[C@@H](C)c1ccccc1C(F)(F)F 766531516 QKOVUZWSFMRVIH-KGLIPLIRSA-N 392.446 5.243 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(Br)cc1F 767739853 ZUWWZSFOFOVQHY-FPYGCLRLSA-N 399.219 5.067 30 20 GKED COc1cc(C(=O)Nc2ccc(C#N)cc2Cl)ccc1OCc1ccccc1 769729904 KSVHWJLIQPUCAH-UHFFFAOYSA-N 392.842 5.052 30 20 GKED C[C@H](C#N)Oc1ccc(CN(C)[C@H](c2ccc(Cl)cc2)C(F)(F)F)cc1 770323261 FZWGJDCNWVROII-FZKQIMNGSA-N 382.813 5.366 30 20 GKED CC(C)[C@@H]1C[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773982694 LKHZPZTVLNYTSB-MJBXVCDLSA-N 379.312 5.585 30 20 GKED C[C@H](N[C@@H](c1ccc(Br)cc1)C1CCC1)c1ccc(OCC#N)cc1 776157607 COLMARFMEPWKLN-YCRPNKLZSA-N 399.332 5.543 30 20 GKED Cc1cc(-c2cc(C(=O)O[C@@H](C#N)C(C)C)c3cnn(C(C)C)c3n2)c(C)s1 777315806 HNRODOQZRFABSE-IBGZPJMESA-N 396.516 5.063 30 20 GKED N#CCOc1cc(F)ccc1NCc1ccc(OCc2ccccc2F)cc1 779609252 MOCJCSYESDWYLK-UHFFFAOYSA-N 380.394 5.058 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 782383195 MBZXXJNVRUIOSZ-MOPGFXCFSA-N 381.479 5.367 30 20 GKED C[C@@H](OC(=O)c1ccncc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 783827133 HGWIFBYZXMALTC-MRVPVSSYSA-N 381.247 5.176 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(C(C)(C)C#N)cc1 796036735 MZSSGTUGZGMHLU-KRWDZBQOSA-N 392.499 5.104 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cnc4ccccc4c3)n2)cc1 796635025 OJUSMAWSEGWNLO-HXUWFJFHSA-N 397.503 5.476 30 20 GKED C[C@H](Nc1ccc(OCC(F)(F)F)c(Cl)c1)c1ccc(OCC#N)cc1 800497250 CXEYELUAHCAIOU-LBPRGKRZSA-N 384.785 5.357 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnn(Cc3ccccc3)c2Cl)c(C#N)s1 808632053 CHZWYTNDIVZFCR-UHFFFAOYSA-N 398.919 5.068 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cc(Cl)ncc3Cl)c2C#N)[C@H](C)C1 839389345 OJRYSGHKGYBDNO-RKDXNWHRSA-N 380.300 5.260 30 20 GKED N#C[C@@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nc(C2CC2)cs1 842941073 MXNMAFFDNWCCAV-INIZCTEOSA-N 383.904 5.285 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(-c2ccc(Cl)cc2)no1 848602452 CRDKFNGBCZUOLO-OAHLLOKOSA-N 390.871 5.040 30 20 GKED Oc1ccc(N=Cc2cc3ccccc3nc2O)cc1-c1nc2ccccc2s1 912776682 SHTDKDSKLTWGSJ-UHFFFAOYSA-N 397.459 5.673 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(F)c(Cl)c2)cc1 915124462 KISVDQSKKDPRPI-GOSISDBHSA-N 395.890 5.943 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2nc3ccccc3s2)cc1 915180642 QOKIERZBIRWNRQ-HMZRMUTASA-N 395.487 5.604 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\c2ccccc2Cl)cc1 916947630 OWDDZDSEPCVDNP-XNBKMWJZSA-N 380.875 5.214 30 20 GKED CCCCCOc1ccc([C@@H](C)Nc2snc(Cl)c2C#N)cc1OC 917077731 SBCYLCYPWKNMJJ-GFCCVEGCSA-N 379.913 5.419 30 20 GKED O=C(Nc1cccc(F)c1)c1cccc(N=Cc2cc3ccccc3nc2O)c1 917557335 GRIVEYDKEFPMRL-UHFFFAOYSA-N 385.398 5.082 30 20 GKED Cc1ncc(CO)c(C=Nc2ccc(Sc3ccc(Cl)cc3)cc2)c1O 918712763 FRXRSKIKRNEGSD-UHFFFAOYSA-N 384.888 5.143 30 20 GKED O=C(O)c1ccc(NN=C/C=C\c2ccc(OCc3ccccc3)cc2)cc1F 1776075356 BOTXWMHLISKUEG-ALXZNIRBSA-N 390.414 5.214 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccc(Cl)cc1Oc1ccc(Cl)c(F)c1 1776149375 LVTABUUQMRXNQH-CQSZACIVSA-N 398.261 5.434 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2F)c1)C(=O)O 1776470773 HLQNOYGQBMWHAF-CMUBDUJZSA-N 396.439 5.302 30 20 GKED CCCCCCCOc1cccc(CN[C@H]2c3ccccc3C[C@H]2C(=O)O)c1 1776787418 HLMMQIQQOCVYOZ-PKTZIBPZSA-N 381.516 5.124 30 20 GKED C=CCn1c(SCC#N)nnc1-c1cc(-c2ccc(C)cc2)nc2ccccc12 9397830 GADXIXMPENLNNS-UHFFFAOYSA-N 397.507 5.270 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cc(C)ccc2C)[n+]2cccc(C)c2)cc1 41466075 ZBLUKMFBWMZJJS-UHFFFAOYSA-O 389.544 5.259 30 20 GKED CCN(C(=O)c1ccc(C2SCCS2)cc1)[C@H](C)c1ccc(C#N)cc1 45499584 ZEUZNOXXVRLWTD-OAHLLOKOSA-N 382.554 5.260 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccc(Oc4cccnc4)cc3)c2C#N)C1 63262895 FZPBLHFCAKHBDP-AWEZNQCLSA-N 389.480 5.184 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1ccc(F)cc1F 66954219 MDQAERLASLBWPT-STQMWFEESA-N 375.444 5.242 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccc(O)cc2)Cc2ccco2)cc1 104997089 XGLVUYIPZICWFI-UHFFFAOYSA-N 389.455 5.021 30 20 GKED C[C@@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C/c1ccccc1Cl 108251815 GMLCZPVXXFCUMW-VNDWYCCKSA-N 392.933 5.004 30 20 GKED CCN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)[C@H](C)c1cccnc1 115769712 HYBJXHWFOZYYKP-QGZVFWFLSA-N 386.455 5.361 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cccc(CC#N)c1 170974817 RYFBPJCARIXBGW-UHFFFAOYSA-N 389.402 5.030 30 20 GKED Cc1cccn2c(NC(=O)c3cccc(SCC#N)c3)c(-c3ccccc3)nc12 175538665 FZYWWDYQFRUMQU-UHFFFAOYSA-N 398.491 5.178 30 20 GKED CC(C)c1ccc(-c2nc(CS(=O)(=O)CCCC(C)(C)C#N)cs2)cc1 178154787 YICLHJMYWWLLOK-UHFFFAOYSA-N 390.574 5.178 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CCC(C)(C#N)CC3)c(C)c2)n1 272580188 UCWTUXKXVBUYIO-UHFFFAOYSA-N 386.546 5.069 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 303949498 SUZOKULYTRCOAZ-ZDUSSCGKSA-N 377.271 5.407 30 20 GKED CCc1nc([C@H](C)/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)cs1 329388703 UDLHVEREKUSHLF-HOCLYGCPSA-N 386.565 5.230 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(c1ccc(Cl)cc1)c1nc(C(=O)OCC)cs1 411058051 BYTGEGQOYVWHIT-CYBMUJFWSA-N 392.908 5.240 30 20 GKED C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[S@](=O)CCC1(C#N)CCCCC1 417149986 PHBOBSVKHRDHGB-IYJVBRSBSA-N 391.924 5.064 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 433988248 OQMQTPZSDYAEHV-UHFFFAOYSA-N 391.349 5.092 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N=c1[nH]n(C2CCCCC2)cc1C 434181855 HGKDEMFARVZMRB-UHFFFAOYSA-N 380.536 5.615 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1)c1ccccc1 435114571 UJVMCMKGUPPKAW-LEWJYISDSA-N 394.515 5.258 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)N[C@H](CCC#N)c3ccccc3)cc2s1 435185945 ZQTVXRODQWKCMF-OAHLLOKOSA-N 384.892 5.425 30 20 GKED CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 436348613 AHPAURMOHFQIDQ-MOXGXCLJSA-N 395.528 5.015 30 20 GKED CC[C@]1(C)CCCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 437746163 NIQLJVGKMFHSPR-XMMPIXPASA-N 391.515 5.376 30 20 GKED N#CCc1ccc(CN[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1 444746293 XSOJZHZFQAAZHW-QGZVFWFLSA-N 386.339 5.555 30 20 GKED CC(C)N(C)c1ccccc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 446158826 UNUTWZYPSBAUSF-KRWDZBQOSA-N 396.560 5.105 30 20 GKED C=CCN(C(=O)CC(C)(C)C#N)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 447138936 MXVBUPHAUSUNAV-UHFFFAOYSA-N 394.327 5.576 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc([C@H](C)C(F)(F)F)cc1 456070139 ZQIHQIJJWROKPC-INIZCTEOSA-N 393.453 5.348 30 20 GKED C[C@H](CC(F)(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 457593197 YLJCQOBWVMUCBJ-SECBINFHSA-N 384.345 5.238 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)Cc1cccc(F)c1 459401455 NXGAGPIJTZTSKI-HZPDHXFCSA-N 385.508 5.315 30 20 GKED C[C@@H](C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1ccsc1 460333943 WQEZWFAGKPVCDM-OAHLLOKOSA-N 380.900 5.610 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 460565703 PCSPJWVNKYGILK-CXAGYDPISA-N 395.334 5.210 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccc(C(C)(C)C#N)cc3)cc2)cs1 474701277 LCXCKZJCDVYGIC-HNNXBMFYSA-N 389.524 5.411 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)COc1ccc(F)cc1F 475561610 BZUZVFKTVXVPLN-HNNXBMFYSA-N 388.458 5.406 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cncc(Cl)c2Cl)c1 480858376 SBQZZUBTLZWIMR-UHFFFAOYSA-N 398.249 5.091 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 495445527 WWBJRPJYTWHNTQ-LLVKDONJSA-N 378.259 5.099 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@H]1CCCC[C@H]1C 498070963 FLUXKRRFXNSTEE-ZHRRBRCNSA-N 378.472 5.193 30 20 GKED Cc1ccc(-c2ccc(C(=O)N(CCC#N)Cc3cccnc3)c(F)c2)cc1C 499992132 VPCJAKPHMJZVMZ-UHFFFAOYSA-N 387.458 5.061 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 503753263 BRDSGJMOXDMOCF-QHCPKHFHSA-N 383.495 5.707 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(CC(C)C)[C@@H](C)c1ccccc1Cl 504129274 SXMPOCPSNZDDKV-QKLQHJQFSA-N 378.944 5.050 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1 505001631 WNEZDIPKJLSGKP-UHFFFAOYSA-N 395.890 5.744 30 20 GKED Cc1ccc(NC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 505767643 UZJAWGVVXBYBSB-KRWDZBQOSA-N 381.888 5.326 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(Oc3cccc(Br)c3)cc2)CC1 507837798 MTOHIVMOVGDCPU-UHFFFAOYSA-N 399.288 5.007 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1Oc1ccncc1)c1cccc(Cl)c1Cl 509287124 NFHCZWSMXDUAQT-QGZVFWFLSA-N 398.249 5.175 30 20 GKED COc1cc(C(=O)Nc2sc(C)c(C)c2C#N)cc(Cl)c1OCC(C)C 515322709 ZVXKKHQSSTZGFD-UHFFFAOYSA-N 392.908 5.186 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc(C(C)C)cc1C(C)C 515624842 KJKCGBRPVDGSQZ-UHFFFAOYSA-N 384.520 5.629 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Nc1cn(C)nc1C1CCCCC1 517012753 YKBJGNXSVMUZKX-OAHLLOKOSA-N 397.548 5.506 30 20 GKED C=CCCO[C@@H](C)C(=O)N(c1ccc(CC)cc1)c1nc2ccccc2s1 519999430 QJAVMKUGKXXKSI-INIZCTEOSA-N 380.513 5.505 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(CN4CCCC4)c3)cc2)cc1 520633665 UGKGPIRHBFIMGM-UHFFFAOYSA-N 397.478 5.199 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 520678092 UTTHANZIQNYNSG-CQSZACIVSA-N 379.378 5.417 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCCOc2ccccc21 522931198 STYCZABNJFSSAE-INIZCTEOSA-N 376.909 5.013 30 20 GKED COc1cc(CSCCC(F)(F)F)ccc1OCc1cccc(C#N)c1 524886569 CZUPTFWUQSWLQD-UHFFFAOYSA-N 381.419 5.331 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@@H](c3nc4c(s3)CCCC4)C2)c1 537660746 ISGQKNWCYLJOQE-LJQANCHMSA-N 395.572 5.084 30 20 GKED COc1cc(CNCc2ccc(-c3ccccc3C#N)cc2)ccc1OC(C)C 538002332 LZADCWXJSHZKJU-UHFFFAOYSA-N 386.495 5.311 30 20 GKED CCS[C@H]1CC[C@H](N(C)C(=O)c2ccccc2Oc2ccccc2C#N)C1 538663314 ZTWUDBHROGKLIL-ROUUACIJSA-N 380.513 5.097 30 20 GKED N#Cc1cc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)ccc1Cl 544401373 BSLPQKQNUJVKDX-SFHVURJKSA-N 384.913 5.123 30 20 GKED C=CCCO[C@@H](C)c1nc(-c2cc(Br)cc(C(F)(F)F)c2)no1 546487259 IUROFQZDPWTLRM-VIFPVBQESA-N 391.187 5.172 30 20 GKED C=C(C)Cn1c(-c2sccc2C)nnc1N1CCC[C@H](c2nc(C)cs2)C1 549270880 SYDUHELGJXHUFA-INIZCTEOSA-N 399.589 5.040 30 20 GKED COc1ccc([C@H](NCC(C)(C)CCC#N)c2ccccc2Cl)cc1OC 562045457 YIZZQXJAKUWNPJ-NRFANRHFSA-N 386.923 5.366 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)Cc2ccccc21 564440871 GCOQKUOMIRHJKU-UHFFFAOYSA-N 398.466 5.071 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)N2CCC(CCC#N)CC2)cc1 566186122 IFNMBKOBGRDDDD-UHFFFAOYSA-N 393.487 5.425 30 20 GKED CCc1cncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 573314438 GNUUFRKKXBXXCX-HXUWFJFHSA-N 375.859 5.205 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N3CCC(CCC#N)CC3)c2)C1 573561314 CMXBYLMJWUEYII-XMSQKQJNSA-N 383.536 5.330 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC=C(c2ccccn2)C1 576671466 BOORZJXTCAJXRK-UHFFFAOYSA-N 397.503 5.034 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@]3(CCSC3)C2)cc1 579439206 CYWUKBIFOPMZJT-JOCHJYFZSA-N 393.512 5.102 30 20 GKED Cc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)ccc1-c1ccncc1 583338672 ABVHRMPCKUMHBU-UHFFFAOYSA-N 389.458 5.848 30 20 GKED CC[C@@H](C)c1nc(C)c(CC(=O)Nc2cc(C(C)(C)C)sc2C#N)c(C)n1 593996089 JXCQPZQLXVRGFY-GFCCVEGCSA-N 384.549 5.019 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCc1ccsc1 603533152 QINDPWAXFOYKKH-UHFFFAOYSA-N 378.472 5.233 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccc(C)c(Oc2ccncc2)c1 604223332 DVYKHOAAAFOUES-UHFFFAOYSA-N 388.467 5.019 30 20 GKED N#C[C@@H](NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1)c1ccc(F)cc1 609043884 CUOZJFVNMJVNTM-OAQYLSRUSA-N 394.833 5.053 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(F)c3F)cc2Cl)c1 609062480 RLPVNCUPSNUCIJ-UHFFFAOYSA-N 398.796 5.321 30 20 GKED CC(C)CCN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609080676 RUDIBLQPZNNIEF-UHFFFAOYSA-N 385.895 5.300 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)c(C)c1 609098510 BYWAWRUBXKSZKF-VGSWGCGISA-N 393.556 5.365 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccnc(-c3ccccc3)c2)o1 609531094 DVLHTESZEPKCIU-UHFFFAOYSA-N 395.418 5.045 30 20 GKED Cc1ccc(C)c(Oc2ccc(CNc3nc(C(F)(F)F)ccc3C#N)cn2)c1 609669649 PNWYNBCMYXEGDM-UHFFFAOYSA-N 398.388 5.388 30 20 GKED C[C@@H](Nc1cccc(CSC2CCCC2)c1)C(=O)NC1(C#N)CCCCC1 610140359 XMBROACMWFVVSI-QGZVFWFLSA-N 385.577 5.005 30 20 GKED CC(C)(C#N)CNC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 611690179 IKTZAVNCJVALQP-UHFFFAOYSA-N 382.460 5.144 30 20 GKED CC(C)(CC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)C(F)(F)F 619127053 QQUURWYPXDPCQD-UHFFFAOYSA-N 375.275 5.135 30 20 GKED COc1ccc([C@H](C)NCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 625285578 GTIPAPKNNFIWTQ-JTQLQIEISA-N 395.318 5.723 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1Cl 726473882 ABQRRCAQYDVGJE-MRXNPFEDSA-N 394.931 5.269 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccc(NC(C)=O)cc2)c1 728227639 QZAHXEPYDISGOY-UHFFFAOYSA-N 399.519 5.030 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc2ccccc2c1OC(F)F 728695351 UINHOXXZESWSEP-FPLPWBNLSA-N 396.315 5.096 30 20 GKED Cc1cc(C)c(NC(=S)Nc2ccccc2S[C@H](C)CC#N)c(Cl)c1 731321781 SCJRTLWOUGSEQF-CQSZACIVSA-N 389.977 6.160 30 20 GKED CCN(CC)c1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 731400954 ZCMXZHSWMZGJAO-KRWDZBQOSA-N 396.560 5.249 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc2ccccc2c1 731960963 WNLGBYKMZZJDIB-UHFFFAOYSA-N 379.419 5.175 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739595009 CBZPTCWVMTVPSN-UHFFFAOYSA-N 399.475 5.180 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(O[C@H](C)C#N)cc2)cc1 742376092 MHTVDGXXGUXCNH-MOPGFXCFSA-N 386.495 5.504 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 743629273 KYRJDIQYPFWGLD-GOSISDBHSA-N 390.874 5.161 30 20 GKED C=CC[C@H](NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1)c1ccncc1 745828823 WCXYXMUILMGDQD-DVECYGJZSA-N 385.511 5.768 30 20 GKED Cc1cccc(CN(Cc2ccccn2)Cc2cc(Cl)ccc2OCC#N)c1 746462240 SEGAPHAATHUCJM-UHFFFAOYSA-N 391.902 5.148 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1ccc(Oc2ccccc2Cl)cc1 747108739 QXUPXQCLDLVTSE-GOSISDBHSA-N 390.826 5.093 30 20 GKED COc1cc(/C=C/C(=O)c2ccsc2)ccc1OCc1ccc([N+](=O)[O-])cc1 749102339 QYNYRDBCHVUFGN-XBXARRHUSA-N 395.436 5.140 30 20 GKED O=C(/C=C/c1ccc(-c2ccncc2)cc1F)c1c(Cl)nc2ccccn12 751535637 OOXLCIQQCDTNLK-VOTSOKGWSA-N 377.806 5.085 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(C2SCCS2)cc1 752038211 GFPDBMHFFQNSMU-WOJBJXKFSA-N 394.565 5.077 30 20 GKED CC(C)N(C(=O)c1ccc(C#N)c(Cl)n1)c1ccc(Nc2ccccc2)cc1 753004918 TWJWIMPIESASJU-UHFFFAOYSA-N 390.874 5.405 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC=C(C(F)(F)F)CC2)cc1 757882771 URUZFKDMYXTAFF-LJQANCHMSA-N 385.389 5.068 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 758508557 STFBMFRSMJVBCA-QMHKHESXSA-N 394.877 5.649 30 20 GKED C[C@@H]1C(=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C[C@@H]1c1ccccc1 767782243 NDLCUVCSYQHDGU-ZFWWWQNUSA-N 397.404 5.149 30 20 GKED Cc1c(C(=O)/C=C/c2cccc(Br)c2OC(F)F)cnn1C(C)C 787187620 STVHFPRHQNXZKK-BQYQJAHWSA-N 399.235 5.032 30 20 GKED C[C@@H](OC(=O)c1cccnc1F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 789009787 DJWDYISOICEBOR-MRVPVSSYSA-N 381.247 5.176 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2cccc(Cl)c2)n1 789719366 OIXZGRWLSUWRLM-UHFFFAOYSA-N 380.879 5.025 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)Cc3c(C)cccc3Cl)n2)cc1 790769446 SXUIQENYHPEHCJ-QGZVFWFLSA-N 396.899 5.200 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(C(F)(F)F)cc2)cn1 792871186 GZQVEUHRPFWGKB-WDZFZDKYSA-N 384.357 5.067 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C2(c3ccc(F)cc3F)CCCC2)s1 797568032 NYWKTPJQUURFBB-AWEZNQCLSA-N 388.483 5.407 30 20 GKED Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)OCC(C)(C)CCC#N 798879289 KGPIMPIVKWDHCD-UHFFFAOYSA-N 392.908 5.171 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC=C(c3ccco3)C2)cc1 806201078 SYRSJDNYDHTBQO-QFIPXVFZSA-N 383.451 5.256 30 20 GKED C=CCC(F)(F)C(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 815405846 LBPDMKZXLNOBDR-UHFFFAOYSA-N 398.331 5.108 30 20 GKED Cc1c(C#N)nn(-c2ccccc2)c1NC(=O)c1sc2ccccc2c1Cl 821635724 NXJIZJVIDJKQOU-UHFFFAOYSA-N 392.871 5.173 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)[C@H](CC)Sc1ccccc1 842291006 YRYZMKREAZKHAJ-PMACEKPBSA-N 394.540 5.030 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)c1c(C)oc(-n2cccc2)c1C#N 914734115 XHHSZHSRKHBFJY-UHFFFAOYSA-N 381.435 5.478 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCn2ccc3ccccc32)cc1 915086142 HENPSBOEJOFZSP-QHCPKHFHSA-N 379.463 5.326 30 20 GKED Cc1ccc(C(C)C)c(O[C@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 916847992 ZXZCWRISSYLPGK-NVXWUHKLSA-N 378.497 5.372 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)sc1C 916904362 BEJUSENSJULGCY-QGZVFWFLSA-N 390.464 5.118 30 20 GKED N#C[C@@H](C(=O)CCCc1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 917042396 BIWWDNQRXLIJIB-HNNXBMFYSA-N 388.414 5.514 30 20 GKED N#C[C@@H](C(=O)Cn1ccc2ccccc21)c1nc2cc(C(F)(F)F)ccc2s1 918491802 INXVEXGSCYKDGO-AWEZNQCLSA-N 399.397 5.146 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3nc4ccccc4s3)s2)cc1 1776015283 VYRRMFTWXHIZRQ-UHFFFAOYSA-N 379.466 5.169 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Oc2ccccc2)cc1 1776033301 BGNCETAVSPDDJL-UHFFFAOYSA-N 394.858 6.057 30 20 GKED CC(C)[C@H]1/C(=C/c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2ccccc21 1776308880 ULUMZPWSDJJEMH-GBQPJDALSA-N 382.459 6.071 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(F)c2ccccc12 1776354535 OQNWHSDCRCZFKT-DHZHZOJOSA-N 378.399 5.360 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cnc(C3CCCCC3)s1)C2=O 1777683164 YWMYPUMREDHWIY-FOWTUZBSSA-N 381.497 5.492 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1ccc(OC)cc1 5853829 JMEZDSOWIAFUGY-UHFFFAOYSA-N 394.525 5.042 30 20 GKED CCN(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)[C@@H](C)c1ccc(C#N)cc1 45501072 BWSHPLKWJWZDBO-SFHVURJKSA-N 397.478 5.034 30 20 GKED CC(C)OCc1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)oc2ccccc12 48823016 YYOGGZYPDVRDAL-HNNXBMFYSA-N 390.464 5.458 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(F)c(F)c2)cs1 54897384 PSKWVJGXNQUWDS-POHAHGRESA-N 398.434 5.310 30 20 GKED COc1cccc(-c2nc(-c3cn(CCC#N)c4ccccc34)cs2)c1OC 57943202 CCLIVHQQODQFJJ-UHFFFAOYSA-N 389.480 5.363 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)[C@H](C)C1CC1 66680347 GRKDFWXOVFAPPX-ZWKOTPCHSA-N 393.556 5.771 30 20 GKED CCC[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 106116847 LYNABGMUUCLAEH-NRFANRHFSA-N 385.467 5.576 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccccc3SC[C@H](C)C#N)o2)cc1 108408480 XDKRVESTFSUKDY-HZPDHXFCSA-N 378.501 5.470 30 20 GKED N#Cc1ccc(CNCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c(F)c1 113338211 VYQHZQXTPSRVQX-UHFFFAOYSA-N 391.393 5.129 30 20 GKED C[C@H](c1ccncc1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 116635117 MOJICYYYKYCOCQ-OAHLLOKOSA-N 391.858 5.232 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3ccccc3)n2)cc1 121855288 BRFXMWDVIMAJMK-KXBFYZLASA-N 376.481 5.189 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2c(F)cc(C#N)cc2F)cc1)c1ccccc1 132265932 JJNMLMWDABQSSH-AWEZNQCLSA-N 377.394 5.262 30 20 GKED CC[C@](C)(NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nccs1 159078278 WQKUJJIGZHJQOR-NRFANRHFSA-N 392.484 5.254 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1 176599803 GPSLUJXSFKKUFC-KRWDZBQOSA-N 377.513 5.269 30 20 GKED C[C@H](c1ccc([S@](C)=O)cc1)N(C)Cc1ccc(-c2ccccc2C#N)cc1 177731118 WPARLZWWGKQOJC-WRHNGFHOSA-N 388.536 5.156 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(C(F)(F)F)cc2Cl)c1 180162228 GAOPNKVKJYOQDA-UHFFFAOYSA-N 390.695 5.084 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2cccc(C)c2)cs1)c1ccc(F)cc1F 211971563 MVVKDHZUJNYRNM-CLFYSBASSA-N 398.434 5.310 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1cccc(OCCCC#N)c1 237496154 NTVVROFDAHUAHP-KRWDZBQOSA-N 391.540 5.652 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1ccc(N=Nc2ccccc2)cc1 255621497 HMFSQPPWYFIHSE-UHFFFAOYSA-N 384.443 5.445 30 20 GKED CC(C)(C#N)CCCCS(=O)(=O)Cc1csc(-c2ccc(Cl)cc2)n1 277847115 LCXATIIHTCSMOZ-UHFFFAOYSA-N 396.965 5.098 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3ncsc3C(F)(F)F)c2C#N)[C@H](C)C1 297901742 QZVUTMUQJSJOKJ-HTQZYQBOSA-N 385.436 5.033 30 20 GKED COc1ccc(C(=O)/C=C/c2c(C)nn(Cc3ccccc3Cl)c2C)c(F)c1 301493173 XBVWVQRGYQKQMT-ZHACJKMWSA-N 398.865 5.245 30 20 GKED N#Cc1c(Cl)nsc1N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 301955231 LFEXEFNXEWMYSB-CYBMUJFWSA-N 390.896 5.420 30 20 GKED N#Cc1ccc(CSCC(=O)N[C@@H](c2ccc(Cl)cc2)C2CCC2)cc1 303250011 MVOKUKGJPIWSQZ-OAQYLSRUSA-N 384.932 5.102 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)CCCCOc2cccc(C#N)c2)cc1 303828171 GDZAJAZYYDAKDB-QHCPKHFHSA-N 376.500 5.170 30 20 GKED O/C(COc1ccsc1Cl)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329079227 BYESPTQCUDIBDO-AWEZNQCLSA-N 379.913 5.126 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CCSc2ccc(F)cc21 330327326 VMQCRAFKHPFBSH-IUODEOHRSA-N 392.521 5.026 30 20 GKED C=CCN(Cc1cccc(C#N)c1)[C@H](C)C(=O)Nc1c(C)cccc1C(C)C 411189798 GNJOXLXPOLYUBL-LJQANCHMSA-N 375.516 5.005 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C(C)(C)CC(F)F 412337301 JRFYWAWBRPKEAM-UHFFFAOYSA-N 391.302 5.364 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1cn(CCCC#N)c2ccccc12 426954935 GWCATWSDJREEKT-KNKQGSTJSA-N 385.511 5.352 30 20 GKED CC(C)Oc1cc(Br)ccc1C(=O)Nc1ccc(C#N)cc1Cl 430364264 AUHXAKSAYJCVSP-UHFFFAOYSA-N 393.668 5.014 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(-n2cccn2)c(Cl)c1)c1ccccc1 432842191 JCNPEQGIDPHELK-IBGZPJMESA-N 393.878 5.082 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCC1CC(OC(C)(C)C)C1 433504971 BYXWDKSWQTXMIU-GTPINHCMSA-N 389.565 5.044 30 20 GKED Cc1ccccc1CCCSCC(=O)Nc1ccccc1SC[C@H](C)C#N 439877564 XTQOTBHSYHUJSG-QGZVFWFLSA-N 398.597 5.551 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cc2)cs1 440486138 NPBKCPQYUCMLHM-AWEZNQCLSA-N 393.537 5.623 30 20 GKED CSc1ccc(-c2csc(NC(=O)C3(c4ccc(C#N)cc4)CC3)n2)cc1 444005249 PWLVPFKFLQWXFW-UHFFFAOYSA-N 391.521 5.074 30 20 GKED CCOc1ccc(Oc2cc(CN[C@@H](CC)c3ccc(C#N)cc3)ccn2)cc1 447546934 ZVUGUDCITQZTML-QHCPKHFHSA-N 387.483 5.385 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 457700472 PNAIPQMUNMINEX-XCBNKYQSSA-N 381.238 5.014 30 20 GKED COc1cccc(C2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)CC2)c1 458810047 AKURZEPAFZWRJD-QHCPKHFHSA-N 391.515 5.019 30 20 GKED C=C(C)COc1cccc(NC(=O)[C@H](C)c2ccc(Br)s2)c1 463556625 JYMOPOKDKXYHQX-GFCCVEGCSA-N 380.307 5.208 30 20 GKED C=CCC[C@@H](NC(=O)N1CCCC[C@H](COC)C1)c1ccc(C(F)(F)F)cc1 468117908 UYJWRQKPFIYSQQ-QFBILLFUSA-N 398.469 5.171 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)cc1 469262417 ZCIUFINSMBCINT-UHFFFAOYSA-N 381.262 5.713 30 20 GKED C[C@H]1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)[C@@H](c2ccco2)C1 469477895 LMJHPUQIVWCECU-LAUBAEHRSA-N 375.472 5.151 30 20 GKED C[C@H](Oc1cnc2ccccc2c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 470891531 MFEXXOJJOCWCGF-CVEARBPZSA-N 391.496 5.035 30 20 GKED Cc1ccccc1-c1nnc(SCCCC(C)(C)C#N)n1Cc1ccco1 476466400 INIORIXFBCQTJM-UHFFFAOYSA-N 380.517 5.317 30 20 GKED CCc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cnn1-c1ccc(Cl)cc1 477026751 SAPIVRLAGGUHFW-QGZVFWFLSA-N 392.890 5.114 30 20 GKED C=C(C)[C@@H](N[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)c(F)c1 481604913 MZKQEUNHZYCZDR-AUUYWEPGSA-N 392.877 5.469 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cccnc1SCc1c(C)noc1C 482881193 NIMDQOXWKLRRRK-UHFFFAOYSA-N 399.560 5.187 30 20 GKED N#Cc1ccccc1OCc1cccc(-c2nc([C@@H]3CCC(F)(F)C3)no2)c1 484552014 NTRHIBMECWGOCI-MRXNPFEDSA-N 381.382 5.090 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(Cl)c(Br)c1)c1ccccc1 487500250 JMNMIUDDILJPPJ-KRWDZBQOSA-N 391.696 5.267 30 20 GKED CCc1cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)oc1CC 487929704 LUSSIVRQJBDAFA-GFCCVEGCSA-N 386.423 5.296 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)C(=O)Nc1ccccc1Sc1ccccc1 495275881 DQLJKWXPXXHLDE-OAHLLOKOSA-N 391.521 5.224 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2cccs2)cc1Cl 510007979 YAPOHDJAHHRLCB-GOSISDBHSA-N 381.888 5.379 30 20 GKED CC(C)(CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccs1 510418249 UYVZMBXLJLCURE-UHFFFAOYSA-N 390.508 5.314 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)N(Cc1ccco1)c1ccccc1C#N 517652195 GCUYDEPNAFRKBI-KRWDZBQOSA-N 376.481 5.113 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)C3(Cc4cccs4)CCCCC3)CC2)cc1 517790591 XACKNBPDBIPQNG-UHFFFAOYSA-N 390.552 5.429 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 520195643 GEAVTJCLOUSZRH-YLJYHZDGSA-N 381.545 5.990 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2ccccc2)cc1C 521715273 LYLKOEIQUQTWKL-UHFFFAOYSA-N 381.479 5.754 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cc(F)cc(F)c1 521735145 ZAVVXJRLWWEFEV-UHFFFAOYSA-N 386.345 5.242 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 522702584 TWLNLMZCLPXTRL-XLIONFOSSA-N 381.501 5.146 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C 525348822 PROIUZFSSNNFOB-IBGZPJMESA-N 385.552 5.220 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3oc(CC(C)C)nc3C)n2)cc1 530549429 LZYJGQUKADDCIB-INIZCTEOSA-N 379.485 5.104 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc(OC(C)C)c(C#N)c2)c1C1CC1 536475890 IQBZUWDNGQVPDZ-AWEZNQCLSA-N 381.480 5.034 30 20 GKED C=CCCC[C@@H](C)NC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 537262443 FCHAPHGHEGGMPI-CQSZACIVSA-N 375.900 5.115 30 20 GKED N#CCCCOc1cccc(N[C@H]2CCc3c(F)ccc(Br)c32)c1 537424805 GRFINYYVJYPBON-SFHVURJKSA-N 389.268 5.370 30 20 GKED Cc1scc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1C 538035394 TZJSXQDUFWCDTP-UHFFFAOYSA-N 384.448 5.642 30 20 GKED Cc1cc(C)cc(-n2nc(C(=O)Nc3ccccc3SCCC#N)cc2C)c1 539623139 OBOLZYLOCPQVEK-UHFFFAOYSA-N 390.512 5.056 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c(C(F)(F)F)c1 540721853 VKBPWMYZOIBLOR-UHFFFAOYSA-N 388.389 5.300 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)CCOCc1ccccc1 554440596 ALVLVSWYDMGIRD-ZWKOTPCHSA-N 397.544 5.055 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC([C@H](F)c2ccccc2F)CC1 561340471 JUYOEZFARRXSNL-KRWDZBQOSA-N 381.348 5.038 30 20 GKED CC(C)(c1noc(C[C@@H](CC#N)c2ccccc2)n1)c1cccc(Cl)c1F 573044672 KGVCGAJGHHRWOD-OAHLLOKOSA-N 383.854 5.428 30 20 GKED CC[C@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(C#N)cc1 576695858 HIAXCTQBTAZASR-KOSHJBKYSA-N 383.495 5.612 30 20 GKED C[C@@H](NC[C@H](C#N)CCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 578313868 PTTIAJYGDAYECS-KGLIPLIRSA-N 377.435 5.528 30 20 GKED Cc1sc(NC(=O)c2ccc(C(F)(F)F)cc2N2CCCC2)c(C#N)c1C 584676091 RVEWJGRDOWVQQL-UHFFFAOYSA-N 393.434 5.108 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)[C@@H](N)CCCCC#N)cc2)c1 594431209 JREDLOQSBHNURO-QFIPXVFZSA-N 393.531 5.047 30 20 GKED CCCN(CCC)C(=O)c1ccc(NCc2ccc(C3(C#N)CC3)cc2)cc1 594736248 YHOVSJCEPVFDEE-UHFFFAOYSA-N 375.516 5.116 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)oc2ccc(F)cc12 603764468 HDRBYXHYJFSGCR-UHFFFAOYSA-N 387.370 5.192 30 20 GKED COc1ccc([C@H]2CCCN2c2c(C#N)cnc3c(F)ccc(Cl)c23)cc1 603838119 YLABISSHOHCYQH-GOSISDBHSA-N 381.838 5.249 30 20 GKED CCc1ccc([C@H](NC(=O)CSc2ccc(C#N)cc2)c2cccs2)cc1 603917034 CEUUFTGENZOCDW-QFIPXVFZSA-N 392.549 5.180 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(C(F)F)cc2)cc1 608808129 RVFRBLRZACXAQN-UHFFFAOYSA-N 394.377 5.549 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1 608918611 OAWRNUQOAFLNDN-LJQANCHMSA-N 389.421 5.172 30 20 GKED CCCN(C(=O)c1csc(Cc2ccccc2)n1)c1cc(Cl)ccc1C#N 609286324 UNWNLPZKKYNEPE-UHFFFAOYSA-N 395.915 5.316 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3ccnc(-c4ccccc4)c3)o2)cc1 609531375 TZPYNDBFUJHNEC-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#C[C@@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1ccc(F)cc1 609600620 OSNAIUJXZUOBGH-QGZVFWFLSA-N 384.863 5.105 30 20 GKED Cc1ccc(CCNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 609711709 MNIXYAPYLWROBS-UHFFFAOYSA-N 399.494 5.004 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4ccc(F)cc4s3)n2)cc1 613315291 LDPSSTXILDGTPI-MRXNPFEDSA-N 392.480 5.962 30 20 GKED N#C[C@@H](C(=O)c1csc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 613320124 RUEMORIEWRMIIZ-HNNXBMFYSA-N 394.908 6.168 30 20 GKED N#CCn1c(C(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)cc2ccccc21 618166374 ZMXNLXWJGSEWME-HXUWFJFHSA-N 377.875 5.186 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)oc2c(F)cccc12 618297411 HYCKQFMCMFZNGN-AOOOYVTPSA-N 397.290 5.083 30 20 GKED Cc1ocnc1-c1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 618437580 BPIOTPMBOFHVKL-UHFFFAOYSA-N 378.775 5.017 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N[C@@H](c1ccccc1OC(F)F)C(F)(F)F 626391402 VTEZIQLLXAKJGI-LBPRGKRZSA-N 399.262 5.160 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(C[C@H]2CCCOC2)c1C 626633765 KPRNNDVTEMUWMA-HXUWFJFHSA-N 394.559 5.636 30 20 GKED CCOc1cc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)ccc1O 727267883 VGEKWMVEWRILPH-WZUFQYTHSA-N 383.444 5.258 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C\c1ccc(O[C@@H](C)C#N)cc1 728699476 VJORRKGINGXZIX-UQTJOTSZSA-N 392.455 5.445 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Oc3ccc(F)cc3)cn2)cc1Cl 729160082 UHDAIIAESJRESA-UHFFFAOYSA-N 398.850 5.347 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccc(F)cc3)CC2)cc1 729552248 CCNSLEIJQWJSTG-JOCHJYFZSA-N 385.442 5.292 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2c[nH]c3cc(Br)ccc23)cc1 729937531 VEKVUUCNIPTIAO-QGQQYVBWSA-N 395.256 5.117 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccc1C(C)C 730417186 LPUFFEZJUOGFQZ-KSSFIOAISA-N 396.487 5.511 30 20 GKED O=C(/C=C/c1ccc(OCc2occc2C(=O)O)cc1)c1ccccc1Cl 730951312 MKDJDVYPDWVJBI-JXMROGBWSA-N 382.799 5.106 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)OCc2cc(Cl)ccc2OCC#N)s1 735337918 SNAOGWQUXORZID-UHFFFAOYSA-N 398.871 5.031 30 20 GKED N#Cc1ccc(-c2ccc(OC(=O)Cc3cc(-c4ccccc4)on3)cc2)cc1 735803819 OPQXXKKNLSLXDZ-UHFFFAOYSA-N 380.403 5.028 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2C[C@@]23CCc2ccccc23)cc1 743312725 UPVXVBXFWIXWTA-KTIWRFAQSA-N 378.475 5.185 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C(\C)c2ccc(F)cc2)cc1 743447221 LGFNJPWDDIWHAF-RCAIIDNGSA-N 378.447 5.090 30 20 GKED N#CCC1(COC(=O)c2sc3cc(Br)ccc3c2Cl)CC1 744275369 CISPXAXIHLHXJW-UHFFFAOYSA-N 384.682 5.168 30 20 GKED O=C1Nc2ccccc2C12CCC(=NOCc1ccc(C(F)(F)F)cc1)CC2 746576515 KCEVFKMVFGJQCK-UHFFFAOYSA-N 388.389 5.042 30 20 GKED COc1ccccc1C1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 749121899 AAGPSPKWICXFJB-NRFANRHFSA-N 382.463 5.021 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C/C(=O)c1cccc(N2CCOC2=O)c1 756785606 CRYLWXFLSMYEFY-ZRDIBKRKSA-N 399.446 5.215 30 20 GKED C#CC[C@H](NC(=O)c1ccc(SCc2csc(C)n2)cc1)c1ccccc1 757624534 VOGPPYNXEYZVSW-NRFANRHFSA-N 392.549 5.238 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3ccc(-c4ccc(F)cc4)o3)cc2N1 758025428 LGCNCBFEWYRFEU-ALCCZGGFSA-N 385.441 5.088 30 20 GKED C=CC[C@@H](N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccncc1 766017328 ABGITQBGKHLCCP-AUUYWEPGSA-N 383.948 6.135 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)Cc2c(C)oc3ccccc23)cc1 767958476 FWJJDEFUFGXZJN-YCRPNKLZSA-N 388.467 5.145 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775487481 IVOXQKNTMKGJCI-DQEYMECFSA-N 395.506 5.883 30 20 GKED Cc1cc(C)c(NC(=O)Nc2ccccc2O[C@@H](C)C#N)c(Br)c1 780600686 QXTSHLJIQDBSAX-ZDUSSCGKSA-N 388.265 5.001 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](C)C(c1ccccc1)c1ccccc1 780670109 JRHQAJQCGGPHEA-OALUTQOASA-N 399.494 5.320 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)Nc1ccc(C#N)c(Cl)c1 796523557 PRXNYSSBIPDYKF-UHFFFAOYSA-N 385.851 5.119 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCSc2ccc(Cl)cc2)s1 797568059 FAXVTHPLOHAVAG-CQSZACIVSA-N 378.950 5.453 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)Cc2csc(-c3cccs3)n2)s1 797571866 WHHOLBHYQPOQCN-LBPRGKRZSA-N 387.555 5.045 30 20 GKED O=C(NC[C@H](c1ccccc1)C(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801692602 SBJYHDSWZCMCCJ-HUUCEWRRSA-N 393.302 5.178 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813217376 KUGKEPHQSUGDQN-WMLDXEAASA-N 390.405 5.176 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/C(C)=C/c2ccccc2COC)C(=O)c2ccccc21 814191648 RWMFZWZXXHTAEW-NXQUCHIDSA-N 390.479 5.096 30 20 GKED CC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C[C@H]2C[C@@H]2C1 815912056 XVBZQYCAWZLADU-GYSYKLTISA-N 391.323 5.729 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 836274373 UYTOTUVYLKXOCM-SFHVURJKSA-N 387.405 5.148 30 20 GKED CCCCn1c(S[C@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)nc(C)c1C 863874149 NNCFUBRKKLZEPD-LJQANCHMSA-N 398.576 5.036 30 20 GKED N#Cc1ccc(CSCc2nc(-c3ccsc3C(F)(F)F)no2)cc1 904924559 HVMKSQARDCPQJR-UHFFFAOYSA-N 381.404 5.122 30 20 GKED N#CCOc1ccc(C(=O)/C=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)cc1 912777538 FLZZZGPCOHHRCR-NTMALXAHSA-N 390.420 5.122 30 20 GKED Cc1cc(OCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)ccc1Cl 915102383 RPYZYSYHSGDULE-INIZCTEOSA-N 382.872 5.027 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@@H]2c2cccn2C)s1 915311585 NNPLPFJEUQPCLP-QGZVFWFLSA-N 389.569 5.149 30 20 GKED C[C@H](/N=C\c1cc(Cl)cc(Cl)c1O)c1ccc(NC(=O)NC2CC2)cc1 915978980 KYUDFDRJOZNQES-NQWZYWRBSA-N 392.286 5.163 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1C=NNc1ncc(C(F)(F)F)cc1Cl 916286456 FUPNCQSIMWLURC-UHFFFAOYSA-N 393.800 5.002 30 20 GKED CCCCCCCCC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 917342340 UOUXTGSLZGYSOQ-UHFFFAOYSA-N 376.928 5.938 30 20 GKED C=CCN(C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(C)C 920025130 OPMGXULOVINGBF-CQSZACIVSA-N 378.925 5.040 30 20 GKED C=CCOc1c(Cl)cc(CNc2ccc([C@H](C)CC(=O)O)cc2)cc1OC 1776183373 AXBVSDPOZUPBIU-CQSZACIVSA-N 389.879 5.104 30 20 GKED C[C@@H]1C/C(=C/c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1776589793 YGBWTHXGTBAWDH-LCJWNIEWSA-N 398.458 5.737 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Br)ccc1Cl 1776783714 DNHHGVYKGYYQTD-HNNXBMFYSA-N 390.749 5.396 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OC)c(OCCC(C)C)c1 1776783900 JHNGHLZTZUKIKS-HXUWFJFHSA-N 393.568 5.414 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CCc2ccccc2)CC(=O)O)c1 1776787236 GCEXSOOHMOUJGE-HSZRJFAPSA-N 397.559 5.602 30 20 GKED COc1cccc(Oc2ccc(/C=C\C(=O)c3csc(C(=O)O)c3)cc2)c1 1777382001 GDQSMNJCFWDQAH-YFHOEESVSA-N 380.421 5.143 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3nc(-c4ccccc4)cs3)c2c1 1777683952 GQUFHXPGGIRHRI-SOFGYWHQSA-N 391.473 5.619 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 25101661 XNEFJSQPKBQFOY-UHFFFAOYSA-N 396.446 5.156 30 20 GKED N#C[C@H](C(=O)c1sc(-c2ccccc2)nc1-c1ccccc1)c1ccccn1 41482640 CGNYYHLYGFIXNY-SFHVURJKSA-N 381.460 5.362 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3sc4c(c3C#N)CCC4)cs2)c(C)c1 63891078 VPRHMJAZTAKHRA-UHFFFAOYSA-N 379.510 5.101 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Oc2ccccc2)nc1 65751031 DCHGNPUKBDSDLK-UHFFFAOYSA-N 391.430 5.665 30 20 GKED C[C@@H](NC(=O)Nc1cccc(CSc2ccccn2)c1)c1ccc(C#N)cc1 105029435 GYZJTPNWAIRAIZ-MRXNPFEDSA-N 388.496 5.128 30 20 GKED COCc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 108241703 SADWKMBNQVBOMM-UHFFFAOYSA-N 394.418 5.110 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n1 117081868 HDBBCYRTZOATBH-INIZCTEOSA-N 393.855 5.259 30 20 GKED N#C[C@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc2cc(Cl)ccc2s1 119971173 RYTLPOHPBONCAY-MRXNPFEDSA-N 393.899 5.630 30 20 GKED Cc1cccc(NC(=O)[C@@H](C#N)C(=O)c2cc(-c3ccc(F)cc3)c(C)s2)c1 119995359 SGMBWAMWQHYBEN-IBGZPJMESA-N 392.455 5.132 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(F)c3)s2)c1 236899049 UNEZNQMDRXNSGX-LJQANCHMSA-N 380.488 5.525 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C1(C)C 276373263 NXFTWQJEKYARCX-DOMZBBRYSA-N 385.455 5.133 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1cccc(Cl)c1 301218262 MXCBUHWXRPVYNO-UHFFFAOYSA-N 378.884 5.293 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)CCC1=O 329004430 WXHZAVKEVMMQFR-AYPBNUJASA-N 377.484 5.063 30 20 GKED OC(=Nc1ccc2nc[nH]c2c1)C1CCC(/N=C(/O)CC2CCCCC2)CC1 329487278 GOUHTMRMEWEKCR-UHFFFAOYSA-N 382.508 5.637 30 20 GKED O/C(=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1cc(F)cc2cccnc12 329535500 ZKDREOBLLHSSAY-IBGZPJMESA-N 378.451 5.068 30 20 GKED O/C(=N\[C@H]1CCCC(F)(F)C1)C1(/C(O)=N\[C@@H]2CCCC(F)(F)C2)CCC1 330249523 ZXDABYZQSSZTPV-BETUJISGSA-N 378.410 5.226 30 20 GKED CC(C)OCc1c(C(=O)N[C@H]2CCCc3cc(C#N)ccc32)oc2ccccc12 416108557 QFZMGHNCRNPMPI-NRFANRHFSA-N 388.467 5.037 30 20 GKED Cc1ccnc2[nH]c([C@@H](C#N)C(=O)c3cc4sc5ccccc5c4s3)nc12 429581640 VFISVIDDXFLTMX-LBPRGKRZSA-N 388.477 5.186 30 20 GKED Cc1ccc(-c2csc3nc(S[C@@H]4CC[C@H](C#N)C4)n(C)c(=O)c23)cc1C 430094253 JEYFUULLASWAQW-GOEBONIOSA-N 395.553 5.063 30 20 GKED C=CCC(C)(C)C(=O)NC[C@@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 431746201 UHBOYOPRYNBQSL-FQEVSTJZSA-N 376.500 5.027 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(CCC(F)(F)F)c1)c1ccccc1 433023383 PMGPDHNPMHILQP-LJQANCHMSA-N 389.421 5.738 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 436336604 AWORDTDXPAOABX-ZVZYQTTQSA-N 399.947 5.659 30 20 GKED C=CCC[C@@H](NC(=O)CCc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 441583005 UANQARKRSXZHKS-GOSISDBHSA-N 380.410 5.067 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(Br)cc1Cl 461687169 IPLBLKKGBAUXLQ-UHFFFAOYSA-N 392.684 5.048 30 20 GKED Cc1cc(C(=O)N(C)CCC#N)ccc1N[C@@H](C)c1cc(Cl)ccc1Cl 465395081 ODBOAOPCPKONLY-AWEZNQCLSA-N 390.314 5.461 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1)c1ccccc1 466871084 FDKUAMCJGHWRSB-SFHVURJKSA-N 384.882 5.215 30 20 GKED C[C@H](Sc1ccccn1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 475512528 OUYRKADOPBNOAG-AWEZNQCLSA-N 393.443 5.004 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCN(c2c(F)cccc2F)C1 475554681 ZCGTYSULVFSDJU-KRWDZBQOSA-N 399.485 5.217 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H](OC)c1ccccc1F 475589134 YVYPHQWERUBFGU-OPAMFIHVSA-N 384.495 5.575 30 20 GKED CCS[C@@H]1CCC[C@@H]1NC(=O)c1ccccc1Sc1ccccc1C#N 475967447 MNUMUFDYHZTTGQ-FXAWDEMLSA-N 382.554 5.113 30 20 GKED CCCn1c(C)cc(-c2csc(NC(=O)c3cc(C#N)ccc3Cl)n2)c1C 476518958 XCWQPKNJVATVKS-UHFFFAOYSA-N 398.919 5.416 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@@H]1CCc2ccc(F)cc21 481080473 ZDFGFJBNVSGCMD-LJQANCHMSA-N 399.466 5.101 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1nccc2ccccc12 483188945 BUGNDOXXRDEAIZ-HXUWFJFHSA-N 389.414 5.533 30 20 GKED C[C@@H](Oc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1)c1ccccc1 483216014 JWHHPBRVBHUIRA-HOYKHHGWSA-N 392.458 5.865 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H]1CCO[C@@H]1c1ccc(Cl)c(F)c1 485473633 ZYRIGWBQKBFWTG-PKOBYXMFSA-N 391.895 5.017 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc4ccccc4s3)s2)cc1 487448011 SVDZHNOJUQRZGE-UHFFFAOYSA-N 375.478 5.073 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)NC12CCC(C(F)(F)F)(CC1)CC2 488288518 DOCBTDIJSOUOGW-UHFFFAOYSA-N 398.322 5.621 30 20 GKED Cc1ccc(CN(C(=O)c2cccc(CC#N)c2)[C@H]2CCc3ccccc32)cc1 489335598 YJZZBXWDGFYAJP-VWLOTQADSA-N 380.491 5.391 30 20 GKED CCN(C(=O)c1scc(C)c1Br)c1ccc(C#N)c(Cl)c1 489720126 LFBLLHCFTSZSKE-UHFFFAOYSA-N 383.698 5.011 30 20 GKED COc1ccc(-c2nc3cc(Cl)ccc3n2C2CC2)cc1OCCCC#N 493949939 NIFOHOJHGQVPIU-UHFFFAOYSA-N 381.863 5.383 30 20 GKED C=CCOc1ccccc1CNC(=O)C(C)(C)c1csc(-c2cccs2)n1 503623120 YUKDYNZFASTHLW-UHFFFAOYSA-N 398.553 5.030 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1nc2ccccc2n1CC 505011502 WLVMGSSSSNNAOS-JOCHJYFZSA-N 388.515 5.544 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H]2CCCC[C@@H]2C)cc1 508278314 KVFRIGLIMCCFGH-OXJNMPFZSA-N 393.487 5.402 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1ccc(C#N)cc1 509703623 CYPOTPGSZIJZKX-GOSISDBHSA-N 387.458 5.170 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)CCO1 513690403 XXGFLYCOYSGJHJ-KXBFYZLASA-N 394.540 5.165 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)NCCC2=CCCCC2)cc1 513883537 FNDXLPKCAGVODZ-UHFFFAOYSA-N 391.490 5.300 30 20 GKED N#Cc1ccc(C2(c3nc([C@H](F)c4ccc(C(F)(F)F)cc4)no3)CC2)cc1 516347219 PXPRHGNWSYYPPU-MRXNPFEDSA-N 387.336 5.099 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(-c4cccs4)c3)cc2)nc1 517657349 QQYPTCCDDHSYEU-UHFFFAOYSA-N 397.459 5.726 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 518120109 SOIXDKIJWFIHQO-HUUCEWRRSA-N 391.323 5.741 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1cccc(C)c1 518789262 IJJNCISYIPCBIH-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 519066923 QZKRPDMNKQDGMK-UHFFFAOYSA-N 395.812 5.673 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1ccccc1F 520224253 UZLHEAYEQKUQQU-UHFFFAOYSA-N 398.488 5.279 30 20 GKED CC(C)c1ccc(OCCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521260450 DFCUPWJCQPUAHB-QGZVFWFLSA-N 397.544 5.262 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 521730578 PMXMCWSVYSRJNX-INIZCTEOSA-N 387.508 5.561 30 20 GKED N#CCCCOc1cccc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1 522282830 QYFINSURRGUHKR-UHFFFAOYSA-N 377.400 5.149 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(C)c1cccc2ccccc12 532486819 SDBLTQYZDJOMKK-KRWDZBQOSA-N 389.524 5.309 30 20 GKED C=CCC[C@@H](NC1CCC(O)(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1 536840931 VKLWWWGXVDIDQU-AQFXKWCLSA-N 395.387 5.538 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(Cl)c(C#N)c2)CC1 537584197 CZQGBPIJIKKRDA-UHFFFAOYSA-N 377.875 5.021 30 20 GKED COc1cccc(C(N[C@H](C)c2ccc(C#N)c(F)c2)c2cccc(OC)c2)c1 538508031 RNXBWJSCNDGYQO-MRXNPFEDSA-N 390.458 5.155 30 20 GKED N#Cc1cccc(C2(C(=O)N[C@H]3CCC[C@H]3c3ccc(C(F)(F)F)cc3)CC2)c1 538579820 ZQLDLMBHMHWYLR-PMACEKPBSA-N 398.428 5.061 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 538775675 ZPPHJSYWJVZRRX-PXNSSMCTSA-N 397.400 5.099 30 20 GKED CSc1c(F)cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc1F 542394734 SAILVLXJSJKCSL-UHFFFAOYSA-N 375.444 5.001 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC[C@@H]1c1ccc(Br)s1 542403988 CFLOPLWKDWREHS-CQSZACIVSA-N 390.306 5.060 30 20 GKED CC(C)(C)c1ccc(-c2nnc(N3CCC(C#N)CC3)n2Cc2ccccc2)cc1 549501303 QZFOVOQBDXKRHM-UHFFFAOYSA-N 399.542 5.031 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3cccs3)C3Cc4ccccc4C3)cc2)CC1 552743563 PDBQCHXAFZUXHU-UHFFFAOYSA-N 398.531 5.113 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1csc(-c2ccc(Cl)cc2)c1 559558443 YRMQHNWZMMQDBW-UHFFFAOYSA-N 381.888 5.020 30 20 GKED CC(C)(C(=O)Nc1ccc(CCC(F)(F)F)cc1)c1cc(F)cc(C#N)c1 560575336 BDZHPXWFKNCHDQ-UHFFFAOYSA-N 378.369 5.109 30 20 GKED N#CCCN(C(=O)CCCc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 567499678 KXIKTEBVPUSKQK-UHFFFAOYSA-N 379.262 5.402 30 20 GKED N#Cc1ccc(CNc2ccccc2C(=O)Nc2cccc(Cl)c2)c(F)c1 589357707 LWYXIPXDLBURLC-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CC[C@@H]1CCCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)C1 597915905 JXMDTXXGQHYIKK-KRWDZBQOSA-N 389.474 5.059 30 20 GKED N#C[C@H]1CCC[C@@]2(C1)Nc1ccccc1C(=O)N2c1ccc(Cl)c(Cl)c1 602754053 AXXOFDBSXCDHNJ-RNODOKPDSA-N 386.282 5.476 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1F 605074806 CDJXCYZSBFCWSE-NRFANRHFSA-N 398.412 5.979 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(COC2CCCC2)cc1 606966169 QBPVUOQJVQOTEW-UHFFFAOYSA-N 380.488 5.032 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(C(F)(F)F)cn3)c2)cc1 609176201 AUDVVJIIZPEKEA-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CN(C(=O)c1cccc(COc2cccc(C#N)c2)c1)c1cccc2ccccc12 609643120 RFEKMDZMPSBZCC-UHFFFAOYSA-N 392.458 5.567 30 20 GKED CCO[C@@H](C)c1nc(CSCc2ccc(-c3ccccc3C#N)cc2)cs1 609917976 FQWWCIGAKFFNKH-INIZCTEOSA-N 394.565 6.213 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)c1cccc(Cl)c1 610019208 IGZABIGUXYMTGR-CQSZACIVSA-N 387.936 5.649 30 20 GKED C[C@@H](Sc1ccccc1C#N)C(=O)Nc1ccc(OCc2ccccc2)cc1 610206601 QQPQEFWFTKPVMT-QGZVFWFLSA-N 388.492 5.257 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1C#N)C(=O)Nc1ccccc1C(F)(F)F 610655059 OLRMITKEORZMER-SNVBAGLBSA-N 384.810 5.350 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CCCOc3c(Cl)cccc32)c(Cl)c1 611433590 YONSXLXNYBTZQB-HNNXBMFYSA-N 395.673 5.162 30 20 GKED N#C[C@H](Sc1nnc(C2CC2)n1Cc1ccccc1)c1ccc(Cl)cc1 619863941 KCGAHNLPAJQLKG-SFHVURJKSA-N 380.904 5.214 30 20 GKED Fc1cnc2c(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)ccnc2c1 672162014 UGILIHXVKJSBFI-RKDXNWHRSA-N 381.295 5.090 30 20 GKED C[C@H](NCc1c(F)c(F)cc(F)c1F)c1ccc(OCC(F)(F)F)cc1 678595109 MIIAEJSBLXZWLE-VIFPVBQESA-N 381.291 5.035 30 20 GKED COc1cc(C(C)=NNc2ccc(C#N)c(C(F)(F)F)c2)ccc1OC(F)F 726426220 SETCFVLZTTXPJR-UHFFFAOYSA-N 399.319 5.023 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 727953875 IAECSIIJROKXEB-BLLLJJGKSA-N 389.282 5.007 30 20 GKED O=C1/C(=C\c2nc(-c3ccccc3)cs2)CC/C1=C\c1cccc([N+](=O)[O-])c1 727973913 DGAMXSGKRRGAQB-JAFZKPNWSA-N 388.448 5.548 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)cc1 728697886 YWJHPZRFIIDUGF-RKPNYOAGSA-N 385.435 5.505 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCc3ccc(OCC#N)cc3)o2)cc1 729240547 AFAUHAAKAQVENX-UHFFFAOYSA-N 379.485 5.229 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(Cl)c1 730962408 RFDMFQXSEJPGAZ-FQEVSTJZSA-N 376.843 5.256 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(=O)c1ccccc1 732753563 SSWCWYLTSLPZDT-FDDCHVKYSA-N 382.463 5.190 30 20 GKED CC(C)C[C@H](C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 741111282 JIIJDLSLENRWKO-IRXDYDNUSA-N 382.916 5.956 30 20 GKED CCCCCC[C@H](C)C(=O)Nc1nnc(SCc2ccc(C#N)cc2)s1 741885652 SHCLVOTUSBSUQP-AWEZNQCLSA-N 388.562 5.247 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ncc(-c2ccccc2F)o1 742969916 FGXFDBSQQRZUMJ-UHFFFAOYSA-N 388.851 5.470 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccncc1)c1ccc(Cl)s1 747004132 ZDHHWUJUNQOIPK-SREVYHEPSA-N 391.883 5.545 30 20 GKED COc1ccc(/C=C2/CCc3cc(SC)ccc3C2=O)cc1OCCCC#N 748148329 SRKRHKZZFSKTQO-AQTBWJFISA-N 393.508 5.312 30 20 GKED Cc1nn(C)c2ncc(/C=C/C(=O)c3ccc(SC4CCCC4)cc3)cc12 750903738 CZVGBOFPSZWVQM-KPKJPENVSA-N 377.513 5.208 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cc(Cl)sc2Cl)cc1OC 750904550 XFDXKTNDFLEYRC-WAYWQWQTSA-N 387.284 5.367 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2cc(C#N)ccc2C(C)=O)on1 754063042 GXIKNDDMICRZHZ-UHFFFAOYSA-N 397.434 5.190 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1c(C)nn(CC(C)C)c1Cl)c1ccccc1 759374494 QLQSCQVVAQQKPD-QUCCMNQESA-N 399.966 5.524 30 20 GKED Cc1ccccc1-c1noc([C@H](C)SCc2cc(Cl)ccc2OCC#N)n1 762810713 BTNKPWPUBTXDQZ-AWEZNQCLSA-N 399.903 5.595 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C[C@H](O)c3ccc(Cl)cc3)cc2)c1 772667397 TYBRTAKZDBLLRO-NRFANRHFSA-N 392.842 5.066 30 20 GKED Cc1ccccc1COc1ccc([C@@H](C)NCc2ccc(OCC#N)cc2)cc1 772961089 ZYTVWIFGMXKWQE-HXUWFJFHSA-N 386.495 5.327 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccc(F)c(F)c1 775558219 MGLKKKFFAMNFBV-HJPURHCSSA-N 397.469 5.186 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(Cl)c1SC(F)F 780543028 BFCIZMLOGZNVIH-SNVBAGLBSA-N 397.834 5.590 30 20 GKED Cn1nc(Br)cc1/C=C\C(=O)c1ccc(Cl)c(Cl)c1Cl 782300636 HMGLRZYGKJSINF-DJWKRKHSSA-N 394.483 5.039 30 20 GKED CC(C)(C#N)CCCOC(=O)c1oc2ccccc2c1CSc1ncccn1 783229542 FWLGFUDEEIYLKQ-UHFFFAOYSA-N 395.484 5.002 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCCc3ccsc3)n2)cc1 783360948 JTEBCRBKWVBTRQ-KRWDZBQOSA-N 382.510 5.079 30 20 GKED COCC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(Cl)c(Cl)c1 790614347 QJTSCZFPTTXMCS-VBKZILBWSA-N 393.314 5.152 30 20 GKED O=C(/C=C\c1nc(-c2cc(Cl)ccc2Cl)cs1)c1ccnc(F)c1 794719599 PJUBDQAWMNWWJF-ARJAWSKDSA-N 379.243 5.547 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1nc(Br)ccc1F 794972870 UOLXVUVDAKUJSK-IWQZZHSRSA-N 395.278 5.064 30 20 GKED N#C[C@@H](C(=O)C(F)(F)Cc1ccccc1)c1nc2cc(Cl)ccc2s1 796651107 PCPLGZJJPADEAV-ZDUSSCGKSA-N 376.815 5.004 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Br)s1 797568195 OVOIVSAUOJQAEM-VHSXEESVSA-N 397.363 5.245 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C[C@H](c2ccccc2)C(F)(F)F)s1 797573148 OITKIPJPLOYKFR-UONOGXRCSA-N 380.435 5.353 30 20 GKED C[C@@H](Nc1ccc(C(F)(F)F)cc1C#N)c1ccc(N2CCCOC2=O)cc1 814263691 QLKGVRRMOYZQAF-CYBMUJFWSA-N 389.377 5.097 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2csc(-c3ccccc3)n2)c1 840730152 TZRBANOAFLKCEY-APWZRJJASA-N 377.513 5.342 30 20 GKED CN1[C@H]2CC[C@H]1CC(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C2 842895246 YQENBDGGZXOWSP-KBPBESRZSA-N 384.339 5.013 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C2(c3cccc(OC(F)(F)F)c3)CC2)n1 845480824 PQDLQIBJMHQVTC-CQSZACIVSA-N 394.418 5.073 30 20 GKED CN(CCC#N)c1ccc(CNc2ccc(N(C)C(=O)OC(C)(C)C)cc2)cc1 858247898 NXYSFEMXIAUPSX-UHFFFAOYSA-N 394.519 5.020 30 20 GKED COc1cc2c(cc1NC(=O)/C=C/C(=O)c1ccc(C)cc1)oc1ccccc12 900020718 GUORFZPBCBBZPR-VAWYXSNFSA-N 385.419 5.281 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2oc3c(c2C)C(=O)CCC3)s1 915843877 OLHIUSFSTZBJRA-UHFFFAOYSA-N 389.521 5.114 30 20 GKED CC(=NNc1ccc(Cl)cc1[N+](=O)[O-])c1sc2nc(C)nc(C)c2c1C 915976406 TUZXRRLXEVSEGN-UHFFFAOYSA-N 389.868 5.014 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3ccc(Cl)s3)n2)cc1 916974139 DWTNQGAZJJRRMD-OAHLLOKOSA-N 386.929 5.643 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(C)s2)cc(Br)c1OC 917042356 AGXIPTJGSAONPP-VOTSOKGWSA-N 381.291 5.122 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(SC(F)(F)F)cc2)c1 917727746 FWDRIYJYCMMQIT-UHFFFAOYSA-N 380.391 5.233 30 20 GKED O=C(O)c1cc2c(C=NOCc3ccc(C(F)(F)F)cc3)c(F)ccc2s1 1776112271 UVAIBXRIQOLWBZ-UHFFFAOYSA-N 397.349 5.308 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(Cl)s2)cc1 1776144263 KYRXTMMHVVENBF-SREVYHEPSA-N 383.252 5.127 30 20 GKED CC(C)[C@@H]1/C(=C/c2cc(C(=O)O)ccc2Br)C(=O)c2ccccc21 1776308918 YPMQZTYOFHLYPG-FJJYYWMZSA-N 385.257 5.167 30 20 GKED C[C@H](Oc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cc1)C(=O)O 1776469806 NOERWUYBHGEXNM-MSKHEQNASA-N 396.439 5.302 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCCC)c(OCC)c1 1776784728 NNVVWZASJXZSLR-FQEVSTJZSA-N 393.568 5.558 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2nc(C)c(CC(=O)O)c(O)n2)cc1 1776785436 ABYIDTRPFWYVJR-SDNWHVSQSA-N 398.503 5.027 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C[C@H](C)c2ccccc2)C(=O)O)cc1 1776786334 AHZBCMWBONMZBB-RDPSFJRHSA-N 397.559 5.772 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2ccccc2CC)cc1 1776788213 QVGFMWFHYSCAIU-XMMPIXPASA-N 397.559 5.904 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)[C@H]3C[C@H]3C3CC3)cc2)CCC1 1786054794 KDMHDPJCQYMOOI-SFTDATJTSA-N 394.559 5.159 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(-c3cccs3)no2)nnc1-c1ccccc1 26007775 HBGYXCDCODKIIT-ZDUSSCGKSA-N 395.513 5.096 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccccc2C)cs1 54897221 QBTUMFYZMQRWQE-RAXLEYEMSA-N 376.481 5.341 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nc2ccccc2[nH]1 56562722 BKLHDPNOHBJAFA-OAHLLOKOSA-N 397.438 5.110 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 120773316 XKQUPNURGQXRQY-WMZOPIPTSA-N 378.501 5.105 30 20 GKED C[C@H](NCc1cccc(C#N)c1)c1nc(-c2ccc(Br)cc2)cs1 126150196 SWOAUIRBXLPSQJ-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED C=CCCCCCN(C)C(=O)c1ccsc1NC(=O)c1ccccc1Cl 128750943 SRKWECKTQFTAHQ-UHFFFAOYSA-N 390.936 5.472 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 181571631 DQMVCELKPBMSQL-QRWLVFNGSA-N 379.504 5.953 30 20 GKED C[C@@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccc(C#N)c1 184605174 RAZWJPOREFKIPL-KUHUBIRLSA-N 377.488 5.549 30 20 GKED Cc1c(/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)cnn1C1CCCCC1 329713995 SHWGOQRNTDORSW-OAQYLSRUSA-N 395.551 5.391 30 20 GKED OC1=N[C@H](/C(O)=N/[C@@H](c2ccc(Br)cc2)C2CCC2)CCCC1 329867210 VRCRPLPZHSYKNA-DOTOQJQBSA-N 379.298 5.146 30 20 GKED OC(=Nc1cccc(C/N=C(/O)[C@@H]2CCCCN2C2CCCC2)c1)C1CCC1 330351986 MXRSTVZRHQLRRJ-NRFANRHFSA-N 383.536 5.328 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)/C(O)=N/[C@@H]1CCO[C@@H](C(C)(C)C)C1 330530123 ZRPZERRDUGVLEI-ARFHVFGLSA-N 381.586 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc([C@@H](C)C(=O)OC)c1 417045996 RXPZBVXFEIOTDI-MRXNPFEDSA-N 380.488 5.459 30 20 GKED Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(OCC(F)(F)F)c1 425644299 LVFGPLJWHYZGTG-AWEZNQCLSA-N 391.393 5.033 30 20 GKED N#Cc1c(F)cccc1C(=O)Nc1ccccc1NCc1ccc(Cl)cc1 427808375 PLXRPPOBSPVLIL-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CCCCn1cc(C(=O)N2CCC(Cc3ccccc3)CC2)c2ccccc21 436462937 VQQWIHJVDUNBGS-UHFFFAOYSA-N 385.511 5.040 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1Cl 437901070 JFBGJDYZWHXBQA-QUCCMNQESA-N 397.906 5.431 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)N[C@H](CCC#N)c3ccccc3)ccc2o1 439390888 YUPDSAOJMGCZPL-QGZVFWFLSA-N 376.460 5.292 30 20 GKED C=CCC[C@@H](NC(=O)NCC1CCC(C#N)CC1)c1ccc(C(F)(F)F)cc1 441003777 OJVLGIATMNOSGR-LADRWXRNSA-N 393.453 5.342 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1F 441425191 RJKNDRYFNMSLIG-UHFFFAOYSA-N 395.821 5.205 30 20 GKED N#C[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)c1ccc(F)cc1 442286610 UXDQGFNZRAFOSM-INIZCTEOSA-N 388.229 5.122 30 20 GKED Cc1ccccc1Sc1ccc(C(=O)N(CCC#N)Cc2ccccn2)cc1 448134950 PJLFVCFXOFZUBC-UHFFFAOYSA-N 387.508 5.097 30 20 GKED CCCn1ncc(NC(=O)c2ccccc2Oc2ccccc2C#N)c1C1CC1 452993296 QRLVCPDVSKHKEN-UHFFFAOYSA-N 386.455 5.087 30 20 GKED C=CCC1(NC(=O)Nc2ccc(NC(C)=O)cc2C(F)(F)F)CCCCC1 454367615 AXPGLBKPVSOAFM-UHFFFAOYSA-N 383.414 5.064 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC4(CCC4)[C@@H]3c3ccco3)cc2)c1 454768184 SFYJRSZDMRFMFN-QFIPXVFZSA-N 399.450 5.703 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCOC[C@H]1c1ccc(F)cc1 455254871 XKXCYHZRCCCMFR-NRFANRHFSA-N 382.479 5.283 30 20 GKED C=CCCOc1ccc(Cl)cc1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 462662131 NAILZPFEWJODKZ-UHFFFAOYSA-N 381.215 5.109 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc3cc[nH]c23)cc1Cl 463388325 BBUDEEGAQUESOA-FQEVSTJZSA-N 385.854 5.729 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccc3ccsc23)cc1 464449791 KYUFRUBZEVJHKL-UHFFFAOYSA-N 398.487 5.799 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2ccccc2Cl)C1 464472439 PVWLQLFWJHCWLB-SFHVURJKSA-N 382.935 5.657 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NCC#Cc2ccccc2)cc1 465574269 PDOJYESONJREDA-HXUWFJFHSA-N 398.506 5.116 30 20 GKED N#C[C@H](C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1nc2ccccc2s1 467059566 MOAVDLUEAXDBNA-QGZVFWFLSA-N 389.867 5.502 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Oc1ccc2ccccc2c1 470890328 VEABHMXXXHMDGT-IRXDYDNUSA-N 390.508 5.498 30 20 GKED C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N(C)Cc1ccc(C#N)cc1 472767230 HKOGOWACAAKBOA-GFCCVEGCSA-N 387.270 5.108 30 20 GKED CSCc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1F 473935657 CFMPUHNQQUZSGP-ZDUSSCGKSA-N 390.892 5.442 30 20 GKED COc1ccc(N(Cc2ccco2)C(=O)C[C@H](CC#N)c2ccccc2)cc1F 476095133 DVKOMKKJCGCYEE-SFHVURJKSA-N 392.430 5.048 30 20 GKED C[C@@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 480382887 ZATOLPYVDIRJST-HNNXBMFYSA-N 377.469 5.165 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2ccccc2F)co1 482120962 PUBZQEDYTJKJIN-UHFFFAOYSA-N 383.382 5.272 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccc(F)cc2)o1)c1nccc2ccccc12 483203192 QJSLVEWBIXECRY-HXUWFJFHSA-N 386.382 5.036 30 20 GKED CC(C)CN(CC(F)(F)F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 485946603 VTERERFWCDEFIB-UHFFFAOYSA-N 395.265 5.385 30 20 GKED C=CCSc1ccccc1C(=O)Nc1nnc(-c2ccccc2Cl)s1 486236637 ZBGQVGUTLBLNOI-UHFFFAOYSA-N 387.917 5.389 30 20 GKED CSc1cc(O)ccc1NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 486954966 DXVKOOFKDQRXOT-UHFFFAOYSA-N 391.452 5.422 30 20 GKED C=CC[C@H](C(=O)N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 488677226 RIQLPXJNBAGAHD-DVECYGJZSA-N 386.495 5.198 30 20 GKED COc1cccc([C@H](NCc2cc(C#N)ccc2F)c2ccccc2Cl)c1 494021322 VFPUCSKREUVVEQ-QFIPXVFZSA-N 380.850 5.239 30 20 GKED Cc1ccoc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 494595210 LRYAIELGQWTNEE-SFHVURJKSA-N 379.847 5.219 30 20 GKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)sc2nc(C(F)(F)F)ccc12 494610044 WQUPDLFCWIDNSF-UHFFFAOYSA-N 395.793 5.401 30 20 GKED C=CCc1cc(CNC(=O)N(CC)[C@H](CC)c2ccccc2)cc(OC)c1OC 497836760 PZISXRJXSRGRCO-OAQYLSRUSA-N 396.531 5.115 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 503352764 DZJXOEUCJJXTJY-DHIUTWEWSA-N 386.451 5.066 30 20 GKED CC(C)[C@@H](CNC(=O)N1CCC(C)(C#N)CC1)Cc1ccc(Cl)cc1Cl 503929418 QTNQKOAYHGTWAP-MRXNPFEDSA-N 396.362 5.143 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H]2CCCc3cn(C4CCCC4)nc32)c1 506409131 XCTIFFXUCHPESS-NRFANRHFSA-N 394.519 5.152 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c2)cn1 513052914 UIIKMRAMTBFJEW-IBGZPJMESA-N 399.475 5.069 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 517461511 KAVFHBCWXZZHSG-QGZVFWFLSA-N 382.529 5.388 30 20 GKED N#Cc1ccccc1OC1CCC(NC(=O)c2cc3cc(Cl)ccc3o2)CC1 521112935 POPRZAUVIIAIMF-UHFFFAOYSA-N 394.858 5.078 30 20 GKED CN(Cc1ccc(C#N)cc1F)[C@@H]1CCSc2ccc(Br)cc21 521334598 UIJDWNFODUWWKQ-QGZVFWFLSA-N 391.309 5.129 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2sccc2C#N)cc1 525534074 KGNRQVBEPWVIFK-OAHLLOKOSA-N 376.481 5.129 30 20 GKED Cc1c(F)cccc1-c1ccc(CNC2(c3ccc(C#N)cc3)CCOCC2)o1 527812557 RPBVYIMCWVUUBA-UHFFFAOYSA-N 390.458 5.061 30 20 GKED C=CCC[C@H](NCc1cnn(CC(F)(F)F)c1)c1ccc(C(F)(F)F)cc1 532725535 AOUAWXJAESBXAX-INIZCTEOSA-N 391.359 5.261 30 20 GKED C=CCC[C@@H](NCc1cnc2c(c1)c(C)nn2C)c1ccc(C(F)(F)F)cc1 533069635 QFMASRWYOINJSA-LJQANCHMSA-N 388.437 5.093 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cc(Cl)c(C)c1F 534912197 JIBUMBDXCDDCKX-UHFFFAOYSA-N 395.793 5.055 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccc(F)cc2)c2ccccn2)cc1 541564851 FUIMMFXYDRFEIJ-SANMLTNESA-N 393.465 5.639 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 542399891 JQUVDZZSHSRVTP-UHFFFAOYSA-N 393.556 5.705 30 20 GKED C[C@@H](NCc1ccc(-n2ccnc2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542942373 PTHIHXZIWFXICV-LJQANCHMSA-N 378.479 5.262 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Sc2cccc(Cl)c2C#N)c(Cl)c1 543960741 VDDULDPBCURBBO-LBPRGKRZSA-N 379.312 5.601 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1c(F)cccc1Sc1ccccc1 547418591 AWLUJJVJKYRIHH-UHFFFAOYSA-N 378.428 5.109 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(Cl)ccc2OC2CCCC2)c1 552158619 VQYVJHQGAHUYKH-UHFFFAOYSA-N 375.255 5.439 30 20 GKED N#CCCC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1 552312200 XAVYMAAGHQXMPC-HXUWFJFHSA-N 391.496 5.848 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(COc4ccc(F)cc4)c3)cc2)CC1 552594578 ZHXDQHOYIDZGNH-UHFFFAOYSA-N 386.426 5.212 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OC(C)C)cc1C 558311421 HJEGTMFLJLVVJR-UHFFFAOYSA-N 384.524 5.170 30 20 GKED CC(C)C(=O)c1ccc([C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 558805883 RHLGLTWMRYBQBZ-IAGOWNOFSA-N 394.540 5.662 30 20 GKED CC(C)c1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1ccccc1 570378890 AKLYZKRHVNVRBN-FQEVSTJZSA-N 380.451 5.034 30 20 GKED CCOc1ccc([C@H](C)NCc2ccc(C#N)cc2C(F)(F)F)cc1OCC 583235380 BUSPWYLFCFIAPU-AWEZNQCLSA-N 392.421 5.225 30 20 GKED N#CCCCCSc1nc2scc(C3CC3)c2c(=O)n1-c1ccccc1 589331374 MLRLURMTUXXEBI-UHFFFAOYSA-N 381.526 5.111 30 20 GKED CCCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 590942326 JPIQMADGLABWOU-QFIPXVFZSA-N 379.504 5.052 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)C1 596699116 ALFCVXXHHUGVJN-HNNXBMFYSA-N 385.920 5.649 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3Cl)cn2)c1 603623661 LEXJSTXHBZELMB-RTBURBONSA-N 389.842 5.141 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCCc1ccc(Cl)cc1 603754913 IZIFUNQCNREVHZ-UHFFFAOYSA-N 378.859 5.361 30 20 GKED CCC[C@@H](NC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608860874 MQHOJIVYEXDJQY-IFXJQAMLSA-N 389.421 5.479 30 20 GKED Cc1ccccc1C1(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)CC1 608871385 XZNXKXUJOUIYSN-UHFFFAOYSA-N 382.463 5.116 30 20 GKED COc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c(Cl)c1 609371179 MICCDTARJYBYLZ-UHFFFAOYSA-N 394.883 5.300 30 20 GKED CCN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CCCCC1 609554073 QQBYIJCDYMIKSD-UHFFFAOYSA-N 391.515 5.518 30 20 GKED CC[C@H](NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1nccs1 609979884 NICLXTQHVHFWMD-KRWDZBQOSA-N 397.887 5.342 30 20 GKED CCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@H](C)c1cccc(C(F)(F)F)c1 610355387 PFRLLOMLOAXDQP-LSDHHAIUSA-N 389.421 5.431 30 20 GKED CSc1c(F)cccc1C(=O)Nc1c(C#N)c(C)c(C)n1-c1ccccc1 619569843 HPJSPWQNHPNBIX-UHFFFAOYSA-N 379.460 5.079 30 20 GKED COc1ccc2c(c1F)CC[C@@H]2NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 675638007 DAUHULBNTPGNOL-RULNRJAQSA-N 399.350 5.321 30 20 GKED CC(C)(C)c1cc(C=Nn2cnnc2-c2ccccc2)cc(C(C)(C)C)c1O 725856292 OWKYFTJCOFPCEE-UHFFFAOYSA-N 376.504 5.128 30 20 GKED COCCOc1cccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)c1 727268022 YSNGMDFYSQLYQN-WDZFZDKYSA-N 397.471 5.179 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1cnn(-c2ccccc2)c1 746485756 OCMSEGYLMAKWSR-UHFFFAOYSA-N 380.666 5.064 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2)c1)c1ccc(N2CCOC2=O)cc1 748583089 ASXRLNSZXSSFAC-ZROIWOOFSA-N 399.446 5.118 30 20 GKED O=C(Nc1cccc(/C=C2\Oc3ccc(F)cc3C2=O)c1)c1ccccc1Cl 749746685 OXXJZJOVWYVALI-JAIQZWGSSA-N 393.801 5.348 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1 750593199 FVTCDNDCHQNDML-UHFFFAOYSA-N 376.932 5.124 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3cc4c(cc32)CCCC4)c1 772985057 QAZCAJIEJWIIHX-XUZZJYLKSA-N 390.527 5.250 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(F)c2)CCC1)c1nc2cc(F)ccc2s1 774072122 LFRZWVKTGAYXMK-INIZCTEOSA-N 382.435 5.164 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@@H]1c1ccccc1 775489787 XVEHDEDLQZAHAC-QFWMQHCXSA-N 381.479 5.567 30 20 GKED N#CCOc1cccc(NCc2ccc(-c3ccccc3Br)s2)c1 779588799 QPTVVJLNEKSVOH-UHFFFAOYSA-N 399.313 5.692 30 20 GKED CC(C)(O)c1cccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 788037053 NQQKKRFQDCHZKD-UHFFFAOYSA-N 387.439 5.222 30 20 GKED Cc1cc(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)sc1Br 794733466 WUGUJGADOMHFMF-VVEJJEBESA-N 376.275 5.006 30 20 GKED CCN(C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 801657692 OSQXVPDTXVDLCL-FZKQIMNGSA-N 378.369 5.197 30 20 GKED N#Cc1sc(N[C@H]2CCCc3sc(-c4ccc(F)cc4)nc32)nc1Cl 804617796 JKEGOSDUPINVAN-NSHDSACASA-N 390.896 5.420 30 20 GKED CC(C)c1ccc(Cc2noc([C@H](CCCC#N)NC(=O)OC(C)(C)C)n2)cc1 818377708 IZXIXBOZEMYHSB-SFHVURJKSA-N 398.507 5.043 30 20 GKED CS(=O)(=O)c1ccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)s1 840715111 OEDQEAMZNNBOIC-BENRWUELSA-N 392.567 5.082 30 20 GKED CCc1nc(SCC(=O)Nc2ccccc2S[C@@H](C)CC#N)sc1C 845325335 OYFLFWBTFRSYJD-LBPRGKRZSA-N 391.587 5.139 30 20 GKED Cc1nc(SCC(C)C)sc1CC(=O)[C@@H](C#N)c1nc(C(C)C)cs1 850874363 ZLMFLMUOOYJXOC-CYBMUJFWSA-N 393.603 5.199 30 20 GKED N#CC[C@H]1CCCN(C(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)C1 855258694 BWKDQWAUXCNZKB-RHTHQAGFSA-N 382.866 5.172 30 20 GKED Cc1cccc(OCCCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915087620 VWDVPWGXRODIAC-DEOSSOPVSA-N 384.479 5.448 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2o1 917509831 BNEPICOXLQSQEQ-CCCPALQASA-N 388.423 5.585 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 918548227 QBJHYTHMTDVXRR-IIBYNOLFSA-N 375.497 5.156 30 20 GKED N#Cc1ccc(COC(=O)c2c(Cl)cc(C(F)(F)F)cc2Cl)c(F)c1 919295429 ABCBOPQLJSSFOE-UHFFFAOYSA-N 392.135 5.380 30 20 GKED CSc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 919904432 MIWQCQNTDFXOHB-QFIPXVFZSA-N 387.508 5.386 30 20 GKED CCC(CC)CNN=C(C)CCc1ccc(OCc2cccc(C(=O)O)c2)cc1 1776056110 LSRQBJREGACYOC-UHFFFAOYSA-N 396.531 5.298 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776805941 GZMHIOAXPHUBFO-JLHYYAGUSA-N 390.435 5.589 30 20 GKED Cc1cc(N(CCC#N)C(=O)CSc2ccc3ccccc3n2)ccc1Cl 9659061 FOPLRNYPNQJDCF-UHFFFAOYSA-N 395.915 5.236 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 24965724 KERXDEQVWJODCV-FOCLMDBBSA-N 388.492 5.634 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2Cl)cc1Cl 46861700 HJHDSTPBCKZBKQ-SFHVURJKSA-N 381.262 5.901 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1csc(-c2cccc(Cl)c2)n1 60017608 CVNBMGORIHCEEF-UHFFFAOYSA-N 397.887 5.375 30 20 GKED CN(C(=O)c1ccc(-c2nc3ccccc3s2)s1)c1cccc(C#N)c1 63324879 YIYZYHIDBNBYFG-UHFFFAOYSA-N 375.478 5.173 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCC(=O)c1ccc(Cl)cc1 66856459 NNMXPDQYYHHEKK-AWEZNQCLSA-N 386.904 5.336 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCC[C@@H]2C2CCC2)cc1 102953526 KVVXDNKCODGWGF-HSZRJFAPSA-N 389.499 5.128 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C(=O)[C@@H](C#N)c1ccccn1)c1ccccc1 106983771 PJHRUDUIINSNQR-AVRDEDQJSA-N 376.843 5.040 30 20 GKED Cc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(Br)c1 113525846 QDHUFJDPSAZXCB-UHFFFAOYSA-N 388.265 5.084 30 20 GKED CC(C)c1ccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cn1 121304371 PINYSEUNLLWGMO-UHFFFAOYSA-N 385.467 5.102 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 128407411 PTHJVRVJUNUYGB-WMZOPIPTSA-N 384.549 5.322 30 20 GKED CCN(C(=O)c1ccc(NC(=O)CC(C)C)c(C)c1)[C@H](C)c1ccc(C#N)cc1 172755687 UAQHZCVQWGQWDE-GOSISDBHSA-N 391.515 5.075 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cccc(OCC(F)(F)F)c1 172905840 JHKNLROOPQGYID-CQSZACIVSA-N 380.435 5.492 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1nc(C)cs1)C1CC1 175843853 UDLRDGUZRUXDOU-OAHLLOKOSA-N 381.954 5.015 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ncc(C(C)(C)C)o1 177445168 KKWMXZPYTJTALY-INIZCTEOSA-N 375.472 5.596 30 20 GKED Cc1sc(C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1-c1ccc(F)cc1 182110914 LFNXJXYPZYQKCZ-ZDUSSCGKSA-N 380.444 5.406 30 20 GKED CC(C)Oc1ccc(Br)cc1NC(=O)c1ccc(C2(C#N)CC2)cc1 182153489 UIOCQRHDXGSCMT-UHFFFAOYSA-N 399.288 5.044 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)cc2)CC1 182612857 BCHCLFZZKCHAOP-UHFFFAOYSA-N 379.419 5.302 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@H]1c1ccc2c(c1)OCCO2 189871802 NZFMFKSLNPQDBA-VQTJNVASSA-N 377.484 5.052 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2c(CC=C)cccc2C(C)C)cc1 191438137 QYYSERPYLKYQGM-UHFFFAOYSA-N 392.503 5.490 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/CC1(c2ccc(Cl)cc2)CC1 328884646 YREYJDAMFBLMFW-CQSZACIVSA-N 390.936 5.035 30 20 GKED O/C(=N/[C@@H]1CCCc2c1[nH]c1ccc(Br)cc21)[C@@H]1CCCOCC1 329662275 PHBVEYLKTXJNHH-SJKOYZFVSA-N 391.309 5.081 30 20 GKED OC(=Nc1ccc2c(c1)oc1ccccc12)N1CC2(CCC2)[C@H]1[C@@H]1CCCO1 329781014 NAKVWROLESLYIA-PZJWPPBQSA-N 376.456 5.165 30 20 GKED Cc1ccc(N=C(O)N2CC[C@]3(C)[C@@H](C2)C3(F)F)cc1N=C(O)C(C)(C)C 330335860 RXULSNCPWGROCE-DNVCBOLYSA-N 379.451 5.152 30 20 GKED Cc1ccc(/C(O)=N/CC2CCC(F)(F)CC2)cc1N=C(O)NC(C)(C)C 330401394 OIQPJZPXCMMYDU-UHFFFAOYSA-N 381.467 5.059 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Sc3ccccn3)cc2)s1 430595659 HXYNXORBFKSDEC-INIZCTEOSA-N 393.537 5.477 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(OC(F)(F)F)c1)c1ccccc1 432688955 YDBKDLACZCQLHB-KRWDZBQOSA-N 377.366 5.142 30 20 GKED CCn1c(C)cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1C 437484499 VMUYUFFPICWQDW-UHFFFAOYSA-N 377.419 5.180 30 20 GKED N#CC[C@H](CC(=O)N[C@H]1C[C@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 437486087 ODDDURMWFFXBOL-QWFCFKBJSA-N 386.417 5.155 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1 437677595 WTQRHTVPZBKUNF-INIZCTEOSA-N 376.378 5.108 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)Nc2ccc(F)c(C#N)c2)cc1 437974799 DSJIQQKUKGZZDQ-HNNXBMFYSA-N 389.430 5.256 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(Oc2ccncc2)c1 438167406 OVWZRTJUEBALJR-GOTSBHOMSA-N 398.466 5.178 30 20 GKED CCN(C(=O)CC(C)(C)CC(=O)c1ccccc1)[C@H](C)c1ccc(C#N)cc1 441821064 MIEUPXCJZBOJCI-GOSISDBHSA-N 376.500 5.157 30 20 GKED Cc1cccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1Br 455172164 ROWIOZSXAPWTDQ-INIZCTEOSA-N 386.293 5.314 30 20 GKED Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458857427 ZMZHTCKCRHZCJC-YADHBBJMSA-N 379.479 5.416 30 20 GKED C[C@H](C(=O)N[C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1)c1cccc(C#N)c1 462440890 MQYWRHCICYWRJH-PNHOKKKMSA-N 386.417 5.133 30 20 GKED C=C(C)COc1cc(CNC[C@H]2CCCO[C@H]2c2ccc(C)cc2)ccc1OC 464049309 KNFAEHGWMKLGES-RDGATRHJSA-N 395.543 5.216 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Br)c(F)cc1F 466702189 BJOHSHHSOBPDBE-UHFFFAOYSA-N 387.249 5.009 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)c2c1 468752893 ACMWMRIQXFQAQB-GOSISDBHSA-N 386.282 5.097 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCSc4c(F)cccc43)ccc21 468809346 BXOBVHDFZZKZEI-IBGZPJMESA-N 395.503 5.058 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(Oc3ccccc3)cn2)c2ccccc21 468825593 DJIYOJDMVMYYNW-UHFFFAOYSA-N 396.450 5.385 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1ccc(F)cc1C#N 469675690 SXHGMKQJFGXUQM-CQSZACIVSA-N 394.475 5.354 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCCC2)c(OC)c1 476082806 ZYRDIUMYJSMXRV-UHFFFAOYSA-N 393.527 6.121 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CN[C@H](c1ccccc1)C(F)(F)F 476785330 JXJKUSSYTUZXGB-OAQYLSRUSA-N 390.449 5.370 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(-c2ccc(Cl)cc2)nc1C 476794946 NZORJNNEFUWMTF-UHFFFAOYSA-N 393.918 5.938 30 20 GKED CCCCc1ccc([C@@H](NC(=O)N2CCC(F)(C#N)CC2)c2cccs2)cc1 476903335 NRDJDZNPTCLQRA-HXUWFJFHSA-N 399.535 5.217 30 20 GKED C=C(C)[C@H](NC(=O)N(Cc1ccccc1)CC(F)F)c1ccc(F)c(F)c1 483313485 WYIGXGDHYVFAGD-IBGZPJMESA-N 380.385 5.059 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C 488527513 HASZIABXLCMJQJ-SFHVURJKSA-N 392.478 5.260 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1ccc(OC(F)(F)F)cc1 492605259 GWVUEKMZYUQXES-NSHDSACASA-N 399.210 5.070 30 20 GKED CCc1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)oc1CC 495037990 MUVNISLZWKQKSH-UHFFFAOYSA-N 388.467 5.302 30 20 GKED CCCc1c(NC(=O)Nc2cccc(F)c2Cl)cnn1-c1cccc(C#N)c1 495353135 HVXULUZGQCSOMS-UHFFFAOYSA-N 397.841 5.133 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F 497813533 SHAMSDBUABOKOG-SJORKVTESA-N 380.419 5.307 30 20 GKED CN(CCCC1(C#N)CCOCC1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 499619838 OCAQBEUCAMJFOF-UXHICEINSA-N 394.481 5.374 30 20 GKED CC(C)(C)c1ccc(Oc2ccc(CNCCCCC#N)cc2[N+](=O)[O-])cc1 504161737 FXBVXDZTRFGJQS-UHFFFAOYSA-N 381.476 5.468 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2OCCc2ccccc2)c1 505351644 ULHHYNQAAUKBMT-UHFFFAOYSA-N 376.843 5.085 30 20 GKED Cc1csc(-c2ccc(NC(=O)[C@H](Oc3ccccc3C#N)C(C)C)cc2)n1 506065315 XGQHGLQOWXNNJW-HXUWFJFHSA-N 391.496 5.032 30 20 GKED C=CCOc1cccc(NC(=O)NCCc2ccc(-c3csc(C)n3)s2)c1 510507374 ZLHSNPPEAGVVEF-UHFFFAOYSA-N 399.541 5.109 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)on1 510656738 GSSALDZOBCANLP-LJQANCHMSA-N 388.427 5.016 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1nc(C(C)C)oc1C 511961004 OYNSFWBBLWEKJA-UHFFFAOYSA-N 391.446 5.273 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@]3(CC=CCC3)C2)cc1 512528872 LYDWMTQMDROKMA-DEOSSOPVSA-N 387.483 5.705 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NCC(C)(C)CCC#N)cc1 513107821 IOFNWQYESZXNMV-SFHVURJKSA-N 393.531 5.395 30 20 GKED Cc1ccc(SCc2cccc(C(=O)[C@@H](C#N)c3nc(C)cs3)c2)c(C)c1 513676413 DQZMADMWKFJRQE-LJQANCHMSA-N 392.549 5.851 30 20 GKED C[C@@]12CCN(C(=O)Nc3ccc(Sc4ccccc4C#N)cc3)C[C@@H]1C2(F)F 518106586 WZSFHBUWJNURAY-AZUAARDMSA-N 399.466 5.218 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(Cl)c2OC(C)C)cc(OC)c1OC 524018168 HCGGPSYLLCMMSX-UHFFFAOYSA-N 389.879 5.125 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)CCCCOc1cccc(C#N)c1 525366728 LOSCPRAGMDDUMJ-FQEVSTJZSA-N 390.527 5.497 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(C)Cc2ccccc2C1 536732945 NQKGMPVVOLFLMT-MRXNPFEDSA-N 379.529 5.007 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 541274826 ZFQFVWBWSWHXMI-AWEZNQCLSA-N 384.476 5.331 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)C(C)(C)Oc1ccc(C#N)cc1 542561860 GDUQVRDNILVYKR-UHFFFAOYSA-N 380.488 5.060 30 20 GKED C[C@@H](NC(=O)N(C1CC1)[C@H](C)c1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 543943243 FWYHVLYNLGUNID-QZTJIDSGSA-N 399.494 5.814 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NCCC[C@@H]2CCCCO2)cc1Cl 545454237 JWFVLOPTXBDFGS-SFHVURJKSA-N 398.890 5.083 30 20 GKED CCc1sc(C(=O)Nc2ccccc2SCCC#N)cc1Br 550846769 RSHZKYANZSXWMD-UHFFFAOYSA-N 395.347 5.331 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](c1cncc(Br)c1)C1CC1 551811531 DXKXZHONELRUDS-RTWAWAEBSA-N 396.332 5.224 30 20 GKED C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 558121980 IQWDYVXDNCXXRA-IVZQSRNASA-N 393.874 5.206 30 20 GKED N#CCCC[C@H](N[C@H]1CCc2sc(Br)cc21)c1ccccc1 566576515 YPXXRMHQHOIWDP-HOTGVXAUSA-N 375.335 5.523 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(Cc3nc4cc(Cl)ccc4s3)no2)cc1 569233920 NKPIXTGUXZOQAF-UHFFFAOYSA-N 394.887 5.392 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 570706878 ZOENYMLGHIMUNW-DNQXCXABSA-N 387.527 5.326 30 20 GKED COc1ccccc1[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccccc1Cl 571724751 ARPXBJAUNPVJAL-UPVQGACJSA-N 388.898 5.587 30 20 GKED N#Cc1ccc(NC(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)cc1F 578561484 GTAHXOKYDLENTL-UHFFFAOYSA-N 389.352 5.037 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(OC[C@@H]3CCCCO3)c(F)c2)cc1 580730942 WJLUPYIVCLCBTP-AVRDEDQJSA-N 399.506 5.189 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)CCCCC#N)nc2c1C 593947786 XQQIMQXEQUXAFR-UHFFFAOYSA-N 377.513 5.530 30 20 GKED CC[C@@H](C)N(CC(=O)Nc1ccccc1C(F)(F)F)[C@H](C#N)c1ccccc1 595292410 XRMQWGFOOBQTGB-DNVCBOLYSA-N 389.421 5.009 30 20 GKED Cc1c(C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)oc2ccccc12 603995957 YLCCJMNBHOGODC-UHFFFAOYSA-N 395.418 5.118 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 609031134 BJRAUKUISSXOMQ-CABCVRRESA-N 389.282 5.394 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cc2c1 609376454 AMSLKKHGODJJQU-HNNXBMFYSA-N 375.497 5.356 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609428435 GTXFOPYHTBCHNF-SJORKVTESA-N 382.529 5.610 30 20 GKED C[C@H](CC(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 609968521 MYMYLCYVVQISRE-OAHLLOKOSA-N 390.405 5.520 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1nccc2ccccc12 682995156 PAFDRRFVNRKMSD-SFHVURJKSA-N 399.837 5.566 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)N1CC[C@H](CC(F)(F)F)C1 683406196 XXISDUANMXHILI-SECBINFHSA-N 390.274 5.147 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1cccc(Br)c1 726729516 GZBNJXUDWISYCL-QGZVFWFLSA-N 393.284 5.151 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2cccc(OCc3ccccc3)c2)cc1 728698088 CJDGLWZSCSVHRS-LJQBUTKESA-N 383.447 5.453 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(F)cccc2s1)c1c(Cl)cccc1Cl 730092904 VCQPQYXDJAJGLO-CYBMUJFWSA-N 379.243 5.342 30 20 GKED N#C[C@H](C(=O)Cc1csc(-c2cccs2)n1)c1nc2cc(F)ccc2s1 730420174 ASQIGNJBRYVJBW-GFCCVEGCSA-N 399.497 5.039 30 20 GKED N#C[C@H](C(=O)[C@@H](OC1CCCC1)c1ccccc1)c1nc2cc(F)ccc2s1 730420398 DDHLEFQXUDHQRU-UTKZUKDTSA-N 394.471 5.312 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=S)Nc3ccccc3C#N)s2)cc1 730734796 LSMBHRVVCXWRJY-OAHLLOKOSA-N 392.553 5.346 30 20 GKED N#CCOc1ccc(CC(=O)O[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1 732499417 PWCCHYBWXIRGDG-QHCPKHFHSA-N 391.854 5.118 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2sc3cc(C)ccc3c2Cl)c1 733775444 VKQPRJBSGLYWBM-HNNXBMFYSA-N 398.915 5.474 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccncc1 734684593 OBGNQUREBYWIDI-LJQANCHMSA-N 389.421 5.092 30 20 GKED Cc1c(NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)n[nH]c1C1CC1 735043380 CQGMJVAXNVNSCD-UHFFFAOYSA-N 392.846 5.165 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 735172421 ZENSZPBLHUOIMD-CJFMBICVSA-N 397.522 6.175 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccccc3OC)cc2)ccc1OCC#N 741469972 NTCFHPBJUWYIFN-QPEQYQDCSA-N 399.446 5.169 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2c(Cl)nc3sccn23)cc1OC 741845435 WCFPUTWZOJLBHI-PLNGDYQASA-N 397.283 5.006 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@@H](c2cccc(Cl)c2)C(C)C)c1 749389576 DZZNQWWGFHWFFZ-PZJWPPBQSA-N 384.907 5.077 30 20 GKED C=CCN(C(=O)C[C@@H](C)OC)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 749474582 QIIUAJFGZZZCEX-QGZVFWFLSA-N 392.524 5.421 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccncc1 751800202 RZAPCMCUSHIXPZ-OAQYLSRUSA-N 385.458 5.131 30 20 GKED CC(C)(C=NOc1ccccc1C(F)(F)F)[C@H](C[N+](=O)[O-])c1ccccc1 754712766 SIUDRQMVBFGYCG-MRXNPFEDSA-N 380.366 5.157 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1cc(Cl)sc1Cl)c1nc2ccccc2o1 756233459 DZVRVWTVJDNJSB-JTQLQIEISA-N 393.251 5.035 30 20 GKED C=CC[C@H](N[C@@H](CC)c1ccc(I)cc1)c1ccncc1 766018097 FZTWGPUIOZFNJT-ROUUACIJSA-N 392.284 5.044 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2C[C@H](C)c3c(Br)cccc32)c1 772986500 XSLCSKVWUVGQNQ-NBQZKYEYSA-N 399.332 5.468 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2ccccc2F)C2CCCC2)ccc1OC 774449708 QLHMNIQBEZMBGF-NTKDMRAZSA-N 396.506 5.536 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1 780532482 MFGWNAPTDUXMLK-OAHLLOKOSA-N 398.894 5.265 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(C#N)cc2Cl)cc(Cl)c1OC 788361224 XDYVIOLRYYXGHM-ALCCZGGFSA-N 376.239 5.168 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@](C)(O)c1ccccc1Cl 789459254 PGDKVFYDODLOAT-QFIPXVFZSA-N 386.923 5.221 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(C3SCCS3)cc2)s1 797569044 MSYDJMGTMJEFFX-AWEZNQCLSA-N 388.583 5.409 30 20 GKED C[C@H](NCc1cccc2c1CCCN2C(=O)OC(C)(C)C)c1cccc(C#N)c1 806180260 ALIPVADUMUMQLW-KRWDZBQOSA-N 391.515 5.097 30 20 GKED Cc1nn(C)c2sc(C(=O)/C=C\c3ccc(N(C)c4ccccc4)nc3)cc12 806576854 IVQLNPMNFUOIJP-LUAWRHEFSA-N 388.496 5.002 30 20 GKED Cc1cc(C(C)(C)NCc2ccc(O[C@H](C)C#N)cc2)ccc1Br 810181903 WLDVOHIDOLURMN-OAHLLOKOSA-N 387.321 5.073 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2cccnc2)C2CCCCC2)ccc1OC 846151098 VKFOQKISBFJKGT-URXFXBBRSA-N 393.531 5.182 30 20 GKED CCCCCOc1ccc(C=NOCc2nc3ccccc3s2)cc1OC 854068377 NFXQZOSOIFTJKP-UHFFFAOYSA-N 384.501 5.425 30 20 GKED CCOc1ccc([C@@H](NC(=S)Nc2ccccc2C#N)C(C)C)cc1OCC 915998969 NBHGHRXXVGMNSJ-NRFANRHFSA-N 397.544 5.039 30 20 GKED CCCCCCCCC(=O)Nc1ccc(N2CCN(C)CC2)cc1C(F)(F)F 916089309 MYRROBRNXJQVCL-UHFFFAOYSA-N 399.501 5.146 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccc(F)cc2)cc1 918486696 KSGFCTJZPDSZDS-QYWGDWMGSA-N 380.463 5.180 30 20 GKED O=C(O)c1ccc(NN=C2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)cc1F 1776074934 CJKHVTMNWULGHG-LBPRGKRZSA-N 380.341 5.278 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1csc(-c2ccc(F)cc2)n1 1776784527 ZDALBPIEEDJNLF-KRWDZBQOSA-N 378.513 5.243 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2ccsc2)cc1 1776788297 YQLWHJJBYUZYIJ-FQEVSTJZSA-N 375.534 5.403 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)cc1 1776806029 VLLXQWGPPRIYMO-YFHOEESVSA-N 387.273 5.386 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2ccc(CC(=O)O)cc2)cc1 1776869274 ZYWFWAGBOGYEOT-ATVHPVEESA-N 399.490 5.236 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1OCCC1CCCCC1 1777436296 GUEGOXQZMJYGNN-YPKPFQOOSA-N 392.495 5.939 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)c1 1777686122 MQENUDHMWNQHDG-YVMONPNESA-N 397.770 5.103 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(-n2cccc2)c1 49723858 OGTYESQQPPRDOY-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)s1 66801962 HOBDBZHXYSPOME-JTQLQIEISA-N 381.320 5.157 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCc1c[nH]c2ccccc12 66954360 RHPPVCMUPFIZEI-MRXNPFEDSA-N 392.528 5.316 30 20 GKED CN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1cccc(C#N)c1 72037047 TZVSGEZVCXWOJW-UHFFFAOYSA-N 381.410 5.189 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)C(=O)Nc1cc(Cl)ccc1F 108408083 LPEROWJNIRBREZ-STQMWFEESA-N 391.899 5.170 30 20 GKED N#CCCN(C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)C12CC3CC(CC(C3)C1)C2 133742245 AQQRVAJQBMJDPZ-ZBLKQVMWSA-N 382.470 5.066 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccccc1O)C1CCCCC1)c1ccccc1 160674508 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N#CCOc1ccc(C(=O)/C=C\C2=Cc3cc(Cl)cc(Cl)c3OC2)cc1 215023280 NTPZNLFHOFMHGL-BHQIHCQQSA-N 386.234 5.111 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CC1 303538856 HKVQXNFVNRPSTM-QGZVFWFLSA-N 386.451 5.096 30 20 GKED COc1cccc(Nc2ccccc2C(=O)Nc2ccc(C(C)(C)C#N)cc2)c1 303843753 MLZUPRDBBIDEDZ-UHFFFAOYSA-N 385.467 5.492 30 20 GKED O/C(=N/[C@@H]1CCCC12CCOCC2)N[C@H](c1cccc(C(F)(F)F)c1)C1CC1 328689988 BMYQLYKMGFYQEG-MSOLQXFVSA-N 396.453 5.009 30 20 GKED CC[C@@H]1C[C@H](/C(O)=N/CC2(c3ccc(Br)s3)CCC2)CC(O)=N1 329270797 HGXWFAXUHSRULH-NWDGAFQWSA-N 399.354 5.034 30 20 GKED Cc1ccc(Br)cc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 390889452 KNGXNOAVLIOBMD-JTQLQIEISA-N 389.318 5.068 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N(C)C[C@H](C)C#N 431705389 QPFIHVWIWNRUEN-LLVKDONJSA-N 380.275 5.003 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 431861033 KJCLWOWAIJRKRL-BEFAXECRSA-N 389.421 5.501 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1 431927632 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CC(C)(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccccc1Cl 609140936 RMEOSLCSFOXXCA-UHFFFAOYSA-N 391.858 5.315 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)CSc1ccc(C#N)cc1 609908734 LZYKQGFSXXQETO-FQEVSTJZSA-N 392.549 5.121 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)N(Cc3ccco3)Cc3ccco3)c2)cc1 609986307 IQHJZTRHAJCWFY-UHFFFAOYSA-N 397.434 5.330 30 20 GKED Cc1nc(C(=O)N(c2cccc(Br)c2)C2CCCCC2)ccc1C#N 610046539 ADJDTOSTKWBMFL-UHFFFAOYSA-N 398.304 5.004 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1CC(OCc2ccccc2)C1 610466569 WTWDWUPZKKCZBD-IVMQYODDSA-N 380.513 5.015 30 20 GKED CN(Cc1ccccc1N[C@@H]1CCC[C@H](C#N)C1)C(=O)c1cc2ccccc2o1 613255271 WBVMYSLPHOFPKJ-FXAWDEMLSA-N 387.483 5.199 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)(F)F)cc1)c1nc2cc(Cl)ccc2s1 613403806 VERGSUWVNPVURH-GFCCVEGCSA-N 396.777 5.338 30 20 GKED O=C(Nc1ccc(Cl)c(F)c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618543366 OYSWJKWVFCMTBF-OCAPTIKFSA-N 392.702 5.074 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)ccc1Cl 619129901 USGMGEDHQBTFAR-UHFFFAOYSA-N 379.703 5.263 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)o2)c(C)c1 619752982 OXOXMKSPOISIJD-FQEVSTJZSA-N 396.446 5.514 30 20 GKED CSc1cc(Br)ccc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 654982478 NPYUPKUHKCHTFU-LBPRGKRZSA-N 395.347 5.241 30 20 GKED COc1cc(C#N)ccc1OC(=O)[C@H](Sc1ccccc1F)c1ccccc1 729945955 WUCMXIZPJWAOMV-OAQYLSRUSA-N 393.439 5.145 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730420166 AOHDXOFPPQWRBL-HZMBPMFUSA-N 390.892 5.446 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CCc2nc3cc(Cl)ccc3s2)cc1 730533134 LPWUMCNUQZWDIN-UHFFFAOYSA-N 383.904 5.138 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(COc3ccc(C#N)cc3)c2)cc1 734429450 JRMLXXFTIIEQDB-UHFFFAOYSA-N 395.462 5.006 30 20 GKED Cc1ccccc1SCC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739589870 FBUHUQSAQQWGFX-UHFFFAOYSA-N 378.522 5.004 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1cccc(-c2ccncc2)c1 741463394 FUIMXRDGTNZXMW-UHFFFAOYSA-N 385.389 5.526 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)cc1 741468792 HUMLKRCWBAHCBM-WJDWOHSUSA-N 392.458 5.715 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1ccccc1SCC#N 741732278 WSNARTLIYBAYJG-UHFFFAOYSA-N 387.508 5.027 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2CCCC[C@H]21)c1nc(-c2ccc(Cl)cc2Cl)cs1 751151643 IZKOOPFYJIRPKM-GNNTXSLPSA-N 391.323 5.729 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccc[nH]1 760764855 FFUKOLXCTNYVBY-AWEZNQCLSA-N 394.862 5.001 30 20 GKED Cc1ccc(F)c(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)c1 763288650 INRXTOIBMBQLFG-ZRDIBKRKSA-N 393.845 5.936 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3sccc3Br)c2)s1 764976582 YPPDRMMGSUUAKO-UHFFFAOYSA-N 389.343 5.401 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 773761856 WEANXOYJALDOLF-NQIIRXRSSA-N 379.463 5.330 30 20 GKED C[C@@H]1CC[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 776515085 HDUNWRRLQMFIIE-GYSYKLTISA-N 379.312 5.729 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc(C4CCC4)s3)cc2F)c1 779596580 YEOBYTDVKIFIJH-UHFFFAOYSA-N 393.487 5.612 30 20 GKED C#Cc1cccc(N(C(=S)Nc2cccc(OC(F)(F)F)c2)C(C)C)c1 783734044 JFGIJIBUKJZVML-UHFFFAOYSA-N 378.419 5.178 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCc3cc(Br)cc(C)c32)c1 786852693 IGASXSHYEROZSG-AZUAARDMSA-N 399.332 5.216 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2cc(Cl)ccc2Cl)c(-c2ccncc2)n1 788344754 KOMGXTMRUVQHIQ-DJWKRKHSSA-N 397.265 5.062 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2c(Cl)nc3cc(Cl)ccn23)c(Cl)c1 794711971 HDNFTTFRZHEKGY-ARJAWSKDSA-N 376.630 5.062 30 20 GKED C[C@H](Nc1ccc(N2CCCCC2)c2ncccc12)c1ccc(OCC#N)cc1 794835214 ZMLNKTBYMUBSID-SFHVURJKSA-N 386.499 5.301 30 20 GKED O=C(/C=C\c1nc(-c2ccccc2)cs1)c1nc(Br)ccc1F 794969699 JOGPNKYWRUJMKR-CLFYSBASSA-N 389.249 5.003 30 20 GKED N#CC1(CCCOC(=O)CCCc2cc(Cl)sc2Cl)CCOCC1 800181148 GNUNSDLNLORDCM-UHFFFAOYSA-N 390.332 5.021 30 20 GKED CC(C)[C@@H]1CCCN1c1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1F 803042430 DBPCMLNNFVWCSC-IBGZPJMESA-N 385.870 5.228 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 806200966 QKJIFYVTXJNSGL-WVQWTBLQSA-N 395.506 5.957 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 808385285 OGKWQCUYNIDTHT-SNVBAGLBSA-N 380.300 5.201 30 20 GKED O=C(CSC(F)(F)F)O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809128400 UTBZMTWLOXAPFM-SECBINFHSA-N 386.235 5.105 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813212662 FNYWTZVRXZXNJG-KDOFPFPSSA-N 390.405 5.259 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)c(Cl)c1)C1CC1 836497742 VHOKYQNWVUDABH-BUXKBTBVSA-N 387.842 5.043 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842942582 PKLUHAIYYRXCST-XHDPSFHLSA-N 378.419 5.409 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(C(C)(C)c2ccccc2)no1 848608265 CMFDWXJWBKQQQL-QGZVFWFLSA-N 398.507 5.045 30 20 GKED Cc1nc(C)c2c(C)c(C=NNc3ncc(C(F)(F)F)cc3Cl)sc2n1 873867902 RLLOJKJDSFNTQN-UHFFFAOYSA-N 399.829 5.130 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc2cnccc12 875870315 SGXMYOVTAPAWGH-UHFFFAOYSA-N 381.460 5.510 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3[nH]c(C)c(C)c3c2)cc1 916914979 ZVECIXJFVNJPKZ-OAQYLSRUSA-N 387.483 5.089 30 20 GKED CCCCCCCCCNC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1 918319900 IFKQXUCJHNVOSX-UHFFFAOYSA-N 399.000 5.121 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 920055892 WCSPKNFZHJGZNA-GAJHUEQPSA-N 387.458 5.406 30 20 GKED O=C1/C(=C\c2c(Cl)nc3sccn23)COc2c1ccc(Cl)c2Cl 920066300 OQICZCPTDXZQGJ-ALCCZGGFSA-N 385.659 5.015 30 20 GKED CCCc1sc(C(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc1CC 920101847 KYHBDQBUELVSRO-MRXNPFEDSA-N 378.497 5.258 30 20 GKED Cc1cc(C=NNc2ccc(F)c(C(=O)O)c2)c(C)n1-c1ccc(C(C)C)cc1 1776062349 PNPKQQHIMAHBRW-UHFFFAOYSA-N 393.462 5.501 30 20 GKED Cc1cccc(NN=Cc2cccc(OCc3cccc(C(=O)O)c3)c2)c1Cl 1776106501 IMUJPSUNFUJQEB-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCCCCCOc1ccc(CN[C@H]2c3ccccc3C[C@H]2C(=O)O)cc1 1776789014 KHPMYFQOYMTZAU-PKTZIBPZSA-N 381.516 5.124 30 20 GKED Cc1sc2nc3n(c(=O)c2c1-c1ccccc1)CC/C3=C\c1ccc(C#N)cc1 16387261 BRMBTXFFKYFIQO-CPNJWEJPSA-N 395.487 5.249 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1ccc(C)s1)[n+]1ccc(C)cc1 27291938 VOCOSEWOBXGNAD-UHFFFAOYSA-O 395.573 5.266 30 20 GKED N#Cc1ccc(CSc2nnc(-c3ccc(F)cc3)c3ccccc23)c(F)c1 29864645 FPIHHODJPBPIDT-UHFFFAOYSA-N 389.430 5.739 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66956224 MOUMVRDVEAVWDK-MSOLQXFVSA-N 393.556 5.913 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(F)c(F)c1 108530849 DAFUOYDVRPQPOK-ZIAGYGMSSA-N 389.471 5.441 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 112149387 UEGXVSFCFOAUHS-DZGCQCFKSA-N 382.435 5.143 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 120033944 ISEJRKDSZCXPTD-OAHLLOKOSA-N 379.872 5.158 30 20 GKED CCc1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)co1 123700181 QEEGLJIKXCRWBV-NSHDSACASA-N 392.267 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1cccc(OC(C)(C)C)n1 131863041 XJQTVUYILADBSV-INIZCTEOSA-N 397.544 5.082 30 20 GKED COc1ccc(C[C@@H](C)C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 136902882 XFWLUOTWUBRCSZ-WBMJQRKESA-N 384.888 5.013 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCO[C@H](c4ccccc4)C3)c2)c1 157261516 IXXQWALOTACEIS-RSXGOPAZSA-N 398.506 5.147 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 160112622 DROHOBYIXNWHRL-AWEZNQCLSA-N 397.450 5.458 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c2c(C(C)C)noc2n1 170974204 WOHCLTFVRWYJFM-ZDUSSCGKSA-N 394.500 5.159 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 171742955 DVXCECLHZIMUSH-INIZCTEOSA-N 390.512 5.007 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(F)c(F)c2)C(C)C)ccc1OC 182136473 VBHZFKBWNUXLNZ-HTAPYJJXSA-N 388.458 5.141 30 20 GKED O=C(/C=C\c1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)c(F)c1 211151997 CFOPNJICAOAYFG-FLIBITNWSA-N 397.808 5.767 30 20 GKED O=C(Nc1ccccc1)c1cccc(CON=Cc2ccccc2OC(F)F)c1 252463516 RCNFJWMMIFWKHI-UHFFFAOYSA-N 396.393 5.091 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccnc2ccccc12)c1nc2cc(Cl)ccc2s1 254993157 BRXSZEMRLRLEGL-GMNBZTITSA-N 389.867 5.388 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@]1(C#N)CC12CCCC2 298283168 HQMJWUJRSWBIQT-HSZRJFAPSA-N 388.471 5.052 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1Cl 303854188 SEYFVQADNWNJAS-RDBSUJKOSA-N 388.895 5.616 30 20 GKED C[C@]1(/C(O)=N/[C@@H]2CCCCC[C@@H]2c2ccccc2C(F)(F)F)CCC(O)=NC1 328689658 BMBLJACSUCSJPL-MDYRTPRTSA-N 396.453 5.835 30 20 GKED Cc1cccc(C)c1N=C(O)[C@@H](C)N1CCC([C@H]2C(O)=Nc3ccccc32)CC1 328712465 RSMWWERFMDYFFV-DYESRHJHSA-N 391.515 5.377 30 20 GKED Cc1cccc(C)c1N=C(O)[C@@H](C)N1CCC([C@@H]2C(O)=Nc3ccccc32)CC1 328712469 RSMWWERFMDYFFV-UTKZUKDTSA-N 391.515 5.377 30 20 GKED COc1ccccc1-c1noc([C@H](C)/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)n1 329183543 OXIWWGHUZCZGOY-MWDXBVQZSA-N 383.492 5.369 30 20 GKED Cc1oc(-c2ccsc2)nc1CC(=O)Nc1sc(C(C)(C)C)cc1C#N 411006483 JJCHMLXAOQGTNG-UHFFFAOYSA-N 385.514 5.123 30 20 GKED COc1ccc(N(Cc2cccs2)C(=O)c2cccc(SCC#N)c2)cc1 429939779 WCNTUEFSTMDNKA-UHFFFAOYSA-N 394.521 5.219 30 20 GKED N#CCCC[C@@H](NC(=O)NCCc1cc(Cl)cc(Cl)c1)c1ccccc1 431872696 UYZNAKASOFSAOE-LJQANCHMSA-N 390.314 5.270 30 20 GKED Cc1ccc(-n2cc(C)cn2)c(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1 433263655 WQDNYZXMOJZFMQ-HXUWFJFHSA-N 387.487 5.046 30 20 GKED C=CCC[C@@H](NC(=O)NCCc1coc(-c2ccc(F)cc2)n1)c1ccccc1 435759844 JFUDKUBVFWBSJO-OAQYLSRUSA-N 393.462 5.030 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N[C@@H](CCC#N)c1ccccc1 439662986 DMNSTKDHLBEIGX-SFHVURJKSA-N 379.460 5.033 30 20 GKED CC[C@H](N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1ccc(C#N)cc1 447540442 JDBXCCBXCQVMTJ-UPVQGACJSA-N 398.485 5.529 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1cc(C(=O)OC)co1)c1ccc(C(F)(F)F)cc1 447588365 UVVVKMKTSAHBAE-SUMWQHHRSA-N 381.394 5.443 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1 455677065 SXKTVEJMDFDHOH-JPYJTQIMSA-N 391.515 5.058 30 20 GKED CCC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)cc1 464916099 CRLBPJUIWPCZNE-UHFFFAOYSA-N 399.450 5.260 30 20 GKED C[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1cc2cccc(F)c2o1 469837775 DZUYAIXWOUJJJK-OAHLLOKOSA-N 389.430 5.321 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1sc(-c2ccc(Cl)cc2)nc1C 471168180 FYLIHRZIDRZWMV-UHFFFAOYSA-N 375.925 5.316 30 20 GKED Cc1ccc(NCc2nnc(-c3cccc(C#N)c3)o2)c(OCc2ccccc2)c1 471630458 ZAMZMVTYLYLHAX-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)CC(=O)c1cn(CCC#N)c2ccccc12 472423245 BWXORSGJTJUMHP-QGZVFWFLSA-N 385.467 5.177 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccccc1 475768588 OBMWXLLCNLMERQ-GOSISDBHSA-N 382.454 5.324 30 20 GKED Cc1c([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccccc12 484155472 FFMXFXWLGXFWFZ-HOCLYGCPSA-N 393.512 5.876 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1ccccc1Oc1ccccc1C#N 484609309 WORVIUXHMBWKIL-RHSMWYFYSA-N 388.389 5.154 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485811454 BZGCEBAGRVCVFZ-AWEZNQCLSA-N 394.833 5.424 30 20 GKED COc1ccc([C@@H](NCCCC(C)(C)C#N)c2ccc(C(F)(F)F)cc2)cc1 486174205 XAHGWVDRFCASLV-FQEVSTJZSA-N 390.449 5.723 30 20 GKED Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 487039047 DDUKBRXXDDAJAL-UHFFFAOYSA-N 393.450 5.253 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Nc1cc(C#N)ccc1OC(F)F 490338352 DFEGBUKRHFTZGG-IBGZPJMESA-N 387.430 5.329 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCc4cc(F)ccc4C3)cc2)c1 510076050 ZRSWLCRZMDUEOS-UHFFFAOYSA-N 387.414 5.080 30 20 GKED COc1ccc(Cl)c(NC(=O)c2cccc(COc3ccccc3C#N)c2)c1 513233701 NPVYMEBNIQSEJF-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1ccsc1CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 516326178 DYUXTXZDGMAONZ-UHFFFAOYSA-N 377.469 5.384 30 20 GKED C=CCOc1cccc(NC(=O)N(Cc2ccc(OC)cc2)[C@H](C)C2CC2)c1 518723613 JFOHQEVOHHLLKX-QGZVFWFLSA-N 380.488 5.093 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCc1cc(Cl)cc(Cl)c1 519062618 FTROXMXPJPXEIJ-UHFFFAOYSA-N 390.314 5.028 30 20 GKED Cc1cccc2c1CC[C@@H]2NC(=O)c1ccccc1SCc1ccc(C#N)cc1 519112949 REVKXYMBBOOVMW-QHCPKHFHSA-N 398.531 5.576 30 20 GKED N#C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1cccc(Cl)c1Cl 521293578 ZWERZQIGOGZMEP-CQSZACIVSA-N 385.703 5.120 30 20 GKED CC[C@H](NCc1cccc(NC(=O)c2ccc(C)cc2)c1)c1ccc(C#N)cc1 521536048 AOWICUZASLKZGW-DEOSSOPVSA-N 383.495 5.360 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)sc1-c1ccc(F)cc1 521716399 IYAVRPPAAXFYML-UHFFFAOYSA-N 396.512 6.121 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nc2sccc2c1=O 522863443 KXGMCXQMDITVPO-ZDUSSCGKSA-N 395.509 5.152 30 20 GKED CCN(C(=O)[C@H](C)c1ccc(Br)s1)c1ccc(C#N)c(Cl)c1 539173321 PTKZTCLXBMSXAY-SNVBAGLBSA-N 397.725 5.192 30 20 GKED C[C@H](NC(=O)N(Cc1cccnc1)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 543942587 TUADQDWCHMSOOT-SFHVURJKSA-N 396.494 5.055 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)c1 552427433 BFZLMOZICHFONW-UHFFFAOYSA-N 396.277 5.729 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccccc1Cl)c1ccc(Cl)c(Cl)c1 553962573 XKPGOHBPHAQTPQ-IGCXYCKISA-N 379.674 5.131 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)Nc3ccc(C4CCC4)cc3)CC2)c(F)c1 554350256 OVILIKUMPNEBGN-UHFFFAOYSA-N 393.462 5.040 30 20 GKED COc1ccc([C@H](CCC#N)NCC[C@H](c2ccccc2)C(F)(F)F)cc1 556221290 LPNVCBDRWQHRHH-UXHICEINSA-N 376.422 5.366 30 20 GKED CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 558511519 PONWXFSFTARNQP-KKSFZXQISA-N 378.476 5.178 30 20 GKED CCCOc1ccc(Oc2ncccc2CN[C@H]2CCc3ccc(C#N)cc32)cc1 567003040 SMPLQPFKXXNJIK-DEOSSOPVSA-N 399.494 5.311 30 20 GKED CC(C)(CC#N)CSc1nnc(-c2cccc(Cl)c2)n1Cc1ccco1 571418136 IKRPHCZTJCWLLW-UHFFFAOYSA-N 386.908 5.272 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NC[C@H](Cc2ccccc2)C(F)(F)F)cc1 572170784 IUVOHKNRUBAIPA-KRWDZBQOSA-N 389.421 5.030 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1cc(C(C)(C)C)sc1C#N 572400388 FSQHSPALZKUPPV-AWEZNQCLSA-N 377.513 5.283 30 20 GKED N#C[C@H](NC(=O)c1cc2c(s1)CCCCC2)c1cccc(C(F)(F)F)c1 573311662 OOIYPZWEUVPZCP-HNNXBMFYSA-N 378.419 5.030 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N(CCC#N)c1ccc(F)cc1 574779253 KUMLOMQTWPYFRJ-UHFFFAOYSA-N 399.878 5.472 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCC1 577202014 JZYBYVOAPOBQFS-HRAATJIYSA-N 379.529 5.601 30 20 GKED C=CCn1c([C@@H](CC)c2ccccc2)nnc1N1CCC[C@@H]1c1csc(C)n1 583172298 BEVWMSBTSJHKLZ-AZUAARDMSA-N 393.560 5.112 30 20 GKED COc1cc(-c2noc(-c3ccc(C(C)(C)C#N)cc3)n2)ccc1OC(C)C 584375924 OVQCGAFOEVYJML-UHFFFAOYSA-N 377.444 5.001 30 20 GKED CC(C)(C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 590663270 BPAARVONUNSMRS-VXGBXAGGSA-N 399.350 5.129 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C(F)(F)F)o1 594072581 UNHLWKFFXDBUCF-BLLLJJGKSA-N 397.422 5.407 30 20 GKED N#CC1(CC(=O)N2CCCCC[C@@H]2c2noc(-c3ccccc3)n2)CCCCC1 597484730 RHECYASXRPPLEL-LJQANCHMSA-N 392.503 5.044 30 20 GKED N#CCC1CN(C(=O)c2cccc(CSc3cc(Cl)cc(Cl)c3)c2)C1 598033669 AHDYGVHALYOJBK-UHFFFAOYSA-N 391.323 5.271 30 20 GKED N#Cc1ccc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)cc1Cl 603008424 OYCMSYNGFQLWJB-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 603945969 WLNSTISUKRKFQD-UHFFFAOYSA-N 379.293 5.907 30 20 GKED Fc1ccccc1-c1cnc(CN2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)o1 607727586 XFYUJCJOCFCQKF-QWRGUYRKSA-N 396.306 5.043 30 20 GKED Cc1c(F)cccc1NC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 608776072 XXPIIQQMNNIADS-NXEZZACHSA-N 386.311 5.165 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(Oc3ccc(F)cc3)cc2)c1 609066786 SSVFKTQLXXHDFU-UHFFFAOYSA-N 398.340 5.343 30 20 GKED N#C[C@@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 609460853 YCPCBJABGMMEIU-QGZVFWFLSA-N 380.797 5.063 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1(c2cccs2)CCCCC1 609968985 BEACOPTWUIGSSU-UHFFFAOYSA-N 384.501 5.073 30 20 GKED C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1ccccc1Oc1ccccc1C#N 611548556 AVSLVOSWVFBFKQ-GDBMZVCRSA-N 388.389 5.154 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccn3Cc3ccccc3)n2)cc1 613318049 KEJOIUJARKKLTE-HXUWFJFHSA-N 397.503 5.458 30 20 GKED Cc1ccc(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 642403581 GVQRWLBAIAFVLE-URLYPYJESA-N 386.311 5.165 30 20 GKED CC(C)(CNC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)C(F)(F)F 669953533 PXPSETAKAIQENZ-UHFFFAOYSA-N 378.263 5.051 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(COC(C)(C)C)cc1 674577929 RGTLIXIGOJGXHC-UHFFFAOYSA-N 382.504 5.230 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1C(=O)/C=C\c1cccnc1 727779877 ALHHOOIEQXCMLK-WTKPLQERSA-N 385.286 5.172 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3c[nH]nc3C(C)(C)C)s2)cc1 727974396 JPKFCPAQFGPDRH-FLIBITNWSA-N 381.501 5.044 30 20 GKED C=CC[C@H](NC(=O)N1CCC(c2c(C)[nH]c3ccccc23)CC1)c1ccncc1 734682815 GJLPWYWPRARVMT-NRFANRHFSA-N 388.515 5.078 30 20 GKED CC(C)(C)C1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 734929693 OIHNZPFNLOPHFD-JOCHJYFZSA-N 375.516 5.632 30 20 GKED CSCC[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 736958959 BMKNKHYPJVCDMT-KBXCAEBGSA-N 387.936 5.259 30 20 GKED Cc1ccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)cc1C 739438557 ZEGCCJWJWZDRKK-UHFFFAOYSA-N 377.538 5.390 30 20 GKED CS[C@H]1CC[C@@H](NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 742743242 VIXYYWJHZVDRQS-AEFFLSMTSA-N 386.904 5.018 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccccc2Cl)cc1 743294566 OTKVNYFWUILWSW-NRFANRHFSA-N 389.886 5.360 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c1 744117522 WVCWBPBTJSOLGR-INIZCTEOSA-N 381.476 5.079 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(Cl)c(C(F)(F)F)c1 754690739 ZBJYIWJAHATADV-PLNGDYQASA-N 383.584 5.295 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)CCCc2csc3ccccc23)c1 755320462 OBKZTMYHSPPAMD-LJQANCHMSA-N 392.524 5.221 30 20 GKED C=CCC[C@@H](NC(=O)Cc1ccccc1NC(=O)OC(C)(C)C)c1ccccc1 756013934 QCWZALFDGVZORJ-HXUWFJFHSA-N 394.515 5.400 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C/c3ccc(Cl)nc3)cc2)c1 759044477 OVAOJKBCEOMDLN-VZUCSPMQSA-N 375.815 5.051 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CSc2ccccc2OC)c1 764235500 WPIZTYRFIVKPEH-UHFFFAOYSA-N 393.533 5.064 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(N3CCCCC3)nc2)cc1 764991158 SIFZPTQQVHFUKO-SFHVURJKSA-N 385.939 5.054 30 20 GKED CCC[C@H](NCc1ccc(OC)c(O[C@H](C#N)CC)c1)c1ccc(Cl)cc1 772987915 ZRYIKMUVFCLRQJ-PMACEKPBSA-N 386.923 5.661 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1cccc2ccccc12)c1ccc(OCC#N)cc1 776155996 JQNCNYAGPPMFKD-NFQMXDRXSA-N 392.502 6.182 30 20 GKED C[C@@H](C1CC1)N(C(=O)Cc1ccccc1CC#N)c1cccc(C(F)(F)F)c1 776823464 DQXIKBNNSSBPMF-HNNXBMFYSA-N 386.417 5.146 30 20 GKED O=C1/C(=C\c2scnc2C2CC2)CSc2ccc(Br)cc21 782326630 CKDMYOIYCHWCNN-YHYXMXQVSA-N 378.316 5.155 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782383196 MBZXXJNVRUIOSZ-OALUTQOASA-N 381.479 5.367 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(SC(F)F)cc2)c2ncc[nH]2)c1 787167248 BTMPFJHZCYMUBH-GZTJUZNOSA-N 386.423 5.157 30 20 GKED CSc1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccccc2)cc1F 788354677 GXORQRQKLBDCBM-NTMALXAHSA-N 391.471 5.221 30 20 GKED N#CC[C@@H](CC(=O)OCc1csc(-c2ccc(F)cc2)n1)c1ccccc1 795979634 BKDFEXOSHXRXHI-KRWDZBQOSA-N 380.444 5.080 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571036 LIQKDHVQQWAPEM-DOMZBBRYSA-N 394.462 5.514 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 797829662 FARGNERKCXQGDJ-LJQANCHMSA-N 376.456 5.455 30 20 GKED O=C1/C(=C/c2csc(-c3cccc(Br)c3)n2)Cc2c(O)cccc21 810251488 ZBQHORDFHPKZKP-XYOKQWHBSA-N 398.281 5.101 30 20 GKED C#Cc1ccccc1CC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1 810437613 AFMVEQXONWFYTI-IBGZPJMESA-N 383.491 5.106 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813216844 GDQPTCRDKPFRAC-ZHZWZMEUSA-N 398.306 5.399 30 20 GKED CCC[C@H](OC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 835070985 XTLGDRABWYJTIQ-DOMZBBRYSA-N 383.300 5.108 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@]34CCCC[C@H]3C4(F)F)n2)cc1 850762265 HLTHCZJOQXTXLA-ZTNFWEORSA-N 386.467 5.510 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccc(-c3nccs3)cc2)cc1OC 883951384 AAJSUKFJEVNCJB-WZUFQYTHSA-N 392.480 5.035 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CC1)c1nc2cc(Cl)ccc2s1 917047111 RDVFADYMKCUPJY-AWEZNQCLSA-N 387.291 5.511 30 20 GKED O=C(O)Cc1ccc(NN=C2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1 1776084539 XVDXBBCBTZTMSK-GOSISDBHSA-N 390.405 5.458 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc4c(c3)CCCC4)s2)cc1 1776113718 SFHAAQIQVKTMCR-ACCUITESSA-N 388.488 5.888 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777372597 MSSJWZGIFPMPFJ-DNPFKWNUSA-N 398.458 5.519 30 20 GKED Cc1cc(CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)ccc1F 26053850 HEBLFGIJTYUCHV-UHFFFAOYSA-N 390.483 5.228 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2cc(C)cc(C)c2)cc1 27187261 MTRPGLWVHOIIAM-UHFFFAOYSA-O 395.573 5.320 30 20 GKED CSc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 41549379 GUMBGZASKVJHAX-GFCCVEGCSA-N 392.427 5.527 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N(C)[C@@H](C)c2ccc(C)cc2)cc1 56757738 VDEHNLLGHOKVBL-IBGZPJMESA-N 391.515 5.034 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CNc3ccccc3Cl)cc2)cc1 63661240 WOUSLUQILZLKAY-UHFFFAOYSA-N 377.831 5.055 30 20 GKED Cc1cccc(-c2nnc(SC[C@H](C#N)CCC#N)n2[C@H]2CCCC[C@H]2C)c1 66237892 MBDKJXWEFFQGNH-HBFSDRIKSA-N 393.560 5.540 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1nc2ccccc2o1 67799310 OJPKLGMVGSSNTI-LBPRGKRZSA-N 389.238 5.170 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1ccc(Br)cc1 97546127 QCQUVWUTERRQDQ-BQYQJAHWSA-N 376.300 5.530 30 20 GKED C[C@@H](CC#N)N(C)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 120249797 KVIZMDCAJJUSDH-ZDUSSCGKSA-N 377.366 5.264 30 20 GKED N#CCC[C@H](NC(=O)NC(c1cccs1)c1cccs1)c1ccccc1 133073752 RQKTUUMSDRMCCS-INIZCTEOSA-N 381.526 5.243 30 20 GKED N#C[C@@H](C(=O)CC1CCSCC1)c1nc(-c2ccc(Cl)cc2)cs1 134978900 YCYWVTMCCPVDSS-HNNXBMFYSA-N 376.934 5.173 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC=C(c2ccc(F)cc2)CC1 171839200 HQRCCGQUVIDYHK-MRXNPFEDSA-N 395.503 5.541 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC(C(F)(F)F)CC1 173482559 XZYPBINUZCOBDV-UHFFFAOYSA-N 390.430 5.124 30 20 GKED C[C@H](CCOc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 173968804 CNTPLWIMIXGGRY-VQIMIIECSA-N 376.481 5.092 30 20 GKED N#CCSc1cccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 176022660 DODQZSZRWHSUPW-AWEZNQCLSA-N 383.885 5.055 30 20 GKED Cc1c([C@@H](C)Nc2cccc(OCCCC#N)c2)cnn1-c1ccc(F)cc1 179821629 VZXISBGANGYVEU-MRXNPFEDSA-N 378.451 5.176 30 20 GKED CCC(C)(C)N/C(S)=C(/C(=O)c1ccc(C(C)C)cc1)[n+]1cccc(C)c1 186970139 IKYPEUTUVWREJT-UHFFFAOYSA-O 383.581 5.123 30 20 GKED C=C(C)[C@@H](NCc1coc(-c2c(F)cccc2F)n1)c1ccc(F)c(F)c1 187779458 LGVVWWWSKYGJPE-LJQANCHMSA-N 376.353 5.305 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2 191427091 CIYRQGLZULMFMO-INIZCTEOSA-N 391.515 5.306 30 20 GKED N#Cc1c(NC(=O)c2ccc(COc3ccccc3)cc2)sc2c1CCCC2 247708470 HCXCCYOPEQZBOQ-UHFFFAOYSA-N 388.492 5.330 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)/C=C(\c2ccc(Cl)cc2)C(F)(F)F)n1 255054082 CFMXZRQRYJTEKW-PFLCFFIHSA-N 398.837 5.742 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1cccc(Cl)c1 303417465 XAMWWVSUXAMJLD-YOEHRIQHSA-N 387.936 5.865 30 20 GKED CC(C)(C)C(O)=Nc1nc(C/C(O)=N/[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cs1 329573193 AGQKODKJCVRFJV-RRFJBIMHSA-N 377.554 5.635 30 20 GKED N=C(O)N1CCc2ccc(N=C(O)[C@@]3(Cc4ccccc4)C[C@H]4CC[C@H]3C4)cc21 330334226 YOQAFRVHESWGQV-KDLAUNOPSA-N 389.499 5.179 30 20 GKED CC(C)n1nc(-c2ccccc2)cc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425648208 GFVVQZRZLMKVQP-QGZVFWFLSA-N 387.487 5.228 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1O[C@@H](C)C(F)(F)F 425674106 OUUMEBMKAKDAOX-KBPBESRZSA-N 391.393 5.113 30 20 GKED Cc1[nH]c2ccccc2c1C1=CCN(C(=O)Nc2ccc(C#N)cc2Cl)CC1 426153424 MSVDONJORKLMBZ-UHFFFAOYSA-N 390.874 5.323 30 20 GKED Cc1nc(C(C)C)oc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 428057058 NNGOLYYBDACOEP-UHFFFAOYSA-N 395.846 5.676 30 20 GKED CN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)[C@H]1CCC(C)(C)C1 431975582 XVJDVJBGKWFLAD-FQEVSTJZSA-N 391.515 5.374 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OCc2ccccc2)cc1)c1ccccc1 432468068 FBNXZPXYFSXVIW-XMMPIXPASA-N 399.494 5.822 30 20 GKED N#Cc1ccc(NC(=O)NCC[C@@H](c2ccccc2)C(F)(F)F)c(Cl)c1 433288069 YGSYSQUMXGOUIG-AWEZNQCLSA-N 381.785 5.069 30 20 GKED COc1ccc(C)cc1NC(=O)[C@H](Sc1cccc(C#N)c1)c1ccccc1 435025675 DYNPMNQHHMUJHK-JOCHJYFZSA-N 388.492 5.347 30 20 GKED CC(C)Cc1ccc([C@@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)cc1 437645583 KHYNXVYFEMIPQA-QHCPKHFHSA-N 388.515 5.294 30 20 GKED CCCOc1cc(C)ccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 437807162 SBHPBQWOZBGJMJ-CTNGQTDRSA-N 377.488 5.088 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(OCC2CC2)c(F)c1 438842334 OVVBWAKHWDYMQN-IIBYNOLFSA-N 395.478 5.020 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1 439588615 SLASMEVICFBTHV-MOPGFXCFSA-N 395.469 5.095 30 20 GKED N#CCC[C@H](NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1ccccc1 439667838 LNHQQWPJEMIDSG-QHCPKHFHSA-N 380.451 5.077 30 20 GKED C=CCC[C@H](NC(=O)N(C)C1CCC(OC)CC1)c1ccc(C(F)(F)F)cc1 442283055 JSSGPZHPEJDKKV-ACBHZAAOSA-N 398.469 5.312 30 20 GKED CC(C)(C)c1nsc(Oc2ccc(N[C@@H]3CC[C@H](C#N)C3)cc2Cl)n1 442862488 OKUZXZHBTIEVQU-NWDGAFQWSA-N 376.913 5.385 30 20 GKED Cc1sc(NC(=O)c2cc3ccccc3n2CC(F)(F)F)c(C#N)c1C 447197987 CJLPQUPMJBFUIG-UHFFFAOYSA-N 377.391 5.006 30 20 GKED Cc1cc(CSc2nnc(-c3ccco3)n2Cc2ccccc2)ccc1C#N 447295111 JIEGQQXQJKAJCJ-UHFFFAOYSA-N 386.480 5.059 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@@H]2Cc2ccccc2Cl)c(Cl)c1 455702962 LRYZPEDPPKAWDR-MRXNPFEDSA-N 388.298 5.298 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c(Cl)c1 464415530 XUOJEQKJJFKRCD-HNNXBMFYSA-N 396.796 5.423 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C 466121371 HSSYWFKVFSWEAF-XGRCMKMKSA-N 395.934 5.529 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(F)c(Br)cc3Cl)cc2)CC1 466444638 YBIDLVDHKLDKMP-UHFFFAOYSA-N 393.643 5.049 30 20 GKED CC(C)Sc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 472556444 OTELEQHJZFNHGC-UHFFFAOYSA-N 389.480 5.498 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 475500040 CUCNFPUEOLMFSV-UHFFFAOYSA-N 375.428 5.098 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccc2c(c1)OCO2)c1ccccc1)c1ccccc1 475647843 SMBUJHYIJLTIHE-NRFANRHFSA-N 398.462 5.036 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)CS[C@H](C)c1ccc(C#N)cc1 476165433 UCTUQYKUEONNTG-OXQOHEQNSA-N 382.529 5.019 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(-c2nc(C)co2)c1 480991254 MLAPTGUSXGFFCJ-UHFFFAOYSA-N 387.892 5.585 30 20 GKED O=C(Nc1nc2c(C(F)(F)F)cccc2s1)c1c(F)c(F)cc(F)c1F 481765292 SBOQWENHZYWLHV-UHFFFAOYSA-N 394.271 5.124 30 20 GKED CCCn1c(SCc2ccc(F)cc2C#N)nnc1-c1ccc(Cl)cc1 483086992 KSZPARSBELESAX-UHFFFAOYSA-N 386.883 5.312 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1ccc(F)cc1 483198403 QCCGEUGJEMJMAK-HXUWFJFHSA-N 398.441 5.002 30 20 GKED N#C[C@@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1nc2ccccc2o1 483476925 IIDKCGORGZSCED-INIZCTEOSA-N 379.375 5.126 30 20 GKED N#CCSc1cccc(C(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)c1 485545812 OUXIQODTVDFDAH-BHDDXSALSA-N 376.525 5.101 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2cccc(OCCC(C)C)c2)cc1 502657043 XSFKHWXZHPIDLZ-UHFFFAOYSA-N 396.491 5.063 30 20 GKED Cc1ccc([C@@H](NC(=O)c2sc3ccc(C#N)cc3c2C)c2ccccn2)cc1 510073926 PQAJFBPRLOXPMK-JOCHJYFZSA-N 397.503 5.304 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N(Cc2cccs2)C(C)C)cc1 513874278 KMFDMKYPMXZMCN-UHFFFAOYSA-N 397.544 5.005 30 20 GKED C=CCN(C(=O)c1ccn(Cc2ccccc2)c1)c1nc(-c2ccccc2)cs1 514151468 LKEVDDTYAZFEGY-UHFFFAOYSA-N 399.519 5.493 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)n1 516075092 USGCIMDVCAZOLR-NSHDSACASA-N 393.320 5.977 30 20 GKED CCCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H]1CCc2ccccc21 517533574 WSNPFMPFOFJNOJ-LAUBAEHRSA-N 393.556 6.012 30 20 GKED CC(C)(C)CCCNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 523560102 JSKFGVYDUROOOP-UHFFFAOYSA-N 379.504 5.279 30 20 GKED C=CCC[C@H](NCc1nc(C(F)(F)F)cs1)c1ccc(C(F)(F)F)cc1 540428907 BXOQSSNCNULSSX-ZDUSSCGKSA-N 394.384 5.978 30 20 GKED CCC(C)(C)OCc1ccccc1N[C@H](C)C(=O)N(CCC#N)c1ccccc1 542519882 UFUCFBDCLVOSMY-LJQANCHMSA-N 393.531 5.139 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1F 543320598 MUPQMUFEXVUPLX-PXNSSMCTSA-N 399.441 5.056 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c(F)c1 543860802 MFIPEOJJAWMNLB-LLVKDONJSA-N 382.382 5.144 30 20 GKED CSCc1ccccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 544708174 IFCQKHJHSCATIU-UHFFFAOYSA-N 388.492 5.253 30 20 GKED CC(C)N(Cc1ccc(NCc2ccc(C#N)cc2F)cc1)C[C@@H]1CCCCO1 544926695 HZMSQZMBIDGSMR-QHCPKHFHSA-N 395.522 5.089 30 20 GKED N#Cc1ccsc1NC(=O)Cc1cccc(OCc2ccc(Cl)cc2)c1 552853691 LSLOXPHBZRPMPI-UHFFFAOYSA-N 382.872 5.033 30 20 GKED C[C@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 555005094 GYYLRUCVJMKZKP-GAJHUEQPSA-N 398.466 5.155 30 20 GKED C[C@H](SCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1F 561138582 SARRGERJPZZBJT-CABCVRRESA-N 388.533 5.653 30 20 GKED Cc1c([C@@H](C)NCC(C)(C)CCC#N)cnn1-c1ccc(Cl)cc1Cl 562045137 JAGHTWMSDNDPEQ-CYBMUJFWSA-N 379.335 5.468 30 20 GKED CSc1nc(C2CC2)cc(-c2nc(CSCc3ccccc3)no2)c1C#N 576502666 LBQZJSNLVZMFPD-UHFFFAOYSA-N 394.525 5.036 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2ncc(C#N)cc2C)c(C(F)(F)F)c1 581712208 UYVRVNZWOSDEHY-LBPRGKRZSA-N 393.434 5.423 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1cccnc1)c1nc2cc(F)ccc2s1 592974028 MMHVYUHTQFNIOV-INIZCTEOSA-N 389.411 5.113 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 596691880 PYSDBCMFBHPMKH-OXQOHEQNSA-N 392.890 5.153 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccncc1 596733814 KQIIYFGLFKCPBV-JXFKEZNVSA-N 392.528 5.092 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@@H](C)C(F)(F)F 599432015 YCARZFJUNVAYKY-CQSZACIVSA-N 378.369 5.128 30 20 GKED N#Cc1c(NC(=O)CCc2ccc(F)cc2)sc2c1-c1ccccc1CC2 603991522 AQJGNLRCCUPCKB-UHFFFAOYSA-N 376.456 5.096 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1 604085124 SGFFSSMPXLESAC-KRWDZBQOSA-N 375.394 5.303 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H](C)c1ccccc1C(F)(F)F 607803196 USMDMMHDMRRPLF-OAHLLOKOSA-N 377.406 5.032 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3nc(C)c(SCC#N)s3)c(F)c2)cc1 609297954 WJMVWYUZQISGOI-UHFFFAOYSA-N 397.500 5.434 30 20 GKED Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)c2ccc(SC(C)C)cc2)c1C 610053833 YQRAXKMLDJSRCP-UHFFFAOYSA-N 390.512 5.114 30 20 GKED C[C@@H](NCc1ccc(-c2cccc(Br)c2)o1)c1cccc(C#N)c1 610344869 JROOQSMGEGFRTD-CQSZACIVSA-N 381.273 5.432 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)C1 612308091 NNZMICBROLLRDL-NRFANRHFSA-N 383.879 5.077 30 20 GKED Cn1c(S[C@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccc(Cl)cc1 619863450 LFODFHAUMKZTTN-OAHLLOKOSA-N 375.284 5.146 30 20 GKED FC(F)c1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 684368019 YTBOXUUIOURUAG-ITGUQSILSA-N 375.303 5.623 30 20 GKED C=CCN(Cc1cccs1)C(=S)N[C@H](C)c1ccc(Cl)cc1Cl 726444618 YEMXLOHZIAAFCA-GFCCVEGCSA-N 385.385 5.679 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=NNc2nncc4ccccc24)CCC3)cc1 727648255 AJTWJMRZAJREOF-UHFFFAOYSA-N 385.496 5.214 30 20 GKED N#C[C@H](C(=O)Cc1cccc(Cl)c1)c1nc(-c2ccc(Cl)cc2)cs1 727955103 YEBICLFVFWQWRQ-MRXNPFEDSA-N 387.291 5.536 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3SC(F)F)c2)cc1 728458614 ARNASLMJFADLJH-UHFFFAOYSA-N 396.418 5.918 30 20 GKED N#C[C@@H](C(=O)[C@@H](OC1CCCC1)c1ccccc1)c1nc2cc(F)ccc2s1 730420400 DDHLEFQXUDHQRU-UWJYYQICSA-N 394.471 5.312 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 731167095 KYUDDUPSXUPKNK-DHIUTWEWSA-N 391.474 5.079 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@@H]2CCOc3ccccc32)cc1 731280663 SNKNAIIETQRLNA-NZQKXSOJSA-N 397.478 5.030 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)Cc2ccc(OCC#N)cc2)C(C)C)cc1 731962267 LDNNBWBLFSPYHY-UUOWRZLLSA-N 378.516 5.158 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 732496366 SHAZIANCWYOXBO-IEBWSBKVSA-N 378.522 5.557 30 20 GKED O=C(/C=C\c1nccn1Cc1ccccc1)c1ccc(Cl)c(Cl)c1Cl 734096481 NDVJHJNFDBPFCY-HJWRWDBZSA-N 391.685 5.788 30 20 GKED C=CC[C@@H](NC(=O)Nc1ccc(N(C)C2CCCCC2)c(F)c1)c1ccncc1 734684497 SJLSGDNGNGAPBQ-OAQYLSRUSA-N 396.510 5.429 30 20 GKED C[C@H]1C[C@H]1c1ccc(CCC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 739594960 BKNGIENZXHYNME-MGPUTAFESA-N 390.508 5.252 30 20 GKED CS[C@H]1CC[C@H](NC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 742744332 JNMGWFNRKGGESU-HOCLYGCPSA-N 386.904 5.018 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 743447382 OKRCIBUIPCQUAC-FERCGXDMSA-N 376.456 5.537 30 20 GKED CCOc1ccc(O)c(C=Nc2ccc(OCc3ccccn3)c(Cl)c2)c1 743538855 QOSRUDGTYSAQKF-UHFFFAOYSA-N 382.847 5.169 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 747196175 IEVGUHUBXQFVND-SFHVURJKSA-N 384.545 5.455 30 20 GKED COc1cc(/C=C/C(=O)c2ccsc2)c([N+](=O)[O-])cc1OCc1ccccc1 749105042 QCFVRDBMTICDBS-BQYQJAHWSA-N 395.436 5.140 30 20 GKED N#C[C@@H](COC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)Cc1cccs1 772736163 XASGHQVFJUAKBE-AWEZNQCLSA-N 398.871 5.128 30 20 GKED N#CCCCn1cc(C(=O)O[C@@H](c2ccccc2)c2ccncc2)c2ccccc21 774068338 HDNTZYUCKAHXGU-DEOSSOPVSA-N 395.462 5.286 30 20 GKED CC(=O)N1C/C(=C/c2ccc(-c3ccccc3F)s2)C(=O)c2ccccc2C1 778520495 ZLZUQKOTQZQFBE-ATVHPVEESA-N 391.467 5.183 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(Oc2ccccc2Cl)nc1 780153273 WSHYYBGVGROLTK-AWEZNQCLSA-N 393.830 5.070 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c1 780161714 ITOPFYAUKNHABE-KRWDZBQOSA-N 386.451 5.295 30 20 GKED Cc1cc(-c2cc(C(=O)OCCCC(C)(C)C#N)c3c(C)noc3n2)c(C)s1 782637373 SQDOGZOWHLFGEO-UHFFFAOYSA-N 397.500 5.363 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)Nc1cc(C)n(CCC#N)n1 782763177 KNQPUYJDBRQNFH-UHFFFAOYSA-N 393.878 5.378 30 20 GKED N#C[C@@H](C(=O)CCCCc1ccc(Cl)c(Cl)c1)c1cnc2ccccc2n1 792100429 NIZBPHPRZOBPTR-OAHLLOKOSA-N 398.293 5.526 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCC(C)(C)c3ccccc32)ccc1OC 795803214 ODFMUZHXFGQDJX-WIYYLYMNSA-N 378.516 5.278 30 20 GKED CC[C@H](Oc1ccccc1Cl)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571003 MUFZHGJFFNUPJZ-JSGCOSHPSA-N 376.909 5.128 30 20 GKED Cc1ccc(C(=O)N(c2ccccc2)c2ncccc2Br)cc1C#N 799355073 ZOSCVLZIRSBWMK-UHFFFAOYSA-N 392.256 5.003 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCC(F)(F)C1)c1nc(-c2ccc(Cl)cc2)cs1 800387899 WPTUYSFFRQIMCK-JSGCOSHPSA-N 380.847 5.465 30 20 GKED C=C(CNC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1ccccc1 805250442 DAOPYVMPCIOCJZ-UHFFFAOYSA-N 386.879 5.130 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 805857446 UQCHLGZZJKWBJX-ZDUSSCGKSA-N 379.312 5.729 30 20 GKED COc1cc(/C=C2/C(=O)c3cccc(C)c3[C@H]2C)cc(OC)c1OCC(F)F 809157276 JEUNECNBRUQQMH-MJOIQJIUSA-N 388.410 5.040 30 20 GKED O=C(Nc1cccc(SC(F)F)c1)c1c(F)cc(C(F)(F)F)cc1F 810333142 PIWPRTODIQHDIT-UHFFFAOYSA-N 383.288 5.551 30 20 GKED CCC[C@H](C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccn1 810556019 WYXVCSJEXQRJGL-KBPBESRZSA-N 397.450 5.243 30 20 GKED C#C[C@@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)cc1 812795170 OQCOYRXIZIDGAX-JOCHJYFZSA-N 392.861 5.196 30 20 GKED C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C2(C#N)CC2)cc1 819468959 NESDZTAVMFXJJW-LJQANCHMSA-N 399.538 5.214 30 20 GKED CCC[C@@H](C(=O)[C@H](C#N)C(=O)Nc1ccccc1Cl)c1cccc(Cl)c1 860468949 GRNVGNDIOVNCJU-CVEARBPZSA-N 389.282 5.225 30 20 GKED CCO[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 860475878 VUKGRHPPWKYFBD-GUYCJALGSA-N 395.311 5.108 30 20 GKED C=C1CCC(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)CC1 887864507 VTVJETUFVQPZTL-UHFFFAOYSA-N 392.377 5.236 30 20 GKED C=CCCC[C@H](NCc1ccccc1Oc1ccc(F)cc1Cl)C(=O)O 900068463 IWFPKYQXMQDZHK-KRWDZBQOSA-N 377.843 5.171 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)cc2nc1C 915086832 NPQOCWZTFHBXRM-QFIPXVFZSA-N 392.462 5.154 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4c(F)cccc4s3)cn2)c1 915175225 QKZXGYWAZPAAPV-UHFFFAOYSA-N 389.411 5.352 30 20 GKED Clc1ccccc1NN=Cc1cn(Cc2ccccc2)nc1-c1cccnc1 916262578 IGSYWRWBYUEZAR-UHFFFAOYSA-N 387.874 5.093 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2sc3cccc(C)c3c2Cl)c1 916897993 WJVYCUBVWBKXPH-CQSZACIVSA-N 382.872 5.133 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)[C@H](C#N)c1nc2ccccc2o1 917509825 BAQZVCMHWTVVLB-HWOXTHGCSA-N 384.435 5.806 30 20 GKED O=C(Nc1cccc(CCC(F)(F)F)c1)N1CC[C@]2(C1)CC(F)(F)C2(F)F 930312224 ZBMDONSVSPVHCB-CQSZACIVSA-N 398.322 5.080 30 20 GKED C[C@H]1[C@H](C)N(CCCCC2(C#N)CCC2)CCN1CCCCC1(C#N)CCC1 931069829 ISCNWWDLSRGUJA-VXKWHMMOSA-N 384.612 5.109 30 20 GKED Cc1ccc(NN=Cc2ccc(-c3cccc(CC(=O)O)c3)cc2)c(Cl)c1 1776060774 NEQHLUCCLIBNFM-UHFFFAOYSA-N 378.859 5.389 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2cc(C)cc(C)c2)cc1 1776782785 JTFGEACTCZQUJF-XMMPIXPASA-N 381.560 6.264 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(F)ccc1N(C)C[C@H](C)CC 1776782910 LUHIJZOSUBCWJD-WIYYLYMNSA-N 394.575 5.601 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OCCCC)c(OC)c1 1776784794 XEQGKXTUDOTKSA-IBGZPJMESA-N 379.541 5.168 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1OC 1776789315 SJNRPEIBCITZCN-XFXZXTDPSA-N 396.483 5.557 30 20 GKED CCCOc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1OCC 1776818089 KIRMFDCYXWOMKB-AQTBWJFISA-N 394.467 5.175 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CC4(CC4)c4ccccc4C3=O)s2)cc1 1777670921 BBUIVMUGOLHXCT-LGMDPLHJSA-N 386.472 5.815 30 20 GKED O=C1/C(=C\c2ccccc2OC2CCCCC2)C[C@H](C(=O)O)c2ccccc21 1777698151 NZNAPNYAXKAFPQ-JIHAQRTOSA-N 376.452 5.236 30 20 GKED O=C(Nc1cccnc1)/C(=C/c1cccc(C(F)(F)F)c1)C(=O)c1ccccc1 7367458 OMMPKMSCKROIIJ-CPNJWEJPSA-N 396.368 5.005 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1Cl 33195181 UWZULGWTRSOKNR-HTQZYQBOSA-N 391.714 5.118 30 20 GKED CCCCN(C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C1CC1 47570410 BYAJJGLTSVKCDU-UHFFFAOYSA-N 377.488 5.128 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)cc(Cl)c1 63388651 BNXOEKPFIBOIQP-UHFFFAOYSA-N 380.231 5.122 30 20 GKED C=CCn1c(SCc2csc(C3CCCC3)n2)nnc1-c1ccccc1 64022531 LYZGZIXGZOMQRS-UHFFFAOYSA-N 382.558 5.538 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCC(=O)c1ccc(Cl)cc1 66856460 NNMXPDQYYHHEKK-CQSZACIVSA-N 386.904 5.336 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1cc(F)ccc1F 72030818 QGKKHMVZDWRSND-AWEZNQCLSA-N 393.393 5.068 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccnc3Cl)cc2Cl)c1 102731211 QAOPAXXLASTCAB-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Sc2ncccn2)cc1C 105030282 XKJUPKOPIMWABR-UHFFFAOYSA-N 396.541 5.218 30 20 GKED CCN(CC(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@@H](C)c1ccc(F)cc1 108359800 DJRANVGVHUTICA-IRXDYDNUSA-N 399.535 5.099 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1cccc(OC(F)F)c1 113570101 PIPHJBGMIJTTSV-GFCCVEGCSA-N 377.416 5.184 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(CSC2CCOCC2)c1 116517284 BGYCABJXMXUCGV-UHFFFAOYSA-N 396.556 5.319 30 20 GKED C=CCn1c(SCc2nc(-c3ccsc3)oc2C)nnc1-c1ccccc1 116679321 LMRNJFOIFNOJLF-UHFFFAOYSA-N 394.525 5.448 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)[C@@H]1c1ccc(C(F)(F)F)cc1 156547293 XYZOCPKIRRQZEX-LIRRHRJNSA-N 387.405 5.386 30 20 GKED C[C@@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)c1ccc(C#N)cc1 159353716 NJRBBNSPUIYNGS-MRXNPFEDSA-N 389.528 5.570 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Oc2cccc(Cl)c2Cl)n1 177773151 MWCNMRAKSZVNTK-WDEREUQCSA-N 383.300 5.217 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)cn1 186366072 GOCFYCCUVGTWCT-HNNXBMFYSA-N 388.496 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccn(-c2ccc(F)cc2F)n1 189902419 KFHVXPUIBDFEKB-UHFFFAOYSA-N 381.426 5.255 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)s1 255639084 NVIAYCQVSHMDEK-ZBTGYSDGSA-N 393.537 5.454 30 20 GKED COc1ccc(Cl)c(N/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 329512699 NNBSDMXDSBFZPL-QGZVFWFLSA-N 388.899 5.064 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(F)(F)F 361442894 UBYUNGSBSPZTJE-PKOBYXMFSA-N 387.405 5.095 30 20 GKED CO[C@@H](C)c1nc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 369987897 UEYXXDGKZGZNGS-HOTGVXAUSA-N 377.513 5.240 30 20 GKED CC(C)[C@H](NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)c1ccc(F)cc1 410214962 KCTUOBAYQVYBJV-FKBYEOEOSA-N 379.479 5.004 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1OCC(F)(F)F)c1ccccc1 432695202 ZFAMCHVHHJTEEP-INIZCTEOSA-N 391.393 5.184 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433686713 VJKICCSSOTVMBP-UHFFFAOYSA-N 381.263 5.006 30 20 GKED CN(C(=O)c1ccc(COc2ccccc2)cc1)c1cc(Cl)ccc1C#N 436006076 YPQKJANHDOMVLT-UHFFFAOYSA-N 376.843 5.067 30 20 GKED CC(C)(C#N)CCCCSc1nnc2c(Cl)cc(C(F)(F)F)cn12 436114984 NFDVMLQHWAWRIL-UHFFFAOYSA-N 376.835 5.214 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc(F)c(F)c(F)c2)cc1F 437502785 VSFNPZVDDAGDCE-UHFFFAOYSA-N 386.304 5.159 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Cl)c3cccnc23)cc1C(F)(F)F 443886289 RZPQLFIIQBPIJS-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CCc1ccc(Cl)c(Cl)c1 464943299 LQPYVNVQGKPVKM-FXAWDEMLSA-N 387.310 5.224 30 20 GKED Cc1cccc(NCc2cn(CCC#N)nc2-c2ccccc2)c1Br 470338028 OKXSHEVLWQJZIE-UHFFFAOYSA-N 395.304 5.147 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C 476165838 VQJAGRABCXRCTJ-UHFFFAOYSA-N 393.918 5.938 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)N[C@@H](C)CC#N 481239935 WZHXXHJTTHRQRK-HNNXBMFYSA-N 393.466 5.155 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)CCc2ccc3ccccc3n2)cc1 486858067 SEGWSDTWZSLHBU-UHFFFAOYSA-N 391.474 5.022 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@H](C#N)c3ccc(Cl)cc3)s2)c(C)c1 499863117 PJZZXGWOHZIESE-GOSISDBHSA-N 395.915 5.383 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NC(=O)c1cscc1C#N 500355348 KWCBROBSCHYUKY-UHFFFAOYSA-N 395.871 5.086 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2cccs2)Cc2cccs2)c1 502417089 OMULJSPULHTBGV-UHFFFAOYSA-N 398.553 5.999 30 20 GKED CCC[C@@H]1C[C@H](C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)CCO1 503417888 HFRQCRXIBYSMLV-DENIHFKCSA-N 396.918 5.340 30 20 GKED Cc1nc(NC(=O)CSc2ccc(C(C)(C)C)cc2)sc1SCC#N 504699297 FWVJSVALUBJGOT-UHFFFAOYSA-N 391.587 5.096 30 20 GKED CCN(C(=O)c1cc2c(Br)cccc2[nH]1)[C@@H](C)c1ccc(C#N)cc1 509239708 LKZLIQMURVDBGY-ZDUSSCGKSA-N 396.288 5.025 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cccc(C#N)c3C)c(C)c2)n1 509934684 MZCUSJGBTCRDPB-UHFFFAOYSA-N 379.510 5.344 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CC[C@H]1c1ccc(Cl)cc1 511544718 DLFDOYIPTMEJOL-BEFAXECRSA-N 399.947 5.120 30 20 GKED N#C[C@H](NC(=O)c1cc(C2CC2)nc2ccccc12)c1ccc(Cl)c(Cl)c1 518321564 SWNJUQQEUVWTIM-FQEVSTJZSA-N 396.277 5.414 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCCCC3)c2c(C(C)C)noc2n1 521325986 GUNDJBBEKKZITL-UHFFFAOYSA-N 394.500 5.109 30 20 GKED C[C@H](CC(=O)Nc1sc2c(c1C#N)CC[C@@H](C(C)(C)C)C2)c1cccnc1 522887782 KJYDBKDIFLWDCU-GDBMZVCRSA-N 381.545 5.298 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](n2ncc3ccccc32)C1 530553131 WYEYHMSMLKFSLO-FQEVSTJZSA-N 388.515 5.367 30 20 GKED N#CCCCOc1cccc(CNC2(c3c(Cl)cccc3Cl)CC2)c1 532104486 LNGROUGXCVNNJU-UHFFFAOYSA-N 375.299 5.455 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)c1ccc(CC#N)cc1 533948605 HHULOYPHMIXRJR-UHFFFAOYSA-N 398.441 5.006 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)c1ccc(CC#N)cc1 536221373 NDUDFRLGFLSQFY-UHFFFAOYSA-N 388.492 5.306 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)N(Cc1ccco1)c1ccccc1 538943991 YLSXAMXZQRBCOG-UHFFFAOYSA-N 382.872 5.130 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccccc2Cc2ccccc2)C2CC2)cc1 542356718 TXHAMOJBTKJMNM-UHFFFAOYSA-N 381.479 5.346 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1-n1cccn1 557384567 WUGZDZSPEFWUDD-IBGZPJMESA-N 378.479 5.262 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC(c4ccccc4)CC3)cc2)ccn1 575790494 BETKQOCGZOAPHH-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CC1(C)CN(C(=O)c2cn(CCCC#N)c3ccccc23)[C@H]1c1cccs1 584832227 SHSZRKDDKCRLTH-FQEVSTJZSA-N 377.513 5.230 30 20 GKED C[C@H](NC(=O)NCc1ccccc1-c1ccc(Cl)cc1)c1ccc(C#N)cc1 608860885 NEYBRZUBQIAPAV-INIZCTEOSA-N 389.886 5.439 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCC(C)(C)c1cccc(Cl)c1 608920686 YQMADVSHKQEGMR-UHFFFAOYSA-N 383.923 5.109 30 20 GKED CC(C)CN(C(=O)c1csc(-c2ccccc2Cl)n1)c1ccc(C#N)cc1 608935588 BXSCYXDLCBANNI-UHFFFAOYSA-N 395.915 5.638 30 20 GKED N#Cc1cccc(COc2ccc(Nc3ncnc4sccc34)cc2F)c1 609111758 HIWGAGIFNQFTFE-UHFFFAOYSA-N 376.416 5.025 30 20 GKED N#Cc1cccc(NC(=O)[C@H](Sc2cc(F)ccc2F)c2ccccc2)c1 609297377 ALZIDESTNIFVAF-HXUWFJFHSA-N 380.419 5.309 30 20 GKED CC(C)(C(=O)N1CCC(Oc2cccc(C#N)c2)CC1)c1ccc2ccccc2c1 610227534 BKCDTQOIZKCLBL-UHFFFAOYSA-N 398.506 5.059 30 20 GKED N#C[C@@H](NC(=O)C1CCC(c2ccccc2)CC1)c1ccccc1Br 610293838 KORRSPHHRPYKLG-LBXVMSDZSA-N 397.316 5.104 30 20 GKED CC(C)[C@@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610349933 LUNNUDMQEMDNDG-IFXJQAMLSA-N 389.421 5.335 30 20 GKED COc1ccc([C@H](C)NC(CCC(F)(F)F)CCC(F)(F)F)cc1F 658254631 MERCENUQPBXZBB-JTQLQIEISA-N 375.328 5.539 30 20 GKED C[C@@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(Br)cc1 726439927 BJIKVAYYWMIFLK-SNVBAGLBSA-N 394.725 5.022 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)c2)cc1 729656212 UHLQLGQIGLSYKD-UHFFFAOYSA-N 393.786 5.164 30 20 GKED N#Cc1ccc(NC(=S)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1Cl 730950309 IDTOFWATDHDTPB-HXUWFJFHSA-N 394.931 5.617 30 20 GKED Cc1cc(C(=O)/C=C/c2ccc(OCc3occc3C(=O)O)cc2)c(C)s1 730952471 WWBQWTGARZVBEF-VMPITWQZSA-N 382.437 5.131 30 20 GKED C#CCOc1ccc(NC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1 731114928 SRRRWESXDUWCMB-LJQANCHMSA-N 389.282 5.374 30 20 GKED O=C1/C(=C/c2nccn2Cc2ccccc2)CCOc2c1ccc(Cl)c2Cl 734096009 VDHLQVUAMLURHU-NTCAYCPXSA-N 399.277 5.287 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CSc4ccccc43)n2)cc1 735769218 HMRJAHVVHSUSQK-IAGOWNOFSA-N 376.506 5.184 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@H](C)c3cccc(C(F)(F)F)c3)[nH]c12 739190606 IIKBAIYWXQILND-BBRMVZONSA-N 385.389 5.260 30 20 GKED Cc1c(C(=O)/C=C\c2cnc3ccc(Br)cn23)oc2ccccc12 740764886 JIGQGGHGHIQQKA-FPLPWBNLSA-N 381.229 5.048 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1cc(Cl)ccc1Br 742432581 CKVYLQFZQDIUIL-VMPITWQZSA-N 381.701 5.393 30 20 GKED N#Cc1cccc(COc2cccc(/C=C\C(=O)c3ccc4c(c3)COC4)c2)c1 742435894 BFYHSNFFXTZROC-YFHOEESVSA-N 381.431 5.064 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1 743200523 HCBALJTWKKGXQA-ZDUSSCGKSA-N 394.368 5.081 30 20 GKED Cc1cc(C)c(NC(=S)N(Cc2ccc(C#N)cc2)CC(C)C)c(Cl)c1 745695826 VLKAOSHXMBXZAM-UHFFFAOYSA-N 385.964 5.684 30 20 GKED COc1cc(/C=C\C(=O)c2c[nH]c3ncccc23)ccc1OCc1ccccc1 761817915 PIAFJOMCYJMWHS-LUAWRHEFSA-N 384.435 5.047 30 20 GKED CC(C)c1ccc(C[C@H]2CCN(C(=O)c3ccccc3SCC#N)C2)cc1 764032964 BVBPTAXWYIVUQF-LJQANCHMSA-N 378.541 5.130 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(O)(c2ccccc2Cl)CC1)c1ccccc1 765533524 GUFWGBDPAHTUJC-OAQYLSRUSA-N 398.934 5.041 30 20 GKED CC(C)(C#N)CCCCOC(=O)COc1ccc(C2SCCCS2)cc1 768538613 XKEBEYDIHLXRCH-UHFFFAOYSA-N 393.574 5.197 30 20 GKED Cc1csc(Sc2ccc(NC(=O)Cc3ccccc3CC#N)c(C)c2)n1 776874692 ZXFFUHOEPKKUHH-UHFFFAOYSA-N 393.537 5.158 30 20 GKED N#CCCn1cc(/C=C2\C(=O)c3cccc4c3[C@@H]2CCC4)c(-c2ccccc2)n1 788355979 SRROXORIYGLYRN-AREJXAQWSA-N 379.463 5.164 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1c[nH]c2cccc(OC)c12 789455088 HYWZUTZZFFETND-UHFFFAOYSA-N 391.515 5.393 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C#Cc1ccc(C(F)(F)F)cc1 790617740 UMIRNBXQKSREDH-AWEZNQCLSA-N 388.414 5.090 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2cnc3ccccc3n2)cc1 792099791 GPISVLPTAGOVJW-HXUWFJFHSA-N 399.494 5.202 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(CC[C@H](O)c2ccccc2)cc1)c1ccccc1 793629817 SEFQBSLHLBQUCR-ZCYQVOJMSA-N 398.506 5.379 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1nc(Br)ccc1F 794968347 BQOLSTPRFSSHGE-HWKANZROSA-N 395.278 5.064 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1cc(F)cc(C#N)c1 796813057 VOZMPYRIQRNAIW-OAHLLOKOSA-N 397.862 5.115 30 20 GKED O=C1/C(=C/c2ccc(-c3c(F)cccc3F)o2)C[C@@H](C(=O)O)c2ccccc21 806559565 CJRGEELSUHLWHK-YBHKSSGVSA-N 380.346 5.063 30 20 GKED N#C[C@H](C(=O)Cc1ccc(Br)c(Cl)c1)c1ccc2ccccc2n1 810521788 ROENSFVRLJTLGC-AWEZNQCLSA-N 399.675 5.070 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)Cc1ccc(Cl)cc1 813212111 XQWUSFZTKRZRFM-INIZCTEOSA-N 394.824 5.589 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)N(C(=O)OC(C)(C)C)C1CC1 830897521 OHSZZLTXMPRQRZ-MRXNPFEDSA-N 386.536 5.265 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H]2CCCc3c2[nH]c2ccc(Cl)cc32)cc1 858297769 HJJYYQNXHAFXBW-SZNDQCEHSA-N 379.891 5.279 30 20 GKED C=CCN1C(=O)c2ccccc2NC12CCC(O)(c1ccc(C(C)C)cc1)CC2 877844674 XRCDPGKFNKLGRJ-UHFFFAOYSA-N 390.527 5.022 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H](C(F)(F)F)C2)cc1 878218038 IQQYXBLMKCJBME-HKUYNNGSSA-N 387.405 5.148 30 20 GKED CC(C)c1ccc(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915088142 ZYIXLHJLPIVRDM-XMMPIXPASA-N 384.479 5.483 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)/C=C\c1cc2cnn(C(C)C)c2nc1Cl 915115075 VRIKSCVPXZPUAS-HJWRWDBZSA-N 378.863 5.351 30 20 GKED O=C(O)c1ccccc1NN=C(CCSc1ccccc1)c1ccc(F)cc1 1776030148 HBWKSUGPOSAWQL-UHFFFAOYSA-N 394.471 5.523 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3c(F)cccc3Cl)c2)c1 1776055743 NBRBGFSYGLZYDF-UHFFFAOYSA-N 398.821 5.202 30 20 GKED CC(C)COc1ccc(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)cc1 1776126373 KODBIEPYOJNSFB-UITAMQMPSA-N 380.465 5.530 30 20 GKED C=C(C)COc1cc(/C=C\c2nc3ccccc3c(C(=O)O)c2C)ccc1OC 1776140117 VQKOGTVJSOSGSA-LUAWRHEFSA-N 389.451 5.375 30 20 GKED C=CCC1(C(=O)O)CCN([C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)CC1 1776157976 FILJAHYIXTZHPI-OAHLLOKOSA-N 388.895 5.107 30 20 GKED CCCCCCCOc1ccc(/C=C\c2ncc(C(=O)O)s2)cc1OCC 1776788193 PTVMTSKOXXXETB-BENRWUELSA-N 389.517 5.760 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)cc1OC 1776814650 JLYMYWIOTWURFW-VURMDHGXSA-N 388.847 5.040 30 20 GKED Cc1cccc2c1C(=O)/C(=C/c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2 1777455782 YYVAFQWABLFWFI-WKDXJHLXSA-N 384.431 5.022 30 20 GKED O=C(O)/C=C/c1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 1777623991 IUMGKPQNTYCXIE-VTBWALSUSA-N 381.642 5.641 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@@H]3CCC5)s2)c1 1777684382 ZFAQNWNTJRLLJE-RXWSAZGZSA-N 386.472 5.813 30 20 GKED C[C@H](SC1=Nc2ccccc2CS1)C(=O)Nc1ccc(C#N)c(Cl)c1 22022539 TZXXDTJYQDAAIV-NSHDSACASA-N 387.917 5.206 30 20 GKED CC(C)c1c(C(=O)N[C@H](C)c2ccc(C#N)cc2)cnn1-c1ccc(Cl)cc1 26130649 UVAYEELVARUTBR-OAHLLOKOSA-N 392.890 5.012 30 20 GKED CCN(CC(=O)Nc1ccccc1-c1ccccc1)[C@H](C)c1ccc(C#N)cc1 42741731 IIUNFJZPWHYICC-LJQANCHMSA-N 383.495 5.247 30 20 GKED C=CCc1cc(CNC(=O)Nc2cccc(Cl)c2Cl)cc(OC)c1OC 65364831 GZRDWEXIIHSKNA-UHFFFAOYSA-N 395.286 5.061 30 20 GKED CCCc1ccc(C(=O)CCC(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc1 65839759 XDRAIOZTRVJHKX-GOSISDBHSA-N 376.500 5.083 30 20 GKED CCOc1ccc(C(=O)CCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66856192 WEIBPIAUBSGMOZ-MRXNPFEDSA-N 396.512 5.081 30 20 GKED CCO[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 67581828 ANVRODYTCKFBBY-ICSRJNTNSA-N 397.906 5.028 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2Cc3ccccc3C2)cc1Cl 106321330 ATLSXIAHGACRTR-OAQYLSRUSA-N 387.870 5.543 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H]1CCc2ccccc21 115208794 RGNZVGKKMYVYHY-GOSISDBHSA-N 383.451 5.113 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1 116553131 NMFWNCJPUZUHNB-UHFFFAOYSA-N 392.842 5.194 30 20 GKED N#Cc1ccccc1CNc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 121162967 UQGGBEMXCPUSQP-UHFFFAOYSA-N 385.345 5.034 30 20 GKED C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N(C)Cc1cccc(C#N)c1 122606975 MSRMWUNOKWRSMY-GFCCVEGCSA-N 387.270 5.108 30 20 GKED N#C[C@@H](C(=O)C1=Cc2ccccc2OC1)c1nc(-c2ccc(Cl)cc2)cs1 132304912 OKVYFKFAYQOGSA-KRWDZBQOSA-N 392.867 5.116 30 20 GKED C[C@@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(Br)cc1 163289306 GYGINZMMNURTDD-CYBMUJFWSA-N 389.318 5.197 30 20 GKED Cc1nc(-c2ccccc2)sc1CNC(=O)Nc1ccc(C(C)(C)C#N)cc1 171252157 DHVNHEREPAEUHH-UHFFFAOYSA-N 390.512 5.241 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)s1 184556721 WCKDTVDCDPQCSC-OAHLLOKOSA-N 377.494 5.357 30 20 GKED COCCc1ccccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 188223525 NUSXDBTZRQKOHV-UHFFFAOYSA-N 388.492 5.151 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](C)Cc1ccsc1 188917811 IDGKFKKJRNAIRY-CVEARBPZSA-N 387.574 5.627 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CNC(=O)C(C)(C)C)cc1 189894982 RYMJTCVEHGNDPU-UHFFFAOYSA-N 392.543 5.453 30 20 GKED C#CCCCC(=O)Nc1c(C)cccc1-c1nc2ccc(F)cc2n1C(C)C 192352154 OBHXOVBPHYCAIB-UHFFFAOYSA-N 377.463 5.474 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3cccc4ccccc34)n2)cc1 193666111 WPRWWKXHOVGIQF-OAQYLSRUSA-N 393.471 5.254 30 20 GKED CC(C)(CCC#N)COC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 195069262 DZCUWPUVOBEQQP-UHFFFAOYSA-N 390.892 5.141 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccccc2SC)cc1 195352315 RMBXAZJACDMZJW-UHFFFAOYSA-N 390.464 5.333 30 20 GKED O/C(=N/[C@H]1CCOC2(CCC2)C1)Nc1ccc(Br)c2ccccc12 329191852 SPFXJXDKGWDZNE-ZDUSSCGKSA-N 389.293 5.030 30 20 GKED CCCN1CCC[C@@H]1C(O)=Nc1ccc(Cl)c(/C(O)=N/C2CCCCC2)c1 329248932 ANORPGMIMCQHTA-LJQANCHMSA-N 391.943 5.440 30 20 GKED OC(=Nc1cccc(/C(O)=N/C2CCN(C3CCCC3)CC2)c1)C1CCCCC1 330082521 QDZKBOBGUUEHHZ-UHFFFAOYSA-N 397.563 5.567 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N[C@@H](CCCC#N)c1ccccc1 431877365 HBARVPHBVVYQBB-SFTDATJTSA-N 379.504 5.271 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2cccc(Cl)c2)C1 433157057 LBEYDUVMHYSGGV-WBVHZDCISA-N 399.947 5.756 30 20 GKED CCCNc1ccc(CNCc2cccc(OCc3cccc(C#N)c3)c2)cc1 434776519 NFCCEQYRYHHDDV-UHFFFAOYSA-N 385.511 5.249 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(OCCc2ccccc2)CC1)c1ccccc1 435093560 FQHDLYRUJVZQPS-DEOSSOPVSA-N 392.543 5.127 30 20 GKED C=CCC[C@H](NC(=O)c1cc(NC(=O)C(C)C)ccc1Cl)c1ccccc1 435289326 NODGSWQUNGWPAQ-FQEVSTJZSA-N 384.907 5.372 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 437272998 ZLTGGWSWDOTMAY-CRAIPNDOSA-N 392.808 5.271 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cnn(-c2cc(C)ccc2C)c1C 437769091 AHTIIXQSEKTJBG-UHFFFAOYSA-N 380.517 5.079 30 20 GKED C[C@@H]1COCC[C@@H]1c1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 442693057 YKOCKMDMRKJNDJ-CJNGLKHVSA-N 395.846 5.194 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H](Cc2ccccc2)C1)c1ccccc1 458795358 CKYHTVBGGRJFCS-JTHBVZDNSA-N 375.516 5.086 30 20 GKED CC(C)(CC#N)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 459236287 QQVSMRYWTFPKEQ-SFHVURJKSA-N 380.879 5.057 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@H]3CCC[C@H]32)c1 460411754 ZVJNAJYBFMYYRK-FOIQADDNSA-N 380.875 5.409 30 20 GKED Cc1c(CSC(C)C)cccc1N[C@@H](C)C(=O)N(CCC#N)c1ccccc1 463926137 OJUXQOHPUXTQCA-IBGZPJMESA-N 395.572 5.384 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 464935877 AOSCOUGLWXBCEU-DLBZAZTESA-N 393.537 5.092 30 20 GKED Cc1c(C(=O)N(CCC(F)(F)F)CC(F)(F)F)sc2cccc(F)c12 468514635 CQJNANLWGVJEAM-UHFFFAOYSA-N 387.320 5.306 30 20 GKED Cn1nc(C(F)F)c2cc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)sc21 471036198 XEERSUWGKQJXQP-UHFFFAOYSA-N 394.472 5.055 30 20 GKED Cc1nc(CC(C)C)oc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 475022337 HTNOQPIZCUVOPT-OAHLLOKOSA-N 399.903 5.449 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1ccccc1OC(F)F 475546441 ISWGPWFDDOIMIK-OAHLLOKOSA-N 388.458 6.023 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1ccc(NC(=O)NC(C)C)cc1)c1ccc(F)c(F)c1 480696853 XYMIGLLCZAWLQL-YCRPNKLZSA-N 387.474 5.463 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)c1ccc(F)c(F)c1 481198976 DLIGVXAJKNBFPT-KRWDZBQOSA-N 384.348 5.509 30 20 GKED Cc1ccc(N[C@H]2CCCCc3cc(C#N)ccc32)cc1NC(=O)C(C)(C)C 481990769 MSHYHOFJNFZOTL-NRFANRHFSA-N 375.516 5.731 30 20 GKED CCOCCC1(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCC1 482920715 QVBHUUXPCZUBJB-UHFFFAOYSA-N 393.487 5.069 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N[C@H](c3ccccc3)[C@H]3CCCO3)c2)cc1 483668878 NZAWEKFOLUECJW-DNQXCXABSA-N 398.462 5.001 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)c1ccccc1 487247873 BDHUVFJRHAKKNZ-AQNXPRMDSA-N 397.316 5.104 30 20 GKED C=CC[C@@H](C(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 488619799 ANGKYPGZGKSGEC-YADARESESA-N 398.506 5.476 30 20 GKED Cc1cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)sc1C 501478924 NXBVDFQXDBBYNN-UHFFFAOYSA-N 376.481 5.262 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc([C@@H]2CCCOC2)cc1 502516845 LKCVGMFJQJMHRE-QGZVFWFLSA-N 375.921 5.124 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)Cc1cn(CCC#N)nc1-c1ccccc1 506327058 RSXKAACNZOCTRZ-SFHVURJKSA-N 384.483 5.403 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2ccc3c(c2)COC3)c1 508389441 BMUQQWOVPNIFDT-UHFFFAOYSA-N 390.826 5.286 30 20 GKED COCCC[C@H](c1ccc(Cl)cc1)c1noc(-c2ccc(CC#N)cc2)n1 508672303 RHORJESTSAHACB-LJQANCHMSA-N 381.863 5.015 30 20 GKED Cc1sc(CN[C@H](C)c2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 512642300 OIIJJDKVZXLUNA-GFCCVEGCSA-N 385.895 5.634 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1csc(-c2ccccc2)n1 515690950 UBDDWOFHSMZZTH-UHFFFAOYSA-N 387.489 5.663 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)cc1 518038435 DIURTLAONKJQFE-NRFANRHFSA-N 376.456 5.364 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 519610368 ISFILHIRWARGKE-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C[C@H](NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 522432405 MQRDXHIURBNCEX-LBPRGKRZSA-N 376.287 5.161 30 20 GKED C=CCOc1ccc(CN[C@H](Cc2ccc(C)cc2)c2ccccn2)cc1Cl 523736620 MTXNQWVHQUVSOR-HSZRJFAPSA-N 392.930 5.682 30 20 GKED CCCC[C@H](COC)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 524079141 HYOPLBGMCIUPLG-QUCCMNQESA-N 399.922 5.322 30 20 GKED Cc1cccc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)c1Cl 534356294 VVUBLAQSAGWNHB-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 542717547 MFGOVNDAKFWQIZ-UHFFFAOYSA-N 391.515 5.460 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1ccc(Br)s1 544281674 YQSAQYWYVBFLIL-CQSZACIVSA-N 390.306 5.060 30 20 GKED CN(C(=O)c1ccc(F)c(C#N)c1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 551610169 OAUMYHIHZFIPHR-MJGOQNOKSA-N 390.380 5.124 30 20 GKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1ccc(C#N)cc1 558872893 QTGJMXBMIIDIRE-CSWVRBLFSA-N 393.962 5.476 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 559861121 WDODBKOEKBWQKR-IERDGZPVSA-N 393.531 6.343 30 20 GKED C=CCC(C)(C)c1noc([C@H]2CCCN2C(=O)c2cc(Cl)cc(Cl)c2)n1 560027312 ZLHQKNUQTFZRSS-OAHLLOKOSA-N 394.302 5.207 30 20 GKED C=CCn1c(C)nnc1SC[C@@H]1CCCO[C@H]1c1ccc(C(F)(F)F)cc1 562440190 XOKNUPXOGHHQRV-RDJZCZTQSA-N 397.466 5.051 30 20 GKED CC(C)(CC#N)CSc1nnc(-c2cccnc2)n1-c1ccc(Cl)cc1 567063304 UYQJEKKYJYHUEY-UHFFFAOYSA-N 383.908 5.015 30 20 GKED Cc1ocnc1-c1noc(-c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 572927025 ACFKMZCTNRJXPN-UHFFFAOYSA-N 378.775 5.017 30 20 GKED N#CCCCCCC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 588156409 DYXROOWSQOWDDC-UHFFFAOYSA-N 381.863 5.203 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3ccc(Cl)cc3)o2)cc1 604068315 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CC(=NNc1ccc(C(F)(F)F)cn1)c1sc(Cc2ccccc2)nc1C 814711508 LVFCHYNCAVYOEU-UHFFFAOYSA-N 390.434 5.292 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C=C1CCN(C(=O)OC(C)(C)C)CC1 816444895 UTYPFEHJKRNLNE-UHFFFAOYSA-N 398.547 5.434 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C 861397022 NAQJAKGUUKMAAQ-UHFFFAOYSA-N 399.491 5.198 30 20 GKED C=C[C@@H](CC(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 862720698 ZIELZJJXUQHZEU-KRWDZBQOSA-N 380.488 5.640 30 20 GKED CN(CCC#N)c1ccc(CN[C@H](CCc2ccccc2)c2ccccc2)cc1 916839753 ZVOICSKFUUEEIZ-AREMUKBSSA-N 383.539 5.500 30 20 GKED CCC(=NNc1c(Cl)cc(Cl)cc1Cl)c1cc(C(=O)O)ccc1F 1776014258 AWOHGYLGOKRBKX-UHFFFAOYSA-N 389.641 5.710 30 20 GKED CCC(CSc1ccc(Cl)cc1)=NNc1ccc(C(=O)O)cc1OC 1776049961 HDQKKBUMEJFEJK-UHFFFAOYSA-N 378.881 5.017 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3cc(F)cc(Cl)c3)cc2)c1 1776091281 DWVPMFIMXPIAHC-UHFFFAOYSA-N 382.822 5.219 30 20 GKED O=C(O)[C@H](Oc1cccc(C=NNc2ccc(F)c(Cl)c2)c1)c1ccccc1 1776097780 BKUCMIDXLUZKGV-HXUWFJFHSA-N 398.821 5.130 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)cc1)C(=O)O 1776126765 WLULMXCRESLLJP-JDZKTDJGSA-N 388.419 5.227 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(F)c1C(F)(F)F 1776355351 BCBPUNMIAVQRNN-SOFGYWHQSA-N 396.336 5.226 30 20 GKED CCCCCCCOc1ccc(CN[C@@H]2CCCc3cc(C(=O)O)ccc32)cc1 1776786282 LGOBOGWRULEXPH-XMMPIXPASA-N 395.543 5.901 30 20 GKED O=C(O)/C=C\c1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 1777624242 YOKBLTWHIQCDJE-POQLCMLLSA-N 380.749 5.353 30 20 GKED O=C(O)c1ccc2scc(/C=C3/Cc4cc(Br)ccc4C3=O)c2c1 1777685470 FASIZTUWYNIJQU-SDQBBNPISA-N 399.265 5.184 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3cccs3)cc2)CCC1 1787275125 IJGWHHZASHJGCW-IBGZPJMESA-N 394.540 5.264 30 20 GKED Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1cccc(C#N)c1 44872255 STFOUOSYKXBDEX-UHFFFAOYSA-N 395.871 5.086 30 20 GKED N#C[C@H](C(=O)CSCc1ccc(Cl)cc1Cl)c1nc2ccccc2o1 66516443 SXVUSGIMNXTASS-CYBMUJFWSA-N 391.279 5.244 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 66953889 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C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(OCC(F)(F)F)c1 189890276 YNARXLKFCLQFIB-UHFFFAOYSA-N 391.433 5.661 30 20 GKED C[C@@H](S[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1C(F)(F)F 190876346 AEUGIPRHMXFSBM-CHWSQXEVSA-N 378.419 5.398 30 20 GKED CC(C)CCOC1CCN(C(=O)Nc2cccc(C#Cc3ccccc3)c2)CC1 195713406 VXOSBSFKICHQPR-UHFFFAOYSA-N 390.527 5.145 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3ccccc3OC(C)C)o2)cc1C 255846025 PMIGGHVYGHGIIV-QGZVFWFLSA-N 379.460 5.252 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)cc1 255906737 YGNQTFSTNQNTKI-WMHRWZGDSA-N 387.508 5.392 30 20 GKED CN(Cc1ccc(F)cc1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 255946444 GTLXGUAEZGAPSA-UHFFFAOYSA-N 390.483 5.262 30 20 GKED CC(F)(F)c1cccc(N=C(O)N[C@H]2CCCc3cn(C4CCCC4)nc32)c1 328608996 MIQHHCIJEFWRCC-SFHVURJKSA-N 388.462 5.323 30 20 GKED COc1ccc(C2(/N=C(/O)CC34C[C@H]5C[C@@H](CC(O)(C5)C3)C4)CCCC2)cc1 329466902 WFWROOVUGSLRQT-YUOVDFJASA-N 383.532 5.142 30 20 GKED COc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c(Cl)c1 424284818 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LOACYHANRCRNBB-UHFFFAOYSA-N 383.407 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(CN2CCCC2)c1 475572812 ZOBMCRJUCJLPOD-UHFFFAOYSA-N 391.559 5.456 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1c(F)cc(F)cc1-c1ccccc1 483640616 RXWYIEKENQHSPO-UHFFFAOYSA-N 377.394 5.167 30 20 GKED CC(C)(C)c1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1[N+](=O)[O-] 487264505 GHIMEZKGTUZOCM-IBGZPJMESA-N 379.460 5.057 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)c1ccc(F)cc1F 489662354 SRGROJRWKSFNPS-AWEZNQCLSA-N 387.455 5.175 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(-c2noc(C(F)(F)F)n2)c1)c1ccccc1 490250956 PGCHGNKJAMNGGI-MRXNPFEDSA-N 387.361 5.054 30 20 GKED Cc1c(C(=O)Nc2cnn(CC(C)C)c2C(F)F)sc2ccc(C#N)cc12 492169407 QHHGTFITMGOMNV-UHFFFAOYSA-N 388.443 5.124 30 20 GKED C=C(C)[C@H](NC(=O)[C@@H](C)Cc1cncc2ccccc12)c1ccc(F)c(F)c1 505965455 URMUXUGKJRWXSE-NYHFZMIOSA-N 380.438 5.125 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1 508437946 SSGLLXCXAUOJBR-UHFFFAOYSA-N 383.407 5.093 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc(F)cc2)cc1 513955523 FJMZVODBVIZNMI-UHFFFAOYSA-N 377.394 5.071 30 20 GKED C=CCC[C@H](NC(=O)C[C@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 514060714 ROLMTQFKFIQMIQ-UGSOOPFHSA-N 394.437 5.628 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)CSCc1ccc(C#N)cc1 515281397 IRVPMQGKIKKVOG-CYBMUJFWSA-N 393.339 5.318 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(C(F)F)c3)cc2)cc1 518378002 LTFNMGIGBMFMKT-UHFFFAOYSA-N 378.378 5.735 30 20 GKED CC(C)Oc1ccc([C@@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520280534 GUFRIWZGGVGXIA-DLBZAZTESA-N 397.544 5.751 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 523818815 UWWCAGAPPQXVHL-SFHVURJKSA-N 397.478 5.251 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@@]1(C#N)CCC[C@@H](C)C1 524197687 VDQHTTHAEQVSPL-QGHHPUGFSA-N 379.938 5.036 30 20 GKED Cc1cnc([C@@H](NCc2cccc(OCc3ccccc3C#N)c2)C2CC2)s1 525196050 TZZGSUXOHFGIBV-QFIPXVFZSA-N 389.524 5.143 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 531430910 QIYGMBDPTOYRJK-UHFFFAOYSA-N 398.768 5.837 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccc(C2(C#N)CC2)cc1 540784343 RYUICQFJISQSLN-SFHVURJKSA-N 386.520 5.707 30 20 GKED C[C@H](NCc1nccn1Cc1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 541995267 MBHHLQAMOZNRDX-FQEVSTJZSA-N 392.506 5.321 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc2cc(C)ccc2n1C 549289273 YCGZKJPKAIBNLE-UHFFFAOYSA-N 376.504 5.055 30 20 GKED COc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1Br 551211548 JGYXOHIIEWIHGE-KXBFYZLASA-N 387.321 5.543 30 20 GKED Cc1cc(C#N)cnc1C(=O)N(Cc1ccc(-c2cccc(F)c2)s1)C(C)C 567412040 SEWFEXCUXGMAJT-UHFFFAOYSA-N 393.487 5.180 30 20 GKED O=C(N[C@@H](c1ccccc1)C(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 574495502 QRCKPPBJOFMXOS-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(CCC#N)CC2)cc1 575866526 WSKJAFGMWACVDA-GOSISDBHSA-N 393.556 6.088 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N(C)CCOCc1ccc(C#N)cc1 580738662 VYVXOTODYWCTEX-INIZCTEOSA-N 395.890 5.076 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 603657694 DCPCVFYKEGVTBK-UHFFFAOYSA-N 376.287 5.458 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)C(C)(C)c1cccs1 604227202 BJHBKKDDTOXSHL-UHFFFAOYSA-N 396.325 5.142 30 20 GKED CN(CC(C)(C)C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079621 IEPCBDXHHFPNHG-UHFFFAOYSA-N 385.895 5.300 30 20 GKED C[C@@H](CC#N)NC(=O)[C@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 609306285 JRBVYJOFOHIMTJ-YVEFUNNKSA-N 379.312 5.245 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Oc2ccc(F)cc2)cc1 609375882 GUXGHZGUDONURX-UHFFFAOYSA-N 392.455 5.876 30 20 GKED CN(Cc1ccc(Cl)cc1Cl)C(=O)CCCCOc1cccc(C#N)c1 609496908 PSIHOGOXOWHSGX-UHFFFAOYSA-N 391.298 5.073 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 609825899 ZXQOTZBYZYSONU-KRWDZBQOSA-N 380.557 6.238 30 20 GKED N#Cc1cc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)ccc1Cl 611182498 GMDHHWWDWZJTOY-UHFFFAOYSA-N 389.814 5.525 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(COCc2ccccc2)cc1 611390603 KLCLDVANDCYPGC-SANMLTNESA-N 382.507 5.442 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc2cc(C(F)(F)F)ccc21 647378345 PPJVOHFXMLFRSY-CYBMUJFWSA-N 389.402 5.021 30 20 GKED C[C@H]1CCCc2ncc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)n21 651265202 JDLGKNYOBIWGMP-SWLSCSKDSA-N 396.903 5.047 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 679541670 WELDXYKDKCDFRE-KRWDZBQOSA-N 387.439 5.296 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)Cc2ccc(OCCC)c(OC)c2)c1 726441935 PFJXHVLOQPNCRS-UHFFFAOYSA-N 396.556 5.074 30 20 GKED N#Cc1ccc(NC(=S)Nc2cccc(COCc3ccco3)c2)cc1Cl 726467910 MYLGXZBYNOOIKI-UHFFFAOYSA-N 397.887 5.330 30 20 GKED O=C1CCc2cc(C(=O)/C=C/c3ccc(Cl)c(C(F)(F)F)c3)ccc2N1 727266617 BABYYVAOSFYDAH-FARCUNLSSA-N 379.765 5.140 30 20 GKED C#Cc1cccc(N(CC)Cc2nc(O)c3cc(-c4ccccc4)sc3n2)c1 728926771 SYJJXWSJTHOHGB-UHFFFAOYSA-N 385.492 5.072 30 20 GKED CC[C@@H](C)n1c(-c2ccccc2)nn(CN(CCC#N)CC(C)(C)C)c1=S 729468203 PICJVILOSUCFDF-QGZVFWFLSA-N 385.581 5.271 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Nc2ccc(F)cc2)c2ccncc12 732104294 PPEMHLAKODWXBD-UHFFFAOYSA-N 388.427 5.303 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ccc(Br)s1 735317897 HJUKYKOKXJWJKV-UHFFFAOYSA-N 388.739 5.500 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccnn3C3CCCCC3)c2)cc1 737833367 ZRMBUKWETDDOFU-UHFFFAOYSA-N 385.471 5.256 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCCCOc2ccc(C#N)cc2)cc1 742264079 OXMOFYKFVFBVMZ-KRWDZBQOSA-N 395.503 5.025 30 20 GKED C[C@H](C#N)Oc1ccc(C=NNc2nc3cc(C(F)(F)F)ccc3s2)cc1 743444421 MRVWFUOYQVCSKI-LLVKDONJSA-N 390.390 5.052 30 20 GKED CC(=NOCc1csc(C2CCCC2)n1)c1ccc(NC(=O)C2CC2)cc1 746353071 NXMVXJOMCHFYGX-UHFFFAOYSA-N 383.517 5.090 30 20 GKED COc1cc(/C=C\C(=O)c2c(C)[nH]c3ccccc23)ccc1OCC(F)(F)F 750905588 OBWFWUHSXWLCHB-CLFYSBASSA-N 389.373 5.322 30 20 GKED C=CC[C@@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1ccncc1 756581445 CULCBKDSKAXNHO-BDJLRTHQSA-N 381.701 5.171 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)N1CCC[C@@H]1c1nc2ccccc2n1C(C)C 758296183 KPPMNKQHKXOCKZ-RTWAWAEBSA-N 398.551 5.252 30 20 GKED N#CCOc1cccc(CC(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c1 760270796 QAGGVZAMTSTQQS-UHFFFAOYSA-N 399.475 5.047 30 20 GKED C=CC[C@@H](N[C@H]1CCSc2ccc(Br)cc21)c1ccncc1 766018191 GFJNLWUPAANGIH-SJORKVTESA-N 375.335 5.288 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)Nc1ccccc1O[C@H](C)C#N 766596826 MMFXHYIDGMAUFZ-RSKUSDAESA-N 375.255 5.326 30 20 GKED N#CC1(c2ccccc2)CCC(NC[C@@H](O)c2ccc(Cl)cc2Cl)CC1 768403065 NAICVQVZOBYIMK-TWMPVWRBSA-N 389.326 5.021 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3cc(C#N)cc([N+](=O)[O-])c3Cl)s2)o1 781743440 JVHCMMJUAYXHRX-UHFFFAOYSA-N 387.804 5.002 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c[nH]c2ccccc12 782548043 ZOEFURITNHNTQC-MBSDFSHPSA-N 393.490 5.956 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCC#N)c1ccc(-c2cccc(C#N)c2)cc1 782828736 HYKHYTZWWIPVQU-QGZVFWFLSA-N 397.503 5.332 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2ccsc2)cc1 790315313 WBSRSOUWVUDNKW-UHFFFAOYSA-N 381.482 5.230 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(N3CCCCCC3)cc2)c(Cl)c1 792704957 XDQUWDNJXKFEPI-UHFFFAOYSA-N 388.298 5.498 30 20 GKED C=CCc1cc(CN[C@H](CC)c2cccc(Cl)c2O)cc(OC)c1OC 806146114 RLUNHAUEMDZECG-GOSISDBHSA-N 375.896 5.032 30 20 GKED CC(C)CN(C(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccc(C#N)cc1 812884434 PRKOMNVAXGYCQW-UHFFFAOYSA-N 392.242 5.076 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](Oc2ccc(Cl)cc2)C(C)C)n1 813072955 QHDCUQRWPUBXIT-YJBOKZPZSA-N 376.909 5.200 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CCCCC1)c1cc(C(F)(F)F)ccn1 813218168 SOQPUVLWOGZJRE-QGZVFWFLSA-N 390.380 5.318 30 20 GKED N#CCCCn1cc(C(=O)OC[C@@H]2CC[C@H](c3ccccc3)O2)c2ccccc21 814056949 NLURKSSIXRERJH-WMZHIEFXSA-N 388.467 5.022 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(NC(=O)OC(C)(C)C)c1C)c1ccccc1 862718780 PFUGIZDNKICCCY-SFHVURJKSA-N 380.488 5.640 30 20 GKED O=C(c1ccc(C2SCCS2)cc1)N(O)Cc1cccc2ccccc12 901367393 CTFSHURNKOSREC-UHFFFAOYSA-N 381.522 5.350 30 20 GKED CCn1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2ccccc21 915199431 BEBGVMSFVFHBLL-JOCHJYFZSA-N 379.463 5.569 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915352309 GWTKNCTWXHQSRH-DQEYMECFSA-N 395.506 6.020 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2ccc(NC(C)=O)cc2)cc1OCCC 916127527 CZJPAYXDJKBCOK-WQLSENKSSA-N 381.472 5.119 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc(-c2ccc(F)cc2)s1 916882613 HDTRXQORDGSKQK-INIZCTEOSA-N 398.846 5.169 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCCOc2ccccc2C)cc1 916949583 PHISUWXYMLFYGE-DYESRHJHSA-N 392.499 5.015 30 20 GKED Cc1cc(Cl)ccc1NN=Cc1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1776104316 AGJYFANUWVNISK-NRFANRHFSA-N 394.858 5.299 30 20 GKED O=C(/C=C/c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1cc(F)ccc1F 1776113738 SONCFFDQEGVNAJ-RUCTVCJSSA-N 394.373 5.066 30 20 GKED CC(C)(C)[C@@H]1C/C(=C/c2cccc(C#N)n2)c2nc3ccccc3c(C(=O)O)c2C1 1776121620 PGNQQKFCECWTLV-RTYFKUQISA-N 397.478 5.349 30 20 GKED CCCCCCCOc1cccc(CNC[C@@]2(CC(=O)O)CC[C@H](C)C2)c1 1776788727 UEAADUKVDHOQSX-CVDCTZTESA-N 375.553 5.407 30 20 GKED C#Cc1cccc(NC(=O)c2cc3ccccc3cc2OCc2c(C)noc2C)c1 23010293 BUTVKWFLXFYQOU-UHFFFAOYSA-N 396.446 5.257 30 20 GKED C[C@@H](N[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1ccc(C#N)cc1 114747471 GVKCSGKXMBOAIO-CHWSQXEVSA-N 386.377 5.039 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CC1)c1nc(-c2c(F)cccc2F)cs1 115910003 UHAGYBSWJFTUJM-CQSZACIVSA-N 398.409 5.135 30 20 GKED Cc1ccc(-c2nnco2)cc1NCc1cccc(OCc2ccccc2C#N)c1 119840170 WJGXKNZHTQHJJJ-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](c2cccc(F)c2)c2nccn2C)cc1 128558471 JNQRSSQPGWLEQQ-KKSFZXQISA-N 399.897 5.131 30 20 GKED N#CCC[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccccc1 130598526 VHDLYDDCDPCAHH-RUZDIDTESA-N 381.479 5.272 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccccc1 158178379 DXTPSKYMHWOIEN-OAHLLOKOSA-N 394.858 5.484 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1SCc1cccs1)c1ccc(Cl)cc1 159387250 WBAKHHVUHQFZFL-GOSISDBHSA-N 398.940 5.688 30 20 GKED Cc1cc(C(=O)Nc2ccc(F)cc2OCC#N)c(C)n1[C@H](C)c1ccccc1 159434081 SNZLYXXAXBDULZ-MRXNPFEDSA-N 391.446 5.008 30 20 GKED C=CCCC(=O)Nc1ccc(-c2ccc(NC(=O)CCC=C)c(C)c2)cc1C 174103005 CXYGUTHHYDKZQP-UHFFFAOYSA-N 376.500 5.780 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c12 177755368 BVNJSUMGTSAMTI-AWEZNQCLSA-N 394.500 5.123 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(OC(C)C)cc2)ccc1OC 180811839 OPDZETWYPKYWGE-PXNSSMCTSA-N 382.504 5.014 30 20 GKED Cc1c([C@@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)oc2ccccc12 183260618 CMBPPBJDYIADRI-NRFANRHFSA-N 386.455 5.150 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc3ccccc3c2O)ccc1OC 186029073 IWACXCPRPCBKNO-APWZRJJASA-N 390.483 5.086 30 20 GKED COc1ccc2c(c1)CN(C(=O)Nc1ccc(CC#N)cc1)[C@@H](c1ccccc1)C2 186536404 WCGZAFIEPCDEND-XMMPIXPASA-N 397.478 5.093 30 20 GKED CCC(C)(C)N/C(S)=C(\C(=O)c1cc(C)c(C)c(C)c1C)[n+]1ccc(C)cc1 186970392 PGDRHEHCXGOYAS-UHFFFAOYSA-O 397.608 5.233 30 20 GKED CCCOc1c(Cl)cc(C=NO[C@H](C)c2nc(C(C)C)no2)cc1OCC 255624108 WQNPUANUZPNYQS-CYBMUJFWSA-N 395.887 5.146 30 20 GKED CC(O)=Nc1ccc(F)c(N/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c1 329364298 FXRDHLVLZXNFCK-SFHVURJKSA-N 399.470 5.149 30 20 GKED CC(C)(C)Cc1nc2cc(N=C(O)N3CCC(OC4CCCC4)CC3)ccc2o1 329579242 UERWBTVKWXILTO-UHFFFAOYSA-N 399.535 5.386 30 20 GKED O=C(Nc1ccc(F)c(N=C(O)C2CCCCC2)c1)c1ccnn1C1CCCC1 330074932 LMLRIORFWUFEPF-UHFFFAOYSA-N 398.482 5.558 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)Nc4ccc(C#N)cc4Cl)CC3)c[nH]c2c1 426137979 IURAXWJUXLSTAK-UHFFFAOYSA-N 390.874 5.323 30 20 GKED C=CCC[C@@H](C(=O)N[C@H](C)c1nc(-c2ccncc2)cs1)c1ccccc1 426990015 FTYJPDLCQSHUCI-VQIMIIECSA-N 377.513 5.132 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432956584 UQCDXCWVCXUASR-JOCHJYFZSA-N 395.572 6.193 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(CC(F)(F)F)c1)c1ccccc1 432965483 GRBSNZCQYJUAJI-GOSISDBHSA-N 375.394 5.348 30 20 GKED C[C@@H](NC(=O)CN[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 433023262 OGHMBBWUPSXMNX-NTKDMRAZSA-N 385.511 5.042 30 20 GKED CC[C@H](c1ccccc1)[C@H]1CCCN1Cc1cn(CCC#N)nc1-c1ccncc1 435122612 BKQXVHBLYKPEHQ-DNQXCXABSA-N 399.542 5.017 30 20 GKED C=CCN1CCC(NC(=O)Nc2ccc([C@@H](C)Sc3ccccc3)cc2)CC1 438873948 LSEGROOSMNVFRQ-GOSISDBHSA-N 395.572 5.312 30 20 GKED CCCCc1ccc([C@@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)cc1 441183221 WISXBEBFKZSGTP-QHCPKHFHSA-N 388.515 5.438 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccsc2Cl)cc1 446463358 MBEPAWHTZKUJCS-UHFFFAOYSA-N 399.878 5.647 30 20 GKED CC[C@H](N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccc(C#N)cc1 447581260 SPRAQKBCPLDKBQ-VFNWGFHPSA-N 391.540 5.801 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F 451690675 RDQFYWFTURTUFJ-SECBINFHSA-N 375.284 5.074 30 20 GKED C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2ccc(CC#N)cc2Cl)C1 452646341 QCTUFYHWXMTRTK-WMZOPIPTSA-N 376.928 5.500 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F 453080500 FGEPVEAYJSELDN-LBPRGKRZSA-N 395.406 5.620 30 20 GKED N#CC[C@@H](Cc1nc(CSCc2ccc(Cl)cc2)no1)c1ccccc1 453261196 YTIBLBFYCQDTLQ-KRWDZBQOSA-N 383.904 5.396 30 20 GKED COCC[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 453331610 BXVPXILWRONWSF-YJYMSZOUSA-N 380.385 5.145 30 20 GKED CC1CCC(OC2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)CC2)CC1 458795835 DAWQXRXAOZGZLD-POOLCLQXSA-N 397.563 5.191 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(F)cc1F)C1CCCC1)c1ccc(C#N)cc1 465655801 GBBNYYDUBLHFKH-OAHLLOKOSA-N 383.442 5.052 30 20 GKED CCN(c1ccccc1)c1ccc(CNC(=O)N(C)Cc2cccc(C#N)c2)cc1 466258395 STIMUVJACGIQRF-UHFFFAOYSA-N 398.510 5.058 30 20 GKED C=CCCCC(=O)N[C@H](C)c1sc(-c2ccccc2Br)nc1C 466914486 ULDSCZXWGGNSEF-GFCCVEGCSA-N 393.350 5.415 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(Cl)ccc2OCC2CCC2)c1 467051878 SYRHCBRRUZJAJB-UHFFFAOYSA-N 386.904 5.387 30 20 GKED CC[C@H](Cc1ccc(C)cc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469078297 PNGRCQRIRSSJCH-OAQYLSRUSA-N 375.516 5.011 30 20 GKED CC(C)c1nc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 469795523 FDPYDOFUUKZGCY-IRXDYDNUSA-N 375.541 6.217 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 470048077 VJAGJXKRFSZXTP-LJQANCHMSA-N 387.405 5.014 30 20 GKED CC(C)c1ccc(CCNc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 470155018 PTUQROURGUKCOJ-UHFFFAOYSA-N 375.516 5.048 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1coc2cc(F)ccc12 474782882 ICDWSEUOARNMQG-UHFFFAOYSA-N 387.370 5.192 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1ccccc1 475386893 DQYMPMBEOAUFCM-QFIPXVFZSA-N 386.470 5.442 30 20 GKED Cc1ccc(CCN(Cc2ccco2)C(=O)C[C@@H](CC#N)c2ccccc2)cc1 476188613 JFDMKDLWGXTGBP-HSZRJFAPSA-N 386.495 5.247 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)CC#N)cc2Cl)c(Br)c1 476227728 POLCWIIINOFNIN-UHFFFAOYSA-N 379.641 5.055 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F 477590758 SVHGRZQBFUQKGQ-WFASDCNBSA-N 387.471 5.427 30 20 GKED COc1ccc(NC(=O)c2ccc(NCc3ccc(Cl)cc3C#N)cc2)cc1 478400091 SJPLSJSEQGSTRW-UHFFFAOYSA-N 391.858 5.085 30 20 GKED C[C@@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)c1ccc(C#N)cc1F 480752939 ZSZRLUWHQKOBOZ-WYRIXSBYSA-N 391.259 5.401 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1)c1ccccc1 483216016 JWHHPBRVBHUIRA-MHECFPHRSA-N 392.458 5.865 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)CC2)cc1 503897024 GHVZBAPNZPJHSB-VQTJNVASSA-N 397.305 5.284 30 20 GKED C=C(C)[C@@H](NC(=O)[C@H](C)Cc1cncc2ccccc12)c1ccc(F)c(F)c1 505965454 URMUXUGKJRWXSE-IVZQSRNASA-N 380.438 5.125 30 20 GKED Cc1cccc(Cc2sc(NC(=O)c3cc(C#N)ccc3Cl)nc2C)c1 507159862 JIJLRMIBUHKFBZ-UHFFFAOYSA-N 381.888 5.128 30 20 GKED COc1ccc(COCc2cccc(N[C@@H](C)c3ccc(C#N)cc3F)c2)cc1 512283547 QMKZNVMTDKLEDF-KRWDZBQOSA-N 390.458 5.596 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCCOc2ccc(F)cc21 513161860 VCNAAFVYNJYLCR-JOCHJYFZSA-N 386.426 5.008 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1cccc(C(F)(F)F)c1 517605421 CMQVNAHUQJDGQW-NJYVYQBISA-N 394.396 5.343 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)Nc1cccc(C#N)c1 518016791 SJLLLZVWXDXBCV-ZDUSSCGKSA-N 396.903 5.526 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2SCCC#N)cc1OCC 521715784 ACAFCASYZSTOMP-UHFFFAOYSA-N 384.501 5.132 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)cc2)c2cc(F)ccc2F)c1 525688656 WLZCDFGIGOQSRP-QFIPXVFZSA-N 380.463 5.438 30 20 GKED N#CC1(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)c(Cl)c2)CC1 527246304 FRGPRUKXTAOMMN-UHFFFAOYSA-N 381.646 5.225 30 20 GKED C[C@@H](C(=O)Nc1cc(C(C)(C)C)sc1C#N)c1ccc(Br)s1 538071680 CNDCUYOJHNQYBC-SECBINFHSA-N 397.363 5.483 30 20 GKED Cc1cccc(C)c1CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 539631586 IBLFXYXGPIWZTB-UHFFFAOYSA-N 384.479 5.130 30 20 GKED C[C@@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)c1cc(F)c(Cl)cc1Cl 540692998 VKELKZRQUTUAJU-LLVKDONJSA-N 377.246 5.179 30 20 GKED N#CCc1ccc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)cc1 542215952 RBTDHVQSVQYPTK-UHFFFAOYSA-N 385.496 5.120 30 20 GKED COc1cc(C#N)ccc1NC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 547417413 YFCCDXUUHLHYQC-KRWDZBQOSA-N 390.270 5.243 30 20 GKED C=C(C)Cn1c(C(C)C)nnc1N1CCC(c2nc3cc(Cl)ccc3o2)CC1 549638215 NWTHSYJGAAXHSF-UHFFFAOYSA-N 399.926 5.156 30 20 GKED C[C@@H](NCc1cc(F)c(F)cc1Br)c1ccc(C#N)cc1Cl 552338630 KKTBRHUZBMIWBB-SECBINFHSA-N 385.639 5.103 30 20 GKED Cc1coc(C)c1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 556568778 UGEFNWLKXLLHFU-CYBMUJFWSA-N 391.279 5.817 30 20 GKED CC(C)NC(=O)Nc1ccc([C@H](C)N[C@@H](CCCC#N)c2ccccc2)cc1 559867800 VMGNENGVDNXDSR-AVRDEDQJSA-N 378.520 5.302 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cccc(OCc2ccccc2)c1 564458079 LSYIOSQOKBIBDY-QFQXNSOFSA-N 384.523 6.351 30 20 GKED N#CCc1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c(Cl)c1 576711060 SUBDPURQGMRSPJ-OPYAIIAOSA-N 379.891 5.206 30 20 GKED N#Cc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)c([N+](=O)[O-])c1 580080451 DMJYSCGVYVSOLP-GOSISDBHSA-N 376.243 5.014 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 588899522 MHOFQXKRORELHJ-UHFFFAOYSA-N 376.378 5.910 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3cc[nH]c3c2)cc1Cl 603962382 SPFHZSMIONFPSY-FQEVSTJZSA-N 385.854 5.729 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCOc1ccc(F)cc1 603968910 KVLDNBMGEFBRRC-UHFFFAOYSA-N 380.444 5.224 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)C(=O)Nc1ccc(C(C)(C)C)cc1 604044354 MEUHHIDRKFJQQQ-KRWDZBQOSA-N 379.504 5.106 30 20 GKED CC(C)c1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609064268 YWNNMQXBCVONSZ-UHFFFAOYSA-N 376.481 5.574 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1 609160898 FXICBEJEDFIOSS-UHFFFAOYSA-N 397.434 5.218 30 20 GKED CN(C)c1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 609378582 WTKKFJLNMGPZEO-UHFFFAOYSA-N 393.434 5.029 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(OCc2ccccc2)cc1 609378769 OWJPMCARLBRNBB-UHFFFAOYSA-N 388.492 5.524 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(-c2ccccc2)o1 609398852 YRJTYUGYVASLQV-MRXNPFEDSA-N 391.496 5.520 30 20 GKED CCc1cccc2c(CC(=O)Nc3sc(-c4ccccc4)cc3C#N)c[nH]c12 609453111 AXQNIHJFVGURQC-UHFFFAOYSA-N 385.492 5.512 30 20 GKED COc1ccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1Cl 609642998 SXFXCESITCDAMZ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(-c3ccco3)cc2F)c(Cl)c1 618886422 ZSCZMMNWRDWEGH-UHFFFAOYSA-N 375.186 5.516 30 20 GKED O=C(N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)C1(C(F)(F)F)CCCCC1 667004166 KXPXWTVAYILUNU-NXEZZACHSA-N 399.297 5.089 30 20 GKED CC(C)N(C(=S)N[C@H](C)c1ccc(Cl)cc1Cl)c1cccc(C#N)c1 726491233 XANRCIHCOYCGEO-CYBMUJFWSA-N 392.355 5.716 30 20 GKED O=C1/C(=C/c2csc(-c3ccc4c(c3)OCO4)n2)Cc2c(Cl)cccc21 728439714 DXFGVQATVGHSBB-WUXMJOGZSA-N 381.840 5.015 30 20 GKED COc1ccc(CNN=Cc2cn(C(C)(C)C)nc2-c2ccccc2Cl)cc1 731152120 WXROGHOFKPDREF-UHFFFAOYSA-N 396.922 5.091 30 20 GKED C=CC[C@@H](NC(=O)N1CC=C(c2cccc3ccccc23)CC1)c1ccncc1 734680187 NRDCFHPFGLNDRH-XMMPIXPASA-N 383.495 5.351 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C(F)(F)F)cc2)c(SC)cc1OC 741165227 IECJJFUBEAMYFU-TWGQIWQCSA-N 382.403 5.341 30 20 GKED Cc1nc(C#N)c(NN=C(CCSc2ccc(F)cc2)c2ccc(F)cc2)o1 741461136 FEGNESXZUDSZFJ-UHFFFAOYSA-N 398.438 5.132 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2c(Cl)nc3sccn23)cc1 741470792 WAXTVQPWLWVEOZ-ZHACJKMWSA-N 394.883 5.621 30 20 GKED COCc1nc(CON=C(C)c2ccc(-c3ccc(F)cc3)s2)cs1 742354880 QEFMNFDSJWOALY-UHFFFAOYSA-N 376.478 5.098 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 742537417 JRTRVKMOAOXTJP-BEFAXECRSA-N 391.496 5.148 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2cccc(CC(F)(F)F)c2)cc1OC 742826443 HOEQGIZVBMWELK-CSKARUKUSA-N 391.389 5.017 30 20 GKED CN(CCc1cccs1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093190 OGUAYVOPXKVWLK-NRFANRHFSA-N 375.497 5.110 30 20 GKED O=C1CCc2cc(N=Cc3ccccc3O)ccc2N1Cc1ccc(Cl)cc1 743538581 NFOLZULJGAIFLO-UHFFFAOYSA-N 390.870 5.276 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1cccc(C#N)c1 743709014 PYHWANIVHCEHMW-IFXJQAMLSA-N 387.405 5.185 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3cccc(F)c3F)n2)cc1 744034687 KDLYRVKBYINKOM-IXDOHACOSA-N 394.446 5.377 30 20 GKED C#Cc1cccc(NC(=S)Nc2cc(Br)cc(OC(C)C)c2)c1 751914109 IQGNICKFZNZHDH-UHFFFAOYSA-N 389.318 5.027 30 20 GKED C=CCC[C@H](NCc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O 756378385 FIXNBTQKOYSDGJ-DEOSSOPVSA-N 386.495 5.665 30 20 GKED C=CCc1cc(OCC)cc(CN(C)[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c1O 758257819 HLPBOCWNFQOOFB-FYYLOGMGSA-N 399.506 5.011 30 20 GKED C=CCC(CC=C)C(=O)O[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 761200538 VSWOHPHKLIAFEE-LLVKDONJSA-N 381.259 5.416 30 20 GKED CCOc1ccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)cc1[N+](=O)[O-] 765615513 GVASIYDNTILZJL-KTKRTIGZSA-N 380.425 5.013 30 20 GKED N#CCSc1ccccc1C(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21 779302296 UPVBXWFFZYNVRA-JOCHJYFZSA-N 384.504 5.387 30 20 GKED Cc1cc(/C=C\C(=O)c2ccnc(Cl)c2)cc(C)c1OCc1ccccn1 779460618 RTIJAZOWHKUGSW-SREVYHEPSA-N 378.859 5.222 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 782773176 LYGZWBVHHILHDT-GOSISDBHSA-N 395.528 5.480 30 20 GKED C=CCC[C@H](C(=O)O[C@H](C)c1nnc(-c2ccc(F)cc2)o1)c1ccccc1 784824606 JLJNQDDVVKEHOR-BEFAXECRSA-N 380.419 5.230 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cc(C(F)(F)F)cnc3Cl)c2C#N)C1 790625949 MAACUGPWLZMFCZ-QMMMGPOBSA-N 399.825 5.064 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2C(F)(F)F)CC2CC2)c1 795095064 ABZAFOFUENPMEF-UHFFFAOYSA-N 388.458 5.296 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)(F)F)s2)cc1 796791047 BOCSZZSHWCZYRV-FZMZJTMJSA-N 394.418 5.242 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2ccc(SC(F)F)c(OC)c2)cc1 797005928 FCQGZCYPWZZBDX-AWEZNQCLSA-N 379.472 5.426 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/C(=O)c3ccccc3[C@@H]2C)cs1 809157174 QWNQHFCLGBCGLI-NGZBARDMSA-N 388.492 5.520 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3cccc(Cl)c23)cc1 814305540 JYFQQJGLLOGWFG-HXUWFJFHSA-N 399.881 5.658 30 20 GKED CC(=NNc1ncnc(Cl)c1C(C)C)c1sc(-c2ccccc2)nc1C 814922816 YFTNWLIMXUKZBX-UHFFFAOYSA-N 385.924 5.521 30 20 GKED CN(C)c1ccc(C2(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)cc1 815010082 HMAWWGXGWDRAON-DEOSSOPVSA-N 395.506 5.078 30 20 GKED C[C@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)c1ccc(C#N)o1 816768376 ULBCTPSCZHPMMD-CQSZACIVSA-N 384.888 5.140 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)cc1 915085836 OVWYDGLVFFWCJZ-KRWDZBQOSA-N 382.250 5.296 30 20 GKED N#C[C@H](C(=O)[C@H]1Cc2ccccc2S1)c1nc(-c2ccc(Cl)cc2)cs1 915102339 XKCSZAVXODVXJR-CRAIPNDOSA-N 396.924 5.357 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3cn(CCC#N)nc3-c3ccccc3)oc12 916130621 YYNSXMPNTYMHCY-QXMHVHEDSA-N 397.434 5.115 30 20 GKED N#C[C@H](C(=O)CCC1CCCCC1)C(=O)Nc1ccccc1Oc1ccccc1 916904763 INUDSONJAINGNW-HXUWFJFHSA-N 390.483 5.487 30 20 GKED C[C@H](Cc1ccccc1F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 919773623 VDALMDLUGJRQLF-VGOFRKELSA-N 387.458 5.234 30 20 GKED CCCCCC/C(C=NNc1ccc(Cl)c(C(=O)O)c1)=C/c1ccccc1 1776033337 JNWGFQWWTZANCL-NKKMKODYSA-N 384.907 6.490 30 20 GKED CC[C@@H](NN=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12)C(=O)O 1776065770 WAPVBBNTRPKGFW-JOCHJYFZSA-N 397.478 5.084 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3cccc(F)c3Cl)cc2)c1 1776093574 ZCCRJTCFYIBUEJ-UHFFFAOYSA-N 382.822 5.219 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2csc(C(=O)O)c2)cc1)c1ccccc1 1776469523 VGJDGBAQDGUBOE-CUXKMMBLSA-N 378.449 5.482 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(C(F)(F)C(F)(F)F)c1 1776784777 URFBYPRMDAMINR-MRXNPFEDSA-N 395.412 5.634 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cnc(-c2ccc(C)c(C)c2)s1 1776785699 SUFOICVSDKXBTG-LJQANCHMSA-N 388.577 5.720 30 20 GKED CCCCCCCOc1ccc(CN[C@@](C)(COc2ccccc2)C(=O)O)cc1 1776787835 ACUQJGZWNIPTEB-DEOSSOPVSA-N 399.531 5.048 30 20 GKED Cc1cccc2c1C(=O)/C(=C\c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2 1777455781 YYVAFQWABLFWFI-VGTKIRILSA-N 384.431 5.022 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4ccc(Cl)cc4C3=O)s2)c1 1777684290 GOBQWLSWWQOMCM-PTNGSMBKSA-N 394.879 5.979 30 20 GKED N#Cc1ccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)cc1Cl 12832432 GNZYJSFQYNEGQK-UHFFFAOYSA-N 386.238 5.091 30 20 GKED N#Cc1cccc(C(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 25522538 VSAKOMWBCQYXLY-UHFFFAOYSA-N 388.370 5.058 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccccc2Cl)cc1Cl 46861699 HJHDSTPBCKZBKQ-GOSISDBHSA-N 381.262 5.901 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(C)cc2)cs1 54894955 PXCDBJKLNWVMGV-JLHYYAGUSA-N 376.481 5.341 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 66680344 GRKDFWXOVFAPPX-MSOLQXFVSA-N 393.556 5.771 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)c2nnc(-c3cccs3)o2)n1 79317009 QLJDOGKSVODSOQ-SECBINFHSA-N 396.419 5.245 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 120052214 WAZHAGLYGFGLGH-OJNOIJSXSA-N 379.872 5.138 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(C(F)(F)F)c1)c1ccc(C(F)(F)F)cn1 123742256 PJBPPWOKVGVKLH-LBPRGKRZSA-N 392.686 5.263 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2cccc(F)c2C#N)cs1 132059614 LDWMIEKGVGBWKL-UHFFFAOYSA-N 395.459 5.034 30 20 GKED COc1cc(-c2noc(CNc3ccccc3S[C@H](C)CC#N)n2)ccc1C 136572074 SOHTZGDQDHVYJB-OAHLLOKOSA-N 394.500 5.060 30 20 GKED C[C@H](N[C@H](C)c1nnc(-c2ccc(Cl)c(Cl)c2)o1)c1ccc(C#N)cc1 150872888 RPHSMYRYTWANLB-NWDGAFQWSA-N 387.270 5.327 30 20 GKED Cc1oc2cc(OC[C@H](C#N)CCC#N)ccc2c(=O)c1-c1ccccc1Cl 152947392 YHYUYXAVFPZSLB-HNNXBMFYSA-N 392.842 5.244 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)cc1C(F)(F)F 156563531 PPNFVHLMEDUQMQ-LLVKDONJSA-N 382.382 5.349 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccccc2)c2nccs2)cc1 178380561 QDFJYDZWHFOGQS-QHCPKHFHSA-N 381.504 5.561 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C[C@@H]1CCOC1)c1ccccc1 191433360 XYMFCQCAHFHRRE-CVDCTZTESA-N 392.543 5.828 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)c1ccncc1 191486076 WTPPMAVCAMIMCF-HSZRJFAPSA-N 385.511 5.845 30 20 GKED C[C@H]1CCN(C(=O)c2cccc(CC#N)c2)c2cc(C(F)(F)F)ccc2S1 195695809 YFVVNMUNSCCOCB-ZDUSSCGKSA-N 390.430 5.303 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 248610146 WBXJKNKUHBJAHT-SVMVAKDDSA-N 377.488 5.291 30 20 GKED COc1ccccc1[C@@H](Nc1ccc(C#N)cc1C(F)(F)F)c1ccccn1 301891210 UNYVVYYVWSAJDG-HXUWFJFHSA-N 383.373 5.182 30 20 GKED Cc1ccc(-n2c(S[C@@H](C)c3ccc(C#N)cc3)nnc2-c2ccncc2)cc1 303682516 JMALEFMORFBDJN-KRWDZBQOSA-N 397.507 5.363 30 20 GKED CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 304064597 SLTQTRLJOLLCBO-DEOSSOPVSA-N 398.506 5.231 30 20 GKED C[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1cc2ccccc2o1 329415877 CZZSUXWTNNABEA-QFBILLFUSA-N 391.515 5.957 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1C[C@H](C)C[C@H]1c1cccc(OC)c1 424237313 GFAYORCIAPGLRS-UXPWSPDFSA-N 398.576 5.018 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 426058880 MSEYZYQIEOQTDD-QGZVFWFLSA-N 385.920 5.048 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)CSc1ccc(F)cc1 426381612 NYXYCLOHXGEXLP-LSDHHAIUSA-N 388.533 5.587 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC3(CCC3)[C@@H]2C2CC2)cc1 427590611 CBLAGBCAXXOUCW-QFIPXVFZSA-N 388.536 5.255 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ncc(C#N)cc2Cl)cc1)c1ccccc1 427921307 FGTRJRRPEHCYEZ-AWEZNQCLSA-N 376.847 5.032 30 20 GKED Cc1ccccc1C1CC(N(C(=O)c2cccc(SCC#N)c2)C2CC2)C1 430593769 JDCBIGGGFAIKBC-UHFFFAOYSA-N 376.525 5.162 30 20 GKED Cc1cc2nc(/C=C\c3cn(CCC#N)nc3-c3ccncc3)sc2cc1C 432711374 UDUVABFHXVQFKW-PLNGDYQASA-N 385.496 5.256 30 20 GKED Cc1nc(-c2ccccc2NC(=O)N[C@@H](CCC#N)c2ccccc2)cs1 433793107 QMAXCSSOGOGRIP-SFHVURJKSA-N 376.485 5.285 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)Nc2cccc(C(C)(F)F)c2)c1 435920251 HSVMBAJONINRBW-QGZVFWFLSA-N 385.458 5.162 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)CS[C@@H](C)c1cccc(C#N)c1 443135281 CGYUECDVUUUBDA-JXFKEZNVSA-N 382.529 5.019 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)CCCC1(C)C 444898728 PGPWFDAMTTUALR-NRFANRHFSA-N 386.536 5.151 30 20 GKED Cc1c(F)ccc(Cl)c1NC(=O)c1ccc(COc2ccccc2C#N)o1 448511642 IAPGHQNWYAZHLU-UHFFFAOYSA-N 384.794 5.084 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccccc1)c1ccccc1 457897704 HPZIGDXXRPUGQW-MOPGFXCFSA-N 389.421 5.414 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CC3(O)CCCCC3)cc2Cl)cc1 467978291 QKTXIFFLEUDLFG-UHFFFAOYSA-N 384.863 5.028 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)ccc(C(F)(F)F)c1F 467999032 VVDJBZQWWGGNMR-NSHDSACASA-N 396.409 5.800 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1nc(C(C)(C)C)cs1 468778227 BFZMKJBPCYKBNM-HNNXBMFYSA-N 394.544 5.190 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cccc(N[C@@H](C)C(C)C)c2C)cc1 474712799 VOMNQZOBKCFWKH-KRWDZBQOSA-N 394.519 5.011 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1 474898357 GYHQJFPTBQWPJU-KNQAVFIVSA-N 375.516 5.087 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccccc1 475590796 SDNNAGOCJDVROI-QFIPXVFZSA-N 395.462 5.163 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccccc1 477082062 AWBRZLIYLIMQPL-FZKQIMNGSA-N 398.787 5.286 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3Br)c2)cc1 482224329 VYELBUQZZDXWMH-UHFFFAOYSA-N 393.240 5.365 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cccn2C2CCCC2)cc1 487745259 WXHJRTYZSQCPPG-UHFFFAOYSA-N 399.494 5.501 30 20 GKED Cc1cc(NC(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)ccc1F 491446432 VSMRIEOBSSLBCG-UHFFFAOYSA-N 391.421 5.379 30 20 GKED N#Cc1ccc(Br)c(CNC2(c3cccc(C(F)(F)F)c3)CC2)c1 492726176 ZRUJUUHEDZALQH-UHFFFAOYSA-N 395.222 5.118 30 20 GKED COc1ccc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)cc1OCCCC#N 494126570 JIKXAXQNYRCTGU-YFHOEESVSA-N 389.411 5.005 30 20 GKED CSc1ccc([C@H](C)NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 500245492 MEBWAIJCKQWLTG-HOTGVXAUSA-N 399.585 5.092 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(C)Cc1ccccc1-c1ccccc1 513863584 JPFMKZAHEZNXPS-UHFFFAOYSA-N 385.467 5.288 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)cc1 515014163 LEWGWLSKHIGFRQ-UHFFFAOYSA-N 398.350 5.542 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCc2c(Cl)cccc21 516242535 JMPZROSEKZWUMT-INIZCTEOSA-N 381.328 5.440 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 518120108 SOIXDKIJWFIHQO-GJZGRUSLSA-N 391.323 5.741 30 20 GKED COc1ccc2oc(C(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)c(C)c2c1 521292409 NRJCSCSQGRQBQR-OAHLLOKOSA-N 389.238 5.051 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1ccc(F)cc1 523959181 SLEYQGXTICGMIV-UHFFFAOYSA-N 380.806 5.420 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](c1ccccc1)[C@H]1CCCO1 524258495 QBFGZPASQPWZBR-IEBWSBKVSA-N 390.936 5.019 30 20 GKED CCCCc1ccc([C@H](NCCCC2(C#N)CCOCC2)c2cccs2)cc1 538610486 YBYFJYNDDIOSJH-QHCPKHFHSA-N 396.600 5.870 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccoc2C2CC2)cc1Cl 540840775 QGWMRGLOFPZVAY-LJQANCHMSA-N 376.843 5.718 30 20 GKED C[C@H](NC(=O)Nc1c(F)cc(F)cc1F)c1ccc(-c2cccc(C#N)c2)cc1 542027276 VHBPLWUMBOFXTD-ZDUSSCGKSA-N 395.384 5.525 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)NCCC[C@H]2CCCCO2)cc1Cl 545454236 JWFVLOPTXBDFGS-GOSISDBHSA-N 398.890 5.083 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)N(Cc1ccccc1)Cc1ccco1 551099498 IDXVHTYUDLLKEH-UHFFFAOYSA-N 396.899 5.126 30 20 GKED N#Cc1ccc(C(=O)N(Cc2cccs2)C23CC4CC(CC(C4)C2)C3)cc1 552815832 JUVASIZTOGGZHG-UHFFFAOYSA-N 376.525 5.231 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1nccc2ccccc12 556933579 HXEVMVWKZNJECK-XMMPIXPASA-N 399.453 5.940 30 20 GKED N#CC[C@H](CC(=O)N1CC[C@H](Sc2cccc(Cl)c2)C1)c1ccccc1 558115484 AIXRIRHESVNEAJ-XLIONFOSSA-N 384.932 5.121 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1ccc(Oc2cccnc2)cc1 561624492 YNBKSYPOWMCFHX-QGZVFWFLSA-N 390.508 5.643 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)Nc1ccccc1CC#N 567393108 UCZCDSDYJOYJOD-UHFFFAOYSA-N 386.238 5.275 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)C[C@@H]1OCc2cc(Cl)ccc21 593976754 XZWSFEKXESHHLE-ACJLOTCBSA-N 386.904 5.334 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)C1 597913563 MPKGEMQXFGGIOG-JTQLQIEISA-N 386.826 5.339 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@H]1CCC(F)(F)C1 601059980 MBLGUIUXWMRABG-KBPBESRZSA-N 384.517 5.045 30 20 GKED COc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603673240 QIHSZQNSGMWWQB-IBGZPJMESA-N 376.843 5.256 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1 604085125 SGFFSSMPXLESAC-QGZVFWFLSA-N 375.394 5.303 30 20 GKED N#CCCCOc1cccc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)c1 608845938 JZIMKLDVQLTDDS-SAPNQHFASA-N 392.480 5.384 30 20 GKED CC(C)c1ccc(CN(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 609384919 UFAWXWREMIYISO-SFHVURJKSA-N 395.572 5.275 30 20 GKED CCOc1cccc([C@H](C)NCc2cccc(OCc3ccccc3C#N)c2)c1 609433172 BCNWFJPSPAYRJW-IBGZPJMESA-N 386.495 5.387 30 20 GKED COc1ccc(CCCCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 609460622 YNMNFPQPDQADKX-IBGZPJMESA-N 391.298 5.096 30 20 GKED Cc1cccc2c(CCC(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)c[nH]c12 610172162 ZCWULVAYELKLAG-UHFFFAOYSA-N 396.450 5.107 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 610343998 YDWPOFZQOROGSA-OLZOCXBDSA-N 386.377 5.039 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccc(Cl)s1 610540065 OBAJTTPJIVQBOR-GFCCVEGCSA-N 383.860 5.203 30 20 GKED CCCc1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 611622762 AQLFYDBJQFMZFK-NRFANRHFSA-N 381.545 5.125 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CC[C@H](c3cccc(F)c3)C2)c(Cl)c1 619457098 RCLXZMCWAWETCM-DZGCQCFKSA-N 377.246 5.070 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 619804391 UPCYALQVDAPEJZ-NQIIRXRSSA-N 395.934 5.941 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 619804393 UPCYALQVDAPEJZ-WIYYLYMNSA-N 395.934 5.941 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 662082490 VTRVHROZDXBLGA-OYRHEFFESA-N 395.572 5.436 30 20 GKED Fc1ccc(-c2nc(CN3C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C3)cs2)cc1 674458915 FCLGBLXWVMLUPZ-BETUJISGSA-N 398.347 5.122 30 20 GKED C[C@H](CNC(=O)c1ccccc1SCC#N)c1c(Cl)cccc1Cl 726176503 QNANHQJXJKQXCA-GFCCVEGCSA-N 379.312 5.143 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 728006981 WGZGDTAOABKWNZ-QGZVFWFLSA-N 388.442 5.094 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2cccc(Cl)c2)c1 728227164 CRKZJYZERXLTNN-UHFFFAOYSA-N 376.912 5.725 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2ccccc2OC)cc1 728767196 XFJXFGGXBUNANK-XGHQBKJUSA-N 392.499 5.050 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)cn1 728820023 UQQQXVPMUQWAMM-GFCCVEGCSA-N 378.419 5.225 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(Cl)nc(Cl)c3)c2)cc1 729375945 XYBNLKWMTNVBEC-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](Sc2ccccc2Cl)c2ccccc2)n1 730072301 TVINFWQLTGMOSC-DNVCBOLYSA-N 398.940 5.815 30 20 GKED C[C@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731536674 JNPIXPPKTLKKGL-UZUQRXQVSA-N 385.467 5.273 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 732903318 UFRDMNHZHHMCCQ-HZPDHXFCSA-N 396.462 5.533 30 20 GKED O=C1/C(=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCc2ccccc21 733081444 YQNLLOURRWYCDG-PTNGSMBKSA-N 376.437 5.321 30 20 GKED C#CCCOc1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 733324205 MXKJIWBSUOJXKM-HUUCEWRRSA-N 393.371 5.088 30 20 GKED C/C(=C\C(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 742068371 MMVDZWYVWZVAMT-JICACKBISA-N 378.781 5.143 30 20 GKED N#Cc1ccc(F)c(CNCc2ccc(-c3cccc(Br)c3)o2)c1 742382055 ZQUSRFKRLPITPF-UHFFFAOYSA-N 385.236 5.010 30 20 GKED CCCCCSc1nc2ccc(NC(=O)N(C)C[C@H](C)C#N)cc2s1 743189198 IPEGATZAFFVMMW-CYBMUJFWSA-N 376.551 5.202 30 20 GKED N#C[C@H](C(=O)CCCC1CCCC1)c1nc2cc(C(F)(F)F)ccc2s1 744038113 MLSXOLGBATWPHL-CQSZACIVSA-N 380.435 5.852 30 20 GKED Cc1cccc(NC(=S)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)c1 745724934 ZTOZIFJLPZNHAK-UHFFFAOYSA-N 389.499 5.718 30 20 GKED N#Cc1ccc(C(=O)O[C@@H](c2ccccc2)c2cccc(Cl)c2Cl)cn1 745964624 KUNDCUNZYPDHAY-IBGZPJMESA-N 383.234 5.206 30 20 GKED O=C(/C=C/c1cc(Cl)c2c(c1)OCCCO2)c1ccc(-c2ccncc2)cc1 745990111 KGOQCMPSUVCHEZ-FARCUNLSSA-N 391.854 5.459 30 20 GKED COc1ccc(NC(=S)N(Cc2ccccc2C#N)C2CCCC2)cc1Cl 747707450 ZZCVDANTEVKJTG-UHFFFAOYSA-N 399.947 5.362 30 20 GKED N#Cc1cc(/C=C(/Cl)c2nc(O)c3c4c(sc3n2)CCCC4)ccc1F 756263710 VSUKOGCTIABSAO-MDWZMJQESA-N 385.851 5.023 30 20 GKED C#CC[C@H](NCc1cnc(-c2ccc(Br)cc2)s1)c1ccccc1 756998036 QHEFAHZCKYZKRW-IBGZPJMESA-N 397.341 5.427 30 20 GKED Cc1cccnc1/C=C\C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 758951426 DTWKIEUKZBWNEO-ZCPJJFRWSA-N 387.870 5.351 30 20 GKED Cc1nc([C@H](C)OC(=O)c2cccc(CC#N)c2)oc1-c1ccc(Cl)cc1 763933764 QLJFKGAZNXTYCO-AWEZNQCLSA-N 380.831 5.288 30 20 GKED C=CC[C@H](N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccncc1 766020438 PMQWDHBNSJQTIG-LRDDRELGSA-N 384.373 5.252 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnc(Cl)c2ccccc12 766633166 PTOVWMBSBZZXIJ-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)cc1 772591489 ATRDDSPMEPFUBA-FCHUYYIVSA-N 390.870 5.058 30 20 GKED Fc1cccc(F)c1-c1csc(CON=Cc2ccccc2OC(F)F)n1 774720271 WWKTXPXDLUTTTK-UHFFFAOYSA-N 396.365 5.240 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCCCc1ccc(Cl)cc1Cl 780674852 RKSQTUHHOCYMQC-CYBMUJFWSA-N 392.286 5.039 30 20 GKED O=C(O[C@H](Cc1ccc(F)cc1)C(F)(F)F)[C@@H]1CCC[C@@H](C(F)(F)F)C1 781752526 AJRFTHRCKQLZJQ-YRGRVCCFSA-N 386.307 5.211 30 20 GKED N#CCC1CCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)CC1 782057437 OGJHQTAMXVCXJX-UHFFFAOYSA-N 389.886 5.321 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2)c(-c2ccncc2)n1 788345420 NOTZVUCASNLEML-HYXAFXHYSA-N 397.265 5.062 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@@H](C#N)c2nccc3ccccc23)C1 792102801 JLXCBSJTAGEYRU-SYYKKAFVSA-N 378.516 5.567 30 20 GKED CC[C@@](C)(C#N)C(=O)Oc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 794846897 KQIBCTQTGYJTIM-QHCPKHFHSA-N 378.472 5.082 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1F 813216760 YJMPBWCXRQBWGU-NSHDSACASA-N 384.760 5.047 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1cc(C(F)(F)F)ccn1 853352678 DKSXFRCDIVNWQX-UHFFFAOYSA-N 381.242 5.553 30 20 GKED C=CCCC[C@H](NCc1ccc(-c2ccccc2Br)s1)C(=O)O 900069295 XOIJHVPVAIQSNH-INIZCTEOSA-N 394.334 5.077 30 20 GKED C=C[C@H](Cc1nc(-c2cccc(Cn3nc(C)cc3C)c2)no1)c1ccccc1 904526257 USTOWFGMPHAHJZ-HXUWFJFHSA-N 384.483 5.111 30 20 GKED N#C[C@@H](C(=O)/C=C/Sc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 916977276 OXCXMBAWMJOQHZ-DVQDXYAYSA-N 396.924 5.946 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)cc3cccnc23)cc1 917668532 ASEOQCBGYIIFTA-JOCHJYFZSA-N 397.865 5.796 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@@H]1c1ccccc1 919904874 XEHBPGZGBPEENY-DNQXCXABSA-N 395.506 5.957 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H](C)Sc1ccc(Cl)cc1 920102356 SFCTYONETFVXHI-SUMWQHHRSA-N 396.899 5.202 30 20 GKED Cc1cccc(OCCCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 920114017 XHHQMXTVXWANTD-HXUWFJFHSA-N 390.508 5.544 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(OC)cn1 931060926 YWHRIBPHTYQORQ-NRFANRHFSA-N 379.504 5.311 30 20 GKED Cc1c(C(=O)O)oc2c1C(=NNc1c(Cl)cc(Cl)cc1Cl)CCC2 1776014347 DOHFROWUVPRJIS-UHFFFAOYSA-N 387.650 5.399 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2sc(Br)cc2C(=O)O)cc1 1776105741 CRDDZDSMMLJRMV-LLVKDONJSA-N 395.322 5.017 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CC=C(C)CC3)CCC2)cc1 1791250567 VNOVCDFVEGKFSA-RBUKOAKNSA-N 380.532 5.079 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C/c2cccc(Cl)c2Cl)cc1 59324384 OSFSMKFXIRULEZ-JXMROGBWSA-N 387.266 5.202 30 20 GKED CSc1ccc(Cl)cc1NC(=O)c1ccccc1-c1ccccc1C#N 64848491 LRXPVQCSKKKYFA-UHFFFAOYSA-N 378.884 5.853 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nnc(-c2ccccc2)o1 105402680 MSYZSSJXFATQRG-INIZCTEOSA-N 382.423 5.574 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2)cc1)[C@@H](C)c1ccc(C#N)cc1 105909117 SKQVZRSOIMXQAW-IBGZPJMESA-N 384.479 5.361 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1nc2cc(Cl)ccc2s1 120048195 WZQTUEKJSTZMEF-JFGNBEQYSA-N 386.826 5.495 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 127421844 SAXOJQOOUQQINH-HXUWFJFHSA-N 384.526 5.455 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)C(C)(C)C#N 130275425 XAYAACSUMWANSD-UHFFFAOYSA-N 378.451 5.220 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N[C@H](CCC#N)c2ccccc2)cc1 153460105 PGPVQPBGMREUAX-HXUWFJFHSA-N 389.524 5.131 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2cc(F)ccc21 182341883 PBJBLKBTBGERLU-WMLDXEAASA-N 399.491 5.255 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)c1cn(C)c2ccccc12 185727747 NSMYLBFZFSCCKB-HOTGVXAUSA-N 377.513 5.315 30 20 GKED Fc1ccc([C@@H](NCc2ccc(OCC(F)(F)F)cc2)C(F)(F)F)cc1 237780216 POKFANDLQOMIJC-OAHLLOKOSA-N 381.291 5.160 30 20 GKED CC(C)n1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 261436788 FDIZZSVEDLYLDB-UHFFFAOYSA-N 380.835 5.034 30 20 GKED O/C(=N/[C@@H]1CCc2c[nH]nc2C1)C1(c2cccc(C(F)(F)F)c2)CCCCC1 329869971 ZPLJMGXSCIZTKS-QGZVFWFLSA-N 391.437 5.144 30 20 GKED OC(=Nc1cccc(CN2CCCCC2)c1)C1CCC(/N=C(/O)C2CC2)CC1 329954661 KEVFMUURMCQCOY-UHFFFAOYSA-N 383.536 5.186 30 20 GKED C[C@H]1CCc2sc(NC(=O)C3CCC(OC(F)F)CC3)c(C#N)c2[C@@H]1C 410976020 ALMJHGMAPVYRNA-ZFDZMSFRSA-N 382.476 5.042 30 20 GKED CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)c1ccc(C#N)o1 428056198 SJVWSEGQTHXBTI-UHFFFAOYSA-N 388.345 5.092 30 20 GKED C[C@H](NC(=O)c1cccc(SCC#N)c1)c1c(Cl)ccc(F)c1Cl 429850503 VSSICTDBEDIRSU-JTQLQIEISA-N 383.275 5.239 30 20 GKED CCOc1ccc(-n2c(S[C@@H]3CC[C@@H](C#N)C3)nnc2-c2ccccc2)cc1 430138979 ZXAURQMNMVAFHA-OXQOHEQNSA-N 390.512 5.117 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1)c1ccc(F)cc1 431721192 GBEYUADVOWRYEJ-INIZCTEOSA-N 388.320 5.099 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](c2ccccc2)C(C)(C)C1 434223609 VXBFZVKFAWOXEK-MJGOQNOKSA-N 393.556 5.596 30 20 GKED C=CCC[C@H](NC(=O)C1CCC(NC(=O)CC2CCCC2)CC1)c1ccccc1 435298631 YOVYCDUQTBJYCR-VNXZQDSDSA-N 396.575 5.065 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)o2)cc1 436364610 OKKRQSUTMFTWGJ-FCHUYYIVSA-N 398.462 5.061 30 20 GKED CSc1ccsc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437475270 LLEYXHKRGMGIMQ-UHFFFAOYSA-N 384.457 5.525 30 20 GKED CC[C@@H](C(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 437662814 UPBOLVRPWDPSLM-LJQANCHMSA-N 390.405 5.520 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 438076692 UHHCJEKIUGRZSM-RXVVDRJESA-N 393.556 6.148 30 20 GKED N#Cc1ccc(NC(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1C(F)(F)F 438637934 BWULSAJLHJMLGX-UHFFFAOYSA-N 389.352 5.037 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cc(F)ccc1SCC(F)F)c1ccccc1 439394514 GMUGRCNKUUJYDK-OAHLLOKOSA-N 393.434 5.349 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(CC#Cc3ccccc3)C2)n1 447399810 XJQYCOPAUHHAGZ-FQEVSTJZSA-N 388.536 5.050 30 20 GKED COCCCC[C@H](NC(=O)Nc1ccc(CC#N)cc1Cl)c1ccccc1 455733650 NUFFVJVLIHIFNP-IBGZPJMESA-N 385.895 5.086 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 460322270 QZHCJGZYESDMNF-XMMPIXPASA-N 398.506 5.231 30 20 GKED C[C@H](C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)c1ccsc1 460333942 WQEZWFAGKPVCDM-HNNXBMFYSA-N 380.900 5.610 30 20 GKED Cc1cc(Br)cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 463713646 RVWRRRZVLYEBOW-ZDUSSCGKSA-N 389.318 5.262 30 20 GKED CC(C)(c1ccc(NC(=O)c2cc(-c3cccc(C#N)c3)no2)cc1)C(F)(F)F 468800526 CWZCTXABYHWYPU-UHFFFAOYSA-N 399.372 5.305 30 20 GKED N#Cc1csc(C(=O)N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 474275322 PAXNLZNRDIMCSJ-GFCCVEGCSA-N 392.324 5.062 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(OC)cc1)C1CC1 475567772 YGKXUSYFHUDUGV-UHFFFAOYSA-N 378.516 5.744 30 20 GKED CCN(Cc1cccc(-c2ccncc2)c1)C(=O)C[C@H](CC#N)c1ccccc1 476132775 DXOKLHAIEHURKZ-DEOSSOPVSA-N 383.495 5.185 30 20 GKED COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 477507529 GBGXZVYYZCSTSM-OAQYLSRUSA-N 377.488 5.038 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cnn(CC(C)C)c1C(F)F)c1ccc(F)c(F)c1 480947524 CNJUSHXICMDMTE-INIZCTEOSA-N 398.404 5.194 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 481298272 AZGPRCOPHSCICQ-FQEVSTJZSA-N 388.433 5.240 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)s1 487622976 AQUXKHBHZALNIG-FQEVSTJZSA-N 389.524 5.592 30 20 GKED Cc1c(C(=O)Nc2ccc(Cl)c(C#N)c2)sc2nc(C(F)(F)F)ccc12 494737661 HHLHQWCOVOEJCB-UHFFFAOYSA-N 395.793 5.401 30 20 GKED CCN(Cc1ccc(Cl)s1)Cc1cn(CCC#N)nc1-c1ccccc1 506087646 YMSUPFLBDKBVSP-UHFFFAOYSA-N 384.936 5.201 30 20 GKED CCOc1cc(CCCNC2CCC(C#N)(c3ccccc3)CC2)ccc1OC 507645056 OQCULVYYGYDMGO-UHFFFAOYSA-N 392.543 5.020 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 517654105 KRVPUEIDQCDNGX-UHFFFAOYSA-N 387.439 5.094 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(Br)ccc1F 520828766 XTFPTCFEXWGQBP-GFCCVEGCSA-N 379.298 5.452 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@H](c3cccs3)C3CC3)cc2)cc1 521951244 VKAJJSKDMWWQLY-QFIPXVFZSA-N 388.492 5.488 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)c1ccccc1C(F)(F)F 525575360 YAIYALLPKQQGOV-YVEFUNNKSA-N 380.797 5.233 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 527229205 DKZIAPMRJPCKIK-XMSQKQJNSA-N 378.472 5.180 30 20 GKED Cc1ccc(C)c(Oc2ccc(CNC(=O)C[C@@H](CC#N)c3ccccc3)cn2)c1 527233219 WTZSALJMTNDJSC-JOCHJYFZSA-N 399.494 5.195 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)N(C)c3cc(Cl)ccc3C#N)c(C)c2c1 531934001 OUMXUVYOWCJVEN-UHFFFAOYSA-N 394.858 5.065 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3Oc3ccccc3Cl)cc2)CC1 537389327 MBLSKRQTDXCTMO-UHFFFAOYSA-N 388.854 5.940 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)c3ccc(C#N)c(F)c3)s2)cc1 538509239 JAFDNBYIESGXJS-GJZGRUSLSA-N 379.504 5.850 30 20 GKED C=CC[C@H](C)[C@@H](C)Nc1ccc(NC(=O)[C@H](C)n2nc(C)cc2C)c(Cl)c1 538634114 HEHYNDRCGHQSKY-XKQJLSEDSA-N 388.943 5.366 30 20 GKED CC[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc(F)cc(Br)c1 540606741 OCJKCQFIJNQXRO-OALUTQOASA-N 375.285 5.674 30 20 GKED N#CCCC[C@@H](NCc1csc(COc2ccccc2)n1)c1ccccc1 552312135 SIEBAEJWHKYQMU-OAQYLSRUSA-N 377.513 5.247 30 20 GKED CN(C)Cc1nc(NCC(C)(C)CCC#N)c2c(-c3ccccc3)csc2n1 554687982 HRSNYZSRJYPJBN-UHFFFAOYSA-N 393.560 5.162 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 558367949 OUCVBGOLKOWXRR-SFHVURJKSA-N 379.504 5.426 30 20 GKED C=CCCC1(c2nc(-c3cccc(NC(=O)c4ccccc4F)c3)no2)CC1 567962159 VWXQMRFLFFDMPR-UHFFFAOYSA-N 377.419 5.126 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cnc(-c2ccc(Cl)cc2)s1 570053936 ZQINYFPICFXGHH-FQEVSTJZSA-N 379.916 5.502 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)CC2)c1 575930218 NCAHPRJPDXASHO-UHFFFAOYSA-N 382.744 5.040 30 20 GKED Cc1c(Br)cccc1-c1noc(C[C@@H](CC#N)c2ccccc2)n1 576216184 ZVTOGGGRGXPACD-OAHLLOKOSA-N 382.261 5.048 30 20 GKED COc1cc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C2CC2)cc1Cl 594204039 PBPYQDMHSDJWPN-LJQANCHMSA-N 397.906 5.783 30 20 GKED COc1cc2ccc([C@H](C)N[C@@H](CCCC#N)c3ccccc3)cc2cc1OC 595040307 XKTXZNNCFMROLD-MBSDFSHPSA-N 388.511 5.943 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2ccccc2F)C1 598414789 GJUCSHMXTYLJLA-JOCHJYFZSA-N 394.471 5.240 30 20 GKED C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccco1 599390796 QMCCMSVYRALORQ-LBPRGKRZSA-N 382.407 5.436 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)cc1 599522424 JPEVKTYXWGVDMA-UHFFFAOYSA-N 390.870 5.175 30 20 GKED CCCN(Cc1ccccc1F)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601187790 QWPOUARAACPBNO-UHFFFAOYSA-N 387.458 5.065 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2cccc(Cl)c2Cl)cc1 603747418 QZVNEPQURAHCRY-UHFFFAOYSA-N 387.188 5.070 30 20 GKED C[C@@H](Cc1ccccc1F)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606173814 AARHHMUSIUMMET-SCUASFONSA-N 399.350 5.030 30 20 GKED N#C[C@@H](C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nc2cc(F)ccc2s1 609322050 VJGIJDZYWUSJHR-LBPRGKRZSA-N 397.412 5.048 30 20 GKED Cc1cc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)n(C(C)(C)C)n1 609503907 FOMRKRBUVUZDSV-UHFFFAOYSA-N 388.471 5.057 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)c(Cl)c2)nnc1-c1cccnc1 615346647 RHTJSMZCRZKAEV-LBPRGKRZSA-N 391.327 5.686 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)CCCCC1 625937310 VAXIGFGOVHCSTR-UHFFFAOYSA-N 397.588 5.813 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1[nH]ccc1C1CC1 649227718 KGMFDSNTYTYYQF-UHFFFAOYSA-N 394.290 5.434 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 662081650 QAWZCBRYJRNSOE-HDICACEKSA-N 387.936 5.164 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 672239378 PUVJELHGFXJVFG-INIZCTEOSA-N 393.453 5.191 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 726073374 AAUYWWBBYGBTHE-XMMPIXPASA-N 383.495 5.785 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cnc3c(c2)c(C)nn3C)cc1 727781830 YBSVZQZPGJVNFT-JYRVWZFOSA-N 397.478 5.060 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3nc(Cl)ccc3Cl)cc2)c1 731331889 UYCURZZTPLHVJE-UHFFFAOYSA-N 384.222 5.305 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)c(Cl)c1 733083738 QCXHJVGXNBXYBW-ALCCZGGFSA-N 388.807 5.407 30 20 GKED Cc1ccc(-c2ncc(/C=C/C(=O)c3sccc3Br)s2)cc1 734305922 HXKBVGGSKRYTQO-VOTSOKGWSA-N 390.327 5.839 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)Nc2cccc(OCC#N)c2)cc1F 735251248 RVWMXNAZSPFVGQ-UHFFFAOYSA-N 378.378 5.095 30 20 GKED Cn1c(CC(=NOCc2ccc(F)c(F)c2)c2ccccc2)nc2ccccc21 735488170 HRXFLXONTAJYGV-UHFFFAOYSA-N 391.421 5.015 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=S)Nc1ccc(C#N)c(Cl)c1 740773589 VKYKKHCBUYRUSD-OAHLLOKOSA-N 383.948 5.772 30 20 GKED C[C@@H]1Sc2sccc2C(=O)/C1=C/c1cccc(NC(=O)C(F)(F)F)c1 742437448 UPDAPFPAYKODCY-ITTMYVLYSA-N 383.416 5.009 30 20 GKED C#Cc1cccc(N(Cc2nnc(-c3cccc(F)c3)o2)Cc2cccs2)c1 744395098 REODHXGZVPWXCL-UHFFFAOYSA-N 389.455 5.125 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C=NNc1cccc(Br)c1 745987430 DXGBWICAZYZNQJ-UHFFFAOYSA-N 389.684 5.043 30 20 GKED Cc1ccc(/C=C\C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cn1 754257350 XUSIHOXOILEZIR-YVMONPNESA-N 391.418 5.067 30 20 GKED C=CC[C@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1ccncc1 756581455 CULCBKDSKAXNHO-BZNIZROVSA-N 381.701 5.171 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccc2ccccc2n1 759188569 WBFRQOYABRHJJP-LEVJEWGPSA-N 383.838 5.326 30 20 GKED Cc1nc([C@@H](C)OC(=O)/C=C\c2ccccc2C#N)oc1-c1ccc(Cl)cc1 763907812 GTTJRLZXSXMXJA-HMVFGEFZSA-N 392.842 5.493 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1ncoc1-c1ccccc1Cl 768034441 HBGCSNHMPTUKCD-UHFFFAOYSA-N 380.831 5.153 30 20 GKED CC(C)(C)c1nc(COC(=O)c2cn(CCCC#N)c3ccccc23)cs1 769544728 SULITCQFEQYBGM-UHFFFAOYSA-N 381.501 5.056 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(N2CCCc3ccccc32)cc1 780169956 VISOFRNPBNJYMN-GOSISDBHSA-N 397.478 5.314 30 20 GKED CSCCCCCCNC(=S)N(Cc1ccccc1C#N)C1CCCC1 782208636 WMXNWDOEGNZJGB-UHFFFAOYSA-N 389.634 5.101 30 20 GKED Cc1ccc2c(CN[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)cc(=O)oc2c1 782230930 JCYIMHXPPBKVNA-SFHVURJKSA-N 394.474 5.491 30 20 GKED N#C[C@@H](C(=O)CCCc1ccsc1)c1nc(-c2c(F)cccc2F)cs1 783363983 JYRKYAGDHXFPCQ-ZDUSSCGKSA-N 388.464 5.349 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C(F)(F)F 787398829 CLPDKBUTAMJFOK-MSOLQXFVSA-N 375.394 5.050 30 20 GKED O=c1[nH]ccc2cc(NN=C3CCC[C@@H]3c3ccc(C(F)(F)F)cc3)ccc12 789073627 ONKLQGBJCFIWHY-QGZVFWFLSA-N 385.389 5.283 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(Br)c(Cl)s2)c1 790965604 TVCFXPWRTCYHOI-LBPRGKRZSA-N 399.741 5.135 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 793390281 NQFQIRQWARKFHB-PXNSSMCTSA-N 386.417 5.456 30 20 GKED N#CC[C@H](CC(=O)OCc1csc(Nc2ccccc2)n1)c1ccccc1 795981061 LGXQMQXCENYSFJ-QGZVFWFLSA-N 377.469 5.017 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 796632638 DZYCSTRADWREOI-XKQJLSEDSA-N 388.920 5.235 30 20 GKED C=CCC[C@H](Nc1ccc(OC)c(NC(=O)C2CCCCC2)c1)c1ccco1 796927930 XWCITUGKPSTPFM-IBGZPJMESA-N 382.504 5.926 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1csc(-c2ccccc2F)n1 812245463 UPBNDIMSAGJEPG-AATRIKPKSA-N 393.468 5.364 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)ccc1C(C)C 813216083 NEDHDYITDWPVGJ-KDOFPFPSSA-N 390.405 5.176 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(N2CCCCCC2)cc1 824320869 NYMGXDJSZBFHDU-SFHVURJKSA-N 376.504 5.164 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)OC(=O)[C@@H](C)CC#N 850855522 YCESRTRAETXNEU-CMPLNLGQSA-N 393.306 5.035 30 20 GKED CC(C)(C)Oc1c(F)cc(NCc2cc(C#N)ccc2Br)cc1F 864022504 IVUXNBMBSVIHKJ-UHFFFAOYSA-N 395.247 5.388 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)c1nc(-c2cccnc2Oc2ccccc2)no1 904455281 ZHYVNCVUCKFDSR-INIZCTEOSA-N 382.423 5.142 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCSc1nc2ccccc2s1 914499727 DGLSTPAMZDIYMH-UHFFFAOYSA-N 395.553 5.089 30 20 GKED COc1ccc(/C=C2/SC(=Nc3c(C)cccc3C)NC2=O)c2ccccc12 915983590 OWWXQHDWTVDZHP-DEDYPNTBSA-N 388.492 5.357 30 20 GKED CCOc1ccc([C@@H](NC(=S)Nc2ccccc2C#N)c2ccccc2)cc1 915999062 AZWDXXOVSZTBFZ-QFIPXVFZSA-N 387.508 5.033 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1nc2ccccc2[nH]1 916844445 JXCGUTMEGAZDHN-FPISAVPCSA-N 387.439 5.320 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(SC(C)C)cc1 916904392 BTPRATNDOWJIOT-HXUWFJFHSA-N 394.540 5.273 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccc(Cl)s2)cc1 916948867 KEKVSSARUVTZMX-RHPXVONCSA-N 386.904 5.276 30 20 GKED C[C@H](Cc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921132362 QATCJXRJTVUXKT-FZKQIMNGSA-N 398.890 5.658 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/Cc3c(F)cccc3C2=O)cs1 921264307 QQOHWKCQAXFNCM-GDNBJRDFSA-N 392.455 5.098 30 20 GKED O=C(O)[C@H](Oc1cccc(C=NNc2c(F)cccc2Cl)c1)c1ccccc1 1776055718 KZZRXZVVAGLRBI-HXUWFJFHSA-N 398.821 5.130 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)[C@H](C)Oc1ccc(Cl)cc1Cl 1776062344 PFRCJPJQHQUBME-JTQLQIEISA-N 385.222 5.086 30 20 GKED COc1cccc(Sc2ccccc2C=NNc2ccc(C(=O)O)c(F)c2)c1 1776075708 YSKYRDFZJINPSL-UHFFFAOYSA-N 396.443 5.130 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3ccc4ccccc4c3)cc2)c1 1776130932 AZSWDWQEFHXCRO-XNTDXEJSSA-N 392.454 6.030 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2cccc(SCc3ccccc3)c2)CC1 1776162290 YCQJSDZWRYGCQZ-UHFFFAOYSA-N 381.541 5.222 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cs1 1776380458 BHFSUEIKFJQCHM-HWKANZROSA-N 375.446 5.215 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cn(C)nc1-c1cc2ccccc2o1 1776785562 LZNNJEYKXQPYBC-IBGZPJMESA-N 397.519 5.127 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\CCCc4ccc(Cl)cc4C3=O)o2)cc1 1777671055 XJNLMUNWMKVYJE-SFQUDFHCSA-N 392.838 5.901 30 20 GKED C=CCn1c(SCc2ccc(-c3ccccc3)cc2)nnc1-c1cccnc1 8472065 NUSBUQMRSGQBNW-UHFFFAOYSA-N 384.508 5.485 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc(F)cc3Cl)c2)cc1 46347103 RPHDCBDPWQOCTI-UHFFFAOYSA-N 394.833 5.376 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 103674271 FFOANPMUTHPJBX-PXNSSMCTSA-N 385.492 5.442 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc(F)c(F)cc2F)cc1 104477643 IEARAOFULYSNRM-UHFFFAOYSA-N 398.409 5.520 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cccc(F)c1F 108241826 CFNCZFFZUJALJK-UHFFFAOYSA-N 386.345 5.242 30 20 GKED Cc1ccc(-c2noc(CNc3cccc(OCc4cccc(C#N)c4)c3)n2)cc1 108350230 KNMSJPNIFDLIML-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1SC[C@H](C)C#N 108531339 LKIPQARYKXPTEN-QGZVFWFLSA-N 390.512 5.030 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)c2)cc1 124780190 QBYRJUCWMZXQIO-FQEVSTJZSA-N 396.475 5.066 30 20 GKED CC(C)N(CCc1nccs1)C(=O)Nc1ccccc1S[C@H](C)CC#N 150992993 PXZVMRLJDZTLEH-OAHLLOKOSA-N 388.562 5.022 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc2ccccc2n1C(F)F 170998923 SJYSYHJPLSQWSZ-QGZVFWFLSA-N 395.409 5.243 30 20 GKED CN(C)c1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)c(C(F)(F)F)c1 178496315 BENMOWKZBAOBQL-UHFFFAOYSA-N 394.290 5.182 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1cccc(OC)c1 191423827 IFXHKJMXWAXNLR-QFIPXVFZSA-N 378.516 5.916 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2ccc(F)cc2)CCOCC1 191490387 UFJRVZAUBWSLMT-UHFFFAOYSA-N 396.506 5.505 30 20 GKED Cc1nc(/C=C\c2cnn(C(C)C)c2)sc1C(=O)/C=C\c1cnn(C(C)C)c1 255619794 GMFKXJKNIKUDSV-VRHVFUOLSA-N 395.532 5.073 30 20 GKED Cc1cc(F)cc2c(N3CCC[C@H](c4nc5ccccc5o4)C3)c(C#N)cnc12 301556096 WPQDNMTTZXCHTA-HNNXBMFYSA-N 386.430 5.079 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(-c3ccc(OC(F)F)cc3)s2)cc1 303323602 RWGCKEBYHJEDBM-UHFFFAOYSA-N 384.407 5.335 30 20 GKED CC(=O)N1CC[C@@H](/N=C(/O)Cc2coc3cc(C)c(C)cc23)c2ccccc21 328776049 CNQSQPAHLACBLB-HXUWFJFHSA-N 376.456 5.047 30 20 GKED CC(O)=Nc1ccc(C/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)cc1 329497353 JHAIPDBRGHKNAN-FQEVSTJZSA-N 380.492 5.183 30 20 GKED COc1ccc(-c2nc3c(s2)[C@H](/N=C(/O)[C@@]2(C)C[C@H]4CC[C@H]2O4)CCC3)cc1 330115391 UDCZPTGJDCCMFN-KLSTYFJDSA-N 398.528 5.110 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@@H]1CCCc2cc(C#N)ccc21 419647663 QZXFPPKLTPKEPJ-DNVCBOLYSA-N 396.560 5.227 30 20 GKED CC(C)n1ncc2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc21 432766318 BTPWENHZJVDXPK-HXUWFJFHSA-N 375.476 5.174 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(c2ccccc2)CC1 433856929 YMGXALMZULJDBZ-UHFFFAOYSA-N 380.507 6.031 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(C(C)C)nc1 435366467 YVTZXOLVZVZAPA-UHFFFAOYSA-N 385.467 5.216 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 438659692 GKAUOTDBACOMFH-UHFFFAOYSA-N 395.459 5.524 30 20 GKED Cc1ccc2c(C3=CCN(C(=O)N[C@@H](CCC#N)c4ccccc4)CC3)c[nH]c2c1 438841585 ZPWOTCTYHTXESB-QHCPKHFHSA-N 398.510 5.320 30 20 GKED Cc1ccccc1C[C@H](C)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 444902306 WJQDBTTVWNYVPR-WMZOPIPTSA-N 381.545 5.342 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(OCc3cscn3)c2)CCCC1(C)C 445237634 HYSYARRRLCQMNQ-LJQANCHMSA-N 385.533 5.321 30 20 GKED Cc1cc(-c2ncccc2NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cs1 446427932 MHMMMJFYMZAQAO-UHFFFAOYSA-N 388.496 5.187 30 20 GKED CCN(C(=O)Nc1cccc(CC#N)c1)[C@H](C)Cc1ccccc1C(F)(F)F 455905188 LFZPOLQMKSFOBU-OAHLLOKOSA-N 389.421 5.256 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCC[C@H]1Cc1ccccc1)c1ccccc1 458804484 SRLGGQKUNGZKPY-GOTSBHOMSA-N 375.516 5.228 30 20 GKED Cc1cc(F)cc([C@]2(F)CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c1 458854162 XBBLLNDNRVAPSW-GMAHTHKFSA-N 397.469 5.149 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469268200 UKUSBLWKTDSMCM-HNNXBMFYSA-N 396.560 5.331 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc2c(C)nn(-c3ccc(F)cc3)c2s1 471166973 ZWAGAZFZZNCNCH-UHFFFAOYSA-N 398.507 5.079 30 20 GKED C[C@H](C(=O)N[C@](C)(C#N)CCc1ccccc1)c1ccc(Cl)c(Cl)c1 471969538 JIMLIKFSLOVXQM-XOBRGWDASA-N 375.299 5.128 30 20 GKED N#CC(CCN1CCO[C@@H](c2ccsc2)C1)(c1ccccc1)c1ccccc1 472572715 YIJFKTNGFVHWFU-HSZRJFAPSA-N 388.536 5.021 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cn(Cc3ccccc3)c3ccccc23)n1 474430593 GGCYPSOBFKZILY-LJQANCHMSA-N 399.519 5.760 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](CCc2ccccc2)C1 475549827 PGIJYCXZXCOBCO-JOCHJYFZSA-N 392.543 5.404 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCC[C@H]1c1ccccc1OC)c1ccc(F)c(F)c1 477738828 AUMTYZULXBXNNF-PZJWPPBQSA-N 386.442 5.137 30 20 GKED C=C(C)Cn1c(S[C@@H](C)c2cccc(Cl)c2F)nnc1-c1ccncc1 478848894 CPJIYMXYSVEPAT-ZDUSSCGKSA-N 388.899 5.562 30 20 GKED C=C(C)[C@@H](N[C@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)c(F)c1 481627017 MVOBXFVVLSIISZ-IIBYNOLFSA-N 386.486 5.631 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCC[C@@H]1C(F)(F)F 483651071 RLUUCXTYIZHLHZ-KFWWJZLASA-N 399.482 5.571 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N(CC(F)F)c3ccccc3)c2)c1 485249446 WUFJNDWMWOKLGT-UHFFFAOYSA-N 392.405 5.049 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)cc1 487420161 VYIQTXVQHWNUIK-HNNXBMFYSA-N 393.537 5.033 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)[C@H]2CCCC(F)(F)C2)c1 499889390 UIABYEONRAEHBH-KRWDZBQOSA-N 388.845 5.570 30 20 GKED C=CCc1cc(C(=O)N(CC2CCCCC2)c2ccccn2)cc(OC)c1OC 507955863 NDZQDEKBRPCJEP-UHFFFAOYSA-N 394.515 5.054 30 20 GKED Fc1ccccc1C(F)(F)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 512014906 JGFOHAWYAQYLTF-ZDUSSCGKSA-N 390.258 5.427 30 20 GKED CC(=O)c1ccc(CC(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)cc1 515286366 UTBLROWVLLXKMU-KRWDZBQOSA-N 394.540 5.155 30 20 GKED C[C@@H]1c2c(sc(NC(=O)[C@@H]3CCC(=O)c4ccccc43)c2C#N)CC[C@H]1C 517316970 SQRFCGJXWGYKTF-DVOMOZLQSA-N 378.497 5.004 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)n1-c1nccs1 518140128 FDBNHAMCXYRTLB-CYBMUJFWSA-N 396.541 5.055 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 518259415 KTFXFEOWNBRGMP-QZTJIDSGSA-N 381.545 5.923 30 20 GKED COc1ccc(CNCC2(c3ccc(Cl)cc3)CCC2)cc1OCCCC#N 518279081 WCIHDMUHOJIFRE-UHFFFAOYSA-N 398.934 5.243 30 20 GKED Cn1ccc2c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)c(Cl)c3)cccc21 519105389 OAIMQKXEPKMPJB-OAQYLSRUSA-N 399.881 5.739 30 20 GKED C=CCc1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)cc(OC)c1O 520694510 VTDISEQFUGDZPV-HXUWFJFHSA-N 393.449 5.635 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 520711490 IELZOESAQBVLME-GFCCVEGCSA-N 392.267 5.013 30 20 GKED CC[C@H](C)[C@@H](C)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CC1 524487450 JNPRWEBNMWUSTM-ZWKOTPCHSA-N 376.500 5.176 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3ccc(F)cc3Cl)c2)c1 524502410 FPLBMWDMSXNVKS-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)cc1 524572723 PIURYWMLANAZLL-MLGOLLRUSA-N 379.312 5.164 30 20 GKED COCc1nc2cc(NCc3cccc(OCc4ccccc4C#N)c3)ccc2o1 531429913 LHZIKRSJIVNRGF-UHFFFAOYSA-N 399.450 5.037 30 20 GKED Cc1ccnc(CNc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)n1 535896294 HIZXZMRNOXHKQV-UHFFFAOYSA-N 384.361 5.080 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)NCc1cc(Cl)sc1Cl 536148143 AZUMYKZROKJOOD-GJZGRUSLSA-N 394.327 5.036 30 20 GKED Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)c2ccc(CC#N)cc2)c1C 536244483 NREJUROBMLAULW-UHFFFAOYSA-N 399.281 5.114 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(N2CCCC2=O)c1 538113617 WYLXPDHMNJGEFE-LJQANCHMSA-N 395.506 5.203 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)CC1 540296483 SHKZYUCAWQDNTL-CDSKWGQSSA-N 398.909 5.303 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2cccc3cc[nH]c23)cc1 548506886 KFISXLLRWWDDPK-UHFFFAOYSA-N 398.441 5.413 30 20 GKED C[C@H](C#N)CN(C)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCCCC1 549658625 DKSVRCJRCKEZBZ-KDOFPFPSSA-N 381.442 5.128 30 20 GKED C[C@H](C1CC1)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 556502830 KDQGPEBVTKHUGL-CQSZACIVSA-N 383.879 5.053 30 20 GKED CCCN(C(=O)c1cc(C#N)cs1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 558082358 XBAPOJIWQNTMRW-NRFANRHFSA-N 393.487 5.104 30 20 GKED CC(C)[C@H](c1ccc(Cl)cc1)c1noc([C@H](C#N)Cc2ccc(C#N)cc2)n1 558388516 NIFYNKIIOXWAIT-AZUAARDMSA-N 390.874 5.232 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cccc(-c4ccncc4)c3)cc2)ccn1 558494210 GRJIIMRLRVZCLA-UHFFFAOYSA-N 378.435 5.420 30 20 GKED COCc1ccc([C@H]2CCCN2c2c(C#N)cnc3c(Cl)cc(C)cc23)o1 558785562 RRNKHYVAAFGJHW-GOSISDBHSA-N 381.863 5.149 30 20 GKED N#Cc1cc(NC(=O)c2ccc(C(F)(F)F)cc2Cl)nc2ccccc12 580255421 NSPSOQMOWJHSPE-UHFFFAOYSA-N 375.737 5.031 30 20 GKED CC(C)Oc1ccccc1NC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 584559573 XKWFLKUAODOVGU-UHFFFAOYSA-N 388.427 5.177 30 20 GKED CCOc1ccc(C[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 591059646 KTOPYMCTPWJOCL-IRXDYDNUSA-N 382.529 5.297 30 20 GKED N#CC1(c2cccc(-c3cc(F)ccc3OC[C@H]3CCCCO3)c2)CCOCC1 592982690 BATKXUXYTLVPQX-OAQYLSRUSA-N 395.474 5.012 30 20 GKED CC1(C)C[C@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)c2cc(F)ccc2O1 593407712 UUKOICYNPULUGM-UXHICEINSA-N 395.478 5.162 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)cc1OCc1cccc(Cl)c1 596853626 SNAWSNHPRPMXOV-KRWDZBQOSA-N 397.906 5.385 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3)cc2)cc1 604458617 PQPJXINVARSFCS-UHFFFAOYSA-N 379.419 5.598 30 20 GKED CC(C)(C)c1ccc(CCCC(=O)Nc2ncccc2OCCCC#N)cc1 608962462 MUJVUXXXYLBEIK-UHFFFAOYSA-N 379.504 5.023 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)CC(C)(C)c1ccccc1 609398024 BMZANMDBPKZWMH-ZWKOTPCHSA-N 395.572 5.816 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)c1ccccc1C(F)(F)F 610228154 ORMQUGDARBIDJT-KBPBESRZSA-N 392.446 5.842 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H](C)c2ccccc2C(F)(F)F)cc1 610239824 LCPCOHQYYUCFOZ-HNNXBMFYSA-N 390.405 5.154 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CCC[C@](C)(C#N)C1 612305095 RGZSOERVFJENTO-JOCHJYFZSA-N 397.450 5.093 30 20 GKED CC(C)(C)c1ccc(C#N)c(N2CCC[C@H](c3nc(C(F)(F)F)cs3)C2)n1 613427862 PVULQVKDMKCVEV-ZDUSSCGKSA-N 394.466 5.110 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1[nH]c(C)c(C(C)=O)c1CCC 614527107 LVNRVZAMASTFKJ-UHFFFAOYSA-N 378.925 5.022 30 20 GKED CC(C)(C#N)CC[S@](=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 616181937 UDJROZCFLCNRGC-DEOSSOPVSA-N 380.340 5.771 30 20 GKED N[C@@H](CC(F)(F)F)c1ccc(-c2cc(F)ccc2OCC(F)(F)F)cc1 629736251 MTHUKEHHFCPGEX-AWEZNQCLSA-N 381.291 5.386 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OCc2cccnc2)cc1 642163631 RWZUCEWJLJCQKZ-UHFFFAOYSA-N 398.915 5.204 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2nnsc2Cl)cc1)C(F)(F)F 647634032 LDAQJWILXMQDCW-UHFFFAOYSA-N 393.715 5.093 30 20 GKED O=C(Nc1cc(C(F)F)ccc1F)N1CCC(C(F)(F)F)(C(F)(F)F)C1 650387329 FJLUDKNDWCOQKX-UHFFFAOYSA-N 394.237 5.112 30 20 GKED CC(C)(C)C(F)(F)CNC(=O)NC(CCC(F)(F)F)CCC(F)(F)F 661900922 XILTWXRGTDTFQL-UHFFFAOYSA-N 386.327 5.021 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c12 679536837 TZUZBRONAOYZRH-KRWDZBQOSA-N 396.450 5.262 30 20 GKED N#Cc1ccc(NC(=S)NCCCCOc2ccc(Cl)cc2)cc1Cl 726453074 QZFWPCNLTHVKLG-UHFFFAOYSA-N 394.327 5.011 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)c(C)c1 728062098 DLHMJTOHLPLDGD-IBGZPJMESA-N 399.494 5.193 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3ccc(OC(F)F)c(OC)c3)c(C)c2c1 729149872 GIZQLTNXARIWHS-QPJJXVBHSA-N 388.366 5.256 30 20 GKED C#CCOc1ccccc1CNCc1nc(-c2ccc(Cl)cc2)c(C)s1 729680327 CCYSMVHUMFBRBT-UHFFFAOYSA-N 382.916 5.074 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccncc1 734684592 OBGNQUREBYWIDI-IBGZPJMESA-N 389.421 5.092 30 20 GKED COC(=O)[C@@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(Cl)c1 735508148 VNUJPTDXWJURHG-YADHBBJMSA-N 390.870 5.322 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CSc3cc(Cl)ccc3Cl)[nH]c12 735792792 OARTTYBUHCCZFP-GFCCVEGCSA-N 390.295 5.147 30 20 GKED Clc1ccc2c(NN=Cc3sc(N4CCCC4)nc3Cl)ccnc2c1 735971273 WDJHXLQFTAYKEL-UHFFFAOYSA-N 392.315 5.044 30 20 GKED Cc1nc(C(C)C)sc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739591485 XXXPZTWGZKZVRJ-UHFFFAOYSA-N 381.526 5.105 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1cnc2ccccn12 740765484 CPXHRSZAGLCDNC-MDZDMXLPSA-N 379.872 5.316 30 20 GKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 746415770 FNKBTLMCVRMECX-QGZVFWFLSA-N 381.426 5.329 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 747124104 RFWQCUFJEINRRT-LJQANCHMSA-N 389.524 5.657 30 20 GKED C[C@@H](Nc1cccc(OCCCC#N)c1)c1cc(Br)c(F)cc1O 756818418 GBTTUIRRQZDGEH-GFCCVEGCSA-N 393.256 5.149 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 758447186 RZSDQTNMECQZTR-HNNXBMFYSA-N 398.963 5.708 30 20 GKED C=C[C@H](CC(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C)c1ccccc1 758800509 VJESVLMGHREFRW-GOSISDBHSA-N 394.515 5.352 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(C)nc3ccccc23)cc1 760182821 IIEPRQXAHWHQDU-QVKFZJNVSA-N 385.467 5.018 30 20 GKED N#CCCCCOC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 767337924 YDNGTQQULDNAHO-UHFFFAOYSA-N 376.239 5.075 30 20 GKED N#CC1(c2ccccc2)CCC(Nc2ccc(N3CCSCC3)cc2)CC1 770420617 JEDVHUSOSCCHQZ-UHFFFAOYSA-N 377.557 5.056 30 20 GKED C#CC[C@@H](NCc1cc(Cl)ccc1OCc1cccnc1)c1ccccc1 775400949 USFBLESCJVZCLL-JOCHJYFZSA-N 376.887 5.168 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc3c(ccc4ccccc43)o2)c1 776165689 UUFMGBZHHNONOM-YLJYHZDGSA-N 384.479 6.118 30 20 GKED COc1cccc(/C=C\C(=O)c2cc(Br)cs2)c1OC(F)F 782370545 VPPHIPNSLLQXTC-WAYWQWQTSA-N 389.217 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)CC(=O)OCc1ccccc1 789449725 JRCRQQNGSMBIRI-SFHVURJKSA-N 394.515 5.182 30 20 GKED Cc1nc(-c2ccccc2)sc1COC(=O)C[C@@H](CC#N)c1ccccc1 795993082 SKNHCWCSHCKJGK-LJQANCHMSA-N 376.481 5.249 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)[C@@H]3CC[C@@H](C(F)(F)F)C3)cc2)cc1 797097650 ACMAEKIVEVXJEK-HUUCEWRRSA-N 375.346 5.235 30 20 GKED Cc1ccc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1C#N 799295696 WAAFLMBXUYIBQW-UHFFFAOYSA-N 375.409 5.096 30 20 GKED CC(=NNc1ccc(C#N)cc1C(F)(F)F)c1[nH]c(-c2ccccc2)nc1C 799493081 ZJDILJRBLVJCDC-UHFFFAOYSA-N 383.377 5.112 30 20 GKED N#Cc1ccccc1C(=O)/C=C\c1cccc(/C=C\C(=O)c2ccccc2C#N)c1 799499198 SXDPCFYYHQXBLB-DZDAAMPGSA-N 388.426 5.222 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813218533 PZXFRUCCRWDBFQ-OMAIJTBJSA-N 388.389 5.167 30 20 GKED COc1cccc2c1[C@@H](C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 814305922 RHZFHWYMSXEWMR-FCHUYYIVSA-N 382.463 5.019 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915087135 ZZOPNELRUGPALQ-LJQANCHMSA-N 395.384 5.317 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)cc1 915352853 KGMSFZLLOFGNLG-DNQXCXABSA-N 399.469 5.850 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc2ccccc12)c1ccc2ccccc2n1 916848927 KSRSBUKQAAGHCO-OAQYLSRUSA-N 380.447 5.423 30 20 GKED COc1cc([C@H](C)Nc2snc(Cl)c2C#N)ccc1OCCC(C)C 917083571 SZTBQMBBFYSLEX-LBPRGKRZSA-N 379.913 5.275 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cc2sccc2s1 918486779 LIBYZVAOYPVSGJ-VIFPVBQESA-N 395.292 5.231 30 20 GKED Cc1nn(C)c(C)c1C(=O)/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1 920832752 WPVBGOWYQXIGAE-HJWRWDBZSA-N 391.418 5.075 30 20 GKED O=C(O)c1cc(NN=Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 1776062460 VKGWJSMMRGIWIB-UHFFFAOYSA-N 394.246 5.008 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCCCC)c(OC)c1 1776784795 XEQGKXTUDOTKSA-LJQANCHMSA-N 379.541 5.168 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776805962 KCUIYSZDVWVTCU-NVMNQCDNSA-N 384.475 6.291 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3c(F)ccc(C(=O)O)c3F)s2)cc1 1777430618 SCOXJFKOIOJFCL-NTMALXAHSA-N 399.418 5.299 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C/c1ccc(CC(=O)O)cc1 1777487799 VLBKDGRLWMTUBL-IZZDOVSWSA-N 397.883 5.295 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 14738875 MXUZHXGGZYZXEI-UHFFFAOYSA-N 384.479 5.675 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2ccccc2)cs1 25720302 SSIBDCBXHLEAIR-UHFFFAOYSA-N 381.460 5.601 30 20 GKED CC(C)OCc1c(C(=O)[C@@H](C#N)c2nc3ccccc3s2)oc2ccccc12 48823014 YYOGGZYPDVRDAL-OAHLLOKOSA-N 390.464 5.458 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2cccc(O)c2)cs1 54897246 JXIBSCPVBDSPRN-YFHOEESVSA-N 398.871 5.083 30 20 GKED Cc1cc(C(=O)CCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)s1 66856049 ZSRBTZZPKDVUMP-ZDUSSCGKSA-N 386.542 5.361 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc4ccccc4[nH]3)sc2C)cc1 123120785 GEFBNCIHAWDLIO-KRWDZBQOSA-N 387.464 5.099 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](c1cccc(Cl)c1)c1ccccn1 133767215 XJENEGMHGVYIKA-JOCHJYFZSA-N 375.903 5.415 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)cs1 173915942 XIFHLBOELDNSNV-SFHVURJKSA-N 399.475 5.114 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCC2)c(F)c1 175477406 OYVPFBALIWQUSX-UHFFFAOYSA-N 381.451 5.071 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1ccccc1O[C@H](C)C#N 180027850 WJHBXSQEBHEKMV-HIFRSBDPSA-N 386.521 5.091 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](c2cccs2)C2CCCC2)ccc1OC 180809809 HIPHONGLDQPJRA-XMSQKQJNSA-N 384.545 5.459 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1SC[C@H](C)C#N 189962383 SBBAOVQOCFNXBX-MRXNPFEDSA-N 392.528 5.474 30 20 GKED CCN(C(=O)Cc1csc(-c2ccc(C)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 248059727 CWJPSJVVRGZZIA-KRWDZBQOSA-N 389.524 5.142 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)ccc1OCC#N 255894149 ACPUPJNPFVMZNH-KXFIGUGUSA-N 395.764 5.166 30 20 GKED Cc1c(C(=O)/C=C/c2csc(-c3cccs3)n2)cnn1-c1ccc(F)cc1 303211529 RMJHUPIWAICLBQ-RMKNXTFCSA-N 395.484 5.401 30 20 GKED CC(C)(C)c1nnc(C/N=C(/O)N2CCC[C@@H]2c2cccc3ccccc23)s1 329856713 YKLSNCJJNSVMKD-GOSISDBHSA-N 394.544 5.240 30 20 GKED C=CCC1(C(=O)N2CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C2)CCC1 330116032 UTIDXOJIAQGJDG-SFHVURJKSA-N 385.552 5.035 30 20 GKED CC(C)n1cnc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c1 409493999 YEYJRJVCSKTQPG-UHFFFAOYSA-N 380.835 5.034 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)c1cccc(CC#N)c1 432869169 ZDFHYEWZUVTLDB-UHFFFAOYSA-N 388.492 5.306 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 435097557 SNIFSJKKZZVWRZ-GJZGRUSLSA-N 397.466 5.620 30 20 GKED Cc1c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cnn1-c1ccccc1 435780146 BNGHHJJRITUFTB-UHFFFAOYSA-N 393.450 5.048 30 20 GKED C[C@H](SCc1ccc(F)cc1C#N)c1nc(Cc2ccc(Cl)cc2)no1 437268228 LLZKNYDWCXFHMA-LBPRGKRZSA-N 387.867 5.319 30 20 GKED C[C@H]1Cc2ccccc2CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 438040498 JTVUANZPEAAGCX-KRWDZBQOSA-N 383.451 5.329 30 20 GKED C[C@H](N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1(C)CC1 438636472 YWLHQDXKQSRJGH-HNAYVOBHSA-N 381.907 5.648 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)CSc2ccccc2C#N)cc1 439718292 WUWJFXYGJBBJPL-FQEVSTJZSA-N 378.541 5.312 30 20 GKED CCO[C@@H](c1ccccc1)c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 445803399 SNZJNLWGUTWXOP-ZVQQDINOSA-N 398.466 5.234 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(C2CC2)c1 451113860 JWOCLBRPFSUVDG-SJORKVTESA-N 393.556 5.248 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464470648 WPYHECODWKUYAC-CQSZACIVSA-N 382.769 5.031 30 20 GKED CCN(C(=O)N[C@@H](C)c1ccc(C#N)cc1)[C@@H](Cc1ccc(F)cc1)C(C)C 465672013 XQGOIGAIQPOFOO-JTSKRJEESA-N 381.495 5.057 30 20 GKED Cc1nn(-c2ccc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)cc2)c(C)c1Cl 474447194 PURDKROYYZIZJM-INIZCTEOSA-N 398.919 5.213 30 20 GKED N#CC[C@H](CC(=O)Nc1ncc(Cc2ccc(F)cc2F)s1)c1ccccc1 475186595 ZNTTUMQNUVCAAV-OAHLLOKOSA-N 397.450 5.038 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccc(C)o1)N1CCCC1 475547911 PBLUBSTUBJBLTR-NRFANRHFSA-N 395.547 5.399 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccn(C3CCCC3)n2)cc1F 476973280 LVFKAIZNVRLRHU-UHFFFAOYSA-N 390.418 5.054 30 20 GKED C=C(C)[C@H](NCc1csc(-c2ccc(OC)cc2)n1)c1ccc(F)c(F)c1 479405961 FZADMVAILSLCEN-FQEVSTJZSA-N 386.467 5.504 30 20 GKED C=CCn1c(SCc2csc(C(C)(C)C)n2)nnc1-c1cccs1 481379984 VTPNAOICLPHUQG-UHFFFAOYSA-N 376.576 5.239 30 20 GKED CC(C)c1c(NC(=O)CCc2ccc(C#N)cc2)cnn1-c1ccccc1Cl 482685288 BMINJBPLJXTBMZ-UHFFFAOYSA-N 392.890 5.092 30 20 GKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)ccc1NC(=O)CC(C)C 487276403 YHIQUFBKYDTRJN-QFIPXVFZSA-N 391.515 5.145 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)n1 488695885 AONAIAGFNKLJLB-INIZCTEOSA-N 392.528 5.375 30 20 GKED C[C@H](NCc1cc(C#N)ccc1Br)c1cccc(OC(F)(F)F)c1 492764317 BYRBRPLNCVJTGM-NSHDSACASA-N 399.210 5.070 30 20 GKED N#C[C@@H](NC(=O)CCCOc1cccc2ccccc12)c1ccc(Cl)cc1 499810248 IUMJFLDXDSXNQR-HXUWFJFHSA-N 378.859 5.033 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)CCc1ccc(C#N)cc1)C1CC1 502888652 TWCSILUXMYPCAT-HNNXBMFYSA-N 386.417 5.262 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](CCCC)c1ccc(OC)cc1 503793518 HZJJPBVPDCNUSM-HSZRJFAPSA-N 391.515 5.196 30 20 GKED CCN(C(=O)CCc1ccc(-c2ccccc2F)o1)[C@@H](C)c1ccc(C#N)cc1 509562054 UTDXBYAUCOBARM-KRWDZBQOSA-N 390.458 5.500 30 20 GKED Cc1nc2cc(Cl)c(NC(=O)c3sc4ccc(C#N)cc4c3C)cc2s1 511363221 XJRUSYUHUXGTBJ-UHFFFAOYSA-N 397.912 5.905 30 20 GKED COc1cccc(C(N[C@H](C)c2ccc(C#N)cc2F)c2cccc(OC)c2)c1 512626160 SJSNBXHFANLRRH-MRXNPFEDSA-N 390.458 5.155 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1cc(C)sc1C 516833889 ROGSEFALZCMLJM-UHFFFAOYSA-N 389.521 5.153 30 20 GKED Cc1ccc(C(C)C)cc1OCC(=O)Nc1ccccc1SC[C@@H](C)C#N 518139984 KHYURWVTHMNGKS-INIZCTEOSA-N 382.529 5.388 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1 518916606 JCDLBXNCTGDVOT-QFIPXVFZSA-N 383.451 5.031 30 20 GKED CCOc1ccc(OCC)c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 521822278 IIEOHXFLEVZFEC-UHFFFAOYSA-N 395.503 5.046 30 20 GKED Cc1nc(-c2ccc(CNc3c(C#N)cnc4c(F)cc(F)cc34)s2)cs1 522123022 VNNNYKGBLMMFJL-UHFFFAOYSA-N 398.463 5.490 30 20 GKED C[C@@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccc(C#N)cc1 524515368 SWBWTMJWSDFRMF-JLTOFOAXSA-N 393.537 5.100 30 20 GKED COc1ccc2c(c1)[C@@H](N(Cc1ccccc1)Cc1cccc(C#N)c1)CCO2 525121599 VALYBOOHOUSZFK-DEOSSOPVSA-N 384.479 5.093 30 20 GKED C[C@H](N[C@@H]1CCc2c(Br)cc(Cl)cc21)c1ccc(C#N)cc1 534793390 NALMCTRODRXHMI-BBATYDOGSA-N 375.697 5.312 30 20 GKED N#C[C@H](C(=O)c1cccc([C@@H]2CCCOC2)c1)c1nc2cc(Cl)ccc2s1 536587747 ZSWJQQFVNKGRPN-NVXWUHKLSA-N 396.899 5.334 30 20 GKED Cc1cc(C)c(CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c(C)c1 538008360 JIFADGYHNLDURY-UHFFFAOYSA-N 385.467 5.160 30 20 GKED CSc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1C 539339543 GNXUNDUYMAXVMC-UHFFFAOYSA-N 378.453 5.013 30 20 GKED C[C@H](NC1CCN(c2nccs2)CC1)c1ccc(-c2cccc(C#N)c2)cc1 543962828 KWQSNRVRRSNEDY-KRWDZBQOSA-N 388.540 5.001 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1Cl 548607471 BUBAGFGPYSYERO-UHFFFAOYSA-N 390.830 5.108 30 20 GKED COC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 550833491 YMEYLIUUBWIWQH-VQTJNVASSA-N 376.422 5.418 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc2c(c1)OCCCO2 552756559 KHAOBYWOHRHGJQ-GOSISDBHSA-N 384.479 5.237 30 20 GKED CSc1cccc(F)c1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 554444741 QFZKNFIPUTZYMF-CYBMUJFWSA-N 389.521 5.121 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2cccc(Cl)c12)c1cccc(Cl)c1Cl 563289916 YVPLCVCZJGPXBP-OAHLLOKOSA-N 392.673 5.052 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)Cc3cccc(Cl)c3Cl)cc2)ccn1 565747965 WLYGYNVOYCJDRV-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#CC1(CNC(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)CC1 574894748 ZXHUQCPBLFDCJD-UHFFFAOYSA-N 398.875 5.167 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H]1c1cccs1 578513248 PVGPBSDFQNBFEH-HNNXBMFYSA-N 379.407 5.254 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)NCc2ccc(C#N)c(OC)c2)c(C)c1 579412480 QFTBOOZOCBEJBF-HNNXBMFYSA-N 383.517 5.088 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCC23CCC3)cc1Cl 580513109 XLZQLDIAYWEUPI-LJQANCHMSA-N 379.891 5.546 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1csc(-c2ccccc2)n1 588337697 FMSMHTNRQDJHTI-UHFFFAOYSA-N 376.485 5.126 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)sc2c1CCCC2 589191028 AZANWHFDMRSNIO-KGLIPLIRSA-N 390.430 5.260 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CC=CC2)[C@H]1c1ccccc1)c1ccccc1 592024898 GLEXHRPVGIZMPJ-XZOQPEGZSA-N 385.511 5.524 30 20 GKED Cc1ccc(OC2CCCC2)c(-c2ccc(S(=O)(=O)C(C)(C)C#N)cc2)c1 592985714 BMKWZGCMRZOOTN-UHFFFAOYSA-N 383.513 5.059 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc2c1ccn2C(F)F 596981655 PIYKXTNJYMVZGX-FXAWDEMLSA-N 394.425 5.340 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 608996037 QKIHFMTTZNLLRN-GOSISDBHSA-N 385.467 5.618 30 20 GKED CCCCN(C(=O)Nc1cc(C#N)ccc1OC(F)F)[C@@H](C)c1ccc(C)o1 609080231 DXEAMLSRDDARND-AWEZNQCLSA-N 391.418 5.456 30 20 GKED Cc1cc(OCC(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1C(C)C 609377978 NBMBBWSXLZSYEU-MRXNPFEDSA-N 382.529 5.388 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)Nc1ccccc1S[C@@H](C)CC#N 609427784 LBUFPHDCUWJEQP-WMZOPIPTSA-N 394.540 5.538 30 20 GKED CC(C)(C)CN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 609504793 HRMNFBDIZTUSAP-UHFFFAOYSA-N 390.405 5.401 30 20 GKED CC[C@](C)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1nccs1 610048664 DVWPWBCEJJGPAB-QFIPXVFZSA-N 391.496 5.057 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2N2CCCCCC2)cc(OC)c1OC 616211063 MRXVPDDCVBNPIW-UHFFFAOYSA-N 394.515 5.065 30 20 GKED N#CC(CCN1CCC(c2ccccn2)CC1)(c1ccccc1)c1ccccc1 618288434 NTDQACXJWTUVSV-UHFFFAOYSA-N 381.523 5.161 30 20 GKED O=C(Cc1ccc(F)cc1Cl)NC(CCC(F)(F)F)CCC(F)(F)F 619124608 CGWYGASIXWPLQO-UHFFFAOYSA-N 393.730 5.191 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N(CC(F)F)CC1CCC1 622469106 AZTTXOCZCQNPIQ-UHFFFAOYSA-N 389.286 5.232 30 20 GKED COc1ccnc(CN[C@@H](C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1F 656691158 WLUFIBKHSULSPM-VIFPVBQESA-N 396.306 5.118 30 20 GKED FC(F)(F)Oc1ccccc1CN1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 678207803 DRXFKFUTXJJHGP-GHMZBOCLSA-N 395.265 5.148 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCOc2ccc(OCC)cc21 682776910 AJBNPOVMXYOLSX-NRFANRHFSA-N 394.515 5.583 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 726143200 ZWOBHCQZVNNHOY-JOCHJYFZSA-N 393.446 5.558 30 20 GKED N#CCOc1ccc(COC(=O)c2ccccc2N=Nc2ccc(O)cc2)cc1 733406980 NODVMESCTAHBEA-UHFFFAOYSA-N 387.395 5.067 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(-c3cccs3)c2)c1 733843861 BOHGXMDOGDCQDW-LJQANCHMSA-N 391.496 5.418 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Br)s2)c(OC(F)F)c1 734097156 ZQXGFENQSAVSNT-HYXAFXHYSA-N 389.217 5.017 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)OC(=O)/C=C/c1ccccc1C#N 739592755 XPHYKGSHOADPAN-UJGDBWEASA-N 388.492 5.232 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3cccc(F)c3)CC2)cc1 740435584 RFUXAMFSXLBGNJ-QHCPKHFHSA-N 399.469 5.334 30 20 GKED O=C1/C(=C/c2cnc(-c3ccccc3)nc2)CCc2cc(SC(F)F)ccc21 750915045 BWAIVOZCTWLOQW-LICLKQGHSA-N 394.446 5.671 30 20 GKED C#Cc1ccc(C(=O)Nc2c(Oc3ccc(Cl)cc3)ccc3ncccc23)cn1 764534428 XWARDDAEQUEHKN-UHFFFAOYSA-N 399.837 5.309 30 20 GKED CC(C)C[C@@H]1OCCC[C@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775486646 DBPIQYRPTUYSCQ-ZRBLBEILSA-N 391.515 5.057 30 20 GKED C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)Nc1ccccc1O[C@@H](C)C#N 780667651 KLBJYZMHSSQGNG-STQMWFEESA-N 392.286 5.037 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C(F)(F)F)cnc1Cl 789887397 DBPWNNLGGDYKQB-UHFFFAOYSA-N 382.813 5.858 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nc2ccccc2n1C(F)F 795981819 FHSSUPCRXQXMFD-HOCLYGCPSA-N 383.398 5.123 30 20 GKED CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1cnn(-c2ccccc2)c1C 818235978 YHRCPVZWUOBZCL-UHFFFAOYSA-N 394.693 5.372 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1)c1ccccc1 819475133 HBWKYCMAGIITEV-FPOVZHCZSA-N 387.527 5.122 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2nc(-c3ccccc3)cs2)cc1 915863164 UKMGOYUVZDRSHY-OAQYLSRUSA-N 395.487 5.718 30 20 GKED Cc1ncsc1C(=O)/C=C\c1csc(-c2cccc(Br)c2)n1 915987481 FFHUXVOUGXQYPH-WAYWQWQTSA-N 391.315 5.234 30 20 GKED Cc1cc(C)cc(NC(=S)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 916001032 ZICJLNOSJFULLP-UHFFFAOYSA-N 387.508 5.563 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cc1cc(=O)oc2cc(O)c(Cl)cc12 916576310 QRNLDTREKBJZHC-UHFFFAOYSA-N 396.295 5.055 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)[C@H](C#N)c5nc(C)cs5)(C4)C2)C3)cc1 916844230 YRVZHKBEOAEVDV-WBJPEYBSSA-N 390.552 5.474 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2CSc2nc(C)cs2)c1 919837960 SNSDEXMZVFURPX-UHFFFAOYSA-N 396.537 5.561 30 20 GKED C=CCCCN(CC)C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 929891369 LHWZZEOUFRXVOT-UHFFFAOYSA-N 375.856 5.005 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(C)=NNc2ccccc2C(=O)O)cc1 1776030011 CQONSFHUUOGCCK-GOSISDBHSA-N 382.504 5.816 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2cc(Br)cc(C(=O)O)c2)s1 1776339848 HBFZSFDXLOMCLM-HWKANZROSA-N 393.302 5.303 30 20 GKED CCCCCCOc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776788953 KJXHTIKKCGCEMQ-CAPFRKAQSA-N 392.495 5.947 30 20 GKED CCCCCCOc1cccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)c1 1776790355 QSYXDIDUTXSJDK-HMMYKYKNSA-N 392.495 5.947 30 20 GKED CCCCCOc1cc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)ccc1OC 1776793101 KTJNNCROAUWJHP-FOWTUZBSSA-N 398.455 5.076 30 20 GKED COc1ccc(/C=C2\CCc3cc(SC)ccc3C2=O)c2cc(C(=O)O)oc12 1777360280 QQCLQBGOVXCVOM-NTEUORMPSA-N 394.448 5.074 30 20 GKED O=C(O)c1ccc2scc(/C=C3/CSc4cc(F)c(F)cc4C3=O)c2c1 1777685671 TUWBIRXGBOPWFB-JYOAFUTRSA-N 388.416 5.250 30 20 GKED CSc1ccc(NC(=O)[C@H](C)Oc2ccc(-c3ccc(C#N)cc3)cc2)cc1 21372867 UOLXPIKSQLWMJO-INIZCTEOSA-N 388.492 5.353 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccccc2)nc1C)c1nc2c(s1)CCCC2 24472788 QSOIIEYBMBOPTM-UHFFFAOYSA-N 389.524 5.225 30 20 GKED CCCCOc1c(Cl)cc(C(=O)[C@H](C#N)c2nc(C)cs2)cc1OCC 41520995 ZEGYBVGHEDBRQE-AWEZNQCLSA-N 392.908 5.173 30 20 GKED N#C[C@@H](C(=O)c1ccccc1COc1ccccc1)c1ccc(C(F)(F)F)cn1 41553025 IGOGPYKRAMONIH-LJQANCHMSA-N 396.368 5.169 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(C)n(C(C)(C)C)n1 56470352 DGNFXVQEVWKWRI-UHFFFAOYSA-N 388.471 5.171 30 20 GKED C=CCN(C(=O)c1ccc(SCc2cn3ccccc3n2)cc1)c1ccccc1 58642466 DKZNWPFDNVFXID-UHFFFAOYSA-N 399.519 5.459 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(C)c([N+](=O)[O-])c2)ccc1SC(F)F 63874732 NYMXDUJTJLKTEC-FNORWQNLSA-N 379.384 5.123 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCCOCc2ccccc2)cc1 64934952 CJVCLUKNDSMXKE-UHFFFAOYSA-N 386.451 5.286 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1sc(-c2ccccc2)nc1C 67101520 SHSXOVAEZZRPJO-UHFFFAOYSA-N 383.542 5.078 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CC2(Cl)Cl)cc1Cl 97404280 LKEMMRFJQGIPDJ-LSDHHAIUSA-N 379.674 5.128 30 20 GKED N#C[C@@H](C(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1)c1ccccn1 106983692 COQFENGDIVLXPH-IERDGZPVSA-N 396.874 5.584 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1ccccc1F 111180675 WYXIMOIBLWIQAK-HNNXBMFYSA-N 393.468 5.159 30 20 GKED CCCc1sc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1CC 128857661 RBJSYLQKZVSYBM-HNNXBMFYSA-N 381.526 5.272 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nc(-c2ccc(F)c(F)c2)no1 131707942 CYDRUGKMXYXOEO-GFCCVEGCSA-N 386.427 5.021 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1cn(C)c2ccccc12 150921624 KFCQCQJVANZFRN-MRXNPFEDSA-N 377.513 5.001 30 20 GKED C[C@H](Sc1cc(C#N)ccn1)c1nnc(-c2ccc(Cl)cc2Cl)o1 155512986 OBNSFEATCKONGV-VIFPVBQESA-N 377.256 5.163 30 20 GKED N#CCOc1cc(F)ccc1NCc1coc(-c2ccc(C(F)(F)F)cc2)n1 159625032 GQPIHCCFJURRML-UHFFFAOYSA-N 391.324 5.014 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1F 170673841 VWCPWBUAFZSVAC-RDTXWAMCSA-N 389.455 5.191 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(Cc2ccccc2)CC1 176942611 FAXVBKPLLWWXIP-UHFFFAOYSA-N 383.451 5.015 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccc(OCC#N)cc3)s2)cc1 180551409 PBUHZQBCBAPYOG-MRXNPFEDSA-N 377.513 5.180 30 20 GKED COc1cc([C@@H](C)N[C@@H](CCC#N)c2ccccc2)ccc1SC(F)F 181575836 UVVNRLQTARFDEG-PBHICJAKSA-N 376.472 5.706 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(Br)c(F)cc3Cl)cc2)CC1 181694659 XMPXIXNVYBXNLO-UHFFFAOYSA-N 393.643 5.049 30 20 GKED C=C(C)[C@H](NCC(=O)Nc1c(Cl)cccc1Cl)c1ccc(F)c(F)c1 187760544 DCVUMKPHINUQKR-KRWDZBQOSA-N 385.241 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccc(F)cc2)CC1 191415038 OGDSUFXNSQIFHE-UHFFFAOYSA-N 381.495 5.032 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2cc(F)ccc2s1 193599190 HTTSQXQKRZYBIS-HNNXBMFYSA-N 376.412 5.036 30 20 GKED Cc1[nH]c2ccccc2c1C1=CCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1 194215236 VYASQIZHPDWDQF-UHFFFAOYSA-N 398.510 5.599 30 20 GKED COc1cc([C@H](C)NCc2ccc(O[C@H](C)C#N)cc2)ccc1OC1CCCC1 237277371 NSDGJJMSOKPHHT-MSOLQXFVSA-N 394.515 5.158 30 20 GKED C[C@@H](Nc1ccc2cc(C#N)ccc2n1)c1cccc(NC(=O)c2ccccc2)c1 301992299 YTDOUJBGFNLXSV-QGZVFWFLSA-N 392.462 5.532 30 20 GKED N#C[C@@H](NC(=O)c1coc2ccccc12)c1ccc(OCc2ccccc2)cc1 303579428 MIXPYGXKADMYQY-JOCHJYFZSA-N 382.419 5.006 30 20 GKED Cc1csc([C@H](/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)C2CC2)n1 329414863 CRDQONXMVZIJNZ-PKOBYXMFSA-N 398.576 5.366 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)c1 410292002 ZYITYVXQWUKKLI-MRXNPFEDSA-N 394.858 5.114 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3ccc(C(C)(F)F)nc3)c(C#N)c2[C@H](C)C1 411024522 ZMPVTLLHMQOVLG-GHMZBOCLSA-N 375.444 5.065 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c(Cl)c1 427278922 DOHLUASLGWIDOU-UHFFFAOYSA-N 378.884 5.600 30 20 GKED CC(C)C[C@@H](C)N(C(=O)c1cccc(SCC#N)c1)c1ccc2[nH]ccc2c1 429796306 OIFOVXSQFQXVOW-QGZVFWFLSA-N 391.540 5.865 30 20 GKED Cc1cc(C(F)(F)F)ccc1CNC(=O)N[C@H](CCCC#N)c1ccccc1 431899396 QHRVHLKGPVEDPT-LJQANCHMSA-N 389.421 5.248 30 20 GKED N#CCc1ccc(NC(=O)N(Cc2cccc3ccccc23)C2CCCC2)cc1 437621328 DXTAJQDOOWFTMC-UHFFFAOYSA-N 383.495 5.883 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2CCc2ccccc2)cc1C(F)(F)F 438641919 OKXRHKCCDKTOKN-SFHVURJKSA-N 387.405 5.206 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccc(Cl)cc3-c3ccccc3)o2)cc1 442876320 VCZOEYUHCPQJPV-UHFFFAOYSA-N 386.842 5.541 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN2CCCC(C)(C)[C@H]2C#N)on1 444722342 HNMAKBANCVFUPA-OAQYLSRUSA-N 375.472 5.018 30 20 GKED COc1ccc([C@H](N[C@H]2CC[C@@H](CC#N)C2)c2ccccc2Cl)cc1OC 453288298 GRPIWVKWMCJZFO-YHEJKZAPSA-N 384.907 5.119 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CCC1(F)F 455936644 CNLICDMFUFNVKG-CQSZACIVSA-N 387.455 5.218 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CC[C@@H]1CCCCO1 460166956 VADPXTKTAUBCHH-FQEVSTJZSA-N 382.891 5.094 30 20 GKED CN(CC(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 465255646 JUQHQXLCHQHKOO-UHFFFAOYSA-N 396.303 5.089 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1csc(Cl)c1 466987920 BVKLZWQZEBTKCO-UHFFFAOYSA-N 390.839 5.678 30 20 GKED Cc1c([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)oc2ccccc12 468908479 IABCOUUJIOMJRV-QGZVFWFLSA-N 387.483 5.497 30 20 GKED C[C@H](NC(=O)NCC[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 470468820 UKVQUYNEUPPPJP-CABCVRRESA-N 389.421 5.131 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Br)cc1Cl 475116420 FLBOZTDBGRJHSN-CQSZACIVSA-N 391.696 5.153 30 20 GKED N#Cc1cccc(OCCCSCC(=O)Nc2cccc(Cl)c2Cl)c1 477346064 CNCUVIIHBBNMIA-UHFFFAOYSA-N 395.311 5.006 30 20 GKED C=CCn1c(SCc2ncc(-c3cccc(F)c3)o2)nnc1-c1cccs1 481389981 JZHCAPVKAWQDJQ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CC3(CCCC3)Oc3ccccc32)cc1 483028317 WGCCNRSMPAXMRG-HXUWFJFHSA-N 389.499 5.446 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)c1C(C)C 483792585 MMYCYWLPYOWUFT-UHFFFAOYSA-N 393.413 5.341 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cc1 486097728 QQGWYTJJTWMGBW-ZRBLBEILSA-N 387.527 5.678 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1)c1ccccc1 487386334 GQTYTMMEUPJZHY-QGZVFWFLSA-N 385.389 5.352 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N(Cc2ccc(C#N)cc2)C2CC2)C1 499268731 BCTIZHVVLZITSL-XXBNENTESA-N 382.548 5.205 30 20 GKED CC(C)CN(C(=O)CCCCc1nc2ccccc2s1)c1ccc(C#N)cc1 499326744 ITKVDLSNBLBUEL-UHFFFAOYSA-N 391.540 5.570 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(F)cc1 502557348 CIVRBCLYFXCAPX-AOMKIAJQSA-N 399.535 5.003 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2cc(Cl)ccc12)c1cccc(Cl)c1Cl 505307446 FMWHCDHFSRFCAA-INIZCTEOSA-N 392.673 5.052 30 20 GKED N#C[C@H](NC(=O)c1cccc(C(F)(F)F)c1F)c1cccc(Cl)c1Cl 505342229 GKBQDVRATCCFRP-LBPRGKRZSA-N 391.151 5.146 30 20 GKED N#C[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1ccc(Cl)c(Cl)c1 505955451 WUSZMVWQWCPLTD-KRWDZBQOSA-N 392.673 5.052 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 518682279 YPOHGYVLRCDGRR-INIZCTEOSA-N 385.508 5.520 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)on1 518742935 DJLZDZUMNAPNFG-CYBMUJFWSA-N 397.887 5.642 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(Oc2ccccc2)c1 520477969 RMIWAKRAFUJEBB-UHFFFAOYSA-N 385.467 5.793 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3cccc(C(F)(F)F)c3)c2)c1 520479825 BKEYJBFDDHLEDO-UHFFFAOYSA-N 396.412 5.446 30 20 GKED CC(C)Oc1ccc(Cl)cc1C(=O)Nc1ccccc1SC[C@H](C)C#N 520835182 AHXBKVOYAHVEKJ-CQSZACIVSA-N 388.920 5.631 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@H](C#N)c3nc4cccc(C)c4[nH]3)c2)c1 522831002 BMGBPGAYBCAZQS-NRFANRHFSA-N 395.462 5.249 30 20 GKED Cc1cnc([C@H](NCc2cccc(OCc3ccccc3C#N)c2)C2CC2)s1 525196049 TZZGSUXOHFGIBV-JOCHJYFZSA-N 389.524 5.143 30 20 GKED CCCc1c(NC(=O)Nc2cc(F)ccc2Cl)cnn1-c1cccc(C#N)c1 527127129 XKKZPGAQDSAQOV-UHFFFAOYSA-N 397.841 5.133 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(Cl)cc2cccnc12 530980890 DJXDDUOSSLQOOD-UYAOXDASSA-N 390.874 5.192 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(O[C@H](C)c3ccccc3)nc2)n1 531091618 KDKFCNRRCRBSMP-CRAIPNDOSA-N 391.496 5.292 30 20 GKED COc1ccc(CNc2cc(C)c(C)c3ncccc23)cc1OCCCC#N 532895463 NQBLDPATTAUCNR-UHFFFAOYSA-N 375.472 5.155 30 20 GKED Cc1cc([C@H](NC(=O)Nc2ccccc2SC[C@@H](C)C#N)C2CC2)ccc1F 534036601 RCXLORBNFLASBN-LHSJRXKWSA-N 397.519 5.659 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 534749513 UBSRTKUJBUWVGT-UHFFFAOYSA-N 388.471 5.212 30 20 GKED C[C@@H](NCc1ccccc1CN(C)C1CCCCC1)c1ccc(C#N)c(F)c1 540707032 MHGDBCLAZGRACH-GOSISDBHSA-N 379.523 5.313 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541156568 JPHXKDALENVQEJ-KOSHJBKYSA-N 398.510 5.474 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(NC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 543776919 HMXFEZLPGDTTJE-BTYIYWSLSA-N 390.449 6.022 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CC=C(c3ccccc3C(F)(F)F)CC2)c1 552094142 NMTZRAVCHAPWJY-UHFFFAOYSA-N 390.792 5.160 30 20 GKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 552871596 QQOLZBAGNFGBPZ-FXAWDEMLSA-N 377.488 5.241 30 20 GKED CC(C)(C)[S@@](=O)Cc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 565569194 WAOMEGRQMLNLNG-MHZLTWQESA-N 394.462 5.236 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1nc3c(s1)C[C@H](c1ccccc1)CC3)CC2 569009965 IJKFTLALIKXFQM-CTNGQTDRSA-N 385.536 5.064 30 20 GKED N#CC1(CCCSCc2cc(Br)cc(F)c2F)CCOCC1 574758701 BETLQZWRFRCQBH-UHFFFAOYSA-N 390.293 5.061 30 20 GKED CCCCOc1ccc([C@H](C)NCc2ccc(C3(C#N)CC3)cc2)cc1OC 594920828 AUQWSBFRVAXJJF-SFHVURJKSA-N 378.516 5.280 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N3CC[C@](C)(C#N)C3)cc2Cl)n1 596715702 LDTDMKBKXWPTDQ-QGZVFWFLSA-N 392.937 5.024 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)cc1 603656259 BTAGNJFTHKYRQZ-FQEVSTJZSA-N 393.487 5.599 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccs3)cn2)c1 603692348 IEFRLRCZVUISEL-GOSISDBHSA-N 390.468 5.176 30 20 GKED Cc1ccc(CCC(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)cc1Cl 603747216 UEZQHKHGVIBHEU-UHFFFAOYSA-N 394.824 5.044 30 20 GKED Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccccc1SCc1ccc(C#N)cc1 604333722 LKMPKXFLSVHOLZ-QHCPKHFHSA-N 398.531 5.576 30 20 GKED N#Cc1ccc(CCC(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)cc1 608945333 GPTVPDAGEGWQKR-HXUWFJFHSA-N 386.417 5.263 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(Cc2ccccc2)n1 609376854 KYYXUNDPIXCOPQ-OAHLLOKOSA-N 393.537 5.238 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccccc1 609398415 ZXZJEYAKJUPEAA-IEBWSBKVSA-N 379.529 5.177 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)s1 609988438 JZJQMVAPKLAFKD-HNNXBMFYSA-N 390.512 5.208 30 20 GKED C[C@@H](C(=O)N(Cc1ccco1)c1ccccc1C#N)c1ccccc1C(F)(F)F 610223548 VIXOCQLCJNRKLQ-OAHLLOKOSA-N 398.384 5.507 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 610357946 WOGSWVJFNXFBBX-VBKZILBWSA-N 395.915 5.423 30 20 GKED CC(C)(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1F 619124639 DRHVEOHYADEJBF-UHFFFAOYSA-N 387.339 5.273 30 20 GKED CC[C@@H](C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)cc1 619126618 ITLGOOCBYLOWOI-CQSZACIVSA-N 387.339 5.489 30 20 GKED N#Cc1cc(Cl)c(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c(Cl)c1 619781745 VRXNYRAVOWCMJQ-ZDUSSCGKSA-N 391.220 5.060 30 20 GKED N#Cc1ccc(CNC(=O)N(Cc2ccc3ccccc3c2)C2CC2)cc1Cl 619827647 YWDHIZUPWCFKIM-UHFFFAOYSA-N 389.886 5.239 30 20 GKED C[C@H](C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccco1 648494389 NBEZVRVWQANZQR-VIFPVBQESA-N 383.263 5.311 30 20 GKED Fc1ccccc1-c1nc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cs1 674460265 ORHVINBXIFUGKO-TXEJJXNPSA-N 398.347 5.122 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)csc1Br 681356841 NRKYWWWZCVMMPI-VIFPVBQESA-N 395.278 5.058 30 20 GKED O=C(Nc1cccc(C(F)F)c1Cl)c1cc(F)c(C(F)(F)F)c(F)c1 683217252 VCNMPEXIVFJBRZ-UHFFFAOYSA-N 385.666 5.827 30 20 GKED Clc1ccccc1COc1cccc(C=Nn2cnnc2-c2ccccc2)c1 725856046 KSUMJADVKGOYMP-UHFFFAOYSA-N 388.858 5.060 30 20 GKED O=C(OCC#Cc1ccccc1)c1csc(-c2cccc(C(F)(F)F)c2)n1 726323749 QZGYOMUBDKTMTH-UHFFFAOYSA-N 387.382 5.037 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 726471832 USFBYILVHRZICA-UHFFFAOYSA-N 398.746 5.737 30 20 GKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(N2CCCC2=O)cc1 727264177 NHKSGWXIUHNIPM-ONNFQVAWSA-N 393.792 5.382 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)c1 728483152 MKFVIXNGRHHEFK-UHFFFAOYSA-N 393.442 5.026 30 20 GKED Cc1cccc2c1C/C(=C\c1cn(-c3ccccc3)nc1-c1cccnc1)C2=O 729151384 SAPXZRGDWFDKND-CPNJWEJPSA-N 377.447 5.065 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2ccc(-n3cncn3)c(C)c2)cc1 742433820 AQOSFMDELOPUGI-RIYZIHGNSA-N 395.462 5.147 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2SCCc3sccc32)c1 742658732 CJLQYCDOUCVCFA-HXUWFJFHSA-N 395.574 5.355 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCC(=O)c2ccc3ccccc3c2)n1 747193691 NGVBJBCERAPAJW-GOSISDBHSA-N 376.481 5.259 30 20 GKED COc1ccc2oc([C@@H](C)NCc3cc(Cl)ccc3OCC#N)c(C)c2c1 754739963 WYGQNORYHADTKB-CQSZACIVSA-N 384.863 5.156 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C/c3ccc(Cl)nc3)c2)cc1 759020972 QQVRPJYIQAYUDV-YRNVUSSQSA-N 375.815 5.051 30 20 GKED O=C(/C=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1c[nH]c2ncccc12 761813338 RVRPORWGCAYUFT-BQYQJAHWSA-N 399.397 5.601 30 20 GKED C[C@@H](CSCc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 772971344 LYLPWTXILMWNHL-LPHOPBHVSA-N 392.549 5.556 30 20 GKED N#CC1(NC(=O)/C=C\c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CCCCC1 787728140 CDFVIKMKTJZLQU-PLNGDYQASA-N 390.327 5.080 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc(SCC(F)F)cc1 788356618 ULHROSQGQIPPPH-AATRIKPKSA-N 379.375 5.415 30 20 GKED COCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)sc2cccc(F)c12 792108948 ZSKLQOGJPLYBAH-HNNXBMFYSA-N 390.439 5.225 30 20 GKED C#C[C@@H](NC(=O)c1cnc2ccccc2c1C(F)(F)F)c1ccc(Cl)cc1 794060535 PCKIRHGUJYGFDL-MRXNPFEDSA-N 388.776 5.011 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CSc2ccc3ccccc3c2)s1 797573512 SUXBHWSWMKBWBK-QGZVFWFLSA-N 380.538 5.562 30 20 GKED C#C[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)cc1 810184461 REGFZHXCVXOYGK-WMLDXEAASA-N 383.904 5.088 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1cccnc1C#N)CC(C)(C)O2 811863787 ZNLSSGQJDDZJLZ-KRWDZBQOSA-N 394.475 5.015 30 20 GKED O=C(O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)c1ocnc1C(F)F 860770183 UMTATXYFDAYFIG-SNVBAGLBSA-N 389.198 5.091 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCc1ccc(C(F)F)cc1 870139053 MBCUHXOTKPLMOY-IBGZPJMESA-N 398.453 5.029 30 20 GKED CCC(=O)N(C)c1ccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 878675896 MCSLBIPGYWBNRB-OAHLLOKOSA-N 396.516 5.098 30 20 GKED N#CC1(CCCC[S@](=O)Cc2cc(F)c(C(F)(F)F)cc2F)CCC1 899406641 POGLIJVJPSGZQM-VWLOTQADSA-N 379.394 5.096 30 20 GKED FC(F)(F)C(F)(c1ccc(-c2nc(-c3cccnc3)no2)cc1)C(F)(F)F 904321249 OSRRJKUUVBTFKN-UHFFFAOYSA-N 391.246 5.088 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915084974 CAPYFFAMNCGOJJ-HSZRJFAPSA-N 379.463 5.313 30 20 GKED C[C@@H](CCc1ccccc1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915353469 UKRHIFMCKFYOAK-YADARESESA-N 383.495 5.485 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 915353830 YCAPQEQZAKNXJL-ZEQRLZLVSA-N 383.495 5.861 30 20 GKED O=C(/C=C\c1cccc(OC2CCCC2)c1)c1ccc(N2CCCC2=O)cc1 917519473 PTMRANLQDYQBRG-GDNBJRDFSA-N 375.468 5.031 30 20 GKED CCN(C(=O)/C=C\c1ccccc1OC(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 919862535 MDNAQJQTTVLGGR-LLNWESEBSA-N 388.389 5.080 30 20 GKED Cc1cc(C=NNc2ccc(Cl)c(C(=O)O)c2)c2c(C)ccc(C(C)C)cc1-2 1776033167 HGQPLTIVIBPMLA-UHFFFAOYSA-N 394.902 6.329 30 20 GKED C=CCCCCCCCCNc1c(C(=O)O)cnc2c(OC)cc(OC)cc12 1776207988 VNFDMYQZTLZYCZ-UHFFFAOYSA-N 386.492 5.279 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cn(CC(=O)O)nc2-c2ccccc2)cc1 1776697677 MJXRLDOWGYFMBR-LKBMAGLMSA-N 388.467 5.044 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCC[C@H]2C(C)(C)C(=O)O)cc1 1776787506 IIEUWPHSDLWDQY-IBGZPJMESA-N 391.577 5.465 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4ccc(O)c(C(=O)O)c4)o3)coc12 1777449112 YLBSXAOEMXHSAN-TWGQIWQCSA-N 388.375 5.301 30 20 GKED N#Cc1ccsc1NC(=O)c1oc2ccccc2c1CSC1CCCCC1 14626500 XVZSLOBCNCJPTC-UHFFFAOYSA-N 396.537 6.184 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nc2ccccc2n1C(F)F 41558874 BSOOEHYGLUUJEV-LBPRGKRZSA-N 380.181 5.228 30 20 GKED C=CCn1c(S[C@H](C)CCc2ccccc2)nnc1-c1ccccc1OC 59739866 MAWWIEJCTPYJAR-QGZVFWFLSA-N 379.529 5.253 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)[C@H](C)c1ccco1 102796517 UMAMZZCTXRYKJX-QGZVFWFLSA-N 389.455 5.264 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCCC(=O)c1ccccc1 108463559 UZHKUDQXXIKOQV-KRWDZBQOSA-N 380.513 5.320 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2nc(-c3ccccc3)cs2)cc1 110537174 RYKXDBRVYAEMNH-OUKQBFOZSA-N 391.496 5.236 30 20 GKED C=C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1)c1ccccc1 120017817 WFBSRSHVJUPFNI-OXQOHEQNSA-N 388.492 5.355 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(OC(F)F)cc1)c1nc(-c2ccccc2)cs1 122369940 DBFIZJXLHAJEKQ-KRWDZBQOSA-N 398.434 5.221 30 20 GKED Cc1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)oc2c1C(=O)CCC2 171513726 CTDQUJRGISRDIT-UHFFFAOYSA-N 386.407 5.023 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C 173115567 NFLIKRLQZKSBSP-HRAATJIYSA-N 393.556 5.924 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1 182387580 SIYSYDPONYXSCP-CONOYDDESA-N 395.528 5.529 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1c(C)nc2cc(C)nn2c1C 189904006 IXLHEKKFHYYPTA-UHFFFAOYSA-N 390.531 5.078 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CCCC1)c1nc2ccccc2n1C(F)F 193769195 IAWQPKHSMNXEJE-MRXNPFEDSA-N 397.400 5.259 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)[C@H](c2ccco2)C1 248569812 QILVJKZGZUNCPZ-JZXOWHBKSA-N 383.517 5.536 30 20 GKED Cc1cc(N=Cc2cc(Cl)cc(Cl)c2O)ccc1NC(=O)c1ccco1 254612747 LASBWKNDZQEZPU-UHFFFAOYSA-N 389.238 5.603 30 20 GKED Cc1[nH]c2ccccc2c1C1=CCN(c2nc(C(F)(F)F)ccc2C#N)CC1 301783769 KDPOSSVQHLMSKK-UHFFFAOYSA-N 382.389 5.056 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(F)cc3F)cc2Cl)c1 303193893 MVTUDYBPUMPICN-UHFFFAOYSA-N 398.796 5.321 30 20 GKED O/C(=N/Cc1cnc2ccccc2c1)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329255614 AQIVHCPASXEKMK-FQEVSTJZSA-N 388.515 5.198 30 20 GKED CC1(C)CN(C(O)=Nc2cc3c(cc2Cl)OCCCO3)[C@H]1c1cccs1 329370284 LWAONYFKVWHTRR-KRWDZBQOSA-N 392.908 5.191 30 20 GKED Cc1csc(C(=O)Nc2scc(C(C)(C)C)c2C#N)c1Br 410931359 QNZNXGVIDYJOKC-UHFFFAOYSA-N 383.336 5.302 30 20 GKED Cc1nc(C(C)C)oc1CN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 428370237 OSSNXENIUWCNKF-UHFFFAOYSA-N 377.463 5.320 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 429672771 OYHITXQQUVEKSC-UHFFFAOYSA-N 380.410 5.382 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2csc(CCc3ccccc3)n2)s1 430596609 JRFBESSLIWFESA-HNNXBMFYSA-N 395.553 5.172 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@@H](C#N)C(C)C 430790095 DEXKHCQDZWZRNW-ZDUSSCGKSA-N 380.275 5.050 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 432982765 DAYSELWPMWZLBL-HXUWFJFHSA-N 377.488 5.472 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 435707339 WLICJBDOBUFYJJ-UHFFFAOYSA-N 378.428 5.464 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 438377094 WESMMLZWYFOSCK-RTWAWAEBSA-N 377.488 5.168 30 20 GKED N#Cc1ccc(NC(=O)Nc2cnccc2-c2ccc(C(F)(F)F)cc2)cc1 440801995 QSTOTKIYVSHLJX-UHFFFAOYSA-N 382.345 5.283 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)c(F)c1 445737479 WVVCJZYVTRSZRM-JOCHJYFZSA-N 388.373 5.102 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1cc(Cl)c(NC(=O)c2ccncc2)c(Cl)c1 466859226 NNDISCUIDRZRIZ-LBPRGKRZSA-N 392.286 5.182 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(Br)s1 471283012 MPGZBOGBSNCTRX-SNVBAGLBSA-N 395.347 5.466 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(Oc3ccc(Cl)cc3)c(F)c2)n1 473937379 QBJIZZMMSLQJHA-HNNXBMFYSA-N 386.835 5.526 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 474427129 PVNIKYGBHBLSNB-IBGZPJMESA-N 398.466 5.357 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Cc2cccnc2)CC1 475573121 RGIFPEVUNKDJNF-UHFFFAOYSA-N 377.532 5.420 30 20 GKED C=C(C)[C@@H](NC(=O)Cc1csc(-c2cccs2)n1)c1ccc(F)c(F)c1 475696514 LYPRJRFYMKDRKN-GOSISDBHSA-N 390.480 5.126 30 20 GKED N#CC[C@H](CC(=O)N1CCc2ccccc2[C@H]1c1ccccc1)c1ccccc1 475763222 PQMUBRBFKWUMPH-ZEQKJWHPSA-N 380.491 5.248 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c(F)c(F)cc(F)c3F)c2)cc1 480867679 BTQUQXYOYDPBNX-UHFFFAOYSA-N 386.304 5.159 30 20 GKED C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(Cl)c(C#N)c1 482119499 FTCWALIIBJZVFE-CQSZACIVSA-N 391.858 5.008 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)ccc1OC1CCCC1)c1cnc2ccccc2n1 483208281 XGBROKXXHORILH-KRWDZBQOSA-N 391.858 5.095 30 20 GKED C[C@@H](SCc1ccc(Cl)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 483302035 VSIYPDSRLFYNPO-CQSZACIVSA-N 376.884 5.048 30 20 GKED Cc1cccc2cc(C(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)oc12 488629109 PAIUXCXEDGWMTE-UHFFFAOYSA-N 382.419 5.444 30 20 GKED C=CCN(Cc1cccs1)[C@H](C)C(=O)Nc1ccccc1-c1ccccc1 499054219 IPURUQWBKHTJOO-GOSISDBHSA-N 376.525 5.430 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cnc(-c4ccccc4)s3)n2)c1 501114896 FGCJJHBHGMRITK-UHFFFAOYSA-N 388.477 5.058 30 20 GKED C[C@H](SC(c1ccccc1)c1ccccc1)C(=O)NC1(C#N)CCCCC1 502531538 SPTMDUFEBBOBEU-SFHVURJKSA-N 378.541 5.240 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 502728454 XCBIKAYVEWOYKT-UHFFFAOYSA-N 397.450 5.012 30 20 GKED CC(C)c1cc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)nn1C(C)(C)C 505344167 NWHSCRKMWLTWEW-OAHLLOKOSA-N 393.318 5.063 30 20 GKED C[C@@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(-c2ccc(Cl)cc2)s1 508275992 RSGYCPBBYPDPDL-CQSZACIVSA-N 387.936 5.465 30 20 GKED CC(C)COc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(C)(C#N)CC1 508307246 SDCOWIADDHSOEO-HXUWFJFHSA-N 385.552 5.144 30 20 GKED CN(Cc1ccccc1F)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 512802373 LXSFNYRTGUIJHE-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(-c2nc(C)cs2)cc1 513964197 DLCWJDQUEVNZRP-UHFFFAOYSA-N 377.513 5.381 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 514898804 JRUILMGTKKNYFV-GFCCVEGCSA-N 393.537 5.429 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1ccc(Cl)cc1Cl 519413124 CKRJOXMWRUVMPO-LBPRGKRZSA-N 395.311 5.263 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1c(Cl)cccc1Cl 520923696 ZSSQUFYWVNNNMM-GFCCVEGCSA-N 379.312 5.569 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cccc(Nc3ccccc3)c2)cc1 522819321 JHXOWLBYVAXVBP-UHFFFAOYSA-N 385.467 5.389 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1ccc(C#N)cc1 532794516 FDMLCMZEFSPLEG-UHFFFAOYSA-N 377.831 5.066 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc([C@@H]4CCOC4)c3)cc2)c1 536417118 GXJVJXRYTXLUJG-HXUWFJFHSA-N 384.435 5.107 30 20 GKED CC(C)CN(C(=O)c1coc(-c2ccccc2Cl)n1)c1ccc(C#N)cc1 537363753 RFVMREZTRJEGGS-UHFFFAOYSA-N 379.847 5.169 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)C2)cc1 541447412 YIUKUUVVDPXPJF-PKOBYXMFSA-N 379.529 5.268 30 20 GKED Cc1cccn2c(NC(=O)c3ccc(Cl)c(C#N)c3)c(-c3ccccc3)nc12 542509993 DNWGIFWKHJXGIJ-UHFFFAOYSA-N 386.842 5.087 30 20 GKED CCC(C)(C)OCc1ccccc1N[C@@H](C)C(=O)N(CCC#N)c1ccccc1 542519881 UFUCFBDCLVOSMY-IBGZPJMESA-N 393.531 5.139 30 20 GKED CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543943124 FFLFBCPGYDWTCK-KRWDZBQOSA-N 389.524 5.579 30 20 GKED N#Cc1ccc2ncc(CNC3(c4cccc(C(F)(F)F)c4)CCCCC3)n2c1 551806467 RXZIBGALZBZPLK-UHFFFAOYSA-N 398.432 5.174 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)c1 557043647 BZZBPUBITCZKEJ-CQSZACIVSA-N 391.151 5.038 30 20 GKED C[C@@H]1CCC[C@](C#N)(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 558121990 IQWDYVXDNCXXRA-QRQCRPRQSA-N 393.874 5.206 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@H](C)NC1(c2ccc(C#N)cc2)CCC1 594514578 IRBXEAWTARJISZ-SFHVURJKSA-N 375.516 5.068 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 596693689 BBRAQUAGLGAMGJ-HXUWFJFHSA-N 389.499 5.152 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3cscc3C(F)(F)F)c(C#N)c2[C@@H]1C 598839445 RITORFLKFQQSCQ-RKDXNWHRSA-N 384.448 5.638 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])s3)cc2Cl)cc1 604027027 WPUUJZUQGBEUNO-UHFFFAOYSA-N 399.815 5.226 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccccc2Cl)s1 604517386 HCYHHOHNNKEYIC-UHFFFAOYSA-N 395.915 5.388 30 20 GKED CC(=O)c1cccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)c1 604842323 FTEDUKBFRZYZPO-UHFFFAOYSA-N 390.826 5.459 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(CNc2ccc(CC#N)cc2)cs1 608923585 JUGRYTNQNQILRD-UHFFFAOYSA-N 396.903 5.159 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(Cl)c3ncccc23)c1 609600671 SGHNKPGYXUFOGR-UHFFFAOYSA-N 380.835 5.215 30 20 GKED Cc1ccc2cccc(C(=O)Nc3sc4c(c3C#N)-c3ccccc3CC4)c2n1 610152445 YRQYLWIQCYMOOB-UHFFFAOYSA-N 395.487 5.494 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 611210615 SRVAETRFIRARKF-QUCCMNQESA-N 377.875 5.042 30 20 GKED CC(C)(c1ccc(NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)cc1)C(F)(F)F 618766932 XPNNFZUMWHHGRG-GOSISDBHSA-N 387.405 5.207 30 20 GKED C=CCCO[C@@H](C)C(=O)N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 620574658 GERDMPXWMMOPCN-IFXJQAMLSA-N 378.299 5.180 30 20 GKED FC(F)(F)C1CCC(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CC1 681007565 QFRFBBJWOZCDMY-QQFIATSDSA-N 399.341 5.854 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@@H](C)c1cccs1 726477997 CTUSEVBYOMBHJM-HNNXBMFYSA-N 393.537 5.768 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](c2ccc(C)cc2)c2ccc(OC)cc2)c1 726479258 XVRCVRDULFZBEI-HSZRJFAPSA-N 386.520 5.061 30 20 GKED CC(C)Oc1ccccc1C=NOCc1nc(-c2ccc(C(C)C)cc2)no1 727470114 BLQZKROLWRTDSX-UHFFFAOYSA-N 379.460 5.198 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)/C=C\c1ccccc1O[C@@H](C)CC 729827610 QAZWIUOAMWISDI-BDEQVGPYSA-N 399.494 5.013 30 20 GKED COc1cc(C)c(C(=O)/C=C/c2csc(-c3ccc(F)cc3)n2)cc1OC 731318800 KYDAQPHAXRPUMM-CMDGGOBGSA-N 383.444 5.171 30 20 GKED CC[C@@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)cc1)c1cccs1 734375560 REIMWUXFLPRYSE-GOSISDBHSA-N 393.537 5.850 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)cc(Cl)c1OC 734979312 BSVBOAFBJLXXNH-BAQGIRSFSA-N 384.831 5.568 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2cccc(Cl)c2Cl)cc1OC 734980823 LKRNOHWADSLCIW-HJWRWDBZSA-N 381.255 5.305 30 20 GKED C[C@H](OC(=O)CCCCOc1cccc(C#N)c1)c1ncc(-c2ccccc2)o1 741319982 ORNTUUIHXOMBJE-KRWDZBQOSA-N 390.439 5.067 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)NCc1cc(C#N)ccc1F 743677974 YTEULJXLRMWJSB-SFHVURJKSA-N 387.458 5.170 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@]3(C)CCc4ccccc4C3)n2)cc1 744034350 GXUMKGMPPBJQLZ-YKSBVNFPSA-N 386.520 5.490 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3cc(F)ccc3F)n2)cc1 744034370 HGJFRQNTGHJAGP-CGTJXYLNSA-N 394.446 5.377 30 20 GKED CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 748942403 PJVHBIFZXUGVBG-BDTNDASRSA-N 393.556 5.528 30 20 GKED CCc1ccc(C(C)(C)C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 750691024 WEWFZFZMMLKSRN-INIZCTEOSA-N 381.426 5.148 30 20 GKED N#CCCN(C(=O)CNc1ccc(SC(F)F)cc1)c1cccc(Cl)c1 753310734 YOSVDPZISQJIGE-UHFFFAOYSA-N 395.862 5.013 30 20 GKED C=C(C)COc1cc(CN[C@@H]2CC3(CCC3)Oc3ccccc32)ccc1OC 757704721 INGIYBFCRIYJJZ-HXUWFJFHSA-N 379.500 5.186 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)c1 772983183 GQFAIMBUBAJTLS-LPHOPBHVSA-N 377.513 5.342 30 20 GKED C#CCCCCC(=O)N(CC)[C@@H]1CCSc2ccc(Br)cc21 773335489 ZXPNPXGXTFMVTF-MRXNPFEDSA-N 380.351 5.028 30 20 GKED CCCN(C[C@@H]1CCCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775487524 JJPCZLKBYDWDIM-XZOQPEGZSA-N 391.515 5.155 30 20 GKED Cc1c(C(=O)/C=C/c2nc(-c3cc(Cl)ccc3Cl)cs2)cnn1C 778518583 WZODCUJJGJPFER-AATRIKPKSA-N 378.284 5.055 30 20 GKED C=CCC[C@H](C(=O)O[C@@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 778554040 ZJFLNTJGKGNVNO-PXNSSMCTSA-N 376.456 5.015 30 20 GKED CC(C)c1ccc(CN(C(=O)Nc2ccccc2O[C@H](C)C#N)C2CC2)cc1 780669011 GLRDIHMVENRWSF-QGZVFWFLSA-N 377.488 5.297 30 20 GKED C#Cc1cccc(N(C(=O)c2cc3ccccc3n2CC(F)(F)F)C(C)C)c1 783245592 CLGCJTAHWZDGDZ-UHFFFAOYSA-N 384.401 5.240 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1c[nH]c2ccccc12 786318886 LPROHKXDXLARKG-QAPCUYQASA-N 385.492 5.661 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2nccc3ccccc23)cc1 792107044 UEPYJNIJUBQWSN-NRFANRHFSA-N 384.479 5.409 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1cnc2ccccc2n1)c1ccc(-c2ccccc2)cc1 792115514 ZKBWMEPLNHYMJZ-NRFANRHFSA-N 391.474 5.451 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(C(=O)N(C)C)cc2)c(C)n1C1CCCCC1 792924660 OEEXBGXMHIHKHV-PFONDFGASA-N 378.516 5.208 30 20 GKED Cc1csc(Nc2cccc(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2)n1 793166234 BBDPFFXTTKXDHJ-UHFFFAOYSA-N 376.485 5.249 30 20 GKED N#CC[C@H](CC(=O)OCc1nc(-c2ccccc2Cl)cs1)c1ccccc1 795991738 OTUBDBAOZCBQTK-MRXNPFEDSA-N 396.899 5.594 30 20 GKED COc1cc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)ccc1C#N 799494703 JKZSKBFEIZSSTJ-LZYBPNLTSA-N 399.219 5.254 30 20 GKED Cc1nc(C(F)(F)F)c(CNc2ccc(OCC(F)(F)F)c(F)c2)s1 799968543 OHFQCNJEPLDHOP-UHFFFAOYSA-N 388.308 5.163 30 20 GKED N#CC1(CSc2nnc(-c3ccccc3F)n2Cc2ccccc2)CCCC1 806580170 FVUVGABMRVVNHU-UHFFFAOYSA-N 392.503 5.309 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2c(Cl)cccc2Cl)C2CC2)cc1 810160361 DSDCTULZWRBHOH-ZUOKHONESA-N 375.299 5.525 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(Cl)cc1 810184400 QCUDYIXVLCTHED-PBHICJAKSA-N 383.904 5.230 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c1 817325251 ZYRMRWQAMKZXBF-HXUWFJFHSA-N 393.487 5.199 30 20 GKED Cc1cc(NC(=O)N[C@@H](C)c2cccc(C#N)c2)ccc1NC(=O)OC(C)(C)C 825967579 INTABBAQBNNWBI-HNNXBMFYSA-N 394.475 5.096 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ccc(Cl)nc3Cl)c2C#N)[C@H](C)C1 839388251 JURJPHDNPRVLBJ-DTWKUNHWSA-N 380.300 5.260 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 855930240 KKFJJFVZFZBBIY-LLVKDONJSA-N 387.339 5.174 30 20 GKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cc(F)c(Br)cc1F 858376936 SYJVRSHPEIOENW-NEPJUHHUSA-N 395.247 5.041 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(OC(F)F)c(Cl)c2)c1 863996878 KQVZIQVCAZNRPO-UHFFFAOYSA-N 387.611 5.188 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1cccc(C#N)c1 864010644 HXDKPSGCHFAJOM-INIZCTEOSA-N 387.870 5.835 30 20 GKED Cc1ccccc1OCCCC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 915102134 NLMOMNRXCKMRMF-GOSISDBHSA-N 376.481 5.154 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C)Cc2csc3ccccc23)cc1OC 915630395 FRHPJZZODOGZLP-BENRWUELSA-N 393.508 5.147 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)Cc2coc3cc(C)c(C(C)C)cc23)c1 916898092 TVIPFKFYHFWSPD-OAQYLSRUSA-N 388.467 5.063 30 20 GKED N#C[C@@H](C(=O)Nc1ccc(F)c(Cl)c1)C(=O)c1ccc(-c2ccccc2)cc1 916936691 SXCAGSVQOCUGCQ-GOSISDBHSA-N 392.817 5.107 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCOc3ccccc3F)n2)cc1 918488508 AGHHCASVSJRQJE-QGZVFWFLSA-N 394.471 5.293 30 20 GKED Cc1cccc(OC[C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 919773604 TYDFQSCUJNTUFO-CYFREDJKSA-N 399.494 5.240 30 20 GKED C[C@@H]1CCCC[C@H]1CC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 920790059 NJVHMRFLTLMLBE-HBFSDRIKSA-N 390.483 5.343 30 20 GKED Cc1cc(NN=Cc2csc3ccc(C(=O)O)cc23)nc2ccc(Cl)cc12 1776021564 OHHYUZPCLXOJSE-UHFFFAOYSA-N 395.871 5.556 30 20 GKED O=C(O)/C=C/c1ccc(/C=C/C(=O)c2ccc(OCc3ccccc3)cc2)cc1 1776127044 GJDGWJHNSFZNPP-OTYYAQKOSA-N 384.431 5.260 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(Cl)ccc1Cl 1776354831 ZEPWWECNNFDEOI-XVNBXDOJSA-N 379.239 5.375 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1)C(=O)O 1776469867 WSRRDLBCBAJFBH-MCRQLQJRSA-N 396.439 5.302 30 20 GKED CC1(C)/C(=C\c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)C(=O)c2ccccc21 1776515377 ZFOBRKILCLXZRT-FOOJEKODSA-N 398.458 5.449 30 20 GKED N#Cc1ccc(-c2ccc(OCC(=O)Nc3ccc(F)cc3Cl)cc2)cc1 6409264 FOWDKVHLNMKQOR-UHFFFAOYSA-N 380.806 5.035 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3)o2)nnc1-c1ccc(F)cc1 22583663 MDFJMNNETPAPPZ-UHFFFAOYSA-N 392.459 5.218 30 20 GKED CCN/C(S)=C(\C(=O)c1cc(C)ccc1C)[n+]1ccc(C(CC)CC)cc1 22686678 YPHHYRAEHRXITC-UHFFFAOYSA-O 383.581 5.043 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc4c(F)cccc4s3)s2)cc1 22865704 JASVAMZENLFVRJ-UHFFFAOYSA-N 393.468 5.212 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1nc2ccccc2o1 41544973 MFWSZFCPIKJTSR-XMSQKQJNSA-N 384.460 5.538 30 20 GKED N#C[C@H](C(=O)CCCOc1ccc(Cl)cc1Cl)c1nc2ccccc2o1 41546213 LSAGHOOIUABOJQ-CYBMUJFWSA-N 389.238 5.170 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccc(C#N)cc1 45218902 YCKRVNIVJJMTPR-QGZVFWFLSA-N 397.503 5.213 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)/C(O)=N/c1nnc(-c2ccsc2)s1 52496490 ZVCUCEFKVIHONY-NSHDSACASA-N 384.486 5.251 30 20 GKED C=CCN(C(=O)Cc1cccc(OC(C)C)c1)c1nc(-c2ccccc2)cs1 66015184 IALGUDODBHBPKM-UHFFFAOYSA-N 392.524 5.359 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 66801602 IDOJMMCQKBNZTM-GOEBONIOSA-N 392.446 5.756 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c1 72087102 ZJFZQTMLEFMCGI-KRWDZBQOSA-N 386.451 5.097 30 20 GKED CC(C)[C@@H](Oc1ccccc1C#N)C(=O)Nc1cccc(C2SCCS2)c1 108658301 VMQYVYODSOTSFF-LJQANCHMSA-N 398.553 5.079 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc3cccc(F)c3c2C)cc1 111020731 BIAGZAYZDJMBEM-UHFFFAOYSA-N 382.460 5.308 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(F)cc(F)c2)cs1 126515411 MOSDHPKTVVSLMM-VMPITWQZSA-N 398.434 5.310 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 160042645 BFSBXJKBRNBODK-AYBZRNKSSA-N 397.544 5.987 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](C)c1ccc(OCC#N)cc1 180538053 ZWIKXGUXUPZVNY-CABCVRRESA-N 395.503 5.572 30 20 GKED C=C(C)CN(C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 181702397 JWFUJTHFVKKHAI-UHFFFAOYSA-N 387.402 5.092 30 20 GKED C#CCOc1ccccc1NC(=O)c1ccc(SCc2csc(C)n2)cc1 187226482 PXZMRJGXRJDOLO-UHFFFAOYSA-N 394.521 5.008 30 20 GKED C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)c1cccc(C#N)c1 189755621 WOWGXRSGZGKVFI-LLVKDONJSA-N 386.274 5.224 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)c(OC(F)F)c1 189888325 OLSPHPUQTHRUPF-UHFFFAOYSA-N 375.415 5.401 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1C(F)(F)F)c1cccc(C#N)c1 190876325 AEUGIPRHMXFSBM-QWHCGFSZSA-N 378.419 5.398 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2ccc(-c3cccnc3)cc2)ccc1OC 237290828 HSFKDTAWFBCPPB-IBGZPJMESA-N 388.511 5.563 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 264568237 UEIZORYOSGJZDP-KRWDZBQOSA-N 392.528 5.253 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c2[C@@H]1C 297916765 RUDIDNVDADZZBC-HTQZYQBOSA-N 385.436 5.033 30 20 GKED N#CC1(CCCN[C@H]2CCC[C@@H]2c2cccc(C(F)(F)F)c2)CCOCC1 367532186 YGJFFYOJOWYQPY-MOPGFXCFSA-N 380.454 5.032 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)N[C@@H]1CC[C@H](C#N)C1 424317276 BQWWAGCGPIZOTB-FPMFFAJLSA-N 390.350 5.224 30 20 GKED CCc1ccc(-c2nc(CC(=O)N(C)[C@H](C)c3cccc(C#N)c3)cs2)cc1 425127294 INLKYQBLYMJRIP-MRXNPFEDSA-N 389.524 5.006 30 20 GKED Cc1noc(C)c1-c1ccc(OCc2ccc(C#N)cc2Br)cc1 432295681 XNFXUGZILDYZCW-UHFFFAOYSA-N 383.245 5.172 30 20 GKED CC(C)Oc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)cc1C#N 433278943 MVMMEMOSRLPWDC-NRFANRHFSA-N 375.472 5.105 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(Cl)cc(Br)c1F)c1ccccc1 435914325 FZZPWAHLRDXELC-OAHLLOKOSA-N 395.659 5.016 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccsc2Cl)cc1C 438561633 DHKKZOWWZBTVDM-UHFFFAOYSA-N 384.892 5.048 30 20 GKED CCCc1c(NC(=O)c2oc3c(C)cccc3c2C)cnn1-c1cccc(C#N)c1 440081601 PZNJYGINHOQGKR-UHFFFAOYSA-N 398.466 5.312 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)Cc1ccncc1)c1ccc(C(F)(F)F)cc1 440858568 WZTXLJCUJGIESF-HNAYVOBHSA-N 391.437 5.038 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 441291312 RGZQYZSZQXJKPX-GFCCVEGCSA-N 387.270 5.108 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1 442195060 FCBZUFHAXRBXSW-QFIPXVFZSA-N 384.479 5.600 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCCCC(C)(F)F 454696942 RTTSIUXJAUNZOH-UHFFFAOYSA-N 387.430 5.003 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCOc2c(F)ccc(F)c21 463732502 YBGVDYQJDFTJGD-GOSISDBHSA-N 386.442 5.462 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(CC)Cc1ccc(OCc2cccs2)c(OC)c1 464535955 ROGCMPKEKXPWFF-QGZVFWFLSA-N 387.545 5.287 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 466339913 MOLWARCKVMOIQH-OAHLLOKOSA-N 375.434 6.300 30 20 GKED C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 470396498 FKUBKJSYTPTQKL-ZHRRBRCNSA-N 384.545 5.127 30 20 GKED N#Cc1cccc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 474261378 YOORQOFECHONOH-HNNXBMFYSA-N 386.295 5.001 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1ncc(C(F)(F)F)s1 475850963 HAQGDQKZOIBHRS-UHFFFAOYSA-N 389.358 5.078 30 20 GKED N#CC[C@H](CC(=O)N1CCCCC[C@H]1CC(=O)c1ccccc1)c1ccccc1 476240415 UPVBRTHWZGRZCN-PKTZIBPZSA-N 388.511 5.118 30 20 GKED Cc1cc(C)c(NC(=O)CCCN(Cc2ccc(C#N)cc2)C(C)C)c(C)c1 485046611 STQAXNXDJOBISN-UHFFFAOYSA-N 377.532 5.113 30 20 GKED Cc1cc(Cl)cnc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 485091818 YEIMXRMLWPJOEG-UHFFFAOYSA-N 381.794 5.099 30 20 GKED N#CCCC[C@H](NC(=O)CCCn1ccc2cc(Cl)ccc21)c1ccccc1 487245889 ZPMCFEGGNCHTCB-NRFANRHFSA-N 393.918 5.626 30 20 GKED CC(C)[C@@H]1CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c2ccccc21 487259268 SSRXYMWOEWACSU-NRFANRHFSA-N 383.451 5.146 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 487783000 KHGACDGTIJBBHW-FQEVSTJZSA-N 390.508 5.689 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)CC(C)(C)C#N 499255493 WKXZIWHNHVRIQN-UHFFFAOYSA-N 392.478 5.610 30 20 GKED C[C@@H](NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)c1ccc(C#N)cc1 505316758 DKQDNWRZKSUROV-OAHLLOKOSA-N 398.491 5.718 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3cc(C#N)ccc3Cl)cc2)n1 507718679 PEAPEQSGUDYBER-UHFFFAOYSA-N 385.901 5.380 30 20 GKED CC(C)[C@@H](Sc1nc2c(cc1C#N)CCCC2)C(=O)Nc1ccccc1Cl 511368082 BNXHNMRNWHZZNJ-LJQANCHMSA-N 399.947 5.241 30 20 GKED C[C@@H](NC(=O)c1ccc(COc2ccccc2C#N)o1)c1cccc2ccccc12 511800627 BXUCOMKCOKMPAR-QGZVFWFLSA-N 396.446 5.374 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)N2CCC(CCC#N)CC2)c1C 515645493 ZRYOCJZIKMUPMM-UHFFFAOYSA-N 378.476 5.038 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1csc(Cc2ccccc2)n1 517518183 YCLANXLVEMYKCT-OAHLLOKOSA-N 393.537 5.380 30 20 GKED Cc1nc2cc(NC(=O)c3ccc(Oc4ccc(CC#N)cc4)cc3)ccc2o1 517664524 YCHRKPBWITVMNK-UHFFFAOYSA-N 383.407 5.247 30 20 GKED C[C@@H](N[C@H](C)c1ccccc1-n1ccnn1)c1ccc(-c2cccc(C#N)c2)cc1 517765785 IEURJNALZAKFSM-RTBURBONSA-N 393.494 5.218 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 518123693 QAHPVRJDVRVRRO-UHFFFAOYSA-N 382.872 5.858 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@H]1Cc1ccccc1 518166108 VMFKMLJUWJGVJB-ICSRJNTNSA-N 393.556 5.567 30 20 GKED N#Cc1ccc(/C=C/c2nc(-c3ccccc3OCc3ccccc3)no2)cc1 518340389 DHUMCNADNDVAMB-CCEZHUSRSA-N 379.419 5.358 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2nc(C3CC3)cs2)cc1 521598916 NDSZOTGCGWQLDD-UHFFFAOYSA-N 379.416 5.076 30 20 GKED C=C[C@H](CC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 535499550 KIDFYWYLJVJIRI-HXOBKFHXSA-N 376.887 5.301 30 20 GKED C=C[C@@H](CC(=O)NCCc1ccc(-c2csc(C)n2)s1)c1ccccc1 536166083 SUCKMAUWIUDIBD-INIZCTEOSA-N 382.554 5.199 30 20 GKED N#C[C@H](C(=O)c1coc(C2CCCCC2)n1)c1nc(-c2ccccc2)cs1 549080146 OTURJXOTUFVKKM-MRXNPFEDSA-N 377.469 5.336 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCc2ccc(Br)cc21)c1ccccc1 551210660 IBEOXSYYZGZAFO-LEWJYISDSA-N 383.333 5.851 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccncc1F 559841991 DJFBDJJBQZZGGK-BMIGLBTASA-N 380.307 5.584 30 20 GKED COC(=O)c1csc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 560548797 BUAKOVLLPHBHSH-JKSUJKDBSA-N 390.508 5.485 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1ccc(-c2cccnc2)cc1 561854986 FMJJUKYOUVRNPE-HNNXBMFYSA-N 392.300 5.234 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N[C@H](CCC#N)c1ccccc1)C(F)(F)F 573403625 VOBXKKMMUCAPKG-GOEBONIOSA-N 391.393 5.183 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1cccc(O)c1)CC1CC1 580977481 CGZOUBCORZHPGG-INIZCTEOSA-N 395.528 5.231 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@H]3C)c1C1CC1 582287347 SXPGJNHUBBPISY-QWHCGFSZSA-N 382.533 5.042 30 20 GKED Cc1c(C(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)sc2ccc(C#N)cc12 589985251 MVPBYRXJCWLEBO-KBPBESRZSA-N 380.435 5.180 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(CSc2ccccn2)c1 591509449 SCLIAJOSIMPIGZ-UHFFFAOYSA-N 395.553 5.656 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3c(Cl)cccc3[C@@H]21 599737588 MKZRPCLQHFAHFG-FWMLUHEOSA-N 397.931 5.194 30 20 GKED CC(C)(C#N)c1ccc(NS(=O)(=O)c2ccc3oc4ccccc4c3c2)cc1 603573337 MTIZTUPUPGCTGH-UHFFFAOYSA-N 390.464 5.188 30 20 GKED Cc1ccc(C[C@@H]2CCCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)cc1 604522358 UOFZEYBQUDRHBD-FQEVSTJZSA-N 375.516 5.283 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C[C@H](C)c2ccc(C(C)C)cc2)cc1 606348593 HJNFBTXCSSQEDT-KRWDZBQOSA-N 379.504 5.250 30 20 GKED CC(C)[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(Cl)cc1 608918541 JDKQWQKKAWSBSG-OAQYLSRUSA-N 383.923 5.529 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1 609062143 ADIJOOQGYOTOAB-UHFFFAOYSA-N 394.833 5.491 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)c2cc3ccccc3n2CC#N)c1C 609165001 CYNXODNIMRVZHI-UHFFFAOYSA-N 396.450 5.221 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H](C)c1cccs1 609968005 YCZKIBVFRIJQIZ-MRXNPFEDSA-N 378.472 5.404 30 20 GKED C[C@@H](N[C@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 610706280 IBOAJXBABBHKIW-VXGBXAGGSA-N 387.270 5.327 30 20 GKED C[C@@H](NCc1c(-c2ccc(Cl)cc2)nc2sccn12)c1cccc(C#N)c1 611389518 YHQIXEWDVIOSFP-CQSZACIVSA-N 392.915 5.439 30 20 GKED C[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C#N)cc1F 611586390 QHLVHXLHEJZRAB-XEZLXBQYSA-N 382.323 5.257 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccsc1 619777640 QRDKPDCWNGXVON-OAHLLOKOSA-N 378.522 5.403 30 20 GKED FC(F)(F)c1cccc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 623585029 XQQKIOZRNMBNTI-BRPSZJMVSA-N 380.254 5.422 30 20 GKED C[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C(F)F)nc1 657826525 HWWZTXXAFJQMOF-JMJZKYOTSA-N 390.318 5.579 30 20 GKED C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726485074 UKYXCCDZMZRRGI-LLVKDONJSA-N 397.853 5.620 30 20 GKED CCOc1c(Br)cc(/C=C2/CCc3sccc3C2=O)cc1OC 726894117 VUJNWLGRHDOYAN-WQLSENKSSA-N 393.302 5.130 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=O)c2csc(-c3ccccn3)n2)c1 728248575 XFCAXDUOZAQVJC-UHFFFAOYSA-N 395.487 5.033 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ccc(O[C@@H](C)C#N)cc2)cc1OC 728697977 APKYWNQRYYPDIB-UEICXMAYSA-N 379.456 5.061 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(Nc2cccc(F)c2)sc1=S 729469510 BFTQKEVENFFRIF-UHFFFAOYSA-N 393.557 5.166 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(Br)cc1 733253758 OTYVAHQQONWJTG-FQEVSTJZSA-N 391.268 5.111 30 20 GKED C=CCNC(=S)N(C)Cc1cc(C)c(OCc2ccccc2Cl)c(C)c1 734386700 LCCRBYOKTUCRGJ-UHFFFAOYSA-N 388.964 5.028 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 739143926 TYGFTYVIONHWMB-IUODEOHRSA-N 388.414 5.685 30 20 GKED COc1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)cc1C#N 741840396 SBOLRLJAVVDKNY-RGEXLXHISA-N 396.471 5.600 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](CC(C)C)c1ccccc1OCC)c1ccncc1 746419912 ACTANPFPRISHJD-SFTDATJTSA-N 381.520 5.184 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1)c1ccccc1 747987329 BXTUTNGSZDDWAU-OAQYLSRUSA-N 386.499 5.102 30 20 GKED C/C(=C/C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 748181635 QATDLHAAVUIKDW-SQFISAMPSA-N 388.389 5.430 30 20 GKED Cc1cc(C(=O)N[C@@H](CCC#N)c2ccccc2)c(C)n1[C@H](C)c1ccccc1 749045941 QUTMFVQXYPIBSU-DVECYGJZSA-N 385.511 5.489 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(Br)c1)c1nc2ccccc2s1 761000957 GAJORTQZWWBMGG-HNNXBMFYSA-N 399.313 5.258 30 20 GKED O=C(O[C@@H](Cc1ccc(F)cc1)C(F)(F)F)C1CCC(C(F)(F)F)CC1 766940287 XRIKLCCMMSYCMS-YIZWMMSDSA-N 386.307 5.211 30 20 GKED CN(CCC#N)c1ccc(CN2CCC[C@H](c3nc4ccccc4s3)C2)cc1 768185435 PJBUKAOUSKWZGR-IBGZPJMESA-N 390.556 5.026 30 20 GKED CCc1noc(C)c1C(C)=NNc1ncnc2scc(-c3ccc(C)cc3)c12 769797309 QVDICVYIHIEYTN-UHFFFAOYSA-N 391.500 5.362 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2sccc2Br)c1 772985735 XSVRIBFGURBZOH-GXTWGEPZSA-N 379.323 5.042 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](CC(C)(C)C)c2ccccc2)ccc1OC 776165885 YCEYFJBDTZUDLM-RTWAWAEBSA-N 380.532 5.643 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CCc3ccc(Cl)cc3C2=O)cn1 792888190 XYFJDGWUWJHBNW-YBEGLDIGSA-N 376.843 5.018 30 20 GKED C[C@@H](OC(=O)c1ccc(C(C)(C)C#N)cc1)c1nnc(-c2ccccc2F)s1 796042457 HJLDLYWMFOKGLY-CYBMUJFWSA-N 395.459 5.063 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801656952 VJHNVLKPZMCTAA-GOSISDBHSA-N 378.369 5.025 30 20 GKED C#C[C@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccc(F)cc1 812933676 KBGKJHFIZQWRCH-IBGZPJMESA-N 384.501 5.035 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)N(c2ccc(C#N)cc2)C2CCC2)c1 857676920 KUPSGKNDINNQJN-UHFFFAOYSA-N 391.471 5.105 30 20 GKED C[C@H](Nc1ccc(C#N)cc1Cl)c1cccc(NC(=O)c2ccccc2)c1 864020045 ULUYUSHBPGIDCX-HNNXBMFYSA-N 375.859 5.637 30 20 GKED CCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc3cccc(C)c3c2Cl)cc1 916912033 FIOAQZWVTJBUSZ-HNNXBMFYSA-N 396.899 5.387 30 20 GKED COc1ccc2cc(/C=C\C(=O)Nc3cccc(OCCCC#N)c3)ccc2c1 917728240 QRKAFOLZDLQDIV-WQLSENKSSA-N 386.451 5.183 30 20 GKED COc1cccc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 918034213 JVKIZPVUMNZBEK-SBUREZEXSA-N 385.467 5.233 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(Oc2ccccc2)cn1 1776033864 QUSBCYMWBJGMFR-UHFFFAOYSA-N 381.819 5.062 30 20 GKED C[C@H](Oc1cccc(/C=C/C(=O)c2ccc(-c3ccc(F)cc3)s2)c1)C(=O)O 1776472197 YPQLWGMVAHAXEQ-SEIPJRMCSA-N 396.439 5.302 30 20 GKED CCCCCCCCOc1ccc(/C=C(/CC(=O)O)c2ccc(C=O)o2)cc1 1776785527 KOENQWBGHVUYQE-CYVLTUHYSA-N 384.472 5.847 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CCc2ccccc2)C(=O)O)c1 1776787298 NQNYSBULWBTFLR-QHCPKHFHSA-N 383.532 5.211 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776801480 SRONYMSHGJQBAH-YRNVUSSQSA-N 394.423 5.215 30 20 GKED C#CCCCCC(=O)Nc1ccc(C2(NC(=O)[C@H](CC=C)C(=C)C)CCC2)cc1 1791729118 WKYJXKBUTDUZTD-JOCHJYFZSA-N 392.543 5.083 30 20 GKED CC1(C)OB(c2ccc3c4ccccc4c4oc5ccccc5c4c3c2)OC1(C)C 2382215608 UZNQPNXWMOQYDB-UHFFFAOYSA-N 394.279 6.192 30 20 GKED CC(C)c1ccc(N/C(S)=C(/C(=O)c2ccccc2)[n+]2ccccc2)cc1 15248438 UFGUOVWKCALVSO-UHFFFAOYSA-O 375.517 5.148 30 20 GKED Cc1cccc(-c2nc(CC(=O)[C@H](C#N)c3nc4ccccc4s3)cs2)c1 97261628 SHKRXLGWYYSRAR-INIZCTEOSA-N 389.505 5.147 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Br)cs1 108981560 UFEIAZJHBWWBOT-SNVBAGLBSA-N 381.320 5.157 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(SC(C)C)cc1 147619268 NFZBWOTXRDMYCN-SFHVURJKSA-N 376.481 5.182 30 20 GKED N#CCC[C@H](NC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1ccccc1 153397477 JQVLXLVCGIWGQC-SJFMBGHLSA-N 375.859 5.063 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl 159102602 MMPKSTRBYIDWPW-UHFFFAOYSA-N 379.932 5.031 30 20 GKED COCCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCCC1 162521429 HFAZSBWTGSJYRV-INIZCTEOSA-N 388.920 5.237 30 20 GKED CCC(CC)c1cc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)on1 173116001 BUMFTNZURAXOHA-AWEZNQCLSA-N 386.521 5.152 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(CC1CCC1)[C@H](C)c1ccccc1 180053128 QLSISNPOMQBIGB-QZTJIDSGSA-N 377.488 5.373 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(C2SCCS2)cc1 301748945 MJCFPUVVGCVSBA-UHFFFAOYSA-N 396.002 5.709 30 20 GKED N#Cc1ccc2nc(N3CCC(c4nc5cc(Cl)ccc5o4)CC3)ccc2c1 301978159 GJCMEEZFAZFPFH-UHFFFAOYSA-N 388.858 5.285 30 20 GKED C[C@H]1C[C@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329266336 CSFMNGVQBNAXFQ-RWUQSCMSSA-N 381.520 5.410 30 20 GKED O=[S@](Cc1cc(F)c(C(F)(F)F)cc1F)C1CCC(C(F)(F)F)CC1 414270995 QMJZKLUBPFFPOX-ZFIFMYTKSA-N 394.327 5.353 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425659824 WGJXLOGRURNHQJ-HOTGVXAUSA-N 378.501 5.177 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Oc3cccnc3)cc2)s1 430587091 YDWRQTGOXOIRDF-KRWDZBQOSA-N 377.469 5.118 30 20 GKED Cc1ccnc(-c2cccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2)n1 433144310 LUGGLPPXORSMDQ-NRFANRHFSA-N 385.471 5.009 30 20 GKED Cc1nc(-c2ccc(Br)cc2Cl)nn1CCCCC(C)(C)C#N 436208953 WABZLOMLVPRQEP-UHFFFAOYSA-N 395.732 5.390 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2ccc(F)cc2F)cc1F 438646779 GTPZSKJXCRFMLX-UHFFFAOYSA-N 397.356 5.090 30 20 GKED Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)N[C@H](CCC#N)c2ccccc2)cc1 440239576 JPGWZULIDXPXHM-ZRBLBEILSA-N 375.516 5.318 30 20 GKED C=CCN(C(=O)c1ccc(-c2csc(C)n2)cc1)c1nc2c(s1)CCCC2 440453054 CTWLMTQJZWMEBB-UHFFFAOYSA-N 395.553 5.287 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1ccoc1)C1CCCCC1)c1ccccc1 458803418 RFTAJVTWGFVBAI-QFIPXVFZSA-N 379.504 5.559 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)[C@@H](C)c1cccc(C#N)c1 462215641 RJOYIPKKFHEWJL-DOTOQJQBSA-N 389.524 5.313 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cs1 464421844 OFZIXQYWAOKKLY-CQSZACIVSA-N 387.386 5.022 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 464713261 RNISKVBWQFLNBE-LJQANCHMSA-N 396.487 5.532 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)C1CCC(C(F)(F)F)CC1 469418684 UMKFPLUIQIEGFR-UHFFFAOYSA-N 387.295 5.074 30 20 GKED CCO[C@@H](CCNC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CCCC1 473637092 AOLFGULJFFHLNA-APWZRJJASA-N 389.565 5.188 30 20 GKED Cc1ccc(-n2c(SCCCC(C)(C)C#N)nnc2-c2ccccn2)c(C)c1 475963156 CEYPXZZUBCXROX-UHFFFAOYSA-N 391.544 5.368 30 20 GKED CC(C)CN(C(=O)c1cc2cc(Br)ccc2o1)c1ccc(C#N)cc1 480099627 NAANGWTUGIMZNB-UHFFFAOYSA-N 397.272 5.370 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2Cc3ccccc3C3(CC3)C2)cc1 480809988 GWHPNVZVYFSCKF-UHFFFAOYSA-N 395.462 5.430 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc4cc(F)ccc4s3)s2)cc1 487296530 YYWCFPXMBDKFCK-UHFFFAOYSA-N 393.468 5.212 30 20 GKED COCc1c(C(=O)N[C@@H](CCCC#N)c2ccccc2)sc2cccc(F)c12 487298399 MRMZFMIVYKLPGW-SFHVURJKSA-N 396.487 5.352 30 20 GKED N#CCC[C@@H](NC(=O)N[C@@H]1CC=C(c2ccc(F)cc2)CC1)c1ccccc1 487935766 OLQPBFCSYMAUCW-FGZHOGPDSA-N 377.463 5.106 30 20 GKED CN(Cc1cccc2[nH]ccc12)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 495111349 LBWHNEPGIXNQGI-UHFFFAOYSA-N 399.425 5.243 30 20 GKED CCc1nc(C)c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)s1 496532626 FDVQHGVGDCUXCZ-GFCCVEGCSA-N 387.574 5.350 30 20 GKED CCCc1ccc([C@H](NC(=O)NCc2ccc(C#N)cc2)c2cccs2)cc1 500420894 LWTKYXMGBPKGCG-QFIPXVFZSA-N 389.524 5.161 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1 500793420 OBAATVBHYFQCBP-GOSISDBHSA-N 378.516 5.185 30 20 GKED C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)N1CC=C(c2ccc(C#N)cc2)CC1 502508274 QRIYYAIOJIQXJG-HNNXBMFYSA-N 390.874 5.112 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 505326777 XDIHPIWPXSFXHM-YWZLYKJASA-N 385.508 5.739 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC(C)(C#N)CC3)cc2)cc1 506266435 BYKOSTBNZPSSTF-UHFFFAOYSA-N 379.460 5.035 30 20 GKED C=CCOc1cccc(CN[C@@H](C)c2sc(-c3ccc(OC)cc3)nc2C)c1 506290583 BSRUGPXWCPTERC-INIZCTEOSA-N 394.540 5.543 30 20 GKED C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1ccc(C#N)cc1F 512621262 VYKKMAFLYQUGMP-GOSISDBHSA-N 396.469 5.401 30 20 GKED C[C@H]1c2ccsc2CCN1C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517652230 ICEMJBBQROMRNS-INIZCTEOSA-N 388.492 5.366 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(C(F)(F)F)cc3)cc2)nc1 520326186 QVJMJKDXBMXCRG-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 521152185 YCYQPRXEVGIGIO-STQMWFEESA-N 376.287 5.329 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)NCc1cccc(COC(C)(C)C)c1 523215627 XCXLRAGUXZZHAX-UHFFFAOYSA-N 384.495 5.039 30 20 GKED C[C@H](NC(=O)c1cccnc1SCC1CCCCC1)c1ccc(C#N)cc1 523708759 WQPDSROYPHSJTF-INIZCTEOSA-N 379.529 5.117 30 20 GKED N#Cc1cc(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)ccc1F 524455045 DKUBRWYSKPEJLX-UHFFFAOYSA-N 379.441 5.288 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@@H](C)c1cccc(F)c1 525155596 NVDRTDCSDKQVGR-ZDUSSCGKSA-N 394.259 5.046 30 20 GKED C[C@@H]1CC(F)(F)CCN1C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 530010562 ICKQUANJEDPAHX-CYBMUJFWSA-N 390.817 5.264 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc2cc(Cl)ccc2n1C 530500165 QIYUMTRRBBHGKZ-UHFFFAOYSA-N 396.922 5.400 30 20 GKED C=C(C)[C@@H](CC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1)OCC 533684309 YUCFFRGONRSLAY-WOJBJXKFSA-N 396.531 5.500 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 536935094 MQUQEOUKIGLIIZ-YJBOKZPZSA-N 397.400 5.196 30 20 GKED Cc1cc(C)c(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c(Br)c1 541459779 KBMZDBHBTCMVKR-UHFFFAOYSA-N 398.304 5.134 30 20 GKED N#Cc1ccc(CN[C@@H](Cc2ccccc2)c2cccs2)c(OC(F)F)c1 541596319 SIMUINFBSCKWIT-SFHVURJKSA-N 384.451 5.295 30 20 GKED CC(C)(C)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(F)cc1 544304555 FAYIJCJCDYCVRX-OAQYLSRUSA-N 379.479 5.159 30 20 GKED CC1(C)C[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCO1 546640174 CKEZAVMTUSTPMB-MRXNPFEDSA-N 399.878 5.083 30 20 GKED C=C[C@@](C)(CCOC)c1nc([C@@H](c2ccc(Br)cc2)C(C)C)no1 561902965 SAWQMFQQMUQGKG-APWZRJJASA-N 393.325 5.100 30 20 GKED N#CCCC[C@H](NC(=O)NCc1cccc(Cl)c1Cl)c1ccccc1 566539443 DCJQBEFGBTXUCZ-KRWDZBQOSA-N 376.287 5.228 30 20 GKED Cc1oc(C#N)cc1-c1nc(-c2ccc(Oc3ccccc3F)c(F)c2)no1 575365568 FUMVVVYHLYPQID-UHFFFAOYSA-N 379.322 5.247 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)C1CCC(F)(F)CC1 588791640 JARRXEMBVJQJIZ-UHFFFAOYSA-N 386.467 5.359 30 20 GKED C=CCN(CCc1ccccc1)C(=O)NCc1sc(-c2ccccc2)nc1C 589683948 NLMNMSMILCIKML-UHFFFAOYSA-N 391.540 5.059 30 20 GKED CC(C)Oc1ccccc1C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 592360802 KBLTZLGWZGOHKV-AWEZNQCLSA-N 398.434 5.366 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)C1 596663128 ZHPSCAWDSJXCSB-QGZVFWFLSA-N 399.441 5.036 30 20 GKED N#C[C@H]1CCC[C@]2(C1)Nc1ccccc1C(=O)N2c1ccc(Cl)c(Cl)c1 602754052 AXXOFDBSXCDHNJ-RBZFPXEDSA-N 386.282 5.476 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 603918302 QHOCBHTYJWZOKO-UHFFFAOYSA-N 394.883 5.735 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1cccc(C(=O)Nc2ccccc2)c1 603934181 KKCSZEWTGBGKFR-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC[C@H](NC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 604500711 YLDYVMJKJSAYPA-QFIPXVFZSA-N 398.466 5.083 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1Oc1ccncc1 604691052 YOFDOQZBGNEFKW-HXUWFJFHSA-N 379.419 5.221 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC[C@H](C(C)(C)C)CC2)cc1 604798732 RTZUTTVDUUYXIH-FQEVSTJZSA-N 397.563 5.181 30 20 GKED CCN(C(=O)[C@H](C)c1c(Cl)cccc1Cl)[C@@H](C)c1ccc(C#N)cc1 609581113 JHDAKMQAWXUMLU-KGLIPLIRSA-N 375.299 5.578 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3nc(-c4cccc(C#N)c4)cs3)sc2n1 611072090 OSIDYFJHTJQGRU-UHFFFAOYSA-N 390.493 5.161 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc2c(F)cccc2[nH]1 619126119 KQSVARUOMHKMAG-UHFFFAOYSA-N 384.295 5.090 30 20 GKED FC(F)(F)c1cccc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)n1 623585031 XQQKIOZRNMBNTI-YUMQZZPRSA-N 380.254 5.422 30 20 GKED C[C@H](NC(=S)N(Cc1ccccc1)c1ccccc1C#N)c1cccs1 726484996 IDTPAGHKYAMVDE-INIZCTEOSA-N 377.538 5.262 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417273 LXLFXCQQJQQAOX-GUYCJALGSA-N 396.487 5.377 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](OC1CCCC1)c1ccccc1 730988724 BSNCDXFSGCMOFZ-JTSKRJEESA-N 394.540 5.577 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccco2)C2CCCC2)cc1 731752490 HVQUNGBKDPEQEJ-XMMPIXPASA-N 399.494 5.912 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(C2SCCCS2)cc1 732644569 XAWSQVXEDXHFBZ-UHFFFAOYSA-N 375.603 5.764 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(Oc3cccnc3)c(C)c2)cc1OC 732713939 OEYXGFKERHSUCL-TWGQIWQCSA-N 375.424 5.096 30 20 GKED Cn1nc(-c2ccccc2)c(C=NNc2cccc(C(F)(F)F)c2)c1Cl 734744229 HNJGXYZOVNIALS-UHFFFAOYSA-N 378.785 5.205 30 20 GKED CCOc1ccccc1NC(=O)[C@H](C#N)C(=O)C[C@H](C)c1ccc(C(C)C)cc1 739154292 ITILRILQSSGEKN-FXAWDEMLSA-N 392.499 5.050 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2c(Cl)nc3sccn23)cc1 741470791 WAXTVQPWLWVEOZ-KHPPLWFESA-N 394.883 5.621 30 20 GKED CCCCc1nc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)cs1 742262063 UVOLYVUJZYNBCW-UHFFFAOYSA-N 395.503 5.688 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1 743201934 RQRWZNZMZIXKFA-HNNXBMFYSA-N 380.419 5.199 30 20 GKED CC(=NNc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(-c2ccncc2)cc1 745198821 YXCUXEQQVIOVKO-UHFFFAOYSA-N 380.373 5.475 30 20 GKED O=C(/C=C/c1ccccc1OCC(F)(F)F)c1ccc(-c2ccncc2)cc1 745990524 SCKWQYSSTMYMFT-MDZDMXLPSA-N 383.369 5.586 30 20 GKED Cc1ccc(C)c(-n2ncc(NC(=S)Nc3ccc(C#N)c(Cl)c3)c2C)c1 746532121 HKDGEWVXFUAVQC-UHFFFAOYSA-N 395.919 5.132 30 20 GKED Cc1ccccc1[C@H](OC(=O)[C@H](C)Oc1ccc(C#N)cc1)c1cccs1 748501829 FLEPAGOBRDJOGQ-KKSFZXQISA-N 377.465 5.028 30 20 GKED Cc1nc(Cl)sc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 748556824 WUNJFIUCOICNIO-UHFFFAOYSA-N 387.823 5.160 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)s1 762442376 KBTCGVUKQPZPOZ-KXFIGUGUSA-N 384.800 5.337 30 20 GKED COc1cc2c(cc1NC(=O)[C@H](C#N)CCc1ccccc1)oc1ccccc12 763991194 DWBIODNSHRVWSJ-KRWDZBQOSA-N 384.435 5.306 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C34C[C@H]5C[C@@H](CC(F)(C5)C3)C4)n2)cc1 766259071 ONCWTJATHYRWSV-XPGIJCKBSA-N 394.515 5.603 30 20 GKED Cc1nn(CCC#N)c(C)c1CCC(=O)O[C@@H](C)c1sc2ccccc2c1C 767578202 QXLWGLPVXKUYRD-KRWDZBQOSA-N 395.528 5.174 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](c1ccccc1)C1CCOCC1)c1ccccc1 771992244 VQUGZPKQCHBIPX-DHIUTWEWSA-N 378.516 5.161 30 20 GKED CC(C)c1nccnc1NN=Cc1c(C(C)C)nn(Cc2ccccc2)c1Cl 773077074 CKHMHCVCGOCCHZ-UHFFFAOYSA-N 396.926 5.068 30 20 GKED Oc1nc(NN=C2CCC[C@H]2c2ccc(C(F)(F)F)cc2)nc2ccccc12 776778217 QUAVLFKHTGRTRP-AWEZNQCLSA-N 386.377 5.090 30 20 GKED N#C[C@@H](C(=O)[C@H](F)Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 778297072 GCYWPTHLZRAYGW-DLBZAZTESA-N 384.863 5.221 30 20 GKED Cc1nc(C(=O)OCc2cc(Cl)ccc2OCC#N)c(-c2ccccc2)s1 778856433 YMFXJZBLPXRDKQ-UHFFFAOYSA-N 398.871 5.031 30 20 GKED CCc1ccccc1CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 785887731 ZLCPIBLOIGRRBN-HNNXBMFYSA-N 382.435 5.070 30 20 GKED O=C(/C=C\c1ccc2occc2c1)c1ccc(S(=O)(=O)C2CCCC2)cc1 794702388 PPJGLNSIWLCFBE-WZUFQYTHSA-N 380.465 5.045 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCCCCC2)cc1 801775295 IGYVFJUWFNDYNP-UHFFFAOYSA-N 390.531 5.383 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1oc2ccccc2c1CC 835063375 KQUIPVBVXCXUBY-IBGZPJMESA-N 388.467 5.081 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 857436581 DQJDDNKOHVPLCL-AWEZNQCLSA-N 397.265 5.190 30 20 GKED C=CCN(Cc1ccccc1)Cn1nc(Nc2cccc(OC)c2)sc1=S 914570599 UYCWACVEWCRLJC-UHFFFAOYSA-N 398.557 5.072 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2ccc(F)cc2)cs1 916268100 JSNIVHQQDAAFFV-UHFFFAOYSA-N 388.855 5.066 30 20 GKED Cc1sc2ncn(N=Cc3cccc4ccccc34)c(=O)c2c1-c1ccccc1 916283427 AFYZKUAXLPFVSW-UHFFFAOYSA-N 395.487 5.469 30 20 GKED Cc1ccc(SCC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 916972187 KOZBMSRBFAZUBE-GOSISDBHSA-N 378.522 5.396 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(Cl)c(C(F)(F)F)c2)ccc1Cl 1776033475 NRKNJVZPXRSXQQ-UHFFFAOYSA-N 377.149 5.156 30 20 GKED Cc1ccc(NN=Cc2cccc(OCc3cccc(C(=O)O)c3)c2)c(Cl)c1 1776060906 VMHQQYMFGQPGDX-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)c(O)c2)cc1 1776125765 RXZGVRDQSSAFJY-AAKUMTKESA-N 396.483 5.582 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(C3CCCCC3)cc2)cc1CC(=O)O 1776132937 JVRYIXFAWCTAPT-UKTHLTGXSA-N 378.468 5.266 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cn(C)nc1-c1cc2ccccc2o1 1776785565 LZNNJEYKXQPYBC-LJQANCHMSA-N 397.519 5.127 30 20 GKED CN(C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1777038836 JPVNZEPZUVPZLO-QBFSEMIESA-N 377.465 5.075 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1cc(C(=O)O)ccc1Br 1777559905 VSYUXWKQSPRLRH-VQHVLOKHSA-N 385.213 5.098 30 20 GKED C=CCN(C(=O)c1ccccn1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 18085159 XTLWJKZVFMTMTK-UHFFFAOYSA-N 390.295 5.345 30 20 GKED Cc1cccc(-c2nnc(SCc3ccc(-c4ccccc4C#N)cc3)o2)c1 22414025 YMMSVMVPTPXHBM-UHFFFAOYSA-N 383.476 5.876 30 20 GKED Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(C(C)(C)C#N)cc1 25439993 UHXNAUSLILSLSG-UHFFFAOYSA-N 397.837 5.496 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COc2ccc3oc4ccccc4c3c2)cc1 25838743 TUGJYKXJUUDWKV-UHFFFAOYSA-N 384.435 5.405 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3sc4c(c3C#N)CCCC4)s2)c(C)c1 61111602 DTXZQXXNZQDOBC-UHFFFAOYSA-N 393.537 5.491 30 20 GKED N#C[C@@H](C(=O)c1ccc2ccccc2c1)c1nc(-c2ccc(Cl)cc2)cs1 71794349 KRBNSJNKRNYJEA-IBGZPJMESA-N 388.879 6.107 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1nnc(-c2ccccc2)o1 72030864 KPHPTWHQTIUOBC-INIZCTEOSA-N 382.423 5.574 30 20 GKED N#CCCSc1ccccc1NC(=O)c1csc(-c2ccc(Cl)cc2)n1 78669057 RHMAAMZFELOKRF-UHFFFAOYSA-N 399.928 5.722 30 20 GKED Cc1cccc2[nH]cc(CC(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)c12 103640371 QHJRAMRLOMLECB-AWEZNQCLSA-N 379.872 5.158 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COCc2ccccc2)cc1Cl 107875243 UOQPIGKDIPHJKS-NRFANRHFSA-N 390.870 5.151 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@@H](C)c1ccc(F)cc1 108359796 RWBFNVRWGREODB-SJORKVTESA-N 399.535 5.242 30 20 GKED C=CCn1c(S[C@H](c2ccccc2)c2ccccc2C)nnc1-c1cnccn1 124041779 MOEDUCLPIBZMBU-OAQYLSRUSA-N 399.523 5.111 30 20 GKED CC[C@H](C#N)Sc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 127013224 AZFBPQIPFRIYAT-CYBMUJFWSA-N 393.299 5.287 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccccc2CCC(F)(F)F)c1 156587734 XBTNRJXEMZAXQQ-UHFFFAOYSA-N 390.405 5.241 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(CSC2CCOCC2)c1 159496936 WNBASZVVSHQDQB-UHFFFAOYSA-N 376.566 5.309 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCCc4ccccc43)n2)cc1 171777551 FJGNXEVPHGYFJK-TZIWHRDSSA-N 397.503 5.368 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(CSc2ccccc2C#N)cs1 172679843 OQZZYOBZQHGRBA-UHFFFAOYSA-N 393.537 5.609 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(CC(F)(F)F)cc2)c1 175262460 YRAVMSMUNIQPIK-UHFFFAOYSA-N 377.366 5.118 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Oc2ccc(Cl)cc2Cl)n1 177743416 MLQCPTITOOJTTK-CMPLNLGQSA-N 383.300 5.217 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(Br)s2)s1)c1ccccn1 183178745 IHKZWXPAYISGLU-SNVBAGLBSA-N 389.299 5.124 30 20 GKED Cc1nc(NC(=O)CCCc2cccc(C(F)(F)F)c2)sc1SCC#N 185228054 PNSDEQPYDFDLLQ-UHFFFAOYSA-N 399.463 5.047 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)CC(C)(C)O 191518198 SDJZOKQVWNCDJN-UHFFFAOYSA-N 380.532 5.344 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)Sc1ccccc1Cl 303281863 KIFLDYLQCXRBAF-UONOGXRCSA-N 390.961 5.711 30 20 GKED Cc1csc(Sc2c(Cl)cccc2N=C(O)[C@H]2C[C@H]3CC[C@H]2O3)n1 329312642 CEHPEUOCXWPWLS-UHIISALHSA-N 380.922 5.412 30 20 GKED CC1(C)Oc2ccc(N=C(O)N3CCCC[C@H]3c3nc4ccccc4o3)cc2O1 330145708 LESQXKCJYALMBW-INIZCTEOSA-N 393.443 5.108 30 20 GKED CC(C)c1csc([C@H]2CCCN(C(=O)c3ccc(C(C)(C)C#N)cc3)C2)n1 332307412 LOBDCEXWFDVVSA-KRWDZBQOSA-N 381.545 5.087 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC2(CC1)OCc1ccccc12 373706621 GXOLAOMDFWMCSY-UHFFFAOYSA-N 390.527 5.592 30 20 GKED Cc1cc(Br)c(C(=O)Nc2sc(C)c(C)c2C#N)cc1Cl 386371684 PKNXPGQFLVZYDB-UHFFFAOYSA-N 383.698 5.213 30 20 GKED COC(=O)[C@@H](C)c1cccc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 416822621 XKGZJYQFTOQZKT-CABCVRRESA-N 397.500 5.001 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@@H]2CC[C@H](C#N)C2)c(C(F)(F)F)c1 425642366 WEXPASDBNABEDF-FRRDWIJNSA-N 385.455 5.410 30 20 GKED Cc1csc(-c2cccc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2)n1 430600724 IBGNLFDHNKESEI-OAHLLOKOSA-N 381.526 5.363 30 20 GKED COc1ccc(-c2ncc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)s2)cc1 430622507 FMRXPZZDCSXBAW-AWEZNQCLSA-N 397.525 5.063 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ncc(Cc2ccccc2)s1)c1ccccc1 431689125 APYUVNJHOHKTTL-HXUWFJFHSA-N 390.512 5.291 30 20 GKED CC(C)COc1ccccc1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 437825039 WAUBSTSKUIGSEI-FPOVZHCZSA-N 377.488 5.025 30 20 GKED C=CCC[C@@H](NC(=O)c1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 441593619 TVFJGEJVOCJYHV-LJQANCHMSA-N 390.405 5.101 30 20 GKED CC(=O)c1cc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)ccc1C 448200832 YSAIKRYRCFVYHA-UHFFFAOYSA-N 386.476 5.149 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)NCc2ccc(C#N)c(F)c2)c1C 454913851 BCNNMLTVKNHIBH-UHFFFAOYSA-N 383.467 5.033 30 20 GKED CC1CCC(OC2CCN(c3c(C#N)cnc4ccc(Cl)cc34)CC2)CC1 462832390 LEUAXUYKQATGEB-UHFFFAOYSA-N 383.923 5.324 30 20 GKED COc1ccc(N(C)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1F 466909810 AMHBNLYDMJGCMY-UHFFFAOYSA-N 395.274 5.149 30 20 GKED CC(=O)c1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 467990949 RXWXLIDLETYIDH-UHFFFAOYSA-N 390.826 5.459 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 471175922 IZQGYGMJODDTKF-UHFFFAOYSA-N 395.890 5.548 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@@H](C)CC2(C)C)cc1 472722851 KZYYZJSPHXBPFL-HNNXBMFYSA-N 379.460 5.011 30 20 GKED N#C[C@@H](C(=O)c1ccc2sccc2c1)c1nc(-c2c(F)cccc2F)cs1 473137441 FCLODBAXMBEXFJ-ZDUSSCGKSA-N 396.443 5.793 30 20 GKED CCCCn1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c(C)n1 473487072 JJKCRXIRXCADEX-MRXNPFEDSA-N 398.919 5.259 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1ccccc1 475379188 HQNBBLIRTWCDDG-QHCPKHFHSA-N 386.470 5.442 30 20 GKED C=CCCC1(C(=O)N2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)CC1 476342971 QGEZHDUPKYAJRV-UHFFFAOYSA-N 382.331 5.247 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)[C@H](C)Oc2ccc(C#N)cc2)o1 477905291 WUUZPXWJAOOZFK-AWEZNQCLSA-N 380.831 5.186 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H](C)c1cccc(OC)c1 481751594 SXOGYNKGYBVWEN-OAHLLOKOSA-N 399.491 5.044 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(CC(F)F)c3ccccc3)c2)cc1 485246248 BSKMBCFFTKGYNM-UHFFFAOYSA-N 378.378 5.262 30 20 GKED N#CCCC[C@@H](NC(=O)CCOc1ccc(Cl)c(Cl)c1)c1ccccc1 487251745 OKFBWMHQTAUXIW-LJQANCHMSA-N 391.298 5.314 30 20 GKED N#CCCC[C@@H](NC(=O)CC(c1ccccc1)c1ccccc1)c1ccccc1 487537509 MYYUROVDACLJLI-RUZDIDTESA-N 382.507 5.760 30 20 GKED COc1ccccc1[C@H](NCc1cc(C#N)ccc1F)c1ccccc1Cl 494020699 OHTXDRWCACADBB-JOCHJYFZSA-N 380.850 5.239 30 20 GKED CCc1cccc(CC)c1NC(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 499483658 JCWWKFOYFKCMAG-UHFFFAOYSA-N 392.446 5.433 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)C1 503956119 ROQVEBQGAQKPNL-YKSBVNFPSA-N 394.559 5.330 30 20 GKED N#CC1(CCCSCCOc2ccc(Oc3ccccc3)cc2)CCOCC1 507692931 DDCASNUZHNGBBN-UHFFFAOYSA-N 397.540 5.691 30 20 GKED N#CC1(CCCSCCCc2ccccc2Br)CCOCC1 512315035 RMVUXBFYAGWMKB-UHFFFAOYSA-N 382.367 5.215 30 20 GKED CCCN(C(=O)NCC(C)(C)CCC#N)[C@H](C)c1ccc(Cl)c(Cl)c1 513106802 AGIOPTFIZBEFDX-CQSZACIVSA-N 384.351 5.806 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 515859153 JDUIHMHPEIGQED-CQSZACIVSA-N 394.824 5.113 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccccc3)cc2)ccn1 516859991 UWQVWNNHGJQNQY-JOCHJYFZSA-N 384.439 5.115 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 517473775 UCLTVGHXWOHGGI-SFHVURJKSA-N 379.529 5.201 30 20 GKED Cc1ccc(SCCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 520195574 DLLGXLBECHWSMR-INIZCTEOSA-N 385.558 5.303 30 20 GKED C=CCN1CCC(NC(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CC1 521581802 MODYJNNKACALCA-UHFFFAOYSA-N 395.355 5.102 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H]3c3ccsc3)c2)cc1 522322627 OKXWYXXHHWEIHE-QFIPXVFZSA-N 388.492 5.176 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)C[C@H](C)c1ccccc1C(F)(F)F 525041481 FVYDJCWEYXXMAY-INIZCTEOSA-N 388.433 5.509 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)cc1 534758394 XXVPMNBAFGOXTJ-UHFFFAOYSA-N 384.464 5.032 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccccc3)Cc3ccc(F)cc3)cc2)CC1 539684164 GHOGGNNHBXOYNU-UHFFFAOYSA-N 384.454 5.223 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)Nc1ccc(C#N)cc1Cl 539768633 UNINUKDBMPCRKT-UHFFFAOYSA-N 384.060 5.188 30 20 GKED CC(=O)Nc1cccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 541994417 TVFUEWBOWYBDAP-MRXNPFEDSA-N 398.466 5.066 30 20 GKED Cc1ccccc1C1(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 561205694 HESMQENLNLPBQU-MRXNPFEDSA-N 379.529 5.100 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)c2ccc(-c3ccccc3)o2)cc1 563476274 SQILNGAIMSHQGL-UHFFFAOYSA-N 384.357 5.023 30 20 GKED Cc1noc(C)c1-c1ccc(OCc2ccc(Br)cc2C#N)cc1 564077632 FDGVHASTBXTCEZ-UHFFFAOYSA-N 383.245 5.172 30 20 GKED C=CCC[C@H](NC(=O)NCCCc1nccs1)c1ccc(C(F)(F)F)cc1 568940091 WAMOSYCTPQMEOW-INIZCTEOSA-N 397.466 5.101 30 20 GKED N#CC(CCN1CCC(F)(c2ccccn2)CC1)(c1ccccc1)c1ccccc1 569889690 ROMGJXCTTKCGSL-UHFFFAOYSA-N 399.513 5.242 30 20 GKED N#Cc1c(NC(=O)CCN2CCCCC[C@H]2c2ccccc2)sc2c1CCC2 574046772 OLWTWYXYNZTAHT-FQEVSTJZSA-N 393.556 5.054 30 20 GKED C[C@H](NC[C@H](C#N)CCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 578313867 PTTIAJYGDAYECS-KBPBESRZSA-N 377.435 5.528 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3cc(Cl)ccc3Cl)cc2)ccn1 580503549 NHKNVPUNTZGLTB-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=CCN(C(=O)C[C@@H](C)c1ccccc1F)c1nc(-c2ccccc2)cs1 588353173 FTBWNTSURLNTEG-MRXNPFEDSA-N 380.488 5.662 30 20 GKED CC[C@H](OCCNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 593158038 SDEMQLQFRQOUOQ-XLIONFOSSA-N 397.544 5.370 30 20 GKED CC[C@@H](C)n1c(Sc2nc(C#N)c(Cl)s2)nnc1-c1ccccc1 596105052 LYSBVVZYCIWTOJ-SNVBAGLBSA-N 375.910 5.049 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(F)cc1Cl 609061553 DVVFXGBVRNXQPE-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cc(F)ccc2Cl)c1 609065305 RIVIRSHETJYMBP-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1c(Cl)cccc1Cl 609581105 HVRGREHEQROEIK-CQSZACIVSA-N 375.299 5.406 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1ccc(-c2nc3ccccc3[nH]2)cc1 609670428 ISTDZOSIWBGCEE-UHFFFAOYSA-N 393.372 5.127 30 20 GKED Cc1ccc(C(=O)N[C@@H](C)c2cccc(C#N)c2)cc1NC(=O)Nc1ccccc1 610359350 IWIHERCODIOHDQ-KRWDZBQOSA-N 398.466 5.002 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)N[C@H](C)c1cccc(C#N)c1 610363087 WVCSIUJVKKFATK-SNVBAGLBSA-N 387.917 5.196 30 20 GKED C[C@H]1CCc2c(C(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)csc2C1 613392140 JQOQRXXAXQLNCM-BBRMVZONSA-N 378.522 5.486 30 20 GKED CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622851951 PCHBPCOLRHSFDD-LLVKDONJSA-N 389.286 5.144 30 20 GKED C=CCN(Cc1ccccc1)Cc1csc(-c2cccc(OC)c2OC)n1 642103482 SFHCGPFBHVGAAH-UHFFFAOYSA-N 380.513 5.016 30 20 GKED N#CCOc1ccc(CNC(=O)N[C@H](CC2CCCCC2)c2ccccc2)cc1 727844829 OIUXOTGTTKHWFK-HSZRJFAPSA-N 391.515 5.100 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4cc(C#N)ccc4OC(F)F)cc3c2C1 728040763 LIUAVNSBFDGUHJ-LBPRGKRZSA-N 395.409 5.018 30 20 GKED O=C(/C=C/c1csc(-c2ccc3c(c2)OCO3)n1)c1ccc(Cl)s1 728438291 SFYNZHPPNMIRRN-NSCUHMNNSA-N 375.858 5.150 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2oc3c(ccc4ccccc43)c2C)c1 733773196 UZDGGYRIFZMAOH-IBGZPJMESA-N 398.462 5.505 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2c(-c3ccccc3)nn(C)c2Cl)cc1 734745196 FTQRSIFSEPDXLH-INIZCTEOSA-N 380.923 5.549 30 20 GKED Cc1c(Cl)cccc1OCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 736003359 ZAUIFSRZTQSJIG-FQEVSTJZSA-N 390.870 5.321 30 20 GKED N#Cc1ccc(F)c(CNC(=O)N(Cc2ccccc2Cl)C2CCCC2)c1 745891588 VJHCACIYSGFLTD-UHFFFAOYSA-N 385.870 5.005 30 20 GKED COc1cc(/C=C\C(=O)c2nc3ccccc3s2)ccc1OCC(F)(F)F 750902683 MDMYIEZMWCFPIF-VURMDHGXSA-N 393.386 5.142 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(-c4ccncc4)cc3F)c2)s1 752079676 KAJJKTNEUGNZGE-UHFFFAOYSA-N 399.494 5.778 30 20 GKED C#CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1)c1ccccc1 757006807 ZKRKCJCHDUMTMN-KKSFZXQISA-N 389.524 5.243 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)COc2cc(Cl)cc(Cl)c21 758919277 QARQTVKQHKJBFP-VZUCSPMQSA-N 389.263 5.171 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3)o2)cc1OCCCC#N 761804153 KMTNUUQVFGKNKY-LUAWRHEFSA-N 387.435 5.534 30 20 GKED CC1(c2ccccc2)C/C(=C/c2nccs2)C(=O)/C(=C\c2nccs2)C1 767886224 FVWWAOUAHQUQIW-NFLUSIDLSA-N 378.522 5.387 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCc2cccs2)cc1 769952242 DRLBFTOOURKSGG-NRFANRHFSA-N 375.497 5.158 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(-c3cccs3)cc2)c1 772985599 SXPWTLXCUWFNBT-UWJYYQICSA-N 376.525 5.947 30 20 GKED COc1ccc(C(=O)/C=C\c2nc3ccc(Br)cc3s2)c(F)c1 773125938 QCVWXRXBCJIJQK-SREVYHEPSA-N 392.249 5.103 30 20 GKED C/C(=C/C(C)(C)C)C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 773980263 PRAJVTKOTBBCSC-HRYDCMBCSA-N 376.456 5.119 30 20 GKED C=CCc1cc(CN[C@@H](C)c2cc3cccc(OC)c3o2)cc(OC)c1OC 776163994 NJPUDSDWICATES-HNNXBMFYSA-N 381.472 5.038 30 20 GKED C=CCC[C@@H](C(=O)O[C@H](C)c1nc(Cc2ccccc2)no1)c1ccccc1 778554043 ZJFLNTJGKGNVNO-YLJYHZDGSA-N 376.456 5.015 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@H](C)C#N)[C@@H](Cc1ccc(F)cc1)C(C)C 780670316 KTIIFKTYBPJFHI-UTKZUKDTSA-N 397.494 5.238 30 20 GKED CCCc1c(NC(=S)Nc2cccc(CC)c2)cnn1-c1cccc(C#N)c1 783954462 VTMBWCNXQASXCB-UHFFFAOYSA-N 389.528 5.068 30 20 GKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccnc1 797943058 MWYCVYJNXVYYOW-IEBWSBKVSA-N 395.915 5.475 30 20 GKED CCOCC1(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CC1 799604261 XDALBWYUVVYPCC-ZDUSSCGKSA-N 395.311 5.110 30 20 GKED COc1cccc(O)c1C=Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 812396098 ZLOHMPOWZUSNNW-GOSISDBHSA-N 376.843 5.460 30 20 GKED N#CCCC[C@H](NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)c1ccccc1 814305217 YDSINMHYPKYVER-NRFANRHFSA-N 392.503 5.110 30 20 GKED N#CCSCCCSC1=NC(=O)/C(=C/c2csc3ccccc23)S1 814771691 CKOSHZJCRIINLK-GDNBJRDFSA-N 390.580 5.252 30 20 GKED O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)[C@H](F)C(F)(F)F 815121305 JNWFLSCROAMLLV-ZDUSSCGKSA-N 381.247 5.337 30 20 GKED Cc1cc(NC(=S)Nc2ccccc2C#N)ccc1NC(=O)OC(C)(C)C 853050712 OAIOJKCXWKNXTE-UHFFFAOYSA-N 382.489 5.023 30 20 GKED Cc1cc(N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc(C#N)c1[N+](=O)[O-] 864007161 RLBXRTMNWMQORY-QGZVFWFLSA-N 375.350 5.135 30 20 GKED O=C(c1csc(Cc2ccccc2)n1)N1CCCSC1=Nc1ccccc1 915132639 GLDVTZIOZBONJV-UHFFFAOYSA-N 393.537 5.001 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1 916000864 WXDQMEIOBUUKNL-IIBYNOLFSA-N 379.529 5.002 30 20 GKED COc1ccc2oc(C)c(C(=O)N(Cc3ccco3)c3ccccc3C#N)c2c1 918583755 KBFCQFCPNZRPPS-UHFFFAOYSA-N 386.407 5.062 30 20 GKED Fc1ccc(-c2nc(CON=Cc3ccccc3Br)cs2)cc1 920760255 ZFPBKMQWQNWWEM-UHFFFAOYSA-N 391.265 5.262 30 20 GKED Cc1ccc(NN=Cc2cccc(O[C@H](C(=O)O)c3ccccc3)c2)c(Cl)c1 1776060857 SFEDKJKBCJVGET-NRFANRHFSA-N 394.858 5.299 30 20 GKED CCC(=NNc1cccc(C(=O)O)c1C)[C@H](C)c1cccc(Br)c1 1776089614 AEBDWVIEXYVHGZ-GFCCVEGCSA-N 389.293 5.437 30 20 GKED COc1ccc2c(c1)CC/C(=C\c1ccc(-c3cccc(C(=O)O)c3)s1)C2=O 1776127589 XSFVNTWFEXFEMW-DTQAZKPQSA-N 390.460 5.334 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C\C(=O)c1ccc(C(=O)O)cc1O 1776365042 LXNRVHLCRREVNR-HJWRWDBZSA-N 376.861 5.140 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cnc(-c2ccc(Cl)cc2)s1 1776785688 RWLSGLPIXYZXHL-KRWDZBQOSA-N 394.968 5.757 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cn(-c2ccccc2Cl)nc1C 1776786898 ANONLRBHDRATNL-SFHVURJKSA-N 391.943 5.128 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C\C(=O)c1ccc(CC(=O)O)cc1 1777341977 KKGQQIQDSNINEO-QBFSEMIESA-N 386.447 5.194 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc([N+](=O)[O-])cc2)cc1OCc1ccccc1 6338619 GCELVWQRLKJJGH-NTUHNPAUSA-N 389.407 5.079 30 20 GKED N#Cc1c(NC(=O)CCN2CCC[C@@H]2c2ccccc2)sc2c1CCCCC2 10088772 JNEMQZAFLDKOGO-HXUWFJFHSA-N 393.556 5.054 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1 15311854 PFRNTHUNXXAKAS-UHFFFAOYSA-N 378.884 5.756 30 20 GKED COc1ccc(Cl)cc1CN(C)C(=O)c1ccccc1-c1ccccc1C#N 25458707 CBTYRZOZHRMDSH-UHFFFAOYSA-N 390.870 5.159 30 20 GKED N#C[C@H](C(=O)c1ccc(Br)cc1)c1nc(-c2ccccc2)cs1 41536297 WWKRJPFIDDAHAX-OAHLLOKOSA-N 383.270 5.063 30 20 GKED N#C[C@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1ccc(C(F)(F)F)cn1 41556537 MTHBVDHRVKDYOY-IBGZPJMESA-N 396.368 5.169 30 20 GKED C=CCN(Cc1csc(-c2ccc(OC)c(OC)c2)n1)Cc1cccs1 60942822 WLMIOLMSCNXXGO-UHFFFAOYSA-N 386.542 5.077 30 20 GKED CC(C)(C)c1ncc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)s1 63236027 ZKIBOJBLEHMVGY-JTQLQIEISA-N 375.906 5.194 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1OC 105226723 LHSXKQHOKZVXID-UHFFFAOYSA-N 399.450 5.056 30 20 GKED CSCCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 124114129 BWHWHMPITSQFAZ-CYBMUJFWSA-N 399.368 5.826 30 20 GKED Cc1coc(-c2cc(NC(=O)c3ccccc3-c3ccccc3C#N)ccc2C)n1 129837749 KJROOPVTBOXELH-UHFFFAOYSA-N 393.446 5.749 30 20 GKED CN(Cc1ccc(C#N)cc1)Cc1cccc(NC(=O)c2ccccc2Cl)c1 131163910 SSVCEVAWYXPRSU-UHFFFAOYSA-N 389.886 5.096 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 155109996 PVLUCORNTOCIBX-INIZCTEOSA-N 384.526 5.455 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 160110222 GZNCJJKGPFQBHY-KRWDZBQOSA-N 395.915 5.833 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)COCc1ccccc1 171838749 QEDBVKSDGAMYSR-ZWKOTPCHSA-N 397.544 5.055 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 173137324 KJEKJATXDYWGLE-ZDUSSCGKSA-N 385.558 5.613 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2ccc(N3CCC(O)CC3)cc2)cc1 210160980 ZUGVMQQRSLPAIG-AUWJEWJLSA-N 393.527 5.113 30 20 GKED Cc1cc(NC(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)n(CCC#N)n1 211211239 XXMJJMYCGKZWJM-NTMALXAHSA-N 396.903 5.139 30 20 GKED CC(=O)N(Cc1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1)C(C)C 255456671 YZTGQSWWPALZGB-UHFFFAOYSA-N 379.287 5.207 30 20 GKED Cc1nc(/C=C/c2cnn(C(C)C)c2)sc1C(=O)/C=C\c1cnn(C(C)C)c1 255619793 GMFKXJKNIKUDSV-MKKAVFGOSA-N 395.532 5.073 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2csc(-c3ccc(C)cc3)n2)c1 303213816 SFXWHQCMDMORGC-UHFFFAOYSA-N 378.497 5.255 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3c(C)noc3C)n2)o1 303677257 YDPVDEPZEAPXHO-UHFFFAOYSA-N 393.390 5.438 30 20 GKED Cc1ccc(C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)c(O)n1 329299658 VENCANZNUXIWCG-UHFFFAOYSA-N 377.488 5.113 30 20 GKED Cc1nc(-c2ccccc2)oc1/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329318863 IJDNUOLAZHNFCF-IBGZPJMESA-N 390.487 5.344 30 20 GKED Cn1nc([C@H]2CCCOC2)cc1N=C(O)c1cc2sc3ccccc3c2s1 329838175 IQCRCLNISXCTRT-LBPRGKRZSA-N 397.525 5.380 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccncc3)cc2)c1 363365457 LSMQBMULZOSIQI-QFIPXVFZSA-N 384.439 5.115 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(NC(=O)c2cccs2)c(C)c1 410343261 FHPMEMKETATVLR-UHFFFAOYSA-N 390.508 5.680 30 20 GKED CCN(CCC1(C#N)CCCCC1)CC(=O)Nc1c(Cl)cccc1Cl 411146559 NLASRVGNXRPUSJ-UHFFFAOYSA-N 382.335 5.118 30 20 GKED COc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C#N)cc2Cl)cc1 426139928 XFLGEYBDLYIUAY-FQEVSTJZSA-N 383.879 5.369 30 20 GKED CCOc1ccc(Cl)cc1CCNC(=O)N[C@H](CCCC#N)c1ccccc1 431451899 VAORDJOXVCWQMC-HXUWFJFHSA-N 399.922 5.016 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc(C2CC2)nn1-c1ccccc1)c1ccccc1 431719467 RAIHPRDNQSDSFF-NRFANRHFSA-N 399.498 5.306 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cc2c(cc1Cl)OCCCO2)c1ccccc1 432699613 NUOWIKKEERBUTI-KRWDZBQOSA-N 399.878 5.058 30 20 GKED Cc1sc(CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)nc1C(C)C 436436625 SUKMDZPESCJJAN-UHFFFAOYSA-N 391.496 5.420 30 20 GKED C=CCC[C@H](NC(=O)CSCc1ccncc1)c1ccc(C(F)(F)F)cc1 441537851 CKISIPSJMSPJHC-SFHVURJKSA-N 394.462 5.157 30 20 GKED C=C(C)CN1CCC(NC(=O)N(C2CC2)[C@@H](C)c2ccc3ccccc3c2)CC1 444697901 QYYXYFCLBZEVOO-IBGZPJMESA-N 391.559 5.115 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@@H]1c1ccccc1Cl 453469913 YTCRJKOYCBSZBQ-MOPGFXCFSA-N 386.927 5.091 30 20 GKED COc1ccccc1CSc1ccccc1NC(=O)NCC(C)(C)CC#N 459463184 LDLDSKAQQGCZQH-UHFFFAOYSA-N 383.517 5.049 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)c1cccc(COc2cccc(C#N)c2)c1 460296965 KJQUKWQASUXOIF-XMMPIXPASA-N 398.506 5.231 30 20 GKED N#Cc1ccc(CCC(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)cc1 462397110 UJCMPAUOOOFXAY-UHFFFAOYSA-N 387.310 5.204 30 20 GKED CCCOc1ccccc1Oc1ncccc1CNc1ccc(F)cc1C#N 462786342 XLZMUFXAHZZPPR-UHFFFAOYSA-N 377.419 5.286 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1nc2ccccc2cc1Cl 463950376 MWQJPHFKKTYPIC-CYBMUJFWSA-N 381.888 5.392 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCC(F)(F)F)c1cc(C(F)(F)F)ccn1 464408777 SFLNZVIJIBANBM-CQSZACIVSA-N 386.295 5.085 30 20 GKED N#C[C@@H](C(=O)c1ccccc1OC1CCCCC1)c1cc(C(F)(F)F)ccn1 464421759 VRFXSZQZVKQLDY-QGZVFWFLSA-N 388.389 5.302 30 20 GKED N#Cc1ccc(SCc2cccc(C(=O)NCc3ccco3)c2)c(Cl)c1 465387758 JYRQBQYXDRMDPN-UHFFFAOYSA-N 382.872 5.027 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@@H](CC(C)C)C1 467708286 CWAMOYOUPRKQMN-FQEVSTJZSA-N 391.515 5.346 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12 471158007 BBYOFVBSVHOHRZ-UHFFFAOYSA-N 396.535 5.233 30 20 GKED CC(C)CCc1nc(CNc2ccccc2Oc2ncccc2C#N)cs1 475169902 BYPQZLRGVUPPHX-UHFFFAOYSA-N 378.501 5.403 30 20 GKED C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)C[C@H](CC#N)c1ccccc1 476305197 JYHKIVYCDLFLAP-HOCLYGCPSA-N 387.310 5.527 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)cc1 476322206 QSUCJAZORDDFSB-OAQYLSRUSA-N 389.886 5.056 30 20 GKED C=CCCCC(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 480561939 ZOLIWNQTZPBKFJ-LJQANCHMSA-N 387.405 5.144 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)CSc1ccc(C#N)cc1 483440186 PUKWQFITKXVORA-UHFFFAOYSA-N 390.533 5.749 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1OC(C)C 489554784 SLJIGANXQKRUPY-SFTDATJTSA-N 377.488 5.086 30 20 GKED N#Cc1ccc(Br)c(CSCc2cc(-c3ccco3)on2)c1 492153211 QFRWBBRXMJEEHW-UHFFFAOYSA-N 375.247 5.002 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H]1CC=C(c2ccc(F)cc2)CC1 498370984 CWUVXBVQFZXSAT-QHCPKHFHSA-N 389.474 5.031 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NCC(=O)NCc1cccc(C#N)c1 498649918 TWTWHFJYJRFWPZ-UHFFFAOYSA-N 393.556 5.020 30 20 GKED C[C@@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(C(F)(F)F)cc1 499330578 UKXGDXVYVZVIPY-HNNXBMFYSA-N 386.417 5.262 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 499493656 XBJRMNDZEAQLHT-LBPRGKRZSA-N 396.409 5.028 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@@H](c2cccc(C)c2)c2ccccn2)c1 499580249 UBTKIJPHQAOYFX-QHCPKHFHSA-N 387.483 5.256 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CCCc3ccccc3)c2)cc1 501425276 SFKHDBFTENKBQI-UHFFFAOYSA-N 384.479 5.293 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2cc(C#N)ccc2OC(C)C)c1 512566155 SFUQRIFEZLQSMM-KRWDZBQOSA-N 380.488 5.183 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C1(c2ccc(F)cc2)CC1 512843842 JYHXCDNFOUOVME-UHFFFAOYSA-N 386.426 5.468 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1cc(C#N)ccc1Cl)c1ccccc1 512935869 MYEFOKMOIANDPL-HNNXBMFYSA-N 376.843 5.604 30 20 GKED C=CCOc1c(Br)cc(-c2nc3cnccc3s2)cc1OCC 513861400 JNLSUWUYYXDISO-UHFFFAOYSA-N 391.290 5.084 30 20 GKED CC(C)Cc1ccc(S(=O)(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518241347 FYIAUADIQOIDNC-MRXNPFEDSA-N 388.558 5.080 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccccc1SC[C@H](C)C#N 519427376 CHDCWBOMCZVDOD-CQSZACIVSA-N 393.537 5.623 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@@H]1CCCc2ccccc21 520194382 RLNHSWJVIFOCAG-OXQOHEQNSA-N 379.529 5.622 30 20 GKED COc1cccc([C@H]2C[C@@H]2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 520704517 PYMKJJRHVLEWCD-YADHBBJMSA-N 384.435 5.101 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 521840659 FSMANEPPLLFBEL-AWEZNQCLSA-N 395.846 5.822 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCSC[C@@H]1c1ccccc1 522458698 URFQOTJDNGBQOY-QFBILLFUSA-N 397.569 5.260 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1c[nH]c2ccc(Cl)cc12 523484415 FVUAHLZKQCFOHD-UHFFFAOYSA-N 379.312 5.294 30 20 GKED Cn1ccc2c(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)cccc21 524708177 CHDQUESVAKTJEJ-UHFFFAOYSA-N 385.398 5.234 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 532810853 WWQZMEQHKPRUGW-QRWLVFNGSA-N 392.890 5.151 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2cccc(C)c2C)n1 534472958 VDAIVLWBJLVMMK-UHFFFAOYSA-N 385.577 5.623 30 20 GKED C[C@H](c1ccco1)N(C(=O)NCc1ccc(-c2ccccc2C#N)cc1)C1CC1 537007536 XGDWUMZFIOZBGK-QGZVFWFLSA-N 385.467 5.253 30 20 GKED CCC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(F)cc1F 542410280 IMNBXIJGAJEVAZ-NRFANRHFSA-N 383.442 5.052 30 20 GKED COc1cc(C)c(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1OC 543874087 VMXJHYLUVMVDCO-GOSISDBHSA-N 386.495 5.402 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1ccc(-c2ccccc2F)o1 557609100 AMVYFMMMZMETKE-UHFFFAOYSA-N 381.451 5.082 30 20 GKED FC(F)(F)c1cc(N[C@H]2CCO[C@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 558113097 DZHUZIDBPJQONB-ONGXEEELSA-N 381.238 5.246 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1nc(-c2ccnc(C(F)(F)F)c2)no1 573167121 WZFVUHMJLFDNLA-GFCCVEGCSA-N 391.246 5.228 30 20 GKED CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@@H]1CCCOC1 593143693 MIMDYGSQMAPVBS-QUCCMNQESA-N 397.906 5.028 30 20 GKED N#Cc1c(NC(=O)c2ccc(OC(F)F)cc2)sc2c1CCCCCC2 603996070 FNTWSLUVUZHDRF-UHFFFAOYSA-N 376.428 5.132 30 20 GKED CCc1c(C)sc(NC(=O)[C@@H](Oc2ccccc2)c2ccccc2)c1C#N 609032586 QRHBEAQTAQWEGO-FQEVSTJZSA-N 376.481 5.249 30 20 GKED CC(C)(C)c1ccc(OCCCC(=O)Nc2ccccc2SCCC#N)cc1 609375447 QVGONLPGSJJAFT-UHFFFAOYSA-N 396.556 5.788 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N[C@@H]3CCCC[C@@H]3c3ccccc3)cc2)nc1 609502189 SSXFLBRDZOZRCP-DHIUTWEWSA-N 397.478 5.202 30 20 GKED Cc1cc(CN(C)C[C@H](C#N)CCC#N)cc(C)c1OCc1ccccc1Cl 609681738 VZZNKFGWQHVLGR-IBGZPJMESA-N 395.934 5.411 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)n2)cc1 609959701 PSBXXNDYHPXGRD-INIZCTEOSA-N 397.843 5.170 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(OC3CCCC3)c2)c(Cl)c1 611093059 UIDHNLIBYJFFMS-UHFFFAOYSA-N 375.255 5.439 30 20 GKED Cc1c(C#N)c(NC(=O)c2ccccc2C(F)(F)F)n(-c2ccccc2)c1C 611466943 FNQBYXREOWDOPP-UHFFFAOYSA-N 383.373 5.237 30 20 GKED C[C@@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1ccc(Oc2ccccc2)c(F)c1 612103153 WTVUOVCFRFDVEP-OPAMFIHVSA-N 381.451 5.014 30 20 GKED C[C@H](c1ccc(F)c(Cl)c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 618447759 BEOBIYLNSMYXGM-MIMYLULJSA-N 377.731 5.603 30 20 GKED CC(C)(CC(F)(F)F)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619128057 CRZMDUWHTDZNGH-UHFFFAOYSA-N 375.275 5.135 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 647373690 MWTGZCIFAVNOQX-AWEZNQCLSA-N 399.928 5.596 30 20 GKED C=CCC1(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCCC1 663678209 IKARFZCKOMFOJK-VXGBXAGGSA-N 386.380 5.084 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccccc1Oc1ccccc1 725852913 LHGNHGWLZDNTRM-FQEVSTJZSA-N 385.511 5.680 30 20 GKED C=CCOc1ccccc1/C=C1\SC(=S)N([C@@H](C)c2cccs2)C1=O 726630830 XSWHIUDZEKYHMR-IGWPVBGESA-N 387.551 5.275 30 20 GKED CCn1nc(C)c(C(=O)/C=C/C2=Cc3cc(Cl)cc(Cl)c3OC2)c1C 726741025 RZCMYHFZPZWJEH-AATRIKPKSA-N 377.271 5.042 30 20 GKED Fc1ccc(-c2nc3c(s2)C(=NNc2ncnc4sccc24)CCC3)cc1 727682938 AFPBYOHOUYAEKZ-UHFFFAOYSA-N 395.488 5.106 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2ccc(-c3cnco3)cc2)c1 728182171 ZJVQTSPULBJQGN-UHFFFAOYSA-N 384.460 5.231 30 20 GKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 728770162 OLTCBMKGUISXGW-NHCUHLMSSA-N 399.519 5.688 30 20 GKED Cc1cccc(COc2ccc(NC(=S)Nc3ccccc3C#N)c(C)c2)c1 729821498 QVSSYRRYYAZXHY-UHFFFAOYSA-N 387.508 5.563 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C)c3)cc2C)cc1 729845813 JDUNTZQWHQRBON-UHFFFAOYSA-N 388.467 5.115 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@@H](C#N)c1nc2ccccc2s1 729891062 XBAWZNIIWPZYCT-QFPYFPQMSA-N 376.481 5.363 30 20 GKED CN(Cc1cccc(N=Cc2c(O)ccc3ccccc23)c1)Cc1cscn1 731938571 VHDGLHQJNUUXCO-UHFFFAOYSA-N 387.508 5.385 30 20 GKED Cc1nc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cs1 733679449 IIYQELOOIHRVTM-OAHLLOKOSA-N 387.917 5.038 30 20 GKED CCCCOc1ccc(NC(=O)NCc2cccc(O[C@H](C#N)CC)c2)c(C)c1 733843394 HCSRFCBQXBLNCR-IBGZPJMESA-N 395.503 5.177 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2-c2cccs2)c1 733843823 WFOJJTUOCVQSFT-QGZVFWFLSA-N 391.496 5.418 30 20 GKED C=CC[C@@H](NC(=O)NCCSCc1cccc2ccccc12)c1ccncc1 734661265 KYSRHNGJBJLHNC-JOCHJYFZSA-N 391.540 5.085 30 20 GKED CS[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccc1 740535282 LUKZVNQIICNWKJ-YLJYHZDGSA-N 378.522 5.399 30 20 GKED CCOCCOCc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1C 745977425 VOMBBMRKBSYNKL-UHFFFAOYSA-N 382.287 5.311 30 20 GKED COc1cccc(-c2nc(/C=C/C(=O)c3ccc(-c4ccncc4)cc3)cs2)c1 745990847 ZGHKDBZWJZGWAF-MDZDMXLPSA-N 398.487 5.777 30 20 GKED CCOCc1cc(/C=C2\CCc3[nH]c4ccc(F)cc4c3C2=O)ccc1OC 747612621 GXBBNRUHGHYFDS-XNTDXEJSSA-N 379.431 5.065 30 20 GKED Cc1cc(C(=O)N[C@H](CCC#N)c2ccccc2)c(C)n1[C@H](C)c1ccccc1 749045942 QUTMFVQXYPIBSU-NTKDMRAZSA-N 385.511 5.489 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccccc3OC(C)C)n2)cc1 749047335 FSAMUCAXUJWLRN-LJQANCHMSA-N 390.508 5.325 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 754887457 AEGCVIMJDFFBSW-JTSKRJEESA-N 385.467 5.693 30 20 GKED N#Cc1cc(NC(=O)[C@H]2C[C@@H]2c2ccc3ccccc3c2)c(Cl)c([N+](=O)[O-])c1 764307829 VPYXTCKMNSPPKD-SJORKVTESA-N 391.814 5.015 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCC[C@@H]2c2cccc(Br)c2)cc1 768420239 ACSQYFJCBVPTCT-MGPUTAFESA-N 385.305 5.077 30 20 GKED C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Br)cc(Cl)c1O 787034902 UJUZKQSDQGPSCE-BMLIUANNSA-N 391.696 5.018 30 20 GKED C=CCC[C@@H](NCc1cccc(Br)n1)c1ccc(C(F)(F)F)cc1 794461707 GZOWAYBVYGALRV-MRXNPFEDSA-N 399.254 5.660 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(C(C)(C)C#N)cc1 796036737 MZSSGTUGZGMHLU-QGZVFWFLSA-N 392.499 5.104 30 20 GKED CCN(C(C)=O)c1nc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cs1 797051415 OESVRWPFIVGTNF-KAMYIIQDSA-N 392.480 5.204 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(COc2ccc(Cl)nc2)CC1 800576815 YGARCYYGHRTXKN-UHFFFAOYSA-N 399.922 5.177 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)sc2cc(F)ccc12 805865922 DRGFZLRNQYSFTI-OAHLLOKOSA-N 393.468 5.357 30 20 GKED O=C(CCCC(F)(F)F)O[C@@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F 809126746 XLJABGKUEQZBNZ-NSHDSACASA-N 382.222 5.585 30 20 GKED C=CCC1(C(=O)O[C@@H](C)c2sc(Cc3ccccc3)nc2C)CCOCC1 820098830 VNSOTQDFEVYKHE-KRWDZBQOSA-N 385.529 5.019 30 20 GKED C#C[C@](C)(CC)NCc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 852100820 JPDYFFUYDFWTGP-GOSISDBHSA-N 396.343 5.026 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c1 912773359 LZOPBOUMDQDZLM-NTMALXAHSA-N 392.436 5.178 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2cccs2)cc1 915352172 ILLOVKKNNMLUSH-NHCUHLMSSA-N 387.508 5.773 30 20 GKED CC(C)c1ccc(C(=O)/C=C\c2cc3ccccc3nc2N2CCOCC2)cc1 916132617 LEMVSTBZSYKHET-QXMHVHEDSA-N 386.495 5.091 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 916708042 GYMMQNUUGWSGFA-HNAYVOBHSA-N 391.421 5.503 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCSc3ccccc3F)n2)cc1 916975351 YFVHFCDOIWCWIR-INIZCTEOSA-N 396.512 5.616 30 20 GKED CC(F)(F)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 916995698 COTYWNHMUIINQL-LLVKDONJSA-N 389.254 5.729 30 20 GKED N#CCCCOC(=O)c1cc(-c2ccccc2)nc2cc(Br)ccc12 919593603 GQZKUBIQOQHNDB-UHFFFAOYSA-N 395.256 5.125 30 20 GKED Cc1nc(NC(=O)Nc2cccc(OCCCC#N)c2)sc1-c1ccccc1 920939115 TUJBEUGONMAOOY-UHFFFAOYSA-N 392.484 5.445 30 20 GKED CC(=NNc1cccc(C(F)(F)F)c1)c1oc2cc(C)ccc2c1CC(=O)O 1776014924 OTESUEISEZPALU-UHFFFAOYSA-N 390.361 5.223 30 20 GKED CCc1ccc(-c2ccc(/C=C(\C(=O)C(=O)O)c3ccc4ccccc4n3)o2)cc1 1776115847 DDGKFJSJHCRNDS-HKWRFOASSA-N 397.430 5.252 30 20 GKED CC(C)COc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776332917 MFYLDRVGDPEWBN-LFYBBSHMSA-N 390.435 5.576 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(-c2ccccc2)cs1 1776354811 ZBFISMCSIHYLGL-KTKRTIGZSA-N 392.476 5.797 30 20 GKED CCCCCCCOc1cccc(CNCC[C@@H](CC(=O)O)C(F)(F)F)c1 1776788693 MOZOLPQVQLHGGG-KRWDZBQOSA-N 389.458 5.169 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccsc3)CCC2)cc1 1791243464 ODBGOTFRINBKSJ-SCBHQAGPSA-N 394.540 5.108 30 20 GKED CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)C1(C#N)CCCCC1 63633768 BKXPZPRVZRQIFT-UHFFFAOYSA-N 397.494 5.126 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc(OC(F)F)cc1 71923675 VRWMIBFTEWAMFE-FMIVXFBMSA-N 381.378 5.158 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 103438928 YBOYGKBNFPWJSI-UHFFFAOYSA-N 391.858 5.083 30 20 GKED C[C@H](Nc1ccc(Cl)c(C#N)n1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 111218034 FPFIJGNGQFBRQH-ZDUSSCGKSA-N 394.837 5.171 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)(F)F 115769750 UZKJDALQNDJVBM-SUMWQHHRSA-N 393.434 5.506 30 20 GKED CC(C)C[C@H](C)OCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 120777647 BZNBXWFURYNWNZ-KBPBESRZSA-N 392.471 5.106 30 20 GKED N#CCCN(C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)C12CC3CC(CC(C3)C1)C2 133742420 AQQRVAJQBMJDPZ-JFNPMQPZSA-N 382.470 5.066 30 20 GKED N#C[C@@H](C(=O)c1cnc2ccc(F)cc2c1)c1nc2cc(Cl)ccc2s1 178989353 IUXAHYVFMGJBHA-AWEZNQCLSA-N 381.819 5.127 30 20 GKED N#CCCn1cc(CNc2ccccc2N2CCCCCC2)c(-c2ccccc2)n1 180867125 MIZJEJSXSYZISS-UHFFFAOYSA-N 399.542 5.456 30 20 GKED C=CCn1c(S[C@@H](C)c2noc(-c3ccccc3)n2)nnc1-c1ccccc1 189444740 UZHKVQPVDDLWOZ-HNNXBMFYSA-N 389.484 5.034 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1cccc(O)c1)C(=O)c1ccccc1 213678342 WXXLRKDIFFGGEE-QJOMJCCJSA-N 399.490 5.422 30 20 GKED Cc1ccc(C[C@H](Nc2nc(C(F)(F)F)ccc2C#N)c2ccccn2)cc1 301274833 IOFJPSLHSXMSLY-SFHVURJKSA-N 382.389 5.071 30 20 GKED CC(C)c1nc([C@@H]2CCCCCN2C(O)=Nc2cccc3ccccc23)no1 329586216 YIBSGYFUULVNKV-IBGZPJMESA-N 378.476 5.509 30 20 GKED O/C(=N/[C@@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F)c1csc(O)n1 329977999 GTEUQKAMCOLNMD-TZMCWYRMSA-N 384.423 5.289 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(C(=O)OC(C)(C)C)c1 410321573 DGMLPHWEDSMPQA-MRXNPFEDSA-N 382.529 5.648 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccccc1CN(C(=O)[C@@H](C)CC(=C)C)C(C)C 411086565 OVPMYEQWSGYRAJ-PMACEKPBSA-N 384.564 5.567 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc2nc(C3CC3)sc2c1 425640765 QUIBGETYSDMSTF-CYBMUJFWSA-N 376.485 5.270 30 20 GKED COc1cccc([C@H](NCc2cccc(F)c2C#N)c2ccccc2Cl)c1 427434589 KASNUYYLPOLSII-QFIPXVFZSA-N 380.850 5.239 30 20 GKED N#CCSc1cccc(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)c1 429870381 SASANQZXIKPZKQ-NRFANRHFSA-N 392.911 5.475 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1C[C@H](C)C[C@H]1c1ccc(C(F)(F)F)cc1 431947495 AAQWAPZBUXMDHM-YJYMSZOUSA-N 387.405 5.501 30 20 GKED N#CCCC[C@H](NCC(=O)N[C@@H](c1ccccc1)C1CCCC1)c1ccccc1 433020664 OIZJXWGJFPEXLJ-ZCYQVOJMSA-N 389.543 5.059 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Br)c(Cl)c2F)cc1 435619394 XXKUJTKYDAHKSO-UHFFFAOYSA-N 395.659 5.295 30 20 GKED N#C[C@@H](NC(=O)C1CCC(C(F)(F)F)CC1)c1cccc(Cl)c1Cl 436019727 COQVHXPASZFYHS-SRHKJQAYSA-N 379.209 5.043 30 20 GKED CC1(C)[C@@H]2CN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)c(Cl)c3)C[C@H]21 437900548 ZSJSYBLCKAOSRF-IAGOWNOFSA-N 381.863 5.124 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@@H](C)CCC[C@@H]2C)cc1 438219454 YIGPYYPDTWZPHR-IRXDYDNUSA-N 393.487 5.402 30 20 GKED Cc1ccc(CNC(=O)N[C@H](CCC#N)c2ccccc2)c(OC(C)(C)C)c1 438851762 ZGMVJNPPFBKORL-HXUWFJFHSA-N 379.504 5.017 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 439397818 QXZUGSBPQDDJQV-HSZRJFAPSA-N 396.450 5.517 30 20 GKED CC(C)[C@H](NC(=O)NCC1CCC(C#N)CC1)c1cccc(C(F)(F)F)c1 440990933 VRVDMXYOBUYBAH-JMLCCBQJSA-N 381.442 5.032 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2cscn2)c1)c1nc2cc(Cl)ccc2s1 442672242 PVJDALGGSOMIHM-AWEZNQCLSA-N 395.896 5.563 30 20 GKED C=CCn1c(SCc2nc(C(F)(F)F)cs2)nnc1-c1cccc(C)c1 443449987 CZGFZTWNXVSXRM-UHFFFAOYSA-N 396.463 5.207 30 20 GKED N#CCc1ccc(NC(=O)NCC[C@@H](c2ccccc2)C(F)(F)F)c(Cl)c1 455727674 GJCBSYYHASTIIG-HNNXBMFYSA-N 395.812 5.264 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@H]1c1cccc(Cl)c1)c1ccccc1 458797739 GPVZBUMLGIUQAL-RTWAWAEBSA-N 381.907 5.622 30 20 GKED N#CCCC[C@@H](NC(=O)N1[C@H]2C=C(c3ccccc3)C[C@H]1CC2)c1ccccc1 458848961 SPSMHWWEHLSRRU-WXFUMESZSA-N 385.511 5.451 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464473567 SKUUJJHTVDOMMK-INIZCTEOSA-N 390.430 5.649 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466239585 DMPXFCGDLRKPST-HXUWFJFHSA-N 390.499 5.384 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 466894557 SSSHIJWZFRBKKA-AVRDEDQJSA-N 397.478 5.154 30 20 GKED CC(C)OCc1cccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1 469139860 ZPXLXVFZQPYZFR-UHFFFAOYSA-N 375.472 5.122 30 20 GKED COc1ccc(N(Cc2cccs2)C(=O)C[C@@H](CC#N)c2ccccc2)cc1 475931914 IYLJNHAJIGWIDI-LJQANCHMSA-N 390.508 5.377 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1cccc(Br)c1 476141286 HUADKPMPQFMNCM-UXHICEINSA-N 398.344 6.043 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccc([N+](=O)[O-])cc1)c1ccccc1)c1ccccc1 476209238 QHVHBSKGPYNADG-OAQYLSRUSA-N 399.450 5.216 30 20 GKED C=CCCCC(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)cs1 478525287 CIELNFAWQDLZMU-LBPRGKRZSA-N 379.323 5.106 30 20 GKED CC(C)N(C)c1ccc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 480300633 KGXBBGOYLJYYSC-IBGZPJMESA-N 384.527 5.316 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC[C@H](C)C1 480603604 SQVAPACMJZFMJW-KRWDZBQOSA-N 377.488 5.100 30 20 GKED C=C(C)[C@H](N[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccc(F)c(F)c1 481627019 MVOBXFVVLSIISZ-KKSFZXQISA-N 386.486 5.631 30 20 GKED CCC(CC)CN(CCC#N)Cc1nnc(-c2c(Cl)cccc2Cl)o1 484905062 BIHGRKUIIZARQV-UHFFFAOYSA-N 381.307 5.195 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1 485416132 SCUMKAXNCGRKKR-UHFFFAOYSA-N 397.563 5.159 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(-c2c(F)cccc2F)n1)c1ccccc1 487294011 CBLXYDPHRZYMKM-KRWDZBQOSA-N 397.450 5.253 30 20 GKED N#C[C@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(Cl)cc1 499814179 QRJSILULEXCHGO-NRFANRHFSA-N 392.911 5.627 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)cc1 499849964 WTZUEAPVHJWWKM-BLLLJJGKSA-N 379.312 5.164 30 20 GKED CCCN(CC1CC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 508277674 IBFAETCJISUMBX-UHFFFAOYSA-N 379.460 5.013 30 20 GKED C=C(C)[C@H](NCc1nc2cc(Br)ccc2o1)c1ccc(F)c(F)c1 509133760 BFKZTLLNPHOERH-SFHVURJKSA-N 393.231 5.276 30 20 GKED CCN(C(=O)c1cc(-c2cccc(Cl)c2)on1)[C@H](C)c1ccc(C#N)cc1 509600750 FEINWBGOBNCTHF-CQSZACIVSA-N 379.847 5.090 30 20 GKED CCN(C(=O)c1sc(-c2ccc(F)cc2)nc1C)[C@H](C)c1ccc(C#N)cc1 509605289 YGTCMSBOMWHPAN-OAHLLOKOSA-N 393.487 5.353 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 511545916 OEBDWPIKNJRFAZ-SFHVURJKSA-N 380.385 5.217 30 20 GKED N#C[C@@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(F)cc1 511700800 ZFLBPMMZZDHOGW-OAQYLSRUSA-N 376.456 5.113 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)s1 512545814 XHCIIQSSVFMRKH-STQMWFEESA-N 393.965 5.926 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@H](C)c1nnc(-c2ccccc2F)s1 512552163 JWYSGRPJSBBHHF-MRXNPFEDSA-N 399.539 5.261 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCOc2c(Cl)cccc21 516686445 ZNJQPJANCXLMRX-OAHLLOKOSA-N 397.327 5.276 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(Cl)c(Cl)c3)cc2)nc1 518907009 HVSLQAPVAWUISW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CC[C@@H](CC(=O)NC(Cc1ccccc1)Cc1ccccc1)c1ccccc1 530421721 WPJSIDIEOPUFMS-DEOSSOPVSA-N 382.507 5.044 30 20 GKED C=C(C)CN(CC)C(=O)CSCc1coc(-c2ccc(C(F)(F)F)cc2)n1 535139700 ZDGKHMXNISKRKK-UHFFFAOYSA-N 398.450 5.018 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1cccc(OCCCC#N)c1 538527502 MGPSKZLHHZQKPL-HNNXBMFYSA-N 395.503 6.113 30 20 GKED C=CCC[C@@H](NCc1csc([C@H](C)OC)n1)c1ccc(C(F)(F)F)cc1 539335578 HJDLXCVKUDDGDW-SUMWQHHRSA-N 384.467 5.666 30 20 GKED COc1ccc(Oc2ccc(NCc3cccc(OCCCC#N)c3)cn2)cc1 539707902 RNSJRMCGJXFDQS-UHFFFAOYSA-N 389.455 5.177 30 20 GKED Cc1nc2ccccc2nc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542943673 QBKLOWZVNSMFLG-KRWDZBQOSA-N 378.479 5.328 30 20 GKED C[C@H](NCc1cc(-c2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543874450 WCQUTOVUZRGYTH-SFHVURJKSA-N 379.463 5.731 30 20 GKED C=CCOCCCC(=O)Nc1ccc(-c2nc3cc(F)ccc3s2)cc1C 544340230 IZIKFTMTICQZSG-UHFFFAOYSA-N 384.476 5.332 30 20 GKED C[C@H](Oc1ccccc1)c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 545733648 MJBOAVHOUVZZJB-QOHRORDFSA-N 384.439 5.248 30 20 GKED N#C[C@@H]1CN(C(=O)c2sc(C3CC3)nc2-c2ccccc2)C[C@H]1c1ccccc1 553817048 NAMVNNCFEHCYCA-UXHICEINSA-N 399.519 5.067 30 20 GKED N#Cc1ccc2ncc(CN[C@H](c3ccc4c(c3)CCCC4)c3cccs3)n2c1 556595148 BKCXLSSEICPZTG-XMMPIXPASA-N 398.535 5.025 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(C)n(-c4ccccc4)n3)n2)cc1 558731694 HNSPHMFBUCADOA-IBGZPJMESA-N 398.491 5.103 30 20 GKED N#CCCN(C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1ccc(F)cc1 561916665 UGZTVLSARUYGNG-UHFFFAOYSA-N 375.447 5.136 30 20 GKED CC(C)c1scnc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 573603296 VBRHTTAYWYWWSO-UHFFFAOYSA-N 381.432 5.322 30 20 GKED Cc1nc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)ccc1-c1ccccc1 580803436 KCZLRKNQGZQVMB-PKTZIBPZSA-N 396.494 5.361 30 20 GKED COC(=O)[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cccc(Cl)c1 583405018 VBIMSMNWRUDHSP-NRFANRHFSA-N 392.842 5.330 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2OC(C)(C)C1 588996103 VHEZCCBKQJCKRT-INIZCTEOSA-N 395.528 5.143 30 20 GKED N#CCCCCC(=O)N(Cc1ccccc1)Cc1ccc(Br)cc1 594002603 RRPKCKVFKRUTEL-UHFFFAOYSA-N 385.305 5.062 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(Oc3cccc(Br)c3)cc2)C1 597913983 SLBYXTCERCFIMF-HNNXBMFYSA-N 399.288 5.007 30 20 GKED CC(C)c1ccsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 609164452 OTOXCFYZFALGNJ-IBGZPJMESA-N 394.927 6.433 30 20 GKED CC(C)Oc1ccc(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)c(C(F)(F)F)c1 609212788 XHRJKPKXSBGVNO-ZDUSSCGKSA-N 391.393 5.247 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1cccc2ccccc12 609434677 INIIJDVGNLLMFV-IRXDYDNUSA-N 389.524 6.117 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1 609460844 BRPCNBRFUACNNA-MEDUHNTESA-N 397.689 5.104 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1c(F)cccc1F 609500224 WQKRURZXSSIPQP-OAHLLOKOSA-N 392.405 5.314 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 609695015 SNODNRVHDLYJPG-MRXNPFEDSA-N 375.497 5.046 30 20 GKED C[C@H](SCCC(=O)Nc1ccc(Br)cc1)c1ccc(C#N)cc1 609825665 LHDYBNMYUVXTKL-ZDUSSCGKSA-N 389.318 5.144 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](C)c2cccc(C)c2)cc1 610043116 FMNAWIVSZVQQRO-KRWDZBQOSA-N 386.451 5.410 30 20 GKED CCN(C(=O)N[C@@H](C)c1cccc(C#N)c1)[C@@H](Cc1ccc(F)cc1)C(C)C 610406607 GIQJQWPUCFZZKM-JTSKRJEESA-N 381.495 5.057 30 20 GKED C[C@@H](NC(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1cccc(C#N)c1 610947437 GKDRNECKVMIULP-OAHLLOKOSA-N 399.947 5.239 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCC3)c1nc(-c2ccccc2)cs1 613392149 KREWMLOOHWKDAY-IBGZPJMESA-N 397.503 5.660 30 20 GKED Cc1ccc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(F)c1 622485541 QIKXKDPHFHPKIX-CQSZACIVSA-N 379.275 5.186 30 20 GKED CC(C)n1cc(NC(=O)c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cn1 668018393 KVSYWEHQQDKVBZ-UHFFFAOYSA-N 397.294 5.006 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(F)cc2F)n1)c1ccccc1 674869812 KWJNWCFTLUECDB-UHFFFAOYSA-N 399.466 5.299 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(OC)cc3OC)s2)cc1 727974560 KKUPAIXQFCBISY-WQLSENKSSA-N 395.480 5.040 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3sccc3SC(F)F)c2C#N)C1 730468618 BZXGMXFAKQVEAD-QMMMGPOBSA-N 384.498 5.373 30 20 GKED Cc1cccc(-c2noc(CSCc3cc(Cl)ccc3OCC#N)n2)c1 735317676 FAVRGBXLMMXKKJ-UHFFFAOYSA-N 385.876 5.034 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(C)cc1 739154898 FXYPKIZHSYWITQ-NVXWUHKLSA-N 381.426 5.500 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=S)Nc3cccc(Cl)c3)c2)s1 739437059 ICAQBKLEUSLTSC-UHFFFAOYSA-N 383.929 5.427 30 20 GKED CSc1ccccc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740429522 KHKWAXVELBEFIF-UHFFFAOYSA-N 379.510 5.330 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2nccn2Cc2ccccc2)cc1 741470772 VGXATXMHVZYLOX-NXVVXOECSA-N 394.474 5.503 30 20 GKED C[C@@H](ON=Cc1ccccc1OC(F)F)c1nnc(-c2cccc(Cl)c2)o1 741753052 QOAUXJBKJOSGQN-LLVKDONJSA-N 393.777 5.103 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746658011 ALLUSSLCAWMESQ-JWQCQUIFSA-N 397.522 6.347 30 20 GKED O=C(O)CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3)s2)c1 746685189 ZOXRAEKIAKOWLI-KTKRTIGZSA-N 378.449 5.165 30 20 GKED Cc1cccc(-c2nn(CN(CC#N)C3CC3)c(=S)n2[C@@H]2CCCC[C@@H]2C)c1 747789456 YHFBEJWGZGDWOC-FXAWDEMLSA-N 395.576 5.086 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCc3cccc(F)c3F)n2)cc1 750394305 FJJRHRIISUIHIS-MRXNPFEDSA-N 382.435 5.206 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2c(C)nn(CC)c2C)cc1OCC 750907897 BSHSDQYLXRYXLG-KTKRTIGZSA-N 390.911 5.257 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)CCc1c(C)nn(CCC#N)c1C 751256921 IFORDISIYITRND-UHFFFAOYSA-N 398.576 5.184 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2cc(C)ccc2C)c1 762041065 CUCDKMZQPLWRQS-REWPJTCUSA-N 391.515 5.031 30 20 GKED CC[C@@H](CC#N)NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 762720108 WQTBVCDQPMPOFU-IBGZPJMESA-N 382.463 5.355 30 20 GKED C[C@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1F 764751704 CWPXMPSDCIWIAU-MRVPVSSYSA-N 396.249 5.034 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CCC[C@H]2c2ccsc2)c1=S 764888615 HOHFNUZYIAPTRJ-HNNXBMFYSA-N 388.587 5.185 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1ccc(F)cc1Cl 767754492 PWLWMNNCJZIQOY-UHFFFAOYSA-N 397.862 5.108 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1cccc(Br)n1 777915897 AMDMUDIZGDUCOO-KHPPLWFESA-N 385.286 5.172 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2snc(Cl)c2C#N)on1 778012327 FFLSWMZYDLGGAO-UHFFFAOYSA-N 396.859 5.097 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c[nH]nc3-c3ccccc3)cc2)c1 779595232 WCPMITVWTIRHKY-UHFFFAOYSA-N 380.451 5.139 30 20 GKED Cc1c(-c2ccccc2)oc2c(C(=O)OCC3(C#N)CCCC3)cccc2c1=O 780532102 MPIVVFNRVMMKKD-UHFFFAOYSA-N 387.435 5.009 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1ccc(C#N)cc1F 781108261 OIUMKQDLZHKXCO-KTKRTIGZSA-N 393.849 5.109 30 20 GKED C[C@H](Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(C#N)cc1F 781422354 OREFTALPHPBJRH-HNNXBMFYSA-N 377.488 5.495 30 20 GKED Cc1c(C(=O)O[C@H](c2ccccn2)C(F)(F)F)ccc(C(F)(F)F)c1F 785894610 TYXRRAQHIUOFLT-CYBMUJFWSA-N 381.247 5.008 30 20 GKED Cc1c(C(=O)/C=C\c2cccc(OCc3cccc(C#N)c3)c2)cnn1C(C)C 787186928 PXMGXVOZDKTODH-KHPPLWFESA-N 385.467 5.119 30 20 GKED CCC(=NNc1nnc(-c2ccccn2)s1)c1ccc(Cl)cc1Cl 788027526 MDAOMKGIGJOANK-UHFFFAOYSA-N 378.288 5.133 30 20 GKED N#Cc1cc(NC(=S)Nc2ccc(F)c(Cl)c2)ccc1OC(F)(F)F 799511700 RNAWSOWDHXWUCF-UHFFFAOYSA-N 389.761 5.058 30 20 GKED N#Cc1ccc(/C=C2\CCc3ncc(C(F)(F)F)cc3C2=O)c(C(F)(F)F)c1 811693475 JEUQMYCYPVSKBR-WUXMJOGZSA-N 396.290 5.203 30 20 GKED CC(C)(C)OC(=O)N1CCC(CCN[C@@H](CCCC#N)c2ccccc2)CC1 814304552 NUKRMSFXKDOEIM-NRFANRHFSA-N 385.552 5.048 30 20 GKED N#C[C@H](C(=O)[C@H]1CC[C@@H]1c1ccc(Cl)cc1F)c1cc(C(F)(F)F)ccn1 835455457 NBYRTHLTZQJLHO-SNPRPXQTSA-N 396.771 5.263 30 20 GKED C=CCCC[C@H](C(=O)NC12CCC(C(F)(F)F)(CC1)CC2)c1ccccc1 883982999 ROLKOOXXSANHGZ-PELRDEGISA-N 379.466 5.898 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CC(NC(=O)OC(C)(C)C)C1 907677789 SFKRYHIUALMWSN-UHFFFAOYSA-N 386.536 5.170 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)Cc2ccc(Cl)nc2)s1 915311771 QTZJVVPSDGRABM-UHFFFAOYSA-N 395.960 5.153 30 20 GKED COc1cc(/C=C\C(=O)c2ccccc2)ccc1OCc1ccc([N+](=O)[O-])cc1 916134557 YXNZGCPAHUSCFI-LCYFTJDESA-N 389.407 5.079 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)n1-c1ccc(F)cc1 916848605 FMZYDOMKQNDXGX-OAQYLSRUSA-N 383.426 5.272 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 918034679 VECOYZBSSGOTQY-QHCPKHFHSA-N 399.469 5.701 30 20 GKED CN(C)c1ccc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)cc1 918712278 IDNNPGBYZUGQER-GHXNOFRVSA-N 398.915 5.338 30 20 GKED C=CCOc1ccc(/C=C\c2cc(C(=O)O)c3ccc(F)cc3n2)cc1Cl 1776183936 KZMUOSATURKPKJ-UTCJRWHESA-N 383.806 5.461 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1cc(Br)cc(C(=O)O)c1)CC2 1776374636 NGVKREUMKKSATP-APSNUPSMSA-N 399.284 5.483 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C\C(=O)c2csc(C(=O)O)c2)cc1 1776869235 GMKGFAIAHOWTBT-RAXLEYEMSA-N 391.492 5.369 30 20 GKED Cc1nc(CSc2ccccc2C(=O)N[C@@H](C)c2ccc(C#N)cc2)cs1 26126684 LDYDSLQNMBPVNI-AWEZNQCLSA-N 393.537 5.107 30 20 GKED Cc1ccc(N(CCC#N)C(=O)CSC2=Nc3ccccc3CS2)cc1C 29515264 PDSAWICLYGVKTC-UHFFFAOYSA-N 395.553 5.218 30 20 GKED N#C[C@@H](C(=O)c1cccc(Br)c1)c1nc(-c2ccccc2)cs1 42654285 ZKNWZZSWOPRZAE-HNNXBMFYSA-N 383.270 5.063 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccccc2Cl)on1)c1nc2ccccc2s1 48823676 ZMSTYTJSRDIKRH-LBPRGKRZSA-N 379.828 5.095 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c(C)c1 60127419 WKAHFNJPXSFKEL-GOSISDBHSA-N 385.467 5.407 30 20 GKED CN(CCCCCc1cc(-c2cccc(F)c2)no1)Cc1ccc(C#N)cc1 63764039 KBXWUUPNDJSARM-UHFFFAOYSA-N 377.463 5.197 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cc(Cl)ccc1SC 64562696 MUGHBCXITOOMFR-UHFFFAOYSA-N 376.909 5.291 30 20 GKED C=CCN(C(=O)c1ccc(C#N)c(Cl)c1)c1nc(-c2ccccc2)cs1 153648165 SSXJLNZTJYOUJK-UHFFFAOYSA-N 379.872 5.168 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2-c2nc3ccccc3s2)c(F)c1 153740848 QXQOCVKNIKRVOY-UHFFFAOYSA-N 391.402 5.365 30 20 GKED CCSc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1 154390880 CNJOSPSDTBIIGC-SFHVURJKSA-N 389.505 5.284 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1c(C)noc1C 160972548 MITFPPYRYPKCCJ-IBGZPJMESA-N 375.428 5.088 30 20 GKED COc1cc2c(cc1OC)[C@H](c1cccs1)N(CCCC(C)(C)C#N)CC2 174809624 UCNQUHRMCDJWSI-OAQYLSRUSA-N 384.545 5.043 30 20 GKED CCOc1ccc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)c(C(F)(F)F)c1 183825671 QRJJLHXFKVIGSB-LBPRGKRZSA-N 393.365 5.039 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1cccnc1 185221161 OMNMYGUBXVNOPL-JTDSTZFVSA-N 380.517 5.091 30 20 GKED COc1ccc(/C=C/C(=O)c2cc3cc(Br)ccc3o2)cc1OC 196394186 HLHAZASRIPQXCD-ZZXKWVIFSA-N 387.229 5.109 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1ccc(OC(F)F)cc1 210112874 PKCLJFSSCDSGMK-RAXLEYEMSA-N 381.378 5.158 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2oc3c(ccc4ccccc43)c2C)cc1 302223523 ULNSAYATYSYQSH-UHFFFAOYSA-N 398.462 5.854 30 20 GKED Cc1cc(SC2CCCCC2)ccc1N/C(O)=N/C[C@@H]1CCc2nccn2C1 329851322 SYKGYPKYHOGCGJ-KRWDZBQOSA-N 398.576 5.205 30 20 GKED OC1=Nc2ccccc2O[C@H]1C/C(O)=N/[C@H]1CC2(CCCC2)Oc2ccccc21 330165156 WQZBLRMBXSYZCR-PXNSSMCTSA-N 392.455 5.219 30 20 GKED CSc1ccc([C@H](C)NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 410239167 ROYYZTIETGFQQW-INIZCTEOSA-N 377.513 5.158 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2c(F)cccc2F)CCC1 421455221 GJEQMPJIOCSYQU-CQSZACIVSA-N 386.467 5.277 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430592970 OADHEEMXELQZQJ-AEFFLSMTSA-N 391.540 5.536 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccn1)N[C@H](CC(F)(F)F)c1ccc(F)cc1 434229970 UWKMOKSJIMEVNL-GFCCVEGCSA-N 395.278 5.055 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 438509450 XYTIPQXLAXOTRC-UHFFFAOYSA-N 391.471 5.352 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(OCc3cccnc3)c2)CCCC1(C)C 444850358 RHBAIELITBAOCK-OAQYLSRUSA-N 379.504 5.259 30 20 GKED N#CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 452142068 WOVGPWGHDFPSKL-NLWGTHIKSA-N 386.417 5.360 30 20 GKED C[C@H](c1ccc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cc1)C(F)(F)F 453564371 GWIXDSDHVGJAFG-YGRLFVJLSA-N 386.295 5.256 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)C1 454285162 WSKAJRWCXXLPCE-WMZOPIPTSA-N 390.512 5.091 30 20 GKED Cc1cc2c(cc1C)O[C@@H](C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1C)C2 463138963 FWHRMKQXQGRYKP-XMMPIXPASA-N 398.462 5.218 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(OC4CCC4)cc3)cc2)c1 463480853 IBUIZSJYWXIFMP-UHFFFAOYSA-N 398.462 5.321 30 20 GKED CS[C@@H](C)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 464297895 UHSCMEVYHRYHAH-NSHDSACASA-N 380.391 5.059 30 20 GKED CCO[C@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1=CCCC1 465172828 YATLSHJRCBBCBJ-JOCHJYFZSA-N 376.456 5.195 30 20 GKED C[C@@H](c1ccccc1Br)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474693466 IPHMISVUYJXHDY-RDJZCZTQSA-N 385.305 5.056 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](COc2ccccc2)C1 475551379 TWZVFUXZIBLHPP-LJQANCHMSA-N 378.516 5.471 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Cl)ccc1OC1CCCC1)c1ccccc1 476831849 UKZIDVSEXNQEBW-QGZVFWFLSA-N 382.891 5.687 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccccc1 477082065 AWBRZLIYLIMQPL-UGSOOPFHSA-N 398.787 5.286 30 20 GKED C=CCN(CC(=O)Nc1c(Cl)cccc1C(F)(F)F)CC1CCCCC1 484514072 LURHDXIVPCBYSW-UHFFFAOYSA-N 388.861 5.366 30 20 GKED Cc1cccc(C)c1NC(=O)CCCSCc1ccccc1C(C)(C)C#N 486743749 ICECKWMNASRRDO-UHFFFAOYSA-N 380.557 5.757 30 20 GKED C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1ccccc1C(F)(F)F 487223228 BUNBJTDUKKVYTH-VIFPVBQESA-N 379.275 5.354 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 498446727 ODOZHZNUYJYLNW-RTBURBONSA-N 386.417 5.119 30 20 GKED N#C[C@@H](NC(=O)CCCSc1ccc(Cl)cc1)c1ccc(Cl)cc1 499837003 KQTGEHFYVRXIPC-QGZVFWFLSA-N 379.312 5.247 30 20 GKED C=CCc1cc(CN[C@@H](COc2ccccc2)c2ccccc2)cc(OC)c1O 500893371 RKFAYTVGVUAJNA-QHCPKHFHSA-N 389.495 5.039 30 20 GKED CC[C@H](CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(OC)cc1 503018627 VPXOQGRYKUKHRO-IAGOWNOFSA-N 382.529 5.612 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 504456802 UZMAQYFFHXYLMZ-INIZCTEOSA-N 395.503 5.408 30 20 GKED Cc1ccccc1[C@@]1(F)CCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 505311753 SRGMXTCPDDYMQK-KSFYIVLOSA-N 397.519 5.349 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1N1CCc2ccccc21)c1ccc(C#N)cc1 505319713 SJLYVYCPBVZGCL-QGZVFWFLSA-N 382.467 5.135 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@H]3C3CCCCC3)s2)cc1 509652557 QGLNXTSSKSDFPE-FQEVSTJZSA-N 394.544 5.182 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H]2CCC[C@H]2c2ccccc2C(F)(F)F)cc1 509720739 UDEGTJITBYKRRQ-PKOBYXMFSA-N 387.405 5.229 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)cc2n1 511787645 BBDJWRJZHNHEMF-UHFFFAOYSA-N 383.407 5.361 30 20 GKED N#Cc1cccc(F)c1CC(=O)Nc1ccc(Oc2ccnc3ccccc23)cc1 512491478 HKSQJPVUMWNLDX-UHFFFAOYSA-N 397.409 5.219 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccc(Cl)s3)n2)sc2c1CCC2 512523221 FODKPLCGSMQALB-UHFFFAOYSA-N 391.930 5.199 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ncc(-c4cccc(F)c4)o3)cc2)ccn1 514765050 UZFQWRIOZVLMKA-UHFFFAOYSA-N 386.386 5.152 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 517483342 ZADAGIOGWWFPHO-RPWUZVMVSA-N 392.458 5.641 30 20 GKED COc1ccccc1[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 518166478 PPSHIJBESRUPEN-HSZRJFAPSA-N 399.494 5.407 30 20 GKED CCc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 520672660 XLSGOBSSOGVASV-UHFFFAOYSA-N 392.446 5.455 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(-c2ccccn2)cc1 521320301 NXKKPHILBVWLHB-JTHBVZDNSA-N 382.467 5.052 30 20 GKED C=CCC[C@H](NCc1nc(-c2cccs2)no1)c1ccc(C(F)(F)F)cc1 538229457 QKNDGYISHYDSRV-HNNXBMFYSA-N 393.434 5.614 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCCC(F)(F)F)cc1 539943846 XDJGYAXNTXHONJ-UHFFFAOYSA-N 376.378 5.003 30 20 GKED N#CCC1CCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)CC1 541048284 WRZFUROHFVWEDK-UHFFFAOYSA-N 389.474 5.059 30 20 GKED N#CC1(c2ccc(-c3nc(-c4ccc(Oc5cccnc5)cc4)no3)cc2)CC1 545677350 KZVRTEZOQCUCKG-UHFFFAOYSA-N 380.407 5.146 30 20 GKED C[C@H]1C[C@H](CCNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C[C@@H](C)O1 549232065 YTLCNHVRPZNBPN-BCDXTJNWSA-N 393.487 5.066 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cnc(Oc2ccccc2)cn1 560972883 KSDHHNTZDIPJPR-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#CCCN(C(=O)CSCc1ccccc1Cl)c1cccc(Cl)c1 561919030 TUZDKVIYCFFCQH-UHFFFAOYSA-N 379.312 5.173 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1Cc2ccccc2OC(C)(C)C1 579401883 CYEZCPZCVZDFII-UHFFFAOYSA-N 378.516 5.744 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2cc(Cl)ccc2C(F)(F)F)cc1 583048602 FXRPLRORBVYRAM-UHFFFAOYSA-N 384.810 5.102 30 20 GKED CN(CC(C)(C)C#N)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12 590493400 GZESCPKJWWRRQC-UHFFFAOYSA-N 395.453 5.054 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)NC1(c2ccc(C#N)cc2)CCC1 594072169 FGFZVTAUIUHLQN-UHFFFAOYSA-N 391.515 5.383 30 20 GKED N#CCCCOc1cccc(NCc2cccc(F)c2OCC(F)(F)F)c1 598956768 PEPDOTMKGIQKCA-UHFFFAOYSA-N 382.357 5.061 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCc1ccc(C#N)cc1 603532854 ZRZDIWDAEGQSFC-UHFFFAOYSA-N 397.453 5.043 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N(Cc3cccs3)C3CC3)cn2)cc1 603689188 BGBWOMASHYGRDZ-UHFFFAOYSA-N 390.468 5.004 30 20 GKED CCCN(CC1CC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079659 GCADSNYUAMPCDO-UHFFFAOYSA-N 397.906 5.445 30 20 GKED C[C@H](NC(=O)NCc1ccc(C#N)cc1F)c1ccccc1Oc1ccccc1 609240556 POJWPZPWYAXXHV-INIZCTEOSA-N 389.430 5.050 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 609298324 SRSILKSPCHIHHF-GOTSBHOMSA-N 398.462 5.410 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1 609307789 BFKOFXPEFWJLCJ-UHFFFAOYSA-N 394.418 5.080 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434333 VHJKSKGTHYDPRK-UHFFFAOYSA-N 383.451 5.571 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCC[C@H]1c1ccccc1 609555573 UBAUZBUQFPUWRY-NEWSRXKRSA-N 379.529 5.396 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C(C)(C)c1cccs1 609643978 NNETVCFMGYMDCH-UHFFFAOYSA-N 390.508 5.424 30 20 GKED N#Cc1ccc(Cl)cc1NCc1cccc(NC(=O)c2cccc(F)c2)c1 609892882 ZPYAIDNONMOFON-UHFFFAOYSA-N 379.822 5.215 30 20 GKED N#CC1(C(=O)N2CCC(COc3cc(Cl)cc(Cl)c3)CC2)CCCCC1 610200901 BLKVGPRWUAVZCB-UHFFFAOYSA-N 395.330 5.085 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N[C@H](C)c1cccc(C#N)c1 610356563 VCZCGDBUUPZQPB-UTKZUKDTSA-N 389.524 5.272 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccnc1Oc1ccccc1 610629283 AKXVVKJNKKJGLH-IFMALSPDSA-N 398.466 5.178 30 20 GKED Cc1cccc(CN(Cc2ccc(C(C)(C)C#N)cc2)Cc2cccc(C)n2)n1 614175959 WUPPAELPFWQLHQ-UHFFFAOYSA-N 384.527 5.097 30 20 GKED C=CC(C)(C)CCNCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 639343487 JNTUKZRNJYRJHP-UHFFFAOYSA-N 377.941 5.173 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(C(F)(F)F)ccc1N(C)C 642441292 UJONCMAKTMQXHN-UHFFFAOYSA-N 383.439 5.053 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cncc(C(F)(F)F)c1 673597981 ULKJSWKUOMTIKH-UHFFFAOYSA-N 384.226 5.007 30 20 GKED C/C(=C\C(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(C(F)(F)F)cc1 728012636 JNESQEYPBCKAAL-DHZHZOJOSA-N 396.315 5.220 30 20 GKED N#Cc1ccc(NC(=O)c2sc3cc(Br)ccc3c2Cl)cc1 729823246 JUJDQINKFYTHNT-UHFFFAOYSA-N 391.677 5.441 30 20 GKED CC[C@@H](C)c1ccc([C@H](NC(=O)Cc2ccc(OCC#N)cc2)C(C)C)cc1 731962260 LDNNBWBLFSPYHY-HOYKHHGWSA-N 378.516 5.158 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)/C=C(/C)c1cccc(C(F)(F)F)c1 742592380 AONDHIBIOKWAGG-WJDWOHSUSA-N 384.401 5.195 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 749611887 GKUMSRIDPXCSDK-FQEVSTJZSA-N 381.526 5.011 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccc(Cl)cc2Cl)cc1OC 750895321 FUZGLQRSJRZFJN-YVMONPNESA-N 381.255 5.305 30 20 GKED COc1ccc(NN=Cc2c(C(C)C)nn(Cc3ccccc3)c2Cl)cc1 754710864 ITNNFLVJSTZKQM-UHFFFAOYSA-N 382.895 5.163 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 755699960 POMACINICSGCCV-UHFFFAOYSA-N 383.106 5.288 30 20 GKED N#CC(CCOC(=O)c1ccc(C2CC2)cn1)(c1ccccc1)c1ccccc1 756651563 IZYDGYIFFXABMS-UHFFFAOYSA-N 382.463 5.016 30 20 GKED CC(C)(CC#N)COC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 764833398 AOFXOQJVSBISPN-UHFFFAOYSA-N 379.243 5.277 30 20 GKED COc1cccc(C=Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1O 766009003 LAOCYLSMEYXMPP-UHFFFAOYSA-N 398.821 5.196 30 20 GKED N#C[C@@H](COC(=O)c1ccc(Oc2ccccc2Cl)nc1)Cc1cccs1 772737518 RFOLFUDIGPFRHU-AWEZNQCLSA-N 398.871 5.128 30 20 GKED CS[C@H](C)CCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 773771993 USVWSLKYOSODNJ-ZWNOBZJWSA-N 399.368 5.825 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc4ccc(Cl)cn34)cc2)c1 779594311 FKCWEDKDHODJTC-UHFFFAOYSA-N 388.858 5.050 30 20 GKED N#CCOc1cccc(NC(=O)N2CCCCC[C@H]2/C=C\c2cccs2)c1 783044741 URYYOAXNVLRMJC-LENZSSGSSA-N 381.501 5.140 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1O 788694914 XLKSAHMEZICGBX-MEBBXXQBSA-N 395.318 5.894 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2F)CCCC1)c1nccc2ccccc12 792101961 HLHCLZQSFAEBKG-SFHVURJKSA-N 376.406 5.201 30 20 GKED COc1cnc2ccccc2c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 801660423 FWWUSXNRKDJSPA-NRFANRHFSA-N 393.446 5.151 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCCCCC2)cc1 801774441 FUAYXSOUSUDBCL-UHFFFAOYSA-N 390.531 5.381 30 20 GKED COCC[C@@H](Nc1snc(Cl)c1C#N)c1ccc(Cl)c(Cl)c1 804708598 RRRMFOXBCOBASI-GFCCVEGCSA-N 376.696 5.165 30 20 GKED C=CC[C@@H](NC(=O)c1sc2ccccc2c1Br)c1ccncc1 810408927 XHUIHKBEERLVNU-CQSZACIVSA-N 387.302 5.106 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211843 ROHXDFSLMQRSOV-QMTHXVAHSA-N 384.810 5.111 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)Cc2cccc3cccnc23)cc1 818110798 UGOPGOXJHQDOLH-UHFFFAOYSA-N 378.431 5.059 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCC[C@H]1CC1(Cl)Cl 844533500 BLFPCRZUGXCQIA-STQMWFEESA-N 386.348 5.176 30 20 GKED COc1cc([C@H](C)NC2(c3ccc(C#N)cc3)CCC2)ccc1SC(F)F 848566714 GISBIWORLDYJQA-AWEZNQCLSA-N 388.483 5.612 30 20 GKED Cc1cc(NCc2cccc(OCCCC#N)c2)ccc1NC(=O)OC(C)(C)C 850416455 UCWGUIAIQSCISC-UHFFFAOYSA-N 395.503 5.637 30 20 GKED CCc1ccc(NC(=S)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1 916000793 RQCSLRZZBDILJR-UHFFFAOYSA-N 387.508 5.509 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H](CCc2ccccc2)c2ccccc2)c1 916680711 JJXVTIJCAQUGQD-HSZRJFAPSA-N 385.467 5.085 30 20 GKED Cc1c(N=Cc2cc(Cl)cc(Cl)c2O)cccc1NC(=O)c1ccccc1 917557260 CTASUJZGAMBRRS-UHFFFAOYSA-N 399.277 6.010 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)/C=C/c1ccc2ccc(Cl)cc2n1 917828884 WETQZFCMDOPJDA-JLHYYAGUSA-N 392.886 5.125 30 20 GKED CCc1cccc2c(/C=C/C(=O)c3ccc(NC(=O)NC(C)C)cc3)c[nH]c12 918156179 MOGSXIGFOQVURC-JLHYYAGUSA-N 375.472 5.156 30 20 GKED CCCOc1ccc2c(c1)C(=O)/C(=C\c1csc(-c3ccsc3)n1)CO2 920068923 GGANGQIPVLTSLM-ZSOIEALJSA-N 383.494 5.319 30 20 GKED CC(=NNc1ccc(OCc2ccccc2)cc1)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776093414 PWGUESWOAIDMCM-NQIIRXRSSA-N 380.488 5.190 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c(C)s1 1776133471 XQQPTBRXALYFEM-VDZCTEQFSA-N 392.476 5.466 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)[C@@H](C)c2ccccc2)cc1 1776788277 WHAVEKJLAAJFAP-CVDCTZTESA-N 383.532 5.382 30 20 GKED CCSc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776950926 PZVMNFZBRTZJLD-WDZFZDKYSA-N 394.448 5.359 30 20 GKED C=CCN(C(=O)CSc1ccc(OC)cc1)c1nc(-c2ccccc2)cs1 7294734 NAOFBYURGONPBV-UHFFFAOYSA-N 396.537 5.130 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1)=C(/S)Nc1ccccc1Cl 10826062 MWSAMDJFCUSBLT-UHFFFAOYSA-O 395.935 5.241 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(c2ccccc2)CCC1 47974586 ZXVNJOYSKKFLBB-UHFFFAOYSA-N 383.451 5.114 30 20 GKED C[C@H](CCc1ccco1)NC(=O)c1ccccc1Sc1ccccc1C#N 57469300 BIHOASTULFATJB-MRXNPFEDSA-N 376.481 5.054 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(C(C)(C)C)nc2C)cc1OCCCC#N 64367484 IVCZCPNCJPSTIO-CSKARUKUSA-N 398.528 5.336 30 20 GKED COc1ccc(Cl)c(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c1 64829169 MTWQQNTUNHBUPH-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1nc(C)cs1 78514991 VTVJECLGROOXFI-QGZVFWFLSA-N 393.537 5.356 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@H](Sc2ccccc2F)c2ccccc2)n1 106353501 NNNOEUMOPMRESU-HNAYVOBHSA-N 382.485 5.301 30 20 GKED CCN(Cc1c(F)cccc1F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108529960 DIXWMZVDZCFGLL-AWEZNQCLSA-N 389.471 5.271 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(NC(=O)c2ccco2)c(C)c1 112211041 ZTCQMRUSMZDVIE-UHFFFAOYSA-N 395.503 5.441 30 20 GKED C=CCC[C@@H](NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 133671782 QWNLGMHBTUATBV-LJQANCHMSA-N 395.890 5.146 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)ccc1Cl 136902972 AAZBZLFZNDZELT-NSHDSACASA-N 377.252 5.102 30 20 GKED COc1ccc2cccc(CC(=O)Nc3ccccc3SC[C@H](C)C#N)c2c1 153660675 RVMWIZLVHAYTEO-MRXNPFEDSA-N 390.508 5.281 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc3nc(Cc4ccccc4)oc3c2)c1 160504055 GDPUSAHRRHZCGN-UHFFFAOYSA-N 399.475 5.287 30 20 GKED C[C@@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Oc2ccccc2)cc1 181810314 KYJOYOGCHKFIFB-QGZVFWFLSA-N 396.450 5.251 30 20 GKED Cc1cccnc1/C=C/C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 184779199 BLAIVIPGFACGIJ-SOFGYWHQSA-N 391.418 5.067 30 20 GKED N#CCCN(Cc1ccccn1)C(=O)Nc1cc(Cl)ccc1OC1CCCC1 189739037 QSYXSDXMDDFUGY-UHFFFAOYSA-N 398.894 5.004 30 20 GKED Cn1ccc2ccc(N=C(O)[C@@H]3CCn4c(cnc4C4CCCCC4)C3)cc21 329417924 DPJYXQAAWVHPLY-GOSISDBHSA-N 376.504 5.273 30 20 GKED Cn1cc(CN2CCC(C(O)=Nc3cccc(F)c3)CC2)c(C2CCCCC2)n1 329761896 SAYLELFUSMZPGJ-UHFFFAOYSA-N 398.526 5.107 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1)C1CC1 330011802 JNHKTXYMHYSGOY-VEDCXYSMSA-N 384.495 5.643 30 20 GKED O=C1CCCc2cc(N/C(O)=N/[C@H]3CCCc4sc(Cl)cc43)ccc2N1 330319531 DIAATIFRDHOAKU-HNNXBMFYSA-N 389.908 5.080 30 20 GKED CC(C)n1c([C@@H]2CCCN2c2ccc(C(F)(F)F)c(C#N)n2)nc2ccccc21 409724084 ZXDZJZXTWNPYCX-SFHVURJKSA-N 399.420 5.244 30 20 GKED CC(C)[C@H]1CCc2c(sc(NC(=O)c3ncsc3C(F)(F)F)c2C#N)C1 411004311 CFJVSQLBYZKFPX-VIFPVBQESA-N 399.463 5.108 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC(CC(F)F)C3)cc2Cl)cc1 425628541 CBQBVNYHTIFMCX-UHFFFAOYSA-N 391.805 5.123 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 429860422 SNZJKLFFHREURW-UHFFFAOYSA-N 393.399 5.009 30 20 GKED Cc1ccc(NC(=O)[C@@H](C#N)CCc2ccccc2)c(OCc2ccccc2)c1 433302819 JQSIAKXUXWVDHV-JOCHJYFZSA-N 384.479 5.285 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CC[C@@H](C)[C@H]1c1ccc(C(F)(F)F)cc1 437763016 VZBZHFXERVHDGA-KUHUBIRLSA-N 387.405 5.501 30 20 GKED CCc1ccccc1CSCC(=O)Nc1ccccc1SC[C@@H](C)C#N 438299074 ATWGTMLAJMYJOG-INIZCTEOSA-N 384.570 5.373 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc(C(C)(C)C)cs1 438623628 DJXYDPDVWMGUPN-SNVBAGLBSA-N 396.438 5.214 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@@H]1c1cccc2ccccc12)c1ccccc1 438869517 SFYDZRQNFJUEIJ-DNQXCXABSA-N 383.495 5.731 30 20 GKED N#CCCCn1cc(C(=O)NCc2cc(Cl)sc2Cl)c2ccccc21 444265916 HJJXKRGZUIFQLD-UHFFFAOYSA-N 392.311 5.243 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)c2ccccc21 444325113 ADBOSJZGGRYSJJ-UHFFFAOYSA-N 393.397 5.011 30 20 GKED C=CCN(C(=O)Cc1cccc(C(F)F)c1)c1nc(-c2ccccc2)cs1 448097351 NXVNVDOZDKJLNK-UHFFFAOYSA-N 384.451 5.509 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@@H](C)CC(F)(F)F 457561172 QNMRWTDBGDXNKB-AWEZNQCLSA-N 378.369 5.128 30 20 GKED Cc1cc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c2cccnc2c1C 464459558 INRHDEZKRNFTJT-UHFFFAOYSA-N 397.434 5.148 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1)c1ccccn1 466976850 LKOZHOKSGBAVOL-INIZCTEOSA-N 383.234 5.671 30 20 GKED FC(F)Oc1ccccc1[C@H](NCc1cccc(C(F)F)c1)C(F)(F)F 470781807 YTFXKUJALQECGA-AWEZNQCLSA-N 381.291 5.619 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1 471171841 CBDWKUSKOQUVDA-UHFFFAOYSA-N 379.435 5.178 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(CSc3ccccc3)cc2)n1 474436047 NOHSLEKKXZAYLE-IBGZPJMESA-N 392.549 6.049 30 20 GKED CC[C@@H](CC#N)NC(=O)Nc1ccc(Sc2nc(C)cs2)c(Cl)c1 475001925 LXVXAPZVCJEOSN-NSHDSACASA-N 380.926 5.070 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ncc(Cc3ccc(F)cc3F)s2)cc1 475182413 KIQQPTCQCAHITR-UHFFFAOYSA-N 397.450 5.066 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 476318121 HGGPXWOGIMJVET-MBSDFSHPSA-N 389.886 5.028 30 20 GKED CC(C)(CNC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 476957639 DLMXLJNNOMVSDH-QGZVFWFLSA-N 388.433 5.187 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(C4CCC4)cc3)n2)cc1 482572100 AFAXYMYIGKKMRD-FQEVSTJZSA-N 388.492 5.576 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2nc(C(F)(F)F)cs2)cc1Cl 486811319 LNBATOPJELHLJW-SNVBAGLBSA-N 376.831 5.231 30 20 GKED N#Cc1ccc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)s1 487214348 GAOZBQCUSNFUHX-UHFFFAOYSA-N 380.281 5.302 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2ccc(C#N)s2)C(C)C)cc1 487607158 ODWPRHZTKRQCOS-UHFFFAOYSA-N 390.508 5.346 30 20 GKED Cc1csc(-c2cccc(C(=O)N[C@@H](CCCC#N)c3ccccc3)c2)n1 487615440 FUNPUEPERVECPI-FQEVSTJZSA-N 375.497 5.284 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 489046028 UILVZGXKQQUBPT-QHCPKHFHSA-N 395.568 5.787 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 497800847 VINKCGPIJZWVMF-HSZRJFAPSA-N 392.499 5.008 30 20 GKED C=CCN(CCCC(=O)Nc1c(C)cccc1C)Cc1ccc(Cl)s1 499685409 HFWFBJJBKHRQKR-UHFFFAOYSA-N 376.953 5.425 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCc3ccc(Cl)c(Cl)c3)CC2)cc1 503857559 NKDXTKFCWNZLEB-UHFFFAOYSA-N 385.294 5.114 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 505213247 JPWDSZSKADAXRG-UHFFFAOYSA-N 380.332 5.126 30 20 GKED CCc1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c(C)o1 506477049 KRACGISGSOSNAP-QGZVFWFLSA-N 379.847 5.107 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 511541317 KYDCTQNUUSKKTO-SFHVURJKSA-N 398.375 5.356 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 511992884 DQVPRQAFQPYROV-ZBEGNZNMSA-N 391.324 5.159 30 20 GKED N#C[C@H](C(=O)c1cccc(F)c1Sc1ccccc1)c1nc2ccccc2o1 512715233 DQJABMVWHKXOCQ-MRXNPFEDSA-N 388.423 5.608 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513102856 OHMMBJIHQRPRRF-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc(C)c1OC(F)F 517426091 JNLGZJCBAFEHGI-MRXNPFEDSA-N 398.434 5.518 30 20 GKED CC(C)CCOCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 519261905 GBNALDMYOQATPQ-HXUWFJFHSA-N 399.922 5.180 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)COc1ccc(C(C)(C)C)cc1 520826358 PAPZVQWVFQECRU-INIZCTEOSA-N 382.529 5.253 30 20 GKED C=CCOc1c(Br)cc(CNC(C)(C)c2cccs2)cc1OC 522649302 BNTULRAWLWVZSI-UHFFFAOYSA-N 396.350 5.109 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)c1ccc(SC)cc1 523488124 RGDNRABMJYHPAE-UHFFFAOYSA-N 381.419 5.269 30 20 GKED C=CCOc1cccc(NC(=O)NCc2sc(-c3ccccc3)nc2C)c1 524304787 MADVCLNHGWJHCG-UHFFFAOYSA-N 379.485 5.005 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)CCCC1CCOCC1 540809129 XHCCCWNLXAXADD-UHFFFAOYSA-N 394.490 5.136 30 20 GKED CCN(C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)[C@H](C)c1cccnc1 541159327 VTAJUZFUJWLZCY-RBUKOAKNSA-N 398.510 5.474 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542060195 BDUPLQZANPLXEM-ZWKOTPCHSA-N 376.500 5.188 30 20 GKED CC[C@@H](CC#N)NCc1ccc(OCc2cccc(C(F)(F)F)c2)c(OC)c1 547286439 ZLSAUDRJXACQMK-SFHVURJKSA-N 392.421 5.075 30 20 GKED Oc1cc(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)cc(C(F)(F)F)c1 563658472 XQAUDVIHIJNWLK-HNNXBMFYSA-N 381.291 5.333 30 20 GKED Cc1cccc(-c2n[nH]cc2CNc2ccc(Oc3ccnc(C#N)c3)cc2)c1 563783957 ZGEAIDDITIUBJK-UHFFFAOYSA-N 381.439 5.056 30 20 GKED CCCc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1C1CCCC1 564128379 FKUVVWOCIQRVNF-INIZCTEOSA-N 396.560 5.455 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCC1 577202015 JZYBYVOAPOBQFS-IERDGZPVSA-N 379.529 5.601 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 590236150 CYZKEIRQBISOJQ-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)CSc1ccccc1 593159016 HHFHVFJGAQPNRC-DLBZAZTESA-N 399.585 5.583 30 20 GKED N#CCCCCC(=O)N(Cc1cccs1)c1ccc(Br)cc1 593965415 AENIGOHQGFQQEK-UHFFFAOYSA-N 377.307 5.128 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C3(C#N)CC3)cc2)ccc1OCC(C)C 594914993 OFCZGBACDNSFFX-GOSISDBHSA-N 378.516 5.136 30 20 GKED N#CC1(CC(=O)Nc2ccc(Cl)c(C(=O)Nc3ccccc3)c2)CCCCC1 597256120 SYIBXOPWENHQGL-UHFFFAOYSA-N 395.890 5.395 30 20 GKED Cc1cccc(-c2nc3cc(F)ccc3n2C(C)C)c1NC(=O)[C@@H](C)CC#N 598814938 NHJKVAARJKSDPJ-HNNXBMFYSA-N 378.451 5.220 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603692339 HRHJPDZNYUMPCP-UHFFFAOYSA-N 392.846 5.063 30 20 GKED N#Cc1c(NC(=O)CCCc2cccs2)sc2c1-c1ccccc1CC2 603991599 NNCHYQVLSDBUJW-UHFFFAOYSA-N 378.522 5.408 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCSc2ccc(F)cc21 604495458 STMFMVFFBPBIRX-FQEVSTJZSA-N 397.519 5.102 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@@H](C)c1c(Cl)cccc1Cl 604567784 BMXARGQSNOWVSC-ZDUSSCGKSA-N 393.270 5.220 30 20 GKED Cc1oc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)c1C 609073065 WIZUQWGSRXRKJE-UHFFFAOYSA-N 394.858 5.561 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc4[nH]ccc4c3)cc2F)c1 609345958 RWSXPNQKEWMBFV-UHFFFAOYSA-N 385.398 5.010 30 20 GKED CCN(CC[S@@](=O)c1cc(Cl)ccc1Cl)[C@H](C)c1ccc(C#N)cc1 609798393 ZNOPBUSZSUKIPN-DLUDVSRJSA-N 395.355 5.056 30 20 GKED CC(C)(C)c1nc2cc(NC(=O)Nc3cccc(OCCCC#N)c3)ccc2o1 609808774 GUKQUJLKCOKCML-UHFFFAOYSA-N 392.459 5.452 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(F)c(F)c2)cc1)c1cccc(C#N)c1 610361291 YEPMHCIGIYPUBF-AWEZNQCLSA-N 378.378 5.120 30 20 GKED C[C@H](C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1ccccc1C(F)(F)F 610598288 CDVHXTLHYMWVQV-CVAIRZPRSA-N 386.417 5.107 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(COC(C)(C)C)cc1 610634735 ILECGFCRKVKGLN-UHFFFAOYSA-N 379.504 5.316 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(-n4nccc4C)cc3)n2)cc1 613315622 SAANLNIXMHNFQK-FQEVSTJZSA-N 398.491 5.103 30 20 GKED CC1=CCCN(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)C1 646440991 SXYNKOIQTOMRJV-UHFFFAOYSA-N 384.295 5.160 30 20 GKED CCc1c(C)nn(-c2cccc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)c2)c1C 678028853 YHBYVSZQCJVNAK-QFIPXVFZSA-N 394.478 5.090 30 20 GKED C#Cc1cccc(N(C(=S)Nc2ccc(SC(F)F)cc2)C(C)C)c1 728226996 TTZGKUCHHMOURA-UHFFFAOYSA-N 376.497 5.594 30 20 GKED CC(C)(C)c1ccc(CCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730416163 BIHVBKFVPQFTOK-KRWDZBQOSA-N 380.488 5.542 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1ccc2ccccc2n1 730687659 ZGMQDLQRBXHBKC-BBWFWOEESA-N 381.262 5.522 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc2c(c1)OCCCO2 731318200 CUVASSHPPMQEQN-CQSZACIVSA-N 399.541 5.051 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 731400247 MJILUHUNACHFQE-HNNXBMFYSA-N 377.469 5.603 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)/C=C/c2ccccc2C#N)cc1 732963617 PDLIZPAOWAMUMW-OXVFXORMSA-N 395.506 5.167 30 20 GKED CCSc1ccc([C@H](C)NC(=O)NCc2cccc(O[C@@H](C#N)CC)c2)cc1 733801767 WZRJLSCYTUJSNQ-QFBILLFUSA-N 397.544 5.040 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2Cl)C(C)C)c1 734529981 CDGITUYTQYFAQG-UTKZUKDTSA-N 399.922 5.217 30 20 GKED CC1CCN(c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)CC1 739598634 HXSXHFWBWZKGKZ-UHFFFAOYSA-N 395.506 5.714 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740060233 RHMDOCUSXLOXGC-QGZVFWFLSA-N 389.524 5.498 30 20 GKED C[C@@H](c1ccccc1)N(CC1CCC1)C(=S)Nc1ccc(C#N)c(Cl)c1 740773588 VKYKKHCBUYRUSD-HNNXBMFYSA-N 383.948 5.772 30 20 GKED COc1ccc(C=NNc2ccnc3cc(Cl)ccc23)cc1OCCCC#N 747356743 GVIPSHZGMLBWGY-UHFFFAOYSA-N 394.862 5.025 30 20 GKED CCCN(CC)c1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 751329402 QQCUXVVHBALTMW-HSZRJFAPSA-N 398.510 5.226 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)/C=C\SCc3ccco3)c2)c1 753980447 LPYQVOIFIQYXRK-LUAWRHEFSA-N 390.464 5.116 30 20 GKED CCc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1CC(C)C 755510419 GQLBKUSCTGIUMX-OAQYLSRUSA-N 386.499 5.009 30 20 GKED C=CCC[C@@H](NCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C(=O)O 756379208 KYZJQPYWLDFOBR-LJQANCHMSA-N 394.298 5.081 30 20 GKED N#Cc1cc(NC(=O)[C@@H]2C[C@@H]2c2ccc3ccccc3c2)c(Cl)c([N+](=O)[O-])c1 764307825 VPYXTCKMNSPPKD-IAGOWNOFSA-N 391.814 5.015 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@@H](C)c1ccc(Cl)c2ccccc12 765255317 UZHNDVAAMSBEGX-GJZGRUSLSA-N 393.874 5.667 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2ccncc2)n1Cc1ccccc1 767032167 BCUZDCMAHXQXHP-UHFFFAOYSA-N 391.544 5.201 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cc(Cl)cc(Cl)c2)ccc1OC 772985017 IMGULKASQVCGQP-ACJLOTCBSA-N 393.314 5.534 30 20 GKED CC(C)CN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCCc2cccnc21 774238739 UYHVOYVOWKXWNC-LJQANCHMSA-N 398.963 5.339 30 20 GKED C=C(C)[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 775319645 WPYAFSQKJRYXIS-QGZVFWFLSA-N 397.219 5.043 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)Nc3ccccc3O[C@H](C)C#N)cc2)nc1 780579061 SRVTYTKWPDQNTH-MRXNPFEDSA-N 388.427 5.117 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2nc(Cl)ccc2Cl)n1 785029795 JTTBTIDRMYQTPC-UHFFFAOYSA-N 378.206 5.275 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1ccc2[nH]ccc2c1 788260898 FRFYQZZCBINMCN-UHFFFAOYSA-N 395.462 5.285 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1 788311386 TUGPOPLTHVBMSO-HXUWFJFHSA-N 393.531 5.765 30 20 GKED O=C(/C=C/c1ccsc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 790219945 PLTVCWALXJPNMF-JXMROGBWSA-N 380.918 5.014 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1ccc(F)c(Cl)c1 795140741 VVZHTKZGSHHCCT-UHFFFAOYSA-N 380.920 5.032 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 797829661 FARGNERKCXQGDJ-IBGZPJMESA-N 376.456 5.455 30 20 GKED COc1cccc2c1[C@@H](C(=O)[C@@H](C#N)c1nc(-c3ccc(C)cc3)cs1)CC2 815911115 RNTATHIEKUDRHA-ZWKOTPCHSA-N 388.492 5.033 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 820125673 MZLWTDIGIXPWSC-ZIAGYGMSSA-N 398.359 5.130 30 20 GKED N#C[C@@H](C(=O)C1(Cc2cccc(Cl)c2)CC1)c1nc2ccccc2n1C(F)F 835072829 IOPGAPXCCKCAOC-HNNXBMFYSA-N 399.828 5.284 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2oc3ccccc3c2Br)c1 848536768 VIJSZORHGLWREH-HNNXBMFYSA-N 399.288 5.166 30 20 GKED Cc1c(NC(=O)OC(C)(C)C)cccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 862718794 PJSMBLAGCPLEQK-UHFFFAOYSA-N 391.471 5.150 30 20 GKED C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)c1nc(Cc2ccccc2Cl)no1 904376130 XMQXQTFIONXYBP-AWEZNQCLSA-N 398.290 5.022 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2csc3c2CCCC3)cc1 916947611 ORJAVQDMDKLAAH-KBXCAEBGSA-N 380.513 5.102 30 20 GKED C=CCn1c(-c2ccc(Cl)cc2)nn(CN2CC[C@@H]2c2ccccc2)c1=S 917446332 MQQCBNWYFIZBHE-LJQANCHMSA-N 396.947 5.325 30 20 GKED C[C@@H](OC(=O)/C=C\c1ccccc1C#N)c1cccc(NC(=O)c2ccccc2)c1 919046868 QIHKRSKKYODUMH-KGUUONHRSA-N 396.446 5.128 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cn(CC(C)C)c2ccccc12 920101804 JIHRBPYLIBFSGT-IBGZPJMESA-N 397.478 5.292 30 20 GKED C=C[C@H](CCC(=O)O)NCc1cc(F)ccc1Oc1ccc(Cl)c(CC)c1 1776148414 JJZQKPCMEFXSPF-QGZVFWFLSA-N 391.870 5.343 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Oc2ccc(OC)cc2)cc1 1776784740 PBPRRQHPPXMPGX-FQEVSTJZSA-N 399.531 5.781 30 20 GKED CCc1c(C(=O)/C=C/c2nc3ccccc3c(C(=O)O)c2C)oc2ccccc12 1776956103 CUIBCNSHOZYXFP-OUKQBFOZSA-N 385.419 5.446 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777316326 XKDLYWCNKXWJQL-YIXHJXPBSA-N 392.838 5.610 30 20 GKED C=C1CC(C(=O)Nc2ccc(C3(NC(=O)C4(C)CCCCC4)CCC3)cc2)C1 1785810477 MRFHFHPWEOAPCS-UHFFFAOYSA-N 380.532 5.057 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2)CCCC1)c1nc2ccccc2n1C(F)F 51655720 LDAYNERAZVKBPI-INIZCTEOSA-N 397.400 5.259 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c1 51656062 IOYPGFWWOWLTRQ-WMLDXEAASA-N 397.425 5.199 30 20 GKED Cc1ccc(NC(=O)[C@@H](Nc2cccc(OCCCC#N)c2)c2ccccc2)cc1 56199920 OPRHWMXMIRQTEJ-DEOSSOPVSA-N 399.494 5.470 30 20 GKED C[C@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1F 108965855 RZVJJQSUSGSKOJ-KRWDZBQOSA-N 388.442 5.213 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)CCCCc1ccccc1 109028399 LJIUHPGDHJWQQD-GOSISDBHSA-N 381.545 5.567 30 20 GKED N#CCC[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccccc1 130453027 UOMOEYBHMCIKDO-VWLOTQADSA-N 381.479 5.272 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC(C)(C)O1 141993914 LXONZSDAABSIKD-BEFAXECRSA-N 397.906 5.027 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(C(C)C)c(=O)c2ccccc12 189868047 CMKHQWZOHCAIHB-UHFFFAOYSA-N 389.499 5.082 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1 189903102 DKSSHKVPENRKLZ-UHFFFAOYSA-N 392.503 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccc2c(c1)OCO2 191467985 UMTSLTXCQZUWGO-UHFFFAOYSA-N 380.488 5.321 30 20 GKED Cc1c(Cl)cccc1NC(=O)c1ccccc1Sc1ccccc1C#N 247822020 HCKBJCINYYSLAS-UHFFFAOYSA-N 378.884 5.924 30 20 GKED N#CCCCOc1cccc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3o2)c1 255522169 JYQGGUONSPCFHK-LFIBNONCSA-N 383.791 5.155 30 20 GKED COc1ccccc1-c1csc(C2CCN(c3ccc(F)cc3C#N)CC2)n1 302742105 RMWGYAOJVAHCHG-UHFFFAOYSA-N 393.487 5.213 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/[C@H]5CCc6c[nH]nc6C5)(C4)C2)C3)cc1 329874917 GCLXJNFBYBGQRL-NSGFGWDLSA-N 389.543 5.070 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 409471241 QDZWUICLDMJJJX-WOJBJXKFSA-N 386.417 5.118 30 20 GKED CCO[C@H](c1ccccc1)c1noc(-c2sc3ccc(C#N)cc3c2C)n1 426620821 RUFJNRUKJQDZEU-GOSISDBHSA-N 375.453 5.257 30 20 GKED CC(C)c1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c2ccccc2n1 430617794 PCQVOZMGUBCLTP-INIZCTEOSA-N 377.513 5.602 30 20 GKED N#Cc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccccc2)cc1C(F)(F)F 432961032 QRSDMHYCNHWJSP-SFHVURJKSA-N 385.389 5.336 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc3c(ccn3Cc3ccccc3)c2)n1 433186374 DUFMZHGQIORERF-HXUWFJFHSA-N 399.519 5.760 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccccc1C(C)(C)C 434006921 DNFJOFIJACZKSS-UHFFFAOYSA-N 385.467 5.604 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1ccc(C)c(C)c1 453467572 RGCJQNQLUOHRKE-LEWJYISDSA-N 380.536 5.054 30 20 GKED C[C@]1(c2ccccc2)CCCN(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458804383 SLVMUASBJOFTJR-VWNXMTODSA-N 375.516 5.185 30 20 GKED CN(Cc1cc(Cl)cc(Cl)c1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458808026 YQLXNSZAWXOIEA-IBGZPJMESA-N 390.314 5.570 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 465803802 DPJNBZHBRXOFGA-BHIFYINESA-N 391.515 5.018 30 20 GKED COc1ccccc1[C@H](NC(=O)Nc1ccc(C#N)cc1)c1ccccc1Cl 466083767 XAKROECLQPMCHU-OAQYLSRUSA-N 391.858 5.131 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(OC3CCC3)c(F)c2)c2ccccc21 469545434 SVSPGWYEZBVFFK-UHFFFAOYSA-N 391.446 5.268 30 20 GKED CN(C(=O)c1ccccc1Sc1ccccc1C#N)c1ccc2cc[nH]c2c1 473571511 REJPFZVIPLHCRH-UHFFFAOYSA-N 383.476 5.467 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1 473623646 JDMJRIINMKCZDP-UHFFFAOYSA-N 388.345 5.114 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Sc3ccccn3)cc2)n1 474425778 JFFLEVLXBFYFHM-INIZCTEOSA-N 379.510 5.303 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)c(C(F)(F)F)c1 475637263 FZANDGLGYCZCCH-UHFFFAOYSA-N 390.405 5.546 30 20 GKED Cc1ccc(-c2ncc[nH]2)cc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 478012527 ACJJGZBNCZXLIV-UHFFFAOYSA-N 394.434 5.301 30 20 GKED C[C@H](NCc1nccn1-c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 480300660 KUVCNTIGIRIZAK-IBGZPJMESA-N 378.479 5.262 30 20 GKED N#Cc1nc(SCCCCSc2ccc(Cl)c(C#N)n2)ccc1Cl 480493383 NVSMUKQRIGZBAO-UHFFFAOYSA-N 395.340 5.191 30 20 GKED CCc1cccc2c(C3CCN(C(=O)Nc4ccc(F)c(C#N)c4)CC3)c[nH]c12 481685869 NFHCOHDLZKLQPK-UHFFFAOYSA-N 390.462 5.153 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1cc2sc(C)nc2cc1Cl 484665433 UESCJMNELODKAY-UHFFFAOYSA-N 388.876 5.084 30 20 GKED CC(C)CCn1ncc(NC(=O)Nc2cc(C#N)cn2C(C)(C)C)c1C(C)C 486876340 CIIPONNBIWQAFG-UHFFFAOYSA-N 384.528 5.125 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1 487547348 ZESKYVKECSCDJW-JOCHJYFZSA-N 390.527 5.516 30 20 GKED COc1ccc([C@H](Nc2cccc(OCCCC#N)c2)c2ccc(F)cc2)cc1 494953184 QBRUMIYBFJFKMX-XMMPIXPASA-N 390.458 5.718 30 20 GKED CC(C)N(Cc1ccc(-c2ccccc2F)s1)C(=O)c1sccc1C#N 497983468 VJZKTXLMZIFVBG-UHFFFAOYSA-N 384.501 5.538 30 20 GKED C=CCc1cc(CN[C@H](c2ccccc2)c2cccc(Cl)c2)cc(OC)c1O 500113453 VBNAJTGOEQJDRH-HSZRJFAPSA-N 393.914 5.662 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2Oc2ccccc2Cl)c1 505886307 BWNAITKYTNGHGC-UHFFFAOYSA-N 383.234 5.910 30 20 GKED COc1ccccc1C1(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)CCCC1 506294780 LZVXDRHBCOTBMK-UHFFFAOYSA-N 391.515 5.130 30 20 GKED COc1ccc2c(CC(=O)Nc3ccc(Oc4ccccc4C#N)cc3)coc2c1 507877942 NLUPSXYEGQRVTD-UHFFFAOYSA-N 398.418 5.287 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)[C@@H](C)c1ccc(C#N)cc1 509565435 YFUUSTKYQLPFNS-GDIGMMSISA-N 386.417 5.290 30 20 GKED Cn1c(-c2ccc(NC(=O)c3cc(C#N)ccc3Cl)cc2)nc2ccccc21 511462982 UDQZGFQZWOIXEM-UHFFFAOYSA-N 386.842 5.018 30 20 GKED CCn1c(NC(=O)c2ccccc2Sc2ccccc2C#N)nc2ccccc21 514853197 DGOXSHVFFZOGRW-UHFFFAOYSA-N 398.491 5.331 30 20 GKED CCc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)sc1C 516269981 IFBHJDZEUOVWHD-MRXNPFEDSA-N 382.510 5.241 30 20 GKED CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)N(C)Cc1ccc(C#N)cc1 519495911 QOMPXKNFQUDGET-SFHVURJKSA-N 390.314 5.028 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(N[C@H](C)C(=O)Nc3ccccc3C#N)c2)C1 521107970 PSPPLHDIXQDCNT-JBYIUTFZSA-N 391.515 5.093 30 20 GKED C=CC1CCN(C(=O)c2cc3c(C)nn(Cc4ccc(Cl)cc4)c3s2)CC1 521956268 PGWWUOOEKNRSCR-UHFFFAOYSA-N 399.947 5.146 30 20 GKED COc1ccc2oc(C(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)c(C)c2c1 522203494 CSBVURVFTPZIJY-OAHLLOKOSA-N 389.238 5.051 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H](c3ccccn3)C3CCC3)c2)c1 527774371 SZRDLLQXNCZEJF-RUZDIDTESA-N 383.495 5.163 30 20 GKED C[C@H](Nc1ccc(C#N)cc1Br)c1nc2ccccc2n1C(F)F 534880065 LLASJCLSLOYBDA-JTQLQIEISA-N 391.219 5.239 30 20 GKED Cc1cccc(Cl)c1NC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1 535994174 UCURFXBQRPLQTJ-UHFFFAOYSA-N 376.843 5.205 30 20 GKED C[C@H](N[C@H]1c2cc(Br)ccc2SC[C@@H]1C)c1cccc(C#N)c1 540593762 KZJGJIYLRPQKFJ-WTOJCKNJSA-N 387.346 5.454 30 20 GKED N#CCC[C@H](NC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1)c1ccccc1 541210473 OWWBUILIDQRVRK-FQEVSTJZSA-N 399.897 5.355 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N(Cc1cccs1)Cc1cccs1 549511641 XNNXLESBBIATAK-UHFFFAOYSA-N 398.557 5.472 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 554858540 UURHOTJPLVVKAZ-HXUWFJFHSA-N 393.874 5.561 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)NCC(C)(C)CCC#N)cc1F 562136449 FXUMYKNFGFWXJO-UHFFFAOYSA-N 385.439 5.078 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)Nc1cc(C#N)ccn1 563558152 RVQCJOASPCDDLJ-NSHDSACASA-N 399.317 5.321 30 20 GKED Cc1csc(NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)c1C#N 567394028 BEHXWPFKRJDMKZ-UHFFFAOYSA-N 395.431 5.128 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2sc(Cl)cc2C1 571557006 AFMFYZKHUKXHEA-LBPRGKRZSA-N 391.949 5.386 30 20 GKED CC(C)n1cc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)cn1 572916179 URUFIQVLRGFBSR-UHFFFAOYSA-N 380.835 5.034 30 20 GKED C[C@H](Oc1ccccc1C#N)c1nc(C2(c3cccc(C(F)(F)F)c3)CC2)no1 575367191 XQVYKGPNPVQAAI-ZDUSSCGKSA-N 399.372 5.180 30 20 GKED C[C@@H](Sc1cccc(F)c1C#N)c1nc(O)c2c(-c3ccco3)csc2n1 590596235 HPRUAPWQZDQHFL-SNVBAGLBSA-N 397.456 5.521 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1ccc2ccccc2n1 591862694 YWZQAAHEBPOFBE-LJQANCHMSA-N 389.414 5.533 30 20 GKED C[C@@H](N[C@@H]1CSCc2ccc(Br)cc21)c1ccc(C#N)cc1F 595075965 DZJPMYLWDPNCIP-ADLMAVQZSA-N 391.309 5.099 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3o2)cc1F 605075030 NCMDJORXUHRJHR-SFHVURJKSA-N 388.373 5.572 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccc(C(F)F)cc2)cc1 608804704 GGMZMKAOMYPSKV-UHFFFAOYSA-N 394.396 5.478 30 20 GKED CCCCN(Cc1ccccc1Cl)C(=O)c1cc2ccccc2n1CC#N 609171152 BLRMHWKRVYEIBK-UHFFFAOYSA-N 379.891 5.261 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)Cc3ccccc3OC(F)F)c2)cc1 609815202 YUNQQSCTEHZSSK-UHFFFAOYSA-N 394.377 5.133 30 20 GKED N#CC1(NC(=O)c2cccc(CSc3c(Cl)cccc3Cl)c2)CC1 610198398 YSCPKANWWRXGFS-UHFFFAOYSA-N 377.296 5.072 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(NC(=O)c2ccc(F)cc2)c1 611391168 YJWFFTDKOSVZJT-DEOSSOPVSA-N 399.469 5.117 30 20 GKED CCCCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 613392090 FFKXRHKRCPSIGJ-LJQANCHMSA-N 376.481 5.479 30 20 GKED CC(C)(c1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1)C(F)(F)F 647379575 WHDATVBZVJCCSC-CQSZACIVSA-N 378.419 5.350 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCO[C@H](c2ccccc2)C1 682777831 SMWPXFIOODEAQQ-QFIPXVFZSA-N 378.516 5.534 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=S)Nc1ccc(OC(C)C)cc1 726484146 FKQOINRQFNUKNW-UHFFFAOYSA-N 381.545 5.200 30 20 GKED CCS[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 727627186 MARAQSNPZDRGHH-PBHICJAKSA-N 378.950 5.417 30 20 GKED CCn1nc(C)c(/C=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1C 727975874 XGNFFPGXSMZQQS-WAYWQWQTSA-N 390.327 5.454 30 20 GKED COc1cc(C(=O)/C=C\c2csc(-c3cccs3)n2)ccc1OC(F)F 728440442 XXFWIAHWRIVWEF-WAYWQWQTSA-N 393.436 5.378 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)cc1 728698460 JYRHCZRDPKCVFR-SGPNVBEDSA-N 385.250 6.023 30 20 GKED Cc1ccc(C2=CCN(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CC2)cc1 731113992 BILRWWBBFZPDKZ-SFHVURJKSA-N 391.540 5.568 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc(-c2ccccc2)cs1 731287672 IAQPFSPNHSHJBZ-YPAWHYETSA-N 394.499 5.943 30 20 GKED CC[C@@H](OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(OC)cc1 732505049 NYBXCQDRPBXOMZ-OAQYLSRUSA-N 388.423 5.062 30 20 GKED COc1ccc(OC(F)F)c(/C=C/C(=O)c2sccc2Br)c1 732926708 SAWSCKFACXWVJH-DUXPYHPUSA-N 389.217 5.017 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1ccc(SCC(F)F)cc1 741848030 ULIJXCGQKDZXQP-TWGQIWQCSA-N 388.464 5.458 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCSc3ccccc32)cc1 741901351 HLBIUSWUHCZIRC-FCHUYYIVSA-N 384.504 5.560 30 20 GKED COc1ccc(CN[C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)cc1C#N 742369908 IXFLQAWSXHSLPG-CYBMUJFWSA-N 397.931 5.503 30 20 GKED CS[C@@H]1CC[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 743123151 GEKRIQVXNBAQSL-VQIMIIECSA-N 381.501 5.065 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1ncc(-c2ccccc2)n1CC(F)(F)F 748031698 CXKWPARSNGQIIG-QGZVFWFLSA-N 387.430 5.339 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccc(F)cc2)CC1 752678014 LRLPEOYEHNQUSD-INIZCTEOSA-N 397.519 5.489 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(N2CCC(C)CC2)cc1 754617220 NLVKARFYRYTMSS-UHFFFAOYSA-N 390.531 5.239 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(F)c(F)c1)c1nc2cc(Cl)ccc2s1 756245763 YGXZBLXOARBGSW-CYBMUJFWSA-N 390.842 5.427 30 20 GKED CC(=NNc1cncc(Br)c1)[C@@H](C)c1nc2ccccc2s1 758123773 XFLDGTNBPOROPP-SNVBAGLBSA-N 375.295 5.045 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc2c(ccn2Cc2ccccc2)c1 762249755 PGPBGUQDHNERNF-GOSISDBHSA-N 395.462 5.233 30 20 GKED N#C[C@H](NC(=O)c1sccc1SC(F)F)c1c(Cl)cccc1Cl 768139796 ILOYJACZGNCZII-VIFPVBQESA-N 393.267 5.364 30 20 GKED C=CC[C@H](NC(=O)c1sc(C(C)(C)c2ccccc2)nc1C)c1ccncc1 769859132 OAQNVJMBQNNXEH-IBGZPJMESA-N 391.540 5.220 30 20 GKED COc1cccc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1F 770064844 CCKXXNNPLKQCQG-UHFFFAOYSA-N 381.247 5.124 30 20 GKED COc1c(Br)cc(Cl)cc1NCc1ccc(O[C@H](C)C#N)cc1 770511993 IUXOGXGADPZBMC-LLVKDONJSA-N 395.684 5.014 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 775144518 WCKWFXURXXLRRC-NHCUHLMSSA-N 392.628 5.260 30 20 GKED O[C@H](CN[C@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(C(F)(F)F)c1 775191982 NPQROLLAIBWIBX-HZPDHXFCSA-N 395.318 5.161 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1cccc2ccccc12)c1ccc(OCC#N)cc1 776155985 JQNCNYAGPPMFKD-DCFHFQCYSA-N 392.502 6.182 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1 780672912 AAKMTKMOSKGFNQ-QWHCGFSZSA-N 392.286 5.509 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCO[C@H](C(C)C)C3)n2)cc1 781765507 OELSSKPPZZHSFC-CDXJDZJCSA-N 382.529 5.136 30 20 GKED Cc1nnc([C@H](C)OC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 784424679 BBFLROZIZXMAOB-NSHDSACASA-N 399.859 5.082 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1cc(C(C)=O)ccc1Cl 788847186 BHWGBGURAXQZIF-UHFFFAOYSA-N 391.920 5.195 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2c(OC(F)F)ccc3ccccc23)cc1 792917409 LWXDURBNNYBVSS-OUKQBFOZSA-N 395.405 5.039 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 793279816 ALUHVSOLVTWKJW-UZLBHIALSA-N 396.412 5.699 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(C)c(Br)s2)c1 796307295 JXKFOZXLZYRTCP-HIFRSBDPSA-N 393.350 5.351 30 20 GKED Cc1ccccc1[C@H](O)C1CCN(c2c(C#N)cnc3ccc(Cl)cc23)CC1 804811577 XRPAQKNVKOEHHN-HSZRJFAPSA-N 391.902 5.018 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c(F)cc1Br 806601787 QJGNZEQYWJAIRC-UHFFFAOYSA-N 398.688 5.231 30 20 GKED Cc1nc(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)c(Cl)cc1C#N 812452184 QKKLOQYJLVMETB-UHFFFAOYSA-N 388.810 5.481 30 20 GKED Cc1cc(O[C@@H](C)C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)ccc1C(C)C 813216081 NEDHDYITDWPVGJ-KBXCAEBGSA-N 390.405 5.176 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1nc2ccccc2s1 814301685 BIBUPNNFTNVTFR-NVXWUHKLSA-N 378.501 5.092 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Br)cc(F)c1O 815635959 MRUFQQHGQXSKFQ-FZKQIMNGSA-N 391.284 5.380 30 20 GKED FC(F)(F)Oc1ccc(NN=Cc2ccccc2OCc2ccccn2)cc1 819845348 IMTZOZMJWWSNJT-UHFFFAOYSA-N 387.361 5.005 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(N)c(OC(F)(F)F)c1 834315449 ZZTCRAJJBSVOSW-UHFFFAOYSA-N 378.394 5.272 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cc(Cl)ncc3Cl)c(C#N)c2[C@H]1C 839391268 WMACHHJUDYLJQP-IUCAKERBSA-N 380.300 5.260 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](Cc2ccccc2)c2nccn2C)cc1 846207217 LUZHLIMTILFABY-PGRDOPGGSA-N 395.934 5.186 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccccc3)s2)cc1 915598046 INUVZAYGSYTLTE-OAQYLSRUSA-N 395.487 5.718 30 20 GKED CCCCCCCCCCC(=O)N1CCC[C@H](c2nnc3n2CCCCC3)C1 915700498 IRQMGZDQHYFDFT-FQEVSTJZSA-N 388.600 5.241 30 20 GKED N#C[C@H](C(=O)CC1CCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 916997538 WBCYYCMVOKYTRN-CQSZACIVSA-N 379.312 5.873 30 20 GKED N#CCSc1ccccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047298 WMGRBBASFSFSDM-CYBMUJFWSA-N 383.885 5.055 30 20 GKED COc1cc(C=NOCc2c(Cl)ccc3cccnc23)ccc1OC(C)C 917395600 UFVLJOMMPRNCKV-UHFFFAOYSA-N 384.863 5.235 30 20 GKED C=CCn1c(Cc2ccccc2)nn(CN2CCC[C@H]2c2ccsc2)c1=S 917454325 BTKMZWLDSNOYCC-IBGZPJMESA-N 396.585 5.047 30 20 GKED Fc1cc(-c2cccs2)ccc1C=Nn1c(S)nnc1-c1ccccc1F 917537665 DOYKGTQARFNVFZ-UHFFFAOYSA-N 398.463 5.123 30 20 GKED N#CCOc1ccccc1C(=O)N(c1ccccc1)c1nc2ccccc2s1 919989596 ZWZUNVGWJGVEIK-UHFFFAOYSA-N 385.448 5.177 30 20 GKED CCCCCCCCCCCCOc1ccc(C=NN[C@@H](CC)C(=O)O)cc1 1776065755 ORUGLDIZYFLCCC-QFIPXVFZSA-N 390.568 5.773 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1776114468 QLVNSZDYOZKOME-YVLHZVERSA-N 378.449 5.513 30 20 GKED O=C(/C=C\c1c(F)ccc(C(=O)O)c1F)c1ccc(Oc2ccccc2)cc1 1776126578 PTCOTYOLKDQBPV-QBFSEMIESA-N 380.346 5.351 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O 1776365010 HXMODIITJXYYRF-KVNDZABWSA-N 386.900 5.679 30 20 GKED CC(C)c1nc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cs1 1776380490 JQDCAHALQFYILE-CLFYSBASSA-N 383.494 5.589 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1c(F)ccc(C)c1Br 1776784110 QWJSWUBDIPSLEF-AWEZNQCLSA-N 388.321 5.190 30 20 GKED CCCCCCCCc1ccc(C(=O)NCc2ccc(CC(=O)O)cc2)cc1 1776786606 BJIIUFNKUFTZHA-UHFFFAOYSA-N 381.516 5.147 30 20 GKED CCCCCCCOc1cccc(CN[C@@](C)(CCCCCC)C(=O)O)c1 1776788078 PDJGBSZDXMDBLR-QHCPKHFHSA-N 377.569 5.939 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3C3CC3)CCC2)cc1 1789622282 HVTSJFGZACLWMW-NHCUHLMSSA-N 394.559 5.159 30 20 GKED N#Cc1ccc(F)c(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c1 11645360 NHEYAZFHDKAHOO-LJQANCHMSA-N 393.487 5.032 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Cc2coc3ccc4ccccc4c23)cc1 29201120 IWKCTCOBIHZVRT-UHFFFAOYSA-N 399.450 5.075 30 20 GKED C=CCOc1ccc(C(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1 42759951 SOEVRPRWYQDLQK-UHFFFAOYSA-N 396.874 5.066 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(OC[C@H]2CCCO2)c1 44847266 VTKIGOADSCRGCN-OAQYLSRUSA-N 398.462 5.035 30 20 GKED C=CCn1c(S[C@@H](C(=O)c2ccccc2)c2ccccc2)nnc1C1CC1 49583411 PLJWPUGRAPWAJS-HXUWFJFHSA-N 375.497 5.058 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(F)cc2)cs1 54895548 LOMYIDFOMFKIQO-FMIVXFBMSA-N 380.444 5.171 30 20 GKED C=CCn1c(Sc2nc(C(F)F)nc3ccccc23)nnc1-c1ccccc1 66451884 XQYAGGIEMPNLLE-UHFFFAOYSA-N 395.438 5.163 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)Nc1cccc(C(F)(F)F)c1 66861289 VTVJUHWJZPGOKF-ZDUSSCGKSA-N 393.434 5.150 30 20 GKED C#Cc1cccc(N/C(S)=C(\C(=O)c2ccc(C(C)C)cc2)[n+]2ccccc2)c1 102387465 GHBCATFJUBCLEV-UHFFFAOYSA-O 399.539 5.130 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)c1nc2ccccc2n1C(F)F 108407903 BBHSHOFAVWXMBI-KBPBESRZSA-N 386.471 5.856 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(CCc1cccc(F)c1)C1CC1 114011037 POGNEVXOUKEHDM-MRXNPFEDSA-N 397.519 5.316 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccc(F)cc3OCC#N)c(F)c2)cc1 120133326 RPWRINJKGYBKMK-UHFFFAOYSA-N 378.378 5.095 30 20 GKED CC(C)(C)[S@@](=O)Cc1cccc(NCc2cccc(OCCCC#N)c2)c1 133589585 RYOISLFXLLLVJG-HHHXNRCGSA-N 384.545 5.028 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Cl)cc2-c2nc3ccccc3[nH]2)c1 172540728 IXJWVDIVTHCLLW-UHFFFAOYSA-N 386.842 5.202 30 20 GKED CC[C@H](Cc1ccccc1Br)C(=O)[C@H](C#N)c1nc2ccccc2o1 177137127 ZVEKWUOEGGIDFR-HIFRSBDPSA-N 397.272 5.035 30 20 GKED C[C@H](Oc1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccccc1 180881230 IBXZWJCFVIRAOE-SFHVURJKSA-N 382.463 5.634 30 20 GKED CC(F)(F)c1cccc(NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)c1 186954012 CPUUVIUKGMIXCM-UHFFFAOYSA-N 390.274 5.147 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(F)c(Cl)c2)cc1 301237412 DFLZDNZGBOSHQI-UHFFFAOYSA-N 396.874 5.895 30 20 GKED CC[C@@H](Nc1ccc(C(F)(F)F)cc1C#N)c1nc(C(F)(F)F)cs1 301738734 WOBRBPRKYJMZHD-SNVBAGLBSA-N 379.329 5.616 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Oc2ncc(C#N)cc2Cl)c(Cl)c1 302756677 WXAXDMVCXNRCOA-UHFFFAOYSA-N 380.231 5.399 30 20 GKED CC(F)(F)c1cccc(N=C(O)N[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 328608994 MIQHHCIJEFWRCC-GOSISDBHSA-N 388.462 5.323 30 20 GKED CC(O)=Nc1ccc(N=C(O)NC2[C@H]3CC[C@H]2Cc2ccccc2C3)c(Cl)c1 329493755 WQKIXWYUJIZXKV-IRXDYDNUSA-N 397.906 5.277 30 20 GKED O/C(=N/C1CCC(/C(O)=N\[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)CC1)C1CC1 330004536 CRLOTFZHPYKIPA-JDGDGYACSA-N 390.911 5.052 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430610695 LJSPVOCFANCUHG-QGZVFWFLSA-N 375.497 5.301 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc(F)cc(F)c1 434150122 JKWXXGOOOHXOMD-CYBMUJFWSA-N 375.444 5.023 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 435610996 OPZMOBZZGRXOCW-HXUWFJFHSA-N 381.501 5.100 30 20 GKED CC(C)[C@@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccnc1 436113245 UREYEHGHNHHCSA-HOYKHHGWSA-N 383.495 5.237 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCC(C)(C)CC2)cc1 438211917 GZHAUITZSLHAQC-UHFFFAOYSA-N 393.487 5.403 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)N[C@H](c1ccc(F)cc1)C(F)(F)F 438566366 IOHIQSJNPNLTEC-CQSZACIVSA-N 394.290 5.356 30 20 GKED C=CCC[C@H](NC(=O)Cc1ccc(C(C)=O)cc1)c1ccc(C(F)(F)F)cc1 441565738 MVYHPRVCESFIMX-FQEVSTJZSA-N 389.417 5.274 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Sc1ccccc1)c1nc2ccccc2s1 442619919 RELJKHVPRXDIOT-KRWDZBQOSA-N 386.501 5.938 30 20 GKED C[C@H]1CC[C@@H](CCC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)O1 443893428 DIHWSHNMCMURAW-JXFKEZNVSA-N 382.891 5.093 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(C(F)(F)F)ccc2F)c2ccccc21 444128343 FQLBAPWKGMPRDF-UHFFFAOYSA-N 389.352 5.355 30 20 GKED CC[C@@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(C#N)cc1 447528673 JLGYOYVOFYIQSW-AREMUKBSSA-N 383.539 5.528 30 20 GKED C[C@@H]1CC[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)c2sccc21 453208091 BARGIMNLGVKPGS-BEFAXECRSA-N 379.529 5.382 30 20 GKED Cc1ccccc1-c1nc(C(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cs1 464933824 BCFJENHOSZLTNO-TZIWHRDSSA-N 387.508 5.031 30 20 GKED CC(C)c1ccc([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 468832663 DJHZDTGQLMVVEW-GOSISDBHSA-N 375.516 5.566 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)c1cn(CCCC#N)c2ccccc12 468979866 MYTYEGBQLPEXQN-UHFFFAOYSA-N 379.891 5.261 30 20 GKED CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@H](C)c1ccc(C#N)cc1 470023146 WYOMMKUNYZANSO-DYESRHJHSA-N 379.504 5.105 30 20 GKED FC(F)Oc1ccc([C@@H](NCc2cccc(C(F)F)c2)C(F)(F)F)cc1 470777961 AJXANVVMBRBQEM-CQSZACIVSA-N 381.291 5.619 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCSCc1ccccc1 470803085 MVCBWOKWWOMRJV-UHFFFAOYSA-N 376.481 5.008 30 20 GKED C[C@H](NC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1ccc(C#N)c(F)c1 477853424 GCBAZEQQADERTE-NSHDSACASA-N 382.788 5.709 30 20 GKED C=CCn1c(Sc2ncnc3cccc(F)c23)nnc1-c1ccc(Cl)cc1 480423868 YYSJGLZWKDJXAU-UHFFFAOYSA-N 397.866 5.018 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Cl)cc2Br)cc1 483872053 NXKSDAZSPMBWGG-UHFFFAOYSA-N 377.669 5.156 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1S[C@H](C)c1ccccc1F 501601571 KEQLATSKSRELBU-CQSZACIVSA-N 387.455 5.175 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@H](C)CC)cc2)nnc1-c1cccnc1 503711270 HIOWEQVDDDEFNE-MRXNPFEDSA-N 392.528 5.015 30 20 GKED N#C[C@@H](NC(=O)c1sccc1-c1ccccc1)c1cccc(C(F)(F)F)c1 505972200 VNPZZTVGNZOOAU-QGZVFWFLSA-N 386.398 5.429 30 20 GKED C=CCNC(=O)[C@H](C)S[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 506235896 UUHQDOAIHRPFNO-ZJUUUORDSA-N 385.373 5.209 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)c2cc(C#N)ccc2Cl)c1C 507790066 VUJXWYHFCHZNOV-UHFFFAOYSA-N 377.831 5.268 30 20 GKED O=C(Cc1ccccc1C(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 509278251 XYJVRVOTKHXZLO-HNNXBMFYSA-N 393.302 5.197 30 20 GKED CC(C)[C@H](C)N(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 510892962 IRGFQAVBPBILLJ-HNNXBMFYSA-N 390.405 5.400 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@H](Cc2nc(C3CCCCCC3)no2)C1 510942368 ALOSRMRDVBOTPF-GOSISDBHSA-N 385.552 5.057 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)Nc1ccccc1SC[C@H](C)C#N 518170140 ZXMJNIGSMIZUFC-SJORKVTESA-N 397.544 5.608 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1occc1CSc1ccccc1 521542319 XRFSZHFJZNBXLJ-UHFFFAOYSA-N 377.509 5.443 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2cccc(OCc3ccccc3)c2)cc1 522282932 CQWSJBFYPRHDFL-UHFFFAOYSA-N 387.483 5.185 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnn(-c3ccc(F)cc3)c2C(C)C)c1 524167665 LLEQDRLRXNKIAU-UHFFFAOYSA-N 393.462 5.342 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1)c1ccccc1 534625004 DBJHQROBLJKIGR-OAQYLSRUSA-N 398.506 5.191 30 20 GKED C=C[C@H](CC(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccccc1 536163536 PNSDNJPICMBYGK-VQIMIIECSA-N 385.891 5.196 30 20 GKED C=CCCOCCCCC(=O)NC[C@H]1CC2c3ccccc3C1c1ccccc12 538266040 YTWKNOPNDTWYDV-DJOCHQMASA-N 389.539 5.163 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)NC1(c2cccc(C#N)c2)CC1 551574059 CETPISDEHZFBDR-OAHLLOKOSA-N 377.488 5.469 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(COc3ccc(F)cc3)c2)c1 553062001 XNUCOJVZRHAUTF-UHFFFAOYSA-N 380.806 5.182 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@@H](NCc1ccc(C#N)c(F)c1)c1ccc(Cl)cc1)C2 574416214 KPJKXVNSHITPEJ-FUDKSRODSA-N 397.925 5.054 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCCc3c[nH]c4ccccc34)cc2)ccn1 580492037 ZIADVVPDEVWSGX-UHFFFAOYSA-N 396.450 5.188 30 20 GKED C[C@H]1CN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC2(CCCCC2)O1 594073058 ZMAWEPIZOQVPOA-IRXDYDNUSA-N 387.549 5.036 30 20 GKED CCOc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603673270 VHWGLVIWRRCSCH-FQEVSTJZSA-N 390.870 5.646 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2nc(-c3ccsc3)oc2C)n1 608845532 GGJVYCBKSZOYFT-UHFFFAOYSA-N 395.431 5.598 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609176837 YYDBDNJGPPYAFY-UHFFFAOYSA-N 388.492 6.103 30 20 GKED Cc1cccc2c1CC[C@@H]2NC(=O)c1ccccc1Sc1ccccc1C#N 609189959 QPTOTPJECPSDPH-NRFANRHFSA-N 384.504 5.435 30 20 GKED C[C@](C#N)(NC(=O)c1sc2cccc(Cl)c2c1Cl)C1CCCCC1 609638185 NNIABEXOYHXMHL-GOSISDBHSA-N 381.328 5.800 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(F)cc2C)c(F)c1 609754852 JQKJXNJKPJXEKI-UHFFFAOYSA-N 378.378 5.073 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cc4occc4s3)c2)cc1 609855590 ZKMZDJOWSANLPM-UHFFFAOYSA-N 388.448 5.392 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@@H]2C2CCCCC2)cc1 610205625 RNXCSTKMEZTZPC-YADHBBJMSA-N 390.552 5.549 30 20 GKED C[C@@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1cccc(C#N)c1 610407066 PYYDXHVBHJNTBT-OAHLLOKOSA-N 383.442 5.052 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N(C[C@H](C)C#N)C2CC2)c(C(F)(F)F)c1 611095051 PDUWLMQKKFWOJJ-CHWSQXEVSA-N 399.482 5.752 30 20 GKED CN1CC[C@H](CN[C@@H]2CCCc3cc(C#N)ccc32)[C@H]1c1ccc(Cl)c(F)c1 611395223 VGPBRBKAISWPHC-SXSPYAJSSA-N 397.925 5.011 30 20 GKED N#C[C@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc2ccccc2n1 613290823 NHWSNPGWCCFIEH-AWEZNQCLSA-N 397.286 6.246 30 20 GKED Cc1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c(C)c(C)c1O 615497251 UACUYVDSGGAACH-UHFFFAOYSA-N 388.427 5.020 30 20 GKED C[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 620457143 WSZKKRJDMASJQL-MUYACECFSA-N 399.350 5.030 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H]1CCCC(F)(F)C1 622284064 MWDIJVUPZZWAFP-QMMMGPOBSA-N 375.259 5.488 30 20 GKED C=CCN(C(=O)c1oc2c(Cl)cccc2c1C)c1nc2c(s1)CCCC2 623331539 CPJBHGZSHXIIQR-UHFFFAOYSA-N 386.904 5.563 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2Cl)cc1)c1nc2ccccc2o1 673812255 SLCUSEMLZOODPQ-INIZCTEOSA-N 388.810 5.764 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)C[C@H]1CCCO[C@@H]1c1ccccc1 674249805 KCUSKEHUHHSISJ-IFMALSPDSA-N 387.445 5.157 30 20 GKED Fc1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(C(F)(F)F)c1 678208120 LNODBCLMGVBOCT-NXEZZACHSA-N 397.256 5.407 30 20 GKED CCCCN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](C)c1ccc(C)o1 726484929 GAYXMAJQOFSLIL-CQSZACIVSA-N 375.925 5.673 30 20 GKED COc1ccc(NC(=S)N(Cc2ccc(C#N)cc2)CC(C)C)cc1Cl 726905557 RSTYEFCLDULHAM-UHFFFAOYSA-N 387.936 5.075 30 20 GKED CC(=NNc1ccc(Cl)nn1)c1sc(-c2ccc(Cl)cc2)nc1C 727650573 MWZYGGVCDLEQPL-UHFFFAOYSA-N 378.288 5.051 30 20 GKED Cc1cc(C(=O)N2CCCSc3ccccc32)c(C)n1-c1ccc(C#N)cc1 728694118 DLIINCRQFOVGGV-UHFFFAOYSA-N 387.508 5.108 30 20 GKED COc1ccc(/C=C2/CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)c(Cl)c1OC 730433918 KFNZMYGAXCIFDD-CYRKZOTCSA-N 399.830 5.095 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1ccccc1SC[C@H](C)C#N 730989121 HNBBKBJLINWMFO-DNHBRAKOSA-N 394.540 5.768 30 20 GKED N#C[C@@H](NC(=O)Cc1ccc(Cl)cc1Cl)c1cccc(Cl)c1Cl 731195728 NINSPRMRLTXCFR-CQSZACIVSA-N 388.081 5.224 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])s1 731966312 GLHLAGJCZQYSEL-UHFFFAOYSA-N 396.900 5.255 30 20 GKED C#CC[C@H](OC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccccn1 733692468 GVTUZWFXVAVLIP-QFIPXVFZSA-N 391.854 5.089 30 20 GKED C#CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1ccccc1)c1cccs1 735188991 OPMRKNNJVKAKEQ-NRFANRHFSA-N 392.499 5.016 30 20 GKED Cc1ccc(C)c(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)c1 739436914 DUQSJLNASAGYGY-UHFFFAOYSA-N 377.538 5.390 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(SCC(F)(F)F)cc2)cc1 741844192 SQDYXRHBLNHATP-MCRQLQJRSA-N 391.414 5.528 30 20 GKED CCc1cnc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 747536969 HBGVPNJBPCLPCX-HXUWFJFHSA-N 390.512 5.025 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2ccc(F)cc2)cc1 751015822 YAYQVWMHZQKGKY-UHFFFAOYSA-N 393.443 5.307 30 20 GKED Cn1c(CC(=NOCCCCC(F)(F)F)c2ccccc2)nc2ccccc21 752778289 AEAIWWRURHRCNG-UHFFFAOYSA-N 389.421 5.269 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Nc3ccccc3)cc2)c(Cl)c1 754400755 MBOWOTVXRSGRDW-UHFFFAOYSA-N 382.250 5.861 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1ncccc1Cl 754706877 SXXIJBGVBGKSKS-UHFFFAOYSA-N 388.302 5.203 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1 761668565 OXCHVPHIPBOMQZ-IBGZPJMESA-N 387.842 5.044 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(O)(c2ccccc2Cl)CC1)c1ccccc1 765533521 GUFWGBDPAHTUJC-NRFANRHFSA-N 398.934 5.041 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(OC)c(Cn2cccn2)c1)c1ccccc1 773076372 NCBBXRKANPYSJU-AUSIDOKSSA-N 375.516 5.298 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 773761835 WEANXOYJALDOLF-GHTZIAJQSA-N 379.463 5.330 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CCO1 777566394 RWVDAFNXPPHIDO-ZLNRFVROSA-N 391.515 5.057 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1C(F)(F)F 797570112 CTIUTVZNKFGESM-TZMCWYRMSA-N 394.462 5.829 30 20 GKED C[C@@H](CSc1ccc(F)cc1)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570137 DGBHIAKGHAVQIM-SWLSCSKDSA-N 376.522 5.184 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)CCSc1cccc(Cl)c1 808978298 JOQNMBVDKWCYPD-KRWDZBQOSA-N 396.899 5.204 30 20 GKED C=CCOc1c(Br)cc(/C=C\C(=O)c2cccc(F)c2)cc1OC 810194869 OIZFHWDWMOIKBX-FPLPWBNLSA-N 391.236 5.058 30 20 GKED C[C@@]12CC[C@H]3[C@H](CC=C4C[C@H](OC(=O)CC5(C#N)CC5)CC[C@@]43C)[C@@H]1CCC2=O 815965887 FSTKFRZRNYBVMM-WGTGAISYSA-N 395.543 5.124 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ccc(Cl)nc3Cl)c2C#N)[C@@H](C)C1 839388253 JURJPHDNPRVLBJ-IUCAKERBSA-N 380.300 5.260 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842942567 PKLUHAIYYRXCST-ABAIWWIYSA-N 378.419 5.409 30 20 GKED C[C@@H]1CCC[C@H](c2noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)C1 848605732 ROSSGZUNIHLQGM-PMPSAXMXSA-N 376.501 5.013 30 20 GKED CCCCSc1ccc(Cl)cc1-c1noc([C@@H](N)CCCCC#N)n1 848625807 MIGXNLHABMFZGS-HNNXBMFYSA-N 378.929 5.366 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCSc3ccccc3)n2)cc1 920140648 AMRPSTKJXJABFP-SFHVURJKSA-N 394.521 5.177 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C\C(=O)c3cc(F)ccc3F)c2)c1 1776113649 QQXOYKRCDBBDKY-YFHOEESVSA-N 394.373 5.138 30 20 GKED C=CCCC[C@@H](NCc1ccccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776172194 HORMEADJEZLPAX-GOSISDBHSA-N 394.298 5.685 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1csc(Cl)c1Cl 1776355049 BZVAQYHKSMKZRO-HYXAFXHYSA-N 385.268 5.436 30 20 GKED CCCCCCCOc1ccc(CN[C@H](c2ccccc2)[C@H](C)C(=O)O)cc1 1776786497 MTCAASVLKSIUJW-CVDCTZTESA-N 383.532 5.587 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776817320 WNERDGMGXXDKDN-CXUHLZMHSA-N 386.447 5.737 30 20 GKED Cc1ccsc1C(=O)/C=C/c1cccc(OCc2cccc(C(=O)O)c2)c1 1777477157 BKFWHVPHEFQWTJ-CMDGGOBGSA-N 378.449 5.230 30 20 GKED CCN(C(=O)CCCc1ncc(-c2ccccc2)o1)[C@H](C)c1ccc(C#N)cc1 44573004 NNOBKMQOCMBRBF-GOSISDBHSA-N 387.483 5.146 30 20 GKED COCc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)oc2ccccc12 66801881 LEVNRVYKAKCLHU-CQSZACIVSA-N 380.469 5.226 30 20 GKED COc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66954265 BZIZSAZDWDVDAA-QFBILLFUSA-N 395.528 5.458 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)[C@H](C#N)c1nc2ccccc2o1 69285812 OHQMRTFOIRHXMS-JTQLQIEISA-N 399.884 5.465 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(Cc1ccncc1)C1CC1 98030906 RHKIEPIBAPYJNK-UHFFFAOYSA-N 398.466 5.251 30 20 GKED Cc1cc(C(=O)CCC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)s1 108324332 ZPTMDPUNIUQUMN-CYBMUJFWSA-N 386.542 5.218 30 20 GKED CCN(C(=O)c1sccc1C#N)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 112640650 LDKCRGNSSMMLSE-NRFANRHFSA-N 389.524 5.390 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Br)cc2F)c1 127925970 RTVATCDXZHEHMN-BBRMVZONSA-N 391.284 5.120 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1)c1ccccc1 155147550 FIIJRDKKOACPTF-INIZCTEOSA-N 394.902 5.547 30 20 GKED C[C@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)c1ccc(C#N)cc1 159353568 NJRBBNSPUIYNGS-INIZCTEOSA-N 389.528 5.570 30 20 GKED N#Cc1csc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 176949031 DJVNEICEUNWSSN-KRWDZBQOSA-N 377.856 5.181 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(CC1CCC1)[C@H](C)c1ccccc1 180053109 QLSISNPOMQBIGB-ZWKOTPCHSA-N 377.488 5.373 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 180063043 FLLZKXBGGRSROY-LAUBAEHRSA-N 393.487 5.135 30 20 GKED COc1cccc([C@H](N[C@H](C)c2ccc(C#N)cc2)c2cc(F)ccc2OC)c1 181847619 OYKBSOKHHMOWHQ-GYCJOSAFSA-N 390.458 5.155 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2nc3ccccc3s2)o1 183104904 HOQYMDYHFKWQBJ-ZDUSSCGKSA-N 389.436 5.099 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccc(O[C@H](C)C#N)cc1 237606864 DNBWTSFMWQHVRH-HZPDHXFCSA-N 377.513 5.260 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(F)cc(F)c2)cs1 255831817 MOSDHPKTVVSLMM-YVMONPNESA-N 398.434 5.310 30 20 GKED O/C(=N/CCc1cc2ccccc2o1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329503718 ZDSGEJQIMSVYKG-LJQANCHMSA-N 391.515 5.439 30 20 GKED Cc1cc([C@H]2CCCN2C(O)=Nc2cc(Cl)ccc2OCC2CCC2)on1 329799263 HILFEQAWJWHZCJ-QGZVFWFLSA-N 389.883 5.198 30 20 GKED CC[C@@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1ccccc1OC(F)F 425427366 SMTJJGVVYDCZPQ-RDTXWAMCSA-N 387.430 5.013 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(N2CCCCCC2)c1 425654013 PRIJCDUHZIUSHY-SFHVURJKSA-N 376.504 5.164 30 20 GKED N#Cc1ccc(NC(=O)Nc2cccc(CC(F)(F)F)c2)cc1C(F)(F)F 438627853 AFAPAMBEQCBAKV-UHFFFAOYSA-N 387.283 5.326 30 20 GKED C[C@H](CC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(Br)cc1 439669345 DOFZIEQCWUEWGS-DNVCBOLYSA-N 385.305 5.104 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(OCC3CCOCC3)cc2)CCCC1(C)C 444902680 WSCWJGZJYPQRAZ-OAQYLSRUSA-N 386.536 5.091 30 20 GKED C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCC[C@@H]1c1ccccc1Cl 453461069 NQRPGBDTPMYLIX-IPELMVKDSA-N 386.927 5.089 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc(Sc2ccccc2C#N)cc1 455946332 PTNAIOSMHCUYKG-UHFFFAOYSA-N 378.501 5.161 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCCC[C@@H]1c1ccncc1)c1ccccc1 458807639 XUWNSVCZWJHWJV-FCHUYYIVSA-N 376.504 5.143 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3c(F)cccc3NC3CC3)c2)cc1 471142196 LFEKTYUCEGVZGJ-UHFFFAOYSA-N 387.414 5.316 30 20 GKED N#CC[C@@H](CC(=O)NCc1ccc(OC2CCCCC2)cc1)c1ccccc1 475443322 FGNSVVSUOJJKJV-NRFANRHFSA-N 376.500 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Br)cc1C 476091381 ONZOVMLZOVAAOZ-UHFFFAOYSA-N 386.333 5.791 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccc(F)cc1)C(C)C 476841445 CSMCADWPEYGZQE-NRFANRHFSA-N 386.515 5.088 30 20 GKED C=C(C)[C@@H](NCc1nnc(-c2cc(C)c(CC)s2)o1)c1ccc(F)c(F)c1 481598371 NHPQZEQZVZDHCK-LJQANCHMSA-N 389.471 5.354 30 20 GKED Cn1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c2cc(F)ccc21 483486096 AUVGYVWGYMCOOP-ZDUSSCGKSA-N 383.835 5.071 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 487797130 LRRNBNGUMZIHBL-QFIPXVFZSA-N 385.467 5.629 30 20 GKED C=CCC[C@H](C(=O)Nc1ccccc1CC(=O)OC(C)(C)C)c1ccccc1 489704799 UMIVKGVQLHNMAF-FQEVSTJZSA-N 379.500 5.259 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](c1c[nH]c2ccccc12)C(F)(F)F 490855219 OFLYHGAQLPJJHK-KRWDZBQOSA-N 393.434 5.231 30 20 GKED C=CCN(Cc1cccs1)C(=O)CCCc1ccc(Br)s1 493701629 IYTHVDYCXWWAKP-UHFFFAOYSA-N 384.364 5.110 30 20 GKED COc1ccc(/C=C\c2nc(-c3ccccc3)cs2)cc1OCCCC#N 494111053 CYMOJLVPGLPXJS-BENRWUELSA-N 376.481 5.672 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CCCCC(=O)c1ccc(F)cc1 494822838 WJRIVISLGFFADM-UHFFFAOYSA-N 394.490 5.125 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(OCc2ccncc2)cc1 497508616 ZVXUCUYWERVOAG-UHFFFAOYSA-N 398.915 5.204 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)nc1 498164453 FSZPHZDQAODGJI-UHFFFAOYSA-N 395.871 5.130 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cnn1CC(C)C 500453329 VMNKSMNZZSDSKX-INIZCTEOSA-N 398.919 5.115 30 20 GKED Cc1cccc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c1C 502464484 AMABRGYZOZOTIX-UHFFFAOYSA-N 389.430 5.537 30 20 GKED COc1ccc(NC(=O)c2ccc(C(F)(F)F)c(F)c2)c(C(F)(F)F)c1 503059554 YTPROXATBXDBCL-UHFFFAOYSA-N 381.247 5.124 30 20 GKED Cc1ccc2nc(-c3ccc(NC(=O)Cc4ccc(C#N)cc4)cc3)sc2c1 504362854 QVBDPLGOWZNZHX-UHFFFAOYSA-N 383.476 5.325 30 20 GKED C[C@@H](Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1F 512295607 MHJIBAGZKYEAHI-CQSZACIVSA-N 383.442 5.528 30 20 GKED CCN(C(=O)c1cnc(-c2ccccc2F)s1)[C@H](C)c1ccc(C#N)cc1 516757887 QOWVXSFIAOUHFH-CQSZACIVSA-N 379.460 5.044 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccc1F 517346745 XKOWISZQRALEBS-UHFFFAOYSA-N 378.378 5.295 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 519077732 RASTXNIWDAXKAI-UHFFFAOYSA-N 395.233 5.307 30 20 GKED CC(C)c1ccc(SCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 519414581 MMSBDZSHCNIVOE-MRXNPFEDSA-N 384.570 5.793 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)cc1 520198876 JFHRVTPQTJNOSH-YOEHRIQHSA-N 387.936 6.007 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2cccs2)n1)c1cccc(Cl)c1Cl 520889837 UTPVGYOBTQAEAM-LLVKDONJSA-N 394.308 5.173 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(-c2ccccc2OC)n1 531342460 WYAGMLUSMDJUGF-UHFFFAOYSA-N 377.513 5.103 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl)OCC 534491266 ONDHZALWOIMBNG-QGZVFWFLSA-N 395.286 5.491 30 20 GKED N#Cc1cc(F)ccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 534885359 DQCJNMVBMAJGFQ-UHFFFAOYSA-N 391.789 5.267 30 20 GKED CCC[C@H](C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 538827589 JOPUHWVUKGRQHM-CQSZACIVSA-N 382.847 5.087 30 20 GKED CSc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c1C 540435830 YURYGANNIDYZEO-UHFFFAOYSA-N 375.453 5.028 30 20 GKED COc1ccc(C[C@@H](N[C@@H](C)c2cccc(C#N)c2)c2ccccc2)cc1OC 540594627 CSFXIQHNMXGWAB-FDDCHVKYSA-N 386.495 5.210 30 20 GKED Cc1c(C(=O)N[C@H](CCC#N)c2ccccc2)oc2c(Br)cccc12 543854311 CXNRVFLDTZVMKF-QGZVFWFLSA-N 397.272 5.279 30 20 GKED Cc1nc(CCCC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 543915301 FKZMNTLUMJMMAC-MRXNPFEDSA-N 389.524 5.190 30 20 GKED Cc1cc(Br)cc(CNc2ccc(CC#N)cc2)c1OC(F)F 546780554 GFQYJAUFDVGKSX-UHFFFAOYSA-N 381.220 5.037 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC=C(c4ccco4)C3)cc2)c1 554446099 CDKMLQUMVBMZJG-UHFFFAOYSA-N 385.423 5.265 30 20 GKED N#Cc1ccc(CNc2ccc3nc(C(F)F)sc3c2)c(C(F)(F)F)c1 554975535 IVYMPMOXHXZWSQ-UHFFFAOYSA-N 383.345 5.736 30 20 GKED COc1ncc([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1Cl 560234630 JWUMFLIPCWZSQW-JKSUJKDBSA-N 391.902 5.694 30 20 GKED FC(F)(F)c1nsc(N2CCC(F)(c3ccccc3C(F)(F)F)CC2)n1 561322157 LKOQWRAHKLOENT-UHFFFAOYSA-N 399.335 5.041 30 20 GKED CC1(C#N)CCC(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)CC1 572210869 SQRKLNSFMQNUHS-UHFFFAOYSA-N 384.527 5.160 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CC1 572875459 JCKFUKXWMXJTRJ-UHFFFAOYSA-N 385.414 5.305 30 20 GKED COc1ccc([C@H](N[C@@H]2CCCc3cc(C#N)ccc32)c2ccc(F)cc2)cc1 580943865 YQEJIVSNTCRODU-JWQCQUIFSA-N 386.470 5.463 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CC1 583751741 UQIFCOXQITWZIX-UHFFFAOYSA-N 390.512 5.257 30 20 GKED CN(Cc1ccc(C#N)cc1C(F)(F)F)C[C@H]1CCCO[C@H]1c1ccccc1 589499684 ZISSXLYYBZOJKQ-CTNGQTDRSA-N 388.433 5.177 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2ccccc2[C@H](C)C1 593159107 JPSCNEZURDRCHI-DLBZAZTESA-N 379.529 5.132 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC[C@H](CC#N)C3)cc2)cc1 596642458 WRPDTTYKSKTIMW-QGZVFWFLSA-N 379.460 5.035 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C[C@@H](C)C1(F)F 599727327 ZLQZIBUTZXUKTK-HUUCEWRRSA-N 385.414 5.106 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 602784760 HKRGEKZATIICAD-UHFFFAOYSA-N 376.934 5.516 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1cc2ccccc2o1 604374957 PEKWXWRRCQQRFI-UHFFFAOYSA-N 382.419 5.586 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc2ccccc2c2cccnc12 609377342 SPOFTBHUXGTWSM-INIZCTEOSA-N 397.503 5.892 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC(C)(C)c1cccc(F)c1 609826860 HAWKRPQSXPMOMU-OAHLLOKOSA-N 385.508 5.177 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCCC34CCCCC4)cn2)cc1 611160280 IZYNDGIBDOHVRM-UHFFFAOYSA-N 376.460 5.076 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)s2)C1 612239823 NVEYMWBEWWOONG-GOSISDBHSA-N 394.418 5.080 30 20 GKED CC(C)(C)c1nc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)no1 647634396 XKKVEYXTSGHXNO-UHFFFAOYSA-N 399.310 5.269 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)n1 673812097 PSOOSFMBGQGRBF-LBPRGKRZSA-N 393.415 5.084 30 20 GKED N#C[C@@H](C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1ccc2ccccc2n1 683221509 QGOBYYYOUIFIFS-GFCCVEGCSA-N 376.284 5.022 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)c1 728482090 HBMZPMOGFPRBDT-UHFFFAOYSA-N 396.368 5.151 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417792 SOXMRIBQLLSAPL-OXJNMPFZSA-N 398.528 5.570 30 20 GKED Cc1cccc(OCCCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730418504 WFCZJLCQIRKMJG-QGZVFWFLSA-N 382.460 5.169 30 20 GKED COc1cc(C)c(NCc2cccc(OCc3ccccc3C#N)c2)cc1OC 734157580 BXKIOWCRQOMGHV-UHFFFAOYSA-N 388.467 5.075 30 20 GKED C=CC[C@@H](NC(=O)NCc1ccccc1-c1ccc(Cl)cc1)c1ccncc1 734666810 LWEOGYIHBICSCF-JOCHJYFZSA-N 391.902 5.519 30 20 GKED CCc1ccc(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 736955819 PQTUDWIJSBANQE-XMMPIXPASA-N 383.495 5.269 30 20 GKED C[C@@H]1c2ccc(F)cc2CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738894460 FMBJHUHYAMTSOA-MZNJEOGPSA-N 399.469 5.632 30 20 GKED CC(C)c1cccc(S(=O)(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 742028810 IDDGFWBABDMTRJ-QHCPKHFHSA-N 390.508 5.266 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2cccc(OC3CCCC3)c2)n1 747196519 LUZOONWBARTBQT-IBGZPJMESA-N 382.529 5.397 30 20 GKED CC[C@H](Oc1ccccc1F)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 748294546 GEWCNGIVYQYQDB-IRLDBZIGSA-N 388.442 5.277 30 20 GKED CC(C)[C@H](C#N)OC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 750649434 ZLWBGCCGGQVVIL-KRWDZBQOSA-N 382.510 5.294 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)sc21 752046816 COQLIAYLYVFDQJ-TZIWHRDSSA-N 399.519 5.305 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(N2CCCCC2)cc1 753135938 UJUOFCRKGMTHBU-QXMHVHEDSA-N 375.497 5.092 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C\c2ccc(C(F)(F)F)s2)SC1=S 760990181 YNPPNDIVXPTLOY-KPKJPENVSA-N 396.440 5.044 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3nc(Cl)ccc3Cl)o2)cc1 762479028 JBWSVKXZURPFLL-UHFFFAOYSA-N 394.283 5.296 30 20 GKED C=CCn1c(C)nn(CN2CCCC[C@H]2c2cccc(C(F)(F)F)c2)c1=S 768905288 WAPWTCSLIXQVPL-KRWDZBQOSA-N 396.482 5.112 30 20 GKED N#C[C@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nccc2ccccc12 792102684 IZOKSWDHSMDVNI-HXUWFJFHSA-N 387.870 5.500 30 20 GKED COCCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CC[C@H](C)C1 792230708 XJYRTKORHYBJNG-CDNPAEQRSA-N 391.515 5.011 30 20 GKED O=C(/C=C\c1cnnn1Cc1ccccc1)c1cc2c(ccc3ccccc32)o1 792870730 SWAKJAFODCYYSO-QXMHVHEDSA-N 379.419 5.122 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797567319 GNUZJEONCOJKFT-MAUKXSAKSA-N 382.529 5.136 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)Cc2ccc(Br)c(Cl)c2)n1 810604916 BSBHTGHCWDWAOX-LLVKDONJSA-N 397.725 5.101 30 20 GKED N#Cc1sc(NC(=O)c2cc(-c3cccs3)nc3ccccc23)nc1Cl 813371089 WKCYANBCAWUAMC-UHFFFAOYSA-N 396.884 5.197 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc3ccccc3n2)cc1 813409740 LNWIJCYGXFCQBS-XMMPIXPASA-N 391.474 5.462 30 20 GKED Cc1c(C(=O)/C=C/c2cn(C3CCCC3)nc2-c2ccccn2)cnn1C(C)C 840719505 GOZXNIGFUFTGCJ-VAWYXSNFSA-N 389.503 5.042 30 20 GKED COCc1csc(/C=C2/CC(C#N)C/C(=C/c3cc(COC)cs3)C2=O)c1 899381045 LTDWVWRQHIKTCT-MZAUSLISSA-N 399.537 5.072 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1sccc1Br 915049842 ZOWRVJZJQOTRNE-UHFFFAOYSA-N 387.262 5.036 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3cccs3)on2)cc1 915087897 XRDVLTXEOPEVQH-SFHVURJKSA-N 385.448 5.311 30 20 GKED CCCCCCCCCNC(=O)N1CCC(C(=O)c2cc(F)ccc2F)CC1 916193978 CHJAGKGLBQNWFJ-UHFFFAOYSA-N 394.506 5.320 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C/Sc2ccccc2)cc1 916953543 DAYCKIQANMVCPC-LCRSLFLVSA-N 378.497 5.153 30 20 GKED N#CCCC[C@H](N[C@H]1CCCc2ncc(Br)cc21)c1ccccc1 926479809 MSEBEBQTMHCJQW-ICSRJNTNSA-N 384.321 5.246 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H]2CC[C@@]21c1cccnc1 931058726 DLVGFRRJXYFCEW-CYFREDJKSA-N 375.516 5.477 30 20 GKED CCCCCCCC[C@H](C)C(=O)NCc1cc2sc(C(=O)O)cc2s1 1776786013 AMLFLGWWNOQFKS-ZDUSSCGKSA-N 381.563 5.664 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2SCc2cscn2)c1 55723696 IRFFJLFQVDUWMQ-UHFFFAOYSA-N 382.510 5.253 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(OCc2cccs2)c1 62905898 FFRMXSONJSLRKS-UHFFFAOYSA-N 388.492 5.027 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1CCc2cc(F)ccc21 72023926 NJIKEXZVEBACGC-FQEVSTJZSA-N 388.467 5.266 30 20 GKED CSc1cccc(NC(=O)[C@H](C)Nc2ccccc2SC[C@@H](C)C#N)c1 108407474 ZJMAIFAMAKGSBG-GJZGRUSLSA-N 385.558 5.099 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 112149391 UEGXVSFCFOAUHS-ZFWWWQNUSA-N 382.435 5.143 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1 113321684 IBBYUJLIVYTYSR-FQEVSTJZSA-N 398.506 5.192 30 20 GKED C[C@@H](S[C@H](C)c1ccc(C#N)cc1)C(=O)Nc1ccccc1C(F)(F)F 118445091 IIKXHYZAKKATNK-CHWSQXEVSA-N 378.419 5.398 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cccc(C[S@](=O)C3CCCCC3)c2)cc1 133307828 FFDZHSRDCYDLOJ-XDBZFTIUSA-N 396.556 5.171 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(COCc3ccccc3)cc2)cc1 150855212 OCJKAEQIKBJKTJ-UHFFFAOYSA-N 388.492 5.006 30 20 GKED C[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1cccc(NC(=O)c2ccccc2)c1 174044912 WAXOGDVUUNYNLV-MOPGFXCFSA-N 399.494 5.253 30 20 GKED COc1cc([C@@H](C)NCc2cc(C#N)ccc2F)ccc1OCc1ccccc1 179708250 UYHFYBCLMLXXCI-QGZVFWFLSA-N 390.458 5.136 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(SC)c(F)c2)ccc1OC 180813697 SIWCALJZPMOFTO-WMLDXEAASA-N 388.508 5.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nc(-c2cccc(OC)c2)[nH]c1C 188066284 GWXWDOMBXUCUEX-UHFFFAOYSA-N 389.499 5.498 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(NC(C)=O)c1 191455181 DPKSGQOKNVJBFK-MRXNPFEDSA-N 379.504 5.380 30 20 GKED CC(=O)c1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 192786881 GWCFHDMCDLQTOQ-GOSISDBHSA-N 394.883 5.465 30 20 GKED N#Cc1ccc([C@H](S[C@@H](c2ccccc2)c2ccc(Cl)cc2)C(N)=O)cc1 261440571 BOQIMYXORDIDDX-SFTDATJTSA-N 392.911 5.261 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303310927 QZBWUEXMNOCMKD-SJORKVTESA-N 382.529 5.468 30 20 GKED C[C@@H]1CCCC[C@@H]1OCC/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329414396 CPRNTTDQGNBMSO-QFUCXCTJSA-N 387.568 5.045 30 20 GKED CC(C)(C)Cc1nc2cc(N=C(O)N3CCC[C@H]3c3ccncc3)ccc2o1 329593548 ZUFRCIVZDDQTEI-SFHVURJKSA-N 378.476 5.194 30 20 GKED OC(=Nc1cccc(F)c1)C1CCN(/C(O)=N/[C@@H]2CC[C@@H]3CCC[C@H]3C2)CC1 329823283 ZLCOWTZHDWFJER-RIFZZMRRSA-N 387.499 5.009 30 20 GKED C=CCCc1ccccc1NCc1nnc(-c2ccccc2Br)o1 409842201 CMVFAMXMOTWZQD-UHFFFAOYSA-N 384.277 5.230 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@H](C)CC3)s1 410990422 WMMVSSHPTIPXRP-IJLUTSLNSA-N 389.546 5.112 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@H]3C)s1 410992446 WZSILTJYORCTOK-QJPTWQEYSA-N 389.546 5.112 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 432980249 SPHLIIUEXOHTSU-UHFFFAOYSA-N 398.510 5.619 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)[C@H](C#N)CCc2ccccc2)c1C 433312654 MWFWDQBNADVNEN-FQEVSTJZSA-N 385.467 5.202 30 20 GKED C=CCn1c(S[C@@H](C#N)CC)nc2sc(-c3ccccc3)c(C)c2c1=O 436041442 PNZHWVXHLRZVIN-OAHLLOKOSA-N 381.526 5.014 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438860122 QPUVXYNROWZRHA-XGHQBKJUSA-N 383.923 5.518 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)CC1 441798271 CXVVHPIFTJQAGQ-JFIBYHEFSA-N 389.421 5.072 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(c3cccc(F)c3C#N)C2)n1 447689528 QGKQGHNMPSXSJR-OAHLLOKOSA-N 393.487 5.213 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC4(CCC4)[C@@H]3c3ccco3)cc2)cc1 454598198 FVGDSLYDYUNVGW-QFIPXVFZSA-N 399.450 5.703 30 20 GKED CC(C)Oc1c(F)cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1F 455123720 GBAQTCYSKPSQIG-IBGZPJMESA-N 387.430 5.309 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F 463740883 WQSUMBFISDMUSJ-LZWOXQAQSA-N 399.482 5.523 30 20 GKED N#C[C@H](C(=O)c1ccccc1Sc1ccccc1)c1cc(C(F)(F)F)ccn1 464467368 YWGPRBQIPDBTNK-KRWDZBQOSA-N 398.409 5.742 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1ccc(F)cc1F 467319370 IVLLFGZVXXJZGQ-CYBMUJFWSA-N 392.496 5.231 30 20 GKED Cc1oc2ccccc2c1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 467334914 IXBDASLPPBKURX-CQSZACIVSA-N 379.485 5.315 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)c1ccccc1Sc1ccccc1C#N 470621967 RTTWEACNTXVWAP-BBRMVZONSA-N 390.430 5.122 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cccc(COCc2ccco2)c1 471205363 XILQEIMJXZQIDU-UHFFFAOYSA-N 390.483 5.607 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(NC(=O)C(C)C)ccc1C 471207991 PBNGTEODEGODGQ-UHFFFAOYSA-N 379.504 5.200 30 20 GKED CSc1ccc(NC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1Cl 474776244 QAHYIEUKBWTJSB-UHFFFAOYSA-N 395.871 5.373 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCN(c2ccccc2)C1 475568120 MLQKNCWIIGURBY-FQEVSTJZSA-N 377.532 5.329 30 20 GKED C[C@@H](C(=O)Nc1sc2c(c1C#N)CCCCC2)N1[C@H]2CC[C@H]1c1ccccc12 483065405 CYTHDKDMRDGYRL-GKCIPKSASA-N 391.540 5.107 30 20 GKED CC(C)(C)[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 483088851 OERQPFPOSVJPFQ-WIYYLYMNSA-N 393.487 5.066 30 20 GKED Cc1ccc(-n2ncc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)c2C(C)C)cc1 483835549 CHCWZAIBSBQDAV-KRWDZBQOSA-N 387.487 5.059 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C 484142206 WOQWMTWIHAQRKC-OAHLLOKOSA-N 389.459 5.471 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccnc(Oc3ccc(F)cc3F)c2)cc1 484268870 PNGPICZYBROCKC-UHFFFAOYSA-N 393.393 5.206 30 20 GKED CC(C)(C#N)CC(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 486009310 UCMOWYQZKZRCJL-UHFFFAOYSA-N 390.405 5.396 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2OCC(F)F)sc2ccc(C#N)cc12 497663564 OKHZECOABAFWOU-UHFFFAOYSA-N 390.386 5.117 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(Br)cc1)[C@H](C)c1ccc(C#N)cc1 499284836 DTSMYAHIYZOJMO-LSDHHAIUSA-N 385.305 5.034 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1c(Cl)cccc1Cl 499830411 DQMIXNRPJFFGPF-LJQANCHMSA-N 398.293 5.302 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3ccc4c(c3)CCC4)c2)cc1 501473722 HCCFTNRMLLUGPC-UHFFFAOYSA-N 396.490 5.002 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 502672705 VUAOBJKYKYUYCI-INIZCTEOSA-N 399.454 5.085 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(O)c2ccccc2n1 510206117 AOJLJPWMWPTITC-CQSZACIVSA-N 384.464 5.122 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@@H](C)c1ccccc1 510856928 MLHFCUDGMVOIFH-SFHVURJKSA-N 385.467 5.884 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@H](C)c1ccc(C#N)cc1F 512661054 PSCQDZNJKSLWLR-OLZOCXBDSA-N 399.922 6.195 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1cccc(OC(F)F)c1 513225609 HRIHFLFGSNYBIV-OAHLLOKOSA-N 392.405 5.318 30 20 GKED Cc1ccnc2ccc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc12 513661153 NCUAPFWOFQKJTM-HNNXBMFYSA-N 377.856 5.296 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cc(F)cc(F)c2)cc1 514714673 IUIFLVICTYJUPE-UHFFFAOYSA-N 380.419 5.381 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H](C)Oc1ccc(F)cc1 516230630 NENAJHMTTIQUIU-INIZCTEOSA-N 390.414 5.204 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(SC)ccc3C)n2)cc1 517800699 BWXHFNXJHVYQMD-GOSISDBHSA-N 394.521 5.339 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 520704514 PYMKJJRHVLEWCD-FCHUYYIVSA-N 384.435 5.101 30 20 GKED CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 521712711 OUHWTCCZNOHKAX-JKSUJKDBSA-N 388.558 5.253 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cc(OC)ccc1Cl 523528486 BOAFQXVHHYWBQW-UHFFFAOYSA-N 385.769 5.185 30 20 GKED C[C@@H](c1cc2ccccc2o1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523590967 NDLFUENWYIDPOS-SFHVURJKSA-N 395.462 5.453 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2cccc3cccnc23)cc1 524029400 RBTALDGTFVKFKQ-UHFFFAOYSA-N 395.437 5.088 30 20 GKED C=CCC[C@H](NCc1ccc(Br)cn1)c1ccc(C(F)(F)F)cc1 533528395 RZSFZPQMWIGLPQ-KRWDZBQOSA-N 399.254 5.660 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(F)c(SC)c(F)c1 543320671 CQNBSZMKYQHYCI-UHFFFAOYSA-N 375.444 5.002 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccccc1C(F)(F)F 543346359 WSMXDXREKBSLDP-AWEZNQCLSA-N 387.405 5.012 30 20 GKED Cc1nsc(C)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 550604128 HAGBMMRJCIZCAR-UHFFFAOYSA-N 397.887 5.116 30 20 GKED C=CCOc1ccc(CN[C@H](Cc2cccnc2)c2cccc(Cl)c2)cc1 552322198 GPWVATFPMVLAJB-HSZRJFAPSA-N 378.903 5.373 30 20 GKED CCN(C(=O)c1cc(C2CC2)nc2ccccc12)c1ccc(C#N)c(Cl)c1 553049923 RDAAIFDXKNIOIE-UHFFFAOYSA-N 375.859 5.304 30 20 GKED CCN(C(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccccc1 553299480 DIUUIDPZTYXDHZ-SFHVURJKSA-N 385.467 5.204 30 20 GKED COCC(C)(C)CCCNC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 554341678 YLSKEZRWWSJGDP-GOSISDBHSA-N 393.531 5.038 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1csc(-c3ccc(C(F)(F)F)cc3)n1)CC2 554982098 IIDDGVCUIHMKCK-IBGZPJMESA-N 399.441 5.478 30 20 GKED N#Cc1ccc(CN[C@@H]2CCCc3cn(C4CCCC4)nc32)c(C(F)(F)F)c1 567524187 CGRUGOKHQQTONV-LJQANCHMSA-N 388.437 5.056 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@]1(C)OCCc2sccc21 574609181 UYUMIMDQUNXVOH-JOCHJYFZSA-N 384.545 5.210 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CC1 576944767 FHPDGNOEVMJBJQ-UHFFFAOYSA-N 393.874 5.160 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc([C@@H]2CCOC2)cc1 579557974 GTPBCHKZSRTBMA-DOTOQJQBSA-N 381.501 5.229 30 20 GKED CC1(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCC(=O)CC1 582527464 QOWHDOPSRHNQPE-IBGZPJMESA-N 380.875 5.083 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@@H]3CCc4c(Cl)cccc43)cc2)ccn1 589471445 JSHBABCKTNSMEJ-HXUWFJFHSA-N 389.842 5.067 30 20 GKED N#CCCC[C@H](NCc1cnn(Cc2ccccc2Cl)c1)c1ccccc1 590069755 WCJYECXDSZXOSQ-QFIPXVFZSA-N 378.907 5.110 30 20 GKED C[C@@H](Sc1ccc(Cl)cn1)C(=O)Nc1sc2c(c1C#N)CCCCC2 603503426 QZOWKUMZRUWYOQ-LLVKDONJSA-N 391.949 5.056 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1c(Cl)cccc1Cl 609377042 NABWCCDTQJMFDY-QWHCGFSZSA-N 393.339 5.987 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1SC[C@H](C)C#N 609398770 PJKZBGVCZYKSPC-YLJYHZDGSA-N 381.545 5.943 30 20 GKED CC(C)n1c(CNC(=O)c2ccccc2-c2ccccc2C#N)nc2ccccc21 609839128 MUZASIBJPFZTIA-UHFFFAOYSA-N 394.478 5.086 30 20 GKED C[C@H](CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)Cc1cccs1 610191429 NQZZWIQIMBJUAG-KRWDZBQOSA-N 390.508 5.215 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](C)c1cccc(C#N)c1 610355438 QOGIJFUNICIIOE-CYBMUJFWSA-N 376.287 5.158 30 20 GKED CC(C)c1noc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 647634103 NVXDXPSKIGRDEM-UHFFFAOYSA-N 385.283 5.095 30 20 GKED COc1cc(/C=C2/CCc3nc(-c4ccc(C)cc4)sc3C2=O)ccc1O 727654252 JOEAWMRFQJKCDJ-WJDWOHSUSA-N 377.465 5.045 30 20 GKED C[C@H]1CCCC[C@@H]1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 728175615 YGASBXOBOXOBIA-YWZLYKJASA-N 397.519 5.141 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)/C=C\c1ccc(Br)o1 731332303 IMXJRCDSXKJOAX-UPZNUWHASA-N 391.290 5.088 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2C(=O)O)c1)c1ccc(F)cc1F 731562847 HYAWULBBVHLCOO-DHZHZOJOSA-N 394.373 5.138 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1cccc(C(F)(F)F)c1 731646203 ZNNWXISIXSBBIK-HXUWFJFHSA-N 380.369 5.367 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)OC(=O)[C@@H](C)Oc1ccccc1C#N 733072724 RTFWGQXHEDOLFW-HZPDHXFCSA-N 392.480 5.062 30 20 GKED N#CCOc1ccc(Cl)cc1CSCC(=O)Nc1ccc2ccccc2c1 735319955 GPQUDFLNDWBSQY-UHFFFAOYSA-N 396.899 5.267 30 20 GKED Cc1ccc(/C=C2/CC(O)(C(F)(F)F)C/C(=C/c3ccc(C)cc3)C2=O)cc1 735792528 GGIYWZRDYQYZLW-YZLQMOBTSA-N 386.413 5.427 30 20 GKED CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738896237 MYORIACEIQVYAX-NMNUPHIUSA-N 375.516 5.775 30 20 GKED C#CCCNC(=O)c1ccc(N[C@H](C)c2cc(Cl)ccc2Cl)c(C)c1 741284195 IVHCSYPTLCLRPI-CQSZACIVSA-N 375.299 5.228 30 20 GKED N#C[C@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2s1 744017019 XOJFKTPUCWIPKT-LEWJYISDSA-N 396.515 5.889 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)c2cccc(Cl)c2)cc1 744034009 XYBNNOFRNJYQQT-BXTJHSDWSA-N 382.891 5.305 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2ccc(Cl)c(F)c2)cc1 747634823 BFTBFIRJPHEDFK-UHFFFAOYSA-N 376.863 5.189 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(OC)cc1 752476384 POZSNPMXRLVEJL-JXFKEZNVSA-N 390.508 5.579 30 20 GKED CC(C)Oc1ccc(-c2nc(C(=O)OCC3CCC(C#N)CC3)cs2)cc1 755956174 MYTVMXMUPLCWMM-UHFFFAOYSA-N 384.501 5.084 30 20 GKED CC(C)C[C@H](C)OCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 756231468 MOKBOFZMPWZXCX-WMLDXEAASA-N 390.936 5.481 30 20 GKED C=C[C@H](CC(=O)O[C@H](C)C(=O)Nc1c(C)cc(C)cc1Cl)c1ccccc1 758909970 DRYRWSVWCXDKQK-IAGOWNOFSA-N 385.891 5.187 30 20 GKED COc1cccc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1F 770065439 CEIJFOATLYOSBN-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C[C@H](NCc1c(F)c(F)c(F)c(F)c1F)c1ccc(OCC(F)(F)F)cc1 775223595 HCJMGDGZUXJFOA-QMMMGPOBSA-N 399.281 5.174 30 20 GKED CC(C)Cc1ccc([C@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 781928262 WFEQYRYWHILZPP-QFIPXVFZSA-N 395.572 5.371 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)c3cc(C4CC4)cnc3Cl)c2)s1 793540350 OBRAHUSHEIWVCS-UHFFFAOYSA-N 393.899 5.143 30 20 GKED COCC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 793565219 GXFDXWFFCKQUQD-XOBRGWDASA-N 393.314 5.324 30 20 GKED Cc1c(C(=O)O[C@H](C)c2nnc(-c3ccccc3)o2)sc2ccc(C#N)cc12 796614700 KPGKHVQEYWXXKI-CYBMUJFWSA-N 389.436 5.049 30 20 GKED C[C@H](C(=O)Oc1ccc(-c2ccc(C#N)cc2)cc1)[C@H]1OCCc2sccc21 796749640 WAUZQRROXRTHKF-OYHNWAKOSA-N 389.476 5.142 30 20 GKED N#C[C@H](C(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 819946353 MEQNDRSTGUGSNS-FAQJLRJSSA-N 393.295 5.028 30 20 GKED Cc1nc(C)c(/C=C2/CC(c3ccccc3)C/C(=C\c3oc(C)nc3C)C2=O)o1 821028603 USTRFRNULGVLPC-AYRZQKSOSA-N 388.467 5.510 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2Cl)cc1 915088074 ZVWQMMAGDYRYRR-IBGZPJMESA-N 381.262 5.901 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1OC 915352027 FHRNAQPFRXNAFF-GOTSBHOMSA-N 399.494 5.623 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(F)ccc3s2)cc1 916913987 JGLPKZSTPYXJBG-GOSISDBHSA-N 394.471 5.344 30 20 GKED CCN(C(=O)CCSc1nc2ccccc2s1)[C@@H](C)c1ccc(C#N)cc1 919862721 NYLTZZQIEMYHLG-HNNXBMFYSA-N 395.553 5.260 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3cccc4ccccc34)s2)cc1 1776114091 FTUSUUJGIWDHRQ-OWBHPGMISA-N 384.456 6.163 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ccc(Br)cc3)c2c1 1776114380 NYIQDIKHAQYRCK-XVNBXDOJSA-N 387.254 5.258 30 20 GKED Cc1c(Cl)ccc(/C=C(\C(=O)C(=O)O)c2ccc3ccccc3n2)c1Cl 1776117403 WDUXTQAMRYACJV-UVTDQMKNSA-N 386.234 5.044 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)cc2)cc1 1776125591 MPBLWJHSVGBRFQ-WBNHJWIASA-N 380.484 5.876 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)cc1)c1ccccc1 1776469407 JMGTXIVGKWBLNA-QMJOVRGKSA-N 386.447 5.350 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2ccccc21 1776526589 UDDLKWZDRYLCPZ-GHRIWEEISA-N 388.488 6.061 30 20 GKED CCCCCCCCCCCN(C)[C@H](C(=O)O)c1cc(OC)cc(OC)c1 1776785255 LDVJKOKEMPBLRM-NRFANRHFSA-N 379.541 5.292 30 20 GKED C=CCC(F)(F)C(=O)NC1(c2ccc(NC(=O)CCC=C(C)C)cc2)CCC1 1790452521 GXJDJUQMNIMHIT-UHFFFAOYSA-N 390.474 5.078 30 20 GKED N#CCCCOc1cccc(NC(=O)Cc2coc3ccc4ccccc4c23)c1 59770325 DZKZGIOYQHMPBM-UHFFFAOYSA-N 384.435 5.450 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1ccc(Cl)c(C#N)c1 66018660 UUSMLQZNCLPIJD-UHFFFAOYSA-N 394.308 5.611 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2c(c1)OC1(CCCC1)O2 66158343 OPZIMUUDZUKGBW-UHFFFAOYSA-N 391.471 5.042 30 20 GKED CSc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66954148 SAJPBCURWRCYQM-CABCVRRESA-N 385.558 5.685 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccccc1Cl)c1ccccc1)c1ccccn1 106353713 SCJBUELPVNOQNR-KKSFZXQISA-N 378.884 5.445 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccccc2)CC1 108530880 OLIDSRISUULGQN-KRWDZBQOSA-N 379.529 5.350 30 20 GKED CC[C@H](C)n1ncc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C1CC1 124948245 GCAQVPCOPLVAIA-CABCVRRESA-N 382.533 5.236 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(C[S@](=O)C3CCCCC3)c2)cc1 133308045 FFDZHSRDCYDLOJ-KWMCUTETSA-N 396.556 5.171 30 20 GKED Cc1nnc(-c2cccc(NCc3cccc(OCc4ccccc4C#N)c3)c2)o1 150997378 TZSUAOLIFQUOPF-UHFFFAOYSA-N 396.450 5.108 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2cccnc2-c2ccccc2)o1 152620683 FFAQLGPDOBLXER-UHFFFAOYSA-N 395.418 5.045 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)c3cccc(SCC#N)c3)CC2)n1 177280900 VPAVSLBUEPNTPI-UHFFFAOYSA-N 399.585 5.076 30 20 GKED C=CCC[C@@H](NCc1nnc(-c2ccccc2Br)o1)c1ccccc1 180049671 WIVMUDCOXQQSCP-GOSISDBHSA-N 398.304 5.296 30 20 GKED COc1ccc(CNc2ccccc2O[C@@H](C)C#N)cc1OCc1ccccc1 181133048 AJIXJDPAZVRWLH-SFHVURJKSA-N 388.467 5.177 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@@H](CC3CCCCC3)c3ccccc3)o2)cc1 181826032 SBKVGBVVGPOXCW-QFIPXVFZSA-N 386.499 5.410 30 20 GKED CCN(C(=O)Nc1ccccc1O[C@@H](C)C#N)[C@H](C)c1cc2ccccc2o1 184359183 APFPNZCFVHYOOO-JKSUJKDBSA-N 377.444 5.339 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccc(CN(C)C)cc1 191419022 NWDGAECWOJZKDS-UHFFFAOYSA-N 393.575 5.654 30 20 GKED Cc1cncc(/C=C\C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 255581498 IEUNKXHMCANSEK-WLHRWRHDSA-N 379.872 5.057 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CC[C@H]3CCCC[C@H]3C2)C1 328748987 BKXNIGDDZVDRCM-RCLSDMTESA-N 397.563 5.628 30 20 GKED CC(C)[C@H](C/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1cccnc1 329411124 BRMUUGXGSDTXGR-UGKGYDQZSA-N 394.563 5.285 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cccc(Sc3ccc(Cl)cc3)c2)CC1 331843596 UVFWAXBGZQJLIO-UHFFFAOYSA-N 385.920 5.649 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(CN2CCCCC2)c1 413397007 DWIYRHVYRGPHPD-SFHVURJKSA-N 393.556 5.177 30 20 GKED N#CC1(CCCOc2ccc(Cl)cc2C(=O)c2ccccc2)CCOCC1 419123334 VRRNWYOZPSNGOG-UHFFFAOYSA-N 383.875 5.050 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)ccc1SCC(F)F 425654977 PPJABCJTFPFQPH-LBPRGKRZSA-N 393.434 5.279 30 20 GKED CCc1occc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 430520660 PGZUBGKWCFGKHC-CYBMUJFWSA-N 391.279 5.762 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c2ccccc2n1 430617795 PCQVOZMGUBCLTP-MRXNPFEDSA-N 377.513 5.602 30 20 GKED CO[C@@H]1CCC[C@@H](C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 432713055 GZDRRXBIYPWYIK-POAQFYNOSA-N 382.891 5.139 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1ccccc1CSc1nc2ccccc2o1 432835732 JHPJXZYELZVFRP-UHFFFAOYSA-N 399.475 5.553 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C[C@H]1c1ccccc1 434082229 IWHIKUBXUZKXPW-QFIPXVFZSA-N 397.478 5.011 30 20 GKED Cc1nc(C(C)(C)C)sc1[C@@H](C)NC1CCC(Oc2ncccc2C#N)CC1 437098830 SFZHGROPUIFHTB-RWBZWWBESA-N 398.576 5.057 30 20 GKED N#Cc1ccc(NC(=O)c2ccc3noc(-c4ccc(F)cc4)c3c2)c(Cl)c1 437120362 XQCYSOBDUJHPLS-UHFFFAOYSA-N 391.789 5.411 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2occc2-c2ccccc2)cc1F 437459867 OXNTXZXHZDZVDO-UHFFFAOYSA-N 398.393 6.002 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](Sc1ccccc1C#N)c1ccccc1 439711561 UOPINADHOFKHCX-QFIPXVFZSA-N 388.492 5.429 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)c2)cs1 442616157 CIKBEUVTAZVGOO-OAHLLOKOSA-N 387.386 5.022 30 20 GKED CC[C@@H](N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1 447546243 UIFGLAKCCBZBBN-QPPBQGQZSA-N 380.495 5.275 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccn(-c2ccc(Cl)cc2)n1 467258009 WQNJERVVTIPMLU-HNNXBMFYSA-N 382.920 5.390 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ncccn2)cc1C 471252104 WSSYMKGIROGULF-UHFFFAOYSA-N 388.471 5.188 30 20 GKED COc1ccc(Br)cc1CNc1ccccc1S[C@H](C)CC#N 474434888 RBNJTIFQDYLUAF-CYBMUJFWSA-N 391.334 5.464 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)C[C@@H](CC#N)c1ccccc1 475111571 OTCFJCPUIRMLRP-OXQOHEQNSA-N 389.524 5.383 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)[C@H](C)Oc2ccccc2C#N)o1 477895484 MUNGSCNOFCPAMF-AWEZNQCLSA-N 380.831 5.186 30 20 GKED CC[C@H](C)n1nc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C 480922378 TXZSSDXXMYUMHL-YOEHRIQHSA-N 378.501 5.085 30 20 GKED C[C@@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(C#N)c(Cl)c1 482381202 NIZMNZWAYXZBPR-CQSZACIVSA-N 391.858 5.008 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cccc(C(=O)N(CCC)CCC)c2)c1 484262695 BNGRWVIFRBIHCX-UHFFFAOYSA-N 394.515 5.156 30 20 GKED CC(C)(C#N)CC(=O)Nc1c(Oc2ccc(Cl)cc2)ccc2ncccc12 486453947 HULYZDBGMINUDO-UHFFFAOYSA-N 379.847 5.559 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)nc1 493414830 YZHKEMHUJRWINH-UHFFFAOYSA-N 395.871 5.130 30 20 GKED C=CCN(Cc1ccccc1)C(=O)CCc1nc(-c2ccc(C(C)C)cc2)no1 497811130 FXMRQCBRTQCBRU-UHFFFAOYSA-N 389.499 5.007 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1)[C@H](C)c1ccc(C#N)cc1 499369183 AYPBTIRKXDWKPS-JSNMRZPZSA-N 397.316 5.034 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 503246622 PSQFOLLDDCORSF-UHFFFAOYSA-N 394.434 5.174 30 20 GKED CSc1cc(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)c(Cl)cc1Cl 505824550 FSDALUHJCKARIK-CQSZACIVSA-N 385.703 5.363 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 507918971 PROGPGPMSUFCOS-UHFFFAOYSA-N 386.451 5.528 30 20 GKED CCCc1ccc(C(=O)CCC(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc1 509621211 XDRAIOZTRVJHKX-SFHVURJKSA-N 376.500 5.083 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1cccc(C#N)c1 510534029 PTCQLODTUPYVQW-CYBMUJFWSA-N 386.282 5.713 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cccc(C(F)F)c1 511537822 AQDOSZLJVPBWLH-UHFFFAOYSA-N 394.396 5.790 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1nc2ccccc2o1 512952145 BTCADKWEURGELJ-OAHLLOKOSA-N 389.798 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCOc1ccc(F)c(Cl)c1 518738980 IUYXHHNBQYABON-ZDUSSCGKSA-N 392.883 5.281 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3ccsc3)cc2)cc1 520595283 RSTUHNDEXLCINB-OAQYLSRUSA-N 389.480 5.781 30 20 GKED C[C@H](NC(=O)N1CCC(c2cccc3ccccc23)CC1)c1ccc(C#N)cc1 521205470 AYMYAUABUDGLSX-SFHVURJKSA-N 383.495 5.362 30 20 GKED C[C@@H](SCC(=O)Nc1ccccc1Oc1ccccc1)c1ccc(C#N)cc1 522841550 FNLNPYIWIYUVPR-QGZVFWFLSA-N 388.492 5.783 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NCCc2cccs2)c1 523881721 OZIAKDKPRBIJAX-UHFFFAOYSA-N 382.872 5.038 30 20 GKED Cc1cc([C@H](NC(=O)c2cccc(CC#N)c2)c2ccccc2Cl)ccc1F 525076326 GKZFNBIXGWODCH-QFIPXVFZSA-N 392.861 5.373 30 20 GKED C=C(C)[C@H](CC(=O)N(CC)[C@H](c1ccc(Cl)cc1)c1ccccn1)OCC 533712158 FVUQNXKYCIQMNX-RBBKRZOGSA-N 386.923 5.044 30 20 GKED N#CCc1ccc(C(=O)Nc2cccc(Oc3ccnc4ccccc34)c2)cc1 533942062 RRJUZKLXYDDOPP-UHFFFAOYSA-N 379.419 5.345 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)c1cccc(C(=O)c2ccccc2)c1 534869618 SEOVKEDUFDMPDO-SFHVURJKSA-N 389.520 5.297 30 20 GKED C=CCC(C)(C)c1noc(-c2c(-c3c(Cl)cccc3Cl)noc2C)n1 551110109 RHKWYTAIHMIOFF-UHFFFAOYSA-N 378.259 5.861 30 20 GKED N#CC1(c2ccccn2)CCN(C(=O)Nc2ccc3oc4ccccc4c3c2)CC1 554569775 VIBNPCXBTKFYGR-UHFFFAOYSA-N 396.450 5.070 30 20 GKED CN(Cc1ccccc1)C1CCC(Nc2cccc(OCCCC#N)c2)CC1 556886261 RWKMRTKZPDLHOL-UHFFFAOYSA-N 377.532 5.224 30 20 GKED COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H]2CCc3ccc(C#N)cc32)cc1 562095870 LYJXTKDRRPLYIJ-JWQCQUIFSA-N 386.470 5.267 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc3nc(-c4ccc(F)cc4)oc3c2)CC1 566189089 JDXGWWPRVPNDRA-UHFFFAOYSA-N 392.434 5.182 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCCCOc1cccc(C#N)c1 576380679 LJDZALIHPLWGAI-GOSISDBHSA-N 396.556 5.519 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2cncc(C(F)(F)F)c2)n1 577145180 RWPRMRHLGPHZEP-GFCCVEGCSA-N 391.246 5.228 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 585720096 ISKFVKSIPRNILK-NRFANRHFSA-N 395.553 5.136 30 20 GKED Cc1nc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(Cl)cc1C#N 589685012 OSJRFICFONTTQQ-NXEZZACHSA-N 385.739 5.237 30 20 GKED N#C[C@@H](NC(=O)C1CC(c2ccc(F)cc2)C1)c1ccc(Cl)c(Cl)c1 590235585 KQUNXHPUZOCBBF-WTNGLUPJSA-N 377.246 5.007 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H](c1ccc(O)cc1)C1CC1 597180921 WUYYVRVFAPSIIW-HNAYVOBHSA-N 380.513 5.166 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N(c1ccc(C#N)cc1)C1CCC1 598885571 NACPRNGSLIJTKH-UHFFFAOYSA-N 379.510 5.251 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1[C@H]2c3cccc(Cl)c3C[C@H]21 599409100 GSUMEPSHWHDQHH-HHLQROKJSA-N 382.916 5.259 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(Cl)c1Cl 603600886 JOSGQIZCLJAAHG-UHFFFAOYSA-N 398.249 5.613 30 20 GKED CCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1cccc2ccccc12 603959634 KUQQIXJFXGVASX-UHFFFAOYSA-N 396.446 5.550 30 20 GKED C=CCCCCCN(C)C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 606814157 HMFHMPYMDJLPJF-UHFFFAOYSA-N 376.953 5.135 30 20 GKED CC[C@@H](C)c1ccc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 609384570 QCFSAMFTUSENJJ-SJORKVTESA-N 382.529 5.612 30 20 GKED CN(CCc1ccccc1)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609723653 QKBBYBGZIAHPFX-UHFFFAOYSA-N 390.870 5.319 30 20 GKED C[C@H]1c2ccc(F)cc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 610019308 LWKLLRJLCSDVNE-CABCVRRESA-N 383.492 5.229 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnc2ccsc2c1 610225555 KATCMWVMOPFYQY-UHFFFAOYSA-N 385.448 5.521 30 20 GKED CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610432010 SOYJHWAKEVELAX-LAUBAEHRSA-N 379.504 5.105 30 20 GKED CC(C)(CNC(=O)c1ccccc1Sc1ccccc1C#N)[C@@H]1CCCCO1 610718705 YWSVOPFOXQFWQA-NRFANRHFSA-N 394.540 5.035 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N1CCC[C@@](C)(C#N)C1 612305096 RGZSOERVFJENTO-QFIPXVFZSA-N 397.450 5.093 30 20 GKED CC(C)COc1cccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 613403981 YCMAUMRTSADLPJ-MRXNPFEDSA-N 384.888 5.475 30 20 GKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(SCC(F)(F)F)cc1 619755855 WKKOTEDTSJTNGM-LBPRGKRZSA-N 384.854 5.717 30 20 GKED N#C[C@H](C(=O)c1ccc(OC(F)(F)F)cc1)c1nc(-c2ccccc2)cs1 642281544 ILPNSQHMPQWURN-OAHLLOKOSA-N 388.370 5.199 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccccc2OC)n1 661116268 ICXZFHNMBOOSMH-HKUYNNGSSA-N 399.560 5.061 30 20 GKED N#C[C@@H](C(=O)c1cc(F)c(C(F)(F)F)c(F)c1)c1nc2ccccc2s1 683221503 PJRBCZMKVDOWRR-VIFPVBQESA-N 382.313 5.083 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(OCc3ccccc3F)cc2)c1 726487627 NXLZGSSAEPKOSC-UHFFFAOYSA-N 376.456 5.195 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(N3CCCCC3)c(F)c2)c1 726741284 DKADWDOTMITLMW-XFXZXTDPSA-N 392.474 5.395 30 20 GKED Cc1ccccc1N1C(=O)/C(=C/c2cccc(OCCCC#N)c2)SC1=S 726802195 WIILSOSJJKIHIT-RGEXLXHISA-N 394.521 5.083 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1 726940778 RQEXSJYGUKVLCH-UHFFFAOYSA-N 398.466 5.200 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN(C)Cc2ccc(C)s2)c1=S 728048428 RIJPUVHLNSYZEK-UHFFFAOYSA-N 384.574 5.035 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)C(C)C)c1 728824972 XHLRBVVJZIZTBV-UHFFFAOYSA-N 397.478 5.367 30 20 GKED Cc1c(Cl)c(COC(=O)c2cc3ccccc3n2CC#N)nc2ccccc12 729767639 PVVGWKSHBMRJAT-UHFFFAOYSA-N 389.842 5.032 30 20 GKED CC/C=C(\C)C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 729886262 DEDTUERHEYLZSG-MDWZMJQESA-N 378.522 5.963 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1F 731411378 XLFKJDIAZSBBKX-GWCFXTLKSA-N 392.377 5.434 30 20 GKED COc1cc(C(=O)/C=C/c2cnc(-c3ccc(C)cc3)s2)cc(OC)c1OC 734303607 WCRCVUSWEAHCME-MDZDMXLPSA-N 395.480 5.040 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)C1CCCC1)c1ccncc1 734667512 GUFHYYQKLOLDGG-RTWAWAEBSA-N 383.923 5.583 30 20 GKED CCOCc1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)ccc1OC 734980964 NIKHAKOSHWPQOB-WMZJFQQLSA-N 378.440 5.443 30 20 GKED C[C@H](N[C@H](C)c1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 743490545 HUOPQLXSQBYABQ-MSOLQXFVSA-N 385.467 5.028 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 744037829 FFHGRSQBKWYFJQ-QGZVFWFLSA-N 396.441 5.158 30 20 GKED N#C[C@@H](COC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)Cc1ccccc1 750783621 IMXQHCSZNLIOQK-KRWDZBQOSA-N 392.842 5.067 30 20 GKED C=C[C@@H](CC(=O)OCc1csc(-c2ccccc2OC)n1)c1ccccc1 758906901 FNRVWRDAWAITBK-INIZCTEOSA-N 379.481 5.222 30 20 GKED COc1cccc(C(=O)/C(=C\c2csc(Cl)c2Cl)c2ncc[nH]2)c1 761475816 GFMQJQZUYAPEFN-MDWZMJQESA-N 379.268 5.210 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C/c2csc(Cl)c2Cl)cc1 761479167 XFXMZJDYXQOOKI-QPJJXVBHSA-N 393.295 5.264 30 20 GKED CN(CCC#N)c1ccc(CNCc2ccc(Oc3ccc(F)cc3)cc2)cc1 761645403 DBVWWDWDUZMEOE-UHFFFAOYSA-N 389.474 5.258 30 20 GKED CCSc1ccc([C@H](C)NCc2ccc(OC)c(O[C@H](C#N)CC)c2)cc1 772984959 HIJLFKCBMZTULB-LPHOPBHVSA-N 384.545 5.339 30 20 GKED C#CC[C@H](N[C@H](C)c1ccc(OC[C@H]2CCCCO2)c(F)c1)c1ccccc1 773103549 AQPIPTIMZDKIOF-AAIMPIBUSA-N 381.491 5.189 30 20 GKED N#Cc1cc(N[C@@H]2CCCCc3ccc(Cl)cc32)ccc1N1CCC(O)CC1 777118146 RZJLZYZQTVDISQ-JOCHJYFZSA-N 395.934 5.052 30 20 GKED C=CC[C@@H](C(=O)O[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 778427483 FSLIVWBLQZTMLB-YLJYHZDGSA-N 376.456 5.318 30 20 GKED O=C(/C=C\c1cnn(Cc2ccc(F)cc2)c1)c1ccc(-c2ccncc2)cc1 780186229 FKSSCPJHSLFHJJ-KMKOMSMNSA-N 383.426 5.029 30 20 GKED CC(C)n1cc2c(n1)[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)CCC2 780422106 GZEIVTVDEHQVSL-CRAIPNDOSA-N 397.548 5.057 30 20 GKED C=CCn1c(SCc2cc3ccccc3c(Cl)n2)nnc1-c1ccncc1 787488667 UDXYZOBFOVFFMO-UHFFFAOYSA-N 393.903 5.020 30 20 GKED N#C[C@H](c1ccc(Cl)cc1)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 787718701 SQPQHXGLACDWFK-WOJBJXKFSA-N 375.299 5.004 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ncc(C(F)(F)F)s1 788355775 PKJIHSRHIPLKDY-FPLPWBNLSA-N 380.416 5.490 30 20 GKED CCOc1c(Cl)cc(/C=C/C(=O)c2ccc(C#N)cc2Cl)cc1OC 788360741 MFZWHPBVWCNTJC-FNORWQNLSA-N 376.239 5.168 30 20 GKED Cc1cc(C)c(N2CC[C@H](Nc3ccccc3SC[C@@H](C)C#N)C2=O)c(C)c1 788689859 DYELORKDZQEZIQ-JXFKEZNVSA-N 393.556 5.081 30 20 GKED C=CCC1(C(=O)O[C@@H](C)c2nnc(-c3ccc(Cl)cc3Cl)o2)CCC1 791557258 AKKWVKTZPWRRRH-NSHDSACASA-N 381.259 5.394 30 20 GKED Cc1nc(COC(=O)C[C@H](CC#N)c2ccccc2)oc1-c1ccc(Cl)cc1 795988678 BRTNGDKIYRCSOI-SFHVURJKSA-N 394.858 5.434 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(N3CCCCCC3)cc2)C2CC2)cc1 801772309 CFXBANQSKFJYFL-UHFFFAOYSA-N 388.515 5.135 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)cc1 801875758 UYLQNLQOOORIKX-SFHVURJKSA-N 394.368 5.062 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)s1 810555011 AGJWQUNLBBLLRS-CYBMUJFWSA-N 388.464 5.267 30 20 GKED CC1CCN(CCC[C@@H](NCc2ccc(C#N)cc2)c2ccc(F)cc2)CC1 812718383 QQCVOARJQWILQI-XMMPIXPASA-N 379.523 5.040 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942913 RKVWMANHPIGNAD-QMTHXVAHSA-N 379.312 5.382 30 20 GKED N#C[C@H](C(=O)CCCc1cccc(C(F)(F)F)c1)c1nc(C2CC2)cs1 842944680 MMAKIDFFRGRYGJ-OAHLLOKOSA-N 378.419 5.238 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCC1C[C@@H]2[C@@H](C1)C2(F)F 902590947 UEHHYFBYSHNGMC-BPLDGKMQSA-N 396.528 5.044 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSc2nc3ccccc3o2)cc1 915086057 RBRHUNJVIYWHKC-LJQANCHMSA-N 399.475 5.214 30 20 GKED COc1ccc(CN(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915353548 VCYYSSKFWSYREV-HSZRJFAPSA-N 385.467 5.015 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)cc1 916948201 DWHAZBZNCHVDQD-UGSOOPFHSA-N 394.858 5.561 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4ccc(Cl)cc4)CC3)n2)cc1 916972747 QHSGYWKKIRAYJW-GOSISDBHSA-N 392.911 5.680 30 20 GKED N#CCOc1ccccc1C(=O)N(Cc1ccc(Cl)cc1)c1ccccc1 920006063 FPHYPOLBDZFVSQ-UHFFFAOYSA-N 376.843 5.089 30 20 GKED C[C@@H]1CCC[C@H](CCN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)C1 1307546019 KUOSDWLWGGENTR-QZTJIDSGSA-N 388.515 5.363 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NOCCC1CC1 1776068746 WOFGBAOSBWQWIZ-UHFFFAOYSA-N 381.472 5.089 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(Cl)cc2ccoc12 1776354685 RUQOMKGKQCVUGK-HYXAFXHYSA-N 384.815 5.468 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Cl)ccc1OC(F)F 1776783061 UBGIYCAQFPQGNH-OAHLLOKOSA-N 377.859 5.235 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(F)ccc(C)c1Br 1776784112 QWJSWUBDIPSLEF-CQSZACIVSA-N 388.321 5.190 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2ccccc2C)c1 1776787906 DTGMYEQKMIBZTQ-HSZRJFAPSA-N 383.532 5.650 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)c2cc(F)ccc2F)c1 1776788194 WVWIWGRXGAUTEH-OAQYLSRUSA-N 391.458 5.230 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C\c1cccc(Oc3ccccc3)c1)C2=O 1777683155 XUSUOUDEQOQGEO-XMHGGMMESA-N 384.431 5.780 30 20 GKED N#Cc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 41514618 UFXZDFQRVURXCF-SFHVURJKSA-N 391.883 5.144 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2)n1)c1nc2ccccc2n1C(F)F 41558070 YJMFPTZTORKACX-ZDUSSCGKSA-N 394.406 5.045 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66954302 HALWDPXUVHEDOG-HOTGVXAUSA-N 383.517 5.362 30 20 GKED Cc1sc(NC(=O)CCOc2ccccc2-c2ccccc2)c(C#N)c1C 106034602 KCIGJFHXMGKBIR-UHFFFAOYSA-N 376.481 5.311 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 114003497 ZLCZEZMBHVOVCW-UHFFFAOYSA-N 386.455 5.188 30 20 GKED COc1ccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c(C)nc2c1 122375003 QDTVVAYCAPZTJR-LJQANCHMSA-N 399.475 5.165 30 20 GKED N#Cc1ccsc1NC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 133218247 CKBBBUHNTXTNSV-UHFFFAOYSA-N 379.388 5.014 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1nnc(-c2cccc(Cl)c2)o1 133836277 XTZKTLRUVNOQRK-CYBMUJFWSA-N 384.892 5.254 30 20 GKED C[C@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1ccc(-c2cccnc2)cc1 151279448 KBGSTXXREYRURN-FDDCHVKYSA-N 384.483 5.154 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cc(NC(=O)C(C)C)ccc2Cl)c1 153964699 PTNUTXOQLGUXCC-UHFFFAOYSA-N 386.879 5.142 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NCc1ccc(O[C@@H](C)C#N)cc1 160418588 LIFXETQESNYSKE-INIZCTEOSA-N 381.476 5.245 30 20 GKED C[C@@H](CCC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 160576534 XEHSGHVBVUGMCT-JXFKEZNVSA-N 385.492 5.442 30 20 GKED Cc1nc(COc2cccc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)c2)cs1 177743161 BJSYLONGGLNRQP-KRWDZBQOSA-N 397.525 5.101 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc3cc(C)c(C)cc3o2)ccc1OC 180815068 REVJQUVWFAJNSO-FXAWDEMLSA-N 392.499 5.590 30 20 GKED Cc1cccc(Cl)c1NC(=O)CSc1ccc(C#N)c(C(F)(F)F)c1 181065971 JTOHPWWMEZZHRG-UHFFFAOYSA-N 384.810 5.270 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1C(F)(F)F)N[C@@H](CCC#N)c1ccccc1 181572943 RICCHVZFAUWVPF-YJBOKZPZSA-N 389.421 5.057 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 183003078 OTOMHALKTZBPLD-CYBMUJFWSA-N 375.856 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(Cc2ccccc2)CC1 191499826 PJLVXLDFTZTOAW-UHFFFAOYSA-N 391.559 5.325 30 20 GKED CCCc1ccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)c2cccs2)cc1 236965082 AVCADWHFUVNHPH-HOYKHHGWSA-N 390.552 5.871 30 20 GKED C[C@@H](OCCCNC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1 248290138 KQEWBLPZTCCECT-LJQANCHMSA-N 384.479 5.123 30 20 GKED N#Cc1ccc([C@H](S[C@H](c2ccccc2)c2ccc(Cl)cc2)C(N)=O)cc1 261440569 BOQIMYXORDIDDX-RTWAWAEBSA-N 392.911 5.261 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3scnc3C(F)(F)F)c2C#N)CC[C@H]1C 297760864 IXPMYKWEDWGYOU-SFYZADRCSA-N 385.436 5.033 30 20 GKED CCN(C(=O)c1cc(-c2cccc(Cl)c2)no1)[C@@H](C)c1ccc(C#N)cc1 302971814 BIABELLCDJCUCI-AWEZNQCLSA-N 379.847 5.090 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Cl)c(Br)c2)c1 322878417 TYZCCKVWOWDABY-UHFFFAOYSA-N 393.668 5.037 30 20 GKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 329703441 ISQAOCLSGGPKBI-YFVAEKQCSA-N 396.535 5.143 30 20 GKED CC(O)=Nc1cc(/C(O)=N/C2CCC3(CCOCC3)CC2)cc(C(F)(F)F)c1 329921675 SSQMMMZGNWHGHK-UHFFFAOYSA-N 398.425 5.357 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccnc1SCc1c(C)noc1C 410353619 SRTLLTNQQGYVTL-UHFFFAOYSA-N 393.512 5.350 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2oc3ccccc3c2COc2ccccc2Cl)C1 424975719 IHZNTDIIDOYWSO-LSDHHAIUSA-N 394.858 5.087 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1coc(-c2cccs2)n1 425529926 DBWAPXPQALVJAG-CYBMUJFWSA-N 391.418 5.336 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1 429024169 GPZKSFBRPQGWSA-UHFFFAOYSA-N 399.441 5.036 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)ccc1OC1CCCC1 430641236 IJSSUOMUWFFYRF-INIZCTEOSA-N 398.528 5.261 30 20 GKED CCC(CC)n1nccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 431169054 KVIDMSYLIRHUDF-QGZVFWFLSA-N 378.501 5.166 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1N1CCCCC1)c1ccccc1 432746801 KGEWJNRCZJSZAQ-FQEVSTJZSA-N 376.504 5.234 30 20 GKED Cc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1OCC(F)F 432850945 MCSMMMBMUUXRSW-GOSISDBHSA-N 387.430 5.196 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)COCc1ccccc1 443527970 CSEWOZJBZXMINX-QGZVFWFLSA-N 382.529 5.120 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc3ccccc3s2)cc1-c1ccc(F)cc1 447238446 NQMXDXARDBFKSN-INIZCTEOSA-N 392.480 5.962 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)c(Cl)c1 452642794 IMIXKZMURJPVLP-UONOGXRCSA-N 378.781 5.167 30 20 GKED N#CCCCC(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 461795488 KDLWSIDZQVIHKR-UHFFFAOYSA-N 375.291 5.233 30 20 GKED N#Cc1cccc(Cl)c1NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 462813977 CHMMVEUCXUZPNN-UHFFFAOYSA-N 398.897 5.736 30 20 GKED C[C@@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCCC(C)(C)C#N)nnc1-c1ccco1 463035116 HAOZXWXIKFRKQA-LUKYLMHMSA-N 384.549 5.567 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 470414653 LKTBRVZXUSISLX-DLBZAZTESA-N 384.545 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(-c2ncccc2F)n1 476123055 NIWAGKDABFWZCV-UHFFFAOYSA-N 381.476 5.448 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccccc2Cl)cc1C 476123334 OYHVGYOIVCJBBV-UHFFFAOYSA-N 393.918 5.938 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C2CCC2)cc1Cl 480118668 CCUJLANCDDQNNB-UNMCSNQZSA-N 393.918 5.792 30 20 GKED N#Cc1ccccc1COc1ccc(-c2nc([C@H]3CCC(F)(F)C3)no2)cc1 482625801 XMNOGNFVSVDHIV-HNNXBMFYSA-N 381.382 5.090 30 20 GKED N#C[C@H](C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1nccc2ccccc12 483203069 QSAYHRQTCMONQG-NRFANRHFSA-N 388.430 5.064 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CSc1ccc(C#N)cc1 483415878 PKRRLDHAAOEHLQ-UHFFFAOYSA-N 399.475 5.261 30 20 GKED Cn1cc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c2cc(F)ccc21 483486093 AUVGYVWGYMCOOP-CYBMUJFWSA-N 383.835 5.071 30 20 GKED Cc1c([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccccc12 484155476 FFMXFXWLGXFWFZ-ZBFHGGJFSA-N 393.512 5.876 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(Br)c1 485993002 ITFAHPMUJIEMCU-LBPRGKRZSA-N 390.306 5.487 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc2ccccc2n1 486233320 WDUQQQAVYBYMMT-MRXNPFEDSA-N 375.497 5.200 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N1CCc2[nH]c3ccc(Cl)cc3c2C1 488275058 WYVUCFUWEZYLTH-UHFFFAOYSA-N 394.812 5.082 30 20 GKED N#C[C@@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(Cl)cc1 499838670 YZOKDJKWYUHSNQ-CYBMUJFWSA-N 395.698 5.856 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1nc2ccccc2s1 505029670 PEXHKRGUMXOXTI-LJQANCHMSA-N 377.513 5.784 30 20 GKED N#C[C@@H](NC(=O)c1cccc(C(F)(F)F)c1F)c1cccc(Cl)c1Cl 505342228 GKBQDVRATCCFRP-GFCCVEGCSA-N 391.151 5.146 30 20 GKED CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)CC(C)(C)CCC#N 506051525 PICRZXDCJIINHW-UHFFFAOYSA-N 378.545 5.363 30 20 GKED CC[C@H]1C[C@@H](CC(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)CCO1 514108845 GJFWCKSEQYTSTP-AVRDEDQJSA-N 394.490 5.134 30 20 GKED N#C[C@@H](C(=O)c1ccc(-n2cccc2)cc1)c1nc2cc(Cl)ccc2s1 515539583 ZSYYYSBRHFKHKR-INIZCTEOSA-N 377.856 5.230 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1C[C@@H]1C[C@H]2CC[C@H]1C2 517473472 OAFUPALVWLTXQE-DEPCRRQNSA-N 397.588 5.761 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 521327063 OSYJGRPRLQCMBC-TYCQWZJGSA-N 386.520 5.976 30 20 GKED N#Cc1ccsc1C(=O)N1CCC(CCc2cccc(C(F)(F)F)c2)CC1 522111631 LNZPADFWADVOKF-UHFFFAOYSA-N 392.446 5.124 30 20 GKED CCN(C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 523113499 WVZBHFSUAWPNHQ-JKSUJKDBSA-N 388.433 5.365 30 20 GKED C=CCn1c(SCc2csc(-c3ccccc3F)n2)nnc1-c1ccco1 524455811 BZDOXPQHLRRNRJ-UHFFFAOYSA-N 398.488 5.279 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccccc12 530725784 ZRFORXNSJPLIGS-XUZZJYLKSA-N 381.479 5.024 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1Cc1csc(-c2ccc(F)cc2)n1 530970914 UEAIPAXPBPIAQW-NHCUHLMSSA-N 377.488 5.221 30 20 GKED N#Cc1cc(C(=O)Nc2cccc(CSc3ccccn3)c2)ccc1Cl 537583183 IIRLJGLMMKEPOO-UHFFFAOYSA-N 379.872 5.151 30 20 GKED C[C@H](N[C@@H](COc1ccccc1F)c1ccccc1)c1ccc(C#N)c(F)c1 540707514 GRRPQVAZOWLGME-AOMKIAJQSA-N 378.422 5.307 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2CCO[C@@H](c3ccc(F)cc3)C2)CC1 543618755 VUNHFOHAVOYKJU-JULQRDMDSA-N 378.491 5.040 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 543820666 CZRAMMUHHDEJNF-HTAPYJJXSA-N 395.572 5.686 30 20 GKED C=CCOc1ccccc1CN[C@@H](Cc1cccnc1)c1ccc(Cl)cc1 546166695 PYQKUZBJHKWCGY-QFIPXVFZSA-N 378.903 5.373 30 20 GKED C=C(C)Cn1c(-c2cc(C)oc2C)nnc1N1CCC(OC2CCCCC2)CC1 549254147 RXXNNUJWLWVRBU-UHFFFAOYSA-N 398.551 5.049 30 20 GKED CN(C(=O)c1cc(C#N)ccc1Cl)c1ccc(OCc2ccccc2)cc1 552492572 QJPXSQYISXBHBH-UHFFFAOYSA-N 376.843 5.067 30 20 GKED CC(C)c1c(NC(=O)c2cc(C#N)ccc2Cl)cnn1-c1ccc(Cl)cc1 560654886 HJQZYQWONPDLJQ-UHFFFAOYSA-N 399.281 5.426 30 20 GKED C[C@@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCC(CCC#N)CC1 567790056 MKQSSBCKRIHJDB-ZDUSSCGKSA-N 378.303 5.725 30 20 GKED COc1cccc(CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)c1F 578168003 ANIQQGVZQZCPFE-UHFFFAOYSA-N 380.444 5.006 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1ccc(Br)cc1C(F)(F)F)CC2 580803543 LTSRFFILAKDHGR-KRWDZBQOSA-N 395.222 5.117 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)[C@H]1CCN(c2ccc(C#N)cc2F)C1 583268866 DFFBTFFUHQAGHL-IBGZPJMESA-N 393.506 5.238 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2ccc(F)c(F)c2)CC1)c1ccccc1 590942125 SDBVDJWJWGTWSG-JOCHJYFZSA-N 397.469 5.289 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1oc2ccc(OC)cc2c1C 592537346 LICSDFNTTXDYLM-MRXNPFEDSA-N 396.462 5.348 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C(F)(F)F)o1 594072587 UNHLWKFFXDBUCF-LRDDRELGSA-N 397.422 5.407 30 20 GKED Cc1nc(NC(=O)c2cc3c(Cl)cccc3s2)sc1SCC#N 603775574 SXYJXKGFXVLVSY-UHFFFAOYSA-N 379.919 5.188 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)C1 604561903 XVKGDVIVLVXFJM-IBGZPJMESA-N 398.466 5.075 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccccc2OC(F)(F)F)C2CCCC2)cc1 609175682 UVZPONLOXKZZMF-UHFFFAOYSA-N 388.389 5.042 30 20 GKED CCCN(C[C@@H]1CCCCO1)C(=O)c1ccccc1Sc1ccccc1C#N 609304465 HFKOXSKWEKQWCT-IBGZPJMESA-N 394.540 5.131 30 20 GKED Cc1ccc(-c2nc(C(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)cs2)o1 609463686 PUGAUHGMYHIDIY-ZDUSSCGKSA-N 392.267 5.013 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)cc1C#N 610109162 WTLSDPHEWSGBKT-UHFFFAOYSA-N 391.352 5.368 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N[C@H](C)c1cccc(C#N)c1)c1ccccc1 610325062 MADWSNWXDJSYPI-MSOLQXFVSA-N 385.467 5.581 30 20 GKED CC1CCN(Cc2ccc(NCc3cccc(OCCCC#N)c3)cc2)CC1 610909728 YRLLEFFNGTUTNQ-UHFFFAOYSA-N 377.532 5.213 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCC[C@H]1C1CC1 646436630 LDOZVNJWUXAMCP-ZDUSSCGKSA-N 398.322 5.382 30 20 GKED N#C[C@@H](C(=O)c1cc2[nH]ccc2s1)c1nc2cc(C(F)(F)F)ccc2s1 684631053 JXSIMYNXTSNPNC-VIFPVBQESA-N 391.399 5.348 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 726319048 XBVAEKPCYLQLRM-LBPRGKRZSA-N 375.280 5.412 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2ccc4ncccc4c2)CC3)cc1 727780175 IRXAZWTXROVXJG-NBVRZTHBSA-N 398.487 5.579 30 20 GKED C#Cc1ccc(C(=O)N(Cc2ccc(Cl)cc2)[C@H](C)Cc2cccs2)nc1 728803592 JNPMFMIRQRABIT-MRXNPFEDSA-N 394.927 5.051 30 20 GKED Cc1cccc(Nc2nnc(SCc3ccc(OCC#N)cc3)s2)c1C 729241344 VQAHXRQNPABXPN-UHFFFAOYSA-N 382.514 5.093 30 20 GKED O=C(/C(=C\c1cnn2ccccc12)c1nc2ccccc2s1)c1ccccc1 729641665 RZFBFBRFIJEHIA-NBVRZTHBSA-N 381.460 5.368 30 20 GKED C=CC[C@H](NC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1ccncc1 734460947 SXLZFQXWDWYMAF-NRFANRHFSA-N 392.886 5.214 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@]3(C#N)CCC[C@H](C)C3)cs2)cc1 735056980 AOWRTXPAXCGMGC-KSFYIVLOSA-N 381.545 5.065 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 739160089 QQKGYZYISFIKES-HRAATJIYSA-N 399.519 5.614 30 20 GKED C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 754110283 UGUVTYGPZMESGT-ZBORUMQWSA-N 397.434 5.292 30 20 GKED Cc1c(C(=O)/C=C/c2cccc(-c3cccnc3)c2)cnn1-c1ccc(C#N)cc1 768489882 ITUIVOVAHHKKQX-FMIVXFBMSA-N 390.446 5.011 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](Oc2cccc(Cl)c2)C(C)C)n1 770141584 NNDSZGAZTDSRHB-CRAIPNDOSA-N 376.909 5.200 30 20 GKED C#CC[C@H](N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccccc1 773113835 FAEFZNGEDVEJSY-IERDGZPVSA-N 376.525 5.542 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(Cl)cc2C#N)cc1 774305244 QNORNVAYROTTRI-CQSZACIVSA-N 385.895 5.409 30 20 GKED N#Cc1ccc([C@H](O)CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 776033428 HESIJKLBLGZILF-MOPGFXCFSA-N 394.824 5.005 30 20 GKED COc1ccc(C(=O)/C=C\c2cc(Cl)cc(C(F)(F)F)c2)cc1NC(C)=O 780185926 ABJZIDZJHOWNAM-HYXAFXHYSA-N 397.780 5.222 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)Nc1ccccc1O[C@H](C)C#N 780674937 JVGRFLOAQDCYER-HXUWFJFHSA-N 399.494 5.520 30 20 GKED C[C@@H](C=Nn1c(S)nnc1CSc1ccccc1)c1cccc(Cl)c1 782244564 IMOWISLSUKCWGJ-ZDUSSCGKSA-N 388.949 5.150 30 20 GKED Cc1ccccc1C1=CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 782553617 TXGKJNXRCIMXLY-RUZDIDTESA-N 393.490 5.582 30 20 GKED C=C(C)[C@H](NCc1ccc(Cl)nc1C(F)(F)F)c1ccc(F)c(F)c1 787301432 BDTNHVBPAUEBNJ-HNNXBMFYSA-N 376.756 5.439 30 20 GKED N#C[C@@H](c1ccc(Cl)cc1)N1CCC([C@H](O)c2ccc(Cl)cc2)CC1 787718699 SQPQHXGLACDWFK-VQTJNVASSA-N 375.299 5.004 30 20 GKED Cc1ccccc1-n1nccc1CNCc1cccc(-c2ccc(C#N)s2)c1 792990388 VMZSXNHLWNYUGD-UHFFFAOYSA-N 384.508 5.071 30 20 GKED N#Cc1ccc(/C=C(\Cl)c2nc3cc(Br)ccc3o2)c(F)c1 794740189 TUGMSCNPFDJIDW-SDQBBNPISA-N 377.600 5.338 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1ncc(-c2ccc(Cl)cc2)o1 795984229 WJUKSNWIFXMMLD-CRAIPNDOSA-N 394.858 5.687 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C(F)(F)Cc3ccccc3)n2)cc1 796636116 WESFLQFJPFSLJO-QGZVFWFLSA-N 382.435 5.173 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)OCCCC1(C#N)CCOCC1 800202151 PROQPEIWWMJRJS-WYMLVPIESA-N 382.287 5.040 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)c1cc(F)c(C(F)(F)F)cc1F 804196178 DYGWMYDUGYKAOU-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C#C[C@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1ccc(F)cc1 812795171 OQCOYRXIZIDGAX-QFIPXVFZSA-N 392.861 5.196 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(CN[C@H](CCCC#N)c2ccccc2)c1 814661373 YDNMJOXMTCDSBE-OAQYLSRUSA-N 379.504 5.558 30 20 GKED N#C[C@H](C(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 819946356 MEQNDRSTGUGSNS-UUSSSYRCSA-N 393.295 5.028 30 20 GKED N#CCCC[C@H](N)c1nc(C2(c3ccc(Cl)cc3Cl)CCCCC2)no1 823279858 DOMKIWVCWMFITC-INIZCTEOSA-N 393.318 5.320 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1ccccc1 836557747 HKJSPCWJQQLVCK-OFAXGOBFSA-N 388.515 5.232 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21)c1nc2cc(Cl)ccc2s1 860479483 QJBMVJFWKIWKLK-MJSCVDMRSA-N 399.302 5.365 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc(-c2cnc(C3CC3)o2)cc1 914526880 ATJGPLHMAPWXFN-UHFFFAOYSA-N 398.422 5.035 30 20 GKED COc1cccc(-c2nc(/C=C\C(=O)c3cc4cccc(OC)c4o3)cs2)c1 916129888 BGHRHXPNYMSRKV-KTKRTIGZSA-N 391.448 5.470 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 916927215 GDQIREBEDZCIBC-OAHLLOKOSA-N 389.282 5.252 30 20 GKED COc1ccc(C(=O)/C=C\c2c(C)nn(-c3ccc(Cl)cc3)c2C)c(F)c1 917145314 QTFGYBVFMRNKRF-KHPPLWFESA-N 384.838 5.186 30 20 GKED Sc1nnc(SCc2ccccc2)n1N=Cc1cc(Cl)cc(Cl)c1 917542713 NCGSLLPKNKXMDS-UHFFFAOYSA-N 395.340 5.048 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cccc(OC(C)C)c1 918225817 UPEBAQGATJFEGH-UHFFFAOYSA-N 378.925 5.087 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 918491090 XOYVAFCWBKYKKF-UGSOOPFHSA-N 398.890 5.973 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2SCc2ccccc2)cc1 921197181 CGJUXYZDNNRILC-UHFFFAOYSA-N 376.481 5.212 30 20 GKED N#CCCCCOC(=O)c1oc2ccccc2c1CSc1ccccc1F 921215865 DGEYRIPNHAOONC-UHFFFAOYSA-N 383.444 5.715 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2C(=O)O)cc1)c1ccc2c(c1)CCCC2 1776113562 NVCOPBMIKFAMST-LFIBNONCSA-N 382.459 5.827 30 20 GKED COc1cc(Cl)ccc1C(=O)/C=C/c1c(F)ccc2sc(C(=O)O)cc12 1777316241 JEBDFZHZOLLYNE-GQCTYLIASA-N 390.819 5.297 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Cl)nc4ccccc34)c2c1 1777685510 JOCOKYLYLASUOX-FNORWQNLSA-N 393.851 5.697 30 20 GKED C=CCn1c(S[C@H](C)c2nc(C(C)C)no2)nnc1-c1ccc(Cl)cc1 27780251 HWXKKLKDKRDKGZ-GFCCVEGCSA-N 389.912 5.144 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1nc2ccccc2o1 41545174 NYOOVHORCKKGRN-NSHDSACASA-N 387.247 5.839 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 52033196 SZYCUBOIVWSRHZ-UHFFFAOYSA-N 388.370 5.683 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Nc1cccc(OCc2cccc(C#N)c2)c1 56153478 KANWZCBEOBPCRN-LJQANCHMSA-N 399.494 5.193 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 56744683 FZCVLBTUPHWPLU-HNNXBMFYSA-N 377.469 5.637 30 20 GKED Cc1ccc(OCc2nc(CN(Cc3ccc(C#N)cc3)C(C)C)cs2)cc1 58396971 JCFISYKIGJNGBE-UHFFFAOYSA-N 391.540 5.313 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)nn1-c1ccccc1 78719866 XTDYHBHDLKKIKJ-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccc(F)cc2)o1 128724862 DYKCXQKZKBQDAG-IBGZPJMESA-N 398.393 5.200 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(CCC(F)(F)F)CC1CC1 175997021 JEIQWTFOHYZJNN-CYBMUJFWSA-N 385.455 5.135 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3ccc(F)cc3C#N)cc2)cs1 177571456 YPTUYGZUVHIVHP-UHFFFAOYSA-N 383.473 5.007 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N(CCC#N)Cc3ccccn3)cc2)cc1 178055850 NOFDEAWGWOMDNP-UHFFFAOYSA-N 386.455 5.130 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@H](C)c1cccc(NC(C)=O)c1 185110200 IHAKNQZCYFTHCS-RBUKOAKNSA-N 378.516 5.337 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nnc(COc2ccc(Cl)cc2)o1 186395067 USNKIURWVXINDF-UHFFFAOYSA-N 392.267 5.119 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccncc3C(F)(F)F)cc2)c1 193082964 AGOOWUMDAFZQCB-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(F)c(-c3cccs3)c2)c1 236898581 UFGSMKXLABZENF-GOSISDBHSA-N 380.488 5.525 30 20 GKED CCCCOc1ccc(C=NO[C@@H](C)c2nnc(-c3ccccc3)o2)cc1OC 255362863 TVLHFOIPSOYNSF-INIZCTEOSA-N 395.459 5.036 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(-c2ccncc2)ccc1OC 277247333 JORUOPHEWWZQOD-NRFANRHFSA-N 384.520 5.051 30 20 GKED COc1ccc(N=C(O)N2CC[C@H]3CCC[C@@H]32)cc1N=C(O)C1CCCCC1 330245666 KVIBXWFJEKNKSF-BEFAXECRSA-N 385.508 5.283 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(Cl)cc2CC#N)c2cnn(C(C)C)c2n1 410973734 WSIHURTZNRRJEF-UHFFFAOYSA-N 395.894 5.107 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@@H]3C)s1 410982268 OXSYXSVVQBNDHB-JBLDHEPKSA-N 389.546 5.030 30 20 GKED Cc1sc(Br)c(C(=O)Nc2sc(C(C)(C)C)cc2C#N)c1C 411007822 PUOVZTWQIFUZHS-UHFFFAOYSA-N 397.363 5.610 30 20 GKED N#CCc1ccc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)c(Cl)c1 411012683 HGSZRFHPBSHICJ-UHFFFAOYSA-N 378.781 5.095 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(c3ccccc3C(F)(F)F)CC2)c1 412189396 FWEPVSBOICMQDG-VQTJNVASSA-N 398.428 5.087 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)cc2)o1 425662408 ZMBXFMPRGTUSIY-INIZCTEOSA-N 388.471 5.562 30 20 GKED N#C[C@H]1CC[C@H](Sc2nnc(Cc3ccccc3)n2-c2ccc(Cl)cc2)C1 430097201 GTFAHGJFACAWSW-LPHOPBHVSA-N 394.931 5.296 30 20 GKED N#CCC1(CNC(=O)[C@H](Sc2ccc(F)c(Cl)c2)c2ccccc2)CC1 431131443 BNDYLAUVJWPPDS-GOSISDBHSA-N 388.895 5.123 30 20 GKED C=CCn1c(SCc2ccn(C(CC)CC)n2)nnc1-c1ccccc1C 433391593 RYWZJOZYSPPFOW-UHFFFAOYSA-N 381.549 5.289 30 20 GKED CC(C)(C#N)CCCC[S@](=O)Cc1ccc(Br)c(Cl)c1 436093978 WQYDMZFHSKTMEH-FQEVSTJZSA-N 376.747 5.071 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1OC1CCCC1 437765377 QYQADDHRWSWNDO-IRLDBZIGSA-N 389.499 5.312 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1nc(C)cs1)c1ccc(C(F)(F)F)cc1 440836707 WSYCTVWFXDJGHC-BBRMVZONSA-N 397.466 5.538 30 20 GKED Cc1c(C(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)ccc(C(F)(F)F)c1F 442934651 JAPBENXTWBDHRJ-FUHWJXTLSA-N 390.380 5.065 30 20 GKED N#C[C@H]1CC[C@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1 450883752 QNBDBTLVGKLDET-GUYCJALGSA-N 384.892 5.024 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCc2cccc(Cl)c2C1 459405755 UBUNSAYKBSWFBE-CQSZACIVSA-N 385.920 5.182 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCCC(C)(C)C#N)n2)o1 463253336 DEQMLIQFWUUESW-UHFFFAOYSA-N 379.407 5.572 30 20 GKED CCN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ncccc1C 466521440 YMCHGYCWJVRIMS-UHFFFAOYSA-N 391.858 5.374 30 20 GKED C=CCC[C@H](NC(=O)Nc1c(C)noc1C1CC1)c1ccc(C(F)(F)F)cc1 466892316 YCESUMBUJUDHGO-INIZCTEOSA-N 393.409 5.708 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(CC(F)(F)F)c2)c2ccccc21 469493221 CNZCWIWXVHMKAZ-UHFFFAOYSA-N 385.389 5.302 30 20 GKED C[C@@H](Sc1nc2c(cc1C#N)CCCC2)c1nnc(-c2ccccc2F)s1 470435805 IWAYFYXQEDSDIF-GFCCVEGCSA-N 396.516 5.343 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](COCC(C)C)c1ccco1 475547697 HNZRENWZIZOZOC-FQEVSTJZSA-N 384.520 5.667 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCCOc2cc(F)ccc21 475554374 ISPXRRXLKLZVSA-FQEVSTJZSA-N 382.479 5.713 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(Cl)cc3C#N)o2)cc1 479133389 XCWJACGKUZKRPK-UHFFFAOYSA-N 383.860 5.119 30 20 GKED C[C@H](c1cc(F)ccc1F)N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482638433 SJOKYJWNQSJOSC-OAHLLOKOSA-N 392.405 5.462 30 20 GKED N#CCCC[C@@H](NC(=O)c1cnc(Cc2ccc(F)cc2)s1)c1ccccc1 487547410 ZYBGXXSLZOHDEJ-LJQANCHMSA-N 393.487 5.038 30 20 GKED CCc1c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1CCC(C)C 494753651 ZSMNKGNWSADEQM-MRXNPFEDSA-N 399.564 5.530 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C(C)(C)CCCc1ccccc1 496308594 KHRGFIWLYVLAGT-SFHVURJKSA-N 380.557 5.926 30 20 GKED Cc1c(NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cnn1CC(C)C 499557056 NPAIXAXKTUXGBT-UHFFFAOYSA-N 389.459 5.156 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc(-c2ccc(C)cc2C)nc1C 500590445 VVBUHIVOSBFFCC-UHFFFAOYSA-N 391.496 5.258 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)cc1F 505812899 QFNFECXYCOYWKL-HNNXBMFYSA-N 381.291 5.246 30 20 GKED COc1ccc2c(-c3ccccc3)c(C(=O)Nc3ccc(CC#N)cc3)oc2c1 508555309 ZOPBBFUXLXVFMU-UHFFFAOYSA-N 382.419 5.427 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(C)cc1)CCC2 509230035 NHOWEZSZOIJPLK-JZJYNLBNSA-N 395.506 5.406 30 20 GKED Cc1cc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccc1F 510522097 GNFPRYVDLPTYQA-UHFFFAOYSA-N 389.430 5.428 30 20 GKED COc1cccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)c1 510652172 OEYVTYKPLSCQLN-UHFFFAOYSA-N 389.411 5.012 30 20 GKED C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1C(=O)NCC(C)(C)CCC#N 513139956 ABNRNMPHYMZJBM-AUSIDOKSSA-N 389.543 5.105 30 20 GKED Cc1sc(NC(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)c(C)c1C 517050624 YRVYYCRKYUYQLQ-UHFFFAOYSA-N 384.448 5.295 30 20 GKED C=CCOc1ccc(CNCc2nc(-c3ccc(Cl)cc3)c(C)s2)cc1 518775937 JMYNQVARPNICNB-UHFFFAOYSA-N 384.932 5.627 30 20 GKED COc1ccccc1[C@H](NC(=O)Nc1ccc(C#N)c(Cl)c1)c1ccccc1 521742296 RJYQRURCRACLGA-OAQYLSRUSA-N 391.858 5.131 30 20 GKED Cc1nc(-c2ccc([C@H](C)NCc3cccc(OCCCC#N)c3)cc2)cs1 521807050 HQDWYEIPPRAKNV-KRWDZBQOSA-N 391.540 5.652 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)Cc1ccccc1-c1ccccc1 523578186 BKHJBOIPMPUJNW-UHFFFAOYSA-N 386.495 5.260 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCn2cc(C(F)(F)F)nc21 529134036 ACFOYDLBWLBPEJ-MRXNPFEDSA-N 391.437 5.270 30 20 GKED C[C@H](N[C@H](C)c1ccc2ccccc2n1)c1ccc(-c2cccc(C#N)c2)cc1 541175239 CNMQGTPGDCDPID-RBUKOAKNSA-N 377.491 6.185 30 20 GKED N#Cc1cccc(C2(NCc3cc(Br)cc(C(F)(F)F)c3)CC2)c1 550515259 TXEBJFJTVSGHKA-UHFFFAOYSA-N 395.222 5.118 30 20 GKED N#Cc1ccc2c(c1)[C@H](NCc1cn(-c3ccccc3)nc1-c1ccccc1)CC2 554997679 PWLHGFGGCRCNDK-RUZDIDTESA-N 390.490 5.188 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)c2ccc(F)c(C#N)c2)cc1 560077509 RVDNQQNILBNIEO-MRXNPFEDSA-N 388.442 5.206 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)Nc2cc(C#N)c3ccccc3n2)cc1 564187292 AOMAZPVIMUYVQT-UHFFFAOYSA-N 398.491 5.028 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccc([C@H]2CCOC2)cc1 564778048 YWXRNDUMJSTILC-RDJZCZTQSA-N 381.501 5.086 30 20 GKED COc1cccc([C@H](C)CCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 568353322 YAGDQTAZQZHLCZ-QZTJIDSGSA-N 396.556 6.002 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1OC(F)F 582656538 CFRCSIXTAAKCDW-RDTXWAMCSA-N 378.850 6.027 30 20 GKED C=C[C@@](C)(CCOC)c1nc(CC2(SCc3ccccc3)CCCC2)no1 584555846 ZAXBMZCALLCJSU-NRFANRHFSA-N 386.561 5.339 30 20 GKED N#CCCCCCC(=O)N[C@H](c1cc(F)ccc1F)c1ccccc1Cl 588621504 UCLYEHVLKZYQGT-FQEVSTJZSA-N 376.834 5.298 30 20 GKED CSCc1cccnc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 589450902 VATYQOSSGARKNO-HNNXBMFYSA-N 399.928 5.212 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(SC4CC4)cc3)cc2)ccn1 589470838 WYVMJLOJLRJIGG-UHFFFAOYSA-N 387.464 5.252 30 20 GKED N#CCn1c(C(=O)N(CC2CC2)c2cccc(C(F)(F)F)c2)cc2ccccc21 589807457 SEFZINXVXWZHJE-UHFFFAOYSA-N 397.400 5.240 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)oc12 592975360 CBWIECKCGFVUGK-CQSZACIVSA-N 378.428 5.597 30 20 GKED CCC1(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)CCC(F)(F)CC1 596790690 PPUUXCFBOPLPJZ-UHFFFAOYSA-N 399.441 5.598 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 597660294 KMNMSOYFXQEKGS-UHFFFAOYSA-N 398.322 5.036 30 20 GKED CCN(C(=O)Nc1cccc(C#Cc2cccs2)c1)[C@@H](C)c1cccnc1 604612333 NKMGJWXVRSEOLS-KRWDZBQOSA-N 375.497 5.158 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1F 605075029 NCMDJORXUHRJHR-GOSISDBHSA-N 388.373 5.572 30 20 GKED CCCN(C(=O)c1csc(-c2ccccc2)n1)c1cc(Cl)ccc1C#N 609286447 WZSUEANMOJWQEV-UHFFFAOYSA-N 381.888 5.392 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1Cc1ccccc1 609398417 ZXZJEYAKJUPEAA-PKOBYXMFSA-N 379.529 5.177 30 20 GKED Cc1ccc(-c2ncc(C(=O)N3CC=C(c4ccc(C#N)cc4)CC3)s2)c(C)c1 611247271 UDJSEXLBAVURQI-UHFFFAOYSA-N 399.519 5.228 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1cccc(C#N)c1 611263114 UXLCKAAYOHMGPC-SFHVURJKSA-N 387.458 5.170 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1ccc(C(F)(F)F)cc1 612145474 FMZBSDPIYRFRLS-PKOBYXMFSA-N 379.426 5.048 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cs2)o1 613407515 WRPXCSBPDDZLOZ-LLVKDONJSA-N 399.884 5.465 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)c1C 618758520 ITYSPSAOHWTXPP-JOCHJYFZSA-N 391.515 5.381 30 20 GKED C[C@H](CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C(F)(F)F 626369510 GBYBGLFZVPQSPK-HQJQHLMTSA-N 381.238 5.014 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 642282384 MMHVHHCGEDHHHZ-INIZCTEOSA-N 391.377 5.083 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)c2ccc(CC)cc2)cc1 727953930 RECKCTHAEPGVKW-VGSWGCGISA-N 376.500 5.043 30 20 GKED C[C@H](OC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cnc2ccccc2c1 728147769 ZYUPUUGMASWFGK-INIZCTEOSA-N 398.418 5.196 30 20 GKED CC(C)[C@H](CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1 728766714 HJTYOIYKUDOUAC-VXKWHMMOSA-N 384.479 5.317 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccc(Cl)cc2)cc1F)c1ccc(F)cc1 730209592 RNKFNHICMNNUGR-HXUWFJFHSA-N 382.797 5.280 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1F 731317311 CPKRFSCAKBGCMI-UHFFFAOYSA-N 377.444 5.607 30 20 GKED C#CC[C@H](OC(=O)c1sc(-c2ccc(Cl)s2)nc1C)c1ccccn1 733692229 RDMHGSJWBKVUHY-ZDUSSCGKSA-N 388.901 5.150 30 20 GKED COc1cc(/C=C2\CCOc3ccc(Cl)cc3C2=O)cc(Cl)c1OC 733749020 QEGIMVRZCXLLLH-KPKJPENVSA-N 379.239 5.059 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 739155774 VQGPBTIVIYTXFJ-HTAPYJJXSA-N 384.479 5.243 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N[C@@H](c3ccccc3)C3CC3)c2)s1 740026201 SYQKTRTWRHWIEC-QFIPXVFZSA-N 387.508 5.237 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3ccccc3SCC#N)c2)C1 745136056 QWSIAOMLTHRJIY-PXNSSMCTSA-N 394.540 5.650 30 20 GKED Cc1c(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccccc2)oc2ccccc12 747140406 RZPBUWRBSSJODH-OUKQBFOZSA-N 381.435 5.415 30 20 GKED COc1ccc(CNC(=O)N(C2CC2)[C@H](C)c2ccc3ccccc3c2)cc1C#N 747430180 IZIRUASVAGFJFG-QGZVFWFLSA-N 399.494 5.155 30 20 GKED CCCCn1nc(C)c(/C=C\C(=O)c2ccc(SC)c(OC)c2)c1Cl 747614704 MLDNEOBKDARMHB-HJWRWDBZSA-N 378.925 5.272 30 20 GKED N#C[C@H](C(=O)CSc1ccc(N)cc1Cl)c1nc(-c2ccccc2)cs1 753860027 XAWLPEMQASCUAM-CQSZACIVSA-N 399.928 5.014 30 20 GKED Clc1nc(Cl)c(C=NNc2nc(Cl)c(Cl)cc2Cl)s1 755544332 CKEPGLTYMFVBET-UHFFFAOYSA-N 376.483 5.251 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(C)cc3)c12)c1ccc(N)cc1C 758098283 CCAFRWFIPCRVAY-UHFFFAOYSA-N 387.512 5.393 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3nnc(-c4cccc(F)c4)o3)c2)cc1 760455213 LUDINWIKYJIHTF-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1ccc(Br)cc1Cl 763357026 WGADRWCUUOZQHY-UHFFFAOYSA-N 395.688 5.096 30 20 GKED C[C@H]1C(=NNc2cc(C(F)(F)F)nc(-c3ccccn3)n2)C[C@H]1c1ccccc1 767782241 NDLCUVCSYQHDGU-UKRRQHHQSA-N 397.404 5.149 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccccc2Br)cc1 779018478 LVFRYEDTVCGRBQ-NRFANRHFSA-N 377.285 5.200 30 20 GKED CSc1cc(Br)ccc1CNc1ccccc1O[C@@H](C)C#N 779988375 DTMJIIVBEZWQLC-LBPRGKRZSA-N 377.307 5.074 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC=C(c3ccccc3)C2)cc1 782552901 LQUXDAMKRHEBIN-DEOSSOPVSA-N 379.463 5.273 30 20 GKED CC[C@@](C)(C#N)C(=O)O[C@H](C)c1cnc(-c2ccc(Br)cc2)s1 797172349 RWFYSEMDVIBFBL-DIFFPNOSSA-N 393.306 5.117 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801672868 VRVCRHDUDZZKQA-ZDUSSCGKSA-N 383.238 5.513 30 20 GKED C=CC[C@@H](OC(=O)Cc1ccc([S@@](C)=O)cc1)c1ccc(Cl)c(Cl)c1 805947404 NGVLZQAQCKBHPX-IQGLISFBSA-N 397.323 5.134 30 20 GKED CC(C)(C(=O)OCc1ccc(CC#N)cc1)c1csc(-c2ccccc2F)n1 814593035 JZUURDHHYGMPRQ-UHFFFAOYSA-N 394.471 5.036 30 20 GKED C[C@@H]1C[C@H](CN[C@H](CCCC#N)c2ccccc2)CCN1C(=O)OC(C)(C)C 824434983 VLOGRZKVNWLPNP-SFHLNBCPSA-N 385.552 5.047 30 20 GKED COc1ccccc1[C@@H]1C[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 842288875 LSBSSZPMRDOMIT-OTWHNJEPSA-N 388.492 5.107 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C[C@@H](C)C1(F)F 860424542 IUGAWWFYEYELAP-GQIGUUNPSA-N 383.442 5.097 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCc1ccc(C#N)cc1 913350030 FJAYEJZAGJHHNE-UHFFFAOYSA-N 387.222 5.186 30 20 GKED O=C(O)Cc1ccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)cc1 915987887 MFUDKTAKSRQYOU-PKNBQFBNSA-N 389.432 5.080 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccnc(Cl)c2)cc1Cl 916056684 GCHLZZBWGVXKTD-QGZVFWFLSA-N 382.250 5.296 30 20 GKED N#C[C@@H](C(=O)/C(=C/c1ccc(F)cc1)c1cccs1)c1ccc2ccccc2n1 916849612 WAIKPZVUPWSWLY-IAERKFLBSA-N 398.462 5.852 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccccc2Cl)cc1 916947450 KPPZGBCKJMUBGK-HNAYVOBHSA-N 382.891 5.134 30 20 GKED Sc1nnc(-c2ccccc2Cl)n1N=Cc1cccc(OC2CCCC2)c1 917537715 AJNGDWDKUMRMOQ-UHFFFAOYSA-N 398.919 5.091 30 20 GKED N#Cc1cccc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c1 917749460 KXIHALBYLYISFC-AWEZNQCLSA-N 377.296 5.096 30 20 GKED CCC(=NNc1ccc(C)cc1Cl)c1ccc(OCCCCC(=O)O)cc1 1776060845 RUQFXYMMSJUDLQ-UHFFFAOYSA-N 388.895 5.508 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)cc1F 1776073521 ZNYLRHNDIHQNCI-UHFFFAOYSA-N 393.201 5.537 30 20 GKED CC(C)(C#N)c1ccc(/C=C(/CCC(=O)O)c2nc3ccccc3s2)cc1 1776123520 QQLOYVDRAKFECN-SSZFMOIBSA-N 376.481 5.503 30 20 GKED Cc1cccc2c1[C@H](C)/C(=C/c1cccc(O[C@H](C(=O)O)c3ccccc3)c1)C2=O 1777455894 KKMPNWWBYUVYNM-SNUWRFOCSA-N 398.458 5.583 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CSc3ccc(Cl)cc3)n2)cc1 14497004 DPLWMHBRQMHFPK-UHFFFAOYSA-N 385.901 5.066 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(OC(F)(F)F)cc1 21022933 RMWYRYDYRBPDCI-UHFFFAOYSA-N 396.368 5.054 30 20 GKED Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1[N+](=O)[O-] 24371601 DRBGSVUUKHZUME-UHFFFAOYSA-N 389.436 5.178 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COc2ccc(Cl)c3ccccc23)cc1 25438820 JPCOVQDQQSIGJL-UHFFFAOYSA-N 378.859 5.312 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 66801919 JXTUGBXTDRQHAH-IAGOWNOFSA-N 382.529 5.297 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccccc2F)on1 66802261 PADBXEIVGOXPQK-CYBMUJFWSA-N 381.432 5.127 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(C(F)(F)F)c1 66955499 DEYDSLAUXAFFTC-ZDUSSCGKSA-N 393.434 5.421 30 20 GKED CCn1nc(C)c(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c1C 120320072 WQTGPDVWAKJJGQ-UHFFFAOYSA-N 394.862 5.090 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 153971214 WHFSCYJISUGKSX-YTQUADARSA-N 393.556 5.657 30 20 GKED C=CCn1c(S[C@H](C)c2nc(C(C)C)no2)nnc1-c1cccc(Cl)c1 154895280 FMOGGCLPUVYIPB-GFCCVEGCSA-N 389.912 5.144 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 155088534 RVSTVXKTONOFQS-UHFFFAOYSA-N 394.862 5.113 30 20 GKED C=CCn1c(S[C@@H](C)c2nc(CCCC)no2)nnc1-c1ccccc1C 158123408 VCRLGLWMCVZSFW-HNNXBMFYSA-N 383.521 5.018 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1 172881884 NXAXZRWBHNQTEK-QFIPXVFZSA-N 380.850 5.261 30 20 GKED Cc1cnc([C@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C2CC2)s1 174544873 OOMZDTFDGNJMII-JOCHJYFZSA-N 389.524 5.143 30 20 GKED CC(C)(C)O[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 179224527 KKVABRSKINJSGO-DNVCBOLYSA-N 397.425 5.164 30 20 GKED COc1cccc([C@H](N[C@@H](C)c2cccc(C#N)c2)c2cc(F)ccc2OC)c1 181847680 XHOKBPSGNLSFFZ-FYSMJZIKSA-N 390.458 5.155 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 182122436 ATANQZSXQKUGCT-KBPBESRZSA-N 376.378 5.129 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H](C)c1cccc(C#N)c1 190879324 IXRRZEZCFZLLJE-JKSUJKDBSA-N 395.553 5.243 30 20 GKED COc1ccc([C@H](/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c2nccn2C)cc1 328990736 IGODKCNCCUMGJE-DVWBAYGPSA-N 381.520 5.081 30 20 GKED CCCN1CCC[C@H]1C(O)=Nc1ccc(Cl)c(/C(O)=N/C2CCCCC2)c1 329248930 ANORPGMIMCQHTA-IBGZPJMESA-N 391.943 5.440 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F 410973708 WPVNJZXEWVDDRP-LSDHHAIUSA-N 394.780 5.047 30 20 GKED CCc1cc(Br)ccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425651914 IDRRXWWSYGTFEC-CYBMUJFWSA-N 386.293 5.108 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2Cc3ccccc3S2)cc1F 437493160 SNYSNSPHZCNYIW-NRFANRHFSA-N 390.439 5.145 30 20 GKED CCCc1c(NC(=O)[C@H](C)c2cc3ccccc3o2)cnn1-c1cccc(C#N)c1 440072897 CZFSRUNOMZZLCG-MRXNPFEDSA-N 398.466 5.185 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1nc(C)cs1)c1ccc(C(F)(F)F)cc1 440836711 WSYCTVWFXDJGHC-CZUORRHYSA-N 397.466 5.538 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2cccc(F)c2)c(OC(F)F)c1 447340260 JEOOXMLLYCSWKR-OAQYLSRUSA-N 382.385 5.178 30 20 GKED CC[C@H](N[C@@H](C)c1ccc(OC2CCCC2)c(OC)c1)c1ccc(C#N)cc1 447533819 SVLHHQJRJSHZSN-JTSKRJEESA-N 378.516 5.690 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccc(C#N)c1 462185144 YHAOQMSLNWJICP-HNNXBMFYSA-N 385.398 5.104 30 20 GKED N#Cc1c(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)sc2c1CCCC2 463068033 FOESPNUBYHVDSB-UHFFFAOYSA-N 386.345 5.048 30 20 GKED CCN(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](c1ccc(C)cc1)c1cccnc1 463821284 XXNMXTZAIJMCLO-CYFREDJKSA-N 383.495 5.003 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 465528131 SJYKUPZYRYEXEA-OFAXGOBFSA-N 391.515 5.016 30 20 GKED C=C(C)C[C@H](C)C(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1 466245093 XABHQUJUXIGYSH-FZMZJTMJSA-N 378.232 5.161 30 20 GKED C[C@H](Sc1cccc(C#N)c1)c1nc(O)c2c(-c3ccccc3)csc2n1 468638029 MBWMMLZFBOTOCG-ZDUSSCGKSA-N 389.505 5.789 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 471255290 SAACHBDCGIXCEU-GUYCJALGSA-N 389.377 5.155 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(NC(=O)CC)ccc1C)c1ccc(F)c(F)c1 480386247 LVQZXXGFZORWJL-HXUWFJFHSA-N 387.430 5.061 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(-c2nccc(C)n2)cc1)c1ccc(F)c(F)c1 480582823 PKOXRDJVCXCGAP-FQEVSTJZSA-N 394.425 5.169 30 20 GKED C=C(C)[C@H](NC(=O)N(CCC)[C@@H]1CCCc2cccnc21)c1ccc(F)c(F)c1 483311212 SGBXDBXKBCNLSY-RTWAWAEBSA-N 399.485 5.476 30 20 GKED N#C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1cccc(Cl)c1Cl 486438147 YFWRDTLZEMUFGA-CKYFFXLPSA-N 385.703 5.193 30 20 GKED C=CCC[C@@H](C(=O)NC1CCN([C@H](C)c2ccccc2)CC1)c1ccccc1 488991431 ZNJHSCCVHNDHQK-HYBUGGRVSA-N 376.544 5.078 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 490815405 QSOCVQVFRFVPHU-UHFFFAOYSA-N 387.439 5.350 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCc2[nH]c3ccc(Cl)cc3c2C1 505040700 WAEPUZKAGYTLRA-UHFFFAOYSA-N 379.891 5.530 30 20 GKED N#CCCn1cc(CN2CCC[C@@H]2/C=C\c2ccccc2)c(-c2ccccc2)n1 507872463 CKBPUCPUHOWZNC-DJKHGBOQSA-N 382.511 5.142 30 20 GKED CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 513709643 JMCRJRSCGGCNTR-GCJKJVERSA-N 378.472 5.130 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 520195801 MKEQHZTZXNUAIQ-QRWLVFNGSA-N 399.535 6.129 30 20 GKED CCSc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521748146 MYELQRGKXPIYHB-CVEARBPZSA-N 399.585 5.933 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)cc2cccnc12 521815573 OETXWURFGKUNTD-UHFFFAOYSA-N 392.890 5.450 30 20 GKED CSc1ccc(N(C)C(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1 522303235 VSDAQCHFZXUOHV-UHFFFAOYSA-N 388.492 5.136 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ncc(-c2ccccc2)o1 530553136 YUDQRFYFPFSEIZ-UHFFFAOYSA-N 375.472 5.515 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2nc3c(s2)CCC3)cc1 531132525 BORDGLMPNJHKBT-UHFFFAOYSA-N 391.521 5.048 30 20 GKED C[C@H](N[C@H]1CCc2c(Br)cc(Cl)cc21)c1ccc(C#N)cc1 534793391 NALMCTRODRXHMI-VOJFVSQTSA-N 375.697 5.312 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc([C@@H]4CCOC4)c3)cc2)cc1 535589075 RFGXLGRFDYNAGJ-HXUWFJFHSA-N 384.435 5.107 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)NCc1cc(Cl)sc1Cl 536148118 AZUMYKZROKJOOD-CABCVRRESA-N 394.327 5.036 30 20 GKED Cc1cc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)ccc1NC(=O)CC(C)C 536971655 WXJLSSUTQIOJGO-UHFFFAOYSA-N 397.544 5.463 30 20 GKED CC[C@H]1C[C@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 541944747 GUAKEWYRRASXNJ-QAPCUYQASA-N 382.435 5.023 30 20 GKED N#CCc1ccc(CNc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1 542237242 ZPEIQWTXALCHQF-UHFFFAOYSA-N 399.372 5.229 30 20 GKED COC[C@H](N[C@@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 550833488 YMEYLIUUBWIWQH-PMACEKPBSA-N 376.422 5.418 30 20 GKED C=CCC[C@@H](NCc1ncc(CSC)s1)c1ccc(C(F)(F)F)cc1 555563932 SAOWWPYHMLRZIY-MRXNPFEDSA-N 386.508 5.822 30 20 GKED N#CCc1ccc(CN[C@@H]2CCCc3nc(-c4ccccc4F)sc32)cc1 568883273 VIKBUYRXZZUKOT-LJQANCHMSA-N 377.488 5.182 30 20 GKED Cc1nnc(SCc2ccc(C#N)cc2OC(F)F)n1[C@H]1CCC[C@@H](C)C1 569110823 ONDZXWAQLHUZKQ-WBMJQRKESA-N 392.475 5.103 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(c4cccnc4)CCCC3)cc2)cc1 577139611 BHQAKKFSLNYGCP-UHFFFAOYSA-N 383.451 5.196 30 20 GKED Cc1c(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)ccn1C(C)C 577642675 QDMCSAPMCHCVTQ-UHFFFAOYSA-N 387.483 5.275 30 20 GKED C[C@H]1C[C@H](CCNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C[C@@H](C)O1 577709283 IPIKBWBDDMYVSN-BCDXTJNWSA-N 393.487 5.066 30 20 GKED CCC(=O)Nc1cccc(-c2noc(-c3cn(CCCC#N)c4ccccc34)n2)c1 589093644 VEYMPGMYPFWIFO-UHFFFAOYSA-N 399.454 5.011 30 20 GKED N#CC1(CCCOc2cc(C(F)F)nc3ccc(Cl)cc23)CCOCC1 596281266 KMBQDTKZGCJDAA-UHFFFAOYSA-N 380.822 5.305 30 20 GKED COc1ccc(NC(=O)CC2(C#N)CCCCC2)cc1NC(=O)C1CCCCC1 597256801 HCKKDEOUTJWNDJ-UHFFFAOYSA-N 397.519 5.017 30 20 GKED C[C@@H]1CC(F)(F)CCN1C(=O)Nc1ccc(Sc2ccccc2C#N)cc1 599793319 GBURTRROJVJZLH-CQSZACIVSA-N 387.455 5.361 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)CCc1ccc(-c2ccccc2F)o1 603527354 LIBFVWFYYIIEKY-UHFFFAOYSA-N 390.458 5.327 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(COc2ccc(F)cc2)n1 603849949 WPVRDKWPSAQLDK-UHFFFAOYSA-N 395.503 5.145 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)oc2c(Cl)cccc12 609068380 PZOQXWPFPPSALO-UHFFFAOYSA-N 376.746 5.120 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)oc2c1ccc1ccccc12 609375325 HFGGRTQHDOUQIU-UHFFFAOYSA-N 386.476 6.153 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccccc1 609435507 SRWJKSHFOUIHPI-JXFKEZNVSA-N 379.529 5.696 30 20 GKED CCCN(CC(F)(F)F)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609727264 GTGXSALODHCIST-UHFFFAOYSA-N 396.796 5.418 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccccc1OC1CCC1 609819854 CYGYXLSUNUNFCR-UHFFFAOYSA-N 382.463 5.087 30 20 GKED CC(C)c1c(C(=O)N[C@H](C)c2cccc(C#N)c2)cnn1-c1cccc(Cl)c1 610360211 TUWLPYCLJDWOOX-OAHLLOKOSA-N 392.890 5.012 30 20 GKED COc1ccccc1-c1nc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cs1 611359724 UELAIIPAJKAPHH-UHFFFAOYSA-N 397.525 5.302 30 20 GKED C[C@H]1CSc2ccc(Cl)cc2N(C(=O)c2cc3ccccc3n2CC#N)C1 612243989 ANJJPDUHVBBRAH-CQSZACIVSA-N 395.915 5.207 30 20 GKED N#C[C@@H](C(=O)c1cccc(-n2cccc2)c1)c1nc2cc(Cl)ccc2s1 613407434 SPVYEAHYSWJKFP-INIZCTEOSA-N 377.856 5.230 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)c(Cl)c1 619423373 FMALPYBVDSPUGY-UKRRQHHQSA-N 377.246 5.070 30 20 GKED Cc1cc(NC(=O)NCc2ccc(C#N)c(Cl)c2)ccc1Oc1cccnc1 619787591 HBZJROVRWDQKDF-UHFFFAOYSA-N 392.846 5.029 30 20 GKED C=CCC[C@@H](NC(=O)N1CC[C@@]2(C1)CC2(F)F)c1ccc(C(F)(F)F)cc1 650982166 LXZOTTQLQOZIKJ-WBVHZDCISA-N 388.380 5.153 30 20 GKED Fc1cc(-c2ncco2)ccc1CN1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 662543716 MYMNZKZHBGETCE-CHWSQXEVSA-N 396.306 5.043 30 20 GKED Fc1cc(Cl)cc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 681594671 HBFYNQJCPVYIES-IWIIMEHWSA-N 377.731 5.478 30 20 GKED Fc1cncc([C@@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C2CC2)c1 684954727 XFELVBRIABOVIH-MXYBEHONSA-N 384.339 5.171 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(O[C@H](C)C#N)cc3)cc2)cs1 728713174 RMOQGILEMXEUMV-HZPDHXFCSA-N 377.513 5.260 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(C2SCCCS2)cc1 729433791 RLCFYICOCGNUNN-UHFFFAOYSA-N 376.591 5.347 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3ccc(F)cc3F)cc2)oc1C(=O)O 729937475 SWVRSSPNJXDWHH-RUDMXATFSA-N 398.361 5.040 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2ccc(C(F)(F)F)nc2O)cc1 731564546 JKWQUVZGKOCVOV-WQLSENKSSA-N 393.405 5.661 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Oc3ccnc4ccccc34)cc2)c1 733212255 JVISHSAZCWKHTB-UHFFFAOYSA-N 395.487 5.817 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@@](C)(C#N)C3CCCCC3)c(F)c2)cc1 734239642 GONJUTMTHVHMIJ-QHCPKHFHSA-N 380.463 5.094 30 20 GKED C[C@H](SCc1cc(Cl)ccc1OCC#N)C(=O)Nc1ccc(Cl)cc1 735319827 FFULCJVOFUUYHV-LBPRGKRZSA-N 395.311 5.156 30 20 GKED C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)c1ccc(C#N)cc1 735617016 RVPQBUURVKNUFF-LLVKDONJSA-N 389.958 6.042 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@@H](C)OC(=O)/C=C\c1ccccc1C#N 739592753 XPHYKGSHOADPAN-MUSGIIIZSA-N 388.492 5.232 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc(Cl)c1OC 741472469 JMPKMEMGDFNDLH-SREVYHEPSA-N 379.843 5.315 30 20 GKED C#Cc1cccc(NC(=S)NCc2ccc(Oc3ccccc3F)c(F)c2)c1 741868329 WQZUZOLXMSEYGN-UHFFFAOYSA-N 394.446 5.225 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)[C@@H]3CCSc4ccccc43)c2)s1 741948627 NYRQFSZFEWRAQK-LJQANCHMSA-N 390.533 5.183 30 20 GKED COc1cc(C=NOCc2csc(C3CCCCC3)n2)ccc1OC(C)C 744180566 TVRHXXQKDFYJJA-UHFFFAOYSA-N 388.533 5.537 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(OC)cc1 752481370 LFHVWHKDKJGSCC-CXAGYDPISA-N 398.915 5.718 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1nc(C(F)(F)F)cs1 752808366 AFSOXGHTAILIOS-UHFFFAOYSA-N 378.828 5.151 30 20 GKED N#CCCCOc1cccc(CN[C@@H]2CCOc3c2ccc(Cl)c3Cl)c1 752978432 DRPRRBPJZDXBPZ-GOSISDBHSA-N 391.298 5.289 30 20 GKED N#Cc1ccc(COc2ccc(C3SCCS3)cc2)c(OC(F)F)c1 753061522 RACXANXWJBUQNU-UHFFFAOYSA-N 379.453 5.217 30 20 GKED CC(C)C[C@H](C)N(C(=O)Cc1cccc(OCC#N)c1)c1ccc2[nH]ccc2c1 760441968 SZAYCUQDYPGQDH-SFHVURJKSA-N 389.499 5.081 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc2c(c1)CCCN2Cc1ccc(Cl)cc1 763926746 GXGUXGYCPIVNHN-UHFFFAOYSA-N 396.922 5.060 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 765910146 KBEONDBHZHJQRG-KBXCAEBGSA-N 393.284 5.052 30 20 GKED C#CCOc1ccc([C@H](C)N[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1 766598336 GMOAKFFVWDUGEL-SBUREZEXSA-N 376.887 5.187 30 20 GKED O=C(/C=C/c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cncs1 787171756 OWKPSJDEDIWVFJ-FNORWQNLSA-N 386.816 5.393 30 20 GKED C#CCC1(C(=O)OCc2nnc(-c3c(Cl)cccc3Cl)o2)CCCCC1 788211807 BRJJRUVTRHISCW-UHFFFAOYSA-N 393.270 5.060 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2sc(Br)cc21 788356997 YHDVZFOBOMNMHI-ZZXKWVIFSA-N 394.237 5.198 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@@H](C#N)c3nccc4ccccc34)cs2)cc1 792100218 KXQHTWJAHYGBAP-HXUWFJFHSA-N 383.476 5.086 30 20 GKED C=CC[C@@H](OC(=O)CCCc1nc(C2CC2)no1)c1ccc(Cl)c(Cl)c1 797566981 WTBOQZQJELJTDY-MRXNPFEDSA-N 395.286 5.437 30 20 GKED Cc1cc(Cl)nc(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 800528599 RIQICPJNVSULGK-UHFFFAOYSA-N 392.846 5.029 30 20 GKED O=C1/C(=C\c2cc(Br)c(Cl)s2)C[C@H](C(=O)O)c2ccccc21 806560859 PCYDQDBXOVRTLU-JECSTDCCSA-N 397.677 5.002 30 20 GKED O=C1/C(=C\c2cc(Br)c(Cl)s2)C[C@@H](C(=O)O)c2ccccc21 806560861 PCYDQDBXOVRTLU-VVEJJEBESA-N 397.677 5.002 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1 808239465 JMMMDLZTDWTTDS-SFHVURJKSA-N 381.357 5.008 30 20 GKED C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-c2c(F)cccc2F)cc1 810224732 KTLQLVQXOZVPHO-MRXNPFEDSA-N 378.422 5.385 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCCC[C@@H]3[C@H]3CCOC3)nc2c1 814860134 LMNTWFPWMPTVET-WCQYABFASA-N 383.439 5.310 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1 825959321 HLQQWQTWXZUQQZ-UHFFFAOYSA-N 395.503 5.562 30 20 GKED Cc1cc(C)cc(-c2noc([C@@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)c1 848606848 KPKKNVHCRRVZDY-QGZVFWFLSA-N 384.480 5.003 30 20 GKED CCc1ccc(C(=O)CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915088739 XPORZEORWAQFQU-DEOSSOPVSA-N 396.490 5.506 30 20 GKED Cc1cc(/C=C\C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)c(C)n1C1CCCCC1 916844769 BKPNGADCTOHNGT-GHYICZDASA-N 386.499 5.376 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)c1 916848326 BLKRQKQAZFUKQK-FQEVSTJZSA-N 384.479 5.390 30 20 GKED CC(C)CC(=NNc1ccc(C(=O)O)c(F)c1)c1cccc(Br)c1 1776075002 GWRAGFLNCSHNBP-UHFFFAOYSA-N 393.256 5.149 30 20 GKED C=C(C)C[C@H](NCc1cc(Cl)ccc1Oc1ccc(Cl)cc1)C(=O)O 1776137448 MKZNJZKODSJHHK-KRWDZBQOSA-N 380.271 5.295 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)C(=O)c2ccccc21 1776308923 YSYHNXQDAQEDAB-PSXBWXLBSA-N 388.419 5.370 30 20 GKED CCCCCCOc1cccc(/C=C2/CCc3oc(C(=O)O)c(C)c3C2=O)c1 1776790240 DEASQXNHTWRJOD-LGMDPLHJSA-N 382.456 5.458 30 20 GKED COc1cc(C(=O)O)ccc1/C=C/C(=O)c1ccc(-c2ccc(Cl)cc2)s1 1777268172 NMKNDDSYTTZBII-RMKNXTFCSA-N 398.867 5.671 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)o1 1777424516 DRYKIHHMSMWRQG-JLHYYAGUSA-N 380.371 5.206 30 20 GKED Cc1ccc(Sc2ccc(C(=O)Nc3sccc3C#N)cc2[N+](=O)[O-])cc1 14626453 DTGJFAFHKTUQAT-UHFFFAOYSA-N 395.465 5.240 30 20 GKED C=CCN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)Cc1cccs1 19540380 OWTVGZHPSXBKKR-UHFFFAOYSA-N 388.842 5.047 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCC(=O)c2cccs2)cc1 55428103 XEQLOUGXKRWUMV-UHFFFAOYSA-N 376.437 5.014 30 20 GKED CC(C)c1ccc(-c2noc(CNc3cccc(OCCCC#N)c3)n2)cc1 55876834 SPJFPUOODIRZMO-UHFFFAOYSA-N 376.460 5.155 30 20 GKED COc1cc(C(=O)/C=C/c2ccccc2OC(F)F)ccc1SC(F)F 63874771 BYZVTZBRZPADSM-SOFGYWHQSA-N 386.366 5.507 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCc1ccc(C#N)cc1)C1CC1 121501389 YQCBBAHDNCGIER-AWEZNQCLSA-N 387.405 5.012 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1F 121697068 BAKGCXTTZUVUOJ-AWEZNQCLSA-N 386.835 5.101 30 20 GKED COc1ccc(F)c(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 154504797 YZSRRKPXLFNIRY-UHFFFAOYSA-N 378.428 5.109 30 20 GKED Cc1c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1CCC(C)C 160225227 JAWRPYPGEDIWQK-OAHLLOKOSA-N 385.537 5.276 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)C2CC2)cc1 171246012 VMWAIOJZCXSCNQ-UHFFFAOYSA-N 391.805 5.010 30 20 GKED CCN(C(=O)c1ccc(CCC(F)(F)F)cc1)c1ccc(C#N)c(Cl)c1 179524054 APSLGUNJOMTXPP-UHFFFAOYSA-N 380.797 5.373 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)cc1F 182070528 IEDCOGWHVHGTCU-AWEZNQCLSA-N 378.378 5.175 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N(CCC(F)(F)F)Cc1ccccc1 191448543 VWWHZJKLISBTEN-UHFFFAOYSA-N 392.425 5.101 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(c4ccncc4)CC3)cc2)c1 191893424 RLOGAVGIRIMFIF-UHFFFAOYSA-N 398.466 5.157 30 20 GKED N#CCCCCNCc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 237897643 MHRRAZYHQAPONF-UHFFFAOYSA-N 378.907 5.035 30 20 GKED C[C@@H](Nc1ccc(C#N)cc1F)c1cccc(NC(=O)Cc2ccccc2F)c1 301137850 DKXWUJITHOBTAU-OAHLLOKOSA-N 391.421 5.191 30 20 GKED Cc1cccc2cc(/C(O)=N/[C@H]3CC4(CCN(C)CC4)Oc4ccccc43)oc12 329406031 BVVKGWKMPJSGLB-IBGZPJMESA-N 390.483 5.034 30 20 GKED COc1cccc(Cl)c1C/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329623844 NYJUCWMIIYOCAF-GOSISDBHSA-N 387.911 5.237 30 20 GKED C[C@H](C(O)=Nc1ccccc1NC12CC3CC(CC(C3)C1)C2)c1ncccc1F 329914484 XVUZDXWZHABBOA-KSKOPSKJSA-N 393.506 5.993 30 20 GKED Cc1c(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)oc2c(C)cccc12 410044592 LIQXHMZJQDQBBB-UHFFFAOYSA-N 387.464 5.221 30 20 GKED C=CCCc1ccccc1NC(=O)c1cn(CCC#N)nc1-c1ccc(C)c(C)c1 410344585 LTTYULYVSZAEHJ-UHFFFAOYSA-N 398.510 5.452 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@@H](C)C3)s1 411021915 XEZCTVSQYWFYIX-JFGNBEQYSA-N 389.546 5.030 30 20 GKED N#Cc1ccc(C(=O)[C@@H](C#N)c2nc(C34CC5CC(CC(C5)C3)C4)cs2)s1 429338533 MJGQBTYVRYTNFX-JISUQADQSA-N 393.537 5.034 30 20 GKED N#CCCC[C@H](NC(=O)NCc1nc2cc(Cl)ccc2s1)c1ccccc1 431873602 UQRQTLPKRWVONV-INIZCTEOSA-N 398.919 5.184 30 20 GKED Cc1ccc(-c2cccnc2)cc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 432991052 ILFZOBCHOFCZSH-LADGPHEKSA-N 396.494 5.361 30 20 GKED C[C@H](NC(=O)C1(c2cccc(C#N)c2)CC1)c1cccc(OCc2ccccc2)c1 433718158 IYIYZDMEKRBCKL-IBGZPJMESA-N 396.490 5.046 30 20 GKED COc1ccc(CSc2nnc(SCCCCC(C)(C)C#N)s2)cc1 436132759 NJOXUDNFCNNWJA-UHFFFAOYSA-N 393.603 5.651 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cnc(-c3ccc(C)o3)s2)cc1 437234653 AZXKQVKURAMFNB-UHFFFAOYSA-N 393.512 5.138 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(-c2nccs2)c1 437881201 ASHAQOQWGVOMLJ-UXHICEINSA-N 388.496 5.114 30 20 GKED CCCc1c(NC(=O)Nc2cc3[nH]ccc3cc2C)cnn1-c1cccc(C#N)c1 439691191 FTEPYUHZOOUMAP-UHFFFAOYSA-N 398.470 5.130 30 20 GKED N#C[C@@H](C(=O)c1ncoc1-c1ccccc1Cl)c1nc2ccccc2s1 442601834 HAHFYRCOGSKENE-LBPRGKRZSA-N 379.828 5.095 30 20 GKED C=CC[C@H](CC)NC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 466390838 FBVRJONORFMDNS-OALUTQOASA-N 381.520 5.666 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Cn2cnc3ccccc32)cc1)c1ccccc1 475399339 ZRFBPWCUFDRJJZ-NRFANRHFSA-N 394.478 5.111 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCOC)CCc1ccccc1 475544234 GGVLPVYVHDCMAO-UHFFFAOYSA-N 380.532 5.262 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F)c1ccccc1 476622933 GGQOLVDTMPFWIA-GCJKJVERSA-N 396.412 5.647 30 20 GKED CCS[C@H](C)c1noc(CN(C)Cc2ccc(-c3ccccc3C#N)cc2)n1 485979419 YTYWDTJUAISPAC-MRXNPFEDSA-N 392.528 5.054 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cc1 486097725 QQGWYTJJTWMGBW-YTFSRNRJSA-N 387.527 5.678 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1 490196775 LUNBUMVTOAXRLK-UHFFFAOYSA-N 396.512 5.061 30 20 GKED C/C(=C\c1ccccc1)CN(C)CC(=O)Nc1ccccc1S[C@H](C)CC#N 494261097 BZYCPSQXROUXSL-LRXXLLMYSA-N 393.556 5.055 30 20 GKED N#C[C@@H](NC(=O)c1cc2ccc(Cl)cc2[nH]1)c1c(Cl)cccc1Cl 499800561 MVKIWKJBHJOXRT-OAHLLOKOSA-N 378.646 5.123 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(C#N)cc1 505317572 JNHJNFAZMJHXLD-MZNJEOGPSA-N 395.462 5.454 30 20 GKED CC(C)Sc1ccc(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)cc1 505939388 VPIIJXBTTDCMOC-KRWDZBQOSA-N 378.419 5.201 30 20 GKED CC[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 507613386 QZEDLHXCJCTGDA-WUJZJPHMSA-N 393.478 5.607 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)Nc2ccccc2SCCC#N)c1 507707053 JJHJKGPHGROQHJ-UHFFFAOYSA-N 382.529 5.532 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 513664329 TWRZHXQZKOLWAS-JTSKRJEESA-N 378.472 5.130 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N(Cc3cccs3)C3CC3)cc2)c1 518256626 JHJFRWNPJKMPLC-UHFFFAOYSA-N 389.480 5.609 30 20 GKED Cc1cc2cc(NC(=O)c3ccc(Oc4cccc(F)c4C#N)cc3)ccc2[nH]1 518551434 KQNCDRGYEUWSMQ-UHFFFAOYSA-N 385.398 5.532 30 20 GKED CC(C)N(Cc1cccc(Cl)c1)C(=O)CCCCOc1cccc(C#N)c1 518902098 OMFXGCRUIFISPH-UHFFFAOYSA-N 384.907 5.198 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cc1 520457619 LYAJPSPFGRTYOQ-QGZVFWFLSA-N 385.920 5.500 30 20 GKED Cc1ccc(-n2ncc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2C)cc1 520924156 LMEHHQQVYNNKTH-MRXNPFEDSA-N 390.512 5.136 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(F)cc1)C(C)(C)C 521075459 QTECIFLYLISUTA-NRFANRHFSA-N 379.479 5.182 30 20 GKED CC[C@H](C)c1ccc(S(=O)(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521712699 OUHWTCCZNOHKAX-CVEARBPZSA-N 388.558 5.253 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cs1 522073080 RWFJFZCPKBVQBQ-CQSZACIVSA-N 392.484 5.252 30 20 GKED CCc1c(C)sc(NC(=O)[C@H]2C[C@@H]2c2ccccc2OC(F)(F)F)c1C#N 524962706 NQYZNHLWPCPKCY-KGLIPLIRSA-N 394.418 5.131 30 20 GKED C=C(C)[C@@H](CC(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)OCC 535154353 WEUVPROZYXSKRT-SUMWQHHRSA-N 392.952 5.320 30 20 GKED C=C[C@@H](CC(=O)N(C)Cc1c(C)nn(-c2ccccc2C)c1C)c1ccccc1 536162705 GOJWBNOIVHTBEU-NRFANRHFSA-N 387.527 5.116 30 20 GKED COc1ccccc1[C@H](C)CC(=O)NCc1ccc(-c2ccccc2C#N)cc1 538000615 RAZRMTARTJXMDP-GOSISDBHSA-N 384.479 5.044 30 20 GKED CCOc1ccc(OC)cc1NC(=O)c1ccccc1Oc1ccccc1C#N 538666893 BVBMGYPHKDOIRC-UHFFFAOYSA-N 388.423 5.010 30 20 GKED CC[C@@H](C)[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 540386453 SULHVWNKPBNABT-VLIAUNLRSA-N 380.879 5.139 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(-n2ncc3ccccc32)cc1)c1ccccc1 544255363 OLKRBVWNZCDWRS-QFIPXVFZSA-N 395.466 5.192 30 20 GKED C[C@@H]1C(=O)CC[C@@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1(C)C 548366731 FDUZKIXVFUQNRV-PBHICJAKSA-N 394.446 5.070 30 20 GKED Cc1sc(C2(NCc3ccccc3C#N)CCC2)nc1-c1ccccc1F 550321876 VMLIPASKUIBGRK-UHFFFAOYSA-N 377.488 5.298 30 20 GKED CCCCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c(C)c1 551107429 XGTLBHVOGVDFMA-UHFFFAOYSA-N 377.488 5.242 30 20 GKED N#CCCCn1cc(-c2nc(Cc3cc4ccccc4o3)no2)c2ccccc21 551182362 BZCBLNRRHGIMEU-UHFFFAOYSA-N 382.423 5.332 30 20 GKED CC[C@@](C)(C#N)C(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 552492290 AVJDVJOPOBMROD-IBGZPJMESA-N 385.876 5.620 30 20 GKED Cc1ccnc(-c2ccc(NC(=O)c3sc4ccc(C#N)cc4c3C)cc2)n1 556212947 OOILIQRSTATPIB-UHFFFAOYSA-N 384.464 5.099 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 556874951 HIWBLFCITPLLKG-HSZRJFAPSA-N 392.478 5.610 30 20 GKED Cc1c(C(=O)N[C@@H](C)Cc2nc3ccccc3s2)sc2ccc(C#N)cc12 560261978 ANZSYORKYVYXIL-LBPRGKRZSA-N 391.521 5.052 30 20 GKED C=CCC[C@H](NC(=O)N[C@H]1c2ccccc2CC12CCOCC2)c1ccccc1 564581368 LKPJAJVGHPDALH-GOTSBHOMSA-N 390.527 5.087 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N[C@H](c3ccccc3)C3CC3)cc2)ccn1 569041707 XAZZQHNPAZKZPW-JOCHJYFZSA-N 384.439 5.018 30 20 GKED C=CCN(C(=O)[C@@H]1CC[C@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 570754428 DSYCHQWLBMYTEI-CABCVRRESA-N 380.435 5.308 30 20 GKED C=C[C@](C)(CCOC)c1nc(C2(c3cccc(C(F)(F)F)c3)CCC2)no1 574000905 SDJCORLZYRBNOM-GOSISDBHSA-N 380.410 5.039 30 20 GKED CCN(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)c1cc(C)ccc1C 574548273 YVKODTBJXZNNPI-UHFFFAOYSA-N 384.479 5.421 30 20 GKED N#Cc1ccc(CNc2cccc(-c3ncc4n3CCCC4)c2)c(C(F)(F)F)c1 579095770 KIVZLKOIXARMSA-UHFFFAOYSA-N 396.416 5.389 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccc(OC)cc2)[C@H](C)C2CC2)c1 595762976 ROYWQSLENXMIHI-GOSISDBHSA-N 394.515 5.483 30 20 GKED CCCCc1ccc([C@H](NC(=O)CC2(C#N)CCOCC2)c2cccs2)cc1 596710049 JLGWILXJCZMLBW-QFIPXVFZSA-N 396.556 5.007 30 20 GKED N#CC1(CC(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)CCOCC1 597801834 UAKKGLFRHOSBOC-UHFFFAOYSA-N 386.904 5.140 30 20 GKED C=CCn1c(SCCOC2CCCCCC2)nnc1-c1ccc(F)cc1 607058808 WFXXEDUKUGZJDL-UHFFFAOYSA-N 375.513 5.102 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208902 KFXCLKZSMCVNKF-UHFFFAOYSA-N 393.393 5.293 30 20 GKED CCCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1ccc(F)cc1 609385301 PFJGPUPZWPKQPM-KRWDZBQOSA-N 399.535 5.071 30 20 GKED N#CCCn1cc(-c2csc(COc3ccc(F)cc3)n2)c2ccccc21 609571441 ASOYXXBXVGHXRF-UHFFFAOYSA-N 377.444 5.397 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)Nc1ncccc1C#N 610077480 ROFXUIMHVKYQDG-LLVKDONJSA-N 399.317 5.321 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 611557374 OPBLLKJCGWZPFM-RDBSUJKOSA-N 385.455 5.133 30 20 GKED CC(C)(C#N)CNC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 612566591 ITVLPLVIIBATBQ-UHFFFAOYSA-N 396.409 5.275 30 20 GKED CCCCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 613392087 FFKXRHKRCPSIGJ-IBGZPJMESA-N 376.481 5.479 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F 615081463 JAYXJUFYSDWNTJ-MOPGFXCFSA-N 389.417 5.032 30 20 GKED N#Cc1ccc(C[C@@H](C#N)C(=O)Nc2cccc(Sc3ccccc3)c2)cc1 619287343 JKMJAPNFJCXTQT-IBGZPJMESA-N 383.476 5.030 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C1(CCF)CC1 648494372 MFTDCRZBROGXJW-UHFFFAOYSA-N 375.259 5.054 30 20 GKED C=CCOc1cccc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)c1 677753034 OXJNZOLWRCWMTH-UHFFFAOYSA-N 386.423 5.565 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 726073373 AAUYWWBBYGBTHE-DEOSSOPVSA-N 383.495 5.785 30 20 GKED N#CCCCOc1cccc(/C=C2/CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)c1 726743651 NSIXHXNEPRCJPU-AXPXABNXSA-N 388.423 5.107 30 20 GKED N#C[C@H](C(=O)[C@H](OC1CCCC1)c1ccccc1)c1nc2ccccc2s1 727039221 UWRMTORMSZHMFN-DYESRHJHSA-N 376.481 5.173 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccc(C(C)=O)cc2)c1 728227350 HRTCNGRVXRDUKK-UHFFFAOYSA-N 384.504 5.274 30 20 GKED C#Cc1cccc(N(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)C(C)C)c1 728248067 YZIRDWRMEGBXBY-UHFFFAOYSA-N 378.472 5.070 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@H](CC)c1ccccc1 729069991 OROOYDUQTCUXEZ-PZJWPPBQSA-N 376.500 5.043 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 729070854 ZLBLOWHDRQMTQY-SCLBCKFNSA-N 389.282 5.225 30 20 GKED C=CC[C@H](NC(=O)[C@H](C)Sc1cc(Cl)ccc1Cl)c1ccncc1 734360009 FFBHPIMYEOVLDZ-LRDDRELGSA-N 381.328 5.303 30 20 GKED N#C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C1CCCCC1 734368639 VYOWKGNJSFWFPR-KRWDZBQOSA-N 379.451 5.677 30 20 GKED Cc1cccc([C@H](C)C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 740531250 OFFJUPRGCJLGFF-SWLSCSKDSA-N 388.414 5.604 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cnn(-c3ccccc3)c2)cc1 741470767 VEZUNUNJWUKFDD-WJDWOHSUSA-N 380.447 5.444 30 20 GKED C[C@H](Oc1ccc(Cl)c(COC(=O)c2sccc2C#N)n1)c1ccccc1 744291387 ZSUZEEQDDOVCIB-ZDUSSCGKSA-N 398.871 5.165 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)/C=C/c2cccc(OC3CCCC3)c2)n1 747197355 YDFIKQMCVMFYBX-VYENPZKTSA-N 380.513 5.478 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCc2ccc(-c3ccccc3F)o2)n1 747199228 RVLYGBSORIVOTG-MRXNPFEDSA-N 382.460 5.475 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 748594729 XFEZMZUMSXRRJO-FQEVSTJZSA-N 381.545 6.052 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1nc(-c2ccccc2)cs1 753145144 WCYUMQPHIDPPMD-KTKRTIGZSA-N 375.478 5.225 30 20 GKED N#C[C@@H](C(=O)CCCc1csc2ccccc12)c1nc2ccccc2s1 756228805 UUWBISDIPZAMAA-INIZCTEOSA-N 376.506 5.710 30 20 GKED Cc1ccccc1-c1nc(CSCc2cc(Cl)ccc2OCC#N)no1 760300738 GSYYXCRIOHNJKJ-UHFFFAOYSA-N 385.876 5.034 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 761047726 OULHRFVKPNGRGO-GOEBONIOSA-N 376.909 5.254 30 20 GKED C=C(C)[C@@H](NC1CCC(NC(=O)OC(C)(C)C)CC1)c1ccc(F)c(F)c1 775558319 OCRZJFZYBJBRTO-LADRWXRNSA-N 380.479 5.008 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)c(F)c1 781108135 NNOFHCFGQDHDSU-TWGQIWQCSA-N 378.384 5.230 30 20 GKED CC(C)N(C(=S)Nc1ccc(C#N)c(Cl)c1)c1cnc2ccccc2c1 788334270 TZOZROHMHVCEEI-UHFFFAOYSA-N 380.904 5.372 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)c1 789430931 OLNDSYWQUFVMAK-DNVCBOLYSA-N 375.472 5.030 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CSc3c(Cl)cccc3C2=O)cn1 792882308 FEEYPOVUWGCHOG-NTEUORMPSA-N 394.883 5.178 30 20 GKED Cc1sc([C@H](C)Nc2nc(Cl)c(C#N)s2)nc1-c1ccc(Cl)cc1 804543423 UWVCDHOPELAALO-QMMMGPOBSA-N 395.340 5.927 30 20 GKED N#Cc1sc(N[C@H](c2cc(F)cc(Br)c2)C2CC2)nc1Cl 804623659 RPUTZPYJCPMXNZ-LBPRGKRZSA-N 386.677 5.133 30 20 GKED C#CCC1(C(=O)N2CCc3nc(-c4ccccc4Cl)sc3C2)CCCCC1 807737466 UUNBULHHIPJWHZ-UHFFFAOYSA-N 398.959 5.322 30 20 GKED N#C[C@@H](C(=O)CC1CCC(C(F)(F)F)CC1)c1cc(C(F)(F)F)ccn1 813211464 KUQKSBVZRAGXSJ-GCZXYKMCSA-N 378.316 5.035 30 20 GKED CC(=NNc1ncccc1C(F)(F)F)c1sc(-c2ccccc2F)nc1C 814802140 ZSURGHPPTXSNKM-UHFFFAOYSA-N 394.397 5.508 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1sc2nc(C)nc(C)c2c1C 863964815 AZJJSUYCBGMPBE-UHFFFAOYSA-N 396.545 5.074 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)[C@@H](O)c1ccccc1 878676266 PBRRPIQPINMNOT-CBGDNZLLSA-N 397.544 5.057 30 20 GKED Cc1ccc(OCCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 915353680 WAFYXIMGSFSWNI-QHCPKHFHSA-N 399.494 5.159 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(Cl)cc(Cl)c2)cc1 916947379 ISXJEFMPGBVVMX-KPZWWZAWSA-N 389.282 5.468 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)CCc2ccc(Cl)s2)cc1 916950151 RKUOLVGQJLBYCT-CXAGYDPISA-N 388.920 5.195 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3ccccc3s2)cc1 916955125 MTRGWQHQBZKYLZ-KDOFPFPSSA-N 376.481 5.376 30 20 GKED COc1cc([C@H](C)Nc2snc(Cl)c2C#N)ccc1OCc1ccccc1 917088669 FMIDFNLNTIPXLH-ZDUSSCGKSA-N 399.903 5.429 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C=C(C2CC2)C2CC2)cc1Cl 917675095 ZWUSQRCEFWCJKF-OAQYLSRUSA-N 376.887 5.680 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCC3CCCCC3)n2)cc1 920140753 JLEBTQIDJYRWKA-LJQANCHMSA-N 377.513 5.609 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3cccc(C(F)(F)F)c3)o2)cc1F 1776075181 SDNMGOKCEJRDDV-UHFFFAOYSA-N 392.308 5.249 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1csc(-c2ccsc2)n1 1776355250 YDVRDOQPAOLZEC-PLNGDYQASA-N 399.493 5.253 30 20 GKED CCCCCCCOc1ccc(CNCc2cc(C(=O)O)sc2C)cc1 1776786982 IALOTSBSTPYROL-UHFFFAOYSA-N 375.534 5.394 30 20 GKED CCCCCCCOc1cccc(CN[C@H](Cc2ccc(C)c(C)c2)C(=O)O)c1 1776787197 BBVJKWPJPVKMSG-XMMPIXPASA-N 397.559 5.438 30 20 GKED Cc1cc(COc2ccc(/C=C3\C(=O)c4ccccc4[C@@H]3C)cc2)oc1C(=O)O 1777423192 AKTSUMSZWDWPMX-RANIVTSPSA-N 388.419 5.249 30 20 GKED C=CCn1c(SCc2c(C)cc(C)c(C(C)=O)c2C)nc2sccc2c1=O 36855155 KMMBQPXNPXRROD-UHFFFAOYSA-N 398.553 5.064 30 20 GKED CSCc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 41513703 WCFNOCMDMHRZSP-SFHVURJKSA-N 378.522 5.472 30 20 GKED Cc1nccc(-c2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2)n1 46291331 JIBMWUNLUZYFMT-UHFFFAOYSA-N 390.446 5.243 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2ccccc2SC(C)C)cc1 56300325 ZZWBEZCDFHAWKN-UHFFFAOYSA-N 394.540 5.254 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 66954888 FHOJITLFTRQVGG-WIYYLYMNSA-N 393.556 6.067 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955389 PWFDDADCPABPHI-QGZVFWFLSA-N 390.512 5.173 30 20 GKED N#Cc1cccc(COc2cccc(CNC3(c4nccs4)CCCC3)c2)c1 116374111 NBJMEBRQGQQVAS-UHFFFAOYSA-N 389.524 5.153 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1CCCc2sccc21 119595597 GMKKUHGALCPHSD-GOSISDBHSA-N 389.480 5.174 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCCC2)c1nc(-c2ccncc2)cs1 128856971 AZJPAEVLAKVYJL-INIZCTEOSA-N 393.537 5.416 30 20 GKED Cc1nc(CNc2ccccc2SC[C@@H](C)C#N)oc1-c1ccc(Cl)cc1 129974096 KUQCNDPUMDJQOX-AWEZNQCLSA-N 397.931 6.167 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)N[C@@H](CCC#N)c2ccccc2)C2CC2)o1 160682770 ULWAYDCVVYMHHY-CZAAIQMYSA-N 377.488 5.122 30 20 GKED CC(C)[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 172545533 HEJOYRNWTOMMHB-SJORKVTESA-N 381.426 5.123 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2o1 176543153 NQHPITXGAQFYAB-KRWDZBQOSA-N 398.418 5.509 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3cccc(C#N)c3C)cc2)cs1 178377807 RAQBDGACOSHMPW-UHFFFAOYSA-N 379.510 5.176 30 20 GKED Cc1c([C@H](C)N[C@@H](CCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 181571732 ARNIBTVAEHUOTD-AOMKIAJQSA-N 378.907 5.530 30 20 GKED COc1cccc(F)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 184518917 NDEIPTXLQJZTBA-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CC1(C)OB(c2ccc3ccccc3c2-c2cccc3ccccc23)OC1(C)C 195978098 ITJGUUJJWGIMDT-UHFFFAOYSA-N 380.296 5.959 30 20 GKED C/C(O)=N/C1(c2noc(-c3sc(-c4ccccc4)nc3C)n2)CCCCC1 329199289 AYAKPRHIAHSPMZ-UHFFFAOYSA-N 382.489 5.304 30 20 GKED C[C@@H](CC(F)(F)F)C(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410688652 OEBCUMLOBBSIGU-KWQFWETISA-N 395.265 5.356 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@H](C)C[C@@H](C)C2 411015386 QCURGNGXFKMBBV-HTQZYQBOSA-N 399.463 5.342 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CN(C)[C@@H](C)c1cccc(C#N)c1 425529405 BQOLYUMIVKSSKD-SFHVURJKSA-N 377.532 5.437 30 20 GKED Cc1cc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)o1 429371819 KIKMRJITDJASPH-ZDUSSCGKSA-N 391.279 5.817 30 20 GKED Cc1c(C(=O)Nc2ccccc2OCC(F)(F)F)sc2ccc(C#N)cc12 429934289 ZZXNLJYEDXXFBB-UHFFFAOYSA-N 390.386 5.275 30 20 GKED N#C[C@H](C(=O)c1ccc2c(ccn2Cc2ccccc2)c1)c1nc2ccccc2[nH]1 433106648 SFLBHCGNBDBENB-HXUWFJFHSA-N 390.446 5.056 30 20 GKED Cc1c(NC(=O)Nc2cccc(C#Cc3ccccn3)c2)cccc1-c1ncco1 433133467 IILNWFHQENOFKY-UHFFFAOYSA-N 394.434 5.089 30 20 GKED CSc1cc(C(=O)N[C@H](CCC#N)c2ccccc2)c(Cl)cc1Cl 439668414 AUYIBQBCCMPZNX-MRXNPFEDSA-N 379.312 5.490 30 20 GKED CCCc1c(NC(=O)[C@@H](c2ccccc2)C(C)C)cnn1-c1cccc(C#N)c1 440065668 AYOPJZFHMOTZPO-HSZRJFAPSA-N 386.499 5.075 30 20 GKED C=CCN(Cc1cccs1)C(=O)CCC(=O)c1cc(Cl)sc1Cl 445674570 UOOQKNJKKWOOEK-UHFFFAOYSA-N 388.341 5.294 30 20 GKED CCCCn1ncc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1C 448421893 RGAWDVQWOXSMNX-UHFFFAOYSA-N 388.471 5.102 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)N1CCC(F)(c2ccccc2C(F)(F)F)CC1 451423378 RJQQMHNLXSPLDE-GFCCVEGCSA-N 399.350 5.471 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)[C@@H]1OCCc2sccc21 455254919 XOURFKKLVZAATI-VFNWGFHPSA-N 384.545 5.424 30 20 GKED N#CCc1ccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c(Cl)c1 455742587 BYBCIYFWYDLDRH-QGZVFWFLSA-N 396.903 5.385 30 20 GKED C[C@H](c1cccc(C#N)c1)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 463050137 AWQGOJLIVJSSCL-BZNIZROVSA-N 375.325 5.171 30 20 GKED COc1ccc(C#N)cc1N[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 466142983 IKGBVFGETKLGSJ-JTQLQIEISA-N 389.242 5.097 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1N(C)C1CCCC1 475026766 BNFQXUQPXXYNBO-UHFFFAOYSA-N 390.531 5.380 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 476121228 NCBKMUVUOFDOMS-UHFFFAOYSA-N 397.478 5.850 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](CC)c1cccc(Cl)c1 478536146 DEYZBQPVQOEQGG-FQEVSTJZSA-N 388.943 5.356 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cc(F)cc(Br)c1 484764077 BCDZNSDCHLCHQC-LBPRGKRZSA-N 379.298 5.595 30 20 GKED N#C[C@@H](NC(=O)c1ccc(CSc2ccccc2)cc1)c1ccc(Cl)cc1 499814180 QRJSILULEXCHGO-OAQYLSRUSA-N 392.911 5.627 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)COc1ccccc1Cl 500773729 UNZRRYHVPPFGRO-UHFFFAOYSA-N 392.842 5.330 30 20 GKED COc1cccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 502315371 GQXXXMOKQWZSDW-HXUWFJFHSA-N 391.858 5.648 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)[C@@](C)(C#N)CC(=O)OC(C)(C)C 503149947 FGJSNWOAJJGJQV-LJQANCHMSA-N 396.940 5.041 30 20 GKED COc1ccc2ccccc2c1CNC(=O)c1ccccc1-c1ccccc1C#N 512905577 QKGGYKQIRHZYJG-UHFFFAOYSA-N 392.458 5.317 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cc1 513143004 KEAJBJJLLFSJJS-KRWDZBQOSA-N 376.378 5.015 30 20 GKED Cc1ccc(-n2cc(C(=O)[C@@H](C#N)c3nc(C)cs3)c(-c3ccccc3)n2)cc1 513681869 KXYZMMZOYRAUPH-LJQANCHMSA-N 398.491 5.103 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccccc3SC(C)C)n2)cc1 517277636 KBQHLWSQNJMUSL-SFHVURJKSA-N 392.549 6.109 30 20 GKED Cc1ccc([C@@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 518029014 AZDPSOMDZKQZEH-GOSISDBHSA-N 386.520 5.650 30 20 GKED Cc1cc(Br)ccc1C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 518709235 NSRNPCNERZMRSE-CQSZACIVSA-N 398.087 5.059 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2cccs2)n1 519434229 SREPUAGASPZTPX-GFCCVEGCSA-N 385.539 5.376 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1CCC(c2ccccc2)CC1 520195858 ONQJYHVTEUYPIE-KKXNLOMOSA-N 393.556 5.929 30 20 GKED CC(C)(C)[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521093915 LPGXZLPTWVKZAM-UXHICEINSA-N 377.488 5.080 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(OC2CCCCC2)c1 523086152 MWRHPCUKKQFTAI-KRWDZBQOSA-N 394.540 5.902 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4c(s3)CCC4)cc2F)c1 524457595 QOIXHRBIUSEODP-UHFFFAOYSA-N 392.455 5.079 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)cc1Br 530507940 OPEQFUHDVAYALS-UHFFFAOYSA-N 388.305 5.562 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccc(F)cc3C(F)(F)F)c2C#N)C1 532874221 ZRSCNZXAPJJPMT-VIFPVBQESA-N 382.382 5.155 30 20 GKED Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 537059949 HIVAEZJUHAKXTR-WZONZLPQSA-N 395.572 5.315 30 20 GKED CC(C)CC[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 538167110 KFYYEZYENOFGBW-FQEVSTJZSA-N 394.906 5.529 30 20 GKED C[C@H](NC(=O)C1(c2cccc(C#N)c2)CC1)c1ccc(-c2cccc(C#N)c2)cc1 541998527 SVAGJMDOJDEYRX-SFHVURJKSA-N 391.474 5.006 30 20 GKED C[C@@H](NC(=O)N[C@H]1CCCC(F)(F)C1)c1ccc(-c2cccc(C#N)c2)cc1 542076824 QLWAERAWLKJVNL-QRWLVFNGSA-N 383.442 5.163 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nc(Cc2ccccc2)no1 542934736 SWFBGSXGEVAKLW-GFCCVEGCSA-N 389.402 5.404 30 20 GKED Cc1cccc(C)c1NC(=O)CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542948142 NTYCBAFDCIRVTC-LJQANCHMSA-N 383.495 5.131 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2cccs2)o1)c1cccc(C(F)(F)F)c1 543076939 KFJYDHVPYDNWMF-ZDUSSCGKSA-N 376.359 5.022 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(-c2nc(Cc3cscn3)no2)c1 545591165 VMLWZJUTEJARQK-UHFFFAOYSA-N 394.843 5.101 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Nc3cccc4cc[nH]c34)c2)cc1 548162384 MMZIJJJHLLTEIZ-UHFFFAOYSA-N 396.450 5.457 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1Cl 554210608 KTLZRUHPEJQDHL-UHFFFAOYSA-N 377.831 5.066 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@](F)(c3cccc(Cl)c3)C2)cc1 558747398 GKIMPEHKDWZTAW-OAQYLSRUSA-N 385.870 5.244 30 20 GKED CCN(CC)Cc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 577516216 OYMPIBZIKITAEQ-QGZVFWFLSA-N 397.931 5.282 30 20 GKED C[C@H](N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccc(C#N)cc1 584861775 KYLCEVHFQKVTEI-RBZFPXEDSA-N 394.316 5.530 30 20 GKED C=CCCC(=O)N(C)Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 588213657 LAGLKRBGFXGPNU-UHFFFAOYSA-N 393.918 5.176 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC[C@H](C3CC3)C2)cc1 589525511 GSEJCZNJDGSZPX-FQEVSTJZSA-N 376.525 5.113 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(C[S@](=O)C3CCCCC3)c2)cc1 594504034 FWDPHOGILZBFQG-NDEPHWFRSA-N 394.584 5.681 30 20 GKED CCCCSc1ccc(Cl)cc1-c1noc(CC2(C#N)CCOCC2)n1 596592748 RUUMFKVIUXEQHK-UHFFFAOYSA-N 391.924 5.145 30 20 GKED COc1ccc(CNc2ccc(F)c(C(F)(F)F)c2)cc1OCCCC#N 600848232 HJHBBFAVAMXONR-UHFFFAOYSA-N 382.357 5.148 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1ccc(Cl)c(Cl)c1 603766990 XQPXNKYXXVFPNT-UHFFFAOYSA-N 385.703 5.390 30 20 GKED N#Cc1c(NC(=O)[C@H]2Cc3ccccc3S2)sc2c1-c1ccccc1CC2 603991529 BEWNGPQZFGICHZ-LJQANCHMSA-N 388.517 5.041 30 20 GKED CSc1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)c1 604241630 CRVJUEUSTFBUEP-UHFFFAOYSA-N 375.453 5.028 30 20 GKED C[C@@H](S[C@@H]1CCCc2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2 608801717 JWGMNGOLCOUWFR-FZKQIMNGSA-N 382.554 5.246 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCCC1 609398213 KMWROGKNGPAGHU-INIZCTEOSA-N 397.519 5.668 30 20 GKED C[C@@H]1C[C@@H](C)N(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)C1 610142447 LWXJMWNMBDIVBA-HUUCEWRRSA-N 383.879 5.053 30 20 GKED C[C@@H](NC(=O)C1(c2ccc(Br)cc2)CCCC1)c1cccc(C#N)c1 610362147 BRDPRNFHPYVAPJ-OAHLLOKOSA-N 397.316 5.010 30 20 GKED Cn1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c2ccccc21 613319118 PDPNSTFEBVNTBV-INIZCTEOSA-N 391.883 5.445 30 20 GKED CCCN(Cc1ccccc1F)C(=O)c1cn(CCCC#N)c2ccccc12 618178984 FTXRFWWYDYULJN-UHFFFAOYSA-N 377.463 5.137 30 20 GKED Fc1ccc(-c2nc(CN3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)co2)cc1 618455149 YOXWRLXKCGHBGP-TXEJJXNPSA-N 396.306 5.043 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H]3CCc4cc(C#N)ccc43)s2)cc1 618806061 NIGFYEUBHJHXEG-QKKBWIMNSA-N 389.524 5.337 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1)C(C)(C)C 661760354 SAQDODAZNMHQRY-UHFFFAOYSA-N 377.941 5.268 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1ccccc1Br)c1ccccc1 677564710 CGLCZUMYEOSHEV-UZLBHIALSA-N 384.317 5.473 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2ccc(OC)c(NC(C)=O)c2)cc1 726430081 XEQFDHMTERPDBK-LCYFTJDESA-N 381.472 5.119 30 20 GKED N#Cc1ccc(NC(=S)N[C@H](c2ccc(Cl)cc2)C2CC2)cc1Cl 726445328 UVCXFQFHWYJFHT-KRWDZBQOSA-N 376.312 5.303 30 20 GKED Cc1cc(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)c(C)n1-c1ccc(C#N)cc1 728268234 ITKITEFZICSUFS-UHFFFAOYSA-N 399.281 5.107 30 20 GKED Cc1ccccc1CCC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 729070302 TXZJTPWFBBTAPL-NRFANRHFSA-N 398.462 5.068 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2C(=O)O)c1)c1ccc(F)cc1F 731562848 HYAWULBBVHLCOO-FLIBITNWSA-N 394.373 5.138 30 20 GKED Cc1cc(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c(C)n1C(C)C 739749167 IBCXISAEKUZURC-UHFFFAOYSA-N 377.513 5.216 30 20 GKED Cc1ccc(-c2ocnc2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 741901236 FZXCUCWATAJURR-QFIPXVFZSA-N 393.446 5.558 30 20 GKED C[C@@H]1Sc2sccc2C(=O)/C1=C\c1cccc(NC(=O)C(F)(F)F)c1 742437457 UPDAPFPAYKODCY-LMRAXHDRSA-N 383.416 5.009 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@]23CCc2ccccc23)cc1 743312727 UPVXVBXFWIXWTA-NOOIUNMQSA-N 378.475 5.185 30 20 GKED Cc1cc(CSc2ccccc2C(=O)O[C@H](C)c2ccc(C#N)cc2)on1 748680273 BNVLZAMEXASTDK-OAHLLOKOSA-N 378.453 5.065 30 20 GKED CN(C)C(=O)Sc1ccc(CSCCCOc2ccc(C#N)cc2)cc1 753126488 NLYZDEZYBAAQPZ-UHFFFAOYSA-N 386.542 5.034 30 20 GKED O=C(Nc1cccc(C=NO[C@@H]2CCCCO2)c1)c1ccc(Cl)cc1Cl 755823674 YVUFUYRZHNXVLW-GOSISDBHSA-N 393.270 5.123 30 20 GKED Cc1cccc(Cl)c1NC(=O)CSCc1cc(Cl)ccc1OCC#N 756866892 BWQZHYIJILAMHJ-UHFFFAOYSA-N 395.311 5.076 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 763975149 FKNGDAPBRRSGHR-OAQYLSRUSA-N 395.478 5.611 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccnc(SC(C)(C)C)c1 778721130 CJWTZECOMDRBQZ-AWEZNQCLSA-N 385.558 5.619 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)cn1 792884840 SIJZQYNFFTUQIT-VAWYXSNFSA-N 399.475 5.172 30 20 GKED CC[C@H](NC(=O)[C@@H](C#N)C(=O)c1coc2ccc(C(C)C)cc12)c1ccccc1 805928907 RQJACSCFFRQKBE-FPOVZHCZSA-N 388.467 5.146 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2nc3ccccc3cc2Cl)cc1 810115527 ZNLISOBOUILCMJ-HXUWFJFHSA-N 397.865 5.796 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1sc(-c2ccccc2)nc1C 814821828 MLDUKRYAUIXHTP-UHFFFAOYSA-N 379.489 5.112 30 20 GKED C=CCOc1ccccc1CNc1ccc([C@@H]2C[C@H]2NC(=O)OC(C)(C)C)cc1 864042506 PFTOGWYYBXHYLL-LEWJYISDSA-N 394.515 5.244 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC(c1noc(C)n1)C2 879351925 GWWIIFSTVFDTKX-OALUTQOASA-N 394.519 5.172 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)ccc1OCC#N 914703732 ZGLWYCQZLAWEJA-SDQBBNPISA-N 393.508 5.528 30 20 GKED COc1cc([C@H](C)/N=C/c2cc(Cl)ccc2O)ccc1OCc1ccncc1 915981406 RTBDOZAXHALXNL-SQAVSUBZSA-N 396.874 5.208 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1 916943514 YZICTHIIPXNFIJ-IYKSTZQJSA-N 393.657 5.008 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2)CCC1)c1nc2cc(Cl)ccc2s1 917045900 CFXRRBTWACISRU-OAHLLOKOSA-N 384.863 5.387 30 20 GKED Cc1c(Cl)cccc1N=C1SCCN1C(=O)c1cncc2ccccc12 917565960 YXFJSKQFBDGIQM-UHFFFAOYSA-N 381.888 5.073 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2ccc(-c3ccccc3)o2)SC1=S 917645006 QLDQLFFHNAMHQB-UNOMPAQXSA-N 388.473 5.224 30 20 GKED Cc1cccc(C2(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)CC2)c1 920111090 QLSPALBHLHSXAG-SFHVURJKSA-N 392.911 5.680 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1nc(Br)ccc1F 926478941 FYWOSEPOGSWERG-XJKSGUPXSA-N 376.273 5.069 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2ccc(C(=O)O)cc2)cc1 1776012023 RGDARQBTVZGXCX-SFHVURJKSA-N 382.504 5.816 30 20 GKED CC(C)CC(=NNc1cccc(C(=O)O)c1)c1cccc(Br)c1 1776037113 XGTWQYXNNMUADA-UHFFFAOYSA-N 375.266 5.010 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C/C(=O)c3ccc4c(c3)CCCC4)s2)c1 1776113342 GTTMFTIJPLIXIY-ZRDIBKRKSA-N 388.488 5.888 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2csc(-c3ccc(C(C)C)cc3)n2)C1 1776155960 XXUGVVSAYBYNTM-JOCHJYFZSA-N 384.545 5.176 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2ccccc21 1776308568 DMRYDURDGRJPCR-CRYHJCRISA-N 382.459 6.071 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C\C(=O)c1cc(C(=O)O)ccc1C 1777342041 TVVPTRATGSBGRQ-BENRWUELSA-N 386.447 5.573 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)n1 5642201 YXFOZUHBGSUYGJ-FQEVSTJZSA-N 391.471 5.181 30 20 GKED O/C(=N\c1nnc(C(F)(F)F)s1)c1cc2c(s1)-c1ccccc1CC2 31564604 NPDJTBDMRUXWND-UHFFFAOYSA-N 381.404 5.020 30 20 GKED N#C[C@@H](C(=O)c1ccccc1NC(=O)c1ccccc1)c1nc2ccccc2s1 41500275 DTVNNDGYOCLLFI-KRWDZBQOSA-N 397.459 5.039 30 20 GKED N#C[C@@H](C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nc2ccccc2[nH]1 46440921 SRMMVVJDMFMSBU-LBPRGKRZSA-N 397.278 5.091 30 20 GKED C=CCn1c(SC(c2ccccc2)c2ccccc2)nnc1-c1ccoc1C 60384044 WFYXGRFXDRELJP-UHFFFAOYSA-N 387.508 5.914 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCCc1c[nH]c2ccccc12 78662176 YVFPLGFQAIPEIE-UHFFFAOYSA-N 379.463 5.069 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 108408275 BFFVMNSLTJYCGY-IAGOWNOFSA-N 381.545 5.501 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1nc(-c2ccncc2)cs1 114619047 YULLEXLOTQBIJB-PWRODBHTSA-N 395.487 5.338 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1cccc(OC(F)(F)F)c1 121828753 QNUSJLXXNLKQHM-CYBMUJFWSA-N 394.418 5.018 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccncc1 133491772 AJFTUUKCIUKEJV-MRXNPFEDSA-N 392.528 5.013 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)nn1C 173309027 RNUQXMOKMOWWCY-SFHVURJKSA-N 392.890 5.105 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(SC(=O)N(C)C)cc1 176881085 LAYDVEVKLSEUJC-OAHLLOKOSA-N 385.558 5.467 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@@H]1CCCc2nc(C)sc21)c1ccc(F)c(F)c1 185834917 ZOAQOZIXWLRCKD-QZTJIDSGSA-N 391.487 5.066 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccccc1Cl)C(=O)Nc1ccc(Cl)cc1Cl 193465447 LDMDONYDOUPJDS-OQHXTRMZSA-N 393.657 5.008 30 20 GKED CSC1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 193749209 FGHYGVUCXIOAMB-QGZVFWFLSA-N 385.920 5.013 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 248526892 CZNOLQJYUYAVKJ-QZTJIDSGSA-N 392.503 5.309 30 20 GKED Cc1nc(/C=C\c2ccc(C#N)s2)sc1C(=O)/C=C/c1ccc(C#N)s1 255440776 NVURPHCBZXPSPS-FFELTBSMSA-N 393.518 5.384 30 20 GKED O/C(=N/C[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)C1CCC(c2ccccc2)CC1 329115478 MUFKHIGFPYOKTH-HFPIOELMSA-N 395.503 5.098 30 20 GKED CC(C)c1ncc(N=C(O)C2CCC(/N=C(/O)CC3CCCCC3)CC2)cn1 330117454 XAPASMMTUXZNPE-UHFFFAOYSA-N 386.540 5.674 30 20 GKED CSc1cccc(F)c1C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 409912576 QKOMLWSRADBBKC-HNNXBMFYSA-N 390.483 5.577 30 20 GKED CC(C)(C)c1csc(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C#N 410932254 XMLHSWKVDOHIHF-UHFFFAOYSA-N 397.378 5.097 30 20 GKED CCCOc1ccc(CNC(=O)N[C@H](CCCC#N)c2ccccc2)c(C)c1 431928362 WJVCQCSOIABWNT-JOCHJYFZSA-N 379.504 5.018 30 20 GKED CCN(CC1CCC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 432072890 BKWXRVDABSJTEW-UHFFFAOYSA-N 377.488 5.100 30 20 GKED CC(C)(c1ccc(C(=O)N[C@H](C#N)c2ccccc2Cl)cc1)C(F)(F)F 433861882 GKMUQZKUAVFTNM-MRXNPFEDSA-N 380.797 5.175 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](CC(F)(F)F)C3)cc2)cc1 434136628 HBVJICJYKVSLBZ-HNNXBMFYSA-N 389.377 5.157 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)c(F)c1 441409166 NXZBUPRHBJTEDD-UHFFFAOYSA-N 395.821 5.205 30 20 GKED CCCN(CCCCC(C)(C)C#N)CC(=O)Nc1ccc(Cl)cc1Cl 444582203 IZCIJSOUYWPVMN-UHFFFAOYSA-N 384.351 5.364 30 20 GKED COc1cccc([C@H]2C[C@@H](C)CN2C(=O)Nc2ccc(CC#N)cc2Cl)c1 455725138 CXYICYAZHZCEHZ-JLTOFOAXSA-N 383.879 5.030 30 20 GKED Cc1cc(Br)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)s1 457583340 RHOYOUKIUXXMHE-SNVBAGLBSA-N 395.347 5.323 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458798739 IKSOBGNVCYRSEI-LAUBAEHRSA-N 383.923 5.348 30 20 GKED Cc1cc(F)ccc1C1CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC1 458854376 XMCNPVZSCDUCKV-HSZRJFAPSA-N 393.506 5.458 30 20 GKED N#Cc1cccnc1-n1cc(NCc2ccc(-c3ccccc3Cl)s2)cn1 461424742 WVOLQGZUYKUQGK-UHFFFAOYSA-N 391.887 5.133 30 20 GKED CC(C)C[C@H]1CCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 465317977 OVOQJPNIRRIOMS-HXUWFJFHSA-N 378.541 5.359 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(Cl)c1)c1nc(-c2c(F)cccc2F)cs1 465418815 UYJWXELGDQZXCW-LBPRGKRZSA-N 392.789 5.371 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)c(Br)s1 471265571 QYMHPJXVDGSTHK-UHFFFAOYSA-N 381.320 5.077 30 20 GKED N#Cc1cc(Cl)ccc1CN1CCC[C@H](c2nc(C(F)(F)F)cs2)C1 480893267 CSGYZCIVPSGTTN-LBPRGKRZSA-N 385.842 5.067 30 20 GKED C=CCn1c(SCc2cn3cc(Cl)ccc3n2)nnc1-c1ccccc1C 481388789 GHKVPQSTKWMRKF-UHFFFAOYSA-N 395.919 5.033 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2cccs2)Cc2cccs2)cc1 481903054 XMNGNEGMEKHOPE-UHFFFAOYSA-N 384.551 5.002 30 20 GKED C[C@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1cc2ccccc2o1 482125862 WBBUDVPQONWHIO-AWEZNQCLSA-N 387.464 5.094 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)oc2c1ccc1ccccc12 483196708 DKNYPBDXVOSYBI-OAQYLSRUSA-N 376.415 5.933 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(OC2CCC2)c(F)c1 483518605 MRMUXOLOOKKVDH-TZIWHRDSSA-N 393.462 5.061 30 20 GKED N#Cc1ccc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)s1 487215545 MLMHZNLJVPBVDI-UHFFFAOYSA-N 380.281 5.302 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(C(F)(F)F)cc1Cl)c1ccccc1 487284856 FYQZUHFVDKBVFQ-KRWDZBQOSA-N 380.797 5.524 30 20 GKED C=C(C)Cn1c(SCC(=O)c2ccc(C(C)C)cc2)nnc1-c1ccncc1 489409984 SWMJCRIOSDMFLZ-UHFFFAOYSA-N 392.528 5.015 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(-c2ccccc2)s1 499290444 SWCIXZRIOGYSMD-CQSZACIVSA-N 375.478 5.218 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCC1CCC(F)(F)CC1 501223507 TZNSBGCERMMODU-UHFFFAOYSA-N 386.467 5.265 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)N[C@H](C#N)c2ccccc2Cl)C1 501728261 UBWUVTGNBMDQAL-MBOZVWFJSA-N 376.928 5.177 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]3c3ccc4ccccc4c3)CC2)cc1 503843783 TXPZDLAIWQIAMR-DQEYMECFSA-N 378.475 5.131 30 20 GKED C[C@@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccccc1-c1ccc(Cl)cc1 504428286 XYHTWHSQSFJDBI-MRXNPFEDSA-N 381.907 5.403 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2ccccn2)cc1 506857697 MXAZIKGACZIDCL-UHFFFAOYSA-N 386.455 5.188 30 20 GKED COC1(c2noc(C3(c4cccc(C#N)c4)CC3)n2)CCC(c2ccccc2)CC1 508644716 GPGOAZAWAHMKKU-UHFFFAOYSA-N 399.494 5.221 30 20 GKED C=CCn1c(SCc2cc(-c3ccc(C)cc3)no2)nnc1-c1ccccc1 508869657 YJOWLGULHCORBX-UHFFFAOYSA-N 388.496 5.387 30 20 GKED C[C@H](Sc1ccc(C#N)cc1)C(=O)N(Cc1ccccc1)Cc1ccccc1 509653193 NQKAEQJLUSIWEM-IBGZPJMESA-N 386.520 5.268 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 517455214 VEOZLNKNHAQBAK-AWEZNQCLSA-N 393.537 5.623 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)c1ccc(Cl)cc1 520117756 INGZHKXYWSQMHR-NWDGAFQWSA-N 390.961 5.583 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524138338 KUNSULFMUZSZLA-SFHVURJKSA-N 388.467 5.171 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)F)c1cc(F)ccc1F 525549906 CFNVILVMJNDTRD-UHFFFAOYSA-N 397.315 5.593 30 20 GKED C=CCN(C(=O)c1cccc(-c2ccccn2)c1C)c1nc2c(s1)CCCC2 534383567 TXWYCPRFWMMCLE-UHFFFAOYSA-N 389.524 5.225 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 535324638 GNFJRUAGMWIXDW-OAQYLSRUSA-N 381.863 5.062 30 20 GKED CSc1cccc([C@H](NCc2ccc(C#N)s2)c2ccc(F)c(F)c2)c1 537328828 GIEJOVGWUTUGBR-FQEVSTJZSA-N 386.492 5.499 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(OCCN(C)C)c1 538113472 HIEPAURAUSLPMV-HXUWFJFHSA-N 399.538 5.016 30 20 GKED C=CCN(C(=O)c1cc(C)n([C@H](C)CC)n1)c1nc(-c2ccccc2)cs1 538689674 BAWYVKGRPIGWQP-OAHLLOKOSA-N 380.517 5.119 30 20 GKED C[C@@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)n1cnc2ccccc21 541133109 QQOCEKJBFDUMQA-MSOLQXFVSA-N 394.478 5.013 30 20 GKED CC(=O)Nc1ccccc1-c1noc(-c2cccc(Oc3ccc(C#N)cc3)c2)n1 546958136 MDNCTOHZQQDJIH-UHFFFAOYSA-N 396.406 5.026 30 20 GKED CC(C)(C)[C@@H](CC1CCCCC1)NC(=O)N1CCC(C#N)(c2ccccn2)CC1 554602202 WKOCTYKDZGEFOW-OAQYLSRUSA-N 396.579 5.033 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccc(F)cc1 557553141 AJKZFIQOBOJJHA-QGZVFWFLSA-N 399.535 5.069 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1cccc2ccccc12 562198380 CEGFIBOJAXAEPJ-LJQANCHMSA-N 390.531 5.466 30 20 GKED CCCCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C1CCCCC1 569326202 MIJWKZCFKYCBCX-UHFFFAOYSA-N 377.488 5.321 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)C[C@@H]1CCOc2ccccc21 572757484 UBNCCOXMDFATST-FQEVSTJZSA-N 382.463 5.048 30 20 GKED Cc1ccc(C)c2sc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)nc12 589837691 VYNIDCCAYJPCMT-UHFFFAOYSA-N 376.268 5.344 30 20 GKED O=C(Nc1cccc(C#Cc2ccccc2)c1)N1CCCO[C@H](c2ccccc2)C1 591835502 GKUGGYMBHXBLKC-VWLOTQADSA-N 396.490 5.082 30 20 GKED Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3C#N)cc2[N+](=O)[O-])cc1 598544397 WYKUVSCIHZAQIO-UHFFFAOYSA-N 389.436 5.178 30 20 GKED Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1N[C@H](C)c1cccc(C#N)c1 600847261 BERWZSLQDOXPDZ-ZHALLVOQSA-N 375.516 5.158 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H](c3cccs3)C3CC3)cc2)cc1 604461403 UUDUMSWQDHLGPE-NRFANRHFSA-N 389.480 5.685 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)N1CCC(C(F)(F)F)CC1 608300772 GLIHGERCFNVSID-UHFFFAOYSA-N 390.274 5.147 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609031077 AEIYTAHCBDHXND-ZWKOTPCHSA-N 385.294 5.183 30 20 GKED CCN(C(=O)[C@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 609432396 JCSMSFQLCONXAX-SFHVURJKSA-N 385.467 5.204 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)NC2(c3ccccc3F)CC2)cc1 609865184 JIYGINPTSANRLN-UHFFFAOYSA-N 390.389 5.048 30 20 GKED Cc1cccc([C@@H](C)C(=O)N[C@H](C#N)c2ccc(OCc3ccccc3)cc2)c1 610063325 OTKZQOAZXKTGOG-NTKDMRAZSA-N 384.479 5.059 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCc2ccccc2F)cc1)c1cccc(C#N)c1 610323093 YYCBRKXGTJINCA-MRXNPFEDSA-N 389.430 5.159 30 20 GKED Cc1ccc(NC(=O)CSc2ccc(Cl)cc2C#N)c(Br)c1 610655141 RDVCCKSSSMIXFI-UHFFFAOYSA-N 395.709 5.013 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)Nc2c(O)cccc2F)cc1Cl 611190862 CCNRSIRSGPJTCI-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1cc2c(ccc3ccccc32)o1 611438290 HELFAQOXBYFIJV-KRWDZBQOSA-N 396.494 5.172 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1ccc(C(F)(F)F)cc1 612145471 FMZBSDPIYRFRLS-HKUYNNGSSA-N 379.426 5.048 30 20 GKED CC(C)C[C@H](C#N)NC(=O)c1c(F)cccc1Sc1ccc(Cl)cc1 613189664 RCRVUHVPGQXQSY-CQSZACIVSA-N 376.884 5.298 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccccc1OC(C)C 615859161 SGONELJTYJYVHF-UHFFFAOYSA-N 378.925 5.087 30 20 GKED COc1ccc(CNc2ccc(C(F)(F)F)c(OC)c2)cc1OCCCC#N 619199943 RPDCZHSQMUSIBQ-UHFFFAOYSA-N 394.393 5.017 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)ccc1F 675737358 GAALXMNSIMOKSV-UXCLJVHYSA-N 375.303 5.525 30 20 GKED Oc1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc2cccc(F)c12 676027255 ULSSRNXMBNSVOJ-UHFFFAOYSA-N 376.231 5.179 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccc(OC(C)C)cc1 726431196 QUHVDQLFQHCZGZ-UHFFFAOYSA-N 379.529 5.134 30 20 GKED CC(C)(C)CCCC(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 729070753 XPLFXMWIQXQIPA-SFHVURJKSA-N 378.472 5.343 30 20 GKED CC(C)COc1ccc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 730170907 LUSALSHEOGPOFR-VWLOTQADSA-N 398.506 5.558 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)Nc3ccc4ccccc4c3)cc2)c1 731320960 ZEDMLEALDFJCRF-UHFFFAOYSA-N 395.487 6.313 30 20 GKED C[C@H](CSc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 732496133 NWOJQKDHUBCZAZ-UKRRQHHQSA-N 385.439 5.036 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2ccccc2)cc1)c1ccc(Br)cc1 733253759 OTYVAHQQONWJTG-HXUWFJFHSA-N 391.268 5.111 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc(Cl)cc3F)c2)s1 740426782 FJWMWBVNPQMSSC-UHFFFAOYSA-N 385.851 5.401 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)cc1OC 742377620 ORQKUKBYECUUAP-QHCPKHFHSA-N 392.886 5.108 30 20 GKED Oc1nc2ccccc2cc1C=Nc1ccc(Oc2ccc(Cl)cn2)cc1 743044802 RKDGMWCKVHSXKT-UHFFFAOYSA-N 375.815 5.532 30 20 GKED Cc1ccc2c(CCC(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c[nH]c2c1 745952940 OEPMADRBZKERSN-INIZCTEOSA-N 377.444 5.034 30 20 GKED Cc1cc(OCCCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)ccc1Cl 747198656 JJIZLNNYYRRVAH-HNNXBMFYSA-N 376.909 5.264 30 20 GKED Cc1ccccc1-c1cc(C(=O)O[C@H](C)C(C)(C)C#N)c2cnn(C(C)C)c2n1 753621702 YPUVFUKIZWSMBC-MRXNPFEDSA-N 390.487 5.083 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 756277013 VLCUKYDWZBYNNI-IAQYHMDHSA-N 388.464 5.179 30 20 GKED CCCOc1cccc(CC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 762995083 MNNCBNHDYJELNW-MRXNPFEDSA-N 384.888 5.157 30 20 GKED N#CCOc1ccc(CNC2(c3cccc(Br)c3)CCCCC2)cc1 763605487 URRLAKZFBIJPOL-UHFFFAOYSA-N 399.332 5.301 30 20 GKED Cc1ccsc1CCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F 764751928 IUOQMZUGJBPNBO-UHFFFAOYSA-N 398.315 5.093 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(SC)c(OC)c2)cc(OC)c1OC 772947399 RSJIUVUCRNUGIX-HNNXBMFYSA-N 387.545 5.014 30 20 GKED C#CCCCCCC(=O)O[C@@H](C)c1nnc(-c2ccc(Cl)cc2Cl)o1 780264243 MYIOTCHRPKYUQT-LBPRGKRZSA-N 381.259 5.231 30 20 GKED CCC[C@@H]1C[C@H](C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 780314228 FTAGTQFXIFWFBP-BNOWGMLFSA-N 396.434 5.087 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(F)cc1OC1CCCC1 780599921 MZYXIRXRNBFMAV-CQSZACIVSA-N 383.423 5.082 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccccc2)o1 784831707 PMMWUBIASAMUMS-IBGZPJMESA-N 380.403 5.061 30 20 GKED Cc1cc(F)c(Br)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 788679712 IVSNQLDAPIHGSU-UHFFFAOYSA-N 398.688 5.231 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792092888 FFPOZMFJJDAGJJ-VUVZNRFTSA-N 380.369 5.533 30 20 GKED C[C@@H](NCc1cccc(Br)n1)c1ccc(-c2cccc(C#N)c2)cc1 794477147 HMROQUDQUVZXKC-OAHLLOKOSA-N 392.300 5.234 30 20 GKED COc1cc(C=NOCc2nc(-c3ccccc3Cl)cs2)cc(OC)c1 794727857 QQBOWIKVIQMNIJ-UHFFFAOYSA-N 388.876 5.031 30 20 GKED CC(C)(Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797573075 OAIYPSDODBXQBH-AWEZNQCLSA-N 376.909 5.128 30 20 GKED Cc1cc(-c2cc(C(=O)OCC(C)(C)CCC#N)c3c(C)noc3n2)c(C)s1 798878392 YACRBYCFHIGGFP-UHFFFAOYSA-N 397.500 5.363 30 20 GKED C=CC[C@H](NC(=O)c1cc(Br)c2ccccc2c1)c1ccncc1 815623151 OYYGVWNWVKFUSK-IBGZPJMESA-N 381.273 5.045 30 20 GKED CC(C)CN(CCC#N)C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 842479556 UCSPFIKMMXOPGC-UHFFFAOYSA-N 391.490 5.305 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(Br)cc1)c1cc(C#N)ccn1 902966094 YZPHBZMZTMEQHG-BDJLRTHQSA-N 398.226 5.060 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C)n(-c2ccccn2)c1C 914847203 YJCYIZVWCLQZMW-UHFFFAOYSA-N 385.920 5.032 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3c(Cl)n2)cc1 915179495 PSXRSCBBIXTXLU-NRFANRHFSA-N 397.865 5.796 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(N3CCCCC3)cc2)ccc1OC(F)F 916127040 XEWZHCHQMCSYHR-XFFZJAGNSA-N 387.426 5.183 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCC(=O)c3cccs3)n2)cc1 916627221 GYXQJYCGQLYYKP-HNNXBMFYSA-N 380.494 5.019 30 20 GKED Cc1cccc(C)c1OCCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 917046795 MRUNLJASUBUMNO-HNNXBMFYSA-N 384.888 5.212 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)Nc1cccc(OCCCC#N)c1 918331337 PSMUSUZPQIFZCD-UHFFFAOYSA-N 379.485 5.091 30 20 GKED CC(=NNc1nc2ccccc2[nH]c1=S)c1sc2ccccc2c1C(=O)O 1776093003 RXLBIEADNUOWFN-UHFFFAOYSA-N 394.481 5.041 30 20 GKED Cc1cc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)c(C)s1 1776133430 WQFLXCQVTJQVLD-DHZHZOJOSA-N 376.477 5.555 30 20 GKED C=C(C)C[C@H](NCc1ccccc1Oc1cc(Cl)cc(Cl)c1)C(=O)O 1776139094 FQYWUDCPQBZURV-KRWDZBQOSA-N 380.271 5.295 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)c1cccc(OCC(=O)O)c1 1776807948 FONGZZNSQKDKLO-OUKQBFOZSA-N 378.424 5.135 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)ccc1SC 1777263362 KOQKJGVTWKNMNA-CSKARUKUSA-N 394.448 5.271 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1ccc(C(=O)O)cc1Cl 1777488221 GIAHKVRYTFWHCG-KTKRTIGZSA-N 383.856 5.366 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2cc(Br)cc(C(F)(F)F)c2)c1 1777684961 PKLFPBDHLXWJMC-PLNGDYQASA-N 399.162 5.062 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3cccs3)cc2)CCC1 1787275126 IJGWHHZASHJGCW-LJQANCHMSA-N 394.540 5.264 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)sc2cccc(F)c12 19683058 MERITGSUKQKIAH-UHFFFAOYSA-N 393.468 5.596 30 20 GKED OC1=Nc2c(Cl)cc(Cl)cc2/C1=N\Nc1ccnc2cc(Cl)ccc12 24035833 DBTNGPSYGAYWJI-UHFFFAOYSA-N 391.645 5.613 30 20 GKED Cc1cc(C)c(C(=O)/C(=C(\S)N[C@@H]2CCCC[C@H]2C)[n+]2ccccc2)cc1C 27489585 BOGXOFBSUMPMIU-IIBYNOLFSA-O 395.592 5.006 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 29202851 XNZNHOBGLRTJKN-UHFFFAOYSA-N 395.459 5.114 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2ccc3c(c2)CCC3)cc1 55823716 XIEGFOASLQJPDN-UHFFFAOYSA-N 396.490 5.002 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(Br)cc1Cl 56213159 SINHFDPCPQOKBG-UHFFFAOYSA-N 393.668 5.014 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 61068880 WRZWTQGIJMRFBZ-NSHDSACASA-N 389.933 5.502 30 20 GKED C[C@@H](SCC(=O)N(CCC#N)c1cccc(Cl)c1)c1ccc(F)cc1 62697516 DMDACNQDRRVDKK-CQSZACIVSA-N 376.884 5.220 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 72041245 ZXSIELKXZNMPBL-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCCCc1noc([C@@H](C)Nc2cc(C(F)(F)F)ccc2SCCC#N)n1 108408671 BVAIRWXCGDVGEY-GFCCVEGCSA-N 398.454 5.610 30 20 GKED C=CCc1cc(CNc2cccc(COCc3ccco3)c2)cc(OC)c1O 114763559 VOGOXDALDQBXRI-UHFFFAOYSA-N 379.456 5.051 30 20 GKED COc1cc(C(=O)/C=C/c2cnn(-c3ccc(Cl)cc3)c2)ccc1SC 116227303 NXODKYSNGOKTLP-YCRREMRBSA-N 384.888 5.152 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(CCC(F)(F)F)c1 124481289 RMZDYDQKNDBCBP-UHFFFAOYSA-N 387.405 5.273 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccccc2F)o1 128723224 IJXKXCSTBSEVFF-GOSISDBHSA-N 398.393 5.200 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1cccnc1 133962616 UTLCYFNLZXXJMX-INIZCTEOSA-N 392.528 5.013 30 20 GKED N#Cc1cc(CN[C@H](c2ccccc2C(F)(F)F)C(F)(F)F)ccc1F 183338193 TUSZTQXEJMWVCI-OAHLLOKOSA-N 376.275 5.109 30 20 GKED Cc1cc(C#N)ccc1CN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 186320420 ICYMLVIXXFSJNI-KRWDZBQOSA-N 387.458 5.109 30 20 GKED C=CC[C@H](C(=O)N[C@H](C)c1ccc(NC(=O)N(CC)CC)cc1)c1ccccc1 186746271 WPVGCMYJPIQMCH-GCJKJVERSA-N 393.531 5.097 30 20 GKED C=CCOc1ccc(CN(C(=O)C[C@H](C)c2c(C)noc2C)C(C)(C)C)cc1 188079652 QYWCGDWLMHYIIP-INIZCTEOSA-N 384.520 5.177 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(NC(=O)OCC)cc1 191469415 KGWDZHWOBPNVLE-UHFFFAOYSA-N 381.476 5.751 30 20 GKED COc1cc(CNCc2cccc(C#N)c2)ccc1OCc1ccc(Cl)cc1 237108322 OHVUTGNZBODKTA-UHFFFAOYSA-N 392.886 5.089 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)/C=C\c1cnc(C(C)(C)C)s1 255202880 CNYLDLOSVOJPGI-CFYYFVFUSA-N 385.558 5.344 30 20 GKED C[C@H]1CCN(C(=O)CSc2ccc(C#N)cc2)c2cc(Cl)ccc2S1 303135178 BZPCJWNHQKPHOJ-ZDUSSCGKSA-N 388.945 5.221 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 303336207 XOGDJLMYNVCMLE-SJORKVTESA-N 396.556 5.642 30 20 GKED CC(C)(C)c1ncc(/C=C2/CCOc3cc(Br)ccc3C2=O)s1 303758312 KBTPSTRBMFPINS-FLIBITNWSA-N 392.318 5.252 30 20 GKED Cc1ccccc1N=C(O)[C@@H](C)N1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1 329227547 ADAUSTWNXCSBNW-IEBWSBKVSA-N 395.551 5.017 30 20 GKED CC(C)(C)/N=C(/O)c1cccc(N=C(O)N2Cc3ccccc3C3(CCC3)C2)c1 329503042 YYNXTEXNKUHNAU-UHFFFAOYSA-N 391.515 5.273 30 20 GKED Cc1ccc2oc(N3CCC[C@H](c4n[nH]cc4N=C(O)C4CCCC4)C3)nc2c1 329579743 WQYLCCUPDYBXDO-INIZCTEOSA-N 393.491 5.022 30 20 GKED OC(=Nc1ccccc1)c1cc(N=C(O)N2CC[C@@H]3CCC[C@@H]32)ccc1Cl 330231076 DUXVALVDEXMTTI-LIRRHRJNSA-N 383.879 5.396 30 20 GKED Cc1ccc(Br)cc1N=C(O)c1sc([C@@H]2CCCOC2)nc1C 330265625 ZMFDOQMLBFTMQC-GFCCVEGCSA-N 395.322 5.053 30 20 GKED Cc1nc(C(O)=Nc2cc(C(C)(C)C)sc2C#N)c(Br)s1 331308633 BJAGRDLRMVAKJT-UHFFFAOYSA-N 384.324 5.081 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc23)c1 409779504 KXVORQCHGYABTA-ROUUACIJSA-N 378.378 5.055 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3ncsc3C(F)(F)F)c(C#N)c21 411015038 PZQBQFIUDUSPIO-SFYZADRCSA-N 385.436 5.033 30 20 GKED N#CCCn1ncc(C(=O)N2CCCC3(CCCCC3)CC2)c1-c1ccccc1 429026243 HNHNUCRQHOMQRO-UHFFFAOYSA-N 390.531 5.040 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3ccc(Oc4ccncc4)c(Cl)c3)CC2)cc1 436340604 GHDDVTKHBNLNOI-UHFFFAOYSA-N 389.842 5.069 30 20 GKED CCCOc1ccc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c(C)c1 437890087 ORYLOCOWXQLLPW-UNMCSNQZSA-N 377.488 5.088 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)cc1C 439373137 SUDVYAQXESCVPU-KRWDZBQOSA-N 385.895 5.377 30 20 GKED CC(C)c1ccc(-c2nc(CN(C#N)c3ccc(F)c(C#N)c3)cs2)cc1 439703356 ADYMKFBPJTYFSA-UHFFFAOYSA-N 376.460 5.432 30 20 GKED Cc1nc(-c2ccccc2)c(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)s1 443885184 ZYWXPWFXTYDZBG-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C[C@H]1c2cc(Cl)cc(Cl)c2CCN1Cc1nnc(-c2cccc(C#N)c2)o1 446727274 BWBXFQVYBPGEKM-LBPRGKRZSA-N 399.281 5.034 30 20 GKED CC[C@H](NCc1cccc(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 447544663 VJLLJPYYUUNAOL-QHCPKHFHSA-N 375.516 5.318 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1OC(F)F 460255342 HAJIDSYQZUAXDW-UHFFFAOYSA-N 393.821 5.257 30 20 GKED C[C@H](C(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1)c1cccc(C#N)c1 462002170 WKUHYTKYIKFQFU-INIZCTEOSA-N 389.886 5.566 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(C3CC3)CCOCC2)cc1Cl 462419278 AYYXFCYOONBAII-FQEVSTJZSA-N 394.902 5.141 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 464272709 PHGJSPOGRNHOOS-LLVKDONJSA-N 382.769 5.075 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2ccccc2)c1)c1cc(C(F)(F)F)ccn1 464412920 UTDYVKWZQWLECV-SFHVURJKSA-N 382.341 5.383 30 20 GKED COc1ccc(-c2ccc(CNC(=O)Nc3ccc(C(C)(C)C#N)cc3)cc2)cc1 466256019 SVGBJWPOSPZIAJ-UHFFFAOYSA-N 399.494 5.485 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Oc3ccccc3)ccn2)cc1C(F)(F)F 467098325 YZLYZZDEOJCQGQ-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@@H](c1c(F)cccc1F)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 468758438 AEZIZKLZPUMDIH-HNNXBMFYSA-N 381.426 5.056 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)[C@@H](C)c1ccccc1C(F)(F)F 476503048 AXKIBXYYAIPNOM-SOLBZPMBSA-N 388.433 5.401 30 20 GKED CC(C)c1csc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)n1 478597626 ZDRMKLKSEXICBC-UHFFFAOYSA-N 392.484 5.252 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1Br 479777233 OQVQSURZCIYVDE-UHFFFAOYSA-N 385.714 5.384 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@@H]1CCCO[C@H]1c1ccc(C)cc1 485460242 CMOVRFQHKDJIJF-UGKGYDQZSA-N 381.541 5.171 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC[C@@H](c2nc3ccc(F)cc3o2)C1 485485634 CMBBTBCTBMAFNO-OAHLLOKOSA-N 396.487 5.265 30 20 GKED O=[S@@](Cc1cccc(C(F)F)c1)Cc1cc(F)c(C(F)(F)F)cc1F 488836716 JFMFSNXBDZZAJT-VWLOTQADSA-N 384.316 5.370 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(OCc2ccccc2C#N)c1 493624515 XMNRBZDICMTVFE-KRWDZBQOSA-N 388.442 5.110 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1sc2c(c1C#N)CCCCC2 494021741 ZJBBIWBOTYXNNX-UHFFFAOYSA-N 383.498 5.166 30 20 GKED C=C(C)COc1cccc(NC(=O)Nc2cccc(COCc3ccco3)c2)c1 502425732 PNFJXNNOLVMRSU-UHFFFAOYSA-N 392.455 5.595 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1 505057106 GVMTWFREYZYTBK-HNNXBMFYSA-N 394.450 5.185 30 20 GKED N#C[C@@H](NC(=O)c1cnc(-c2ccsc2)s1)c1cccc(Cl)c1Cl 505348835 IQADVJQDGIZMTA-GFCCVEGCSA-N 394.308 5.173 30 20 GKED C[C@H]1CCC[C@H](CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 508248137 OBVSNCAAUYRMLU-PXNSSMCTSA-N 378.541 5.407 30 20 GKED CCOc1ccccc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 508459837 WPOFDPJNKFDUJU-UHFFFAOYSA-N 388.423 5.010 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1ccccc1F 510384117 ZDAZJFSUIZWKKB-UHFFFAOYSA-N 375.403 5.120 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(Cl)ccc3C)n2)cc1 511906329 UTRGIZSAPQKKDW-KRWDZBQOSA-N 382.872 5.271 30 20 GKED Cc1cccc(Oc2cc(CN[C@H](C)c3ccc(C#N)cc3F)ccn2)c1C 512641172 DVIACWPOKXLYTM-QGZVFWFLSA-N 375.447 5.352 30 20 GKED Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2cc(C#N)ccc2Cl)cc1 513275444 FKNJWERXSSROOC-UHFFFAOYSA-N 378.863 5.082 30 20 GKED CC(C)Cn1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 513715066 LGDJQRDARKEEOQ-HXUWFJFHSA-N 392.890 5.100 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccc(Br)o3)no2)c2ccccc21 515359841 JFOOCTDAPHIALX-UHFFFAOYSA-N 397.232 5.018 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1 521243946 CLZSRSCDAFEJBY-UHFFFAOYSA-N 391.361 5.207 30 20 GKED C[C@@H](SCc1cccc(C(=O)NCc2ccco2)c1)c1ccc(C#N)cc1 522840547 QNQFBRBLMSROPK-MRXNPFEDSA-N 376.481 5.076 30 20 GKED N#C[C@@H](Sc1nnc(Cc2cccs2)n1-c1ccccc1)C1CCCCC1 524535358 BOBLEYVFCKMGBQ-LJQANCHMSA-N 394.569 5.484 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(-c2noc(CC(C)(C)C)n2)cc1 525054741 BBFMRVMRMROZFX-UHFFFAOYSA-N 396.535 5.117 30 20 GKED N#Cc1cccc(CN2CCC(OCc3ccc(Cl)c(Cl)c3)CC2)c1 531868025 LGXRIUFGDLWHED-UHFFFAOYSA-N 375.299 5.046 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1CCC(F)(F)F 535467664 FNVVAXSIYCSNLJ-CQSZACIVSA-N 392.446 5.686 30 20 GKED O=[N+]([O-])c1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(F)c1 538321514 MLTOUPBJBYYFEA-CQSZACIVSA-N 396.262 5.146 30 20 GKED C[C@@H](NC(=O)Nc1scnc1C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 542960066 LCHLIMRDUYCGSD-CQSZACIVSA-N 388.496 5.442 30 20 GKED N#CC[C@@H](Cc1nc(-c2cc(F)ccc2C(F)(F)F)no1)c1ccccc1 558301561 LJOFGTMQAQLEBR-ZDUSSCGKSA-N 375.325 5.134 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(COCc2ccccc2)no1 561880159 KFTWJHULOXFTBK-UHFFFAOYSA-N 390.361 5.037 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(-c2ccccc2)ns1 576968276 IOJHXJFICKQCAP-UHFFFAOYSA-N 395.532 5.198 30 20 GKED C[C@@H]1CCc2onc(C(=O)[C@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)c2C1 577582991 PUZFDCCTMLEWBC-ABAIWWIYSA-N 397.887 5.066 30 20 GKED CCN(CC(=O)Nc1c(Cl)cccc1Cl)[C@H](C#N)c1ccc(Cl)cc1 585717746 XAEZBSROWWNXED-MRXNPFEDSA-N 396.705 5.172 30 20 GKED CCc1cc2c(=O)n(CCc3ccccc3)c(SCCCCC#N)nc2s1 592053649 MNFSCAJUVWYEFF-UHFFFAOYSA-N 397.569 5.049 30 20 GKED C[C@@H](CSc1ccccc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 593406651 KFAGOGLTUCPOKD-RXVVDRJESA-N 381.545 5.244 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3ccc4ccccc4c3)c2)c1 603995557 MJWMPESFGHIQGP-UHFFFAOYSA-N 391.430 5.216 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1nc(C(C)(C)C)no1 604046693 KZYOSGYAQWXJEM-ZDUSSCGKSA-N 396.878 5.858 30 20 GKED C=CC[C@@H](C)NC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 605129659 MDNUWJMIVOAXDB-GFCCVEGCSA-N 392.286 5.332 30 20 GKED Cn1ccc2c(C(=O)N(Cc3ccc(C#N)cc3)Cc3cccc(F)c3)cccc21 608877542 KDWKHYVSNRHBEG-UHFFFAOYSA-N 397.453 5.032 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(C(F)F)cc3)cc2)c1 609064917 SBGGJCINRNJBGK-UHFFFAOYSA-N 378.378 5.327 30 20 GKED CCCCCN(Cc1ccc(F)cc1)C(=O)c1cc2ccccc2n1CC#N 609162933 YDYGELVKZPVFJZ-UHFFFAOYSA-N 377.463 5.137 30 20 GKED COc1cc(C2(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)CC2)ccc1C 609176472 MHLDBWMUPWPXEE-UHFFFAOYSA-N 398.462 5.338 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609306614 YEBADPXJRBCFMS-CQSZACIVSA-N 380.444 5.384 30 20 GKED CC(C)c1nc(CCNCc2cccc(OCc3ccccc3C#N)c2)cs1 609433312 UHFFCVZLQSRQQA-UHFFFAOYSA-N 391.540 5.049 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@@H]3CCCOc4ccccc43)cc2)cc1 609502812 DSQOCNWBCZXKCS-HSZRJFAPSA-N 398.462 5.189 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CNc3cccc(Cl)c3)cc2)c1 609622446 QTGYUECIXBRURG-UHFFFAOYSA-N 377.831 5.055 30 20 GKED C[C@H](Oc1ccccc1NC(=O)[C@@H](C)Oc1ccccc1C#N)c1ccccc1 609652446 ZDZNNMQFBKCAKC-ZWKOTPCHSA-N 386.451 5.104 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N[C@H](C)c1cccc(C#N)c1 610361832 LDZRODHPFRXFDM-VXGBXAGGSA-N 379.312 5.223 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@@](C)(C#N)C1 612305164 JXWRAPMPNAGWRR-MBSDFSHPSA-N 377.488 5.293 30 20 GKED COc1cccc([C@H](C)c2noc(/C=C/c3cn(CCC#N)c4ccccc34)n2)c1 612917851 QYZXUEDGLGQFOG-FLVLSHQESA-N 398.466 5.269 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)N(CCC#N)CC3CC3)c2cc1C 728870618 TUOVFQIAVJIUFA-UHFFFAOYSA-N 383.495 5.285 30 20 GKED N#C[C@H](C(=O)CCCCCc1cccs1)c1nc(-c2ccccc2)cs1 731546756 RUTNBMAPIAVSJZ-GOSISDBHSA-N 380.538 5.851 30 20 GKED CC(C)(C)c1cnc(COC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 733495199 KGPBTHJHUPLJBK-UHFFFAOYSA-N 390.439 5.187 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2c[nH]c3ccc(F)cc23)cc1 734318413 UQYORHUAVVOHLG-QFIPXVFZSA-N 383.426 5.144 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccnc2Cl)c1 735032016 PBEOCQLFLIMDDX-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc(NC(=O)[C@H](C)SCc2cc(Cl)ccc2OCC#N)c(C)c1 735317514 BVOSDKFMINZIRF-HNNXBMFYSA-N 388.920 5.120 30 20 GKED C[C@H](SCc1cc(Cl)ccc1OCC#N)c1nc(-c2cccs2)no1 735318978 TXFZQKGVHRLCHV-NSHDSACASA-N 391.905 5.348 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)OC(=O)c1ccccc1OCC#N 739300936 JNWCXTGYHSDCEC-AWEZNQCLSA-N 396.443 5.078 30 20 GKED Cc1cccc2c(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)c[nH]c12 741178905 VLRVXPXLECYKFB-HSZRJFAPSA-N 379.463 5.313 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(CC#N)c3ccccc3)cs2)cc1 745353653 FZSPEQPDOPIIQH-UHFFFAOYSA-N 375.497 5.033 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 750391218 DQPJHTRZJZHTDW-HXUWFJFHSA-N 390.826 5.093 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C/c3cc(C(F)(F)F)ccc3Cl)ccc21 754690414 VFKQGUWRVIHZOJ-FPYGCLRLSA-N 393.792 5.164 30 20 GKED C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cc(Br)cc(Cl)c1O 756855934 HYZCZUVKXXOXSI-LLVKDONJSA-N 391.696 5.020 30 20 GKED Cc1cccc(C)c1CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 765948072 YYYVDNSQAHIDBF-UHFFFAOYSA-N 399.494 5.270 30 20 GKED C#CCOc1ccccc1NCc1cccc(NC(=O)c2ccccc2Cl)c1 775365218 RRNRLZLFBPMSAI-UHFFFAOYSA-N 390.870 5.216 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc3oc(CCOC)nc3c2)cc1 777122739 JCNDSOYPGPHYPB-OAHLLOKOSA-N 386.879 5.321 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC2CCC2)c2ccccc2)c1 778669769 KOGBARYNRAUNDU-FYYLOGMGSA-N 391.515 5.098 30 20 GKED CC(C)Oc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)c(Cl)c1 780583563 QRKACSFPIYBKHL-UHFFFAOYSA-N 394.906 5.516 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1ccc(-c2ccccc2)o1 782246037 TYMAPTOOWWIDPI-UHFFFAOYSA-N 392.509 5.001 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccccc2)o1 784831708 PMMWUBIASAMUMS-LJQANCHMSA-N 380.403 5.061 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@@H](C#N)c2nccc3ccccc23)C1 792102799 JLXCBSJTAGEYRU-KAGYGMCKSA-N 378.516 5.567 30 20 GKED CSc1cccc(F)c1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 798446551 HWIGKMGUBBXYRW-UHFFFAOYSA-N 382.485 5.078 30 20 GKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccn1 810531072 FPOTWWDEKNPVRH-IAGOWNOFSA-N 395.915 5.619 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cnn(-c2ccccc2Cl)c1)c1ccccc1 814647770 JFUVARKWASOFOS-LJQANCHMSA-N 393.878 5.082 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 836780963 DUHAUCHZHCFKLI-FPMFFAJLSA-N 375.255 5.026 30 20 GKED C[C@H](C(=O)[C@H](C#N)C(=O)c1cc2c(s1)CCCC2)c1ccc(Cl)s1 845838402 SKEKCEVUBHGDTC-JQWIXIFHSA-N 377.918 5.037 30 20 GKED C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915087999 YJGCWQJPXPTNDH-OPAMFIHVSA-N 390.870 5.401 30 20 GKED COc1ccc(/C=C\C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1OC 915179338 CFYVDUKGDYMVPK-BQEXRTDESA-N 398.462 5.011 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccc(F)cc2)C2CC2)cc1 915352582 MLKJDKKXVDAQMB-DEOSSOPVSA-N 399.469 5.678 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(CC)[C@@H](C)c2ccc(F)cc2)cc1OC 916486184 BEQZHNAZEQQOFI-QHIITQONSA-N 383.463 5.022 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3cccc(F)c3)n2)cc1 921132353 PYUHSOKOJDJCDS-BEFAXECRSA-N 378.472 5.313 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2ccc(CC(=O)O)cc2)cc1 1776083618 QGSAGBOUEWPRKX-IBGZPJMESA-N 396.531 5.745 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(F)c2ccccc12 1776354542 OQNWHSDCRCZFKT-FLIBITNWSA-N 378.399 5.360 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cc(Cl)cc2ccoc12 1776354682 RUQOMKGKQCVUGK-HWKANZROSA-N 384.815 5.468 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(C2CCCC2)c1 1776355490 SRDVDZOARGEJAG-ZRDIBKRKSA-N 378.468 5.726 30 20 GKED CN(c1ccccc1)c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cn1 1777084753 NEFAYMIRMHNQKV-RGEXLXHISA-N 398.462 5.150 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2c[nH]c3ccc(C(=O)O)cc23)s1 1777462878 DXZIHPYKYKCOCG-CLFYSBASSA-N 388.448 5.194 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)oc2ccc(Cl)cc12 41554621 IERWISOGBNORGQ-ZDUSSCGKSA-N 378.737 5.299 30 20 GKED C=CCN(CCC(=O)Nc1c(Cl)cccc1Cl)Cc1ccc(OC)cc1 54272472 YQTGJALXBFCDCY-UHFFFAOYSA-N 393.314 5.019 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2c2ccccn2)cc1 56745380 QDAMEAIYEVCASJ-NRFANRHFSA-N 384.439 5.115 30 20 GKED C[C@@H](SCc1cccc(Cl)c1)C(=O)Nc1sc2c(c1C#N)CCC2 63128676 QKDPGZRHVGKDAJ-LLVKDONJSA-N 376.934 5.022 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3nc4ccccc4o3)s2)c(C)c1 64102289 KEPKCLXAQUOSET-MRXNPFEDSA-N 387.464 5.367 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2ccc(OC(F)F)cc2)cc1 65680218 OSWSPQGGYLWWPL-UHFFFAOYSA-N 394.377 5.133 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1ccccc1C#N 68234109 PJEACKJFGMSNFT-UHFFFAOYSA-N 377.447 5.263 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H](C)c1ccccn1 68547068 RSKHNNYAYYGAAC-QGZVFWFLSA-N 386.455 5.279 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ncc(-c2ccc(F)cc2)o1 98041304 SXYQAYSLQWRJPF-UHFFFAOYSA-N 386.386 5.152 30 20 GKED Cc1cc(-n2c(C)cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2C)no1 108998765 ZGLHAMSAQRZGIV-OAHLLOKOSA-N 394.500 5.037 30 20 GKED COc1ccc(CSc2nnc(S[C@@H](C)c3ccc(C#N)cc3)s2)cc1 118173227 HTTKENUYGNZXEQ-ZDUSSCGKSA-N 399.566 5.564 30 20 GKED C/C(=C/c1cccc(Cl)c1)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 120051712 GBZUPSQYNAVBQA-GQPJMJRUSA-N 379.872 5.138 30 20 GKED Cc1nc(-c2ccccc2Br)sc1C(=O)/C=C/c1cncs1 130070011 RAXICKRXZSXBJD-VOTSOKGWSA-N 391.315 5.234 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C)C(C)(C)C#N 131155726 SOAUBOPJSPCHGW-CHWSQXEVSA-N 392.908 5.098 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1cccnc1SCC1CCCCC1 182143104 RWFCOFZPMMVROY-MRXNPFEDSA-N 395.528 5.297 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nnc(-c2ccc(Cl)cc2)n1C 185390936 VKFCCWLXOYTPRR-CQSZACIVSA-N 397.935 5.142 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3ccc(SC)cc3)cc2c1C 206605135 BVDFGZJSHNIZEH-TWGQIWQCSA-N 383.494 5.009 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1OC(F)F 211714076 NKWPYIMDMGKXMV-CLTKARDFSA-N 397.761 5.144 30 20 GKED CC(C)(NCc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 236698058 QHGKALLCZNDGJU-UHFFFAOYSA-N 377.315 5.701 30 20 GKED C[C@H](Nc1ccc(CC#N)cc1)C(=O)Nc1ccccc1Sc1ccccc1 302810958 KRANTYZIBOJSJF-KRWDZBQOSA-N 387.508 5.343 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(C)c(C)s2)cc1 303151517 STXNPRVWNRJEPE-UHFFFAOYSA-N 378.453 5.290 30 20 GKED OC(=Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)[C@@H]1CCCSC1 329796788 HBUPMVCBRQEHGS-CYBMUJFWSA-N 390.940 5.056 30 20 GKED C=CCOc1ccc(/C=C2/CCn3c2nc2sc(C)c(C)c2c3=O)cc1Cl 409712290 OJTUJDVUOSSWMT-GDNBJRDFSA-N 398.915 5.237 30 20 GKED N#CCC1(CNC(=O)c2sc3cccc(F)c3c2COc2ccccc2)CC1 431174187 ZWMVSJXFVDJLIW-UHFFFAOYSA-N 394.471 5.043 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2Cc3ccc(C)cc3C2)cc1 432031199 IPAJVJMGKQEZKM-UHFFFAOYSA-N 399.450 5.215 30 20 GKED N#CCSc1ccccc1NC(=O)CN(Cc1ccccc1)C1CCCCC1 434820516 GFGMRBLUYQQRRS-UHFFFAOYSA-N 393.556 5.076 30 20 GKED CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 436355441 YIUHPLJORRQONB-MOXGXCLJSA-N 395.528 5.015 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 436364953 LVRUBUFEIKIMIN-NOXFTYBFSA-N 394.515 5.238 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438837463 ITZBYRDBTXMQTL-FQEVSTJZSA-N 375.472 5.182 30 20 GKED Cc1c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)cnn1CCC(C)C 440789953 CTLLKECWKZESRK-UHFFFAOYSA-N 378.501 5.090 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)c2)n1 443885346 PYOAYYKGXJABFP-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C=CCOc1cccc(CNc2ccc(C(=O)Nc3ccccc3OC)cc2)c1 446905925 KFMLKTCKDZZOPT-UHFFFAOYSA-N 388.467 5.124 30 20 GKED CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CCC(c2c[nH]c3ccccc23)CC1 454428866 KXQZQZJEVONECB-UHFFFAOYSA-N 385.511 5.014 30 20 GKED C[C@@H](C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1cccc(C#N)c1 462198830 JJSMFHPRLNNSTQ-MRXNPFEDSA-N 381.435 5.032 30 20 GKED C=C(C)CN(CC)C(=O)N[C@H](c1cccc(SC)c1)c1cc(F)ccc1F 466242561 HRALPMBKJFCQFZ-HXUWFJFHSA-N 390.499 5.384 30 20 GKED C=C(C)C[C@H](C)C(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 466434299 KFTBBWRYYQWVLR-HTAPYJJXSA-N 378.541 5.837 30 20 GKED CCSCc1cccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1 469453065 UPRLFJTZWDKWAR-UHFFFAOYSA-N 377.513 5.450 30 20 GKED Cc1nc2c(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cccc2o1 470831104 KMVNQBADXCIZOP-UHFFFAOYSA-N 397.434 5.034 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCCC3(CCC3)C2)cc1 471292482 LRECQJAFRNFBOI-UHFFFAOYSA-N 391.471 5.157 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CC1(CSc2ccccc2)CC1 471821426 LGVFSODIJPFHBW-KRWDZBQOSA-N 396.581 5.839 30 20 GKED Cc1ccc([C@@H](NC2CCC(C#N)(c3ccccc3)CC2)c2ccccn2)cc1 475349625 HCEYFWRTEIRYGJ-CNWYCCFASA-N 381.523 5.473 30 20 GKED N#Cc1ccc(NC(=O)N2[C@H]3CC[C@H]2CC(Cc2ccccc2)C3)c(Cl)c1 478115993 ATUBHTCSDZQVDS-OALUTQOASA-N 379.891 5.229 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nc2ccccc2[nH]1 480380548 RFBNXSSJVYFDLN-OAHLLOKOSA-N 397.438 5.110 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN(CCC#N)CCC(C)C)on1 481116811 XFJCJRBWNPLEDC-UHFFFAOYSA-N 377.488 5.265 30 20 GKED C=CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccccc2)cs1 483079862 DDAKGHAWHZNGMF-UHFFFAOYSA-N 387.508 5.444 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2ccc(Cl)cc2)c1)c1cnc2ccccc2n1 483230514 MDWOMNBYRDFSNF-IBGZPJMESA-N 399.837 5.566 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)N[C@H](CCCC#N)c3ccccc3)o2)cc1 487293482 BNAIWSYCNOZWBG-OAQYLSRUSA-N 387.483 5.134 30 20 GKED C=CCC[C@H](NC(=O)c1ccc(-c2noc(C(F)F)n2)cc1)c1ccccc1 501767147 FDXQARUIEGDWID-KRWDZBQOSA-N 383.398 5.112 30 20 GKED CCCC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccc(OC)cc1 503794948 KJDIQFDOZWLEBS-QHCPKHFHSA-N 391.515 5.172 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1 510859279 IXVQBHJDPJGVCM-HNNXBMFYSA-N 377.444 5.318 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2cccc(COc3ccccc3C#N)c2)C1 513266073 GJKRNMHCWWNGLB-HSZRJFAPSA-N 396.490 5.075 30 20 GKED CCOc1cc(C)ccc1NC(=O)c1cccc(COc2ccccc2C#N)c1 513494562 XHOAACDGYJMGKE-UHFFFAOYSA-N 386.451 5.097 30 20 GKED N#CCCN(Cc1ccc(Oc2cc(F)cc(F)c2)cc1)Cc1ccccn1 513737189 WPAGDXQTEYWASM-UHFFFAOYSA-N 379.410 5.068 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1)C1CC1 513767155 FHDUDGSHYKTXKL-HNNXBMFYSA-N 390.512 5.043 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(Br)cc1 515687783 FHPMGBHWQSWHLF-UHFFFAOYSA-N 383.270 5.302 30 20 GKED N#Cc1cccc(/C=C(\CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c1 518602940 SXUNAMRFXGOZQN-NTUHNPAUSA-N 388.370 5.202 30 20 GKED N#C[C@@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccc(Cl)cc1 519304826 SZDBLCVKEKIUBN-CQSZACIVSA-N 378.646 5.123 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)C(C)(C)c1ccccc1 520856630 LNRXVMHWQCOTIZ-DLBZAZTESA-N 381.545 5.426 30 20 GKED Cc1ccc(NC(=O)CNc2cccc(Oc3ccc(C#N)cc3)c2)c(Cl)c1 521527330 OXQNVFJUWGCTBZ-UHFFFAOYSA-N 391.858 5.363 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)CCCCc1nc2ccccc2s1 521719381 BAQQWUSRHUTMAL-UHFFFAOYSA-N 380.517 5.076 30 20 GKED CCN(C(=O)c1ccc(-c2ccsc2)nc1C)[C@@H](C)c1ccc(C#N)cc1 523582378 DQEZSFYUOWGYIW-INIZCTEOSA-N 375.497 5.214 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F 525041644 HTRITEOQCKGUPO-MRXNPFEDSA-N 388.433 5.508 30 20 GKED N#CCc1ccc(NC(=O)N2CCc3cccc(C(F)(F)F)c3C2)c(Cl)c1 529105828 KSHCUXSLNRUSKJ-UHFFFAOYSA-N 393.796 5.015 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cccc3[nH]ccc23)cc1 530853226 FXAJWKDJZPIIGT-UHFFFAOYSA-N 383.407 5.093 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1cccc(OCCCC#N)c1 539626757 GXCLSABURIOENY-INIZCTEOSA-N 377.513 5.974 30 20 GKED CC(=O)c1ccc(C(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)c1 541073154 OWZRZBJDJZIGFG-HNNXBMFYSA-N 386.426 5.058 30 20 GKED N#Cc1ccc(NC(=O)c2cc(Cl)ccc2SC2CCCC2)cc1C#N 542511751 VTPFPRRBLSUSCM-UHFFFAOYSA-N 381.888 5.370 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccc[nH]1)c1ccc(-c2cccc(C#N)c2)cc1 543017795 WSNCUDLHEMXFGG-UZUQRXQVSA-N 384.483 5.161 30 20 GKED N#CCCCNC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 543280082 GMSHXHSWWOSRGH-UHFFFAOYSA-N 381.329 5.062 30 20 GKED N#Cc1cc(NC(=O)c2ccncc2C(F)(F)F)ccc1Oc1ccccc1 552445194 FMTCHCQMVZUDDE-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1cc(Oc2cc(C(F)(F)F)nc(-c3cccnc3)n2)c(C)c(C)c1C#N 553387954 QOEFJOXUBUUVEX-UHFFFAOYSA-N 384.361 5.147 30 20 GKED FC(F)(F)c1cc(N[C@@H]2CCO[C@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 558113095 DZHUZIDBPJQONB-KOLCDFICSA-N 381.238 5.246 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cc(Br)cs3)cc2)ccn1 562082519 LYEATHISOZOTMC-UHFFFAOYSA-N 386.274 5.182 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 567038729 HTHQDZHITBQJEG-RYUDHWBXSA-N 379.312 5.223 30 20 GKED C[C@H]1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)c2ccccc2S1 571862466 ZWWSZUOTHZSNSK-KRWDZBQOSA-N 389.524 5.476 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3scnc3C3CCCC3)cc2)ccn1 577924852 MYUPXEYOWJLJJT-UHFFFAOYSA-N 390.468 5.112 30 20 GKED Cc1nc(C(C)(C)C)sc1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 583233522 FMEKIDJWMVBIPB-UHFFFAOYSA-N 392.484 5.060 30 20 GKED O=C(Cc1coc(-c2cccs2)n1)Nc1cccc(C#Cc2cccs2)c1 591938786 VALRNWPKWQEIAD-UHFFFAOYSA-N 390.489 5.046 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)cs2)cc1 592973386 FHBHEWJGOIOIOR-CQSZACIVSA-N 393.468 5.357 30 20 GKED COc1cccc(CNCc2ccc(C(C)(C)C#N)cc2)c1OC1CCCC1 594499280 BXFQCNNNAYSNEW-UHFFFAOYSA-N 378.516 5.108 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)[C@@H](C)CC#N 597297763 IHZODABQIXUYBC-AWEZNQCLSA-N 378.451 5.220 30 20 GKED N#CC1(CC(=O)Nc2ccc(Br)cc2C(F)(F)F)CCCCC1 598808163 NUTDCIRVAUTRPD-UHFFFAOYSA-N 389.215 5.271 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccccc1Cl 609140905 HYPBVQXEKCBSPB-UHFFFAOYSA-N 391.858 5.315 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccccc1Cl 609377970 SJYMNOCCWICOHU-CQSZACIVSA-N 390.961 5.464 30 20 GKED N#C[C@H](NC(=O)c1cc2ccc(F)cc2s1)c1cccc(Cl)c1Cl 609414277 DWQSCWYRBRWZRE-ZDUSSCGKSA-N 379.243 5.342 30 20 GKED CC(C)CCN(CCC(C)C)C(=O)Nc1ccccc1S[C@H](C)CC#N 609437023 LNBZVWCSPVKGRT-GOSISDBHSA-N 375.582 6.007 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 609556429 IRACFVOKNQPFDX-UHFFFAOYSA-N 393.535 5.027 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2ccccc2CC1 609711656 ICFOEEPNVBRFPS-UHFFFAOYSA-N 397.478 5.292 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cc(-c2ccccc2)ns1 609830876 NLOQQLBPXWDFGN-UHFFFAOYSA-N 381.460 5.601 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1ccc(CC#N)cc1 611154021 HXWAKWHIJXVBFP-MRXNPFEDSA-N 375.497 5.018 30 20 GKED CSc1ccc(-c2noc([C@H]3CCCN3c3ccc(C#N)cc3)n2)c(Cl)c1 615133196 OZYXDJWVKJEHQM-GOSISDBHSA-N 396.903 5.325 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1C[C@]1(F)c1ccccc1 619130091 XPECDNAKJLCIJM-HIFRSBDPSA-N 385.323 5.041 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(F)cc2)n1 657529404 VMXHMQWAINNTGE-OXJNMPFZSA-N 387.524 5.191 30 20 GKED FC(F)(F)c1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 683352455 CZFSPPORVYUVQR-OCAPTIKFSA-N 385.295 5.330 30 20 GKED CC(=NNc1nc2ccccc2[nH]1)c1sc(-c2ccc(Cl)cc2)nc1C 727648643 OGQPIXNTTNBAPM-UHFFFAOYSA-N 381.892 5.484 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc3ccccc3c2OC(F)F)cc1 728695423 WQOCRYGNSPWWNC-ODDCISTRSA-N 393.389 5.628 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(-c2ccccc2Cl)s1 728699528 TUXFPFFCFJBQLK-YVMONPNESA-N 396.821 5.723 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 729553429 POXKZKMNXHOGJY-SFHVURJKSA-N 375.394 5.148 30 20 GKED N#C[C@@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc2cc(F)ccc2s1 730417390 NGGBSSSVNUBDMH-INIZCTEOSA-N 377.444 5.116 30 20 GKED N#Cc1ccc(CNC(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)cc1 732436750 KYCXLVVXSHJBRO-UHFFFAOYSA-N 391.858 5.112 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)c2cccc3ccccc23)c1 733845548 DLEHTLJDNBURLK-XLIONFOSSA-N 387.483 5.081 30 20 GKED C[C@@H]1c2ccc(F)cc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738894461 FMBJHUHYAMTSOA-OSPHWJPCSA-N 399.469 5.632 30 20 GKED N#Cc1cc([N+](=O)[O-])cnc1Oc1ccc(-c2ccc(Br)cc2)cc1 743078223 IZPFKTWGFKOKRW-UHFFFAOYSA-N 396.200 5.083 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC=C(C(F)(F)F)CC2)cc1 757882767 URUZFKDMYXTAFF-IBGZPJMESA-N 385.389 5.068 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c(Cl)c1 768995539 JYCDDWKAAQGLSQ-KRWDZBQOSA-N 393.796 5.599 30 20 GKED CCC[C@@H](NCc1ccc(OC)c(O[C@@H](C#N)CC)c1)c1ccc(Cl)cc1 772987930 ZRYIKMUVFCLRQJ-WOJBJXKFSA-N 386.923 5.661 30 20 GKED C[C@H](NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1ccc(OCC#N)cc1 776159562 JKZRASQNIAJHTH-SFHVURJKSA-N 384.479 5.042 30 20 GKED C[C@H](Nc1cccc(COc2cccc(F)c2)c1)c1ccc(OCC#N)cc1 777640362 AGZKBCXATABXSW-KRWDZBQOSA-N 376.431 5.480 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(OCc3cccc(F)c3)c(F)c2)cc1 779595464 JLUODSTXZAIBKT-MRXNPFEDSA-N 394.421 5.447 30 20 GKED C#CCCCCCC(=O)N(CCC)[C@H](c1cccnc1)c1ccc(F)cc1F 779953108 AHHICFFYTBWSRH-HSZRJFAPSA-N 384.470 5.272 30 20 GKED N#Cc1cccc(COc2cccc(/C=C/C(=O)c3ccc(C#N)cc3F)c2)c1 781108390 PVOMZIMHGQFIJR-CSKARUKUSA-N 382.394 5.044 30 20 GKED Fc1nc(F)c(F)c(NN=C2CC(c3ccc(C(F)(F)F)cc3)C2)c1F 781581686 JDVDJVHJNGIVEK-UHFFFAOYSA-N 377.263 5.002 30 20 GKED CC[C@@H](CC#N)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 787079196 QHBLLAGXMDVHTQ-ZDUSSCGKSA-N 376.239 5.073 30 20 GKED N#CCCn1cc(/C=C\C(=O)c2ccc3cc(O)ccc3c2)c(-c2ccccc2)n1 788357260 XIGFARUOHPRSFZ-BENRWUELSA-N 393.446 5.219 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3nccc(C)c3c2)cc1 796791198 DAJOOBPAEOARGN-YCRPNKLZSA-N 385.467 5.018 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCCCc2nc3ccccc3s2)s1 797569776 WNTZQVDHDIIVBW-AWEZNQCLSA-N 397.569 5.640 30 20 GKED C#Cc1cccc(NC(=S)/C(=C(/O)c2ccc(CCC)cc2)[n+]2ccccc2)c1 797800294 WIIQFFSOCRDWPC-UHFFFAOYSA-O 399.539 5.231 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(-c2ccc(Cl)s2)nc1 801157197 UNGCULUKKGNUOP-UHFFFAOYSA-N 385.901 5.331 30 20 GKED CN1CCC[C@@H](COC(=O)CCCCCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1 805885999 XLQVBVACDRBCCB-PXNSSMCTSA-N 396.453 5.106 30 20 GKED C[C@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(N2CCCOC2=O)cc1 814263358 BTXKGQJBYSRJGN-ZDUSSCGKSA-N 389.377 5.097 30 20 GKED O=[N+]([O-])c1cccc([C@H](NCc2cccc(C(F)(F)F)c2)C(F)(F)F)c1F 839650403 BGOFEYKABVLXEQ-AWEZNQCLSA-N 396.262 5.146 30 20 GKED Cc1nc(CCC(=O)N(O)Cc2cccc3ccccc23)oc1-c1ccccc1 901369977 MYAHLYCOQGEWEK-UHFFFAOYSA-N 386.451 5.154 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2c3ccccc3n(C)c2s1 914501480 KCODLNLZWIJDCU-UHFFFAOYSA-N 387.508 5.315 30 20 GKED N#C[C@@H](C(=O)Cc1ccc2c(c1)CCCC2)c1nc2cc(Cl)ccc2s1 917044013 OEDJHRNJTPLNAO-KRWDZBQOSA-N 380.900 5.247 30 20 GKED COc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1OC 917603964 DAWCESNUPAJAEZ-KHPPLWFESA-N 395.436 5.237 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(Cl)cc1 917669091 NPBALIBKEWZIEL-JOCHJYFZSA-N 388.898 5.912 30 20 GKED C[C@@H]1CCCC[C@H]1CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 920790062 NJVHMRFLTLMLBE-WSTZPKSXSA-N 390.483 5.343 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(-c3cccs3)nc3ccccc23)cc1 920970320 HGEGFNXYVOBVBM-UHFFFAOYSA-N 397.503 5.832 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)[C@H](C)Oc1ccc(Cl)cc1Cl 1776087184 MOXAPGBHSNQEJI-LBPRGKRZSA-N 381.259 5.255 30 20 GKED CC(C)(C)c1ccc(-c2ccc(/C=C3/CCc4occ(C(=O)O)c4C3=O)o2)cc1 1776271528 YONQSONPCRJRDX-QINSGFPZSA-N 390.435 5.748 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776473695 ZRPNXLVESNLSFH-ATWMFIQVSA-N 396.439 5.302 30 20 GKED CCCCCCCOc1ccc(/C=C/c2ccc3cc(C(=O)O)ccc3n2)cc1 1776785904 NVMMAXRXLOHSCF-KPKJPENVSA-N 389.495 6.453 30 20 GKED CCCCCCOc1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)cc1 1776788997 LPSKQVCLUGIQRR-LXKWBGADSA-N 378.468 5.484 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C/c1ccc(OCc3occc3C(=O)O)cc1)C2=O 1777455888 KFEDXECVXYGHMN-DKNZLLBESA-N 388.419 5.249 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777566929 ZPINNJQTEKQLRJ-FSJBWODESA-N 393.442 5.065 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCSCc1ccccc1F 8369028 GQBMWSPODHQVLT-UHFFFAOYSA-N 390.483 5.028 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1nc2ccccc2o1 66516415 GTNPEGUBIGEGAK-SECBINFHSA-N 385.857 5.156 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)c(Cl)nc1Cl 66802196 OODICFBFCAJZIB-VIFPVBQESA-N 384.263 5.174 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66955749 NECKWYMCTBTBHZ-PXNSSMCTSA-N 379.529 5.758 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 103330741 NSFUMFZQSFEPKJ-WFASDCNBSA-N 384.888 5.328 30 20 GKED CO[C@@](C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 106985075 LEVXTGXDIQAEFP-LAUBAEHRSA-N 396.899 5.202 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@H](C)Nc1cccc(OCCCC#N)c1 120608149 ZJGWSSLLUVAOTA-ROUUACIJSA-N 379.504 5.322 30 20 GKED CC(C)(C)OC1CCN(C(=O)c2ccccc2Sc2ccccc2C#N)CC1 151439730 QKGAKJAELLKJCZ-UHFFFAOYSA-N 394.540 5.129 30 20 GKED Cc1nc(NC(=O)CCCCCO[C@@H]2CCC[C@@H](C)C2)sc1SCC#N 159619800 WHEBHAQBCYWMKO-GDBMZVCRSA-N 395.594 5.161 30 20 GKED N#CCCCC[S@](=O)Cc1ccc(Oc2cccc(Cl)c2Cl)cc1 172841898 UFNVHDPSSRVJLU-DEOSSOPVSA-N 382.312 5.728 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 176830902 SEALLMXSCJPQDS-UHFFFAOYSA-N 393.491 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCc1ncc(-c2ccccc2)o1 189893349 XCMSADNGYCSYQQ-UHFFFAOYSA-N 388.511 6.155 30 20 GKED Cc1cc(C(=O)CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c(C)s1 193273570 XFFLABRYDHWVDJ-KRWDZBQOSA-N 394.521 5.328 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NCCCC1(C#N)CCOCC1 281485088 WXVYAOXNNBZSDP-HNNXBMFYSA-N 387.524 5.009 30 20 GKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/C2CCC3(CCCCC3)CC2)CC1 329884763 SVYPWDOKZBOEPC-UHFFFAOYSA-N 376.585 6.397 30 20 GKED CC(C)c1noc([C@H](/N=C(/O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)C2CCOCC2)n1 330285623 ZDYFNUCOLZFUDC-JCHJZTRSSA-N 389.540 5.224 30 20 GKED N#C[C@H]1CC[C@@H](NCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)C1 424188776 CIANRAQOWBIVDF-XJKSGUPXSA-N 388.298 5.028 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cccc(SCC#N)c1 429924969 MGPYFFFZVSUJKD-UHFFFAOYSA-N 394.418 5.362 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc(C)c1OC(F)F 430626135 RGWHAGIOHYIQSK-CYBMUJFWSA-N 378.444 5.149 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)Nc2ccc(C#N)cc2)C(C)C)cc1 437649855 JYDKGDHSVJCOHY-UHFFFAOYSA-N 399.494 5.676 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)O1 439111850 NIUJKWRTZORKNN-PBHICJAKSA-N 384.863 5.290 30 20 GKED C[C@H]1C[C@H](CC(F)(F)F)[C@@H](C)N1C(=O)Nc1ccccc1S[C@H](C)CC#N 454748040 APBKPIPAAGLVGO-GBJTYRQASA-N 399.482 5.664 30 20 GKED COc1cccc([C@H]2C[C@H](N(C)C(=O)N[C@H](CCCC#N)c3ccccc3)C2)c1 458842427 PKPPELCAPFGVIG-MQSCRBSSSA-N 391.515 5.018 30 20 GKED C[C@@H](SCC(=O)N(CC#N)c1ccccc1)c1ccc(Cl)c(Cl)c1 463198808 FNOFEEPHELLQHL-CYBMUJFWSA-N 379.312 5.344 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N[C@H](C#N)c1cccc(Cl)c1Cl 463747530 UYYKUFHTGGPZID-YVEFUNNKSA-N 379.262 5.082 30 20 GKED CCO[C@H](CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)C1=CCCC1 465167356 OOVXSHLGKRILQU-HSZRJFAPSA-N 390.483 5.503 30 20 GKED Cc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1OC(F)F 469420591 RWBHUHPNOUWVPD-UHFFFAOYSA-N 383.398 5.107 30 20 GKED N#CCCCn1cc(C(=O)N2CCCCC[C@@H]2c2ccco2)c2ccccc21 469448725 SRVHKLZGBUMIGE-OAQYLSRUSA-N 375.472 5.296 30 20 GKED CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cn(CCCC#N)c3ccccc23)s1 469462634 LJUBVUYZXDTWCW-MRXNPFEDSA-N 394.544 5.106 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 471904474 DHYXZTUQTOOWON-STQMWFEESA-N 393.339 5.987 30 20 GKED COc1cccc(C=C2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CC2)c1 473768532 WCEHIDGGXUTJME-UHFFFAOYSA-N 389.499 5.208 30 20 GKED COc1ccc(N(Cc2ccccc2)C(=O)C[C@H](CC#N)c2ccccc2)cc1 475901877 APELTFUGGCKWIK-QFIPXVFZSA-N 384.479 5.316 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 477042456 ILFRMCWPWBHGFP-VLIAUNLRSA-N 397.425 5.297 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C(C)=O)c(Cl)c1 481262228 GRACZRBRTRBJAX-UHFFFAOYSA-N 383.300 5.478 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(OCc2cccnc2)c1 485731957 JAQCOVRJPJLVBK-UHFFFAOYSA-N 376.481 5.191 30 20 GKED N#CCCC[C@H](NC(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccccc1 487454025 HGUWJSMRMSOXEU-QFIPXVFZSA-N 389.886 5.567 30 20 GKED CCN(C(=O)c1ccc(C#N)s1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 487641359 XSNXNWBSKCCGIR-QFIPXVFZSA-N 389.524 5.390 30 20 GKED CCS[C@@H](C)c1noc(CSc2nc(-c3ccccc3)ccc2C#N)n1 488829516 FTQSKJNXJKVJKU-ZDUSSCGKSA-N 382.514 5.110 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCCCC(=O)c1ccccc1 494053546 AKQKQHIXBGNEDS-UHFFFAOYSA-N 375.921 5.359 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)c(Cl)c1 494686688 RYXVLVLRVQIIDI-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#CCc1ccc(CN[C@H](CC2CC2)c2cc(F)cc(Br)c2)cc1 495258562 CSKRCCSBXWYPNJ-HXUWFJFHSA-N 387.296 5.285 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(-c2cccs2)nc1C 500008421 ONTMNYAAZNLKTG-UHFFFAOYSA-N 375.497 5.043 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N[C@@H]2CCc3ccccc32)cc1 508261406 ZPDOIRWXOATTQY-OAQYLSRUSA-N 399.450 5.168 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)c1 509040805 VSSZYUMAXPSNMG-UHFFFAOYSA-N 384.222 5.305 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@@H](C)CC[C@H]2C)cc1 510094264 SPAOLYDSBFIZER-JKSUJKDBSA-N 379.460 5.011 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3c[nH]c4cc(F)ccc34)cc2)cc1 511746892 UIDJGTGKRSUXAV-UHFFFAOYSA-N 385.398 5.152 30 20 GKED COc1cc(C#N)ccc1OCCSCc1csc(-c2cccs2)n1 524888099 JCKCYURQWYBXFV-UHFFFAOYSA-N 388.539 5.064 30 20 GKED CC(C)Oc1ccc(NC(=O)c2ccccc2CCC(F)(F)F)cc1C#N 533997136 IDCQLMAZCSSKFJ-UHFFFAOYSA-N 376.378 5.093 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@H](c3nc4ccccc4s3)C2)c1 535781616 GUQQYUJTUVHHER-IBGZPJMESA-N 391.540 5.358 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)nn1[C@@H](C)C1CC1 537421739 BDBYWHDZYZDDSM-INIZCTEOSA-N 386.455 5.079 30 20 GKED N#CCCCOc1cccc(NC2CCN(Cc3ccccc3Cl)CC2)c1 539627196 OASRNFHHEWAPTE-UHFFFAOYSA-N 383.923 5.099 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)n([C@H](C)C4CC4)n3)n2)cc1 540778149 DILYOOVECYUEIZ-CRAIPNDOSA-N 390.512 5.085 30 20 GKED COCc1ccccc1NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543851935 DLWZSYWAXGBIQG-KRWDZBQOSA-N 385.467 5.254 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1 551012420 QSYARMAQOSEIIM-XMMPIXPASA-N 390.433 5.077 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CC(C)(C)CC(=O)c1ccccc1 553119533 PMULIOBLRDNTHF-UHFFFAOYSA-N 395.547 5.058 30 20 GKED C=CCn1c(-c2sccc2C)nnc1N1CC[C@H](C(F)(F)F)C2(CCC2)C1 554930962 QLWFRFRPLMMKQW-AWEZNQCLSA-N 396.482 5.060 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)o1 558745756 IOCLQFCMUMLNID-UHFFFAOYSA-N 375.428 5.224 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1C[C@H](c2ccccc2F)C1 565284019 MRTGZHPVWZUVSK-JYJNAYRXSA-N 383.492 5.288 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cc(C(F)F)ccc1Cl 567773580 ZCTLXWYIKQVAFP-UHFFFAOYSA-N 398.796 6.194 30 20 GKED C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 588447167 GXRQEFRKGXBPLB-MEODZPNASA-N 397.843 5.138 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1cnc2ccccc2n1 588587636 VHLOUWWJGMBNPU-UQTJOTSZSA-N 382.250 5.216 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCc2sccc2[C@@H]1c1cccs1 593953675 IBFZJTZLTJBTIC-QVKFZJNVSA-N 392.549 5.034 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ncoc3-c3ccccc3)n2)cc1 601618232 VWWWLFLPGGEWKE-QGZVFWFLSA-N 385.448 5.264 30 20 GKED Cc1cccc(C2(C(=O)Nc3nc(C)c(SCC#N)s3)CCCCC2)c1 603774956 NFYCNQVQZPRBKX-UHFFFAOYSA-N 385.558 5.216 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2(C(F)(F)F)CC2)cc1Cl 608786286 GXPIFGQAHNZFFS-HNNXBMFYSA-N 378.781 5.276 30 20 GKED CC(C)N(CCC#N)C(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 608813850 KCHDZYKNBMPZKU-UHFFFAOYSA-N 377.463 5.057 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(F)c(F)c1 609370793 XVGAYFVWWOXHCH-GFCCVEGCSA-N 378.469 5.090 30 20 GKED CC[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 609381741 UGCWUCGFGUMEJN-INIZCTEOSA-N 392.446 5.843 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cccc(Cl)c1Cl 609414291 GARJDYAFWHRZLE-LZWOXQAQSA-N 379.674 5.131 30 20 GKED C[C@H](NCc1cccc(NC(=O)c2ccc(Cl)cc2)c1)c1cccc(C#N)c1 610344913 MCCDSQVCHJMQBN-INIZCTEOSA-N 389.886 5.315 30 20 GKED N#Cc1csc(CN[C@@H](CC(F)(F)F)c2ccc(Br)cc2)c1 612593501 IADURUXFUUXTCI-AWEZNQCLSA-N 389.240 5.166 30 20 GKED Cc1ccccc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 613346056 BNCSEPUCYDHNPJ-HNNXBMFYSA-N 387.291 5.915 30 20 GKED C=CCC1(C(=O)N[C@@H](C)c2ccc(O[C@H](C)c3ccccc3)cc2)CCOCC1 617940299 GXIJFTZKXVBHIL-VQTJNVASSA-N 393.527 5.377 30 20 GKED O=C(CCc1cc(F)ccc1F)NC(CCC(F)(F)F)CCC(F)(F)F 619126414 RFAAFTQEWYYULA-UHFFFAOYSA-N 391.302 5.067 30 20 GKED CC(=O)c1cccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 623451520 PECKYKPPERMUOG-UHFFFAOYSA-N 385.423 5.506 30 20 GKED CC1(C(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CCC(F)(F)CC1 623983352 YYGUUBUCSTZWLJ-URLYPYJESA-N 395.334 5.228 30 20 GKED CC(C)C[C@@H](N)c1noc(-c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)n1 663250133 CCZGWWVAZSMIHK-LLVKDONJSA-N 399.310 5.072 30 20 GKED C=CCCC[C@@H](C)NC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 678895228 MLXGVPWECFOLMS-CYBMUJFWSA-N 382.451 5.232 30 20 GKED COc1ccc(C(=O)/C=C\c2sc3ccccc3c2Cl)cc1CC(=O)O 726743904 SNVADLQSCYNIOB-CLFYSBASSA-N 386.856 5.087 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1Cl 727627499 NQXWSXVPSYUFEM-RXHHAWBHSA-N 388.854 5.244 30 20 GKED C#Cc1cccc(N(C(=O)c2csc(-c3c(F)cccc3F)n2)C(C)C)c1 728247082 QXZRKAOBJSYVAI-UHFFFAOYSA-N 382.435 5.125 30 20 GKED O=C1/C(=C\c2csc(-c3ccc4c(c3)OCO4)n2)CSc2c(F)cccc21 728440750 TWBQPKGBOCVUGF-SDQBBNPISA-N 397.452 5.050 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cnc(-c3ccco3)s2)cc1 728813080 HCWNCOXXSRUAEQ-GOSISDBHSA-N 385.448 5.311 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416534 FLGCSYXSJYECKA-YOEHRIQHSA-N 396.487 5.511 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C\c1ccc(Br)o1 731332304 IMXJRCDSXKJOAX-ZVTBTPLYSA-N 391.290 5.088 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 731973401 XVXSOASIHYJVAE-FDDCHVKYSA-N 386.520 5.709 30 20 GKED Cc1ncc(/C=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)s1 732732107 JEOUVSZNQHKVTA-LHUXKHBRSA-N 393.899 5.412 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc([N+](=O)[O-])ccc2Cl)n1 735414593 CYTMLCQISXGEFM-UHFFFAOYSA-N 387.770 5.134 30 20 GKED N#Cc1ccc(NC(=S)Nc2nc3ccccc3n2C2CCCC2)cc1Cl 740772113 GRKFXFIDBWIKBR-UHFFFAOYSA-N 395.919 5.485 30 20 GKED N#Cc1cccc(-c2nnc(CSc3nc(-c4ccc(F)cc4)cs3)o2)c1 741845085 WTFBLIKYULEEEJ-UHFFFAOYSA-N 394.456 5.163 30 20 GKED CCSCC[C@H](C)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743092812 DQCKZNQZFDCIES-UWJYYQICSA-N 381.545 5.337 30 20 GKED C=CC[C@H](NC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccncc1 750002271 DMCZFDKDQOJCFK-KSSFIOAISA-N 397.931 5.197 30 20 GKED C[C@@H]1/C(=C\c2cnc(-c3ccncc3)s2)C(=O)c2cccc(Br)c21 753144945 RRZRHTZDRQLYIG-BTAWCLGRSA-N 397.297 5.351 30 20 GKED CC[C@H](C#N)Oc1cc(CNC/C(C)=C/c2ccc(Cl)cc2)ccc1OC 753852676 FFLWFATTXBNWDY-MBNYPGIVSA-N 384.907 5.223 30 20 GKED CC(C)C[C@H](C)OCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 756231469 MOKBOFZMPWZXCX-YOEHRIQHSA-N 390.936 5.481 30 20 GKED O=C(/C(=C/c1nc(Cl)cs1)c1nc2ccccc2s1)c1ccccc1 759071958 ICKZKOHYUTWCAY-RAXLEYEMSA-N 382.897 5.830 30 20 GKED Cc1cc(O)ccc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 761996143 DSYXRZRRQAVQDL-UHFFFAOYSA-N 378.815 5.270 30 20 GKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1cc(Br)ncc1F 762421078 GIKBFJVBTUUQRM-SREVYHEPSA-N 389.249 5.003 30 20 GKED COc1cc(/C=C2\CCc3c(sc4ccccc34)C2=O)ccc1OCC#N 763101827 RLMLMSZQOYDNIX-NTCAYCPXSA-N 375.449 5.025 30 20 GKED C[C@@H]1CN(c2ccc(NCC(C)(C)CCC#N)cc2C(F)(F)F)C[C@@H](C)O1 770565342 QTNWZIIWSQMQQA-HUUCEWRRSA-N 383.458 5.061 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2cc(Cl)c(Cl)cc2O)c1 774246453 ZTROVPWSRPFBEO-GXTWGEPZSA-N 379.287 5.231 30 20 GKED C[C@]1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCCOC1 781447179 DICWVAXEWPJLTL-ACJLOTCBSA-N 395.311 5.110 30 20 GKED CC(C)n1nccc1CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 793061908 OHFYPSJNVIMJEH-UHFFFAOYSA-N 380.879 5.180 30 20 GKED Cc1c(C(=O)O[C@@H](C)c2nnc(-c3cccs3)o2)sc2ccc(C#N)cc12 796610721 MHNKYOOSHIPIIQ-NSHDSACASA-N 395.465 5.111 30 20 GKED C#Cc1cccc(NC(=O)N2CCC[C@@H]2c2ccc(Br)c(C)c2)c1 797610934 HIFDDBYRGLOSJJ-LJQANCHMSA-N 383.289 5.108 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H]2c3ccccc3CC23CCOCC3)cc1 810255641 QMNXMEYSAAQLMO-MBSDFSHPSA-N 397.946 5.563 30 20 GKED C=CC[C@@H]1N(C(=O)c2ccc(N(C)C(=O)OC(C)(C)C)s2)CCCC1(C)C 811460950 CLFGWZUBFOUUMW-INIZCTEOSA-N 392.565 5.326 30 20 GKED Cc1nc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1-c1ccccc1 811707119 OTRDSBVGQQNQTQ-UHFFFAOYSA-N 378.888 5.391 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCCC(F)(F)C2)cc1 813761148 KRAYELZXTDXTNT-LAUBAEHRSA-N 397.469 5.679 30 20 GKED Fc1cc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)cnc1Cl 846850659 KMWYEGRSSQZMKF-LBPRGKRZSA-N 386.698 5.286 30 20 GKED C#CC[C@@H](NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1 852229141 MNSLOJHKBRZKJY-OAHLLOKOSA-N 394.359 5.104 30 20 GKED N#Cc1ccc(Br)c(CNc2cc(Cl)ccc2OC(F)F)c1 864030993 VJRARSPIWHIWKH-UHFFFAOYSA-N 387.611 5.188 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)c1cc(F)ccc1F 916134379 HAZOIQSYXQSXQA-NTMALXAHSA-N 386.829 5.376 30 20 GKED N#C[C@@H](C(=O)COc1ccc(Cl)c2ccccc12)c1nc2ccccc2s1 916846395 SMFWHGNTLFOGKV-HNNXBMFYSA-N 392.867 5.358 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4ccc(Cl)cc4)CC3)n2)cc1 916972829 QHSGYWKKIRAYJW-SFHVURJKSA-N 392.911 5.680 30 20 GKED O=C(/C=C1\COc2ccc(F)cc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 918156921 XARCMIILTCKKTP-FMIVXFBMSA-N 381.384 5.121 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccccn2)cc1 919905050 YGDINAKISADPSZ-GMAHTHKFSA-N 382.467 5.106 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921131341 IYTWQTPGPWRFIO-ACJLOTCBSA-N 398.890 5.658 30 20 GKED CC(=NNc1ccc(Cl)c(Br)c1)[C@@H]1C[C@H](CC(=O)O)C1(C)C 1776105137 PODJOWDOWHKYBC-PWSUYJOCSA-N 387.705 5.027 30 20 GKED O=C(/C=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1cc(F)ccc1F 1776113739 SONCFFDQEGVNAJ-RYGYDFEPSA-N 394.373 5.066 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)cc1 1776125264 BNKQDQACDDMRRE-RIYZIHGNSA-N 384.447 5.769 30 20 GKED CC(C)c1cccc2c1OCC/C(=C\c1cc(C(=O)O)c(Cl)s1)C2=O 1776378036 OOWFDSKXCWIBDJ-DHZHZOJOSA-N 376.861 5.272 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)c1cccc(O[C@@H](C)C(=O)O)c1 1776807987 OHRIELQWYKPCDK-VUSFMPOISA-N 392.451 5.523 30 20 GKED N#Cc1ccccc1CSCCNC(=O)c1ccc(-c2ccccc2Cl)o1 7239776 MNFIOLZEIAVFJY-UHFFFAOYSA-N 396.899 5.135 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1nc2c(c(C)c1C#N)CCC2 24851592 WBDGCDRSZNFIEI-GDBMZVCRSA-N 393.556 5.383 30 20 GKED Cc1ccc(C[C@H](C#N)Sc2nnc(-c3ccccc3F)n2CC(C)C)cc1 27122836 PLANMBKVGORGQY-GOSISDBHSA-N 394.519 5.276 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)N[C@H]2CCCC[C@H]2C)cc1 27486988 CJDOVOIPSCARKS-CTNGQTDRSA-O 395.592 5.006 30 20 GKED C[C@@H](Nc1snc(Cl)c1C#N)c1cccc(NC(=O)c2ccccc2)c1 52104355 ZFIVVXOUUXTGMQ-GFCCVEGCSA-N 382.876 5.094 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1sc2cccc(F)c2c1COC 104917443 ROHNEWWKKZGFQE-UHFFFAOYSA-N 375.490 5.077 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 110290661 MKONDQCSPYAMNT-UHFFFAOYSA-N 394.833 5.230 30 20 GKED C=CCOc1ccc(C(=O)N2CCC[C@@H]2[C@H](CC)c2ccccc2)cc1OC 116161103 ZUIBDYYTPOPNKF-NHCUHLMSSA-N 379.500 5.058 30 20 GKED CSc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)nc1 116242440 WAAGBPRHWABJGX-UHFFFAOYSA-N 391.521 5.220 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](c1ccccc1)C1CC1 123096660 JYOKBNRQFPXCBD-JOCHJYFZSA-N 383.451 5.186 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3cc(C(C)(C)C)sc3C#N)cs2)o1 154261608 QEEGWWSJGGGRLE-UHFFFAOYSA-N 385.514 5.123 30 20 GKED CC(=O)N(c1nc(CN(CCC#N)CC(C)(C)C)cs1)c1cccc(C)c1C 166000973 LMVWYJOWTHXHGM-UHFFFAOYSA-N 398.576 5.206 30 20 GKED N#C[C@@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1nc2ccccc2o1 171530593 WVKHUVPSZCSVEO-INIZCTEOSA-N 379.375 5.126 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc2ccccc2c1 175947409 VRKBTBQFUDSPQQ-KBXCAEBGSA-N 389.405 5.565 30 20 GKED COCCCn1c(SCCCC(C)(C)C#N)nnc1-c1ccccc1Cl 177144555 NWHVLYQAFPZORF-UHFFFAOYSA-N 392.956 5.057 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2csc(-c3c(F)cccc3F)n2)n1 177760616 INMZDPRSBXUPAQ-SNVBAGLBSA-N 389.452 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)C[C@@H](O)c1ccc(F)cc1 191517174 FETZLRMJZNMFHB-HRAATJIYSA-N 384.495 5.311 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2nccn2CC(F)(F)F)cc1 255900674 LNRJUTUJGICYCR-KHPPLWFESA-N 386.373 5.017 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(NC(=O)Nc2ccccc2)s1 410345141 PAXMMKBPLKUWJN-UHFFFAOYSA-N 391.496 5.763 30 20 GKED CC(C)(CC(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 413182037 WVPAJQHQFIXWFZ-INIZCTEOSA-N 376.834 5.615 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@](C)(c2ccc(F)cc2)C1 432082604 UNDSKCYQJZVUDZ-OPAMFIHVSA-N 397.519 5.415 30 20 GKED Cc1ccc(-c2ccc(Cl)cc2NC(=O)N(CCC#N)Cc2ccccn2)o1 434202957 LTWBIPOUJSPNRI-UHFFFAOYSA-N 394.862 5.251 30 20 GKED CC(C)Oc1ccc(NC(=O)Nc2ccccc2CCC(F)(F)F)cc1C#N 435546906 YQXYIHGQGWFICD-UHFFFAOYSA-N 391.393 5.484 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(C(=O)Nc1ccc(C(C)(C)C#N)cc1)C1CC1 437919990 XHUSJAYXQKPOOQ-GOSISDBHSA-N 397.522 6.398 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccnc(Oc2ccccc2Br)c1 438368202 ROOHHNHDHCXDNH-UHFFFAOYSA-N 390.281 5.066 30 20 GKED Cc1ccc(Br)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444034422 UKMUTWKQHZNSHB-UHFFFAOYSA-N 396.288 5.268 30 20 GKED N#CC(CCN[C@@H](c1ccccc1)[C@H]1CCOC1)(c1ccccc1)c1ccccc1 444672071 FCAFPNZUNDZEAN-OZXSUGGESA-N 396.534 5.254 30 20 GKED C=CCOc1ccc(Oc2cc(C(F)(F)C(F)(F)F)ncc2[N+](=O)[O-])cc1 447677769 WBHLRBJBBSOSRB-UHFFFAOYSA-N 390.264 5.001 30 20 GKED N#Cc1ccc(NC(=O)[C@H](Sc2ccc(F)cc2)c2ccccc2)cc1C#N 460113574 KHKMCBRIGADBQO-OAQYLSRUSA-N 387.439 5.041 30 20 GKED C[C@H](C(=O)Nc1cccc(Oc2ccnc3ccccc23)c1)c1cccc(C#N)c1 462076985 TYYNYFKEUFRSKC-KRWDZBQOSA-N 393.446 5.641 30 20 GKED COc1ccccc1[C@H](C)S[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1 463201074 ICPVSRZFBVMHTK-OALUTQOASA-N 396.556 5.442 30 20 GKED C[C@H](SCCC(=O)Nc1ccccc1C#N)c1ccc(Cl)c(Cl)c1 463206280 RMKXVPBQSFHJNI-LBPRGKRZSA-N 379.312 5.688 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 464471345 YGCLXODHPJPPQB-LJQANCHMSA-N 396.368 5.169 30 20 GKED COCC[C@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 467370214 NXHKUQZHMAVZDC-LJQANCHMSA-N 393.487 5.021 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1)c1ccccc1 475472483 PKOYMYZPYQXLGX-GOSISDBHSA-N 383.495 5.913 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H]1CCO[C@H]1c1ccc(F)cc1 475550100 NQRMLYMIZALTNT-CVDCTZTESA-N 396.506 5.577 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 476092076 USDUZSMZIAFLRW-UHFFFAOYSA-N 377.444 5.040 30 20 GKED N#CC[C@H](CC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 476529826 GCRPFMCZHQRXRI-SJLPKXTDSA-N 378.369 5.023 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@H](C)c2ncc(C(C)(C)C)o2)cc1 476534600 MEGWRBPQYYQDBR-OAHLLOKOSA-N 391.471 5.818 30 20 GKED C=CCOCCCS[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 479611870 HOTOGDKRRJMRBT-NSHDSACASA-N 381.847 5.012 30 20 GKED CC(C)c1nn(C)cc1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 482919604 KQDSJAALUYTHHT-UHFFFAOYSA-N 394.862 5.113 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1 483346921 LAIAQZJLPOAFKV-UHFFFAOYSA-N 376.406 5.685 30 20 GKED C=CCN(CCOC)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 483870717 ZUBNRUZJPVXGBK-UHFFFAOYSA-N 394.393 5.164 30 20 GKED C[C@H](NCc1ccc(C#N)c(F)c1)c1ccc(OCc2ccc(F)cc2)cc1 484082307 GNRUVUKSLNANAG-INIZCTEOSA-N 378.422 5.266 30 20 GKED C=CCN(C(=O)c1ccncn1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 487592784 PSEBGAFTPCLUPH-UHFFFAOYSA-N 398.491 5.100 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3csc(-c4ccccn4)n3)c2)cc1 498605998 KJXROBPEXNNTMZ-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CSc1ccsc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 499600353 NIRAKEVESZQGJK-LBPRGKRZSA-N 390.942 5.737 30 20 GKED N#CCCn1cc(CNCCc2ccc(Cl)cc2Cl)c(-c2ccccc2)n1 500024560 AOYSAEOUPDZTNE-UHFFFAOYSA-N 399.325 5.103 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)cc1 501000946 PNCCDZPBFONCDX-KRWDZBQOSA-N 376.481 5.174 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cccc(Oc4ccncc4)c3)CC2)cc1 503465485 FIGWGUJJDNFEEY-UHFFFAOYSA-N 396.450 5.067 30 20 GKED C[C@@H]1CCC[C@H](CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 504057812 JETNMCFMTTYDNT-QUCCMNQESA-N 376.500 5.487 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(OCc3ccccc3C#N)cc2)C1 504937911 XRBKWOAIYNOBCB-JOCHJYFZSA-N 396.490 5.075 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N[C@@H](c1c(F)cccc1F)C(F)(F)F 506924049 YEYADISEIIXINB-ZDUSSCGKSA-N 380.263 5.328 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2cc(Br)cs2)CC1 507570582 YNYXFCBOIQPDQM-UHFFFAOYSA-N 375.335 5.004 30 20 GKED C[C@H](NCc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(-c2cccc(C#N)c2)cc1 509008237 XSGLGVWAIICMNQ-AWEZNQCLSA-N 393.393 5.262 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 509969991 PRNACFWUUCPDAP-KRWDZBQOSA-N 383.561 5.188 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C(C)C 511381965 JTMRYKJBKMEFHS-UHFFFAOYSA-N 378.863 5.082 30 20 GKED Cc1c(C(=O)Nc2ccc(OC(F)F)cc2F)ccc(C(F)(F)F)c1F 512475413 UWIUEBRZSBYWLE-UHFFFAOYSA-N 381.247 5.146 30 20 GKED N#CC1(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)CCCCC1 512977449 MHAQYIUNQUJPQN-UHFFFAOYSA-N 393.434 5.165 30 20 GKED CCN(C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1)[C@@H](C)c1ccc(C#N)cc1 516209419 KYXOYCYKZRTSHT-RBUKOAKNSA-N 399.494 5.317 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)[nH]n1 518743032 JKBSVFVZWZNMCT-ZDUSSCGKSA-N 396.903 5.377 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc3c[nH]nc3c2)c1 522586338 JKPRQTIQZYNVLG-UHFFFAOYSA-N 388.814 5.133 30 20 GKED N#Cc1cc(Br)ccc1NCc1ccc(Oc2ccc(F)cc2)nc1 522900902 AWSWTDRSGDGQIY-UHFFFAOYSA-N 398.235 5.259 30 20 GKED C=CCN(C(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1nc2c(s1)CCCC2 524824542 YMQNDHDILJJPFJ-CHWSQXEVSA-N 390.911 5.137 30 20 GKED C=CCCO[C@@H](C)C(=O)N(Cc1ccc(-c2ccccc2OC)cc1)C(C)C 525081056 ZOFLANVMKFPCFG-IBGZPJMESA-N 381.516 5.080 30 20 GKED Cc1cc(-c2nnco2)ccc1NCc1cccc(OCc2cccc(C#N)c2)c1 533209588 IDTDQQQLHDUWTJ-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C[C@H](NCC#Cc1ccccc1Cl)c1cccc(OCc2ccccn2)c1 538152468 BHMPVZOORAWCNR-SFHVURJKSA-N 376.887 5.016 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(Cl)c(C#N)c1 542532325 PFSOHGFFMZESIA-UHFFFAOYSA-N 389.842 5.025 30 20 GKED CCOc1ccc(NC(=O)c2ccc(NCc3ccc(CC#N)cc3)cc2)cc1 544094909 FNJIBDGOCKKQAU-UHFFFAOYSA-N 385.467 5.016 30 20 GKED N#CCCCn1cc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c2ccccc21 553296841 SQRRIKJRQQYOFQ-LFAGZIFBSA-N 397.522 5.353 30 20 GKED N#Cc1ccc(CNc2ccccc2OC[C@@H]2CCCCO2)c(C(F)(F)F)c1 562575915 MRXZOURYIKZFDE-KRWDZBQOSA-N 390.405 5.137 30 20 GKED Cc1ccc(-c2csc(C(=O)[C@H](C#N)c3ccccn3)c2-n2cccc2)cc1 571845289 GPOIFFXKOCHJGF-GOSISDBHSA-N 383.476 5.399 30 20 GKED N#Cc1cccc(C2(C(=O)N3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)CC2)c1 581386873 RTDIGNHXMVCMCR-SFHVURJKSA-N 398.428 5.015 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)ccc12 588899391 VQPIRTNGKNPWPI-UHFFFAOYSA-N 395.418 5.165 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2SCc2ccco2)nc2ccccc12 589043090 OCQRTQRAWWKSTH-UHFFFAOYSA-N 385.448 5.244 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)ccc1F 590995247 FCIXNOMRTWKZRO-GFCCVEGCSA-N 378.350 5.253 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@@H]1CCC[C@H](C(F)(F)F)C1 591781587 URPGQFPSFXHLLH-KOLCDFICSA-N 389.286 5.648 30 20 GKED Cc1ccccc1Oc1cc(F)cc(F)c1NC(=O)N1CCC[C@@H](CC#N)C1 598658785 QMJYEWNIQSIDPP-HNNXBMFYSA-N 385.414 5.223 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CSc3ccccc3Cl)cn2)c1 603622691 WKZXZKLFKVDSOS-UHFFFAOYSA-N 395.871 5.130 30 20 GKED CCCn1c(S[C@H](C#N)Cc2ccccc2)nnc1-c1ccc(Cl)cc1 604008586 RURTZCQPIGQPDC-SFHVURJKSA-N 382.920 5.235 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(-c2nnc(-c3cccc(C)c3)o2)cc1 606815089 OJBJWMONPFUSOZ-UHFFFAOYSA-N 389.499 5.530 30 20 GKED Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(C)s1 609378303 BZDNVISXMXQVQE-UHFFFAOYSA-N 384.448 5.642 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)CSc2nc(C)c(C)c(C)c2C#N)o1 609984380 AAYSOFGBWIJPAH-IBGZPJMESA-N 397.544 5.016 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1 610019400 NWQPRGYUYURUTE-RLLQIKCJSA-N 393.556 5.471 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 610387557 LAERNMHJLGMPMS-LLVKDONJSA-N 385.558 5.419 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3c(Cl)cccc3Cl)cn2)c1 610472373 SDAJMCBXHHKBDO-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cn2)cc1 611096099 MCSUDTSCRLETDL-UHFFFAOYSA-N 398.249 5.613 30 20 GKED Cc1ccncc1[C@H](C)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 611299896 GEZVTBBDCLWESX-HNNXBMFYSA-N 391.858 5.198 30 20 GKED COc1ccc2oc([C@H](C)NCc3ccc(C#N)cc3Br)c(C)c2c1 612512641 VPDHEIHPYFRKGU-ZDUSSCGKSA-N 399.288 5.235 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)sc2C)cc1 613290721 KLUGPJUOIPVIHD-HXUWFJFHSA-N 398.487 5.770 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(C(=O)NC3CCCCC3)cc2)cc1 614056112 IDVSUDKSZSVOOD-UHFFFAOYSA-N 375.516 5.162 30 20 GKED COC1CCC(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 614808078 YKVCGOUSLQHXOE-NLPFYKDJSA-N 382.891 5.139 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cc[nH]c1C1CC1 649227798 NUWZAQYSJDEYDG-UHFFFAOYSA-N 394.290 5.434 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 665429262 OICHJYGOBJEDMH-BGYRXZFFSA-N 376.460 5.046 30 20 GKED N#C[C@H](C(=O)c1ccc2ncccc2c1)c1nc2cc(C(F)(F)F)ccc2s1 677560354 YZGSFQNKNXVIBZ-CQSZACIVSA-N 397.381 5.353 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 683150346 ZAXDYHJURAKINE-VIFPVBQESA-N 392.290 5.583 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccccc2CSc2nc3ccccc3[nH]2)c1 728536575 NOIWDHGQNQUNNY-UHFFFAOYSA-N 397.503 5.113 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 729070531 XCHXYEHTVZUIQD-CZUORRHYSA-N 389.282 5.225 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3ccc(C#N)c(Cl)c3)c2c1 730447831 SLWAKKDJEMAUTN-UHFFFAOYSA-N 398.853 5.383 30 20 GKED C#CCN(C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)C1CCCCC1 730487147 OTYGDLUYVGVIOU-UHFFFAOYSA-N 394.462 5.042 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(Sc2ccccc2)c1 731011732 BXRBMAAOJKPVQQ-UHFFFAOYSA-N 376.506 5.706 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2c1 731333042 WAJXKRIJULQBRS-CQSZACIVSA-N 391.496 5.198 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2ccnc3c(Br)cccc23)c1 733793364 XLWVNKYMSRELMZ-OAHLLOKOSA-N 396.288 5.290 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C)c2csc3ccccc23)c1 733803174 UXSUHYJGXRZLKD-RDJZCZTQSA-N 393.512 5.143 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)c2csc3ccccc23)c1 733803175 UXSUHYJGXRZLKD-WBVHZDCISA-N 393.512 5.143 30 20 GKED CC[C@H](NC(=S)NCc1cccc(-c2ccc(C#N)s2)c1)c1cccs1 739438367 WDDVMCYRAFXPFA-KRWDZBQOSA-N 397.594 5.464 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 742537691 NPCGONWHEKXTBW-MBSDFSHPSA-N 386.470 5.689 30 20 GKED CCOc1ccc(O)c(C=Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c1 743045176 YWBARHHSVCNNGH-HNNXBMFYSA-N 384.476 5.127 30 20 GKED COc1cc(C(C)=NNc2ccc(C(F)(F)F)cn2)ccc1SC(F)F 746486441 AJPXNGHIJDKJLF-UHFFFAOYSA-N 391.365 5.260 30 20 GKED COc1ccc(/C=C2/CSc3ccc(Cl)cc3C2=O)cc1OCCCC#N 747361691 WNHZUZUELXZPGJ-GDNBJRDFSA-N 399.899 5.403 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@H](C)ON=Cc1ccccc1C(F)(F)F 749352577 KFDGFLIUHKQJEL-LBPRGKRZSA-N 384.785 5.045 30 20 GKED COc1cc(/C=C\C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1O 750917005 QSTNFSRCJYEVJP-RQOWECAXSA-N 390.279 5.335 30 20 GKED N#Cc1cc(F)ccc1NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F 751554878 SZRICJMPWXXWJK-QGZVFWFLSA-N 377.341 5.085 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1sc(Oc2ccccc2)nc1Cl 754712186 FFAHRXLVVAMRAK-UHFFFAOYSA-N 398.793 6.021 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3nccn3Cc3ccccc3)c2)cc1 755948480 AWXWKABZRARHAZ-UHFFFAOYSA-N 380.451 5.207 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 756242772 OKOUPKVALIMDID-RDTXWAMCSA-N 396.512 5.554 30 20 GKED COc1cc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)ccc1OCC#N 760262541 BCXCFEYFOKPPEF-DHZHZOJOSA-N 394.279 5.178 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F 767942258 PWCRZCUCWLDCIW-QGZVFWFLSA-N 395.475 5.082 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2cc3ccccc3[nH]2)cc1 771464359 RZKLGPRDXPMSJS-QHCPKHFHSA-N 394.478 5.188 30 20 GKED C#CCOc1ccccc1NC(=O)[C@H](C)Sc1ccnc2cc(Cl)ccc12 775942802 NUSREPJBSNWQSH-AWEZNQCLSA-N 396.899 5.020 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2cc3ccccc3o2)C(C)C)ccc1OC 776309687 LOYMBDXGXDXHSE-YADARESESA-N 392.499 5.609 30 20 GKED CC(C)(C#N)CCOC(=O)c1ccc(Cl)cc1SCCC(C)(C)C#N 776399377 VGZPTLIDTJUZEX-UHFFFAOYSA-N 378.925 5.469 30 20 GKED C=CCC[C@H](C(=O)O[C@@H](C)c1nnc(-c2ccc(C)cc2)o1)c1ccccc1 778550923 FCBMCNJXVPAAHR-PXNSSMCTSA-N 376.456 5.399 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1cc(Cl)cc(Cl)c1 782245284 LPXHHJANDKDDLZ-UHFFFAOYSA-N 395.340 5.048 30 20 GKED CC(C)[C@@H](CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782708005 BINPISPFLSPPOL-RBUKOAKNSA-N 389.421 5.441 30 20 GKED O=C(/C=C\c1cc(-n2ccnc2)cs1)c1ccc(SCC(F)F)cc1 783710707 MGBMBHKXAZEHNS-WAYWQWQTSA-N 376.453 5.187 30 20 GKED CCc1cc(Br)ccc1NN=C(C)c1c(C)nn(C(C)C)c1C 783872462 ZMHCZHMJIVKITO-UHFFFAOYSA-N 377.330 5.242 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCc2sc(Br)cc21 788356990 YHDVZFOBOMNMHI-UTCJRWHESA-N 394.237 5.198 30 20 GKED C#Cc1cccc(N(CC)C(=O)CCc2ccccc2NC(=O)OC(C)(C)C)c1 790901642 HGGSXEDXLWSLJM-UHFFFAOYSA-N 392.499 5.001 30 20 GKED CCOC(=O)c1csc([C@@H](C#N)C(=O)C2(C3CCCCC3)CCCCC2)n1 796658021 IJUQCGMZXARLLO-INIZCTEOSA-N 388.533 5.027 30 20 GKED C=CCn1c(SCc2ccc(Cl)s2)nnc1-c1ccc(OC)cc1 799197602 ZHADKCHQMCZCKS-UHFFFAOYSA-N 377.922 5.147 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cncc(C(F)(F)F)c2)cc1 808240014 PJYGKNDIPVEYME-LJQANCHMSA-N 381.357 5.008 30 20 GKED CCN(C(=O)c1cc(F)c(C(F)(F)F)cc1F)c1ccc(C#N)c(Cl)c1 808624865 ANHHMWXCVXOROJ-UHFFFAOYSA-N 388.723 5.175 30 20 GKED Cn1c([C@H](C#N)C(=O)C2(Cc3cccs3)CCCCC2)nc2ccccc21 810520627 YRVGKMHYLSKKOO-QGZVFWFLSA-N 377.513 5.004 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1cc(C(F)(F)F)ccn1 813214392 WMAZUFLOFYWMCK-IBGZPJMESA-N 378.353 5.162 30 20 GKED N#CCCC[C@H](NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1ccccc1 817318938 IZSOQQUMOFGDMW-ZWKOTPCHSA-N 378.369 5.267 30 20 GKED CC(C)(C)C(=O)CCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835073041 IXVPMIRNASZQIR-LBPRGKRZSA-N 396.434 5.277 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cc(C4CC4)cnc3Cl)c2C#N)CC[C@H]1C 839390970 ONYVQQACWGVKRP-MNOVXSKESA-N 385.920 5.484 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(NC(=O)OC(C)(C)C)cc1 863471302 QDBPPYHNYBEPEH-GOSISDBHSA-N 393.487 5.084 30 20 GKED O=C(Nc1cccc(C/N=C\c2cc(Cl)cc(Cl)c2O)c1)C1CCC1 914599357 FLFWMYCYIUWTQB-JJFYIABZSA-N 377.271 5.057 30 20 GKED COc1ccc2[nH]cc(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2c1 915282777 WRJOTWNDUSJYAK-QHCPKHFHSA-N 395.462 5.013 30 20 GKED CC(=O)N(c1cccc(Cl)c1)c1nc(C=NNc2cccc(C)c2)cs1 916256232 PZKHTJCNLGBCGF-UHFFFAOYSA-N 384.892 5.236 30 20 GKED C=CCN(C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)C(C)C 916707563 TUAKQFRMZQOEEU-UHFFFAOYSA-N 383.439 5.181 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc(Cl)cc(Cl)c1 916900558 QEHPZSPJFCPSBH-KRWDZBQOSA-N 389.282 5.079 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 917426451 LRLIOFXCHSPMRA-RGJVZEKDSA-N 396.446 5.230 30 20 GKED Cc1ccc2c(c1)C/C(=C/c1cn(-c3ccccc3)nc1-c1ccncc1)C2=O 921264123 PBYGYTVQVYOKSB-HKWRFOASSA-N 377.447 5.065 30 20 GKED C=C(Br)CSc1nc(O)c2c(C[C@@H](C)CC)c(C)sc2n1 1559353013 NFTUMELVCOLPKS-QMMMGPOBSA-N 387.368 5.295 30 20 GKED CC(CC1(C(=O)O)CCC1)=NNc1ncnc2scc(-c3ccc(C)cc3)c12 1776022630 AAUDLUFFJPWKEJ-UHFFFAOYSA-N 394.500 5.100 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NNc1ccc(Cl)c(Cl)c1 1776032669 IQPHPBCVGSSGPT-ZDUSSCGKSA-N 395.286 5.266 30 20 GKED CC(C)(C)C1CCN(N=Cc2ccc(-c3cccc(CC(=O)O)c3)cc2)CC1 1776058024 ZNHNGIFQMXJUHS-UHFFFAOYSA-N 378.516 5.073 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(SCc3ccccc3)cc2)ccc1F 1776062324 OFZXPMZHFPEVTF-UHFFFAOYSA-N 380.444 5.262 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)o2)cc1 1776125572 LYHDQBAZJSWFFJ-QXGSCYJRSA-N 396.483 5.869 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)c1 1776341447 NVWHGXIQYSEPCL-CLFYSBASSA-N 387.273 5.242 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1)C(=O)O 1776469765 HJSRAKAWMYOSHJ-LLGDCAAFSA-N 399.657 5.395 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2ccccc21 1776526457 GMWYLDIFMAORIJ-RCCKNPSSSA-N 382.459 5.999 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(O[C@H](C(=O)O)c3ccccc3)c2)s1 1776966064 SVWPQBJBAPUBNU-SDNYCIMKSA-N 392.476 5.411 30 20 GKED COc1ccccc1-c1nc2ccc([N+](=O)[O-])cc2c(-c2ccccc2)c1C#N 15454031 HGYUBWXSBGYKGO-UHFFFAOYSA-N 381.391 5.357 30 20 GKED C=CCN(C(=O)c1ccoc1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 26866115 WENJSSAIIMSDRM-UHFFFAOYSA-N 379.268 5.543 30 20 GKED N#C[C@H](C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nc2ccccc2[nH]1 46440923 SRMMVVJDMFMSBU-GFCCVEGCSA-N 397.278 5.091 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 47571352 XCDUSMURDKCZAM-UHFFFAOYSA-N 388.515 5.275 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1oc2ccccc2c1C 47974641 VUNAYKOWTYGSBC-UHFFFAOYSA-N 383.407 5.361 30 20 GKED N#C[C@@H](C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1)c1ccccn1 49457912 ASVQCNXCDRUTHV-GOSISDBHSA-N 384.332 5.397 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c2nc(-c3ccccc3)no2)n1 53064585 JYJLYIRTDPELOL-NSHDSACASA-N 390.390 5.184 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 97169162 FYWICMMIQBELNB-VQTJNVASSA-N 386.417 5.118 30 20 GKED N#CCCSc1ccccc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 108200238 WTNUKWYETJIGPB-HNNXBMFYSA-N 378.419 5.367 30 20 GKED Cc1cccnc1[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)C(C)C 115622663 URSAPEXRRFXOCS-DEOSSOPVSA-N 385.511 5.328 30 20 GKED C=C[C@H](CC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 136643803 UVQATGBOKNDYKC-CJNGLKHVSA-N 387.266 5.001 30 20 GKED Cc1noc(C2CC2)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 152882707 ULRNQWNXBICSHZ-UHFFFAOYSA-N 393.830 5.430 30 20 GKED C[C@H](C(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Br)s1 173375255 UTJPQRDJDTULHU-NSHDSACASA-N 377.307 5.054 30 20 GKED Cc1sc([C@H](C)NC(=O)c2cccc(CC#N)c2)nc1-c1ccc(Cl)cc1 176335013 DUHYXRGXCFGOPQ-ZDUSSCGKSA-N 395.915 5.329 30 20 GKED C=CCCC[C@@H](C)NC(=O)Nc1cccc(C[S@](=O)Cc2ccccc2)c1 179634651 BROSCYGIGQPPOF-DNOBIOAJSA-N 384.545 5.002 30 20 GKED Cc1nc(C(F)(F)F)c(CN[C@@H](c2cccc(F)c2F)C(F)(F)F)s1 183668910 ZZNDBUDPRVGXEO-NSHDSACASA-N 390.299 5.142 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nnc(C2CC2)n1Cc1ccccc1 186390563 UDWWLEZRBHUMGX-UHFFFAOYSA-N 380.904 5.021 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCc2cc(Cl)ccc2C1 192216538 JTEGQKKOBCQBBD-AWEZNQCLSA-N 385.920 5.182 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nnc1-c1ccccc1F 195568917 BJRRVMNCAFCKKG-UHFFFAOYSA-N 382.489 5.172 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)cc1OCCCC#N 237300752 CGGFUXBUXUFLDW-QHCPKHFHSA-N 398.934 5.662 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3c(Cl)cc(F)cc3Cl)n2)c1 431920905 HVUOMTGRHDRBFL-UHFFFAOYSA-N 392.242 5.380 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc2c(c1)OC1(CCCC1)O2)c1ccccc1 432624493 VKIXZROOYSEKEN-IBGZPJMESA-N 391.471 5.285 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(F)F 433145341 PVJAGVFWUJAPTE-GUYCJALGSA-N 375.444 5.209 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 433306258 RVAAAMXYNSBBBR-WIYYLYMNSA-N 394.927 5.380 30 20 GKED CC(C)(C#N)CCCCSCc1nc(-c2cccc(C(F)(F)F)c2)no1 435884104 NYIQOCUNBTXKQE-UHFFFAOYSA-N 383.439 5.709 30 20 GKED CSc1ccc(CCNC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 436350108 FOIRABAERKERRT-OAHLLOKOSA-N 385.558 5.024 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC2(CCCCC2)C1 437840511 KAAQCPPHAYBZFN-UHFFFAOYSA-N 389.499 5.847 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](Cc1ccccc1)c1cccs1)c1ccccc1 438856258 KQVDALGHFIAVJL-SFTDATJTSA-N 389.524 5.376 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1ccc(Br)s1 440840380 GCXVZGPOMUZFSX-NSHDSACASA-N 382.348 5.280 30 20 GKED C[C@H](SCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1cccc(C#N)c1 443156947 PRUROISOMHDTNA-NSHDSACASA-N 390.295 5.909 30 20 GKED N#CCCCn1cc(C(=O)Nc2cc(Cl)cc(Cl)c2O)c2ccccc21 444344066 PBTUHFLNMAHEGR-UHFFFAOYSA-N 388.254 5.210 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccccc2CC(=O)OC(C)(C)C)CCCC1(C)C 444923131 GEELGHJRIVQNOU-LJQANCHMSA-N 386.536 5.169 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccccc1Cl)c1ccccc1 458798384 HZUYFYAAJQQDQR-NHCUHLMSSA-N 381.907 5.622 30 20 GKED C=CCOCCCC(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 463842942 VNENZWRYLXTVNU-HSZRJFAPSA-N 394.540 5.217 30 20 GKED N#Cc1cccc(-n2ccc(C(=O)Nc3cc(-c4ccccc4)ccc3Cl)n2)c1 466354590 YPOLJGHTOAIMEJ-UHFFFAOYSA-N 398.853 5.317 30 20 GKED C=CCN(C(=O)c1cc(C(F)(F)F)ccc1F)c1nc2c(s1)CCCC2 471107420 QEBTXPXBMPFTNU-UHFFFAOYSA-N 384.398 5.013 30 20 GKED CCCCn1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(C)n1 472637615 UUMFPDHEYSZQLX-UHFFFAOYSA-N 392.434 5.047 30 20 GKED CCO[C@@H](CCNC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CCCC1 473637111 AOLFGULJFFHLNA-LPHOPBHVSA-N 389.565 5.188 30 20 GKED COc1ccc(CN[C@@H](C)c2cc3cccc(F)c3o2)cc1OCCCC#N 473980622 AOSAMIOQEBJVKD-HNNXBMFYSA-N 382.435 5.114 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1sc(-c2ccccc2)nc1C 476080261 NZSWBNJKQAMCAV-UHFFFAOYSA-N 376.525 6.223 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(COCC2CC2)c1 480795836 FVTSCZYEDLQLTK-UHFFFAOYSA-N 390.936 5.548 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2F)c2ccccc2)cc1 482579527 KGNPRFRLQROQCS-UHFFFAOYSA-N 376.456 5.023 30 20 GKED CC(C)(C)[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CCO1 483000275 ZTCSUDRLBYRWDP-WIYYLYMNSA-N 393.487 5.066 30 20 GKED N#CC[C@@H](CC(=O)Nc1c(F)cc(F)cc1-c1ccccc1)c1ccccc1 483348756 MZSRIFJDLFVDOV-SFHVURJKSA-N 376.406 5.658 30 20 GKED C[C@H](Oc1ccccc1C(F)(F)F)C(=O)N[C@H](CCCC#N)c1ccccc1 487214970 AKIRTKWGYPWJGC-MAUKXSAKSA-N 390.405 5.024 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1COCc1ccccc1)c1ccc(C#N)cc1 505311278 QDEVXBVGBNTDKG-GOSISDBHSA-N 385.467 5.158 30 20 GKED Cc1cc(F)cc2c1CN(C(=O)Nc1ccccc1S[C@H](C)CC#N)CC2 505324743 JKRLNNLGIKEVCP-OAHLLOKOSA-N 383.492 5.119 30 20 GKED C=C(C)CCSc1nnc(CNc2cccc(OC)c2)n1C1CCCCC1 505488825 XKLIIGOUQBTVPW-UHFFFAOYSA-N 386.565 5.462 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@@H]2CCOc3c(-c4ccccc4)cccc32)c1 509068394 XSEFHTQILSHZGJ-OAQYLSRUSA-N 388.854 5.132 30 20 GKED N#Cc1cnc(Sc2nnc(-c3ccco3)n2C2CCCCC2)c(Cl)c1 513639671 DXINGBJELVWHJC-UHFFFAOYSA-N 385.880 5.115 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 514868986 FVLBFODSUOJDSS-LPHOPBHVSA-N 397.544 5.562 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3oc4ccccc4c3C)n2)cc1 516714161 RITRHZNTONDYEG-QGZVFWFLSA-N 388.448 5.363 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cccc(Cl)c3F)cc2)cc1 517653193 KYVVIXZQWRQSLR-UHFFFAOYSA-N 380.806 5.590 30 20 GKED CCOc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cc1OC 520612109 DWEABXLRQIUFOM-UHFFFAOYSA-N 388.423 5.010 30 20 GKED N#CCc1cccc(C(=O)N(c2cccc(Br)c2)C2CCCCC2)c1 523512662 LTOUSCHZLQBXJE-UHFFFAOYSA-N 397.316 5.495 30 20 GKED COCc1ccccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523878513 WXUVUGQNSIEIRH-UHFFFAOYSA-N 392.842 5.403 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 524572669 LRDDPMRSCDFKOK-LBPRGKRZSA-N 392.267 5.013 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1C[C@H]1c1c(F)cccc1Cl 524822821 PKLMGECPJDASEK-NQIIRXRSSA-N 390.845 5.304 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)C1 527244462 LUQMHACKSXWAJO-IFMALSPDSA-N 394.490 5.134 30 20 GKED CC(C)c1nc2cc(NC(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)ccc2o1 531221187 LTUUKXPFOPJZSF-UYAOXDASSA-N 388.471 5.255 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3ccc(CC#N)cc3)s2)cc1 533948379 USHOWKWQNLWMNN-QGZVFWFLSA-N 389.524 5.326 30 20 GKED Cc1ncc(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)c(Cl)c1Cl 540317134 GIECFHPQWXYJNN-UHFFFAOYSA-N 396.277 5.166 30 20 GKED N#C[C@@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1c(Cl)cccc1Cl 542148044 DZECLAHZEPTUCZ-QIMFLAQGSA-N 393.236 5.433 30 20 GKED C[C@@H](NCc1ncc(Cl)cc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 543876184 SREDXRKMDIFCKD-CQSZACIVSA-N 382.294 5.778 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(F)c2ccccc2c1 549741174 KJTCYZIDKPXQDP-UHFFFAOYSA-N 397.409 5.599 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC[C@H](c4cccc(C(F)(F)F)c4)C3)cc2)CC1 557074011 GMBJEXVHRSUJRJ-SFHVURJKSA-N 398.428 5.280 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)Nc1ccccc1CC#N 558190472 OOGMNGUQLCOKIL-CYBMUJFWSA-N 381.888 5.074 30 20 GKED Cc1cc(C(=O)N(CCC#N)Cc2ccco2)sc1-c1cccc(Cl)c1 558901487 ODHKZJJMXYSSMZ-UHFFFAOYSA-N 384.888 5.526 30 20 GKED C=CCOc1cccc(NC(=O)c2cc(Cl)cc(F)c2Br)c1 559489760 LWRPYCXOIAWYMC-UHFFFAOYSA-N 384.632 5.059 30 20 GKED C=CCn1c(SCc2ccc(C(F)(F)F)cn2)nnc1-c1cccc(C)c1 559976054 MPCICUDUTIODJJ-UHFFFAOYSA-N 390.434 5.146 30 20 GKED Cc1ccc(C(=O)Nc2cc(C#N)c3ccccc3n2)c(Sc2ccccc2)n1 564190987 RNUNTZPORODSFU-UHFFFAOYSA-N 396.475 5.213 30 20 GKED N#Cc1ccc(C2(NC(=O)Nc3cc(C(F)F)ccc3Cl)CCC2)cc1 594084161 OJGAWYCJSBLWLH-UHFFFAOYSA-N 375.806 5.350 30 20 GKED Cc1ccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C#N 600648625 PXHAHVPQXKHHMU-INIZCTEOSA-N 395.553 5.133 30 20 GKED N#Cc1c(NC(=O)c2cc(F)c(F)c(F)c2F)sc2c1CCCCCC2 603996096 IZOFTQTWAAWNKR-UHFFFAOYSA-N 382.382 5.087 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604459685 CHPMFIQUVDUIJG-MRXNPFEDSA-N 389.430 5.237 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4ccsc4[nH]3)cc2F)c1 609109782 ARYPQCGHAFKZGP-UHFFFAOYSA-N 391.427 5.071 30 20 GKED Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)CSCc2ccc(C#N)cc2)cc1 609979871 ZUBWBAAYHJOUOO-MBSDFSHPSA-N 378.541 5.100 30 20 GKED C[C@]1(C#N)CCCN(C(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)C1 612367618 RMQLIVFDEFPPRX-JOCHJYFZSA-N 395.572 5.332 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CCC(C#N)(c2ccccn2)CC1 619804037 VTQNLAQXXAUFDN-UHFFFAOYSA-N 396.922 5.122 30 20 GKED C=CC(C)(C)CCNC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 628313796 AMTATZIZYSOXFV-UHFFFAOYSA-N 396.318 5.085 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C[C@@H]1CCCO1)C(F)(F)F 654046931 HCFZMBFQNBIMKA-DOTOQJQBSA-N 384.442 5.160 30 20 GKED N#C[C@@H](C(=O)c1cccc(N2CCCC2)c1)c1nc2cc(Cl)ccc2s1 659053926 UTGASFBGMGXPNB-INIZCTEOSA-N 381.888 5.040 30 20 GKED Cc1cc(C(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc(C)c1F 677856655 SZYNYJOLMPSALQ-ITGUQSILSA-N 385.323 5.082 30 20 GKED N#Cc1ccc(N2C(=O)/C(=C/c3cccc(Cl)c3)SC2=S)cc1Cl 726627593 SBVJXSCOPGEWMB-CHHVJCJISA-N 391.304 5.271 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1ncc(-c2cccc(Cl)c2)o1 727470127 CVOXKPQGMRYPBO-UHFFFAOYSA-N 380.753 5.565 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 727953877 IAECSIIJROKXEB-MLGOLLRUSA-N 389.282 5.007 30 20 GKED COc1cc(/C=C/C(=O)c2cncc(F)c2)ccc1OCc1ccc(Cl)cc1 737446630 YVQZFRUIMGHDLT-XBXARRHUSA-N 397.833 5.358 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 741641271 JEEBHFAPFRLAOA-UHFFFAOYSA-N 394.254 5.612 30 20 GKED COc1ccc(CNC(=S)Nc2c(C(C)C)cccc2C(C)C)cc1C#N 746532215 ILXLQXHGFHFOOQ-UHFFFAOYSA-N 381.545 5.300 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12 756514534 DCQJQVLUIXYDEX-RXHHAWBHSA-N 388.854 5.244 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760915938 SMURAWYLIXCIBN-WMZOPIPTSA-N 375.394 5.195 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2oc3ccc(OC)cc3c2C)c1 772982274 BKOVKGSLAAAZAY-FUHWJXTLSA-N 378.472 5.282 30 20 GKED CC[C@@H](NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)cc1 774234952 YQAJXKBWXAYOSY-VGOFRKELSA-N 393.531 5.385 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cc(Cl)ccn1 775322479 UYLWACDTVUHFNF-UHFFFAOYSA-N 392.846 5.029 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccc(OCC2CCCCC2)cc1 780165897 IWJPCPBJDRNXQN-KRWDZBQOSA-N 378.472 5.189 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)c1 788361314 ZKSCVYVJZQCPIA-ALCCZGGFSA-N 395.827 5.139 30 20 GKED N#C[C@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nccc2ccccc12 792094591 GFOOQTCAYRJSCF-OAHLLOKOSA-N 389.307 5.802 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792097943 ZGEBJWHLHRHAEC-ACJLOTCBSA-N 383.278 5.597 30 20 GKED N#C[C@@H](C(=O)[C@H](Oc1ccccc1)c1ccccc1)c1nccc2ccccc12 792102868 IHILSEDDFPYHHK-RCZVLFRGSA-N 378.431 5.231 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3)s2)cc1 792925092 IPYVIJYIOSRANY-ZRDIBKRKSA-N 379.456 5.152 30 20 GKED CC(C)(C#N)CCCOC(=O)C(C)(C)c1csc(-c2c(F)cccc2F)n1 795947564 RTQAWGKGHJAXCZ-UHFFFAOYSA-N 392.471 5.239 30 20 GKED COc1ccc(-c2nc(/C=C3\CCc4cc(OC)ccc4C3=O)cs2)cc1 797091120 BEUSJMZMFMBHOD-LFIBNONCSA-N 377.465 5.040 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(OC(F)(F)Cl)cc2)s1 797573031 NFQVROMVSVURDM-LBPRGKRZSA-N 384.835 5.099 30 20 GKED Fc1ccc(-c2csc3ncnc(NN=C4CCCc5cccnc54)c23)cc1 799107956 LNACHFJACPUWIC-UHFFFAOYSA-N 389.459 5.045 30 20 GKED C[C@H](Nc1nc(Cl)c(C#N)s1)c1cccc(NC(=O)c2ccccc2)c1 804349571 MPSOLBGXXSXTTB-LBPRGKRZSA-N 382.876 5.094 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 806201291 WFHYFSAWKOUPFL-HXUWFJFHSA-N 388.471 5.004 30 20 GKED COCc1ccccc1/C=C(C)/C=C/C(=O)c1cnn(-c2ccc(C#N)cc2)c1C 814190360 RMAYQGRKVIJALD-KHDGVMNXSA-N 397.478 5.041 30 20 GKED CCCCCCCC(=O)N(CCC)Cc1nc(O)c2ccc(Cl)cc2n1 834811294 WASCZEICFBJONC-UHFFFAOYSA-N 377.916 5.088 30 20 GKED CC(C)(CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC(F)(F)F 854303306 KIWBPXKADLTVDJ-GOSISDBHSA-N 389.421 5.442 30 20 GKED C=CC[C@@H](OC(=O)C1(C(F)(F)F)CCOCC1)c1ccc(Cl)c(Cl)c1 857616749 UHWOWZVGCUNDNJ-CQSZACIVSA-N 397.220 5.513 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](c2ccccc2)C2CC2)cc1 915352757 KAEXNOGPZKUZCU-ZEQRLZLVSA-N 381.479 5.615 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNCc1cc(F)ccc1F 915980506 YJQNOGWHDYKMDS-UHFFFAOYSA-N 388.849 5.051 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3ccccc3OCc3cccnc3)oc12 915984663 BBWTZZXHGDICID-QXMHVHEDSA-N 385.419 5.312 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)c1 916847941 XCQBQNBVZAQXGC-QGZVFWFLSA-N 390.508 5.451 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(CSC)cc2)cc1 916947221 HARNCCUKJJJVKC-MGPUTAFESA-N 380.513 5.024 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C\Sc2ccccc2)cc1 916953541 DAYCKIQANMVCPC-KYLMHTFMSA-N 378.497 5.153 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CCC1)c1nc2cc(Cl)ccc2s1 917047102 QZXRKQHVPUTITH-OAHLLOKOSA-N 384.863 5.387 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc(C)c(Br)s1 1776033876 SFXZHHFWBZECMR-UHFFFAOYSA-N 387.686 5.007 30 20 GKED CC(C)(C)[C@H]1C/C(=C\c2cccc(C#N)c2)c2nc3ccccc3c(C(=O)O)c2C1 1776121592 OLCPXTFFBFLKMI-GQEMFKIVSA-N 396.490 5.954 30 20 GKED Cc1oc(/C=C\C(=O)c2ccccc2Oc2cccc(Cl)c2)cc1C(=O)O 1777559581 QTQHSGJJFPCUFR-KTKRTIGZSA-N 382.799 5.628 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 41539649 VZTIHQRHKZIJPR-JXFKEZNVSA-N 382.419 5.139 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N[C@H](C)c3ccc(C#N)cc3)c2)C1 63398371 WTWTYHVWZYAQBK-PNCHPQGNSA-N 391.515 5.536 30 20 GKED C[C@@H](NC(=O)NCCSCc1cccc2ccccc12)c1ccc(C#N)cc1 65553095 RGKSKFMQEMHXQJ-QGZVFWFLSA-N 389.524 5.005 30 20 GKED N#CCCSc1ccccc1NC(=O)CCc1cccc(OC2CCCC2)c1 78668990 NHFXAJBUMVPHDH-UHFFFAOYSA-N 394.540 5.585 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3ncc(C)o3)n2)o1 151050764 AJIASSITMIDNNY-UHFFFAOYSA-N 379.363 5.129 30 20 GKED C#Cc1cccc(N(C)Cc2csc(N(C(C)=O)c3cccc(C)c3C)n2)c1 165451064 GGABCDUCXZFVKA-UHFFFAOYSA-N 389.524 5.062 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C[C@H](O)c1cccs1 191420340 XSHGAGFDYZNFKL-QUCCMNQESA-N 398.572 5.720 30 20 GKED N#Cc1ccc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c(F)c1 301217166 ZPSKJOLJBIULHD-UHFFFAOYSA-N 382.442 5.221 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1N1CCC[C@@H](c2nc3ccccc3o2)C1 301528514 OGDOSEZIILILDD-CQSZACIVSA-N 388.858 5.285 30 20 GKED C[C@@H](/N=C(/O)N[C@H]1CCCc2ccc(F)cc21)c1ccc2c(c1)CCC(O)=N2 329952381 IRUORCBTLFWPLF-XCLFUZPHSA-N 381.451 5.002 30 20 GKED N#CC1(CCCNc2ccc(CSc3ccc(F)cc3)cc2)CCOCC1 417068731 OABFVVPMNVJBSP-UHFFFAOYSA-N 384.520 5.630 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1C[C@H](C)C[C@@H]1c1cccc(OC)c1 424237300 GFAYORCIAPGLRS-AHRSYUTCSA-N 398.576 5.018 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](Cc4ccccc4)C3)cc2)c1 438066504 QWEZENLCXITHRH-NRFANRHFSA-N 397.478 5.447 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H]2Cc2ccccc2)cc1 443850395 FUNXWBAVXXRSEQ-NRFANRHFSA-N 383.451 5.199 30 20 GKED CC1(C)CN(C(=O)c2cn(CCCC#N)c3ccccc23)C[C@H]1c1ccccc1 444270539 VITLSJGBKFXZHB-QFIPXVFZSA-N 385.511 5.211 30 20 GKED Cc1ccc(C(=O)c2ccsc2NC(=O)c2cccc(SCC#N)c2)cc1 448452165 KMUKXMZPTOKCNL-UHFFFAOYSA-N 392.505 5.156 30 20 GKED COc1ccc(-c2ccc(NC(=O)[C@@H](C)c3cccc(C#N)c3)nc2)cc1Cl 462334700 RTQIFJOMQHZOBX-AWEZNQCLSA-N 391.858 5.024 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 464162169 YJVUFDJKLXTWHI-OAQYLSRUSA-N 381.863 5.062 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cc1 465528132 SJYKUPZYRYEXEA-TZYHBYERSA-N 391.515 5.016 30 20 GKED C=CC[C@H](C)NC(=O)N[C@@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466250370 OWTVYTRSVSJVFS-DJJJIMSYSA-N 376.472 5.040 30 20 GKED CCn1c2ccccc2c2cc(NC(=O)[C@@H](C#N)Cc3ccc(C#N)cc3)ccc21 470712611 BJSNMLCXNFLUFN-LJQANCHMSA-N 392.462 5.007 30 20 GKED C=C[C@@](C)(CCOC)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 473953983 WPVOYYISRSAUAL-RBZFPXEDSA-N 392.952 5.178 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2c(F)cc(F)cc2[C@@H]1C 475580573 FVHVELDCGZSRBD-HNNXBMFYSA-N 384.470 5.968 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)N2CCC(F)(C#N)CC2)c2cccs2)cc1 476839783 ATIQZQCSQOSKBH-JXFKEZNVSA-N 399.535 5.388 30 20 GKED C=C(C)[C@@H](NC(=O)N(C)[C@@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 477727650 SCXHMZVSKKNKIU-HXPMCKFVSA-N 380.385 5.263 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cccc(Br)c1C 480533668 USLCWSTUWRURFZ-UHFFFAOYSA-N 386.333 5.791 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccc(COc3ccccc3)cc2)no1)c1ccccc1 481901648 FTMSQXOXMDWFHA-QFIPXVFZSA-N 395.462 5.556 30 20 GKED N#C[C@@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1nccc2ccccc12 483232891 HYVVYWUUWMEEKA-HSZRJFAPSA-N 378.431 5.304 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1 487562654 FRHHMMCPQONDOX-QHCPKHFHSA-N 397.478 5.104 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cnn(CCC(C)C)c1C(C)C 487605100 HPBBVRBEKJIESE-UHFFFAOYSA-N 398.551 5.281 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 494750641 GKDABLRXOZLYJA-SOBQPUOHSA-N 379.529 5.648 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1 502590373 DHPLYEYSUIJRBB-HNNXBMFYSA-N 392.952 5.648 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)Cc2ccc(C#N)cc2)cc1 504404979 YBENWALGKXCPGD-UHFFFAOYSA-N 392.842 5.194 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@H]3CC[C@@H](C(F)(F)F)C3)cc2)c1 510843896 YCWIREMOJOVWFT-DLBZAZTESA-N 388.389 5.054 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 510886137 ADKBPLZJJLNIBY-IBGZPJMESA-N 399.494 6.192 30 20 GKED C=CCN(C(=O)C[C@@H]1CCCc2cc(OC)ccc21)c1nc2c(s1)CCCC2 512595242 LWTHNSDNECRAGO-KRWDZBQOSA-N 396.556 5.060 30 20 GKED COc1cc(CN[C@@H](c2ccccc2Cl)c2ccccc2OC)ccc1C#N 515227915 ARVNKQJQHFLGHD-QHCPKHFHSA-N 392.886 5.108 30 20 GKED C=CCn1c(SCC(=O)c2cccc(Cl)c2)nnc1-c1cccc(C)c1 515302399 OHRLCMZWOMLAGG-UHFFFAOYSA-N 383.904 5.068 30 20 GKED N#Cc1ccc(CC(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)cc1 518311661 YKUAVFFIAWPFRJ-SANMLTNESA-N 376.459 5.160 30 20 GKED C=CCn1c(CCN2CCCCC2)nnc1S[C@H](C)c1c(C)cc(C)cc1C 518841939 QEGHFTMMAPBSEK-HXUWFJFHSA-N 398.620 5.271 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1)OCC 535969888 YKJJYMVTDOKSAB-SFHVURJKSA-N 384.476 5.412 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)N(Cc2cccs2)C2CC2)cc1 539210397 IBMTWEYTRZCIQK-UHFFFAOYSA-N 387.508 5.161 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H]1CCCOc2cc(Cl)ccc21 540502502 MDSSAAFLEPODSF-KRWDZBQOSA-N 376.909 5.013 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 554399083 MKDBPKAQUZSBME-LJQANCHMSA-N 394.906 5.447 30 20 GKED C=CCC[C@H](Nc1ccc(C)c(NC(=O)CN2CCCCC2)c1)c1ccco1 556891258 CVUZMWPAKIHDBH-FQEVSTJZSA-N 381.520 5.132 30 20 GKED COc1ccc(CN2CC[C@@H](c3cccc(Cl)c3)C2)cc1OCCCC#N 556909388 BHGANRCKKLAQKE-LJQANCHMSA-N 384.907 5.021 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@H]3C)c1C1CC1 582287345 SXPGJNHUBBPISY-CHWSQXEVSA-N 382.533 5.042 30 20 GKED CC1(C(=O)Nc2ccc3ccoc3c2)CCN(c2ccc(Cl)cc2C#N)CC1 584130114 IDCBABUKCCHTPW-UHFFFAOYSA-N 393.874 5.203 30 20 GKED CCN(C(=O)CCCCCC#N)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 588927165 SVFRRZMQBSYSBZ-DEOSSOPVSA-N 377.532 5.617 30 20 GKED N#CCCC[C@H](NC(=O)c1sc2cc(F)ccc2c1Cl)c1ccccc1 590477923 MBQYHTLNDCCYOT-INIZCTEOSA-N 386.879 5.859 30 20 GKED CC(C)(C#N)c1ccc(CNc2cccc(CSC3CCOCC3)c2)cc1 594504126 GXUFZLSLXKCMTM-UHFFFAOYSA-N 380.557 5.512 30 20 GKED COc1cccc(OC)c1Oc1ccc(CNc2cccc(Cl)c2C#N)cn1 603869371 NALGOEILMDWUPA-UHFFFAOYSA-N 395.846 5.028 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccc(-c3ccccc3Cl)o2)cc1 604068318 BQGDIXWGXJBEAD-UHFFFAOYSA-N 381.863 5.520 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCc3cccs3)cc2Cl)c1 609063333 ZWCRXDUOIPGQCZ-UHFFFAOYSA-N 396.899 5.423 30 20 GKED CN(CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 609164659 UALTUHMDRVJWHX-NRFANRHFSA-N 389.886 5.070 30 20 GKED CCCN(CC)c1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 609376134 OROUDWAJVDQNSV-KRWDZBQOSA-N 381.545 5.427 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2COc3ccccc32)cc1Cl 609587058 UDIRAWMZAITFKV-UXHICEINSA-N 388.854 5.110 30 20 GKED COC(=O)[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc(Cl)c1 609804075 BFKDEHFLPZUVKA-OAQYLSRUSA-N 392.842 5.330 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CC1CC1)c1ccccc1 610325860 XBRJPKYEAHSAEN-UZLBHIALSA-N 379.529 5.601 30 20 GKED CCC[C@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 611802978 DMFJUYZVHTYFKB-KOSHJBKYSA-N 398.510 5.522 30 20 GKED COc1cc2c(cc1F)CC[C@H]2NC(CCC(F)(F)F)CCC(F)(F)F 658254727 OUWWJLISGYXUMU-CQSZACIVSA-N 387.339 5.465 30 20 GKED O=C(Nc1ccc(C(F)F)nc1)NC(CCC(F)(F)F)CCC(F)(F)F 667619062 RKVUPUZUJBLICU-UHFFFAOYSA-N 393.278 5.194 30 20 GKED C=C(C)Cn1c(CSc2ccc(C)cc2)nnc1N1CC[C@H](c2ccco2)C1 670200526 SNBZEQNJNRBDAW-SFHVURJKSA-N 394.544 5.042 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)c1Br 682990313 RSRQLUHEHQXIPI-INIZCTEOSA-N 379.257 5.104 30 20 GKED Cc1cc2c(c(C)c1Cl)C(=O)/C(=C/c1csc(-c3ccccn3)n1)CO2 727780643 QZCUEBYAVFKDAW-MDWZMJQESA-N 382.872 5.134 30 20 GKED Cc1cc(COc2ccc(/C=C\C(=O)c3ccccc3Cl)cc2)oc1C(=O)O 729936553 DEFWOXJBBIOHOW-FLIBITNWSA-N 396.826 5.415 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC(C)C)c2ccccc2C)c1 733807286 UCMISVRFSRNGLB-OFNKIYASSA-N 393.531 5.263 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@H](C)c2cccc(F)c2)cc1 734965975 RWKUEMUDBUYGJV-CKJXQJPGSA-N 380.463 5.180 30 20 GKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1c(Cl)nc2ccccn12 737450296 RLLWDPXXBGDJPX-NTMALXAHSA-N 393.786 5.052 30 20 GKED N#Cc1ccc(F)c(CNCc2ccc(-c3ccc(C(F)(F)F)cc3)s2)c1 742381185 QVMLIOCHCSNEHO-UHFFFAOYSA-N 390.405 5.734 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 742538270 WKNCDLUNRYYCRB-QODFHFCMSA-N 390.527 5.654 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)ccc1SC 746342450 UTGFIGKNVATJHX-YCRREMRBSA-N 394.448 5.271 30 20 GKED Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl 754573858 TYJQYQULLPNHNV-JSGCOSHPSA-N 383.835 5.048 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ccc(F)cc1OCC#N 757681896 GMSGGFIRJMYYBK-UHFFFAOYSA-N 385.439 5.077 30 20 GKED CC1(C)C(=O)Nc2ccc(C(=O)/C=C\c3csc(-c4ccc(F)cc4)n3)cc21 759121591 QVAWAKRJIIVDPH-NTMALXAHSA-N 392.455 5.075 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C34C[C@H]5C[C@@H](CC(F)(C5)C3)C4)n2)cc1 766259069 ONCWTJATHYRWSV-BNLHITBZSA-N 394.515 5.603 30 20 GKED N#C[C@@H](C(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2)c1nc2cc(Cl)ccc2s1 766263280 QVVPJZYVHREKDD-ZIUTZDDDSA-N 388.895 5.434 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](CC2CCC2)c2ccccc2)ccc1OC 776165406 QDEYFABXURPDCD-YADHBBJMSA-N 378.516 5.397 30 20 GKED C[C@H](Nc1cccc(OCc2ccc(F)cc2)c1)c1ccc(OCC#N)cc1 776821058 YWKMIZYOQYBWAK-KRWDZBQOSA-N 376.431 5.480 30 20 GKED Cc1nc(COC(=O)c2ccc(C3(C#N)CC3)cc2)oc1-c1ccc(Cl)cc1 777174001 XSYKOICEXZCXRB-UHFFFAOYSA-N 392.842 5.216 30 20 GKED Fc1ccc(C(F)(F)F)cc1NC(=S)Nc1cccc(OC(F)(F)F)c1 783733594 AEXVCVLNINNLLU-UHFFFAOYSA-N 398.303 5.552 30 20 GKED Cc1ccncc1/C=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 783906260 GWUGKVJCOJNVPX-TYOLEZHBSA-N 387.870 5.351 30 20 GKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1nc(Br)ccc1F 794969896 KXTOCVZKLOXLCC-VURMDHGXSA-N 389.249 5.003 30 20 GKED Fc1ccc(NC(=S)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)c(F)c1 795014493 GUXDYARLAYSXNW-UHFFFAOYSA-N 398.303 5.394 30 20 GKED CC(C)(C)OCCCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 795253434 VSAJJZBWOYYSGX-IBGZPJMESA-N 384.907 5.529 30 20 GKED CC1(C)CC[C@@H](NCc2ccc(OCC#N)cc2)c2cc(Br)ccc21 795799349 BKQHYZLTJFNZNQ-HXUWFJFHSA-N 399.332 5.254 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 802036550 ZVGDERJJURVVTD-WMLDXEAASA-N 376.481 5.115 30 20 GKED N#CCCC[C@@H](NC(=S)NCc1cccc(C(F)(F)F)c1)c1ccccc1 814210476 PHUDPDGUXDZHNV-GOSISDBHSA-N 391.462 5.105 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C/c1csc(-c2ccccc2)n1 818246335 SRHHCMDSYXVPEW-LVAJTGTJSA-N 388.448 5.548 30 20 GKED COc1cc(C=NOCc2ccccc2)ccc1OC(=O)c1ccccc1Cl 839418876 BGAZBDUREPZOMJ-UHFFFAOYSA-N 395.842 5.119 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904448397 HRHAHSRMTHJFAY-INIZCTEOSA-N 382.423 5.142 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Br)c2)cc1 915086391 JQNNMVIBASHCGO-FQEVSTJZSA-N 391.268 5.357 30 20 GKED Cc1cc(/C=C\C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)c(C)n1C1CCCCC1 916844767 BKPNGADCTOHNGT-CBUFDYBVSA-N 386.499 5.376 30 20 GKED O=C(O)c1cc(NN=Cc2cnc(-c3cccc(Cl)c3)s2)ccc1Cl 1776034142 PIJZBBXGKBFOQS-UHFFFAOYSA-N 392.267 5.261 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(Oc2cccc(Cl)c2)cc1 1776051719 XHBTZBTTZSJJEP-UHFFFAOYSA-N 396.830 5.285 30 20 GKED COc1ccc(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)c2ccccc12 1776132775 FLXZQDCJQWBZGX-SEYXRHQNSA-N 397.430 5.299 30 20 GKED CCCCCCCOc1ccc(/C=C/C(=O)c2ccc(C(=O)O)cc2O)cc1 1776785886 HGRXAZIFZWPZHN-NTEUORMPSA-N 382.456 5.336 30 20 GKED CCc1c(C(=O)/C=C\c2csc3ccc(C(=O)O)cc23)oc2ccc(C)cc12 1776956260 OBIIPWLWUVBFSB-ALCCZGGFSA-N 390.460 6.113 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)[C@@H]3CC=CCC3)cc2)CCC1 1786075550 KEKUDPDWDQZFMO-KNQAVFIVSA-N 392.543 5.245 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C/c1cccnc1)C(=O)c1ccccc1 7367595 DILZZRGXSNDVFI-CJLVFECKSA-N 384.479 5.111 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 15992267 MDZBJCOEBYLGNV-UHFFFAOYSA-N 378.884 5.924 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1cccs1)c1ccc(C#N)cc1 26122696 PHOJRGONPVLAGY-HNNXBMFYSA-N 378.522 5.403 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1F 41548530 RSWYHOGZEQMVKU-LBPRGKRZSA-N 378.350 5.253 30 20 GKED N#C[C@@H](C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)c1ccccn1 46440048 NPMKZEGZPQEXMW-LJQANCHMSA-N 378.884 5.517 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2cccc(Cl)c2Cl)o1 54857828 QUAKIXCELHSBBN-UHFFFAOYSA-N 387.222 5.289 30 20 GKED C=CCOc1cccc(NC(=O)c2c(C)nn(Cc3ccc(C)cc3)c2Cl)c1 55723010 ARFMJCOSPRSVRQ-UHFFFAOYSA-N 395.890 5.019 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1Cl 60669203 YTNVSCRQAVTUMK-UHFFFAOYSA-N 390.830 5.108 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl 78877007 GJSFAGISNKJMJW-ROUUACIJSA-N 385.294 5.183 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(c2ccccc2)CC1 108530873 OLIDSRISUULGQN-QGZVFWFLSA-N 379.529 5.350 30 20 GKED CCN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cccnc1 116639018 POUHCQIKZDSWFL-UHFFFAOYSA-N 377.831 5.066 30 20 GKED CC(C)Sc1c(Cl)cccc1NCc1nnc(-c2ccc(C#N)cc2)o1 133981193 TWFGRNCOANYOOQ-UHFFFAOYSA-N 384.892 5.374 30 20 GKED Cc1nc(C(C)(C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)sc1C 150968167 FLOANRACAGWGJA-LBPRGKRZSA-N 388.562 5.069 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)c2ccc(Br)cc2)n1 156452693 MPFQPGKDXLNVEM-BXUZGUMPSA-N 377.307 5.009 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)c1nc2cc(Cl)ccc2s1 161401135 PYHKVJOXRVOMQV-SNVBAGLBSA-N 396.686 5.502 30 20 GKED CN(C(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccc(Cl)cn1 175679233 UEJDMMYAZBNHHL-UHFFFAOYSA-N 379.872 5.034 30 20 GKED Cc1cnc(C(C)(C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)s1 177055163 XDIYNCCLUXRQIS-UHFFFAOYSA-N 392.484 5.172 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1c(C)oc2ccccc12 185321764 ZHQVEGXAPYYFDM-UHFFFAOYSA-N 383.407 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1cccc(Br)c1 189903376 OYEMOBHWYOTNAU-UHFFFAOYSA-N 388.305 5.319 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2[nH]c3ccc(F)cc3c2C1 191417060 XBDNCDVAWSRPNC-UHFFFAOYSA-N 391.490 5.749 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1 194748918 RWCHUZAGIQLMFX-HNNXBMFYSA-N 391.323 5.025 30 20 GKED C[C@@H](Nc1cccc(F)c1C#N)c1cccc(NC(=O)Cc2ccccc2F)c1 301080573 HPLJTBUAUWEXJQ-OAHLLOKOSA-N 391.421 5.191 30 20 GKED COc1ccc(C[C@H](Nc2snc(Cl)c2C#N)c2ccccc2)cc1OC 301960044 PUDUKSRMEIVKHF-INIZCTEOSA-N 399.903 5.081 30 20 GKED Cc1coc2ccc(N=C(O)N3CCCCC[C@@H]3c3noc(C(C)C)n3)cc12 330077710 NEIDXLHWZHUSPP-QGZVFWFLSA-N 382.464 5.410 30 20 GKED CN(C(=O)CC1CC(F)(F)C1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410684966 BBWUXPKXLCCICH-CYBMUJFWSA-N 389.286 5.203 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)CCCc1ccc(Br)s1 410974853 YJNKEPJAFZCCOJ-UHFFFAOYSA-N 397.725 5.191 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC1(C#N)CCC1 416345677 INHAVIHRBAZWHE-UHFFFAOYSA-N 392.286 5.025 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 428141083 XEFPAQPMTDVULN-UHFFFAOYSA-N 377.469 5.072 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3ncc(C(C)(C)C)s3)c2c1 430647906 QQZFSPRUDLDPGI-QGZVFWFLSA-N 389.524 5.665 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 436365850 NCNKDKPVMFWDQB-UNMCSNQZSA-N 387.508 5.031 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)cc2n1 437475966 NBJLJVRXCCXPKH-UHFFFAOYSA-N 387.370 5.192 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438842675 QGALQABMTYDKRR-KUHUBIRLSA-N 390.314 5.741 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cscc1C 439489893 FNLQUKDHTCGTQI-UHFFFAOYSA-N 383.286 5.178 30 20 GKED COc1cc(CN[C@@H](C)c2nc(-c3ccc(Cl)cc3)c(C)s2)ccc1C#N 440618307 VZVNEDVBTQYPDO-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@H]1NCC1CCC(C#N)CC1 442876341 QXPVNMXQLMQDJG-XILSRCRHSA-N 379.367 5.152 30 20 GKED COc1ccc([C@H](N[C@@H]2CCC[C@@H](C#N)C2)c2ccccc2Cl)c(OC)c1 463241806 FEOZMECIBDUCQN-XCGNWRKASA-N 384.907 5.119 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)Nc1ccccc1-c1ccccc1 464819153 RJAXLBGSVXLTAK-ILBGXUMGSA-N 395.506 5.064 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2c(F)cccc2F)cc1 465453081 PVWZABMFVSJJLO-UHFFFAOYSA-N 378.378 5.214 30 20 GKED CC(C)(C)c1ccc(CNc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469054094 VDZSYHCAAKFKFM-UHFFFAOYSA-N 375.516 5.179 30 20 GKED Cc1cccc(C[C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CC2)c1 469292527 IVTIXOBOPVPTKW-QHCPKHFHSA-N 387.527 5.011 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 474443631 DUOUJGOYONYNHN-LBPRGKRZSA-N 389.546 5.111 30 20 GKED CO[C@H]1CCC[C@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 475185056 ORCWEJZHOXWFRQ-ICSRJNTNSA-N 378.472 5.193 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(CSc2ccccn2)c1)c1ccccc1 475438697 IDHBOYXERRBPDS-FQEVSTJZSA-N 387.508 5.400 30 20 GKED CO[C@]1(C)CCCN(C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CC1 477838996 WSBPFOSZDHNTBY-JOCHJYFZSA-N 398.890 5.035 30 20 GKED N#Cc1cc(Cl)ccc1CNc1cccc(C(=O)N2CCc3ccccc32)c1 478351044 RMKYLGVXYZNXRQ-UHFFFAOYSA-N 387.870 5.027 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3cccc(SCC#N)c3)c2C(C)C)cc1 481863317 WRFIESBOQWVTQW-UHFFFAOYSA-N 390.512 5.172 30 20 GKED C=CCOc1cccc(NC(=O)c2c(C)nn(Cc3ccc(Cl)cc3)c2C)c1 482080293 JECQHWXIMVHHRN-UHFFFAOYSA-N 395.890 5.019 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC12CCC(C(F)(F)F)(CC1)CC2 489086261 CIZZXTBBHDTAGC-UHFFFAOYSA-N 394.481 6.315 30 20 GKED COc1cc(C(=O)Nc2ccc(C#N)cc2Cl)cc(Cl)c1OCC(C)C 494582358 OPTQKNQUTXZOJP-UHFFFAOYSA-N 393.270 5.161 30 20 GKED C=C[C@@H](CC(=O)Nc1nc(-c2c[nH]c3ncccc23)c(C)s1)c1ccccc1 503906262 ALHYENAUCHGHLL-HNNXBMFYSA-N 388.496 5.293 30 20 GKED N#CCSc1cccc(C(=O)NC[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)c1 510194898 BXZHLMIVPNJGAM-SUMWQHHRSA-N 391.323 5.143 30 20 GKED Cc1sc(NC(=O)CCSc2ccccc2Br)c(C#N)c1C 514424191 GIHJZHAHOHEZOS-UHFFFAOYSA-N 395.347 5.120 30 20 GKED C[C@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCCCCC#N)nnc1-c1cccs1 514588804 FKDYNXZZUSVUHO-QZWWFDLISA-N 386.590 5.790 30 20 GKED CCSc1ccc([C@H](C)NC(=O)CCCCOc2cccc(C#N)c2)cc1 518362763 XKAFODOCUCJBIZ-KRWDZBQOSA-N 382.529 5.097 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C 520197868 ROWUQQMDBARSCB-UZLBHIALSA-N 381.545 5.990 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1ccc(C(C)(C)C)cc1 520826359 PAPZVQWVFQECRU-MRXNPFEDSA-N 382.529 5.253 30 20 GKED Cc1cc2cc(NC(=O)c3cccc(COc4ccc(C#N)cc4)c3)ccc2[nH]1 524519288 IOEGAZFPOMLQDV-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CC[C@H]1CCCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 525348686 LYOBRIKCOIPKBY-IBGZPJMESA-N 377.488 5.846 30 20 GKED C=C[C@@H](CC(=O)NCCCCc1nc(-c2cccnc2)cs1)c1ccccc1 535344347 JUANJJAKSIHOOT-SFHVURJKSA-N 391.540 5.004 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)Nc1cccc(-c2cnco2)c1 540877780 LKRNLRXIZLIYPJ-UHFFFAOYSA-N 381.391 5.258 30 20 GKED Cc1csc([C@@H](C)NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 542021052 YABAOWDWUGLJDS-HZPDHXFCSA-N 390.512 5.112 30 20 GKED C=C[C@@H](Cc1nc(-c2cccc(NC(=O)c3ccco3)c2)no1)c1ccccc1 545059634 LQDQMOMMWFPUOU-INIZCTEOSA-N 385.423 5.094 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCC(=O)c4ccccc43)cc2)c1 550310968 GPSLIRPJVCWDFI-QFIPXVFZSA-N 382.419 5.049 30 20 GKED CCCCN(C(=O)c1ccc(COc2ccccc2C#N)o1)C1CCCCC1 550582426 HZCRCNDQXLBFQQ-UHFFFAOYSA-N 380.488 5.305 30 20 GKED CN(C)c1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 555085299 HAJWJBZOFZOMSB-KRWDZBQOSA-N 381.888 5.020 30 20 GKED O=C([C@@H]1CC[C@H](C(F)(F)F)C1)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 557033610 KYTMZPCQRJUQAX-WPGHFRTFSA-N 397.334 5.081 30 20 GKED CN(C(=O)c1cnc(C(F)(F)F)c(C#N)c1)c1ccccc1Oc1ccccc1 559331453 IJGYVUIZXRQDIN-UHFFFAOYSA-N 397.356 5.041 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(Br)c1 559865358 SLYPKEYKPNTVRD-KUHUBIRLSA-N 375.285 5.674 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2ccc(Oc3cccnc3)cc2)cc1OC 561748941 REDCUFZKJZDHPL-GOSISDBHSA-N 390.483 5.298 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2cccc(F)c2)C1 563719532 TUDGQNPTRIHZQI-DOTOQJQBSA-N 383.492 5.099 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@H]1c1ccsc1 564381334 WMNPTFBVJDHVMR-QAPCUYQASA-N 398.507 5.146 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cc(C(F)F)ccc3Cl)c2)cc1 575902920 HNKFMSOPANQPCP-UHFFFAOYSA-N 398.796 6.194 30 20 GKED C=CCOc1ccc(CNC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)cc1 577402837 PYLKNYLXCFNKGW-AGXSTUJCSA-N 393.449 5.017 30 20 GKED N#CC1CCN(C(=O)NCc2oc3ccc(Cl)cc3c2-c2ccccc2)CC1 577719509 NOLSQNZEUSLTKJ-UHFFFAOYSA-N 393.874 5.198 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2 578856054 HMKLZQFAYHWWBG-UHFFFAOYSA-N 395.509 5.320 30 20 GKED Cc1cccc(-c2cnc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)s2)c1 588186319 YMFMDTDJVAWMOM-UHFFFAOYSA-N 388.279 5.549 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591839802 YAGJDGITMHAPOB-UHFFFAOYSA-N 378.263 5.147 30 20 GKED N#CCc1cccc2c1CCN(C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)C2 600784177 YWLVFZHAEFBUDX-RUZDIDTESA-N 394.518 5.054 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(Cl)c1 609438052 AJUBNLZDLRQKPP-PBHICJAKSA-N 387.936 6.007 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccnc(-c2ccccc2)c1 609531182 IUINXEVLJPOWDP-UHFFFAOYSA-N 375.431 5.540 30 20 GKED Cc1noc([C@H](C)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)n1 610342848 YWUVVSQEMXYRLW-NSHDSACASA-N 388.349 5.234 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cncc(-c4ccccc4)c3)cn2)cc1 610706214 XGKJMVNJBNVPFA-UHFFFAOYSA-N 392.418 5.060 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)nc1 616096553 MZGLYSPDCDTPAQ-UHFFFAOYSA-N 386.455 5.026 30 20 GKED CN(C(=O)NCc1ccc(C#N)c(Cl)c1)C1c2ccccc2-c2ccccc21 619828160 NIFCXNYHKTZQPJ-UHFFFAOYSA-N 387.870 5.123 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](CC1CC1)c1ccccc1 672900697 LGLSSWUYJNDXGY-QFIPXVFZSA-N 380.536 5.093 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)/C=C/c3ccco3)cc2Cl)c1 727998696 DNNBOOQTUORHHP-VQHVLOKHSA-N 378.815 5.036 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cccc2cnccc12 728431750 BNJHECQUNQTMHL-UHFFFAOYSA-N 389.890 5.643 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1ccc(Cl)s1 730951717 OJWATHPDRBAMJC-UTCJRWHESA-N 388.828 5.168 30 20 GKED C#CCOc1ccc(NC(=O)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 731113685 LGUBFKSCNVLPOF-OAHLLOKOSA-N 391.496 5.013 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(F)cc2C)cs1 731319476 PTVOIXBNFZPESK-XFFZJAGNSA-N 394.471 5.480 30 20 GKED O=C(/C=C/c1ncc(-c2cccc(Br)c2)[nH]1)c1ccc(F)cc1F 731937306 HOGVNOPVLKHEMM-VOTSOKGWSA-N 389.199 5.014 30 20 GKED CCOc1cc(/C=C2/CCOc3c(Cl)cccc3C2=O)cc(Cl)c1O 733749490 XZGPZQWPXFGNLK-WQLSENKSSA-N 379.239 5.147 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1cc(OC)c(OCC)c(OC)c1 735978549 ICBLEIQHUXUGOI-CLFYSBASSA-N 390.863 5.051 30 20 GKED Cc1ccc(C[C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 738897496 VFJZNWZSEGBGQJ-ZHRRBRCNSA-N 389.524 5.465 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@H]1c1cccc2ccccc12 739838897 BIQXWOFHUGAWAQ-DEOSSOPVSA-N 393.494 5.073 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 744028526 LUXYCIBHJOIEIP-JOCHJYFZSA-N 399.494 5.037 30 20 GKED CCCCCCCCc1nnc(NC(=O)N(C)[C@H](C)c2ccccn2)s1 744747020 QKFZHKHUEVTUJN-OAHLLOKOSA-N 375.542 5.061 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@@H]3c3sccc3C)n2)cc1 748834072 JRFOLMTVDXEACP-IXDOHACOSA-N 378.522 5.468 30 20 GKED CC(C)c1nn(C)c(Cl)c1C=NNc1ccc(Br)cc1Cl 750938493 JCHPMWGJTRBPDP-UHFFFAOYSA-N 390.112 5.059 30 20 GKED C=CCn1c(SCCSc2ccc(C)c(C)c2)nnc1-c1cccnc1 750951066 NJKKUSABEKGUMH-UHFFFAOYSA-N 382.558 5.027 30 20 GKED C=C[C@H](CC(=O)OCc1csc(-c2ccccc2OC)n1)c1ccccc1 758906910 FNRVWRDAWAITBK-MRXNPFEDSA-N 379.481 5.222 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C2CCC(C(F)(F)F)CC2)cc1 774050996 HKUKSTJNEMUQHD-CUGJKRCDSA-N 394.437 5.216 30 20 GKED CN1C(=O)CCc2cc(/C=C3/CCc4c(Cl)sc(Cl)c4C3=O)ccc21 774137487 WOAZFXXALXCUBZ-XFXZXTDPSA-N 392.307 5.176 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2nc3cc(Cl)ccc3n2C)cc1 779073786 QYGYLYFUTWIANO-AWEZNQCLSA-N 390.314 5.209 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 796632634 DZYCSTRADWREOI-KBRIMQKVSA-N 388.920 5.235 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(Cl)ccc2OCC2CC2)c1 797467152 YHCVVOBRSHARFW-HXUWFJFHSA-N 384.907 5.100 30 20 GKED CCc1cc(C)cc(CC)c1NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1 797683394 KOGOEFWTMMZGQE-HXUWFJFHSA-N 379.504 5.123 30 20 GKED O=C(NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)[C@H](F)c1ccc(C(F)(F)F)cc1 801679630 NIDQEDOEQAMPKE-LERXQTSPSA-N 385.323 5.201 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 805947556 PFFKQPOXOSWFOQ-MRXNPFEDSA-N 394.496 5.117 30 20 GKED C[C@@H](N[C@H](c1c(Cl)cccc1Cl)C1CC1)c1ccc(OCC#N)cc1 810243944 NMZWDNRZZLDJRQ-XCLFUZPHSA-N 375.299 5.698 30 20 GKED N#C[C@@H](C(=O)CCCC1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 813060595 DXIYABHUWKUKQV-AWEZNQCLSA-N 379.312 5.873 30 20 GKED O=C(/C=C/c1csc(-c2ccc(Cl)cc2)n1)c1cc([N+](=O)[O-])ccc1F 814192118 YEVYTLQPTAKBJU-VMPITWQZSA-N 388.807 5.407 30 20 GKED Cc1c(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)sc2ccc(C#N)cc12 815352199 FKYFMBGUZOSMLE-UHFFFAOYSA-N 395.509 5.107 30 20 GKED C=CC[C@H](c1ccccc1)c1nc(C(C)(C)NC(=O)c2cccc(Cl)c2)no1 904599560 GPDQXIWXXYPHFK-GOSISDBHSA-N 395.890 5.096 30 20 GKED Cc1ccc(/C=C/S(=O)(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 917737721 HEHUWJHXRMGTCG-POICXBNUSA-N 388.492 5.063 30 20 GKED O=C(O)c1cc(-c2ccc(C=NNc3cc(Cl)cc(Cl)c3)o2)ccc1O 1776058601 VTZPRLYHAKEAAR-UHFFFAOYSA-N 391.210 5.103 30 20 GKED Cc1ccc(C)c(C(=O)/C=C/c2cccc(OCc3cccc(C(=O)O)c3)c2)c1 1776133503 YLDZVIUXTOTQAD-VAWYXSNFSA-N 386.447 5.477 30 20 GKED CCC(=O)Nc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776676229 JDKXDICUZYBSOO-SXGWCWSVSA-N 399.446 5.296 30 20 GKED CCCCCCCOc1cccc(CNCc2cc(C(=O)O)c3n2CCCC3)c1 1776787717 ZMGBKGTUFOSKJF-UHFFFAOYSA-N 398.547 5.162 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)cc1OC 1776789313 SJNRPEIBCITZCN-FMIVXFBMSA-N 396.483 5.557 30 20 GKED Cc1ccccc1-c1cc(C(=O)Nc2ccc(C#N)cc2)c2cnn(C(C)C)c2n1 12831768 LEIQWQRRBZELEC-UHFFFAOYSA-N 395.466 5.112 30 20 GKED CC(C)N(CC/N=C(\O)CCc1ncc(-c2ccc(Cl)cc2)o1)C(C)C 27458553 DUXKRFOFOCZEPN-UHFFFAOYSA-N 377.916 5.003 30 20 GKED Cc1nc(SCC(=O)N(CCC#N)c2ccccc2)n(C2CCCCC2)c1C 45383503 MUBMQFOAQGXOHQ-UHFFFAOYSA-N 396.560 5.044 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3c(C)nn(C(C)(C)C)c3C)n2)cc1 51154354 GJWIWSMWWNNMQN-KRWDZBQOSA-N 392.528 5.177 30 20 GKED CSc1ccc(Cl)c(C(=O)N(Cc2ccc(C#N)cc2)CC(F)(F)F)c1 58498990 RQYQPGRIPCVFNI-UHFFFAOYSA-N 398.837 5.138 30 20 GKED C[C@H]1CCCC[C@H]1OCCNC(=O)c1ccccc1Sc1ccccc1C#N 60574290 IGMPRXLETVCFIH-FXAWDEMLSA-N 394.540 5.035 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(\S)Nc2cc(C)ccc2F)cc1 65940502 FXWWMMBKVZFVCO-UHFFFAOYSA-O 393.507 5.035 30 20 GKED C[C@H](Sc1cc(C#N)ccn1)C(=O)Nc1ccccc1Sc1ccccc1 71918502 MOBNQBJTHXXDFG-HNNXBMFYSA-N 391.521 5.224 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C(=O)[C@@H](C#N)c1ccccn1)c1ccccc1 106983774 PJHRUDUIINSNQR-PGRDOPGGSA-N 376.843 5.040 30 20 GKED CSc1ccc(NC(=O)[C@H](C)Nc2ccccc2SC[C@H](C)C#N)cc1 108407605 UZGASDVSYQLYLX-CABCVRRESA-N 385.558 5.099 30 20 GKED Cc1ccc(-c2noc([C@H](C)Nc3ccccc3SC[C@@H](C)C#N)n2)cc1F 108408015 QCHUPLVMYAIHNW-ZFWWWQNUSA-N 396.491 5.609 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC(C)(c2ccccc2)CC1 119915962 UWPRYQRESCEASB-GOSISDBHSA-N 393.556 5.524 30 20 GKED CC(C)(C#N)c1ccccc1CSc1nnc(CCCc2ccccc2)o1 121268626 NCAOLGGYTUIKCM-UHFFFAOYSA-N 377.513 5.338 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cc(-c4cccs4)on3)o2)cc1 126304153 ZNUTWPOQXOEHTL-UHFFFAOYSA-N 397.481 5.310 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1Cl 165634083 OBXOQJVWYIKLCO-UHFFFAOYSA-N 390.870 5.546 30 20 GKED CN(C(=O)c1ccc(Cl)c(NC(=O)C2(C#N)CCCCC2)c1)c1ccccc1 172500040 RZYSRQCREGHNIK-UHFFFAOYSA-N 395.890 5.029 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)[C@@H](C#N)c1nc(C)cs1 176516635 MMEVDCJVLWINIJ-MRXNPFEDSA-N 378.453 5.133 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H](C)c2cccc(C(F)(F)F)c2)n1 177765065 CKANHGGQAGLZCO-DOMZBBRYSA-N 380.435 5.655 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](CCC#N)c1ccccc1 181571666 DQMVCELKPBMSQL-FOIQADDNSA-N 379.504 5.953 30 20 GKED CCC[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 181767501 RABGICYFTNAGHZ-HKUYNNGSSA-N 381.545 5.150 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)C1(c2ccc(C#N)cc2)CC1 187899830 ANRMYZZDFZXSBL-UHFFFAOYSA-N 382.463 5.116 30 20 GKED CN(Cc1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 193050036 AUJQNJUJGBQHPY-UHFFFAOYSA-N 391.393 5.050 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1cccc(Br)c1 214012278 OUAJVLKEXKERNI-PLNGDYQASA-N 376.300 5.530 30 20 GKED COc1ccc([C@@H](NCc2cccc(C#N)c2)c2ccccc2Cl)c(OC)c1 237274546 JTFHOQZRJFTGSI-QHCPKHFHSA-N 392.886 5.108 30 20 GKED COc1cccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 302914687 UUKFLNVSIDDUFC-SFHVURJKSA-N 396.899 5.281 30 20 GKED COc1ccc2oc([C@@H](C)/N=C(/O)N3CCC(c4nccs4)CC3)c(C)c2c1 329206521 ZQUJNHFIYHFKJP-CQSZACIVSA-N 399.516 5.061 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1SCCc2ccccc21 428877747 AATSWTLADICSPO-FOIQADDNSA-N 397.569 5.090 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H]2CC[C@@H](C)C2)cc1 429771881 ZBFIKZOGKYMDIL-CRAIPNDOSA-N 379.460 5.011 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(Cc1cccc(C(F)(F)F)c1)C(C)C 431724945 XQHZEXOCDVSLJD-UHFFFAOYSA-N 375.394 5.328 30 20 GKED CCCNc1ccc(CNCc2cccc(OCc3ccccc3C#N)c2)cc1 434788401 YNQHCTIKAPNCOR-UHFFFAOYSA-N 385.511 5.249 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ncc(-c2ccccc2)s1 436150695 KMFZZMDNWIGVHA-RTBURBONSA-N 388.496 5.114 30 20 GKED Cc1cc(C)cc(C[C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 438038496 NMTOVXLQOHKTSZ-ZWKOTPCHSA-N 381.545 5.450 30 20 GKED N#CC1CCC(CNCc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 441381288 RUZCOHNTALWSCO-UHFFFAOYSA-N 381.907 5.012 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)Cc1nnc(-c2cccc(C#N)c2)o1 441541850 OADROUNNUVZDPH-UHFFFAOYSA-N 394.478 5.119 30 20 GKED COc1cccc(-c2nc(CS[C@@H](C)c3cccc(C#N)c3)cs2)c1OC 443128098 CXTYFRAMJCSBSK-AWEZNQCLSA-N 396.537 5.693 30 20 GKED Cc1sc(NC(=O)C(C)(C)c2csc(-c3cccs3)n2)c(C#N)c1C 443458924 CUHWCORYFOIUFZ-UHFFFAOYSA-N 387.555 5.338 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2OC(F)(F)F)c2ccccc21 443896053 BFAGDNDKIZOGIL-UHFFFAOYSA-N 387.361 5.096 30 20 GKED CC(C)c1cccc(NC(=O)C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)c1 446512566 NHNPEWJQESQYKM-UHFFFAOYSA-N 399.450 5.051 30 20 GKED COc1ccccc1-c1ccc([C@H](C)Nc2nc(C(F)(F)F)ccc2C#N)cc1 462886094 FVOSHEQENMDFAW-AWEZNQCLSA-N 397.400 5.821 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 464945279 ZXDHYLSWWBJOCC-RTBURBONSA-N 379.529 5.021 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)c2c1 473586956 DXTPUCFKNUUZLT-RCZVLFRGSA-N 395.506 5.333 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cnn1-c1cccc(Cl)c1 474427551 BKFPDSPGLUAWSV-OAHLLOKOSA-N 398.919 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@@H]1c1cccc(OC)c1 475557294 XRJQQIPNHOWBLR-WZONZLPQSA-N 392.543 6.162 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)Nc1cccc(OCCCC#N)c1 475649445 KWRLVHHGHGOTCV-UHFFFAOYSA-N 395.503 5.637 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3c(F)c(F)cc(F)c3F)cc2)cc1 481181525 MVMMTBRVIJVNCP-UHFFFAOYSA-N 386.304 5.159 30 20 GKED CCCOc1nc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc2ccccc12 483229226 NVSXMCDVZJJTGA-FQEVSTJZSA-N 381.435 5.062 30 20 GKED Cc1c2ccc(NC(=O)c3ccccc3Sc3ccccc3C#N)cc2nn1C 485451650 CLFZPTGNNOINFR-UHFFFAOYSA-N 398.491 5.157 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl)c1ccccc1 487176401 MIXODASJECHIOZ-AOIWGVFYSA-N 387.310 5.648 30 20 GKED O=C(N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1ccc(F)cc1C(F)(F)F 487315920 HDACUHMKFCYBPU-IUODEOHRSA-N 391.286 5.149 30 20 GKED Cn1cc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c2ccccc21 487994885 HRBRWJKHFHZICX-UHFFFAOYSA-N 397.453 5.032 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 494800819 PGKDDWLKXQOIQI-GXFFZTMASA-N 388.327 5.240 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(-c4ccco4)s3)cc2)cc1 504319068 UOKCLXUDNBMXHX-UHFFFAOYSA-N 387.420 5.319 30 20 GKED Cc1ccccc1[C@@]1(F)CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 505311754 SRGMXTCPDDYMQK-OPAMFIHVSA-N 397.519 5.349 30 20 GKED C[C@H](NC(=O)N(CCc1ccccc1)Cc1ccccc1)c1ccc(C#N)cc1 505318471 NFELDKRZVAEWIN-FQEVSTJZSA-N 383.495 5.074 30 20 GKED C[C@@H](NC(=O)N(CCc1ccccc1)Cc1ccccc1)c1ccc(C#N)cc1 505318472 NFELDKRZVAEWIN-HXUWFJFHSA-N 383.495 5.074 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCCc2cccc(Cl)c2Cl)cc1 506187088 DPCGSCMZMZVZIA-UHFFFAOYSA-N 376.287 5.159 30 20 GKED CCN(C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1)[C@@H](C)c1ccc(C#N)cc1 509577976 FRSVWNOLELRMOM-INIZCTEOSA-N 386.451 5.244 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1cccc(F)c1Sc1ccccc1 510978278 QDILAZZYWWUVRZ-UHFFFAOYSA-N 378.428 5.109 30 20 GKED C[C@H](N[C@H](C)c1cccc(OCc2ccccn2)c1)c1ccc(C#N)cc1F 512646527 AVWUZJWCXZAOGN-SJORKVTESA-N 375.447 5.083 30 20 GKED C=CCN(C(=O)c1sc2nccc(C)c2c1C)c1nc2c(s1)CCCC2 515341381 PWEFOGKRTAIJKX-UHFFFAOYSA-N 383.542 5.081 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517902145 YXRDGEVRXIAGME-INIZCTEOSA-N 389.430 5.715 30 20 GKED CCOc1cccc2cc([C@H](C)Nc3nc(C(F)(F)F)ccc3C#N)oc12 522408607 HVFJIBOEBPLAGX-NSHDSACASA-N 375.350 5.290 30 20 GKED Cc1ccc(OC2CCN(C(=O)c3ccccc3-c3ccccc3C#N)CC2)cc1 523889941 HNVUCSDJBZSJNP-UHFFFAOYSA-N 396.490 5.217 30 20 GKED CC(C)c1c(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cnn1-c1ccccc1 525285575 LLPHZQWINLBNOX-UHFFFAOYSA-N 398.388 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccccc1COC(C)C 530500111 BBZBCBXIDINLSU-UHFFFAOYSA-N 380.532 5.785 30 20 GKED N#CCC[C@H](NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 532654724 XPWNIESJFQRKBH-PZJWPPBQSA-N 393.487 5.321 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1 535326128 PZHBIJCATRYMHR-HSZRJFAPSA-N 376.456 5.070 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1 536513215 FJCVSJFXWFOSME-MRXNPFEDSA-N 379.508 5.047 30 20 GKED CC(=O)c1ccc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(F)c1 541073155 OWZRZBJDJZIGFG-OAHLLOKOSA-N 386.426 5.058 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)ccc1Cl 542513122 XGLJJOVBLDJELJ-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=C(C)COc1cccc(NC2CCN(C(=O)c3ccccc3Cl)CC2)c1 543065687 AEWIZSAPNVZVFU-UHFFFAOYSA-N 384.907 5.012 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1-n1cccn1 557384568 WUGZDZSPEFWUDD-LJQANCHMSA-N 378.479 5.262 30 20 GKED Cc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c(-c2ccnn2C)c1 564420149 UMZKNTMLCCANTA-UHFFFAOYSA-N 395.466 5.067 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)cc1 564578468 VBWXIUVFAJEEQU-OAQYLSRUSA-N 397.469 5.582 30 20 GKED O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)[C@H]1CC[C@@H](C(F)(F)F)C1 567069390 DKVIZMAVTBWQJA-YGOYTEALSA-N 391.714 5.177 30 20 GKED Cc1ccc(-c2n[nH]cc2CNc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 570090041 MHEXBHRYSWHFHH-UHFFFAOYSA-N 381.439 5.056 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3F)cc2)ccn1 573433876 FFVZTEKSHFUHPQ-UHFFFAOYSA-N 398.397 5.132 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(Cc3c[nH]c4ccc(Cl)cc34)no2)cc1 573705932 AKSVUEKELGLKKY-UHFFFAOYSA-N 376.847 5.263 30 20 GKED N#Cc1c(F)cccc1C(=O)N1CCC(c2ccc(Cl)cc2Cl)CC1 578800766 YFEGALUJPSBIDM-UHFFFAOYSA-N 377.246 5.024 30 20 GKED COc1cccc(C(=O)/C(=C\c2ccc(-c3ccncc3)cc2F)c2ncc[nH]2)c1 588559798 IYJAPCPMLDYMRX-KGENOOAVSA-N 399.425 5.043 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1sc2c(c1C#N)CCCCC2 590765843 VKZGBAVWJYJRRD-UHFFFAOYSA-N 393.537 5.573 30 20 GKED CC(C)(C#N)c1ccc(CNc2ccc(NC(=O)N3CCCCCC3)cc2)cc1 594505230 QUGKRNFJQVEIQY-UHFFFAOYSA-N 390.531 5.508 30 20 GKED N#C[C@H](Sc1nnc(-c2ccncc2)n1C1CCCCC1)c1ccccc1 594892573 AYAADUWAQLWPSR-IBGZPJMESA-N 375.501 5.202 30 20 GKED N#C[C@@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)c1cccc(Cl)c1Cl 598827023 ZTLQNKZJJMDIMP-IRUJWGPZSA-N 379.209 5.043 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2cccc(C#Cc3cccs3)c2)cs1 601102924 MQLWABPVPSWCAP-CQSZACIVSA-N 381.526 5.050 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 604548000 RLHBMIZRVGCMSQ-YJYMSZOUSA-N 393.874 5.343 30 20 GKED Cc1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)c2ccccc2n1 609064160 KDCBIVMYXNKXIN-UHFFFAOYSA-N 393.446 5.246 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCO[C@H](c2ccccc2)C1 609435041 MRIPFXLDRYROAU-XLIONFOSSA-N 395.528 5.076 30 20 GKED Cc1ccc(C)c(SCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1 609461020 NYHOLIHMBIARKJ-MRXNPFEDSA-N 379.312 5.083 30 20 GKED Cc1ccc2cccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)c2n1 610153392 ORPICBQBCYZZIT-UHFFFAOYSA-N 393.446 5.768 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1)n1cccc1 610234856 VOBWOMURLPOYFR-QGZVFWFLSA-N 377.875 5.198 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)NCc1ccc(C#N)cc1F 610326765 JOIXCSFCZMJGTM-UHFFFAOYSA-N 377.872 5.173 30 20 GKED N#C[C@H](C(=O)c1ccccc1CCc1ccccc1)c1nc2ccccc2s1 612893495 QXQCXGFRNVQPSX-HXUWFJFHSA-N 382.488 5.572 30 20 GKED CC(=O)c1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 631127149 WMDSTRADCFOFPV-UHFFFAOYSA-N 386.476 5.305 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC(C)C)cc2)cc1OCCCC#N 728441679 OLYJCAATEVFEAW-WUXMJOGZSA-N 395.524 5.774 30 20 GKED N#C[C@@H](C(=O)Cc1c(Cl)cccc1Cl)c1nc2cc(F)ccc2s1 730416652 GUSWNZYIIQCLPG-NSHDSACASA-N 379.243 5.161 30 20 GKED COc1ccc(OC(F)F)c(/C=C/C(=O)c2ccc(Br)s2)c1 732926222 IRUCBZMKENPQDN-DUXPYHPUSA-N 389.217 5.017 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N[C@H](c3ccccc3)C3CC3)c2)s1 740026200 SYQKTRTWRHWIEC-JOCHJYFZSA-N 387.508 5.237 30 20 GKED O=C(/C=C/c1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(-c2ccncc2)c1 741472896 LPVKWUSYXJOQAR-GQCTYLIASA-N 396.349 5.154 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)c(OC(F)F)c1 741473491 QTNPRLBXXSYXTI-VURMDHGXSA-N 381.378 5.255 30 20 GKED O=C(/C=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1c(Cl)nc2sccn12 741849758 YVCXHDJIIGZYQJ-ALCCZGGFSA-N 399.815 5.114 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743093058 KZRVWSBIFCDSOI-RPBOFIJWSA-N 397.522 5.827 30 20 GKED C[C@H](ON=Cc1ccccc1C(F)(F)F)c1nc(-c2ccc(Cl)cc2)no1 744443236 ILOFCWKELKDVKF-NSHDSACASA-N 395.768 5.521 30 20 GKED Cc1cccnc1CC(=NOCc1ccc(C(F)(F)F)cc1)C(F)(F)F 746577238 SYSSOCWFLVAARW-UHFFFAOYSA-N 376.300 5.086 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@@H]3c3sccc3C)n2)cc1 748834073 JRFOLMTVDXEACP-YESZJQIVSA-N 378.522 5.468 30 20 GKED C[C@@H](C#N)Oc1ccc(CN2CCc3sccc3[C@H]2c2cccs2)cc1 768209465 YIBXCKDPUJUGLD-BTYIYWSLSA-N 380.538 5.248 30 20 GKED C[C@H](CNC(=O)c1ccccc1Oc1ccccc1C#N)c1nc2ccccc2o1 778024493 CPLIYFNTBFKOMW-MRXNPFEDSA-N 397.434 5.025 30 20 GKED C=CC[C@@H](C(=O)O[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 778416179 DXCHTCYFQYSEPB-GHTZIAJQSA-N 379.500 5.349 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1csc(-c2cccc3ccccc23)n1 780170598 YGMHONPMXFHUCV-HNNXBMFYSA-N 399.475 5.506 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)CC1 780511214 RRQGJEYRCDEQLF-UHFFFAOYSA-N 388.298 5.818 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780669233 ACDLILSRRMGZGQ-AWEZNQCLSA-N 391.393 5.050 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)c1 790541790 BUOQXEBDXMXCLP-GOSISDBHSA-N 397.931 5.434 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 791752978 XJVLKSWFWSBMIY-NIKGAXFTSA-N 387.405 5.147 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1C(=O)N(CCC#N)c1ccc(F)cc1 793461135 ORKVVKWMCSJKHD-UHFFFAOYSA-N 397.450 5.042 30 20 GKED N#CC[C@@H](CC(=O)N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1)c1ccccc1 793830739 NWNIVZCWZYTEJZ-OALUTQOASA-N 386.417 5.109 30 20 GKED COc1ccccc1CON=Cc1cccc(NC(=O)c2ccccc2Cl)c1 799116943 DHUXLZOFUNQVSH-UHFFFAOYSA-N 394.858 5.152 30 20 GKED C#C[C@H](NCc1csc(-c2ccc(OC)cc2)n1)c1ccc(Cl)cc1F 809698810 JGJGMMHMUUHZGJ-IBGZPJMESA-N 386.879 5.075 30 20 GKED O=C(/C=C\c1csc(-c2ccccn2)n1)c1csc(-c2ccccc2F)n1 812245634 WFQLIYHUJFNQHZ-HJWRWDBZSA-N 393.468 5.364 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC[C@@]1(C)CC1(Cl)Cl 836385553 HNQMXHZEQGUXQP-WBMJQRKESA-N 386.348 5.034 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cccc(C(=O)C(F)(F)F)c1 841694211 FFZUKINDHQLLEN-CYBMUJFWSA-N 378.419 5.295 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)n2)cc1 850762693 MAKCHSBESXNLNN-OWCLPIDISA-N 392.446 5.664 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)OC(=O)[C@@H](C)CC#N 850855523 YCESRTRAETXNEU-JQWIXIFHSA-N 393.306 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C(F)(F)F)O[C@@H](C)C1 879352575 WNENJFQTZIKKLS-WMLDXEAASA-N 384.442 5.112 30 20 GKED N#C[C@@H](C(=O)CSCc1cccc(Cl)c1)c1nc(-c2ccccc2)cs1 915101698 GTGLELIRRNFNMN-KRWDZBQOSA-N 398.940 5.573 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)/C=C/c3nc4ccccc4s3)cn2)c1 915175129 MPEBJASKCVVRRE-PKNBQFBNSA-N 398.447 5.007 30 20 GKED Cc1cc(NN=Cc2c(C(C)C)nn(C)c2Cl)nc2ccc(Cl)cc12 915955800 KGLJIDOYFQUHEO-UHFFFAOYSA-N 376.291 5.153 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047323 WVHKXKXMYBSFKQ-XJKSGUPXSA-N 398.915 5.718 30 20 GKED COc1ccccc1CON=C(C)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776057294 RYOUEIOBOIGSDM-UHFFFAOYSA-N 391.423 5.127 30 20 GKED CCc1ccc(-c2ccc(/C=C(/C(=O)C(=O)O)c3ccc4ccccc4n3)o2)cc1 1776115849 DDGKFJSJHCRNDS-HMMYKYKNSA-N 397.430 5.252 30 20 GKED C/C(=C/c1ccc(-c2cccc(C(=O)O)c2)s1)c1nc2ccccc2n1CC#N 1776197307 ZHAGMWUJIANJIT-SQFISAMPSA-N 399.475 5.547 30 20 GKED CCCCCCCCOc1ccc(/C=C/c2ncc(/C=C\C(=O)O)s2)cc1 1776785554 LKTANOOLRHOBQZ-BZTGPAQBSA-N 385.529 6.151 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)s1 1776965991 MTWIPPZNIHRSIH-LUAWRHEFSA-N 392.476 5.484 30 20 GKED N#Cc1ccc(CSc2nc3ccccc3c(=O)n2C2CCCCC2)cc1 6532292 KCKBNSHQUMHXIE-UHFFFAOYSA-N 375.497 5.066 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 32291030 JSIKVIZTWPNSJD-UHFFFAOYSA-N 395.462 5.108 30 20 GKED C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2o1 54736782 HVIVLQFCWRJRKV-JQWIXIFHSA-N 391.279 5.492 30 20 GKED Cc1ccccc1C(=O)/C(=C(/S)Nc1ccc(C(C)C)cc1)[n+]1ccccc1 55011660 NXXFJYALOZRITM-UHFFFAOYSA-O 389.544 5.457 30 20 GKED CCc1sc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1C 60043654 ULZGNMNQKHSRLE-OAHLLOKOSA-N 382.510 5.241 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 65880704 LNILSQZOSZADSZ-XYGUXCPDSA-N 387.508 5.015 30 20 GKED N#Cc1ccc(CSCC(=O)N2CCC[C@H]2c2cccc3ccccc23)cc1 65884666 GJKLDGNLQNVFSL-QHCPKHFHSA-N 386.520 5.308 30 20 GKED CCc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[nH]c(C)c1C(C)=O 66037239 OEOLKLLRUQUDNL-UHFFFAOYSA-N 387.439 5.004 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)C3(c4ccccc4)CCOCC3)cc2)cc1 66037332 JYUZKYTXTMUMGF-UHFFFAOYSA-N 398.462 5.037 30 20 GKED N#C[C@H](C(=O)c1ccc2ccccc2n1)c1nc(-c2c(F)cccc2F)cs1 68348706 PBJCWLGVEVNXLS-CYBMUJFWSA-N 391.402 5.127 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C1(C#N)CCCCC1 98114241 KLMAXICQCPSPOW-UHFFFAOYSA-N 376.460 5.052 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1nc(-c2ccccc2)cs1 107375227 UBZUCNODAKITKF-OAHLLOKOSA-N 390.512 5.494 30 20 GKED CCOc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c(C(F)(F)F)c1 119961571 KECBCXDVSHEVTM-QGZVFWFLSA-N 391.393 5.271 30 20 GKED C[C@H](Nc1cccc(Oc2ncc(Br)cn2)c1)c1ccc(C#N)cc1 120869170 PRUDKEQSWGAIKM-ZDUSSCGKSA-N 395.260 5.076 30 20 GKED CC(C)OCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 122390638 RGDJFRJSJUTSAW-ZDUSSCGKSA-N 383.300 5.108 30 20 GKED CC[C@H](C)n1ncc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 127919902 PMRNWDUTEFIEQF-SMDDNHRTSA-N 398.919 5.485 30 20 GKED CC[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1nccs1 130406261 VZKQIYMWBXPOAC-SFHVURJKSA-N 393.537 5.188 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)nc(-c2ccc(Cl)cc2)n1 131179545 MVNJHEMLQGEJIG-OAHLLOKOSA-N 396.903 5.175 30 20 GKED Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 135255896 HWHNFAOULOMLEA-IIBYNOLFSA-N 381.451 5.042 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)CCc2ccc(C#N)cc2)C1 136069845 RSPNSUSXHJVIDD-QRWLVFNGSA-N 386.417 5.119 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(F)cc1C(F)(F)F 159258211 LFEKCRAWKUSHJV-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@@H](c1ccccn1)N(C)C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 172233887 MIDWSYLHWIIXPP-HNNXBMFYSA-N 391.858 5.232 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)C(=O)c1cccc(F)c1 177603732 WKNLSMYOEIKKNI-KSSFIOAISA-N 392.455 5.035 30 20 GKED N#Cc1c(NC(=O)c2ccc(Cl)cc2Br)sc2c1CCCC2 177690049 PVQSLNBDMGOHTB-UHFFFAOYSA-N 395.709 5.167 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 179827542 PLNDWCKWRMQKIC-UHFFFAOYSA-N 379.419 5.158 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 182089333 APWOSEYIVURICB-MRXNPFEDSA-N 399.475 5.253 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@H]1/C=C/c1cccs1 182123158 XKRXVFQVZZXQMI-IJDCCNJMSA-N 399.491 5.279 30 20 GKED Cc1cc([C@H](C)NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)s1 182745232 PFIFSROJSKBQAR-ZFWWWQNUSA-N 387.574 5.049 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(NC(=O)C2CC2)ccc1C)c1ccc(F)c(F)c1 186203669 UWBGTMVILBLFSU-HXUWFJFHSA-N 399.441 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@]1(O)CCC[C@H](C(F)(F)F)C1 191511849 XLOIHPNIOZLZKK-JXFKEZNVSA-N 398.469 5.144 30 20 GKED N#CCCCOc1cccc(CNc2ccc(C(=O)Nc3ccccc3)cc2)c1 195149844 SRFRSQRMKNVSPO-UHFFFAOYSA-N 385.467 5.234 30 20 GKED CCOc1cc(CN[C@H](C)c2cccc(C#N)c2)ccc1OCc1ccccc1 237015284 VTEPVBCGFXUVIG-LJQANCHMSA-N 386.495 5.387 30 20 GKED C[C@H](NC(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1)c1ccc(C#N)cc1 248245275 JFZXGPQSLAMJBH-ZYSHUDEJSA-N 387.508 5.095 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@@H]2c2nnc(C3CCC3)o2)c1 289713106 OEEUIHGGWPBQKU-LJQANCHMSA-N 396.491 5.051 30 20 GKED N#Cc1c(Cl)nsc1Oc1ccc2c(-c3ccccc3)cc(=O)oc2c1 301930361 MQCLQMNMYFTJAM-UHFFFAOYSA-N 380.812 5.234 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1ccc(C(F)(F)F)cc1 409668000 WAYPSNLTQLIQJS-ZIAGYGMSSA-N 392.446 5.842 30 20 GKED C=CC[C@@H](Cc1ccccc1)NC(=O)Nc1cccc(NC(=O)CCC)c1C 416772028 IRABFACTMYZVDR-IBGZPJMESA-N 379.504 5.043 30 20 GKED N#C[C@H]1CC[C@H](Sc2nc3ccccc3c(=O)n2CCC2=CCCCC2)C1 430103853 HHNYTLMWKPQSPG-ROUUACIJSA-N 379.529 5.071 30 20 GKED COc1cc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc(OC)c1C 433148574 RKFYJKMBCORVRX-ZDUSSCGKSA-N 385.489 5.051 30 20 GKED COc1cccc(C)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 436238772 LENSFJHNEHGEOO-UHFFFAOYSA-N 392.842 5.573 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(CCC(F)(F)F)CC1CC1 438024346 RAWTWYZRTVCKRG-UHFFFAOYSA-N 395.343 5.075 30 20 GKED C[C@H](NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)c1nc(C(C)(C)C)cs1 438623627 DJXYDPDVWMGUPN-JTQLQIEISA-N 396.438 5.214 30 20 GKED C[C@@H](SCC(=O)Nc1ccccc1Cc1ccccc1)c1cccc(C#N)c1 443139528 ABMUESWYIAHJOU-GOSISDBHSA-N 386.520 5.582 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@H]1Cc1ccccc1 443850055 FJBDXZLDRRXAGX-OAQYLSRUSA-N 397.478 5.508 30 20 GKED CC[C@@H](C)n1c(C(F)(F)F)nc2cc(NC(=O)c3cc(C#N)oc3C)ccc21 452581733 DCKWFHGBXUZMDN-SNVBAGLBSA-N 390.365 5.052 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1ccc(Cl)cc1 453470107 ZHBYEOWBQAVUOW-RBUKOAKNSA-N 386.927 5.091 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccco1 454752175 LEVKDKJCZBSGAH-HNAYVOBHSA-N 381.501 5.290 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 457554033 OGXCRBANDJGIHE-OALUTQOASA-N 399.947 5.611 30 20 GKED Cc1cccc(Br)c1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 464187176 NAZGXYSZDVSXRB-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl)Cc1cccc(F)c1 469298846 WACGSQNMWVORAQ-SJCJKPOMSA-N 379.262 5.082 30 20 GKED C=C(C)[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)F)c1ccc(F)c(F)c1 475702795 NNYAYUUCZLGLMK-CLCXKQKWSA-N 393.380 5.103 30 20 GKED C=CCN(C(=O)CCCOCC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 476143110 HBSWNRVPSAXXPY-UHFFFAOYSA-N 399.343 5.453 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1 476779450 ZTEZDRJLFITWNL-OAQYLSRUSA-N 394.534 5.528 30 20 GKED COc1cccc(C(NCc2ccc(Cl)cc2C#N)c2cccc(OC)c2)c1 478396095 UMDWQPMVYFKRJT-UHFFFAOYSA-N 392.886 5.108 30 20 GKED C=CCOc1cccc(NC(=O)N(CC(C)C)[C@H]2CCCc3cccnc32)c1 480809328 CHFFBASCXHKVQY-NRFANRHFSA-N 379.504 5.214 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1cnc2ccccc2n1 483201419 MPNLFYGVRLJMHA-MRXNPFEDSA-N 399.475 5.247 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Cl)cc3C)n2)cc1 484110861 YPNDXVJYOQHQDQ-KRWDZBQOSA-N 382.872 5.271 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1OC(C)C 489554781 SLJIGANXQKRUPY-LEWJYISDSA-N 377.488 5.086 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(C(=O)C2CCC2)cc1 489676302 HGYJEGJYDDZVPD-UHFFFAOYSA-N 380.447 5.460 30 20 GKED C[C@@H](Sc1ccc(C#N)cn1)c1nc(O)c2c(-c3ccccc3)csc2n1 495268665 ZMGISZTWZSQLSP-GFCCVEGCSA-N 390.493 5.184 30 20 GKED N#C[C@H](NC(=O)c1ccc(Oc2ccccc2)nc1)c1c(Cl)cccc1Cl 499810517 AYAWYTZVJVLZGY-KRWDZBQOSA-N 398.249 5.175 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1 504917228 CISUVXGAZLPIMU-UHFFFAOYSA-N 391.821 5.075 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC 505024720 VTBNICNJVYSUPR-OAQYLSRUSA-N 380.488 5.191 30 20 GKED C[C@@H](CC#N)N(C)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 505118738 FRZQBEYCFNMLDJ-ZDUSSCGKSA-N 393.339 5.660 30 20 GKED N#Cc1ccc(Cl)c(C(=O)NCc2ccc(-c3nc4ccccc4s3)o2)c1 505916788 JLAGTJIYUYETOM-UHFFFAOYSA-N 393.855 5.011 30 20 GKED CC(C)c1cc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)nn1C(C)(C)C 505938938 RHSNQDNYTKYHNM-INIZCTEOSA-N 393.318 5.063 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(C#N)ccc1Cl 506806559 RJUVGIRRRMKPNV-UHFFFAOYSA-N 387.826 5.436 30 20 GKED Cc1ccc(OCc2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2)cn1 513052915 UIIKMRAMTBFJEW-LJQANCHMSA-N 399.475 5.069 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nnc(-c2ccccc2F)s1)c1ccc(F)c(F)c1 514193592 RHIZSVUJSGHGJK-XIKOKIGWSA-N 389.446 5.590 30 20 GKED COc1cc(CN[C@H](c2ccccc2Cl)c2ccccc2OC)ccc1C#N 515227914 ARVNKQJQHFLGHD-HSZRJFAPSA-N 392.886 5.108 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1c([N+](=O)[O-])cccc1C(F)(F)F 516215075 DTKACWWXFQNOFO-UHFFFAOYSA-N 396.218 5.024 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C(C)(c1ccccc1)c1ccccc1 517928088 IOKBCGMGNHXVEO-UHFFFAOYSA-N 380.491 5.079 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccc(C#N)cc1 519888499 AFTIXCNDBJOSQQ-KBPBESRZSA-N 375.394 5.041 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(-c3ccccc3OC)c2)cc1OC 520345352 KZZSPPZFFSTMLF-UHFFFAOYSA-N 389.451 5.188 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@H]2c2cccc3ccccc23)c1 521370856 PEZQECDWKRHZNG-VWLOTQADSA-N 398.506 5.624 30 20 GKED COc1ccc(C)cc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 524191739 KKKLCJDMXRUNRE-UHFFFAOYSA-N 392.842 5.573 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 524329363 FVMLAHTYYYJNIY-ZWKOTPCHSA-N 387.310 5.406 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C2CCCC2)C2CC2)cc1 531313984 JRUCDORGONEXRZ-UHFFFAOYSA-N 391.471 5.298 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(Cc2ccccn2)C(C)C)cc1 532046335 FDLOOUQFMUDKJI-UHFFFAOYSA-N 385.467 5.105 30 20 GKED CSc1ccc(C)c(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c1 537219364 JCBFFKLXPGOBHL-UHFFFAOYSA-N 395.528 5.100 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCOc2cc(Cl)ccc21 539406880 FSHYCSCDDAXAQT-HXUWFJFHSA-N 397.906 5.047 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)s1 540609118 AFAQJGKPRQHSNJ-LJQANCHMSA-N 383.314 5.261 30 20 GKED CN(Cc1ccccc1)Cc1cccc(C(=O)N[C@H](CCC#N)c2ccccc2)c1 543155241 NFAFDEMEOLNIAI-RUZDIDTESA-N 397.522 5.093 30 20 GKED C[C@H](NCC#Cc1ccc(C(F)(F)F)cc1)c1nc2ccccc2n1C(F)F 548074869 DMSYKTRTHUMPIH-ZDUSSCGKSA-N 393.359 5.153 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc(F)ccc1Cl 555820676 WKMQODKPUOJPDS-UHFFFAOYSA-N 394.833 5.491 30 20 GKED CC(C)(CCC#N)CN[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl 558237076 GADHVQTYRIOHOE-NRFANRHFSA-N 384.907 5.120 30 20 GKED N#Cc1ccc(CN2CCC(c3ncccc3Cl)CC2)c(C(F)(F)F)c1 565571919 PNFNWPXGTBQUQQ-UHFFFAOYSA-N 379.813 5.005 30 20 GKED CC(C)OC1CCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CC1 567327344 KXGRVVJVEWFHIN-UHFFFAOYSA-N 395.528 5.131 30 20 GKED N#CC(CCOc1nnc(-c2ccccc2)o1)(c1ccccc1)c1ccccc1 570581882 SWUZRUXKFQVJMM-UHFFFAOYSA-N 381.435 5.015 30 20 GKED Cc1cccc([C@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)c1 573971377 VSECIJFMRUYJDR-NRFANRHFSA-N 381.401 5.160 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cccc(-c4cccnc4)c3)cc2)ccn1 577802983 VAWFUUNNHKJZMQ-UHFFFAOYSA-N 378.435 5.420 30 20 GKED N#CCCCCCC(=O)Nc1ccc(Oc2cccc(F)c2)c2ccncc12 588345068 RHFKLACPWQKFNR-UHFFFAOYSA-N 377.419 5.579 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccccc1 590116385 CUJHHMQKMLSJJV-DYESRHJHSA-N 391.540 5.840 30 20 GKED CC(C)(C#N)S(=O)(=O)c1ccc(-c2ccccc2OC2CCCCC2)cc1 592985955 JGYLWEWIVJEVLB-UHFFFAOYSA-N 383.513 5.141 30 20 GKED Cc1ccc([C@@H](NC(=O)N2CCC[C@H](CC#N)C2)c2ccc(F)cc2Cl)cc1 596283403 VHPATYSIYISAFD-IIBYNOLFSA-N 399.897 5.212 30 20 GKED Cc1ccc(C(F)(F)F)c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 597077841 ZHXOLNRJKDMXCS-UHFFFAOYSA-N 375.394 5.328 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(-c3cccc(OC(F)(F)F)c3)s2)C1 597906892 SPSYWIHJYIKSGV-ZDUSSCGKSA-N 394.418 5.080 30 20 GKED CCc1cc(C#N)c(NC(=O)CSc2ccc3c4c(cccc24)CC3)s1 604027557 DPCSVPICJNZARC-UHFFFAOYSA-N 378.522 5.165 30 20 GKED Cc1ccc2c(c1)N(C(=O)c1ccccc1SCc1ccc(C#N)cc1)CC2 604505403 VKPQHDAJOGSGAZ-UHFFFAOYSA-N 384.504 5.362 30 20 GKED C[C@@H](S[C@@H]1CCCc2ccccc21)C(=O)N(CCC#N)c1ccc(F)cc1 608801742 MIKFFMRPKSCBTK-IIBYNOLFSA-N 382.504 5.272 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccccc1)C(F)(F)F 609682385 ISGZRSHHGFTHJJ-CXAGYDPISA-N 393.434 5.363 30 20 GKED CSc1nc(C2CC2)cc(C(=O)N(C)c2ccc(-c3ccccc3)cc2)c1C#N 610296284 KEXNFSYSCUDMRF-UHFFFAOYSA-N 399.519 5.496 30 20 GKED Cc1[nH]c2ccc(C(=O)[C@H](C#N)c3nc4cc(Cl)ccc4s3)cc2c1C 613403899 XGLOKAXAWUUYSA-HNNXBMFYSA-N 379.872 5.538 30 20 GKED O=C(Nc1c(F)cccc1Cl)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 646345144 LWOSTQHWJVIWJS-YUMQZZPRSA-N 392.702 5.074 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(OCc3ccc(F)cc3)c2)c1 726454983 GKIQKAOCMPYOQR-UHFFFAOYSA-N 376.456 5.195 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(Cl)c2Oc2cccnc2)c1 726476066 DVIKJVRNSJAKLF-UHFFFAOYSA-N 379.872 5.318 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1ccc(Cl)c(Cl)c1O 727648607 MYHVJTNYDGYHJS-UHFFFAOYSA-N 381.288 5.157 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2sc(CC(C)C)nc2C)cc1 727954900 VUHPWJXQDXSOIP-KSSFIOAISA-N 397.544 5.125 30 20 GKED N#CCn1c(C(=O)OCc2nc3ccccc3c3ccccc23)cc2ccccc21 729767329 DGEVXMXUVPYRJG-UHFFFAOYSA-N 391.430 5.223 30 20 GKED N#C[C@H](C(=O)c1sc2ccccc2c1Cl)c1nc2cc(F)ccc2s1 730421769 PCUJTZQFSXWOTH-LLVKDONJSA-N 386.860 5.794 30 20 GKED C=CC[C@H](NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1)c1ccncc1 734458032 SGEGDNCTFAULRH-SFHVURJKSA-N 399.516 5.175 30 20 GKED O=C(/C=C/c1nccs1)c1ccc(-c2ccccc2Br)s1 735229257 XFUYFXMZSPJOID-VMPITWQZSA-N 376.300 5.530 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(NC2CCCCC2)s1 735231373 UDIALDNSDGEXRN-UHFFFAOYSA-N 394.953 5.131 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(Oc2ccc(C(C)(C)C)cc2)nc1 741213092 ZARFCLHCYZQGLO-UHFFFAOYSA-N 379.504 5.183 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)CCC(=O)N3)cc1 741467356 KYKOSFRSSPMAAK-ZSOIEALJSA-N 383.447 5.143 30 20 GKED Cc1cccc(F)c1CNC(=O)c1ccccc1Sc1ccccc1C#N 742727071 JLHCRONJTHECMK-UHFFFAOYSA-N 376.456 5.087 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 744117523 WVCWBPBTJSOLGR-MRXNPFEDSA-N 381.476 5.079 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc(Cl)c1OC 745989941 HGJCCSXNUXBFPG-FPYGCLRLSA-N 379.843 5.315 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1 747210903 PCKDXHWGSLLCBY-LJQANCHMSA-N 396.475 5.113 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2cnc(-c3ccncc3)s2)cc1OC 753143163 IGFHMIUNVBYDOO-VOTSOKGWSA-N 394.496 5.289 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1cc2c(ccc3ccccc32)o1 753143263 VVKAFJRTYYDIQZ-VOTSOKGWSA-N 382.444 6.001 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCCc2cc(Cl)cc(Cl)c2)c(Cl)c1 754412146 GFGKCJAANYYQQR-UHFFFAOYSA-N 388.081 5.144 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)Cc1ccc(OCC#N)cc1 759404111 PYTMAGDBJHBZJN-QGZVFWFLSA-N 377.513 5.214 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@H](C)c2ccc(F)cc2F)c1C(F)F 768150772 PDPZKYPZDHASIK-SSDOTTSWSA-N 398.278 5.056 30 20 GKED CC(C)(NCc1cc(Cl)ccc1OCC#N)c1ccccc1Br 775538400 FNEVIQQOXVKHPD-UHFFFAOYSA-N 393.712 5.030 30 20 GKED C=CCC[C@@H](NCc1ccc(OC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 775551748 AOMQJLZXHZNJTJ-HXUWFJFHSA-N 377.406 5.428 30 20 GKED C=CCN(CCc1ccco1)C(=S)Nc1ccccc1Oc1ccccc1 778534116 WMVCWILAZKXPQK-UHFFFAOYSA-N 378.497 5.499 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cnc3ccccc3c2)cc1 784345628 GFALNVVMCFQHKL-HSZRJFAPSA-N 377.447 5.071 30 20 GKED C#CCC1(C(=O)Nc2cccc(C[S@](=O)Cc3ccccc3)c2)CCCCC1 788223460 MKBSHXKZBYSFLR-MUUNZHRXSA-N 393.552 5.048 30 20 GKED COc1cc(OC2CC2)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 790292181 HYTORHFVPPUWNF-HSZRJFAPSA-N 398.462 5.144 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Cl)cc1-c1ccccc1Cl 791013041 PMOHITVPOBBDML-UHFFFAOYSA-N 397.261 5.815 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792108853 ZKLHRYPQTOQEAO-IFXJQAMLSA-N 393.284 5.052 30 20 GKED COc1ccccc1-c1ncc(C=NN=C2c3ccccc3-c3ccccc32)cn1 792957349 CEICGVRMJMPUFE-UHFFFAOYSA-N 390.446 5.004 30 20 GKED Cc1c(C(=O)COC(=O)C[C@H](CC#N)c2ccccc2)sc2ccccc12 795985617 LRELYXQUPDVIAE-KRWDZBQOSA-N 377.465 5.023 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)Nc3ccccc3O[C@H](C)C#N)c2)o1 797642672 JUJRRMUAWPXMEJ-MRXNPFEDSA-N 375.428 5.498 30 20 GKED N#CCCCCCC(=O)O[C@@H](c1cccc(Br)c1)C(F)(F)F 805892445 FBHMPJRQLDANJZ-AWEZNQCLSA-N 378.188 5.070 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc2c(c1)CCC(=O)N2C 811692694 GYNIZRPBKVVHSB-BGDPHZDFSA-N 397.421 5.039 30 20 GKED O=C(/C(=C/c1cnn(CC(F)F)c1)c1nc2ccccc2s1)c1ccccc1 814187645 PKONQIAECJMWPU-YBEGLDIGSA-N 395.434 5.181 30 20 GKED COc1cc(Cl)cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 814306123 WSEVQFZJPYWGEN-NRFANRHFSA-N 376.843 5.256 30 20 GKED CSc1ccc2cc(CN[C@H](CCCC#N)c3ccccc3)c(Cl)nc2c1 814661180 XDBGCTYQYFGLOJ-HXUWFJFHSA-N 395.959 6.135 30 20 GKED C=CCOc1ccccc1-c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 904508274 TXHCGVIATZALAW-UHFFFAOYSA-N 389.386 5.295 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C)[C@@H](C)c2ccccc2Cl)cc1OC 914490833 KYKLPJZRMDRAJH-KVNDZABWSA-N 385.891 5.146 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 918034654 SXVXHAQJYUKBJU-LOSJGSFVSA-N 395.506 6.020 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)Cc1ccco1 919906305 WAPPBMSKLHXIEY-MRXNPFEDSA-N 375.428 5.005 30 20 GKED COc1ccc(-c2ccccc2)cc1C=NNc1ccc(Cl)c(C(=O)O)c1 1776033402 AZFAKBVHZUOFQE-UHFFFAOYSA-N 380.831 5.160 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(C(=O)O)c(F)c2)cc1 1776074084 HKPWHULMLPSDQT-UHFFFAOYSA-N 378.403 5.036 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(C(F)(F)F)c(Cl)c2Cl)cc1F 1776076559 VAXPERKTPCRQBX-UHFFFAOYSA-N 395.139 5.296 30 20 GKED Cc1c(NN=C(CCc2ccccc2)CCc2ccccc2)cccc1C(=O)O 1776087334 VULKONVITHLCCS-UHFFFAOYSA-N 386.495 5.727 30 20 GKED O=C(O)c1ccoc1COc1ccc(/C=C/C(=O)c2cccc3ccccc23)cc1 1776114293 LDPUEGJFYWYBOO-JLHYYAGUSA-N 398.414 5.606 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1cc(C(=O)O)ccc1Br)CC2 1776374592 CTWXGNFRFKUFAM-OQLLNIDSSA-N 399.284 5.483 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(OCC(F)(F)F)c(F)c1 1776783892 HVTQZBBYPYWVMI-OAHLLOKOSA-N 393.421 5.060 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)ccc1Cl 1777263381 KWIICICLDDHHQP-JXMROGBWSA-N 398.867 5.671 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3cccc(C(=O)O)c3F)s2)cc1 1777430600 PELGKCRKPVCROK-ZHACJKMWSA-N 381.428 5.160 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2ccc(CC(=O)O)cc2)cc1 1777472273 AFFTYJRTJVVFEF-GDNBJRDFSA-N 386.447 5.097 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3cc(Cl)ccc3Cl)o2)c1 1777686199 VZMOCRLDLCYEIV-VMPITWQZSA-N 387.218 5.848 30 20 GKED N#C[C@@H](C(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)c1ccccn1 41482403 GXIPOWGHYUEWOT-HXUWFJFHSA-N 383.426 5.178 30 20 GKED Cc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 46872345 SABUWJFDGIOYQZ-HXUWFJFHSA-N 390.874 5.021 30 20 GKED CC(=O)Nc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)ccc1Cl 63336466 REKYJNCNBQXFDE-UHFFFAOYSA-N 389.842 5.089 30 20 GKED CC(C)Oc1ccccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 66953829 NTEROGVSHQLPIT-INIZCTEOSA-N 383.517 5.190 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cccc(-c2ncc[nH]2)c1 103964791 GBORSROZWVTMHT-UHFFFAOYSA-N 396.475 5.352 30 20 GKED Cc1ccc(CCCCC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 114619447 PKQPKVBPAOYFNH-IBGZPJMESA-N 375.497 5.103 30 20 GKED C[C@@H](Sc1nnc(-c2cccc(Br)c2)o1)c1ccc(C#N)cc1 118173663 RBKZCWAHNBOBEG-LLVKDONJSA-N 386.274 5.224 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1c(C)noc1C 124618682 BKEFGYNLUPCAAL-FQEVSTJZSA-N 390.443 5.228 30 20 GKED C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)Nc1ccc(F)cc1OCC#N 135248514 LMCMZDLYKANPDZ-LLVKDONJSA-N 396.249 5.260 30 20 GKED CCOc1ccc(-n2c(Cc3ccccc3)nnc2SCCCCC#N)cc1 135961353 UFWSESMAHDXQOO-UHFFFAOYSA-N 392.528 5.043 30 20 GKED Cc1ccc(Br)c(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 153625808 ZAHKXTUCEJNBMK-ZDUSSCGKSA-N 389.318 5.404 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F 154257915 PZPUVIYBISXANV-NSHDSACASA-N 382.382 5.349 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3ccc(C#N)cc3)s2)cc1 174094305 ZJQLNKXVFKVFLT-HUUCEWRRSA-N 377.513 5.411 30 20 GKED Cc1cc(CCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c(C)s1 175947548 MJCIUVZHPBHLEM-HNNXBMFYSA-N 387.455 5.309 30 20 GKED N#CCCCOc1cccc(CNc2nnc(Cc3cccc4ccccc34)o2)c1 181656641 YTDXUMXWTXIRMO-UHFFFAOYSA-N 398.466 5.108 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC)cc1OC(F)F 189879974 REAPYMSHNVMICW-UHFFFAOYSA-N 375.415 5.401 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCOc1ccc(C#N)cc1OC 189910643 WYBIMIJRGQKAJN-UHFFFAOYSA-N 392.499 5.216 30 20 GKED CN(Cc1ccccc1OC(F)(F)F)C(=O)Nc1ccc(C(C)(C)C#N)cc1 193051288 OWFIIDRWTJLRHK-UHFFFAOYSA-N 391.393 5.050 30 20 GKED COc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc(C)cs3)c3ccccc3n2)cc1 193271023 FGVCQNJDOZVYDA-LJQANCHMSA-N 399.475 5.165 30 20 GKED Cc1csc(-c2cccc(N=C(O)N3CCC[C@@H](c4nc(C)cs4)C3)c2)n1 328601897 GHYCNYUIANDWIS-MRXNPFEDSA-N 398.557 5.309 30 20 GKED O/C(=N/CC1(c2cccc(Cl)c2)CCCC1)c1coc(C2CCOCC2)n1 328769568 CFFSNASQCYBFRA-UHFFFAOYSA-N 388.895 5.039 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN(Cc2ccc3c(c2)CCC3)C1)C1CCCC1 329401486 YDNKTWOKMNOFAD-OAQYLSRUSA-N 392.547 5.056 30 20 GKED Cc1cnc([C@H](C)C/N=C(/O)[C@@H]2CCn3c(cnc3C3CCCCC3)C2)s1 329406274 CTBSEKKEVIVLGD-RHSMWYFYSA-N 386.565 5.018 30 20 GKED COc1cccc([C@@H]2C[C@@H]2/C(O)=N/[C@@H]2CCCc3cn(C4CCCC4)nc32)c1 329522568 RESFIZMANQZYHQ-PCCBWWKXSA-N 379.504 5.144 30 20 GKED O/C(=N/[C@H]1CCOC2(CCCC2)C1)c1ccc2nc(-c3ccccc3)oc2c1 330016157 PCYZBANTZVGIFV-SFHVURJKSA-N 376.456 5.291 30 20 GKED N#CC1(CCCN[C@@H]2CCC[C@@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 375621711 WIZVJRXQBVEAMV-RTBURBONSA-N 380.454 5.032 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H]2c3ccccc3CC23CCOCC3)cc1 411742445 DKAUPGWUSLPYAN-SANMLTNESA-N 394.518 5.409 30 20 GKED C=CCC[C@H](C(=O)NCCc1nc2ccccc2n1C(C)C)c1ccccc1 427454823 DXWQBIUCTZMORK-FQEVSTJZSA-N 375.516 5.026 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(-c3cc4ccccc4o3)cs2)c1 429940553 ACRLZXXZQDSHTI-UHFFFAOYSA-N 391.477 5.424 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1ccccc1Cl 430635724 WEKDKTKGDDMELE-CYBMUJFWSA-N 398.919 5.078 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 433924441 CMTLKDHQDSKRGT-HNNXBMFYSA-N 390.414 5.028 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2C[C@H]2c2c(F)cccc2Cl)c2ccccc21 437272218 IMYLLMOHTLJDHY-DNVCBOLYSA-N 395.865 5.023 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H](C)c1ccc(F)cc1F 438052275 IJMKHDYVMSLDDQ-UONOGXRCSA-N 389.471 5.284 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H]2CCC[C@H]21 444380428 DJMYEMLHCWCTJP-PGRDOPGGSA-N 375.472 5.455 30 20 GKED C[C@H](NCc1ncc(C(C)(C)C)s1)c1ccc(-c2cccc(C#N)c2)cc1 447898002 QUNZCRHZPZTSJE-INIZCTEOSA-N 375.541 5.830 30 20 GKED C[C@H](c1ccc(C(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1)C(F)(F)F 455825548 PBRFRFFGJYQWDS-UIAACRFSSA-N 386.417 5.264 30 20 GKED C=CCC[C@@H](CC)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 461892044 YWKVXNMTHWYUQJ-CTNGQTDRSA-N 391.964 5.167 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1coc(-c2cccc(Cl)c2)n1 464814361 LOUVYKLMAHPRLS-SFTDATJTSA-N 377.875 5.267 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1 465139345 SSDCSPZFMGMKMD-UHFFFAOYSA-N 389.282 5.552 30 20 GKED C=C[C@](C)(CC)C(=O)N(C)c1ccc(Cl)c(N(C)C(=O)[C@](C)(C=C)CC)c1 467971651 WZZPNUONWHYLDZ-FGZHOGPDSA-N 390.955 5.470 30 20 GKED CC(C)[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)cc1 469357962 RECUMARWOODWRP-QHCPKHFHSA-N 395.934 5.732 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c(Cl)c1 469818447 FXCXNZHEVBKNMS-UHFFFAOYSA-N 395.890 5.638 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)[C@H]2C)cc1 470629565 VMASNTBQJSAJNX-RDTXWAMCSA-N 388.389 5.072 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1nc2ccccc2[nH]1)C(C)C 475543659 DGLOGYONQUGHLW-NRFANRHFSA-N 390.531 5.934 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(-c2ccncc2)cc1 475568907 HFDIZRLOMRLVPU-UHFFFAOYSA-N 385.511 5.922 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1C1CC1 477321156 KGFSPWCASTXJDX-MRXNPFEDSA-N 399.498 5.599 30 20 GKED C[C@H](NC(=O)Nc1cccc(COCCc2ccccc2)c1)c1ccc(C#N)cc1 480297689 ZEQMLXXZYFMKLH-IBGZPJMESA-N 399.494 5.200 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCC[C@H]1C(F)(F)F 483651073 RLUUCXTYIZHLHZ-QLFBSQMISA-N 399.482 5.571 30 20 GKED CC(C)(C#N)c1ccccc1CNc1ccc(C(=O)NC2CCCCC2)cc1 486453098 SGIXOLMWDKKSCE-UHFFFAOYSA-N 375.516 5.162 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1OC(C)C 489554783 SLJIGANXQKRUPY-RTWAWAEBSA-N 377.488 5.086 30 20 GKED Cc1ccnc2sc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c(C)c12 489852273 JHQISXCITBGNIL-LBPRGKRZSA-N 396.422 5.148 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2Cc2nnc(-c3cccc(C#N)c3)o2)cc1 490630852 XGIGMQHYLFSIPY-JOCHJYFZSA-N 386.499 5.459 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)c1 504100202 XKFQBZIPMQFYNQ-HNNXBMFYSA-N 379.485 5.258 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(Cc1ccco1)C(C)C 509222350 BTMBUBICVKUDGI-UHFFFAOYSA-N 389.455 5.695 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)cc1Br 509885535 MFFSLYBCHQDIID-ZDUSSCGKSA-N 385.286 5.166 30 20 GKED CCCCc1ccc(N(C(=O)CSCC#N)c2nc3ccccc3s2)cc1 512142515 LRUMKRJCPKTEPB-UHFFFAOYSA-N 395.553 5.560 30 20 GKED CC(=O)c1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)s1 512183061 TYCGFEZSRXBRBF-LBPRGKRZSA-N 386.542 5.287 30 20 GKED CC[C@H](C)[C@@H](C)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CC1 513278785 HYIIQTRQFZSIMU-ZWKOTPCHSA-N 376.500 5.176 30 20 GKED Cc1oc(C(C)C)nc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 513634161 WYPDJZVSABTVEP-CQSZACIVSA-N 385.876 5.373 30 20 GKED CC(C)[C@H](NS(=O)(=O)CCCCC#N)c1ccc(C2CCCCC2)cc1 517582402 RJTANTBTYAUWDX-NRFANRHFSA-N 376.566 5.045 30 20 GKED COc1ccc(CCCCC(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)cc1 517767897 OTUXJXDQUGTAJL-UHFFFAOYSA-N 391.496 5.042 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)CCc1ccccc1 520854491 UCAUNOUISNUCPW-QGZVFWFLSA-N 381.545 5.471 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2ccccc2OCc2ccccc2)cc1 522283027 RPBGSIHTHQMCGI-UHFFFAOYSA-N 387.483 5.185 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@@H]3CSc4ccccc43)cc2)cc1 524002855 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N#CCC[C@H](C#N)COc1ccc(Sc2ccnc3cc(Cl)ccc23)cc1 562769271 JQTPHYIXWHJUJE-OAHLLOKOSA-N 393.899 5.862 30 20 GKED CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)SCc1ccc(OC)c(C#N)c1 573836251 CHSVROSPQBBAFH-HZPDHXFCSA-N 382.529 5.341 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCc3cccnc32)cc1Cl 589830564 XCLCVZPQNBXKBM-PMACEKPBSA-N 387.870 5.059 30 20 GKED COc1ccc2c(c1)c(C(=O)N1CCC[C@@H](CC#N)C1)c(C)n2C1CCCCC1 597912754 JRAQMJARDZAAAH-SFHVURJKSA-N 393.531 5.229 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2cccc(F)c2)cc1Cl 603758808 IZLLVEJITPPVJP-HXUWFJFHSA-N 394.833 5.152 30 20 GKED CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 604509042 WAUIDZULWFJQKZ-KRWDZBQOSA-N 382.533 5.038 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccccc1F 608847534 OSMJWHSOPQGRCA-HNNXBMFYSA-N 375.403 5.017 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)Cc1ccc(OCc2cccnc2)cc1 609536648 ORHYJXCFCHSYJM-UHFFFAOYSA-N 385.511 5.190 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1)c1cccc(C#N)c1 610356275 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N#CCOc1cccc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)c1 730151603 NWBFGQNMZHJCQK-GZTJUZNOSA-N 399.219 5.276 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 732901693 ZZOFROCIHSIFRR-QFBILLFUSA-N 394.927 5.909 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)[nH]c12 735793800 ZABXMZZTUQFLEU-SOUVJXGZSA-N 384.266 5.158 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2[C@H]3CC[C@H]2c2ccccc23)c1=S 739875672 HFNQISVXPKOUQR-PMACEKPBSA-N 392.503 5.255 30 20 GKED Cc1ccc(C(=O)Nc2cc(C#N)cn2C(C)(C)C)cc1NC(=O)OC(C)(C)C 744363410 SZZHRFWHCWYZIM-UHFFFAOYSA-N 396.491 5.023 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1cnn(C(C)C)c1 746679746 VATKFYYATZWMMF-UHFFFAOYSA-N 390.516 5.280 30 20 GKED Cc1ccc(Cl)c(NC(=S)N[C@H](CCC#N)c2ccccc2)c1Cl 747711191 YELVWQGANHIPBW-OAHLLOKOSA-N 378.328 5.633 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3csc(-c4ccoc4)n3)cc2)cc1 748688138 OIRCMWZUYSWBKM-UHFFFAOYSA-N 388.404 5.286 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cn(C)c4ccccc34)n2)cc1 756231713 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CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 796790651 UFQCCECDUNFXAA-DOIPELPJSA-N 380.532 5.065 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1Cc2ccc(Cl)cc2C1 800537741 HXIQCFOMABALEX-DYVFJYSZSA-N 385.920 5.023 30 20 GKED C[C@@H](C#N)OCCSc1nnc(-c2ccc(C(C)(C)C)cc2)n1C1CCCC1 801652965 XMHAWUIHIXTFKC-INIZCTEOSA-N 398.576 5.378 30 20 GKED C[C@@H](OC(=O)c1cccc(C(F)(F)F)c1F)c1ccc(C(F)(F)F)nc1 803064952 WWTXRBLPZUQVLU-MRVPVSSYSA-N 381.247 5.176 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1ccccc1C(F)(F)F 810194944 QRNWBYJBLTUKND-HJWRWDBZSA-N 387.279 5.102 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1c(Cl)cccc1Cl 813216050 FKFBMQGXYQMJEX-MWLCHTKSSA-N 387.188 5.387 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cc(OC)c1OC 818259282 BTOMAARFIXVWKT-WDZFZDKYSA-N 380.465 5.337 30 20 GKED N#C[C@H](C(=O)Cc1csc(C2CC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 873499150 YKNJBWXCDCMDGS-OAHLLOKOSA-N 399.928 5.216 30 20 GKED CC(=O)c1ccc(C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)s1 914887313 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6.025 30 20 GKED C=C(C)[C@@H](NCc1cccc(SC(=O)N(C)C)c1)c1ccc(F)c(F)c1 187772549 MEKKZHMFJXJHEM-LJQANCHMSA-N 376.472 5.146 30 20 GKED C=C(C)COc1cc(CNc2ccc(OCC3CCOCC3)cc2)ccc1OC 237403542 NWOMOOLFYZAWAD-UHFFFAOYSA-N 397.515 5.068 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](COc2ccccc2)C1 272598535 XESWSBNVYLTKMN-ZWKOTPCHSA-N 395.528 5.014 30 20 GKED Cc1cccc(-c2nnc(Sc3cccc(F)c3C#N)n2Cc2ccco2)c1 301137046 BFAMMDLQEGVKMB-UHFFFAOYSA-N 390.443 5.057 30 20 GKED COc1cc(C2(C(=O)Nc3ccc(C(C)(C)C#N)cc3)CCCC2)ccc1C 303260275 FBJKILMVVJHVJQ-UHFFFAOYSA-N 376.500 5.255 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)ccc2Br)sc2c1CCCC2 318082261 HEIFKOXFBWSJAM-UHFFFAOYSA-N 395.709 5.167 30 20 GKED N=C(O)[C@@H]1CCCN(Cc2ccccc2N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)C1 329055900 ICZGZRPCERVQKG-OYNPSCLESA-N 397.563 5.628 30 20 GKED CCOc1ccc(N/C(O)=N/[C@H]2CCCc3cn(C4CCCC4)nc32)c(C)c1 329373622 JZSZVACKYPYQEO-FQEVSTJZSA-N 382.508 5.109 30 20 GKED C[C@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)[C@H]1COc2ccccc21 329482654 RPDLXPOWOSRQFA-YRISNDGFSA-N 393.531 5.014 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)C1CCC(/N=C(/O)C2CC2)CC1 330006594 CXSIMBNUUKKENL-QHGAOEGBSA-N 397.563 5.238 30 20 GKED C[C@H](/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cn(C)c2ccccc12 330014713 BBJSHMNAJPDOEJ-HRAATJIYSA-N 390.531 5.628 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCc1sccc1Cl 419590066 JVZGMQORTPCDEY-LBPRGKRZSA-N 396.990 5.525 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)c(Cl)c1 426161289 LTCSAIOUFUHAOL-LJQANCHMSA-N 397.265 5.171 30 20 GKED Cc1ccc(Br)cc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430603098 IZYFIQXWHRYMSF-ZDUSSCGKSA-N 377.307 5.002 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)Nc1cccc(C#N)c1C 430800239 QCQFSIYPYXYPKY-UHFFFAOYSA-N 386.238 5.389 30 20 GKED C[C@@H](c1ccccc1Cl)N(C(=O)c1cc(-c2cccc(C#N)c2)no1)C1CC1 436406123 BFPOEEHLMSOUDQ-AWEZNQCLSA-N 391.858 5.232 30 20 GKED C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639746 YDBACPZCPOQCTK-WFASDCNBSA-N 391.368 5.126 30 20 GKED C[C@H](N[C@H]1CC[C@@H](CC#N)C1)c1ccc(Br)cc1C(F)(F)F 453285532 BMGMGIHUYBQKSW-GVXVVHGQSA-N 375.232 5.201 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(Cl)cc2)c(Cl)c1 455730792 KYEBYTMFHDELLR-IBGZPJMESA-N 388.298 5.819 30 20 GKED Cc1ccc(Cl)c(N(Cc2cccnc2)C(=O)c2ccc(C#N)cc2C)c1 466620358 SRJKTYJQUBKAOF-UHFFFAOYSA-N 375.859 5.071 30 20 GKED COc1ccccc1[C@H](NCc1ccc(F)c(C#N)c1)c1ccccc1Cl 467764139 ZBJOYMICDLDESU-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCN1c2ccccc2CC[C@H]1C 469196994 ZDIJQINENINRQZ-MSOLQXFVSA-N 393.556 5.251 30 20 GKED C[C@@H](C(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)C(F)(F)F 474259966 QEMCYUAHWAXBLB-XVKPBYJWSA-N 381.238 5.014 30 20 GKED C=CC1CCN(C(=O)N[C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 477505280 YHTULRPAYNSPRA-AWEZNQCLSA-N 389.952 5.441 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)cc1 481930055 YQWKUVOQWWSWOD-UHFFFAOYSA-N 396.450 5.179 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(-c2ccco2)cc1F 490502241 XLFIOAPKCYCBMJ-GHTZIAJQSA-N 389.430 5.389 30 20 GKED C=CCc1cc(CN[C@@H](c2ccccc2)c2cccc(Cl)c2)cc(OC)c1O 500113454 VBNAJTGOEQJDRH-QHCPKHFHSA-N 393.914 5.662 30 20 GKED N#Cc1cccc(CNC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c1 500230198 JZEUEFASXWTTLT-UHFFFAOYSA-N 384.464 5.157 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCc1ccc(C2CCC2)cc1 502896505 PDMXTMLEBXCQLR-UHFFFAOYSA-N 380.536 5.019 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1nc(-c2ccccc2)cs1 504757147 QETBSQVOLKGLPP-UHFFFAOYSA-N 387.489 5.663 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cc(C#N)ccc1Cl 506743649 MJTMTRZIGUZYTJ-LBPRGKRZSA-N 381.888 5.135 30 20 GKED CC(C)c1ccccc1NC(=O)CSc1nc(-c2ccccc2)ccc1C#N 510188728 DHJZBPQRLCQWMK-UHFFFAOYSA-N 387.508 5.474 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@@H](C)c2ccc(C#N)cc2F)cn1 512637037 QUHMAWUSAPRGGE-INIZCTEOSA-N 391.446 5.134 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4ccc(C(F)(F)F)cn4)cc3c2C1 513158220 ADHCVRFFKFPOEN-SJCJKPOMSA-N 397.400 5.197 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccc(OC4CCCC4)cc3)cc2)nc1 517654991 OLQLYDVCACASRS-UHFFFAOYSA-N 399.450 5.319 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 518728595 LVNKVVDVOGVHJI-UHFFFAOYSA-N 390.464 5.322 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccs3)cc2)cc1 519052742 DMERVNIOENQFEX-FQEVSTJZSA-N 389.480 5.781 30 20 GKED Cc1ccc(NC(=O)Nc2cccc3c2CCN(Cc2cccc(C#N)c2)C3)cc1 520239410 DOJOBSBKZQHACJ-UHFFFAOYSA-N 396.494 5.069 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1OCC 520923958 AWEYDHRKAYTZIW-INIZCTEOSA-N 398.528 5.521 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2ncc(-c3ccccc3F)o2)n1 525111451 YPZHFYRCMCCBPI-UHFFFAOYSA-N 393.365 5.367 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl)OCC 534491265 ONDHZALWOIMBNG-KRWDZBQOSA-N 395.286 5.491 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(C#N)c(F)c2)c2ccc(F)cc2)cc1 537405633 RDLBEXPWGCERCN-NPMXOYFQSA-N 378.422 5.285 30 20 GKED C=CCN(C(=O)c1cc(C)n([C@@H](C)C2CC2)n1)c1nc(-c2ccccc2)cs1 538492285 CWHLFFYEHGFZKX-INIZCTEOSA-N 392.528 5.119 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 538855603 ZNHVTTCWRHESGH-HXUWFJFHSA-N 389.886 5.307 30 20 GKED Cc1ccccc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541076018 WESBITIUZJSWAA-RBUKOAKNSA-N 383.495 5.212 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 542403551 PELRRUFGGVDRNO-UHFFFAOYSA-N 388.496 5.187 30 20 GKED N#C[C@@H](C(=O)c1cncc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 543058901 ZXXSSMPPALXEFA-KRWDZBQOSA-N 389.867 5.502 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)CC1 543829651 YWLFTVCGMCFIMH-UHFFFAOYSA-N 394.475 5.260 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ncc(Br)cc1F 550826388 DOAKKQWYWWPMOG-DYVFJYSZSA-N 376.273 5.069 30 20 GKED C=CCC(C)(C)c1noc(-c2ccc(Cl)c(NC(=O)c3cccs3)c2)n1 581206082 UXANWILFGCNGQH-UHFFFAOYSA-N 387.892 5.558 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cncnc3-c3ccccc3)c2C#N)[C@@H](C)C1 584515776 FAQHCLZORFOLLZ-KBPBESRZSA-N 388.496 5.015 30 20 GKED N#CCCCCCC(=O)N[C@@H](CC(F)(F)F)c1ccc(Br)cc1 588677837 DDDIASDWVASJFA-AWEZNQCLSA-N 391.231 5.033 30 20 GKED N#CC1(c2ccccn2)CCN(CC(Cc2ccccc2)Cc2ccccc2)CC1 589517613 RLSRXXVJCKFDHW-UHFFFAOYSA-N 395.550 5.040 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@H]2c2ccccc2OC)c1 592338752 HLBUGTCXDSQKOE-NRFANRHFSA-N 380.488 5.409 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)Cc2sc(C)nc2-c2cccs2)cc1 594029498 XXPINZGNDYXDKV-KRWDZBQOSA-N 395.553 5.008 30 20 GKED Cc1sc(NC(=O)[C@@H](C)Sc2ccc(Br)cc2)c(C#N)c1C 603946835 DKXCONSVKHTZAC-LLVKDONJSA-N 395.347 5.118 30 20 GKED CCOC(=O)c1sc(NC(=O)c2oc3c(C)ccc(C)c3c2C)c(C#N)c1C 604382242 CHTMCFZECNCGDN-UHFFFAOYSA-N 396.468 5.029 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@@H]1c1ccccc1 604460583 CIWHXRYSMDZLQK-HSZRJFAPSA-N 397.478 5.966 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)Nc1ccc(C(C)(C)C#N)cc1 609205750 XKKKSORHKJEXNP-UHFFFAOYSA-N 397.522 6.031 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)cc2)c1 609427198 UDBNIXUMYYOFSZ-JKSUJKDBSA-N 388.389 5.658 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H]3c3ccsc3)c2)c1 609643448 OJYZEGPBQFRUJN-QFIPXVFZSA-N 388.492 5.176 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3ccncc3)n2)o1 609782839 BQNAWAMXMFDYRF-LBPRGKRZSA-N 389.402 5.789 30 20 GKED C=CC(C)(C)CNCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 639229379 VIARRLJOBRDSNC-UHFFFAOYSA-N 397.466 5.148 30 20 GKED CC(C)[C@H]1CCN1C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 646440914 PMDXIXDGXNEQKZ-GFCCVEGCSA-N 386.311 5.238 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)C1 665592598 WPQBPEHNAJVGGE-GOSISDBHSA-N 377.488 5.067 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2ccc(Oc3ccccc3Cl)cc2)nc(C)n1 673812110 QMEZVOWIAKBBNH-KRWDZBQOSA-N 377.831 5.029 30 20 GKED Cc1cccc2sc(C(=O)[C@@H](C#N)c3cnc4ccccc4n3)c(Cl)c12 682993814 BEUMLPQEKARGOU-LBPRGKRZSA-N 377.856 5.296 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1nccc2ccccc12 682993985 DBOSMKLOVOCBFR-MRXNPFEDSA-N 389.867 5.502 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726446035 WKLYZELZSDWBRM-UHFFFAOYSA-N 383.826 5.059 30 20 GKED N#CCCCOc1cccc(/C=C2\COc3c(Cl)ccc(Cl)c3C2=O)c1 726741804 ZZDWZYNPOQAFOJ-GXDHUFHOSA-N 388.250 5.335 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 729070856 ZLBLOWHDRQMTQY-UGSOOPFHSA-N 389.282 5.225 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(N3CCCC3)c(Cl)c2)cc1Cl 730737369 YQTMLBCMCQIQLA-UHFFFAOYSA-N 391.327 5.274 30 20 GKED COc1cc(C)c(C(=O)/C=C\c2csc(-c3ccc(F)cc3)n2)cc1OC 731318801 KYDAQPHAXRPUMM-HJWRWDBZSA-N 383.444 5.171 30 20 GKED Cc1nc(-c2ccc3ccccc3c2)n(Cc2cc(Cl)ccc2OCC#N)n1 735232769 BXWHSRZLNIPQFM-UHFFFAOYSA-N 388.858 5.011 30 20 GKED N#Cc1ccc(NC(=S)NC(c2cccs2)c2cccs2)cc1Cl 737452958 RDQDRBNCLAKIPQ-UHFFFAOYSA-N 389.958 5.411 30 20 GKED C[C@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1c(F)cccc1F 740034742 XGIFNHDDCLDFQB-ZDUSSCGKSA-N 397.450 5.125 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)NC(=O)/C=C\c2ccccc2C#N)cc1 741639890 IVMQJOYQEIECPB-WBYGGXTKSA-N 382.463 5.124 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(OC3CCCC3)c(F)c2)cc1Cl 741879985 JNYXJKPKBNDGQO-UHFFFAOYSA-N 389.883 5.481 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc3cc(C(F)(F)F)ccc3n2C)cc1 742593132 KNOGADPUFXEZGC-UHFFFAOYSA-N 385.389 5.066 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2cccc(C)c2C)c1 743612916 YZPQCAXICPLJEX-OFNKIYASSA-N 391.515 5.031 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)s1 744016731 SLJSXRJKNCHNST-DGCLKSJQSA-N 385.286 5.039 30 20 GKED CC(C)CN(CCC#N)C(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 751382165 NQOCGZFBRARGSE-SNAWJCMRSA-N 392.343 5.136 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc3ccc(C)cc3o2)ccc1OC 756040279 JBSMYIIEQXCPIE-LPHOPBHVSA-N 378.472 5.282 30 20 GKED N#C[C@H](C(=O)CCCc1csc2ccccc12)c1nc2ccccc2s1 756228808 UUWBISDIPZAMAA-MRXNPFEDSA-N 376.506 5.710 30 20 GKED CCC(CC)[C@@H](NC(=O)Nc1ccc(F)cc1OCC#N)c1cccs1 761665763 VFTSDKIOMLQJFJ-GOSISDBHSA-N 375.469 5.089 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1cc(Cl)c(Cl)cc1O 766033299 DRSHDLMZAGNZJU-UPHRSURJSA-N 377.252 5.114 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](Oc2cccc(Cl)c2)C(C)C)n1 770141586 NNDSZGAZTDSRHB-QAPCUYQASA-N 376.909 5.200 30 20 GKED C#CCCCCC(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 773188299 UIZJCCKCFVQHIH-LJQANCHMSA-N 378.903 5.263 30 20 GKED CC[C@H](NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)c1ccc(C#N)cc1 774366160 AHYXZWQMAZFDNQ-QFIPXVFZSA-N 391.515 5.050 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccnc(SC(C)(C)C)c1 778720748 XVILKXHHAWMAMI-AWEZNQCLSA-N 385.558 5.476 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cncc4ccccc34)cc2F)c1 779596610 YRTVWFKLAVJIQI-UHFFFAOYSA-N 383.426 5.437 30 20 GKED C[C@H](C#N)Oc1ccc(CNC(C)(C)Cc2ccc(C(F)(F)F)cc2)cc1 785554014 FNQCULJANPEJDR-OAHLLOKOSA-N 376.422 5.107 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3)s2)cc1 792925088 IPYVIJYIOSRANY-BENRWUELSA-N 379.456 5.152 30 20 GKED Cc1nc(-c2ccccc2NC(=O)C#Cc2ccc(C(F)(F)F)cc2)cs1 794130222 RMXGZHIKSCLBMP-UHFFFAOYSA-N 386.398 5.128 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(Cl)c(Cl)c1 797570702 JCLLQTJLCKBXBZ-CMPLNLGQSA-N 381.328 5.727 30 20 GKED CN(C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 809372100 JCPZXHNXODHWJE-HZSPNIEDSA-N 385.323 5.296 30 20 GKED N#CC1(CC(=O)Nc2ccc(N3CCc4sccc4C3)cc2)CCCCC1 824943051 GTGXDRLMOQTXDN-UHFFFAOYSA-N 379.529 5.113 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=Cc1ccc(Cl)s1 839394091 RNZWVOAHFIDEEP-UHFFFAOYSA-N 389.720 5.138 30 20 GKED c1ccc(N/C(=N/C[C@@H]2CCCO[C@@H]2c2ccccc2)N2CCCCC2)cc1 849067846 KGNYPVLAHZUHJX-JTHBVZDNSA-N 377.532 5.108 30 20 GKED Cc1ccc(N=Nc2cc(C)ccc2NC(=O)CC2(C#N)CCOCC2)cc1 857560941 RMMNVMCXQPMOCU-UHFFFAOYSA-N 376.460 5.368 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H]2CCCc3c2[nH]c2ccc(Cl)cc32)cc1 858297766 HJJYYQNXHAFXBW-LHSJRXKWSA-N 379.891 5.279 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1 860626527 VZXMLXXLMHRDBU-BTHPGYMESA-N 391.540 5.206 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc(-c2cc(OC)c(OC)c(OC)c2)no1 904669010 IGOSGQWCOMNKTO-GOSISDBHSA-N 394.471 5.251 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915087132 ZZOPNELRUGPALQ-IBGZPJMESA-N 395.384 5.317 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cccc2ncccc12 915964979 YAPDGGQAKAPYMX-UHFFFAOYSA-N 389.890 5.643 30 20 GKED CCCOc1c(Br)cc(/C=C\C(=O)c2cccs2)cc1OC 916137062 KUAXFBVPEZCJPJ-SREVYHEPSA-N 381.291 5.204 30 20 GKED C[C@@H](/N=C/c1cc2ccccc2nc1O)c1cccc(OCc2ccccn2)c1 917559581 PSZBKHQDGRKQGD-CIRUFVMISA-N 383.451 5.095 30 20 GKED COc1ccc(-c2n[nH]cc2/C=C\C(=O)c2cc(Cl)sc2Cl)cc1 920064001 OOIOECKWWWSQHQ-DAXSKMNVSA-N 379.268 5.350 30 20 GKED CC(=NNc1ccc(Cl)c(Cl)c1)c1oc2cc(C)ccc2c1CC(=O)O 1776032784 SAJUDZLQRJPMNF-UHFFFAOYSA-N 391.254 5.511 30 20 GKED C=CC[C@@]1(C(=O)O)CCCN(Cc2cc(-c3cccc(F)c3F)ccc2F)C1 1776160878 WSWLXZZLLCEXDP-JOCHJYFZSA-N 389.417 5.014 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2ccc(OCc3ccccc3F)cc2)CC1 1776169317 JGBHRFRZKHBRGB-UHFFFAOYSA-N 397.490 5.038 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@H](C(=O)O)c1ccc(C(F)(F)F)cc1 1776179920 DKUDFLMTWHBNSM-KRWDZBQOSA-N 383.797 5.173 30 20 GKED CC(C)c1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)c1 1776375390 LGZQSMZWKGLSMY-ZRDIBKRKSA-N 376.477 6.133 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc(F)cc2)s1 1776783016 VTQYGUARPWGOEH-GOSISDBHSA-N 377.525 5.848 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(SC(F)(F)F)cc1 1776784734 OQLBCFPHRPLRQS-HNNXBMFYSA-N 377.472 5.592 30 20 GKED COc1cc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)ccc1SC 1777263883 NEHGAXJIELDRGB-ZZXKWVIFSA-N 384.478 5.226 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@@H](C)c3ccc(Cl)cc3)CCC2)cc1 1791586442 ZMUOGUIDWUCQBJ-INIZCTEOSA-N 396.918 5.154 30 20 GKED C=CC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)CCCCC)CC1 1831376302 LTUFVWTYTURMFF-ONTIZHBOSA-N 390.612 5.035 30 20 GKED C[C@@H](NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccc(C#N)cc1 43931665 UCMLUSSLJGANFK-OAHLLOKOSA-N 382.423 5.249 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3cccs3)n2)sc2c1CCCCC2 61198110 CUTMUKCGGORJTN-UHFFFAOYSA-N 385.539 5.326 30 20 GKED COc1cc(/C=C/C(=O)c2c(C)nn(-c3ccccc3)c2C)cc(Cl)c1OC 72035704 MQOHVSAHUKWHOH-ZHACJKMWSA-N 396.874 5.056 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(-c2nc(C)cs2)c1 102542740 OEYZDHZWUBZJHY-UHFFFAOYSA-N 388.496 5.210 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(C2CC2)n(C(C)(C)C)n1 107823369 FQDUBKYSFQUDRC-UHFFFAOYSA-N 377.941 5.059 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4nc(C)ccc4c3)n2)cc1 120022258 MCOZOFUZLQJVRN-IBGZPJMESA-N 399.475 5.165 30 20 GKED CN(C[C@H]1CCCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 128427649 FLTWMRWXLWMRLE-QUCCMNQESA-N 397.906 5.028 30 20 GKED Cc1cc(Cl)cc2nc(SCc3nnc(-c4ccc(C#N)cc4)o3)oc12 151065223 JDNBMDLAPQHGQA-UHFFFAOYSA-N 382.832 5.004 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)c2)n1 151867396 PLTIVLBFUPORGR-HNNXBMFYSA-N 393.537 5.765 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 173265474 XUCIWSKMQAZPKD-LBPRGKRZSA-N 389.318 5.404 30 20 GKED C=CCC[C@@H](NCc1csc(-c2cccc(OC)c2OC)n1)c1ccccc1 180037629 JWHOGOWYWPGXIY-HXUWFJFHSA-N 394.540 5.624 30 20 GKED CCC[C@H]1CCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 184477780 GJWIJGYZKDTHST-NRFANRHFSA-N 391.515 5.518 30 20 GKED N#CC1(c2ccccc2)C/C(=C/c2cccs2)C(=O)/C(=C\c2cccs2)C1 213186567 KTZAIMPHPYLLNW-MZGHLJKDSA-N 387.529 6.101 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccccc3)cc2)c1 303362060 QCSQTZPHSSCKCD-QHCPKHFHSA-N 383.451 5.720 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1c(F)cccc1Cl)c1cccc(Cl)c1Cl 303851272 OIAAMGVGTPGMKF-ZETOZRRWSA-N 397.664 5.270 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/C1(c2ccc(F)cc2F)CCC1 328970565 UVHVQWYOZGGOCS-ZDUSSCGKSA-N 392.471 5.008 30 20 GKED CC(C)(C)C(O)=Nc1nc(C/C(O)=N/[C@H]2CCCCC23CCCC3)cs1 329573209 AHGQNPCBAOLEPM-HNNXBMFYSA-N 377.554 5.779 30 20 GKED CCc1ccc(-c2nc(CC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)cs2)cc1 425127293 INLKYQBLYMJRIP-INIZCTEOSA-N 389.524 5.006 30 20 GKED C=CC[C@H](C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 427115526 BSKWEIHQOKVCON-QHCPKHFHSA-N 399.494 5.307 30 20 GKED N#Cc1cccc(COc2cccc(CNC[C@@H]3CCO[C@H]3c3ccccc3)c2)c1 428689899 RBCZVIDKAKWGMQ-AHWVRZQESA-N 398.506 5.005 30 20 GKED CC[C@H](C)Oc1cc(C)ccc1CNC(=O)N[C@H](CCCC#N)c1ccccc1 431279737 HDUMXHFIIVTHRL-SIKLNZKXSA-N 393.531 5.407 30 20 GKED CCn1ccnc1[C@H]1CCCCN1C(=O)Nc1ccccc1C#Cc1ccccc1 432243986 ZOQYUBWNNBJKJT-HSZRJFAPSA-N 398.510 5.062 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(NC(=O)CC)ccc1Cl)c1ccccc1 435654797 LGIYZZQZTNATJQ-SFHVURJKSA-N 385.895 5.518 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)Nc2cccc(C#N)c2)C(C)C)cc1 437582525 VHKSFDZXTOADNU-UHFFFAOYSA-N 399.494 5.676 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 437657383 QQXSIEOZBHRYSM-XZOQPEGZSA-N 389.543 6.237 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(F)(F)F)c1 438561806 MKWQPRHPDMSNFA-RTBURBONSA-N 387.405 5.095 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)c1cn(CCCC#N)c2ccccc12 443953359 SVBZSRIEGLDTPQ-MRXNPFEDSA-N 379.891 5.432 30 20 GKED CCc1nc([C@@H](C)NCCC(C#N)(c2ccccc2)c2ccccc2)cs1 444682580 ATXBZQLVCJZYGM-GOSISDBHSA-N 375.541 5.256 30 20 GKED CC(C)(C#N)CCCCN[C@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 444683891 JPKDTWKSLVGBQK-HXUWFJFHSA-N 377.523 5.190 30 20 GKED C[C@H](NC(=O)N1CCCc2occc2C1)c1ccc(-c2cccc(C#N)c2)cc1 460884487 PKXYNQQASJNUGD-KRWDZBQOSA-N 385.467 5.037 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC(c4ccccc4F)C3)cc2)cc1 463518319 RFJSLKKEIMFAFI-UHFFFAOYSA-N 387.414 5.121 30 20 GKED CCCOc1ccc(CCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 463742807 DAFDESRZNDKWAT-IBGZPJMESA-N 391.298 5.096 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CC[C@@H](CC(C)C)C2)cc1 467608720 QACIJOXGEWVBDT-SFHVURJKSA-N 393.487 5.259 30 20 GKED C=CCC[C@@H](NC(=O)N1CCCC[C@@H](COC)C1)c1ccc(C(F)(F)F)cc1 468117909 UYJWRQKPFIYSQQ-VQIMIIECSA-N 398.469 5.171 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)c2ccccc21 473663380 SCGWWMNKCVWUAX-AZUAARDMSA-N 389.474 5.150 30 20 GKED N#CC[C@@H](CC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1ccccc1 474584200 JAKNVPUWAOKEOD-WIOPSUGQSA-N 380.491 5.248 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C)Oc1ccc(OC)cc1 475571559 VRXXVTSSGPLVAA-QGZVFWFLSA-N 382.504 5.136 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cncc(-c2ccc(N(C)C)cc2)c1 476093083 XGRQBZVQOYCEBK-UHFFFAOYSA-N 399.538 5.919 30 20 GKED N#Cc1ccc(CN[C@H](CC(F)(F)F)c2ccccc2)c(Br)c1 481284875 MCNOTOHCENNLQZ-MRXNPFEDSA-N 383.211 5.104 30 20 GKED C=C(C)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1ccc(F)c(F)c1 483296410 NHKFJFUHQRFBMH-NRFANRHFSA-N 383.442 5.074 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1OCc1ccccc1)c1ccccn1 483448408 MMDOMBPACKHWTD-QGZVFWFLSA-N 397.261 5.457 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1F 483990095 CFIUXGGKQAAKQR-INIZCTEOSA-N 390.302 5.499 30 20 GKED CCC(CC)CN(CCC#N)Cc1nnc(-c2ccc(Cl)cc2Cl)o1 484912768 TYESNYSDCANOIO-UHFFFAOYSA-N 381.307 5.195 30 20 GKED C=CCSc1ccccc1C(=O)NCCc1nc2cc(Cl)ccc2s1 485768780 UHFVYUBGBYXORG-UHFFFAOYSA-N 388.945 5.200 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C)(OCC)CC1)c1ccc(C(F)(F)F)cc1 489760561 ZXKNYVOEMXCCAK-SFHVURJKSA-N 398.469 5.313 30 20 GKED C[C@H](N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(C(=O)N(C)C)cc1 494928263 DEJHQCGWXMZHLT-OALUTQOASA-N 397.522 5.339 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2ccc(-c3ncco3)cc2)c1 500116410 YBOSTLRMLGEBDI-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#Cc1c(NC(=O)Cc2csc(-c3cccs3)n2)sc2c1CCCCC2 500251477 FRGMXEFKKITIQK-UHFFFAOYSA-N 399.566 5.255 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(C)c(NC(=O)c2ccccc2)c1 505602457 AJSFLRTYEOYSCC-UHFFFAOYSA-N 384.479 5.076 30 20 GKED C[C@H](c1cc2ccccc2o1)N(C)Cc1cn(CCC#N)nc1-c1ccccc1 506327054 RSXKAACNZOCTRZ-GOSISDBHSA-N 384.483 5.403 30 20 GKED CC1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)CC[C@@H](C(C)(C)C)C3)CC1 509366888 YDSZWYWMVCXJDF-QGZVFWFLSA-N 389.543 5.152 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)Cc2cc3c(ccc4ccccc43)o2)c1 510547768 SVHUFRKNPUZDIJ-UHFFFAOYSA-N 392.361 5.240 30 20 GKED CC(C)(CC(=O)N1CC[C@](F)(c2cccc(C(F)(F)F)c2)C1)C(F)(F)F 512372160 RSPHTJPVTMYDPA-OAHLLOKOSA-N 385.323 5.081 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1 512542077 KEJJXFSDNAFEOY-IBGZPJMESA-N 393.535 5.270 30 20 GKED CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 513862615 XTVSNZNGTPYNKI-GOSISDBHSA-N 399.878 5.037 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)Sc1ccc(OC)cc1 515638707 JTYJHCBSGUAGOU-ZDUSSCGKSA-N 381.950 5.106 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(F)(F)F)cc2)c1 519507445 YKKBBZPLKIMUKH-OALUTQOASA-N 388.389 5.658 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC2CCC(F)(F)CC2)cc1 534216189 MMRDXJWRKFFTDJ-UHFFFAOYSA-N 386.467 5.158 30 20 GKED CCc1cc(C#N)c(NC(=O)[C@H](C)c2cccc(C(=O)c3ccccc3)c2)s1 535587095 HSUATBXUEDXFTK-OAHLLOKOSA-N 388.492 5.155 30 20 GKED N#Cc1ccc(NC2CC2)c(NC(=O)c2[nH]c3ccc(Cl)cc3c2Cl)c1 537714955 GOJQHWJILWYXAN-UHFFFAOYSA-N 385.254 5.173 30 20 GKED C=CCC[C@@H](NCc1nc2ccc(F)cc2o1)c1ccc(C(F)(F)F)cc1 539331471 MRWYSONEYRILHO-MRXNPFEDSA-N 378.369 5.783 30 20 GKED N#CCc1ccc(CNC2(c3noc(C4CCCC4)n3)CCCCCC2)cc1 542628347 UVGYMOOQSBZQGX-UHFFFAOYSA-N 378.520 5.133 30 20 GKED C=CCC[C@H](NCc1cncc(Br)c1)c1ccc(C(F)(F)F)cc1 543184777 PDBABNBFAOFUTN-KRWDZBQOSA-N 399.254 5.660 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1 548809376 YHIMKWOZCHRURH-GOSISDBHSA-N 391.540 5.826 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCc2ccccc21 553665134 LPZISJAUHDLIIP-AEFFLSMTSA-N 379.529 5.322 30 20 GKED COCC[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(Cl)c(Cl)c1 562100622 UIBQEIWISBIOCY-UXHICEINSA-N 375.299 5.220 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N3CCC(CCC#N)CC3)cc2)c1 574449840 CWGXBDGRSVOFJK-UHFFFAOYSA-N 379.460 5.035 30 20 GKED CSCC[C@@](C)(C#N)NC(=O)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 582444768 ROSNFMRQYBUDLS-KRWDZBQOSA-N 399.368 5.487 30 20 GKED N#CC[C@H](Cc1nc(C2(c3cccc(C(F)(F)F)c3)CC2)no1)c1ccccc1 583051289 IPTRPRFABPPZMH-MRXNPFEDSA-N 397.400 5.408 30 20 GKED C=CCOc1ccc(CNCc2nc3cc(Cl)ccc3s2)cc1Cl 589645525 NLJRSHIOPOPOGH-UHFFFAOYSA-N 379.312 5.458 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)CSCc3ccc(Cl)cc3)n2)cc1 602742961 JGRMCBPFSDXUGS-UHFFFAOYSA-N 399.928 5.207 30 20 GKED N#Cc1cc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)ccc1Cl 603084853 WPCHCUMTMIMEJE-UHFFFAOYSA-N 375.737 5.031 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(SCc4ccccc4)cc3)[nH]c12 605363299 SXHCHBOFTWIPAI-FQEVSTJZSA-N 397.503 5.654 30 20 GKED CC(C)CN(CC(F)(F)F)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297673 CJPILIUPIQPYGB-UHFFFAOYSA-N 394.368 5.150 30 20 GKED CCCN(CCc1ccccn1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609520504 PLZKRYMNUXAWSQ-UHFFFAOYSA-N 399.494 5.035 30 20 GKED CCCN(CC1CCCCC1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609521486 JBZRNOXULLSNKL-UHFFFAOYSA-N 377.488 5.178 30 20 GKED N#C[C@@H](NC(=O)c1sc2cc(F)ccc2c1Cl)c1ccc(Cl)cc1 609589595 OXMOSLBZPXVYMV-CYBMUJFWSA-N 379.243 5.342 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3nc4ccsc4s3)c2)c1 609795369 PRMSLDQTPRJDQQ-UHFFFAOYSA-N 391.477 5.061 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc(Br)c3)n2)cc1 612894875 VEAWTRQRGCWMCH-MRXNPFEDSA-N 397.297 5.371 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)cc2c1 619564091 PXPPMVBOWZDBLV-ZDUSSCGKSA-N 375.497 5.162 30 20 GKED CCc1noc(C)c1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647634298 UIUUXNWZSRVZSP-UHFFFAOYSA-N 384.295 5.447 30 20 GKED C=CCC[C@H](C(=O)N1CCC(c2ccc3cccnc3n2)CC1)c1ccccc1 655269370 JMCHYBATCPBLHC-QFIPXVFZSA-N 385.511 5.086 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)cc(Br)c1)c1ccc2ccccc2n1 676590802 IMJBHEJUQPZUBU-HNNXBMFYSA-N 385.648 5.141 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676725029 KAYDKRCQDZAPMY-SJCJKPOMSA-N 395.425 5.378 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Cc3ccncc3)cc2)cc1Cl 726450640 HUEMTQGYCONKKW-UHFFFAOYSA-N 378.888 5.006 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(CN3CCc4ccccc43)cc2)c1 726907232 BTLSMPTUSOFZDE-UHFFFAOYSA-N 383.520 5.040 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\Cc3c(C)cccc3C2=O)cs1 729151689 VUUBRRJRNWXKLR-XNTDXEJSSA-N 392.455 5.098 30 20 GKED N#Cc1c(NC(=O)c2sccc2SC(F)F)sc2c1CCCCCC2 730481129 DESCAQCTJUFCEF-UHFFFAOYSA-N 398.525 5.907 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cccc(OC2CCCC2)c1 731288265 QZNUHMXZRDBZBE-QFIPXVFZSA-N 398.462 5.122 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 741636447 LDEAUUIIIOWEFT-UHFFFAOYSA-N 394.254 5.612 30 20 GKED CC[C@H](C)Oc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)ccc1OC 741844035 MQTVJINDSGMRTG-PZBABLGHSA-N 390.892 5.131 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cnn(Cc2ccccc2Cl)c1 754712863 WAFJWZHZPLJEEU-UHFFFAOYSA-N 379.769 5.017 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1nc(Cl)ccc1Cl 762475835 UKDVMAXVBURRRC-UHFFFAOYSA-N 391.327 5.049 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCc3cccc(F)c3C2)cc1 767849790 ZZNFPIKGBHFEIR-NRFANRHFSA-N 385.442 5.071 30 20 GKED N#CCOc1ccc(CN[C@H](Cc2ccccc2Cl)c2ccccc2)cc1 772957393 FHMTYIMLKMTEKR-HSZRJFAPSA-N 376.887 5.316 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)Cc1ccccc1CC#N)C1CC1 776801913 GFWVKIABOZUCLW-OAHLLOKOSA-N 386.417 5.066 30 20 GKED Cc1cc(-c2cc(C(=O)O[C@H](C#N)C(C)C)c3cnn(C(C)C)c3n2)c(C)s1 777315812 HNRODOQZRFABSE-LJQANCHMSA-N 396.516 5.063 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1)c1ccccc1 778775340 GBKCYTFWRBBAED-FQEVSTJZSA-N 380.488 5.010 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2cccc(Cl)c2o1 783068262 KJKHPSVQZUZLJH-AWEZNQCLSA-N 376.799 5.081 30 20 GKED C=CC[C@H](N[C@H](C)c1ccc(Br)cc1C(F)(F)F)c1ccncc1 790679784 VUPQMZXTRYKRCZ-PXAZEXFGSA-N 399.254 5.831 30 20 GKED Cc1cc(C(=O)/C=C\c2cnc(-c3ccccc3)nc2)sc1Br 794731373 ASNSOXVQSCBRDF-FPLPWBNLSA-N 385.286 5.172 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc1 798008655 PNWCEJBMSJDHKC-GMKZXUHWSA-N 381.479 5.410 30 20 GKED N#C[C@@H](C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1nc2ccccc2s1 802036112 PZPVESBLEMLDIZ-SWLSCSKDSA-N 378.350 5.202 30 20 GKED N#Cc1ccc(/C=C/C(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1 811694580 UOMJULRBTPSJJZ-ZZXKWVIFSA-N 380.709 5.035 30 20 GKED COCc1nc(Cl)cc(NN=C(C)c2ccc(Cl)c(Cl)c2Cl)n1 814976417 TVNPLHMYXBXPJM-UHFFFAOYSA-N 394.089 5.073 30 20 GKED COc1cc(/C=C2/CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1OC 818242014 HAYKVTYSKIQRQV-SRKDFGFSSA-N 399.830 5.095 30 20 GKED O=C(c1cccc(SC(F)(F)F)c1)N(CCC(F)(F)F)CC(F)(F)F 834736382 MUDQQVZKPUGASS-UHFFFAOYSA-N 399.278 5.255 30 20 GKED CC(=NOCC(=O)c1cc(C)n(CC(F)(F)F)c1C)c1cc2ccccc2o1 836548576 VCNQKCKFBXHCTQ-UHFFFAOYSA-N 392.377 5.037 30 20 GKED N#Cc1cccc(C2(NCc3cc(Cl)cc(C(F)(F)F)c3)CCOCC2)c1 850383794 JRZSVNJURKLLHT-UHFFFAOYSA-N 394.824 5.026 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccc(OC(C)C)cc2C)cc1OC 917781334 HZDQGUYFWMDUGZ-WQLSENKSSA-N 381.472 5.008 30 20 GKED Cc1ccc(C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)c(Cl)n1 919253853 WQKRYYGOIBIHIP-UHFFFAOYSA-N 390.870 5.100 30 20 GKED Cn1cc(C=NNc2cccc(Br)c2)c(-c2cc3ccccc3o2)n1 920370281 GKGSSMCRSYGTBO-UHFFFAOYSA-N 395.260 5.042 30 20 GKED C=CCCCc1ccc(C(=O)NCc2ccccc2-c2cccc(C(=O)O)c2)cc1 1776174502 FRLKQBPSYMIMAU-UHFFFAOYSA-N 399.490 5.491 30 20 GKED CCOc1ccc(Cl)cc1/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776931564 YCRWKPAMJVQVNU-VQHVLOKHSA-N 396.826 5.593 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)cc2)ccc1SC(F)F 1777263352 ITPBBYFFPWJTSD-QHAIXMIYSA-N 390.407 5.004 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)C45CCC(CC4)CC5)cc3)CCC2)C1 1791978031 XGDZBUWVRBIYRP-UHFFFAOYSA-N 392.543 5.057 30 20 GKED N#Cc1ccc(-c2ccc(OCC(=O)Nc3c(Cl)cccc3Cl)cc2)cc1 5407247 SRXPGSQZRZKBAU-UHFFFAOYSA-N 397.261 5.550 30 20 GKED COc1ccc(/C=C/C(=O)c2cccc([N+](=O)[O-])c2)cc1OCc1ccccc1 6339153 QCVSBNSPLRAURN-ZRDIBKRKSA-N 389.407 5.079 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)N2CCC[C@@H]2c2cccs2)nc2ccccc21 22351781 WNPBIKGPMLYVLI-MAUKXSAKSA-N 397.569 5.128 30 20 GKED N#C[C@H](C(=O)CS[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccccn1 41493694 YUEGHLQXLBAWGX-UGKGYDQZSA-N 392.911 5.434 30 20 GKED CCN(C(=O)CCCc1nc2ccccc2s1)[C@@H](C)c1ccc(C#N)cc1 45499191 QCMWYYLWVCYZNM-INIZCTEOSA-N 377.513 5.100 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(NC(=O)c2ccoc2)c1 70049791 QICBTQKVEGASNZ-UHFFFAOYSA-N 381.476 5.132 30 20 GKED O=C(/C=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cccc(O)c1 98042635 RXZPAOXSCJABLN-HJWRWDBZSA-N 375.371 5.431 30 20 GKED N#C[C@@H](C(=O)Cc1ccccc1C(F)(F)F)c1nc(-c2ccccc2)cs1 105759003 VSXCWIAZIOJKMW-HNNXBMFYSA-N 386.398 5.248 30 20 GKED CCN(Cc1c(F)cccc1F)C(=O)Nc1ccccc1SC[C@H](C)C#N 108529964 DIXWMZVDZCFGLL-CQSZACIVSA-N 389.471 5.271 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1ncc(-c2ccc(Cl)cc2)o1 109002277 DVACXQCSDCTJJO-AWEZNQCLSA-N 383.904 6.001 30 20 GKED Cc1nc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)ccc1C#N 109572197 KICNDUMPLVXGNO-CQSZACIVSA-N 390.874 5.341 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H](C)c1c(C)noc1C 114003697 SVWVYYPDXCWJIB-AWEZNQCLSA-N 390.443 5.147 30 20 GKED C=CCn1c(SCc2cc3ccccc3nc2Cl)nnc1-c1ccccn1 124875952 CVOKEAZTRDNYSL-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cc(Br)ccc2Cl)c1 136142112 SDZXERJWTPMKHZ-INIZCTEOSA-N 393.712 5.073 30 20 GKED C[C@H](C1CC1)N(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC1 175374329 HAEZQCFFWDTQAS-QGZVFWFLSA-N 389.499 5.126 30 20 GKED Cc1cc2oc(=O)cc(CNc3ccccc3O[C@H](C)C#N)c2cc1C(C)C 182545325 LTJWYXVAYNYAAN-MRXNPFEDSA-N 376.456 5.128 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 186663332 OOOCOGQJNAOSBW-OAQYLSRUSA-N 383.451 5.352 30 20 GKED CCOc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc(Cl)c1O 186795513 KFTVGXUMQBEDPC-GFCCVEGCSA-N 390.892 5.091 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C(C)(C)Cc1ccc(C(F)(F)F)cc1 188060724 JKVVXRZSJMNFFJ-CQSZACIVSA-N 390.405 5.204 30 20 GKED COc1cc(/C=C\C(=O)c2c(C)nn(-c3ccccc3)c2C)cc(Cl)c1OC 210454671 MQOHVSAHUKWHOH-KHPPLWFESA-N 396.874 5.056 30 20 GKED N#CC1(CCCN[C@H]2CCC[C@@H]2c2ccccc2C(F)(F)F)CCOCC1 281208901 CZJUZZIAIHFIMA-MJGOQNOKSA-N 380.454 5.032 30 20 GKED CCS(=O)(=O)c1ccc([C@H](C)/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc1 329149292 QMKFOEYFNBJHIT-SMMRIJLZSA-N 377.550 5.104 30 20 GKED OC(=Nc1ccc2c(c1)oc1ccccc12)N1CC2(CCC2)[C@@H]1[C@H]1CCCO1 329781012 NAKVWROLESLYIA-CTNGQTDRSA-N 376.456 5.165 30 20 GKED CC(C)[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccccc1Cl 330013844 MNKRARRINWXDQJ-RJYAGPCLSA-N 376.928 5.919 30 20 GKED Cc1ccc(-c2cccnc2)cc1N=C(O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1 330080494 JJANLEPNFQZTQY-SFTDATJTSA-N 391.515 5.074 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CC[C@@H](c2ccccc2F)C1 432088658 KIWNDCIGLKQQPD-ZACQAIPSSA-N 397.519 5.535 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1C[C@H](c2cccc(Cl)c2)C1 436336603 AWORDTDXPAOABX-QGPMSJSTSA-N 399.947 5.659 30 20 GKED COc1cc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)ccc1O 436980688 OOHLIKYVUTZUHY-IBGZPJMESA-N 393.512 5.049 30 20 GKED CC(C)[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(C(F)(F)F)cc1 439314321 MVSXLVROYXUJRJ-GOSISDBHSA-N 375.394 5.290 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)O1 440372837 DSBBNDGVJGXEJB-MOXGXCLJSA-N 382.891 5.282 30 20 GKED O=C(Cc1cccs1)Nc1ccccc1NCC#Cc1cccc(Cl)c1 448058725 RPNIYUXNYFRHSQ-UHFFFAOYSA-N 380.900 5.046 30 20 GKED Cc1cc(F)ccc1[C@H]1CCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458857425 ZMZHTCKCRHZCJC-FGZHOGPDSA-N 379.479 5.416 30 20 GKED CCc1nc2ccc(Cl)cn2c1C(=O)Nc1ccccc1SC[C@H](C)C#N 463950536 NTVKNSQHUXWETK-CYBMUJFWSA-N 398.919 5.054 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)o2)cc1 464418350 KMRJMQFQYGIPRY-INIZCTEOSA-N 384.357 5.413 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccn(-c2ccc(Cl)cc2)n1 467259409 YGRQCKIUTMFBKJ-OAHLLOKOSA-N 382.920 5.532 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nnnn1C1CCCCC1 468961175 LIYUBVKDABCXBS-INIZCTEOSA-N 388.475 5.015 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C[C@@H](C)c1c[nH]c2ccccc12 469410667 VMGGSGYXJAUPCA-JKSUJKDBSA-N 377.513 5.552 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(-c2ccc(Cl)cc2)c[nH]1 469410858 XSHCKNHKSZWECP-AWEZNQCLSA-N 395.915 5.839 30 20 GKED C[C@H](CCNC(=O)c1cc(F)c(F)c(F)c1F)c1cccc(C(F)(F)F)c1 470240659 XYHVVCKORYNMEK-SECBINFHSA-N 393.302 5.185 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)CCc2cnc3ccccc3c2)cc1 471087643 AFAZICTXCQLBDB-UHFFFAOYSA-N 391.474 5.022 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Sc3ccccn3)cc2)n1 474425781 JFFLEVLXBFYFHM-MRXNPFEDSA-N 379.510 5.303 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccc(C(F)(F)F)cc1 476168723 XSOGVMLWSHOKPE-HNNXBMFYSA-N 391.433 5.963 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)c(F)c1 481606080 QFBWDYXEQAOMGS-KZULUSFZSA-N 389.833 5.636 30 20 GKED C[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1cccc(OCc2ccccn2)c1 481915127 BRYMAPOZMZMESL-AFMDSPMNSA-N 397.522 5.651 30 20 GKED COC(=O)c1ccccc1-c1ccc(CNc2cccc(OCCCC#N)c2)o1 482013201 UUGWTVABHNLNAZ-UHFFFAOYSA-N 390.439 5.028 30 20 GKED CC(C)(CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 483290442 HGGBCNGGMFZSAY-MRXNPFEDSA-N 394.824 5.913 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)[C@@H]2CCCC(F)(F)C2)c1 499889391 UIABYEONRAEHBH-QGZVFWFLSA-N 388.845 5.570 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 503218554 PAPWEMKVAKZUBL-LBPRGKRZSA-N 389.908 5.553 30 20 GKED CCN(C(=O)c1ccc2noc(-c3ccc(F)cc3)c2c1)c1ccc(C#N)cc1 510398635 YKEJFEQWBCXNEE-UHFFFAOYSA-N 385.398 5.172 30 20 GKED Fc1cc(-c2nc([C@@H](F)c3ccc(C(F)(F)F)cc3)no2)cc(F)c1F 512014314 DRQFXHYJSUVRJJ-LBPRGKRZSA-N 376.231 5.232 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccccc1-c1nc2ccccc2s1)C1CC1 513768719 ANMFHSJDDYFMLA-CQSZACIVSA-N 376.485 5.119 30 20 GKED CC(C)CCc1ccc(S(=O)(=O)Nc2ccccc2SCCC#N)cc1 518643497 IBCVUEMAQFQYOZ-UHFFFAOYSA-N 388.558 5.082 30 20 GKED C[C@H](N[C@@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1cccc(C#N)c1 519545990 AYGNWFORTKAJPU-CSWVRBLFSA-N 393.962 5.476 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 520433531 GBYFUUDHPQPHRP-QGZVFWFLSA-N 387.508 5.901 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cc(Cl)ccc3F)cc2)cc1 521089289 HXHILPGGEOXKOU-UHFFFAOYSA-N 380.806 5.590 30 20 GKED N#Cc1ccc(NCc2cccc(NC(=O)C3CCCC3)c2)c(C(F)(F)F)c1 523114515 OWJLGWHFYLLBIU-UHFFFAOYSA-N 387.405 5.318 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@H]2C[C@@H]2c2ccc(Cl)c(Cl)c2)c1 524113684 CPLWOYNGKNIVGA-NEPJUHHUSA-N 397.208 5.209 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCC[C@H]1C1CCCCC1 532920459 VFCWONQKOZRHBQ-PXNSSMCTSA-N 385.577 5.064 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CCOCC1 535126091 UYPJKDMXKAHRRU-CQSZACIVSA-N 384.863 5.005 30 20 GKED COc1ccccc1COc1cccc(NCCCC2(C#N)CCOCC2)c1C 538610886 AGUXZFUZHAKIBJ-UHFFFAOYSA-N 394.515 5.095 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c(F)c1 539654875 PZGVLAYIVFZJPW-UHFFFAOYSA-N 392.361 5.084 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccc(C(F)(F)F)cc3)C3CC3)cc2)CC1 540703252 UFFVXAYDJAPTCE-UHFFFAOYSA-N 384.401 5.065 30 20 GKED CC(C)(C#N)NC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 541900024 DXWGBNMAJIBRHK-UHFFFAOYSA-N 379.312 5.318 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1ccc(F)c(C#N)c1 544487198 WWQUOORCVRHKNE-LBPRGKRZSA-N 385.895 5.634 30 20 GKED CCN(CCC1CC1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 544892089 DCEWNNVNRFBYDP-UHFFFAOYSA-N 377.488 5.100 30 20 GKED C[C@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1cccc(OC(F)F)c1 564410706 FGCULCAWEGMKCJ-QMMMGPOBSA-N 395.274 5.076 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccccc1OC1CCCC1 577204698 MLPJWTRFCVFPRW-UHFFFAOYSA-N 396.535 5.396 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cccc(C(F)F)c1 591009081 NPFAEMLIBKSSLL-QWRGUYRKSA-N 389.286 5.264 30 20 GKED N#Cc1ccc(CN[C@H]2CCCSc3ccc(Br)cc32)s1 596093149 SQJXNLOMSIQZKD-HNNXBMFYSA-N 379.348 5.099 30 20 GKED N#CCn1c(C(=O)N(CCc2ccccc2)c2ccccc2)cc2ccccc21 609167809 XLNIRSNRNJYKPB-UHFFFAOYSA-N 379.463 5.054 30 20 GKED CCCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccccc1F 609385323 QVOFSFLDLXVFCS-QGZVFWFLSA-N 399.535 5.071 30 20 GKED Cc1ccccc1C[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 609636267 KOZDJWYBELQRMH-QUCCMNQESA-N 393.556 5.628 30 20 GKED Cc1ccccc1-n1c(S[C@@H](C)c2ccc(C#N)cc2)nnc1-c1ccncc1 609813509 FJKXQVGLPNSAPE-KRWDZBQOSA-N 397.507 5.363 30 20 GKED C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1c(Cl)cc(C#N)cc1Cl 611097164 VXCNSTKTZOHFCF-CYBMUJFWSA-N 375.299 5.351 30 20 GKED N#C[C@H](C(=O)c1ccccc1SCc1ccco1)c1ccc2ccccc2n1 613292455 KNNYFQFQHSRSHN-IBGZPJMESA-N 384.460 5.610 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)c1 618754375 ZRGNMVNSOWGFCJ-JOCHJYFZSA-N 383.451 5.043 30 20 GKED C=C(C)[C@@H](N[C@H](CC)c1cc(OC)c(OC)c(OC)c1)c1ccc(F)c(F)c1 652190512 QEKCNIRZTURRED-WIYYLYMNSA-N 391.458 5.349 30 20 GKED Fc1ccc(/C=C/CNC2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 671706740 OVKJSHMDNQRMJI-MHZOUISFSA-N 387.314 5.477 30 20 GKED N#C[C@@H](C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1ccc2ccccc2n1 673812310 USFOQGZCRLXEAP-QGZVFWFLSA-N 399.837 5.566 30 20 GKED COc1cc(C=NNc2ccc(OC(F)F)cc2)c(-c2ccccc2)cc1OC 726427302 UZKUDZHENRLKRW-UHFFFAOYSA-N 398.409 5.418 30 20 GKED CC(=O)Nc1ccc(/C=C2\CCc3nc(-c4ccc(C)cc4)sc3C2=O)cc1 727654972 QFDZZYUOKBMZDN-QGOAFFKASA-N 388.492 5.289 30 20 GKED N#CCOc1ccc(COc2ccc(C(=O)c3ccc(Cl)cc3)cc2)cc1 729241057 GKVFYDBXXHLZTO-UHFFFAOYSA-N 377.827 5.052 30 20 GKED Cc1onc(-c2ccc(F)cc2)c1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416241 BYYLHPIZXZSRRT-AWEZNQCLSA-N 395.390 5.028 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N[C@@](C)(C#N)C3CCCCC3)cs2)cc1 734240864 VVTCREWUFGBMAP-QHCPKHFHSA-N 395.572 5.455 30 20 GKED O=C(/C=C/c1cnc2ccc(Br)cn12)c1ccc(C(F)(F)F)cc1 736409041 BFQWNSOMXKXCDV-VOTSOKGWSA-N 395.178 5.012 30 20 GKED Cc1cc(NC(=S)Nc2ccc(C#N)c(Cl)c2)ccc1OCC(F)(F)F 737450728 ZDMVRYDQWKQXEF-UHFFFAOYSA-N 399.825 5.270 30 20 GKED CO[C@H](C)c1cccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740449346 XOKHJFUMPJRZPQ-OAHLLOKOSA-N 391.496 5.316 30 20 GKED Cc1cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2Cl)ccc1-n1cncn1 742429170 JGPRQPPJMFPREE-XVNBXDOJSA-N 392.673 5.432 30 20 GKED O=C(/C=C\c1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1F 743056832 MUMCSHXYNNEMEI-QTONRWBISA-N 378.802 5.072 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc1OC 745990791 YFGQSACGTUGFMO-WTKPLQERSA-N 393.870 5.705 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccc(Cl)c(Cl)c1 747105208 QOEDHQWXWAWSMO-CMPLNLGQSA-N 375.280 5.583 30 20 GKED COc1cc(C(=O)/C=C\c2cccc(OCC(F)(F)F)c2)ccc1SC 747615421 XNFKJECMTMANPO-VURMDHGXSA-N 382.403 5.254 30 20 GKED COc1cc(/C=C/C(=O)c2c(C)[nH]c3ccccc23)ccc1OCC(F)(F)F 750905589 OBWFWUHSXWLCHB-VQHVLOKHSA-N 389.373 5.322 30 20 GKED COc1ccc(C(=O)/C=C/c2cc(C(F)(F)F)ccc2Cl)cc1NC(C)=O 753717151 IIADUBVHOITRPT-XVNBXDOJSA-N 397.780 5.222 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2ccc(Br)cc2)C2CC2)c1 774449377 PEOSTKWQLAATDY-CTNGQTDRSA-N 399.332 5.371 30 20 GKED CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775486639 DBPIQYRPTUYSCQ-VJBWXMMDSA-N 391.515 5.057 30 20 GKED CC(C)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776171605 UKXFCYLBWKGNTM-YWZLYKJASA-N 376.422 5.656 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21 789450690 FUQCIEAJDVEPEH-OAQYLSRUSA-N 390.527 6.107 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCCc3c(O)cccc32)cc1 789739174 SRKLVNPOLMWEPX-DHIUTWEWSA-N 382.463 5.106 30 20 GKED N#CC[C@H](CC(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1)c1ccccc1 793484844 XTYKLRJUCKNRDL-HXUWFJFHSA-N 390.483 5.198 30 20 GKED N#C[C@H](C(=O)CCc1cnc2ccccc2c1)c1nc2cc(Cl)ccc2s1 796653207 YEQJABAACNKMLE-MRXNPFEDSA-N 391.883 5.307 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3[C@@H](C)[C@@H]3c3ccccc3)n2)cc1 797551301 NBWVHVPTKFRXMV-FEHMIHBQSA-N 388.492 5.045 30 20 GKED Cc1nc(NN=C2CCC23CCOCC3)c2cc(-c3ccccc3)sc2n1 799867155 FVXRMGPXOGRHMG-UHFFFAOYSA-N 378.501 5.025 30 20 GKED O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)[C@H](F)c1ccc(C(F)(F)F)cc1 801679628 NIDQEDOEQAMPKE-DDTOSNHZSA-N 385.323 5.201 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2nc(C(F)F)sc2c1 806698574 QVHASBBHKGVROS-JTQLQIEISA-N 388.399 5.169 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCC[C@H]1CC1(Cl)Cl 844533419 ABMIRVRDKJEYDT-OLZOCXBDSA-N 386.348 5.034 30 20 GKED COc1cc2ccc(NCc3cccc(OCCCC#N)c3)cc2cc1OC 850408363 JTHNUNKAFPLULI-UHFFFAOYSA-N 376.456 5.152 30 20 GKED N#CC1(CCCC[S@@](=O)Cc2csc(-c3ccc(F)cc3)n2)CCC1 899385623 UQZWXLOKRUVWTH-RUZDIDTESA-N 376.522 5.062 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1c(F)cccc1F 912706541 VMAUZXSTFYPOMD-SNAWJCMRSA-N 395.249 5.654 30 20 GKED COc1cc(/C=C\C(=O)c2scnc2C)ccc1OCc1ccc(F)cc1 915987907 MTAAFBAPGVUYDI-UITAMQMPSA-N 383.444 5.074 30 20 GKED N#CCCn1cc(C=NNc2ccc(Cl)c(Cl)c2)c(-c2ccccc2)n1 916249554 YGDYQPFRUNUFJU-UHFFFAOYSA-N 384.270 5.217 30 20 GKED O=C(Cc1ccccc1)Nc1cc(N=Cc2c(O)ccc3ccccc23)ccc1F 917556909 RFPKXARUELJRON-UHFFFAOYSA-N 398.437 5.616 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC(F)F 918030076 PKHXICVABQCTTJ-UHFFFAOYSA-N 378.444 5.230 30 20 GKED C(=NNc1ncnc2c1oc1ccccc12)c1csc(-c2ccsc2)n1 920369018 GQQOCNSGUDAKRN-UHFFFAOYSA-N 377.454 5.007 30 20 GKED N#C[C@@H](COC(=O)c1occc1CSc1ccccc1)Cc1ccc(F)cc1 920877222 YINVZBNKHPAVDN-KRWDZBQOSA-N 395.455 5.250 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2nc(-c3ccccc3Cl)cs2)CC1 1776169955 XQNWYKNLLORIMZ-UHFFFAOYSA-N 390.936 5.097 30 20 GKED CC(C)(C)COc1cccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)c1 1776249977 ABXYHNDYGWDSNN-PDGQHHTCSA-N 378.468 5.412 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1 1776327468 TZAMNIPSXOHGJW-OQFOIZHKSA-N 378.424 5.452 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2nc3c(C(=O)O)cccc3o2)cc1 1776785448 AZRAFGHTQNHGJQ-SSZFMOIBSA-N 393.483 6.436 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)ccc1OCC(=O)O 1777289030 KGNWEGLRNGPAQK-NTUHNPAUSA-N 394.467 5.102 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)c4cccc(Cl)c4)cc3)CCC2)C1 1790262760 NPNMCJQBHHLVMS-UHFFFAOYSA-N 394.902 5.054 30 20 GKED N#Cc1ccc(CCC(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)cc1 10447496 CBFBXIOIJFXWQZ-UHFFFAOYSA-N 397.503 5.330 30 20 GKED N#Cc1ccc(CSc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)c(F)c1 11645923 PPGHYEZSAWEEDT-LJQANCHMSA-N 393.487 5.032 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1F 46861750 VNTTVMHGVDXDHY-GOSISDBHSA-N 394.833 5.395 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CSc1nc2ccccc2o1)c1ccccn1 49457034 NPJVBISOFVQDKA-QGZVFWFLSA-N 385.448 5.005 30 20 GKED CCCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@H](C)c1cc2ccccc2o1 65477900 JKFGJXDIOIHQSJ-IAGOWNOFSA-N 375.472 5.548 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCCCC(=O)c2ccccc2)cc1 65680287 MGCGBRCKTVNSPF-UHFFFAOYSA-N 398.462 5.732 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1nc2ccccc2s1 78665504 LFPTVKWCMLUHRI-ZDUSSCGKSA-N 399.566 5.421 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)Cc1ccc(F)cc1 108242046 YJRIMLCYLGYIFQ-UHFFFAOYSA-N 382.382 5.031 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(CCc1cccc(F)c1)C1CC1 114011200 ZBEJKQLGSSODSH-INIZCTEOSA-N 397.519 5.459 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccco1 118611704 PPFQFSSXUFCKSR-CQSZACIVSA-N 378.457 5.232 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2ccc(CC#N)cc2)C1 157093911 DHOIDAIKKRRSMK-LIRRHRJNSA-N 387.405 5.386 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cs1 171362873 JIUIMZDACTVVTH-KRWDZBQOSA-N 399.475 5.114 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc(Cl)c1[N+](=O)[O-] 175757387 GDCWTGFGOAWHPT-UHFFFAOYSA-N 383.816 5.101 30 20 GKED CC(C)(C)C[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Cl)cc1 179707761 DAKSALPTSCKSAD-IBGZPJMESA-N 394.906 5.529 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(OC(F)(F)F)cc1 191725758 DOKATIFXIPKNCJ-HNNXBMFYSA-N 378.394 5.119 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1ccc(Cl)c([N+](=O)[O-])c1 209742425 PAQLPTNLCDSDKU-XQRVVYSFSA-N 376.846 5.329 30 20 GKED CCN(c1ccccc1)c1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cc1 237064520 OHBQBUVVLOLSSX-HXUWFJFHSA-N 385.511 5.425 30 20 GKED CN(CCC#N)c1ccc(CN[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1 237214193 XEORLXLFXYUHMC-SANMLTNESA-N 395.506 5.662 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@]2(C)[C@@H](C1)C2(Cl)Cl 284490658 BNQFLJAWGXPXDT-SRCQZFHVSA-N 398.359 5.128 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)CCCc1nc2ccccc2s1 301751102 SETRNCGXMOYRRK-UHFFFAOYSA-N 390.961 5.549 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2csc(-c3ccoc3)n2)cc1 303266512 GHYVLMODTXNWAX-UHFFFAOYSA-N 387.420 5.319 30 20 GKED CC(O)=Nc1cccc(N=C(O)[C@@H](C)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 328727211 DBPXLMJYSZSJHL-DYVFJYSZSA-N 397.441 5.326 30 20 GKED C[C@H]1Oc2c(cccc2C(O)=Nc2ccc3c(c2)OC2(CCCCC2)O3)N=C1O 329170172 JZHKQIKUTJBELA-CYBMUJFWSA-N 394.427 5.123 30 20 GKED O=C1CCCc2ccc(N=C(O)N3CCCC[C@@H]3c3nc4ccccc4o3)cc21 330150388 NCFJTHCQEVEHEO-LJQANCHMSA-N 389.455 5.120 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 409755939 SMRJQRGYUOUOSC-OALUTQOASA-N 385.294 5.183 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCC[C@@H]2c2cccc(C(F)(F)F)c2)c1 412264081 CMQCFWZKCQETOR-PWRODBHTSA-N 398.428 5.434 30 20 GKED Cc1c(C(=O)Nc2cccc(COCC3CC3)c2)sc2ccc(C#N)cc12 428187840 URPHXIZZUBRGOB-UHFFFAOYSA-N 376.481 5.260 30 20 GKED N#CCCC[C@@H](NCc1nc2ccc(Br)cc2o1)c1ccccc1 433025395 KFQOJWSKLAIOPE-MRXNPFEDSA-N 384.277 5.115 30 20 GKED C=CCn1c(S[C@H](C#N)CC)nc2sc(-c3ccccc3)c(C)c2c1=O 436041441 PNZHWVXHLRZVIN-HNNXBMFYSA-N 381.526 5.014 30 20 GKED CCO[C@H](C)c1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 442683613 WDIBCPZIDISRGV-UKRRQHHQSA-N 397.525 5.163 30 20 GKED COc1ccc([C@@H](NCC2CCC(C#N)CC2)c2ccccc2Cl)cc1OC 442871774 GRSKWNUTPZPRJB-PVWAMWICSA-N 398.934 5.366 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccc(O)cc3)cc2Cl)c1 443603712 JORGXKGXVPGGPC-UHFFFAOYSA-N 393.830 5.140 30 20 GKED Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 454759408 LPGGJYGHZUEVRV-UZLBHIALSA-N 397.519 5.897 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1CCSc2ccc(Cl)cc21)c1ccccc1 457554035 OGXCRBANDJGIHE-RTBURBONSA-N 399.947 5.611 30 20 GKED C=C(C)Cn1c(COc2cccc(C)c2)nnc1N1CCC[C@@H]1c1cccs1 460958619 LCQSEDRDOBLYDG-LJQANCHMSA-N 394.544 5.145 30 20 GKED CSc1ccc(-c2csc(NC(=O)[C@H](C)c3cccc(C#N)c3)n2)cc1 461787909 IHRDYDBNGQQHET-CYBMUJFWSA-N 379.510 5.146 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1ccccc1S[C@H](C)CC#N 462058108 LCHCFOGDLDQNGS-SECBINFHSA-N 385.436 5.117 30 20 GKED CCc1ccc([C@H](c2cccnc2)N(CC)C(=O)[C@H](C)c2cccc(C#N)c2)cc1 463817042 VOLORQGXDHDLIU-KBMIEXCESA-N 397.522 5.257 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cccc2cnccc12 465129569 LFKXNCTUNBZGBA-UHFFFAOYSA-N 395.437 5.401 30 20 GKED CC[C@H]1C[C@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 467690469 FWEZNMBEZFEMTO-KXBFYZLASA-N 397.906 5.443 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cn(CCCC#N)c2ccccc12 467869960 XLPMWLULLDHRLW-PZJWPPBQSA-N 385.511 5.353 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)N3CCC[C@]4(CCCCO4)[C@H]3C#N)o2)c1 468143512 HYSGFDQAYLFABQ-ISKFKSNPSA-N 392.499 5.137 30 20 GKED Cc1ccc(CC[C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469183309 XTNRCWNLCMJPGC-IBGZPJMESA-N 375.516 5.011 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCC[C@@H]3Cc3ccccc3)ccc21 469258431 SMPAPPBVLAUVNA-NFBKMPQASA-N 387.527 5.093 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1cc(C(F)(F)F)ccc1F 471139125 HJPYUZKHSLLTFO-UHFFFAOYSA-N 399.237 5.177 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 475113551 DOTOUBUZWSLSKG-IBGZPJMESA-N 381.435 5.377 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 475203000 KVTGCILRSWCGOM-IAGOWNOFSA-N 395.934 5.527 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccco1)c1ccc(Cl)cc1)c1ccccc1 475932807 YPYULSVDRUTXNG-SFHVURJKSA-N 378.859 5.554 30 20 GKED C[C@@H]1C[C@@H]1[C@H](NCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccc(Cl)cc1 478388686 UGSOYHDMQXJXIQ-LDLFBNOTSA-N 390.918 5.099 30 20 GKED CN(C)Cc1cccc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1 479528011 IJLIGJAXYZQGKX-UHFFFAOYSA-N 387.508 5.023 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CCCc4cc(F)c(F)cc43)c2)cc1 482697554 XIKUHOBYLHXMMW-UHFFFAOYSA-N 390.389 5.222 30 20 GKED N#C[C@@H](C(=O)c1cccc(NC(=O)c2cccs2)c1)c1nccc2ccccc12 483241080 VNNJBMALXSDKLZ-LJQANCHMSA-N 397.459 5.039 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 505299683 YYKDFOMQJPWHAX-QRWLVFNGSA-N 385.508 5.596 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc(C)cs3)c3ccccc3n2)cc1 505300615 WYMGEBRFWWHJJL-LJQANCHMSA-N 383.476 5.465 30 20 GKED CC(C)c1cc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)nn1C(C)(C)C 505938939 RHSNQDNYTKYHNM-MRXNPFEDSA-N 393.318 5.063 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1ccc(OCc2ccccc2C#N)cc1 512691629 WOERAQQZBFOEOW-UHFFFAOYSA-N 390.508 5.250 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)cc1 512900699 DRKURTYBXPMTMI-IBGZPJMESA-N 383.373 5.331 30 20 GKED C=CCN(C(=O)COc1ccccc1Cl)c1nc(-c2ccccc2)cs1 514301770 NAKUIPYPPUOEHP-UHFFFAOYSA-N 384.888 5.062 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)CSCc2ccc(C#N)cc2)cc1 514420476 DLTMAHBJPWAQCW-UHFFFAOYSA-N 388.492 5.531 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)Nc3ccccc3Cl)c2)c1 518430528 VVNJUFCQFSFNCS-UHFFFAOYSA-N 377.831 5.435 30 20 GKED CC(C)CN(C(=O)c1ccc(N(C)c2ccccc2)nc1)c1ccc(C#N)cc1 520151909 PVEKMYMNMKUUKU-UHFFFAOYSA-N 384.483 5.024 30 20 GKED Cc1cc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)s1 520818164 WKYGSZMHMJTEHK-ZDUSSCGKSA-N 390.599 5.489 30 20 GKED C=CCN(C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 525521126 HJOIQAXFGUWPGM-WMZOPIPTSA-N 396.462 5.411 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)Cc1cccc(F)c1 532493640 FZUFTMJZUYKFPQ-KRWDZBQOSA-N 399.535 5.069 30 20 GKED C=CCC[C@H](NCc1nccn1Cc1ccccc1)c1ccc(C(F)(F)F)cc1 533069279 MGTYNHAKELILNK-NRFANRHFSA-N 399.460 5.747 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)n1 537483626 ZMDWUMMDAKUSDD-UHFFFAOYSA-N 391.521 5.410 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ncc(-c2ccccc2)[nH]1 540446771 YGUHHQYGNODFQW-LJQANCHMSA-N 387.487 5.151 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cc(Cl)ccc2SC2CCCC2)n1 542650253 QNLHXIKWTPJGQT-OAHLLOKOSA-N 376.934 5.630 30 20 GKED C=CCOc1ccc(CNC(=O)N(C)[C@@H](C)c2sc(C(C)C)nc2C)cc1 558103397 ABRXLGPHTBUVTO-INIZCTEOSA-N 387.549 5.042 30 20 GKED C=CCC1(c2nc(-c3cccc(NC(=O)c4ccccc4F)c3)no2)CCC1 577023447 RMHZWKAFYBRWTF-UHFFFAOYSA-N 377.419 5.126 30 20 GKED C=CCCOCC(=O)Nc1c(C)cccc1-c1nc2cc(F)ccc2n1C(C)C 607852304 QVKPFQBZJWJSKW-UHFFFAOYSA-N 395.478 5.263 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCC[C@@H](c2ccccc2)CC1 608995251 FYLFLPBJMLTLJI-HXUWFJFHSA-N 377.488 5.147 30 20 GKED Cc1ccc(NC(=O)c2cc3ccccc3n2CC#N)c(OCc2ccccc2)c1 609165099 GQOXPDCPJZFASV-UHFFFAOYSA-N 395.462 5.305 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)c1cccc(COc2cccc(C#N)c2)c1 609640455 OVJAYRYUKYNGQE-UHFFFAOYSA-N 390.870 5.063 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@H](C)c1cccc(C#N)c1 610355859 DOIISZYNDBDJKN-OLZOCXBDSA-N 376.287 5.329 30 20 GKED CC(C)N1CCC(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 610422268 LYMYJGKUROYKKL-NRFANRHFSA-N 395.934 5.054 30 20 GKED C[C@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1cccc(C#N)c1 611184125 PYMHKVCGLCOFSM-LBPRGKRZSA-N 383.423 5.110 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 611384939 DHKOHJSJEQTCNO-KRWDZBQOSA-N 391.452 5.134 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H]1CCc2cc(C#N)ccc21 618804841 MNIFIPXJBZZGKT-RBZFPXEDSA-N 377.488 5.467 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OC(C)C)cc3)n2)cc1 619756426 AVTARRBAQGUTAJ-LJQANCHMSA-N 392.480 5.096 30 20 GKED O=C(CCCC(F)(F)F)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 648494397 NPOSRPFNTVEVAJ-UHFFFAOYSA-N 399.228 5.647 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cnn(-c2ccc(Cl)cc2)c1C(C)C 666876874 SPHGUMCVLSZEDZ-HDICACEKSA-N 384.911 5.364 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2cccs2)c2ccc(F)cc2F)c1 726472910 BXUDHTXIPQENIV-UHFFFAOYSA-N 384.476 5.411 30 20 GKED COc1ccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)cc1F 726485886 WPUSPTNHEMNFHL-UHFFFAOYSA-N 391.471 5.110 30 20 GKED C=CC[C@@H](NC(=O)N1CCCCC[C@H]1c1ccc(OC)cc1)c1ccncc1 734681875 ZYVXYIJLHWAMKY-YADHBBJMSA-N 379.504 5.034 30 20 GKED C[C@H](NCc1ccc(O[C@H](C)C#N)cc1)c1ccccc1-c1ccc(Cl)cc1 740014239 OVYWKMBHIQLJDC-MSOLQXFVSA-N 390.914 6.149 30 20 GKED O=C(/C=C/c1nccc2ccccc12)c1cc2cc(Br)ccc2o1 740765021 NPKJIWCLPXUPJK-VOTSOKGWSA-N 378.225 5.640 30 20 GKED N#C[C@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2[nH]1 744010945 UAQDIKXKRXMETE-NHCUHLMSSA-N 379.463 5.156 30 20 GKED CC(=NNc1ccccc1Br)c1c(C)nn(-c2ccccc2)c1C 746490049 PQKYGHOWMSBJEI-UHFFFAOYSA-N 383.293 5.088 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 747315125 TWIMPUOGWICGLE-KTKRTIGZSA-N 378.353 5.294 30 20 GKED COc1ccc(C=NNc2ccc(Cl)c(Cl)c2)cc1OCCCC#N 747357746 TVTZAOLAVWMTJA-UHFFFAOYSA-N 378.259 5.131 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc(Cl)n2)cc1Cl 749487299 XBTDVURSJWSMFE-INIZCTEOSA-N 382.250 5.296 30 20 GKED Cn1c([C@H](C#N)C(=O)C2(c3ccc(Cl)c(Cl)c3)CCC2)nc2ccccc21 750677291 FGVWWLQLILMVDP-CQSZACIVSA-N 398.293 5.178 30 20 GKED CC(C)(C)SCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 754532806 YWJYSRNPMKPMTC-HNNXBMFYSA-N 392.977 5.952 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cccc(NC(=O)c2ccccc2)c1C 757867202 RRSSBBKMYYHKQL-NRFANRHFSA-N 395.503 5.157 30 20 GKED C=C(C)[C@H](CC(=O)O[C@H](c1cccnc1)c1cccc(C(F)(F)F)c1)OCC 759594431 GNYMHOYRDILZRF-ICSRJNTNSA-N 393.405 5.104 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)c(N)c(Cl)c1 764200679 ZVDFWKSVFPXBIX-SNVBAGLBSA-N 380.300 5.222 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 774575505 LJOKGKZIFZRSCF-HZPDHXFCSA-N 383.410 5.003 30 20 GKED C=CC[C@H](C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1C)c1ccccc1 777754209 MECYTWCISHBTHK-IBGZPJMESA-N 380.488 5.640 30 20 GKED Fc1cccc(F)c1[C@@H](NCc1c(F)c(F)c(F)c(F)c1F)C(F)(F)F 780415426 RVAFKSXCBVVEKR-CQSZACIVSA-N 391.208 5.054 30 20 GKED N#C[C@H](C(=O)CCCc1ccsc1)c1nc(-c2ccc(Cl)cc2)cs1 783355276 LCDVRPVJIGVSOV-MRXNPFEDSA-N 386.929 5.724 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1Cl 789156935 HGWPEMYRILLQKE-BQYQJAHWSA-N 384.888 5.542 30 20 GKED COc1ccccc1-c1ncc(C=NN(Cc2ccccc2)c2ccccc2)cn1 792872602 OSIDSDKRAUKMDD-UHFFFAOYSA-N 394.478 5.193 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1OC(F)F 797567169 ZCZDMWRYNJPJLY-FWLQQBITSA-N 390.455 5.322 30 20 GKED COc1ccc(/C=C/C(=O)c2csc(C(C)C)n2)c(OCc2cccnc2)c1 812244028 YEGFHWSEGCGRBV-VQHVLOKHSA-N 394.496 5.145 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@@H](CCCC#N)c1ccccc1 814210553 QUSRSXZTLGLKLG-QFIPXVFZSA-N 393.600 6.655 30 20 GKED C=CCCC[C@@H](c1ccccc1)c1nc([C@@H]2CCC(=O)N(CC3CCC3)C2)no1 904838578 YYXZBEBRNRWJGE-RTWAWAEBSA-N 393.531 5.064 30 20 GKED Cc1cccc(CSCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915088232 LTAUZHNEWXKQEU-HSZRJFAPSA-N 386.520 5.522 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3n2C)c(C)n1[C@@H](C)c1ccccc1 916845215 QVGNBMIUAGKZAN-LAUBAEHRSA-N 396.494 5.091 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(OC(F)F)cc3)s2)cc1 1776040613 BCJSNOHQIMNVJC-UHFFFAOYSA-N 388.395 5.161 30 20 GKED CC(Cc1ccc(Cl)c(C(F)(F)F)c1)=NNc1ccc(CC(=O)O)cc1 1776085574 WKIJHKMVOIDJCQ-UHFFFAOYSA-N 384.785 5.016 30 20 GKED O=C(O)c1cc(F)c(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)c(F)c1 1776126601 QOEXUKDNUPWLNY-KHPPLWFESA-N 380.346 5.351 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2ccc(OCc3ccc(F)cc3)cc2)CC1 1776169468 TVRLMGRITHEDSK-UHFFFAOYSA-N 397.490 5.038 30 20 GKED C=CCc1cc(C)c(OCCCN[C@@H](c2ccccc2)C(C)(C)C(=O)O)cc1C 1776187114 XMPSFGCBKSJLRB-QHCPKHFHSA-N 395.543 5.243 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1\C[C@H](C(=O)O)c2ccccc2C1=O 1776200190 ZATPSPPPYUXXCP-YZNGDSSZSA-N 386.369 5.490 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1c(F)ccc3sc(C(=O)O)cc13)CO2 1776374693 SRHWSZJYPCLKBW-MDWZMJQESA-N 396.439 5.521 30 20 GKED CCCCCCCOc1cccc(CNCc2ccc(C(=O)O)c(C3CC3)n2)c1 1776787690 RDALDGVESRMZQY-UHFFFAOYSA-N 396.531 5.296 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)o1 1777424549 KVWDTMDHQHLQHC-SSZFMOIBSA-N 390.410 5.695 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)C(=O)Nc1cc(Cl)ccc1OC 7664158 WHZZWMAXZWGYBU-LBPRGKRZSA-N 399.343 5.079 30 20 GKED CCCn1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1cccc(C)c1 24730282 WLFNECDEKSMBMN-FQEVSTJZSA-N 376.529 5.199 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)oc2c(F)cccc12 41558308 ZHIXNYKNTABUDZ-LBPRGKRZSA-N 383.329 5.115 30 20 GKED N#C[C@@H](C(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccc2ccccc2n1 47376715 DSJXBMGHNCXVSU-LJQANCHMSA-N 386.382 5.036 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccc(F)cc2)cs1 54895562 QODNSMYISGNKMS-DHZHZOJOSA-N 384.407 5.002 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)c(F)c1 66955210 GUABBSPWANEIPT-ZDUSSCGKSA-N 375.444 5.023 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 69572795 LNWAHJXGOCCCAS-KXBFYZLASA-N 393.874 5.813 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 108201054 PUVWIKCZQXPJEG-UHFFFAOYSA-N 399.475 5.609 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2sccc2C)cs1 113772010 VLMOTBAHCAPALB-VMPITWQZSA-N 386.473 5.233 30 20 GKED Cc1ccc(Br)c(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 128941764 RHLAWNKZHIGZSW-UHFFFAOYSA-N 386.293 5.072 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 165037496 RVPDPPUKRSSXID-JOCHJYFZSA-N 398.466 5.423 30 20 GKED N#Cc1c(NC(=O)c2cnc(-c3ccccn3)s2)sc2c1CCCCCC2 171414636 UESKSOWZRXQUDR-UHFFFAOYSA-N 394.525 5.050 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2C2(CC2)C1 187130854 LMXHMMQNXALFIR-MRXNPFEDSA-N 377.513 5.160 30 20 GKED Cc1ccc(C)c(NC2=NC(=O)/C(=C\c3cccc(OCCCC#N)c3)S2)c1 207613567 FSFSSJUPKRRABV-XSFVSMFZSA-N 391.496 5.068 30 20 GKED COc1cc(/C=C\C(=O)c2ccccc2OCc2ccccc2)ccc1OCC#N 208124426 VECNAZWCISCARG-QBFSEMIESA-N 399.446 5.073 30 20 GKED CN(C)Cc1nc(Oc2ccccc2C#N)c2c(-c3ccccc3)csc2n1 301114566 NZDISOXWSGVLHA-UHFFFAOYSA-N 386.480 5.084 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(-c2ccc(F)cc2)n1 302639378 XWPMJPNRGCHSTG-UHFFFAOYSA-N 392.908 5.493 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1ccccc1SCCC#N 303337679 XULBMEQQKXTTOF-KRWDZBQOSA-N 382.529 5.530 30 20 GKED C[C@H](SC1CCOCC1)C(O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328764540 GGXMSMSEJYNPCD-AWEZNQCLSA-N 377.506 5.007 30 20 GKED OC(=Nc1ccccc1N1CCCCCC1)N1CCc2[nH]c3ccccc3c2C1 329284860 GFEBAHHNQDKIRH-UHFFFAOYSA-N 388.515 5.152 30 20 GKED CC(C)Oc1ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)cc1Cl 329953423 JHVQBRWURRVGST-UHFFFAOYSA-N 378.900 5.641 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c21 411007269 FWYZLQHNWMAAGB-OLZOCXBDSA-N 381.526 5.174 30 20 GKED CCOc1cc2c(cc1NC(=O)c1sc3ccc(C#N)cc3c1C)O[C@@H](C)C2 429905661 VNLCXYXDQASDLV-LBPRGKRZSA-N 392.480 5.056 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1Br 430606450 VRYBGAAYCYZGNW-LBPRGKRZSA-N 377.307 5.002 30 20 GKED N#Cc1c(F)ccc(/C=C(/CCC(=O)O)c2nc3ccccc3s2)c1Cl 431581390 ZOCZFBXAEMDQQC-XFXZXTDPSA-N 386.835 5.366 30 20 GKED N#CCCC[C@H](NC(=O)NCCc1cccc(Cl)c1Cl)c1ccccc1 431862063 XAIWIZDNMDQALS-SFHVURJKSA-N 390.314 5.270 30 20 GKED CCc1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)o1 432004500 AMVZBPYRUDQRSR-QGZVFWFLSA-N 379.847 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(C)(C)C(F)(F)F)cc1 433891598 DRZINZLMTCOMSB-UHFFFAOYSA-N 389.461 6.631 30 20 GKED CCCOc1cccc(CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 434212380 ULAKAICMHLJYFM-KRWDZBQOSA-N 397.544 5.234 30 20 GKED CSc1c(F)cccc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 435779747 YMQPMVXHNLQGLB-LLVKDONJSA-N 376.865 5.301 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 439313107 JGLJVHNRMYQJTK-QFIPXVFZSA-N 396.450 5.517 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c(Cl)c1 439440109 POKCAMIWUAXNRW-UHFFFAOYSA-N 392.261 5.358 30 20 GKED CC(C)(C#N)CCCCN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 444668180 CBOJCTSFDVKEAZ-OAQYLSRUSA-N 378.495 5.226 30 20 GKED C=CCC[C@@H](NC(=O)c1ccoc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 464205026 MKAJVLNWNJIFSF-CQSZACIVSA-N 391.311 5.755 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCc1ccc(-c2ccccc2)o1 464958677 GBAJWAKLLBCSAH-DHIUTWEWSA-N 384.479 5.178 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1C1CC1 469734207 CKFYDCXENKUOKL-INIZCTEOSA-N 389.503 5.242 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)Cc2cnc3ccccc3c2)cc1 475263444 YRDZRLJFCXNEAO-UHFFFAOYSA-N 379.419 5.080 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@](C)(c2ccccc2)C1 503227003 UQWCIRBXXFRQQC-JPYJTQIMSA-N 393.556 5.524 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](CCCCc2ccccc2)c2ccccc2)CC1 504394262 CUPHOOFYGXJTLE-QHCPKHFHSA-N 389.543 5.476 30 20 GKED CCCCS[C@@H](C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 515905047 NLQTWTNEMWDBLU-KRWDZBQOSA-N 382.529 5.192 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 518137718 PZCIUFADGVXSON-CABCVRRESA-N 388.920 5.306 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)n1-c1nccs1 518140129 FDBNHAMCXYRTLB-ZDUSSCGKSA-N 396.541 5.055 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)Cc2c[nH]c3cc(Cl)ccc23)cc1 518709512 ZYJGSJZEJCNSLV-FQEVSTJZSA-N 379.891 5.042 30 20 GKED Cc1csc(-c2ccc(NC(=O)CCCCOc3cccc(C#N)c3)cc2)n1 520327973 CKWAKMSVMJWRPX-UHFFFAOYSA-N 391.496 5.178 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)C(=O)Nc1ccc(C(C)(C)C)cc1 521731245 OQYKGBHBLKKTHK-IRXDYDNUSA-N 395.572 5.675 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)C(C)(C)c1cccc(C(F)(F)F)c1 524278812 CUHCVZDUOIBGSF-UHFFFAOYSA-N 391.433 5.206 30 20 GKED COc1ccccc1-c1ccc(CN(C(=O)c2ccc(C#N)cc2)C(C)C)cc1 525093163 WUAFRIOUFZFMQI-UHFFFAOYSA-N 384.479 5.285 30 20 GKED C[C@@H](NC(=O)Nc1cccc2[nH]ccc12)c1ccc(-c2cccc(C#N)c2)cc1 541096828 JEWZSZHNNCGWQY-MRXNPFEDSA-N 380.451 5.589 30 20 GKED CCC(=O)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 542130862 WAAADDDFYQGVHM-QGZVFWFLSA-N 394.883 5.546 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccccc1COC(C)(C)CC 544627474 IHDYNABUYUMCCZ-UHFFFAOYSA-N 382.504 5.278 30 20 GKED COc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2ccccc2)cc1Cl 550969192 POBHCLKJBRGPBO-AWEZNQCLSA-N 398.919 5.381 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)cc1 572417476 SKOHNKRINLWYDE-UZUQRXQVSA-N 390.531 5.160 30 20 GKED COc1ccc2cc([C@H](C)C(=O)Nc3cc(C#N)ccc3NC3CC3)ccc2c1 582113191 FGBWMQMIBOZDAL-HNNXBMFYSA-N 385.467 5.037 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@@H](c1cc(F)cc(Br)c1)C1CC1)CC2 583663679 QKIOEYNDZPHBTQ-WOJBJXKFSA-N 385.280 5.188 30 20 GKED N#C[C@H](C(=O)c1cc2c(Cl)cccc2s1)c1nc2cc(F)ccc2s1 592974573 ULCCZGCOMYAOMN-LLVKDONJSA-N 386.860 5.794 30 20 GKED Cc1cc([C@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2ccccc2Cl)ccc1F 596398637 QWVOCBKFVZLJKZ-KKSFZXQISA-N 399.897 5.212 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)n1 596533254 BYLBKKFKCUBBEH-QGZVFWFLSA-N 385.448 5.264 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)N5CCC[C@@H](CC#N)C5)(C4)C2)C3)cc1C 597916663 YKHOBCLAWFDUCA-FVGREDNUSA-N 390.571 5.294 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)Cc3csc(-c4cccs4)n3)c2C#N)C1 604480828 PJYMCJCMDRCBGB-NSHDSACASA-N 399.566 5.111 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N(C)c1ccc(C#N)cc1F 609217485 IAPRJXFZMBGJBI-UHFFFAOYSA-N 385.851 5.059 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)C(=O)Nc1ccccc1 609387146 POOZEZDFPJPJPB-ZDUSSCGKSA-N 393.434 5.150 30 20 GKED CC[C@H](c1ccccc1)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 609435174 WESXETRGQBBWFI-YLJYHZDGSA-N 381.545 6.086 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)sc2ccc(F)cc12 609460314 WFBGHDNYJDUZHQ-HNNXBMFYSA-N 392.377 5.362 30 20 GKED CN(Cc1ccc(F)cc1F)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 609498676 WWKKNMNGQPUQEU-UHFFFAOYSA-N 392.405 5.095 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)s2)C1 612239824 NVEYMWBEWWOONG-SFHVURJKSA-N 394.418 5.080 30 20 GKED COc1cccc(C[C@@H](NCc2ccc(C#N)c(Cl)c2)c2ccccc2)c1 619755849 WCUCXMMBCZMBPU-HSZRJFAPSA-N 376.887 5.294 30 20 GKED CCN(Cc1ccc2ccccc2c1)C(=O)NCc1ccc(C#N)c(Cl)c1 619825881 CPNKYAPADSLFHS-UHFFFAOYSA-N 377.875 5.097 30 20 GKED O=C(NC1CCC(C(F)F)CC1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 622696078 YFNMNWSORAPFPL-UHFFFAOYSA-N 389.286 5.278 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(OCc3ccccc3)cs2)n1 626355918 IEJJGQJLZTUZIK-INIZCTEOSA-N 382.510 5.397 30 20 GKED C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccccc1Oc1ccccc1 725852919 LHGNHGWLZDNTRM-HXUWFJFHSA-N 385.511 5.680 30 20 GKED CCC[C@H](C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 726532634 NHLFNNRCMWOVRS-MRXNPFEDSA-N 381.526 5.011 30 20 GKED CC(=O)Nc1ccc(/C=C2/CCc3nc(-c4ccc(C)cc4)sc3C2=O)cc1 727654971 QFDZZYUOKBMZDN-AQTBWJFISA-N 388.492 5.289 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc4c(c3)CCC4)c2)cc1 729159655 BADVECGQTDMSJV-UHFFFAOYSA-N 385.492 5.648 30 20 GKED CCSc1ccc(Cl)cc1NC(=O)c1c(C)oc(-n2cccc2)c1C#N 729657437 OTBCWTAXSUJNON-UHFFFAOYSA-N 385.876 5.268 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2cn(C(C)(C)C)nc2-c2ccccc2Cl)cn1 731158765 IHHBSDDCADGETG-KHPPLWFESA-N 396.922 5.632 30 20 GKED CCOc1c(Cl)cc(C=NOCc2ccc(SC)c(OC)c2)cc1OC 731664101 VCQLXVCBGVYSJM-UHFFFAOYSA-N 395.908 5.029 30 20 GKED CC(C)c1ccc2cc(C(=O)N[C@@H](C#N)c3ccccc3Br)[nH]c2c1 733266744 MLYJZOCAPYTTHB-IBGZPJMESA-N 396.288 5.048 30 20 GKED C=CC[C@@H](NC(=O)c1sc(-c2ccc(Cl)s2)nc1C)c1ccncc1 734235216 YZMUNLVEJXVVQG-CYBMUJFWSA-N 389.933 5.276 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1ccc(OCC2CCOCC2)cc1 736430858 KLSISODWWHRPOT-UHFFFAOYSA-N 380.271 5.255 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 736483914 CTNNFSBYXVDMEK-XFXZXTDPSA-N 398.853 5.407 30 20 GKED Cc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 740531248 OFFJUPRGCJLGFF-DOMZBBRYSA-N 388.414 5.604 30 20 GKED CC(C)(C)OC(=O)N[C@@H](C/N=C\c1c(O)ccc2ccccc12)c1ccccc1 741844969 RGUAESJUWXNLFV-BABSMXRMSA-N 390.483 5.230 30 20 GKED CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 748942414 PJVHBIFZXUGVBG-YPAWHYETSA-N 393.556 5.528 30 20 GKED CC(C)c1noc2nc(-c3ccco3)cc(C(=O)OCC3CCC(C#N)CC3)c12 755974646 KUYFBJXXOJVUHN-UHFFFAOYSA-N 393.443 5.093 30 20 GKED CC(C)(C)c1ccc(CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 762996955 SZNAYOQSFARMJQ-INIZCTEOSA-N 381.426 5.148 30 20 GKED Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)OCCCCC(C)(C)C#N)c12 768544451 SOPFIXPXNKPNGG-UHFFFAOYSA-N 395.434 5.214 30 20 GKED O=C1/C(=C/c2csc(-c3ccccn3)n2)CCc2ccc(Br)cc21 769616849 LIJXFNMGJVMCCO-UKTHLTGXSA-N 397.297 5.180 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2csc(-c3csc(C)n3)c2)c1 772982082 DOQPEMGQDYFYKO-KBXCAEBGSA-N 397.569 5.712 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1 780676824 FVNIVMLWNQNUJH-UWJYYQICSA-N 391.515 5.644 30 20 GKED Cc1nnc([C@@H](C)OC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)s1 783704480 VGMHSXCRXULSGU-LLVKDONJSA-N 399.859 5.082 30 20 GKED C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cc(Br)cc(Cl)c1O 787034930 UJUZKQSDQGPSCE-DYZYQPBXSA-N 391.696 5.018 30 20 GKED C[C@@H](Cc1ccc(Br)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792108858 ZKLHRYPQTOQEAO-LIRRHRJNSA-N 393.284 5.052 30 20 GKED C=CC[C@@H](OC(=O)c1csc([C@H]2CCCO2)n1)c1ccc(Cl)c(Cl)c1 797553071 QRQAVOKMFUBSQG-HZPDHXFCSA-N 398.311 5.776 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(Br)cc2)s1)c1ccnc(O)c1 798230778 PPUBOQTUTMWTJP-FNORWQNLSA-N 386.270 5.174 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)c(F)cc2Cl)cc1 815009772 CNARYELWLNMUID-QGZVFWFLSA-N 399.252 6.040 30 20 GKED N#CCCC[C@H](NC(=O)/C=C\c1ccccc1OC(F)(F)F)c1ccccc1 817319822 SHTYMBIVINYVCL-HWOXTHGCSA-N 388.389 5.150 30 20 GKED C=C(C)CCNC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 836375712 AXZYCPICOWRMGN-UHFFFAOYSA-N 387.402 5.140 30 20 GKED O=[N+]([O-])c1cccc([C@@H](NCc2ccccc2C(F)(F)F)C(F)(F)F)c1F 839650423 LVIXWGHJEKPXAL-CQSZACIVSA-N 396.262 5.146 30 20 GKED CCCn1c(=S)n(CN(CCC#N)Cc2cccnc2)c2cc(Cl)ccc21 914565420 UGOAPWYWTBHWJC-UHFFFAOYSA-N 399.951 5.004 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)NCc3ccc(C#N)cc3)cc2)cc1 916408870 FKHZNQWXYODGBQ-UHFFFAOYSA-N 387.439 5.071 30 20 GKED O=C(O)c1cc2c(C=NNc3cccc(C(F)(F)F)c3)c(F)ccc2s1 1776014800 BHODNGUVVNITPU-UHFFFAOYSA-N 382.338 5.203 30 20 GKED CC(CCc1ccc(OCC(=O)O)cc1)=NNc1ccc(-c2ccccc2)cc1 1776059696 GJXFFELINOKFRR-UHFFFAOYSA-N 388.467 5.238 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(-c2ccccc2Cl)s1 1776073607 CWXMLDDWGCKTAU-UHFFFAOYSA-N 388.851 5.742 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)cc1)c1ccccc1 1776469476 YUNZDOZAPUKOJD-SCOADAFUSA-N 390.410 5.560 30 20 GKED C[C@@H](Oc1cccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)c1)C(=O)O 1776473536 OELGDAJWJDDIEI-SCZPIIQISA-N 396.508 5.469 30 20 GKED CC1(C)/C(=C/c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1776515330 JTAIYVQTVPUWPW-HZHRSRAPSA-N 398.458 5.521 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(C(F)(F)C(F)(F)F)cc1 1776784100 JXQMUZJPVCWQGM-INIZCTEOSA-N 395.412 5.634 30 20 GKED CCCCCCCOc1cccc(/C=C/C(=O)c2cc(C(=O)O)ccc2C)c1 1776789018 KOSYHTXSTVANKX-WYMLVPIESA-N 380.484 5.939 30 20 GKED COc1ccc(/C=C2/CCc3ccc(Cl)cc3C2=O)c2cc(C(=O)O)oc12 1777360312 WJBRYTIWNHQGDK-JYRVWZFOSA-N 382.799 5.006 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H]3CC=C(C)CC3)CCC2)cc1 1791250565 VNOVCDFVEGKFSA-MOPGFXCFSA-N 380.532 5.079 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)sc2C)=C(/S)Nc2ccccc2)cc1 10170856 CFHVHNYNCUHHCF-UHFFFAOYSA-O 395.573 5.266 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3c(F)cccc3Cl)c2)c1 32290682 SOFZEDFMXUTRMS-UHFFFAOYSA-N 380.806 5.182 30 20 GKED N#C[C@H](C(=O)c1csc(-c2cccs2)n1)c1nc(-c2ccccc2)cs1 41533787 YDQUIRXXJSCGMG-CYBMUJFWSA-N 393.518 5.485 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2ccc(C)o2)cs1 54897870 VEVQXHGSEVGQBV-TWGQIWQCSA-N 386.860 5.279 30 20 GKED C=CCCO[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67798825 PKKCZBBWPFDSKI-BXUZGUMPSA-N 395.311 5.274 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 102536240 SWSKCWAIQFTVKK-UHFFFAOYSA-N 391.427 5.006 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)C(=O)Nc1cc(Cl)ccc1F 108408085 LPEROWJNIRBREZ-CHWSQXEVSA-N 391.899 5.170 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@@H]1CCCO[C@@H]1C(C)(C)C 118544618 FQURWALBSPQYCU-GJYPPUQNSA-N 389.565 5.044 30 20 GKED N#C[C@H](C(=O)c1csc(Br)c1)c1nc2cc(Cl)ccc2s1 120050951 MHMHAIQLPAKCSP-SECBINFHSA-N 397.706 5.264 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(-n2cccn2)cc1C(F)(F)F)c1ccccc1 122879118 AIHJHQLGTMGAAY-HNNXBMFYSA-N 385.389 5.190 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccccc2C(F)(F)F)o1 126444690 HPFQYJMXCDTSIN-UHFFFAOYSA-N 386.329 5.001 30 20 GKED Cc1cc2cc(NC(=O)c3cn(CCC#N)nc3-c3ccc(C)c(C)c3)ccc2[nH]1 150211549 FXAOYXZHHAZDHG-UHFFFAOYSA-N 397.482 5.123 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 153991436 XGMIWRYGDJMYNX-QFIPXVFZSA-N 386.455 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCO)[C@@H]1CCCc2ccccc21 191444277 HSNLDPUWRHMWBF-HSZRJFAPSA-N 392.543 5.442 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1nc2ccccc2s1 191466505 VEFZIOJQFKSROL-UHFFFAOYSA-N 379.529 5.812 30 20 GKED Cc1ccsc1-c1nnc(SCc2cc(C#N)ccc2Br)o1 191741941 USDWBMBZYWWXTE-UHFFFAOYSA-N 392.303 5.033 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(C2CC2)[C@H]2CCCc3ccccc32)c1 303544142 YZTKPPFWBOWLMP-DEOSSOPVSA-N 388.511 5.176 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 303639555 AVJCKDCYCHDABS-VIFPVBQESA-N 379.266 5.583 30 20 GKED CC1(C)C[C@@H](/N=C(/O)CCc2nc(C3CCCC3)no2)c2ccc(F)cc2O1 330062245 AOVMIEUYWSTHMT-MRXNPFEDSA-N 387.455 5.058 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@@H](C)CC3)c(C(F)(F)F)o1 410990387 WJEQYJSPWZLQSE-WCBMZHEXSA-N 382.407 5.478 30 20 GKED N#Cc1ccc(NC(=O)N2CCc3cc(-c4ccccc4)oc3C2)c(Cl)c1 426155711 AEIQKZBOCGLZFW-UHFFFAOYSA-N 377.831 5.062 30 20 GKED C[C@@H](NC(=O)c1cnn(CCC#N)c1-c1ccccc1)c1cccc2ccccc12 428333465 WPQLJZMDPHHDSH-GOSISDBHSA-N 394.478 5.108 30 20 GKED N#CCCn1cc(/C=C/c2ccc3cc([N+](=O)[O-])ccc3n2)c(-c2ccccc2)n1 432707441 DGZHDSUPAQINKI-CSKARUKUSA-N 395.422 5.091 30 20 GKED Cc1ccc(/C=C/CC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 440530881 ARBMUFSWLIBOIT-HWKANZROSA-N 383.451 5.404 30 20 GKED N#CCSc1ccccc1NC(=O)CN(c1ccsc1)C1CCCCC1 447385667 OZWIMPYBOUSEIV-UHFFFAOYSA-N 385.558 5.142 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1)c1ccccc1 455669135 XOBUQXPDQMRWQZ-JOCHJYFZSA-N 377.488 5.031 30 20 GKED CO[C@H](c1ccccc1Cl)[C@@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 458670862 XOVSHALTQPQDFS-HBGVWJBISA-N 399.922 5.150 30 20 GKED CCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 458849948 TXRBCUMDMXLUFI-FCHUYYIVSA-N 390.531 5.316 30 20 GKED C=C(C)Cn1c(-c2cccc(Cl)c2)nnc1N1CCC[C@@H]1c1csc(C)n1 460372573 FTGXGBXTPLWVIA-GOSISDBHSA-N 399.951 5.281 30 20 GKED C=C(C)Cn1c(-c2ccccc2OC)nnc1N1CCC[C@@H]1c1cccc(F)c1 460944291 QJYGBKUIQWEDFC-HXUWFJFHSA-N 392.478 5.010 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)CCC(=O)Nc1ccccc1C#N 464769143 ZWRYBWJXCHCZTR-IBGZPJMESA-N 383.495 5.247 30 20 GKED N#CC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3Cl)cc2)CC1 465179526 YEQVDSSNXHLLEU-UHFFFAOYSA-N 375.255 5.161 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1csc(Cl)c1 466999636 ZPJBXNPEXGJDNX-UHFFFAOYSA-N 382.872 5.413 30 20 GKED C[C@@H](CC(C)(C)c1ccccc1)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469242865 MXEOICOZORNBBW-IBGZPJMESA-N 389.543 5.438 30 20 GKED CC(C)(CC(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C(F)(F)F 480748763 INGSTKNDKTVOBM-LLVKDONJSA-N 395.265 5.404 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1cccc2ccccc12)C(F)(F)F 481483264 IVOORGLBJGHYEC-QGZVFWFLSA-N 377.410 5.072 30 20 GKED Cc1ccc(C[C@@H](C)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 483849578 UXCHMPIILQWGOJ-GOSISDBHSA-N 385.467 5.180 30 20 GKED C=CCN(C(=O)c1sc(COc2ccc(F)cc2)nc1C)c1ccccc1 484258776 BRIWMJYRNHSJAW-UHFFFAOYSA-N 382.460 5.002 30 20 GKED Cc1cc(C)c(C[S@](=O)CCCCC(C)(C)C#N)c(OCc2ccccc2)n1 488843239 YKSPMLAPFKCVAJ-MUUNZHRXSA-N 398.572 5.246 30 20 GKED N#Cc1cc(NC(=O)c2c(Cl)cncc2Cl)ccc1Oc1ccccc1 501569083 MNTAIASWRZAIMJ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 504137604 AJBQYWBNRDBLQI-IFMALSPDSA-N 398.526 5.027 30 20 GKED O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)[C@@H]1CCC[C@@H](C(F)(F)F)C1 505445603 KHMMMJKGUOEZOQ-JRKPZEMJSA-N 389.286 5.053 30 20 GKED N#C[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1nc(-c2ccccc2)cs1 505755521 FVVOUWSMUFEJMA-HNNXBMFYSA-N 388.279 5.363 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)sc1Cl)c1cccc(C(F)(F)F)c1 505980380 AVTNUMAIZGSWGV-SNVBAGLBSA-N 379.190 5.068 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)CC1 508494065 CZJIDMXBXAQGFQ-HSZRJFAPSA-N 383.495 5.264 30 20 GKED CC(C)COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 515542493 QAKBNXYBSWHAKJ-IBGZPJMESA-N 376.481 5.335 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 517456256 HNRYGWCYADAIDW-WMZOPIPTSA-N 396.556 5.776 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ncc(-c3ccccc3)s2)c1 518958099 NWCSKYCAZXSWGY-UHFFFAOYSA-N 378.457 5.137 30 20 GKED C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 520326182 QLMRBVKUSUOPIO-SFHVURJKSA-N 399.494 5.232 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521092136 JRFGNOQKLDSJPB-SFHVURJKSA-N 397.478 5.186 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(C(C)(C)C)cc1 521261703 WWFUAKYGMGXSLF-KRWDZBQOSA-N 395.572 5.900 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C1CC1 521598877 JQEZMIABTMGNDL-HNNXBMFYSA-N 390.414 5.448 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)[C@@H](C)Oc3ccccc3C#N)c2)C1 521670820 YZHHYSFDSXETFA-HMFYCAOWSA-N 392.499 5.060 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccccc3SC[C@H](C)C#N)coc2c1C 521726993 QYLJJGOUHORMFO-CQSZACIVSA-N 378.497 5.483 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3cccc(Cl)c3Cl)o2)cc1 524138382 MPBHPXJFNRAULE-UHFFFAOYSA-N 387.222 5.289 30 20 GKED Cc1cnc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 525221641 KWPGESUVCLDWLC-UHFFFAOYSA-N 398.875 5.091 30 20 GKED C=C(C)[C@H](CC(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)OCC 535154352 WEUVPROZYXSKRT-GUYCJALGSA-N 392.952 5.320 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2CCC(F)(F)CC2)cc1Cl 536157996 NNIXINBKACBDSS-GOSISDBHSA-N 388.845 5.759 30 20 GKED CCN(C(=O)c1ccc(Sc2ccccn2)cc1)c1ccc(C#N)c(Cl)c1 539173941 KTKDMUMPTFHNNC-UHFFFAOYSA-N 393.899 5.425 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc(OC(F)F)c(F)c2)cc1 540203225 OKPLNUFVILVAAK-UHFFFAOYSA-N 382.385 5.256 30 20 GKED C[C@@H](N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(C#N)c(F)c1 540710424 SMOCRJZVBHVPMY-QRQCRPRQSA-N 379.866 5.380 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)s2)o1 542865295 ILWOSKJBZXPSCY-AWEZNQCLSA-N 382.510 5.963 30 20 GKED C[C@H](N[C@@H](C)c1cn(-c2ccccc2)nn1)c1ccc(-c2cccc(C#N)c2)cc1 542934934 XSTKXAPIKUYUDX-OALUTQOASA-N 393.494 5.218 30 20 GKED N#CCc1ccnc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 546634897 JUKLBPBEGNNETI-UHFFFAOYSA-N 394.818 5.114 30 20 GKED CO[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 549779114 TWUVQCFLZBYPHL-QKNQBKEWSA-N 382.891 5.139 30 20 GKED Cc1cccc2[nH]cc(CC(=O)N(Cc3ccccc3)c3ccccc3C#N)c12 551993986 MPTQJBRIFCSQNC-UHFFFAOYSA-N 379.463 5.124 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C(C)(C)c1ccc(Cl)cc1F 557609907 RPGFBTPFUVJJBK-UHFFFAOYSA-N 391.918 5.139 30 20 GKED CC(C)c1ccccc1OC[C@H](O)CNc1ccccc1S[C@@H](C)CC#N 563881594 DJDXVNVFDGBYFI-ZWKOTPCHSA-N 384.545 5.056 30 20 GKED COc1cc(NCc2ccc(C#N)cc2C(F)(F)F)cc(OC)c1C(C)C 564411427 TWHBZDMLWRUXGF-UHFFFAOYSA-N 378.394 5.330 30 20 GKED CC1(C)CCCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)[C@H]1C#N 570034483 QLCPQRQDSNIMDP-FQEVSTJZSA-N 381.907 5.106 30 20 GKED C[C@](C#N)(NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C1CCCCC1 578164379 AWFDQXWFOHZAEZ-HSZRJFAPSA-N 391.446 5.082 30 20 GKED CN(C(=O)Cc1cccc(C#N)c1)[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 583060157 JXYKBDOONWMTBP-HSZRJFAPSA-N 392.861 5.141 30 20 GKED COc1ncc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1Cl 585765065 CXHUCCRXPGRHSZ-OAHLLOKOSA-N 377.875 5.133 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1 591773951 HYUBTTWGOBRVRC-YOEHRIQHSA-N 394.462 5.115 30 20 GKED C[C@@H](NCc1ccc(O[C@@H]2CCOC2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 594942423 IFXNBJUKVIXXBU-NIYFSFCBSA-N 398.506 5.244 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3cc[nH]c3c2)cc1Cl 603962383 SPFHZSMIONFPSY-HXUWFJFHSA-N 385.854 5.729 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1 603968967 PVBRWTSRJPNBBL-ZFWWWQNUSA-N 378.419 5.594 30 20 GKED Cc1cccc(COc2ccc([C@@H](C)NC(=O)NCc3ccc(C#N)cc3)cc2)c1 609042880 DVPSGNRSBHFYEP-LJQANCHMSA-N 399.494 5.006 30 20 GKED N#C[C@@H](NC(=O)C1CC(c2cccc(F)c2)C1)c1cccc(Cl)c1Cl 609414083 GLHNSKCXVNNRAR-QWQCLYJRSA-N 377.246 5.007 30 20 GKED Cc1cc(Oc2ccccc2)ccc1NC(=O)c1cc2ccccc2n1CC#N 609445309 PTVHFCOUGFJKED-UHFFFAOYSA-N 381.435 5.518 30 20 GKED C[C@H](Nc1cccc(CSC2CCCC2)c1)C(=O)Nc1ccccc1C#N 610139734 BOTQBHWZJBQUHL-INIZCTEOSA-N 379.529 5.173 30 20 GKED CCN(C(=O)c1sc2ccc(OC)cc2c1C)[C@H](C)c1ccc(C#N)cc1 610226925 SESYKPUSXFAYGC-OAHLLOKOSA-N 378.497 5.313 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@H](c2cc3ccccc3[nH]2)C1)c1ccccc1 610972575 KCFCSVXDOCLUFD-LEWJYISDSA-N 386.499 5.102 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCCSc2ccc(Cl)cc2)c(Cl)c1 611093025 ZRRHDIGFGLEFEF-UHFFFAOYSA-N 385.703 5.041 30 20 GKED Cc1ccccc1-c1noc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)n1 611807228 XJTSQSJBAMLFLZ-GOSISDBHSA-N 394.478 5.435 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)C2)c1 612298515 AFXFFQRHOCCIEB-FQEVSTJZSA-N 398.466 5.075 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(N[C@H](C)c2cc(C)c(OC)cc2C)cc1 630061812 XHOLJYNNVDVHDT-LJQANCHMSA-N 378.516 5.299 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCc2cc(OC)ccc2C1 682777104 CXPKRBTXVYWEAJ-FQEVSTJZSA-N 378.516 5.226 30 20 GKED COc1cccc(NN=Cc2cccc(NC(=O)c3ccccc3Cl)c2)c1 725853207 NVRSQVCZVUJOHP-UHFFFAOYSA-N 379.847 5.047 30 20 GKED CCn1nc(C)c(C(=O)/C=C\C2=Cc3cc(Cl)cc(Cl)c3OC2)c1C 726741033 RZCMYHFZPZWJEH-WAYWQWQTSA-N 377.271 5.042 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCCc3ccccc3C2)cc1 730378941 AGEFLVDEKWGSAC-XMMPIXPASA-N 381.479 5.322 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730417271 LXLFXCQQJQQAOX-CXAGYDPISA-N 396.487 5.377 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@@H](C#N)c1cccc(Cl)c1Cl 731195457 HJCIBHOMXUJLBY-LBPRGKRZSA-N 392.267 5.013 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCc2cccc(F)c2)cc1 731753119 XNKWMKIVBYBJSD-QHCPKHFHSA-N 387.458 5.235 30 20 GKED C#CC[C@H](OC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1ccccn1 733692224 BPRBYLLCYGBIDE-JEZWAEDTSA-N 379.765 5.075 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(-c3cccs3)c2)c1 733843859 BOHGXMDOGDCQDW-IBGZPJMESA-N 391.496 5.418 30 20 GKED CC(C)[C@H](CC1CCCCC1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 734706441 HTAFQUICAIQDHM-DLBZAZTESA-N 387.474 5.850 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1cc([N+](=O)[O-])ccc1Cl 735506731 KMSOOVDDXZVGSY-UHFFFAOYSA-N 383.256 5.237 30 20 GKED C=C(C)CN1C(=O)/C(=C/c2ccc(-c3ccccc3OC)cc2)SC1=S 743282692 QJHBMXJIUMXHIC-UNOMPAQXSA-N 381.522 5.140 30 20 GKED Cc1cc(-c2noc([C@@H](C)ON=Cc3ccccc3OC(C)C)n2)ccc1F 744444467 WZYIAHQWPXGJJN-OAHLLOKOSA-N 383.423 5.083 30 20 GKED COc1ccc([C@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 746659628 MOYMFHILKFSSTR-GAJHUEQPSA-N 385.467 5.233 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Oc2ccc(Oc3ccc(C#N)cc3)cc2)s1 748684046 UDDPTIIVALDLGY-AWEZNQCLSA-N 394.452 5.124 30 20 GKED N#C[C@@H](C(=O)CC1CCCCCC1)C(=O)Nc1ccc(SC(F)F)cc1 750683971 KLCVIRJKGAMRJW-INIZCTEOSA-N 380.460 5.009 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1ccc(Cl)c([N+](=O)[O-])c1 751513894 TYSQYNFYIHZHRI-GQCTYLIASA-N 376.846 5.329 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(SC(F)F)cc1 752616460 TYOCZSQNJGZOPI-ZWKOTPCHSA-N 387.455 5.305 30 20 GKED C#CC[C@@H](NC(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 757881185 RHISZVGQAGLTPS-HSZRJFAPSA-N 397.478 5.133 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 766408365 DLRMAWPRXGYWHF-HSZRJFAPSA-N 398.462 5.168 30 20 GKED C#CC[C@@H](NCc1csc(-c2ccc(Br)cc2)n1)c1ccccc1 775398778 LTEKFGKECCQHGR-LJQANCHMSA-N 397.341 5.427 30 20 GKED C[C@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccn1)c1ccc(OCC#N)cc1 776171881 QWFKJZOFILXVKL-GAJHUEQPSA-N 391.902 5.272 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2cccnc2)c2cc3ccccc3o2)c1 779411734 HIXQYOQEZSKVSU-PXDATVDWSA-N 397.478 5.388 30 20 GKED N#CCOc1cccc(NCc2cn(-c3ccccc3)nc2-c2cccs2)c1 779588327 KSHMZQVMRRYMCF-UHFFFAOYSA-N 386.480 5.115 30 20 GKED CCc1c(C(=O)/C=C\c2cnc(-c3ccccc3OC)nc2)oc2ccccc12 792870557 ROAMLRBJBGQRSG-SEYXRHQNSA-N 384.435 5.357 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)c2sc(-c3ccccc3)nc2C(F)F)CC1 809089671 LVXVQRFDUGZYOI-BETUJISGSA-N 376.428 5.234 30 20 GKED C=CCCCCCCCNC(=O)N(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1 812493258 CHPFLEDGVIKSNP-LEWJYISDSA-N 376.516 5.214 30 20 GKED CC(C)c1cnc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)s1 814747948 AHHBELPJPIPUIZ-UHFFFAOYSA-N 398.344 5.003 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CC3(CCC3)[C@H]2c2ccco2)c1=S 840139792 KVMWRBCTULRENN-QGZVFWFLSA-N 398.557 5.106 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)C(F)(F)F 860478196 RPRIBKGXVHXKHK-CBAPKCEASA-N 380.313 5.080 30 20 GKED Cc1[nH]c2c(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cccc2c1C 915085190 IGERLSNWMOUKGL-HSZRJFAPSA-N 379.463 5.693 30 20 GKED O=C1/C(=C/c2csc(-c3ccsc3)n2)CCc2[nH]c3ccc(F)cc3c21 920066174 TVLBTSWBZJWUII-YRNVUSSQSA-N 380.469 5.705 30 20 GKED C=CCCO[C@H](C)C(=O)Oc1ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc1 921149578 VLQRBXXFDVXXFA-QGZVFWFLSA-N 395.499 5.123 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc2nc(C(C)C)sc2c1 921155353 LPNCLBMGFOUFPP-UHFFFAOYSA-N 390.468 5.236 30 20 GKED C[C@H]1CCC[C@H](CCN(Cc2ccc(C#N)cc2)c2ccc3nc(O)[nH]c3c2)C1 1307546022 KUOSDWLWGGENTR-ZWKOTPCHSA-N 388.515 5.363 30 20 GKED N#Cc1ccc(CN(Cc2ccc(Cl)s2)c2ccc3nc(O)[nH]c3c2)cc1 1644837771 RVFSRZQNSXLHAI-UHFFFAOYSA-N 394.887 5.062 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(C)c1ccc(Cl)c(Cl)c1Cl 1776049817 KTKVTTOJJHNAAB-UHFFFAOYSA-N 387.650 5.190 30 20 GKED O=C(O)c1ccc(NN=C(Cc2ccccc2F)Cc2ccccc2F)cc1F 1776074316 TZILPZSAROEOIF-UHFFFAOYSA-N 398.384 5.055 30 20 GKED C=CCCC[C@@H](NCc1cc(C(C)(C)OCc2ccccc2)ccc1F)C(=O)O 1776170834 CMLWFBNDEAUIRG-JOCHJYFZSA-N 399.506 5.177 30 20 GKED C=CCCC[C@@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 1776171440 ZZEUQXQMHGRVND-HXUWFJFHSA-N 391.870 5.479 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 1776354835 AALAVXSSTMYTIH-MDZDMXLPSA-N 393.464 5.192 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2cncc(C(=O)O)c2)cc1 1776785619 TXCGVTCWLWGVRG-RAXLEYEMSA-N 381.472 5.415 30 20 GKED CCCCCCCOc1ccc(/C=C\c2cc(C(=O)O)ncn2)cc1OCC 1776785847 AGSQRPIKZJXJPG-LUAWRHEFSA-N 384.476 5.093 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)c1cccc(O[C@H](C)C(=O)O)c1 1776807986 OHRIELQWYKPCDK-OMACXJQVSA-N 392.451 5.523 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)c1 1777686171 UHUQFVVVDJQPGE-CSKARUKUSA-N 375.405 5.151 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)N(C)Cc3cccc(C#N)c3)cs2)cc1 25105388 AIFGFQQQBNXJHG-UHFFFAOYSA-N 375.497 5.077 30 20 GKED C[C@H](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 31436195 UOXPKQPGUZAHLH-JTQLQIEISA-N 386.295 5.087 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2ccc(C)cc2C)cs1 54897272 CFZVEHMRLNXQPS-WQLSENKSSA-N 390.508 5.649 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 65680125 BIXNABZCTJRCDL-UHFFFAOYSA-N 394.883 5.978 30 20 GKED CC(C)Oc1ccc(NC(=O)N(C)Cc2cccc(C#N)c2)c(C(F)(F)F)c1 105059607 PPXSTDPUEMYXLQ-UHFFFAOYSA-N 391.393 5.028 30 20 GKED CCCO[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)CC1 119622436 CGPAOJQFSPNSNJ-NRFANRHFSA-N 392.499 5.080 30 20 GKED COc1ccc(CNc2cccc(-c3nc(C)c(C)o3)c2)cc1OCCCC#N 121507292 LXGYZTGEHKBRKE-UHFFFAOYSA-N 391.471 5.262 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 123392562 LVGOJPKXXQOPJF-UHFFFAOYSA-N 379.419 5.441 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2C[C@H](C)Sc3sccc32)ccc1OC 180816836 NEZHFOTUGJCLML-LXZKKBNFSA-N 388.558 5.153 30 20 GKED COc1cccc(-c2ccc(CNCc3ccc(N(C)CCC#N)cc3)cc2)c1 237342985 WUAVHLNOJXDQCO-UHFFFAOYSA-N 385.511 5.002 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(F)cc1OCC1CC1 303803416 HDGSHEDMRKMOGM-UHFFFAOYSA-N 386.426 5.405 30 20 GKED CC1(C)CCc2ccccc2[C@H](/N=C(/O)[C@H]2CCS(=O)(=O)c3ccccc32)C1 328845957 AJVJFHUUVDRHNZ-VQTJNVASSA-N 397.540 5.008 30 20 GKED O/C(=N/Cc1cccc(C/N=C(/O)[C@@H]2CCCCS2)c1)[C@@H]1CCCCS1 329258083 ABHLBIOIWSJURQ-ROUUACIJSA-N 392.590 5.171 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2/N=C(/O)c2ccc3c(c2)N=C(O)CCS3)cc1 329972238 XZKRELFEDVYVKO-UTKZUKDTSA-N 396.512 5.304 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2c(F)ccc(Br)c2F)s1 411008743 UNOQYHBKKIMIAX-UHFFFAOYSA-N 399.260 5.210 30 20 GKED CC1(C)CCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 429042295 DKPIXHQTBQXTSG-OAQYLSRUSA-N 377.488 5.032 30 20 GKED COC(=O)c1cc([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)oc1C 431120541 NNCXPEIBNDSGKH-HOTGVXAUSA-N 388.467 5.325 30 20 GKED N#Cc1ccc(Sc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1C(F)(F)F 436327907 HRTDHYWCNCQNAZ-UHFFFAOYSA-N 393.268 5.050 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@H](C(C)C)C1 437839136 LYJMETUWHRWTNU-NRFANRHFSA-N 395.528 5.264 30 20 GKED CC(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] 439660151 IFQWDALCDHQQCP-QGZVFWFLSA-N 391.452 5.332 30 20 GKED CCN(C(=O)CC(C)(C)CC(=O)c1ccccc1)[C@@H](C)c1ccc(C#N)cc1 441821065 MIEUPXCJZBOJCI-SFHVURJKSA-N 376.500 5.157 30 20 GKED Cc1cc(NC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)ccc1O 443610180 XDEGXNFPCUTSKN-UHFFFAOYSA-N 387.439 5.104 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2 443884421 VWLTVYSKIDPFCF-UHFFFAOYSA-N 392.455 5.175 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1nc(C(C)(C)C)cs1 445589839 YCQBTJWRWFSFKK-UHFFFAOYSA-N 384.574 5.101 30 20 GKED CC[C@@H](CC(F)F)C(=O)N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 457690536 DZOQNJBLMLDTAR-UFBFGSQYSA-N 377.275 5.106 30 20 GKED N#CCc1cccc(C(=O)N(CCSc2ccc(F)cc2)c2ccccc2)c1 460487361 GCSYRRNJRVWKDD-UHFFFAOYSA-N 390.483 5.331 30 20 GKED CC(C)(C#N)CCSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1 463035343 PCDJXTNURPIZBC-UHFFFAOYSA-N 397.931 5.130 30 20 GKED CCc1ccc(-c2ccc(C(=O)Nc3ccccc3SCCC#N)o2)cc1 463799943 YYFLNHIUXWMUJO-UHFFFAOYSA-N 376.481 5.767 30 20 GKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 467609739 BNTGBTDNQADCSX-QKYXUNIQSA-N 381.907 5.648 30 20 GKED CC[C@@H]1[C@H](C)CCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 480657153 DBESKJUJDDXVDV-OPAMFIHVSA-N 377.488 5.098 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Br)c1cccc(C(F)(F)F)c1 481214334 UXMISIJPNKMIPO-NSHDSACASA-N 383.211 5.190 30 20 GKED N#C[C@@H](C(=O)c1cccc(Oc2ccc(Cl)cc2)c1)c1cnc2ccccc2n1 483230518 MDWOMNBYRDFSNF-LJQANCHMSA-N 399.837 5.566 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCC(c2nc3cc(Cl)ccc3o2)CC1 487436481 ZUXSAAGCUNQGJM-UHFFFAOYSA-N 393.918 5.662 30 20 GKED COc1cccc([C@@H](NCc2cc(C#N)ccc2F)c2ccccc2Cl)c1 494021321 VFPUCSKREUVVEQ-JOCHJYFZSA-N 380.850 5.239 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](c2cccc(F)c2)c2ccccn2)c1 499580220 TWOSQTSPPJYIMQ-JOCHJYFZSA-N 391.446 5.087 30 20 GKED Cc1ccc(SCC(=O)N(Cc2ccco2)c2ccccc2C#N)c(C)c1 501019084 PLGPEMRZGPIMCK-UHFFFAOYSA-N 376.481 5.094 30 20 GKED O=C(CC1(C(F)(F)F)CC1)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 503952636 OIRGKOHGCIAHOT-NSHDSACASA-N 393.249 5.158 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCCc1cccc(Cl)c1Cl 506184968 VTKFKKSUXFGKDX-UHFFFAOYSA-N 390.314 5.029 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1 507765499 DODFZUWYVVTTNV-KXBFYZLASA-N 393.487 5.258 30 20 GKED COc1ccc(CN2CCC[C@H]2/C=C\c2ccccc2)cc1OCCCC#N 507875246 MWRCMOPDBCEPQH-YLQXFRFJSA-N 376.500 5.056 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cccc(OC(C)C)c1 519896976 NHUJEGYDGACIJR-IBGZPJMESA-N 393.531 5.274 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)NCc1cccc(OCCCC#N)c1 520236613 KJPXEBROULIACN-INIZCTEOSA-N 376.422 5.109 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OCc2ccccc2)cc1 520598445 MFSVROAYWDRRMW-UHFFFAOYSA-N 399.494 5.581 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 523122099 IKDJMDFORBYUSH-UHFFFAOYSA-N 392.462 5.002 30 20 GKED C=C(C)COc1cc(CNC2(c3ccc(OC)cc3)CCCC2)ccc1OC 523839922 FBDLELNWIPIHME-UHFFFAOYSA-N 381.516 5.218 30 20 GKED Cc1ccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c(Cl)c1 524493460 RSMUIXILRQSQPG-UHFFFAOYSA-N 376.843 5.351 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@H]1COc2ccccc21 532849678 RDZIHFCIFMUSBS-HRAATJIYSA-N 399.450 5.037 30 20 GKED COc1cccc([C@@H](C)C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)c1 536940907 LSYCAEADCMQGHR-CQSZACIVSA-N 388.492 5.136 30 20 GKED C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 554204820 HPPSQXXYHFDASD-UEXGIBASSA-N 393.556 5.943 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1 554442690 OGCZDNZFLWBHKN-UWVAXJGDSA-N 379.529 5.696 30 20 GKED CC(C)[C@H](NC(=O)N1CCC(CCC#N)CC1)c1ccc(C(F)(F)F)cc1 563041882 JNMOJZCWZHLTGW-SFHVURJKSA-N 381.442 5.128 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@@H]1CCc2ccccc21 596735345 YDBKRJLVIUMDKJ-WMZOPIPTSA-N 379.529 5.132 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)CC1(C#N)CCCCC1 596810961 BZTMVZXKMAGFRM-UHFFFAOYSA-N 375.472 5.050 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 608920658 XKCKMURHIQBONM-OAQYLSRUSA-N 379.504 5.028 30 20 GKED Cc1cc(C)c(NC(=O)CNc2cccc(Oc3ccc(C#N)cc3)c2)c(C)c1 609220648 DTDXVUKHBKTZQC-UHFFFAOYSA-N 385.467 5.326 30 20 GKED N#Cc1ccccc1-c1ccc(CSCc2nc3ccccc3c(=N)[nH]2)cc1 609236156 YDROKHQBOKXFLL-UHFFFAOYSA-N 382.492 5.014 30 20 GKED CSc1cccc([C@@H](NCc2cccc(C#N)c2)c2ccc(F)c(F)c2)c1 610271598 MAMJEIBJYWWLSE-JOCHJYFZSA-N 380.463 5.438 30 20 GKED N#Cc1cnc2c(F)ccc(F)c2c1N1CC[C@H](CSc2ccccc2)C1 610282531 RXDNLRAOOKCBFH-AWEZNQCLSA-N 381.451 5.003 30 20 GKED C[C@@H](NC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 610357344 KZNPIVOTLXPQRQ-OPAMFIHVSA-N 389.886 5.361 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2OC)n1)c1ccc(C#N)c(Cl)c1 611359414 OTHKAWVFVFZVEI-UHFFFAOYSA-N 397.887 5.010 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 611561770 LBMNEFZDKKVQIE-WMLDXEAASA-N 387.405 5.105 30 20 GKED Cc1ncncc1[C@@H](C)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 655779595 OKNJHFTZFICHGQ-SNVBAGLBSA-N 381.295 5.248 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)s2)c(C)c1 673813618 DXAAKDRYQRRSIN-HNNXBMFYSA-N 381.526 5.497 30 20 GKED Cc1nc(-c2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 726448634 HXZPNLUYSINETQ-UHFFFAOYSA-N 384.917 5.453 30 20 GKED CSc1ccc2cc(CNc3ccccc3SCCC#N)c(Cl)nc2c1 731028027 FKNAVCNTQLSTKR-UHFFFAOYSA-N 399.972 6.228 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(CCc3ccccc3)C3CC3)cc2)cc1 731969122 IAFYJEIAPVDBDC-UHFFFAOYSA-N 396.490 5.392 30 20 GKED O=C1/C(=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCc2ccccc21 733081445 YQNLLOURRWYCDG-RVDMUPIBSA-N 376.437 5.321 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)N[C@H]2CCOc3ccccc32)c1 741484236 IZNOYIAUNWIIFS-QHCPKHFHSA-N 398.531 5.073 30 20 GKED CC(=NNc1cc(Cl)nc(C)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 741765978 LZSAYLFAWGKKRW-UHFFFAOYSA-N 396.722 5.312 30 20 GKED O=C(/C=C/c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1ccc2c(c1)COC2 742436757 NHAFJSDIPLHZCZ-SOFGYWHQSA-N 377.421 5.250 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)Cc1cccs1 743092973 IZDNYHUBSRKKDB-VGOFRKELSA-N 389.524 5.404 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@H](c2cccc(Cl)c2)C(C)C)c1 749389575 DZZNQWWGFHWFFZ-FPOVZHCZSA-N 384.907 5.077 30 20 GKED Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 753935890 BHIFPYZDLBNNSN-HHXXYDBFSA-N 387.508 5.371 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 756517093 LYSUPHJDZMUENM-WKOYGUFESA-N 378.884 5.743 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 757739761 BULZYWNDTXXXAU-HXUWFJFHSA-N 396.491 5.240 30 20 GKED N#Cc1c(NC(=O)/C=C/c2ccc(Cl)nc2)sc2c1-c1ccccc1CC2 759842526 AHKSUPCHEATSFB-UXBLZVDNSA-N 391.883 5.086 30 20 GKED N#Cc1c(F)ccc(/C=C/C(=O)c2cc(Br)ccc2F)c1Cl 761478390 FMNUZGOOAWHFGI-QHHAFSJGSA-N 382.591 5.148 30 20 GKED C[C@H](Oc1ccccc1C#N)c1nc(-c2ccc(SC(C)(C)C)cn2)no1 762404755 MPRNZFAQOCCXPR-ZDUSSCGKSA-N 380.473 5.034 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)Nc2ccccc2O[C@H](C)C#N)c(C)c1 780535723 XGEKOIDOUZPWNY-CVEARBPZSA-N 383.517 5.821 30 20 GKED Cc1cccc(C)c1NC(=S)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782204169 KAUNMDAKLHSYHJ-GOSISDBHSA-N 385.536 5.890 30 20 GKED COc1cccc(/C=C/C(=O)c2cc(Br)cs2)c1OC(F)F 782370543 VPPHIPNSLLQXTC-AATRIKPKSA-N 389.217 5.017 30 20 GKED C[C@@H](NCc1ccc(C#N)cc1)c1ccc(Br)cc1C(F)(F)F 790678244 SHQIDRZBPXCNMR-LLVKDONJSA-N 383.211 5.190 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 793122609 STJDSPHIAFCKIP-ZBFHGGJFSA-N 386.373 5.292 30 20 GKED CC(C)(COCc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 800387056 PWHMFMKAKGPXFI-INIZCTEOSA-N 398.915 5.369 30 20 GKED COc1cnc2ccccc2c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 801660426 FWWUSXNRKDJSPA-OAQYLSRUSA-N 393.446 5.151 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)CCCCCC#N)c2ccccc2)c1 805695882 MTASWKJOLJCSAN-QFIPXVFZSA-N 378.472 5.001 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)sc2cc(F)ccc12 805865921 DRGFZLRNQYSFTI-HNNXBMFYSA-N 393.468 5.357 30 20 GKED C#C[C@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccc(Cl)cc1 810195143 YWEDPKORBNOOHB-SFHVURJKSA-N 379.847 5.108 30 20 GKED Cc1cc(NC(=O)CCCCCC#N)c(C(=O)N[C@@H](C)c2ccccc2)cc1F 813285194 MBYLGURHUKQEGN-KRWDZBQOSA-N 395.478 5.038 30 20 GKED C/C(=C/C(=O)N[C@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 817318729 HARNWJBTCVQRBW-OAXWQBPPSA-N 384.426 5.243 30 20 GKED C[C@H](NCc1ccc(C2(C#N)CC2)cc1)c1ccc(C(F)(F)F)nc1Cl 862378640 FDRJNCSDCCXZMO-LBPRGKRZSA-N 379.813 5.160 30 20 GKED COc1cccc(/C=C\C(=O)c2ccc(Br)s2)c1OC(C)C 916134630 UOXUOEDMHRKPAH-FPLPWBNLSA-N 381.291 5.203 30 20 GKED COc1ccc(-c2csc3ncnc(NN=Cc4c(F)cccc4F)c23)cc1 916357419 PKAXNITYVIHTCR-UHFFFAOYSA-N 396.422 5.091 30 20 GKED O=C(/C=C\c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccc(F)c(F)c1 1776125337 FIKDHBYTMWVXKX-REBWPMHBSA-N 394.373 5.066 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1scc(Cl)c1Cl 1776355095 LHDIPJAATYTGOY-XQRVVYSFSA-N 385.268 5.436 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Br)c(Cl)s1 1776783783 KMPXCTDIMXMSGR-NSHDSACASA-N 396.778 5.457 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2cccc(O[C@H](C)C(=O)O)c2)cc1 1776788932 JBNIPVIEMUSTCQ-NKAIQICCSA-N 396.483 5.394 30 20 GKED N#CCSc1ccccc1NC(=O)CSc1cccc(C(F)(F)F)c1 5078124 BEHRNGZJSPTGKO-UHFFFAOYSA-N 382.432 5.052 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N2CCCCCCC2)cc1 48161440 CCHVBTIHAFKVJL-UHFFFAOYSA-N 377.488 5.130 30 20 GKED C[C@H](NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1 71919990 ZQAYERMWXDRHMN-SFHVURJKSA-N 385.467 5.214 30 20 GKED CCOc1ccc(SCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 108146932 XRFJBVMRQKOHEM-OAHLLOKOSA-N 386.542 5.210 30 20 GKED CCCCOc1ccc(/C=C/C(=O)c2ccc(OCc3nccn3C)cc2)cc1 108308954 OLPPTAGSZRZZNC-VGOFMYFVSA-N 390.483 5.074 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 131131917 STFBEDMHMPYTEB-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCCCN(C)C(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 135086503 GFFXNQUYQJSWFR-UHFFFAOYSA-N 394.899 5.140 30 20 GKED C[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccs1 152226494 YPBKMLUBPWBCDN-MRXNPFEDSA-N 376.481 5.135 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1OC(F)F 175982590 HHEGQYSCZXUVTN-BCNIOPEESA-N 376.428 5.148 30 20 GKED CO[C@H](C)c1nc(C)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 176148765 JEQZMWKMNWMDNS-CQSZACIVSA-N 393.468 5.075 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cn2cc(Cl)cc(Cl)c2n1 177236757 BSRSYWZFXDRXQV-GFCCVEGCSA-N 391.327 5.647 30 20 GKED N#CC1(NC(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)CCSCC1 180482259 KWMFIEPGNNYYRI-UHFFFAOYSA-N 388.945 5.010 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(F)F)cc1 183846524 SWLQIRSYMSLWPF-CYBMUJFWSA-N 375.444 5.340 30 20 GKED COc1ccc(CN[C@H]2CCc3ccc(C(C)C)cc32)cc1OCCCC#N 189615999 MRWWGJHWNWSXPE-QFIPXVFZSA-N 378.516 5.278 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1C[C@@H]1c1cc(OC)ccc1OC 189908389 NSGBCIVCPCBLIG-CTNGQTDRSA-N 379.500 5.298 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1c(-c2ccc(C(F)(F)F)cc2)noc1C 190679085 HRQKFLACNDSKSI-UHFFFAOYSA-N 385.345 5.101 30 20 GKED COc1ccccc1-c1csc(C2CCN(CC(C)(C)CCC#N)CC2)n1 191836462 PMKXBPYQGNACQM-UHFFFAOYSA-N 383.561 5.328 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccccc2)c2ccccc2OC)cc1OC 237344350 UCNLWVOUGYCACW-VWLOTQADSA-N 389.495 5.148 30 20 GKED N#CCc1ccc(NCc2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 237836065 RMGLXUGCZIKJMU-UHFFFAOYSA-N 378.479 5.277 30 20 GKED OC(=Nc1cc2c(cc1Cl)OCCCO2)N1CCCC[C@@H]1c1ccccc1 329629713 VEHYCEHQMQOODJ-GOSISDBHSA-N 386.879 5.274 30 20 GKED Cc1cc(C2CC2)nc(N=C(O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)n1 329773101 LGXWSJJCWYOYOO-NFAYLAGKSA-N 379.426 5.399 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(Cl)cc1OCC(F)F 425672983 MEVZLPLSLAMIFC-LBPRGKRZSA-N 393.821 5.080 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 425677745 FQSADZQUCSORHU-AWEZNQCLSA-N 389.421 5.623 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2cc(C#N)ccc2C)ccc1Br 432009373 VCICMSWULNWOHN-LJQANCHMSA-N 398.304 5.307 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@H]1c1ccncc1 433135781 OJHXSWDIEZGDMN-QFIPXVFZSA-N 398.466 5.361 30 20 GKED C[C@@H](SCc1ncc(-c2ccccc2Br)o1)c1ccc(C#N)cc1 437278869 VKUFONZKEQXYMK-CYBMUJFWSA-N 399.313 5.970 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 439121686 ZNGHKXDTAWBCQV-UHFFFAOYSA-N 389.842 5.025 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(Cl)c(Cl)cc1F 439967891 PLEHLSOZCFWVIA-UGSOOPFHSA-N 392.261 5.436 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3ccc(C(F)(F)F)cn3)o2)cc1 442608031 IXAHWMIEGYDSJK-INIZCTEOSA-N 384.357 5.413 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ccc(F)c(F)c1 460179076 XGBZUPPXSKFSBM-HNNXBMFYSA-N 392.405 5.158 30 20 GKED CC(C)Oc1ccc(C#N)cc1N[C@H](C)c1nc(Cc2ccc(Cl)cc2)no1 463940254 ZZNRONOOAOZOQZ-CQSZACIVSA-N 396.878 5.146 30 20 GKED CCCc1ccccc1NC(=O)c1cn(CCC#N)nc1-c1ccc(C)c(C)c1 465460205 QXMVSVFSRFMHFJ-UHFFFAOYSA-N 386.499 5.285 30 20 GKED N#Cc1cccc(-c2nnc(CNc3cc(Cl)ccc3OCC3CCC3)o2)c1 466857551 LKTRSHUECYFKIZ-UHFFFAOYSA-N 394.862 5.053 30 20 GKED C=CCN(C(=O)C[C@H](OCC)C1=CCCC1)c1nc(-c2ccccc2)cs1 467099337 FAXJPAQJAHBTNO-FQEVSTJZSA-N 382.529 5.235 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 467449202 ILSXBVJBSGIMQZ-OAQYLSRUSA-N 393.849 5.456 30 20 GKED C=CCC[C@@H](N[C@@H](C)c1cnn(C(C)C)c1C)c1ccc(C(F)(F)F)cc1 469182473 QIUPFUXWVFNJRZ-MGPUTAFESA-N 379.470 6.149 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCC[C@@H](C)c1cccc(OC)c1 469338246 UXJMIHQLXIOEIE-LJQANCHMSA-N 376.500 5.055 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1 475548237 NRCGMAJHTFKKBT-SFHVURJKSA-N 388.515 5.607 30 20 GKED C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1 480208987 XZXCOXOAQNMTSR-PISWEHOVSA-N 396.490 5.118 30 20 GKED N#C[C@@H](C(=O)c1sc2cc(Cl)ccc2c1Cl)c1cnc2ccccc2n1 483232457 JVUKHTBSIQVSQX-GFCCVEGCSA-N 398.274 5.641 30 20 GKED CCc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cnn1C(CC)CC 485514623 CPXRYNXVASMKFB-HNNXBMFYSA-N 384.549 5.311 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)Nc1ccccc1SCCC#N 497688741 PMMNIWWXALNYLN-MRXNPFEDSA-N 375.497 5.058 30 20 GKED N#Cc1ccc(C2=CCN(Cc3coc(-c4cccc(Cl)c4)n3)CC2)cc1 502531594 QCGOCRZBFKYXMB-UHFFFAOYSA-N 375.859 5.156 30 20 GKED N#Cc1c(NC(=O)c2ccc([C@H]3CCCOC3)cc2)sc2c1CCCCC2 502566760 CNKZFUCARPCYSX-KRWDZBQOSA-N 380.513 5.035 30 20 GKED CC(C)[C@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 513664328 TWRZHXQZKOLWAS-HTAPYJJXSA-N 378.472 5.130 30 20 GKED CC(C)[C@H]1C[C@@H](CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 513731034 QOMMROXELIZIOC-PGRDOPGGSA-N 378.472 5.130 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@@H]3c3ccsc3)s2)cc1 514511853 XIDSVWVIXWNCAG-GOSISDBHSA-N 394.525 5.036 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C(=O)c2ccccc2)c1 517124008 HMQFRHXPQDTILG-UHFFFAOYSA-N 397.478 5.232 30 20 GKED Cc1ccsc1CN(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 517196684 FKLGLCGXQNBIGZ-QGZVFWFLSA-N 389.524 5.498 30 20 GKED N#CCCCCNc1ncnc2scc(-c3ccc(Br)cc3)c12 521224057 MEGLPZSRISYFAA-UHFFFAOYSA-N 387.306 5.227 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1csc2ccccc12 521260126 WDXGVCFZLNOCTA-CQSZACIVSA-N 381.526 5.475 30 20 GKED C=CCN(C(=O)C[C@@H]1CCOc2ccccc21)c1nc(-c2ccccc2)cs1 524553098 DVPBPSVVTZJMDV-SFHVURJKSA-N 390.508 5.286 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)c(F)c1 526051267 IFSIDNNMXGPEOD-CQSZACIVSA-N 385.870 5.235 30 20 GKED CC1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCC(F)(F)CC1 528921577 YHWJTKQSQHQDIZ-CQSZACIVSA-N 394.874 5.855 30 20 GKED C=C[C@H](CC(=O)N(C)Cc1ccc(OC(F)F)c(OCC)c1)c1ccccc1 534652650 IUAMJYYCYKKNOA-QGZVFWFLSA-N 389.442 5.005 30 20 GKED N#C[C@H](C(=O)c1c(-n2cccc2)sc2c1CCC2)c1nc2ccccc2s1 534670446 KMDZUCBHKBJZHI-CQSZACIVSA-N 389.505 5.127 30 20 GKED C=CCN(C(=O)c1ccc(Cl)c(OC)c1)c1nc(-c2ccccc2)cs1 536209399 VASLMPVDMVSDED-UHFFFAOYSA-N 384.888 5.305 30 20 GKED C[C@@H](NC(=O)[C@@H](C)n1cnc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 541133113 QQOCEKJBFDUMQA-QZTJIDSGSA-N 394.478 5.013 30 20 GKED Cc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 541447410 YIUKUUVVDPXPJF-IEBWSBKVSA-N 379.529 5.268 30 20 GKED CC(=O)[C@H](C)CCCCC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542060182 BDUPLQZANPLXEM-MSOLQXFVSA-N 376.500 5.188 30 20 GKED N#CCC1CCN(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCCc3ccccc32)CC1 542853561 FZNNCZPVJSBZNX-RPWUZVMVSA-N 387.527 5.183 30 20 GKED C=C[C@H](Cc1nc(Cc2ccc(OCc3cccnc3)cc2)no1)c1ccccc1 544965544 KVCPXAXPIOQSPE-OAQYLSRUSA-N 397.478 5.147 30 20 GKED CN1CC[C@@H](NCc2ccc(-c3ccccc3C#N)cc2)C[C@H]1c1ccccc1 551087214 NDPQEJHVBQMAJH-RSXGOPAZSA-N 381.523 5.150 30 20 GKED N#Cc1c(NC(=O)c2csc(C(F)(F)F)n2)sc2c1CCCCCC2 551518871 OHIYWAHSOZPOLM-UHFFFAOYSA-N 385.436 5.006 30 20 GKED O=C(Nc1c(F)cccc1F)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 553267856 NHICNPPABBYTFA-CYBMUJFWSA-N 398.253 5.409 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)Nc1ccc(CC#N)cc1 562183571 ASZVFKNHZVWUDR-QGZVFWFLSA-N 375.497 5.609 30 20 GKED N#CC[C@@H](Cc1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1)c1ccccc1 576146757 HDUHQWHPFRJXMN-YJBOKZPZSA-N 389.352 5.387 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1Cc2ccccc2CO1 584250444 UHIZOOBVIOLNPP-UHFFFAOYSA-N 385.423 5.138 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Nc3ccc4oc(CO)cc4c3)cc2)cc1 590607054 PUAQIAYUZVQRSM-UHFFFAOYSA-N 399.406 5.233 30 20 GKED C[C@@H]1CCCCN1C(=O)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 593943977 HDEWZNVBKUZTGK-GOSISDBHSA-N 375.516 5.114 30 20 GKED C[C@@H](C#N)N(C(=O)c1oc2ccccc2c1CSc1cccs1)C1CC1 598872211 WLQQCVGFOOGGCZ-ZDUSSCGKSA-N 382.510 5.303 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(O[C@@H]2CC2(F)F)cc1 599410105 XMJOQUIFRYLIBB-FZKQIMNGSA-N 388.439 5.120 30 20 GKED Cc1cc(Br)ccc1[C@@H]1CCCN1C(=O)Nc1cccc(CC#N)c1 599796094 ZVQULUMAXIUYEX-IBGZPJMESA-N 398.304 5.193 30 20 GKED CCC[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(Cl)c(Cl)c1 604505980 TVXVJHLWNPCREH-IBGZPJMESA-N 390.314 5.548 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CNc3ccccc3Cl)c2)cc1 609176391 JREFAUQCKHKNMU-UHFFFAOYSA-N 377.831 5.055 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1Cl 609501226 AZYGRZOXENZRKJ-KGLIPLIRSA-N 375.255 5.006 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCC[C@H]1c1ccccc1 609555977 PAXVNMAMXVVTPV-NEWSRXKRSA-N 379.529 5.539 30 20 GKED CC(C)(C)n1cc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)cn1 609723982 QTIJAIRNASNPJB-UHFFFAOYSA-N 394.862 5.208 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N(C)C(=O)c3cccc(CC#N)c3)s2)cc1 610050821 LDMCUFHPDVPQLQ-KRWDZBQOSA-N 389.524 5.326 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 610095185 IAKNAACPEHEFNT-UHFFFAOYSA-N 391.515 5.656 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCc2cccc(F)c2)c1)c1cccc(C#N)c1 610321906 PTEBXDZSWGRADZ-MRXNPFEDSA-N 389.430 5.159 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)cs1 610347394 IUFWUHQROSJNGB-GJZGRUSLSA-N 390.512 5.112 30 20 GKED C[C@@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1cccc(C#N)c1 610408420 WSQOBLKDBIKJKL-JLTOFOAXSA-N 393.537 5.100 30 20 GKED CCn1c(C)cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 613319351 CSJGDMXKVJGWGX-QGZVFWFLSA-N 383.904 5.392 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 620314255 XFCHQGDVWUBZBK-CALCHBBNSA-N 392.446 5.081 30 20 GKED CCc1cccnc1NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 621929166 FHOSENUBGXCARY-UHFFFAOYSA-N 394.290 5.186 30 20 GKED C=CCc1cc(C(=O)N(C)[C@@H](C)c2cc3ccccc3o2)cc(OC)c1OC 641897664 GDMBZNSEABPFDU-HNNXBMFYSA-N 379.456 5.012 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)s1 642077264 VOEGFLMTIGBJHP-UHFFFAOYSA-N 392.455 5.117 30 20 GKED CC[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccn(C)n1 647323510 SOKPRDRPPDCWRE-GFCCVEGCSA-N 383.311 5.273 30 20 GKED COc1cc(C#N)ccc1OC(=O)[C@@H](Sc1ccccc1F)c1ccccc1 729945954 WUCMXIZPJWAOMV-NRFANRHFSA-N 393.439 5.145 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417811 SUDNNVKRJMNZRO-RISCZKNCSA-N 388.851 5.041 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C)cn2)cc1 733636508 QNJZRDFQJPOTPE-UHFFFAOYSA-N 387.483 5.445 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)C2CCCC2)c1 733805135 NSUZMRULZKITMP-GMAHTHKFSA-N 391.515 5.098 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1)c1ccncc1 734683208 JQXDASMXUAFNCM-GHTZIAJQSA-N 391.540 5.733 30 20 GKED Cc1cc(NCc2c(F)c(F)c(F)c(F)c2F)ccc1OCC(F)(F)F 738296753 KEMYJFUJJIUZLM-UHFFFAOYSA-N 385.254 5.244 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)/C=C\c3ccc4ccccc4n3)c2)s1 739591418 WFOFMYLAQSCIDO-RAXLEYEMSA-N 395.487 5.165 30 20 GKED CC(C)c1nn(C)c(Cl)c1CNCc1cccc(-c2ccc(C#N)s2)c1 740013723 JEJZHMDVWZDXDR-UHFFFAOYSA-N 384.936 5.087 30 20 GKED Cc1ccc([C@H]2CCCCN2CC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 741792646 CXADOYFKRWCGFD-UYAOXDASSA-N 389.524 5.008 30 20 GKED CC(=NNc1c(Cl)cc(Br)cc1Cl)c1cncc(F)c1 741844800 QGKHSDBTFAJHNO-UHFFFAOYSA-N 377.044 5.126 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@H](C)c1ccccc1C(F)(F)F 744016775 SSGFRZUKKLLPAN-WBMJQRKESA-N 398.384 5.190 30 20 GKED N#C[C@@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1nc2ccccc2o1 744038865 AZTRGQOGOIIHPH-SFTDATJTSA-N 380.447 5.421 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cnc3ccccc3c2C)cc1 749025431 FCXYSWYRZQCTBO-MGPUTAFESA-N 385.467 5.018 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)cc1C#N 753689399 YQJNLWQRTLAMKZ-VWLOTQADSA-N 397.453 5.133 30 20 GKED CC(C)c1sc(NC(=O)Cc2cccc(OCC#N)c2)nc1-c1ccccc1 760372633 ROQGACGNQMLWQN-UHFFFAOYSA-N 391.496 5.017 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@@H](c2cccc(Cl)c2)c2ccccn2)cc1 766598335 GMOAKFFVWDUGEL-HXOBKFHXSA-N 376.887 5.187 30 20 GKED N#Cc1cc(/C=C(\Br)c2ncc(-c3ccc(F)cc3)o2)ccc1F 770571889 YZWZKLKPPGSGNW-NVNXTCNLSA-N 387.183 5.384 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cccc2c(=O)c(C)c(-c3ccccc3)oc12 770729461 YZDSRYPAQSFCHP-UHFFFAOYSA-N 394.430 5.201 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)c1 772983185 GQFAIMBUBAJTLS-QFBILLFUSA-N 377.513 5.342 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C2CCC(C(F)(F)F)CC2)cc1 774051071 HKUKSTJNEMUQHD-VTCYXGNWSA-N 394.437 5.216 30 20 GKED C#CCCCCCC(=O)N(Cc1ccccc1)[C@@H](C)c1cccc(NC(C)=O)c1 779769269 VDYVLFYHSHMFNZ-FQEVSTJZSA-N 390.527 5.319 30 20 GKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(OC(F)F)cc1OC(F)F 782305538 JAFMOYKCTXHXCK-QHHAFSJGSA-N 391.320 5.334 30 20 GKED Sc1nnc([C@H]2CCCCO2)n1N=Cc1ccc(-c2ccc(Cl)cc2)cc1 789020920 PQIOCWJWQDVVGM-GOSISDBHSA-N 398.919 5.011 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@](C)(O)c1cccc(Cl)c1 789455439 LCJUOAHIOWPZMX-QFIPXVFZSA-N 386.923 5.221 30 20 GKED O=C(Nc1ccc(F)cc1OC(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801677398 LQWXKEVILSXVJM-ZDUSSCGKSA-N 381.247 5.095 30 20 GKED CC(C)(C(=O)OCc1ncc(-c2ccc(Cl)cc2)o1)c1cc(F)cc(C#N)c1 803925897 DSAZNJZHAVHZLC-UHFFFAOYSA-N 398.821 5.027 30 20 GKED Cc1nc(NC(=O)c2cc(F)c(C(F)(F)F)cc2F)sc1C(F)(F)F 808802034 FSTKOHGYFFQPDG-UHFFFAOYSA-N 390.255 5.020 30 20 GKED N#Cc1ccc(CNc2cccc(C3SCCS3)c2)c(C(F)(F)F)c1 810149135 YWDGLGHWKHZIGZ-UHFFFAOYSA-N 380.460 5.668 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc2ccccc12)c1nc(C2CC2)cs1 842937541 DNOSOROXXCHSTJ-GOSISDBHSA-N 376.481 5.209 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)c1sc2ccccc2c1Cl 896831686 OXTVRKWEOXEYMH-UHFFFAOYSA-N 378.236 5.308 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3[C@@H](C=C(C)C)C3(C)C)n2)cc1 920139384 SQKIDSNZYLXOIJ-LMMKCTJWSA-N 380.513 5.233 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=S)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1 920994347 QKUBNOIMFQRLNW-VGSWGCGISA-N 395.547 5.153 30 20 GKED O=C(O)c1cc(F)c(C=NNc2c(Cl)cc(Cl)cc2Cl)c(F)c1 1776014679 QYVFHXTVANHHOM-UHFFFAOYSA-N 379.577 5.069 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(O[C@@H](C)c2ccccc2)cc1 1776076093 VUKNLPKHVYSXEQ-INIZCTEOSA-N 392.430 5.500 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)cc1)c1ccccc1 1776469385 DHIMTPSQPXXLHU-SBNBMVPLSA-N 390.410 5.560 30 20 GKED Cc1cc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)ccc1C(F)(F)F 1777420924 PDLFRIQIQZPPPB-VMPITWQZSA-N 392.373 5.395 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cnc(-c3ccccc3F)s1)C2=O 1777682947 IEYLTUIDODCLNR-KAMYIIQDSA-N 393.439 5.250 30 20 GKED N#CCC[C@@H](C#N)CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1 15242232 IFBULMGMEOZPRR-HNNXBMFYSA-N 393.903 5.123 30 20 GKED C=CCn1c(SCc2ccc(Cl)nc2)nnc1-c1ccc(Cl)cc1 23382445 WAIRBPMCAGNRME-UHFFFAOYSA-N 377.300 5.125 30 20 GKED COc1ccc(-c2cc(NC(=O)c3cccc(C#N)c3)ccc2OC(F)F)cc1 45369832 CDIDHFBZCDOLFY-UHFFFAOYSA-N 394.377 5.088 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3cc[nH]c3c2)cc1 55823931 BHCYIBALHSLXAJ-UHFFFAOYSA-N 381.435 5.065 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cccc(Br)c1 60564951 LZWDKQHPBKKJCX-UHFFFAOYSA-N 399.741 5.062 30 20 GKED CCN(Cc1cccs1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 60675633 PRDHAKOTRJVSEX-UHFFFAOYSA-N 392.549 5.574 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(OCc3cccc(C#N)c3)cc2)n1 102778582 GJJDVENWAQLEJU-MRXNPFEDSA-N 376.460 5.036 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1Cl 123933999 AJVCURRSCFEDOD-MRXNPFEDSA-N 382.876 5.190 30 20 GKED Cc1ccc(C(=O)N(CCC#N)CC(C)(C)C)cc1NC(=O)Nc1ccccc1 126849404 JNBQQACDKVJGPO-UHFFFAOYSA-N 392.503 5.041 30 20 GKED C[C@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(C)(C)C#N 131155308 SOAUBOPJSPCHGW-OLZOCXBDSA-N 392.908 5.098 30 20 GKED N#C[C@@H](C(=O)C1CCC(F)(F)CC1)c1nc(-c2ccc(Cl)cc2)cs1 136725588 YALGKGLQAPMYES-AWEZNQCLSA-N 380.847 5.465 30 20 GKED CSCC[C@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 150849620 OIELYBXMJNIJNZ-KRWDZBQOSA-N 397.544 5.051 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CC[C@@H]4CCCC[C@@H]43)c2)cc1 160706315 CNAHTWNVNAWRHZ-REWPJTCUSA-N 389.499 5.128 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(Cl)s1 175132944 FYSSCTZIKSNQNE-BXUZGUMPSA-N 397.912 5.377 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCSc2nc3ccccc3s2)n1 177776898 MWOIZHVHGFGODP-LBPRGKRZSA-N 387.555 5.235 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)NC(C)C)c1 188072884 KVOLLLTWHIUVCG-UHFFFAOYSA-N 379.504 5.321 30 20 GKED CC(C)(C)c1ncc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)s1 303157288 HAWUUMIWVADNPJ-UHFFFAOYSA-N 391.496 5.144 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H]3c3ccccc3)c2)cc1 303663952 XEVUILGKRPASGB-DEOSSOPVSA-N 382.463 5.115 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(CC(F)(F)F)cc1 303856652 KZENTLSXOFDDHI-UHFFFAOYSA-N 380.369 5.582 30 20 GKED Cc1c(NCc2cn(CCC#N)nc2-c2ccccc2)cccc1-c1ncco1 430098575 SHCVYPCMFCOJEZ-UHFFFAOYSA-N 383.455 5.039 30 20 GKED COc1cc(Cl)c(Cl)cc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430645785 OIAOCWWNALPDMS-JTQLQIEISA-N 383.300 5.246 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@H]2c2ccc(F)cc2F)c(Cl)c1 431821828 GVCCIGRKEROYIV-SFHVURJKSA-N 375.806 5.249 30 20 GKED CCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@@H](C)c1cccc(OC)c1 458794258 ATBSYQHWTNQRAJ-AVRDEDQJSA-N 379.504 5.223 30 20 GKED N#CCCC[C@H](NC(=O)N(Cc1cccc(F)c1)C1CCCC1)c1ccccc1 458805185 UFOXLXBXKFGYFH-QHCPKHFHSA-N 393.506 5.715 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 467159297 GLHRXKNHQSXVPK-LRDDRELGSA-N 395.812 5.458 30 20 GKED CCSCc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)no1 471744899 NRWYWFQRBCYUGL-UHFFFAOYSA-N 393.468 5.152 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)c2c1 473586959 DXTPUCFKNUUZLT-RDGATRHJSA-N 395.506 5.333 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1ccc(C(F)(F)F)c(F)c1 473589677 HGRNDHUFFFUCLP-UHFFFAOYSA-N 399.237 5.177 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1 474411822 MRPHJHRWYPKCHB-GOSISDBHSA-N 375.497 5.075 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccccc1CCC(F)(F)F 475573763 USDSDPIXGOEPMR-UHFFFAOYSA-N 390.449 6.677 30 20 GKED C[C@H](NC(=O)c1c(F)ccc(F)c1F)c1ccc(-c2cccc(C#N)c2)cc1 477764776 MGTUVSPWQVUNKU-ZDUSSCGKSA-N 380.369 5.134 30 20 GKED Cc1cccc(CCCSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 481958331 BULINYRGFWZTGH-SFHVURJKSA-N 398.597 5.551 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(OC(F)F)c(Cc2ccccc2)c1 497981528 OIJIKYWTCAZYKI-UHFFFAOYSA-N 384.407 5.064 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCCc1csc2ccccc12 501680294 NVWXIVMUKOUSSX-UHFFFAOYSA-N 382.488 5.412 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 509246799 LGHOXGPFBPHCBB-CYBMUJFWSA-N 377.366 5.121 30 20 GKED C[C@H]1CN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c2ccccc21 509906475 ZNCCRYDOLIIOAW-SFHVURJKSA-N 397.478 5.487 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CCCc2cccs2)cc1 512539709 FYAYBKOYFHWAJT-UHFFFAOYSA-N 392.480 5.382 30 20 GKED CC[C@H](NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)c1ccc(Cl)s1 513074684 IZBNIUHRTHPVBZ-KRWDZBQOSA-N 389.952 5.592 30 20 GKED CC(C)CN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1ccc(C#N)cc1 517814796 GQCFEYICOMTUSD-UHFFFAOYSA-N 393.874 5.098 30 20 GKED Cc1cccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 519450842 KXPBEAIHBLBBLH-KRWDZBQOSA-N 381.545 5.346 30 20 GKED COC1CCC(N(C)C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)CC1 522581318 DSUFTIWIZPLNMS-UHFFFAOYSA-N 398.890 5.034 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 524019265 BFTKIJCRXVQWFL-INIZCTEOSA-N 388.492 5.669 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3cccc(C(F)F)c3)c2)cc1 524505187 OZNIUIZTEGVXFN-UHFFFAOYSA-N 378.378 5.327 30 20 GKED Cc1cc(C)c(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 524614569 FZIDRNFIAQRJSS-SFHVURJKSA-N 398.597 5.878 30 20 GKED C[C@H](CC(=O)Nc1sc2c(c1C#N)CCC2)c1ccccc1C(F)(F)F 525519517 XRUOBQYZIYXSED-LLVKDONJSA-N 378.419 5.260 30 20 GKED C[C@@H](C#N)CN(C(=O)Nc1ccc([C@@H](C)Sc2ccccc2)cc1)C1CC1 533598381 ZRVDUTZGEVCHIE-DLBZAZTESA-N 379.529 5.696 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@H]1COc2ccccc21 533630720 WPCHFDVWMGPRJM-OPAMFIHVSA-N 399.450 5.037 30 20 GKED CCCCOc1ccc(C(=O)N(CC)c2ccc(C#N)c(Cl)c2)cc1OC 533673678 CULHKJWYWFULLB-UHFFFAOYSA-N 386.879 5.066 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1c(F)cc(Cl)c(C)c1F 535623947 CRCMKHPSLOEQCM-UHFFFAOYSA-N 377.822 5.242 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 540314611 RIXDWXBQSWIGKU-LVXARBLLSA-N 382.507 5.483 30 20 GKED C[C@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)[C@H](C)c1ccccc1C(F)(F)F 540741349 FWABJUAZPHMAOZ-GJZGRUSLSA-N 386.417 5.183 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(C)(C#N)CC2)cc1 540949773 PVYMEVRBVGLPQF-QGZVFWFLSA-N 379.529 5.697 30 20 GKED O=C(CCCC(F)(F)F)N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F 541112784 ZLHMDCKHJPVGJQ-NSHDSACASA-N 397.237 5.037 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(F)ccc1OC(C)C 554185633 LRXAFGWBTMOECC-UHFFFAOYSA-N 388.487 5.001 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1csc(-c2ccccc2F)n1 556201647 HMMOLKWIHGATKE-OXJNMPFZSA-N 379.504 6.035 30 20 GKED CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)C1(C#N)CCCCC1 556576358 PQONWMFRFCYUJJ-UHFFFAOYSA-N 392.343 5.157 30 20 GKED N#CCc1ccccc1NC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1 559251946 VAWNVTBSCJYTQC-UHFFFAOYSA-N 396.368 5.816 30 20 GKED N#Cc1ccc(CN(C(=O)c2[nH]c3ccc(Cl)cc3c2Cl)C2CC2)cc1 567338285 BIDKGTHTSNMXOM-UHFFFAOYSA-N 384.266 5.151 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccn(C)c1C1CCC1 575130649 FLSXOALUFPKYFQ-UHFFFAOYSA-N 385.467 5.517 30 20 GKED C[C@H](Oc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1)C(F)(F)F 579631860 APJQUAZDCCJJID-GOEBONIOSA-N 376.378 5.042 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4cccc5ncccc45)no3)cc2)nc1 585731380 DYIWOTAVRODZSP-UHFFFAOYSA-N 391.390 5.011 30 20 GKED C=CCCCCCN(C)C(=O)c1cnn(-c2ccc(C)cc2)c1C(F)(F)F 606816990 MYHUKQLVFSUMNC-UHFFFAOYSA-N 379.426 5.018 30 20 GKED Cc1cccc2c1CC[C@H]2NC(=O)c1ccccc1Sc1ccccc1C#N 609189967 QPTOTPJECPSDPH-OAQYLSRUSA-N 384.504 5.435 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)Cc1ccccc1 609206856 IVYBSKFZBUCFGU-UHFFFAOYSA-N 385.467 5.191 30 20 GKED N#Cc1ccc(CNC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c(F)c1 609254380 MASWJRWSJBOAGM-GOSISDBHSA-N 392.261 5.051 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2)c1 609427376 JWQKHKCQMLYPQU-UHFFFAOYSA-N 382.341 5.622 30 20 GKED CCOc1ccccc1CNC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434037 YOBHSVIVRREXTN-UHFFFAOYSA-N 387.439 5.071 30 20 GKED Cc1ccc(CN(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 609504010 JKJYJDIMHDIFCP-UHFFFAOYSA-N 376.481 5.187 30 20 GKED CSc1cccc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c1 609601369 KSIUXUSJZZISRB-UHFFFAOYSA-N 376.441 5.111 30 20 GKED C[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccsc1 609970420 CUQWFCFBNWSCGK-CQSZACIVSA-N 396.899 5.594 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C[C@H](C)c1ccccc1C(F)(F)F 610173047 KZRCDYRBDDZLNG-INIZCTEOSA-N 386.417 5.285 30 20 GKED CCc1cc(C)c(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 676053650 ZQLOJCWCCLXRTC-GFCCVEGCSA-N 378.375 5.269 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc(OC)c1C(C)C 679730645 VOHJOQVLCRECIA-CQSZACIVSA-N 398.459 5.066 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC[C@H](c2nc3ccccc3o2)C1 681622231 RITUVJCEPUKRJS-INIZCTEOSA-N 378.497 5.126 30 20 GKED C[C@@H](NC(=S)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1cccs1 726480771 LITACIWNFPZZAH-CQSZACIVSA-N 379.510 5.460 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(-c3nc4ccccc4s3)o2)cc1 726942072 PYRMFZAAWODREB-UHFFFAOYSA-N 387.464 5.425 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC(C)C)cc2)c([N+](=O)[O-])cc1OC 728442006 SRZRNWXWPAONJK-YFHOEESVSA-N 387.457 5.009 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCc2ccccc2C1)c1nc2cc(Cl)ccc2s1 732595995 GQTQPAAHJRJOFZ-CXAGYDPISA-N 380.900 5.321 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156235 LRODLDQOSZKATB-MAUKXSAKSA-N 395.453 5.925 30 20 GKED C[C@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1ccc(C#N)cc1 756456477 MXZKVBKIYOYBRP-WDEREUQCSA-N 379.685 5.092 30 20 GKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1 756516205 GCNCHUWDHSUALS-CRAIPNDOSA-N 385.389 5.187 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2cc(Cl)c(O)cc2Cl)S1 759036327 VSYATCZVOMACMC-VIZOYTHASA-N 393.295 5.207 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)c1nc2ccccc2n1C 766836967 GJQKHGYKPQIKJA-IEZBTEQYSA-N 384.266 5.160 30 20 GKED CCn1c(SCc2cc(Cl)ccc2OCC#N)nnc1-c1ccc(C)cc1 768411625 KGTKKBSUHQLWEL-UHFFFAOYSA-N 398.919 5.122 30 20 GKED C=CCCN(OCc1ccccc1)[C@H](C)c1nc(O)c2c(C)c(C)sc2n1 782669691 QXGSYCRIZAEXAS-OAHLLOKOSA-N 383.517 5.085 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc(-c2ccccn2)nc2ccccc12 790876633 NJVZWWNBLXQIDY-UHFFFAOYSA-N 386.499 5.089 30 20 GKED N#CCOc1ccc(CNC(=O)Nc2cc(-c3ccccc3)ccc2Cl)cc1 791949132 BWLYVTGBSDCMPS-UHFFFAOYSA-N 391.858 5.231 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 793164956 QYYPPBYLXCHNCU-ZBFHGGJFSA-N 394.462 5.730 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Nc2ccc(-c3ccncc3)c(C)c2)cc1 793909941 QLKXWVJGWNGWHW-FQEVSTJZSA-N 398.510 5.113 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)C(C)(C)c1cc(F)cc(C#N)c1 795072903 GOHHKLJSSRECPS-UHFFFAOYSA-N 392.396 5.042 30 20 GKED COc1ccc(-c2nc(/C=C/C(=O)c3ccc(OC(F)F)cc3)cs2)cc1 796992528 WMGGCNLTOCSSQI-IZZDOVSWSA-N 387.407 5.316 30 20 GKED CSCc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)oc2ccccc12 797573085 ODVKQILYNXWJQA-CYBMUJFWSA-N 384.526 5.540 30 20 GKED CC(C)(C)OC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)c(Cl)c2)c2ccccc21 800989395 CESHWXJBVYVFGH-PMACEKPBSA-N 397.906 5.012 30 20 GKED COc1ccc(CN[C@H](CCCC#N)c2ccccc2)cc1SC(F)(F)F 814659667 OKAUGKFUBXASAI-QGZVFWFLSA-N 394.462 5.832 30 20 GKED C[C@@H](C(=O)O[C@H]1CC[C@@](C)(C#N)CC1)c1cccc(C(=O)c2ccccc2)c1 836154581 UMNLCBASPBCIFG-JKHABCDFSA-N 375.468 5.037 30 20 GKED CCN(Cn1nc(-c2ccccc2Cl)n(C2CCCC2)c1=S)[C@@H](C)C#N 853577015 AOVAQBDGIAXEDB-AWEZNQCLSA-N 389.956 5.041 30 20 GKED Cc1c(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cccc1NC(=O)OC(C)(C)C 861401543 ZDFFPPJJAMEMFH-HNNXBMFYSA-N 394.475 5.096 30 20 GKED N#CCCCn1cc(-c2nc(-c3c(Cl)cccc3Cl)no2)c2ccccc21 904309603 DYTNCYPNLZMXBB-UHFFFAOYSA-N 397.265 5.969 30 20 GKED N#Cc1ccccc1NC(=S)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 915995191 JROSMZCLWHVWID-FQEVSTJZSA-N 396.519 5.158 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(Br)s2)cc(Cl)c1O 916134490 MZTMUQNGOJXSHG-ONEGZZNKSA-N 387.682 5.164 30 20 GKED O=C(/C=C/c1ccc(OCc2ccccc2)c(Br)c1)c1ccncc1 916136509 QNOOZVBWKGRNBQ-SOFGYWHQSA-N 394.268 5.319 30 20 GKED N#C[C@@H](C(=O)Cc1c(Cl)cccc1Cl)c1nc2cc(Cl)ccc2s1 917043637 LLBDQYAFMHACDV-NSHDSACASA-N 395.698 5.675 30 20 GKED Sc1nnc(-c2ccccc2Cl)n1N=Cc1ccc(-c2ccccc2)o1 917538055 FOXMJKIPXLEVDO-UHFFFAOYSA-N 380.860 5.029 30 20 GKED CC(C)=C[C@@H]1[C@@H](C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)C1(C)C 920804402 QEAHJUOHUYBLOK-VFVRVIDISA-N 386.467 5.503 30 20 GKED CC(=Nn1c2ccccc2c2ccccc21)c1cc(C(=O)O)ccc1OC(C)C 1776112626 DILQRSFBCWVYLI-UHFFFAOYSA-N 386.451 5.552 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3cc(F)ccc3F)cc2)c1 1776113514 MJUSKXGDFPQXMM-IZZDOVSWSA-N 378.374 5.155 30 20 GKED C=C(Cl)C[C@H](NCc1ccc(-c2ccc(Cl)c(Cl)c2)s1)C(=O)O 1776142972 UGTGXWBSONQIOW-AWEZNQCLSA-N 390.719 5.407 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1sc(Br)cc1C 1776786696 BYAWXQIECGXMJB-ZDUSSCGKSA-N 376.360 5.112 30 20 GKED N#Cc1ccc(F)c(CSc2nc3ccccc3c(=O)n2C2CCCCC2)c1 10143614 AZHVBHOWMHZULF-UHFFFAOYSA-N 393.487 5.205 30 20 GKED N#CCCCCOC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(O)cc1)CC2 24882559 ABECZIVOLJRCAI-FBMGVBCBSA-N 398.462 5.278 30 20 GKED CC(C)(C)c1cc[n+](/C(C(=O)c2ccccc2)=C(/S)NC2CCCCC2)cc1 27330127 YWIFSDGEBPNWBZ-UHFFFAOYSA-O 395.592 5.133 30 20 GKED Cc1onc(-c2c(F)cccc2Cl)c1C(=O)[C@@H](C#N)c1nc2ccccc2o1 41541874 HHNOFMSYEMZONX-LLVKDONJSA-N 395.777 5.074 30 20 GKED O=C(/C(=C(\S)Nc1ccc2ccccc2c1)[n+]1ccccc1)c1ccccc1 55013214 XEXIAGFSGURQMX-UHFFFAOYSA-O 383.496 5.178 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NCCC3=CCCCC3)c2)cc1 71919719 GRNIQCPFBBKVFO-UHFFFAOYSA-N 389.499 5.344 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C1CCC(F)(F)CC1 128496724 XXTFJYPUXCNUGW-UHFFFAOYSA-N 384.426 5.210 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1c(C)noc1C 160972675 MITFPPYRYPKCCJ-LJQANCHMSA-N 375.428 5.088 30 20 GKED Cc1c(C#N)cccc1NC(=O)N(C)[C@H](c1ccncc1)c1ccc(Cl)cc1 178534394 HXEDBVRTPJZRGP-NRFANRHFSA-N 390.874 5.168 30 20 GKED C[C@H](N[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1 185019246 PGFGQUGDQPFEGK-LIRRHRJNSA-N 377.488 5.549 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1cnc2ccccc2n1 190886058 PJEKMQHYKOSNDP-KRWDZBQOSA-N 398.853 5.199 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cn(-c2ccccc2)nn1 191463075 XNOBFEIZCSLDMZ-QGZVFWFLSA-N 389.503 5.002 30 20 GKED CSC1(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 193749192 FGHYGVUCXIOAMB-KRWDZBQOSA-N 385.920 5.013 30 20 GKED Cc1ccc(C)c(N=C(O)[C@@H](C)N2CCC([C@@H]3C(O)=Nc4ccccc43)CC2)c1 328682076 CVOMWQADQXVECB-VGSWGCGISA-N 391.515 5.377 30 20 GKED CCCS(=O)(=O)Nc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c1C 329015771 QGEOXXPGGKLVNY-KZNAEPCWSA-N 392.565 5.341 30 20 GKED CC(O)=Nc1cccc([C@H](C)/N=C(/O)N2Cc3ccccc3C3(CCC3)C2)c1 329224594 ZYYYEVQEAVIJRM-INIZCTEOSA-N 377.488 5.207 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c(C#N)c2[C@H](C)C1 411010957 LIFHXCMIAYUSKE-VHSXEESVSA-N 389.864 5.119 30 20 GKED C[C@@H](CC(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 413499316 DBBHAEJIONKGJH-ZETCQYMHSA-N 377.325 5.292 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)c1cnc(C(F)(F)F)c(C#N)c1)C1CCCC1 425580352 JFPBERLGTHFXIY-AWEZNQCLSA-N 387.405 5.118 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2nccc3ccccc23)cnn1-c1ccccc1C 429205526 RJOFDPOENZOBFT-HXUWFJFHSA-N 394.478 5.172 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(Cl)ccc2OC(F)F)s1 430611367 NXIDMCJIBCDFTP-NSHDSACASA-N 384.835 5.185 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(C(C)(F)F)cc1 433139674 CDVMKBKXGMCIEZ-CQSZACIVSA-N 389.471 5.514 30 20 GKED C=CCC[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 435288946 MEEBIGKCLNENJJ-QFIPXVFZSA-N 383.451 5.183 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(-c3ccccc3)c(-c3ccccc3)o2)c1 436446200 FDNVEPRRFLDBJB-UHFFFAOYSA-N 379.419 5.327 30 20 GKED Cc1cc(Br)ccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 437567511 LWWPYIGEQBQKSB-MJGOQNOKSA-N 398.304 5.061 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccccc1-c1nncn1C(C)C 440286785 XZWYHYPDRVJGBV-UHFFFAOYSA-N 381.524 5.126 30 20 GKED Cc1cc(C(=O)CS[C@H](C)c2cccc(C#N)c2)c(C)n1CC(F)(F)F 443146143 ODJZIVWRQNURPV-CQSZACIVSA-N 380.435 5.216 30 20 GKED CN(CCC#N)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 444031928 JNIYRHGFZUTTEE-UHFFFAOYSA-N 382.222 5.302 30 20 GKED N#CCCCn1cc(C(=O)Nc2scnc2-c2ccccc2)c2ccccc21 444124539 OTFMCTNOZCKBCN-UHFFFAOYSA-N 386.480 5.321 30 20 GKED CCOc1ccccc1Oc1ccc(CN[C@@H](CC)c2ccc(C#N)cc2)cn1 447533522 XXVNJIXFQSHQGF-NRFANRHFSA-N 387.483 5.385 30 20 GKED CCCCCOc1ccc(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 464475964 OKCULIIILXNNSN-KRWDZBQOSA-N 376.378 5.159 30 20 GKED C[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccnn1-c1ccccc1 467361208 BYBKHGLNZSZWME-LJQANCHMSA-N 378.479 5.262 30 20 GKED C[C@@H](C(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(Cl)c(Cl)c1 471865858 NGYYPCDCQCUQBQ-SECBINFHSA-N 385.197 5.209 30 20 GKED CC(C)(C#N)c1ccc(N[C@@H](c2ccccc2)c2nc(-c3ccccc3)no2)cc1 475755867 PAMDJLNIHCWRIQ-QFIPXVFZSA-N 394.478 5.739 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F)c1ccccc1 476622932 GGQOLVDTMPFWIA-AVRDEDQJSA-N 396.412 5.647 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2Cl)c1 479401118 VJKYSFRFBRHDLN-HNNXBMFYSA-N 390.817 5.165 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)c(F)c2)c2cc(F)ccc2F)c1 479483355 WGDYWXSDBZTPIM-JOCHJYFZSA-N 398.453 5.577 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccccc1)c1ccco1 480482126 KNVDSXUALYXWSL-HSZRJFAPSA-N 387.483 5.108 30 20 GKED C=CCn1c(S[C@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1ccccc1C 481374025 NSUPNBJBRSJJOC-OAHLLOKOSA-N 380.473 5.201 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 482993612 XMFYTURFFLTEJR-UHFFFAOYSA-N 397.434 5.285 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1cc(C(F)(F)F)ccc1F 488423397 AJWIQOZVBIPKLY-UHFFFAOYSA-N 383.307 5.230 30 20 GKED C[C@H](c1cc(Cl)ccc1Cl)n1nccc1NC(=O)c1cccc(CC#N)c1 488703812 QIURAWWKKUTSHK-CYBMUJFWSA-N 399.281 5.118 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccc(C#N)cc1 505364464 QJSWYDZSJLZSEG-VLIAUNLRSA-N 395.915 5.423 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1cccc(Br)c1 508987230 LUEMVYPOELFVAP-UHFFFAOYSA-N 397.297 5.230 30 20 GKED CCC(CC)N(C(=O)C[C@H](CC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 511281066 KLZLAEDKSUTXDL-JTHBVZDNSA-N 389.543 5.564 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(Oc2ccccc2)nc1 513049459 XFKNTRUOMWADKL-UHFFFAOYSA-N 384.888 5.417 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccccc1OCc1ccncc1 514758715 QUFCOXXLFDALSC-UHFFFAOYSA-N 390.531 5.016 30 20 GKED C[C@H]1CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 521710947 PTYUIPHSGMOTQF-JXFKEZNVSA-N 381.907 5.649 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1 525003570 KAMRDORRSUBEAV-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccccc2OC2CCCCC2)c1 525044541 CROSNOCBPQUXMB-UHFFFAOYSA-N 378.472 5.333 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)c1 537884086 IOYCEIGWNHFUSQ-LJQANCHMSA-N 382.419 5.384 30 20 GKED Cc1cccc(F)c1NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 539533041 MEYQJNTVFZZHJD-UHFFFAOYSA-N 380.806 5.704 30 20 GKED N#CCCN(C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1ccc(F)cc1 562421250 BUQMZACEABLKHJ-UHFFFAOYSA-N 393.849 5.465 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)CC1 564430394 CNFRPKPENWRGPM-UHFFFAOYSA-N 383.492 5.276 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(C(F)F)cc1 588025570 IZBGWETWRYNMDJ-GHMZBOCLSA-N 389.286 5.264 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCC3(CCCCC3)CC2)cc1 588249945 GCWJRZXMBVSCLK-UHFFFAOYSA-N 395.547 5.079 30 20 GKED CN(C(=O)CCCCCC#N)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 588757014 MWYHXFVYOSUVBW-UHFFFAOYSA-N 391.393 5.330 30 20 GKED CC[C@H](C#N)C(=O)Nc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1C 593487003 JUMKRSFYMBAYQT-OAHLLOKOSA-N 378.451 5.220 30 20 GKED COc1cc2ccc([C@@H](C)N[C@H](CCCC#N)c3ccccc3)cc2cc1OC 595040312 XKTXZNNCFMROLD-WZONZLPQSA-N 388.511 5.943 30 20 GKED Cc1cccc(C)c1[C@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 596733763 VGSWQBCLZCYMTA-UYAOXDASSA-N 393.556 6.067 30 20 GKED Cc1ccc(CS[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)cc1C#N 600649868 ZGTKFXXZRVPCMF-ZDUSSCGKSA-N 378.419 5.146 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2ccccc2O)cc1Cl 603758931 PCQIPNLVTJGNDF-HXUWFJFHSA-N 390.870 5.272 30 20 GKED C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc(OCCCC#N)c1 603972293 IBTVHLZBOFJKFS-CYBMUJFWSA-N 393.270 5.082 30 20 GKED CCc1c(C)sc(NC(=O)c2sc(-c3ccc(OC)cc3)nc2C)c1C#N 609033222 XORYRZFAMYNUDO-UHFFFAOYSA-N 397.525 5.183 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1c(F)cccc1F 609438580 LGRWFEIQTZYHFE-CHWSQXEVSA-N 375.444 5.242 30 20 GKED Cc1cc(CN(C(=O)CCc2ccc(C#N)cc2)C2CCCC2)c2ccccc2n1 609522325 AZKLOWDTWOCLND-UHFFFAOYSA-N 397.522 5.319 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3nc(-c4cccnc4)cs3)c2)cc1 610011125 KJIQBSSCUUBSPE-UHFFFAOYSA-N 397.463 5.073 30 20 GKED C[C@@H](NCc1ncccc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 611983732 DYYROHIWSDOSPC-OAHLLOKOSA-N 381.401 5.490 30 20 GKED Cc1cccc(COc2cccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2)c1 613291193 WDGFHOAEUQVMEB-HSZRJFAPSA-N 392.458 5.612 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N3CC[C@](F)(C#N)C3)cc2)c1 615538519 PGMVBCFXFOVLDH-QHCPKHFHSA-N 395.478 5.167 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ncc(-c3ccc(F)cc3)s2)c(Cl)c1 617780897 ZIWLDQVEPAHJJP-UHFFFAOYSA-N 392.242 5.380 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)c(F)c1 622485308 KECZSDDKDUARRD-CYBMUJFWSA-N 383.238 5.017 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)Nc1nc(C(F)(F)F)ns1 664469260 FXAYYNVIYIGWQV-UHFFFAOYSA-N 375.260 5.022 30 20 GKED CC(C)[C@@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cn1 679387001 UTXJKYHOAOUQPD-REJLFOLJSA-N 386.355 5.417 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=S)Nc1ccc(C#N)c(Cl)c1 726440603 XTBYVJKHFRAOJF-UHFFFAOYSA-N 384.719 5.347 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H]3CCCc4ccccc43)n2)cc1 731135653 FZXLFAVVQOFNHM-PZJWPPBQSA-N 386.520 5.805 30 20 GKED CC(C)(C)n1cc(C=NNc2cccc(C(=O)O)c2)c(-c2ccccc2Cl)n1 731153024 WFSLYPLMWOMOMT-UHFFFAOYSA-N 396.878 5.103 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(OC(F)F)cc1 731321237 OGCWMZVTTKNWBJ-LBPRGKRZSA-N 393.484 5.491 30 20 GKED CCOc1c(OC)cc(/C=C2/CSc3c(Cl)cccc3C2=O)cc1OC 731939688 QLAXBEMIJPJVNA-JYRVWZFOSA-N 390.888 5.128 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccccc1SCc1cc(C)no1 732644231 OVORHGIZIQUJMW-UHFFFAOYSA-N 384.545 5.484 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc2ccccc12 733081452 YYRFSDKIRABCRB-QXMHVHEDSA-N 386.432 5.768 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C/C(=O)c2ccc(N3CCOC3=O)cc2)o1 734304593 PEZZUUQGWYWOBR-PKNBQFBNSA-N 391.398 5.247 30 20 GKED C=CC[C@H](NC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1)c1ccncc1 735386754 QACKBSCOJLDCAP-SFTDATJTSA-N 383.923 5.679 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(C)cc1 739155706 SWZUNJYFSKGHCO-AVRDEDQJSA-N 384.479 5.380 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1cccc(-c2ccncc2)c1 741471994 DFRCMMBOROMKKK-QXMHVHEDSA-N 392.458 5.619 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccccc2F)cc1F 743037107 QZKFSEUBRGIKOY-UHFFFAOYSA-N 381.407 5.438 30 20 GKED CCC[C@@]1(C)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 743093520 VOXNSRLWUIWJFR-UPVQGACJSA-N 375.516 5.776 30 20 GKED CCc1cccc(CC)c1NC(=S)N(Cc1ccc(C#N)cc1)CC(C)C 745695581 QMHWEHDKLGCIJT-UHFFFAOYSA-N 379.573 5.538 30 20 GKED N#CC(CCOC(=O)c1csc(C2CC2)n1)(c1ccccc1)c1ccccc1 747506025 BRZVHLKUGRMIOW-UHFFFAOYSA-N 388.492 5.077 30 20 GKED C=CC[C@@H](N[C@@H](C)c1cc(Br)cc(Cl)c1O)c1ccncc1 756581457 CULCBKDSKAXNHO-MEDUHNTESA-N 381.701 5.171 30 20 GKED C[C@@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ccc(-c2cccc(C#N)c2)cc1 757659984 XJLUOSLENWBVMC-HUUCEWRRSA-N 378.422 5.621 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 757681041 XDLPPCFMYKGUQQ-AQKFKSFVSA-N 389.898 5.528 30 20 GKED COc1ccc(C[C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 759214083 XZSIMMIGXGKDQR-JXFKEZNVSA-N 390.508 5.182 30 20 GKED C=CC[C@@H](N[C@@H](CC)c1ccc(I)cc1)c1ccncc1 766018100 FZTWGPUIOZFNJT-ZWKOTPCHSA-N 392.284 5.044 30 20 GKED N#CCCN(C(=O)c1cnc(Cl)c2ccccc12)C12CC3CC(CC(C3)C1)C2 766886029 PJRVDGWBVLCWEN-UHFFFAOYSA-N 393.918 5.213 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Br)cc2F)c(Cl)c1OC 767736482 LXTCJWZSPNIGNF-CLTKARDFSA-N 399.643 5.155 30 20 GKED COc1ccc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cc1O 779596537 XFZRKFDQONPOHF-UHFFFAOYSA-N 394.858 5.117 30 20 GKED C#CCCCCCC(=O)N(Cc1cccc(C(F)(F)F)c1)Cc1ccccn1 779979505 BJRFLFADXZDUJH-UHFFFAOYSA-N 388.433 5.213 30 20 GKED N#Cc1ccc(CSc2nn(-c3ccccc3)c(=S)s2)c(Cl)c1 783978202 DVJWSHZLUHTCMV-UHFFFAOYSA-N 375.931 5.481 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792101195 FUDZNPLOCQEBKK-BLLLJJGKSA-N 385.250 5.185 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(C)n1[C@@H](C)c1ccccc1 792102729 JCYGEEBEJHNPKZ-MHECFPHRSA-N 393.490 5.753 30 20 GKED N#CC[C@H](CC(=O)OCc1coc(-c2ccc(Cl)cc2)n1)c1ccccc1 795987795 WXLOOKGYIBFMJK-QGZVFWFLSA-N 380.831 5.126 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)n2)cc1 796890245 SYJRGAHGMZGDFB-IJXRJRJASA-N 389.524 5.465 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 807898566 HHWFOESDYRXIOU-UWJYYQICSA-N 383.492 5.022 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H]2c3ccccc3CC23CCOCC3)cc1 810255640 QMNXMEYSAAQLMO-JPYJTQIMSA-N 397.946 5.563 30 20 GKED CCCCN(C)c1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 814633442 FLBHWQSDPBCGFL-QFIPXVFZSA-N 378.520 5.480 30 20 GKED C[C@@H](NN=Cc1cn(C(C)(C)C)nc1-c1ccccc1Cl)c1ccncc1 819815690 UFQYGIAUDAUDCM-OAHLLOKOSA-N 381.911 5.038 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2ccc3ccccc3n2)cc1 915181335 YXUBTUXTVLNWDT-NSNCMOJPSA-N 389.458 5.542 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCc2ncc(Br)cc21)c1ccccc1 926479808 MSEBEBQTMHCJQW-AZUAARDMSA-N 384.321 5.246 30 20 GKED Cc1cc(C)c(C(=O)O)cc1/C=C\C(=O)c1ccc(OCc2ccccc2)cc1 1776127608 YJJNXVXYYNSWRY-RAXLEYEMSA-N 386.447 5.477 30 20 GKED C=CCc1ccccc1/C=C\c1cc(C(=O)O)c2ccc(Br)cc2n1 1776189029 AKDBVWHRDKKQMT-NTMALXAHSA-N 394.268 5.594 30 20 GKED C[C@H]1/C(=C\c2ccc3oc(C(=O)O)cc3c2)C(=O)c2cccc(Br)c21 1776586940 DQMSMMSJNGLNDI-CEITULEQSA-N 397.224 5.277 30 20 GKED CCCCC(=O)Nc1ccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)cc1 1776765927 BENBAIWUQNIXFF-NBVRZTHBSA-N 391.467 5.116 30 20 GKED CCCCCCCC/C=C/CCCCCCCc1nc([C@@H](N)CC(=O)O)no1 1776785224 INJAHHHAAUADNC-YXBWYFRISA-N 393.572 5.734 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](CC2CCCC2)C(=O)O)c1 1776788742 VYTWRWSIXGYAPE-NRFANRHFSA-N 375.553 5.407 30 20 GKED CCCCOc1ccc(/C=C\C(=O)c2ccc(OCCCC(=O)O)cc2)cc1 1776801286 HNMXUKKRARFYNY-NVNXTCNLSA-N 382.456 5.005 30 20 GKED O=C(O)c1ccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)c(Cl)c1 1777673469 YCUBHJJQIOBQQN-GHXNOFRVSA-N 394.826 5.565 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)cc2)CCC1 1789192852 ITHJCLFTGJKYGR-VLCRHTCISA-N 394.559 5.303 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(C)o3)CCC2)cc1 1789624255 PVEYPEKMWHRQSX-UHFFFAOYSA-N 394.515 5.328 30 20 GKED Cc1sc2nc(SCCCC#N)n(-c3ccc(Cl)cc3)c(=O)c2c1C 5430347 ZPJTXAOPCXDTQM-UHFFFAOYSA-N 389.933 5.113 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccccc2C(F)(F)F)cc1OC 110092803 FYISQMYOWTZBBG-MDZDMXLPSA-N 380.362 5.017 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 112738203 DUZZAISTMHAHFF-UWJYYQICSA-N 381.545 5.799 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(F)cc2C(F)(F)F)c1 113564572 RPUXSVFMQKBUIT-UHFFFAOYSA-N 381.329 5.171 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(F)cc1-c1nc(C2CC2)no1)c1ccccc1 127577073 GLHUMWAFNBILKJ-CQSZACIVSA-N 377.419 5.052 30 20 GKED Cc1cccc(C)c1/N=C1/NC(=O)/C(=C/c2cccc(-c3cccnc3)c2)S1 127719340 BBPFTRFSTCGPTH-MOSHPQCFSA-N 385.492 5.257 30 20 GKED CCc1onc(C)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 153977269 BWMQVQLSTMLFTD-UHFFFAOYSA-N 381.819 5.115 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(C3CC3)nc3ccc(F)cc23)n1 176188690 JMZXRWZIWKHVQZ-MRXNPFEDSA-N 379.460 5.321 30 20 GKED O=C(N[C@H](c1cccc(F)c1F)C(F)(F)F)c1ccccc1C(F)(F)F 181607694 KJKISPACPQSOQZ-CYBMUJFWSA-N 383.238 5.017 30 20 GKED Fc1cccc(F)c1[C@@H](NCc1nc2ccccc2n1C(F)F)C(F)(F)F 183443533 JYAIWBVEOBDUJC-OAHLLOKOSA-N 391.290 5.103 30 20 GKED COCCC1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CCCCC1 187129571 IJJHDFWQFWGZRP-QGZVFWFLSA-N 389.565 5.189 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)NCC(C)(C)C)cc1 189894636 QREGGVOJFCLLRR-UHFFFAOYSA-N 392.543 5.567 30 20 GKED CCN(CCC(=O)Nc1sccc1C#N)[C@H](C)c1cccc(C(F)(F)F)c1 195732848 YMDOWYFCEMMAMB-CYBMUJFWSA-N 395.450 5.050 30 20 GKED CSCCc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 303146273 DSYURJNVIFMFSQ-UHFFFAOYSA-N 388.492 5.508 30 20 GKED CC(C)(/N=C(/O)c1ccc2c(c1)N=C(O)C2(C)C)/C(O)=N/CC1CCCCC1 328940360 HOFZMMIGOKVIMF-UHFFFAOYSA-N 385.508 5.186 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(C(F)(F)F)cc1 409674321 BEDYOCKCHOHXJA-ZDUSSCGKSA-N 378.419 5.453 30 20 GKED CC(C)c1ccccc1-n1c(S[C@@H]2CC[C@H](C#N)C2)nnc1-c1cccnc1 430100646 MAXIDDRSMJLRAU-FUHWJXTLSA-N 389.528 5.237 30 20 GKED C[C@@H](C#N)NC(=O)c1sc2ccccc2c1CSc1ccccc1Cl 432123615 VSPTXOAGWMBSKL-LBPRGKRZSA-N 386.929 5.489 30 20 GKED CCN(C(=O)c1ccc(C(C)(C)C(F)(F)F)cc1)c1ccc(C#N)c(Cl)c1 433849734 SPESSWNHDYVQLZ-UHFFFAOYSA-N 394.824 5.718 30 20 GKED CC(C)(c1ccc(C(=O)N[C@@H](C#N)c2ccccc2Cl)cc1)C(F)(F)F 433861881 GKMUQZKUAVFTNM-INIZCTEOSA-N 380.797 5.175 30 20 GKED CC(C)(c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1)C(F)(F)F 434114352 MOZJTRJDUSSBEZ-UHFFFAOYSA-N 392.446 5.785 30 20 GKED C[C@H](Sc1cccc(C#N)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 435041975 KJYHALWXABXJFO-NSHDSACASA-N 375.375 5.480 30 20 GKED CCOc1cccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 436335037 LNEJINIIPAELOW-MOXGXCLJSA-N 395.528 5.157 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2cscn2)c1)c1nc2ccccc2n1C(F)F 442680963 REPDPNCGVQLXOP-CQSZACIVSA-N 394.406 5.045 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3cccnc3)cc2)cc1C(F)(F)F 443874864 COGDMHVRNSVSBO-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Clc1ccccc1C#CCSc1nnc(Cc2cccs2)n1C1CC1 446984497 IOIQNXXGWYZZKH-UHFFFAOYSA-N 385.945 5.063 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 473850115 MTCSCNDSKYZLKT-QUCCMNQESA-N 379.529 5.491 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1nc(C(C)(C)C)cs1 475577872 JCOUSUHGGIBUSO-OAHLLOKOSA-N 385.577 6.175 30 20 GKED C=C(C)[C@H](NC(=O)Cc1csc(-c2ccccc2)n1)c1ccc(F)c(F)c1 475674677 KMNKOALFDRTROI-FQEVSTJZSA-N 384.451 5.064 30 20 GKED N#Cc1ccc(F)c(CN[C@H](c2ccccc2)c2ccc(Br)cc2)c1 479280510 HWJBVSBRXRBFHK-OAQYLSRUSA-N 395.275 5.339 30 20 GKED N#Cc1cc(NC(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)ccc1F 481714258 SITZLZCBNCDKTD-UHFFFAOYSA-N 378.234 5.201 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(C)c(NC(=O)N2CCCC[C@@H]2C=C)c1 485571709 RTEOFRKQAQZTQX-PMACEKPBSA-N 396.535 5.140 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(OC)c(OCC(F)(F)F)c1 485753922 VTNWIBYFSRHSCJ-UHFFFAOYSA-N 397.418 5.167 30 20 GKED N#Cc1ccc(F)c(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)c1 487339365 ONYKLUGDGFKBQD-DEOSSOPVSA-N 399.469 5.287 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1ccc(F)c(C(F)(F)F)c1 488447457 WGJNLICDAVWGKU-UHFFFAOYSA-N 383.307 5.230 30 20 GKED COc1ccc(/C=C\c2nc3cc([N+](=O)[O-])ccc3s2)cc1OCCCC#N 494101216 UKLBMUHOFOYCBG-UITAMQMPSA-N 395.440 5.066 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@H](C)C(F)(F)C1 494568292 XQPXTEAWEIVMTH-HNNXBMFYSA-N 385.414 5.168 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1C 502319281 PSSMPCIVWWLICH-UHFFFAOYSA-N 385.467 5.593 30 20 GKED C=CCN(C(=O)c1sc2nc(C(F)(F)F)ccc2c1C)c1ccccc1 502910827 DJXDRESRVYPVIY-UHFFFAOYSA-N 376.403 5.456 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)CC2CCCC2)cc1 508274810 DBYLQYKMELSDJI-UHFFFAOYSA-N 379.460 5.013 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1SCCc2ccccc21 514837630 KGCSSGCPHWUCQV-HSZRJFAPSA-N 384.504 5.122 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)Nc3ccc(F)cc3Cl)c2)cc1 517923311 FOGMQQDGSQFKRQ-UHFFFAOYSA-N 395.821 5.194 30 20 GKED CC(C)COc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 520183941 VTHCQTYFLXEKDK-UHFFFAOYSA-N 379.504 5.283 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)ccc1Cl 521817819 XZQLIKQWVNWDFB-UHFFFAOYSA-N 376.287 5.555 30 20 GKED Cc1ccc(CC(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1C 524389158 SWQJFYNYGZGDGC-UHFFFAOYSA-N 384.479 5.244 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@H](C)[C@@H](C)O1 525841978 ANGQERBQDSNAKS-AXHMDWHKSA-N 397.906 5.025 30 20 GKED CN(C)c1ccc(C(F)(F)F)cc1NCc1cccc(OCCCC#N)c1 533464113 XFVLXNGXIRSNHZ-UHFFFAOYSA-N 377.410 5.066 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)Nc2cccc(OCCCC#N)c2)c1C1CC1 534988997 RWNAGWPEAVKRGP-OAHLLOKOSA-N 381.480 5.058 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)c3ccc(C4(C#N)CC4)cc3)ccc2C)c1 537454350 ZKELEGOOUOWUTA-UHFFFAOYSA-N 383.451 5.298 30 20 GKED COc1ccc(CN2CCC(=Cc3ccccc3F)CC2)cc1OCCCC#N 537704728 CCRSRZOAMKTOMR-UHFFFAOYSA-N 394.490 5.196 30 20 GKED CC(C)c1nccn1Cc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1 537719697 GWWHLQLHEHWQSZ-UHFFFAOYSA-N 398.554 5.871 30 20 GKED N#Cc1c(Cl)cccc1SCc1cccc(C(=O)NCc2ccco2)c1 538942086 BIIDXCICZGUHME-UHFFFAOYSA-N 382.872 5.027 30 20 GKED CCN(C(=O)c1cc(Cl)ccc1OC(F)F)c1ccc(C#N)c(Cl)c1 539172233 FERUNYFBRYDGLT-UHFFFAOYSA-N 385.197 5.133 30 20 GKED O=C(N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F)C1CCC1 542159390 CXBZSHMPODAHFR-LLVKDONJSA-N 393.249 5.244 30 20 GKED C=C[C@H](Cc1nc(Cc2ccc(OCc3ccncc3)cc2)no1)c1ccccc1 544965571 CSRCMXIAKVKUBG-OAQYLSRUSA-N 397.478 5.147 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 546089827 DAIFCERRHYHOEX-PKTZIBPZSA-N 388.511 5.037 30 20 GKED N#CCCn1cc(CN2CC[C@@H](c3cccc(Cl)c3)C2)c(-c2ccccc2)n1 552316954 VJUCAUGVZQVWCG-HXUWFJFHSA-N 390.918 5.107 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3ccc(C#N)c(F)c3)s2)cc1 553790928 IELFRMSVXWPHCJ-ZIAGYGMSSA-N 395.503 5.550 30 20 GKED N#Cc1ccc2c(c1)[C@@H](NCc1nc3c(s1)C[C@@H](c1ccccc1)CC3)CC2 569009967 IJKFTLALIKXFQM-FPOVZHCZSA-N 385.536 5.064 30 20 GKED CCOCc1ccc(-c2noc(-c3cn(CCCC#N)c4ccccc34)n2)cc1 574843983 RULXSRQJXMTCFQ-UHFFFAOYSA-N 386.455 5.199 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N1CCC(CCC#N)CC1 581826321 YMBIZRZSQIPPHC-UHFFFAOYSA-N 392.286 5.113 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@H](c1cc(F)cc(Br)c1)C1CC1)CC2 583663676 QKIOEYNDZPHBTQ-PMACEKPBSA-N 385.280 5.188 30 20 GKED Cc1ccc(CC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1C 604003956 NHRZOLPDECGORL-UHFFFAOYSA-N 384.479 5.130 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1c(F)cccc1F 605479025 GCDFCXLUEZQATK-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1ccccc1 608995276 GXFKNWNZVMXSDC-SFHVURJKSA-N 385.467 5.618 30 20 GKED CCOc1cccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)c1 609060482 FRRUZIWZYQYGIB-UHFFFAOYSA-N 386.451 5.097 30 20 GKED CCc1cc(C#N)c(NC(=O)CCc2nc3cc(Cl)ccc3s2)s1 609326819 RIOZOCLSMNUFDL-UHFFFAOYSA-N 375.906 5.017 30 20 GKED CC(C)OCc1cccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 609987179 HTCUWEHEKWWKDF-UHFFFAOYSA-N 385.467 5.479 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccc(Cl)s1 610540336 YJGAQEMRJBBGQT-GFCCVEGCSA-N 383.860 5.203 30 20 GKED C[C@H](NC1CCN(CC#N)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 610812848 NELGLLVWULHDDF-AWEZNQCLSA-N 393.478 5.072 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(COc3ccc4ccccc4c3)no2)cc1 615132041 XILQPQVMAFPHBC-JOCHJYFZSA-N 396.450 5.015 30 20 GKED O=C(Nc1ccc(Cl)cc1F)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618539927 YMWKAHQRKPTKIO-OCAPTIKFSA-N 392.702 5.074 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cccc(C(F)F)c1 619125577 SNHOKXMPXWIKSO-UHFFFAOYSA-N 377.275 5.408 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cnc(-c2ccccc2Cl)s1 622710982 PNQZPDCOZRQZBE-UHFFFAOYSA-N 382.916 5.334 30 20 GKED C=CCC[C@H](NC(=O)[C@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676730109 ALEXZCYNADTKIJ-PXAZEXFGSA-N 380.410 5.237 30 20 GKED N#C[C@H](C(=O)c1cc2cccc(F)c2o1)c1nc(-c2ccc(Cl)cc2)cs1 682127135 HGJQIKVHRGJTBI-CQSZACIVSA-N 396.830 5.839 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)c1 726480801 NJEBPFRPWLRDBS-UHFFFAOYSA-N 399.494 5.078 30 20 GKED CCN(C(=S)NCc1cccc(C(F)(F)F)c1)[C@H](C)c1ccc(C#N)cc1 726480908 OGKSZJSQAZQITM-CQSZACIVSA-N 391.462 5.035 30 20 GKED CC(C)C[C@H](C#N)NC(=O)c1ccc(CSc2nc3ccccc3s2)cc1 726559550 KFPBYIYGSCBLFU-QGZVFWFLSA-N 395.553 5.257 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(CC(C)C)nc2C)cc1 727954901 VUHPWJXQDXSOIP-RDTXWAMCSA-N 397.544 5.125 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)cc1O 728438443 FPZMVWBTFCYQEF-GXDHUFHOSA-N 397.883 5.390 30 20 GKED N#Cc1cc(F)ccc1CSc1ncc(-c2ccccc2)n1CC(F)(F)F 728441193 BRKGSPRILWYKSL-UHFFFAOYSA-N 391.393 5.415 30 20 GKED Cc1cc2nc(-c3ccccc3)cc(C(=O)Nc3sccc3C#N)c2cc1C 728456991 SIPPVDPZDVZLMB-UHFFFAOYSA-N 383.476 5.704 30 20 GKED Cc1cc(OCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)ccc1C(C)C 730421818 QIHGLLMVNQQCQA-QGZVFWFLSA-N 382.460 5.123 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)-c1ccccc1C2)c1nc2cc(F)ccc2s1 730422407 XKGPOKCNIPIJGN-LJQANCHMSA-N 384.435 5.497 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)c1cc(C)ccc1C 733080257 ICHUWYMJSUPETM-UHFFFAOYSA-N 385.393 5.010 30 20 GKED O=C1CCc2cc(C(=O)/C=C\c3ccc(-c4c(F)cccc4F)o3)ccc2N1 734366851 BFXZTFKUSMBSOT-TWGQIWQCSA-N 379.362 5.006 30 20 GKED O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)c1c(Cl)nc2sccn12 741844934 SVSIFOOHWOPMCL-RQOWECAXSA-N 391.201 5.618 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@H]2SCCc3sccc32)c1 742658731 CJLQYCDOUCVCFA-FQEVSTJZSA-N 395.574 5.355 30 20 GKED COc1ccc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c(C)c2c1 744017024 XOUUVRFBBNNBDL-CQSZACIVSA-N 378.478 5.318 30 20 GKED CCCOc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 744037168 OTYCUBOIGFISAM-HXUWFJFHSA-N 390.508 5.408 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1ccc(C)c(N2CCOC2=O)c1 746730782 KSHAUXDSEQDUKI-UHFFFAOYSA-N 375.513 5.166 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCOc2cccc3ccccc23)n1 747196547 MVRIXGNZMGBIOZ-SFHVURJKSA-N 378.497 5.455 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](c1ccc(C(F)(F)F)cc1)C(C)C)c1ccncc1 749202010 LARMVVMKTMDJBL-RBUKOAKNSA-N 391.437 5.414 30 20 GKED Cn1nc(C(F)(F)F)c(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c1Cl 758932102 RCOVIDUOLMECGG-SREVYHEPSA-N 391.780 5.050 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(F)c1F 766337112 RDLWCCRMSUTDDS-FOIQADDNSA-N 391.421 5.503 30 20 GKED CCc1noc(C)c1C(C)=NNc1ccc(Br)cc1C(F)(F)F 769791281 GIRVGJVRNBGWLE-UHFFFAOYSA-N 390.203 5.163 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccnc(Cl)c3)n2)cc1 771261301 MPWHRTJTCMWLQA-HQQUCIOCSA-N 379.872 5.057 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccccc2OC(F)(F)F)c1 772985721 XPUBXHHYJCQCAJ-HOCLYGCPSA-N 378.394 5.117 30 20 GKED C[C@H](NCC/C=C/c1ccc(Br)cc1)c1ccc(OCC#N)cc1 775336629 OHAYSHWUUMIRBB-ICTCPBKTSA-N 385.305 5.106 30 20 GKED N#CC1(c2ccc(COC(=O)COc3ccccc3-c3ccccc3)cc2)CC1 777148274 NJMIZILIFYZRER-UHFFFAOYSA-N 383.447 5.031 30 20 GKED CC(C)Oc1ccc(NCc2cn(C)nc2-c2ccc(C#N)cc2)cc1Cl 778077174 SCCGAMYGNZFSQZ-UHFFFAOYSA-N 380.879 5.011 30 20 GKED CC(C)c1ncc(CNc2ccc(OCc3cccc(C#N)c3)c(F)c2)s1 779596376 UXPBAYFXLUOEIU-UHFFFAOYSA-N 381.476 5.468 30 20 GKED C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1cccc(C#N)c1 781873502 QDQXOVSKVHXIIJ-SSDOTTSWSA-N 390.053 5.485 30 20 GKED O=C(/C=C/c1cccc2cnccc12)c1ccc(OC(F)F)cc1OC(F)F 782879475 GASYHCUEYGQDFM-QPJJXVBHSA-N 391.320 5.334 30 20 GKED N#CC[C@@H](CC(=O)OCc1ncc(-c2cccc(Cl)c2)o1)c1ccccc1 795993033 SDDVLFHTUDOIQQ-INIZCTEOSA-N 380.831 5.126 30 20 GKED CON(Cc1ccccc1Cl)C(=O)Nc1ccccc1SC[C@@H](C)C#N 810183705 DARLWMZFPMXHPB-AWEZNQCLSA-N 389.908 5.187 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cnn(-c2ccccc2Cl)c1)c1ccccc1 814647766 JFUVARKWASOFOS-IBGZPJMESA-N 393.878 5.082 30 20 GKED C=CCN(CCC#N)C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 816803343 XDIJTRVDGVFPFW-UHFFFAOYSA-N 398.491 5.053 30 20 GKED N#Cc1cscc1C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 839256918 SLXRKJIZWCJETR-LLVKDONJSA-N 383.325 5.158 30 20 GKED C#CC[C@H](NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1 852229140 MNSLOJHKBRZKJY-HNNXBMFYSA-N 394.359 5.104 30 20 GKED COc1cccc(SCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 916050780 HFCXUOPICXJGHV-JOCHJYFZSA-N 388.492 5.081 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SC)cc2)cc(Br)c1O 916133353 IKKLABAGKHNXOA-RUDMXATFSA-N 393.302 5.171 30 20 GKED O=C(/C=C\c1cccc(O[C@@H](C(=O)O)c2ccccc2)c1)c1ccccc1Cl 1776115391 XFCVEUNCFIHPMH-KCNXZKISSA-N 392.838 5.441 30 20 GKED C=CC[C@@H](CC(C)C)C(=O)Nc1cc2c(c(C(=O)O)c1)Oc1ccccc1O2 1776151948 LGJOJTNERLFHGW-AWEZNQCLSA-N 381.428 5.460 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 1776783078 WOMDRAKGVHEPMY-INIZCTEOSA-N 388.464 5.148 30 20 GKED Cc1ccc(C[C@@H](C#N)Sc2nnc(-c3ccco3)n2C2CCCCC2)cc1 7442288 CBUQFMHQXDDWGN-IBGZPJMESA-N 392.528 5.579 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(F)c(F)c(F)c1F 14582961 OHCALRYBPTXONK-UHFFFAOYSA-N 395.274 5.303 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc3oc(C4CC4)nc3c2)o1 52641935 GQRYPIXCTJILKB-UHFFFAOYSA-N 399.406 5.001 30 20 GKED CC(C)Cc1nc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)cs1 63596248 GJEMDWLNZAMLNY-UHFFFAOYSA-N 393.537 5.293 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2s1)c1nc(-c2c(F)cccc2F)cs1 64714732 KPPDZOWXAOREBE-GFCCVEGCSA-N 396.443 5.793 30 20 GKED N#Cc1ccccc1NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 102831131 GOBNXYDBFZWRAT-UHFFFAOYSA-N 388.279 5.170 30 20 GKED N#CCCSc1ccccc1NC(=O)CCOc1ccc2ccccc2c1 108199995 PXACNNKERQOBOB-UHFFFAOYSA-N 376.481 5.253 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCc1ccc(C#N)cc1)C1CC1 121501553 YQCBBAHDNCGIER-CQSZACIVSA-N 387.405 5.012 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(Br)s1 173133898 QPORSNYTTWKOAO-NSHDSACASA-N 395.347 5.259 30 20 GKED N#C[C@@H](C(=O)CC[C@H]1CCOC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 176098049 ZTNRFNDMRXPYNR-FZMZJTMJSA-N 395.311 5.110 30 20 GKED Cc1cnc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 177085964 FKCUESJTGXFNMI-CYBMUJFWSA-N 396.447 5.137 30 20 GKED CC(=O)N(c1nc(CSc2cccc(C#N)c2)cs1)c1ccc(C)cc1C 177104180 DFFJGXPDXIBRDI-UHFFFAOYSA-N 393.537 5.609 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3cnccn3)n2)o1 186140588 STXPBFIBGLNVGF-NSHDSACASA-N 390.390 5.184 30 20 GKED CN(C(=O)c1cccc(SCC#N)c1)c1ccc(OCc2ccccc2)cc1 187910183 XRXAOBRETBZIDJ-UHFFFAOYSA-N 388.492 5.158 30 20 GKED CCCc1ccc([C@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2cccs2)cc1 236966958 AVCADWHFUVNHPH-UUOWRZLLSA-N 390.552 5.871 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](COc2ccccc2)C1 272598531 XESWSBNVYLTKMN-QZTJIDSGSA-N 395.528 5.014 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 303581247 OYSCRKTYUWFBIX-MRXNPFEDSA-N 376.481 5.032 30 20 GKED Cc1cc([C@H](/N=C(/O)c2sc([C@@H]3CCCOC3)nc2C)C2CC2)ccc1F 328971315 VAUHBFPYKOJZSS-SJLPKXTDSA-N 388.508 5.249 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1scnc1C1CCCC1 329511644 KRLYTRZOUJQLCY-QGZVFWFLSA-N 384.549 5.495 30 20 GKED Cc1csc(-c2cccc(N=C(O)N3CCC[C@@H]3c3noc(C(C)C)n3)c2)n1 330250711 NCHDMVVIINIXCF-MRXNPFEDSA-N 397.504 5.008 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2 410980413 FTPFBSZCZHRQCA-JTQLQIEISA-N 380.391 5.096 30 20 GKED C=C(C)[C@@H](NCCC(=O)Nc1ccccc1C(F)(F)F)c1ccc(F)c(F)c1 411554632 LQAAYHNLNCWIMB-LJQANCHMSA-N 398.375 5.219 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1CCC[C@H]1c1ccc(OCC)cc1 424256420 VMNPNHLZLYCXQX-PMACEKPBSA-N 398.576 5.163 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(Cl)cc1OCC(F)F 425672980 MEVZLPLSLAMIFC-GFCCVEGCSA-N 393.821 5.080 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCS1 435112858 ZNCXYUDFXOMNHJ-GOSISDBHSA-N 399.947 5.355 30 20 GKED C[C@@H](NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1)c1ccc(C#N)cc1 437839609 VACDLCVETDHFEK-QZTJIDSGSA-N 383.495 5.708 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 438060167 PMOREFNJZVDJCL-NQIIRXRSSA-N 393.556 6.006 30 20 GKED C=CCN(C(=O)c1cc(F)cc(C(F)(F)F)c1)c1nc2c(s1)CCCC2 445684980 YEGUSTBFEKDYFN-UHFFFAOYSA-N 384.398 5.013 30 20 GKED CCc1nc(C)c([C@@H](C)N(C)C(=O)N[C@@H](CCCC#N)c2ccccc2)s1 458808243 YRQYWXWGFVEFIZ-AEFFLSMTSA-N 384.549 5.152 30 20 GKED C=C(C)COc1cc(CNC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)ccc1OC 464049307 KNFAEHGWMKLGES-DHLKQENFSA-N 395.543 5.216 30 20 GKED CCS[C@H]1CC[C@H](N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1 464881529 UDOURALUBWXWPM-RXVVDRJESA-N 380.513 5.097 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 469871441 HBONTYGXLUYQIO-UHFFFAOYSA-N 398.249 5.613 30 20 GKED CCOc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H](C)c1ccc(C#N)cc1 470023149 WYOMMKUNYZANSO-UWJYYQICSA-N 379.504 5.105 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2csc(-c3cccc(Cl)c3)n2)n1 474449825 VYBNTXDQVKEWIB-CYBMUJFWSA-N 387.917 5.533 30 20 GKED CCCc1c(NC(=O)C[C@@H](CC#N)c2ccccc2)cnn1-c1ccc(C)cc1 477090186 PTGYRCJBFICKFH-HXUWFJFHSA-N 386.499 5.159 30 20 GKED N#CCCCCN[C@@H]1CCCc2nc(-c3ccccc3Br)sc21 482434702 GKHFOXZEEUNKJD-OAHLLOKOSA-N 390.350 5.233 30 20 GKED N#Cc1ccsc1NC(=O)c1ccc(Oc2cccc(Br)c2)cc1 486997409 OROXAJFPABNHLY-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1csc(C(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c1Br 489752120 NHIKDDUYQCQYMB-CQSZACIVSA-N 391.334 5.111 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)[C@@H](C)c1ccc(C#N)cc1 493976474 IBGIKHBMQRCPKD-VHKYSDTDSA-N 397.316 5.034 30 20 GKED C=CCc1cc(CNC(C)(C)c2ccc(Cl)c(Cl)c2)cc(OC)c1O 500132505 OUUPKTDIFUSVDD-UHFFFAOYSA-N 380.315 5.461 30 20 GKED Cc1cc(-c2csc(Nc3ccc(C#N)cc3)n2)c(C)n1CC(F)(F)F 500402487 XLQQBDHCBMXAIP-UHFFFAOYSA-N 376.407 5.406 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1cc2ccccc2o1 502390089 GHJXUUIKEUZXTP-QGZVFWFLSA-N 380.492 5.059 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@H]1CCc2ccccc21 510645575 MWYOSCZCECFODZ-QFIPXVFZSA-N 383.451 5.502 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 510667542 PORZUZZZNFEWDI-GOSISDBHSA-N 385.467 5.884 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(-c2cccc(F)c2)no1 514815249 JBNWPAWLUDMJSR-UHFFFAOYSA-N 376.840 5.024 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521259709 QAWNCWIFBXEZJQ-XLIONFOSSA-N 379.529 5.616 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC1 522517305 VIYWOMVSWAABEQ-LJQANCHMSA-N 377.488 5.034 30 20 GKED CCN(C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 523113498 WVZBHFSUAWPNHQ-HZPDHXFCSA-N 388.433 5.365 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc(Cl)cc2Cl)c1 523957715 ISYDYNUFVMWDHQ-UHFFFAOYSA-N 387.222 5.289 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1csc(-c2ccc(F)cc2)n1 530970916 UEAIPAXPBPIAQW-SFTDATJTSA-N 377.488 5.221 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cccc([C@H]4CCOC4)c3)n2)cc1 534926785 PZCSCSOWLUCPHD-VQTJNVASSA-N 388.492 5.113 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@H]1c1cccc(Br)c1)c1ccccc1 535354188 JEAYFTCMUHCJOO-UZLBHIALSA-N 384.317 5.473 30 20 GKED CCN(C(=O)c1csc(-c2cccc3ccccc23)n1)c1ccc(C#N)cc1 539759404 IVNJJHJJCJNKGK-UHFFFAOYSA-N 383.476 5.502 30 20 GKED C=C(C)[C@@H](CC(=O)N(C)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)OCC 541253762 XRPLSVQGBAZHOQ-ZBFHGGJFSA-N 397.359 5.139 30 20 GKED N#Cc1cc(C(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)ccc1Cl 542541890 AZJNODIFHUAVGT-UHFFFAOYSA-N 382.250 5.107 30 20 GKED C[C@@H]1COc2ccccc2CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 543852290 NXSKJHFUBYFPRW-QGZVFWFLSA-N 399.450 5.166 30 20 GKED C[C@@H](Nc1ccccc1NC(=O)CSc1ccc(C#N)cc1)c1ccccc1 559250130 LAFKUZTUVGXAEQ-QGZVFWFLSA-N 387.508 5.462 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@H]1Cc1ccccc1 577013200 IWBVYIHEEARBMT-ICSRJNTNSA-N 393.556 5.710 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCc3cc(F)ccc32)cc1 577078634 WTWYMPJKSCVDMN-UHFFFAOYSA-N 388.467 5.193 30 20 GKED C=CCCO[C@@H](C)c1nc([C@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 577680848 WYHSFOWMISQTOB-XHDPSFHLSA-N 388.361 5.007 30 20 GKED C=CCOc1ccccc1CNC(=O)c1ccccc1SCc1cccs1 599819400 CFNWNNLVPDDAJJ-UHFFFAOYSA-N 395.549 5.535 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 603872662 BQLAQILARGRIHF-UHFFFAOYSA-N 376.481 5.477 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(N2CCCC2)c(F)c1 609298507 RPQOQGBAMRROLR-UHFFFAOYSA-N 391.471 5.278 30 20 GKED CC1(CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CCCC1 609422120 HTCJTCLJGCFAMV-UHFFFAOYSA-N 377.488 5.033 30 20 GKED CCc1cccc(CC)c1S(=O)(=O)Nc1ccccc1S[C@@H](C)CC#N 609873228 OSCBWZRBLNZQDS-HNNXBMFYSA-N 388.558 5.006 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCc1ccccc1)c1ccccc1)c1cccc(C#N)c1 610357243 JIWJDMRUXBPGAA-DVECYGJZSA-N 383.495 5.293 30 20 GKED O=C(c1ccc(F)c2ccccc12)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 684566010 COYXCIXLFJGGQC-QWRGUYRKSA-N 393.302 5.182 30 20 GKED CN(CCC1CCCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 726075050 ZQOHATOMUXSEOK-QHCPKHFHSA-N 375.516 5.776 30 20 GKED Cc1ccccc1NC(=O)[C@H](C)Nc1ccc(OCc2cccc(C#N)c2)cc1C 728061954 BYTINYZUGWEJDT-IBGZPJMESA-N 399.494 5.193 30 20 GKED Cc1ncccc1/C=C\C(=O)c1sc(-c2ccccc2Br)nc1C 730148639 IRGPKDRGMBKPHM-KTKRTIGZSA-N 399.313 5.481 30 20 GKED CC[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccccc1OC 731360846 QMLNBTPBJDWIKB-XMMPIXPASA-N 386.495 5.387 30 20 GKED CCCC[C@@H]1CCCC1=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1 733080165 GAJXAAFYYZCKQX-CYBMUJFWSA-N 377.414 5.316 30 20 GKED N#Cc1ccc(NC(=S)N[C@@H](Cc2ccccc2)c2cccs2)cc1Cl 734982422 DBEIPCAFOPLEAL-SFHVURJKSA-N 397.956 5.544 30 20 GKED CC(C)(Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 735592681 CQQMMAGAXPIXJM-GOSISDBHSA-N 394.927 5.909 30 20 GKED CC(C)[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 740531432 UBTZXENPQSFRES-IAGOWNOFSA-N 382.916 5.641 30 20 GKED C/C(=C/C(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 742646386 NMWUMEMWPAWKEQ-GKUQOKNUSA-N 378.781 5.143 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=S)NCc1ccccc1 745723533 BAQKWOAWTYDVMB-UHFFFAOYSA-N 389.499 5.087 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(-c3ccncc3)cc2)cc(Cl)c1OC 745990242 PDPLSJZYUONONE-RUDMXATFSA-N 393.870 5.705 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC)cc2)ccc1OCC(F)(F)F 750901072 BWMTUUVZTAZPNK-OQFOIZHKSA-N 382.403 5.254 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Br)cc2F)cc(Cl)c1OC 767736422 KPJHDMCGRNDFED-UTCJRWHESA-N 399.643 5.155 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CC3(CSc4ccccc4)CC3)[nH]c12 770870978 MTZWDNZUZWVFDO-QGZVFWFLSA-N 375.497 5.010 30 20 GKED COCc1cc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)ccc1OC 774477882 MEMFLVWKUQMWPC-SFHVURJKSA-N 386.495 5.231 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3O[C@H](C)C#N)s2)c(C)c1 780178378 SOIJIJPNVSKRGH-OAHLLOKOSA-N 391.496 5.279 30 20 GKED C[C@@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c[nH]c2ccccc12 782548014 ZOEFURITNHNTQC-FDDCHVKYSA-N 393.490 5.956 30 20 GKED C=CCN(C(=O)c1nc(Cl)sc1C)c1nc(-c2ccccc2)cs1 788122696 CHZQIQOGCNRDQM-UHFFFAOYSA-N 375.906 5.061 30 20 GKED N#Cc1cnc2c(c1)CC/C(=C/c1ccc(-c3nc4ccccc4s3)o1)C2=O 788357347 QKMHAGDJVNCHJC-GDNBJRDFSA-N 383.432 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](c1ccccc1)N1CCOC1=O 789721307 ZOCRXCZPSPNTLD-OAQYLSRUSA-N 392.499 5.061 30 20 GKED CN(C)Cc1cnc(/C=C/C(=O)c2ccc(Oc3ccccc3)c(F)c2)s1 794699460 MJPOXCZFXDGHQY-PKNBQFBNSA-N 382.460 5.032 30 20 GKED N#C[C@H](C(=O)[C@H]1Cc2ccc(F)cc21)c1nc(-c2ccc(Cl)cc2)cs1 796632204 CNCFKQVMFRQSTF-DLBZAZTESA-N 382.847 5.119 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570731 JJYMATBONPLEEF-CQSZACIVSA-N 399.516 5.278 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2nc3ccccc3cc2Cl)cc1 810115522 ZNLISOBOUILCMJ-FQEVSTJZSA-N 397.865 5.796 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1csc(C)n1 812442674 CMVLXDABJIVUBV-UHFFFAOYSA-N 383.477 5.098 30 20 GKED CCOC1CCC(=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CC1 853281526 WCTVIFPNNBAQIM-UHFFFAOYSA-N 384.480 5.244 30 20 GKED CC(C)c1ccc(Nc2nn(CN3CCC[C@@H](CC#N)C3)c(=S)s2)cc1 853526624 VBTIGAGRTOLCJK-HNNXBMFYSA-N 387.578 5.124 30 20 GKED C=CCOc1c(Br)cc(CNc2ccc3occc3c2)cc1OC 864017852 DQZKNXTXPQRAMY-UHFFFAOYSA-N 388.261 5.381 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(OCc2ccc(C#N)cc2OC(F)F)c1 864046539 DLZBWDHEQFOEEA-UHFFFAOYSA-N 390.386 5.086 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1 915085499 BZBBHOKWRGWVNC-HXUWFJFHSA-N 380.369 5.613 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)s1 916849639 WKNXOVXVTHUQDY-HNNXBMFYSA-N 389.505 5.147 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1Cl 917026041 VRKAYXDGWWEATF-QGZVFWFLSA-N 380.900 5.581 30 20 GKED CCSCc1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc([C@@H](C)CC)cc2)cc1 918486996 NTZRSKFSRQLOIV-KKSFZXQISA-N 394.540 5.414 30 20 GKED CC[C@@H](C)CON=C(C)CCc1ccc(OCc2cccc(C(=O)O)c2)cc1 1776077896 KMADTHBYGZCXOP-QGZVFWFLSA-N 383.488 5.335 30 20 GKED CCCOc1ccc(C(C)=NNc2cccc(C(=O)O)c2C)cc1OCCC 1776086428 UGODINGDJNNLBW-UHFFFAOYSA-N 384.476 5.107 30 20 GKED C=C(C)COc1cc(/C=C/c2cc(C(=O)O)c3cc(C)ccc3n2)ccc1OC 1776140051 GHNKZFIZXTYWOM-SOFGYWHQSA-N 389.451 5.375 30 20 GKED CC(C)Oc1ccc(F)cc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776358489 CNOYDICNPOUKNQ-CLFYSBASSA-N 394.398 5.467 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)cc1OC 1776801133 FIGSCNVIYSLDHH-YVMONPNESA-N 394.423 5.215 30 20 GKED CCc1cccc2cc(/C=C\C(=O)c3cc(C(=O)O)ccc3OC(C)C)oc12 1776977827 LZJAGXINPAYDEY-KTKRTIGZSA-N 378.424 5.377 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(OCC#N)cc2)cc1OCc1ccccc1 6432298 QHCMZOYQKXEPDY-NTUHNPAUSA-N 399.446 5.073 30 20 GKED C=CCn1c(SCc2coc(-c3cccc(Cl)c3)n2)nnc1-c1ccco1 26118381 QPLGNFPYGAMEQV-UHFFFAOYSA-N 398.875 5.325 30 20 GKED N#Cc1ccc(CCC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1 41136589 HUXGVLSHTRQIFU-NRFANRHFSA-N 380.900 5.112 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)[C@@H](C#N)c2ccccn2)c(C)c1 46706099 CHYAOVZYUUCXOG-NRFANRHFSA-N 392.462 5.041 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3ccccc3S[C@H](C)CC#N)cs2)o1 66800285 CYVVPFIHIPGIMI-CQSZACIVSA-N 397.525 5.287 30 20 GKED CCCOCc1ccccc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 108532600 GOKSTDHUOIJRDS-KRWDZBQOSA-N 397.544 5.187 30 20 GKED C=CCOc1ccc(C(=O)N2CCC[C@@H]2[C@@H](CC)c2ccccc2)cc1OC 116161101 ZUIBDYYTPOPNKF-LEWJYISDSA-N 379.500 5.058 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(OCc3ccccc3C#N)c2)cc1 116712480 NLBHMWYKNZWTQE-UHFFFAOYSA-N 395.462 5.006 30 20 GKED N#Cc1ccc(-c2nnc(CSc3nc(-c4ccc(F)cc4)cs3)o2)cc1 133010519 XKQNPECXLBXJOP-UHFFFAOYSA-N 394.456 5.163 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3ccccc3F)n2)cc1 170673819 OEHZTLKGCFCVIM-RDTXWAMCSA-N 394.471 5.328 30 20 GKED COc1cccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 175947727 XZIWWRILLDNNBT-LRDDRELGSA-N 384.888 5.328 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2C)n1)c1ccc(C#N)c(Cl)c1 179529916 GRSLZVPQPLYGAF-UHFFFAOYSA-N 381.888 5.310 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1S[C@@H](C)CC#N 184019452 VRUISEQHCLXUTI-GJZGRUSLSA-N 380.473 5.016 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 186663313 OOOCOGQJNAOSBW-NRFANRHFSA-N 383.451 5.352 30 20 GKED N#Cc1ccc(CN(C(=O)CCCCc2nc3ccccc3s2)C2CC2)cc1 193052570 QLHMHFFLORUXCH-UHFFFAOYSA-N 389.524 5.072 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2cccc(N3CCOC3=O)c2)cc1 208088111 SVZDHMYRMUYDPT-RAXLEYEMSA-N 379.456 5.108 30 20 GKED Cc1nc(C2CC2)oc1C(O)=Nc1ccccc1NC12CC3CC(CC(C3)C1)C2 329803394 ZQIXMAOUFPWJNS-UHFFFAOYSA-N 391.515 5.877 30 20 GKED N#CCCC[C@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccccc1 410958789 XZDOEVFKIASSCH-INIZCTEOSA-N 382.332 5.149 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cccc(SCC#N)c3)c2C#N)[C@H](C)C1 410977212 KOTDEVKWRXAITG-QWHCGFSZSA-N 381.526 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H]1CC(C)(C)Oc2ccccc21 412092093 QJFQFBDXTBGZGG-NVXWUHKLSA-N 380.513 5.364 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cc(F)ccc1SCC(F)F 425654975 PPJABCJTFPFQPH-GFCCVEGCSA-N 393.434 5.279 30 20 GKED Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cc1Br 425664116 NZBFZXZDGJJASR-AWEZNQCLSA-N 386.293 5.163 30 20 GKED Cc1nc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c(-c2ccccc2)s1 430647474 XYOVTWWUFQDZHV-AWEZNQCLSA-N 381.526 5.363 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1 432864905 IYRLXOSSWSIFSA-MRXNPFEDSA-N 379.357 5.401 30 20 GKED CC[C@@H](C#N)Sc1nnc(-c2cc(-c3ccccc3)nc3ccccc23)n1CC 436048082 UVJJXCQVJKYMAD-KRWDZBQOSA-N 399.523 5.574 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1cccnc1Oc1ccc(Cl)cc1Cl 437162075 FQFAMMJCLILICA-UHFFFAOYSA-N 388.210 5.206 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(C(=O)NCCC)c(Cl)c2)CCCC1(C)C 445237188 HBNDPTGOHVPCEA-SFHVURJKSA-N 391.943 5.078 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(CSC(C)C)c2C)cc(OC)c1OC 460257920 KCAIBMLNGVMJAB-UHFFFAOYSA-N 399.556 5.635 30 20 GKED C[C@@H](C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1)c1cccc(C#N)c1 464099804 RHKVETUFZYNLQS-CYBMUJFWSA-N 380.369 5.385 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)NCc2ccc(C#N)cc2)cc1 465513959 CSKCPBNWBPYECJ-SFHVURJKSA-N 399.494 5.136 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 470477864 PZZJFEDOFPNJAW-FQEVSTJZSA-N 385.511 5.250 30 20 GKED CSc1ccccc1CN(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 471277036 LEKSJEYZMRIKDJ-OAHLLOKOSA-N 385.558 5.324 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2c(CCC)cccc2C(C)C)cc1 471904704 GLALXENXXSRDCX-UHFFFAOYSA-N 394.519 5.714 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1nc2ccccc2o1 474949432 DHQJPOIHROJNJD-CYBMUJFWSA-N 396.324 5.597 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccc(C)cc2)c2ccccn2)cc1Cl 475332207 JOLRSIOQKQJKJH-QHCPKHFHSA-N 378.903 5.487 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)ccn1 475757836 VNWSEJMMUTWYHV-UHFFFAOYSA-N 375.431 5.540 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cc(OC)ccc1Br 485332672 RQNZJSCJYTUWGJ-UHFFFAOYSA-N 381.314 5.058 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1c(F)ccc(Br)c1F 485693502 JOVKJPOYBIZTFW-UHFFFAOYSA-N 394.259 5.832 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc(Cl)c3)c2)cc1 501446775 UMRHEKPIMGPXPO-UHFFFAOYSA-N 376.843 5.237 30 20 GKED C=CCOc1ccccc1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 501450967 IOGYSJNVIWNYKW-UHFFFAOYSA-N 398.462 5.149 30 20 GKED CCCCOc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)c(C)c1 502632471 GWBXPTUDQQGECL-UHFFFAOYSA-N 381.476 5.501 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@H](C)c3cccnc3)n2)o1 504486555 CXSNDKTXFUSFIX-GFCCVEGCSA-N 389.402 5.789 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C 510626503 GQJNIKPTVHAJED-CYBMUJFWSA-N 392.425 5.358 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCC[C@@H]1c1cccc2ccccc12 510871511 HXKPRXPWTLGUDK-JOCHJYFZSA-N 385.467 5.479 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCC#Cc1cccc(F)c1 512156398 NWDMHDYDIOUCAS-GOSISDBHSA-N 392.499 5.212 30 20 GKED CC(C)CCc1ccccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 520923797 LGIOUHBPOHXBAE-UHFFFAOYSA-N 388.467 5.571 30 20 GKED CCN(CC)C(=O)[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 522548613 CSUSSUSDKYXHAM-XMMPIXPASA-N 399.494 5.372 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2F)c1 524460160 DKXVWKLGNKEKPD-UHFFFAOYSA-N 385.398 5.010 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccccc1 524916886 IGQNNDCEXZPPRK-MRXNPFEDSA-N 388.496 5.639 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)c2ccc(C3(C#N)CC3)cc2)cc1 539656936 BIWWNDPQMIKMQF-SFHVURJKSA-N 396.490 5.408 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CC2)c(OC(F)F)c1 549412388 VIXFNQXXZFJYPV-GOSISDBHSA-N 396.359 5.419 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](NC2(c4cccc(C#N)c4)CC2)CCC3)cc1 560263376 SJQULSZVUYGHPY-NRFANRHFSA-N 385.536 5.647 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 570706877 ZOENYMLGHIMUNW-BJKOFHAPSA-N 387.527 5.326 30 20 GKED C[C@@H]1CC(CCNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C[C@@H](C)O1 577709284 IPIKBWBDDMYVSN-IAGOWNOFSA-N 393.487 5.066 30 20 GKED C[C@@](C#N)(NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C1CCCCC1 578164380 AWFDQXWFOHZAEZ-QHCPKHFHSA-N 391.446 5.082 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2noc3cc(F)ccc23)CC1)c1ccccc1 581698670 QNODEXUSWMPMIA-INIZCTEOSA-N 378.447 5.033 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N3CCC4(CCC4)CC3)c2)cc1 588236814 HIXGGXPZODFHRX-UHFFFAOYSA-N 389.499 5.130 30 20 GKED Cc1c(C(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)sc2ccc(C#N)cc12 589985252 MVPBYRXJCWLEBO-KGLIPLIRSA-N 380.435 5.180 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 596104226 WWMISHQDXBTVGM-UHFFFAOYSA-N 384.435 5.261 30 20 GKED CC(C)C(=O)Nc1ccc(Cl)c(C(=O)N(c2ccc(C#N)cc2)C2CCC2)c1 598886713 ITLGCOXBEXHKPN-UHFFFAOYSA-N 395.890 5.005 30 20 GKED CC[C@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 600002801 XNPQQIYUUVDOMF-HOTGVXAUSA-N 395.528 5.172 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3occc3-c3ccccc3)c2)cc1 609177442 ULXCIPQSDMNMPI-UHFFFAOYSA-N 380.403 5.863 30 20 GKED Cc1cc(Cl)ccc1O[C@@H](C(=O)Nc1ccc(CC#N)cc1)c1ccccc1 609296933 KSMOLURYVBFGTF-JOCHJYFZSA-N 390.870 5.473 30 20 GKED COc1ccc2c(c1)[C@@H](N(Cc1ccccc1)Cc1ccccc1C#N)CCO2 610215875 AHTNJGSOACCMRQ-DEOSSOPVSA-N 384.479 5.093 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1ccccc1C(F)(F)F 610223477 LWECCHSTZZPYMC-MRXNPFEDSA-N 388.433 5.365 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](C)c2cccc(C#N)c2)cc1 610344675 DXRVPDIHNHUSFV-FQEVSTJZSA-N 392.506 5.570 30 20 GKED CCOc1ccc([C@@H](NC(=O)N[C@H](C)c2cccc(C#N)c2)c2ccccc2)cc1 610355469 RSXYAGZPTPUDAA-KOSHJBKYSA-N 399.494 5.107 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](C(F)(F)F)CC[C@H]1C 611557357 LUPLXEPXXUCSHL-MGPQQGTHSA-N 385.455 5.276 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3sc4c(c3C#N)CCCCC4)cc2c1 619564180 WBKXJKZKNUBUKK-UHFFFAOYSA-N 375.497 5.306 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2cc3cccc(OCC)c3o2)ccc1OC 622266335 VOKMGIIXTCOQOT-QGZVFWFLSA-N 395.499 5.646 30 20 GKED C=CCC[C@H](NC(=O)N1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1)c1ccccc1 676422915 GKTWAYOYFUHZOH-KFWWJZLASA-N 394.359 5.076 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 676999337 VQZYRUYWBGQUGE-ZDUSSCGKSA-N 383.835 5.369 30 20 GKED CCOc1cc(/C=C2\CCc3sccc3C2=O)cc(Br)c1OC 726892047 KYRLANVHRWSLSX-XYOKQWHBSA-N 393.302 5.130 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(OC)c(OC)c3)s2)cc1 727975976 ZFZMLCMXQFZKLW-WZUFQYTHSA-N 395.480 5.040 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(\Cl)c2ncc(-c3ccc(Cl)cc3)o2)cc1 728698424 JYRHCZRDPKCVFR-CCOVPTLTSA-N 385.250 6.023 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cccc(OCC#N)c2)CC3)cc1 730149046 ANURWKNQJWSGOG-AQTBWJFISA-N 386.476 5.233 30 20 GKED Cc1oc(-c2ccccc2F)nc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 737469243 HAPITYUIGXVDSF-NSHDSACASA-N 395.459 5.099 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)NCCc2cccs2)cc1F 743038324 XWLNCUPJMIMSQG-UHFFFAOYSA-N 397.500 5.080 30 20 GKED CCN(CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 743887125 MJQGGKRSWGEWHE-UHFFFAOYSA-N 385.467 5.124 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCC(=O)c2ccc3ccccc3c2)n1 747193692 NGVBJBCERAPAJW-SFHVURJKSA-N 376.481 5.259 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Cc2ccc(Cl)cc2Cl)n1 747197394 YVGOYTHCSFLJQZ-SMDDNHRTSA-N 381.328 5.628 30 20 GKED N#C[C@H](C(=O)CCc1cncc2ccccc12)c1nc2cc(Cl)ccc2s1 765591244 SOORZSPGFRCKPH-QGZVFWFLSA-N 391.883 5.307 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)c(Cl)c1 765606365 VMWMOSKYVPVHDY-WTKPLQERSA-N 382.872 5.540 30 20 GKED CC[C@@H]1Cc2ccccc2CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 767585810 MEXDIKDDVKROJD-JWQCQUIFSA-N 395.506 5.711 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nn(-c2ccccc2)c(=S)s1 775143825 OWFKZTCNEWDRFV-UHFFFAOYSA-N 375.931 5.481 30 20 GKED C=CCC[C@H](NCc1ccc(OC(C)=O)cc1)c1ccc(C(F)(F)F)cc1 775551747 AOMQJLZXHZNJTJ-FQEVSTJZSA-N 377.406 5.428 30 20 GKED C[C@@H](CCc1ccc(Br)cc1)N[C@@H](C)c1ccc(OCC#N)cc1 776154473 CEFCKTMMXFMCFT-HOTGVXAUSA-N 387.321 5.023 30 20 GKED N#C[C@H](C(=O)COC(c1ccccc1)c1ccccc1)c1nccc2ccccc12 792094040 MJEBYICHOUUCKI-HSZRJFAPSA-N 392.458 5.217 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1ccccc1 793961763 FKHGXQLLYBGBTE-WMLDXEAASA-N 389.282 5.021 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nnc(-c2cccc(Cl)c2)o1 795980978 AODLMWHDVINKSE-HOCLYGCPSA-N 395.846 5.082 30 20 GKED C[C@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccc(Cl)cc2)no1 795984627 UOWZBHXEPYFLHD-YOEHRIQHSA-N 395.846 5.082 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)CCn2ccc3cc(Cl)ccc32)s1 797569157 BCUUGHWSCBSSFT-HNNXBMFYSA-N 385.920 5.315 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797571890 WVUZZSFZXHGPTB-CQSZACIVSA-N 398.919 5.078 30 20 GKED Cc1nc(-c2cccc(NCc3cc(C#N)ccc3Br)c2)cs1 863998608 ITWVAMZDGOKNAL-UHFFFAOYSA-N 384.302 5.365 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)c1nc(-c2ccccc2OCc2ccccc2)no1 904467017 TZEWBPHFGLMETH-SFHVURJKSA-N 395.462 5.533 30 20 GKED C=CC[C@H](c1ccccc1)c1nc(-c2cccc(OCc3cccnc3)c2)no1 904502748 MAQGIRBMIMCAHQ-JOCHJYFZSA-N 383.451 5.419 30 20 GKED Cc1ccc([C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C2CC2)cc1 915350348 UFTKGNLZVRDLTA-JWQCQUIFSA-N 395.506 5.923 30 20 GKED CC[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 915352368 KMNXXJUUMOVKPB-DVECYGJZSA-N 383.495 5.657 30 20 GKED N#CCCn1cc(C=NNc2nc(-c3ccccc3)cs2)c(-c2ccccc2)n1 916545556 NJXGWHIILVYJPZ-UHFFFAOYSA-N 398.495 5.033 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSc2cccc(C(F)(F)F)c2)c1C 917156281 KBUMDYDEOHQROZ-UHFFFAOYSA-N 392.446 5.361 30 20 GKED O=C(O)c1cc(NN=C(CCc2ccccc2)Cc2ccccc2)ccc1Cl 1776033474 NQQMOWPXRPRZBF-UHFFFAOYSA-N 392.886 5.682 30 20 GKED O=C(O)c1cc(NN=C2CCCCC[C@H]2c2ccc(Cl)cc2)ccc1Cl 1776033885 UAECXWCKXLJJSZ-INIZCTEOSA-N 391.298 6.207 30 20 GKED O=C(/C=C/c1cccc(OCc2ccccc2C(=O)O)c1)c1ccc(Cl)cc1 1776115377 WUMLIJCSKPAXRD-MDWZMJQESA-N 392.838 5.513 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(Cl)c(Cl)c1 1776354414 LLOAOXZLBBNMNJ-QPJJXVBHSA-N 379.239 5.375 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC)c(OCCC(C)C)c1 1776783899 JHNGHLZTZUKIKS-FQEVSTJZSA-N 393.568 5.414 30 20 GKED Cc1cc2c(s1)C/C(=C\c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777428150 YLRZDOYCNHRKCV-LICLKQGHSA-N 390.460 5.156 30 20 GKED O=C(O)/C=C\c1ccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)cc1 1777623988 IUMGKPQNTYCXIE-OZDSWYPASA-N 381.642 5.641 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1 1777684971 PSHAJPPPJNCFOH-SNAWJCMRSA-N 388.263 5.319 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1 25438385 QTAHBOWDOZDVDZ-UHFFFAOYSA-N 389.307 6.262 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)oc2ccc(F)cc12 41558310 SKTMVVNQYBXARQ-CYBMUJFWSA-N 383.329 5.115 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1coc(-c2cccs2)n1 54023596 RLGBKNAMUBPVGE-UHFFFAOYSA-N 393.921 5.016 30 20 GKED N#CCSc1ccccc1NC(=O)CSCc1cccc2ccccc12 58486027 GNIQRYCNCNDSLP-UHFFFAOYSA-N 378.522 5.327 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(OCCC(C)C)c1 63394566 BXPXVKDPWSCEBH-UHFFFAOYSA-N 377.488 5.203 30 20 GKED Cc1ccnc(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)n1 115128809 ACEZMPXEOOAOCV-UHFFFAOYSA-N 390.446 5.243 30 20 GKED O=C(c1sccc1SC(F)F)N1CCC(C(F)(F)F)(C(F)(F)F)C1 117203066 KZNATTWHXHNEDC-UHFFFAOYSA-N 399.328 5.020 30 20 GKED CC[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccc(C)cc1 122024083 RVPHTPWHJKUSHF-QFBILLFUSA-N 375.497 5.274 30 20 GKED Cc1cc(Br)c(NC(=O)c2cccc(SCC#N)c2)cc1Cl 153887862 IOASGXGCXRTULQ-UHFFFAOYSA-N 395.709 5.279 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1cccc(F)c1F 161576840 NZSKPLLHNNYMEO-CHWSQXEVSA-N 375.444 5.242 30 20 GKED CCSCC[C@@H](C)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 173261762 HJSJZMWHWWFPKJ-MRXNPFEDSA-N 384.570 5.112 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCC2CCOCC2)cc1Cl 173515603 ZYGJJHMBTBVXAY-FQEVSTJZSA-N 382.891 5.141 30 20 GKED COc1ccccc1-c1cccc(NC(=O)Nc2ccccc2O[C@H](C)C#N)c1 184021274 VQNJQMHLRHNNKD-MRXNPFEDSA-N 387.439 5.297 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1noc(-c2ccc(F)cc2F)n1 187493490 YMKKBUCFLOJNTO-GFCCVEGCSA-N 386.427 5.021 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@H]1Cc2ccccc2NC1=O 189881747 FPTIFQPKSVAAQT-IBGZPJMESA-N 376.500 5.068 30 20 GKED N#Cc1cc(NC(=O)c2cccnc2C(F)(F)F)ccc1Oc1ccccc1 190134031 QDAMVWQUWSJXGY-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1coc(-c2ccccc2)n1 191505922 ZLUMIAXWOKROCD-UHFFFAOYSA-N 375.472 5.515 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)cc1OCCCC#N 237306962 RBPZDYQOFOEEHC-LERMDLETSA-N 398.934 5.518 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 303173910 BULBEABBAKZPAC-UHFFFAOYSA-N 395.450 5.231 30 20 GKED C/C(O)=N/C1(c2noc([C@@H]3C[C@@H]3c3cccc4ccccc34)n2)CCCCC1 329239624 QLTNPGRHENRHTP-WOJBJXKFSA-N 375.472 5.630 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc2c(c1)CCC(O)=N2 330005543 BZOJHBBGXCOJHD-UQHVZDHRSA-N 383.492 5.164 30 20 GKED Cc1ccc(-n2cc(C)cn2)c(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c1 330007795 GDQUOBBPHXPRJN-UHFFFAOYSA-N 380.492 5.002 30 20 GKED CCC1CCC(N(C)C(O)=Nc2cc(/C(O)=N/CC(F)(F)F)ccc2C)CC1 330593979 SUEQLHRKKAHQRG-UHFFFAOYSA-N 399.457 5.308 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c2[C@@H]1C 410988866 SZLWIFMDCHLVEB-QWHCGFSZSA-N 381.526 5.174 30 20 GKED N#CCCC[C@H](NC(=O)N1C[C@@H](c2ccccc2)C2(CCC2)C1)c1ccccc1 413573515 JEIPECWQJGEEBC-GOTSBHOMSA-N 387.527 5.401 30 20 GKED CC[C@@H]1C[C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 421044500 IBZYIZSNKPFCHF-GGPKGHCWSA-N 397.906 5.075 30 20 GKED N#CCC[C@H](NC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl)c1ccccc1 429066435 UCYIJKGAJVCZSB-ROUUACIJSA-N 388.298 5.325 30 20 GKED Cc1cc(C(=O)NCCC#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 429453699 ZAFXWJKQSOKVOX-CYBMUJFWSA-N 376.287 5.118 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N(c2ccccn2)C2CCCC2)cc1 430276942 XSDARRLXTCCCFW-UHFFFAOYSA-N 399.519 5.694 30 20 GKED CC(C)[C@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431289040 VTIOASUJTNOMQN-RTWAWAEBSA-N 385.458 5.396 30 20 GKED C[C@@H](Sc1cccc(C#N)c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 435041972 KJYHALWXABXJFO-LLVKDONJSA-N 375.375 5.480 30 20 GKED N#Cc1cccc(C2(c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)CC2)c1 435244141 ZIEOXZMWHRYBPG-UHFFFAOYSA-N 398.397 5.015 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C2(c3ccc(F)cc3)CC2)cc1F 437465279 DTIOAYDUDCDXON-UHFFFAOYSA-N 390.389 5.299 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 437485822 NEPGOJHHYMKTPG-UHFFFAOYSA-N 380.400 5.006 30 20 GKED Cc1cc(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)ccc1C#N 443978796 MMYMIDOTZNRLFG-UHFFFAOYSA-N 392.506 5.068 30 20 GKED COCC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(C(F)(F)F)c1 453336943 GEFORHMVSPCDKG-BFUOFWGJSA-N 380.385 5.145 30 20 GKED N#CCCC[C@@H](NC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21)c1ccccc1 458798374 HYXDOGGPPCUWJX-DNQXCXABSA-N 387.527 5.673 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1Cc1csc(-c2ccccc2F)n1 464822001 JWLVHJLWCIUFJE-FPOVZHCZSA-N 377.488 5.221 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(F)cc(Cl)c1 464857927 NZVNVHLUPZUYAN-UHFFFAOYSA-N 381.794 5.099 30 20 GKED C=CCCOCCCCC(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1 466274273 VFOQVGXKQGUSGW-GOSISDBHSA-N 398.316 5.015 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 466894558 SSSHIJWZFRBKKA-GCJKJVERSA-N 397.478 5.154 30 20 GKED C=CCC(CC=C)C(=O)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 474978987 NXDXJNCYFHBWQI-HXUWFJFHSA-N 399.332 5.013 30 20 GKED COc1ccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(OCC(C)C)c1 475502740 JVYDCSGNXWNRRX-INIZCTEOSA-N 398.528 5.234 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@H]1OCCc2ccccc21 475572177 OLJWQGIZVRMGIX-JOCHJYFZSA-N 378.516 5.316 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2c(-c3ccccc3)nc3ccccn23)cc1 483105982 SHGYTCJQGGIXOA-UHFFFAOYSA-N 380.451 5.055 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(C)c(OC(C)C)c1 483573469 IUQHAWDTVTWPHK-UHFFFAOYSA-N 384.524 5.170 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1csc2ccccc12)c1ccccc1 487501344 LLJVSVNYKQUUSE-NRFANRHFSA-N 376.525 5.775 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(Cl)c2)cc1)C(=O)Nc1ccccc1C#N 488560786 QBVNYKRDCQYXCP-HNNXBMFYSA-N 391.858 5.443 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccccc1COc1ccccc1 490439638 XYDXHBSSCUGHQV-UHFFFAOYSA-N 376.456 5.121 30 20 GKED N#Cc1ccc(CN(CC(F)(F)F)C(=O)CC2CC(c3ccccc3)C2)cc1 494518781 LCNOBPKUASVNRJ-UHFFFAOYSA-N 386.417 5.033 30 20 GKED CCN(C(=O)CCCCC(=O)c1ccc(F)cc1)[C@@H](C)c1ccc(C#N)cc1 495132145 XJRDDYCTMCDWBR-KRWDZBQOSA-N 380.463 5.050 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 504576407 AHDZYRPZWMWSDB-UHFFFAOYSA-N 380.831 5.281 30 20 GKED CC[C@](C)(C#N)C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 505163769 IBHDZPUQPJBQOC-HTAPYJJXSA-N 379.891 5.009 30 20 GKED C=CCC(C)(C)C(=O)N1CCC[C@@H](c2nc(-c3ccccc3OC)cs2)C1 508373321 YVWYVXMUVBGKPD-MRXNPFEDSA-N 384.545 5.127 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)c1 510519862 DQDXEAVYXSXBRG-UHFFFAOYSA-N 397.356 5.211 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Cn1ccc2ccccc21 511878284 XPNIQPHSDJMCMU-DLBZAZTESA-N 377.513 5.168 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(C(F)F)c3)cc2)c1 511906372 IXYLKRKHYDJOKJ-UHFFFAOYSA-N 378.378 5.327 30 20 GKED N#C[C@@H](C(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1nc2ccccc2s1 513737016 RRHTZTQZTQTWNP-SFHVURJKSA-N 397.459 5.039 30 20 GKED Cc1ccc([C@@H](NCc2ccc(C#N)cc2F)c2ccc(F)cc2Cl)cc1 517456264 HZVMZGZIOVLIOI-JOCHJYFZSA-N 382.841 5.678 30 20 GKED N#Cc1cccc(CNC(=O)[C@@H](Sc2ccccc2Cl)c2ccccc2)c1 517981225 RPXSZUZERQIKTP-NRFANRHFSA-N 392.911 5.361 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 520105994 LZNNYEPFXPCJDO-FQEVSTJZSA-N 386.495 5.093 30 20 GKED C[C@H](NCc1ccc(-c2ccc(Br)cc2)o1)c1ccc(C#N)cc1 521830695 LZJAVKFGXNCATE-AWEZNQCLSA-N 381.273 5.432 30 20 GKED N#Cc1cc(Oc2ccc(NCc3cnc(-c4ccccc4)s3)cc2)ccn1 522037466 KLUNNSITOHDUBY-UHFFFAOYSA-N 384.464 5.481 30 20 GKED N#Cc1ccccc1COc1cccc(CNC2(c3nccs3)CCCC2)c1 522557841 IWYNWMYKMVBVMM-UHFFFAOYSA-N 389.524 5.153 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](Cc1ccccc1)c1cccs1 522686216 PKZNNLIBPILTFW-IBGZPJMESA-N 382.554 5.491 30 20 GKED CC1(C)[C@H](c2ccc(F)cc2)CCN1C(=O)Nc1ccc(CC#N)cc1Cl 529110186 XSJVCXUNHZLBEA-KRWDZBQOSA-N 385.870 5.345 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CC2CCSCC2)c1 531882683 ZAYAZKMLHOVVBH-UHFFFAOYSA-N 384.932 5.278 30 20 GKED C=CCC[C@@H](NC(=O)c1sc(COC)nc1C)c1ccc(C(F)(F)F)cc1 535435887 MEAOHJIVVYFWPZ-OAHLLOKOSA-N 398.450 5.054 30 20 GKED C[C@@H](N[C@H]1CCc2c(Cl)cc(Br)cc21)c1ccc(C#N)cc1 535509384 XLYWGONBPHHNBY-ZMZPIMSZSA-N 375.697 5.312 30 20 GKED CCN(C(=O)c1ccccc1CCC(F)(F)F)c1ccc(C#N)c(Cl)c1 538071830 KERSFEQGFYPSGJ-UHFFFAOYSA-N 380.797 5.373 30 20 GKED C[C@@H](NCc1csc(N(C)C2CC2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541086064 XQSKMPOIPSDPCE-MRXNPFEDSA-N 388.540 5.131 30 20 GKED CC(C)Oc1ccc(Br)cc1NC(=O)c1ccc(Cl)c(C#N)c1 542529324 XPJOYVMPMKTYLC-UHFFFAOYSA-N 393.668 5.014 30 20 GKED CCN(C(=O)Nc1ccc(C#N)cc1OC)[C@H](C)c1cccc(C(F)(F)F)c1 546708625 GNFKXWBFHSWKFT-CYBMUJFWSA-N 391.393 5.201 30 20 GKED C=C[C@](C)(CCOC)c1nc([C@H](c2ccc(Br)cc2)C(C)C)no1 561902972 SAWQMFQQMUQGKG-QFBILLFUSA-N 393.325 5.100 30 20 GKED COc1ccccc1[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccccn1 564809757 WJHZVEXCYLHYEQ-RCZVLFRGSA-N 383.495 5.109 30 20 GKED N#Cc1cc(Cl)cc(Br)c1NCc1ncoc1-c1ccccc1 570833677 ACEKCFCGDHSUFO-UHFFFAOYSA-N 388.652 5.241 30 20 GKED Cc1ccc(-n2ncc(NC(=O)c3ccc(C4(C#N)CC4)cc3)c2C(C)C)cc1 570898339 KGZKNHQJYHKZDK-UHFFFAOYSA-N 384.483 5.112 30 20 GKED C=C(C)COc1cccc(NC(=O)Cc2sc(C)nc2-c2cccs2)c1 589385065 WZUHEWXQSJQOND-UHFFFAOYSA-N 384.526 5.316 30 20 GKED N#CCCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 593976595 RZUBBVXVQOOSNV-UHFFFAOYSA-N 381.526 5.536 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1F 595694968 XJOZQJPHLFBPNQ-KSFYIVLOSA-N 399.535 5.145 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)[C@H](C)CC#N 597298641 LZOGHBLNZDBVST-OAHLLOKOSA-N 378.451 5.220 30 20 GKED CC(C)(C#N)c1ccc(CN[C@H](CCO)c2cc(Cl)cc(Cl)c2)cc1 599013837 NCKGWVMBNWKHFM-LJQANCHMSA-N 377.315 5.008 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C)c(C#N)c3)s2)cc1 599363883 SBTRRAQTORXEFE-HNNXBMFYSA-N 377.513 5.158 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(Cc1ccc(C#N)cc1)C(C)C 603527124 CKEJOEHUMBGWNI-UHFFFAOYSA-N 393.487 5.180 30 20 GKED CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 604499937 QYUAWMCPZWPYJH-UHFFFAOYSA-N 386.455 5.108 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(OC(F)F)cc3)c2)cc1 609175892 MIXBBGDVTPHDSF-UHFFFAOYSA-N 380.350 5.204 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)Nc3cccc(Cl)c3)c2)cc1 609220638 CIOWVGZKCYRUTF-UHFFFAOYSA-N 377.831 5.055 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 609773518 IOVXIIPPLAWQFN-IEBWSBKVSA-N 381.501 5.146 30 20 GKED N#Cc1cnc2c(F)ccc(F)c2c1N1CCC(c2c[nH]c3ccccc23)CC1 610246083 XVVIONVGFGOXGT-UHFFFAOYSA-N 388.421 5.250 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](CC1CC1)c1ccccc1 611395732 RQUKUQZAUFIZJP-UTKZUKDTSA-N 393.556 5.150 30 20 GKED O=C(CCc1ccc(F)cc1F)NC(CCC(F)(F)F)CCC(F)(F)F 619125642 VJXLLFGTQRQVBS-UHFFFAOYSA-N 391.302 5.067 30 20 GKED C=C[C@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 677515338 TUMGWLDVBXUNHH-OJLVUWQFSA-N 393.371 5.372 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2oc3ccc(Br)cc3c2C)cc1 726942204 TXYCEHXWRYFVSB-UHFFFAOYSA-N 397.272 5.373 30 20 GKED CCCCCCCCc1nnc(NC(=O)N[C@H](C)c2nc(C)cs2)s1 727935351 PRCJHMLJGSRWHM-CYBMUJFWSA-N 381.571 5.089 30 20 GKED COCCOc1cccc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)c1 728441845 RNJKOCASJHHFGH-ZHACJKMWSA-N 397.471 5.179 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)nc1 728822949 WNPMMFSAMFBKAW-UHFFFAOYSA-N 382.341 5.126 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@@H](C#N)c1nc2ccccc2s1 729891061 XBAWZNIIWPZYCT-IPBJHCPJSA-N 376.481 5.363 30 20 GKED C#Cc1cccc(N(C(=S)Nc2ccc(OC(F)F)c(Cl)c2)C(C)C)c1 735628260 PAGQEJBPPCAQRI-UHFFFAOYSA-N 394.874 5.535 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(SCC(F)F)cc1 743056147 QGTZTCLVVVLHQJ-XCVCLJGOSA-N 398.434 5.522 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@H](C)c3ccccc3C(F)(F)F)[nH]c12 744161926 WZDRHSHCYBCBFN-DZGCQCFKSA-N 385.389 5.260 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C#N)c(Cl)c2)cc1NC(=O)OC(C)(C)C 744353421 YLUKQPFIFCJGPW-UHFFFAOYSA-N 385.851 5.119 30 20 GKED C[C@H](CNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2o1 746562728 FAEQQMPHRUZXRZ-MRXNPFEDSA-N 397.434 5.025 30 20 GKED N#Cc1ccccc1-c1ccc(CS(=O)(=O)Cc2ccc(Cl)s2)cc1 749840171 JMCVUWQOOQMKPV-UHFFFAOYSA-N 387.913 5.055 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2nc(-c3cc(Cl)ccc3Cl)cs2)cn1 753899956 BRPAMQQEYIJBRL-AATRIKPKSA-N 392.311 5.790 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(C(F)F)cc2)cc1 765138910 RVHWCHJGHQWWQT-NRFANRHFSA-N 391.421 5.601 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1ccc(Cl)c2ccccc12)c1ccncc1 765887208 ZSNSOTJHZQMFCP-BTYIYWSLSA-N 379.891 5.566 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C2CCC(C(F)(F)F)CC2)cc1 774054961 URVMCFLNQMELNS-HTWSVDAQSA-N 394.437 5.045 30 20 GKED N#C[C@H](C(=O)C1CCC(C(F)(F)F)CC1)c1nc(-c2ccccc2)cs1 774057337 XYWMMFUZHAEWOK-YMAMQOFZSA-N 378.419 5.355 30 20 GKED CC(C)c1ccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776154026 LGXNZBWHFVZXCT-MHECFPHRSA-N 390.552 6.214 30 20 GKED C[C@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(C#N)c(F)c1 776856516 TYMRUJYJUZWSKR-LBPRGKRZSA-N 384.348 5.287 30 20 GKED N#Cc1ccc(CNCc2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1 780555190 PESUZCJPTKXCFR-UHFFFAOYSA-N 390.490 5.713 30 20 GKED CCCc1c(NC(=S)Nc2cc(C)cc(C)c2)cnn1-c1cccc(C#N)c1 783953323 MMTNIUVWQAEJBD-UHFFFAOYSA-N 389.528 5.122 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3c[nH]c4ccccc34)n2)cc1 786306668 ABKGAAYSQXHHLX-QFBILLFUSA-N 399.519 5.970 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)c1cccc(C(F)(F)F)c1 797572878 KBVUDQNHTNJSJH-WFASDCNBSA-N 394.462 5.829 30 20 GKED O=C(Nc1ccc(OC(F)F)cc1F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801709591 RKARPVXBGHTXEL-ZDUSSCGKSA-N 381.247 5.095 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2c(O)c(Cl)cc(Cl)c2Cl)c1 802991330 JARHNPGBIYQPFD-UHFFFAOYSA-N 376.026 5.130 30 20 GKED O=C(/C=C/c1cccc(NC(=O)C(F)(F)F)c1)c1ccccc1C(F)(F)F 810194943 QRNWBYJBLTUKND-CMDGGOBGSA-N 387.279 5.102 30 20 GKED O=C(/C=C\c1cnc(-c2ccc(Cl)cc2)s1)c1cc([N+](=O)[O-])ccc1F 814192116 YEIICJDTKNTNGT-VURMDHGXSA-N 388.807 5.407 30 20 GKED C=CCC(F)(F)C(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 815121927 FYSVPHNGGNERIA-UHFFFAOYSA-N 385.241 5.129 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC[C@H]3CC3(Cl)Cl)n2)cc1 850763270 XTBQBOYRKYHOPP-UONOGXRCSA-N 379.312 5.269 30 20 GKED CO[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CCC1 850763467 APSFHAYLKRJPFF-GUYCJALGSA-N 395.311 5.108 30 20 GKED CC(C)(C)c1nc2cc(NCc3cc(C#N)ccc3Br)ccc2o1 864036242 WIQRIJFICQWBFP-UHFFFAOYSA-N 384.277 5.372 30 20 GKED CCCC(=O)Nc1ccc(O)c(C(C)=NNc2ccnc3cc(Cl)ccc23)c1 916269388 LAHVSLFOEAREMU-UHFFFAOYSA-N 396.878 5.169 30 20 GKED Cc1cc(C)c(/C=C/C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1C 916918109 MBNFFPMOECPYSC-LEQVUBRHSA-N 382.463 5.126 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(C(F)(F)F)cc1)c1nc2cc(Cl)ccc2s1 917042665 CRMMJBYTCPGDET-ZDUSSCGKSA-N 394.805 5.387 30 20 GKED O=C(/C(=C\c1csc([N+](=O)[O-])c1)c1nc2ccccc2s1)c1ccccc1 917143533 IMOPFFBKLFJFPX-XNTDXEJSSA-N 392.461 5.690 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(CCc1ccccc1)Cc1ccccc1 1776050045 RBDOIWHTSULVAR-UHFFFAOYSA-N 388.467 5.037 30 20 GKED CCC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(Br)cc1Cl 1776062577 ACQFGUUPBZIONC-UHFFFAOYSA-N 399.647 5.166 30 20 GKED CCC(CC)c1nnc(/N=C(\O)c2sc(-c3ccc(F)cc3)nc2C)s1 24106394 CHCWXVCQCDQQQT-UHFFFAOYSA-N 390.509 5.649 30 20 GKED Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 48372936 JNXSIEWKUNAXOB-QGZVFWFLSA-N 398.466 5.002 30 20 GKED O=[N+]([O-])c1cccc(/C(Cl)=N/Nc2c(Cl)cc(Cl)cc2Cl)c1 60240622 VSXDLKGIUYKEGT-UYRXBGFRSA-N 379.030 5.568 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1 63402621 BONMQNIFGMRSOS-DEOSSOPVSA-N 399.469 5.185 30 20 GKED Cc1nc(NC(=O)c2ccccc2Nc2ccccc2)sc1SCC#N 71961649 ZNGUMRPPSIUZRH-UHFFFAOYSA-N 380.498 5.063 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1sc(-c2ccc(F)cc2)nc1C 105915466 JZWFLVRAMKIPBM-UHFFFAOYSA-N 393.487 5.182 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(Cl)cc2F)cc1C 112852036 ZHRYOAYVKKBFCS-UHFFFAOYSA-N 396.853 5.125 30 20 GKED CCOCCC1(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)CCCC1 134977548 CHJJNUULEPUANC-QGZVFWFLSA-N 389.565 5.189 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2CCC(F)(F)F)cc(OC)c1OC 156819189 SGSUEZZVHBMCQA-UHFFFAOYSA-N 393.405 5.180 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1 174507114 KXRLVJDOINDJOX-UHFFFAOYSA-N 389.455 5.103 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2cccnc2C(F)(F)F)s1 179908813 JOEYXLKZGMNBBU-UHFFFAOYSA-N 386.443 5.107 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)s2)o1 181565561 SLZNWFBDNVKDGD-CQSZACIVSA-N 391.477 5.325 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1c1ccc(COC)o1 191518613 IUEWGADXPXXGFW-FQEVSTJZSA-N 382.504 5.647 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cnn(-c2ccccc2)c1 302968189 CWQYVVKUNGAYLX-UHFFFAOYSA-N 396.475 5.147 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(C)ccc2F)cc1 303194267 XMDWPMUMIZOGPS-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(OCC(F)(F)F)c(C)c1 303813237 NXGBAJLBYWIYRO-UHFFFAOYSA-N 396.384 5.295 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 304120793 ZZUASGWFIKBOEL-PMACEKPBSA-N 385.294 5.183 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCC1=O 328962322 QPGGSLPCENGLEC-XPKDYRNWSA-N 386.492 5.288 30 20 GKED CC(C)(C(=N)O)c1ccc(N/C(O)=N/C2[C@H]3CC[C@H]2Cc2ccccc2C3)cc1 329390447 UXXQXIGUUBSAAP-ROUUACIJSA-N 391.515 5.019 30 20 GKED O/C(=N/Cc1nc2ccccc2s1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329415800 CXUYSISKTARCGB-MRXNPFEDSA-N 394.544 5.260 30 20 GKED N#CCc1ccc(NC(=O)C2(c3ccc(C(F)(F)F)cc3)CC2)c(Cl)c1 411010250 BWAKYMHOMJKOAC-UHFFFAOYSA-N 378.781 5.095 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 417628009 QETMTEWQQSNXAZ-INIZCTEOSA-N 394.298 5.081 30 20 GKED Cc1c(C(=O)Nc2ccc(OCC(F)(F)F)cc2)sc2ccc(C#N)cc12 428001490 QKHVROPMLGLOLK-UHFFFAOYSA-N 390.386 5.275 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3ccc(C#N)cc3Cl)sc2C)cc1 430362065 SGYCIQAEMMLVTR-UHFFFAOYSA-N 382.872 5.510 30 20 GKED C=CCn1c(S[C@@H](C)CCSc2ccccc2)nnc1-c1ccncc1 431243690 FJLCXMHGHWBNTH-INIZCTEOSA-N 382.558 5.189 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(Br)s1 444102619 CJEXZQVDQUNYOU-NSHDSACASA-N 385.352 5.031 30 20 GKED C=CCC(CC=C)c1nc(CC(=O)Nc2ccc(Oc3ccccc3)cc2)no1 445373245 HDUXHYPSOSLARF-UHFFFAOYSA-N 389.455 5.279 30 20 GKED Cc1cc(C)c(-c2csc(NC(=O)c3c(F)cc(C#N)cc3F)n2)cc1C 445664006 CAAUJZPUDGMXJA-UHFFFAOYSA-N 383.423 5.138 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(C(=O)C2CCC2)cc1)c1ccccc1 455272813 NNGOFZZZQNDNDM-NRFANRHFSA-N 375.472 5.226 30 20 GKED CC(=O)c1ccc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)cc1 460162144 ODZNTGKLVYQJJT-UHFFFAOYSA-N 388.854 5.261 30 20 GKED Cc1ccc(Br)cc1C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 461093910 XFCDDZYMDXIUDC-OAHLLOKOSA-N 398.087 5.059 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)N(CCC#N)Cc3cccnc3)o2)cc1 463513371 DZFRHXXHTHPDRA-UHFFFAOYSA-N 387.483 5.195 30 20 GKED CCN(CC)Cc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 469817545 QGKCISRELOARPK-UHFFFAOYSA-N 388.515 5.039 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 471247993 ALCBTSWSSFHDOL-SECBINFHSA-N 394.258 5.907 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2cccs2)Cc2cccs2)cc1 474792181 KZRJTIWIAGJEIR-UHFFFAOYSA-N 380.538 5.453 30 20 GKED CCCN(CCC)C(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C#N)cc2)cc1 474942002 CJLWPYZLBZVCEZ-UHFFFAOYSA-N 391.515 5.002 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1 475550032 MTZQXLCIEMTHBW-SIKLNZKXSA-N 391.559 5.496 30 20 GKED CCCC(C#N)(CCC)NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl 475745682 GSRVYGOYBSGEKG-UHFFFAOYSA-N 391.943 5.307 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 482268211 LWVQJLWGLFLDLW-UHFFFAOYSA-N 390.443 5.012 30 20 GKED N#Cc1ccccc1COc1cccc(-c2nc([C@H]3CCC(F)(F)C3)no2)c1 482747922 BPQPUSIDRDVYIQ-HNNXBMFYSA-N 381.382 5.090 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cc(-c2ccc(C)o2)ccc1C 483324900 MXASTRAWBYMZCI-UHFFFAOYSA-N 394.471 5.259 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CC1 485390605 YLIBEQBOZZIXFV-CQSZACIVSA-N 385.920 5.403 30 20 GKED N#CCCn1cc(CNc2ccc(-c3ccco3)cc2F)c(-c2ccccc2)n1 486795537 HTIKHLFWEOHDEY-UHFFFAOYSA-N 386.430 5.475 30 20 GKED C[C@H](CC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1C(F)(F)F 487384655 AZRLLAQRWFHLDY-UZLBHIALSA-N 388.433 5.750 30 20 GKED Cc1sc2ncn(Cc3ccccc3C(C)(C)C#N)c(=O)c2c1-c1ccccc1 487970973 MIZPUUDVASRVDF-UHFFFAOYSA-N 399.519 5.283 30 20 GKED CC(C)Oc1ccc(NC(=O)NC23CCC(C(F)(F)F)(CC2)CC3)cc1C#N 488898876 FSVZURBHAPEBMW-UHFFFAOYSA-N 395.425 5.122 30 20 GKED COc1cc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cc(OC)c1C(C)C 495323817 JSRLWNPZNLBUFD-UHFFFAOYSA-N 395.503 5.141 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)cc1 499849968 WTZUEAPVHJWWKM-WBMJQRKESA-N 379.312 5.164 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1c(C)cccc1C 502665503 TZFJMZHJHKCVEJ-UHFFFAOYSA-N 391.284 5.425 30 20 GKED N#C[C@H](NC(=O)[C@@H](Sc1ccccc1F)c1ccccc1)c1ccccc1F 505942515 IYKMHLMOZHDKKF-FPOVZHCZSA-N 394.446 5.179 30 20 GKED CCc1sc(-c2nnc(CN(CC)[C@@H](C)c3ccc(C#N)cc3)o2)cc1C 507689118 QTHRTWYXVGMDOI-HNNXBMFYSA-N 380.517 5.124 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)o1)c1nc(-c2ccc(Cl)cc2Cl)cs1 509541205 LSVODTWDZDALPZ-SNVBAGLBSA-N 397.670 5.853 30 20 GKED CCSc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1 509545268 SJWPUPHLTXCHNM-INIZCTEOSA-N 379.529 5.105 30 20 GKED CC[C@](C)(C#N)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 510826584 BCJHJQNYNMCICF-LJQANCHMSA-N 376.378 5.163 30 20 GKED CCSCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 511356234 BKLWBXQJHVCJKZ-GOSISDBHSA-N 378.522 5.553 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)Nc2ncc(C#N)cc2Cl)cc1 513653521 RUNVHTGCHYAYMZ-FQEVSTJZSA-N 381.838 5.150 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N(C[C@H](C)C#N)C1CC1 513760365 HVXOHNBXMJCKKH-GFCCVEGCSA-N 386.293 5.067 30 20 GKED CCN(C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1)[C@H]1CCOC(C)(C)C1 514870693 SRIVUCISNVOFPW-IBGZPJMESA-N 393.487 5.162 30 20 GKED COc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520940491 UGMMYSGAGXDRIY-INIZCTEOSA-N 397.544 5.232 30 20 GKED CC(C)N(CCC#N)C(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 522583947 DLDCAYKNDYKAHZ-UHFFFAOYSA-N 383.561 5.330 30 20 GKED CC[C@H](CC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccc(C)cc1 523112601 QSJKJCMAYSJNBS-LJQANCHMSA-N 399.494 5.885 30 20 GKED Cc1cccc(C)c1CSCC(=O)Nc1ccccc1S[C@@H](C)CC#N 523389547 YHIPLGAASLKYAL-KRWDZBQOSA-N 384.570 5.570 30 20 GKED C=CCOc1cccc(NC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)c1 523898071 QFWADBGNQGGPLW-UHFFFAOYSA-N 377.271 5.148 30 20 GKED C[C@H](c1ccc(C#N)cc1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 533502799 QTSGICNMLISWRE-DNVCBOLYSA-N 392.890 5.202 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 534597374 SWMWMGCEGTVFQS-INIZCTEOSA-N 388.842 5.632 30 20 GKED C[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@@H](C)O1 535775177 BYGJIBPBCNVIRF-XOIINTDNSA-N 399.878 5.081 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 538107828 KLPHPUAAJJPALT-KRWDZBQOSA-N 387.458 5.267 30 20 GKED C=CCC[C@H](NC(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccccc1 541464144 OCHZGCPWKWGBRH-GMAHTHKFSA-N 391.559 5.317 30 20 GKED CC[C@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 542024171 XGZDRRWUHLCWAN-SBUREZEXSA-N 384.483 5.132 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nc(-c2cccs2)no1 542931210 ADENTTTVHVKKGQ-SECBINFHSA-N 381.404 5.542 30 20 GKED CC[C@H](CC#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 547277927 HZNJEEUWCZYAKW-LJQANCHMSA-N 389.524 5.137 30 20 GKED Cc1ccc(S[C@H](C)C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 561603614 LRZBRFMZHHRGTO-SJKOYZFVSA-N 379.312 5.164 30 20 GKED C[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccc([N+](=O)[O-])c1 569301281 NAWFQPBXHRRPHB-DLBZAZTESA-N 399.450 5.114 30 20 GKED CCc1ccc2occ(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)c2c1 573031606 NFMRVDVVTZDDSF-SFHVURJKSA-N 397.459 5.480 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(-c3ccccc3Cl)on2)c(C#N)s1 577213456 DHIQJHUIGLJODU-UHFFFAOYSA-N 385.876 5.478 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCc2oc(-c3ccccc3)cc2C1)c1ccccc1 593407004 PHYRGDZXKOKBKU-JOCHJYFZSA-N 399.494 5.449 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)[C@H](C)CC#N 597297620 HYOSTZPYOGFAEJ-OAHLLOKOSA-N 378.451 5.220 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(F)cc1F 599736191 CHOZMRJBGZGUQV-XLWVJDPXSA-N 387.455 5.037 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3cc4ccccc4o3)c2)cc1 604383203 XIYNWGYPVSXBHY-UHFFFAOYSA-N 396.446 5.259 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1ccc(Cl)cc1)C1CCCC1 609213284 AUHCENJPHWBIDQ-OAQYLSRUSA-N 381.907 5.285 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccc(Cl)cc1)C1CC1 609403061 PXYILGROFPANTC-JLTOFOAXSA-N 399.947 5.865 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1 609428571 PXMXHZVLEUEOOT-QGZVFWFLSA-N 388.492 6.125 30 20 GKED CCCCn1ccnc1-c1cccc(NC(=O)c2cc3ccccc3n2CC#N)c1 610789022 UACXYECWEJTHPP-UHFFFAOYSA-N 397.482 5.081 30 20 GKED C[C@@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619768115 IVDOWXOGHQXAPI-ZIAGYGMSSA-N 390.314 5.199 30 20 GKED CC(C)c1[nH]ccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 651266265 JQUNSWIXBIDYFN-GFCCVEGCSA-N 377.391 5.257 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCOc2cc(OC)ccc21 682777192 IADQNFWUHORUID-HXUWFJFHSA-N 380.488 5.192 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C\c1ccc(O[C@H](C)C#N)cc1 728698225 LRJNPGFPJJIMFT-WTKLMOFPSA-N 392.455 5.445 30 20 GKED Cc1cccc(COc2cccc(CC(=O)[C@H](C#N)c3nc4ccccc4o3)c2)c1 730071484 NOAUPUBICLHCMO-NRFANRHFSA-N 396.446 5.134 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C/c1cccc(NC(=O)c3ccccc3Cl)c1)C2 730949582 XTYUHMAVDZRTPO-LDADJPATSA-N 387.866 5.723 30 20 GKED N#Cc1ccccc1-c1ccc(CN(Cc2ccccc2O)C[C@H]2CCCO2)cc1 731845250 WNGCZOTVTVIIGF-XMMPIXPASA-N 398.506 5.112 30 20 GKED CCOc1cccc(C(=O)/C=C/c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 733083437 JGUIDGNOMLEWGE-MDZDMXLPSA-N 380.425 5.013 30 20 GKED CC[C@@H](C#N)Oc1cc(C/N=C\c2cc(Cl)cc(Cl)c2O)ccc1OC 733205008 HCWOCKOUHPSLBV-CEABSUDRSA-N 393.270 5.008 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)/N=C/c3c(O)cccc3OC)s2)cc1 733750058 KUMUPEADZKUJLD-AEOXGOBCSA-N 382.485 5.021 30 20 GKED C=CCNC(=S)Nc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1C 741860549 GMYMSPHOZCMEFD-UHFFFAOYSA-N 382.508 5.204 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)s1 742650682 BNCLJRQTBHMOAF-HSBSLETESA-N 394.327 5.142 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CC[C@@H]3c3cccc(F)c3)c2)s1 743626662 ZRMAHQZOELNURQ-HXUWFJFHSA-N 391.471 5.082 30 20 GKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1cccc(N2CCOC2=O)c1 745626407 OGAOSQPAPZTIEL-KTKRTIGZSA-N 375.449 5.268 30 20 GKED Cc1ccc(CCCCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 746415768 FNKBTLMCVRMECX-KRWDZBQOSA-N 381.426 5.329 30 20 GKED C=CCC[C@@H](NCc1ccc(-n2ccnc2)nc1)c1ccc(C(F)(F)F)cc1 749840141 MDQBPFFSTDTWKY-LJQANCHMSA-N 386.421 5.083 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)/C=C\SCc3ccco3)cc2)c1 754232641 AFSQBQKCFWLCOA-BENRWUELSA-N 390.464 5.116 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc([C@H](C)CC)cc1 756232958 IHTFTOHLOXHUKT-IERDGZPVSA-N 376.500 5.286 30 20 GKED C[C@H]1c2cc(Cl)c(Cl)cc2CCN1C(=O)Nc1cccc(OCC#N)c1 759494429 KHMDGTHUHWPNQE-LBPRGKRZSA-N 390.270 5.047 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCC[C@H]3c3ccccc3)cn2)c1 762814443 ZIRALRAMKUCEPQ-QFIPXVFZSA-N 398.466 5.505 30 20 GKED N#CCOc1cccc(/C=C(/Cl)c2nc3cc(C(F)(F)F)ccc3o2)c1 764432370 MDZAYAZPWYTKPL-NTEUORMPSA-N 378.737 5.486 30 20 GKED C#CCOc1ccc([C@H](C)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 764775401 VOUFGVQSUXKGNS-QEJZJMRPSA-N 393.371 5.259 30 20 GKED Cc1cc(Br)cc2c(C(=O)Nc3ccccc3O[C@@H](C)C#N)coc12 770013741 DZCIIHQFXLTLHT-LBPRGKRZSA-N 399.244 5.047 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(SC(F)F)cc2)c1 772983525 JIQTTXLAJOOYBC-RHSMWYFYSA-N 376.472 5.533 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2ccccc2s1)C(=O)c1ccc(Cl)cc1 777295719 QAYHSOYBXHESIW-WFASDCNBSA-N 382.872 5.035 30 20 GKED Cc1ccc(-c2nc(/C=C3/CCc4ncc(C(F)(F)F)cc4C3=O)co2)cc1 777468773 ZNIBFQBUEAWRET-ZSOIEALJSA-N 384.357 5.276 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cccc(OCc2ccccc2F)c1 779989393 RTWBGZLQNKFBBK-KRWDZBQOSA-N 376.431 5.308 30 20 GKED CC(=O)Nc1ccc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)cc1 781552857 DFPXFVHNMDTYSY-ZHACJKMWSA-N 382.872 5.318 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](O)c1c(F)cccc1Cl 789452140 QNTLTUVNTRJJHR-SFHVURJKSA-N 390.886 5.186 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1cnc2ccccc2n1 792099466 BJEFTQMKZUDRKS-LECLMCCNSA-N 399.450 5.387 30 20 GKED O=C(O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H]1CCC(F)(F)C1 796747443 YCLDNHMKMKCJDN-GXSJLCMTSA-N 376.243 5.287 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)sc2ccc(C#N)cc12 796756832 PHXLNJPSBOTVQJ-QGZVFWFLSA-N 399.500 5.695 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1 814978884 ZNLQKXXPBBQIML-UHFFFAOYSA-N 381.357 5.200 30 20 GKED N#CCCC[C@@H](N[C@H]1CCCN(C(=O)Oc2ccccc2)CC1)c1ccccc1 815636021 NRIFZVZKNVNSNR-JTHBVZDNSA-N 391.515 5.065 30 20 GKED CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1ccccc1SCC#N 819741097 FHMMKINAPRWXEP-UHFFFAOYSA-N 392.446 5.026 30 20 GKED CC(C)(C)OC(=O)N1CC[C@H](NCC2CCC(C#N)CC2)C[C@H]1c1ccccc1 824333745 ZUXCVSGDIDIHJI-NZUHHQEFSA-N 397.563 5.047 30 20 GKED CCCCOc1ccc(C=NOCc2cc(-c3ccccc3)no2)cc1OC 913029456 NSUAGFGKCBUVTN-UHFFFAOYSA-N 380.444 5.080 30 20 GKED CC(=O)c1ccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915124254 AOKHPNKMRZFCRB-JOCHJYFZSA-N 385.492 5.354 30 20 GKED COc1cccc(SCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 916050781 HFCXUOPICXJGHV-QFIPXVFZSA-N 388.492 5.081 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(-c2ccccc2Cl)o1 916904696 CMEXPGKRFPTPTG-ZDUSSCGKSA-N 399.233 5.215 30 20 GKED CCOc1ccccc1CCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917047080 QRJVZXRSONJVHL-OAHLLOKOSA-N 384.888 5.157 30 20 GKED Cc1nn(C)cc1C(=O)/C=C/c1ccc(-c2ccccc2Br)s1 917519798 FNAKTWLJFNFNAD-VQHVLOKHSA-N 387.302 5.116 30 20 GKED O=C(O)c1cc(NN=Cc2c(-c3ccccc3)[nH]c3ccccc23)ccc1Cl 1776033369 SHKWUJRHBDTVEA-UHFFFAOYSA-N 389.842 5.633 30 20 GKED CCCC(=NNc1ccc(C(=O)O)cc1OC)c1cccc(C(F)(F)F)c1 1776050104 YTUFRWVVTKHNHX-UHFFFAOYSA-N 380.366 5.029 30 20 GKED Cc1cc2ccccc2nc1NN=Cc1ccc(-c2cccc(CC(=O)O)c2)cc1 1776052817 VFLDWEZLPYEDSY-UHFFFAOYSA-N 395.462 5.283 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2C(=O)O)c1)c1ccccc1Cl 1776115095 MGGFALRREAWGKT-SEYXRHQNSA-N 392.838 5.513 30 20 GKED C=CC[C@]1(C(=O)O)CCCN([C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 1776154590 MFQGWAFRPVBRSL-UNMCSNQZSA-N 387.882 5.311 30 20 GKED C/C(=C/c1c(F)ccc2sc(C(=O)O)cc12)c1nc2ccccc2n1CC#N 1776199468 SJUUCRGXWOWZQJ-BENRWUELSA-N 391.427 5.172 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@H](CC(=O)O)c2ccccc2)cc1 1776785811 CBDLSDGCFRYHJD-JOCHJYFZSA-N 381.516 5.535 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C\c2ccc3oc(C(=O)O)cc3c2)s1 1777462913 NAHSXJLTGJNBHH-VURMDHGXSA-N 389.432 5.459 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccn1 49457110 CTCYCVHNFKVQRA-ISZGNANSSA-N 384.279 5.009 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2csc(C)n2)cc1 63390077 BINXHQZRYRKZOT-UHFFFAOYSA-N 388.496 5.210 30 20 GKED N#Cc1ccc(NC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)cc1 65505179 XDTCEJCFYLWGHN-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cn1cc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c2ccccc21 65857218 CZYCUZZPYMUWOF-UHFFFAOYSA-N 381.435 5.023 30 20 GKED C=CCOc1cccc(NC(=O)c2c(C)nn(Cc3ccccc3Cl)c2C)c1 65878374 RNBVRAFMJDZVPM-UHFFFAOYSA-N 395.890 5.019 30 20 GKED COc1ccccc1S[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCCCC2 72042319 DSRIPADTSMRMFD-ZDUSSCGKSA-N 386.542 5.017 30 20 GKED CCCCCCCC(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 107899110 WBVGEXCEUHSGOT-QGZVFWFLSA-N 389.927 5.457 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)Cc1cc(-c2ccccc2)on1 119013319 OFUHGNFKXVZYEN-UHFFFAOYSA-N 385.448 5.123 30 20 GKED Cc1c(NCc2ccccc2C(C)(C)C#N)cccc1NC(=O)c1ccccc1 131584379 RSPDMQULJZEKJF-UHFFFAOYSA-N 383.495 5.661 30 20 GKED CCc1ncsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 137378021 YQBHJGBLHSQIRN-MRXNPFEDSA-N 381.888 5.267 30 20 GKED CN(CCC#N)c1ccc(CNc2cccc(CSC3CCOCC3)c2)cc1 151018910 ASSVGYCJVJANHR-UHFFFAOYSA-N 395.572 5.061 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(N2CCCC2)cc1C 153845714 BUVHWWPBZAPUDB-UHFFFAOYSA-N 389.952 5.530 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@@H](CSc3ccccc3)C2)cc1 174909223 WGSQVPGJVYVQRZ-QGZVFWFLSA-N 379.529 5.134 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)ccc1NC(=O)CC(C)C 177765306 NDLZSGZONIIXJY-INIZCTEOSA-N 383.517 5.050 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)N(C)C)cc1Cl 189872903 UDGYATVIDBFVAN-UHFFFAOYSA-N 399.922 5.538 30 20 GKED N#C[C@@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1cnc2ccccc2n1 190951949 CFMUCWCQOWXHHW-HXUWFJFHSA-N 395.487 5.412 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@H]1c1cccc(Br)c1 301296738 PLOWPQKVPQRMNQ-AWEZNQCLSA-N 396.210 5.076 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N(Cc3cccs3)C3CC3)c2)cc1 303652831 UPNDZVAPMZBDMK-UHFFFAOYSA-N 388.492 5.004 30 20 GKED Cn1nc([C@@H]2CCCOC2)cc1N=C(O)c1cc2sc3ccccc3c2s1 329838174 IQCRCLNISXCTRT-GFCCVEGCSA-N 397.525 5.380 30 20 GKED CSc1nc(C(C)(C)C)nc(C)c1/C(O)=N/[C@@H]1CCC[C@H](C(F)(F)F)C1 331006553 ZRWSSICGLSHCAB-NWDGAFQWSA-N 389.487 5.230 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425669082 NTLXSYGMBFCYSQ-KRWDZBQOSA-N 379.504 5.488 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cccc(SCC#N)c1 429863422 CLIPZMJSZAIIQH-UHFFFAOYSA-N 379.312 5.271 30 20 GKED C[C@H]1CN(CCCC(C)(C)C#N)c2ccccc2N(Cc2ccccc2)C1=O 430772342 KYJSSRJJQJEOJS-IBGZPJMESA-N 375.516 5.006 30 20 GKED C=CCn1c(S[C@H](C)CCSc2ccccc2)nnc1-c1ccncc1 431243691 FJLCXMHGHWBNTH-MRXNPFEDSA-N 382.558 5.189 30 20 GKED CC(C)[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccnc1 436215994 FETZUTIBANJGAP-QFIPXVFZSA-N 389.430 5.263 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N(C)[C@H](C)CC#N)cc2)c1 444395449 GZFNNNXSIKUUFM-GOSISDBHSA-N 379.504 5.463 30 20 GKED Cc1cc2cc[nH]c2cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 444446021 FBLFPWYMMOXNKG-UHFFFAOYSA-N 381.435 5.587 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC(C)C)cc1Cl 445037174 FFGLVUSZMXYJDY-UHFFFAOYSA-N 385.895 5.443 30 20 GKED C[C@H](c1ccccc1)N(CCC(=O)Nc1sccc1C#N)Cc1ccccc1 463218545 LOWRCMNRFLMXKW-GOSISDBHSA-N 389.524 5.212 30 20 GKED Cc1cc(Br)cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 464414487 KXLCNSUHMZEJGQ-CYBMUJFWSA-N 389.318 5.404 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ncc(-c4ccccc4F)o3)c2)c1 467267579 FJFMKBMVZIVYQR-UHFFFAOYSA-N 399.425 5.543 30 20 GKED C=CCC[C@H](N[C@H](C)c1cnn(C(C)C)c1C)c1ccc(C(F)(F)F)cc1 469182542 QIUPFUXWVFNJRZ-QRWLVFNGSA-N 379.470 6.149 30 20 GKED C[C@@H](CC(=O)Nc1ccccc1SC[C@H](C)C#N)c1c[nH]c2ccccc12 469410664 VMGGSGYXJAUPCA-CVEARBPZSA-N 377.513 5.552 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1cccc(C)c1)c1ccccn1 472130425 NTJACMMMDYWVNI-XMMPIXPASA-N 385.511 5.267 30 20 GKED CC(C)(C)c1ncsc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 473477854 BCHSDQXNVOWWTR-UHFFFAOYSA-N 391.496 5.144 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1nc2c(C)cccc2o1 475552641 XDRQZDREELMOMD-UHFFFAOYSA-N 377.488 5.352 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1 475572299 INIKVLPQAOQESW-GOTSBHOMSA-N 387.527 5.842 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(SCc2ccccc2)cn1)c1ccccc1 476471248 LQGPFXAYOSTIMX-HXUWFJFHSA-N 387.508 5.400 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@]1(C)CCCO)c1ccc(C(F)(F)F)cc1 483190949 DBKDBSAJLHNJMD-UYAOXDASSA-N 398.469 5.049 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(C(=O)NC(C)C)ccc1Cl 485755060 ULTLDXHPXPINOZ-UHFFFAOYSA-N 388.920 5.009 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)CC3CCCC3)s2)c(C(F)(F)F)c1 487348216 AWXJUPMRVXHCSX-UHFFFAOYSA-N 393.434 5.143 30 20 GKED N#CCCC[C@@H](NC(=O)COc1ccccc1-c1ccccc1)c1ccccc1 487410348 XLUFTYXQRXBTSU-HSZRJFAPSA-N 384.479 5.284 30 20 GKED C=CCn1c(SCc2nc3ccccc3o2)nnc1-c1cccc(Cl)c1 489641964 OYTPFPHOVRCCBE-UHFFFAOYSA-N 382.876 5.218 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CCc1c[nH]c2ccccc12 500740401 CVSJXJRVPLHGAI-UHFFFAOYSA-N 395.462 5.712 30 20 GKED C=CCn1c(SCc2cn3c(C)cccc3n2)nnc1-c1ccc(Cl)cc1 503678533 AALOORYCYMBAFW-UHFFFAOYSA-N 395.919 5.033 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cc2ccccc2s1 504463272 WWBVOVGNIICHOT-INIZCTEOSA-N 377.513 5.456 30 20 GKED CC(C)CN(C(=O)c1ccc(COc2ccccc2)cc1)c1ccc(C#N)cc1 513557603 WMGOYFKTEYTVJE-UHFFFAOYSA-N 384.479 5.440 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCSc3cccc(Cl)c3)CC2)cc1 515475592 AJKLSWPOBQMBAG-UHFFFAOYSA-N 382.916 5.010 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1csc(C(F)(F)F)n1 519720474 XUQXFNUPTYBZPD-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CCCc1ccc(C(=O)CCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 520188717 OKKPMGDHQMBWNX-QGZVFWFLSA-N 394.540 5.635 30 20 GKED N#CCc1cccc(C(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)c1 521872581 VEIFSBIXPXQDRM-RUZDIDTESA-N 376.459 5.425 30 20 GKED Cc1ccc2cc(C(=O)N[C@H](C#N)c3ccc(OCc4ccccc4)cc3)[nH]c2c1 524332420 DGVGKPXMILYEEC-XMMPIXPASA-N 395.462 5.050 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](c1ccccc1)C(C)(C)C 533489459 XOEGAXLFZRPPGH-VGOFRKELSA-N 395.572 5.396 30 20 GKED C=CCn1c(SCc2ncc(-c3ccccc3C)o2)nnc1-c1ccccc1 534527937 WYCZJPZFVLFRTI-UHFFFAOYSA-N 388.496 5.387 30 20 GKED C=CCC[C@@H](NC(=O)Nc1c(C)nn(CC)c1C)c1ccc(C(F)(F)F)cc1 536782334 DTYBIJDQMKKZFJ-QGZVFWFLSA-N 394.441 5.368 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c1 536785438 SCEQPQXQELRBBK-LJQANCHMSA-N 390.508 5.822 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccc(-c4cccc(F)c4)c(F)c3)o2)c1 541292198 BYRPSYUXWCJQOP-UHFFFAOYSA-N 388.377 5.166 30 20 GKED N#CCc1ccnc(NC(=O)c2cc(Cl)ccc2Sc2ccccc2)c1 545341915 FEIIBBKUZWSTJN-UHFFFAOYSA-N 379.872 5.205 30 20 GKED CC[C@H](c1ccccc1OC)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 558338281 GGUWZFAYMJIXGE-VQIMIIECSA-N 397.544 5.704 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2c(Cl)cccc2Cl)CC1 569498946 JTUMMRLRVJRGFA-UHFFFAOYSA-N 384.347 5.462 30 20 GKED COc1cc(CS[C@@H](C)c2cccnc2)ccc1OCc1cccc(C#N)c1 570999004 BTRNGCBOLPLQCI-KRWDZBQOSA-N 390.508 5.535 30 20 GKED Cc1cccc(C)c1-c1cccc(OCc2nnc(-c3ccc(C#N)cc3)o2)c1 575030535 IFPOYNKPMJPXTA-UHFFFAOYSA-N 381.435 5.471 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1cc(-c2cncc(F)c2)ccc1C 576328405 MHJPPOZGVZJMJC-UHFFFAOYSA-N 391.446 5.083 30 20 GKED N#CCCn1cc(CNCCc2cc3ccccc3s2)c(-c2ccccc2)n1 578635114 WQFQTDXAODDYKB-UHFFFAOYSA-N 386.524 5.011 30 20 GKED CCOCc1ccccc1-c1noc(-c2cn(CCCC#N)c3ccccc23)n1 582088025 MQNNPAUMTFGGQJ-UHFFFAOYSA-N 386.455 5.199 30 20 GKED CSCc1c(C(=O)N[C@H](CCCC#N)c2ccccc2)oc2ccccc12 590477753 HCHRBMTWDNCIIL-LJQANCHMSA-N 378.497 5.461 30 20 GKED C[C@H](c1ccccc1)n1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cn1 592025098 IGRMTCXNZCBACX-GCJKJVERSA-N 387.487 5.049 30 20 GKED CC(C)(CNC(=O)c1ccccc1Sc1ccccc1C#N)CC(F)(F)F 598581876 RQTVBOKNDWSDNB-UHFFFAOYSA-N 392.446 5.418 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)c1cccc(C#N)c1 610356564 VCZCGDBUUPZQPB-UWJYYQICSA-N 389.524 5.272 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 613407279 OMYBCVOCWNLEAR-INIZCTEOSA-N 392.867 5.602 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1coc2cc(F)ccc12 619127227 VUVQZAOSNZLQLO-UHFFFAOYSA-N 385.279 5.355 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622842153 FDXGFWBQTPSPPK-CABZTGNLSA-N 389.286 5.144 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccccc2Cl)s1)c1nccc2ccccc12 682993969 DBOSMKLOVOCBFR-INIZCTEOSA-N 389.867 5.502 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cc(F)ccc1O 725840105 WZFAZOFOCQENAR-UHFFFAOYSA-N 396.422 5.178 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1ncc(-c2ccc(Cl)cc2)o1 727470139 DQWQAPSXMMPTDR-UHFFFAOYSA-N 380.753 5.565 30 20 GKED O=C1/C(=C\c2csc(COc3ccc(Cl)cc3)n2)CCOc2ccccc21 728441413 JNWRZQJECZJVFQ-KAMYIIQDSA-N 397.883 5.424 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Oc3ccccc3)cn2)cc1Cl 728453301 VUNFMTJMHMCZKY-UHFFFAOYSA-N 380.860 5.208 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)/N=C\c1cc([N+](=O)[O-])ccc1O 729149704 NXMMTSNVBJUJRV-VARIZKOUSA-N 385.420 5.052 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740060295 SMYVRSFXKSJERC-AWEZNQCLSA-N 381.526 5.251 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(Br)s2)c(SC)cc1OC 741165371 LUNHKKAKNJVOPI-SNAWJCMRSA-N 399.331 5.146 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1cccc(-c2ccncc2)c1 741471997 DFRCMMBOROMKKK-VAWYXSNFSA-N 392.458 5.619 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)[C@H]2C[C@@H](OCC)C23CCCCC3)c1 741514791 XIAGIWXAEFNHSZ-LEWJYISDSA-N 384.589 5.205 30 20 GKED Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)cc1 743004233 HQVGNGBLVPCVJB-QUCCMNQESA-N 383.948 5.485 30 20 GKED C=CCN(C(=O)Nc1ccnc(Oc2ccccc2Br)c1)C(C)C 743191932 HGKRNWNJHBMGSL-UHFFFAOYSA-N 390.281 5.065 30 20 GKED Cc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)ccc1Br 746394348 PRHUOBUWODGLHA-HWKANZROSA-N 381.682 5.016 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2ccc(F)cc2F)cc1 751602397 KZBVPPRWCVBPGH-NRFANRHFSA-N 376.406 5.192 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H]1c1ccc(Cl)cc1 752235176 IGBVIOFEQQNRHC-KDOFPFPSSA-N 385.920 5.571 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(OC(F)F)c(OC)c2)cc1 764640188 GTXXEFNXNVOWOB-CQSZACIVSA-N 397.849 5.279 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc3c(c2)CCCC3)ccc1OC 772979765 MECMJBBKKVUNSZ-VGOFRKELSA-N 378.516 5.106 30 20 GKED C#Cc1cccc(NC(=S)N(C)C[C@H](C)Oc2ccc(Cl)c(Cl)c2)c1 787200799 ZDIFNHDYFYLGIE-ZDUSSCGKSA-N 393.339 5.071 30 20 GKED C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792100656 LXBQJMIGELOIKQ-KUHUBIRLSA-N 382.385 5.309 30 20 GKED CO[C@@H]1CCC[C@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 796632630 DZYCSTRADWREOI-IAOVAPTHSA-N 388.920 5.235 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)[C@H]1CCC(F)(F)C1 796747460 YCLDNHMKMKCJDN-ONGXEEELSA-N 376.243 5.287 30 20 GKED Cc1nc(-c2ccccc2NC(=O)Nc2ccccc2O[C@@H](C)C#N)cs1 797669263 JUMVIHNGVSFGHN-ZDUSSCGKSA-N 378.457 5.053 30 20 GKED CC(C)N(CCCC1(C#N)CCOCC1)c1ccc(Nc2ccccc2)cc1 799136814 OEJOZOFFALXZNK-UHFFFAOYSA-N 377.532 5.746 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(Cl)c1F)c1nc2cc(Cl)ccc2s1 810536713 ROSULVUKVQLAJI-NSHDSACASA-N 379.243 5.161 30 20 GKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)n1-c1ccc(C#N)cc1 817319848 SYPFCGPFNNFLIF-XMMPIXPASA-N 396.494 5.131 30 20 GKED Fc1ccc(-c2ccc(C=Nn3c(S)nnc3-c3ccccc3F)s2)cc1 839395065 CDWWRFOQPXMTPJ-UHFFFAOYSA-N 398.463 5.123 30 20 GKED CCOc1ccc(S[C@@H](C)C(=O)N(CCC#N)c2cc(C)cc(C)c2)cc1 857841362 SSNPPEOFQNQNOS-SFHVURJKSA-N 382.529 5.130 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(Cl)c(OC(F)F)c2)c1 864022050 KPHJJGPIQFFCRN-UHFFFAOYSA-N 387.611 5.188 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(Cl)cc1Cl)c1nc2ccccc2s1 915098567 XWVKIZVCKLDZAU-ZDUSSCGKSA-N 375.280 5.412 30 20 GKED Cc1cccc(OCCN(C)C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915353446 UDNRWQBLNUSJEW-DEOSSOPVSA-N 399.494 5.193 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccccc1Cl)C(=O)Nc1cc(Cl)cc(Cl)c1 916943517 YZICTHIIPXNFIJ-YVACAVLKSA-N 393.657 5.008 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)c(Cl)n1 917877271 ZZMAKTDBBLZJJA-UHFFFAOYSA-N 398.249 5.613 30 20 GKED CCCCS[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 918488980 IMKAJFKWAXVLAJ-IUODEOHRSA-N 378.950 5.562 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2ccc(C(=O)O)nc2)cc1 1776125340 FIUZUYDXDXBIJT-AAKUMTKESA-N 381.472 5.271 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)cc1 1776144347 XZSUXPYSYZIIFR-KRXBUXKQSA-N 382.799 5.158 30 20 GKED C=CCCC[C@H](NCc1ccc(-c2ccc(Cl)c(Cl)c2)s1)C(=O)O 1776170898 PMHGUWXAUOYWDF-INIZCTEOSA-N 384.328 5.621 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2Cl)cc1OC 1776801467 RXILOVNQHAPGEE-NTMALXAHSA-N 388.847 5.122 30 20 GKED N#Cc1c(CSc2nc(C(F)(F)F)nc3ccccc23)cn2ccccc12 10498058 FASFLECIXGGGMX-UHFFFAOYSA-N 384.386 5.065 30 20 GKED Cc1ccc(-n2c(SC[C@H](C#N)CCC#N)nnc2-c2cccc(C)c2)cc1 15242486 PNWJNQLQRWHZGM-SFHVURJKSA-N 387.512 5.087 30 20 GKED Cc1ccc(C)c(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2cccc(C)c2)c1 22729812 JFVBBNPAMYTHPT-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1ccc(C)c(C(=O)c2ccccc2C(=O)[C@H](C#N)c2nc3ccccc3o2)c1 41542716 RARKNCLXZLZYDH-FQEVSTJZSA-N 394.430 5.166 30 20 GKED CC1CCC(N(C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 48161600 UOEWKSNFUHZPNU-UHFFFAOYSA-N 391.515 5.374 30 20 GKED Cc1csc(CNC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 56750858 BROOHDNOYVHQDQ-UHFFFAOYSA-N 398.875 5.091 30 20 GKED CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccccc1S[C@H](C)CC#N 66955857 TTZKHGPBXVUKPX-CYBMUJFWSA-N 393.965 5.850 30 20 GKED N#Cc1ccsc1NC(=O)c1oc2ccccc2c1CSc1cccs1 121184904 CRAMPICYZDNMPL-UHFFFAOYSA-N 396.518 5.972 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N(CCC#N)Cc1ccco1 125089281 HKTIHYNDWCDHGV-UHFFFAOYSA-N 389.455 5.115 30 20 GKED Cc1c(Cl)cccc1-n1c(SCCCCC#N)nnc1-c1ccncc1 136027794 LCPZADOITVAKPN-UHFFFAOYSA-N 383.908 5.077 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccccc1 153280713 CETYRJPTPVFUMK-IBGZPJMESA-N 382.554 5.330 30 20 GKED CCS[C@H]1CCC[C@@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 178056540 AXYQQLBWNYRWKO-FPOVZHCZSA-N 396.581 5.255 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccccn3)ccc2Cl)sc2c1CCC2 178806010 NJEJYYHWQDRFAB-UHFFFAOYSA-N 379.872 5.076 30 20 GKED C[C@@H](N[C@H](COc1ccccc1F)c1ccccc1)c1ccc(OCC#N)cc1 181622520 JXTVXUBCBXOCBJ-WZONZLPQSA-N 390.458 5.199 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 182122493 ATANQZSXQKUGCT-ZIAGYGMSSA-N 376.378 5.129 30 20 GKED Cc1ccc(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)s1 215886353 CODBLMQFSSXKNS-KHPPLWFESA-N 385.492 5.259 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)cc1OCCCC#N 237307117 RBPZDYQOFOEEHC-ITSWEJNFSA-N 398.934 5.518 30 20 GKED N#CCC[C@H](Nc1nn2cc(-c3ccc(Cl)cc3)nc2s1)c1ccccc1 302496902 KJMDPGIYQGIDEC-KRWDZBQOSA-N 393.903 5.568 30 20 GKED C[C@H]1CCCN(C(O)=Nc2cccc(C(O)=Nc3ccc(Cl)cn3)c2)CC1 329217054 PNDOXIBLENQJJM-AWEZNQCLSA-N 386.883 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(F)(c2cccnc2)CC1 368497154 WAJLMMDNWBKWTA-UHFFFAOYSA-N 381.495 5.426 30 20 GKED N#CC1(CC[S@](=O)Cc2coc(-c3ccc(Cl)cc3)n2)CCCCC1 417159559 OTGBOLYDVWTNQW-VWLOTQADSA-N 376.909 5.108 30 20 GKED N#Cc1ccc(NC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)c(Cl)c1 426131322 ZWXADRLWGUWBMU-HXUWFJFHSA-N 387.870 5.391 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cccc(N2CCCC2)c1 431282890 MUZVKOCQVIJQLM-XXBNENTESA-N 390.531 5.082 30 20 GKED N#CCCC[C@H](NC(=O)NCc1cc(Cl)sc1Cl)c1ccccc1 431458119 POPGRVMLHMCTKZ-AWEZNQCLSA-N 382.316 5.289 30 20 GKED N#CCCC[C@@H](NC(=O)NCCCCc1ccc(F)c(F)c1)c1ccccc1 431475656 YWEWZTLBEYYGNI-OAQYLSRUSA-N 385.458 5.022 30 20 GKED CN(c1ccccc1NC(=O)N[C@@H](CCCC#N)c1ccccc1)C1CCCC1 433262421 QKTGPFZMKDDELD-NRFANRHFSA-N 390.531 5.622 30 20 GKED N#Cc1cc(NC(=O)N2CC[C@@H](CC(F)(F)F)C2)ccc1Oc1ccccc1 434160478 AEPKIHZJALWHOJ-AWEZNQCLSA-N 389.377 5.157 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 435288945 MEEBIGKCLNENJJ-JOCHJYFZSA-N 383.451 5.183 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 436354176 VLPODEWBIKOUPM-QANKJYHBSA-N 385.920 5.269 30 20 GKED O=C(NC[C@H]1CCC[C@@H](C(F)(F)F)C1)Nc1ccc(F)cc1C(F)(F)F 438583477 MUJHIZJJWWSNNC-VHSXEESVSA-N 386.311 5.335 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)CNc1ccc([C@@H](C)Sc2ccccc2)cc1 439550469 NHIHJCCLKAJOCL-VGSWGCGISA-N 381.545 5.006 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(Cc3ccccc3C#N)C2)n1 447065979 IUOOXGRRDPJSQS-LJQANCHMSA-N 389.524 5.070 30 20 GKED C=CCC[C@@H](NCc1ccn(CC(F)(F)F)n1)c1ccc(C(F)(F)F)cc1 450686536 UVTAYTHBRWSBSJ-MRXNPFEDSA-N 391.359 5.261 30 20 GKED C=C(C)Cn1c(-c2ncccc2C)nnc1N1CCC[C@H]1c1cccc(Cl)c1 460584736 OLEYHJJWUZFKSG-IBGZPJMESA-N 393.922 5.220 30 20 GKED C[C@@H](NCc1nnc(-c2ccccc2)s1)c1ccc(-c2cccc(C#N)c2)cc1 464480475 LVSCVJKGFCQSKO-QGZVFWFLSA-N 396.519 5.595 30 20 GKED N#Cc1cc(NC(=O)c2cc(F)c(Br)cc2Cl)ccc1Cl 474598211 YBGGKRIMIOHAFG-UHFFFAOYSA-N 388.023 5.019 30 20 GKED N#CC[C@@H](CC(=O)NCc1ccc(COCc2ccccc2)cc1)c1ccccc1 474891342 DBMPELHGMAODDP-VWLOTQADSA-N 398.506 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC=C(c2c(F)cccc2F)CC1 475554786 JZSPSSZJXGRGDD-UHFFFAOYSA-N 396.481 6.138 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1ccccc1 476135724 GMRYNMZGKXMYFW-KRWDZBQOSA-N 391.858 5.553 30 20 GKED CC(C)c1ccc(/C=C/CC(=O)N2CCC(Oc3cccc(C#N)c3)CC2)cc1 487420114 OBELRGVWDXZEMQ-SNAWJCMRSA-N 388.511 5.155 30 20 GKED N#Cc1ccc(Br)c(CN2CCCC[C@@H]2c2nc3ccccc3o2)c1 492744748 HPGFDRHPVLRBSU-GOSISDBHSA-N 396.288 5.189 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1csc(-c2ccc(Cl)s2)n1 493666926 OZIBCIDCERRIHD-UHFFFAOYSA-N 380.947 5.415 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccccc2)cc1Cl 510023072 JFTQMUHDVFWPJX-FQEVSTJZSA-N 375.859 5.317 30 20 GKED CC(=O)c1ccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 510246378 ZCACFLRMJVUAEX-UHFFFAOYSA-N 384.435 5.043 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(CC)[C@H](C)c1cc2ccccc2o1 510859280 IXVQBHJDPJGVCM-OAHLLOKOSA-N 377.444 5.318 30 20 GKED C[C@H]1CCCC[C@H]1N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511373534 PNJHOOVOBKFNAP-FDDCHVKYSA-N 391.515 5.374 30 20 GKED CC1=C(c2ccco2)CN(C(=O)c2cccc(COc3ccccc3C#N)c2)CC1 512762393 RLXJNSOXSQSKPC-UHFFFAOYSA-N 398.462 5.050 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1F 519505428 VMUSDSADNFLINY-GFCCVEGCSA-N 396.409 5.592 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccccc1OC(C)C 521572825 ZVCWYZYZQNMCNF-UHFFFAOYSA-N 386.451 5.699 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC[C@@H](c2ccncc2)C1 521671890 AZCBHAMLLGPNBR-HXUWFJFHSA-N 399.519 5.124 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1 523699191 APSXGTNAILLWGG-WMZOPIPTSA-N 387.405 5.184 30 20 GKED CCC[C@H](C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 532072699 GWBOWHQRUDTYDH-LJQANCHMSA-N 389.524 5.137 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)NCc2ccc(-c3ccccc3C#N)cc2)c1C(C)C 536884750 GVOJJQDWSOHJFB-UHFFFAOYSA-N 399.494 5.118 30 20 GKED C=C(C)COc1cc(CN(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)ccc1OC 542709909 LIHYPDBVFAEGDV-GGAORHGYSA-N 399.506 5.141 30 20 GKED C[C@@H](NC(=O)CSc1ccc(C#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 543859624 OCXHRSIBBHVUKP-QGZVFWFLSA-N 397.503 5.066 30 20 GKED CCN(C(=O)c1ccc(OC)c(OC2CCCC2)c1)[C@H](C)c1ccc(C#N)cc1 544084509 QEABMTZNTLVTFT-QGZVFWFLSA-N 392.499 5.112 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCC[C@@H]2CCCCO2)c1 546161127 LHUNWTIKFPRXCA-KRWDZBQOSA-N 398.890 5.083 30 20 GKED Cc1ccc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)cc1Br 566999037 LIZGDHQDURHAFB-OAHLLOKOSA-N 382.261 5.048 30 20 GKED Cc1ccc([C@@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2ccc(F)cc2Cl)cc1 596283395 VHPATYSIYISAFD-HRAATJIYSA-N 399.897 5.212 30 20 GKED N#CC[C@H]1CCCN(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)C1 596704310 KJPQKIWAHHDESH-OAHLLOKOSA-N 385.920 5.649 30 20 GKED N#CCCCn1cc(C(=O)N2CC3(CCCC3)[C@@H]2c2ccco2)c2ccccc21 598041316 SOFJSZYUPIKTBV-QFIPXVFZSA-N 387.483 5.296 30 20 GKED Cc1cc(Br)c(F)c(C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 599969858 GBVROMLYCKSHRB-KRWDZBQOSA-N 389.268 5.062 30 20 GKED CC1(C(=O)Nc2ncc(Cc3ccc(C#N)cc3C(F)(F)F)s2)CCCC1 603758308 TZRALPFIOVZWGM-UHFFFAOYSA-N 393.434 5.143 30 20 GKED C=CC[C@H](C)NC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 605129660 MDNUWJMIVOAXDB-LBPRGKRZSA-N 392.286 5.332 30 20 GKED C=CCCCCCN(C)C(=O)c1csc(-c2cc(Br)cs2)n1 606816734 LBMBRHTVNODHRT-UHFFFAOYSA-N 399.379 5.453 30 20 GKED COc1ccc([C@H](NCc2cccc(OCCCC#N)c2)c2ccccc2)cc1 608860630 VYZFFMUQPFJICE-RUZDIDTESA-N 386.495 5.257 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccccc1 608994733 RVMUBQKSWAIBKR-KRWDZBQOSA-N 386.455 5.013 30 20 GKED CC(C)(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1ccccc1 609104157 RLBLLWPNANWPON-UHFFFAOYSA-N 388.442 5.193 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(C#Cc2ccccc2)cc1 609378752 MFCGUXXEPHFLHV-UHFFFAOYSA-N 382.488 5.344 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434417 HGBUSDNGEYJJBH-OAHLLOKOSA-N 377.469 5.637 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc2ccccc2c1 609437310 ZUSMPHSGACLRDN-QGZVFWFLSA-N 389.524 5.898 30 20 GKED N#C[C@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)C1CCCCC1 609648647 YCBHMRYKFHSOSL-IBGZPJMESA-N 378.501 5.151 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](c3ccco3)C2)cc1F 610335088 QDRYZQGJAFAIAQ-INIZCTEOSA-N 391.402 5.104 30 20 GKED C=CCn1c(S[C@@H](C)c2cc(F)ccc2F)nnc1-c1ccc(OC)cc1 615346695 WPHGYTKFMWUHLA-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED CCn1cc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cn1 647323148 LVYMQBSWTHMNNR-JTQLQIEISA-N 383.311 5.366 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)s2)c(C)c1 647377352 FOTZOXQMYGSIJG-OAHLLOKOSA-N 379.510 5.251 30 20 GKED C=CC[C@H]1CCCN(Cc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)C1 661378948 PCHZLMOBYPHQLZ-FQEVSTJZSA-N 397.588 5.541 30 20 GKED Fc1ccc2c(c1)OCCC[C@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 679768808 TZQRBNGSETVKBW-REJLFOLJSA-N 399.350 5.539 30 20 GKED Cc1ccnc2sc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c(C)c12 683810253 WMFALAUPMLIUJL-GFCCVEGCSA-N 381.457 5.152 30 20 GKED CCc1cccc(NC(=S)Nc2ccc(OCc3cccc(C#N)c3)cc2)c1 727980242 HJSMIMFNNQQOAG-UHFFFAOYSA-N 387.508 5.509 30 20 GKED CCc1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)s1 728028256 AZIHPVQTTHHGDP-UHFFFAOYSA-N 376.481 5.322 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cc(-c2cccs2)nc2ccccc12 731838310 GFFHXKCGDSJZFC-UHFFFAOYSA-N 377.513 5.365 30 20 GKED CC(CCc1cccc(C)c1)=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1 733080521 ZAEDWLMIQBXFTN-UHFFFAOYSA-N 399.420 5.286 30 20 GKED C#CC[C@H](OC(=O)c1sc2cccc(Cl)c2c1Cl)c1ccccn1 733692885 ZYWOUMVXEVPVSU-ZDUSSCGKSA-N 376.264 5.525 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(-c2ccoc2)n1 735317843 GHNZYJZKZSNUGF-UHFFFAOYSA-N 376.890 5.392 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743097854 XXJLBIQIRCIBPG-OAQYLSRUSA-N 399.425 5.137 30 20 GKED CC(C)(C)C[C@@H](NC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)cc1 743103472 UVACQUDANPAPKY-LJQANCHMSA-N 385.895 5.541 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3nc(S)oc3c2)cc1 746125400 HRZSXHBXKCWYNS-SFHVURJKSA-N 385.448 5.024 30 20 GKED CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(C#N)c(Cl)c1 746660037 ORBMVNAXBQUERS-UHFFFAOYSA-N 381.785 5.284 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 748535574 FHSXBSYHOJFGPF-DNQXCXABSA-N 394.478 5.509 30 20 GKED Cc1cc(CCC(=O)[C@H](C#N)c2nc(C(C)C)cs2)ccc1Br 751870832 RVDVREUFTJOBCQ-AWEZNQCLSA-N 391.334 5.147 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 755219980 NEAQYJYZXXOAKA-CRMANMIKSA-N 395.506 5.909 30 20 GKED C[C@H](OC(=O)C1(C#N)CCCCC1)c1nnc(-c2ccc(Cl)cc2Cl)o1 758001904 JSNZJGTXCLRDTO-NSHDSACASA-N 394.258 5.122 30 20 GKED C=C[C@@H](CC(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C)c1ccccc1 758800511 VJESVLMGHREFRW-SFHVURJKSA-N 394.515 5.352 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCCC[C@H]1c1nc2ccccc2o1 761991303 ZUZKVKLHIKHKGD-SFHVURJKSA-N 381.863 5.111 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](Cc2nccn2C)c2ccccc2)cc1 766297678 CCVRSBGVFGNPIF-AVRDEDQJSA-N 395.934 5.186 30 20 GKED Cc1csc(SCc2c(C(=O)N[C@@H](C#N)CC(C)C)oc3ccccc23)n1 768143052 KXFYWCYLKANSIQ-CQSZACIVSA-N 399.541 5.158 30 20 GKED FC(F)SCc1ccc(CN2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)o1 768993605 WQNXSLQLHRTXNN-DTORHVGOSA-N 397.331 5.298 30 20 GKED CC[C@H](Nc1ccc(OC)c(NC(=O)C2CCCCC2)c1)c1ccc(C#N)cc1 774346516 XUHUOJKROFKNSI-NRFANRHFSA-N 391.515 5.649 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776168244 HVRBCKIMUDDHDE-IIBYNOLFSA-N 388.433 5.966 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)c(-c2ccc(C#N)cc2)n1 777917523 AZXZASOTOSAULW-FLIBITNWSA-N 395.434 5.170 30 20 GKED Cc1nc([C@@H](C)OC(=O)c2cccc(F)c2C#N)oc1-c1ccc(Cl)cc1 778370928 IWLHGNYCRFOZHR-GFCCVEGCSA-N 384.794 5.232 30 20 GKED C=CC[C@H](C(=O)O[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccccc1 778427480 FSLIVWBLQZTMLB-XLIONFOSSA-N 376.456 5.318 30 20 GKED CCc1cc(O)ccc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 791152719 WVQSBUKJHRKUBJ-UHFFFAOYSA-N 376.387 5.010 30 20 GKED Cc1nn(-c2ccccn2)c(Cl)c1C=NNc1c(Cl)cc(F)cc1Cl 794922593 LEYYWGMDTCJCTF-UHFFFAOYSA-N 398.656 5.121 30 20 GKED O=C(C[C@@H]1CCC(F)(F)C1)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 797972651 XFNKIAJZIJTTOQ-ZANVPECISA-N 389.286 5.251 30 20 GKED Cc1cc(O)nc2cc(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)ccc12 808240107 QXYXSUXFXOBJAD-QFIPXVFZSA-N 393.446 5.157 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1nc(C2CC2)cs1 842940997 MFUBSHCEMSWRKC-RBSFLKMASA-N 377.296 5.307 30 20 GKED N#CC1(CCCC[S@](=O)Cc2csc(-c3ccccc3F)n2)CCC1 899391330 IWCFEJZJGPWZHN-VWLOTQADSA-N 376.522 5.062 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)COc2c(Cl)cc(Cl)cc21 915986954 KLTFXHNVIVSLNM-YHYXMXQVSA-N 389.263 5.171 30 20 GKED COc1ccc(C(=O)/C=C\c2c(C)nn(-c3ccc(F)cc3)c2Cl)c(F)c1 916142010 XYJDJQVFCRBKRF-KTKRTIGZSA-N 388.801 5.017 30 20 GKED CCCCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3ccccc3[nH]2)cc1 916844628 RGPGUNAGMVCSQG-IBGZPJMESA-N 387.483 5.135 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2oc3ccc(F)cc3c2C)cc1 916954619 JMAGGFOXQXPMDS-BFUOFWGJSA-N 392.430 5.355 30 20 GKED COc1cccc(Oc2ccc(NC(=O)c3ccccc3SCC#N)cc2)c1 918675730 AEIOCQPJVTTXHC-UHFFFAOYSA-N 390.464 5.355 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1cc2c(s1)CCCCCC2 920102134 QBMPOENIOOZUBT-KRWDZBQOSA-N 390.508 5.402 30 20 GKED C=CCn1c(-c2cccnc2)nn(CN(C)C2CCC(C(C)(C)C)CC2)c1=S 921047101 VMCQOVUKNMPEOS-UHFFFAOYSA-N 399.608 5.156 30 20 GKED CC(/C=C1/CCCc2cc(C(=O)O)ccc2C1=O)=C\c1ccccc1OC(F)F 1776200012 JGYSCXWUTFGUDZ-YYMXQEISSA-N 398.405 5.535 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc(Cl)cc2)s1 1776783137 ZWGPRGNFAXETCK-SFHVURJKSA-N 393.980 6.362 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](Cc2cccc(C)c2)C(=O)O)c1 1776788710 QADDQCARFUFZEC-QHCPKHFHSA-N 397.559 5.377 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(C(C)(C)C(=O)O)cc2)cc1 1776788911 AJCKJSSDCSNVMT-UHFFFAOYSA-N 383.532 6.010 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1cc(C(=O)O)c(C)o1 1777487782 SQZHUYHFNNDOGO-FPLPWBNLSA-N 387.844 5.268 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4c(O)cccc4C3=O)s2)c1 1777684373 WYHJROTZPUQNDA-WYMLVPIESA-N 376.433 5.031 30 20 GKED O=C(O)c1ccc(/C=C(/C(=O)c2ccccc2)c2nc3ccccc3s2)cc1 6341770 TYPSIOJRJPUDHA-JXAWBTAJSA-N 385.444 5.418 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2ccc(SC)cc2)nc2ccccc21 22351468 IADIWZVUIZYYMI-CQSZACIVSA-N 383.542 5.064 30 20 GKED Cc1nc(C(C)C)sc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 66037324 VQSFWRZSNIIFKR-UHFFFAOYSA-N 377.469 5.491 30 20 GKED Cc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(Br)c1 66157915 JOGBCHHXPUEEJP-UHFFFAOYSA-N 386.293 5.072 30 20 GKED COc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 66954012 YYFPQXKECCABIB-UZLBHIALSA-N 395.528 5.458 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H](C)c1ccc(F)cc1 108359794 RWBFNVRWGREODB-IRXDYDNUSA-N 399.535 5.242 30 20 GKED N#C[C@H](NC(=O)CCCCC(=O)c1ccccc1)c1cccc(Cl)c1Cl 112908194 XXAVWNINSJZEEG-KRWDZBQOSA-N 389.282 5.118 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)n1 117081863 KKWDHAQIHHIYGJ-KRWDZBQOSA-N 393.855 5.259 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1nccc2ccccc12 121319431 RDIQUUDPEMBXJR-HNNXBMFYSA-N 393.537 5.360 30 20 GKED C=CCn1c(COc2ccccc2)nnc1S[C@@H](C)c1ncc(C(C)(C)C)o1 122718560 ARZRTFGXXBNKCM-HNNXBMFYSA-N 398.532 5.182 30 20 GKED COCc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2SC[C@@H](C)C#N)o1 123696147 FWFPOWMAHQIHIU-MAUKXSAKSA-N 399.516 5.047 30 20 GKED CCc1ccccc1N/C(S)=C(\C(=O)c1ccccc1C)[n+]1ccc(C)cc1 127602422 VWKAYQDWQSNHQY-UHFFFAOYSA-O 389.544 5.204 30 20 GKED CC[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(C)noc1C 161305313 WROQIQUIKUPUBU-HXUWFJFHSA-N 375.428 5.088 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)c1cccc(CC#N)c1 172540885 MXWXIAHFFYHXPG-UHFFFAOYSA-N 398.441 5.006 30 20 GKED CCS[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 175362927 LXOKCIWQJBLTLR-HRCADAONSA-N 377.579 5.267 30 20 GKED C[C@H]1CCC[C@@H](C)N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 175374020 RFQHLCNFMFDSHA-RBUKOAKNSA-N 391.515 5.374 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc2ccccc2n1)c1nc2cc(Cl)ccc2s1 176462563 ZRVBSPSDAOHYRW-ROJDOSBLSA-N 389.867 5.388 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccccc1OC 182235833 BKHXJXBIWUFUKB-AWEZNQCLSA-N 392.484 5.134 30 20 GKED Cc1cc2cc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)oc2cc1C 187574809 IHVHYNXOPBMGPW-CQSZACIVSA-N 379.366 5.285 30 20 GKED N#C[C@H](C(=O)c1occc1CSc1ccccc1)c1cnc2ccccc2n1 190937653 QTKZAVXACWDWTI-KRWDZBQOSA-N 385.448 5.005 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2csc(-c3ccsc3)n2)cc1 195120109 GDGSRCUSWMNUNG-UHFFFAOYSA-N 395.553 5.298 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)NCCCCC#N)nc1-c1ccccc1 267227714 VWVNVAOZZNSBQM-GOSISDBHSA-N 380.492 5.005 30 20 GKED CC(C)OCc1cc(NC(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1O 290070852 BOEQORPFQXPASO-OAHLLOKOSA-N 399.516 5.213 30 20 GKED Cc1csc([C@H](C)C/N=C(/O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)n1 329806813 BGZGILHQKOYMFN-PBHICJAKSA-N 386.565 5.018 30 20 GKED C[C@H](/N=C(/O)N1CC2(CCC2)c2ccccc21)c1nc(C2CCCCC2)no1 330051450 NMYFCIRUONXNPF-HNNXBMFYSA-N 380.492 5.034 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 413405704 PTLPWUHTQWLSRB-SWLSCSKDSA-N 383.439 5.230 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431811179 QMCHQHDASLNZKT-PGRDOPGGSA-N 379.504 5.269 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1C[C@H]1c1c(F)cccc1Cl)c1ccccc1 431980653 KAADULXEWRIZRN-MNEFBYGVSA-N 385.870 5.069 30 20 GKED CC[C@@H](CNC(=O)N[C@@H](CCCC#N)c1ccccc1)Oc1ccccc1Cl 431982387 RZOUVNBQPHCBNT-ICSRJNTNSA-N 399.922 5.232 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC[C@H]1c1ccccc1 438639302 VSLXUBGIZCLHDJ-RDTXWAMCSA-N 387.405 5.235 30 20 GKED N#CCC[C@@H](NC(=O)N[C@H]1CCSc2ccc(Cl)cc21)c1ccccc1 438845386 BBRKSVFYSDNYQR-MSOLQXFVSA-N 385.920 5.221 30 20 GKED Cc1c(F)ccc2sc(NC(=O)c3cn(CCCC#N)c4ccccc34)nc12 444313202 VBGWEJSTMUBAPT-UHFFFAOYSA-N 392.459 5.255 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)c1C 444460196 ZUQKJJKTJGIXDG-INIZCTEOSA-N 384.357 5.467 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)[C@@]1(C#N)C[C@H]1C 449978903 BOWAWCOZYNBCNH-IQMFZBJNSA-N 390.462 5.220 30 20 GKED Cc1ccccc1[C@]1(F)CCN(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458855138 XWYJPMPOVIZFRL-GMAHTHKFSA-N 379.479 5.010 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(-c2cccnc2)cc1 464895724 BTYLCZJBGHREAH-UHFFFAOYSA-N 389.458 5.217 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(Cc2ccccc2)CCC1 466424581 GLBTYTKZXGCGCD-UHFFFAOYSA-N 397.478 5.406 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ncccc1OCCCC#N 466613521 GCARIKKYPUBLKY-UHFFFAOYSA-N 396.491 5.113 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCc4ccc(Cl)cc43)ccc21 468876626 GZUUKMHNISJSLO-FQEVSTJZSA-N 379.891 5.022 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1C 471252224 XPIFPHDXEZHFNM-LJQANCHMSA-N 393.531 5.134 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)Cc1cc[nH]n1 475542409 AGDLAYYWTCESKS-UHFFFAOYSA-N 388.515 5.496 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 476168626 XMZOPWOTIRWZBJ-QGZVFWFLSA-N 396.918 5.184 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](C)c1ccc(OC(C)C)cc1 479373380 JHELJTIRABLYQH-LJQANCHMSA-N 398.551 5.100 30 20 GKED CCN(C(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(F)c(F)c1 482466980 QJKONWIXMADOLK-UHFFFAOYSA-N 378.378 5.295 30 20 GKED C=CCSc1ccccc1C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F 485747238 WKYUISSGNKVYBA-ZDUSSCGKSA-N 387.455 5.201 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(-c3ccc(C(F)(F)F)cc3)o1)CC2 490394228 BYYKYHOCCRKJAQ-UHFFFAOYSA-N 382.341 5.040 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2nc(C(F)F)sc2c1 493053460 GQKBFTQXOKNIBQ-UHFFFAOYSA-N 398.438 5.326 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1C(C)C 496027239 GFGLCVCXXCPQFK-QGZVFWFLSA-N 383.904 5.644 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1Cl 496407274 MVIOUVBUMAEASJ-NSHDSACASA-N 377.252 5.102 30 20 GKED C[C@H]1CCN(CCCC2(C#N)CCOCC2)[C@H]1c1ccc(C(F)(F)F)cc1 499569627 CCDLDUJGEMJMCH-QFBILLFUSA-N 380.454 5.189 30 20 GKED N#CCc1ccc(NC(=O)[C@@H](Oc2ccc(F)cc2Cl)c2ccccc2)cc1 499748251 JDIZVBIDWKRYHO-NRFANRHFSA-N 394.833 5.304 30 20 GKED C=CCN(Cc1cc(-c2ccco2)on1)Cc1cc(Br)ccc1F 502171360 SVZUMJSOMWGECB-UHFFFAOYSA-N 391.240 5.024 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C 510626504 GQJNIKPTVHAJED-ZDUSSCGKSA-N 392.425 5.358 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1C#N 511418030 ZNUAEXITIHXPOM-LLVKDONJSA-N 382.420 5.211 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)c2ccc(C#N)cc2F)cc1 512617762 GQYOWZDOANVWMZ-FYSMJZIKSA-N 392.449 5.480 30 20 GKED Cc1cccc([C@H](NC(=O)Nc2ccc(C(C)(C)C#N)cc2)C(F)(F)F)c1 512889199 MKKHKHBYTOPXNB-KRWDZBQOSA-N 375.394 5.221 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(CC#N)c2)n(-c2cccc(Cl)c2)n1 516112532 WYZOIKHJYYIPIM-UHFFFAOYSA-N 392.890 5.142 30 20 GKED C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(C#N)cc1 518277285 DODQCNCXRCNKBZ-HNNXBMFYSA-N 391.402 5.249 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)Nc1ccccc1SC[C@H](C)C#N 520832416 JIXHOZINFDNGAJ-RTBURBONSA-N 395.572 5.176 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@@H](c3ccccc3)C2)cc1 521213559 LKWVENIXWAOJJV-JOCHJYFZSA-N 398.531 5.480 30 20 GKED Cc1ccc(Br)c(C)c1C(=O)Nc1cccc(OCCCC#N)c1 521959364 QHEJJPSOYGUFGB-UHFFFAOYSA-N 387.277 5.001 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@H](C)Nc1ccc(-c2ccccc2)cc1 525761176 YXIPGCNFENCVDO-IBGZPJMESA-N 399.494 5.109 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3ccco3)c3cccc(Cl)c3)o2)cc1 532700916 NOEQSHHMFHXAPD-UHFFFAOYSA-N 390.830 5.061 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cn(C)nc3-c3ccccc3)n2)cc1 536766369 FFNYMHBDHIIGFL-SFHVURJKSA-N 398.491 5.009 30 20 GKED C[C@@H](NCc1cccc(C#N)c1F)c1ccc(OCc2ccc(F)cc2)cc1 537099373 WEGWQCDAPLVNRV-MRXNPFEDSA-N 378.422 5.266 30 20 GKED CC(C)(C)OCc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 538043952 OEBPCVKAHUMOOA-MRXNPFEDSA-N 397.425 5.237 30 20 GKED N#CCC[C@@H](NC1CCN(Cc2c(F)cccc2Cl)CC1)c1ccccc1 540148666 YIVDZRNEJMMLNU-JOCHJYFZSA-N 385.914 5.078 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)c1ccc(OCc2ccc(CC#N)cc2)cc1 541289442 PKDQADYEXLVOSY-UHFFFAOYSA-N 390.870 5.262 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cc2ccccn2)ccc1C 549387305 FZLIZTZUVDLEJZ-UHFFFAOYSA-N 396.494 5.073 30 20 GKED N#CCCC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 552313115 MWHXJUXKRGLCSX-OAQYLSRUSA-N 375.428 5.380 30 20 GKED CC(C)[C@@H](c1ccc(Cl)cc1)c1noc([C@@H](C#N)Cc2ccc(C#N)cc2)n1 558388518 NIFYNKIIOXWAIT-QUCCMNQESA-N 390.874 5.232 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Cl)cc1-c1nc(C2CCCC2)no1 563686583 GTRWZWKTGBHJJY-UHFFFAOYSA-N 398.875 5.233 30 20 GKED N#Cc1ccc(CNCc2cc(F)c(C(F)(F)F)cc2F)c(C(F)(F)F)c1 565591295 PUVJPPBYCZPUMN-UHFFFAOYSA-N 394.265 5.164 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)C3(C(F)F)CCCC3)c2)cc1 582263166 HQDUGTJLYYLXKB-UHFFFAOYSA-N 384.426 5.096 30 20 GKED CCOc1cc(CN(C)[C@H](C#N)c2ccc(Cl)cc2)ccc1OC(F)F 585718203 MPHMGWAQILQGGE-MRXNPFEDSA-N 380.822 5.037 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2Cl)C1 589404674 DWYIASUYABSHCU-HOTGVXAUSA-N 399.947 5.199 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(OCc2ccccc2)cc1 590257318 JPYZEHGSTWOHHF-QFQXNSOFSA-N 384.523 6.351 30 20 GKED C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 593695362 LZWMMWTVTQOLKW-RYGJVYDSSA-N 399.991 5.019 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2Sc2ccccc2C#N)cc1Cl 603454470 FUUGTNLWUZMSNV-UHFFFAOYSA-N 389.867 5.487 30 20 GKED CC(C)c1ccccc1NC(=O)CNc1cccc(OCc2cccc(C#N)c2)c1 604006921 AFANPZRJKLOLDU-UHFFFAOYSA-N 399.494 5.311 30 20 GKED C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NCc1ccccc1C#N 604009940 GUMRGZRGJYMSOK-HOTGVXAUSA-N 381.907 5.227 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc2cc(F)ccc2o1 605083645 UXCLXSVYTXBFIX-IAZYJMLFSA-N 397.290 5.211 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCCCC[C@@H]1c1ccco1 605925533 XVYXMIJNOUEBAQ-JOCHJYFZSA-N 385.467 5.224 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)c1 606944558 UUJWHUAROIEDCE-MRXNPFEDSA-N 377.444 5.179 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 609031685 LHPPPTGGCYAIFI-KBPBESRZSA-N 375.255 5.006 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1SC[C@H](C)C#N 609376721 IDXWACBGNWCTKQ-OAHLLOKOSA-N 391.496 5.083 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)NC[C@H]3CCOc4ccccc43)cc2)c1 609437210 WDUXBZGZIOBWPI-GOSISDBHSA-N 399.450 5.038 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H]3c3cccc(F)c3)cc2)cc1 611042782 XFANESDNLKOYOE-JOCHJYFZSA-N 387.414 5.469 30 20 GKED N#Cc1ccc(SCc2nnc(-c3ccc(Cl)cc3Cl)o2)c(Cl)c1 611102497 PGLOFMYESOJAIL-UHFFFAOYSA-N 396.686 5.861 30 20 GKED C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(NC(=O)c2ccccc2)c1 611390656 MZLXJYMWGYPJHK-CJAUYULYSA-N 395.506 5.539 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)C1 612241912 GZZUJFWNXUJFPC-NRFANRHFSA-N 384.932 5.398 30 20 GKED Cc1cc(C)c(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)cc1O 613032405 IDXXWFAMRVAPKD-UHFFFAOYSA-N 376.387 5.064 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F 615081466 JAYXJUFYSDWNTJ-RTBURBONSA-N 389.417 5.032 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)NCC#Cc2cccc(C(F)(F)F)c2)c(C)c1 615641181 OYPPAHGPLOZGER-KRWDZBQOSA-N 388.433 5.076 30 20 GKED Cc1ccnc(Oc2cc(NC(=O)N[C@H]3CCc4cc(C#N)ccc43)ccc2C)c1 618758721 KVVSDQHFGPUDLZ-NRFANRHFSA-N 398.466 5.171 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc(Cl)c1Br 647379709 GXOWIUFQVBVIGK-LLVKDONJSA-N 395.709 5.235 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1c(C)cccc1C 669321958 ZNLXBILETRAGJP-VQTJNVASSA-N 380.536 5.054 30 20 GKED Fc1ccc([C@H](NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C2CC2)cc1 678685327 STVAFHRTMMBSAA-XJKCOSOUSA-N 383.351 5.776 30 20 GKED CC(C)(C#N)c1ccc(CN2CCC(C(=O)c3ccc(Cl)cc3)CC2)cc1 681400640 SJHKUOCNOHTYAO-UHFFFAOYSA-N 380.919 5.236 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)C(=O)Nc1ccc(SC(F)F)cc1)C1CCCCC1 726320328 WUVBZFFTTPRSMV-SUMWQHHRSA-N 394.487 5.255 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccccc2C(F)(F)F)cc1 729316106 IBIWNJMUAIZLLP-HXUWFJFHSA-N 394.396 5.542 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=S)Nc3ccccc3C#N)s2)cc1 730734791 LSMBHRVVCXWRJY-HNNXBMFYSA-N 392.553 5.346 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)s1 732729549 YRSJPLLDMMCPJR-FWPCIQOSSA-N 385.558 5.188 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N1CCC(c2cc3ccccc3[nH]2)CC1 732803239 HGNQBEZEHFDVRC-UHFFFAOYSA-N 388.421 5.250 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3c(F)cccc3F)n2)cc1 734964858 DOZMYGPCWRTTDB-BZUAXINKSA-N 394.446 5.377 30 20 GKED Cc1cc(-c2csc(NC(=O)[C@@H](C)C#N)n2)c(C)n1Cc1ccccc1Cl 736667241 NXCVMFBLKNSMFE-LBPRGKRZSA-N 398.919 5.028 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)OC(=O)c1cccc(CC#N)c1 739301064 FUTWEKMKLWCPHJ-AWEZNQCLSA-N 380.444 5.242 30 20 GKED N#Cc1ccc(F)c(CNC(=O)Nc2cccc(Sc3ccccc3)c2)c1 743146511 HJZHZHXXHOXILB-UHFFFAOYSA-N 377.444 5.170 30 20 GKED Cc1cccc(-c2nn(CN(C)C[C@H](C)C#N)c(=S)n2[C@@H]2CCCC[C@H]2C)c1 746707151 XWKDXLLSGPSYTB-QWFCFKBJSA-N 397.592 5.190 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1ccc(Cl)c(C(F)(F)F)c1 754689411 GLEXEEHJMPPOPS-RQOWECAXSA-N 394.805 5.773 30 20 GKED CC(C)[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1 756516220 GCNCHUWDHSUALS-QAPCUYQASA-N 385.389 5.187 30 20 GKED COc1ccc(C(=O)CC(C)(C)CC(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1 760221910 ZOPFXDPFNNNSDG-KRWDZBQOSA-N 398.528 5.141 30 20 GKED CCCNc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 765235478 UXEHUPZYZYMSBZ-XMMPIXPASA-N 398.510 5.486 30 20 GKED C=CCn1c(SCc2cnc(Cl)s2)nnc1-c1cccc(Cl)c1 768402500 LLGXTGOBCXJUJV-UHFFFAOYSA-N 383.329 5.187 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(Cl)cc2)C(C)C)ccc1OC 774449646 PPBVBFCGZSGRNK-UGKGYDQZSA-N 386.923 5.516 30 20 GKED Cc1ccc(-c2nc(-c3ccccc3)sc2CC(=O)OC(C)(C)C#N)cc1 779225358 ACLZDHIUGNDDIX-UHFFFAOYSA-N 376.481 5.173 30 20 GKED N#Cc1cccc(COc2ccc(NCc3cnc4ccccn34)cc2Cl)c1 779596568 XVSAJDCYAACMSE-UHFFFAOYSA-N 388.858 5.050 30 20 GKED O=C1CCc2cc(N=Cc3c(O)ccc4ccccc34)ccc2N1CC(F)(F)F 780148491 HSXRQSBJXSDPHZ-UHFFFAOYSA-N 398.384 5.138 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c(F)c1 781107163 GAUFHFGAVVFNQN-RMKNXTFCSA-N 378.384 5.230 30 20 GKED C#CCCCCCC(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 788842715 WNMXUFQQWPMQTR-UHFFFAOYSA-N 378.259 5.098 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nccc3ccccc23)c(Cl)c1 792108788 ZCUNNPKAPMLWHC-GOSISDBHSA-N 378.859 5.232 30 20 GKED Cc1ccc2c(c1)CCN(C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)C2 792228709 OLFGLFWKBQBJNP-XMMPIXPASA-N 381.479 5.241 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1)c1nccc2ccccc12 796898330 GBZOJXGSSYYSJJ-IPMKNSEASA-N 396.368 5.113 30 20 GKED O=C1/C(=C\c2ccc(-c3cccc(F)c3F)o2)C[C@H](C(=O)O)c2ccccc21 806560436 LXUJDUVVSDDJPF-LUJNMSEFSA-N 380.346 5.063 30 20 GKED C#CCCCCCc1nc(-c2ncoc2-c2cccc(C(F)(F)F)c2)no1 809532073 ZDXUYHCDSCUVCH-UHFFFAOYSA-N 375.350 5.147 30 20 GKED COc1ccc2sc(C(=O)[C@@H](C#N)c3cc(C(F)(F)F)ccn3)c(C)c2c1 813213003 HAUBLMDIQPDDSW-AWEZNQCLSA-N 390.386 5.122 30 20 GKED O=C(/C=C\c1csc(-c2ccc(Cl)cc2)n1)c1cc([N+](=O)[O-])ccc1F 814192120 YEVYTLQPTAKBJU-YVMONPNESA-N 388.807 5.407 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCCC2)cc1 815635472 DFDRFGCLLYENCP-SQJMNOBHSA-N 375.560 6.153 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)c(OC)c1OC 818259470 DNVAVYXDGQPDGL-BENRWUELSA-N 380.465 5.337 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC1CN(C(=O)OC(C)(C)C)C1 861269025 JZUAJSCKVZCSGI-UHFFFAOYSA-N 386.536 5.124 30 20 GKED N#CCOc1cccc(Cc2nc(-c3cccc(Oc4ccccc4)c3)no2)c1 904592013 UWKHQSIPUZRJJS-UHFFFAOYSA-N 383.407 5.022 30 20 GKED CC(C)n1ncc2cc(/C=C3\CSc4ccc(F)cc4C3=O)c(Cl)nc21 913617581 KWQZSOHTZZBFIK-AWNIVKPZSA-N 387.867 5.177 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccc(Cl)s2)cc1 915180557 OVCYWHFHZKEJNJ-BPOBUFBUSA-N 378.884 5.709 30 20 GKED O=C(Nc1cccc(/C=C\C(=O)c2ccc(F)cc2F)c1)c1ccc(Cl)cc1 916127988 BKJHZJYOHKETKZ-WCIBSUBMSA-N 397.808 5.767 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)c3ccc(C#N)cc3)cc2)cc1 916135280 OMSDBIGZFWMZNH-VULZFCBJSA-N 388.426 5.222 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1ccc(SC(F)F)cc1 917713093 DWIKQHHCCVCEJA-UHFFFAOYSA-N 386.448 5.854 30 20 GKED CCC(=NNc1cc(F)cc(Cl)c1)c1ccc(OCCCCC(=O)O)cc1 1776091638 ZAKZIJRSJURCNI-UHFFFAOYSA-N 392.858 5.339 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(C)c(C(=O)O)c2)cc1OCCC 1776125440 JCVXYLJAFNKJGW-CSKARUKUSA-N 382.456 5.167 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(O)c(C(=O)O)c2)cc1 1776125831 TXSZDHOHQLISES-QPEQYQDCSA-N 382.456 5.336 30 20 GKED COc1cc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)ccc1Cl 1777263520 SNWNFIFNPBZYAE-YIXHJXPBSA-N 392.838 5.610 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CSc4ccccc4C3=O)s2)c1 1777684384 ZYEUUIPSKATESM-PTNGSMBKSA-N 378.474 5.485 30 20 GKED CCCCN/C(S)=C(/C(=O)c1ccc(CC)cc1)[n+]1ccc(C(C)(C)C)cc1 27326349 BQGUCCNRBNVYPH-UHFFFAOYSA-O 397.608 5.163 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)C(=O)c1cccc(Cl)c1 32789154 ITVWOYAEXWOEON-HNNXBMFYSA-N 397.931 5.072 30 20 GKED C=C(C)CNC(=S)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 63791089 LXUIBCIGLDDNBK-UHFFFAOYSA-N 394.462 5.380 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cn2)c(C(F)(F)F)c1 107468162 BYLGOFLYHNBAGL-LLVKDONJSA-N 379.407 5.115 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccccc3SC[C@@H](C)C#N)o2)cc1C 123564650 JQFHJWPCGDBSRQ-WMLDXEAASA-N 392.528 5.778 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 151290734 SPLAVRRLSSLMQI-DOTOQJQBSA-N 378.501 5.044 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(C)c1cccc(C#N)c1 180778724 ULNHYEDXKHUDFB-UHFFFAOYSA-N 386.238 5.105 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSCC(=O)Nc1ccc(C)cc1 189873941 AKJMCEWKFQPYHP-UHFFFAOYSA-N 396.556 5.157 30 20 GKED Cc1ccc(NC(=O)CS[C@@H](C)c2cccc(C#N)c2)c(Br)c1 190882823 OETKSZSHGURLPO-ZDUSSCGKSA-N 389.318 5.062 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2c(cccc2NC(C)=O)C1 191419943 XDXQLXCMNPWRCS-UHFFFAOYSA-N 391.515 5.087 30 20 GKED COc1cc(CNCCCCC#N)ccc1OCc1ccc(Cl)cc1Cl 237139809 OJHGVYYFLOOUDJ-UHFFFAOYSA-N 393.314 5.364 30 20 GKED Cc1ccc([C@H]2CCCCN2C(O)=Nc2nc(C3CCOCC3)cs2)cc1 329463221 UHILLEHLLMBBRB-LJQANCHMSA-N 385.533 5.118 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cnc(-c4ccccn4)s3)c2C#N)CC[C@H]1C 410978164 CMSLOSOOKURJJI-NEPJUHHUSA-N 394.525 5.076 30 20 GKED CN(C)c1ccccc1N(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1 435378180 CQVMGUVWJHSONB-UHFFFAOYSA-N 387.508 5.052 30 20 GKED C[C@H](CC(F)(F)F)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 457713908 RYCJGHNUJYGWBW-GMSGAONNSA-N 381.238 5.014 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H](Cc2ccccc2)C1)c1ccccc1 458795356 CKYHTVBGGRJFCS-GMAHTHKFSA-N 375.516 5.086 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458826666 CWTFJPPSFKYZBT-RTWAWAEBSA-N 379.504 5.223 30 20 GKED FC(F)Oc1ccccc1[C@@H](NCc1ccc(C(F)F)cc1)C(F)(F)F 461372707 FQCCGEGKTAKGHD-CQSZACIVSA-N 381.291 5.619 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC2CCCCC2)c1)c1cc(C(F)(F)F)ccn1 464416839 FHNWEVGJFBPTSH-GOSISDBHSA-N 388.389 5.302 30 20 GKED C[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Oc1ccc(Cl)cc1 464630310 RVJHMDBHNWVHBG-INIZCTEOSA-N 390.870 5.076 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)C1Cc2ccccc2C1 469413675 IVWXCTFJXPEEBW-UHFFFAOYSA-N 390.430 5.065 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)o1 480639003 UWNOATZRKGJLMT-LRDDRELGSA-N 389.402 5.066 30 20 GKED C=C(C)CN(C)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 481675495 UYIVMVYGWRQGNU-UHFFFAOYSA-N 376.403 5.003 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)ccc1OC(F)F 482539056 WJAGZWHJCAJEMK-LLVKDONJSA-N 396.846 5.445 30 20 GKED C=C(C)[C@@H](NC(=O)N1CCCCC[C@@H]1c1ccncc1)c1ccc(F)c(F)c1 483312207 GZXCBOMGZMVBRE-NHCUHLMSSA-N 385.458 5.304 30 20 GKED CC(C)C[C@@H](NC(=O)CNc1ccccc1SC[C@H](C)C#N)c1ccccc1 487400084 ZDVTVOCHHAFPOC-WIYYLYMNSA-N 395.572 5.254 30 20 GKED C[C@H](S[C@H](C)c1cccc(Br)c1)C(=O)Nc1ccccc1C#N 487903509 DLUMHCXPHBJCOX-OLZOCXBDSA-N 389.318 5.142 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 490251964 TZDGUSGWIIJXPU-GCJKJVERSA-N 395.572 6.250 30 20 GKED COc1cccc(Cn2ccc3ccc(NC(=O)c4cccc(CC#N)c4)cc32)c1 490371221 RHSBAUAZTMQDFW-UHFFFAOYSA-N 395.462 5.017 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CO[C@@H]1CCCC[C@@H]1C 498070961 FLUXKRRFXNSTEE-KSFYIVLOSA-N 378.472 5.193 30 20 GKED C=CCN(C(=O)c1cc2ccccc2s1)c1nc(-c2ccccc2)cs1 498727057 CZMCERWNRTUFMC-UHFFFAOYSA-N 376.506 5.858 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(F)cc3)no2)cc1C(F)(F)F 499515469 GRTQLOLTAZNRSH-UHFFFAOYSA-N 379.338 5.058 30 20 GKED CCc1ccc(NC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cc1 502631089 DIELFMWMLQWEHG-UHFFFAOYSA-N 385.467 5.538 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(NC(=O)c2ccccc2)c1 505016683 KTXYLEHIAGVNMR-UHFFFAOYSA-N 399.494 5.379 30 20 GKED C[C@@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(Cl)cn1 507188711 QGNMBQGUWTYHCS-CYBMUJFWSA-N 395.821 5.029 30 20 GKED CCc1cc(C(=O)Nc2ccccc2SCCC#N)c2c(C(C)C)noc2n1 509487267 QFKIWNZTJITAPZ-UHFFFAOYSA-N 394.500 5.167 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Cc2c[nH]c3ccccc23)cc1 512539763 GYZQLCCBFCSHGT-UHFFFAOYSA-N 397.434 5.022 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCc2c(Cl)cccc21 516242536 JMPZROSEKZWUMT-MRXNPFEDSA-N 381.328 5.440 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cnc(C4CC4)s3)cc2Cl)cc1 519108646 SFMPYJGHEKMUKA-UHFFFAOYSA-N 395.871 5.590 30 20 GKED CC[C@H](C)c1ccc(NC(=O)CNc2ccccc2SC[C@H](C)C#N)cc1 519425157 VZMVLLPFFRQHTF-SJORKVTESA-N 381.545 5.502 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Br 519906362 ZDYKLLYLFZEYGL-UHFFFAOYSA-N 386.293 5.011 30 20 GKED CCCOc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1OCC 520923959 AWEYDHRKAYTZIW-MRXNPFEDSA-N 398.528 5.521 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)Nc1ccccc1S[C@H](C)CC#N 520941365 LMRQSEOYPPBPEK-CRAIPNDOSA-N 397.544 5.818 30 20 GKED CC(C)[C@@H](CNC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 521260023 TWUORLHGFNKVCI-PKOBYXMFSA-N 381.545 5.500 30 20 GKED C[C@H](C#N)C(=O)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 522984733 JERUUZZRXZNVGZ-XMSQKQJNSA-N 393.490 5.243 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cc3c(s2)-c2ccccc2OC3)c1 524382172 NYFAYBJRRWJHJF-UHFFFAOYSA-N 398.390 5.033 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1 531150762 JSRWUKFMSZPWNP-UHFFFAOYSA-N 398.249 5.234 30 20 GKED C=CCC[C@H](NCc1nccn1CC(F)(F)F)c1ccc(C(F)(F)F)cc1 532724968 OJEATGOIFLTCQN-HNNXBMFYSA-N 391.359 5.261 30 20 GKED CCc1c(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cnn1CC(C)C 533756744 ZIJANLDCESGUAO-KRWDZBQOSA-N 392.528 5.024 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cnn1CC(C)C 533756748 ZIJANLDCESGUAO-QGZVFWFLSA-N 392.528 5.024 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)cc1OC(F)F 536838903 MXLPDIVTEBZFMJ-BONVTDFDSA-N 395.318 5.911 30 20 GKED CSc1ccc(NC(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)cc1 541077451 OWCLAGFECCPUTM-UHFFFAOYSA-N 382.432 5.030 30 20 GKED COc1ccc(CNc2cccc(C(F)F)c2Cl)cc1OCCCC#N 542690836 GTTARGWVFKEIKP-UHFFFAOYSA-N 380.822 5.581 30 20 GKED CC(C)N(Cc1ccc(NCc2ccc(C#N)s2)cc1)C[C@@H]1CCCCO1 546963634 ZDILMLNCLYBLKE-FQEVSTJZSA-N 383.561 5.011 30 20 GKED Cc1sc(C2(NCc3cccc(C#N)c3)CCC2)nc1-c1ccccc1F 555646290 SOSMIABZBKRPDA-UHFFFAOYSA-N 377.488 5.298 30 20 GKED CC(C)Cn1c(-c2sc3ccccc3c2Cl)nnc1N1CCC(C#N)CC1 559091131 OOJDWHDJANFNDS-UHFFFAOYSA-N 399.951 5.209 30 20 GKED C[C@@H](NC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1cccc(OC(F)F)c1 564410704 FGCULCAWEGMKCJ-MRVPVSSYSA-N 395.274 5.076 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@@H](C)C3)c1C1CC1 569553162 BCVMPNGZJQYZCQ-OLZOCXBDSA-N 382.533 5.042 30 20 GKED Cc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)c1Br 590477904 FASHYJYKTCOFHJ-SFHVURJKSA-N 385.305 5.231 30 20 GKED CCc1cc(C#N)c(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)s1 604029873 IRHPCRULRGKOON-UHFFFAOYSA-N 387.917 5.140 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(F)ccc1Oc1ccccc1 609049823 WJIWXWUGGHETJW-UHFFFAOYSA-N 375.403 5.154 30 20 GKED CSCc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 609454489 PWVDPWBQOROIJB-UHFFFAOYSA-N 390.533 5.825 30 20 GKED CC(C)Oc1ccccc1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 609643410 GMGDVCOTADGUIP-UHFFFAOYSA-N 386.451 5.177 30 20 GKED C[C@H](c1ccccc1)c1ccc(OCc2nnc(-c3cccc(C#N)c3)o2)cc1 610270514 SDNBINMDGZPBMQ-QGZVFWFLSA-N 381.435 5.339 30 20 GKED C[C@@H](Sc1ccc(Cl)cc1C#N)C(=O)Nc1ncc(Cl)cc1Cl 610654696 BCYZOHFYZUMTAF-MRVPVSSYSA-N 386.691 5.033 30 20 GKED N#C[C@@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1ccc2ccccc2n1 613291068 SAEAQXCWQFNUFW-JOCHJYFZSA-N 378.431 5.304 30 20 GKED C=CCOc1c(Cl)cc(CNC(C)(C)c2nc(C)c(C)s2)cc1OC 623426008 XXNOFJQESXMGHL-UHFFFAOYSA-N 380.941 5.012 30 20 GKED Cc1ncc([C@H](C)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)c(C)n1 647323279 WETMSUJAEGHXFH-JTQLQIEISA-N 395.322 5.556 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@@H]1c1ccncc1 666866005 FRUWRHLTPGRVNN-QFIPXVFZSA-N 375.516 5.693 30 20 GKED FC(F)Oc1cccc(Cl)c1CN1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 678299112 VAMCJZKNOODHRC-RKDXNWHRSA-N 397.693 5.114 30 20 GKED COc1cc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)ccc1C(F)(F)F 685840460 RKRMUIHRFDVWBP-UHFFFAOYSA-N 399.237 5.263 30 20 GKED CN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@H](c1ccccc1)C(F)(F)F 728453520 LCMZNFKHBFQIKX-OAHLLOKOSA-N 383.826 5.144 30 20 GKED COc1ccccc1CCN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 729552753 JKYMQJAWVVGSRU-HSZRJFAPSA-N 399.494 5.057 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N(C)CCCC)cc1 730668526 VRVVEGXCDDTORE-UHFFFAOYSA-N 396.491 5.051 30 20 GKED Cc1c(C(=O)/C=C\c2cn3cc(Cl)ccc3n2)cnn1-c1cccc(Cl)c1 731565189 HPPYSRKPOJYECT-SREVYHEPSA-N 397.265 5.031 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 731971449 BFLNVHTXFRFYBP-KRWDZBQOSA-N 391.814 5.156 30 20 GKED CC(C)N(C(=O)Cc1ccc(OCC#N)cc1)c1ccc(Nc2ccccc2)cc1 731978105 BWOLHMXWGKYSNE-UHFFFAOYSA-N 399.494 5.317 30 20 GKED CC[C@H](NC(=S)N(Cc1ccc(C#N)cc1)CC(F)(F)F)c1cccs1 734375023 RUZFMHXJWNYUGK-HNNXBMFYSA-N 397.491 5.010 30 20 GKED C=CC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccncc1 734685338 ZMOMZKAMCVXDEB-RTBURBONSA-N 390.314 5.552 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](C)c3cccc(F)c3)n2)cc1 734965742 OLKWBNZQFITAIJ-DNVCBOLYSA-N 378.472 5.628 30 20 GKED COC(=O)[C@H](Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccc(Cl)c1 735508146 VNUJPTDXWJURHG-FGZHOGPDSA-N 390.870 5.322 30 20 GKED C=CCN(CC1CCCCC1)C(=S)Nc1ccc(OC(F)F)c(Cl)c1 735627298 MUUSBSUTTVOZHM-UHFFFAOYSA-N 388.911 5.707 30 20 GKED COC(=O)[C@@H](Nc1cccc(CSC2CCCCC2)c1)c1ccc(C#N)cc1 740000813 QSBXJXSSOGELSW-QFIPXVFZSA-N 394.540 5.450 30 20 GKED Cc1c(C(=O)/C=C\c2cccnc2Cl)cnn1-c1ccc(Cl)cc1Cl 743055959 OVPOOZYABFMKFS-DAXSKMNVSA-N 392.673 5.432 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)C(=O)Nc3ccccc3Cl)o2)cc1 744029537 VABRFLYKHRGYRB-INIZCTEOSA-N 392.842 5.124 30 20 GKED N#CC1(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)CCCC1 746164229 UKIYIRYUQRRCQY-UHFFFAOYSA-N 382.872 5.606 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Cc2csc3ccc(Cl)cc23)c1 751968943 QLXISFDTEOSWNL-QGZVFWFLSA-N 398.915 5.095 30 20 GKED N#Cc1cccc(COc2cccc(C=NOc3ccccc3C(F)(F)F)c2)c1 754712268 IXAZNXJXIIGIJX-UHFFFAOYSA-N 396.368 5.569 30 20 GKED C#CC[C@H](NC(=O)N[C@H](C)c1sc(-c2ccccc2)nc1C)c1ccccc1 757017513 ZFHBFUSLKRNMNU-XLIONFOSSA-N 389.524 5.243 30 20 GKED CC(C)c1ncc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)s1 758368153 UJVNSYFWTBHSJH-UHFFFAOYSA-N 398.344 5.003 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/SCc3ccco3)n2)cc1 759833613 JEYJANDSVQTKQL-VMSUTVGLSA-N 380.494 5.335 30 20 GKED CCC(CC)[C@H](NC(=O)Nc1ccc(F)cc1OCC#N)c1cccs1 761665769 VFTSDKIOMLQJFJ-SFHVURJKSA-N 375.469 5.089 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@H]1/C=C/c1ccccc1 761674447 TUENAMKXVZFSGF-XETPZZHUSA-N 393.462 5.218 30 20 GKED C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 765907459 JDXRKUJAHSGSJE-UUOWRZLLSA-N 399.494 5.143 30 20 GKED O=C1/C(=C/c2cccc(-c3cccnc3)c2)CCc2ncc(C(F)(F)F)cc21 777470606 UPJYPDJDTLYZQT-MHWRWJLKSA-N 380.369 5.375 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 780679009 ZXIVVISNTIJSGJ-GCJKJVERSA-N 391.515 5.860 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)NCC(C)(C)C#N)cc3C2)cc1 781896941 ASSJNDWBFZYHBY-UHFFFAOYSA-N 376.504 5.001 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=S)Nc1cccc(OC(F)(F)F)c1 783726140 BUJLAUYAEOKLLU-UHFFFAOYSA-N 393.434 5.066 30 20 GKED C=CCOc1ccc(/C=C(\C(=O)c2cccc(OC)c2)c2ncc[nH]2)cc1Cl 787169101 MAMLPNSJOBVCIV-LDADJPATSA-N 394.858 5.060 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OCc2cccnc2)cc1 791810028 QFFQVFZHOFTTNL-UHFFFAOYSA-N 387.483 5.271 30 20 GKED N#CCc1ccc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)cc1 796468480 DPAXCRXMPZIGJC-SFHVURJKSA-N 392.717 5.435 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(C)Cc2ccc3ccccc3c2)c1=S 798178645 PXZXUTFRCXJEBD-UHFFFAOYSA-N 390.512 5.103 30 20 GKED C#C[C@H](N[C@@H](C)CC(=O)Nc1ccccc1C(F)(F)F)c1ccc(Cl)cc1 811516580 QCMAQASBAXXJMQ-GUYCJALGSA-N 394.824 5.040 30 20 GKED CC(/C=C\C(=O)c1ccc2c(c1)CCC(=O)N2C)=C/c1ccccc1OC(F)F 811692699 GYNIZRPBKVVHSB-KFMOSWKXSA-N 397.421 5.039 30 20 GKED C#C[C@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccc(Cl)cc1 811963617 QTNAVDRKQSRQQZ-IBGZPJMESA-N 384.888 5.081 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1 839645850 JIQGICBBKYBRPP-NLWGTHIKSA-N 384.401 5.044 30 20 GKED N#C[C@@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc(C2CC2)cs1 842941237 OUUJZMJKMBAIRO-NSHDSACASA-N 385.341 5.588 30 20 GKED Cc1nc(-c2ccccc2NC(=O)C2(c3ccc(C#N)cc3)CCCC2)cs1 861462599 WHXQORGTSNMMDJ-UHFFFAOYSA-N 387.508 5.441 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)/C=C\c1ccccc1C#N)C1CC1 914482163 LZRADYNXIYKFIY-HMVFGEFZSA-N 384.401 5.342 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)cc2)cc1 915085704 DVIUMQDKGBTEIJ-FQEVSTJZSA-N 380.369 5.613 30 20 GKED COc1cc(/C=C/C(=O)c2sccc2Br)ccc1OC(F)F 915113041 MICJWXQGCPTHQP-DUXPYHPUSA-N 389.217 5.017 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2csc(-c3ccccc3)n2)cc1 915114360 LBDQGPDPWDRDNM-SEYXRHQNSA-N 391.496 5.236 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2oc3ccc(F)cc3c2C)cc1 916954622 JMAGGFOXQXPMDS-YJYMSZOUSA-N 392.430 5.355 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(Cl)cc1Cl)c1nc2cc(Cl)ccc2s1 917043676 MGKWVLORTHEWNE-LBPRGKRZSA-N 395.698 5.675 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(Cl)cc1 917430842 VIVBGMQMNWJHQY-AWEZNQCLSA-N 389.307 5.757 30 20 GKED Fc1ccc(C=Nn2c(S)nnc2-c2ccccc2F)cc1-c1cccs1 917538784 SWIUKLVSUNJICW-UHFFFAOYSA-N 398.463 5.123 30 20 GKED COc1cccc(/C=C\C(=O)c2cnn(-c3ccc(F)cc3)c2C)c1OC(C)C 920992018 YQLLPBNTNIMHOT-JYRVWZFOSA-N 394.446 5.012 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3c(Cl)cccc3Cl)s2)cc1 1776048988 SFXPNRYFQTUXFC-UHFFFAOYSA-N 391.279 5.866 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1)C(=O)O 1776469779 JZAPTIORBUIVIP-VKJYCEFSSA-N 398.764 5.107 30 20 GKED C[C@H]1/C(=C/c2cc(C(=O)O)c(Cl)s2)C(=O)c2cccc(Br)c21 1776586651 JTICKSAYNNFUFQ-ZHNVUNHESA-N 397.677 5.246 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)oc2ccc(Cl)cc12 18118306 MGVXPTOBIGQANQ-UHFFFAOYSA-N 393.855 5.642 30 20 GKED Cc1ccc[n+](/C(C(=O)c2cc(C)c(C)cc2C)=C(/S)Nc2ccccc2)c1 28776745 MUGUTEXSAXROGH-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#CCOc1cccc(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)c1 46047550 QFJOMIVXNLMAEM-UHFFFAOYSA-N 398.418 5.166 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N[C@@H](C)c1ccc(Cl)cc1 66861307 UEORUROEWRKRHQ-GJZGRUSLSA-N 387.936 5.024 30 20 GKED CCOc1ccc2cc(C(=O)Nc3ccccc3SC[C@H](C)C#N)[nH]c2c1 108324045 MVQCFZHYPBMTOS-CQSZACIVSA-N 379.485 5.071 30 20 GKED Cc1cccc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1Br 119574043 IUFSNCKBSNDSAZ-LBPRGKRZSA-N 389.318 5.262 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C)[C@H](C)CC#N)cc2Cl)n1 120322274 AHCMWHMEBREZTC-LLVKDONJSA-N 380.926 5.022 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cccc(OCc3cccc(Cl)c3)c2)n1 147471057 FKGMIFLZWDMXGF-SFHVURJKSA-N 382.872 5.174 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 165037386 RVPDPPUKRSSXID-QFIPXVFZSA-N 398.466 5.423 30 20 GKED CC[C@](C)(NC(=O)Nc1ccccc1SC[C@H](C)C#N)c1nc(C)cs1 173116839 NLKNFZQMZBUWLQ-YJYMSZOUSA-N 388.562 5.150 30 20 GKED N#CCSc1cccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 177272484 QHZBGIRVSQITNG-OAQYLSRUSA-N 375.497 5.151 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)n1 177773005 PVADGIJYZWFSQW-MRXNPFEDSA-N 399.516 5.032 30 20 GKED C[C@@H](Cc1ccccc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 179224440 MTHJLHSKUQCYMC-JSGCOSHPSA-N 387.817 5.140 30 20 GKED Cc1c(Cl)cccc1-n1c(SCCCCC#N)nc2ccccc2c1=O 195552168 BATVZGWFSMKUIG-UHFFFAOYSA-N 383.904 5.134 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C\c3ccc(OC(C)C)cc3)cc2c1C 206968659 HUIVTQSBWGXILY-YFHOEESVSA-N 395.480 5.075 30 20 GKED COc1ccc(CCCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 261449487 PWYUNSDFBAXMLS-QGZVFWFLSA-N 382.529 5.298 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(c2nc(C(F)(F)F)ccc2C#N)CC1 301248730 BNVZHRYWQOATTE-UHFFFAOYSA-N 384.405 5.146 30 20 GKED Cc1ccc(-c2noc([C@H](C)Sc3nc4c(cc3C#N)CCCC4)n2)cc1F 302931793 FTXIDTQLEMRCRI-ZDUSSCGKSA-N 394.475 5.183 30 20 GKED O/C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)=N/C1c2ccccc2Oc2ccccc21 328677888 AUZDRXDVGRZLMJ-IMWZJCIKSA-N 389.495 5.560 30 20 GKED O/C(=N/CC1(c2ccc(Cl)cc2)CCCC1)c1coc(C2CCOCC2)n1 328837909 YBSYQDZCJXICLY-UHFFFAOYSA-N 388.895 5.039 30 20 GKED CC(C)(C)c1ccccc1N=C(O)N[C@H]1CCCc2cn(C3CCCC3)nc21 329252838 CBQAMIRWRPCYQH-FQEVSTJZSA-N 380.536 5.508 30 20 GKED Cc1ccc(N=C(O)C2CCN(Cc3csc(C4CCCC4)n3)CC2)nc1 329299148 USCAQKVFWCPHAS-UHFFFAOYSA-N 384.549 5.004 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc(-c2ccccc2)nc2c1cnn2C(C)C 432837958 YGFFDUIYRBXPIE-UHFFFAOYSA-N 395.466 5.112 30 20 GKED C=CCCCCNC(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433678746 HGJHTJFQLATXNN-UHFFFAOYSA-N 381.263 5.054 30 20 GKED O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)c1ccccc1C(F)(F)F 436460882 PQNWRASIJGFRCL-CYBMUJFWSA-N 399.693 5.531 30 20 GKED N#CCCC[C@@H](NC(=O)NCC1(Sc2ccccc2)CC1)c1ccccc1 458363899 JZBJFUQRHYWBSG-HXUWFJFHSA-N 379.529 5.046 30 20 GKED Fc1ccc(CN2CC[C@@H](C(F)(F)F)C3(CCOCC3)C2)cc1C(F)(F)F 459645435 GPUIMVFJYFLEGL-OAHLLOKOSA-N 399.350 5.026 30 20 GKED CC(C)=CCOc1cccc(C(=O)N[C@@H](C#N)c2cccc(C(F)(F)F)c2)c1 461105600 YPDFHWUGEDYFNB-IBGZPJMESA-N 388.389 5.045 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)Cc2nc3ccc(F)cc3o2)cc1 466816433 NYVWLLMEZOYWPB-UHFFFAOYSA-N 389.405 5.180 30 20 GKED C=C[C@@](C)(CCOC)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 473953985 WPVOYYISRSAUAL-XCLFUZPHSA-N 392.952 5.178 30 20 GKED N#Cc1c(NC(=O)Cc2cnc3ccccc3c2)sc2c1CCCCCC2 475255622 KKYNJMVHHWGEPN-UHFFFAOYSA-N 375.497 5.008 30 20 GKED Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)C[C@@H](CC#N)c1ccccc1 475597978 BBAPMBSFKVZJGB-FYYLOGMGSA-N 398.510 5.143 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1nc(-c2ccccc2Cl)cs1 478348708 VUMWMGAEWSXKIV-AWEZNQCLSA-N 399.972 6.470 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(NC(C)=O)cc1Cl)c1ccc(F)c(F)c1 480623570 IBMOBKNSGFPQSD-SFHVURJKSA-N 393.821 5.016 30 20 GKED CC[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 480637848 RWKDOPTVNRGMTE-BEFAXECRSA-N 379.460 5.011 30 20 GKED CC[C@](C)(NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nccs1 480842005 JPBIAQGDLNIDFF-NRFANRHFSA-N 393.537 5.221 30 20 GKED C=C(C)[C@@H](NCc1nn(-c2ccccc2)c2c1CCC2)c1ccc(F)c(F)c1 481597781 UAHIKPLJIPPZFO-HSZRJFAPSA-N 379.454 5.046 30 20 GKED N#Cc1c(NC(=O)c2cc(C3CC3)nc3ccccc23)sc2c1CCCCC2 481689050 TXDRLMNJTIRFNM-UHFFFAOYSA-N 387.508 5.567 30 20 GKED C=CCSc1ccccc1C(=O)NCc1sc(-c2ccccc2)nc1C 485467271 MRSCGFNGGXUJGE-UHFFFAOYSA-N 380.538 5.327 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2ccncc2)c1C(F)F 485704821 ZBEFWZMFSNAMFL-UHFFFAOYSA-N 396.441 5.309 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(COC(C)(C)CC)c1C 493984582 SUKXWMLTTADRPJ-UHFFFAOYSA-N 384.520 5.556 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC(CC(F)(F)F)CC1 497327421 MOARVDKKCUWDKB-ZDUSSCGKSA-N 385.455 5.135 30 20 GKED C=CCc1cc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)cc(OC)c1O 500107590 DGOJDSITMFZJMO-OAQYLSRUSA-N 399.943 5.723 30 20 GKED Cc1ccc(CN(C(=O)c2ccc(COc3ccccc3C#N)o2)C(C)C)s1 500904674 WPDDZAONXCHDPT-UHFFFAOYSA-N 394.496 5.151 30 20 GKED CCCOc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1Cl 502638867 ZFOMEVJKGUPHAH-UHFFFAOYSA-N 387.867 5.455 30 20 GKED CCC[C@@H]1C[C@@H](C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 504077472 SFHZUYDBSYYTCT-FBBABVLZSA-N 396.918 5.529 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2ccccc2OCC(F)(F)F)CC1 507652656 JOEMITFNSQYWIL-UHFFFAOYSA-N 388.433 5.121 30 20 GKED O=C(CC(F)(F)F)Nc1ccc(NCc2ccc(F)cc2C(F)(F)F)cc1 509943416 LMJUGHFBOYXJBK-UHFFFAOYSA-N 394.290 5.348 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](CC)c2ccccc2OC(F)F)c1 510735091 MDKVDUXIWRQPQK-QGZVFWFLSA-N 376.403 5.126 30 20 GKED CCc1c(C)sc(NC(=O)CCc2nc3cc(Cl)ccc3s2)c1C#N 516157828 DOPZESQALGUYIH-UHFFFAOYSA-N 389.933 5.325 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3SCCC#N)s2)o1 518120363 YMEWAZVUABQGBE-UHFFFAOYSA-N 383.498 5.278 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 518685110 ZVZVGUXJSNLWRM-CABCVRRESA-N 387.936 5.817 30 20 GKED COc1ccc(S[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 520824880 GFIUJFFRCMEAPA-GJZGRUSLSA-N 386.542 5.066 30 20 GKED N#Cc1ccc(/C=C/c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1 521049449 DCVVHGWXNJEHTK-VZUCSPMQSA-N 384.370 5.105 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 523615317 AZDUURTVNQUOSY-QGZVFWFLSA-N 383.879 5.020 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CC2CCC(=O)CC2)cc1Cl 530558167 BPICBBDRRIZXLC-FQEVSTJZSA-N 380.875 5.083 30 20 GKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 536818485 XLEVQPOHFXIWTF-YJBOKZPZSA-N 379.460 5.154 30 20 GKED C[C@H](CC(=O)Nc1cccc(C(F)(F)F)c1)N[C@H](CCC#N)c1ccccc1 536838882 LPPGVONVUNDXJO-DNVCBOLYSA-N 389.421 5.057 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(CC#N)CC1)c1ccc(C(F)(F)F)cc1 541018682 OVXYMJQFSMFVMD-GOSISDBHSA-N 379.426 5.048 30 20 GKED C[C@@H](C1CCCCC1)[C@@H](C)NCC(=O)Nc1ccccc1S[C@H](C)CC#N 542533696 XGLVMVKCBSAGHM-KZNAEPCWSA-N 387.593 5.214 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)N[C@H](CCC#N)c1ccccc1 544280542 KYTJJMXXUAXZEB-GOSISDBHSA-N 376.485 5.285 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1oc2ccccc2c1COc1ccccc1 546710563 NXLZVRBBPHGSFS-UHFFFAOYSA-N 398.418 5.144 30 20 GKED C[C@H]1CCC[C@@](C#N)(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)C1 558121987 IQWDYVXDNCXXRA-OYHNWAKOSA-N 393.874 5.206 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1(C)C 558511029 GEMYDFFYJDEQSP-GOSISDBHSA-N 391.515 5.232 30 20 GKED Cc1cc(C)c(NC(=O)CNc2c(C#N)cnc3c(Cl)cc(C)cc23)c(C)c1 558755156 LJLMYBMLYZFZMY-UHFFFAOYSA-N 392.890 5.044 30 20 GKED Cc1ccc(-c2cncc(F)c2)cc1NC(=O)N[C@@H](CCC#N)c1ccccc1 558850208 ACNNKBKOWHQNSN-NRFANRHFSA-N 388.446 5.363 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1c[nH]c2ccccc12 562190862 ZLDZTOIACWGCBF-MRXNPFEDSA-N 396.450 5.359 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2ccccc2SCc2cccs2)cc1 565799701 RLGVXYKTCHCGIS-FQEVSTJZSA-N 392.549 5.597 30 20 GKED N#Cc1cc2c(nc1S[C@@H](C(=O)Nc1ccccc1)c1ccccc1)CCCC2 585688860 UPJAMWCQQNUFFW-JOCHJYFZSA-N 399.519 5.304 30 20 GKED COc1ccc([C@H](Cc2ccccc2)NCc2ccc(C#N)c(Cl)c2)cc1 589344253 VRZOWYYSMINPAJ-QHCPKHFHSA-N 376.887 5.294 30 20 GKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 589572307 NKEQHKNHCPXUQT-MRXNPFEDSA-N 382.423 5.574 30 20 GKED COc1cccc(CN(CC(C)C)C(=O)N[C@@H](CCCC#N)c2ccccc2)c1 590942410 YUFLKGITTUICBO-QHCPKHFHSA-N 393.531 5.298 30 20 GKED N#CC[C@H]1CCCN(C(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 596534727 QLHQEFJIHMDMBX-SJKOYZFVSA-N 399.844 5.145 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)Cc3csc4ccccc34)cn2)cc1 603764769 LWAOGKMNWUJPSG-UHFFFAOYSA-N 385.448 5.141 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)o1 603944802 AWRMXTAPYKMYJQ-UHFFFAOYSA-N 386.329 5.001 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(C(F)(F)F)CC2)cc1Cl 608786288 GXPIFGQAHNZFFS-OAHLLOKOSA-N 378.781 5.276 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N[C@@H](C)c1ccc(C#N)cc1 609080343 HLGOWDOSGJTOAS-OALUTQOASA-N 399.494 5.889 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC[C@@H]2c2cccs2)cc1 609296461 SAEFGFFFPILFSB-LJQANCHMSA-N 392.455 5.528 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(-c2cccc(Cl)c2)no1 609427529 HJIUXANKYSRLJY-CYBMUJFWSA-N 397.887 5.642 30 20 GKED N#Cc1ccccc1OCC(=O)Nc1cccc(CSCc2ccccc2)c1 609697394 VATJGJTZNASRMQ-UHFFFAOYSA-N 388.492 5.009 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H](C)c1ccccc1C(F)(F)F 610227851 NJOLCQNAVPLKAY-ZIAGYGMSSA-N 392.446 5.699 30 20 GKED C[C@H](NC(=O)N[C@@H](C)c1cc(F)c(Cl)cc1Cl)c1cccc(C#N)c1 610345425 JHGBSOHZGGXMOM-QWRGUYRKSA-N 380.250 5.126 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cccc(C#N)c1 610357947 WOGSWVJFNXFBBX-VLIAUNLRSA-N 395.915 5.423 30 20 GKED CC(C)(C#N)c1ccccc1CN1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 610859218 REGGRGFBTYTQHJ-ZIAGYGMSSA-N 378.360 5.050 30 20 GKED C=CCOc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 613319694 LIEBOHOMFFBBEE-SFHVURJKSA-N 394.883 5.518 30 20 GKED CCCc1sc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1CC 613401585 GAAKIRMGDVIXKA-ZDUSSCGKSA-N 387.455 5.498 30 20 GKED C=CCN(C(=O)c1cc(C2CC2)nc2c1c(C)nn2C(C)(C)C)c1ccccc1 643139978 IHIGWFCJXKARMA-UHFFFAOYSA-N 388.515 5.205 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C(F)(F)F)s3)n2)cc1 671751173 VTPMUYGASLEMPN-GFCCVEGCSA-N 392.427 5.689 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(SC(C)(C)C)cc2C)cc1OC 725758551 BFMJFKZODBHGSF-UHFFFAOYSA-N 385.529 5.711 30 20 GKED CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1 726488422 VBPDGXADYMBDQD-PXNSSMCTSA-N 399.947 5.008 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 727223710 MXTCMYIFIPZJAC-UHFFFAOYSA-N 395.572 6.200 30 20 GKED C#CC[C@@H](OC(=O)[C@H](C)Sc1cc(Cl)ccc1Cl)c1ccccn1 727776070 RHYKOVZJJNQRGI-BLLLJJGKSA-N 380.296 5.177 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Sc3ccc(OC)cc3)cc2)c1 728175140 JVYCUJUQUFTENL-UHFFFAOYSA-N 390.533 5.637 30 20 GKED C#Cc1cccc(N(C(=O)c2cc(-c3ccccc3)nc3onc(C)c23)C(C)C)c1 728247041 PYZGOLPCCWGDOU-UHFFFAOYSA-N 395.462 5.235 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCCCN3CCCC3)cc2Cl)cc1 729330377 PCDWWONJFPJPLP-UHFFFAOYSA-N 397.906 5.209 30 20 GKED CCc1oc2ccccc2c1C=Nn1c(S)nnc1-c1ccccc1Cl 730547352 RJJUDNAJRDFMQP-UHFFFAOYSA-N 382.876 5.078 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1ccccc1SC[C@@H](C)C#N 730989125 HNBBKBJLINWMFO-QUQQQVAWSA-N 394.540 5.768 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=S)Nc2ccc(Cl)c(Cl)c2)c1 733755511 TVAURLTWTWCRNY-CQSZACIVSA-N 394.327 5.161 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](CC)c2ccc(Cl)s2)c1 734013118 MJNHTJPLRRGOCO-GDBMZVCRSA-N 391.924 5.033 30 20 GKED Cc1c(C(=O)/C=C\c2cnc3ccc(Cl)cn23)cnn1-c1cccc(Cl)c1 737443970 MVZDORPUOCHAAD-SREVYHEPSA-N 397.265 5.031 30 20 GKED N#C[C@@H](C(=O)[C@H]1Cc2ccccc21)c1nc(-c2ccc(Cl)cc2Cl)cs1 744035136 KMLVVPNRIRLCAU-HOTGVXAUSA-N 399.302 5.633 30 20 GKED C=CCc1cc(CNC(=S)Nc2cccc(C(C)C)c2)cc(OC)c1OC 747623569 NCPCHAKNHMMHDS-UHFFFAOYSA-N 384.545 5.042 30 20 GKED C/C(=C\C(=O)Nc1nc(C)c(SCC#N)s1)c1ccc(C(F)(F)F)cc1 748181473 OJCJRJDKORXEPG-MDZDMXLPSA-N 397.447 5.128 30 20 GKED CC1CCN(c2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cc2)CC1 754425191 HEDFFVFSBGZJSO-UHFFFAOYSA-N 388.298 5.354 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C\c3ccc(Cl)nc3)c2)cc1 759020971 QQVRPJYIQAYUDV-XFFZJAGNSA-N 375.815 5.051 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1nc2ccccc2s1 759184179 QXTLVUBIPJJJRZ-ZBTGYSDGSA-N 389.867 5.388 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)c(Cl)c2F)cc1 760519382 KRYGWJLYCZYNKF-KRWDZBQOSA-N 382.797 5.526 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cnc(C)s1 761255821 RBNPASFFFCRNJV-UHFFFAOYSA-N 383.477 5.098 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCO1 763931914 RULUYTOGQWFPNE-VSKRKVRLSA-N 391.515 5.057 30 20 GKED Cc1oc2ccccc2c1CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 767072031 KVWWRBRIHOPHAB-HSZRJFAPSA-N 380.447 5.578 30 20 GKED CC1(C)OCc2cc(CNCc3cccc(-c4ccc(C#N)s4)c3)ccc2O1 768692883 RUZBSTMLWRCNDP-UHFFFAOYSA-N 390.508 5.222 30 20 GKED CC(C)(C#N)c1ccccc1COC(=O)c1cn(CCCC#N)c2ccccc12 769544147 PQUBHVHCVVLUEZ-UHFFFAOYSA-N 385.467 5.103 30 20 GKED Nc1c(Cl)cc(C(=O)/C=C/c2ccc(Oc3cnccn3)cc2)cc1Cl 773159695 IZUYYUWJBSXIAT-ZZXKWVIFSA-N 386.238 5.054 30 20 GKED C=CCOc1cccnc1C(=O)O[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 775112660 MGFOJRFHIHYUFC-AWEZNQCLSA-N 398.846 5.181 30 20 GKED C[C@@H](NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)c1ccc(C#N)c(F)c1 776741160 CKLXWWNMPQKEHO-HZPDHXFCSA-N 397.494 5.134 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(OC)c(NC(=O)OC(C)(C)C)c1)c1ccccc1 777517646 VJKXQEMEZKTZRA-SFHVURJKSA-N 396.487 5.341 30 20 GKED CCc1noc(C2CCC(=NNc3nc4cc(Cl)ccc4cc3C)CC2)n1 778551908 ADDDXWBJPQTFPF-UHFFFAOYSA-N 383.883 5.268 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@@H]1c1ccc(Cl)cc1 780677640 GSBNBEJCWSJVAF-OXJNMPFZSA-N 397.906 5.780 30 20 GKED C[C@@H](NC(=O)/C=C/SCc1ccco1)c1ccc(-c2cccc(C#N)c2)cc1 782485251 FYYMKAZORMAZJX-MLFXKNMZSA-N 388.492 5.443 30 20 GKED N#CCOc1ccc(CC(=O)N[C@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)cc1 791234994 NHYBFALISNPAIR-YADHBBJMSA-N 396.918 5.018 30 20 GKED N#C[C@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1nccc2ccccc12 792095961 YREKVMHZAZSVQC-MDRMPYQZSA-N 382.463 5.446 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(NC(=O)OC(C)(C)C)ccc2C)cc1 793253495 CQBDEWKWTPIZQR-UHFFFAOYSA-N 393.487 5.211 30 20 GKED N#CC[C@H](CC(=O)N[C@H]1CCOc2c1ccc(Cl)c2Cl)c1ccccc1 793961761 FKHGXQLLYBGBTE-PBHICJAKSA-N 389.282 5.021 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)c1ccc2c(c1)COC2 794982445 WOIKFIUGEBVHJJ-UHFFFAOYSA-N 398.388 5.029 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797570813 KQRLTRNSGXVDSE-QWRGUYRKSA-N 397.327 5.391 30 20 GKED C=CC[C@H](NC(=O)N[C@H]1C[C@H](c2ccc(Cl)c(Cl)c2)C1)c1ccncc1 798414050 CONDGUYHPZFHNV-BXWFABGCSA-N 390.314 5.251 30 20 GKED CC(=NNc1cccc(C(F)(F)F)n1)c1sc(-c2ccccc2)nc1C 814853188 GPWHDGKPGQBPNU-UHFFFAOYSA-N 376.407 5.368 30 20 GKED O=C(Nc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1)c1cccs1 819839827 RPJLZBLYCJPTOR-UHFFFAOYSA-N 391.279 5.763 30 20 GKED Cc1cc(C)cc(-c2noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n2)c1 848606847 KPKKNVHCRRVZDY-KRWDZBQOSA-N 384.480 5.003 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1C=NNc1ccc(Br)cc1 912828154 SYNBXSCQNXXCLA-UHFFFAOYSA-N 389.684 5.043 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3Cc4ccccc4S3)n2)cc1 915099842 CYSHBBDUHHOHHT-APWZRJJASA-N 376.506 5.012 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915352319 GWTKNCTWXHQSRH-JWQCQUIFSA-N 395.506 6.020 30 20 GKED CCCCCCOc1ccc(C(=O)Nc2nc(C)c(SCC#N)s2)cc1 916089368 CNXOTUKTWRGSHJ-UHFFFAOYSA-N 389.546 5.279 30 20 GKED CCCCn1nc(C)c(C=NNc2ccnc3cc(Cl)ccc23)c1Cl 916269479 RGKMJKWDMCAYBX-UHFFFAOYSA-N 376.291 5.293 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)/C=C/c3cccc(F)c3)c2)cc1 916449586 HAVKYPXLKNNLLF-FMIVXFBMSA-N 386.426 5.123 30 20 GKED Cc1cc(C)c(/C=C/C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 920140497 DPWVESMUMZLSST-SHBDEGQCSA-N 397.503 5.497 30 20 GKED CCc1nc(SCCC(C#N)(c2ccccc2)c2ccccc2)nc(O)c1C 1166307554 JCLHKQXCXMBVIV-UHFFFAOYSA-N 389.524 5.045 30 20 GKED O=C(O)c1cc(Cl)sc1C=NN(Cc1ccccc1)Cc1ccccc1 1776023149 MYKQBOIGVIHNIM-UHFFFAOYSA-N 384.888 5.136 30 20 GKED C=CCCC[C@@H](NCc1ccc(Cl)cc1Oc1ccc(C)cc1C)C(=O)O 1776171147 VYPZNPURJLGZMU-LJQANCHMSA-N 387.907 5.648 30 20 GKED Cc1ccc(C(=O)Nc2ccc(C#N)c(Cl)c2)cc1NC(=O)c1ccccc1 20630608 DLCFTGQLYUWPHK-UHFFFAOYSA-N 389.842 5.025 30 20 GKED Cc1ccc(-c2ccsc2C(=O)[C@@H](C#N)c2ccc(C(F)(F)F)cn2)cc1 48828943 VTNWTBGMTNUPQN-INIZCTEOSA-N 386.398 5.627 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NCCC2=CCCCC2)cc1 71944539 NODKPDADVGHLKB-UHFFFAOYSA-N 389.499 5.344 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 78668934 MYHITVHQZPYZRC-JKSUJKDBSA-N 390.430 5.453 30 20 GKED C=C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccccc2)CC3)CC1 111195053 PAVIXERAFDBUHK-JZJYNLBNSA-N 380.491 5.514 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1nc(-c2ccncc2)cs1 114619854 FONHLRSIEDFWFE-IBGZPJMESA-N 399.475 5.274 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NCc1ccc(O[C@H](C)C#N)cc1 124716760 VAEJCJJMERCFBG-GCJKJVERSA-N 376.525 5.421 30 20 GKED Cc1cc(-c2noc(CNc3ccccc3SC[C@@H](C)C#N)n2)ccc1F 157818017 KWLXWQDFFRJRHO-ZDUSSCGKSA-N 382.464 5.048 30 20 GKED N#CCCCCNC(=O)c1sc2cccc(F)c2c1COc1ccccc1 171503328 BLESDCWZXJRSAA-UHFFFAOYSA-N 382.460 5.043 30 20 GKED C[C@@H](c1ccc(Cl)cc1)N(CC(=O)Nc1ccccc1SCC#N)C1CC1 173236163 WTAGVFMLSFNTTN-HNNXBMFYSA-N 399.947 5.120 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Br)c(Cl)c2Cl)c1 183635560 PAWJIBHCDFVSGV-UHFFFAOYSA-N 384.060 5.074 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(C)c(NC(=O)c2ccncc2)c1)c1ccccc1 187220059 DRAJAXGORKLWDW-JOCHJYFZSA-N 399.494 5.331 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(Cl)c2c(c1)OCCO2 189887397 UBFCEOIMEKDKTC-UHFFFAOYSA-N 385.891 5.144 30 20 GKED C[C@@H]1C/C(=C\c2ccccc2)c2nc3ccccc3c(C(=O)N(C)CCC#N)c2C1 212459683 PACOASVYJBTAEX-GMQRBVGNSA-N 395.506 5.343 30 20 GKED COc1ccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2ccc(F)cc2)cc1 237273730 DZULLNZCZCZIHK-XDHUDOTRSA-N 390.458 5.004 30 20 GKED CCOc1cc(/C=C/C(=O)c2cc(Cl)c(OC)cc2OC)cc(Cl)c1O 301578300 CVXJENOEONXXFC-AATRIKPKSA-N 397.254 5.011 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1CC1CCCCC1 303370425 JWCPZGYFUNFPLW-HKUYNNGSSA-N 385.577 5.905 30 20 GKED C=CC[C@H]1N(C(=O)Nc2cccc(-c3noc(C4CC4)n3)c2)CCCC1(C)C 434086034 YQAOQSLLGRVEEN-GOSISDBHSA-N 380.492 5.213 30 20 GKED CC(C)c1ccc(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 438945530 USHBGPBPRFLPKZ-UHFFFAOYSA-N 395.503 5.043 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1cccc(OCCCC#N)c1 444012566 VUPJNCDMEPPKFQ-FQEVSTJZSA-N 376.422 5.461 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)cc1 445232233 AGUBAWHNUVGPFN-HXUWFJFHSA-N 397.906 5.015 30 20 GKED C=CCN(C(=O)c1ccc2nc(C)ccc2c1)c1nc(-c2ccccc2)cs1 448168310 FZDYCXVPAJBKKI-UHFFFAOYSA-N 385.492 5.500 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@H]2CC[C@@H](CC#N)C2)c(C(F)(F)F)c1 454641346 CAZXGJRLONFYOZ-RDBSUJKOSA-N 399.482 5.800 30 20 GKED CCN(C(=O)CCCOc1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 461531459 HMDCHIJURBLLBB-UHFFFAOYSA-N 377.271 5.077 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)cc1F 464653895 YEBUIWLXXIQEMJ-UHFFFAOYSA-N 383.382 5.272 30 20 GKED CSc1ccccc1C[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469321092 HBFWESWHZBAPPD-KRWDZBQOSA-N 393.556 5.035 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2cccc(C(F)(F)F)c2C)c1C#N 472801487 GQIYZKJEQKTNIK-UHFFFAOYSA-N 391.418 5.132 30 20 GKED C=C[C@@](C)(CC)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 473558080 XSZIKSBZHFPOOG-DEOSSOPVSA-N 391.515 5.126 30 20 GKED Cc1c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)cccc1C(F)(F)F 473829291 LAROLHQWSSIOSH-LPHOPBHVSA-N 387.405 5.318 30 20 GKED C[C@@H]1CCCCN1Cc1ccc(NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 474898356 GYHQJFPTBQWPJU-DENIHFKCSA-N 375.516 5.087 30 20 GKED CC(C)(CNC(=O)C[C@@H](CC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 475532334 ZDYSTSRPJSLUOV-QGZVFWFLSA-N 388.433 5.187 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ccc(C)nc2)CC1 475576866 YSZVZFZOCISZHN-UHFFFAOYSA-N 377.532 5.653 30 20 GKED CCN(C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl)[C@@H](C)c1ccc(C#N)cc1 480045954 RZWAOFYJUYGRPX-UONOGXRCSA-N 391.298 5.242 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](CC)c1ccccc1OC 482078248 QDCAHAWTPPIJQT-NRFANRHFSA-N 380.532 6.162 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(-c2ccc(Cl)s2)nn1C 490485874 OOODLVAYEBZPJI-UHFFFAOYSA-N 392.937 5.084 30 20 GKED CC(C)c1ccc([C@@H]2CCCCN2Cc2nnc(-c3ccc(C#N)cc3)o2)cc1 490610386 WPOINTSUEVZLTC-QFIPXVFZSA-N 386.499 5.459 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@H]2C[C@H]2C)o1 499710987 PUGHMIUDYBNKMU-SYAUCNOPSA-N 375.921 5.436 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CCOCC1 505044845 FJXGTWSJCPBXTA-UHFFFAOYSA-N 382.479 5.157 30 20 GKED C=CCN(Cc1cccc(NC(=O)c2ccccc2Cl)c1)CC(F)(F)F 511927460 OOXVTNQSRHTPBH-UHFFFAOYSA-N 382.813 5.143 30 20 GKED CC(C)c1nn(C)cc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 512191945 BUNFHDYVKDURBG-SFHVURJKSA-N 392.890 5.105 30 20 GKED C=CC[C@H](C)NC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 512744978 ULVNZEPKNJIIQA-NSHDSACASA-N 383.344 5.475 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1C[C@H](C)C[C@H]1c1ccccc1 513235297 AKXYQMFEUOTLPM-LQWHRVPQSA-N 393.556 5.102 30 20 GKED CC[C@H]1C[C@H](CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 514121125 RZDPXGOXGABJET-IRLDBZIGSA-N 394.490 5.134 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H]1CCCc2ccccc21 518127708 IGPAOLJGEXQZOU-OXQOHEQNSA-N 396.581 5.830 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)n1C1CCCCC1 518662310 BKOILBCNBXAJLR-MRXNPFEDSA-N 395.572 6.114 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1ccc(-c2ccncc2)cc1 525354306 GEQMQCDMIHUIEF-UHFFFAOYSA-N 397.931 5.361 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2cccs2)cc1 526980337 XMQPCXCNCIQSSM-HXUWFJFHSA-N 378.472 5.208 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H](C)c2sc(C(C)C)nc2C)c1 535217150 ZYXFVJDAIICFMS-INIZCTEOSA-N 387.549 5.755 30 20 GKED C=CCC[C@H](NC(=O)Nc1c(C)noc1CC)c1ccc(C(F)(F)F)cc1 536289924 HILSOVFWXBWZRS-HNNXBMFYSA-N 381.398 5.393 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCCOc3c(Cl)cccc32)cc1 537237154 PSEGJNDQZJMKMK-SFHVURJKSA-N 383.879 5.177 30 20 GKED CC(C)c1ccc([C@H](NCCCC2(C#N)CCOCC2)c2cccs2)cc1 537508173 AWPMXTQKCCNKKY-QFIPXVFZSA-N 382.573 5.651 30 20 GKED N#C[C@H](C(=O)c1ccc(OC2CCCC2)nc1)c1nc(-c2ccccc2)cs1 541017895 ATMHQPFRNRFVKQ-GOSISDBHSA-N 389.480 5.017 30 20 GKED Cc1cc([C@@H](NCCSCc2ccccc2C#N)c2cccnc2)ccc1F 543401807 SJULPTRAXWAFDS-HSZRJFAPSA-N 391.515 5.013 30 20 GKED C=CCOc1ccc(CN[C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1Cl 543642429 PMTXFJUJRXZJQF-WIYYLYMNSA-N 375.871 5.054 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC1(c2cccc(C#N)c2)CC1 556607911 INKJEHKIXKVAPW-HNNXBMFYSA-N 377.488 5.469 30 20 GKED C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 562168814 LLGSDXUJFZPYII-OPYAIIAOSA-N 393.556 6.086 30 20 GKED N#CCCC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccccc1 564718786 OBYCNZVOTGULHS-HXUWFJFHSA-N 375.428 5.380 30 20 GKED C=C(C)CN(Cc1cccc(OCc2ccccn2)c1)Cc1cnn(C(C)C)c1 567174765 HWRAWUDMRITOKI-UHFFFAOYSA-N 390.531 5.016 30 20 GKED CC(C)c1ccoc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 567480372 KMLYZKQLGHYBCH-IBGZPJMESA-N 378.859 5.964 30 20 GKED COc1cc2ccccc2cc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 592974240 QFBQLDDWYSNOQX-MRXNPFEDSA-N 376.412 5.087 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H](c3ccccc3)C3CC3)cn2)cc1 603690618 NFQROYVDUBOKDB-JOCHJYFZSA-N 384.439 5.018 30 20 GKED CN(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)[C@H]1CCCc2ccccc21 603693041 UCQAMKRAXVLTBY-QFIPXVFZSA-N 398.466 5.287 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)CNc1ccc(C#N)cc1 609073836 CHGDOUJPHFVDHK-GOSISDBHSA-N 385.467 5.057 30 20 GKED N#C[C@H](NC(=O)c1csc(-c2ccccc2)n1)c1cccc(Cl)c1Cl 609416394 NUOMXRFVGWGUSQ-AWEZNQCLSA-N 388.279 5.112 30 20 GKED N#CC1(NC(=O)c2ccc(CSc3cc(Cl)ccc3Cl)cc2)CC1 609990635 FCOZOCWUBDJNMM-UHFFFAOYSA-N 377.296 5.072 30 20 GKED C[C@H](N[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1cccc(C#N)c1 610344000 YDWPOFZQOROGSA-STQMWFEESA-N 386.377 5.039 30 20 GKED CC(F)(F)c1ccccc1NC(=O)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 653567014 VVNNTRWAYSNAHO-UWVGGRQHSA-N 390.274 5.003 30 20 GKED Clc1cccc(-c2cnc(CON=Cc3ccccc3Br)o2)c1 727470344 SAGNPJRCWYMVQN-UHFFFAOYSA-N 391.652 5.308 30 20 GKED Fc1ccccc1-c1nc2c(s1)C(=NNc1cnc3ccccc3n1)CCC2 731926396 AMNQRNKJHRNXFK-UHFFFAOYSA-N 389.459 5.045 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cccc(Oc3ccccc3)c2)c1 733772118 XVFYNVCPIBOTFY-FQEVSTJZSA-N 386.451 5.090 30 20 GKED Cc1ccsc1[C@H](Cc1ccccc1)NC(=S)Nc1ccccc1C#N 736446985 MTYFQVJIYVOVGZ-IBGZPJMESA-N 377.538 5.199 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2F)CC1)c1nc(-c2ccc(Cl)cc2)cs1 737322867 MNUFSHRXBROAQR-HNNXBMFYSA-N 396.874 5.511 30 20 GKED CCCCCCCCCCC(=O)N1Cc2ccccc2C[C@@H]1c1nnc(C)o1 737619614 YEFWNEXCVFMTFP-OAQYLSRUSA-N 383.536 5.535 30 20 GKED CCOc1cc(/C=C2\Cc3cc(Cl)ccc3C2=O)cc(Br)c1O 742437724 QGNDCNJVEYZLTN-LFYBBSHMSA-N 393.664 5.029 30 20 GKED COc1cc(C(C)=NNc2oc(C(C)(C)C)nc2C#N)ccc1SC(F)F 746498121 ITXBWVJCTQKJIU-UHFFFAOYSA-N 394.447 5.003 30 20 GKED C=CCc1cc(/C=C(/Cl)c2nc3cc(F)c(F)cc3[nH]2)cc(OC)c1O 747063407 JOUVQAHWYVLVBS-WUXMJOGZSA-N 376.790 5.021 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCSc2ccc(Cl)cc2)n1 747193067 DGLAPIHQFMUPNZ-HNNXBMFYSA-N 378.950 5.669 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CNCc1cc(C#N)ccc1F 754824827 RZIPOHCDAWWESK-UHFFFAOYSA-N 396.897 5.009 30 20 GKED COCc1nc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cs1 754856919 GAXXQTKPMLCNAH-UHFFFAOYSA-N 399.903 5.006 30 20 GKED CCC(=O)c1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)ccc1F 756982017 DUZQRTNLSSXKPC-UHFFFAOYSA-N 388.398 5.335 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)c1ccccc1OCC#N 764299617 TZPUDAOSIRWERN-UHFFFAOYSA-N 395.256 5.065 30 20 GKED COc1ccc(/C=C/C(=O)c2csc(Cl)c2)c(OCc2cccnc2)c1 766492437 XXDMSLXOLOVESY-FNORWQNLSA-N 385.872 5.280 30 20 GKED COc1cccc(-c2nc(/C=C3/CSc4c(F)cccc4C3=O)cs2)c1 767911456 LCOCGKLBAYKEDE-JYRVWZFOSA-N 383.469 5.330 30 20 GKED O=C(/C=C/c1nccc2ccccc12)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 771097860 KWVNRWXAJDYAMZ-YXBWYFRISA-N 391.442 5.218 30 20 GKED CC(C)C[C@@H]1C[C@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCO1 777566392 RWVDAFNXPPHIDO-DNVJHFABSA-N 391.515 5.057 30 20 GKED CCc1ncc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 779595816 OBGUFVQIXQHDHT-UHFFFAOYSA-N 383.904 5.422 30 20 GKED C#CCCCCCC(=O)Nc1cccc(CNC(=O)Nc2ccccc2Cl)c1 780601863 ZHBALYXTDLVOOQ-UHFFFAOYSA-N 397.906 5.184 30 20 GKED C=C(C)[C@@H](NC(=O)c1cc(C(F)(F)F)cnc1Cl)c1ccc(F)c(F)c1 791000891 SHPBRRUFBRKSIR-CQSZACIVSA-N 390.739 5.079 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1C 792484237 ZKCFNZNULVUBDQ-CQSZACIVSA-N 393.516 5.084 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2ccc(SC(C)C)cc2)cn1 792884792 RVCMKDKFCVGIQO-JYRVWZFOSA-N 390.508 5.549 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1)C(=O)c1ccc(Cl)cc1 797568019 NIOFGIBREYHAJS-WFASDCNBSA-N 388.920 5.179 30 20 GKED COc1ccccc1CON=Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 799117243 HIFVKKQBFKSJRO-UHFFFAOYSA-N 392.402 5.388 30 20 GKED N#Cc1sc(NCc2ccc(Br)cc2C(F)(F)F)nc1Cl 804585558 BXOKKCZTOVPYTG-UHFFFAOYSA-N 396.619 5.062 30 20 GKED Cc1csc(NC(=O)Cc2csc(-c3ccc(C(C)C)cc3)n2)c1C#N 809004664 VVTOAYKAFUACNB-UHFFFAOYSA-N 381.526 5.356 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(Cl)sc3[nH]2)cc1 810532327 CPDUTWLYLHHFRY-NHYWBVRUSA-N 399.903 5.357 30 20 GKED N#C[C@H](C(=O)CCCc1ccccc1Cl)c1nc(-c2ccccc2)cs1 810534467 SABNDGSUPWXESR-QGZVFWFLSA-N 380.900 5.663 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccnc(Cl)c3Cl)cc2)c1 811488367 VACCHOKRDJDETC-UHFFFAOYSA-N 384.266 5.451 30 20 GKED CO[C@@](C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 813060557 DGARTPBCSAASIP-FZKQIMNGSA-N 395.311 5.108 30 20 GKED COc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1OCc1cccnc1 848528682 NJOJLENLESHFFD-UHFFFAOYSA-N 387.483 5.082 30 20 GKED CC(C)(CC(F)(F)F)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 850762094 FLRLZQSXLZYCSN-LBPRGKRZSA-N 386.826 5.618 30 20 GKED O=[N+]([O-])c1cc(C=NOCc2ccc(Cl)c(Cl)c2)ccc1N1CCCC1 852302294 GTEKMZRTMHCOBQ-UHFFFAOYSA-N 394.258 5.053 30 20 GKED CC(C)(C#N)c1ccccc1CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F 853725025 JSOADXNRINDNOT-SANMLTNESA-N 384.398 5.174 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccco3)nc3ccccc23)sc2c1CCCC2 863967366 XTLHEURVHNGUSJ-UHFFFAOYSA-N 399.475 5.559 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(F)c(Cl)c2)cc1 915124463 KISVDQSKKDPRPI-SFHVURJKSA-N 395.890 5.943 30 20 GKED CCCCCCCCc1nnc(NC(=O)N2CCC[C@H]2c2ccncc2)s1 915312033 XUYRNFHKNKVAMG-KRWDZBQOSA-N 387.553 5.205 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nc2ccccc2[nH]1 915351386 AGVSTZHTCLYENJ-OXQOHEQNSA-N 395.466 5.101 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(-c2ccc(F)cc2)s1 916907540 BTWFZZGNVVASHN-AWEZNQCLSA-N 398.846 5.169 30 20 GKED CC(C)Cc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 916928637 PTHCONZLQWJLCN-MRXNPFEDSA-N 389.282 5.153 30 20 GKED CCc1oc2ccccc2c1C=NOCc1cccc(C(=O)N2CCCCC2)c1 917623070 JQOVTUGEHUUTBO-UHFFFAOYSA-N 390.483 5.172 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3ccccc3Cl)cs2)cc1 920062907 FLYLXPHDCQUPAD-WDZFZDKYSA-N 385.872 5.280 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccccc3Cl)n2)cc1 920138862 LGZOBGZKUQJKQM-YRYLYKBFSA-N 394.883 5.362 30 20 GKED O=C(/C=C\c1ccc2oc(C(=O)O)cc2c1)c1ccc(OCc2ccccc2)cc1 1776126946 BXVDPTXSMHKHAK-SDQBBNPISA-N 398.414 5.606 30 20 GKED C=CC[C@]1(C(=O)O)CCCN(c2ccnc3ccc(Oc4ccccc4)cc23)C1 1776156695 AYINZRYARJESEB-DEOSSOPVSA-N 388.467 5.274 30 20 GKED N#C[C@H](C(=O)c1ccc(COc2ccc(F)cc2)o1)c1nc2ccccc2s1 46442133 JBAINEXQXKPQFJ-MRXNPFEDSA-N 392.411 5.097 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1cc(C)cc(C)c1 60384036 PQUZUIDLXMJSGS-UHFFFAOYSA-N 383.492 5.091 30 20 GKED CCCn1ccc2cc(NC(=O)c3ccc(COc4ccccc4C#N)o3)ccc21 65316918 ZMLSZCIVMJDONW-UHFFFAOYSA-N 399.450 5.347 30 20 GKED Cc1ccc2oc(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)cc2c1 66544586 JHQACNNBRZHDIN-KRWDZBQOSA-N 383.432 5.226 30 20 GKED Cc1ccc2nc(C)c(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2c1 66801139 XIMITPASFALLAO-OAHLLOKOSA-N 375.497 5.498 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1 69609856 ACEMWPHMELGAAA-UHFFFAOYSA-N 385.901 5.309 30 20 GKED CC[C@H]1c2ccsc2CCN1CC(=O)Nc1ccccc1S[C@@H](C)CC#N 108359078 SJDJUGBYFUORLI-YJBOKZPZSA-N 399.585 5.090 30 20 GKED COc1cccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 108532614 YHCDTAXVGPIWPZ-UZLBHIALSA-N 395.528 5.316 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)cccc1-c1ccccn1 118969961 DPYRNVSQRGUQMQ-MRXNPFEDSA-N 387.508 5.561 30 20 GKED N#CC1CCN(C(=O)Cc2ccccc2Nc2c(Cl)cccc2Cl)CC1 121724815 LKTYPIQBVIAOHW-UHFFFAOYSA-N 388.298 5.042 30 20 GKED N#Cc1ccccc1COc1cccc(CN[C@@H]2CCO[C@@H](c3ccccc3)C2)c1 157312295 VKLQHBZNPYPUGH-AOYPEHQESA-N 398.506 5.147 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3ccccc3C(C)C)n2)cc1 160114528 HBWFFNYDRUTGRY-SFHVURJKSA-N 391.496 5.188 30 20 GKED CC(C)c1csc([C@H]2CCCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)n1 174905817 DWQSRSYWOFBTMT-INIZCTEOSA-N 396.560 5.479 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cs1 175800491 LFYDCKACHGGDMY-UHFFFAOYSA-N 391.496 5.385 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccccc1SC[C@H](C)C#N 185322262 AOCXERYBCGPDTR-APWZRJJASA-N 379.529 5.307 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(-c2cccc(Cl)c2F)nn1 189884773 LGXNFIYSHDIFGY-UHFFFAOYSA-N 398.869 5.164 30 20 GKED N#CCCCOc1cccc(CNCc2ccc(Br)cc2Cl)c1 237805876 KMMWCBYAKPXUKR-UHFFFAOYSA-N 393.712 5.075 30 20 GKED CCOc1c(Cl)cc(C=NO[C@H](C)c2ncc(C(C)(C)C)o2)cc1OC 255469677 QVEMEPAGJNCNSO-GFCCVEGCSA-N 380.872 5.145 30 20 GKED CCCc1ccc(C(=O)/C(=C(\S)N[C@H]2CCCC[C@H]2C)[n+]2ccccc2)cc1 280503682 CYEBDQLZFWYAGO-NQIIRXRSSA-O 395.592 5.034 30 20 GKED C[C@H](Oc1ccccc1Cl)/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329489700 HPWUNHIIMBCLDJ-KBXCAEBGSA-N 387.911 5.453 30 20 GKED N#CC1(CCCN[C@@H]2CCC[C@H]2c2ccc(C(F)(F)F)cc2)CCOCC1 375621710 WIZVJRXQBVEAMV-RBUKOAKNSA-N 380.454 5.032 30 20 GKED N#CC1(CCCN2CCC(=Cc3cc(Cl)ccc3Cl)CC2)CCOCC1 410409944 GCBRAYDNVCKFEM-UHFFFAOYSA-N 393.358 5.573 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C#N)cc1Cl)c1ccc(OCC(F)(F)F)cc1 426134203 SBGUAQGESCLQCX-LLVKDONJSA-N 397.784 5.035 30 20 GKED Cc1cccc(-c2cncc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c2)c1 426613519 TYBNQNPTLNCXAW-KRWDZBQOSA-N 387.508 5.561 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1ccccc1 431313749 QESGJTXPLQUUBE-HMXCVIKNSA-N 381.907 5.320 30 20 GKED C=CCC(C)(C)CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 432919584 UWEZUIQDERDWGH-UHFFFAOYSA-N 377.488 5.055 30 20 GKED Cc1cc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)ccc1Br 437658015 WXAPFVDFSPSIJF-PKOBYXMFSA-N 398.304 5.061 30 20 GKED CCCN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@@H](C)c1ccccc1OC 438848096 ALIOGJIRRNMTRO-RXVVDRJESA-N 379.504 5.223 30 20 GKED CSc1ccc([C@@H](C)NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 439481737 MEBWAIJCKQWLTG-JKSUJKDBSA-N 399.585 5.092 30 20 GKED CCc1oc2ccccc2c1CN(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458803389 RDIBFVXHUSZYHS-NRFANRHFSA-N 389.499 5.572 30 20 GKED COCc1ccc(C(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)cc1 460339398 OFGYNIFNTUMPPE-UHFFFAOYSA-N 390.870 5.205 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3CC(F)(F)F)c2)cc1 460455226 DKXHPPYUVQGAAJ-UHFFFAOYSA-N 396.368 5.708 30 20 GKED O=C(c1ccccc1C(F)(F)F)N(Cc1ccc(F)cc1)CC(F)(F)F 460462570 VOIZXWVKLKQNMQ-UHFFFAOYSA-N 379.275 5.049 30 20 GKED C[C@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)CCCC#N 463254256 DWGARJYOHQQOTQ-YJBOKZPZSA-N 391.902 5.550 30 20 GKED N#Cc1ccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)cc1 464095849 OQESZJOJCCGWMZ-UHFFFAOYSA-N 379.822 5.215 30 20 GKED CO[C@]1(C)CCCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C1 471204548 YVUGNIGWKOFNAO-SIKLNZKXSA-N 397.906 5.028 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(-c2ccc(F)cc2)on1 474649367 JARAXHSGWNUBLZ-UHFFFAOYSA-N 389.411 5.333 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(CC(=O)OCC)c1 475579291 UUBKHBVLZQQAPB-UHFFFAOYSA-N 380.488 5.288 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(Sc2ccc(Cl)cc2)o1 475913355 WQNVEMZIJADFTQ-UHFFFAOYSA-N 384.844 5.217 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 476446320 IHGZWNUEEDZALV-GOSISDBHSA-N 389.474 5.347 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(C)cc1Br 483197637 PLGXYCRJNCYICM-QGZVFWFLSA-N 379.257 5.104 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)C[C@H](c1ccccc1)C(F)(F)F 483436834 ILQAXOJJDVUUEB-MRXNPFEDSA-N 376.378 5.020 30 20 GKED CO[C@H]1CCC[C@@H](CC(=O)N(Cc2ccc(Cl)cc2)c2cccc(C#N)c2)C1 483625871 OXKCMJXIIQQAQA-GCJKJVERSA-N 396.918 5.340 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(Cl)c(F)cc3Cl)n2)c1 487477777 USEWLMRWVFWJHN-UHFFFAOYSA-N 392.242 5.380 30 20 GKED N#CCCC[C@H](NC(=O)CCOc1ccc(Cl)cc1Cl)c1ccccc1 487578719 XLMWDKUHDXVSEP-SFHVURJKSA-N 391.298 5.314 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1 505022372 DIXGNJXDBXDHBB-UHFFFAOYSA-N 396.918 5.585 30 20 GKED COc1ccc(CN(C)[C@H](C)c2cc3ccccc3o2)cc1OCCCC#N 506339548 ILEFVBRERKDOOC-QGZVFWFLSA-N 378.472 5.317 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2c(ccn2CC(C)C)c1 509976499 LXAQZNVMYFYILO-UHFFFAOYSA-N 386.499 5.389 30 20 GKED Cc1cccc(C)c1NC(=O)[C@@H](C)Sc1nc(-c2ccccc2)ccc1C#N 510189242 KQKGBJPREFMZQL-QGZVFWFLSA-N 387.508 5.356 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 510857405 NSSDRQRVUITSMT-UHFFFAOYSA-N 387.508 5.682 30 20 GKED C[C@@H](C#N)CN(C(=O)c1ccc(-c2ccc(OC(F)(F)F)cc2)s1)C1CC1 514248102 LXMCUDVQDYGHGP-LBPRGKRZSA-N 394.418 5.078 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccccc1OC(C)C 519897072 PURSWBSBGJPULR-IBGZPJMESA-N 393.531 5.274 30 20 GKED CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520196829 FORVVEOEQAZFNH-UHFFFAOYSA-N 377.469 5.466 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)CCCOc1ccc(F)cc1F 520685507 UZEPUGQOVPVKQA-UHFFFAOYSA-N 398.434 5.363 30 20 GKED Cc1ccc(-n2nc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c3c2CCC3)c(C)c1 520713640 WLDUKMLEJRGMDT-UHFFFAOYSA-N 398.510 5.031 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)sc2ccc(F)cc12 520827629 QVQYIAONGCVRMR-LBPRGKRZSA-N 384.501 5.853 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1ccccc1C(F)(F)F 520855275 GUVFBVFJQZHXSZ-CYBMUJFWSA-N 393.434 5.279 30 20 GKED Cc1ccc([C@@H]2CCCN2CC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 532896225 ISFITGUXKBQMLM-NQIIRXRSSA-N 393.556 5.022 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN(C)c1cccc2ccccc12 532926892 QPKYFVXWTZIWEZ-QGZVFWFLSA-N 389.524 5.166 30 20 GKED COc1ccccc1[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccccc1Cl 538396550 OOWTYNNWFJWBRE-HJPURHCSSA-N 376.887 5.660 30 20 GKED Cc1ccccc1[C@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 540363004 RCDWRVZVLBULKJ-GAJHUEQPSA-N 395.572 5.172 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)c2ccc(C3(C#N)CC3)cc2)c1C 540728619 NFWFOFXHZWICLR-UHFFFAOYSA-N 383.451 5.298 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCCCc1ccsc1 541172366 SUAQXAGAKVRQFV-HNNXBMFYSA-N 390.599 5.447 30 20 GKED COc1ccccc1[C@H](NCc1ccc(CC#N)cc1)c1ccccc1Cl 541293287 HGXQMYLUBFGRNE-HSZRJFAPSA-N 376.887 5.294 30 20 GKED Cc1nc(-c2ccccc2)sc1NC(=O)Nc1cccc(OCCCC#N)c1 541463971 ODXPUIYCPMHYIZ-UHFFFAOYSA-N 392.484 5.445 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cncc4ccccc34)no2)c2ccccc21 545688866 YPDRPSUKBPEOAP-KHPPLWFESA-N 391.434 5.324 30 20 GKED C[C@H](C#N)CNC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 554307923 DJAQBCRKFLLERR-GFCCVEGCSA-N 379.312 5.175 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1c[nH]c2cccc(Cl)c12 555993859 IYFOVNXFSKFSKD-ZDUSSCGKSA-N 383.904 5.397 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 556931079 QLFDBYSYDNMJFL-KRWDZBQOSA-N 393.506 5.301 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccn(C(C)C)c1C 559520975 CBARATGEIGLOLA-UHFFFAOYSA-N 387.483 5.389 30 20 GKED C[C@@H](Oc1ccccc1NCc1cccc(OCCCC#N)c1)C(F)(F)F 564680085 PZMSDEHYSYXIOT-OAHLLOKOSA-N 378.394 5.311 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ccccc3Oc3ccncc3)n2)cc1 566514805 UMALQXPSMZGDMC-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#C[C@@H](C(=O)c1csc(C2CCCCC2)n1)c1nc(-c2ccncc2)cs1 570913040 YPZNPBLOBVTLHC-HNNXBMFYSA-N 394.525 5.199 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cn1)c1ccccc1 571972197 DXPVNFGTORSUQL-JTSKRJEESA-N 393.446 5.260 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(C#N)c(Cl)c3)cc2)cc1 575856194 OBLXPFCNMOXONP-UHFFFAOYSA-N 387.826 5.322 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1ccc(-c2ccncc2)cc1F 583592211 YPVLPUMPWBQYDE-UHFFFAOYSA-N 378.495 5.243 30 20 GKED N#CC1(c2ccc(CN[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2)CC1 594914760 KRCFLJHZMUNGCW-ZSHCYNCHSA-N 390.371 5.241 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603692406 SZDHXJYDRUKMFR-QGZVFWFLSA-N 386.455 5.279 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 604561826 HUWIIBYMTLUHLY-IBGZPJMESA-N 398.466 5.075 30 20 GKED CSc1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cn1 608908020 UFFMLVLYEBOKLY-UHFFFAOYSA-N 391.521 5.220 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@@H]3CCCc4ccccc43)cc2)c1 609064923 OWEYZWVWWLHCGW-XMMPIXPASA-N 382.463 5.196 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)sc2ccc(F)cc12 609427467 AXPBBFWZHNNIKE-GFCCVEGCSA-N 384.501 5.995 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3cccc(Oc4nccs4)c3)c2C#N)C1 609910969 VWUQOHQLPADLMQ-LBPRGKRZSA-N 395.509 5.246 30 20 GKED C[C@H](NC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1cccc(C#N)c1 610363198 ULKPBUBJYUDRCM-KRWDZBQOSA-N 396.446 5.374 30 20 GKED C[C@@H](NC(=O)c1sc(-c2ccccc2)nc1C(F)F)c1cccc(C#N)c1 611184124 PYMHKVCGLCOFSM-GFCCVEGCSA-N 383.423 5.110 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCc1ccccc1)c1ccc2ccccc2n1 613290500 DWODSAOFAAYHMV-HSZRJFAPSA-N 376.459 5.510 30 20 GKED Cc1ccsc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 613346929 SKRHVUOLRXPAHG-LBPRGKRZSA-N 393.320 5.977 30 20 GKED Fc1ccccc1-c1nc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cs1 674460264 ORHVINBXIFUGKO-RYUDHWBXSA-N 398.347 5.122 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)c1Br 682990815 ZNXAPKTXALVEGO-ZDUSSCGKSA-N 385.286 5.166 30 20 GKED C=CCN(Cc1cccs1)C(=S)N[C@@H](C)c1ccc(Cl)cc1Cl 726444623 YEMXLOHZIAAFCA-LBPRGKRZSA-N 385.385 5.679 30 20 GKED COc1ccc2oc(C(=O)/C=C\c3cccc(OCCCC#N)c3)c(C)c2c1 729148773 ATZLVWTUXQZSTF-NTMALXAHSA-N 375.424 5.329 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 730397162 YMLQUTFZNPBBTA-ZCNNSNEGSA-N 388.492 5.107 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1ccc(Cl)s1 733079414 AAZITNZAFZIZGQ-UHFFFAOYSA-N 397.813 5.108 30 20 GKED C#CC[C@@H](OC(=O)c1sc(-c2ccc(C)cc2C)nc1C)c1ccccn1 733692242 BURSNKMVICDFKU-LJQANCHMSA-N 376.481 5.052 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl)c1ccncc1 734654186 QSLJOMVDIDFLNV-DIFFPNOSSA-N 382.266 5.205 30 20 GKED N#Cc1ccc2ncc(/C=C/C(=O)c3ccc(-c4ccccc4Cl)s3)n2c1 736433709 JKODCSBLCINTGP-VOTSOKGWSA-N 389.867 5.484 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NCc1cc(Cl)ccc1OCC#N 754677798 WGZOXSHJIANMCD-AWEZNQCLSA-N 397.931 5.525 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)CCCc2cc(Cl)sc2Cl)n1 756299260 FOZXZUMTJHMWGA-LLVKDONJSA-N 387.357 5.834 30 20 GKED CN(CCOCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 757196929 AIUVCNWIXCIKEU-XMMPIXPASA-N 399.494 5.023 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccncc1 759223430 UKADTUDRPTYDFH-RISCZKNCSA-N 389.402 5.080 30 20 GKED C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)Cc1cc(C#N)cs1 768227693 VQMDVPOUZFOEQR-INIZCTEOSA-N 375.497 5.065 30 20 GKED CCOc1ccc(-c2nc(CON=Cc3ccccc3OC(C)C)co2)cc1 772874449 COFIREFFTCXAAL-UHFFFAOYSA-N 380.444 5.078 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1 773076815 PBMWKGFTATUXPN-KXBFYZLASA-N 379.472 5.041 30 20 GKED CC(=NN[C@H]1CCOC(C)(C)C1)c1sc(-c2ccc(Cl)cc2)nc1C 780241325 NXSIAESQVVRHHS-INIZCTEOSA-N 377.941 5.043 30 20 GKED CC(C)COc1ccc(C(C)(C)NC(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 780671250 VUTJZIOEDVSOPK-KRWDZBQOSA-N 395.503 5.069 30 20 GKED Cc1nc(Cl)sc1C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782484665 CUTPGJBMHXORSU-GFCCVEGCSA-N 381.888 5.135 30 20 GKED N#C[C@@H](C(=O)CCCc1ccsc1)c1nc2cc(C(F)(F)F)ccc2s1 783359955 WWJQWMYVBBLJLD-ZDUSSCGKSA-N 394.443 5.576 30 20 GKED O=C1/C(=C\c2ncc(C(F)(F)F)s2)CCSc2ccc(Cl)cc21 788353894 CGPDQGMTXOIFRB-YVMONPNESA-N 375.824 5.577 30 20 GKED Cc1csc(C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1Cl 791851917 CWXPAXCQRKJAEP-UHFFFAOYSA-N 390.679 5.038 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C(C)C)cs1 793164955 QYYPPBYLXCHNCU-HOCLYGCPSA-N 394.462 5.730 30 20 GKED O=C(/C=C\c1ncc(-c2ccccc2)s1)c1nc(Br)ccc1F 794969329 ICZSZZMBCLLLTL-CLFYSBASSA-N 389.249 5.003 30 20 GKED Cc1nc(C(C)C)ccc1CON=Cc1cccc(OCc2ccncc2)c1 842021257 LRIWYWMNMJURAG-UHFFFAOYSA-N 375.472 5.038 30 20 GKED CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](N[C@H](CCCC#N)c3ccccc3)C[C@H]2C1 842874617 DUMZWZXOIUGMBQ-MYGLTJDJSA-N 397.563 5.047 30 20 GKED Cc1c(CN(C)C(=O)Nc2ccccc2O[C@@H](C)C#N)oc2c(C)cccc12 844612053 PCJNCYWIULNITC-HNNXBMFYSA-N 377.444 5.004 30 20 GKED C=CCC1(c2nc(Cc3coc(-c4ccc(OC)cc4)n3)no2)CCCCC1 904327476 DWSZAHKQALWZGJ-UHFFFAOYSA-N 379.460 5.102 30 20 GKED CCCCCCCCCN(C)C(=O)C1CCN(C(=O)Nc2ccccc2)CC1 918686629 VLMKGWDRSOMNCK-UHFFFAOYSA-N 387.568 5.140 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 921005753 KDGFSKWTHAFNMI-XMMPIXPASA-N 384.479 5.310 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ncc(C(F)(F)F)cc2Cl)c1 925416016 BTUVNRWANLEUCT-WFASDCNBSA-N 397.828 5.286 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C/C(=O)c3ccc(Cl)cc3)c2)c1 1776115010 JDFFCCWHOSXWIQ-KPKJPENVSA-N 392.838 5.513 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776339938 RQGFUMMVSDTIJO-GDNBJRDFSA-N 398.502 6.075 30 20 GKED CC1(C)/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776515132 CWVABKAMLYKDOZ-HZHRSRAPSA-N 382.459 5.538 30 20 GKED C[C@H]1/C(=C/c2cccc(C(=O)O)c2Cl)C(=O)c2cccc(Br)c21 1776587101 QEGYLAQDSMBOAX-LMRAXHDRSA-N 391.648 5.184 30 20 GKED CCN(C)c1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776855382 XZEJBOQFXRYSGN-NTMALXAHSA-N 383.444 5.091 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(/C=C/C(=O)O)cc3)s2)cc1 1777430643 XWMJGULJEKXEQP-UTLPMFLDSA-N 389.476 5.421 30 20 GKED O=C(O)c1ccc(Br)c(/C=C2/CCc3c(Cl)cccc3C2=O)c1 1777672993 ZMXIDYGOKVZDBC-NTMALXAHSA-N 391.648 5.013 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc(SC(F)(F)F)c1)C2=O 1777682950 IPIVXLLFQLEKIE-ZROIWOOFSA-N 392.398 5.599 30 20 GKED O=C(O)c1cncc(C(=O)/C=C\c2ccccc2Oc2ccc(F)c(Cl)c2)c1 1777694972 MQYMMXPVGARBSG-YVMONPNESA-N 397.789 5.261 30 20 GKED Cc1ccccc1NC(=O)c1cc2ccccc2cc1OC[C@H](C#N)CCC#N 30533310 IBGHETRFTPSNAJ-SFHVURJKSA-N 383.451 5.223 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2cccc(C#Cc3ccccn3)c2)c1 46538152 KCNLPRDUQTWGHX-UHFFFAOYSA-N 378.884 5.109 30 20 GKED CC(C)c1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 60036240 HLQSTQKURWXWQK-GOSISDBHSA-N 399.494 5.913 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1 62903913 BQIXYJFRNMEVSN-SFHVURJKSA-N 384.479 5.038 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)CCCC2)c1nc(-c2c(F)cccc2F)cs1 64714418 FQGOEXCAIQXQGP-INIZCTEOSA-N 394.446 5.457 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cc(C)ccc2F)[n+]2ccccc2)cc1 65940507 SDDXAKUYRWKQBB-UHFFFAOYSA-O 393.507 5.035 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)c1ccco1 66954672 RLEUQZVKCCIMLM-KKSFZXQISA-N 391.496 5.585 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 70024285 AXCCSXALTJEBLE-UHFFFAOYSA-N 381.476 5.132 30 20 GKED N#CC1CCN(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)CC1 105022563 FOGNEXFNCYJIMF-UHFFFAOYSA-N 389.377 5.265 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc2[nH]ccc2c1 107590702 MIFVGJCRJSAAJU-UHFFFAOYSA-N 381.435 5.179 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1nc2ccccc2n1C(F)F 108407909 BBHSHOFAVWXMBI-UONOGXRCSA-N 386.471 5.856 30 20 GKED Cc1nnc(-c2ccccc2NCc2cccc(OCc3cccc(C#N)c3)c2)o1 127882011 YBSVOGYEMRPNFX-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=CCC[C@H](NC(=O)CCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1 133671562 QWNLGMHBTUATBV-IBGZPJMESA-N 395.890 5.146 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C(C)(C)c2ccc(Br)cc2)n1 177749300 AJOVPCQAKCNQAH-AWEZNQCLSA-N 391.334 5.183 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc2ccccc12 180078403 ASRUMUCZLWYYEW-HTAPYJJXSA-N 385.467 5.500 30 20 GKED COc1cc(CNc2ccccc2O[C@H](C)C#N)ccc1OCc1cccs1 181130835 ZNMUFTRJKFBETJ-MRXNPFEDSA-N 394.496 5.239 30 20 GKED CSc1cccc(C)c1NC(=O)c1ccc(COc2ccccc2C#N)o1 184628845 FFAAILAISCUSNX-UHFFFAOYSA-N 378.453 5.013 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSC/C=C\c1ccccc1 255547203 ZNJFPSGIISDLBG-CGQZWFTASA-N 382.554 5.323 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C[C@H]1C 296540824 FDGZLLZUGHQTFX-MCIONIFRSA-N 385.455 5.276 30 20 GKED C[C@H](Nc1ccc(C#N)c(Cl)c1)c1ccc(NC(=O)c2ccncc2)cc1 301270503 JLDLBEKQMRAODL-AWEZNQCLSA-N 376.847 5.032 30 20 GKED CC(C)c1sc(NC(=O)Cc2ccc(OCC#N)cc2)nc1-c1ccccc1 303547619 ZMFSDTYUPCJQNP-UHFFFAOYSA-N 391.496 5.017 30 20 GKED N#C[C@@H](C(=O)c1coc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 303583196 KTNBFBXWDIPOFS-HNNXBMFYSA-N 378.840 5.700 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1/C(O)=N/CC1(c2ccccc2Cl)CC1 328936235 JLTZLLHILUOPTR-AWEZNQCLSA-N 390.936 5.035 30 20 GKED CC(C)c1ccc([C@H](C)/N=C(/O)N2CCn3c(C4CCCC4)nnc3[C@H]2C)cc1 329427133 HFXZOSBDHQBILQ-DLBZAZTESA-N 395.551 5.111 30 20 GKED CC[C@@H]1OCCC[C@@H]1/C(O)=N/Cc1nc2c(s1)C[C@@H](c1ccccc1)CC2 329917469 QVHUAMIKUHLXMA-LNLFQRSKSA-N 384.545 5.077 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)C[C@H](C)C[C@H]3C)c(C(F)(F)F)o1 410981795 OJUMGYBGYZIKHJ-RKDXNWHRSA-N 382.407 5.478 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1cccc(C(F)(F)F)c1F 430690465 GTVNOIVYZNZBSN-UHFFFAOYSA-N 399.237 5.177 30 20 GKED Cc1cc(C)n(-c2cccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)c2)n1 432678780 OMVQMTXSKSMCBB-JOCHJYFZSA-N 387.487 5.046 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(-c2ccnn2C)ccc1C)c1ccc(F)c(F)c1 439979589 LZNDOIKUQBDDRE-OAQYLSRUSA-N 396.441 5.113 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 441533554 IGDPMQVGJIPCEN-KXBFYZLASA-N 391.437 5.510 30 20 GKED O=[S@](Cc1cccc(NCC#Cc2ccccc2Cl)c1)c1ccccc1 442113108 WKLKFHAPVUILCP-AREMUKBSSA-N 379.912 5.111 30 20 GKED C=C[C@](C)(CCOC)C(=O)Nc1ccc(Sc2nc(C)cs2)cc1C 445614603 BJPPCUWUTHLUPV-LJQANCHMSA-N 376.547 5.078 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc2c(c1)CN(CC(F)(F)F)C2 457329810 OSKQYAGWFJSHAF-UHFFFAOYSA-N 392.446 5.095 30 20 GKED CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@H](C)c1cc2ccccc2o1 458798666 IHWLIFXHLIBMCY-WIYYLYMNSA-N 389.499 5.960 30 20 GKED C[C@H](C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1)c1cccc(C#N)c1 462245297 JBLJQCXKRVBNKQ-HNNXBMFYSA-N 384.932 5.098 30 20 GKED COc1ccc2c(c1)[C@@H](NC1CCC(Oc3ccccc3C#N)CC1)CCS2 467410719 JVGMUHZUHJTRMB-NGICGMGXSA-N 394.540 5.084 30 20 GKED CC(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 470351569 MRERWAVUWAJVOZ-GOSISDBHSA-N 382.460 5.142 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccnc(Oc2ccccc2F)c1 470542866 QVHXNPJCLOBFLZ-UHFFFAOYSA-N 394.471 5.221 30 20 GKED C[C@H](C(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccc(Cl)c(Cl)c1 471865859 NGYYPCDCQCUQBQ-VIFPVBQESA-N 385.197 5.209 30 20 GKED CCc1onc(-c2ccccc2Cl)c1C(=O)Nc1ccc(Cl)c(C#N)c1 474598163 XVLSJUZWSAWEDA-UHFFFAOYSA-N 386.238 5.335 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](Oc2ccccc2Cl)C1 475566159 RTHUMCKQDDWVDW-GOSISDBHSA-N 398.934 5.877 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Oc3cccc(F)c3F)nc2)cc1 477125676 XUGDKSCVXMORSJ-UHFFFAOYSA-N 393.393 5.206 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1)OCC 477678662 JNTIHKSPGOAZLN-HNNXBMFYSA-N 384.423 5.139 30 20 GKED C=CCn1c(SCc2ccn(C3CCCC3)n2)nnc1-c1ccc(C)cc1 481334665 CPNZLRUMZXWLSS-UHFFFAOYSA-N 379.533 5.043 30 20 GKED N#C[C@@H](C(=O)c1cc(F)ccc1-c1ccoc1)c1nc2ccccc2n1C(F)F 483485392 CNKQDUGQTIPRDZ-INIZCTEOSA-N 395.340 5.321 30 20 GKED Cc1ccc(-n2ncc(NC(=O)Nc3ccc(C#N)cc3Cl)c2C(C)C)cc1 484533941 RZIXXZJTVXXSJQ-UHFFFAOYSA-N 393.878 5.473 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SCc1cc2ccccc2o1 486633473 FZTAFGBNXXHKPT-UHFFFAOYSA-N 395.459 5.221 30 20 GKED C=CCn1c(SCCCc2cc(CC)no2)nnc1-c1ccc(Cl)cc1 487120710 VWCJQQDCUPTAHL-UHFFFAOYSA-N 388.924 5.060 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 496354476 DPQAUUOYFHQVSQ-CQSZACIVSA-N 382.414 5.002 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c[nH]nc2-c2ccc(F)cc2)cc1 507876741 YWRCIURSMLLOHW-UHFFFAOYSA-N 398.397 5.132 30 20 GKED CN(C(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccccc1C#N 508088472 NSAOTVGMUHMYFG-UHFFFAOYSA-N 382.419 5.160 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCC2CCC(C#N)CC2)c1 508366165 DAKKJQUXZXWKCH-UHFFFAOYSA-N 393.874 5.064 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510676293 XBYCCBLXBXWBBJ-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C[C@@H](c1ccccc1)n1c(SCc2ccccc2C#N)nnc1-c1ccccc1 515487233 IQHHBDPJWKQQRX-SFHVURJKSA-N 396.519 5.718 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1cc(Cl)ccc1Cl 517448436 FJABCQWRYYZDET-LBPRGKRZSA-N 395.311 5.405 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)c(C)s1 518207622 PUMOYPGVHVOHOY-LJQANCHMSA-N 382.529 5.006 30 20 GKED CCCN(CC(C)C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 519918476 TUKCPIXISWLBBZ-UHFFFAOYSA-N 379.504 5.232 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 521260022 TWUORLHGFNKVCI-MJGOQNOKSA-N 381.545 5.500 30 20 GKED C[C@H](C#N)C(=O)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 522984731 JERUUZZRXZNVGZ-GCJKJVERSA-N 393.490 5.243 30 20 GKED Cc1csc(-c2cccc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)c2)n1 523498501 NGOISDKCCBITPM-UHFFFAOYSA-N 375.497 5.293 30 20 GKED CC(C)(C)[C@H]1CCCN(C(=O)c2ccc(COc3ccccc3C#N)o2)CC1 523828501 SAACEBXGTZOPBL-SFHVURJKSA-N 380.488 5.019 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(-c2nc(Cc3cccs3)no2)cc1 524632786 MLROMOLKDDWFQH-UHFFFAOYSA-N 377.400 5.192 30 20 GKED C[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccc(F)c1 525139997 CYMSYXOZECUZLO-KRWDZBQOSA-N 388.442 5.213 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](OCC(F)(F)F)C1 530553315 JCPSIPNAISBOCW-MRXNPFEDSA-N 384.442 5.114 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(OCc2ccccc2Cl)cc1)C1CC1 532810433 CJKLYHNSYQPWGV-OAHLLOKOSA-N 383.879 5.075 30 20 GKED Cc1cnc([C@@H](C)NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)s1 536396694 ZFELPVPFTCOTPB-CYBMUJFWSA-N 397.887 5.260 30 20 GKED COc1cccc([C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)c1 537295821 RASBATJCHSUEFG-WAIKUNEKSA-N 376.887 5.660 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H](c3ccccc3)[C@H]3CCOC3)c2)c1 540068869 VHKXMKGGELNXSH-AHWVRZQESA-N 398.506 5.005 30 20 GKED Cc1ccc(-c2c(C(C)C)c(CC#N)nc3sc4c(c23)CCN(C)C4)cc1 543445254 OIMVKCCZQGUNFR-UHFFFAOYSA-N 375.541 5.449 30 20 GKED CO[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 549779113 TWUVQCFLZBYPHL-IRFCIJBXSA-N 382.891 5.139 30 20 GKED CC[C@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 566526637 MQRHDGJTSXUXHB-OXQOHEQNSA-N 397.544 5.562 30 20 GKED C[C@H]1Cc2sc(NC(=O)c3cnc(-c4cccnc4)s3)c(C#N)c2[C@H](C)C1 569567361 ZAULMMJNJKKMLO-VXGBXAGGSA-N 394.525 5.076 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ncsc2C(F)(F)F)n1 571123692 BGSDRVGWSWQOBU-QMMMGPOBSA-N 397.275 5.290 30 20 GKED CC(C)(c1noc(C[C@H](CC#N)c2ccccc2)n1)c1cccc(Cl)c1F 573044671 KGVCGAJGHHRWOD-HNNXBMFYSA-N 383.854 5.428 30 20 GKED COc1ccc(N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1Cl 580211578 AHZJJRSPBRTUOM-CYBMUJFWSA-N 389.908 5.269 30 20 GKED CC(C)(C)C[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 589363350 DAFHEOVGSTWAJW-GOSISDBHSA-N 378.476 5.178 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 591865377 RQDGRHTXRVNHHJ-GFCCVEGCSA-N 397.347 5.437 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)sc2n1 603834684 VRJPEBJFWTYORE-JTQLQIEISA-N 381.526 5.223 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1)c1ccc(Cl)cc1 603960381 PHDWYIOUXPDULS-UHFFFAOYSA-N 391.858 5.315 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cccc3[nH]ccc23)c1 609724411 YIIRVWASFFJTPL-UHFFFAOYSA-N 387.826 5.738 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)c[nH]c2c1 610396018 QWPXUBOYPVTKEK-UHFFFAOYSA-N 396.450 5.107 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2cccc(Oc3ccccn3)c2)c(Cl)c1 611094998 LYERTJGNPGVMDW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 622511725 MLVPMTPXVOCLGA-JTQLQIEISA-N 381.238 5.185 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726485703 RJKUXSUNEOHVOH-NSHDSACASA-N 397.853 5.620 30 20 GKED CC(=NNc1ccc(Br)cc1C)c1c(C)nn(-c2ccccc2)c1C 728433105 RRCLSURQOSXTGF-UHFFFAOYSA-N 397.320 5.396 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCCN2CCCC2)cc1Cl 729320441 XOKJXBUWUJAPAO-OAQYLSRUSA-N 395.934 5.200 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(-c2nc3cc(F)ccc3[nH]2)cc1 729942623 PQKBQFHTYSGWHK-UHFFFAOYSA-N 387.443 5.050 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(=O)/C=C\c3ccc4ncccc4c3)c12 730434169 LQMRQAVYSMZZKT-QBFSEMIESA-N 392.462 5.228 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 730742068 SREOLIAOEXUXND-MSOLQXFVSA-N 377.827 5.083 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3cccc(Cl)c3)CCCC2)c1 733771319 RSXLIILXGFTEKM-HXUWFJFHSA-N 396.918 5.149 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](CC(C)C)c2cccs2)c1 733804219 ADRCPNKLGKTOHE-MJGOQNOKSA-N 385.533 5.016 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)CCc3c[nH]c4ccccc34)c2)s1 739595058 DNIZHSOSBOZBAL-UHFFFAOYSA-N 385.492 5.017 30 20 GKED CC(C)[C@@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 740531434 UBTZXENPQSFRES-SJORKVTESA-N 382.916 5.641 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)C[C@H](C)c1ccccc1C(F)(F)F 741523364 YNHWHPWWBOCTKP-NSHDSACASA-N 397.780 5.338 30 20 GKED O=C(/C=C\c1cnn(Cc2ccccc2)c1)c1ccc(SCC(F)F)cc1 741848272 XIDGIYXYUBEXNL-WDZFZDKYSA-N 384.451 5.185 30 20 GKED Cc1ccc(NC(=S)N(Cc2ccccc2)c2ccccc2C#N)cc1F 745707418 KEAGHDIOUPOLBN-UHFFFAOYSA-N 375.472 5.409 30 20 GKED CCN(C(=S)Nc1ccccc1-c1ccccc1)[C@H](C)c1ccc(C#N)cc1 751008985 CYOLRZDPCTVTNE-GOSISDBHSA-N 385.536 6.005 30 20 GKED COCCOc1cccc(F)c1C(=O)/C=C/c1csc(Cl)c1Cl 761478648 UWLJYOIRUJTSQU-AATRIKPKSA-N 375.248 5.115 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3cnc(-c4cccnc4)s3)cc2)cc1 761763135 OWISVIIOSYENHB-UHFFFAOYSA-N 399.431 5.088 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C/C=C/c2ccc(C(C)C)cc2)c1 764235023 AZQFXYLZIXDDIR-XYXUZSOXSA-N 376.500 5.211 30 20 GKED C=CC[C@@H](N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccncc1 766020032 OGXFRUPTLSNADH-FOIQADDNSA-N 379.529 5.490 30 20 GKED N#Cc1ccc(CNc2ccccc2SC[C@H]2CC2(Cl)Cl)c(F)c1 772926142 BHVFQKGAFWIURW-CQSZACIVSA-N 381.303 5.595 30 20 GKED Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 775304008 ADOICFSHNWJZBY-YADHBBJMSA-N 399.498 5.051 30 20 GKED CCCCC[C@@H](NCC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)c1ccccc1 775318105 SQQJIQZSNAPVQP-LEWJYISDSA-N 398.510 5.135 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1cccc2ccccc12)c1ccc(OCC#N)cc1 776155990 JQNCNYAGPPMFKD-HRFSGMKKSA-N 392.502 6.182 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC(F)(F)Cl)cc1 783353445 CFWLFSZFBDMPAZ-GFCCVEGCSA-N 396.846 5.501 30 20 GKED C=CC[C@H](C(=O)OCc1nnc(-c2cc(C)c(CC)s2)o1)c1ccccc1 784831678 FANSJHQZUXPVLN-INIZCTEOSA-N 382.485 5.072 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2cccc(OC(C)C)c2)C(F)F)c1 788645283 OPQMTGAHTCUUHE-RXVVDRJESA-N 388.458 5.251 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(C(F)F)c2)cc1 790544208 VRPSQVDJIHLXNE-NRFANRHFSA-N 376.406 5.461 30 20 GKED N#C[C@@H](C(=O)COc1ccccc1-c1ccccc1)c1nccc2ccccc12 792107487 VXBIGEHZYQQKCP-QFIPXVFZSA-N 378.431 5.157 30 20 GKED N#CC[C@H](CC(=O)N[C@@H]1CCOc2c1ccc(Cl)c2Cl)c1ccccc1 793961762 FKHGXQLLYBGBTE-RHSMWYFYSA-N 389.282 5.021 30 20 GKED O=C(Nc1cc(C(F)F)ccc1Cl)c1cc(F)c(C(F)(F)F)cc1F 804461293 FUWKMCVWTPPJDF-UHFFFAOYSA-N 385.666 5.827 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2nc(Cl)c(C#N)s2)on1 804598093 IYOWBQFYLPCPKI-UHFFFAOYSA-N 396.859 5.097 30 20 GKED C=C(C)Cn1c(-c2ccc(Cl)nc2)nnc1N1CCC[C@@H]1c1cccc(F)c1 812181596 QGNBJEQTTHPBLH-GOSISDBHSA-N 397.885 5.050 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813212664 FNYWTZVRXZXNJG-KSSFIOAISA-N 390.405 5.259 30 20 GKED CCN(c1ccc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1)C(C)C 814310359 SYSYAYKACRNTRN-QFIPXVFZSA-N 378.520 5.478 30 20 GKED CC(C)(C#N)[C@@H]1CCCC1=NNc1ncnc2scc(-c3ccc(F)cc3)c12 814765711 PZBFZTSWAISCPD-MRXNPFEDSA-N 393.491 5.615 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)c1ccc(C2SCCCS2)cc1 819737733 ZRQNUZNKEBNHNI-HNNXBMFYSA-N 382.554 5.260 30 20 GKED C[C@]1(C#N)CC[C@@H](OC(=O)c2sc(-c3ccccc3)nc2C(F)F)CC1 836153423 GXJYOXCXJVWAJY-XVDXERDNSA-N 376.428 5.377 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1ccc(C(F)(F)F)cc1 842943718 YNRBEWGPVMRXGU-IAQYHMDHSA-N 378.419 5.409 30 20 GKED Cc1ccccc1[C@@H](C)c1noc([C@H](CCCCC#N)NC(=O)OC(C)(C)C)n1 848610078 JJKSUVVCHCHNGD-AEFFLSMTSA-N 398.507 5.180 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)CCN1c2ccccc2Sc2ccccc21 914450169 YTDWFULCLGFMIM-UHFFFAOYSA-N 399.519 5.210 30 20 GKED CC(=NNc1cccc(Cl)c1C)c1ccc(S(=O)(=O)C2CCCC2)cc1 915050904 FZTHUMWTHCKNEA-UHFFFAOYSA-N 390.936 5.201 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(F)cc1)c1nc(-c2ccc(Cl)cc2)cs1 915102195 UPDYFMLSMYCVCG-KRWDZBQOSA-N 384.863 5.412 30 20 GKED CC[C@@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 915352370 KMNXXJUUMOVKPB-YADARESESA-N 383.495 5.657 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C/c2ccccc2Cl)cc1 916947627 OWDDZDSEPCVDNP-AWZKMIKPSA-N 380.875 5.214 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]cc2-c2ccccc2)cc1 917119611 OMQVDRROPBAESB-QFIPXVFZSA-N 377.447 5.589 30 20 GKED CC(C)c1ccc(NN=Cc2cccc(OCc3ccccc3C(=O)O)c2)cc1 1776060450 VWKPYCSKMIGWEL-UHFFFAOYSA-N 388.467 5.533 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccc4ccccc4c3)cc2)cc1 1776131359 PFMIUSBDKDWAJV-FRKPEAEDSA-N 378.427 6.101 30 20 GKED C=CCOc1cccc(/C=C(/CC(=O)O)c2nc3cc(Cl)ccc3s2)c1 1776184771 PIEVDKSAPNFDOP-ZROIWOOFSA-N 385.872 5.530 30 20 GKED CCCCCCOc1ccc(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1OC 1776788882 ATKUKRQRDBMQFJ-VQHVLOKHSA-N 388.485 5.310 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C/C(=O)c1ccc(CC(=O)O)cc1 1777341975 KKGQQIQDSNINEO-ACCUITESSA-N 386.447 5.194 30 20 GKED Cc1ccsc1C(=O)/C=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1777477298 YXLWBZPBEHTJHC-PISNEZEASA-N 378.449 5.157 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777559821 HMGSQKVHXYGGQL-NVNXTCNLSA-N 382.415 6.003 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)C3(C)CCC3)cc2)CCC1 1785812699 DZYOZLKKNKJLDQ-HXUWFJFHSA-N 380.532 5.079 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2c(C)cccc2C)[n+]2ccc(C)cc2)cc1 27081323 NLHDVKTVGLAGIW-UHFFFAOYSA-O 389.544 5.259 30 20 GKED COc1ccc(NC(=O)[C@@H](Nc2ccc(C(C)(C)C#N)cc2)c2ccccc2)cc1 28373826 WRODAJWPVAJFQA-QHCPKHFHSA-N 399.494 5.288 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cccnc2Sc2ccccc2)c1 55568205 ZSOJTAJIFILLCN-UHFFFAOYSA-N 389.480 5.168 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1nc2ccccc2o1 67622050 FFNMBXHBOPEFIZ-GFCCVEGCSA-N 379.828 5.095 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](Oc2ccc(Cl)cc2)c2ccccc2)n1 68721860 FCAGSMVPHNDHOT-IEBWSBKVSA-N 382.872 5.102 30 20 GKED CC(C)c1nc2ccc(NCC(=O)Nc3ccccc3SCC#N)cc2s1 72041619 FHXMACWHNOIRCM-UHFFFAOYSA-N 396.541 5.086 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3ccccc3c2)cc1 108372266 ZOAOOFKLVUTYRH-UHFFFAOYSA-N 392.458 5.737 30 20 GKED CC[C@H](N/C(S)=C(/C(=O)c1ccccc1)[n+]1cccc(C)c1)c1cccs1 115511085 XFKUMQFJLGAVDX-SFHVURJKSA-O 395.573 5.024 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)F)cc1)c1nc2cc(Cl)ccc2s1 119977452 KPXQGPRHCWLCHM-LBPRGKRZSA-N 378.787 5.041 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 128897431 BPVJXUOUEMWQKR-JSGCOSHPSA-N 399.928 5.216 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2cc(Br)ccc2Cl)c1 136142152 SDZXERJWTPMKHZ-MRXNPFEDSA-N 393.712 5.073 30 20 GKED COc1ccccc1[C@@H]1CCN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 153999840 OMUQEDLZFQQCKS-IAGOWNOFSA-N 395.528 5.111 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 163375901 IHXKTYDLIYVTHF-KPFFTGBYSA-N 395.528 5.123 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1 187132498 MISFTCPVWXKCFX-OAHLLOKOSA-N 385.558 5.554 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(OC[C@H]2CCCO2)c1 189908988 BQVLILVJEDMXIH-OAQYLSRUSA-N 379.500 5.349 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(C(=O)[C@H](C#N)c3cnc4ccccc4n3)c2c1 190886144 INLOOCOXLZROKP-LJQANCHMSA-N 392.462 5.162 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccco2)Cc2cccs2)cc1 193057094 DJTPJPWLKGKBRU-UHFFFAOYSA-N 379.485 5.377 30 20 GKED N#C[C@H](C(=O)c1csc(C2CC2)n1)c1nc(-c2ccc(Cl)cc2)cs1 194990030 KUQHPOOTXHFVLL-CYBMUJFWSA-N 385.901 5.287 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(F)c(F)c2)nnc1-c1ccccc1F 195593711 RQDDYEAEANNAJA-GFCCVEGCSA-N 375.419 5.402 30 20 GKED C=CCn1c(S[C@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1F 216103177 XCMMYZUKVJCJPB-CYBMUJFWSA-N 384.436 5.032 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(Br)cc2)c(Cl)c1OC 222413856 CCGBSCVWFBRDLK-UITAMQMPSA-N 381.653 5.016 30 20 GKED COc1ccc(-c2ccc(CNCc3cccc(OCCCC#N)c3)cc2)cc1 237434658 XQBHKISANMEUCD-UHFFFAOYSA-N 386.495 5.335 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@H]3CCCOc4ccccc43)c2)c1 237855585 YZDIWIWZIKPRIG-DEOSSOPVSA-N 384.479 5.141 30 20 GKED CN(C)Cc1nc(Oc2ccc(C#N)cc2)c2c(-c3ccccc3)csc2n1 301110594 NATONQKARBVNQN-UHFFFAOYSA-N 386.480 5.084 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCc3ccc(Cl)s3)cc2)c1 303198554 NTYQEDGWDPAKGT-UHFFFAOYSA-N 396.899 5.423 30 20 GKED Cc1ccc([C@@H]2OCCC[C@H]2/N=C(/O)c2ccc3c(c2)N=C(O)C3(C)C)cc1 328912087 OSTHHLHOBOKPLY-QUCCMNQESA-N 378.472 5.099 30 20 GKED CC(C)c1noc([C@H](/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)C2CCOCC2)n1 329101634 NCAVNAWPRURAHL-JCHJZTRSSA-N 389.540 5.224 30 20 GKED CC1(C)CCCC[C@@H]1/C(O)=N/C1(c2noc([C@@H]3CCOC3)n2)CCCCCC1 329877213 IYTYNHCEEQCMLU-IAGOWNOFSA-N 389.540 5.296 30 20 GKED C[C@H](CNC(=O)c1cccc(SCC#N)c1)c1c(Cl)cccc1Cl 429786995 VYIMSYOTADKFLX-GFCCVEGCSA-N 379.312 5.143 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C 432759208 IJCMXHWYUVJCAW-OAQYLSRUSA-N 392.503 5.290 30 20 GKED Cc1ccccc1Nc1nc(CN[C@H](CCCC#N)c2ccccc2)cs1 433013156 NLROGXBMFVEPMI-OAQYLSRUSA-N 376.529 5.720 30 20 GKED C[C@@H]1CC2(CCC2)CN1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 433494112 QDRIYYMLKFXWEK-OAHLLOKOSA-N 379.435 5.286 30 20 GKED C[C@H]1c2c(Cl)cc(Cl)cc2CCN1Cc1nnc(-c2ccc(C#N)cc2)o1 434908203 YGWSOVPSUAFCCZ-LBPRGKRZSA-N 399.281 5.034 30 20 GKED C[C@H](c1ccccc1Cl)N(C(=O)c1cc(-c2cccc(C#N)c2)no1)C1CC1 436406125 BFPOEEHLMSOUDQ-CQSZACIVSA-N 391.858 5.232 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 438076695 UHHCJEKIUGRZSM-WIYYLYMNSA-N 393.556 6.148 30 20 GKED O=C(Nc1ccccc1CC(F)(F)F)N[C@@H](c1ccc(F)cc1)C(F)(F)F 438624109 NWFADBUWQUCFOX-AWEZNQCLSA-N 394.290 5.356 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccc1 439675137 ZDCIRLWHHRHHSO-JOCHJYFZSA-N 399.425 5.265 30 20 GKED CC(C)(C#N)CC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 447200936 RERBDXITCPUTSS-UHFFFAOYSA-N 393.487 5.422 30 20 GKED CC[C@@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(C#N)cc1 447581269 SRUGJSKWVBLRRG-GOSISDBHSA-N 380.385 5.538 30 20 GKED COc1ccc(-c2nnc(S[C@@H]3CC[C@@H](C#N)C3)n2C2CCCCC2)cc1 450651249 LGGIMJFXRARPRX-DNVCBOLYSA-N 382.533 5.243 30 20 GKED C=CC[C@H](C(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1)c1ccccc1 452533950 WETQUQFXJJRQBO-INIZCTEOSA-N 394.462 5.228 30 20 GKED Cc1cc(F)ccc1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 454754295 NLKFMMVSNKEOOB-MGPUTAFESA-N 397.519 5.755 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H](CC(F)(F)F)c1ccccc1)c1ccccc1 457897712 HPZIGDXXRPUGQW-RBUKOAKNSA-N 389.421 5.414 30 20 GKED Cc1sc([C@H](C)NC(=O)NCC(C)(C)CC#N)nc1-c1ccc(Cl)cc1 458532828 UKSOEPPTDAULOG-LBPRGKRZSA-N 390.940 5.072 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 464935880 AOSCOUGLWXBCEU-SJORKVTESA-N 393.537 5.092 30 20 GKED COc1ccc2sc(C(=O)N3CCC[C@H]3[C@@H](C#N)c3ccccc3)c(C)c2c1 464937694 FNEVEEMHTHMFRT-PMACEKPBSA-N 390.508 5.130 30 20 GKED CC(C)(C)Nc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 466469029 OHYWXBRLQFJMCG-UHFFFAOYSA-N 386.455 5.208 30 20 GKED C[C@H](Nc1ccc(C(F)(F)F)cc1C#N)c1nc2ccccc2n1C(F)F 467745585 FXZRWFDNAHTWMP-JTQLQIEISA-N 380.320 5.495 30 20 GKED CCCCOc1ccccc1CNc1ccc2c(c1)CCC(=O)N2CCCC#N 469073560 VDIYOIBWRLHEEF-UHFFFAOYSA-N 391.515 5.061 30 20 GKED Cc1ccc(-c2cnc(NC(=O)c3cccc(SCC#N)c3)s2)c(C)c1 470341570 CZHHSCMEHXWDMS-UHFFFAOYSA-N 379.510 5.295 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)[C@@H]1Cc2ccccc2O1 475564466 BEYGCGOZHDCYRV-JTSKRJEESA-N 378.516 5.394 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1)c1ccccc1 476533863 BZYROIYLRRFPJH-LAUBAEHRSA-N 386.417 5.360 30 20 GKED N#CC[C@H](CC(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1 476652945 BNJQCIXTVHAGGV-RTBURBONSA-N 386.417 5.109 30 20 GKED CC[C@@H]1[C@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 480637850 RWKDOPTVNRGMTE-DNVCBOLYSA-N 379.460 5.011 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)c1ccccc1NCc1ccccc1Cl 482440208 WJGVLGUOROZXBX-UHFFFAOYSA-N 389.886 5.096 30 20 GKED Cc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)c(-c2nc3ccccc3[nH]2)c1 483334132 AAQGXYDWCRTIQN-IBGZPJMESA-N 394.478 5.564 30 20 GKED N#C[C@H](C(=O)c1coc(C2CCCCC2)n1)c1nc2cc(Cl)ccc2s1 484050623 XSSDFTBIUOINMC-CYBMUJFWSA-N 385.876 5.475 30 20 GKED COc1ccc(C(=O)Nc2ccccc2SCCC#N)c(OC2CCCC2)c1 485513988 CBUMMAKHQQZZRR-UHFFFAOYSA-N 396.512 5.275 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1 485652925 CEFDQHJJXVDWOR-UHFFFAOYSA-N 396.874 5.749 30 20 GKED CC(C)(C)C[C@H](O)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 485707483 FOAHALUQJCOFDF-MJGOQNOKSA-N 384.907 5.121 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Sc2ncccn2)cc1C 486255954 RBOKJGXVAIMECU-UHFFFAOYSA-N 393.537 5.467 30 20 GKED CC(C)(CCC#N)CNC(=O)c1ccccc1Nc1ccc(OC(F)F)cc1 489875076 MVORMJUWRXUBHK-UHFFFAOYSA-N 387.430 5.091 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2F)nc1 490228558 CEUPORFQVCYEQR-UHFFFAOYSA-N 383.448 5.295 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Br)c1)[C@H](C)c1ccc(C#N)cc1 493976472 IBGIKHBMQRCPKD-JSNMRZPZSA-N 397.316 5.034 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cc2ccccc2n1CC(F)(F)F 495232364 RQUMPHKAFSAXHI-UHFFFAOYSA-N 399.416 5.126 30 20 GKED CCCN(C(=O)c1cccc(CC#N)c1)[C@H](C)c1ccc(Cl)c(Cl)c1 502786579 AENNOTCGFSGURM-CQSZACIVSA-N 375.299 5.673 30 20 GKED CCN(C(=O)c1ccc(Br)c(C(F)(F)F)c1)c1ccc(C#N)cc1 510387767 CFHJTIFLCBSOPW-UHFFFAOYSA-N 397.194 5.006 30 20 GKED C[C@@H](Sc1cc(C#N)ccn1)c1ncc(-c2ccc(Cl)cc2Cl)o1 512757795 QWBFPWVFRLJOPD-SNVBAGLBSA-N 376.268 5.768 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(OC(F)F)cc2)nc2sccc2c1=O 513247144 KJHGQGRZMKAKBH-LLVKDONJSA-N 394.468 5.099 30 20 GKED N#CCc1ccc(NC(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1 514504629 VTXAUGAHHCLRJB-JOCHJYFZSA-N 394.478 5.188 30 20 GKED Cc1nc(SCC(=O)N2CCCCC[C@@H]2c2ccccc2)c(C#N)c(C)c1C 520016560 FOTXOTYOBWNXGR-OAQYLSRUSA-N 393.556 5.115 30 20 GKED Cc1sc(NC(=O)c2cc(Br)cc3ccccc23)c(C#N)c1C 521620476 VDGVVNSEQOJYEZ-UHFFFAOYSA-N 385.286 5.405 30 20 GKED N#C[C@H](NC(=O)CCSc1ccccc1Cl)c1cccc(C(F)(F)F)c1 521886405 VVQNQFGBTWIMKK-HNNXBMFYSA-N 398.837 5.222 30 20 GKED Cc1csc(-c2cccc(NC(=O)[C@@H](Oc3ccccc3C#N)C(C)C)c2)n1 522548379 SWJCARJPBIKJCH-FQEVSTJZSA-N 391.496 5.032 30 20 GKED C[C@@H](C1CC1)N(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)C1CC1 522640149 WDFDHBNMFBWUHM-AWEZNQCLSA-N 380.875 5.407 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccccc1CN(C)C(=O)c1cccs1 524830118 GECHOKDGOHYQCZ-UHFFFAOYSA-N 399.560 5.230 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1)C1(C#N)CCC1 525582112 GMBLATOCOMBEAX-UHFFFAOYSA-N 375.255 5.304 30 20 GKED N#CCc1ccc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1 534736702 HOGODMVIMCMRAZ-UHFFFAOYSA-N 398.249 5.499 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 535333831 WNVGTVMLALTNCN-MRXNPFEDSA-N 376.481 5.299 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCCOc1ccc(F)cc1Cl 539854909 OKXMPPAIFWJHHF-UHFFFAOYSA-N 383.810 5.029 30 20 GKED Cc1sc([C@@H](C)NC(=O)c2cscc2C#N)nc1-c1ccc(Cl)cc1 556602356 SEHRHDNOPUSHIH-SNVBAGLBSA-N 387.917 5.196 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1ccccc1OC(C)C 562255488 HSJHWMLWRZRABN-IBGZPJMESA-N 398.551 5.100 30 20 GKED N#Cc1c(NC(=O)c2coc(C3CCCC3)n2)sc2c1-c1ccccc1OC2 562699815 BCFRLYDGFVHPOJ-UHFFFAOYSA-N 391.452 5.077 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cnc(-c4cccnc4)s3)c(C#N)c2[C@H](C)C1 569567359 ZAULMMJNJKKMLO-NWDGAFQWSA-N 394.525 5.076 30 20 GKED C[C@@H]1Cc2sc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c(C#N)c2[C@@H](C)C1 569685836 XCMOZOFOKGBFIX-XEZPLFJOSA-N 378.497 5.004 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N1CCC(CCC#N)CC1 571520783 ZFPQRVQPRISEFE-UHFFFAOYSA-N 377.488 5.122 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC(F)(F)[C@H](C)C1 577106190 OMZRZKAVRXLAEL-OAHLLOKOSA-N 385.414 5.168 30 20 GKED C[C@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1cccc(F)c1 578407259 ZXVVXJPYUVNVQY-OAHLLOKOSA-N 375.403 5.017 30 20 GKED COCc1nc(NCC(C)(C)CCC#N)c2c(-c3ccccc3)csc2n1 588844837 HDPOFCADGWLNAM-UHFFFAOYSA-N 380.517 5.247 30 20 GKED C=C(C)COc1cccc(NC(=O)c2c(-c3ccccc3Cl)noc2C)c1 589385041 WAXJWUKLEKRFMN-UHFFFAOYSA-N 382.847 5.511 30 20 GKED N#Cc1ccc(C[S@@](=O)Cc2nc(C3CCCCC3)cs2)c(Cl)c1 593195875 CNQGHFPBGMXDNH-XMMPIXPASA-N 378.950 5.165 30 20 GKED CC(C)(C#N)c1ccc(CNCc2ccccc2COCc2ccccc2)cc1 594495697 SMMNLBYUJVXOTG-UHFFFAOYSA-N 384.523 5.494 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@H](c3cccs3)C3CC3)cn2)cc1 603689772 FDOHBLFCNFBLAG-FQEVSTJZSA-N 390.468 5.080 30 20 GKED Cc1nc2ccc(C(=O)Nc3sc4c(c3C#N)CCCCCC4)cc2nc1C 603996397 NWYDZULSEAHKLB-UHFFFAOYSA-N 390.512 5.091 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(C(F)F)cc1 608805856 NFMSMJAUJFBSNE-UHFFFAOYSA-N 378.378 5.849 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cccc2c1ccn2C 608878430 WLQXKWKDRSXNNE-UHFFFAOYSA-N 381.435 5.403 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 609078288 WVBKMYMXHOSTNN-UHFFFAOYSA-N 377.469 5.384 30 20 GKED CC(C)(C)c1nc(CC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cs1 609176446 KTXVFIDZDFZUTO-UHFFFAOYSA-N 391.496 5.286 30 20 GKED COc1cccc2cc(C(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)oc12 609177339 PJHFFCJXRMUOEV-UHFFFAOYSA-N 384.391 5.358 30 20 GKED C/C=C/c1ccc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(OC)c1 609384629 ZFEPFZLWYXEEBA-RRGWEWPQSA-N 396.512 5.140 30 20 GKED C[C@H](NCc1cc(Br)cc(C(F)(F)F)c1)c1cccc(C#N)c1 611146264 FWEYQBRBSVHDAI-NSHDSACASA-N 383.211 5.190 30 20 GKED CC(C)(C)c1ccc(Cl)cc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 619804059 XYXSKASQVJKVPQ-UHFFFAOYSA-N 393.918 5.830 30 20 GKED C[C@@H](CC(=O)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)C(F)(F)F 626405023 VOKSCNGOCGXUPA-WRWORJQWSA-N 381.238 5.014 30 20 GKED Cc1c(C(=O)N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)sc2ccc(F)cc12 674471053 AXCTXYPRRZOZMQ-QWRGUYRKSA-N 399.331 5.162 30 20 GKED CCN(Cc1ccc2ccccc2c1)C(=S)Nc1ccc(C#N)c(Cl)c1 726477519 WIGRAWHZVVFANZ-UHFFFAOYSA-N 379.916 5.584 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)cc1 726940824 UVVNBVJAOGLUCI-UHFFFAOYSA-N 397.478 5.116 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(-c2ccccc2F)s1 728440823 WCZJCDKPPPNICF-VOTSOKGWSA-N 381.259 5.491 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1nc2ccccc2s1 730688075 ZAEGHNPUQOHQNF-BFHYXJOUSA-N 387.291 5.583 30 20 GKED CC(C)Oc1cccc(CNCc2cccc(OCc3ccccc3C#N)c2)c1 731361074 YRWMNFMUOKJGKE-UHFFFAOYSA-N 386.495 5.214 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1)c1ccncc1 734661499 KOLLRVHTOSTAKP-FCHUYYIVSA-N 391.902 5.441 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CC(c3ccccc3)c3ccccc3)[nH]c12 735792134 IFRIIBUFCBBZJB-OAQYLSRUSA-N 379.463 5.270 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Br)s2)c(SC)cc1OC 741165370 LUNHKKAKNJVOPI-PLNGDYQASA-N 399.331 5.146 30 20 GKED CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H](C)c1cccc(O)c1 743096386 QLXNGRDCTCODBC-HOYKHHGWSA-N 399.494 5.663 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)cc1)c1ncc(-c2ccccc2)o1 743475018 PNQHTBNVTHZJPT-SFHVURJKSA-N 395.462 5.965 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NCc3ccc(N(C)CCC#N)cc3)cc2)cs1 754823074 ZJIMYHHKIVIOGY-QGZVFWFLSA-N 390.556 5.319 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(-c3ccccn3)ccc2Cl)cc1 755165411 QTWCWEVURHVOQW-UHFFFAOYSA-N 375.859 5.271 30 20 GKED C=C[C@@H](CC(=O)Oc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 758156430 QQZDNEJZSKQLIP-INIZCTEOSA-N 377.465 5.266 30 20 GKED CC1(C)C(=O)Nc2ccc(C(=O)/C=C/c3csc(-c4ccc(F)cc4)n3)cc21 759121576 QVAWAKRJIIVDPH-CSKARUKUSA-N 392.455 5.075 30 20 GKED C/C(=C\c1ccc(Cl)cc1)C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759184029 OUIJRQKSONABQA-YLZCUGDYSA-N 376.843 5.125 30 20 GKED N#C[C@@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nc2ccccc2s1 760963244 GONSYXSQNPTIOU-INIZCTEOSA-N 393.899 5.561 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2csc(Cl)c2Cl)ccc1OC 762443059 OGTBXRMHQCPDTO-CYBMUJFWSA-N 385.316 5.034 30 20 GKED N#CCCCOc1cccc(CN2CCCCC[C@@H]2C[C@H](O)c2cccs2)c1 770291009 GMJZUTKMBPEGJF-IRLDBZIGSA-N 398.572 5.299 30 20 GKED CN(CCC#N)c1ccc(CNc2ccccc2SCC(F)(F)F)cc1 770511621 HMWNCKSJNVNYEG-UHFFFAOYSA-N 379.451 5.303 30 20 GKED COc1ccccc1-c1nc(CON=C(C)c2cc3ccccc3o2)cs1 774794249 DSXPFGSIQRXQNQ-UHFFFAOYSA-N 378.453 5.506 30 20 GKED N#Cc1cc(Oc2ccc(C3SCCS3)cc2)nc2ccc([N+](=O)[O-])cc12 785718001 JAGLMKPESSUDDJ-UHFFFAOYSA-N 395.465 5.286 30 20 GKED Cc1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c(Cl)c1 790767021 DUQBOVZBOQOVGT-KRWDZBQOSA-N 391.883 5.063 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792100013 CLOGUBMCINGJEK-SIKLNZKXSA-N 378.859 5.168 30 20 GKED C=CCC(C)(C)C(=O)O[C@@H](C)C(=O)N1c2ccccc2Sc2ccccc21 796473984 NKIOZHHJIGDSNF-HNNXBMFYSA-N 381.497 5.350 30 20 GKED FC(F)(F)c1nc(NN=C2CCC[C@@H](c3cccnc3)C2)c2ccccc2n1 799871969 JVFUJDLIJIPHIT-CYBMUJFWSA-N 385.393 5.169 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H]2CCCc3c2[nH]c2ccccc32)ccc1OC 808705862 UXMFJOCZIGRRJI-UTKZUKDTSA-N 389.499 5.025 30 20 GKED Fc1ccc(CCNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(Cl)c1 811472917 MCVLGMLMOVNPQN-QWRGUYRKSA-N 391.758 5.521 30 20 GKED N#Cc1ccc(CN[C@H](CCc2ccccc2)c2ccccc2O)cc1Cl 815624004 MXDGALXWMZVGGO-JOCHJYFZSA-N 376.887 5.381 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)N(C)[C@@H](C)c2cccs2)s1 819122273 UERYWWSUDQOCHD-LBPRGKRZSA-N 386.995 5.120 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)CC(F)(F)F 840433787 SEEBIWXMNOBBON-KBXCAEBGSA-N 375.394 5.052 30 20 GKED CCOc1ccccc1C=NOCC(=O)Nc1c(C(C)C)cccc1C(C)C 849805710 BSLMZBHJXZONPX-UHFFFAOYSA-N 382.504 5.321 30 20 GKED C[C@H](Nc1ccc(CCC#N)cc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 903297080 ASUQLOCRJUNQAN-KRWDZBQOSA-N 382.529 5.032 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1SCc1ccccc1 915329856 JVSIQSJQYUZTFI-UHFFFAOYSA-N 387.508 5.514 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(C)=NNc3cccc4ncccc34)c12 915964089 VJEKCRCCEYZYKE-UHFFFAOYSA-N 394.482 5.168 30 20 GKED C[C@H](Cc1ccco1)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 916510035 ZOPZAYINDGIIFA-FOIQADDNSA-N 393.874 5.341 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2cc(Cl)cc(Cl)c2)S1 917516278 RIFXPLKTYJFZFZ-NVNXTCNLSA-N 377.296 5.502 30 20 GKED N#CCCc1ccc(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)cc1 932567305 UFEWQYSTMHKQPG-UHFFFAOYSA-N 375.394 5.129 30 20 GKED CC(C)[C@@H](Cc1ccccc1)NN=Cc1ccc(-c2cccc(C(=O)O)c2)s1 1776055885 AHJRWOXAAAJOLY-OAQYLSRUSA-N 392.524 5.304 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(C(F)(F)F)cc1 1776354634 PTTLAOOZPCGYRJ-WEVVVXLNSA-N 378.346 5.087 30 20 GKED CCCCCCCC[C@@H](C)C(=O)NCc1ccccc1-c1cccc(C(=O)O)c1 1776786025 CSKOEOAUEPNVGM-LJQANCHMSA-N 395.543 6.055 30 20 GKED CCCCCCCOc1cccc(CN[C@H]2C[C@@H](CCC(=O)O)C2(C)C)c1 1776787422 HYAUCZCQYZDQPH-CTNGQTDRSA-N 375.553 5.405 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CCOc2ccccc2)C(=O)O)c1 1776787459 UAIPHVFLNSXNQW-HSZRJFAPSA-N 399.531 5.048 30 20 GKED COc1cc2ccc(C(=O)/C=C\c3ccc(C(=O)O)cc3Cl)cc2cc1OC 1777343284 IZPPLSIUFHPROU-FPLPWBNLSA-N 396.826 5.105 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCSc2ccc(F)cc21 28319588 TWKQYCARVOTCRJ-OAQYLSRUSA-N 388.467 5.331 30 20 GKED CN(C(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)c1cccc(C#N)c1 63326585 CCIJBTKLIWSSBM-UHFFFAOYSA-N 394.805 5.722 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1CCc1ccccc1 66954606 WZWQBYOXTBEAIS-AZUAARDMSA-N 393.556 5.710 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCCCc1ccccc1 108238952 GTUHJIVDAIYHJZ-KRWDZBQOSA-N 384.570 5.243 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1nccc2ccccc12 120341844 XSGAUXOFUSHREG-HNNXBMFYSA-N 393.537 5.217 30 20 GKED COc1ccc(C(=O)Nc2cccc(CN[C@@H](CCC#N)c3ccccc3)c2)cc1 130464111 JVBKSEIVRKEOQK-DEOSSOPVSA-N 399.494 5.082 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2C2(CC2)C1 187113954 KUXGRDHEHTUHJA-MRXNPFEDSA-N 377.513 5.018 30 20 GKED CCCOc1cc(OC)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 188787095 DTMOXGKCHNMTTI-HNNXBMFYSA-N 384.501 5.131 30 20 GKED C[C@H](Nc1cccc(F)c1C#N)c1cccc(NC(=O)Cc2ccccc2F)c1 301080569 HPLJTBUAUWEXJQ-HNNXBMFYSA-N 391.421 5.191 30 20 GKED Cc1nc(C)c(-c2csc(N=C(O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)n2)s1 328801727 ZMJNDYGDGQHMJE-GHMZBOCLSA-N 389.468 5.840 30 20 GKED Cc1scc(/C(O)=N/C2CCC(/N=C(/O)c3csc(C)c3C)CC2)c1C 329175352 MJDLIJKMMROTPQ-UHFFFAOYSA-N 390.574 5.664 30 20 GKED OC(=Nc1cccc(-c2ncco2)c1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329503667 ZCFJMBGXAAOVKV-QGZVFWFLSA-N 390.487 5.436 30 20 GKED Cc1cc(SC2CCCCC2)ccc1N/C(O)=N/C[C@H]1CCc2nccn2C1 329851323 SYKGYPKYHOGCGJ-QGZVFWFLSA-N 398.576 5.205 30 20 GKED Cc1ccc(-c2csc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)n2)cc1C 330038340 ZWAYMJCIIIZRDQ-UHFFFAOYSA-N 397.544 5.940 30 20 GKED Cc1nc(-c2cccc(NC(=O)c3sc4ccc(C#N)cc4c3C)c2)oc1C 428208893 OXYFRULQCGUVKX-UHFFFAOYSA-N 387.464 5.606 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCC3(CC#N)CC3)cc2Cl)n1 432052613 AQGXTUADDSCVTI-UHFFFAOYSA-N 392.937 5.072 30 20 GKED COc1cccc([C@H](C)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 437472829 ZSDDLBLGMPMJMH-HNNXBMFYSA-N 390.414 5.240 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)Nc1ccc(F)c(C#N)c1)C1CC1 437969430 IORUYVKTIJKUFG-LBPRGKRZSA-N 391.368 5.474 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 438483583 NJBUITCALZXWTF-UHFFFAOYSA-N 393.462 5.824 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 438659594 DJDVEQROVXSGET-OAHLLOKOSA-N 375.403 5.372 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccccc1 452139496 NSWKTPHNRDSQRR-ZCNNSNEGSA-N 397.316 5.104 30 20 GKED CC(F)(F)CCNC(=O)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 455146389 SRSIEFXDEHEKHV-NSHDSACASA-N 392.290 5.043 30 20 GKED Cc1nc(N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c(Cl)cc1C#N 461780653 UJPJWCHVQSIMJH-UHFFFAOYSA-N 387.270 5.094 30 20 GKED C[C@H](c1cccc(C#N)c1)c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 461800184 ABVIXKQYAPBSAN-CQSZACIVSA-N 386.386 5.086 30 20 GKED C[C@H]1CCc2[nH]c3ccc(C(=O)[C@H](C#N)c4cc(C(F)(F)F)ccn4)cc3c2C1 464458020 DIIYOTAKVNWODH-YVEFUNNKSA-N 397.400 5.197 30 20 GKED CC[C@@](C)(NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1)c1nccs1 464968425 ZYYMDBUYQLXTHR-JOCHJYFZSA-N 391.496 5.171 30 20 GKED CC[C@@]1(C)CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)C1 467853411 SSLNGKZTASAMAH-QHCPKHFHSA-N 377.488 5.100 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccnc(-c3ccccc3)c2)c2ccccc21 469384232 REPURSWTPQGZOK-UHFFFAOYSA-N 380.451 5.259 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1cccc(C(F)(F)F)c1 469657428 BWJNXQBWFZGYEN-LJQANCHMSA-N 387.405 5.645 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(OC)c(C(C)C)c(OC)c1 469911257 YKWHUOVLDMCATP-UHFFFAOYSA-N 382.504 5.437 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1 474388621 KCEFYHJSNOHGGV-FQEVSTJZSA-N 392.549 5.399 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1cc2cccc(F)c2o1 474710511 QBUSEAIXGHMLNJ-KBPBESRZSA-N 397.475 5.706 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C[C@H](c1ccccc1)C(F)(F)F 482463223 KSNDOAWIMWJQRZ-HXUWFJFHSA-N 388.433 5.279 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@H](C#N)c1nccc2ccccc12 483201441 MXYLJZNJTQSPKL-GOSISDBHSA-N 384.460 5.462 30 20 GKED N#CCCC[C@@H](NC(=O)COc1ccc2oc3ccccc3c2c1)c1ccccc1 487515128 OBYDJFYZHCAFPH-JOCHJYFZSA-N 398.462 5.516 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1c(F)cccc1Cl 500771205 VMYHAXNHYHKBQN-UHFFFAOYSA-N 394.833 5.633 30 20 GKED C[C@@H](NC(=O)Nc1cccc(C#N)c1)c1ccc(NC(=O)Nc2ccccc2)cc1 502670636 PZJHQULKKGNAND-MRXNPFEDSA-N 399.454 5.085 30 20 GKED C=CCN(C(=O)c1ccccc1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 502974339 MBMOGPXQCJZQNW-UHFFFAOYSA-N 389.307 5.950 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(Cl)c(Br)c2)n1 511866938 BDALPOCUXPCELA-SNVBAGLBSA-N 383.698 5.172 30 20 GKED CC(C)[C@H](Sc1cc(C#N)ccn1)C(=O)Nc1ccc(Cl)c(Cl)c1 515287928 GOILQGLUNROKOH-INIZCTEOSA-N 380.300 5.015 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)Cc1ccc(C(F)(F)F)cc1 518971703 PFMLUYNZEUQVDS-AWEZNQCLSA-N 382.451 5.096 30 20 GKED Cc1ccc(CN(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C(C)C)s1 522070968 UFFNVEZYXIBYTL-UHFFFAOYSA-N 389.524 5.294 30 20 GKED N#Cc1c(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)sc2c1CCCCCC2 522894572 LNCIARBCSWLMHK-UHFFFAOYSA-N 389.864 5.093 30 20 GKED C=CCC[C@@H](NCc1nc(C)c2ccccc2n1)c1ccc(C(F)(F)F)cc1 537131869 FECYMZLWNQNUNO-LJQANCHMSA-N 385.433 5.754 30 20 GKED C=CCCC[C@@H](C)NC(=O)Cc1csc(-c2cc(Br)cs2)n1 538332219 CYCMRLXIPHSNJC-LLVKDONJSA-N 399.379 5.038 30 20 GKED C=CCn1c(SCc2cnc3ccccc3c2)nnc1-c1ccccc1F 538570469 UWGQWYQFKLWENX-UHFFFAOYSA-N 376.460 5.111 30 20 GKED N#CC1(c2ccc(C(=O)N(CCc3ccc(F)cc3)C3CCCC3)cc2)CC1 539659732 HDDZJRJWKJDZSH-UHFFFAOYSA-N 376.475 5.008 30 20 GKED N#CC1(CCCN[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)CCOCC1 539710833 HUWFFGNPUSPLFE-OAQYLSRUSA-N 386.898 5.259 30 20 GKED C[C@H](N[C@H](C)c1cnc2ccsc2c1)c1ccc(-c2cccc(C#N)c2)cc1 541175790 DWEGHWODKIMVFA-DLBZAZTESA-N 383.520 6.247 30 20 GKED N#Cc1cccc(C2(N[C@H]3CCc4c(Br)cc(Cl)cc43)CC2)c1 556608980 LFKZPKJWQZGSNH-SFHVURJKSA-N 387.708 5.240 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 559846459 ZCVYKOZUDQVOBA-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1sc(-c2ccccc2)nc1C 561239998 DTZFQBDMPLHVLV-UHFFFAOYSA-N 394.544 5.114 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(CC2CC2)c2cccc(C(F)(F)F)c2)cc1 567977227 IOVPCGGRBOOTFO-UHFFFAOYSA-N 386.417 5.563 30 20 GKED N#CCCC1CCN(Cc2cccc(NC(=O)c3ccccc3Cl)c2)CC1 581252050 KQQHDWGVHSLOSO-UHFFFAOYSA-N 381.907 5.108 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCCC[C@H]1c1ccccc1 581343383 PNQFLBVTHCQHIE-PXNSSMCTSA-N 379.529 5.840 30 20 GKED COc1ccc(COCc2cccc(NC(=O)CC3(C#N)CCCCC3)c2)cc1 596949934 YZDPJVMVTXXMPC-UHFFFAOYSA-N 392.499 5.215 30 20 GKED CN(Cc1ccccc1Cl)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603689854 BFHVTLRJGGABNL-UHFFFAOYSA-N 392.846 5.063 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 603690406 OLYJLUSKVXVMFF-FDDCHVKYSA-N 390.487 5.178 30 20 GKED C=CCCOCC(=O)Nc1c(C)cccc1-c1nc2ccc(F)cc2n1C(C)C 607852261 APGKBRUJZNEKJH-UHFFFAOYSA-N 395.478 5.263 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C(c1ccccc1)c1ccccc1 609427802 MSMBAYFJYFSOTA-SFHVURJKSA-N 386.520 5.851 30 20 GKED N#Cc1ccc(SCc2ncc(-c3cccc(Br)c3)o2)c(F)c1 610219607 ANVTXZOZDJUMAR-UHFFFAOYSA-N 389.249 5.407 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1cccc(C#N)c1 610331334 URYXTYBYTSIPET-CQSZACIVSA-N 392.846 5.282 30 20 GKED C[C@@H](NCc1ccc(-c2ccc(Br)cc2)o1)c1cccc(C#N)c1 610344938 NRTWAJGYVOLYMA-CQSZACIVSA-N 381.273 5.432 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1cccc(C#N)c1 610357342 KZNPIVOTLXPQRQ-AOMKIAJQSA-N 389.886 5.361 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C[C@@H](C)C#N)C3CC3)c(C)c2)n1 611095174 ZLTFZLWGTZPXDW-LBPRGKRZSA-N 386.546 5.067 30 20 GKED O=C(CCCC(=O)C1CC1)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 649227885 RYLKPJYRHWZHRH-UHFFFAOYSA-N 399.306 5.064 30 20 GKED O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1c(F)cc(C(F)(F)F)cc1F 685778740 TZJCGHPBPFFFHC-BDAKNGLRSA-N 389.286 5.082 30 20 GKED COc1ccc2nc(C)c(C(=O)Nc3ccccc3SC[C@@H](C)C#N)cc2c1 730993860 DQELHXLMNWBNDZ-AWEZNQCLSA-N 391.496 5.056 30 20 GKED N#C[C@@H](NC(=O)c1ccc(SC(F)F)cc1)c1cccc(C(F)(F)F)c1 731645185 HAYMVQXQQLTDTF-CQSZACIVSA-N 386.345 5.015 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccccc3)[nH]2)cc1 732495916 KQAKBCKYNPMWPG-OXJNMPFZSA-N 385.467 5.156 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)OCc1cc(Cl)ccc1OCC#N 735339157 GZJXJVZHAGBAMB-UHFFFAOYSA-N 398.871 5.031 30 20 GKED Cc1c(C(=O)/C=C\c2cnc(-c3ccccc3)[nH]2)cnn1-c1cccc(Cl)c1 742434655 MEFLPLIVECTQEG-KHPPLWFESA-N 388.858 5.120 30 20 GKED Cc1csc(SCc2ccc(C(=O)N[C@H](C)c3cccc(C#N)c3)cc2)n1 743778418 ITQPKIIMRKWLHO-OAHLLOKOSA-N 393.537 5.107 30 20 GKED O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)NCCCC(F)(F)F 743779454 WQDSWXNDCBBFDG-NSCUHMNNSA-N 393.249 5.196 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2ccccc2C)cc1 751014886 SUAOFGGIVUZBPD-UHFFFAOYSA-N 389.480 5.477 30 20 GKED C[C@H](ON=Cc1ccccc1OC(F)F)c1ncc(-c2ccc(Cl)cc2)o1 752754556 SSQMHVHTCNVLFC-LBPRGKRZSA-N 392.789 5.708 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C\C(=O)c1ccc(N2CCOC2=O)cc1 756789362 XEWFIGFOGPDNSN-LCYFTJDESA-N 399.446 5.215 30 20 GKED O=C1CSc2sc(C(=O)/C=C/c3c(Cl)oc4ccccc34)cc2N1 758027972 YHVCWEPJSBTCCF-AATRIKPKSA-N 375.858 5.088 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N3CC=C(c4ccc(C#N)cc4)CC3)sc21 767963249 ADXVXSYLFMTUEP-UHFFFAOYSA-N 397.503 5.194 30 20 GKED O=C(/C=C\c1nccc2ccccc12)c1ccc(OC[C@H]2CCCCO2)c(F)c1 771097865 KWVNRWXAJDYAMZ-ZBTAVZRMSA-N 391.442 5.218 30 20 GKED N#C[C@@H](COC(=O)c1cncc(-c2ccc(Cl)cc2)c1)Cc1cccs1 772735305 RJVIBKBKWDHLJK-AWEZNQCLSA-N 382.872 5.003 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNc2nnc(Cc3ccc(Cl)cc3)s2)c1 777758068 QASYEXFLRWBFSX-KRWDZBQOSA-N 398.919 5.075 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)ccc1OC 779407849 DADUBGHDCXFNRK-FGZHOGPDSA-N 394.490 5.241 30 20 GKED Cc1nc(-c2cccc(C(F)(F)F)c2)[nH]c1C(=O)OCC1(C#N)CCCCC1 780490553 XSWVRGXYIFILHG-UHFFFAOYSA-N 391.393 5.035 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1cnc(-c2ccc(Cl)cc2)s1 789033354 HROBCZQUTGEZTB-UHFFFAOYSA-N 382.794 5.895 30 20 GKED CC(=O)Nc1cccc(C(=O)/C=C/c2cnc(-c3ccc(Cl)cc3)s2)c1 789127018 JOTKPUVAPPNJRP-MDZDMXLPSA-N 382.872 5.318 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 791809283 CRNPMXTZFNSROW-UHFFFAOYSA-N 395.503 5.644 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c(C)c1 797568390 HZXBACCRFRTNBM-KRWDZBQOSA-N 396.556 5.595 30 20 GKED C[C@@H](Cc1ccccc1C(F)(F)F)N(C)Cc1ccc(O[C@H](C)C#N)cc1 809725077 IVLPJGKUEAWCMQ-JKSUJKDBSA-N 376.422 5.059 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2cc(C)ccc2s1 810529576 JTRAEJXWLFJADX-GOSISDBHSA-N 390.508 5.296 30 20 GKED N#C[C@@H](C(=O)c1ccccc1SC(F)(F)F)c1cc(C(F)(F)F)ccn1 813211162 FIBHDRYTWAAKNQ-LLVKDONJSA-N 390.308 5.202 30 20 GKED C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813217223 DHWFMOQRGDFEMF-GUYCJALGSA-N 390.405 5.042 30 20 GKED CC(C)c1ccc(Cc2noc([C@@H](CCCC#N)NC(=O)OC(C)(C)C)n2)cc1 818377707 IZXIXBOZEMYHSB-GOSISDBHSA-N 398.507 5.043 30 20 GKED C=C(C)[C@@H](NCc1ccc(OC(=O)CC)c(OCC)c1)c1ccc(F)c(F)c1 840938804 RRTUHCSPHMVSSQ-JOCHJYFZSA-N 389.442 5.086 30 20 GKED Cc1cc(NC(=O)C(C)(C)c2ccc(C#N)cc2)ccc1NC(=O)OC(C)(C)C 862234758 ZHMHKZIIBUMSKZ-UHFFFAOYSA-N 393.487 5.130 30 20 GKED C=CCCC[C@H](NCc1ccc(-c2cccc(Br)c2)s1)C(=O)O 900068192 AXPUWWYQQAEQCZ-INIZCTEOSA-N 394.334 5.077 30 20 GKED N#C[C@@]1(c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)CC2CCC1CC2 904505241 NFOLMTZCDRGXDQ-AWBPIWROSA-N 390.418 5.034 30 20 GKED Cc1ccc(SCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 917047527 ZIGMXOXAAKMREV-CQSZACIVSA-N 386.929 5.535 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776029692 NJKMMKNILCIUES-UHFFFAOYSA-N 389.238 5.788 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 1776049620 JWDOQJLWBBDHPO-UHFFFAOYSA-N 398.503 5.140 30 20 GKED O=C(O)c1ccc(NN=C(CCCc2ccccc2)c2ccccc2)cc1F 1776073271 LZJGVDWZYPLTKG-UHFFFAOYSA-N 376.431 5.363 30 20 GKED Cc1c(NN=Cc2ccc(-c3ccc(Br)cc3)o2)cccc1C(=O)O 1776086425 TWULWHLKNSNAAF-UHFFFAOYSA-N 399.244 5.162 30 20 GKED O=C(/C=C/c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccc(F)cc1F 1776125481 JUTFNQRUIFXBDY-FQTAANOTSA-N 394.373 5.066 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2cc(C(=O)O)c(C)cc2C)cc1 1776125961 XYRWXWLLECYWJH-KAMYIIQDSA-N 394.511 6.247 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3C(=O)O)cc2)c(F)c1 1776128020 MCSQIDDCAKVSKC-JYRVWZFOSA-N 376.383 5.096 30 20 GKED CC(C)(C#N)c1ncc(/C=C(\CCCC(=O)O)c2nc3ccccc3s2)s1 1776230675 YYTMSMYBOFDVIT-JLHYYAGUSA-N 397.525 5.349 30 20 GKED CCCCCCCCc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cc1 1776785807 BECLJIFCIJHRCA-QFIPXVFZSA-N 381.516 5.015 30 20 GKED CCCCCCCOc1ccc(CNc2cc(C(=O)O)ccc2OC(C)C)cc1 1776789034 LGHACDGCKQKTEM-UHFFFAOYSA-N 399.531 6.133 30 20 GKED CCCCCCCOc1ccc(CNc2ccc(SC)c(C(=O)O)c2)cc1 1776789219 WYDVFYBJLCZVOJ-UHFFFAOYSA-N 387.545 6.068 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c2ccccc12 1777360742 HLTJTXHZRCSNIQ-BENRWUELSA-N 398.414 5.703 30 20 GKED C=CCn1c(S[C@H](C)c2ccccc2Cl)nnc1-c1ccccc1OC 6077432 GXPJFAXSANYKGA-CQSZACIVSA-N 385.920 5.646 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2cc(C)c3ccccc3n2)cc1 23410277 RIAVQQKEAWCDNJ-GOSISDBHSA-N 389.524 5.279 30 20 GKED Cc1cc(Cl)ccc1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 32051089 VKLAQFYULWJNNV-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#C[C@H](C(=O)c1cn(Cc2ccccc2)c2ccccc12)c1nc2ccccc2o1 54735478 XFGPKTFPMGIATF-LJQANCHMSA-N 391.430 5.321 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)Nc2cc(C#N)ccc2OC(C)C)c(Cl)c1 63640823 NJADKWYWNKMJHC-HNNXBMFYSA-N 385.895 5.055 30 20 GKED C=CCN(C(=O)c1ccc(-c2cnco2)cc1)c1nc(-c2ccccc2)cs1 71940698 KDFHKMXOLDRYDL-UHFFFAOYSA-N 387.464 5.298 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cn1 115045513 PKFFXHPLKCPJKY-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccccc1Sc1ccccc1 120144433 LPAUSAPPGWOMJP-UHFFFAOYSA-N 378.428 5.132 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1C(F)(F)F)c1nc2cc(Cl)ccc2s1 161400896 BDBYUWFIIMXGJH-JTQLQIEISA-N 395.793 5.214 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C[C@@H](C)C1 161412955 HODDFJCEDGLULT-MOPGFXCFSA-N 391.515 5.232 30 20 GKED N#CCCCCNC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 171510064 ZFBIPABCCSJNPQ-UHFFFAOYSA-N 398.915 5.802 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc(-c4ccncc4)cs3)o2)cc1 174104782 IXUGTHCEFQPAMR-SFHVURJKSA-N 399.475 5.518 30 20 GKED C=C[C@@H](CC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 179363306 NDBWDSJHEDNZMN-HKUYNNGSSA-N 380.557 5.088 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nn(-c2ccccc2)c2c1CCC2 180589859 BOVIKOGZCPPCCF-QGZVFWFLSA-N 388.540 5.367 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Oc1ccc(CCC(C)=O)cc1 189882678 PMNHFAKRQRBRCQ-LJQANCHMSA-N 393.527 5.466 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(Nc2cccc(C)c2)CC1 191419784 SJGVJVCGIZTNRY-UHFFFAOYSA-N 391.559 5.955 30 20 GKED Cc1ccc(C)c(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303273742 IBVNLRPOQIRUBZ-INIZCTEOSA-N 384.570 5.427 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1ccc(OC2CCC2)c(F)c1 328867014 CBHDAFPAVXMFNW-ZDUSSCGKSA-N 390.480 5.052 30 20 GKED OC(=Nc1c[nH]nc1[C@H]1CCCN([C@H]2CCCc3ccccc32)C1)C1CCCC1 329314688 CMEHBRJYGZSHTC-UGKGYDQZSA-N 392.547 5.445 30 20 GKED O=C1CCCc2ccc(N=C(O)[C@H]3CCn4c(cnc4C4CCCCC4)C3)cc21 329418757 DTTZVBBRRNFBAM-SFHVURJKSA-N 391.515 5.300 30 20 GKED CC(C)c1ccccc1N=C(O)N1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1 329427317 HHUHKVVIDFAQHT-SFHVURJKSA-N 395.551 5.401 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 432755137 RQZUOKJKJKOHME-UHFFFAOYSA-N 391.393 5.511 30 20 GKED Cc1ccc(C#N)cc1NC(=O)CCSc1ccnc2cc(Cl)ccc12 433669546 KOOWZBARBRSNIS-UHFFFAOYSA-N 381.888 5.189 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3c[nH]c4cc(F)ccc34)c2)cc1 434620956 NMIHCYFNYAHJOS-UHFFFAOYSA-N 399.425 5.204 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(Nc2cccc(C)c2)CC1)c1ccccc1 435766409 XMGCLPNVRDXAOO-QHCPKHFHSA-N 377.532 5.288 30 20 GKED C[C@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cncc(F)c1 437042523 IJLOSFWVXXAZDN-ZUZCIYMTSA-N 380.307 5.584 30 20 GKED C[C@H](Oc1ccccc1NC(=O)NCc1cc(C#N)ccc1F)c1ccccc1 438501096 JYTPGWPGLCEYOU-INIZCTEOSA-N 389.430 5.159 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@H](CCC#N)c1ccccc1 438846457 JZYGSYPSUJVCNX-LJQANCHMSA-N 390.314 5.570 30 20 GKED C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438860116 QPUVXYNROWZRHA-CSODHUTKSA-N 383.923 5.518 30 20 GKED CCN(C(=O)NCC1CCC(C#N)CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 440990450 UZOLOCOITACYAB-FHERZECASA-N 381.442 5.128 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1cnc(C)s1)c1ccc(C(F)(F)F)cc1 441536341 ACBGFWPOBRTLEW-QGZVFWFLSA-N 397.466 5.319 30 20 GKED CC[C@H](NCc1cccc(C(=O)NCc2ccc(C)cc2)c1)c1ccc(C#N)cc1 447552616 UHXMEPMRKQVDCY-VWLOTQADSA-N 397.522 5.038 30 20 GKED Cc1sc(CNC(=O)[C@@H](C)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 461917089 JNGXLAOAHBRXOM-ZDUSSCGKSA-N 395.915 5.064 30 20 GKED C=CCC[C@H](NCc1cncc(C(F)(F)F)c1)c1ccc(C(F)(F)F)cc1 463144092 JXRSHLIDCSHOBA-KRWDZBQOSA-N 388.355 5.916 30 20 GKED C[C@@H](SCC(=O)Nc1ccc(CC#N)cc1)c1ccc(Cl)c(Cl)c1 463197141 OYMNGQPKWGOHCP-GFCCVEGCSA-N 379.312 5.492 30 20 GKED CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)CCCCOc2cccc(C#N)c2)o1 464885077 KLZNXZDUTAZYNF-XMSQKQJNSA-N 394.515 5.263 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 468316319 MWVAXXHWLQHPEF-QZTJIDSGSA-N 376.504 5.128 30 20 GKED CC(C)C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccs1 469212190 LZMWCKGSBLPZOS-IBGZPJMESA-N 381.545 5.530 30 20 GKED N#CCCCn1cc(C(=O)Nc2cccc(Oc3ccccn3)c2)c2ccccc21 469475512 ALTUWCQGCZULJZ-UHFFFAOYSA-N 396.450 5.385 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)CSc1nc(C)c(C)c(C)c1C#N 472675366 FQCYPYPNOHEDHQ-UHFFFAOYSA-N 395.572 5.685 30 20 GKED C[C@H](c1ccccc1Br)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1 474693310 IBAPNKVKMCEDOR-CQSZACIVSA-N 385.305 5.083 30 20 GKED CCOc1ccc(-c2csc(NC(=O)C[C@H](CC#N)c3ccccc3)n2)cc1 475773746 LOSCICZRYANIPV-SFHVURJKSA-N 391.496 5.235 30 20 GKED N#CC[C@H](CC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1)c1ccccc1 476147317 LULXBUKPCXCAMT-ILBGXUMGSA-N 380.491 5.400 30 20 GKED N#Cc1cc(NC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)ccc1F 481740446 KNRKZEGEKJYOFJ-SFHVURJKSA-N 391.368 5.475 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccnc1-c1ccc(Cl)s1)c1ccccc1 484212637 YBMUHERHOOZSON-HNNXBMFYSA-N 381.888 5.490 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)N[C@@H](CCCC#N)c1ccccc1 487596503 RXMGQRQJIMLCEG-IBGZPJMESA-N 393.487 5.423 30 20 GKED C[C@H](c1ccc(F)c(F)c1)[S@@](=O)Cc1cc(F)c(C(F)(F)F)cc1F 488802644 HIIDZSCXMWXKNH-NRYVIMAVSA-N 384.316 5.272 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(Cl)ccc2C(F)(F)F)c1 489709723 CMIGQRQVCOKAKW-UHFFFAOYSA-N 397.784 5.685 30 20 GKED C=CCC[C@H](C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 489749942 IJDSZVQDQMNVMI-GJZGRUSLSA-N 382.451 5.479 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 494371379 XCIBRHULBSQKOM-MJJDPTRDSA-N 379.451 5.217 30 20 GKED C[C@@H]1[C@H](c2ccccc2)c2ccccc2CCN1CCCC1(C#N)CCOCC1 499560378 FUXGYHOKSRYRDN-PXDATVDWSA-N 388.555 5.166 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(-c2ccc(Cl)cc2)on1 500323138 DWMMMUPMVDXJST-UHFFFAOYSA-N 393.874 5.165 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 508278555 LLDDHSZRVGIHGZ-SFHVURJKSA-N 379.460 5.156 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3sc4c(c3C#N)CC[C@H](C)C4)cs2)o1 515204876 VZFAZUNNKSJOHT-JTQLQIEISA-N 383.498 5.022 30 20 GKED C=CCOc1ccccc1-c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 515359982 PUHXQJNTGMYPEX-INIZCTEOSA-N 378.325 5.379 30 20 GKED CC(C)N(Cc1ccco1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518753678 XWCSXXCVBOFEEH-UHFFFAOYSA-N 375.428 5.386 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 521260299 AZWFGEQSSUKVNC-SJLPKXTDSA-N 381.545 5.780 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N(C)C[C@H](C)C#N)cc2)c1 523446113 LAPSGPFHJBFENI-GOSISDBHSA-N 379.504 5.321 30 20 GKED COc1ccc2oc([C@@H](C)Nc3nc(C(F)(F)F)ccc3C#N)c(C)c2c1 523756075 YWRRUJCAOLUXCD-LLVKDONJSA-N 375.350 5.208 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccs1 524492934 UHCRJPDYFDXLMV-GOSISDBHSA-N 394.927 5.973 30 20 GKED CO[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1ccccc1 535880861 WUILYUXDVYPZAQ-UNMCSNQZSA-N 390.870 5.322 30 20 GKED N#CCC1CCN(C(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)CC1 541048270 SPTOHDWBUZJHFT-UHFFFAOYSA-N 379.312 5.488 30 20 GKED CC(C)COc1ncc(C(=O)Nc2ccccc2SCCC#N)cc1Cl 542147559 BJFPODMCUSPUQB-UHFFFAOYSA-N 389.908 5.028 30 20 GKED CC(=O)c1ccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1Cl 543040580 UYRBNUYMSGKFPS-UHFFFAOYSA-N 383.879 5.104 30 20 GKED N#Cc1ccc(CN(C(=O)c2cncc(-c3ccc(Cl)cc3)c2)C2CC2)cc1 544166192 UXPJRICNINBDLJ-UHFFFAOYSA-N 387.870 5.078 30 20 GKED CCOc1ccccc1-c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 544976872 FZIHUPFABBCWFC-OUKQBFOZSA-N 384.439 5.174 30 20 GKED N#Cc1ccccc1COc1ccc(-c2nc([C@@H]3CCCCS3)no2)cc1 545102791 RDODMACNOMMLLJ-IBGZPJMESA-N 377.469 5.145 30 20 GKED C=C[C@@H](CC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1 546526441 IOZUNZRFUVEQCH-HNNXBMFYSA-N 385.389 5.190 30 20 GKED Cc1cc(NCC(=O)Nc2ccccc2SCC#N)ccc1-c1ccccc1 547248406 YAGSAHCSSVHROF-UHFFFAOYSA-N 387.508 5.328 30 20 GKED Cc1noc(C)c1C(C)(C)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 554446531 KPOHTTIKZVHJKV-UHFFFAOYSA-N 390.443 5.012 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)N(CCC#N)c2ccc(F)cc2)c1 557223608 YLJCHRKMJVDBDK-UHFFFAOYSA-N 388.442 5.452 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1 571636434 IPALKCURAAZAOJ-PXNSSMCTSA-N 392.524 5.086 30 20 GKED CC(C)CCc1nc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)cs1 572212474 HKZNGBDOTXPDRK-UHFFFAOYSA-N 378.501 5.403 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 576892016 AKLBWDFHDKKFJI-BEFAXECRSA-N 397.316 6.281 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cccc(OCc3csc(C)n3)c2)c1 589382072 ITGLAERSUWVGPB-UHFFFAOYSA-N 394.496 5.238 30 20 GKED C=CCOCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 591123046 XYDCAYRHZXOGBT-YJBOKZPZSA-N 394.902 5.059 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(F)cc2)n1)c1nc2cc(F)ccc2s1 592975840 VAEPOOXTHRKNKG-CYBMUJFWSA-N 397.431 5.188 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)CCc2ccc(F)cc21 593158409 VKTXRWPFNYVWBW-HZPDHXFCSA-N 397.519 5.414 30 20 GKED Cc1cccc(-c2nc3cc(F)ccc3n2C(C)C)c1NC(=O)CCCCC#N 593984463 PLCUQIFGHTZQLJ-UHFFFAOYSA-N 392.478 5.754 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3nc(-c4ccc(C#N)cc4)cs3)sc2n1 603834044 ZHCZQEJILJIAHM-UHFFFAOYSA-N 390.493 5.161 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ncc(-c4ccc(F)cc4)o3)c2)c1 604006956 FLBGRJVVXCWFIF-UHFFFAOYSA-N 399.425 5.543 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)NCc1cnc2ccccc2c1 604441808 FHZSGBBIWWFAFO-UHFFFAOYSA-N 395.487 5.188 30 20 GKED CCc1sc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)cc1C 609062046 UFRLNVAQROGGHU-UHFFFAOYSA-N 390.508 5.630 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208477 LTWAUVOYLYCMFV-UHFFFAOYSA-N 377.366 5.157 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H]3c3ccccc3)c2)c1 609659184 XMUDTZBPNHDKTI-DEOSSOPVSA-N 382.463 5.115 30 20 GKED Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)C1 609976287 DMDZMETUQROXJO-RXVVDRJESA-N 397.478 5.072 30 20 GKED CC[C@@H](CC(=O)N[C@H](C#N)c1ccc(Br)cc1)c1ccc(C)cc1 609986493 ZHEOWEWVUWGELF-HNAYVOBHSA-N 385.305 5.022 30 20 GKED N#Cc1ccc(SCC(=O)N2c3ccccc3CCc3ccccc32)c(F)c1 610164741 UVBTWHMGVKJENZ-UHFFFAOYSA-N 388.467 5.253 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(Cc2ccccc2)no1 610166728 XLCYWRGEINXQMY-INIZCTEOSA-N 398.491 5.447 30 20 GKED N#C[C@H](C(=O)c1cc2sc3ccccc3c2s1)c1ccc2ccccc2n1 613290722 KNJQDQONEOBRPX-HNNXBMFYSA-N 384.485 6.154 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3[nH]c(-c4ccccc4)nc3C)n2)cc1 613319063 NBGLDGBRRJUZQU-GOSISDBHSA-N 398.491 5.307 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1oc2ccc(F)cc2c1C 620089491 VSFFOBZGTBFNCW-UHFFFAOYSA-N 392.883 5.493 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(COCCc2ccccc2)c1 665866500 RASVANTZZQGEEM-ZRZAMGCNSA-N 376.500 5.161 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1F 675627443 IFROETWBDRVYNZ-HTQZYQBOSA-N 391.714 5.118 30 20 GKED Fc1cc(F)c2c(c1)[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)CC2 677129550 MRFXWVIXIYSOEF-HHFXWNNXSA-N 387.314 5.451 30 20 GKED Cc1c(Br)cccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726909752 XGFCMVAGOXKAND-UHFFFAOYSA-N 380.698 5.092 30 20 GKED COCCOc1ccc(/C=C\C(=O)c2sc(-c3ccc(F)cc3)nc2C)cc1 730464918 OLYMZXOTFWJNGF-XGICHPGQSA-N 397.471 5.179 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2ccc(O)c(Cl)c2)cc1 732306622 IPPYCUSVHDUZLJ-UHFFFAOYSA-N 382.778 5.101 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccc(Oc3ccnc4ccccc34)cc2)cc1 733288088 ZLDNUXIPYRGHLM-UHFFFAOYSA-N 397.434 5.260 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)c1cccs1)c1ccncc1 734683216 JQXDASMXUAFNCM-WIYYLYMNSA-N 391.540 5.733 30 20 GKED Cc1nc(SCc2cc(Cl)ccc2OCC#N)n(C2CCCCC2)c1C 735230760 PYEVVBPNRHGOCE-UHFFFAOYSA-N 389.952 5.853 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)[C@@H](C)c1ccccc1C(F)(F)F 744016772 SSGFRZUKKLLPAN-LRDDRELGSA-N 398.384 5.190 30 20 GKED CC[C@H](Oc1cccc(C)c1)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 750688498 DNYZDDCEGZDATQ-WBVHZDCISA-N 384.888 5.292 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(OC)c(OCCCC#N)c2)cc1 755607291 WSZLMXRCRYWKLC-WUXMJOGZSA-N 381.497 5.386 30 20 GKED CC1(C)CCC[C@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1 756530266 UNEYEYKMLGRRBF-AEFFLSMTSA-N 377.513 5.465 30 20 GKED CC(=NO[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1cc2ccccc2o1 758410937 OUQFIEWJUOWKDD-MRXNPFEDSA-N 375.428 5.601 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C1(c2cccc(Cl)c2)CCCCC1 760785978 KMAQTWDUVYMPJX-UHFFFAOYSA-N 386.854 5.222 30 20 GKED C=CC[C@@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccncc1 766018068 FTQFMWFPNDDCGP-MOPGFXCFSA-N 379.504 5.629 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2cccc(OCc3ccccc3)c2)cc1 766227349 ZZJJIWNZODHUSN-VQTJNVASSA-N 386.495 5.407 30 20 GKED COc1cc(C#N)ccc1NC(=O)c1ccccc1N=Nc1ccc(N(C)C)cc1 766648492 JWLPREQJGRIBGI-UHFFFAOYSA-N 399.454 5.301 30 20 GKED Cc1cc(Cl)cc2c1OCC/C(=C/c1cnc(-c3ccncc3)s1)C2=O 768498319 HNPGHBBHCXIDBW-ZROIWOOFSA-N 382.872 5.216 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCc3cccc(C(F)(F)F)c3)[nH]c12 770870445 LDOJSHCWYPCWLJ-INIZCTEOSA-N 385.389 5.089 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cc(Cl)cc(Cl)c2)ccc1OC 772985021 IMGULKASQVCGQP-SCLBCKFNSA-N 393.314 5.534 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 782788219 DFGXLGYFPQAEHW-UHFFFAOYSA-N 391.471 5.500 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)c1 790541792 BUOQXEBDXMXCLP-SFHVURJKSA-N 397.931 5.434 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 791752979 XJVLKSWFWSBMIY-ZMYBRWDISA-N 387.405 5.147 30 20 GKED CCNc1ccc(Cl)cc1C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 793123615 ZXACLBANUVYBED-CYBMUJFWSA-N 388.805 5.007 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCCOc2ccc(Cl)cc2)s1 797566374 IDCDDHWBJZNLEB-OAHLLOKOSA-N 376.909 5.129 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2nc(-c3ccccc3)cs2)C(=O)c2ccccc21 802706982 CGBBYAOVAMCFIN-AGWAZZAUSA-N 389.476 5.127 30 20 GKED Cc1c(-c2nc(-c3c(Cl)nc4sccn34)no2)sc2ccc(C#N)cc12 813892166 FLYCZNZSSOLJDO-UHFFFAOYSA-N 397.872 5.161 30 20 GKED CC(=O)c1cc(C(=O)OCCC(C#N)(c2ccccc2)c2ccccc2)cs1 815276724 GMKWYEVFICYAEJ-UHFFFAOYSA-N 389.476 5.007 30 20 GKED N#C[C@@H](C(=O)C1(C(F)(F)F)CCCCC1)c1nc2ccccc2n1C(F)F 850770092 XGAWQBAQQKJHIG-NSHDSACASA-N 385.336 5.120 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)[C@H](F)c1ccc(C(F)(F)F)cc1 857458191 RIWPSFFEUYAJMH-CQSZACIVSA-N 379.275 5.460 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2)cc1 915085314 KUJDFRTTZAIHKD-GOSISDBHSA-N 381.357 5.008 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCOC2CCCCC2)cc1 915352880 ORQUIBUKPFWBJY-QHCPKHFHSA-N 391.515 5.203 30 20 GKED C/C(C=Nn1cnc2sc(C)c(-c3ccccc3)c2c1=O)=C\c1ccccc1 916283600 JVAWLFGWTRSLOO-HHUWDJMLSA-N 385.492 5.371 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 918171439 XLYPVRAUSCSDBP-UHFFFAOYSA-N 384.451 5.001 30 20 GKED Cc1c(C(=O)O)oc2c1C(=O)/C(=C/c1csc(-c3ccc(Cl)cc3)n1)CC2 920067785 CVQCIEGQHBCADO-XYOKQWHBSA-N 399.855 5.276 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(NC(=O)OCC(C)C)c1 920233950 FMWFYIUUXMBMEC-UHFFFAOYSA-N 399.466 5.250 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccccc1Oc1ccc(F)cc1Cl 1776030599 VIRGRZPPCRPZGN-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(SC2CCCC2)cc1 1776033370 SJOKSDJRWZNRKQ-UHFFFAOYSA-N 388.920 5.909 30 20 GKED CCC(=NNc1cccc2c1CCCC2)c1ccc(OCCCCC(=O)O)cc1 1776036547 WZJWHNWCBJBWRG-UHFFFAOYSA-N 394.515 5.425 30 20 GKED O=C(/C=C\c1cccc(O[C@H](C(=O)O)c2ccccc2)c1)c1ccc(Cl)cc1 1776114793 BEXGIFXUIKWQFU-GUIXVQPWSA-N 392.838 5.441 30 20 GKED CCCCCCCOc1ccc(C(=O)/C=C\c2ccc(/C=C\C(=O)O)o2)cc1 1776125803 SWNVXTTVMRCBPK-VMNXYWKNSA-N 382.456 5.623 30 20 GKED C=C(Br)CN(Cc1ccc(Cl)cc1)[C@H](C)c1ccc(C(=O)O)o1 1776137019 NDAFAFMFWQGFFJ-GFCCVEGCSA-N 398.684 5.103 30 20 GKED C=CCN(Cc1ccc(Cl)cc1)[C@@H](C(=O)O)c1c(Cl)cccc1Cl 1776179969 SPARAHQGKXSKHT-QGZVFWFLSA-N 384.690 5.461 30 20 GKED CCCCCCCOc1ccc(/C=C/c2cc(C(=O)O)ncn2)cc1OCC 1776785849 AGSQRPIKZJXJPG-PKNBQFBNSA-N 384.476 5.093 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2cccc(C(=O)O)c2)cc1OC 1776788904 FNMFKOKBYDXKBW-BENRWUELSA-N 382.456 5.249 30 20 GKED Cc1cccc2c1CC/C(=C\c1cccc(O[C@@H](C(=O)O)c3ccccc3)c1)C2=O 1777457405 RZUBGIYAQPNOPQ-JIPFHLNWSA-N 398.458 5.412 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)cc1 1777472301 MQZGUGIQXOBCEC-NTUHNPAUSA-N 390.410 5.307 30 20 GKED O=C(/C=C/c1ccc(Cl)cc1[N+](=O)[O-])c1ccc(-c2ccc(C(=O)O)o2)cc1 1777570099 SLRPAGJBUAKAKU-SOFGYWHQSA-N 397.770 5.103 30 20 GKED O=C(O)c1cccc(C(=O)/C=C\c2ccc(Br)cc2C(F)(F)F)c1 1777686135 OELCJKYRIOXWFW-ALCCZGGFSA-N 399.162 5.062 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@H](c3ccccc3)C(C)C)cc2)CCC1 1786184545 ZZAWVHBFLWBAND-QHCPKHFHSA-N 390.527 5.136 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)cc2)CCC1 1789192851 ITHJCLFTGJKYGR-STZQEDGTSA-N 394.559 5.303 30 20 GKED C=CCn1c(SCc2cccc3cccnc23)nnc1-c1ccc(Cl)cc1 11389612 KPMNQCILBNKKLT-UHFFFAOYSA-N 392.915 5.625 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2ccccc2C(C)C)nc2ccccc21 27070143 DPTVZMUIILKPTJ-MRXNPFEDSA-N 379.529 5.465 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nnc1-c1ccco1 31654695 YRYZIOMVYVYLMY-UHFFFAOYSA-N 382.876 5.218 30 20 GKED Cc1cc([C@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)c(C)s1 60973851 VSBDFYTYPBHPFV-KRWDZBQOSA-N 376.525 5.666 30 20 GKED CCCN(CCC(=O)Nc1ccccc1C#N)[C@@H](C)c1cc2ccccc2o1 63559301 CDCFJEOAJNSZLQ-KRWDZBQOSA-N 375.472 5.106 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 64069935 RPFKYBIDSWBRGT-UHFFFAOYSA-N 395.871 5.086 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C\c3ccc(Cl)cc3)n2)cc1 66545037 KEWHOQHIPOFWOO-PRCIHIDRSA-N 389.867 5.225 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@H](c2ccccc2)O[C@H](C)C1 66954893 IWPOPUFMXTYWPT-FUHIMQAGSA-N 395.528 5.075 30 20 GKED CCN(CC)C(=O)Nc1ccc([C@@H](C)N[C@H](CCC#N)c2ccccc2)cc1 90665067 BHYQVSUGWAZLQY-XMSQKQJNSA-N 378.520 5.256 30 20 GKED Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)n1 108270492 OQQLCVORKWBUMY-FQEVSTJZSA-N 375.859 5.260 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CC1 108530090 KPAMGZBCXOVXGI-HNNXBMFYSA-N 383.492 5.274 30 20 GKED C[C@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1cccs1 152399902 XGMNZZBCMBJJOZ-INIZCTEOSA-N 376.481 5.135 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 152775762 OPLJTQFPGKOGDK-GOSISDBHSA-N 383.451 5.352 30 20 GKED CCc1cc[n+](/C(C(=O)c2cc(C)c(C)c(C)c2C)=C(/S)N[C@@H](C)CC)cc1 154488494 LEKCPJNMEDQPHX-INIZCTEOSA-O 397.608 5.097 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(F)c(Br)c1 173137473 TWDIXZPBSZUGDJ-NSHDSACASA-N 393.281 5.092 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(COc3ccccc3)cc2)n1 177756783 UOSBBQJBMSSIMD-LJQANCHMSA-N 376.481 5.336 30 20 GKED CC(C)(CCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1 179224491 RQGHHNYIGMQHOT-MRXNPFEDSA-N 381.426 5.366 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2ccc(F)cc2F)CCC1 180491717 CHUVYSWJADQOPJ-CQSZACIVSA-N 386.467 5.277 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2nnc(-c3ccccc3)s2)cc1 181309995 YVKAUQPIYROXFM-HNNXBMFYSA-N 385.920 5.187 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1ccccc1SCc1cccs1 182118225 NFVXYHBFDQTXCZ-HNNXBMFYSA-N 394.521 5.584 30 20 GKED COc1ccc(CN[C@@H](C)c2cc3ccccc3s2)cc1OCCCC#N 237288201 UEFAZHVQYWOSPR-INIZCTEOSA-N 380.513 5.443 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@]3(CC=CCC3)C2)c1 303622419 XEUOXTFBACCAIN-RUZDIDTESA-N 386.495 5.100 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@]4(CC=CCC4)C3)c2)cc1 303677434 JEWNWRNKHWRLGK-RUZDIDTESA-N 386.495 5.100 30 20 GKED OC(CN1CCC(/N=C(/O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1)=Nc1ccccc1 329009571 OEKHRUNIOARFTO-VLCRHTCISA-N 397.563 5.302 30 20 GKED Cc1[nH]c2ccccc2c1C/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329481931 DOLACQLCDVJPCY-NRFANRHFSA-N 376.504 5.365 30 20 GKED CC[C@](C)(/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1nccs1 329491576 VNKWAEBIANZXHA-KKSFZXQISA-N 386.565 5.232 30 20 GKED CC[C@H](/C(O)=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1)c1ccccc1 329690560 DAHBXGGHMTYLDL-RBUKOAKNSA-N 397.519 5.621 30 20 GKED CCN(CCC#N)C(=O)Nc1ccc(Oc2ccc(Br)cc2)cc1 429219763 ISHXPDLVBKNOLE-UHFFFAOYSA-N 388.265 5.009 30 20 GKED CSc1c(F)cccc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 436124189 AEYDCSXVZQLUDV-UHFFFAOYSA-N 378.428 5.464 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccccc3Oc3ccccc3)on2)c1 436325717 OGOMFFFLRDPICX-UHFFFAOYSA-N 381.391 5.258 30 20 GKED COC(=O)c1cccc(-c2nc(CSCc3cc(C#N)ccc3F)cs2)c1 437432879 MYXJLOMURPYUFO-UHFFFAOYSA-N 398.484 5.041 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(F)c(C(F)(F)F)c1 438078835 IIKHSHCPGVRXKW-CRAIPNDOSA-N 391.368 5.148 30 20 GKED CC(C)OC(=O)c1ccc(Cl)c(NC(=O)N[C@@H](CCC#N)c2ccccc2)c1 439391778 FRSGSVYVFCPZHL-SFHVURJKSA-N 399.878 5.072 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 439398875 SFNNJZIEYQFULM-LBPRGKRZSA-N 381.263 5.052 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C(F)F)CC1)c1ccc(C(F)(F)F)cc1 442292494 MSHXWHPKZMEJPB-INIZCTEOSA-N 390.396 5.399 30 20 GKED COc1ccc([C@H](NCC2CCC(C#N)CC2)c2ccccc2Cl)cc1OC 442871773 GRSKWNUTPZPRJB-OCJFHSIUSA-N 398.934 5.366 30 20 GKED CCC(CC)CN(CCC#N)CC(=O)Nc1c(Cl)cc(Cl)cc1Cl 444230775 ATMITDHNPVVFGJ-UHFFFAOYSA-N 390.742 5.237 30 20 GKED CC(C)(C#N)CCCCN[C@@H](c1ccc(F)c(F)c1)C(C)(C)N1CCCC1 444683889 JPKDTWKSLVGBQK-FQEVSTJZSA-N 377.523 5.190 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@@H]2c2cccc(Cl)c2)cc1 444857629 JINXBESGVBFSOO-HXUWFJFHSA-N 381.907 5.900 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)c1C 458795927 DJXUCAACQOQELK-GOTSBHOMSA-N 375.516 5.585 30 20 GKED C=CCOc1ccc(CNCc2ccc(-c3ccc(OC)cc3)cc2)cc1OC 462732421 ZNUCTFUJUCRBRT-UHFFFAOYSA-N 389.495 5.225 30 20 GKED N#Cc1cc(F)c(C(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)c(F)c1 462762528 MWVKMGJLZYCDJP-UHFFFAOYSA-N 395.236 5.163 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](CSc2ccccc2)C1 464324132 LXAZKWYVACJIJI-IBGZPJMESA-N 398.531 5.480 30 20 GKED N#Cc1ccc(NC(=O)c2c(F)cccc2Sc2ccccc2)c(Cl)c1 464397213 HNCFPPWMGKUAFA-UHFFFAOYSA-N 382.847 5.754 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3CCCC[C@H]3C(F)(F)F)cc2)ccn1 464667953 KVUATOAXYVPPTM-ZWKOTPCHSA-N 389.377 5.053 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1Cc1ncc(-c2cccc(Cl)c2)o1 464821731 JORUSVHSOSQAPS-UXHICEINSA-N 377.875 5.267 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 466227629 SASCVOTXNVVQCH-OAHLLOKOSA-N 377.315 5.520 30 20 GKED N#CC[C@@H](CC(=O)N1CCc2sccc2[C@H]1c1cccs1)c1ccccc1 474394555 ZCAXQKYGDFCCFT-JTSKRJEESA-N 392.549 5.371 30 20 GKED C=CCCC1(C(=O)NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)CC1 474949194 UBPYYFDBQILLTA-UHFFFAOYSA-N 377.488 5.002 30 20 GKED Cc1cccc(CN(Cc2ccccn2)C(=O)c2ccc(C(C)(C)C#N)cc2)c1 475610672 VXCYKOXAEGJGHV-UHFFFAOYSA-N 383.495 5.034 30 20 GKED COc1ccc(-c2csc(NC(=O)c3ccc(C(C)(C)C#N)cc3)n2)cc1F 475777019 INZTYONRDZRJSM-UHFFFAOYSA-N 395.459 5.011 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccccc3NCCCc3ccccc3)cc2)CC1 480807611 AUKJYVCFSIKSMY-UHFFFAOYSA-N 395.506 5.539 30 20 GKED N#C[C@H](C(=O)c1cc2[nH]ccc2s1)c1nc(-c2ccc(Cl)cc2)cs1 483460767 LPTNXJKYGZHKIS-GFCCVEGCSA-N 383.885 5.496 30 20 GKED C=CCC[C@@H](NC(=O)c1sccc1COC)c1ccc(C(F)(F)F)cc1 485479792 JOJBGOGHGSGQDZ-MRXNPFEDSA-N 383.435 5.351 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccc(Cl)c(Cl)c1 486436857 UGSAJUCZECWPKX-BREBYQMCSA-N 385.703 5.193 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(NCCc3ccccc3)cc2)c1 497035287 UTYHJSSEVMPFAG-UHFFFAOYSA-N 375.859 5.119 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@@](C)(C#N)CC(=O)OC(C)(C)C)c(C)c1 503055189 OKHMPSGVKFSGQA-YCRPNKLZSA-N 390.549 5.086 30 20 GKED CCCCOc1cccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 503470117 MBDROWQQHDDNNW-UHFFFAOYSA-N 375.472 5.058 30 20 GKED N#C[C@@H](NC(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1ccc(F)cc1 504980072 TVXWCORWORUDKK-OAQYLSRUSA-N 394.833 5.053 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H]1CCCc2occc21 510715148 IJEKKNCRQOQCCH-NRFANRHFSA-N 387.439 5.451 30 20 GKED C[C@@H]1CCCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 512549387 QCJCGRPBAMJYLD-MRXNPFEDSA-N 381.451 5.073 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N(C[C@@H](C)C#N)C3CC3)cc2)cc1 513660410 LOBJGGIWHJZVAL-INIZCTEOSA-N 379.460 5.034 30 20 GKED COc1cc(F)c(F)cc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 516357041 OIIISHPVPGYMEI-UHFFFAOYSA-N 398.340 5.029 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 522027033 MJMSIRFHJCRFBT-HOYKHHGWSA-N 396.494 5.228 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1nc2ccsc2s1 522729144 LOVMBYTZPXSPJT-UHFFFAOYSA-N 393.518 5.633 30 20 GKED CCN(Cc1ccccc1Cl)C(=O)c1occc1COc1cccc(C#N)c1 523945904 WZVPDJZKIGOULF-UHFFFAOYSA-N 394.858 5.046 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)S1 525739463 YSWZIDRCKBWWDS-SPYBWZPUSA-N 399.947 5.353 30 20 GKED Cc1ccc([C@H](C)N(C)CC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 532931179 VGCYBKIMQBELLI-MOPGFXCFSA-N 395.572 5.329 30 20 GKED Cc1cccc(C(=O)N[C@H](C#N)c2ccc(OCc3ccccc3)cc2)c1Cl 533650768 GBMCPGKAZSWBEJ-OAQYLSRUSA-N 390.870 5.222 30 20 GKED C[C@@H](N[C@@H]1CCc2c(Br)cc(Cl)cc21)c1ccc(C#N)cc1 534793385 NALMCTRODRXHMI-ADLMAVQZSA-N 375.697 5.312 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3cc(C(C)(C)C)sc3C#N)cc12 538073664 IQWMBOIWRYNIHD-UHFFFAOYSA-N 386.546 5.241 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@H](c3ccc(Cl)cc3)C3CCCC3)o2)c1 538204746 LNDMWZOVLSXWLA-NRFANRHFSA-N 392.890 5.283 30 20 GKED CCc1nc(C)c(NC(=O)c2ccccc2Sc2ccccc2C#N)s1 547969466 WCYKBSOTDCDTKE-UHFFFAOYSA-N 379.510 5.289 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)Nc2cccc(C#Cc3ccccn3)c2)cc1 554886080 HCPSGBAACBDYKS-IBGZPJMESA-N 396.490 5.062 30 20 GKED Cc1cc(CN[C@@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)ccc1C#N 556407545 LFIJBSCENKFHJR-OAQYLSRUSA-N 388.433 5.143 30 20 GKED C[C@@H]1Cc2sc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c(C#N)c2[C@H](C)C1 569685837 XCMOZOFOKGBFIX-ZENOOKHLSA-N 378.497 5.004 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3[nH]2)sc1-c1ccc(F)cc1 588348209 DUNBZFZRIZUDFV-OAHLLOKOSA-N 375.428 5.229 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)N[C@@H](CCCC#N)c2ccccc2)s1 590477831 BQIRUUIYIONJCV-KRWDZBQOSA-N 395.553 5.274 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3ccccc3SCCC#N)o2)cc1 594542872 OZVVJYHEBGMNQH-UHFFFAOYSA-N 390.464 5.407 30 20 GKED N#CCc1cccc2c1CCN(C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)C2 599703113 YGCIIGRSEHDZOV-UHFFFAOYSA-N 393.796 5.015 30 20 GKED CC(C)c1cc(Cl)ccc1NC(=O)NC1(c2cccc(C#N)c2)CCOCC1 599883606 RTHXMFPSTZLSNF-UHFFFAOYSA-N 397.906 5.162 30 20 GKED Cc1ccnc2sc(C(=O)N(Cc3ccco3)c3ccccc3C#N)c(C)c12 603569353 KQAXCQFYEJNSKR-UHFFFAOYSA-N 387.464 5.225 30 20 GKED CCC[C@@H](C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 603995480 GLOMZOAFYVDYEO-HSZRJFAPSA-N 397.478 5.333 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1 608896067 KQROSTGGCUJSOW-LBPRGKRZSA-N 393.270 5.058 30 20 GKED COc1ccsc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 609262174 QEDWKBIVXYYLJI-MRXNPFEDSA-N 382.872 5.318 30 20 GKED CC(C)c1csc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)n1 609296952 MZCQLSJVDGVLSO-UHFFFAOYSA-N 381.432 5.322 30 20 GKED Cc1ccc(CN(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)s1 609298390 COJTYKZFBCGEDZ-UHFFFAOYSA-N 380.444 5.132 30 20 GKED C[C@H](NC(=O)CS[C@H](C)c1ccc(C#N)cc1)c1ccc(Cl)cc1Cl 609825863 XSUJKAWZXDAWHP-QWHCGFSZSA-N 393.339 5.537 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CC/C=C/c1ccccc1 609970198 ORADHXVJYAVLAG-BJMVGYQFSA-N 396.490 5.878 30 20 GKED N#Cc1cc(CNc2ccc(Oc3ccc(Br)cc3)cc2)ccn1 610955830 CABYWOAWZGPHTD-UHFFFAOYSA-N 380.245 5.120 30 20 GKED COc1cc(Cl)c(Cl)cc1C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 674299648 RUBQFQLKBXNMRE-SNVBAGLBSA-N 395.242 5.241 30 20 GKED CN(CCc1cccc2ccccc12)C(=S)Nc1ccc(C#N)c(Cl)c1 726489980 SNSOYFXBSVUEOK-UHFFFAOYSA-N 379.916 5.236 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1ccc(SC(C)(C)C)cc1 726757203 JAZCRFYIWCQGPK-UHFFFAOYSA-N 379.485 5.393 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 728287520 FGOVCWRUTAQKTE-TVYUQYBPSA-N 393.293 5.829 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccc(Oc3ccccc3)cc2)c1 733771691 RHRPRCSXHSCBSX-HXUWFJFHSA-N 386.451 5.090 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc3c(c2)Cc2ccccc2-3)c1 733842164 QJJZBWLYWUQNGU-OAQYLSRUSA-N 397.478 5.260 30 20 GKED C[C@@H](CNC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(C)(C)C 734648855 VGOFSBZLVWAZML-KRWDZBQOSA-N 379.504 5.135 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1oc2ccccc2c1C)C(C)C)c1ccncc1 734668520 IPHGKSGSDXBWNY-TZIWHRDSSA-N 377.488 5.450 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 739143931 TYTYRWMVEMBISE-KSSFIOAISA-N 382.385 5.309 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@@H]1c1cccc2ccccc12 739838902 BIQXWOFHUGAWAQ-XMMPIXPASA-N 393.494 5.073 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(Br)cn2)cc1 741463415 FZZDHGYTYIRNNL-UHFFFAOYSA-N 396.288 5.356 30 20 GKED N#Cc1ccc(F)c(CNCc2cccc(OCc3ccccc3Cl)c2)c1 742383945 VRROJDKIWIZRSD-UHFFFAOYSA-N 380.850 5.220 30 20 GKED N#Cc1ccc(F)c(CNC(=O)c2sc3cccc(Cl)c3c2Cl)c1 742732772 DBAAYUDJMDILQX-UHFFFAOYSA-N 379.243 5.149 30 20 GKED CCCN(CC)c1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 744117647 ALTGIVZUINLEGG-KRWDZBQOSA-N 381.476 5.162 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 747106601 WOFJPVMKOMVKAD-ZDUSSCGKSA-N 378.375 5.026 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(CC)s2)cc(Br)c1O 747202184 HYBJMANHJSPYEJ-ALCCZGGFSA-N 381.291 5.073 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(SC)c(OC)c2)cc(Cl)c1O 747615352 VWYYHLGXCTUECZ-ALCCZGGFSA-N 378.877 5.071 30 20 GKED N#C[C@@H](C(=O)[C@@H]1[C@H]2CCCC[C@H]21)c1nc(-c2ccc(Cl)cc2Cl)cs1 751151628 IZKOOPFYJIRPKM-GMIGKAJZSA-N 391.323 5.729 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c(Cl)c1 752755713 XKCCAQIDEQKDNA-CQSZACIVSA-N 393.796 5.252 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 759184026 OUIJRQKSONABQA-LVWOJMJRSA-N 376.843 5.125 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)cc2s1 761533308 KMBJLGZWOVQICD-HXUWFJFHSA-N 383.476 5.513 30 20 GKED C[C@H](C=Nn1cnnc1SCc1ccc(Cl)cc1)c1cccc(Cl)c1 763359646 QYAPEHREDGDGPB-CYBMUJFWSA-N 391.327 5.515 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(CC[C@@H](O)c3ccccc3)cc2)cc1 770559795 PHUKBLLBXKNVRQ-KBMIEXCESA-N 386.495 5.256 30 20 GKED C=CCn1c(SCc2cc(Cl)nc3ccccc23)nnc1-c1ccco1 771751955 ZCLSEXRVBGAUEU-UHFFFAOYSA-N 382.876 5.218 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)cc1 772591525 ATRDDSPMEPFUBA-VXKWHMMOSA-N 390.870 5.058 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(N(C)C)cc1 775363172 LCIOLDDIAAAUOK-IBGZPJMESA-N 385.511 5.054 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(Cl)cc1)c1ccc(OCC#N)cc1 776158386 WRLQCCRBWOGJKH-QGZVFWFLSA-N 376.887 5.760 30 20 GKED N#CCc1ccccc1CC(=O)Nc1ccc(-c2cccc(C(F)(F)F)c2)cn1 777049430 RGZQVTFFOJCAIR-UHFFFAOYSA-N 395.384 5.015 30 20 GKED C=CCC[C@@H](C(=O)OCc1ccccc1NC(=O)c1ccco1)c1ccccc1 778654219 IYDJTEYWWDLNSX-HXUWFJFHSA-N 389.451 5.325 30 20 GKED N#CCC[C@H](NC(=O)Nc1cc(F)c(N2CCCCC2)c(F)c1)c1ccccc1 779141528 OCRXNIBCKZIKRC-FQEVSTJZSA-N 398.457 5.122 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCCCc1ccc(Cl)c(Cl)c1 780152976 VDSHPNLHIKAFTH-CQSZACIVSA-N 391.298 5.636 30 20 GKED C/C=C\C(=O)N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 783557731 HXHGGOUXBHFVBZ-QUCGXOGASA-N 379.222 5.020 30 20 GKED COC[C@H](C)[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 813060478 ASPOQYPTCVHNDP-WDMOLILDSA-N 397.327 5.212 30 20 GKED N#C[C@@H](C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1nc2ccccc2s1 819935399 ATRUIQOMXQKHDU-QCJMZQNMSA-N 378.419 5.087 30 20 GKED CC1(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CCOCC1 835067897 KTMVKUZIWLZAPK-MWWKQMNYSA-N 386.904 5.013 30 20 GKED COCc1c(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)sc2cccc(F)c12 842940087 XAEZHMTYLHLWGE-LLVKDONJSA-N 386.473 5.011 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C1(c2ccc(C(F)(F)F)cc2)CCC1 846958509 UBNOEZHODHFEJP-AWEZNQCLSA-N 388.389 5.057 30 20 GKED CO[C@@H]1CC[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)C1 850765146 UFJGPKUMTPTZEK-MPKXVKKWSA-N 395.311 5.108 30 20 GKED C[C@H](OC(=O)CC1(C#N)CCCCC1)c1ccccc1NC(=O)c1ccccc1 850800617 HHIGFFWSPHXYMM-SFHVURJKSA-N 390.483 5.407 30 20 GKED COc1cc2ccc(NCc3cc(C#N)ccc3Br)cc2cc1OC 864032890 WXGMWEHWLRMMPX-UHFFFAOYSA-N 397.272 5.103 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2ccc(NC(C)=O)cc2C1 879351647 AAHLZVZPOVQFIT-UHFFFAOYSA-N 391.515 5.087 30 20 GKED CC(C)Cc1ccc(CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917040572 MSRVQNXXVZNOSL-QGZVFWFLSA-N 381.426 5.049 30 20 GKED CC[C@H](NN=Cc1c(-c2ccccc2)n(-c2ccccc2)c2ccccc12)C(=O)O 1776065771 WAPVBBNTRPKGFW-QFIPXVFZSA-N 397.478 5.084 30 20 GKED C=C(Cl)C[C@H](NCc1ccc(Oc2ccc(F)c(C)c2)cc1Cl)C(=O)O 1776143164 UOBMSJKDTXBJRG-SFHVURJKSA-N 398.261 5.265 30 20 GKED CCCCCCCOc1cccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)c1 1776788969 HOBNZMMUOLKDCI-UWUFYVNFSA-N 392.495 5.874 30 20 GKED Cc1cc(COc2ccc(/C=C3/CCc4ccsc4C3=O)cc2)oc1C(=O)O 1777423229 LFDYATFXCUAFJA-WJDWOHSUSA-N 394.448 5.139 30 20 GKED Cc1c(C(=O)Nc2ccc(C#N)c(Cl)c2)oc2ccc(Br)cc12 6201121 COEWFOKTPLQGBT-UHFFFAOYSA-N 389.636 5.281 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)oc2c(Cl)cccc12 14496983 WDIJTQXMWLZBLY-UHFFFAOYSA-N 393.855 5.642 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(-c3nc4ccccc4s3)s2)n1 41519752 ZGIBMBJYYHBKGY-NSHDSACASA-N 381.507 5.280 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2ccc(C)s2)cs1 54897646 CTDRKOUOPFBHIR-JXMROGBWSA-N 382.510 5.402 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C(F)(F)F)c3)n2)cc1 60477246 KJCQVPGKAFGRBT-INIZCTEOSA-N 386.398 5.627 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)c(Cl)cc1Cl 66800977 SABDBFRHRMATLZ-SNVBAGLBSA-N 383.275 5.779 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCCN(C)c1ccccc1 66955984 HQBFPIABNLPPJE-SFHVURJKSA-N 396.560 5.119 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12 78668432 DHONFZJQJXQHCD-UHFFFAOYSA-N 399.475 5.753 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Br)cs1 108239454 QNOFUQLEHGNLHG-JTQLQIEISA-N 381.320 5.015 30 20 GKED Cc1[nH]c2ccccc2c1CCNC(=O)Nc1ccccc1SC[C@@H](C)C#N 108531909 ZISKOSZGJQZHRG-HNNXBMFYSA-N 392.528 5.092 30 20 GKED N#CCCCOc1cccc(NC(=O)c2occc2CSc2ccccc2)c1 121053535 PSECTYNPOXLKAT-UHFFFAOYSA-N 392.480 5.507 30 20 GKED C=C[C@@H](CC(=O)NCc1nc(C)c(-c2ccc(Cl)cc2)o1)c1ccccc1 124914348 CTSOJPOSHQHDLK-INIZCTEOSA-N 380.875 5.280 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(F)cc2Cl)cc1OCCCC#N 130334215 SPNWVINVUKNVPW-CQSZACIVSA-N 376.859 5.021 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cccc(CN2CCCCC2=O)c1)c1ccccc1 155507002 IRJRVHBUBXMDNU-JOCHJYFZSA-N 391.515 5.028 30 20 GKED C=C[C@@H](CC(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1)c1ccccc1 158401616 YOGNYEZZIUSOJJ-KRWDZBQOSA-N 381.903 5.121 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3ccccc3O[C@H](C)C#N)c(F)c2)cc1 182073524 UXNHVNJGPQGXQX-OAHLLOKOSA-N 390.414 5.044 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1F 182142664 YZMCSXPQYYEIHB-HNNXBMFYSA-N 392.405 5.483 30 20 GKED Cc1ccsc1-c1nnc(SCc2ccc(C#N)cc2Br)o1 182337079 ZRTTWLJIIHPUOA-UHFFFAOYSA-N 392.303 5.033 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](c2cccc(F)c2F)C(F)(F)F)cc1 183379768 XQZIBTWSBZXLCV-INIZCTEOSA-N 397.347 5.191 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)cc1 208271849 LJIIYIYWQIMDQH-XVCALJJASA-N 377.440 5.741 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C)C[C@@H]1c1ccco1 248569811 QILVJKZGZUNCPZ-JFIYKMOQSA-N 383.517 5.536 30 20 GKED Cc1ccc2cc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3C)[nH]c2c1 303203531 OUYDMAQNWHXMSM-UHFFFAOYSA-N 395.462 5.488 30 20 GKED C[C@@H](c1ccco1)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CC1 303588786 GZEGHRVWSMFFME-KRWDZBQOSA-N 386.451 5.096 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1Cl 303834713 PFZMJJVKBCUZHS-MGPQQGTHSA-N 388.895 5.473 30 20 GKED O=C1CC[C@@H](C(O)=Nc2ccc3nc(N4CCCC4)sc3c2)c2ccccc21 328826374 SDYLSMYUYNLXLP-QGZVFWFLSA-N 391.496 5.245 30 20 GKED CC1(C)C(O)=Nc2cc(C(O)=Nc3ccccc3N3C[C@H]4CC[C@H]3C4)ccc21 329042301 DTGIFTCQOLTENY-HOCLYGCPSA-N 375.472 5.191 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cc(Cl)ccc1N1CCCCC1 429210701 UKXZLCUNOUCISW-UHFFFAOYSA-N 376.932 5.124 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)c1 438282643 LHEZZGDKTCUYOY-NRFANRHFSA-N 394.906 5.236 30 20 GKED CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)N[C@@H](CCC#N)c1ccccc1 438846454 JZYGSYPSUJVCNX-IBGZPJMESA-N 390.314 5.570 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c(C)c1 439359552 PAYQZKLQGSSBMA-LAUBAEHRSA-N 381.545 6.052 30 20 GKED C=CCC[C@H](NC(=O)CSc1ccncc1)c1ccc(C(F)(F)F)cc1 441581656 NOVSONTZTDMYLL-KRWDZBQOSA-N 380.435 5.016 30 20 GKED CC(C)(C)Oc1cc(F)ccc1NC(=O)c1cn(CCCC#N)c2ccccc12 444348022 ZNAURAQPVYBIRQ-UHFFFAOYSA-N 393.462 5.514 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)N[C@H](C#N)c2cccc(C(F)(F)F)c2)c1C 446010575 JZQCXYWNRYTBMB-GOSISDBHSA-N 398.384 5.577 30 20 GKED CCCN(C(=O)N[C@@H](CCCC#N)c1ccccc1)[C@H]1CCCc2cccnc21 458849954 TXRBCUMDMXLUFI-VXKWHMMOSA-N 390.531 5.316 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)[C@H](C)c1cccc(C#N)c1 462022864 HOONRIWKCXRING-KGLIPLIRSA-N 393.487 5.110 30 20 GKED C[C@@H]1C[C@H](Nc2ccc(Oc3ccnc(C#N)c3)cc2)CCN1Cc1ccccc1 463255328 KXTOCTMPUWVLHQ-DENIHFKCSA-N 398.510 5.211 30 20 GKED C[C@@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)NCCCCC#N 465892857 PBSBTTQMLYCFNR-INIZCTEOSA-N 389.952 5.238 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1 471274476 WTCLURDFVOOXLW-UHFFFAOYSA-N 393.531 5.590 30 20 GKED COc1ccc(Br)cc1CNc1ccccc1SC[C@H](C)C#N 474435798 UBUBLAIJNLDSQO-CYBMUJFWSA-N 391.334 5.322 30 20 GKED C=CCN(C(=O)[C@H]1CCSC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 475428442 KNLRJNLRTIFQEO-LBPRGKRZSA-N 399.368 5.389 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](c2c[nH]c3ccccc23)C(F)(F)F)c(Cl)c1 478051009 UGFBMQHXOYVUGP-INIZCTEOSA-N 392.768 5.118 30 20 GKED C[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)c1ccc(C#N)cc1 480208985 XZXCOXOAQNMTSR-MUEKUWCCSA-N 396.490 5.118 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3-c3cccs3)c2)cc1 481974971 PNBSYQHWAMTVPT-UHFFFAOYSA-N 396.471 6.331 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(CCC#N)CC(C)(C)C)cc1 494310102 QYTLFZTVYLQCDQ-UHFFFAOYSA-N 375.472 5.061 30 20 GKED C[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1nc(C(F)(F)F)cs1 494371392 XCIBRHULBSQKOM-UQHVZDHRSA-N 379.451 5.217 30 20 GKED C=C(C)CN(CC)C(=O)[C@H](C)SCc1cc(-c2ccc(Cl)cc2)no1 497870514 WBLWSJRVFWLQNY-AWEZNQCLSA-N 378.925 5.041 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(Cc4ccc(Cl)cc4)no3)cc2)nc1 504833760 ONBMGRRFOKCRPA-UHFFFAOYSA-N 388.814 5.040 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1ccnc(Oc2ccccc2F)c1 505030091 SJFXKOOKFVMIOL-UHFFFAOYSA-N 391.446 5.453 30 20 GKED Fc1ccc(-c2noc(-c3ncsc3C(F)(F)F)n2)c(C(F)(F)F)c1 508054013 LQHBJMWYGJNKOJ-UHFFFAOYSA-N 383.248 5.037 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1coc(-c2cccc(Cl)c2)n1 512525909 BEOJBFZGLXQBKF-UHFFFAOYSA-N 384.911 5.351 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 513455922 VDMATZKRQFSFMO-QGZVFWFLSA-N 381.545 5.032 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 517125602 RYEQJVQYYWRAKD-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCCCCOc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 519515819 XTNFGIYNXFJAAX-KRWDZBQOSA-N 382.529 5.902 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)c1 520473716 NYJLUSPCQDWCCT-FQEVSTJZSA-N 382.460 5.363 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 521748490 FYYPJXADQCGLSE-OAHLLOKOSA-N 387.936 5.646 30 20 GKED CSc1cccc(N(C)C(=O)c2cccc(COc3cccc(C#N)c3)c2)c1 522391900 ZYOFCNBFXQEDMP-UHFFFAOYSA-N 388.492 5.136 30 20 GKED Cc1ccc(F)cc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524387825 ZTDUEZRXUNKXLP-UHFFFAOYSA-N 394.833 5.491 30 20 GKED C=CCN(C(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1nc(-c2ccccc2)cs1 525006071 DABZERVNYXJBSP-IRXDYDNUSA-N 396.462 5.411 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C3(C)CCC(F)(F)CC3)n2)cc1 528935111 PZXAVLGYICYBIH-OAHLLOKOSA-N 390.455 5.211 30 20 GKED Cc1nnc(-c2cc(F)ccc2NC2CCC(C#N)(c3ccccc3)CC2)o1 530278726 SSSATIVKGYYFGV-UHFFFAOYSA-N 376.435 5.000 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(C(=O)N2CCC[C@@H](C)C2)cc1C)c1ccccc1 535366682 CADXKVNTYSNCCZ-QUCCMNQESA-N 390.527 5.166 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)ccc1Sc1ccc(Cl)cc1)C1CC1 538253296 VYWFXPGBFNZSRN-MRXNPFEDSA-N 377.296 5.177 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1)C(=O)Nc1ccccc1C#N 539853430 DPPIGJYETODMIZ-SJORKVTESA-N 387.458 5.042 30 20 GKED C[C@@H](NCC(=O)Nc1ccccc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 541089395 VTXSSKNWZGJYQY-MRXNPFEDSA-N 389.886 5.168 30 20 GKED N#Cc1ccc(CN(Cc2nnc(-c3c(Cl)cccc3Cl)o2)C2CC2)cc1 541314903 QMBSIQOTVBAJRC-UHFFFAOYSA-N 399.281 5.080 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(F)c(OC(C)C)c(F)c1 542393623 GCPNJWPKGIQEHE-UHFFFAOYSA-N 387.430 5.068 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)[C@H]3CCC(=O)c4ccccc43)c2C#N)[C@H](C)C1 562699422 WYVYLEFGHWHASP-ZENOOKHLSA-N 378.497 5.004 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc(C#N)c([N+](=O)[O-])c1 579173689 FBWYDWAXYMUYFR-NSHDSACASA-N 382.420 5.211 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3nccc4ccccc34)c12 583475429 MGUJQKKFXZUCNQ-GOSISDBHSA-N 396.450 5.262 30 20 GKED C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)Nc1ccc(F)cc1C(F)(F)F 590253453 NQVNTEVHAKFWBP-SECBINFHSA-N 395.274 5.269 30 20 GKED Cc1ccc(C(C)(C)c2noc(-c3cn(CCCC#N)c4ccccc34)n2)nc1 596620742 SBSLQSZYNBREDG-UHFFFAOYSA-N 385.471 5.024 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(Cl)sc1Cl 603968427 QLCXDMHLISCYSQ-UHFFFAOYSA-N 379.293 5.907 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 609073333 BRJPXYSOBHVBSV-UHFFFAOYSA-N 381.435 5.179 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@H](C)c2ccccc2F)cc1 609426370 VCIWBSPRRAWZRS-OAHLLOKOSA-N 390.414 5.240 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 609572979 IFGLJUYUOIHSAB-UHFFFAOYSA-N 386.455 5.188 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)C(c1ccccc1)c1ccccc1 610400919 SNFKLAOOHDNHSK-MOPGFXCFSA-N 383.495 5.139 30 20 GKED CC[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1nccn1C 647323377 DYPPVIMZBZLMTM-GFCCVEGCSA-N 383.311 5.273 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1sc(C)nc1-c1cccs1 682803600 FVQXCXMQQLQKHN-UHFFFAOYSA-N 396.581 6.213 30 20 GKED COc1ccc2c(-c3ccccc3)cc(=S)n(CN(C)[C@H](C)CC#N)c2c1 728902408 OXUDYTOLMFCDRF-MRXNPFEDSA-N 377.513 5.238 30 20 GKED CCC(CC)CN(CCC#N)Cn1nc(NC2CCCCC2)sc1=S 729470866 JKHFDSALAIRAOJ-UHFFFAOYSA-N 381.615 5.028 30 20 GKED C#CCOc1ccc(NC(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)cc1 731113801 RWMSAMRFEFSEPG-SFHVURJKSA-N 390.508 5.555 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)C(CC)(CC)c2ccc(Cl)cc2)c1 733771849 WDEIIVJPWFAYNJ-HXUWFJFHSA-N 398.934 5.395 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](Cc1ccccc1)c1sccc1C)c1ccncc1 737048540 VYGYPONBLXWDKM-RTWAWAEBSA-N 391.540 5.352 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC3(CCCC3)C2)c1 742878228 XSJURJWMIMAITB-UHFFFAOYSA-N 380.875 5.410 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(C(F)(F)F)c(C)c2)c1 743222818 ROHNOPZHVOXNSO-MRXNPFEDSA-N 391.393 5.017 30 20 GKED CN(Cc1cc2ccccc2o1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 746718136 NEYQKALGRCEKJJ-HSZRJFAPSA-N 395.462 5.752 30 20 GKED COc1cc(C2(C(=O)[C@H](C#N)c3nc(C(C)C)cs3)CCCC2)ccc1C 747198710 KKOGWWBJANXPSB-KRWDZBQOSA-N 382.529 5.272 30 20 GKED C[C@@H]1CN(c2ccc(N=Cc3cc(Cl)cc(Cl)c3O)cc2)C[C@@H](C)O1 747361973 GUIAGRVHZVYATE-CHWSQXEVSA-N 379.287 5.063 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)c2ccccc2OCC#N)cc1 752474813 WBXPTXOEPQSYDZ-KRWDZBQOSA-N 388.492 5.695 30 20 GKED N#C[C@H](C(=O)[C@H]1CC12CCC2)c1nc(-c2ccc(Cl)cc2Cl)cs1 759833638 JUBBSAKKEOGRCG-CHWSQXEVSA-N 377.296 5.483 30 20 GKED Cn1cc(/C=C2\CCc3c(Cl)sc(Cl)c3C2=O)c(-c2ccncc2)n1 760264857 NJOPYPHOJROKQI-DHZHZOJOSA-N 390.295 5.063 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)c1 760270139 WTLXLTJCSWSMPD-UHFFFAOYSA-N 392.842 5.216 30 20 GKED CC[C@@H](C)n1ncc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C1CC1 760350433 KIRZHWMQRUXRJI-VGOFRKELSA-N 398.510 5.639 30 20 GKED C#CCOc1ccccc1-c1noc(COC(c2ccccc2)c2ccccc2)n1 762002212 WTSDYJWBEPNBOL-UHFFFAOYSA-N 396.446 5.055 30 20 GKED O=C(/C=C/c1cscc1Cl)c1ccc(S(=O)(=O)C2CCCC2)cc1 771859508 NIFSCAYESXFUJK-JXMROGBWSA-N 380.918 5.014 30 20 GKED Cc1nc(NC(=O)c2ccccc2SCC#N)sc1Cc1cccc(F)c1 772120310 CPZBAOPHSQPETD-UHFFFAOYSA-N 397.500 5.049 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1F 781420247 AIDLXUACHZCOGI-CQSZACIVSA-N 381.451 5.168 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1nc2ccccc2n1C(F)F 786325751 VMBUUYKAZKGLBI-MXWKQRLJSA-N 391.830 5.126 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 800387885 WEUJRLANIIKGRU-MWLCHTKSSA-N 388.361 5.317 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1 800578928 WGFHJSXYGZTKFY-IFMALSPDSA-N 382.479 5.064 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](OC(=O)CCCCCC#N)c2ccccc2)c1 805695881 MTASWKJOLJCSAN-JOCHJYFZSA-N 378.472 5.001 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccccc1COCc1ccccc1 806208826 FWFKWHWXHQNDLY-UHFFFAOYSA-N 384.479 5.071 30 20 GKED C#Cc1ccc(CNCc2ccc(Oc3ccccc3C(F)(F)F)nc2)cc1 809620484 QWAWVYZZKKJYLY-UHFFFAOYSA-N 382.385 5.164 30 20 GKED N#CCCC[C@H](NCC(=O)Nc1ccc(-c2ccccc2)cc1)c1ccccc1 814658901 IBAWLBFTXRXWTE-DEOSSOPVSA-N 383.495 5.317 30 20 GKED COc1ccc(NC(=O)OC(C)(C)C)c(NCc2ccc(C3(C#N)CC3)cc2)c1 826017871 XOZZBUMKJRBOEI-UHFFFAOYSA-N 393.487 5.209 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842940360 BZEMGFSIIYPRRO-OCOPJHETSA-N 376.403 5.319 30 20 GKED Cc1cc(NC(=O)[C@H](C)Cc2ccc(C#N)cc2)ccc1NC(=O)OC(C)(C)C 856369867 PMFUAGZCUXNAMS-MRXNPFEDSA-N 393.487 5.031 30 20 GKED Cc1ccc(NC(=S)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1F 916000824 VYTFSCGXLQMZQD-UHFFFAOYSA-N 391.471 5.394 30 20 GKED CCCc1sc(C(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1CC 916898334 BEDOECLEQVTAGQ-SFHVURJKSA-N 396.556 5.349 30 20 GKED Cc1ccc2c(C=Nn3cnc4sc(C)c(-c5ccccc5)c4c3=O)c[nH]c2c1 917538558 MARRRAMEUXPSBW-UHFFFAOYSA-N 398.491 5.105 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc2c3ccccc3n(C)c2s1 919864129 HTNFFYFPUHJXFQ-UHFFFAOYSA-N 389.480 5.304 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C/C(=O)c3ccccc3OC(F)F)o2)cc1 1776119804 LZUVNPMEPBKYOG-PKNBQFBNSA-N 384.334 5.142 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccsc1C(F)(F)F 1776354861 CMHDRRAWIVEGGI-HYXAFXHYSA-N 384.375 5.148 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 43788426 GSFODQVJPQAFMF-YWZLYKJASA-N 390.874 5.273 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCSCc2ccccn2)cc1 63910922 GWWWNCSFLNMMKB-UHFFFAOYSA-N 389.480 5.008 30 20 GKED Cc1cccc(OCCCC/C(O)=N/S(=O)(=O)c2ccc3ccccc3c2)c1 65762938 MMDPPTKREJJZPO-UHFFFAOYSA-N 397.496 5.043 30 20 GKED N#Cc1ccccc1COc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 65772245 IXBDWRXFEUVEDL-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)Cc1cccc(F)c1 66022044 WIHXNLMVAIXNBV-MRXNPFEDSA-N 389.430 5.010 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2[nH]c3ccccc3c2C1 66955465 GIWJEUKBJSKVNI-HNNXBMFYSA-N 390.512 5.152 30 20 GKED CCCOc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)c(C)c1 102236888 YLDJAJYBBMDQJY-UHFFFAOYSA-N 390.439 5.080 30 20 GKED C=CCOc1ccc(C(=O)N(CC=C)c2nc(-c3ccccc3)cs2)cc1 105849557 WJYPWNLJXDHDQD-UHFFFAOYSA-N 376.481 5.208 30 20 GKED N#Cc1cccc(OCCCSCC(=O)Nc2c(Cl)cccc2Cl)c1 126483782 ZPVYSHKRJUZUDR-UHFFFAOYSA-N 395.311 5.006 30 20 GKED N#CCCn1cc(CNc2cccc(CC(F)(F)F)c2)c(-c2ccccc2)n1 151802152 APRFWFUIRXRMBJ-UHFFFAOYSA-N 384.405 5.181 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccc(C#N)cc1 174056459 YPCDTLLZZGKGLH-FQEVSTJZSA-N 392.506 5.321 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccncc3Cl)cc2Cl)c1 174287975 YPDXGUPSROESIJ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccc(F)c(F)c1 187783846 KLNPQIUBIZEIQI-QRWLVFNGSA-N 383.442 5.600 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4c3CCC4)c2)cc1 195647995 JDASUNRJBHVKFJ-UHFFFAOYSA-N 382.463 5.073 30 20 GKED Cc1cccnc1[C@H](NCc1cccc(OCc2ccccc2C#N)c1)C(C)C 236755819 CYKLAPSAAHDLPZ-XMMPIXPASA-N 385.511 5.328 30 20 GKED COc1cccc(C2=CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 272804461 IBYREJILFJPACJ-INIZCTEOSA-N 393.512 5.021 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2cccc(C(F)(F)F)c2)c1 303475823 NVECDUKFMJIDLT-OALUTQOASA-N 388.389 5.130 30 20 GKED CC1(C)CC[C@@H]2C[C@@H](/N=C(/O)c3coc(C4CCOCC4)n3)c3cccc1c32 328836325 XLSSWOCAMTWTLS-CRAIPNDOSA-N 380.488 5.173 30 20 GKED CO[C@@H](C)c1nc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cs1 369987896 UEYXXDGKZGZNGS-CVEARBPZSA-N 377.513 5.240 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1cccc(CCC(F)(F)F)c1 425659159 KJYALOXIVKIELT-CQSZACIVSA-N 375.394 5.278 30 20 GKED N#CCCC[C@@H](NCC(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 433011675 POKZWUASDMTJCB-JOCHJYFZSA-N 399.494 5.442 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC[C@H](CC(F)(F)F)C2)cc1 433734522 ATIDMEQGMGOOCX-MRXNPFEDSA-N 388.389 5.074 30 20 GKED C[C@@H]1CCN(Cc2nnc(-c3ccc(C#N)cc3)o2)c2cc(Cl)ccc2S1 440396872 GMTQWAAFDPPBCI-CYBMUJFWSA-N 396.903 5.153 30 20 GKED C=CCC[C@H](NC(=O)NCC1CCC(C#N)CC1)c1ccc(C(F)(F)F)cc1 441003780 OJVLGIATMNOSGR-RJYAGPCLSA-N 393.453 5.342 30 20 GKED CCOc1c(F)cccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 442668518 AXJSCICQHKBVQZ-MRXNPFEDSA-N 380.444 5.146 30 20 GKED C[C@@H](c1cccc(C#N)c1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 442693004 OFZUAWFIMVWWDS-HNAYVOBHSA-N 392.890 5.202 30 20 GKED COC[C@@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 454477900 DROCDKBDOANBST-ICSRJNTNSA-N 397.906 5.028 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 454634699 CQWAHJDVFSGVFA-IBGZPJMESA-N 393.878 5.156 30 20 GKED C[C@@H](c1ccc(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1)C(F)(F)F 456016708 MUMLQNALJAIVSJ-HNNXBMFYSA-N 384.401 5.154 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H]1CCCCC12CCCC2 463458378 XGAOJDZLMBLTDW-PXNSSMCTSA-N 385.577 5.112 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N[C@](C)(C#N)C(C)(C)C 464158313 NAKSGKPGURZJES-RUZDIDTESA-N 385.511 5.197 30 20 GKED Cc1cc(Br)cc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 464508401 FFCKNAXVGVCMHC-MRXNPFEDSA-N 397.297 5.371 30 20 GKED C[C@@H]1CCN(C(=O)c2cn(CCCC#N)c3ccccc23)[C@@H](c2ccco2)C1 469477894 LMJHPUQIVWCECU-DYESRHJHSA-N 375.472 5.151 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F 475550064 NHZNLHZLHFORQR-HTAPYJJXSA-N 380.507 6.293 30 20 GKED CC(C)Oc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)c(C(F)(F)F)c1 475636472 BQSBDFYSNWBPNI-INIZCTEOSA-N 390.405 5.519 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1cccc(COC(C)(C)C)c1C 475964501 AWCUSBXLLDXOBM-UHFFFAOYSA-N 396.531 5.539 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2cnn(C)c2)ccc1F 476106158 CXAMWXMWVIYYSU-UHFFFAOYSA-N 377.463 5.330 30 20 GKED C=CCN(C(=O)c1cccnc1OCC(C)C)c1nc(-c2ccccc2)cs1 482275860 ZDFZHBDYAWQTKT-UHFFFAOYSA-N 393.512 5.073 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)cc1 483412447 SVYMJIUXEJPECO-UHFFFAOYSA-N 395.871 5.130 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CCC(c2ccsc2)CC1 486620716 NWZXZXUQJNNZOB-UHFFFAOYSA-N 388.492 5.432 30 20 GKED Cc1c(C(=O)N[C@@H](CCCC#N)c2ccccc2)oc2c1ccc1ccccc12 487599102 CLDUBCNCRFQHOK-QFIPXVFZSA-N 382.463 6.059 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)c2ccccc2Cl)cc1 487996547 LYXRHKKOJLIUAK-UHFFFAOYSA-N 378.834 5.193 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC[C@@H](C)C(F)(F)C1 494568293 XQPXTEAWEIVMTH-OAHLLOKOSA-N 385.414 5.168 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc2ccccc2n1CC(F)(F)F 495182426 UDJWLKLFSMCSDS-UHFFFAOYSA-N 386.417 5.075 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cn1ccc2ccccc21 500735985 BBWFCGSBKOQKIW-UHFFFAOYSA-N 381.435 5.252 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc4ncccc34)c2)cc1 501480451 OJLYJFUZVOFAQO-UHFFFAOYSA-N 393.446 5.132 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)F)cc1 505834605 UQZCMJILGSCSKT-QRVBRYPASA-N 398.453 5.070 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc2cc(Br)ccc2o1 509092239 FMLSPCWQOSMWPW-UHFFFAOYSA-N 376.275 5.085 30 20 GKED C=CCC[C@@H](NCc1ncc(CN(C)C)s1)c1ccc(C(F)(F)F)cc1 512055694 ZBNCBUAFTNPTTH-QGZVFWFLSA-N 383.483 5.021 30 20 GKED Cc1ccc(SCc2cccc(C(=O)[C@H](C#N)c3nc(C)cs3)c2)c(C)c1 513676412 DQZMADMWKFJRQE-IBGZPJMESA-N 392.549 5.851 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccn(Cc2ccccc2)c1 514223916 USWUEKIOSGMTNQ-QGZVFWFLSA-N 375.497 5.040 30 20 GKED Cc1cc(C)c(C#N)c(S[C@H](C)C(=O)N[C@H](C)c2ccc3ccccc3c2)n1 514360299 GAXBNAVTPQDOHF-IAGOWNOFSA-N 389.524 5.081 30 20 GKED CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 514966309 OBPOFBXKMWMSAC-NRFANRHFSA-N 383.923 5.153 30 20 GKED N#Cc1cccc(NC(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c1 519145312 GKNVOLVJTUZPIY-GOSISDBHSA-N 392.459 5.020 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C 519450825 KIUQYPVVLZRXRA-UZLBHIALSA-N 381.545 5.847 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C(C)(C)C 520667391 JDDYVLFRQAXCRH-OAQYLSRUSA-N 379.504 5.278 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1c(F)cccc1F 520714516 YDLAEQIETBTAHY-UHFFFAOYSA-N 382.341 5.044 30 20 GKED C=CCOc1ccc(CNCc2ccccc2-c2ccc(CN(C)C)cc2)cc1 520953277 ZAPDKOVWXNOURK-UHFFFAOYSA-N 386.539 5.270 30 20 GKED Cc1onc(-c2ccccc2)c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 521494816 BAVHXRGDSCQTJH-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(C#N)cn2)cc1 522111283 IWXDJLVHZBGMCV-UHFFFAOYSA-N 393.830 5.050 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3nc(-c4ccccc4)cs3)n2)cc1 522234403 ZVUFAAASFAWGCY-UHFFFAOYSA-N 388.477 5.058 30 20 GKED CC(C)Cc1ccc([C@H](NCc2nnc(-c3cccc(C#N)c3)o2)C2CC2)cc1 537292679 ZGXZGEGOHMYZEI-QHCPKHFHSA-N 386.499 5.048 30 20 GKED Cc1oc(-c2ccccc2)nc1CN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542948042 OIQRPMBISXTHLB-GOSISDBHSA-N 393.490 6.040 30 20 GKED N#CCCC[C@H](NCc1csc(-c2ccc3c(c2)OCO3)n1)c1ccccc1 552312023 MLPUNRXUVGLGGH-IBGZPJMESA-N 391.496 5.064 30 20 GKED Cc1sc(NC(=O)c2cc(Cl)cc(F)c2Br)c(C#N)c1C 560001931 AEGVKRULJGNXFY-UHFFFAOYSA-N 387.661 5.044 30 20 GKED COc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)c1OC 564115433 YYCDJPKIMSWOJO-GOSISDBHSA-N 386.495 5.402 30 20 GKED Fc1ccc(C(F)(F)c2noc([C@@H](F)c3ccc(C(F)(F)F)cc3)n2)cc1 571563471 TYKVHXYMXIKBEY-ZDUSSCGKSA-N 390.258 5.427 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N2CCC(CCC#N)CC2)c1 582604701 XIKAMVRCGICBEM-UHFFFAOYSA-N 377.488 5.122 30 20 GKED Cc1nn(-c2ccccc2Cl)cc1CN[C@@H](CCCC#N)c1ccccc1 594518482 IQPIOCMXDGLDQW-NRFANRHFSA-N 378.907 5.359 30 20 GKED COc1ccc(CNCc2ccc(-c3cccs3)cc2)cc1OCCCC#N 594968503 PZDIQQWXSBEHIA-UHFFFAOYSA-N 392.524 5.396 30 20 GKED Cc1cc(N2CCC[C@@H]2c2ccc(F)c(C(F)(F)F)c2)cc(C#N)c1[N+](=O)[O-] 600851769 HCLLPSDFWPWYBD-QGZVFWFLSA-N 393.340 5.274 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccc(Oc2cccnc2)c(C)c1 601140270 GHBMCRFQZFGAMV-UHFFFAOYSA-N 389.455 5.069 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1 603728762 MEADFVAGRUFUNY-UHFFFAOYSA-N 399.928 5.207 30 20 GKED O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cccc(F)c1Cl 608110436 ZVMJHQAQBJQIJM-BRPSZJMVSA-N 391.714 5.118 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 609376535 BSKIWHJUCHKCBX-MAODMQOUSA-N 386.520 5.834 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccs3)cc2)c1 609434536 VUOYDUQRPNXBMW-FQEVSTJZSA-N 389.480 5.781 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1CSc2ccccc21 609791624 PLULZQKMNIIYJG-SFHVURJKSA-N 388.517 5.286 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N[C@H]2CSc3ccccc32)cc1 609791992 YKJRIZKQQQUEHR-IBGZPJMESA-N 390.439 5.066 30 20 GKED C[C@@H](NC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1)c1cccc(C#N)c1 610317803 CEJGYAPHPMBHPK-OAHLLOKOSA-N 398.491 5.718 30 20 GKED C[C@H](NCc1ccc(-c2cccc(Br)c2)o1)c1cccc(C#N)c1 610344868 JROOQSMGEGFRTD-AWEZNQCLSA-N 381.273 5.432 30 20 GKED CN(C(=O)c1cc(C2CC2)nc2ccc(Cl)cc12)c1ccc(C#N)cc1F 610577051 HHHIECSOYKXWPU-UHFFFAOYSA-N 379.822 5.053 30 20 GKED Cc1cccc(CC2CN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 610632517 KOHFTRHQIYKKDJ-KRWDZBQOSA-N 379.529 5.096 30 20 GKED Cc1coc(-c2cccc(NCc3cccc(OCc4cccc(C#N)c4)c3)c2)n1 610911595 JVJHPUCUVZLLIS-UHFFFAOYSA-N 395.462 5.713 30 20 GKED C=CCC[C@H](NC(=O)N1CC(CC(F)(F)F)C1)c1ccc(C(F)(F)F)cc1 676760565 INPUWIJNQYANQC-HNNXBMFYSA-N 394.359 5.307 30 20 GKED COc1c(O)cccc1/C=C/C(=O)c1ccc(OCc2ccc(F)cc2)cc1 727685474 OOINBPYMVMBWAF-NTEUORMPSA-N 378.399 5.015 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C/c1ccccc1F 727996786 NCDOITGHDYEHHF-FMIVXFBMSA-N 386.426 5.237 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@H](C)c2ccccc2OC)cc1 728767194 XFJXFGGXBUNANK-FIKGOQFSSA-N 392.499 5.050 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(C(C)(C)C)nc2C)c(Cl)c1OC 730434308 OLAOZMFEULWVRH-VQHVLOKHSA-N 379.909 5.316 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C\c1ccsc1 730995456 RPDFFMUFCPLEDN-DJWKRKHSSA-N 382.432 5.425 30 20 GKED Cc1ccc(COc2cccc(NC(=O)c3ccccc3SCC#N)c2)cc1 732143594 AMXCLQOQFKULMH-UHFFFAOYSA-N 388.492 5.442 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CC4C[C@H]5CC3C[C@@H](C4)C5)c2)s1 740058568 XFBLMZPRWBNYCL-ZVBHREPYSA-N 391.540 5.007 30 20 GKED COc1ccc2cc(/C=C\C(=O)c3cnn(-c4ccc(C#N)cc4)c3C)ccc2c1 741843522 HFVPALACJHDBMY-SDQBBNPISA-N 393.446 5.110 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)s1 742646342 LZAQOZJPLDQWGZ-HSBSLETESA-N 394.327 5.142 30 20 GKED Cc1ccc([C@@H](C)C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)o1 742660320 ZGKTYYAARVWFRS-QGZVFWFLSA-N 376.431 5.244 30 20 GKED COc1ccc(/C=C\C(=O)c2c[nH]c3cc(Cl)ccc23)cc1OCCCC#N 747361477 PEYXJPFKWDHBPD-YWEYNIOJSA-N 394.858 5.409 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)s1 749322433 DNRWEPCSOKMCMM-KXBFYZLASA-N 391.496 5.067 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3cnc(-c4ccncc4)s3)oc12 753142163 OWRAXZUARTUOJM-VOTSOKGWSA-N 376.437 5.246 30 20 GKED Cc1cnc([C@@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 755755236 CTBJLKIEAJMHII-MGPUTAFESA-N 390.512 5.032 30 20 GKED Cc1sc2ncn(N=Cc3ccc(F)cc3Cl)c(=O)c2c1-c1ccccc1 767760374 HYJDSXPPDAYOFJ-UHFFFAOYSA-N 397.862 5.108 30 20 GKED Cc1cc(C(=O)OCCCCC(C)(C)C#N)ccc1NC(=O)c1cccs1 768819272 JTDBBAUUCVSPNQ-UHFFFAOYSA-N 384.501 5.186 30 20 GKED C[C@H](N[C@H](C)c1ccc(Oc2ccccc2)c(F)c1)c1ccc(OCC#N)cc1 772958928 ISHLZQIZQMWZGE-ZWKOTPCHSA-N 390.458 5.932 30 20 GKED C[C@H](OC(=O)c1cn(CCCC#N)c2ccccc12)c1nc(C2CC2)cs1 774186873 FODGZXUJPNSWEN-AWEZNQCLSA-N 379.485 5.197 30 20 GKED O=C1/C(=C\c2csc(-c3cccs3)n2)CCc2ncc(C(F)(F)F)cc21 777468122 OYKKMCQWSYQMRL-POHAHGRESA-N 392.427 5.498 30 20 GKED Cc1sc2ncn(N=Cc3cc(Cl)cs3)c(=O)c2c1-c1ccccc1 782149291 AUOJWIJLNAWEJJ-UHFFFAOYSA-N 385.901 5.031 30 20 GKED N#Cc1ccc(CN[C@@H](CCSc2ccccc2)c2ccc(F)cc2)nc1 783301322 VZOVOWNYVFFHJU-QFIPXVFZSA-N 377.488 5.106 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(Cc4ccccc4F)CC3)n2)cc1 785881276 VYUJHUXWXDKENG-GOSISDBHSA-N 390.483 5.457 30 20 GKED N#C[C@@]1(F)CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)C1 787374869 SDLZMFIUEPUDRP-VWLOTQADSA-N 398.437 5.011 30 20 GKED Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cc(C#N)ccc2Cl)c1 795160533 ZNEKOEGGRVCBKI-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC(c2cccc(Cl)c2)CC1 797642720 LJQWCWZSYIFUAI-HNNXBMFYSA-N 383.879 5.042 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 805947266 LDQNXRANNXRFHG-RDTXWAMCSA-N 377.513 5.044 30 20 GKED N#Cc1nc(F)ccc1Oc1nc(C2CC2)nc2scc(-c3ccccc3)c12 808140998 JFAXEYOYPYNCDV-UHFFFAOYSA-N 388.427 5.434 30 20 GKED CN(C(=O)c1cc(F)c(C(F)(F)F)cc1F)[C@H]1CC[C@@H](C(F)(F)F)CC1 809371962 GKDLCFMGMVIOML-DTORHVGOSA-N 389.286 5.177 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCCOC2=O)cc1 815636661 YQMCLRBVEBYENX-AVRDEDQJSA-N 377.488 5.119 30 20 GKED Cc1cc(Cl)ccc1OCC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915086165 HYHOAJQWLAEDQQ-NRFANRHFSA-N 390.870 5.321 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2ccc(F)cc2s1 916915974 MGWQKDLMUIJKBD-KRWDZBQOSA-N 388.423 5.155 30 20 GKED Fc1ccccc1-c1ccc(C=Nn2c(S)nnc2-c2ccccc2Cl)o1 917025626 BEIUFYAOXXGUJK-UHFFFAOYSA-N 398.850 5.169 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C/c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1777372562 JVYWZZCDNXFSBX-GPILYODUSA-N 396.439 5.206 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4c(O)cccc4C3=O)s2)c1 1777684372 WYHJROTZPUQNDA-OWBHPGMISA-N 376.433 5.031 30 20 GKED COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)[C@H](C#N)c2ccccn2)cc1 41492723 ULUMNCWHITZDMI-OAQYLSRUSA-N 395.462 5.048 30 20 GKED N#C[C@H](C(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1nc2ccccc2o1 41542605 LBXPOFJCXZEBBO-HXUWFJFHSA-N 394.430 5.334 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cccc(Cl)c2Cl)cc1 56300144 CBCXBMJZHUAEIM-UHFFFAOYSA-N 389.282 5.060 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(-c2cccs2)n1 61203235 PASYQVGTJSGMIV-UHFFFAOYSA-N 380.947 5.415 30 20 GKED O=C1/C(=C/c2ccc3ncccc3c2)CSC/C1=C/c1ccc2ncccc2c1 104758810 XPHDECRJKHNVCO-VOKWCDJLSA-N 394.499 5.566 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1nc(C(C)(C)C)cs1 105296542 IBEDQFQSYHIHJT-UHFFFAOYSA-N 383.970 5.053 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1sccc1Br 108240731 RECUTFGTLPCOIR-JTQLQIEISA-N 381.320 5.015 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(OC)cc1 108529707 FYTCPUPFBCGLNR-YJBOKZPZSA-N 383.517 5.220 30 20 GKED CC[C@@H](N/C(S)=C(/C(=O)c1ccccc1C)[n+]1ccccc1)c1cccs1 115511120 KBRYAZKHZFIPEI-GOSISDBHSA-O 395.573 5.024 30 20 GKED Cc1cccnc1[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 115769538 BCMLJYJAMNVSPK-HNAYVOBHSA-N 382.533 5.161 30 20 GKED C=CCn1c(SCc2csc(-c3ccsc3)n2)nnc1-c1ccccn1 159668970 NEULOHHSQZIMGB-UHFFFAOYSA-N 397.554 5.003 30 20 GKED C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1cccc(C#N)c1 162760606 JAHZVHVERFWITJ-GFCCVEGCSA-N 387.270 5.108 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cccc(CC(F)(F)F)c1 173122466 JLIUPKUCEDMNJN-ZDUSSCGKSA-N 393.434 5.830 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 178844076 HRABVNGPKSLNSE-GDBMZVCRSA-N 399.466 5.177 30 20 GKED C=CCCC[C@H](C)NC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 189198199 REPYRIKJDVLKRF-ZDUSSCGKSA-N 396.318 5.227 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C\SCc1ccco1 255237853 AHAVFNPMYJVQRC-FLIBITNWSA-N 391.452 5.033 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccncc1 293265810 JASDXDGDWOJLLN-BEFAXECRSA-N 380.517 5.091 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(SC)cc2)cc1 303139825 QWYWYHHBWDXQOT-UHFFFAOYSA-N 390.464 5.333 30 20 GKED Fc1ccccc1-c1nc(CN2CCC(C(F)(F)F)(C(F)(F)F)C2)cs1 303732738 ZULVMENTLNNCJL-UHFFFAOYSA-N 398.347 5.266 30 20 GKED OC(=Nc1nc(C2CCOCC2)cs1)N1CCCCC[C@H]1c1ccccc1 329406118 BXOPTLXLMYYPDE-IBGZPJMESA-N 385.533 5.200 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 410256047 YNQMNPFSVQSIAE-ZDUSSCGKSA-N 384.423 5.106 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccccc1N1CCCCCC1 425606763 JPEZRURRYGDATO-GOSISDBHSA-N 376.504 5.164 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 429060599 BAUUXJHJHRAAJI-ACJLOTCBSA-N 376.287 5.399 30 20 GKED N#Cc1ccc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)c(Cl)c1 430363748 ZHJAVKOZEJRERK-UHFFFAOYSA-N 375.737 5.031 30 20 GKED Cc1nnc(-c2cccc(C#N)c2)n1Cc1ccc(Oc2ccccc2)c(F)c1 433383846 BOLQYYNPVCFXDY-UHFFFAOYSA-N 384.414 5.105 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)Nc1cc(C(F)(F)F)ccc1F 437991518 XZTSDEIZBWZHDT-UHFFFAOYSA-N 380.263 5.593 30 20 GKED C[C@]1(Cc2ccccc2)CCCN1C(=O)c1cn(CCCC#N)c2ccccc12 444265679 MGKFJQHKGIYWKR-RUZDIDTESA-N 385.511 5.182 30 20 GKED Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 454754296 NLKFMMVSNKEOOB-QRWLVFNGSA-N 397.519 5.755 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(Cc2ccc(F)cc2)CC1 454778875 ZQYWDCRRHSULRO-HNNXBMFYSA-N 383.492 5.117 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(Sc3ccccc3C#N)cc2)CCS1 455939769 HGFSDXSBTDXWLP-OAHLLOKOSA-N 383.542 5.069 30 20 GKED COc1ccc([C@H](NCc2ccccc2C#N)c2ccccc2Cl)c(C)c1 462175640 LEHRIYQOXVGXOO-QHCPKHFHSA-N 376.887 5.408 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(-c2ccccc2)cc1)c1ccc(C#N)cc1 465669853 WZJWSHCIAFSNLA-RTBURBONSA-N 383.495 5.689 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1 470486860 MFJCOEXVJYXVRW-GOSISDBHSA-N 389.474 5.347 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)cc1 475590138 PVFJHKXZTTZGFE-UHFFFAOYSA-N 395.462 5.191 30 20 GKED COc1ccc(N(Cc2cccs2)C(=O)C[C@H](CC#N)c2ccccc2)cc1 475931913 IYLJNHAJIGWIDI-IBGZPJMESA-N 390.508 5.377 30 20 GKED CCCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1cccc(C)c1 477103480 VXROQKKMSMBRBA-UHFFFAOYSA-N 386.499 5.187 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1)[C@@H](c1cccnc1)c1csc2ccccc12 480970307 YFJGRAUUHFFGHS-QHCPKHFHSA-N 397.503 5.420 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)[C@H](C#N)c2cnc3ccccc3n2)c1 483218900 QUPAUSSCQXOBCP-GOSISDBHSA-N 387.508 5.463 30 20 GKED CSc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)o1 486694415 ICSKNJGJFZEPGY-UHFFFAOYSA-N 384.844 5.571 30 20 GKED Cc1ccccc1-c1nc(C(=O)N[C@H](CCCC#N)c2ccccc2)cs1 487415523 ATHWOOYIMVMIRP-LJQANCHMSA-N 375.497 5.284 30 20 GKED CC(C)[C@H](Sc1ccc(C#N)cc1)C(=O)Nc1ccccc1C(F)(F)F 488837035 YMCHGWXGWFBBRX-KRWDZBQOSA-N 378.419 5.332 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCCCCc3ccc(F)cc3)CC2)cc1 489660942 XXPIOPWVBWOUAY-UHFFFAOYSA-N 376.475 5.116 30 20 GKED CCN(C(=O)c1cccc(C#N)c1)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 496446246 HDMXDNBCCQMDPQ-DEOSSOPVSA-N 383.495 5.328 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 504989700 ZGURNRGSKZEXFN-UHFFFAOYSA-N 388.386 5.048 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cccc(OC(C)(C)C)n3)o2)cc1 507373698 DUXJZOAPBQRRNN-UHFFFAOYSA-N 397.500 5.166 30 20 GKED N#CCC[C@@H](NC(=O)N1CC=C(c2ccccc2Cl)CC1)c1ccccc1 509208036 CNGYPGQZPGFWHE-OAQYLSRUSA-N 379.891 5.184 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(Br)c1)c1nc2ccccc2s1 511918705 OXJIHOQIIJFLOF-JTQLQIEISA-N 391.677 5.202 30 20 GKED C=CCOc1ccccc1-c1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1 515359983 PUHXQJNTGMYPEX-MRXNPFEDSA-N 378.325 5.379 30 20 GKED N#Cc1c(NC(=O)c2ccc3ccccc3n2)sc2c1-c1ccccc1CC2 515628913 RRUVMZKRVZDBHO-UHFFFAOYSA-N 381.460 5.186 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(F)c(C(F)(F)F)cc1F 516995117 TUSOVMABYDIKNG-LLVKDONJSA-N 386.389 5.847 30 20 GKED N#Cc1cccc(C(=O)N(Cc2ccccc2OC(F)(F)F)C2CCCC2)c1 517841049 CXJIEJLLMAAQKJ-UHFFFAOYSA-N 388.389 5.042 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cc(-c3ccccc3)ccc2Cl)c1 518361390 DPRFDUGZXPBXJZ-UHFFFAOYSA-N 398.796 5.732 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(Cl)c(Cl)c1 519515774 WECWMTKZJDKZEM-ZDUSSCGKSA-N 393.339 5.959 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1ccc(Cl)c(Cl)c1 521016130 KFHQVMLLJJAZRP-AWEZNQCLSA-N 396.636 5.262 30 20 GKED CCN(C(=O)c1[nH]c2ccccc2c1Br)[C@H](C)c1ccc(C#N)cc1 521199821 CKDDIQJYDCFFPP-CYBMUJFWSA-N 396.288 5.025 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1cc(F)ccc1F 522639884 HYLIQVKWBILFGQ-UHFFFAOYSA-N 398.796 5.559 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3csc(-c4cccc(Cl)c4)n3)[nH]c12 522830539 CVMAZHHLOXNLES-CQSZACIVSA-N 392.871 5.138 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4ccccc4o3)cc2F)c1 524459365 AHFSPJZJIWFJRE-UHFFFAOYSA-N 386.382 5.275 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)c(F)c1 531264453 LKGIBRFMDGPZJS-UHFFFAOYSA-N 397.362 5.065 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 531695841 MKLPDQGMPPFPJU-NEPJUHHUSA-N 386.339 6.008 30 20 GKED CCOc1cccc([C@@H]2C[C@@H]2NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 537256773 LNEJINIIPAELOW-BPAFIMBUSA-N 395.528 5.157 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2coc3ccc(C(C)C)cc23)cc1 552777349 DLQPNQRFJQSQGM-UHFFFAOYSA-N 377.444 5.116 30 20 GKED COc1cccc(C(=O)CCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 555994709 XHSZVGNTQGTCBV-MRXNPFEDSA-N 396.512 5.081 30 20 GKED C[C@@H](N[C@@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1Cl 560584785 JQXNKHUJZJIGGH-ZMZPIMSZSA-N 383.706 5.293 30 20 GKED C[C@@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 561800087 OGPOLSJGDQSVNB-AWEZNQCLSA-N 378.369 5.285 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cccc(F)c1Br 570298866 JFUGUOYEMXKNLW-LLVKDONJSA-N 393.281 5.092 30 20 GKED C=CCn1c(S[C@H](CCOC)c2ccccc2)nnc1-c1ccccc1C 570990768 NSVJKFFZXPSTOD-HXUWFJFHSA-N 379.529 5.309 30 20 GKED CCSCc1ccccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 572748868 YYVYKKMVNUZCRE-UHFFFAOYSA-N 379.510 5.187 30 20 GKED Cc1nn(C(C)C)cc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 578665955 UFJXPDBUTJNIDA-HNNXBMFYSA-N 384.892 5.039 30 20 GKED Cc1cc(CNC2(c3ccc(C#N)cc3)CCC2)nc(-c2ccc(Cl)cc2)n1 594033079 HBKISSXZHWRTDG-UHFFFAOYSA-N 388.902 5.146 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21 599390120 FLUOAFKUYUBFNS-BMZRXHPRSA-N 382.916 5.116 30 20 GKED CC[C@@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 600002776 WVNUNJQQOVZLRP-HZPDHXFCSA-N 395.528 5.029 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)C3(c4ccccc4)CCCC3)s2)cc1 602225829 APVOFQAYOYNULU-UHFFFAOYSA-N 387.508 5.056 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)[C@@H]1CCCc2ccccc21 603690774 QDWNPANHZKOWAI-JOCHJYFZSA-N 398.466 5.287 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 605930722 FGCQLSIRFWPRLW-UHFFFAOYSA-N 379.382 5.323 30 20 GKED C=CCn1c(S[C@H](CC)C(=O)c2ccccc2)nnc1-c1ccccc1F 606150136 DDMOQTHVOVOVFH-GOSISDBHSA-N 381.476 5.024 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1ccc2ncsc2c1 606768532 RSFHOPHWXZJUKD-UHFFFAOYSA-N 378.375 5.132 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 607433074 ADOQLKLYVSOCFX-MRXNPFEDSA-N 378.522 5.845 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)Nc3ccccc3-c3ccccc3)CC2)c1 609205290 QKDUUZZTNMQSAU-UHFFFAOYSA-N 397.478 5.301 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(OC3CCCCC3)cc2)c1 609784069 ISZMQXRLAWAPDL-UHFFFAOYSA-N 378.472 5.333 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)cc1 610169161 WIFLADYYOWDRHD-UHFFFAOYSA-N 398.249 5.499 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(Cc2ccoc2)C2CCCCC2)c1 610180434 KRCLKBICQPPRHB-UHFFFAOYSA-N 380.488 5.062 30 20 GKED C[C@@H](NC(=O)Nc1cccc(CSC2CCCC2)c1)c1cccc(C#N)c1 610326572 BINHPXQFWFKVJZ-MRXNPFEDSA-N 379.529 5.617 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@H]2/C=C\c2ccccc2)cc2ccccc21 610655096 SHQMGYDLASSRRR-MTVZPNFRSA-N 383.495 5.263 30 20 GKED CC1(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)CCC(F)(F)CC1 612064690 PBGQOMWDIUPGNQ-UHFFFAOYSA-N 388.389 5.187 30 20 GKED N#CCc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(Br)cc2)cc1 612536466 UZHNQETYJMTJFE-KRWDZBQOSA-N 397.238 5.298 30 20 GKED N#C[C@H](C(=O)c1cc2ccsc2[nH]1)c1nc2cc(C(F)(F)F)ccc2s1 613405327 YHPJEQWFMDRHAW-SNVBAGLBSA-N 391.399 5.348 30 20 GKED Cc1cccc2sc(C(=O)N[C@]3(C#N)CCc4ccccc4C3)c(Cl)c12 613677711 IBLXJMSNFVIMMK-OAQYLSRUSA-N 380.900 5.044 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1Cl 614056167 PSOCPENFMGWEKR-UHFFFAOYSA-N 397.950 5.672 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccoc1C1CC1 648494189 CCQNVGGTXMGBKV-UHFFFAOYSA-N 395.274 5.699 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(OCc2ccccc2F)CC1)c1ccccc1 678165327 MNERRAJCSSFHSB-QHCPKHFHSA-N 396.506 5.224 30 20 GKED FC(F)(F)c1cscc1CN1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 685834855 PVFZOHGAODYVNU-IUCAKERBSA-N 385.295 5.330 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1c(Cl)nc2sccn12 727780026 FGPVFJCVHXKHSV-BQYQJAHWSA-N 385.901 5.377 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 730749361 KVZNLZJYSYIJAE-DHIUTWEWSA-N 391.474 5.079 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)/C=C\c1nc2ccccc2s1 730988887 DOYCXCNOSATQTF-BMSUMIBZSA-N 379.510 5.200 30 20 GKED CC[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1ccccc1OC 731360845 QMLNBTPBJDWIKB-DEOSSOPVSA-N 386.495 5.387 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)c2ccccc2Oc2ccccc2)c1 733770455 ADBURAWKVQRWDR-LJQANCHMSA-N 386.451 5.090 30 20 GKED CC(C)(NCc1cc(Cl)ccc1OCC#N)c1cccc(C(F)(F)F)c1 735309617 QFMCFVALDZPFSE-UHFFFAOYSA-N 382.813 5.286 30 20 GKED N#CCOc1ccc(Cl)cc1CNC1(c2cccc(C(F)(F)F)c2)CC1 735309755 SYCCDCTZMOLJKS-UHFFFAOYSA-N 380.797 5.040 30 20 GKED O=C1/C(=C/c2ccccc2F)CC(O)(C(F)(F)F)C/C1=C\c1ccccc1F 735792745 JUJBMLCGOXPDTP-KAVGSWPWSA-N 394.339 5.088 30 20 GKED CC(C)Sc1ccccc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739594651 MVDVQLSPWYVCAV-UHFFFAOYSA-N 392.549 5.717 30 20 GKED O=C(/C=C/c1ccc(Oc2cnccn2)cc1)c1ccc(OC(F)(F)F)cc1 743056686 JNOHFYXKXYGTOK-XCVCLJGOSA-N 386.329 5.064 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 744017143 ZFAURAGBGGYAOV-RZXPCSSPSA-N 386.398 5.595 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 744031334 KRZVPJZVJCBXGA-VELGLUOQSA-N 396.556 5.669 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@]12CCc1ccccc12)c1nc2cc(Cl)ccc2s1 744036409 YGDSKAUXHRNMNF-NVAPDCRFSA-N 378.884 5.030 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c2c1 747105944 FUVDPHVKALZWDJ-MRXNPFEDSA-N 393.899 5.549 30 20 GKED COc1cc(C(=O)/C=C/c2cccc(OCC(F)(F)F)c2)ccc1SC 747615419 XNFKJECMTMANPO-SOFGYWHQSA-N 382.403 5.254 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(N2CCCCCC2)cc1)c1ccccc1 749221743 OZMRNHOKZVGNJG-QFIPXVFZSA-N 376.504 5.234 30 20 GKED N#C[C@H](C(=O)C1[C@H]2CCCC[C@H]12)c1nc(-c2ccc(Cl)cc2Cl)cs1 751151646 IZKOOPFYJIRPKM-SGMGOOAPSA-N 391.323 5.729 30 20 GKED CSCCCCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 752484663 IOCSXRFEUBTSQY-NRFANRHFSA-N 381.545 5.387 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C(F)(F)c1c(F)cccc1F 756983515 LKHCXRBDTJXPMV-NSHDSACASA-N 382.382 5.090 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1cc(-c3cccs3)nc3ccccc13)CC2 757535521 ZNTAVFGAPYWJMW-UHFFFAOYSA-N 381.460 5.038 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/SCc3ccco3)n2)cc1 759833610 JEYJANDSVQTKQL-SYJIQKIWSA-N 380.494 5.335 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(-c2ccco2)s1 766254036 GIAKVBUQAZEFKV-INIZCTEOSA-N 386.432 5.122 30 20 GKED CCN(c1ccc(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1)C(C)C 770112310 VWLWHGRJOIEHAE-KRWDZBQOSA-N 396.441 5.156 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2cc(Cl)c(N)c(Cl)c2)c1 773160173 LBQKYXRUFCSGCP-VOTSOKGWSA-N 375.255 5.154 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc(N(C)C)cc1 775363174 LCIOLDDIAAAUOK-LJQANCHMSA-N 385.511 5.054 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2cc(OC)c(OC)c(OC)c2)cc1 776786545 YGEQQJLCWLXPNB-CQSZACIVSA-N 377.868 5.017 30 20 GKED O=C1/C(=C\c2cnc(-c3cccs3)s2)CCc2ncc(C(F)(F)F)cc21 777469528 DTTFVJDQJDWHQI-POHAHGRESA-N 392.427 5.498 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H]2CCCSc3ccc(OC)cc32)c1 783252751 UZMWZVVYBKYALH-LAUBAEHRSA-N 382.529 5.093 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(CN2CCOC2=O)c1 789455365 JTLXFNIAOHKTCS-UHFFFAOYSA-N 393.487 5.135 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCCSC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810530996 DWITXKMYDYLRQV-MFKMUULPSA-N 397.352 5.436 30 20 GKED CC[C@H](C#N)Oc1cc(CNCc2ccc(C3CCCC3)cc2)ccc1OC 812756021 HCJFWFZUVOVSJH-JOCHJYFZSA-N 378.516 5.324 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813218531 PZXFRUCCRWDBFQ-LXQCCHTASA-N 388.389 5.167 30 20 GKED N#CCSc1ccccc1C(=O)N[C@H]1CCC[C@H](c2cccc(Cl)c2)C1 837190623 UUIZFSBKWMKDOH-WMZOPIPTSA-N 384.932 5.412 30 20 GKED CSc1ccc(/C=C\C(=O)[C@@H](C#N)C(=O)c2cc3c(s2)CCCC3)s1 860853149 DWTRIXQOURHWOX-IQCBXXCUSA-N 387.551 5.015 30 20 GKED COc1ccccc1-c1nc(C(=O)N(O)Cc2cccc3ccccc23)cs1 901370188 UOOCAKDFEKGQGK-UHFFFAOYSA-N 390.464 5.004 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1OC 915086554 LBWTZJKIYRMSTP-QFIPXVFZSA-N 398.462 5.168 30 20 GKED N#C[C@H](C(=O)CCc1cccs1)c1nc2cc(C(F)(F)F)ccc2s1 915103677 BKHJHINFTQWYFN-GFCCVEGCSA-N 380.416 5.186 30 20 GKED Oc1c(Cl)cc(Cl)cc1C=Nc1cccc(COCc2ccco2)c1 915981577 UYILBTHEOQKCQQ-UHFFFAOYSA-N 376.239 5.759 30 20 GKED Cc1cc(C)c(C=Nn2cnc3sc(C)c(-c4ccccc4)c3c2=O)cc1C 916283502 DSDJPQZBCYLOOG-UHFFFAOYSA-N 387.508 5.241 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(Cl)c(Cl)c2)cc1 916914485 ZLHSYISICUPVNG-INIZCTEOSA-N 389.282 5.297 30 20 GKED C=C(Br)CNC(=O)Nc1ccc(Sc2ccccc2)cc1C 921117974 IIKADIBUSFOWOE-UHFFFAOYSA-N 377.307 5.176 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc(Cl)cc(Cl)c1O 1776033355 OOWSAOMATLXJSM-UHFFFAOYSA-N 387.650 5.277 30 20 GKED CC(CC(C)(C)c1c[nH]c2ccccc12)=NNc1ccc(Cl)c(C(=O)O)c1 1776033741 AXHIYBUHGZAWCP-UHFFFAOYSA-N 383.879 5.675 30 20 GKED CCc1cccc(C)c1NN=Cc1cccc(O[C@H](C(=O)O)c2ccccc2)c1 1776056747 MPGPYIBRBJUNGW-QHCPKHFHSA-N 388.467 5.208 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776120231 YTKSSDVYTBKWMV-UBKPWBPPSA-N 384.475 6.245 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2cccc(O[C@H](C)C(=O)O)c2)cc1 1776125783 SIVZBKHVKADJFD-RKCSUWQLSA-N 382.456 5.004 30 20 GKED C[C@H](Oc1cccc(/C=C2/CCc3c(Cl)sc(Cl)c3C2=O)c1)C(=O)O 1776472014 UCMKNDJREHMADZ-MKVDPYIPSA-N 397.279 5.119 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cn(C(C)(C)C)nc1C(C)(C)C 1776787040 KYRRAOOBFIZQIU-SFHVURJKSA-N 379.589 5.229 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)Cc3c(F)cccc3Cl)c2)c1 31777131 DOVAAHICMGUIPA-UHFFFAOYSA-N 394.833 5.111 30 20 GKED C=CCn1c(SCc2cc(-c3ccc(F)cc3)no2)nnc1-c1ccoc1C 32324884 FIWVKOFKTGGMBV-UHFFFAOYSA-N 396.447 5.119 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)s1 66801963 HOBDBZHXYSPOME-SNVBAGLBSA-N 381.320 5.157 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2cccc(F)c2)C1 66954355 IATHNZGPWHLGGL-RDJZCZTQSA-N 383.492 5.241 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CSC(F)(F)F)cc1Cl 107876063 AANNXZJUVLHPHN-CQSZACIVSA-N 384.810 5.187 30 20 GKED C=CCN(CC=C)C(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 115094361 OEZXTBLTFYSMHH-UHFFFAOYSA-N 380.538 5.282 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ncc(-c2ccccc2)o1 126194842 QCVQNSPPHPFGAV-KRWDZBQOSA-N 393.446 5.371 30 20 GKED Cc1cccc2cc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)oc12 149775048 WRNLTPVHADSHJL-UHFFFAOYSA-N 396.446 5.639 30 20 GKED C[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccs1 152226394 YPBKMLUBPWBCDN-INIZCTEOSA-N 376.481 5.135 30 20 GKED CC[C@@](C)(NCc1cccc(OCc2ccccc2C#N)c1)c1nccs1 152665079 OAIALYOPYLOILN-JOCHJYFZSA-N 377.513 5.009 30 20 GKED CC(C)[C@@H](NC(=O)CNc1ccccc1SC[C@H](C)C#N)c1ccc(F)cc1 178388706 PNLPMOIQFZMVIX-OPAMFIHVSA-N 399.535 5.003 30 20 GKED Cc1csc(-c2ccc(NCc3cn(C)nc3-c3ccc(C#N)cc3)cc2)n1 180322362 VFHPKAPPRPKHEM-UHFFFAOYSA-N 385.496 5.003 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2ccc(F)cc2Cl)ccc1OC 180814634 FFQUZNJXEDIQMM-CZUORRHYSA-N 376.859 5.019 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Cl)cc1C(F)(F)F 185730221 KVDQIDVYKOHXOE-UHFFFAOYSA-N 384.810 5.617 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1cc2cc(F)ccc2s1 193599207 HTTSQXQKRZYBIS-OAHLLOKOSA-N 376.412 5.036 30 20 GKED N#C[C@H](C(=O)c1cc(Br)cs1)c1nc(-c2ccccc2)cs1 194589950 UQHCVIWIJMRWDC-GFCCVEGCSA-N 389.299 5.124 30 20 GKED C=CCn1c(S[C@@H](C)c2noc(-c3ccccc3)n2)nnc1-c1cccs1 194610833 NRHCQDFSGYVYCO-ZDUSSCGKSA-N 395.513 5.096 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 246618955 SOMZCBWZHDEIRL-BHYGNILZSA-N 380.419 5.068 30 20 GKED N#CC1(NC(=O)c2ccc(-c3ccc(Br)cc3)s2)CCCCC1 302989434 XCIHGVWIQDTLPE-UHFFFAOYSA-N 389.318 5.134 30 20 GKED Cc1nnc(N=C(O)C2(c3cccc(C(F)(F)F)c3)CCCC2)n1C1CC1 329162904 ZXSCEFWJJOVHQI-UHFFFAOYSA-N 378.398 5.040 30 20 GKED OC(=Nc1ccccc1)c1cc(N=C(O)N2CC[C@H]3CCC[C@H]32)ccc1Cl 330231073 DUXVALVDEXMTTI-AUUYWEPGSA-N 383.879 5.396 30 20 GKED N#C[C@@H](C(=O)c1cncs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 429689373 OBQXLUPXSQJQOW-JTQLQIEISA-N 380.281 5.063 30 20 GKED COc1ccccc1-c1nnc(S[C@@H]2CC[C@@H](C#N)C2)n1-c1ccc(C)cc1 430145836 KAGWQHZHNXJYHJ-SJLPKXTDSA-N 390.512 5.036 30 20 GKED CN(c1ccccc1)c1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cn1 430641231 LQFHARALNXIPTG-QGZVFWFLSA-N 390.512 5.094 30 20 GKED Cc1c(Br)cccc1NC(=O)N[C@H](CCCC#N)c1ccccc1 432868323 YIKHOGNIIPDRBJ-GOSISDBHSA-N 386.293 5.314 30 20 GKED Cc1ccc(C(C)C)c(OCc2ccc(NC(=O)N(C)CC(C)(C)C#N)cc2)c1 432947332 GSEDGQCNRHZPJB-UHFFFAOYSA-N 393.531 5.711 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(N2CCCCCC2)c1)c1ccccc1 432950832 SFSMVEPBALBLQE-QHCPKHFHSA-N 390.531 5.624 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(-c2ccccc2)ns1)c1ccccc1 432965314 MJJYPZIVFLXEDW-GOSISDBHSA-N 376.485 5.367 30 20 GKED C[C@H]1CCC[C@@H](C)CN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 437744999 LQTUWEGTCUEYBK-MOPGFXCFSA-N 391.515 5.374 30 20 GKED C[C@@H](c1ccco1)N(C(=O)Nc1ccc(Oc2ccccc2C#N)cc1)C1CC1 444396706 OMBPJSNUAOVKMG-INIZCTEOSA-N 387.439 5.701 30 20 GKED C=CCCCCNC(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 446204203 CNAHLMMXGXURLN-KRWDZBQOSA-N 399.560 5.064 30 20 GKED Cc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)nn1C(C)C 448935724 BBQZCCSHQSLZKI-UHFFFAOYSA-N 396.438 5.049 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1cccc(C)n1)c1ccc(C(F)(F)F)cc1 458580851 RJYFMUPDWHERJC-LJQANCHMSA-N 391.437 5.258 30 20 GKED CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458831176 GQMZOFRLFXXMJF-FCHUYYIVSA-N 381.495 5.599 30 20 GKED CCc1cccc2c(C3CCN(C(=O)[C@H](C)c4cccc(C#N)c4)CC3)c[nH]c12 461924815 YCLFFEBPHYWBQW-QGZVFWFLSA-N 385.511 5.112 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@]1(C)CCc2ccccc2C1 463102717 FQGQYCFCNMKTGP-RUZDIDTESA-N 397.478 5.188 30 20 GKED CC(C)(C)c1cc(NC(=O)[C@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)c(C#N)s1 464402105 XHFHWBPVRXHKRC-MNOVXSKESA-N 378.419 5.077 30 20 GKED N#C[C@H](C(=O)c1ccccc1Oc1ccccc1)c1cc(C(F)(F)F)ccn1 464412698 UJXYIKASKKZIDP-KRWDZBQOSA-N 382.341 5.383 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(Cl)c(C)c3)n2)cc1 469559645 AHCYUVOCBGOJQI-INIZCTEOSA-N 382.872 5.271 30 20 GKED CC(=O)c1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 481793510 GWZMKCQTKNGRAI-UHFFFAOYSA-N 392.402 5.166 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](c1cccc2ccccc12)C(F)(F)F 482429505 AGCFDJSMMMMNCW-FQEVSTJZSA-N 397.400 5.156 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(C4CC4)on3)cc2Cl)cc1 491030537 WLAMSDUBCXVFEO-UHFFFAOYSA-N 379.803 5.122 30 20 GKED CC(C)n1ncc(C(=O)Nc2ccc(Oc3ccccc3)c(C#N)c2)c1C1CC1 494040126 WVECOIBIRJZQDJ-UHFFFAOYSA-N 386.455 5.258 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 494752787 MGAJUMDNIZECHE-CQSZACIVSA-N 391.393 5.593 30 20 GKED C=CCC[C@@H](NC(=O)CC1(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1 502019782 SPTDUPZYBLWVNF-CQSZACIVSA-N 379.344 5.562 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CC(c3ccccc3)c3ccccc3)CC2)cc1 503895640 XDBKUAIOUNGGCH-UHFFFAOYSA-N 392.502 5.396 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccccc1 504289549 MUKUUKXCLCANBA-SFHVURJKSA-N 387.458 5.170 30 20 GKED C=CCCc1ccccc1NC(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1 505057301 ICMADDVBOAVDCF-JOCHJYFZSA-N 391.559 5.181 30 20 GKED CCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 510902135 JSMGOCKWTBZHTK-UHFFFAOYSA-N 385.467 5.713 30 20 GKED CCCCS[C@@H](C)C(=O)N(Cc1cccc(C#N)c1)c1ccc(F)cc1C 515810091 MNVPOAAXAWBLAR-KRWDZBQOSA-N 384.520 5.461 30 20 GKED C=CC1CCN(C(=O)c2ccsc2NC(=O)c2ccc(C(C)C)cc2)CC1 517703042 YKQIKMFHEQFWPE-UHFFFAOYSA-N 382.529 5.162 30 20 GKED N#CCc1ccc(NC(=O)Cc2cccc(OCc3cccc(Cl)c3)c2)cc1 518557781 PNDNJXPXBXUGDL-UHFFFAOYSA-N 390.870 5.166 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(c2ccc(Cl)cc2)CC1 520940253 KIBJGZGKCHGJHZ-OAHLLOKOSA-N 399.947 5.588 30 20 GKED N#Cc1ccc(OCc2cccc(C(=O)Nc3ccc(-c4cnco4)cc3)c2)cc1 522314863 XWMDCNFVYFSWEK-UHFFFAOYSA-N 395.418 5.045 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 522434558 KORBSLXFGJFKDD-NQIIRXRSSA-N 397.478 5.760 30 20 GKED N#C[C@H](NC(=O)CCCc1ccc(Cl)cc1)c1cccc(Cl)c1Cl 524572863 ZBVXRXQDACGXCE-INIZCTEOSA-N 381.690 5.351 30 20 GKED C=CCCO[C@H](C)C(=O)N(Cc1ccc(-c2ccccc2OC)cc1)C(C)C 525081057 ZOFLANVMKFPCFG-LJQANCHMSA-N 381.516 5.080 30 20 GKED Cc1ccc(C(=O)N[C@@H](C)c2ccc(C#N)cc2)cc1NC(=O)Nc1ccccc1 525471945 PPPOZDYFIQMOLT-KRWDZBQOSA-N 398.466 5.002 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(C(F)F)c2F)cc1 528920953 WAAIUASRYCFUMP-PXAZEXFGSA-N 388.389 5.238 30 20 GKED CC(C)N(CC(F)F)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 533184310 ILCGWMSRWRINMV-UHFFFAOYSA-N 378.806 5.120 30 20 GKED N#CC1(c2ccccc2)CCC(NC(c2cccs2)c2cccs2)CC1 540183444 SFCQUAWRQHVYPB-UHFFFAOYSA-N 378.566 5.893 30 20 GKED N#CCC[C@H](NC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1 543068050 DFIGBDHUCKTMLB-SFHVURJKSA-N 388.298 5.327 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)C[C@H]1CC=CCC1 544250082 WDQHCVPYWSAOLL-IBGZPJMESA-N 389.499 5.266 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1F 551205304 JDGSSGABTDDAQE-IFXJQAMLSA-N 375.285 5.674 30 20 GKED CC(C)(C#N)CCN1CCCc2c(NC(=O)Nc3ccccc3F)cccc21 557966552 PFSCTEVPBSUVCY-UHFFFAOYSA-N 380.467 5.162 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc3cc(Br)cnc23)cc1 561046078 CHUVICBWEIVWII-UHFFFAOYSA-N 394.272 5.051 30 20 GKED CC(C)(C#N)c1ccccc1CN1CCO[C@@H](c2ccccc2C(F)(F)F)C1 566757403 GXJKQKGEGGKNTR-HXUWFJFHSA-N 388.433 5.080 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1csc(-c2ccc(Cl)cc2)n1 603527286 HNTQERDCGSOYLJ-UHFFFAOYSA-N 395.915 5.386 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc3ccccc3[nH]2)cc1Cl 603759227 YOGANUVEAZKPEU-IBGZPJMESA-N 385.854 5.729 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCSc3ccccc3F)cn2)cc1 603763883 ANNIVLXRVPYVMY-UHFFFAOYSA-N 393.443 5.006 30 20 GKED N#Cc1cnc(NCc2cn(Cc3ccccc3)nc2-c2ccccc2)c(Cl)c1 608885350 XPBJPBCOLIXWTO-UHFFFAOYSA-N 399.885 5.131 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N(Cc3ccco3)c3ccccc3)o2)cc1 609055636 LMPVZZJKBGRULD-UHFFFAOYSA-N 398.418 5.170 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C3CC3)cc2Cl)cc1 609137811 FMIZCHWTEQKOQJ-IBGZPJMESA-N 381.863 5.410 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 609297084 FTJQRIAGBOJOBC-HNNXBMFYSA-N 392.405 5.462 30 20 GKED N#Cc1cccc(OCCCCC(=O)N(Cc2cccc(F)c2)C2CCCC2)c1 609499680 XEVTTZIRROPDMX-UHFFFAOYSA-N 394.490 5.218 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cccc(OC2CCCCC2)c1 609971123 HUFIUBVVQFTGJI-UHFFFAOYSA-N 380.513 5.656 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 609987463 FEKYGLGUBHIVEG-UHFFFAOYSA-N 398.466 5.293 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)Cc2ccc(C#N)cc2)nc1-c1ccccc1 610294511 LZUJABASUCUKRB-OAQYLSRUSA-N 399.494 5.243 30 20 GKED CCCCc1ccc(C(=O)CCC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 613590315 BGUDSMXSGCFONA-UHFFFAOYSA-N 376.500 5.432 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1cn(Cc2ccccc2)c2ccccc12 618741559 GAWWSXDYKNHQRE-VWLOTQADSA-N 377.491 5.338 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 618891715 CSXFYXJAESBEGX-ZCNNSNEGSA-N 399.519 5.021 30 20 GKED C=C(C)Cn1c(-c2c[nH]c3ccccc23)nnc1N1CCC[C@@H]1c1ccc(O)cc1 642725770 HDGZOGMZZIQHAZ-JOCHJYFZSA-N 399.498 5.050 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)C3CCCCC3)n2)cc1 726324455 AFPMVYQZZJWIOE-HNAYVOBHSA-N 382.529 5.601 30 20 GKED Cc1cc(Br)ccc1NC(=S)Nc1ccc(C#N)c(Cl)c1 726440032 PZDLTYLISMCYIP-UHFFFAOYSA-N 380.698 5.092 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 727784207 BYDNHHLHTNPVQQ-NEPJUHHUSA-N 396.657 5.236 30 20 GKED C#Cc1cccc(N(C(=O)c2cc(-c3ccncc3)nc3ccccc23)C(C)C)c1 728247786 QXZDIQCUDLPKAK-UHFFFAOYSA-N 391.474 5.333 30 20 GKED Cc1cc(COc2ccc(/C=C/C(=O)c3ccccc3Cl)cc2)oc1C(=O)O 729936549 DEFWOXJBBIOHOW-DHZHZOJOSA-N 396.826 5.415 30 20 GKED O=C(/C=C\c1ccc(OCc2occc2C(=O)O)cc1)c1cc2ccccc2o1 730950935 HQCASTGJPUTFSE-YFHOEESVSA-N 388.375 5.199 30 20 GKED CCc1cccc2c(CC(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)c[nH]c12 731767796 KXHPBJNHZMIECJ-MRXNPFEDSA-N 393.899 5.412 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)s1 733080945 HGFOBLRAWYQHCT-PLNGDYQASA-N 376.846 5.329 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1cccs1)Cc1cccs1)c1ccncc1 734682380 CDFLIMDUENKPBT-LJQANCHMSA-N 383.542 5.234 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCOc4ccccc43)n2)cc1 735594369 YDXYQNDEXVPTOD-IEBWSBKVSA-N 388.492 5.251 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(c4ccccc4F)CC3)n2)cc1 737323701 XAMYGDKTFDBSAE-MRXNPFEDSA-N 376.456 5.166 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)o2)cc1 744016812 UMFIOKZEIZSXOG-IBGZPJMESA-N 396.446 5.504 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccccc1F)C1CCCCC1)c1ccncc1 745828653 VOFYHWOMFJXBEE-JOCHJYFZSA-N 381.495 5.382 30 20 GKED O=C(CSC(F)(F)F)O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 750216207 IKELQDRXFLDTHV-SECBINFHSA-N 386.235 5.105 30 20 GKED COc1cccc(/C=C2/CCc3cc(SC(F)F)ccc3C2=O)c1OC 750915977 JOXWTSLAMLUCOH-RAXLEYEMSA-N 376.424 5.231 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C\c2cnc(-c3ccncc3)s2)cc1 753143904 LDDBZRDAZIADTE-SREVYHEPSA-N 382.872 5.233 30 20 GKED C=CCCC[C@H](C)OC(=O)c1cn(C2CC2)c2cc(Cl)c(F)cc2c1=O 765496991 QGJFWSDYBDNEIB-LBPRGKRZSA-N 377.843 5.031 30 20 GKED CCCCCCCC[C@@H](C)CC(=O)N1CCC(c2nnc3n2CCCC3)CC1 772962832 GRFGYELVDKXXKZ-LJQANCHMSA-N 388.600 5.097 30 20 GKED FC(F)(F)c1ccccc1ON=Cc1ccc(Br)c2cccnc12 777887938 MJYKDLWXRQPSAA-UHFFFAOYSA-N 395.178 5.429 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@H](F)Cc1ccccc1 777990914 BCHSXZKFDYEPCS-OAHLLOKOSA-N 396.409 5.230 30 20 GKED N#CCCCOc1cccc(CNc2ccc(OCc3cccc(C#N)c3)cc2)c1 779594364 IHKVLLDGHUYOOV-UHFFFAOYSA-N 397.478 5.432 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cc(Cl)cc(Cl)c2)cn1 792885017 NGXPADYMNYOKQW-SREVYHEPSA-N 385.250 5.355 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)cnc2Cl)cc1 793044814 TXDFFGZVVLJIRW-NRFANRHFSA-N 387.870 5.520 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(OCC(F)(F)F)c(Cl)c2)ccc1Cl 800130002 BMSHLVSQFHCILA-UHFFFAOYSA-N 389.160 5.058 30 20 GKED CC(C)CCn1c(COc2ccccc2)nnc1SCC1(C#N)CCCC1 806586249 VGQXDLLIRDCOPS-UHFFFAOYSA-N 384.549 5.079 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ccc(C#N)cc2F)cc1OCC 809844150 VUCUIPAGCOVUSZ-UHFFFAOYSA-N 390.842 5.089 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)c(F)cc2Cl)cc1 815009771 CNARYELWLNMUID-KRWDZBQOSA-N 399.252 6.040 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)cc2C(F)(F)F)c1 858379081 VLUJDJVQFZTWAP-BBRMVZONSA-N 380.385 5.376 30 20 GKED CC(=O)[C@@](C#N)(CCN(C)[C@H](C)c1sc(C(C)C)nc1C)c1ccccc1 878301802 CEYOYNNKAWOIFZ-VGSWGCGISA-N 383.561 5.008 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC([C@@H](O)c3ccccc3)CC2)cc1 914787998 JBSNYWPPUAVUGL-SANMLTNESA-N 382.507 5.171 30 20 GKED Sc1nnc(-c2cccs2)n1N=Cc1ccc(-c2ccc(Cl)cc2)o1 916314201 OXDVBHRUSKHOQK-UHFFFAOYSA-N 386.889 5.091 30 20 GKED N#C[C@H](C(=O)COc1ccccc1Cc1ccccc1)c1ccc2ccccc2n1 916848152 CSQUIPMPQYTBGS-QFIPXVFZSA-N 392.458 5.081 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1sc2ccccc2c1Cl 916904869 FNSYIRGVEOGXHD-LLVKDONJSA-N 389.263 5.169 30 20 GKED FC(F)(F)c1nc(NN=Cc2c(Cl)cccc2Cl)c2ccccc2n1 917215579 VDHJSLXQWHSEBZ-UHFFFAOYSA-N 385.176 5.401 30 20 GKED CC(C)Cc1ccc(CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 920140256 DFVIOSPGDQPEAM-NRFANRHFSA-N 399.519 5.299 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(Oc3cccc(Cl)c3)cc2)ccc1F 1776064276 GOPMRJBPUFBCAK-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CC(C)COc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776126693 UNFVQRLRPMAQPU-VQHVLOKHSA-N 398.455 5.670 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3csc(C(=O)O)c3)ccc21 1777002823 HWJWMBDEYKHLBJ-NTMALXAHSA-N 375.449 5.470 30 20 GKED C[C@H](SCc1ccc(Cl)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 22694816 FZBOTEXBYVQGEW-NSHDSACASA-N 376.934 5.022 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66801342 JFQWFJYDHWHPDH-AWEZNQCLSA-N 393.537 5.765 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 66956271 MYVYKDZXIFLRKT-XLIONFOSSA-N 379.529 5.758 30 20 GKED C=CCN(C(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)c1ccccc1 71846318 RVRHDJQQYKWNSK-UHFFFAOYSA-N 377.465 5.019 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@@H](C)CC)cc2)nnc1-c1ccoc1C 104598579 SCZDNARTMGYOCA-HNNXBMFYSA-N 395.528 5.521 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)[nH]c2c1C(=O)CC(C)(C)C2 108998794 DSMMSPLSCMMZAT-CYBMUJFWSA-N 395.528 5.125 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(OCc3cccs3)c2)cc1 116101279 AFMJUOOIRWKRJR-UHFFFAOYSA-N 376.481 5.196 30 20 GKED CN(Cc1cccnc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 122906976 XXVGCWUKURCPOK-HXUWFJFHSA-N 390.874 5.054 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)Nc2cccc(O)c2F)c1 129571467 PUYYVVAMRZGCNM-UHFFFAOYSA-N 382.778 5.101 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1cccnc1 133962405 UTLCYFNLZXXJMX-MRXNPFEDSA-N 392.528 5.013 30 20 GKED COc1ccc(CN(C(=O)N[C@H](CCC#N)c2ccccc2)[C@H](C)C2CC2)cc1 160619813 JXGCVVXSMMVELQ-WZONZLPQSA-N 391.515 5.050 30 20 GKED CO[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccccc1 170974813 LGWKIODIOSKXSE-QGZVFWFLSA-N 394.418 5.037 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)N2CCC(C#N)CC2)cc1 171507183 DXRGDWCYNVKLMC-UHFFFAOYSA-N 399.878 5.298 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1ccc2c(c1)OCCO2 189871764 NZFMFKSLNPQDBA-WOJBJXKFSA-N 377.484 5.052 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccccc2Cl)C1 191442972 WJAVOGRQGVCUPI-OAQYLSRUSA-N 398.934 5.797 30 20 GKED CSc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 195595243 NLTSKZKHMVTLBS-IBGZPJMESA-N 392.911 5.970 30 20 GKED COc1cccc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)c1 212565132 AMGKDLPDSKAIGU-SEYXRHQNSA-N 391.854 5.497 30 20 GKED C[C@H]1CCCCN1Cc1ccc(CNCc2cccc(OCCCC#N)c2)cc1 237525753 DOGSBWHWMGAHAE-NRFANRHFSA-N 391.559 5.033 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1Cl 255658877 YPKGHBBICPCPSF-HCYCVZQXSA-N 385.801 5.365 30 20 GKED O=C(/C=C\c1csc(-c2cccs2)n1)c1c(Cl)nc2sccn12 255896294 VSWIHXYRZJQIKC-ARJAWSKDSA-N 377.903 5.130 30 20 GKED Cc1nc2sccn2c1-c1nc(-c2cn(CCC#N)c3ccccc23)cs1 303322090 RLXQIEPZBVGHJN-UHFFFAOYSA-N 389.509 5.363 30 20 GKED CC(C)[C@H](/N=C(/O)N1[C@H]2C=C(c3ccnn3C)C[C@H]1CC2)c1ccccc1Cl 328697784 LLHRGDJCXJAQOC-LZJOCLMNSA-N 398.938 5.005 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 430592975 OADHEEMXELQZQJ-WMZOPIPTSA-N 391.540 5.536 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(-c2nccs2)c1)c1ccccc1 432921960 IGQQUKDGZIDZKS-LJQANCHMSA-N 376.485 5.367 30 20 GKED C=CCN(CCC#N)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 432966707 MOCAIEHMWDDUMP-UHFFFAOYSA-N 389.377 5.431 30 20 GKED CC(C)[C@@H](CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccnc1 434172688 KDSOSORWYSWWEY-XMMPIXPASA-N 399.494 5.110 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1cc(C#N)oc1C 435683870 SMKRZYOMAUWUNJ-SNVBAGLBSA-N 385.876 5.036 30 20 GKED CN(CCc1cccs1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 438047489 CSNLOVAKHUTOEE-UHFFFAOYSA-N 377.469 5.118 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(Oc2ccccn2)cc1 438190564 ODJPCVAEGZLJLC-FGZHOGPDSA-N 398.466 5.178 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(C1CC1)[C@@H](C)c1ccc2ccccc2c1 438451217 QQTAVIAKFPWOBV-LXBDKUERSA-N 378.516 5.056 30 20 GKED C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1 438451219 QQTAVIAKFPWOBV-OAOOKAIFSA-N 378.516 5.056 30 20 GKED CC(C)[C@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1ccc(C(F)(F)F)cc1 438861638 JIHQPVLDUXSKJU-IBGZPJMESA-N 389.421 5.116 30 20 GKED C=CCC[C@H](NC(=O)C[C@@H](C)c1cccnc1)c1ccc(C(F)(F)F)cc1 441592465 ULEXVXISWSITDP-BEFAXECRSA-N 376.422 5.418 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@H]1c1ccc[nH]1)c1ccc(C(F)(F)F)cc1 442289167 FQLWXZLEYQDOBX-HKUYNNGSSA-N 391.437 5.588 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1cccc(OCc2ccccc2C#N)c1 443120812 WKLVYBVKQZHAKZ-UHFFFAOYSA-N 376.843 5.351 30 20 GKED N#Cc1ccc(NC(=O)C2(c3cccc(C(F)(F)F)c3)CC2)cc1C(F)(F)F 443884782 YTTZAVKKTWQZOI-UHFFFAOYSA-N 398.306 5.266 30 20 GKED Cc1ccc2sc(N(Cc3ccccc3)C(=O)CC(C)(C)C#N)nc2c1C 447131600 HUDULXDLYNCJAB-UHFFFAOYSA-N 377.513 5.386 30 20 GKED C[C@H](C(=O)N1CCC(c2ccccc2C(F)(F)F)CC1)c1cccc(C#N)c1 462258442 PUTJMHXENXHVIR-HNNXBMFYSA-N 386.417 5.087 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCc1cc(C#N)ccc1F 466194404 LOIHZJUUEHYQKS-INIZCTEOSA-N 393.487 5.232 30 20 GKED Cc1ccc(-c2nc(NC(=O)C3(c4ccc(C#N)cc4)CC3)sc2C)s1 467248482 LRYWMOIZRDBJHN-UHFFFAOYSA-N 379.510 5.030 30 20 GKED COc1ccc([C@H](NCc2ccc(F)c(C#N)c2)c2ccccc2Cl)cc1 467758640 JRSSRARDBPOAOG-QFIPXVFZSA-N 380.850 5.239 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@H](C)c1ccc(C#N)cc1 468316321 MWVAXXHWLQHPEF-ZWKOTPCHSA-N 376.504 5.128 30 20 GKED CC[C@H](CC#N)NC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 475002022 QFWWJFCUAJTEQY-SNVBAGLBSA-N 399.360 5.174 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(-c2cccnc2)c1 475583263 PNCWEZBQPOEASQ-UHFFFAOYSA-N 385.511 5.922 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2F)c1 475602246 KULIFDMZSXGJLO-UHFFFAOYSA-N 391.427 5.071 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CC(=O)N(c2cccc(C)c2C)C1 476082138 WWLUGBFQDHJKOW-HXUWFJFHSA-N 390.527 5.147 30 20 GKED CSc1ccc(CS[C@@H](C)C(=O)N(CCC#N)c2ccc(F)cc2)cc1 478763993 JRCSVIXEBIYZFF-HNNXBMFYSA-N 388.533 5.116 30 20 GKED C=CCC1(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CCC1 479627456 FLLSPYGZNHHMON-INIZCTEOSA-N 380.463 5.002 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)N[C@@H](CC(C)(C)C)c1ccccc1 480518677 NBQANUFHMKJFHS-NRFANRHFSA-N 384.520 5.037 30 20 GKED CC(C)OCCOCc1cccc(N[C@@H]2CCCCc3cc(C#N)ccc32)c1 481997567 INRBYRWNFNAMNM-XMMPIXPASA-N 378.516 5.379 30 20 GKED C[C@H](Oc1ccc(C(F)(F)F)cc1)C(=O)N[C@H](CCCC#N)c1ccccc1 487498940 GSBRGRQVALHLRB-HNAYVOBHSA-N 390.405 5.024 30 20 GKED N#Cc1cc(F)ccc1CSCc1nc(-c2cccc(C(F)(F)F)c2)no1 488491666 JTGLTFSYDRCWDN-UHFFFAOYSA-N 393.365 5.200 30 20 GKED CCOc1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1Cl 491976479 HYQXHZLXYGRRCP-OAHLLOKOSA-N 397.887 5.056 30 20 GKED C/C(=C/c1ccccc1)CN(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 494261099 BZYCPSQXROUXSL-VZWFDDOASA-N 393.556 5.055 30 20 GKED C[C@H](CC(=O)N[C@H](C#N)c1ccccc1Cl)c1ccc(C(F)(F)F)cc1 499958791 PRQMXOFEACVNJM-SJKOYZFVSA-N 380.797 5.233 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)oc2ccc(Cl)cc12 503874119 NZRMISGRKRZTJW-UHFFFAOYSA-N 376.843 5.196 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1C[C@H](c2ccc(OC)c(F)c2)C1 504794115 OTBHMVJBKZFCSN-WGSAOQKQSA-N 396.506 5.754 30 20 GKED N#CCCN(C(=O)c1ccc(Cl)c2ncccc12)C12CC3CC(CC(C3)C1)C2 509304329 RABDBIJZNATHNB-UHFFFAOYSA-N 393.918 5.213 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C2(c3cccc(C)c3)CCCCC2)cc1 511009218 FCEYLJXEZBAXBO-UHFFFAOYSA-N 391.515 5.143 30 20 GKED CC(=O)c1oc2cc(C)ccc2c1CC(=O)N(CC(C)C)c1ccc(C#N)cc1 512494137 NDNNLFHGWKFJCZ-UHFFFAOYSA-N 388.467 5.047 30 20 GKED COc1ccc2c(c1)CN(C(=O)NCC(C)(C)CCC#N)[C@@H](C1CCCCC1)C2 513141651 SWFJPAAGEZQKJH-JOCHJYFZSA-N 397.563 5.042 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 514559793 LVCZRWWTQHDUKN-UHFFFAOYSA-N 375.472 5.052 30 20 GKED CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)N(CCC#N)CC(C)(C)C)c1 525138859 SMONNPKEGFOTHA-UHFFFAOYSA-N 391.943 5.117 30 20 GKED Cc1cc([C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C2CC2)ccc1F 534036603 RCXLORBNFLASBN-SPLOXXLWSA-N 397.519 5.659 30 20 GKED N#CCCCOc1cccc(N[C@@H]2CCCc3nc(-c4ccccc4)sc32)c1 538526721 WZPZWAAYBNYLHO-HXUWFJFHSA-N 389.524 5.982 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 549372157 MKWSMSHUMGYYBO-UHFFFAOYSA-N 389.474 5.459 30 20 GKED CN1CC[C@@H](NCc2ccc(-c3ccccc3C#N)cc2)C[C@@H]1c1ccccc1 551087212 NDPQEJHVBQMAJH-AOYPEHQESA-N 381.523 5.150 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC[C@H](c2cccc(F)c2)C1 558330315 DKJQPLXOYUYFDN-IBGZPJMESA-N 386.426 5.119 30 20 GKED C[C@H](SCc1ccccc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 564517370 MXWQXLLYIJNZMA-INIZCTEOSA-N 389.480 5.006 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1ccccc1C#N)c1ccc(Cl)cc1Cl 567038728 HTHQDZHITBQJEG-NWDGAFQWSA-N 379.312 5.223 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC[C@H]2CCOc3ccccc32)cc1 567398295 RTKSLNMOWXERGG-GOSISDBHSA-N 399.450 5.038 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(N=S2(=O)CCCC2)cc1)c1ccccc1 572256458 MRNUGWDMFZCWIK-OAQYLSRUSA-N 382.529 5.268 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@]1(C)OCCc2sccc21 574609182 UYUMIMDQUNXVOH-QFIPXVFZSA-N 384.545 5.210 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)[C@@H]1C1CC1 579897829 MAFZMMGKHPCMKI-HXUWFJFHSA-N 379.435 5.142 30 20 GKED CC(C)(C)C(=O)N1CCC(CNc2ccc(Oc3ccccc3)c(C#N)c2)CC1 582075529 CUHYYIFIMIUNGR-UHFFFAOYSA-N 391.515 5.047 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)Cc2ccc(SC)c(OC)c2)c1 589738799 AAFRWPGAESNNGN-UHFFFAOYSA-N 386.517 5.036 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)c1ccc(C(F)(F)F)cc1 595570429 ZOSKURPUHUMUNQ-YJBOKZPZSA-N 379.426 5.048 30 20 GKED C=CCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)[C@H](C)COC 596691126 IQFQXNGCALWWTI-OXQOHEQNSA-N 397.906 5.050 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cc4ccc(F)cc4s3)n2)cc1 604468089 GSJVFKYPVVRNIE-UHFFFAOYSA-N 379.441 5.288 30 20 GKED C=CCCCN(C)C(=O)c1c(C)n(Cc2ccccc2)c2ccc(OC)cc12 606202922 XLRQPSQJKGRNJJ-UHFFFAOYSA-N 376.500 5.045 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CSCCC(C)C 609060550 HWVVULSRZVRROC-UHFFFAOYSA-N 382.529 5.164 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)c(F)c1 609252933 JOXGCXZWPHYEJW-LJQANCHMSA-N 399.878 5.001 30 20 GKED COc1ccc(-c2cc(C(=O)Nc3cc(C#N)cn3C(C)(C)C)sc2C)cc1 609358775 XDCUWUWMNJONOS-UHFFFAOYSA-N 393.512 5.413 30 20 GKED CC(C)c1ccccc1OCCNC(=O)Nc1ccccc1SC[C@H](C)C#N 609555377 GZODERWKCKLCPL-QGZVFWFLSA-N 397.544 5.262 30 20 GKED CC[C@@H](C)N(Cc1ccccc1)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609744592 RZQDPUIATSDCRZ-ZWKOTPCHSA-N 381.545 5.771 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)CCC2)c1nc(-c2ccc(Cl)cc2)cs1 613319169 SUDITNKSCDMMJM-SFHVURJKSA-N 378.884 5.442 30 20 GKED CC[C@]1(C)Oc2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cc2O1 615486582 CZBKABZHCOCCSH-GOSISDBHSA-N 377.227 5.015 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618843264 VOETXYZGZVHMNO-DEOSSOPVSA-N 381.479 5.054 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc(F)cc2ccncc12 619128248 HAIFZRXTKPKYBY-UHFFFAOYSA-N 396.306 5.157 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccccc1SCc1ccco1 620863670 PIFNNGOZWQESTL-UHFFFAOYSA-N 377.509 5.443 30 20 GKED C=CCN(C(=O)c1ccncc1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891464 NWOJGDZVMUEKEA-UHFFFAOYSA-N 397.503 5.705 30 20 GKED O=C(Nc1ccc(CCC(F)(F)F)cc1)N1CCC2(CC1)C(F)(F)C2(F)F 650072064 IEOKAUYPMQHRDF-UHFFFAOYSA-N 398.322 5.080 30 20 GKED COc1cc(/C=C2/Cc3c(F)cc(Br)cc3C2=O)ccc1SC 727780365 MEGCFGHQLXGXAX-WZUFQYTHSA-N 393.277 5.141 30 20 GKED N#Cc1ccc(OC2CCN(Cc3cc4oc5ccccc5c4cc3O)CC2)cc1 728903355 LXWAKZQFGIALIO-UHFFFAOYSA-N 398.462 5.207 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 732696468 JMQKDBJOXMFZQF-DEOSSOPVSA-N 387.527 5.942 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)C[C@@H](C)c2cccc(F)c2)cc1 734965976 RWKUEMUDBUYGJV-GCKMJXCFSA-N 380.463 5.180 30 20 GKED CC[C@H](Sc1nc(O)c(C#N)c(-c2ccc(OC)cc2)n1)c1ccc(F)cc1 737398891 VTIYIGVJZOKPKI-SFHVURJKSA-N 395.459 5.112 30 20 GKED Cc1ccc([C@@H](C)NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)s1 740058213 UDMISUUTRBCKTM-CQSZACIVSA-N 381.526 5.217 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 740435548 PVFSWQSVIQHLEF-BJKOFHAPSA-N 398.510 5.742 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1 743038252 XBMFJNHIYIGVLL-UHFFFAOYSA-N 388.427 5.170 30 20 GKED CC(=NNc1cncc(Cl)n1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750937561 LDARSDWSWXAQRB-UHFFFAOYSA-N 382.695 5.004 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc1 751517828 OFXGZPPKGAEXGS-QPJJXVBHSA-N 377.494 5.262 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2cn(C(C)(C)C)nc2C)cc1 768279188 KYJXPNATMIIUNJ-JKSUJKDBSA-N 375.944 5.490 30 20 GKED Cc1nc([C@@H](C)OC(=O)Cc2ccccc2CC#N)oc1-c1ccc(Cl)cc1 777162464 FMYUBBCAESPKAS-OAHLLOKOSA-N 394.858 5.216 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)[C@@H](O)c1c(Cl)cccc1Cl 777177491 FENPADQGKDMUKH-KZULUSFZSA-N 396.339 5.123 30 20 GKED O=C1/C(=C/c2ccc3cnccc3c2)CSC/C1=C/c1ccc2cnccc2c1 782314224 QXJFRARSXWGFNI-QEUMEHMPSA-N 394.499 5.566 30 20 GKED Cc1c(C(=O)N[C@@H](C)c2nc3ccccc3s2)sc2ccc(C#N)cc12 794329377 RETGSVGXKKKKLM-LBPRGKRZSA-N 377.494 5.182 30 20 GKED C#CC[C@H](NC(=O)N1CCC([C@@H](F)c2ccccc2F)CC1)c1ccccc1 805234868 SHGQYATUOIIGSA-FCHUYYIVSA-N 382.454 5.023 30 20 GKED CC(C)[C@@H](c1ccc(Cl)cc1)c1noc(Cc2cccc(OCC#N)c2)n1 809499682 SMHBYKORYGEXPF-FQEVSTJZSA-N 381.863 5.004 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)C1 813217334 KNPHBYFZITYEAT-NJAFHUGGSA-N 396.453 5.432 30 20 GKED CC(=NNc1nc2cc(F)c(F)cc2[nH]1)c1sc(-c2ccccc2)nc1C 814796531 YJDRSGINEBCISV-UHFFFAOYSA-N 383.427 5.109 30 20 GKED N#CCCC[C@@H](NC(=O)/C=C\c1ccccc1OC(F)(F)F)c1ccccc1 817319829 SHTYMBIVINYVCL-SWNWVQGVSA-N 388.389 5.150 30 20 GKED Cc1c(NCc2ccc(N(C)CCC#N)cc2)cccc1NC(=O)OC(C)(C)C 858233295 KDPKPHDCTJFGMH-UHFFFAOYSA-N 394.519 5.304 30 20 GKED CC1(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)CCC(F)(F)CC1 860507377 TZBXCAMVLMZXJV-LLVKDONJSA-N 396.409 5.480 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 914864437 SMZXKKIRFJERKY-UHFFFAOYSA-N 393.786 5.164 30 20 GKED COc1cc(/C=C\C(=O)c2cccc(OCc3ccccc3)c2)ccc1OCC#N 915989051 VRXDIMSDLODHAY-BENRWUELSA-N 399.446 5.073 30 20 GKED O=C(/C=C/c1ccc2ncccc2c1)c1cc2cc(Br)ccc2o1 916130248 LNMQOQXCOFQLMT-QPJJXVBHSA-N 378.225 5.640 30 20 GKED CC(C)Cc1ccc(CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917040571 MSRVQNXXVZNOSL-KRWDZBQOSA-N 381.426 5.049 30 20 GKED N#C[C@@H](C(=O)C1(c2ccc(F)cc2)CCCC1)c1nc2cc(Cl)ccc2s1 917043557 JRCJEAIZROVPTD-INIZCTEOSA-N 398.890 5.777 30 20 GKED N#C[C@H](C(=O)Cc1ccc2c(c1)CCCC2)c1nc2cc(Cl)ccc2s1 917044014 OEDJHRNJTPLNAO-QGZVFWFLSA-N 380.900 5.247 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCOc3cccc(F)c3)n2)cc1 918490769 VUZKJWGPTCCVQE-LJQANCHMSA-N 394.471 5.293 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 919909998 FYDWLCXBWYCDCH-INIZCTEOSA-N 391.496 5.912 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3ccc(Cl)cc3)cs2)cc1 920062979 MDLZUMWIJHEQFP-WDZFZDKYSA-N 385.872 5.280 30 20 GKED N#Cc1cccc(OCC(=O)Nc2ccccc2Oc2ccc(Cl)cc2)c1 920224183 XKBNMOSRBPWNGP-UHFFFAOYSA-N 378.815 5.021 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(OC(F)F)ccc2ccccc12 1776784091 QEOSKCJQUGCQHL-QGZVFWFLSA-N 393.474 5.735 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3ccc4oc(C(=O)O)cc4c3)oc12 1776940540 JCBSQHYNYFNGAC-VURMDHGXSA-N 376.364 5.172 30 20 GKED O=C(O)COc1ccc(/C=C2\CCc3c(sc4ccccc34)C2=O)cc1Cl 1777645737 BHRDCZWECSYCEL-UKTHLTGXSA-N 398.867 5.231 30 20 GKED C=CC[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CC=C(C)CC3)CCC2)cc1 1791250568 VNOVCDFVEGKFSA-RTBURBONSA-N 380.532 5.079 30 20 GKED C[C@H](N[C@@H](CCCc1ccccc1)c1ccccc1)C(=O)Nc1ccccc1C#N 12667546 GPNABHVLBWBPNN-RDPSFJRHSA-N 397.522 5.239 30 20 GKED C#Cc1cccc(NC(=O)c2ccccc2-c2ncc(-c3ccc(C)cc3)o2)c1 23182225 HXEDFJPLPJKPNV-UHFFFAOYSA-N 378.431 5.551 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(F)cc2)s1)c1ccc(C(F)(F)F)cn1 41554697 HHYGVVSAOCFYBH-CQSZACIVSA-N 390.361 5.458 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC2CCCC2)cc1)c1nc2ccccc2n1C(F)F 41556577 YMCMZTHFTQRATC-KRWDZBQOSA-N 395.409 5.243 30 20 GKED C[C@@H](Nc1cccc(F)c1C#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1 59420539 OGBSDFOEAIORPI-CQSZACIVSA-N 377.394 5.262 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4c(c3)CCCC4)n2)cc1 66544866 IEUNVOQERSZSHF-HXUWFJFHSA-N 383.476 5.051 30 20 GKED N#C[C@H](C(=O)c1sccc1OC(F)F)c1nc2cc(Cl)ccc2s1 105759491 FNCYCKJBZQROAW-MRVPVSSYSA-N 384.816 5.103 30 20 GKED CSc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 107145750 NJESQJADUMUFEE-UHFFFAOYSA-N 398.484 5.312 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(-c2ccccc2OC)c1 111773716 PWDMGHJQMJNWKF-UHFFFAOYSA-N 397.478 5.454 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 120354447 UVGGYMJDVJAHSI-CQSZACIVSA-N 391.393 5.050 30 20 GKED Cc1ccsc1[C@@H](Cc1ccccc1)NCc1ccc(O[C@@H](C)C#N)cc1 124716128 VAEJCJJMERCFBG-PGRDOPGGSA-N 376.525 5.421 30 20 GKED Cc1nc(CNc2ccccc2S[C@@H](C)CC#N)oc1-c1ccc(Cl)cc1 129978625 VYTVEXXGMBPHOY-AWEZNQCLSA-N 397.931 6.310 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc(-c3ccncc3)nc3ccccc23)n1 131155899 IXZOHDUEEQRGPR-SFHVURJKSA-N 398.491 5.367 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(CC(F)(F)F)cc1 173638010 ROZWBKXYZXKWOF-UHFFFAOYSA-N 375.394 5.107 30 20 GKED C[C@H](c1ccc2ccccc2c1)N(Cc1nnc(-c2ccc(C#N)cc2)o1)C1CC1 173667558 HYZANEQIEKNIDV-QGZVFWFLSA-N 394.478 5.487 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 182055270 DVAMXNSBNJUAKR-ZIAGYGMSSA-N 376.378 5.129 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 189897638 SXWLQBSEJMJYRQ-UHFFFAOYSA-N 393.487 5.299 30 20 GKED O=C(Nc1cccc(/C=C2\Cc3c(O)cccc3C2=O)c1)c1ccccc1Cl 207543098 YSGCETOUDHXGJL-RVDMUPIBSA-N 389.838 5.120 30 20 GKED O=C(/C=C\c1cc(-c2ccccc2)cs1)c1ccc(C(F)(F)F)nc1O 255547223 ZYOLWCXMEAOGTP-VURMDHGXSA-N 375.371 5.431 30 20 GKED C=CCCCCNCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 274632199 ZVSZTOKQGCYUSH-UHFFFAOYSA-N 397.466 5.292 30 20 GKED CS(=O)(=O)c1ccc(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1C(F)F 329280492 MXZZOCZLYYNIKX-MELADBBJSA-N 385.476 5.222 30 20 GKED N=C(O)N1CCCc2ccc(N=C(O)C3CCC(c4ccccc4)CC3)cc21 330319080 RCKZSJDLOBGOMK-UHFFFAOYSA-N 377.488 5.494 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cccc(OCCCC#N)c1 409838127 UUSPUYRVEUTRLT-AWEZNQCLSA-N 391.298 5.493 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 428876156 ZCLATGJTQXIWRU-UHFFFAOYSA-N 394.450 5.283 30 20 GKED C/C(=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1)c1nc(=O)c(C#N)c(C)[nH]1 435337464 WKOCYVYVWHBNEU-JXMROGBWSA-N 386.238 5.077 30 20 GKED C=C(C)[C@@H]1OCC[C@H]1CNC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 436364391 LVRUBUFEIKIMIN-LEDOBFOHSA-N 394.515 5.238 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)CCCC1(C)C 445239866 SMONNEOUXUZVES-OAQYLSRUSA-N 397.563 5.266 30 20 GKED CN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 459007089 JOXNUXGZUCMRIJ-JHVJFLLYSA-N 399.897 5.292 30 20 GKED CCC(CC)N(C(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H]1CCCc2cccnc21 464479555 IUFKNPFLDRSFPU-HTAPYJJXSA-N 375.516 5.152 30 20 GKED COc1ccc(-c2cnc(CNc3cccc(Oc4ccc(C#N)cc4)c3)o2)cc1 467270502 ZNBPHQWRXFFGCT-UHFFFAOYSA-N 397.434 5.626 30 20 GKED COCCCC[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 471178648 SAQVRIDYNHBUHI-OAQYLSRUSA-N 379.504 5.167 30 20 GKED O=C(Cc1ccccc1F)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474260291 RSLZVGPGGZZIGU-OAHLLOKOSA-N 393.302 5.197 30 20 GKED Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)Nc1cccc(OCCCC#N)c1 474335054 CMMPVIQICRUEGL-SFHVURJKSA-N 379.504 5.386 30 20 GKED CCCOc1nc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc2ccccc12 474442357 WEPPPURNYWWUGK-MRXNPFEDSA-N 379.485 5.094 30 20 GKED C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)C[C@H](CC#N)c1ccccc1 476307873 UGTBVPAOZHVQPO-ZBFHGGJFSA-N 387.310 5.527 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@H](C)c2ccc(C(F)(F)F)cc2)n1 476691380 GDVTXGWMXDJOMY-LLVKDONJSA-N 380.391 5.002 30 20 GKED Cc1nccc(CNc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)n1 480139886 STURKCDTNNKXSB-UHFFFAOYSA-N 384.361 5.080 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1nccc2ccccc12 483218889 QRSZWDMAOMNOIU-HNNXBMFYSA-N 391.402 5.127 30 20 GKED C[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 487175443 IYHLMOBCCLNGDO-OXJNMPFZSA-N 388.433 5.750 30 20 GKED N#Cc1ccc(CNC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)cc1 495417008 MTYFRZHRSCFFDR-UHFFFAOYSA-N 397.453 5.095 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cc(C(F)F)ccc2Cl)C2CC2)cc1 497391968 PTGIOEZUPLAATD-UHFFFAOYSA-N 375.806 5.346 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(Br)cs1 497489379 GIYDACQDDSRJDH-UHFFFAOYSA-N 376.728 5.054 30 20 GKED COc1ccccc1C1(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)CC1 501959213 MEKWHDYKAYFPMX-UHFFFAOYSA-N 398.462 5.338 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 504117342 WMGXZTWBWFWXTJ-GFCCVEGCSA-N 396.903 5.526 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1ccccc1Cl 510209163 OIBGCFYSBGETLH-CQSZACIVSA-N 393.899 5.393 30 20 GKED C[C@@H](Oc1ccccc1C#N)c1nc([C@@H](F)c2ccc(C(F)(F)F)cc2)no1 511980940 JBCLIJCASLVJMM-BZNIZROVSA-N 391.324 5.159 30 20 GKED CSCc1ccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)cc1 513225148 ZVARIDORRJSGLZ-UHFFFAOYSA-N 388.492 5.253 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(OC(F)F)cc2)nnc1-c1ccco1 513329489 NWZOVYQQBANLEF-LBPRGKRZSA-N 377.416 5.179 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 514528310 GXZTYYDKYDXIHK-SNVBAGLBSA-N 383.498 5.022 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 515542764 CVCJFECLWAKXEW-CQSZACIVSA-N 391.477 5.325 30 20 GKED Cc1ccc(-c2noc([C@@H](C#N)Cc3ccc(C#N)cc3)n2)c(OC2CCCC2)c1 516995848 HUMPMOIDENTLNG-LJQANCHMSA-N 398.466 5.088 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)sc2cccc(F)c12 524381936 AEAATEDRXJMRST-UHFFFAOYSA-N 376.359 5.074 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ccc(COC)c(C#N)c1 529213984 SNUOQUVMNVXEGV-UHFFFAOYSA-N 381.476 5.054 30 20 GKED C[C@H]1CC(F)(F)CCN1C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 530018418 UMNDUPYJBYSBAD-ZDUSSCGKSA-N 390.817 5.264 30 20 GKED CC(C)c1cccc(O[C@H](C(=O)Nc2cc(CC#N)ccn2)c2ccccc2)c1 531929588 YCDIUFKNOMONIZ-QHCPKHFHSA-N 385.467 5.030 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc([C@@H]4CCOC4)c3)n2)cc1 534926784 PZCSCSOWLUCPHD-UXHICEINSA-N 388.492 5.113 30 20 GKED N#CC1(c2ccccc2)CCC(NCCc2coc(-c3ccc(F)cc3)n2)CC1 538983969 IRKXYDBNQABBMK-UHFFFAOYSA-N 389.474 5.017 30 20 GKED C=CCC[C@@H](NCc1cccc(NC(C)=O)c1)c1ccc(C(F)(F)F)cc1 540431371 YPOLWMYJTCEFGA-HXUWFJFHSA-N 376.422 5.461 30 20 GKED C[C@H](NCc1csc(-c2ccccn2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541066229 BYZMKZKPZZYIMM-KRWDZBQOSA-N 396.519 5.595 30 20 GKED CCSc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1 541719077 XSSJMSVROYILLX-OAHLLOKOSA-N 399.928 5.461 30 20 GKED CCc1ncsc1NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542964161 HAIFUAWHQAMWHB-CQSZACIVSA-N 376.485 5.127 30 20 GKED C[C@H]1C[C@@H](c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCO1 547218444 MXJNXYSIOMNDMF-KBPBESRZSA-N 395.846 5.336 30 20 GKED CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H]1CCCc2cccnc21 547829621 ZDZZHLOBEGWNRL-FQEVSTJZSA-N 376.504 5.204 30 20 GKED C[C@H](NC(=O)[C@H]1CCC(=O)[C@@H](C)C1(C)C)c1ccc(-c2cccc(C#N)c2)cc1 548374514 JMCKOLDYAGOKIZ-HYFFOGBASA-N 388.511 5.044 30 20 GKED C=C(C)Cn1c(-c2sc3ccccc3c2Cl)nnc1N1CCC(C#N)CC1 549272532 JMRKYAFSVJTVPF-UHFFFAOYSA-N 397.935 5.129 30 20 GKED CCc1ccccc1[C@@H]1C[C@H]1C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 558762542 RWMYUNUZCYOTOI-FCHUYYIVSA-N 397.478 5.359 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@@H]2c2nc3ccccc3o2)c(Cl)c1 567562583 GVJQCRHLEROMTE-GOSISDBHSA-N 394.862 5.306 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2)ccn1 589541634 VKJBOOSVPLYUOV-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CC[C@@H](C#N)N(C)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 594089949 YDFIEPZGPUANEA-NSHDSACASA-N 380.275 5.146 30 20 GKED C[C@H](Cc1ncc(C(F)(F)F)cc1Cl)N[C@@H](CCCC#N)c1ccccc1 599048695 PQDWCBSJUZFGIH-KDOFPFPSSA-N 395.856 5.710 30 20 GKED C=CCCCCCN(C)C(=O)c1sc(NC(=O)c2cccc(F)c2)cc1C 606814922 YPPKZPHCKKRTLN-UHFFFAOYSA-N 388.508 5.266 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 609398835 VXZHZDCEKWZUAY-SJLPKXTDSA-N 381.545 5.780 30 20 GKED Cc1cccc(OCCCCC(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)c1 609416369 MCDRPFWKPVZRFO-SFHVURJKSA-N 391.298 5.232 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)CNc1cccc(Cl)c1 609622224 KLBBLAONRNHCBY-UHFFFAOYSA-N 391.858 5.363 30 20 GKED CC[C@H](C)[C@H](C)N(C(=O)c1cccc(COc2cccc(C#N)c2)c1)C1CC1 609644190 PVACAMDVAZZSGE-ROUUACIJSA-N 376.500 5.176 30 20 GKED COc1ccc([C@@H](NC(=O)Nc2cccc(C#N)c2)c2ccccc2Cl)cc1 610089819 TZYRTCQFUBRQIZ-OAQYLSRUSA-N 391.858 5.131 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)C2)c1 612299013 NAPKPVFWPFMERI-FQEVSTJZSA-N 398.466 5.075 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C)cc1Br 615471278 HYQCBNNIGJTCLK-UHFFFAOYSA-N 377.257 5.117 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)Nc2ccccc2C(C)(F)F)c1C(F)F 661732407 YPLKEEWQNVNYFJ-UHFFFAOYSA-N 397.294 5.223 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)c1C#N 727790471 JRSYZPTZAWBOKM-UHFFFAOYSA-N 385.489 5.090 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1ccc(OCc2cccc(C#N)c2)cc1 728062640 ROMBQJSFTOEAND-SFHVURJKSA-N 399.494 5.139 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C\c1ccc(Cl)cc1 730997842 WLQFYWCNWNHGEB-IWMPZKFUSA-N 392.933 5.004 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 731837804 CADBOZIJOQWECA-UHFFFAOYSA-N 389.474 5.443 30 20 GKED O=C(/C=C/c1ncc(-c2cccc(Br)c2)[nH]1)c1cc2ccccc2o1 731938990 UCPGYRSTXVAOBI-CMDGGOBGSA-N 393.240 5.482 30 20 GKED C[C@@]1(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)CCc2ccccc2C1 744034518 ACWPXDZZNZJNKJ-IIBYNOLFSA-N 380.900 5.321 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(OCC(F)(F)F)cc2)ccc1SC 746346984 WBNUMDXPEMMPMA-OQFOIZHKSA-N 382.403 5.254 30 20 GKED C[C@@H](OC(=O)c1ccc(C#N)s1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753378522 DEVBICGDEKCUHP-SECBINFHSA-N 393.251 5.500 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ccc(OC(F)F)c(F)c3)c2)s1 754827484 FDNIDXZZFGZUNJ-UHFFFAOYSA-N 388.414 5.317 30 20 GKED CC(C)c1nnc(S)n1N=Cc1nc(-c2cc(Cl)ccc2Cl)cs1 755537000 SCFKZMPWSIIYLF-UHFFFAOYSA-N 398.344 5.003 30 20 GKED CC(C)(C)C[C@H](NC(=O)Cc1cccc(OCC#N)c1)c1ccc(Cl)cc1 760390744 OVGRLGQEKPQZQF-FQEVSTJZSA-N 384.907 5.079 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(F)c(SC)c2)cc1 766623449 QXZWXSWTELVXHU-SUMWQHHRSA-N 384.476 5.022 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1ccc(N(C)CCC#N)cc1 767737749 IQHUJAJIVJCIDE-FQEVSTJZSA-N 375.438 5.128 30 20 GKED COc1ccc(CN[C@H]2CCCc3nc(-c4ccc(C)cc4)sc32)cc1C#N 773086122 YPRZDHNNAFAYOB-IBGZPJMESA-N 389.524 5.166 30 20 GKED N#C[C@@H](C(=O)C1CCC(=O)CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 773982617 JEPJLULMFRPIKB-AWEZNQCLSA-N 393.295 5.052 30 20 GKED COc1cc(C)c(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1F 775893205 JKEZFSOZDWRZMC-UHFFFAOYSA-N 395.459 5.065 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)c(F)c1 776743548 PCZYEXQAAVJUAE-CRICUBBOSA-N 386.470 5.463 30 20 GKED CC[C@H]1C[C@H](C=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CCO1 779762509 ZLNSYVCLFOONBZ-CJNGLKHVSA-N 384.480 5.100 30 20 GKED O=C1/C(=C\c2scnc2C2CC2)CCc2nc(-c3ccc(F)cc3)sc21 782324926 IQKTUAHSQQSZRZ-LCYFTJDESA-N 382.485 5.496 30 20 GKED C[C@H](ON=C(c1ccccc1)C(F)(F)F)c1nnc(-c2ccccc2F)s1 784670253 CPAKAQGCAKOZCB-NSHDSACASA-N 395.381 5.388 30 20 GKED CC1=C[C@H](C)C[C@@H](C=Nn2c(S)nnc2Cc2cccc3ccccc23)C1 789641421 YDYUSGADFJEGTI-DOTOQJQBSA-N 376.529 5.137 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc(C)c(Cl)cc1C 796630062 AUBKSBWVSSNTPA-GOSISDBHSA-N 382.891 5.043 30 20 GKED C#C[C@H](NC(=O)Nc1cc(-c2cccnc2)ccc1C)c1ccc(Cl)cc1 810226632 HUHZDQGBCDFFCL-FQEVSTJZSA-N 375.859 5.206 30 20 GKED COCc1ccccc1/C=C(C)/C=C1\SC(=Nc2c(C)cccc2C)NC1=O 814188111 WGGOQUKCJPPUAD-QIROLCGISA-N 392.524 5.288 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)nn1-c1ccccc1 915861771 GDXZHLBNMCWHKM-QHCPKHFHSA-N 392.462 5.089 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)Oc3ccccc3Cl)n2)cc1 916974829 RTPALUUNYZLPRD-ZBFHGGJFSA-N 396.899 5.416 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1-n1cccc1 917025131 DZTPLUVOLJFJJP-LJQANCHMSA-N 383.476 5.399 30 20 GKED CCc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 920138316 DMRVFWIDNAATPH-FQEVSTJZSA-N 390.508 5.190 30 20 GKED C[C@H]1[C@@H](C)N(CCCCC2(C#N)CCC2)CCN1CCCCC1(C#N)CCC1 931069828 ISCNWWDLSRGUJA-SZPZYZBQSA-N 384.612 5.109 30 20 GKED O=C(O)c1ccc(NN=C2CCCC[C@@H]2c2cc(F)c(F)c(F)c2)cc1F 1776076514 SGFIXMVVKZQFDA-GFCCVEGCSA-N 380.341 5.067 30 20 GKED CCCCCCOc1cccc(/C=C/C(=O)c2ccc(OC)c(CC(=O)O)c2)c1 1776131850 POSHIJKGNVNDMV-ZRDIBKRKSA-N 396.483 5.178 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)[C@@H]2CCc3ccccc32)cc1 1776787904 DNFZXLNIKNVWOP-DNQXCXABSA-N 395.543 5.309 30 20 GKED COCc1ccccc1/C=C(C)/C=C1/CCCc2cc(C(=O)O)ccc2C1=O 1777237589 JCZCJELQQOIABT-UBSBAQTRSA-N 376.452 5.080 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3ccsc3Br)c2c1 1777684162 YYZSQHAPGBVPLO-HNQUOIGGSA-N 393.283 5.320 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OC(F)(F)F)cc1 7277462 OSGCLSCWBQPLAJ-UHFFFAOYSA-N 382.341 5.376 30 20 GKED N#Cc1cccc(/C=C(/c2nc3ccccc3[nH]2)c2nc3ccccc3s2)c1 50665517 OYQVXDBXMWUSCS-LGMDPLHJSA-N 378.460 5.633 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc3ccccc3c2)c1 55013212 YDLZBCLREKICKL-UHFFFAOYSA-O 397.523 5.487 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(C)cc2)=C(/S)NC(C)(C)C)cc1 55015090 KWGACAPJBQPPIR-UHFFFAOYSA-O 397.608 5.513 30 20 GKED Cc1cccc(SCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccccc2)c1 60134274 FBPVIEGQGLNBAP-UHFFFAOYSA-N 389.524 5.064 30 20 GKED CC(C)Oc1ccccc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 108533061 UTNCTEIPOQIOJI-MRXNPFEDSA-N 383.517 5.047 30 20 GKED COc1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CC2)cc1OCCCC#N 119989866 ZZHMCIMRNHKPHF-JOCHJYFZSA-N 384.907 5.272 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1ccc(Oc2ccccc2)cc1 120575001 LKRPLMIYYVOEPP-UHFFFAOYSA-N 389.480 5.145 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Cc2ccc(Br)cc2)n1 162460778 SILSDLHQEXXOOJ-SWLSCSKDSA-N 391.334 5.084 30 20 GKED Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 180520348 DGWVOHBNSHCBEH-LBPRGKRZSA-N 383.473 5.024 30 20 GKED Cc1csc([C@H](C)CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 185219656 ODIHLGCJYUVNCY-CQSZACIVSA-N 392.484 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCc2[nH]nc(C(F)(F)F)c2C1 188062580 ICFGUOOAAIQWPU-AWEZNQCLSA-N 391.437 5.024 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1Cl 191379366 FJNBXAXLHRGZGB-INIZCTEOSA-N 381.888 5.472 30 20 GKED Cc1nc2ccccc2c(NC(=O)c2cccc(SCC#N)c2)c1C(C)C 191956820 ZFMXBQDQGOHBTQ-UHFFFAOYSA-N 375.497 5.535 30 20 GKED Cc1ccccc1N(CC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 217005393 YOIPVDVASPWBEI-QGZVFWFLSA-N 381.545 5.100 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cccc(F)c2Br)s1 411009788 ZDDCBZSWFVLEBR-UHFFFAOYSA-N 381.270 5.071 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C1(C(F)(F)F)CCCC1 414886361 PUEGEIHGQCVSLB-UHFFFAOYSA-N 389.377 5.115 30 20 GKED Cc1ccc2cc([C@@H](C)Nc3ccc4c(c3)CCC(=O)N4CCCC#N)oc2c1 426038162 WLFWQLSMINTUSI-QGZVFWFLSA-N 387.483 5.497 30 20 GKED N#Cc1ccc(NC(=O)c2c(-n3cccc3)sc3c2CCSC3)c(Cl)c1 430373774 VZYPUFCNBAWFMT-UHFFFAOYSA-N 399.928 5.105 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@H](c2ccc(F)cc2)C1 432095269 PUTCNCDUSXIJFA-WBVHZDCISA-N 383.492 5.099 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1CC(F)(F)F)c1ccccc1 432972345 LQDZEPLLZCIIIA-KRWDZBQOSA-N 375.394 5.348 30 20 GKED CC(C)OCc1c(C(=O)Nc2ccc(OC(C)C)c(C#N)c2)oc2ccccc12 435357226 JPTLBZILANARAO-UHFFFAOYSA-N 392.455 5.269 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1SC[C@H](C)C#N 438072841 LJUULBSGHJCWMR-UZLBHIALSA-N 399.535 5.466 30 20 GKED COCc1cccc(NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)c1 438648123 IZCXGMUXLWJKDT-UHFFFAOYSA-N 391.402 5.280 30 20 GKED CC(C)[C@H](NC(=O)NCC1CCC(C#N)CC1)c1ccc(C(F)(F)F)cc1 440997038 DFJAIAHQGQXQCW-JMLCCBQJSA-N 381.442 5.032 30 20 GKED CC[C@H](C)[C@H](NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 446281383 MIPATUABHAFFCZ-BIMULSAOSA-N 388.327 5.095 30 20 GKED Cc1cc(-c2ncccc2NC(=O)N[C@@H](CCC#N)c2ccccc2)cs1 446429419 JIEVQFZSVJJXRH-SFHVURJKSA-N 376.485 5.285 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(c2ccc(Cl)cc2)C1 454759306 LIKPPSSSKWWPBO-AWEZNQCLSA-N 385.920 5.366 30 20 GKED N#CCc1cccc(NC(=O)N(Cc2ccccc2C(F)(F)F)CC2CC2)c1 455905260 LMNIVCKINWEUHR-UHFFFAOYSA-N 387.405 5.216 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CCC2)c2c(F)cccc21)c1ccccc1 458804352 SJOYLEUOSPZEIY-IBGZPJMESA-N 377.463 5.212 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)[C@@H](C)c1cccc(C#N)c1 462022865 HOONRIWKCXRING-UONOGXRCSA-N 393.487 5.110 30 20 GKED CCCCOc1ccc(CNc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 468817361 DSRYZSVAQHJRCM-UHFFFAOYSA-N 391.515 5.061 30 20 GKED C[C@@]1(c2ccccc2)CCCN(C(=O)c2cn(CCCC#N)c3ccccc23)C1 469385565 FRHHFRYAUXYVFD-RUZDIDTESA-N 385.511 5.139 30 20 GKED CSc1ccccc1CN(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 471271730 DAIYNMFFLYRKFO-HNNXBMFYSA-N 385.558 5.467 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(F)c(Br)cc2Cl)cc1 474782481 YDVKJWOFRIXWOF-UHFFFAOYSA-N 395.659 5.295 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 480517628 XFPHXYDIMSEEQX-PKTZIBPZSA-N 390.527 5.157 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(COC(C)C)cc1 480817788 BVTOYSZMOLPTAY-UHFFFAOYSA-N 378.925 5.547 30 20 GKED CCCOC1(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)CCCCC1 483617031 CWXUJUOCJPNJJY-QGZVFWFLSA-N 389.565 5.189 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cc(NC(=O)CC)ccc1Cl 485291492 UFWAOHJJPUDROV-UHFFFAOYSA-N 377.916 5.289 30 20 GKED C=CCSc1ccccc1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1 486414702 XEZXDHOMJZFVEA-FPOVZHCZSA-N 394.584 5.090 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 487485302 LUYDNPRTTCWUET-UFYCRDLUSA-N 386.417 5.360 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@@H](CCCC#N)c3ccccc3)s2)o1 487606873 VPRCQWVOCMLWTG-KRWDZBQOSA-N 379.485 5.185 30 20 GKED CCC(C)(C)OCc1cccc(NCC(=O)Nc2cc(Cl)ccc2C#N)c1C 495075044 OPZXKRPVUDPRMU-UHFFFAOYSA-N 399.922 5.276 30 20 GKED C[C@H]1CCC[C@H](OCCCCCC(=O)Nc2cc(C#N)ccc2OC(F)F)C1 499369229 NUNGSMZNGYGBEM-RDJZCZTQSA-N 394.462 5.254 30 20 GKED C=CCN(C(=O)CCSC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 502976113 KQBBOKKIUYEDEL-UHFFFAOYSA-N 387.357 5.389 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H]1CCOc2c(Br)cccc21 503889217 WBUIJRUTGPZNSU-WOJBJXKFSA-N 397.316 5.202 30 20 GKED Cc1ccccc1CCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 504273364 BZXOXYBIBWBULL-UHFFFAOYSA-N 384.479 5.211 30 20 GKED N#CCCCCNC(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 505076858 VQTVDGZAGSMMOU-UHFFFAOYSA-N 393.339 5.709 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)Cc3noc4ccccc34)c2C#N)C1 506885001 NYOFJNABXVHRTG-CYBMUJFWSA-N 393.512 5.093 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(C#N)cc2F)c2ccccc2OC)cc1 512637696 YLHJESKFACSQLZ-FYSMJZIKSA-N 390.458 5.155 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@H]1CCO[C@H](C(C)C)C1 513658765 WOANQJRTJJOCFV-CVDCTZTESA-N 392.499 5.439 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cs2)cc1 515597261 DMXQHKKXHGQHHA-MRXNPFEDSA-N 387.464 5.565 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)CCCc2nc3ccccc3s2)cc1 517491866 FMCLKOHNRJGKNA-LJQANCHMSA-N 391.540 5.298 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 520331922 NZKORUIHAKOJJL-UHFFFAOYSA-N 376.843 5.530 30 20 GKED CCc1cccc2c1OCC[C@H]2NC(=O)Nc1ccccc1SC[C@@H](C)C#N 520855693 XULAJYIBTPNTBP-MAUKXSAKSA-N 395.528 5.146 30 20 GKED CCSCc1ccc(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)cc1 521769664 SVQJTLMTKQSWKN-INIZCTEOSA-N 379.312 5.241 30 20 GKED CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCCCOc1cccc(C#N)c1 524767897 DNQJEPSPJGJBCJ-RPWUZVMVSA-N 390.527 5.292 30 20 GKED CC(C)c1ccc([C@H]2CCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 535489884 XNWSVKBLNKRJSI-JOCHJYFZSA-N 375.516 5.980 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)s1 535681315 PJNTYKVRXKCHDC-UHFFFAOYSA-N 395.189 5.120 30 20 GKED CC1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)CC1 540963968 IYQNRYUXXKWNCO-BMRADRMJSA-N 397.478 5.080 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2COCc2ccccc2)ccc1Cl 544433077 ODYWISKCZNATGD-UHFFFAOYSA-N 376.843 5.181 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2SC2CCCC2)cnc1C(F)(F)F 549317194 JPJVAPPMJFJGPQ-UHFFFAOYSA-N 391.418 5.259 30 20 GKED C[C@H](NCc1ccccc1C(C)(C)C#N)c1ccc(Br)cc1F 570858673 PTUISENMBDGYNW-ZDUSSCGKSA-N 375.285 5.240 30 20 GKED CC(C)(CCC#N)CNC(=O)c1sc(-c2ccccc2)nc1-c1ccccc1 572436811 HZWHBQUSPDENGL-UHFFFAOYSA-N 389.524 5.537 30 20 GKED C[C@H](Oc1ccccc1NCc1ccc(C#N)cc1OC(F)F)C(F)(F)F 577678611 BDACVMWINKVMOZ-NSHDSACASA-N 386.320 5.101 30 20 GKED N#CCCCOc1cccnc1NC(=O)c1csc(-c2ccc(Cl)cc2)c1 581621253 IYGKTPZPYQSXMO-UHFFFAOYSA-N 397.887 5.398 30 20 GKED N#CC(CCN1CCC(F)(c2cccnc2)CC1)(c1ccccc1)c1ccccc1 583515079 IXNLFTAJKGZLQN-UHFFFAOYSA-N 399.513 5.242 30 20 GKED CCCC[C@H](C)N(C)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 589321821 APWPGOUZZRTAJV-SFHVURJKSA-N 379.504 5.374 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(CSc3ccc(F)cc3)cc2)C1 591350620 YZLTWRZBMLLNKQ-NRFANRHFSA-N 383.492 5.276 30 20 GKED N#CCCC1CCN(C(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)CC1 592819598 GLATVQKZMNMXFO-UHFFFAOYSA-N 376.287 5.144 30 20 GKED N#Cc1ccccc1Sc1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)S3)cc1 599793436 IMCCEIRIZXABRZ-MOPGFXCFSA-N 395.553 5.211 30 20 GKED CCN(C(=O)c1ccc(Br)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 603956419 RTKWSCGQCAPYNV-LBPRGKRZSA-N 391.696 5.197 30 20 GKED N#Cc1ccc(N2CCC[C@H]2C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1 609094640 HQNHNBXYLKPWLU-KRWDZBQOSA-N 394.689 5.126 30 20 GKED C[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nc2ccccc2[nH]1 609208729 CFQBCDRNSMTSDT-HNNXBMFYSA-N 397.438 5.110 30 20 GKED C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1O[C@@H](C)c1ccccc1 609652331 OPXBKLWPDJOLJS-ROUUACIJSA-N 386.451 5.104 30 20 GKED CC(C)(NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccs1 609726621 MVMNODJLVWNTOY-UHFFFAOYSA-N 376.481 5.272 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N[C@@H]3CC=CCC3)cc2Cl)c1 609929407 YPHFKJUVWJBROB-QGZVFWFLSA-N 381.863 5.021 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc(OCCCC#N)c1 609968656 XNFQMLKNRKLPOG-HNNXBMFYSA-N 390.405 5.205 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cccc(Cl)c1 610224010 BNQPZMARQGXYCS-CQSZACIVSA-N 377.831 5.141 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(Cn2cccn2)cc1)c1ccc(C#N)cc1 610341299 QRBUQYWIEGZWDJ-FQEVSTJZSA-N 392.506 5.321 30 20 GKED N#CCn1c(C(=O)Nc2c(O)c(Cl)cc(Cl)c2Cl)cc2ccccc21 611216523 BPUYSEGAGUQFJM-UHFFFAOYSA-N 394.645 5.083 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 613292260 FEGZDKYZTKOTPA-KRWDZBQOSA-N 384.460 5.462 30 20 GKED CN(C(=O)c1cc2ccccc2n1CC#N)c1ccc(OCc2ccccc2)cc1 614895787 NCHCSVKOCJQHEF-UHFFFAOYSA-N 395.462 5.020 30 20 GKED N#CC1CCC(CNC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)CC1 619659803 DSTJQLAIVFKGMA-UHFFFAOYSA-N 385.467 5.068 30 20 GKED C[C@H]1CC[C@@H](c2noc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)n2)O1 624688509 XNSKGCOFZIJNCE-KWQFWETISA-N 398.278 5.266 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C)c1c(C)noc1C)c1ccc(C(F)(F)F)cc1 676725028 KAYDKRCQDZAPMY-PXAZEXFGSA-N 395.425 5.378 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(C)n([C@H](C)c3ccccc3)c2C)cc1 726940780 RUKBLCVQYIDPAD-HXUWFJFHSA-N 385.511 5.583 30 20 GKED CCCCCC[C@@H](C)CC(=O)[C@@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 727952932 XWLBGBGBCUPPLJ-GDBMZVCRSA-N 399.560 5.449 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 729574507 XLQYUTOFVQPHSX-UHFFFAOYSA-N 395.503 5.296 30 20 GKED N#CCOc1cccc(NC(=O)[C@H](Sc2ccccc2F)c2ccccc2)c1 729947665 YDJTVBAIHJGMSL-OAQYLSRUSA-N 392.455 5.200 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CC1 732878899 SBJBNNKAHWFBJP-RPBOFIJWSA-N 395.506 5.923 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1c[nH]c2cc(F)ccc12 733083083 CMRGZDCGVYHWFD-ALCCZGGFSA-N 393.399 5.235 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2SC(F)F)c1 733842418 UNUDYBIPVYLMRH-CQSZACIVSA-N 391.443 5.004 30 20 GKED OC1(C(F)(F)F)CCC(=NNc2c(Cl)cc(Cl)cc2Cl)CC1 734744137 BPIZRKJRARSDHN-UHFFFAOYSA-N 375.605 5.282 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1 736001886 MHULNXCTALUALJ-HSZRJFAPSA-N 393.446 5.178 30 20 GKED CCOc1c(Cl)cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1OC 741472917 LUXDAPBUGNONRM-FPLPWBNLSA-N 393.870 5.705 30 20 GKED CC(C)c1ccc(/C=C/C(=O)c2ccc(S(=O)(=O)CC(F)(F)F)cc2)cc1 741843156 NUQUPLFNGKOMQX-LFYBBSHMSA-N 396.430 5.042 30 20 GKED C=CCNc1nnc(SCc2ccc(OC)c(SC(F)(F)F)c2)s1 741845752 CGMMGLYVJSAHAK-UHFFFAOYSA-N 393.481 5.049 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)/C=C/c2cnc(C(C)(C)C)s2)cc1 742657598 PQPQRUYHXCEABP-DXRVJIQQSA-N 381.545 5.132 30 20 GKED Cc1cccc(F)c1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 743128172 LUVXBSCTUUXSBM-UHFFFAOYSA-N 375.403 5.120 30 20 GKED Cc1ccccc1-c1noc([C@@H](C)ON=Cc2ccccc2C(F)(F)F)n1 744443906 OUUJYWJSCAKDIF-CYBMUJFWSA-N 375.350 5.176 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)C#Cc2ccccc2)nc1-c1ccccc1 747399616 SOFDNFJLANRTNG-NRFANRHFSA-N 384.479 5.180 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=O)NCc1ccc(C#N)cc1 748450560 JISDIELEXRNWNP-UHFFFAOYSA-N 379.529 5.613 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=S)N[C@@H]1CCCC[C@H]1C 749101089 AOVNHZSOKSFNKM-CXAGYDPISA-N 399.373 5.029 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(OC)c(F)c2)ccc1OCC(F)(F)F 750900735 AIKAVNYPAJQTKG-QPJJXVBHSA-N 398.352 5.070 30 20 GKED O=C(/C=C\c1ccc(Cl)nc1Cl)c1ccc(Br)cc1F 761480795 UDGHTVKXGYMRGX-KTAJNNJTSA-N 375.024 5.186 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2C[C@@H](c3ccccc3)C2(C)C)ccc1OC 766329637 MYJMGJIZBKZJGK-ZRCGQRJVSA-N 378.516 5.048 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCc3ccc(Br)cc32)c1 772981745 ADYUIVPOEPIAPD-RXVVDRJESA-N 399.332 5.297 30 20 GKED C[C@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 773761864 WEANXOYJALDOLF-WIYYLYMNSA-N 379.463 5.330 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCc2c(Cl)cccc21)c1nc2cc(Cl)ccc2s1 776080791 JGDBJWYSYNUJOK-KGLIPLIRSA-N 387.291 5.509 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cc(Br)cc2ccccc12 780154743 ZVCRKUJABKINDB-ZDUSSCGKSA-N 395.256 5.145 30 20 GKED COc1cc2c(cc1NC(=O)C[C@@H](CC#N)c1ccccc1)oc1ccccc12 792876224 MFEINEKSSYPGBD-QGZVFWFLSA-N 384.435 5.621 30 20 GKED C=CC[C@H](OC(=O)c1csc([C@H]2CCCO2)n1)c1ccc(Cl)c(Cl)c1 797553072 QRQAVOKMFUBSQG-JKSUJKDBSA-N 398.311 5.776 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797569057 MWHLFIBDXOWQAP-DLBZAZTESA-N 384.545 5.598 30 20 GKED CC(C)[C@H](c1ccc(Cl)cc1)c1noc(Cc2cccc(OCC#N)c2)n1 809499683 SMHBYKORYGEXPF-HXUWFJFHSA-N 381.863 5.004 30 20 GKED C#C[C@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccc(Cl)cc1 810151965 QVBKCDZTMFMFCP-KRWDZBQOSA-N 388.945 5.315 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc(C(F)(F)F)cc2O)c1 810226442 YAMIGSGDLBICIX-VQIMIIECSA-N 392.421 5.333 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3ccccc3OC(F)F)c(Cl)nc21 913615386 SAUHDAWSEBPTEZ-BQYQJAHWSA-N 391.805 5.163 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)cc1 916850009 XTAGAICQGMBDBR-OAQYLSRUSA-N 384.479 5.273 30 20 GKED N#CC1(CSc2nc(O)c3c(-c4ccc(F)cc4)csc3n2)CCCC1 1651696864 NVWRJPFCVLSJIC-UHFFFAOYSA-N 385.489 5.379 30 20 GKED CSc1ccc(Oc2ccc(F)cc2C=NNc2cccc(C(=O)O)c2)cc1 1776037866 GGTGRPFOJKHEQB-UHFFFAOYSA-N 396.443 5.484 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCCC23CC(C(=O)O)C3)cc1 1776787530 PMWBRLDKSBTUAT-UHFFFAOYSA-N 389.561 5.219 30 20 GKED CCn1c2ccccc2c2cc(/C=C/C(=O)c3csc(C(=O)O)c3)ccc21 1777002820 HWJWMBDEYKHLBJ-CSKARUKUSA-N 375.449 5.470 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(OC(C)(C)C)cc2)c2cc(C(=O)O)oc12 1777361024 LQFULRISCZZWOI-XFFZJAGNSA-N 394.423 5.213 30 20 GKED Cc1ccsc1C(=O)/C=C\c1cccc(OCc2cccc(C(=O)O)c2)c1 1777477158 BKFWHVPHEFQWTJ-HJWRWDBZSA-N 378.449 5.230 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N(CCC#N)c1ccccc1 12807377 UMBUVEVKLTZRSA-CYBMUJFWSA-N 379.312 5.421 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 41516667 ZVGNMWZGKFOYOD-SFHVURJKSA-N 389.505 5.106 30 20 GKED N#C[C@@H](C(=O)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)c1ccccn1 46440089 IOCYMOKCKQHHMR-LJQANCHMSA-N 398.853 5.078 30 20 GKED N#CC1CCN(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)CC1 107383505 GIJHSTZCXUCVIC-UHFFFAOYSA-N 381.479 5.788 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 108199402 TZZVUTIEUYJLSN-GJZGRUSLSA-N 390.430 5.453 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 128114108 RGQNKPWCQIPPMV-MRXNPFEDSA-N 380.856 5.030 30 20 GKED Cc1cc(CN[C@H](CCC#N)c2ccccc2)cc(C)c1OCc1ccccn1 130596216 WOAKNNJVKINQBW-XMMPIXPASA-N 385.511 5.412 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(C(F)(F)F)ccc1F 154334884 HMRFUIAQHNUYSO-NSHDSACASA-N 382.382 5.491 30 20 GKED Cc1noc(C)c1[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 159808041 PCKZPKKKNZYRTE-BMIGLBTASA-N 385.876 5.048 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CC(F)(F)F)c1 174314332 VRRFVTUIZCHRGP-UHFFFAOYSA-N 375.394 5.106 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccccc2O[C@@H](C)C#N)CC[C@@H]1c1ccccc1 184327204 IOORZJUFMPCRCD-NSHGMRRFSA-N 377.488 5.025 30 20 GKED N#CC(CCSc1nnc(C2CC2)s1)(c1ccccc1)c1ccccc1 193068174 OFMYEOSFUKPYCY-UHFFFAOYSA-N 377.538 5.408 30 20 GKED C=CCn1c(SCCCCC#N)nc2sc(-c3ccccc3)cc2c1=O 195564595 ZCLGBFJHDKEAII-UHFFFAOYSA-N 381.526 5.097 30 20 GKED N#CCc1cccc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c1 195609518 ZSYVQDGEBWMDCD-UHFFFAOYSA-N 388.279 5.435 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Br)cc2)c(F)c1 195695860 SQQPWFQILIOXSW-OAQYLSRUSA-N 395.275 5.339 30 20 GKED N#CCCCOc1cccc(CNC2(c3cccc(C(F)(F)F)c3)CCC2)c1 237668325 DNFTXCOOBSXOFU-UHFFFAOYSA-N 388.433 5.557 30 20 GKED C[C@@H](c1ccc(OC(F)F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 261452829 PNLVVNSBEKVENT-VIFPVBQESA-N 377.275 5.166 30 20 GKED CCCCOc1c(Cl)cc(C(=O)N(CC#N)c2ccccc2)cc1OCC 302382833 YUNCLIUWFXLPFD-UHFFFAOYSA-N 386.879 5.088 30 20 GKED OC(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)=Nc1ccc2c(c1)OC1(CCCCC1)O2 329201745 XTHNCAZUWZNYLD-TWVWUCKLSA-N 397.515 5.428 30 20 GKED OC1=Nc2cc(/C(O)=N/[C@@H]3CC[C@H](c4ccc(F)cc4)C3)ccc2SCC1 329942505 VQJJMOAFOPDPRH-WMLDXEAASA-N 384.476 5.550 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2cccc(C#N)c2)C1 364537122 NSTHOQIRZVFKRW-JOCHJYFZSA-N 389.499 5.016 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cccc(SCC#N)c3)c2C#N)CC[C@H]1C 410988864 SZLWIFMDCHLVEB-OLZOCXBDSA-N 381.526 5.174 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cccc(Br)c2F)c(C#N)s1 428778838 JOMYPLILYBPTQC-UHFFFAOYSA-N 381.270 5.071 30 20 GKED COc1ccc(OC(C)C)c(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c1 433172276 DMEINLJZGJJVNX-IBGZPJMESA-N 381.476 5.039 30 20 GKED CCCc1c(NC(=O)c2ccc3ccccc3c2)cnn1-c1cccc(C#N)c1 440088984 PWSHIXCRIVNPOP-UHFFFAOYSA-N 380.451 5.102 30 20 GKED N#Cc1cc(F)c(C(=O)N2CCC(c3cccc4ccccc34)CC2)c(F)c1 446144478 MASUOPLRDNFZFX-UHFFFAOYSA-N 376.406 5.009 30 20 GKED C[C@H](N[C@H]1CCC[C@H](c2ccnn2C)C1)c1ccc(-c2cccc(C#N)c2)cc1 448024559 ZAFUCOHJBPCMBL-NWVWQQAFSA-N 384.527 5.336 30 20 GKED Cc1csc([C@@H](NCc2cc(F)c(C(F)(F)F)cc2F)C(F)(F)F)n1 451139008 CLTDNGUALNWFIQ-LLVKDONJSA-N 390.299 5.142 30 20 GKED C=CCn1c([C@@H]2CCCCO2)nnc1N1CCCC[C@H]1c1ccc(Cl)cc1 453433350 CYEHJAVIVATUAE-OALUTQOASA-N 386.927 5.091 30 20 GKED C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCC[C@H]1c1cccc(Cl)c1 453462975 PPQPFXZSLICTPB-SNRMKQJTSA-N 386.927 5.089 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1 455677064 SXKTVEJMDFDHOH-FDDCHVKYSA-N 391.515 5.058 30 20 GKED C=CCC[C@@H](CCC)N[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1 461883558 JZMTZNFHSUKTFV-IFMALSPDSA-N 389.536 5.043 30 20 GKED N#C[C@H](NC(=O)c1cc(-c2ccccc2)ns1)c1cccc(Cl)c1Cl 462003954 BRUWYBLQOUOKNH-HNNXBMFYSA-N 388.279 5.112 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)N(CCC#N)Cc3ccco3)o2)cc1 463623578 ODUCDBIPVIERLH-UHFFFAOYSA-N 376.456 5.393 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C1CCC(c2ccccc2)CC1 463755876 OVQKKCGVMAWHRJ-KKXNLOMOSA-N 378.541 5.993 30 20 GKED CCSc1cccc(Br)c1NC(=O)CCc1ccc(C#N)cc1 464709322 IWMCASPJUTWLMU-UHFFFAOYSA-N 389.318 5.004 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(COc2ccccc2)cc1 464947495 FMBAMSBHQIBNCG-JWQCQUIFSA-N 396.490 5.178 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@]1(C)Cc1ccccc1 467340076 BYNOILXCSAKUFJ-MBSDFSHPSA-N 393.556 5.567 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3cccc(-c4ccccc4)c3)ccc21 469060151 PPGMHDLMGRWHLO-UHFFFAOYSA-N 395.506 5.549 30 20 GKED C=CC[C@@H]1N(C(=O)Cc2ccc(OCc3c(C)noc3C)cc2)CCCC1(C)C 470300303 YYLUXDAVJXMRAZ-QFIPXVFZSA-N 396.531 5.006 30 20 GKED C=CCCC1(C(=O)NC[C@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)CC1 474439502 ZIIPZEVTGFXPBZ-OAQYLSRUSA-N 388.511 5.171 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cn(-c2ccccc2)nc1C 475569570 AOXYKETVXSBWJV-UHFFFAOYSA-N 388.515 5.354 30 20 GKED C=CCCC1(C(=O)N2CCC[C@@H](Cc3nc(C4CCCCCC4)no3)C2)CC1 476484475 SICPDSHNPSLEHW-SFHVURJKSA-N 385.552 5.035 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Br)c(Cl)c1 477094944 YAHWPIXZQOVXHD-UHFFFAOYSA-N 395.709 5.361 30 20 GKED C=C(C)COc1cc(CNc2cnn(CC(C)C)c2C(F)F)ccc1OC 478325432 UEUBSLWEXRPENP-UHFFFAOYSA-N 379.451 5.052 30 20 GKED C=CCN1CCC(N[C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 482651452 YDECZCQPKBVTHM-CQSZACIVSA-N 375.969 5.073 30 20 GKED N#CC[C@H](CC(=O)Nc1cccnc1-c1ccc(Cl)s1)c1ccccc1 484212638 YBMUHERHOOZSON-OAHLLOKOSA-N 381.888 5.490 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2nc(C(C)C)no2)cc1 486233619 PRDHMYQNRBOGJV-UHFFFAOYSA-N 379.485 5.390 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 493236456 KBLNSXMFLPVYCI-CYBMUJFWSA-N 393.896 5.077 30 20 GKED Cc1ccccc1N(C(=O)c1sccc1C#N)c1nc2ccccc2s1 497987107 UUVBKTHPRBKASV-UHFFFAOYSA-N 375.478 5.516 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2cccc(C3CC3)n2)cc1 498081519 DEPMHOWRUPZSAA-UHFFFAOYSA-N 385.492 5.375 30 20 GKED N#CCc1cccc(C(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)c1 500047401 IKIXWNADOAFYLA-UHFFFAOYSA-N 385.511 5.386 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1nc2ccccc2s1 505313801 VWTWUXFOYSBQDL-NSHDSACASA-N 397.431 5.188 30 20 GKED N#C[C@@H](NC(=O)Cc1c[nH]c2cc(Cl)ccc12)c1ccc(Cl)c(Cl)c1 505922514 IDNBIQVTYIPVKA-QGZVFWFLSA-N 392.673 5.052 30 20 GKED COc1cc([C@H](C)NC(=O)Nc2ccc(CC#N)cc2)ccc1OCCC(C)C 506231654 OQJVCWAOJUIHMM-KRWDZBQOSA-N 395.503 5.069 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)CC1 506958398 ZAXKVDFKAJRHML-UHFFFAOYSA-N 385.920 5.649 30 20 GKED N#CCCCOc1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1 507683761 MCWQLEQRESYHBC-UHFFFAOYSA-N 384.907 5.066 30 20 GKED Cc1csc(-c2ccc(NC(=O)C(C)(C)c3cc(F)cc(C#N)c3)cc2)n1 509180751 FFYRSFSRDWUYAN-UHFFFAOYSA-N 379.460 5.046 30 20 GKED N#Cc1ccc(-c2ccccc2)nc1SCc1nc(-c2ccsc2)no1 510192770 VTFZJRPJGMPHKN-UHFFFAOYSA-N 376.466 5.024 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(Cc3cccc(F)c3)CC2)cc1 510607745 XDKJHWAFHKCRHK-UHFFFAOYSA-N 379.479 5.113 30 20 GKED Cc1ccsc1CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510656099 DHVANRXFHSMSRS-UHFFFAOYSA-N 377.469 5.384 30 20 GKED COc1ccc(SCC(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 511064828 QZDZSACLARVLBC-UHFFFAOYSA-N 386.542 5.018 30 20 GKED CCOc1ccccc1CCC(=O)Nc1sc(-c2ccccc2)cc1C#N 511138480 YTHVXBNIYQEORC-UHFFFAOYSA-N 376.481 5.257 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(C#N)cc1F 512619779 NCIKKXVPCVTYPH-LBPRGKRZSA-N 383.810 5.369 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H](Sc1ccccc1)c1ccccc1 512844880 PWPXVICJZYWZKJ-QFIPXVFZSA-N 388.492 5.429 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3ccccc3s2)oc2c1ccc1ccccc12 513686769 FTHOIVSFQPVDRD-KRWDZBQOSA-N 382.444 5.994 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(Cl)c(Cl)c1 517456134 GCUWRJOHTZTOJZ-ZDUSSCGKSA-N 393.339 5.816 30 20 GKED CCCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 520429313 KFWONKDFZBLVQM-OAHLLOKOSA-N 398.434 5.367 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520941368 LMRQSEOYPPBPEK-YJBOKZPZSA-N 397.544 5.818 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1C[C@@H]1c1c(F)cccc1F 522537814 LACUHIMWDAJHGI-GJZGRUSLSA-N 380.419 5.307 30 20 GKED N#C[C@@H](C(=O)c1cnc2ccsc2c1)c1nc(-c2ccc(Cl)cc2)cs1 524767264 AFRYAQUIQCQGLI-AWEZNQCLSA-N 395.896 5.563 30 20 GKED Cc1cc(F)ccc1-c1ccc(CNC2(c3ccc(C#N)cc3)CCOCC2)o1 527813659 ZBWXSKKEUCHZNZ-UHFFFAOYSA-N 390.458 5.061 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)OCC 535138696 QXYNMLNHDHZENI-CTNGQTDRSA-N 382.891 5.305 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)c(C)c2)C2CC2)cc1OCCCC#N 535368833 KEKNLPCQOOKSGD-QHCPKHFHSA-N 382.479 5.066 30 20 GKED Cc1cc([C@@H](C#N)C(=O)c2ccc(Sc3ccc(Cl)cc3)cc2)nc(C)n1 536933640 HHQMZAJBNVZVNS-LJQANCHMSA-N 393.899 5.388 30 20 GKED COc1ccc([C@H](Cc2ccccc2C)NCCCC(C)(C)C#N)cc1OC 539275135 AFPGWEUCDQLFSH-NRFANRHFSA-N 380.532 5.216 30 20 GKED C=CCC[C@@H](NCc1nc(-c2ccoc2)no1)c1ccc(C(F)(F)F)cc1 540432479 PMCKJOZPVGMBTR-MRXNPFEDSA-N 377.366 5.146 30 20 GKED CCn1c(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2cc(F)ccc21 541087022 NULNLAWNBUVZEV-QGZVFWFLSA-N 398.485 5.585 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@@H](c2ccc(F)cc2)c2cnccn2)cc1 542493885 FWJFJWCCNSZPTP-VWLOTQADSA-N 394.453 5.034 30 20 GKED O=C(Nc1cccc(C(F)F)c1)N[C@@H](c1cccc(F)c1F)C(F)(F)F 544250507 YNCQZEHOMSEBIY-ZDUSSCGKSA-N 380.263 5.328 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1OC(F)F 551212025 PTAISIFBRFETEF-HTAPYJJXSA-N 394.465 6.527 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N(CCC#N)c3ccc(F)cc3)o2)c(C)c1 554168463 WDCLGDBSORBASP-UHFFFAOYSA-N 392.430 5.175 30 20 GKED Cc1ccc([C@@H](C)N(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 557418921 IBBACHSILRGFIY-PKOBYXMFSA-N 395.572 5.187 30 20 GKED N#Cc1cccc(C2(NC(=O)N[C@@H](c3cccc(C(F)(F)F)c3)C3CC3)CC2)c1 558990978 HYVHGEWUKDNUBO-LJQANCHMSA-N 399.416 5.017 30 20 GKED C[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 575019503 INGJTLBKRYWDJD-IBGZPJMESA-N 384.479 5.149 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N3CCC(CCC#N)CC3)cn2)cc1C 577390651 BCHOEHJKMFGHMJ-UHFFFAOYSA-N 378.476 5.038 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc3nc(C(F)F)sc3c2)c(Cl)c1 588054514 ZKCQTSVRENCVPT-UHFFFAOYSA-N 398.221 5.665 30 20 GKED N#CCCCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F 588755340 GTFSPLHEJRXYSG-UHFFFAOYSA-N 398.372 5.772 30 20 GKED N#Cc1ccc(-c2nnc(CN(CC3CC3)c3cccc(C(F)(F)F)c3)o2)cc1 589291212 WNZSGFLNNCRPCL-UHFFFAOYSA-N 398.388 5.044 30 20 GKED Cc1ccc(-c2c(C)sc3nc(CSCC4(CC#N)CC4)nc(O)c23)cc1 596332448 YRTDYBDIDAKACE-UHFFFAOYSA-N 395.553 5.608 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)c1ccc2c(c1)CCCO2 596735246 XEYFICBBECUOOK-HOTGVXAUSA-N 395.528 5.146 30 20 GKED N#Cc1ccc(CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)c(F)c1 604007790 FNDJEVXPJBIVNS-UHFFFAOYSA-N 397.812 5.354 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C[C@H](C)c1cccnc1 609663049 RLNZSDBSMRVGHC-KRWDZBQOSA-N 387.458 5.128 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)CC1 609773194 ZRCADDHWJUMNIG-QGZVFWFLSA-N 395.478 5.320 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(-c4cscn4)c3)cn2)cc1 610290628 NCOWMZJIVQVZNX-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(COC(C)(C)C)cc1 610634729 GXSPFXLROBJITB-UHFFFAOYSA-N 397.475 5.130 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(NC(=O)c2ccc(F)cc2)cc1 611392533 SWNYAMSNVWZINI-DEOSSOPVSA-N 399.469 5.117 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1cccc(OCc2ccccn2)c1 614179071 BIPGJTSJCJCOTA-LJQANCHMSA-N 385.511 5.313 30 20 GKED N#C[C@@H](C(=O)c1cccc2c1CCC2)c1nc2cc(C(F)(F)F)ccc2s1 619753788 IQNJVDITBAFNNA-HNNXBMFYSA-N 386.398 5.294 30 20 GKED Cc1nc2sccc2c(=O)n1N=Cc1ccc(-c2ccc(Cl)cc2)s1 725842198 CSELXDCJMPWWLC-UHFFFAOYSA-N 385.901 5.031 30 20 GKED CCc1ccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 727955658 MIXVRWQZWFOFID-FOIQADDNSA-N 390.508 5.361 30 20 GKED N#C[C@@H](C(=O)[C@H](OC1CCCC1)c1ccccc1)c1nc2cc(F)ccc2s1 730420396 DDHLEFQXUDHQRU-LAUBAEHRSA-N 394.471 5.312 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2csc(-c3ccoc3)n2)cc1 731092388 XBNDKSQIGAVZDF-UHFFFAOYSA-N 386.432 5.299 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 731163388 VYTUEBGECYGLSV-MSOLQXFVSA-N 377.827 5.083 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(F)c(Cl)c1 731322386 YPUAWPZPUCEZQL-LLVKDONJSA-N 379.913 5.682 30 20 GKED CCCn1ccc2cc(NC(=O)NCc3cccc(O[C@H](C#N)CC)c3)ccc21 733845184 OQYVJOXKFXQKRH-FQEVSTJZSA-N 390.487 5.054 30 20 GKED CC[C@@H](NC(=S)Nc1ccccc1S[C@H](C)CC#N)c1cccs1 734379198 DYEIFGDQWRXXDE-ZIAGYGMSSA-N 375.588 5.580 30 20 GKED C#Cc1cccc(N(Cc2csc([C@@H](C)OCC)n2)Cc2cccs2)c1 736620412 UFVCDJIVAGFZFV-MRXNPFEDSA-N 382.554 5.490 30 20 GKED COc1ccc2sc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)c(C)c2c1 744117166 UXIYUXLIFRKKRB-AWEZNQCLSA-N 396.468 5.457 30 20 GKED O=C(/C=C/c1cnn(-c2ccc(Cl)cc2)c1)c1ccc(-c2ccncc2)cc1 745990099 JSUQLWVINCVTNJ-BCTAIJSYSA-N 385.854 5.484 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(C)n1Cc1ccccc1 747197931 OKJDPLORBZJRAD-IBGZPJMESA-N 377.513 5.223 30 20 GKED COc1cc(/C=C2/CCc3cc(SC)ccc3C2=O)ccc1OC(F)F 748146184 FBXRMMAIGMHRJZ-ZROIWOOFSA-N 376.424 5.231 30 20 GKED O=C(/C=C\c1ccc(-c2cccc(F)c2)s1)c1ccc(N2CCOC2=O)cc1 750913526 OBVGBZVMEXCVCV-NTMALXAHSA-N 393.439 5.407 30 20 GKED C[C@@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 751544633 ZAWIHAOZMGXGIB-UKDVSSAZSA-N 395.506 5.752 30 20 GKED Cc1ccc(OCCCC(=O)[C@H](C#N)c2ccc3ccccc3n2)c(Cl)c1 766238172 QASYZDISJOTILZ-QGZVFWFLSA-N 378.859 5.232 30 20 GKED Cc1ccc(C(=O)OCCCCC(C)(C)C#N)cc1NC(=O)c1ccccc1F 768592048 DIYJEKFFCDKPQI-UHFFFAOYSA-N 396.462 5.263 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCOc3c(Cl)cc(C)cc32)c1 772982285 BPWIBVOZHWAVPJ-DYESRHJHSA-N 384.907 5.333 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2cn3ccccc3c2C#N)cc1 773370617 JRCTXFUHDHYUTB-INIZCTEOSA-N 390.487 5.009 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2ccccc2OC)C2CCCC2)c1 774449239 NATUDGLPPSCDMM-GBXCKJPGSA-N 378.516 5.397 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCCc3c(O)cccc32)cc1 789739175 SRKLVNPOLMWEPX-GOTSBHOMSA-N 382.463 5.106 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C1(Cc2cccc(F)c2)CCCCC1 808714503 XQDGGMQKLPJOLP-QGZVFWFLSA-N 380.463 5.248 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)C(F)(F)c1c(F)cccc1F)C(F)(F)F 809316684 PAXDHIQHZQOFIW-SECBINFHSA-N 395.274 5.025 30 20 GKED COc1c(O)cccc1/C=C(/C(=O)c1nc2ccccc2s1)c1ccccc1 810232320 YCSYLFUFGAUJRZ-SAPNQHFASA-N 387.460 5.434 30 20 GKED C=CC[C@H](NC(=O)c1sc2ccccc2c1Br)c1ccncc1 810408926 XHUIHKBEERLVNU-AWEZNQCLSA-N 387.302 5.106 30 20 GKED N#C[C@@H](C(=O)Cc1ccc(-c2ccccc2)cc1)c1cc(C(F)(F)F)ccn1 813212458 CMRBIROCIZYVBV-LJQANCHMSA-N 380.369 5.186 30 20 GKED CC(C)[C@@H](Oc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813213890 QTNOKHZKTARPHP-CRAIPNDOSA-N 396.796 5.034 30 20 GKED CC(C)(C)c1ccc([C@@H](O)CCC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 817319609 QAJZDXHNOYHNPW-PKTZIBPZSA-N 392.543 5.349 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)n2)cc1 842296163 REJJREPDXBKZHF-PWHSHALESA-N 388.492 5.189 30 20 GKED FC(F)(F)CCC(CCC(F)(F)F)=NNc1ccc(C(F)(F)F)cn1 853262556 AKAQASKCTZUHFJ-UHFFFAOYSA-N 381.242 5.553 30 20 GKED C[C@H](Sc1cccc(C(F)(F)F)c1)C(=O)N(CCC#N)c1ccc(F)cc1 912698783 UFRPPQXRALJAHH-ZDUSSCGKSA-N 396.409 5.272 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Br)s2)cc1 915180999 VNACWQAISJDJJP-MRXNPFEDSA-N 397.297 5.418 30 20 GKED Cc1cc(/C=C\C(=O)Nc2cccc(OCC#N)c2)c(C)n1C1CCCCC1 915740640 BZSBPUWOYZTFQD-QXMHVHEDSA-N 377.488 5.164 30 20 GKED O=C(/C=C\c1ccc(OCc2ccncc2)cc1)c1ccccc1OC(F)F 915982688 WFLHRFYVKNYXPW-YFHOEESVSA-N 381.378 5.158 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc(Cl)c(OC)cc2OC)cc(Cl)c1O 916154355 CVXJENOEONXXFC-WAYWQWQTSA-N 397.254 5.011 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)(F)F)cc2)cc1 916912757 JVMYTDJQQPDBFH-SFHVURJKSA-N 388.389 5.009 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)CCc2ccc(Cl)s2)cc1 916915410 JAGFQCCUQUINEN-KRWDZBQOSA-N 388.920 5.024 30 20 GKED N#C[C@H](C(=O)CCc1ccc2ccccc2c1)c1nc(-c2ccccc2)cs1 917429134 KWWMWVJRWPYZKC-OAQYLSRUSA-N 382.488 5.772 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1sc(-c2ccccc2F)nc1C 1776088400 JKKHDIQAJCPNHI-UHFFFAOYSA-N 383.448 5.100 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3cccc4ccccc34)cc2)c1 1776114590 TVNDFGSAQZTTPV-SSZFMOIBSA-N 392.454 6.030 30 20 GKED C=CCCC[C@H](NCc1cc(C)c(OCc2ccccc2C)c(C)c1)C(=O)O 1776174230 CVOMFPBVUJJUIE-QFIPXVFZSA-N 381.516 5.090 30 20 GKED C=CCCC[C@@H](NCc1ccccc1Oc1cc(Cl)cc(Cl)c1)C(=O)O 1776207271 KJHQIUKIMTURSI-GOSISDBHSA-N 394.298 5.685 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776388545 BVYLBUXKXWQQEV-ACCUITESSA-N 376.408 5.328 30 20 GKED CCc1cccc2cc(/C=C/C(=O)c3ccc(OCCCC(=O)O)cc3)oc12 1776977811 JTXZCTYPTVIUKN-OUKQBFOZSA-N 378.424 5.135 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C\c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1777372564 JVYWZZCDNXFSBX-ZRRZQRFHSA-N 396.439 5.206 30 20 GKED N#C[C@@H](C(=O)CCc1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41537982 PDWTWUKLCSVNMM-AWEZNQCLSA-N 391.279 5.519 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc(-c2cccs2)cs1 60915777 XXLRNSRALLAJOE-UHFFFAOYSA-N 387.489 5.663 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@@H]1CCc2cc(F)ccc21 72023925 NJIKEXZVEBACGC-HXUWFJFHSA-N 388.467 5.266 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCc1nc2ccccc2s1 108241509 HPASVOQUKLSSTL-HNNXBMFYSA-N 395.553 5.509 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 109234709 GGTURUZJGWSNAJ-KRWDZBQOSA-N 394.515 5.156 30 20 GKED COc1cc(CN[C@H](C)c2ccc(C#N)cc2)ccc1OCc1ccc(F)cc1 128058943 XITVXMRXTCMLMR-QGZVFWFLSA-N 390.458 5.136 30 20 GKED COC1CCN(c2ccc(NCC(C)(C)CCC#N)cc2C(F)(F)F)CC1 129971875 OSPFJYWWTWAIOC-UHFFFAOYSA-N 383.458 5.062 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 174000845 NQUARCKKDQYMKP-CZUORRHYSA-N 385.389 5.016 30 20 GKED Cc1csc([C@@H](C#N)C(=O)CCSc2ccnc3cc(Cl)ccc23)n1 176080042 IWQCHDXFHFYEDW-AWEZNQCLSA-N 387.917 5.012 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(Sc2nncs2)cc1)c1ccccc1 186942804 UZYCUXKPEWOERX-SFHVURJKSA-N 381.526 5.378 30 20 GKED COc1ccccc1NC(=O)c1ccc(NCc2ccc(Cl)cc2C#N)cc1 187713066 UFWJDKODSRPUKH-UHFFFAOYSA-N 391.858 5.085 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)Cc1nc2c(s1)CCCC2 191516523 WLRCAGJJAXAKCN-UHFFFAOYSA-N 383.561 5.538 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3cccc4ccccc34)n2)cc1 193666127 WPRWWKXHOVGIQF-NRFANRHFSA-N 393.471 5.254 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(O[C@H](C)C#N)cc2)ccc1SC(F)F 255529346 FAGWQLSIRBHCOJ-WYOARUQKSA-N 389.423 5.197 30 20 GKED Cc1cc(C[S@](=O)CCCCC(C)(C)C#N)nc(-c2ccc(Cl)cc2)n1 277947836 QXYVLAFEGJNALL-AREMUKBSSA-N 389.952 5.074 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N(C)[C@H](C)c2cccc(C#N)c2)cc1 425131569 PXZDOSXXUDTEKE-MRXNPFEDSA-N 389.524 5.061 30 20 GKED Cc1cccc(C(NC(=O)NCC2CCC(C#N)CC2)c2cccc(C)c2)c1 441004573 XQKCJLDDSVSMPU-UHFFFAOYSA-N 375.516 5.022 30 20 GKED N#CC1CCC(CNC(=O)Nc2ccccc2-c2nc3ccccc3s2)CC1 441313815 GBIRZJJNOYKHGD-UHFFFAOYSA-N 390.512 5.415 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(C#N)cc1Cl 444901661 MTNVGRCYUANXQP-MRXNPFEDSA-N 381.785 5.335 30 20 GKED N#Cc1cc(F)c(C(=O)Nc2ccccc2Oc2ccccc2Cl)c(F)c1 445717718 HWLTVCVJNDXBQT-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CC[C@H](N[C@H](C)c1sc(-c2ccc(F)cc2)nc1C)c1ccc(C#N)cc1 447562566 MGYKZIFAHDHXNO-VLIAUNLRSA-N 379.504 5.931 30 20 GKED C[C@@H](Cc1coc2ccccc12)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 449272674 OAKRPUPILFPEQK-KRWDZBQOSA-N 387.483 5.059 30 20 GKED N#CC[C@@H]1CC[C@H](NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 449446766 SWPKVROODLGFGQ-HOCLYGCPSA-N 385.851 5.212 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1cccc(Cl)c1 453470128 ZMXHJFNSLKFZND-OALUTQOASA-N 386.927 5.091 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)ccc1F 469898637 HSWLQCQDIFPWLU-UHFFFAOYSA-N 379.822 5.215 30 20 GKED C=CCN(C(=O)c1ccn(C2CCCCC2)n1)c1nc(-c2ccccc2)cs1 470732516 LSCJLVSCWNYXKO-UHFFFAOYSA-N 392.528 5.345 30 20 GKED COCc1ccsc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 487692697 VVCANISFDPZJJH-UHFFFAOYSA-N 398.871 5.464 30 20 GKED CC[C@H](CN(C)CCCC1(C#N)CCOCC1)Oc1ccc(Cl)c(Cl)c1 499705392 JLSOPPIFVYWGKT-MRXNPFEDSA-N 399.362 5.183 30 20 GKED CCOc1cc(F)ccc1NC(=O)c1ccccc1Sc1ccccc1C#N 502061022 KUOCOQYWALDGSH-UHFFFAOYSA-N 392.455 5.500 30 20 GKED CC(C)Sc1ccc(Cl)cc1NC(=O)[C@](C)(C#N)CC(=O)OC(C)(C)C 503149946 FGJSNWOAJJGJQV-IBGZPJMESA-N 396.940 5.041 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(n2c(C)nc3ccccc32)CC1 505056151 AIMIYLGGZUVAJH-UHFFFAOYSA-N 388.515 5.332 30 20 GKED Cc1ccc(NC(=O)c2cc(C#N)ccc2Cl)c(OCc2ccccc2)c1 507188791 RPCWXIGVZLQBQC-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CC1(C#N)CCN(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)CC1 508050467 MFYOEJSBFGZSAN-JOCHJYFZSA-N 375.516 5.086 30 20 GKED CN(Cc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510024209 SUSLINQXYWATJR-NRFANRHFSA-N 389.886 5.659 30 20 GKED C[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(C#N)cc1F 512616305 AFSAIQPDLAJASJ-CYBMUJFWSA-N 377.444 5.418 30 20 GKED CN(Cc1ccc(C#N)s1)[C@@H]1CCSc2ccc(Br)cc21 513728117 FNXABAQQJKNDDA-OAHLLOKOSA-N 379.348 5.051 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(-c2ccccn2)cc1 514636945 FKNLWXYAVNHTKB-UHFFFAOYSA-N 383.904 5.684 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1 517782094 LVHUMMQUHOKCDE-UHFFFAOYSA-N 391.496 5.178 30 20 GKED Cc1cc(-c2noc([C@H](C)Nc3cc(C#N)ccc3OC(C)C)n2)ccc1F 518013592 MPOBBJCOPBIYFS-AWEZNQCLSA-N 380.423 5.016 30 20 GKED N#C[C@@H](NC(=O)c1ccc(F)c(C(F)(F)F)c1)c1ccc(Cl)c(Cl)c1 518320244 CLKBIEPZUPUWPC-CQSZACIVSA-N 391.151 5.146 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NC[C@@H]3CCc4ccccc43)cc2)cc1 520326847 PTFLOZRUUOVTCV-NRFANRHFSA-N 382.463 5.005 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520726223 JMJIULCDECEPOY-UHFFFAOYSA-N 396.805 5.404 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cnc2ccccc2c1C(F)(F)F 521541591 XOOCTHTXZFDMSW-UHFFFAOYSA-N 384.401 5.125 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1 522434724 PXQWIPCMAMSUKE-VWLOTQADSA-N 399.538 5.114 30 20 GKED N#Cc1cccc(OC2CCN(C(=O)Nc3ccc(-c4ccccc4)cc3)CC2)c1 524715034 ULYRAPMCSDMAQK-UHFFFAOYSA-N 397.478 5.301 30 20 GKED COc1ccc(CNc2ccc(C)c(Br)c2)cc1OCCCC#N 532726474 YPQYBROAARSMNV-UHFFFAOYSA-N 389.293 5.061 30 20 GKED CCN(C(=O)c1csc(-c2ccc(C)cc2)n1)c1ccc(C#N)c(Cl)c1 536972579 DPHUKFFVXAPZDP-UHFFFAOYSA-N 381.888 5.310 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(C#N)c(F)c1 538506860 GFMVDBMJGTXHDJ-SFHVURJKSA-N 387.502 5.277 30 20 GKED N#CC1(CCCN[C@H](c2cccc(F)c2)c2cccc(Cl)c2)CCOCC1 539710832 HUWFFGNPUSPLFE-NRFANRHFSA-N 386.898 5.259 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@@H](C)c2nc3ccccc3o2)cc1 540852947 OJRKULRAGMIFQX-HNNXBMFYSA-N 385.423 5.673 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1cccc2cc[nH]c12 547833821 WRKWBVBRHOYQJT-UHFFFAOYSA-N 382.423 5.784 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CC[C@@H](c2cccc(F)c2)C1 558330325 DKJQPLXOYUYFDN-LJQANCHMSA-N 386.426 5.119 30 20 GKED N#CC[C@@H](CC(=O)N1CCC(c2c[nH]c3ccc(F)cc23)CC1)c1ccccc1 561718116 VVKWZJKSKQTBRF-IBGZPJMESA-N 389.474 5.101 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](Oc2ncccc2F)C1 562351940 VNBPRQLQAZAMTI-SFHVURJKSA-N 397.494 5.148 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 564113535 VJNUYNKZLNHEGK-LHSJRXKWSA-N 391.515 5.858 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1 569639653 JUIXCIRLCHEJEX-YNEHKIRRSA-N 376.934 5.395 30 20 GKED C=CCC1(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)CCOCC1 582960012 WZFIQAZOTBWFQO-UHFFFAOYSA-N 392.524 5.199 30 20 GKED CCN(CCC(=O)Nc1sccc1C#N)C(c1ccccc1)c1ccccc1 583457358 AKBZOVNUOFDQAV-UHFFFAOYSA-N 389.524 5.060 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)CCc1ccccc1F 603532832 XPTMBNYCWUUPAX-UHFFFAOYSA-N 390.433 5.311 30 20 GKED CCCN(C(=O)Nc1ccc(C#N)cc1)[C@@H](C)c1ccccc1Br 604073033 MFERNCIXIIRBPT-AWEZNQCLSA-N 386.293 5.326 30 20 GKED Cc1cccc(Oc2ncccc2NC(=O)N(C)Cc2cccc(C#N)c2)c1C 604086105 ZANYEAQITLNSJY-UHFFFAOYSA-N 386.455 5.026 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1 609070405 WMNVMVYMTLFHCZ-JOCHJYFZSA-N 386.451 5.016 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)C1 612294352 LFQTZEVAIROPCP-OAQYLSRUSA-N 376.485 5.121 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@@H]3CCc4cc(C#N)ccc43)s2)cc1 618806062 NIGFYEUBHJHXEG-SPLOXXLWSA-N 389.524 5.337 30 20 GKED Cc1ccc(F)c(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1F 619126854 OPPGYFRCJJMELL-UHFFFAOYSA-N 377.275 5.057 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)N1[C@H]2CC[C@H]1CC(F)(F)C2 624377733 WOECTXNPWQFEHO-QWRGUYRKSA-N 396.322 5.012 30 20 GKED Cc1ccc(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c(F)c1 642403580 GVQRWLBAIAFVLE-NXEZZACHSA-N 386.311 5.165 30 20 GKED Fc1ccc(C(F)(F)F)cc1CN1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 678207921 IDGOIDHBGHCIJY-PHIMTYICSA-N 397.256 5.407 30 20 GKED COc1ccccc1/C(C)=C/C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 727304364 ALLUTJLKBHRCRS-YJCCFKNTSA-N 382.463 5.393 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1cccc(C#N)c1 727636810 ZBRNEVGCNIJJTB-LLVKDONJSA-N 388.901 5.244 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1ccc2ccccc2n1 727952843 TUOJHGKHHHNACY-OWSFEGEDSA-N 382.463 5.446 30 20 GKED CCN(C(=O)/C=C/c1ccccc1C#N)[C@H](c1ccccc1)c1ccc(F)cc1 730193661 PNQCJDACJVQZNB-YGMDYZATSA-N 384.454 5.349 30 20 GKED CC(C)N(Cc1ccccn1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 732878954 ULFYQWKSTAVGKK-QHCPKHFHSA-N 384.483 5.180 30 20 GKED C=CC[C@H](NC(=O)c1csc(-c2ccc(OC(C)C)cc2)n1)c1ccncc1 734361206 RNLYZPOXOOXAFW-IBGZPJMESA-N 393.512 5.040 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1sc(-c2ccc(C)cc2C)nc1C 741636110 GFKRODISYKJXSB-UHFFFAOYSA-N 394.471 5.139 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1sc(-c2cccnc2)nc1C 747601996 HYGNOJOXEIAJNA-UHFFFAOYSA-N 393.903 5.551 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)/C=C/c2ccsc2)cc1 750842226 FRYWIQWSVKRJSJ-YCRREMRBSA-N 376.437 5.073 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)/C=C\c2cccs2)cc1 750842520 XBQRQNLHTDHLMF-LUAWRHEFSA-N 376.437 5.073 30 20 GKED COc1ccc(NN=Cc2cccc(NC(=O)c3ccccc3Cl)c2)cc1 750920850 CUBGWAWPVDKTOV-UHFFFAOYSA-N 379.847 5.047 30 20 GKED CC1(C)C(=O)Nc2ccc(C(=O)/C=C/c3ccc(-c4ccncc4)cc3F)cc21 751537113 VJSLDTZLNVOSQH-SOFGYWHQSA-N 386.426 5.014 30 20 GKED CC(C)c1ccc(C2(O)CCC(=NNc3nc(C(F)(F)F)cs3)CC2)cc1 753931439 GMLVMDLZCGPDCQ-UHFFFAOYSA-N 397.466 5.515 30 20 GKED CCCCOc1ccc(C=NOCc2ncc(-c3ccccc3F)o2)cc1OC 754279896 RFHMPMHBWJLVKE-UHFFFAOYSA-N 398.434 5.219 30 20 GKED C=C[C@H](CC(=O)N(Cc1ccccc1)C[C@@H](O)c1ccsc1)c1ccccc1 759349882 UFVZREVEJGVPPJ-NFBKMPQASA-N 391.536 5.170 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(C=NNc2cc(C)ccc2F)cs1 759652401 IVGONOHTZITMHP-UHFFFAOYSA-N 382.464 5.030 30 20 GKED C[C@@H](NC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccc[nH]1 760764858 FFUKOLXCTNYVBY-CQSZACIVSA-N 394.862 5.001 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@@H]3CCOC3)c2)cc1 761311281 OJCZYDZNUWGRMD-VWNXMTODSA-N 382.463 5.098 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(Br)ccc2F)c(Cl)c1OC 763122973 WQSRQHMCEOUXIP-XVNBXDOJSA-N 399.643 5.155 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccc([C@H]3CCCOC3)c2)cc1 766355414 LCGWMHUYIXFLMZ-ZCYQVOJMSA-N 396.490 5.488 30 20 GKED CC(C)c1ccc(NC(=O)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 782827092 YKZCPRQHKJKHLH-HSZRJFAPSA-N 397.478 5.043 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C/c1csc(-c2ccsc2)n1 787179223 OEMZZOLAQRCULO-HWKANZROSA-N 389.885 5.208 30 20 GKED CCCc1cc(C(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)ccc1Cl 788352117 RLVZPTBGWPGLHX-IBGZPJMESA-N 396.918 5.378 30 20 GKED CC(C)c1c(NC(=S)Nc2ccc(C#N)c(Cl)c2)cnn1-c1ccccc1 792688553 MYSYTECJRVOFRA-UHFFFAOYSA-N 395.919 5.330 30 20 GKED FC(F)c1ccc(C=Nn2c(S)nnc2Cc2cccc3ccccc23)cc1 794474582 QREJVPVJLNHZFX-UHFFFAOYSA-N 394.450 5.131 30 20 GKED FC(F)Sc1ccc(NC(=S)NN=C2CCC[C@@H]2c2ccccn2)cc1 794871284 WRJRVNWYVIWUJY-CQSZACIVSA-N 392.500 5.006 30 20 GKED O=C(NC[C@H](c1ccccc1)C(F)(F)F)[C@@H](F)c1ccc(C(F)(F)F)cc1 801692600 SBJYHDSWZCMCCJ-CABCVRRESA-N 393.302 5.178 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2csc(-c3ccsc3)n2)C(=O)c2ccccc21 802708919 XUHVTBKSCQBQBY-MXHVWWQHSA-N 395.505 5.188 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)c1ccc(F)c2ccccc12 808842765 FWSLCFHDWHSAAC-LSDHHAIUSA-N 377.419 5.152 30 20 GKED C#CCOc1ccccc1-c1noc(-c2c(-c3ccccc3Cl)noc2C)n1 809396602 AUYMXPDKCWOZFG-UHFFFAOYSA-N 391.814 5.032 30 20 GKED CCN(Cc1ccc(N(C)CCC#N)cc1)Cc1cccc(-c2ccncc2)c1 809747926 IEFCLLTWMFJKPH-UHFFFAOYSA-N 384.527 5.121 30 20 GKED C#Cc1ccccc1CC(=O)N(c1nc2ccccc2s1)c1ccccc1C 812826043 XOLSDZPNRSXQDB-UHFFFAOYSA-N 382.488 5.493 30 20 GKED C=CCC(F)(F)C(=O)N(CC)[C@H]1CCSc2ccc(Br)cc21 815408039 SKGXLTDCRYBRSP-ZDUSSCGKSA-N 390.293 5.046 30 20 GKED N#CCCC[C@H](N[C@H]1CCCN(C(=O)Oc2ccccc2)CC1)c1ccccc1 815636020 NRIFZVZKNVNSNR-GMAHTHKFSA-N 391.515 5.065 30 20 GKED CCOc1cc(/C=C2/CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)cc(Cl)c1O 818242826 LZNXAXUCZKLRIN-SRKDFGFSSA-N 399.830 5.182 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCC[C@H]1c1ccc(Cl)cc1 836457474 WRDPGWJMVUCNSO-SFHVURJKSA-N 387.842 5.141 30 20 GKED Cc1nc(SCC(C)C)sc1CC(=O)[C@H](C#N)c1ccc2ccccc2n1 850741840 QJWVBUXKNCHJMR-MRXNPFEDSA-N 395.553 5.167 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCCC[C@H]1c1nnc([C@H]2CCCO2)o1 854460128 DDCWMXYAUULYRO-GBESFXJTSA-N 391.556 5.361 30 20 GKED N#Cc1ccc(C2(c3nc(-c4ccccc4Br)no3)CCCC2)cc1 904959112 CHPUXJCFXVQWFU-UHFFFAOYSA-N 394.272 5.231 30 20 GKED C[C@H](Nc1ccc(CCC#N)cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 905854194 KGBRQMZDHUVQGP-LBPRGKRZSA-N 395.812 5.254 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cccc([N+](=O)[O-])c1 914554780 RQXVFNUFTVWHHJ-UHFFFAOYSA-N 383.839 5.003 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(F)c(Br)c1 915987057 PMSQDDIUQRGZSD-FNORWQNLSA-N 389.249 5.003 30 20 GKED O=C1/C(=C/c2ccc(OCc3ccncc3)cc2)CSc2c(F)cccc21 915988026 NCUPQSOAQRDNPH-SFQUDFHCSA-N 377.440 5.172 30 20 GKED COc1cccc(-c2nc(/C=C3\CSc4ccc(F)cc4C3=O)cs2)c1 916128680 WDNMYPMNAFRWBL-NTUHNPAUSA-N 383.469 5.330 30 20 GKED Cc1sc(NC(=O)CSc2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 1640866603 OVTPJBFCCUBIOA-UHFFFAOYSA-N 399.928 5.374 30 20 GKED O=C(O)c1cc(NN=Cc2c(Cl)cccc2Oc2ccccc2)ccc1F 1776062375 QTOQFDBMOSRBLU-UHFFFAOYSA-N 384.794 5.416 30 20 GKED CCCCCCCOc1ccc(/C=C\c2ncc(C(=O)O)c(C(C)C)n2)cc1 1776788225 RRBHAKMSPUTWCY-KAMYIIQDSA-N 382.504 5.818 30 20 GKED COc1cc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)ccc1Cl 1777263130 TWDXRCBSPCWRRO-ZZXKWVIFSA-N 390.819 5.297 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C/c1ccc(-c3cccc(C(=O)O)c3)s1)CC2 1777371110 MDZHBYVUVWDCNW-FOWTUZBSSA-N 390.460 5.334 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(C(=O)O)cc3Cl)s2)cc1 1777430630 VDCXWAZULAQBFB-MDZDMXLPSA-N 397.883 5.675 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccccc1OCCC1CCCCC1 1777436295 GUEGOXQZMJYGNN-BUHFOSPRSA-N 392.495 5.939 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)/C=C\c1ccc(C(=O)O)s1 1777487780 SKGSFOQEXRQPRW-VURMDHGXSA-N 389.885 5.428 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc([N+](=O)[O-])ccc3Cl)c2c1 1777685710 UXNXMXULVZLFNH-KTAJNNJTSA-N 387.800 5.057 30 20 GKED C=CCCC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(C(C)C)cc1)C2 1792573459 TYMMFDZLRGKTOU-KOUNCHBCSA-N 396.575 5.054 30 20 GKED Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4ccc(CC#N)cc4)cc3)o2)c1 30933074 XJIPQKHLWZKEEM-UHFFFAOYSA-N 394.434 5.030 30 20 GKED CSCc1ccc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1 31776820 MZPYMVOBVHEMLZ-UHFFFAOYSA-N 388.492 5.253 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c(Cl)c2ccccc21 51656385 JXNRDOCPGZUSHL-GFCCVEGCSA-N 398.800 5.067 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)NC(C)C)cc1 55012667 WVWOWRMUBUVPOL-UHFFFAOYSA-O 383.581 5.123 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C1c2ccccc2Oc2ccccc21 62904322 ABXZDZJITSYGML-UHFFFAOYSA-N 380.447 5.011 30 20 GKED N#CCOc1ccc(C(=O)/C=C/C2=Cc3cc(Cl)cc(Cl)c3OC2)cc1 72057952 NTPZNLFHOFMHGL-LZCJLJQNSA-N 386.234 5.111 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Cl)cc2cccnc12 108240565 CAILAXJDDNLERN-ZDUSSCGKSA-N 381.888 5.392 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)c1c(C)noc1C 114003698 SVWVYYPDXCWJIB-CQSZACIVSA-N 390.443 5.147 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nnc(/C=C/c2ccco2)s1 134475268 FATZSBNMIKZULW-VAWYXSNFSA-N 398.447 5.092 30 20 GKED Cc1nc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(C)s1 151636770 KNAKKRCCQYXOCR-SFHVURJKSA-N 395.915 5.250 30 20 GKED CC[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 159985823 CAHMRRBALYQTNT-UZLBHIALSA-N 379.529 5.480 30 20 GKED N#Cc1csc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)c1 176826683 QYGJCZSJHMTEOY-UHFFFAOYSA-N 389.505 5.119 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](c1ccccc1OC(F)F)C(F)(F)F 179903839 FRXPAQLRLHJTSX-KRWDZBQOSA-N 398.375 5.482 30 20 GKED C=C(C)[C@@H](NC(=O)N(Cc1ccco1)Cc1ccco1)c1ccc(F)c(F)c1 185481565 TYXOVCBMBXUESH-HXUWFJFHSA-N 386.398 5.180 30 20 GKED Cc1cnccc1CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 188604229 FVKKAJJUNZRJFA-FQEVSTJZSA-N 390.874 5.021 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)n1 194079718 YNMCTUZLQCPXRS-INIZCTEOSA-N 395.465 5.001 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2sc(C(C)(C)C)nc2C)cc1OC 206861737 CRTVHEYINAKLAJ-KTKRTIGZSA-N 389.517 5.061 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCOC2(CCSCC2)C1 276400864 KLYZTPIWESXBRE-SFHVURJKSA-N 388.577 5.105 30 20 GKED COc1cc(C(=O)Nc2ccc(F)cc2C#N)cc(Cl)c1OCCC(C)C 433983753 CXZIPCQFQSANAF-UHFFFAOYSA-N 390.842 5.037 30 20 GKED CC(C)(C#N)CCCCS(=O)(=O)Cc1ccc(Oc2ccccc2)c(F)c1 436091499 ITVDLTOVLKRABA-UHFFFAOYSA-N 389.492 5.253 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(CC(F)(F)F)cc1 438366819 XUGPUDBFNQZIJW-OALUTQOASA-N 387.405 5.095 30 20 GKED Cc1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)ccc1OCC(F)(F)F 439396932 PRVGTUBZBUAMRA-KRWDZBQOSA-N 391.393 5.103 30 20 GKED C=CCC[C@H](NC(=O)CSCc1ccccn1)c1ccc(C(F)(F)F)cc1 441577274 BPGDMPXRCYXDEE-SFHVURJKSA-N 394.462 5.157 30 20 GKED C=CCC[C@@H](NC(=O)NCCCc1ccccn1)c1ccc(C(F)(F)F)cc1 442234570 GKZJOUNEWCQGAX-LJQANCHMSA-N 391.437 5.040 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)CCCC1(C)C 444837563 MJNBBGCMUBKOTO-IBGZPJMESA-N 381.476 5.131 30 20 GKED CC[C@@H](N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1 447546246 UIFGLAKCCBZBBN-ZJSXRUAMSA-N 380.495 5.275 30 20 GKED CC(C)(C)C(=O)CCCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 448753907 RJCLSDPBCMLCJG-UHFFFAOYSA-N 392.499 5.056 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1cccc(C2CC2)c1 451113858 JWOCLBRPFSUVDG-IAGOWNOFSA-N 393.556 5.248 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(C(F)(F)F)n1 455238008 AYPFELBSOYEZGY-UHFFFAOYSA-N 377.410 5.274 30 20 GKED CC[C@@H](CC(F)F)C(=O)N(C)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 457799548 VYTPSXZMTHPMBL-JTQLQIEISA-N 391.302 5.364 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@@H]1c1ccc(F)cc1F)c1ccccc1 458840576 NTYXIPUJCCMIOO-LEWJYISDSA-N 383.442 5.246 30 20 GKED Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 460467511 PICGCWFEMBEYDZ-NSHDSACASA-N 389.864 5.061 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 463769885 KVAYODNKRZPMCF-AWEZNQCLSA-N 393.468 5.157 30 20 GKED CC(C)=CCSc1ccccc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464473568 SKUUJJHTVDOMMK-MRXNPFEDSA-N 390.430 5.649 30 20 GKED N#CCCCn1cc(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)c2ccccc21 468810398 CQPZLPMYZWPYAN-LJQANCHMSA-N 399.416 5.369 30 20 GKED CCNc1ccc(C#N)cc1NC(=O)c1ccc(-c2nc3ccccc3s2)o1 469948138 QOHRCCGAIFJYQD-UHFFFAOYSA-N 388.452 5.112 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1 470499591 WZBODHQNHDIWQM-KRWDZBQOSA-N 377.513 5.269 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccccc3OCC(F)F)c2)cc1 474992137 KQCHKRVIAZGZDZ-UHFFFAOYSA-N 394.377 5.247 30 20 GKED CC(C)(C#N)c1ccc(N[C@H](c2ccccc2)c2nc(-c3ccccc3)no2)cc1 475755866 PAMDJLNIHCWRIQ-JOCHJYFZSA-N 394.478 5.739 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)cc1 476053239 QICDIZTZRORQJE-IBGZPJMESA-N 384.932 5.071 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1c1ccc(Br)cc1 476172696 WZZDIGWIVOXDEX-WOJBJXKFSA-N 398.344 6.043 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(-c2csc(C(F)(F)F)n2)cc1 477708546 VOVVKARJVARDCE-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CC[C@H](C)n1ncc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1C 480548280 BXAYLTOAYVVAHD-DLBZAZTESA-N 386.499 5.192 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(=O)C2CCC2)cc1 486988237 IFSHXVPQYNGKNQ-UHFFFAOYSA-N 389.499 5.231 30 20 GKED C=CC[C@H](C(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1)c1ccccc1 489705432 VOJHUVPMAMTKTA-CVEARBPZSA-N 394.462 5.228 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 493905326 SORVZTIWHWZMDT-UHFFFAOYSA-N 395.503 5.061 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 494548655 OULYJTZYLJIXBQ-AWEZNQCLSA-N 391.393 5.593 30 20 GKED COc1cc(Cl)cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 496406536 HKDCXVYSTOBKMH-ZDUSSCGKSA-N 377.252 5.102 30 20 GKED Cc1c(C(=O)Nc2ccc(OCC(F)(F)F)c(C#N)c2)oc2c(C)cccc12 498312345 BBYHDVOBOACIJJ-UHFFFAOYSA-N 388.345 5.115 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cccc(Br)c1 500406737 UKUWCPQEBQZQKQ-CYBMUJFWSA-N 386.293 5.133 30 20 GKED CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 502401360 URMVTWPJGSZCEZ-HXUWFJFHSA-N 383.923 6.002 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1nc(-c2ccccc2)cs1 505755522 FVVOUWSMUFEJMA-OAHLLOKOSA-N 388.279 5.363 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1nc(C(C)C)oc1C 506805666 NZKIMFYULDAPAQ-UHFFFAOYSA-N 375.428 5.331 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 509517047 RZCZLWMEVFGXGB-UHFFFAOYSA-N 387.439 5.535 30 20 GKED C[C@@H](NC(=O)Nc1cccc(OCc2cccc(F)c2)c1)c1ccc(C#N)cc1 511354948 IUQSWLXSAHNSLR-MRXNPFEDSA-N 389.430 5.159 30 20 GKED C[C@@H](Nc1ccc(C#N)c(C(F)(F)F)c1)c1ccc(OCc2cccnc2)cc1 518814683 GCWIQPWIADHSRI-OAHLLOKOSA-N 397.400 5.724 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(Cc3ccccc3)C3CC3)cc2)cc1 520322198 BALNEOIKJQIYTR-UHFFFAOYSA-N 382.463 5.350 30 20 GKED CCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CCC1 523420816 BQLFHAPGXOPIMN-UHFFFAOYSA-N 383.879 5.197 30 20 GKED CCN(Cc1ccc(Cl)cc1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523590914 KCWLBLPEAUFVBH-UHFFFAOYSA-N 389.886 5.189 30 20 GKED CC(C)c1cccc(N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 532485943 NHESDDFUTGJRMI-KRWDZBQOSA-N 381.545 5.279 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H](c3cccnc3)C3CC3)cc2)cc1 534777036 PALSBQXMMBUMIZ-JOCHJYFZSA-N 384.439 5.018 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(C)Cc2ccccc2C1 536732944 NQKGMPVVOLFLMT-INIZCTEOSA-N 379.529 5.007 30 20 GKED Cc1nnc(N(CCC(C)C)C(=O)c2ccc(C3(C#N)CC3)cc2)c2ccccc12 538543300 VGQIFBHXHLPIBL-UHFFFAOYSA-N 398.510 5.186 30 20 GKED COc1ccc2ccccc2c1-c1cc(CNc2ncc(C#N)cc2Cl)on1 538673415 QRQBWTLLUGCWOZ-UHFFFAOYSA-N 390.830 5.036 30 20 GKED CC(=O)c1c(C)oc2ncnc(N[C@H](C)c3ccc(-c4cccc(C#N)c4)cc3)c12 542019198 SCOHILXZFJWQDS-CQSZACIVSA-N 396.450 5.446 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2C[C@H](C)C[C@H]2c2cccnc2)cc1 544483437 NQAVBFGSQGWLEP-HXOBKFHXSA-N 397.478 5.277 30 20 GKED N#C[C@H](C(=O)c1oc2ccccc2c1CSCc1ccccc1)c1ccncn1 546153264 MNXOJUCFZFZEKP-SFHVURJKSA-N 399.475 5.146 30 20 GKED CCN(C(=O)[C@@H](C)CC(=O)c1ccc(Cl)cc1)[C@@H](C)c1ccc(C#N)cc1 546794693 LXORKBXZWYVJBH-HOTGVXAUSA-N 382.891 5.030 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(-c2cncc(F)c2)ccc1C 549062959 BCHAASXPPXRXPC-UHFFFAOYSA-N 389.474 5.806 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C)c1nc(N)c2c(C)c(C)sc2n1 553457527 WGNIUOGHNHMCRK-LLVKDONJSA-N 392.981 5.354 30 20 GKED C[C@H](NCc1cnc2ccc(C#N)cn12)c1ccc(-c2ccc(Cl)cc2)s1 556599046 WWRKQDOXXYBKCN-AWEZNQCLSA-N 392.915 5.439 30 20 GKED C[C@@H](c1nc2ccccc2s1)N(C)Cc1ccc(Br)cc1C#N 561866923 KXPQYZLRRKMZSO-LBPRGKRZSA-N 386.318 5.123 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1 571709223 WUQYBMROVOXILB-OAHLLOKOSA-N 394.346 5.479 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)C1(c2cc(F)cc(C#N)c2)CC1 572519214 AFUWZBYNXQWRNV-UHFFFAOYSA-N 380.463 5.073 30 20 GKED COc1ccc([C@H](C)N[C@H]2CCCc3cc(C#N)ccc32)cc1Br 576131629 ZXDSMXWEAUCTIA-DJJJIMSYSA-N 385.305 5.058 30 20 GKED C[C@@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)c(F)c1 578611971 DSIMQUKQVSQMET-BLVKFPJESA-N 378.369 5.398 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NC[C@H]2CCCSC2)cc1Cl 579040064 FAYMUQDREOHANZ-DNVCBOLYSA-N 399.947 5.260 30 20 GKED C[C@@H](NC(=O)NCC1(C#N)CC1)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 583120743 ZGPFUKIRRIYDMF-GFCCVEGCSA-N 393.434 5.098 30 20 GKED C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)CCCCCC#N 588869426 OWNDSSGLZVBKNQ-IYBDPMFKSA-N 389.927 5.156 30 20 GKED N#Cc1cc(Oc2ccc(NCc3c(Cl)ccc4cccnc34)cc2)ccn1 589324404 GAEFOHWGBRFVLA-UHFFFAOYSA-N 386.842 5.559 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 589366878 NCXDUYROJPIYJT-KRWDZBQOSA-N 386.455 5.279 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3nc4ccccc4s3)sc2c1 591020085 PZWWXCRUHLUBLX-GFCCVEGCSA-N 382.897 5.963 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(C(F)F)ccc1F 593254757 MEGNWALUPGKKNH-UHFFFAOYSA-N 375.394 5.325 30 20 GKED CCCc1ccc([C@@H](NC(=O)N2CCC[C@@H](CC#N)C2)c2cccs2)cc1 596108115 VDVHKVCXKKENCE-GHTZIAJQSA-N 381.545 5.125 30 20 GKED CCCN(C(=O)c1cnn(CC(C)C)c1C(F)F)c1cc(Cl)ccc1C#N 598812628 YTMGKIFPNMAEAI-UHFFFAOYSA-N 394.853 5.059 30 20 GKED CCc1onc(C)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 603759092 UBWNISSPOFQXQT-QGZVFWFLSA-N 379.847 5.107 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1 603806804 MMVQVKWEXSZGEJ-CYBMUJFWSA-N 397.887 5.050 30 20 GKED N#Cc1cccnc1NCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 603870606 GWVYYJHXJVVOST-UHFFFAOYSA-N 394.434 5.545 30 20 GKED C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1cccc(OCCCC#N)c1 608895862 BUHNCPBKVRFETL-ZDUSSCGKSA-N 393.270 5.082 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2ccccc2)n1)c1cccc(Cl)c1Cl 609416395 NUOMXRFVGWGUSQ-CQSZACIVSA-N 388.279 5.112 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)o1 609461069 XXVBZIYUKJJOJI-WHCBVINPSA-N 377.271 5.023 30 20 GKED Cc1ccccc1COc1c(C)cc(CN(C)C[C@H](C#N)CCC#N)cc1C 609681662 LNFSUMBNCQTIAN-NRFANRHFSA-N 375.516 5.066 30 20 GKED C[C@@H](SCCC(=O)Nc1cccc(Br)c1)c1ccc(C#N)cc1 609901433 WEOHATUBHOSEQP-CYBMUJFWSA-N 389.318 5.144 30 20 GKED N#Cc1c(NC(=O)c2cccc(Oc3nccs3)c2)sc2c1CCCCC2 609910471 KTJXPZMRBQSJTK-UHFFFAOYSA-N 395.509 5.390 30 20 GKED C[C@H]1C[C@@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 610142445 LWXJMWNMBDIVBA-CABCVRRESA-N 383.879 5.053 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)C1 612302730 VMGQEIZLAIQLAR-NRFANRHFSA-N 383.879 5.077 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)c1ccsc1 619787691 ZXSXALZWARJJQT-OAHLLOKOSA-N 377.469 5.603 30 20 GKED COc1cc([C@H](C)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ccc1F 678113361 QHCGQEOOBFXBJF-DLOVCJGASA-N 387.339 5.394 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc3c(c2)oc2ccccc23)cc1Cl 726460646 GBIIKKMBCXCNRA-UHFFFAOYSA-N 377.856 5.920 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(O[C@H](C)C#N)cc3)s2)cc1 728697712 HWRAQKHZITTYIE-LPDYGMJQSA-N 388.492 5.614 30 20 GKED N#C[C@H](C(=O)CC1=CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 730398652 LHHSEIZSYWQHQO-OAHLLOKOSA-N 391.323 6.184 30 20 GKED COc1ccc2c(c1)CCCN2C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 731965351 WKTYPEPCMDAAPL-UHFFFAOYSA-N 398.462 5.147 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)OC(=O)Cc1ccc(C#N)cc1 734727852 DWQKEFZHJKRSQR-AWEZNQCLSA-N 396.899 5.491 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 734966269 XCROHYMPEVBBPX-ACJLOTCBSA-N 398.890 5.973 30 20 GKED C=CCN(C(=O)Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)C(C)C 737010356 VVXSCQXPGCHKSS-UHFFFAOYSA-N 384.320 5.075 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)s1 744117128 UNRFBXWKZSVGEL-GFUIURDCSA-N 385.489 5.079 30 20 GKED Oc1nc2ccccc2cc1C=Nc1ccc(N2CCc3sccc3C2)cc1 748585598 IYENZAJIKZXKHO-UHFFFAOYSA-N 385.492 5.315 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3cnc(-c4ccccn4)s3)cc2)cc1 748682737 FCDKGNTZIYVLKO-UHFFFAOYSA-N 399.431 5.088 30 20 GKED COc1ccc(C(=O)/C=C/c2coc(-c3ccccc3)n2)cc1Br 749891402 JFSXNYDVABKDHM-CMDGGOBGSA-N 384.229 5.009 30 20 GKED C[C@H](C#N)Oc1ccc(CNCc2ccc(-c3ccc4c(c3)C[C@@H](C)O4)cc2)cc1 756991788 WLJXBYDYUTYTHR-RTBURBONSA-N 398.506 5.258 30 20 GKED C#CC[C@@H](NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccccc1 758003602 OVSJLAVMZGMDAB-IAZZRBKQSA-N 375.434 5.016 30 20 GKED O=C(/C=C/c1cnc(-c2cccs2)s1)c1cc(Br)ncc1F 762421545 JUBZAMBUGCVUIM-ONEGZZNKSA-N 395.278 5.064 30 20 GKED C#CC[C@H](N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccccc1 773113837 FAEFZNGEDVEJSY-KKSFZXQISA-N 376.525 5.542 30 20 GKED O[C@H](CN[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 775191987 NQYQBEHEGWUKHI-HZPDHXFCSA-N 395.318 5.161 30 20 GKED N#C[C@@H](C(=O)Cc1cccc(F)c1F)c1nc2cc(C(F)(F)F)ccc2s1 775226540 FULALQVPFHAWQI-NSHDSACASA-N 396.340 5.012 30 20 GKED CCCCC[C@H](NCC1=CC(=O)n2c(nc3ccccc32)[C@H]1C#N)c1ccccc1 775318108 SQQJIQZSNAPVQP-SFTDATJTSA-N 398.510 5.135 30 20 GKED CCOc1cccc2cc([C@H](C)NCc3cccc(O[C@@H](C#N)CC)c3)oc12 776163382 AGFHCWQFDBABSY-QFBILLFUSA-N 378.472 5.363 30 20 GKED CCCc1c(NC(=S)Nc2ccc(CC)cc2)cnn1-c1cccc(C#N)c1 783953258 LVCBSOZIMKPMDG-UHFFFAOYSA-N 389.528 5.068 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3ccccc3)cs2)c(-c2ccncc2)n1 788349866 MNDQNALYJQBHAS-FPLPWBNLSA-N 383.480 5.153 30 20 GKED Cc1nc([C@H](C)OC(=O)c2ccc(F)c(C#N)c2)oc1-c1ccc(Cl)cc1 792324195 OBOBZGVUOZTUSY-LBPRGKRZSA-N 384.794 5.232 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(Br)cc1 794998166 JYDUHKKMOBOQGT-UHFFFAOYSA-N 375.335 5.224 30 20 GKED COc1cc(C2SCCS2)ccc1OC(=O)C[C@@H](CC#N)c1ccccc1 796540201 QGKXGNZLYGOLPR-MRXNPFEDSA-N 399.537 5.167 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)c(C)cc1Cl 796637349 VOODATOASOTLLY-CYBMUJFWSA-N 395.673 5.225 30 20 GKED N#CC1(CCCOC(=O)c2sc3cc(Cl)ccc3c2Cl)CCOCC1 800082913 VDBIWPOKNMNTBM-UHFFFAOYSA-N 398.311 5.465 30 20 GKED CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)c(Cl)c2)c2ccccc21 800989398 CESHWXJBVYVFGH-WOJBJXKFSA-N 397.906 5.012 30 20 GKED Cc1cc([C@@H](OC(=O)CCCCCC#N)C(F)(F)F)ccc1Br 805929769 PZMIXRIGMUBMSX-OAHLLOKOSA-N 392.215 5.378 30 20 GKED N#Cc1cc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)nc2ccccc12 809079297 KGCUYCCDWXRHPE-UHFFFAOYSA-N 376.630 5.319 30 20 GKED Cc1ccc(C(C)C)c(OCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813215209 UGJDQSYYLHUMBC-QGZVFWFLSA-N 390.405 5.178 30 20 GKED N#C[C@@H](C(=O)CCC(=O)c1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813216790 ZCPOLFJQJQKHRA-GOSISDBHSA-N 396.368 5.093 30 20 GKED CC(=NNc1ccc(F)c([N+](=O)[O-])c1)c1sc(-c2ccc(F)cc2)nc1C 814904915 DTYLYZUITFCSRK-UHFFFAOYSA-N 388.399 5.141 30 20 GKED CC(C)c1ccc(C2(O)CCC(N[C@H](CCCC#N)c3ccccc3)CC2)cc1 815635537 FCKHGMVZGFUYEI-GXUWAKPLSA-N 390.571 5.965 30 20 GKED C#CCCCCCC(=O)NC1(c2nc(-c3ccccc3F)c(C)s2)CCC1 819342938 VBQDRQIHRUKALK-UHFFFAOYSA-N 384.520 5.337 30 20 GKED Fc1ccc(-c2ccc(C=Nn3c(S)nnc3-c3ccc(F)cc3)s2)cc1 839410065 IUPCOEBNXIBIDE-UHFFFAOYSA-N 398.463 5.123 30 20 GKED CCC(CC)(COCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2o1 842694738 ZDWFTMHJJGQFAD-SFHVURJKSA-N 376.456 5.027 30 20 GKED C[C@H](c1cccs1)N1C(=O)/C(=C/c2ccc(C3(C#N)CC3)cc2)SC1=S 849173056 BNQZSSWDJGMCAO-GPLLRDDGSA-N 396.562 5.266 30 20 GKED CC(C)c1ccc(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917045257 XLYBRKXHRSQQMM-MRXNPFEDSA-N 384.888 5.328 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)N[C@@H]1C[C@H]2CC[C@H]1C2 920078283 AJMSDURCABITEI-XGHQBKJUSA-N 377.513 5.134 30 20 GKED O=C(Nc1ccc(C(F)F)cc1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 933112418 TXJWKSHDDZCREF-NXEZZACHSA-N 390.274 5.219 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1ccccc1C(=O)O 1776031031 IXJOVTBXCGMKFH-UHFFFAOYSA-N 380.831 5.585 30 20 GKED CCCCOc1ccc(C(C)=NNc2ccc(Cl)c(C(=O)O)c2)cc1OC 1776033380 VNXRSMPGYOMGLF-UHFFFAOYSA-N 390.867 5.062 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C)c(C(=O)O)c2)cc1 1776125573 MATPLMUZYDAOMD-DQXUBXGMSA-N 394.511 6.185 30 20 GKED C=C(C)C[C@@H](NCc1ccccc1Oc1cc(Cl)cc(Cl)c1)C(=O)O 1776139095 FQYWUDCPQBZURV-QGZVFWFLSA-N 380.271 5.295 30 20 GKED C=CCOc1c(Cl)cc(CN[C@H](CCCCCCC)CC(=O)O)cc1OC 1776183343 ZVKPREPRNZAHKS-QGZVFWFLSA-N 397.943 5.207 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776471096 JJLJVNKWSWVBLH-JLVNDZCYSA-N 396.386 5.047 30 20 GKED COc1ccc(/C=C2/CCCc3cc(C(=O)O)ccc3C2=O)cc1OCC(C)C 1777359893 DJPGRGUMDZQRTQ-WQRHYEAKSA-N 394.467 5.031 30 20 GKED Cc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)c(Br)c1 1777433854 ZVRQHUFPPCASTK-HWKANZROSA-N 385.666 5.067 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1ccc(CC2CC2)s1 1777569418 PRMGXJMZQWHSJX-YWEYNIOJSA-N 394.448 5.261 30 20 GKED C=CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCCCCC(C)(C)C)CC1 1831860927 IMYANNLXPVCPOE-OAQYLSRUSA-N 390.612 5.179 30 20 GKED C[C@@H](NC(=O)C1(c2cccc(Br)c2)CCCC1)c1ccc(C#N)cc1 26130013 DFYGHOYTEFHZKL-OAHLLOKOSA-N 397.316 5.010 30 20 GKED COc1ccc(SCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 51533540 PYFHIILLVAMJGK-SFHVURJKSA-N 394.521 5.177 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 51534131 QIYZELJUOZYJIN-QAPCUYQASA-N 378.522 5.308 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H](C)c1cccs1 56800296 UNEFZJHWGDHCNL-MRXNPFEDSA-N 391.496 5.945 30 20 GKED COc1ccc(/C=C/c2ccc3ccc(Cl)cc3n2)cc1OCCCC#N 64367467 GQCBLPZRCKFSAZ-RUDMXATFSA-N 378.859 5.750 30 20 GKED Cc1c(C#N)c(SCc2ccc(OCc3ccccn3)cc2)nc2c1CCC2 65845169 MIVCINUAXRIWNX-UHFFFAOYSA-N 387.508 5.017 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)N[C@H]2C[C@H]2c2ccccc2)cc1 67583159 ZNZCMDXGDNBYJU-UPVQGACJSA-N 397.478 5.009 30 20 GKED C=CCn1c(SCCCC(C)=O)nc2scc(-c3ccc(C)cc3)c2c1=O 71840459 ZPAIXHZNPJCRCQ-UHFFFAOYSA-N 398.553 5.081 30 20 GKED CCOc1ncccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 107647275 APPQRFDXKPMRJR-LJQANCHMSA-N 391.858 5.041 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCC(=O)c1ccc(Cl)cc1 108324167 HLDDUOSPFFIEOD-AWEZNQCLSA-N 386.904 5.193 30 20 GKED C=CCN(C(=O)CCOCC)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 110878749 VYDFUIVMYZEWIQ-UHFFFAOYSA-N 385.316 5.063 30 20 GKED C[C@@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1cccs1 120187766 GNGHVSXGXBJVMJ-LLVKDONJSA-N 384.448 5.515 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3cc(C#N)ccc3OC(C)C)o2)cc1C 123548646 IPISKGLTNDEHJR-MRXNPFEDSA-N 376.460 5.185 30 20 GKED CCN(CC(=O)Nc1ccccc1SCC#N)[C@@H](C)c1cc2ccccc2o1 173246058 UEWNSTNMKBQFDN-INIZCTEOSA-N 393.512 5.070 30 20 GKED CCC[C@@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 181774622 FUPNLJBQCNFFLT-IEBWSBKVSA-N 381.545 5.008 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)cc1 182146305 HGWAHNQOSDEHKL-QGZVFWFLSA-N 397.434 5.202 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)Cc1ccc(OC)c(OC)c1 189879707 VENYNDMYSXVRLK-KRWDZBQOSA-N 381.516 5.373 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@](C)(c2ccccc2)C1 191432664 AVVJHVVZAAGLDC-DEOSSOPVSA-N 378.516 5.318 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)Nc1ccc(C(C)(C)C#N)cc1 193051308 HJWUFYRKYABUIE-UHFFFAOYSA-N 375.394 5.170 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1F 261376173 KBJHRRMHUJGUPF-UHFFFAOYSA-N 376.387 5.059 30 20 GKED C[C@@H](Sc1nc2cc(Cl)ccc2o1)C(=O)Nc1ccc(C#N)c(Cl)c1 302769199 VWQXTIKHRNNSHV-SECBINFHSA-N 392.267 5.126 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(-c2cc(Cl)cc(Cl)c2)s1 303231739 VVBMEYSZRMPCSW-UHFFFAOYSA-N 379.312 5.488 30 20 GKED OC(C[C@@H]1CCCC(O)=N1)=Nc1cc(C(F)(F)F)ccc1N1CCCCC1 329432031 HWYJXTPOJKAVSB-AWEZNQCLSA-N 383.414 5.183 30 20 GKED CO[C@H](c1noc(-c2sc3ccc(C#N)cc3c2C)n1)c1ccccc1Cl 426452092 WRVRZVDHWRKXJP-KRWDZBQOSA-N 395.871 5.521 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)c3cccc(SCC#N)c3)c2)C1 429854508 PVVFCHVROPBQFZ-UTKZUKDTSA-N 394.540 5.650 30 20 GKED CCN(C(=O)c1cccc(SCC#N)c1)[C@H](Cc1ccc(F)cc1)C(C)C 430590980 DULMPDUJUGFCKU-OAQYLSRUSA-N 384.520 5.171 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H]1CCCOc2cc(Cl)ccc21)c1ccccc1 431454930 CMPXTYBLDASIGS-UXHICEINSA-N 397.906 5.288 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2c(-c3ccc(Cl)c(Cl)c3)noc2C)n1 435775973 HARPZSSPDKOFJB-NSHDSACASA-N 392.267 5.212 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1 438371001 DWVMSBNPGUSFJL-UHFFFAOYSA-N 392.846 5.063 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)CCCSc1ccccc1C#N 439709613 WAHWYMGBVBHNKA-UHFFFAOYSA-N 386.948 5.847 30 20 GKED C[C@H](SCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 443142445 HDUJATUZABBMPR-NSHDSACASA-N 398.837 5.663 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc3nc(C4CC4)oc3c2)c2ccccc21 444279840 XAPCJUQOPQJIHF-UHFFFAOYSA-N 384.439 5.216 30 20 GKED CCN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@H](C)Cc1ccsc1 444280345 JARNVWCLAKGDQV-QGZVFWFLSA-N 379.529 5.100 30 20 GKED C=CC[C@@H]1N(C(=O)Nc2cccc(COCc3ccco3)c2)CCCC1(C)C 444856108 JDOBQCDSYPTKFS-NRFANRHFSA-N 382.504 5.595 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nnc(-c3cccc(Cl)c3)n2Cc2ccco2)C1 450883753 QNBDBTLVGKLDET-SUMWQHHRSA-N 384.892 5.024 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)C2CC2)o1 455758712 VSSPZIUNXLKYIW-CXAGYDPISA-N 383.879 5.319 30 20 GKED CN(C(=O)N[C@H]1CC[C@@H](CC#N)C1)[C@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 459020524 VZIYULCZWYNPEH-QZHFEQFPSA-N 393.453 5.065 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccccc1Cl 461046302 PFFMZCOECCTPHN-UXLLHSPISA-N 379.674 5.131 30 20 GKED COc1ccccc1[C@@H](C)SCC(=O)N(CCC#N)c1cccc(Cl)c1 463203623 GFIORVVUTZJCIY-OAHLLOKOSA-N 388.920 5.090 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nnc(-c2cccs2)o1 463253164 BPDTZDSDKJVPMS-CYBMUJFWSA-N 390.493 5.585 30 20 GKED N#C[C@H](NC(=O)C1CCC(c2ccccc2)CC1)c1ccc(Br)cc1 463312583 XCWUKAHMSNMOCM-NLPFYKDJSA-N 397.316 5.104 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cncc(-c2ccc(Cl)cc2)c1 466321178 UECYWYUGVZWHDQ-UHFFFAOYSA-N 391.858 5.313 30 20 GKED COCC[C@H]1CCCCN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 467329495 BYTIMVKPJLGGKL-GOSISDBHSA-N 393.487 5.021 30 20 GKED C[C@@H](CNc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1 470144007 USMGQEPRULCETF-INIZCTEOSA-N 381.907 5.139 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc2nc(-c3cccc(Cl)c3)sc2c1 470593995 CKOJSHAZICOWHU-LBPRGKRZSA-N 384.892 5.240 30 20 GKED N#CC[C@H](CC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1ccccc1 474584199 JAKNVPUWAOKEOD-RDGATRHJSA-N 380.491 5.248 30 20 GKED COc1ccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(OCC(C)C)c1 475506048 CJXAHDOEOXONKB-MRXNPFEDSA-N 398.528 5.377 30 20 GKED C[C@H](Oc1ccccc1NC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1 476062748 OTAQFIJJZYZTML-UGKGYDQZSA-N 384.479 5.853 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(Br)cc1 479727722 CXTZLWISAUWAMZ-LBPRGKRZSA-N 390.306 5.487 30 20 GKED CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1 480481822 OOCAJXCXNSAVEZ-JXFKEZNVSA-N 379.504 5.648 30 20 GKED Cc1cc2n[nH]cc2cc1NC(=O)c1ccccc1Sc1ccccc1C#N 481321644 KVFCWQGLVHNGFZ-UHFFFAOYSA-N 384.464 5.147 30 20 GKED C=CCn1c(SCc2cc(-c3ccccc3)no2)nnc1-c1cccs1 481390980 NBSNBVDVEREYPM-UHFFFAOYSA-N 380.498 5.140 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)s1 481860153 GPNBGBDTSPDPHA-KRWDZBQOSA-N 381.888 5.075 30 20 GKED CCN(C(=O)c1cc(Cl)ccc1OC(F)F)[C@@H](C)c1ccc(C#N)cc1 482560602 QJDZKXGVXQXSIE-LBPRGKRZSA-N 378.806 5.036 30 20 GKED Cn1ccnc1-c1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 483010493 GYQYRIMNLFCSLA-UHFFFAOYSA-N 394.434 5.003 30 20 GKED C[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487546722 WPLDWTXORFEDQY-OXQOHEQNSA-N 399.332 5.494 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(Cl)cc1Br)c1ccccc1 487600854 HAPIWDLXBUTSKW-QGZVFWFLSA-N 391.696 5.267 30 20 GKED Cc1nc(C(=O)Nc2cccc(OCCCC#N)c2)c(-c2ccccc2)s1 487771831 RAEQGBFFKJRJHN-UHFFFAOYSA-N 377.469 5.053 30 20 GKED COc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 495445528 WWBJRPJYTWHNTQ-NSHDSACASA-N 378.259 5.099 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)C1 501094410 MSTHXBVQFYXWOU-GNLZIIPMSA-N 396.575 5.440 30 20 GKED C=CCn1c(-c2cccc3ccccc23)nnc1N1CCC(OC(C)(C)C)CC1 508831360 BVABWXNFXGDBPT-UHFFFAOYSA-N 390.531 5.068 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(F)cc1)CCC2 509229828 IOOFPLFTAONLGM-VLGSPTGOSA-N 399.469 5.236 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)c1cccc(C#N)c1C 509417107 PIIFKGNZZNKZKU-UHFFFAOYSA-N 398.441 5.120 30 20 GKED CCCCOCCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 510004639 JZCUOYAGYFFMCR-HXUWFJFHSA-N 399.922 5.324 30 20 GKED C=CCN(Cc1cccs1)[C@@H](C)C(=O)c1cc(C)n(Cc2ccco2)c1C 510830230 YHWKNVXORVZKSK-SFHVURJKSA-N 382.529 5.067 30 20 GKED N#Cc1cccc(CSCc2coc(-c3ccc(Br)cc3)n2)c1 517939752 PVGTWCSGGYKMOP-UHFFFAOYSA-N 385.286 5.409 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)Nc3ccc(C#N)cc3)s2)cc1 518611653 AAZODFKPJVGSGA-HNNXBMFYSA-N 376.485 5.181 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccs3)cc2)cc1 519052743 DMERVNIOENQFEX-HXUWFJFHSA-N 389.480 5.781 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3nc(C4CC4)cs3)cc2)cc1 520322073 ZLSFQBYQFONSKB-UHFFFAOYSA-N 375.453 5.131 30 20 GKED Cc1cc2occ(CC(=O)Nc3ccccc3S[C@H](C)CC#N)c2cc1C 521329317 AXEJHXYMTWDFHT-MRXNPFEDSA-N 378.497 5.625 30 20 GKED CC(C)N(Cc1cccs1)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 522305342 GMHZJLWRGWOCBH-UHFFFAOYSA-N 390.508 5.250 30 20 GKED C=CCn1c(S[C@H](CCOC)c2ccccc2)nnc1-c1ccccc1OC 534054981 HFXAIPKKZSOJPW-HXUWFJFHSA-N 395.528 5.010 30 20 GKED N#C[C@H](NC(=O)c1cc(Cl)ccc1Sc1ccc(Cl)cc1)C1CC1 538253295 VYWFXPGBFNZSRN-INIZCTEOSA-N 377.296 5.177 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cc(C(F)(F)F)ccc3N3CCCC3)cc2)CC1 540691738 LCQKSKZHTQXTIE-UHFFFAOYSA-N 399.416 5.113 30 20 GKED Cc1sc(CN[C@H](C)c2ccc(C#N)c(F)c2)nc1-c1ccc(Cl)cc1 540706826 UDQHPGHHGHUTBW-GFCCVEGCSA-N 385.895 5.634 30 20 GKED C[C@@H](c1cccnc1)N(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 541158414 APHUJJZNKIXVCT-MSOLQXFVSA-N 384.483 5.084 30 20 GKED N#CCc1ccc(C(=O)Nc2ccc(Br)c(Cl)c2Cl)cc1 543496543 OSRXCOAATCPBIE-UHFFFAOYSA-N 384.060 5.074 30 20 GKED C[C@@H]1C(=O)CC[C@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1(C)C 548366732 FDUZKIXVFUQNRV-RHSMWYFYSA-N 394.446 5.070 30 20 GKED C[C@@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)cc1F 552318132 QZFYTDGDDMIIQR-BLVKFPJESA-N 378.369 5.398 30 20 GKED CCCN(C(=O)c1ccc(COc2ccccc2C#N)o1)c1ccc(Cl)cc1 553908940 BVKTWVNQCSVVCW-UHFFFAOYSA-N 394.858 5.440 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)C1CCC(OC(F)F)CC1 572072982 AASCGASZLFZMCJ-UHFFFAOYSA-N 376.428 5.023 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(OC)c(O)c1)c1ccc(C(F)(F)F)cc1 575873796 CNNKAYIBJYSHBH-KDOFPFPSSA-N 379.422 5.778 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N(C)CCOCc1ccc(C#N)cc1 580738663 VYVXOTODYWCTEX-MRXNPFEDSA-N 395.890 5.076 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Cl)ccc1OC(F)F 582656536 CFRCSIXTAAKCDW-KDOFPFPSSA-N 378.850 6.027 30 20 GKED N#CCCC1CCN(C(=O)c2ccc(-c3ccccc3C(F)(F)F)o2)CC1 584410200 BAGZZLBXOVZMLQ-UHFFFAOYSA-N 376.378 5.121 30 20 GKED COc1cccc([C@H]2[C@@H](c3ccccc3)CCN2C(=O)CCCCCC#N)c1 588676322 CEQSDWCNTMWOHB-VWNXMTODSA-N 376.500 5.226 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CCCC2)[C@H]1c1ccco1)c1ccccc1 596605556 FQYOWKYTDSDNNW-PZJWPPBQSA-N 377.488 5.341 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)CC1CCCC1 609079107 IXQRMMXPFSHMSD-UHFFFAOYSA-N 377.488 5.100 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1cccc(F)c1 609297947 PNABUDXTEISLBV-UHFFFAOYSA-N 378.378 5.295 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)NC3CCC(c4ccccc4)CC3)cc2)nc1 609500120 OWFXDUYNBUXARV-UHFFFAOYSA-N 397.478 5.202 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3scnc3C3CCCC3)cn2)cc1 612665525 VDYINUAEPHISHX-UHFFFAOYSA-N 390.468 5.112 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(SC(C)C)cc3)n2)cc1 613319409 ZHWHSAWXFGHDBP-LJQANCHMSA-N 392.549 6.109 30 20 GKED Fc1ccc(-c2cnc(CN3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)o2)cc1 618453822 UYWWWNIVIKOVOT-TXEJJXNPSA-N 396.306 5.043 30 20 GKED CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC(C)(C)C#N 619543538 ICVYVWIFEKSORI-UHFFFAOYSA-N 380.275 5.051 30 20 GKED C=C(C)COc1cc(CN[C@H](c2ccccc2)c2ccc(F)cc2)ccc1OC 622266545 AGVXROKVJYTCHO-RUZDIDTESA-N 391.486 5.668 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 642564275 URNLDCCJJSHSSQ-UHFFFAOYSA-N 381.501 5.114 30 20 GKED CCn1ccnc1[C@@H](C)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647323482 PYVCOCKLGGSZPA-SNVBAGLBSA-N 383.311 5.366 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)N1CC[C@@H](CC(F)(F)F)C1 683406200 XXISDUANMXHILI-VIFPVBQESA-N 390.274 5.147 30 20 GKED CCCCN(Cc1ccccc1F)C(=S)Nc1ccc(C#N)c(Cl)c1 726485599 RPYFUBFNVHPBIO-UHFFFAOYSA-N 375.900 5.350 30 20 GKED CCC[C@@H](C)N1Cc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2C1 726494825 NJOFDCVNOYZCBD-CQSZACIVSA-N 398.963 5.525 30 20 GKED CC(C)[C@@H](SCc1ccccc1)C(=O)[C@H](C#N)c1nc2ccccc2s1 727629180 PBCPXNIJFMRTMN-OXJNMPFZSA-N 380.538 5.431 30 20 GKED N#CCn1c(C(=O)Nc2cccc(Cl)c2SC(F)F)cc2ccccc21 729359609 UNODLESRCMEUHC-UHFFFAOYSA-N 391.830 5.385 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1ccccc1S[C@H](C)CC#N 731332733 QUIJGYOPLWRBSW-DPYIKZRWSA-N 394.540 5.910 30 20 GKED C#CCCOc1ccc(CN[C@H](c2ccc(Cl)cc2)c2cccs2)cc1 733324758 XHZCLPQSTPMLQJ-JOCHJYFZSA-N 381.928 5.683 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2ccc(Cl)cc2)c1 733807026 QAZHUNXHZCXRDK-CTNGQTDRSA-N 397.906 5.068 30 20 GKED Cc1cc(C)cc(NC(=O)[C@H](C)SCc2cc(Cl)ccc2OCC#N)c1 735320001 IAERSHFOMJUGMZ-HNNXBMFYSA-N 388.920 5.120 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc(C(F)(F)F)cn2)cc1 741453586 TUEWCDIUFIJOHG-UHFFFAOYSA-N 385.389 5.612 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1)C(C)C 743149482 VXKXXBXBUHYMDP-UHFFFAOYSA-N 379.382 5.321 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1 744035577 OGWDZFZMSWOEMG-MRXNPFEDSA-N 397.931 5.593 30 20 GKED CCC(=NNc1ccc(Br)cc1C(F)(F)F)C1CCOCC1 745205404 XNXFSTQDSRGBON-UHFFFAOYSA-N 379.220 5.072 30 20 GKED C=CC[C@H](NC(=O)N(Cc1cccc2ccccc12)C1CCCC1)c1ccncc1 745828835 WEISCLHJYCQIAJ-VWLOTQADSA-N 399.538 6.006 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)Nc1cccc(COC(C)(C)C)c1C 747345699 KHQPTNXWEFTQSL-UHFFFAOYSA-N 391.471 5.126 30 20 GKED Cc1sc2nc([C@@H](C)ON=C(c3ccccc3)C(F)(F)F)nc(O)c2c1C 751965533 NWKBFFJSBXHWHN-SNVBAGLBSA-N 395.406 5.058 30 20 GKED C=CCc1cc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2O)cc(OC)c1OC 756686410 IUHFNOALGITFTJ-LBPRGKRZSA-N 396.314 5.296 30 20 GKED FC(F)(F)C1CCC(C=Nn2c(S)nnc2-c2cccc(Cl)c2)CC1 767368179 PMORMOQWWCWOHJ-UHFFFAOYSA-N 388.846 5.090 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](Oc2cccc(Cl)c2)C(C)C)n1 770141587 NNDSZGAZTDSRHB-YJBOKZPZSA-N 376.909 5.200 30 20 GKED Cc1cnc([C@H](C)OC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)o1 770983798 RMZLBMHKVZDMTF-ZDUSSCGKSA-N 382.803 5.218 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 774025089 ZEQZOKAUVYLJMU-SBUREZEXSA-N 384.483 5.182 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCc2c(Cl)cccc21)c1nc2cc(Cl)ccc2s1 776080787 JGDBJWYSYNUJOK-KBPBESRZSA-N 387.291 5.509 30 20 GKED O=C(/C=C/c1ccccc1OCc1cccnc1)c1ccc([N+](=O)[O-])cc1Cl 782190119 XHPNAQNFDALTBO-JXMROGBWSA-N 394.814 5.118 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ncc(C(F)(F)F)s2)cc1OC 788349442 KTNLKMNTBLSQJO-VURMDHGXSA-N 385.407 5.246 30 20 GKED O=C(/C=C/c1ncc(C(F)(F)F)s1)c1ccc(SCC(F)(F)F)cc1 788356833 WHIIFBAHPBSIIC-AATRIKPKSA-N 397.365 5.712 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)/C=C/c2ccc3ccc(Cl)cc3n2)s1 797571470 RYCQLPMUOCDIHQ-FDMDGMSGSA-N 395.915 5.532 30 20 GKED O=C(/C=C/c1ccc2ccc(Br)cc2n1)c1cnn(C2CCCC2)c1 799895880 BVHMQBZPYHOZRX-MDZDMXLPSA-N 396.288 5.205 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccc(F)c([C@@H](C)O)c2)cc1 804790709 CPUDJXHGWSRNDA-OAHLLOKOSA-N 390.414 5.104 30 20 GKED CC(=NNc1cccc2cnccc12)c1sc(-c2ccc(F)cc2)nc1C 814835950 FXAVTKLGCMJZOX-UHFFFAOYSA-N 376.460 5.642 30 20 GKED N#CCCC[C@H](NC(=O)CCSc1nc2ccccc2s1)c1ccccc1 817319226 MENGGZRZKVYVAJ-KRWDZBQOSA-N 395.553 5.330 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cccc(C(=O)C(F)(F)F)c1 841694243 GQUZTBPTXJGXKS-CYBMUJFWSA-N 378.419 5.438 30 20 GKED COc1ccc2cc([C@H](C)C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)ccc2c1 842941416 ASWVUEZVDNBVPR-ORAYPTAESA-N 376.481 5.162 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC[C@H]2CC2(Cl)Cl)cc1 856822708 NTUIJENZIKOWOT-WMZOPIPTSA-N 388.298 5.047 30 20 GKED CC(C)CN(Cc1cccc(Cl)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 857205126 OIORFLXSOPBJCH-UHFFFAOYSA-N 392.355 5.720 30 20 GKED C=CCOc1ccc(CNc2ccc([C@@H]3C[C@H]3NC(=O)OC(C)(C)C)cc2)cc1 864042335 GOBLRUUCHNOXMV-FCHUYYIVSA-N 394.515 5.244 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1ccc([N+](=O)[O-])cc1 914556045 RYFMAZCMECVBIK-UHFFFAOYSA-N 383.839 5.003 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1 915747250 YFSMUJKFXQUJGW-VZOQVYJPSA-N 378.884 5.192 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2csc3ccccc23)cc1 916955927 VTNVLZPDGKAUCA-RDTXWAMCSA-N 376.481 5.376 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cc(C(=O)O)cs2)cc1 1776125628 OEOZQELNKZDGLH-LPQFERQCSA-N 386.513 5.938 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC)c(OCCCCC)c1 1776783851 BPWPMIUPRNTKLN-FQEVSTJZSA-N 393.568 5.558 30 20 GKED CCCCCCCCCCCCC(C)(C)C(=O)NCc1ccc(C(=O)O)cc1 1776785277 NQWCYWWKWJSXJP-UHFFFAOYSA-N 389.580 6.338 30 20 GKED CCCCCCOc1cccc(/C=C2\CCc3oc(C(=O)O)c(C)c3C2=O)c1 1776790239 DEASQXNHTWRJOD-GHRIWEEISA-N 382.456 5.458 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1F 1777353251 FTPNBVQEEBMQRD-XFFZJAGNSA-N 390.410 5.025 30 20 GKED N#C[C@@H](C(=O)CSc1ccccc1Cl)c1nc2ccccc2n1C(F)F 41559567 RZKODOWTSUPLCZ-NSHDSACASA-N 391.830 5.053 30 20 GKED N#CCSc1ccccc1NC(=O)CNc1cccc(Oc2ccccc2)c1 46170476 RXOBKZIXHQQAHC-UHFFFAOYSA-N 389.480 5.145 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(-c3cnco3)cc2)cc1 55429555 NTWABVAJKLKSQF-UHFFFAOYSA-N 381.391 5.258 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccccc1C(F)(F)F 58773060 PNONCGUJLJECKU-UHFFFAOYSA-N 397.356 5.325 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(SC(F)F)c(OC)c2)ccc1OC 63874735 MZSHOCKTXCAEPP-VMPITWQZSA-N 394.439 5.313 30 20 GKED CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C(C1CC1)C1CC1 65369408 OFXRUZBGGPKKHI-UHFFFAOYSA-N 395.890 5.656 30 20 GKED CCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)sc1C 66544794 FEAKCFYTSDXZQR-INIZCTEOSA-N 377.494 5.104 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(F)ccc1Br 66802341 SQCPDXJKSOPPKS-LLVKDONJSA-N 393.281 5.235 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955765 OAEIBHWRZIMSGV-WMLDXEAASA-N 385.558 5.684 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cc(C)cc(C)c2)cs1 107066923 KAXDXTPAZJCTQP-RMKNXTFCSA-N 394.471 5.480 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1sccc1-c1ccccc1 108239174 HQKHRQKIWLMUJP-HNNXBMFYSA-N 378.522 5.919 30 20 GKED CCc1ccc(C(=O)/C(=C(\S)N[C@H](C)CC)[n+]2ccc(C(C)(C)C)cc2)cc1 154523715 GPZRBYHJJNEFGZ-QGZVFWFLSA-O 397.608 5.161 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cnc(-c3ccncc3)s2)cc1 172798496 CIJWJOBLRSOHGF-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@@H](C)C#N)[C@H](C)c1cccc(O)c1 173116243 LXFUGQDAQLMLMG-JKSUJKDBSA-N 383.517 5.259 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@@H](CCc3ccccc3)c3ccccc3)o2)cc1 180377332 GFTVWCZXSSNTCL-QHCPKHFHSA-N 394.478 5.072 30 20 GKED C=C[C@@H](CC(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1)c1ccccc1 187003947 QFKIDZMOHDDTKW-INIZCTEOSA-N 391.496 5.067 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCCC(=O)Nc1ccccc1C#N 188066655 MAHUCYYJJXQSOV-UHFFFAOYSA-N 389.499 5.158 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1csc(-n2c(C)ccc2C)n1 189893475 MXZOQQCSRSQELD-UHFFFAOYSA-N 393.556 5.584 30 20 GKED CCOc1ccc(-n2c(SCCCCC#N)nnc2-c2ccccc2)cc1 195561363 FTBLXVGQQYLWDP-UHFFFAOYSA-N 378.501 5.119 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 301749631 OTGJHDJNPYWIMJ-LBPRGKRZSA-N 396.921 5.005 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCC2)c1nc(-c2ccc(Cl)cc2)cs1 301759871 HZTZSZFIQIORSJ-CQSZACIVSA-N 384.913 5.504 30 20 GKED N#CCOc1ccc([C@@H]2Nc3ccccc3C(=O)N2c2cccc(Cl)c2)cc1 302639346 XPLPPFFHSKQVDL-OAQYLSRUSA-N 389.842 5.013 30 20 GKED C[C@H](NC/C(O)=N/C12CC3CC(CC(C3)C1)C2)c1nc(C(C)(C)C)cs1 329678328 QGWIRWDYRFVPBV-JHMRYYBSSA-N 375.582 5.017 30 20 GKED CC(C)c1nc([C@@H]2CCCN2C(O)=Nc2ccc3c(c2)oc2ccccc23)no1 330264927 YMRZZIFNKIETCU-KRWDZBQOSA-N 390.443 5.475 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O 331983514 VVUUKGGNOPRDIX-YCZSINBZSA-N 384.564 5.332 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc2nc(C3CC3)oc2c1 431154672 ZYIGJRYVZJYQDH-UYAOXDASSA-N 386.455 5.009 30 20 GKED CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)C(=O)NCC1(CC#N)CC1 431191384 KCWCEMAOKZJSFV-UHFFFAOYSA-N 385.508 5.168 30 20 GKED COc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H](CCC#N)c1ccccc1 438859594 PTBHCTAYNPEDKE-RTWAWAEBSA-N 379.504 5.127 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N(CCC#N)CC2CC2)cc1 438863007 XEAXMMJJPNPPSG-QGZVFWFLSA-N 379.529 5.697 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnccc1Oc1ccccc1 443531727 MDOQOJUBUOAGIV-INIZCTEOSA-N 389.480 5.378 30 20 GKED CCC1(c2ccccc2)CN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)C1 459393235 FGOHWXCMSMHISE-KRWDZBQOSA-N 379.529 5.134 30 20 GKED N#C[C@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccccc1F 464398457 LKYFAZXYBJYXKW-SFHVURJKSA-N 380.419 5.111 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1ccc(C#N)c(F)c1 464645436 DKXRANHVBMIYNQ-UHFFFAOYSA-N 390.201 5.220 30 20 GKED Cc1ccc2c(CCC(=O)Nc3sc(-c4ccccc4)cc3C#N)c[nH]c2c1 466991431 HJBYAWBQIYZPEL-UHFFFAOYSA-N 385.492 5.648 30 20 GKED Cc1ccc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 468647748 LIKDXXZWDGNTKE-KRWDZBQOSA-N 384.570 5.570 30 20 GKED Cc1nc2ccc(C(=O)Nc3cccc(COc4ccc(CC#N)cc4)c3)cc2o1 470849058 PMHBNIMEMGJCEC-UHFFFAOYSA-N 397.434 5.034 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](c2cccc(Cl)c2)c2ccccn2)c1 473791138 HYYJICUAWZEVIG-OAQYLSRUSA-N 393.874 5.211 30 20 GKED CCOc1cccc2cc([C@@H](C)NC(=O)C[C@H](CC#N)c3ccccc3)oc12 474293800 RXSXJRXZOKHNFC-AEFFLSMTSA-N 376.456 5.096 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485811457 BZGCEBAGRVCVFZ-CQSZACIVSA-N 394.833 5.424 30 20 GKED CC(C)CN(C(=O)c1csc(-c2ccc(F)cc2)n1)c1ccc(C#N)cc1 499320603 SRHCDQTTYLAQOS-UHFFFAOYSA-N 379.460 5.124 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cccc([C@H]2CCCOC2)c1 499617092 MQAPYHSLMDLQRP-IBGZPJMESA-N 388.492 5.433 30 20 GKED C=CCN(C(=O)c1csc(-c2ccc(OC(C)C)cc2)n1)c1ccccc1 501909209 BNTNIIIPGSSHDA-UHFFFAOYSA-N 378.497 5.430 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(c2nc3cccc(C)c3o2)CC1 505050355 CAKWGMPNGFKVIA-UHFFFAOYSA-N 389.499 5.666 30 20 GKED C[C@H](NC(=O)N[C@H](C)c1ccc(C#N)cc1)c1cc(F)c(Cl)cc1Cl 505320242 WBAWSVKEIPSBKR-MNOVXSKESA-N 380.250 5.126 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N[C@@H](C#N)c2ccc(Cl)cc2)cc1 505789627 HTAVZUZOESKQBG-SFHVURJKSA-N 395.915 5.004 30 20 GKED N#Cc1cc(F)ccc1CN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 505879018 CARJHXZNHQEAEC-OAHLLOKOSA-N 376.275 5.109 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NS(=O)(=O)c1csc2ccccc12 506645122 HAOFGLJICWNLSU-ZDUSSCGKSA-N 388.539 5.096 30 20 GKED C=C(C)CCc1noc(/C=C\c2csc(N(C(C)=O)c3ccccc3F)n2)n1 508644063 STIHCGCCIAIMMV-LUAWRHEFSA-N 398.463 5.029 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCc2c(Cl)cccc21 520154008 HQZJLWGNNLBPCI-OAQYLSRUSA-N 381.907 5.067 30 20 GKED C[C@@H](Sc1ccc(C#N)cc1F)C(=O)N[C@H](C)c1cccc2ccccc12 525116911 WCWMTTQZHTVEQS-HUUCEWRRSA-N 378.472 5.209 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc(F)c(F)c1 525158044 JQZSQTHVVJJOCP-CQSZACIVSA-N 378.378 5.371 30 20 GKED Fc1ccc([C@@H](CC(F)(F)F)NCc2ccccc2OCC(F)(F)F)cc1 538176676 VDQVCBHBBXPYFE-OAHLLOKOSA-N 395.318 5.550 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc(C3CCCCC3)nc2C)cc1 540473536 YNKXMEVKSYGBMA-UHFFFAOYSA-N 397.544 5.458 30 20 GKED Cc1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)nn1[C@@H](C)C1CC1 540720784 BPNCLBBMXIJFNZ-INIZCTEOSA-N 386.455 5.079 30 20 GKED N#CCC1CCN(C(=O)c2ccccc2Oc2ccc(Cl)cc2Cl)CC1 542909940 YUCZNEMAGIGQHU-UHFFFAOYSA-N 389.282 5.552 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nc(Cc2ccccc2)no1 542934737 SWFBGSXGEVAKLW-LBPRGKRZSA-N 389.402 5.404 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NCc3ccccc3C(C)(C)C#N)s2)cc1 544490350 PUJAVIGSFVPJKT-QGZVFWFLSA-N 389.568 6.079 30 20 GKED N#Cc1ccc(Oc2ccc(Oc3ncnc4sc([N+](=O)[O-])cc34)cc2)cc1 553486530 UFKYJLOMAKNHTD-UHFFFAOYSA-N 390.380 5.056 30 20 GKED CC(C)(CCC#N)CNC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 554099342 SHTJBSAWGKZTEJ-UHFFFAOYSA-N 381.863 5.064 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Cc2nc(C(C)C)no2)cc1)c1ccccc1 558793196 FLDVSOYOARPAOL-SFHVURJKSA-N 375.472 5.082 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCCc2nc(-c3ccccc3)sc21 561130824 IDXQFMJRRLJLIV-RTWAWAEBSA-N 385.536 5.726 30 20 GKED C=CCC[C@H](N[C@@H](C)c1ccc(OC)c(O)c1)c1ccc(C(F)(F)F)cc1 575873797 CNNKAYIBJYSHBH-KSSFIOAISA-N 379.422 5.778 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)c1 589382490 RMNHRFAHVHFQCT-UHFFFAOYSA-N 386.451 5.146 30 20 GKED Cc1nc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(Cl)cc1C#N 589685014 OSJRFICFONTTQQ-UWVGGRQHSA-N 385.739 5.237 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](C)c2ccc(OC(C)C)c(OC)c2)c1 589740187 MHXJPAFSWZEKSS-QGZVFWFLSA-N 398.503 5.320 30 20 GKED CN(Cc1cccc(C(F)(F)F)c1)C(=O)Nc1ccc(F)cc1C(F)(F)F 590336903 KTYSLWZUZBTIBU-UHFFFAOYSA-N 394.290 5.527 30 20 GKED CC(C)(NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1cccc(C#N)c1 598859938 NTCXBUWMMQXQFQ-XBLGPDGASA-N 390.449 5.058 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1csc(C(F)(F)F)c1 599737988 RDMLSADDKCDQSY-NSHDSACASA-N 399.463 5.340 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N[C@@H](c3cccs3)C3CC3)cn2)cc1 603689773 FDOHBLFCNFBLAG-HXUWFJFHSA-N 390.468 5.080 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(Cc1ccccc1)CC(C)(C)C 609398294 SNFHACXUUHKNHW-SFHVURJKSA-N 395.572 6.019 30 20 GKED C[C@H](NC(=O)NCc1ccccc1Sc1ccccc1)c1cccc(C#N)c1 610350991 CTQNZACTOWBAFH-KRWDZBQOSA-N 387.508 5.270 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)N(C)c1ccc(C#N)cc1F 610550823 YPUYYTQQVWSPIC-GFCCVEGCSA-N 399.878 5.043 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NNc1cnc2ccccc2n1 727255813 HPSSOJZDOYZGPU-UHFFFAOYSA-N 390.878 5.038 30 20 GKED N#Cc1cccc(COc2ccc(N=Cc3cc4ccccc4nc3O)cc2F)c1 728174217 MFPBSQTYSYXDRS-UHFFFAOYSA-N 397.409 5.281 30 20 GKED CC[C@H](C)n1c(-c2ccccc2)nn(CN(CCC#N)CC(C)(C)C)c1=S 729468202 PICJVILOSUCFDF-KRWDZBQOSA-N 385.581 5.271 30 20 GKED O=C(/C=C\c1ncc(-c2cccc(Br)c2)[nH]1)c1ccc(F)cc1F 731937302 HOGVNOPVLKHEMM-SREVYHEPSA-N 389.199 5.014 30 20 GKED C=CCn1c(C2CC2)nn(CN(Cc2ccc(C(C)C)cc2)C2CC2)c1=S 732508388 FGNRXNCTBALYNH-UHFFFAOYSA-N 382.577 5.223 30 20 GKED CC(=NNc1ccc(Br)nc1)c1csc(-c2csc(C)n2)c1 732712851 JKQJTTHCBKQJJM-UHFFFAOYSA-N 393.335 5.174 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)C(=O)Nc1ccccc1Cl)C12CC3CC(CC(C3)C1)C2 733678702 GNPUFBZUBPJTIL-QJHFDQTNSA-N 396.918 5.150 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1C(=O)/C=C/c1nccs1 735232524 OKZSBFQGGXJRDE-VOTSOKGWSA-N 391.315 5.234 30 20 GKED CC(C)(C)c1ncc(/C=C2/CCOc3ccc(Br)cc3C2=O)s1 736434249 RIDAGHXVCRBXAU-FLIBITNWSA-N 392.318 5.252 30 20 GKED O=C(/C=C\c1cnc2ccc(Cl)cn12)c1ccc(N2CCCCC2)c(F)c1 737443656 KCLDKOCKOBVXJF-VURMDHGXSA-N 383.854 5.013 30 20 GKED CC(C)(C)n1cc(/C=C\C(=O)c2cncc(F)c2)c(-c2ccccc2Cl)n1 737445605 BKDMVMYIQVDFLO-HJWRWDBZSA-N 383.854 5.389 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740064713 QZJRXIXTBUXZSG-UHFFFAOYSA-N 395.915 5.282 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC(F)F)cc2)c(SC)cc1OC 741165647 PNTPEYWZXMSWBP-TWGQIWQCSA-N 396.480 5.637 30 20 GKED C/C(=C/C(=O)Nc1ccccc1SCCC#N)c1ccccc1C(F)(F)F 741924599 HCVIITBJONEULY-YPKPFQOOSA-N 390.430 5.753 30 20 GKED COc1ccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)cc1C#N 742370191 VNSIMDKDDCLIEJ-SANMLTNESA-N 378.475 5.599 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)cc1 742888823 ZQXVTGFLLDCGLY-MRXNPFEDSA-N 396.487 5.089 30 20 GKED Cc1ccc([C@H](C)C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)o1 744037626 ASNZTVHMQVBTPW-JQWIXIFHSA-N 378.375 5.197 30 20 GKED C=CC[C@@H](NC(=O)NCC[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 746420411 DTPDCHSYENHNAD-HNAYVOBHSA-N 391.437 5.211 30 20 GKED Cc1cc(/C=C/C(=O)N(CCC#N)Cc2ccco2)c(C)n1C1CCCCC1 749378659 FNHQKZFZBLQEBY-VAWYXSNFSA-N 379.504 5.159 30 20 GKED COc1ccc(C[C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 759214085 XZSIMMIGXGKDQR-OXQOHEQNSA-N 390.508 5.182 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2cc(Cl)ccc2OCC(F)(F)F)cc1 770513757 FZIXUOHBQUVSPB-LBPRGKRZSA-N 384.785 5.184 30 20 GKED FC(F)(F)[C@@H]1CCC[C@H](NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)C1 782526248 MCSNMEVANMVMFY-DBIOUOCHSA-N 385.314 5.607 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccccc2F)CC1)c1nc2cc(Cl)ccc2s1 785880503 MMCDNIQHDZFSTB-CQSZACIVSA-N 384.863 5.288 30 20 GKED N#CC1(NC(=O)c2ccc(CSc3nc4ccccc4s3)cc2)CCCC1 786752820 IDBNQDMOFJBLKW-UHFFFAOYSA-N 393.537 5.155 30 20 GKED CC[C@H](C)c1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 787351921 IOXFORPPHGELAO-KRWDZBQOSA-N 389.499 5.035 30 20 GKED N#C[C@@H](C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1nccc2ccccc12 792097604 XXVYJKWMLAISHC-QJRAZLAKSA-N 383.838 5.326 30 20 GKED N#C[C@@H](C(=O)Cc1coc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 796800961 XITSYQRSCSRHSC-KRWDZBQOSA-N 392.867 5.629 30 20 GKED C#CC[C@H](NC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 800593518 LJOCHXUCONNVOH-INIZCTEOSA-N 394.368 5.043 30 20 GKED C[C@H](OC(=O)c1ncsc1C(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 801687072 NGGWGRGAWZOTNW-LURJTMIESA-N 387.276 5.238 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\C(=O)c3ccccc3[C@H]2C)cs1 809159630 STZTUEURYHKSNJ-RBFBNPFJSA-N 392.455 5.350 30 20 GKED CCCCCCC[C@H](C)CNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 812009880 DNKZLWOQMCSUHY-PKOBYXMFSA-N 390.572 5.570 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cn(C)nc2C(F)F)CC3)cc1 812241844 NOIWLOXXNMAWAD-UKTHLTGXSA-N 385.439 5.002 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCOCC2)cc1Cl 815636160 QKKHSJYJUONAIW-MBSDFSHPSA-N 397.950 5.262 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 916948460 GUZAAIKYDJDIKD-AAJLLMFJSA-N 394.437 5.216 30 20 GKED O=C1/C(=C\c2cnc(-c3ccccc3)nc2)COc2c1ccc(Cl)c2Cl 920066871 YUAOOOFBNYQPII-ZSOIEALJSA-N 383.234 5.109 30 20 GKED CC(F)(F)c1ccccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776446844 MHLYXCOKOUNIGE-KHPPLWFESA-N 382.362 5.653 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(SC3CCCC3)cc2)cc1)C(=O)O 1776469844 URDUHZVTYDRCDP-AHQMPEJBSA-N 396.508 5.469 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(SC(F)(F)F)cc2)c1)C(=O)O 1776471371 NWDWEHOYFOGVHX-MQGYJPLLSA-N 396.386 5.047 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/COc4c(F)ccc(F)c4C3=O)s2)c1 1777684276 CFVRCLLHLZLXTR-LCYFTJDESA-N 398.386 5.050 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CCc1ccc(-c2ccccc2F)o1 62903474 PCFAZSGNUUKXNB-UHFFFAOYSA-N 388.442 5.105 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 111766099 FXYVAHOBCWIPBZ-NVXWUHKLSA-N 399.947 5.613 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccccc1CCC(F)(F)F 126164837 IQGCSGMDLZYRHZ-UHFFFAOYSA-N 378.394 5.068 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(Oc2ccccc2)o1 176532393 XAIIAFOGFQFUJE-LJQANCHMSA-N 396.402 5.186 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@H]1/C=C/c1cccs1 182387614 SIYSYDPONYXSCP-QJPGBWLHSA-N 395.528 5.529 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](C[C@H](C)O)c1ccccc1 191478775 XTSVJPKDZCXQLV-RXVVDRJESA-N 380.532 5.215 30 20 GKED COc1cccc([C@@H](C)C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 193614762 RNMKYLRWUPFTKV-ACJLOTCBSA-N 396.899 5.452 30 20 GKED C[C@@H](C#N)OC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(Cl)cc1)CC2 210927542 AXUDSZCBQDNAIR-QXPQOBGOSA-N 388.854 5.444 30 20 GKED CCn1c2ccccc2c2cc(C=Nn3c(-c4ccco4)n[nH]c3=S)ccc21 254710496 KZBUOEHKHBZYFV-UHFFFAOYSA-N 387.468 5.211 30 20 GKED CC(=O)c1ccc(C#N)c(N[C@@H]2CCCc3sc(-c4ccc(F)cc4)nc32)c1 302200914 RUKLNOLLRXAQQD-GOSISDBHSA-N 391.471 5.513 30 20 GKED CCN(CC)[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1 302817681 RZAVOFUNFSGNOT-RUZDIDTESA-N 397.522 5.038 30 20 GKED CC(C)Oc1ccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c(F)c1 303154138 FYKFPRFVMWSEQM-UHFFFAOYSA-N 390.414 5.529 30 20 GKED C[C@@H]1C[C@@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329266334 CSFMNGVQBNAXFQ-HXMUEYFJSA-N 381.520 5.410 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN([C@@H]2CCCc3ccccc32)C1)C1CCCC1 329314669 CMEHBRJYGZSHTC-DENIHFKCSA-N 392.547 5.445 30 20 GKED Cc1cc(SC2CCCCC2)ccc1N/C(O)=N/[C@@H]1CCc2c[nH]nc2C1 329845613 QISBUPOLNBGADH-MRXNPFEDSA-N 384.549 5.026 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1ccccc1OCc1cccs1 409753861 MIERVRMVZOKVPM-UHFFFAOYSA-N 388.492 5.027 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 411004158 BTWHMOCHRPPWLO-UHFFFAOYSA-N 397.378 5.097 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@H](C)C3)s1 411007472 GLYTUEDPRVRFOD-SDDRHHMPSA-N 389.546 5.112 30 20 GKED N#Cc1ccc(NC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)c(Cl)c1 426165003 FZEGUTWLGXPQEP-UHFFFAOYSA-N 380.662 5.109 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cccc(OCc3cccs3)c2)s1 430603221 JFELSISVPHBLEO-KRWDZBQOSA-N 396.537 5.571 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cn(C(C)(C)C)nc1-c1ccc(F)cc1F 432837042 YBFIKLJGOBFDOH-UHFFFAOYSA-N 394.425 5.016 30 20 GKED CCOC(=O)c1oc2ccccc2c1CN[C@H](CCCC#N)c1ccccc1 433008888 FJDKFZWRPQBXHJ-HXUWFJFHSA-N 376.456 5.134 30 20 GKED N#CCCC[C@@H](NCc1coc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 433026461 FKLAXSPSEPOOJU-HXUWFJFHSA-N 399.416 5.885 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)[C@@H](C#N)CCc1ccccc1 433377177 VMUIDDMBYHJXLR-OAQYLSRUSA-N 383.495 5.318 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(C(=O)NCCC)c(Cl)c1)c1ccccc1 435663862 PIDXSXQAGLHXGE-FQEVSTJZSA-N 399.922 5.309 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 438040890 VMFMAFUGWUJKBA-AZUAARDMSA-N 395.572 5.874 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1cccc(F)c1)C1CCCC1)c1ccccc1 440255031 MEASPXPWLLHZBC-JOCHJYFZSA-N 379.479 5.325 30 20 GKED Cc1cc(C(=O)CS[C@@H](C)c2cccc(C#N)c2)c(C)n1CC(F)(F)F 443146141 ODJZIVWRQNURPV-AWEZNQCLSA-N 380.435 5.216 30 20 GKED CC(C)(c1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc1)C(F)(F)F 447632966 RRCSFSMRAOUPCY-GOSISDBHSA-N 382.385 5.565 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1sccc1Br 451327509 GJDPTHGLYIPTQX-UHFFFAOYSA-N 378.335 5.544 30 20 GKED Cc1cccc([C@@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)C(F)(F)F)c1 455175340 FPERHFIUMHDMHQ-RBUKOAKNSA-N 389.421 5.333 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)Nc1ccccc1CCC(F)(F)F 465170216 WJQVOSBETKARRH-UHFFFAOYSA-N 377.366 5.096 30 20 GKED C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@H]1CCOc2ccc(OC)cc21 466424467 FMVXIBWTBIBNQY-GCJKJVERSA-N 379.500 5.150 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCN(Cc2ccccc2)C[C@H]1C 475565282 DEFPHDWDCLAMHI-HXUWFJFHSA-N 391.559 5.277 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)[C@H](C#N)c2nc3ccccc3s2)s1 477838624 SBZDYITXDQFTJX-HNNXBMFYSA-N 389.505 5.527 30 20 GKED C=C(C)[C@@H](NCc1ccc(OCc2ccncc2)cc1)c1ccc(F)c(F)c1 479411959 BOVVKTJAMJWPCT-HSZRJFAPSA-N 380.438 5.346 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Cc1ccc(Cl)cc1Cl 500310834 FUDMKQCGMPTQOB-UHFFFAOYSA-N 375.299 5.092 30 20 GKED CCOc1ccccc1NC(=O)[C@@H](Sc1ccc(C#N)cc1)c1ccccc1 509668948 YDEAKBDUQNXJDY-QFIPXVFZSA-N 388.492 5.429 30 20 GKED C=CCCc1ccccc1NC(=O)c1cccc(-c2noc(C(F)(F)F)n2)c1 510139948 NTUDWJSQIBOXOX-UHFFFAOYSA-N 387.361 5.126 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2Nc1ccc(NC(=O)CC(F)(F)F)cc1 511004374 ZRDUVZBGBRZCKI-LJQANCHMSA-N 387.405 5.329 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1coc(-c2ccc(OCC)cc2)n1 512522275 RDPNMLCYDKQLFC-UHFFFAOYSA-N 394.519 5.096 30 20 GKED COc1ccccc1Oc1ccc(CN[C@H](C)c2ccc(C#N)cc2F)cc1 512637185 SJTBIOFHRKVZRU-MRXNPFEDSA-N 376.431 5.349 30 20 GKED COc1ccc(-c2ccc(C)c(NC(=O)c3ccc(C(C)(C)C#N)cc3)c2)cn1 512956297 XUOVKHLUAWBFPC-UHFFFAOYSA-N 385.467 5.119 30 20 GKED C[C@H](c1nnc(-c2ccccc2F)s1)N1CC=C(c2ccc(C#N)cc2)CC1 514125879 AFBZUNWEPYVWBE-OAHLLOKOSA-N 390.487 5.066 30 20 GKED N#CCc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1 515703838 BZXQODWWCRKQGK-XZOQPEGZSA-N 382.463 5.074 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N(C)CCOCc1ccc(C#N)cc1 516111929 LNRHKTVDAYABHC-UHFFFAOYSA-N 393.531 5.486 30 20 GKED C=CCN(Cc1ccccc1)C(=O)c1ccc(Sc2ccccc2Cl)nn1 525692716 SIUSHQRFNAXHOI-UHFFFAOYSA-N 395.915 5.110 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCC[C@@H]1C1CCCCC1 532920461 VFCWONQKOZRHBQ-YLJYHZDGSA-N 385.577 5.064 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1Br 536076986 WKWCLQFLYBBHOU-CYBMUJFWSA-N 389.318 5.404 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ncc(Cc4ccccc4Cl)s3)cc2)CC1 538499313 HXECWUPXPPGGOA-UHFFFAOYSA-N 393.899 5.195 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2c[nH]nc2-c2ccccc2F)cc1 540202048 DZZYMMPAHZEKOO-UHFFFAOYSA-N 382.442 5.044 30 20 GKED N#Cc1cc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)ccc1Cl 544401372 BSLPQKQNUJVKDX-GOSISDBHSA-N 384.913 5.123 30 20 GKED C=C[C@H](CC(=O)Nc1cnn(-c2ccccc2)c1C(F)(F)F)c1ccccc1 546526442 IOZUNZRFUVEQCH-OAHLLOKOSA-N 385.389 5.190 30 20 GKED CC1=C(c2ccco2)CN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1 554876000 BJEIXAZXHDXMLO-OAHLLOKOSA-N 381.501 5.243 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)c1 563679763 LENAVIHTATUBLR-GVDBMIGSSA-N 387.336 5.290 30 20 GKED CCCc1nc(C)c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)o1 565340067 POEIIXXJONABIQ-CQSZACIVSA-N 385.876 5.203 30 20 GKED Cc1csc(NC(=O)c2cc3c(C)nn(-c4ccc(F)cc4)c3s2)c1C#N 589035494 UFROAQGDFSSGMH-UHFFFAOYSA-N 396.472 5.028 30 20 GKED CCN(CCC(F)(F)F)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 591474609 MKEXLWIRPTYBME-UHFFFAOYSA-N 396.253 5.530 30 20 GKED CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)C1(C)C 603738432 BRTLORHPGQLTCT-QUCCMNQESA-N 375.472 5.231 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 608920656 XKCKMURHIQBONM-NRFANRHFSA-N 379.504 5.028 30 20 GKED C[C@@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(F)c(Br)c1 609670593 ZOFGYKPHJIUCDB-MRVPVSSYSA-N 388.162 5.047 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CCc3cc(Cl)cs3)c2)c1 609907163 OKMXHXRTPAVTFI-UHFFFAOYSA-N 396.899 5.423 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccnc2ccccc12 609907328 JKXZRLHODVBTHD-MRXNPFEDSA-N 375.497 5.058 30 20 GKED C[C@@H]([C@H](C)c1ccc(Cl)cc1)N(C)C(=O)c1cc2ccccc2n1CC#N 610471899 IQCFCIPPDGILJV-HOTGVXAUSA-N 379.891 5.082 30 20 GKED Cc1ccc(OCc2ccc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)o2)c(C)c1 619752985 OXOXMKSPOISIJD-HXUWFJFHSA-N 396.446 5.514 30 20 GKED CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(F)cc1C(F)(F)F 622278894 QHPQEYNSYGCZJI-UHFFFAOYSA-N 379.275 5.136 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cccc(F)c1F 622485287 JNHYXVWUMOYWEH-CYBMUJFWSA-N 383.238 5.017 30 20 GKED Cc1ccc(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 642399856 JGHPCJSQGOQSSZ-NXEZZACHSA-N 386.311 5.165 30 20 GKED C=CCC[C@@H](NC(=O)Nc1c(C)cnn1CC)c1ccc(C(F)(F)F)cc1 667812444 MSXWKQDBAHALFO-MRXNPFEDSA-N 380.414 5.059 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc2c(cnn2C(F)F)c1)c1ccc(F)c(F)c1 681412614 PLERWYLCKSFGEC-KRWDZBQOSA-N 392.356 5.149 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)Nc2ccc(OC)c(F)c2)c1 728227263 DXKQZRNQKCQQDS-UHFFFAOYSA-N 390.483 5.219 30 20 GKED Cc1ccc2oc(C(=O)Nc3sc4c(c3C#N)-c3ccccc3CC4)cc2n1 729177800 DTKVMEXQYOASIZ-UHFFFAOYSA-N 385.448 5.087 30 20 GKED Cc1cccc2c1CCN(C(=O)Nc1ccc(Oc3ccc(C#N)cc3)cc1)C2 729564542 COZUHVZFYDICPT-UHFFFAOYSA-N 383.451 5.249 30 20 GKED COc1ccc2oc([C@@H](C)NC(=S)Nc3ccc(C#N)c(Cl)c3)c(C)c2c1 730152494 LGVBFYFEKXAMAJ-GFCCVEGCSA-N 399.903 5.323 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1ccc2ccccc2n1 730685501 HGNZFYWNFGMLRM-SUMWQHHRSA-N 383.278 5.597 30 20 GKED Cc1c(Cl)cccc1NC(=S)Nc1ccccc1S[C@H](C)CC#N 731322434 ZTAMONFMJQJMNJ-GFCCVEGCSA-N 375.950 5.852 30 20 GKED C#CC[C@@H](OC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1ccccn1 733691862 CGCGYYMMWMPVCY-XMMPIXPASA-N 380.447 5.006 30 20 GKED C=CCOc1ccccc1CN(C(=O)C(=O)C(C)(C)C)c1ccc(C)c(C)c1 733913007 YVOSVAOBEGLERR-UHFFFAOYSA-N 379.500 5.017 30 20 GKED COc1ccc(CN(Cc2cc(Cl)ccc2OCC#N)[C@H](C)C2CC2)cc1 735307965 BCIFAATYDZEUOJ-MRXNPFEDSA-N 384.907 5.052 30 20 GKED Cc1cccc(/C=C2/CC(O)(C(F)(F)F)C/C(=C\c3cccc(C)c3)C2=O)c1 735792961 OTKGUZPXVQRVJP-UHWBUFEVSA-N 386.413 5.427 30 20 GKED C#CCOc1cc(F)ccc1NC(=S)Nc1c(Cl)ccc(C)c1Cl 741503920 YWFCCCPIEIPEDC-UHFFFAOYSA-N 383.275 5.262 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)/C=C\c2ccccc2C#N)cc1 741639899 IVMQJOYQEIECPB-ZPWFJYARSA-N 382.463 5.124 30 20 GKED C#Cc1ccc(C(=O)N(c2cccc(N3CCCC3)c2)C2CCCCCC2)nc1 741936327 GOEMORKXWNHADU-UHFFFAOYSA-N 387.527 5.033 30 20 GKED COc1cc(/C=C2/C(=O)c3cccc(Br)c3[C@H]2C)cc(Cl)c1O 742434944 OGXBYDFGWSJVRA-DAVUEJTQSA-N 393.664 5.200 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cn(Cc3ccccc3)c3ccccc23)cc1 745406473 LILPJPNESIIDGM-UHFFFAOYSA-N 393.490 5.559 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CNc2ccccc2Cl)cc1 745853730 VRMHMXGWQQTXGA-LJQANCHMSA-N 375.859 5.046 30 20 GKED Cc1cccnc1CC(=NNc1ncc(C(F)(F)F)cc1Cl)C(F)(F)F 746365678 AVRYHUHKOBOOMY-UHFFFAOYSA-N 396.722 5.030 30 20 GKED C=CC[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccncc1 748312703 CGZKPUGZQNMBOX-NRFANRHFSA-N 385.492 5.152 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1ccc(C#N)cc1 748683827 FEAQPANERUZXTN-LLVKDONJSA-N 388.901 5.244 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2cc(Cl)ccc2Cl)cc1C#N 752151051 FDEVXSHWCHQIDY-UHFFFAOYSA-N 393.230 5.077 30 20 GKED C[C@H](CSc1ccc(F)cc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 756242770 OKOUPKVALIMDID-KDOFPFPSSA-N 396.512 5.554 30 20 GKED CCC[C@H](NC(=O)Cc1cccc(OCC#N)c1)c1ccc(Cl)c(Cl)c1 760380215 TXLDIKCLKSAERT-IBGZPJMESA-N 391.298 5.096 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(OCc3ccc(F)cc3)c2)cc1 770489950 VYVWFQOOGXKCQV-QGZVFWFLSA-N 376.431 5.308 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)c1 772985045 QAZCAJIEJWIIHX-QPPBQGQZSA-N 390.527 5.250 30 20 GKED C#CCCCCCC(=O)N(CCC)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 779965820 YEPCMWHDSLICMB-XMMPIXPASA-N 380.507 5.441 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1cccc(OCc2ccc(F)cc2)c1 779995736 XMFUSJHWYQZJRT-KRWDZBQOSA-N 376.431 5.308 30 20 GKED N#Cc1ccc(C(=O)/C=C\c2cccc(OCc3ccccc3C#N)c2)c(F)c1 781109894 BRPIDTSRJKNURP-LUAWRHEFSA-N 382.394 5.044 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)O[C@H](C#N)C1CCCCC1 782422496 FWKHSKWIPMCXHL-MRXNPFEDSA-N 392.377 5.298 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792096284 ZWSZHSSVNFCIAP-HXUWFJFHSA-N 397.503 5.394 30 20 GKED Cn1cc2c(n1)CC/C(=C\c1nc(-c3cc(Cl)ccc3Cl)cs1)C2=O 794961642 ISDUQOVHSZHBOY-UXBLZVDNSA-N 390.295 5.063 30 20 GKED CN(Cc1ccccc1)C1CCC(=NNc2nc(C(F)(F)F)cs2)CC1 797786338 RLEUKAPXESHNKF-UHFFFAOYSA-N 382.455 5.004 30 20 GKED C[C@@H](C#N)Oc1ccc(CN(C)[C@H](C)Cc2ccccc2C(F)(F)F)cc1 809725074 IVLPJGKUEAWCMQ-CVEARBPZSA-N 376.422 5.059 30 20 GKED CC(C)(C)c1ccc([C@H](O)CCC(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 817319610 QAJZDXHNOYHNPW-XZOQPEGZSA-N 392.543 5.349 30 20 GKED CCCCCCOCc1cccc(NC(=O)N2Cc3ccc(C#N)cc3C2)c1 847147247 IBAOEBPVCGDIPP-UHFFFAOYSA-N 377.488 5.203 30 20 GKED N#CC1(c2ccc(-c3nc(-c4ccccc4OCc4ccccc4)no3)cc2)CC1 904463408 KRCFYOUFQYRGEF-UHFFFAOYSA-N 393.446 5.538 30 20 GKED COC1(c2noc(-c3ccc(Sc4ccccc4C#N)cc3)n2)CCCC1 904836175 OAYYLFHIGVJOPW-UHFFFAOYSA-N 377.469 5.175 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 916997036 RNCURXLOCMHTQU-LBIZBFCRSA-N 377.296 5.649 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3o2)c(C2CC2)c1 933845383 CZLPUXUCORRWPR-FQEVSTJZSA-N 386.455 5.336 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3cccc(F)c3F)o2)ccc1Cl 1776033609 HEYWYWFTDPEOEE-UHFFFAOYSA-N 376.746 5.022 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(/C=C/C(=O)O)o2)c2c(c1)C(C)(C)CC2 1776269178 AFUPWWIPYYQNII-GFULKKFKSA-N 392.495 5.795 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2F)cc1)c1ccccc1 1776469469 YUNZDOZAPUKOJD-DKGMDFAASA-N 390.410 5.560 30 20 GKED Cc1cc2c(c(C)c1Cl)C(=O)/C(=C\c1cc(C(=O)O)c(Cl)s1)CO2 1777427865 LYZVUOHOMZQPJT-WTKPLQERSA-N 383.252 5.029 30 20 GKED Cc1ccccc1-c1ncc(C(=O)/C=C/c2ccc3oc(C(=O)O)cc3c2)s1 1777462912 NAHSXJLTGJNBHH-SOFGYWHQSA-N 389.432 5.459 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C/c1ccc(C(=O)O)cc1Cl 1777488222 GIAHKVRYTFWHCG-MDZDMXLPSA-N 383.856 5.366 30 20 GKED N#CCc1ccc(NC(=O)CSc2ccc(Cl)c(C(F)(F)F)c2)cc1 5318874 QZJBEVAUKNLQSZ-UHFFFAOYSA-N 384.810 5.156 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)c2cnn(C(C)C)c2n1 25438684 VWFFZBZYMMMYLF-UHFFFAOYSA-N 389.503 5.189 30 20 GKED C=CCN(C(=O)c1cc(-c2ccccc2)no1)c1nc(-c2ccccc2)cs1 33153192 KSCMMPFKXPZPKE-UHFFFAOYSA-N 387.464 5.298 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1c1cccc(F)c1 66955206 CXRYVJJTGAVIMJ-KXBFYZLASA-N 383.492 5.589 30 20 GKED N#C[C@H](C(=O)[C@H]1CCOc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 102967406 AOLLHLAHGYCEGF-DLBZAZTESA-N 394.883 5.206 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2ccc(Cl)cc2)cc1 111183035 AUMAUCAHALKELF-OAHLLOKOSA-N 388.920 5.166 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(C#N)c(Cl)c2)CC1 123282717 WVULVBKWFZWWNH-UHFFFAOYSA-N 377.875 5.021 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 131744266 MFGRAWBFMQSNCG-LBPRGKRZSA-N 395.846 5.351 30 20 GKED CCN(C(=O)c1sc2nc(C(F)(F)F)ccc2c1C)c1ccc(C#N)cc1 152268649 NCGBJYKRQZNHSI-UHFFFAOYSA-N 389.402 5.162 30 20 GKED N#C[C@@H](C(=O)NC1CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 155688173 SCJBECGHBPTWDW-AWEZNQCLSA-N 394.327 5.173 30 20 GKED CC(=O)N(c1nc(/C=C2/CCCC(C)(C)C2=O)cs1)c1ccc(F)cc1F 158991499 ITJSDNZYDHEUDT-LCYFTJDESA-N 390.455 5.269 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 173122399 UTUIILGRALMZGK-IEBWSBKVSA-N 381.545 5.566 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2)ccc1OC 180815370 SPZJGUSVPXNDCF-KBXCAEBGSA-N 392.421 5.246 30 20 GKED Cc1c([C@H](NCc2nnc(-c3ccc(C#N)cc3)o2)C(C)C)oc2ccccc12 183260601 CMBPPBJDYIADRI-OAQYLSRUSA-N 386.455 5.150 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCCc1cccs1 187567324 HYUZDJGGXYIOEA-AWEZNQCLSA-N 376.572 5.057 30 20 GKED CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 195737647 WGHCVKZYENJTBU-YADHBBJMSA-N 375.516 5.678 30 20 GKED N#CCCCOc1cccc(CNCCc2nc(C3CCCCC3)cs2)c1 237821956 KHGBXZIPHOLLSU-UHFFFAOYSA-N 383.561 5.206 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2F)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 246672507 GIYAXNIXMOPBPS-QINHECLXSA-N 397.519 5.835 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)c1cc(-c2ccccc2Cl)nc2ccccc12 302220949 IGAYIXMYQWSQIZ-QFIPXVFZSA-N 377.875 5.223 30 20 GKED CC(C)COc1ccc(CC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 303319887 TZTNYBSBODPJBV-KRWDZBQOSA-N 382.529 5.154 30 20 GKED CC1CCC(N(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)CC1 303368754 JIIIJDUHSDQCOB-ADKAHSJRSA-N 385.577 5.062 30 20 GKED CCS(=O)(=O)c1ccc([C@H](C)/N=C(/O)[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1 329162879 ZWUTXEPUXCAVKL-DSLXNQLJSA-N 377.550 5.104 30 20 GKED CC(C)C[C@H](/N=C(/O)N1CCn2c(C3CCCC3)nnc2[C@H]1C)c1ccccc1 329490913 VFTWUVYSIGLWTQ-XLIONFOSSA-N 395.551 5.014 30 20 GKED COc1ccc(/C(O)=N/[C@@H]2CCOC3(CCCCC3)C2)cc1OC1CCCC1 329673029 UVLAYJXJTXBSQS-GOSISDBHSA-N 387.520 5.203 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](CC(F)F)c1ccccc1 421066315 PQQPQAOGOJMVCF-PBHICJAKSA-N 389.471 5.456 30 20 GKED Cc1cc(Cl)c(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)cc1Cl 428524509 VORWDRSDPDUKSU-UHFFFAOYSA-N 399.281 5.331 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(Cl)c2SCC(F)F)c1 430629730 WVZWRPBMTZXURN-UHFFFAOYSA-N 398.887 5.565 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 433144507 MNFADGUROKRQFY-YLJYHZDGSA-N 393.556 5.665 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1nc(-c2ccccc2)cs1 435902117 MNZFBXNMQPJYOI-UHFFFAOYSA-N 399.928 5.207 30 20 GKED C=C[C@](C)(CC)C(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 442902604 WRRSEMACHUEJHV-HYBUGGRVSA-N 376.500 5.027 30 20 GKED C[C@@H](c1ccc(C(=O)Nc2ccccc2SCCC#N)cc1)C(F)(F)F 455507545 ALWYXCMYKGUSCT-ZDUSSCGKSA-N 378.419 5.610 30 20 GKED N#CCCC[C@H](NC(=O)N1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)c1ccccc1 458809384 AIQAMDUPEKTNNX-LWSSLDFYSA-N 387.527 5.399 30 20 GKED C[C@@H](c1cccc(C#N)c1)c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 461800183 ABVIXKQYAPBSAN-AWEZNQCLSA-N 386.386 5.086 30 20 GKED CC(C)C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 468756490 ADSQZZHBGHVTDJ-JOCHJYFZSA-N 375.516 5.469 30 20 GKED Cc1ccc([C@]2(C)CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)cc1 469359979 WZZRKLVVHSAXGW-RUZDIDTESA-N 385.511 5.057 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(COc2cc(Cl)ccc2C#N)cs1 474389436 IKRRAQXTFSEYRZ-UHFFFAOYSA-N 397.887 5.240 30 20 GKED Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)C[C@@H](CC#N)c1ccccc1 475597985 BBAPMBSFKVZJGB-GGAORHGYSA-N 398.510 5.143 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC2CCC2)cc1Cl 476149172 MNHSQLLFCFWAOM-UHFFFAOYSA-N 383.919 6.376 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(NCCc2ccccc2)cc1)c1ccccc1 479395612 HXBFZAUKZASKTL-JOCHJYFZSA-N 383.495 5.367 30 20 GKED CC(C)CN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@H]1CCCc2cccnc21 479721930 XZIAJVSIBHZENP-IBGZPJMESA-N 393.535 5.077 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccccn1)c1ccc(Cl)cc1)c1ccccc1 483358960 NHGCHKDNOPBJEP-IBGZPJMESA-N 389.886 5.356 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F 483862466 ZYJHNPKZPJPRBL-HNNXBMFYSA-N 390.478 5.270 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 485383289 LDMCHYNJTVDCIW-IERDGZPVSA-N 381.545 5.766 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1c(Cl)cccc1Cl)c1c[nH]c2ccccc12 486429053 UQTVEWYJKNJNLA-KPZWWZAWSA-N 386.282 5.349 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1ncc(-c2cccc(Cl)c2)o1 488762682 IKTFNYWJINFTFH-UHFFFAOYSA-N 395.793 5.573 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 494753375 OLFMKFSBWCOLCC-CQSZACIVSA-N 391.393 5.593 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cc(C(F)F)ccc1Cl 497214452 KDBVFYANPCNXNE-CRAIPNDOSA-N 389.833 5.581 30 20 GKED N#Cc1ccc(CSCc2nc(-c3cccc(C(F)(F)F)c3)no2)c(F)c1 497871478 YLSJZKWEOYHFEM-UHFFFAOYSA-N 393.365 5.200 30 20 GKED COc1cccc([C@H](NCc2ccc(C#N)cc2OC)c2ccccc2Cl)c1 500853942 XZMFCKXFIPXJNU-QHCPKHFHSA-N 392.886 5.108 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCCC[C@H]2c2noc(C(C)C)n2)c1 501146791 YYUQULQBIXISME-IBGZPJMESA-N 398.507 5.297 30 20 GKED Cc1nc(NC(=O)c2ccc(Oc3ccccc3)cc2)sc1SCC#N 504714789 ASQFOYXREITVNJ-UHFFFAOYSA-N 381.482 5.112 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1ccco1)c1ccccc1OC 505061965 NWYXQLCNDAGXPP-QFIPXVFZSA-N 376.456 5.318 30 20 GKED CCN(C(=O)c1csc(-c2ccc(Cl)cc2)n1)[C@H](C)c1ccc(C#N)cc1 509557031 DKBVPVSLSXPSEW-CQSZACIVSA-N 395.915 5.558 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OCc3ccccc3F)cc2)c1 509827838 QETXGNZOGNOGEE-UHFFFAOYSA-N 380.806 5.182 30 20 GKED F[C@@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccc(C(F)(F)F)nc2)n1 512033587 XPESCSWAQJBBAZ-LBPRGKRZSA-N 391.246 5.228 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1cccc(COc2ccccc2C#N)c1 513114234 YVBKPGSVBJVUCM-KRWDZBQOSA-N 388.442 5.110 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 518027636 SEIUCSXLUOGDBE-HNNXBMFYSA-N 392.405 5.462 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3nc4ccccc4s3)cc2)cc1 518372854 DZYAEMLSCJBPCK-UHFFFAOYSA-N 399.475 5.085 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1ccccc1C(F)(F)F 520814675 IIYJGLQEMNPOKF-CYBMUJFWSA-N 394.418 5.117 30 20 GKED Cc1nc(CC(C)C)sc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 524374449 CZVDRCSGAGZPDP-HNNXBMFYSA-N 381.526 5.264 30 20 GKED CC[C@H]1CCC[C@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 524724629 GMYXSAFMVKZGKC-PXNSSMCTSA-N 378.541 5.549 30 20 GKED N#Cc1cccc(CC(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1 531145773 JPFOVLAUJTXZBQ-UHFFFAOYSA-N 398.249 5.234 30 20 GKED N#C[C@@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1nc2ccccc2s1 534925314 GHDARXQYJCDHIS-HNNXBMFYSA-N 394.402 5.541 30 20 GKED COc1ccc(CN(Cc2ccoc2)C2CCCCC2)cc1OCCCC#N 536658919 UNRQUBNHNANZMK-UHFFFAOYSA-N 382.504 5.306 30 20 GKED N#CC1(c2ccc(C(=O)N(Cc3ccccn3)c3ccc(Cl)cc3)cc2)CC1 537425583 QUCHNUCBXNRIGP-UHFFFAOYSA-N 387.870 5.137 30 20 GKED CCC(C)(C)[C@H]1CCc2nc3ccccc3c(C(=O)[C@H](C#N)c3ccncn3)c2C1 546152490 BXCATDWFOHALKY-QFBILLFUSA-N 398.510 5.056 30 20 GKED Fc1cccc(F)c1C(F)(F)c1nc(Cc2cccc(C(F)(F)F)c2)no1 546258710 DWBKAMQBJDXDPA-UHFFFAOYSA-N 390.258 5.098 30 20 GKED CC[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 559597899 WHRHJSVZCJLYNW-QFIPXVFZSA-N 378.497 5.288 30 20 GKED CCN(C(=O)c1ncc(C#N)cc1C)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 559755108 FAWGSCRVINEQJY-XMMPIXPASA-N 398.510 5.032 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCN(C)c2ccccc21 560400096 OKNHHTBVKKLNBW-WMZOPIPTSA-N 394.544 5.174 30 20 GKED O=C(N[C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)[C@@H]1CC[C@@H](C(F)(F)F)C1 567069388 DKVIZMAVTBWQJA-KBVBSXBZSA-N 391.714 5.177 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(Br)cc1 575224703 MYINNGNKNOOFPY-NSHDSACASA-N 383.211 5.190 30 20 GKED C[C@H](N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1)c1ccc(C#N)c(F)c1 578611972 DSIMQUKQVSQMET-BUXKBTBVSA-N 378.369 5.398 30 20 GKED CC(C)CN(CC(C)(C)C)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 581101589 MZUKGUBNHBQJOK-UHFFFAOYSA-N 380.492 5.282 30 20 GKED CCc1ccc([C@H](C)CC(=O)NC2CCC(Oc3ccccc3C#N)CC2)cc1 609970794 JWDIMEKOEPYNHA-WDGBRCNXSA-N 390.527 5.121 30 20 GKED CC[C@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1nccs1 609982374 SEKDEIDDVYOHGB-KRWDZBQOSA-N 397.887 5.342 30 20 GKED C[C@@H](Sc1nc(-c2ccccc2)ccc1C#N)c1nc(Cc2ccccc2)no1 610166734 XLCYWRGEINXQMY-MRXNPFEDSA-N 398.491 5.447 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)c2c1 610423945 KJNLPLMTZNUEDP-UHFFFAOYSA-N 396.450 5.107 30 20 GKED C[C@H](NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1)c1cccc(C#N)c1 610884640 HLDCNHIPPOBUMQ-SFHVURJKSA-N 396.494 5.055 30 20 GKED COc1ccc(CN[C@H]2CCCc3cc(C#N)ccc32)cc1OC1CCCC1 611391866 CCTIFAGZRQXTBB-QFIPXVFZSA-N 376.500 5.055 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F 626408422 VCTAVOOQZYAFSI-GFCCVEGCSA-N 399.262 5.160 30 20 GKED Cn1c(C(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc2cc(C(F)(F)F)ccc21 647378346 PPJVOHFXMLFRSY-ZDUSSCGKSA-N 389.402 5.021 30 20 GKED CCC1(C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CCC(F)(F)CC1 667004158 KTDHPMFLBCHQGH-QWRGUYRKSA-N 395.334 5.181 30 20 GKED C[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)c(F)c1 673627896 XAPYWIARLFFSQF-OHBODLIOSA-N 375.303 5.525 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 682089728 CIJUNKCIVALEQF-QWRGUYRKSA-N 397.334 5.066 30 20 GKED C[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1ccccc1C(F)(F)F 726476932 NXQSHXZFJNWNOP-JTQLQIEISA-N 383.826 5.278 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(SC(C)(C)C)cc1 726846686 UKUGQYQRPXZVJH-UHFFFAOYSA-N 381.545 5.893 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2cnc(-c3ccccc3)s2)cc1 727263484 DHBOBEVLVGHAJQ-SEYXRHQNSA-N 391.496 5.236 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2cccc(OCC#N)c2)CC3)cc1 730149047 ANURWKNQJWSGOG-QGOAFFKASA-N 386.476 5.233 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730416172 BKCMSTCUYIXFPL-YKMGAGOLSA-N 394.471 5.502 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1nc2cc(F)ccc2s1 730422707 VVRBAFPFMKNDSI-QGZVFWFLSA-N 390.439 5.504 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCc3sccc3C2)cc1 730664384 GYPJZYIETOGDEJ-NRFANRHFSA-N 387.508 5.384 30 20 GKED C/C=C/c1ccc(OC(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c(OC)c1 732494285 DBNRCEUGOHNPLR-ONEGZZNKSA-N 386.407 5.006 30 20 GKED Clc1ccccc1Nc1nc(Cl)c(C=NNc2nccnc2Cl)s1 733079224 AJEKJTZRJWFJFP-UHFFFAOYSA-N 399.694 5.083 30 20 GKED Fc1ccc(C(F)(F)F)cc1C=NNc1ccc(OCC(F)(F)F)cc1 733204147 JMERTICTOAJXIR-UHFFFAOYSA-N 380.263 5.232 30 20 GKED O=C(O)COc1cccc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)c1 733205071 JRACMHJLBJHVEJ-DAXSKMNVSA-N 385.630 5.006 30 20 GKED C#CC[C@@H](OC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccccn1 733691191 BGIAURCRAPRMEO-HSZRJFAPSA-N 397.430 5.328 30 20 GKED C[C@@H](NCc1cccc(OCc2ccccc2C#N)c1)c1nc2ccccc2s1 734163715 GXRNKZQVPCIOMI-QGZVFWFLSA-N 399.519 5.598 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1coc(-c2ccc(F)cc2)n1 735319262 XHIDWXQTJQIFIQ-UHFFFAOYSA-N 388.851 5.470 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2(c3ccccc3F)CC2)cc1 736955558 MSLXNEVUQHIGLW-FQEVSTJZSA-N 385.442 5.292 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)cc(Cl)c1O 741474658 XYMQDSLYQDWRQB-VOTSOKGWSA-N 379.843 5.402 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccccc3)n2C)cc1 744033488 RSTISYKTOCNVOE-UTKZUKDTSA-N 399.494 5.167 30 20 GKED CC(C)CN(C(=S)Nc1ccc(OC(F)F)cc1)c1ccc(C#N)cc1 745686516 CUFPJWHSUWTEDO-UHFFFAOYSA-N 375.444 5.019 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(OCCC(C)C)cc2)c1 745821725 UAHASORRRQSMAH-FQEVSTJZSA-N 395.503 5.114 30 20 GKED C=C(Cl)COc1ccc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1 753142516 CZTHLUCHMFVMFS-MDZDMXLPSA-N 382.872 5.233 30 20 GKED O=C(/C=C\c1ccc(-c2ccncc2)cc1F)c1ncc(Br)s1 756843445 FPCWOYXRYAXZNC-ARJAWSKDSA-N 389.249 5.003 30 20 GKED CC(C)N(CCC#N)Cn1nc(Cc2ccccc2)n(C2CCCCC2)c1=S 764927339 YOAAFBYZQRIPSK-UHFFFAOYSA-N 397.592 5.092 30 20 GKED C=CC[C@H](N[C@@H]1CCCc2nc(-c3ccc(Cl)cc3)sc21)c1ccncc1 766019209 KQFZQAMUKQYLPR-RBUKOAKNSA-N 395.959 6.143 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 774089049 HXLYCYGOJRPVPI-GUYCJALGSA-N 390.439 5.232 30 20 GKED C[C@H](N[C@H](C)c1cccc(OCc2ccccc2)c1)c1ccc(OCC#N)cc1 774381287 AZBYAVAXFGTRKX-VQTJNVASSA-N 386.495 5.580 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 774575503 LJOKGKZIFZRSCF-HOTGVXAUSA-N 383.410 5.003 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775487499 IVOXQKNTMKGJCI-LOSJGSFVSA-N 395.506 5.883 30 20 GKED Cc1cc(-c2ncccc2NC(=O)Nc2ccccc2O[C@H](C)C#N)cs1 782897339 JMVMPABOFYAINC-CYBMUJFWSA-N 378.457 5.053 30 20 GKED COc1cccc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1F 795205122 NQMRYMRDMONHOA-OAQYLSRUSA-N 388.442 5.061 30 20 GKED N#CC[C@@H](CC(=O)O[C@@H](c1ccc(Cl)cc1)c1cccnc1)c1ccccc1 796691186 KBGRYHFEIYQIOQ-CVDCTZTESA-N 390.870 5.455 30 20 GKED O=C(Nc1ccccc1OCC(F)(F)F)[C@H](F)c1ccc(C(F)(F)F)cc1 801654172 HGGCHQWTOVJGJE-CQSZACIVSA-N 395.274 5.296 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2ncc(-c3ccccc3)s2)C(=O)c2ccccc21 802709111 ZQSJGMLHGRCOJL-AGWAZZAUSA-N 389.476 5.127 30 20 GKED N#CC1(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)CCCC1 806584860 XGZXLDSKLDOYKG-UHFFFAOYSA-N 398.919 5.416 30 20 GKED N#Cc1cc(C(=O)Nc2cccc(CC[C@H](O)c3ccccc3)c2)ccc1Cl 806762195 XRRURJXUNVPVFQ-QFIPXVFZSA-N 390.870 5.130 30 20 GKED CC1CCN(CCC[C@H](NCc2cc(C#N)ccc2F)c2ccc(F)cc2)CC1 812724629 IILYJHMXLZIXDW-DEOSSOPVSA-N 397.513 5.179 30 20 GKED O=C1/C(=C\c2ccccc2OCc2ccccn2)CSc2ccc(F)cc21 819842255 LFHMLTKZRQHBHO-WJDWOHSUSA-N 377.440 5.172 30 20 GKED O=C(/C=C\c1csc(-c2ccccc2)n1)c1sccc1Br 915113707 STJXUALRIZEUTR-SREVYHEPSA-N 376.300 5.530 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(OCc3ccncc3)cc2)cnn1-c1ccccc1 915987218 ZEMNIVQJYWDSQO-XFXZXTDPSA-N 395.462 5.051 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1cccc(-c2ccc(Cl)cc2)c1 1776051199 ZSXQPFIOFLRCJZ-UHFFFAOYSA-N 380.831 5.160 30 20 GKED CC(C)(C)c1cc(C=NNc2ccc(C(=O)O)c(F)c2)cc(C(C)(C)C)c1O 1776073513 YXVFAAGWBKYNOZ-UHFFFAOYSA-N 386.467 5.271 30 20 GKED C=CCCC[C@H](NCc1cc(C)c(OCc2cccc(C)c2)c(C)c1)C(=O)O 1776174248 HLXOZBNTKXZMEH-QFIPXVFZSA-N 381.516 5.090 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2ccc(Cc3ccccc3)cc2)c1)C(=O)O 1776471126 BEQVBYMEPSCOKS-JJJPLKNQSA-N 386.447 5.025 30 20 GKED CC1(C)/C(=C\c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1776515329 JTAIYVQTVPUWPW-HAHDFKILSA-N 398.458 5.521 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cccc(F)c1OCC(F)(F)F 1776783797 LXUJDHDBZNHOSR-OAHLLOKOSA-N 393.421 5.060 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Oc2cccc(F)c2)cc1 1776784719 MJNHQBRYMZGNEP-HXUWFJFHSA-N 387.495 5.911 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1sc(C)cc1Br 1776786812 OXCRKVXNKUINIK-ZDUSSCGKSA-N 376.360 5.112 30 20 GKED CC(C)(C)CCCCCC(=O)NC1(c2ccc(NC(=O)CCC#N)cc2)CCC1 1787889365 DYHCDUZKRQINRD-UHFFFAOYSA-N 397.563 5.421 30 20 GKED C#CCCC(=O)NC1(c2ccc(NC(=O)c3cccc4ccccc34)cc2)CCC1 1788897119 SBNPVEOXHZZPAS-UHFFFAOYSA-N 396.490 5.001 30 20 GKED CN(CCC#N)c1ccc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc1 67253727 KAGTZEHVEHCMSI-UHFFFAOYSA-N 391.465 5.194 30 20 GKED Cc1c(Br)cccc1NC(=O)Nc1cccc(OCCCC#N)c1 113562123 OHUMICIRFMOHBT-UHFFFAOYSA-N 388.265 5.084 30 20 GKED Cc1ccc2oc(SCC(=O)Nc3ccccc3S[C@@H](C)CC#N)nc2c1 113777348 NKZVWOKKJLMZFS-AWEZNQCLSA-N 397.525 5.261 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2cccc(C)c2C)cs1 114992149 CYTZXPBLBXTHNH-FMIVXFBMSA-N 394.471 5.480 30 20 GKED CC(C)[Si](C(C)C)(C(C)C)n1cc(B2OC(C)(C)C(C)(C)O2)c2ccccc21 169743542 MXFFSQNKCJHCKO-UHFFFAOYSA-N 399.460 5.964 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccccc1-c1cc(F)c(F)c(F)c1 175563724 WFSFENABAISOQJ-CYBMUJFWSA-N 396.368 5.049 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(C[S@](=O)c2ccccc2)c1)c1ccccc1 188036759 ZFASPPVVGBEEFP-LXFBAYGMSA-N 389.520 5.293 30 20 GKED COc1ccc(CCCCC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 261449486 PWYUNSDFBAXMLS-KRWDZBQOSA-N 382.529 5.298 30 20 GKED N#Cc1nc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)ccc1Cl 301190057 YIQNXNMEXPAHEZ-UHFFFAOYSA-N 399.885 5.131 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1cc2c(C)nn(-c3ccccc3)c2s1 303240550 JITYCTXQPOJHGR-UHFFFAOYSA-N 394.544 5.188 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)c1 304053105 PDGWUDYOOKZCRQ-RTBURBONSA-N 389.282 5.418 30 20 GKED CC[C@@H]1C[C@H](C(O)=Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)CC(O)=N1 329406392 CUPSUEPKKAPCIH-AVIDTZRGSA-N 395.547 5.800 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NCc1c[nH]nc1-c1ccc(C(F)(F)F)cc1 418146416 PIBMRHCHCJOWRG-HXUWFJFHSA-N 396.416 5.134 30 20 GKED N#CCCn1ncc(C(=O)Nc2cccc(-c3cccs3)c2)c1-c1ccccc1 428920646 LJYDKSYSBGSWEX-UHFFFAOYSA-N 398.491 5.445 30 20 GKED C[C@@](NC(=O)C1CCC(C(F)(F)F)CC1)(c1ccc(F)cc1)C(F)(F)F 436043880 SZISAXGJMXQUBJ-MBRGGSNBSA-N 385.323 5.088 30 20 GKED COc1cc(-c2nc(CSc3cccc(Cl)c3C#N)cs2)ccc1O 436751272 RHYNLJSMDDZPPU-UHFFFAOYSA-N 388.901 5.342 30 20 GKED CCCCOc1ccccc1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 437884716 XFIQZJRAMPOLQE-CTNGQTDRSA-N 377.488 5.169 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CC[C@@H](Cc4ccccc4)C3)c2)cc1 438037691 SRRSXIBQGLEMGH-NRFANRHFSA-N 397.478 5.447 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 439064199 KTHIPJQAESLQBC-NRFANRHFSA-N 385.854 5.428 30 20 GKED O=C(Nc1cc(F)ccc1OCC(F)(F)F)c1ccc(C(F)(F)F)c(F)c1 439143599 ZLAJFRIWSAWBQM-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C=CC[C@H]1N(C(=O)C2CCN(c3nc4ccccc4s3)CC2)CCCC1(C)C 443872139 YICIHOJBWUMLQN-HXUWFJFHSA-N 397.588 5.106 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 443948764 WESVXDFXBKAMJQ-UHFFFAOYSA-N 396.878 5.505 30 20 GKED C[C@H](c1ccc(Br)cc1)c1noc([C@H](C)c2cccc(C#N)c2)n1 463062769 YNRZLQKEIZQJHR-CHWSQXEVSA-N 382.261 5.007 30 20 GKED C[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1Br)c1cccc(C#N)c1 464194589 MRJIXPFPFDYEBB-JTQLQIEISA-N 397.194 5.082 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(CC(F)(F)F)c1 464426432 CPZAAAYUDLXOLD-UHFFFAOYSA-N 380.369 5.582 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 465803808 DPJNBZHBRXOFGA-FSSWDIPSSA-N 391.515 5.018 30 20 GKED N#CC[C@@H](CC(=O)Nc1cc(F)c(Br)cc1Cl)c1ccccc1 466454382 JFNGKBDKILJAGD-LBPRGKRZSA-N 395.659 5.268 30 20 GKED COc1cccc([C@@H](C)CCCC(=O)Nc2cc(C#N)ccc2OC(F)F)c1 469307535 VJLYCDHCKFYFGE-AWEZNQCLSA-N 388.414 5.081 30 20 GKED N#CCCCn1cc(C(=O)N2CCC(c3ccsc3)CC2)c2ccccc21 469813796 KDIVOQRLINRZCW-UHFFFAOYSA-N 377.513 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(-c2ccc(C)n2C)n1 476165842 VQLFFHCANULVLJ-UHFFFAOYSA-N 379.529 5.561 30 20 GKED CN(C(=O)[C@H]1CCC(F)(F)C1)[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 484087487 YYNSXPDAYDTCSN-JQWIXIFHSA-N 389.286 5.203 30 20 GKED N#CCCC[C@H](NC(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccccc1 487235725 AUGQTHUDLCFRGZ-NRFANRHFSA-N 387.458 5.416 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccccc1 487600849 HAJXBNYADAIFMA-HLIPFELVSA-N 387.310 5.648 30 20 GKED CC(C)c1ccc([C@@H]2CCCN2C(=O)c2cnc(C(F)(F)F)c(C#N)c2)cc1 491313113 SMQNTNITKYQIMH-SFHVURJKSA-N 387.405 5.073 30 20 GKED CSc1cccc([C@@H](NCc2cc(C#N)ccc2F)c2cc(F)ccc2F)c1 494020494 NCEWZBJAMMRLLM-JOCHJYFZSA-N 398.453 5.577 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 494750126 XROZAUPASKZLKL-AWEZNQCLSA-N 391.393 5.593 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2ccc(C)c(Cl)c2)cc1C 497815503 RZYVJADKQKFABD-UHFFFAOYSA-N 392.890 5.295 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccccc1N1CCCCC1 499588243 URDDWFIJHQQILU-QGZVFWFLSA-N 379.529 5.181 30 20 GKED C=CCc1cc(CN[C@H](COc2ccccc2)c2ccccc2)cc(OC)c1O 500893369 RKFAYTVGVUAJNA-HSZRJFAPSA-N 389.495 5.039 30 20 GKED CN(CC(F)(F)F)C(=O)Nc1cc(C(F)(F)F)ccc1SCC(F)F 503003387 RSTCGYUILJFKAW-UHFFFAOYSA-N 396.303 5.089 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)c1ccccc1F 508604649 PQTFHDWCGANQJK-UHFFFAOYSA-N 388.442 5.714 30 20 GKED O=C(N[C@H](c1ccc(OC(F)F)cc1)C(F)(F)F)c1ccc(C(F)F)cc1 511740474 JPOLHNOIVCXFOV-CYBMUJFWSA-N 395.274 5.259 30 20 GKED C[C@@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1C(F)(F)F 513148415 PQLNJDREOQCNSX-OAHLLOKOSA-N 394.396 5.735 30 20 GKED N#Cc1ccc(CN[C@@H]2CCc3c(Br)cccc32)c(C(F)(F)F)c1 516898751 FGFKEXHVZIVYNT-QGZVFWFLSA-N 395.222 5.117 30 20 GKED CC(C)N(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@H](C)C#N 518682280 YPOHGYVLRCDGRR-MRXNPFEDSA-N 385.508 5.520 30 20 GKED COc1cc(CNc2nc(C(F)(F)F)ccc2C#N)ccc1OCCC(C)C 522409326 TUPCIBOQSCEEFD-UHFFFAOYSA-N 393.409 5.018 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccc(C(F)F)c2)c1 523959228 VMWCDJFLWGXFTR-UHFFFAOYSA-N 398.796 6.194 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@@H]1c1c(F)cccc1Cl 525394489 STGZBKRLXWEZIS-PXNSSMCTSA-N 399.897 5.074 30 20 GKED CCc1ccc(C(C)(C)NCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 538256918 FJNYNCUDDSKICQ-QGZVFWFLSA-N 395.572 5.107 30 20 GKED CC(=O)c1cc(F)c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c(F)c1 538542519 ACJCVJPUXUQLKI-UHFFFAOYSA-N 392.361 5.084 30 20 GKED CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1nccs1 542964237 KVCFUKYJOCZWFE-FOIQADDNSA-N 390.512 5.193 30 20 GKED Fc1ccccc1-c1csc(N2CCC(C(F)(F)F)(C(F)(F)F)C2)n1 549141592 HYUGSPLWOSLWIK-UHFFFAOYSA-N 384.320 5.270 30 20 GKED N#CCCN(C(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccc(F)cc1 556707462 HGJSXKZLWZLRLS-UHFFFAOYSA-N 378.428 5.007 30 20 GKED O=C([C@@H]1CC[C@@H](C(F)(F)F)C1)N1CC[C@@](F)(c2cccc(C(F)(F)F)c2)C1 557033611 KYTMZPCQRJUQAX-XFJVYGCCSA-N 397.334 5.081 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)N1CCC(CCC#N)CC1 565954156 WUBOZUICBCGGAH-UHFFFAOYSA-N 392.286 5.113 30 20 GKED COc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c(Cl)c1OC 570132227 YFHMINSVCPQULJ-UHFFFAOYSA-N 395.846 5.028 30 20 GKED CC(C)[C@@H](Oc1ccccc1C#N)C(=O)Nc1cc(C(F)F)ccc1Cl 571087192 VPCUJMJCVZJXSR-QGZVFWFLSA-N 378.806 5.191 30 20 GKED N#Cc1ccc(CNC(=O)Nc2ccc3nc(C(F)F)sc3c2)cc1Cl 588330158 OZHHSGQDKNQQAM-UHFFFAOYSA-N 392.818 5.081 30 20 GKED CSc1cccc([C@H](NC(=O)CCCCCC#N)c2cc(F)ccc2F)c1 588621133 COKRADTWOQTGQM-NRFANRHFSA-N 388.483 5.366 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](C)(c2cccc(F)c2)C1 593159495 NQPCDHAKGVMSQL-AOMKIAJQSA-N 397.519 5.273 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(C#N)cc2)CCC1 594068834 AMLPFKOPADMCGA-MRXNPFEDSA-N 390.512 5.153 30 20 GKED C[C@H](NC1(c2ccc(C#N)cc2)CCC1)c1csc(-c2ccccc2F)n1 594518367 PNZWCVGNPPLPFX-HNNXBMFYSA-N 377.488 5.551 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)cn2)c1 604510895 KLXMYTDRBLRWFV-WOJBJXKFSA-N 389.842 5.141 30 20 GKED CCCCN(C)c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609377721 JQZOLJIAQZIPCJ-QGZVFWFLSA-N 381.545 5.427 30 20 GKED CCCc1ncc(C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)s1 610223576 ZZRUEYUDUSNNIQ-UHFFFAOYSA-N 393.487 5.262 30 20 GKED Cc1cccc(CC2CN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 610632518 KOHFTRHQIYKKDJ-QGZVFWFLSA-N 379.529 5.096 30 20 GKED CC(C)[C@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 610792650 SLHZFPRQSPYWSJ-VGSWGCGISA-N 393.556 5.868 30 20 GKED N#Cc1cnc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c(Cl)c1 610899467 PMPDTVRZSCBYNI-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cccc(C(F)(F)F)c1 611627873 YUSZNVATOGLCGF-UHFFFAOYSA-N 388.842 5.318 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCC[C@](C)(C#N)C1 612305165 JXWRAPMPNAGWRR-WZONZLPQSA-N 377.488 5.293 30 20 GKED Cc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c1 613347065 WMPPTDOYNWLQJT-HNNXBMFYSA-N 387.291 5.915 30 20 GKED Fc1cc(-c2ccncc2)ccc1CN1C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C1 678297607 NCGKXGLASBBXML-HUUCEWRRSA-N 392.318 5.060 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4cc(C#N)ccc4OC(F)F)cc3c2C1 728040762 LIUAVNSBFDGUHJ-GFCCVEGCSA-N 395.409 5.018 30 20 GKED C=CC[C@@H](NC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccncc1 734361647 VGCHLGYZUGRHMR-OAHLLOKOSA-N 388.311 5.166 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)CCS[C@@H](C)c3cccs3)c2C#N)C1 737406890 ZWZXCWCNLJYAJK-STQMWFEESA-N 390.599 5.629 30 20 GKED C=CCN(C(=O)N[C@H](c1cc(F)ccc1F)c1ccccc1Cl)C(C)C 745876475 OSLRISDQZNQHAB-IBGZPJMESA-N 378.850 5.314 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2ccc(-c3ccccc3F)o2)n1 747199225 RVLYGBSORIVOTG-INIZCTEOSA-N 382.460 5.475 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1 752521042 KLVSHKDUQHOWFJ-CXAGYDPISA-N 398.359 5.130 30 20 GKED C[C@]1(c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)CCCO1 763317809 DHZGEODTOJQKRZ-HXUWFJFHSA-N 381.819 5.080 30 20 GKED Cc1cc(Cl)c2ccccc2c1NC(=O)Nc1ccccc1O[C@H](C)C#N 765348436 LIBQABWBGPPPJH-CQSZACIVSA-N 379.847 5.737 30 20 GKED CC[C@@H]1CCCC[C@H]1OCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 766846423 LZFWLVVGHDDJIY-SUYBPPKGSA-N 376.909 5.111 30 20 GKED N#CCCCn1cc(C(=O)OCc2nc(Cl)ccc2Cl)c2ccccc21 769544730 SULSGAZEDXZWPJ-UHFFFAOYSA-N 388.254 5.004 30 20 GKED O=C(O[C@H](Cc1ccc(F)cc1)C(F)(F)F)[C@H]1CCC[C@H](C(F)(F)F)C1 781752521 AJRFTHRCKQLZJQ-SGMGOOAPSA-N 386.307 5.211 30 20 GKED COC(=O)c1cc(Cl)ccc1C(=O)/C=C/c1cnc(-c2ccccc2)s1 787179893 SGSSSMIHWXBSAW-CSKARUKUSA-N 383.856 5.146 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 791752960 XJVLKSWFWSBMIY-CCKFTAQKSA-N 387.405 5.147 30 20 GKED N#Cc1cccc(CN[C@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)c1F 796472607 YHIVYXFXKASCCS-QGZVFWFLSA-N 396.680 5.380 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)C(F)(F)F 796669961 JOUSERFMTFRIPX-VIFPVBQESA-N 388.361 5.243 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cccc(CC(C)C)c2)ccc1OC 796827960 UACURMQZHCTLTJ-PGRDOPGGSA-N 380.532 5.425 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCC(F)(F)C1)c1nc(-c2c(F)cccc2F)cs1 797944616 JSBGTCMYLAKVJG-QWRGUYRKSA-N 382.382 5.090 30 20 GKED C=C(C)CCc1noc(C(C)(C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 809500984 ZHEHEUYIFDMUBO-GOSISDBHSA-N 385.508 5.122 30 20 GKED COc1ccc([C@H](Cc2ccccc2)NCc2ccc(N(C)CCC#N)cc2)cc1 810171843 WDYJZOQCVLZUIT-SANMLTNESA-N 399.538 5.119 30 20 GKED CC(=NNc1ccccc1Br)c1nc2ccccc2n1C(F)F 812462339 MLDGQEBWBUJIMB-UHFFFAOYSA-N 379.208 5.030 30 20 GKED CC(C)c1ccc(SCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813214493 YOLJJVXJFSVLBX-MRXNPFEDSA-N 378.419 5.192 30 20 GKED CC1CCN(c2ccc(NC(=O)N(C)[C@H](C)c3cccc(C#N)c3)cc2)CC1 824017552 QAFNCYSMDWVWCF-GOSISDBHSA-N 376.504 5.019 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835073090 KDWCEFOQMUSRHD-PSASIEDQSA-N 394.340 5.470 30 20 GKED CC(C)Oc1ccccc1C(F)(F)C(=O)Nc1ccccc1SCCC#N 846865040 OITLKZJWDLSBCA-UHFFFAOYSA-N 390.455 5.210 30 20 GKED CC(C)(C#N)CCCOC(=O)Cc1cccc(NC(=O)OC(C)(C)C)c1Cl 850117723 BMZALYODVUDFAU-UHFFFAOYSA-N 394.899 5.103 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccco1 860477128 AVGSLYIRGRRYMV-JQWIXIFHSA-N 378.375 5.278 30 20 GKED C[C@@H](Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1cccc(C#N)c1 864010645 HXDKPSGCHFAJOM-MRXNPFEDSA-N 387.870 5.835 30 20 GKED N#Cc1c[nH]c2cc(-c3nc(-c4ccccc4OCc4ccccc4)no3)ccc12 904465704 MWDZUEYJUPHTQM-UHFFFAOYSA-N 392.418 5.336 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C=NNc1nccc2sccc12 915980676 YPBNGIJYDOFCTF-UHFFFAOYSA-N 399.882 5.088 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCc2ccccc21)c1nc(-c2c(F)cccc2F)cs1 920804622 XCIYYDGQKOIRQN-HOTGVXAUSA-N 394.446 5.385 30 20 GKED O=C(O)c1cc2cc(C=NN(Cc3ccccc3)Cc3ccccc3)ccc2o1 1776023317 ZOHZSOUDWSGWNH-UHFFFAOYSA-N 384.435 5.167 30 20 GKED CC(C)Oc1cc(Cl)c(C=NNc2ccc(F)c(C(=O)O)c2)cc1Cl 1776064109 ZBNLQQBEZDNQBB-UHFFFAOYSA-N 385.222 5.064 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(-c3ccc(C)cc3)c2)cc1CC(=O)O 1776131799 KDNVEOHZEZXQNZ-XYOKQWHBSA-N 386.447 5.194 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2csc(-c3ccccc3Cl)n2)CC1 1776169909 MPTNHEPYELXLQL-UHFFFAOYSA-N 390.936 5.097 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1csc(-c2ccc(OC)cc2)n1 1776784466 QXLDAKIWRJGXHJ-QGZVFWFLSA-N 390.549 5.112 30 20 GKED CCCCCCCOc1ccc(CNC[C@@]2(CC(=O)O)CC[C@H](C)C2)cc1 1776786377 TYUYBBMEYLXOQV-CVDCTZTESA-N 375.553 5.407 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1sc(Br)cc1C 1776786695 BYAWXQIECGXMJB-CYBMUJFWSA-N 376.360 5.112 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)c2ccccc2Cl)cc1 1776788424 BUXUGRDRHKQMIS-NRFANRHFSA-N 389.923 5.605 30 20 GKED COc1ccc(/C=C2\CCc3ccc(C(C)C)cc3C2=O)c2cc(C(=O)O)oc12 1777360192 BDNWXTPRHICCEW-LICLKQGHSA-N 390.435 5.476 30 20 GKED Cc1cc(Br)sc1/C=C1\CCCc2cc(C(=O)O)ccc2C1=O 1777418134 KUUSJGWQECNGPB-FMIVXFBMSA-N 391.286 5.120 30 20 GKED COc1ccc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)cc1OC 7744522 RDHRMCPDTWTIMA-CMDGGOBGSA-N 385.872 5.377 30 20 GKED C=CCN(C(=O)c1cc(C)ccc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14724238 GCLOVBBOCVMIQT-UHFFFAOYSA-N 393.468 5.168 30 20 GKED Cc1sc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(C#N)c1C 20836547 LVVIZVXEILYICD-UHFFFAOYSA-N 392.324 5.527 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)n1C 41538110 MUHXAMYOSUDUMJ-ZDUSSCGKSA-N 390.295 5.254 30 20 GKED C[C@H](c1ccccc1)N(C)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 48125628 HZRKZDHYLZORRX-QGZVFWFLSA-N 398.466 5.035 30 20 GKED C=CCN(C(=O)c1csc(CC(C)C)n1)c1nc(-c2ccccc2)cs1 63570513 QIYWNLJWPYQDHW-UHFFFAOYSA-N 383.542 5.298 30 20 GKED N#C[C@H](C(=O)Cc1coc(-c2cccs2)n1)c1nc2cc(Cl)ccc2s1 106353870 PNIPZPNPNRPCAZ-GFCCVEGCSA-N 399.884 5.085 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccc(Br)cc1Cl 108200334 IMZYMLBCTGJDSC-UHFFFAOYSA-N 395.709 5.361 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnn(-c2ccc(Cl)cc2)c1 108237370 ATRXDMFNHCYECY-AWEZNQCLSA-N 396.903 5.030 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C1CCC1 108372881 AVSFOSBEAIQJSG-SBUREZEXSA-N 393.556 5.008 30 20 GKED CC(C)CCO[C@@H](C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 109195690 JIIHDFLQEUCLAE-OXJNMPFZSA-N 384.907 5.385 30 20 GKED CC(=O)Nc1cc(NCc2cccc(OCc3ccccc3C#N)c2)ccc1C 114761681 JDDJNYAIHCBYBN-UHFFFAOYSA-N 385.467 5.016 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccccc3C)n2)cc1 118977458 LFZONSUXDKUPCY-XUVXKRRUSA-N 388.492 5.107 30 20 GKED Cc1ccc2cc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)ccc2n1 127482141 FAUUJVMMCCEVMN-UHFFFAOYSA-N 394.434 5.163 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2cccc(C(F)(F)F)c2C)c1 135219864 FWUNGFUWCSKMPV-OAHLLOKOSA-N 391.393 5.017 30 20 GKED CN(Cc1ccccc1NCCCC(C)(C)C#N)C(=O)c1cc2ccccc2o1 154058113 GBBLAHKVQMUZHA-UHFFFAOYSA-N 389.499 5.447 30 20 GKED CC(C)c1ccc(-c2nc(C[S@](=O)Cc3ccc(C#N)c(F)c3)cs2)cc1 190738759 NNKQDJBVARLFSL-HHHXNRCGSA-N 398.528 5.393 30 20 GKED COc1ccccc1-c1csc(C2CCN(Cc3cc(C#N)cs3)CC2)n1 191836244 IZGIBMAQEZRQMN-UHFFFAOYSA-N 395.553 5.131 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)cc1OC 216730272 ZAVCTMVEISAQKB-LBPRGKRZSA-N 384.278 5.557 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](c2ccccc2)c2cccc3ccccc23)cc1 237611570 PNJLZZBHAJFASV-NFQMXDRXSA-N 392.502 6.010 30 20 GKED N#CCCCOc1cccc(CN[C@@H](c2ccccc2)c2ccc(Cl)cc2)c1 237788523 HHVHBAVLMIWIRX-DEOSSOPVSA-N 390.914 5.902 30 20 GKED Cc1nc2ccccc2n1CC/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329533327 XWVOGRKKWVCTGN-FQEVSTJZSA-N 391.519 5.081 30 20 GKED CC(C)(C)[C@@H]1N=C(O)CC[C@H]1/N=C(/O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 329703440 ISQAOCLSGGPKBI-SLYNCCJLSA-N 396.535 5.143 30 20 GKED OC(=Nc1nc2c(s1)CCCCCC2)C1CCC(/N=C(/O)C2CC2)CC1 330024665 JWTPWDNINKTISD-UHFFFAOYSA-N 375.538 5.315 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@H]3C[C@@H]3c3ccccc3)c2)cc1 409779549 LJCARNGWFQJJLT-RPWUZVMVSA-N 397.478 5.009 30 20 GKED CN(C(=O)c1cscc1C#N)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 410684953 BATDVNJZMSVNDH-CYBMUJFWSA-N 392.324 5.014 30 20 GKED COCCCCN(Cc1ccccc1)C(=O)c1sc2ccc(C#N)cc2c1C 429811721 OYKFIUHSEWKNLN-UHFFFAOYSA-N 392.524 5.150 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2ccc3nc(C)sc3c2)cc1 437261587 HGWMNEXWTVPXJD-UHFFFAOYSA-N 377.513 5.031 30 20 GKED CCCc1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 437458328 ILGDLWZPUMQQBO-UHFFFAOYSA-N 381.432 5.151 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1 437657381 QQXSIEOZBHRYSM-PKTZIBPZSA-N 389.543 6.237 30 20 GKED Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)NCC1CCC(C#N)CC1 441131645 BZKIRJOFJOHYQK-UHFFFAOYSA-N 392.286 5.017 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H](C)c1cccc(C2CC2)c1 451116784 RYTWOFJTHIPSDF-IAGOWNOFSA-N 393.556 5.105 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)N2CCC(C#N)CC2)cc1 455984096 NJYFGWQNGCKEPX-UHFFFAOYSA-N 396.903 5.130 30 20 GKED C[C@@H]1CN(C(=O)N[C@@H](CCCC#N)c2ccccc2)CC[C@@H]1c1ccccc1 458799935 KMULUVSDEQAKCT-OIBXWCBGSA-N 375.516 5.257 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)[C@H](C)c2cccc(C#N)c2)cc1 462135247 PJFWGHSMIKDARG-RTBURBONSA-N 398.506 5.557 30 20 GKED C[C@H](C(=O)N[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462553027 PPEZWEQZKHCBFM-KPOBHBOGSA-N 386.417 5.133 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)[C@@H](C)c2cccc(C#N)c2)cc1 463817041 VOLORQGXDHDLIU-DFBJGRDBSA-N 397.522 5.257 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)cc1Cl 469125226 SAWCCCRURDQGJS-CQSZACIVSA-N 385.870 5.235 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(-c2cnn(C)c2)c1 475557648 ZUENFXKNVLKMSN-UHFFFAOYSA-N 388.515 5.261 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCc2ccccc2)nc1 476117176 GTGOIJOLEXJRFR-UHFFFAOYSA-N 386.495 5.765 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(NCCc2ccccc2)cc1)c1ccccc1 479395621 HXBFZAUKZASKTL-QFIPXVFZSA-N 383.495 5.367 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](N[C@@H](C)CC)c1ccco1 482183897 IDMSUGBCRRDIDX-PXNSSMCTSA-N 383.536 5.382 30 20 GKED N#C[C@@H](C(=O)c1cc(F)ccc1-c1ccoc1)c1nc2cc(Cl)ccc2s1 483494204 VOQQBOGXOOSFPJ-INIZCTEOSA-N 396.830 5.839 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)s1 486738405 QOLVALAJBMYPOC-UHFFFAOYSA-N 377.513 5.253 30 20 GKED CC(C)(C#N)c1ccccc1CSCc1nc(-c2ccc(F)c(F)c2)no1 486756265 TXGNWCMJNIDGFF-UHFFFAOYSA-N 385.439 5.249 30 20 GKED CC(C)c1ccc(/C=C\CC(=O)N2CCC(Oc3ccc(C#N)cc3)CC2)cc1 487418524 IPLNATSAOMABKV-ARJAWSKDSA-N 388.511 5.155 30 20 GKED C=CCC[C@H](C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1)c1ccccc1 489749944 IJDSZVQDQMNVMI-LSDHHAIUSA-N 382.451 5.479 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccccc1Oc1ccccc1Cl 495116675 HTXPDYJGEMGURR-UHFFFAOYSA-N 395.846 5.673 30 20 GKED Cc1ccnc2sc(C(=O)N[C@H](C#N)c3c(Cl)cccc3Cl)c(C)c12 505533941 TXFQCZKRJPZQFW-CYBMUJFWSA-N 390.295 5.215 30 20 GKED CC[C@H](C)c1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508047255 ABNATZOBZDRCAW-LAUBAEHRSA-N 395.572 5.686 30 20 GKED COc1ccc(C)cc1NC(=O)[C@@H](Sc1ccc(C#N)cc1)c1ccccc1 509654527 XQCIEKSAPRLSAM-QFIPXVFZSA-N 388.492 5.347 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC2CCCCCC2)cc1 511414929 NQFUHYISVBARNV-UHFFFAOYSA-N 377.488 5.176 30 20 GKED CC1=C(c2ccco2)CN(C(=O)c2cccc(COc3ccc(C#N)cc3)c2)CC1 512725898 ROFSDENGCXYHET-UHFFFAOYSA-N 398.462 5.050 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccn(Cc2ccccc2)c1 514223915 USWUEKIOSGMTNQ-KRWDZBQOSA-N 375.497 5.040 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCCc1ccc2ccccc2c1 518684817 NPOHPWKWCKFBSW-QGZVFWFLSA-N 389.524 5.456 30 20 GKED C[C@H](CC(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)n1cccc1 519166385 FUMKLQPPQKEKDC-MRXNPFEDSA-N 393.874 5.182 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c(C)c1 521260298 AZWFGEQSSUKVNC-FUHWJXTLSA-N 381.545 5.780 30 20 GKED C[C@@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(Oc2cccnc2)cc1 521663022 GVIRMCGPRQBPQS-WIYYLYMNSA-N 385.467 5.139 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(CSC2CCCCC2)c1 523985901 RHDGVXXQEPPQAV-UHFFFAOYSA-N 393.556 5.788 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1cc2ccccc2s1 527497257 FEQJHDRZKYHJET-GJZGRUSLSA-N 395.553 6.178 30 20 GKED Cc1cc(C(=O)NC[C@@H](C)C#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 530642777 HFICTBZWBBMLDF-GXTWGEPZSA-N 390.314 5.364 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1c(F)cccc1Br 538940689 QLWTXKIUFHRPAL-GFCCVEGCSA-N 379.298 5.452 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2csc(-c3cccs3)n2)cc1 540809728 PDSMDMDGJMETST-UHFFFAOYSA-N 387.533 5.700 30 20 GKED N#C[C@H](C(=O)c1ccnc(C2CC2)c1)c1nc(-c2ccc(Cl)cc2)cs1 541200701 URCISQPTSUSZOA-MRXNPFEDSA-N 379.872 5.226 30 20 GKED N#Cc1cc(F)ccc1CNC1(c2noc(C3CCCC3)n2)CCCCCC1 541701302 OWDYHNQFXRWKHI-UHFFFAOYSA-N 382.483 5.077 30 20 GKED CN(C[C@H]1CC=CCC1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 542348698 BQACNUIJDOBXOL-FQEVSTJZSA-N 389.499 5.152 30 20 GKED C=CCC[C@@H](NC1CCN(c2nccs2)CC1)c1ccc(C(F)(F)F)cc1 542840701 LKTINXAOVJHPLE-GOSISDBHSA-N 395.494 5.428 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(CCC(F)(F)F)no2)c1 545040015 CBWVMAYSIRHIFY-UHFFFAOYSA-N 393.752 5.549 30 20 GKED N#Cc1ccc(-c2nc(-c3ccnc(Oc4ccccc4Cl)c3)no2)s1 545705847 KIJCBMBAEBSFJV-UHFFFAOYSA-N 380.816 5.177 30 20 GKED N#C[C@@H](C(=O)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1)c1ccncn1 546153578 NTQWFCRKYAGYPP-OAHLLOKOSA-N 386.213 5.080 30 20 GKED C=CCC[C@@H](NCc1cnc2ccc(C#N)cn12)c1ccc(C(F)(F)F)cc1 556599309 KUDVIKIDTAYIGB-LJQANCHMSA-N 384.405 5.022 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccnc(Oc3ccccc3)c2)s1 559319158 HQJMEEPJPVDWDG-INIZCTEOSA-N 377.469 5.118 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)ccn1 564438723 KZVUFPSCNYCDJS-QHCPKHFHSA-N 388.471 5.100 30 20 GKED CC(C)(C)Oc1c(F)cc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1F 566523360 PFSAQIOFOFAWFM-UHFFFAOYSA-N 399.441 5.210 30 20 GKED C=CCn1c(-c2cccc3cccnc23)nnc1N1CCC[C@H]1c1ccsc1 567547875 JXHPCBHNIPAALQ-IBGZPJMESA-N 387.512 5.082 30 20 GKED N#CCc1ccc(NC(=O)N2C[C@@H](c3ccccc3)C3(CCC3)C2)c(Cl)c1 573222909 SONZWKNTXXEONR-SFHVURJKSA-N 379.891 5.208 30 20 GKED CCC(C)(C)NC(=O)c1ccc(NCc2c(F)cc(C#N)cc2F)cc1Cl 585731634 DXHQUILECOPJDN-UHFFFAOYSA-N 391.849 5.020 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc(-c2ccccc2)cs1 595869380 LPBFEEJKHXRGGO-HXUWFJFHSA-N 388.492 5.622 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc4cc(Cl)ccc4o3)cn2)cc1 603765588 WXLYFFHXXXHLIP-UHFFFAOYSA-N 389.798 5.397 30 20 GKED CCCN(C(=O)CCc1ncc(-c2ccccc2)o1)c1cc(Cl)ccc1C#N 609286210 NRKNMWNIWKTIAV-UHFFFAOYSA-N 393.874 5.242 30 20 GKED COc1ccc(CCCCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 609460625 YNMNFPQPDQADKX-LJQANCHMSA-N 391.298 5.096 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609503873 BWKSRQCWGSTIPB-HXUWFJFHSA-N 389.480 5.255 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 609641306 JZSVAGNFDTZRAJ-KRWDZBQOSA-N 388.442 5.110 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C[C@H](C)c1ccccc1C 609693645 BNKXWBKJULEMNY-KRWDZBQOSA-N 385.467 5.495 30 20 GKED C[C@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)c1ccco1 610174468 ZHXIBFPNLLDUNO-AWEZNQCLSA-N 380.831 5.126 30 20 GKED C[C@H](NC(=O)N1CCC[C@](C)(C#N)C1)c1ccc(Oc2ccccc2)c(F)c1 612103152 WTVUOVCFRFDVEP-KSFYIVLOSA-N 381.451 5.014 30 20 GKED Cc1nn(C(C)(C)C)c(C)c1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 613407606 ZGBFQDKTCVZUIZ-ZDUSSCGKSA-N 386.908 5.008 30 20 GKED C[C@H](CC(F)(F)F)NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 613560846 NYBXNNATJZQPLK-SSDOTTSWSA-N 399.228 5.047 30 20 GKED COc1ccc(CNCc2ccc(C#N)c(Cl)c2)cc1OCc1ccccc1 619748256 DXHMUFOTOOKMET-UHFFFAOYSA-N 392.886 5.089 30 20 GKED C=CCN(C(=O)c1ccc(OC(C)C)cc1)c1nc(-c2ccccc2)cs1 641902192 FUSXKMWMUXZRJT-UHFFFAOYSA-N 378.497 5.430 30 20 GKED O=C(Nc1ccccc1C(F)F)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 645015441 KKPPQVRDMDVACC-IUCAKERBSA-N 390.274 5.219 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc(F)cc(Cl)c1 674915297 XGZKJGHTHRMWQV-RKDXNWHRSA-N 391.714 5.118 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3cc(C)n(-c4ccc(C#N)cc4)c3C)cc2)co1 728266882 ZMNAJBVHFIYTFS-UHFFFAOYSA-N 396.450 5.182 30 20 GKED COc1ccc(NC(=S)Nc2ccccc2SC[C@@H](C)C#N)cc1Cl 730954642 GKBRHODKXIAKML-LBPRGKRZSA-N 391.949 5.409 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H]3CCCc4ccccc43)n2)cc1 731135655 FZXLFAVVQOFNHM-TZIWHRDSSA-N 386.520 5.805 30 20 GKED Cc1ccc(F)c(/C=C2/SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)c1 735125990 QKHIPESPCFUQSX-FRKPEAEDSA-N 388.876 5.065 30 20 GKED Cc1ccc(/C=C2/CC(O)(C(F)(F)F)C/C(=C/c3ccc(C)s3)C2=O)s1 735793048 QJLKLFBTGJFMEQ-PVRNWPCDSA-N 398.471 5.550 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@H](C)c3cccc(C(F)(F)F)c3)[nH]c12 739190615 IIKBAIYWXQILND-XJKSGUPXSA-N 385.389 5.260 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3cccc(Cl)c3F)c2)s1 740429742 MSYDJPHZVBQRIF-UHFFFAOYSA-N 385.851 5.401 30 20 GKED C/C(=C/C(=O)[C@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1)C(C)(C)C 744029293 SLUDBAJXRYNGTN-BROZXCPCSA-N 376.456 5.119 30 20 GKED Cc1ccc(-c2csc3ncnc(NN=Cc4ccc(OCC#N)cc4)c23)cc1 744756242 ROKVVFQCQALMMZ-UHFFFAOYSA-N 399.479 5.015 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1nc(-c2ccccc2)cs1 753144106 JCEPNGCGTLYCDD-SREVYHEPSA-N 375.478 5.225 30 20 GKED C=C(C)[C@H](CC(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl)OCC 755586187 ZVDLJVBEAVWKGM-HIFRSBDPSA-N 388.360 5.282 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)OC3CCCCCC3)n2)cc1 761048955 OMLAIUSZRDLPPV-APWZRJJASA-N 382.529 5.423 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCCC[C@@H]1/C=C\c1ccccc1 761674445 TUENAMKXVZFSGF-QXHGNLAOSA-N 393.462 5.218 30 20 GKED CC(C)c1csc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)n1 764049469 GCBGCMLYKYBNEW-IBGZPJMESA-N 390.512 5.244 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(OC)c(OC(F)F)c2)cc1 764776407 ATLZSKZZWRFLQO-AWEZNQCLSA-N 397.849 5.279 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1cc(Cl)ccn1 777907487 WGIZHZVEFQCCKL-UHFFFAOYSA-N 388.302 5.203 30 20 GKED CC(C)c1ccc(-c2ncc(CNc3ccccc3O[C@H](C)C#N)s2)cc1 779744014 YOSJPSMOLJDZOS-MRXNPFEDSA-N 377.513 5.836 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)Nc1ccccc1O[C@@H](C)C#N 780674936 JVGRFLOAQDCYER-FQEVSTJZSA-N 399.494 5.520 30 20 GKED CC(C)Cc1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 780817086 MIEGOMDCSVLFNC-OAQYLSRUSA-N 395.572 5.371 30 20 GKED C=CCc1cc(CN[C@@H](C)c2cc(Br)cs2)cc(OC)c1OC 786848229 JVIZDMCAINOYJG-LBPRGKRZSA-N 396.350 5.107 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1csc(-c2ccc(O)cc2)n1 789887368 CERAWGHVKRXHHX-UHFFFAOYSA-N 378.497 5.620 30 20 GKED N#Cc1sc(NCc2cc(Cl)cc(Cl)c2OC(F)F)nc1Cl 804545444 YQAXGVJSRAPRPB-UHFFFAOYSA-N 384.622 5.188 30 20 GKED N#CC[C@@H](CC(=O)O[C@H](c1nc2ccccc2o1)C(F)(F)F)c1ccccc1 816066202 WDXWRUPZBYPEGQ-KBXCAEBGSA-N 388.345 5.062 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1ccc(Br)cc1 842941508 QOBBWUVDUGZOIS-ABAIWWIYSA-N 389.318 5.153 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)C(=O)c1cc2c(s1)CCCC2)c1ccc(Cl)s1 845838409 SKEKCEVUBHGDTC-ZYHUDNBSSA-N 377.918 5.037 30 20 GKED C=CCC1(C(=O)OCc2coc(-c3cc(Cl)cc(Cl)c3)n2)CCOCC1 859723584 HGOIEMOXCMBXEV-UHFFFAOYSA-N 396.270 5.065 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCC1CCC(C#N)CC1 902567594 NUWIMFKQZSMFQT-GTPINHCMSA-N 387.574 5.083 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)[C@@H](C#N)c3cc(C)nc(C)n3)c2c1 915103461 WQKORZWNIQKYJH-NRFANRHFSA-N 392.462 5.107 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)COc3cccc4ccccc34)n2)cc1 916650310 CINNTSAOWVITFG-FQEVSTJZSA-N 398.487 5.527 30 20 GKED O=C(O)c1cc(C=NN(Cc2ccccc2)Cc2ccccc2)sc1Cl 1776023209 QTCQGPXATQHNNF-UHFFFAOYSA-N 384.888 5.136 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3ccc(Cl)c(Cl)c3)s2)cc1 1776032753 PPDCDOIRFOQZRE-UHFFFAOYSA-N 391.279 5.866 30 20 GKED O=C(O)c1cc(NN=C(Cc2ccccc2Cl)c2ccoc2)ccc1Cl 1776034132 OVHIKQZANOTCBX-UHFFFAOYSA-N 389.238 5.344 30 20 GKED O=C(/C=C/c1ccc(OC(F)(F)C(=O)O)cc1)c1ccc(-c2ccccc2)cc1 1776131266 MVQNCHZPOCRGHT-OVCLIPMQSA-N 394.373 5.306 30 20 GKED C=CCCC1(C(=O)O)CCN([C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)CC1 1776168406 JZIBSRQSZNNOJI-OAHLLOKOSA-N 388.895 5.189 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)cc2)cc1)c1ccccc1 1776469396 GPQUOWGJFGWYOL-IXWWDANJSA-N 398.458 5.821 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2ccc([C@@H](C)C(=O)O)cc2)cc1 1776787520 LGZBFECUWMVAKD-QGZVFWFLSA-N 399.556 6.190 30 20 GKED CCCCCCCOc1cccc(CN[C@@](C)(COc2ccccc2)C(=O)O)c1 1776787870 AUACTQOMAMBHGR-DEOSSOPVSA-N 399.531 5.048 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C1\CCc2occ(C(=O)O)c2C1=O 1777341913 AKERJJSTGGWLTJ-FOWTUZBSSA-N 388.419 5.174 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(N(C)Cc2cccs2)cc1 1777436255 ZTYDNYVDQSMXCD-WQLSENKSSA-N 391.492 5.287 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccc(C)o3)cc2)CCC1 1786491147 JQNXPRZEWVYXCS-UHFFFAOYSA-N 394.515 5.328 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2ccc(C)c(F)c2)[n+]2ccccc2)c1 11083067 HCLRPORXOXIWIJ-UHFFFAOYSA-O 393.507 5.089 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 41549332 BBTSBDKMUOSQIB-GFCCVEGCSA-N 382.313 5.083 30 20 GKED CN(Cc1ccco1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 56750740 MXCMRCFUWLSKGI-UHFFFAOYSA-N 381.819 5.261 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCc2c[nH]c3ccccc23)cc1 65680152 VHFJLADKCLQAPR-UHFFFAOYSA-N 381.435 5.403 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)N(C)[C@@H]1CCCc2ccccc21 66861086 KCSLGXSEUVWYCL-DYESRHJHSA-N 393.556 5.029 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C(C)C)s1 66956063 JZWUSAYFKIKMJK-MRXNPFEDSA-N 387.574 5.893 30 20 GKED Cc1csc([C@@H](C#N)C(=O)[C@@H](Sc2ccc(F)cc2)c2ccccc2)n1 106982220 QTFXAZLFJQKWNS-HKUYNNGSSA-N 382.485 5.301 30 20 GKED Cc1ccc([C@H](C)N(C)CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 108359468 QWFFCCLFEUZUSY-ROUUACIJSA-N 381.545 5.021 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1cc(F)ccc1F 108529437 MCJHBEIIZILQFS-KBPBESRZSA-N 389.471 5.441 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(NC(=O)CC)ccc1Cl 125135650 CMAVSPWZDGWXGE-UHFFFAOYSA-N 398.894 5.004 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2c([nH]c3ccccc23)C1 129455927 VVYXTVRKGQMOKY-HNNXBMFYSA-N 390.512 5.152 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Oc1ccc(Oc2ccc(C#N)cc2)cc1 157150311 XXAGSIOAKLBHHS-CQSZACIVSA-N 376.412 5.055 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc2ccccc2o1 175854505 ZWXCGJRHDMAEIP-OAHLLOKOSA-N 379.485 5.491 30 20 GKED Cc1nc(CSCC(=O)Nc2ccccc2S[C@@H](C)CC#N)sc1C 176414722 CFLRDTGURFFIPO-LBPRGKRZSA-N 391.587 5.026 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC(c1cccs1)c1cccs1 184329438 IVIUIMNPACOICY-ZDUSSCGKSA-N 383.498 5.012 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccccc1Oc1ccccc1Cl 194134838 JGHZCZLABNCGHN-UHFFFAOYSA-N 378.815 5.287 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 248785351 IHXKTYDLIYVTHF-IMFGXOCKSA-N 395.528 5.123 30 20 GKED N#Cc1ccsc1C(=O)Nc1ncc(Cc2cc(Cl)ccc2Cl)s1 303024965 MPOAGIOCYZLKEH-UHFFFAOYSA-N 394.308 5.226 30 20 GKED C[C@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)c1ccc(C#N)cc1 303727779 UFSWONBIGXQTDH-HNNXBMFYSA-N 378.501 5.768 30 20 GKED Cc1ccccc1C1(C(O)=Nc2ccc3c(c2)nc(C2CC2)n3C)CCOCC1 328842832 QEJHZYUMKPFYED-UHFFFAOYSA-N 389.499 5.096 30 20 GKED OC(=Nc1cccc(-c2cc[nH]n2)c1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329447970 MHGQHWQDNMFJOD-GOSISDBHSA-N 389.503 5.172 30 20 GKED N#CC1CCC(CNC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)CC1 331580517 LNCDTCFCZDOWRY-UHFFFAOYSA-N 376.287 5.048 30 20 GKED Cc1sc([C@@H](C)NCc2cccc(F)c2C#N)nc1-c1ccc(Cl)cc1 428358651 HSZWDYAOXRRJED-GFCCVEGCSA-N 385.895 5.634 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCc2cccc(C)c2C1 429772704 OXLLFRLUWXMKIK-UHFFFAOYSA-N 397.478 5.558 30 20 GKED N#CCC1(CN[C@@H](c2ccc(Cl)cc2)c2ccc(OC(F)F)cc2)CC1 430747282 LLNMWKKGLCKMLS-SFHVURJKSA-N 376.834 5.314 30 20 GKED C[C@@H](NCc1ncc(C(F)(F)F)s1)c1ccc(-c2cccc(C#N)c2)cc1 433339884 BYOKARHIYGOTLE-CYBMUJFWSA-N 387.430 5.551 30 20 GKED C[C@@H](Oc1ccccc1F)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437456610 BAYQIVQCXFUIBO-CQSZACIVSA-N 394.377 5.035 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(OC(F)F)c2ncccc12)c1ccccc1 439305475 KDFICEITCISWAM-MRXNPFEDSA-N 396.397 5.003 30 20 GKED CCCc1c(NC(=O)c2cccc3c(C)c(C)[nH]c23)cnn1-c1cccc(C#N)c1 440065758 BLVGXSQLWYIINB-UHFFFAOYSA-N 397.482 5.047 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)CC1 440999977 PNEKIEGCCBRDBI-MYKUNDNFSA-N 381.907 5.059 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@@H]3CCC[C@@H]32)cc1F 444392777 CJUCPRAJSKJATA-KXBFYZLASA-N 379.435 5.286 30 20 GKED O=C(Nc1ccc(F)cn1)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444938117 VSOPJYDWVQBAKD-GFCCVEGCSA-N 395.278 5.055 30 20 GKED COc1ccc(-c2nnc(S[C@H]3CC[C@H](C#N)C3)n2C2CCCCC2)cc1 450651254 LGGIMJFXRARPRX-KXBFYZLASA-N 382.533 5.243 30 20 GKED Cc1ccc(-c2csc(Cc3noc([C@@H](C)c4cccc(C#N)c4)n3)n2)cc1 461795179 JHTFWUDLORBCPC-HNNXBMFYSA-N 386.480 5.116 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCN(c2ccccc2F)C1 463727970 KQGFHOTWSORLHM-GOSISDBHSA-N 395.522 5.326 30 20 GKED COc1ccccc1-c1nc(CN2CCC[C@H]2[C@H](C#N)c2ccccc2)cs1 464824156 ULQMFWDUXCDXGJ-RTWAWAEBSA-N 389.524 5.090 30 20 GKED CSc1cc(C)ccc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 465249394 CTKXCBYUOHVJLS-OAHLLOKOSA-N 385.558 5.290 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1ccc(C2CCC2)cc1 466358809 GAPALQVATAAMLF-INIZCTEOSA-N 380.513 5.366 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1 470268507 YYSUIFHYUMGASD-DYVFJYSZSA-N 389.377 5.155 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(F)cc(F)cc2F)cc1F 473617085 AVJDGQHMCYXGCX-UHFFFAOYSA-N 386.304 5.159 30 20 GKED C=CCC1(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)CCC1 479627457 FLLSPYGZNHHMON-MRXNPFEDSA-N 380.463 5.002 30 20 GKED N#Cc1c(N[C@@H](c2ccccc2)c2ccccn2)nc2c(c1C#N)CCCCCC2 479849511 IGDFDHKSFMGSBY-DEOSSOPVSA-N 393.494 5.080 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCCc1csc2ccccc12 482634379 PWDRMMIAHMHUMF-UHFFFAOYSA-N 396.560 5.009 30 20 GKED Cc1ccccc1-n1ncc(C(=O)Nc2ccc(C#N)cc2Cl)c1C(C)C 485716285 DAKBZYNFIMHFBV-UHFFFAOYSA-N 378.863 5.082 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 488340004 ZMAOQPYFKXFVAE-LJQANCHMSA-N 397.906 5.189 30 20 GKED Cc1cc(C)c(C[S@@](=O)CCCCC(C)(C)C#N)c(OCc2ccccc2)n1 488843240 YKSPMLAPFKCVAJ-NDEPHWFRSA-N 398.572 5.246 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@@H]3CCCC(F)(F)C3)c2)cc1 494236875 HCAKZWOCTLVCDA-LJQANCHMSA-N 399.441 5.031 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NCC(=O)Nc1ccc(CC#N)cc1 498652751 DQLLLODYNSWHEL-UHFFFAOYSA-N 393.556 5.537 30 20 GKED C=CCN(Cc1ncc(C(C)(C)C)o1)Cc1cc(Br)ccc1F 502198443 UFOYRGZGJGLDPZ-UHFFFAOYSA-N 381.289 5.062 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3sc4c(c3C#N)CCCCCC4)c12 504268549 XRFWHSDJKAPRCY-UHFFFAOYSA-N 377.513 5.250 30 20 GKED N#CCCCCNC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 505042113 QHTNEGAOXSXSSW-UHFFFAOYSA-N 393.339 5.709 30 20 GKED Cc1oc(C(C)C)nc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 507200354 CJYSRRYJWYSRPP-UHFFFAOYSA-N 389.455 5.004 30 20 GKED CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@H](C)c1cc2ccccc2o1 507667148 AUCSGLMCHDKETB-QGZVFWFLSA-N 389.499 6.239 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccc(F)c(Cl)c3)c2)c1 508043954 BBHHJISCLBEZFS-UHFFFAOYSA-N 380.850 5.220 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CCCCC3)cnn1C1CCCCC1 510381849 ZQNCMICAXKSIFK-UHFFFAOYSA-N 382.533 5.151 30 20 GKED CN(C(=O)NCC(C)(C)CCC#N)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 513113849 STKZDMRYKDALNR-ZWKOTPCHSA-N 395.469 5.313 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Cc1coc2ccc3ccccc3c12 514532642 ISRAQBCKZXTKDJ-UHFFFAOYSA-N 382.463 5.439 30 20 GKED CCc1cc(C#N)c(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)s1 515713077 GGNZOVOKJJWYQO-UHFFFAOYSA-N 385.876 5.062 30 20 GKED CC(C)C[C@H](NC(=O)c1ccc(COc2ccccc2C#N)o1)c1cccs1 515873308 UWBSJWCKSZUIAD-SFHVURJKSA-N 394.496 5.309 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@H]1N[C@@H]1CCc2ccc(C#N)cc21 515924638 HIVUVLTUQBWGIJ-LIUKBUMOSA-N 399.357 5.381 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccs1 520197893 SKKKOHYSJSIBSB-NVXWUHKLSA-N 387.574 6.051 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 520271964 XDAZNYRSAOLLJJ-HXUWFJFHSA-N 395.384 5.071 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cnc3ccsc3c2)cc1 525659248 OCTHEYGKFDQEIJ-UHFFFAOYSA-N 399.475 5.194 30 20 GKED Cc1nc(O)c(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)cc1-c1ccccc1 530694085 UTWIEBCTEIWPJN-QFIPXVFZSA-N 399.494 5.055 30 20 GKED CC[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)N(CC)CC 531050487 LQGVCPDBGHVWCG-TZIWHRDSSA-N 383.923 5.054 30 20 GKED Cc1ccccc1-c1cnc(CNc2ccccc2Oc2ncccc2C#N)o1 534528580 ONLHHQFKQUNSIX-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C=C[C@@H](CC(=O)N[C@H](c1ccccc1)c1ccc2nc[nH]c2c1)c1ccccc1 536182961 SSRGEYLKRYUHDF-AVRWGWEMSA-N 381.479 5.128 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)CCCC(F)(F)F)c2)cc1 537744273 WKBJTFAIUZDDRD-UHFFFAOYSA-N 376.378 5.003 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 538577769 WUWDPOUDUSZQOL-IBGZPJMESA-N 396.490 5.943 30 20 GKED N#CCC[C@H](NC(=O)NCc1ccc(-c2ccccc2C#N)cc1)c1ccccc1 539177459 HFWMLAFCUWYWQX-DEOSSOPVSA-N 394.478 5.070 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ncc(Cc4cccc(Cl)c4)s3)cc2)CC1 539600234 DGRLKIPHBBXHPB-UHFFFAOYSA-N 393.899 5.195 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)NC/C=C/c2ccccc2)cc1 539786234 CSEUVFRAXKDWOU-RMKNXTFCSA-N 397.478 5.167 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CC1CCC(C(F)(F)F)CC1 543101933 NVKNASQBAZWFBX-FYOYPEGLSA-N 378.438 5.044 30 20 GKED C[C@@H]1C[C@H](c2noc(-c3cccc(Oc4ccc(Cl)cc4C#N)c3)n2)CCO1 547216260 UCCHITJPAXELHQ-ZIAGYGMSSA-N 395.846 5.336 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cc(C#N)ccn2)cc1Cl)c1ccccc1 555587591 AHKSXCCZTWHCLF-AWEZNQCLSA-N 376.847 5.032 30 20 GKED Cc1cccc([C@@H]2CCCCCN2C(=O)c2cnc(C(F)(F)F)c(C#N)c2)c1 556248646 JWBIOBGEGKUTFE-SFHVURJKSA-N 387.405 5.038 30 20 GKED Cc1cc(C#N)cnc1-c1nc(CC2(SCc3ccccc3)CCCC2)no1 559967232 OJWQFNSAEZUXEX-UHFFFAOYSA-N 390.512 5.100 30 20 GKED CCc1ccc([C@@H](C#N)N(C)C(=O)c2csc(-c3ccccc3C)n2)cc1 562322696 FNIFSSCSYDUTTP-HXUWFJFHSA-N 375.497 5.018 30 20 GKED N#Cc1ccc(CNC2(c3ccc(Cl)cc3)CCOCC2)c(C(F)(F)F)c1 567037483 LHJMTMRSFMLPMB-UHFFFAOYSA-N 394.824 5.026 30 20 GKED CCO[C@H](c1noc(C2(C#N)CCCCC2)n1)c1ccc(F)cc1C(F)(F)F 567084377 QJMMCGRROMRSOV-HNNXBMFYSA-N 397.372 5.079 30 20 GKED Cc1ncc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C2CC2)n1 576456318 IYXLQKNJARZLDP-OAHLLOKOSA-N 397.482 5.084 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSC1CCCCC1 585719961 AEDWXPDBCQYICE-JOCHJYFZSA-N 384.545 5.667 30 20 GKED C[C@H](Oc1ccccc1C(F)(F)F)C(=O)Nc1ccc(F)cc1C(F)(F)F 590253455 NQVNTEVHAKFWBP-VIFPVBQESA-N 395.274 5.269 30 20 GKED CC(C)c1ccc(N(C(=O)CCCCC#N)c2nc3ccccc3s2)cc1 593942542 SUXPTATWMBOUCG-UHFFFAOYSA-N 377.513 6.168 30 20 GKED C=C(C)C[C@H](NC(C)=O)c1nc(CC2(SCc3ccccc3)CCCC2)no1 596591774 KLTZTPNYTNEDJD-IBGZPJMESA-N 399.560 5.002 30 20 GKED Cc1oc(-c2ccccc2)nc1CC(=O)Nc1sc(-c2ccccc2)cc1C#N 603968924 MQMVLOZIWNDXPQ-UHFFFAOYSA-N 399.475 5.431 30 20 GKED C=CCn1c(SCc2sc(C)nc2C)nnc1-c1ccc(Cl)cc1 607758209 KDQLSRAQPQBCNN-UHFFFAOYSA-N 376.938 5.150 30 20 GKED CCC1CCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)CC1 609078971 GCORAUZTZZXLLN-UHFFFAOYSA-N 377.488 5.100 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609503872 BWKSRQCWGSTIPB-FQEVSTJZSA-N 389.480 5.255 30 20 GKED C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1ccccc1-c1ccccc1C#N 609909297 AVYUWSJSYQNRII-PXNSSMCTSA-N 384.454 5.383 30 20 GKED CC[C@H](C)[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 610015731 RAEDFIPPXOIYRG-JXFKEZNVSA-N 378.476 5.178 30 20 GKED C[C@H](NC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1cccc(C#N)c1 610406962 NHNZSXHVTBUHTF-AWEZNQCLSA-N 387.405 5.012 30 20 GKED CC(=O)N(c1ccccc1)c1nc(CSc2ccc(Cl)cc2C#N)cs1 610654657 AESKMHWGUQASMC-UHFFFAOYSA-N 399.928 5.645 30 20 GKED Cc1cc(C)n(-c2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2)n1 613392561 UOVXQFLDKWWGBE-HXUWFJFHSA-N 398.491 5.103 30 20 GKED Fc1cc(-c2ccncc2)ccc1CN1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 678297605 NCGKXGLASBBXML-GJZGRUSLSA-N 392.318 5.060 30 20 GKED CC(=NNc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(SC(C)C)cc1 728429371 DSHOJTDMMCAOMF-UHFFFAOYSA-N 398.500 5.020 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCCCCc1cccs1 731546454 OXZTULJZNGTPHC-GOSISDBHSA-N 378.497 5.233 30 20 GKED C[C@H]1C[C@H]1c1ccc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)o1 732765246 XAVWQXSVSRQBSK-TVQRCGJNSA-N 393.299 5.139 30 20 GKED CC(C)c1cnc(COC(=O)c2ccccc2Sc2ccccc2C#N)o1 733383483 JWNSKUAIIGVMCA-UHFFFAOYSA-N 378.453 5.178 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)cc1 734771720 GBNBNYQDQWAUOA-HSALFYBXSA-N 388.417 5.362 30 20 GKED COc1cccc(-c2nc(/C=C3/CCc4ccc(OC)cc4C3=O)cs2)c1 741848238 OBODHADNSYHZDD-GDNBJRDFSA-N 377.465 5.040 30 20 GKED Cc1c(C(=O)/C=C/c2nc(-c3ccccc3)cs2)cnn1-c1ccc(C#N)cc1 741852008 HQEAVOJYWNSEGA-VAWYXSNFSA-N 396.475 5.072 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 742538271 WKNCDLUNRYYCRB-WJXFIBLPSA-N 390.527 5.654 30 20 GKED C[C@@H](NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccccc1 743038369 YJFFNKADAHXBPK-OAHLLOKOSA-N 391.471 5.537 30 20 GKED Cc1ccsc1[C@@H]1C[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 748833484 CRQNPUWNLRQCAH-OAGGEKHMSA-N 398.940 5.813 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3ccc(F)c(F)c3)n2)cc1 756232521 UNGOCNJGGVROKX-QGZVFWFLSA-N 396.462 5.596 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(SC(F)(F)F)cc1 767131364 RGGAGYWHROWUJV-UHFFFAOYSA-N 394.447 5.036 30 20 GKED CC(C)c1cccc2c1OCC/C(=C\c1cnc(-c3ccncc3)s1)C2=O 768489733 GENCHDUXZLBTCT-FOWTUZBSSA-N 376.481 5.377 30 20 GKED COc1ccsc1C(=O)/C=C/c1cccc(NC(=O)c2ccccc2Cl)c1 769744445 LGNDVIMOOLLEJQ-MDZDMXLPSA-N 397.883 5.559 30 20 GKED O=C1/C(=C\c2ccc(F)nc2)CC(c2ccccc2)C/C1=C\c1ccc(F)nc1 777463353 BIWMSXSZRKMBLY-NGHQTVFFSA-N 388.417 5.369 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C1CCCC1 780668671 DTIJXSYJAXZZRX-BTYIYWSLSA-N 381.451 5.170 30 20 GKED CCCN(Cc1c(F)cccc1Cl)C(=O)Nc1ccccc1O[C@H](C)C#N 780678631 VUEQAUKKMGUMCK-CQSZACIVSA-N 389.858 5.214 30 20 GKED CCOc1cc(/C=C(/C(=O)OCCCC(C)(C)C#N)c2ccccc2)ccc1O 782328590 WOHIOBRUFUHQKO-HMMYKYKNSA-N 393.483 5.205 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 785768867 MCJUROPJEPSQJX-OAQYLSRUSA-N 386.517 5.090 30 20 GKED O=C1/C(=C\c2cnc(-c3ccco3)s2)CCc2ncc(C(F)(F)F)cc21 789146710 BKQGXMIJSGENRI-POHAHGRESA-N 376.359 5.029 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2sc(C(C)(C)C)nc2C)cn1 792873025 RVZPRSUZTRZFRQ-KHPPLWFESA-N 393.512 5.111 30 20 GKED N#CC[C@@H](Cc1nc(C(c2ccccc2)c2ccccc2)no1)c1ccccc1 795703681 HVRYNJLKEYQEMF-QFIPXVFZSA-N 379.463 5.490 30 20 GKED CCCCN(Cc1ccccc1O)C(=O)Nc1ccccc1SC[C@@H](C)C#N 801628307 DWQJHXDYNNUTRW-KRWDZBQOSA-N 397.544 5.478 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1 801656953 VJHNVLKPZMCTAA-SFHVURJKSA-N 378.369 5.025 30 20 GKED N#CC1(c2ccc(COC(=O)[C@H](F)c3ccc(C(F)(F)F)cc3)cc2)CC1 801689495 MYSDJRKRFGQKRH-QGZVFWFLSA-N 377.337 5.015 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](Nc1cc(C#N)ccn1)CC(C)(C)O2 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CC(C)CCOc1ccc(/C=C/C(=O)c2cc(C(=O)O)ccc2OC(C)C)cc1 1776326954 IZMXWCRCHKNBDS-YRNVUSSQSA-N 396.483 5.493 30 20 GKED C[C@@H]1/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)C(=O)c2c(O)ccc(F)c21 1776586679 MCXFOYRCOVOWLD-RNEAKCBISA-N 388.394 5.280 30 20 GKED C[C@H]1C/C(=C/c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1776589794 YGBWTHXGTBAWDH-PNWWAVQQSA-N 398.458 5.737 30 20 GKED CCCCCCC[C@H](CC(=O)O)NC/C(C)=C\c1ccccc1C(F)(F)F 1776782385 POFOYJHSCHTCMV-BBLCHGJFSA-N 385.470 5.902 30 20 GKED CCSc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776950887 GGRXVGLHZHYHCQ-ACCUITESSA-N 394.517 6.121 30 20 GKED Cc1cccc2c1C(=O)/C(=C/c1cccc(OCc3ccccc3C(=O)O)c1)C2 1777455650 IUSBHZVVVSSGIS-UDWIEESQSA-N 384.431 5.095 30 20 GKED C#CCCC(=O)Nc1ccc(C2(NC(=O)c3cccc4ccccc34)CCC2)cc1 1792263991 QZLZLLFGCDPZEC-UHFFFAOYSA-N 396.490 5.001 30 20 GKED C=CCn1c(SCc2ccc(-c3ccccc3)cc2)nnc1-c1ccncc1 6905115 RBELBGAGPNYGFN-UHFFFAOYSA-N 384.508 5.485 30 20 GKED C=CCn1c(S[C@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1cccc(C)c1 23278402 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158919318 COVDCPQNWILXGB-UHFFFAOYSA-N 390.464 5.355 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc(C(F)F)c3)n2)cc1 171569511 ZGVQLWJCKJJSJI-INIZCTEOSA-N 384.407 5.246 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)cc1 182146287 HGWAHNQOSDEHKL-KRWDZBQOSA-N 397.434 5.202 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccc(N2CCCCCC2)c1 184035425 JOSUTEJRFLTCQR-KRWDZBQOSA-N 378.476 5.002 30 20 GKED Cc1cc(C)c2ncc(C#N)c(NCc3ccc(NC(=O)c4ccco4)cc3)c2c1 301378415 YWXVZRJFAZRJDU-UHFFFAOYSA-N 396.450 5.181 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 303429281 FJNNXHQZGKYDPY-PMACEKPBSA-N 386.417 5.119 30 20 GKED N#Cc1ccc(C(=O)N(c2cccc(Br)c2)C2CCCCC2)cc1 303834167 RMTYSWSCAGEOOF-UHFFFAOYSA-N 383.289 5.300 30 20 GKED Fc1ccc(NCc2ncccc2C(F)(F)F)c(OCCC(F)(F)F)c1 409861707 YRCJAHRNVRRNNK-UHFFFAOYSA-N 382.279 5.183 30 20 GKED C[C@@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)CC(F)(F)F 413988965 ODSPHMYFFRAWFC-CYBMUJFWSA-N 378.419 5.028 30 20 GKED N#Cc1ccc(NC(=O)N2CCSC[C@H]2c2ccc(Cl)cc2)c(Cl)c1 426129233 QRRRAYASEOLJEC-KRWDZBQOSA-N 392.311 5.187 30 20 GKED C=CCC(C)(C)C(=O)N(CC)Cc1ccc(OCc2cccs2)c(OC)c1 429926827 MVXYWSMLDQZJJW-UHFFFAOYSA-N 387.545 5.287 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1OC(F)(F)F)c1ccccc1 431704619 ZDDOENZHIWFKIO-OAHLLOKOSA-N 377.366 5.142 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N(C)c1ccc(C#N)cc1 439929298 WEJDHGKGQJVJGR-UHFFFAOYSA-N 391.474 5.287 30 20 GKED C=CCC[C@H](NC(=O)Nc1nc(COC)cs1)c1ccc(C(F)(F)F)cc1 442211403 XCHLAJIGIZLQAU-HNNXBMFYSA-N 399.438 5.137 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc[nH]1)c1ccc(C(F)(F)F)cc1 442289172 FQLWXZLEYQDOBX-IEBWSBKVSA-N 391.437 5.588 30 20 GKED COc1ccccc1-c1csc([C@@H]2CCCN(CCCCC(C)(C)C#N)C2)n1 447389538 ZEYDXWXOTOEYPN-GOSISDBHSA-N 397.588 5.718 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(C(F)F)c1Cl)c1ccccc1 455169353 ZDDAAOCDSMAZSF-OAHLLOKOSA-N 377.822 5.834 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 460171899 MRGFHVJUWYQRRP-CVEARBPZSA-N 391.323 5.741 30 20 GKED Cc1ccccc1[C@@H]1CN(C(=O)c2ccccc2-c2ccccc2C#N)[C@H](C)CO1 460379081 FQXRSLNIXAFMAQ-CLOONOSVSA-N 396.490 5.136 30 20 GKED C[C@@H](C(=O)N1CCC(c2ccccc2C(F)(F)F)CC1)c1cccc(C#N)c1 462258446 PUTJMHXENXHVIR-OAHLLOKOSA-N 386.417 5.087 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1ccc(Cl)c(F)c1 468266034 INMMCNSLEWBTEK-UHFFFAOYSA-N 395.821 5.028 30 20 GKED Cc1occc1-c1nnc(SCc2ccc(C#N)c(F)c2)n1-c1ccccc1 478517530 BCKQAIYNDIRPOT-UHFFFAOYSA-N 390.443 5.139 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](CC)c1cccc(Cl)c1 478536148 DEYZBQPVQOEQGG-HXUWFJFHSA-N 388.943 5.356 30 20 GKED Cc1cc2c[nH]nc2cc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 479679002 WORUGKQHWZCATL-UHFFFAOYSA-N 384.464 5.147 30 20 GKED C=CCC1(C(=O)NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)CCC1 479781086 NSTOIJGAHYBJBJ-UHFFFAOYSA-N 390.405 5.255 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](C4CC4)C3)cc2Cl)cc1 482951689 CBNVNDQPEZBOOR-INIZCTEOSA-N 381.863 5.268 30 20 GKED Cc1cccn2c(NC(=O)C[C@@H](CC#N)c3ccccc3)c(-c3ccccc3)nc12 483123083 DENNYRJCOAQMJK-OAQYLSRUSA-N 394.478 5.336 30 20 GKED N#C[C@H](C(=O)c1csc(-c2c(F)cccc2F)n1)c1nccc2ccccc12 483191170 BAMPVOXKCWIBJQ-AWEZNQCLSA-N 391.402 5.127 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nccc2ccccc12 483238380 CQBQATKYDKBMPD-GOSISDBHSA-N 382.444 5.346 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 485791745 VBWDBPYGCYTMDR-UHFFFAOYSA-N 378.472 5.273 30 20 GKED COc1ccc([C@H](NCCCC(C)(C)C#N)c2ccc(C(F)(F)F)cc2)cc1 486174208 XAHGWVDRFCASLV-HXUWFJFHSA-N 390.449 5.723 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 487797097 LRRNBNGUMZIHBL-JOCHJYFZSA-N 385.467 5.629 30 20 GKED CC(C)(C#N)CCCSc1nnc(COc2ccccc2)n1-c1ccccc1 488875883 HCDUXPMVSLBAAE-UHFFFAOYSA-N 392.528 5.268 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@@H](C)CC)cc2)nnc1-c1ccccn1 488921912 UONPTNLXJFHNAG-INIZCTEOSA-N 392.528 5.015 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Sc2ccc(C#N)c(C(F)(F)F)c2)c(C)c1 499483668 JDWZHCFTOWVXTC-ZDUSSCGKSA-N 378.419 5.313 30 20 GKED C=CCN(Cc1cc(Br)ccc1F)C(=O)Nc1cc(F)ccc1C 502663669 XMSGZKYAWSKCPV-UHFFFAOYSA-N 395.247 5.256 30 20 GKED Fc1cccc(F)c1[C@@H](NCc1ccc(OCC(F)(F)F)cc1)C(F)(F)F 506277529 PQPMVVFBSAJBEA-OAHLLOKOSA-N 399.281 5.299 30 20 GKED Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1cc(C#N)ccc1Cl 510829762 LAMXFMXKGONDQB-UHFFFAOYSA-N 394.833 5.491 30 20 GKED N#C[C@@H](C(=O)c1ccc(OCc2ccccc2)cc1)c1nc2ccccc2s1 513676501 GGMFWASRCHDOKA-IBGZPJMESA-N 384.460 5.365 30 20 GKED COc1ccccc1CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 515723648 REUQCKWXDYIAGM-UHFFFAOYSA-N 392.842 5.194 30 20 GKED C[C@@H](c1ccccc1)N(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CC1 516820047 QTFFVYQICSGLIQ-KRWDZBQOSA-N 398.466 5.503 30 20 GKED N#CC1(c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)CCCCC1 521315377 KJFUMNLZSYBYOC-UHFFFAOYSA-N 388.349 5.136 30 20 GKED C=CCCCN(C)C(=O)c1cc(-c2ccc(C)s2)nc2c1cnn2C(C)C 522950472 BCSBMGKKVOZGTC-UHFFFAOYSA-N 382.533 5.087 30 20 GKED N#C[C@H](NC(=O)c1ccc(Cl)cc1F)c1ccc(OCc2ccccc2)cc1 524335439 REVMDDSYTLVQLW-NRFANRHFSA-N 394.833 5.053 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(-c4ccccc4)no3)cc2)c1 524390951 MCEIWRDXKREWDZ-UHFFFAOYSA-N 395.418 5.045 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)N[C@@H](CC(F)(F)F)c1ccccc1 524441690 XGTZFDYTFKAKOR-AWEZNQCLSA-N 394.290 5.660 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(NC(=O)c2ccccc2)c1 540705266 MLLVQQSLBQXURL-DLBZAZTESA-N 387.458 5.361 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cccs2)o1)c1nc2cc(Cl)ccc2s1 543057663 LGELBZSZYHOXKA-NSHDSACASA-N 384.869 5.761 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(Cl)cc2Cl)cc1)c1ccncn1 544815862 FCWROIVVPBSFLB-HNNXBMFYSA-N 384.222 5.066 30 20 GKED C[C@@H](c1ccncc1)c1noc(-c2ccc(Oc3cccc(F)c3C#N)cc2)n1 545097913 PYKBOMIAFVHJMU-AWEZNQCLSA-N 386.386 5.086 30 20 GKED CC(C)(CCC#N)CNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1 554365049 XWESYFCPTNYMHH-UHFFFAOYSA-N 396.438 5.280 30 20 GKED CC(C)(CCC#N)CNC(=O)C1(c2cccc(Br)c2)CCCCC1 558289846 QQBUUTPVBUONAC-UHFFFAOYSA-N 391.353 5.097 30 20 GKED C=CCC[C@H](NCc1cnc(C(C)(C)C)nc1)c1ccc(C(F)(F)F)cc1 560258663 RNWZMISWVRYEQA-SFHVURJKSA-N 377.454 5.590 30 20 GKED Cc1cc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc(C)c1Cl 561136669 OXPGEDHSMVXUJV-OAHLLOKOSA-N 388.920 5.369 30 20 GKED C[C@H](NC(=O)N1CCC(CCC#N)CC1)c1ccc(-c2cccc(C#N)c2)cc1 569839810 LDYIDIXQOUOUTL-SFHVURJKSA-N 386.499 5.012 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(F)cc2)c(C(F)(F)F)c1 570015557 WROGJFVHWSUOFS-INIZCTEOSA-N 390.302 5.499 30 20 GKED CC[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1OC(F)F 575034161 YHVRFQCCMRQONU-INIZCTEOSA-N 384.348 5.419 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 577895387 HHZNCMPOYFHWKB-RBZFPXEDSA-N 398.293 5.101 30 20 GKED CC(C)(c1noc(C[C@@H](CC#N)c2ccccc2)n1)c1cccc2ccccc12 581325283 QGDADZHVUCCKCU-HXUWFJFHSA-N 381.479 5.789 30 20 GKED N#Cc1ccc(CN2CCC[C@@H](c3nc4ccccc4o3)C2)c(C(F)(F)F)c1 589494116 DXAFJBXBFXFLBP-MRXNPFEDSA-N 385.389 5.098 30 20 GKED COc1ccccc1-c1csc(C2CCN([C@@H](C#N)c3ccccc3)CC2)n1 595463084 ZIYDNXSEKFIBIN-NRFANRHFSA-N 389.524 5.263 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)CCCSCC1(CC#N)CC1 596355296 VDBCRVLRTAQFCL-UHFFFAOYSA-N 395.366 5.212 30 20 GKED CC(C)c1cc(Cl)ccc1NC(=O)CCC(=O)N(CCC#N)c1ccccc1 600367847 DPAFRMBYTIMMSC-UHFFFAOYSA-N 397.906 5.129 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1nc2ccccc2n1C(F)F 603656447 WVHATFNDFVJQFS-CYBMUJFWSA-N 397.429 5.115 30 20 GKED N#Cc1c(NC(=O)Cc2c[nH]c3ccccc23)sc2c1-c1ccccc1CC2 603991601 NNPQGXNFJLYKGD-UHFFFAOYSA-N 383.476 5.048 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)c1occc1COc1cccc(C#N)c1 608802960 RNJZGCOVUUBCAD-UHFFFAOYSA-N 388.467 5.091 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(F)c(Cl)c1 609370716 QXOWPCUDBADDOW-LBPRGKRZSA-N 394.924 5.604 30 20 GKED Cc1occc1-c1nnc(S[C@H](C#N)C2CCCCC2)n1Cc1ccccc1 609648710 RIYOUOAQMCHQNG-HXUWFJFHSA-N 392.528 5.459 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 610225653 VIBUALKXTMPFJZ-HZPDHXFCSA-N 375.255 5.006 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCCc2nc(-c3ccccc3F)sc21 618805412 HITAGMJLBPPGMU-UXHICEINSA-N 389.499 5.475 30 20 GKED C=CCCC1(CNCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)CCCC1 657567561 UFGAFNFBNWUXGW-UHFFFAOYSA-N 397.588 5.752 30 20 GKED C[C@H](OC(=O)c1occc1COc1cccc(C#N)c1)c1cnc2ccccc2c1 726736407 YIAYYSBYTNAQCO-INIZCTEOSA-N 398.418 5.196 30 20 GKED O=C(/C=C\c1ccccc1-n1cncn1)c1ccc(SC2CCCC2)cc1 726744233 XZLSBVXUADKEIU-KAMYIIQDSA-N 375.497 5.198 30 20 GKED CC(=NNc1ncccc1Cl)c1sc(-c2ccc(Cl)cc2)nc1C 727651107 IEVMMCUPEYAYDY-UHFFFAOYSA-N 377.300 5.656 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)c(Cl)c1OC 730434774 SQIIZQLOILJFDH-WQLSENKSSA-N 385.891 5.244 30 20 GKED CC(=NNc1ccc(Br)cc1C(F)(F)F)c1csc(C)n1 731487148 LPKOGENZLSXKRC-UHFFFAOYSA-N 378.217 5.069 30 20 GKED CC(C)c1ocnc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 731987994 ZIAASUCLVHTUME-UHFFFAOYSA-N 395.846 5.154 30 20 GKED C=CC[C@@H](NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1ccncc1 734235625 KZTAKGJICOESDM-DANOYGIBSA-N 380.797 5.201 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1scnc1Cl 741919310 DDTBNMGYALZNDZ-UHFFFAOYSA-N 388.279 5.169 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CCC#N)CC(F)(F)F)c3ccccc3n2)cc1 746438667 WGYPRTBGYKQYIN-UHFFFAOYSA-N 397.400 5.128 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccccc1OC(F)F 753389079 AJWFPVXWIDBCSY-VSOYFRJCSA-N 378.378 5.116 30 20 GKED CC(C)(C)O[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1 754530258 DXBXCMRKBSLKHL-BEFAXECRSA-N 398.915 5.682 30 20 GKED Cc1sc2ncn(N=Cc3ccc(F)c(Cl)c3)c(=O)c2c1-c1ccccc1 755535384 YEJIAXJDDQRUAF-UHFFFAOYSA-N 397.862 5.108 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 761535491 UFZVSYCOSDFDAX-VWNXMTODSA-N 382.463 5.019 30 20 GKED C=CC[C@H](N[C@@H]1CCCc2nc(-c3ccc(C)cc3)sc21)c1ccncc1 766018889 JLDXETMKRQHZHZ-VQTJNVASSA-N 375.541 5.798 30 20 GKED CC[C@@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccc(OC)cc1 775658336 NBWNIXFPTKAUFX-RPWUZVMVSA-N 384.479 5.483 30 20 GKED C#CCCCCC(=O)N[C@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 779062231 UKZSXOJSRHEQNR-NRFANRHFSA-N 389.417 5.113 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1cnc(-c2ccco2)s1 789126958 GNHQOOTZARULJI-GNESMGCMSA-N 378.409 5.141 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1nccc2ccccc12 792090293 DJFATLCALAVCSJ-KRWDZBQOSA-N 383.278 5.741 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=S)Nc1ccc2ccccc2c1 795141165 WRZWVZCPFLQJGO-UHFFFAOYSA-N 378.545 5.392 30 20 GKED Cc1ccc2c(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)csc2c1 796637289 VEKYWPBRYKBAHL-GOSISDBHSA-N 384.460 5.324 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)[C@H]2CC=CC[C@@H]2c2nc3ccccc3s2)CC1 809089442 CWLJSSRCKHJKEK-MHORFTMASA-N 380.513 5.219 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 810537249 QMZALCIANNZULC-ZDUSSCGKSA-N 394.443 5.494 30 20 GKED C#CCO[C@H](C)C(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 839214291 RVGIVMGJXOBNHE-MRXNPFEDSA-N 378.497 5.123 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)c(Cl)c1)c1nc(C2CC2)cs1 842942838 QVJPWSSUILACTE-CYBMUJFWSA-N 379.312 5.526 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@H]1CC[C@H](C2CCC2)CC1 850760987 YQKNHTIXOUYFLT-NJDAHSKKSA-N 380.532 5.065 30 20 GKED O=[N+]([O-])c1cc(C(F)F)ccc1N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 853226734 GEIMXFDGICUFKE-DTORHVGOSA-N 392.246 5.100 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(F)cc2C(F)(F)F)c1 858379084 VLUJDJVQFZTWAP-XJKSGUPXSA-N 380.385 5.376 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc3c(Cl)nccc3o2)ccc1OC 866297366 VBVLLZCGFVRIBT-ZFWWWQNUSA-N 399.878 5.022 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(N=Cc2cc(Cl)cc([N+](=O)[O-])c2O)cc1 915113227 RQOQGADAIVFITQ-IBGZPJMESA-N 391.814 5.360 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)cc1 916908717 NUOFBTLITFNQIJ-OAQYLSRUSA-N 398.462 5.068 30 20 GKED C=CCN(Cc1ccccc1F)Cn1nc(NC2CCCCC2)sc1=S 918181586 KPZTVVXJUXHFIV-UHFFFAOYSA-N 392.569 5.203 30 20 GKED Cc1nn(C)c(C)c1C(=O)/C=C\c1cccc(OCc2ccccc2Cl)c1 920832494 MIINMLNNJPHVKI-QXMHVHEDSA-N 380.875 5.165 30 20 GKED O=C(/C=C/c1cc(C(=O)O)c(Cl)s1)c1ccc(OCc2ccccc2)cc1 1776127636 YZQOFQQWPZRXQX-ZHACJKMWSA-N 398.867 5.575 30 20 GKED CC(C)c1cccc2c1OC/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1776377847 KQXOWIAQTZBLDA-ATVHPVEESA-N 388.419 5.427 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(C)cc(Br)c1F 1776783956 MPPJGQCSPNUDGE-HNNXBMFYSA-N 388.321 5.190 30 20 GKED CCCCCCCOc1ccc(CNCc2ccc(CCC(=O)O)cc2)cc1 1776787133 XHYSSYAUSCQNLE-UHFFFAOYSA-N 383.532 5.343 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(N2CCCCC2)cc1 18115291 IGARLPHFQCUOMW-UHFFFAOYSA-N 381.479 5.468 30 20 GKED CCOc1ccc(C(C)=O)cc1CSc1nc(C)cc(C(F)(F)F)c1C#N 24284226 JPJMQRJJOMOBFM-UHFFFAOYSA-N 394.418 5.174 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc(Br)ccc2Cl)cc1 25438254 OBZKAFKCEZPDSD-UHFFFAOYSA-N 377.669 5.156 30 20 GKED CC(C)=CC(=O)Nc1scc(-c2ccccc2)c1C(=O)OCCCCC#N 26483075 CNBDMVLORMDDSP-UHFFFAOYSA-N 382.485 5.170 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1ccc(OC)c(F)c1 45103597 JKOIIOCCVQOYKE-LBPRGKRZSA-N 382.888 5.008 30 20 GKED CC(=O)c1cccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 45826953 DLWYRQJPJABWDG-UHFFFAOYSA-N 386.476 5.305 30 20 GKED C=CCCC(=O)N(c1nc(-c2ccc(C)cc2)cs1)c1cc(C)ccc1C 60364734 FXLZUJHNVJCERS-UHFFFAOYSA-N 376.525 6.366 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1ccc(CSc2ccccc2)cc1 60852342 OSVVISBDHHHKQD-UHFFFAOYSA-N 376.481 5.128 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1cc2c(ccc3ccccc32)[nH]1 63250615 CBSAFJQJDCPCHK-UHFFFAOYSA-N 385.423 5.058 30 20 GKED C[C@H](C#N)CSc1ccccc1NS(=O)(=O)/C=C/c1ccc(Cl)cc1 108252209 WLQFYWCNWNHGEB-PLSXKVAHSA-N 392.933 5.004 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3ccccc3SC[C@H](C)C#N)o2)cc1 108408482 XDKRVESTFSUKDY-CVEARBPZSA-N 378.501 5.470 30 20 GKED N#Cc1ccc(NC(=O)c2oc3ccccc3c2CSc2cccs2)nc1 110287114 QSLKYTAEPXYLDX-UHFFFAOYSA-N 391.477 5.306 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCc2ccccc2C1 114580470 UYOVFAKCFVNQJD-APWZRJJASA-N 379.529 5.102 30 20 GKED COCc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)o1 123754166 OPXLWMTZKIPVBD-YJBOKZPZSA-N 399.516 5.189 30 20 GKED CCCCSCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 124414076 VLFHZPAURFHUIT-LBPRGKRZSA-N 380.485 5.188 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1)CC(F)F 130081539 DCWXVXBIYPGUHX-OAHLLOKOSA-N 389.471 5.380 30 20 GKED C=C[C@@H](CC(=O)N[C@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 153199381 OJEQBXDSVVWKOQ-CTNGQTDRSA-N 386.495 5.198 30 20 GKED N#CCC[C@@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccccc1 153236364 PXESTAZDYROHEF-GOSISDBHSA-N 377.513 5.170 30 20 GKED N#CCCCCNC(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 170885578 RXHOHQDYBDCTTR-UHFFFAOYSA-N 376.287 5.076 30 20 GKED C[C@H](Sc1ccccc1C#N)c1nc2scc(-c3cccs3)c2c(=O)[nH]1 173720943 YTDPAHBXADYOMT-NSHDSACASA-N 395.534 5.438 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc2ccccc2c1 175947431 VRKBTBQFUDSPQQ-RDTXWAMCSA-N 389.405 5.565 30 20 GKED C[C@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccc(C#N)c1 184605121 RAZWJPOREFKIPL-IFXJQAMLSA-N 377.488 5.549 30 20 GKED N#Cc1ccc(Oc2nc(-c3cccnc3)nc3sc4c(c23)CCC4)c(F)c1 301675160 BWMQPDLGDHDCEI-UHFFFAOYSA-N 388.427 5.045 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(N3CCCCC3)c(F)c2)cc1 303205234 MXHFQTKHAWEOON-CRVDFBCUSA-N 378.447 5.003 30 20 GKED C[C@@H]1C[C@H](/C(O)=N/[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)CCC1=O 328962321 QPGGSLPCENGLEC-XNRPHZJLSA-N 386.492 5.288 30 20 GKED C[C@@H](OC1CCCCCC1)/C(O)=N/Cc1nc2cc(Br)ccc2o1 329204163 XLQQYNFNFKCFQR-GFCCVEGCSA-N 395.297 5.175 30 20 GKED CC(C)c1nc([C@H]2CCCCN2CC(O)=Nc2ccc(Cl)cc2Cl)n[nH]1 329833054 KOEZHGZHYQCPCM-OAHLLOKOSA-N 396.322 5.050 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2C#N)CC[C@H]1C 410983738 KOHLAEFYTQSDNE-ZJUUUORDSA-N 389.864 5.119 30 20 GKED CC(C)C1(c2ccccc2)CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 416802000 APTHDYZFQAWTDT-GOSISDBHSA-N 393.556 5.522 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 428903621 ZYABTLPZJALZKV-UHFFFAOYSA-N 396.447 5.181 30 20 GKED N#Cc1ccc(SCc2ncc(Br)s2)cc1C(F)(F)F 432494491 OHWQCMYSELFEHQ-UHFFFAOYSA-N 379.226 5.088 30 20 GKED COc1c(Cl)cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)cc1Cl 439373048 SXIQZQMIDPSBOA-INIZCTEOSA-N 378.259 5.169 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2Sc2ccccc2[N+](=O)[O-])n1 442028649 KGGOZJNMJFILSJ-AWEZNQCLSA-N 395.465 5.001 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)NCC1CCC(C#N)CC1)C1CC1 442742116 WWQXYBYKEUMFSM-QQFBHYJXSA-N 393.453 5.270 30 20 GKED N#Cc1ccc(NC(=O)c2cnc(-c3ccsc3)s2)cc1C(F)(F)F 443884848 YHNZHRMHZZPFAS-UHFFFAOYSA-N 379.388 5.014 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 444823232 DIHNNAYQJIJJBV-FQEVSTJZSA-N 391.515 5.232 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1c1ccccc1Cl)c1ccccc1 458798386 HZUYFYAAJQQDQR-SFTDATJTSA-N 381.907 5.622 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1ccc(Cl)cc1 461109153 CTLFTVYTVOMQEV-ZACQAIPSSA-N 379.674 5.131 30 20 GKED COc1cc(-c2noc([C@H](C)c3cccc(C#N)c3)n2)cc(Cl)c1OC(C)C 462828316 ZUXSZYRNGKDRTM-CYBMUJFWSA-N 397.862 5.209 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc(-c4cscn4)c3)cc2)cc1 463666348 URBKTFPWGWYRRG-UHFFFAOYSA-N 397.459 5.726 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Oc2ccccc2)ccn1 465127214 LBIXMWAUUONAMI-INIZCTEOSA-N 389.480 5.520 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccccc3SC[C@H](C)C#N)c[nH]c2c1 465129046 RPKDBNTXDMMAPA-MRXNPFEDSA-N 377.513 5.299 30 20 GKED CC[C@@H]1CN(C(=O)CCCCOc2cccc(C#N)c2)CC[C@H]1c1ccccc1 470014235 WYHWYXJHKRKFED-ZJSXRUAMSA-N 390.527 5.150 30 20 GKED CCOc1ccc(-c2nc(C)c(C(=O)N(CCC#N)C(C)(C)CC)s2)cc1 471164227 FBQGYUOQIMIIOH-UHFFFAOYSA-N 385.533 5.062 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(Br)cc3ccccc23)n1 474425618 IEJCDDQWRDFNQR-MRXNPFEDSA-N 399.313 5.672 30 20 GKED Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1ccc(C(C)(C)C#N)cc1 475600032 JDAGJSOHZYBCMD-JOCHJYFZSA-N 398.510 5.171 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](C(F)(F)F)[C@H]1C 480541380 POEQMCYFOTZKAL-MCIONIFRSA-N 385.455 5.133 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cc2c(cc1Cl)OCCCO2 484989644 QZXNIBMKBIUDBR-UHFFFAOYSA-N 378.900 5.102 30 20 GKED CCCCn1ncc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1C(C)C 485157294 DXMODLOTUGDFSY-UHFFFAOYSA-N 381.524 5.121 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@H](c1ccccc1)C(F)(F)F 485595646 ADUDUODAXFVAOM-OAQYLSRUSA-N 394.396 5.301 30 20 GKED Cc1cc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)o1 487331529 GGYMEUPYJVNWFL-UHFFFAOYSA-N 380.831 5.253 30 20 GKED C=CC[C@@H](C(=O)Nc1ccc(C(=O)N2CCC[C@H](C)C2)cc1C)c1ccccc1 488709302 BOOOXLVBNBWWDR-PGRDOPGGSA-N 390.527 5.166 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(N2CCSCC2)cc1C)c1ccccc1 488716730 RJGVUDGKKFCPRS-NRFANRHFSA-N 380.557 5.237 30 20 GKED CC(C)(C#N)CC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 497101954 ZNXBHUQLNXKIOT-UHFFFAOYSA-N 376.378 5.163 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 497393309 XMHHFRMHIDKECI-VKAVYKQESA-N 399.494 5.326 30 20 GKED CCCc1c(N[C@@H](C)c2cnn(C3CCCC3)c2)cnn1-c1cccc(C#N)c1 502439314 WEMOPTFGIRLDBH-KRWDZBQOSA-N 388.519 5.181 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1 505036367 WECNXDCHCRVOPU-JOCHJYFZSA-N 391.902 5.765 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 507874987 SFWYAJHEERNEGU-UHFFFAOYSA-N 390.464 5.322 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510022096 BLRSCPDAHBPPQY-ICSRJNTNSA-N 381.907 5.792 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)c1 511188239 ULNQUPGOQCCVRF-UHFFFAOYSA-N 398.796 5.321 30 20 GKED CC(C)(CCC#N)CNC(=O)N(Cc1ccccc1C(F)(F)F)C1CCCC1 513124344 RADVBKUSTQBXRF-UHFFFAOYSA-N 395.469 5.490 30 20 GKED CC(C)[C@@H](NS(=O)(=O)CCCCC#N)c1ccc(C2CCCCC2)cc1 517582403 RJTANTBTYAUWDX-OAQYLSRUSA-N 376.566 5.045 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](c1ccc(Cl)cc1)C1CC1 520133210 SFGYWNKIXHYAAJ-FQEVSTJZSA-N 399.878 5.097 30 20 GKED CC(C)[C@@H](NCc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 521833252 ZFLBZOGCEGAHIQ-OAQYLSRUSA-N 390.449 5.875 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N[C@H]3CSc4ccccc43)cc2)cc1 524002854 ATOXEOVYPVMYFD-NRFANRHFSA-N 386.476 5.122 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N(CCCC)[C@@H](CC)c2ccccc2)cc1 524482358 OOPVJNIUDAVJHY-QFIPXVFZSA-N 393.531 5.388 30 20 GKED C=CC1CCN(C(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)CC1 524629165 QLTDOBJDTBSENW-UHFFFAOYSA-N 378.847 5.424 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(Sc2ccccc2)CC1 524634573 NAPOWIMOQVPFOV-MRXNPFEDSA-N 397.569 5.385 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ccc(OC(F)(F)F)cc1 534630562 ABONHXAEMPDFDC-LBPRGKRZSA-N 395.406 5.623 30 20 GKED C=C[C@H](CC(=O)NCCc1ccc(-c2csc(C)n2)s1)c1ccccc1 536166099 SUCKMAUWIUDIBD-MRXNPFEDSA-N 382.554 5.199 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccccc2C(C)(C)C#N)cc1 539359691 ZZCFFLHBDMEQTL-IBGZPJMESA-N 384.523 6.014 30 20 GKED Cc1ccc(-c2c(C(C)(C)C)c(CC#N)nc3sc4c(c23)CCOC4)cc1 541589109 WOWAXJBJZJNFAI-UHFFFAOYSA-N 376.525 5.708 30 20 GKED Cc1oc(-c2ccsc2)nc1CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542013939 QISNNWGQADDJLJ-INIZCTEOSA-N 399.519 6.101 30 20 GKED C[C@@H](NCc1nc(-c2ccsc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 543873267 SFKVGERJQAHOHS-OAHLLOKOSA-N 386.480 5.188 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 597036969 HAYXQGQBABNDOH-CQSZACIVSA-N 398.322 5.034 30 20 GKED COc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c(F)c1 603759215 YHGNPTHXPWVFDX-IBGZPJMESA-N 394.833 5.395 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)oc2c(F)cccc12 603764755 LLLZHFWIYFLCPV-UHFFFAOYSA-N 387.370 5.192 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603831076 JDEUNVRKZKJOGE-QFIPXVFZSA-N 398.466 5.423 30 20 GKED CC(C)=C[C@@H]1[C@@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1(C)C 604003411 ABKIPROAUYSJLC-GGAORHGYSA-N 388.511 5.509 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cccc(C(=O)N(C)CC(C)(C)C)c1 607499757 ABVCFBMXTWLCSW-UHFFFAOYSA-N 384.564 5.013 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccc(-c4cnco4)cc3)c2)cc1 609176754 XPOUFWSNRQDHAY-UHFFFAOYSA-N 381.391 5.258 30 20 GKED N#Cc1ccc(NC(=O)[C@H](Sc2ccc(F)c(F)c2)c2ccccc2)cc1 609261227 CBJFHUCSPRSXEV-HXUWFJFHSA-N 380.419 5.309 30 20 GKED COc1cc(CSc2nccn2C(C)C)ccc1OCc1cccc(C#N)c1 609721962 KIYQVCIOGKALHI-UHFFFAOYSA-N 393.512 5.216 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1 610023538 JFIMAESDCMEPDN-IBGZPJMESA-N 387.405 5.014 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)N(Cc1cccs1)Cc1cccs1 618840765 KZGYPHDRKBLZQC-HXUWFJFHSA-N 393.537 5.081 30 20 GKED C[C@H](Oc1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cn1)c1ccccc1 647377287 ATSSZLBCIGTJJS-KBXCAEBGSA-N 389.480 5.046 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2cc1OC(F)F)c1ccc2ccccc2n1 677790789 DBHSYYZGSVYFBQ-SFHVURJKSA-N 388.373 5.479 30 20 GKED N#C[C@H](C(=O)c1csc(Cl)c1)c1nc2cc(C(F)(F)F)ccc2s1 682436977 SPGURJKKXTYZTF-SECBINFHSA-N 386.807 5.520 30 20 GKED CCCCCCCCC/C=C/C(=O)N1CCC(C(=O)N2CCC[C@@H](C)C2)CC1 727756167 RKACQHLDCZSEMY-QGFLDLQWSA-N 390.612 5.180 30 20 GKED O=C1/C(=C/c2ccc(OCc3ccncc3)cc2)CCOc2c(Cl)cccc21 733749216 SOJIYQBRAYNYLL-NBVRZTHBSA-N 391.854 5.363 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)C2CCC(C(C)(C)C)CC2)c1 733851600 DUSYRTLNRQDXPN-SOAGJPPSSA-N 385.552 5.114 30 20 GKED COc1ccc(Cl)cc1[C@@H](CC(C)C)NCc1ccc(N(C)CCC#N)cc1 738440690 XEDBHYZZULBZFL-JOCHJYFZSA-N 399.966 5.575 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1ccc([N+](=O)[O-])cc1 740763959 JUZBUJKCCYZZJI-QXMHVHEDSA-N 395.846 5.006 30 20 GKED Cc1csc(SCc2ccccc2C(=O)N[C@H](C)c2cccc(C#N)c2)n1 743775476 NQLWPQKOQQEBPL-OAHLLOKOSA-N 393.537 5.107 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c1 744038302 PUJFOYQNNZSBKL-INIZCTEOSA-N 396.441 5.075 30 20 GKED CC(C)Oc1ccccc1C=NO[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1 747827997 SZSLVXIRSVYKDK-AWEZNQCLSA-N 385.851 5.289 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)CCCCc1ccc(Cl)c(Cl)c1 753117633 PTVWATQDGBPNQX-UHFFFAOYSA-N 395.261 5.386 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1OC(F)F 753390114 JPTLMWQORWVSQR-WONIAPNHSA-N 384.407 5.177 30 20 GKED CC(C)CN(CCC#N)CC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 755671465 LIOABVHNYGALAU-UHFFFAOYSA-N 397.133 5.110 30 20 GKED C=CCn1c(-c2cccs2)nn(CN(C)Cc2ccc(Cl)s2)c1=S 764862052 ZEHQXAPVRQUXBL-UHFFFAOYSA-N 396.994 5.133 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2CC[C@@H]2c2cccc(F)c2)c1=S 765037274 HMZCDFBKXFGMOZ-HXUWFJFHSA-N 394.519 5.119 30 20 GKED CC(C)(C)[C@@H](C#N)OC(=O)c1cccc(Oc2ccc(Cl)c(Cl)c2)n1 765631020 IDYQQAYWHXMWJF-OAHLLOKOSA-N 379.243 5.276 30 20 GKED N#C[C@@H](C(=O)[C@H](c1ccccc1)C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 765916487 SEBIAHNYCZLSSG-AZUAARDMSA-N 392.911 5.834 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)Cc1ccccc1CC#N)C1CC1 776801912 GFWVKIABOZUCLW-HNNXBMFYSA-N 386.417 5.066 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc([C@H]3CCCOC3)cc2)cc1 779836210 AFRIGVLMMXLKEI-ZCYQVOJMSA-N 396.490 5.488 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OC(=O)C[C@H](CC#N)c3ccccc3)cc2)cc1 793352382 MQFXWQKIONQNPZ-NRFANRHFSA-N 398.462 5.240 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1cccc(OC(F)(F)F)c1 794994307 GGEOMSASUGXKGT-UHFFFAOYSA-N 380.435 5.360 30 20 GKED CC(C)c1ccc2occ(C(=O)[C@H](C#N)C(=O)Nc3ccccc3Cl)c2c1 805856552 XRLXDOFYEXPCDA-HNNXBMFYSA-N 380.831 5.171 30 20 GKED CSc1ccc(CCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 842804392 YWRAISRFNPKJCA-INIZCTEOSA-N 378.419 5.021 30 20 GKED N#C[C@H](C(=O)CCCn1ccc2cc(Cl)ccc21)c1nc(C2CC2)cs1 842941074 MXNMAFFDNWCCAV-MRXNPFEDSA-N 383.904 5.285 30 20 GKED C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F 847433397 BSJAZOGOWCJLNN-YWZLYKJASA-N 386.417 5.119 30 20 GKED C[C@@H](c1cccs1)N1C(=O)/C(=C\c2ccc(C3(C#N)CC3)cc2)SC1=S 849173057 BNQZSSWDJGMCAO-HNEYUBDGSA-N 396.562 5.266 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)N(O)Cc2cccc3ccccc23)c1 901371749 WNVHFOYBLYINFB-UHFFFAOYSA-N 392.455 5.218 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3ccccc3)CC2)cc1 915352132 FLISVGKIRPFWTC-QHCPKHFHSA-N 381.479 5.195 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3ccc(F)cc3s2)cc1 916955268 NVQQUTYBFVFJQB-ACJLOTCBSA-N 394.471 5.515 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccccc1 917043758 OLHDIEGFGUWOHP-SWLSCSKDSA-N 388.414 5.685 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(C(F)(F)F)c(Cl)c2Cl)c1 1776037923 JVECLPMWPQJWOJ-UHFFFAOYSA-N 377.149 5.156 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(-c2cccc(Cl)c2)s1 1776049882 TZOOKWBBHHBFLG-UHFFFAOYSA-N 386.860 5.221 30 20 GKED COc1cc(NN=Cc2ccc(-c3cccc(C(=O)O)c3)s2)ccc1Cl 1776056774 ONDKSYWEPHZHQJ-UHFFFAOYSA-N 386.860 5.221 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2csc(-c3ccc(C(C)C)cc3)n2)CC1 1776164463 NZPILCDFYNBCAN-UHFFFAOYSA-N 384.545 5.176 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)c1 1776341519 XDZWXHGEIDOVSB-JXMROGBWSA-N 390.435 5.445 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Br)c(Cl)c1 1776782741 DFGXTAXNGOFURM-CQSZACIVSA-N 390.749 5.396 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(C)cc(Br)cc1C 1776783023 CZAWCNUURUXMLA-QGZVFWFLSA-N 384.358 5.359 30 20 GKED CCCCCCCCCCCCC(C)(C)C(=O)N1CCC2(CC1)C[C@H]2C(=O)O 1776785267 MOLBVTKXXDHRJP-FQEVSTJZSA-N 393.612 6.037 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776805994 PHHFXNRQZYEEQT-WYMLVPIESA-N 390.504 6.352 30 20 GKED CC(C)(C)c1ccc(-c2nnc(SCCOc3ccc(C#N)cc3)o2)cc1 22250477 KVQPWGHPPCOWFP-UHFFFAOYSA-N 379.485 5.077 30 20 GKED CCN/C(S)=C(/C(=O)c1cc(C)c(C)c(C)c1C)[n+]1ccc(C(C)(C)C)cc1 27056580 XLHLWXDOEOESRL-UHFFFAOYSA-O 397.608 5.054 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 32289676 QAIUNYCXLIXGRZ-UHFFFAOYSA-N 381.435 5.179 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CCC(COc2ccccc2)CC1 65675896 XJOURISTNWVMPQ-UHFFFAOYSA-N 396.490 5.156 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1csc(C2CCCC2)n1 105635396 NNWNCKIHOSLQSN-UHFFFAOYSA-N 391.949 5.198 30 20 GKED Cc1noc(C)c1[C@H](C)NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 116646259 IEBBDZKMHIWDKM-LBPRGKRZSA-N 395.846 5.100 30 20 GKED Cc1cc(F)ccc1-c1ccc(C(=O)Nc2ccc(F)cc2OCC#N)cc1F 120452668 QTYLLHLAEVRRRB-UHFFFAOYSA-N 396.368 5.234 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc(Cl)cc(Cl)c1 128675068 BWUYQOTUJHMDRQ-QGZVFWFLSA-N 383.234 5.108 30 20 GKED CCc1ncsc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 137377960 YQBHJGBLHSQIRN-INIZCTEOSA-N 381.888 5.267 30 20 GKED Cc1c(NCc2ccc(-c3ccccc3C#N)cc2)cccc1N1CCOC1=O 174905420 OYJCRDSAUAFCBI-UHFFFAOYSA-N 383.451 5.102 30 20 GKED Cc1cc(CSc2ccccc2C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)on1 177753833 OHUAMWUWYKOUPH-MRXNPFEDSA-N 397.525 5.345 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(S(=O)(=O)C2CCCC2)cc1 181575679 MEJIOAJQAGRVGP-MBSDFSHPSA-N 396.556 5.099 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCOC1)c1ccccc1 188774166 ZCUCRDSCYWKJQQ-QFBILLFUSA-N 385.891 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC[C@@H]1Cc2ccccc2NC1=O 189881733 FPTIFQPKSVAAQT-LJQANCHMSA-N 376.500 5.068 30 20 GKED C=CCn1c(SCCCC(=O)c2ccccc2)nnc1-c1ccccc1F 195569647 MMLZQBJLDFZYNR-UHFFFAOYSA-N 381.476 5.025 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 303424952 DLJJEYCAEANOKM-PMACEKPBSA-N 389.417 5.032 30 20 GKED Cc1ccc(C(F)(F)F)cc1N=C(O)c1sc([C@@H]2CCCOC2)nc1C 328880023 LQTDPAFVYZQJFA-GFCCVEGCSA-N 384.423 5.309 30 20 GKED O=C(Nc1ccc(SC2CCCC2)cc1)C1CCC(/N=C(/O)C2CC2)CC1 329983062 AUHGPIPHMLGXGL-UHFFFAOYSA-N 386.561 5.585 30 20 GKED O/C(=N\C1CCC(/C(O)=N\Cc2nc3cc(Cl)ccc3s2)CC1)C1CC1 330023999 JKZMSEPNIPWSGB-UHFFFAOYSA-N 391.924 5.332 30 20 GKED Cc1ccc(N=C(O)c2sc([C@@H]3CCCOC3)nc2C)cc1C(F)(F)F 330323986 TYHKEIUCYXGDGM-GFCCVEGCSA-N 384.423 5.309 30 20 GKED CC[C@@H]1C[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 421044504 IBZYIZSNKPFCHF-NLWGTHIKSA-N 397.906 5.075 30 20 GKED Cc1oc2ccc(NC(=O)c3cnn(CCC#N)c3-c3ccccc3)cc2c1C 429088251 QVOPIISTAYEPQZ-UHFFFAOYSA-N 384.439 5.079 30 20 GKED C[C@@H](NC(=O)Nc1cnn([C@H](C)C2CC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 429663908 VFZTZKSZUXKOLD-IAGOWNOFSA-N 399.498 5.275 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)N[C@@H](c1cc(F)ccc1F)C(F)F 433009980 ATYFEUOIJTWOBJ-AWEZNQCLSA-N 394.290 5.198 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccccc2N2CCCCC2)c2ccccc21 434717094 GVPNQKGNHGCOED-UHFFFAOYSA-N 386.499 5.188 30 20 GKED Cc1cc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)ccc1Br 437658013 WXAPFVDFSPSIJF-IEBWSBKVSA-N 398.304 5.061 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc2oc(C3CC3)nc2c1 437927374 PJCQSSYTLWEMFP-QUCCMNQESA-N 386.455 5.009 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(C(=O)c2ccccc2)c1)c1ccccc1 439387456 OVZYEDZHGSIORA-JOCHJYFZSA-N 383.451 5.084 30 20 GKED Fc1ccc([C@H](NCc2nc(C(F)(F)F)cs2)C(F)(F)F)cc1Cl 444812506 NMPAYHPKVNMTDG-NSHDSACASA-N 392.727 5.348 30 20 GKED C=C(C)Cn1c([C@H]2CCCO2)nnc1N1CCCC[C@H]1c1ccc(Cl)cc1 453447391 AXSAIMYLILNLPH-RBUKOAKNSA-N 386.927 5.091 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1 458832401 HTHXHXCVORYACT-PTUXOGIPSA-N 375.516 5.399 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ncsc1C(C)C 463710963 PIEPTQJQTHEDME-UHFFFAOYSA-N 391.496 5.278 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(F)(F)F)cc2)ccn1 464667952 KVUATOAXYVPPTM-ROUUACIJSA-N 389.377 5.053 30 20 GKED N#Cc1ccc(C(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)cc1 469899741 SWXFQJBSEHGCRC-UHFFFAOYSA-N 384.222 5.305 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4sccc4c3)n2)cc1 473152490 PAKFIMDVXRRGJF-QGZVFWFLSA-N 385.473 5.387 30 20 GKED O=C(Nc1cc(F)cc(NCC(F)(F)F)c1)[C@@H]1CCCC[C@H]1C(F)(F)F 473254847 KKJKOOYJDYFWPM-CHWSQXEVSA-N 386.311 5.107 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H]2CCCc3nc(CC)sc32)c1 478643703 CHVZATGSXYGGRO-GOSISDBHSA-N 385.533 5.202 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)s1 487490863 ZJPFREUJSTZWQS-UHFFFAOYSA-N 390.251 5.366 30 20 GKED CC(=O)N(c1nc(CSc2ccc(C#N)cn2)cs1)c1ccc(C)cc1C 495278797 VYYSDNQCWUYKMU-UHFFFAOYSA-N 394.525 5.004 30 20 GKED CC(C)Sc1ccccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 502658318 IUHXQBMLIZQZCZ-UHFFFAOYSA-N 377.513 5.380 30 20 GKED C=CCn1c(SCc2cc(Cl)cc3cccnc23)nnc1-c1cccnc1 505832392 MVVDYONTNZMTRU-UHFFFAOYSA-N 393.903 5.020 30 20 GKED Fc1cccc(F)c1[C@H](NCc1cccc(OCC(F)(F)F)c1)C(F)(F)F 506268262 IEJUMWSNNMMZKA-HNNXBMFYSA-N 399.281 5.299 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1ccc(Sc2ccccn2)cc1 508596982 FMRHMSOWSMUAHI-UHFFFAOYSA-N 389.480 5.144 30 20 GKED N#Cc1ccc(CN(C(=O)c2cccc(OCc3cccs3)c2)C2CC2)cc1 509170156 QXLNYVUPQFEIDV-UHFFFAOYSA-N 388.492 5.004 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)N[C@@H](c2cccs2)C2CC2)cc1 515216285 KCNCTUSHIKRYAJ-JOCHJYFZSA-N 388.492 5.080 30 20 GKED N#Cc1c(NC(=O)CCc2nc3ccccc3s2)sc2c1CCCCCC2 515677817 ZMMLKUCEKSBCFB-UHFFFAOYSA-N 395.553 5.460 30 20 GKED CCC(C#N)(CC)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 528059379 UHKFEFLNNRLHHC-UHFFFAOYSA-N 389.927 5.013 30 20 GKED CN(C(=O)CSc1ccc(C#N)cc1)[C@@H](c1ccc(Cl)cc1)C(F)(F)F 532341441 UACRREOVPQQKQS-KRWDZBQOSA-N 398.837 5.066 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@H]1CCCO1 534480799 SPWOLUAPSJUAIJ-SESVDKBCSA-N 397.906 5.075 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1Cl 535405504 SWRXFLOZKLZUFQ-OAHLLOKOSA-N 382.872 5.271 30 20 GKED C=CCC[C@H](NCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccccc1 538258278 XRMLSUNFZGQVEM-SFHVURJKSA-N 388.298 5.841 30 20 GKED N#Cc1ccccc1Oc1ccc(NCCCC2(C#N)CCOCC2)cc1F 538611085 FMIGYESUUPSBFT-UHFFFAOYSA-N 379.435 5.002 30 20 GKED CCN(C(=O)CCc1ccc(-c2ccccc2)[nH]1)c1ccc(C#N)c(Cl)c1 540274679 QGFFRUXEISNLKW-UHFFFAOYSA-N 377.875 5.192 30 20 GKED C=C(C)CN1CCC(N[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 542472423 JUVCDHGOFRBMJK-VWLOTQADSA-N 389.518 5.093 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cs1 551598020 ILKWJRXVDGRVKJ-UHFFFAOYSA-N 380.400 5.006 30 20 GKED COc1ccc([C@H](Cc2ccccc2)NC(=O)C[C@@H](CC#N)c2ccccc2)cc1 555171974 UHHUEWXOKFPJBQ-NOZRDPDXSA-N 398.506 5.183 30 20 GKED CC(=O)c1cc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1F 560731256 DJNAWNFRDDWCHD-UHFFFAOYSA-N 393.258 5.318 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCC(OCc3ccccc3)CC2)cc1 576720819 IPAKIGDOTVEMGB-UHFFFAOYSA-N 382.507 5.406 30 20 GKED CC1(C)CN(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)[C@H]1c1cccs1 579273280 LFMAGXOFLYHXQN-FQEVSTJZSA-N 392.480 5.015 30 20 GKED C/C(=C/c1ccc(C)cc1)C(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl 588402200 SZPPOGDBGREYOQ-OVHOFWQVSA-N 387.266 5.053 30 20 GKED CC(C)CN(C(=O)CCCCCC#N)C(C)(C)c1ccc(Br)cc1 588968222 JNICTUQVEFQYKD-UHFFFAOYSA-N 393.369 5.643 30 20 GKED C=CCn1c(C)cc(C(=O)CSc2nnc(-c3ccc(C(C)C)cc3)o2)c1C 589278086 PPVUXAYBVZWWCX-UHFFFAOYSA-N 395.528 5.439 30 20 GKED O=C(NCc1ccc(OC(F)(F)F)cc1)Nc1ccc(F)cc1C(F)(F)F 590334630 GJIBGBQXXXETGZ-UHFFFAOYSA-N 396.262 5.065 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1 591773948 HYUBTTWGOBRVRC-PBHICJAKSA-N 394.462 5.115 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3sccc3C3CC3)n2)cc1 591862707 ZVWQPMYLMDTJJP-INIZCTEOSA-N 380.494 5.248 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc(Cl)c1OC 606771465 YJUSYWSUJZEDLO-UHFFFAOYSA-N 385.769 5.185 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 608784968 LFWSPWZFZXUMQR-UHFFFAOYSA-N 386.455 5.188 30 20 GKED CO[C@@H](C)c1cccc(N[C@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)c1 608889106 IIBLLPDJAJEOKJ-CABCVRRESA-N 397.544 5.035 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)C(=O)N[C@H](C)c1cccc(C#N)c1 610408109 IUYDIPDYAMZJDH-HXUWFJFHSA-N 383.495 5.340 30 20 GKED N#CCCCOc1cccc(CNc2cc(F)ccc2OCC(F)(F)F)c1 610909768 HEANRCJDAXKJMO-UHFFFAOYSA-N 382.357 5.061 30 20 GKED Cc1ccncc1[C@@H](C)NC(=O)c1ccccc1SCc1ccc(C#N)cc1 611300674 VHWCBYPBYNJMGC-QGZVFWFLSA-N 387.508 5.045 30 20 GKED C[C@H](NC(=O)N(C)Cc1ccsc1)c1ccc(-c2cccc(C#N)c2)cc1 611855945 ILGCBVSMUUSTBP-INIZCTEOSA-N 375.497 5.189 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)cc2Cl)nnc1-c1cccnc1 614510253 YIPALFWJGIHYKV-LBPRGKRZSA-N 391.327 5.686 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H]1CCc2cc(C#N)ccc21 618807239 TVKATFQOMOJDDG-ZUOKHONESA-N 377.488 5.467 30 20 GKED CC(C)Oc1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 620304357 VQIRFHDGGYKNLF-HNNXBMFYSA-N 398.434 5.366 30 20 GKED C[C@@H](CC(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)C(F)(F)F 626369509 GBYBGLFZVPQSPK-CPCISQLKSA-N 381.238 5.014 30 20 GKED C=CC[C@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(C)cc2)n1 657528483 BYKZBEWNCAFXQU-GHTZIAJQSA-N 383.561 5.361 30 20 GKED C[C@H](NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(C(F)F)nc1 658256067 WEKSYYFEPFFBHO-VIFPVBQESA-N 378.307 5.723 30 20 GKED CC(C)(CNC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)CC(F)(F)F 662195566 UCJGPKRWAVEMNW-GFCCVEGCSA-N 388.327 5.097 30 20 GKED C=CCC[C@H](C(=O)N1CCC(OCc2ccc(F)cc2)CC1)c1ccccc1 681667676 RGWLWGHXFVCFSC-QHCPKHFHSA-N 381.491 5.083 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1c(Cl)cccc1Cl 726319133 ZBHXGXCPPREERP-GHMZBOCLSA-N 375.280 5.583 30 20 GKED CC(C)[C@@H](C)N1Cc2cccc(N=Cc3cc(Cl)cc([N+](=O)[O-])c3O)c2C1 727685358 KHWVHPYBJYEYPT-CYBMUJFWSA-N 387.867 5.065 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(SC(F)(F)F)cc2)c1 728012700 LCQXFCKFFXQCRG-UHFFFAOYSA-N 388.317 5.024 30 20 GKED COCCOc1ccc(/C=C\C(=O)c2sc(-c3ccccc3)nc2C)cc1 730464997 RNMHFOLVBCBDCO-RAXLEYEMSA-N 379.481 5.040 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)n1C 730996683 YNSWAGGRNXARFY-HNNXBMFYSA-N 393.487 5.335 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2cn(C(C)(C)C)nc2-c2ccccc2Cl)cn1 731158766 IHHBSDDCADGETG-ZHACJKMWSA-N 396.922 5.632 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(Oc3ccnc4ccccc34)c2)c1 734311812 XWEKTYHTJACTPW-UHFFFAOYSA-N 395.487 5.817 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C[C@H](C)c3ccccc3C)n2)cc1 734965047 GHULWFJAQBYEOF-OXJNMPFZSA-N 390.508 5.497 30 20 GKED CC(C)(C)OC(=O)N[C@@H](C/N=C/c1c(O)ccc2ccccc12)c1ccccc1 741844979 RGUAESJUWXNLFV-XAOCGEIJSA-N 390.483 5.230 30 20 GKED N#Cc1cccc(COc2cccc(/C=C3/CCc4cc(C#N)ccc4C3=O)c2)c1 742438341 WIJXOJVUHNBQBF-FMCGGJTJSA-N 390.442 5.221 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(N=Cc2cc3ccccc3nc2O)cc1 743044992 VVCJEJCBAOSRGT-OAHLLOKOSA-N 391.471 5.277 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@@H](C#N)C(=O)Nc3ccccc3)o2)cc1 744027920 CSKBBDLNFXKODO-LJQANCHMSA-N 386.451 5.205 30 20 GKED C[C@@H]1C[C@H](N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c2c(O)ccc(F)c21 756380550 VTXUZMQRAUGZOD-IIEKFROSSA-N 399.350 5.579 30 20 GKED Cc1ccc(C(=O)CC(C)(C)CC(=O)[C@@H](C#N)c2nc3cccc(C)c3[nH]2)cc1 760214892 BLDGYIYPACITEO-GOSISDBHSA-N 387.483 5.045 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1cc(Br)ncc1F 762421503 JUBZAMBUGCVUIM-ARJAWSKDSA-N 395.278 5.064 30 20 GKED N#C[C@H](C(=O)[C@H](c1ccccc1)C1CC1)c1nc(-c2ccc(Cl)cc2)cs1 765916490 SEBIAHNYCZLSSG-UYAOXDASSA-N 392.911 5.834 30 20 GKED C=CC[C@H](N[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccncc1 766020035 OGXFRUPTLSNADH-YWZLYKJASA-N 379.529 5.490 30 20 GKED C#CC[C@@H](N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccccc1 773113836 FAEFZNGEDVEJSY-IIBYNOLFSA-N 376.525 5.542 30 20 GKED N#CCCCn1cc(C(=O)O[C@@H](c2ccccc2)c2ccccn2)c2ccccc21 774068929 MEEJDHLAIUMXSB-DEOSSOPVSA-N 395.462 5.286 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 776781328 CLFDWYBUPBKJHP-QFIPXVFZSA-N 384.504 5.872 30 20 GKED CC(C)(C)[C@@H]1CCc2nc(NC(=O)c3ccccc3SCC#N)sc2C1 778505863 XPULQUAPISFSQS-CYBMUJFWSA-N 385.558 5.162 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3C#N)c2)c(F)c1 781109895 BRPIDTSRJKNURP-PKNBQFBNSA-N 382.394 5.044 30 20 GKED N#Cc1cccc([C@@H](NCc2ccc(-c3ccccc3C#N)cc2)C(F)(F)F)c1 783670940 AGFKPNOTKDXUJH-JOCHJYFZSA-N 391.396 5.490 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(Cl)nc1C(F)(F)F 790006074 UWVBEMNTPGGSGF-SNVBAGLBSA-N 399.825 5.258 30 20 GKED N#CCOc1ccc(CC(=O)N[C@@H]2CCCCC[C@@H]2c2ccc(Cl)cc2)cc1 791234990 NHYBFALISNPAIR-FGZHOGPDSA-N 396.918 5.018 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)C[C@@H]1CCC(F)(F)C1 797856831 NJTVSHPTKNTJDF-INIZCTEOSA-N 384.426 5.210 30 20 GKED C[C@H](C(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 798426607 GIGZZPSQZLWHDI-VIFPVBQESA-N 379.275 5.606 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)cc1 814577800 RZRGQPGULOSGCE-OYDLWJJNSA-N 399.469 5.549 30 20 GKED C=CCOc1ccc(CNc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)cc1Cl 815166150 ZJFQGOJKFQIAMQ-QVKFZJNVSA-N 384.907 5.278 30 20 GKED C[C@H](C(=O)O[C@H]1CC[C@@](C)(C#N)CC1)c1cccc(C(=O)c2ccccc2)c1 836154577 UMNLCBASPBCIFG-CODAWKSHSA-N 375.468 5.037 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCC[C@H]1CC1(Cl)Cl 844533421 ABMIRVRDKJEYDT-STQMWFEESA-N 386.348 5.034 30 20 GKED N#CCCCCC(=O)O[C@H](c1c(F)cncc1Br)C1CCCCC1 847645044 LFYIIMKOPJJKPA-SFHVURJKSA-N 397.288 5.232 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccccc1C#N 914519758 CLVPWEOMSJMVRK-FMIVXFBMSA-N 395.437 5.124 30 20 GKED COc1ccc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cc1 915656218 HGDHGPCRIVYWCU-OAQYLSRUSA-N 390.870 5.185 30 20 GKED Clc1ccc(NN=Cc2cn(Cc3ccccc3)nc2-c2cccnc2)cc1 916246971 REHYWUTXRFPHKE-UHFFFAOYSA-N 387.874 5.093 30 20 GKED CCCCCCNC(=O)[C@@H](C#N)C(=O)c1sc2cc(Cl)ccc2c1Cl 916876311 YDPXBNFRGURQQA-ZDUSSCGKSA-N 397.327 5.227 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(F)(F)c1ccccc1 920018839 XDEROXDAVUVGNO-UHFFFAOYSA-N 378.378 5.390 30 20 GKED COc1ccc(O)c(C=Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 920942269 UZPMONYTPGWFQK-HXUWFJFHSA-N 376.843 5.460 30 20 GKED COc1ccc(C=NN=C(c2ccccc2)c2ccccc2)c2cc(C(=O)O)oc12 1776012772 NJMRAFPTFQORPA-UHFFFAOYSA-N 398.418 5.011 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)[C@@H](C)Oc1ccc(Cl)cc1Cl 1776074405 YKGFOXKTGDVZMR-SNVBAGLBSA-N 385.222 5.086 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2cccc(C(=O)O)c2)cc1 1776125354 GFXBGURAGALRBN-BXBOZWQASA-N 380.484 5.876 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1c(Cl)cccc1Oc1c(C)ccc(C)c1C 1776147488 JIQBBFCDJQOMFU-KRWDZBQOSA-N 387.907 5.567 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)ccc1OCC#N 6340121 UGOPBSVSXVQFMG-NTUHNPAUSA-N 375.468 5.541 30 20 GKED CCCOc1c(Cl)cc(C(=O)Nc2sc(C)c(C)c2C#N)cc1OCC 21247439 FLPBQVHUAFZWIP-UHFFFAOYSA-N 392.908 5.330 30 20 GKED C=CCn1c(SCc2csc(C(C)C)n2)nnc1-c1ccccc1OC 31651087 RTPWCEGCGNQSDU-UHFFFAOYSA-N 386.546 5.012 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N(C)[C@H]1CCCc2ccccc21 66861087 KCSLGXSEUVWYCL-UWJYYQICSA-N 393.556 5.029 30 20 GKED C=CCSc1ccccc1NC(=O)CN(Cc1ccco1)Cc1cccs1 71805291 UXVBQIBUEWMNJC-UHFFFAOYSA-N 398.553 5.260 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 108241997 IBGWRVZNDGDGTF-JTQLQIEISA-N 397.422 5.058 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(CC1CCC1)[C@@H](C)c1ccccc1 180053078 QLSISNPOMQBIGB-ROUUACIJSA-N 377.488 5.373 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(NC(=O)c2ccncc2)c1)c1ccccc1 186613176 AHHWSHVPPCUVAQ-QFIPXVFZSA-N 385.467 5.022 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](C[C@H](C)O)c1ccccc1 191478762 XTSVJPKDZCXQLV-GHTZIAJQSA-N 380.532 5.215 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cc(O)ccc3C(F)(F)F)cc2)cc1 192939016 JPQNQQFBALOSFJ-UHFFFAOYSA-N 398.340 5.327 30 20 GKED Cc1nc([C@@H](C)ON=CC(=O)Nc2ccccc2)oc1-c1ccc(Cl)cc1 255279412 YQEDIKQKSXFBFC-CQSZACIVSA-N 383.835 5.006 30 20 GKED C[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccc(C#N)cc1 301270716 XOALZMWQMMRYOK-CQSZACIVSA-N 376.847 5.032 30 20 GKED COc1ccc(C[C@@H](Nc2snc(Cl)c2C#N)c2ccccc2)cc1OC 301960047 PUDUKSRMEIVKHF-MRXNPFEDSA-N 399.903 5.081 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)cc1 303494241 WRJCCZWRFGRIOQ-UHFFFAOYSA-N 392.405 5.811 30 20 GKED N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)Nc1ccccc1CCC(F)(F)F 416905799 GTVXXWNLXBHNSH-LJQANCHMSA-N 387.405 5.252 30 20 GKED Cc1cc(F)ccc1N(Cc1ccco1)C(=O)c1cccc(SCC#N)c1 429917711 ADZVCFNSTBLHFZ-UHFFFAOYSA-N 380.444 5.190 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1CCC(F)(F)F)c1ccccc1 433010770 LTWZUYWSXPUQLF-SFHVURJKSA-N 389.421 5.738 30 20 GKED CN(c1ccccc1NC(=O)N[C@H](CCCC#N)c1ccccc1)C1CCCC1 433262424 QKTGPFZMKDDELD-OAQYLSRUSA-N 390.531 5.622 30 20 GKED C=CCC[C@@H](NC(=O)CSCc1ccncc1)c1ccc(C(F)(F)F)cc1 441537849 CKISIPSJMSPJHC-GOSISDBHSA-N 394.462 5.157 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2noc(-c3ccccc3)n2)cc1F 444400698 UGZKWVKSWKDVKH-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CC1(C)CCCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 446230282 YWKVPIPPVCGEFZ-UHFFFAOYSA-N 391.515 5.376 30 20 GKED CC[C@@H](N[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C)c1ccc(C#N)cc1 447581259 SPRAQKBCPLDKBQ-QVKFZJNVSA-N 391.540 5.801 30 20 GKED C=CCn1c(SCc2nnc(C(C)C)s2)nnc1-c1ccc(Cl)cc1 450689528 GXANVFGGHHCVLG-UHFFFAOYSA-N 391.953 5.052 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H](c1ccc(F)cc1)C(F)(F)F)c1ccccc1 455200562 KPMLTFDRDVMAFC-QZTJIDSGSA-N 393.384 5.163 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@@H](c2cccc(Cl)c2)C1)c1ccccc1 458843481 POVHDRRZYDKKAA-CTNGQTDRSA-N 381.907 5.274 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@@H]3CCC[C@@H]32)c1 460411757 ZVJNAJYBFMYYRK-YWZLYKJASA-N 380.875 5.409 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)[C@@H](C)c1cccc(C#N)c1 462022863 HOONRIWKCXRING-KBPBESRZSA-N 393.487 5.110 30 20 GKED CCN(CC(C)(C)C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 463746907 ANRFMZXMVOGWGJ-UHFFFAOYSA-N 379.504 5.346 30 20 GKED N#Cc1ccc(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)cc1C(F)(F)F 463968080 YMLPADBRZBOAIZ-UHFFFAOYSA-N 394.221 5.126 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1cc(C(F)(F)F)ccn1 464426602 NSAPHBHGKLSCPA-ZDUSSCGKSA-N 390.748 5.504 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2Cc2c(F)cccc2Cl)cc1 474968835 IMCNYYRROMMRIP-QGZVFWFLSA-N 384.882 5.128 30 20 GKED N#CC[C@@H](CC(=O)N[C@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 476107100 DCNZZYSOALMFQR-MAUKXSAKSA-N 380.797 5.147 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CC(C)(C)C(F)(F)F 479379568 QXIOFRJVRZTBEA-UHFFFAOYSA-N 390.405 5.363 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)NCC#Cc2cccc(C(F)(F)F)c2)c1 481311217 DMBGECBWGDNRFP-KRWDZBQOSA-N 388.433 5.076 30 20 GKED C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 487426860 HQVLVRCKCZRHMO-JXFKEZNVSA-N 382.891 5.100 30 20 GKED N#Cc1ccc(NC(=O)N2CCCCC[C@H]2c2ccco2)cc1Br 487837451 MGNKRWZNYARBQX-INIZCTEOSA-N 388.265 5.063 30 20 GKED C[C@H](NC(=O)CSCc1ccc(F)cc1C#N)c1ccc(Cl)c(Cl)c1 488589056 XPMRLSFRSKGJBM-NSHDSACASA-N 397.302 5.115 30 20 GKED C=CCc1cc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)cc(OC)c1O 500153241 YGYXBVRJSDMPGI-HSZRJFAPSA-N 393.914 5.662 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1 500793431 OBAATVBHYFQCBP-SFHVURJKSA-N 378.516 5.185 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)Cc2ccc(C#N)cc2)c(C(F)(F)F)c1 505079087 YZPNYPYSMJDJGS-ZDUSSCGKSA-N 392.446 5.649 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c1 509745724 KOAUGOXJSOFHQT-QGZVFWFLSA-N 382.357 5.206 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3SC(C)C)n2)cc1 517277635 KBQHLWSQNJMUSL-GOSISDBHSA-N 392.549 6.109 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CCCOCc3ccccc3)c2)cc1 519122336 AOHUPRCXGDYTMO-UHFFFAOYSA-N 386.451 5.286 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520939250 ORFZERVHOCPHBW-MRXNPFEDSA-N 389.430 5.715 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 522434557 KORBSLXFGJFKDD-GHTZIAJQSA-N 397.478 5.760 30 20 GKED C[C@H](Oc1ccccc1NC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1 523783866 XHMBMRDRCXQUPN-SFHVURJKSA-N 385.467 5.362 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)c1cc(Cl)ccn1 524704848 UTVWYPHMETZDDN-UHFFFAOYSA-N 382.250 5.107 30 20 GKED C=CCN(C(=O)Cc1c[nH]c2c(C)cccc12)c1nc(-c2ccccc2)cs1 525430390 BJNCPHKWNPZFTI-UHFFFAOYSA-N 387.508 5.362 30 20 GKED COc1ccc(CNCc2cccc(OCc3ccccc3C#N)c2)cc1Cl 531698314 RHACNEKHONSLMY-UHFFFAOYSA-N 392.886 5.089 30 20 GKED C[C@@H](Nc1ccc(COc2ccccc2)cc1)C(=O)N(CCC#N)c1ccccc1 536882974 SYQMPUQCQPBPLF-HXUWFJFHSA-N 399.494 5.013 30 20 GKED CC(C)c1c(NCCCC2(C#N)CCOCC2)cnn1-c1ccccc1Cl 537532974 FDLDPFDWGVGOQT-UHFFFAOYSA-N 386.927 5.162 30 20 GKED C=CCN(C(=O)c1ccoc1C1CC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 539505921 NTNMWFGQYPHYSM-UHFFFAOYSA-N 395.440 5.022 30 20 GKED COc1cccc([C@@H](NCc2ccc(CC#N)cc2)c2ccccc2Cl)c1 544083598 NWSNVKRAIBUUBA-HSZRJFAPSA-N 376.887 5.294 30 20 GKED N#CCCn1cc(/C=C\c2nc(-c3cccc4[nH]ccc34)no2)c2ccccc21 545563140 QMLKIEFSZVEHAJ-KTKRTIGZSA-N 379.423 5.257 30 20 GKED Cc1nc(C2CC2)oc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 546773514 ZQMFLHSHUXAKPV-GOSISDBHSA-N 391.858 5.422 30 20 GKED Cc1c(C(=O)Nc2ccc(OCc3ccncc3)cc2)sc2ccc(C#N)cc12 550707563 NJAZKENVPDTYFX-UHFFFAOYSA-N 399.475 5.308 30 20 GKED N#CCCC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 552313114 MWHXJUXKRGLCSX-NRFANRHFSA-N 375.428 5.380 30 20 GKED CC[C@@H](C)Oc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c1 558367948 OUCVBGOLKOWXRR-GOSISDBHSA-N 379.504 5.426 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1F 558532474 FZRXRTMXXQZORP-RTWAWAEBSA-N 388.417 5.173 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)C3(c4ccc(Cl)cc4)CC3)cc2)ccn1 562228767 RJCACYPZUTWPTH-UHFFFAOYSA-N 389.842 5.069 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)Nc3scc(C)c3C#N)cc2)cc1 569963514 MPJALMDBUWMHPG-UHFFFAOYSA-N 376.437 5.175 30 20 GKED CC(C)CCO[C@H]1CC[C@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CC1 600378612 ZHHUOSXPASZVHS-MXVIHJGJSA-N 395.547 5.049 30 20 GKED CC(C)N(Cc1ccc(F)cc1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601186497 YCILZVUDCGKZOW-UHFFFAOYSA-N 387.458 5.063 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cccc(-c2cnco2)c1 606768981 GWAGVQDREIKGJT-UHFFFAOYSA-N 388.345 5.178 30 20 GKED CC[C@@](C)(NC(=O)Nc1cccc(C#Cc2cccs2)c1)c1nccs1 606938003 APQHURJEAPSXKC-HXUWFJFHSA-N 381.526 5.051 30 20 GKED Cc1cc(C(=O)Nc2sc3c(c2C#N)CCC3)sc1-c1ccc(F)cc1 608802599 HHWKMXWNZMNPOS-UHFFFAOYSA-N 382.485 5.537 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CCc1ccsc1 609151869 WXLVQUFLSYPPSY-UHFFFAOYSA-N 380.900 5.439 30 20 GKED CC(C)COc1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1Cl 609162535 BKLJBIPXCVISAN-UHFFFAOYSA-N 381.863 5.105 30 20 GKED Cc1cc(C)c(C)c(OCCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 609376919 LRAYACZKKVMAML-MRXNPFEDSA-N 382.529 5.271 30 20 GKED Cc1ccccc1N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C(C)C 609644065 IJTISLSHQJZDPF-UHFFFAOYSA-N 384.479 5.501 30 20 GKED COc1ccc(CS[C@@H](C)c2ccc(C#N)cc2)c(Br)c1OC 609825700 NUCJSOZVLMUPCC-LBPRGKRZSA-N 392.318 5.332 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(F)c(Cl)c1 619125897 YDDOLDVWQZTMOE-UHFFFAOYSA-N 379.703 5.263 30 20 GKED N#C[C@H](C(=O)c1cc(C2CC2)[nH]c1C1CC1)c1nc2ccccc2n1C(F)F 626300032 JWYGUNNDUOPHCM-CQSZACIVSA-N 380.398 5.004 30 20 GKED Fc1ccccc1-c1ncc(CN2C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)s1 648381411 YUWBAWRBQVFKIQ-TXEJJXNPSA-N 398.347 5.122 30 20 GKED FC(F)(F)c1csc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)n1 676867628 QJXVFMFWGWKPIL-UHFFFAOYSA-N 376.272 5.428 30 20 GKED N#C[C@H](C(=O)c1cncc2ccccc12)c1nc2cc(C(F)(F)F)ccc2s1 679980505 ZSFAUUYQRFSWLI-CQSZACIVSA-N 397.381 5.353 30 20 GKED CC[C@@H](C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1 680851061 LIWADBTWILFQJI-PAPYEOQZSA-N 399.350 5.345 30 20 GKED Brc1ccc(NN=C2CCCc3nc(-c4ccccc4)sc32)nc1 727263095 MTSUPXVVZHGOGB-UHFFFAOYSA-N 399.317 5.120 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)/C=C(/C)c1ccccc1Cl 727626938 JFWTWIJROVUQKK-ZDRDQBANSA-N 394.902 5.216 30 20 GKED Fc1ccc(-c2nc3c(s2)C(=NNc2cnc4ccccc4n2)CCC3)cc1 727683904 BREZFILWJFCSCM-UHFFFAOYSA-N 389.459 5.045 30 20 GKED Cc1cc(C(=O)N[C@H](c2ccccc2)c2ccco2)c(C)n1-c1ccc(C#N)cc1 728311126 ZPBRFMMJNMFVKW-XMMPIXPASA-N 395.462 5.078 30 20 GKED O=C1/C(=C/c2cccnc2)CCc2nc(-c3ccc(Br)cc3)sc21 728438127 AKLLMELCSCSJJB-GXDHUFHOSA-N 397.297 5.180 30 20 GKED C#Cc1cccc(N(C)C(=O)c2ccc(CSc3nc(C)cs3)cc2)c1 728536521 JSOGRDIUOGFRKS-UHFFFAOYSA-N 378.522 5.002 30 20 GKED O=C(/C=C\c1ccccc1OC(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 729248050 ZHUSJRIHPKWLRB-YVMONPNESA-N 393.258 5.395 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)o1 732765243 XAVWQXSVSRQBSK-RNCFNFMXSA-N 393.299 5.139 30 20 GKED C[C@H](CNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)C(C)(C)C 734645385 DOKLMIDWCUYVSG-QGZVFWFLSA-N 379.504 5.135 30 20 GKED C=CC[C@H](NC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccncc1 734684603 WEHBYXJOMPGNOB-OALUTQOASA-N 389.421 5.264 30 20 GKED CCSc1ccccc1C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 739591310 VLYLAFSAAIQNMV-UHFFFAOYSA-N 378.522 5.329 30 20 GKED Cc1ccc([C@H](C)NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740034862 FGFVGBTVVJNFFD-INIZCTEOSA-N 375.497 5.156 30 20 GKED Cn1cc(-c2cccc(C(=O)Nc3ccc(Oc4ccccc4C#N)cc3)c2)cn1 741547655 CBNVALBBLNSWPT-UHFFFAOYSA-N 394.434 5.003 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CC(C)(C)c2ccccc2)cc1 743447791 SWMLBEIVJNYPDT-UWJYYQICSA-N 376.500 5.215 30 20 GKED C=CC[C@H](NC(=O)NCC[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 746420407 DTPDCHSYENHNAD-BEFAXECRSA-N 391.437 5.211 30 20 GKED C=CCc1cc(CNc2ccc(C(F)(F)F)c(Cl)n2)cc(OC)c1OC 747809974 HCPBXTXBATWCBR-UHFFFAOYSA-N 386.801 5.112 30 20 GKED CC(C)c1nc(C#N)c(NN=C2CCCc3cc(SC(F)F)ccc32)o1 750937098 MPTSWUNKCGJXCU-UHFFFAOYSA-N 376.432 5.137 30 20 GKED C=CC[C@@H](NC(=O)CCSc1ccnc2cc(Cl)ccc12)c1ccncc1 751276055 SVHJKDUUOGLJFH-GOSISDBHSA-N 397.931 5.199 30 20 GKED COc1ccc2oc(C(=O)/C=C/c3cnc(-c4ccncc4)s3)c(C)c2c1 753142845 ASGHOZBXFAFHNV-SNAWJCMRSA-N 376.437 5.164 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C/SCc3ccco3)c2)cc1 754235283 KODBTBGUDYRIKQ-ZRDIBKRKSA-N 376.437 5.329 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccnc(Cl)c3)n2)cc1 771261310 MPWHRTJTCMWLQA-RRGWEWPQSA-N 379.872 5.057 30 20 GKED C[C@H](N[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F)c1ccc(OCC#N)cc1 772959309 KUNCZVAZAJKALV-OAGGEKHMSA-N 376.422 5.451 30 20 GKED C=C(C)[C@H](NC(=O)c1sccc1SC(F)F)c1ccc(F)c(F)c1 776399372 PETKXVRGHFZHAB-ZDUSSCGKSA-N 375.412 5.388 30 20 GKED N#CCc1ccccc1CC(=O)Nc1cc(Cl)ccc1SCC(F)(F)F 776948783 ISVRMXKGVBTSRX-UHFFFAOYSA-N 398.837 5.242 30 20 GKED N#CC1(c2ccc(C(=O)Nc3cccc(CC[C@@H](O)c4ccccc4)c3)cc2)CC1 777410526 UDXBZMMKNGLRRO-XMMPIXPASA-N 396.490 5.160 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc(C(F)(F)F)cnc1Cl 779768510 MWLLDVDCJRHAKN-SNVBAGLBSA-N 399.825 5.258 30 20 GKED CC(C)Sc1cccc(Cl)c1C=NNc1nnc(-c2ccccn2)s1 788028342 LJROFKLWDNCLPM-UHFFFAOYSA-N 389.937 5.200 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1)c1nccc2ccccc12 792102865 JWUOUQDAQYFKHA-QRVBRYPASA-N 381.262 5.522 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 796650723 NTIRKHPZVBZQIZ-BNOWGMLFSA-N 396.434 5.087 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc(C(F)(F)F)nc1O 811686790 AJLNCALDPSFWOR-PRNVZQMKSA-N 399.315 5.250 30 20 GKED Cc1cccc2cc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c(Cl)nc12 813400283 ZDWDVZYYVYQHFO-ZDUSSCGKSA-N 395.915 5.701 30 20 GKED Fc1nc(F)c(F)c(NN=C(CCC(F)(F)F)CCC(F)(F)F)c1F 853271753 IGRGYQMNPPXVNQ-UHFFFAOYSA-N 385.205 5.091 30 20 GKED CCc1nc2ccccc2n1N=Cc1cc(OC)c(OC)cc1-c1ccccc1 915271494 YDQIYYYTHYTSEZ-UHFFFAOYSA-N 385.467 5.165 30 20 GKED N#Cc1ccccc1NC(=S)N[C@H](c1ccccc1)c1cc2ccccc2o1 915998556 AVWHJHNBPOBOBF-JOCHJYFZSA-N 383.476 5.380 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)oc12 920111196 YQBXVVDEKQZFRO-IBGZPJMESA-N 396.446 5.472 30 20 GKED Cc1cc(C)c(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1C 1776132846 HQESEIGYQKYFOI-CLFYSBASSA-N 376.477 5.935 30 20 GKED C=CCOc1ccc(CNCc2cccc3ccc(C(=O)O)cc23)cc1Cl 1776184339 OCKGWYXVSJQFSV-UHFFFAOYSA-N 381.859 5.046 30 20 GKED CCCCCCCOc1ccc(CN[C@](C)(Cc2ccccc2)C(=O)O)cc1 1776788026 MDRCAAYTPBLOMK-XMMPIXPASA-N 383.532 5.211 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C/c1c(F)ccc2sc(C(=O)O)cc12 1777545325 INSMSOHMHYHFTR-FNORWQNLSA-N 386.448 5.029 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)[C@@H](C)c3ccc(Cl)cc3)cc2)CCC1 1785988816 QDGASCBDPIDDLJ-INIZCTEOSA-N 396.918 5.154 30 20 GKED C=CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCCCCC(C)(C)C)CC1 1831577236 LQRKXNXTEFDFRX-NRFANRHFSA-N 390.612 5.179 30 20 GKED CCN/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccc(C(CC)CC)cc1 32813713 OHOUXGWOCRQGGJ-UHFFFAOYSA-O 383.581 5.043 30 20 GKED N#C[C@@H](C(=O)c1ccccc1COc1ccccc1)c1nc2ccccc2s1 41499735 DSSBPYNKWUWECZ-IBGZPJMESA-N 384.460 5.365 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)ccc2o1)c1nc2ccccc2n1C(F)F 41557900 UCEDOZDWKQCQKN-GFCCVEGCSA-N 385.757 5.321 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)C2CCCCC2)cs1 54897769 OEZGZUNGYGZDHH-FMIVXFBMSA-N 388.920 5.644 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)CC(c1ccccc1)c1ccccc1 62904120 FYAUAZWTPBDVRU-UHFFFAOYSA-N 380.491 5.295 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c(C)n1C(C)C 64714645 COZDUOWPRUYCGX-HNNXBMFYSA-N 399.466 5.578 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66956269 MYVYKDZXIFLRKT-PXNSSMCTSA-N 379.529 5.758 30 20 GKED Cc1cc(SC(C)(C)C)ccc1NC(=O)NCc1ccc(OCC#N)cc1 69680797 CBIYOLAYAFTWMN-UHFFFAOYSA-N 383.517 5.110 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cc(Cl)ccn1 108241777 FTMIWUTYLAHVMO-UHFFFAOYSA-N 385.798 5.012 30 20 GKED C[C@H](c1ccccc1)N(CC1CCC1)C(=O)Nc1ccc(F)cc1OCC#N 135327925 WSMMLOZMDIXBKA-MRXNPFEDSA-N 381.451 5.123 30 20 GKED CC[C@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 151813576 YKZXRMPRSMUATR-OAQYLSRUSA-N 382.460 5.286 30 20 GKED CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 158871897 NSLYMUYBPVLQJP-UHFFFAOYSA-N 399.450 5.178 30 20 GKED N#CCCn1cc(CNc2cccc(COCC3CC3)c2)c(-c2ccccc2)n1 177556549 HEJWPOSDSANLAG-UHFFFAOYSA-N 386.499 5.002 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 179867685 WKBWOPAASMHRLK-MRXNPFEDSA-N 375.497 5.189 30 20 GKED C=CCC[C@@H](C(=O)Nc1cc(C(=O)N(C)C(C)C)ccc1Cl)c1ccccc1 187390948 FRLHKGDUGXVFCY-LJQANCHMSA-N 398.934 5.509 30 20 GKED C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccccc1SCCC#N 188623548 VDRYUGZJJZLEKT-CYBMUJFWSA-N 394.418 5.117 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](C(F)(F)F)C1(C)C 276366039 MIYSODJGGOISQH-DOMZBBRYSA-N 385.455 5.276 30 20 GKED CCOc1cc(/C=C2/CCOc3c(ccc(Cl)c3Cl)C2=O)ccc1O 303026581 MZMMPHWQLZQKAY-XFXZXTDPSA-N 379.239 5.147 30 20 GKED C[C@@H]1CCCCN1CC(O)=Nc1ccc(F)c(N=C(O)CC2CCCC2)c1 328882209 LPTFUJSWTUQMDR-OAHLLOKOSA-N 375.488 5.456 30 20 GKED Cc1ccc(CN(CCCC2(C#N)CCOCC2)[C@H]2CCc3ccccc32)cc1 410421898 NPYQPOBFIAOYQB-VWLOTQADSA-N 388.555 5.585 30 20 GKED C=CCN(Cc1cccc(C#N)c1)[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C 411189794 GNJOXLXPOLYUBL-IBGZPJMESA-N 375.516 5.005 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1ccccc1Oc1ccc(Cl)cc1 426093759 YPYGJOUOKBZKTF-UHFFFAOYSA-N 395.846 5.673 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)CNc2ccc(-c3ccncc3)c(C)c2)c1 427417608 WABFILRWAITEBK-UHFFFAOYSA-N 398.510 5.033 30 20 GKED Cc1c(C(=O)Nc2ccc(CC#N)cc2)sc2ccc(Br)cc12 431032050 HIJJWUSDNFTDFB-UHFFFAOYSA-N 385.286 5.291 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCCOc2c(Cl)cccc21)c1ccccc1 431468169 CXRYZKZHRYRMBU-PMACEKPBSA-N 397.906 5.288 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cn(-c2ccccc2)nc1-c1cccs1 432833081 BEHCXPQRQZIIIL-UHFFFAOYSA-N 384.464 5.033 30 20 GKED C=CCC[C@@H](NC(=O)N(Cc1ccco1)Cc1cccs1)c1ccccc1 435113093 HAXSMBLHMXGKLR-OAQYLSRUSA-N 380.513 5.760 30 20 GKED C=CCC[C@H](NC(=O)Nc1cccc(OCc2cscn2)c1)c1ccccc1 435612038 VNLUUZDTJRBERO-NRFANRHFSA-N 393.512 5.551 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)[C@@H]2CSc3ccccc32)cc1F 437463211 ZIDHTEUKUCSDJD-QGZVFWFLSA-N 390.439 5.318 30 20 GKED C[C@H]1CCC[C@H](C)N(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 437745002 LQTUWEGTCUEYBK-OALUTQOASA-N 391.515 5.374 30 20 GKED C=CCN(C(=O)c1cccc(-c2csc(C)n2)c1)c1nc2c(s1)CCCC2 443802471 OBBGTOQWFWYNIF-UHFFFAOYSA-N 395.553 5.287 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)cs1 443878159 KAJQPHVXGMPZOK-UHFFFAOYSA-N 387.386 5.261 30 20 GKED CCc1c(NC(=O)N[C@H](CCCC#N)c2ccccc2)cnn1CCC(C)C 455272135 RSDDVBFBDXQGII-LJQANCHMSA-N 381.524 5.048 30 20 GKED Cc1ccc(NC(=O)C(C)(C)Cc2ccc(C#N)cc2)cc1NC(=O)C(C)(C)C 455640327 WYMZTAVPMAJECN-UHFFFAOYSA-N 391.515 5.059 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@H](C)CC(F)(F)F 457557206 MVQIEBCYHDASDA-CQSZACIVSA-N 378.369 5.128 30 20 GKED CC(C)c1c(NC(=O)[C@H](C)c2cccc(C#N)c2)cnn1-c1ccc(Cl)cc1 462341515 QARSCQYWTILTJK-OAHLLOKOSA-N 392.890 5.263 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 464182067 HPHYFOHXPGRLTC-NSHDSACASA-N 393.415 5.084 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](CSc2ccccc2)C1 464324133 LXAZKWYVACJIJI-LJQANCHMSA-N 398.531 5.480 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 466390837 FBVRJONORFMDNS-MOPGFXCFSA-N 381.520 5.666 30 20 GKED C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H]1CCOc2ccc(OC)cc21 466424471 FMVXIBWTBIBNQY-PGRDOPGGSA-N 379.500 5.150 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)nc2ccccc21 468268214 PNFZHRACKADWAI-SFHVURJKSA-N 376.479 5.008 30 20 GKED CC(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSCc1ccccc1 470356304 HHUXUJYWLBMZPY-LJQANCHMSA-N 378.497 5.144 30 20 GKED C=CCC(CC=C)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 470394771 SPZVJGYDXSUGDB-SFHVURJKSA-N 396.556 5.293 30 20 GKED Cc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cccc1C(=O)Nc1ccccc1 475469166 QAYQWKIRHWHGDT-UHFFFAOYSA-N 397.478 5.301 30 20 GKED C=CCOCCCSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 475996667 SCFIASNFUOVLLK-SFHVURJKSA-N 379.529 5.239 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OCCC)c(OCC)c1 476076779 CBWCTLZOGKHHLW-UHFFFAOYSA-N 381.516 5.978 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@H](C)c1c(F)cccc1F)c1ccc(F)c(F)c1 477727647 SCXHMZVSKKNKIU-BLVKFPJESA-N 380.385 5.263 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)NCc3cccc(C#N)c3)o2)cc1 482405671 DFJGSUCMYLZGBL-UHFFFAOYSA-N 393.446 5.119 30 20 GKED C[C@H](NC(=O)Nc1ccnn1[C@@H](C)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1 482461516 SVCVKNDNCIVXTL-IRXDYDNUSA-N 399.498 5.275 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@](C)(Cc1ccccc1)[C@H](C)O 484658053 WFSDZHXLBHJLHA-UQBPGWFLSA-N 394.559 5.290 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@@H](C)CSc1ccccc1OC 486228789 IHTLCYMTYLPOHZ-MRXNPFEDSA-N 387.570 5.132 30 20 GKED O=[N+]([O-])c1cc(CNCc2ccc(F)cc2C(F)(F)F)cc(C(F)(F)F)c1 487185084 IKEVCHVZFBDBLM-UHFFFAOYSA-N 396.262 5.061 30 20 GKED O=[N+]([O-])c1cc(CNCc2cc(C(F)(F)F)ccc2F)cc(C(F)(F)F)c1 487201807 RUMABEASURPWBE-UHFFFAOYSA-N 396.262 5.061 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)c1ccccc1 494534968 ZXPRXSNYSPZJDL-XLIONFOSSA-N 399.918 5.444 30 20 GKED C/C(=C/c1ccccc1)CN(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 494750713 AAPHGCVMGRXYPF-FDWYHIAWSA-N 379.529 5.506 30 20 GKED C=CCc1cc(CNC(=O)Nc2ccccc2C(C)(C)C)cc(OC)c1OC 497734678 IZTZUADJASYRSJ-UHFFFAOYSA-N 382.504 5.052 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)c1cccc(OCc2ccccc2C#N)c1 498655510 RXZRVTFSCUEHET-MRXNPFEDSA-N 376.481 5.032 30 20 GKED Cc1c(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cnn1-c1ccc(Cl)cc1 499311699 VEHDIWUXFKLURZ-UHFFFAOYSA-N 392.890 5.009 30 20 GKED N#Cc1ccc(SCc2nnc(-c3ccc(Cl)cc3)o2)cc1C(F)(F)F 499476947 YCIVDWKGPMTPKP-UHFFFAOYSA-N 395.793 5.573 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3Cl)CC2)cc1 503900072 HERBSYJDQQYSCA-RTBURBONSA-N 397.305 5.284 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2)c1ccccc1 505979848 WCPBECXQOORDDO-GOSISDBHSA-N 388.433 5.253 30 20 GKED CCc1c(NC(=O)c2sc3ccc(C#N)cc3c2C)cnn1C(CC)CC 506644149 AXODRPLQPQXGKF-UHFFFAOYSA-N 380.517 5.454 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)[C@H](Sc1ccccc1)c1ccccc1 512844879 PWPXVICJZYWZKJ-JOCHJYFZSA-N 388.492 5.429 30 20 GKED N#Cc1cccc(COc2cccc(CNc3cccc(-c4ncco4)c3)c2)c1 514076563 ADHGHIGRNFAIRM-UHFFFAOYSA-N 381.435 5.404 30 20 GKED Cc1ccc(CN(CCc2ccccc2)C(=O)Nc2ccc(CC#N)cc2)s1 515219494 VNXWEKIQIMNOGA-UHFFFAOYSA-N 389.524 5.399 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc(OCCCC#N)c3)o2)cc1 515443236 SAMPRHPODWCNTO-UHFFFAOYSA-N 388.423 5.084 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(CC)o2)nnc1-c1ccc(C(C)(C)C)cc1 517660282 KATXIYDKOUTVAN-AWEZNQCLSA-N 397.548 5.227 30 20 GKED COc1ccccc1CC(C)(C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 518681759 JLDUHRRTTUNJNA-INIZCTEOSA-N 397.544 5.090 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](CC(C)C)c1ccccc1 520132212 SROHTUGDGGCGJO-NRFANRHFSA-N 381.476 5.080 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCCCCCc1ccccc1 521811944 ZVBOQNONFVDYIK-SFHVURJKSA-N 381.545 5.615 30 20 GKED C=CC1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 523628597 WXQAZWWHVXGCRF-HXUWFJFHSA-N 379.891 5.425 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)c1ccccc1C(F)(F)F 525301541 FCYYAQCFYSGJAL-CQSZACIVSA-N 380.385 5.303 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccccc1F 532490256 SZGNSHOJGPIAJZ-QGZVFWFLSA-N 399.535 5.069 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](C3CC3)C2)cc1Cl 535001700 ZGQCRQCKOWYYFE-FXAWDEMLSA-N 379.891 5.259 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)c2ccc(C#N)c(F)c2)cc1 537406258 FATSDOCNEWLOBJ-GYCJOSAFSA-N 392.449 5.480 30 20 GKED CCOCc1ccc(NC(=O)NCc2ccc(-c3ccccc3C#N)cc2)cc1 540251274 VCRNTUFTHQIKIE-UHFFFAOYSA-N 385.467 5.083 30 20 GKED CN(C(=O)c1cccc(CC#N)c1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 540632654 KKODHFAIEDOCKK-VQTJNVASSA-N 386.417 5.180 30 20 GKED CCC(=O)Nc1cccc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 542000097 BYLSNMNNVGQYCB-QGZVFWFLSA-N 397.478 5.065 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 542674596 HTPYJZCOIWPLMU-IRLDBZIGSA-N 398.478 5.165 30 20 GKED C[C@@H](NC(=O)C[C@H]1OCCc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 542927627 KXFIRQVXGHOCMP-IQGLISFBSA-N 396.490 5.107 30 20 GKED C[C@H](NCc1ncc(-c2cccs2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543873666 AOICMBUYVOTXOV-INIZCTEOSA-N 385.492 5.793 30 20 GKED CNc1ccc(C#N)cc1NC(=O)c1sc2cc(Cl)ccc2c1Cl 552575782 LHSYHPRKDSJREG-UHFFFAOYSA-N 376.268 5.374 30 20 GKED CSc1cccc(F)c1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 554444742 QFZKNFIPUTZYMF-ZDUSSCGKSA-N 389.521 5.121 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc(F)c(F)c1 557305751 QPKQJOBYGPHXAF-UHFFFAOYSA-N 396.368 5.435 30 20 GKED COc1cc(C(C)=O)ccc1OCCC(C#N)(c1ccccc1)c1ccccc1 569026756 DOQNVPULMHGQNR-UHFFFAOYSA-N 385.463 5.177 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1C[C@@H]1c1ccccc1 576366935 JICRRAJJOHJUHX-VWNXMTODSA-N 397.478 5.123 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccccc1-c1ccccc1 578993089 SIYWBJHFXKJDCZ-UHFFFAOYSA-N 376.456 5.049 30 20 GKED CN(Cc1ccc(Cl)cc1Cl)C(=O)N[C@H](CCCC#N)c1ccccc1 590942425 AJCJJEIHHYMWRQ-LJQANCHMSA-N 390.314 5.570 30 20 GKED N#CCCCOc1cccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)O)c1 608845957 LODGCEDAMMEKSR-SAPNQHFASA-N 384.435 5.102 30 20 GKED N#CCCCOc1cccc(NC(=O)c2csc(-c3ccccc3Cl)n2)c1 608938758 VSULZOBAJUNEEF-UHFFFAOYSA-N 397.887 5.398 30 20 GKED COc1ccc(C#N)cc1NC(=O)Nc1ccc(OCc2ccccc2)cc1C 609773441 CVCUGCHAPCTGSP-UHFFFAOYSA-N 387.439 5.098 30 20 GKED Cc1cc(NC(=O)CS[C@H](C)c2ccc(C#N)cc2)ccc1Br 609825799 ULBPHVZZCJNWDB-CYBMUJFWSA-N 389.318 5.062 30 20 GKED CC(C)Oc1c(Cl)cccc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 609827302 OSMJZAQQZVUNCL-UHFFFAOYSA-N 385.895 5.441 30 20 GKED Cc1ccc(-n2nc(C(C)C)cc2NC(=O)c2cc3ccccc3n2CC#N)cc1 610055170 IKWHMMQAEQSYDI-UHFFFAOYSA-N 397.482 5.035 30 20 GKED CC(C)[C@H](NC(=O)N[C@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610349934 LUNNUDMQEMDNDG-KUHUBIRLSA-N 389.421 5.335 30 20 GKED C[C@H](NC(=O)N(C1CC1)[C@H](C)c1ccc2ccccc2c1)c1cccc(C#N)c1 610664086 OWOIVQABDCEBAC-ZWKOTPCHSA-N 383.495 5.708 30 20 GKED O=C(Nc1cc(Cl)ccc1F)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618538320 IZCRCOVAFAMOIC-OCAPTIKFSA-N 392.702 5.074 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@H]1CCc2cc(C#N)ccc21 618848330 UFWNEUDBUMDNKK-BLVKFPJESA-N 388.298 5.255 30 20 GKED C[C@H](NC(=O)Nc1ccccc1CN(C)c1ccccc1)c1cccc(C#N)c1 619020922 DZPRNJXSPTZKEL-SFHVURJKSA-N 384.483 5.077 30 20 GKED O=C(c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1[C@H]2CC[C@H]1CC(F)(F)C2 628442895 DNKYLZKACWBGHU-RYUDHWBXSA-N 387.270 5.127 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2ccccc2)sc1-c1cccc(Cl)c1 726732809 KYIVHGYADYVURM-KRWDZBQOSA-N 394.883 5.338 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2\CCc3cc(SC(F)F)ccc3C2=O)cc1 728697885 YWJHPZRFIIDUGF-BVTUPMQUSA-N 385.435 5.505 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1csc(-c2csc(C)n2)c1 729140639 KSFVQROZEAJQRX-UHFFFAOYSA-N 399.570 5.638 30 20 GKED O=C(/C=C/c1c(Cl)ccc(Cl)c1Cl)c1ccc(C(F)(F)F)nc1O 731565058 ZFCNNLKMGNDMME-ORCRQEGFSA-N 396.579 5.662 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2cccnc2Cl)cc1OCC 733192689 LZNFGCZDZQEMRF-UHFFFAOYSA-N 383.275 5.127 30 20 GKED C#CC[C@@H](OC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccn1 733693041 RPZAYPDZRHODJJ-OAHLLOKOSA-N 387.279 5.041 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C)c2csc3ccccc23)c1 733803173 UXSUHYJGXRZLKD-NVXWUHKLSA-N 393.512 5.143 30 20 GKED CCCn1c(C)cc(C(=O)CSCc2cc(Cl)ccc2OCC#N)c1C 735320010 IIHGIOJQBUUPFL-UHFFFAOYSA-N 390.936 5.187 30 20 GKED CCN(CCC#N)Cn1nc(-c2cccc(C)c2)n([C@H]2CCCC[C@H]2C)c1=S 742539282 HGVRQMMBAOCVHH-QUCCMNQESA-N 397.592 5.334 30 20 GKED C[C@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1ccc(C#N)cc1 748683274 BMFFGTNGAHHZNB-ZETCQYMHSA-N 390.053 5.485 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3cccc(F)c3F)n2)cc1 750394303 FJJRHRIISUIHIS-INIZCTEOSA-N 382.435 5.206 30 20 GKED CCCCN(C(=O)Nc1ccc(F)cc1OCC#N)[C@@H](CC)c1ccccc1 761664781 KYHXXKDLQWSUQA-FQEVSTJZSA-N 383.467 5.513 30 20 GKED CCc1nc2ccccc2n1N=Cc1ccc(OC)c(OCc2ccccc2)c1 767374916 XRTMCBWPPMJDRM-UHFFFAOYSA-N 385.467 5.069 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(Br)c(F)c2)c1 772985280 WADOJDAOIHKTKQ-XJKSGUPXSA-N 391.284 5.120 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](CO)c2ccc(C(F)(F)F)cc2)cc1 773120228 RQLCVJFETHAZFM-LIRRHRJNSA-N 399.840 5.221 30 20 GKED CCCCCCCOc1ccc([C@H](C)N[C@H]2CCO[C@]3(CCOC3)C2)cc1 773154111 XENNMDWAOSIANI-IEIRFRATSA-N 375.553 5.025 30 20 GKED Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(C)(C)C#N)c3cnn(C(C)C)c3n2)cc1 777332564 DWVXJFDVUMPTOW-INIZCTEOSA-N 390.487 5.083 30 20 GKED C[C@H](Nc1ccc(N2CCSCC2)c(Cl)c1)c1ccc(C#N)cc1F 781420249 AJONAZPCDOFNEG-ZDUSSCGKSA-N 375.900 5.077 30 20 GKED N#CCOc1cccc(NC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)c1 781439216 RCUQXOSYLFRSKL-LJQANCHMSA-N 399.372 5.167 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)C[C@H](C)c1c[nH]c2ccccc12 786277606 SNIMYOWXESFVEU-KBXCAEBGSA-N 383.451 5.043 30 20 GKED CC(=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1)C1CCSCC1 794980417 BCQDZLCWENFEIM-UHFFFAOYSA-N 380.439 5.093 30 20 GKED Cc1ccc(C(=O)Nc2cnn(-c3ccc(Cl)cc3)c2C(C)C)cc1C#N 799374000 QKJKYBPLAJPQFT-UHFFFAOYSA-N 378.863 5.082 30 20 GKED Fc1ccc(-c2csc3ncnc(NN=C4CCCC45CCOCC5)c23)cc1 799872963 GQELJMMAUISCBQ-UHFFFAOYSA-N 396.491 5.246 30 20 GKED O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 801985475 WGMWNUMQSBQLCN-UONOGXRCSA-N 397.334 5.297 30 20 GKED C#CC[C@H](NC(=O)N1CCC([C@H](F)c2ccccc2F)CC1)c1ccccc1 805234873 SHGQYATUOIIGSA-VXKWHMMOSA-N 382.454 5.023 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] 812985439 SLIHEFFPODHALG-UHFFFAOYSA-N 396.255 5.160 30 20 GKED Cc1ccc(-c2nnc([C@H](C)SCc3cc(Cl)ccc3OCC#N)o2)cc1 842175684 UWRMXZLUMRMWLN-AWEZNQCLSA-N 399.903 5.595 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)C(=O)C1(c2ccccc2)CC1)c1ccccc1C(F)(F)F 845841864 QUIJOMXQEDKJNS-XXTMNZORSA-N 397.396 5.118 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(-c2ccc(Cl)cc2)no1 848602451 CRDKFNGBCZUOLO-HNNXBMFYSA-N 390.871 5.040 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)CC3CCC(F)(F)CC3)n2)cc1 860502967 QNQBKGBPZLZZRQ-MRXNPFEDSA-N 390.455 5.211 30 20 GKED N#CCCC[C@@H](NCc1nc(Cl)ccc1Br)c1ccccc1 877549551 NKXXJULMCNTPKG-OAHLLOKOSA-N 378.701 5.022 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 914490940 LLVSPJDASGCYGM-ZRDIBKRKSA-N 376.456 5.098 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C\c2cn(CCC#N)nc2-c2ccccc2)cc1 916131251 RTIAGTFJQUBBOS-KAMYIIQDSA-N 385.467 5.147 30 20 GKED CCCCc1oc2ccccc2c1/C=C\C(=O)[C@@H](C#N)C(=O)Nc1ccccc1 916900853 XXQKUNQSXBTVIL-HMZRMUTASA-N 386.451 5.136 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cc(-c2cccs2)nc2ccccc12 921164566 MHYMFMAMYDTIOI-UHFFFAOYSA-N 376.403 5.154 30 20 GKED O=C(O)c1cc2ccccc2c(C=NNc2ccccc2Oc2ccccc2)c1O 1776091154 XVEUBQZBUWJMIH-UHFFFAOYSA-N 398.418 5.482 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C\c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1776114286 KZVZXXCPMCKHRM-SXGWCWSVSA-N 396.439 5.652 30 20 GKED C=CCCC[C@@H](NCc1cc(C)c(OCc2ccccc2C)c(C)c1)C(=O)O 1776174229 CVOMFPBVUJJUIE-JOCHJYFZSA-N 381.516 5.090 30 20 GKED CCCCCCCOc1ccc(CN[C@@]2(C(=O)O)C[C@]2(C)c2ccccc2)cc1 1776788462 VTFZANSCOFSVLF-JWQCQUIFSA-N 395.543 5.310 30 20 GKED O=C(/C=C/c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccc(Cl)cc2)s1 1777570155 YZDPRRZTWFDNPG-KRXBUXKQSA-N 386.831 5.802 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CSc4ccccc4C3=O)s2)c1 1777684385 ZYEUUIPSKATESM-RVDMUPIBSA-N 378.474 5.485 30 20 GKED Cc1ccc(C(=O)/C(=C(\S)Nc2ccc(C(C)C)cc2)[n+]2ccccc2)s1 22728700 FDPDBKUBRCKCCF-UHFFFAOYSA-O 395.573 5.518 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1cc2ccccc2o1 45899589 CCGPWICFNQAMNH-INIZCTEOSA-N 398.487 5.947 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(-c2ccc(OC)cc2)n1 61001754 IBTPDJJJBPDREL-UHFFFAOYSA-N 377.513 5.103 30 20 GKED Cc1cc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)on1 69202977 VWFBZIKBFBQREG-HXUWFJFHSA-N 388.427 5.016 30 20 GKED Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2cccc(OCCCC#N)c2)c1 108292218 QNKWNRYLSHOUBK-SFHVURJKSA-N 380.488 5.207 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)c1c(F)cc(C#N)cc1F 126615544 OXASMRIOPXSYDX-CYBMUJFWSA-N 397.450 5.102 30 20 GKED C[C@H](Sc1ccc(C#N)cc1Cl)C(=O)Nc1ccccc1C(F)(F)F 154159027 MRSKHGZGEACZAX-JTQLQIEISA-N 384.810 5.350 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H]1Cc1cccc(F)c1 171742195 HDNOHEXWJZHZNU-VQIMIIECSA-N 397.519 5.316 30 20 GKED Cc1cc(-c2ncccc2NC(=O)CCCCOc2cccc(C#N)c2)cs1 186906141 ZIFCEOQBIBKMNL-UHFFFAOYSA-N 391.496 5.178 30 20 GKED N#Cc1cc(NCc2ccc(OCc3ccccn3)cc2)ccc1C(F)(F)F 302186281 VEOTUYIIESUJKM-UHFFFAOYSA-N 383.373 5.163 30 20 GKED C=CCCCN(C)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 303694763 ACOCUISYURZZJN-UHFFFAOYSA-N 391.943 5.175 30 20 GKED CC(C)[C@H](/N=C(/O)C12CC3CC(CC(C3)C1)C2)c1nc([C@H]2CCCS2)no1 329547861 CCSWKPMFSLOAGS-BELXIORKSA-N 389.565 5.508 30 20 GKED CSc1nc(C(C)(C)C)nc(C)c1/C(O)=N/[C@@H]1CCC[C@@H](C(F)(F)F)C1 331006554 ZRWSSICGLSHCAB-VXGBXAGGSA-N 389.487 5.230 30 20 GKED N#CC1(CC[S@@](=O)Cc2csc(-c3ccccc3F)n2)CCCCC1 417142410 RLMNVCIYFBFAAB-RUZDIDTESA-N 376.522 5.062 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(CSc2ccc(F)cc2)cc1 417468010 NHXSVSUBAYVWJO-UHFFFAOYSA-N 383.492 5.276 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1c(Cl)ccc2c1OC(C)(C)C2 425669533 CPZUCXZWCVIFDW-CYBMUJFWSA-N 383.879 5.150 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 425729006 VNKOMJPDJPSPDD-FZKQIMNGSA-N 393.384 5.093 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cncc(-c3ccc(Cl)cc3)c2)s1 430616103 DQGMAYYQODXOGV-QGZVFWFLSA-N 395.915 5.646 30 20 GKED CCC(CC)n1ccc(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)n1 432645137 OMISXXBVQKEAHJ-UHFFFAOYSA-N 390.512 5.195 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ccc(F)c(F)c1 437458816 KNFFLTWFGNOVFX-ZDUSSCGKSA-N 396.368 5.510 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)cc1C(F)(F)F 438635313 UDEFBPKHFNDPLC-CQSZACIVSA-N 393.796 5.252 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(C#N)oc2C)cc1 439145840 YDMWBBRNUBZWTF-UHFFFAOYSA-N 382.803 5.166 30 20 GKED CCCCc1noc([C@@H](C)Nc2ccc(Oc3ccccc3C#N)c(F)c2)n1 439676201 UQAUOMQHTXMRNZ-CQSZACIVSA-N 380.423 5.388 30 20 GKED N#CCCCn1cc(C(=O)N(C2CC2)[C@@H]2CCc3ccccc32)c2ccccc21 444043112 FDYXTIJZABAQKP-XMMPIXPASA-N 383.495 5.237 30 20 GKED CC(C)N(C)c1ccccc1CNC(=O)Nc1ccccc1SC[C@H](C)C#N 446158827 UNUTWZYPSBAUSF-QGZVFWFLSA-N 396.560 5.105 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H]1CC[C@@H](CC#N)C1)c1ccc(C(F)(F)F)cc1 454701565 AFPHCNILRWMEEC-JCGIZDLHSA-N 379.426 5.094 30 20 GKED CC(C)(C)[C@](C)(C#N)NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 464156132 DMMKEPOUUQCLPT-NRFANRHFSA-N 381.863 5.062 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)oc2ccc(Cl)cc12 464470628 WMZQRWCLBOVETQ-ZDUSSCGKSA-N 378.737 5.299 30 20 GKED CC(C)(C#N)CCCOc1ccc(Oc2ccc(Br)cn2)cc1 466833727 XBYCUBWBHIIZJT-UHFFFAOYSA-N 375.266 5.345 30 20 GKED N#Cc1ccc(CC(=O)Nc2cccnc2Oc2ccc(Cl)cc2Cl)cc1 469869410 FTWAKDOSUUTGQC-UHFFFAOYSA-N 398.249 5.234 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2ccccc2)ns1 475798922 PXNNFVIQWNJZLF-UHFFFAOYSA-N 376.485 5.124 30 20 GKED COc1ccc([C@@H](NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)C(C)C)cc1 480485880 VHZMYIFCOHFYEF-QHCPKHFHSA-N 393.531 5.132 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cnn([C@H](C)CC)c1C1CC1)c1ccc(F)c(F)c1 480929026 PUSWZOUQCFLWKX-BFUOFWGJSA-N 388.462 5.449 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)cc1 483465830 OZMSMGPWDLQOLO-UHFFFAOYSA-N 391.323 5.148 30 20 GKED C=C(C)[C@H](NC(=O)N1CCC(c2ccsc2)CC1)c1ccc(F)c(F)c1 486254829 IHZGCQOFWPEFLL-IBGZPJMESA-N 376.472 5.233 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)N[C@H]3CCCC(F)(F)C3)c2)cc1 494236874 HCAKZWOCTLVCDA-IBGZPJMESA-N 399.441 5.031 30 20 GKED N#Cc1ccc(CN[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c(F)c1 517723139 URDSCDKRPVDMJU-OAQYLSRUSA-N 385.269 5.883 30 20 GKED Cc1noc(C2CCC(N[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)CC2)n1 518873968 IDQQYQPQARMUPY-ULKQQTICSA-N 386.499 5.294 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cccc2c1CCC2 520835862 XXRYPLZFXUEXAY-UHFFFAOYSA-N 390.430 5.452 30 20 GKED C[C@@H]1CCCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524441104 RYPILRWHDOPDNT-OAHLLOKOSA-N 383.879 5.197 30 20 GKED CCc1ccccc1CNC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 524902517 MDTUJFAUYCEDOG-UHFFFAOYSA-N 399.494 5.216 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)CCCCc1nc2ccccc2s1 532687467 WJYWZAXMNUERRW-QHCPKHFHSA-N 391.540 5.040 30 20 GKED C=CCC[C@@H](NCc1nnc(-c2c(Cl)cccc2Cl)o1)c1ccccc1 537154239 AMLYPZONXHFQFH-QGZVFWFLSA-N 388.298 5.841 30 20 GKED COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC1(C#N)CC1 538656583 GXBBYERYUCIMRL-UHFFFAOYSA-N 386.451 5.092 30 20 GKED CC(C)c1cccc(O[C@@H](C(=O)N2CCC(CC#N)CC2)c2ccccc2)c1 541055574 UOYJYQKTMOYPSQ-HSZRJFAPSA-N 376.500 5.082 30 20 GKED C=C(C)[C@H](CC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1)OCC 541446236 MDKAAUXPEJLYGF-GIFXNVAJSA-N 393.527 5.124 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccc(C(F)(F)F)c(F)c3)no2)cc1 545699794 CZKPBJYGOTUMPB-UHFFFAOYSA-N 379.338 5.058 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 546919765 QRPKBCOPLQYCHE-CQSZACIVSA-N 377.366 5.203 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ncoc2C2CC2)cc1Cl 555320344 HYUPVQCNOBMUOE-QGZVFWFLSA-N 377.831 5.113 30 20 GKED CC(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nc1 559988978 JWCFAWFLXGCFFL-MRXNPFEDSA-N 397.887 5.136 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)cc1 561863498 NENXFRLYZZAJID-FHSBBHSISA-N 390.449 5.079 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cc(C2CC2)nc2ccccc12 580593503 AHQXRRGCWGFNFQ-UHFFFAOYSA-N 388.515 5.108 30 20 GKED Cc1nc(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)ccc1-c1ccccc1 580803435 KCZLRKNQGZQVMB-GOTSBHOMSA-N 396.494 5.361 30 20 GKED Cc1coc(C)c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 581205536 NPWOZEFTLDRRIS-UHFFFAOYSA-N 380.831 5.253 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)sc1-c1ccc(F)cc1 588348318 IRIZDLXRQIQLHN-GOSISDBHSA-N 386.451 5.901 30 20 GKED Cc1ccc(-c2ncc(C(=O)N[C@H](CCCC#N)c3ccccc3)s2)c(C)c1 590476054 GCHFHWHETPKAFA-HXUWFJFHSA-N 389.524 5.592 30 20 GKED C=CCN(C(=O)CC1(C#N)CC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 590975726 DHUKTHRBTRFKRY-UHFFFAOYSA-N 392.311 5.330 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](c1c[nH]c2cccc(F)c12)C(F)(F)F 592156184 JOCSPOWHLXEPRJ-IBGZPJMESA-N 389.396 5.501 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c(Cl)c2ccccc21 592974661 WQYMVIWOGZYQHE-GFCCVEGCSA-N 383.835 5.071 30 20 GKED N#CCC1(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)CC1 594882583 XUMHGPJOXUGENR-UHFFFAOYSA-N 384.892 5.026 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)C1 596697021 JSXOMLWMXQZGCK-INIZCTEOSA-N 383.879 5.077 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N[C@H]1CCCC[C@@H]1C 609078726 KRUCOMDZOHKSGG-KKSFZXQISA-N 377.488 5.146 30 20 GKED CCCCN(C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)C1CC1 609079049 HBNHQGHRQCRFCO-UHFFFAOYSA-N 377.488 5.242 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3c3cccs3)cc2)c1 609434537 VUOYDUQRPNXBMW-HXUWFJFHSA-N 389.480 5.781 30 20 GKED Cc1ccc(CCCNC(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 609434865 VZHDVABJDAKKLH-GOSISDBHSA-N 381.545 5.452 30 20 GKED CC[C@@H](Sc1ccccc1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 609496444 XNMZXEZQDCZVAL-GOSISDBHSA-N 379.510 5.191 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CNc3ccc(C#N)c(Cl)c3)c2)cc1 609501715 GOHWQGMVHDSKMJ-UHFFFAOYSA-N 375.859 5.385 30 20 GKED CC[C@H](CC(=O)N[C@@H](C#N)c1ccccc1Br)c1ccc(C)cc1 609994006 IXWOTUWLULHXBO-BEFAXECRSA-N 385.305 5.022 30 20 GKED C[C@H](NC(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1)c1cccc(C#N)c1 610361618 CWFGXYKGLSWWST-SNRMKQJTSA-N 387.508 5.095 30 20 GKED C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1ccccc1Oc1ccccc1C#N 611548557 AVSLVOSWVFBFKQ-GOEBONIOSA-N 388.389 5.154 30 20 GKED C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 619754645 GPTLZNCCAGGUBY-ZDUSSCGKSA-N 397.887 5.699 30 20 GKED N#C[C@H](C(=O)c1cccc2c1CCC2)c1nc(-c2c(F)cccc2F)cs1 620304553 MHFAAZQUBTZZIB-OAHLLOKOSA-N 380.419 5.067 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)c1ccc(F)c(F)c1 681374630 CUUKVJRIQAMONK-FQEVSTJZSA-N 397.425 5.676 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)c[nH]c2c1 726145383 BNSQSDWKLZEPRP-UHFFFAOYSA-N 381.435 5.322 30 20 GKED Cc1ccc(N(CCC#N)C(=O)COC(c2ccccc2)c2ccccc2)cc1 726941577 DMWXRWAYKUTAAO-UHFFFAOYSA-N 384.479 5.048 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nn1)c1ccc(Cl)c(Cl)c1Cl 727744831 MBZZXRWACOIPCD-TWGQIWQCSA-N 378.646 5.124 30 20 GKED C#CCOc1cccc(NC(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)c1 731109399 RCLALJBORPCVMQ-CYBMUJFWSA-N 377.271 5.230 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N(Cc2ccco2)C2CCCC2)cc1 731752489 HVQUNGBKDPEQEJ-DEOSSOPVSA-N 399.494 5.912 30 20 GKED O=C(/C=C/c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccccc1Cl 732714057 QOYKSTJWQFLPTM-MDZDMXLPSA-N 387.664 5.389 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@@H](C)c3cccc(F)c3)n2)cc1 734965741 OLKWBNZQFITAIJ-BEFAXECRSA-N 378.472 5.628 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CC=C(c2c[nH]c3ccccc23)CC1 735307042 XOBBQWDLAMJKKB-UHFFFAOYSA-N 377.875 5.013 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)/C=C/c2ccnc3ccccc23)c1 735439686 PZVVSYGFXVVOJL-OUKQBFOZSA-N 378.431 5.056 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 739180024 GWFPOPKBRWZCDT-KSSFIOAISA-N 380.488 5.929 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)/C=C/c3ccccc3C#N)cc2c1 739751089 LKXQCOLGAVQCHU-PKNBQFBNSA-N 396.446 5.448 30 20 GKED CCCCCSc1nc2ccc(NC(=O)N3CCC(C#N)CC3)cc2s1 743189715 OTZKUROBONJDJH-UHFFFAOYSA-N 388.562 5.346 30 20 GKED C[C@H](N[C@H](C)c1csc2ccccc12)C(=O)N(CCC#N)c1ccc(F)cc1 743475149 NYSQOXZBFJHTBN-CVEARBPZSA-N 395.503 5.026 30 20 GKED CCCOc1c(Cl)cc(/C=C\C(=O)c2c(C)nn(C(C)C)c2C)cc1OC 746346521 RAQWNEGUCQARQF-HJWRWDBZSA-N 390.911 5.428 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1C(F)(F)F 747197949 PGQAQALLMONOQK-BCNIOPEESA-N 378.419 5.565 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccccc3)c2)cc1OCCCC#N 747361608 RDROGTRDWSXKSY-OWBHPGMISA-N 397.474 5.941 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1cccc2[nH]ccc12 747387614 ZKDZTGLTXIBSHM-UHFFFAOYSA-N 389.402 5.445 30 20 GKED Cc1sc2nc([C@H](C)ON=C(c3ccccc3)C(F)(F)F)nc(O)c2c1C 751965516 NWKBFFJSBXHWHN-JTQLQIEISA-N 395.406 5.058 30 20 GKED C=CCC[C@@H](C(=O)O[C@@H](C)c1nnc(-c2cccc(C)c2)o1)c1ccccc1 753423415 RAMKCMUJUVDFIY-FXAWDEMLSA-N 376.456 5.399 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC3CC(OC(C)(C)C)C3)n2)cc1 753920328 FLPMCFRMYUDVBP-VJFUWPCTSA-N 382.529 5.279 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 760111549 MFNITDNSCCOJAK-CYBMUJFWSA-N 391.393 5.461 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H]2CCCc3c(C)ccc(C)c32)ccc1OC 769962691 JFVFBOJMEWTVIT-TZIWHRDSSA-N 378.516 5.160 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(CNC(=O)OC(C)C)cc1)c1ccccc1 777670234 UDGSHZPFIYGRJR-NRFANRHFSA-N 380.488 5.010 30 20 GKED CC[C@H](CC#N)OC(=O)c1oc2ccccc2c1CSc1nc(C)cs1 787089578 JFXZERQBCQOGJA-CYBMUJFWSA-N 386.498 5.339 30 20 GKED COc1cccc(C=Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)c1O 794834169 RKRFNKSYDRNIOS-UHFFFAOYSA-N 378.375 5.294 30 20 GKED N#C[C@@H](C(=O)CC1CC(c2ccccc2)C1)c1nc2ccccc2n1C(F)F 798817038 ULSMDEXHHNUHDM-PREGVCBESA-N 379.410 5.192 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1cc2ccccc2c(Cl)n1 801665954 LTKOLTKAROHHIX-UHFFFAOYSA-N 394.261 5.085 30 20 GKED CC[C@H](CC#N)OC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 802799854 MJTVCCIJRJFDQQ-LLVKDONJSA-N 397.327 5.630 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)CCCCCC#N)cc3C2)cc1 805194024 COSZKSBCZZLACI-UHFFFAOYSA-N 375.516 5.743 30 20 GKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccn1 810531070 FPOTWWDEKNPVRH-DLBZAZTESA-N 395.915 5.619 30 20 GKED O=C(/C=C\c1cnn(CC(F)F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 814188921 XZGVFPBDTIUTRJ-UPHRSURJSA-N 398.253 5.082 30 20 GKED CCOc1ccc(OCC)c(NC(=S)N[C@@H](CCCC#N)c2ccccc2)c1 814210515 QCXNKUPVJKUZIP-IBGZPJMESA-N 397.544 5.206 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Br)s2)cc1 915180998 VNACWQAISJDJJP-INIZCTEOSA-N 397.297 5.418 30 20 GKED COc1cc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)cc([N+](=O)[O-])c1O 916131373 BIXUVJWCZNRIFO-VURMDHGXSA-N 389.363 5.105 30 20 GKED C=CCN(C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1)C(C)C 916713013 LOEIYHYHKDGKBX-UHFFFAOYSA-N 391.943 5.173 30 20 GKED CC(C)c1cccc(OCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046418 JUGXUTPZYMKLHK-INIZCTEOSA-N 384.888 5.328 30 20 GKED CCOc1ccc(O)c(C=Nc2cccc(COCc3ccc(OC)cc3)c2)c1 921138626 VZMBGYKJINNDCM-UHFFFAOYSA-N 391.467 5.267 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2C(=O)O)c1)c1ccc(F)c(F)c1 1776126004 ZHYSBLLCOOMNAB-FLIBITNWSA-N 394.373 5.138 30 20 GKED C=CCN(Cc1ccc(C)cc1)Cc1csc(-c2ccc(C(=O)O)cc2)n1 1776179944 JUVCEURBEMRKPG-UHFFFAOYSA-N 378.497 5.005 30 20 GKED CCc1ccc(-c2ccc(/C=C/C(=O)c3cccc(O[C@H](C)C(=O)O)c3)o2)cc1 1776964249 YMRKTDAEVCTXFS-SICOMBFOSA-N 390.435 5.257 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(C)C)oc2c1ccc1ccccc12 65839429 YNTRBRWWVZAFQA-UHFFFAOYSA-N 384.435 5.806 30 20 GKED CCOc1cccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)c1 107722608 RRNMVHGYSJJAML-UHFFFAOYSA-N 388.492 5.038 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H]1CCCc2ccccc21 107807209 HZSQESOUSAMYDD-NRFANRHFSA-N 383.451 5.113 30 20 GKED N#C[C@@H](C(=O)c1cccc(OC(F)F)c1)c1nc2cc(Cl)ccc2s1 120006124 PCTYCRTYKOCODM-LBPRGKRZSA-N 378.787 5.041 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)c3cc(Cl)sc3Cl)s2)cc1 121458760 LCUIHNCXLJRUQE-UHFFFAOYSA-N 394.308 5.226 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)Nc1cccc(C#N)c1 126862601 GQTXYUYEMDSWIJ-OAHLLOKOSA-N 376.485 5.215 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 128407890 PTHJVRVJUNUYGB-FUHWJXTLSA-N 384.549 5.322 30 20 GKED Cc1nc(CNc2ccccc2SC[C@H](C)C#N)oc1-c1ccc(Cl)cc1 129974320 KUQCNDPUMDJQOX-CQSZACIVSA-N 397.931 6.167 30 20 GKED Cc1ccc(C(=O)N[C@H](CCC#N)c2ccccc2)cc1NC(=O)OC(C)(C)C 153699819 YDWNHHVIQMBQKE-LJQANCHMSA-N 393.487 5.117 30 20 GKED C[C@H](N[C@@H]1CCCc2nc(-c3ccccc3F)sc21)c1ccc(C#N)cc1 154330997 UWXULYZVKXNHBT-IFXJQAMLSA-N 377.488 5.549 30 20 GKED CCCc1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)s1 173988446 AHDWFKGSZYQUMM-ZDUSSCGKSA-N 387.917 5.363 30 20 GKED C[C@@H](Sc1ccccc1C#N)c1nnc(-c2ccc(Cl)cc2Cl)o1 176754853 NZGBOJNHUWZXND-SNVBAGLBSA-N 376.268 5.768 30 20 GKED CCCCOc1ccc(C(=O)Nc2nc(C)c(SCC#N)s2)c(Cl)c1 185228128 WDQFLWJDTITEMF-UHFFFAOYSA-N 395.937 5.152 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccccc1Cl)c1nc(-c2ccc(Cl)cc2)cs1 301767138 WMVWWNNFMBDOQT-JCVNQNCUSA-N 399.302 6.007 30 20 GKED C[C@H](C/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)/N=C(/O)C1CCCC1 329535791 ZRROYFSSXYGCGK-DNVCBOLYSA-N 386.540 5.257 30 20 GKED C=CCOc1ccc(/C=C2\CCn3c2nc2sc(C)c(C)c2c3=O)cc1Cl 409712291 OJTUJDVUOSSWMT-XNTDXEJSSA-N 398.915 5.237 30 20 GKED C=CC[C@@H](CC)NC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 410114882 DFKARQSOVCLYFO-CYBMUJFWSA-N 394.899 5.186 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H]3CCCC[C@H]3C2)cc1 429076327 HNTLQZVLZBCDNV-HDICACEKSA-N 391.471 5.013 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2cc(Cl)cc(C(F)(F)F)c2)s1 430600535 SFKPVJUHWKMZMA-LBPRGKRZSA-N 386.826 5.603 30 20 GKED C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)Nc1ccc(F)cc1C#N 433974966 DCIOSOBGVCKWLA-LLVKDONJSA-N 385.851 5.018 30 20 GKED CC(C)(C#N)CCCCSCc1csc(COc2ccc(F)cc2)n1 435883937 NKDMVRDHLDAKHO-UHFFFAOYSA-N 378.538 5.814 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)c2cn(CCCC#N)c3ccccc23)c1 436038186 WIZSYNNTYCPPCR-SFHVURJKSA-N 389.499 5.223 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2)c1ccccc1 439296718 OPRJIFANFXSOLZ-IBGZPJMESA-N 391.471 5.285 30 20 GKED CC(C)(C#N)CCCSCc1ccnc(-c2ccc(Br)cc2)n1 441406131 DIWDDFDODGSBEH-UHFFFAOYSA-N 390.350 5.469 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)CS[C@H](C)c1cccc(C#N)c1 443135284 CGYUECDVUUUBDA-UZLBHIALSA-N 382.529 5.019 30 20 GKED C=CCOCCCC(=O)N(c1ccc(CC)cc1)c1nc2ccccc2s1 443829057 ZOYDPCVQURVXHB-UHFFFAOYSA-N 380.513 5.506 30 20 GKED CC(C)N(C)c1ccccc1CNC(=O)Nc1ccccc1S[C@H](C)CC#N 446143111 FYZHRVGZLKTEHK-QGZVFWFLSA-N 396.560 5.247 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCCC2CC(F)(F)C2)cc1 457213584 KTKDTLNBJUTWQG-UHFFFAOYSA-N 386.467 5.016 30 20 GKED CCC1(c2ccccc2)CN(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 459394616 HCSYJUJJSCCOAW-QGZVFWFLSA-N 379.529 5.276 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)S[C@@H](C)c1ccccc1OC 463196588 DKNQUJREHVSSAU-JKSUJKDBSA-N 375.559 5.154 30 20 GKED N#Cc1cccc(CCN[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)c1 467447180 HDSSXCOACCJGFH-RUZDIDTESA-N 381.454 5.167 30 20 GKED Cc1ccc(CN(C(=O)c2cn(CCCC#N)c3ccccc23)C(C)C)s1 469205568 SUZDEZNDSICOFT-UHFFFAOYSA-N 379.529 5.366 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1cc(C)n(-c2ccc(Cl)cc2Cl)n1 471172684 ITSZCWHRLPSYJJ-UHFFFAOYSA-N 393.318 5.032 30 20 GKED CCc1c(NC(=O)c2ccc(C(C)(C)C#N)cc2)cnn1-c1cccc(Cl)c1 477011487 LKRXDWZWCINACN-UHFFFAOYSA-N 392.890 5.142 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](C)c1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 477042455 ILFRMCWPWBHGFP-VBKZILBWSA-N 397.425 5.297 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(C)(C)C)s1 477340603 ISNKHQQTTBZJRI-UHFFFAOYSA-N 391.496 5.665 30 20 GKED C=C(C)[C@H](NC(=O)N(C)[C@@H](C)c1ccc(F)c(F)c1)c1ccc(F)c(F)c1 477755314 PCTINKZCBBQXDN-BUXKBTBVSA-N 380.385 5.263 30 20 GKED Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)o1 480639004 UWNOATZRKGJLMT-MLGOLLRUSA-N 389.402 5.066 30 20 GKED CCCOc1nc(C(=O)[C@H](C#N)c2nccc3ccccc23)cc2ccccc12 483229238 NVSXMCDVZJJTGA-HXUWFJFHSA-N 381.435 5.062 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 496286983 VNYDZXURIWDUOK-QHCPKHFHSA-N 385.467 5.215 30 20 GKED C=C(C)CN(CC)C(=O)[C@H](C)SCc1coc(-c2ccc(Cl)cc2)n1 497846598 MGGXLMHPIIGNMK-AWEZNQCLSA-N 378.925 5.041 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](Cc1ccccc1)c1ccccc1 503845383 KOMDOMZTKXPYTA-RUZDIDTESA-N 397.522 5.464 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)Cc1cccc(F)c1)c1ccccc1 504338642 MUKUUKXCLCANBA-GOSISDBHSA-N 387.458 5.170 30 20 GKED CC[C@](C)(C#N)C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 505163771 IBHDZPUQPJBQOC-VGOFRKELSA-N 379.891 5.009 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Nc3cc(Cl)ccc3C)n2)cc1 505777006 MZDNJTBOPIENQC-INIZCTEOSA-N 381.888 5.326 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)Cc2ccccc2)cc1 508281843 STJOBZHECMSCJK-UHFFFAOYSA-N 387.439 5.023 30 20 GKED N#Cc1ccc(CCC(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)cc1 510892719 ILUDDICXYUMGJV-UHFFFAOYSA-N 385.294 5.114 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)cc1 511788407 ADARPJHGEZVPBJ-DEOSSOPVSA-N 390.458 5.452 30 20 GKED C[C@@H]1CCc2[nH]c3ccc(C(=O)[C@@H](C#N)c4ccc(C(F)(F)F)cn4)cc3c2C1 513158219 ADHCVRFFKFPOEN-PXAZEXFGSA-N 397.400 5.197 30 20 GKED N#Cc1c(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)sc2c1CCC2 518073759 FZMCYJWYUVWASV-QWHCGFSZSA-N 377.296 5.157 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc4ccccc4c3)n2)cc1 518516778 YDTYNVDLPHMIFO-FQEVSTJZSA-N 384.460 5.462 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(Cl)c1 518685112 ZVZVGUXJSNLWRM-HUUCEWRRSA-N 387.936 5.817 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 520100853 YNUJGTVNIGTDMC-UHFFFAOYSA-N 392.846 5.170 30 20 GKED Cc1ccnn1-c1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 520917208 SLUVWGOYJBQWTR-UHFFFAOYSA-N 394.434 5.097 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 520924444 WQLNEMFRSBTGMF-LJQANCHMSA-N 396.556 5.886 30 20 GKED C=CC1CCN(C(=O)c2oc3ccccc3c2CSc2cccs2)CC1 521095929 YCUIBYPZEFWCIK-UHFFFAOYSA-N 383.538 5.825 30 20 GKED C[C@@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2C(F)(F)F)s1)C(C)(C)C 523715829 ZYQCZAKYPLNFMI-NSHDSACASA-N 395.450 5.245 30 20 GKED CCc1cccc(C)c1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 523878502 WFAJSYZWVFGSCM-UHFFFAOYSA-N 390.870 6.127 30 20 GKED N#Cc1ccc(C2(NCc3cc(Cl)cc(C(F)(F)F)c3)CCOCC2)cc1 527810868 NXDULJYVLALNEK-UHFFFAOYSA-N 394.824 5.026 30 20 GKED Cc1cc([C@@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)C2CC2)ccc1F 534732812 LIVQAPWCVJCMIX-BTYIYWSLSA-N 397.519 5.801 30 20 GKED C=CCC[C@H](NC1CCC(O)(C(F)(F)F)CC1)c1ccc(C(F)(F)F)cc1 536840947 VKLWWWGXVDIDQU-CGZBRXJRSA-N 395.387 5.538 30 20 GKED C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 537947523 XRYFIEKCUHYCHF-BEFAXECRSA-N 378.463 6.037 30 20 GKED COc1cccc([C@@H](N[C@H](C)c2cccc(C#N)c2)c2ccccc2Cl)c1 540595874 GWVWAZATJFSHLR-WAIKUNEKSA-N 376.887 5.660 30 20 GKED CSc1cccc(NC(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)c1 541073852 KXVMREKAGQKRLC-UHFFFAOYSA-N 382.432 5.030 30 20 GKED Cc1ccccc1-c1cnc(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)o1 542017349 QGRZZMLXNKJPFL-IBGZPJMESA-N 393.490 6.040 30 20 GKED C[C@@H](Sc1ccc(C#N)c(C(F)(F)F)c1)c1nnc(-c2cccs2)o1 543860745 IUSNPWRLNLQYDW-SECBINFHSA-N 381.404 5.542 30 20 GKED Cc1nc(C2CC2)oc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 544684638 MCLPTXCJRGWMNP-ZDUSSCGKSA-N 383.517 5.197 30 20 GKED C[C@@H](c1ccncc1)c1noc(-c2ccc(Sc3ccccc3C#N)cc2)n1 546510633 ZIBZGKUWGHRDIF-HNNXBMFYSA-N 384.464 5.306 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1nc2ccccc2n1C1CC1 554957836 YYGFEKTWHJGVJV-UHFFFAOYSA-N 388.515 5.545 30 20 GKED Cc1sc(NC(=O)CCc2ccc(C#N)cc2)nc1-c1cccc(Cl)c1 556680755 WUPTVSJLXQZVTI-UHFFFAOYSA-N 381.888 5.215 30 20 GKED N#Cc1c(NC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)sc2c1-c1ccccc1OC2 560681999 AHJQFSCITQWEOO-MNOVXSKESA-N 392.402 5.096 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC2(CCCCC2)C1 570892417 QCXPPZXWVBYCJE-UHFFFAOYSA-N 375.472 5.457 30 20 GKED N#C[C@H]1CC[C@@H](NC(=O)c2oc3ccccc3c2CSCc2ccccc2)C1 576151451 WGWOVEVLAWTQBR-ZWKOTPCHSA-N 390.508 5.288 30 20 GKED O=C(C1CC(c2cccc(F)c2)C1)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 576476748 AILDUNNPEJHQHX-CXTZMWEQSA-N 397.334 5.051 30 20 GKED C=CCCO[C@H](C)c1nc([C@@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 577680845 WYHSFOWMISQTOB-ABAIWWIYSA-N 388.361 5.007 30 20 GKED N#C[C@@]1(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)CC12CCCC2 577933163 QJTRGDGHGYCTGC-JOCHJYFZSA-N 393.874 5.005 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC(C)(C)[C@@H]1C1CC1 583292389 HLXSDHZAQUGLTD-QFIPXVFZSA-N 389.499 5.098 30 20 GKED N#CCn1c(C(=O)N(Cc2ccc(F)cc2Cl)CC2CC2)cc2ccccc21 586866565 AOGOBEVZMOQHIO-UHFFFAOYSA-N 395.865 5.010 30 20 GKED Cc1csc(NC(=O)c2cc(C3CC3)nc3onc(CC(C)(C)C)c23)c1C#N 589035327 QRHSLLFYFOOCMH-UHFFFAOYSA-N 394.500 5.183 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@@H](CCF)C1 596724801 VNKXWESIULPNCO-SFHVURJKSA-N 395.478 5.049 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 596777783 AVQMXZCUEAJQJJ-HDICACEKSA-N 377.419 5.205 30 20 GKED CCCCn1c(S[C@@H](C#N)Cc2ccccc2)nc2sc(C)c(C)c2c1=O 603998248 ZWVDMMRRNJLMCJ-QGZVFWFLSA-N 397.569 5.102 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3sccc3-c3ccccc3)cn2)cc1 604241881 UAFWQOGPRWFLCH-UHFFFAOYSA-N 397.459 5.726 30 20 GKED N#Cc1c(NC(=O)Cc2cc3ccccc3o2)sc2c1-c1ccccc1CC2 604387724 AXZOXRKTLHLDJD-UHFFFAOYSA-N 384.460 5.313 30 20 GKED C[C@H](C(=O)NCCSCc1ccccc1C#N)c1c(Cl)cccc1Cl 604565511 SWJYDUJKHHQSCK-ZDUSSCGKSA-N 393.339 5.018 30 20 GKED C=CCCCCCN(C)C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 606816918 ZRIFRKRFLUDLPT-UHFFFAOYSA-N 395.528 5.187 30 20 GKED C=CCCO[C@@H](C)C(=O)N1CCC[C@H]1c1nc(-c2ccccc2)c(C(C)C)o1 607040548 XACNNAOPWBIYQW-HKUYNNGSSA-N 382.504 5.110 30 20 GKED C[C@H](S[C@@H]1CCCc2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2 608801718 JWGMNGOLCOUWFR-SCLBCKFNSA-N 382.554 5.246 30 20 GKED CC[C@@H](C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C)c1ccccc1 609062095 XDEILNNRJFQJMS-HSZRJFAPSA-N 384.479 5.578 30 20 GKED N#CCn1c(C(=O)Nc2cccc(CSc3ccccn3)c2)cc2ccccc21 609169710 GIBQTUVAFUDGHK-UHFFFAOYSA-N 398.491 5.104 30 20 GKED N#CCn1c(C(=O)N(Cc2c(F)cccc2F)C2CCCC2)cc2ccccc21 609175450 FYWOJGTVDHAGDE-UHFFFAOYSA-N 393.437 5.028 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(Cc2ccccc2)n1 609376848 KYYXUNDPIXCOPQ-HNNXBMFYSA-N 393.537 5.238 30 20 GKED C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1ccccc1Oc1ccccc1C#N 611548558 AVSLVOSWVFBFKQ-HOCLYGCPSA-N 388.389 5.154 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(Cl)cc2)n1)c1ccc2ccccc2n1 613290844 NYUUNKGRLULTAR-MRXNPFEDSA-N 389.867 5.502 30 20 GKED C[C@@H]1CCc2c(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)csc2C1 613392142 JQOQRXXAXQLNCM-CZUORRHYSA-N 378.522 5.486 30 20 GKED CCOC(=O)c1ccc(-c2ccc(CN[C@H](CCC#N)c3ccccc3)o2)cc1 614245880 ZHQSKHFXNJHEOH-JOCHJYFZSA-N 388.467 5.258 30 20 GKED COc1ccc(CSc2nnc(SCc3ccc(C#N)cc3C)s2)cc1 614398126 IZTCDAKKLLEYIF-UHFFFAOYSA-N 399.566 5.311 30 20 GKED CC[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(C#N)cc1 618562059 VCRBVAWHWBDWPM-DZKIICNBSA-N 378.360 5.508 30 20 GKED CCc1nnc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)s1 647634073 MYPHJEVGLBAFFN-UHFFFAOYSA-N 387.324 5.002 30 20 GKED N#C[C@H](C(=O)c1ncccc1Oc1ccccc1)c1nc2cc(F)ccc2s1 669601548 SWQLRLKBUWYAHC-OAHLLOKOSA-N 389.411 5.113 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 684632061 PKGOQZVXYHDKLN-AWEZNQCLSA-N 391.427 5.143 30 20 GKED O=C(NC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1c(F)cc(C(F)(F)F)cc1F 685778741 TZJCGHPBPFFFHC-DTWKUNHWSA-N 389.286 5.082 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)C[C@H](C)c3ccc(C(F)(F)F)cc3)[nH]c12 735792120 HUNFPWOKTFDLSM-XJKSGUPXSA-N 385.389 5.260 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1C#N 742366988 ABPUXOJZSLFEDZ-INIZCTEOSA-N 376.431 5.349 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1NC(=O)OC(C)(C)C 747199583 XOBOEHTXQCRGRF-OAHLLOKOSA-N 399.516 5.412 30 20 GKED C[C@@H]1CCC[C@H](CC(=O)[C@H](C#N)C(=O)Nc2ccccc2Oc2ccccc2)C1 750667754 KUWAXBTWQCXFNT-HBFSDRIKSA-N 390.483 5.343 30 20 GKED CC(C)c1nc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)co1 752886129 HFXLRZZPJBDZRH-ZHACJKMWSA-N 394.858 5.600 30 20 GKED N#CC1CCC(COC(=O)c2ccccc2C(=O)c2ccc(Cl)cc2)CC1 755966208 OSYBUEIQZIQNKB-UHFFFAOYSA-N 381.859 5.058 30 20 GKED C#CCCCCCC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 766131554 NXWLJAIMHVCGFT-UHFFFAOYSA-N 386.854 5.254 30 20 GKED COc1ccc(-c2ccc(C(=O)Nc3ccc(C#N)cc3Cl)c(F)c2)cc1 769729321 HIHOCLIZPCIQRG-UHFFFAOYSA-N 380.806 5.279 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](c2ccc(Br)cc2)C2CC2)c1 774449379 PEOSTKWQLAATDY-PZJWPPBQSA-N 399.332 5.371 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc(CF)cc1 776905387 AJOGBKADKSPCFI-OAHLLOKOSA-N 388.533 5.280 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2cccc(Br)n2)cc1 777917585 DKRKWZMEDYOHIF-YPKPFQOOSA-N 394.268 5.416 30 20 GKED COc1ccc(/C=C\C(=O)c2cc3ccccc3s2)cc1OCCCC#N 780189190 VBJXSMCEEIKRIS-NTMALXAHSA-N 377.465 5.489 30 20 GKED CCc1oc2ccccc2c1C=Nn1c(S)nnc1CSc1ccccc1 782245832 QJBRQCDUJJYMMZ-UHFFFAOYSA-N 394.525 5.050 30 20 GKED Sc1nnc(CSc2ccccc2)n1N=Cc1c(Cl)cccc1Cl 782246417 YMYFZSDATIVUJK-UHFFFAOYSA-N 395.340 5.048 30 20 GKED C[C@@H](ON=C(c1ccccc1)C(F)(F)F)c1nnc(-c2ccccc2F)s1 784670252 CPAKAQGCAKOZCB-LLVKDONJSA-N 395.381 5.388 30 20 GKED C#CC[C@@H](NC(=O)NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 790797992 ZUGFFDQPEZVRGL-LJQANCHMSA-N 395.915 5.027 30 20 GKED Cc1nn(-c2ccccn2)c(Cl)c1C=NN[C@@H](C)c1ccc(C(C)C)cc1 794896498 LTIFNGXSNBEZIC-HNNXBMFYSA-N 381.911 5.037 30 20 GKED N#CC[C@H](CC(=O)OCc1cccc(C(=O)Nc2ccccc2)c1)c1ccccc1 795985481 LEDQUOZMEILKCF-OAQYLSRUSA-N 398.462 5.070 30 20 GKED C=C(C)[C@H](NCc1cnc(NC(=O)OC(C)(C)C)s1)c1ccc(F)c(F)c1 800263943 IRDLGUKUUHTJQI-INIZCTEOSA-N 395.475 5.175 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](Oc2ccc(Cl)cc2)C(C)C)n1 813072953 QHDCUQRWPUBXIT-MAUKXSAKSA-N 376.909 5.200 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccc2ccccc2c1 813215300 WJZUUXKWLVNCSN-GOSISDBHSA-N 382.385 5.408 30 20 GKED C[C@]1(C#N)CC[C@@H](OC(=O)C2=NN(c3ccccc3)[C@H](c3ccccc3)C2)CC1 836159661 AGENWGYOZNOXFM-ODGPQVTHSA-N 387.483 5.010 30 20 GKED O=C(O[C@H](c1ccc(C(F)(F)F)cc1)C(F)(F)F)c1ccc(C(F)F)nc1 847054099 UKBXNQNUKLLUNP-GFCCVEGCSA-N 399.237 5.498 30 20 GKED N#C[C@H](C(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@H]21)c1nc2cc(C(F)(F)F)ccc2s1 860478303 VCMZULOFHUTWLP-DTTOXWODSA-N 398.409 5.077 30 20 GKED CCOCCCCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 870158185 DMEMLKSFQUEGRG-ZDUSSCGKSA-N 384.423 5.088 30 20 GKED CCOc1cccc(/C=N/C2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1O 914703693 XFFMUELOZDDMSD-TZPQHZNJSA-N 383.332 5.119 30 20 GKED COc1ccc(C(=O)/C=C\c2cc3cccc(OC)c3o2)cc1Br 916134325 GPPSWCAYQLLBBC-FPLPWBNLSA-N 387.229 5.109 30 20 GKED O=C1/C(=C/c2csc(-c3cccc(Br)c3)n2)Cc2ccccc21 916137112 LMOVTMMXEFKGFJ-GXDHUFHOSA-N 382.282 5.395 30 20 GKED Cc1cccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccc(Cl)cc3)s2)c1 916896980 GCYFFSVWEIKCEN-QGZVFWFLSA-N 394.883 5.338 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1cccc(Oc2ccccc2)c1 916908162 ZCAFERKYBOCNSW-SFHVURJKSA-N 390.826 5.093 30 20 GKED CC(=NOCC(=O)Nc1c(C)cccc1C)c1ccc(-c2ccc(F)cc2)s1 917403178 SWECBNRYERQDKG-UHFFFAOYSA-N 396.487 5.550 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3sccc3s2)cc1 918486113 CTOBGFTXEDITPA-SWLSCSKDSA-N 382.510 5.437 30 20 GKED Cc1cc(C(=O)Nc2cccc(OCCCC#N)c2)c(C)n1Cc1ccccc1 918635707 YRLINRSNDRQUGF-UHFFFAOYSA-N 387.483 5.088 30 20 GKED C=CCN(C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1)C(C)C 920920777 KINZNSWKAQMKLH-IBGZPJMESA-N 387.321 5.145 30 20 GKED O=C(O)c1cccc(NN=Cc2cc(F)ccc2Oc2cc(F)cc(F)c2)c1 1776037905 IIAYJLJIXXNHME-UHFFFAOYSA-N 386.329 5.040 30 20 GKED Cc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1[N+](=O)[O-] 1776115913 MTEIGEXNJRFPMA-CLFYSBASSA-N 393.420 5.226 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C/c2cncc(C(=O)O)c2)cc1 1776125711 QVQLHGGDJMKFFI-SNQZOLJRSA-N 381.472 5.271 30 20 GKED C=CCOc1ccc(CNc2ccc(S[C@@H](C)C(=O)O)cc2)cc1Cl 1776184588 PSBAADXOIFUQFE-ZDUSSCGKSA-N 377.893 5.082 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1c(F)ccc3sc(C(=O)O)cc13)CC2 1776374710 UXBSCBGSRTXTEB-XNTDXEJSSA-N 394.467 6.075 30 20 GKED CCSc1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776951544 WUNORVXIJGLIBI-WDZFZDKYSA-N 378.449 5.653 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(C(=O)O)cc2Cl)ccc1SC(F)F 1777263616 ZLDBVIBLWDPZGX-XQRVVYSFSA-N 398.814 5.258 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(-c3ccc(F)cc3)no2)n1 32327798 SRIDSURLCPQBEI-UHFFFAOYSA-N 393.365 5.367 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 41536525 ATCAMKWGVZMNOH-KRWDZBQOSA-N 385.448 5.264 30 20 GKED COCc1c(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)oc2ccccc12 55428550 UPVBTYXWKXRDRC-UHFFFAOYSA-N 398.418 5.495 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)Cc2ccccc2Cl)cc1 55823531 YJHWRGVJPCKSSM-UHFFFAOYSA-N 390.870 5.166 30 20 GKED COC(=O)c1ccc(-c2nc(-c3cn(CCC#N)c4ccccc34)cs2)cc1 65975341 KABWEHVMVGLYJZ-UHFFFAOYSA-N 387.464 5.132 30 20 GKED COc1ccc2oc([C@H](C)NCc3cccc(OCCCC#N)c3)c(C)c2c1 106472149 VKNYCFGOIJEBCQ-KRWDZBQOSA-N 378.472 5.283 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2c(C)oc(C)c2C)cc1 116525181 RFLREWIPJCCGNE-UHFFFAOYSA-N 376.412 5.130 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c1 134686435 TWNKSHRLGHAXED-UHFFFAOYSA-N 399.475 5.047 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F)c1ccc(Cl)c(Cl)c1 161221621 VQTYOPODMRMXFQ-MJVIPROJSA-N 379.209 5.043 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 163375649 IHXKTYDLIYVTHF-POAQFYNOSA-N 395.528 5.123 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCO[C@H](c2ccccc2)C1 163375782 IHXKTYDLIYVTHF-QRFRQXIXSA-N 395.528 5.123 30 20 GKED CCCOc1ccc(CCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 173999825 MFXHRKDIRKGODR-KRWDZBQOSA-N 397.425 5.029 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccc(C)cc2)cs1)c1ccc(F)cc1F 208894435 SAZCEQRJJXRSSM-NTMALXAHSA-N 398.434 5.310 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)ccc1OC(F)F 210432072 WVIJGXDYECPYSE-WZUFQYTHSA-N 387.426 5.183 30 20 GKED C=CCOc1ccc(/C=C(/CCC(=O)O)c2nc3ccccc3s2)cc1OC 213365325 LZADKCHHVUQXKP-SSZFMOIBSA-N 395.480 5.275 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)/C=C\c1nc2ccccc2s1 255443465 PTUCLIRODJNJFL-IWMPZKFUSA-N 379.510 5.342 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CCCC1 303319015 SZMHUESBQSKNCB-MRXNPFEDSA-N 398.959 6.042 30 20 GKED OC(=Nc1c[nH]nc1[C@@H]1CCCN([C@H]2CCCc3ccccc32)C1)C1CCCC1 329314677 CMEHBRJYGZSHTC-KNQAVFIVSA-N 392.547 5.445 30 20 GKED O/C(CC1(Cc2nc3ccccc3s2)CCCCC1)=N/C[C@@H]1CC[C@H](O)C1 330016351 PKNMKYDRTYMPHR-SJORKVTESA-N 386.561 5.297 30 20 GKED Cc1c(/C(O)=N/[C@H]2CCOC3(CCCCC3)C2)cnn1-c1ccc(Cl)cc1 330199349 VHXUKJASEWGAKO-KRWDZBQOSA-N 387.911 5.021 30 20 GKED CCc1c(NC(=O)c2ccccc2-c2ccccc2C#N)cnn1CCC(C)C 427214587 BQKYKHFVERMEOC-UHFFFAOYSA-N 386.499 5.283 30 20 GKED CC(C)c1ccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)cc1 433012907 MEGAPIOWONVNAN-HSZRJFAPSA-N 389.568 6.458 30 20 GKED CS[C@H]1CCCCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)C1 435595110 UEKBXFDJNFZAFU-FQEVSTJZSA-N 381.501 5.100 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Br)c1)c1nc2ccccc2s1 437550779 SFKWTIXVOLYRLV-LBPRGKRZSA-N 391.677 5.202 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 438638280 CYSLOEIKWKGCRN-UHFFFAOYSA-N 395.478 5.463 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)NCC1CCC(C#N)CC1 440985350 DSLQEXYJRYUXJF-AOCRQIFASA-N 396.560 5.151 30 20 GKED Cc1cccc(-c2cnc([C@@H]3CCCN3c3ccc(C(F)(F)F)c(C#N)n3)[nH]2)c1 443510039 MLLARSFATFQSGO-SFHVURJKSA-N 397.404 5.012 30 20 GKED N#Cc1ccc(C2(C(=O)Nc3nc(-c4ccccc4Cl)cs3)CC2)cc1 444009834 PDVRIAXASJLTIK-UHFFFAOYSA-N 379.872 5.005 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798139 HGBHTJISJJBBMP-MJGOQNOKSA-N 398.576 5.713 30 20 GKED CC(C)c1c(NC(=O)[C@@H](C)c2cccc(C#N)c2)cnn1-c1ccc(Cl)cc1 462341514 QARSCQYWTILTJK-HNNXBMFYSA-N 392.890 5.263 30 20 GKED CCCc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 468888458 GUSDSLFMWPENOD-SFHVURJKSA-N 375.516 5.395 30 20 GKED C=C(C)CN(CC(=O)Nc1c(Cl)cccc1C(F)(F)F)Cc1ccccc1 470917844 NOCSLCKYAJRIMF-UHFFFAOYSA-N 396.840 5.376 30 20 GKED N#Cc1cccc(-c2nnc(CNc3ccccc3Sc3ccccc3)o2)c1 471606685 PNUNAGPEGGBGOD-UHFFFAOYSA-N 384.464 5.372 30 20 GKED CSc1cccc(C)c1NC(=O)c1ccc(COc2ccc(C#N)cc2)o1 472247392 DLPXKKYCVILWMD-UHFFFAOYSA-N 378.453 5.013 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccccc2CN2CCc3ccccc32)cc1 474954451 NXZYKZNBVFGHFH-UHFFFAOYSA-N 395.506 5.303 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CC(=O)OC)c1ccc(F)cc1 475553014 NTVHGFLEDAGSEA-FQEVSTJZSA-N 398.478 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)Cc1ccc(OC)c(OC)c1 475556322 PMRPMOKQJFRONQ-QGZVFWFLSA-N 396.531 5.308 30 20 GKED CC(C)[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(F)ccc1F 479457721 RMVLSMUYJVMNNO-QHCPKHFHSA-N 397.469 5.357 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CCOCC1 479794419 ABVUOPPMBIJKFO-UHFFFAOYSA-N 398.890 5.395 30 20 GKED C[C@H](NC(=O)Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)c1ccc(C#N)cc1 480354040 WTWTYHVWZYAQBK-IEGUWTFLSA-N 391.515 5.536 30 20 GKED C[C@H](c1c(F)cccc1F)N(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 482629787 ALWVABYTCLXLNV-OAHLLOKOSA-N 392.405 5.462 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(OC(F)F)c(F)c3)c2)cc1 483015577 AACGSVJCSIJGDL-UHFFFAOYSA-N 398.340 5.343 30 20 GKED COc1ccc(C)c2c1N(C(=O)c1cccc(Oc3ccc(C#N)cc3)c1)CCC2 484317570 JHEKYSUUQPGYGO-UHFFFAOYSA-N 398.462 5.261 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(COCc2ccco2)c1 485373522 MZIJTXSCJFUYFA-UHFFFAOYSA-N 382.504 5.597 30 20 GKED Cc1ccccc1-c1cc(NC(=O)c2ccccc2-c2ccccc2C#N)n(C)n1 486510493 RUPYKRPYYXMSLD-UHFFFAOYSA-N 392.462 5.187 30 20 GKED COc1ccc(CN[C@@H]2CCC[C@H](c3ccccc3)C2)cc1OCCCC#N 486904101 SCTRFHCPPKPCJA-FCHUYYIVSA-N 378.516 5.194 30 20 GKED COc1ccc2c(c1)CCC[C@H]2CC(=O)N[C@@H](CCCC#N)c1ccccc1 487537916 OBGVUPYOSISZDY-REWPJTCUSA-N 376.500 5.057 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 489377193 FZHWKBBLSIAUIF-QHCPKHFHSA-N 390.531 5.542 30 20 GKED CC(C)c1nn(C)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 490997201 RTCQKXSSDVJVFO-UHFFFAOYSA-N 394.862 5.113 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(S[C@H](C)CC)cc1C 498834937 GURQCQAEORHYJN-GOSISDBHSA-N 393.556 5.977 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@@](C)(C#N)CC(=O)OC(C)(C)C)c(C)c1 503055185 OKHMPSGVKFSGQA-QVKFZJNVSA-N 390.549 5.086 30 20 GKED O=[N+]([O-])c1cccc(F)c1CN[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 505834628 USVAWJANJNJWRK-AWEZNQCLSA-N 396.262 5.146 30 20 GKED CCc1cccc2c1OCC[C@@H]2NC(=O)c1ccccc1-c1ccccc1C#N 506981403 JEIXPVVVILIERE-QHCPKHFHSA-N 382.463 5.041 30 20 GKED COc1cccc(COc2cccc(Cl)c2CN2CCC(C)(C#N)CC2)c1 507718656 KGTPZAXWFPSVRP-UHFFFAOYSA-N 384.907 5.053 30 20 GKED CC(C)(C)c1ccc(Cn2nccc2NC(=O)c2cc(C#N)ccc2Cl)cc1 509225744 OTLGWZQWUDURAF-UHFFFAOYSA-N 392.890 5.006 30 20 GKED CCOc1ccccc1CNC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510703911 SWEGWTFFWLHHON-UHFFFAOYSA-N 387.439 5.071 30 20 GKED CCc1cc(C#N)c(NC(=O)CSCc2ccc(Cl)cc2Cl)s1 512644502 PHQZBAWYWCCQDP-UHFFFAOYSA-N 385.341 5.361 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3ccc(C#N)cc3F)s2)cc1 512674438 XKVUYYSSDKTPBB-CABCVRRESA-N 379.504 5.850 30 20 GKED C[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1c(F)cccc1F 513638402 RVNAWNQXXQDJKP-INIZCTEOSA-N 378.422 5.266 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCC1 517532123 KVXJMPDZFKAWPI-HRAATJIYSA-N 379.529 5.744 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)Nc1cccc(C#N)c1 517865959 YSLKICAWZAXCSL-CYBMUJFWSA-N 380.448 5.012 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCc1c(F)cccc1Cl 518681729 HQCBDRRIGURZLV-GFCCVEGCSA-N 377.872 5.053 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N(C3CC3)[C@@H]3CCc4ccccc43)cc2)nc1 521090288 FWHFFUUNCUJNQI-HSZRJFAPSA-N 395.462 5.038 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cs1 522088741 DZDXRWOEXRXKLX-CQSZACIVSA-N 392.484 5.252 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cnc4ccsc4c3)c2)cc1 524662685 AASYZHPTGWVIMT-UHFFFAOYSA-N 399.475 5.194 30 20 GKED COc1cc(-c2ccccc2)ccc1CNC1(c2ccc(C#N)cc2)CCOCC1 527807030 AGDRJQYNOJMACF-UHFFFAOYSA-N 398.506 5.029 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1nc2ccccc2o1 531335213 SFWAHUFEFKEGHK-CQSZACIVSA-N 389.798 5.159 30 20 GKED CCN(CCc1cccs1)C(=O)c1ccccc1Oc1ccccc1C#N 537574500 RJZUOIXSXZRETA-UHFFFAOYSA-N 376.481 5.117 30 20 GKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 537926725 HFTFQLIFJREMDL-DNVCBOLYSA-N 381.451 5.071 30 20 GKED C[C@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(C#N)c(F)c1 540705269 MLLVQQSLBQXURL-SJORKVTESA-N 387.458 5.361 30 20 GKED CC(C)(C)N(Cc1ccccc1)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 541592976 JXFCRPKEMLETGX-UHFFFAOYSA-N 385.467 5.186 30 20 GKED C[C@H](NC(=O)N1CCC[C@@H]1c1cccnc1)c1ccc(-c2cccc(C#N)c2)cc1 542086828 WTXDTRHKEDQDNW-MHECFPHRSA-N 396.494 5.228 30 20 GKED C[C@](NC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)(c1ccc(F)cc1)C(F)(F)F 543797423 UONJNEFGZWGTFM-NVBFEUDRSA-N 385.323 5.088 30 20 GKED Cc1cccc(NC2CCN(C(=O)c3sc4ccc(C#N)cc4c3C)CC2)c1 551041553 YBDSOEGMODLHAQ-UHFFFAOYSA-N 389.524 5.107 30 20 GKED C=CCC[C@H](NCc1cccc(NC(=O)c2cccc(F)c2)c1)c1ccco1 552032978 FWRXIWVNWVINKV-NRFANRHFSA-N 378.447 5.468 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccc(F)cc3F)no2)c2ccccc21 556353579 RJRXYCRADUYBEU-RMKNXTFCSA-N 376.366 5.054 30 20 GKED N#CCCC[C@@H](NC1CCN(Cc2ccc(Cl)cc2)CC1)c1ccccc1 565707017 AVTONXBUFZUIKQ-HSZRJFAPSA-N 381.951 5.329 30 20 GKED C=CCn1c(-c2ccc3ccccc3n2)nnc1N1CCC[C@H]1c1cccs1 567086586 NTVSYWYWQZRQLE-IBGZPJMESA-N 387.512 5.082 30 20 GKED CCOc1ccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)cc1OCC 571486501 IEYISCNQMAVFAN-UHFFFAOYSA-N 389.455 5.155 30 20 GKED Cc1ccc(-c2nc(Cc3noc(C4(c5ccc(C#N)cc5)CC4)n3)cs2)cc1 571922192 LIJCPEYELHENHB-UHFFFAOYSA-N 398.491 5.044 30 20 GKED Cc1ccc(OCc2ccc(C(=O)N[C@@](C)(C#N)C3CCCCC3)o2)c(C)c1 572554241 QJVJWTHSYLCYNO-QHCPKHFHSA-N 380.488 5.068 30 20 GKED N#CCCCNC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 579220406 APMKLDPUILQMSF-UHFFFAOYSA-N 398.825 5.245 30 20 GKED COc1cccc(C(=O)/C(=C\c2cnc(-c3cccs3)s2)c2ncc[nH]2)c1 588559820 LSTGJCDFJXCPPJ-LFIBNONCSA-N 393.493 5.027 30 20 GKED N#CCCCCCC(=O)N[C@@H](c1ccccc1)c1cc(Cl)ccc1Cl 588676888 ZQTDLQFSCITCFK-FQEVSTJZSA-N 375.299 5.673 30 20 GKED N#CCCCCCC(=O)N(Cc1ccccc1)Cc1ccc(Br)cc1 588759360 VIAFIEIGLWFMBD-UHFFFAOYSA-N 399.332 5.452 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCc4ccc(F)c(Cl)c43)ccc21 593626025 TVURYAJFBAKZJN-GOSISDBHSA-N 397.881 5.161 30 20 GKED CC(C)CN(CCCC1(C#N)CCOCC1)Cc1cccc(C(F)(F)F)c1 599534159 XNUMDKVFWJNHSL-UHFFFAOYSA-N 382.470 5.264 30 20 GKED C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 603564530 NKWHVRBWEBFJNF-OAHLLOKOSA-N 388.492 5.181 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(F)(F)F)cc1 603600831 CSHKXPMUUUFGPK-UHFFFAOYSA-N 397.356 5.325 30 20 GKED Cc1cc(Br)cc(C)c1CNCc1cccc(OCCCC#N)c1 608861114 UHVNCHXVJVFWRE-UHFFFAOYSA-N 387.321 5.038 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)CCCCOc2cccc(C#N)c2)cc1 609504971 SKTBZPIHGCLNOG-GOSISDBHSA-N 396.556 5.485 30 20 GKED C[C@H](SCC(=O)N(C)Cc1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1 609825627 JFFIEWPRVMNPFM-ZDUSSCGKSA-N 393.339 5.318 30 20 GKED N#Cc1ccc(NCc2ccc(COCC(F)(F)F)cc2)c(C(F)(F)F)c1 609960857 GNNVAGFIQOQPRI-UHFFFAOYSA-N 388.311 5.268 30 20 GKED C[C@H](NC(=O)Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)c1cccc(C#N)c1 610325173 FBXNJOKKXDEAMJ-STSQHVNTSA-N 391.515 5.536 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610355861 DOIISZYNDBDJKN-QWHCGFSZSA-N 376.287 5.329 30 20 GKED COc1ccccc1[C@H]1CCCCN1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 610936434 USUGASWSJFTDRX-HXUWFJFHSA-N 393.487 5.113 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)N2CCC(c3ccccn3)CC2)cc1 611085766 XCKCSOULHKJKAQ-UHFFFAOYSA-N 399.519 5.124 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1cc2cccc(OCC)c2o1 612199131 QCMHRFOHTYQEFT-KRWDZBQOSA-N 378.472 5.290 30 20 GKED Fc1ccc(-c2cc(CN3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)on2)cc1 618450409 KTXMQVIGSSJKCD-VXGBXAGGSA-N 396.306 5.043 30 20 GKED Fc1cc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)cc(C(F)(F)F)c1 678296304 ALNMHFGWAXADJV-QWRGUYRKSA-N 383.229 5.017 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1ccc(C)cn1)c1ccc(C(F)(F)F)cc1 682714826 NCFXQRDFGHMSDH-LJQANCHMSA-N 391.437 5.258 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3nccc4ccccc34)sc2c1 682995297 SIYWLUQQNFQEBK-MRXNPFEDSA-N 376.868 5.901 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(OCc3cccc(F)c3)c2)c1 726472945 DFRDIMILERMQAO-UHFFFAOYSA-N 376.456 5.195 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1C 728164654 FSUYZUVFQCRISD-UHFFFAOYSA-N 388.492 5.505 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C1/CCc2cc(SC(F)F)ccc2C1=O 728439949 HXWUYJLUKBSRFK-CLFYSBASSA-N 389.254 5.254 30 20 GKED O=C(/C=C/c1csc(-c2cccs2)n1)c1sccc1Br 728440121 JFFLQRWTTJOSJG-ONEGZZNKSA-N 382.329 5.592 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)Nc1ccc(F)cc1 730954583 DNGUXMOJRZWNOG-UHFFFAOYSA-N 399.438 5.659 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)/C=C/c1ccnc2ccccc12 735434173 PWSABTNWQJIONE-ZHACJKMWSA-N 381.460 5.487 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@@H]2CCOc3ccccc32)c1 735439672 PMCKVWWUZKTONL-IBGZPJMESA-N 387.504 5.219 30 20 GKED CC[C@@H](c1ccncc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 738893988 CNANUUUEWNYYMH-GOTSBHOMSA-N 384.483 5.352 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1 743204061 VSMRYVFUGTYQEZ-ZDUSSCGKSA-N 394.368 5.081 30 20 GKED C=CCCCC(=O)OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 748226294 NAXCPSCCPNXTSG-UHFFFAOYSA-N 386.517 5.152 30 20 GKED N#C[C@H](COC(=O)c1cnc(-c2ccccc2Cl)s1)Cc1ccccc1 750781062 MEXWGUAQIYZZMD-OAHLLOKOSA-N 382.872 5.003 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccnc1 751543833 RRKIPLWEXDVYFY-ZEQRLZLVSA-N 398.510 5.298 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2Oc2ccccc2Cl)nc1Cl 752997799 FPBSENRHNNKQDC-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1ccncc1 759223433 UKADTUDRPTYDFH-SMDDNHRTSA-N 389.402 5.080 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 761535484 UFZVSYCOSDFDAX-ISKFKSNPSA-N 382.463 5.019 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)c2noc(-c3ccccc3)n2)cc1 766602114 SIEIHASHCYMKIY-HZPDHXFCSA-N 383.879 5.280 30 20 GKED C=C(C)C[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 767959961 NHMPTSWYMFXARW-RISCZKNCSA-N 379.312 5.895 30 20 GKED N#C[C@@H](C(=O)CC1(CSc2ccccc2)CC1)c1nc2ccccc2s1 770843715 VGLJXKVVXSYSDV-INIZCTEOSA-N 378.522 5.435 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(OC)c(C3CC3)c2)cc1 774049574 BFHBNGQJKPNXML-VFNWGFHPSA-N 390.483 5.047 30 20 GKED CC(C)c1noc2nc(C3CC3)cc(C(=O)O[C@@H](C)c3cccc(C#N)c3)c12 780347028 IYYKVWLNCFSORN-ZDUSSCGKSA-N 375.428 5.013 30 20 GKED CC(C)c1nc2ccc(NC(=O)Nc3ccccc3O[C@H](C)C#N)cc2s1 780529782 BZAVQLOVUMJFBD-CYBMUJFWSA-N 380.473 5.355 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c(F)c1 781111881 QZUIKPWFHXVNOA-VMPITWQZSA-N 378.384 5.230 30 20 GKED Cc1cccc(C)c1NC(=S)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782204189 KAUNMDAKLHSYHJ-SFHVURJKSA-N 385.536 5.890 30 20 GKED Cc1ccc(C(=O)OCCCC(C)(C)C#N)cc1NC(=O)Nc1ccccc1 783806116 CXYVKHYHWGBKII-UHFFFAOYSA-N 379.460 5.126 30 20 GKED Cc1c(C(=O)O[C@@H](c2ccccn2)C(F)(F)F)ccc(C(F)(F)F)c1F 785894616 TYXRRAQHIUOFLT-ZDUSSCGKSA-N 381.247 5.008 30 20 GKED COc1ccccc1-c1ncc(/C=C\C(=O)c2cccc(C(F)(F)F)c2)cn1 792858818 MUFLJKPZPWWUBH-KTKRTIGZSA-N 384.357 5.067 30 20 GKED N#C[C@@H](C(=O)[C@H]1Cc2ccc(F)cc21)c1nc(-c2ccc(Cl)cc2)cs1 796632208 CNCFKQVMFRQSTF-IRXDYDNUSA-N 382.847 5.119 30 20 GKED N#C[C@@H](C(=O)CCSc1cccc(Cl)c1)c1nc(-c2ccncc2)cs1 808980394 APAKHEMZEJTUJN-INIZCTEOSA-N 399.928 5.217 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@H](N[C@H]1CCC[C@@H](C#N)C1)CC(C)(C)O2 810258234 SLTCQLXTNPDKJP-JTDSTZFVSA-N 399.535 5.308 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(Cl)sc3[nH]2)cc1 810532325 CPDUTWLYLHHFRY-IAQYHMDHSA-N 399.903 5.357 30 20 GKED COc1ccc(CCCCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 813213167 JKGGELMJYVKKMA-SFHVURJKSA-N 390.405 5.088 30 20 GKED CC[C@@H](CC1CCCC1)C(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842280265 AKBKZPLBHCSCCS-HOCLYGCPSA-N 397.544 5.058 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N(O)Cc1cc(Cl)cc(Cl)c1 901380235 PZYPZSLKTYRJKF-UHFFFAOYSA-N 383.256 5.050 30 20 GKED Cc1ccccc1C[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916681188 QNENTOPGEVBWRV-YADARESESA-N 383.495 5.403 30 20 GKED Cc1ccc(SCC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)c(C)c1 917041062 OPBHSGHTBGRWMP-AWEZNQCLSA-N 385.439 5.017 30 20 GKED Cc1cc(C)cc(C2(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)CC2)c1 917046829 SDTCYPONDPLIMI-MRXNPFEDSA-N 380.900 5.475 30 20 GKED O=C(/C=C/c1c(Cl)nc(Cl)n1-c1ccccc1)c1ccc(F)cc1F 920063650 CKCLNEKOKGJCDX-CMDGGOBGSA-N 379.193 5.353 30 20 GKED O=C(O)c1ccc(NN=C2CCCCC[C@H]2c2ccccc2C(F)(F)F)cn1 1776070623 YSOKAGYFRLLEAP-HNNXBMFYSA-N 391.393 5.314 30 20 GKED O=C(O)c1c(Br)cccc1C=Nn1c2ccccc2c2ccccc21 1776112899 PKWFVBFQKZSSKV-UHFFFAOYSA-N 393.240 5.137 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2cc(C)cc(C)c2)cc1 1776787064 QNCCKQCCTYAWSZ-DEOSSOPVSA-N 397.559 5.958 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)cc1 1777559822 HMGSQKVHXYGGQL-OVCLIPMQSA-N 382.415 6.003 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2ccc(Cl)cc2)n(Cc2ccco2)c1C 5273384 ZHUOKXZGNBXDGC-UHFFFAOYSA-N 399.903 5.002 30 20 GKED CCOc1ccccc1Nc1nnc(S[C@@H](C#N)Cc2ccc(C)cc2)s1 24701715 ONBANYYEKOCYTJ-MRXNPFEDSA-N 396.541 5.216 30 20 GKED CCC(CC)(Cc1nc2ccccc2s1)C(=O)[C@@H](C#N)c1nc(C)cs1 48787818 RFEDASFFASGSHW-CQSZACIVSA-N 383.542 5.287 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1ccccc1Sc1ccccc1C#N 60273136 GVAOPVIYZZKVFT-UHFFFAOYSA-N 378.419 5.124 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 66954887 FHOJITLFTRQVGG-NQIIRXRSSA-N 393.556 6.067 30 20 GKED N#Cc1ccc(N2CCC([C@H](O)c3ccc(Cl)cc3)CC2)cc1C(F)(F)F 78721877 ATRVEBFUDCKKNN-LJQANCHMSA-N 394.824 5.180 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1cccc(C(F)(F)F)c1 108354141 FWNSFVXSFYBEIV-CYBMUJFWSA-N 393.434 5.008 30 20 GKED COc1ccccc1[C@H]1CCCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 108530494 KHADOTQMULCLEB-VQIMIIECSA-N 395.528 5.316 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(C(F)(F)F)ccc2F)c1 113564373 DSAOHXDJEGRSBB-UHFFFAOYSA-N 381.329 5.171 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 122026416 POGHHTMLXADCOJ-BEFAXECRSA-N 375.497 5.138 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(Cl)sc3Cl)n2)c1 160691731 QFDIXQURTPTZGL-UHFFFAOYSA-N 380.281 5.302 30 20 GKED N#C[C@@H](C(=O)C1CCC(c2ccccc2)CC1)c1nc(-c2ccncc2)cs1 174104894 IJOIIPCJEFOFFX-UUKMXZOPSA-N 387.508 5.355 30 20 GKED CCN(C(=O)c1cccc(-c2nc(C)cs2)c1)c1ccc(C#N)c(Cl)c1 179520590 FBDLGWRRZKEUFN-UHFFFAOYSA-N 381.888 5.310 30 20 GKED C=CCn1c(S[C@@H](C)c2nc3ccccc3o2)nnc1-c1ccccc1C 182377210 DCEQMVUEJRVREO-HNNXBMFYSA-N 376.485 5.434 30 20 GKED COC1(C)CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 271773733 GLKGLWZBOKNYRZ-LJQANCHMSA-N 397.906 5.028 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N[C@@H](c1cccc(Cl)c1)c1ccccn1 301664761 NVHWIFBWDHXWQM-KRWDZBQOSA-N 388.780 5.222 30 20 GKED COc1ccccc1-c1csc(C2CCN(c3cccc(F)c3C#N)CC2)n1 302686333 BDGMLSBMMMHUQU-UHFFFAOYSA-N 393.487 5.213 30 20 GKED CSc1ccsc1C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 409784716 OTMAZLLXUNEGJF-UHFFFAOYSA-N 380.494 5.173 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cccc(SCC#N)c3)c(C#N)c2[C@@H](C)C1 411007271 FWYZLQHNWMAAGB-STQMWFEESA-N 381.526 5.174 30 20 GKED Cc1cc(N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)ccc1-c1ccncc1 427834513 SNNSVLRPTJKGCS-HNNXBMFYSA-N 390.874 5.021 30 20 GKED CC(C)Cn1nc(-c2ccccc2)cc1NC(=O)c1cccc(SCC#N)c1 431942453 ZXBXWZCHESANPP-UHFFFAOYSA-N 390.512 5.074 30 20 GKED CC(C)[C@@H](C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccnc1 436113247 UREYEHGHNHHCSA-MHECFPHRSA-N 383.495 5.237 30 20 GKED Cc1ccc(-n2c(SCCCCC(C)(C)C#N)nnc2-c2ccncc2)cc1 436196466 HPIWAINLJWOLPP-UHFFFAOYSA-N 391.544 5.450 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2cc(Cl)c3ccccc3c2O)cc1 436568707 VTYYJCSXKOSFNX-UHFFFAOYSA-N 394.858 5.158 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3nc(CCc4ccccc4)no3)c2)cc1 437509950 XZLMXEQXSJFCBP-UHFFFAOYSA-N 396.450 5.131 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1Br 437670047 PWLBCOAQYUEDHJ-IEBWSBKVSA-N 398.304 5.061 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3cc(C#N)ccc3OC(C)C)cc2)cs1 440695313 QYIJYSQUOQHUEV-UHFFFAOYSA-N 377.469 5.030 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)c1cccc(C#N)c1 442777610 DLVHYQMUZOHXIL-HNNXBMFYSA-N 375.859 5.637 30 20 GKED N#CCCCn1cc(C(=O)Nc2ccc(-c3nccs3)cc2)c2ccccc21 443915424 LMFBUKTUENOWJX-UHFFFAOYSA-N 386.480 5.321 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccn(CCc2ccccc2)n1 453086867 MFJBBTOEUVFMAS-GOSISDBHSA-N 376.529 5.132 30 20 GKED O=C(c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F 456564615 BQXWHIXTRLBPDN-MNOVXSKESA-N 393.249 5.051 30 20 GKED C[C@@H]1C[C@@H](c2cccc(F)c2)N(C(=O)N[C@H](CCCC#N)c2ccccc2)C1 458794661 BNZAVOHRPZJWSZ-YHYVQYDKSA-N 379.479 5.353 30 20 GKED CC[C@@H](c1ccccc1OC)N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458826668 CWTFJPPSFKYZBT-SFTDATJTSA-N 379.504 5.223 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1c(F)cccc1Sc1ccccc1 463722589 AWTLTCUNECXWFP-UHFFFAOYSA-N 378.428 5.109 30 20 GKED C=CCC(CC=C)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 467341086 MCVKRERULCLKNK-UHFFFAOYSA-N 390.405 5.277 30 20 GKED C[C@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccc2ncsc2c1 469817736 GCSJJCFZQKEYPJ-HNNXBMFYSA-N 388.496 5.046 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 473046925 DRZHYYHBIPCEGE-UHFFFAOYSA-N 375.394 5.328 30 20 GKED CC(C)N(Cc1ccc(Br)cc1)C(=O)C[C@@H](CC#N)c1ccccc1 475122434 WHLAHAQCAJJKSH-LJQANCHMSA-N 399.332 5.274 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3cnc4ccccc4c3)cc2)c1 475499747 AMEPFVXVFFZYPQ-UHFFFAOYSA-N 379.419 5.080 30 20 GKED C=CCCC1(C(=O)N2CCC(COc3ccccc3C(F)(F)F)CC2)CC1 476748111 QEPJEIGWZOCLDZ-UHFFFAOYSA-N 381.438 5.069 30 20 GKED C=C(C)[C@H](NC(=O)NCc1cccc(-c2cccnc2)c1)c1ccc(F)c(F)c1 477174328 AKLKHSWGFXVFBN-QFIPXVFZSA-N 393.437 5.143 30 20 GKED N#CC1(c2ccc(C(=O)NCCc3c[nH]c4cc(Cl)cc(Cl)c34)cc2)CC1 481640990 LPWBUJINGBOJBF-UHFFFAOYSA-N 398.293 5.002 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@@H](C#N)c2ccccc2Cl)s1 481890087 HWVVCFSSUKEULN-KRWDZBQOSA-N 381.888 5.075 30 20 GKED CCOCCC1(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCC1 483365988 LXCAFZVAUFCBGK-UHFFFAOYSA-N 393.487 5.069 30 20 GKED C=CCSc1ccccc1C(=O)N1CCC[C@H](c2nc3ccc(C)cc3[nH]2)C1 486469340 UKFYIEYECOPGOJ-KRWDZBQOSA-N 391.540 5.169 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 488492271 WODSKIZYRYIDQT-KRWDZBQOSA-N 383.879 5.165 30 20 GKED C=C(C)[C@@H](NCc1cc(C#N)ccc1Br)c1ccc(F)c(F)c1 492819629 SWXUXJZLFQUQJI-GOSISDBHSA-N 377.232 5.006 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1c(F)ccc(C)c1F 499625509 HYTUIIUXCWKJRP-UHFFFAOYSA-N 378.378 5.498 30 20 GKED N#CC1(NC(=O)c2ccc(CSc3cc(Cl)ccc3Cl)cc2)CCC1 501894223 NAVQGNYDESLEIB-UHFFFAOYSA-N 391.323 5.462 30 20 GKED CCOc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccc1C 503499487 FQEWNXQDCFOAGE-KRWDZBQOSA-N 396.899 5.661 30 20 GKED CCOc1ccc([C@@H]2CCCN2Cc2ccc(OC)c(OCCCC#N)c2)cc1 506718633 JHOKGFUUDUIOJO-QFIPXVFZSA-N 394.515 5.114 30 20 GKED N#Cc1c(NC(=O)c2ccc(CCC(F)(F)F)cc2)sc2c1CCCC2 506858803 VDFUMZVMCAACRF-UHFFFAOYSA-N 378.419 5.246 30 20 GKED CC(C)[C@](C)(C#N)NC(=O)CS[C@H](c1ccccc1)c1ccc(Cl)cc1 509564212 PIOKJPSYCHVFRT-RTWAWAEBSA-N 386.948 5.217 30 20 GKED Cc1cc2cc(CNCc3cccc(OCc4cccc(C#N)c4)c3)ccc2[nH]1 513105856 CKQFHQRODZKGSF-UHFFFAOYSA-N 381.479 5.217 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2cc3ccccc3s2)cc1 515651374 HQSXYOMGBFOJMA-UHFFFAOYSA-N 398.487 5.799 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 517529583 HHLATZRIKMUDQR-HNNXBMFYSA-N 377.469 5.165 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c1 518259417 KTFXFEOWNBRGMP-ZWKOTPCHSA-N 381.545 5.923 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 519888980 PZYGUZMZCMMVLN-UONOGXRCSA-N 375.394 5.041 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1 520721267 ISRJTNWBVNXITF-UHFFFAOYSA-N 392.455 5.380 30 20 GKED N#C[C@@H](NC(=O)c1cccc(OC2CCCC2)c1)c1cccc(C(F)(F)F)c1 521351739 BWLOGVBKEBEGDV-LJQANCHMSA-N 388.389 5.021 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)nc1 523653733 VKLSKSXDTPQBCW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@H](C[C@@H]1CCCO1)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 524200521 RNEWUKXNIJPEMP-KDOFPFPSSA-N 399.878 5.083 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 525345538 RJMJPHGSQCAFTN-UHFFFAOYSA-N 393.487 5.569 30 20 GKED Cc1ccc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c1 525632580 UBDPHVHTMFCQDZ-CYBMUJFWSA-N 397.500 5.240 30 20 GKED COc1cccc([C@H]2CN(C(=O)Nc3ccc(CC#N)cc3Cl)CC2(C)C)c1 529108066 PGTDJWQOKXATMF-GOSISDBHSA-N 397.906 5.072 30 20 GKED CCCN(CC)C(=O)c1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1 538072590 JVZUTLQFNIAPHP-UHFFFAOYSA-N 397.544 5.042 30 20 GKED N#CC1(c2ccc(-c3nc(-c4ccc(Oc5ccccc5)nc4)no3)cc2)CC1 538526315 ADWDEJVPUOYLDY-UHFFFAOYSA-N 380.407 5.146 30 20 GKED C=C(C)COCCN[C@@H](C)c1sc(-c2ccccc2Br)nc1C 539059465 CIZCVFJDVPFMAT-ZDUSSCGKSA-N 395.366 5.124 30 20 GKED C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cc2cc(Br)ccc2o1 539506588 CGANBLIPBFXNOL-KSSFIOAISA-N 383.289 5.891 30 20 GKED CCn1c(CN[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)nc2c(F)cccc21 542947496 DVXCIELGTLOEPX-KRWDZBQOSA-N 398.485 5.585 30 20 GKED C[C@@H](NCc1cnc(-c2ccncc2)s1)c1ccc(-c2cccc(C#N)c2)cc1 554644390 JHVFSCGQHLVGFB-QGZVFWFLSA-N 396.519 5.595 30 20 GKED CC[C@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)cc(Br)c1 556197959 ODYXPIKSAYUDPP-VQTJNVASSA-N 389.312 6.064 30 20 GKED COCc1nc(N2CCC(CCC#N)CC2)c2c(-c3ccccc3)csc2n1 566160759 PJHYVPXZUOGOMK-UHFFFAOYSA-N 392.528 5.025 30 20 GKED N#Cc1c(NC(=O)c2cncc(C(F)(F)F)c2)sc2c1-c1ccccc1CC2 573161483 ZHHJUDGPCVFKOV-UHFFFAOYSA-N 399.397 5.051 30 20 GKED N#Cc1ccc(-c2nnc(CNC3(c4c(Cl)cccc4Cl)CCC3)o2)cc1 578410064 LJKNZKJLCLLVJR-UHFFFAOYSA-N 399.281 5.084 30 20 GKED N#Cc1cc(Oc2ccc(NCc3csc(C4CCCC4)n3)cc2)ccn1 582758093 VAIBJHQOEVUDTI-UHFFFAOYSA-N 376.485 5.472 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](COc1ccccc1)c1ccccc1 594308872 PGNDLPSTTPKOPU-QFIPXVFZSA-N 392.524 5.266 30 20 GKED N#CC1(CC(=O)N2CCC[C@H]2c2ccc(Br)s2)CCCCC1 597500431 JVPCKWVZQAHIPK-ZDUSSCGKSA-N 381.339 5.038 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@H]21 599736372 FKJRFASOKXRFTF-BMZRXHPRSA-N 397.931 5.194 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2nccs2)c1)c1nc2ccccc2s1 606145054 GWUDDKGEFSOAGN-CQSZACIVSA-N 377.450 5.035 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 609110841 VXOJJYSVCPSVOO-UHFFFAOYSA-N 399.425 5.318 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)Oc1ccccc1 609636203 CHBSOTDCTDJOOH-MRXNPFEDSA-N 383.517 5.060 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)c1cccc(C(F)(F)F)c1 609993921 CLIKAZHRGLSXSD-PXAZEXFGSA-N 380.797 5.233 30 20 GKED C[C@@H](c1ccccc1)c1ccc(OCc2nnc(-c3ccc(C#N)cc3)o2)cc1 610270477 BHQUZEBHPHSZTE-KRWDZBQOSA-N 381.435 5.339 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Cl)cc1OCC(F)(F)F)c1cccc(C#N)c1 610324632 OCHNJFYJXLPVFA-LLVKDONJSA-N 397.784 5.035 30 20 GKED C[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1cccc(C#N)c1 610357259 JODSARQIKKRYSU-ZHRRBRCNSA-N 389.886 5.361 30 20 GKED C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)c1ccc(Br)cc1 618247936 OMOAKIHDDTYFPT-VIFPVBQESA-N 398.087 5.119 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](N[C@@H]2CCc4cc(C#N)ccc42)CCC3)cc1 618805748 KFBSDHMNTXLTLB-NHCUHLMSSA-N 385.536 5.645 30 20 GKED Cc1ccc(OC(F)F)c(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 678207847 FUJIVWZQIIGKIC-VXGBXAGGSA-N 391.302 5.159 30 20 GKED CC(=NNc1ncnc2sc3c(c12)CCC3)c1ccc(Cl)c(Cl)c1O 727648271 AXTCPOBXHAJXJC-UHFFFAOYSA-N 393.299 5.029 30 20 GKED CN(C(=S)Nc1ccc(C#N)c(Cl)c1)[C@@H](c1ccccc1)C(F)(F)F 728453519 LCMZNFKHBFQIKX-HNNXBMFYSA-N 383.826 5.144 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1cccc(-c2ccncc2)c1 741471980 DFHRJWORRUUOBB-KHPPLWFESA-N 392.458 5.619 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(N3CCCCC3)cc2)cc1 746515182 MXUVLTBSXCDYIZ-VWLOTQADSA-N 395.506 5.585 30 20 GKED FC(F)(F)c1ccc(CON=Cc2ccccc2OCc2ccccn2)cc1 746575868 DOIGPPXFRMLVDX-UHFFFAOYSA-N 386.373 5.230 30 20 GKED C[C@@H]1CCC[C@H](CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)C1 750668187 PAQPEZMXKVHYFX-DYEKYZERSA-N 380.435 5.708 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)/C=C/SCc3ccco3)cc2)cc1 754223842 LKTLHBVPBLQOPM-ACCUITESSA-N 376.437 5.329 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COC/C=C\c2ccccc2)cc1 763259399 JHCOMGSEUORCEL-DUFUGNAASA-N 382.463 5.011 30 20 GKED C[C@H](Cc1ccc(O)cc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 765907453 JDXRKUJAHSGSJE-HOYKHHGWSA-N 399.494 5.143 30 20 GKED N#CCCCOc1cccc(CNc2ccc(OC(F)F)c3ncccc23)c1 770541064 STJKPHNHOVOTKE-UHFFFAOYSA-N 383.398 5.131 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1CCCc1ccccc1 780671739 UDOBBCKWFGQVAW-FPOVZHCZSA-N 391.515 5.387 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1cccnc1-c1ccc(Cl)s1 782912419 ZFTAGRXQIDREIC-LBPRGKRZSA-N 398.875 5.398 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3ccc(C#N)cc3Cl)c(Cl)nc21 788359729 CWMNMHHINSSRFT-GQCTYLIASA-N 385.254 5.087 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1c(Cl)cccc1Cl 797572767 IBTSYDCKTFZBRB-WDEREUQCSA-N 381.328 5.727 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)[C@H](C)c1ccc(C(=O)C(C)C)cc1 801650332 BCDICYSHXKGUHQ-CQSZACIVSA-N 399.874 5.158 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ccnc3c(Cl)cccc23)ccc1OC 804456231 VHZLJSLLYKOWDH-HNNXBMFYSA-N 381.863 5.190 30 20 GKED CC[C@H](NC(=O)[C@H](C#N)C(=O)c1coc2ccc(C(C)C)cc12)c1ccccc1 805928906 RQJACSCFFRQKBE-CTNGQTDRSA-N 388.467 5.146 30 20 GKED CC(=C/c1ccccc1OC(F)F)/C=C/C(=O)c1ccc(N2CCOC2=O)cc1 811689935 POJYPIRGNCQTPS-ADAMLCODSA-N 399.393 5.087 30 20 GKED N#C[C@H](C(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1nc(C2CC2)cs1 842941707 SXDPMLYCLJNBJW-CRMJKIRDSA-N 396.821 5.496 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842942856 DZFCNGAHTTUZRO-BBRMVZONSA-N 392.446 5.484 30 20 GKED CCc1nc2ccccc2n1N=Cc1cc(Cl)ccc1OCc1cccnc1 914695017 BALUULIJWPOXRZ-UHFFFAOYSA-N 390.874 5.108 30 20 GKED CN(CCCCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 916679576 SFHPGUJSXRBWAZ-RUZDIDTESA-N 397.522 5.829 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)/C=C/c1cc(C)c(C)cc1C 916906635 IIKJYUDEDAHZSD-VDZCTEQFSA-N 388.511 5.097 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3cccs3)[nH]n2)cc1 917119536 KMBCGBBANWOVRV-GOSISDBHSA-N 384.464 5.046 30 20 GKED C=CCc1cc(OCC)cc(CN2CCC[C@H](c3nc4ccccc4o3)C2)c1O 919940675 IJMLSXXZQHOZPA-SFHVURJKSA-N 392.499 5.040 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccc(SCc2ccccc2)cc1 1776050146 GPJAYXHXPOFYDY-UHFFFAOYSA-N 392.480 5.132 30 20 GKED CC(CCc1ccc(O[C@H](C)C(=O)O)cc1)=NNc1cccc(Cl)c1Cl 1776080959 OIGUGWCDZALZLJ-CYBMUJFWSA-N 395.286 5.266 30 20 GKED CC(C)[C@@H]1/C(=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776308741 LJTFZUMYJXWCMN-GVMLUORFSA-N 396.486 6.000 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1c(Cl)[nH]c2ccccc12 1776354806 ZBDJTWYAXKYNEP-CMDGGOBGSA-N 383.831 5.203 30 20 GKED C[C@H]1Cc2ccccc2C(=O)/C1=C\c1cccc(OCc2cccc(C(=O)O)c2)c1 1776665994 RBAQNAOYZKMNCS-HZRSJKMUSA-N 398.458 5.422 30 20 GKED CCCCCCCCOc1ccc(/C=C/C(=O)c2ccc(CC(=O)O)cc2)cc1 1776785594 QDOHBDOWYRZNGB-SFQUDFHCSA-N 394.511 5.949 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)c2c[nH]c3ccccc23)cc1 1776788036 NLBGWJCKYJGYCR-HSZRJFAPSA-N 394.515 5.433 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CSC(C)(C)C)C(=O)O)cc1 1776788450 NYIMLPUIFULERM-IBGZPJMESA-N 381.582 5.110 30 20 GKED COc1cc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc2ccccc12 1777263954 UJDDTDDRXAWMTO-SOFGYWHQSA-N 388.444 5.657 30 20 GKED COc1cc(OC)c(C(=O)O)cc1/C=C\C(=O)c1sc2c(C)cccc2c1C 1777326401 ZVJHLSNDTNVKJU-HJWRWDBZSA-N 396.464 5.130 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3c(F)ccc4sc(C(=O)O)cc34)coc12 1777449032 GKFPZADVADFXAO-ALCCZGGFSA-N 380.396 5.689 30 20 GKED Cc1nc(N/N=C2\C(O)=Nc3c(C)cccc32)c2cc(-c3ccccc3)sc2n1 8285002 YQOURKKDSKLLDT-UHFFFAOYSA-N 399.479 5.393 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2csc(-c3ccccn3)n2)n1 23192685 JVRUBDYSUMZIDE-UHFFFAOYSA-N 392.431 5.091 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(S[C@H](C)C(=O)Nc2ccc(C)c(C)c2)n1 26142508 PYEQSWGMJSEJMU-CYBMUJFWSA-N 393.434 5.017 30 20 GKED N#Cc1cccc(CNCc2ccccc2-c2ccc(CN3CCCC3)cc2)c1 30669627 RYANKEQDBAOREY-UHFFFAOYSA-N 381.523 5.111 30 20 GKED C=CCN/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccc(C(CC)CC)cc1 32813760 FTFFXHOLWWFXGN-UHFFFAOYSA-O 395.592 5.209 30 20 GKED Cc1[nH]c2ccc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1C 41559596 JRJHTFRUVRNJBJ-HNNXBMFYSA-N 378.382 5.020 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)SC2=Nc3ccccc3CS2)cc1 42512961 YOHNXWJDUJGODG-INIZCTEOSA-N 395.553 5.298 30 20 GKED Cc1noc(C(C)C)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 56036955 NDHRZQSZGMINFR-UHFFFAOYSA-N 395.846 5.676 30 20 GKED N#CCc1ccc(NC(=O)c2ccccc2CSc2nc3ccccc3o2)cc1 57821095 QTKRJCHACLQZHZ-UHFFFAOYSA-N 399.475 5.438 30 20 GKED CC(C)Cc1nc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cs1 64101813 OSBRGMCKMASUQU-NSHDSACASA-N 375.906 5.095 30 20 GKED N#Cc1cccc(NC(=O)c2cccc(NC(=O)c3sccc3C3CC3)c2)c1 67209544 WADXTHPALZIJFS-UHFFFAOYSA-N 387.464 5.002 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1ccc(Cl)cc1Cl 108354379 DCZORZOIUNRKLF-GFCCVEGCSA-N 394.327 5.296 30 20 GKED CC(C)N(Cc1cccnc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 114011146 CCXSLPQGBQNUHC-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1ccccc1COc1cccc(NC(=O)N(CCC#N)Cc2ccco2)c1 124923387 LMPFKSIFCBKQPV-UHFFFAOYSA-N 389.455 5.115 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)N[C@H](C)CC)cc1 154477433 XXJQDXHVGSFRMH-GOSISDBHSA-O 397.608 5.513 30 20 GKED C[C@@H]1CCN(C(=O)CCc2ccc(C#N)cc2)[C@@H]1c1ccc(C(F)(F)F)cc1 155044223 LIMOKOQDWQVCTP-VFNWGFHPSA-N 386.417 5.119 30 20 GKED C[C@@H]1CCN(C(=O)CCc2ccc(C#N)cc2)[C@H]1c1ccc(C(F)(F)F)cc1 155044446 LIMOKOQDWQVCTP-QVKFZJNVSA-N 386.417 5.119 30 20 GKED CC[C@@]1(C)CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 175374373 SCNKQMIEHGNGOT-DEOSSOPVSA-N 391.515 5.376 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)CCCc1nccn1CCC 191942350 AJXJYSYMNYHOQA-UHFFFAOYSA-N 382.552 5.242 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCC[C@@H](C)c2cccc(C(F)(F)F)c2)cc1 237464594 HNGSADOEAXTBCA-CVEARBPZSA-N 376.422 5.280 30 20 GKED C[C@](Cc1cccc(Br)c1)(NCc1ccc(C#N)o1)c1ccccc1 237655442 BKXOQKLOTQIDTD-OAQYLSRUSA-N 395.300 5.161 30 20 GKED CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1O[C@H](C)C#N 248523204 BZBJKSPEJKFXAU-QFUCXCTJSA-N 377.488 5.168 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@H](c1ccccc1)C(F)(F)F 303233364 ZHMQGVPRFVVMMZ-OAHLLOKOSA-N 387.854 5.652 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/C(C)(C)c1cccc(Cl)c1 328840861 PCYCUZDJEALTOO-CYBMUJFWSA-N 378.925 5.239 30 20 GKED CC[C@@H]1C[C@H](/C(O)=N/C[C@H]2CC3c4ccccc4C2c2ccccc23)CC(O)=N1 329559072 FLEMUEZBBLKPFC-DOQDBPRISA-N 388.511 5.385 30 20 GKED OC(=Nc1cccc(COC2CCCCC2)c1)N1CC2(CCC2)[C@H]1[C@H]1CCCO1 329720778 AOECQIDQRJYPSF-FGZHOGPDSA-N 398.547 5.115 30 20 GKED Cc1nc(/C(O)=N/[C@H](C)c2nc(C(C)(C)C)cs2)c(Br)s1 331328578 GXVPJSMARWUJIN-SSDOTTSWSA-N 388.356 5.034 30 20 GKED COc1ccc([C@H]2CCCCCN2C(=O)c2cccc(SCC#N)c2)cc1 429950611 PQYQVRLJJDOSFG-OAQYLSRUSA-N 380.513 5.068 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(OC2CCCC2)c(F)c1)c1ccccc1 432962179 VSSQVCODSLYQIV-OAQYLSRUSA-N 395.478 5.704 30 20 GKED CC(C)(c1ccc(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)cc1)C(F)(F)F 433861051 XFVSAHXFSZTCAV-MRXNPFEDSA-N 380.797 5.175 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1OC1CCCC1 437765376 QYQADDHRWSWNDO-IFMALSPDSA-N 389.499 5.312 30 20 GKED Cc1ccc(CN(C)C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 438660437 IYWKHYQTEGTMAJ-UHFFFAOYSA-N 389.430 5.462 30 20 GKED Cc1cc2sc(C(=O)Nc3nc(C)c(SCC#N)s3)c(C)c2cc1C 446093913 GJVAVCYOEHQTQE-UHFFFAOYSA-N 387.555 5.459 30 20 GKED CC[C@@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(C#N)cc1 447579158 JHAWSUCAIVIHIM-GOSISDBHSA-N 379.847 5.620 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)CC[C@H]2CCCCO2)c1 460337019 FLIOTLKFTOAXSN-OAQYLSRUSA-N 382.891 5.094 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 464935878 AOSCOUGLWXBCEU-IAGOWNOFSA-N 393.537 5.092 30 20 GKED C=C(C)C[C@H](C)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 466668216 QQVVVEABTXPFJV-SFHVURJKSA-N 391.515 5.126 30 20 GKED CC[C@@H]1C[C@H](C)CN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 467708938 NHFZWPUSSJDBKI-OXJNMPFZSA-N 377.488 5.098 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCC[C@H]3c3ccc(F)cc3)ccc21 469304542 HUVLSYTWILMWCH-VXKWHMMOSA-N 391.490 5.157 30 20 GKED FC(F)(F)CCN1CCO[C@@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 469457691 VCQPEWPCOAIDTN-GFCCVEGCSA-N 395.265 5.050 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Br)c(F)cc1C 475045005 BIZQXERDPWNMNM-UHFFFAOYSA-N 383.286 5.178 30 20 GKED CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(C(C)(C)C#N)cc1 475186608 ZRYBSFKLXHGKPS-UHFFFAOYSA-N 376.378 5.158 30 20 GKED C=C(C)[C@H](NC(=O)Cc1csc(-c2cccs2)n1)c1ccc(F)c(F)c1 475696516 LYPRJRFYMKDRKN-SFHVURJKSA-N 390.480 5.126 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(OCC2CC2)c(Cl)c1 476170950 XZVJIGIIKXCVRM-UHFFFAOYSA-N 384.907 5.628 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(OC(F)F)c(F)c1 480340502 XUYXWMHXYXKBEA-UHFFFAOYSA-N 390.814 5.362 30 20 GKED CC[C@H]1[C@@H](C)CCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 480637854 RWKDOPTVNRGMTE-KXBFYZLASA-N 379.460 5.011 30 20 GKED Cc1c(C#N)cccc1NC(=O)NCc1nc(-c2cc3ccccc3o2)cs1 480964175 PQDKWYYURLHWSG-UHFFFAOYSA-N 388.452 5.058 30 20 GKED COc1cccc([C@@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 484962160 UVMWXBUJFOQZKB-DEOSSOPVSA-N 398.462 5.336 30 20 GKED CC(C)n1ncc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c1-c1ccccc1 488714259 UFESPFSXUOZAER-FQEVSTJZSA-N 380.451 5.169 30 20 GKED C[C@@H](Sc1nc(C(F)(F)F)ccc1C#N)c1ncc(-c2ccccc2)o1 488800692 OIJQVNFKLKNTDR-LLVKDONJSA-N 375.375 5.480 30 20 GKED COc1ccc(-c2nc(CSCc3ccccc3C#N)cs2)c(OC)c1 498119289 IAIIGHWSANDYRI-UHFFFAOYSA-N 382.510 5.132 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 502724483 GDGHATMCDSXVDQ-UHFFFAOYSA-N 397.450 5.011 30 20 GKED Cc1ccnc2sc(C(=O)N[C@H](C#N)c3cccc(Cl)c3Cl)c(C)c12 505313765 JDGLSABMPPSQJT-CYBMUJFWSA-N 390.295 5.215 30 20 GKED C[C@H](NC(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(C#N)cc1 505317571 JNHJNFAZMJHXLD-BXKMTCNYSA-N 395.462 5.454 30 20 GKED CC1(C#N)CCN(C(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1 509368768 ITIFARPCBPUZBU-UHFFFAOYSA-N 391.273 5.565 30 20 GKED CC(C)n1ncc2cc(CSc3nc(-c4ccccc4)ccc3C#N)cnc21 510202745 BOWUAFBRUCKFLR-UHFFFAOYSA-N 385.496 5.238 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H]1CCCC[C@@H]1C 510856623 HLDFEUGRULYLPE-AOMKIAJQSA-N 377.488 5.701 30 20 GKED C=CCOc1ccccc1C(=O)N1CCC(c2nc(C(C)(C)C)cs2)CC1 511400054 KSARMPNIHPAVAL-UHFFFAOYSA-N 384.545 5.025 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)c1cccc(OCc2ccccc2C#N)c1 512375496 SUUCDLWETLZAKA-UHFFFAOYSA-N 384.479 5.821 30 20 GKED N#Cc1ccc(NCCc2coc(-c3ccc(F)cc3)n2)cc1C(F)(F)F 513646355 WVELPCRKKXNOKI-UHFFFAOYSA-N 375.325 5.026 30 20 GKED CC(C)(C)[C@H]1CCc2sc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)cc2C1 515597259 DMTHKMLMRCHHES-LSDHHAIUSA-N 378.497 5.530 30 20 GKED Cc1ccc2oc(C(=O)[C@@H](C#N)c3nc(-c4ccc(Cl)cc4)cs3)cc2c1 516465477 SAHKVASKYJWPHE-MRXNPFEDSA-N 392.867 6.008 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCc2c(Cl)cccc21 518753709 YYJBPDDLQWUTBN-GUYCJALGSA-N 385.920 5.543 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1 520169695 DSTLSYYEEPZIQX-UHFFFAOYSA-N 391.393 5.147 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 524278870 GRYASLAWVROKGI-LJQANCHMSA-N 378.834 5.695 30 20 GKED C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCCCC(C)(C)C#N 532412867 BETUWHOZPDPZMO-HZPDHXFCSA-N 375.944 5.485 30 20 GKED CC[C@H](NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccncc1 534157827 KYXXHLGJNNDDHB-IBGZPJMESA-N 391.858 5.280 30 20 GKED Cc1cccc([C@H](NC2CCC(C#N)(c3ccccc3)CC2)c2ccccn2)c1 539042051 CETMZZLOLOUODT-DHWVBAGJSA-N 381.523 5.473 30 20 GKED CCN(Cc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cc1)C1CC1 539173945 VAZBLBOULVPQIJ-UHFFFAOYSA-N 381.545 5.154 30 20 GKED N#Cc1ccccc1-c1ccc(CN[C@H](C[C@H]2CCOC2)c2ccccc2)cc1 540314612 RIXDWXBQSWIGKU-QFQXNSOFSA-N 382.507 5.483 30 20 GKED Cc1ccc(C(C)(C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cn1 544790787 IZWBAEWTTDZXHL-UHFFFAOYSA-N 386.455 5.111 30 20 GKED CC1(C(=O)Nc2ccccc2Cl)CCN(c2ccc(Cl)cc2C#N)CC1 552699182 MPLIZMOORFSTEF-UHFFFAOYSA-N 388.298 5.110 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(CCC#N)c1ccc(F)cc1 554167889 MHWAJMWXENFOFV-UHFFFAOYSA-N 399.878 5.472 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc([C@H]4CCOC4)cc3)c2)c1 555626349 LAVFDJXXBMKJAH-QHCPKHFHSA-N 384.479 5.253 30 20 GKED COC(=O)c1ccc(-c2ccc(CN[C@@H](CCCC#N)c3ccccc3)o2)cc1 556906843 BMQIOURERSMMGQ-QFIPXVFZSA-N 388.467 5.258 30 20 GKED C=CCOc1ccc(CN(C(=O)[C@H]2CCC(=O)c3ccccc32)C(C)(C)C)cc1 560115966 JJNXTLZHNOZXHF-QFIPXVFZSA-N 391.511 5.139 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)cc1 561863500 NENXFRLYZZAJID-IAZZRBKQSA-N 390.449 5.079 30 20 GKED CCc1c(C)sc(NC(=O)c2nc(COC)sc2-c2ccccc2)c1C#N 564280983 SROOBLAWXMGPQN-UHFFFAOYSA-N 397.525 5.013 30 20 GKED N#CCCC[C@@H](N[C@@H]1CCc2sc(Br)cc21)c1ccccc1 566576516 YPXXRMHQHOIWDP-HZPDHXFCSA-N 375.335 5.523 30 20 GKED N#CCCN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1ccc(F)cc1 568696567 MJXMFKTVUQXFLA-UHFFFAOYSA-N 384.414 5.001 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CC[C@@H](c2ccccc2)O1 570323000 JCRFJANQLVTVRG-IRLDBZIGSA-N 378.516 5.580 30 20 GKED N#CCCCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 588925375 DUAVMVDPJNPVQU-UHFFFAOYSA-N 395.553 5.926 30 20 GKED C=C(C)COc1cccc(NC(=O)c2oc3ccccc3c2COC(C)C)c1 589384757 LTMFCZOXNWUMMV-UHFFFAOYSA-N 379.456 5.565 30 20 GKED CC(C)(C#N)c1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 594496042 XYQWXMDLYRLXEL-GJZGRUSLSA-N 392.387 5.487 30 20 GKED C=C(C)C[C@@H](NC(C)=O)c1nc(CC2(SCc3ccccc3)CCCC2)no1 596591775 KLTZTPNYTNEDJD-LJQANCHMSA-N 399.560 5.002 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1ccc(F)cc1 597137762 RWUAXZZZWWLSHC-UHFFFAOYSA-N 398.488 5.279 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(O[C@H]2CC2(F)F)cc1 599410107 XMJOQUIFRYLIBB-UGSOOPFHSA-N 388.439 5.120 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2F)cc1Cl 603673215 MCUCVDGKCIUBGZ-SFHVURJKSA-N 382.797 5.526 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C2CC2)o1 604364089 FAAADHZDKPGSOZ-UHFFFAOYSA-N 387.439 5.449 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)[C@@H](C)c1ccc(C#N)cc1 609031017 AJRNYCVEBLSACI-MORSLUCNSA-N 387.310 5.578 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CSc1ccccc1 609062082 WDUVUZDLTLCTHD-UHFFFAOYSA-N 388.492 5.177 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccccc2)n1 609376474 AVZORIDRRBLSAW-AWEZNQCLSA-N 379.510 5.314 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)c1 609496019 FDEDCOVNWODXSS-UHFFFAOYSA-N 396.796 5.418 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCS[C@H](c2ccccc2)C1 609811109 NQBAUKNNLQMNTC-UZLBHIALSA-N 397.569 5.403 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ccnc2ccccc12 609907556 IWDBNZUOODYACC-INIZCTEOSA-N 375.497 5.200 30 20 GKED N#Cc1ccc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)cc1C#N 610231516 PVFSEFLWNJORQM-UHFFFAOYSA-N 390.402 5.004 30 20 GKED N#CCc1ccc(C(=O)N[C@@H](c2cccc(F)c2)c2cccc(Cl)c2)cc1 611153588 AKHAOEZHWOTMIU-OAQYLSRUSA-N 378.834 5.065 30 20 GKED C[C@H](CC(=O)Nc1nc(-c2ccc(C#N)cc2)cs1)c1c[nH]c2ccccc12 618623676 NPZHNPKYYNHEJW-CQSZACIVSA-N 386.480 5.295 30 20 GKED N#CCc1ccccc1NC(=O)c1cc2ccccc2n1Cc1ccccc1F 619873106 LHOJOODCJJLQNR-UHFFFAOYSA-N 383.426 5.147 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nc(C3CC3)cs2)cc1OCCC 647375876 IIKULOAVERDZCA-MRXNPFEDSA-N 384.501 5.088 30 20 GKED N#C[C@@H](C(=O)c1cncc(-c2ccc(Cl)cc2)c1)c1ccc2ccccc2n1 675131104 XNYMINPLLJYHFM-HXUWFJFHSA-N 383.838 5.440 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@H](C#N)c3nc4cc(F)ccc4s3)s2)o1 679762791 QDWBVQSJPBSLTB-LBPRGKRZSA-N 382.441 5.555 30 20 GKED C=CCC[C@H](C(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 681653702 WFIXPPSNRALULG-XHSDSOJGSA-N 393.371 5.326 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1C=Nn1cnc2ccccc21 725848922 MFRBDIYPQIWKGF-UHFFFAOYSA-N 377.451 5.080 30 20 GKED N#C[C@@H](C(=O)Cc1ccccc1C(F)(F)F)c1nc2cc(Cl)ccc2s1 729891671 LWMJJQYRBXKSGH-LBPRGKRZSA-N 394.805 5.387 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 730895260 FSNLRAZDJIKDTD-NOZRDPDXSA-N 383.495 5.789 30 20 GKED Cc1oc(-n2cccc2)c(C#N)c1C(=O)N[C@H](C)c1cccc(Cl)c1Cl 735457952 LXWMJDHOOIIUQD-LLVKDONJSA-N 388.254 5.048 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccccc2OC(F)F)cc1 735634647 UUVVQUOWBSGYGQ-HXUWFJFHSA-N 392.405 5.125 30 20 GKED C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1nc2ccccc2s1 739141805 CTOCCRVJZQFAKB-WFASDCNBSA-N 388.414 5.370 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)OC(=O)CCc1ccc(C#N)cc1 739299134 BPWHRGPWWSUYNZ-OAHLLOKOSA-N 394.471 5.366 30 20 GKED C[C@@H](/N=C/c1cc(Cl)cc(Cl)c1O)c1nc(-c2cccc(F)c2)no1 743045477 MACHVVMLGJXWOD-KPCMJMSPSA-N 380.206 5.068 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1ccncc1 748312708 CGZKPUGZQNMBOX-OAQYLSRUSA-N 385.492 5.152 30 20 GKED Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 753920112 DRFOIUYQEFFJHU-BFYDXBDKSA-N 393.437 5.597 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@H](Cc2nc(C)no2)c2ccccc2)cc1 760052937 UGXJXCKSVPBKOR-IIBYNOLFSA-N 397.906 5.144 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1cnc(-c3ccncc3)s1)CCO2 767738376 VKGLKKTTZGPZNP-GZTJUZNOSA-N 376.481 5.377 30 20 GKED CSc1cc(Br)ccc1CNc1ccccc1O[C@H](C)C#N 779988374 DTMJIIVBEZWQLC-GFCCVEGCSA-N 377.307 5.074 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C(=C/c1ccc(F)cc1)c1cccs1 780156078 CQVIYEGKSVCNJP-VUODPORTSA-N 392.455 5.357 30 20 GKED N#C[C@@H](C(=O)c1cc2cccc(Cl)c2o1)c1nc(-c2ccncc2)cs1 783071094 DZYYUOOFEPKRQX-ZDUSSCGKSA-N 379.828 5.095 30 20 GKED FC(F)Oc1ccc(NCc2ncc(C(F)(F)F)s2)cc1C(F)(F)F 793316697 LXERYEMKDASDQW-UHFFFAOYSA-N 392.271 5.394 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCc2ccccc2F)cc1 793462727 DRYVBWPQIWTVPJ-JOCHJYFZSA-N 387.458 5.235 30 20 GKED Fc1ccc(/C=C/C=Nn2cnnc2SCc2ccc(Cl)cc2)cc1F 794888463 QOYHGADUSBQEGU-OAPZASBZSA-N 390.846 5.049 30 20 GKED O=C(/C(=C\c1cnn(CC(F)F)c1)c1nc2ccccc2s1)c1ccccc1 814187644 PKONQIAECJMWPU-MHWRWJLKSA-N 395.434 5.181 30 20 GKED Cc1cc(C#N)cnc1C(=O)Nc1ccc2c(c1)CN(c1ccc(C(C)C)cc1)C2 815933939 HUNVAMMIINWLIS-UHFFFAOYSA-N 396.494 5.158 30 20 GKED C=CC[C@H]1CCCN(C(=O)Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)C1 821470515 VVBFMSUIECGWJU-IRXDYDNUSA-N 387.524 5.092 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC(c3ccco3)CC2)cc1 854302554 LUTOTKKOXZMFSP-QFIPXVFZSA-N 385.467 5.347 30 20 GKED Clc1ccc(OCc2cccnc2)c(C=NNc2cccc3ncccc23)c1 915964716 KOIBERIQQDYMDP-UHFFFAOYSA-N 388.858 5.308 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@H](C#N)C(=O)Nc2ccc(F)c(Cl)c2)cc1 916938897 MRSYKBNROOJRGK-CEUCYRDJSA-N 398.865 5.137 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCOc3ccc(C)cc3C)n2)cc1 916974190 GCOFDQRRRIDJJK-IBGZPJMESA-N 390.508 5.381 30 20 GKED CC(C)c1cccc(OCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 917027263 ZTNIEADQEYCNKK-LJQANCHMSA-N 376.481 5.189 30 20 GKED Cc1nc(-c2ccccc2)[nH]c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 917119857 YNYJQPSFNOTFRO-JOCHJYFZSA-N 392.462 5.293 30 20 GKED C=CCN(C(=O)[C@@H](C)Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 920998709 IFHCHKGOKSFIKV-INIZCTEOSA-N 380.488 5.347 30 20 GKED O=C(O)Cc1ccc(NN=C2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1 1776084890 VWPNTCWDVKERLA-OAHLLOKOSA-N 377.271 5.356 30 20 GKED Cc1c(Cl)ccc(/C=C(/C(=O)C(=O)O)c2ccc3ccccc3n2)c1Cl 1776117402 WDUXTQAMRYACJV-GXDHUFHOSA-N 386.234 5.044 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/COc4c(F)cc(F)cc4C3=O)s2)c1 1777684338 SSAHAWPPIIOLPR-QPEQYQDCSA-N 398.386 5.050 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3ccoc3C)cc2)CCC1 1787364041 CSTJOTXNCRMNEZ-FQEVSTJZSA-N 392.499 5.104 30 20 GKED C=CC[C@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)/C=C\C=C\C)cc2)CCC1 1791241237 QQCJIWHRRJXIPJ-BYLRXVRFSA-N 378.516 5.021 30 20 GKED N#CCc1ccc(NC(=O)c2ccc(COc3ccc(Cl)cc3)cc2)cc1 8126009 FUTZMWDKZIGIJM-UHFFFAOYSA-N 376.843 5.237 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CNc1ccccc1Sc1ccccc1 11619525 MNNLWFFYXJCFQP-UHFFFAOYSA-N 393.899 5.413 30 20 GKED CCCn1c(S[C@H](C#N)Cc2ccc(C)cc2)nnc1-c1ccc(Cl)cc1 24705545 DPSOZIVPQXGTKM-IBGZPJMESA-N 396.947 5.544 30 20 GKED N#C[C@H](C(=O)c1ccc2ccccc2n1)c1nc2cc(C(F)(F)F)ccc2s1 41549152 ATOUWEJBOUHHTN-CYBMUJFWSA-N 397.381 5.353 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)c1 41558731 LEGQPFVVTXUTEU-MRXNPFEDSA-N 397.425 5.119 30 20 GKED N#CCCCSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 58026168 MXSVYGXPNDUHLH-UHFFFAOYSA-N 393.299 5.289 30 20 GKED C=CCN(C(=O)COc1ccc(C2SCCCS2)cc1)c1ccccc1 58642247 LTPVIMCWXLGPKR-UHFFFAOYSA-N 385.554 5.153 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)N1CCCCC[C@@H]1c1ccncc1 111769208 ALUKMHRALJDDLO-XMMPIXPASA-N 396.494 5.026 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(-c2ccncc2)cc1 151402522 UVEILNNPXDTBAJ-MBSDFSHPSA-N 384.483 5.154 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C3(Cc4ccccc4)CC3)n2)cc1 181268459 BQXAFLPMVKMMGP-IBGZPJMESA-N 388.492 5.018 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)CCOc1ccccc1-c1ccccc1 182062870 DWEBAILOGOZQCM-GOSISDBHSA-N 386.451 5.052 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(Cl)cc2)o1)c1cccc(N2CCOC2=O)c1 210812070 SNIMOPTVPAWREC-NTMALXAHSA-N 393.826 5.453 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CSCc2ccc(Cl)cc2Cl)cc1 303036942 VHVOONLGUGERLD-UHFFFAOYSA-N 393.339 5.666 30 20 GKED Cc1ccc([C@H](C)/N=C(/O)CN2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1C 329368971 LKTSOCTVANRHMR-FXAWDEMLSA-N 396.535 5.199 30 20 GKED COc1cccc(F)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 429052537 BEQGFXKCPAPJGA-UHFFFAOYSA-N 376.387 5.059 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1 431927887 VUNWJOIWSQSAOV-HJNYFJLDSA-N 379.479 5.196 30 20 GKED C=CCC[C@H](NC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1)c1ccccc1 435266331 JOKOGWGXZCMJQZ-FQEVSTJZSA-N 388.467 5.278 30 20 GKED C=CCn1c(S[C@H](C#N)CC)nc2sc(C)c(-c3ccc(F)cc3)c2c1=O 436040873 LHBJDMGCRJYERB-HNNXBMFYSA-N 399.516 5.153 30 20 GKED N#Cc1csc(C(=O)N2CCC(Cc3cc(Cl)ccc3Cl)CC2)c1 437926214 MIVNUPLQJSMRTP-UHFFFAOYSA-N 379.312 5.021 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(F)cc1C(F)(F)F 437989132 CIAGCUBGMZNWBN-YJBOKZPZSA-N 391.368 5.148 30 20 GKED CCCc1c(NC(=O)CCc2cc3ccccc3o2)cnn1-c1cccc(C#N)c1 440085293 BBJDHCVIKWHAQA-UHFFFAOYSA-N 398.466 5.014 30 20 GKED C/C(=C/c1nc(COCC(F)(F)C(F)F)no1)c1ccc(C(F)(F)F)cc1 445753683 UIUKSXBQKLWTBQ-TWGQIWQCSA-N 398.278 5.066 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1-c1ccc(F)cc1 447038181 KVISNJZAGCWUMD-INIZCTEOSA-N 384.501 5.933 30 20 GKED C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455702357 LEGXLYCHFBYBOL-CYBMUJFWSA-N 376.287 5.154 30 20 GKED CC1(c2ccccc2)CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC1 458803041 QODWBFSJLUXHTE-JOCHJYFZSA-N 375.516 5.185 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)C2)c(C)c1 458855413 YAVYDELWABIFEC-GMAHTHKFSA-N 375.516 5.238 30 20 GKED CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(OC)c(OC)c1 459394771 HKAIPCFLSHMXML-HNNXBMFYSA-N 399.516 5.156 30 20 GKED C[C@@H](C(=O)Nc1cccc(COCCc2ccccc2)c1)c1cccc(C#N)c1 461922745 NZUYOFVMAKQITP-LJQANCHMSA-N 384.479 5.060 30 20 GKED CCc1cccc2c(C3CCN(C(=O)[C@@H](C)c4cccc(C#N)c4)CC3)c[nH]c12 461924814 YCLFFEBPHYWBQW-KRWDZBQOSA-N 385.511 5.112 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3cccc(F)c3Cl)c2)cc1 463121111 ZEGBMVNVQRUQKB-UHFFFAOYSA-N 394.833 5.376 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H]1CCCC[C@H]1C(F)(F)F 463738062 OEZYZOKXTASYSJ-LZWOXQAQSA-N 399.482 5.666 30 20 GKED C=C(C)C[C@H](C)C(=O)N(C)c1ccc(NC(=O)[C@H](C)CC(=C)C)cc1Cl 466873446 JHMKMVHLFQCYCF-CVEARBPZSA-N 376.928 5.446 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)c1ccc(-n2ccnc2C)cc1 472080652 RGAKAHUQQVHTND-LJQANCHMSA-N 388.515 5.030 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(C(=O)N(CC)CC)cc1 476117961 ABZJMLRSCIMANS-UHFFFAOYSA-N 378.516 5.273 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1cccc(C)c1 476469177 UYKWFYOHFBCBJZ-OAHLLOKOSA-N 382.533 5.578 30 20 GKED C[C@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 480354659 HKRXMYHDXGBCKE-WBMJQRKESA-N 395.812 5.315 30 20 GKED CC1(C)C[C@]1(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 484909236 MZWGOOANHFAHSC-JOCHJYFZSA-N 394.471 5.286 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)[C@H]1CCCCCC(=O)C1 486259827 MJYWMEMRZQVPGS-FQEVSTJZSA-N 392.474 5.079 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)CNc1ccccc1S[C@H](C)CC#N 487378667 NGRRDZBAXRYVDM-LJQANCHMSA-N 395.572 5.240 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1)c1ccccc1 488711662 IHIJQKNFXKGPHQ-NRFANRHFSA-N 385.467 5.022 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1c(F)cccc1Cl 498624335 RHWOUYJMLBEYFG-HNNXBMFYSA-N 392.906 5.105 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cnc(-c3ccc(F)c(F)c3)s2)c1 502942442 UJSXLEDOQVGJOK-UHFFFAOYSA-N 399.422 5.023 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)sc2cc(F)ccc12 503651426 UPZRRUCTFAZEKA-UHFFFAOYSA-N 376.456 5.150 30 20 GKED CN(CCCCCc1cc(-c2ccccc2)no1)Cc1ccc(C#N)cc1F 507244330 VRJZLUYHSUUTKI-UHFFFAOYSA-N 377.463 5.197 30 20 GKED CC(C)CCN(CCC#N)Cc1cccc(NC(=O)c2ccccc2Cl)c1 513716665 GFOWEYHBJNBSPP-UHFFFAOYSA-N 383.923 5.354 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)cc1 516603381 ABCRPXPNZKLTKS-UHFFFAOYSA-N 387.361 5.120 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1C1CCCCC1 520188447 CCEHSVJIMDYVMG-KRWDZBQOSA-N 395.572 6.257 30 20 GKED CN(Cc1csc2ccccc12)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523593161 JYVMSGRAGOJEOK-UHFFFAOYSA-N 397.503 5.360 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 535964918 VCRRLBVTVGWSLA-UHFFFAOYSA-N 391.968 5.659 30 20 GKED COc1ccc(C#N)cc1CN[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1 538200954 FRAXPVGVLRPQSH-KRWDZBQOSA-N 390.458 5.136 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3ccc(C#N)c(F)c3)s2)cc1 538509241 JAFDNBYIESGXJS-LSDHHAIUSA-N 379.504 5.850 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](Cc1ccc(Cl)cc1)c1ccccn1 542124769 QPXWXZOCLILDDW-HSZRJFAPSA-N 389.930 5.610 30 20 GKED C=C(C)CN1CCC(N[C@H](c2ccc(F)cc2)c2cnc3ccccc3c2)CC1 542472420 JUVCDHGOFRBMJK-RUZDIDTESA-N 389.518 5.093 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1ccccc1COC(C)(C)CC 543648385 LVONYYGJHBIANN-UHFFFAOYSA-N 380.532 5.654 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@@H]3/C=C\c3cccs3)o2)c1 543988658 VDJVUAIQGZKEST-OEIFXAAASA-N 390.512 5.128 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Br)c(F)c1 553830867 BMTVOZMQCNISBR-ZDUSSCGKSA-N 377.257 5.444 30 20 GKED N#CCC[C@H](C#N)CNc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 558506735 LOHKAKPGKLCTAH-GFCCVEGCSA-N 378.234 5.780 30 20 GKED CSc1ccc(NC(=O)C2(C)CCN(c3ccc(Cl)cc3C#N)CC2)cc1 567053800 NPOIYLGJUFAAKH-UHFFFAOYSA-N 399.947 5.179 30 20 GKED COc1cc(CN[C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)ccc1C#N 567284788 BQTFQGSYRTYXOZ-KRWDZBQOSA-N 390.458 5.136 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccco2)Cc2cccs2)c1 589740908 JNLPHKYREIIQSG-UHFFFAOYSA-N 382.485 5.530 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC[C@H]1CCCCC1(F)F 596396723 TZUBAIUFWDGCJM-HUUCEWRRSA-N 398.544 5.578 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@H]3CCc4cc(F)ccc43)c2)cc1 609209930 WJBUKXMBFUMXQZ-QFIPXVFZSA-N 387.414 5.299 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ncoc1-c1ccccc1 609558602 PUYOMEYQYFWRLH-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)NC(c1ccccc1)c1ccccc1 610164661 NJXRJKVHKULISC-INIZCTEOSA-N 390.483 5.084 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 610226963 XWIBZOFQNIHWFR-UXHICEINSA-N 387.310 5.406 30 20 GKED N#C[C@H](C(=O)c1cc2ccc(F)cc2s1)c1nc2cc(Cl)ccc2s1 613403285 NDTXOZXXRPCQBA-GFCCVEGCSA-N 386.860 5.794 30 20 GKED C[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(OCC(F)(F)F)cc1 614178890 HKBCGXXUVAONHH-OAHLLOKOSA-N 376.422 5.280 30 20 GKED Cc1c(C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)oc2ccc(F)cc12 618297766 NFZBIRIYJGFCKF-NXEZZACHSA-N 397.290 5.083 30 20 GKED Cc1c(C(=O)N2C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C2)sc2ccc(F)cc12 674471051 AXCTXYPRRZOZMQ-GHMZBOCLSA-N 399.331 5.162 30 20 GKED Fc1ccc(-c2csc(N3C[C@@H](C(F)(F)F)[C@H](C(F)(F)F)C3)n2)cc1 674932526 IRSUULCQVQFRJK-GHMZBOCLSA-N 384.320 5.126 30 20 GKED COc1ccc(C(=O)/C=C\c2sc3ccccc3c2Cl)cc1NC(C)=O 726430549 ZDSLKMPOWLVUGI-NTMALXAHSA-N 385.872 5.418 30 20 GKED C#Cc1cccc(NC(=S)N[C@H](C)c2sc(-c3ccccc3)nc2C)c1 726475508 BGELOCNYXJLXJE-OAHLLOKOSA-N 377.538 5.147 30 20 GKED N#CCCN(CC1CC1)C(=O)c1sc2cc(Br)ccc2c1Cl 729845527 KXJVHOFNHHAFIY-UHFFFAOYSA-N 397.725 5.083 30 20 GKED COc1ccc(CCCCCC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 730422434 XVLLDYGRPKJDEL-GOSISDBHSA-N 396.487 5.423 30 20 GKED C=CCCC(=O)Oc1cc2ccccc2cc1C(=O)Nc1cc(C)ccc1OC 733678055 RGETYGNERNPHEF-UHFFFAOYSA-N 389.451 5.281 30 20 GKED CCC(CC)[C@@H](NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1)c1ccccc1 733845597 GAUXEVIWHIKPAW-FYYLOGMGSA-N 393.531 5.344 30 20 GKED O=C(/C=C\c1nccc2ccccc12)c1ccc(-c2ccccc2[N+](=O)[O-])s1 740764967 LQYVCDIPXGEOIB-KTKRTIGZSA-N 386.432 5.768 30 20 GKED COc1cc(/C=C/C(=O)c2ccc3c(c2)COC3)ccc1OCc1ccccc1 742437337 SVWNHFCRGLTAJU-YRNVUSSQSA-N 386.447 5.201 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)[nH]c12 744162367 ZZRJMGQMNOEWMX-HRCADAONSA-N 384.266 5.158 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COc2ccc(Cl)c3ccccc23)n1 747194147 VIGNMHROOBGVRW-HNNXBMFYSA-N 384.888 5.328 30 20 GKED Cc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cnn1CCC(C)C 749769335 OOPZBNOFWDWHRC-JOCHJYFZSA-N 386.499 5.145 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CC3CC(OC(C)(C)C)C3)n2)cc1 753920329 FLPMCFRMYUDVBP-VMWRSERWSA-N 382.529 5.279 30 20 GKED CC(C)(C)C[C@@H](NC(=O)Cc1cccc(OCC#N)c1)c1ccc(Cl)cc1 760390745 OVGRLGQEKPQZQF-HXUWFJFHSA-N 384.907 5.079 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Cl)c(N)c(Cl)c1 764200678 ZVDFWKSVFPXBIX-JTQLQIEISA-N 380.300 5.222 30 20 GKED Cc1cnc([C@H](C)OC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)o1 770985521 VBTISCUSJSPTIU-ZDUSSCGKSA-N 382.803 5.218 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1 774304551 OBEGHVGSHZBCCS-QGZVFWFLSA-N 393.531 5.686 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Br)c(Cl)c1 780599900 GICOJKGRNPLSGW-JTQLQIEISA-N 394.656 5.037 30 20 GKED CCCCOc1ccc(C(=O)/C=C/c2ncc(C(F)(F)F)s2)cc1OC 788349440 KTNLKMNTBLSQJO-SOFGYWHQSA-N 385.407 5.246 30 20 GKED C[C@@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccccc2)cs1 796688329 AHOHANMTTNNVTO-VQIMIIECSA-N 376.481 5.502 30 20 GKED CC[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1O 815636080 OGCYBEAAVVXSGE-MOPGFXCFSA-N 376.422 5.887 30 20 GKED CC1(CC(F)(F)F)CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 836274368 UYTOTUVYLKXOCM-GOSISDBHSA-N 387.405 5.148 30 20 GKED Cc1cc(NCc2ccc(O[C@H](C)C#N)cc2)ccc1NC(=O)OC(C)(C)C 850415964 AAARRYMFGNYXCC-MRXNPFEDSA-N 381.476 5.245 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@](O)(c2ccccc2)C1 861012804 ISDRYNCUHVXEJJ-DEOSSOPVSA-N 378.516 5.054 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(-c3ccsc3C(F)(F)F)no2)cc1 904924295 PIXLXNWOIWGIHA-CQSZACIVSA-N 390.390 5.030 30 20 GKED C[C@H](NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1ccc(C#N)cc1 914485876 YDOMLEWYEQKYEA-HYTQYMIGSA-N 376.456 5.177 30 20 GKED Cc1ccc(OCCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915087061 PCOKEKAMLIJAME-XMMPIXPASA-N 384.479 5.448 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(Cl)s2)cc1 915350181 KQWQMLFRWSOWNM-SFHVURJKSA-N 381.888 5.379 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(Cc2ccccc2)[C@@H](C)CC)c1=S 917454095 AKTGHTLQZOAHNG-KRWDZBQOSA-N 382.533 5.118 30 20 GKED C[C@@H]1CCCC[C@H]1CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 920791064 SYKYIZRJWLODIN-DYEKYZERSA-N 380.435 5.708 30 20 GKED CCOc1ccc(/C=C\C(=O)c2sccc2Br)cc1OCC 920991437 HZGRBQSZDHJLRF-ALCCZGGFSA-N 381.291 5.204 30 20 GKED Cc1ccc(Oc2cc(Cl)ccc2C=NNc2ccc(C(=O)O)nc2)c(C)c1 1776072355 UFGJXMRSABNZNW-UHFFFAOYSA-N 395.846 5.288 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccccc1Oc1cccc(F)c1 1777436279 DFNOJIIXCFFVIQ-QXMHVHEDSA-N 376.383 5.521 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C(C)C)cc2)=C(\S)Nc2ccccc2)c1 10170713 IDHGNTZNSDJTEM-UHFFFAOYSA-O 389.544 5.457 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2ccccc2Oc2ccccc2)cc1 29202162 JFBSEQLLJVSYJI-UHFFFAOYSA-N 387.439 5.039 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)Cc1ccoc1C 56800463 YIODDJANTWLGJW-UHFFFAOYSA-N 375.428 5.224 30 20 GKED Cc1noc2nc(C3CC3)cc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c12 66801111 OLUSTVKLUMXAEZ-GFCCVEGCSA-N 392.484 5.055 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)NCc2ccc(OCC#N)cc2)c(C)c1 69662950 VPIOFZKEAKHBDN-INIZCTEOSA-N 383.517 5.110 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cc(C)c(OCc2cccnc2)c(C)c1 106308449 WFJCRTHDWJTRNW-UHFFFAOYSA-N 392.524 5.167 30 20 GKED C=CCN(C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 107835425 FJWJMIWUKGJPPP-HOTGVXAUSA-N 394.462 5.698 30 20 GKED C[C@@H](c1ccc2ccccc2c1)N(CCC(=O)Nc1ccccc1C#N)C1CC1 110985550 ADZJSIFBCKLXIG-SFHVURJKSA-N 383.495 5.266 30 20 GKED CCCO[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)CC1 119622252 CGPAOJQFSPNSNJ-OAQYLSRUSA-N 392.499 5.080 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(F)cc1F)c1nc2cc(Cl)ccc2s1 152467024 XDIPYHLYXRJXRH-ZDUSSCGKSA-N 376.815 5.037 30 20 GKED CCC(=O)Nc1ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1 172192569 XCEYWKWNACZISV-UHFFFAOYSA-N 385.467 5.098 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1coc(-c2ccccc2)n1 173121564 WBWCXIRNUXEOQZ-OAHLLOKOSA-N 392.484 5.058 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C#N)cs2)c(C(F)(F)F)c1 177007560 JQPNUEQUFWHLHC-SNVBAGLBSA-N 384.448 5.781 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COc2ccccc2-c2ccccc2)n1 177750955 JUGIYCLQAHSSGY-SFHVURJKSA-N 376.481 5.189 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCN(C(=O)C(CC)CC)CC1 191439115 BNBFDICFXBOEPO-UHFFFAOYSA-N 399.579 5.087 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(OC(F)F)cc2)ccc1SC(F)F 214932935 RBOQZZYGDMLJOG-YWEYNIOJSA-N 386.366 5.507 30 20 GKED O=[S@@](Cc1ccccc1)Cc1cccc(N=Cc2cc(Cl)ccc2O)c1 255006362 ZFXGOYVUYOXKID-SANMLTNESA-N 383.900 5.245 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 264568238 UEIZORYOSGJZDP-QGZVFWFLSA-N 392.528 5.253 30 20 GKED CC(C)/C(O)=N/C1CCN(/C(O)=N/[C@H](CC2CCCC2)c2ccccc2)CC1 328715211 OJQHZCGWWCOZPM-OAQYLSRUSA-N 385.552 5.299 30 20 GKED Cc1nc(-c2cccc(N=C(O)[C@@H]3CCCC[C@@H]3C(=O)N3CCCC3)c2)cs1 329227291 BAFFYTZSAHPGSQ-MOPGFXCFSA-N 397.544 5.135 30 20 GKED CC(C)c1c(/C(O)=N/[C@@H]2CCOC3(CCC3)C2)cnn1-c1ccccc1Cl 330075739 GPAQIEINBXMCQL-OAHLLOKOSA-N 387.911 5.055 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1Cc1ccccc1)c1ccccc1 432739134 WOJMTIKGNOPQNW-HSZRJFAPSA-N 383.495 5.834 30 20 GKED N#CCCC[C@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1ccccc1 433027098 SUNXZQCYYADWCE-SANMLTNESA-N 393.534 5.911 30 20 GKED Cc1nc(-c2ccccc2NC(=O)N[C@H](CCC#N)c2ccccc2)cs1 433793010 QMAXCSSOGOGRIP-GOSISDBHSA-N 376.485 5.285 30 20 GKED Cc1cc(Br)ccc1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 437567508 LWWPYIGEQBQKSB-IEBWSBKVSA-N 398.304 5.061 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Nc1cccc(CCC(F)(F)F)c1 441731094 SPIXFLLRJLTLFO-HNNXBMFYSA-N 396.478 5.258 30 20 GKED C=CC[C@@H]1N(C(=O)[C@H]2CCn3c(cnc3C3CCCCC3)C2)CCCC1(C)C 444639263 YYLOUJMRIQCFOP-FPOVZHCZSA-N 383.580 5.087 30 20 GKED N#Cc1cccc(-c2cc(C(=O)Nc3ccc(Sc4ccncc4)cc3)on2)c1 447559184 SEYWSYWYJCNFQR-UHFFFAOYSA-N 398.447 5.012 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F 464944444 OTAPKEUACLRIJM-HUUJSLGLSA-N 398.428 5.107 30 20 GKED C[C@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)NCCCCC#N 465892859 PBSBTTQMLYCFNR-MRXNPFEDSA-N 389.952 5.238 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3c(Cl)cccc3Cl)ccc21 468847278 FTTCVXZVTFMVNX-UHFFFAOYSA-N 388.298 5.188 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1 474591729 BKQVNNFEOJMWJO-UHFFFAOYSA-N 396.796 5.335 30 20 GKED Cc1onc(-c2ccc(C(F)(F)F)cc2)c1C(=O)N[C@@H](C)c1ccc(C#N)cc1 478075738 AHOBKVWJFAYSNU-LBPRGKRZSA-N 399.372 5.032 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1nc(Cc2ccc(F)cc2)no1)c1ccc(F)c(F)c1 481579715 HVORKHNLRKCRCX-RBZFPXEDSA-N 387.405 5.046 30 20 GKED Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483211013 FTRAWHNUGFZCMP-INIZCTEOSA-N 391.496 5.079 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cc(C(F)(F)F)ccc1Br 483382491 QXQCUKXTBJGKTI-NSHDSACASA-N 377.204 5.040 30 20 GKED COc1ccc(CNc2ccc(-c3ccco3)cc2F)cc1OCCCC#N 486791724 PIBLAYPQZQVDMU-UHFFFAOYSA-N 380.419 5.389 30 20 GKED CCCC(=O)Nc1ccc(OCc2ccccc2C(C)(C)C#N)c(C(C)=O)c1 486912224 LPKOIORGPBTWPR-UHFFFAOYSA-N 378.472 5.008 30 20 GKED N#CCCC[C@@H](NC(=O)c1c[nH]c2ccc(Br)cc12)c1ccccc1 487247842 AXIHZLOIILNBOU-GOSISDBHSA-N 396.288 5.095 30 20 GKED COc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)cc1OC1CCCC1 487498163 DBJFXYLSHCLUAJ-OAQYLSRUSA-N 392.499 5.182 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(C)c(C(=O)N(C)C(C)C)c2)CCCC1(C)C 489603336 HUZFAUYFPUPDMG-HXUWFJFHSA-N 385.552 5.074 30 20 GKED N#CC1(CCCOc2cc(Cl)c(Br)cc2Cl)CCOCC1 499986044 AIBNWIRERIQCFL-UHFFFAOYSA-N 393.108 5.235 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](c1cccc(F)c1)c1ccccn1 505015998 AGYLJTFZQYCSOJ-QFIPXVFZSA-N 375.447 5.250 30 20 GKED CCCN(C(=O)Cc1ccc(C#N)cc1)[C@@H](C)c1ccc(Cl)c(Cl)c1 505070153 JBEAGHPOHAHGBJ-AWEZNQCLSA-N 375.299 5.407 30 20 GKED CC1(C#N)CCN(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)CC1 506321174 OJYKHQXDSSJQNB-UHFFFAOYSA-N 385.920 5.649 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2CN2CCc3ccccc32)c1 507169533 WGVJRCYETBQHAN-UHFFFAOYSA-N 387.870 5.027 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cc(C#N)ccc2Cl)n(-c2ccc(F)cc2)n1 507787830 VBWCFLNXUUHPNP-UHFFFAOYSA-N 396.853 5.086 30 20 GKED CCN(C(=O)c1sc(-c2ccccc2)nc1C)[C@@H](C)c1ccc(C#N)cc1 509569053 FUSCXXGYODVRFZ-INIZCTEOSA-N 375.497 5.214 30 20 GKED CC(=O)N(c1nc(CSc2ccc(C#N)cc2)cs1)c1ccc(C)cc1C 509656824 VTPJMVCITYJAQX-UHFFFAOYSA-N 393.537 5.609 30 20 GKED Cc1ccc(Cc2nc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)cs2)cc1 509884816 KEKCVQSJKVMARW-OAHLLOKOSA-N 389.505 5.142 30 20 GKED C[C@@H]1CN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c2ccccc21 509906474 ZNCCRYDOLIIOAW-GOSISDBHSA-N 397.478 5.487 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccccc2)cc1Cl 510023264 LLGWRSHOCKBWRJ-NRFANRHFSA-N 389.886 5.360 30 20 GKED CCN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1ccc(F)c(F)c1 513121966 BEFTUEDNMBTCAT-UHFFFAOYSA-N 392.405 5.082 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(OC(F)F)cc2)nnc1-c1ccccc1 513257889 UCZIKKXQCHTSAM-AWEZNQCLSA-N 387.455 5.586 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)Nc3ccc(C#N)cc3)s2)cc1 518611654 AAZODFKPJVGSGA-OAHLLOKOSA-N 376.485 5.181 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Cl)cc1Cl 520171091 KDKLTLIPKGCFKA-UHFFFAOYSA-N 376.287 5.555 30 20 GKED CC[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccc(Cl)cc1 520855235 FMHWJTXNHJMGDT-WMLDXEAASA-N 387.936 5.865 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)sc1-c1cccc(Cl)c1 524013947 COJOCIKFTMNOTL-OAHLLOKOSA-N 392.867 6.008 30 20 GKED C[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)c1cccc(OCc2ccccc2C#N)c1 524512292 NUOTULZYDBLEQD-NTKDMRAZSA-N 396.490 5.155 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1cccc(F)c1 532493642 FZUFTMJZUYKFPQ-QGZVFWFLSA-N 399.535 5.069 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN(C#N)c2ccc(F)c(C#N)c2)on1 538660569 QXUGMZZJVHFKGB-UHFFFAOYSA-N 398.397 5.002 30 20 GKED COc1cc(C)c([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)cc1OC 539214403 JXIPLWRHJMAVHT-SFHVURJKSA-N 386.495 5.402 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nc2cc(Cl)ccc2c1=O 539758510 SFKNEVYAEPYPQO-GFCCVEGCSA-N 397.887 5.230 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCCCc1ccsc1 542104963 XVYMIPTWQQFBNE-OAHLLOKOSA-N 390.599 5.304 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N2CCC(CC#N)CC2)c(C(F)(F)F)c1 543829592 FSGMNSWPCJWVHN-ZDUSSCGKSA-N 399.482 5.754 30 20 GKED CC(C)(C)c1cc(CCC(=O)N2CCC(CC#N)CC2)cc(C(C)(C)C)c1O 543836557 SQMLICJYPYDOCI-UHFFFAOYSA-N 384.564 5.072 30 20 GKED C[C@@H](NCc1cnc(-c2ccccc2)nc1)c1ccc(-c2cccc(C#N)c2)cc1 543874727 MROOXWAWSLSPDK-LJQANCHMSA-N 390.490 5.533 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 544037263 BJDXVSAFLJYTQF-CYBMUJFWSA-N 392.324 5.014 30 20 GKED N#CCCC[C@H](N[C@@H]1CCCc2nc(-c3ccccc3)sc21)c1ccccc1 551207641 BHIGIQXUEUISCG-LEWJYISDSA-N 387.552 6.212 30 20 GKED C[C@H](NCc1ccc(C#N)cc1C(F)(F)F)c1ccc(Oc2cccnc2)cc1 555099744 WFKFNSDJJSEVOT-HNNXBMFYSA-N 397.400 5.615 30 20 GKED COc1ccc([C@H](CCC#N)NCc2cccc(OCc3ccccc3)c2)cc1 558261076 ZJUJJDFHZINCHR-VWLOTQADSA-N 386.495 5.409 30 20 GKED Cc1cc(-c2noc(C[C@@H](CC#N)c3ccccc3)n2)ccc1Br 566880653 WEERCUHWHHKUEB-OAHLLOKOSA-N 382.261 5.048 30 20 GKED Cc1c(C(=O)N[C@@](C)(C#N)C2CCCCC2)oc2ccc(Br)cc12 573637409 RGLXKYSSBSWDQR-IBGZPJMESA-N 389.293 5.096 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1ccnc2ccccc12 576982625 YDPSYMIQNCOGKP-UHFFFAOYSA-N 391.474 5.272 30 20 GKED Cc1ccc2c(CCC(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)c[nH]c2c1 580253275 XWMBRBWCDQKWSY-UHFFFAOYSA-N 396.450 5.107 30 20 GKED C=CCn1c([C@@H]2OCC[C@@H]2C)nnc1N1CCC[C@@H]1c1ccc(C(C)C)cc1 580603929 YIXBWPZOJXLBKQ-IOMROCGXSA-N 380.536 5.027 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C(F)(F)F)o1 594073022 ZAUXEVZZVZSNLF-BZNIZROVSA-N 397.422 5.265 30 20 GKED CC(C)n1c(SCC2(CC#N)CC2)nnc1-c1ccc(Cl)cc1Cl 594884135 VLQDSSHWCCVOGU-UHFFFAOYSA-N 381.332 5.619 30 20 GKED N#Cc1ccc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)cc1F 602755670 FHIXSGVRTYQQHY-FQEVSTJZSA-N 395.796 5.261 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H](c3cccs3)C3CC3)cn2)c1 603691516 OFBPMPCVWBLUHB-HXUWFJFHSA-N 390.468 5.080 30 20 GKED N#Cc1c(NC(=O)[C@H](Oc2ccccc2)c2ccccc2)sc2c1CCCC2 603727597 ARDSBUODQUSJGR-OAQYLSRUSA-N 388.492 5.257 30 20 GKED C[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(COc2ccccc2C#N)o1 603872014 MOQFUZPEYUDIPZ-OAHLLOKOSA-N 394.858 5.217 30 20 GKED Cc1cccnc1CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 609207367 TVMRUOGGJYEWIR-UHFFFAOYSA-N 392.846 5.029 30 20 GKED Cc1cc(C)cc(CSCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 609388188 RVTUEZYZCFGJDA-KRWDZBQOSA-N 384.570 5.427 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2ccc(F)cc12 609403048 OQVSWFLVQIBCBC-ZDUSSCGKSA-N 397.475 5.454 30 20 GKED C[C@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccccc1F 609426058 GHSKUJNZPGAMOU-KRWDZBQOSA-N 388.442 5.213 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc(F)c(F)c3F)cc2)cc1 609497241 VDVPZLPNSOFEFA-UHFFFAOYSA-N 382.341 5.215 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCc4cccc(Cl)c43)cc2)cc1 609501916 MMIQZGFCTOAQBX-UHFFFAOYSA-N 388.854 5.401 30 20 GKED CCCc1nc(C)c(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)s1 613407148 JUSJRTJSVJPFAN-LLVKDONJSA-N 375.906 5.157 30 20 GKED O=C(C/C=C/c1cccc(F)c1)NC1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 674080664 MKNKDMKKNWUTOZ-CAXWSFSTSA-N 397.334 5.255 30 20 GKED C=CCC[C@H](C(=O)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 681653698 WFIXPPSNRALULG-OAGGEKHMSA-N 393.371 5.326 30 20 GKED Cc1ccc(-c2nc3c(s2)C(=O)/C(=C/c2csc([N+](=O)[O-])c2)CC3)cc1 727655389 WBQDMTUPRWDYCZ-RIYZIHGNSA-N 382.466 5.301 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 729571146 PTKPFZFXJHJBLQ-HNNXBMFYSA-N 377.469 5.603 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)[C@H](C#N)c1nc2ccccc2s1 730071678 QHCYDNIPUDKCNH-FUHWJXTLSA-N 378.497 5.454 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCc3ccc(F)cc32)cc1 730131382 LNAWBXXTEKHHMJ-PKTZIBPZSA-N 385.442 5.290 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 731332570 OPLYFJSJUZFWAW-LBPRGKRZSA-N 396.459 5.945 30 20 GKED FC(F)Oc1cccc(Cl)c1C=NNc1ccc(OCC(F)(F)F)cc1 732925208 UKUDCYXYSWGXHN-UHFFFAOYSA-N 394.727 5.329 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(-c2ccsc2)n1 735317475 AZIOCLDHRVSNAG-UHFFFAOYSA-N 392.958 5.861 30 20 GKED CCO[C@@H](C)c1nc(CSCc2cc(Cl)ccc2OCC#N)cs1 736640413 CQIYSASPSOWWSW-LBPRGKRZSA-N 382.938 5.230 30 20 GKED COc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1C#N 742368190 YGKNIUAQYTVKQK-JOCHJYFZSA-N 376.887 5.294 30 20 GKED C[C@@H](Nc1cccc(COc2ccccc2)c1)C(=O)N(CCC#N)c1ccccc1 743472950 TZZJOTMDNZBCCN-HXUWFJFHSA-N 399.494 5.013 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)[nH]c12 744162365 ZZRJMGQMNOEWMX-ARFHVFGLSA-N 384.266 5.158 30 20 GKED N#C[C@H](COC(=O)c1ccc(C2SCCCS2)cc1)Cc1ccccc1 750790432 WMOOMXHRQUFITC-QGZVFWFLSA-N 383.538 5.095 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(-c3ccccc3)s2)c1 756708725 HSZOEPAYDWTECA-FXAWDEMLSA-N 376.525 5.947 30 20 GKED C=C[C@@H](CC(=O)Nc1sc(C)c(-c2ccccc2)c1C(N)=O)c1ccccc1 759781860 MJFLNEMZJLAJFD-INIZCTEOSA-N 390.508 5.121 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)Nc2cccc(-c3cn[nH]c3)c2)cc1 761571094 GHZMDVXJEPPWPW-UHFFFAOYSA-N 398.397 5.132 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1 764755025 LQNFDPAHDXJVFJ-IRXDYDNUSA-N 398.934 5.578 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1ccc(Br)cc1F 767736926 OMGNOWLDKJXKLK-DUXPYHPUSA-N 389.249 5.003 30 20 GKED COc1cccc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1F 771241609 AULIAFGYFCBCHE-OAHLLOKOSA-N 389.430 5.256 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2cccc(F)c2)c2ccccn2)cc1 773133691 RKYAWVJSIKZPOM-GAJHUEQPSA-N 396.893 5.792 30 20 GKED C[C@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(OCC#N)cc1 777220908 CTCCHRBAEWVKSI-INIZCTEOSA-N 393.487 5.060 30 20 GKED COc1cc(OC)cc(Oc2ccc(CNc3cccc(OCC#N)c3)cc2)c1 779589259 ZSXVFAQVPPZXST-UHFFFAOYSA-N 390.439 5.011 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1ccc(C(F)(F)F)cc1 780674122 JYXUMBLNCNTYHH-UONOGXRCSA-N 391.393 5.221 30 20 GKED C[C@@H](NC(=O)Nc1cccnc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 782252018 NVJKSKSWWVCJMW-CQSZACIVSA-N 376.847 5.156 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1)c1c[nH]c2ccccc12 786318885 LPROHKXDXLARKG-MAUKXSAKSA-N 385.492 5.661 30 20 GKED C#CCC1(C(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)CCCCC1 788499273 WNBRQQCCYVPSFM-UHFFFAOYSA-N 384.907 5.161 30 20 GKED CC(=NNc1nncc2ccccc12)c1ccc2ccccc2c1OC(F)F 793376410 ASAKAVSDQVQCQH-UHFFFAOYSA-N 378.382 5.221 30 20 GKED N#Cc1cc(CN[C@@H](c2c[nH]c3ccccc23)C(Cl)(Cl)Cl)ccc1F 796470500 MCCHORFWQHWYQK-KRWDZBQOSA-N 396.680 5.380 30 20 GKED C#C[C@H](NC(=O)N(C)[C@@H](C)c1nc2ccccc2s1)c1ccc(Cl)cc1 811959343 NOKKDYOZTFVPNI-BBRMVZONSA-N 383.904 5.027 30 20 GKED Cc1cc(C)c(NC(=O)[C@H](C)ON=Cc2ccccc2C(F)(F)F)c(C)c1 818613404 NPKBHRNFBLBGFP-HNNXBMFYSA-N 378.394 5.008 30 20 GKED CCc1nc(SCC(=O)Nc2ccccc2S[C@H](C)CC#N)sc1C 845325334 OYFLFWBTFRSYJD-GFCCVEGCSA-N 391.587 5.139 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CSC[C@H]1c1ccccc1)c1nc2cc(Cl)ccc2s1 845452873 ZYLSFTRVQKEWMQ-HRCADAONSA-N 398.940 5.273 30 20 GKED CCC1(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)CCC(F)(F)CC1 850768994 CVYZBVGQGZRFET-GFCCVEGCSA-N 381.373 5.213 30 20 GKED Cc1ccccc1-c1nnc(S)n1N=Cc1ccc(-c2ccccc2Cl)o1 916342176 WYJAYKZENIWCHW-UHFFFAOYSA-N 394.887 5.338 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3ccccc3s2)cc1 916955124 MTRGWQHQBZKYLZ-KBXCAEBGSA-N 376.481 5.376 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C1CC1 916997037 RNCURXLOCMHTQU-OAUONFCTSA-N 377.296 5.649 30 20 GKED CCc1ccc(C(=O)/C=C\c2csc(COc3ccc(OC)cc3)n2)s1 920064128 PTCJHKDWPHWDER-WMZJFQQLSA-N 385.510 5.251 30 20 GKED CC(C)n1ncc2cc(/C=C/C(=O)c3c[nH]c4cc(Cl)ccc34)c(Cl)nc21 920068210 LMTXNAVOOYJIQV-ZZXKWVIFSA-N 399.281 5.696 30 20 GKED CC(C)c1cccc2c1OCC/C(=C\c1ccc3oc(C(=O)O)cc3c1)C2=O 1776377931 FZJSJSUMBXZUOE-XNTDXEJSSA-N 376.408 5.303 30 20 GKED C[C@@H](Oc1cccc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)c1)C(=O)O 1776473534 OELGDAJWJDDIEI-IHWMJMDHSA-N 396.508 5.469 30 20 GKED CCCCCCCCCCCN(C)CCOc1ccc(/C=C/C(=O)O)cc1 1776784567 HMVJDPDNSLUCFW-SAPNQHFASA-N 375.553 5.626 30 20 GKED CCc1cccc2c1OC/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1776977826 LLCZNSGERZOKIW-XKZIYDEJSA-N 398.458 5.202 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc(Oc3ccccn3)c1)C2=O 1777682914 FKESUDGBRIDYHM-AQTBWJFISA-N 385.419 5.175 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\COc4c(F)cc(F)cc4C3=O)s2)c1 1777684337 SSAHAWPPIIOLPR-NTUHNPAUSA-N 398.386 5.050 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Cl)cc(Cl)c3F)c2c1 1777685569 MZTWCMSWLFNVPZ-IWQZZHSRSA-N 395.238 5.942 30 20 GKED N#CC1(c2ccccc2)C/C(=C\c2cccs2)C(=O)/C(=C/c2cccs2)C1 6432849 KTZAIMPHPYLLNW-PWDIZTEBSA-N 387.529 6.101 30 20 GKED Cc1ccccc1-c1cc(C(=O)Nc2cccc(C#N)c2)c2cnn(C(C)C)c2n1 12228731 VLAKORWVTVOERL-UHFFFAOYSA-N 395.466 5.112 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cc(C)cc(C)c2)[n+]2ccccc2)cc1 20834594 CWQRNJOPRRNVGO-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@H]2CCCC[C@H]2C)c1 27490061 RFWRHXWPOWVUAV-NQIIRXRSSA-O 395.592 5.006 30 20 GKED C=CCn1c(S[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)nc2ccccc21 58698020 XJWAHQIPINAQDK-QGZVFWFLSA-N 393.556 5.773 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccccc2Cl)cc1 65028766 WGFVHWACAFHGOB-UHFFFAOYSA-N 393.849 5.585 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66801343 JFQWFJYDHWHPDH-CQSZACIVSA-N 393.537 5.765 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ncc(-c2cccc(Cl)c2)o1 66860973 XAZQLOVGDBQRBA-CQSZACIVSA-N 383.904 6.001 30 20 GKED CN(C)c1ccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 70733980 PJGVDTZOOOYYKP-UHFFFAOYSA-N 387.508 5.169 30 20 GKED N#C[C@@H](C(=O)[C@@H]1CCOc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 102967407 AOLLHLAHGYCEGF-SJORKVTESA-N 394.883 5.206 30 20 GKED Cc1ccccc1[C@@H]1CCCN1C(=O)c1ccc(COc2ccccc2C#N)o1 108333253 FBKSUZDSTHSBFN-NRFANRHFSA-N 386.451 5.016 30 20 GKED Cc1cc(C#N)ccc1Oc1nc(-c2cccnc2)nc2sc3c(c12)CCC3 110852258 XFCTZNJJMKKYQQ-UHFFFAOYSA-N 384.464 5.214 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(CSc2ccccn2)c1 111109058 RTFFZCBYZGTWET-UHFFFAOYSA-N 389.524 5.594 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 173968817 CNTPLWIMIXGGRY-LPHOPBHVSA-N 376.481 5.092 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F 189902242 FRYVLEJKIIWCJH-UHFFFAOYSA-N 390.386 5.300 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2nnc(-c3ccccc3)s2)n1 193516308 MHQOBGIZMVGICU-UHFFFAOYSA-N 392.431 5.091 30 20 GKED CCOc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 301758959 FWKVDPVPWXAAFU-GOSISDBHSA-N 396.899 5.281 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)C2(c3c(Cl)cccc3Cl)CCC2)CC1 328744251 NUXXZLKEKUAKLC-CQSZACIVSA-N 381.303 5.413 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCCC2CCOCC2)cc1F 409753879 MKZFXLRXUWKYNM-UHFFFAOYSA-N 382.435 5.025 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@H](C)C[C@H](C)C2 411015389 QCURGNGXFKMBBV-JGVFFNPUSA-N 399.463 5.342 30 20 GKED C[C@@H](NCc1ccc(C#N)s1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 421198036 IJLWWLDMVSPSJS-SECBINFHSA-N 378.341 5.508 30 20 GKED N#Cc1cc(NCc2cnc([C@@H]3CCCO3)s2)ccc1Oc1ccccc1 428409371 BPVPLTGCMPECEL-FQEVSTJZSA-N 377.469 5.271 30 20 GKED N#CCCC[C@@H](NC(=O)NCc1cc(Cl)sc1Cl)c1ccccc1 431458122 POPGRVMLHMCTKZ-CQSZACIVSA-N 382.316 5.289 30 20 GKED N#Cc1cnc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)c(Cl)c1 431581081 XLMSOIZAVGHBJD-UHFFFAOYSA-N 390.855 5.136 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)no2)cc1Cl 440757686 IHIUUPKGILEFRG-QGZVFWFLSA-N 377.831 5.113 30 20 GKED C[C@H](CC(=O)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F)c1ccc(F)cc1 456563551 AVCWZGLGQWJPQP-RIEGTJTDSA-N 385.323 5.051 30 20 GKED Cc1nc(C)c(CNC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)s1 461034144 PSDWSRKEONIBFM-UHFFFAOYSA-N 397.887 5.007 30 20 GKED C[C@@H](C(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1)c1cccc(C#N)c1 462200219 FSRISFBXAVDKAY-QRWLVFNGSA-N 386.417 5.434 30 20 GKED C[C@H](NC(=O)[C@H](C)c1cccc(C#N)c1)c1cccc(OCc2ccccc2)c1 462332552 NFQDRTJHKTZCTM-MOPGFXCFSA-N 384.479 5.118 30 20 GKED CN(CC[C@H]1CCCO1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 466372828 CMQFMKJEGWKORC-UYAOXDASSA-N 397.906 5.028 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1nc2c(COC)cccc2s1 471280768 YQDCQEBBBKIQFV-UHFFFAOYSA-N 381.501 5.053 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)NCc3ccc4ncccc4c3)c2)cc1 471288483 RKIGJHHYALFRFQ-UHFFFAOYSA-N 394.434 5.220 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1 474427130 PVNIKYGBHBLSNB-LJQANCHMSA-N 398.466 5.357 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1=Cc2cccc(OCC)c2OC1 476144626 KTVUKUUYHYQHTD-UHFFFAOYSA-N 377.484 5.352 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2cc(C)cc(C)c2)C1=O 476784175 BSYJNPHODGCBAR-QFIPXVFZSA-N 390.527 5.147 30 20 GKED CC(C)c1csc(CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 478578995 FRIXTECHSWJEFN-UHFFFAOYSA-N 392.484 5.252 30 20 GKED Cc1csc(C(=O)Nc2cccc(C(=O)Nc3cccc(C#N)c3)c2)c1Cl 478851866 HSMLSGWQUFLDSU-UHFFFAOYSA-N 395.871 5.086 30 20 GKED CC(C)(CC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1)C(F)(F)F 479369210 WMGUJCNEMHQYNY-UHFFFAOYSA-N 376.378 5.054 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(Oc2ccncc2)c1 480580926 MMZRHDMOQBUXKK-UHFFFAOYSA-N 399.903 5.809 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1ccc(NC(C)=O)cc1Cl)c1ccc(F)c(F)c1 480623569 IBMOBKNSGFPQSD-GOSISDBHSA-N 393.821 5.016 30 20 GKED C=CCn1c(SCc2coc(-c3ccccc3)n2)nnc1-c1ccccc1C 481388760 GAQMIOMKJGBIHZ-UHFFFAOYSA-N 388.496 5.387 30 20 GKED N#CCCCn1cc(C(=O)N[C@@H]2CC[C@H](c3ccccc3F)C2)c2ccccc21 482868895 RLLGIOCXAMZOQM-ZWKOTPCHSA-N 389.474 5.150 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCCC[C@H]1c1ccc(F)cc1 483620618 IMIQEJLTTXSVGQ-UZLBHIALSA-N 397.519 5.837 30 20 GKED N#CCCC[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 487160476 UKKXXVGXUZYIJQ-XMMPIXPASA-N 395.462 5.516 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccc(C#N)c(Br)c2)s1 487837556 MQXBSLUPXWLSBO-OAHLLOKOSA-N 390.306 5.060 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 488323221 IIFDDOKBHNFLMV-QWFCFKBJSA-N 393.556 5.799 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc(CCC(F)(F)F)cc2)c1 492609381 TUHKLAWYJCRFQA-UHFFFAOYSA-N 383.211 5.428 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 497771422 LYCPMPJRWGLANF-DEOSSOPVSA-N 383.495 5.342 30 20 GKED N#CCCN(CC1CC1)C(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 505187399 LOHOTTYGXLGFMR-UHFFFAOYSA-N 387.719 5.627 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(C(F)F)c3)cc2F)c1 511878976 ZWLOXLYVSVOVRZ-UHFFFAOYSA-N 396.368 5.466 30 20 GKED Fc1cc(F)c(Cc2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1F 512014542 GURYTFCMRZJWSY-OAHLLOKOSA-N 390.258 5.155 30 20 GKED C=CCN(C(=O)C[C@H]1CCCc2cc(OC)ccc21)c1nc2c(s1)CCCC2 512595243 LWTHNSDNECRAGO-QGZVFWFLSA-N 396.556 5.060 30 20 GKED COc1c(C)ccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1C 518537724 FXZBTMIIXWVRDB-UHFFFAOYSA-N 390.414 5.367 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 524767523 IFJDDSZPMSNHDQ-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(OCc2ccccn2)c(F)c1)c1ccccc1 534655407 HQOINEZQFKMVGS-KRWDZBQOSA-N 376.431 5.098 30 20 GKED CCSc1ccc([C@@H](C)NCC(=O)N(CCC#N)c2cccc(C)c2C)cc1 537098289 AHKHPFOICJZXPU-LJQANCHMSA-N 395.572 5.013 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)Nc1ccccc1SCCC#N 538192248 VQXHTOYZFSWXIV-UHFFFAOYSA-N 385.558 5.757 30 20 GKED C=CCN(C(=O)c1cc(C)n([C@@H](C)CC)n1)c1nc(-c2ccccc2)cs1 538689673 BAWYVKGRPIGWQP-HNNXBMFYSA-N 380.517 5.119 30 20 GKED Cc1coc(-c2cccc(NC(=O)c3ccccc3Oc3ccccc3C#N)c2)n1 540861159 UTQGWYJZBZBXLQ-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)CSCc1ccc(C#N)cc1 543489273 UEBYUQJGHLILJO-UHFFFAOYSA-N 382.529 5.135 30 20 GKED N#CCCC[C@H](NCc1cnc(-c2ccc(Cl)cc2)s1)c1ccccc1 552311873 GCKQAXHWPHXUEC-FQEVSTJZSA-N 381.932 5.988 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)c1nc(N)c2c(C)c(C)sc2n1 553457529 WGNIUOGHNHMCRK-NSHDSACASA-N 392.981 5.354 30 20 GKED N#CCCC[C@H](NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1)c1ccccc1 556908182 LCKPUHBFAXJROG-FQEVSTJZSA-N 398.432 5.416 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1c(F)cccc1Cl 557427390 BHJUFLZCANBBFU-LBPRGKRZSA-N 377.872 5.195 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1F 558532473 FZRXRTMXXQZORP-NHCUHLMSSA-N 388.417 5.173 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2CCn1ccc2cc(Cl)ccc21 568918205 AGQWUHMYQBRHAK-UHFFFAOYSA-N 396.277 5.143 30 20 GKED CCO[C@H](c1noc([C@@H](C)C(F)(F)F)n1)c1ccc(F)cc1C(F)(F)F 573733751 KERXOFAABUPSCC-HQJQHLMTSA-N 386.267 5.019 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCCC[C@@H]2c2nnc(C3CCC3)o2)cc1 574978499 XQXIPNWDZPWMBT-HSZRJFAPSA-N 398.510 5.603 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4cc(Cl)sc4[nH]3)n2)cc1 583234650 QUPBYEUKWGJQMC-CYBMUJFWSA-N 397.912 5.805 30 20 GKED CC(C)(C#N)c1ccc(-c2nc(-c3ccc(Oc4cccnc4)cc3)no2)cc1 589116252 FBZCJQXCFFIAFE-UHFFFAOYSA-N 382.423 5.392 30 20 GKED COc1cccc(CN(CC(C)C)C(=O)N[C@H](CCCC#N)c2ccccc2)c1 590942409 YUFLKGITTUICBO-HSZRJFAPSA-N 393.531 5.298 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 596696523 KDTOLEOSTUBLLO-INIZCTEOSA-N 394.862 5.162 30 20 GKED Cc1ccc(CC2CN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 596735556 OKHHNSWOIUXPRG-QGZVFWFLSA-N 379.529 5.096 30 20 GKED CCOc1cc(CN[C@@H](C)c2ccc(C#N)cc2)ccc1OCc1ccccc1 603633236 AKUAQMPKGVZUKD-IBGZPJMESA-N 386.495 5.387 30 20 GKED C=CCCCCCN(C)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1 606979980 QYGXDBKUCZDRTJ-UHFFFAOYSA-N 394.519 5.218 30 20 GKED CC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)c1nc(C)cs1 609206825 GYHJBHNVJHNZGI-GOSISDBHSA-N 392.484 5.388 30 20 GKED CCCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)Cc1ccc(F)cc1 609385302 PFJGPUPZWPKQPM-QGZVFWFLSA-N 399.535 5.071 30 20 GKED N#Cc1ccc(CNC(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)cc1 609471167 DQXBXEMYVRNWTM-VWLOTQADSA-N 391.474 5.300 30 20 GKED CC(C)Oc1ccccc1NC(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 609601297 FCDXEXDBMQDKFL-UHFFFAOYSA-N 388.427 5.177 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3OC)cc2)CC1 609773850 ZXUJFWPJXIHBML-QGZVFWFLSA-N 393.487 5.403 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(CSc2ccc(C#N)cc2F)cs1 610219813 VVAOXCOBUAHICY-UHFFFAOYSA-N 397.500 5.439 30 20 GKED CCC[C@@H](NC(=O)N[C@@H](C)c1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 610356016 HGFDGEKGFHDZPV-IFXJQAMLSA-N 389.421 5.479 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)c1c(Cl)cc(C#N)cc1Cl 611096105 MUNAOOWYGZROHR-OAHLLOKOSA-N 377.271 5.210 30 20 GKED CC(C)(C#N)c1ccc(CN2CCO[C@@H](c3cccc(C(F)(F)F)c3)C2)cc1 614169042 PQMVGQINRZOLDR-HXUWFJFHSA-N 388.433 5.080 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)N[C@@H]1CCc2cc(C#N)ccc21 618843265 VOETXYZGZVHMNO-XMMPIXPASA-N 381.479 5.054 30 20 GKED C#CC[C@H](OC(=O)c1sc(-c2cccc(Cl)c2)nc1C)c1ccccn1 727775317 FAPJAUFXCNMWCG-KRWDZBQOSA-N 382.872 5.088 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2cccc(OC(F)(F)F)c2)cc1 727974526 MBDQXDGPDHWKGI-IZZDOVSWSA-N 392.377 5.011 30 20 GKED Cc1c(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)c(C#N)c2n1CCC2 731937102 FQQPPJBELNTERO-CMDGGOBGSA-N 393.899 5.287 30 20 GKED CC[C@H](C)c1ccc([C@H](NC(=O)Cc2ccc(OCC#N)cc2)C(C)C)cc1 731962265 LDNNBWBLFSPYHY-MHECFPHRSA-N 378.516 5.158 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(-c2ccccn2)n1 735318791 QGVCVJGEYOZIRL-UHFFFAOYSA-N 387.917 5.194 30 20 GKED COc1ccccc1[C@H](C)S[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1 742455095 JRQHUARWCKLSNX-ROUUACIJSA-N 382.529 5.133 30 20 GKED C=C(C)COc1cccc(NC(=S)NCc2ccc(OC(F)(F)F)cc2)c1 742995767 XFXMNWHRRUWNBR-UHFFFAOYSA-N 396.434 5.027 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccc(Cl)nc2)cc1F 743038336 YCBCAERZBNVUJS-UHFFFAOYSA-N 398.850 5.347 30 20 GKED N#Cc1ccc(F)c(CNC(=O)Nc2ccccc2SCc2ccccc2)c1 743082259 NGFCVHFCUWVAAN-UHFFFAOYSA-N 391.471 5.311 30 20 GKED CC(=NNc1ccc(OCC(F)(F)F)cc1)c1ccc(-c2ccncc2)cc1 745197259 SBOPKSQEZOSZSD-UHFFFAOYSA-N 385.389 5.526 30 20 GKED CCO[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1(C)C 748943007 RFPDWEFMKMEMJZ-YPAWHYETSA-N 391.515 5.009 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H]1c1ccc(Cl)cc1 752238558 RTODFQVCKQRHFF-RDTXWAMCSA-N 385.920 5.713 30 20 GKED CC(C)(C)O[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 753968683 OIFPXRKRPIQIEF-RPWUZVMVSA-N 398.506 5.837 30 20 GKED C=CC[C@H](NC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C)c1ccncc1 759580893 IXYNIQZBMIABHU-YJYMSZOUSA-N 390.314 5.335 30 20 GKED N#Cc1c(F)ccc(/C=C\C(=O)c2ccc(Br)cc2F)c1Cl 761480776 TXVAKLNLZJEUHG-KXFIGUGUSA-N 382.591 5.148 30 20 GKED CC(C)N(C(=O)c1ncc(C#N)cc1Cl)c1ccc(Nc2ccccc2)cc1 770080039 WUHLAVXEAQNYOZ-UHFFFAOYSA-N 390.874 5.405 30 20 GKED C=CCN(Cc1ccc(Cl)s1)Cn1nc(C(F)(F)F)sc1=S 780426524 GQGUHJYXPMUPEX-UHFFFAOYSA-N 385.889 5.053 30 20 GKED CC1(C)[C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C[C@H]1c1ccccc1 786961123 SFBYOSCFSSRYLL-GMAHTHKFSA-N 387.527 5.264 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2ccc(Cl)c(F)c2)c(-c2ccccc2)n1 788352807 CVGAMSBLPVWAGC-CSKARUKUSA-N 379.822 5.152 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CCc2ncc(C(C)(C)C)o2)c1 788530694 AUURYHPQPSOTNO-UHFFFAOYSA-N 392.524 5.181 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 801670975 SYWARHCBQSCSHK-YVEFUNNKSA-N 396.409 5.606 30 20 GKED C=CC(C)(C)CC(=O)OCc1csc(N(C(C)=O)c2cccc(C)c2C)n1 884652040 IHLIICOPRHNIFK-UHFFFAOYSA-N 386.517 5.090 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)/C=C\c1ccccc1C#N 914519933 CLVPWEOMSJMVRK-XFXZXTDPSA-N 395.437 5.124 30 20 GKED CC(C)c1ccccc1OCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086502 LFUAQPNSRFFICQ-HSZRJFAPSA-N 384.479 5.483 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccc(Cl)cc3)CC2)cc1 915088438 RPXYAQCUIYTLOW-JOCHJYFZSA-N 386.882 5.666 30 20 GKED C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 916847295 BVCWPZWYUACERN-WMLDXEAASA-N 378.497 5.238 30 20 GKED N#C[C@H](C(=O)CC12CC3CC(CC(C3)C1)C2)c1nc2ccccc2n1C(F)F 917039836 FEDGOZSNDAVYQB-LBMSDSGBSA-N 383.442 5.214 30 20 GKED CCCCCCOc1ccc(CC(=O)[C@H](C#N)c2nc3ccccc3o2)cc1 920116015 WLQKQUUNDYNSTK-IBGZPJMESA-N 376.456 5.206 30 20 GKED CC(C)Cc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 920140258 DFVIOSPGDQPEAM-OAQYLSRUSA-N 399.519 5.299 30 20 GKED CC1(C)C(=NNc2ccc(C(=O)O)cc2)C[C@@H]1c1ccc(Br)cc1 1776014146 JEAKEGWDJTVUKV-MRXNPFEDSA-N 387.277 5.129 30 20 GKED O=C(O)c1ccc2scc(C=NNc3c(Cl)cc(Cl)cc3Cl)c2c1 1776014707 SFXBANBIRYJWMZ-UHFFFAOYSA-N 399.686 6.006 30 20 GKED CC(=NNc1ccc(Cl)cc1Cl)c1cccc(OCCCC(=O)O)c1 1776029642 JLHANTKNSFLOCR-UHFFFAOYSA-N 381.259 5.073 30 20 GKED CC(=NNc1ccccc1C(F)(F)F)c1sc2ccccc2c1C(=O)O 1776033246 SJEBFYSQXJYGAZ-UHFFFAOYSA-N 378.375 5.454 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3cc(Cl)cc(Cl)c3)s2)c1 1776058451 GYAQHNNBSCZLAG-UHFFFAOYSA-N 391.279 5.866 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1csc3ccc(C(=O)O)cc13)CC2 1776374609 CFYIDKOJHWZGEC-SXGWCWSVSA-N 376.477 5.935 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1776697809 PABHZCRKXKJJAF-HECSCLNYSA-N 390.504 6.523 30 20 GKED CCc1cccc2c1OC/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1776977825 LLCZNSGERZOKIW-LPYMAVHISA-N 398.458 5.202 30 20 GKED COc1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)s1)CC2 1777371082 HBUFEFHDDWFHQE-ATVHPVEESA-N 390.460 5.334 30 20 GKED C=CCn1c(SCc2ccc3ccccc3n2)nnc1-c1ccc(F)cc1 7206598 WXBBULNFYSOEPR-UHFFFAOYSA-N 376.460 5.111 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)CCSc3ccccc3)c2)c1 32291787 IHALVSQMCNTBEJ-UHFFFAOYSA-N 388.492 5.258 30 20 GKED C[C@@H]1CCc2sc(C(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)cc2C1 41559391 DPDDJLGDRDIXDP-YPMHNXCESA-N 385.439 5.108 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3cc(C#N)ccc3C)cc2)cs1 63961728 UNGLXKCRJLFQEL-UHFFFAOYSA-N 379.510 5.176 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1sccc1Br 70163814 ZGVHGCFSFNXRAM-UHFFFAOYSA-N 376.728 5.054 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)NCC3CCCCC3)c2)cc1 71922600 MJUNLMIYWRQSHF-UHFFFAOYSA-N 377.488 5.033 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 72040928 NDPLNYWDKKSJFH-SFHVURJKSA-N 385.467 5.407 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1ccc(Cl)nc1C 123694189 JMJDVZFMSNPZSX-UHFFFAOYSA-N 391.858 5.055 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(C(=O)Nc3ccccc3)cc2)n1 131160219 VDQQYKYFJHBGHX-SFHVURJKSA-N 389.480 5.009 30 20 GKED CCS[C@@H]1CC[C@@H](N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 135768947 OHILSMWCDAJNMN-ARFHVFGLSA-N 377.579 5.219 30 20 GKED CN(C(=O)Nc1ccc(CC#N)cc1)[C@H](c1ccncc1)c1ccc(Cl)cc1 175131271 NIBUBMPVCMGBMI-NRFANRHFSA-N 390.874 5.054 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(-c2cccnc2)cc1 175615025 IUCRFMGGFMCFRX-QGZVFWFLSA-N 384.483 5.432 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 176599816 GPSLUJXSFKKUFC-QGZVFWFLSA-N 377.513 5.269 30 20 GKED N#Cc1ccc(-c2nnc(CN[C@H](c3cccc(Cl)c3)C3CCCC3)o2)cc1 181035924 SZQBBSSIACVSOG-NRFANRHFSA-N 392.890 5.283 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc(OCC)cc1 188061925 AXLDJDBVYQOHEG-UHFFFAOYSA-N 379.500 5.539 30 20 GKED O=C(/C=C\c1cccc(OCc2ccccc2)c1)c1cccc(N2CCOC2=O)c1 208087685 JUZWGWUTQRILEB-SEYXRHQNSA-N 399.446 5.118 30 20 GKED O=C1CC[C@@H](/C(O)=N/CCc2nc(C3CCCCC3)cs2)c2ccccc21 328794606 BMYQDSJAKXHVHQ-GOSISDBHSA-N 382.529 5.450 30 20 GKED C[C@H](S[C@@H]1CCO[C@@H]1C)C(O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328870933 YDTPTXSRLPYIMQ-QWQRMKEZSA-N 377.506 5.005 30 20 GKED Cc1onc(-c2ccccc2)c1/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329475956 BJHYRGZVMIZUJO-LJQANCHMSA-N 390.487 5.344 30 20 GKED O/C(CC1CCCC1)=N/C1CCC(/C(O)=N\[C@@H]2CSc3ccccc32)CC1 329562004 NAGSAXBCIKZQGK-FAFZWHIHSA-N 386.561 5.886 30 20 GKED C[C@H]1c2ccsc2CCN1C(O)=Nc1cccc(-c2ncc3n2CCCC3)c1 329620817 MTLALXOGELLRRE-HNNXBMFYSA-N 392.528 5.113 30 20 GKED Cc1c([C@@H](/N=C(/O)N2CCC(OCC3CC3)CC2)C(C)C)oc2ccccc12 329814240 UHGYPIPDIROBGU-NRFANRHFSA-N 384.520 5.243 30 20 GKED C=CCC[C@H](N[C@H](C)c1ncc(C(=O)OC)s1)c1ccc(C(F)(F)F)cc1 414101873 MIFRRXFDBMOWNO-DOMZBBRYSA-N 398.450 5.307 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3cc(Cl)cc(C(F)(F)F)c3)[nH]c12 426867314 UCEKLIMMUNRLCN-CYBMUJFWSA-N 377.753 5.034 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2C(=O)c2cccs2)s1 430612237 QUNSKHFOXNGINV-HNNXBMFYSA-N 394.521 5.223 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 432714262 RDLNXHQWPUAXJE-KRWDZBQOSA-N 377.856 5.181 30 20 GKED Cc1nc(-c2ccccc2NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)cs1 433794661 ZFOZEUXGSZYNJX-UHFFFAOYSA-N 390.512 5.433 30 20 GKED Cc1cccc([C@@H](C)SCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 437437221 DIRNKFUWRMSTPM-DLBZAZTESA-N 384.570 5.680 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC(Cc2ccccc2Cl)C1 438666223 GUVUGTCPCDNJQT-OAHLLOKOSA-N 399.947 5.298 30 20 GKED Cc1ccnc2sc(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)c(C)c12 443885848 QMSDPNRYYCVSJT-UHFFFAOYSA-N 375.375 5.056 30 20 GKED COCC[C@@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 453331607 BXVPXILWRONWSF-BFUOFWGJSA-N 380.385 5.145 30 20 GKED CCCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H]1CCCc2cccnc21 458849951 TXRBCUMDMXLUFI-FGZHOGPDSA-N 390.531 5.316 30 20 GKED C[C@@H](Sc1ccc(Cl)c(Cl)c1)C(=O)N(CCC#N)c1ccccc1 463189936 CDWNKRZTBKQJOE-CYBMUJFWSA-N 379.312 5.421 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](c1ccc(OC)cc1)C(F)(F)F 468000336 NFPXZMJDBOJYLW-IBGZPJMESA-N 392.421 5.087 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@@H](COC)C1)c1ccc(C(F)(F)F)cc1 468117906 UYJWRQKPFIYSQQ-APWZRJJASA-N 398.469 5.171 30 20 GKED CCCCOc1cc(OC)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 469975635 TUBXJMQHCQLFOG-INIZCTEOSA-N 398.528 5.378 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1coc2c(C)cc(Br)cc12 471168275 HDVQKQRQNAGJTA-UHFFFAOYSA-N 377.282 5.048 30 20 GKED Cc1csc(Sc2ccc(NC(=O)C[C@H](CC#N)c3ccccc3)cc2)n1 474965784 KHCUUHFSUCKMIZ-KRWDZBQOSA-N 393.537 5.629 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cn(C(C)(C)C)nc1C 475558090 HIAPNOZZAWZILR-MRXNPFEDSA-N 382.552 5.681 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Br)ccc1Cl)c1ccccc1 475590875 SPVLBXFJXZTFDV-CYBMUJFWSA-N 377.669 5.129 30 20 GKED Cc1ccc(F)c(C(=O)Nc2ccc(OC(F)F)c(C(F)(F)F)c2)c1F 477615114 ZQCVYYHMXLMNJU-UHFFFAOYSA-N 381.247 5.146 30 20 GKED CC(C)c1c(C(=O)N[C@H](C)c2ccc(C#N)cc2)cnn1-c1ccccc1Cl 478097613 RYGKTALPYZFEHF-OAHLLOKOSA-N 392.890 5.012 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(-c2nccs2)cc1 479958588 OAJMQRSCFNOCDZ-UHFFFAOYSA-N 389.933 5.745 30 20 GKED N#CCCn1cc(CN[C@@H]2CC[C@H](c3ccccc3F)C2)c(-c2ccccc2)n1 481812275 CPYDNEVHTPUGMK-PZJWPPBQSA-N 388.490 5.029 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)CSc1ccc(C#N)cc1 482520058 RTVJMNSZZGPRQJ-KRWDZBQOSA-N 392.549 5.502 30 20 GKED CC(C)(C)[C@H]1C[C@@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 482936018 WSBBBODXLRUUHA-GHTZIAJQSA-N 393.487 5.066 30 20 GKED CCS[C@H](C)c1noc(CNc2ccc(Oc3ccccc3)c(C#N)c2)n1 488204048 VBUIOIJNOLUXTB-CQSZACIVSA-N 380.473 5.160 30 20 GKED Cc1coc(-c2ccc(C)c(NCc3cc(C#N)ccc3Br)c2)n1 492649209 HARKIVSOKHFQQW-UHFFFAOYSA-N 382.261 5.205 30 20 GKED C=CCC[C@@H](NCc1ncnn1-c1ccccc1)c1ccc(C(F)(F)F)cc1 499606058 MXFGZDUALLVJPR-LJQANCHMSA-N 386.421 5.083 30 20 GKED CCOc1ccc([C@@H](NC(=O)c2cc(C#N)ccc2Cl)c2ccccc2)cc1 505320014 IWGMLDHQTXIARH-QFIPXVFZSA-N 390.870 5.130 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccc(COc2ccccc2)cc1 505754326 HEUQTMCNEBALKI-UHFFFAOYSA-N 392.524 5.225 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2ccccn2)cc1 506865778 SXXBKCRBZJBJLG-UHFFFAOYSA-N 386.455 5.190 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)N2CCC(C)(C#N)CC2)c2cccs2)cc1 508047252 ABNATZOBZDRCAW-DYESRHJHSA-N 395.572 5.686 30 20 GKED C=CCN(C(=O)Cc1c[nH]c2cc(F)ccc12)c1nc(-c2ccccc2)cs1 508902765 WZCOUJQFMFGZJN-UHFFFAOYSA-N 391.471 5.192 30 20 GKED Cc1cccc(NC(=O)[C@H](C)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 521374037 RTIRRUMYSVRYQY-SFHVURJKSA-N 385.467 5.407 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 523509966 GDKZUIDYDICKEA-UHFFFAOYSA-N 392.421 5.711 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1 524609858 MWOXQPZPYXSVNW-FQEVSTJZSA-N 379.504 5.792 30 20 GKED CC(C)c1ccc(OC2CCN(C(=O)c3ccc(C(C)(C)C#N)cc3)CC2)cc1 525990812 QYIMIQMZYWTJAB-UHFFFAOYSA-N 390.527 5.295 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1cc2ccccc2s1 527201187 YPRSQXLMUSICFL-HNNXBMFYSA-N 399.475 5.451 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(Cl)c2c(c1)OCCCO2 530560175 PBNUTIOCJVHNMU-UHFFFAOYSA-N 385.891 5.606 30 20 GKED CC(C)N(CCC(=O)Nc1ccccc1-c1ccccc1)Cc1ccc(C#N)cc1 532490289 HXKBKSPIDCNCDA-UHFFFAOYSA-N 397.522 5.464 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](c1ccccc1)C(C)(C)C 533489457 XOEGAXLFZRPPGH-JTSKRJEESA-N 395.572 5.396 30 20 GKED C=CCCCCCN(C)Cc1csc(N(C(C)=O)c2ccc(C)cc2C)n1 534471256 BKCBZZZCBIJXRE-UHFFFAOYSA-N 385.577 5.623 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 534752218 VTQPQZGEDRVZOV-UHFFFAOYSA-N 386.333 5.185 30 20 GKED C=CCC[C@H](NC(=O)Cc1cccc(OCc2cccnc2)c1)c1ccccc1 536126616 WSHPHZMDVZPQPJ-DEOSSOPVSA-N 386.495 5.027 30 20 GKED N#Cc1ccc(CC(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 536886963 SZJOOFCQBLFCSG-IBGZPJMESA-N 392.808 5.040 30 20 GKED COc1ccc([C@H](C)N(C)C(=O)NCc2ccc(-c3ccccc3C#N)cc2)cc1 538111103 WIUZLHLTIUYBLA-SFHVURJKSA-N 399.494 5.136 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@H](C#N)c1nc2cccc(C)c2[nH]1 540374343 FSMGEJCQPWJDGS-HNNXBMFYSA-N 378.501 5.174 30 20 GKED C=CCC[C@@H](NCc1nc(C(F)(F)F)cs1)c1ccc(C(F)(F)F)cc1 540428906 BXOQSSNCNULSSX-CYBMUJFWSA-N 394.384 5.978 30 20 GKED C[C@H](NC(=O)c1ncccc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 542003379 OTMQAMAVLDRFEL-AWEZNQCLSA-N 395.384 5.130 30 20 GKED N#CCCN(C(=O)c1ccc(SCc2ccccc2)cc1)c1ccc(F)cc1 554286364 FUQLQNYCIQNTES-UHFFFAOYSA-N 390.483 5.678 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1 560611504 DKWVQUWCOBEMBO-UHFFFAOYSA-N 392.808 5.250 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1cccc(C(=O)Nc2ccccc2)c1 570062933 ACDUVUFTYVDTEZ-UHFFFAOYSA-N 383.495 5.223 30 20 GKED C=CCN(C(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 570754432 DSYCHQWLBMYTEI-HUUCEWRRSA-N 380.435 5.308 30 20 GKED CC(C)c1nc(Cc2noc(-c3cn(CCCC#N)c4ccccc34)n2)cs1 580886031 SSQANNVEKWTKJF-UHFFFAOYSA-N 391.500 5.166 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)C(C)(C)c1cc(F)cc(C#N)c1 581847549 OLXNFHRBUJKRQL-CQSZACIVSA-N 387.524 5.083 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC3(CCC3)CC2)cc1 588023088 XWMNMBVWVBTLOP-UHFFFAOYSA-N 376.525 5.257 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)CCCCCC#N)C1CCCC1 588753286 UQAMTEVQTKGIAZ-UHFFFAOYSA-N 378.516 5.594 30 20 GKED C=CCCO[C@H](C)C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 590023890 YPORXXQYKVIDRQ-OAHLLOKOSA-N 380.419 5.086 30 20 GKED N#CC1(CC(=O)N(Cc2ccc(-c3ccccc3C(F)(F)F)o2)C2CC2)CC1 590176960 XANLWTFYRYMRJY-UHFFFAOYSA-N 388.389 5.150 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](C)(c2cccc(F)c2)C1 593159498 NQPCDHAKGVMSQL-ZHRRBRCNSA-N 397.519 5.273 30 20 GKED Cc1nc(CNC2(c3ccc(C#N)cc3)CCC2)oc1-c1ccc(Cl)cc1 594032458 SRWUPZDYVLGFND-UHFFFAOYSA-N 377.875 5.344 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCCC(F)(F)CC1 599741256 FZZZNWMNYNBCOC-UHFFFAOYSA-N 399.441 5.099 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 609176013 VZYVBUFGNBQLTB-UHFFFAOYSA-N 394.883 5.978 30 20 GKED COCc1c(C(=O)Nc2ccccc2SC[C@H](C)C#N)oc2ccccc12 609377122 PDUXNWBZXORUPW-CQSZACIVSA-N 380.469 5.083 30 20 GKED CN(C)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 609378434 LQWBPIXSXHGYOM-UHFFFAOYSA-N 393.434 5.029 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)CCc3cc(Cl)cs3)cn2)cc1 609907135 MTOGGCHBDDENNF-UHFFFAOYSA-N 383.860 5.032 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cccc(-c4cscn4)c3)cn2)c1 610290473 LDLQBGFQVXBIHE-UHFFFAOYSA-N 398.447 5.121 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1cccs1)c1cccc(C#N)c1 610360789 GNXYHKBZKGWOAP-HNNXBMFYSA-N 378.522 5.403 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1F)c1cccc(C#N)c1 610406874 GTKJEISVMUDIDO-GOSISDBHSA-N 387.458 5.170 30 20 GKED Cc1ccc(NCc2cccc(OCCCC#N)c2)c(OCC(F)(F)F)c1 610910449 JCHXDPMPPPNORI-UHFFFAOYSA-N 378.394 5.231 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3nc(-c4ccccc4)oc3C)n2)cc1 613315231 DABRVSUNJNRTHJ-GOSISDBHSA-N 399.475 5.572 30 20 GKED COc1ccc2cc(-c3noc([C@H]4CCCN4c4ccc(C#N)cc4)n3)ccc2c1 615131475 OEZDEIAEFTZWJE-JOCHJYFZSA-N 396.450 5.112 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 618742646 NVQZVQCVIVXHMB-FQEVSTJZSA-N 393.830 5.157 30 20 GKED N#Cc1cc(O)cc(C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)c1 619137139 UAORWUQINQPOTM-UHFFFAOYSA-N 383.234 5.490 30 20 GKED C[C@H](NCc1ccc(OC(F)(F)F)c(Br)c1)c1cccc(C#N)c1 619427377 TXAUUFJYJWSLQB-NSHDSACASA-N 399.210 5.070 30 20 GKED C[C@H](CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 727589078 HURFPOMSHHUUAS-NTKDMRAZSA-N 383.495 5.609 30 20 GKED CC(C)(C)c1ccc(SCC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730422324 WHWSUGXEXNBYBN-INIZCTEOSA-N 398.528 5.701 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(F)c(Br)c2)c(Cl)c1OC 730434677 RTVLUJPZCBVGOS-QPJJXVBHSA-N 399.643 5.155 30 20 GKED C[C@H](Cc1ccccc1Cl)NC(=O)Nc1ccccc1S[C@H](C)CC#N 731400913 XSWBSCGALYUAHK-HUUCEWRRSA-N 387.936 5.487 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccccc3SC(F)F)cc2)nc1 731960334 ZHRXRSAKUVSXOD-UHFFFAOYSA-N 397.406 5.313 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)NC/C=C\c2ccccc2)cc1 733044553 YDTMDLQCMLSRND-UITAMQMPSA-N 399.469 5.123 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(CCC2CCCCC2)o1 735233056 HTRFDKDVTAZJFS-UHFFFAOYSA-N 391.924 5.431 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc(N4CCCC4)cc3)c2)cc1 737778346 WCHTWACGVZYGIA-UHFFFAOYSA-N 382.467 5.154 30 20 GKED CCCCn1nc(C)c(CNCc2cccc(-c3ccc(C#N)s3)c2)c1Cl 740011064 IMJXPPVWQUHDMZ-UHFFFAOYSA-N 398.963 5.535 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccccc2SCC=C(C)C)c1 741188448 QHBXZDPCAAOVPL-IBGZPJMESA-N 394.540 5.356 30 20 GKED FC(F)Sc1ccc(CN2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 747447474 KFOGAPGIOAMWON-GHMZBOCLSA-N 393.343 5.564 30 20 GKED N#CCC[C@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 749035035 NLJIXVALJLIUFV-KJCUYJGMSA-N 392.808 5.447 30 20 GKED N#Cc1cccc(COc2ccc(NCc3coc(-c4ccccc4)n3)cc2)c1 755426975 YTBPYHLJNMJUOQ-UHFFFAOYSA-N 381.435 5.404 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cc(F)ccc2F)cs1 757476643 YAGZCNCXLUNQOT-UXBLZVDNSA-N 398.434 5.310 30 20 GKED CSCc1ccccc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 760074091 RKRIAAQQPQUSBS-UHFFFAOYSA-N 393.537 5.471 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1)c1nc(-c2ccc(SC(C)(C)C)cn2)no1 762391260 QUQYLRNWBYFUTP-CYBMUJFWSA-N 380.473 5.034 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C/C(=O)c2ccc(Br)cc2Cl)cc1 765612796 FQHOYLTWFUBISQ-KFRNIWOLSA-N 390.664 5.289 30 20 GKED C=CCC[C@@H](NC(=O)Nc1cnn(C)c1C1CC1)c1ccc(C(F)(F)F)cc1 771209841 GQTLXICTWMGZSV-MRXNPFEDSA-N 392.425 5.145 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(OC)cc1 776076924 KXBWEHHEIBBTJX-VQTJNVASSA-N 390.508 5.497 30 20 GKED COC(C)(C)CC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 786317515 SXBQMEVZXUJFNL-LBPRGKRZSA-N 383.300 5.108 30 20 GKED Cn1c(CC(=NOCCCCOC(C)(C)C)c2ccccc2)nc2ccccc21 788784923 ALDMBXLTTMMPLQ-UHFFFAOYSA-N 393.531 5.132 30 20 GKED N#CC1(N(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)C2CC2)CCC1 791002067 BMGJZXCAYHIDMK-UHFFFAOYSA-N 385.442 5.092 30 20 GKED CCc1ccccc1[C@@H]1C[C@H]1C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 802053142 JDTBOYBTCVIFCC-HBMCJLEFSA-N 397.503 5.224 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(Br)nc1 810229089 RQLBFKBURTYRPA-HNNXBMFYSA-N 392.300 5.234 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CCC[C@@H]2NCc1ccc(C#N)c(F)c1 817409549 AYDNZKXOJANWGN-NRFANRHFSA-N 395.478 5.212 30 20 GKED COc1ccc(CNc2cnc(Cl)c(C(F)(F)F)c2)cc1OCCCC#N 841504757 AAZMZEQNLVDRSG-UHFFFAOYSA-N 399.800 5.057 30 20 GKED N#C[C@@H](C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1nc(C2CC2)cs1 842939134 OPWXXLXJZNULTI-HNNXBMFYSA-N 397.887 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)OC(C)(C)C)nc1 861268827 DRWRWHLBONKRAF-UHFFFAOYSA-N 395.503 5.533 30 20 GKED C=CCN(C(=O)/C=C\c1cccs1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 896595647 WGHLNBJQNUALKD-KTKRTIGZSA-N 397.481 5.012 30 20 GKED COC(=O)c1sc2ncc(C(=O)/C=C/c3ccc(Cl)s3)cc2c1C 914773704 RXNSGNLNYJKIJX-HWKANZROSA-N 377.874 5.002 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2csc3ccccc23)cc1 916955926 VTNVLZPDGKAUCA-KSSFIOAISA-N 376.481 5.376 30 20 GKED COc1cc(/C=C\C(=O)c2ccccc2C)cc(Br)c1OC(F)F 917142472 FEFQZZHCGJUEMG-FPLPWBNLSA-N 397.215 5.264 30 20 GKED CCc1cccc2c(C(=O)[C@@H](NCc3ccc(C#N)cc3)c3ccccc3)c[nH]c12 917934976 JCTGQVLYXDVRQZ-VWLOTQADSA-N 393.490 5.316 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3ccsc3)n2)cnn1-c1ccccc1 920065701 GYVJTPCTZHICNH-FPLPWBNLSA-N 377.494 5.262 30 20 GKED Cc1ncc(CO)c(C=Nc2ccc(Sc3ccccc3Cl)cc2)c1O 920864318 SIJDQINKFLBFNV-UHFFFAOYSA-N 384.888 5.143 30 20 GKED Cc1c(O)nc2ccccc2c1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 1293164607 LOHPNVZXPYEIQV-UHFFFAOYSA-N 395.418 5.165 30 20 GKED O=C(O)c1cc(NN=CCCc2ccc(-c3ccccc3)cc2)ccc1Cl 1776033740 ASQLLQLIQKYKAP-UHFFFAOYSA-N 378.859 5.736 30 20 GKED C=C(C)COc1cc(/C=C\c2ccc3cc(C(=O)O)ccc3n2)ccc1OC 1776140132 YWUIXPPMWZCZSF-YWEYNIOJSA-N 375.424 5.067 30 20 GKED C=CCN(C(=O)c1cc(C)cc(C)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 7724825 QRDIGJHOBBBOOY-UHFFFAOYSA-N 393.468 5.168 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccccc1OC(F)(F)F 21039938 UCYVJMJJRRLKFH-UHFFFAOYSA-N 396.368 5.054 30 20 GKED Cc1c(C#N)c(S[C@H](C(=O)Nc2ccccc2)c2ccccc2)nc2c1CCC2 25041650 KGKBWEWBQPVSJL-QFIPXVFZSA-N 399.519 5.223 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@H](C#N)c1ccc2ccccc2n1 48858923 LNTCQTFXIMLJPG-GOSISDBHSA-N 383.476 5.081 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)c1cc(-c2ccco2)nc2ccccc12 116712250 MJHHEFBJOCPVAS-UHFFFAOYSA-N 397.434 5.406 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3ncccc3c2)cc1 122799413 UTXRMWRQLXOFHX-UHFFFAOYSA-N 393.446 5.132 30 20 GKED COc1cc(CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1Cl 122853076 UWGIPGNKNWVGAI-AWEZNQCLSA-N 388.920 5.172 30 20 GKED CC[C@H](C)n1ncc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 127920291 PMRNWDUTEFIEQF-FZMZJTMJSA-N 398.919 5.485 30 20 GKED Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 153999965 XCTQTJPUUBANGN-GBESFXJTSA-N 393.556 5.799 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(-c2ccccc2F)s1 171540565 QYOLXHKHTVUBHA-VMPITWQZSA-N 380.366 5.209 30 20 GKED Cc1cccc2c(CCNC(=O)Nc3ccccc3S[C@H](C)CC#N)c[nH]c12 173122259 QNPSNPYHPAYMIS-MRXNPFEDSA-N 392.528 5.235 30 20 GKED Cc1csc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1Br 190928052 YGCGDWXQOFJTSU-NSHDSACASA-N 395.347 5.466 30 20 GKED C[C@H](NC(=O)c1ccccc1Sc1ccccc1C#N)c1nc2ccccc2[nH]1 195127321 IESXLTXSSKVYHN-HNNXBMFYSA-N 398.491 5.077 30 20 GKED CSCC[C@H](/N=C(/O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1nnc2ccccn12 328985180 GKQAHUNCMUELKZ-MLHJIOFPSA-N 386.565 5.087 30 20 GKED COc1c(N=C(O)[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc(Cl)cc1C(=O)N(C)C 329150356 RMHWIHPNVAWXNC-RRFJBIMHSA-N 392.927 5.245 30 20 GKED C[C@@H]1CC(=O)CC[C@H]1C(O)=Nc1nc(-c2ccc(Br)s2)cs1 329188516 BQNAHNKEPMECOT-PSASIEDQSA-N 399.335 5.227 30 20 GKED Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1N=C(O)[C@H](C)c1ncccc1F 329902118 PEGHXXWKTFYRPU-BFYDXBDKSA-N 397.494 5.039 30 20 GKED CCC[C@H]1CCc2nc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)sc2C1 330027265 MULBLWZRIXYCQN-JEYLPNPQSA-N 389.565 5.561 30 20 GKED Cc1ccccc1-c1ccc(CN(CCCC2(C#N)CCOCC2)C(C)C)s1 410336430 GJCYETRFLDEQJE-UHFFFAOYSA-N 396.600 6.035 30 20 GKED C=CCC[C@H](NC(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 429085543 ZTAPMGNLHPQMCO-VABKMULXSA-N 378.516 5.161 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cnn1-c1ccc(Cl)cc1 430597748 MVQSJXCNOZMOLU-OAHLLOKOSA-N 398.919 5.078 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OC(F)F 431777997 FVBIQRKNDCJKNM-YJBOKZPZSA-N 387.430 5.083 30 20 GKED C=CCC[C@H](NC(=O)c1ccc(SCc2nc(C)no2)cc1)c1ccccc1 435282898 XHQJGCSKWQAOLA-FQEVSTJZSA-N 393.512 5.108 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc3cccnc23)cc1F 437470485 UTUHEAXLJIEUDS-UHFFFAOYSA-N 383.382 5.290 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc2c3c(cccc13)CC2 437614702 MRJQFEUKVVWCIK-FYYLOGMGSA-N 381.479 5.242 30 20 GKED CSc1ccccc1[C@H](C)NCC(=O)Nc1ccccc1S[C@H](C)CC#N 440632266 CJOYZIJKEAJIKD-CVEARBPZSA-N 399.585 5.092 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1NC(=O)CC(C)C 442619759 UNLCFARFEGQPJY-INIZCTEOSA-N 391.496 5.079 30 20 GKED CC(=O)c1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1Cl 445156198 GCVDRDVNFFCAHS-UHFFFAOYSA-N 379.847 5.053 30 20 GKED CCO[C@H](c1ccccc1)c1noc(/C=C/c2cn(CCC#N)c3ccccc23)n1 445803398 SNZJNLWGUTWXOP-YAOQVBECSA-N 398.466 5.234 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3cc(Cl)sc3Cl)ccc21 449273863 XINYQBXPPWGNHN-UHFFFAOYSA-N 394.327 5.250 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H](C(F)(F)F)[C@H]1C(F)(F)F)c1ccccc1 456578164 PHKPVUUNNYFXDA-XPKDYRNWSA-N 379.344 5.078 30 20 GKED C=C(C)Cn1c(-c2ncccc2C)nnc1N1CCC[C@@H]1c1ccc(Cl)cc1 460772250 QKMWFHQGQFPQMB-LJQANCHMSA-N 393.922 5.220 30 20 GKED N#C[C@@H]1CCC[C@H](NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 463296721 FYZGZMNYNDFWCG-ZBFHGGJFSA-N 375.394 5.065 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(COc2ccccc2)cc1 464947496 FMBAMSBHQIBNCG-LOSJGSFVSA-N 396.490 5.178 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccc4cnccc34)cc2Cl)cc1 465077283 HNVUPSJJTXKKNW-UHFFFAOYSA-N 399.837 5.804 30 20 GKED C[C@@H](CC(F)(F)F)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 467159296 GLHRXKNHQSXVPK-BLLLJJGKSA-N 395.812 5.458 30 20 GKED CC[C@@H](NC(=O)c1cn(CCCC#N)c2ccccc12)c1ccc(F)cc1F 469448318 NKIMQJVDYJOHBD-HXUWFJFHSA-N 381.426 5.104 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NC[C@H]1CCCO[C@@H]1c1ccc(C)cc1 471977838 JLQBHSGLSPIMRP-DNQXCXABSA-N 392.543 5.251 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1ccc(C(C)(C)C(=O)OC)cc1 475549584 QUFDVZAXVAZENL-UHFFFAOYSA-N 394.515 5.633 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1csc(C(C)(C)C)n1 475570245 KRQMDJSKHRARKE-UHFFFAOYSA-N 385.577 5.657 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)[C@H]1c1ccccc1 480803296 KKXJDGJTHHYDDX-GAJHUEQPSA-N 383.451 5.575 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)c(OC2CCCC2)c1 482854946 GYZZFNYTEYVWFP-KRWDZBQOSA-N 384.501 5.087 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(-c2nc(O)cc(CC)n2)c1)c1ccccc1 488641685 ANNBYDDBJFTTET-NRFANRHFSA-N 387.483 5.100 30 20 GKED C=CCC[C@@H](C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccccc1 488820730 UUUBHJSWVCWSQU-AAZCMCCISA-N 388.555 5.048 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc2nc(-c3ccccc3Cl)[nH]c2c1 497994425 REKAAHRHKROPEW-UHFFFAOYSA-N 378.844 5.069 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 500611398 OMARINSYLAHKOQ-ZDUSSCGKSA-N 376.378 5.108 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COc2cccc(F)c2)c1)c1ccc(C#N)cc1 505356791 AMQYEWNQHMEMAX-MRXNPFEDSA-N 389.430 5.159 30 20 GKED N#C[C@H](C(=O)c1cc(-c2ccco2)nc2ccccc12)c1nc2ccccc2s1 517281326 JSHVBGOYTSZFRX-MRXNPFEDSA-N 395.443 5.595 30 20 GKED CC(C)c1ccc(CCNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 518256468 XEFOMTRSAHZGMU-QGZVFWFLSA-N 381.545 5.568 30 20 GKED Cc1[nH]c2ccc(CNC(=O)Nc3ccccc3SC[C@H](C)C#N)cc2c1C 521748513 UWIPLQGSXUVOQO-CQSZACIVSA-N 392.528 5.358 30 20 GKED N#CCc1cccc(C(=O)N[C@@H](c2ccccc2)c2ccc3ccccc3c2)c1 521872582 VEIFSBIXPXQDRM-VWLOTQADSA-N 376.459 5.425 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 523510796 ANDJLUDZGVVQRB-UHFFFAOYSA-N 381.442 5.454 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)N[C@@H](C)c1cccc2ccccc12 525116910 WCWMTTQZHTVEQS-GJZGRUSLSA-N 378.472 5.209 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1[C@H]2CC[C@H]1CC1(C2)CC1(F)F 529654753 FSFRZUFZVZHLRC-IRXDYDNUSA-N 394.421 5.143 30 20 GKED CN(C(=O)CCc1nc2cc(Cl)ccc2s1)c1cc(Cl)ccc1C#N 532190205 YTVWGUZQQLLEMY-UHFFFAOYSA-N 390.295 5.070 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cs2)n1C 536186740 JARUIRLMJKODQJ-AWEZNQCLSA-N 396.541 5.104 30 20 GKED C=CCC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1)c1ccccc1 540147413 UMGRGGQKNKBBLV-NTKDMRAZSA-N 397.584 5.761 30 20 GKED COc1cc(C[S@@](=O)CCCC(C)(C)C)ccc1OCc1cccc(C#N)c1 542857711 CEQDBUFOXVFANM-NDEPHWFRSA-N 399.556 5.221 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H](C)Cc1cncc2ccccc12 554678674 KODDCJQIMULIGK-OAHLLOKOSA-N 384.932 5.343 30 20 GKED C=CCN(C(=O)c1ccc(SCC)nc1)c1nc(-c2ccccc2)cs1 556343928 YMDHZOFUUVECOI-UHFFFAOYSA-N 381.526 5.150 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(Oc4ccccc4)o3)cc2)ccn1 561406064 CHLUVAXGEKERSC-UHFFFAOYSA-N 397.390 5.383 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N[C@@H]3CCCc4sccc43)cc2)ccn1 562108894 MWNWKOKJLMIQJU-LJQANCHMSA-N 390.468 5.006 30 20 GKED N#Cc1cccc(C2(NCCC(C#N)(c3ccccc3)c3ccccc3)CC2)c1 574589889 JYZPJNVUNNCBRA-UHFFFAOYSA-N 377.491 5.037 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC(c4c(Cl)cccc4Cl)CC3)cc2)CC1 576970650 OPSDLHIKDUNPTC-UHFFFAOYSA-N 399.321 5.568 30 20 GKED C[C@H](c1ccccc1)N(C(=O)c1ccc(COc2ccccc2C#N)o1)C1CC1 577302038 BWTAFCVKOBCUIA-QGZVFWFLSA-N 386.451 5.096 30 20 GKED CCc1noc(-c2ccc(C)c(NCc3ccc(C#N)cc3C(F)(F)F)c2)n1 589503155 PHGMYDZZDNHANG-UHFFFAOYSA-N 386.377 5.110 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(C2CCOCC2)cc1 601128833 DTJKAQSKKWYCQD-INIZCTEOSA-N 380.513 5.085 30 20 GKED CCCN(C(=O)c1cccc(CC#N)c1)[C@@H](C)c1ccccc1Br 603962626 LMABBJMDKCOMEY-HNNXBMFYSA-N 385.305 5.129 30 20 GKED CC(=O)c1csc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 607274332 HHYUNVDRRAJVBC-LLVKDONJSA-N 394.399 5.069 30 20 GKED COc1ccccc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609063025 QYTJNKYIHCDABQ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1ccc2oc(C(=O)Nc3ccc(OCc4cccc(C#N)c4)cc3)cc2c1 609063585 FBJBSMFJMWAQED-UHFFFAOYSA-N 382.419 5.444 30 20 GKED N#Cc1ccc(CNC(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)cc1 609471166 DQXBXEMYVRNWTM-RUZDIDTESA-N 391.474 5.300 30 20 GKED C[C@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)c1c(Cl)cccc1Cl 610355445 QVSGTYGEIZVELB-OLZOCXBDSA-N 376.287 5.029 30 20 GKED COc1ccc(CN(C)Cc2ccc(C(F)(F)F)cc2)cc1OCCCC#N 610931013 DAOYDTUIFMKHRX-UHFFFAOYSA-N 392.421 5.029 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccccc2Cl)nc1)c1ccc2ccccc2n1 673812306 USFOQGZCRLXEAP-KRWDZBQOSA-N 399.837 5.566 30 20 GKED C=C(C)COc1cc(CN2CCCC[C@@H]2c2nnc(C3CCC3)o2)ccc1OC 685450989 RMOIUGJURQAVON-LJQANCHMSA-N 397.519 5.028 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3F)s2)cc1NC(C)=O 726429467 UIWDBLPWMDAOOW-NTMALXAHSA-N 395.455 5.417 30 20 GKED COc1ccc(C(=O)/C=C/c2cccc(Oc3ccccc3)c2)cc1NC(C)=O 726430137 XKWFOLMOMHVDTO-ACCUITESSA-N 387.435 5.342 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc4ncccc4c3)s2)cc1 727976031 ZZQPBOLKLQOXCL-WUXMJOGZSA-N 386.476 5.571 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cc3ccccc3n2Cc2ccccc2F)c1 728481932 WKFJGHNWILNSLM-UHFFFAOYSA-N 382.438 5.087 30 20 GKED O=C(/C=C/c1ncc(-c2cccc(Br)c2)[nH]1)c1ccc(Cl)s1 731938595 QOQSWUUOTAHXDC-QPJJXVBHSA-N 393.693 5.450 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1c1ccccc1C(F)(F)F 734479199 IWTNAIXYXRIJHT-CQSZACIVSA-N 385.311 5.332 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)COc2c(Cl)ccc(Cl)c21 743055555 FMCZKNFHUYLAGJ-LCYFTJDESA-N 399.233 5.234 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)n1 747197948 PDWNMBDJZPKVFT-SOUVJXGZSA-N 379.312 5.553 30 20 GKED CCOc1ccccc1Oc1ccccc1C(=O)Nc1cccc(OCC#N)c1 748698715 PPMMSPWVFZZWRE-UHFFFAOYSA-N 388.423 5.032 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 757854241 GKQCLQRZMODMTI-FCHUYYIVSA-N 377.488 5.252 30 20 GKED COc1cccc2c1CC[C@@H]2NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760010551 XAVHVPDECUAESH-GOTSBHOMSA-N 397.478 5.160 30 20 GKED C[C@@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1ccc(C#N)cc1 761713496 SKFBTDOPRGYEBD-YXHQGMJNSA-N 378.781 5.035 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1cnc(-c3ccncc3)s1)CCO2 767738375 VKGLKKTTZGPZNP-BOPFTXTBSA-N 376.481 5.377 30 20 GKED Cc1cnc([C@H](C)OC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)o1 771040644 YMHFLSBAJKPADL-ZDUSSCGKSA-N 382.803 5.218 30 20 GKED C[C@H](N[C@H](c1ccc(Br)cc1)C1CCC1)c1ccc(OCC#N)cc1 776157576 COLMARFMEPWKLN-BTYIYWSLSA-N 399.332 5.543 30 20 GKED N#Cc1ccc(CN[C@H](c2ccc(Br)cc2Cl)C2CC2)cc1 783225080 UYUCZEOLGVTWIW-SFHVURJKSA-N 375.697 5.215 30 20 GKED Fc1ccc(C(C[C@@H]2CCOC2)=NNc2ccc(OCC(F)(F)F)cc2)cc1 793004878 QFQOJNRODVYMDN-AWEZNQCLSA-N 396.384 5.010 30 20 GKED Cc1ccc2c(C(=O)[C@H](C#N)C(=O)Nc3cccc4ccccc34)csc2c1 796637293 VEKYWPBRYKBAHL-SFHVURJKSA-N 384.460 5.324 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1 798813940 BLRHZUYTJNGHOD-YVEFUNNKSA-N 398.384 5.190 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)cc1C#N 799377257 JOHQZSICZOKGAX-UHFFFAOYSA-N 399.237 5.008 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2ccc(C(F)(F)F)s2)C(=O)c2ccccc21 802707037 CVNHFQQJSYCKGD-GDXASINISA-N 380.387 5.084 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)c2cc3cc(Br)ccc3o2)cn1 806566866 BPPPBPOFJQWJIP-XQRVVYSFSA-N 385.261 5.179 30 20 GKED C=CC[C@H](N[C@H]1CCCc2c1[nH]c1ccc(Br)cc21)c1ccncc1 808697113 WFBZPLAYSPJRQS-ICSRJNTNSA-N 396.332 5.610 30 20 GKED CC(=NOCC(=O)c1cc(C)n(Cc2ccco2)c1C)c1cc2ccccc2o1 852754597 XKGJPZGAMCQJBJ-UHFFFAOYSA-N 390.439 5.116 30 20 GKED C[C@H](c1nc(-c2ccc(Cl)cc2)no1)[S@@](=O)CCCCC1(C#N)CCC1 899394047 CDDOSYGUHIEFOJ-PTFIGZPYSA-N 391.924 5.064 30 20 GKED C=C(Cl)C[C@H](NC(=O)OC(C)(C)C)c1nc(Cc2ccc(Cl)cc2)no1 904543749 FIRSIZDASQFFIW-AWEZNQCLSA-N 398.290 5.022 30 20 GKED N#Cc1ccsc1NC(=O)c1sc2cc(Cl)cc(Cl)c2c1Cl 908180004 GFHGGINUHQZKSB-UHFFFAOYSA-N 387.700 6.047 30 20 GKED C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915087997 YJGCWQJPXPTNDH-AOMKIAJQSA-N 390.870 5.401 30 20 GKED C[C@H](/N=C/c1cc2ccccc2nc1O)c1ccc(OCc2cccnc2)cc1 915271253 QKIGPLYHEPDPEQ-AEIQVQRHSA-N 383.451 5.095 30 20 GKED CC[C@@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1OC 915352032 FHRNAQPFRXNAFF-XZOQPEGZSA-N 399.494 5.623 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2sccc2Br)cc1 915863004 RCTUHNYBIZJVGZ-MRXNPFEDSA-N 397.297 5.418 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C/C=C\c4ccco4)c23)cc1 920367772 QAFOTVCMXZVJPK-RXEZMWGXSA-N 376.441 5.071 30 20 GKED CCC(=NN1CCC(C(C)(C)C)CC1)c1ccc(OCCCCC(=O)O)cc1 1776057820 HKBQKFMONQPGDN-UHFFFAOYSA-N 388.552 5.193 30 20 GKED C=C(C)C[C@H](NCc1cc(F)ccc1Oc1ccc(Cl)c(Cl)c1)C(=O)O 1776137678 QVFBFFZPLSUMQV-KRWDZBQOSA-N 398.261 5.434 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cc(C(=O)O)ccc2Br)cc1 1776700063 SKYWCADNUIVXFG-YGNAEDSMSA-N 387.273 5.557 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CC[C@@H](C(=O)O)CC23CC3)cc1 1776787504 HVSNSVREQJLZEX-GOSISDBHSA-N 389.561 5.219 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)c(C)c1 1777353291 RBRYPGZCEFBWOD-JXMROGBWSA-N 378.449 5.326 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3cc(C(=O)O)c(C)cc3C)s2)cc1 1777430653 YVWLMZPMBQXNSB-KTKRTIGZSA-N 391.492 5.638 30 20 GKED O=C(/C=C/c1ccc(-c2cc(Cl)ccc2Cl)o1)c1csc(C(=O)O)c1 1777569475 YOGLWFLPOUNEPE-GORDUTHDSA-N 393.247 5.909 30 20 GKED Cc1cc(C(=O)COc2ccc(C#N)cc2Cl)c(C)n1Cc1cccs1 7856689 XNSXNFQGLJDMAN-UHFFFAOYSA-N 384.888 5.002 30 20 GKED Cc1cc[n+](/C(C(=O)c2cc(C)ccc2C)=C(/S)N[C@@H]2CCCC[C@@H]2C)cc1 27486994 CJDOVOIPSCARKS-PZJWPPBQSA-O 395.592 5.006 30 20 GKED CCCCC[C@H](C)n1c(SC[C@@H](C#N)CCC#N)nc2ccccc2c1=O 61732739 DBILMCKESRXKOE-DLBZAZTESA-N 382.533 5.073 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cnc(-c2ccccc2F)s1 109025828 YQDQYMYHZATLON-UHFFFAOYSA-N 392.908 5.493 30 20 GKED Cc1csc(-c2cccc(NC(=O)Nc3cccc(OCCCC#N)c3)c2)n1 113561885 VXGAPKNTNGVUMC-UHFFFAOYSA-N 392.484 5.445 30 20 GKED CC(C)[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1ccccc1 114620438 YRPZLUGPZCPAGF-RTBURBONSA-N 375.497 5.211 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2ccc(Cl)cc2)[n+]2ccccc2)s1 123653325 OOSHBVPNWPOKDK-UHFFFAOYSA-O 387.937 5.048 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 161973696 BAFZNRMVDXCVIA-ZDUSSCGKSA-N 384.892 5.095 30 20 GKED N#Cc1ccc(SCc2nc3scc(-c4ccco4)c3c(=O)[nH]2)c(Cl)c1 163309488 DAXIASHEOWFLQQ-UHFFFAOYSA-N 399.884 5.062 30 20 GKED N#Cc1cc(F)c(C(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c(F)c1 176012975 QRDIUKISSBTSJI-SFHVURJKSA-N 388.826 5.071 30 20 GKED COc1ccc(-c2ccc(CN[C@H](C)c3ccc(OCC#N)cc3)s2)cc1 181850290 BJNXBELGUFSNHH-MRXNPFEDSA-N 378.497 5.177 30 20 GKED COc1ccc(CNc2ccccc2O[C@@H](C)C#N)cc1SC(F)(F)F 182570203 BDZPRDDHOOVRFR-LBPRGKRZSA-N 382.407 5.210 30 20 GKED N#CC1(c2ccc(-c3nc(-c4cccnc4Oc4ccccc4)no3)cc2)CC1 182789993 VYACNPRRXOOGAY-UHFFFAOYSA-N 380.407 5.146 30 20 GKED COc1ccc(CNC2(c3cccc(C)c3)CCCC2)cc1OCCCC#N 237345500 XGLMOYIMIVVJBC-UHFFFAOYSA-N 378.516 5.245 30 20 GKED CCc1nc2cc(N=C(O)CC/N=C(/O)C34CC5CC(CC(C5)C3)C4)ccc2o1 328906216 KOAINUNGKCFXBW-UHFFFAOYSA-N 395.503 5.541 30 20 GKED COc1ccc(N=C(O)[C@H]2CCC(=O)[C@H](C)C2)cc1N=C(O)C1CCCCC1 328947629 KFTBHUDDJCWLAQ-ZBFHGGJFSA-N 386.492 5.457 30 20 GKED COc1cccc(Cl)c1C/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329623846 NYJUCWMIIYOCAF-SFHVURJKSA-N 387.911 5.237 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 409916830 ZEOHWLOFIUGCBJ-RTBURBONSA-N 387.310 5.406 30 20 GKED C[C@@H]1[C@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)[C@@H]1c1ccccc1 430418790 YGLDFUCPJVWIFG-WDNCENIBSA-N 396.490 5.320 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)NCC2(CC#N)CC2)C(C)C)s1 431193074 OITIERGOLZYDES-UHFFFAOYSA-N 381.545 5.337 30 20 GKED N#CCc1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)cc1 454336883 AGWZVNUSNBPZEF-IBGZPJMESA-N 393.878 5.041 30 20 GKED Cc1ccc(CC[C@@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 460541198 ZYQFISQENUVZLL-QGZVFWFLSA-N 388.467 5.198 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cccc(-c2ncc3n2CCCC3)c1 463688545 FUQMJIOCPMDJIQ-UHFFFAOYSA-N 392.528 5.168 30 20 GKED CCN(C(=O)N[C@H](C)c1ccc(C#N)cc1)[C@@H](Cc1ccc(F)cc1)C(C)C 465672017 XQGOIGAIQPOFOO-VGSWGCGISA-N 381.495 5.057 30 20 GKED C[C@@H](N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1nc(C(F)(F)F)cs1 467750400 YMCBHTZUQQFLPX-KCJUWKMLSA-N 386.336 5.645 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cnn1-c1ccc(Cl)cc1 473505980 CGVKKGHTDMJTFB-OAHLLOKOSA-N 398.919 5.158 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(F)(F)F)c(F)c1 473584961 ZWTZWPTYXUKRIU-LLVKDONJSA-N 382.382 5.349 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1ccccc1 474435686 SLRICTDTQUOXFI-LVXARBLLSA-N 394.474 5.726 30 20 GKED Cc1nn(-c2ccc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cc2)c(C)c1Cl 474447204 PURDKROYYZIZJM-MRXNPFEDSA-N 398.919 5.213 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(Cl)c2Oc2cccnc2)cc1 475117516 IIKOYINEOVVZTD-UHFFFAOYSA-N 391.858 5.581 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 475185059 ORCWEJZHOXWFRQ-UYAOXDASSA-N 378.472 5.193 30 20 GKED Cn1cc(CNCc2cccc(Oc3ccccc3)c2)c(-c2ccc(C#N)cc2)n1 479973539 ZCEOBSDFGQVQRH-UHFFFAOYSA-N 394.478 5.041 30 20 GKED C=CCn1c(SCc2cc(C)ccc2OC(F)F)nnc1-c1ccoc1C 488280748 GZRHQJNEKHLJSM-UHFFFAOYSA-N 391.443 5.235 30 20 GKED Cc1c(Br)cccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 501124137 FCTDHEGHFMYERZ-UHFFFAOYSA-N 398.285 5.005 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 503625767 HBNSRSRDRSALHK-UHFFFAOYSA-N 387.527 6.126 30 20 GKED C[C@@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCCCCC#N)nnc1-c1cccs1 514588803 FKDYNXZZUSVUHO-QAETUUGQSA-N 386.590 5.790 30 20 GKED Cc1sc(NC(=O)c2ccc3c(c2)nc(C)n3-c2ccccc2)c(C#N)c1C 514612535 MOHSUTBDZYGZEU-UHFFFAOYSA-N 386.480 5.136 30 20 GKED C=CCC[C@@H](NCc1cc(OC)c(O)c(OC)c1)c1ccc(C(F)(F)F)cc1 515093533 MFIULVPSHCSWKU-QGZVFWFLSA-N 395.421 5.225 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C)c(C)c2)nnc1-c1ccc(F)cc1 515304580 MPRYKWVKQBZAHN-INIZCTEOSA-N 395.503 5.251 30 20 GKED C=CCN(C(=O)CCCOc1ccccc1)c1nc(-c2ccccc2)cs1 515327665 PDTFVVZXCDOBAM-UHFFFAOYSA-N 378.497 5.188 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ncc(Cc2ccccc2)s1 515767723 URWZUWGOTLPQLD-UHFFFAOYSA-N 381.476 5.093 30 20 GKED Cc1cc(C)n([C@H](C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)n1 517734683 BDTFSGIOVQPKPU-OXQOHEQNSA-N 392.890 5.009 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1ncc(-c2ccccc2)s1 519512691 GVWLXXBXWRGIJW-AWEZNQCLSA-N 394.525 5.848 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cccc3[nH]ccc23)c1 522634296 SZMPYNNUFZNOJJ-UHFFFAOYSA-N 387.826 5.738 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)cc1 525005597 LXFDTAWPXZVNQI-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)cc2)c2ccc(F)c(F)c2)c1 525689052 DFMUWFIWNYOXEX-JOCHJYFZSA-N 380.463 5.438 30 20 GKED COc1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1F 534170140 DHTSYDWMDQVWQC-GOSISDBHSA-N 394.833 5.395 30 20 GKED COc1ccc(CN[C@@H](c2ccc(F)c(C)c2)C2CC2)cc1OCCCC#N 535368832 KEKNLPCQOOKSGD-HSZRJFAPSA-N 382.479 5.066 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(C(F)(F)F)nc1C 549295763 GHAOTOVWDLWPHE-UHFFFAOYSA-N 389.830 5.344 30 20 GKED N#Cc1ccc(C2(C(=O)N(Cc3ccccc3C(F)(F)F)CC3CC3)CC2)cc1 552740806 WEDCQCYNLKLYNR-UHFFFAOYSA-N 398.428 5.047 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCc2sc(Cl)cc21 564369680 KYHVGXSNOIIODS-DGCLKSJQSA-N 391.949 5.462 30 20 GKED Cc1cc(=NC(=O)Nc2ccccc2SC[C@H](C)C#N)[nH]n1C1CCCCC1 589327762 FNTDVDMAUXGKMI-OAHLLOKOSA-N 397.548 5.014 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)oc2c(F)cccc12 589470152 HQTRFANKKKGNQM-UHFFFAOYSA-N 387.370 5.192 30 20 GKED Cc1cc(-c2nc3ccc(F)cc3n2C(C)C)ccc1NC(=O)[C@H](C)CC#N 597297764 IHZODABQIXUYBC-CQSZACIVSA-N 378.451 5.220 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2sc(-c3ccccc3)nc2-c2ccccc2)C1 597916535 NXSRQGQPIVTNJA-KRWDZBQOSA-N 387.508 5.243 30 20 GKED C[C@H](Oc1ccc(-c2ccccc2)cc1)C(=O)Nc1sc2c(c1C#N)CCC2 603564528 NKWHVRBWEBFJNF-HNNXBMFYSA-N 388.492 5.181 30 20 GKED CCCN(C(=O)CCc1ccc(C#N)cc1)[C@H](C)c1ccccc1Br 603962647 NUYBZXSDMJLNHU-MRXNPFEDSA-N 399.332 5.253 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 609176562 QRPOTGHSIGABMM-UHFFFAOYSA-N 392.846 5.170 30 20 GKED C[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)c1c(Cl)cccc1Cl 609377040 NABWCCDTQJMFDY-OLZOCXBDSA-N 393.339 5.987 30 20 GKED CC(C)CCN(C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)C1CCCC1 609499371 NMZBTXXSWDNDSF-UHFFFAOYSA-N 377.488 5.176 30 20 GKED N#C[C@@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)C1CCCCC1 609648648 YCBHMRYKFHSOSL-LJQANCHMSA-N 378.501 5.151 30 20 GKED CCCCn1c(S[C@H](C)c2ccc(C#N)cc2)nnc1-c1ccc(OC)cc1 609813517 HGVKVMHMGQMIKA-MRXNPFEDSA-N 392.528 5.479 30 20 GKED Cc1cccc([C@H](C)C(=O)N[C@@H](C#N)c2ccc(OCc3ccccc3)cc2)c1 610063323 OTKZQOAZXKTGOG-CYFREDJKSA-N 384.479 5.059 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C(C)(C)c1ccc2ccccc2c1 610227939 ZINMUMYRFCIJJD-QGZVFWFLSA-N 388.536 6.008 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)c1cc2ccccc2n1CC#N 610303239 WXMGVTACZIZBAH-LJQANCHMSA-N 393.490 5.665 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N[C@@H](C)c1cccc(C#N)c1 610364168 QJYMRZDJAIHZKV-LBPRGKRZSA-N 381.888 5.135 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1-c1cccs1 615491196 KORAEMOAVUYGQR-UHFFFAOYSA-N 378.497 5.644 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(C(F)F)nc1 653734800 KBMYOMGURZBPPQ-GFCCVEGCSA-N 398.253 5.071 30 20 GKED C[C@H](c1ccc(OC(F)F)cc1)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 674461357 XKWGXNBZQCTPEO-FXAINCCUSA-N 377.275 5.022 30 20 GKED Cc1cc(COc2ccc(/C=C3\CCc4sccc4C3=O)cc2)oc1C(=O)O 729936676 FUQPOPVNKAWZPR-RVDMUPIBSA-N 394.448 5.139 30 20 GKED COc1cccc([C@@H]2C[C@@H]2C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 730171649 XSFHOKDGAXGMHP-HJOGWXRNSA-N 382.463 5.093 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(-c2ccc(OC)cc2)cc1F 730177403 FLKLLDDWLYLEPL-UHFFFAOYSA-N 390.414 5.024 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)/C=C/c1ccccc1 730994604 KLFXYFNJFGFFCS-JXMROGBWSA-N 376.403 5.363 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)cc1OC 732571590 SXMHVYUFGFTLOH-ZHACJKMWSA-N 395.480 5.122 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)c3ccccc3SCC#N)CC2)n1 733953386 CSWKALDEMBYGCQ-UHFFFAOYSA-N 399.585 5.076 30 20 GKED CC(C)c1ccccc1NC(=O)CSCc1cc(Cl)ccc1OCC#N 735317876 GYNQZDCUOPEKGQ-UHFFFAOYSA-N 388.920 5.238 30 20 GKED Cc1nn(-c2ccccc2)c(C)c1C(=O)/C=C/c1ccc(OCC(F)F)cc1 741841534 CBXVJKXWYQOEBL-JLHYYAGUSA-N 382.410 5.029 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccc2ccccc2n1 744015365 OYAHOGUDUPGIAO-KSZLIROESA-N 381.262 5.522 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)CCc3cccc(F)c3)n2)cc1 744035001 MAUNLGHDNQPLFJ-JXFKEZNVSA-N 392.499 5.703 30 20 GKED N#Cc1ccc(NC(=O)c2ccccc2SC(F)(F)F)cc1C(F)(F)F 744371626 VMIRKBFFDJMSSV-UHFFFAOYSA-N 390.308 5.441 30 20 GKED O=C(O)CCOc1cccc(/C=C\C(=O)c2cc3c(ccc4ccccc43)o2)c1 746684212 LLYBMWWBUHKQRS-NTMALXAHSA-N 386.403 5.336 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 747359794 VZNILUOSFDSBRR-KRWDZBQOSA-N 381.262 5.901 30 20 GKED C/C(=C\C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 748181634 QATDLHAAVUIKDW-FYWRMAATSA-N 388.389 5.430 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1 748992512 JSVPHKBWHFGNGO-UHFFFAOYSA-N 389.952 5.612 30 20 GKED COc1cc(/C=C2/CSc3ccccc3C2=O)ccc1OCC(F)(F)F 750901260 QOBODVNKKUFIJX-JYRVWZFOSA-N 380.387 5.008 30 20 GKED C[C@@H](C(=O)[C@H](C#N)C(=O)Nc1ccc(F)c(Cl)c1)c1ccc2ccccc2c1 753392414 BAKQIIHTOVZGAU-ACJLOTCBSA-N 394.833 5.083 30 20 GKED COc1cc(F)ccc1NN=Cc1c(C(C)C)nn(-c2ccccc2)c1Cl 761885369 SLMLAADXLNPIDF-UHFFFAOYSA-N 386.858 5.243 30 20 GKED FC(F)(F)C1CCC(C=Nn2c(S)nnc2-c2ccccc2Cl)CC1 767359481 GCLZOBKKDIXBKG-UHFFFAOYSA-N 388.846 5.090 30 20 GKED O=C(OCCCF)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 767374678 MYIXNIRIOZADST-MWENRILCSA-N 390.339 5.012 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2sccc2SC(F)F)cc1 768161240 UTXBYSNGKDGSNB-ZDUSSCGKSA-N 380.485 5.355 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)[C@@H](C)c2nc3ccccc3s2)c1 772983800 LGHZVYGSDNJJNB-SOLBZPMBSA-N 379.529 5.259 30 20 GKED C=CCn1c(SCc2ccc3c(c2)COC3)nnc1-c1cccc(Cl)c1 777933210 QJIKVVAMZUCFCI-UHFFFAOYSA-N 383.904 5.107 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1 780670111 JRHQAJQCGGPHEA-RTBURBONSA-N 399.494 5.320 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)Nc1ccccc1O[C@H](C)C#N 780672911 AAKMTKMOSKGFNQ-OLZOCXBDSA-N 392.286 5.509 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](Cc1ccccc1)c1ccccc1 780678958 ZKXTVDMDVKJVQT-XMSQKQJNSA-N 385.467 5.083 30 20 GKED CCCCCn1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c2ccccc21 781033720 ABUNOZWJHNDRRN-KRWDZBQOSA-N 375.472 5.375 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 783074531 ILCPINPINSIRSR-JSGCOSHPSA-N 390.455 5.050 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)C1(c2c(Cl)cccc2Cl)CCC1 784180558 FBVLNWCDSYRFRE-UHFFFAOYSA-N 393.245 5.095 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1cc(Cl)ccc1OC(F)F 788357338 YCWKDJDUNLSILE-RQOWECAXSA-N 383.725 5.313 30 20 GKED N#C[C@@H](C(=O)/C=C/c1cccc(OC2CCCC2)c1)c1nccc2ccccc12 792095962 YREKVMHZAZSVQC-OTOIZHKDSA-N 382.463 5.446 30 20 GKED CC(C)[C@@](C)(NCc1ccc(OCC#N)cc1)c1ccc(Br)cc1 792344831 LPZDWSKNLWFANQ-HXUWFJFHSA-N 387.321 5.012 30 20 GKED CC(C)[C@H](C=Nn1cnnc1SCc1ccc(Cl)cc1)c1ccccc1 794485295 VCAQIYARLDDUAH-IBGZPJMESA-N 384.936 5.498 30 20 GKED CCCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 797567074 CWXWRIHLYPMINL-KRWDZBQOSA-N 382.529 5.232 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)Cc2coc3cc4c(cc23)CCC4)s1 797568505 JETHDBVRIJQOKK-QGZVFWFLSA-N 378.497 5.094 30 20 GKED N#C[C@H](C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1nc2cc(F)ccc2s1 802077338 RCSZBOJWKNPAON-IUODEOHRSA-N 396.340 5.341 30 20 GKED O=C1/C(=C/c2cc(C(F)(F)F)ccc2Cl)C[C@@H](C(=O)O)c2ccccc21 806561978 FIZTUCZTXMXKNC-XKOZXHHJSA-N 380.749 5.197 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ccc(OC)cc2)cc1OCC 809844307 XGBNJFLOGKWSBG-UHFFFAOYSA-N 377.868 5.087 30 20 GKED O=C(/C=C\c1nccn1CC(F)(F)F)c1ccc(-c2c(F)cccc2F)cc1 811696216 BKJSHIIVTVGGLD-HJWRWDBZSA-N 392.327 5.287 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1cccc(C(=O)C(F)(F)F)c1 841694244 GQUZTBPTXJGXKS-ZDUSSCGKSA-N 378.419 5.438 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C3(C(F)(F)F)CCCC3)n2)cc1 842287668 AGNZYZPWONLYSL-CQSZACIVSA-N 378.419 5.418 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@H](CC)Sc1ccccc1 842291007 YRYZMKREAZKHAJ-UXHICEINSA-N 394.540 5.030 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)C1(c2cccnc2)CC2(CCC2)C1 888862605 LAGDJVHSMBASRZ-KRWDZBQOSA-N 391.540 5.174 30 20 GKED C=C[C@@H](Cc1nc(-c2ccc(OCc3cccnc3)cc2)no1)c1ccccc1 904465973 LGUMHEZBRBPNNG-IBGZPJMESA-N 383.451 5.223 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)/C=C/c1ccc2ccc(Cl)cc2n1 914500241 XAAPSFVVGFGUPP-VAWYXSNFSA-N 389.886 5.212 30 20 GKED CN(Cc1ccc(Cl)s1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351818 GZLKKBIWIHTYCQ-IBGZPJMESA-N 395.915 5.721 30 20 GKED N#Cc1ccccc1NC(=S)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 915996936 CTOSMXSXWGCQFP-FQEVSTJZSA-N 377.900 5.288 30 20 GKED Cc1nc2scc(-c3ccc(Cl)cc3)c2c(=O)n1N=CC1CCCCC1 916272694 IKEDUWBZKQDXME-UHFFFAOYSA-N 385.920 5.501 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4c(F)cccc4s3)n2)cc1 916974013 CVLUMLBCKHDACL-OAHLLOKOSA-N 392.480 5.962 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc3c(c2)CCC3)cc1 919716744 UGMWVJNHYREQMP-HSZRJFAPSA-N 383.520 5.640 30 20 GKED CC(C)=C[C@@H]1[C@@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)C1(C)C 920140347 BYTQZVRCRJFPSX-LMMKCTJWSA-N 375.497 5.096 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C=NNc3ccc(Cl)c(C(=O)O)c3)o2)cc1 1776033503 RTMHBQUHNPFOAW-UHFFFAOYSA-N 396.874 6.042 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1c(Cl)cccc1Cl 1776180261 NHSRSXLRQIOQQL-HNNXBMFYSA-N 390.719 5.522 30 20 GKED CCn1c2ccccc2c2cc(/C=C3\CCc4occ(C(=O)O)c4C3=O)ccc21 1777002728 AXSXZNBVTPOCEQ-RVDMUPIBSA-N 385.419 5.318 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C\c1csc3ccc(C(=O)O)cc13)C2=O 1777372660 RUERYYQDQNVRQD-NNLQFVHNSA-N 378.449 5.067 30 20 GKED Cc1csc([C@@H](C#N)C(=O)COc2ccc(-c3ccccc3)cc2Cl)n1 23104889 BPPVHLJCIYTHGR-INIZCTEOSA-N 382.872 5.027 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cccc(C)c2)[n+]2ccc(C)cc2)cc1 27174012 VHFURQFDWMRXON-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#C[C@H](C(=O)c1ccsc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538203 WZHIQSXTJUSOIG-GFCCVEGCSA-N 379.293 5.668 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccc(Oc3ccccc3C#N)cc2)c(C)c1 60036228 JKSJFKBKPKKAFU-GOSISDBHSA-N 385.467 5.407 30 20 GKED CCc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 66544740 JNYMAXDJLDGYMC-FQEVSTJZSA-N 385.492 5.053 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCCCC(=O)c1ccccc1 66931841 XPKNBKILUQFXAZ-KRWDZBQOSA-N 380.513 5.463 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1ccccc1 91707846 HGBJWPKRADAIEB-ROUUACIJSA-N 393.384 5.163 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CC2(Cl)Cl)cc1Cl 97404278 LKEMMRFJQGIPDJ-GJZGRUSLSA-N 379.674 5.128 30 20 GKED CC(C)(C#N)CCSc1nnc(-c2cccc(Cl)c2)n1Cc1ccco1 122429644 GUUHDKKBAQQLDJ-UHFFFAOYSA-N 386.908 5.272 30 20 GKED O=C(c1occc1-c1ccc(F)cc1)N1CCC(C(F)(F)F)(C(F)(F)F)C1 152398288 VZDHEXDLXVZIEE-UHFFFAOYSA-N 395.274 5.043 30 20 GKED CC1(C)C[C@@H](NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCO1 162545732 TYDPZHIXQYVUIU-PKOBYXMFSA-N 397.906 5.075 30 20 GKED CC(C)c1nc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)cs1 171438269 FSKMKIUEXQRLAB-UHFFFAOYSA-N 391.496 5.164 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(-c3nc4ccccc4s3)o2)n1 177747512 YWPJSXTZRGCCHJ-LBPRGKRZSA-N 393.493 5.626 30 20 GKED Cc1c([C@H](C)Nc2cccc(OCCCC#N)c2)cnn1-c1ccc(F)cc1 179821644 VZXISBGANGYVEU-INIZCTEOSA-N 378.451 5.176 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1ccc(C(F)(F)F)cc1Cl 180249205 CJDYUFCQRKKVRP-SFHVURJKSA-N 380.797 5.004 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN(CCC#N)Cc2ccco2)on1 181132510 VCNNLEMRIIJLRH-UHFFFAOYSA-N 387.439 5.012 30 20 GKED C=C(C)CN(C)Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 181310939 JQMQIHNAKOQOOH-UHFFFAOYSA-N 384.332 5.142 30 20 GKED C[C@H](N[C@H](c1cccc(Cl)c1)c1ccccn1)c1ccc(OCC#N)cc1 181901480 RCXHTBQSBSTMIE-KSFYIVLOSA-N 377.875 5.078 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1ccc(F)c(F)c1 187783825 KLNPQIUBIZEIQI-MGPUTAFESA-N 383.442 5.600 30 20 GKED C[C@H](S[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1ccccc1Br 190899199 SBJPUBJAEJDDTA-STQMWFEESA-N 389.318 5.142 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(C(=O)c2ccccc2)CC1 191423757 JYRRSDNITIAEIA-UHFFFAOYSA-N 390.527 5.665 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(F)cc2C(F)(F)F)CC[C@@H]1C(F)(F)F 192201897 TXMKWMLTGQOZSH-LBPRGKRZSA-N 386.311 5.287 30 20 GKED CC1C/C(=C/c2csc([N+](=O)[O-])c2)C(=O)/C(=C\c2csc([N+](=O)[O-])c2)C1 207185098 YEKCSYZVSMYJEU-JWZUQALGSA-N 390.442 5.092 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2sccc2C)cs1 255211375 VLMOTBAHCAPALB-YVMONPNESA-N 386.473 5.233 30 20 GKED Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@@]1(C#N)CC12CCCC2 298283174 HQMJWUJRSWBIQT-QHCPKHFHSA-N 388.471 5.052 30 20 GKED C[C@H](/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21)c1cn(C)c2ccccc12 330014714 BBJSHMNAJPDOEJ-KKSFZXQISA-N 390.531 5.628 30 20 GKED Cc1ccc(Br)cc1N=C(O)C1CCC(/N=C(/O)C2CC2)CC1 330028553 ORSUQPKALIRFEZ-UHFFFAOYSA-N 379.298 5.271 30 20 GKED C=CCC[C@H](NC(=O)N1CCCC[C@H]1c1nnc(C2CCC2)o1)c1ccccc1 378102725 SEYFHVIBZPQEIW-PMACEKPBSA-N 394.519 5.281 30 20 GKED Cc1nc(C(F)(F)F)sc1C(=O)Nc1sc2c(c1C#N)[C@H](C)[C@@H](C)CC2 410976502 ATRUJAOMVBQJPE-JGVFFNPUSA-N 399.463 5.342 30 20 GKED C=CC[C@@H](C(=O)NCCCCc1nc(-c2cccnc2)cs1)c1ccccc1 427097123 OROHIKNPKVULBI-HXUWFJFHSA-N 391.540 5.004 30 20 GKED Cc1ccc(CN(C(=O)c2cccc(SCC#N)c2)c2ccc(F)cc2)o1 430910784 XUNMCJHZUSOFNA-UHFFFAOYSA-N 380.444 5.190 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)[C@H](C#N)CCc2ccccc2)c1 433344946 VCMQBECBJMWILE-INIZCTEOSA-N 392.446 5.361 30 20 GKED C[C@H](Nc1ccc(NC(=O)[C@@H](C#N)CCc2ccccc2)cc1)c1ccccc1 433357399 XIXDZMWZXOVNKA-SIKLNZKXSA-N 383.495 5.571 30 20 GKED CC[C@@H](C)c1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)on1 437458777 GMQHSYOFLPDGFD-CYBMUJFWSA-N 379.391 5.243 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCc3c([nH]c4c(F)cccc34)C2)c1 439531101 INMFSJRYNJDHPG-UHFFFAOYSA-N 393.462 5.242 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)N(C)Cc2ccc(C#N)cc2)c1 442459138 VLIIHGFCKHJCCT-UHFFFAOYSA-N 385.467 5.110 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1nc2ccccc2[nH]1 442611611 UBFLYKHYNBHMNV-HNNXBMFYSA-N 391.352 5.137 30 20 GKED CCN(C(=O)c1sc(-c2cccc(Cl)c2)nc1C)c1ccc(C#N)cc1 461548514 YCTGGBZVENRLSY-UHFFFAOYSA-N 381.888 5.310 30 20 GKED COc1ccccc1[C@@H](C)SCC(=O)N(CCC#N)c1cccc(C)c1C 463214888 VHMBJLJNLKOLCU-GOSISDBHSA-N 382.529 5.053 30 20 GKED Cc1ccc2c(CCC(=O)N[C@@H](C#N)c3c(Cl)cccc3Cl)c[nH]c2c1 465122233 ORXUESJAFUXCNK-SFHVURJKSA-N 386.282 5.097 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3ccc(-c4ccccc4)cc3)ccc21 468864914 GPSAXGILAVBCKL-UHFFFAOYSA-N 395.506 5.549 30 20 GKED CCCn1nc(C)c(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 470565230 QYFRQJQIBDFMDA-INIZCTEOSA-N 398.919 5.177 30 20 GKED CC1(c2ccc(Cl)cc2)CCN(C(=O)c2cccc(SCC#N)c2)CC1 470694752 RXOUTBDKEKDGFK-UHFFFAOYSA-N 384.932 5.150 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)C[C@H](CC#N)c1ccccc1 474701620 GQCCSPFAGACWTJ-HOCLYGCPSA-N 375.299 5.600 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H](COc2ccccc2Cl)C1)c1ccccc1 476508031 OVWGHICGAOFNIU-AZUAARDMSA-N 396.918 5.045 30 20 GKED C[C@H](NC(=O)Nc1ccc(OCc2ccccc2F)cc1)c1ccc(C#N)cc1 480347582 MCXUJVLEIPYRJD-INIZCTEOSA-N 389.430 5.159 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2)cc1 483199657 OAGRVDJSSADYRG-HSZRJFAPSA-N 388.430 5.340 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2cnc(-c3ccsc3)s2)cc1 485959202 DITRJXBQLXPJSK-INIZCTEOSA-N 381.526 5.164 30 20 GKED C=CCC[C@H](C(=O)Nc1cc(N2CCCC2=O)ccc1Cl)c1ccccc1 488626731 ISGHZXTVIGHWFJ-SFHVURJKSA-N 382.891 5.155 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cc(C(F)F)ccc1Cl 497214463 KDBVFYANPCNXNE-QAPCUYQASA-N 389.833 5.581 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Cc1cncc2ccccc12 497577736 HTSWSIKRCAFXAA-IRXDYDNUSA-N 389.524 5.446 30 20 GKED Cc1nc(NC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)sc1SCC#N 504754650 LGOUBIHMYBXDEJ-UHFFFAOYSA-N 384.530 5.098 30 20 GKED C[C@H]1CCC[C@@H](CNC(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 510610399 XNQCJJTYFAUKBE-AZUAARDMSA-N 391.515 5.279 30 20 GKED N#Cc1cc(F)c(C(=O)N2CC=C(c3ccc(Cl)c(Cl)c3)CC2)c(F)c1 510850925 JTUYOLPTNGPBCB-UHFFFAOYSA-N 393.220 5.073 30 20 GKED COc1cc(CN[C@H](C)c2ccc(C#N)cc2F)ccc1OCc1ccccc1 512611191 IPGONHJFBJLZDO-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#C[C@@H](C(=O)c1cccc(F)c1Sc1ccccc1)c1nc2ccccc2o1 512715230 DQJABMVWHKXOCQ-INIZCTEOSA-N 388.423 5.608 30 20 GKED Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N 518140226 UEXWPPRKMSAAHH-UKRRQHHQSA-N 388.920 5.306 30 20 GKED CSCc1cccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c1 518829529 IYBZYGFGEHUKIO-UHFFFAOYSA-N 388.492 5.253 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCCOc2ccc(F)cc21 520197078 SHLIQNFCFBBTAU-WMLDXEAASA-N 399.491 5.255 30 20 GKED N#CCC[C@@H](NC(=O)N(Cc1ccccc1Cl)CC1CC1)c1ccccc1 521416097 DOHCOWDHNZFSBH-OAQYLSRUSA-N 381.907 5.307 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 524489777 SUIZCONFWOXGPW-UHFFFAOYSA-N 388.492 5.027 30 20 GKED COc1cc(CNC2(c3ccccc3)CCC2)ccc1OCc1cccc(C#N)c1 533029573 YTDUBSHBLZYFLZ-UHFFFAOYSA-N 398.506 5.315 30 20 GKED N#Cc1ccc(CN2CCC(N[C@H]3CCSc4ccc(Cl)cc43)CC2)cc1 539498623 VFCVBSOXYJUBGP-NRFANRHFSA-N 397.975 5.003 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(SCc3cccnc3)cc2)ccc1Cl 540883468 PGHSWTRDXPRKAS-UHFFFAOYSA-N 379.872 5.151 30 20 GKED C[C@H](NCc1nc(Cc2ccccc2)no1)c1ccc(-c2cccc(C#N)c2)cc1 541084079 GMZCIOIHEKEULN-SFHVURJKSA-N 394.478 5.050 30 20 GKED CC[C@H]1C[C@@H](CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 541944748 GUAKEWYRRASXNJ-YJBOKZPZSA-N 382.435 5.023 30 20 GKED C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 541992179 QWLOBKPFIMOEPT-QGZVFWFLSA-N 380.451 5.174 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC2CCCC2)nc1 543794026 HSIJDAUFNIIJBM-OAHLLOKOSA-N 381.501 5.050 30 20 GKED N#CC1(c2ccc(C(=O)N[C@@H](c3cccc(C(F)(F)F)c3)C3CC3)cc2)CC1 549311984 VRULEWZKCYNFIP-LJQANCHMSA-N 384.401 5.142 30 20 GKED N#CCc1ccccc1NC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 550100133 ZVFUAUGRYCZIQZ-UHFFFAOYSA-N 397.453 5.611 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-c3cccc4cccnc34)cc2)n1 552073248 WQQILIKAAVMALW-HXUWFJFHSA-N 397.503 5.972 30 20 GKED Cc1ccc(-c2nsc(NC(=O)c3sc4ccc(C#N)cc4c3C)n2)s1 555860070 SPNLHRZGJLBPCF-UHFFFAOYSA-N 396.522 5.222 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(C(=O)C(C)C)cc1)[C@H](C)c1ccc(C#N)cc1 558764304 CYNLDSQFSGRFGC-ZWKOTPCHSA-N 376.500 5.110 30 20 GKED N#Cc1cccc(COc2cccc(NCc3ccc(C(F)(F)F)cn3)c2)c1 559945019 RXBLGPDZMUXAGF-UHFFFAOYSA-N 383.373 5.163 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N(CCC#N)c2ccc(F)cc2)s1 567418971 QMWFHQKESKBGFZ-UHFFFAOYSA-N 379.460 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cc(C)nc(N2CCCC2)c1 569396518 BHJNEXJZPJZYPN-UHFFFAOYSA-N 392.547 5.164 30 20 GKED Cc1oc(C2CC2)nc1C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N 577294987 RCMFZFZTCKVSOT-UHFFFAOYSA-N 391.858 5.233 30 20 GKED C[C@H](NCc1ccc(C#N)cc1OC(F)F)c1ccc(Oc2cccnc2)cc1 584787763 VIUFOPKIGHGMDI-HNNXBMFYSA-N 395.409 5.198 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@H](CCO)c1cc(Cl)cc(Cl)c1 599669145 WVADLCMJDYBYJL-LJQANCHMSA-N 377.315 5.008 30 20 GKED CCOc1ccc(SCC(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603968442 RVUUYWQFZVAJOM-UHFFFAOYSA-N 394.521 5.416 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc(-c4ccc(F)cc4)s3)[nH]c12 605363291 SMSOLXAZTZMKQU-HNNXBMFYSA-N 375.428 5.229 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 608864375 RAJPBMYLLPIVLW-UHFFFAOYSA-N 389.886 5.851 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc(Cl)ccc3Cl)cc2)c1 609064188 KTOCQVQOGFPZIY-UHFFFAOYSA-N 397.261 5.696 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1cc2ccccc2n1CC#N 609162670 QOAYUWPIRPOCJY-ZDUSSCGKSA-N 386.282 5.305 30 20 GKED CC[C@@H](C)c1ccc(OCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 609384568 QCFSAMFTUSENJJ-IAGOWNOFSA-N 382.529 5.612 30 20 GKED N#Cc1ccccc1/C=C\c1nc(-c2ccccc2OCc2ccccc2)no1 609475692 VUPNYMJQDMRWCT-PFONDFGASA-N 379.419 5.358 30 20 GKED N#Cc1ccc(-n2nccc2NC(=O)c2sc3cc(F)ccc3c2Cl)cc1 609580928 VXSOYLCRCQYNAO-UHFFFAOYSA-N 396.834 5.003 30 20 GKED CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609926782 FIRHAYOVTZHGAR-AUUYWEPGSA-N 385.895 5.039 30 20 GKED C[C@@H](NC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1cccc(C#N)c1 610714011 NHFUITOCKONTFI-MRXNPFEDSA-N 396.450 5.173 30 20 GKED N#CCn1c(C(=O)N2CCc3cc(-c4ccccc4)ccc32)cc2ccccc21 610834733 YCTZNSLOTZTSBE-UHFFFAOYSA-N 377.447 5.035 30 20 GKED CC(C)(C#N)c1ccc(CNc2cc(Cl)ccc2OC[C@@H]2CCOC2)cc1 614480927 HYVHIUUUHGFJOI-QGZVFWFLSA-N 384.907 5.169 30 20 GKED C[C@H](N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccc(F)cc1C(F)(F)F 623973173 IZHIAHHQAIAGSL-JGVFFNPUSA-N 386.336 5.732 30 20 GKED C=CC[C@@H]1CCCC[C@H]1NCc1csc(N(C(C)=O)c2ccc(OC)cc2)n1 639303329 PBZQVLNJPLUKEV-DYESRHJHSA-N 399.560 5.061 30 20 GKED C=CCC[C@@H](NCc1ncccc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 678938693 HMHCBFKGIKQDSM-MRXNPFEDSA-N 388.355 5.916 30 20 GKED N#CC1(c2ccccc2)CCC(=NNc2ncnc3c2oc2ccccc23)CC1 725844376 VWGNRWQDNIOTHP-UHFFFAOYSA-N 381.439 5.179 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1sc(-c2ccc(Cl)cc2)nc1C 727649946 DSYKZJAIKWHTIK-UHFFFAOYSA-N 385.876 5.306 30 20 GKED Cc1ccc([C@@H](C)NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)s1 731979231 MODKQJNGSPMSRE-MRXNPFEDSA-N 376.481 5.406 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nnc(Nc2ccccc2)s1 735230172 DPUCQUNMWUOUNZ-UHFFFAOYSA-N 388.905 5.130 30 20 GKED Cc1ccc([C@@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 738894478 FXMBRLXLPWOONM-CYFREDJKSA-N 383.495 5.576 30 20 GKED CC[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(C)cc1 739159216 IMLGURDACWUPGG-RXVVDRJESA-N 399.519 5.750 30 20 GKED C=CCn1c(-c2cccc(C)c2)nn(CN2CC[C@@H]2c2cccc(F)c2)c1=S 743389036 HISTUCBETGCXSC-HXUWFJFHSA-N 394.519 5.119 30 20 GKED CC(=NNc1nc2cc(C(F)(F)F)ccc2s1)c1ccc(OCC#N)cc1 743444478 NYQFUTWKTFETLA-UHFFFAOYSA-N 390.390 5.054 30 20 GKED CCOc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)ccc1OC(F)F 745989867 DLZSDUHYNHTLQB-OQFOIZHKSA-N 395.405 5.645 30 20 GKED O=C1/C(=C/c2c(Cl)nc3sccn23)COc2c(Cl)ccc(Cl)c21 748584347 QZXQLIMEZVCTAS-FNORWQNLSA-N 385.659 5.015 30 20 GKED CC1(C)CCC(CC(=O)[C@@H](C#N)c2nc(O)c3c4c(sc3n2)CCCC4)CC1 752474198 RLNUKNQPOOZTSO-OAHLLOKOSA-N 397.544 5.058 30 20 GKED CC(=C\c1ccc(Cl)cc1)/C=C(/C(=O)C(=O)O)c1ccc2ccccc2n1 753713693 KVUOUTQEMZXBEQ-FBRLRESOSA-N 377.827 5.029 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=S)Nc1ccccc1C#N 763140726 KKQCTRMSSJPXLO-UHFFFAOYSA-N 396.313 5.591 30 20 GKED C#CCOc1ccc([C@H](C)N[C@H](c2ccccc2)c2nc3ccccc3n2C)cc1 765607085 LEVAYHZFOVCACC-UQBPGWFLSA-N 395.506 5.026 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C\c3ccc4[nH]ccc4c3)n2)cc1 765915021 IIWCOZNKPUMVCH-STISFXCESA-N 383.476 5.490 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2cccc(Br)c2)c1 772984210 NQMXYHNZCFKIGS-AZUAARDMSA-N 387.321 5.371 30 20 GKED C[C@H](NCc1cc(Cl)nc(Cl)c1)c1ccc(-c2cccc(C#N)c2)cc1 782525585 ZWKKNKIVGLBBFV-AWEZNQCLSA-N 382.294 5.778 30 20 GKED C=C(C)COc1cccc(NC(=O)C(=O)Nc2ccc(SC(C)(C)C)cc2)c1 784257957 PEGIMUPMPRYLPZ-UHFFFAOYSA-N 398.528 5.109 30 20 GKED N#Cc1ccc(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1F 791435937 SAMHNHBISOMMGG-UHFFFAOYSA-N 388.370 5.115 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 791752973 XJVLKSWFWSBMIY-MDASCCDHSA-N 387.405 5.147 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1csc(-c2ccc(Cl)cc2)c1 796750042 ZMKPVDNEVYPIMJ-KRWDZBQOSA-N 380.856 5.030 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(OC(F)(F)Cl)cc2)s1 797573030 NFQVROMVSVURDM-GFCCVEGCSA-N 384.835 5.099 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1 812966866 NLIQPGKAJSRQGA-UHFFFAOYSA-N 381.215 5.109 30 20 GKED CC(C)(CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)Cc1ccc(Cl)cc1 813212112 XQWUSFZTKRZRFM-MRXNPFEDSA-N 394.824 5.589 30 20 GKED C=CC[C@H](C=C)OC(=O)CCCc1nnc(-c2ccc(Cl)cc2Cl)o1 860926294 WBXMTYHDVMLKMB-ZDUSSCGKSA-N 381.259 5.040 30 20 GKED COc1ccc2cc(/C=C/C(=O)N(Cc3ccc(C#N)cc3)C(C)C)ccc2c1 914501438 IDPKGMOYLNXQIM-UKTHLTGXSA-N 384.479 5.170 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1ccc(-c2cccc(Cl)c2)s1 914702367 CISGWGPJUSSBIB-BOPFTXTBSA-N 388.945 5.571 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2csc(-c3ccccc3)n2)cc1 915114359 LBDQGPDPWDRDNM-OUKQBFOZSA-N 391.496 5.236 30 20 GKED CCOCc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915353637 PUNDTFADRGIACL-DEOSSOPVSA-N 399.494 5.200 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915353960 RTTISIJKJDXYFF-IERDGZPVSA-N 375.497 5.156 30 20 GKED Clc1cccc(NN=Cc2cn(Cc3ccccc3)nc2-c2cccnc2)c1 916269315 GEQXDJULHHMFML-UHFFFAOYSA-N 387.874 5.093 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@H]1c1ccccc1 919904876 XEHBPGZGBPEENY-ZEQRLZLVSA-N 395.506 5.957 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccccn2)cc1 919905049 YGDINAKISADPSZ-GGAORHGYSA-N 382.467 5.106 30 20 GKED O=C(O)c1ccc2scc(C=NOCc3ccc(C(F)(F)F)cc3)c2c1 1776112262 SQIURGQKLBDNGD-UHFFFAOYSA-N 379.359 5.169 30 20 GKED C=C[C@H](CCC(=O)O)NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1 1776149327 GXIIIYSFJVXWBM-MRXNPFEDSA-N 377.843 5.089 30 20 GKED C=CCOc1ccc(/C=C/c2cc(C(=O)O)c3cnn(C(C)C)c3n2)cc1Cl 1776183978 YBMRUZQXAVPWRE-FNORWQNLSA-N 397.862 5.099 30 20 GKED C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)s1)c1nc2ccccc2n1CC#N 1776197264 RQPILXSFPLXOFP-CCEZHUSRSA-N 399.475 5.547 30 20 GKED CC(=C\c1ccccc1C(F)(F)F)/C=C1\CCc2oc(C(=O)O)c(C)c2C1=O 1776200019 RKCMLJHNJWTCBZ-LRGIMLIUSA-N 390.357 5.464 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(Cl)c(Cl)c2Cl)ccc1C(=O)O 1777289140 VHYWZTUCXKMAQP-CLTKARDFSA-N 385.630 5.250 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1cc2c(s1)CCCC2 1777569425 RFZJWCNTTOTUDF-RMKNXTFCSA-N 394.448 5.187 30 20 GKED O=C(O)c1cc(/C=C2/Oc3cc(Cl)cc(Cl)c3C2=O)sc1Cl 1777663567 AMLTYERZSQELMG-ONNFQVAWSA-N 375.616 5.023 30 20 GKED CC(C)(C)CCCCCC(=O)Nc1ccc(C2(NC(=O)CC#N)CCC2)cc1 1791382047 PJQIPHXUXIBLKV-UHFFFAOYSA-N 383.536 5.031 30 20 GKED Cc1noc(C(C)C)c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 41514427 ZEJVDAKSBQYWQJ-AWEZNQCLSA-N 385.876 5.373 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/C(=O)c2cccc(Cl)c2)cs1 54895829 ZTOXAQZIAVPYPH-DHZHZOJOSA-N 396.899 5.686 30 20 GKED COc1ccc(C#N)cc1NC(=O)CSc1cccc2cccc(Cl)c12 64456557 XLQXUTMJTPELPK-UHFFFAOYSA-N 382.872 5.104 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1Cl 103336590 WWHVALCWKFANLV-MRXNPFEDSA-N 377.856 5.134 30 20 GKED N#C[C@@H](NC(=O)CCCCC(=O)c1ccccc1)c1ccc(Cl)c(Cl)c1 112910654 KWVDNWWXIJXFFB-GOSISDBHSA-N 389.282 5.118 30 20 GKED CC(C)C[C@@H](C)OCCC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 120777212 BZNBXWFURYNWNZ-ZIAGYGMSSA-N 392.471 5.106 30 20 GKED CC(C)(C)c1ncc(/C=C/C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)s1 173992940 NVIAYCQVSHMDEK-ZNFPLGDCSA-N 393.537 5.454 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(-c2cccnc2)cc1 175615006 IUCRFMGGFMCFRX-KRWDZBQOSA-N 384.483 5.432 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(NC(=O)c3ccccc3)cc2)n1 177762773 KUSLTJHNVVDIHZ-SFHVURJKSA-N 389.480 5.009 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cc(F)c(F)c(F)c1 182342272 VIXNIZYXILLNFN-GFCCVEGCSA-N 393.434 5.162 30 20 GKED O=C(/C=C\c1cn(Cc2ccccc2)nc1-c1cccnc1)c1cccc(F)c1 209308110 JJKCPPKTAOVLEP-QXMHVHEDSA-N 383.426 5.029 30 20 GKED CC[C@H](C#N)Oc1cc(CNc2ccnc3ccc(Cl)cc23)ccc1OC 301252135 DMMJRPMVCSMRKC-MRXNPFEDSA-N 381.863 5.190 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cnc(-c4ccccc4)nc3)c2)cc1 303231585 YQFVPCZDCLKOGA-UHFFFAOYSA-N 392.418 5.060 30 20 GKED O/C(=N/[C@H]1CCCO[C@@H]1c1ccncc1)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 328636279 ADQWYZQKJHZOKN-JHDROBOHSA-N 391.298 5.369 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC[C@H]3c3cccnc3)c2)cc1 377182298 JJFBFECQBIMEGS-QFIPXVFZSA-N 384.439 5.115 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(F)c1)[C@@H]1CCCC[C@@H]1C(F)(F)F 410401843 XYZOOQJGHSBRJH-MNOVXSKESA-N 387.295 5.074 30 20 GKED C=C(C)[C@H](N[C@H]1CCCc2ncc(C(F)(F)F)cc21)c1ccc(F)c(F)c1 427877843 PHVCGHINUXGUFD-OALUTQOASA-N 382.376 5.663 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3cnccc3-c3ccccc3)o2)cc1 428440612 KYYWRVCAVKKFMP-UHFFFAOYSA-N 395.418 5.045 30 20 GKED N#CCSc1cccc(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)c1 429818668 DZPRMSYBBXIGOZ-UHFFFAOYSA-N 392.455 5.273 30 20 GKED Cc1nc(-c2cccc(C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)c2)cs1 430628681 NTHGHPUFLSMGMX-HNNXBMFYSA-N 381.526 5.363 30 20 GKED CCCc1ccc(OC)c(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 432298801 ZEFVUIHCZDCWDD-INIZCTEOSA-N 398.528 5.059 30 20 GKED CC(C)[C@@H](C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1cccnc1 436124310 NDMLTGZJHIQTJV-XMMPIXPASA-N 399.494 5.105 30 20 GKED CCc1cccc2c(C3CCN(C(=O)C4(c5ccc(C#N)cc5)CC4)CC3)c[nH]c12 436132099 MQERIBZEXIHPGY-UHFFFAOYSA-N 397.522 5.040 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)NCc3cc(C#N)ccc3F)c2)C1 438093093 CAZCBKHKNQICDX-IIBYNOLFSA-N 395.478 5.114 30 20 GKED CC(C)c1nc2ccc(N[C@H](C)C(=O)N(CCC#N)c3ccccc3)cc2s1 439575565 RXLMBBHUNDZGIR-MRXNPFEDSA-N 392.528 5.167 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)C(=O)NCC1CCC(C#N)CC1 441000184 AONKPQGTGVRWMA-XEVCZEQESA-N 375.516 5.386 30 20 GKED N#CCC[C@H](NC(=O)N1C[C@H](c2ccccc2)c2ccccc21)c1ccccc1 445216126 NQXFOYYYGHHLRT-PKTZIBPZSA-N 381.479 5.393 30 20 GKED C=CCn1c(SCc2nccs2)nc2scc(-c3ccccc3)c2c1=O 446971204 CUHALTVJYYGINC-UHFFFAOYSA-N 397.550 5.060 30 20 GKED N#CCc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2OC(F)(F)F)c(Cl)c1 452643362 JGEAXIDQGLFVTF-UONOGXRCSA-N 394.780 5.047 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)N2CCCC3(CCCCCC3)C2)c1 464683364 WDAQHBSUOVHWGO-UHFFFAOYSA-N 392.499 5.307 30 20 GKED N#Cc1c(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)sc2c1CCC2 466423681 ZXMJERQUJNZYGF-UHFFFAOYSA-N 379.872 5.076 30 20 GKED C=C(C)C[C@@H](C)C(=O)NC[C@H](c1ccc(OC)cc1)c1c[nH]c2ccccc12 466602204 QVODDOUGZRXEMX-DYESRHJHSA-N 376.500 5.027 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@]1(C)Cc1ccccc1 467341422 OAWJCHBFJOSVDZ-WZONZLPQSA-N 393.556 5.710 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H]3CCSc4c(F)cccc43)ccc21 468809442 BXOBVHDFZZKZEI-LJQANCHMSA-N 395.503 5.058 30 20 GKED CCC[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(Cl)cc1 469175143 FXSGSRXSRZVQSM-OAQYLSRUSA-N 395.934 5.876 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(OC)c(Cl)c1 473761787 DKDDHWUZYILYOI-UHFFFAOYSA-N 379.909 5.001 30 20 GKED N#CC[C@H](CC(=O)Nc1cc(Cl)ccc1N1CCCCC1)c1ccccc1 474571294 AHELCLOBOPRVOM-GOSISDBHSA-N 381.907 5.356 30 20 GKED COc1ccc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(OCC(C)C)c1 475506046 CJXAHDOEOXONKB-INIZCTEOSA-N 398.528 5.377 30 20 GKED CC[C@H]1[C@H](C)CCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 480657154 DBESKJUJDDXVDV-ZHRRBRCNSA-N 377.488 5.098 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1ccc(C)c(NC(=O)c2ccco2)c1 482761249 KTHBFADOTPWREG-UHFFFAOYSA-N 380.488 5.049 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)c(Br)c1)c1nccc2ccccc12 483234873 SEDRVHIXXPATOW-AWEZNQCLSA-N 385.648 5.141 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)C[C@@H](CC#N)c2ccccc2)c1C 484081134 INYQWLCPGXFZQH-GOSISDBHSA-N 392.890 5.169 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 484144350 YXQCCHNKRGPFDX-HNNXBMFYSA-N 389.459 5.471 30 20 GKED CC[C@@H](C#N)NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1 484426394 CQMRSZOTYGOZEU-ZDUSSCGKSA-N 382.382 5.028 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)N[C@H](CCCC#N)c1ccccc1 487327551 RZTQXYZHVHHKCQ-HXUWFJFHSA-N 375.497 5.284 30 20 GKED N#CCCC[C@@H](NC(=O)c1coc(-c2ccccc2Cl)n1)c1ccccc1 487615903 IFNXINGAUIRPHZ-GOSISDBHSA-N 379.847 5.160 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CCCC(F)(F)C2)cc1F 494037463 JYUSCRSJIHMRPS-OAHLLOKOSA-N 389.377 5.189 30 20 GKED Cc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)N(CC#N)C2CC2)cc1 495517536 RMBYPBIMTHACAL-KNTRCKAVSA-N 393.490 5.158 30 20 GKED CC(C)n1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 497797432 AWPXVVVWNYCQLN-SFHVURJKSA-N 378.863 5.025 30 20 GKED COc1ccc(CN[C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)cc1OCCCC#N 500429918 UNEQTQPIMYUTHX-AOMKIAJQSA-N 384.907 5.056 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@H]3C[C@@H]3c3cccc4ccccc34)CC2)cc1 503901015 LCZVLONCPZHDIR-RPBOFIJWSA-N 378.475 5.131 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1c(F)cccc1Oc1ccccc1 504205838 XDBOFSJKINJVLX-UHFFFAOYSA-N 375.403 5.154 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)sc2nccn12 505406747 ZXSTWXVMVZJLSA-LBPRGKRZSA-N 398.557 5.041 30 20 GKED N#Cc1ccc(SCc2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)cc1 512042034 RYDYNBKVOWNGRR-MRXNPFEDSA-N 393.365 5.311 30 20 GKED COc1ccc([C@@H](N[C@H](C)c2ccc(C#N)cc2F)c2ccccc2OC)cc1 512637699 YLHJESKFACSQLZ-VOIUYBSRSA-N 390.458 5.155 30 20 GKED C[C@H](NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccncc1F 513393624 HFVCBGBORQQGRD-ZDUSSCGKSA-N 395.821 5.029 30 20 GKED C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(COc2ccccc2C#N)o1 515499255 RIBOJMRNAQUYNT-HNNXBMFYSA-N 394.858 5.217 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Br)cs3)cc2)c1 517510498 KGXOZIAABVGKGR-UHFFFAOYSA-N 399.269 5.427 30 20 GKED Cc1ccccc1-c1nc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cs1 519515839 YEKNKSXLJIXWPC-HNNXBMFYSA-N 393.537 5.765 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1 521251189 VPCJVUQPVQSTAL-UHFFFAOYSA-N 392.311 5.069 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)cc1 521793667 YMRJLTJBXNODML-UHFFFAOYSA-N 399.450 5.197 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)cc1 525050411 VNJZTXUFUAKRNJ-UHFFFAOYSA-N 390.439 5.160 30 20 GKED C[C@@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccccc1C(F)(F)F 525570555 JWQLWQQNXDMKAH-SJCJKPOMSA-N 380.797 5.233 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3c(Cl)cccc3Cl)c2)cc1 531338462 SRYCXUDHOPPZCQ-UHFFFAOYSA-N 383.234 5.910 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1ccccc1 534615580 GULZWXFJBILADV-CYBMUJFWSA-N 387.361 5.054 30 20 GKED CCN(C(=O)CCc1cc(Br)cs1)c1ccc(C#N)c(Cl)c1 538073776 LQQFFIVVDGSLCW-UHFFFAOYSA-N 397.725 5.021 30 20 GKED C[C@H](NC(=O)Nc1cccc2[nH]ccc12)c1ccc(-c2cccc(C#N)c2)cc1 541096827 JEWZSZHNNCGWQY-INIZCTEOSA-N 380.451 5.589 30 20 GKED C[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)c2ccccc21 542587613 SAYXFIGJTZFNJN-QGZVFWFLSA-N 383.451 5.290 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(F)cc1Cl)CC1CC1)c1ccc(C#N)cc1 553799149 HYITUBNJFBXESH-AWEZNQCLSA-N 385.870 5.034 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Br)ccc1OCC 556504786 RQZDSJCGFNLOFS-UHFFFAOYSA-N 395.322 5.129 30 20 GKED N#Cc1ccc(C[C@@H](C#N)c2nc(-c3cccc(Oc4ccccc4)c3)no2)cc1 558300660 WJFBWCUTPLEFQC-FQEVSTJZSA-N 392.418 5.250 30 20 GKED C[C@H]1C[C@@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)C1 558504876 ZOCSLXSNYWOXBZ-SBUREZEXSA-N 398.466 5.361 30 20 GKED C=CCn1c(S[C@H](C)c2nccn2-c2ccccc2)nnc1-c1ccoc1C 561442308 MWUNHEPYPZIINQ-MRXNPFEDSA-N 391.500 5.072 30 20 GKED CC(C)(c1ccc(NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)cc1)C(F)(F)F 567298872 VIDJBDUFHIESQD-UHFFFAOYSA-N 390.380 5.208 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cnc(-c4cccnc4)s3)c2C#N)[C@H](C)C1 571979225 ZXELSDSNGQYOSM-NWDGAFQWSA-N 394.525 5.076 30 20 GKED Cc1ccc(C#N)cc1NC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 579050215 SJBHGBOQRQTDLG-UHFFFAOYSA-N 397.450 5.185 30 20 GKED O=C(Nc1nc2c(F)c(F)ccc2s1)c1c(F)cc(C(F)(F)F)cc1F 582212615 QRVPAPNBWUYNLZ-UHFFFAOYSA-N 394.271 5.124 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(Cc1cccc(O)c1)CC1CC1 589327950 SBLPMLYOICCQBZ-MRXNPFEDSA-N 395.528 5.088 30 20 GKED Cc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)nnn1-c1ccc(Cl)cc1 590257341 NEJKHWVEUAGMOG-IIBYNOLFSA-N 393.922 5.315 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSC[C@@H]1CCCCC1(F)F 596393311 JVVZVBJLBIVVTQ-GJZGRUSLSA-N 398.544 5.436 30 20 GKED CCN(C(=O)Nc1cccc(CC#N)c1)[C@@H](C)Cc1ccc(C(F)(F)F)cc1 596925313 FOYDZHFOVXBAFO-HNNXBMFYSA-N 389.421 5.256 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CSc3ccc(Cl)cc3)cn2)c1 603621968 GBJBOYVSZHGVMN-UHFFFAOYSA-N 395.871 5.130 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603689749 DCTSXKXQWYDMEA-CQSZACIVSA-N 378.457 5.032 30 20 GKED O=C(Cc1csc(-c2ccoc2)n1)Nc1cccc(C#Cc2cccs2)c1 606167899 MREDOVSBDDVHAS-UHFFFAOYSA-N 390.489 5.046 30 20 GKED CC(C)(C)[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccccc1 609499879 PIERFIXYISBSLD-QFIPXVFZSA-N 385.467 5.263 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609682696 QODYHSDAQDPVCQ-RXVVDRJESA-N 397.478 5.760 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)CSCc2ccc(C#N)cc2)cc1 609979869 ZUBWBAAYHJOUOO-JPYJTQIMSA-N 378.541 5.100 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COC2CCCCC2)c1)c1cccc(C#N)c1 610325239 NRDWEDZOLYGKNI-QGZVFWFLSA-N 377.488 5.290 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610456173 HYWBQKWEJFUZNU-SFHVURJKSA-N 385.467 5.328 30 20 GKED COc1cc(Br)ccc1[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21 615761927 GJSLVBHMDKSMLK-ORAYPTAESA-N 385.305 5.058 30 20 GKED O=C(NC1CCC2(CC1)CC2(F)F)c1ccc(C(F)(F)C(F)(F)F)cc1 622961266 OGQIRTPYYNXUHQ-UHFFFAOYSA-N 383.307 5.039 30 20 GKED O=C(N[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ccc(C(F)F)o1 626404805 OJYLEHDKLSTKFI-NSHDSACASA-N 387.226 5.269 30 20 GKED C=CC[C@H]1CCCC[C@@H]1NCc1csc(N(C(C)=O)c2ccc(OC)cc2)n1 639303333 PBZQVLNJPLUKEV-UWJYYQICSA-N 399.560 5.061 30 20 GKED CC(C)c1nc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)no1 647634162 PMZDVENECDCLHD-UHFFFAOYSA-N 385.283 5.095 30 20 GKED C=C(CNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1)c1ccccc1 672623717 HQSHLQSNXZEXSK-UHFFFAOYSA-N 386.455 5.166 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 684631840 MXOXJQZQFSMGKZ-HNNXBMFYSA-N 391.427 5.197 30 20 GKED O=C1/C(=C\c2csc(COc3ccc(Cl)cc3)n2)CCc2cc(O)ccc21 726427338 KDXINOGVRMVXGZ-ZROIWOOFSA-N 397.883 5.294 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c(Br)c1 726437713 GRJUIQQBBDSJDV-UHFFFAOYSA-N 380.698 5.092 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(N2CCCCCC2)cc1 726876008 BWLJHNIJVQOOPN-ZHACJKMWSA-N 378.303 5.003 30 20 GKED C#CCOc1cccc(NC(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)c1 731108946 HZFMRFZUWHMSQL-MRXNPFEDSA-N 391.496 5.013 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1csc(-c2ccco2)n1 735318107 IVNCEGKMUHQECK-UHFFFAOYSA-N 376.890 5.392 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)CCCSc3ccc(Cl)cc3)[nH]c12 735791874 CZDSNNLIDZTFCY-INIZCTEOSA-N 383.904 5.274 30 20 GKED O=C(Nc1cccc(/C=C2\Oc3ccccc3C2=O)c1)c1ccccc1Cl 742436489 LOOBBKMSCBGFJN-MOSHPQCFSA-N 375.811 5.209 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1)c1cccc(F)c1 744037812 DWIVESLOGJVTLQ-HZMBPMFUSA-N 392.377 5.434 30 20 GKED N#Cc1ccc(CN(C(=S)Nc2ccc(Cl)c(Cl)c2)C2CC2)cc1 745653729 QXUMKPRJPSWPMH-UHFFFAOYSA-N 376.312 5.226 30 20 GKED COc1cc(C(=O)/C=C/c2sc3ccccc3c2Cl)cc(OC)c1OC 747003877 RTYUPKZQXOQCDA-CMDGGOBGSA-N 388.872 5.477 30 20 GKED CCCCC[C@@H](OC(=O)CCc1c(C)nc(O)c(C#N)c1C)c1ccccc1 748114699 CREOOCCOOZDELG-OAQYLSRUSA-N 380.488 5.073 30 20 GKED COc1ccc(-c2nc(NN=Cc3ccccc3Cl)sc2C)c(OC)c1 749260165 AUIJMFUGOQPOQP-UHFFFAOYSA-N 387.892 5.235 30 20 GKED Cc1nn(-c2ccccc2)c(Cl)c1CNc1ccccc1S[C@@H](C)CC#N 749272768 WJLCWEXQZJSOGL-HNNXBMFYSA-N 396.947 5.841 30 20 GKED Cc1cc(/C=C\C(=O)c2ccc(Cl)nc2)cc(C)c1OCc1ccccn1 759081853 AMJVRTLXWLHNTP-VURMDHGXSA-N 378.859 5.222 30 20 GKED O=C(O[C@H](Cc1ccc(F)cc1)C(F)(F)F)C1CCC(C(F)(F)F)CC1 766940286 XRIKLCCMMSYCMS-ORHYLEIMSA-N 386.307 5.211 30 20 GKED CCCCn1ncc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 773260076 LLIMDPCKZHGLHK-OAQYLSRUSA-N 387.487 5.291 30 20 GKED C[C@H](NCc1ccc(CN2CCc3ccccc32)cc1)c1ccc(OCC#N)cc1 776154864 WQSQQESSNRHCJH-FQEVSTJZSA-N 397.522 5.002 30 20 GKED Cn1c(/C(Cl)=C\c2ccc(C#N)s2)nc2ccc(Br)cc21 776723584 JHVUUFHIMVWIRV-KPKJPENVSA-N 378.682 5.006 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 781070279 JNLLTXGKVIMYGD-FQEVSTJZSA-N 396.491 5.240 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3cnc4ccccc4n3)c2cc1C(C)C 792115245 VQSCSBCXNTWTJH-LJQANCHMSA-N 383.451 5.227 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)COc2ccccc2-c2ccccc2)s1 797570087 DEUWDRKQOKWYCQ-GOSISDBHSA-N 390.508 5.363 30 20 GKED CCCN(C(=O)c1ccc(C)c(C#N)c1)[C@H](c1ccc(F)cc1)c1cccnc1 799339220 KBBBFXHRGRVXMP-HSZRJFAPSA-N 387.458 5.043 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(SC(F)F)c1)c1ccccc1 814629779 FVKGANMNJHITMM-KRWDZBQOSA-N 375.444 5.558 30 20 GKED C[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCOC2=O)cc1 815634231 GQMLTSCZJGJACH-GAJHUEQPSA-N 389.499 5.023 30 20 GKED Cn1nccc1-c1ccccc1CNc1ccc(OCc2cccc(C#N)c2)cc1 816565059 ZXRQZLUHZOBXCT-UHFFFAOYSA-N 394.478 5.150 30 20 GKED CC(C)(Oc1ccc(F)cc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915086812 NDDXOIOLQUEUPK-JOCHJYFZSA-N 388.442 5.277 30 20 GKED N#C[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc2ccccc2c1 916944553 HRDHSLQRISIWLC-SFHVURJKSA-N 383.234 5.108 30 20 GKED CCN(CC(=O)[C@@H](C#N)c1nc2ccccc2s1)Cc1ccc2ccccc2c1 920089386 PPKLDHOBRSECDS-HXUWFJFHSA-N 399.519 5.148 30 20 GKED COc1ccc(C=NNc2ccc(-c3ccccc3)cc2)c2cc(C(=O)O)oc12 1776059383 KPQVIPHMXNYAGI-UHFFFAOYSA-N 386.407 5.253 30 20 GKED CCCCCCCOc1cccc(CN[C@H](c2ccccc2)[C@@H](C)C(=O)O)c1 1776787306 ODIMZLOZQNFUAM-XXBNENTESA-N 383.532 5.587 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCC3(CC2)C[C@@H]3C(=O)O)cc1 1776787491 DOZTVHZUTYBDKV-LJQANCHMSA-N 389.561 5.076 30 20 GKED CCCCOc1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)cc1OCC 1776801320 KANHZRDVEITFFH-QUHSPFQSSA-N 394.467 5.102 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C/c1nc2ccccc2c(C(=O)O)c1C 1776931509 RNKRDJKSDSKPHB-MDZDMXLPSA-N 395.842 5.190 30 20 GKED C=CC[C@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)CC(C)(C)C)CCC2)cc1 1789451668 QUADYALRXHHZJZ-HXUWFJFHSA-N 382.548 5.325 30 20 GKED C=CCc1ccc(OCC(=O)Nc2ccccc2Oc2ccccc2)c(OC)c1 15963685 OSTBLYOSVFFJAO-UHFFFAOYSA-N 389.451 5.234 30 20 GKED Cc1ccc(CNC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1F 27170329 OFDVBBNGHSXBRM-UHFFFAOYSA-N 390.483 5.228 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cc(C)cc(C)c2)[n+]2ccc(C)cc2)cc1 27187428 NXKFFLXCJIHYBB-UHFFFAOYSA-O 389.544 5.259 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c(C)s1 41548791 MFKVENZJWUBADM-LBPRGKRZSA-N 380.416 5.484 30 20 GKED N#C[C@@H](C(=O)c1cc(F)cc(F)c1)c1nc2cc(C(F)(F)F)ccc2s1 41549330 BBTSBDKMUOSQIB-LBPRGKRZSA-N 382.313 5.083 30 20 GKED CSC[C@@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 67001712 VSPDCYGDPKNVNO-SKDRFNHKSA-N 385.341 5.292 30 20 GKED C=CCn1c(SCc2csc(C3CCCCC3)n2)nnc1-c1ccncc1 97363080 JZECEICHKFWPPO-UHFFFAOYSA-N 397.573 5.323 30 20 GKED C=CCCO[C@H](C)C(=O)N(c1nc2ccccc2s1)c1ccc(C)cc1C 116546144 CEPGQTFRGROIDF-QGZVFWFLSA-N 380.513 5.559 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 119618270 HORBFEBOKLSNEV-OAHLLOKOSA-N 389.282 5.009 30 20 GKED N#C[C@H](C(=O)CCSc1ccccn1)c1nc(-c2ccc(Cl)cc2)cs1 120112824 YCZFFXWVDMJSPX-OAHLLOKOSA-N 399.928 5.217 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nnc1-c1cccnc1 120766400 IWNVVHIEKPZDSZ-UHFFFAOYSA-N 393.903 5.020 30 20 GKED COc1cc(CCC(=O)Nc2ccccc2S[C@H](C)CC#N)ccc1Cl 127724689 HNTFXJPVUOYSOK-CQSZACIVSA-N 388.920 5.314 30 20 GKED CC(C)Oc1ccc(NCc2cn(CCC#N)nc2-c2ccccc2)c(F)c1 129003779 OCHHQELEQFCMHY-UHFFFAOYSA-N 378.451 5.002 30 20 GKED Cc1cccc([C@H](C)C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c1 150775619 FPWHHOWMTIHDGL-IBGZPJMESA-N 384.479 5.382 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cccc(Cl)c2Cl)ccc1OC 180815749 USOMLSDADXSDGT-HIFRSBDPSA-N 393.314 5.534 30 20 GKED CCC(CC)n1nc(C)cc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 181044332 LRHUMEVTWVNZKV-CQSZACIVSA-N 386.908 5.306 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 181120213 QLCSYNZBKXARFQ-AWEZNQCLSA-N 379.441 5.226 30 20 GKED N#Cc1ccc(C[S@](=O)Cc2ccc(Oc3ccccc3)c(F)c2)cc1F 190832124 BLLKTOZJKLZIBF-MHZLTWQESA-N 383.419 5.078 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccccc2-c2ccccc2)cc1OC 209233787 DVMUGICJOPUCTQ-PEZBUJJGSA-N 385.463 5.579 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 255566019 JPPJOZOUVWFNBY-NTMALXAHSA-N 375.453 5.076 30 20 GKED N#Cc1ccccc1/C=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 255865081 QXUXJYHOOVMYEI-IEODJVTJSA-N 389.867 5.225 30 20 GKED CC(C)c1cccc(N(C)CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 303349520 DUZUHRCLNOLTCC-KRWDZBQOSA-N 381.545 5.137 30 20 GKED OC(=Nc1ccccc1)N1CCC(/C(O)=N/C[C@@H]2C[C@H]2C2CCCCC2)CC1 329361400 YNASSJRGLXPKLJ-FPOVZHCZSA-N 383.536 5.117 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(CCCC2(C#N)CCOCC2)C1 410413324 KHFIUNXGWKPEEC-QFBILLFUSA-N 380.454 5.189 30 20 GKED CC(C)c1cnc(-c2ccc(NC(=O)c3cccc(SCC#N)c3)cc2)o1 430608183 CWHQVDMWWUDEPY-UHFFFAOYSA-N 377.469 5.333 30 20 GKED N#Cc1ccc(NC(=O)CS[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 437453673 NCCJIFBUAFESTK-QFIPXVFZSA-N 376.456 5.159 30 20 GKED CCN(CC)C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)c(C#N)c1 438517491 MWKIDRYZWWVKRJ-UHFFFAOYSA-N 377.366 5.243 30 20 GKED CCc1ccc([C@@H](c2cccnc2)N(CC)C(=O)c2ccc(C#N)cc2C)cc1 438829707 DCBOLEYCPWPKQK-DEOSSOPVSA-N 383.495 5.076 30 20 GKED COC(=O)[C@H](Nc1cccc(OCCCC#N)c1)c1ccc(Cl)cc1Cl 439567710 WWZCFVJLUYQBEN-GOSISDBHSA-N 393.270 5.002 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1cc(F)c(Br)cc1Cl 439620366 KAWDRMHUANADFG-UHFFFAOYSA-N 390.684 5.035 30 20 GKED C[C@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)NCC2CCC(C#N)CC2)C1 441006570 UYSYLZHARGGGMV-YHRBYZFPSA-N 393.453 5.128 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@H](C)c1ccccn1)c1ccc(C(F)(F)F)cc1 441533546 IGDPMQVGJIPCEN-BEFAXECRSA-N 391.437 5.510 30 20 GKED C=CCC[C@H](NC(=O)Cc1nc(C)sc1C)c1ccc(C(F)(F)F)cc1 441592855 RUHZHJMKVGFGNR-INIZCTEOSA-N 382.451 5.145 30 20 GKED C=CCc1cc(CN[C@H](CC(F)(F)F)c2ccccc2C)cc(OC)c1O 444010307 OURLGJBYIKELQX-GOSISDBHSA-N 379.422 5.221 30 20 GKED Cc1ccc([C@@H]2CSCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458798150 HHBGPQDOMFEEMC-VXKWHMMOSA-N 393.556 5.230 30 20 GKED C[C@@H](C(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)c1cccs1 460166686 GCFIHOSDRBRUFU-OAHLLOKOSA-N 380.900 5.610 30 20 GKED C[C@@H](C(=O)Nc1cccc(Cl)c1Oc1cccnc1)c1cccc(C#N)c1 463571832 WIUWPRNYIISNCT-CQSZACIVSA-N 377.831 5.141 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(N2CCCC[C@@H]2C)cc1C 468313912 ACYNWRMAFGROPK-SFHVURJKSA-N 383.561 5.655 30 20 GKED Cc1nc2cc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3C)ccc2o1 470849003 XIBGWBFWKPHTEZ-UHFFFAOYSA-N 383.407 5.361 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(OCc2ccncc2)cc1 471287811 PKFRURBQEOVTTR-UHFFFAOYSA-N 387.483 5.271 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1CN1CCc2ccccc21)c1ccccc1 474955102 RBJKKRVKMDUEAH-JOCHJYFZSA-N 395.506 5.275 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1(c2ccc3c(c2)OCO3)CC1 475542989 BKZCLRQGBYGHTA-UHFFFAOYSA-N 378.472 5.078 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1nc2ccccc2[nH]1)C(C)C 475543669 DGLOGYONQUGHLW-OAQYLSRUSA-N 390.531 5.934 30 20 GKED C=CCn1c(SCc2ccc(C#N)c(F)c2)nnc1-c1cccc(Cl)c1 478731973 ILACWQJURZRJNG-UHFFFAOYSA-N 384.867 5.088 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(F)c(SC)c(F)c1 480339685 VLNRTDIIAUFIGW-UHFFFAOYSA-N 394.491 5.074 30 20 GKED CC(C)(C)c1nn(-c2ccccc2)cc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483242053 JXFKSALUIKVDQE-FQEVSTJZSA-N 394.478 5.208 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1cccc(-c2ccc(Br)cc2)c1 486448421 QAOHVYPCWNAINM-UHFFFAOYSA-N 398.304 5.274 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(OCc2ccccn2)c(F)c1)c1ccccc1 489723811 VJOYBKDBICGCKE-FQEVSTJZSA-N 376.431 5.098 30 20 GKED C=CCCO[C@H](C)C(=O)N(CC)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496453856 YMKYHFDBAGNTMP-AUSIDOKSSA-N 380.532 5.124 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1Cl 499954198 DDBASLMCUUUXCJ-OAHLLOKOSA-N 393.855 5.204 30 20 GKED COc1ccc(C)cc1CC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 500758739 MLJDJMGRYFCTLN-UHFFFAOYSA-N 386.451 5.157 30 20 GKED COc1ccc(CN2[C@H]3C=C(c4ccccc4)C[C@H]2CC3)cc1OCCCC#N 503045256 IKSWLYCPKLPKDN-DHIUTWEWSA-N 388.511 5.198 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CCc1ccc(Cl)c(Cl)c1 509016049 JXGFEPMKCWEGFM-UHFFFAOYSA-N 399.277 5.624 30 20 GKED COc1ccc(F)cc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 509247342 PMMHHUVVMOAMDJ-UHFFFAOYSA-N 378.428 5.109 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)c(C)cc1Br 509885530 MFFSLYBCHQDIID-CYBMUJFWSA-N 385.286 5.166 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 513200930 KSULMNVFJYXQOL-INIZCTEOSA-N 389.430 5.237 30 20 GKED COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)Nc1cc(C#N)cn1C(C)(C)C 513518378 DTXWZWTZWJVJMJ-VQIMIIECSA-N 394.519 5.128 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1 517866969 JALMWPFBUDSDMJ-GOSISDBHSA-N 392.459 5.020 30 20 GKED C[C@@H](S[C@H](C)c1ccc(Cl)cc1)C(=O)N(CCC#N)c1ccc(F)cc1 521021526 ZEIAFVLUGKPDLH-HUUCEWRRSA-N 390.911 5.609 30 20 GKED Cc1c(CNC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)oc2ccc(F)cc12 524027264 LWJOALLIVPADQM-UHFFFAOYSA-N 393.462 5.120 30 20 GKED Cc1cccc(-c2nc(C)c(C(=O)Nc3ccccc3SC[C@H](C)C#N)[nH]2)c1 536049434 HXYHZJUSJUSAIO-OAHLLOKOSA-N 390.512 5.198 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](N[C@H](CCC#N)c2ccccc2)CCC3)cc1 536838510 LNAQTFNQKQQBJI-NHCUHLMSSA-N 387.552 6.131 30 20 GKED Cc1sc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)nc1-c1ccc(Cl)cc1 537293605 XXXZJHQEARGSCX-ZIAGYGMSSA-N 381.932 6.055 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2ccncn2)c(Sc2ccc(Cl)cc2)c1 544814628 DWGCIMAWZVJUAC-QGZVFWFLSA-N 379.872 5.080 30 20 GKED Cc1c(C(=O)Nc2cccc(Cl)c2OC(C)C)sc2ccc(C#N)cc12 550908396 FWIWDTYSCSKXDJ-UHFFFAOYSA-N 384.888 5.774 30 20 GKED N#Cc1csc(CN(Cc2cccc(C(F)(F)F)c2)Cc2ccccn2)c1 558423630 MPRQEQXAVDZKJX-UHFFFAOYSA-N 387.430 5.236 30 20 GKED C[C@H](N[C@@H](C)c1ccc(C#N)cc1Cl)c1ccc(Br)cc1F 566038965 TUKPOVSHIWGNBQ-QWRGUYRKSA-N 381.676 5.525 30 20 GKED N#CCC[C@H](NC(=O)c1cc(Cl)cc(F)c1Br)c1ccccc1 568115486 JOSWEDKELPNVIR-HNNXBMFYSA-N 395.659 5.016 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)c1 571911098 BCFRXDCGTPNSMR-UHFFFAOYSA-N 395.827 5.440 30 20 GKED Cc1csc(NC(=O)c2csc(-c3ccc(OC(C)C)cc3)n2)c1C#N 573956524 KGKCJDPRWDWECA-UHFFFAOYSA-N 383.498 5.091 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 576045617 JDBYBRZITBXOBS-UHFFFAOYSA-N 390.487 5.021 30 20 GKED N#Cc1ccc(-c2nnc(COc3c(Cl)cc(Cl)c4cccnc34)o2)cc1 577683320 IGWYFZNQZHJVTC-UHFFFAOYSA-N 397.221 5.042 30 20 GKED N#CCC[C@H](NC(=O)c1sc2ccccc2c1Br)c1ccccc1 582212725 VTYKKKRWDHGAGV-HNNXBMFYSA-N 399.313 5.439 30 20 GKED CN(C(=O)C1(c2cc(F)cc(C#N)c2)CC1)c1ccc(Cl)c(C(F)(F)F)c1 584018984 IBYLEEGYICIZIH-UHFFFAOYSA-N 396.771 5.064 30 20 GKED CC(C)(C)c1ccc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)cc1[N+](=O)[O-] 586834227 JHAPYLMGFOWBHC-UHFFFAOYSA-N 392.242 5.323 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)Sc2c(F)cc(F)cc2F)c1 603939169 YOGIVDOMHAHZLK-AWEZNQCLSA-N 392.446 5.148 30 20 GKED COc1ccc2oc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)c(C)c2c1 603969160 IVHVIZVIKLPGOI-UHFFFAOYSA-N 388.448 5.602 30 20 GKED C=CCCCN(C)C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 605965731 ZAGOBOGOQPJISR-LJQANCHMSA-N 387.321 5.146 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)c2cc3ccccc3n2CC#N)cc1 609159436 FGIPJIBEGVVXFS-UHFFFAOYSA-N 381.435 5.518 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccccc1SC[C@H](C)C#N 609377324 TUACAHKMGTWXEK-IAGOWNOFSA-N 382.529 5.469 30 20 GKED COc1ccc(SCCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 609378186 ZNFAKPDSEGNJLO-OAHLLOKOSA-N 386.542 5.068 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1 610019143 DRFQZALTAGDWII-YZGWKJHDSA-N 393.556 5.614 30 20 GKED N#C[C@H](C(=O)c1ccc(C2CCCCC2)cc1)c1nc2ccccc2n1C(F)F 613401992 WNFFJQXYWXLQES-GOSISDBHSA-N 393.437 5.969 30 20 GKED N#CCCCOc1cccc(CNc2ccc(C(F)(F)C(F)(F)F)cc2)c1 613657729 FIJCKXLFSSJPGF-UHFFFAOYSA-N 384.348 5.635 30 20 GKED Cc1ccc(-c2cc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)c3ccccc3n2)o1 642282184 RMYDJZVBMUQCKT-QGZVFWFLSA-N 393.402 5.435 30 20 GKED C[C@@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccc(F)cn1 647323568 ZHLNLEYTQBEYSM-SECBINFHSA-N 384.270 5.683 30 20 GKED C=CC[C@@H]1CCCC[C@@H]1NCc1csc(CC(=O)Nc2cc(C)ccc2C)n1 661115257 AWZFWALUEPKWRY-QUCCMNQESA-N 397.588 5.166 30 20 GKED C=CCN(Cc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1)c1ccccc1 674869795 KRTJPWTXQCGSJJ-UHFFFAOYSA-N 391.540 5.637 30 20 GKED Fc1cc(Cl)ccc1CNC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 682085972 ZIYAQROORVOXFX-NXEZZACHSA-N 377.731 5.478 30 20 GKED CC(C)Oc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1Cl 726457853 RQXDAIXTXSLIQB-UHFFFAOYSA-N 380.300 5.461 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(CC[C@H](O)c3ccccc3)cc2)cc1 727761841 DWWJIAGHDYPGGW-DEOSSOPVSA-N 387.479 5.170 30 20 GKED Cc1cc(OC(C)C)ccc1NC(=O)c1cc(C)n(-c2ccc(C#N)cc2)c1C 728268654 SFFJKKHQECUDBI-UHFFFAOYSA-N 387.483 5.314 30 20 GKED Cc1ncccc1/C=C/C(=O)c1sc(-c2ccc(Br)cc2)nc1C 728787589 PFYRQOZCHIVBQG-JXMROGBWSA-N 399.313 5.481 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)[C@H](C#N)c3nc4ccccc4o3)sc2c1 732708223 OTLNIEMLRFEZOA-AWEZNQCLSA-N 394.883 6.309 30 20 GKED O=C(/C=C\c1cc(Cl)ccc1OC(F)F)c1c(Cl)nc2ccccn12 737446635 YXPDCTXSZBREPH-XQRVVYSFSA-N 383.181 5.139 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc(F)c(F)c3F)c2)s1 740427448 KTTWPIRAXHSUOR-UHFFFAOYSA-N 387.386 5.026 30 20 GKED C/C(=C\C(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 741908559 FVSSXOLYCJSFGR-FYWRMAATSA-N 388.389 5.430 30 20 GKED Cc1ccc(CCCCC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 746417085 RQIMETSOOBOVKD-OAQYLSRUSA-N 399.519 5.579 30 20 GKED C#CC[C@H](NC(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 757779352 VMYAOCISYRNDGI-QFIPXVFZSA-N 397.478 5.133 30 20 GKED Cc1cc(NC(=O)c2cccc(OCc3ccccc3C#N)c2)c(C)c(C)c1O 774838135 MEIXNJMNOXBDDY-UHFFFAOYSA-N 386.451 5.020 30 20 GKED CCOCOc1ccc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1 782969823 YAYUTDUIGMQVQI-LJQANCHMSA-N 386.495 5.449 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)[C@@H](C#N)c2nccc3ccccc23)cc1 792106449 QUFCHHRRKLGBBO-IBGZPJMESA-N 387.439 5.072 30 20 GKED C#Cc1cncc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)c1 798165340 GCYKHMOHVIHHAO-HNNXBMFYSA-N 375.859 5.142 30 20 GKED Cc1c(F)cccc1-c1ccc(/C=C2/C[C@H](C(=O)O)c3ccccc3C2=O)o1 806561380 UWKNRNMWJROTEH-RNUYOQPASA-N 376.383 5.232 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)Nc1ccccc1O[C@H](C)C#N 806635642 UFROLTFQHNVRRB-GOSISDBHSA-N 392.503 5.310 30 20 GKED N#C[C@H]1CC[C@@H](COC(=O)c2cnc(-c3ccc(C(F)(F)F)cc3)s2)CC1 809091741 LIWRJLOSBSAPLM-BETUJISGSA-N 394.418 5.316 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(c4cccc(C)c4)CCC3)n2)cc1 916975012 UUPZWMIAKQBECP-FQEVSTJZSA-N 386.520 5.725 30 20 GKED CC(C)N(CC(=O)[C@H](C#N)c1nc2ccccc2s1)Cc1cccc(Cl)c1 917125248 XHELQPNSCOXIEN-KRWDZBQOSA-N 397.931 5.037 30 20 GKED C=CCN(C(=O)/C=C/c1ccsc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 919673311 LVSRADBPPKFHSD-FPYGCLRLSA-N 397.481 5.012 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(Br)c1 1776033151 DZOGIQZQEMHPSE-UHFFFAOYSA-N 381.657 5.027 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2cccc(CC(=O)O)c2)cc1 1776125904 WAVJZHUTXJURCK-XZGNNNQISA-N 394.511 5.805 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C/c2cc(Cl)cc(C(F)(F)F)c2)c1)C(=O)O 1776470952 RFEQEZYSLDHELA-MVIFTORASA-N 398.764 5.107 30 20 GKED C[C@@H]1C/C(=C\c2cccc(OCc3ccccc3C(=O)O)c2)C(=O)c2ccccc21 1776589792 YGBWTHXGTBAWDH-HDAKKWKLSA-N 398.458 5.737 30 20 GKED N#Cc1ccc(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1 7765037 OABXZVGBMOKWHF-HXUWFJFHSA-N 399.881 5.255 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)c(C)c2)=C(/S)N[C@@H]2CCCC[C@@H]2C)cc1 27490300 UWPDYYMUDLRZIR-GHTZIAJQSA-O 395.592 5.006 30 20 GKED Cc1occc1-c1nnc(SCc2cc(C#N)ccc2F)n1-c1ccccc1 29845006 LAHZTIHKXWWVJG-UHFFFAOYSA-N 390.443 5.139 30 20 GKED CCCCOc1c(Cl)cc(C(=O)[C@@H](C#N)c2nc(C)cs2)cc1OCC 41520993 ZEGYBVGHEDBRQE-CQSZACIVSA-N 392.908 5.173 30 20 GKED CSc1ccccc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 41549381 GUMBGZASKVJHAX-LBPRGKRZSA-N 392.427 5.527 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nc2ccccc2s1 46706583 OPRPBCBHSKMFRI-CQSZACIVSA-N 388.473 5.407 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc1 56720230 XFVGYNJDJARTGC-HSZRJFAPSA-N 399.494 5.125 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1-c1cccs1 63390227 PSQSHYYVVXALSP-UHFFFAOYSA-N 393.468 5.543 30 20 GKED CCN(Cc1csc(COc2ccc(C)cc2)n1)[C@@H](C)c1ccc(C#N)cc1 65432857 QMZRQUARWGAXSR-SFHVURJKSA-N 391.540 5.485 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(CSC)cc3)n2)cc1 66543812 BNIITRVACDECCK-SFHVURJKSA-N 394.521 5.172 30 20 GKED Cc1oc(-c2ccccc2)nc1CSCC(=O)Nc1cc(Cl)ccc1C#N 105628240 DQWVFXQFUYDXHW-UHFFFAOYSA-N 397.887 5.047 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1csc(Cc2ccccc2)n1 106207325 DFPLUKIQZLRICF-UHFFFAOYSA-N 388.945 5.277 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1sc2cccc(F)c2c1COC 108434891 SKJKUEVGCUWHCT-UHFFFAOYSA-N 387.451 5.154 30 20 GKED Cc1nn(C(C)(C)C)cc1[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 123692960 ZLOLXGJJPUXVOX-GJZGRUSLSA-N 399.564 5.081 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2C)=C(/S)Nc2ccc(C)c(F)c2)cc1 127603459 YCKUOTKIOGMOLF-UHFFFAOYSA-O 393.507 5.089 30 20 GKED CCCn1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C1CC1 127960565 IDHURCTZLRBSIY-UHFFFAOYSA-N 386.455 5.087 30 20 GKED C=CCn1c(S[C@@H](C)c2cc(Cl)ccc2Cl)nnc1-c1cnccn1 155881300 RACRZLMRTPLVDS-NSHDSACASA-N 392.315 5.081 30 20 GKED Cc1nc(NC(=O)CCCCCO[C@H]2CCC[C@H](C)C2)sc1SCC#N 159619662 WHEBHAQBCYWMKO-HOCLYGCPSA-N 395.594 5.161 30 20 GKED CC[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 160045645 JFJSIWISKYCJCV-OXQOHEQNSA-N 379.529 5.622 30 20 GKED Cc1cnc(C(C)(C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)s1 177047349 AVHWPHXZWDAAHN-UHFFFAOYSA-N 392.484 5.172 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@H](C)Cc2ccc(C(F)(F)F)cc2)n1 177761403 VCFUOVUJQMSGMH-DOMZBBRYSA-N 380.435 5.340 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(C)C)s1 185618213 MMFDIIUJEJJHJV-UHFFFAOYSA-N 377.469 5.491 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCN(c2ccccc2)C1 191487609 DQOSTTURAMKFNO-LJQANCHMSA-N 377.532 5.187 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 191500886 BVJJCFLVKUDLJW-UHFFFAOYSA-N 393.487 5.643 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1 303165200 IELWFHQNTPHHBL-UHFFFAOYSA-N 385.554 5.763 30 20 GKED O/C(=N/[C@@H]1CCCc2cn(C3CCCC3)nc21)c1sccc1OC(F)F 329489078 HIFXBRCOPKWNAQ-CYBMUJFWSA-N 381.448 5.043 30 20 GKED CCc1ccc(Cl)c(CC)c1N=C(O)N1CCC(C(=O)OC(C)(C)C)CC1 330639711 PKMIOTJPRYPJDR-UHFFFAOYSA-N 394.943 5.064 30 20 GKED C=CC[C@@H](CC)NC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 410118618 AXSPQZZUTARPQS-CZUORRHYSA-N 378.925 5.088 30 20 GKED C=CCCc1ccccc1NC(=O)Cc1c[nH]c2cc(Br)ccc12 410343979 ILFCUOSSWDMEIM-UHFFFAOYSA-N 383.289 5.230 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@H](C)[C@@H](C)CC3)c1C1CC1 410980685 GIGPOXGXJXOUOK-QWHCGFSZSA-N 382.533 5.213 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)N(C)[C@H](C)c1cccc(C#N)c1 425663030 PGOXKIUOFHJMOW-RTBURBONSA-N 390.531 5.470 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2nc(C3CC3)oc2c1 431129737 YUFLCISVWOQMSA-UHFFFAOYSA-N 388.471 5.267 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)N[C@@H](CCCC#N)c1ccccc1 431845428 OIMLMWAEMWRALG-VQTJNVASSA-N 379.504 5.336 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CC[C@@H](Cc2ccccc2)C1)c1ccccc1 431916741 PHOSHAPIBNHRHW-WWNPGLIZSA-N 375.516 5.132 30 20 GKED CO[C@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)N[C@H](CCCC#N)c1ccccc1 431947451 ZSRJMPVSEVYCQU-HBGVWJBISA-N 399.922 5.150 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(O)ccc2Cl)cc1Cl 432004884 CXVIXPJWMPERHQ-SFHVURJKSA-N 397.261 5.607 30 20 GKED CC(C)[C@@H]1N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1(C)C 432901390 PUIDHUORZZHSRU-QFIPXVFZSA-N 391.515 5.230 30 20 GKED CC1(C)CCCN(C(=O)c2ccc(-c3nc4ccccc4s3)s2)[C@H]1C#N 434017102 LHZXEEYMAMKDEW-KRWDZBQOSA-N 381.526 5.179 30 20 GKED Cc1cc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)ccc1Br 437658014 WXAPFVDFSPSIJF-MJGOQNOKSA-N 398.304 5.061 30 20 GKED COc1ccc([C@@H](C)CCNC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 438048642 KCQOWLKKAWPMQA-IRXDYDNUSA-N 397.544 5.405 30 20 GKED N#Cc1csc(C(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)c1 438489030 WPWWTCLAEXBPMP-UHFFFAOYSA-N 377.513 5.253 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC(F)(F)F)c1ccccc1C 446915299 USFGQIHSWKQQMK-LJQANCHMSA-N 376.422 5.386 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@@H](CSc2ccccc2)C1)c1ccccc1 458799906 KJAZYSVTXAONCN-KNQAVFIVSA-N 393.556 5.245 30 20 GKED Cc1ccc(-c2cc(CNc3ccccc3Oc3ncccc3C#N)on2)cc1 462226764 YGXBEBZWGDNMMR-UHFFFAOYSA-N 382.423 5.321 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1ccc(F)c(Br)c1 462232803 BJLNTGADGXQVII-GFCCVEGCSA-N 379.298 5.452 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 464474310 KAXWAESEYJFAKL-LJQANCHMSA-N 391.352 5.129 30 20 GKED C[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)Oc1ccc(Cl)cc1 464630311 RVJHMDBHNWVHBG-MRXNPFEDSA-N 390.870 5.076 30 20 GKED CC(C)(C)c1ccc(CNc2ccc3c(c2)CCC(=O)N3CCCC#N)s1 469112827 YAHNIHNSSFDAAH-UHFFFAOYSA-N 381.545 5.241 30 20 GKED C=CC[C@@H]1N(C(=O)c2ccc(C)c(NC(=O)c3ccco3)c2)CCCC1(C)C 470304801 YBQZPBUFKXUCIP-FQEVSTJZSA-N 380.488 5.047 30 20 GKED CC(C)c1cccc(C(=O)N(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)n1 474210101 IYHYYPIQXQAPGK-UHFFFAOYSA-N 387.458 5.058 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)N[C@H](C)CC#N 481210413 DPVPHDFDWAAWHW-OAHLLOKOSA-N 393.466 5.155 30 20 GKED N#C[C@H](NC(=O)c1cccc(-c2cscn2)c1)c1c(Cl)cccc1Cl 505500672 KWLLQAYTFXEZQA-HNNXBMFYSA-N 388.279 5.112 30 20 GKED CCc1sc(-c2nnc(CN(CC)[C@H](C)c3ccc(C#N)cc3)o2)cc1C 507689122 QTHRTWYXVGMDOI-OAHLLOKOSA-N 380.517 5.124 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1sccc1C 510729675 KMQYRBVAMJBZJX-UHFFFAOYSA-N 377.469 5.351 30 20 GKED Cc1c(C#N)cccc1C(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 512831454 CGBRWFGRRXFRRI-OAQYLSRUSA-N 399.494 5.622 30 20 GKED CCN(C(=O)c1cccc(COc2ccccc2C#N)c1)c1cccc(C)c1C 513514140 PLCLSUWPXWYYRI-UHFFFAOYSA-N 384.479 5.421 30 20 GKED CC[C@H](Cc1ccc(Cl)cc1)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 514966327 OBPOFBXKMWMSAC-OAQYLSRUSA-N 383.923 5.153 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC(C)(C)C1 515257799 VZTQWTAGTCJSSF-UHFFFAOYSA-N 378.476 5.036 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cc(F)c(Cl)cc2Cl)cc1 517491757 DKNSZYKFUPIEFP-QGZVFWFLSA-N 379.262 5.425 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCCCOc1ccc(F)cc1 519076131 CLSZRJPRLRZRCD-UHFFFAOYSA-N 396.915 5.097 30 20 GKED C=CCOc1ccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1OC 519430469 PLACKCLQMLTWSB-OAQYLSRUSA-N 390.483 5.109 30 20 GKED N#C[C@H](NC(=O)c1cnc(-c2ccccc2)s1)c1ccc(Cl)c(Cl)c1 521017122 CGHIEUWUOFQPHU-HNNXBMFYSA-N 388.279 5.112 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1 521079832 VWNFASSIAIBFGH-HSZRJFAPSA-N 391.490 5.326 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cccc(-c2nnc(C)n2C)c1 530500190 MQROYZFECSQCAV-UHFFFAOYSA-N 389.503 5.286 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](OCC(F)(F)F)C1 530553311 JCPSIPNAISBOCW-INIZCTEOSA-N 384.442 5.114 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)N[C@@](C)(C#N)CC(C)C 536079578 FJRSGPOUWFRBES-RUZDIDTESA-N 385.511 5.197 30 20 GKED C=CCCOCCCCC(=O)N1Cc2cc(Cl)ccc2C[C@@H]1c1ccccc1 539518908 OPSOKKUGYRIZFY-HSZRJFAPSA-N 397.946 5.729 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cncnc2-c2ccccc2)cc1 541235261 LMHQOSZFQFPLLU-UHFFFAOYSA-N 392.418 5.060 30 20 GKED CCOC(=O)[C@@H]1CC[C@@H](N[C@@H](CCCC#N)c2ccccc2)c2ccccc21 550827134 KOIQZDKDRZLMQT-XPWALMASSA-N 376.500 5.193 30 20 GKED N#CCCN(C(=O)CCCCc1nc2ccccc2s1)c1ccc(F)cc1 553821022 FTJYAXHLJIZJIW-UHFFFAOYSA-N 381.476 5.095 30 20 GKED N#CCCC1CCN(c2nnc(-c3ccc(Cl)cc3Cl)n2C2CC2)CC1 568104161 CXKXAZNGMWNVSJ-UHFFFAOYSA-N 390.318 5.107 30 20 GKED Cc1nc(CSc2ccc(C(=O)Nc3scc(C)c3C#N)cc2)cs1 576548647 XNNQDBBTZKWWOQ-UHFFFAOYSA-N 385.539 5.238 30 20 GKED COCC[C@@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)c(Cl)c1 585754938 UTIRUIMYOZEPAV-HXUWFJFHSA-N 391.342 5.662 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC[C@@H]1CCCCC1(F)F 596396721 TZUBAIUFWDGCJM-GJZGRUSLSA-N 398.544 5.578 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)n1C1CCOCC1 597187995 WCBKQXWPNWGCKJ-MRXNPFEDSA-N 397.544 5.103 30 20 GKED Cc1ccc(-c2nc(CC(=O)N(CC(C)C)c3ccc(C#N)cc3)cs2)cc1 603529173 XASMOPXTZJJTBR-UHFFFAOYSA-N 389.524 5.222 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)Cc3csc4ccccc34)cn2)c1 603756382 VDKRMKNCEVIDQQ-UHFFFAOYSA-N 385.448 5.141 30 20 GKED C[C@@H](Oc1ccccc1Cl)C(=O)Nc1sc(-c2ccccc2)cc1C#N 603968928 NDUXKLZAUNVZOV-CYBMUJFWSA-N 382.872 5.346 30 20 GKED CC(C)(C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cccc(F)c1 605452861 JZWPXYIDUOTMJO-RYUDHWBXSA-N 399.350 5.129 30 20 GKED C=CCCCN(C)C(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 605974689 ONRPIZZZRXGXRN-CQSZACIVSA-N 377.941 5.441 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2C)n1)[C@@H](C)c1ccc(C#N)cc1 608936059 PDFCUXKHEFVHSU-INIZCTEOSA-N 375.497 5.214 30 20 GKED COCc1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)oc2ccccc12 609176356 FWECZNBEXWKGKP-UHFFFAOYSA-N 398.418 5.495 30 20 GKED COc1ccc(C2(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CCC2)cc1 609376469 ASCNKXQEMPARQR-INIZCTEOSA-N 380.513 5.007 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccc(F)cc2)o1 609378014 UFRFDODZVCTUTH-CQSZACIVSA-N 380.444 5.590 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc(F)c(F)c1 610228217 WPBVSJVSISBBPE-CQSZACIVSA-N 378.378 5.371 30 20 GKED O=[N+]([O-])c1cc(F)c(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c(F)c1 610988142 IYSXFXUJBSJYHE-BQBZGAKWSA-N 392.246 5.194 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccccc1COCc1ccccc1 611390978 YKOAJASZPQYSOE-SANMLTNESA-N 382.507 5.442 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1ccc(Br)cc1F 613901032 MCSWYXLYHIAVLA-UHFFFAOYSA-N 390.296 5.621 30 20 GKED CSc1c(F)cccc1C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619127191 UEGWQNLSSCHZPQ-UHFFFAOYSA-N 391.352 5.331 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)s2)c(C)c1 621676736 QLBNFYURFMQFQI-IBGZPJMESA-N 397.503 5.774 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c(C)c1Br 682990315 RSRQLUHEHQXIPI-MRXNPFEDSA-N 379.257 5.104 30 20 GKED C[C@H](NC(=S)N[C@H](C)c1ccc(Cl)cc1Cl)c1ccc(C#N)cc1 726481080 WOZMEDUVXCBIJJ-NWDGAFQWSA-N 378.328 5.151 30 20 GKED O=C(/C=C/c1csc(COc2ccc(Cl)cc2)n1)c1ccc(O)c(F)c1 728439013 UBNARYZUILBNII-XBXARRHUSA-N 389.835 5.116 30 20 GKED Fc1ccc(-c2nnc(S)n2N=Cc2ccc(-c3ccccc3Cl)o2)cc1 730550299 ZOJYDRFARYEYSI-UHFFFAOYSA-N 398.850 5.169 30 20 GKED C=CCN(CC1CCCCC1)Cn1nc(-c2ccccc2)c2ccccc2c1=O 732668705 DOFRPKKBUVUNTR-UHFFFAOYSA-N 387.527 5.089 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CSc4ccccc43)n2)cc1 735769220 HMRJAHVVHSUSQK-SJORKVTESA-N 376.506 5.184 30 20 GKED CC(=NNc1ncnc2sccc12)c1ccc(SCC(F)(F)F)cc1 741757456 RIPFXCLJKCMSND-UHFFFAOYSA-N 382.436 5.182 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1 742770496 OLPAWOQAGQFPJK-UHFFFAOYSA-N 395.871 5.395 30 20 GKED C[C@H](NC(=O)Nc1cccc(OCCc2ccccc2)c1)c1cccc(C#N)c1 743111763 YVKBIHIYYIIPBL-SFHVURJKSA-N 385.467 5.062 30 20 GKED CCc1oc2ccccc2c1C=NO[C@H](C)c1nnc(-c2cccc(Cl)c2)o1 747827435 NBEIRLKBJINTOG-CYBMUJFWSA-N 395.846 5.810 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)n1 751870188 LOYDEEFDPIMJED-UFKIDYELSA-N 396.478 5.592 30 20 GKED CC(C)CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)C1CCCC1 754889149 IKTWUTOZWOXMNP-HSZRJFAPSA-N 375.516 5.775 30 20 GKED C=CCC(CC=C)C(=O)Oc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 758533611 SFUPOBCXEXKJJN-UHFFFAOYSA-N 383.875 5.290 30 20 GKED N#Cc1cccc(COc2ccc(NCc3csc(C4CC4)n3)cc2Cl)c1 759109636 SCLGOOYSSLPGJH-UHFFFAOYSA-N 395.915 5.737 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)Sc1nc2ccccc2s1 762508855 KTLXTTILSGQSSS-ZDUSSCGKSA-N 397.525 5.074 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)Nc3cc(C#N)cc([N+](=O)[O-])c3Cl)oc12 764301211 KSVGGJMYSQJDDF-UHFFFAOYSA-N 383.791 5.044 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@H](c2ccccc2)c2nc3ccccc3n2C)cc1 765607084 LEVAYHZFOVCACC-KBMIEXCESA-N 395.506 5.026 30 20 GKED C[C@H](C(=O)OCCCCC(C)(C)C#N)c1cccc(C(=O)c2ccccc2)c1 768819587 MUYUDCWJLGUDEI-SFHVURJKSA-N 377.484 5.284 30 20 GKED C#CCCCCC(=O)N(C)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 773390971 PQDIEEZVNKYGGI-UHFFFAOYSA-N 376.378 5.049 30 20 GKED CC(C)c1nn(C)c(Cl)c1CNCc1ccc(-c2ccccc2C#N)cc1 773425697 BCOTWBCEOYIYBO-UHFFFAOYSA-N 378.907 5.025 30 20 GKED CC[C@H](Nc1ccc(OCc2cn3ccccc3n2)cc1)c1ccc(C#N)cc1 774356500 YSNYLZVBMCQOFU-QHCPKHFHSA-N 382.467 5.348 30 20 GKED CCc1ccc([C@@H](NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)C(C)C)cc1 774450243 SSBKOVNUNHQOGY-QPPBQGQZSA-N 380.532 5.425 30 20 GKED N#Cc1ccc(CSC2=Nc3ccccc3CS2)c(Br)c1 777907711 ZMYWBGWQUUBFBD-UHFFFAOYSA-N 375.316 5.488 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c[nH]nc2-c2ccsc2)cc1 780345088 AHABOTXVWGIJQU-IBGZPJMESA-N 384.464 5.046 30 20 GKED O=C(/C=C/c1ccc2cnccc2c1)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 782346834 DXZRMPIZNBPTJW-FERLCFGISA-N 391.442 5.218 30 20 GKED N#C[C@H](C(=O)C1(Cc2ccc(F)cc2)CC1)c1nc2cc(Cl)ccc2s1 783071091 ZECUKDXMRABLFE-OAHLLOKOSA-N 384.863 5.288 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(Cc2ccccc2)c1C 789887889 GNMYXOPVNWIXNR-UHFFFAOYSA-N 386.539 6.257 30 20 GKED Cc1sc(CC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)nc1C(C)C 789896579 WPMOHDYZMSDSQS-HXUWFJFHSA-N 389.524 5.412 30 20 GKED C=CCOc1c(Br)cc(/C=C/C(=O)c2cccc(F)c2)cc1OC 810194868 OIZFHWDWMOIKBX-BQYQJAHWSA-N 391.236 5.058 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C\C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813218529 PZXFRUCCRWDBFQ-HFAYGXORSA-N 388.389 5.167 30 20 GKED C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1ccc(N2CCCOC2=O)cc1 814264508 UXOPRBSYWYGHIR-CYBMUJFWSA-N 389.377 5.097 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(N2CCCCCC2)cc1 824320864 NYMGXDJSZBFHDU-GOSISDBHSA-N 376.504 5.164 30 20 GKED CC(C)[C@H]1N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC12CC=CC2 831230090 CSYAORVGQXWAOZ-DHIUTWEWSA-N 385.511 5.551 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)F)cc2F)cc1 847625898 ANIJDFHGHZEFMD-SJCJKPOMSA-N 388.389 5.238 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H]2[C@@H](C[C@H]2c2ccccc2)C1 860626974 CVOCDAVAZLLOQU-FRYIKTPZSA-N 391.540 5.348 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 915085621 DFRDENWOPLGFAE-DEOSSOPVSA-N 398.506 5.791 30 20 GKED CC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)c1cccc(C#N)c1 915954928 QDEIINVGAYGQAY-UHFFFAOYSA-N 387.443 5.205 30 20 GKED N#C[C@H](C(=O)c1ccccc1SC(F)(F)F)c1nc2ccccc2s1 916847327 CJBYBBGMFHOGHX-LLVKDONJSA-N 378.400 5.398 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1ccc(Cl)c(Cl)c1 916899595 JZLPARORJIRNIE-OAHLLOKOSA-N 389.282 5.079 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccc(Cl)cc2)cc1 916914334 YNYXOJSTXDUXIS-KRBJHKROSA-N 380.875 5.043 30 20 GKED N#C[C@@H](C(=O)CN1Cc2ccccc2-c2ccccc21)c1nc2ccccc2s1 917144247 DDXIKKGGRJNROI-IBGZPJMESA-N 395.487 5.160 30 20 GKED C=CCn1c(C2CC2)nn(CN(CC)Cc2ccc(Cl)c(Cl)c2)c1=S 917488250 LKJVBMQQZYJYEW-UHFFFAOYSA-N 397.375 5.264 30 20 GKED O=C(O)c1ccc2scc(C=NNc3ccnc4cc(Cl)ccc34)c2c1 1776011855 UIYCLTJYSPJWFD-UHFFFAOYSA-N 381.844 5.247 30 20 GKED COc1cc(C(=O)O)ccc1NN=Cc1ccccc1OCCC1CCCCC1 1776051516 NTUQVLUASRQASC-UHFFFAOYSA-N 396.487 5.189 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2sc3ccccc3c2Cl)c1)C(=O)O 1776472560 DZUYCNHIMXLTMT-ZWLSGLHFSA-N 386.856 5.303 30 20 GKED CCCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1776817228 FBUSAPDEQYFHEP-ACCUITESSA-N 376.408 5.330 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2cc(C)ccc2C)[n+]2ccccc2)cc1 20834578 CFUUWTVURLLOER-UHFFFAOYSA-O 389.544 5.204 30 20 GKED Cc1ccccc1C(=O)/C(=C(/S)Nc1ccc2ccccc2c1)[n+]1ccccc1 55013174 HZYOZVQWYWAKNU-UHFFFAOYSA-O 397.523 5.487 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCc1c[nH]c2ccccc12 66802117 FFWBJTQQVCIKDV-MRXNPFEDSA-N 377.513 5.524 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCCC(=O)c1ccccc1 66931842 XPKNBKILUQFXAZ-QGZVFWFLSA-N 380.513 5.463 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1F 66954220 MDQAERLASLBWPT-OLZOCXBDSA-N 375.444 5.242 30 20 GKED CC(C)COC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)CC1 69202967 FKMPBFPMEWUDRA-UHFFFAOYSA-N 393.487 5.019 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nnc(-c2ccccc2)o1 72040941 RNGMLSMPGVJZND-INIZCTEOSA-N 382.423 5.574 30 20 GKED C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)c1ccc(C#N)cc1 118172541 GYSRLISWAXAGPB-QGZVFWFLSA-N 397.507 5.113 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)n1 119065791 IHXAZEOMVXCMSZ-QHCPKHFHSA-N 383.451 5.031 30 20 GKED CC1CCN(c2cccc(NC(=O)N[C@@H](CCC#N)c3ccccc3)c2)CC1 121000838 NIHGMCQJDUWLPG-QFIPXVFZSA-N 376.504 5.089 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCCCCC2)c1nc(-c2ccncc2)cs1 128857222 AZJPAEVLAKVYJL-MRXNPFEDSA-N 393.537 5.416 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 129524162 INMOEDWBCDWOOU-UHFFFAOYSA-N 399.494 5.072 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccccc1OCC(F)F 151791337 DRSXDGZTZWHZII-UHFFFAOYSA-N 378.378 5.121 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)C[C@@H](C)c2ccccc2C(F)(F)F)n1 177765211 DZXSWCGPDQERDR-OCCSQVGLSA-N 380.435 5.655 30 20 GKED Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)CC1 180140262 KAMPUQYCOXZJOC-UHFFFAOYSA-N 383.495 5.051 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCOc2cc(F)ccc21 182341923 PBJBLKBTBGERLU-YOEHRIQHSA-N 399.491 5.255 30 20 GKED Fc1cccc([C@@H](NCc2nc3ccccc3n2C(F)F)C(F)(F)F)c1F 182576237 BSJDPZGOEJLLCH-OAHLLOKOSA-N 391.290 5.103 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(C(F)F)cc1 183843624 CMPKKCHNAKXNEP-ZDUSSCGKSA-N 375.444 5.198 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 190878070 XOPFJWLIULEWAK-GFCCVEGCSA-N 387.917 5.157 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccccc2Cl)C1 191442954 WJAVOGRQGVCUPI-NRFANRHFSA-N 398.934 5.797 30 20 GKED CCOc1ccccc1Oc1ccc(CNc2c(C#N)cnc3ccccc23)cn1 301363986 MZEYYYCHUFBKBN-UHFFFAOYSA-N 396.450 5.305 30 20 GKED Cn1cc(C(O)=Nc2cccc(CN3CCCCC3)c2)c(C2CCCCC2)n1 328766139 PKBYFLIOHUXIBD-UHFFFAOYSA-N 380.536 5.090 30 20 GKED OC(C[C@H]1CCCC(O)=N1)=Nc1cc(C(F)(F)F)ccc1N1CCCCC1 329432506 HWYJXTPOJKAVSB-CQSZACIVSA-N 383.414 5.183 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1[C@H]2CC[C@H]1c1ccccc12 329638483 AQIDQVJKKFPYNX-VXKWHMMOSA-N 384.483 5.324 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cnccc3Oc3ccccc3)n2)c1 409988714 QZFKSDWZBFAFSR-UHFFFAOYSA-N 398.447 5.121 30 20 GKED CCN(C(=O)c1ccc([C@@H](C)C(F)(F)F)cc1)c1ccc(C#N)c(Cl)c1 410617623 XUWIHRBVGYCHDV-GFCCVEGCSA-N 380.797 5.544 30 20 GKED Cc1nc(NC(=O)c2cccc(SCC#N)c2)sc1Cc1cccc(F)c1 429876087 IGCWBRSWWNGUSH-UHFFFAOYSA-N 397.500 5.049 30 20 GKED Cc1c(C)n(Cc2ccco2)c2ncnc(N[C@H](CCCC#N)c3ccccc3)c12 431137156 CRBUIPOXMMTRKZ-OAQYLSRUSA-N 399.498 5.537 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc2nc(C3CC3)oc2c1 431154670 ZYIGJRYVZJYQDH-QUCCMNQESA-N 386.455 5.009 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F 431404376 GIACXQJWXQUUTH-GOSISDBHSA-N 386.446 5.152 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ncc(-c2ccccc2)s1)c1ccccc1 431711108 LZIIIEOGPBIWFK-GOSISDBHSA-N 376.485 5.367 30 20 GKED N#Cc1cccc(C2(C(=O)Nc3nc(-c4ccc(Cl)s4)cs3)CC2)c1 435183760 OOOWHUDKSNYPNZ-UHFFFAOYSA-N 385.901 5.067 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(Cl)cc2F)cc1F 437477300 AEYOQOCGDJGCKN-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CC(C)c1n[nH]cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 445178955 IRQLAARXFQGCTC-UHFFFAOYSA-N 380.835 5.103 30 20 GKED CC(C)c1oc([C@H]2CCCN2C(=O)NCC(C)(C)CC#N)nc1-c1ccccc1 459252896 DEHJEYFBWZUQPO-GOSISDBHSA-N 394.519 5.251 30 20 GKED Cc1cc(NC(=O)c2cccc(Cl)c2)ccc1NCc1cccc(C#N)c1 463702632 FWJKGWHBBMBEQM-UHFFFAOYSA-N 375.859 5.385 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CCc4c(Cl)cccc43)ccc21 469180048 JCOHFNHEXSQMRP-FQEVSTJZSA-N 379.891 5.022 30 20 GKED CCC1(c2ccc(Cl)cc2)CCN(C(=O)Nc2ccc(CC#N)cc2)CC1 471184605 BCSCUDGNBQDUFJ-UHFFFAOYSA-N 381.907 5.382 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 471255288 SAACHBDCGIXCEU-CXAGYDPISA-N 389.377 5.155 30 20 GKED CCC(C)(C)OCc1cccc(NCc2nnc(-c3ccc(C#N)cc3)o2)c1C 471664190 TZSTYSUOUKNBEH-UHFFFAOYSA-N 390.487 5.234 30 20 GKED CCN(C(=O)c1csc(Br)c1C)c1ccc(C#N)c(Cl)c1 484116287 PRGWZMGHZWNNLZ-UHFFFAOYSA-N 383.698 5.011 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1coc(C2CCCCC2)n1 485745442 RTVSYEKAOSQILT-UHFFFAOYSA-N 375.428 5.034 30 20 GKED N#CCCCOc1cccc(CNc2ccc(Oc3cccc(F)c3F)nc2)c1 485976528 RYYHGILKAUQFBL-UHFFFAOYSA-N 395.409 5.447 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1nc2ccccc2s1)c1ccccc1 487615523 GWSCIJKFTIUGNQ-GOSISDBHSA-N 377.513 5.170 30 20 GKED COCCSc1ccc([C@H](C)Nc2c(C#N)cnc3c(F)cc(F)cc23)cc1 488177413 HSGGABNAVCZWRF-ZDUSSCGKSA-N 399.466 5.296 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)c2ccc(COc3ccccc3C#N)o2)c(C)c1 497383283 GUYWVBZVXASWCX-GOSISDBHSA-N 388.467 5.180 30 20 GKED C[C@H](NC(=O)Nc1c(F)cccc1Oc1ccccc1)c1ccc(C#N)cc1 504154546 JWWZQRLJUKXBJN-HNNXBMFYSA-N 375.403 5.372 30 20 GKED CC(C)(C#N)c1ccccc1CN[C@@H](CCO)c1ccc(Cl)c(Cl)c1 512215248 ZSZUYKWZOSJIFB-IBGZPJMESA-N 377.315 5.008 30 20 GKED N#Cc1cnc2c(F)c(F)c(F)cc2c1Oc1cncc(-c2ccccc2)c1 515025179 ZOAMSBHNQCUZIK-UHFFFAOYSA-N 377.325 5.378 30 20 GKED C[C@H](Sc1ccccc1Cl)C(=O)Nc1sc2c(c1C#N)CCCC2 515599975 ZBUUBUBZHGXCGN-NSHDSACASA-N 376.934 5.271 30 20 GKED N#C[C@H](C(=O)c1cccn1Cc1cccs1)c1nc2cc(Cl)ccc2s1 517306538 QVYLDHVDTNFJJZ-CQSZACIVSA-N 397.912 5.351 30 20 GKED N#Cc1ccc(CNc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3)cc2)cc1 517604630 IRRLIFAFGPENID-XMMPIXPASA-N 381.479 5.148 30 20 GKED Cc1cc(C)cc(CSCC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 518130903 ARKOMNZWBSVJIF-QGZVFWFLSA-N 384.570 5.570 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1ccc(Cl)cc1 521935887 JNCHSZWOLBYPLG-HXUWFJFHSA-N 391.858 5.280 30 20 GKED CCOC(=O)c1ccc(C#N)c(S[C@H](c2ccccc2)c2ccc(F)cc2)n1 525111053 FYVIARHLOLARBO-HXUWFJFHSA-N 392.455 5.151 30 20 GKED Cc1nc2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc2n1C 525217458 DRZXRIHEWQDCPM-UHFFFAOYSA-N 398.491 5.157 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](N[C@@H](C)c2ccc(C#N)cc2)CCC3)cc1 531695535 NPDHFGGGRLLFQV-YWZLYKJASA-N 389.524 5.419 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCCCc2cccs2)cc1 537717603 YDRUQNYCUPQNMN-UHFFFAOYSA-N 392.549 5.275 30 20 GKED Cc1c([C@@H](NCc2nnc(-c3cccc(C#N)c3)o2)C(C)C)oc2ccccc12 539261591 QMEBTQIRFWMTMU-NRFANRHFSA-N 386.455 5.150 30 20 GKED COc1cc(CS[C@@H](C)c2ncc(C)o2)ccc1OCc1cccc(C#N)c1 539951524 WTJJRMUKJQJXIB-INIZCTEOSA-N 394.496 5.437 30 20 GKED C[C@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)C(c1ccccc1)c1ccccc1 540736752 MUGKGQLKTDIMKD-IBGZPJMESA-N 380.491 5.192 30 20 GKED CC[C@@H](C)c1ccc([C@@H](NC(=O)N2CCC(CC#N)CC2)c2cccs2)cc1 543820668 CZRAMMUHHDEJNF-VGOFRKELSA-N 395.572 5.686 30 20 GKED C[C@@H](NC(=O)Nc1c(F)cccc1F)c1ccc(-c2cccc(C#N)c2)cc1 543917008 RGFISPJFRKEVJP-CQSZACIVSA-N 377.394 5.386 30 20 GKED N#C[C@H](C(=O)c1cnc(OC2CCCCC2)c(Cl)c1)c1nc2ccccc2o1 551795027 LCRRCYNRPKHIPI-OAHLLOKOSA-N 395.846 5.078 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)c3sc4ccc(C#N)cc4c3C)c2)n1 560289493 VIHRGEXGWNBRAS-UHFFFAOYSA-N 387.464 5.606 30 20 GKED C=C(C)[C@H]1OCC[C@H]1c1nc(CC2(SCc3ccccc3)CCCC2)no1 572524834 ROSRHGKRAYKJGX-UYAOXDASSA-N 384.545 5.307 30 20 GKED N#Cc1ccc(CSc2nc3c(c(-c4ccco4)c2C#N)CCC3)c(F)c1 589002521 GXWUDMMURNNHHW-UHFFFAOYSA-N 375.428 5.005 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2(C#N)CCCC2)cc1Cl 593143991 UBHFEJIEHISBMH-IBGZPJMESA-N 392.890 5.201 30 20 GKED C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)[C@@H]1C[C@H]1c1ccc(Cl)s1 593695363 LZWMMWTVTQOLKW-UIAACRFSSA-N 399.991 5.019 30 20 GKED C[C@]1(CCNC(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1(F)F 598215889 MOTSQWVWNCRLLU-FQEVSTJZSA-N 386.467 5.016 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 603652605 IXENYZNABDWTCT-UHFFFAOYSA-N 391.858 5.668 30 20 GKED CCCN(Cc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 603691870 VKSYYIGFGATMEQ-UHFFFAOYSA-N 386.455 5.190 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3cc4sc5ccccc5c4s3)[nH]c12 605363048 FDGQQOBZJOVSFU-ZDUSSCGKSA-N 387.489 5.791 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1Cc1ccccc1 608915435 XLJLUBWOGYBYME-UHFFFAOYSA-N 383.495 5.592 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)Nc3cc(Cl)ccc3Cl)o2)cc1 609053381 QPLXRTUMWLZFRS-UHFFFAOYSA-N 387.222 5.289 30 20 GKED CCN(Cc1ccccc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 609078642 FAFFIWSBACLLSC-UHFFFAOYSA-N 399.494 5.500 30 20 GKED C[C@H](c1ccc(Cl)cc1)N(C(=O)c1cc2ccccc2n1CC#N)C1CC1 609165006 MCVONNWESOMLNL-OAHLLOKOSA-N 377.875 5.184 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 610070425 LADJNAHBYBJZEK-QHCPKHFHSA-N 384.483 5.310 30 20 GKED C[C@H](NC(=O)c1cccnc1SCC1CCCCC1)c1cccc(C#N)c1 610362049 OANZXWSGQDBYBY-INIZCTEOSA-N 379.529 5.117 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 615971632 PIYNCKPWXKFAIR-MSOLQXFVSA-N 377.381 5.163 30 20 GKED C[C@@H](NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1)c1ccsc1 619787402 KXPNVTRASVKNRP-MRXNPFEDSA-N 391.496 5.276 30 20 GKED C[C@@H](CC(=O)NCc1cc(F)c(C(F)(F)F)cc1F)c1ccc(F)cc1F 622601260 VYVYXCGKZURCAS-VIFPVBQESA-N 393.302 5.072 30 20 GKED C=C[C@H](CC(=O)Nc1c(O)cc(Br)cc1Cl)c1ccccc1 673483527 TUEFLSDTQMHULO-LLVKDONJSA-N 380.669 5.107 30 20 GKED COc1cc2c(cc1F)CC[C@@H]2NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 684953207 DPHYXUXYFZKTRH-HFAKWTLXSA-N 399.350 5.321 30 20 GKED CC(C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(F)cc1 728687448 GSEIFLCPMBZIPJ-JOCHJYFZSA-N 387.458 5.538 30 20 GKED C#Cc1cccc(N(CC)Cc2nc(O)c3c(-c4ccccc4)csc3n2)c1 728926075 APOSFNWNVHYCMY-UHFFFAOYSA-N 385.492 5.072 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1csc(-c2csc(C)n2)c1 729145120 JMIFXRAMSVFYNX-UHFFFAOYSA-N 385.518 5.173 30 20 GKED C=CCNC(=O)c1ccccc1NC(=O)c1sc2cc(C)ccc2c1Cl 729171340 FMSYUMLAUJZNTQ-UHFFFAOYSA-N 384.888 5.031 30 20 GKED N#C[C@@H](NC(=O)Cc1ccc(Cl)c(Cl)c1)c1ccc(Cl)c(Cl)c1 731644262 OKGFSEAVPVELQT-OAHLLOKOSA-N 388.081 5.224 30 20 GKED N#CCOc1ccc(COC(=O)c2sc3cc(Cl)ccc3c2Cl)cc1 733385743 SMBZRKTUJABKBQ-UHFFFAOYSA-N 392.263 5.467 30 20 GKED N#CCOc1ccc(Cc2nc(-c3cccc(Oc4ccccc4)c3)no2)cc1 733742959 YRLPJQDDSDXPNK-UHFFFAOYSA-N 383.407 5.022 30 20 GKED CC[C@H](NC(=S)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1cccs1 734374047 OZAYXNUGTYETHB-UXHICEINSA-N 391.565 5.841 30 20 GKED C[C@H](c1ccccc1F)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740063588 BQIXCWGQMGHNNS-OAHLLOKOSA-N 393.487 5.328 30 20 GKED O=C1/C(=C/c2ccc(OCc3occc3C(=O)O)cc2)Cc2cc(Cl)ccc21 742438244 UNLZDQFCQGJUKG-OQLLNIDSSA-N 394.810 5.033 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)/C=C(/C)c2ccc(F)cc2)cc1 743447220 LGFNJPWDDIWHAF-FTBYOFJDSA-N 378.447 5.090 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1cccc(Cl)c1 744035482 MRBCZVSSHOQGCN-QMTHXVAHSA-N 375.280 5.583 30 20 GKED N#C[C@@H](C(=O)CCCc1cccc(Br)c1)c1ccc2ccccc2n1 761009129 BRZPGMALOXANAI-GOSISDBHSA-N 393.284 5.196 30 20 GKED C#CCOc1ccc(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)cc1 761432661 RJVLZQHJTHFVPA-UHFFFAOYSA-N 384.407 5.012 30 20 GKED N#Cc1ccccc1Oc1ccc(C(=O)OCc2ncc(C3CC3)o2)cc1Cl 761487888 NIAVFSJLFWNFJO-UHFFFAOYSA-N 394.814 5.226 30 20 GKED N#C[C@@H](OC(=O)c1sc(-c2ccccc2)nc1C(F)F)C1CCCCC1 776395209 CTTNTCGHIOKIMD-CQSZACIVSA-N 376.428 5.377 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 780674301 MDQULLCOLNNQKV-LBPRGKRZSA-N 390.270 5.095 30 20 GKED C=C[C@](C)(CCOC)COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1 784620156 YSXHXRNLDKDKLG-GOSISDBHSA-N 399.434 5.215 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cccc(CN(CC)C(=O)OC(C)(C)C)c1 785818063 DISJFXXFFCQHIE-IBGZPJMESA-N 387.524 5.016 30 20 GKED CCc1ccccc1CC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 785880491 LMIPJASHIWJFOA-HNNXBMFYSA-N 388.414 5.296 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1c[nH]c2ccccc12 786320619 CBCOLUKENVKTSJ-WFASDCNBSA-N 393.899 5.801 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccccc1 793135974 PQBICHWBDGIWOI-GOSISDBHSA-N 381.907 5.356 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(F)c(Br)cc2Cl)cc1 793254735 KJVYGZMGULVFTR-UHFFFAOYSA-N 395.659 5.111 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c1 797572177 ZVNSGUAFHDSOOJ-OAHLLOKOSA-N 399.516 5.278 30 20 GKED Cc1cc(Cl)c2ncc(C#N)c(N3CCC([C@H](O)c4ccccc4)CC3)c2c1 801667400 LYOVABYTXURQQT-HSZRJFAPSA-N 391.902 5.018 30 20 GKED Cc1nn(-c2ccccn2)c(C)c1/C=C/C(=O)c1ccc(SC(F)F)cc1 802705415 GWXOLTYDAQTPAF-ZHACJKMWSA-N 385.439 5.095 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2ccc(Cl)c(Cl)c2)cc1 914772423 VEIXMZOWJZAGGG-UHFFFAOYSA-N 393.318 5.703 30 20 GKED Cc1cc(C)c(OCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)c1 915087984 GAQYSOYODRKMBE-QHCPKHFHSA-N 384.479 5.285 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CCc2ccccc21 915351643 AMNNOUBUPXTULQ-RPWUZVMVSA-N 381.479 5.493 30 20 GKED C(=NNc1nc(-c2ccccc2)cs1)c1ccccc1OCc1cccnc1 915956373 RWCOMQXQZQAZHM-UHFFFAOYSA-N 386.480 5.230 30 20 GKED CCOc1cc(/C=C/C(=O)c2[nH]c(-c3ccccc3)nc2C)cc(Cl)c1O 917145560 NQJSYHXEKSVULF-MDZDMXLPSA-N 382.847 5.039 30 20 GKED CCCCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1OC 917510027 HSJGYAKEYBWUQP-QGZVFWFLSA-N 392.455 5.286 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cccn2Cc2cccs2)cc1 918322620 HSSMMSJZJDWKBV-QFIPXVFZSA-N 397.503 5.506 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/Sc3ccccc3)n2)cc1 920138849 LAJLQPMFFWXECI-DXRVJIQQSA-N 392.505 5.301 30 20 GKED CC[C@@H](C)n1ncc(NC(=O)N2CCC(c3ccc(C#N)cc3)CC2)c1C1CC1 930597791 KZFLFBJJGWHNPU-MRXNPFEDSA-N 391.519 5.015 30 20 GKED Cc1ccccc1COc1c(C)cc(C=NNc2ccccc2C(=O)O)cc1C 1776030245 ZYWXRAUPJYZMEZ-UHFFFAOYSA-N 388.467 5.335 30 20 GKED CC(CCc1ccc(O[C@@H](C)C(=O)O)cc1)=NN[C@H](C)c1ccc(C(C)C)cc1 1776106318 ZWFCGKVBOOIBNO-MOPGFXCFSA-N 396.531 5.321 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C/c1csc3ccc(C(=O)O)cc13)C2=O 1776114467 QLVNSZDYOZKOME-LICLKQGHSA-N 378.449 5.513 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(C)c(C(=O)O)c3)s2)cc1 1776133144 OLOONSYWGAMKES-IZZDOVSWSA-N 393.464 5.030 30 20 GKED C=CCCC1(C(=O)O)CCN(Cc2cc(-c3ccc4ccccc4c3)on2)CC1 1776177571 JPCWIFMMISPINE-UHFFFAOYSA-N 390.483 5.128 30 20 GKED CC1(C)C/C(=C\c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)C(=O)c2ccccc21 1776526628 FYJCNHWTXNIKTI-RVDMUPIBSA-N 388.419 5.298 30 20 GKED C[C@@H]1Cc2ccccc2C(=O)/C1=C\c1cccc(OCc2cccc(C(=O)O)c2)c1 1776665997 RBAQNAOYZKMNCS-WMWHPZEKSA-N 398.458 5.422 30 20 GKED CCCCCCCOc1ccc(CNC2(C(=O)O)CCC(CC)CC2)cc1 1776786427 ICWXMYLQDJYOEA-UHFFFAOYSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2ccccc2CC)c1 1776788097 RNURSVVCSRWGGD-DEOSSOPVSA-N 397.559 5.904 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2csc(C(=O)O)c2)cc1OC 1776789390 ZEMATFWDYPRANV-CLFYSBASSA-N 388.485 5.310 30 20 GKED COc1ccc2c(c1F)C/C(=C/c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777373698 SCQLIIVYDBPNCT-PDGQHHTCSA-N 388.394 5.022 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)[C@H]3CC=C(C)CC3)CCC2)cc1 1791250566 VNOVCDFVEGKFSA-OALUTQOASA-N 380.532 5.079 30 20 GKED N#Cc1c(NC(=O)CSc2cccc3cccnc23)sc2c1CCCCC2 20494405 KVMQFEWYUYHHFX-UHFFFAOYSA-N 393.537 5.168 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(C(C)C)cc2)cc1 27171716 WQPHNHVTYUEEKL-UHFFFAOYSA-O 389.544 5.457 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 60043801 REIHFAFQMQXLQP-IBGZPJMESA-N 385.492 5.469 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1csc(-c2ccccc2)n1 60451010 MNFDGEYFMXYAPB-UHFFFAOYSA-N 388.945 5.282 30 20 GKED CCc1nc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cs1 65662452 PNSVKTCQPRJAMG-UHFFFAOYSA-N 397.887 5.204 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 66800640 FXOHGNAIAKWJCK-NSHDSACASA-N 379.407 5.055 30 20 GKED CC(=O)Nc1ccc(S[C@@H](C)C(=O)/C=C2\N(C)c3ccccc3C2(C)C)cc1 102847868 UQLJZOYIIFJPSV-HSMAQGNYSA-N 394.540 5.006 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1cccnc1 102907764 YPRDHDMQAQDENK-CYBMUJFWSA-N 390.434 5.398 30 20 GKED CC(=O)[C@@H](C)CCCCC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 123095428 GJUBUAMPXDRZCL-SUMWQHHRSA-N 388.920 5.425 30 20 GKED Cc1cc(C#N)ccc1C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 123314810 OAMIMPFWMKXGBA-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)N(CCC#N)Cc3ccco3)c2)C1 123576923 HSLMRKUFUPWYRU-GHTZIAJQSA-N 395.503 5.323 30 20 GKED CC(C)Cn1ncc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1C(F)F 125061181 PNLYNUYVCSYXDX-CYBMUJFWSA-N 392.475 5.123 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ncc(-c4ccccc4)o3)o2)cc1 126326632 DBTWGXOLYUPKIK-UHFFFAOYSA-N 391.452 5.249 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(Cl)c(Cl)c1 128667339 CXMMETCIHJMGDV-OAHLLOKOSA-N 383.234 5.108 30 20 GKED N#C[C@H](C(=O)/C=C/c1nc2ccccc2s1)c1nc(-c2ccccc2)cs1 154804274 ZZEAEDOSCRVOLI-AUECHBEKSA-N 387.489 5.309 30 20 GKED Cc1cnc([C@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)s1 177085980 FKCUESJTGXFNMI-ZDUSSCGKSA-N 396.447 5.137 30 20 GKED Cc1nscc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 184553020 MEKVDYNHEKHZCA-NSHDSACASA-N 394.308 5.372 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)NC(C)C)cc1 188063531 SLCOLNHKDDUNPZ-UHFFFAOYSA-N 379.504 5.321 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccnc(N2CCCCC2)c1 191467639 RYBVGZFQFUJMCL-UHFFFAOYSA-N 392.547 5.246 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)cn1 214912553 FQJUJKMLIKYIPL-KHPPLWFESA-N 393.874 5.266 30 20 GKED CC(C)COc1ccc(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 303379201 VKKCMXBFGYJSSK-KRWDZBQOSA-N 382.529 5.297 30 20 GKED CN(Cc1cccc(Cl)c1)C(=O)c1cccc(COc2ccccc2C#N)c1 303572447 NAPHYCGZHNPSKM-UHFFFAOYSA-N 390.870 5.063 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC[C@H](c4ccccc4F)C3)c2)cc1 410330883 YSQJIUOYQUETBB-IBGZPJMESA-N 386.426 5.119 30 20 GKED Cc1onc(C2CC2)c1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 410460667 XBQLOKWXGKHHBV-UHFFFAOYSA-N 395.406 5.137 30 20 GKED C=CCC[C@@H](C(=O)N1CCC[C@H](c2nc3ccc(F)cc3o2)C1)c1ccccc1 427644189 GPZSTPXNCIAAEC-AZUAARDMSA-N 392.474 5.423 30 20 GKED C[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1nc(C(C)(C)C)cs1 431939791 TYNSZFNQAICTNX-NVXWUHKLSA-N 384.549 5.236 30 20 GKED COc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c(C(F)(F)F)c1 432642710 FZMLXTCPIWXJGW-QGZVFWFLSA-N 391.393 5.271 30 20 GKED C=CCC[C@H](NC(=O)CCc1ncc(-c2ccc(OC)cc2)o1)c1ccccc1 435275151 PIFOGGRQTPLWFF-NRFANRHFSA-N 390.483 5.107 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)Nc2cccc(C#N)c2)cc1 437648765 HMCXLPGEHAKGGF-QGZVFWFLSA-N 385.467 5.459 30 20 GKED CC[C@H](N[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C)c1ccc(C#N)cc1 447562567 MGYKZIFAHDHXNO-XOBRGWDASA-N 379.504 5.931 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F 453086986 LOSSWXPKALNVQZ-GFCCVEGCSA-N 395.406 5.477 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1-c1nc(-c2ncsc2Cl)no1 463168233 HARABRBYEZXHSA-UHFFFAOYSA-N 387.770 5.097 30 20 GKED C=CCOCCCC(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 463473443 HNGUAQJLJDUWPP-LJQANCHMSA-N 396.918 5.052 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2cccn2-c2c(Cl)cccc2Cl)n1 467190003 DOIXOYCOHGMPAG-LLVKDONJSA-N 376.268 5.039 30 20 GKED Cc1c(C(=O)Nc2cc(F)ccc2OC(F)F)ccc(C(F)(F)F)c1F 467969531 NLRCGGDMPBLAJG-UHFFFAOYSA-N 381.247 5.146 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)C[C@H](CC#N)c1ccccc1 475391814 PTKCJFQXMKXLJI-IBGZPJMESA-N 388.433 5.530 30 20 GKED C[C@@H](NC(=O)C[C@H](CC#N)c1ccccc1)c1ccc(-c2cccc(C#N)c2)cc1 476662579 FKYQMQBKJIQBKQ-CLOONOSVSA-N 393.490 5.490 30 20 GKED C=C(C)[C@@H](NCC(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)c(F)c1 481597486 XLFPSABISKQLSF-LJQANCHMSA-N 378.850 5.081 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3nccc4ccccc34)s2)c(C)c1 483207497 XKSLWYPUWNNNQI-HXUWFJFHSA-N 397.503 5.774 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NCc1ccc(C#N)c(F)c1 483699863 JBZAGUCIAUWESY-LBPRGKRZSA-N 385.895 5.634 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cnc2ccccc12 484564500 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N#CC1CCN(C(=O)NCc2cccc(Oc3ccc4ccccc4c3)c2)CC1 558139140 FHIKFISEQUHJTG-UHFFFAOYSA-N 385.467 5.077 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c2nccc(C)c2c1 559565994 DRQJVCBWMQBDBH-INIZCTEOSA-N 375.497 5.498 30 20 GKED N#CCCC1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)CC1 563085642 ONNKDSDUJGVHPI-UHFFFAOYSA-N 384.867 5.075 30 20 GKED Cc1nc(-c2cc([C@H](C)N[C@H](CCCC#N)c3ccccc3)cs2)cs1 567296269 HQJURPRSWKBFEF-HNAYVOBHSA-N 381.570 6.266 30 20 GKED C=CCn1c(S[C@@H](CCOC)c2ccccc2)nnc1-c1cccc(OC)c1 569244149 HXHFWMOXMCEATJ-FQEVSTJZSA-N 395.528 5.010 30 20 GKED C=CCSc1ccccc1C(=O)NC[C@@H](Cc1ccccc1)C(F)(F)F 570135234 KFVDVIWZHSECMG-MRXNPFEDSA-N 379.447 5.116 30 20 GKED Cc1nc(-c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)co1 589154323 YSWVAZWMRXSKLP-UHFFFAOYSA-N 378.775 5.017 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)c1 589913560 VJNFASFRIBKZOF-UHFFFAOYSA-N 391.471 5.241 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)C[C@@H](c1ccc(O)cc1)C1CC1 591059575 FGBIDQZIXFUUGE-HNAYVOBHSA-N 380.513 5.309 30 20 GKED N#CCCCOc1cccc(CNc2ccc3nc(C(F)(F)F)oc3c2)c1 592375363 GMXHWVXAFZCVII-UHFFFAOYSA-N 375.350 5.141 30 20 GKED Cc1ccc(OCc2nc(CNC3(c4ccc(C#N)cc4)CCC3)cs2)cc1 594033028 WBSULCJLVGVFBB-UHFFFAOYSA-N 389.524 5.071 30 20 GKED N#CC1(Cc2nc(C(F)(F)c3ccc(Cl)c(Cl)c3)no2)CCCCC1 596590923 FQRNTJAZBBXUPG-UHFFFAOYSA-N 386.229 5.533 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)Cc1c[nH]c2ccccc12 603533146 QBVHFDPQZRPDGH-UHFFFAOYSA-N 397.453 5.263 30 20 GKED CC(C)CN(C(=O)c1ccc(Br)cc1Cl)c1ccc(C#N)cc1 603956661 ZKFQVDQSXBGCBK-UHFFFAOYSA-N 391.696 5.277 30 20 GKED CCSCc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603962015 VLHHVHSOJSJLEN-UHFFFAOYSA-N 389.480 5.251 30 20 GKED C[C@H](SCc1ccccc1)C(=O)Nc1sc(-c2ccccc2)cc1C#N 603969062 YPAXLOPXFUKXQG-HNNXBMFYSA-N 378.522 5.547 30 20 GKED COc1ccccc1-c1nc(C(=O)Nc2ccccc2SCCC#N)cs1 609375445 QDWBOHUWNQDDJX-UHFFFAOYSA-N 395.509 5.077 30 20 GKED CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 609376766 JAQIBFDRWOUNOV-FXAWDEMLSA-N 396.556 5.858 30 20 GKED CCN(CCCNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1 609435293 DKINQUFAEXBBQJ-GOSISDBHSA-N 396.560 5.119 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCc2cccc(F)c2[C@H]1C 610019384 NLEHKYMIBLOIIG-LSDHHAIUSA-N 383.492 5.371 30 20 GKED C=CCN(C(=O)[C@H](C)C1CCCC1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610550028 JNCCBILMPNWACD-CQSZACIVSA-N 385.489 5.064 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CCC(c2cccnc2)CC1 611264981 DNZGPYHRRYQITD-UHFFFAOYSA-N 399.519 5.124 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21 618759109 UAJFPXNKAHTZLR-GAJHUEQPSA-N 388.515 5.055 30 20 GKED O=C(c1cccc(C(F)F)c1F)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 627664525 KPPFKLSUONHQGU-GXSJLCMTSA-N 393.249 5.109 30 20 GKED O=C(N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F)C1=CCC1 679995247 LQRGHHDBQXTHKO-LLVKDONJSA-N 391.233 5.164 30 20 GKED FC(F)Oc1ccccc1C=NOCc1ncc(-c2ccc(Cl)cc2)o1 727410589 RLCFFWGSLNPXHA-UHFFFAOYSA-N 378.762 5.147 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1OC 727685311 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741845393 VLKVDVNCYIEPEG-DHZHZOJOSA-N 394.883 5.621 30 20 GKED CC(C)(C)C[C@@H](NC(=O)NCc1ccc(OCC#N)cc1)c1ccc(Cl)cc1 743583258 PGMWEGWGOZFOQC-HXUWFJFHSA-N 399.922 5.219 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc4nc(S)oc4c3)cc2)c1 746238976 XHFLWGBICDOKII-UHFFFAOYSA-N 387.420 5.033 30 20 GKED C[C@@H](OC(=O)CCc1ccc(C#N)cc1)c1ccc(NC(=O)c2ccccc2)cc1 748011680 FFGYUHVYYILWBG-GOSISDBHSA-N 398.462 5.048 30 20 GKED C[C@H](OC(=O)c1ccccc1SCc1cscn1)c1ccc(C#N)cc1 748679958 MNCYOZKCZMYRBZ-AWEZNQCLSA-N 380.494 5.225 30 20 GKED Cc1c(Cl)cccc1NC(=O)[C@@H](C)ON=Cc1ccccc1C(F)(F)F 749352572 KFDGFLIUHKQJEL-GFCCVEGCSA-N 384.785 5.045 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1cc(SC)c(Cl)cc1Cl 760564747 UNNWMQXWCJGWQW-UHFFFAOYSA-N 384.259 5.119 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc2cc(Br)ccc2c1 763139759 QVILSHCCDNPKQH-UHFFFAOYSA-N 382.286 5.283 30 20 GKED CC[C@@H](C#N)Oc1cc(CNC2CCC(c3ccccc3)CC2)ccc1OC 772987456 WENSNCGJHDNUEW-HRTMPFAESA-N 378.516 5.192 30 20 GKED CC[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2o1 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CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(C(F)(F)F)cc2)cc1 916948366 URFULDSNQBXPQI-ACJLOTCBSA-N 388.389 5.180 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)Nc2ccc(Cl)cc2)cc1 920073337 UWLGGUJKCKXLQR-UHFFFAOYSA-N 379.872 5.813 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(OCC(F)(F)F)cc2)cnn1-c1ccccc1 921265841 STGMFFUUSAKKKN-FMIVXFBMSA-N 386.373 5.018 30 20 GKED Cc1cc(C)c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1C 1776132713 CKZNIFHSFFYISL-NTMALXAHSA-N 376.477 5.935 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(CC(F)(F)F)cc1 1776354374 JVBKWGAIFWTCGH-CLFYSBASSA-N 392.373 5.173 30 20 GKED CCCCCCCOc1cccc(CNc2cccc(C(C)(C)C(=O)O)c2)c1 1776787571 APIZNIUWWPNWJL-UHFFFAOYSA-N 383.532 6.010 30 20 GKED CN(C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1777038866 PTXATMFYTJMIOB-ZRDIBKRKSA-N 377.465 5.075 30 20 GKED Cc1ccsc1C(=O)/C=C\c1cccc(OCc2ccccc2C(=O)O)c1 1777477301 ZMQGSIPUOKRALY-KTKRTIGZSA-N 378.449 5.230 30 20 GKED CCn1c2ccccc2c2cc(/C=C3\S/C(=N\C4CCCC4)NC3=O)ccc21 20987593 HZQVCUOYDVBBAL-STZFKDTASA-N 389.524 5.317 30 20 GKED C=CCn1c(SCc2csc(C(C)C)n2)nc2sc(C)c(C)c2c1=O 31648917 OAUDUDVLQRCSFX-UHFFFAOYSA-N 391.587 5.133 30 20 GKED N#Cc1c(NC(=O)c2cc(F)c(Cl)cc2Cl)sc2c1CCCCC2 61047439 RCQJCGCOESTXJZ-UHFFFAOYSA-N 383.275 5.587 30 20 GKED C=CCOc1ccc(C(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1OC 63692425 BVLBYNAYLRLGND-UHFFFAOYSA-N 399.490 5.343 30 20 GKED N#Cc1ccsc1NC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 65714571 JOJSTTOXPWLCSL-UHFFFAOYSA-N 380.281 5.302 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1cccc(C(F)(F)F)c1 66861290 VTVJUHWJZPGOKF-CYBMUJFWSA-N 393.434 5.150 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 104417955 OKLSXQCBETXIPN-UHFFFAOYSA-N 399.406 5.088 30 20 GKED COc1ccc2oc([C@@H](C)NCc3cccc(OCCCC#N)c3)c(C)c2c1 106472147 VKNYCFGOIJEBCQ-QGZVFWFLSA-N 378.472 5.283 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F 108199408 TZZVUTIEUYJLSN-LSDHHAIUSA-N 390.430 5.453 30 20 GKED C=CCn1c(SC(c2ccccc2)c2ccccc2)nnc1-c1cccnc1 134191813 CWJAKZCVOZQMCN-UHFFFAOYSA-N 384.508 5.408 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1C1CC1 161162253 LMXBGOVUQHCAAA-PIGZYNQJSA-N 391.302 5.033 30 20 GKED Cc1cnc(C(C)(C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 177089950 MOVMMZJSWLEEDA-UHFFFAOYSA-N 392.484 5.172 30 20 GKED CSc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)ccn1 181422454 FVMAEZCAWBNSRN-CQSZACIVSA-N 385.901 5.070 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(=O)CC(C)C)c(F)c1 189889768 VTGONHZBECQBFV-UHFFFAOYSA-N 396.506 5.915 30 20 GKED C=CCN(Cc1nc(-c2cccc(C(F)(F)F)c2)no1)Cc1cccs1 247967794 CGINCFIPEJVORA-UHFFFAOYSA-N 379.407 5.005 30 20 GKED O=C(/C=C\c1cnc(-c2cccs2)s1)c1c(Cl)nc2sccn12 255913297 LERKPIGSOSYSJE-ARJAWSKDSA-N 377.903 5.130 30 20 GKED N#Cc1c(NC(=O)c2cc(Br)ccc2F)sc2c1CCCCC2 321088548 FULVETAYIGVJOQ-UHFFFAOYSA-N 393.281 5.043 30 20 GKED C[C@]1(C(O)=Nc2ccc(F)c(N=C(O)C3CCCCC3)c2)CCC(O)=NC1 328652952 KGRYSDZGBHEQSU-FQEVSTJZSA-N 375.444 5.339 30 20 GKED CSc1ccsc1C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 409791516 HQXGXXYCUGHPEW-UHFFFAOYSA-N 381.482 5.090 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 409916829 ZEOHWLOFIUGCBJ-RBUKOAKNSA-N 387.310 5.406 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 410974324 XRIVUCOSWHMNQU-HZPDHXFCSA-N 378.781 5.167 30 20 GKED CC(C)(C)CC(=O)N1CCC(Nc2ccc(Oc3ccccc3)c(C#N)c2)CC1 428408473 KFSFBPJHEGHAFH-UHFFFAOYSA-N 391.515 5.190 30 20 GKED Cc1onc(-c2cccc(Cl)c2Cl)c1C(=O)N1CCc2ccc(C#N)cc21 430804596 FHKXOAAOJIYEHM-UHFFFAOYSA-N 398.249 5.031 30 20 GKED C[C@H](Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1)c1ccc(C#N)cc1 432512577 HNYMYYKDPZANPQ-LBPRGKRZSA-N 385.254 5.620 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(CCC(F)(F)F)cc1)c1ccccc1 433019562 OGWVYTSUXANJSE-LJQANCHMSA-N 389.421 5.738 30 20 GKED C=CCC[C@@H](NC(=O)Nc1ccccc1CN1CCSCC1)c1ccccc1 435602747 WUDCEJSQLKXGCJ-OAQYLSRUSA-N 395.572 5.064 30 20 GKED C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639745 YDBACPZCPOQCTK-SWLSCSKDSA-N 391.368 5.126 30 20 GKED N#Cc1ccc(CN[C@@H](c2cccc(C(F)(F)F)c2)C(F)(F)F)c(Cl)c1 439453970 QQLFOGIGENRBOQ-HNNXBMFYSA-N 392.730 5.624 30 20 GKED N#CCC[C@@H](NC(=O)CCCc1cc(Cl)sc1Cl)c1ccccc1 439671356 PIGZPXJBDFBFBA-OAHLLOKOSA-N 381.328 5.539 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ncccc1Oc1ccccc1 440484320 KUOYVFHGZBEDOV-INIZCTEOSA-N 389.480 5.378 30 20 GKED CCO[C@@H](C)c1ncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)s1 442683611 WDIBCPZIDISRGV-DZGCQCFKSA-N 397.525 5.163 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)Nc1ccc(CC#N)cc1Cl 455699326 GZOUUNMCQXMBJI-ZDUSSCGKSA-N 390.940 5.519 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cc(Oc2ccccc2)ccn1 465125035 BQWWADPKEFOYET-INIZCTEOSA-N 389.480 5.378 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCCc1cccc(C#N)c1 466811338 GMAHMKHQBBWLIJ-GOSISDBHSA-N 389.524 5.135 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Cl)ccc1O[C@H](C)COC 470530936 RWMIXJKCVWIJMX-CQSZACIVSA-N 394.924 5.035 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(Br)c(C(F)(F)F)c1 471164847 JUMVPSLNFRJATC-UHFFFAOYSA-N 391.231 5.012 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc(C)cc1-c1nc(C2CC2)no1 472877559 QJFQBJJCTHKIST-UHFFFAOYSA-N 388.471 5.143 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(F)cc(NCC(F)(F)F)c1 473240409 BFBPFZYMYXUWPI-UHFFFAOYSA-N 384.398 5.330 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3sc(CC4CC4)nc3C)n2)cc1 475021636 BOQGDFWIFUSKQL-INIZCTEOSA-N 393.537 5.326 30 20 GKED Cc1ccc(CCN(CC(F)(F)F)C(=O)C[C@@H](CC#N)c2ccccc2)cc1 476118752 NSPPXLPGKKZUEP-HXUWFJFHSA-N 388.433 5.016 30 20 GKED Cc1ccc(CCN(CC(F)(F)F)C(=O)c2ccc(C(C)(C)C#N)cc2)cc1 476121773 YSSBIJJMCUDREF-UHFFFAOYSA-N 388.433 5.043 30 20 GKED C[C@@H](NC(=O)NCCCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 479362326 OOPVPVDNSGHQER-GFCCVEGCSA-N 381.423 5.098 30 20 GKED CN(C(=O)c1cccc(COc2cccc(F)c2)c1)c1cc(Cl)ccc1C#N 479570337 PKDGYEQCMGJAHJ-UHFFFAOYSA-N 394.833 5.206 30 20 GKED C=CCN(CC1CCCCC1)C(=O)c1cccc(NC(=O)c2cccs2)c1 482877500 GHLRDRFIBYUXDT-UHFFFAOYSA-N 382.529 5.209 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Br)ccc2o1)c1nccc2ccccc12 483216032 SOOIYOMEJSGMHN-INIZCTEOSA-N 391.224 5.234 30 20 GKED CC(C)(C)[C@@H]1C[C@H](NC(=O)c2ccccc2Sc2ccccc2C#N)CCO1 485707216 NRBPJHRWVUHNRB-UTKZUKDTSA-N 394.540 5.033 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@@H](c1ccc(F)cc1)C(F)(F)F 486160345 UWZOZWMZHABMJC-ZDUSSCGKSA-N 380.263 5.270 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1ccccc1C(F)(F)F 492585459 WTXUFSCMUDFKFC-LLVKDONJSA-N 383.211 5.190 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn(CC(C)C)c1C1CC1 497660306 IYWWYWRFFQYNLG-UHFFFAOYSA-N 392.956 5.352 30 20 GKED C=CCN(Cc1cccs1)[C@@H](C)c1nc(O)c2c3c(sc2n1)C[C@@H](C)CC3 499055902 YNNMVERGZUHZIW-KBPBESRZSA-N 399.585 5.332 30 20 GKED N#C[C@H](NC(=O)c1sc2cc(Cl)ccc2c1Cl)c1ccc(Cl)cc1 499838671 YZOKDJKWYUHSNQ-ZDUSSCGKSA-N 395.698 5.856 30 20 GKED CC(C)c1ccc([C@@H](NC(=O)NCc2ccc(C#N)cc2)c2cccs2)cc1 500429231 NJIRUWPVZYKQNE-JOCHJYFZSA-N 389.524 5.332 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@H](C)c1nc(-c2ccccc2)cs1 502592533 GGMIEGPBFWDEPV-GOSISDBHSA-N 391.540 5.311 30 20 GKED N#CCCN(Cc1ccco1)C(=O)c1cccc(OCc2ccc(Cl)cc2)c1 505104927 MKIGUSLHFJHNFF-UHFFFAOYSA-N 394.858 5.068 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@@H](C)CC[C@@H]1C 510103237 IIEMDXHSYGEPQD-WMZOPIPTSA-N 377.488 5.098 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)[C@H]1CCC[C@H](C)C1 510858893 GFWCPCKGDCFSNE-LPHOPBHVSA-N 377.488 5.701 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1C#N 511418031 ZNUAEXITIHXPOM-NSHDSACASA-N 382.420 5.211 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccccc1OCc1ccccc1C 512843403 HCFPSTYBNAGIQJ-UHFFFAOYSA-N 386.451 5.097 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1COCc1ccccc1 515267476 WONCIOBPPFMLMD-UHFFFAOYSA-N 392.524 5.685 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCCCc1ccccc1 517458780 AIRQDIFMTOFBLF-KRWDZBQOSA-N 384.570 5.385 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccc(Cl)cc1)C1CC1 518255435 DGTRAPHTIJXSJL-HNNXBMFYSA-N 399.947 5.931 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CNC(=O)c2ccccc2Sc2ccccc2C#N)o1 518308536 CXPJYQWNEPYNHO-KXBFYZLASA-N 388.492 5.356 30 20 GKED N#Cc1ccc(/C=C(\CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)cc1 520764415 XEKFNAWCOSHDBH-NTUHNPAUSA-N 388.370 5.202 30 20 GKED CCCC[C@H](C)N(C)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 521120898 PETHLMVITPRCDU-SFHVURJKSA-N 379.504 5.374 30 20 GKED C=CCOc1cccc(NC(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c1 521208058 CBNNLKWJCLITDY-CQSZACIVSA-N 378.394 5.495 30 20 GKED N#Cc1ccc(F)c(CSCc2csc(COc3ccc(F)cc3)n2)c1 521541704 IDCAICZLMNTPDR-UHFFFAOYSA-N 388.464 5.305 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 523615316 AZDUURTVNQUOSY-KRWDZBQOSA-N 383.879 5.020 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)CCc1ccc(F)cc1 524389719 YBYYCRLYGDDJRR-UHFFFAOYSA-N 388.442 5.156 30 20 GKED N#CC[C@@H](CC(=O)N1CCCC[C@@H]1c1ncc(-c2ccccc2)[nH]1)c1ccccc1 526011210 YUWUEJSMWIOJPD-JTHBVZDNSA-N 398.510 5.218 30 20 GKED N#Cc1c(NC(=O)c2cccc([C@H]3CCOC3)c2)sc2c1CCCCCC2 534913412 QGZIBKLNJFICDH-KRWDZBQOSA-N 380.513 5.035 30 20 GKED COc1cc(C#N)ccc1CN[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1 539302194 FNAOKVWRIJHOTB-KRWDZBQOSA-N 390.458 5.136 30 20 GKED C[C@@H](NC(=O)c1c(F)cc(F)cc1F)c1ccc(-c2cccc(C#N)c2)cc1 541130444 DCKJXLXLTBTNFD-CYBMUJFWSA-N 380.369 5.134 30 20 GKED COc1ccc(CN[C@H](c2ccc(OC(F)(F)F)cc2)C(F)(F)F)cc1F 542014071 UYMBEVWAZCNIIO-OAHLLOKOSA-N 397.290 5.126 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(C)c1ccccc1C#N 542890557 RXZZWHPEHGRHKS-UHFFFAOYSA-N 386.238 5.105 30 20 GKED Cc1c(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)oc2c1C(=O)CCC2 543857014 SRDSARQARBNUBW-MRXNPFEDSA-N 398.462 5.137 30 20 GKED Cc1c(C(=O)Nc2cnccc2Oc2ccccc2)sc2ccc(C#N)cc12 549936555 FQZRWHPQETZKKL-UHFFFAOYSA-N 385.448 5.521 30 20 GKED O=C(Nc1ccc(F)cc1OCCC(F)(F)F)[C@H]1CC[C@H](C(F)(F)F)C1 552250585 QHZONJOPPQMWHO-UWVGGRQHSA-N 387.295 5.074 30 20 GKED N#Cc1ccc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc1[N+](=O)[O-] 562576841 VPGDRVOVMCRQGZ-UHFFFAOYSA-N 398.875 5.114 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 565659929 IFIDIVRDHSXSOK-LAUBAEHRSA-N 375.541 6.204 30 20 GKED Cc1ccc(-c2noc(C[C@H](CC#N)c3ccccc3)n2)cc1Br 566999036 LIZGDHQDURHAFB-HNNXBMFYSA-N 382.261 5.048 30 20 GKED COc1ccc2oc([C@@H](C)NCc3ccc(C#N)cc3C(F)(F)F)c(C)c2c1 576512155 VQROORCQKJQBGD-CYBMUJFWSA-N 388.389 5.491 30 20 GKED Cn1c(-c2ccc(C#N)cc2)nnc1N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 580979954 QYBIXBBENRCVTM-GOSISDBHSA-N 398.297 5.002 30 20 GKED COc1ccccc1-c1ccc(CNC2(c3cccc(C#N)c3)CCOCC2)cc1 594983949 KBNQANHWGRNESO-UHFFFAOYSA-N 398.506 5.029 30 20 GKED N#CC1(CCCOc2cccc3scc(Br)c23)CCOCC1 596308509 QCSQNQQDANNHCR-UHFFFAOYSA-N 380.307 5.143 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1ccc2c(c1)CCCO2 596735248 XEYFICBBECUOOK-HZPDHXFCSA-N 395.528 5.146 30 20 GKED C[C@@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)C1 598410026 JFYVBJLVSMJFOP-LXGWOEDASA-N 399.519 5.159 30 20 GKED N#CCCC[C@@H](N[C@H](c1ccc(Br)cc1)C(F)F)c1ccccc1 598678978 CAFYWMHSIZTLSW-QZTJIDSGSA-N 393.275 5.780 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)C1CCC(C)CC1 609078838 QRFQBVZMWIKATQ-UHFFFAOYSA-N 391.515 5.488 30 20 GKED N#Cc1cccc(NC(=O)[C@H](Sc2ccc(F)c(F)c2)c2ccccc2)c1 609261237 DWOIYELPPJBAAD-HXUWFJFHSA-N 380.419 5.309 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1Cl 609378387 FMZQDBUPPBAEBH-UHFFFAOYSA-N 398.837 5.925 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)C1CCCC1 609437041 LZIVCJZYJJJYMS-VGOFRKELSA-N 393.556 6.134 30 20 GKED N#C[C@H](NC(=O)c1ccc(OC2CCCC2)cc1)c1cccc(C(F)(F)F)c1 609460373 DKZWAZMZNIOPAY-IBGZPJMESA-N 388.389 5.021 30 20 GKED Cc1ccc(NC(=O)N[C@H](C)c2cccc(C#N)c2)c(OCc2ccccc2)c1 610321758 SRPLRUZSIFRRHQ-GOSISDBHSA-N 385.467 5.328 30 20 GKED COc1cc(CN[C@H](C)c2cccc(C#N)c2)ccc1OCc1cccs1 610345062 RBOSNQUNNZZIIZ-MRXNPFEDSA-N 378.497 5.058 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)c1c(Cl)cc(C#N)cc1Cl 611190801 YZXSPOQYCMSWDN-UHFFFAOYSA-N 382.250 5.488 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cscc1C(F)(F)F 622835735 AGRJRELIKJSKIC-LBPRGKRZSA-N 385.304 5.330 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccccc2SCc2ccco2)s1 684673640 BARPCPMTORMJCV-INIZCTEOSA-N 396.537 5.816 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)C[C@@H]1C[C@@H](C)CC(C)(C)C1 727627744 QHHBNAKJWWWBJT-FUHIMQAGSA-N 382.548 5.311 30 20 GKED C[C@@H]1C[C@@H](CC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC(C)(C)C1 727631424 DYAVNCLYEYIIEA-HHXXYDBFSA-N 391.540 5.711 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)CCc2ccc(OC)c(Cl)c2)c1 728182246 DXGHUSVEKSTCPQ-UHFFFAOYSA-N 393.870 5.089 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cc3cc(Br)ccc3o2)cc1 728700947 YPQULFAFLMKBOA-FLUIGGAXSA-N 396.240 5.382 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 729448427 QTGUEARACOHCBD-UHFFFAOYSA-N 389.474 5.443 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C/c3ccc(OCc4ccncc4)cc3)c2c1 734306652 HUQYLZUEVUYUTQ-RUDMXATFSA-N 384.435 5.047 30 20 GKED Cc1nc2c(s1)C(=NNc1nc3cc(C(F)(F)F)ccc3s1)CCC2 743445075 CHVUTOKUBRKXES-UHFFFAOYSA-N 382.436 5.233 30 20 GKED CC(C)(C)c1ccc(-c2ccc(C(=O)[C@H](C#N)C(=O)NC3CCCCC3)o2)cc1 744027577 YXBUROKOMNVCDT-IBGZPJMESA-N 392.499 5.015 30 20 GKED COc1cc(C(=O)/C=C\c2ccccc2OCc2cccnc2)ccc1SC 747614589 IZMXUAJPTPKIIR-LUAWRHEFSA-N 391.492 5.287 30 20 GKED CCOc1c(Cl)cc(C=NOCc2ccc(C(F)(F)F)cc2)cc1OC 749539458 ZHYBMIZCBRTWAS-UHFFFAOYSA-N 387.785 5.317 30 20 GKED Cc1oc(-c2ccco2)nc1CC(=O)OCc1ccc(-c2ccccc2C#N)cc1 750190970 OVZYCYXEGZKBGB-UHFFFAOYSA-N 398.418 5.068 30 20 GKED N#C[C@@H](C(=O)C1CC(F)(F)C1)c1nc(-c2ccc(Cl)cc2Cl)cs1 753802678 QHIVKTHDDSQPTI-NSHDSACASA-N 387.238 5.338 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)C(=O)Nc1cccc2ccccc12 756514518 DCQJQVLUIXYDEX-LLLGYDHXSA-N 388.854 5.244 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 757854247 GKQCLQRZMODMTI-YADHBBJMSA-N 377.488 5.252 30 20 GKED CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 761673288 FNZLARBXTNDVBH-FQEVSTJZSA-N 395.478 5.395 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)NCc2ccc(OC)c(OC(F)F)c2)cc1 764776408 ATLZSKZZWRFLQO-CQSZACIVSA-N 397.849 5.279 30 20 GKED CCCn1ncc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C1CC1 765625634 UJQYWGSVWSQLTA-NRFANRHFSA-N 384.483 5.078 30 20 GKED Cc1cc(NC(=O)c2sc3cc(C(C)C)ccc3c2Cl)nn1CCC#N 767934482 UYMMSJOQWSTGOO-UHFFFAOYSA-N 386.908 5.349 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCOc3c(Cl)cc(C)cc32)c1 772982288 BPWIBVOZHWAVPJ-UWJYYQICSA-N 384.907 5.333 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CCCCC(=O)c2ccc(F)cc2)s1 797568743 VQDLKIQQJJEHFG-MRXNPFEDSA-N 386.492 5.199 30 20 GKED C=CCn1c(-c2ccco2)nn(CN(CC)Cc2ccc(Cl)s2)c1=S 798178711 VULWRBJLWIESLZ-UHFFFAOYSA-N 394.953 5.055 30 20 GKED O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N(CCC(F)(F)F)CC(F)(F)F 801705638 RLFFCMPDQMRGKI-JTQLQIEISA-N 399.228 5.059 30 20 GKED C[C@@H](N[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1)c1cccc(C#N)c1 810264245 ZHZQGOSTNQWQHS-XMSQKQJNSA-N 393.531 5.255 30 20 GKED CCC[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccccn1 810530692 CORHWSDNVYXSEY-ZWKOTPCHSA-N 375.497 5.274 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc2ccccc12)c1cc(C(F)(F)F)ccn1 813212236 ZVJFJCGJZZCVAE-SFHVURJKSA-N 398.384 5.289 30 20 GKED Cc1cccc(C)c1-c1cccc(OC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c1 813306488 XILWYIODCZVDAL-JOCHJYFZSA-N 380.447 5.130 30 20 GKED CCOC(=O)Nc1ccc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(Cl)c1 820479615 ZGHCZFRHDJKQAD-LJQANCHMSA-N 399.878 5.073 30 20 GKED Cc1cc(Br)c2ccccc2c1NC(=O)N[C@H]1CC[C@@H](CC#N)C1 836462493 MIHJBVMDSAYWQA-KBPBESRZSA-N 386.293 5.115 30 20 GKED C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)[C@H](C#N)c1nc(C2CC2)cs1 842940945 GENRCWVQUMRZCC-ABAIWWIYSA-N 378.419 5.094 30 20 GKED Cc1cc([C@@H](C#N)C(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)nc(C)n1 916880779 ZBDIHRXNAXOTAE-NBEHIINDSA-N 393.899 5.365 30 20 GKED N#CCc1cccc(C(=O)O[C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)c1 919313267 CLHGPCYBHQCVNK-DEOSSOPVSA-N 394.430 5.015 30 20 GKED N#C[C@@H](COC(=O)c1ccccc1SCc1ccco1)Cc1ccc(F)cc1 920876427 JWSFJVZLMGRECN-KRWDZBQOSA-N 395.455 5.250 30 20 GKED C/C(=C\C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccc(F)cc1 921281725 UMUBHVMNZAWQOQ-FYWRMAATSA-N 387.414 5.235 30 20 GKED CC(=NNc1cccc(Cl)c1Cl)c1cccc(OCCCC(=O)O)c1 1776081132 ZRVHAQYNASKHHS-UHFFFAOYSA-N 381.259 5.073 30 20 GKED O=C(/C=C/c1cc(C(=O)O)c(Cl)s1)c1ccccc1OCc1ccccc1 1776126560 PGAPFWWGBNIXEX-ZHACJKMWSA-N 398.867 5.575 30 20 GKED CC(C)COc1ccccc1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776333758 OUFQKKHALOBTSK-LUAWRHEFSA-N 382.456 5.103 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(-c2ccccc2F)o1 1776354459 MDRNWHNTGFCXPG-CSKARUKUSA-N 394.398 5.467 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(Cl)ccc1OC(F)F 1776783050 UBGIYCAQFPQGNH-HNNXBMFYSA-N 377.859 5.235 30 20 GKED CCCCCCCOc1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)cc1 1776785955 ZOJFUFMATFYOCY-WNLUNTPQSA-N 392.495 5.874 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccc(Cl)cc3)s2)cc1C(=O)O 1777360753 JTCQVUXYEXRWFQ-WAPJZHGLSA-N 398.867 5.671 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C\c1cc(C(=O)O)ccc1Br 1777559904 VSYUXWKQSPRLRH-CLFYSBASSA-N 385.213 5.098 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Cl)c(Cl)cc3O)c2c1 1777685464 BGTYPCZEVKGPCL-HNQUOIGGSA-N 393.247 5.508 30 20 GKED O=C1/C(=C/c2ccccc2OCc2ccccc2)C[C@@H](C(=O)O)c2ccccc21 1777698110 HSACEPCGKSASAS-PGPKDTDWSA-N 384.431 5.104 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cccc(Cl)c2)nnc1-c1ccoc1C 21925262 DEGHYYYDGUPYRV-CYBMUJFWSA-N 387.892 5.049 30 20 GKED CC(C)Oc1ccc(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1 31776974 ZKKKPEDUZOJNIW-UHFFFAOYSA-N 386.451 5.177 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)[C@@H](C#N)c1ccc(C(F)(F)F)cn1 41553088 GYSUFQSTIAJNII-IBGZPJMESA-N 391.352 5.129 30 20 GKED C=CCn1c(S[C@H](C(=O)c2ccccc2)c2ccccc2)nnc1C1CC1 49583408 PLJWPUGRAPWAJS-FQEVSTJZSA-N 375.497 5.058 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(Cl)c(Cl)c1 66800694 UKIASSUSMTVRNK-LBPRGKRZSA-N 379.312 5.569 30 20 GKED CC(C)c1ccc(Sc2ccc(NC(=O)N3CCC(C#N)CC3)cc2)cc1 105027776 VKBAPPQPLNPBKO-UHFFFAOYSA-N 379.529 5.729 30 20 GKED CSc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)ccn1 108241636 AITHSVRBSIYBDX-UHFFFAOYSA-N 397.447 5.080 30 20 GKED CSc1ccc(C)c(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c1 108470759 FOTRRMMZMVMVMW-UHFFFAOYSA-N 389.480 5.337 30 20 GKED N#CCN(C(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C1CCCC1 125119069 RAVMHWPQUJZKND-UHFFFAOYSA-N 380.300 5.025 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C 162055412 ZYLWWYLHQSAAAL-UHFFFAOYSA-N 379.869 5.147 30 20 GKED C[C@@H](N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccc(OCC#N)cc1 174044938 WAXOGDVUUNYNLV-RTBURBONSA-N 399.494 5.253 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cc(F)c(F)c(O)c1F 185436495 BFUKUFKJJHRJDW-UHFFFAOYSA-N 398.340 5.034 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc3cc[nH]c3c2)cc1 194799029 JKOWCLQXXXYZPK-UHFFFAOYSA-N 383.476 5.584 30 20 GKED CCS[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C1 247325989 LXOKCIWQJBLTLR-BZUAXINKSA-N 377.579 5.267 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)N2CCC(Oc3cccc(C#N)c3)CC2)cc1 303773290 JQKCFQWRCFQCMV-LJQANCHMSA-N 390.527 5.245 30 20 GKED Cc1cccc(C)c1N=C(O)[C@H](C)N1CCC([C@@H]2C(O)=Nc3ccccc32)CC1 328712472 RSMWWERFMDYFFV-UWJYYQICSA-N 391.515 5.377 30 20 GKED CC(C)c1csc([C@H]2CCCN(C(O)=Nc3scnc3C3CC3)C2)n1 328919469 SMQIOIDMBOSORS-ZDUSSCGKSA-N 376.551 5.026 30 20 GKED Cc1c([C@H](/N=C(/O)N2CCC(OCC3CC3)CC2)C(C)C)oc2ccccc12 329814243 UHGYPIPDIROBGU-OAQYLSRUSA-N 384.520 5.243 30 20 GKED Cc1ccccc1COc1cccc(N=C(O)N2CCCC3(CCOCC3)C2)c1 330181363 OALLVSVGBNHPAK-UHFFFAOYSA-N 394.515 5.012 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F 432957775 FHCKQRFEASWLCK-UHFFFAOYSA-N 379.835 5.008 30 20 GKED N#Cc1ccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)s1 436401231 UMLWWNFVWUVJNT-AWEZNQCLSA-N 378.341 5.422 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)c1 437207085 GVEMLSXKQSVCEY-UHFFFAOYSA-N 390.695 5.084 30 20 GKED CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 438046453 XQDJYEIZUBAKOS-OXJNMPFZSA-N 399.535 5.609 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N(Cc1ccco1)c1ccccc1C#N 443837561 OPBNCIHNIDNPEQ-QGZVFWFLSA-N 376.431 5.092 30 20 GKED N#CCCCOc1cccnc1NC(=O)N1CCCC[C@@H]1c1cccc(Cl)c1 445155843 GJTGRMWIPBAGGW-GOSISDBHSA-N 398.894 5.177 30 20 GKED CCN(C(=O)CCC(=O)c1csc2ccccc12)[C@H](C)c1ccc(C#N)cc1 445914028 XPMMUENKJHGGCK-MRXNPFEDSA-N 390.508 5.346 30 20 GKED CCc1ccc(Cl)c(CC)c1NC(=O)c1cc(-c2cccc(C#N)c2)no1 448101261 NHMNMVSWKLXNOJ-UHFFFAOYSA-N 379.847 5.244 30 20 GKED CCCn1ncc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1C1CC1 452463164 GIVOFRWQKNILTF-UHFFFAOYSA-N 385.471 5.038 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 458540365 WIOYHDNMTZPMNG-NJAFHUGGSA-N 381.442 5.089 30 20 GKED C[C@H](C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(F)c(F)c1 460164763 SOEXZDBFVJZBGY-AWEZNQCLSA-N 378.378 5.371 30 20 GKED C=CC1CCN(C(=O)N[C@@H](c2ccccc2Cl)c2ccccc2OC)CC1 466083395 WJTGCPWPOYCBQD-NRFANRHFSA-N 384.907 5.046 30 20 GKED CC(C)n1cnc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)c1 467056115 FUUCCHQLVMUOQF-SFHVURJKSA-N 378.863 5.025 30 20 GKED COc1ccc(CNc2ccc3c(c2)CCC(=O)N3CCCC#N)c2ccccc12 468912475 HCJPWGHHJICVOF-UHFFFAOYSA-N 399.494 5.043 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 471666374 WOYAYKYPLJUNFR-GFCCVEGCSA-N 392.286 5.043 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(SCc2cccnc2)cc1)c1ccccc1 474420339 FCNVRWRLKTZRIG-HXUWFJFHSA-N 387.508 5.400 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(Cn3cnc4ccccc43)cc2)cc1 475387797 DXSNCSIHEKVNTB-UHFFFAOYSA-N 394.478 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(-c2ccc(OC)cc2)[nH]n1 476791455 ILNGWCGGVCAWQL-UHFFFAOYSA-N 375.472 5.190 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)C(C)(C)Oc2ccc(C#N)cc2)c1C 482846150 TYMMNMLNBFHLAA-UHFFFAOYSA-N 394.515 5.368 30 20 GKED CCc1c(NC(=O)Nc2ccccc2SC[C@H](C)C#N)cnn1C(CC)CC 484165841 VKDPUUCWROESRJ-OAHLLOKOSA-N 399.564 5.702 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)cc1 488307098 JXVMTGHDAGVNRE-WSTZPKSXSA-N 393.556 5.657 30 20 GKED CC(C)(C#N)CCCSc1nnc(Cc2ccccc2)n1C1CCCCC1 489442270 VYGMGAOZZLGJTQ-UHFFFAOYSA-N 382.577 5.796 30 20 GKED C=C[C@@H]1CCCCN1Cc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 489501594 UQYARTZREVUAAN-QGZVFWFLSA-N 375.925 5.022 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cc2ccccc2n1CC(F)(F)F 494196652 YMGLUTOVRUSCKK-UHFFFAOYSA-N 399.416 5.128 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1 499055199 VGYQJJQWUHVEKA-UHFFFAOYSA-N 384.266 5.175 30 20 GKED CC(C)(C#N)CNC(=O)NCc1ccccc1-c1ccc(Cl)cc1Cl 499739300 IKQVHBQAYCHIIY-UHFFFAOYSA-N 376.287 5.009 30 20 GKED COCc1cccc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 502621517 KRWZNVLYHDXDND-UHFFFAOYSA-N 387.439 5.449 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 505029647 OSXSDMIZRSULFI-UHFFFAOYSA-N 380.332 5.154 30 20 GKED COC(=O)c1ccc(C(C)C)c(NC(=O)c2sc3ccc(C#N)cc3c2C)c1 505082947 YVLAZBXQQKSHLE-UHFFFAOYSA-N 392.480 5.244 30 20 GKED Cc1cc(N(C)C)cc(C)c1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 505104686 NYSAJSHEWGTIKC-UHFFFAOYSA-N 399.494 5.480 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)sc2nccn12 505406746 ZXSTWXVMVZJLSA-GFCCVEGCSA-N 398.557 5.041 30 20 GKED N#C[C@@H](C(=O)c1ccc(-n2cccc2)c(F)c1)c1nc2cc(Cl)ccc2s1 511700090 KAEDMQQTJZNPKG-AWEZNQCLSA-N 395.846 5.370 30 20 GKED N#CC1(NC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)CCCCC1 514239059 KIDMHXYONFGUKZ-UHFFFAOYSA-N 389.474 5.249 30 20 GKED CSc1cccc(N(C)C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1 517339651 XDVXEFLCHQLGLP-UHFFFAOYSA-N 392.455 5.488 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1 518683215 MQXDKYUUWKXZLH-FXAWDEMLSA-N 381.545 5.847 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 519508041 LWGQXCZFEHQDSO-UHFFFAOYSA-N 397.228 5.267 30 20 GKED CC(C)(C)[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 521093917 LPGXZLPTWVKZAM-WOJBJXKFSA-N 377.488 5.080 30 20 GKED CC(C)[C@H](NCc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 521833251 ZFLBZOGCEGAHIQ-NRFANRHFSA-N 390.449 5.875 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 534595980 BPCQDWZPEPYEDQ-SFHVURJKSA-N 396.343 5.104 30 20 GKED N#CCCCCNC(=O)c1cc(Cl)ccc1Sc1ccc(Cl)cc1 538191777 XDRJSZDMXIPQOB-UHFFFAOYSA-N 379.312 5.568 30 20 GKED CSc1ccc(C)c(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 538344753 BDHBATQWDTXVSX-UHFFFAOYSA-N 390.533 5.992 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(Cc2ccc(F)cc2)CC1 538949693 JKLQMXYRKXRKLW-INIZCTEOSA-N 397.519 5.222 30 20 GKED CC(C)c1cc(Br)ccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 539669127 JXMCLTBRWYUBJQ-UHFFFAOYSA-N 383.289 5.380 30 20 GKED C[C@@H]1COc2ccccc2CN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 542953224 CEECWCGKEUVLKU-QGZVFWFLSA-N 399.450 5.166 30 20 GKED C=C(C)CN1CCC(NC(=O)c2cc(Cl)ccc2SCCCC)CC1 544490848 CAKYUEYHCFICJV-UHFFFAOYSA-N 380.985 5.003 30 20 GKED C[C@H](c1ccncc1)c1noc(-c2ccc(Oc3cccc(F)c3C#N)cc2)n1 545097914 PYKBOMIAFVHJMU-CQSZACIVSA-N 386.386 5.086 30 20 GKED C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1 554122356 BZAYYRQVXHGMAT-OAHLLOKOSA-N 388.433 5.210 30 20 GKED N#Cc1cc(Cl)ccc1Sc1ccc(NC(=O)[C@H]2CCCOCC2)cc1 556691186 ORMBMGYTXICCPB-AWEZNQCLSA-N 386.904 5.118 30 20 GKED Cc1cc(C(=O)CSc2cccc(Cl)c2C#N)c(C)n1CC(F)(F)F 557186015 YQEONXDKHDKOQK-UHFFFAOYSA-N 386.826 5.167 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ncsc2C(C)C)cc1 562096185 BFUUBPONISGCTH-UHFFFAOYSA-N 393.468 5.191 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccc(Cl)cc2)CC1 567934669 GZKMVVIQTCJEIT-HNNXBMFYSA-N 399.947 5.445 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N[C@H](c3cccs3)C3CC3)cc2)ccn1 589362549 KLKZZAKGVZRKKY-FQEVSTJZSA-N 390.468 5.080 30 20 GKED Cc1ccc2c(Cl)c(C(=O)N[C@H](CCCC#N)c3ccccc3)sc2c1 590477558 RMGBTQHFSIJXJX-QGZVFWFLSA-N 382.916 6.028 30 20 GKED C=C(C)CN1CCC(NC(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)CC1 592302262 YMFGKZGDTWVDIP-IBGZPJMESA-N 397.588 5.061 30 20 GKED CCCCCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 592973889 KVVFWFCPDAXAAK-QGZVFWFLSA-N 382.460 5.494 30 20 GKED N#C[C@@H](C(=O)c1cnc(-c2ccccc2)s1)c1nc2cc(F)ccc2s1 592974095 NQCWEJQMHUIDED-ZDUSSCGKSA-N 379.441 5.049 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603763925 CFJXVLJNBSXOGU-UHFFFAOYSA-N 389.480 5.175 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 606576420 IDOWBMDCVHNNOY-IFMALSPDSA-N 395.506 5.200 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1 606942699 WVDJHHLLRPJNER-UHFFFAOYSA-N 379.504 5.173 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c1 609033516 ZKNMNDLJVZIARN-UHFFFAOYSA-N 383.382 5.290 30 20 GKED CC(C)C[C@@H](NC(=O)c1ccc(COc2ccc(C#N)cc2)o1)c1cccs1 609059721 LLCDUDWLPNRRRY-LJQANCHMSA-N 394.496 5.309 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3cnc4ccccc4c3)cc2)cc1 609498715 AQDZRSYWFIHVKW-UHFFFAOYSA-N 379.419 5.345 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)CCc2ccc(C#N)cc2)c1 609908296 MGYUQVWQZQJLKT-UHFFFAOYSA-N 378.419 5.092 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)c1ccc(OCc2ccccc2C#N)cc1 610056015 VCSRBZCMQAFPBJ-DEOSSOPVSA-N 399.494 5.146 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)[C@H](C)c1ccccc1C(F)(F)F 610226094 FQEPVDXBFUYCLU-CYBMUJFWSA-N 376.378 5.106 30 20 GKED Cc1noc([C@@H](C)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)n1 610342847 YWUVVSQEMXYRLW-LLVKDONJSA-N 388.349 5.234 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl 619674385 YSGVDUSHAPKOLD-SFHVURJKSA-N 396.277 5.277 30 20 GKED O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1coc2cc(F)ccc12 684388455 YYCSQOZECYJLKV-RKDXNWHRSA-N 397.290 5.211 30 20 GKED O=C(Nc1cccc(CC(F)(F)F)c1)c1c(F)cc(C(F)(F)F)cc1F 685763870 VEKGHBFVKJZIJI-UHFFFAOYSA-N 383.238 5.341 30 20 GKED O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C=Nn2cnc3ccccc32)cc1 725848806 JJIOXTNILKNZSY-UHFFFAOYSA-N 392.802 5.272 30 20 GKED N#CCCCOc1cccc(/C=C2/COc3c(Cl)cc(Cl)cc3C2=O)c1 726743450 ICCFWCPFSBBSKX-ZSOIEALJSA-N 388.250 5.335 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccccc2SC(F)(F)F)C2CC2)cc1 727590365 JBYWRTFOWOYLFZ-UHFFFAOYSA-N 391.418 5.367 30 20 GKED CC(=NNc1oc(C(C)(C)C)nc1C#N)c1sc(-c2ccc(C)cc2)nc1C 727650811 AAHZRBVWTZQBBX-UHFFFAOYSA-N 393.516 5.420 30 20 GKED CC(C)[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccccc1 728766712 HJTYOIYKUDOUAC-FCHUYYIVSA-N 384.479 5.317 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C/c1cn(-c3ccccc3)nc1-c1cccnc1)C2 730949678 ZOSXCLRRZFRGCV-XSFVSMFZSA-N 377.447 5.065 30 20 GKED O=C(/C=C/c1ncc(-c2ccc(Br)cc2)[nH]1)c1ccc(F)cc1F 732713766 GXRAHTBUPFSQBZ-BQYQJAHWSA-N 389.199 5.014 30 20 GKED C=CC[C@H](NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734665367 NLTCXCZBJBISNO-KRWDZBQOSA-N 378.303 5.240 30 20 GKED CCc1nc(C)c(C(C)=NNc2nc(C)nc3sc4c(c23)CCCC4)s1 735227825 IVQMIEZCBZKEMK-UHFFFAOYSA-N 385.562 5.042 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2sc(N3CCCC3)nc2Cl)cc1 735972100 LMASNFATCNONOL-AWEZNQCLSA-N 376.957 5.205 30 20 GKED CS[C@H]1CC[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 743123142 GEKRIQVXNBAQSL-APWZRJJASA-N 381.501 5.065 30 20 GKED N#C[C@@H](C(=O)CCCC1CCCC1)C(=O)Nc1ccccc1Oc1ccccc1 744029419 TUFRCFZHHQGGFM-FQEVSTJZSA-N 390.483 5.487 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1sc(Cl)nc1C 748528675 IIUOWJPPPLAEPK-UHFFFAOYSA-N 383.860 5.330 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(NC(=O)NC(C)C)cc3)co2)cc1 749890788 BJJDPTZBPQODEV-OUKQBFOZSA-N 389.455 5.076 30 20 GKED C=CC[C@H](NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccncc1 750002270 DMCZFDKDQOJCFK-KDOFPFPSSA-N 397.931 5.197 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccccc2)cc(Br)c1OC(F)F 750898919 ANKMSRRXDSUXOV-CMDGGOBGSA-N 397.215 5.345 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=S)Nc2cccc(C)c2)cc1 751015881 YOXNWCBUGALFIY-UHFFFAOYSA-N 389.480 5.477 30 20 GKED CC(C)c1ccccc1NC(=O)[C@H](C)ON=C(c1ccccc1)C(F)(F)F 751957274 XKNNXHBBBICKDQ-AWEZNQCLSA-N 378.394 5.120 30 20 GKED C/C(=C\c1ccccc1Cl)C(=O)[C@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 756505392 RCKIEFRKLPWYAN-HVJHFUJKSA-N 376.843 5.125 30 20 GKED CCOc1c(Cl)cc(NC(=O)c2ccccc2SCC#N)cc1Cl 767120252 FITVPRVUPQCIFP-UHFFFAOYSA-N 381.284 5.260 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(CC(C)C)cc2)ccc1OC 772979022 JZJUQRPBBNKMOK-GCJKJVERSA-N 380.532 5.425 30 20 GKED CC[C@@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(C#N)cc1 774331135 PGOUNUMNOKYJIO-OAQYLSRUSA-N 377.875 5.749 30 20 GKED CCOc1ccc(Oc2ccccc2NC(=O)Cc2ccccc2CC#N)cc1 776742491 JDJHVGFEAVPJEC-UHFFFAOYSA-N 386.451 5.125 30 20 GKED CCCCC[C@](C)(CC)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 787514542 DVOJWFZAZXVVLR-QHCPKHFHSA-N 383.536 5.205 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)NCc1cccc(O[C@H](C#N)CC)c1 788311385 TUGPOPLTHVBMSO-FQEVSTJZSA-N 393.531 5.765 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)[C@@H](C#N)c1nccc2ccccc12 792099737 IWQVCXLCGDJIOB-WFASDCNBSA-N 385.250 5.185 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=S)NCCCCC(F)(F)F)cc2)c1 794977835 MKCGXLAZXYXSLC-UHFFFAOYSA-N 393.434 5.370 30 20 GKED O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N(Cc1cccs1)CC(F)(F)F 801678359 HPHVOJBIDUVEKH-ZDUSSCGKSA-N 399.331 5.369 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1ccc(C#N)nc1)CC(C)(C)O2 811862093 CBASVDKEHORBBW-SFHVURJKSA-N 394.475 5.015 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)Cc1ccc(Cl)cc1 813211080 CXWTWMRLDPUQLL-BLLLJJGKSA-N 380.797 5.199 30 20 GKED Cc1cc(C(F)(F)F)ncc1NC(=O)[C@H](F)c1ccc(C(F)(F)F)cc1 813276142 SDVPKQHROOEEEN-CYBMUJFWSA-N 380.263 5.077 30 20 GKED C=C(C)C(C)(C)C(=O)OCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 821444191 FQTKFTCCJVEJLE-UHFFFAOYSA-N 392.908 5.127 30 20 GKED N#C[C@H](C(=O)C1(C(F)(F)F)CCC1)c1nc(-c2ccc(Cl)cc2)cs1 835067188 AFIYUGXJPHHUKK-GFCCVEGCSA-N 384.810 5.372 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@@H](C#N)c3nc(C4CC4)cs3)sc21 842940142 XWVHFQVUVDKQAQ-CQSZACIVSA-N 377.494 5.217 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@@H](C)OC(=O)[C@H](C)CC#N 850855525 YCESRTRAETXNEU-ZYHUDNBSSA-N 393.306 5.035 30 20 GKED CCC(F)(F)C(C)(C)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 860424290 DJNNQMCSUHEOGT-IBGZPJMESA-N 385.458 5.535 30 20 GKED CCCOc1ccc(C=NOCc2cc(Cl)cc3cccnc23)cc1OC 914786281 CAQSOHBSOHQMSB-UHFFFAOYSA-N 384.863 5.236 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNc2ccc(Cl)cc2)cs1 916247068 XYGPZSIIZLRGHV-UHFFFAOYSA-N 398.919 5.544 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc2ccccc12)c1nc2ccccc2s1 916847820 RBZFCOJFMKWQNH-GOSISDBHSA-N 386.476 5.485 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3cc(Cl)ccc3o2)cc1 916948197 DWHAZBZNCHVDQD-FZKQIMNGSA-N 394.858 5.561 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)Cc2coc3cc(C)ccc23)cc1 916955705 TUYDZTMMMBPJTM-IERDGZPVSA-N 388.467 5.145 30 20 GKED N#C[C@H](C(=O)C1(c2ccc(F)cc2)CCCC1)c1nc2cc(Cl)ccc2s1 917043558 JRCJEAIZROVPTD-MRXNPFEDSA-N 398.890 5.777 30 20 GKED N#C[C@@H](C(=O)C1(c2ccccc2F)CCCC1)c1nc2cc(Cl)ccc2s1 917047049 PRSGMZFILHCILA-AWEZNQCLSA-N 398.890 5.777 30 20 GKED O=[N+]([O-])c1ccc(O)c(C=Nc2ccc(O)c(-c3nc4ccccc4s3)c2)c1 920944502 MULHKLDHXMLWQC-UHFFFAOYSA-N 391.408 5.033 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(-c3cc(Cl)ccc3Cl)o2)c1 1776036665 PJXZCSNQIJCTJD-UHFFFAOYSA-N 375.211 5.398 30 20 GKED O=C(O)c1cc2c(C=NNc3cccc(Cl)c3Cl)c(F)ccc2s1 1776080878 IAZJZYSGXYZSDB-UHFFFAOYSA-N 383.231 5.491 30 20 GKED O=C(O)Cc1ccc(NN=C2CCC[C@@H]2c2cccc(C(F)(F)F)c2)cc1 1776085256 ZGWDMCMBNKGTBN-QGZVFWFLSA-N 376.378 5.068 30 20 GKED COc1ccc(/C=C2/Oc3c(cccc3C(C)(C)C)C2=O)c2cc(C(=O)O)oc12 1776113361 HJOJQUKNYBZRJY-LICLKQGHSA-N 392.407 5.053 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cs1 1776280429 JLAWCLIIAUBLQS-AWNIVKPZSA-N 391.492 5.702 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)c1 1776341421 GYMNAWCSJAXMKK-NVNXTCNLSA-N 384.475 6.146 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 1776782764 GNOIBKGBBOGCFR-QGZVFWFLSA-N 388.464 5.148 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cnc(CCc2ccccc2)s1 1776785657 OSBAYRGNYFVCOS-LJQANCHMSA-N 388.577 5.222 30 20 GKED CCn1c2ccccc2c2cc(/C=C\C(=O)c3cccc(OCC(=O)O)c3)ccc21 1777002704 AIYHBBHLXOKCQL-QBFSEMIESA-N 399.446 5.174 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)C3=CCCS3)cc2)CCC1 1786414841 SDBVONSCEUUZPJ-UHFFFAOYSA-N 398.572 5.134 30 20 GKED C=CCN(C(=O)c1ccc(Cl)c(Cl)c1)c1nc(-c2ccccc2)cs1 6022233 BWLOHUQBUUFPEI-UHFFFAOYSA-N 389.307 5.950 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccc(C)c(C)c2)cc1 11160488 UTJAQVRQHNRFDV-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=C(C)CN(CC)C(=O)c1cc(-c2ccccc2C)nc2c1cnn2C(C)C 24458638 SZIQQCYTEPQPCE-UHFFFAOYSA-N 376.504 5.026 30 20 GKED Cc1ccc(C(=O)/C(=C(/S)Nc2cccc(C)c2C)[n+]2ccc(C)cc2)cc1 27175797 AXHISOOLDISYSS-UHFFFAOYSA-O 389.544 5.259 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(OC(F)(F)F)c1 31036072 LRQMLQGIKDZFMZ-UHFFFAOYSA-N 382.341 5.376 30 20 GKED N#Cc1cc(NC(=O)c2cc(Cl)ccc2Cl)ccc1OCC(F)(F)F 46845335 YTUUXQAZWXSBRM-UHFFFAOYSA-N 389.160 5.058 30 20 GKED O=C(Nc1c(F)cc(F)cc1F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 92057380 ZNDYXTHAMKDXSA-ZDUSSCGKSA-N 380.263 5.058 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1ccc(F)cc1F 108146713 QYPQQKIXKXSUFB-LBPRGKRZSA-N 378.469 5.090 30 20 GKED N#Cc1ccc(-c2ccc(OCc3cccc(C(=O)N4CCCCC4)c3)cc2)cc1 117501931 SDFDSHUWWSNACU-UHFFFAOYSA-N 396.490 5.430 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CCO[C@H](c2ccccc2)C1 163375516 IHXKTYDLIYVTHF-HQRMLTQVSA-N 395.528 5.123 30 20 GKED CCN(C(=O)c1ccc(NC(=O)CC(C)C)c(C)c1)[C@@H](C)c1ccc(C#N)cc1 172755681 UAQHZCVQWGQWDE-SFHVURJKSA-N 391.515 5.075 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1 176607318 KCUMRLPKTCPFJT-LJQANCHMSA-N 396.494 5.079 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2cccc(Cl)c2)C1 191465249 COKOBYQRNHVOHP-NRFANRHFSA-N 398.934 5.797 30 20 GKED CCOc1c(OC)cc(/C=C\C(=O)c2ccccc2C(F)(F)F)cc1OC 206875876 FYISQMYOWTZBBG-KTKRTIGZSA-N 380.362 5.017 30 20 GKED N#Cc1cccc(CNCc2ccc(-c3ccccc3Br)s2)c1 236590343 NVIVOPCUXJNWHF-UHFFFAOYSA-N 383.314 5.339 30 20 GKED N#Cc1ccnc(Oc2cc(Br)cc(C(F)(F)F)c2)c1Cl 314096734 DHOFROMBQQKKTK-UHFFFAOYSA-N 377.547 5.180 30 20 GKED O/C(=N/[C@H]1CCOC2(CCCCC2)C1)c1cc(-c2ccccn2)ccc1Cl 328717428 FHXMSEBUDSBDPW-KRWDZBQOSA-N 384.907 5.589 30 20 GKED Cc1cc(CN2CCC[C@@H](c3n[nH]cc3N=C(O)C3CCCC3)C2)c(C)s1 329375219 KSJAKGFSHKKXRD-QGZVFWFLSA-N 386.565 5.246 30 20 GKED CC(C)c1nc([C@H]2CCCCN2CC(O)=Nc2c(Cl)cccc2Cl)n[nH]1 329808946 BXIHAWXMWKIPHH-CQSZACIVSA-N 396.322 5.050 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1nccs1)c1ccc(C(F)(F)F)cc1 413405707 PTLPWUHTQWLSRB-WFASDCNBSA-N 383.439 5.230 30 20 GKED CC[C@H](NC(=O)N(C)[C@H](C)c1cccc(C#N)c1)c1ccccc1OC(F)F 425427364 SMTJJGVVYDCZPQ-KDOFPFPSSA-N 387.430 5.013 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 426058684 FNUGNTULVOQGDH-QGZVFWFLSA-N 387.936 5.271 30 20 GKED N#CCSc1cccc(C(=O)Nc2cc(F)ccc2Oc2ccccc2)c1 429814904 XXHJWERCICNROI-UHFFFAOYSA-N 378.428 5.486 30 20 GKED C[C@H](NC(=O)CN[C@H](CCCC#N)c1ccccc1)c1cccc2ccccc12 433017286 YCTYGQNJPRYLMZ-YADARESESA-N 385.511 5.042 30 20 GKED Cc1ccccc1[C@@H](CC(F)(F)F)NC(=O)Nc1cc(C#N)cn1C(C)(C)C 433835409 GXRFPUXWUVLXSQ-MRXNPFEDSA-N 392.425 5.238 30 20 GKED COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(C#N)cs2)cc1 437307824 OBQCNQRLKWHKFE-UHFFFAOYSA-N 384.844 5.326 30 20 GKED CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 438066812 RPLILLDHUMVBOU-AZUAARDMSA-N 395.572 5.732 30 20 GKED Cc1nc(-c2ccccc2)ccc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443883374 VOAUYQQNHMDULS-UHFFFAOYSA-N 381.357 5.200 30 20 GKED C[C@@H]1CC[C@@H](CCC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)O1 443893431 DIHWSHNMCMURAW-UZLBHIALSA-N 382.891 5.093 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)ccc1C 447474901 XRQMVIONSDKYEG-UHFFFAOYSA-N 398.462 5.209 30 20 GKED C=C(C)Cn1c(COc2ccc(C)cc2)nnc1N1CCC[C@@H]1c1cccs1 460549243 PUKHBJOJCIZQQK-LJQANCHMSA-N 394.544 5.145 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2ccnn2[C@H](C)C2CC2)cc1 464930771 TYKCPZXJXSRSQV-MRXNPFEDSA-N 386.455 5.079 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)ccc1Cl 468924250 JYMWTILKGCAFID-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C=CCCOCCCCC(=O)N1CCCCC[C@@H]1c1ccc(C(F)(F)F)cc1 471335268 HGIRSSLFNRXICJ-HXUWFJFHSA-N 397.481 5.912 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)c3cn(CCCC#N)c4ccccc34)C2)c(C)c1 473528928 IDUHOUSODHLFSX-FQEVSTJZSA-N 385.511 5.192 30 20 GKED CCOc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)cs2)cc1 474434324 SLAQJITVKMMPTL-OAHLLOKOSA-N 397.525 5.279 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccccc1-c1ccccc1 476118985 OYWRLVHESPJPSE-UHFFFAOYSA-N 385.507 6.223 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(CCC#N)CC(C)(C)C 477777314 OPQAWABLFPBSEP-UHFFFAOYSA-N 375.925 5.174 30 20 GKED CCc1c(C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cnn1C(CC)CC 482580220 QBVMAPNZBDRTOX-CQSZACIVSA-N 399.445 5.041 30 20 GKED CCC1(CC)[C@@H](N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)C[C@H]1OC 483332451 VEYLGYPQDQFNEC-AYOQOUSVSA-N 389.565 5.138 30 20 GKED Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)C[C@H](CC#N)c1ccccc1 483438147 BGBNOXKFVMNSJB-SFHVURJKSA-N 388.471 5.195 30 20 GKED N#C[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)c1ccc(Cl)c(Cl)c1 486436858 UGSAJUCZECWPKX-GIPNMCIBSA-N 385.703 5.193 30 20 GKED Cc1cccc(-c2nc(CC(=O)N[C@H](CCCC#N)c3ccccc3)cs2)c1 487220298 OZDCDCUTTLWAPK-OAQYLSRUSA-N 389.524 5.212 30 20 GKED C=CC[C@H](C(=O)Nc1nc(-c2cc(OC)ccc2OC)cs1)c1ccccc1 487616009 KQPMWRDLWOXAQT-KRWDZBQOSA-N 394.496 5.126 30 20 GKED Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 488323224 IIFDDOKBHNFLMV-WSTZPKSXSA-N 393.556 5.799 30 20 GKED Cc1ccccc1[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)C1CC1 489105817 OYGUBXWDLSQHSD-AREMUKBSSA-N 382.507 5.687 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N[C@H]1C[C@H]1c1cccc(F)c1 499271461 HWHVHCUMWLGPGO-PMACEKPBSA-N 388.467 5.134 30 20 GKED COc1ccc(-c2cc(C(=O)N[C@H](C#N)c3ccccc3Cl)sc2C)cc1 499946088 AEJJAMSXQJSVET-LJQANCHMSA-N 396.899 5.380 30 20 GKED COc1ccc(CN[C@@]2(c3ccc(Cl)cc3)C[C@H]2C)cc1OCCCC#N 500429921 UNEQTQPIMYUTHX-ZHRRBRCNSA-N 384.907 5.056 30 20 GKED N#C[C@@H](NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1)C1CC1 505916475 CZGCGBRJLGTSHN-GOSISDBHSA-N 396.899 5.410 30 20 GKED CCSc1ccc([C@@H](C)NC(=O)Nc2cc(C#N)ccc2OC(F)F)cc1 509932523 YDJWIHFELUXQCQ-GFCCVEGCSA-N 391.443 5.154 30 20 GKED C[C@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(C#N)cc1F 512622575 BEUDKAFBZMPYST-SFHVURJKSA-N 387.502 5.277 30 20 GKED O=C(c1cc(C(F)(F)F)ccc1F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 513538009 GEKTZRLXCBQOSO-ZDUSSCGKSA-N 383.307 5.039 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3SC[C@H](C)C#N)s2)o1 514224110 XSGPRHVFEWYCHA-CYBMUJFWSA-N 382.510 5.821 30 20 GKED C=CCc1ccc(OCc2nnc(-c3ccc(Cl)cc3Cl)o2)c(OC)c1 516375983 KFIYYXRTZAXPIE-UHFFFAOYSA-N 391.254 5.360 30 20 GKED N#C[C@H](NC(=O)Cc1csc2ccccc12)c1ccc(Cl)c(Cl)c1 521886138 MHOVDHCCGFZKGZ-INIZCTEOSA-N 375.280 5.132 30 20 GKED CCc1nc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)sc1C 521951908 XEVMITWPWXTFMI-UHFFFAOYSA-N 377.469 5.125 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C)cc1NC(=O)Nc1cccc(C#N)c1 524975823 WKRXZWHDGPOAEG-UHFFFAOYSA-N 399.429 5.204 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc(F)c(F)c1 525158043 JQZSQTHVVJJOCP-AWEZNQCLSA-N 378.378 5.371 30 20 GKED C[C@H](NCc1cc(Br)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 533909847 OJTXEIFRRWKVSR-NSHDSACASA-N 383.211 5.190 30 20 GKED C[C@@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1ccc(-c2ccc(F)cc2)cc1 537724581 DBNLEKWWMXVBAN-QGZVFWFLSA-N 387.458 5.267 30 20 GKED N#Cc1ccccc1OC1CCC(N[C@@H](C[C@@H]2CCOC2)c2ccccc2)CC1 537977430 HNFFIMNQMMSSHO-LTKAXEJJSA-N 390.527 5.006 30 20 GKED C=CCCC[C@H](C)NC(=O)Cc1csc(-c2cc(Br)cs2)n1 538332220 CYCMRLXIPHSNJC-NSHDSACASA-N 399.379 5.038 30 20 GKED O=C(N[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1c(F)cccc1F 539525673 XACJVJASBQDRBN-CYBMUJFWSA-N 383.238 5.017 30 20 GKED C[C@@H](Nc1cnn(CC(F)F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 539689378 XYHJALRRRZZJNE-MRVPVSSYSA-N 387.274 5.359 30 20 GKED COc1ccc(C#N)cc1CN[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1 542576109 XJLQDOHJCXMQJA-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED COC1(c2noc(-c3cccc(Oc4cccc(Cl)c4C#N)c3)n2)CCC1 545813223 NRAAEZMQCCUQAQ-UHFFFAOYSA-N 381.819 5.080 30 20 GKED CC(C)C[C@H](NCc1cnc2ccc(C#N)cn12)c1cccc(C(F)(F)F)c1 551530723 VWUDWCQMIWVFLG-IBGZPJMESA-N 386.421 5.102 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)CCc1cc2ccccc2o1 551699790 JUHZYZNIAJLIIS-UHFFFAOYSA-N 380.447 5.470 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)c1 560592338 XCJOMEOFOPQSMB-UHFFFAOYSA-N 384.769 5.534 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1c(-c2ccccc2Cl)noc1C 561583280 BPHLLROAJPNRBK-UHFFFAOYSA-N 391.858 5.004 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Oc2cccnc2)cc1 561818542 DCOQGFAZZWKUOX-UHFFFAOYSA-N 386.455 5.188 30 20 GKED N#CCCCn1cc(-c2nc(-c3cccc4cnccc34)no2)c2ccccc21 573406655 QGKDQWAZEVTXIT-UHFFFAOYSA-N 379.423 5.210 30 20 GKED N#CCCCCCC(=O)N[C@H]1CCCCC[C@@H]1c1ccccc1C(F)(F)F 588162883 OKRTWRZPUXDFSD-MJGOQNOKSA-N 380.454 5.712 30 20 GKED N#CC1(CC(=O)N(Cc2ccccc2)c2nc3ccc(Cl)cc3s2)CC1 590975503 ILODYDCDXVZOOO-UHFFFAOYSA-N 381.888 5.177 30 20 GKED CC(C)CCOc1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 592974696 XFMJOXKDOQLCSA-QGZVFWFLSA-N 382.460 5.350 30 20 GKED CCN(C(=O)Nc1ccc(CC#N)cc1)[C@H](C)Cc1ccc(C(F)(F)F)cc1 596659198 UVQQVACXVUVQQV-OAHLLOKOSA-N 389.421 5.256 30 20 GKED N#CC1(CC(=O)Nc2csnc2-c2cccc(C(F)(F)F)c2)CCCCC1 598846526 YFUUJZYVHYQRLA-UHFFFAOYSA-N 393.434 5.632 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)[C@@H]1C[C@H]1c1ccsc1 599391353 YNJCHEVYGUXVIN-UONOGXRCSA-N 396.459 5.515 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1sc(C(C)C)nc1C 603738942 LAHKXCVOYMLTEJ-UHFFFAOYSA-N 392.484 5.195 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cn2)cc1 603764637 LHOVTAAHBUHSSA-UHFFFAOYSA-N 383.329 5.017 30 20 GKED COc1ccc(S[C@H](C)C(=O)Nc2sc(-c3ccccc3)cc2C#N)cc1 603969746 BJTDZSZBVDFTTI-CQSZACIVSA-N 394.521 5.415 30 20 GKED CC(C)(C)C[C@@H]1CCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 604509988 SMKRYBMBNDROPN-SFHVURJKSA-N 378.476 5.178 30 20 GKED Cc1ccc2c(c1)N(C(=O)c1cccc(COc3ccc(C#N)cc3)c1)CCC2 609644251 CIFJKVDAYJINEZ-UHFFFAOYSA-N 382.463 5.039 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC2CCCCC2)cc1 609786574 UMHDJKFJTCQBDL-KRWDZBQOSA-N 394.540 6.045 30 20 GKED C[C@@H](SCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccc(C#N)cc1 609825234 LWLXYPACXGBNLE-GFCCVEGCSA-N 389.402 5.621 30 20 GKED Cc1ccc(C[C@@H](C)N(C)C(=O)c2cccc(COc3cccc(C#N)c3)c2)cc1 609982359 QPWFAHMHQVVJBF-HXUWFJFHSA-N 398.506 5.149 30 20 GKED CCSCc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 610178976 HBBIRHVVVAHELC-UHFFFAOYSA-N 392.480 5.236 30 20 GKED CCOC(=O)c1sc(NC(=O)C2CCC(c3ccccc3)CC2)c(C#N)c1C 610387779 SBABAZYEGQQCPC-UHFFFAOYSA-N 396.512 5.017 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CC1CCN(CC(F)(F)F)CC1 635843705 CUCPJWYPGYPBQV-UHFFFAOYSA-N 382.470 5.141 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H](C)n1cc(Br)cn1 648368505 URQVTCYRKHLPQV-AWEZNQCLSA-N 390.325 5.087 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)Nc2cccc(C(C)(F)F)c2)c1C(F)F 682012777 QNZCZEZYJQYCKC-UHFFFAOYSA-N 397.294 5.223 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2Cl)c(Cl)c1C=NNC1CCCC1 727652553 RXCCQIIHLAXXHS-UHFFFAOYSA-N 385.726 5.066 30 20 GKED CC[C@@H](c1ccccc1)c1nnc(SCCCOc2ccc(C#N)cc2)o1 727690610 LARCEBXDNURYDJ-IBGZPJMESA-N 379.485 5.044 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730417781 SOCCOMABHNMDGR-DYVFJYSZSA-N 396.487 5.377 30 20 GKED Cc1ccc(-c2ccc(/C=C\C(=O)c3ccc(C(F)(F)F)nc3O)s2)cc1 731564459 FWLNPLALRDUVJW-TWGQIWQCSA-N 389.398 5.739 30 20 GKED C#CCOc1cccc(NC(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)c1 733632498 BNBUSGRJYVYNFJ-GOSISDBHSA-N 385.467 5.516 30 20 GKED C[C@@H]1CCCC[C@H]1OCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 733679244 DSWOKLKHABCRPB-ACWOFJMJSA-N 388.920 5.235 30 20 GKED C=CC[C@H](NC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccncc1 734237246 MDIRYWIJIQHHHG-QHCPKHFHSA-N 398.462 5.454 30 20 GKED COc1ccc([C@@H](C)CC(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1 750685968 AJKWTHSGUNTWSD-JXFKEZNVSA-N 390.508 5.497 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)COc2c(Cl)ccc(Cl)c21 753145102 VHPAXTDNNRRKAI-XFFZJAGNSA-N 389.263 5.171 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1 755754903 BXDUYNBOHIRGPU-QFWMQHCXSA-N 396.494 5.352 30 20 GKED N#CC(CCOC(=O)c1scnc1C1CC1)(c1ccccc1)c1ccccc1 760688755 HPMQYZULHFXCSI-UHFFFAOYSA-N 388.492 5.077 30 20 GKED CC(C)c1ccc([C@H](C)NN=Cc2c(F)ccc(C3OCCO3)c2Cl)cc1 761782287 LUPFDTGVXMHRTE-AWEZNQCLSA-N 390.886 5.333 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@H]2c2ccc(Br)cc2)cc1 768936708 MSPWBXJJDPRZKB-QRWLVFNGSA-N 385.305 5.077 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H]2CCCOc3c(C(C)C)cccc32)c1 772983737 KLNWVVNURJXFBS-XXBNENTESA-N 378.516 5.494 30 20 GKED CSc1cccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C 775306189 UYYNSCISQLGMKL-HXUWFJFHSA-N 387.508 6.016 30 20 GKED C[C@H](NCc1ccccc1Oc1cccc(F)c1)c1ccc(OCC#N)cc1 776159659 ZALBVTDINMNRNJ-KRWDZBQOSA-N 376.431 5.371 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(OCC#N)cc1 777220916 CTCCHRBAEWVKSI-MRXNPFEDSA-N 393.487 5.060 30 20 GKED CCCCCN(Cc1ccc(F)cc1)C(=O)Nc1ccccc1O[C@H](C)C#N 780677432 JLDJTQYKPOTOHK-QGZVFWFLSA-N 383.467 5.341 30 20 GKED Cc1noc(C(F)(F)F)c1C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 782488487 WFOTZHRWQXHDGN-LBPRGKRZSA-N 399.372 5.032 30 20 GKED C=C[C@](C)(CC)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 785761055 HGZGKVWVXXLJOG-JDNHERCYSA-N 378.683 5.119 30 20 GKED FC(F)(F)c1nc(Cl)ccc1CON=Cc1ccccc1Br 786735058 SECOITFCDOGYDO-UHFFFAOYSA-N 393.590 5.067 30 20 GKED CC(=Nn1cnnc1SCc1ccc(Cl)cc1)c1csc(Cl)c1 787152673 KIERYGGCGRWTAO-UHFFFAOYSA-N 383.329 5.211 30 20 GKED C=CC[C@@H](NC(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1ccncc1 788863326 IKBXKPNMMSTFGQ-QGZVFWFLSA-N 386.373 5.408 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792100658 LXBQJMIGELOIKQ-LIRRHRJNSA-N 382.385 5.309 30 20 GKED C[C@@H](OC(=O)C[C@H](CC#N)c1ccccc1)c1nc(-c2ccc(Cl)cc2)no1 795984621 UOWZBHXEPYFLHD-PBHICJAKSA-N 395.846 5.082 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1CNCC1CCC(C#N)CC1 799343545 JAOHEBWUEYCQSP-UHFFFAOYSA-N 384.955 5.128 30 20 GKED CC(C)c1scnc1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 808915129 SCCWVDWBGMHSRZ-UHFFFAOYSA-N 382.514 5.188 30 20 GKED C#C[C@H](NC(=O)N(C)[C@@H](C)c1sc(C(C)C)nc1C)c1ccc(Cl)cc1 811961936 HPFTUTDIUNKPKB-YOEHRIQHSA-N 389.952 5.305 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)c(F)cc1O 815635932 MDWPGTZPFDDGJD-ACJLOTCBSA-N 391.284 5.380 30 20 GKED CC(C)(C)c1cccc(C(=O)[C@@H](C#N)C(=O)c2sccc2Br)c1 847736775 DDJVWOHLIDEXDD-CYBMUJFWSA-N 390.302 5.013 30 20 GKED C[C@@H](OC(=O)CC1(C#N)CCCCC1)c1ccccc1NC(=O)c1ccccc1 850800616 HHIGFFWSPHXYMM-GOSISDBHSA-N 390.483 5.407 30 20 GKED CNC(=O)c1ccc(/C=C(\C(=O)c2nc3ccccc3s2)c2ccccc2)cc1 912859217 HGSPEUGRKXURCJ-CYVLTUHYSA-N 398.487 5.079 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)c4cccc(C#N)c4)c23)cc1 915951361 BCRJQGZKPRXQMY-UHFFFAOYSA-N 399.479 5.075 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1cc(F)ccc1F 916135051 ZZKKIWWQFYXASH-DHZHZOJOSA-N 387.389 5.109 30 20 GKED CC(=NNc1ncc(C(F)(F)F)cc1Cl)c1cccc(OC(F)F)c1 916286669 NQVGEQNYNDSDPI-UHFFFAOYSA-N 379.716 5.191 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)CC(C)(C)C 920805637 DXJWIFBHRYDWMP-QWHCGFSZSA-N 376.472 5.727 30 20 GKED Cc1c(NN=C(Cc2ccc(F)cc2Cl)c2ccoc2)cccc1C(=O)O 1776088323 DTTZEXFQNFDZLB-UHFFFAOYSA-N 386.810 5.138 30 20 GKED O=C1/C(=C\c2cccc(Oc3ccc(F)cc3)c2)C[C@@H](C(=O)O)c2ccccc21 1777698319 DVBYRNAPHODGDQ-MCZSENPKSA-N 388.394 5.456 30 20 GKED N#Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc(Cl)ccc1-2 1857775991 OIYSQBOMHQEJHM-UHFFFAOYSA-N 391.857 6.680 30 20 GKED Cc1cc(C)c(NC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)c(Cl)c1 5406484 YWLFWTIOLXDHCQ-UHFFFAOYSA-N 390.870 5.513 30 20 GKED N#Cc1ccc(COC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)c(F)c1 11226791 WQIHWPBQZGVGRF-VCHYOVAHSA-N 381.403 5.182 30 20 GKED C=CCN(C(=O)CCCOCc1ccccc1)c1nc(-c2ccccc2)cs1 64869824 OKKDUNZOSHZJCJ-UHFFFAOYSA-N 392.524 5.326 30 20 GKED Cc1nc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)oc1C 65817965 GZSPOYOSQYUSJC-UHFFFAOYSA-N 382.807 5.253 30 20 GKED Cc1ccc(F)c(N/C(S)=C(/C(=O)c2cc(C)ccc2C)[n+]2ccccc2)c1 65940424 VHLNMOFDAGZHRP-UHFFFAOYSA-O 393.507 5.089 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CCOc2ccccc21 102852672 PDHYWQGQVOXPME-NRFANRHFSA-N 384.435 5.164 30 20 GKED N#C[C@@H](C(=O)Cc1coc(-c2cccs2)n1)c1nc2cc(Cl)ccc2s1 106353871 PNIPZPNPNRPCAZ-LBPRGKRZSA-N 399.884 5.085 30 20 GKED N#CCCSc1ccccc1NCC(=O)Nc1ccccc1SC(F)F 108352511 SYYPDGVTUYACOE-UHFFFAOYSA-N 393.484 5.058 30 20 GKED N#CCCN(Cc1ccco1)C(=O)Nc1cccc(Cl)c1SC(F)F 123893669 MUAMBPABEQGOLG-UHFFFAOYSA-N 385.823 5.195 30 20 GKED N#C[C@@H](C(=O)Nc1cccc2ccccc12)C(=O)c1cc2cc(Cl)ccc2o1 128792309 SGJVXBAFEWVJEX-QGZVFWFLSA-N 388.810 5.201 30 20 GKED N#CCCSc1ccccc1NCc1nc(-c2ccccc2Cl)cs1 184446427 GBTOJIDNAVAUMO-UHFFFAOYSA-N 385.945 6.081 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(O)ccc3C(F)(F)F)cc2)c1 193205912 AYHARZIUCWZIQL-UHFFFAOYSA-N 398.340 5.327 30 20 GKED CC(C)(C)c1cnc(CCC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)o1 193627406 RZWJETHKMPKSBK-UHFFFAOYSA-N 389.455 5.207 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-n4cccc4)cc3)n2)cc1 197485681 IPSCSLWLRFOCFZ-HXUWFJFHSA-N 383.476 5.399 30 20 GKED CCOCc1cc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)ccc1OC 210431181 HCGLWWHKJJURLL-QPEQYQDCSA-N 379.500 5.118 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C1CCC(NC(=O)C(C)(C)C)CC1 279699884 JHCIDQLYDLXUKY-UHFFFAOYSA-N 384.564 5.198 30 20 GKED OC1=N[C@H](C/C(O)=N/[C@@H](c2ccc(Br)cc2)C2CCC2)CCC1 329321152 GQOMZHCMOHUUHL-MAUKXSAKSA-N 379.298 5.146 30 20 GKED N#CC1(/C(O)=N/[C@@H]2CCCc3c2[nH]c2ccc(Br)cc32)CCCC1 329751586 IZJCHFKHSWVNMF-MRXNPFEDSA-N 386.293 5.348 30 20 GKED CCC(C)(C)/N=C(/O)c1ccc(NC(=O)[C@@H]2CCCC(F)(F)C2)cc1Cl 330416975 VLBQXAKHJXLSMB-GFCCVEGCSA-N 386.870 5.597 30 20 GKED Cc1cc(C)c(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)c(Br)c1 425647805 AKIBOUOXGUTTET-AWEZNQCLSA-N 386.293 5.163 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(Oc3ccccc3)ccn2)s1 430614248 YTVNWTNPYJNEDK-MRXNPFEDSA-N 377.469 5.118 30 20 GKED Cc1ccccc1Nc1nc(CN[C@@H](CCCC#N)c2ccccc2)cs1 433013155 NLROGXBMFVEPMI-NRFANRHFSA-N 376.529 5.720 30 20 GKED Cc1csc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 435503663 ZCYWNVIJVJSYRB-UHFFFAOYSA-N 397.887 5.340 30 20 GKED Cc1cc(N(CCC#N)C(=O)CNc2cccc(C(C)(F)F)c2)ccc1Cl 435897463 KEUMFQHJICBWQT-UHFFFAOYSA-N 391.849 5.119 30 20 GKED C=CCc1cc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc(OC)c1O 436943096 YKSJXNMUOVMWPR-KGENOOAVSA-N 388.423 5.021 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2ccc(F)c(F)c2)cc1F 438652667 VQNWULFMPQCHTB-UHFFFAOYSA-N 397.356 5.090 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc2c(c1)CC[C@@H]2N(C)C 455850281 KQRHMMKUZQPAAY-SFHVURJKSA-N 389.952 5.171 30 20 GKED CCc1ccc(CN(C(=O)N[C@H](CCCC#N)c2ccccc2)C2CC2)cc1 458797766 GTMVQYHAOWGEDN-HSZRJFAPSA-N 375.516 5.358 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 463743910 IUGYKWOZFTUQJO-KZULUSFZSA-N 379.262 5.082 30 20 GKED CC(C)(C)[C@H](C#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 464711843 PLXWTROITMUWPD-IBGZPJMESA-N 396.874 5.333 30 20 GKED Cc1c(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)n(C)c2ccccc12 471279847 YEVNOHCHMCSYFJ-OAHLLOKOSA-N 392.528 5.060 30 20 GKED N#CCCn1cc(CN[C@@H]2CC[C@H](c3cccc(F)c3)C2)c(-c2ccccc2)n1 475575271 ZOCUHTSZTLCMIW-NZQKXSOJSA-N 388.490 5.029 30 20 GKED N#CC[C@@H](CC(=O)N1CCc2ccccc2[C@@H]1c1ccccc1)c1ccccc1 475763221 PQMUBRBFKWUMPH-OZXSUGGESA-N 380.491 5.248 30 20 GKED Cn1c(SCCCC(C)(C)C#N)nc2scc(-c3ccccc3)c2c1=O 476464215 XTBBQPFSKMZYBG-UHFFFAOYSA-N 383.542 5.084 30 20 GKED CC(C)CN(C(=O)c1ccc(C(C)(C)C#N)cc1)[C@H]1CCCc2cccnc21 476814247 IGCALKPPTAXWIQ-NRFANRHFSA-N 375.516 5.059 30 20 GKED C=C(C)CN(C)C(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 479323100 YETBFBABQZVYFV-UHFFFAOYSA-N 383.542 5.107 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1c(C)cccc1OC(F)F 480604519 AQJKDLNWQLWHGZ-UHFFFAOYSA-N 386.851 5.531 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1ccc(F)cc1C(F)(F)F 480605700 GFJFTACLRGFMQM-UHFFFAOYSA-N 392.805 5.780 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)CSc1ccc(C#N)cc1 482520061 RTVJMNSZZGPRQJ-QGZVFWFLSA-N 392.549 5.502 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cc(-c2nc(CC)no2)ccc1C 485462787 OEEGBNIIVKVTKQ-UHFFFAOYSA-N 379.485 5.138 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2)Cc2ccccc2F)cc1 486040166 CQURNTSPDLDCKD-UHFFFAOYSA-N 390.483 5.018 30 20 GKED CCOc1ccccc1CN(C)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 486672097 AWKXFMPHJLLUKA-UHFFFAOYSA-N 386.451 5.021 30 20 GKED COc1ccc(-c2csc3ncnc(Oc4ccc(C#N)cc4F)c23)cc1 486919729 IYRIVGSXRJNSGA-UHFFFAOYSA-N 377.400 5.170 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1cc(Cl)sc1Cl)c1ccccc1 487575599 PJJYTMFTEVXXOI-INIZCTEOSA-N 395.355 5.929 30 20 GKED C[C@H](Cc1ccsc1)NC(=O)c1ccccc1Sc1ccccc1C#N 516130478 IQSPLACMODKMCS-OAHLLOKOSA-N 378.522 5.132 30 20 GKED Cc1ccc([C@H](C)NC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 518029015 AZDPSOMDZKQZEH-SFHVURJKSA-N 386.520 5.650 30 20 GKED C[C@@H](N[C@@H](c1ccc(Cl)cc1)C1C[C@@H]2CC[C@H](C1)N2C)c1cccc(C#N)c1 519546085 AYGNWFORTKAJPU-XYJBZRSYSA-N 393.962 5.476 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)Nc1ccccc1S[C@H](C)CC#N 520941362 LIGSZTLHGXRUHA-SJLPKXTDSA-N 397.544 5.752 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c1 521497229 DYWNSJVDTGPQFZ-UHFFFAOYSA-N 397.356 5.211 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1 523111300 KPIHZQIRASATFF-MRXNPFEDSA-N 388.433 5.194 30 20 GKED Cc1ccc([C@H](NC(=O)CSc2ccc(C#N)cc2F)c2cccs2)cc1 525503552 BLSRLZKFPREZNA-NRFANRHFSA-N 396.512 5.065 30 20 GKED N#Cc1cccc(-c2nnc(CSCc3c(Cl)cccc3Cl)o2)c1 525630494 VPWFNGPTRKEWTF-UHFFFAOYSA-N 376.268 5.348 30 20 GKED N#CCC[C@@H](NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 532670028 QAWRTVNBXANDEW-QGZVFWFLSA-N 386.339 5.859 30 20 GKED COCCOc1ccc(C#N)cc1N[C@@H](C)c1csc(-c2csc(C)n2)c1 541556957 DTXUCVVLFFNEQO-ZDUSSCGKSA-N 399.541 5.250 30 20 GKED Cc1ccc(NC(=O)CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C)c1 543872463 UCXFDIJXURIXLT-LJQANCHMSA-N 383.495 5.131 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1Cc2ccccc2C(C)(C)C1 551192983 MMLFYTSJWJNYGC-MRXNPFEDSA-N 379.529 5.406 30 20 GKED N#CCCC[C@H](NCc1ccc(Br)c2cccnc12)c1ccccc1 552313043 IMXFQMNKDILNHT-FQEVSTJZSA-N 394.316 5.522 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCSc1cccc(Cl)c1 554713676 DKYDRNRVKUOFCI-CQSZACIVSA-N 390.961 5.713 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cn(C2CCCC2)nc1-c1ccccn1 557199969 NXIXVZSTHZFTIU-QHCPKHFHSA-N 397.526 5.099 30 20 GKED N#CC[C@@H](CC(=O)N1CC[C@@H](Sc2cccc(Cl)c2)C1)c1ccccc1 558115482 AIXRIRHESVNEAJ-FXAWDEMLSA-N 384.932 5.121 30 20 GKED CCO[C@H](CC(=O)Nc1sc2c(c1C#N)-c1ccccc1OC2)C1=CCCC1 583917847 KTWDFEQMDOPGRD-GOSISDBHSA-N 394.496 5.023 30 20 GKED C=CCOCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 591123045 XYDCAYRHZXOGBT-QAPCUYQASA-N 394.902 5.059 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21 599737672 OTEXAHJNKDRFTP-WWIODWGFSA-N 397.931 5.052 30 20 GKED N#C[C@@H]1CCC[C@@]2(C1)Nc1ccccc1C(=O)N2c1ccc(Cl)c(Cl)c1 602754055 AXXOFDBSXCDHNJ-ZUOKHONESA-N 386.282 5.476 30 20 GKED CC(C)(C(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 608896065 KOOAZHJDIUZLAH-UHFFFAOYSA-N 390.405 5.304 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)c1ccc(C#N)cc1)C1CCCC1 609064874 QMZHOMATJLPHMM-UHFFFAOYSA-N 384.479 5.305 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(OC(C)(C)C)cc1 609435257 AZLPXNBTYAQBLM-INIZCTEOSA-N 397.544 5.580 30 20 GKED C[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)c1ccsc1 609969342 PHJOMXOWNAVOOR-CYBMUJFWSA-N 382.872 5.808 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)cn2)cc1 610094332 XJZJHNQLZIEKJH-SFTDATJTSA-N 382.423 5.169 30 20 GKED C[C@@H](NCc1cccc(NC(=O)c2ccccc2Cl)c1)c1cccc(C#N)c1 610345167 WBZSVXCPJVDLCB-MRXNPFEDSA-N 389.886 5.315 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@H](C)c1cccc(C#N)c1 610355327 OAVOWMNHYXSUMZ-OLZOCXBDSA-N 376.287 5.329 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCC(c4ccccn4)CC3)c2)cc1 611095331 RHNFBTMWBMTSNI-UHFFFAOYSA-N 398.466 5.157 30 20 GKED Cc1cc(C(F)F)oc1C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(F)(F)F 626408423 VCTAVOOQZYAFSI-LBPRGKRZSA-N 399.262 5.160 30 20 GKED CC(C)Oc1ccc(CNc2snc(Cl)c2C#N)c(C(F)(F)F)c1 726594037 FBFZLTSIEZYQJR-UHFFFAOYSA-N 375.803 5.086 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccccc2SCC#N)cc1)c1ccccc1 728026143 ORAVNOFLUHGJMN-QGZVFWFLSA-N 387.508 5.728 30 20 GKED COc1c(O)cccc1/C=C1\CCc2nc(-c3ccc(Cl)cc3)sc2C1=O 728438247 CTTKTDKRQJMEKI-ACCUITESSA-N 397.883 5.390 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)cc1 728698458 JYRHCZRDPKCVFR-HVOBPNNYSA-N 385.250 6.023 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 731971450 BFLNVHTXFRFYBP-QGZVFWFLSA-N 391.814 5.156 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1)c1ccncc1 734683551 NSJPRUNISFVEGX-SCLBCKFNSA-N 378.303 5.408 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)cc1 741537822 HTNFNCWIMHXBJV-QHAWAJNXSA-N 388.417 5.362 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3C[C@H]3c3cccc(F)c3F)n2)cc1 744034689 KDLYRVKBYINKOM-YESZJQIVSA-N 394.446 5.377 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)Sc2cc(Cl)ccc2Cl)n1 747199433 TVKFYLVLECZQKU-PWSUYJOCSA-N 399.368 5.930 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(Cl)sc2Cl)cc1OCCCC#N 747361487 PTTQTDJCPXMMEW-GQCTYLIASA-N 396.295 5.642 30 20 GKED C=CC[C@@H](NC(=O)[C@@H](C)Sc1ccnc2cc(Cl)ccc12)c1ccncc1 750002272 DMCZFDKDQOJCFK-RDTXWAMCSA-N 397.931 5.197 30 20 GKED CCCCCCCCNC(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 754866443 VBPAJVMUIMKWHC-BETUJISGSA-N 376.385 5.119 30 20 GKED Fc1ccc(C2OCCO2)c(Cl)c1C=NNc1cc(Cl)ccc1Cl 761809024 CESJUFPKNRUTJU-UHFFFAOYSA-N 389.641 5.277 30 20 GKED Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)CC2 776905286 ZIRZZJRDVIGIAU-RUZDIDTESA-N 395.506 5.549 30 20 GKED COc1ccc2oc(C)c(C(=O)N(CCC#N)C34CC5CC(CC(C5)C3)C4)c2c1 776911170 ZUZCKKQDMCARBA-UHFFFAOYSA-N 392.499 5.075 30 20 GKED C#CCCCCCC(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 779844990 CJABDQHEVNOBPA-UHFFFAOYSA-N 377.271 5.703 30 20 GKED C=C[C@](C)(CC)C(=O)OCc1csc(N(C(C)=O)c2ccc(C)c(C)c2)n1 785769296 POQOTBXSVNVMBL-OAQYLSRUSA-N 386.517 5.090 30 20 GKED COc1ccc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1OC1CCCC1 792976672 SAGRMWUFFLBSAH-SFHVURJKSA-N 378.472 5.043 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)O[C@@H](C)c2c(F)cccc2F)c1C(F)F 797059597 GJKJTBUFGPZUFD-ZETCQYMHSA-N 398.278 5.056 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(N3CCCCCC3)cc2)c1 801777098 SEAMJSONKQEAHB-UHFFFAOYSA-N 392.503 5.394 30 20 GKED Cc1ccc(CCC(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 810537244 QMZALCIANNZULC-CYBMUJFWSA-N 394.443 5.494 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@@H](C)OC(=O)CCCC#N 813030466 LEQHSSIJHKCMRF-GFCCVEGCSA-N 393.306 5.179 30 20 GKED O=C(/C(=C/c1cnn(CC(F)F)c1)c1ccccc1)c1nc2ccccc2s1 814187610 OAGNYDZYMSHOTH-MHWRWJLKSA-N 395.434 5.181 30 20 GKED C=C[C@@H](CC(=O)N[C@H](C)c1ccc(C(F)(F)F)nc1Cl)c1ccccc1 817861020 BGCSGLITNKUZPS-OLZOCXBDSA-N 382.813 5.291 30 20 GKED COc1ccc(CNC(C)(C)c2nc(-c3ccccc3F)c(C)s2)cc1C#N 824554291 DXSIWKLMXZDSLY-UHFFFAOYSA-N 395.503 5.163 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1)c1ccccc1 838604675 UYCPVESDNDWYEH-NHCUHLMSSA-N 383.442 5.246 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(Cl)c(C(=O)Nc2cccc(CC#N)c2)c1 863924647 HNBQKNHYIHDOQD-UHFFFAOYSA-N 385.851 5.005 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H](C(F)(F)F)C2)cc1 878218039 IQQYXBLMKCJBME-IEBWSBKVSA-N 387.405 5.148 30 20 GKED CC(=NOCc1nc(-c2cccs2)oc1C)c1ccc(NC(=O)C2CC2)cc1 914572285 MRAXUMLLZWWVGU-UHFFFAOYSA-N 395.484 5.001 30 20 GKED C[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nc2ccccc2[nH]1 915351385 AGVSTZHTCLYENJ-OXJNMPFZSA-N 395.466 5.101 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)o1 916681791 YVEIGDQITOTJCS-URZJWIJPSA-N 385.467 5.380 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)c1 920324974 SNZUVFSBALXRST-QGZVFWFLSA-N 378.497 5.339 30 20 GKED O=C(O)c1cc(NN=C2CCC[C@H]2c2ccc(Cl)c(Cl)c2)ccc1F 1776062244 KPBZNVIKIJFWNW-LBPRGKRZSA-N 381.234 5.566 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C\C(=O)c3ccccc3OC(F)F)cc2)cc1 1776120262 ZRBMQQKCYPRTSY-AUWJEWJLSA-N 394.373 5.549 30 20 GKED Cc1ccc(C(=O)/C=C\c2cccc(OCc3cccc(C(=O)O)c3)c2)c(C)c1 1776133156 OTRVLEJRXSCWEV-BENRWUELSA-N 386.447 5.477 30 20 GKED CCCCCCCSc1ccc(C(=O)NCc2cccc(C(=O)O)c2)cc1 1776787548 VSILXCIMZWAFKE-UHFFFAOYSA-N 385.529 5.377 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cc1 1777533310 MZCZIZKXCBHZNG-BENRWUELSA-N 398.418 5.035 30 20 GKED C[C@@H]1CCc2c(sc(NC(=O)c3ccc(SC(F)F)cc3)c2C#N)C1 10390884 YOSHRZPBUPTPMJ-SNVBAGLBSA-N 378.469 5.312 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(/S)Nc2c(C)cccc2C)[n+]2ccccc2)c1 11153530 CQUHJFWLOWMCSU-UHFFFAOYSA-O 389.544 5.259 30 20 GKED C=CCn1c(SCc2ccccn2)nc2scc(-c3cccs3)c2c1=O 12400169 LAWXAPDBEPIYJS-UHFFFAOYSA-N 397.550 5.060 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)CCCc2ccccc2)cc1 55823943 ZBAVIGQGXJYCPX-UHFFFAOYSA-N 384.479 5.293 30 20 GKED COc1ccc(/C=C/c2nc3cc([N+](=O)[O-])ccc3s2)cc1OCCCC#N 64367259 UKLBMUHOFOYCBG-WEVVVXLNSA-N 395.440 5.066 30 20 GKED CCCOCc1ccccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 66955729 XOINUHUSAVXWDK-KRWDZBQOSA-N 397.544 5.329 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2csc(-c3ccsc3)n2)cc1Cl 72031010 KBMYNLWPQPPDNM-ONEGZZNKSA-N 391.901 5.438 30 20 GKED Cc1csc([C@H](C#N)C(=O)[C@H](Sc2ccccc2F)c2ccccc2)n1 106353502 NNNOEUMOPMRESU-DNVCBOLYSA-N 382.485 5.301 30 20 GKED Cc1cc(NC(=O)/C=C/c2ccc(-c3ccccc3Cl)s2)n(CCC#N)n1 109345988 XXMJJMYCGKZWJM-CSKARUKUSA-N 396.903 5.139 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cc(Cl)ccc2Cl)ccc1OC 154691072 FBEPZOQVEZKYNY-BBRMVZONSA-N 393.314 5.534 30 20 GKED Cc1ccc(CCCC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)s1 176026211 UFZLBQJRRYABRO-GOSISDBHSA-N 391.521 5.251 30 20 GKED COc1cc(CNc2ccccc2O[C@@H](C)C#N)ccc1OCc1ccccc1 181132726 VGXSAUIMIDKJEX-SFHVURJKSA-N 388.467 5.177 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C[C@@H](O)c1cccs1 191420380 XSHGAGFDYZNFKL-AZUAARDMSA-N 398.572 5.720 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H](CC(=O)OC(C)C)C1 191435418 DMSNNYSWSAXOIL-SFHVURJKSA-N 386.536 5.124 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(CC)cc2)nnc1-c1ccccc1 252023373 ZVSMMPVDLSLGGI-INIZCTEOSA-N 377.513 5.057 30 20 GKED N#Cc1c(NC(=O)[C@H]2C[C@H]2c2ccc(C(F)(F)F)cc2)sc2c1CCCC2 253614370 ONIURCYEEAXGTE-GJZGRUSLSA-N 390.430 5.260 30 20 GKED O/C(=N/C1CCCCCC1)C1CCN(c2noc3ccc(Cl)cc23)CC1 328763191 ZWBMJQJPKQFXCM-UHFFFAOYSA-N 375.900 5.377 30 20 GKED CS(=O)(=O)c1ccc(C/N=C(/O)C2(C3CCCCC3)CCCCC2)cc1 328919322 AREOADQWQNIPFN-UHFFFAOYSA-N 377.550 5.077 30 20 GKED N#Cc1ccc(N2CCC[C@@H](c3n[nH]cc3N=C(O)C3CCCC3)C2)cc1Cl 330051775 OALUVRLDSSROPF-MRXNPFEDSA-N 397.910 5.097 30 20 GKED C[C@H](/N=C(/O)C1CCCCC1)C(O)=Nc1cccc(N=C(O)C2CCCCC2)c1 330213373 FJBZYTYSDDIBHK-INIZCTEOSA-N 399.535 6.368 30 20 GKED C[C@@H](NCc1cnc([C@@H]2CCCO2)s1)c1ccc(-c2cccc(C#N)c2)cc1 374696868 ZAPDKCHSMMGKOZ-ZHRRBRCNSA-N 389.524 5.384 30 20 GKED N#CCc1cc(Cl)ccc1NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2 410974248 XEDIQWHNMNLYCY-NFAYLAGKSA-N 396.840 5.493 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2cc(F)ccc2Br)s1 411005785 HEOWZTMDXMMANF-UHFFFAOYSA-N 381.270 5.071 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)N[C@H]1CCCc2cc(C#N)ccc21 419647671 QZXFPPKLTPKEPJ-KXBFYZLASA-N 396.560 5.227 30 20 GKED CO[C@@H](c1noc(-c2sc3ccc(C#N)cc3c2C)n1)c1ccccc1Cl 426452093 WRVRZVDHWRKXJP-QGZVFWFLSA-N 395.871 5.521 30 20 GKED CCO[C@@H](c1ccccc1)c1noc(-c2sc3ccc(C#N)cc3c2C)n1 426620822 RUFJNRUKJQDZEU-SFHVURJKSA-N 375.453 5.257 30 20 GKED CC(C)(NCc1cc(F)c(C(F)(F)F)cc1F)c1cc(C(F)(F)F)on1 429233908 FGDZOEQUTQYTKN-UHFFFAOYSA-N 388.258 5.015 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC4(CCCC4)C3)cc2Cl)c1 429434145 RSNUKAUQIVQDPW-UHFFFAOYSA-N 395.890 5.199 30 20 GKED Cc1ccc(-c2ccc(C)c(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)c2)o1 432978867 LBIUYOHGXJDBTI-UHFFFAOYSA-N 397.478 5.756 30 20 GKED CC(C)Oc1ccc([C@H](C)NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 436163112 QAEYSRSWWUEIGY-SFHVURJKSA-N 389.499 5.223 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1 437906814 SCSOCASGKIXODJ-NRFANRHFSA-N 381.495 5.358 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ncc(-c2ccccc2)o1 439674839 QKTLLKANNOHAAO-MRXNPFEDSA-N 399.425 6.318 30 20 GKED N#Cc1c(SCc2nc(C3CCCC3)no2)nc2c(c1-c1ccco1)CCC2 443441933 GOAXTIRDOCNWMR-UHFFFAOYSA-N 392.484 5.035 30 20 GKED C[C@H](CN(C)CCC(C#N)(c1ccccc1)c1ccccc1)c1nccs1 444690447 SPIXDVSQOYIRJA-LJQANCHMSA-N 375.541 5.078 30 20 GKED Cc1ccc([C@H]2CSCCN2C(=O)N[C@@H](CCCC#N)c2ccccc2)cc1 458798148 HHBGPQDOMFEEMC-FCHUYYIVSA-N 393.556 5.230 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)C2)cc1 458850465 UMWCNUJZNRACOR-VWNXMTODSA-N 375.516 5.103 30 20 GKED COCCN(C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1ccc(C#N)cc1 460365445 OHOLLMKROAXGRG-UHFFFAOYSA-N 396.899 5.233 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCCC4(CCCCCC4)C3)o2)cc1 464667787 WQAUXYYMTKJEJD-UHFFFAOYSA-N 392.499 5.307 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1cccc2cccnc12 466370043 JJRREWDNYBVDFW-UHFFFAOYSA-N 397.409 5.314 30 20 GKED CN(CC[C@@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 466410387 RCDRMOSFPATHOK-KRWDZBQOSA-N 399.878 5.037 30 20 GKED CC#CCCCC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 466870733 NWKYJQZPAQDFBN-UHFFFAOYSA-N 388.389 5.090 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1 467903894 LAQFFAHQPOBVBK-UHFFFAOYSA-N 393.531 5.054 30 20 GKED CC(C)c1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 468833092 DJHZDTGQLMVVEW-SFHVURJKSA-N 375.516 5.566 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H]3CC[C@@H](Cc4ccccc4)C3)ccc21 468971173 LJHZVBFXQJGICD-UNMCSNQZSA-N 387.527 5.093 30 20 GKED Cc1ccc(-c2ccncc2)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 469124945 ZFHSYISSMPIHJD-UHFFFAOYSA-N 394.478 5.568 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc2ccccc2c1 469321074 YXNYXDRFRJYMHL-SFHVURJKSA-N 383.495 5.596 30 20 GKED N#Cc1ccc(CNC(=O)N2CCCC[C@H]2c2cccc(C(F)(F)F)c2)cc1 470048076 VJAGJXKRFSZXTP-IBGZPJMESA-N 387.405 5.014 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2C[C@H](C)CC2(C)C)cc1 472722852 KZYYZJSPHXBPFL-OAHLLOKOSA-N 379.460 5.011 30 20 GKED N#Cc1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)cc1 474262047 AFVOSMJOJQPTAP-HNNXBMFYSA-N 386.295 5.001 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1nn(-c2ccc(F)cc2C)cc1O 476785706 DDDKPQSIURXGLL-UHFFFAOYSA-N 393.462 5.130 30 20 GKED C[C@@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccc(C#N)c(F)c1 480659504 MSFMWGPESRGFPP-CYBMUJFWSA-N 377.444 5.418 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1)c1ccc(F)c(F)c1 480659729 DMJMZSZKCATIHX-ZUOKHONESA-N 376.403 5.240 30 20 GKED C=C(C)[C@@H](NCc1nc(C)c(-c2ccc(Cl)cc2)o1)c1ccc(F)c(F)c1 481630479 WTPFRNFWQPPEND-HXUWFJFHSA-N 388.845 5.989 30 20 GKED CC(C)C(=O)Nc1cccc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1 482678212 KTYRWFFGHQIHRK-UHFFFAOYSA-N 399.450 5.197 30 20 GKED C=C(C)[C@@H](NC(=O)N(Cc1ccccc1)CC(F)F)c1ccc(F)c(F)c1 483313491 WYIGXGDHYVFAGD-LJQANCHMSA-N 380.385 5.059 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Cn2cnc3ccccc32)cc1 486243554 JYDPTIKSVMBUNR-UHFFFAOYSA-N 399.519 5.615 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 489033186 AZPWRJRREUODFZ-JOCHJYFZSA-N 381.541 5.397 30 20 GKED CC[C@@H](OC1CCCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 498079945 NMEYETDSQLBTKR-HXUWFJFHSA-N 394.471 5.035 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(C)(C)C)cc2)nnc1-c1ccncc1 499349193 JCACKAUWIILYFI-INIZCTEOSA-N 378.545 5.677 30 20 GKED C=CCN(CCc1ccccc1)C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 502592535 GGMIEGPBFWDEPV-SFHVURJKSA-N 391.540 5.311 30 20 GKED C=CCN(C(=O)c1ccoc1C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 502960214 BLIAAOPZDTXPKI-UHFFFAOYSA-N 393.295 5.851 30 20 GKED CC[C@H](C)Oc1cccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c1 503616973 WVJWWDRPIXKMCJ-KRWDZBQOSA-N 375.472 5.057 30 20 GKED Cc1ccc(NC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 505767649 UZJAWGVVXBYBSB-QGZVFWFLSA-N 381.888 5.326 30 20 GKED C=C(C)[C@H](NC(=O)Cc1c(C(C)=O)oc2cc(C)ccc12)c1ccc(F)c(F)c1 505899795 ATZHEWVULRIGJC-QFIPXVFZSA-N 397.421 5.198 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cccc(C(F)F)c2)cc1C 505989304 GWYMRMDCXJILSH-UHFFFAOYSA-N 394.425 5.271 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)CSc1ccc2ccccc2c1 509572657 CHULDISXIQPAOW-UHFFFAOYSA-N 376.481 5.229 30 20 GKED N#Cc1ccc(OCCNc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)cc1 511734103 LTOSOEFHDONAHM-UHFFFAOYSA-N 399.372 5.255 30 20 GKED C=CCOc1cccc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)c1 512789117 URNPZFYABJUQEN-UHFFFAOYSA-N 390.917 5.271 30 20 GKED N#Cc1ccc(N2CCC(N[C@H](c3ccccc3)c3cccc(F)c3)CC2)cc1 513673778 XCNHEPNCGSFCQY-RUZDIDTESA-N 385.486 5.045 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)Nc2cccc(C#N)c2)cc1F 518465634 UCEYYDRLSPCZQY-UHFFFAOYSA-N 377.375 5.142 30 20 GKED CCCc1ccc(C(=O)CCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 519423977 MFLOUPRCDCZIQV-QGZVFWFLSA-N 394.540 5.492 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2cc(C#N)ccc2OC(C)C)cc1C 520433559 JGCYEQVAQXLRLG-NRFANRHFSA-N 377.488 5.331 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2sccc2C#N)cc1 525534073 KGNRQVBEPWVIFK-HNNXBMFYSA-N 376.481 5.129 30 20 GKED N#Cc1cccc(CC(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c1 531155069 SZXSOESFJMHNRA-UHFFFAOYSA-N 394.308 5.231 30 20 GKED C=CCC[C@@H](NCc1nc(-c2ccco2)no1)c1ccc(C(F)(F)F)cc1 538230356 XOJDMCMSDNOKKM-OAHLLOKOSA-N 377.366 5.146 30 20 GKED CC(C)(C)c1cc(NC(=O)c2coc(-c3ccccc3Cl)n2)c(C#N)s1 538441566 YMTAJXIUFVXDES-UHFFFAOYSA-N 385.876 5.478 30 20 GKED Cn1c(-c2ccc(NC(=O)c3ccc(C4(C#N)CC4)cc3)cc2)nc2ccccc21 539617265 YRYSYCXSJLDQSC-UHFFFAOYSA-N 392.462 5.048 30 20 GKED Cc1ccccc1NC(=O)CCN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542014779 YSPCKDAUAOJEKH-LJQANCHMSA-N 383.495 5.213 30 20 GKED C[C@H](NCc1ncc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543870348 TZFGUAWGIQSHJA-SFHVURJKSA-N 379.463 5.731 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ncc(-c2ccccc2)o1 560949889 RTHYJJMCDSGGRN-SFHVURJKSA-N 379.463 5.731 30 20 GKED C=CCn1c(S[C@H](C)c2nccn2-c2ccccc2)nnc1-c1ccccc1 561441048 PGUZQDOTEVWXNS-QGZVFWFLSA-N 387.512 5.170 30 20 GKED CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1cn(CCCC#N)c2ccccc12 562468632 WHNALRVLMKGTMF-GOSISDBHSA-N 389.499 5.223 30 20 GKED Cc1csc(NC(=O)c2ccc3c(c2)nc(C(F)(F)F)n3C(C)C)c1C#N 563632288 ZCQAUZGIGVLCRT-UHFFFAOYSA-N 392.406 5.130 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(Cc2ccccn2)ccc1C 564588007 KCMHRXHIBRTJIQ-UHFFFAOYSA-N 377.513 5.262 30 20 GKED N#CCCC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccccc1 564718779 OBYCNZVOTGULHS-FQEVSTJZSA-N 375.428 5.380 30 20 GKED COc1ccc(C(=O)CCCCCC(=O)Nc2ccc(Cl)cc2CC#N)cc1 568763545 PRODEYMISIOFKG-UHFFFAOYSA-N 398.890 5.187 30 20 GKED N#CCCC1CCN(C(=O)c2oc3ccccc3c2COc2ccccc2)CC1 571089695 DQQFTPVVJXGVMN-UHFFFAOYSA-N 388.467 5.168 30 20 GKED C=C[C@@H](CC(=O)N(C)c1ncc2c(n1)-c1ccccc1SC2)c1ccccc1 571798936 AEYHTRVMPQDXLB-INIZCTEOSA-N 387.508 5.072 30 20 GKED Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)CCCCCC#N)sc2c1 588815002 DJYQHMPPFDBYFA-UHFFFAOYSA-N 391.540 5.920 30 20 GKED C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)CCCCCC#N 588869423 OWNDSSGLZVBKNQ-HZPDHXFCSA-N 389.927 5.156 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2SCc2ccco2)c1 589382756 ZUGKFPCTDFUBIE-UHFFFAOYSA-N 379.481 5.779 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccccc3OC(C)C)n2)cc1 592360819 MLJFURZPWOONTH-SFHVURJKSA-N 376.481 5.396 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC2(CC1)CC2(F)F 593148864 ICCYANCCYHERCR-UHFFFAOYSA-N 397.425 5.312 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)C1 598407162 HODBFACFINSBFC-KKFJTVDOSA-N 397.478 5.080 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1[C@@H]2Cc3c(Cl)cccc3[C@H]21 599390670 OOPVXDIYDNKNCI-DDAIWRKXSA-N 382.916 5.116 30 20 GKED N#Cc1c(NC(=O)[C@@H](Oc2ccccc2)c2ccccc2)sc2c1CCCC2 603727596 ARDSBUODQUSJGR-NRFANRHFSA-N 388.492 5.257 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)NC(C3CC3)C3CC3)cc2Cl)c1 609079925 LKGJHRQLSRNOKO-UHFFFAOYSA-N 395.890 5.101 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCO[C@@H](c2ccccc2)C1 609435042 MRIPFXLDRYROAU-YLJYHZDGSA-N 395.528 5.076 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(-c2ccccc2)ccc1Cl 609505198 IFKBNUSJNHOGCD-UHFFFAOYSA-N 392.911 6.265 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(Cl)c1OC(C)C 609827231 LFRPYYBCFKWAJE-UHFFFAOYSA-N 383.879 5.219 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)C1CC1 609929642 IAARPCDVNKSYOO-UZLBHIALSA-N 379.529 5.081 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N[C@H](C)c1cccc(C#N)c1 610364165 QJYMRZDJAIHZKV-GFCCVEGCSA-N 381.888 5.135 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)c2ccc(-c3cccc(OC(F)(F)F)c3)s2)C1 612233196 NDJDSBGNPUBQDE-SFHVURJKSA-N 394.418 5.080 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 613403461 PVOYPTDINNMNSM-AWEZNQCLSA-N 393.855 5.403 30 20 GKED C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(OC(F)F)cc1OC(F)F 618803761 IPKYIMYKFOHXMC-DIFFPNOSSA-N 394.368 5.099 30 20 GKED C[C@H](c1ccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)cc1)C(F)(F)F 622308639 NIBXSKWMPAUWFR-SNVBAGLBSA-N 393.302 5.440 30 20 GKED FC(F)(F)C(F)(c1ccc(NCc2noc3c2CCCC3)cc1)C(F)(F)F 647634105 NWDHRKCXMHGZOC-UHFFFAOYSA-N 396.306 5.455 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cc(-c3ccc(C)o3)nc3ccccc23)cc1 726942017 OGFOMDDSLGNBFR-UHFFFAOYSA-N 395.462 5.672 30 20 GKED CC(=O)Nc1ccc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1 727685392 LSGRYERPEGVQTA-FOWTUZBSSA-N 392.455 5.120 30 20 GKED N#CCOc1cccc(/C=C/C(=O)c2ccc(-c3ccccc3Cl)s2)c1 730149431 IEBJMMOXQCJWBY-CMDGGOBGSA-N 379.868 5.867 30 20 GKED O=C(/C=C\c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1nc2ccccc2s1 733083025 BFOQKUCXUDXNLO-HJWRWDBZSA-N 393.449 5.224 30 20 GKED C#CCOc1cccc(NC(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)c1 733632499 BNBUSGRJYVYNFJ-SFHVURJKSA-N 385.467 5.516 30 20 GKED CC[C@H](C#N)Oc1cccc(CNc2ccnc3cc(Br)ccc23)c1 734834038 YSWMFJOUHZBQOA-MRXNPFEDSA-N 396.288 5.290 30 20 GKED C=CCn1c(-c2ccc(C(C)(C)C)cc2)nn(CN(CCC#N)C(C)C)c1=S 739844628 DPAHGGXYTWVOGZ-UHFFFAOYSA-N 397.592 5.146 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cc(Cl)c(O)c(OC)c2)cc1 741470627 UFHKOXSSKVMJRH-KPKJPENVSA-N 394.854 5.626 30 20 GKED C#CCOc1ccc(F)cc1NC(=O)c1sc2cccc(Cl)c2c1Cl 741643496 CMKZEKWWYQABNY-UHFFFAOYSA-N 394.254 5.612 30 20 GKED CC(=O)Nc1ccc(-c2nc(NN=Cc3ccccc3Cl)sc2C)cc1 749261353 HEEDQYDHYHISLL-UHFFFAOYSA-N 384.892 5.176 30 20 GKED CC(=O)CCCCCCC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 772596104 YVMNYVPGUQSCON-OAQYLSRUSA-N 396.918 5.864 30 20 GKED N#C[C@@H](C(=O)CN(Cc1ccccc1)c1ccccc1)c1ccc2ccccc2n1 772635983 AHTPUNOSYLVCHR-HSZRJFAPSA-N 391.474 5.118 30 20 GKED C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)Cc3ccccc3CC#N)c2)C1 776860502 LIHCBELGVHICCG-FDDCHVKYSA-N 376.500 5.029 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](c2ccccc2)c2ccc(Cl)cc2)c1 779105054 RLLFIAWFXUIRRO-ISKFKSNPSA-N 390.914 5.900 30 20 GKED O=C(/C=C\c1scnc1C1CC1)c1ccc(OC(F)F)cc1OC(F)F 782306362 RNUJYSHXVJTSPP-WAYWQWQTSA-N 387.354 5.119 30 20 GKED C#CCC1(C(=O)Nc2ccc(Oc3nncc4ccccc34)cc2)CCCCC1 788526152 RLBQUAGJBYKCOW-UHFFFAOYSA-N 385.467 5.334 30 20 GKED Cc1oc(C#N)cc1C(=O)O[C@@H](C)c1ncc(-c2ccc(Cl)cc2Cl)o1 797884772 VTWFZHNMNNZHFG-JTQLQIEISA-N 391.210 5.340 30 20 GKED COc1ccc2sc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)c(C)c2c1 813213006 HAUBLMDIQPDDSW-CQSZACIVSA-N 390.386 5.122 30 20 GKED CC(C)(C)OC(=O)N[C@H](CCCCC#N)c1nc(-c2cccc(Cl)c2)no1 848603808 SOVSHIFPVZQUEP-OAHLLOKOSA-N 390.871 5.040 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@H]2Nc1snc(Cl)c1C#N 853850376 IVQBGDFRCKOYSX-CQSZACIVSA-N 390.896 5.115 30 20 GKED CCOc1ccc(O)c(/C=N\C2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c1 914703088 ODGMGFGHNHIZBH-UPAHXGKCSA-N 383.332 5.119 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3CC3(Cl)Cl)cc2Cl)cc1 917876583 MMJRVFFWTRFNDY-CYBMUJFWSA-N 381.646 5.136 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)/C(=C/c1ccc(F)cc1)c1cccs1 920014148 RVAIEBRHCVJFRG-LDADJPATSA-N 392.455 5.337 30 20 GKED Cc1ccc2c(c1)C/C(=C\c1cccc(NC(=O)c3ccccc3Cl)c1)C2=O 921264487 UWXJFXFMKHKCDD-LDADJPATSA-N 387.866 5.723 30 20 GKED CC1(C)CN(CCCCC2(C#N)CCC2)CCN1CCCCC1(C#N)CCC1 929999463 LEBLOQQJFALDNZ-UHFFFAOYSA-N 384.612 5.111 30 20 GKED O=C(Nc1ccc(CCC(F)(F)F)cc1)N1CC[C@@]2(C1)CC(F)(F)C2(F)F 930304794 MANQCJGKLMBNFJ-AWEZNQCLSA-N 398.322 5.080 30 20 GKED O=C(O)c1cc2c(C=NN(c3ccccc3)c3ccccc3)c(F)ccc2s1 1776032767 QOXLZQCUSFKXCJ-UHFFFAOYSA-N 390.439 5.911 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3ccc(Cl)cc3)cc2)c1 1776115483 ZSQFHUBCVZXJER-MLPAPPSSSA-N 376.839 5.530 30 20 GKED O=C(O)c1cc(F)c(/C=C\C(=O)c2ccccc2OCc2ccccc2)cc1F 1776126206 GCKHJWFMUKWHIO-KHPPLWFESA-N 394.373 5.138 30 20 GKED C=CCc1cc(C)c(OCCCN2[C@H](c3ccccc3)CC[C@@H]2C(=O)O)cc1C 1776188995 TZPSXHNHURAIID-XZOQPEGZSA-N 393.527 5.091 30 20 GKED COCc1c(C)cc(C)c(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)c1C 1777230219 KGFHJXOWDZUKGW-HJWRWDBZSA-N 396.483 5.140 30 20 GKED O=C(/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1cc2ccccc2s1 1777569429 SCQHCVRNHJXDQQ-RMKNXTFCSA-N 390.416 5.461 30 20 GKED CCCCc1nnc(/N=C(\O)c2sc(Cc3ccc(F)cc3)nc2C)s1 30561037 MDZAQNSHTBRUME-UHFFFAOYSA-N 390.509 5.012 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@H](C)C(=O)c1ccc(Cl)cc1 32789139 SGYSBNHYBDWTQA-OAHLLOKOSA-N 397.931 5.072 30 20 GKED Cc1occc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538190 ITHJRNSZNNLBHH-CYBMUJFWSA-N 377.252 5.508 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1cc(C#N)ccc1OC(C)C 56212905 HISVXBJIXHURNP-UHFFFAOYSA-N 383.498 5.091 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](c1ccccc1)C(C)(C)C 63402198 OSJFWZHNVYSZRR-FQEVSTJZSA-N 381.476 5.080 30 20 GKED N#C[C@@H](C(=O)CCc1cc(F)ccc1F)c1nc2cc(Cl)ccc2s1 66510902 REIVBGDTVQZMEA-ZDUSSCGKSA-N 376.815 5.037 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1cccc(Br)c1 66800146 STKIHGQXVGHMNE-ZDUSSCGKSA-N 389.318 5.025 30 20 GKED COc1ccccc1S[C@H](C)C(=O)Nc1sc2c(c1C#N)CCCCC2 72042320 DSRIPADTSMRMFD-CYBMUJFWSA-N 386.542 5.017 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(Cl)c(F)c1 129674896 XZADAKFMCOCUBQ-ZDUSSCGKSA-N 391.899 5.395 30 20 GKED C[C@@H](Oc1ccc(C#N)cc1F)c1nnc(-c2ccc(Cl)c(Cl)c2)o1 134304860 YOBMWYPECNUIFV-SECBINFHSA-N 378.190 5.194 30 20 GKED C[C@H](c1nc2ccccc2s1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 151290658 SPLAVRRLSSLMQI-WBVHZDCISA-N 378.501 5.044 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)N[C@@H](C)CC#N 160932242 ZCOWTSSUIHIEMG-HNNXBMFYSA-N 393.466 5.155 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cc2ccccc2s1 170956096 RIWNFBQZCXKWCZ-HNNXBMFYSA-N 375.497 5.208 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1cccc(OC(F)(F)F)c1 175753929 LCDNOEFJSFSDNL-OAHLLOKOSA-N 378.394 5.119 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)N(CCC#N)Cc1ccco1 178083029 PEZNIDZAMQVHSC-UHFFFAOYSA-N 395.381 5.035 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(NC(=O)c2cccnc2)c1 189881531 NJNLKPFIPCRCLN-UHFFFAOYSA-N 399.494 5.438 30 20 GKED N#Cc1cnc2ccc(Cl)cc2c1NCc1cccc(NC(=O)C2CCC2)c1 301360534 PZKLAZMQAWFXBV-UHFFFAOYSA-N 390.874 5.111 30 20 GKED CC[C@H](Nc1ccc(C(F)(F)F)cc1C#N)c1nc(C(F)(F)F)cs1 301738733 WOBRBPRKYJMZHD-JTQLQIEISA-N 379.329 5.616 30 20 GKED COc1ccc(-c2cc(C(=O)N(CC#N)c3ccccc3)c3ccccc3n2)cc1 302382889 ZGBSIIKRTDDUPO-UHFFFAOYSA-N 393.446 5.081 30 20 GKED C[C@H]1C(=O)CC[C@@H](C(O)=Nc2nc3c(Br)cccc3s2)C1(C)C 329296244 STGIYEDACXNDJS-UWVGGRQHSA-N 395.322 5.288 30 20 GKED Cc1ccc2c(c1)CC[C@H](/C(O)=N/[C@@H]1CCCc3cn(C4CCCC4)nc31)O2 330017256 QULKYBLRBFZHHE-TZIWHRDSSA-N 379.504 5.034 30 20 GKED O/C(=N\C1CCC(/C(O)=N\CC2(c3ccc(F)cc3Cl)CC2)CC1)C1CC1 330020915 XASHGVOZAIXFEJ-UHFFFAOYSA-N 392.902 5.393 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](c1ccc(Cl)cc1)C1CC1 330261633 UJYSXYBKWVAVNH-NVXWUHKLSA-N 390.936 5.455 30 20 GKED Cc1cc(Br)cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1 430597801 AWVQEWPRLBUGTJ-ZDUSSCGKSA-N 377.307 5.002 30 20 GKED C[C@H](CCNC(=O)c1cccc(SCC#N)c1)c1cccc(C(F)(F)F)c1 430627561 MHCDGBAAMYDLOS-CQSZACIVSA-N 392.446 5.245 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 432834957 FEVOHUHLCJCQCM-UHFFFAOYSA-N 389.436 5.178 30 20 GKED C[C@@H](NC(=O)Nc1ccc2cc[nH]c2c1)c1ccc(-c2cccc(C#N)c2)cc1 433639971 PLZXTPBYKHIBRB-MRXNPFEDSA-N 380.451 5.589 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccc1 439675142 ZDCIRLWHHRHHSO-QFIPXVFZSA-N 399.425 5.265 30 20 GKED COCCC[C@H](NC1CCC(Oc2ccccc2C#N)CC1)c1ccc(F)cc1 442880372 YOZSURYLIXXDER-VNXZQDSDSA-N 396.506 5.145 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)Nc2ccc(C#N)cc2)cs1 463070315 YZXROTPJMZYOKJ-UHFFFAOYSA-N 379.460 5.046 30 20 GKED CCCCCOc1ccc(C(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 464475965 OKCULIIILXNNSN-QGZVFWFLSA-N 376.378 5.159 30 20 GKED Cc1c(COC(C)(C)C)cccc1N[C@H](C)C(=O)N(CCC#N)c1ccccc1 474926191 KSIDSFHTSWCHMC-LJQANCHMSA-N 393.531 5.057 30 20 GKED COc1ccc(CN(Cc2ccccc2)C(=O)C[C@H](CC#N)c2ccccc2)cc1 475118693 KAGJMMYBUNMYED-DEOSSOPVSA-N 398.506 5.312 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccccc1-c1nc2ccccc2[nH]1)c1ccccc1 475936205 FDLQRURTJBZJKF-SFHVURJKSA-N 380.451 5.256 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@@H]2C2CCC2)cc1 480400052 ADIMMVGYQKZTBB-HXUWFJFHSA-N 391.471 5.156 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)Cc2cccs2)cc1 480401582 CZSYDFNPZZITAY-UHFFFAOYSA-N 393.468 5.085 30 20 GKED Cc1ccc([C@@H]2C[C@H](C)N(C(=O)c3ccc(Oc4ccc(C#N)cn4)cc3)C2)cc1 486640346 NMUFYDKYCNTIRR-PGRDOPGGSA-N 397.478 5.072 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1ccccc1OC(F)(F)F)c1ccccc1 487474389 ODZQZIKCNHRLJV-GOSISDBHSA-N 390.405 5.069 30 20 GKED N#Cc1cccc(CN[C@H](c2ccc(Br)cc2)c2ccccc2F)c1 490137683 RWUAHOXCYKNWGQ-OAQYLSRUSA-N 395.275 5.339 30 20 GKED CCOc1ccccc1NC(=O)[C@H](Sc1ccc(C#N)cc1)c1ccccc1 509668947 YDEAKBDUQNXJDY-JOCHJYFZSA-N 388.492 5.429 30 20 GKED CC[C@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511398747 OGWKAWSQZJNEPI-UGKGYDQZSA-N 391.515 5.422 30 20 GKED C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc(C#N)cc1 512957592 RNIKTVKRCDOWNN-CYBMUJFWSA-N 397.887 5.127 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 513654241 KFSVLNUFNZAODH-IBGZPJMESA-N 398.487 5.674 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccc(F)cc2Cl)cc1 513727211 GTMCKYPKYLDTNP-UHFFFAOYSA-N 396.805 5.404 30 20 GKED CC(C)c1ncncc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 514466575 VAVOESNTVKXJPL-GOSISDBHSA-N 390.874 5.161 30 20 GKED N#CCCCn1cc(-c2nc(-c3ccc(N4CCCC4)cc3)no2)c2ccccc21 515020265 XNNRDADKHGQZBA-UHFFFAOYSA-N 397.482 5.262 30 20 GKED Cn1c([C@H](C#N)C(=O)c2ccc(OCC3CCCCC3)cc2)nc2ccccc21 517795777 UILYWXKWJGSZHT-HXUWFJFHSA-N 387.483 5.022 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1ccc(F)cc1 518164422 BGJZSLOPKYNDFZ-BEFAXECRSA-N 383.492 5.446 30 20 GKED C[C@@H](CSc1ccccc1)C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 518907027 IMMKCFYKQGFQEM-AWEZNQCLSA-N 379.510 5.049 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)NC[C@H](C)c1ccccc1 520268111 WKZVSQHKXQQLFL-OALUTQOASA-N 399.494 5.071 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(CSC2CCOCC2)c1)c1ccccc1 534677383 WNIVSOLESQFPNC-LJQANCHMSA-N 381.541 5.397 30 20 GKED CC(C)C[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 537041315 BTGBBVOZGGFSAC-NQIIRXRSSA-N 395.572 5.254 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1ccc(C2(C#N)CC2)cc1)C1CC1 537429437 ZKYPADHFFRHVGK-HNNXBMFYSA-N 398.428 5.626 30 20 GKED CCN(C(=O)C[C@H](C)C(=O)c1ccc(Cl)cc1)[C@@H](C)c1ccc(C#N)cc1 537479915 YXBVPUTZMZFAHP-HOTGVXAUSA-N 382.891 5.030 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cnn1C(C)C 538847349 GWJCDOBGEZOQRH-UHFFFAOYSA-N 394.862 5.342 30 20 GKED CC[C@@H](CSC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 539303860 DZUOOWHCYLMYBS-MAUKXSAKSA-N 387.936 5.259 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)s2)c2ccccc2Cl)c(OC)c1 539515944 SNSNZUWDTHAPSE-OAQYLSRUSA-N 398.915 5.170 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3cccnc3C3CC3)cc2Cl)cc1 542213968 LVQFOWRBJNSSLV-UHFFFAOYSA-N 389.842 5.529 30 20 GKED N#C[C@@H](C(=O)c1oc2ccccc2c1CSc1cccs1)c1ccncn1 546860108 AHOGBBWTHMYALB-CQSZACIVSA-N 391.477 5.067 30 20 GKED Cc1ccc(Cl)cc1N(C)CC(=O)Nc1ccccc1S[C@@H](C)CC#N 550002554 UBJYRMQFMQKJMV-HNNXBMFYSA-N 387.936 5.118 30 20 GKED N#CCc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1 551719312 WBJLPTXJMSRVQL-NRFANRHFSA-N 388.433 5.029 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F 565943526 RGVQTNXZYKBVME-RBUKOAKNSA-N 388.417 5.173 30 20 GKED N#CCCCCCC(=O)Nc1cc(Cl)c(OCC(F)(F)F)c(Cl)c1 588162973 ZLWYDHJTJCAXGX-UHFFFAOYSA-N 383.197 5.347 30 20 GKED C[C@H](N[C@@H](C)c1nccc2ccccc12)c1ccc(-c2cccc(C#N)c2)cc1 589343924 ICGPMQUWYJRLNQ-OALUTQOASA-N 377.491 6.185 30 20 GKED CN(C(=O)CCCCC#N)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 593987256 JJXTWJDENIFYHE-UHFFFAOYSA-N 375.299 5.625 30 20 GKED CC[C@H](C)c1nc(C)c(CC(=O)Nc2cc(C(C)(C)C)sc2C#N)c(C)n1 593996096 JXCQPZQLXVRGFY-LBPRGKRZSA-N 384.549 5.019 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)c1ccc2c(c1)CCCO2 596736162 UIMHOWDGAXVVHH-HZPDHXFCSA-N 395.528 5.289 30 20 GKED CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)CCc1ccc(C#N)cc1 603989962 BNQNLQUXTBEFFQ-UHFFFAOYSA-N 375.299 5.235 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)c2)C1 610325171 FBXNJOKKXDEAMJ-PMAPCBKXSA-N 391.515 5.536 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1)C1CC1 611095308 ONTZLUGEOCTTPJ-CYBMUJFWSA-N 394.475 5.258 30 20 GKED N#Cc1cc(Cl)c(C(=O)NCC2(c3ccc(F)cc3Cl)CC2)c(Cl)c1 611224451 LDHCTSQBSXFSTD-UHFFFAOYSA-N 397.664 5.119 30 20 GKED Cc1cc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c(Cl)cc1F 619125207 KXJBPXSXENGQJE-UHFFFAOYSA-N 393.730 5.571 30 20 GKED C=CCSc1ccccc1C(=O)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 681594219 WQRURFAZPXTVNJ-RYUDHWBXSA-N 397.384 5.168 30 20 GKED N#C[C@H](C(=O)c1nccs1)c1nc(-c2ccc(Cl)cc2Cl)cs1 683689889 RMJOMBRLHIVFJX-SNVBAGLBSA-N 380.281 5.063 30 20 GKED N#C[C@H](C(=O)CCc1ccc(Cl)c(Cl)c1)c1nc2cc(F)ccc2s1 730420142 ADJUTSJOTBYEPS-GFCCVEGCSA-N 393.270 5.551 30 20 GKED C[C@H](NC(=S)Nc1ccc(C#N)c(Cl)c1)c1nc(-c2ccccc2)cs1 730439114 XLDJAZJVLUJAOG-LBPRGKRZSA-N 398.944 5.383 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Oc2cccc(Cl)c2Cl)cc1 733141914 XKJUSVMOQHAYIV-AWEZNQCLSA-N 377.271 5.016 30 20 GKED C/C(=C\C(=O)N[C@@H](C#N)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)cc1 733259097 RBWYKPLVJYAQRM-JICACKBISA-N 378.781 5.143 30 20 GKED C=CC[C@@H](NC(=O)N(C)[C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccncc1 734679452 MMXIEFSQZZPIIE-KBXCAEBGSA-N 377.410 5.120 30 20 GKED CC(C)(C)c1ncc(/C=C2\CCOc3c(Br)cccc3C2=O)s1 736433340 DCUSHSGNCZGMDJ-PKNBQFBNSA-N 392.318 5.252 30 20 GKED Cc1ccc(-c2cc(C(=O)N(CC#N)C3CCCC3)c3ccccc3n2)c(C)c1 737638306 WXUDBLXQBHWEPN-UHFFFAOYSA-N 383.495 5.427 30 20 GKED CC[C@@](C)(NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1nccs1 740435954 XXTCPIYJNOWCEX-SIKLNZKXSA-N 390.512 5.245 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1C#N 741841615 MSNBDMROVOUXIG-XNTDXEJSSA-N 390.439 5.042 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccc(F)cc1 743457238 AINBUQUXICDTPO-LMICACPXSA-N 387.439 5.101 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccc(F)c1 744034753 LEIMNVJDFWVQNI-PXAZEXFGSA-N 384.863 5.583 30 20 GKED O=C(/C=C\c1ccc(O)c(Br)c1)c1cc(Cl)sc1Cl 744865107 CUUYMOLORYNIGM-IWQZZHSRSA-N 378.074 5.419 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc3sccc3c2)cc1 761035915 IACAFDVGJJRNJP-IFXJQAMLSA-N 376.481 5.376 30 20 GKED Cc1cc(/C=C/C(=O)c2c[nH]c3ncccc23)cc(C)c1OCc1ccccn1 761808724 FBKXPMCSOSYAFB-CMDGGOBGSA-N 383.451 5.050 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](CC)c2ccc3cc(OC)ccc3c2)c1 772982831 FLDMEEVNKYHXQP-WIOPSUGQSA-N 388.511 5.770 30 20 GKED C[C@@H](NCc1cc(Cl)ccc1OCC#N)c1ccc(OCC2CC2)c(F)c1 775542624 MTVLOQNYAIZKAB-CQSZACIVSA-N 388.870 5.021 30 20 GKED Cc1cc2ccccc2nc1NN=Cc1c(-c2ccccc2)nn(C)c1Cl 776783475 BMCLHFVYGWGEMV-UHFFFAOYSA-N 375.863 5.043 30 20 GKED N#CC1(c2ccc(C(=O)O[C@@H](c3ccc(Cl)cc3)c3cccnc3)cc2)CC1 777318111 LBPZJUNMKHGYLG-NRFANRHFSA-N 388.854 5.237 30 20 GKED Cc1ccc(C[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 779197758 ICTKKXURGVGIDX-GOEBONIOSA-N 396.462 5.452 30 20 GKED C[C@H](OC(=O)Cc1csc(Cc2cccc(Cl)c2)n1)c1cccc(C#N)c1 787011162 ASUXWXUBGIMMGH-AWEZNQCLSA-N 396.899 5.106 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2cnn(C(C)C)c2C)cc1OC 787186763 IBZBKJYKLPSXAT-BQYQJAHWSA-N 376.884 5.119 30 20 GKED N#CCCn1cc(/C=C2\C(=O)c3cccc4c3[C@H]2CCC4)c(-c2ccccc2)n1 788355976 SRROXORIYGLYRN-AHFVYKFHSA-N 379.463 5.164 30 20 GKED C=CCn1c(SCSCc2ccc(Cl)cc2)nnc1-c1ccccn1 789956333 VLTIRWBVYVNTQC-UHFFFAOYSA-N 388.949 5.163 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)CCC1 791558463 OMFRUENFTUWFPC-UHFFFAOYSA-N 398.528 5.234 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)n1 793165511 XWLYGNVPKZQNFW-OXJNMPFZSA-N 390.508 5.577 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccccc1OC(F)F 797567168 ZCZDMWRYNJPJLY-BRADTZPFSA-N 390.455 5.322 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570810 KQRLTRNSGXVDSE-GHMZBOCLSA-N 397.327 5.391 30 20 GKED C=CCCc1ccccc1NC(=O)c1sc(NC(=O)OC(C)(C)C)nc1C 800152990 OGMJKRMHVPTVGO-UHFFFAOYSA-N 387.505 5.169 30 20 GKED C=CCC[C@H](C(=O)N1CCC([C@H](O)c2ccccc2C)CC1)c1ccccc1 804515457 JWZRNTOJVDAWDK-ZEQRLZLVSA-N 377.528 5.017 30 20 GKED Cc1cc(/C=C2/Cc3nc(Cl)ccc3C2=O)cc(C)c1OCc1ccccn1 806577931 JHYDTERWFQVRNW-BOPFTXTBSA-N 390.870 5.148 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(C(F)F)cc2F)cc1 847624396 UUFLLKPQUWNYFH-QGZVFWFLSA-N 388.389 5.067 30 20 GKED N#C[C@H](C(=O)C[C@@]12CCCC[C@@H]1C2(F)F)c1nc2cc(Cl)ccc2s1 850771586 SVQBMPPRSRHZBH-PJQXDXOGSA-N 380.847 5.342 30 20 GKED N#Cc1ccc(N2CCC[C@H]2c2nc(-c3ccc(C(F)(F)F)s3)no2)cc1 904971009 HCCOCKTWLVNALS-ZDUSSCGKSA-N 390.390 5.030 30 20 GKED Cc1ccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1F 915124577 QEDNJCVZSLIIBP-HXUWFJFHSA-N 375.472 5.599 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)[C@@H](C#N)c2nc3ccccc3s2)s1 916846267 OFIHKUHRVZOHIR-GFCCVEGCSA-N 395.534 5.209 30 20 GKED Cc1cccc(C)c1OCCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917026711 MSNVPLWZTPVESK-SFHVURJKSA-N 376.481 5.072 30 20 GKED CCCCc1ccc(CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 917041035 OCEWUZMDAQHURU-QGZVFWFLSA-N 381.426 5.193 30 20 GKED N#Cc1ccccc1N1C(=O)/C(=C/c2ccc(Cl)c(Cl)c2)SC1=S 917644976 PMLMHXJNVCISNN-NVNXTCNLSA-N 391.304 5.271 30 20 GKED N#CCOc1ccccc1C(=O)N(Cc1ccccc1)c1ccc(Cl)cc1 920004548 QKBRKPMPEZNLEX-UHFFFAOYSA-N 376.843 5.089 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920805626 DQRFFGDENSBMAO-VOMSXAGXSA-N 380.419 5.368 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)N1CC[C@@]2(C1)CC(F)(F)C2(F)F 930340908 CNFTYSYXACSZBU-AWEZNQCLSA-N 398.322 5.080 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnc(CCC(F)(F)F)s1 935606709 SCPNRFFAZGEFQY-UHFFFAOYSA-N 382.451 5.742 30 20 GKED O=C(O)Cc1cccc(-c2ccc(C=NNc3nc4ccccc4s3)cc2)c1 1776015203 PYZPTQYUGICBCK-UHFFFAOYSA-N 387.464 5.036 30 20 GKED O=C(O)c1cc(NN=C2CC(c3ccccc3Br)C2)ccc1Cl 1776034402 FFUDITVTPNBKRU-UHFFFAOYSA-N 393.668 5.146 30 20 GKED O=C(O)c1cc(-c2ccc(C=Nn3c4ccccc4c4ccccc43)o2)ccc1O 1776112725 IEYXAIOEBIGBOT-UHFFFAOYSA-N 396.402 5.341 30 20 GKED COc1ccc2c(c1)CC/C(=C/c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1776127638 ZCTCVATTZJDLIF-XKZIYDEJSA-N 398.458 5.202 30 20 GKED C=CC1(CC(=O)NCc2ccccc2-c2cccc(C(=O)O)c2)CCCCC1 1776149593 HHFGNAGKNHNNHF-UHFFFAOYSA-N 377.484 5.195 30 20 GKED C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)o1)c1nc2ccccc2n1CC#N 1776196797 LTNXFCCULWAWLC-CCEZHUSRSA-N 383.407 5.079 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cc(OC)cc(C(F)(F)F)c1 1776783074 VROXCSAGQXLCGE-INIZCTEOSA-N 375.431 5.007 30 20 GKED CCCCCCCCOc1ccc(/C=C\C(=O)c2csc(C(=O)O)c2)cc1 1776785489 DOCLLPNLKWPPPH-RAXLEYEMSA-N 386.513 6.082 30 20 GKED CCCCc1oc2ccccc2c1/C=C/C(=O)c1cccc(O[C@H](C)C(=O)O)c1 1776807984 OHRIELQWYKPCDK-FIFPYPGSSA-N 392.451 5.523 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C2\C[C@H](C(=O)O)c3ccccc3C2=O)o1 1777424591 VSNOKURCEWBIBY-IXDOJHRFSA-N 376.383 5.232 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3c(F)ccc4sc(C(=O)O)cc34)coc12 1777449033 GKFPZADVADFXAO-FNORWQNLSA-N 380.396 5.689 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1 24434070 YRCSEESEXALLLV-UHFFFAOYSA-N 387.439 5.148 30 20 GKED Cc1ccc(OCc2nc(CSc3nc(C)cc(C)c3C#N)cs2)cc1 58481440 SJHLGIFHJYNSTG-UHFFFAOYSA-N 381.526 5.206 30 20 GKED C=CCN(C(=O)CCc1nc(-c2ccc(C(C)C)cc2)no1)c1ccccc1 58642470 VFCZFHFHDLMOJX-UHFFFAOYSA-N 375.472 5.012 30 20 GKED C=CCSc1nnc(CNc2cccc(C(F)(F)F)c2)n1C1CCCCC1 61142656 KVBWYBYKECLQNH-UHFFFAOYSA-N 396.482 5.692 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2SCc2cccs2)c1 65749402 MEGFHOOYSVYKJG-UHFFFAOYSA-N 381.522 5.858 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCSCc3ccccn3)cc2)c1 66789172 AILGTFGTWQKCCC-UHFFFAOYSA-N 389.480 5.008 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(N2CCCC2)c(F)c1 66801907 UGSMNXSUSOHUFX-OAHLLOKOSA-N 383.492 5.072 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1nc(C2CC2)no1 108408677 ZNLOZIWZGBBJRD-SNVBAGLBSA-N 382.411 5.145 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(-c2ccccc2F)o1 121018454 HZKOKOFMTAQWBP-INIZCTEOSA-N 386.382 5.081 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@H](C)OC1CCCCCC1 121815617 PGCJZKYVMXCKGN-KRWDZBQOSA-N 393.487 5.120 30 20 GKED C[C@H](Sc1ccccc1C#N)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 172681271 KOVKQPZYRFPUBK-VIFPVBQESA-N 385.703 5.638 30 20 GKED COCCc1ccccc1NC(=O)c1ccccc1Sc1ccccc1C#N 188187563 VDXPVIJSFLJQPH-UHFFFAOYSA-N 388.492 5.151 30 20 GKED C[C@@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1Cl 194626654 VVCYWUHEDYREPT-ZDUSSCGKSA-N 384.888 5.410 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCc2cccc(OC3CCCC3)c2)cc1 303150330 FXOMKZOQMRKYBC-UHFFFAOYSA-N 376.500 5.380 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 303233363 ZHMQGVPRFVVMMZ-HNNXBMFYSA-N 387.854 5.652 30 20 GKED CC(C)c1cccc(O[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)c1 303310922 QZBWUEXMNOCMKD-IAGOWNOFSA-N 382.529 5.468 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 303949497 SUZOKULYTRCOAZ-CYBMUJFWSA-N 377.271 5.407 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H](C#N)c1ccc(C(C)(C)C)cc1 328850176 YZSJEFHOUWKOGL-AEFFLSMTSA-N 397.544 5.213 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/C1(C#N)CCC(C(C)(C)C)CC1 329114451 HRIKEAYHAPNAIF-IZINQKCZSA-N 389.565 5.149 30 20 GKED CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)CSCCC#N)cc1 413012636 MKOHSPIWHBHTBV-UHFFFAOYSA-N 390.892 5.116 30 20 GKED CCN(C(=O)NCC1(CC#N)CC1)[C@@H](C)c1ccc(-c2cccc(OC)c2)cc1 431189330 ZTMYEEGAXFLPMW-SFHVURJKSA-N 391.515 5.149 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccnc(Oc3ccc(F)cc3F)c2)n1 434558882 MKTDTYMWGRFWSM-AWEZNQCLSA-N 399.422 5.222 30 20 GKED N#CCCCn1cc(C(=O)N(Cc2ccco2)C2CCCC2)c2ccccc21 444019559 BXYCXMUJNRLXOC-UHFFFAOYSA-N 375.472 5.123 30 20 GKED C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCC[C@H]1c1cccc(C)c1C 453462610 IIFOXIUKAZQUHH-SFTDATJTSA-N 380.536 5.054 30 20 GKED Cc1ccc(C)c([C@H]2CCCN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458805589 UTCAQZIKRYBHJR-DHIUTWEWSA-N 375.516 5.585 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1CC[C@H](c2ccc(F)cc2)C1 471280461 UKVZGQGCWDFJBX-HHXXYDBFSA-N 397.519 5.678 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(-c2ccccc2Cl)nn1 476134017 FCCNIOOWNCNODS-UHFFFAOYSA-N 380.879 5.025 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)c1ccc(OCC)c(F)c1 476774297 FYAUOTBXHNLYKC-UHFFFAOYSA-N 397.490 5.678 30 20 GKED COc1cc2c(cc1OC)[C@@H](N[C@@H](C)c1ccc(-c3cccc(C#N)c3)cc1)CC2 479460858 MEJPZXQWHCPWCR-XDHUDOTRSA-N 398.506 5.581 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@H](C)c1cccc(Br)c1 479770926 UCWVDSJRMDFTRY-UONOGXRCSA-N 375.335 5.874 30 20 GKED N#Cc1csc(/C=C(\c2nc3ccccc3[nH]2)c2nc3ccccc3s2)c1 480338182 RPAVVVOBXRQZLQ-XNTDXEJSSA-N 384.489 5.695 30 20 GKED O=[N+]([O-])c1cc(CNCc2ccc(F)c(C(F)(F)F)c2)cc(C(F)(F)F)c1 487163371 KDBTUUSJKQDFED-UHFFFAOYSA-N 396.262 5.061 30 20 GKED CN(c1ccccc1)c1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)cn1 487469922 HCJFPPQJMBFIHQ-QFIPXVFZSA-N 384.483 5.014 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1)c1ccccc1 487603036 LVWWMACSRRGBES-UFYCRDLUSA-N 386.417 5.360 30 20 GKED C=CCn1c(SCc2cc(F)cc3cccnc23)nnc1-c1cccs1 489418240 ZRKRXGQFZDMHNJ-UHFFFAOYSA-N 382.489 5.172 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1 490228092 YSDKYHADPRRXTI-IIBYNOLFSA-N 379.529 5.662 30 20 GKED COc1ccc2oc([C@H](C)NCc3cc(C#N)ccc3Br)c(C)c2c1 492876957 YUXWAINBSVPAIB-ZDUSSCGKSA-N 399.288 5.235 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1ccccc1Nc1cccc(C(F)(F)F)c1 497262814 QXVKMXRDEDVSGA-UHFFFAOYSA-N 375.394 5.071 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)CSc1ccc(Cl)cc1 501018080 KWSVMLRIYPPYHZ-UHFFFAOYSA-N 382.872 5.130 30 20 GKED CCCOCc1ccccc1CNC(=O)c1ccccc1-c1ccccc1C#N 502137061 BJGVZRWORJCGFN-UHFFFAOYSA-N 384.479 5.082 30 20 GKED CC(C)c1nc2ccc(NC(=O)CSCc3ccc(C#N)cc3)cc2s1 502477199 WNAJJMMEYKQGRW-UHFFFAOYSA-N 381.526 5.163 30 20 GKED Cc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)cc1C(F)(F)F 503644793 UAUBFDWVZIQPMA-UHFFFAOYSA-N 385.389 5.207 30 20 GKED N#C[C@@H](NC(=O)c1cccc(Oc2ccncc2)c1)c1c(Cl)cccc1Cl 505505684 IHROKYMYCLGPPE-GOSISDBHSA-N 398.249 5.175 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@H]1CC[C@H](C(F)(F)F)C1 506788614 HHOKDGNRIISVAR-HOTGVXAUSA-N 388.389 5.576 30 20 GKED CC1(C#N)CCN(C(=O)N[C@@H](CCCc2ccccc2)c2ccccc2)CC1 508050468 MFYOEJSBFGZSAN-QFIPXVFZSA-N 375.516 5.086 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cc3cc(Br)ccc3o2)cc1 509187068 VRCWJVNHTMIJPF-UHFFFAOYSA-N 383.245 5.249 30 20 GKED CCN(C(=O)c1cc(Br)ccc1Cl)[C@@H](C)c1ccc(C#N)cc1 509593926 TUXMLIVOLSTCGB-LBPRGKRZSA-N 391.696 5.197 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCc4cc(F)ccc4C3)c2)cc1 510049169 JJRZYOWIWHOOHW-UHFFFAOYSA-N 387.414 5.080 30 20 GKED N#C[C@@H](NC(=O)c1cccc(F)c1Sc1ccccc1)c1ccccc1F 511610401 JTIPFFYDIRVBJO-LJQANCHMSA-N 380.419 5.111 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Cn1ccc2ccccc21 511695599 OKVFNCHOQAAJIG-SJORKVTESA-N 377.513 5.310 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1COC(C)(C)CC 515922703 VVZLLSBQCVNGFW-UHFFFAOYSA-N 391.515 5.484 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1ccc(Cl)cc1Cl 518660436 XLYDARMMAWWPKD-CYBMUJFWSA-N 393.339 5.816 30 20 GKED Cc1cccc(CN(C)C(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 518752164 HYLZTFRDNAFLCG-UHFFFAOYSA-N 386.520 5.431 30 20 GKED CC(C)c1nc2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2s1 519065056 PKFYBDTXCLQXPQ-UHFFFAOYSA-N 392.528 5.734 30 20 GKED CCc1nc2ccccc2c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C 521733475 HKDYOEHHMFSINK-OAHLLOKOSA-N 389.524 5.610 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)CSc1ccc(C#N)cc1)c1ccccc1 524528398 WYRJVKURUBFCFE-QGZVFWFLSA-N 388.492 5.429 30 20 GKED CCSCc1ccc(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 524626694 XMJFSXZFNPTVOP-KRWDZBQOSA-N 379.312 5.241 30 20 GKED N#Cc1csc(CNCc2ccc(Oc3ccccc3C(F)(F)F)nc2)c1 530640733 ZSTRHVPPYVEMFL-UHFFFAOYSA-N 389.402 5.116 30 20 GKED C[C@@H]1CC(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C[C@@H](C)O1 535775178 BYGJIBPBCNVIRF-ZIAGYGMSSA-N 399.878 5.081 30 20 GKED C=CCC[C@H](NCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1ccccc1 538256226 GJNUYLKRUOJMHK-SFHVURJKSA-N 387.405 5.553 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1cc2ccc(C(F)(F)F)cc2[nH]1 538775677 ZPPHJSYWJVZRRX-YLJYHZDGSA-N 397.400 5.099 30 20 GKED CCC[C@@H](NCCC(=O)Nc1sccc1C#N)c1cccc(C(F)(F)F)c1 539262929 PCEAZHLNGFEWGR-MRXNPFEDSA-N 395.450 5.098 30 20 GKED COc1c(C)cc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1C 540244524 CIRFRYMNKKTSRH-CQSZACIVSA-N 398.434 5.204 30 20 GKED CC(C)(C)c1nc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cs1 549328517 YLWWJPYFXZORKP-JTQLQIEISA-N 375.906 5.194 30 20 GKED Cc1csc(-c2cccc(NC3CCN(Cc4ccc(C#N)cc4)CC3)c2)n1 554113844 DWUNPBSJBVDBQJ-UHFFFAOYSA-N 388.540 5.067 30 20 GKED C=CCN(C(=O)c1ccc(C=C)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 556342067 UXIYLZXKPPEDOO-UHFFFAOYSA-N 391.452 5.194 30 20 GKED C=C(C)COc1cccc(NC(=O)N(Cc2ccccc2)CC2CCOCC2)c1 562204226 ZURRKGYXWTUWEG-UHFFFAOYSA-N 394.515 5.102 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3cc(Cl)c(Cl)cc3Cl)CC2)c1 564682304 YVZHGUBQOZEKGC-UHFFFAOYSA-N 383.637 5.328 30 20 GKED Cc1sc(NC(=O)[C@H](C)Oc2ccccc2C#N)nc1-c1cccc(Cl)c1 584068740 BXCPNTCLAIVDPV-LBPRGKRZSA-N 397.887 5.050 30 20 GKED Cc1ccccc1-c1cnc(COc2c(Br)cccc2CC#N)o1 589268614 BBHQNUQHBOBSOQ-UHFFFAOYSA-N 383.245 5.058 30 20 GKED COc1cc(NC(=O)NCc2ccc(C#N)c(Cl)c2)c(C2CC2)cc1Cl 594202165 DZGLAODFVHXGMA-UHFFFAOYSA-N 390.270 5.073 30 20 GKED C[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cccc(C#N)c1 600851335 NLWHDSBMFYOLNT-NSHDSACASA-N 390.302 6.021 30 20 GKED CCN(C(=O)c1ccc(OCc2ccccc2C#N)cc1)c1ccc(F)c(F)c1 603638210 ZTNYLZYZTUKGDQ-UHFFFAOYSA-N 392.405 5.082 30 20 GKED Cc1nc(NC(=O)c2ccccc2CCc2ccccc2)sc1SCC#N 603774896 CUXPYXJOHJPYSI-UHFFFAOYSA-N 393.537 5.105 30 20 GKED CC(=O)N(c1nc(CSc2ccc(C#N)cc2)cs1)c1cccc(C)c1C 603826752 CHERVGGOPFQVTP-UHFFFAOYSA-N 393.537 5.609 30 20 GKED C=CC[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 609738695 GOIWSUURQOOQRT-GFCCVEGCSA-N 376.865 5.094 30 20 GKED Cc1sc2nc(S[C@H](C)c3ccc(C#N)cc3)n(C(C)C)c(=O)c2c1C 609813566 LMHSWMXGBRJIFW-CQSZACIVSA-N 383.542 5.381 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)[C@@H](C#N)c1nc2ccccc2o1 614439793 IKBLLPUZLJXWRP-LJQANCHMSA-N 382.419 5.205 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cnc2onc(C(C)(C)C)c2c1 617455554 UHICZMJHPJFFAO-UHFFFAOYSA-N 389.908 5.064 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C(F)(F)F)c(OC)c1 619209587 PMMJJFCNDLBTAH-UHFFFAOYSA-N 391.393 5.030 30 20 GKED C=CCC[C@@H](NCc1cn2cccc(F)c2n1)c1ccc(C(F)(F)F)cc1 677322758 LDAAHEDCQLSXBM-GOSISDBHSA-N 377.385 5.289 30 20 GKED N#C[C@H](C(=O)c1cc2cccc(F)c2o1)c1nc(-c2c(F)cccc2F)cs1 682127144 HKPWIUGHRPYAAC-LLVKDONJSA-N 398.365 5.464 30 20 GKED Cc1ccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)c1Br 682991325 GXPICZNKCJUSQJ-CYBMUJFWSA-N 377.307 5.136 30 20 GKED CCn1cc(NC(=S)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)cn1 726126663 GJLIAKZPHTWBQF-UHFFFAOYSA-N 397.891 5.029 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=S)Nc2ccc(C#N)c(Cl)c2)c(C)c1 726487593 GTWJVBZNCFUASI-CYBMUJFWSA-N 389.977 6.220 30 20 GKED O=C(O)C(=O)/C(=C/c1sc2ccccc2c1Cl)c1ccc2ccccc2n1 728156598 KEUXAHIHIXBQNY-SDNWHVSQSA-N 393.851 5.297 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1nc(C(C)(C)C)no1 728299184 OOUCDZHJASRSGH-AWEZNQCLSA-N 394.450 5.130 30 20 GKED N#CCOc1ccc(CSc2nc3ccccc3c3nc4ccccc4n23)cc1 729242243 RRFCHSCLFLNPRH-UHFFFAOYSA-N 396.475 5.230 30 20 GKED N#C[C@H](C(=O)CCCc1c[nH]c2ccccc12)c1nc2cc(F)ccc2s1 730417393 NGGBSSSVNUBDMH-MRXNPFEDSA-N 377.444 5.116 30 20 GKED N#C[C@@H](C(=O)Cc1csc(-c2cccs2)n1)c1nc2cc(F)ccc2s1 730420175 ASQIGNJBRYVJBW-LBPRGKRZSA-N 399.497 5.039 30 20 GKED CN(CCc1ccccc1F)C(=O)c1ccccc1Sc1ccccc1C#N 731591866 PXRVPFHZHNALMT-UHFFFAOYSA-N 390.483 5.163 30 20 GKED CC(C)n1cc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)cn1 732713685 FHCVOMDHJOGBHT-DHDCSXOGSA-N 383.904 5.453 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccc(-c3ccc(F)cc3)s2)c1 733773881 HCBXBQJCGBBEDW-SFHVURJKSA-N 394.471 5.165 30 20 GKED O=[N+]([O-])c1cc(Cl)cc(C=Nc2ccc(COCc3ccccc3)cc2)c1O 741464062 KLQYRDACOOFQJS-UHFFFAOYSA-N 396.830 5.421 30 20 GKED Cc1ccc(Cl)c(NC(=S)NC2(c3cccc(C#N)c3)CC2)c1Cl 747706991 WLXFMWSYYFFWNF-UHFFFAOYSA-N 376.312 5.149 30 20 GKED CCn1cc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c2ccccc21 748483928 ZBIOPDBYWMIZGQ-HXUWFJFHSA-N 399.519 5.512 30 20 GKED COc1ccc(-c2nc(S[C@@H](C)c3ccc(Cl)cc3)nc(O)c2C#N)cc1 750002474 FNYVBWREZPESTI-LBPRGKRZSA-N 397.887 5.236 30 20 GKED COc1cc(/C=C2\CSc3ccc(F)cc3C2=O)ccc1OCC(F)(F)F 750902620 LNTURACTQRNLKM-WUXMJOGZSA-N 398.377 5.147 30 20 GKED Cc1cc(/C=C2\CSC/C(=C\c3cnc(Cl)c(C)c3)C2=O)cnc1Cl 760263647 OYVLBJSWWAQVEM-IAGONARPSA-N 391.323 5.183 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cc(F)cc2Cl)cc1 761535525 UQPNRQXLCQYTCR-KRWDZBQOSA-N 399.252 6.040 30 20 GKED O=C(/C=C\c1cncc2ccccc12)c1ccc(OC[C@H]2CCCCO2)c(F)c1 772803674 WGASEUODWVJAMZ-CIGMURNLSA-N 391.442 5.218 30 20 GKED CC(C)(C)OC(=O)Nc1ccccc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 774039423 WYACRVSBMHFJMI-KRWDZBQOSA-N 387.439 5.072 30 20 GKED C#Cc1cccc(NC(=S)NCc2nc(-c3cc4ccccc4o3)cs2)c1 774211072 KSGNPQCDOROUKZ-UHFFFAOYSA-N 389.505 5.024 30 20 GKED COc1cc(C2SCCS2)ccc1OCc1ccc(Cl)cc1C#N 774723035 CLHNQYFTDDPMKD-UHFFFAOYSA-N 377.918 5.278 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(OCC#N)cc1 776155108 YCKXYDXNCBLHRJ-UBHSHLNASA-N 394.359 5.149 30 20 GKED Cn1c(/C(Cl)=C/c2cc(C#N)cs2)nc2ccc(Br)cc21 776723662 JYWBSPYQQSFBDX-SDQBBNPISA-N 378.682 5.006 30 20 GKED N#C[C@@H](C(=O)CCCCCc1ccc(F)cc1)c1nc2ccccc2n1C(F)F 778608217 YJMSEJLFBASUKN-KRWDZBQOSA-N 399.416 5.550 30 20 GKED CC[C@H]1C[C@H](C=NNc2ccc(Br)cc2C(F)(F)F)CCO1 779775368 AOXVXRPWZNHSDU-PWSUYJOCSA-N 379.220 5.071 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(Br)c(Cl)c1 780599903 GICOJKGRNPLSGW-SNVBAGLBSA-N 394.656 5.037 30 20 GKED C=CCCN(C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 786107546 SCPQQBDZUYIPKQ-UHFFFAOYSA-N 387.402 5.092 30 20 GKED N#Cc1ccc([C@H](O)C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)cc1 790088357 DYADOFKJINNDEF-FQEVSTJZSA-N 397.261 5.204 30 20 GKED COc1cccc(Cl)c1CC(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 790766701 DFNBDLPBDKQGFF-INIZCTEOSA-N 396.899 5.200 30 20 GKED CC(C)=CCN(Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1O[C@@H](C)C#N 799225911 RGEOLGTZMILKJV-KRWDZBQOSA-N 397.906 5.631 30 20 GKED CC(C)(CCC#N)CNC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 805280904 OXYJNVMVBPFOES-SNAWJCMRSA-N 392.343 5.184 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1ncccc1C#N)CC(C)(C)O2 811861941 AIJHTTXWGZXLQF-KRWDZBQOSA-N 394.475 5.015 30 20 GKED CC1(/C=C/C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOCC1 822528662 HRNUMGMUXPQCDH-SQUSKLHYSA-N 394.902 5.307 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCC[C@@H]1CC1(Cl)Cl 844533496 BLFPCRZUGXCQIA-CHWSQXEVSA-N 386.348 5.176 30 20 GKED Cc1c(NN=C[C@@]2(C(C)(C)C)CCN(Cc3ccccc3)C2)cccc1C(=O)O 857210949 JFQXSJXPCMYUFW-DEOSSOPVSA-N 393.531 5.029 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(C(C)(C)C)cc1 916900858 UOAQVODCBLKMOE-FQEVSTJZSA-N 376.500 5.070 30 20 GKED C[C@H]1CCc2c(sc3nc([C@H](C)Sc4ccc(C#N)cc4)nc(O)c23)C1 1652612672 KOBNFIRJCANJEB-RYUDHWBXSA-N 381.526 5.247 30 20 GKED CC(CCc1ccc(OCCC(=O)O)cc1)=NN[C@H](C)c1ccc(C(C)C)cc1 1776106181 TUWRBDUSZFFQLB-LJQANCHMSA-N 396.531 5.323 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C\c2ccc(C(=O)O)s2)cc1 1776125761 RWYPDYXGFRHUIG-KVNDZABWSA-N 386.513 5.938 30 20 GKED CC(C)CCOc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1 1776327487 WVNUWWYGNOYUFB-BQYQJAHWSA-N 378.877 5.421 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1c[nH]c3ccc(C(=O)O)cc13)CCO2 1776374743 WBMPYOLJORJQJE-OQLLNIDSSA-N 375.424 5.038 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1csc2ccc(C(=O)O)cc12 1776931549 VDGOGMMJRJCXIO-UTCJRWHESA-N 386.856 5.548 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(O[C@H](C)C(=O)O)cc2)oc2ccc(C)cc12 1776956296 QMUZLGAUVQOSDB-MEODZPNASA-N 378.424 5.052 30 20 GKED N#Cc1cccc(CSc2nnc(-c3cccs3)n2Cc2ccccc2)c1 36855120 NGDZCAICBZNZJH-UHFFFAOYSA-N 388.521 5.219 30 20 GKED C=CCN(Cc1cccs1)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 54683114 UXXIDTUBCIZOGX-UHFFFAOYSA-N 386.904 5.204 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCC(=O)c1ccc2c(c1)CCC2 66856335 PABNBOSUOXTDQN-INIZCTEOSA-N 392.524 5.171 30 20 GKED C[C@@H](c1cccc(O)c1)N(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 67577977 YEQUMLVMCZTVJW-INIZCTEOSA-N 387.439 5.281 30 20 GKED C[C@@H]1CCCC[C@H]1NC(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 71922914 OTJCNFORBDSEOJ-VGOFRKELSA-N 377.488 5.032 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1sc(-c2ccc(F)cc2)nc1C 108426877 JDZZKLBILXGLEQ-UHFFFAOYSA-N 396.487 5.095 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CN(Cc1ccc(C#N)cc1)C(C)C 109404802 XSNSRBGZCWVKHZ-UHFFFAOYSA-N 391.559 5.654 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)cccc1-c1ccccn1 118969844 DPYRNVSQRGUQMQ-INIZCTEOSA-N 387.508 5.561 30 20 GKED C=CCN(CC=C)Cc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 133100768 RUCLWJWBRCCYCL-UHFFFAOYSA-N 396.343 5.309 30 20 GKED C[C@@H](Sc1nc2ccccc2s1)C(=O)Nc1cccc(OCCCC#N)c1 134773538 OWLKSFYYGDIGGK-CQSZACIVSA-N 397.525 5.098 30 20 GKED Cc1ccc2cc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)ccc2n1 136903307 CCMGOBIYSISWNB-OAHLLOKOSA-N 377.856 5.296 30 20 GKED Cc1noc(C)c1[C@H](C)CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 152889228 IPPIWGIPVZFFRP-CQSZACIVSA-N 375.428 5.088 30 20 GKED N#C[C@H](C(=O)c1cccc(C(F)F)c1)c1nc(-c2ccc(Cl)cc2)cs1 171567047 MNIVDTFZEZYQMR-OAHLLOKOSA-N 388.826 5.891 30 20 GKED CC(=O)N(c1nc(CSc2ccccc2C#N)cs1)c1ccc(C)cc1C 172682521 JXWZJVRPLVVZBI-UHFFFAOYSA-N 393.537 5.609 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](C)c1cccc(O)c1 173116258 LXFUGQDAQLMLMG-HZPDHXFCSA-N 383.517 5.259 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)c1nc(-c2ccccc2)cs1 173993588 SOMZCBWZHDEIRL-HYVNUMGLSA-N 380.419 5.068 30 20 GKED CCc1ccc(-c2ccc(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)o2)cc1 174104770 IXUGTHCEFQPAMR-GOSISDBHSA-N 399.475 5.518 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(Cl)s1 175119546 ICWBJBIUMFVBRF-VHSXEESVSA-N 379.819 5.126 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1cc(C)c(C)cc1C)=C(\S)NC(C)(C)CC 186969157 URGUABSCXNEYSA-UHFFFAOYSA-O 397.608 5.179 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](c2ccccc2)O[C@H](C)C1 191516604 WJOUUYWBSNBEDX-XMSQKQJNSA-N 378.516 5.532 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccccc3SC)n2)cc1 193664110 VHIFCIMMSGVROT-MRXNPFEDSA-N 380.494 5.031 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(OCc3ccccc3)cc2)c1 236898626 GTOAGEKDPCEWQR-HSZRJFAPSA-N 386.495 5.236 30 20 GKED COc1ccc(CN[C@H]2CCC(C)(C)c3ccccc32)cc1OCCCC#N 237361210 RRHOXAHGFDPCBI-NRFANRHFSA-N 378.516 5.280 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)ccc1Cl 303278336 JJLGSKMEHICRGV-HIFRSBDPSA-N 388.920 5.306 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2ccccc2OCC2CC2)cc1 303807736 HVODJDMXHOLYRM-UHFFFAOYSA-N 398.462 5.178 30 20 GKED C[C@@H](NCc1nnc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 374676541 HDPDUOCHRLIBCL-QGZVFWFLSA-N 380.451 5.126 30 20 GKED C=CCOc1cccc(NC(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)c1 409852572 HZSSIXDRMXWQPO-INIZCTEOSA-N 393.512 5.566 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(SCc2nc(C)no2)cc1 410368756 XRCZBSDJEWYIFD-UHFFFAOYSA-N 379.485 5.041 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)NCC1(CC#N)CC1 430732040 YIDPRNINJWGGJA-LBPRGKRZSA-N 390.350 5.226 30 20 GKED N#Cc1ccc(Oc2cccc(NCc3ncc(Br)s3)c2)cc1 432701639 BICGLXOXWUVHLV-UHFFFAOYSA-N 386.274 5.182 30 20 GKED Cc1ccc([C@@]2(C)CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 432869570 XXNNWIJODVBQRN-JPYJTQIMSA-N 393.556 5.585 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCCC(F)(F)C1 433121304 RDXGDNVICWMVCN-GJZGRUSLSA-N 381.492 5.275 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cncc(F)c1 437042516 IJLOSFWVXXAZDN-BONVTDFDSA-N 380.307 5.584 30 20 GKED CCS[C@H]1CC[C@H](N(C)C(=O)c2ccccc2Sc2ccccc2C#N)C1 437113871 CEOXDZQMONPTMN-ROUUACIJSA-N 396.581 5.456 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCCc1ccc2ccccc2c1 437455198 QUEJPHUHANAJDA-UHFFFAOYSA-N 380.900 5.279 30 20 GKED Cc1ccccc1-n1c(S[C@H](C)c2cccc(C#N)c2)nnc1-c1ccncc1 442923540 WBOQTOUFJZFISY-QGZVFWFLSA-N 397.507 5.363 30 20 GKED Cc1cc(C(=O)CS[C@@H](C)c2cccc(C#N)c2)c(C)n1-c1nccs1 443157449 YWUPOANQEWTJMN-HNNXBMFYSA-N 381.526 5.099 30 20 GKED CCCN(C(=O)CC(C)(C)C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 447197277 CDWRGOVCJAZAKJ-UHFFFAOYSA-N 396.343 5.800 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)c3ccc(C(C)(C)C(F)(F)F)cc3)[nH]c12 447511557 ULONHQZTKAYJSV-OAHLLOKOSA-N 385.389 5.201 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@@H]1c1ccccc1Cl 453469918 YTCRJKOYCBSZBQ-RTBURBONSA-N 386.927 5.091 30 20 GKED CCCN(C(=O)Nc1ccc(CC#N)cc1Cl)[C@H](C)c1ccccc1OC 455707462 RMXYOYZXSGFRAP-OAHLLOKOSA-N 385.895 5.420 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(c3c(F)cccc3F)CC2)c(Cl)c1 455740873 YXNQAHSKMVJPJJ-UHFFFAOYSA-N 389.833 5.096 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1cc(Br)ccc1Cl 462237271 ZNLOVTNPSKRWFP-GFCCVEGCSA-N 395.753 6.109 30 20 GKED C=CCCN(C)C(=O)N[C@@H](c1ccc(OC)cc1)c1ccc(C(F)(F)F)cc1 467084966 LVIZURDKFSOWMF-LJQANCHMSA-N 392.421 5.021 30 20 GKED C[C@H](S[C@H](c1ccccc1)c1ccc(Cl)cc1)C(=O)NC1(C#N)CCC1 468474964 LCKPJQIJBSMFCH-HNAYVOBHSA-N 384.932 5.114 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1cccc(Cl)c1Cl)Cc1cccc(F)c1 469298853 WACGSQNMWVORAQ-SJKOYZFVSA-N 379.262 5.082 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c(C)c1 470895982 COQFAZNWBBTVRR-LPHOPBHVSA-N 377.513 5.078 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C(=O)Nc1cccc(COC(C)C)c1 475184102 QIPILNHZYUXBTC-UHFFFAOYSA-N 394.515 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](C)C[C@H]1c1ccccc1F 475550067 NHZNLHZLHFORQR-VGSWGCGISA-N 380.507 6.293 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)[C@@H](Oc1ccccc1C#N)C(C)C 475919501 MGJATMXAWPFONE-APWZRJJASA-N 399.560 5.070 30 20 GKED Cn1cc(CNCc2ccccc2Oc2ccccc2)c(-c2ccc(C#N)cc2)n1 479950937 TXEZKPIZKCEPPT-UHFFFAOYSA-N 394.478 5.041 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 485246542 PWKUBYOWEUWCNE-UTKZUKDTSA-N 381.545 5.908 30 20 GKED Cc1ccc(-c2cnc(CCC(=O)N[C@@H](CCCC#N)c3ccccc3)o2)cc1 487293481 BNAIWSYCNOZWBG-NRFANRHFSA-N 387.483 5.134 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(OCc2cscn2)c1)c1ccccc1 488716139 XVVOPOCAAOEOBL-NRFANRHFSA-N 378.497 5.411 30 20 GKED CC(C)(CCC#N)CNC(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 489864049 JULKRHVAXQNEQA-UHFFFAOYSA-N 397.588 5.626 30 20 GKED CSc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccn1 500741634 ZBEYJPXGAAMKRC-UHFFFAOYSA-N 375.453 5.028 30 20 GKED Cc1ccc(-c2nc(C(=O)N(Cc3ccco3)c3ccccc3C#N)cs2)cc1 501002779 VMBIREPLFJAFSB-UHFFFAOYSA-N 399.475 5.430 30 20 GKED Cc1nc(NC(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)sc1SCC#N 504803230 XOPWYYKUVICBJZ-UHFFFAOYSA-N 397.312 5.108 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@@H](C)c1nc2ccccc2n1C(F)F 505060201 DKAFKUHNXGYOSQ-AWEZNQCLSA-N 384.430 5.433 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=O)N[C@@H](C)c1ccc(C#N)cc1 505339332 NEIYYAWSIFNJPI-KRWDZBQOSA-N 389.499 5.550 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N[C@H](C)c2ccc(Cl)cn2)cc1 507210526 LZYZHTIZPBBFQH-OAHLLOKOSA-N 391.858 5.198 30 20 GKED CCCN(CC)Cc1ccc(C(=O)N(CC)[C@@H](C)c2ccc(C#N)cc2)cc1 509239662 LGZNHLRNWQAZSZ-IBGZPJMESA-N 377.532 5.013 30 20 GKED C=CCN(C(=O)c1cccc(Oc2ccncc2)c1)c1nc2c(s1)CCCC2 510209886 PFKLGJMGNKSTHE-UHFFFAOYSA-N 391.496 5.042 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 513200921 KPYHDPLEWKZNRU-QGZVFWFLSA-N 385.467 5.352 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccc(-c2nc(C)cs2)cc1 513974521 PAEUYORDDATFKM-UHFFFAOYSA-N 393.512 5.347 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1[nH]c2ccc(F)cc2c1Cl 517455378 DYHSPZUBQBNAQN-LLVKDONJSA-N 387.867 5.464 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 517511743 OSVBFDNFRNEKBJ-UHFFFAOYSA-N 397.356 5.325 30 20 GKED Cc1ccc(F)cc1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 518150532 DPPZIMBZBZYIFY-UHFFFAOYSA-N 382.382 5.411 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1c(F)cccc1F 522640464 JOLOPMORJARJED-UHFFFAOYSA-N 398.796 5.559 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)N[C@H](C)CCC(C)(C)C)cc1C 522913415 HFXUZJCIHDNUFN-GOSISDBHSA-N 380.536 5.025 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(NC(=O)Nc2ccccc2)ccc1C 523556838 PCOFJYNYIUSFED-UHFFFAOYSA-N 394.519 5.849 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@H](C)O1 523628427 NCNYTIIANFMLBH-CVAIRZPRSA-N 397.906 5.027 30 20 GKED Cc1c(C#N)cccc1NC(=O)N1CCC(Oc2ccc(C(C)C)cc2)CC1 532736487 SVHWUVZRVICIRD-UHFFFAOYSA-N 377.488 5.065 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N(CCC#N)CCC(C)C)cc2)cc1 534807440 WCGLKGAYCPLJDW-UHFFFAOYSA-N 378.472 5.083 30 20 GKED CN(C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)C(C1CC1)C1CC1 536379141 POMFQNSFCXUISA-UHFFFAOYSA-N 380.875 5.265 30 20 GKED CC1CCN(C2CCC(NC3CCC(C#N)(c4ccccc4)CC3)CC2)CC1 540144854 QKIRXRJFRYYDNC-UHFFFAOYSA-N 379.592 5.023 30 20 GKED CCN(C(=O)Cc1ccc(N[C@H](C)c2ccc(C#N)cc2)cc1)c1ccccc1 540838890 IQXWDGFQNBEQFD-LJQANCHMSA-N 383.495 5.327 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)NCc1ccc(F)cc1C(F)(F)F 543047571 UQCKWKBXYIZGSG-UHFFFAOYSA-N 385.323 5.220 30 20 GKED COc1ccc(NC(=O)c2ccccc2-c2ccccc2C#N)c2ncccc12 546021353 CUPRZDZCFIEMDE-UHFFFAOYSA-N 379.419 5.034 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1ccc2ncsc2c1 547944735 KHENIRDOJARPFF-INIZCTEOSA-N 392.528 5.097 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1nc2ccccc2o1 550417671 SELWKUNZMOOKJR-AWEZNQCLSA-N 378.840 5.700 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 553451962 BUHKHMICIKJZRM-IBGZPJMESA-N 393.453 5.105 30 20 GKED CC(C)[C@@](C)(Cc1ccc(Cl)cc1)NCc1nnc(-c2ccc(C#N)cc2)o1 559385589 BPCFBHYPEOLYIU-JOCHJYFZSA-N 394.906 5.009 30 20 GKED N#CCc1ccc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 561777462 NREJQVQNLYYCRW-LJQANCHMSA-N 378.825 5.666 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 572886961 GHTCORDZZOMZQL-ZDUSSCGKSA-N 385.489 5.328 30 20 GKED Cc1ccc2sc(C(=O)[C@@H](C#N)c3nc(-c4ccncc4)cs3)cc2c1 573969820 BAZDCBNPQUHWFL-OAHLLOKOSA-N 375.478 5.218 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@@H](C2CC2)[C@@H]1C1CC1 574886479 NRNCPWAYUJOSEB-GMAHTHKFSA-N 387.483 5.311 30 20 GKED N#CC[C@@H](Cc1nc(C2(c3cccc(C(F)(F)F)c3)CC2)no1)c1ccccc1 583051288 IPTRPRFABPPZMH-INIZCTEOSA-N 397.400 5.408 30 20 GKED Cc1cnc(CNc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)nc1 589055839 DOWDLRJASNJKMJ-UHFFFAOYSA-N 384.361 5.080 30 20 GKED Cc1ccc(-c2ccsc2C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 592974196 POHIPMUUKKSQFO-INIZCTEOSA-N 392.480 5.962 30 20 GKED C[C@H]1CCCCN1C(=O)c1ccc(N[C@H](C)c2cccc(C#N)c2)cc1Cl 600848535 ULHZNAIYPYKWNR-JKSUJKDBSA-N 381.907 5.399 30 20 GKED N#Cc1ccccc1-c1ccc(CSc2ccc(C(=O)N3CCCC3)cn2)cc1 602258540 HAGOLFGCYUOITN-UHFFFAOYSA-N 399.519 5.149 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(Br)cc1F 604007727 WWHYIGOIHIPHTB-UHFFFAOYSA-N 398.235 5.259 30 20 GKED CCN(C(=O)c1cnc(-c2ccccc2Cl)s1)[C@H](C)c1ccc(C#N)cc1 604517404 UCIAACTVNICXIS-CQSZACIVSA-N 395.915 5.558 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)ccc1NC(=O)CC(C)C 608552731 ALJYXTGAVFQXCA-LJQANCHMSA-N 385.467 5.018 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](C)c1c(Cl)cccc1Cl 609377044 NABWCCDTQJMFDY-STQMWFEESA-N 393.339 5.987 30 20 GKED N#Cc1cccc(/C=C\c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c1 609475666 ZASDWHZOYKJKGF-WMZJFQQLSA-N 384.370 5.105 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 610634676 BDZRMMDYZIFXCF-YADHBBJMSA-N 391.515 5.305 30 20 GKED C[C@H](N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cccc(C#N)c1 610830300 KSLVYGYIAZKBJW-IFXJQAMLSA-N 377.488 5.549 30 20 GKED C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1 611561769 LBMNEFZDKKVQIE-RHSMWYFYSA-N 387.405 5.105 30 20 GKED C[C@H](N[C@@H](CC(F)(F)F)c1ccc(Br)cc1)c1cccc(C#N)c1 612574917 YDGFYVVFDHALKX-SJCJKPOMSA-N 397.238 5.665 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Cl)c(C(=O)Nc2ccccc2)c1 666081134 MNCGJZRKSOPPSV-HDICACEKSA-N 395.890 5.307 30 20 GKED N#C[C@@H](C(=O)c1ccc2nc(-c3ccccc3)oc2c1)c1ccc2ccccc2n1 684629637 ATRLFSFTPKDDQO-LJQANCHMSA-N 389.414 5.533 30 20 GKED C#Cc1cccc(NC(=S)N(Cc2ccccc2)c2ccc(Cl)cc2)c1 726469249 KRXRMLFIDXDYCJ-UHFFFAOYSA-N 376.912 5.725 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(OCc3ccc(F)cc3)cc2)cc1 727685381 LHBYVTHAOPYQHO-GIDUJCDVSA-N 389.426 5.259 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(N=Nc3ccccc3)cc2)CC1 730063441 CLXWRAZOOSXZBA-UHFFFAOYSA-N 377.492 5.264 30 20 GKED N#C[C@@H](NC(=O)c1cc2c(F)cccc2s1)c1cccc(C(F)(F)F)c1 731645870 TVPXPZBHUSLKDH-CQSZACIVSA-N 378.350 5.054 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3csc(-c4ccc(F)cc4)n3)c2c1 734307829 SZFDJIIILWTYGY-TWGQIWQCSA-N 378.428 5.335 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](Cc2ccccc2)C2CC2)cc1 736955106 FCWTWEKQQUWKHH-LOSJGSFVSA-N 395.506 5.485 30 20 GKED CS[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 740536372 RZMPBMYNMVAHSZ-LPHOPBHVSA-N 398.940 5.744 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C=C/c3ccnc4ccccc34)n2)cc1 741111429 NRENDIFRUVSSFU-CFGKVWFZSA-N 395.487 5.556 30 20 GKED Cc1sc(NC(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)c(C#N)c1C 741882476 BXRARKSBSUNDHX-UHFFFAOYSA-N 386.398 5.573 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2cccc(Cl)n2)c1 741969472 CZKOGHJFVHFRQC-UHFFFAOYSA-N 382.250 5.107 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 743097850 XXJLBIQIRCIBPG-NRFANRHFSA-N 399.425 5.137 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H](CC2CC2)c2ccccc2)cc1 743097988 ZCXVPWVYUPIDHC-DQEYMECFSA-N 395.506 6.005 30 20 GKED FC(F)(F)c1ccc(CON=Cc2cccc(OCc3ccccn3)c2)cc1 746576206 LUZYEBKSWYRNJR-UHFFFAOYSA-N 386.373 5.230 30 20 GKED C[C@@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccc(C#N)cc1 748679289 DDQWDZZPRPDTRT-CYBMUJFWSA-N 382.872 5.182 30 20 GKED Cc1nn(C)c2ncc(/C=C\C(=O)c3ccc(Oc4ccccc4)c(F)c3)cc12 750912152 DAPQGXINHRJFDP-NTMALXAHSA-N 387.414 5.104 30 20 GKED Fc1cccc(F)c1-c1nc(CON=Cc2ccccc2C(F)(F)F)co1 752761715 SVCIONFZQBKNDF-UHFFFAOYSA-N 382.288 5.189 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCC1CCC(C#N)CC1 755972412 GUCDCHNOIIIHMQ-NFOMZHRRSA-N 388.920 5.242 30 20 GKED C=CCC(CC=C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 758510675 WLSHTSGZXFCBRU-OAHLLOKOSA-N 391.323 6.062 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccnc(Cl)c3)n2)cc1 771261305 MPWHRTJTCMWLQA-IEXSPKMKSA-N 379.872 5.057 30 20 GKED COc1cc(Cl)ccc1NC(=O)c1cccc(OCc2ccccc2C#N)c1 772911792 JDUWUHQUIHOSNJ-UHFFFAOYSA-N 392.842 5.052 30 20 GKED CC(C)(C#N)c1ccc(CN2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)cc1 775601543 WMQCUQUNCVDFFD-QFIPXVFZSA-N 382.935 5.087 30 20 GKED C[C@H](CCCc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 776083827 CILMSLOKIAVSPK-UTKZUKDTSA-N 399.519 5.517 30 20 GKED Cc1cc(-c2cc(C(=O)O[C@@H](C#N)C3CCCCC3)c3c(C)noc3n2)c(C)o1 776371164 OJCMJDGGXQYDKN-IBGZPJMESA-N 393.443 5.037 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)C[C@@H](Cc1ccccc1)c1ccccc1 780165014 PCSKJGOMVWGILQ-SIKLNZKXSA-N 384.479 5.333 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 780576121 JBQGXDQFAQKFGJ-NSHDSACASA-N 399.319 5.276 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NCc1cccc(Oc2ccccc2)c1 780678463 UNOJXYXEBFONFR-QGZVFWFLSA-N 387.439 5.091 30 20 GKED Clc1cc(Br)cc(Cl)c1NN=Cc1scnc1C1CC1 782238321 GZCGJBSJXOXGFS-UHFFFAOYSA-N 391.121 5.536 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccccc1OC(F)(F)F)c1nccc2ccccc12 792092388 QENJZOFIRHCXJQ-KSZLIROESA-N 396.368 5.113 30 20 GKED Cc1ccc(/C=C/C(=O)[C@@H](C#N)c2nccc3ccccc23)c(Br)c1 792104222 NZXUYUPJNMXSTI-GFOMBABLSA-N 391.268 5.195 30 20 GKED Cc1ccc(C(=O)Nc2ccc(OC(=O)C[C@@H](CC#N)c3ccccc3)cc2)cc1 793352385 MQFXWQKIONQNPZ-OAQYLSRUSA-N 398.462 5.240 30 20 GKED N#Cc1cc(/C=C(\Cl)c2nc3cc(Br)ccc3o2)ccc1F 794738424 KHEKFOCYMZTWQI-SDQBBNPISA-N 377.600 5.338 30 20 GKED CC(C)C(=O)c1ccc([C@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 802077171 KTHDLYSVWJOZLG-SUMWQHHRSA-N 394.471 5.254 30 20 GKED C[C@H]1C[C@H](c2ccccc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)C1 806207597 UJXYVTOADZBHLT-HTAPYJJXSA-N 398.466 5.361 30 20 GKED F[C@H](c1ccc(C(F)(F)F)cc1)c1noc(-c2ccnc(C(F)(F)F)c2)n1 809497505 PZDJHGZGNBEAOS-GFCCVEGCSA-N 391.246 5.228 30 20 GKED Cc1cccc(COc2ccc(C(=O)/C=C/c3cn(C)nc3C(F)F)cc2)c1 812241900 OIBANJRWXSDLNT-DHZHZOJOSA-N 382.410 5.141 30 20 GKED CCc1nc(C(C)C)ccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 815010904 SHEXYERMIKHREO-JOCHJYFZSA-N 383.495 5.675 30 20 GKED C=CCc1ccc(OC(=O)CCc2ncc(-c3ccccc3Cl)o2)c(OC)c1 822073759 LTNUFZQANYBEDL-UHFFFAOYSA-N 397.858 5.270 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 835110030 MIEIWIZHVBJYKR-NXEZZACHSA-N 388.361 5.243 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cc(F)c(Cl)nc3Cl)c2C#N)[C@H](C)C1 839389780 SRZHCCAUOMXAKE-HTQZYQBOSA-N 398.290 5.399 30 20 GKED O=C(O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ccc(C(F)F)nc1 846909977 LYGIXXDJJYHFMQ-LBPRGKRZSA-N 399.237 5.498 30 20 GKED CCn1cc(C=Nn2cnnc2SCc2ccc(Cl)cc2)c2ccccc21 915049409 RMPZZAAOWSNYDP-UHFFFAOYSA-N 395.919 5.081 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3Cc4ccccc4S3)n2)cc1 915099844 CYSHBBDUHHOHHT-QFBILLFUSA-N 376.506 5.012 30 20 GKED N#C[C@@H](C(=O)c1cc2c(F)cccc2s1)c1nc(-c2ccccc2)cs1 915102584 YSBKHRADKLLVPG-AWEZNQCLSA-N 378.453 5.654 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)ccc1O 916157649 LPUCJONLYSCKHZ-YWEYNIOJSA-N 399.786 5.119 30 20 GKED Cc1cc(C)c(/C=C\C(=O)[C@@H](C#N)C(=O)Nc2cccc3ccccc23)cc1C 916918110 MBNFFPMOECPYSC-SSSWZJSRSA-N 382.463 5.126 30 20 GKED N#Cc1ccc(OCCCOC(=O)c2ccc(C3SCCCS3)cc2)cc1 918899512 IDMRJFAEEGZKJJ-UHFFFAOYSA-N 399.537 5.053 30 20 GKED O=C(O)c1ccc(C=NN(Cc2ccccc2)Cc2ccccc2)c(Cl)c1 1776023028 DJZJEWNXYWRPNY-UHFFFAOYSA-N 378.859 5.075 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1nc(-c2ccccc2)cs1 1776355031 ABLXVHDDBQAKOQ-PKNBQFBNSA-N 393.464 5.192 30 20 GKED CCCCCCCCCCCN(C)Cc1c(C(=O)O)sc2ccccc12 1776784632 YGBBZQYKIFOPJV-UHFFFAOYSA-N 375.578 6.562 30 20 GKED CCCCCCCOc1cccc(/C=C\c2nc3c(s2)CCC[C@H]3C(=O)O)c1 1776789195 UNRDMGOMNUMDDD-FNDLEWIFSA-N 399.556 6.167 30 20 GKED CCOc1cccc2cc(C(=O)/C=C/c3ccc4oc(C(=O)O)cc4c3)oc12 1776940539 JCBSQHYNYFNGAC-SOFGYWHQSA-N 376.364 5.172 30 20 GKED Cc1cccc2c(C(=O)/C=C/c3ccc(-c4ccc(C(=O)O)cc4)cc3)coc12 1777449023 FWQJDQLOUBJANJ-VGOFMYFVSA-N 382.415 6.003 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(-c2cccc(C(=O)O)c2)s1 1777545339 KBSAYBSZNLUPNQ-NTMALXAHSA-N 394.496 5.404 30 20 GKED C[C@@H](CNC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccccc1 15745011 BQKXHUTXKKVJQK-SFHVURJKSA-N 386.520 5.384 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2nc3ccccc3s2)cc1 22458199 DGKGMTXZMJAVAR-HNNXBMFYSA-N 381.526 5.032 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2cc(F)cc3cccnc23)n1 31616957 PFYFTSUYFVXIGH-UHFFFAOYSA-N 377.366 5.260 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(-c2nnco2)cc1 44575076 YFLUIIZJJWGVGH-UHFFFAOYSA-N 398.447 5.012 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc(Cl)cc2Cl)o1 54851373 TYJVFICUHVWBMC-UHFFFAOYSA-N 387.222 5.289 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1cc2sc(Nc3ccccc3)nc2s1 58272516 GMXXRUZHIUMJSQ-UHFFFAOYSA-N 397.447 5.292 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1nc(C2CC2)no1 108408674 ZNLOZIWZGBBJRD-JTQLQIEISA-N 382.411 5.145 30 20 GKED C[C@H](OCCCNC(=O)Nc1ccccc1SC[C@H](C)C#N)c1ccccc1 108531605 CMUNQGPWMGLFHW-MSOLQXFVSA-N 397.544 5.228 30 20 GKED CC[C@H](c1ccncc1)N(CC)C(=O)Nc1ccccc1S[C@H](C)CC#N 159299597 BFHWCOVPQWLEOU-VQIMIIECSA-N 382.533 5.481 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)CSc1ccc(C#N)cc1 170869794 KBIWLDVUCGHLGZ-UHFFFAOYSA-N 395.709 5.013 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C)c(NC(=O)c2ccncc2)c1)c1ccccc1 187220043 DRAJAXGORKLWDW-QFIPXVFZSA-N 399.494 5.331 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C[C@@H](O)c1ccc(C)cc1 191492101 AZGMFMVSMVPEKJ-JOCHJYFZSA-N 380.532 5.434 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)CC/C=C\c3ccccc3)n2)cc1 255496923 JEFFLBAVOGNITF-CWWFIGIMSA-N 383.476 5.352 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCCCC2(C#N)CCOCC2)cc1 282014227 ORFPTNQZBDZNRY-IBGZPJMESA-N 378.516 5.113 30 20 GKED OC(=Nc1scnc1C1CC1)N1CCC(c2nc3ccccc3s2)CC1 328941020 SQFLGAYBHLGNNP-UHFFFAOYSA-N 384.530 5.055 30 20 GKED CCO[C@H](C)c1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)[C@H](C)CC3)s1 410990421 WMMVSSHPTIPXRP-GRYCIOLGSA-N 389.546 5.112 30 20 GKED COc1ccc(-c2nnc(S[C@@H]3CC[C@H](C#N)C3)n2-c2ccc(C)cc2)cc1 430091677 YNZSFBMAIROAHN-OXJNMPFZSA-N 390.512 5.036 30 20 GKED C=CCOc1ccccc1CN[C@H](C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 433406055 LMIYZZBUNUZQBA-NQIIRXRSSA-N 399.506 5.189 30 20 GKED Cc1cccc(COc2ccc(NC(=O)NCC3CCC(C#N)CC3)c(C)c2)c1 441665604 FEAXEQIUODWBNX-UHFFFAOYSA-N 391.515 5.334 30 20 GKED CCC(CC)CN(CCC#N)Cc1nc(O)c2c(-c3ccccc3)csc2n1 444224838 LQPWOFDYUOOHNE-UHFFFAOYSA-N 394.544 5.216 30 20 GKED C[C@H](CCc1cccc(F)c1)C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 463748578 WDSQSUASMSMFTP-XIKOKIGWSA-N 379.262 5.082 30 20 GKED N#Cc1ccc(NC(=O)c2nc3ccccc3cc2Cl)cc1C(F)(F)F 463963778 KSKMUJNUPBPCBK-UHFFFAOYSA-N 375.737 5.031 30 20 GKED N#CC[C@H](CC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccccc1 474895572 MZMCCFZJUDXFSV-XMSQKQJNSA-N 394.927 5.695 30 20 GKED C[C@@H](Nc1cc(C#N)ccc1C(F)(F)F)c1nc2ccccc2n1C(F)F 475448316 WKZAOXKESJNXAR-SNVBAGLBSA-N 380.320 5.495 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H](C)c1ccc(Br)cc1 476088040 DYSGNFSSFSPATL-HNNXBMFYSA-N 386.333 6.043 30 20 GKED C=C(C)[C@@H](NC(=O)CCCc1ncc(-c2ccccc2)o1)c1ccc(F)c(F)c1 478919319 LRKYDVMMQRNSGN-HSZRJFAPSA-N 396.437 5.376 30 20 GKED C=C(C)[C@@H](NCc1cc(Br)c(OC)s1)c1ccc(F)c(F)c1 479410490 PKUKDKILLYJMFQ-OAHLLOKOSA-N 388.277 5.204 30 20 GKED N#CCCSc1ccccc1NC(=O)Nc1ccc(Br)cc1 479744890 RFGADUICFMLFEC-UHFFFAOYSA-N 376.279 5.099 30 20 GKED C=CCn1c(SCc2ccc(C#N)cc2F)nnc1-c1cccc(Cl)c1 481392057 KGZYETAMRKVHTO-UHFFFAOYSA-N 384.867 5.088 30 20 GKED N#C[C@@H](C(=O)c1sc(C2CC2)nc1-c1ccccc1)c1nccc2ccccc12 483213072 LGRKNWUHDAZPOO-LJQANCHMSA-N 395.487 5.726 30 20 GKED CC(C)c1cc(C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)nn1C(C)(C)C 486580381 INOWCGUOBQOBEW-UHFFFAOYSA-N 396.579 5.086 30 20 GKED Cc1cc(CN[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)ccc1C#N 488130316 VRSWWMJUFRTCPC-QGZVFWFLSA-N 387.458 5.109 30 20 GKED CCn1c(COc2ccc(Cl)cc2)nnc1S[C@@H](C#N)C1CCCCC1 489452959 YANIBMCUOKESJI-KRWDZBQOSA-N 390.940 5.095 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)c(C)o1 496094319 RIFFNBPZPPDFAK-GFCCVEGCSA-N 392.267 5.212 30 20 GKED CCN(C(=O)c1cccc(C#N)c1)[C@H](c1ccc(C(C)C)cc1)c1cccnc1 496446247 HDMXDNBCCQMDPQ-XMMPIXPASA-N 383.495 5.328 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1ccc(Oc2cccnc2)c(F)c1 505044418 AXOGILAOOFMKOT-UHFFFAOYSA-N 391.446 5.453 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12 505201343 QXQDJEPDODTBGL-UHFFFAOYSA-N 396.535 5.091 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)N[C@@H](C#N)c1cccc(C(F)(F)F)c1 505986123 FTRNASSYKNJQJW-HNNXBMFYSA-N 393.434 5.123 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(Cl)c2Cl)nc1)c1ccccc1C#N 508077717 JLFLTNKSDHTUCK-UHFFFAOYSA-N 398.249 5.329 30 20 GKED C=CCCO[C@H](C)c1nc(C2(c3ccc(Br)s3)CCC2)no1 508663682 HGZAPUKLDFVFNI-LLVKDONJSA-N 383.311 5.017 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 509718210 XRRDZAMGAPFNNU-OLCHLOJWSA-N 399.494 5.326 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510663221 FOEVCMAQOFTCBB-UHFFFAOYSA-N 391.858 5.668 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1F 512665510 GIDPCCVZIRMKLU-WAIKUNEKSA-N 384.458 5.024 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Oc2ccccc2)nc1 517456373 JISYYVHRCFWSIR-INIZCTEOSA-N 389.480 5.378 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1c(F)cccc1F 517654889 LKXCLLLITLQDAG-UHFFFAOYSA-N 378.378 5.100 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCC2(c3ccccc3)CC2)cc1 518033354 WFCWNMBJRVETPK-UHFFFAOYSA-N 398.531 5.312 30 20 GKED COc1ccccc1[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccccc1 518166479 PPSHIJBESRUPEN-QHCPKHFHSA-N 399.494 5.407 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN1CCCC[C@H]1c1ccccc1 518634203 ZBBYUCCYFICCQW-NQIIRXRSSA-N 393.556 5.247 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)NCCc1cc(Cl)cc(Cl)c1 519063785 YZTNVYHZCHUSOJ-UHFFFAOYSA-N 390.314 5.029 30 20 GKED Cc1ccnc2sc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c(C)c12 519422603 ARMCINBHAVPKSL-GFCCVEGCSA-N 381.526 5.417 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)nc3)cc2)cc1 520561221 HWBOKHKPOIKLGH-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1cc(Cl)ccc1Cl 521716463 JNOQRHDXTCQKOM-UHFFFAOYSA-N 381.284 5.017 30 20 GKED COc1ccc(CN[C@H]2CCCC[C@H]2c2ccccc2)cc1OCCCC#N 521830576 KSSLDACUTIEGNW-VXKWHMMOSA-N 378.516 5.194 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccccc2Cl)n1)c1nc2ccccc2s1 524076530 BQTAGVPNXYVUOH-LBPRGKRZSA-N 395.896 5.563 30 20 GKED CCc1ccc([C@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)o1 524609859 MWOXQPZPYXSVNW-HXUWFJFHSA-N 379.504 5.792 30 20 GKED Cc1nc(-c2ccccc2Br)sc1[C@H](C)Nc1cccc(C#N)n1 532070077 LOLWLSGEIRMLQA-NSHDSACASA-N 399.317 5.321 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc2c(c1)nc(C(F)F)n2C 538403992 MIHUSUDQGXFPFW-UHFFFAOYSA-N 395.862 5.054 30 20 GKED CC(C)[C@H](NCc1cnc2c(C#N)cnn2c1)c1ccc(C2CCCCC2)cc1 550153614 VRNPXEPPALGSOZ-QHCPKHFHSA-N 387.531 5.136 30 20 GKED CC[C@@H](N[C@H](CCCC#N)c1ccccc1)c1cc(F)cc(Br)c1 556197960 ODYXPIKSAYUDPP-WOJBJXKFSA-N 389.312 6.064 30 20 GKED CC(C)Oc1ccc(N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 564737187 XDKAFMNUXMGIAX-INIZCTEOSA-N 383.517 5.536 30 20 GKED O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1c(F)cc(C(F)(F)F)cc1F 565511008 NERYPEOUEQNMCJ-UHFFFAOYSA-N 391.246 5.050 30 20 GKED O=[N+]([O-])c1ccc(C(F)(F)F)c(CN[C@@H](c2ccc(F)cc2)C(F)(F)F)c1 570531650 JTBLAGXFAFUGCC-AWEZNQCLSA-N 396.262 5.146 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cnc(-c3cccnc3)s1)c2C#N 571979224 ZXELSDSNGQYOSM-NEPJUHHUSA-N 394.525 5.076 30 20 GKED N#C[C@H](C(=O)c1cscc1-c1ccccc1)c1nc2ccccc2n1C(F)F 575737811 NKACNQHADORJNU-CQSZACIVSA-N 393.418 5.650 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cc(Cl)sc4[nH]3)n2)cc1 583234651 QUPBYEUKWGJQMC-ZDUSSCGKSA-N 397.912 5.805 30 20 GKED N#CC[C@H](CC(=O)Nc1cccc2cc(Br)cnc12)c1ccccc1 586874731 LMCGRQGMWHDCIA-OAHLLOKOSA-N 394.272 5.023 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)c2cc(C)c(-c3ccc(F)cc3)s2)cc1 588031478 PGJCPAJIOQGGMM-UHFFFAOYSA-N 394.471 5.031 30 20 GKED C=C(C)CN(CC)C(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 589898534 BJBZJJBXPCZRAY-UHFFFAOYSA-N 381.863 5.095 30 20 GKED N#CC[C@@H]1CCCN(C(=O)CC2(Cc3nc4ccccc4s3)CCCCC2)C1 597915774 QPWBAYAWJVTLEN-SFHVURJKSA-N 395.572 5.332 30 20 GKED CSc1ccc(Cl)c(C(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c1 602756422 SKAIUZAEZHMKDL-JTQLQIEISA-N 376.934 5.372 30 20 GKED CC[C@H](Nc1ccccc1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 609240717 HJDNVBHXWDHXJG-DEOSSOPVSA-N 399.494 5.161 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(C2CC2)nc2ccccc12 609430366 STEZFLHXFLONMT-OAHLLOKOSA-N 387.508 5.759 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609496009 ASSHCVJALYZWFR-UHFFFAOYSA-N 399.494 6.245 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C(C)(C)c1cccs1 609643177 ZCGMUXJYUZRUHG-UHFFFAOYSA-N 376.481 5.637 30 20 GKED C[C@@H](CC(=O)Nc1cccc(OCCCC#N)c1)c1ccccc1C(F)(F)F 610171990 ZHJOBGDIVHKAHA-HNNXBMFYSA-N 390.405 5.520 30 20 GKED Cc1c([C@H](NC(=O)N[C@H](C)c2cccc(C#N)c2)C(C)C)oc2ccccc12 610403047 ZJVWACOJYQVFRN-IIBYNOLFSA-N 375.472 5.370 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)CC)nc2sc(-c3ccccc3)c(C)c2c1=O 613979513 VBMPOHBMTNJBMC-AWEZNQCLSA-N 398.553 5.079 30 20 GKED C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1ccc(C(F)(F)C(F)(F)F)cc1 622842152 FDXGFWBQTPSPPK-BXKDBHETSA-N 389.286 5.144 30 20 GKED COc1ccc(F)c(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)c1 666312240 PVNLKFATGHCLES-UHFFFAOYSA-N 390.299 5.009 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](CO)c1ccc(Cl)cc1 672744572 MXAOBSOMIJPXFE-GOSISDBHSA-N 386.923 5.090 30 20 GKED CCC(CC)(CNC(=O)Nc1cccc(OCC#N)c1)c1ccc(Cl)cc1 726073301 GEHINIZYNYUXPY-UHFFFAOYSA-N 385.895 5.122 30 20 GKED CCCN(Cc1ccccc1O)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 728607278 YPABJOBXRPTZDZ-UHFFFAOYSA-N 386.451 5.109 30 20 GKED Cc1ccc(C2(C(=O)Oc3ccc(-c4ccc(C#N)cc4)cc3)CCOCC2)cc1 731955781 CVFXLLWETODGEQ-UHFFFAOYSA-N 397.474 5.188 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)CSc3ccccc3)n2)cc1 732496482 WPYPRYCWHRGGNO-LPHOPBHVSA-N 392.549 5.723 30 20 GKED Cc1nc(CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cs1 733095520 DMRCSRFNSFPZMB-LJQANCHMSA-N 395.915 5.332 30 20 GKED N#C[C@@H](NC(=O)/C=C\c1cccc(OC2CCCC2)c1)c1ccc(Cl)cc1 733258997 OLMWOICZGDDRLK-YDTSGJJXSA-N 380.875 5.056 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 739142986 NBXLYTDLPNLXSA-KSSFIOAISA-N 382.385 5.624 30 20 GKED CCCN(C(=S)Nc1ccccc1C#N)[C@H]1C[C@H](OCC)C12CCCCC2 741513513 QOBSFZYFZHDPEA-PMACEKPBSA-N 385.577 5.095 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccccc2OCc2cccnc2)cc1F 741846748 IDIKQNMNFNTRRX-NTMALXAHSA-N 379.456 5.418 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(N3CCCCC3)cc2)cc1 746515180 MXUVLTBSXCDYIZ-RUZDIDTESA-N 395.506 5.585 30 20 GKED O=C(CSC(F)(F)F)O[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750202368 GVVOJBJQSGXLSE-SECBINFHSA-N 386.235 5.105 30 20 GKED C=CCC[C@H](NC(=O)N(C)Cc1ccccc1O)c1ccc(C(F)(F)F)cc1 750440477 ABMIUZHPGHBXBW-SFHVURJKSA-N 392.421 5.260 30 20 GKED C[C@@H](OC(=O)c1ccc(C(F)(F)F)cn1)c1ccc(F)c(C(F)(F)F)c1 754371179 JSQHCENCOSGAQN-MRVPVSSYSA-N 381.247 5.176 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(-c3ccccc3)s2)c1 756708730 HSZOEPAYDWTECA-YLJYHZDGSA-N 376.525 5.947 30 20 GKED C[C@H](OC1CCCCCC1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 760366163 UTBLMERAXFDHEC-FDDCHVKYSA-N 376.500 5.408 30 20 GKED CC(C)(C#N)c1ccccc1CN(Cc1ccccc1)C[C@@H](O)c1cccs1 767901443 HJBYTGIDFYPGHC-JOCHJYFZSA-N 390.552 5.285 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccccc1F)C1CCCCC1 780672264 ACRIMAPJIZGVSQ-KRWDZBQOSA-N 395.478 5.483 30 20 GKED N#C[C@@H](C(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1nccc2ccccc12 792095157 KAVIUJCOXUSSPJ-NJDPLYHNSA-N 398.428 5.560 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(N2CCCCCC2)cc1 801778575 POUKKWAAUJMZSD-QGZVFWFLSA-N 378.476 5.002 30 20 GKED N#Cc1sc(NCc2nc3c(s2)C[C@@H](c2ccccc2)CC3)nc1Cl 804618223 OGOSFJOVFIYLSC-LBPRGKRZSA-N 386.933 5.009 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(N2CCCCC2)cc1 806103462 LHZNIWRQLMOJOE-UHFFFAOYSA-N 395.551 5.065 30 20 GKED N#C[C@@H](C(=O)C(c1ccccc1)c1ccccc1)c1cc(C(F)(F)F)ccn1 813215493 ZQLBWLHYGWJVAS-GOSISDBHSA-N 380.369 5.109 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)c1csc(-c2ccc(Cl)cc2)c1 814124030 KZYVUALUIHHKIL-CYBMUJFWSA-N 382.872 5.612 30 20 GKED CC(C)c1cnc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)s1 814731119 KTLSVVPXWFZTGU-UHFFFAOYSA-N 398.344 5.003 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1sc(-c2ccccc2)nc1C 814820378 AJDBYRGRTKIBFC-UHFFFAOYSA-N 379.489 5.013 30 20 GKED CC(=NNc1ccc(Br)nc1)c1sc(-c2ccccc2)nc1C 814847532 RSHAOYBDBWPPEE-UHFFFAOYSA-N 387.306 5.112 30 20 GKED C=CCOc1ccc(CNc2ccccc2NC(=O)OC(C)(C)C)cc1OC 816601512 GKVIYJIISGVPDG-UHFFFAOYSA-N 384.476 5.219 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1oc2ccccc2c1CC 835063378 KQUIPVBVXCXUBY-LJQANCHMSA-N 388.467 5.081 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2ccnc(Cl)c2c1 841819001 YBGNIKNXEXUTHH-UHFFFAOYSA-N 397.910 5.276 30 20 GKED Cc1cc(CNC(C)(C)c2cccc(C#N)c2)cc(C)c1OCc1ccccn1 850354791 ABNOFOWGDMLNEJ-UHFFFAOYSA-N 385.511 5.174 30 20 GKED N#Cc1ccc(Br)c(CNc2cccc(N3CCCCCC3)c2)c1 864013325 PRPJBOVEIDQEGM-UHFFFAOYSA-N 384.321 5.313 30 20 GKED Cc1nn(Cc2ccc(F)cc2)c(Cl)c1/C=C/C(=O)c1ccc(F)cc1F 916128320 YODQXTLZLHVOAB-CMDGGOBGSA-N 390.792 5.207 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 916927214 GDQIREBEDZCIBC-HNNXBMFYSA-N 389.282 5.252 30 20 GKED CCc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043565 JRZWLKJWHXDRLU-INIZCTEOSA-N 396.899 5.351 30 20 GKED COCCOc1ccc(C(=O)/C=C/c2cc(-c3ccccc3)cs2)cc1OC 917517819 LDQAPQGIPWIMBG-MDZDMXLPSA-N 394.492 5.345 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)C[C@@H](C)c2ccc(F)cc2)cc1 918488200 XAPBBQFBZFCVFI-IERDGZPVSA-N 380.463 5.009 30 20 GKED CCc1ccc(C=NOCc2coc(-c3ccc(Br)cc3)n2)cc1 920486267 WKVVYHRTYDVCNJ-UHFFFAOYSA-N 385.261 5.217 30 20 GKED CCC[C@@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 920806983 VEQPRKFVNSCGDB-HZPDHXFCSA-N 396.462 5.848 30 20 GKED CC(C)(C)c1csc(C2CCN(C(=O)Nc3ccc(CCC#N)cc3)CC2)n1 932559735 WWZDWLJZRZCPFK-UHFFFAOYSA-N 396.560 5.308 30 20 GKED C=CCc1cc(C)c(OCCCN2CC[C@@H](CC(=O)O)c3ccccc32)cc1C 1776186132 BPYDVHQECYFKEF-NRFANRHFSA-N 393.527 5.269 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1\C[C@@H](C(=O)O)c2ccccc2C1=O 1776365011 HXMODIITJXYYRF-SICOMBFOSA-N 386.900 5.679 30 20 GKED CC1(C)Cc2cc(/C=C/C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)ccc2O1 1776569374 WWWGCKUBDUSMFT-YCRREMRBSA-N 388.419 5.254 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1c(F)cccc1OC(F)(F)F 1776783760 HFMGLIMIXMGTPK-CYBMUJFWSA-N 379.394 5.018 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)CC2CCCCC2)cc1 1776786966 FTWABMHMCHBRMP-JOCHJYFZSA-N 389.580 5.939 30 20 GKED CCCCOc1cc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)ccc1OC 1776799755 XPYZBMCEFLYJTI-QGOAFFKASA-N 394.467 5.175 30 20 GKED CCc1ccc(C(=O)/C=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)s1 1776966066 SVWPQBJBAPUBNU-VZNHHXIYSA-N 392.476 5.411 30 20 GKED COc1ccc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)cc1C(=O)O 1777360711 CCLWHCDOHKTLRT-VURMDHGXSA-N 382.412 5.157 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)c3ccoc3C)CCC2)cc1 1789453208 NXJLGLVFHZNHNO-FQEVSTJZSA-N 392.499 5.104 30 20 GKED CCCCC[C@@H](C)n1c(SC[C@@H](C#N)CCC#N)nc2ccccc2c1=O 66400050 DBILMCKESRXKOE-IAGOWNOFSA-N 382.533 5.073 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2nc3cc(Cl)ccc3n2C)n1 71960922 RJBQVAJKHMNBAG-UHFFFAOYSA-N 396.825 5.113 30 20 GKED Cc1nc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)sc1SCC#N 110223102 VSKCSCCMOICPPO-UHFFFAOYSA-N 399.928 5.640 30 20 GKED CS[C@H]1CCC[C@@H](NC(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 117317928 XTKUBDAGDDYJDV-MOPGFXCFSA-N 396.581 5.255 30 20 GKED C[C@H](Cc1nnc(SCc2ccccc2C(C)(C)C#N)o1)c1ccccc1 133987136 RBNQHVZXOXYANU-MRXNPFEDSA-N 377.513 5.509 30 20 GKED CCN(C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1)c1ccc(C#N)cc1 151879951 CJQOFOMEFHWHMO-UHFFFAOYSA-N 398.466 5.177 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](c1ccccc1)c1nccs1)c1ccccc1 160510534 ZWWRBEBOFWTSDC-UXHICEINSA-N 377.513 5.239 30 20 GKED N#CCCCCNC(=O)[C@@H](Sc1ccc(F)c(Cl)c1)c1ccccc1 170950386 ICBWVAMTXUHBJS-SFHVURJKSA-N 376.884 5.123 30 20 GKED N#CCSc1cccc(C(=O)N(Cc2ccco2)c2ccc(F)cc2F)c1 175656977 CTBXWEUIJVZQTK-UHFFFAOYSA-N 384.407 5.020 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)[C@H](C#N)c3nc(-c4ccccc4)cs3)c2c1 177603817 YPQBCWCALGLOFR-IBGZPJMESA-N 385.492 5.409 30 20 GKED CC[C@H](CC#N)NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 183818125 XMCUKDCSLVEOKF-CQSZACIVSA-N 382.847 5.087 30 20 GKED CC(C)Cn1c(SCCCCC#N)nnc1-c1ccc(Cl)cc1Cl 195539946 RHXVIVGTBFFAPY-UHFFFAOYSA-N 383.348 5.694 30 20 GKED C=CCn1c(SCc2ccccc2C(F)(F)F)nnc1-c1ccoc1C 255931279 WDTRILCZRGBDPK-UHFFFAOYSA-N 379.407 5.344 30 20 GKED CO[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)[C@H](C)C1 282662975 JWMNHTQIMKFLEQ-XFQXTVEOSA-N 397.906 5.027 30 20 GKED CC[C@H](Nc1ccc(C(F)(F)F)c(C#N)c1)c1nc(C(F)(F)F)cs1 302199012 QKCTXODEFJHAOT-NSHDSACASA-N 379.329 5.616 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccccc1CN1CCCC[C@@H]1C 410354200 NSLPBOSBMIIUQC-IBGZPJMESA-N 397.588 5.020 30 20 GKED COc1cc(Cl)ccc1[C@@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 421836061 GKEWMLFKBIGKNZ-OAHLLOKOSA-N 397.906 5.105 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H]1CCSc2ccc(Cl)cc21 425639989 OVDSAXDAVSEETB-UGSOOPFHSA-N 385.920 5.151 30 20 GKED CCCOc1cccnc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 429116112 QFKBDGXBIASGMQ-HNNXBMFYSA-N 397.887 5.137 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430588873 ATMALGDZNXMEAP-CQSZACIVSA-N 381.526 5.363 30 20 GKED CCc1c(C)sc(NC(=O)C23C[C@@H]4C[C@H](C2)CC(C(F)(F)F)(C4)C3)c1C#N 433706797 JIJUAPCHEVBILC-NFAYLAGKSA-N 396.478 5.578 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(C(=O)OC(C)(C)C)cc1 434881807 XPVPOWYYXOTVBH-MRXNPFEDSA-N 382.529 5.648 30 20 GKED C=CCC[C@@H](NC(=O)c1ccc(C)c(NC(=O)c2ccco2)c1)c1ccccc1 435266332 JOKOGWGXZCMJQZ-HXUWFJFHSA-N 388.467 5.278 30 20 GKED N#CCCN(C(=O)CSc1nc(-c2ccccc2)co1)c1cccc(Cl)c1 436247371 OMFXEFGNIVPHMG-UHFFFAOYSA-N 397.887 5.034 30 20 GKED CC(C)CN1Cc2cccc(NC(=O)c3ccccc3-c3ccccc3C#N)c2C1 438340289 GWCHFLWYNBFBIK-UHFFFAOYSA-N 395.506 5.449 30 20 GKED C=CC[C@H](CC)NC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 439377073 IVVCWWGDEPRXOO-HNNXBMFYSA-N 389.858 5.208 30 20 GKED N#Cc1ccccc1SCC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1 439704746 CGBKERNNDAVHGP-QFIPXVFZSA-N 392.911 5.210 30 20 GKED CC(C)[C@H]1CCCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 444825165 KQAKMCMFXREUCQ-NRFANRHFSA-N 391.515 5.232 30 20 GKED C/C=C/COc1cccc(CC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 448944770 TWOBWHXCTWSWQE-REMYHPOOSA-N 380.513 5.217 30 20 GKED C=CCC1(C(=O)Nc2ccc(OC)c(Oc3ccc(C)nn3)c2)CCCCC1 450318126 JKKXXWBNIGWSDE-UHFFFAOYSA-N 381.476 5.051 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCC[C@H]1c1cccc(Cl)c1 453470129 ZMXHJFNSLKFZND-RBUKOAKNSA-N 386.927 5.091 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1)c1ccccc1 458807859 YAAHOTDYLQSQFQ-FGZHOGPDSA-N 379.479 5.497 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)N[C@H](CCCC#N)c1ccccc1 458808288 YWHXVTXNZQOFER-NHCUHLMSSA-N 393.535 5.088 30 20 GKED CC#CCCCC(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 466433477 CTZJVQIHNDAINH-QHCPKHFHSA-N 376.525 5.428 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)C[C@@H]1COc2ccccc2O1 475558451 JMCRJYKHXMHMBR-LJQANCHMSA-N 394.515 5.232 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc(Oc2ccc(F)cc2)cn1)c1ccccc1 475636341 BCABEHQDZAJPEG-KRWDZBQOSA-N 375.403 5.039 30 20 GKED C=C(C)[C@@H](NCc1nc2cc(C(F)(F)F)ccc2o1)c1ccc(F)c(F)c1 481578498 CWEHXIJERXHVSA-GOSISDBHSA-N 382.332 5.532 30 20 GKED N#CCCC[C@H](NC(=O)CCCc1ccccc1Br)c1ccccc1 487215735 BXGAQCNEBMIXRV-FQEVSTJZSA-N 399.332 5.323 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(OCc2ccc(F)cc2)cc1 499601958 HJVGVBFNQNTPHH-LJQANCHMSA-N 396.506 5.156 30 20 GKED CCC[C@@H]1C[C@H](C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CCO1 502799645 SPIVZEITCQITAZ-IFMALSPDSA-N 394.490 5.134 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1c(F)cccc1F 505352017 KHEOTCROZNZUMJ-CYBMUJFWSA-N 383.238 5.017 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(=Cc3cccc(F)c3)CC2)cc1 510608006 YRGJNCADJUURDT-UHFFFAOYSA-N 377.463 5.338 30 20 GKED CCc1csc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)n1 513198070 ZCOXKUSQWJBSQG-SFHVURJKSA-N 395.915 5.196 30 20 GKED N#Cc1ccc(SCc2csc(-c3ccc(C(F)(F)F)cc3)n2)nc1 514539639 MNJVULOIINVVOQ-UHFFFAOYSA-N 377.416 5.388 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1Br 519847670 ZAVIOALGBUJHTL-IFXJQAMLSA-N 375.285 5.674 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 520855260 GKMZRCPQIFCACH-MGPUTAFESA-N 399.535 5.986 30 20 GKED N#C[C@@H](NC(=O)c1ccnc(Oc2ccccc2)c1)c1ccc(Cl)c(Cl)c1 521886388 VGAGGKZUFXGUNE-GOSISDBHSA-N 398.249 5.175 30 20 GKED C[C@H](Oc1ccccc1NC(=O)CSc1ccc(C#N)cc1)c1ccccc1 524528397 WYRJVKURUBFCFE-KRWDZBQOSA-N 388.492 5.429 30 20 GKED COc1ccc(C[C@@H](N[C@H](C)c2ccc(C#N)cc2)c2ccc(OC)cc2)cc1 525248043 YGQYAHGFRFWEIE-IQGLISFBSA-N 386.495 5.210 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)Cc2cccc(C#N)c2)nc1-c1ccccc1 530675199 JKSCHQIFBGHSDH-NRFANRHFSA-N 399.494 5.243 30 20 GKED CC1CC(C#N)(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)C1 531563962 VTUNXKDLYHAZFL-UHFFFAOYSA-N 375.403 5.045 30 20 GKED N#Cc1ccc(SCc2nc(O)c3c4c(sc3n2)CCCC4)c(Cl)c1 532856754 OQPPESVHIWPRIA-UHFFFAOYSA-N 387.917 5.093 30 20 GKED C[C@@H](Nc1cccc(C#N)n1)c1nc(-c2ccc(Br)cc2)cs1 535888017 JQRURPQXUQMHNF-LLVKDONJSA-N 385.290 5.012 30 20 GKED CCCCc1ccc([C@@H](NCCCC2(C#N)CCOCC2)c2cccs2)cc1 538610483 YBYFJYNDDIOSJH-HSZRJFAPSA-N 396.600 5.870 30 20 GKED Cc1nc(C2CCCCC2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 539264281 YHLLYPHIOHMDEN-CQSZACIVSA-N 381.526 5.599 30 20 GKED N#CCC1CCN(C(=O)c2ccc(-c3cc(Cl)cc(Cl)c3)s2)CC1 541976558 AWAHOHBVYHUPTF-UHFFFAOYSA-N 379.312 5.488 30 20 GKED C[C@@H](NC(=O)c1ccc(C2(C#N)CC2)cc1)c1ccc(-c2cccc(C#N)c2)cc1 542991427 DUMPSFXMRHUHTQ-GOSISDBHSA-N 391.474 5.271 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN1CC(C)(C)[C@H]1c1cccs1 558175798 JUXFMBRNAZHDQG-MGPUTAFESA-N 399.585 5.021 30 20 GKED Cc1ccc([C@@H](NC(=O)CSc2cccc(F)c2C#N)c2cccs2)cc1 566047609 ZHRUPJZSRUFMGM-OAQYLSRUSA-N 396.512 5.065 30 20 GKED C=CCn1c([C@@H](C)Oc2ccccc2F)nnc1N1CCC[C@H]1c1ccccc1 577563481 RZPFTCDQODFUIQ-XLIONFOSSA-N 392.478 5.085 30 20 GKED N#CCCn1cc(CN2CC[C@H]2c2ccc(Cl)cc2)c(-c2ccccc2)n1 583922932 KEMGTLUBHPRWDU-NRFANRHFSA-N 376.891 5.064 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cncc(C(F)(F)F)c3)cc2)c1 584433031 GVERTCKQMMCBLT-UHFFFAOYSA-N 383.329 5.017 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@H]1CCC[C@H](C(F)(F)F)C1 591781589 URPGQFPSFXHLLH-ONGXEEELSA-N 389.286 5.648 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)c1 598809203 VLBGAKJLGRQONY-UHFFFAOYSA-N 398.331 5.276 30 20 GKED Cc1cc([C@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c(C)s1 603693571 ZBYFVJNCNQEMRB-AWEZNQCLSA-N 392.484 5.307 30 20 GKED C[C@H](NC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1ccc(C#N)cc1 603872431 SPPTVUYODUBZDB-NWDGAFQWSA-N 379.312 5.223 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1ccc(C(F)F)cc1 608804178 NHPQUMQTOMFSDF-UHFFFAOYSA-N 379.366 5.244 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC4(CCCCC4)CC3)s2)cc1 608838319 LJNZFRMTSXNOJL-UHFFFAOYSA-N 394.544 5.184 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 609402860 DXJGTOXZYNTIAI-RXVVDRJESA-N 393.556 6.088 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1C 609428267 HZGPDQDLLDNRNV-QGZVFWFLSA-N 384.570 5.819 30 20 GKED CC(C)c1nc2cc(NCc3cn(CCC#N)nc3-c3ccccc3)ccc2o1 610909719 RKVZMCHZQWEMRH-UHFFFAOYSA-N 385.471 5.340 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1C 613403057 BPJONRWREQYPBH-NSHDSACASA-N 394.443 5.738 30 20 GKED Cc1ccc(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1F 642399857 JGHPCJSQGOQSSZ-UWVGGRQHSA-N 386.311 5.165 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(Cl)c2ncccc12 672624530 TYMXPOCCXFEJFF-UHFFFAOYSA-N 397.910 5.276 30 20 GKED CC(C)N(CCc1nccs1)C(=O)Nc1cccc(C#Cc2cccs2)c1 677196641 JAQAKOOIUMTLOO-UHFFFAOYSA-N 395.553 5.089 30 20 GKED COc1cccc(NN=Cc2cn(Cc3ccccc3)nc2-c2cccs2)c1 725852794 GEBOJLQTBXCXLB-UHFFFAOYSA-N 388.496 5.115 30 20 GKED C#Cc1ccc(C(=O)N(CC)Cc2ccc(-c3ccc(C(F)(F)F)cc3)o2)nc1 728861426 QLBYFQLYCIWTFK-UHFFFAOYSA-N 398.384 5.004 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2sccc2OC(F)F)cc1 729316615 OUFULSHWKQKUOM-MRXNPFEDSA-N 384.407 5.257 30 20 GKED C#CCOc1ccc([C@@H](C)OC(=O)Cc2sc(C)nc2-c2cccs2)cc1 730425220 IDDFNORROPZDMH-CQSZACIVSA-N 397.521 5.039 30 20 GKED COc1ccc(OC)c(C(=O)/C=C\c2ccc(Oc3cccnc3)c(C)c2)c1 732713460 DYVSIGBVCFDZRN-TWGQIWQCSA-N 375.424 5.096 30 20 GKED CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 738896233 MYORIACEIQVYAX-CDNPAEQRSA-N 375.516 5.775 30 20 GKED CC(C)(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc([N+](=O)[O-])cc1 739512338 TYCQSFGTJBUQDU-JOCHJYFZSA-N 399.450 5.167 30 20 GKED O=C(/C=C/c1cnc2ccc(Br)cn12)c1cccc2ccccc12 740764387 UHIROICKHBPWTD-MDZDMXLPSA-N 377.241 5.146 30 20 GKED CCCCCCCCCCC(=O)N1CCc2c(cccc2N2CCOC2=O)C1 742797984 MFFYIJMHEOQOLV-UHFFFAOYSA-N 386.536 5.059 30 20 GKED CCOc1cccc(NC(=S)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 742984822 NKFCHCFZXWLWBT-QFIPXVFZSA-N 387.508 5.550 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2c(Cl)cccc2Cl)cc1 747359795 VZNILUOSFDSBRR-QGZVFWFLSA-N 381.262 5.901 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1ccccc1-c1ccccc1 750979174 BNBSKRDEXNHCTF-UHFFFAOYSA-N 398.984 6.454 30 20 GKED Cc1nnc(SCc2cc(Cl)ccc2OCC#N)n1[C@H]1CCC[C@@H](C)C1 758168619 JMVRAJAJCLJUSL-DYVFJYSZSA-N 390.940 5.186 30 20 GKED COc1cc(Cl)ccc1NC(=O)c1ccccc1Sc1ccccc1C#N 776408325 MDDIBTCJOMOHMW-UHFFFAOYSA-N 394.883 5.624 30 20 GKED C=CCC[C@@H](NC(=O)Cc1ccccc1CC#N)c1ccc(C(F)(F)F)cc1 777051238 ULRRMQZZOINQLI-HXUWFJFHSA-N 386.417 5.138 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2CCC(=O)c3ccccc32)cc1 785852741 VFDMPGITIBLWLA-GOTSBHOMSA-N 380.447 5.041 30 20 GKED O=C(/C=C\c1ccc(Cl)cc1-n1cncn1)c1cc(Cl)sc1Cl 794937780 JBPGQRMQISGOGY-RQOWECAXSA-N 384.675 5.185 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1CCC(F)(F)C1 797869869 BVCUFVNGNFCERB-SFHVURJKSA-N 386.417 5.365 30 20 GKED Cc1ccc(C)c(OCCCCC(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813212334 BQDOOMRVEGEWQU-KRWDZBQOSA-N 390.405 5.143 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1SC(F)(F)F)c1ccccc1 814615767 IFWQJYCJVBLONE-HNNXBMFYSA-N 393.434 5.855 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1sc(-c2ccc(F)cc2)nc1C 814820424 BZOIBOWPMXRJIB-UHFFFAOYSA-N 397.479 5.152 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)N(C)[C@H](C)c2cccs2)s1 819122266 UERYWWSUDQOCHD-GFCCVEGCSA-N 386.995 5.120 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1ccc(Cl)nc1Cl)c2C#N 839388248 JURJPHDNPRVLBJ-BDAKNGLRSA-N 380.300 5.260 30 20 GKED N#C[C@@H](C(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1nc(C2CC2)cs1 842939762 XDWXNMJNQUNYRW-RJNRQISESA-N 396.821 5.582 30 20 GKED CC(C)Cc1ccc(C(=O)CCC(=O)[C@H](C#N)c2nc(C3CC3)cs2)cc1 842939934 UTNYCYIIZPKVJC-SFHVURJKSA-N 380.513 5.058 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccccc3C)n2)cc1 850790165 LFZONSUXDKUPCY-ZCNNSNEGSA-N 388.492 5.107 30 20 GKED CCCCOc1ccc(C=NOCc2coc(-c3ccccc3)n2)cc1OC 852906315 WQWZSIZELRMGEV-UHFFFAOYSA-N 380.444 5.080 30 20 GKED CCCCc1oc2ccccc2c1CN(C)C(=S)Nc1ccccc1C#N 915996155 IIMUMARGSBJQAB-UHFFFAOYSA-N 377.513 5.476 30 20 GKED CC(=NNc1nc(C)nc2sc(-c3ccccc3)cc12)c1nc(C)sc1C 916311394 DJQJFIRQWDMCCK-UHFFFAOYSA-N 393.541 5.576 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Cc3ccc(-n4cccc4)cc3)n2)cc1 916974008 CSALSLZSKCHTQB-OAQYLSRUSA-N 397.503 5.328 30 20 GKED C[C@@H](Cc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921132365 QATCJXRJTVUXKT-SCLBCKFNSA-N 398.890 5.658 30 20 GKED CCC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccc(OC(F)(F)F)cc1 1776033875 SCPVZAJTKXEURC-UHFFFAOYSA-N 386.757 5.163 30 20 GKED O=C(/C=C/c1cc(F)c(C(=O)O)cc1F)c1ccc(OCc2ccccc2)cc1 1776127341 QFENNWMDMBUUIY-DHZHZOJOSA-N 394.373 5.138 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C/c2sc3ccccc3c2Cl)c1)C(=O)O 1776472559 DZUYCNHIMXLTMT-VMPCVLLUSA-N 386.856 5.303 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)cc1 1776699919 GRGPWFWDSALRCA-VVOKDJNJSA-N 387.273 5.557 30 20 GKED COc1cc2ccccc2cc1/C=C\C(=O)c1cc(C(=O)O)ccc1OC(C)C 1777339066 BHNJNYIBYLIJTC-NTMALXAHSA-N 390.435 5.230 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 25117702 YFDRUSYUPRUHQH-UHFFFAOYSA-N 393.446 5.152 30 20 GKED CC(C)Oc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 51157214 QACWBUFACXHLMI-MRXNPFEDSA-N 397.887 5.136 30 20 GKED N#C[C@@H](C(=O)c1ccc(SCc2ccccc2)cc1)c1nc2ccccc2o1 54736759 ULOZSKWZIQCZDM-IBGZPJMESA-N 384.460 5.610 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2ccccc2C)cs1 54897261 PUDWYVJNHLWFAA-FMIVXFBMSA-N 396.899 5.686 30 20 GKED Cc1ccc(Oc2ccc(NC(=O)N(C)Cc3ccc(C#N)cc3)cn2)cc1C 57711008 YFYDRPPXVLZOST-UHFFFAOYSA-N 386.455 5.026 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(OC(F)F)cc2)nnc1-c1ccccc1 63413973 UCZIKKXQCHTSAM-CQSZACIVSA-N 387.455 5.586 30 20 GKED N#Cc1ccc(OCc2coc(-c3ccc(Br)cc3)n2)c(Cl)c1 63846623 RXBALNLTTVJNDB-UHFFFAOYSA-N 389.636 5.208 30 20 GKED C[C@H](C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccsc1 120188113 UPMYBQFAMUIDLG-NSHDSACASA-N 384.448 5.515 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3sccc3C)n2)cc1 129593208 CHZNARZHIVFHFV-BRWVUGGUSA-N 394.521 5.169 30 20 GKED CCSc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)c1 154390782 CNJOSPSDTBIIGC-GOSISDBHSA-N 389.505 5.284 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(CC(C)C)cc2)=C(/S)N[C@H](C)CC)cc1 154475221 AESMKEWTABYYKC-GOSISDBHSA-O 397.608 5.062 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)N[C@H](CCC#N)c1ccccc1 160970785 FHBFIEVOQXGPSF-QGZVFWFLSA-N 386.293 5.233 30 20 GKED N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)Nc2ccc3[nH]ccc3c2)cc1 171386038 DURQSOKGMVOECO-UHFFFAOYSA-N 398.441 5.413 30 20 GKED CCc1cccc(CC)c1NC(=O)/C(=C\c1cccnc1C)C(=O)c1ccccc1 171418927 OUTWKFLSICNBEV-QJOMJCCJSA-N 398.506 5.420 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 171797786 AWWMWSMGWPDDGA-CECLQJIQSA-N 387.439 5.101 30 20 GKED N#CCCn1cc(CNc2cccc(Oc3ccccn3)c2)c(-c2ccccc2)n1 181435627 PMKSKACLQITOFE-UHFFFAOYSA-N 395.466 5.263 30 20 GKED CCc1ccc([C@@H]2CCCCCN2C(=O)Nc2ccccc2O[C@H](C)C#N)o1 184303500 SZTSZUHKOAIXMH-APWZRJJASA-N 381.476 5.282 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(Cn2ccnc2)c1 191438439 IMNDRPOCLJALTQ-UHFFFAOYSA-N 388.515 5.105 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)ccc1OC 237295912 FBUIBELIBAGZIO-KRWDZBQOSA-N 394.540 5.624 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 247430753 WHFSCYJISUGKSX-BHIYHBOVSA-N 393.556 5.657 30 20 GKED C[C@@H](CC#N)Sc1ccccc1N=Cc1cc(Cl)cc([N+](=O)[O-])c1O 255118143 UWTFYMDWKGYPIS-NSHDSACASA-N 375.837 5.099 30 20 GKED CC(=O)N(c1nc(/C=C2\CCCC(C)(C)C2=O)cs1)c1ccc(F)cc1F 255712565 ITJSDNZYDHEUDT-UKTHLTGXSA-N 390.455 5.269 30 20 GKED Cc1cc(O[C@@H](C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)ccc1Cl 303278339 JJLGSKMEHICRGV-ZFWWWQNUSA-N 388.920 5.306 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1 303936992 YBIUSBOUVODRBM-INIZCTEOSA-N 391.433 5.107 30 20 GKED OC(=Nc1ccccc1OC[C@H]1CCCCO1)N1[C@H]2CC[C@H]1c1ccccc12 329792352 VCCQZGWANWHZSM-CZAAIQMYSA-N 378.472 5.072 30 20 GKED CCC/N=C(/O)c1ccc(N=C(O)N(C)[C@@H](C)C2CCCCC2)cc1Cl 330430046 HWOVXJDVVJQZPD-AWEZNQCLSA-N 379.932 5.501 30 20 GKED C=CCCc1ccccc1NC(=O)c1ccc(OCc2cscn2)c(OC)c1 410343430 GHLMMUWOIHKBAS-UHFFFAOYSA-N 394.496 5.102 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](CC(F)F)c1ccccc1 421066317 PQQPQAOGOJMVCF-RHSMWYFYSA-N 389.471 5.456 30 20 GKED C=CCC1(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)CCOCC1 424650490 YIPTXYDPLSIPQC-UHFFFAOYSA-N 383.463 5.025 30 20 GKED CC(C)n1nc(-c2ccccc2)cc1NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1 425648207 GFVVQZRZLMKVQP-KRWDZBQOSA-N 387.487 5.228 30 20 GKED C=C(C)[C@H](NC(=O)CCCCC(=O)c1ccc(F)cc1)c1ccc(F)c(F)c1 427815285 FJHIQHLDIBFCCX-QFIPXVFZSA-N 389.417 5.281 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@H](c1ccc(Cl)cc1)C1CC1)c1ccccc1 431773038 NOTGVUAJGBUSED-RTWAWAEBSA-N 381.907 5.525 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](C)c1nc(C)cs1)c1ccc(C(F)(F)F)cc1 440836712 WSYCTVWFXDJGHC-XJKSGUPXSA-N 397.466 5.538 30 20 GKED COc1ccc(C(=O)CCCCCC(=O)Nc2ccc(CC#N)cc2Cl)cc1 452646725 FZKYYQJOKPCQGB-UHFFFAOYSA-N 398.890 5.187 30 20 GKED N#CC1(C(=O)Nc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)CCCCC1 461700946 AJNRMCZMJZCEQB-UHFFFAOYSA-N 388.393 5.257 30 20 GKED CN(c1ccccc1)c1ccccc1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464468522 PYGVZGVHNXFTMA-SFHVURJKSA-N 395.384 5.358 30 20 GKED C=C(C)C[C@@H](C)C(=O)NCc1ccc(Cl)c(NC(=O)[C@H](C)CC(=C)C)c1 466415471 GNRHLSGGCVLIDR-HZPDHXFCSA-N 376.928 5.099 30 20 GKED C=C(C)C[C@H](C)C(=O)Nc1ccc(N(C)C(=O)[C@@H](C)CC(=C)C)c(Cl)c1 466873447 JHMKMVHLFQCYCF-HOTGVXAUSA-N 376.928 5.446 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)c1cccc(OCc2c(C)noc2C)c1 470649585 NWQRFUWIFUTENM-UHFFFAOYSA-N 390.483 5.089 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21)c1ccccc1 475447212 USTPLBLVBBQSIU-XUZZJYLKSA-N 396.490 5.381 30 20 GKED N#CC[C@@H](CC(=O)N1CC=C(c2ccccc2C(F)(F)F)CC1)c1ccccc1 476331223 AVYGCAUXBIAGOX-IBGZPJMESA-N 398.428 5.409 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(Br)cccc2[nH]1 476802875 XCTAGUZBNCCYTC-UHFFFAOYSA-N 397.316 6.035 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc(Cc2ccc(F)cc2)no1)c1ccc(F)c(F)c1 481579717 HVORKHNLRKCRCX-RNODOKPDSA-N 387.405 5.046 30 20 GKED CCOc1nc(C)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 482562822 VBICKXHRGUSNKA-MRXNPFEDSA-N 397.887 5.056 30 20 GKED C[C@H](C(=O)Nc1cc(Cl)ccc1NCc1ccccc1)c1cccc(C#N)c1 486622269 ALAGQQUUAJANIO-INIZCTEOSA-N 389.886 5.566 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cc(C)c(F)c(C)c1 488538435 DOORQMPWCDPWDJ-UHFFFAOYSA-N 375.403 5.062 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1cc(F)ccc1SCC(F)F 491999405 MRCZJIJODLORRB-UHFFFAOYSA-N 384.423 5.039 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 498447937 GWASNALWQVDMJG-UXHICEINSA-N 386.417 5.119 30 20 GKED CCC[C@H]1C[C@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 503353388 OGMXMBFMGWSEHV-QAPCUYQASA-N 382.435 5.023 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)Nc3cc(-c4ccccc4)ns3)CC2)cc1 503492812 WZVVAMAIOBQFFR-UHFFFAOYSA-N 386.480 5.003 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)CCSc3ccccc3Cl)CC2)cc1 503901921 PAGRMTLLRPHMIC-UHFFFAOYSA-N 382.916 5.010 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1ccccc1Cl 505704196 BGYUHDBCRDMUCM-GOSISDBHSA-N 398.249 5.175 30 20 GKED COc1ccc2cc(CN(C)C(=O)Nc3ccc(C#N)c(Cl)c3)ccc2c1 515229905 QPYKARKWCPIFPE-UHFFFAOYSA-N 379.847 5.037 30 20 GKED Cc1c([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)oc2ccccc12 519888999 QLUCGYRFHIKDRD-SFHVURJKSA-N 389.499 5.542 30 20 GKED COc1ccc([C@@H](C)NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)cc1 520179006 KGMRYGTUFLFBIL-MRXNPFEDSA-N 387.439 5.242 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1cccs1)C(CC)CC 521077346 JZZOCIZDWSVVKB-OAQYLSRUSA-N 381.545 5.495 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)C1CC1)c1ccc(C#N)cc1 521278572 RRYCWIHFJDFFEI-CYBMUJFWSA-N 388.298 5.300 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)CC2CCC(c3ccccc3)CC2)cc1 521712522 IFUCFSFIUTZUTO-UHFFFAOYSA-N 391.515 5.297 30 20 GKED CSc1cccc(N(C)C(=O)c2ccc(OCc3ccccc3C#N)cc2)c1 523167863 WHZUVQUUDDOKHN-UHFFFAOYSA-N 388.492 5.136 30 20 GKED CC(C)Cc1ccc([C@@H](NC(=O)N(C)Cc2ccc(C#N)cc2)C2CC2)cc1 523220333 KTUNGIOGWXVVOP-HSZRJFAPSA-N 375.516 5.049 30 20 GKED CC[C@@H](NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1)c1ccncc1 534157828 KYXXHLGJNNDDHB-LJQANCHMSA-N 391.858 5.280 30 20 GKED CCc1cccc2c(C3CCN(C(=O)c4ccc(Cl)c(C#N)c4)CC3)c[nH]c12 537585798 BKSGJGJKPUHZIB-UHFFFAOYSA-N 391.902 5.275 30 20 GKED C=CCC[C@@H](NCc1nc(-c2ccccc2)no1)c1ccc(C(F)(F)F)cc1 538229296 GIDBUENXEJDPSU-GOSISDBHSA-N 387.405 5.553 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)c(F)c1 538509840 VTTDETHCQCUBTH-QWHCGFSZSA-N 399.922 6.195 30 20 GKED CCCc1cnc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)s1 539632737 SSELLRIGAWPZQU-UHFFFAOYSA-N 393.537 5.512 30 20 GKED N#CCC1CCN(C(=O)c2cc(Cl)ccc2Oc2cccc(Cl)c2)CC1 542905427 OPOJTJXXNANKOW-UHFFFAOYSA-N 389.282 5.552 30 20 GKED C[C@@H](N[C@H](C)c1nc2ccccc2n1C)c1ccc(-c2cccc(C#N)c2)cc1 543033539 FPMOGCQROYOKKV-QZTJIDSGSA-N 380.495 5.524 30 20 GKED N#CCCN(C(=O)CNc1cccc(C(F)F)c1Cl)c1cccc(Cl)c1 543659768 VEYZUVODRVLZMP-UHFFFAOYSA-N 398.240 5.290 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 544889663 MBCXHINWAPDUMF-AWEZNQCLSA-N 377.366 5.203 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 549185734 CMRCHOSZOVCNQV-ZDUSSCGKSA-N 398.322 5.431 30 20 GKED Cc1c(C(=O)Nc2cnccc2-c2cccc(F)c2)sc2ccc(C#N)cc12 551775809 NEBUHJYMYVJNCT-UHFFFAOYSA-N 387.439 5.535 30 20 GKED C=CCN(C(=O)C1CCC(OC(F)F)CC1)c1nc(-c2ccccc2)cs1 558008402 ZXEDGYUPKASJTF-UHFFFAOYSA-N 392.471 5.127 30 20 GKED N#CCc1ccc(NC(=O)CS[C@@H](c2ccccc2)c2ccc(F)cc2)cc1 558756256 YKCZGVQXLHLZMV-QHCPKHFHSA-N 390.483 5.353 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@H]3C(F)F)cc2Cl)cc1 562131642 HLNWCJQKIWLUJP-MRXNPFEDSA-N 391.805 5.265 30 20 GKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1nc(-c2cccs2)no1 574209411 LQTJVXZDXAAGCG-CYBMUJFWSA-N 389.440 5.030 30 20 GKED Cc1onc(C2CC2)c1C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 577597019 QHQUEUJPGMXPBU-ZDUSSCGKSA-N 383.517 5.197 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)sc1-c1ccc(F)cc1 588348319 IRIZDLXRQIQLHN-SFHVURJKSA-N 386.451 5.901 30 20 GKED C[C@@H](N[C@H](C)c1nccc2ccccc12)c1ccc(-c2cccc(C#N)c2)cc1 589343926 ICGPMQUWYJRLNQ-RTBURBONSA-N 377.491 6.185 30 20 GKED N#CCCC1CCN(C(=O)Nc2cccc(CSCc3ccccc3)c2)CC1 592230528 ONKBDRGAEJZTHG-UHFFFAOYSA-N 393.556 5.668 30 20 GKED CCC(C#N)(CC)C(=O)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 599156598 DMTXPLNWCIOCSD-UHFFFAOYSA-N 384.867 5.252 30 20 GKED Cc1cc(O[C@@H](C)C(=O)N(Cc2ccco2)c2ccccc2C#N)ccc1Cl 603956601 WJUVCNGJVXMKBW-INIZCTEOSA-N 394.858 5.114 30 20 GKED CC(C)COc1cccc(NC(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 609057180 DOPJQKBMNHHXLF-UHFFFAOYSA-N 390.439 5.017 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)COc1c(Cl)cccc1Cl 609371021 UCJFVFQKYAZYAZ-LBPRGKRZSA-N 395.311 5.405 30 20 GKED N#Cc1ccccc1COc1cccc(CNCc2ccccc2C(F)(F)F)c1 609433305 UFKYKQXSGVMIPF-UHFFFAOYSA-N 396.412 5.446 30 20 GKED Cc1ccc(Cl)c(O[C@H](C)C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1 609460840 BRPCNBRFUACNNA-BDJLRTHQSA-N 397.689 5.104 30 20 GKED CC(C)c1ccccc1OCCNC(=O)Nc1ccccc1SC[C@@H](C)C#N 609555375 GZODERWKCKLCPL-KRWDZBQOSA-N 397.544 5.262 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCSC[C@H]1c1ccccc1 609682422 JNBWBPGIJKCAGX-LPHOPBHVSA-N 397.569 5.403 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N(C2CCCC2)C2CC2)c1 609722941 GFAITBWBWFRMAM-UHFFFAOYSA-N 380.875 5.551 30 20 GKED N#CCN(C(=O)c1oc2ccccc2c1CSc1cccs1)C1CCCC1 609976689 WVRQIPMJRDXKRB-UHFFFAOYSA-N 396.537 5.695 30 20 GKED C[C@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(F)c1 610224538 WZXKUVFHLABSAE-YCRPNKLZSA-N 392.861 5.877 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)c2cc3ccccc3n2CC#N)c1C 610527122 XPSBTZVOMMZHFH-UHFFFAOYSA-N 389.499 5.431 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Nc3ccccc3)nc2)c(Cl)c1 611093816 GGCSJTPUYLIHNX-UHFFFAOYSA-N 383.238 5.256 30 20 GKED CC(C)(C)[C@@H](NC(=O)N1CCC[C@@](C)(C#N)C1)c1cccc(C(F)(F)F)c1 612361875 JHFPTFJIKWVOCA-LPHOPBHVSA-N 381.442 5.128 30 20 GKED CCCN(C(=O)N[C@H]1CCc2cc(C#N)ccc21)[C@@H](C)c1cc2ccccc2o1 618842522 NEJIXKLISQKDAC-KKSFZXQISA-N 387.483 5.475 30 20 GKED O=C(N[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1cccc(F)c1F 622485288 JNHYXVWUMOYWEH-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED CC(C)[C@H](NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cn1 679386998 UTXJKYHOAOUQPD-HFAKWTLXSA-N 386.355 5.417 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(Oc3ccc(C)nn3)cc2)CCCC1(C)C 683552340 DYKRFJADQCEYKF-LJQANCHMSA-N 380.492 5.176 30 20 GKED CC(C)c1scnc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 685784318 YYKRTVLKEGJTPI-JTQLQIEISA-N 395.431 5.385 30 20 GKED N#Cc1ccc(NC(=S)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1Cl 726489299 IYPVHEQBQBHFKI-XJKSGUPXSA-N 395.837 5.073 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=S)Nc1ccccc1C#N 726750289 QLALAONVAFHPKR-UHFFFAOYSA-N 377.900 5.996 30 20 GKED O=C(/C=C/c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(N2CCOCC2)cc1 727264420 SNTWNEWBYMFZFD-KRXBUXKQSA-N 395.808 5.092 30 20 GKED Cc1c(C(=O)O)oc2c1C(=O)/C(=C\c1ccc(Cl)c(C(F)(F)F)c1)CC2 727267460 UVOKZRONNUICJA-POHAHGRESA-N 384.737 5.171 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)/C=C\c1c(Cl)nc2sccn12 727780027 FGPVFJCVHXKHSV-FPLPWBNLSA-N 385.901 5.377 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)[C@H](C#N)c1nc2ccccc2s1 729891059 XBAWZNIIWPZYCT-FVOQVABISA-N 376.481 5.363 30 20 GKED C=C(C)COc1cc(/C=C\C(=O)c2c[nH]c3ccc(OC)cc23)ccc1OC 734307612 PSKQHAPOVWQBTF-UITAMQMPSA-N 377.440 5.036 30 20 GKED COc1cc(CSCc2cc(Cl)ccc2OCC#N)ccc1OC(F)F 735318339 LJQFUUARYLIOJF-UHFFFAOYSA-N 399.846 5.286 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)CCc2cc(Cl)cs2)cc1 737317492 YCZNGOOGJHMGNF-GOSISDBHSA-N 388.920 5.024 30 20 GKED CC(C)c1nn(C)c(Cl)c1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 741539677 UDYTXPBHYUKEJS-GOSISDBHSA-N 392.890 5.105 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1cccc(Cl)c1 744035480 MRBCZVSSHOQGCN-IINYFYTJSA-N 375.280 5.583 30 20 GKED CC(=NO[C@@H](C)c1nc(-c2ccc(C)c(F)c2)no1)c1cc2ccccc2o1 744444710 ZZXJQPQQUZIDAH-AWEZNQCLSA-N 379.391 5.432 30 20 GKED CC(C)Cc1nc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 745765564 FWJFNTGLZDGLKF-LJQANCHMSA-N 375.497 5.249 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3ccc(SC)c(OC)c3)cs2)cc1 747614339 DZWRSLMQCAFFNC-YFHOEESVSA-N 397.521 5.445 30 20 GKED COc1c(O)cccc1/C=C/C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 750915844 IOBUWQAABNSCCU-AATRIKPKSA-N 390.279 5.335 30 20 GKED N#C[C@H](C(=O)CCOCC1CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 751826727 JSWPRBZIAHQMKO-CQSZACIVSA-N 395.311 5.110 30 20 GKED Cc1cc(CCCC(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)c(C)s1 753390382 OCSJRXUNKJDBPV-GOSISDBHSA-N 378.497 5.069 30 20 GKED Cc1nc(/C=C/c2ccccc2C#N)sc1C(=O)/C=C\c1ccccc1C#N 755586181 IISVFICQCJEFTL-PJABCKPXSA-N 381.460 5.261 30 20 GKED C=C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 759279319 NNOOGUCRBUTARG-GDBMZVCRSA-N 394.446 5.624 30 20 GKED CC[C@H](OC1CCCCC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1 761046859 GPXAZGLUNXBZLG-QUCCMNQESA-N 382.529 5.423 30 20 GKED C/C(=C/c1c(Cl)cccc1Cl)C(=O)[C@@H](C#N)C(=O)Nc1cccc(C)c1 766842306 WJZSUJBNDJORGR-IVOILVROSA-N 387.266 5.053 30 20 GKED Cc1cccc(C)c1OC[C@H](NCc1ccc(OCC#N)cc1)c1ccccc1 775536324 OHNZZYMFSIYGBS-DEOSSOPVSA-N 386.495 5.116 30 20 GKED O=[N+]([O-])c1ccc(F)cc1CN[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 780391485 ALZNNEAQKAREPK-CQSZACIVSA-N 396.262 5.146 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)c1ccc(C#N)cc1F 781108805 SWVKPISQBLTXRD-MDZDMXLPSA-N 393.849 5.109 30 20 GKED C=CCCN(OCc1ccccc1)C(=O)Nc1cnn([C@@H](C)CC)c1C1CC1 782803587 ULTUHWXCHVFOFX-KRWDZBQOSA-N 382.508 5.273 30 20 GKED C[C@H](OC(=O)Cc1ccc(OCC#N)cc1)c1ccc(SC(F)(F)F)cc1 784106353 IDJOERQCFJKNHA-ZDUSSCGKSA-N 395.402 5.048 30 20 GKED C[C@@H](OC(=O)c1ccc(F)cn1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 784670499 FETSPWREFSAFFQ-MRVPVSSYSA-N 381.247 5.176 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cc(Cl)ccc1O 786956396 DCSPTLUXUUQAMY-IBGZPJMESA-N 397.906 5.192 30 20 GKED O=C(/C=C\c1csc(-c2cccc(Br)c2)n1)c1ccnc(F)c1 794722886 YMGNQKDHJLMECT-PLNGDYQASA-N 389.249 5.003 30 20 GKED COc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[nH]c2ccccc12 795203511 COOYHGUIRUESQY-HXUWFJFHSA-N 381.435 5.084 30 20 GKED C=CCC(C)(C)C(=O)O[C@@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 796455966 VYNWLLZYXJTSMK-VIFPVBQESA-N 378.683 5.119 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OC[C@H]1CC[C@@H](C#N)CC1 809089515 FUQKKHZAOHDZDW-BETUJISGSA-N 393.270 5.444 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2ccc(C(F)(F)F)cc2O)c1 810226440 YAMIGSGDLBICIX-LPHOPBHVSA-N 392.421 5.333 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(-c2c(F)cccc2F)cc1 811696208 BKJSHIIVTVGGLD-CMDGGOBGSA-N 392.327 5.287 30 20 GKED O=C(/C=C\c1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(C(F)F)nc1 853009631 MHYOFXSRTPNHJG-OUOZUETKSA-N 393.817 5.127 30 20 GKED CCC[C@H](C(=O)[C@H](C#N)C(=O)Nc1ccccc1Cl)c1cccc(Cl)c1 860468950 GRNVGNDIOVNCJU-HOTGVXAUSA-N 389.282 5.225 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)c1cc(F)ccc1F 916134993 WIDOZAKDZMDDCC-VQHVLOKHSA-N 376.765 5.148 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)COc3c(C)cc(C)cc3C)n2)cc1 916650334 FAHGPDZWJCVGLV-LJQANCHMSA-N 390.508 5.299 30 20 GKED CC(C)(C)c1ccc(/C=C\C(=O)[C@H](C#N)C(=O)Nc2cccc3ccccc23)cc1 916916554 VUWQSWBAEUVGSX-XEZIEYNOSA-N 396.490 5.498 30 20 GKED Cc1ccc(OCCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917043601 KHTKIYRPZUSWDP-MRXNPFEDSA-N 384.888 5.294 30 20 GKED N#C[C@H](C(=O)C=C1CCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 918490666 UWVFNDGARRPQKU-CQSZACIVSA-N 377.296 5.794 30 20 GKED C=CCn1c(C2CC2)nn(CN2CCC[C@@H]2c2cccc3ccccc23)c1=S 919951337 RNSHLHMDYSNTHV-OAQYLSRUSA-N 390.556 5.425 30 20 GKED O=C(O)c1cccc(COc2cccc(/C=C\C(=O)c3ccccc3Cl)c2)c1 1776114885 FLOHSTPNDIRRMX-QXMHVHEDSA-N 392.838 5.513 30 20 GKED COc1ccc(/C=C/C(=O)c2csc3ccccc23)c2cc(C(=O)O)oc12 1777361581 UKMQMVVUEXAKCY-SOFGYWHQSA-N 378.405 5.250 30 20 GKED O=C(/C=C/c1ccc(F)c(C(=O)O)c1)c1ccc(-c2ccccc2Cl)s1 1777570035 FGLYPAVJVPFVCF-SOFGYWHQSA-N 386.831 5.802 30 20 GKED Cc1ccc(C)c(C(=O)/C(=C(\S)N[C@@H]2CCCC[C@H]2C)[n+]2cccc(C)c2)c1 27486888 DJFFBRJQHACWQG-TZIWHRDSSA-O 395.592 5.006 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cccc(Cl)c2)cs1 54895825 ZTOXAQZIAVPYPH-FLIBITNWSA-N 396.899 5.686 30 20 GKED CCc1cccc[n+]1/C(C(=O)c1ccccc1C)=C(/S)Nc1cccc(C)c1 55011672 KBUHXTKTYJZCKM-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCOc1cccc(NC(=O)c2ccccc2SCc2csc(C)n2)c1 56337563 VPGKUTOAKBGTLC-UHFFFAOYSA-N 396.537 5.561 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1cc(-c2ccccc2)nc2c1cnn2C(C)C 63961179 QYDUWTPNGJUSRD-UHFFFAOYSA-N 395.466 5.112 30 20 GKED Cc1ccc(-c2nnc([C@H](C)Nc3cccc(Oc4ccc(C#N)cc4)c3)o2)cc1 105402691 WFKWZSBANZBUST-KRWDZBQOSA-N 396.450 5.882 30 20 GKED C[C@H](C#N)CSc1ccccc1NCC(=O)Nc1cccc2ccccc12 108354585 IFHNYSGUCMCLBG-MRXNPFEDSA-N 375.497 5.142 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1nc(-c2ccncc2)cs1 114619045 YULLEXLOTQBIJB-QHAWAJNXSA-N 395.487 5.338 30 20 GKED CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)Nc2ccccc2O[C@@H](C)C#N)o1 121440934 SSAVYPXJIXCZJU-GJYPPUQNSA-N 381.476 5.138 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCCCC2)c1nc(-c2ccncc2)cs1 128849967 ZZZYWMOUUCQHCU-HNNXBMFYSA-N 379.510 5.026 30 20 GKED Cc1ccc(-c2ncc(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)s2)c(C)c1 146873139 IVKRMCUEGKQNMG-SFHVURJKSA-N 383.476 5.465 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)N[C@H](CCC#N)c2ccccc2)s1 151440337 QJNRUTRXNFLGOG-OAQYLSRUSA-N 393.512 5.406 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccnc1 173969535 RQNCBWVXRPSXCL-FOIQADDNSA-N 375.859 5.133 30 20 GKED COc1cccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 175946551 UEXLTYZAXNOPMC-HNAYVOBHSA-N 376.481 5.189 30 20 GKED CCN(C(=O)c1csc(Cc2cccc(F)c2)n1)c1ccc(C#N)c(Cl)c1 181174720 KOQHIEPNKGUALU-UHFFFAOYSA-N 399.878 5.065 30 20 GKED CC(=O)Nc1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 188768969 WGAYCPBZDJSVGJ-UHFFFAOYSA-N 399.450 5.178 30 20 GKED Cc1sc(C(=O)[C@H](C#N)c2cnc3ccccc3n2)cc1-c1ccc(F)cc1 190931417 ALOZEJJMNXSQHY-QGZVFWFLSA-N 387.439 5.296 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccco1)Cc1cccs1 191436758 SDMFAWHLYXXRPA-UHFFFAOYSA-N 394.540 6.427 30 20 GKED C[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccc(C#N)cc1 301270715 XOALZMWQMMRYOK-AWEZNQCLSA-N 376.847 5.032 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C/C(=O)c2cccc(OCc3ccccc3)c2)cc1 303149612 CJDGLWZSCSVHRS-LBKOFNPBSA-N 383.447 5.453 30 20 GKED Cc1ccc([C@@H]2OCCC[C@@H]2/N=C(/O)C2CCC(/N=C(/O)C3CC3)CC2)cc1 330013819 MLRLWMVCDSGVRL-JSRAGOMMSA-N 384.520 5.097 30 20 GKED CSc1nc(C(C)(C)C)nc(C)c1/C(O)=N/C1CCC(C(F)(F)F)CC1 330971514 KEKRJTXGOCRXKC-UHFFFAOYSA-N 389.487 5.230 30 20 GKED CC(C)c1nc([C@@H]2CCCCCN2C(=O)Nc2ccc(C(C)(C)C#N)cc2)no1 374776035 DWDKTDPKGCNQCD-SFHVURJKSA-N 395.507 5.143 30 20 GKED C=CCN(C(=O)c1ccc(C2CCCCC2)cc1)c1nc(C(=O)OCC)cs1 409823308 IRWIJLGJVWSSAH-UHFFFAOYSA-N 398.528 5.200 30 20 GKED N#CC1(CC[S@](=O)Cc2cc(-c3ccccc3Cl)on2)CCCCC1 417255320 FELUYXMPZUDJDP-VWLOTQADSA-N 376.909 5.108 30 20 GKED Cc1nc(CNc2ccc(Oc3ccc(C(F)(F)F)cc3)c(C#N)c2)oc1C 439562556 SEAKBFSUMNPCJN-UHFFFAOYSA-N 387.361 5.586 30 20 GKED N#CC(CCN1CCC[C@@H](c2nccs2)C1)(c1ccccc1)c1ccccc1 444603411 SSXDAMOQERKJRA-HXUWFJFHSA-N 387.552 5.222 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc([C@H](C)C(F)(F)F)cc2)cc1 455435261 XRAHGZHXMRBFQD-HNNXBMFYSA-N 390.405 5.312 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458807295 XNQAIKXJMXTFPD-SFHVURJKSA-N 387.936 5.534 30 20 GKED N#Cc1ccsc1C(=O)N(CCSc1ccc(F)cc1)c1ccccc1 460485791 BXYICWBLDZEHQF-UHFFFAOYSA-N 382.485 5.198 30 20 GKED C[C@@H](C(=O)Nc1ncc(Cc2ccccc2Cl)s1)c1cccc(C#N)c1 461803413 PUTAANWHMGKRPZ-CYBMUJFWSA-N 381.888 5.001 30 20 GKED C=CCOCCCC(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 463824697 CBEMCZPNFBXYMF-UHFFFAOYSA-N 398.553 5.435 30 20 GKED C[C@H]1CCc2ccccc2N1CCC(=O)Nc1ccccc1S[C@H](C)CC#N 469197245 ZDIJQINENINRQZ-ZWKOTPCHSA-N 393.556 5.251 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)C[C@@H]1OCCc2ccccc21 475572180 OLJWQGIZVRMGIX-QFIPXVFZSA-N 378.516 5.316 30 20 GKED COc1ccc2ccccc2c1-c1cc(CN(CCC#N)CC(C)(C)C)on1 481140393 KSBWSNHCHARDAP-UHFFFAOYSA-N 377.488 5.265 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@@H](C)[C@@H]1C 482925972 YCLXFMSQUAYVKR-HOTGVXAUSA-N 381.501 5.017 30 20 GKED N#C[C@@H](C(=O)c1cccc(OCc2cccs2)c1)c1nccc2ccccc12 483244416 NYAZQWHJCFJJTQ-OAQYLSRUSA-N 384.460 5.365 30 20 GKED N#CCSc1cccc(C(=O)N2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)c1 485545813 OUXIQODTVDFDAH-VSKRKVRLSA-N 376.525 5.101 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2)c2ccc(C(F)(F)F)cc2)cc1 486031493 RVPFIHVXLTWTPR-QFIPXVFZSA-N 396.412 5.465 30 20 GKED Cc1cc(CN[C@@H](CC(F)(F)F)c2ccc(Br)cc2)ccc1C#N 488303953 VPZNUSUKMKKAKK-KRWDZBQOSA-N 397.238 5.413 30 20 GKED C=CC[C@@H](C(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)c1ccccc1 489694290 HKQVVTNOZAYYFL-YLJYHZDGSA-N 379.891 5.240 30 20 GKED COc1ccc(/C=C\c2nc(-c3ccc(F)cc3)cs2)cc1OCCCC#N 494104981 HJADLKDVFKGNAV-WZUFQYTHSA-N 394.471 5.811 30 20 GKED CC(C)[C@@H](c1ccccc1)N(C)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 495165737 KYOPYNAIPZVQCA-QHCPKHFHSA-N 388.467 5.200 30 20 GKED CC(C)(CCC#N)CNC(=O)N[C@H](c1cccc(F)c1)c1cccc(Cl)c1 499709475 BTURNKPKHKEFFN-IBGZPJMESA-N 387.886 5.198 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1ccc(-c2csc(C)n2)cc1 504156669 PPYLMSULGNODON-OAHLLOKOSA-N 397.569 5.639 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)[C@@H]2CCC[C@H](C)C2)cc1 508239035 CFLPSLUEGMLNOB-QFBILLFUSA-N 393.487 5.402 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](C)c1ccc(C#N)cc1F 512611343 KHVSHKLBKJPALO-QWHCGFSZSA-N 383.467 5.680 30 20 GKED CC(C)COc1cccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)c1 515449650 ZOFVWTJMIPFNLI-UHFFFAOYSA-N 390.439 5.017 30 20 GKED CC(C)(C#N)Cc1nc(-c2ccc(Oc3cccc(Cl)c3Cl)nc2)no1 516190799 NMQYYUXWHHODOK-UHFFFAOYSA-N 389.242 5.323 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccccc1 518755833 OPDIBUZPBDTFBC-NQIIRXRSSA-N 393.556 6.230 30 20 GKED CCC(CC)[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C(C)C)c1cccs1 520475984 QOGHZAVWNKNAPT-NRFANRHFSA-N 383.561 5.717 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@@H](C)S[C@@H]1CCCc2ccccc21 523227496 WUFBBGXDFXFXSS-VGOFRKELSA-N 394.540 5.141 30 20 GKED Cc1ncc(Cl)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 525653121 LBIKJHFFJDKIRX-UHFFFAOYSA-N 399.237 5.008 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 535062510 FHUQPZWSVJWWDZ-UHFFFAOYSA-N 393.490 5.855 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](N[C@H](CCC#N)c2ccccc2)CCC3)cc1 536838512 LNAQTFNQKQQBJI-RTWAWAEBSA-N 387.552 6.131 30 20 GKED Cc1c(C(=O)Nc2cc(C(C)(C)C)sc2C#N)cccc1-c1ccccn1 536971938 NPAHJSYGWMTQPB-UHFFFAOYSA-N 375.497 5.540 30 20 GKED CC(C)(CCC#N)CNCCOc1c(Cl)cc(Br)cc1Cl 537382451 ASTVQKWKSZWONB-UHFFFAOYSA-N 394.140 5.054 30 20 GKED C[C@@H](NCC#Cc1ccc(Cl)cc1)c1ccc(OCc2cccnc2)cc1 538123431 PGTDTGDEWZFEAN-GOSISDBHSA-N 376.887 5.016 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1coc(-c2ccccc2Cl)n1 539541617 JFMSCWKBAFKFDY-CYBMUJFWSA-N 397.887 5.642 30 20 GKED CC(=O)c1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 543056846 AAYJOYCTBCODJZ-QGZVFWFLSA-N 380.856 5.156 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c1 543302996 HFKFDBAZQJDYOK-IEBWSBKVSA-N 379.529 5.268 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4cnc5ccsc5c4)no3)cc2)nc1 547123122 JWPKTNZMNASBAF-UHFFFAOYSA-N 397.419 5.072 30 20 GKED CC[C@@H](CC1CCCCC1)C(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1 553206670 WIAUYGDLIQVJPH-IBGZPJMESA-N 386.511 5.064 30 20 GKED N#CCCN(C(=O)CCC(=O)Nc1cccc(-c2ccccc2)c1)c1ccccc1 554032923 AORQPRGMZYJJFD-UHFFFAOYSA-N 397.478 5.019 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(C1CC1)[C@H](C)c1ccccc1 554444208 ATEKZBMXJRPNNY-IAGOWNOFSA-N 379.529 5.838 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccsc1Br 554957355 HIMLBWCGOZNFEE-UHFFFAOYSA-N 393.350 5.684 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(Br)c1Cl 558822630 JONFNFHWNYBXAW-UHFFFAOYSA-N 382.710 5.633 30 20 GKED Cc1nc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)ccc1-c1ccccc1 565979436 XFIQVKVUCTXFQG-UHFFFAOYSA-N 382.467 5.125 30 20 GKED O=C(Nc1cccnc1C(F)(F)F)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 577896444 IBZPXUOWMCNXQL-LBPRGKRZSA-N 395.278 5.055 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1ccc(Br)cc1C#N 589055906 IJMXQZKAMDSASK-CYBMUJFWSA-N 386.318 5.327 30 20 GKED N#CC1(CC(=O)N2CCCC[C@H]2c2ncc(-c3cccc(F)c3)[nH]2)CCCCC1 597554404 IQRVXYCDIVGOGZ-FQEVSTJZSA-N 394.494 5.134 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)c1ccccc1-c1ccccc1C#N 603773734 HVJGFRAPXSUHLI-SFHVURJKSA-N 384.479 5.503 30 20 GKED C=CCCCN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 605644602 QWGOKYWDXFBCNQ-WUKNDPDISA-N 388.536 5.821 30 20 GKED CCN(C(=O)c1csc(-c2ccccc2Cl)n1)[C@H](C)c1ccc(C#N)cc1 608936230 XDEDKWGAUNUBRO-CQSZACIVSA-N 395.915 5.558 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCOc1ccc2ccccc2c1 609427652 XJVKOQRUFYXSGZ-QGZVFWFLSA-N 390.508 5.642 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2cc(F)ccc2N2CCCCC2)c1 609601980 WNAKKGSKIGZBBG-UHFFFAOYSA-N 396.466 5.143 30 20 GKED Cc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c(CN(C)C)c1 609610688 IVPPAVHWDJSKBI-UHFFFAOYSA-N 399.494 5.167 30 20 GKED N#Cc1ccc(SCc2ncc(-c3ccc(Br)cc3)o2)c(F)c1 610219088 VBEFFEFIXWQZBF-UHFFFAOYSA-N 389.249 5.407 30 20 GKED C=CCN(C(=O)[C@@H]1CCCO1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 641891447 KCURISKKUHFTSS-NRFANRHFSA-N 390.508 5.175 30 20 GKED C=CCC[C@@H](NC(=O)N1CC[C@]2(C1)CC2(F)F)c1ccc(C(F)(F)F)cc1 650982164 LXZOTTQLQOZIKJ-NVXWUHKLSA-N 388.380 5.153 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)N[C@@H](C)c3cccc(C#N)c3)cc2)cc1 677664333 NXBDOXDGMVQFKC-INIZCTEOSA-N 384.435 5.044 30 20 GKED O=C(CCCCCc1ccc(F)cc1)N1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 681664865 MZXNPICLQAROKD-GJZGRUSLSA-N 399.350 5.128 30 20 GKED Cc1ccc(C(=O)[C@H](C#N)c2nccc3ccccc23)c(C)c1Br 682993785 ANZQANMJXDWWLS-QGZVFWFLSA-N 379.257 5.104 30 20 GKED Cc1ccccc1NC(=S)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 728175107 IUZIQVBFMKQACX-UHFFFAOYSA-N 391.471 5.394 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)/C=C/c1c(Cl)nc(Cl)n1C 728439891 GRWGNMRGZBTUNO-BQYQJAHWSA-N 396.274 5.194 30 20 GKED C#Cc1ccc(C(=O)N(c2nc3ccccc3s2)c2ccc(C)cc2C)cn1 728817095 FDHDXZGQKLKAMY-UHFFFAOYSA-N 383.476 5.268 30 20 GKED CC(C)[C@@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1 730421461 KNPMFGPMEGMTQG-HNAYVOBHSA-N 384.501 5.429 30 20 GKED CC(C)c1cccc(O[C@@H](C)C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)c1 730422030 SBGKVCMAUHZOMI-SUMWQHHRSA-N 382.460 5.203 30 20 GKED Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3cc(C#N)ccc3C)c2c1 730487924 DAZAZZYQRBYYOK-UHFFFAOYSA-N 378.435 5.038 30 20 GKED Cc1c(C(=O)/C=C/c2ccc(-c3nc4ccccc4s3)o2)c(C#N)c2n1CCC2 731937147 GNTSHILXKKMMDD-CSKARUKUSA-N 399.475 5.380 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ccccc2Nc2ccccc2)c1 733789683 QUCWQFBVMSTTRV-FQEVSTJZSA-N 385.467 5.041 30 20 GKED COc1ccc2[nH]cc(C(=O)/C=C\c3c(C)nn(-c4ccc(F)cc4)c3C)c2c1 734306913 IVTQBGWYJUPIFY-LUAWRHEFSA-N 389.430 5.014 30 20 GKED C[C@H](SCC(=O)Nc1sc2c(c1C#N)CCCCC2)c1cccs1 737401836 GFWLFTQAWWUYHK-LBPRGKRZSA-N 376.572 5.383 30 20 GKED CCOc1cc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)ccc1OC(F)F 741474647 XVNJRKSUYQHTBT-VURMDHGXSA-N 395.405 5.645 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-c2ccccc2)n1C 741925003 LWRRFUFYQICDOT-MRXNPFEDSA-N 375.497 5.339 30 20 GKED C=CCOc1ccccc1CNc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1 742389310 XTVHOTFPBCQGEP-KRWDZBQOSA-N 382.504 5.449 30 20 GKED C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1ccc(C#N)cc1 748683273 BMFFGTNGAHHZNB-SSDOTTSWSA-N 390.053 5.485 30 20 GKED C[C@@H](NC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccc(C#N)cc1 748990476 YHMLVTHJDJUKPR-OAHLLOKOSA-N 382.895 5.085 30 20 GKED COc1cccc(/C(C)=C/C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 751826176 DMUBTEXSGUCWMX-MBNYPGIVSA-N 388.492 5.407 30 20 GKED CC(CC1CCOCC1)=NNc1ncnc2scc(-c3ccc(C)cc3)c12 757569576 RRCDRNQEDRQLHM-UHFFFAOYSA-N 380.517 5.271 30 20 GKED C#CC[C@H](NC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1)c1ccccc1 757778501 NPZWGRKZXLINSH-FQEVSTJZSA-N 386.417 5.144 30 20 GKED N#Cc1c(F)ccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3o2)c1Cl 761477805 AGEFKMIHGXJMMJ-WZUFQYTHSA-N 378.146 5.137 30 20 GKED N#Cc1cccc([C@@H]2CN(C(=O)Nc3ccc4c(c3)oc3ccccc34)CCO2)c1 761839203 RISCDSZSWFEJLT-QHCPKHFHSA-N 397.434 5.063 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1SCC(F)(F)F 780471389 LKIVEHLKKDHXLT-LBPRGKRZSA-N 395.406 5.276 30 20 GKED C#CC[C@H](N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)c2ccccc21)c1ccccc1 780732154 LKQDRSGZRCZNMB-FDFHNCONSA-N 376.500 5.051 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1ccc(C#N)cc1F 781108658 SCMWFQGJWPPWPG-KTKRTIGZSA-N 379.822 5.049 30 20 GKED C[C@@H](NC(=S)Nc1ccccc1C#N)c1ccc(-c2cccc(C#N)c2)cc1 782204242 KNTWZMTYWGZSQW-MRXNPFEDSA-N 382.492 5.145 30 20 GKED CC1C/C(=C/c2scnc2C2CC2)C(=O)/C(=C\c2scnc2C2CC2)C1 782301151 KJYIJOGOPVUZQY-SRKDFGFSSA-N 382.554 5.820 30 20 GKED N#C[C@H](C(=O)CC1CCC(C(F)(F)F)CC1)c1nc2cc(F)ccc2s1 783379395 VQIOGTVFUAIOJD-GCZXYKMCSA-N 384.398 5.370 30 20 GKED C=C[C@@H](CC(=O)O[C@@H](C)c1nnc(-c2ccccc2F)s1)c1ccccc1 784401695 CXRWHNSXURDHRH-GJZGRUSLSA-N 382.460 5.308 30 20 GKED CC[C@H](CC#N)OC(=O)CCc1c(-c2ccc(OC)cc2)[nH]c2ccccc12 787087245 ZUPRLPXKPGOCGY-QGZVFWFLSA-N 376.456 5.012 30 20 GKED CCCCCCCCOCc1cccc(NC(=O)N2CCC[C@@](C)(O)CC2)c1 791810596 LARNVDJVBYLXQK-HSZRJFAPSA-N 390.568 5.333 30 20 GKED C[C@@H]1CCC[C@@H](OCCCCCC(=O)[C@H](C#N)c2nccc3ccccc23)C1 792102803 JLXCBSJTAGEYRU-UZKOGDIHSA-N 378.516 5.567 30 20 GKED FC(F)Sc1ccc(NC(=S)NN=C2CCC[C@H]2c2ccccn2)cc1 794871283 WRJRVNWYVIWUJY-AWEZNQCLSA-N 392.500 5.006 30 20 GKED C[C@H](OC(=O)c1ccc(C(C)(C)C#N)cc1)c1nnc(-c2ccccc2F)s1 796042461 HJLDLYWMFOKGLY-ZDUSSCGKSA-N 395.459 5.063 30 20 GKED O=C(O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@H]1CCC(F)(F)C1 796745754 RFYUUXMYRBLNCT-GZMMTYOYSA-N 376.243 5.287 30 20 GKED N#Cc1ccccc1C(=O)/C=C\c1cccc(/C=C/C(=O)c2ccccc2C#N)c1 799499199 SXDPCFYYHQXBLB-PMJBJKLVSA-N 388.426 5.222 30 20 GKED Cc1nc(Cl)c(Cl)cc1C(=O)Nc1ccccc1S[C@H](C)CC#N 808385541 SVAOKOHSRARKHS-SNVBAGLBSA-N 380.300 5.343 30 20 GKED N#C[C@H](C(=O)CC1CCC(C(F)(F)F)CC1)c1cc(C(F)(F)F)ccn1 813211465 KUQKSBVZRAGXSJ-XIVSLSHWSA-N 378.316 5.035 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cc(C4CC4)cnc3Cl)c(C#N)c2[C@@H]1C 839390972 ONYVQQACWGVKRP-WDEREUQCSA-N 385.920 5.484 30 20 GKED CC(C)(C)Oc1ccc(NC(=O)c2ccc(Cl)nc2C(F)(F)F)cc1C#N 839408542 IDBXNDGKNHMIMB-UHFFFAOYSA-N 397.784 5.055 30 20 GKED Cc1cc(O[C@H](C)C(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc1C(C)C 916847626 NEHKHGMBQLFDGK-CRAIPNDOSA-N 378.497 5.372 30 20 GKED N#C[C@@H](C(=O)CCc1ccc2ccccc2c1)C(=O)Nc1cccc2ccccc12 917426801 QJOBDQSQXYVWAA-QHCPKHFHSA-N 392.458 5.273 30 20 GKED N#CCOc1ccccc1C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1 920006482 XHNHGVASFXHKMB-UHFFFAOYSA-N 394.883 5.646 30 20 GKED C=CCn1c(SCc2cc(Cl)nc(Cl)c2)nnc1-c1cccc(C)c1 920071564 YSSLBHCVBRLANI-UHFFFAOYSA-N 391.327 5.434 30 20 GKED CC(=NNc1ccc(C(=O)O)cc1)c1ccccc1Oc1cccc(Cl)c1 1776012215 JHCJTDNMPKCZOM-UHFFFAOYSA-N 380.831 5.667 30 20 GKED CCCCCCCCOc1ccc(C=NNc2ccc(F)c(C(=O)O)c2)cc1 1776061683 JJAZKQWVHXBIDE-UHFFFAOYSA-N 386.467 5.709 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C[C@H](C)c2ccccc2)C(=O)O)c1 1776787926 GMFYLCYMZBUJMN-GBXCKJPGSA-N 397.559 5.772 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2cccc(OC)c2)cc1 1776788261 VHJDIBUPGQFALL-HSZRJFAPSA-N 399.531 5.350 30 20 GKED O=C(O)/C=C/c1ccc(/C=C/C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1 1777624240 YOKBLTWHIQCDJE-NXZHAISVSA-N 380.749 5.353 30 20 GKED O=C(O)c1cnc(/C=C\c2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)s1 1777692955 AOKNVFCBFZUCGQ-UTCJRWHESA-N 399.287 5.301 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1cccc(Cl)c1)[n+]1ccccc1 14871853 CGEBYPLVGZSCHS-UHFFFAOYSA-O 395.935 5.241 30 20 GKED N#CCc1ccc(NC(=O)CNc2ccccc2SCc2ccccc2)cc1 28662468 GCSQUJKPBMYNNT-UHFFFAOYSA-N 387.508 5.096 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 41502565 JCLBXCGYQXZCIA-LLVKDONJSA-N 381.507 5.280 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cc(Br)ccc1F 66800556 MKENGLWDTVKYRT-NSHDSACASA-N 393.281 5.235 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1sccc1Br 66802236 TUUIRDBLCHTANL-JTQLQIEISA-N 381.320 5.157 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)[C@H](C)c1cc(F)ccc1F 66956084 CUDJUAVBOMDAKZ-UONOGXRCSA-N 389.471 5.584 30 20 GKED CCN(CC(=O)Nc1ccccc1Cc1ccccc1)[C@@H](C)c1ccc(C#N)cc1 108718669 JTCCASVXFYNSOW-FQEVSTJZSA-N 397.522 5.171 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 109737163 UDESKKVFSJIBSX-UHFFFAOYSA-N 383.106 5.097 30 20 GKED Cc1cc(-c2cc(C(=O)Nc3ccccc3C#N)c3cnn(C(C)C)c3n2)c(C)o1 123012217 HOFXEVMZBDFWOR-UHFFFAOYSA-N 399.454 5.013 30 20 GKED CC[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nccs1 153991616 SSLMIFBAKSZWFQ-SFHVURJKSA-N 378.457 5.080 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1ccccc1OCC1CC1 159294160 XGQNTLDCONKSEL-INIZCTEOSA-N 395.528 5.191 30 20 GKED C=CCn1c(SCc2csc(-c3cccs3)n2)nnc1-c1ccccn1 159667799 MEIJMXYKPHAZGU-UHFFFAOYSA-N 397.554 5.003 30 20 GKED Cc1ccc(CN2CCCC2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 163402516 VZKXQLGDOCTNNM-UHFFFAOYSA-N 395.506 5.382 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)c1 175552738 DWKNIYBKLLDKDB-UHFFFAOYSA-N 385.448 5.363 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccccc1 187027098 GPDXYJFDOLHRAT-KRWDZBQOSA-N 394.858 5.484 30 20 GKED C=CC[C@H](C(=O)Nc1nc(-c2ccccc2)c(NC(C)=O)s1)c1ccccc1 188278128 AEFIVHCBBVJSTQ-SFHVURJKSA-N 391.496 5.067 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc2c(C(C)C)nn(C)c2s1 189889931 QGJUPWPEETVSGX-UHFFFAOYSA-N 381.545 5.862 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)C2CC2)o1 193050327 ZBVRCGWWCVAOEH-QRWLVFNGSA-N 377.488 5.401 30 20 GKED COc1ccc([C@H](C)Nc2cccc(OCCCC#N)c2)cc1Br 195656664 WVJBUZIVXDQRDA-AWEZNQCLSA-N 389.293 5.313 30 20 GKED OC(=Nc1ccc(F)c(Br)c1)C1CCC(/N=C(/O)C2CC2)CC1 330015288 NTNKAJHDGIQUIT-UHFFFAOYSA-N 383.261 5.102 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Nc1ccc(C#N)cc1Cl 426147855 FJTGWXKTMNGMBW-ZDUSSCGKSA-N 396.903 5.526 30 20 GKED Cc1cccc(CN(Cc2ccco2)C(=O)Nc2ccc(C#N)cc2Cl)c1 426151546 XHIDDZGLRDTHII-UHFFFAOYSA-N 379.847 5.347 30 20 GKED C[C@H](NC(=O)c1cccc(SCC#N)c1)C(c1ccccc1)c1ccccc1 429950475 ZBPDMJYJEALHBM-SFHVURJKSA-N 386.520 5.253 30 20 GKED Cc1nc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)c(-c2ccccc2)s1 430647477 XYOVTWWUFQDZHV-CQSZACIVSA-N 381.526 5.363 30 20 GKED CC(C)(C#N)CCCCSCc1nc(-c2ccc(C(F)(F)F)cc2)no1 435884495 TUONQOCSPJCFKZ-UHFFFAOYSA-N 383.439 5.709 30 20 GKED C=CCn1c([C@@H]2CCCCO2)nnc1N1CCCC[C@@H]1c1ccc(Cl)cc1 453433324 CYEHJAVIVATUAE-MOPGFXCFSA-N 386.927 5.091 30 20 GKED CN(Cc1cccc(Cl)c1Cl)C(=O)N[C@@H](CCCC#N)c1ccccc1 458797077 FXTCLCMJLITHOG-SFHVURJKSA-N 390.314 5.570 30 20 GKED C=CCn1c(SCc2nc(C)cs2)nnc1-c1ccc(C(C)(C)C)cc1 461541487 FFUFOCUTISNILH-UHFFFAOYSA-N 384.574 5.486 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H]1CCCCC12CCCC2 463458379 XGAOJDZLMBLTDW-XLIONFOSSA-N 385.577 5.112 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Sc1ccccc1)c1cc(C(F)(F)F)ccn1 464467369 YWGPRBQIPDBTNK-QGZVFWFLSA-N 398.409 5.742 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2ccc3ccccc3n2)cc1 464800606 AIGFERRALQWMAE-UHFFFAOYSA-N 393.446 5.484 30 20 GKED COc1ccc([C@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C(C)C)cc1 468936458 JHLFOLSXYHAKAC-XMMPIXPASA-N 391.515 5.087 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H]2CCc2ccccc2)c2ccccc21 469028439 SWXNNKHQDFGDGG-OAQYLSRUSA-N 385.511 5.182 30 20 GKED C=CCOCCCN[C@H](C)c1sc(-c2ccccc2Br)nc1C 470765549 MJENQWWOWVVSMS-CYBMUJFWSA-N 395.366 5.124 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@H](c2ccc(F)cc2)C[C@H]1C 475545817 BZWKHTBJDCBPJM-YLJYHZDGSA-N 380.507 6.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCSc2c(F)cccc21 475580477 YRLMLTLCARUCRB-LJQANCHMSA-N 384.520 6.036 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1nc(-c2ccccc2Cl)cs1 478348712 VUMWMGAEWSXKIV-CQSZACIVSA-N 399.972 6.470 30 20 GKED C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N[C@H](CCCC#N)c1ccccc1 487518889 YFQLJZOFIGSTHV-AUUYWEPGSA-N 391.298 5.312 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3cc(F)cc4cccnc34)c2)c1 502209940 SYMBGHZAZLSYLN-UHFFFAOYSA-N 397.409 5.077 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)N[C@H](CC(F)(F)F)c3ccccc3)CC2)cc1 504081222 XSVAPTIHCXAXAJ-HXUWFJFHSA-N 399.416 5.051 30 20 GKED N#C[C@H](NC(=O)CCCCc1nc2ccccc2s1)c1ccccc1Cl 505695764 XFNSZQSUBVLFGT-KRWDZBQOSA-N 383.904 5.044 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 509563233 DVCLRJBYNOMVHX-VHKYSDTDSA-N 386.417 5.290 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 510532414 IAYIHHREZVARFB-UHFFFAOYSA-N 389.842 5.025 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](CCC)c2ccccc2)cc1 511745096 YISRQHVHEAVEOK-JOCHJYFZSA-N 376.500 5.023 30 20 GKED CC(C)c1nn(C)cc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 512191944 BUNFHDYVKDURBG-GOSISDBHSA-N 392.890 5.105 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 514177447 DIZJLSQXFTVTFE-KRWDZBQOSA-N 393.512 5.394 30 20 GKED Cc1ccc(NCc2cccc(C#N)c2)cc1Oc1ncccc1Br 515591909 NBZKXUIWNLMGBF-UHFFFAOYSA-N 394.272 5.429 30 20 GKED Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)n1 517975408 JKBMOEROUCGBLD-HNNXBMFYSA-N 394.862 5.017 30 20 GKED CCN(CCc1cccs1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 518902104 OZHDDZQIIALBIM-UHFFFAOYSA-N 390.508 5.311 30 20 GKED CC(C)C[C@@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 520195640 GEAVTJCLOUSZRH-FXAWDEMLSA-N 381.545 5.990 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1Oc1cccc(F)c1)c1ccc(C#N)cc1 520433510 DAXZLDBLFQIKNL-OAHLLOKOSA-N 375.403 5.372 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)cc2)cc1 520558886 UUBVAYMQLOSLMC-RTBURBONSA-N 388.389 5.658 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1C(F)(F)F 521191526 UYFCHZFJQLERGL-UHFFFAOYSA-N 375.394 5.267 30 20 GKED Cc1c(C(=O)Nc2ccccc2SCCC#N)cnn1-c1ccc(Cl)cc1 521716231 KKZGYVDVCLOBKH-UHFFFAOYSA-N 396.903 5.092 30 20 GKED C=CCn1c(SCc2cc(C)nc3ccccc23)nnc1-c1ccc(F)cc1 522746822 WDTHWHCVKYAOLY-UHFFFAOYSA-N 390.487 5.419 30 20 GKED Cc1nc(-c2ccc(Br)cc2)sc1[C@H](C)Nc1cccc(C#N)n1 523514384 DPXZACDRHOCLOV-NSHDSACASA-N 399.317 5.321 30 20 GKED CCCN(Cc1ccc(C)cc1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524383734 SZWMTOLTSSTDBR-UHFFFAOYSA-N 388.467 5.091 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2)cc1 524912616 HREQXVUGWVNVIL-LJQANCHMSA-N 394.459 5.402 30 20 GKED CC(C)c1cc(Cl)ccc1NC(=O)N1CCC(Oc2cccc(C#N)c2)CC1 529244188 MWCFAXXGIITBQO-UHFFFAOYSA-N 397.906 5.410 30 20 GKED C[C@@H](NCCC(=O)Nc1sccc1C#N)c1ccc(Oc2ccccc2)cc1 537053110 DHRHHXNKHDUWKM-MRXNPFEDSA-N 391.496 5.091 30 20 GKED N#CC1(c2ccc(C(=O)N3CCc4cc(-c5cccc(F)c5)ccc43)cc2)CC1 539654697 NJZILAWBUVOBRZ-UHFFFAOYSA-N 382.438 5.251 30 20 GKED N#CCC1CCN(C(=O)c2ccc(CSc3ccc(Cl)cc3)cc2)CC1 542909979 ZXLVNZZLIUUJLF-UHFFFAOYSA-N 384.932 5.398 30 20 GKED C[C@H]1CSc2ccc(Cl)cc2N(C(=O)c2ccc(C3(C#N)CC3)cc2)C1 544218880 JSPPBZZJTSSMHI-CQSZACIVSA-N 382.916 5.284 30 20 GKED C=CCOc1cccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3o2)c1 548159309 KFQRQGOMZIKBFX-IBGZPJMESA-N 377.444 5.152 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2ccn(C(C)C)c2C)cc1 550387891 VDMCYBWHMZWHFQ-UHFFFAOYSA-N 389.455 5.302 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)c3ccc(F)c(C#N)c3)s2)cc1 556385499 JFUZESRCSHRLML-OAHLLOKOSA-N 393.487 5.271 30 20 GKED CC1(C)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)[C@H]1c1ccncc1 560547952 ITIXSBNWBHIEDV-DEOSSOPVSA-N 383.495 5.115 30 20 GKED C=CCn1c(-c2ncccc2C)nnc1N1Cc2ccccc2-c2ccccc2C1 579220717 IVKYBSYPURTESS-UHFFFAOYSA-N 393.494 5.022 30 20 GKED C[C@@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1nccn1-c1ccccc1 579419002 ZOFVQWQCMYOWEM-QGZVFWFLSA-N 381.439 5.104 30 20 GKED COc1cc(CNC(=O)N(C)[C@H](C)c2ccc(-c3ccccc3)cc2)ccc1C#N 583987439 XTVPXCSWPQSGBI-GOSISDBHSA-N 399.494 5.136 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)N[C@@H](C#N)c1ccc(C(C)(C)C)cc1 588952536 RPRZRUZQYQBEFD-HXOBKFHXSA-N 385.511 5.092 30 20 GKED C[C@@H](Cc1ccccc1)N(CCCC1(C#N)CCOCC1)Cc1ccccc1 595864870 FHPCTYWOMBWOBM-QFIPXVFZSA-N 376.544 5.220 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1ccc(F)cc1C(F)(F)F 606191534 YGROENANOHNFEV-JTQLQIEISA-N 393.302 5.681 30 20 GKED Cc1ccccc1COc1c(C)cc(CN(C)C[C@@H](C#N)CCC#N)cc1C 609681663 LNFSUMBNCQTIAN-OAQYLSRUSA-N 375.516 5.066 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609682636 UQPSQOHQZVOUKM-PXNSSMCTSA-N 398.466 5.155 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCCCC[C@H]3c3ccco3)o2)cc1 609909190 STPBXGZDAJUTME-FQEVSTJZSA-N 390.439 5.081 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3nc(C(F)(F)F)cs3)c2)cc1 610011224 NULYZTOGGGDWIN-UHFFFAOYSA-N 388.374 5.029 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1)c1cccc(C#N)c1 610331333 URYXTYBYTSIPET-AWEZNQCLSA-N 392.846 5.282 30 20 GKED C[C@H](NCc1cc(Cl)ccc1OCc1cccnc1)c1cccc(C#N)c1 611387232 IGHDGBRLDKWDIQ-INIZCTEOSA-N 377.875 5.036 30 20 GKED COc1ccc(Sc2ccc(NC(=O)N3CCC[C@@](C)(C#N)C3)cc2)cc1 612306137 HTPOPOCOROZUMO-NRFANRHFSA-N 381.501 5.004 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(COc3ccc(Cl)cc3)cc2)n1 613286785 PWHVETJKEDVKGN-GOSISDBHSA-N 382.872 5.174 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(Cl)cc2cccnc12 614526687 CSSYTOWSTBTAFI-UHFFFAOYSA-N 377.296 5.432 30 20 GKED FC(F)(F)c1ccnc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c1 674244852 XWQRKVALTQTAOM-IUCAKERBSA-N 380.254 5.422 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)Nc1snc(Cl)c1C#N 730110081 YMJCYORVZITYKA-VIFPVBQESA-N 395.340 5.927 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=S)Nc1ccccc1 730954965 PZFCIYONMWVMRK-UHFFFAOYSA-N 381.448 5.520 30 20 GKED C#Cc1cccc(NC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)c1 730963964 SUTJOYBKAMVSCP-UHFFFAOYSA-N 377.875 5.192 30 20 GKED CC(=NNc1ccc2ccccc2n1)c1cnn(-c2cccc(Cl)c2)c1C 731559457 DRGPCJPREGGYNQ-UHFFFAOYSA-N 375.863 5.218 30 20 GKED CCCN(C(=O)/C=C\c1ccccc1C#N)[C@@H](c1ccc(F)cc1)c1cccnc1 732085542 LJPMAGPLRPEQOD-QSRJBLIVSA-N 399.469 5.134 30 20 GKED CC[C@H](C)N(Cc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 735172423 ZENSZPBLHUOIMD-NBGIEHNGSA-N 397.522 6.175 30 20 GKED Cn1ccc2c(NC(=O)NCc3cccc(-c4ccc(C#N)s4)c3)cccc21 740447108 GYLSSUBDMZOQCT-UHFFFAOYSA-N 386.480 5.100 30 20 GKED Cc1ccc(C2=CCN(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)CC2)cc1 743216418 NZHYBKGNEMUMPT-UHFFFAOYSA-N 385.389 5.207 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@H](C)c2c(C)noc2C)c1 754024526 NKMSVOBPPIXXNO-HNNXBMFYSA-N 378.497 5.061 30 20 GKED C=C[C@@H](CC(=O)Oc1cccc(NC(=O)c2cccs2)c1)c1ccccc1 759350866 DBXRXCJUALPMTB-INIZCTEOSA-N 377.465 5.266 30 20 GKED O=C(/C=C\c1csc(COc2ccc(Cl)cc2)n1)c1c[nH]c2ncccc12 761817319 KYVMCQLIDSOCHP-YVMONPNESA-N 395.871 5.148 30 20 GKED N#Cc1cc(Cl)nc(NN=C2CCCc3nc(-c4ccc(F)cc4)sc32)c1 768376678 UPCXVNOHWJMCRO-UHFFFAOYSA-N 397.866 5.022 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(SCC(F)F)cc2)c1 772986018 YYSHXFWBNNMAHV-YJBOKZPZSA-N 390.499 5.576 30 20 GKED N#Cc1ccccc1NC(=S)Nc1ccc(Br)c2ccccc12 773166741 SZULLFARZGYZMJ-UHFFFAOYSA-N 382.286 5.283 30 20 GKED C=CC[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1ccncc1 776185094 DZSYOAPVRJBPRL-XMMPIXPASA-N 398.485 5.480 30 20 GKED CC(C)Cc1cccc([C@@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccncc3)cs2)c1 796892402 YHEYWFHVERUNHL-OXQOHEQNSA-N 389.524 5.384 30 20 GKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)n1[C@H](C)c1ccccc1 817318548 CLFKNPWLSDPEIO-NLFFAJNJSA-N 399.538 5.879 30 20 GKED C[C@H](NC1(c2ccccc2Br)CCC1)c1ccc(OCC#N)cc1 846175361 USVXVFKQHTZIRN-HNNXBMFYSA-N 385.305 5.081 30 20 GKED CCOC1CCC(=NNc2ncnc3scc(-c4ccc(OC)cc4)c23)CC1 853276310 AZQMQVQAYOBRNN-UHFFFAOYSA-N 396.516 5.114 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc([C@H](O)C(F)(F)F)cc2)cc1 864021005 FJEBVUYAVVCCIE-ACJLOTCBSA-N 385.813 5.587 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)c1nc(-c2ccsc2C(F)(F)F)no1 904916330 AEHKELFXVFURSJ-UHFFFAOYSA-N 379.363 5.003 30 20 GKED COc1cccc2cc(C(=O)/C=C\c3cc4cnn(C(C)C)c4nc3Cl)oc12 913617546 IVHPMAZFWYPFJJ-FPLPWBNLSA-N 395.846 5.317 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)(F)F)cc1)c1nc2ccccc2s1 915099270 OZDSPOFDYUCUFO-GFCCVEGCSA-N 378.400 5.398 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354018 SVLQUAUMSJTRTC-HXOBKFHXSA-N 387.458 5.706 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2c(C)nn(-c3ccccc3)c2C)cc1Cl 916154855 XRBLDQGVBSYNHI-ZHACJKMWSA-N 396.874 5.056 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)cc1CC(=O)O 916546999 UCQRRHYABPZOFY-CLFYSBASSA-N 396.826 5.132 30 20 GKED COc1cc(C=NOCc2ccc(Cl)c3cccnc23)cc(Cl)c1OC 917395636 WGQBUYYWFPFTTP-UHFFFAOYSA-N 391.254 5.110 30 20 GKED C=CCN(C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)C(C)C 921237501 OKPDTRDIOWMLGW-UHFFFAOYSA-N 378.394 5.926 30 20 GKED Cc1cc(Br)cc(C(CC(C)C)=NNc2ccccc2C(=O)O)c1 1776032280 XBLGXCDALOAZJX-UHFFFAOYSA-N 389.293 5.318 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@H](C(=O)O)c1ccc(Cl)cc1Cl 1776180266 NVVTUNNGQNVCFR-HNNXBMFYSA-N 390.719 5.522 30 20 GKED C=CCc1ccccc1/C=C/c1cc(C(=O)O)c2ccc(Br)cc2n1 1776189028 AKDBVWHRDKKQMT-CSKARUKUSA-N 394.268 5.594 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CCCc2ccccc2)C(=O)O)c1 1776788189 WTKJVHRYVZVTRD-XMMPIXPASA-N 397.559 5.602 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)c(O)c2)o1 1777559817 GRJBYEAIVYLDGM-JXMROGBWSA-N 388.375 5.301 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3/CCOc4ccc(F)cc4C3=O)s2)cc1 1777670972 LONFGJKLXLRRGG-PTNGSMBKSA-N 394.423 5.301 30 20 GKED N#CCc1ccc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)cc1 17368355 GVVURTVVSKMWBN-UHFFFAOYSA-N 375.042 5.014 30 20 GKED C=CCOc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC)cc2)cc1OC 22790464 OMLAVSVTJMJPGM-VWLOTQADSA-N 389.495 5.148 30 20 GKED C[C@@H]1CCCC[C@@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 48161442 WHLJPMHOTRODON-UTKZUKDTSA-N 377.488 5.032 30 20 GKED CCC(CC)c1cc[n+](/C(C(=O)c2ccc(C)s2)=C(/S)NC(C)C)cc1 55009800 FGOWBZRXNKANAG-UHFFFAOYSA-O 389.610 5.184 30 20 GKED Cc1cc(O[C@H](C)C(=O)Nc2ccccc2SCCC#N)ccc1C(C)C 78668596 RRRBBTAYVNKYRV-QGZVFWFLSA-N 382.529 5.530 30 20 GKED CCc1cccc(CC)c1NC(=O)CNc1ccccc1SC[C@H](C)C#N 108408326 YNNSEZAVJNRRSB-MRXNPFEDSA-N 381.545 5.114 30 20 GKED COc1ccc(CNc2cccc(-c3nccs3)c2)cc1OCCCC#N 120784294 BYOXTIDZVNIEOG-UHFFFAOYSA-N 379.485 5.113 30 20 GKED Cc1noc(C2CC2)c1NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 122125804 QSEJTKXJOUOQNX-UHFFFAOYSA-N 392.390 5.308 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cccc(OC(F)(F)F)c1 153625167 FNSSVFONMNJMPY-LBPRGKRZSA-N 380.391 5.232 30 20 GKED CC(C)(C)[C@@H](C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 155109884 PVLUCORNTOCIBX-MRXNPFEDSA-N 384.526 5.455 30 20 GKED FC(F)(F)Cn1ccnc1CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 172848267 HYVUTDHQPDLBPC-UHFFFAOYSA-N 391.237 5.095 30 20 GKED COc1cc2c(cc1OC)[C@@H](c1cccs1)N(CCCC(C)(C)C#N)CC2 174809635 UCNQUHRMCDJWSI-NRFANRHFSA-N 384.545 5.043 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2sc(-c3ccccc3)cc2C#N)s1 175641030 HRZHQUJFIXODNV-LBPRGKRZSA-N 383.498 5.011 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cccc(OCc3cccs3)c2)n1 177759663 LNPWAORMALIRHX-QGZVFWFLSA-N 382.510 5.397 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)c2ccc(Br)s2)n1 177765484 QSMJYVSEXZDYBL-NXEZZACHSA-N 383.336 5.070 30 20 GKED CC(C)[C@H](CNC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccnc1 177847564 UIKHRMSXHDZPQD-AEFFLSMTSA-N 382.533 5.037 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 178141013 NSEWWZSNJHEQDR-UHFFFAOYSA-N 382.467 5.125 30 20 GKED CC(C)n1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)cn1 189725822 SDBJTIZQLPZCLY-LJQANCHMSA-N 378.863 5.025 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)CCc3cc(Cl)cs3)cc2)c1 303815470 WDNJOTORPMHNKM-UHFFFAOYSA-N 396.899 5.423 30 20 GKED Cc1nc([C@H]2CCCOC2)sc1C(O)=Nc1cccc(C(F)(F)F)c1C 328938873 RTSOQKOVFRCFNX-LBPRGKRZSA-N 384.423 5.309 30 20 GKED CCN(C(=O)c1ccc(OC2CCCC2)c(OC)c1)[C@@H](C)c1ccc(C#N)cc1 410290876 WWMSALSOFIBKGD-KRWDZBQOSA-N 392.499 5.112 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)N[C@H]1CCCc2cc(C#N)ccc21 419647661 QZXFPPKLTPKEPJ-BEFAXECRSA-N 396.560 5.227 30 20 GKED N#CCSc1cccc(C(=O)N(CCc2ccc(Cl)cc2)CC2CC2)c1 430591683 BATMKYNAXUCNQQ-UHFFFAOYSA-N 384.932 5.051 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2c(Cl)cncc2Cl)cc1 432900271 YBBJGNRMCCPVKK-UHFFFAOYSA-N 384.222 5.305 30 20 GKED CN(C(=O)c1cc(C#N)cs1)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 437985620 KHGONOQPHQVAQC-IBGZPJMESA-N 384.863 5.274 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)C(=O)c2ccc(C#N)cc2C)cc1 438829112 JGRWIMYFZWDVSW-SFHVURJKSA-N 384.479 5.376 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)N[C@H](CCC#N)c2ccccc2)c(C)c1 439359544 PAYQZKLQGSSBMA-DYESRHJHSA-N 381.545 6.052 30 20 GKED C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCC[C@@H]1c1ccc(Cl)cc1 453468733 YOOXYSYZPQBAOJ-IPELMVKDSA-N 386.927 5.089 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl 460874875 KDEXQGOKSAMQFF-UHFFFAOYSA-N 391.943 5.117 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)c2nc3ccccc3s2)cc1 465461759 VQUWIKWMXGRXOI-UHFFFAOYSA-N 399.475 5.545 30 20 GKED C=CC[C@H](CC)NC(=O)c1ccccc1Sc1ccc(Br)cn1 466540705 HARFGZCNJSSTSJ-AWEZNQCLSA-N 391.334 5.080 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](c1ccc(OC)cc1)C(F)(F)F 468000337 NFPXZMJDBOJYLW-LJQANCHMSA-N 392.421 5.087 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3c(F)cccc3NC3CC3)c2)cc1 468902114 IIKFTNYMWSQPOE-UHFFFAOYSA-N 386.430 5.268 30 20 GKED CCSc1ccccc1[C@H](C)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 469274721 RKYZPXPJYXYNMN-KRWDZBQOSA-N 393.556 5.555 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3cc(F)ccc3C#N)C2)nc2ccccc21 469340638 ZBHKEKSMMDTAHH-GOSISDBHSA-N 376.479 5.008 30 20 GKED N#Cc1c(NC(=O)CCc2cnc3ccccc3c2)sc2c1CCCCC2 470727446 OSHWWFQMTFPXCP-UHFFFAOYSA-N 375.497 5.008 30 20 GKED CC(C)(C)c1nc2ccc(NCc3nnc(-c4cccc(C#N)c4)o3)cc2s1 471646920 NSLWXOGCWQAMNQ-UHFFFAOYSA-N 389.484 5.128 30 20 GKED C[C@@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(F)(C#N)CC2)cc1 477089177 LGPMMHNJGRXBNC-MRXNPFEDSA-N 383.492 5.399 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnn(-c3ccccc3Cl)c2C)c1 482238897 KKDKOQZYSIHLGW-UHFFFAOYSA-N 381.863 5.041 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1 483322663 ICHLSJXAUMEALU-HXUWFJFHSA-N 398.940 5.271 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 487485300 LUYDNPRTTCWUET-AABGKKOBSA-N 386.417 5.360 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@@H]2C)o1 499710985 PUGHMIUDYBNKMU-DRPJVOAASA-N 375.921 5.436 30 20 GKED C[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccc(F)c2ccccc12 500098695 MYBOOKLPNQSAKM-AOMKIAJQSA-N 375.447 5.384 30 20 GKED Cc1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1C(F)(F)F 502388716 BJKBHOZOUGVZTJ-UHFFFAOYSA-N 377.366 5.340 30 20 GKED CN(Cc1ccccc1)c1ccccc1NC(=O)c1cc(C#N)ccc1Cl 508415748 CCKPSOMLPXHUSQ-UHFFFAOYSA-N 375.859 5.100 30 20 GKED Cc1c(C(=O)Nc2ccccc2S[C@H](C)CC#N)cnn1C1CCCCC1 511023413 CBKVEQNGJZNAKY-OAHLLOKOSA-N 382.533 5.343 30 20 GKED Cc1cc(CN(C(=O)c2ccc(F)c(C#N)c2)C2CCCC2)c2ccccc2n1 511721874 IRVJJSHRGAVEPU-UHFFFAOYSA-N 387.458 5.139 30 20 GKED CC(C)c1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc4ccccc4[nH]3)cs2)cc1 513655623 SIFRACVQMRTXFV-MRXNPFEDSA-N 386.480 5.300 30 20 GKED CCc1ccccc1NC(=O)[C@@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1 517168618 GUBSKZRGNHSHGA-QGZVFWFLSA-N 385.467 5.352 30 20 GKED CC(C)[C@H](Oc1ccccc1C#N)C(=O)Nc1cc(C(F)(F)F)ccc1Cl 517176655 ZTIONMRDHBRRHK-KRWDZBQOSA-N 396.796 5.273 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)c(C)c1 518259414 KTFXFEOWNBRGMP-MSOLQXFVSA-N 381.545 5.923 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C)CC(C)(C)c1ccccc1 518755416 HTTGMUFLMAQLGL-MSOLQXFVSA-N 395.572 5.959 30 20 GKED CCOc1ccc(SCC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 521725917 FWQWQIKHNSRMLH-OAHLLOKOSA-N 386.542 5.068 30 20 GKED C=CCOc1ccccc1CNC(=O)N(C)[C@@H](C)c1ccc(Cl)c(Cl)c1 522066795 AGYINYAQHATQCZ-AWEZNQCLSA-N 393.314 5.461 30 20 GKED Cc1ccc([C@@H]2CCCCCN2C(=O)Nc2cccc(C#Cc3ccccn3)c2)o1 523456347 ATBKBGHZURTUNV-QHCPKHFHSA-N 399.494 5.532 30 20 GKED N#CCc1ccnc(NC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)c1 531671482 OAXJYMOTJFPHEN-UHFFFAOYSA-N 398.441 5.006 30 20 GKED COc1ccc(-c2nc3c(s2)[C@@H](N[C@H](C)c2ccc(C#N)cc2)CCC3)cc1 531695534 NPDHFGGGRLLFQV-QRWLVFNGSA-N 389.524 5.419 30 20 GKED C=C(C)COc1cccc(NCc2ccc(OCc3ccncc3)c(OC)c2)c1 532727155 UJLAZTBXXNOBCZ-UHFFFAOYSA-N 390.483 5.236 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCCOc3cc(Cl)ccc32)cc1 538339488 DLNHBCOSSPHPPR-SFHVURJKSA-N 383.879 5.177 30 20 GKED C[C@@H](NCc1csc(-c2ccoc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542017043 CLSTWIAARXKMJO-MRXNPFEDSA-N 385.492 5.793 30 20 GKED CC(C)[C@@H]1C[C@@H](CC(=O)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)CCO1 542928921 XFLGPIWEVPTJPU-JXQFQVJHSA-N 390.527 5.244 30 20 GKED N#Cc1ccc(CCc2nc(C(F)(F)c3ccc(Cl)c(Cl)c3)no2)cc1 546550010 OEOHOHKYNWLNBC-UHFFFAOYSA-N 394.208 5.173 30 20 GKED N#Cc1ccc(C(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)cc1Cl 547954312 LWCRGQREEUVOKF-UHFFFAOYSA-N 382.250 5.107 30 20 GKED Cc1nc(CSc2ccc(C(=O)N[C@@](C)(C#N)C3CCCCC3)cc2)cs1 550352062 WQKZXHYFAFSVBA-NRFANRHFSA-N 399.585 5.336 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)c1ncc(C#N)cc1C)C1CCCC1 550631974 XEBWZBVQLDHXAB-UHFFFAOYSA-N 399.494 5.009 30 20 GKED C[C@H](NC(=O)NCC(C)(C)C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 558710963 DOGDIYQNLJZRLB-AWEZNQCLSA-N 389.421 5.174 30 20 GKED N#C[C@@H](C(=O)c1ccn(C2CCCCC2)n1)c1nc2cc(Cl)ccc2s1 558832408 WAJSXYSCYJFBKN-AWEZNQCLSA-N 384.892 5.141 30 20 GKED CCCN1Cc2cccc(NC(=O)c3sc4ccc(C#N)cc4c3C)c2C1 559492122 WVMFFPWBXIVPOW-UHFFFAOYSA-N 375.497 5.059 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)C1CCC(C(F)(F)F)CC1 559591877 PPFAPVAQRIMBOS-UHFFFAOYSA-N 386.417 5.460 30 20 GKED N#CCCN(C(=O)c1ccc(-c2ccc(F)cc2)cc1F)c1ccc(F)cc1 569465612 RCLHWKVMWUZVGJ-UHFFFAOYSA-N 380.369 5.331 30 20 GKED N#Cc1cscc1C(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 572980428 SGSQLFAJZUIQDT-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CC[C@@H](C)c1nnc(N2CC=C(c3ccc(C#N)cc3)CC2)n1Cc1ccccc1 578928691 ISEZQWNDRKSSSW-LJQANCHMSA-N 397.526 5.005 30 20 GKED Cc1cc(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ccc1F 590827933 XWKBNONTTWQRDF-UWVGGRQHSA-N 386.311 5.165 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)c1sc2cc(F)ccc2c1Cl 603934680 YNFUQFLNCYPFMM-UHFFFAOYSA-N 375.856 5.374 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2csc(C(C)C)n2)cc1 608808293 ZSIPJQGACVDFBP-UHFFFAOYSA-N 393.468 5.191 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(F)cc1)C(C)(C)C 608918841 YXAMSCKUVWJXMM-OAQYLSRUSA-N 381.495 5.405 30 20 GKED CCN(C(=O)[C@H](C)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 609221977 MHRNAIIYLJIBCG-SFHVURJKSA-N 385.467 5.204 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)C1CCCC1 609437040 LZIVCJZYJJJYMS-JTSKRJEESA-N 393.556 6.134 30 20 GKED CC(C)c1ccc(CCC(=O)NC2CCC(Oc3ccccc3C#N)CC2)cc1 609508820 BIXWHDXHURVVTM-UHFFFAOYSA-N 390.527 5.121 30 20 GKED CC(C)c1nc2cc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)ccc2o1 609810499 UPUUYOXUMSPJJV-UHFFFAOYSA-N 376.460 5.265 30 20 GKED CC(C)(C#N)c1ccc(CN[C@H](c2cccc(Cl)c2)c2ccccn2)cc1 614176656 KALWDALKSUYWRI-JOCHJYFZSA-N 375.903 5.415 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)NCc1ccc(C#N)c(Cl)c1 619796497 CCFIAVYHRIMOOK-UHFFFAOYSA-N 385.895 5.239 30 20 GKED Fc1cc(-c2ncco2)ccc1CN1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 662543709 MYMNZKZHBGETCE-BETUJISGSA-N 396.306 5.043 30 20 GKED C=C(C)COc1cc(CNc2cccc(OCc3cscn3)c2)ccc1OC 676321686 MKZJZNSHFFSWFJ-UHFFFAOYSA-N 396.512 5.298 30 20 GKED CCS[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)C(C)C 727627201 MARAQSNPZDRGHH-RHSMWYFYSA-N 378.950 5.417 30 20 GKED Cc1cccc(-c2nn(CN(C)[C@H](C)CC#N)c(=S)n2[C@H]2CCCC[C@@H]2C)c1 728901863 BNUHBQOISNTOFU-NSHGMRRFSA-N 397.592 5.332 30 20 GKED Cc1cccc2c1CCN(C(=O)Nc1ccc([C@H](C#N)c3ccccc3)cc1)C2 729552759 JTAGCRDITQBVCU-XMMPIXPASA-N 381.479 5.241 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1C=NN=c1cc[nH]c2ccccc12 730146209 KJTMKYDXGNWCES-UHFFFAOYSA-N 389.890 5.065 30 20 GKED COCCOc1ccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cc1 730464957 QCVNYRJHNACQQC-OBGWFSINSA-N 391.492 5.048 30 20 GKED N#Cc1ccc(NC(=S)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1Cl 730950305 IDTOFWATDHDTPB-FQEVSTJZSA-N 394.931 5.617 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=S)N[C@@H]2CCOc3ccccc32)cc1 741483745 NBBBVLPQFACPKV-FGZHOGPDSA-N 399.519 5.152 30 20 GKED CCc1ccccc1NC(=S)Nc1ccc(Oc2ccccc2C#N)c(F)c1 743034702 AZEXTBFBXQILRK-UHFFFAOYSA-N 391.471 5.861 30 20 GKED CCOc1ccc(Cl)cc1C(=O)/C=C\c1ccc(Oc2cnccn2)cc1 743056254 SDKSIDZFFXTJKE-UITAMQMPSA-N 380.831 5.217 30 20 GKED Cc1ccccc1-c1noc([C@H](C)ON=Cc2cccc(Cl)c2Cl)n1 744442596 DFROJGSHMRTUGH-LBPRGKRZSA-N 376.243 5.464 30 20 GKED COc1cc(/C=C\C(=O)c2cc(Cl)sc2Cl)ccc1OC(F)F 744868657 FNZFVFUBFRXCQX-RQOWECAXSA-N 379.211 5.561 30 20 GKED O=C(/C=C\c1cccc(NC(=O)C(F)(F)F)c1)c1ccc(-c2ccncc2)cc1 745989951 ICGPLGHGQCQSLZ-WTKPLQERSA-N 396.368 5.146 30 20 GKED COc1ccccc1C1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 749121907 AAGPSPKWICXFJB-OAQYLSRUSA-N 382.463 5.021 30 20 GKED C/C(=C\c1ccc(F)cc1)C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 749346796 KXRMKDCBBPLECJ-FOWTUZBSSA-N 387.414 5.235 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=S)Nc1ccccc1-c1ccccc1 750991911 VDZDIVORYSYNPA-UHFFFAOYSA-N 385.536 5.834 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccc(OCC4CCCCC4)cc3)o2)cc1 760456820 ZLCDQPRWNWTASB-UHFFFAOYSA-N 388.471 5.179 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2cccc(C(C)(C)O)c2)cc1 760870131 QGFDGATWCVHAMR-UHFFFAOYSA-N 386.451 5.139 30 20 GKED N#C[C@@H](NC(=O)c1sccc1SC(F)F)c1cccc(C(F)(F)F)c1 768175567 UDMBHLKEWUUBGV-SNVBAGLBSA-N 392.374 5.076 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](C)c3cn(C)c4ccccc34)n2)cc1 773983593 ZALWSPUDPSOPTL-QFBILLFUSA-N 399.519 5.590 30 20 GKED C#Cc1cccc(NC(=O)N2CCSC[C@H]2c2cccc(C(F)(F)F)c2)c1 776296154 CMJHZJFBQNJUSN-SFHVURJKSA-N 390.430 5.009 30 20 GKED CCCn1cc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)cn1 779595386 IOUFNYZZDILWPA-UHFFFAOYSA-N 380.879 5.009 30 20 GKED C=CCNC(=S)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 780215137 WWBLEEUJSCTMFW-UHFFFAOYSA-N 375.906 5.214 30 20 GKED C[C@@H](N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(C#N)cc1F 781423543 RQYRFCWNYCZNFJ-CRICUBBOSA-N 386.470 5.463 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C\C(=O)c2c[nH]c3ccc(Br)cc23)cc1 811699314 ZPMNVXPGHOMVJE-PRUHKGEBSA-N 395.256 5.117 30 20 GKED CC(=NNc1nccnc1C1CCC1)c1sc(-c2ccccc2F)nc1C 814932286 VLLQWNLPHXWAJZ-UHFFFAOYSA-N 381.480 5.151 30 20 GKED O=C1/C(=C/c2ccccc2OCc2ccccn2)CSc2ccc(F)cc21 819842252 LFHMLTKZRQHBHO-LFIBNONCSA-N 377.440 5.172 30 20 GKED CC(C)(C)c1ccc(C(=O)Nc2ccc(OC(=O)CCCCC#N)cc2)cc1 846771249 VIGQZSNCNVKLOZ-UHFFFAOYSA-N 378.472 5.226 30 20 GKED Cc1nc(-c2c[nH]c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2)cs1 915086043 FSSRROPVYLMYNC-FQEVSTJZSA-N 398.491 5.354 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCOCc2ccccc2)cc1 915352870 KHQUAKJGPRONCL-DEOSSOPVSA-N 399.494 5.070 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915354017 SVLQUAUMSJTRTC-GAJHUEQPSA-N 387.458 5.706 30 20 GKED COc1cc(C(C)=NNc2ccnc3cc(Cl)ccc23)ccc1OC(F)F 916269540 WITUPHGUOIFGRP-UHFFFAOYSA-N 391.805 5.334 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Cl)C(=O)c1ccc(Oc2ccccc2)cc1 916905590 MAZRIGOLVCPYCT-SFHVURJKSA-N 390.826 5.093 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 918491089 XOYVAFCWBKYKKF-SCLBCKFNSA-N 398.890 5.973 30 20 GKED CC[C@@H](C)c1nnc(N(CCC#N)CC2CC2)n1Cc1ccc(C)cc1SC 1613194605 YCESNEUTDQMOEJ-QGZVFWFLSA-N 397.592 5.000 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(Oc3ccccc3)cc2)cc1)C(=O)O 1776126768 WLULMXCRESLLJP-VHEJECIDSA-N 388.419 5.227 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(-c2ccccn2)c1 1776355493 SYHJWRBEECHIAN-LUAWRHEFSA-N 387.435 5.130 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)cc1 1776388555 DTFITQLSBJASLX-DHZHZOJOSA-N 392.407 5.034 30 20 GKED CC(/C=C/C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1)=C\c1cc(F)cc(F)c1 1776398812 KDUWDEPTXSXFNJ-JPYKHUDHSA-N 394.373 5.765 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C/c1ccc(-c2ccc(C(=O)O)cc2)s1 1777038305 AUHFOOXDTQDEGR-DHZHZOJOSA-N 395.455 5.215 30 20 GKED CN(C)c1cc(F)ccc1C(=O)/C=C\c1ccc(-c2cccc(C(=O)O)c2)s1 1777038347 HTKOMKIMZNCQQM-YFHOEESVSA-N 395.455 5.215 30 20 GKED COc1cccc(Oc2ccc(/C=C\C(=O)c3ccc(C(=O)O)s3)cc2)c1 1777382072 NQQIBHXDHBFJGF-YFHOEESVSA-N 380.421 5.143 30 20 GKED C=CCn1c(SCc2csc(-c3ccccc3OC)n2)nc2ccccc21 39576224 CSHBHWXGUBEWHM-UHFFFAOYSA-N 393.537 5.647 30 20 GKED COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)[C@@H](C#N)c2ccccn2)cc1 41492721 ULUMNCWHITZDMI-NRFANRHFSA-N 395.462 5.048 30 20 GKED CCCCN/C(S)=C(\C(=O)c1ccccc1C)[n+]1ccc(C(CC)CC)cc1 55013009 IAWRCAKACGREKB-UHFFFAOYSA-O 397.608 5.515 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)cc3)cc2nc1C 66037475 PUBMTGWQOANVFP-UHFFFAOYSA-N 394.434 5.163 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)C3(c4ccccc4)CCOCC3)cc2)c1 66789241 QWDPAXVUUZMUQK-UHFFFAOYSA-N 398.462 5.037 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1Cc1ccccc1 66953991 PNDIEFCFLJPKSD-HKUYNNGSSA-N 379.529 5.320 30 20 GKED COc1ccc(CN[C@H](C)c2ccc3c(c2)CCCC3)cc1OCCCC#N 72049928 HJXUMTZXYKIKAN-GOSISDBHSA-N 378.516 5.107 30 20 GKED Cc1c(C(=O)Nc2ccc(Cl)c(C#N)c2)oc2ccc(Br)cc12 105409770 QQGHOTWJYHVJTL-UHFFFAOYSA-N 389.636 5.281 30 20 GKED Cc1nc(C)c(C#N)c(S[C@H](C)c2nc(C)c(-c3ccc(Cl)cc3)o2)n1 129599093 DXXKGOGZXVOMKB-GFCCVEGCSA-N 384.892 5.435 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 131338568 WXUXOIICEDVZCY-RDTXWAMCSA-N 375.394 5.111 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)cc1 156757514 VWYKHQJSASLMGN-UHFFFAOYSA-N 385.920 5.195 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1C[C@H]1c1sccc1C 161422950 MMNLMNWVAVKMRL-QZTJIDSGSA-N 389.480 5.166 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1 173133849 RMSJFNYDCFZLPZ-UHFFFAOYSA-N 381.284 5.017 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(-c3nc4ccccc4s3)o2)n1 177747527 YWPJSXTZRGCCHJ-GFCCVEGCSA-N 393.493 5.626 30 20 GKED C=CCN(CC(F)(F)F)C(=O)c1ccc(-c2ccccc2OC(F)(F)F)o1 189100388 RDDIRDSCVRAJDH-UHFFFAOYSA-N 393.283 5.036 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(NC(=O)c2cccc(SCC#N)c2)c1C 192043156 XJMTZUWCNVXRML-UHFFFAOYSA-N 396.903 5.011 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](c1ccccc1)[C@H]1CCCO1 246249607 LFHXIDFALQSPKY-BSIFCXSSSA-N 395.528 5.123 30 20 GKED O=C(NCC#Cc1cccc(C(F)(F)F)c1)c1sc2ccccc2c1Cl 247381197 JIJSVIITDRLOTG-UHFFFAOYSA-N 393.817 5.355 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\Cc3ccc(F)cc3C2=O)cs1 255232061 MLGGLCRHYAHUTH-MHWRWJLKSA-N 392.455 5.098 30 20 GKED C[C@@H]1CCc2sc(NC(=O)c3scnc3C(F)(F)F)c(C#N)c2[C@@H]1C 297760854 IXPMYKWEDWGYOU-HTQZYQBOSA-N 385.436 5.033 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@@]3(CC=CCC3)C2)c1 303622423 XEUOXTFBACCAIN-VWLOTQADSA-N 386.495 5.100 30 20 GKED N#Cc1cc(Cl)ccc1N1CCC[C@H](c2n[nH]cc2N=C(O)C2CCCC2)C1 330043838 HLMPEMWECMKMLB-HNNXBMFYSA-N 397.910 5.097 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ccc(C(C)(F)F)nc3)c2C#N)[C@@H](C)C1 410977236 KPUVQECYPOWNBY-QWRGUYRKSA-N 375.444 5.065 30 20 GKED CC(C)(C)c1cc(C#N)c(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)s1 411006870 KPJVQSWLGHGGHS-UHFFFAOYSA-N 388.361 5.467 30 20 GKED CCC(CC)(C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C)c1ccccc1 440381152 CDBBKBYPRAEXDU-UHFFFAOYSA-N 399.494 5.751 30 20 GKED Cc1sc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1-c1ccc(F)cc1 447238447 NQMXDXARDBFKSN-MRXNPFEDSA-N 392.480 5.962 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(-c2ccccc2C(F)(F)F)on1)c1ccccc1 462243142 AQKFBMUWUZKWMP-QGZVFWFLSA-N 399.372 5.135 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N[C@H](C#N)c1c(Cl)cccc1Cl 463776308 PNXXDQLBTLXSQB-YVEFUNNKSA-N 379.262 5.082 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)[C@H](C)c1cccc(C#N)c1 463956561 XTMMLMSEOQIWKM-MRXNPFEDSA-N 386.499 5.092 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@H]2c2cccc(F)c2)c2ccccc21 468850156 GFKTYOKLSBIJEY-NRFANRHFSA-N 375.447 5.061 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 472122465 PBJJZCXFFHIMNI-IBGZPJMESA-N 394.412 5.607 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccc(Oc3ccncc3)c(Cl)c2)n1 474445359 MAWZKYIFBQYFBP-HNNXBMFYSA-N 397.887 5.597 30 20 GKED Cc1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c(C)cc1Cl 474785370 YLRBTBODTTWDKY-UHFFFAOYSA-N 391.858 5.577 30 20 GKED C=CCOc1ccc(CN[C@H](c2ccc(C)cc2)c2ccccn2)cc1Cl 475332205 JOLRSIOQKQJKJH-HSZRJFAPSA-N 378.903 5.487 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](c4ccccc4)C3)cc2)cc1 477398665 ZTLYKQOVWDGBRA-FQEVSTJZSA-N 383.451 5.372 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](c1ccc(C)cc1)C1CC1 477881967 TWJHAUGQERVPAQ-JOCHJYFZSA-N 380.536 5.011 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCOc1ccc2c(c1)CCC2 481796392 PWNONIQAARVEMO-KRWDZBQOSA-N 394.540 5.225 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 483480858 XHLRQWLSVIATNH-AWEZNQCLSA-N 391.496 5.463 30 20 GKED CCc1c(C)sc(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)c1C#N 484329755 BJLFRIQAAXZYIS-UHFFFAOYSA-N 387.464 5.407 30 20 GKED Cc1nc2c(s1)CCC[C@H]2C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 485779145 UZSDWSYGRNSAPX-GOSISDBHSA-N 389.480 5.174 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(Oc2ncccn2)cc1C 486239155 IBCHVDBCOFCIHX-UHFFFAOYSA-N 377.469 5.108 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1ccc(SCc2ccccc2)cc1 500556434 LMHFLZDQEVVVFO-UHFFFAOYSA-N 388.492 5.502 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3[nH]c4ccc(Cl)cc4c3Cl)CC2)cc1 503974222 VZYWEHSEIHVYEO-UHFFFAOYSA-N 396.277 5.276 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 510463970 JKYVHXPLBNAOFK-NRFANRHFSA-N 385.854 5.428 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 510678459 FQPUIRRBJVDGCS-HSZRJFAPSA-N 397.478 6.028 30 20 GKED C[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(C#N)cc1F 512276880 ADNRHYXIVHOYRQ-MRXNPFEDSA-N 380.467 5.278 30 20 GKED CC(C)(CCC#N)CNC(=O)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 513135173 HLILGAPLZTXUOG-KRWDZBQOSA-N 381.442 5.272 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(-n2cccc2)c(F)c1 517521962 IOYFMJFIOIMWLR-HNNXBMFYSA-N 379.460 5.263 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N[C@@H]3CCCOc4ccccc43)c2)cc1 517903852 ZPLZKRIFIOYVDF-JOCHJYFZSA-N 399.450 5.386 30 20 GKED Cc1cccc([C@H](C)NC(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)c1C 522464285 NIBVNFGEAAUIMB-INIZCTEOSA-N 390.512 5.105 30 20 GKED Cc1cccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c1Cl 525310503 XJRYQJJAXBZXKF-UHFFFAOYSA-N 376.843 5.351 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(C(F)F)c2F)cc1 528920957 WAAIUASRYCFUMP-SJKOYZFVSA-N 388.389 5.238 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC2CCC(F)(F)CC2)cc1F 536397904 OFBGFNDXWFSEQT-UHFFFAOYSA-N 389.377 5.189 30 20 GKED CCOCCOCc1cccc(NC2CCC(C#N)(c3ccccc3)CC2)c1C 538821106 UNGCWJHCWCDZBF-UHFFFAOYSA-N 392.543 5.364 30 20 GKED N#CCC1CCN(c2nnc(CCC3CCCCC3)n2Cc2cccs2)CC1 549572614 AQMLGLAFMCZPSQ-UHFFFAOYSA-N 397.592 5.031 30 20 GKED CCCCN(C(=O)c1ccc(COc2ccc(C#N)cc2)o1)C1CCCCC1 551673268 JAWNPHCYVUYMIZ-UHFFFAOYSA-N 380.488 5.305 30 20 GKED CCc1cccc2c1OCC[C@@H]2NCc1cccc(OCc2ccccc2C#N)c1 553299387 WVOGVMVYAGIXDD-VWLOTQADSA-N 398.506 5.313 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCC[C@H]1c1ccccc1 554444904 UBAUZBUQFPUWRY-NZSAHSFTSA-N 379.529 5.396 30 20 GKED C=CCC1(c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)CCC1 561933657 VKCMTTZYLJAQKT-UHFFFAOYSA-N 375.350 5.408 30 20 GKED CCSc1cccc(F)c1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 566650627 VHZSVNBZXZKACU-SJLPKXTDSA-N 383.492 5.241 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1 572589867 ZMLOMZMKJFUGPS-MBOZVWFJSA-N 379.529 5.553 30 20 GKED N#CC[C@@H](Cc1nc(-c2ccc(C(F)(F)F)c(F)c2)no1)c1ccccc1 574361948 ACQJAEPLZBFNMM-ZDUSSCGKSA-N 375.325 5.134 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@H]3CSc4ccccc43)cc2)c1 580494440 DCFDUBRCERBPRA-FQEVSTJZSA-N 387.464 5.319 30 20 GKED Cc1cccc(-c2nc3ccc(F)cc3n2C(C)C)c1NC(=O)CC1(C#N)CC1 590985040 ZKGOCKRRAAMTAA-UHFFFAOYSA-N 390.462 5.364 30 20 GKED Cc1ccccc1-c1nc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cs1 592973304 CMDFNNXAKTXFKJ-CQSZACIVSA-N 393.468 5.357 30 20 GKED CC(C)(C#N)c1ccc(CN[C@@H](CC(=O)O)c2cc(Cl)cc(Cl)c2)cc1 593948367 WYKHDCKQPYYKHQ-SFHVURJKSA-N 391.298 5.100 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)Nc3ccc(C(C)(C)C#N)cc3)c12 603663091 LBNWIYHHWADIBU-UHFFFAOYSA-N 388.471 5.106 30 20 GKED N#Cc1cccc(COc2cccc(CNCCc3cccc4cccnc34)c2)c1 603682092 HYXGSCOPCWVISX-UHFFFAOYSA-N 393.490 5.018 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@H](C)C1 606940767 ZUNGEHOHHCKJGY-OALUTQOASA-N 385.552 5.015 30 20 GKED C[C@H](CN(C)C(=O)c1cccc(OCc2ccccc2C#N)c1)c1ccccc1 608947947 JPUBQXBXONKAPO-LJQANCHMSA-N 384.479 5.013 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(COc3ccc(C#N)cc3)o2)c1 609071758 ZFEOXQKAEFFOSY-JOCHJYFZSA-N 386.451 5.016 30 20 GKED Cc1cccc2cc(C(=O)N[C@@H](C#N)c3ccc(OCc4ccccc4)cc3)oc12 609173909 AOTQESRZWDJIHV-QFIPXVFZSA-N 396.446 5.315 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCCc3ccc(Cl)s3)cc2)cc1 609501865 IINRRDZXMMFTLX-UHFFFAOYSA-N 396.899 5.232 30 20 GKED CSc1ccc(NC(=O)c2cccc(Oc3ccc(Cl)cc3C#N)c2)nc1 609731893 OUDMRBOCJUWXQT-UHFFFAOYSA-N 395.871 5.373 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCS[C@H](c2ccccc2)C1 609811032 ILLLLEMZKLTPHJ-UZLBHIALSA-N 397.569 5.260 30 20 GKED Cc1nc(CSc2ccccc2C(=O)N[C@H](C)c2cccc(C#N)c2)cs1 610364806 UUTHFRKQCVXSOG-CQSZACIVSA-N 393.537 5.107 30 20 GKED Cc1c([C@H](C)N[C@H]2CCc3cc(C#N)ccc32)cnn1-c1cccc(Cl)c1 618803252 HRZNRWFIRPSTFS-FPTDNZKUSA-N 376.891 5.044 30 20 GKED C=CC[C@H]1CCN(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)C1 626323312 ZTXJNTHMECPPGK-INIZCTEOSA-N 397.906 5.047 30 20 GKED COc1ccc(/C=C2/CCc3[nH]c4ccc(F)cc4c3C2=O)c(Cl)c1OC 730434235 MTMPVCHCHKBNRN-XFXZXTDPSA-N 385.822 5.190 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccc2ccccc2n1 730687665 ZGMQDLQRBXHBKC-ZACQAIPSSA-N 381.262 5.522 30 20 GKED N#Cc1ccc(NC(=S)N2CC[C@H](c3ccc(Cl)cc3)C2)cc1Cl 731949724 LBQILQBCYLOVAX-AWEZNQCLSA-N 376.312 5.051 30 20 GKED Cc1ccccc1[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)C1CC1 732878898 SBJBNNKAHWFBJP-LOSJGSFVSA-N 395.506 5.923 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2ccc(F)cc2)cc1F)c1ccc(Cl)cc1 733258414 ASPQUSOKFYSMJK-FQEVSTJZSA-N 382.797 5.280 30 20 GKED O=C(/C=C/c1c(Cl)nc2ccccn12)c1ccc(SCC(F)F)cc1 741843834 QYRJHKQMXFADIN-CMDGGOBGSA-N 378.831 5.241 30 20 GKED Cc1c(C(=O)/C=C\c2csc(-c3ccccc3)n2)cnn1-c1ccc(C#N)cc1 741845463 WYDLTSHJWSIYFZ-XFXZXTDPSA-N 396.475 5.072 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2\C(=O)c3cccc(Br)c3[C@@H]2C)cc1 742435508 UTDXQWTTYQBMQV-GBJXNIFPSA-N 382.257 5.123 30 20 GKED C[C@H](NC(=O)Nc1cccc(Cl)c1SC(F)F)c1cccc(C#N)c1 743136855 XANCBQCDSXWVMW-JTQLQIEISA-N 381.835 5.409 30 20 GKED CN(C)c1ccc(N(C)C(=O)c2ccc(Sc3ccccc3C#N)cc2)cc1 748673022 GYMBVPDVDZCMRE-UHFFFAOYSA-N 387.508 5.052 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](Cc2ccc(Cl)cc2)c2ccccn2)cc1 767420696 LDRQAPQGTPEDQY-GAJHUEQPSA-N 391.902 5.099 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)OCc2cnoc2C2CC2)cc1 773430615 SNLPOXGJFBEKCK-UHFFFAOYSA-N 390.464 5.073 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(N(C)C)cc1 775488598 PHOBLWQZGFEODH-HOYKHHGWSA-N 398.510 5.291 30 20 GKED C[C@@H](Nc1ccc(CC[C@H](O)c2ccccc2)cc1)c1ccc(OCC#N)cc1 777676013 SEAVOBVWXCEXLN-CLOONOSVSA-N 386.495 5.428 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccc(F)cc1)C1CCCCC1 780668280 AYTXQURNUQUWTG-QGZVFWFLSA-N 395.478 5.483 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)c1 781646113 OMJXFPVYEWXONT-DENIHFKCSA-N 381.541 5.104 30 20 GKED Sc1nnc(-c2ccc(Cl)cc2Cl)n1N=Cc1cc(Cl)cs1 782144324 XVPQLIKFUZSOEM-UHFFFAOYSA-N 389.720 5.138 30 20 GKED Oc1ccc(Cl)c(F)c1CN[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 790949609 NWMYKIRUOCUOPN-BRPSZJMVSA-N 393.730 5.184 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(Br)c1 792105216 UBEZLMRNYVQGIG-GOSISDBHSA-N 393.284 5.151 30 20 GKED COCCN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@@H]1CC[C@@H](C)C1 792230710 XJYRTKORHYBJNG-SXSPYAJSSA-N 391.515 5.011 30 20 GKED C[C@H](Oc1ccc2ccccc2c1)C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1 796660185 BRMRWHQUFHLZGW-YWZLYKJASA-N 399.475 5.002 30 20 GKED N#CC1(CCCOC(=O)[C@@H](Sc2ccccc2)c2ccccc2)CCOCC1 800082737 LURRXOZZARMPSW-NRFANRHFSA-N 395.524 5.164 30 20 GKED CC(=C/c1cccc(C(F)(F)F)c1)/C=C1\S/C(=N/C2CCCC2)NC1=O 806570380 YAXRFHQFVSQHCC-MNXDUIDKSA-N 380.435 5.154 30 20 GKED COc1ccccc1C1(C(=O)[C@@H](C#N)c2nccc3ccccc23)CCCCC1 816045146 CNJRYBFETOBANX-FQEVSTJZSA-N 384.479 5.322 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc(Cl)nc(C3CC3)c2)cc1 847626952 VIQTVPJESYXKDR-ACJLOTCBSA-N 395.890 5.087 30 20 GKED Cc1ccc(F)c(NC(=S)NC(CCC(F)(F)F)CCC(F)(F)F)c1 849303125 WLNHOVOMXXMUCI-UHFFFAOYSA-N 390.368 5.474 30 20 GKED Cc1c(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)ccnc1F 862398224 BSDQQYAQJSZSCW-UHFFFAOYSA-N 384.270 5.431 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(F)ccc2F)cc1OCc1ccccc1 916134147 FAKANTBMMUSKEY-XFFZJAGNSA-N 380.390 5.449 30 20 GKED CCOc1cc(/C=C/C(=O)c2cccc(Br)c2)cc(Cl)c1O 916134284 HZBOTZRMIXGAHL-VOTSOKGWSA-N 381.653 5.103 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3ccc(F)cc3)CC2)cc1 916623257 NHDJZSQDUJCWQV-QHCPKHFHSA-N 399.469 5.334 30 20 GKED Cc1ccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1C 916652558 CPUHLOLPWLEYFX-GOSISDBHSA-N 380.900 5.499 30 20 GKED COc1ccc(OCc2nc(/C=C3/Cc4c(Cl)cccc4C3=O)cs2)cc1 921263935 LJALMKUAXLZKDJ-LCYFTJDESA-N 397.883 5.207 30 20 GKED COc1cc(C(=O)O)ccc1NN=C1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 1776050330 GYFZFOGASKOWPE-ZDUSSCGKSA-N 392.377 5.148 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NNCCC(C)(C)C 1776053990 ODYXTMNUHUKASB-UHFFFAOYSA-N 396.531 5.298 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3)s2)c1)C(=O)O 1776470955 RMGJJWFJTDJPOX-KUGGDMIFSA-N 378.449 5.163 30 20 GKED C[C@@H]1C/C(=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2sccc21 1776589447 BDIRQDZAHNXWDX-QJMZJAKPSA-N 380.490 5.948 30 20 GKED CCCCCCCCc1ccc(C(=O)NCc2ccc(C(=O)O)cc2OC)cc1 1776786607 BKAQRLCVROOKJG-UHFFFAOYSA-N 397.515 5.226 30 20 GKED CCCCCCOc1ccc(/C=C\C(=O)c2ccc(C(=O)O)s2)cc1OC 1776788881 ATKUKRQRDBMQFJ-CLFYSBASSA-N 388.485 5.310 30 20 GKED C=CCN(C(=O)c1cccc(C(F)(F)F)c1)c1nc(-c2ccccc2)cs1 7724799 SBVMFEORIPQJDU-UHFFFAOYSA-N 388.414 5.662 30 20 GKED CN(Cc1nc2ccccc2s1)C(=O)c1ccccc1-c1ccccc1C#N 28024206 NUOXFYFDMMHUDS-UHFFFAOYSA-N 383.476 5.107 30 20 GKED N#C[C@H](C(=O)c1ccc(CSc2ccccc2)cc1)c1nc2ccccc2o1 41546676 NEDRIYFMRKGFHV-LJQANCHMSA-N 384.460 5.610 30 20 GKED CCCC(=O)Nc1cccc(NC(=O)c2ccccc2-c2ccccc2C#N)c1 55550217 AGOKRZLDCHPKHE-UHFFFAOYSA-N 383.451 5.216 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2nc3cc(Cl)ccc3o2)cc1 58594601 QGJXYALCSYWPDJ-AWEZNQCLSA-N 399.903 5.217 30 20 GKED CCCc1ccc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 64715484 MANGIFOHBDJGAM-HNNXBMFYSA-N 382.435 5.531 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc(Cl)cc3)n2)cc1 72032271 WXEKFLQJKPPKOO-PPCLGBEZSA-N 394.883 5.362 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 97547871 LVVUJACCLBHLJW-UHFFFAOYSA-N 393.446 5.051 30 20 GKED O=C(CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)NCC#Cc1ccccc1 105540213 ZJAPORIIPHVNGH-UHFFFAOYSA-N 396.465 5.075 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccccc1 121071137 SIYYMIWEVOICFM-XMMPIXPASA-N 399.494 5.570 30 20 GKED Cn1c([C@@H](NCc2ccccc2C(C)(C)C#N)c2ccccc2)nc2ccccc21 126007596 USKQNORDEZIECJ-DEOSSOPVSA-N 394.522 5.254 30 20 GKED Cc1ccsc1CCCC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 129594776 NZSKKJPJSOJCCD-KRWDZBQOSA-N 391.521 5.251 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cnc(Cc2ccccc2)s1 150920170 HSXVMHGEUCGXMJ-OAHLLOKOSA-N 393.537 5.238 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)CCCCOc3cccc(C#N)c3)c2)n1 153016608 RSADXQIUICAARW-UHFFFAOYSA-N 389.455 5.018 30 20 GKED N#C[C@H](NC(=O)c1ccc(F)cc1C(F)(F)F)c1cccc(Cl)c1Cl 157976257 UGWPHQUKCPUTMM-ZDUSSCGKSA-N 391.151 5.146 30 20 GKED C[C@H](CCC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1ccccc1 160576406 XEHSGHVBVUGMCT-OXQOHEQNSA-N 385.492 5.442 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1F 178710296 JLTPKYGQMQHCPQ-BXUZGUMPSA-N 389.352 5.080 30 20 GKED O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)c1ccccc1C(F)(F)F 182738843 UAGGXHZAILJCQP-CYBMUJFWSA-N 383.238 5.017 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccccc1)c1cccc(F)c1 184323483 NBCBRYNSCNNXFF-OPAMFIHVSA-N 389.430 5.028 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1 185433633 YBURINNEAIGZBT-UWVGGRQHSA-N 377.259 5.004 30 20 GKED C=C[C@H](CC(=O)Nc1cc(Cl)ccc1OC[C@@H]1CCOC1)c1ccccc1 188820965 AGPPSGXOXJBEPP-IAGOWNOFSA-N 385.891 5.054 30 20 GKED Cc1c(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cnn1C1CCCC1 192745667 CGVPRITZDXOIOA-UHFFFAOYSA-N 386.455 5.223 30 20 GKED COc1ccc(CN[C@@H]2CCC(C)(C)c3ccccc32)cc1OCCCC#N 237314547 RRHOXAHGFDPCBI-OAQYLSRUSA-N 378.516 5.280 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(C(C)C)cs1)c1ccccc1OC(F)F 255181768 HHEGQYSCZXUVTN-UNJUUPHPSA-N 376.428 5.148 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1)c1cccc(Cl)c1 255392369 QAPOYJOFDYUQHL-HOFZKYPUSA-N 379.872 5.138 30 20 GKED C=C(C)CN1CCC(NC(=O)Nc2ccc(-c3cccc(Cl)c3)cc2C)CC1 303256751 ADTUXZYNQZZGKA-UHFFFAOYSA-N 397.950 5.477 30 20 GKED CO[C@@H](C)c1cccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c1 303581608 DTYYXRUSOUKYTD-KRWDZBQOSA-N 386.451 5.097 30 20 GKED CCCC(O)(CCC)CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 303873451 XUJUOPYAKXNPCH-UHFFFAOYSA-N 395.503 5.112 30 20 GKED C[C@H]1C[C@@H](C(O)=Nc2nc(-c3ccc(Br)s3)cs2)CCC1=O 329399179 VKHHLLDQRDRORI-IUCAKERBSA-N 399.335 5.227 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1cccc(NC2CCCC2)c1 409565132 IECLXBFQCCWOCA-UHFFFAOYSA-N 381.479 5.832 30 20 GKED C[C@H](C#N)N(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CCC2 410886163 FNXWXYCARIPEAY-NWCRWOLESA-N 387.508 5.157 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(S(=O)(=O)C2CCC2)cc1 415528586 WGPQXMKIEGTVNC-UHFFFAOYSA-N 397.540 5.117 30 20 GKED C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1C[C@@H](C)C[C@H]1c1cccc(OC)c1 424237318 GFAYORCIAPGLRS-VDGAXYAQSA-N 398.576 5.018 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CC[C@@H](c2cccc(F)c2)C1 432095639 QMKKWQLXHOPTLC-SZVBFZGTSA-N 397.519 5.535 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Nc1cccc(C#N)c1C 432271052 NKDVJJSCHDTSAT-AWEZNQCLSA-N 394.475 5.320 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)Cc2ccccc2O1 432754179 JGQKICDLSJERRZ-KRWDZBQOSA-N 399.450 5.166 30 20 GKED N#C[C@H](CCc1ccccc1)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 433226868 IPYRLPIBBRFOTF-IBGZPJMESA-N 398.466 5.042 30 20 GKED N#CCC[C@@H](NC(=O)c1ccc(Br)c(Cl)c1F)c1ccccc1 435916905 OSTIJHQROHPOBK-CQSZACIVSA-N 395.659 5.016 30 20 GKED CCC[C@]1(C)CCCN(C(=O)Nc2ncc(Cc3ccc(C#N)cc3)s2)C1 437514342 BTZMMPVFUBNPPI-OAQYLSRUSA-N 382.533 5.040 30 20 GKED COc1ccc2cc([C@@H](C)SCC(=O)Nc3ccc(C#N)cc3)ccc2c1 438795605 YPKRVRPYIIYQJD-OAHLLOKOSA-N 376.481 5.153 30 20 GKED C=CCN(C(=O)[C@H]1CO[C@@H](C)C1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 439146038 KYFGZDYDAHZWPB-WCQYABFASA-N 397.327 5.061 30 20 GKED Cc1cscc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 439307187 VSXINVIUJOXQET-KRWDZBQOSA-N 381.888 6.009 30 20 GKED Cc1ccc(-n2c(S[C@H](C)c3cccc(C#N)c3)nnc2-c2ccncc2)cc1 442915998 UBCHOGURXBAAJP-QGZVFWFLSA-N 397.507 5.363 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(-c3cncs3)no2)cc1Cl 445581038 WWKPLKMQHUTHOM-UHFFFAOYSA-N 380.816 5.177 30 20 GKED CC(C)N(C(=O)c1cc(-c2cccc(C#N)c2)no1)c1cccc(C(F)(F)F)c1 448191439 QMUVTLMSJPBEEG-UHFFFAOYSA-N 399.372 5.287 30 20 GKED C[C@@H]1C[C@H](c2ccc(C(F)(F)F)cc2)N(C(=O)Nc2cccc(CC#N)c2)C1 455910946 UZNCINXWDYPUNQ-AUUYWEPGSA-N 387.405 5.386 30 20 GKED Cc1cc([C@@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)ccc1F 462172968 AYOGJTZJIASVCM-JOCHJYFZSA-N 382.841 5.678 30 20 GKED C=C(C)[C@@H](NCc1nc2ccc(Br)cc2o1)c1ccc(F)c(F)c1 463201490 JAXRPPYWUMSVLA-GOSISDBHSA-N 393.231 5.276 30 20 GKED Cc1ccc(-n2c(SCCCSCC#N)nnc2-c2ccccc2F)cc1 466618617 UDBAZNTZLCGZSB-UHFFFAOYSA-N 398.532 5.121 30 20 GKED Cc1cccc2c1OCC[C@H]2NCc1cccc(OCc2ccccc2C#N)c1 473998312 DLWMCLLPVSYGJY-XMMPIXPASA-N 384.479 5.059 30 20 GKED C=CCc1cc(C(=O)Nc2cccc(COC(C)(C)C)c2C)cc(OC)c1OC 474778259 ZGORWBAPHYGEKD-UHFFFAOYSA-N 397.515 5.308 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 475782239 QZFOTHFSGYMSOE-HXUWFJFHSA-N 381.435 5.377 30 20 GKED C[C@H](NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1c(F)cccc1Cl 478385192 UDXPRTBFLHPWDE-GMBSWORKSA-N 385.870 5.021 30 20 GKED N#Cc1cc(NC(=O)N2CCC=C(c3ccncc3)C2)ccc1Oc1ccccc1 482447402 MTKSZRLIRHTRBZ-UHFFFAOYSA-N 396.450 5.067 30 20 GKED N#CC[C@H](CC(=O)Nc1sc2c(c1C#N)CCCCCC2)c1ccccc1 483339994 JVNSUBGMRQFUJM-QGZVFWFLSA-N 377.513 5.305 30 20 GKED CC(C)n1ncc2ccc(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)cc21 483609241 VJGNLIALHOFRPG-UHFFFAOYSA-N 396.450 5.533 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(-c2ncc(C(C)C)o2)cc1 486230623 NFEULYJQJONCBY-UHFFFAOYSA-N 378.497 5.995 30 20 GKED C[C@@H](CC(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1)c1c[nH]c2ccccc12 486432315 JUCJIQGCOLIJSP-ORAYPTAESA-N 385.389 5.061 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Oc2ccccc2)cn1 487451744 UZYYREPFRBSIFR-UHFFFAOYSA-N 391.430 5.665 30 20 GKED C=CCC[C@H](C(=O)N(C)Cc1cc(OC)c(OC)cc1SC)c1ccccc1 488986172 QRTZNHMGZMUKLR-IBGZPJMESA-N 399.556 5.134 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)C[C@@H](C)C2 492092850 CRLMFUQJWKEGGH-GROYHEBESA-N 399.494 5.326 30 20 GKED COc1ccc2oc([C@@H](C)NCc3cc(C#N)ccc3Br)c(C)c2c1 492876954 YUXWAINBSVPAIB-CYBMUJFWSA-N 399.288 5.235 30 20 GKED CC[C@H](c1ccccc1)S(=O)(=O)Cc1ccc(-c2ccccc2C#N)cc1 494720105 HTEMTDHLHSDSJX-HSZRJFAPSA-N 375.493 5.291 30 20 GKED CCN(C(=O)CCCCCO[C@@H]1CCC[C@H](C)C1)[C@@H](C)c1ccc(C#N)cc1 499288929 WWODUEHKOQVERY-SXWKCWPCSA-N 384.564 5.623 30 20 GKED Cc1nc(CSc2ccc(C(=O)N(CCC#N)CCC(C)C)cc2)cs1 505207497 QQXLJQCMCWCOCW-UHFFFAOYSA-N 387.574 5.146 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)c1ccc(Cl)c(Cl)c1 505923537 VQTYOPODMRMXFQ-GYSYKLTISA-N 379.209 5.043 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cscc3Br)c2)cc1 511179260 USHAWGHOIVGTCD-UHFFFAOYSA-N 399.269 5.427 30 20 GKED CC(C)Oc1ccc(CN[C@@H](C)c2ccc(C#N)cc2F)c(C(F)(F)F)c1 512641504 HPXQMEHAZPQJFS-ZDUSSCGKSA-N 380.385 5.354 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)c1ccc(COc2ccccc2)cc1 513583041 UJJCWJAJYYZZTI-UHFFFAOYSA-N 384.479 5.188 30 20 GKED Cc1ccccc1Oc1ccccc1CNC(=O)N(C)Cc1ccc(C#N)cc1 520715270 PCLYJFSBAOVGJB-UHFFFAOYSA-N 385.467 5.001 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 524329360 FVMLAHTYYYJNIY-MSOLQXFVSA-N 387.310 5.406 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@H]1CCCc2ccccc21 524390311 BSHLMFLVNYMRHW-DEOSSOPVSA-N 396.490 5.504 30 20 GKED CC(C)C[C@@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)c1ccccc1 524817813 CVMQXHIFYUEHSZ-XPPIMPSXSA-N 390.527 5.194 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(Cc2cccc(-c3cccnc3)c2)C2CC2)cc1 527251198 VWHGQEAPQZIXNO-UHFFFAOYSA-N 395.506 5.355 30 20 GKED COc1ccc(CN[C@@H](c2cccc(C)c2)C(C)(C)C)cc1OCCCC#N 530686695 NPZKJPZHWVJDRS-QHCPKHFHSA-N 380.532 5.563 30 20 GKED COc1ccccc1[C@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccccc1Cl 539497659 PBLMMMMSDSNCRO-QMHKHESXSA-N 376.887 5.660 30 20 GKED C[C@H](NCc1ccc(F)c(C#N)c1)c1ccc(OCc2ccc(F)cc2)cc1 540404783 XKOJCJFVDKZWLF-INIZCTEOSA-N 378.422 5.266 30 20 GKED N#CCN(C(=O)c1ccc(-c2ccc(Br)s2)s1)C1CCCC1 543859030 YKTKSMVXMSETGO-UHFFFAOYSA-N 395.347 5.147 30 20 GKED COc1ccc([C@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)c1OC 552276720 HUAGNNSFDRQHKO-SFHVURJKSA-N 386.495 5.402 30 20 GKED COc1ccc([C@@H](CCC#N)NCc2ccc(CN3CCCCCC3)cc2)cc1 556063395 ASCGWTLZUPIPET-RUZDIDTESA-N 391.559 5.206 30 20 GKED COc1ccc([C@H](CCC#N)NCc2ccc(CN3CCCCCC3)cc2)cc1 556063396 ASCGWTLZUPIPET-VWLOTQADSA-N 391.559 5.206 30 20 GKED CC(C)(C(=O)Nc1cccc(CCC(F)(F)F)c1)c1cc(F)cc(C#N)c1 560581012 BTPSEWIDBVPPHQ-UHFFFAOYSA-N 378.369 5.109 30 20 GKED C=CCn1c([C@H](CC)c2ccccc2)nnc1N1CCC[C@@H]1c1csc(C)n1 583172300 BEVWMSBTSJHKLZ-UYAOXDASSA-N 393.560 5.112 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1nc(C2CC2)oc1C 586778885 SUDARKFYZRKKKM-UHFFFAOYSA-N 389.430 5.027 30 20 GKED N#Cc1ccc(C[S@@](=O)Cc2csc(C3CCCCC3)n2)c(Cl)c1 593201886 GOEVWDUPHVTDKW-XMMPIXPASA-N 378.950 5.165 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc2c1ccn2C(F)F 596981657 PIYKXTNJYMVZGX-XLIONFOSSA-N 394.425 5.340 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609208739 IMOPBWKJAJOCDM-INIZCTEOSA-N 375.428 5.086 30 20 GKED CN(C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)[C@@H]1CCc2ccccc21 609209179 UASSOCWZRYPALH-HSZRJFAPSA-N 383.451 5.502 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1ccccc1 609399172 DLEGFGHHOPKALO-JXFKEZNVSA-N 379.529 5.553 30 20 GKED Cc1csc(-c2ccc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)cc2)n1 611094051 YEMWAHHMAZYUFF-UHFFFAOYSA-N 388.279 5.549 30 20 GKED C[C@@H](NC(=O)N(Cc1ccccc1)Cc1ccc(F)cc1)c1cccc(C#N)c1 611263113 UXLCKAAYOHMGPC-GOSISDBHSA-N 387.458 5.170 30 20 GKED C=CCN(CC=C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 651590886 RUCPVRLDJXVTDA-ISLYRVAYSA-N 384.479 5.519 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(N(C)C)c(F)c2)ccc1SC(F)F 727653894 BFRGATBTLMVRDB-YVMONPNESA-N 381.419 5.111 30 20 GKED CC(C)COc1ncccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 728465963 MLDJMROGDRWTTH-JOCHJYFZSA-N 385.467 5.024 30 20 GKED C#Cc1cccc(NC(=O)N(Cc2cc(Br)ccc2F)C(C)C)c1 729037757 PMBRUCMQOQJWKD-UHFFFAOYSA-N 389.268 5.012 30 20 GKED N#C[C@@H](C(=O)c1sccc1-c1ccc(F)cc1)c1nc2cc(F)ccc2s1 730422420 XPGGXURWSSJESZ-HNNXBMFYSA-N 396.443 5.793 30 20 GKED C#CCOc1ccccc1[C@@H](C)OC(=O)Cc1sc(C)nc1-c1cccs1 730424331 XJYXGZREKRRHHN-CQSZACIVSA-N 397.521 5.039 30 20 GKED Cc1ccccc1NC(=S)Nc1cc(C(F)(F)F)ccc1SCCC#N 730954822 LPVVXYBWBRQHTB-UHFFFAOYSA-N 395.475 5.829 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCCC3(CCCCC3)C2)cc1 732417896 LNEZJVZPQDSGHG-QHCPKHFHSA-N 387.527 5.920 30 20 GKED COc1ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1Cl 740427681 BDQDXZYEFBKSAW-UHFFFAOYSA-N 397.887 5.270 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744016555 OLYPRUPQXZUANP-WONIAPNHSA-N 386.398 5.595 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)cc(Cl)c1OC 745989940 HGJCCSXNUXBFPG-BAQGIRSFSA-N 379.843 5.315 30 20 GKED CCOc1cc(/C=C\C(=O)c2c(C)nn(C(C)C)c2C)cc(Cl)c1OC 746346309 PDILCVBLWUHOAQ-HJWRWDBZSA-N 376.884 5.038 30 20 GKED COc1cc(C(=O)/C=C\c2ccc(OCC(F)(F)F)cc2)ccc1SC 747615312 UOIOMKIZOBTJKS-UITAMQMPSA-N 382.403 5.254 30 20 GKED N#C[C@H](C(=O)C1[C@@H]2CCCC[C@@H]12)c1nc(-c2ccc(Cl)cc2Cl)cs1 751151647 IZKOOPFYJIRPKM-YRGRVCCFSA-N 391.323 5.729 30 20 GKED CC(C)C[C@H](C)OCCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 756241795 LITVYMSIEANACD-JSGCOSHPSA-N 398.450 5.333 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(Br)cc1F 767739610 YOUIPXKDMDZNCE-RQOWECAXSA-N 394.290 5.669 30 20 GKED C[C@H](C#N)Oc1ccc(CN(Cc2ccc(C#N)cc2)Cc2cccc(F)c2)cc1 768914121 AOWQORJHEHWPJN-LJQANCHMSA-N 399.469 5.191 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 772983861 MNSVOVJPTOCVOM-NQIIRXRSSA-N 395.522 5.348 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N1CCC(Sc2ccc(Cl)cc2)CC1 773197006 XSOCGKMCDQDEMW-BJMVGYQFSA-N 382.916 5.008 30 20 GKED C[C@H](CCCC(F)(F)F)OC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 774732955 XPCHWITTYWBQLZ-CYBMUJFWSA-N 378.350 5.023 30 20 GKED C[C@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccc(N(C)C)cc1 775615352 VPXJZZISUKMALF-CVEARBPZSA-N 382.533 5.030 30 20 GKED O=C(Nc1cccc(C(F)(F)F)n1)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 775734130 ROXOAZWMYVOQED-NSHDSACASA-N 395.278 5.055 30 20 GKED Cc1nc(CSc2ccccc2C(=O)OCc2ccc(CC#N)cc2)cs1 776114327 NYUUFDGYOXYKMX-UHFFFAOYSA-N 394.521 5.167 30 20 GKED CC(C)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(C(F)(F)F)cc1 776171604 UKXFCYLBWKGNTM-QRWLVFNGSA-N 376.422 5.656 30 20 GKED CCCc1c(NC(=S)Nc2cccc(C)c2C)cnn1-c1cccc(C#N)c1 783952740 QJGIABJKIDBTLH-UHFFFAOYSA-N 389.528 5.122 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)[C@@H]2CCC(=O)c3ccccc32)c1 786138538 AOCFGIBMDFTEEX-JOCHJYFZSA-N 385.488 5.023 30 20 GKED N#CCCn1cc(/C=C/C(=O)c2cc(Cl)ccc2Cl)c(-c2ccncc2)n1 788344757 KOMGXTMRUVQHIQ-GORDUTHDSA-N 397.265 5.062 30 20 GKED N#CCSc1ccccc1C(=O)Nc1ncc(-c2ccc(Cl)cc2)s1 793832856 QOIWMQWFVLGYEI-UHFFFAOYSA-N 385.901 5.331 30 20 GKED C#C[C@H](NC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(Cl)cc1 810184405 QCUDYIXVLCTHED-YOEHRIQHSA-N 383.904 5.230 30 20 GKED Cc1ccc2ncc(C#N)c(N3CCC([C@H](O)c4ccc(Cl)cc4)CC3)c2c1 813594313 YUWFGTFDCOIMFF-HSZRJFAPSA-N 391.902 5.018 30 20 GKED C[C@H](NCc1c(F)cc(F)cc1F)c1ccc(OC(F)F)cc1OC(F)F 815650331 OQUHDWCFXZUVLQ-QMMMGPOBSA-N 397.290 5.158 30 20 GKED N#CCCCCC(=O)O[C@@H](c1c(F)cncc1Br)C1CCCCC1 847645039 LFYIIMKOPJJKPA-GOSISDBHSA-N 397.288 5.232 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)[C@@H]1CC[C@@H](c2ccccc2)C1 860469787 KTWNVDZTTNXHCQ-YPAWHYETSA-N 388.511 5.043 30 20 GKED N#CC[C@H](Cc1nc(-c2ccc(OCc3ccccc3)cc2)no1)c1ccccc1 904423487 LUSDRAHLDYDPJE-JOCHJYFZSA-N 395.462 5.556 30 20 GKED Cc1cc(/C=C/C(=O)[C@H](C#N)c2nc3ccccc3[nH]2)c(C)n1C1CCCCC1 916844770 BKPNGADCTOHNGT-SJFMBGHLSA-N 386.499 5.376 30 20 GKED CCCCCCCCCN(C)C(=O)Nc1ccc(-c2cc(O)nc(C)n2)cc1 918548554 XDZSFTYRTYNOIF-UHFFFAOYSA-N 384.524 5.372 30 20 GKED CCCOc1ccc2c(c1)C(=O)/C(=C/c1csc(-c3ccsc3)n1)CO2 920068921 GGANGQIPVLTSLM-RIYZIHGNSA-N 383.494 5.319 30 20 GKED CCOc1ccc(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 920341655 CPHNLLAMSYRHAK-HSZRJFAPSA-N 385.467 5.062 30 20 GKED COc1ccc(/C=C2\Oc3c(cccc3C(C)(C)C)C2=O)c2cc(C(=O)O)oc12 1776113362 HJOJQUKNYBZRJY-YVLHZVERSA-N 392.407 5.053 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1[N+](=O)[O-] 1776116209 UBXZCERTTJZNCI-CSKARUKUSA-N 393.420 5.226 30 20 GKED O=C(/C=C/c1cc(F)c(C(=O)O)c(F)c1)c1ccc(Oc2ccccc2)cc1 1776126587 QBIWJZLFDBPYGO-IZZDOVSWSA-N 380.346 5.351 30 20 GKED CCCOc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(C)c1 1776819134 MQIXXPKHYFBRLR-PKNBQFBNSA-N 390.435 5.638 30 20 GKED O=C(O)c1cc(Br)cc(/C=C2/CCc3ccc(Cl)cc3C2=O)c1 1777663776 SMWAAIKQAIJQFT-XGICHPGQSA-N 391.648 5.013 30 20 GKED C=CC[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cscc3C)cc2)CCC1 1788748111 ZHOHZQGZEHKDCN-HNNXBMFYSA-N 382.529 5.016 30 20 GKED CCc1ccccc1N/C(S)=C(/C(=O)c1ccc(C)c(C)c1)[n+]1ccccc1 7746750 VYXDCWOQXYSNHJ-UHFFFAOYSA-O 389.544 5.204 30 20 GKED C=CCn1c(SCc2ccc(Cl)c3cccnc23)nnc1-c1ccccc1 31645535 BVBRFFDZFWWGDJ-UHFFFAOYSA-N 392.915 5.625 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CSCCC(C)C)cc1 60351444 GNEKWGHOQDOPSX-UHFFFAOYSA-N 384.501 5.077 30 20 GKED CC(C)CCC[C@H](C)n1c(SC[C@@H](C#N)CCC#N)nc2ccccc2c1=O 61733796 JGGIJFFVHADKOV-ZWKOTPCHSA-N 396.560 5.319 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1ccccc1F)C1CC1 66955806 OHZCYTMVCOHELE-HNNXBMFYSA-N 383.492 5.416 30 20 GKED C=CCOc1ccc(CN(C)Cc2csc([C@@H](C)OCC)n2)cc1Cl 93737200 WUWHSZHWJRKGFM-CQSZACIVSA-N 380.941 5.091 30 20 GKED Cc1ccccc1-c1nnc(SCc2cccc(C#N)c2)n1Cc1ccco1 98074211 LIIAAPGGRWVMPM-UHFFFAOYSA-N 386.480 5.059 30 20 GKED CSc1ccsc1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1 107145581 IOWNVOPBPAHINE-UHFFFAOYSA-N 380.494 5.173 30 20 GKED Cc1cc(-c2noc([C@@H](C)Nc3ccccc3SC[C@@H](C)C#N)n2)ccc1F 108408189 VOHNVJJGRWPRLN-DZGCQCFKSA-N 396.491 5.609 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cccc(-c2ccoc2)c1 127842146 MJWFTLTVKHDARJ-OAQYLSRUSA-N 386.451 5.033 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(C#N)c(Cl)c1 154936051 QGAZKZCSBAEPGE-UHFFFAOYSA-N 389.842 5.025 30 20 GKED CC(C)[C@H](Sc1ccccc1C#N)C(=O)Nc1ccccc1C(F)(F)F 173708018 HIKIZMBENXEGES-KRWDZBQOSA-N 378.419 5.332 30 20 GKED C[C@@H](C#N)Oc1ccccc1NCc1ccc(-c2nc3ccccc3s2)o1 181133763 AHDPESIBYSEUGC-AWEZNQCLSA-N 375.453 5.459 30 20 GKED Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc(C2(C#N)CC2)cc1 183110443 SNSYOJFRFKGENT-UHFFFAOYSA-N 389.680 5.218 30 20 GKED Cc1nc(C(F)(F)F)c(CN[C@H](c2c(F)cccc2F)C(F)(F)F)s1 183658225 FBBFASLMFHBZAO-GFCCVEGCSA-N 390.299 5.142 30 20 GKED C=C(C)[C@H](NC(=O)N(C)Cc1nc2ccccc2s1)c1ccc(F)c(F)c1 185476957 QZGHEDVPAWQSCW-IBGZPJMESA-N 387.455 5.033 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1ccc(F)c(CN(C)C)c1 191428492 JONXAZZTAHOUJJ-UHFFFAOYSA-N 383.511 5.061 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1 303369061 RYHZNUJUQTWMQZ-IRXDYDNUSA-N 396.556 5.784 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](C)c2cccc(F)c2)cc1 304088328 WTWNGEUCKVAZBX-HNNXBMFYSA-N 390.414 5.240 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Br)cc1 329987982 GRTMDAAZTAIDJZ-VWDMACCTSA-N 393.325 5.392 30 20 GKED N#Cc1cnc(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)c(Cl)c1 427925688 ONYFDCRGAOPLOW-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1c(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cccc1-c1ncco1 433115794 JHQCPXDALZZLNV-AWEZNQCLSA-N 392.484 5.546 30 20 GKED CC(C)(C#N)CCCCn1cnc2cc(-c3ccc(Cl)cc3)sc2c1=O 436139306 YFVCUFXVALRNRS-UHFFFAOYSA-N 385.920 5.498 30 20 GKED C[C@@H](c1ccc(C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1)C(F)(F)F 455512328 JSJTZQQWMJFCJF-KGLIPLIRSA-N 392.446 5.856 30 20 GKED CCCc1ncc(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2C)s1 460168736 RTLVQYRDWIQAMC-UHFFFAOYSA-N 391.496 5.107 30 20 GKED O=C(c1ccc(C(F)(F)F)cc1)N(Cc1ccc(F)cc1)CC(F)(F)F 460472763 YMNLMIMFFDKIIP-UHFFFAOYSA-N 379.275 5.049 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)Cc2cccc(C(F)F)c2)cc1 468412978 RJUUGOKSXZAUDU-UHFFFAOYSA-N 376.406 5.022 30 20 GKED C[C@H](CCC#N)Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1Cc1ccco1 470450979 GVENEMHEWWMVTH-MRXNPFEDSA-N 394.544 5.668 30 20 GKED Cc1ccc(-c2ncco2)cc1NC(=O)c1ccccc1Oc1ccccc1C#N 480826844 GMCOOSRZEZWRMP-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C=CCn1c(S[C@H](C)Cc2ccc3ccccc3n2)nnc1-c1ccoc1C 481754521 ZOUDKJSAZOXCMQ-OAHLLOKOSA-N 390.512 5.304 30 20 GKED Cc1c([C@H](NC(=O)N(C)Cc2ccc(C#N)cc2)C(C)C)oc2ccccc12 483830058 NOSQJPCIGGNXQE-OAQYLSRUSA-N 375.472 5.152 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1ccccc1Oc1ccccc1C#N 484609308 WORVIUXHMBWKIL-PBHICJAKSA-N 388.389 5.154 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1SCc1csc(-c2ccsc2)n1 488771126 VYQRVLJNVMXMDS-UHFFFAOYSA-N 383.445 5.449 30 20 GKED N#Cc1ccc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(Cl)c1 494642922 LHQJGOBTGDQJFJ-UHFFFAOYSA-N 392.686 5.502 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)NC2(c3cccc(C#N)c3)CC2)cc1 494667388 SQNVSUQAZPAMPF-MRXNPFEDSA-N 379.529 5.108 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(F)c(F)c(F)c1F 498995829 DCSMYEWLGXPWDS-QMMMGPOBSA-N 379.275 5.095 30 20 GKED N#C[C@@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccccc1Cl 499947976 UXPHTDXATPUBIZ-OAQYLSRUSA-N 390.870 5.157 30 20 GKED N#Cc1ccccc1CNc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 500385347 JXLVRVAXJMTAGU-UHFFFAOYSA-N 387.336 5.516 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)OCc1ccccc1 500745066 QZIRBFCDUNJKNW-GOSISDBHSA-N 386.451 5.203 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)Oc1ccc(F)cc1 516230631 NENAJHMTTIQUIU-MRXNPFEDSA-N 390.414 5.204 30 20 GKED CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)c1cccc(CC#N)c1 516372789 XXRSZWHAXSTKMK-UHFFFAOYSA-N 392.499 5.671 30 20 GKED CCCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@H](CC)c1ccccc1 517473255 LXBDQMLIQMCQAH-WIYYLYMNSA-N 395.572 6.334 30 20 GKED COc1cc(Cl)ccc1CNCc1cccc(OCc2ccccc2C#N)c1 517562174 OYLBHZCNDPWVJW-UHFFFAOYSA-N 392.886 5.089 30 20 GKED CN(CCc1ccccc1)C(=O)c1ccccc1SCc1ccc(C#N)cc1 518028663 UNCVYOAVPZQOHZ-UHFFFAOYSA-N 386.520 5.165 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)c1occc1CSc1ccccc1 519876988 QITMVTINUADLGV-UHFFFAOYSA-N 388.492 5.272 30 20 GKED Cc1cccc(N(CCC#N)C(=O)CSc2ncc(C(C)C)n2C(C)C)c1C 523499839 LOMNWPJRXDJTJT-UHFFFAOYSA-N 398.576 5.243 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3ccc(CC#N)cc3)c(C)c2)n1 533960790 GSIUWNARSZWZJN-UHFFFAOYSA-N 379.510 5.230 30 20 GKED CN(Cc1ccccc1)c1ccccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 537425030 MHKVFVJNFDMBCP-UHFFFAOYSA-N 381.479 5.130 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(S[C@@H](C)c3ncc(C)o3)n2)o1 539997401 RPMJWEOREMDBLB-NSHDSACASA-N 393.390 5.690 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1nc(Cc2ccccc2)cs1 544271008 VNCQQUVLOQKIJA-UHFFFAOYSA-N 390.512 5.048 30 20 GKED C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)NCC1CCC(C#N)CC1 567012262 OHGYWPWWXPTVIL-LMDPOFIKSA-N 381.545 5.351 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCN2c3ccccc3C[C@@H]2C1 568697925 DULGRALASJZIEV-OAQYLSRUSA-N 389.543 5.207 30 20 GKED CCSCc1ccccc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 574996435 ZCOPYBFNTZQBIV-UHFFFAOYSA-N 379.510 5.187 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCC2(CCCCC2)O1 577562378 LWNIAWYLEMTLFV-DLBZAZTESA-N 387.549 5.084 30 20 GKED C[C@@H]1Cc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c2[C@@H](C)C1 579445958 MWJTWTJXGICOLO-KBPBESRZSA-N 388.496 5.015 30 20 GKED N#Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccc(-c2cccc3cccnc23)cc1 586814104 OYGNILHFXIPFFX-XMMPIXPASA-N 389.458 5.191 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC2(CCC2)CC1 588238675 NXLZOYZSYFNQTI-UHFFFAOYSA-N 375.472 5.457 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cn(-c4ccccc4)nc3C)n2)cc1 588349096 VCNIKTKIPQTHSS-LJQANCHMSA-N 398.491 5.103 30 20 GKED N#CCCCCCC(=O)N(Cc1ccccc1Br)C1CCCC1 588948657 MLJQSTSQQHDEID-UHFFFAOYSA-N 377.326 5.194 30 20 GKED CC(C)(C)OC(=O)Cc1cccc(NCc2ccc(C#N)cc2C(F)(F)F)c1 589314260 ZKFTVBUOSDOODI-UHFFFAOYSA-N 390.405 5.073 30 20 GKED C=C(C)COc1cccc(NC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)c1 589382264 NWTMQHOPVOHVPD-UHFFFAOYSA-N 398.409 5.146 30 20 GKED CC1(CC(F)F)CN(C(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)C1 592834051 AEHQCYDQTGLRSV-UHFFFAOYSA-N 390.817 5.121 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccsc2C#N)CC1 596865165 LDWWNQWWMOUKIL-UHFFFAOYSA-N 396.560 5.050 30 20 GKED CCN(Cc1ccoc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 608840670 AEPIGNDTHQLIGW-HXUWFJFHSA-N 393.874 5.642 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4sccc4s3)cc2)c1 609064100 VEUYABXCOMSSCO-UHFFFAOYSA-N 390.489 5.666 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209878 RNGNOMCEPIPNMF-UHFFFAOYSA-N 391.496 5.855 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)N[C@H](C#N)c3ccccc3Br)oc12 609589670 DBCNEAHNGLIMBZ-MRXNPFEDSA-N 397.272 5.115 30 20 GKED CN1CCC[C@H](CNCC(C)(C)CCC#N)[C@H]1c1ccc(C(F)(F)F)cc1 610271070 OTXFMOPFUBEUPK-IEBWSBKVSA-N 381.486 5.008 30 20 GKED C[C@@H](NCc1csc(-c2cccc(Br)c2)n1)c1cccc(C#N)c1 610345148 UYTPBEVBISLBEF-CYBMUJFWSA-N 398.329 5.295 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@H](NCc2ccc(C#N)cc2F)CCC3)cc1 610812582 LWMKUYDWNULTBY-LJQANCHMSA-N 377.488 5.297 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCc3ccc(C(C)(C)C#N)cc3)s2)cc1 614184981 FVDHDEBAPXRUFY-KRWDZBQOSA-N 389.568 6.079 30 20 GKED Cc1ccc(CN(Cc2ccco2)C(=O)NCc2ccc(C#N)c(Cl)c2)s1 619769135 IWBIEMDZYJHCKT-UHFFFAOYSA-N 399.903 5.087 30 20 GKED C=CC[C@@H]1CCN(C(=O)Nc2ccc(Oc3ncc(Cl)cn3)c(Cl)c2)C1 626544080 FUFONMLHAXAOMF-GFCCVEGCSA-N 393.274 5.006 30 20 GKED C[C@H](Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1cncc(F)c1 647229854 OIZGWCYHXPFJEN-VIFPVBQESA-N 384.270 5.683 30 20 GKED Clc1ccccc1Nc1nc(Cl)c(C=Nn2cnc3ccccc32)s1 725848734 FNOHLTGDSHUPJQ-UHFFFAOYSA-N 388.283 5.425 30 20 GKED Cc1cc(Br)cc(C)c1NC(=S)Nc1ccc(C#N)c(Cl)c1 726465457 HSQQKAZARDLYMH-UHFFFAOYSA-N 394.725 5.400 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C[C@H](C)c3ccccc3F)n2)cc1 726857870 BAKFLHZUQHWKQQ-YJBOKZPZSA-N 378.472 5.628 30 20 GKED C#Cc1cccc(N(C(=O)c2cc3cc(Br)ccc3o2)C(C)C)c1 728246715 HNZRRCBDAZJFAP-UHFFFAOYSA-N 382.257 5.232 30 20 GKED COc1c(O)cccc1/C=C1/CCc2nc(-c3ccc(Cl)cc3)sc2C1=O 728438248 CTTKTDKRQJMEKI-QBFSEMIESA-N 397.883 5.390 30 20 GKED O=C(/C=C\c1csc(-c2ccc3c(c2)OCO3)n1)c1c[nH]c2cc(F)ccc12 728439758 FHNFFTBJUIPILM-HYXAFXHYSA-N 392.411 5.055 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(C=Nn2c(S)nnc2-c2cc(Cl)ccc2Cl)o1 732763791 HUMJWNJHQKWLOK-SKDRFNHKSA-N 393.299 5.139 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C(C)(C)Cc3ccccc3)n2)cc1 735595456 DTUSADVPLWIGTE-LJQANCHMSA-N 390.508 5.264 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 740822569 MQQNYRUWIPADDU-UHFFFAOYSA-N 393.915 5.089 30 20 GKED O=C(/C=C\c1csc(-c2ccc(F)cc2)n1)c1c(Cl)nc2sccn12 741844536 QISXVTZSYLELQM-WAYWQWQTSA-N 389.864 5.208 30 20 GKED O=C1/C(=C\c2ccc(Oc3cnccn3)cc2)COc2c1ccc(Cl)c2Cl 743058392 YHWPEIAJJIDGNC-LCYFTJDESA-N 399.233 5.234 30 20 GKED Cc1nc2ccccc2nc1CNc1ccc(OCc2cccc(C#N)c2)c(F)c1 749272197 IYUVBGUOVMHUAW-UHFFFAOYSA-N 398.441 5.140 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)c2ccc(Cl)s2)cc1 750686658 ILQOKLVGSOJSFP-ZENOOKHLSA-N 388.920 5.366 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)/C(=C\c1ccc(F)cc1)c1cccs1 760785698 GVFCNRAGNMGIHX-ATVHPVEESA-N 396.418 5.108 30 20 GKED O=C(/C(=C\c1cccc2nccn12)c1nc2ccccc2s1)c1ccccc1 769601059 BIONIEHQQSSHFI-OBGWFSINSA-N 381.460 5.368 30 20 GKED CC[C@@H](Nc1ccc(OCc2cn3ccccc3n2)cc1)c1ccc(C#N)cc1 774356496 YSNYLZVBMCQOFU-HSZRJFAPSA-N 382.467 5.348 30 20 GKED C#CC[C@H](N[C@H](C)c1ccc(OC)c(CN2CCCCC2)c1)c1ccccc1 775414006 CHZGKEGMTPUXNE-YKSBVNFPSA-N 376.544 5.096 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C1CCC(F)(F)CC1 788715966 YHFUICFYWFIAJX-UHFFFAOYSA-N 399.367 5.171 30 20 GKED N#Cc1ccc([C@@H](O)C(=O)Nc2ccc(Cl)cc2-c2ccccc2Cl)cc1 790088777 DYADOFKJINNDEF-HXUWFJFHSA-N 397.261 5.204 30 20 GKED COc1cc(C(=O)/C=C\c2nccn2-c2ccccc2)ccc1SC(F)F 790216785 TUGSWRMFSGVMLZ-NTMALXAHSA-N 386.423 5.092 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)ccc1F 790292156 MMLPYQBOWTUKJC-ZDUSSCGKSA-N 395.286 5.236 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] 791006273 HATVFBWQHWWKCZ-UHFFFAOYSA-N 390.842 5.420 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccn(C3CCCCC3)n2)cc1 791508350 DKGQETUFECKVBZ-JOCHJYFZSA-N 384.483 5.296 30 20 GKED COCC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 793565216 GXFDXWFFCKQUQD-JLTOFOAXSA-N 393.314 5.324 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1ccc(OCC2CCOCC2)cc1 795808691 AOBOWRDODKELPU-DEOSSOPVSA-N 376.500 5.243 30 20 GKED Cc1cc(C(=O)/C=C\c2cccc(NC(=O)c3ccccc3Cl)c2)oc1C 799896198 HCXIVKNTOUUQJJ-KHPPLWFESA-N 379.843 5.698 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N(c1ccccc1)c1nc2ccccc2s1 800401361 PYFRHBRGRLOKJM-CCEZHUSRSA-N 381.460 5.546 30 20 GKED CC(C)(C(=O)OCC1(C#N)CC1)c1csc(-c2c(Cl)cccc2Cl)n1 802992386 KQPODCBBELRTMT-UHFFFAOYSA-N 395.311 5.241 30 20 GKED CC(C)(C(=O)OCC1(C#N)CCC1)c1csc(-c2c(F)cccc2Cl)n1 810679778 ZNIVMSUYZKMNGV-UHFFFAOYSA-N 392.883 5.117 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)[C@@H](Nc1cccc(C#N)n1)CC(C)(C)O2 811863068 OSDBERWVZCOWQI-KRWDZBQOSA-N 394.475 5.015 30 20 GKED N#C[C@H](C(=O)CC1(C#N)CCCCC1)c1nc2cc(C(F)(F)F)ccc2s1 850769341 NWWJJKWHUTZPCM-CYBMUJFWSA-N 391.418 5.356 30 20 GKED N#CC1(CCCC[S@](=O)Cc2csc(CCc3ccccc3)n2)CCC1 899395574 TVBKHCLEEJVTAU-SANMLTNESA-N 386.586 5.041 30 20 GKED Clc1cccc(-c2nc(CON=Cc3ccc(Br)cc3)co2)c1 914572203 HBVAGJWWRVPQGV-UHFFFAOYSA-N 391.652 5.308 30 20 GKED Cc1ccc2nc(-c3ccccc3)cc(C(=O)[C@@H](C#N)c3nc(C)cs3)c2c1 915102029 MIVIZSHFDRSUMS-LJQANCHMSA-N 383.476 5.465 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CSCc3ccc(F)cc3)n2)cc1 915102173 SUAOMXGJKYTVSL-SFHVURJKSA-N 396.512 5.367 30 20 GKED C[C@H](/N=C\c1cc2ccccc2nc1O)c1ccc(OCc2cccnc2)cc1 915271256 QKIGPLYHEPDPEQ-QVMKDISWSA-N 383.451 5.095 30 20 GKED Cc1cc(Br)cc(C(CC(C)C)=NNc2ccc(C(=O)O)cc2)c1 1776014642 XQQPTEGQJNIMMI-UHFFFAOYSA-N 389.293 5.318 30 20 GKED O=C(O)c1ccc2scc(C=NNc3ccccc3Oc3ccccc3)c2c1 1776091097 UBCBJSIUTAKPOA-UHFFFAOYSA-N 388.448 5.838 30 20 GKED CSc1ccc(C(=O)/C=C\c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776113281 DWJLNCJWRHRHKM-AUWJEWJLSA-N 388.488 5.599 30 20 GKED C=CCOc1c(Cl)cc(/C=C(\CC(=O)O)c2nc3ccccc3o2)cc1OC 1776183086 HRDANRIEZFIGJA-NTEUORMPSA-N 399.830 5.070 30 20 GKED C[C@@H](Oc1cccc(C(=O)/C=C\c2ccc(-c3ccccc3F)s2)c1)C(=O)O 1776470885 JMDWITROQAPGNY-RBJHHQRMSA-N 396.439 5.302 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(Cl)c(C(F)(F)F)c1 1776784283 NULFWUXVGOWNAU-AWEZNQCLSA-N 379.850 5.652 30 20 GKED COCc1ccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)cc1 1777232518 TXDOYEQVJKPNHP-BENRWUELSA-N 378.449 5.156 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1 14497773 UEEOBQFTHOTTCE-UHFFFAOYSA-N 391.496 5.131 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 41557217 SEKKAXSFRKRQNM-GDBMZVCRSA-N 397.425 5.200 30 20 GKED CN(Cc1ccncc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 47565607 MJSCAEQPQSAGCG-FQEVSTJZSA-N 390.874 5.054 30 20 GKED C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc(OCCCC#N)c1 55570329 JSBFSQOCJMFFCG-CYBMUJFWSA-N 393.270 5.082 30 20 GKED CC[C@H](C)Oc1ccc(NC(=O)c2ccc(COc3ccccc3C#N)o2)cc1 65710217 NYOKVOLLQZCUMG-INIZCTEOSA-N 390.439 5.160 30 20 GKED CC(C)(C)SCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 108242056 QYYXAUBLOLABMH-UHFFFAOYSA-N 376.469 5.181 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1 111766102 FXYVAHOBCWIPBZ-DOTOQJQBSA-N 399.947 5.613 30 20 GKED COc1ccc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1Cl 125425855 CHJRRVLJQYXWMI-CYBMUJFWSA-N 389.908 5.065 30 20 GKED C=CCCC(=O)CSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 134787672 OZCUFIZUJLVLMK-KRWDZBQOSA-N 377.513 5.182 30 20 GKED O=C(Nc1cccc(/C=C2/Cc3c(O)cccc3C2=O)c1)c1ccc(Cl)cc1 138481535 HDKASTVYMOWRCS-WJDWOHSUSA-N 389.838 5.120 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc(CCC(F)(F)F)cc1 152075325 JEFBGLFRSOMDKU-QGZVFWFLSA-N 398.384 5.177 30 20 GKED CC(C)Cc1ccc([C@H](C)C(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)cc1 156246057 VNUWPJUYYBTALO-JXFKEZNVSA-N 389.524 5.384 30 20 GKED CCc1ccc(C(=O)/C=C/c2csc(N(C(C)=O)c3ccc(F)cc3)n2)o1 176679803 QKVKJSHNFWVMHS-UXBLZVDNSA-N 384.432 5.018 30 20 GKED CCCCN(CCCO)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 181718290 QRUACSMSRDICNG-FQEVSTJZSA-N 399.922 5.012 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)cc1 207491730 RYKXDBRVYAEMNH-SEYXRHQNSA-N 391.496 5.236 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)N1CCC(Oc2ccc(C#N)cc2)CC1 264071724 BFQITZYPJHBFBU-UHFFFAOYSA-N 377.488 5.065 30 20 GKED Cc1ccc(C(F)(F)F)cc1N=C(O)c1sc([C@H]2CCCOC2)nc1C 328880024 LQTDPAFVYZQJFA-LBPRGKRZSA-N 384.423 5.309 30 20 GKED CC(C)n1cnnc1SC/C(O)=N/[C@@H]1C[C@@H]2CCC(C)(C)c3cccc1c32 329237333 OZBJDQNGZWTECX-WMLDXEAASA-N 384.549 5.208 30 20 GKED OC(=Nc1ccccc1)c1cc(N=C(O)N2CC[C@H]3CCC[C@@H]32)ccc1Cl 330231075 DUXVALVDEXMTTI-KUHUBIRLSA-N 383.879 5.396 30 20 GKED CC(C)N(CC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)c1ccccc1 428849159 HQUGZLDTZNUFAG-RTBURBONSA-N 395.572 5.491 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1[C@@H](C)[C@H]1c1ccccc1 430392854 KIEGSKZSYUNHFV-WQTXXOFMSA-N 383.451 5.042 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H](c1ccccc1)C1CC1 433135115 MTOUKDZCDMPNAB-APWZRJJASA-N 379.529 5.254 30 20 GKED CCc1ccccc1N(C(C)=O)c1nc(COc2ccc(C#N)c(C)c2)cs1 434648414 LFOMDKROJHNMBV-UHFFFAOYSA-N 391.496 5.149 30 20 GKED CS[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)C1 438660750 NPPKVTVXFNZROK-NVXWUHKLSA-N 399.491 5.285 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2Cl)c2ccc(F)cc2)cc1 439444923 BYBFEMKNIJOWED-QFIPXVFZSA-N 380.850 5.239 30 20 GKED Cc1ccc(OCc2ccccc2)c(NCc2nnc(-c3ccc(C#N)cc3)o2)c1 442097724 OLXUYBIWGSYQQZ-UHFFFAOYSA-N 396.450 5.108 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Cc1ccc(F)c(F)c1 445921345 GWNPSUACQPEKCK-UHFFFAOYSA-N 378.378 5.118 30 20 GKED CC(C)CCn1ncc(NC(=O)Nc2ccc(CC#N)cc2Cl)c1C(C)C 455734699 PKUREPBXXVVBBX-UHFFFAOYSA-N 387.915 5.416 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)C1(C#N)CCC1 460227097 BCUZNPGWOKKSII-UHFFFAOYSA-N 390.462 5.364 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)c1c(F)cc(C(F)(F)F)cc1F 464099321 FNIAIQKDOFRQIV-UHFFFAOYSA-N 383.238 5.563 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@@H](C)c1ccc(F)cc1F 466429146 VQBABJWLFMYUJN-GFCCVEGCSA-N 384.879 5.181 30 20 GKED N#CC(CCN1CCO[C@H](c2ccsc2)C1)(c1ccccc1)c1ccccc1 472572724 YIJFKTNGFVHWFU-QHCPKHFHSA-N 388.536 5.021 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccc(OCc3ccccc3)cc2)n1 474420450 FLUWZUAZANOBOO-LJQANCHMSA-N 376.481 5.336 30 20 GKED CC[C@@H](CC#N)NC(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 475012495 IIMXPCDQLXFIGH-INIZCTEOSA-N 391.393 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Nc1cc(-c2ncco2)ccc1C 475570744 UERMHJQRYQLHMG-UHFFFAOYSA-N 375.472 6.146 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccco1)c1ccc(Cl)cc1)c1ccccc1 475932806 YPYULSVDRUTXNG-GOSISDBHSA-N 378.859 5.554 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(c2ccc(Cl)cc2)CC1)c1ccccc1 477224333 QTVCNJIFFWHXMK-OAQYLSRUSA-N 381.907 5.274 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2nc(-c3c(F)cccc3F)cs2)cc1 479712900 FIXXBFAIMLAUQD-UHFFFAOYSA-N 383.423 5.142 30 20 GKED COc1ccccc1[C@@H](C)CC(=O)Nc1sc(-c2ccccc2)cc1C#N 483007819 AIDDLIMFUCONPO-HNNXBMFYSA-N 376.481 5.428 30 20 GKED N#CCCC[C@H](NC(=O)c1ccc(COc2ccc(F)cc2)o1)c1ccccc1 487564170 IRQOUONLBSBACL-NRFANRHFSA-N 392.430 5.163 30 20 GKED Cc1ccc2snc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)c2c1 496197637 OSUJSERIRIEWRO-OAHLLOKOSA-N 375.478 5.218 30 20 GKED CSc1ccc(C)c(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 500753921 LYURWCVNSPYDCA-UHFFFAOYSA-N 388.492 5.942 30 20 GKED N#Cc1ccc(NC(=O)Nc2cccc(COCc3ccco3)c2)cc1Cl 502703576 LBHOQQFVMOHXMW-UHFFFAOYSA-N 381.819 5.165 30 20 GKED Cc1ccccc1CCC(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 504912105 QHUWNXDWHXCNIT-UHFFFAOYSA-N 384.479 5.325 30 20 GKED CC(C)(C)c1ccc([C@@H](C#N)NC(=O)c2cnn(-c3ccccc3)c2C2CC2)cc1 505831423 HRTMXZXTQMWALP-JOCHJYFZSA-N 398.510 5.042 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccccc2C(F)(F)F)C(F)(F)F)c1F 505846784 UHMGQNGMEUDHAY-HNNXBMFYSA-N 376.275 5.109 30 20 GKED CCN(C[C@H](C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CC2 509725224 SFHXVKCYSIFGCL-KETZHDHUSA-N 395.506 5.343 30 20 GKED Cc1ccc(CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)s1 512277373 NMVWFVAXFRQXJU-UHFFFAOYSA-N 378.472 5.152 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1c(F)cc(F)cc1F 517447262 FDDRYDXPXCBJQS-LLVKDONJSA-N 396.459 5.229 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCc1ccc(-c2ccccc2)o1 518239753 LTXQCTREXQAEKF-QGZVFWFLSA-N 390.508 5.912 30 20 GKED C[C@@H](S[C@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccccc1C#N 519948471 CEYFIVLXNVYUJX-CHWSQXEVSA-N 394.418 5.278 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccccc2S[C@H](C)CC#N)C2CC2)cc1 520938091 PQORCLKRKOTENY-IERDGZPVSA-N 379.529 5.662 30 20 GKED CC[C@@H]1CCCN(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)CC1 522702151 FCOBKCVWIGNBDM-LJQANCHMSA-N 391.515 5.376 30 20 GKED COCc1nc2cc(NCc3cccc(OCc4cccc(C#N)c4)c3)ccc2o1 531429848 SOSSKCMDXVDVPP-UHFFFAOYSA-N 399.450 5.037 30 20 GKED CC[C@@H](C)C(=O)Nc1cccc(CNC2CCC(C#N)(c3ccccc3)CC2)c1 539093155 GYOZHIYPAZIWFR-FMGIXGHUSA-N 389.543 5.165 30 20 GKED COc1cc([C@@H](C)NCc2ccc(CC#N)cc2)ccc1OCc1ccccc1 542254475 UJSXYZMCTHXDOH-LJQANCHMSA-N 386.495 5.191 30 20 GKED C[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc(-c2cccc(C#N)c2)cc1 543877259 TWGQIIDKICSHNH-IBGZPJMESA-N 382.511 5.071 30 20 GKED CN(CC#Cc1ccc(C(F)(F)F)cc1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1 544527616 ABLGAHUMIXBYBZ-RTWAWAEBSA-N 391.408 5.048 30 20 GKED N#Cc1ccc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1Cl 548607372 GGDWAEPCEOMCJJ-SFHVURJKSA-N 384.913 5.123 30 20 GKED N#Cc1ccnc(SCCCCSc2nccc(C#N)c2Cl)c1Cl 561324068 BOBGOGJZEIPLFC-UHFFFAOYSA-N 395.340 5.191 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cc2)ccn1 565395432 UTNGNZWZQISKRQ-UHFFFAOYSA-N 388.814 5.133 30 20 GKED N#Cc1ccc(CNC2(c3cccc(Br)c3)CC2)c(C(F)(F)F)c1 572895365 UVMOAOGCWJSCDK-UHFFFAOYSA-N 395.222 5.118 30 20 GKED N#Cc1ccc2c(c1)N(C(=O)c1ccc(COc3ccc4ccccc4c3)o1)CC2 577082173 SIXDBDVJDXNRHC-UHFFFAOYSA-N 394.430 5.086 30 20 GKED C[C@H](NC[C@@H](C#N)CCC#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 578313869 PTTIAJYGDAYECS-UONOGXRCSA-N 377.435 5.528 30 20 GKED CCc1ccc([C@H](C#N)N(C)C(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)cc1 578413731 JXANJYWMOGNGCS-NRFANRHFSA-N 386.451 5.048 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)CCCCC2=O)c1nc2cc(Cl)ccc2s1 583255912 INVHWLMQECWIMP-INIZCTEOSA-N 394.883 5.349 30 20 GKED CC[C@@H](C)c1nc(C)c(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1 593976461 WRTBTJGUPZKOJU-CABCVRRESA-N 396.560 5.182 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)NCc2oc(C(C)C)nc2C)cc1 597684464 JINDQWHXPIOKPC-UHFFFAOYSA-N 389.455 5.009 30 20 GKED N#Cc1c(NC(=O)c2cc3c(s2)-c2ccccc2OC3)sc2c1CCCC2 600840979 DMLAJBOUFYDKHI-UHFFFAOYSA-N 392.505 5.372 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 604907414 KHAIJLWTZYEBIE-LLVKDONJSA-N 383.345 5.118 30 20 GKED Cc1ccccc1OCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378292 ANIPMNHIPDMYRH-UHFFFAOYSA-N 394.418 5.037 30 20 GKED C[C@@H](CC(C)(C)c1ccccc1)NC(=O)Nc1ccccc1SC[C@H](C)C#N 609398021 BMZANMDBPKZWMH-MSOLQXFVSA-N 395.572 5.816 30 20 GKED CC(C)Oc1cccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1 609436368 JUHJJNJUASEGCV-SJORKVTESA-N 397.544 5.751 30 20 GKED C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 609553071 UZGGPJYOFLWIFD-AWEZNQCLSA-N 389.421 5.259 30 20 GKED CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(C#N)nc1 609642497 ZWCHLRQYGPAOIA-JOCHJYFZSA-N 391.421 5.025 30 20 GKED CC(C)(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1cccc(Cl)c1 609907197 UTZYXWULLVWPMJ-UHFFFAOYSA-N 391.858 5.315 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3nc(-c4ccc[nH]4)cs3)c2)cc1 609988530 DYSOXYURBJWNKH-UHFFFAOYSA-N 385.452 5.006 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)CCc2ccc(C#N)cc2)cc1 610189113 LZYXAELFHZFROU-SFHVURJKSA-N 384.479 5.044 30 20 GKED CC(C)=CCOc1cccc(C(=O)Nc2ccccc2S[C@H](C)CC#N)c1 610228177 QKNPSBIYTLHPHU-QGZVFWFLSA-N 380.513 5.678 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2ccccc2Oc2cccnc2)cc1 611252021 PFSLSWVEKXMLIU-NRFANRHFSA-N 385.467 5.166 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C(C)(C)C#N)cc2)ccc1OC1CCCC1 614179173 HCZXUXFPCSVCGJ-GOSISDBHSA-N 392.543 5.669 30 20 GKED COc1cc(CN[C@H](C)c2ccsc2)ccc1OCc1cccc(C#N)c1 619782620 GOTWMTHOFLFCKJ-MRXNPFEDSA-N 378.497 5.058 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4cccc(F)c4o3)n2)cc1 682126991 DCKLWROKOGCHOQ-HNNXBMFYSA-N 376.412 5.494 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(Br)s2)c1 726740227 YNVWNXGETUGOER-VOTSOKGWSA-N 376.275 5.089 30 20 GKED N#C[C@H](C(=O)c1ccc(SC(F)(F)F)cc1)c1nc2cc(F)ccc2s1 730420873 HYRCAUMDWARRPY-GFCCVEGCSA-N 396.390 5.537 30 20 GKED C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@H](C#N)c1nc2ccccc2s1 730685031 GCEYJJULWMNCDR-FZMZJTMJSA-N 389.307 5.658 30 20 GKED N#Cc1cccc(OCCCCC(=O)OCc2cc(Cl)cc3cccnc23)c1 732397897 XIPJJQUHZHGZDX-UHFFFAOYSA-N 394.858 5.052 30 20 GKED C=CC[C@@H](NC(=O)c1cccc(OCc2cccc(Cl)c2)c1)c1ccncc1 734460306 OKYCVIDLPBRIAC-JOCHJYFZSA-N 392.886 5.361 30 20 GKED COc1cc2c(cc1NC(=O)N(CCC#N)Cc1ccco1)oc1ccccc12 734512988 BTPXBOAEDKHAEQ-UHFFFAOYSA-N 389.411 5.135 30 20 GKED Cc1ccccc1[C@H](C)CC(=O)[C@@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1 734966006 SOLKGKPISFGCHE-FZKQIMNGSA-N 389.282 5.143 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2ccc(-c3ccccc3OC)cc2)cc1 742375517 DBUAOWCXONZLBN-FQEVSTJZSA-N 385.507 5.615 30 20 GKED C[C@@H](ON=Cc1cccc(Cl)c1Cl)c1nc(Cc2ccccc2)no1 744442818 FSJNWAQMEBADSM-GFCCVEGCSA-N 376.243 5.079 30 20 GKED c1ccc(-c2cc3c(NN=C4CCC5(CCOCC5)CC4)ncnc3s2)cc1 751522502 PZONUOMARRGUCR-UHFFFAOYSA-N 392.528 5.497 30 20 GKED C[C@@H](Cc1ccccc1Cl)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 754531807 MMLYWFVCPOPFGJ-WMLDXEAASA-N 380.900 5.519 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc2ccccc2c1)C(=O)Nc1ccccc1Cl 776076287 DYLASSIQODWTGJ-IBGZPJMESA-N 390.870 5.163 30 20 GKED C[C@@H](NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1ccc(OCC#N)cc1 776159557 JKZRASQNIAJHTH-GOSISDBHSA-N 384.479 5.042 30 20 GKED CC(C)Oc1ccc(NCc2cn(C)nc2-c2ccc(C#N)cc2)c(Cl)c1 780308415 JYAZGVPWISKYCZ-UHFFFAOYSA-N 380.879 5.011 30 20 GKED C=CC[C@@H](C(=O)O[C@@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccccc1 784832176 JVUSXJAWTUUGOG-KBXCAEBGSA-N 382.847 5.354 30 20 GKED Fc1ccc(F)c([C@H](NCc2ccc(Cl)nc2C(F)(F)F)C(F)F)c1 789339978 LFFGXDUNDWERCR-LBPRGKRZSA-N 386.698 5.128 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nccc2ccccc12)c1ccc(Br)cc1 792092881 FFJWRJUWZJSLDX-GOSISDBHSA-N 393.284 5.151 30 20 GKED CN(C)C(=O)c1ccc(C(=O)/C=C\c2ccc(-c3ccccc3Cl)o2)cc1 792925006 QVSVZDJKRNNZJT-QBFSEMIESA-N 379.843 5.198 30 20 GKED Cc1cccc(NC(=O)c2ccccc2NC(=O)C[C@@H](CC#N)c2ccccc2)c1 793011080 FXVXOILMONMASA-HXUWFJFHSA-N 397.478 5.273 30 20 GKED CC[C@H](C)[C@@H](OC)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 796644686 XXRYCFDFOCHVQD-MNRXQERYSA-N 397.327 5.354 30 20 GKED Cc1ccc(C(=O)N(C)[C@H](C)c2sc(-c3ccccc3)nc2C)cc1C#N 799350904 XLHNMXKVJFHHDZ-MRXNPFEDSA-N 375.497 5.132 30 20 GKED Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCc1cccc(C#N)c1 800371398 WTPDHKYEPLYATK-UHFFFAOYSA-N 392.458 5.368 30 20 GKED C[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)c1ccc(N2CCCCC2=O)cc1 810262669 VJMZKRHBMFBJRJ-UUOWRZLLSA-N 387.527 5.193 30 20 GKED N#Cc1ccc(/C=C/C(=O)c2cccc(-c3ccncc3)c2)c(C(F)(F)F)c1 811691641 PEWNSFTXRLWCNC-VOTSOKGWSA-N 378.353 5.535 30 20 GKED CC[C@H](CC(F)(F)F)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 835073094 KDWCEFOQMUSRHD-SCZZXKLOSA-N 394.340 5.470 30 20 GKED COc1cc([C@H](C)N[C@@H]2CCCc3cc(C#N)ccc32)ccc1SC(F)F 841762955 SOZNCTCPNUYFQE-SCLBCKFNSA-N 388.483 5.610 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(C2CC2)cs1)c1cccc(C(F)(F)F)c1 842940361 BZEMGFSIIYPRRO-QARUFBMTSA-N 376.403 5.319 30 20 GKED N#Cc1cccc2c1CN(C(=O)Nc1ccc(N3CCCCCCC3)c(F)c1)C2 844616050 DSMVHNMBMPUBMV-UHFFFAOYSA-N 392.478 5.016 30 20 GKED CCCCCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1c1nnc([C@H]2CCCO2)o1 854460129 DDCWMXYAUULYRO-GUDVDZBRSA-N 391.556 5.361 30 20 GKED Cc1cc(NC(=O)[C@@H](C#N)CCc2ccccc2)ccc1NC(=O)OC(C)(C)C 856371786 AIHCCLWNQXTTTP-GOSISDBHSA-N 393.487 5.053 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccccc3F)s2)ccc1OCC#N 914773542 NAAFXNHVRHYPMM-VURMDHGXSA-N 393.439 5.361 30 20 GKED CCCCOc1ccc(C(C)=NNc2ccc(C(F)(F)F)cn2)cc1OC 915936752 DFVPCQJSXCMHCE-UHFFFAOYSA-N 381.398 5.124 30 20 GKED C=C[C@@H](CCC(=O)O)NCc1cc(Cl)ccc1Oc1ccc(Cl)cc1 1776148353 BBKLBPFZNROPDJ-INIZCTEOSA-N 380.271 5.295 30 20 GKED CC(C)[C@H]1/C(=C\c2ccc(-c3ccccc3C(=O)O)cc2)C(=O)c2ccccc21 1776308879 ULUMZPWSDJJEMH-CRYHJCRISA-N 382.459 6.071 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)cc1 1776339852 HMUJPVRIEXMQDT-LFIBNONCSA-N 384.475 6.146 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1cc(C(=O)O)c(Cl)s1)CCO2 1776374703 UMRQFPKXLQNEID-GHXNOFRVSA-N 376.861 5.272 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1cc2c(s1)CCCC2 1777569426 RFZJWCNTTOTUDF-TWGQIWQCSA-N 394.448 5.187 30 20 GKED C=CCn1c(S[C@@H](C)c2nnc(-c3cccs3)o2)nnc1-c1ccccc1 6845514 GMUWRARYDFXMJM-ZDUSSCGKSA-N 395.513 5.096 30 20 GKED C[C@@H](Sc1nc2ccccc2n1-c1ccccc1)C(=O)Nc1ccccc1C#N 9966641 XWUINIPALPQZNM-MRXNPFEDSA-N 398.491 5.016 30 20 GKED Cc1sc(NC(=O)c2ccccc2OCc2ccc(F)cc2)c(C#N)c1C 14596021 NABGMZFMOCJABZ-UHFFFAOYSA-N 380.444 5.207 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2cc(C)ccc2C)nnc1-c1ccoc1C 21181603 GRNMOLIBQFEICK-INIZCTEOSA-N 381.501 5.013 30 20 GKED N#C[C@H](C(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccc2ccccc2n1 47375772 HSTJKSVGPISMOA-SFHVURJKSA-N 397.459 5.039 30 20 GKED Cc1nc(-c2c[nH]c(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2)cs1 66856328 ZANIDMJDJOPNBC-GFCCVEGCSA-N 382.514 5.093 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)no1 66953441 ANBZJUCZGISYEL-NRFANRHFSA-N 388.427 5.016 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66953960 GDLCJBDTDHPTQG-HZPDHXFCSA-N 383.517 5.314 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](c2ccccc2)CC1 66954926 ZHZXXWFCMJSJSV-QUCCMNQESA-N 393.556 5.882 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2ccc(-c3ccccc3)nc2C)cc1 111020597 GPKVYJSJYWNHGZ-UHFFFAOYSA-N 385.467 5.016 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)[C@H](C)c2cc3ccccc3o2)c1 113980288 QNGGXTKHMTYTKD-VQIMIIECSA-N 391.471 5.016 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F)c1nc2cc(Cl)ccc2s1 116593400 VGYAUVNNHQCQSC-SDDRHHMPSA-N 388.826 5.208 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccccc1SCC(F)(F)F)c1ccccc1 160051143 ZOFVBHQSVKJTDK-HNNXBMFYSA-N 393.434 5.508 30 20 GKED C[C@H](C(=O)Nc1ccccc1SCCC#N)c1ccc(Br)cc1 163289231 GYGINZMMNURTDD-ZDUSSCGKSA-N 389.318 5.197 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@H]1CCCN1C(=O)OC(C)(C)C 188073463 GIFURLFIZWNISO-GOSISDBHSA-N 386.536 5.267 30 20 GKED CCN(Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1SC[C@@H](C)C#N 189962364 SBBAOVQOCFNXBX-INIZCTEOSA-N 392.528 5.474 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)Nc1ccccc1SCCC#N 194317666 JKEKMCMYRWJGMS-INIZCTEOSA-N 376.481 5.252 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1SCc1ccc(Cl)nc1Cl 195500751 JVHTYLRIRYOZDT-UHFFFAOYSA-N 391.327 5.049 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1cc(C2CC2)nc2onc(C(C)C)c12 303061724 MAQUCLWDAHZLKO-UHFFFAOYSA-N 389.499 5.095 30 20 GKED OC1=N[C@@H](/C(O)=N/[C@@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)CCC1 328770612 CNOPOCRQWGTLAQ-USXIJHARSA-N 382.426 5.587 30 20 GKED Cc1nc(-c2ccccc2)sc1N=C(O)N1CCC(c2nccs2)CC1 329408016 CPCUZXZMVMRFBP-UHFFFAOYSA-N 384.530 5.000 30 20 GKED Cc1csc(C2(/N=C(/O)Nc3ccc(N4CCCC[C@@H]4C)cc3C)CCC2)n1 329867726 WLMUPBQCDZPQOJ-KRWDZBQOSA-N 398.576 5.544 30 20 GKED Cc1c(Br)ccc(N=C(O)C2CCC(/N=C(/O)C3CC3)CC2)c1F 330076761 HDMCTHJBKOKQBU-UHFFFAOYSA-N 397.288 5.410 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCCC[C@@H]1c1noc(C)n1 373697156 OTFNNVXFOVRJPI-LJQANCHMSA-N 382.508 5.379 30 20 GKED C=CCCc1ccccc1NC(=O)CCCc1nc(-c2ccc(Cl)cc2)no1 410345855 RXRDQNUWLSBQKZ-UHFFFAOYSA-N 395.890 5.470 30 20 GKED N#CCC1(CNC(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)CC1 431161896 GMJWZNTZRJAIKS-UHFFFAOYSA-N 394.471 5.288 30 20 GKED N#CCCn1cc(/C=C\c2ccc3ccc(Cl)cc3n2)c(-c2ccncc2)n1 432709227 RMTOQMFHZPFQBO-DAXSKMNVSA-N 385.858 5.231 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(OC3CCCC3)c(F)c2)c1 437794145 ABBOYTFTHDRHRS-UHFFFAOYSA-N 397.450 5.474 30 20 GKED O=C(Nc1ccc(CC(F)(F)F)cc1)N[C@@H](c1ccc(F)cc1)C(F)(F)F 438257366 QVCFJXKUWCIUAF-AWEZNQCLSA-N 394.290 5.356 30 20 GKED Cn1cccc1[C@@H]1CCCCCN1C(=O)c1cn(CCCC#N)c2ccccc12 443902258 AOCOIIKAKONYNJ-QHCPKHFHSA-N 388.515 5.041 30 20 GKED N#Cc1cccc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1F 444736859 POQMIBAENFALDD-HNNXBMFYSA-N 390.302 5.499 30 20 GKED C[C@H](Cc1ccccc1)N1CCC(N[C@@H](CCCC#N)c2ccccc2)CC1 449342197 ZTDJMVLDIHBTBR-BWKNWUBXSA-N 375.560 5.107 30 20 GKED C=CCNC(=O)c1ccc(NC(=O)N2CCCC[C@H]2c2ccc(Cl)cc2)cc1 454536101 ZTIKFLIEKUOGGC-FQEVSTJZSA-N 397.906 5.015 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1 455512331 JSJTZQQWMJFCJF-UONOGXRCSA-N 392.446 5.856 30 20 GKED O=C([C@H]1CCC[C@@H](C(F)(F)F)C1)N(Cc1ccc(F)cc1)CC(F)(F)F 460453969 YOEWXXIBJQGVNI-QWHCGFSZSA-N 385.323 5.085 30 20 GKED C=CCOCCCC(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 463657286 XFHDRBPSTPYXOA-UHFFFAOYSA-N 379.378 5.419 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3SCCc4sccc43)cc2)c1 463742035 SENQMFVLIAKNJY-FQEVSTJZSA-N 392.505 5.381 30 20 GKED C=CCCCN(C)C(=O)N[C@H](c1cccc(SC)c1)c1ccc(F)c(F)c1 466250143 OHVUYNSGBNNOCB-HXUWFJFHSA-N 390.499 5.384 30 20 GKED COc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2ccccc2Cl)cc1 470460407 YSNPNEPHOVOWEZ-AWEZNQCLSA-N 398.919 5.381 30 20 GKED C=C(C)CN(Cc1ccccc1)Cc1nnc(-c2ccccc2Br)o1 470917173 DXRMZCYQULQRED-UHFFFAOYSA-N 398.304 5.077 30 20 GKED CCO[C@H](CCNC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CCCC1 473637116 AOLFGULJFFHLNA-VQIMIIECSA-N 389.565 5.188 30 20 GKED CC(C)(C#N)c1ccc(C(=O)NCc2cccc(COCc3ccccc3)c2)cc1 474893912 PBXNZLTZGCDOBJ-UHFFFAOYSA-N 398.506 5.135 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1)c1ccc(F)c(F)c1 481606082 QFBWDYXEQAOMGS-XIKOKIGWSA-N 389.833 5.636 30 20 GKED CN(Cc1nc2ccccc2s1)C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 484995627 UZCBBGNOYWJOSK-UHFFFAOYSA-N 399.475 5.232 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cnn(-c2ccccc2)c1C(C)C 486898360 VKMJUFJEKJGPES-UHFFFAOYSA-N 392.478 5.355 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc2c(OC(F)F)cccc2[nH]1 497486627 RRRPZOYQJIATPW-UHFFFAOYSA-N 396.846 5.313 30 20 GKED C[C@H](Cc1cncc2ccccc12)C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 502071617 PLYLSCWXWDGQLY-OAHLLOKOSA-N 398.491 5.047 30 20 GKED CCCc1c(N[C@H](C)c2cnn(C3CCCC3)c2)cnn1-c1cccc(C#N)c1 502439315 WEMOPTFGIRLDBH-QGZVFWFLSA-N 388.519 5.181 30 20 GKED N#C[C@@H](NC(=O)c1ccc(Oc2cccnc2)cc1)c1c(Cl)cccc1Cl 505507029 PLYQJXIDMJMYCH-GOSISDBHSA-N 398.249 5.175 30 20 GKED CC(C)c1[nH]ccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 506479325 FPMVROCPYJYANA-IBGZPJMESA-N 377.875 5.699 30 20 GKED C[C@H]1CCCCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 512729466 JRDFLDMGHUYYLE-SFHVURJKSA-N 377.488 5.128 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)CSCc1ccc(C#N)cc1 514420542 FHDHULAXACTTFP-AWEZNQCLSA-N 392.446 5.030 30 20 GKED C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccc2oc3ccccc3c2c1 515157932 QHPQTVUKDMWNEY-UHFFFAOYSA-N 390.439 5.282 30 20 GKED N#Cc1cc(Br)ccc1CNc1ccccc1CCC(F)(F)F 521681613 ZMZCASOVAOEDGP-UHFFFAOYSA-N 383.211 5.428 30 20 GKED CC(C)CCN(CCC#N)C(=O)c1ccc2c(c1)nc(C(F)(F)F)n2C(C)C 522389934 PCQFPTGTGOEIOZ-UHFFFAOYSA-N 394.441 5.038 30 20 GKED Cc1csc(-c2cccc(NC(=O)[C@H](Oc3ccccc3C#N)C(C)C)c2)n1 522548380 SWJCARJPBIKJCH-HXUWFJFHSA-N 391.496 5.032 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SC[C@@H](C)c1ccccc1 522573343 OPTYIIMFIJXAFS-MRXNPFEDSA-N 383.492 5.078 30 20 GKED Cc1ccccc1CN(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 524441701 XUBPMDRHYYSECK-UHFFFAOYSA-N 399.494 5.418 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cncc2ccccc12 534742625 YFVWFPWOOJPCDV-UHFFFAOYSA-N 381.460 5.510 30 20 GKED Cc1cccc(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)c1Br 536054618 ZWRMBAHCFFSLRZ-CYBMUJFWSA-N 398.087 5.059 30 20 GKED Cc1ccc(C(=O)Nc2cc(C(C)(C)C)sc2C#N)c(Br)c1 538073758 LDSSAUXOUBSINT-UHFFFAOYSA-N 377.307 5.241 30 20 GKED COc1cc(C#N)ccc1CN[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 539421512 NGKLAJKMBQVZPQ-IBGZPJMESA-N 394.824 5.480 30 20 GKED CC[C@H](CC(F)(F)F)NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 546190481 VXWLWZIWMUCLNV-IFXJQAMLSA-N 389.421 5.316 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)[C@@H](C)n1cnc2ccccc21 552156817 ZDZZMWNONSDUFG-QGZVFWFLSA-N 396.450 5.208 30 20 GKED C=CC[C@@H](C)NC(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 558140056 SRBTWJGJKXGXJH-CYBMUJFWSA-N 376.403 5.050 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@H]1c1cccs1 562174235 IWRGNPKWWFYJMW-RDTXWAMCSA-N 385.558 5.757 30 20 GKED C=C(C)CCc1noc(-c2cc3ccccc3cc2OCc2c(C)noc2C)n1 567428007 NAVSFULJRXHFOL-UHFFFAOYSA-N 389.455 5.582 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)Nc1ccc(C#N)c(Cl)c1 569340075 VXFMJDFOCSYMIL-UHFFFAOYSA-N 389.814 5.174 30 20 GKED C[C@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(-n2cncn2)cc1Cl 570230274 OCPSFFNTLCDFDK-HRAATJIYSA-N 379.895 5.006 30 20 GKED CN(CCOCc1ccc(C#N)cc1)C(=O)Nc1ccc2oc3ccccc3c2c1 573471786 LFFDLTXAYDVXDL-UHFFFAOYSA-N 399.450 5.138 30 20 GKED N#CC[C@@H](Cc1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1)c1ccccc1 576146755 HDUHQWHPFRJXMN-MAUKXSAKSA-N 389.352 5.387 30 20 GKED Cc1ccccc1CN(C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)C1CC1 581161512 BOALXFWXWPOFQO-UHFFFAOYSA-N 398.466 5.251 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F 588411210 CUXUIZXQLWFQQC-XBUHWIKASA-N 394.780 5.215 30 20 GKED CCOc1ccc(C[C@@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 591059645 KTOPYMCTPWJOCL-IAGOWNOFSA-N 382.529 5.297 30 20 GKED Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)CCCCC#N)sc2c1 593943052 JQOJAFYCPNVSGB-UHFFFAOYSA-N 377.513 5.530 30 20 GKED CC[C@@H](C)c1cccc(NC(=O)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 600002777 WVNUNJQQOVZLRP-JKSUJKDBSA-N 395.528 5.029 30 20 GKED N#Cc1c(F)cccc1CNc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 600856548 AHDBYPUDDUHFSH-UHFFFAOYSA-N 394.265 5.599 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)C1=Cc2ccccc2OC1 603532441 HRAMLMZFGXNOKM-UHFFFAOYSA-N 398.437 5.015 30 20 GKED C=CCc1cc(CN[C@H](Cc2ccccc2)c2sccc2C)cc(OC)c1O 605827536 XNPBQDBLGKIHRP-OAQYLSRUSA-N 393.552 5.573 30 20 GKED CN(Cc1ccccc1F)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209968 YOCGIMLTBURDCA-UHFFFAOYSA-N 375.403 5.154 30 20 GKED N#Cc1ccccc1/C=C/c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 609475474 LDEZSKAVYFMQAQ-LFYBBSHMSA-N 384.370 5.105 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2nc(/C=C/c3ccccc3)cs2)cc1 609757099 JAQRSLOOZRQCCR-ZHACJKMWSA-N 391.521 5.057 30 20 GKED C[C@@H](c1ccc(C#N)cc1)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1 609823549 ONFOEWYGTQSVJA-SFHVURJKSA-N 396.494 5.322 30 20 GKED C=CCCCN(C)C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 609908728 ATTRCVKCCGZODN-AWEZNQCLSA-N 378.925 5.041 30 20 GKED Cc1c([C@@H](NC(=O)N[C@@H](C)c2cccc(C#N)c2)C(C)C)oc2ccccc12 610403048 ZJVWACOJYQVFRN-KKSFZXQISA-N 375.472 5.370 30 20 GKED C[C@H](NC(=O)N(CCc1ccccc1)Cc1ccccc1)c1cccc(C#N)c1 610407087 RXIDOEGFWNTBOX-FQEVSTJZSA-N 383.495 5.074 30 20 GKED CCOc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1ccc2ccccc2n1 613292451 KLJIPBPYNPQLME-SFHVURJKSA-N 398.487 5.852 30 20 GKED CCCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 613318150 MSAUZFBHIMXPLS-IBGZPJMESA-N 376.481 5.397 30 20 GKED N#C[C@@H](C(=O)c1ccc(OC(F)(F)F)cc1)c1nc2cc(Cl)ccc2s1 613403810 VERGSUWVNPVURH-LBPRGKRZSA-N 396.777 5.338 30 20 GKED Cc1cc(C#N)ccc1CNC1(c2noc(C3CCCC3)n2)CCCCCC1 614405962 KRWIYIFKJYJDEL-UHFFFAOYSA-N 378.520 5.247 30 20 GKED C=CCCOCC(=O)N(CCC)c1nc(-c2ccc(Cl)cc2Cl)cs1 620326539 JHJNLNORGFZEOA-UHFFFAOYSA-N 399.343 5.453 30 20 GKED Fc1ccccc1-c1csc(N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)n1 645033543 QNPLCVLRDAOENS-AOOOYVTPSA-N 398.347 5.516 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Cc3nc4ccccc4s3)cc2)c1 726442306 YGTNJPXHXDTMAW-UHFFFAOYSA-N 399.544 5.677 30 20 GKED FC(F)Oc1ccccc1C=NOCc1ncc(-c2cccc(Cl)c2)o1 727409651 ASGURQQGQWUXPX-UHFFFAOYSA-N 378.762 5.147 30 20 GKED CC(C)c1ccc(-c2noc(CON=Cc3ccccc3OC(F)F)n2)cc1 727410879 VVVBXHCLJLACIR-UHFFFAOYSA-N 387.386 5.012 30 20 GKED Cc1ncc(/C=C/C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)s1 732730178 OQWGRIRBIHDECB-CSKARUKUSA-N 391.471 5.017 30 20 GKED Cc1ccc(F)c(/C=C2\SC(=S)N(c3ccc(C#N)c(Cl)c3)C2=O)c1 735125989 QKHIPESPCFUQSX-APSNUPSMSA-N 388.876 5.065 30 20 GKED CC[C@](C)(NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1nccs1 740435953 XXTCPIYJNOWCEX-KNQAVFIVSA-N 390.512 5.245 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)cc1C#N 741843029 XMXCFAUTIUOJQO-UVTDQMKNSA-N 390.439 5.042 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN2C[C@H](C)[C@H]2c2ccccc2)c1=S 743395846 UQRZAXZHQDQNIL-JXFKEZNVSA-N 394.519 5.057 30 20 GKED Cc1sc2ncn(N=C/C=C/c3ccc(F)cc3)c(=O)c2c1-c1ccccc1 747746431 IRVQEKNILRSFIN-CJACZGASSA-N 389.455 5.120 30 20 GKED C#CCn1cnc(-c2ccccc2)c1NC(=O)c1ccc(OCCCCC)cc1 749359304 OJDVQYBLSXAYOZ-UHFFFAOYSA-N 387.483 5.005 30 20 GKED N#C[C@H](C(=O)CCCCc1ccc(Cl)c(Cl)c1)c1nc2ccccc2o1 753542888 WTGZDAOIYLEGEO-CQSZACIVSA-N 387.266 5.724 30 20 GKED COc1cccc(-c2nn(C(C)(C)C)cc2/C=C/C(=O)c2ccc(C#N)s2)c1 762441891 CYXZEQLJKKBCFS-CSKARUKUSA-N 391.496 5.143 30 20 GKED CC(C)(C)C1CCC(CC(=O)[C@H](C#N)c2nc(-c3ccncc3)cs2)CC1 766327046 SAJBBMXAGIEAAZ-VJFUWPCTSA-N 381.545 5.624 30 20 GKED O=C1/C(=C/c2ccc(Oc3cc(F)cc(F)c3)cc2)CCc2nc(O)ccc21 769615991 VEUSHAQPGTUIMW-NTEUORMPSA-N 379.362 5.070 30 20 GKED Cc1cc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c(C)n1-c1ccc(Cl)cc1 781034153 HURLHIUJZNKUQA-HNNXBMFYSA-N 393.874 5.291 30 20 GKED C[C@@H](OC(=O)CC(C)(C)C#N)c1cnc(-c2ccc(Br)cc2)s1 784364413 BSSRNHKCRRCVRB-LLVKDONJSA-N 393.306 5.117 30 20 GKED CC[C@H](NC(=O)[C@H](C#N)C(=O)c1cc2c(Cl)cccc2s1)c1ccccc1 787044197 FTMJDEAAIWIQBR-WBVHZDCISA-N 396.899 5.145 30 20 GKED CC(C)Oc1ccc([C@@H]2CCCC2=NNc2ccc3c(=O)[nH]ccc3c2)cc1 789070783 MRFVYWBXXVUOMW-FQEVSTJZSA-N 375.472 5.051 30 20 GKED N#Cc1ccc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)cc1F 790243945 YHDDQYPPCQNLBR-UHFFFAOYSA-N 393.921 5.620 30 20 GKED COCC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 793565218 GXFDXWFFCKQUQD-VLIAUNLRSA-N 393.314 5.324 30 20 GKED N#C[C@H](C(=O)CO[C@@H]1CCCc2ccccc21)c1nc(-c2ccccc2)cs1 797549396 IHRSMWITJWWUOV-DENIHFKCSA-N 388.492 5.081 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)n2)cc1 798288065 QDIBGXCJYBBEPO-IPMKNSEASA-N 376.456 5.238 30 20 GKED CC(C)c1nc(COC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)co1 802970016 QJYZYQFFUWOIQJ-UHFFFAOYSA-N 376.412 5.013 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(NCc2ccc(C#N)cc2C(F)(F)F)cc1 810149005 UWMGCUUMYHYURK-UHFFFAOYSA-N 391.393 5.536 30 20 GKED C/C(=C/c1ccc(OC(F)(F)F)cc1)C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 842942829 NYVRASDTEVUFLS-MEODZPNASA-N 392.402 5.199 30 20 GKED N#CCCCC[C@H](N)c1nc(-c2ccc(Sc3ccc(Cl)cc3)cc2)no1 848626932 UVTONVPOSDODMC-SFHVURJKSA-N 398.919 5.625 30 20 GKED N#CC1(CCCOC(=O)[C@H](c2ccccc2)c2ccc(Cl)cc2)CCOCC1 850239418 PQHCOGHEGAYHPF-OAQYLSRUSA-N 397.902 5.116 30 20 GKED Cc1ccc(-c2csc(NC(=O)c3ccccc3SCC#N)n2)c(C)c1 874962553 GLBUTNKLRIOHOP-UHFFFAOYSA-N 379.510 5.295 30 20 GKED CCN(C(=O)/C=C/c1ccc2ccc(Cl)cc2n1)[C@H](C)c1ccc(C#N)cc1 914509701 XZQKBMRGRYNIMQ-CJTWTEFWSA-N 389.886 5.383 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(OC(F)F)cc2)cc1 915086535 KUFPWNURWWZZGC-OAQYLSRUSA-N 392.405 5.125 30 20 GKED N#Cc1cccc(C(=O)/C=C\c2csc(-c3cccc(Br)c3)n2)c1 915992371 YZSLJZUWXXJEGW-FPLPWBNLSA-N 395.281 5.340 30 20 GKED Cc1csc([C@H](C#N)C(=O)/C=C\c2ccc(-c3ccccc3Cl)s2)n1 916843728 IANRPAJHLSHKRO-DDJMYBDESA-N 384.913 5.723 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(OC2CCCC2)cc1 916918433 PBZXQFGKEGTKHY-QFIPXVFZSA-N 398.462 5.122 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCCOc2ccccc2C)cc1 916949740 PHISUWXYMLFYGE-UWJYYQICSA-N 392.499 5.015 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1ccccc1SC(C)(C)C 1776033776 FOFPYRAGDQICLS-UHFFFAOYSA-N 376.909 5.765 30 20 GKED C=CC[C@]1(C(=O)O)CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)C1 1776159857 DFDQGUNIYHYNFT-DEOSSOPVSA-N 399.481 5.230 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(C(F)(F)F)ccc1F 1776354455 LQRFHQKZJOHOOP-CLTKARDFSA-N 396.336 5.226 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2ccc(SC(F)(F)F)cc2)c1)C(=O)O 1776471375 NWDWEHOYFOGVHX-UMAGTOLTSA-N 396.386 5.047 30 20 GKED COc1cccc(Oc2ccc(/C=C/C(=O)c3cc(C(=O)O)ccc3C)cc2)c1 1777382015 HVEZLGKUORCQLI-UKTHLTGXSA-N 388.419 5.390 30 20 GKED C=C(C)CN/C(S)=C(/C(=O)c1ccc(C)cc1)[n+]1ccc(C(CC)CC)cc1 22796838 JRWMQLGABDVLAO-UHFFFAOYSA-O 395.592 5.291 30 20 GKED CCOc1ccc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cc1 41549058 VNINDPNBQBOQCM-AWEZNQCLSA-N 390.386 5.204 30 20 GKED COc1ccc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cc1OC 60241328 YXVKKZXYZVZZDX-FOWTUZBSSA-N 377.465 5.040 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)c1 62523451 GHMAIONBGZZABI-UHFFFAOYSA-N 390.830 5.108 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C2SCCS2)c1 66158541 PCNVXVAORZSJJO-UHFFFAOYSA-N 397.569 5.479 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(C(F)(F)F)cc1 66801458 DBKZVITXQOCLAC-ZDUSSCGKSA-N 378.419 5.281 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 116505750 USDWPNYGTURXMB-MHZLTWQESA-N 390.593 5.334 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1cc(C2CC2)nc2ccc(Cl)cc12 120029018 HTLLWMLRXZOPMS-UHFFFAOYSA-N 395.821 5.059 30 20 GKED CCO[C@H](C)c1noc(CSCc2ccc(-c3ccccc3C#N)cc2)n1 123077705 BPCYGVCFAIQNHZ-OAHLLOKOSA-N 379.485 5.139 30 20 GKED Cc1ccc(-c2cncc(C(=O)[C@@H](C#N)C(=O)c3c(C)[nH]c4ccccc34)c2)cc1 124442467 LVEYLMHLBTXRDX-OAQYLSRUSA-N 393.446 5.052 30 20 GKED C=C[C@@H](CC(=O)N(C)c1nc(-c2ccccc2[N+](=O)[O-])cs1)c1ccccc1 180287612 XAZZNOHGAHLRHH-HNNXBMFYSA-N 393.468 5.041 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCS[C@H](C)CC1 192239987 FIBGLJPFVVBYFB-MRXNPFEDSA-N 381.501 5.018 30 20 GKED N#CC1(c2ccccc2)C/C(=C/c2ccsc2)C(=O)/C(=C\c2ccsc2)C1 213186935 BFNAXOJGNSTFOI-PZRYXVKFSA-N 387.529 6.101 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@H]2c2nnc(C3CCC3)o2)c1 289713101 OEEUIHGGWPBQKU-IBGZPJMESA-N 396.491 5.051 30 20 GKED N=C(O)C1CCN(c2ccccc2N=C(O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1 329007026 NGLRMJNAZYUCKB-BHIYHBOVSA-N 383.536 5.633 30 20 GKED Cc1c([C@H]2OCC[C@@H]2C(O)=Nc2ccc3nc(C(C)(C)C)sc3c2)cnn1C 329854744 WSXJXPUUZCDERA-KSSFIOAISA-N 398.532 5.002 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1sc(C2CC2)nc1-c1ccccc1 429064628 WZVCWZGQSNFTTE-UHFFFAOYSA-N 389.480 5.210 30 20 GKED C[C@H](NC(=O)Nc1cnn([C@@H](C)C2CC2)c1)c1ccc(-c2cccc(C#N)c2)cc1 429663909 VFZTZKSZUXKOLD-IRXDYDNUSA-N 399.498 5.275 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)c(Cl)c1 433517372 BUYWDDMAXNEVOT-ZDUSSCGKSA-N 391.899 5.537 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1cccc(F)c1 437483046 QTATWAVZKHLBOF-AWEZNQCLSA-N 378.378 5.371 30 20 GKED C=C(C)COc1cccc(NC(=O)NC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)c1 438126958 ZMLQMZJQSMBFCU-REWPJTCUSA-N 394.515 5.239 30 20 GKED Cc1ccccc1[C@H]1C[C@H](NC(=O)Nc2ccccc2SC[C@H](C)C#N)C1 439505484 YBIQCRYYCRIHDB-KBAYOESNSA-N 379.529 5.315 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)c2ccc(C3(C#N)CC3)cc2)c1 442194538 NKCAEMBYVLAUJD-UHFFFAOYSA-N 382.463 5.382 30 20 GKED N#Cc1c(NC(=O)c2cccc(-c3cscn3)c2)sc2c1CCCCCC2 443875196 IEQLHFKZCVBPED-UHFFFAOYSA-N 393.537 5.655 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1cccc(C)c1 447632820 PNTUMWMSHYJJFJ-NRFANRHFSA-N 394.478 5.172 30 20 GKED COc1ccc(-c2nnc(S[C@H]3CC[C@@H](C#N)C3)n2C2CCCCC2)cc1 450651244 LGGIMJFXRARPRX-BEFAXECRSA-N 382.533 5.243 30 20 GKED CC(C)Cn1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)c(C(F)F)n1 455049392 JXILJZQRLIUNNZ-INIZCTEOSA-N 389.450 5.033 30 20 GKED N#CCCC[C@H](NC(=O)N1CCC[C@H]1c1ccc(F)cc1F)c1ccccc1 458840582 NTYXIPUJCCMIOO-SFTDATJTSA-N 383.442 5.246 30 20 GKED C[C@H](C(=O)Nc1ccnc(Oc2ccccc2Cl)c1)c1cccc(C#N)c1 463868296 WKVYYYBTFOZKJT-AWEZNQCLSA-N 377.831 5.141 30 20 GKED N#Cc1cc(NC(=O)c2ccncc2)ccc1Oc1ccc(C(F)(F)F)cc1 464299798 KNVMQBIRDQBORX-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C=C(C)C[C@H](C)C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 467826266 USNURLCGQBSNBU-AWEZNQCLSA-N 392.549 6.209 30 20 GKED Cc1c(C(=O)Nc2ccccc2CCC(F)(F)F)ccc(C(F)(F)F)c1F 467962687 HYRJSRRYNXCVJH-UHFFFAOYSA-N 393.302 5.900 30 20 GKED Cc1ccc(-c2csc3nc(S[C@H](C)CCC#N)n(C)c(=O)c23)cc1C 470451900 MQVZIXSSJFZPNP-CQSZACIVSA-N 383.542 5.063 30 20 GKED COc1c(F)cc(F)cc1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 472495762 GQAWWWNNCUOFPN-UHFFFAOYSA-N 396.418 5.249 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(Oc2ccc(F)cc2)cn1)c1ccccc1 475636344 BCABEHQDZAJPEG-QGZVFWFLSA-N 375.403 5.039 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(NC(C)=O)c(SC)c1 476160699 SMUBJVLNEPGPFS-UHFFFAOYSA-N 382.529 5.471 30 20 GKED CSc1ccc(CS[C@H](C)C(=O)N(CCC#N)c2ccc(F)cc2)cc1 478763994 JRCSVIXEBIYZFF-OAHLLOKOSA-N 388.533 5.116 30 20 GKED Cc1ccccc1[C@@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C 485383291 LDMCHYNJTVDCIW-KKSFZXQISA-N 381.545 5.766 30 20 GKED CC(=O)Nc1cc(F)c(F)cc1NCc1ccc(-c2ccccc2C#N)cc1 487355253 HFBNGGCMVGFMBE-UHFFFAOYSA-N 377.394 5.074 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(C(=O)N[C@H](C)CC)cc1C)c1ccccc1 488711591 HKYXZEADMKOMPQ-NQIIRXRSSA-N 378.516 5.212 30 20 GKED C=CCN(Cc1cccs1)C(=O)CCc1nc(-c2ccc(C(C)C)cc2)no1 493765075 QEJPUNDBAZOKMS-UHFFFAOYSA-N 395.528 5.069 30 20 GKED CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)C(=O)c1sccc1C#N 497980238 IADPUSNNXUHVJW-UHFFFAOYSA-N 384.501 5.538 30 20 GKED C=CCN(CCc1ccco1)C(=O)N[C@@H](C)c1ccc(-c2csc(C)n2)cc1 498160632 DFTFFBCZVHGAPC-INIZCTEOSA-N 395.528 5.213 30 20 GKED COCCC[C@H](c1ccc(Cl)cc1)c1noc(-c2cccc(CC#N)c2)n1 508645005 ITGQXUREIRRVSP-LJQANCHMSA-N 381.863 5.015 30 20 GKED CCN(CCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 510679691 IIDIEEMDVIWZJJ-UHFFFAOYSA-N 385.467 5.447 30 20 GKED N#Cc1ccccc1NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 511819605 FGRMCTPCTLWXRR-UHFFFAOYSA-N 383.426 5.417 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)cc2F)cc1Cl 515131435 VQMKRYJJNUFTCO-GOSISDBHSA-N 399.252 6.040 30 20 GKED Cc1nc(C(C)C)sc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 515547384 UNZVMFANRUSULS-LLVKDONJSA-N 375.906 5.328 30 20 GKED C[C@@H](Sc1ccccc1Cl)C(=O)Nc1sc2c(c1C#N)CCCC2 515599974 ZBUUBUBZHGXCGN-LLVKDONJSA-N 376.934 5.271 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ccc4nc[nH]c4c3)cc2Cl)cc1 516005834 RXOAMHFZDZHQLA-UHFFFAOYSA-N 388.814 5.133 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCOc2c(Cl)cccc21 516686444 ZNJQPJANCXLMRX-HNNXBMFYSA-N 397.327 5.276 30 20 GKED CCOC(=O)c1oc2ccccc2c1CNc1ccccc1SC[C@H](C)C#N 518660012 CWQACBUTGJTGBB-OAHLLOKOSA-N 394.496 5.473 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2c(ccc3ccccc32)[nH]1 518743128 NMVFYNRUOVNVMM-OAHLLOKOSA-N 385.492 5.968 30 20 GKED CC(C)c1ccc(OC2CCN(c3nc(C(F)(F)F)ccc3C#N)CC2)cc1 522408596 HLIDVOXAAZNQMJ-UHFFFAOYSA-N 389.421 5.143 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3ncsc3-c3ccccc3)n2)cc1 525836915 HYZKJXULDGUTQO-UHFFFAOYSA-N 388.477 5.058 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CSCC(F)(F)F 535618127 SDWLMSGYUHWIPV-UHFFFAOYSA-N 398.837 5.040 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)nn1C1CCCCC1 539584409 JZOMBIWSHHXVKF-HNNXBMFYSA-N 398.919 5.450 30 20 GKED COc1c(C)cc(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1C 540244523 CIRFRYMNKKTSRH-AWEZNQCLSA-N 398.434 5.204 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NCc1ccc(CC#N)cc1 541660796 RNSSHFPUSSLKOH-CQSZACIVSA-N 381.932 5.689 30 20 GKED CSc1c(F)cc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1F 544275061 XRKRQFYPPYTNRT-UHFFFAOYSA-N 377.416 5.013 30 20 GKED Cc1ccnc(-c2cccc(NC(=O)c3sc4ccc(C#N)cc4c3C)c2)n1 550846452 DAYLHOUNCGVMBK-UHFFFAOYSA-N 384.464 5.099 30 20 GKED C=CCn1c(S[C@@H](C)CCC#N)nc2scc(-c3ccccc3)c2c1=O 551392260 KWJPNHLTZNXTEP-AWEZNQCLSA-N 381.526 5.095 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1(Cc2ccccc2Cl)CC1 572106695 MDJFLLJPXASXLO-UHFFFAOYSA-N 385.939 5.045 30 20 GKED CC(C)(CCC#N)CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 576427318 XERJDXZQNJEPRS-UHFFFAOYSA-N 387.867 5.460 30 20 GKED N#CCCN(C(=O)c1ccc(C(F)(F)F)s1)C12CC3CC(CC(C3)C1)C2 588961783 ZKFUFUWQDUMOCL-UHFFFAOYSA-N 382.451 5.092 30 20 GKED N#CCCC[C@H](NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1)c1ccccc1 596605555 FQYOWKYTDSDNNW-FPOVZHCZSA-N 377.488 5.341 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(C(F)(F)F)CCCC1 599737273 LUTSFCZCRZWGNL-ZDUSSCGKSA-N 385.455 5.183 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)Cc2cccc(F)c2)cc1Cl 603673249 QZCNLOCVWFMPBL-HXUWFJFHSA-N 378.834 5.316 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 603689748 DCTSXKXQWYDMEA-AWEZNQCLSA-N 378.457 5.032 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3Cl)cn2)cc1 603763516 CWVUGPSZJBSELW-OALUTQOASA-N 389.842 5.141 30 20 GKED CN(C(=O)c1cccc(OCc2ccc(Cl)cc2)c1)c1ccc(C#N)cc1F 609216932 XILZWWRNGYCXPP-UHFFFAOYSA-N 394.833 5.206 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H](C)c1c(Cl)cccc1Cl 609581087 CHEKVVFIPGCOCN-CQSZACIVSA-N 375.299 5.407 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1cccc(Cl)c1 610019624 YKZMKQWKTYRNOC-AWEZNQCLSA-N 387.936 5.791 30 20 GKED Cc1nc(NC(=O)C[C@H](C)c2ccccc2C(F)(F)F)sc1SCC#N 610171885 JJLKQNRVPJASNU-JTQLQIEISA-N 399.463 5.218 30 20 GKED C=CCn1c(S[C@@H](C#N)Cc2ccccc2)nnc1-c1cccc(Cl)c1 610863185 BRLTWKZFULXDPI-GOSISDBHSA-N 380.904 5.011 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1ccc(OC(C)C)cc1 612447583 QLDKJYGJZWMKDW-UHFFFAOYSA-N 392.952 5.129 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H]1CCc2cc(C#N)ccc21 618807229 TVKATFQOMOJDDG-RBZFPXEDSA-N 377.488 5.467 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)[C@H](C#N)c1nc(C2CC2)cs1 647373526 JTFCYXGOTFNDRY-AWEZNQCLSA-N 399.928 5.596 30 20 GKED Fc1cncc([C@H](NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)C2CC2)c1 684954729 XFELVBRIABOVIH-SLEUVZQESA-N 384.339 5.171 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccs3)cc2F)cc1NC(C)=O 726427385 KWLQWUCUNQZMTK-CLFYSBASSA-N 395.455 5.417 30 20 GKED Cc1ccc(-c2nnc(S)n2N=Cc2ccc(Cl)c(C(F)(F)F)c2)cc1 727253316 DUPIDNQPVHIHNJ-UHFFFAOYSA-N 396.825 5.097 30 20 GKED CCN(C(=O)/C=C\c1ccccc1C#N)[C@H](c1ccccc1)c1ccc(F)cc1 730193658 PNQCJDACJVQZNB-KKFJTVDOSA-N 384.454 5.349 30 20 GKED C=CC[C@H](NC(=O)c1cccc(OCc2cccc(Cl)c2)c1)c1ccncc1 734460308 OKYCVIDLPBRIAC-QFIPXVFZSA-N 392.886 5.361 30 20 GKED C=CC[C@H](NC(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 734680196 NVQBTQDIVCUSPF-BEFAXECRSA-N 391.437 5.510 30 20 GKED C=CCCCN(C)C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 736517632 SNPCNPKEEFPLOZ-UHFFFAOYSA-N 387.508 5.550 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1OC(F)F 741474191 VRKLJLIROXLDGM-ALCCZGGFSA-N 381.378 5.255 30 20 GKED C#CCOc1cc(F)ccc1NC(=O)c1cc(C)n([C@@H](C)c2ccccc2)c1C 741726033 RFBZXMSJEPETCX-KRWDZBQOSA-N 390.458 5.118 30 20 GKED CC(=NNc1nc(-c2ccccn2)nc2c1CCC2)c1ccc(Cl)cc1Cl 741810018 USKVRLDBINOFSE-UHFFFAOYSA-N 398.297 5.170 30 20 GKED O=C(C=NOCc1csc(C2CCCCC2)n1)Nc1ccc(F)cc1Cl 742362740 ZEWAKLXPYYOOCH-UHFFFAOYSA-N 395.887 5.124 30 20 GKED CC[C@H](C)c1ccc(-c2cc(C(=O)N3CCC(C#N)CC3)c3ccccc3n2)cc1 747198098 LKGZOZFXAPIZKH-SFHVURJKSA-N 397.522 5.791 30 20 GKED C#CC[C@H](NC(=O)N1CCc2sccc2[C@@H]1c1cccs1)c1ccccc1 757764663 YIWIMXGHUUBQEA-GHTZIAJQSA-N 392.549 5.231 30 20 GKED CCOc1ccc(C(=O)/C=C\c2csc(-c3cccs3)n2)cc1[N+](=O)[O-] 765615992 KPLYMINJYVZZOE-SREVYHEPSA-N 386.454 5.075 30 20 GKED C#C[C@H](C)N(C)C(=O)Nc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 770784965 LQTITVBYQYTVBY-LBPRGKRZSA-N 385.876 5.227 30 20 GKED C#CC[C@H](NCc1cccc(CN[C@H](CC#C)c2ccccc2)c1)c1ccccc1 775402940 DNWDASFNHWAFIL-HNRBIFIRSA-N 392.546 5.395 30 20 GKED COCCOc1ccc(C#N)cc1NC(=O)c1c2ccccc2cc2ccccc12 784684316 PCSHLDKZJZNBAX-UHFFFAOYSA-N 396.446 5.142 30 20 GKED C=CCc1cc(CN[C@@H](C)c2cccc(C(F)(F)F)c2O)cc(OC)c1OC 788641822 ALFJTRQDMWKNPR-ZDUSSCGKSA-N 395.421 5.008 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nccc2ccccc12)c1cccc(C(F)(F)F)c1 792093975 BSZMZHNNYFVRMD-KUHUBIRLSA-N 382.385 5.624 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(OC(F)(F)F)cc1 794997391 YLBHXVDYHKJYCU-UHFFFAOYSA-N 380.435 5.360 30 20 GKED Cc1cc(C#N)ccc1NC1CCC(OC(=O)c2coc(C3CCCC3)n2)CC1 802120585 DBFUEEPYPQTUNI-UHFFFAOYSA-N 393.487 5.092 30 20 GKED N#CCCCCCC(=O)O[C@H](c1ccc(Br)cc1)C(F)(F)F 805878505 NEJYHEMJHXZYGH-CQSZACIVSA-N 378.188 5.070 30 20 GKED CC1(C)C[C@H](OC(=O)CCCCCC#N)c2cc(Br)ccc2O1 805962689 VCMJZNYBOKTMDK-INIZCTEOSA-N 380.282 5.069 30 20 GKED C#Cc1cccc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)c1 817883096 AOPXJFBCWUEYNS-UHFFFAOYSA-N 385.250 5.201 30 20 GKED Cc1cc(Br)ccc1CNc1ccccc1SC[C@H](C)C#N 864005552 BEFIRPKZECHWTC-CYBMUJFWSA-N 375.335 5.621 30 20 GKED COc1cccc2cc(C(=O)/C=C/c3ccc(OCc4ccncc4)cc3)oc12 915041265 MPVWHMVZVIKQSF-JXMROGBWSA-N 385.419 5.312 30 20 GKED Oc1ccc(Br)cc1C=Nc1cccc(COCc2ccco2)c1 915980875 GMOUSWUHARAWOM-UHFFFAOYSA-N 386.245 5.215 30 20 GKED CCc1ccccc1Oc1ccc(C=NNc2cccc(C(=O)O)c2)c(Cl)c1 1776038149 UZRPYTFDPSSHOM-UHFFFAOYSA-N 394.858 5.839 30 20 GKED O=C(O)c1ccc2c(c1)CCCCC2=NOCc1ccc(C(F)(F)F)cc1 1776112283 WMKBWLNBPBLIBS-UHFFFAOYSA-N 377.362 5.051 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2cccc(CC(=O)O)c2)c2c(c1)C(C)(C)CC2 1776269256 UNRYLSUVAJNZJF-KTKRTIGZSA-N 390.523 5.731 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C/c1csc3ccc(C(=O)O)cc13)CCO2 1776374802 SSBTYRBHARMLHM-OQLLNIDSSA-N 392.476 5.772 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)cc1 1776388580 IVCJALPJCLOVOV-FZSIALSZSA-N 386.447 5.735 30 20 GKED CCCCCOc1ccc(/C=C\C(=O)c2cccc(O[C@H](C)C(=O)O)c2)cc1 1776794135 WIPWVBYWLFDEAZ-VWILAXROSA-N 382.456 5.004 30 20 GKED CCc1c(C(=O)/C=C/c2ccc(O[C@@H](C)C(=O)O)cc2)oc2ccc(C)cc12 1776956300 QMUZLGAUVQOSDB-SHQCLWGWSA-N 378.424 5.052 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1csc(-c2ccc(C)cc2)n1 17367218 XPSGRCDYCXXJBE-UHFFFAOYSA-N 398.871 5.262 30 20 GKED CCc1cccc(C)c1NC(=O)CNc1ccc(Oc2ccc(C#N)cc2)cc1C 63641519 HTMIFPZLLWFNPF-UHFFFAOYSA-N 399.494 5.580 30 20 GKED Cc1[nH]c2ccc(CNCc3cccc(OCc4cccc(C#N)c4)c3)cc2c1C 65013536 VCTBYTZPAFFVFB-UHFFFAOYSA-N 395.506 5.525 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1C 66954885 FHOJITLFTRQVGG-RXVVDRJESA-N 393.556 6.067 30 20 GKED C=CCn1c(SCCCOc2ccc(C)c(C)c2)nnc1-c1ccoc1C 71878022 DZKASUIBPWMWRW-UHFFFAOYSA-N 383.517 5.211 30 20 GKED Cc1ccc(Cl)cc1NC(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 108407552 CETNJMPGFMMWDP-DZGCQCFKSA-N 387.936 5.339 30 20 GKED CCOc1ccc([C@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108529532 GIXAMEJFCANJLH-HOTGVXAUSA-N 383.517 5.220 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)Nc2cccc(COCc3ccco3)c2)cc1 113539828 WICUXKIHNHFQSF-UHFFFAOYSA-N 389.455 5.442 30 20 GKED Cc1cc(C(=O)Nc2ccccc2SCCC#N)ccc1Br 119549014 WPSDLUOGEJSMHL-UHFFFAOYSA-N 375.291 5.016 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(-c2ccc(F)cc2)o1 121014281 MNVBPGGRPBQPEU-KRWDZBQOSA-N 386.382 5.081 30 20 GKED CCS[C@@H]1CCC[C@H]1NC(=O)c1ccccc1SCc1ccc(C#N)cc1 178056555 AXYQQLBWNYRWKO-TZIWHRDSSA-N 396.581 5.255 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 180055311 TVVXONQCKGUBOD-KKSFZXQISA-N 388.471 5.218 30 20 GKED Cc1c([C@@H](C)N[C@H](CCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 181571746 ARNIBTVAEHUOTD-OPAMFIHVSA-N 378.907 5.530 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Oc1ccc(CCC(C)=O)cc1 189882697 PMNHFAKRQRBRCQ-IBGZPJMESA-N 393.527 5.466 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1cccc(OC)c1 191423814 IFXHKJMXWAXNLR-JOCHJYFZSA-N 378.516 5.916 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)CCC(=O)c3cccs3)cc2)c1 303338129 LACRWWDQGKONOM-UHFFFAOYSA-N 376.437 5.014 30 20 GKED CC[C@@H](C)c1ccc(S(=O)(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 303383223 WMBPSFOKAVJOIR-CVEARBPZSA-N 388.558 5.395 30 20 GKED CC[C@H](/C(O)=N/C1(c2noc([C@@H]3CCOC3)n2)CCCCCC1)c1ccccc1 329783729 VJUCTYZAUPJMNT-MOPGFXCFSA-N 397.519 5.273 30 20 GKED CC(C)n1ncc(C(=O)Nc2sc3c(c2C#N)[C@@H](C)C[C@@H](C)C3)c1C1CC1 411008836 IRJSCOMUXDYESX-OLZOCXBDSA-N 382.533 5.213 30 20 GKED N#C[C@H]1CC[C@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)C1 430096144 DKAKOIOQJLOTKV-GUYCJALGSA-N 384.892 5.024 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2cc(Cl)ccc2OC(F)F)s1 430611366 NXIDMCJIBCDFTP-LLVKDONJSA-N 384.835 5.185 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc1Br 430614973 ASWMLAQIKYFATG-GFCCVEGCSA-N 377.307 5.002 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@@H](CC(F)(F)F)C1 433992938 KOWKIYXBJYXVRH-AWEZNQCLSA-N 390.430 5.124 30 20 GKED C=CCC[C@@H](NC(=O)Cc1c(CC)noc1CC)c1ccc(C(F)(F)F)cc1 441579189 ZUTACODWGYKQRT-GOSISDBHSA-N 394.437 5.184 30 20 GKED N#C[C@H](NC(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl)C1CCCCC1 442681665 NQXNPAPVCMNRQA-INIZCTEOSA-N 376.287 5.191 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)CS[C@@H](C)c2ccc(C#N)cc2)cc1 447015432 GITGJBGPCZREHO-JTSKRJEESA-N 394.540 5.115 30 20 GKED CN(CC(C)(C)C#N)C(=O)N[C@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 458605685 AKICORLSNPXETF-HNNXBMFYSA-N 387.833 5.001 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(C3CC3)CCOCC2)cc1Cl 462419279 AYYXFCYOONBAII-HXUWFJFHSA-N 394.902 5.141 30 20 GKED C=CCOc1ccc(CNC[C@H]2CCCN(C)[C@H]2c2cccs2)cc1Cl 462729514 QYURJWHCLWQQPF-DYESRHJHSA-N 390.980 5.139 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)N[C@H](C#N)c1ccc(Cl)c(Cl)c1 463743906 IUGYKWOZFTUQJO-KPZWWZAWSA-N 379.262 5.082 30 20 GKED C[C@@H](c1ccc(-c2ccccc2)cc1)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 464758003 NYYNIOZEKVAAEC-SFHVURJKSA-N 394.478 5.468 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC(c2nc3ccccc3s2)C1 465525592 ZBPKDKWVUWVIDS-UHFFFAOYSA-N 395.487 5.075 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1cccc(-c2cccnc2)c1 468317481 OVWIYPYMNUDMCL-UHFFFAOYSA-N 397.931 5.361 30 20 GKED COc1cc(C)c([C@@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1C 469226934 LHEAHYRBZVSFHO-GOSISDBHSA-N 391.515 5.068 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cnc2ccsc2c1 469280939 XEDYIMOHDVBNRO-HNNXBMFYSA-N 390.512 5.052 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1ccc(OCC2CC2)c(F)c1 469414060 MWHNYHSREBVWSN-HNNXBMFYSA-N 388.508 5.135 30 20 GKED Cc1ccc(-c2nnc(COc3ccc(Oc4ccc(C#N)cc4)cc3)o2)cc1 480338070 RACZLUGNLTVIKT-UHFFFAOYSA-N 383.407 5.288 30 20 GKED CN1CCC[C@H](CN[C@@H]2CCCCc3cc(C#N)ccc32)[C@H]1c1cccs1 481667828 KNBAYLRKYHKQBD-LSWJPFSZSA-N 379.573 5.060 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3cnc4ccccc4n3)s2)c(C)c1 483194692 JJSYVMNRTMIVGW-QGZVFWFLSA-N 398.491 5.169 30 20 GKED C=CC[C@@H](C(=O)N1CCC(c2nc3ccccc3s2)CC1)c1ccccc1 487654634 KTDXBDLJLIEWLD-LJQANCHMSA-N 376.525 5.362 30 20 GKED C[C@H](CC(=O)Nc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)cc1 498779713 DMPWRZSMWCJNDZ-OAHLLOKOSA-N 390.405 5.520 30 20 GKED N#CC1(CCCN2CCCC[C@@H]2c2ccccc2C(F)(F)F)CCOCC1 499534791 XMVZLXFDBSEBIJ-LJQANCHMSA-N 380.454 5.333 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)N(Cc2ccco2)c2ccccc2C#N)c1 501016105 DKVJIEYDJYAQQE-UHFFFAOYSA-N 388.467 5.195 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)Nc3cc(Cl)ccc3C)n2)cc1 505777008 MZDNJTBOPIENQC-MRXNPFEDSA-N 381.888 5.326 30 20 GKED FC(F)(F)c1ccc(C#CCNc2cccc3c2CN(c2ccccn2)C3)cc1 507600056 BUMHXWXUJAOFGF-UHFFFAOYSA-N 393.412 5.084 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CCc3cc(F)ccc32)cc1 510703855 QZRFPSCUBKOVLF-OAQYLSRUSA-N 387.414 5.299 30 20 GKED CC(C)(C)c1ccc2c(c1)CN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)CC2 512889677 NREGBRNXVACSOK-UHFFFAOYSA-N 375.516 5.375 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)C[C@@H]1CCO[C@@H](C(C)C)C1 513658764 WOANQJRTJJOCFV-AUSIDOKSSA-N 392.499 5.439 30 20 GKED CC(C)CN(C(=O)c1cnc(-c2ccccc2F)s1)c1ccc(C#N)cc1 517874927 MNOGASZOCHGOMY-UHFFFAOYSA-N 379.460 5.124 30 20 GKED CCCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 520429360 MANGIFOHBDJGAM-OAHLLOKOSA-N 382.435 5.531 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1cccc(C#Cc2ccccn2)c1 523587222 MQQDYAHMYZILIE-KRWDZBQOSA-N 389.886 5.360 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ncsc2C(F)(F)F)cc1 527451702 BELUDIBLIRWFQV-UHFFFAOYSA-N 389.358 5.078 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(Sc2ncccn2)cc1C)c1ccccc1 534697702 SNJRMPXEIFJAEZ-QGZVFWFLSA-N 375.497 5.235 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N(CC(F)F)CC3CCC3)cc2)cc1 535609631 IVWSPYBMIJYPSV-UHFFFAOYSA-N 384.426 5.052 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1ccccc1SCc1cn2ccccc2n1 538333050 SBHUTQMCHLTOIW-QGZVFWFLSA-N 379.529 5.101 30 20 GKED CCCN(C(=O)c1sccc1C#N)[C@H](c1cccnc1)c1ccc(F)c(C)c1 538556892 HQNIVEZAYZOIBH-FQEVSTJZSA-N 393.487 5.104 30 20 GKED CCN(C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)[C@@H](C)c1cccnc1 541159324 VTAJUZFUJWLZCY-OALUTQOASA-N 398.510 5.474 30 20 GKED CCc1nc(C)c([C@@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 542996273 XKHQMYPAPAROQP-JKSUJKDBSA-N 375.541 5.964 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc4ncccc4c3)o2)cc1 547434821 ZGVGZFNBOXLDHA-UHFFFAOYSA-N 375.453 5.142 30 20 GKED N#Cc1ccnc(Sc2nnc(-c3ccco3)n2C2CCCCC2)c1Cl 553244744 BZCSJNBHGGQGQP-UHFFFAOYSA-N 385.880 5.115 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2ncccc2OCc2cccc(Cl)c2)c1 556899344 CZNQAJZGJFJMHC-UHFFFAOYSA-N 398.249 5.091 30 20 GKED COCCSc1ccc([C@@H](C)NCc2ccc(C#N)cc2C(F)(F)F)cc1 565865920 OAVMPLBSGLWKTF-CQSZACIVSA-N 394.462 5.166 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2cc(F)cc(C#N)c2)cs1 565974047 XHLHRDALIHQBMP-UHFFFAOYSA-N 395.459 5.034 30 20 GKED C=CCN(C(=O)[C@H]1CC[C@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 570754431 DSYCHQWLBMYTEI-GJZGRUSLSA-N 380.435 5.308 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1CCN(c2ccccc2Cl)C1 576558461 FQDIHPIMXUPUOW-HZPDHXFCSA-N 399.947 5.057 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1cscc1C#N 582919201 VVCJZZJEWOFOCG-SNVBAGLBSA-N 387.917 5.196 30 20 GKED C=CCn1c(SCc2nc(-c3ccsc3)oc2C)nnc1-c1ccco1 588350335 OYYPYEMIBVPMSU-UHFFFAOYSA-N 384.486 5.041 30 20 GKED Cc1nc(-c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)co1 589154276 SDNQCQSREPEPKC-UHFFFAOYSA-N 378.775 5.017 30 20 GKED N#CC1(CC(=O)Nc2ccc(Oc3nc4ccccc4s3)c(Cl)c2)CC1 590333982 QUSRFZHSQZJUAU-UHFFFAOYSA-N 383.860 5.374 30 20 GKED N#C[C@@H](C(=O)c1sccc1-c1ccccc1)c1nc2cc(F)ccc2s1 592974200 OYAQCYKLRFIYOC-HNNXBMFYSA-N 378.453 5.654 30 20 GKED C=CC1CCN(C(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccc(F)cc23)CC1 599686085 ALTIVABMDLTSLY-UHFFFAOYSA-N 394.465 5.470 30 20 GKED CCOc1ccc([C@H](C)NCc2cccc(OCc3ccccc3C#N)c2)cc1 609432756 PNNVJWXDVDHSID-IBGZPJMESA-N 386.495 5.387 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)[C@H]3CCSc4ccccc43)cc2)c1 610228145 MUEXVJPUPOHUKI-NRFANRHFSA-N 386.476 5.569 30 20 GKED CC(C)(C#N)c1ccc(CN2CCO[C@H](c3cccc(C(F)(F)F)c3)C2)cc1 614169038 PQMVGQINRZOLDR-FQEVSTJZSA-N 388.433 5.080 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1cc2cc(F)ccc2o1 619124933 IGFBGLISFWDUEC-UHFFFAOYSA-N 385.279 5.355 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 620301419 BAAWALAZOIUYHC-OKILXGFUSA-N 395.318 5.299 30 20 GKED C=CCC1(NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CCOCC1 657633602 SCBOOASFJDSCIK-UHFFFAOYSA-N 382.451 5.044 30 20 GKED N#Cc1ccc(NC(=S)N2CCC[C@H]2c2ccccc2Cl)cc1Cl 726473578 MHNWWBQEFAWWIY-KRWDZBQOSA-N 376.312 5.399 30 20 GKED N#CCCCOc1cccc(/C=C(/Cl)c2ncc(-c3ccc(Cl)cc3)o2)c1 726743495 JWQYFENIYNVPOB-CPNJWEJPSA-N 399.277 6.414 30 20 GKED N#CCOc1cccc(NC(=O)NCC2(c3ccccc3)CCCCCC2)c1 727589817 LVWDZEXFTGFDTG-UHFFFAOYSA-N 377.488 5.003 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc(C2SCCS2)c1 732696292 BHNJKELOSTWKPK-UHFFFAOYSA-N 376.591 5.765 30 20 GKED Cc1ncc(/C=C\C(=O)Nc2sc3c(c2C#N)CC[C@H](C(C)(C)C)C3)s1 732729554 YRSJPLLDMMCPJR-WOLRVDTOSA-N 385.558 5.188 30 20 GKED CCCCN(Cc1ccccc1F)C(=O)NCc1cccc(O[C@H](C#N)CC)c1 733806037 VZBCBXXZNNZFBZ-FQEVSTJZSA-N 397.494 5.019 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2cccc(COc3cccc(F)c3)c2)cc1 733953415 JLMXMELXPPAGSF-UHFFFAOYSA-N 388.442 5.274 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCc2ccccc21)c1nc(-c2ccc(Cl)cc2)cs1 734706314 CHKHCTMOBHZQCO-QFBILLFUSA-N 392.911 5.760 30 20 GKED C=CC[C@@H](NC(=O)N(CCc1ccc(Cl)cc1)CC1CC1)c1ccncc1 735189593 DEFOYVOUFVGRDM-OAQYLSRUSA-N 383.923 5.017 30 20 GKED CCc1ccc([C@@H](C)CC(=O)[C@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 739155785 VRQLMUDAMGOPQQ-JTSKRJEESA-N 390.527 5.215 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccccc3OC(F)F)cc2F)c1 742260639 CGBSGDUKHBJNMQ-UHFFFAOYSA-N 398.384 5.490 30 20 GKED CCOc1ccccc1C=NOCc1ccc(OC)c(SC(F)(F)F)c1 742350751 CWKIHHRINJKYJA-UHFFFAOYSA-N 385.407 5.257 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C\c2sc3ccccc3c2Cl)S1 744845080 KOXJIAGGFGAIFW-MHWRWJLKSA-N 398.940 6.063 30 20 GKED Cc1csc(Sc2ccc(NC(=O)/C=C\c3ccccc3C#N)c(C)c2)n1 750826996 SXSPQNOXCNNJEQ-YFHOEESVSA-N 391.521 5.435 30 20 GKED Fc1ccc([C@H](NCc2ccc(Cl)nc2C(F)(F)F)C(F)(F)F)cc1 753835559 ZUVUROBVIRXYSL-LBPRGKRZSA-N 386.698 5.286 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)C3CCC(C(F)(F)F)CC3)c2)s1 766709493 KLMFBYOITKICPP-UHFFFAOYSA-N 392.446 5.272 30 20 GKED CC[C@@H]1CCCC[C@H]1OCC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 766846419 LZFWLVVGHDDJIY-HACGYAERSA-N 376.909 5.111 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCCCCC(C)(C)C#N 768853620 UPKHYACNWZJQPP-UHFFFAOYSA-N 394.393 5.546 30 20 GKED CCN(c1ccc(C(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1)C(C)C 770125249 SZTZGFUGIKSKST-QGZVFWFLSA-N 381.476 5.160 30 20 GKED C[C@H]1CN(c2ccc(NC3CCC(C#N)(c4ccccc4)CC3)cc2)C[C@H](C)O1 770420828 NCXCXVIWWGNQAL-BVUOJPEUSA-N 389.543 5.116 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H]3CCCc4sccc43)n2)cc1 771578756 OJDIXLLFJDMDRS-IRXDYDNUSA-N 378.522 5.476 30 20 GKED C=CCC[C@H](N[C@H](C)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccccc1 773076801 PBMWKGFTATUXPN-BEFAXECRSA-N 379.472 5.041 30 20 GKED Cc1cccn2cc(-c3ccc(N[C@H](C)c4ccc(OCC#N)cc4)cc3)nc12 777641956 SZSIBDCWOHZWAI-GOSISDBHSA-N 382.467 5.385 30 20 GKED C[C@@H](NC(=O)c1cc(Cl)ncc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 781011238 GAHDMRXGFBVGQB-CYBMUJFWSA-N 396.277 5.418 30 20 GKED Cc1cnc(Cl)c(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)c1 787979779 JGHBVLPJXTVOCH-UHFFFAOYSA-N 398.249 5.613 30 20 GKED COc1ccc(/C=C\C(=O)c2cc(C)c(OC)c(Cl)c2)cc1OCCCC#N 794723858 MUJAQWIFUFSCIA-VURMDHGXSA-N 399.874 5.244 30 20 GKED O=C1/C(=C\c2csc(-c3ccccn3)n2)CCc2cc(Br)ccc21 794958293 ZKLWUAQHTNEGKP-RAXLEYEMSA-N 397.297 5.180 30 20 GKED N#Cc1ccccc1CN[C@@H](c1c[nH]c2ccccc12)C(Cl)(Cl)Cl 796467637 AFGJQXQNXDCEJJ-KRWDZBQOSA-N 378.690 5.241 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1cc(C)c(Cl)cc1C 796630064 AUBKSBWVSSNTPA-SFHVURJKSA-N 382.891 5.043 30 20 GKED N#C[C@@H](C(=O)C1(C(F)F)CCCC1)c1nc2cc(C(F)(F)F)ccc2s1 808978389 JCRLITPFNRODOK-JTQLQIEISA-N 388.361 5.317 30 20 GKED N#C[C@H](C(=O)Nc1cccc2ccccc12)C(=O)c1ccc(C2=CCCC2)cc1 810530364 BNOLYHRSYYITRY-QFIPXVFZSA-N 380.447 5.368 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](c1ccccc1)[C@@H](O)c1ccccc1 813874235 DLQRPGJCROHTBI-CYXNTTPDSA-N 382.507 5.390 30 20 GKED CC(C)c1nnc(CNc2ccc(OCc3cccc(C#N)c3)c(Cl)c2)s1 834548929 SBEDIWDLRCHBSJ-UHFFFAOYSA-N 398.919 5.378 30 20 GKED N#C[C@@H](C(=O)[C@H]1CC12CCSCC2)c1nc2cc(C(F)(F)F)ccc2s1 835075279 WVMVONSUVJXRLX-NWDGAFQWSA-N 396.459 5.025 30 20 GKED N#C[C@H](C(=O)CCc1ccco1)c1nc(C23CC4CC(CC(C4)C2)C3)cs1 915102711 DQWGZVFARGACDH-XCLLZBPDSA-N 380.513 5.013 30 20 GKED COc1ccc(C)cc1CCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915354134 VYSSMIJMMMUHDB-QHCPKHFHSA-N 399.494 5.023 30 20 GKED COc1ccc(C(=O)/C=C\c2cccc(OCc3cccc(C#N)c3)c2)c(F)c1 915984282 VGXCPZCDNVJBLG-FLIBITNWSA-N 387.410 5.181 30 20 GKED C[C@H]1CCCC[C@H]1NC(=S)Nc1cccc(OCc2cccc(C#N)c2)c1 916000860 WXDQMEIOBUUKNL-HRAATJIYSA-N 379.529 5.002 30 20 GKED CC(=NNc1ncnc2sc(C)c(C)c12)c1cc(C)ccc1OC(F)F 916310502 XWTAGFTZBHSURA-UHFFFAOYSA-N 376.432 5.054 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 917024914 CJOXTVMGENEIIT-GUYCJALGSA-N 398.940 5.821 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2sc3c(c2C#N)CCCCCC3)s1 917783191 PDWDYBCMYXWYBX-UHFFFAOYSA-N 386.542 5.250 30 20 GKED CCCCCCOc1ccc(CC(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc1 920106353 OOFBWRFNXDUYOQ-QFIPXVFZSA-N 386.495 5.613 30 20 GKED CC(C)CC(=NNc1ccc(C(=O)O)cc1)c1cccc(Br)c1 1776012621 HIPRKNZOMTWDJX-UHFFFAOYSA-N 375.266 5.010 30 20 GKED CC(C)CC(=NNc1ccc(C(=O)O)c(F)c1)c1cccc(C(F)(F)F)c1 1776074295 SIICRPSHMHBKMQ-UHFFFAOYSA-N 382.357 5.405 30 20 GKED C/C(=C\c1ccc(-c2ccc(C(=O)O)cc2)cc1)c1nc2ccccc2n1CC#N 1776196749 HBBNZLFPNQOEAQ-WUKNDPDISA-N 393.446 5.486 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CC(=O)O)c2ccccc2CC)c1 1776788099 RNURSVVCSRWGGD-XMMPIXPASA-N 397.559 5.904 30 20 GKED CCCCCCCOc1cccc(CNC[C@]2(CC(=O)O)CC[C@H](C)C2)c1 1776788728 UEAADUKVDHOQSX-WMZHIEFXSA-N 375.553 5.407 30 20 GKED O=C(O)c1ccc2scc(/C=C3\Cc4c(Br)cccc4C3=O)c2c1 1777685777 WVDRCPAWZUNEOL-IZZDOVSWSA-N 399.265 5.184 30 20 GKED CCCCOc1c(Cl)cc(C(=O)Nc2ccc(CC#N)cc2)cc1OCC 8126545 XNWXIENOCPQKKN-UHFFFAOYSA-N 386.879 5.236 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2ccccc2Cl)n(Cc2ccco2)c1C 18709016 BFWVXCBJLWCANI-UHFFFAOYSA-N 399.903 5.002 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1ccc(NC(=O)Nc2ccccc2)cc1 23738919 UBSKYBYZGYCMRJ-UHFFFAOYSA-N 391.496 5.221 30 20 GKED CC(C)c1c(C(=O)N[C@H](C)c2ccc(C#N)cc2)cnn1-c1cccc(Cl)c1 26133250 YOTUOJBPJGVGOQ-OAHLLOKOSA-N 392.890 5.012 30 20 GKED O/C(=N\c1nnc(C(F)(F)F)s1)c1sc2cc(F)ccc2c1Cl 31564853 OGNRPAIEGANZOF-UHFFFAOYSA-N 381.763 5.200 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cc1nnc(-c2ccc(Cl)cc2Cl)o1 63299741 WCRQOARIQGHJGK-UHFFFAOYSA-N 399.281 5.103 30 20 GKED Cc1[nH]c2ccc(CNC(=O)c3ccccc3-c3ccccc3C#N)cc2c1C 65119248 WVTWCBDPVMPOFP-UHFFFAOYSA-N 379.463 5.253 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)Cc1ccc(C(F)(F)F)cc1 65473458 HHRWXJSOTBKKQL-UHFFFAOYSA-N 391.393 5.028 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1oc2ccccc2c1CSc1ccccc1F 66917454 HSLARZGSUMQBMX-CQSZACIVSA-N 382.460 5.096 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@@H](C)CC)cc2)nnc1-c1ccco1 71833691 XLUJZXOAUXXYOI-HNNXBMFYSA-N 381.501 5.213 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccccc1 108357250 IKNCNYZDZBAWSE-HTAPYJJXSA-N 381.545 5.006 30 20 GKED Cc1cccc(C(=O)Nc2nc(-c3cccc(C#N)c3)cs2)c1Br 153003967 ZXJBFXQSZCMVNN-UHFFFAOYSA-N 398.285 5.005 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1)c1ccccc1 155011576 RIQJGAGHPHEVNH-FQEVSTJZSA-N 389.455 5.361 30 20 GKED N#C[C@@H](C(=O)c1ccc(Cl)c(C(F)(F)F)c1)c1ccc(C(F)(F)F)cn1 156280855 SBKHQSHLAOCTRQ-SNVBAGLBSA-N 392.686 5.263 30 20 GKED C#CCN(Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1)C1CCCC1 166379778 CGRIXUPUITWMED-UHFFFAOYSA-N 395.572 5.131 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)COc1c(Cl)cccc1Cl 170985979 YNYWNBROZBJKKV-GFCCVEGCSA-N 395.311 5.263 30 20 GKED CCN(Cc1ccccc1NCc1ccc(-c2ccccc2C#N)cc1)C(C)=O 178272369 JNMQBJXLNUFUOU-UHFFFAOYSA-N 383.495 5.206 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(CCc1ccccc1)Cc1ccccc1 184342802 SGJZOLRZTVTCJS-HXUWFJFHSA-N 399.494 5.254 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 184578404 SFNJNEXNNMDBQU-JTSKRJEESA-N 398.466 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1cc(Br)ccc1F 189907538 LCERPKHBVVGOMX-UHFFFAOYSA-N 390.296 5.621 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCOCC(F)(F)C(F)(F)F 190902957 CQERHCVRNPYSTB-UHFFFAOYSA-N 379.369 5.081 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2cccc(OC)c2)C1 191433056 YUPWXXYNYRJQFE-QFIPXVFZSA-N 394.515 5.153 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCO)[C@H]1CCCc2ccccc21 191444290 HSNLDPUWRHMWBF-QHCPKHFHSA-N 392.543 5.442 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1nc(-c2cn(CCC#N)c3ccccc23)cs1 193744737 KZEGMSFTJCUXIN-AWEZNQCLSA-N 396.516 5.264 30 20 GKED Cc1csc([C@@H](C#N)C(=O)CSC(c2ccccc2)c2ccccc2)n1 194844870 SOEBYWRXCXEEJO-SFHVURJKSA-N 378.522 5.151 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(Cl)nc3Cl)o2)cc1 195501682 AXPXJLKLSGNFMW-UHFFFAOYSA-N 394.283 5.296 30 20 GKED CC(C)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 236789681 LAHFOZJGAQIZIS-YWZLYKJASA-N 376.422 5.483 30 20 GKED Cc1ccc(N=C(O)CC/N=C(/O)C23CC4CC(CC(C4)C2)C3)c2[nH]ncc12 328779598 IXTUJYZAEKEPKN-UHFFFAOYSA-N 380.492 5.022 30 20 GKED CC1(C)CN(C(O)=Nc2cc3c(cc2Cl)OCCCO3)[C@@H]1c1cccs1 329370288 LWAONYFKVWHTRR-QGZVFWFLSA-N 392.908 5.191 30 20 GKED C[C@@H](N[C@H]1c2ccccc2CC12CCOCC2)C(O)=Nc1ccccc1Cl 329776501 JZALTMAHZRUFLD-QRWLVFNGSA-N 384.907 5.000 30 20 GKED C[C@@H]1Sc2ccc(C(O)=Nc3ccccc3N3C[C@H]4CC[C@H]3C4)cc2N=C1O 329839301 JEBMFVHLKSCILI-DZKIICNBSA-N 393.512 5.394 30 20 GKED Cc1ccc(-c2nc(NC(=O)c3cccc(SCC#N)c3)sc2C)s1 430954450 FNZAJFNKTIACEX-UHFFFAOYSA-N 385.539 5.356 30 20 GKED N#CCCCN1C(=O)CCc2cc(NCc3csc(Cl)c3Cl)ccc21 432260572 VETAIWZKQIVPSM-UHFFFAOYSA-N 394.327 5.250 30 20 GKED Cc1cc(NC(=O)N2CCC(C#N)CC2)ccc1-c1ccc(Br)cc1 432525427 HMXLDAZMFBQHKW-UHFFFAOYSA-N 398.304 5.192 30 20 GKED CCc1ccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)cc1 433144506 MNFADGUROKRQFY-XLIONFOSSA-N 393.556 5.665 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C2(c3ccccc3F)CC2)cc1F 437473247 GUZPSUOBCNFFBV-UHFFFAOYSA-N 390.389 5.299 30 20 GKED N#CCC[C@H](NC(=O)Nc1ccc(OC(F)F)c2ncccc12)c1ccccc1 439305474 KDFICEITCISWAM-INIZCTEOSA-N 396.397 5.003 30 20 GKED CC(C)[C@H](Cc1ccc(F)cc1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 440251033 ANAXTWWRMXKZRZ-YADHBBJMSA-N 381.495 5.079 30 20 GKED N#Cc1cnc2c(F)cc(F)cc2c1N[C@@H]1CCCc2cn(C3CCCC3)nc21 445596691 KNANPWRTCICGAJ-LJQANCHMSA-N 393.441 5.186 30 20 GKED COc1ccccc1NC(=O)c1ccc(NCC#Cc2ccccc2Cl)cc1 447002797 BQNSDBZUDLBXLC-UHFFFAOYSA-N 390.870 5.065 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)nn1C(C)C 453594791 GCGFEQHIUZKHTD-OAHLLOKOSA-N 384.892 5.039 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(c2cccc(Cl)c2)C1 454757655 JQHSJZQIXGLNLL-CQSZACIVSA-N 385.920 5.366 30 20 GKED C=C(C)Cn1c(COCC)nnc1N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 460944462 RJBGNDVLPOAMLQ-KRWDZBQOSA-N 395.334 5.039 30 20 GKED C[C@@H](C(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1cccc(C#N)c1 461802274 JLQWWOCZYNPWCQ-WZONZLPQSA-N 393.490 5.091 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC(=Cc3ccccc3F)CC2)cc1 465161682 ASKLIAVESINNRT-UHFFFAOYSA-N 377.463 5.338 30 20 GKED C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)NCCc1cccc(C#N)c1 466811339 GMAHMKHQBBWLIJ-SFHVURJKSA-N 389.524 5.135 30 20 GKED N#C[C@@H](C(=O)c1csc(Cl)c1)c1nc(-c2c(F)cccc2F)cs1 467277259 HFOSKLDFZDZZQC-VIFPVBQESA-N 380.828 5.293 30 20 GKED N#C[C@H]1N(C(=O)c2cc(-c3ccccc3)ccc2Cl)CCC[C@]12CCCCO2 468119971 JTTDXOWEROKNHA-FYYLOGMGSA-N 394.902 5.074 30 20 GKED C[C@H](Oc1cccc2ccccc12)C(=O)Nc1ccccc1SC[C@H](C)C#N 469407428 FRNUGDHYFHZAAW-SJORKVTESA-N 390.508 5.498 30 20 GKED C=C(C)CN(CCC(=O)Nc1ccccc1C(F)(F)F)Cc1ccccc1 470909133 NVJSFOGVWFVFGR-UHFFFAOYSA-N 376.422 5.112 30 20 GKED CC[C@H](C)Sc1ccc(NCc2nnc(-c3ccc(C#N)cc3)o2)c(C)c1 471629575 QHWFDITZDZIZAA-HNNXBMFYSA-N 378.501 5.419 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccnn2Cc2cccc3ccccc23)cc1 475531456 QTDIEDSGJWXRCV-UHFFFAOYSA-N 394.478 5.138 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H](c1cccs1)N1CCCC1 475556790 STFUKEPENXQWMB-HXUWFJFHSA-N 397.588 5.559 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccccc1)C[C@](C)(O)CC 475571112 DSYUKBIJAXILCC-RUZDIDTESA-N 394.559 5.734 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)COc1ccc(Cl)cc1Cl 476078300 HIPSIDKKKRMJMI-UHFFFAOYSA-N 378.299 5.863 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1ccc2ncsc2c1 485699879 IKEOVTDFKBNELJ-QGZVFWFLSA-N 399.519 5.598 30 20 GKED N#Cc1ccc(Br)c(CN[C@H](c2ccccc2)c2ccc(F)cc2)c1 492515455 QOLOFPNBEUUFSK-OAQYLSRUSA-N 395.275 5.339 30 20 GKED CSc1cc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)ccc1F 500449736 HLXCIPJSUGRFFR-OAHLLOKOSA-N 382.485 5.470 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3cc(Cl)cc4cccnc34)n2)c1 501149923 JAKBCUDOEDNLBX-UHFFFAOYSA-N 390.855 5.136 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CC[C@H](c2cccc(F)c2)C1 504137608 AJBQYWBNRDBLQI-UNMCSNQZSA-N 398.526 5.027 30 20 GKED Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)Sc2nc3cc(C)ccc3o2)c1 504570546 LAGKNZRYRUQEAW-QGZVFWFLSA-N 393.512 5.181 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cccc(F)c1)C[C@H]1CCCO1 505035139 JXGHMKOQZZPAAZ-OAQYLSRUSA-N 382.479 5.157 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccc(C(F)(F)F)nc2)cc1 507893782 ZDINTDUZPAQEQL-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@H](NC(=O)CC(C)(C)C#N)c1ccc(-c2ccc(C(F)(F)F)cc2)s1 508458802 SAUVUFBKUXQKLS-LBPRGKRZSA-N 380.435 5.551 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc3c(s2)C[C@@H](c2ccccc2)CC3)c1 508687421 DYGWGSSCCJAASG-HNNXBMFYSA-N 393.899 5.193 30 20 GKED C=CCSCCNC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 509188783 ZSBVVWHRRLETMT-GOSISDBHSA-N 399.560 5.231 30 20 GKED CCN(C(=O)c1cccc(C#N)c1C)[C@H](c1ccc(Cl)cc1)c1ccccn1 509431415 UHJQYSNPKDECBS-JOCHJYFZSA-N 389.886 5.167 30 20 GKED C=CCN1C(=O)c2ccccc2N[C@H]1c1cc(C)c(OCc2ccccn2)c(C)c1 510878651 KDGWZCTVQKIQGU-XMMPIXPASA-N 399.494 5.030 30 20 GKED N#CCCN(Cc1ccccn1)Cc1ccc(-c2cccc(Br)c2)o1 513736819 MOFNWUXYJNAYID-UHFFFAOYSA-N 396.288 5.020 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(OCC4CC4)cc3)n2)cc1 516710851 XHZSQPDRVOKOGI-HXUWFJFHSA-N 388.492 5.397 30 20 GKED C[C@H](C#N)CN(C)C(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 518028733 HCFIUHJPRYXHJU-CYBMUJFWSA-N 393.339 5.517 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1ccc2c(c1)CCC2 519413416 UZCGOJFIHJGZOL-HNNXBMFYSA-N 382.554 5.158 30 20 GKED CC(C)COc1ccccc1CNC(=O)Nc1ccccc1SC[C@@H](C)C#N 521260332 BUMWDUILHBWBOA-KRWDZBQOSA-N 397.544 5.295 30 20 GKED Cc1nc(C)c([C@H](C)N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)s1 521646358 PRVHHKYLAQVVFF-HNNXBMFYSA-N 391.496 5.257 30 20 GKED C=CCOc1cc(OC)ccc1C(=O)Nc1ccc2nc(C(F)F)sc2c1 521988951 VJRAUKXGZFNTRH-UHFFFAOYSA-N 390.411 5.060 30 20 GKED CCCc1nc(C)c(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)s1 524388217 QAOMTOWWTSAUNA-UHFFFAOYSA-N 391.496 5.107 30 20 GKED CO[C@H](C)CN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(C)C 525417039 SVKYWPUCWKDVLE-UZLBHIALSA-N 399.922 5.273 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C1CC1 532810851 WWQZMEQHKPRUGW-FOIQADDNSA-N 392.890 5.151 30 20 GKED COC1CCC(N(C)C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)CC1 536394049 GDHALSJFJKIWPU-UHFFFAOYSA-N 398.890 5.034 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(C(=O)OC(C)(C)C)cc1 539940468 IAJHLVDQUIAMIB-OAHLLOKOSA-N 396.512 5.146 30 20 GKED Cc1ccc(-c2ccc(C(=O)N3CCC[C@H]3[C@H](C#N)c3ccccc3)s2)o1 541035917 HRVUKORLBHAAEX-MSOLQXFVSA-N 376.481 5.229 30 20 GKED N#CCC1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CC1 541973639 LKCFAIQQHNZIIR-UHFFFAOYSA-N 394.862 5.162 30 20 GKED COc1ccc([C@@H](CCC#N)NCC[C@@H](c2ccccc2)C(F)(F)F)cc1 556221292 LPNVCBDRWQHRHH-VQTJNVASSA-N 376.422 5.366 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1ccncc1F 559841996 DJFBDJJBQZZGGK-MEBBXXQBSA-N 380.307 5.584 30 20 GKED Cc1c(C(=O)Nc2ccc(F)cc2OCC2CC2)sc2ccc(C#N)cc12 559960203 SKCGTWODMZCBKQ-UHFFFAOYSA-N 380.444 5.262 30 20 GKED N#Cc1ccc(OC2CCN(C(=O)Nc3cccc(C4CCC4)c3)CC2)c(F)c1 564684481 UVNBNGCBMOZBAH-UHFFFAOYSA-N 393.462 5.040 30 20 GKED CC(C)c1cc(C(=O)[C@@H](C#N)c2nccc3ccccc23)c2cnn(C(C)C)c2n1 567815442 PZFRRRWDUUTAAD-IBGZPJMESA-N 397.482 5.174 30 20 GKED Cc1c(C(=O)Nc2ccccc2CC#N)oc2c(C)cc(Br)cc12 574194280 XMCPHPNRPSMSBH-UHFFFAOYSA-N 383.245 5.131 30 20 GKED CCCN(C(=O)CC1(C#N)CCOCC1)[C@H](C)c1ccc(Cl)c(Cl)c1 597280100 XNDFECALKYNCTK-CQSZACIVSA-N 383.319 5.003 30 20 GKED C[C@]1(C#N)CCN(C(=O)c2oc3ccccc3c2CSc2ccc(F)cc2)C1 598417048 XSROJCWFRNLQIN-JOCHJYFZSA-N 394.471 5.240 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cncc2ccccc12 603957744 KPJMFZWFIJXRSJ-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1ccccc1C#N 604009942 GUMRGZRGJYMSOK-IYBDPMFKSA-N 381.907 5.227 30 20 GKED C[C@H]1CCCC[C@H]1CC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 604441505 HUOHUGPAAZSQRW-ICSRJNTNSA-N 376.500 5.487 30 20 GKED Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2CNCc2cccc(C#N)c2)c1 608982315 PHNWVUOLBNXKDH-UHFFFAOYSA-N 396.469 5.148 30 20 GKED N#C[C@H](NC(=O)c1cc2cc(Cl)ccc2o1)c1ccc(Cl)c(Cl)c1 609463633 OYUPGWCCQQZJEO-AWEZNQCLSA-N 379.630 5.388 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1nc(-c2ccccc2)no1)c1cccc(C#N)c1 610778438 YFTCIGAVWOVLBS-VGSWGCGISA-N 380.451 5.048 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21 618758695 FLNWDWJDAWVKQZ-NRFANRHFSA-N 379.529 5.317 30 20 GKED Cc1cc(C(=O)Nc2ccc(C(F)(F)C(F)(F)F)cc2)c(C(F)(F)F)o1 681133606 CADWAHOPWDKHIP-UHFFFAOYSA-N 387.226 5.513 30 20 GKED COc1ccccc1/C(C)=C/C(=O)Nc1ccc(Oc2ncccc2C#N)cc1C 727302559 MBHOQJIPVKMACB-JQIJEIRASA-N 399.450 5.105 30 20 GKED C[C@@H](CN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 727589076 HURFPOMSHHUUAS-CYFREDJKSA-N 383.495 5.609 30 20 GKED CC(C)(C)Sc1ccc(NC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)cc1 728168998 ORBHPLSPWITNFL-FQEVSTJZSA-N 379.529 5.056 30 20 GKED C=CC[C@H](NC(=O)c1cc(-c2ccc(C)o2)nc2ccccc12)c1ccncc1 734458270 XKUBDCIIVVFXES-FQEVSTJZSA-N 383.451 5.245 30 20 GKED N#CCOc1ccc(Cl)cc1CN(Cc1ccccc1C(F)(F)F)C1CC1 735308851 VVJDFWRVTIJIIA-UHFFFAOYSA-N 394.824 5.426 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)Nc3ccc4ncsc4c3)c2)s1 740434557 DOPQHBAUIUUYTK-UHFFFAOYSA-N 390.493 5.218 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 743447397 OKRCIBUIPCQUAC-ILCZHQDMSA-N 376.456 5.537 30 20 GKED COc1ccc(CNC(=O)N(C)[C@@H](C)c2ccc(-c3ccccc3)cc2)cc1C#N 746775715 OZYIHEBHJRRRMK-SFHVURJKSA-N 399.494 5.136 30 20 GKED FC(F)(F)c1ccccc1C=NOCc1coc(-c2ccc(Cl)cc2)n1 749353392 QICBAPXSFBLBKX-UHFFFAOYSA-N 380.753 5.565 30 20 GKED O=C(/C=C/c1cncc(F)c1)O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 750207440 SPCMQVZVBLOYQT-RGDDUWESSA-N 393.258 5.100 30 20 GKED CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1C(C)C 753442833 IGSCOYYDSHEYDJ-OAQYLSRUSA-N 399.494 5.557 30 20 GKED C#CC[C@H](NC(=O)c1cc(NC(=O)CC(C)(C)C)ccc1Cl)c1ccccc1 757621558 HAEXFAGMJMMRFB-FQEVSTJZSA-N 396.918 5.209 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(-c3ccc(C4(C#N)CC4)cc3)n2)cn1 762348267 GLHIJWJLCQGIFB-UHFFFAOYSA-N 376.485 5.244 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 773100960 HHXMGMMHFQQZMS-YYDVJCTNSA-N 385.935 5.636 30 20 GKED N#C[C@@H](C(=O)COc1ccc(-c2ccccc2)cc1)c1ccc2ccccc2n1 780302241 NCEHFRUZDFZURV-JOCHJYFZSA-N 378.431 5.157 30 20 GKED COc1cc(C(=O)/C=C\c2ncc(C(F)(F)F)s2)ccc1SC(F)F 788353585 ANCSILKLXYQERQ-HYXAFXHYSA-N 395.374 5.381 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)ccc1-c1ccc(F)cc1 797569585 SOQDRAUCBSKUFU-OAHLLOKOSA-N 381.476 5.075 30 20 GKED CCOC(=O)Oc1ccc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 799909921 RVISDOJPLNJFPD-UHFFFAOYSA-N 398.484 5.066 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1ccc(Cl)cc1Cl)c1ccccc1 814209996 JFIRPXCABBOPKD-MRXNPFEDSA-N 378.328 5.715 30 20 GKED C=CCC(C)(C)c1noc([C@@H](C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)n1 815706461 KBQPMHKQCPROFI-DOTOQJQBSA-N 385.508 5.293 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)c(OC)c1OC 818259472 DNVAVYXDGQPDGL-ZRDIBKRKSA-N 380.465 5.337 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1CN(CC)C(=O)OC(C)(C)C 821196689 WKQAPSMHCHIYML-KDURUIRLSA-N 399.535 5.159 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1SCCC(F)=C(F)F 863239654 JFMXNANOWYFBHT-UHFFFAOYSA-N 389.830 5.256 30 20 GKED C=CCN(C(=O)c1cc2c(F)cccc2s1)c1nc(-c2ccccc2)cs1 895538011 GMVBZDSRCICVJL-UHFFFAOYSA-N 394.496 5.997 30 20 GKED C=CCOc1ccc(C(=O)OCC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1 913359240 AXKWHNOWYSAFGB-UHFFFAOYSA-N 395.499 5.294 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 915351703 BIMILSNKRCRYCG-QFIPXVFZSA-N 389.886 5.659 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2ccccc2)cc1 915352341 GYVSXDJHWOUJQZ-RPWUZVMVSA-N 381.479 5.711 30 20 GKED Cc1cc(C=Nn2c(S)nnc2[C@H]2CCCO2)c2c(C)ccc(C(C)C)cc1-2 916367605 IJRBWBDCXNBPQV-LJQANCHMSA-N 394.544 5.146 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cccc(C(F)(F)F)c2)cc1 916946956 BQCKAOSPUUQAPM-SCLBCKFNSA-N 388.389 5.180 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1OC 917605482 VNBCNDFBVQMLSG-VQHVLOKHSA-N 395.436 5.237 30 20 GKED CC(=NNc1cccc(C(=O)O)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 1776036831 BQMNJOMRJYFECG-UHFFFAOYSA-N 390.283 5.259 30 20 GKED O=C(O)c1ccc2[nH]cc(/C=C\C(=O)c3ccccc3OCc3ccccc3)c2c1 1776126707 UYKFUZDZMVUXLN-QBFSEMIESA-N 397.430 5.341 30 20 GKED CC(C)Oc1cc(Cl)c(/C=C\C(=O)c2cc(C(=O)O)ccc2O)cc1Cl 1776353706 WTNNXPKAKJXNIG-HYXAFXHYSA-N 395.238 5.081 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC(F)(F)F)c(Cl)c1 1776784279 ZXEOUKYTUYVWJP-AWEZNQCLSA-N 395.849 5.532 30 20 GKED CCCCCCCOc1cccc(CNc2ccc(OCCC(=O)O)cc2)c1 1776787604 PGRZFPTYRYPQIZ-UHFFFAOYSA-N 385.504 5.501 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CCC(=O)O)c2ccccc2)c1 1776787964 KIUDPEFWXWMJSE-HSZRJFAPSA-N 383.532 5.732 30 20 GKED CN(Cc1cccs1)c1ccc(/C=C/C(=O)c2csc(C(=O)O)c2)cc1 1777077175 AJRRXDYCAQJNFU-RMKNXTFCSA-N 383.494 5.040 30 20 GKED COc1cc2ccc(C(=O)/C=C/c3ccc(C(=O)O)cc3Cl)cc2cc1OC 1777343283 IZPPLSIUFHPROU-BQYQJAHWSA-N 396.826 5.105 30 20 GKED N#C[C@H](C(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1nc2ccccc2o1 66516417 DBVXGODBTNTTAJ-LLVKDONJSA-N 399.884 5.085 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1csc2ccccc12 66954778 KHIVHELLSYYYRH-HNNXBMFYSA-N 395.553 5.959 30 20 GKED Cc1ccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66955752 NECKWYMCTBTBHZ-YLJYHZDGSA-N 379.529 5.758 30 20 GKED Cc1cc(C(=O)N(CCC#N)Cc2ccccn2)sc1-c1cccc(Cl)c1 103438912 UNWFHDKFWYOTPS-UHFFFAOYSA-N 395.915 5.328 30 20 GKED N#C[C@H](C(=O)[C@H](Sc1ccc(F)c(Cl)c1)c1ccccc1)c1ccccn1 106983688 COQFENGDIVLXPH-HRAATJIYSA-N 396.874 5.584 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COCc2ccccc2)cc1Cl 107875246 UOQPIGKDIPHJKS-OAQYLSRUSA-N 390.870 5.151 30 20 GKED O=C(N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1ccc(F)cc1C(F)(F)F 159898117 ACAHWGPZMVJABN-ZDUSSCGKSA-N 383.238 5.017 30 20 GKED Cc1ccc([C@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1[N+](=O)[O-] 176992937 IMRBJBMXXQKFAK-CABCVRRESA-N 398.488 5.180 30 20 GKED Cc1nc(CSc2ccccc2C(=O)Nc2cccc(C#N)c2C)cs1 178402853 UTRRZEOMLQONBR-UHFFFAOYSA-N 379.510 5.176 30 20 GKED COCCc1ccccc1NC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 188217555 JXDOEXDDKNFRBT-UHFFFAOYSA-N 386.451 5.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)C[C@@H](O)c1ccc(F)cc1 191517186 FETZLRMJZNMFHB-IIBYNOLFSA-N 384.495 5.311 30 20 GKED CC[C@H]1CCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 193771362 YCABVQDGAVTCOV-FQEVSTJZSA-N 377.488 5.128 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(OC(F)(F)F)cc2)c1 207592869 HBSAXUAWHNMBSI-WDZFZDKYSA-N 375.346 5.164 30 20 GKED COc1ccc([C@H](NCc2ccc(O[C@H](C)C#N)cc2)c2ccc(F)cc2)cc1 237362364 DZULLNZCZCZIHK-MZNJEOGPSA-N 390.458 5.004 30 20 GKED C[C@@H](c1ccccc1)N(CCCC1(C#N)CCOCC1)Cc1ccccc1O 282061279 SETAZODDOAAQNP-FQEVSTJZSA-N 378.516 5.056 30 20 GKED Cc1cc(Br)ccc1NC(=O)c1ccccc1-c1ccccc1C#N 302543163 VKBRGBHXJVFGPA-UHFFFAOYSA-N 391.268 5.549 30 20 GKED CCN(C(=O)c1cc(-c2cccc(Cl)c2)no1)[C@H](C)c1ccc(C#N)cc1 302971820 BIABELLCDJCUCI-CQSZACIVSA-N 379.847 5.090 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N3CC=C(c4ccc(F)cc4)CC3)c2)cc1 303201112 OHBCNGKWYDAKPB-UHFFFAOYSA-N 398.437 5.419 30 20 GKED O/C(CCc1nnc(-c2ccc(Cl)cc2)o1)=N/[C@@H]1CC[C@@H]2CCCC[C@H]2C1 329877884 JXNAVSXHMHONKI-QILLFSRXSA-N 387.911 5.638 30 20 GKED CC(O)=Nc1ccc(N=C(O)N2CCCC3(CCCCC3)CC2)c(Cl)c1 329944689 IOHDXFBDOLXHFM-UHFFFAOYSA-N 377.916 5.930 30 20 GKED COc1ccccc1Oc1ccc(NC(=O)N(CCC#N)CCC(C)C)cc1 429244515 LFTSEUJPGINLQT-UHFFFAOYSA-N 381.476 5.281 30 20 GKED Cc1c(C(=O)Nc2ccc(C#N)cc2Cl)oc2ccc(Br)cc12 430359620 NWEHAMONJZTHLG-UHFFFAOYSA-N 389.636 5.281 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(OC(F)F)cc1 431775930 LAGIMYYKTPDUAY-KXBFYZLASA-N 387.430 5.083 30 20 GKED COCCC1(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCC1 431901519 IWJTYCHZFRCCNZ-IBGZPJMESA-N 397.906 5.076 30 20 GKED C[C@H](NC(=O)CN[C@H](CCCC#N)c1ccccc1)c1ccc2ccccc2c1 433023263 OGHMBBWUPSXMNX-YADARESESA-N 385.511 5.042 30 20 GKED COc1ccccc1C[C@H](C)N(Cc1ccccc1)C(=O)Nc1cccc(C#N)c1 437643771 CPIGRVHWGKLSDD-IBGZPJMESA-N 399.494 5.232 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3ccc(C#N)cc3Cl)o2)cc1 438905161 WHDZYNWCTDXSQK-UHFFFAOYSA-N 383.860 5.119 30 20 GKED C[C@@H]1CCC[C@](C#N)(NC(=O)c2[nH]ccc2-c2c(Cl)cccc2Cl)C1 442710020 BBJWEASHNGMSRA-BLVKFPJESA-N 376.287 5.191 30 20 GKED C[C@H]1CCN(C(=O)Nc2cccc(CC#N)c2)[C@@H]1c1ccc(C(F)(F)F)cc1 455907124 OVGXLAASRDTOSJ-LIRRHRJNSA-N 387.405 5.386 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1cc(Br)ccc1Cl 461664169 MAPKMDSABKCYLA-UHFFFAOYSA-N 392.684 5.048 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@H](C)c1cccc(C#N)c1 462039380 OCAISYRTMYSLMR-RTBURBONSA-N 384.479 5.749 30 20 GKED C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)c1ncc(C#N)cc1Cl 462580264 OXNFEVQRVCHIDP-INIZCTEOSA-N 375.859 5.010 30 20 GKED N#C[C@H](C(=O)c1cc(F)cc(Cl)c1)c1nc(-c2c(F)cccc2F)cs1 465418814 UYJWXELGDQZXCW-GFCCVEGCSA-N 392.789 5.371 30 20 GKED C=C(C)C[C@H](C)C(=O)NCc1ccc(Oc2ccccc2C(F)(F)F)nc1 466762554 BLJKRWOSCRHVEH-AWEZNQCLSA-N 378.394 5.111 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CC[C@@H](c2ccc(F)cc2)C1 471280462 UKVZGQGCWDFJBX-SUMDDJOVSA-N 397.519 5.678 30 20 GKED N#Cc1ccc(-c2nnc(CNc3ccc(CCCc4ccccc4)cc3)o2)cc1 471687937 YXDXMEBXTCNJAX-UHFFFAOYSA-N 394.478 5.396 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccccc1C(F)(F)F)C1CC1)c1ccccc1 474696475 REKTXMNBPJXDDR-QGZVFWFLSA-N 386.417 5.284 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cccc(N=c2ccc(C)n[nH]2)c1 476772329 JDXYTGRRCUFUTI-UHFFFAOYSA-N 386.499 5.055 30 20 GKED COC(=O)[C@@H](Nc1ccc(C(C)(C)C#N)cc1)c1ccc(Cl)c(Cl)c1 479457099 QLOBACDISQHITH-KRWDZBQOSA-N 377.271 5.121 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1C[C@H](C)[C@H]1c1ccccc1 480821134 GWMVCVONEXDZJQ-UUOWRZLLSA-N 397.478 5.884 30 20 GKED C=C(C)[C@@H](N[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccc(F)c(F)c1 481591171 FVVAKPDFLINPAQ-KZULUSFZSA-N 389.833 5.636 30 20 GKED Cc1sc(NC(=O)c2ccc(Oc3ccc(F)cc3F)cc2)c(C#N)c1C 481926026 UUVMDMZUESRUMY-UHFFFAOYSA-N 384.407 5.559 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 482339398 UWHGJLYWUDCGRY-IRXDYDNUSA-N 395.812 5.288 30 20 GKED Cc1ccc(C(C)(C)C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 482823406 ZOIFYAXSCXAQAH-UHFFFAOYSA-N 385.467 5.279 30 20 GKED Cc1nc(C(F)(F)F)c(CSc2nc(C(F)(F)F)ccc2C#N)s1 488779899 GMHMIZXBDXFHIZ-UHFFFAOYSA-N 383.342 5.048 30 20 GKED CCN(C(=O)c1cccc(CC#N)c1)[C@@H](c1ccc(Cl)cc1)c1cccnc1 496519536 SFMNZTXJJBZMCR-QFIPXVFZSA-N 389.886 5.053 30 20 GKED Cc1cc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(F)cc1Br 497445131 WGLHBGKWMPVYJU-INIZCTEOSA-N 390.256 5.063 30 20 GKED Cc1nc(NC(=O)c2cccc(Oc3ccccc3)c2)sc1SCC#N 504699359 GUMMLSANTIRUAR-UHFFFAOYSA-N 381.482 5.112 30 20 GKED N#Cc1ccc(NC(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)cc1Cl 509511284 VTQOZDLUOOOVJV-OAHLLOKOSA-N 385.748 5.166 30 20 GKED CCCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@@H](C)c1ccccc1OC 510615083 LLQGKRJDXHDVDX-INIZCTEOSA-N 382.508 5.128 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 514504041 FXAVNGQDQIMSRP-UHFFFAOYSA-N 378.472 5.338 30 20 GKED Cc1cc([C@@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)on1 517905419 BZQCIEKRXSQXMR-FQEVSTJZSA-N 388.427 5.016 30 20 GKED CC(C)Oc1ccccc1[C@H](C)NC(=O)Nc1ccccc1S[C@H](C)CC#N 518256208 PYHCDGLEUQHGRV-SJORKVTESA-N 397.544 5.751 30 20 GKED C[C@H](NC(=O)Nc1cc(Cl)ccc1N1CCCCC1)c1ccc(C#N)cc1 518828009 HSWOBVBGXCLBLE-HNNXBMFYSA-N 382.895 5.085 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1c(Cl)cccc1Cl 520855386 LCIPEUDHCVWWPK-LBPRGKRZSA-N 394.327 5.567 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2nc(-c3cccc(F)c3)cs2)c1 521953268 YNRFGIHTWVNDJL-UHFFFAOYSA-N 395.459 5.009 30 20 GKED N#CC1(C(=O)Nc2ccc(Oc3ccnc4cc(Cl)ccc34)c(F)c2)CCC1 522882556 FKSWMSWCYJBKGJ-UHFFFAOYSA-N 395.821 5.452 30 20 GKED C=CCCCN(C)C(=O)c1cc2c(C)nn(Cc3ccccc3Cl)c2s1 522995396 PITAAKKUNHSYFW-UHFFFAOYSA-N 387.936 5.146 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc(F)cc3Cl)cc2F)c1 524455388 UAVYRUKUVDXGFF-UHFFFAOYSA-N 398.796 5.321 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Nc1ccc(F)cc1OCC1CC1 524896261 OCMOJPRKJOHHOY-AWEZNQCLSA-N 399.491 5.510 30 20 GKED CC[C@@H](c1ccccc1)N(CC)CC(=O)Nc1ccccc1SC[C@@H](C)C#N 533256205 DTLRLAPMDWDFTM-RXVVDRJESA-N 395.572 5.350 30 20 GKED C=CCn1c(S[C@H](C)c2nc3ccccc3o2)nnc1-c1cccc(OC)c1 539759681 NYKVZSJBGSVJKS-CQSZACIVSA-N 392.484 5.134 30 20 GKED C[C@@H](NCc1cc(F)cc2cccnc12)c1ccc(-c2cccc(C#N)c2)cc1 542945922 ZRVFWUJRRRIQGC-QGZVFWFLSA-N 381.454 5.763 30 20 GKED CC[C@@H](CC(F)(F)F)N[C@@H](C)c1ccc(OC(F)F)cc1OC(F)F 544832012 HNWHKJYUQMJPQL-IUCAKERBSA-N 377.300 5.271 30 20 GKED CC(C)(C)c1cnc(CCC(=O)N(Cc2ccccc2)c2ccccc2C#N)o1 548932798 DSFNAJJKGGBPQW-UHFFFAOYSA-N 387.483 5.010 30 20 GKED CCCN(C(=O)c1ncc(C#N)cc1C)[C@H](C)c1ccc(Cl)c(Cl)c1 556278120 JFVUHQFRPRUDFG-CYBMUJFWSA-N 376.287 5.182 30 20 GKED N#Cc1cccc(C2(NC(=O)c3ccc(-c4cccc5cccnc45)cc3)CC2)c1 556940075 SOJDCPILINLJNK-UHFFFAOYSA-N 389.458 5.193 30 20 GKED C=CCC(F)(F)c1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 559960034 LNMXBLRGBOFWAV-UHFFFAOYSA-N 397.303 5.611 30 20 GKED COc1ncc([C@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cc1Cl 560234625 JWUMFLIPCWZSQW-CVEARBPZSA-N 391.902 5.694 30 20 GKED Cn1cc(CNCc2ccc(-c3ccccc3)cc2F)c(-c2ccc(C#N)cc2)n1 573037435 VELHVNNOBGZKFH-UHFFFAOYSA-N 396.469 5.055 30 20 GKED C=CCN(CC=C)C(=O)Nc1ccc(OC(F)F)c(-c2ccc(OC)cc2)c1 579029927 WECIWVBIKZNXAE-UHFFFAOYSA-N 388.414 5.170 30 20 GKED N#CCCC[C@H](NCc1ccc(OCc2cccc(F)c2)cc1)c1ccccc1 590069310 VLEYHFPTIRRYLL-VWLOTQADSA-N 388.486 5.929 30 20 GKED C[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccc(-c2ccccc2)cn1 593620886 QSZVXXLJOZVDFK-NWLLBJEDSA-N 398.510 5.056 30 20 GKED CCSc1cccc(Br)c1NC(=O)CC1(C#N)CCCCC1 598836873 CUNXQSCCPFEWRH-UHFFFAOYSA-N 381.339 5.364 30 20 GKED C[C@@H](NC(=O)Nc1cccc(C#Cc2ccccn2)c1)c1cc2ccccc2o1 601187618 YCCAQEVGOOHQMW-QGZVFWFLSA-N 381.435 5.110 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603969041 XENVUMUTOLFBNO-UHFFFAOYSA-N 389.392 5.193 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3ccc4ccccc4c3)c2)c1 604459821 STZWHBRQZCZTTO-UHFFFAOYSA-N 378.475 5.580 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2ccc(Oc3ccc(C(C)(C)C)cc3)nc2)n1 607433194 IJJBUDRXHYNJCQ-GOSISDBHSA-N 391.496 5.426 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2cscn2)c1)c1nc2cc(F)ccc2s1 608552975 FOGYLLRYCWTCLJ-AWEZNQCLSA-N 379.441 5.049 30 20 GKED N#Cc1ccc(Oc2cccc(NCC(=O)N[C@@H](c3ccccc3)C3CC3)c2)cc1 609221147 ACSNECNAVGIDCW-VWLOTQADSA-N 397.478 5.030 30 20 GKED N#Cc1ccc(CNC(=O)NCc2ccccc2-c2ccc(Cl)cc2)c(F)c1 609240665 YOCWOJAVFMUZMX-UHFFFAOYSA-N 393.849 5.017 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc2ccccc2c1 609437309 ZUSMPHSGACLRDN-KRWDZBQOSA-N 389.524 5.898 30 20 GKED C[C@H](Sc1ccc(C#N)cc1F)C(=O)Nc1ccccc1Oc1ccccc1 610218878 FRJKLUAGZJXSSR-HNNXBMFYSA-N 392.455 5.609 30 20 GKED CCCN(Cc1ccc(C(C)(C)C#N)cc1)[C@@H](C)C(=O)Nc1ccccc1C 618778723 MKXNRUMUZBFLEI-IBGZPJMESA-N 377.532 5.035 30 20 GKED CC(C)(C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1F 624619304 OXIRIFLSJMQWPE-GDNZZTSVSA-N 399.350 5.129 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21 650182081 OKIWHWDXMIYTJT-VABKMULXSA-N 376.500 5.332 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(COc3ccc(C)cc3C)o2)cc1 726940115 ITHDGIIBTPTEGP-UHFFFAOYSA-N 388.467 5.344 30 20 GKED N#CCn1c(C(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc2ccccc21 729374712 WBBLQGFDQJFZSY-LJQANCHMSA-N 397.400 5.161 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(=O)/C=C/c3ccc4ncccc4c3)c12 730434041 LQMRQAVYSMZZKT-ACCUITESSA-N 392.462 5.228 30 20 GKED Cc1c(C(=O)/C=C/c2c(OC(F)F)ccc3ccccc23)c(C#N)c2n1CCC2 731939597 ZHJNIJMIJAEWEB-MDZDMXLPSA-N 392.405 5.265 30 20 GKED CCc1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156962 SGLPDJYNQWLDKJ-PBHICJAKSA-N 381.426 5.364 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C\C(=O)c1cccc([N+](=O)[O-])c1 740763949 JROASQHWLWIGDO-KHPPLWFESA-N 395.846 5.006 30 20 GKED Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1/C=C\C(=O)c1ccc2c(c1)COC2 742434126 CSNODSQLCDFROD-HJWRWDBZSA-N 399.277 5.414 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2ccccc2SC[C@@H](C)C#N)c1 742996907 DIPSMYHVKCHYPX-LBPRGKRZSA-N 391.949 5.409 30 20 GKED CCN(Cc1ccc(C)cc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 746660189 NRYFHEYIPYXNAJ-DEOSSOPVSA-N 383.495 5.705 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)CCCc3sccc3C)n2)cc1 748835435 YNFGAJZPYOUYCS-QGZVFWFLSA-N 380.538 5.688 30 20 GKED CC[C@H](Oc1cccc(C)c1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 750688497 DNYZDDCEGZDATQ-RDJZCZTQSA-N 384.888 5.292 30 20 GKED CC(C)c1ccc([C@@H](NC[C@H](O)c2ccc(C#N)cc2)c2cccs2)cc1 763233816 OQNPTNGHVFOFRQ-JTHBVZDNSA-N 376.525 5.156 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(SCC(F)F)cc2)c1 772986014 YYSHXFWBNNMAHV-MAUKXSAKSA-N 390.499 5.576 30 20 GKED N#CCOc1cccc(NCc2cn(-c3ccccc3)nc2-c2ccccc2)c1 779588543 NXVJLTGMOSOEKH-UHFFFAOYSA-N 380.451 5.054 30 20 GKED C=CCN(C(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)c1ccccc1 796555227 CDKALSUHUFJRKG-UHFFFAOYSA-N 392.499 5.207 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1ccc(C(F)(F)F)cc1 797569605 SZMPINARKUQIAH-IUODEOHRSA-N 394.462 5.829 30 20 GKED COc1cc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(C)cc1C 797614102 SUOYUZBNJGMDBR-NRFANRHFSA-N 385.467 5.612 30 20 GKED CSc1ccc(CCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 842804393 YWRAISRFNPKJCA-MRXNPFEDSA-N 378.419 5.021 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CCC(c3ccnc4ccccc34)CC2)cc1 854758344 OJLINQCDZPNRIL-UHFFFAOYSA-N 383.495 5.056 30 20 GKED Fc1ccc(-c2ccc(C=Nn3c(S)nnc3-c3ccccc3Cl)o2)cc1 916276639 FADYUTKWQASRLL-UHFFFAOYSA-N 398.850 5.169 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc3ccccc3s2)cc1 916914532 MXRYHEHZWDWQSG-GOSISDBHSA-N 376.481 5.205 30 20 GKED Cc1ccc(OCCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c(C)c1 917046709 MLYOBERAGMWECA-HNNXBMFYSA-N 384.888 5.212 30 20 GKED CC(C)(C)c1ccc(OCCCC(=O)[C@@H](C#N)c2nc3ccccc3o2)cc1 917510042 IYYBRFFVARNGHC-GOSISDBHSA-N 376.456 5.161 30 20 GKED Sc1nnc(SCc2ccccc2)n1N=Cc1ccc(-c2ccccc2)o1 917542683 LXVOFNBQLFUCDQ-UHFFFAOYSA-N 392.509 5.001 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)cc1 918035980 SDKZOBCWJZNZSP-DNQXCXABSA-N 399.469 5.850 30 20 GKED CC(=NNc1ccc(Br)c(C)c1)c1nc2ccccc2n1C(F)F 920480016 YWJMWPSZGZBGLK-UHFFFAOYSA-N 393.235 5.338 30 20 GKED COc1cc(/C=C/C(=O)c2sc(-c3ccc(C)cc3)nc2C)ccc1C(=O)O 1777290415 HXHUOLLLFWEXOK-YRNVUSSQSA-N 393.464 5.030 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C/c1ccc(OC(F)(F)F)c(Cl)c1 1777436054 ACAQGPXTIUBWIP-ZZXKWVIFSA-N 384.737 5.141 30 20 GKED O=C(/C=C/c1ccc(C(=O)O)s1)c1ccc(Oc2ccc(Cl)cc2)cc1 1777569691 DBYUZISGIIDJBP-PKNBQFBNSA-N 384.840 5.788 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCc4cc(F)ccc4C3=O)s2)c1 1777684332 RUIYOTSOKOTTHG-QINSGFPZSA-N 378.424 5.465 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4c(F)cccc4C3=O)s2)c1 1777684357 VAAFIJAXFSRUCP-WYMLVPIESA-N 378.424 5.465 30 20 GKED Cc1cc(C)cc(N/C(S)=C(\C(=O)c2ccc(C)s2)[n+]2ccccc2)c1 22730238 JSIXVCVONUFDFZ-UHFFFAOYSA-O 381.546 5.012 30 20 GKED COCc1cccc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)c1 45444159 QZGIMDOKXSMWOY-UHFFFAOYSA-N 388.492 5.249 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccc(Cl)c(C#N)c3)s2)c(C)c1 63574636 KJVHWPZEQBZIAP-UHFFFAOYSA-N 381.888 5.513 30 20 GKED CC(C)Oc1cccc(CC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1 66027398 MUHFQRBOAVWVOT-UHFFFAOYSA-N 386.451 5.319 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ccc[nH]c3=S)cc2Cl)c1 102791514 JEINZRLRMDUHCS-UHFFFAOYSA-N 395.871 5.101 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)CCSc2ccc(Cl)cc2)cc1 104862376 YKJYGDDHURXJQD-UHFFFAOYSA-N 388.920 5.168 30 20 GKED Cc1cccc([C@H]2CCCN2CC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108360419 DJSAKHNFLBWTEP-GHTZIAJQSA-N 393.556 5.022 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)c1ccccc1SCc1cccs1 120510649 MLEVZYMFUDLBMZ-UHFFFAOYSA-N 398.484 5.334 30 20 GKED Cc1noc(C)c1[C@H](C)NC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 127483605 OFQPIKQBUNMTOM-LBPRGKRZSA-N 395.846 5.100 30 20 GKED N#CCCN(Cc1cccnc1)Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1 159075103 UALXIMDSLRYPPV-UHFFFAOYSA-N 387.327 5.035 30 20 GKED CCCN(C(=O)Nc1ccn(CCC#N)n1)[C@H](C)c1ccc(Cl)c(Cl)c1 160573666 CSNBPEZWTMECOR-CYBMUJFWSA-N 394.306 5.109 30 20 GKED N#CCC[C@H](C#N)CSc1nnc(-c2cccc(Cl)c2)n1-c1ccccc1 163307800 UOZMBSOPRGLYLS-OAHLLOKOSA-N 393.903 5.123 30 20 GKED Cc1ccc(N2CCOC2=O)cc1NCc1ccc(-c2ccccc2C#N)cc1 174904645 SPUMZTLASMOHEU-UHFFFAOYSA-N 383.451 5.102 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@@H](C#N)C(=O)c1ccc(Oc2ccccc2)o1 176520707 USHAWQHGQLLPPY-KRWDZBQOSA-N 384.391 5.067 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)N(C)C(=O)Nc1cccc(C#N)c1C 178575851 FQGZJIQZZZJQNU-INIZCTEOSA-N 390.512 5.524 30 20 GKED N#C[C@H](C(=O)c1cccc(-c2ccoc2)c1)c1nc2ccccc2n1C(F)F 179356814 PTJYKQGBSYJJFL-MRXNPFEDSA-N 377.350 5.181 30 20 GKED CC(C)c1cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)no1 179670021 LPYRSYZGZAVLGI-UHFFFAOYSA-N 383.395 5.075 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)c3ccc(OCC#N)cc3)s2)cc1 180539127 ADWDYGRHTVEQHI-DLBZAZTESA-N 391.540 5.741 30 20 GKED CCOc1ccc([C@@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccccc2)cc1 181599790 MAKAPJFGSKICOF-CLOONOSVSA-N 386.495 5.428 30 20 GKED C[C@@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1nc2ccccc2o1 182070035 ZWIRHVROQHTJLN-GFCCVEGCSA-N 391.418 6.025 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1 184297010 VTUSLGHKSMIENW-FDDCHVKYSA-N 397.478 5.309 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(c3nc4cccc(C)c4o3)CC2)c1 190148006 VHHTWNKVIDPKLG-UHFFFAOYSA-N 391.471 5.113 30 20 GKED C[C@H](C#N)OC(=O)/C(=C\c1cccc(OCc2ccccc2)c1)c1cccs1 213832648 DFBCXFSLNWMYHB-RHTHQAGFSA-N 389.476 5.323 30 20 GKED C[C@@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 248515932 OMNMYGUBXVNOPL-MDZRGWNJSA-N 380.517 5.091 30 20 GKED Cc1occc1-c1nnc(Sc2cccc(F)c2C#N)n1Cc1ccccc1 301147898 MXFYXOOSNIPKHE-UHFFFAOYSA-N 390.443 5.057 30 20 GKED O/C(=N/[C@@H]1CCCOc2ccccc21)[C@H]1CCn2c(cnc2C2CCCCC2)C1 329484175 SFCAJCZIDHPUHB-GHTZIAJQSA-N 393.531 5.364 30 20 GKED CC(C)c1c(N=C(O)N2Cc3ccccc3C3(CC3)C2)cnn1-c1ccccc1 330186980 SNUGELQPQPEUMJ-UHFFFAOYSA-N 386.499 5.089 30 20 GKED C=CCC1(C(=O)N2CCC[C@H](Cc3csc4ccccc34)C2)CCOCC1 424786489 UDQMABHYHCFEDX-GOSISDBHSA-N 383.557 5.055 30 20 GKED C[C@@H](C1CC1)n1cc(NC(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cn1 429663910 VFZTZKSZUXKOLD-SJORKVTESA-N 399.498 5.275 30 20 GKED N#C[C@H]1CC[C@@H](Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)C1 430100171 NJZMBWZLZYBNAB-QFBILLFUSA-N 394.931 5.431 30 20 GKED CC1(C)CN(C(=O)Nc2cccc(C#Cc3ccccc3)c2)[C@@H]1c1cccnc1 432686616 LXRAJRCQCOGWFA-HSZRJFAPSA-N 381.479 5.096 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccccc1CN(C)c1ccccc1 433769927 ZLPKAIBFOCWWPR-UHFFFAOYSA-N 391.540 5.605 30 20 GKED C=CCn1c(S[C@H](C)c2cccc(OC)c2)nnc1-c1ccc(OC)cc1 435197931 LRFCNFOJIBMSED-OAHLLOKOSA-N 381.501 5.002 30 20 GKED Cc1csc(Sc2ccc(NC(=O)C3(c4ccc(C#N)cc4)CC3)cc2)n1 436063043 CVJWDQODIDCPLU-UHFFFAOYSA-N 391.521 5.145 30 20 GKED CCc1ncsc1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 437823221 QRMPJWVTXHUQFX-UHFFFAOYSA-N 383.860 5.275 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)NCC5CCC(C#N)CC5)(C4)C2)C3)cc1 441144196 JDPDVWCMAYLUPI-HEUCHTCWSA-N 390.571 5.279 30 20 GKED CCOc1cc(CNCC2CCC(C#N)CC2)ccc1OCc1ccccc1 441341587 UTXBNIDVZFKLOA-UHFFFAOYSA-N 378.516 5.084 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2nccn2Cc2ccccc2)cc1F 447344608 AWCJFIMGZSIBML-UHFFFAOYSA-N 398.441 5.347 30 20 GKED C[C@H](C(=O)N(Cc1ccccc1C(F)(F)F)CC1CC1)c1cccc(C#N)c1 462446367 PXBQEWWCDPEGLC-HNNXBMFYSA-N 386.417 5.119 30 20 GKED Cc1cccc(Oc2cc(CNc3nc(C(F)(F)F)ccc3C#N)ccn2)c1C 463010299 MIYJTJFQEJOHGT-UHFFFAOYSA-N 398.388 5.388 30 20 GKED C[C@@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)CCCC#N 463254252 DWGARJYOHQQOTQ-CRAIPNDOSA-N 391.902 5.550 30 20 GKED C[C@H](Sc1nc2c(cc1C#N)CCCC2)c1nnc(-c2ccccc2F)s1 470435806 IWAYFYXQEDSDIF-LBPRGKRZSA-N 396.516 5.343 30 20 GKED C=CCc1cc(C(=O)Nc2ccc(OC(C)C)cc2Cl)cc(OC)c1OC 474414712 OMEAPDBSIRMZIY-UHFFFAOYSA-N 389.879 5.125 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](C)Cc1ccccc1OC 475557535 YSJSAXKMVGAMKS-GOSISDBHSA-N 380.532 5.642 30 20 GKED C=CCCC1(C(=O)Nc2cc(NC(=O)C3(CCC=C)CC3)c(F)cc2F)CC1 476342152 XURWSHZEVLTDOK-UHFFFAOYSA-N 388.458 5.335 30 20 GKED C=C(C)[C@@H](NC(=O)N(CCOC)[C@@H](C)c1ccccc1)c1ccc(F)c(F)c1 477733108 ZEDCGFGMPLQLSQ-HRAATJIYSA-N 388.458 5.001 30 20 GKED CC[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(CC#N)cc1 478243857 XFWPIMKFTIOQDC-JOCHJYFZSA-N 387.527 5.115 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1ccc(C#N)cc1 480381434 SOETTXQPTYXNIU-MRXNPFEDSA-N 382.423 5.105 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)[C@H](c2ccco2)C1 481210583 WFSHZFWKJJFXHH-WBMJQRKESA-N 377.366 5.175 30 20 GKED Cc1ccc(CN(C)C)cc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 482629206 KFTJBNLHTOOUGE-UHFFFAOYSA-N 399.494 5.167 30 20 GKED CC(C)CCn1ncc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)c1C(C)C 486250690 LUNRJWFFUMHPBT-UHFFFAOYSA-N 381.524 5.498 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)c3ccc(C#N)s3)cc2c1 487571531 KCACEAKRLHIBMT-UHFFFAOYSA-N 376.437 5.110 30 20 GKED C[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)o1 499837947 JIXPAYCJBBSOEO-ZUSNOYAUSA-N 389.282 5.194 30 20 GKED C=CCc1cc(CNC(c2ccc(F)cc2)c2ccc(F)cc2)cc(OC)c1O 500159337 AZUBCMNINZBWFD-UHFFFAOYSA-N 395.449 5.287 30 20 GKED Fc1ccc(C(F)(F)F)cc1CNC1(c2cccc(C(F)(F)F)c2)CC1 500923922 VRZXGESRJNXROU-UHFFFAOYSA-N 377.303 5.642 30 20 GKED Cc1ccc(C)c(SCC(=O)N(Cc2ccco2)c2ccccc2C#N)c1 500997694 MLNROTWMEYIQKE-UHFFFAOYSA-N 376.481 5.094 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 502457464 AWUQPFADBMNNAM-UHFFFAOYSA-N 379.510 5.435 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2CCCC(F)(F)C2)cc1Cl 503993591 PTOQYNPUJKODSM-QAPCUYQASA-N 388.845 5.759 30 20 GKED CC(C)n1c([C@@H]2CCCN(Cc3cc(C#N)ccc3F)C2)nc2ccccc21 512265965 RGYVSGNJJWJVSD-GOSISDBHSA-N 376.479 5.008 30 20 GKED N#Cc1c(NC(=O)c2cccc(OC(F)F)c2)sc2c1-c1ccccc1CC2 515627561 FSKRWSMVLVWHFL-UHFFFAOYSA-N 396.418 5.239 30 20 GKED CCSc1ccc(Cl)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 517904045 DRQRYIZQZAQORL-UHFFFAOYSA-N 387.936 5.766 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1 520170802 PIDHVEZBNYXXGV-NSHDSACASA-N 381.785 5.455 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 520877417 ABFJEVKEWWXQNA-GOTSBHOMSA-N 386.451 5.066 30 20 GKED Cc1ccc(COc2c(C)cc(CN(C)C[C@@H](C#N)CCC#N)cc2C)cc1 523791407 ZSLCUNLAEXDLTN-JOCHJYFZSA-N 375.516 5.066 30 20 GKED CCN(C(=O)Nc1ccc(COC)c(C#N)c1)[C@H](C)c1cc2ccccc2o1 529211964 QUSRWZXMZQKRCT-OAHLLOKOSA-N 377.444 5.066 30 20 GKED C=CCn1c(S[C@H](CCOC)c2ccccc2)nnc1-c1ccc(OC)cc1 534057125 VHVIQCQXCGESRP-HXUWFJFHSA-N 395.528 5.010 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F 540540128 RTRRLOLVIIWMFS-GFCCVEGCSA-N 385.817 5.019 30 20 GKED Cc1ccc(-c2ccc(C(=O)[C@H](C#N)c3ccc(C(F)(F)F)cn3)s2)o1 541018843 MUKKMTGXJJAUEJ-GFCCVEGCSA-N 376.359 5.220 30 20 GKED C[C@@H](NC(=O)c1ncccc1C(F)(F)F)c1ccc(-c2cccc(C#N)c2)cc1 542003381 OTMQAMAVLDRFEL-CQSZACIVSA-N 395.384 5.130 30 20 GKED N#C[C@H](C(=O)c1cccc(CN2CCCC2)c1)c1nc2cc(Cl)ccc2s1 554002077 WQJDTESNBSXRNX-QGZVFWFLSA-N 395.915 5.036 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N(CCC#N)c3ccc(F)cc3)s2)c(C)c1 558049517 OKVNBYCBWDGMSX-UHFFFAOYSA-N 393.487 5.435 30 20 GKED N#CCCC[C@@H](NC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1 559861213 YXLHWRFUMUFQCX-HSZRJFAPSA-N 381.951 5.329 30 20 GKED O=C(Nc1ccc(OC(F)F)c(C(F)(F)F)c1)[C@@H]1CC[C@H](C(F)(F)F)C1 560686811 WBTYLZGTQAWITK-SFYZADRCSA-N 391.258 5.224 30 20 GKED C[C@@H]1CC(=O)CC[C@H]1C(=O)Nc1ccc(Sc2ccc(Cl)cc2C#N)cc1 562954291 ZKZTZTHGHCTWNC-BFUOFWGJSA-N 398.915 5.307 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H]1CCN(c2ccccc2Cl)C1 576558460 FQDIHPIMXUPUOW-HOTGVXAUSA-N 399.947 5.057 30 20 GKED C[C@@H](Oc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1)C(F)(F)F 579631859 APJQUAZDCCJJID-GDBMZVCRSA-N 376.378 5.042 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NCc2cscc2C(F)(F)F)cc1 581698452 FYQUIEXLKZWCKT-UHFFFAOYSA-N 380.435 5.193 30 20 GKED COc1cc(CSCCc2cccnc2)ccc1OCc1cccc(C#N)c1 583164227 CHRIWYYIBJFKNA-UHFFFAOYSA-N 390.508 5.017 30 20 GKED C[C@H](CC(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1F 588360845 FIUVAGJDGHGVPU-IJLUTSLNSA-N 399.350 5.345 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1sc2c(c1C#N)CCCC2 590765718 FEAHGUKPCLSTNF-UHFFFAOYSA-N 379.510 5.183 30 20 GKED C[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(O[C@H](C)c2ccccc2)cc1 595751789 HIPSOVFQMQKANU-RBUKOAKNSA-N 391.515 5.223 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCCC2)[C@@H]1c1ccco1 596733087 BOVMVIUOHOQBEO-UZLBHIALSA-N 395.528 5.681 30 20 GKED C=CCN(CCc1ccccc1)C(=O)Nc1cccc(-c2ccccc2OC)c1 601194097 PXSKLKQLZNKNQM-UHFFFAOYSA-N 386.495 5.625 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@H]3c3cccs3)cn2)c1 603692349 IEFRLRCZVUISEL-SFHVURJKSA-N 390.468 5.176 30 20 GKED N#Cc1cc(NC(=O)N(Cc2ccccc2)Cc2ccccc2F)ccc1F 609207556 DEWGUABUVRHUHH-UHFFFAOYSA-N 377.394 5.071 30 20 GKED CN(C(=O)CCCc1ccc2c(c1)-c1ccccc1C2)c1ccc(C#N)cc1F 609217134 WTDUQYXABJMSPJ-UHFFFAOYSA-N 384.454 5.254 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 609499984 CFBHWRRATMJTMX-UHFFFAOYSA-N 393.446 5.171 30 20 GKED Cc1ccc(C)c2c(C)c(C(=O)N[C@@H](C#N)c3ccccc3Br)oc12 609589669 DBCNEAHNGLIMBZ-INIZCTEOSA-N 397.272 5.115 30 20 GKED CC1CCC(N(C(=O)c2cccc(C#N)c2)c2cccc(N3CCCC3)c2)CC1 609905751 STKMBCAQLRJRDK-UHFFFAOYSA-N 387.527 5.384 30 20 GKED C[C@@H](NC(=O)N(C)[C@H](C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610355857 DOIISZYNDBDJKN-CHWSQXEVSA-N 376.287 5.329 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3oc4c(F)cccc4c3C)n2)cc1 613315256 IPTDYRSCORSWBE-INIZCTEOSA-N 390.439 5.802 30 20 GKED N#C[C@H](C(=O)c1cc2ccccc2s1)c1nc(-c2ccc(Cl)cc2)cs1 613319181 URVGYONPPIMFNF-OAHLLOKOSA-N 394.908 6.168 30 20 GKED C=CCn1c(S[C@@H](C)c2c(F)cccc2F)nnc1-c1ccccc1OC 613932047 AREVETFOLMSLRF-ZDUSSCGKSA-N 387.455 5.271 30 20 GKED O=C(Nc1cccc(C(F)F)c1)NC(CCC(F)(F)F)CCC(F)(F)F 665932504 SKQKFYHLRFKFHC-UHFFFAOYSA-N 392.290 5.799 30 20 GKED CC(=NNc1nccc2sccc12)c1sc(-c2ccc(C)cc2)nc1C 727650990 DZTKGIDITBOUHC-UHFFFAOYSA-N 378.526 5.873 30 20 GKED N#CCOc1ccc(CNC(=O)N[C@@H](CC2CCCCC2)c2ccccc2)cc1 727844830 OIUXOTGTTKHWFK-QHCPKHFHSA-N 391.515 5.100 30 20 GKED N#C[C@@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1nc2cc(F)ccc2s1 730422706 VVRBAFPFMKNDSI-KRWDZBQOSA-N 390.439 5.504 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C\c3ccccc3C#N)s2)cc1 730761094 GUPLJSJGWRMURE-AHKFDXCISA-N 387.508 5.189 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(CCc1ccccc1)C1CC1 731400011 KELPMQYPVAYRAX-KRWDZBQOSA-N 379.529 5.320 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(F)c2)CC1)c1nc(-c2ccc(Cl)cc2)cs1 734706530 LRXJNBVULDOTJS-KRWDZBQOSA-N 396.874 5.511 30 20 GKED O=C(/C=C\c1ccccc1OCc1cccnc1)c1ccc(SC(F)F)cc1 734981167 OBWQLDMKACVRSC-XFXZXTDPSA-N 397.446 5.871 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)OCc1cc(Cl)ccc1OCC#N 735349990 SIHYCPDPUUYQKB-UHFFFAOYSA-N 398.871 5.031 30 20 GKED C[C@H](SCC(=O)Nc1ccc(SC(F)F)cc1)c1ccc(C#N)cc1 735676477 YIRWPDDAYJSRMA-LBPRGKRZSA-N 378.469 5.306 30 20 GKED C[C@H](SC1=Nc2ccccc2C1)C(=O)Nc1sc2c(c1C#N)CCCCC2 740767219 PFMCZJMHMJFOQW-ZDUSSCGKSA-N 395.553 5.235 30 20 GKED Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C/C(=O)c1ccc2c(c1)COC2 742436042 FIGLQCGAOHJISI-BQYQJAHWSA-N 399.277 5.414 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C\c2ccc(Oc3cnccn3)cc2)cc1 743055585 GGZHFLBIKDBJAP-XGICHPGQSA-N 376.481 5.666 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)N[C@@H](C)c2cccc3ccccc23)cc1 743462944 NFELFEYACXURQE-PMACEKPBSA-N 385.511 5.134 30 20 GKED C[C@@H](OC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 744336866 ZIUBLOYTCDTFNV-SKRYNEFJSA-N 380.206 5.231 30 20 GKED CCCCCCCCOCC(=O)Nc1c(F)cc(Br)cc1F 744367780 PCPQNJGSMCNRKA-UHFFFAOYSA-N 378.257 5.043 30 20 GKED C[C@@H](CCOc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 745947710 KAOJQWSMCIEIPA-BBRMVZONSA-N 384.888 5.231 30 20 GKED O=C(/C=C\c1cn(-c2ccccc2)nc1-c1ccncc1)c1cc2ccccc2o1 747004061 XQUHCCRCSDAOKL-KHPPLWFESA-N 391.430 5.577 30 20 GKED C=CCC[C@@H](NC(=O)N(C)Cc1c(C)noc1C)c1ccc(C(F)(F)F)cc1 749874012 ZFLQBRNOLZIJSE-GOSISDBHSA-N 395.425 5.159 30 20 GKED N#C[C@@H](C(=O)CCCCc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1 753531043 DPPMJVGTTFOIJB-INIZCTEOSA-N 389.282 5.054 30 20 GKED C[C@@H](CC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1F 764751707 CWPXMPSDCIWIAU-QMMMGPOBSA-N 396.249 5.034 30 20 GKED N#CC1(COC(=O)c2ccc(Oc3cccc(Cl)c3Cl)nc2)CCC1 768079231 YPLBKEGYGFBZHL-UHFFFAOYSA-N 377.227 5.031 30 20 GKED CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1ccc2ccccc2n1 770095351 BVTVYCXPQHZEFJ-XMSQKQJNSA-N 378.859 5.168 30 20 GKED Cc1ccc(CCC(=O)[C@H](C#N)c2ccc3ccccc3n2)c(Br)c1 773962607 XYOSMURDNJJAPW-QGZVFWFLSA-N 393.284 5.115 30 20 GKED CCCc1ccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)c2cccs2)cc1 776153641 BRQGSWURKBKYKN-KOSHJBKYSA-N 390.552 6.043 30 20 GKED Cc1ccc(-c2cc(C(=O)OCCC(C)(C)C#N)c3cnn(C(C)C)c3n2)s1 776372109 YJBNZTRZKHTHDC-UHFFFAOYSA-N 396.516 5.146 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CSc3cc(C)c(C)cc3C2=O)cn1 792890265 MYHAWAUZQTWRNZ-YVLHZVERSA-N 388.492 5.141 30 20 GKED Cc1cccc(NC(=O)c2ccccc2NC(=O)C[C@H](CC#N)c2ccccc2)c1 793011078 FXVXOILMONMASA-FQEVSTJZSA-N 397.478 5.273 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H]3CCC(=O)c4ccccc43)n2)cc1 793125712 PPRMOCVZYSRRME-MOPGFXCFSA-N 386.476 5.055 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](F)CC3CCCCC3)n2)cc1 796662034 ONIFMVCJGNAUPU-QZTJIDSGSA-N 386.492 5.303 30 20 GKED C[C@H](C#N)COC(=O)C(C)(C)c1csc(-c2c(Cl)cccc2Cl)n1 797162371 SVZNMQUTPODGCH-SNVBAGLBSA-N 383.300 5.097 30 20 GKED N#CCOc1ccc(CN2CCC(F)(c3ccccc3C(F)(F)F)CC2)cc1 799176343 OGOHDQBOUXQBSK-UHFFFAOYSA-N 392.396 5.069 30 20 GKED COc1cc(F)c(C(=O)/C=C/C(C)=C\c2ccccc2OC(F)F)cc1OC 811692066 BWEORHHYNKNIGC-WOKGKLDWSA-N 392.373 5.287 30 20 GKED C[C@H](OC(=O)c1cscc1C#N)c1ncc(-c2ccc(Cl)cc2Cl)o1 814615586 NJKVEWHBSOUPJP-VIFPVBQESA-N 393.251 5.500 30 20 GKED N#C[C@@H](C(=O)C1(C(F)(F)F)CCCCC1)c1nc2cc(Cl)ccc2s1 850771450 OGENHKANJMDTKW-NSHDSACASA-N 386.826 5.639 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)Nc2ccc(C(F)F)cc2)c1C(F)F 885582146 ZOMCRQPCHDDFSD-UHFFFAOYSA-N 383.267 5.049 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc(SC(F)F)cc2)cc1 915084999 CSXVYMMMDHJIKD-HXUWFJFHSA-N 394.446 5.909 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)c1cc(F)c(Cl)cc1Cl 916259469 JCNROSCRLVWDBV-UHFFFAOYSA-N 375.614 5.320 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(-c2ccc(Cl)c(Cl)c2)o1 1776030041 LJZYSKYCWNJCSJ-UHFFFAOYSA-N 375.211 5.398 30 20 GKED O=C(O)c1ccccc1NN=Cc1ccc(-c2ccc(C(F)(F)F)cc2)s1 1776030083 WOPMJTOOTAGQDG-UHFFFAOYSA-N 390.386 5.578 30 20 GKED O=C(O)c1cc2ccccc2c(C=NNc2ccc(-c3ccccc3)cc2)c1O 1776059941 SEYNPOGQYYSVRO-UHFFFAOYSA-N 382.419 5.357 30 20 GKED CCOc1cc(/C=C\C(=O)c2cc(C(=O)O)ccc2C)ccc1OCC(C)C 1776914589 DEXOZBDIEJLGKS-YFHOEESVSA-N 382.456 5.023 30 20 GKED O=C(/C=C\c1ccc(-c2ccc(C(=O)O)c(O)c2)o1)c1cc2ccccc2s1 1777569430 SCQHCVRNHJXDQQ-TWGQIWQCSA-N 390.416 5.461 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3C3CC3)CCC2)cc1 1789622287 HVTSJFGZACLWMW-SFTDATJTSA-N 394.559 5.159 30 20 GKED C=CCn1c(SCc2nc3ccccc3s2)nc2sc(C)c(C)c2c1=O 5212647 TZXSLMKEUABOII-UHFFFAOYSA-N 399.566 5.163 30 20 GKED CCn1c2ccccc2c2cc(N[C@@H](C)C(=O)Nc3ccccc3C#N)ccc21 7239128 RZHCWCQVPSWJOV-INIZCTEOSA-N 382.467 5.125 30 20 GKED COc1ccc(S[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCCCC3)cc1 15028480 DGRZRSUHKDKKBF-ZDUSSCGKSA-N 386.542 5.017 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCc1nc2ccccc2s1 108240890 DLCCPRNNVJGJPD-AWEZNQCLSA-N 381.526 5.119 30 20 GKED N#C[C@H](C(=O)c1ncoc1-c1ccccc1)c1nc2cc(Cl)ccc2s1 112149127 YXIAUSDSARADIZ-CYBMUJFWSA-N 379.828 5.095 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSC1=Nc2ccccc2C1 119253146 RZORSVNWRYUKFK-CQSZACIVSA-N 381.526 5.039 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)Nc1cccc(OCCCC#N)c1 121056451 COPZMAOLCYLYPS-UHFFFAOYSA-N 377.469 5.053 30 20 GKED N#Cc1ccccc1NC(=O)CCCC(=O)Nc1ccccc1Oc1ccccc1 133686612 DAPDCOKPSXRKJW-UHFFFAOYSA-N 399.450 5.098 30 20 GKED C[C@@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1cccs1 152399998 XGMNZZBCMBJJOZ-MRXNPFEDSA-N 376.481 5.135 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@H](O)c1cc(Cl)cc(Cl)c1 163900010 DFDUOMKTKGFNJG-APPDUMDISA-N 395.311 5.060 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc(Cl)cc2Cl)ccc1OC 174091839 HOKKKDVXXIXEQM-XJKSGUPXSA-N 393.314 5.534 30 20 GKED Cc1ccc(CCCC(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)s1 176019700 CYPXMMVHGQBPSS-AWEZNQCLSA-N 395.311 5.034 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)c1ccc(F)c(F)c1 177090053 OIUMABBYZWOTDV-CYBMUJFWSA-N 389.471 5.416 30 20 GKED COc1cc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)ccc1OC1CCCC1 177777782 QHGGHFIGEMDFJL-INIZCTEOSA-N 384.501 5.087 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC[C@H]1c1cccc2ccccc12 180078453 ASRUMUCZLWYYEW-VGSWGCGISA-N 385.467 5.500 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NCc1ccccc1C(C)(C)C#N 183743926 ZDKLCPHNUXAFEA-MRXNPFEDSA-N 375.541 5.771 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C1CCCC1)C(F)(F)F 184010006 PVMHSUNQCZPMBH-WBMJQRKESA-N 385.455 5.181 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1Cc2ccccc2C[C@H]1c1ccccc1 184297066 VTUSLGHKSMIENW-JPYJTQIMSA-N 397.478 5.309 30 20 GKED CC(C)n1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cn1 189725802 SDBJTIZQLPZCLY-IBGZPJMESA-N 378.863 5.025 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@@H](C(F)(F)F)C(C)(C)C1 192216498 UFTCOAGVQPRHLC-XJKSGUPXSA-N 399.482 5.381 30 20 GKED COc1cccc(F)c1[C@@H](C)NCc1cccc(OCc2ccccc2C#N)c1 237286996 UOGMZPLRHOTHFU-QGZVFWFLSA-N 390.458 5.136 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccccc2O[C@H](C)C#N)CC[C@H]1c1ccccc1 248542844 IOORZJUFMPCRCD-QWFCFKBJSA-N 377.488 5.025 30 20 GKED O/C(Cc1cn2cc(Cl)cc(Cl)c2n1)=N/[C@@H]1CCOC2(CCCCC2)C1 330189510 LUUWNOPIYQHCIP-CQSZACIVSA-N 396.318 5.022 30 20 GKED C=CCCn1cc(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)nn1 425487841 ZBSSLQNURRYNBT-LBPRGKRZSA-N 398.454 5.016 30 20 GKED C[C@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 431374629 OQPITVSWNLSIHO-KXBFYZLASA-N 389.421 5.501 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1cc(F)c(Cl)cc1F 432868792 XVEXWUMRKKAYSQ-LLVKDONJSA-N 395.862 5.334 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 433287220 WKQGXLLQMGIBBJ-UHFFFAOYSA-N 398.919 5.630 30 20 GKED Cc1onc(-c2ccc(Cl)cc2Cl)c1C(=O)N1CCc2ccc(C#N)cc21 436150966 JUCDHVAPCACPAA-UHFFFAOYSA-N 398.249 5.031 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)N(C)[C@H]1CC[C@@H](SCC)C1 437104253 OATPLAQSWNTAJZ-LSDHHAIUSA-N 387.467 5.016 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@H](C)C[C@@H]1c1cccc(F)c1 437839194 HVBTUMNHDBDBHG-FOIQADDNSA-N 381.451 5.100 30 20 GKED Fc1cccc(F)c1CN[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444741026 HBUPZWOLUWXSFP-OAHLLOKOSA-N 383.282 5.767 30 20 GKED N#CCCC[C@H](N[C@H]1CCc2c1ccc(F)c2Br)c1ccccc1 449339457 KOLPQBBZFVTPDF-OALUTQOASA-N 387.296 5.600 30 20 GKED COCC[C@H](N[C@@H](C)c1ccc(C#N)cc1F)c1cccc(C(F)(F)F)c1 453331608 BXVPXILWRONWSF-DJJJIMSYSA-N 380.385 5.145 30 20 GKED N#CCCC[C@H](NC(=O)N1CC=C(c2cccc(Cl)c2)CC1)c1ccccc1 458827987 DQECLTZQVQPQDJ-QFIPXVFZSA-N 393.918 5.574 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1ccc(F)c(Br)c1 462223110 OGITWGWXPITHTD-UHFFFAOYSA-N 398.235 5.259 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(Br)ccc1Cl 462236829 MOMXDDNFJOQHAE-GFCCVEGCSA-N 395.753 5.966 30 20 GKED O=C(c1ccc(-c2ccccc2F)o1)N(CCC(F)(F)F)CC(F)(F)F 468534158 BQXYXXPBHHTXHN-UHFFFAOYSA-N 383.263 5.043 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)NCc1ccc(Oc2ccccc2)nc1 471770564 LYKPQBBZACSJAP-UHFFFAOYSA-N 387.483 5.162 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@@H](Cc2ccccc2)[C@H]1C 472757303 VYYBXYNHRNHSFM-GGPKGHCWSA-N 393.556 5.566 30 20 GKED CC(=O)c1cccc(C(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)c1 482148729 GYJCPAKBFPCGLI-UHFFFAOYSA-N 386.426 5.055 30 20 GKED C[C@@H]1CCN(C(=O)c2ccc(C#N)s2)c2cc(C(F)(F)F)ccc2S1 486738222 QOVGIWQYQLNFEB-SNVBAGLBSA-N 382.432 5.170 30 20 GKED C[C@@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)cc1 487546720 WPLDWTXORFEDQY-OXJNMPFZSA-N 399.332 5.494 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)N1CC=C(c2ccc(C#N)cc2)CC1 502548563 MHLTZXBUUSBVLL-LJQANCHMSA-N 387.527 5.106 30 20 GKED Cc1ccccc1[C@@]1(F)CCN(C(=O)Nc2ccccc2S[C@@H](C)CC#N)C1 505340687 ZBJKKOLMDYFFPX-HTAPYJJXSA-N 397.519 5.492 30 20 GKED N#Cc1ccc(Cl)c(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c1 506778294 QQOXLNIQEFYNNN-SFHVURJKSA-N 387.291 5.446 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@@H]3C3CCCCC3)s2)cc1 509652558 QGLNXTSSKSDFPE-HXUWFJFHSA-N 394.544 5.182 30 20 GKED C=C(C)CN(Cc1csc(-c2ccc(Cl)cc2)n1)Cc1ccc(CO)o1 512181823 QIGXCWWTVOPTCY-UHFFFAOYSA-N 388.920 5.127 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2)cc1)c1nc(-c2ccccc2)cs1 515542830 IGOGVDUCJTXSJU-NRFANRHFSA-N 380.472 5.967 30 20 GKED C=C(C)Cn1c([C@H]2CCCCO2)nnc1N(C)[C@H](C)c1cc2ccccc2o1 517012017 UOLBMOMNTKVUBV-VQIMIIECSA-N 380.492 5.039 30 20 GKED C[C@]12CCN(C(=O)Nc3ccc(Sc4ccccc4C#N)cc3)C[C@H]1C2(F)F 518106594 WZSFHBUWJNURAY-QUCCMNQESA-N 399.466 5.218 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)[C@H](Sc1ccccc1F)c1ccccc1 518494229 GHGZKFJUHSSUTH-JOCHJYFZSA-N 390.483 5.189 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCc1ccccc1)c1ccccc1)c1ccc(C#N)cc1 520416282 TVQGKZNKIBRNDD-DVECYGJZSA-N 383.495 5.293 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)cs2)cc1 520923970 BIRYJTXZXOZLEM-HNNXBMFYSA-N 393.537 5.765 30 20 GKED CCc1c(C)sc(NC(=O)Cc2ccc(NC(=O)CC(C)(C)C)cc2)c1C#N 525028114 MSFNMCQLWLBATG-UHFFFAOYSA-N 397.544 5.047 30 20 GKED CSc1cccc([C@@H](NCc2ccc(C#N)cc2F)c2ccc(F)c(F)c2)c1 525175942 LDDHDWVXLNQQFN-JOCHJYFZSA-N 398.453 5.577 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N[C@@H](c3cccnc3)C3CC3)cc2)c1 533996907 OYBJCGVKRLQVID-JOCHJYFZSA-N 384.439 5.018 30 20 GKED CC(C)(C)n1cc(NC(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)cn1 536416902 USIKFVORZKLSMZ-UHFFFAOYSA-N 394.862 5.208 30 20 GKED C=CCCOCCCCC(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 540598791 NHQRMNBHXSTRNT-UHFFFAOYSA-N 397.906 5.585 30 20 GKED CSC[C@H](N[C@H](CCC#N)c1ccccc1)c1ccc(C(F)(F)F)cc1 540992040 QFISRUOIMLEAKF-MOPGFXCFSA-N 378.463 5.744 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(F)c(OC(C)(C)C)c(F)c1 542964177 HYECSTFBBFFWNZ-UHFFFAOYSA-N 399.441 5.234 30 20 GKED COC1CCC(CCNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CC1 544566691 KDOXUMJOVKGJFS-UHFFFAOYSA-N 393.487 5.067 30 20 GKED COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)Nc1ccc(C(C)(C)C#N)cc1 554119851 FVPHZIBUJOFNTC-UTKZUKDTSA-N 391.515 5.501 30 20 GKED CN(C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1cc(Cl)ccc1C#N 554728441 UOEBJYXWLCQJOS-UHFFFAOYSA-N 397.865 5.703 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cnc(-c4cccnc4)s3)c2C#N)[C@H](C)C1 571979227 ZXELSDSNGQYOSM-VXGBXAGGSA-N 394.525 5.076 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 574972866 PWPBTTHJOIMUSN-GOSISDBHSA-N 394.481 6.125 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NCc2ccc(C3(C#N)CC3)cc2)cc1 594929006 JAYIXPIAUYEECF-IBGZPJMESA-N 382.507 5.768 30 20 GKED N#CC1(CC(=O)N2CCCC[C@@H]2c2ncc(-c3cccc(F)c3)[nH]2)CCCCC1 597554405 IQRVXYCDIVGOGZ-HXUWFJFHSA-N 394.494 5.134 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@H]21 599390121 FLUOAFKUYUBFNS-DJGFWBNSSA-N 382.916 5.116 30 20 GKED CN(Cc1ccc2ccccc2c1)C(=O)Nc1cccc(C#Cc2ccccn2)c1 601184906 XFRIHSJGIZKQHH-UHFFFAOYSA-N 391.474 5.299 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2ccc(F)cc2)cc1Cl 603673356 IFBKWCZSGLHKCQ-HXUWFJFHSA-N 394.833 5.152 30 20 GKED N#Cc1c(NC(=O)CSc2ccccc2)sc2c1-c1ccccc1CC2 603992064 YGKOAPGKHFUHAK-UHFFFAOYSA-N 376.506 5.116 30 20 GKED N#C[C@H](NC(=O)c1ccc(SCc2ccccc2)cc1)c1ccc(F)cc1 604074670 FZOVPNJFJPPDMU-NRFANRHFSA-N 376.456 5.113 30 20 GKED CC[C@@H](c1ccccc1)N(CC)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056591 QBEVMKARYGLJNT-QFIPXVFZSA-N 388.467 5.344 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(OCC(F)(F)F)cc1 609377271 SVIZSOQGDQDEPX-CYBMUJFWSA-N 394.418 5.132 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N(Cc3ccccc3)C3CC3)cc2)c1 609434487 QFWKKMHXOHLOOU-UHFFFAOYSA-N 383.451 5.547 30 20 GKED COc1ccccc1-c1noc(-c2ccc(Oc3cccc(F)c3C#N)cc2)n1 609473773 JIZVVCKLNPTOOS-UHFFFAOYSA-N 387.370 5.215 30 20 GKED CC(C)(C)n1nccc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 609725147 IOZRJDDAFIDISQ-UHFFFAOYSA-N 394.862 5.208 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(Cl)cc([N+](=O)[O-])c3)n2)cc1 609959704 PSBXXNDYHPXGRD-MRXNPFEDSA-N 397.843 5.170 30 20 GKED N#Cc1cc(NC(=O)c2cncs2)ccc1Oc1ccc(C(F)(F)F)cc1 610296177 RDQHQUOGVVPAJI-UHFFFAOYSA-N 389.358 5.078 30 20 GKED Cc1ccc(NCc2ccc(C(C)(C)C#N)cc2)cc1OCC1CCOCC1 614058682 NEKCYJODYVIQRC-UHFFFAOYSA-N 378.516 5.214 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N[C@H](C)c2ccsc2)cc1 619787867 MXVDKTCGJWSKFV-CQSZACIVSA-N 393.468 5.303 30 20 GKED COc1ccc([C@@H](C)NC(CCC(F)(F)F)CCC(F)(F)F)cc1F 658254632 MERCENUQPBXZBB-SNVBAGLBSA-N 375.328 5.539 30 20 GKED O=C(Nc1ccc(C(F)(F)C(F)(F)F)cc1)[C@@H]1CC[C@H](C(F)(F)F)C1 671817373 HEQRHMPWBYSQBD-SCZZXKLOSA-N 375.259 5.258 30 20 GKED N#C[C@H](C(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccc2ccccc2n1 679536476 LCMBNVZXUPVWFG-AWEZNQCLSA-N 391.402 5.127 30 20 GKED Cc1sc2ncn(N=Cc3ccc(-c4ccc(Cl)cc4)s3)c(=O)c2c1C 725769153 ILNOTNVOOPXYMR-UHFFFAOYSA-N 399.928 5.339 30 20 GKED CCSc1ccc([C@@H](C)NC(=S)Nc2ccc(C#N)c(Cl)c2)cc1 728790438 AXYWZRFLHZEBGV-GFCCVEGCSA-N 375.950 5.371 30 20 GKED Cc1cccc2[nH]cc(CC(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c12 728813615 PBZCZBVZXSEUOY-QFIPXVFZSA-N 379.463 5.313 30 20 GKED CC(C)(C)c1ccc([C@@H](NCc2ccc(OCC#N)cc2)C(F)(F)F)cc1 731211790 AZSDVNMZLFNLKM-LJQANCHMSA-N 376.422 5.280 30 20 GKED O=C1/C(=C\c2ncc(-c3cccc(Br)c3)[nH]2)CCc2ccccc21 731938797 SEPYMIMUEYDLBJ-PTNGSMBKSA-N 379.257 5.052 30 20 GKED CCCC[C@H]1CCCC1=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1 733080167 GAJXAAFYYZCKQX-ZDUSSCGKSA-N 377.414 5.316 30 20 GKED O=C(/C=C/c1ccc(-c2c(F)cccc2F)o1)c1cccc(N2CCOC2=O)c1 734368277 RCMFDGHFVZZRQH-VQHVLOKHSA-N 395.361 5.078 30 20 GKED C=C(Cl)CNC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1 736238611 MNHNRSXNXPEUAX-UHFFFAOYSA-N 398.677 5.120 30 20 GKED COc1cc(C(=O)/C=C/c2ccccc2OCC(F)(F)F)ccc1SC 741842719 GWIOVIHJHRIOMD-VQHVLOKHSA-N 382.403 5.254 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Nc2ccc(OC(C)C)c(Cl)c2)cc1 743465203 GLFFHEHSMOYAAP-KRWDZBQOSA-N 399.922 5.183 30 20 GKED Cc1c(C(=O)/C=C\c2cc3ccccc3nc2N2CCOCC2)oc2ccccc12 747138428 DIJLSGYDICTKIK-KHPPLWFESA-N 398.462 5.022 30 20 GKED CC(C)(C)c1ccc(C(C)(C)CNC(=O)c2ccccc2SCC#N)cc1 756041975 WZKFBTTVTLDBCF-UHFFFAOYSA-N 380.557 5.307 30 20 GKED COC1CCC(CC(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CC1 759216923 HPHFFWHFWUSTJV-UHFFFAOYSA-N 382.435 5.023 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2nc3ccc(F)cc3s2)cc1Cl 761479867 WQOWJXWJQKVIBJ-WAYWQWQTSA-N 377.824 5.002 30 20 GKED C[C@@H](OC(=O)c1ccccc1SCc1cscn1)c1cccc(C#N)c1 764613189 LMZZOXWGYAFSQN-CQSZACIVSA-N 380.494 5.225 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(O)c(F)c2)cc1Cl 767296977 MHYWKUMCPDSQER-KRWDZBQOSA-N 380.806 5.092 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCCc3ccc(Cl)cc32)ccc1OC 772984982 HMKPMJVKROEIRD-AZUAARDMSA-N 384.907 5.197 30 20 GKED N#C[C@@H](C(=O)C1(c2c(Cl)cccc2Cl)CCC1)c1cnc2ccccc2n1 774271582 SMCUYHYUUDUEAN-CYBMUJFWSA-N 396.277 5.235 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc(Cl)cc2F)cc1 779396180 BQRSTYYKGLIBBV-FQEVSTJZSA-N 393.849 5.456 30 20 GKED CC[C@@H]1C[C@H](C=NNc2ncnc3scc(-c4ccc(F)cc4)c23)CCO1 779762510 ZLNSYVCLFOONBZ-CZUORRHYSA-N 384.480 5.100 30 20 GKED Cc1nc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)sc1-c1ccccc1 780017300 ZRLJLSYUGBAFRC-ZDUSSCGKSA-N 378.457 5.053 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC1(c2ccc(Cl)cc2)CCCC1 780672735 IXDWULGRADWLKQ-OAHLLOKOSA-N 383.879 5.222 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@@H](c1ccccc1F)C1CCCC1 780674539 OZLZDHOTTVCLTC-QVKFZJNVSA-N 381.451 5.170 30 20 GKED Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1 791562676 VBBPTADMYBGEAT-OAQYLSRUSA-N 399.881 5.508 30 20 GKED N#C[C@@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1nccc2ccccc12 792105278 ULZWPGCFWIAWFV-INIZCTEOSA-N 399.277 5.577 30 20 GKED C[C@@H]1CCc2ccc(Br)cc2[C@H](NCc2ccc(OCC#N)cc2)C1 794809679 HORIWVREVLFFRI-QVKFZJNVSA-N 399.332 5.155 30 20 GKED C=C(C)[C@H]1OCC[C@H]1CNC(=O)c1sc2cc(C(C)C)ccc2c1Cl 798038295 WGFDXTTXXHDDGY-KBXCAEBGSA-N 377.937 5.389 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H]1Cc2ccc(Cl)cc2C1 800537740 HXIQCFOMABALEX-CXAGYDPISA-N 385.920 5.023 30 20 GKED Cc1oc(-c2cccs2)nc1CON=Cc1ccccc1Br 818238897 QLVHIDCVKNTODF-UHFFFAOYSA-N 377.263 5.025 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(c2cccnc2)CC2(CCC2)C1 888862606 LAGDJVHSMBASRZ-QGZVFWFLSA-N 391.540 5.174 30 20 GKED Cc1ccc(C(C)C)c(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915085628 DFRDENWOPLGFAE-XMMPIXPASA-N 398.506 5.791 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915088010 YOQDJKUIZXHFKT-QHCPKHFHSA-N 382.463 5.252 30 20 GKED CC(C)[C@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccccc1 915353829 YCAPQEQZAKNXJL-RPWUZVMVSA-N 383.495 5.861 30 20 GKED CCCCc1ccc(C(=O)[C@@H](C#N)C(=O)Nc2c(CC)cccc2CC)cc1 916903902 UHAANNUVPRSQJP-OAQYLSRUSA-N 376.500 5.115 30 20 GKED COCCOc1ccc(C(=O)/C=C\c2cc(-c3ccccc3)cs2)cc1OC 917517818 LDQAPQGIPWIMBG-KTKRTIGZSA-N 394.492 5.345 30 20 GKED C=CCOc1ccc(C(=O)Nc2cccc(Nc3nc(C)cs3)c2)cc1OC 920271550 OIIFUNSCRURJBR-UHFFFAOYSA-N 395.484 5.021 30 20 GKED CCCC[C@H](CC)COc1ccc(C(C)=NNc2cccc(C(=O)O)c2)cc1 1776036807 WKBUVUDIHGNTRZ-SFHVURJKSA-N 382.504 5.816 30 20 GKED Cc1cc(C=NNc2cccc(C(=O)O)c2)c(C)n1-c1ccc(C(C)C)cc1 1776036907 PXCNMDRIKIYPIP-UHFFFAOYSA-N 375.472 5.362 30 20 GKED CCn1c2ccccc2c2cc(C=NNc3ccc(C(=O)O)c(F)c3)ccc21 1776073158 GOZKUYHBMWBXOZ-UHFFFAOYSA-N 375.403 5.098 30 20 GKED CCN(Cc1ccccc1)c1ccc(/C=C/C(=O)c2ccc(C(=O)O)s2)cc1 1776869246 LARXLMMHWLUHJL-JLHYYAGUSA-N 391.492 5.369 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)/C=C\c3ccc(/C=C\C(=O)O)o3)s2)cc1 1777430559 CKAPEPRCDINBKC-HWAYABPNSA-N 379.437 5.014 30 20 GKED C=CC[C@@H](C)C(=O)NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786612472 FGTKYPUZVOEZSK-UTKZUKDTSA-N 394.490 5.044 30 20 GKED Cc1onc(-c2c(F)cccc2Cl)c1C(=O)[C@H](C#N)c1nc2ccccc2o1 41541877 HHNOFMSYEMZONX-NSHDSACASA-N 395.777 5.074 30 20 GKED N#CC1(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)CCCCC1 62524424 JCWDXEFVVGSASF-UHFFFAOYSA-N 396.878 5.397 30 20 GKED Cc1sc(-c2ccco2)nc1C(=O)Nc1ccccc1S[C@H](C)CC#N 66800473 RAIVMGMQHGMWJX-GFCCVEGCSA-N 383.498 5.358 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc(-c2ccccc2F)s1 66802133 MYPKESVTDFTKPE-CYBMUJFWSA-N 397.500 5.596 30 20 GKED CCc1ccc2c(CNc3ccccc3SC[C@@H](C)C#N)cc(=O)oc2c1 68782267 AZHMIVOPAJVPQD-HNNXBMFYSA-N 378.497 5.219 30 20 GKED CCc1nc([C@@H](C)NCc2cccc(OCc3ccccc3C#N)c2)cs1 111407351 ONQDFJCHEHRGDF-MRXNPFEDSA-N 377.513 5.007 30 20 GKED N#C[C@H](Sc1nnc(COc2ccc(Cl)cc2Cl)o1)C1CCCCC1 115186438 NSEXIOFQXYZQHW-HNNXBMFYSA-N 398.315 5.520 30 20 GKED Cc1cccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1F 154259915 KJHACJUTGYZWDA-UHFFFAOYSA-N 382.382 5.411 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(CSc2cccc(C#N)c2)cs1 158757498 ZPSBRCDYMQUXAX-UHFFFAOYSA-N 379.510 5.300 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCC[C@H]1c1cc2ccccc2[nH]1 170992911 VJLCZSORICGJRI-FQEVSTJZSA-N 389.503 5.355 30 20 GKED N#Cc1ccc(CC(=O)Nc2ccc(F)cc2-c2nc3ccccc3s2)cc1 171519770 YUONAOKQUUAODV-UHFFFAOYSA-N 387.439 5.155 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cccc(F)c1F)c1nc2cc(Cl)ccc2s1 174002607 FZWVUVTYPATTHQ-RWMBFGLXSA-N 388.826 5.208 30 20 GKED COc1ccc([C@@H](Cc2ccccc2C)NCc2ccc(C#N)s2)cc1OC 176958187 HGECZSQRHXOPLB-OAQYLSRUSA-N 392.524 5.019 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2COc2ccccc2)n1 177743968 MXJHYCABWWIMJQ-LJQANCHMSA-N 376.481 5.336 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)n1 177780084 NZZZZXBUHJANEX-MGPQQGTHSA-N 394.418 5.145 30 20 GKED Cc1c(C#N)cccc1NC(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 178564664 IQPIREBRHUXLRA-KRWDZBQOSA-N 398.466 5.002 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@H](C)N[C@H](CCC#N)c1ccccc1 181572488 JMNFKOTYYANMQF-MGPUTAFESA-N 379.504 5.953 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 184633731 AOQHEOAFKHQREP-UZUQRXQVSA-N 398.466 5.361 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(OC[C@H]2CCCO2)cc1 189908555 FQJDYABCIAEIMO-OAQYLSRUSA-N 379.500 5.349 30 20 GKED Cc1nc(CC2CC2)sc1C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 190878085 XOPFJWLIULEWAK-LBPRGKRZSA-N 387.917 5.157 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 194104225 DYJHGICXEBLIML-UHFFFAOYSA-N 387.386 5.261 30 20 GKED C[C@H]1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)[C@@H](c2ccco2)C1 248569813 QILVJKZGZUNCPZ-LZLYRXPVSA-N 383.517 5.536 30 20 GKED COc1ccccc1-c1ccc(/C=C\C(=O)c2ccc(N3CCOC3=O)cc2)cc1 255010339 CUOXWCJGRFLKGS-NVNXTCNLSA-N 399.446 5.215 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(Cl)c(Cl)c2)c1 303154441 GOGODUXZVJYVCU-IRXDYDNUSA-N 389.282 5.418 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)/C=C/c1ccc(O[C@@H](C)C#N)cc1 303230758 VJORRKGINGXZIX-TZIYXEQSSA-N 392.455 5.445 30 20 GKED C[C@H](c1ccco1)N(C(=O)c1cccc(COc2ccc(C#N)cc2)c1)C1CC1 303588787 GZEGHRVWSMFFME-QGZVFWFLSA-N 386.451 5.096 30 20 GKED CC(C)c1cc(Br)ccc1N/C(O)=N/[C@@H]1CCOC2(CCC2)C1 328835578 MLGFBKSMGZWVRG-CQSZACIVSA-N 381.314 5.000 30 20 GKED CC[C@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1nc(C)cs1 329492644 WDMGHODPLGSWQG-WMZOPIPTSA-N 386.565 5.366 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCc2cc(C#N)ccc21 416812156 LNPNNXRRCAOBOX-KXBFYZLASA-N 390.512 5.009 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CCCCC(=O)c1ccc(F)cc1 426996260 YVFDHDJKQMTRBL-MRXNPFEDSA-N 398.503 5.602 30 20 GKED CCN(C(=O)c1cccc(SCC#N)c1)[C@@H](Cc1ccc(F)cc1)C(C)C 430590977 DULMPDUJUGFCKU-NRFANRHFSA-N 384.520 5.171 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CC[C@@H](c2cccc(F)c2)C1 432095638 QMKKWQLXHOPTLC-SUMDDJOVSA-N 397.519 5.535 30 20 GKED CCN(C(=O)c1cc(C#N)oc1C)[C@@H](c1ccc(C(C)C)cc1)c1cccnc1 435455818 YPRIYVJDRMRKBE-QHCPKHFHSA-N 387.483 5.230 30 20 GKED CCCCOC1CCN(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 438021434 HIOQBRPWMSESQE-UHFFFAOYSA-N 393.487 5.164 30 20 GKED CC[C@H](Cc1ccccc1)N(C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 438639910 YUAFUKXOIDWHBG-QGZVFWFLSA-N 375.394 5.062 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438842674 QGALQABMTYDKRR-IFXJQAMLSA-N 390.314 5.741 30 20 GKED N#CCC[C@H](NC(=O)N(Cc1ccc2ccccc2c1)C1CC1)c1ccccc1 440255523 LXCHTDCPQQIVJJ-DEOSSOPVSA-N 383.495 5.559 30 20 GKED Cc1ccccc1CN(Cc1ccccc1)Cc1nnc(-c2ccc(C#N)cc2)o1 441547046 ZKSKRGKXXXBMMZ-UHFFFAOYSA-N 394.478 5.119 30 20 GKED CC[C@H](Nc1cccc(COCc2ccc(OC)cc2)c1)c1ccc(C#N)cc1 447598805 WCWLXQYXGTVSCA-VWLOTQADSA-N 386.495 5.847 30 20 GKED C=CCN(Cc1cccs1)C(=O)C(CC)(CC)c1ccc(OC)c(OC)c1 448139485 NGYPXOJRRVNRHX-UHFFFAOYSA-N 387.545 5.038 30 20 GKED C=CCn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCCC[C@@H]1c1ccc(Cl)cc1 453412964 JEARTLHJIXBTGB-IPELMVKDSA-N 386.927 5.089 30 20 GKED CCC(C)(C)OCc1ccccc1NC(=O)Nc1ccc(CC#N)cc1Cl 455700173 ADDFFJQEHBLYBO-UHFFFAOYSA-N 385.895 5.755 30 20 GKED C[C@@H](C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 463242964 PCJBODDMVPMEQH-MZNJEOGPSA-N 380.447 5.314 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 464158281 MXHRCMAGCCFUMN-LJQANCHMSA-N 394.302 5.026 30 20 GKED C=CCC(CC=C)C(=O)N(CC)[C@@H](c1cccnc1)c1csc2ccccc12 467528502 VMNAXMXFFOKSLH-QHCPKHFHSA-N 390.552 6.003 30 20 GKED C=CCOc1ccc(CN(Cc2cc3ccccc3nc2O)C(C)(C)C)cc1 474175380 XYAPFBMEOCJKAM-UHFFFAOYSA-N 376.500 5.306 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCC(=O)C3(C)CC3)n2)o1 475969759 BCEWEVIQVSXXNJ-UHFFFAOYSA-N 380.391 5.002 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)c(F)c1)c1ncc(C(C)(C)C)o1 476517588 ZUQUZOURGLVOOJ-CQSZACIVSA-N 379.435 5.948 30 20 GKED CC(C)(Cc1ccc(C(F)(F)F)cc1)NC(=O)C[C@H](CC#N)c1ccccc1 476909917 CVQQCPYDHYNNFU-SFHVURJKSA-N 388.433 5.230 30 20 GKED COc1ccc(-c2cc(C(=O)N(C)c3cc(Cl)ccc3C#N)sc2C)cc1 479569185 LKDCRONTBBNRPP-UHFFFAOYSA-N 396.899 5.534 30 20 GKED CC(C)C[C@@H](C)n1nccc1NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 481441943 VFUHFAYXICOGJP-GOSISDBHSA-N 381.524 5.052 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccco2)c2cccc(Cl)c2)cc1 482623508 KJZGPNGLWWOVLT-UHFFFAOYSA-N 382.872 5.130 30 20 GKED N#Cc1ccc(SCC(=O)Nc2ccccc2Oc2cccc(F)c2)cc1 483347044 FYFOMRLPAUTRPJ-UHFFFAOYSA-N 378.428 5.220 30 20 GKED N#CCCC[C@@H](NC(=O)CCc1ccc(Cl)cc1Cl)c1ccccc1 487485362 MIEBZLFKPIAOFS-LJQANCHMSA-N 375.299 5.477 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(C(F)F)ccc1Cl 497250406 WKCNOXZITRGEJH-UHFFFAOYSA-N 395.793 5.406 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NCC(=O)NCc1ccc(C#N)cc1 498648250 DAMFGHNQFYNNFC-UHFFFAOYSA-N 393.556 5.020 30 20 GKED C=CCn1c(C)cc(C(=O)Cc2nc(O)c3cc(-c4ccccc4)ccc3n2)c1C 498760550 BSJASDVWMAFBHK-UHFFFAOYSA-N 397.478 5.032 30 20 GKED CCOC(=O)c1ccc(C#N)c(SCCCSc2ccccc2Cl)n1 504537113 ZAGDHBYTXAXOSO-UHFFFAOYSA-N 392.933 5.058 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H]2CCCOc3ccccc32)cc1 506317084 XIZQUMFBBSFLMJ-OAQYLSRUSA-N 399.450 5.386 30 20 GKED C=C(C)CCc1noc(CSc2nnc(-c3ccccc3)n2[C@H](C)CC)n1 508610928 ZJGBAUQCEKEUSN-OAHLLOKOSA-N 383.521 5.100 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@H](C)c1ccc(C#N)cc1 509228577 SUKKCOZKEHLFKL-OAHLLOKOSA-N 389.421 5.258 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)Sc1nc2c(cc1C#N)CCCC2 515179635 ZNNKXVDZSQMLQW-HNNXBMFYSA-N 393.556 5.076 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1CC1CCCCC1 518255956 KVXZCGALDAWSLZ-PKOBYXMFSA-N 385.577 6.048 30 20 GKED Cc1nc2cc(NC(=O)c3ccc(Oc4cccc(F)c4C#N)cc3)ccc2o1 521648043 IZFIJVTYSCWBQB-UHFFFAOYSA-N 387.370 5.192 30 20 GKED Cc1ccc(-c2nc(CC(=O)Nc3ccccc3SCCC#N)cs2)cc1 521716930 QAKHDPDVYXFFBG-UHFFFAOYSA-N 393.537 5.306 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)c1cccc(COc2cccc(C#N)c2)c1 524512511 WXPDLHCNQRNNCY-DVECYGJZSA-N 396.490 5.155 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1ccc(Cl)c(Cl)c1 524859453 NCBIWZVPXFFOML-USBNGQNGSA-N 397.664 5.270 30 20 GKED COc1ccc(CN[C@@H](C)c2ccccc2C(F)(F)F)cc1OCCCC#N 525709530 KGDGKDAKNRVRCM-HNNXBMFYSA-N 392.421 5.247 30 20 GKED CSc1ccc([C@H](C)Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1F 527292727 PRTFZXKWMNWZMA-HNNXBMFYSA-N 397.519 5.304 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(OCC2CCCCC2)CC1 530500151 GKQJDVMCKPCYFE-UHFFFAOYSA-N 398.591 6.132 30 20 GKED Cc1c(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cccc1-c1ccccn1 533650101 SUWICQRASFAOQQ-FQEVSTJZSA-N 396.277 5.359 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1ccc(OCCN(C)C)cc1 539214470 MBQPEBPIEUZJBX-FQEVSTJZSA-N 399.538 5.016 30 20 GKED C=CCC[C@H](Nc1ccc(S(C)(=O)=O)cc1)c1ccc(C(F)(F)F)cc1 542281808 KWCFEHJEIFHAPI-SFHVURJKSA-N 383.435 5.228 30 20 GKED N#Cc1cccc(C2(NC(=O)c3[nH]ccc3-c3c(Cl)cccc3Cl)CC2)c1 557204002 QMNPXAKTNLPOGP-UHFFFAOYSA-N 396.277 5.279 30 20 GKED N#Cc1csc(CN(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)c1 558419226 QOQDAMKKUMTLBE-UHFFFAOYSA-N 388.323 5.524 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 562137521 SAKYVXHXDPSEHT-KRWDZBQOSA-N 387.405 5.297 30 20 GKED CC(C)(NC(=O)c1ccc(COc2ccccc2C#N)o1)c1ccc(Cl)cc1 571944859 NVVCFBKLVABBNK-UHFFFAOYSA-N 394.858 5.049 30 20 GKED COc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2ccc(C(C)(C)C#N)cc2)cc1 602759507 LNFKPBISGJDKBP-QHCPKHFHSA-N 397.478 5.267 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)oc2c(F)cccc12 603877484 NZDATWCPEILCLY-UHFFFAOYSA-N 377.400 5.128 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc(OCCCC#N)c1 603972360 URIMRIOBOYXPJD-QGZVFWFLSA-N 380.488 5.073 30 20 GKED Cc1ccc(CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C2CC2)o1 604461420 XWOFUBXXSXRQSX-UHFFFAOYSA-N 387.439 5.449 30 20 GKED COc1ccc(N(Cc2ccccc2)C(=O)c2cc3ccccc3n2CC#N)cc1 609215674 IDWUJLYQROWUNH-UHFFFAOYSA-N 395.462 5.020 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)[C@@H]1CCc2ccccc21 609297283 BBQDPPMDXXLGAY-JOCHJYFZSA-N 386.426 5.249 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(Cl)c1 609372355 PWKFCRLIFGQETL-UHFFFAOYSA-N 392.842 5.573 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2nc(C(F)F)[nH]c2c1 609377960 LZJJOXQIDQDGES-NSHDSACASA-N 386.427 5.005 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2ccc(F)cc2F)c1 609722707 XIRMUTLRPFJQSP-UHFFFAOYSA-N 384.769 5.534 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)c1cccc(Cl)c1Cl 609805651 MSUSTHFZPKVMAJ-CQSZACIVSA-N 390.314 5.548 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccs1 609968365 YUICQYYZQFRFMD-RDTXWAMCSA-N 380.900 5.799 30 20 GKED CS[C@H](C(=O)Nc1sc2c(c1C#N)-c1ccccc1CC2)c1ccccc1 610041301 CKOOYASKNUJYCS-FQEVSTJZSA-N 390.533 5.428 30 20 GKED Cc1cnc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)s1 610320896 ASIQHUNLYIGPME-KRWDZBQOSA-N 396.903 5.082 30 20 GKED CC(C)Cn1ncc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)c1C(C)C 611238016 UXWGQMSLICWOQL-UHFFFAOYSA-N 379.291 5.093 30 20 GKED C=CCN(C(=O)c1sc(NC(=O)c2ccccc2Cl)cc1C)C(C)(C)C 622943752 PSTVESHJKILSTJ-UHFFFAOYSA-N 390.936 5.389 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@@H]1CC[C@@H]1c1ccc(F)cc1 628112874 BWLPGCSWRDWCFP-HUUCEWRRSA-N 399.350 5.489 30 20 GKED C=CCn1c(S[C@@H](C(=O)C2CC2)c2ccccc2)nnc1-c1cccs1 647118577 IEWJGJSWTPNLCC-GOSISDBHSA-N 381.526 5.005 30 20 GKED C[C@@H](CNC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)CC(F)(F)F 668586337 UFBJSPJGJMSSMQ-MRVPVSSYSA-N 378.263 5.051 30 20 GKED O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N[C@H]1CCC(F)(F)C1 675683355 RGQBTXPXHYWQNP-VIFPVBQESA-N 376.247 5.034 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)cc2)cc1F 726474782 JQPIIHLZXUTAEU-UHFFFAOYSA-N 393.443 5.307 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=S)Nc1ccc(Cl)nc1 727080833 HCQIAIDSPBFWCK-UHFFFAOYSA-N 394.887 5.516 30 20 GKED CN(CCC#N)c1ccc(CNCC(C)(C)c2cccc(C(F)(F)F)c2)cc1 727161997 PLFYMWWUGGBEBJ-UHFFFAOYSA-N 389.465 5.123 30 20 GKED COc1ccc(CCCCCC(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1 727628532 KKFKMEKWSQCSRT-GOSISDBHSA-N 378.497 5.284 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1Cl 727629044 QPUFAQTUXKHUEV-KOTGUFOOSA-N 387.291 5.883 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@H](c3cccc(F)c3)C2)cc1 729553761 UHSIXGDDQWRWJJ-XUZZJYLKSA-N 399.469 5.503 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)C(C)(C)CCCc2ccccc2)c1 733770744 JJSCGHUSOCHOAB-NRFANRHFSA-N 378.516 5.033 30 20 GKED C=CC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccncc1 734510812 ZPSUZWNTJLWEAP-LJQANCHMSA-N 383.835 5.310 30 20 GKED O=C(/C=C/c1nccc2ccccc12)c1c[nH]c2cc(Br)ccc12 740765596 IUXIQNLAIISPAM-BQYQJAHWSA-N 377.241 5.375 30 20 GKED COc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1C#N 742368191 YGKNIUAQYTVKQK-QFIPXVFZSA-N 376.887 5.294 30 20 GKED C[C@@H]1/C(=C/c2nccn2Cc2ccccc2)C(=O)c2cccc(Br)c21 742434992 PFGQDCJUYHPURI-MTOJCTJASA-N 393.284 5.077 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1 744767121 YTZCOQIXYNAZMD-ONTPJNGFSA-N 385.511 5.384 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1ccc(-c2ccncc2)cc1 745990181 MTYDNTDOUMWSLW-KMKOMSMNSA-N 379.419 5.227 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2csc(-c3ccc(C(F)(F)F)cc3)n2)cn1 746686456 FIFANRKHLORKQQ-FPLPWBNLSA-N 391.418 5.502 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=S)Nc1ccccc1-c1ccccc1 751007742 NIKOXZHWWIBJNO-UHFFFAOYSA-N 385.536 5.833 30 20 GKED C[C@]1(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CCCc2ccccc21 751084489 OQPMWAZOUGEOOS-BVAGGSTKSA-N 380.491 5.575 30 20 GKED C[C@@H]1/C(=C/c2cnc(-c3ccncc3)s2)C(=O)c2cccc(Br)c21 753144947 RRZRHTZDRQLYIG-PDICVPPASA-N 397.297 5.351 30 20 GKED N#Cc1ccc(F)c(CN[C@@H](c2ccc(F)cc2)c2cnc3ccccc3c2)c1 753680899 CBJBWHRFCUIGMJ-DEOSSOPVSA-N 385.417 5.264 30 20 GKED CC(C)(C)O[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 753968685 OIFPXRKRPIQIEF-ZEQRLZLVSA-N 398.506 5.837 30 20 GKED C(=NN(Cc1ccccc1)Cc1ccccc1)c1cnc([C@H]2CCCO2)s1 755588518 COKHDLAQKMVDDY-OAQYLSRUSA-N 377.513 5.031 30 20 GKED FC(F)(F)c1ccc2sc(NN=Cc3cnc([C@H]4CCCO4)s3)nc2c1 755751435 XWWKBQGDOMMWJS-GFCCVEGCSA-N 398.435 5.069 30 20 GKED N#C[C@H](C(=O)CCCc1csc2ccccc12)C(=O)Nc1ccccc1Cl 756234192 RWAQKHRCTALERU-MRXNPFEDSA-N 396.899 5.225 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3cc(C#N)ccc3O)o2)cc1 759713720 RFXAQBRZMWMSIT-UHFFFAOYSA-N 395.418 5.147 30 20 GKED CC(=NNc1c(Cl)cccc1Cl)c1sc(-c2cccnc2)nc1C 763187998 JYGPHMOUVSVXCZ-UHFFFAOYSA-N 377.300 5.656 30 20 GKED COc1cc2c(cc1NC(=O)[C@@H](C#N)CCc1ccccc1)oc1ccccc12 763991198 DWBIODNSHRVWSJ-QGZVFWFLSA-N 384.435 5.306 30 20 GKED CC(C)c1ccc([C@H]2CCCCN2C(=O)Cc2cccc(OCC#N)c2)cc1 764281853 JNGXWDQQSIFRLR-HSZRJFAPSA-N 376.500 5.009 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)c2ccccc21 767949408 PLQFSMTYYHHXRJ-NRFANRHFSA-N 399.494 5.121 30 20 GKED N#CCOc1cc(F)ccc1NC(=O)N1CCCC[C@@H]1CCCc1ccccc1 774057171 HVSUFULVTFTJHE-HXUWFJFHSA-N 395.478 5.137 30 20 GKED CC(CCCC(F)(F)F)=NNc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1 774344516 RTCUMDMMFKNMSS-UHFFFAOYSA-N 398.450 5.348 30 20 GKED C=C(C)[C@@H](NCc1cc(C)cc(Br)c1O)c1ccc(F)c(F)c1 775318077 DVWOZOAEZQYDAK-QGZVFWFLSA-N 382.248 5.148 30 20 GKED C[C@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1 779028761 BBYJMZFHOAEYLD-BTYIYWSLSA-N 377.488 5.243 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCC(c2cccc3ccccc23)CC1 780669735 LYVSQRFXWYRKBB-SFHVURJKSA-N 399.494 5.542 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccc(Cl)cc1 780677642 GSBNBEJCWSJVAF-UZLBHIALSA-N 397.906 5.780 30 20 GKED FC(F)(F)c1ccc(-c2n[nH]cc2C=NOc2ccccc2C(F)(F)F)cc1 782255158 RCMZUSDTFFBWEQ-UHFFFAOYSA-N 399.294 5.527 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H]2CCCSc3ccc(OC)cc32)c1 783252749 UZMWZVVYBKYALH-DYESRHJHSA-N 382.529 5.093 30 20 GKED C[C@H](NCc1ccc(C#N)cn1)c1ccc(-c2ccccc2Br)s1 783300882 RNTYQKWFNDKLRI-ZDUSSCGKSA-N 398.329 5.295 30 20 GKED O=C1/C(=C/c2ncc(C(F)(F)F)s2)CCc2nc(-c3ccccc3)sc21 788357272 XQKKQNRKIBMURJ-DHZHZOJOSA-N 392.427 5.498 30 20 GKED C=C(C)[C@@H](N[C@@H](C)c1nc(Br)ccc1F)c1ccc(F)c(F)c1 788754553 PXSLBSUUOAZDFC-MGPLVRAMSA-N 385.227 5.229 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3ccc(C)cc3Cl)n2)cc1 790769439 SVFIXMNXKZIGOE-KRWDZBQOSA-N 396.899 5.200 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)c2ccc(Br)cn2)cc1 794835461 KCQXIXRYMVKYKD-KGLIPLIRSA-N 395.728 5.387 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(NC(=O)OC)c1 806451485 HKBRAUHXSWQJHB-UHFFFAOYSA-N 381.476 5.039 30 20 GKED Cc1ccc(C(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cc1NC(=O)OC(C)(C)C 819736698 NKLKWOOPIPZMAA-INIZCTEOSA-N 393.487 5.047 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NC2CCC(OC(F)F)CC2)cc1 836272693 FLLXKHCAOSDUKC-MHJFOBGBSA-N 399.441 5.014 30 20 GKED CC(C)(C)OC(=O)Nc1ccc2c(c1)CC[C@@H]2N[C@H]1CCc2ccc(C#N)cc21 850539024 PTWFAEUEAQKMAR-VXKWHMMOSA-N 389.499 5.170 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1ccc(C(F)(F)F)nc1Cl 862380086 QJJBERSQRKMYDI-ZDUSSCGKSA-N 397.828 5.287 30 20 GKED Fc1ccccc1-c1ccc(C=Nn2c(S)nnc2-c2ccccc2F)s1 912794828 MWLMOEMYUYHDOP-UHFFFAOYSA-N 398.463 5.123 30 20 GKED CC(C)SCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 915101687 GKUXRGAHGBVDIU-LBPRGKRZSA-N 385.341 5.435 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1ccc(C#N)cc1 915350542 XTXUBVRNRSWMNB-UZUQRXQVSA-N 380.451 5.096 30 20 GKED COc1cc(/C=C/C(=O)c2ccc(N3CCCCC3)cc2)cc(Cl)c1OC 916154242 FHDXYQNRDFGJDL-IZZDOVSWSA-N 385.891 5.244 30 20 GKED COc1cc(OC)c(C(=O)/C=C/c2cc(Br)cs2)cc1Cl 916154687 SQRHLPLHTPSEAM-ONEGZZNKSA-N 387.682 5.077 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)CCSc2ccccc2F)cc1 916948964 KUPGCBXNLINALG-QAPCUYQASA-N 398.503 5.169 30 20 GKED C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 921008729 YYLOGULQPJFLLU-KRWDZBQOSA-N 388.442 5.094 30 20 GKED Cc1ccc(Oc2cc(Cl)ccc2C=NNc2ccccc2C(=O)O)c(C)c1 1776031543 LYCQYTUYKHGSOS-UHFFFAOYSA-N 394.858 5.893 30 20 GKED Cc1c(NN=Cc2ccccc2Oc2ccc(F)cc2Cl)cccc1C(=O)O 1776087412 AKQSOPYAFWAPHL-UHFFFAOYSA-N 398.821 5.724 30 20 GKED C=CCCC[C@@H](NCc1ccc(Oc2ccccc2CC)cc1Cl)C(=O)O 1776171421 YINXTMOSSFZGSA-HXUWFJFHSA-N 387.907 5.594 30 20 GKED C[C@@H]1/C(=C/c2c[nH]c3ccc(C(=O)O)cc23)C(=O)c2cccc(Br)c21 1776586501 AADCPPDTSGIUHZ-DOQDJBIESA-N 396.240 5.012 30 20 GKED CCCCCCCOc1ccc(CN[C@H]2CCCC[C@H]2CCC(=O)O)cc1 1776786449 VZCAKNPWQZGMEO-UNMCSNQZSA-N 375.553 5.549 30 20 GKED CCCCCCOc1cccc(/C=C\C(=O)c2cccc(O[C@@H](C)C(=O)O)c2)c1 1776790350 QLXBVJMEHHJCGA-HWOXTHGCSA-N 396.483 5.394 30 20 GKED O=C(O)c1ccc2c(c1)CCC/C(=C/c1cccc(Oc3ccccc3)c1)C2=O 1777683154 XUSUOUDEQOQGEO-RGEXLXHISA-N 384.431 5.780 30 20 GKED C[C@H](NC(=O)c1ccccc1-c1ccccc1C#N)c1ccccc1OC(F)F 25300870 WGEQKMTZPMLVRU-HNNXBMFYSA-N 392.405 5.318 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)CSc1cccc2cccc(Cl)c12 32615179 XOTCLWOQUGJBFR-UHFFFAOYSA-N 380.900 5.116 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CSc3ccc(C)cc3)n2)cc1 66543806 IJBONDXHSPVNIP-SFHVURJKSA-N 394.521 5.096 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N[C@H](C)c1ccccc1Cl 66861321 YTPVAKFDUVAXSD-LSDHHAIUSA-N 387.936 5.024 30 20 GKED CCOc1cc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)ccc1O 72089934 HEDZDYYOBKGIFX-FOWTUZBSSA-N 377.465 5.127 30 20 GKED C=CCn1c(SCc2c(Cl)ccc3cccnc23)nnc1-c1ccncc1 97363076 KUBDHUHVCOCYLP-UHFFFAOYSA-N 393.903 5.020 30 20 GKED CC(C)OCc1cccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 113570208 SCLVZJGPHNZUQE-INIZCTEOSA-N 383.517 5.507 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1 145309898 ORLIONATYXLFCH-SQJMNOBHSA-N 396.490 5.123 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cc(Cl)ccc2F)cc1C 152028865 MQAPLXKFWYZPQA-UHFFFAOYSA-N 396.853 5.125 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1C(F)(F)F)c1nc(-c2ccccc2)cs1 155441691 NRQJZOWRMXQNBM-CYBMUJFWSA-N 387.386 5.075 30 20 GKED C[C@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1cccc(F)c1 172848263 ROMHTQRQCZHDBU-KRWDZBQOSA-N 388.442 5.213 30 20 GKED Cc1cc(C)c2c(c1)CN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)CC2 187132443 CZJCCVBXEVCDPS-KRWDZBQOSA-N 379.529 5.288 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1C[C@H](O)c1ccco1 191447683 LJRHTHXPNQTOGX-ICSRJNTNSA-N 382.504 5.252 30 20 GKED Cc1ccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c(Cl)c1 191530061 CTFCTQRNCFVNLG-UHFFFAOYSA-N 377.831 5.268 30 20 GKED N#CCCn1cc(CNC2CCC(c3ccccc3)CC2)c(-c2ccccc2)n1 237829070 CHJVTZMSMCBCQV-UHFFFAOYSA-N 384.527 5.280 30 20 GKED CCSc1ccc(Cl)cc1NC(=O)CSCc1ccc(C#N)cc1 303256743 OJESFEAULUPGMN-UHFFFAOYSA-N 376.934 5.196 30 20 GKED CC(C)(C)/C(O)=N/C1CCC(/C(O)=N/[C@@H]2CCC(O)=N[C@H]2C(C)(C)C)CC1 329217561 QJNKOQWKTGGAOF-OCUYMYNFSA-N 379.545 5.038 30 20 GKED Cc1cccc(C(C)C)c1N/C(O)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329320315 DXOZFIQJSBODQZ-FQEVSTJZSA-N 380.536 5.834 30 20 GKED CN(C)C(O)=Nc1ccc(/C(O)=N/[C@H]2CCCCC23CCCC3)c(Cl)c1 329638365 WBUREGZFZUBGJE-KRWDZBQOSA-N 377.916 5.255 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CN[C@H](C)c1ccc(C2CC2)cc1 419341194 NYJDSJARVIKOMD-DLBZAZTESA-N 393.556 5.105 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](CC(F)(F)F)C1 421059785 KQDGQEYXMULBIQ-UONOGXRCSA-N 385.455 5.277 30 20 GKED N#CCCC[C@H](NC(=O)NC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1 431927630 ZFVAPAMHSBQSNW-MOPGFXCFSA-N 389.421 5.067 30 20 GKED N#Cc1ccccc1Oc1ccc(NCc2ncccc2C(F)(F)F)cc1F 432300297 FIAAMYPHWBDHKA-UHFFFAOYSA-N 387.336 5.516 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 433658611 CGRIZORBGAUHGU-AWEZNQCLSA-N 393.274 5.148 30 20 GKED C=CCC[C@H](NC(=O)N1CCC(C(=O)c2ccc(F)cc2)CC1)c1ccccc1 434279981 KOTQGEDGOJYGGJ-QFIPXVFZSA-N 394.490 5.138 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC[C@](C)(CCc3ccccc3)C2)cc1 435137156 BNTMHULCJXIAOO-DEOSSOPVSA-N 375.516 5.364 30 20 GKED Cc1ccc([C@H]2CCCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 438060169 PMOREFNJZVDJCL-WIYYLYMNSA-N 393.556 6.006 30 20 GKED N#CCC[C@H](NC(=O)N1Cc2ccccc2-c2ccccc2C1)c1ccccc1 438865641 RXZVMUHPGJHAHF-DEOSSOPVSA-N 381.479 5.424 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(F)(c3cccc(OC)c3)CC2)c1 439536706 WKLAXESDGQOJAA-UHFFFAOYSA-N 398.478 5.143 30 20 GKED N#CCCC[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1ccccc1 452139006 LUYDNPRTTCWUET-ZCNNSNEGSA-N 386.417 5.360 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCC[C@@H]1Cc1ccccc1)c1ccccc1 458804638 SRLGGQKUNGZKPY-PKTZIBPZSA-N 375.516 5.228 30 20 GKED C[C@@H](c1cccc(C#N)c1)c1nc(C(F)(F)c2ccc(Cl)c(Cl)c2)no1 463054870 SBGNRKYRNLHUNP-JTQLQIEISA-N 394.208 5.540 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cn(-c3ccc(Cl)cc3)nc2C)c1 463560553 VDMJLCDOBFPSNQ-UHFFFAOYSA-N 381.863 5.041 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)c2c1 464468192 MLVGKRRJRMSYRA-QGZVFWFLSA-N 395.384 5.325 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)Nc1ccc(C#N)c(F)c1 464649661 NSKDSEUBHORQBI-UHFFFAOYSA-N 390.201 5.220 30 20 GKED Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2cn(CCCC#N)c3ccccc23)C1 469451536 CFTVQVDGJLLQQQ-PMACEKPBSA-N 385.511 5.272 30 20 GKED C[C@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)CC[C@H]1c1ccccc1 469454571 LQZWDIFJKXRWOT-PZJWPPBQSA-N 385.511 5.211 30 20 GKED Cn1c(-c2cccc(NC(=O)C[C@@H](CC#N)c3ccccc3)c2)nc2ccccc21 475166996 ZHOWLQYJJDEQTH-LJQANCHMSA-N 394.478 5.266 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)cc1 482650965 UPUYOAWBPKPMQM-QGZVFWFLSA-N 386.451 5.192 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)Nc1ccccc1SC[C@@H](C)C#N 483469235 FXEKNWFOVGYPEP-HNNXBMFYSA-N 391.496 5.408 30 20 GKED C=CCSc1ccccc1NC(=O)CNc1ccc(Oc2ccccn2)cc1 487381037 QTDBEUURVMPIEJ-UHFFFAOYSA-N 391.496 5.203 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H](CC)c1ccc(Cl)s1 497480133 JHGRTEBLXWNNGH-MRXNPFEDSA-N 394.972 5.418 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccccc1Cl)c1ccc(C(F)(F)F)cc1 499958789 PRQMXOFEACVNJM-PXAZEXFGSA-N 380.797 5.233 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1cnn(-c2ccccc2)c1 502748424 XTMVTFRAFQWATP-UHFFFAOYSA-N 394.434 5.097 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H](C(=O)c2ccc(F)cc2)C1 505058284 RYMTVYJINTWTJT-LJQANCHMSA-N 380.463 5.071 30 20 GKED CC(C)CN(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CCCC1 513498938 KIYJDAXBEHSHDZ-UHFFFAOYSA-N 376.500 5.178 30 20 GKED C=CCN(C(=O)c1ccc(C)c(C)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514616850 SITZJDNVBCRCOP-UHFFFAOYSA-N 393.468 5.168 30 20 GKED C=Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cc1 519194150 SOFIQTCUWCHAFW-UHFFFAOYSA-N 376.403 5.606 30 20 GKED N#CCCCOc1cccc(CNCc2ccccc2Oc2cccc(F)c2)c1 520228734 HRMRJQMURIJCGT-UHFFFAOYSA-N 390.458 5.590 30 20 GKED C=CCC(F)(F)c1nc(-c2ccccc2-c2ccc(Cn3cccn3)cc2)no1 520851057 SEEDCQIWLMNDOK-UHFFFAOYSA-N 392.409 5.316 30 20 GKED COc1ccc(C[C@@H](N[C@H](C#N)C2CCCCC2)c2ccccc2)cc1OC 522380939 URIGOTSZXBNVCC-FGZHOGPDSA-N 378.516 5.050 30 20 GKED CCN(C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 523113497 WVZBHFSUAWPNHQ-HOTGVXAUSA-N 388.433 5.365 30 20 GKED CCOCc1cccc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1 523270679 JBRPCOZOYOBHDC-UHFFFAOYSA-N 388.492 5.498 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)C[C@@H](C)O1 523628430 NCNYTIIANFMLBH-ZTNFWEORSA-N 397.906 5.027 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Cc1c[nH]c2cc(Cl)ccc12 524316690 UCNPMGXADBGWSF-UHFFFAOYSA-N 379.312 5.294 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)c1ccc(OCC(F)(F)F)cc1 524391005 PYTJYMCDOIPVBP-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1ccc(-n2c(S[C@H](C#N)C3CCCCC3)nnc2-c2ccncc2)cc1 524534659 DGRZZQVFQTZDPT-HXUWFJFHSA-N 389.528 5.202 30 20 GKED CC[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)N(CC)CC 531050484 LQGVCPDBGHVWCG-CTNGQTDRSA-N 383.923 5.054 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(Oc3ccc(C(C)=O)cc3)cc2)s1 534819586 NHDLOLKZYXCWHD-UHFFFAOYSA-N 390.464 5.429 30 20 GKED C=CCC[C@H](NCc1csc(COc2ccc(F)cc2)n1)c1ccccc1 538257316 XYIKOVBSEJFZRL-NRFANRHFSA-N 382.504 5.658 30 20 GKED Cc1nc(-c2ccc(F)c(F)c2)sc1C(=O)Nc1ccc(C(C)(C)C#N)cc1 538679765 JYGOFNNYDKZSLV-UHFFFAOYSA-N 397.450 5.450 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)C2CC2)cc1 541473003 ZRJPXBUGSUMLNW-UHFFFAOYSA-N 393.462 5.215 30 20 GKED N#CCc1ccc(CSCc2nc(-c3ccc(C(F)(F)F)cc3)no2)cc1 544083462 DWVFFGCMCYQSBP-UHFFFAOYSA-N 389.402 5.255 30 20 GKED N#Cc1ccc(NC(=O)N2CCCC[C@H]2c2nc3ccccc3o2)cc1Cl 547827143 PIQVGCFTZDTPOQ-KRWDZBQOSA-N 380.835 5.112 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CCc1ccc(-c2ccccc2)o1 553106091 PVDSKFHNQOOSER-UHFFFAOYSA-N 391.515 5.262 30 20 GKED CC(C)c1cccc(-c2ccc(C(=O)N3CCC(C#N)(c4ccccn4)CC3)o2)c1 558587990 LNEKYGCSSKMOGR-UHFFFAOYSA-N 399.494 5.163 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N1CCC(CC(F)(F)F)CC1 560824800 HNBVWLWJKHOFNO-UHFFFAOYSA-N 388.389 5.155 30 20 GKED CSC[C@H]1CCCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)C1 561901102 QRGVLXFIADISPM-IBGZPJMESA-N 396.581 5.066 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N[C@H]3CCCc4sccc43)cc2)ccn1 562108893 MWNWKOKJLMIQJU-IBGZPJMESA-N 390.468 5.006 30 20 GKED Cc1ccc(CN[C@H](c2cccc(C(F)(F)F)c2)C2CCOCC2)cc1C#N 599405582 ZYXZISHCISALSY-NRFANRHFSA-N 388.433 5.143 30 20 GKED C[C@H](Nc1cc(C(=O)N(C)c2ccccc2)ccc1Cl)c1cccc(C#N)c1 600851552 JFQHXTXEHHDBOC-INIZCTEOSA-N 389.886 5.661 30 20 GKED Cc1cccc2sc(C(=O)Nc3cccc(OCCCC#N)c3)c(Cl)c12 603972033 DETPOGWPDONDOO-UHFFFAOYSA-N 384.888 5.798 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)c2cc(C)sc2C)cc1 604569108 WRVURLXHUPQWMY-UHFFFAOYSA-N 378.453 5.290 30 20 GKED C[C@@H](NC(=O)c1cc2ccccc2n1CC#N)C(c1ccccc1)c1ccccc1 609164139 YKHAPUPWBKOSDM-LJQANCHMSA-N 393.490 5.115 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609207951 QPNGAODVAMRAJT-UHFFFAOYSA-N 383.879 5.221 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCc1ccc(F)cc1 609378540 OACFVJNRPORPIX-UHFFFAOYSA-N 396.409 5.422 30 20 GKED C[C@H](Cc1ccccc1F)C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1 609968130 HQJUPNLJLCCRNR-QGZVFWFLSA-N 388.442 5.094 30 20 GKED C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(-c2ccccc2)s1 612571059 OGBLIBZZJFQTAA-KRWDZBQOSA-N 388.540 5.001 30 20 GKED N#C[C@H](C(=O)c1cc2ccc(F)cc2s1)c1nc(-c2ccccc2)cs1 613392435 OHWOSIDHQKIXNB-OAHLLOKOSA-N 378.453 5.654 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CSc2ccc(Br)cc21 618807998 DLOMYRQDMSRTBK-ZWKOTPCHSA-N 385.330 5.135 30 20 GKED N#CC[C@H](CC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1ccccc1 619429880 ZPGNGENZDLQNQW-MRXNPFEDSA-N 397.450 5.038 30 20 GKED C[C@@H]1C[C@@H](NCc2ccc(C#N)c(Cl)c2)c2cccc(Br)c21 619755346 XNXNNHJFDQUSEZ-PIGZYNQJSA-N 375.697 5.312 30 20 GKED OCc1ccc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cc1 647633884 GAXNLNAENZYMAQ-UHFFFAOYSA-N 381.291 5.080 30 20 GKED CC(C)c1ncsc1C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 651606967 VQVFMSBHGPAVAX-JTQLQIEISA-N 395.431 5.385 30 20 GKED N#C[C@@H](C(=O)c1ccc2ncccc2c1)c1nc2cc(C(F)(F)F)ccc2s1 677560353 YZGSFQNKNXVIBZ-AWEZNQCLSA-N 397.381 5.353 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cccc(F)c1F 678944653 FHXGXUAVTJHJFJ-GUBZILKMSA-N 375.303 5.525 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](c2ccccc2)c2ccc(OCC)cc2)c1 726456896 ICWUDLRIWTUMNB-QHCPKHFHSA-N 386.520 5.143 30 20 GKED C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726484359 KRDZTZRPABVJQX-JTQLQIEISA-N 398.746 5.908 30 20 GKED N#CCCCOc1cccc(/C=C2\CC/C(=C/c3cccc([N+](=O)[O-])c3)C2=O)c1 726743660 NSIXHXNEPRCJPU-LRVMPXQBSA-N 388.423 5.107 30 20 GKED CC(=O)CCc1ccc2oc(C(=O)N(CCC#N)c3ccc(C)cc3)c(C)c2c1 726941554 CUVGHDPNWQMLKZ-UHFFFAOYSA-N 388.467 5.132 30 20 GKED C#Cc1cccc(NC(=O)c2cccc(COc3ccc(CCC(C)=O)cc3)c2)c1 727301406 WUDZZVGEBUTAFT-UHFFFAOYSA-N 397.474 5.021 30 20 GKED CC(=NNc1nc2cc(F)c(F)cc2[nH]1)c1sc(-c2ccc(C)cc2)nc1C 727651158 KQOZKPVPYOPOHA-UHFFFAOYSA-N 397.454 5.418 30 20 GKED O=C1/C(=C\c2cccc([N+](=O)[O-])c2)CC/C1=C\c1nc(-c2ccccc2)cs1 727973919 DGAMXSGKRRGAQB-YIMYCEAYSA-N 388.448 5.548 30 20 GKED Cc1ccc(C)c(CC(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)c1 728146776 GMIOYCILURYFHB-OAHLLOKOSA-N 382.435 5.124 30 20 GKED CCCCN(C)c1ccc(NC(=O)Nc2cccc(OCCCC#N)c2)cc1 733633030 PFCRFPDDYXUHGS-UHFFFAOYSA-N 380.492 5.249 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(OC)c([N+](=O)[O-])c2)cc1 741468751 HLVBYYBPPQWCRH-QPEQYQDCSA-N 389.407 5.175 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1O)C1CCCCC1 743124214 LRCZAEHESSAXKC-UHFFFAOYSA-N 393.487 5.029 30 20 GKED CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744035995 VCEVWKJAPUZHSX-UTXMOHQDSA-N 390.936 5.500 30 20 GKED Fc1cccc(C=NOCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c1 744180600 UMSIKMBCZBANCA-UHFFFAOYSA-N 380.366 5.519 30 20 GKED N#Cc1ccc(CN(C(=S)Nc2ccc(SC(F)F)cc2)C2CC2)cc1 745652462 CFSXMEOSMYKZTO-UHFFFAOYSA-N 389.496 5.234 30 20 GKED C=CC[C@@H](NC(=O)NCC[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccncc1 746420410 DTPDCHSYENHNAD-DNVCBOLYSA-N 391.437 5.211 30 20 GKED N#CCC[C@@H](NC(=S)Nc1ccc(SC(F)F)cc1)c1ccccc1 747711274 ZOPZSGZUWRYAEA-MRXNPFEDSA-N 377.485 5.333 30 20 GKED N#CCCN(Cc1ccco1)C(=O)/C=C/c1ccc(-c2ccccc2Cl)s1 749380386 VROQKTLISRZUAT-PKNBQFBNSA-N 396.899 5.617 30 20 GKED O=C1/C(=C/c2cnc(-c3ccncc3)s2)CCc2c(Cl)sc(Cl)c21 760266191 YSVPOBACOBOLBI-JXMROGBWSA-N 393.320 5.786 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(-c3ccc(C4(C#N)CC4)cc3)n2)nc1 762388272 CXAFZRHRMCAELV-UHFFFAOYSA-N 376.485 5.244 30 20 GKED O=C(/C=C/c1cncs1)c1ccc(-c2ccccc2Br)s1 767722950 UQGSZNCJPWJMOZ-AATRIKPKSA-N 376.300 5.530 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(SC(F)(F)F)cc3)CC2)cc1 767969272 HUVXFILGYYLTQB-UHFFFAOYSA-N 388.414 5.100 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1cc(Cl)ccc1OCC#N 769990916 PUVFTMBQUSCHDV-KRWDZBQOSA-N 382.813 5.334 30 20 GKED O=C(/C=C/c1ncc(-c2ccccc2)s1)c1sccc1Br 770572881 MUGVOYKOVRNIBN-VOTSOKGWSA-N 376.300 5.530 30 20 GKED N#C[C@@H](C(=O)CCCC(F)(F)F)c1nc2cc(C(F)(F)F)ccc2s1 771260335 GDJHAMRINOZQGN-VIFPVBQESA-N 380.313 5.224 30 20 GKED COc1ccc(NC(=S)Nc2ccc(Oc3ccccc3)c(C#N)c2)cc1 777476344 JVUIFFVRSLSHDN-UHFFFAOYSA-N 375.453 5.168 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ncccc3C(F)(F)F)cc2)c1 779594400 JLSBHIKIWUXMMF-UHFFFAOYSA-N 383.373 5.163 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1ccc2ccccc2c1)C1CC1 780681825 PYZZNVFQCDPIGW-QGZVFWFLSA-N 385.467 5.327 30 20 GKED CSc1cc(Br)ccc1/C=C\C(=O)c1ccc(C#N)cc1F 781107576 IEVJUYKIZVDWLR-DAXSKMNVSA-N 376.250 5.078 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c[nH]c2ccccc12 782548044 ZOEFURITNHNTQC-WZONZLPQSA-N 393.490 5.956 30 20 GKED N#Cc1cccc(COc2ccc(NCc3ccc4cnccc4c3)cc2F)c1 787268246 QYBRXIGDFHZFEO-UHFFFAOYSA-N 383.426 5.437 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C1CC1 789890412 QNTVQNJDFJTAJD-LJQANCHMSA-N 386.536 5.170 30 20 GKED N#C[C@H](C(=O)C12CC(c3ccccc3)(C1)C2)c1nc2cc(Cl)ccc2s1 791780092 VAABMUFRWAADFU-TVRCVXMWSA-N 378.884 5.248 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(OCC(F)(F)F)c(Cl)c2)cc1 800290837 VGRDFYRXJWRYKH-LBPRGKRZSA-N 384.785 5.184 30 20 GKED Cc1cc(F)cc2c1CN(C(=O)Nc1ccc([C@@H](C#N)c3ccccc3)cc1)CC2 800519516 QOXOKZGBFJKPSS-QHCPKHFHSA-N 399.469 5.380 30 20 GKED COc1c(O)cccc1/C=C(\C(=O)c1nc2ccccc2s1)c1ccccc1 810232321 YCSYLFUFGAUJRZ-VKAVYKQESA-N 387.460 5.434 30 20 GKED COCc1ccccc1/C=C(C)/C=C\C(=O)c1cnn(-c2ccc(C#N)cc2)c1C 814190363 RMAYQGRKVIJALD-PDOXAQQQSA-N 397.478 5.041 30 20 GKED CC(C)(Cc1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 838965549 YIWABRZRVURLHJ-HNNXBMFYSA-N 380.797 5.199 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2sccc2-c2ccccc2)cc1 915087906 BQRUCPNODUZEOI-QHCPKHFHSA-N 394.499 6.323 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)[C@H](C#N)c1nc2ccccc2s1 916847415 GTPDPBCOGZUKRM-RDJZCZTQSA-N 378.497 5.372 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(Cl)c2)CCCC1)c1nc2ccccc2s1 916847990 ZTCYPTBYGAEWMN-MRXNPFEDSA-N 380.900 5.638 30 20 GKED N#C[C@@H](C(=O)CCCc1cccs1)c1nc(-c2c(F)cccc2F)cs1 920803781 CHYOEMXLQLIPGW-ZDUSSCGKSA-N 388.464 5.349 30 20 GKED O=C(O)c1cccc(COc2cccc(C=NNc3cccc(Cl)c3)c2)c1 1776032675 IWXFPUPMUWNFDG-UHFFFAOYSA-N 380.831 5.063 30 20 GKED CC[C@@H](C)CN(C)c1ccc(F)cc1C=NNc1ccc(Cl)c(C(=O)O)c1 1776033478 OETNVBLDBHWRIL-CYBMUJFWSA-N 391.874 5.106 30 20 GKED C=CCCC1(C(=O)O)CCN(c2ncnc3scc(-c4cccs4)c23)CC1 1776170302 IBMSPOSVGRPBIE-UHFFFAOYSA-N 399.541 5.057 30 20 GKED CCCCCCCOc1ccc(/C=C\c2ccc3cc(C(=O)O)ccc3n2)cc1 1776785902 NVMMAXRXLOHSCF-GHXNOFRVSA-N 389.495 6.453 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](Cc2ccc(C)cc2)C(=O)O)cc1 1776786294 MKVDLUBRXIZELV-QHCPKHFHSA-N 397.559 5.377 30 20 GKED CCCCCCCOc1ccc(CNC[C@]2(CC(=O)O)CC[C@@H](C)C2)cc1 1776786375 TYUYBBMEYLXOQV-AUSIDOKSSA-N 375.553 5.407 30 20 GKED CN(C)c1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1777038865 PTXATMFYTJMIOB-BENRWUELSA-N 377.465 5.075 30 20 GKED Cc1oc2ccccc2c1C(=O)/C=C/c1ccc(-c2cccc(CC(=O)O)c2)cc1 1777559803 DXADDBKQONCJFE-SDNWHVSQSA-N 396.442 5.931 30 20 GKED N#CCc1ccc(NC(=O)COc2ccc(-c3ccccc3)cc2Cl)cc1 5320784 KMPDSGBOVNEISK-UHFFFAOYSA-N 376.843 5.091 30 20 GKED Cc1ccc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2c(C)cccc2C)c1 22693995 SIHZXRFJJRAVNL-UHFFFAOYSA-O 395.573 5.320 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 41502572 GXCIGIUWFHMZSF-CQSZACIVSA-N 375.478 5.218 30 20 GKED N#C[C@@H](C(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)c1nc(-c2ccc(Cl)cc2)cs1 41514449 JJOLIBVQVBFBHM-MYSGWJLTSA-N 398.915 5.035 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)CCCc1ccc2c(c1)-c1ccccc1C2 64388660 ILWWOAUGFBVMFT-UHFFFAOYSA-N 380.491 5.111 30 20 GKED CCOc1c(OC)cc(/C=C/C(=O)c2ccc(Cl)c(Cl)c2)cc1OC 72067719 CRIOSCMJBBPVJS-VMPITWQZSA-N 381.255 5.305 30 20 GKED N#CCCCOc1cccc(CN[C@H](CC(F)(F)F)c2ccc(F)cc2)c1 92851018 ONCNAGLCQVZKRU-LJQANCHMSA-N 380.385 5.292 30 20 GKED CC(C)CC(=O)Nc1ccc(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 113539743 LWHNNOBBQASEHZ-UHFFFAOYSA-N 378.476 5.116 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 116594571 AQMLLKREYJPOBW-JXFKEZNVSA-N 385.492 5.360 30 20 GKED C[C@@H](Nc1cccc(Oc2ncc(Br)cn2)c1)c1ccc(C#N)cc1 120869325 PRUDKEQSWGAIKM-CYBMUJFWSA-N 395.260 5.076 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2cnc([C@H]3CCCO3)s2)s1 134285049 PUKHEXXOGVYLTI-CYBMUJFWSA-N 394.566 5.001 30 20 GKED COc1ccc(CNc2cccc(-c3csc(C)n3)c2)cc1OCCCC#N 155740004 GTASOUXKZDGBTG-UHFFFAOYSA-N 393.512 5.422 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2occc2CSc2ccccc2)n1 177763400 PQSJWQJFVPYHHA-INIZCTEOSA-N 382.510 5.642 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3cc(Br)ccc3o2)n1 177767969 NGNVEDYYHUVKEO-GFCCVEGCSA-N 389.274 5.265 30 20 GKED CCN(C(=O)c1csc(Cc2ccccc2F)n1)c1ccc(C#N)c(Cl)c1 179534214 QVMWVIJNROTHFY-UHFFFAOYSA-N 399.878 5.065 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N(CC#N)c1ccccc1 180954853 KEXXUABYUJMURF-UHFFFAOYSA-N 386.238 5.127 30 20 GKED Cc1ccc(OCc2ccc(C(=O)Nc3ccccc3O[C@@H](C)C#N)o2)c(C)c1 182102464 ODCIEUURCGCXON-KRWDZBQOSA-N 390.439 5.019 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2ccc(F)c(C)c2)C1 191450023 CLXKUPIORCZXAH-JOCHJYFZSA-N 396.506 5.591 30 20 GKED COc1cc(/C=C\C(=O)c2cccs2)ccc1OCc1ccc([N+](=O)[O-])cc1 211718927 BGWXXCNBPZKIHD-POHAHGRESA-N 395.436 5.140 30 20 GKED CC(C)c1nc([C@@H]2CCCCN2CC(O)=Nc2cc(Cl)ccc2Cl)n[nH]1 329723050 BCYDAFZIOSAROX-HNNXBMFYSA-N 396.322 5.050 30 20 GKED C[C@@H](NCc1ccc(OC(F)(F)F)c(Br)c1)c1ccc(C#N)cc1 392289497 PZVZWSZIQJIGPV-LLVKDONJSA-N 399.210 5.070 30 20 GKED Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)C(C)(C)Cc1ccc(C#N)cc1 410471618 QSCZIHQIJOCHKM-UHFFFAOYSA-N 391.515 5.059 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@@H]1CCCC(F)(F)C1 426092233 PZOBFKLGNMXSJK-MRXNPFEDSA-N 385.414 5.358 30 20 GKED O=C(Nc1cccc(C#Cc2ccccn2)c1)c1c(Cl)cc(F)cc1Cl 431358144 KMIKIZUATFJHOR-UHFFFAOYSA-N 385.225 5.180 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCC(=O)c2cccs2)cc1F 437460929 STGOBEWTMAVEDP-UHFFFAOYSA-N 394.427 5.153 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(=O)Nc2cc(C#N)ccc2OC(F)F)cc1 437967824 ASHCNMSDDZRMQL-SFHVURJKSA-N 385.414 5.227 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)NCC2CCC(C#N)CC2)cc1 441001332 SMGVNZIXIKCRRR-VIQWUECVSA-N 391.515 5.052 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1)Cc1nnc(-c2ccc(C#N)cc2)o1 441273254 BUIPXZRXPOPLHA-LJQANCHMSA-N 394.478 5.372 30 20 GKED C=CCn1c(SCc2noc(C3CCCCC3)n2)nnc1-c1ccccc1C 448036967 ASWZYLIQSBWOBD-UHFFFAOYSA-N 395.532 5.163 30 20 GKED N#CC[C@@H]1CC[C@H](NC(=O)CS[C@H](c2ccccc2)c2ccc(Cl)cc2)C1 452563387 SAHDWYMZNIMFTP-XUEUYAKLSA-N 398.959 5.361 30 20 GKED CC(C)C1CCN(C(=O)c2ccccc2SCc2ccc(C#N)cc2)CC1 461417136 BPYNEPQZYBCHKV-UHFFFAOYSA-N 378.541 5.359 30 20 GKED C[C@@H](C(=O)N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1)c1cccc(C#N)c1 462452399 QFMRKDLBHTUIDM-DNVCBOLYSA-N 386.417 5.087 30 20 GKED C[C@@H](SCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)c(Cl)c1 463201676 WMUDJQYRXJOFJA-LLVKDONJSA-N 390.295 5.909 30 20 GKED C[C@@H](C(=O)N(Cc1ccco1)C12CC3CC(CC(C3)C1)C2)c1cccc(C#N)c1 463383758 CGUOWOHTPVQJPU-PYZOSGAUSA-N 388.511 5.252 30 20 GKED CN(C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)[C@H]1CCCC[C@H]1C(F)(F)F 463763614 KNGSVCMPCMJMHX-OCCSQVGLSA-N 393.331 5.162 30 20 GKED Cc1[nH]c2ccc(Cl)cc2c1C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 464477112 RIZVEQOIEJVGFY-ZDUSSCGKSA-N 377.753 5.034 30 20 GKED N#CCSCCCSc1nc2ccccc2c(=O)n1CCC1=CCCCC1 466608266 CYGRAPQDANSKQB-UHFFFAOYSA-N 399.585 5.026 30 20 GKED C=CCC[C@@H](NC(=O)CCc1nc(C)cs1)c1ccc(C(F)(F)F)cc1 469691696 SGFYBWDKKIKGQA-MRXNPFEDSA-N 382.451 5.227 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCc1oc2ccccc2c1OC 473722853 MQQZCWWBKCAUCJ-UHFFFAOYSA-N 390.892 5.054 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)Cc1ccccc1C(F)(F)F 473762456 GEBUSJFVHCMTDK-UHFFFAOYSA-N 397.462 5.499 30 20 GKED N#CC[C@H](CC(=O)N(Cc1ccc2c(c1)OCO2)c1ccccc1)c1ccccc1 475647844 SMBUJHYIJLTIHE-OAQYLSRUSA-N 398.462 5.036 30 20 GKED Cc1c([C@H](NCc2cccc(OCCCC#N)c2)C(C)C)oc2ccccc12 482145702 YYALEPYRSNNUBB-HSZRJFAPSA-N 376.500 5.911 30 20 GKED O=C(NCCCc1cccc(C(F)(F)F)c1)c1ccc(F)cc1C(F)(F)F 487192259 LWPCLWKXSXUPMD-UHFFFAOYSA-N 393.302 5.226 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc(F)c4ccccc4c3)n2)cc1 497367974 WNVACTQTPKRPDT-IBGZPJMESA-N 397.434 5.464 30 20 GKED Cc1nc(CN2CC=C(c3ccc(C#N)cc3)CC2)oc1-c1ccc(Cl)cc1 502554033 NRYKXWJVNVNDOE-UHFFFAOYSA-N 389.886 5.464 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)Nc1ccc(F)cc1F 517168807 LGZAGISXXAFOPT-AWEZNQCLSA-N 393.393 5.068 30 20 GKED COc1ccc2cc(C(=O)Nc3ccc(Oc4cccc(C#N)c4)cc3)[nH]c2c1 517515065 FOVWARZHPTVDLN-UHFFFAOYSA-N 383.407 5.093 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)[C@@H](C)Nc1ccccc1SC[C@@H](C)C#N 520832415 JIXHOZINFDNGAJ-RBUKOAKNSA-N 395.572 5.176 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)Sc1ccc(Cl)cc1 520924080 HYOUINZVLLJOHZ-ZIAGYGMSSA-N 390.961 5.854 30 20 GKED Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520941366 LMRQSEOYPPBPEK-MAUKXSAKSA-N 397.544 5.818 30 20 GKED Cc1ccc(N(CCC#N)S(=O)(=O)c2ccc3oc4ccccc4c3c2)cc1 521265349 BRASLHXAUCTQJF-UHFFFAOYSA-N 390.464 5.003 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(Sc3ccccc3)CCCC2)c1 521926811 GFKNUQWKFCGFLX-UHFFFAOYSA-N 380.513 5.413 30 20 GKED CSc1cccc([C@@H](NCc2cc(C#N)cs2)c2ccc(F)c(F)c2)c1 530640510 DPJLBJAVFDKVEO-HXUWFJFHSA-N 386.492 5.499 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(Cl)c(OCC(F)(F)F)c(Cl)c2)cc1 534970892 LKBJGFZIHNMATP-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C[C@@H](N[C@H](CC(F)(F)F)c1ccc(F)cc1)c1ccc(F)cc1OC(F)F 536838906 MXLPDIVTEBZFMJ-MEBBXXQBSA-N 395.318 5.911 30 20 GKED CC[C@H](NCc1ccc(C#N)cc1OC(F)F)c1ccccc1OC(F)F 539253665 YEDSIXGXAWPKLX-HNNXBMFYSA-N 382.357 5.002 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)c1cccc(OCc2ccccn2)c1 540704831 AXEZBJOYDIXCQN-DLBZAZTESA-N 375.447 5.083 30 20 GKED C[C@H](NC(=O)N(C)[C@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 543944204 IUYUWQVNJCIFIZ-ZWKOTPCHSA-N 399.494 5.394 30 20 GKED Cc1ccc(C(=O)CCCCC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cc1 546089829 DAIFCERRHYHOEX-XZOQPEGZSA-N 388.511 5.037 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3ncccc3Cl)cc2Cl)c1 550605399 LWLGMDXKDGDPSL-UHFFFAOYSA-N 398.249 5.091 30 20 GKED Cc1sc(NC(=O)c2cc(C#N)ccc2Cl)nc1-c1cccc(Cl)c1 551944807 WCBBSSHGXJCXPI-UHFFFAOYSA-N 388.279 5.549 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccc3cccnc23)cc1)c1nccc2ccccc12 556933573 HXEVMVWKZNJECK-DEOSSOPVSA-N 399.453 5.940 30 20 GKED CC[C@@H](c1cccc(OC)c1)N(C)C(=O)Nc1ccccc1SC[C@@H](C)C#N 566526631 MQRHDGJTSXUXHB-JXFKEZNVSA-N 397.544 5.562 30 20 GKED N#Cc1cc(Oc2ccc(NCc3ccc(OCC(F)(F)F)cc3)cc2)ccn1 573886426 MOPKWZDVLAKWOR-UHFFFAOYSA-N 399.372 5.299 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 590122689 PYFJMTUZXPNXKG-OAQYLSRUSA-N 379.504 5.558 30 20 GKED CC(C)Sc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)cc1 603962097 ZGBZJHZIDHSZOP-UHFFFAOYSA-N 389.480 5.498 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)CCc2ccc(Cl)cc2Cl)c1 609066409 JBXFMTRXHGETHO-UHFFFAOYSA-N 385.197 5.038 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)c1 609073386 FHSIRZWRYAFEII-UHFFFAOYSA-N 394.430 5.650 30 20 GKED Cc1cc(C(=O)N[C@H](C)CC#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 610165564 RXQZRLPOEAWKHE-ZIAGYGMSSA-N 390.314 5.507 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N[C@@H](C)c1cccc(C#N)c1 610324916 YQIOXHVXZYJOEO-SFHVURJKSA-N 385.467 5.328 30 20 GKED C[C@@H](NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1cccc(C#N)c1 610363389 ZBVBDIYYIBVWMG-CYBMUJFWSA-N 398.434 5.379 30 20 GKED N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H](Cc1ccc(Cl)cc1)c1ccccn1 611395011 DMVYRMLXPUNOSC-LADGPHEKSA-N 387.914 5.558 30 20 GKED Cc1ccc(-c2nc3c(s2)[C@@H](N[C@@H]2CCc4cc(C#N)ccc42)CCC3)cc1 618805750 KFBSDHMNTXLTLB-RTWAWAEBSA-N 385.536 5.645 30 20 GKED N#Cc1ccc(CCC(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1 619124641 BWIJUJSAZMHUCI-UHFFFAOYSA-N 389.436 5.106 30 20 GKED CC[C@H](C(=O)NCc1ccc(C#N)c(Cl)c1)c1cccc(C(F)(F)F)c1 619765803 IKXLISCFSLGBHL-INIZCTEOSA-N 380.797 5.040 30 20 GKED C=CCOc1c(Cl)cc(CN[C@@H](C)c2cn(C(C)(C)C)nc2C)cc1OC 623494636 YALZWWNKXIEYMR-AWEZNQCLSA-N 391.943 5.024 30 20 GKED C=CCSc1ccccc1NC(=O)CSc1nc(C)c(C)n1CCCC 629959777 XEQFDBUHWFRKMU-UHFFFAOYSA-N 389.590 5.309 30 20 GKED CCN(C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cccc(F)c1 642076065 DDNWCOSJJMQPCZ-UHFFFAOYSA-N 379.275 5.530 30 20 GKED CC1(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)CCC(F)(F)CC1 666802937 OIMGOAHOVLQAGN-UHFFFAOYSA-N 398.338 5.307 30 20 GKED C=CC[C@@H](C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 681649282 OWWALXZCSNRVNA-FXUDXRNXSA-N 393.371 5.372 30 20 GKED C=CCN(C(=O)c1cc2cc(C)ccc2nc1C)c1nc(-c2ccccc2)cs1 684809247 QLKGGOUWZKEUFV-UHFFFAOYSA-N 399.519 5.808 30 20 GKED CN(Cc1ccc(Cl)c(Cl)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 726443341 CYKMVBOVAYEZPE-UHFFFAOYSA-N 384.719 5.347 30 20 GKED O=C(/C=C/c1nccn1CC(F)(F)F)c1ccc(Cl)c(Cl)c1Cl 727745294 WPYVRMRERSYQFH-ONEGZZNKSA-N 383.584 5.302 30 20 GKED C#Cc1cccc(N(C)C(=O)c2cc3ccc(OCc4ccccc4)cc3[nH]2)c1 728537061 WODQFUQKIWVGQT-UHFFFAOYSA-N 380.447 5.005 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(SC(F)(F)F)cc1 731332569 OPLYFJSJUZFWAW-GFCCVEGCSA-N 396.459 5.945 30 20 GKED COc1ccc2oc(C)c(C(=O)N[C@@H](C#N)c3ccc(Cl)c(Cl)c3)c2c1 731645897 UGJMDUIFWJAKRR-INIZCTEOSA-N 389.238 5.051 30 20 GKED C#CC[C@@H](OC(=O)c1sc(-c2ccc(Cl)s2)nc1C)c1ccccn1 733692226 RDMHGSJWBKVUHY-CYBMUJFWSA-N 388.901 5.150 30 20 GKED C[C@H](NCc1cccc(OCc2ccccc2C#N)c1)c1nc2ccccc2s1 734163714 GXRNKZQVPCIOMI-KRWDZBQOSA-N 399.519 5.598 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(SC(F)F)cc2)c(Cl)c1OC 734981702 SCDDCHVIKBNNLQ-WEVVVXLNSA-N 384.831 5.568 30 20 GKED C=CCn1c(-c2ccco2)nn(CN2C[C@H](c3ccccc3C)C[C@@H]2C)c1=S 738054316 NMCXKOPVXSCVAS-ZWKOTPCHSA-N 394.544 5.004 30 20 GKED C[C@H](C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1)c1cccs1 738788259 AFSPUYWKGNRDBW-SFHVURJKSA-N 375.493 5.295 30 20 GKED CCOc1ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)cc1 740427547 MYDHVHATZSZDFS-UHFFFAOYSA-N 377.469 5.007 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SCC(F)F)cc2)cc(Cl)c1O 741841215 DUQWRNKYRUYXTQ-UQCOIBPSSA-N 384.831 5.308 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1ccc(-c2ccncc2)cc1 745198091 DRCFQIJVWOYLAB-UHFFFAOYSA-N 379.423 5.274 30 20 GKED COc1ccc(-c2ccc(C(=O)N[C@@H](CCC#N)c3ccccc3)c(F)c2)cc1 749033598 DUCGZIRPTCOETK-QHCPKHFHSA-N 388.442 5.276 30 20 GKED CCC(=O)Nc1ccc(-c2csc(NN=Cc3ccccc3Cl)n2)cc1 749263801 WAHQTMMFIUTSCK-UHFFFAOYSA-N 384.892 5.258 30 20 GKED CC(C)(CC#N)COC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 764838552 MOWXTWYLKIJPPX-UHFFFAOYSA-N 383.300 5.142 30 20 GKED C=CC[C@@H](N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C)c1ccncc1 766017329 ABGITQBGKHLCCP-IFXJQAMLSA-N 383.948 6.135 30 20 GKED CC(C)N(C)C(=O)c1ccc(Cl)c(NCc2ccc(C(C)(C)C#N)cc2)c1 774286769 BNZJNPBFHJIUAD-UHFFFAOYSA-N 383.923 5.234 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)ccc1OC 776165998 ZSSYWWWGYFNKPN-SFTDATJTSA-N 398.522 5.782 30 20 GKED C[C@@H](Nc1ccc(N2CCSCC2)c(Cl)c1)c1ccc(C#N)c(F)c1 777658172 GKSXCZZLKDGIHR-CYBMUJFWSA-N 375.900 5.077 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cnc(-c2ccccc2Cl)s1 780175961 IOUOGYKMMIZVFB-LBPRGKRZSA-N 383.860 5.007 30 20 GKED N#C[C@@H](C(=O)[C@H]1CCCOCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 786310868 FCTPEBURCNIKBY-FZMZJTMJSA-N 395.311 5.110 30 20 GKED CC[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](C#N)c1nc2ccccc2n1C 793118700 VIXIOPRBURMKRD-RDJZCZTQSA-N 399.416 5.037 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 805947264 LDQNXRANNXRFHG-KSSFIOAISA-N 377.513 5.044 30 20 GKED N#CCOc1cccc(/C=C(\Cl)c2nc3ccc(Br)cc3o2)c1 812248657 QIEQQWBSKXAKMQ-ZROIWOOFSA-N 389.636 5.230 30 20 GKED N#C[C@H](C(=O)CCc1ccc(-c2ccccc2)o1)c1cc(C(F)(F)F)ccn1 813217196 CUJJUMNQVIVTCU-KRWDZBQOSA-N 384.357 5.169 30 20 GKED Cc1c(C(=O)Nc2nnc(C3CCCCC3)s2)sc2ccc(C#N)cc12 814347325 LXSRATRUHZJQSG-UHFFFAOYSA-N 382.514 5.233 30 20 GKED C[C@@H](CC(=O)OCc1coc(-c2ccc(F)c(C(F)(F)F)c2)n1)C(F)(F)F 860326583 ZAPDKJJQIHXNLB-QMMMGPOBSA-N 399.262 5.131 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 916057720 VQZJSJXHIUDZNN-JQCPSUHGSA-N 397.865 5.519 30 20 GKED COc1cc(/C=C\C(=O)c2ccccc2F)ccc1OCc1ccc(F)cc1 916136244 CUAGPHXUNCNYMU-WQLSENKSSA-N 380.390 5.449 30 20 GKED N#C[C@@H](C(=O)C1(c2cccc(Cl)c2)CCCC1)c1nc2ccccc2s1 916847986 ZTCYPTBYGAEWMN-INIZCTEOSA-N 380.900 5.638 30 20 GKED N#C[C@@H](C(=O)Nc1ccccc1Cl)C(=O)c1cc2c(Cl)cccc2s1 916909309 LVCWXSSDVMYWQJ-LLVKDONJSA-N 389.263 5.169 30 20 GKED CCCCc1nc(CON=Cc2cc(Cl)c(OCC)c(OC)c2)cs1 920399135 KVCTXRDFKOPANA-UHFFFAOYSA-N 382.913 5.097 30 20 GKED CC(CCc1ccc(OCc2cccc(C(=O)O)c2)cc1)=NN1CCCC[C@H]1C 1776091303 FZHICTOWSIDGSD-LJQANCHMSA-N 394.515 5.147 30 20 GKED C=CCc1cc(C)c(OCCCN[C@H](c2ccccc2)C(C)(C)C(=O)O)cc1C 1776187113 XMPSFGCBKSJLRB-HSZRJFAPSA-N 395.543 5.243 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2sc(-c3ccco3)nc2-c2ccccc2)n1 41516249 UVAFBSFNTJHXQC-AWEZNQCLSA-N 391.477 5.325 30 20 GKED CCCN(Cc1ccc(C#N)cc1)Cc1csc(COc2ccccc2)n1 60468964 TXLPUKNEFYDAGG-UHFFFAOYSA-N 377.513 5.006 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CC1 66954425 VXUPJVDEPJBKRC-HNNXBMFYSA-N 383.492 5.416 30 20 GKED Cc1cccc(SCCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccco2)c1 72042395 UYSVPDUTIIIFNJ-UHFFFAOYSA-N 393.512 5.047 30 20 GKED CCc1c(C)sc(NC(=O)CCc2nc(C)c(-c3ccccc3)o2)c1C#N 106649522 LHFIFPLDOHDNPT-UHFFFAOYSA-N 379.485 5.025 30 20 GKED N#Cc1ccc(NC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)nc1 110284333 QFIWOGBZMVMIJG-UHFFFAOYSA-N 381.766 5.092 30 20 GKED Cn1ccc2c(C(=O)[C@H](C#N)c3nc(-c4c(F)cccc4F)cs3)cccc21 119005807 NQHDOHISWGIDIM-AWEZNQCLSA-N 393.418 5.070 30 20 GKED Cc1cc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)oc2cc1C 123560487 USKZGNKFXVMYEF-GOSISDBHSA-N 397.459 5.535 30 20 GKED CC(=O)Nc1ccc(C(F)(F)F)cc1NCc1ccccc1C(C)(C)C#N 131614579 FKLUNRPQUVWSQP-UHFFFAOYSA-N 375.394 5.077 30 20 GKED CC(C)(C)c1ccc([C@H](C#N)NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1 133670812 BYUNXXYLSMEXFF-AWEZNQCLSA-N 395.812 5.046 30 20 GKED C=C[C@H](CC(=O)N[C@@H](C)c1ccc(OCc2cccnc2)cc1)c1ccccc1 153199105 OJEQBXDSVVWKOQ-PZJWPPBQSA-N 386.495 5.198 30 20 GKED CN(C(=O)c1csc(-c2ccc(Cl)s2)n1)c1cc(Cl)ccc1C#N 156776190 LEQPSWDOZDLGEH-UHFFFAOYSA-N 394.308 5.327 30 20 GKED N#C[C@H](C(=O)c1ccnc2ccccc12)c1nc(-c2ccc(Cl)cc2)cs1 161962066 SPNGIFZVTDNORI-QGZVFWFLSA-N 389.867 5.502 30 20 GKED Cc1c(C#N)cccc1NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl 178408147 MUAXUJCACLOPNV-UHFFFAOYSA-N 375.042 5.128 30 20 GKED Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccccc1SC[C@H](C)C#N 180520367 DGWVOHBNSHCBEH-GFCCVEGCSA-N 383.473 5.024 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cc3cc(C)c(C)cc3o2)ccc1OC 180815107 REVJQUVWFAJNSO-YLJYHZDGSA-N 392.499 5.590 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2O[C@@H](C)C#N)c(Sc2ccccc2)c1 181315374 CFSSJXCIQUUWPM-KRWDZBQOSA-N 388.492 5.689 30 20 GKED C=CC[C@@H](C(=O)Nc1cc(NC(=O)c2ccccc2)ccc1C)c1ccccc1 186767827 JXIAZEDDFXAUAE-JOCHJYFZSA-N 384.479 5.546 30 20 GKED CC[C@@H](C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 193334971 VTBQRCMACYSLRA-HSZRJFAPSA-N 384.479 5.464 30 20 GKED C[C@H]1CCC[C@H](OCc2cccc(NC(=O)CCc3ccc(C#N)cc3)c2)C1 303013564 ROFVXJTYKGWZOO-MBSDFSHPSA-N 376.500 5.225 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCSc1ccccc1Cl 303395540 PNMJQIMIZSYNDF-AWEZNQCLSA-N 390.961 5.713 30 20 GKED OC(=Nc1ccccc1)N1CCC[C@@H](/C(O)=N/[C@H]2CCCc3ccc(F)cc32)C1 330089580 OVGSCTXVYZIGDS-UTKZUKDTSA-N 395.478 5.117 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1COc1cccnc1C 417047573 VLCGOHDZXZJJPQ-HXUWFJFHSA-N 393.531 5.317 30 20 GKED Cc1sc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1Br 424667338 UUJOSCHTHSRMLI-JTQLQIEISA-N 395.347 5.466 30 20 GKED CO[C@H](c1cccc(Cl)c1)c1noc(-c2sc3ccc(C#N)cc3c2C)n1 426414391 AWLRGBSSYMNURW-QGZVFWFLSA-N 395.871 5.521 30 20 GKED CC(C)(C)C(=O)c1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1 428862089 MPZYMQLAOOUTCY-RTWAWAEBSA-N 389.499 5.219 30 20 GKED Cc1c(C(=O)Nc2cc(Br)ccc2F)sc2ccc(C#N)cc12 431386226 FMUOCBIVLHARPU-UHFFFAOYSA-N 389.249 5.235 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)Cc2ccccc2O1 432771704 YOKUDEKQVBPVIX-QGZVFWFLSA-N 399.450 5.166 30 20 GKED C[C@H](CC(F)(F)F)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 457449383 ILWHDZJNULATRT-WBMJQRKESA-N 380.797 5.522 30 20 GKED C[C@H](C(=O)N[C@H](C)c1cccc(OCc2ccccc2)c1)c1cccc(C#N)c1 462346489 NFQDRTJHKTZCTM-RBUKOAKNSA-N 384.479 5.118 30 20 GKED Cc1ccc(-c2ccsc2C(=O)[C@@H](C#N)c2cc(C(F)(F)F)ccn2)cc1 464420985 KWJQPWKTFDXMAV-INIZCTEOSA-N 386.398 5.627 30 20 GKED C[C@H](c1ccc(-c2ccccc2)cc1)N(C)CCC(=O)Nc1ccccc1C#N 464769145 ZWRYBWJXCHCZTR-LJQANCHMSA-N 383.495 5.247 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Oc2ccccc2)ccn1 465120731 KRDRNVZTJNTNKO-UHFFFAOYSA-N 375.453 5.132 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CC[C@H](CC(C)C)C1 467708287 CWAMOYOUPRKQMN-HXUWFJFHSA-N 391.515 5.346 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N1CCCC[C@H]1c1cccc(C(F)(F)F)c1 469657427 BWJNXQBWFZGYEN-IBGZPJMESA-N 387.405 5.645 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 471175259 FZLQFMGOPOHPFH-UHFFFAOYSA-N 397.466 5.179 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1)c1ccccc1 475463957 HBCCHWBOQAODLX-QGZVFWFLSA-N 389.480 5.026 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H]1CCCN(c2ccccc2)C1 475568928 HGQSFNMQGKPRAL-QFIPXVFZSA-N 391.559 5.671 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)[C@H](Oc1ccccc1C#N)C(C)C 475919503 MGJATMXAWPFONE-QFBILLFUSA-N 399.560 5.070 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476336301 IWGWYBBTBUJQBM-GOSISDBHSA-N 375.516 5.427 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1cc(Cl)ccc1Cl 477540789 JGUFIWSHKXBMIR-GFCCVEGCSA-N 376.287 5.677 30 20 GKED CC[C@H](NCc1ccc(C#N)cc1Br)c1ccccc1OC(F)F 481204709 ZDOVLUVFMAJFNA-INIZCTEOSA-N 395.247 5.163 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccccn1 481366346 AHZQKPUSSKCPGG-ZDUSSCGKSA-N 390.434 5.398 30 20 GKED N#Cc1ccccc1N(Cc1ccco1)C(=O)c1cnc(-c2ccsc2)s1 487010971 ZRSKXSWLZJCISB-UHFFFAOYSA-N 391.477 5.183 30 20 GKED CCN(CC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CCC2 492147991 PGCMFXSUQNRQDG-FOCLMDBBSA-N 387.508 5.159 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3CCCc4ccccc4C3)c2)cc1 499590527 LVVOIWKBAQOXDF-UHFFFAOYSA-N 383.451 5.331 30 20 GKED C[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(Oc2ccccc2)c(F)c1 499602288 MIAHRWDODUEOCX-GOSISDBHSA-N 382.479 5.369 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1C(C)C 499895385 NWFATSJAIJVJRF-INIZCTEOSA-N 399.564 5.558 30 20 GKED N#C[C@@H](NC(=O)c1csc(-c2ccccc2Cl)n1)c1ccccc1Cl 499944124 DIZJNYUVRMUOIQ-OAHLLOKOSA-N 388.279 5.112 30 20 GKED C=CCC[C@@H](NC(=O)Cc1ccc(OCc2ccccn2)cc1)c1ccccc1 501872338 IHQKNDNJUPZWCZ-XMMPIXPASA-N 386.495 5.027 30 20 GKED C[C@@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)c1ccc(F)cc1 502021616 DKSNNHYZPBMJQT-INIZCTEOSA-N 390.483 5.382 30 20 GKED Cc1sc(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)c(C#N)c1C 502762547 JGBJSNMIIKKQRP-UHFFFAOYSA-N 395.431 5.426 30 20 GKED CCC[C@H]1C[C@@H](C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)CCO1 503353389 OGMXMBFMGWSEHV-YJBOKZPZSA-N 382.435 5.023 30 20 GKED Cc1ccccc1[C@@H](C)N(C)C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 511592040 KKPSZUADCYHWCR-CQSZACIVSA-N 391.393 5.033 30 20 GKED COc1cc(C#N)ccc1OCCCC(=O)Nc1ccc(C(C)C)cc1C(C)C 514558414 MHLZLZIBRGJOGE-UHFFFAOYSA-N 394.515 5.611 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)c1cc(-c2ccc(Cl)s2)on1 515984923 NVTRYWQAMZFICS-UHFFFAOYSA-N 376.840 5.024 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1csc2ccccc12 518754152 FELNZJXRJDKXCA-CQSZACIVSA-N 381.526 5.617 30 20 GKED CCN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1cccc(C)c1C 518903502 DVVMIFHBSAJTRM-UHFFFAOYSA-N 384.479 5.829 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1)C1CC1 533132607 VTNSOUCRTFSGAW-CQSZACIVSA-N 394.862 5.160 30 20 GKED CC(C)n1c([C@H]2CCCN(Cc3ccc(C#N)cc3F)C2)nc2ccccc21 533392804 GFGUPPCDZSCWAY-IBGZPJMESA-N 376.479 5.008 30 20 GKED C=C(C)[C@H](CC(=O)N(C)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)OCC 541253753 XRPLSVQGBAZHOQ-GOEBONIOSA-N 397.359 5.139 30 20 GKED C=C(C)COc1cc(CNC2(c3cccc(C(F)(F)F)c3)CC2)ccc1OC 560167102 UQEPRKTZRUQRPD-UHFFFAOYSA-N 391.433 5.448 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2c(C(=O)c3ccco3)oc3ccccc23)c1 581688087 JSGXEFJFAMWMBC-UHFFFAOYSA-N 390.782 5.034 30 20 GKED N#CCCCCCC(=O)N[C@@H](c1cc(F)ccc1F)c1ccccc1Cl 588621505 UCLYEHVLKZYQGT-HXUWFJFHSA-N 376.834 5.298 30 20 GKED C=CCOc1ccc(CNCCc2coc(-c3ccc(C)cc3)n2)cc1Cl 591698040 NDIAEQIEZXFTDM-UHFFFAOYSA-N 382.891 5.201 30 20 GKED Fc1ccc2c(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)ccnc2c1 603493138 KIKPQUSPLOFDSK-IAZYJMLFSA-N 380.307 5.695 30 20 GKED CCCCc1ccc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 603600863 HZNJHKOYGSNPBH-UHFFFAOYSA-N 385.467 5.649 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3Cl)cn2)cc1 603763515 CWVUGPSZJBSELW-MOPGFXCFSA-N 389.842 5.141 30 20 GKED CC(C)n1ncc2cc(CNc3cccc(Oc4ccc(C#N)cc4)c3)cnc21 609221443 XSXIMQZNIZVGFD-UHFFFAOYSA-N 383.455 5.288 30 20 GKED N#C[C@H](C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nc2cc(F)ccc2s1 609322049 VJGIJDZYWUSJHR-GFCCVEGCSA-N 397.412 5.048 30 20 GKED N#CCCCOc1cccc(NC(=O)CCc2nc3cc(Cl)ccc3s2)c1 609326928 XTLYLWYSNWSRKR-UHFFFAOYSA-N 399.903 5.204 30 20 GKED Cc1ccc([C@@H](NC(=O)c2cccc(CC#N)c2)c2ccc(F)cc2Cl)cc1 609374443 XNBDSIVPBAJKGX-JOCHJYFZSA-N 392.861 5.373 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@H]1c1cccc2ccccc12 609376528 BSKIWHJUCHKCBX-CZAAIQMYSA-N 386.520 5.834 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc2c(Cl)cccc2s1 609427773 KPEWCKZTGYSJTK-GFCCVEGCSA-N 386.929 6.201 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCCC[C@H]1c1ccco1 609929606 GEJXTXIUJVYGCS-WMZOPIPTSA-N 383.517 5.681 30 20 GKED CS[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C)c1ccccc1 610042301 ROKVMUONAZCZEY-QFIPXVFZSA-N 388.492 5.702 30 20 GKED Cc1ccc(C)c(SCc2cccc(C(=O)N(CC#N)c3ccccc3)c2)c1 610172874 CRJWCKAQVVNNKZ-UHFFFAOYSA-N 386.520 5.766 30 20 GKED C[C@H](NC(=O)Nc1cccc(COCCc2ccccc2)c1)c1cccc(C#N)c1 610322885 WARSIWKNLUOJIR-IBGZPJMESA-N 399.494 5.200 30 20 GKED C[C@H](CC(=O)N(Cc1ccccc1)c1cc(Cl)ccc1C#N)c1ccncc1 610723024 CRKXLWRDLNIQNI-QGZVFWFLSA-N 389.886 5.334 30 20 GKED Fc1ccc2ncnc(NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c2c1 614305693 NFTHZGYMSOHZGL-RKDXNWHRSA-N 381.295 5.090 30 20 GKED C=CCN(C(=O)Cc1c(Cl)cccc1Cl)c1nc2c(s1)CCCC2 623331846 WLBMWQMJDOFRJX-UHFFFAOYSA-N 381.328 5.090 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc(Br)c3ccccc3c2)n1 645964128 YBEDCPSHGJGORA-OAHLLOKOSA-N 399.313 5.672 30 20 GKED Cc1cccc(-c2cncc(C(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2)c1 676103722 GSDAGTBQZMRIPH-GOSISDBHSA-N 387.439 5.296 30 20 GKED COc1cc(C)ccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 682013020 YWRQCGOYQIYJFM-CYBMUJFWSA-N 390.386 5.122 30 20 GKED N#Cc1c(NC(=O)[C@H](OC2CCCC2)c2ccccc2)sc2c1CCCC2 726912291 XHPQQMQJUDLDMS-HXUWFJFHSA-N 380.513 5.138 30 20 GKED N#C[C@H](C(=O)/C=C\c1cccc(OC2CCCC2)c1)c1nc2ccccc2s1 727952693 QJRMBYWAJRGJJX-SYGIOELKSA-N 388.492 5.507 30 20 GKED COc1ccc(Sc2ccc(NC(=S)Nc3ccccc3C#N)cc2)cc1 728175026 FUQBKFJPWOATPR-UHFFFAOYSA-N 391.521 5.527 30 20 GKED COc1ccccc1[C@H](C)CC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 728464972 DUEKBXQCVDCRQZ-JPYJTQIMSA-N 384.479 5.483 30 20 GKED CC(=NNc1ccc(C)nn1)c1ccc(-c2ccccc2Br)s1 729935796 QJPJHFUDQVSLSA-UHFFFAOYSA-N 387.306 5.112 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)c1csc2ccccc12 730069045 VIFXLLOPEDWUSL-INIZCTEOSA-N 375.497 5.232 30 20 GKED Cc1ccc(C2=CCN(C(=O)Nc3ccccc3SC[C@H](C)C#N)CC2)cc1 731113991 BILRWWBBFZPDKZ-GOSISDBHSA-N 391.540 5.568 30 20 GKED COc1ccc(-c2nc(/C=C\C(=O)c3cc(OC)c(OC)cc3C)cs2)cc1 731317883 FFLZIGVITCKPJI-YFHOEESVSA-N 395.480 5.040 30 20 GKED CC(C)(C)c1ncc(/C=C2/CCOc3c(Br)cccc3C2=O)s1 736433337 DCUSHSGNCZGMDJ-LUAWRHEFSA-N 392.318 5.252 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C\c2ccc(-n3cccn3)cc2)cc1 741470805 WGACKNLZROMZRF-SXGWCWSVSA-N 380.447 5.444 30 20 GKED C[C@H]1/C(=C/c2ccc(O[C@H](C)C#N)cc2)C(=O)c2cccc(Br)c21 742435510 UTDXQWTTYQBMQV-NCCRNRFZSA-N 382.257 5.123 30 20 GKED COc1ccccc1[C@H](C)SCC(=O)N(CCC#N)c1ccc(C)c(C)c1 742455814 WLFKTNLHTFZEKK-SFHVURJKSA-N 382.529 5.053 30 20 GKED CC(=NNc1ncnc2sc(-c3ccccc3)cc12)c1ccc2c(c1)COC2 743424958 SCXMASBMMBCEFW-UHFFFAOYSA-N 386.480 5.225 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)[C@@H](C)c2cccc(Cl)c2)cc1 744034007 XYBNNOFRNJYQQT-AUSJPIAWSA-N 382.891 5.305 30 20 GKED CC(C)COc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)cc1 747196174 IEVGUHUBXQFVND-GOSISDBHSA-N 384.545 5.455 30 20 GKED COc1ccc(OCc2nc(/C=C\C(=O)c3coc4ccccc34)cs2)cc1 747705255 MBXJJCDNBSCNQW-WDZFZDKYSA-N 391.448 5.373 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)[C@H](C)c2ccc(Cl)s2)cc1 750683827 IPULSONCIQDUID-CJNGLKHVSA-N 388.920 5.195 30 20 GKED CCn1nc(C)c(C(=O)/C=C/c2ccc(OCc3ccccc3)c(OC)c2)c1C 750913924 RRLOGTAHQRUGES-ACCUITESSA-N 390.483 5.004 30 20 GKED C/C(=C\c1ccccc1)CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 755219979 NEAQYJYZXXOAKA-BZCZDHRTSA-N 395.506 5.909 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1cc(Br)c(F)cc1O 756818452 GBTTUIRRQZDGEH-LBPRGKRZSA-N 393.256 5.149 30 20 GKED C#CCOc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)cc1 765607082 LEVAYHZFOVCACC-CLOONOSVSA-N 395.506 5.026 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)[C@H](O)c1c(Cl)cccc1Cl 777177494 FENPADQGKDMUKH-XIKOKIGWSA-N 396.339 5.123 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1 780670416 PWERTRYSKVIRCU-CYBMUJFWSA-N 391.393 5.053 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)C[C@H](CC#N)c2ccccc2)c1 793362055 RJLWGGGXJQYKEW-INIZCTEOSA-N 397.450 5.199 30 20 GKED CC(C)c1noc2nc(-c3ccco3)cc(C(=O)OCC(C)(C)CCC#N)c12 798879510 WQJNFOJWIJDLEW-UHFFFAOYSA-N 381.432 5.093 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cc3cc(Cl)sc3[nH]2)cc1 810532323 CPDUTWLYLHHFRY-ABAIWWIYSA-N 399.903 5.357 30 20 GKED C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(C(F)(F)F)nc1Cl 817862814 NTZNNXHWRJJHNJ-LLVKDONJSA-N 395.812 5.046 30 20 GKED O=C1N/C(=N/C2CCCC2)S/C1=C\c1c(Cl)ccc(Cl)c1Cl 817926223 BAVIJNYISQAEDX-GHXNOFRVSA-N 375.708 5.149 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCC#N)c1nc(-c2ccc(C(C)(C)C)cc2)no1 818423965 JBRWEUINVGWWJC-KRWDZBQOSA-N 398.507 5.294 30 20 GKED CCO[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1)C(C)C 860475932 WNDHKKVGYZDKHQ-DYVFJYSZSA-N 397.327 5.354 30 20 GKED Cc1cc(Cl)c(C(C)C)cc1OC(=O)CCc1c(C)nn(CCC#N)c1C 914838198 AYXCNKVYUWKTLO-UHFFFAOYSA-N 387.911 5.037 30 20 GKED O=C(Nc1cccc(/C=C/C(=O)c2ccccc2F)c1)c1ccc(Cl)cc1 916136373 LCGNKZWICDOIHW-MDWZMJQESA-N 379.818 5.628 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)Nc3cccc(OCC#N)c3)cs2)cc1 916410657 AGRBQYFELYRYGY-UHFFFAOYSA-N 391.496 5.017 30 20 GKED Cn1c2ccccc2c2cc(C(=O)[C@H](C#N)c3nc4ccccc4s3)sc21 916846550 YYJXOACDIIUASZ-AWEZNQCLSA-N 387.489 5.493 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(SC)ccc2C)cc1 916912484 AVYPJYQSVLUTHH-HXUWFJFHSA-N 380.513 5.021 30 20 GKED FC(F)(F)COc1cccc(CON=Cc2ccccc2C(F)(F)F)c1 918185815 HUBKLLJTZTYDMZ-UHFFFAOYSA-N 377.284 5.197 30 20 GKED CC(C)(C)c1cccc2c1O/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)o1)C2=O 1776113613 PKODZMXUZMCKJF-MOSHPQCFSA-N 388.419 5.559 30 20 GKED CC(C)(C)COc1cccc(/C=C2\CCCc3cc(C(=O)O)ccc3C2=O)c1 1776249976 ABXYHNDYGWDSNN-LDADJPATSA-N 378.468 5.412 30 20 GKED CC(C)[C@@H]1/C(=C\c2cc(C(=O)O)ccc2Br)C(=O)c2ccccc21 1776308916 YPMQZTYOFHLYPG-BXBHGGAKSA-N 385.257 5.167 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cccc(SC(F)(F)F)c2)c1)C(=O)O 1776471097 JJLJVNKWSWVBLH-LAUAKBEESA-N 396.386 5.047 30 20 GKED CC1(C)Cc2cc(/C=C\C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)ccc2O1 1776569372 WWWGCKUBDUSMFT-OQFOIZHKSA-N 388.419 5.254 30 20 GKED CCCCCCCCCN(C)c1c(C(=O)O)cnc2c(OC)cc(OC)cc12 1776785378 JXFUMCDMFNGYGH-UHFFFAOYSA-N 388.508 5.137 30 20 GKED Cc1ccc(C(=O)O)cc1C(=O)/C=C\c1ccc(OC(F)(F)F)c(Cl)c1 1777436053 ACAQGPXTIUBWIP-UTCJRWHESA-N 384.737 5.141 30 20 GKED C=CCOc1ccccc1C(=O)Nc1ccc(OCc2cccnc2)c(Cl)c1 31468195 WMRAUGAFPBFEDK-UHFFFAOYSA-N 394.858 5.131 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\C(=O)c2ccc(C)c(C)c2)cs1 54895793 RRSXTJAFNZHMDP-FLIBITNWSA-N 394.471 5.480 30 20 GKED CCn1cc(C(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)c2ccccc21 57089602 PZACMROASJXKKM-UHFFFAOYSA-N 396.450 5.281 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2nc(C3CC3)sc2c1 58453773 XEEVFXNLEZJLLQ-UHFFFAOYSA-N 388.496 5.265 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2 61047392 ZUWRICLSIAWCOX-LBPRGKRZSA-N 393.537 5.429 30 20 GKED O=C(Nc1cc(F)c(F)cc1F)N[C@H](CC(F)(F)F)c1ccc(F)cc1 92034033 XNKKEVNCJYXQMK-CQSZACIVSA-N 380.263 5.058 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3cccc(Oc4ccc(C#N)cc4)c3)o2)cc1 105402686 WFKWZSBANZBUST-QGZVFWFLSA-N 396.450 5.882 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccccc1SC[C@@H](C)C#N 108529949 ODSTVWJKDAYSFG-INIZCTEOSA-N 383.492 5.298 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 109028930 HLBBBECAZROROV-DNVCBOLYSA-N 399.947 6.103 30 20 GKED C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)c1ccc(C#N)cc1 118172128 QNADGTYEDGUVBM-MRXNPFEDSA-N 383.480 5.054 30 20 GKED C[C@H](Sc1nnc(-c2cccc(Br)c2)o1)c1ccc(C#N)cc1 118173660 RBKZCWAHNBOBEG-NSHDSACASA-N 386.274 5.224 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3csc(-c4ccoc4)n3)o2)cc1 126289885 FIAAUKXZFVFCOJ-UHFFFAOYSA-N 397.481 5.310 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F)c1ccccc1Cl 171367195 YPKGHBBICPCPSF-WONIAPNHSA-N 385.801 5.365 30 20 GKED CC[C@H](Nc1ccc(C#N)cc1Br)c1nc(C(F)(F)F)cs1 301871284 PMITYZDMHWPKGL-JTQLQIEISA-N 390.228 5.359 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccnc(OC3CCCCC3)c2)s1 430610758 LYRACMVJBRBYTJ-INIZCTEOSA-N 383.517 5.037 30 20 GKED N#CCCC[C@@H](N=c1ccc(Br)c(C(F)(F)F)[nH]1)c1ccccc1 431510670 HNDGLGZKLYWVEJ-CQSZACIVSA-N 398.226 5.132 30 20 GKED N#CCCC[C@H](NC(=O)NCCc1c(Cl)cccc1Cl)c1ccccc1 431858384 NXBLHVYTSYXVJE-IBGZPJMESA-N 390.314 5.270 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 433306253 RVAAAMXYNSBBBR-NQIIRXRSSA-N 394.927 5.380 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCC(=O)c1ccc2ccccc2c1 436364955 QPQLQWCOHRJKGP-RPWUZVMVSA-N 396.490 5.101 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2ccccc2OC(F)F)cc1F 437471723 WWKCTNZILPKMAM-UHFFFAOYSA-N 398.340 5.343 30 20 GKED CC[C@@]1(C)CCCN(C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)C1 437944963 BEEXTWVDHLWGCG-QHCPKHFHSA-N 395.478 5.320 30 20 GKED C[C@@H](CCc1ccco1)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438660805 KWCILHRUUSLHQS-HNNXBMFYSA-N 393.418 5.225 30 20 GKED C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1 438842458 PSTFZRGETUWEFX-AUUYWEPGSA-N 390.314 5.741 30 20 GKED CC[C@@H]1CC[C@H](C)N(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1 454518841 ARURWOBAKUQPFJ-RBUKOAKNSA-N 391.515 5.374 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCCC[C@H]1CC(F)(F)F)c1ccccc1 455271403 UPXVEAUVYMHSMV-BZSNNMDCSA-N 381.442 5.232 30 20 GKED C=CCc1cc(CNCc2ccc(-c3cccc(OC)c3)cc2)cc(OC)c1O 462736107 MVYNGLMAWQSSIE-UHFFFAOYSA-N 389.495 5.095 30 20 GKED CC(C)[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccc(F)c(F)c1 469235705 MANAOFUTZSWVGO-HSZRJFAPSA-N 397.469 5.357 30 20 GKED Cc1cc(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c(C(F)(F)F)o1 472002110 KPDAVKNSQGZHSP-CQSZACIVSA-N 398.384 5.637 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)c1cccc(OC(F)F)c1 475546014 KKXXRHPQBNHEFQ-OAHLLOKOSA-N 388.458 6.023 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1cnc2ccccc2n1 483191657 BQELHFPGDWWKRZ-HNNXBMFYSA-N 389.867 5.502 30 20 GKED N#CCCC[C@@H](NC(=O)c1ccc(COc2ccccc2)cc1)c1ccccc1 487186393 OPIYBNCOADRWNM-XMMPIXPASA-N 384.479 5.431 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)NCCc1ccc(Cl)s1 506107326 QBNXQNRHOYGZCW-UHFFFAOYSA-N 375.346 5.057 30 20 GKED CCN(C(=O)c1cccc(OCc2ccccc2C#N)c1)c1ccc(F)c(F)c1 508990507 GJHCMVSLPLZAQY-UHFFFAOYSA-N 392.405 5.082 30 20 GKED CC(C)(CNC(=O)c1ccccc1Sc1ccccc1C#N)c1cccs1 510423573 FUNDBMHTBSYGDW-UHFFFAOYSA-N 392.549 5.479 30 20 GKED N#CCCCOc1cccc(CNc2cccc3cc(Br)cnc23)c1 512501410 JGRIJUYLOIAKQW-UHFFFAOYSA-N 396.288 5.292 30 20 GKED CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)Nc1ccccc1S[C@H](C)CC#N 517517627 FKABMSTVSLPHKZ-MLYOOKFZSA-N 388.577 5.497 30 20 GKED C=CCc1cc(C(=O)N(c2ccc(F)cc2Cl)C(C)C)cc(OC)c1OC 523242310 RIIKTQQCQJEALW-UHFFFAOYSA-N 391.870 5.280 30 20 GKED C[C@H](Nc1ccc2oc3ccccc3c2c1)C(=O)N(CCC#N)c1ccccc1 525761553 AUFWSHSWZGNRPM-KRWDZBQOSA-N 383.451 5.333 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCc2nc(C(C)C)ncc2C1 527606179 VTLGKFPHTHWMCG-UHFFFAOYSA-N 378.520 5.042 30 20 GKED C[C@H](N[C@H](C)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccc(C#N)cc1 531695842 MKLPDQGMPPFPJU-NWDGAFQWSA-N 386.339 6.008 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@H](C)CC#N)c1cccc(Cl)c1 533026295 CVMPORLTKFQFHV-OAHLLOKOSA-N 387.936 5.199 30 20 GKED CC(=O)c1ccc(Oc2ccc(C(=O)Nc3ccc(C#N)cc3Cl)cc2)cc1 535516471 MMHNIGAGIMNRTQ-UHFFFAOYSA-N 390.826 5.459 30 20 GKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 536818480 XLEVQPOHFXIWTF-CRAIPNDOSA-N 379.460 5.154 30 20 GKED N#CC1(c2ccc(C(=O)N[C@@H]3CCOc4c(-c5ccccc5)cccc43)cc2)CC1 537435836 XSHGCESRHZKUJS-HSZRJFAPSA-N 394.474 5.162 30 20 GKED CCN(C(=O)c1ccc(N(C)c2ccccc2)nc1)c1ccc(C#N)c(Cl)c1 540273744 SZJWKYQUQVYXNV-UHFFFAOYSA-N 390.874 5.041 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc([N+](=O)[O-])cc2Cl)cc1 544370120 AWSVZFUKWOEVKX-UHFFFAOYSA-N 377.831 5.077 30 20 GKED Cc1c(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)cccc1-c1ncco1 552710435 SWEAZWDBNDGMPQ-UHFFFAOYSA-N 394.434 5.518 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)Nc1sc(C)c(C)c1C#N 558358681 DHOSCAITJITXTK-UHFFFAOYSA-N 383.698 5.213 30 20 GKED CC(C)n1c([C@@H]2CCCN2C(=O)c2cc(C#N)ccc2Cl)nc2ccccc21 560557842 KZHGQHDRQFKMGG-FQEVSTJZSA-N 392.890 5.120 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2cnn(C(C)C)c2c1 562125341 UNAFHZURGHHTJP-UHFFFAOYSA-N 394.523 5.005 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Cc1cncc2ccccc12 565678522 OJYCTXXXAVSLCH-DLBZAZTESA-N 389.524 5.304 30 20 GKED Cc1nc(-c2ccccc2F)sc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 572886954 GHTCORDZZOMZQL-CYBMUJFWSA-N 385.489 5.328 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2cc(F)ccc2F)nnc1-c1cccc(C)c1 592562405 GWDXCVCLZKIQSK-CQSZACIVSA-N 399.466 5.081 30 20 GKED Cc1nc(C)c([C@@H](C)N(C)C(=O)Nc2cccc(C#Cc3cccs3)c2)s1 592897911 YDMUFBUPBAKSNT-OAHLLOKOSA-N 395.553 5.446 30 20 GKED Cc1ccc(NC(=O)[C@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)cc1C 604044204 BRKUSMHDHMCCDM-IBGZPJMESA-N 399.494 5.193 30 20 GKED Cn1ccc2c(NC(=O)c3ccccc3Sc3ccccc3C#N)cccc21 608882506 ORGDPNQVXWKOSK-UHFFFAOYSA-N 383.476 5.453 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](Cc2ccccc2)C1 609438937 OZHZYAUWISYIMR-QUCCMNQESA-N 393.556 5.567 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H](Cc2ccccc2)C1 609438939 OZHZYAUWISYIMR-UYAOXDASSA-N 393.556 5.567 30 20 GKED CC[C@H](C)[C@H]1CCCCN1C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 610010282 HQUHRRVYNFVMFJ-HNAYVOBHSA-N 382.533 5.038 30 20 GKED C[C@@H](NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1cccc(C#N)c1 610364603 SDAULVGHQIBDAO-ZHRRBRCNSA-N 390.483 5.408 30 20 GKED C[C@@H](NC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 610401763 KBLFCGGZGJMHPL-GFCCVEGCSA-N 376.287 5.161 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)[C@@H](C#N)c2ccccn2)cc1C 613296626 PUULOZAVIWWOLU-NRFANRHFSA-N 392.462 5.041 30 20 GKED N#Cc1ccc(N2CCC[C@@H]2c2nc(CSc3ccc(Cl)cc3)no2)cc1 615131301 JBAMDFLGNURYNV-GOSISDBHSA-N 396.903 5.228 30 20 GKED COc1ccc2[nH]c(NC(=O)c3cccc(Oc4ccc(C#N)cc4)c3)cc2c1 617862821 SWNFCSCFBVTFQF-UHFFFAOYSA-N 383.407 5.093 30 20 GKED CC(C)Cc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 619756503 HCUXDLSRWYQPCL-FQEVSTJZSA-N 385.492 5.370 30 20 GKED CC1=CCN(C(=O)Nc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)CC1 646438986 DFLHGMMIGJDTSK-UHFFFAOYSA-N 384.295 5.160 30 20 GKED C=CCC[C@@H](NC(=O)NCc1cc(C(C)C)no1)c1ccc(C(F)(F)F)cc1 676725064 LGGXQXJUYATAQL-QGZVFWFLSA-N 395.425 5.324 30 20 GKED N#Cc1ccc(C(=O)CSc2nc(-c3cccs3)nc3ccccc23)cc1 680582509 FRVMAOHJKGPLGW-UHFFFAOYSA-N 387.489 5.205 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(C(=O)NC(C)(C)CC)c(Cl)c2)c1 726469315 MGCAMKMYJUTJOU-UHFFFAOYSA-N 399.947 5.049 30 20 GKED COc1ccc(CN[C@H](C)c2csc3ccccc23)cc1OCCCC#N 730018803 ARDOKISTSRZRED-MRXNPFEDSA-N 380.513 5.443 30 20 GKED Cc1ccc(NC2=NN=C(c3cn(CCC#N)c4ccccc34)CS2)cc1C 733806323 YRZIMAHGIFUAAO-UHFFFAOYSA-N 387.512 5.091 30 20 GKED C=CC[C@H](NC(=O)N1CCC[C@H]1c1ccc(C(C)(C)C)cc1)c1ccncc1 734678868 JIAMCPHVFFGPPV-VXKWHMMOSA-N 377.532 5.543 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)N3CCC[C@@H]3c3cccs3)c2)s1 740060871 YJKFZSMJHIVASB-GOSISDBHSA-N 393.537 5.395 30 20 GKED CC[C@H](NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1c(C)noc1C 757781649 RGKNCNJUEMDMPS-SFTDATJTSA-N 388.471 5.220 30 20 GKED COC1CCC(CC(=O)N(Cc2ccc(C#N)cc2)c2ccc(F)cc2C)CC1 759039924 HEOVKIIATMNYKS-UHFFFAOYSA-N 394.490 5.134 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)/C=C\c2ccc3[nH]ccc3c2)cc1 765914573 CVRLMDQEYYCTHI-RFMJHAEHSA-N 385.467 5.042 30 20 GKED CON=Cc1ccc(C(=O)Nc2ccccc2Oc2ccccc2Cl)cc1 768517930 IHSYCAQLPYMSQE-UHFFFAOYSA-N 380.831 5.365 30 20 GKED CCCCCCCCCCC(C)(C)C(=O)N1CCC2(CCN(C)C2=O)CC1 770794484 JQINIOWKOQMCHQ-UHFFFAOYSA-N 378.601 5.014 30 20 GKED N#C[C@H](COC(=O)c1occc1CSc1ccccc1)Cc1cccs1 772733892 NEZPJSDSTDIJHW-OAHLLOKOSA-N 383.494 5.173 30 20 GKED C[C@@H](N[C@H](Cc1ccc(Cl)cc1)c1ccccc1)c1ccc(OCC#N)cc1 776159593 JWICKADGKKRZQA-HOYKHHGWSA-N 390.914 5.877 30 20 GKED CC(C)(C#N)CC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]4CCC(=O)[C@]4(C)CC[C@@H]32)C1 786434270 JQZFABQMSSHDNY-NSAHPNQPSA-N 397.559 5.370 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(OC)c3ccccc23)cn1 792870286 QNFNSQRWINDEIT-ACCUITESSA-N 396.446 5.210 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1N(C(=O)OC(C)(C)C)CC1(C)C 793948358 KAISRNCJAGEKFW-LJQANCHMSA-N 386.536 5.123 30 20 GKED CO[C@@H]1CCC[C@@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)C1 796632643 DZYCSTRADWREOI-XYPHTWIQSA-N 388.920 5.235 30 20 GKED CC[C@H](N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(F)cc1O 796683275 MPXIULBRBYSBMD-SVBLFDIKSA-N 387.339 5.482 30 20 GKED C[C@H](Oc1cccc(Cl)c1Cl)C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 797570814 KQRLTRNSGXVDSE-WDEREUQCSA-N 397.327 5.391 30 20 GKED N#Cc1ccccc1/C=C\C(=O)Nc1nc(-c2ccco2)c(-c2ccco2)s1 799732997 AEUIZSZGZRGKPK-KTKRTIGZSA-N 387.420 5.187 30 20 GKED N#C[C@H](C(=O)C1(c2cccc(F)c2)CCCCC1)c1cc(C(F)(F)F)ccn1 813218162 SOQPUVLWOGZJRE-KRWDZBQOSA-N 390.380 5.318 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1 814635306 WNVBSDUPJKAOPD-HXUWFJFHSA-N 396.922 5.497 30 20 GKED COc1ccccc1C1(C(=O)[C@H](C#N)c2nc3ccccc3s2)CCCCC1 815899301 LYHQIVLBDYLHOV-INIZCTEOSA-N 390.508 5.383 30 20 GKED Cc1cc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(C)n1Cc1ccccc1 817318681 GJWRPDZGLBHYJO-DEOSSOPVSA-N 385.511 5.318 30 20 GKED Cc1cc(CN[C@@H](C)c2ccc(C#N)cc2F)cc(NC(=O)OC(C)(C)C)c1 834894952 NEHPMLYKHVFZGW-HNNXBMFYSA-N 383.467 5.204 30 20 GKED CCCCCCCCCC(=O)N1CC(C)(c2nnc(-c3cccc(F)c3)o2)C1 856521589 ZKYPAQHJYJSXKF-UHFFFAOYSA-N 387.499 5.116 30 20 GKED CCn1c2ccccc2c2cc(NC(=O)c3ccccc3SCC#N)ccc21 912646351 OAQRJMPQBLKUBI-UHFFFAOYSA-N 385.492 5.682 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)c(C)n1[C@@H](C)c1ccccc1 916848183 DMYYWLBPDDAVAE-MBSDFSHPSA-N 393.490 5.753 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1cc2ccc(F)cc2s1 916904220 YOGJPHWUIXLMJO-QGZVFWFLSA-N 394.471 5.126 30 20 GKED N#C[C@H](C(=O)Nc1ccccc1Oc1ccccc1)C(=O)c1cc2ccccc2o1 916907255 XHSNTGPZNOZTMT-SFHVURJKSA-N 396.402 5.186 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(SC(C)C)cc2)cc1 916915142 DXVIZADOOQCUNE-OAQYLSRUSA-N 394.540 5.491 30 20 GKED CCCc1cc(C(=O)[C@@H](C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)sc1C 916945842 ZRPWXYFPCQOIHS-OAHLLOKOSA-N 395.311 5.277 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1c(F)c(F)c(F)c(F)c1F 917812941 NUCYFPDXHXLURD-UHFFFAOYSA-N 391.299 5.053 30 20 GKED COc1ccc(/C=C\C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 919893747 OJELXDBXDWFKOH-AUWJEWJLSA-N 384.435 5.320 30 20 GKED O=C(O)c1ccc(-c2ccc(C=NNc3cc(Cl)nc(Cl)c3)cc2)cc1 1776082067 ULNWKSKHSZKECS-UHFFFAOYSA-N 386.238 5.200 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2cnc(-c3ccc(C(C)C)cc3)s2)CC1 1776169209 CVVBZBPWJYAETP-UHFFFAOYSA-N 384.545 5.176 30 20 GKED CC(F)(F)c1cccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c1 1776444964 XPOKIPSPDKFGJW-YHYXMXQVSA-N 382.362 5.653 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3ccc(C(=O)O)c(O)c3)o2)C(=O)c2ccccc21 1776526627 FYJCNHWTXNIKTI-PTNGSMBKSA-N 388.419 5.298 30 20 GKED CCCCCCCOc1ccc(/C=C\C(=O)c2ccc(C(=O)O)cc2O)cc1 1776785887 HGRXAZIFZWPZHN-ZROIWOOFSA-N 382.456 5.336 30 20 GKED CCCCCCCOc1ccc(CNCCCC[C@H](CCC)C(=O)O)cc1 1776786987 IFTHZUOZNNHOQF-NRFANRHFSA-N 377.569 5.797 30 20 GKED CCCCCCCOc1cccc(CN[C@](C)(Cc2ccccc2)C(=O)O)c1 1776787969 KMYJSTOUNGZFIZ-XMMPIXPASA-N 383.532 5.211 30 20 GKED COCc1ccc(C(=O)/C=C/c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1777232418 ONOIGSXFHYQYBD-PKNBQFBNSA-N 378.449 5.156 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)Nc1ccc(C2(NC(=O)/C=C\C=C\C)CCC2)cc1 1789457882 DNBNYHCBIGWACB-XCCCRBDCSA-N 378.516 5.021 30 20 GKED O=C(O)C(=O)/C(=C/c1ccc(-c2ccccc2)cc1)c1ccc2ccccc2n1 33498483 YXCWNRVEEWEWKI-LTGZKZEYSA-N 379.415 5.096 30 20 GKED C=CCn1c(SCc2cc(-c3cccs3)on2)nnc1-c1ccoc1C 57955673 SDVCIROZXQCLMN-UHFFFAOYSA-N 384.486 5.041 30 20 GKED C=CCN(C(=O)c1cccc2c(=O)c(C)c(-c3ccccc3)oc12)c1ccccc1 58642114 BLRAMUWYEUYNHC-UHFFFAOYSA-N 395.458 5.601 30 20 GKED N#CCc1ccc(NC(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)cc1 63389975 IPGIRHPTRFVPQO-QFIPXVFZSA-N 389.886 5.512 30 20 GKED C=CCn1c(SCc2noc(C(C)C)n2)nnc1-c1ccc(C(C)(C)C)cc1 64652845 NSDMCJKDGYCYSG-UHFFFAOYSA-N 397.548 5.227 30 20 GKED C=CCN(C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1nc(-c2ccccc2)cs1 107835420 FJWJMIWUKGJPPP-CVEARBPZSA-N 394.462 5.698 30 20 GKED C=CCn1c(S[C@H](C)c2cccnc2)nc2sc3c(c2c1=O)CCCCC3 115672845 ISIAUYLWIOBZHK-CQSZACIVSA-N 397.569 5.161 30 20 GKED CC[C@H](NC(=O)N[C@@H](CCC#N)c1ccccc1)c1ccccc1OC(F)F 131983677 QXSXWPFFWBNYTJ-ROUUACIJSA-N 387.430 5.083 30 20 GKED CCCCCCCCc1ccc2[nH]c3ccc(CCCCCCCC)cc3c2c1 142579812 AVWQSRXGFSWNGI-UHFFFAOYSA-N 391.643 9.127 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)c1cccc(C)c1Cl 165554480 MSWWQJWZFAJFFU-UHFFFAOYSA-N 377.831 5.268 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F)c1ccc(F)cc1F 178710279 JLTPKYGQMQHCPQ-SMDDNHRTSA-N 389.352 5.080 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1)c1ccccc1 188044652 UZYGBDLQVXTPDV-KDYSTLNUSA-N 383.557 5.422 30 20 GKED CC(C)c1ccccc1NC(=O)C[C@@H](C)Nc1cccc(OCCCC#N)c1 236780982 NCDLPARFPXKQKQ-GOSISDBHSA-N 379.504 5.322 30 20 GKED C=CCOc1ccc(CN[C@H](C)c2sc(-c3ccccc3)nc2C)cc1OC 237401620 UZXHWEQMPQXAEX-MRXNPFEDSA-N 394.540 5.543 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1nc2ccccc2n1C(F)F 250571601 XIBGIQCXGADDAH-RRFJBIMHSA-N 385.801 5.065 30 20 GKED Cc1ccc2cccc(N=C(O)N3CCC[C@@H](c4nc(C)c(C)s4)C3)c2n1 328611856 OVDKOZLMANEAJU-QGZVFWFLSA-N 380.517 5.042 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCC[C@H]1c1ccccc1 329835028 UTEHNDGOUVUCOI-QFIPXVFZSA-N 386.499 5.269 30 20 GKED CCN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CC(C)(C)C1 416769967 ORVONDKERXFMNP-UHFFFAOYSA-N 391.515 5.374 30 20 GKED CCSc1cccc(CNC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 433120710 OTVJZKNCHXDLTC-OAHLLOKOSA-N 385.558 5.372 30 20 GKED CC1(C)Cc2ccc(Cl)c(NC(=O)Nc3cccc(OCCCC#N)c3)c2O1 435330161 RYGCCWYFJNXPEH-UHFFFAOYSA-N 399.878 5.380 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CCC(=O)c1ccc2ccccc2c1 436364952 QPQLQWCOHRJKGP-DNQXCXABSA-N 396.490 5.101 30 20 GKED CC(C)=CCOc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c1 442674265 VQGHWZLJPBQLRU-FQEVSTJZSA-N 388.492 5.645 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)Nc2ccc(O)cc2C)cc1 443568577 HPMBVJBGDFYQGS-UHFFFAOYSA-N 389.411 5.017 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1SCCc2ccccc21 443853592 ITFIEQBBLCXVHS-LJQANCHMSA-N 376.506 5.256 30 20 GKED CC(C)(C#N)CC(=O)N(CCc1ccccc1)c1nc(-c2ccccc2)cs1 447124721 DOZGZOLXUURESG-UHFFFAOYSA-N 389.524 5.326 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@H]1c1ccco1 454752172 LEVKDKJCZBSGAH-DNVCBOLYSA-N 381.501 5.290 30 20 GKED CN(Cc1csc2ccccc12)C(=O)N[C@@H](CCCC#N)c1ccccc1 458796855 FJSNGFPOFUAPJD-FQEVSTJZSA-N 377.513 5.478 30 20 GKED CC(C)c1c(NC(=O)[C@H](C)c2cccc(C#N)c2)cnn1-c1ccccc1Cl 462341397 MJCCREIKLSQSAT-OAHLLOKOSA-N 392.890 5.263 30 20 GKED C=C(C)C[C@@H](C)C(=O)Nc1ccccc1CN(C)C(=O)c1cc2ccccc2o1 466432478 XIBISSJDOUEHDF-QGZVFWFLSA-N 390.483 5.246 30 20 GKED Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C[C@@H](CC#N)c1ccccc1 474897632 CWMHWPQZGLJMMW-HXUWFJFHSA-N 397.478 5.273 30 20 GKED N#CC[C@H](CC(=O)NCCc1ccc(OCc2ccccc2)cc1)c1ccccc1 474907538 UKEXRKAHIYNSGA-XMMPIXPASA-N 398.506 5.012 30 20 GKED C=CCN(C(=O)CCOC(C)C)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 476182520 ZVPJCURHNNLQHF-UHFFFAOYSA-N 399.343 5.451 30 20 GKED N#CCSc1cccc(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)c1 476938891 OEYADTJLXNWOCA-UHFFFAOYSA-N 385.901 5.331 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(-c4ccccc4)[nH]3)n2)cc1 477793597 PDZMLOVDADJJAL-GOSISDBHSA-N 383.476 5.604 30 20 GKED N#Cc1cc(Cl)ccc1CSc1nnc(-c2ccccc2F)n1C1CC1 479201719 KILOZAACWMYTDS-UHFFFAOYSA-N 384.867 5.236 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCCc4c(O)cccc43)c2)c1 480452199 GZNGGGJEWHOXLY-XMMPIXPASA-N 384.479 5.010 30 20 GKED Cc1ccc([C@H](Nc2c(C#N)cnc3c(F)cc(F)cc23)c2ccccn2)cc1 480581593 OARMBIVWGYFALL-QFIPXVFZSA-N 386.405 5.290 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccc(F)c(F)c1 480929028 PUSWZOUQCFLWKX-DJJJIMSYSA-N 388.462 5.449 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2NCc1cccc(COCC(F)(F)F)c1 481654154 CKGSRUUTVBRAGH-OAQYLSRUSA-N 388.433 5.194 30 20 GKED Cc1c([C@H](NC(=O)N[C@H](C)c2ccc(C#N)cc2)C(C)C)oc2ccccc12 483778031 XZSHAJTZZKXIBT-IIBYNOLFSA-N 375.472 5.370 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(-c2ccc(Cl)s2)on1)c1ccccc1 487207844 IEHYOSODLMQZHF-CQSZACIVSA-N 385.876 5.221 30 20 GKED N#CCCC[C@H](NC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)c1ccccc1 487249051 GHWXWCRMBIIHIT-HBFSDRIKSA-N 387.310 5.648 30 20 GKED N#Cc1ccc(Cc2cnc(NC(=O)[C@@H]3C[C@@H]3c3cccc(Cl)c3)s2)cc1 493732520 AKRFVRWOOCREQS-RTBURBONSA-N 393.899 5.001 30 20 GKED N#Cc1cc(NC(=O)C2(c3ccccc3)CCOCC2)ccc1Oc1ccccc1 493982782 BSPWKTLVCJAZSB-UHFFFAOYSA-N 398.462 5.037 30 20 GKED C=C(C)CN(CC)C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 497495534 ZBZVGJRWXKIQEW-CQSZACIVSA-N 378.925 5.041 30 20 GKED CCN(C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 509563231 DVCLRJBYNOMVHX-JSNMRZPZSA-N 386.417 5.290 30 20 GKED CCCOc1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)c1 512499630 PWNMAIVATRUZCZ-LJQANCHMSA-N 392.480 5.098 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(NC2CCOCC2)cc1 513071197 SEPUVMSMSVRFIR-UHFFFAOYSA-N 397.478 5.068 30 20 GKED CC[C@@H](C)[C@@H](C)N(C(=O)c1cccc(COc2ccccc2C#N)c1)C1CC1 513278783 HYIIQTRQFZSIMU-QZTJIDSGSA-N 376.500 5.176 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN1CCCC[C@@H]1c1ccccc1 518634202 ZBBYUCCYFICCQW-GHTZIAJQSA-N 393.556 5.247 30 20 GKED Cn1ccc2c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)c(Cl)c3)cccc21 519105388 OAIMQKXEPKMPJB-NRFANRHFSA-N 399.881 5.739 30 20 GKED CC[C@](C)(C#N)c1nc(-c2ccc(Oc3ccccc3C(F)(F)F)nc2)no1 520656311 LOBAPSIJXPWLKS-GOSISDBHSA-N 388.349 5.134 30 20 GKED Cc1cccc(C)c1OC[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 521261114 MHXKMJVWMLMXLN-YJBOKZPZSA-N 397.544 5.144 30 20 GKED CCOc1cccc([C@@H](C)NCc2cccc(OCc3cccc(C#N)c3)c2)c1 521834195 ROZOHQPWQWTQEM-LJQANCHMSA-N 386.495 5.387 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)[C@@H]1C[C@@H]1c1ccccc1OC(F)(F)F 524938047 KNFNNEXECROHJF-IAGOWNOFSA-N 393.380 5.043 30 20 GKED C[C@H]1CSc2ccc(Br)cc2[C@H]1NCc1ccc(C#N)cc1F 532567023 FJBQGUCSDPYJPG-VOJFVSQTSA-N 391.309 5.033 30 20 GKED COc1ccc(CNc2cc(Cl)ccc2SC)cc1OCCCC#N 533210199 WZTFSTRWQFVSAW-UHFFFAOYSA-N 376.909 5.365 30 20 GKED C=C[C@@H](CC(=O)N1CCC(c2nc(C(C)(C)C)cs2)CC1)c1ccccc1 536187125 PYLMMDUVOIDJDM-KRWDZBQOSA-N 382.573 5.507 30 20 GKED CN(C(=O)c1ccc(CC#N)cc1)[C@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 537334024 NSBJJROBQGLXLL-UXHICEINSA-N 386.417 5.180 30 20 GKED C[C@H](NCc1coc(-c2ccc(F)cc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542015865 UUUOFQOSCIMJKI-KRWDZBQOSA-N 397.453 5.870 30 20 GKED Cc1sc2nc(SCc3ccc(CC#N)cc3)n(C(C)C)c(=O)c2c1C 544073930 MWEXYIYUKOILHY-UHFFFAOYSA-N 383.542 5.014 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 545516161 RFOKZFSISVAZTG-AWEZNQCLSA-N 377.366 5.203 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)c1 554426329 PBFAABQNTDQXHU-OAQYLSRUSA-N 386.442 5.345 30 20 GKED CC[C@H]1Cc2ccccc2CN1C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 568144566 PXMIIGSXBRRNKH-NRFANRHFSA-N 398.466 5.114 30 20 GKED CC(C)(C)[C@H](NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1)C(F)(F)F 580508996 HMCSPAHAOPGHNC-NEPJUHHUSA-N 388.327 5.095 30 20 GKED N#Cc1cc(CNC2(c3noc(C4CCCC4)n3)CCCCCC2)ccc1F 581575526 TVKIPIDQZADNHV-UHFFFAOYSA-N 382.483 5.077 30 20 GKED N#CCCCCCC(=O)N[C@H]1CCCCC[C@H]1c1ccccc1C(F)(F)F 588162881 OKRTWRZPUXDFSD-HKUYNNGSSA-N 380.454 5.712 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CC3(CC=CC3)[C@H]2c2ccccc2)c1 592901268 KTOBDVYFUCJZMH-XMMPIXPASA-N 386.495 5.027 30 20 GKED C=CCN(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)[C@H](C)COC 596691127 IQFQXNGCALWWTI-UZLBHIALSA-N 397.906 5.050 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CCC[C@@H](CCF)C1 596703088 CZKKJGVCEKMCOZ-SFHVURJKSA-N 381.451 5.263 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1ccc2c(c1)CCCO2 596735250 XEYFICBBECUOOK-JKSUJKDBSA-N 395.528 5.146 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)C1 597914497 GLSDRVUJGBSHDV-PQMNFKMDSA-N 397.478 5.080 30 20 GKED CC[C@@H](C)Cc1c(C)sc2nc(S[C@@H](C#N)Cc3ccccc3)nc(O)c12 598795119 FZIUARJITAAZNN-CZUORRHYSA-N 397.569 5.521 30 20 GKED N#Cc1csc([C@@H]2Nc3ccccc3C(=O)N2c2cccc(C(F)(F)F)c2)c1 602761703 SUOMSSSQDJVFJD-GOSISDBHSA-N 399.397 5.410 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)c(C)c1 604044182 ADVVVCKIFOWPPW-LJQANCHMSA-N 399.494 5.193 30 20 GKED N#Cc1ccccc1-c1ccc(CN2CCCC[C@H]2c2noc(C3CC3)n2)cc1 609144290 IIUYSYHYYLGIMM-QFIPXVFZSA-N 384.483 5.213 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](COc2ccccc2)c2ccccc2)cc1 609355887 KOWAAJWXWSKGLM-QHCPKHFHSA-N 399.494 5.430 30 20 GKED CCCN(Cc1ccccc1F)C(=O)Nc1ccccc1S[C@H](C)CC#N 609435094 OXKXWCMUCMODCQ-MRXNPFEDSA-N 385.508 5.664 30 20 GKED C[C@H](CNC(=O)[C@@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccccc1 609466151 MGTAJYKWBRNPMU-RTBURBONSA-N 399.494 5.071 30 20 GKED CC(C)Oc1ccccc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 609643488 SKWBXRZYEHTAIR-UHFFFAOYSA-N 386.451 5.177 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](Cc2ccccc2)c2cccs2)cc1 609743547 CKCOWPPTNPHSPR-HXUWFJFHSA-N 389.524 5.655 30 20 GKED C[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1)c1ccc(Cl)s1 610540337 YJGAQEMRJBBGQT-LBPRGKRZSA-N 383.860 5.203 30 20 GKED C[C@H](N[C@H]1CCCc2nc(-c3ccccc3F)sc21)c1cccc(C#N)c1 610829697 FJFLSOAGIMJURP-LIRRHRJNSA-N 377.488 5.549 30 20 GKED CCC[C@@H](NC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccccn1 611802979 DMFJUYZVHTYFKB-MHECFPHRSA-N 398.510 5.522 30 20 GKED N#Cc1cccc(CN[C@H](CC(F)(F)F)c2ccc(Br)cc2)c1 612536372 QZRLGETYFAZQGZ-MRXNPFEDSA-N 383.211 5.104 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(C)n(C(C)C)c3C)n2)cc1 613315650 XHNFQQGTSHHSAJ-LJQANCHMSA-N 377.513 5.608 30 20 GKED CCCCN(C(=O)Nc1ncccc1OCCCC#N)[C@H](C)c1ccc(C)o1 615554687 UGGOLLDRZHEAGY-QGZVFWFLSA-N 384.480 5.061 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@H](Sc1ccccc1)c1ccccc1 618789812 PXLLOPTZWAJFDM-XZOQPEGZSA-N 384.504 5.195 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccccc2OC(F)F)ccc1OC 622266304 GKZZNFPHQLFGKA-OAHLLOKOSA-N 377.431 5.102 30 20 GKED FC(F)(F)c1ccc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)nc1 642186721 VBZLVWFNKQPNKY-IUCAKERBSA-N 380.254 5.422 30 20 GKED C=CCN(C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C1CC1 646439100 ZGLZXNAFRVPCFF-UHFFFAOYSA-N 384.295 5.158 30 20 GKED C=CC[C@@H]1CCCN(C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)C1 665908033 NCXPCMOWWUNQIA-GOSISDBHSA-N 377.488 5.067 30 20 GKED CC(C)[C@@H](C)N1Cc2ccc(NC(=S)Nc3ccc(C#N)c(Cl)c3)cc2C1 726493897 FVJCUDQNZCFISH-CQSZACIVSA-N 398.963 5.381 30 20 GKED C#Cc1cccc(N(CC)C(=O)c2cc(-c3ccco3)nc3onc(CCC)c23)c1 728480150 GMBZOSGKOKKONH-UHFFFAOYSA-N 399.450 5.083 30 20 GKED N#Cc1ccc(-c2ccn(Cc3csc(Cc4ccc(Cl)cc4)n3)n2)cc1 728710971 STNREJXMUZWMAC-UHFFFAOYSA-N 390.899 5.171 30 20 GKED CCN(C(=O)/C=C\c1ccccc1C#N)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 729254531 FDEBGAAVFWNFFE-BMGIKKBBSA-N 399.469 5.052 30 20 GKED C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)[C@@H](C#N)c1ccc2ccccc2n1 730685498 HGNZFYWNFGMLRM-DYVFJYSZSA-N 383.278 5.597 30 20 GKED O=C(/C=C/c1cccc(F)c1F)c1ccc(OC(F)F)cc1OC(F)F 730732739 PDIWGDDXBMWIOH-QPJJXVBHSA-N 376.252 5.064 30 20 GKED CN(CCc1ccccc1F)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 731752697 LXYBVAGRQDYBQI-UHFFFAOYSA-N 389.430 5.196 30 20 GKED CC[C@@H](Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 732903777 WPRURJCJQRFZRS-FXAWDEMLSA-N 390.508 5.264 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2ccccc2Cl)c1 733804317 BPHCBBJNDZGYRP-UTKZUKDTSA-N 397.906 5.068 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)OCc1cc(Cl)ccc1OCC#N 735339729 PIDRJDKRHZVCSI-UHFFFAOYSA-N 398.871 5.031 30 20 GKED CC(C)c1ccc([C@@H](C)NN=Cc2sc(N3CCCC3)nc2Cl)cc1 735972101 LMASNFATCNONOL-CQSZACIVSA-N 376.957 5.205 30 20 GKED C#Cc1cccc(NC(=S)N(CCC)[C@@H]2C[C@@H](OCC)C23CCCCC3)c1 741514792 XIAGIWXAEFNHSZ-NHCUHLMSSA-N 384.589 5.205 30 20 GKED CC(=NNc1ncnc2sc3c(c12)CCC3)c1cc(Cl)sc1Cl 744738760 KETMBHDWBRWPSD-UHFFFAOYSA-N 383.329 5.384 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H](C)Sc2cc(Cl)ccc2Cl)n1 747199431 TVKFYLVLECZQKU-CMPLNLGQSA-N 399.368 5.930 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3C[C@H]3c3sccc3C)n2)cc1 748834070 JRFOLMTVDXEACP-BRWVUGGUSA-N 378.522 5.468 30 20 GKED CCOc1c(OC)cc(/C=C2\CSc3ccc(Cl)cc3C2=O)cc1OC 750905608 OOWHLSXPFMFXFT-NTUHNPAUSA-N 390.888 5.128 30 20 GKED Cc1nc2ccc(/C=C3\SC(=Nc4c(C)cccc4C)NC3=O)cc2s1 754827041 KNGMNUSNTXHDPT-YVLHZVERSA-N 379.510 5.113 30 20 GKED C/C(=C/c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccccc2)cs1 759216703 FKDCOFMWIIPPPH-DEQJRXDXSA-N 378.884 5.743 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)N(C)C(=O)/C=C\c1ccccc1C#N 759291906 WBEPXROTQHFBDE-LKBMAGLMSA-N 387.508 5.223 30 20 GKED C=CCC[C@H](NC(=O)Nc1cnn(C)c1C1CC1)c1ccc(C(F)(F)F)cc1 771209839 GQTLXICTWMGZSV-INIZCTEOSA-N 392.425 5.145 30 20 GKED O=C(/C=C\c1cncc2ccccc12)c1ccc(OC[C@@H]2CCCCO2)c(F)c1 772803687 WGASEUODWVJAMZ-WSCHBXBGSA-N 391.442 5.218 30 20 GKED N#Cc1cccc(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)c1F 774991639 IGSTWGMKWZEARE-UHFFFAOYSA-N 388.370 5.115 30 20 GKED C=CCOc1cccnc1C(=O)O[C@@H](C)c1sc(-c2ccccc2F)nc1C 775245060 MVDVTDDDQFDWPJ-AWEZNQCLSA-N 398.459 5.135 30 20 GKED C=CCCC[C@@H](C)NC(=O)c1cc(Cl)c(NC(=O)OC(C)(C)C)cc1OC 775926180 SAQQVKQFXXTBBY-CYBMUJFWSA-N 396.915 5.170 30 20 GKED N#CCOc1ccc(CN[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1 776033486 JEPPFCMDAHDMQL-LJQANCHMSA-N 394.824 5.502 30 20 GKED Fc1ccccc1NC(=S)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 779729432 AERXKKTZQWGATL-CYBMUJFWSA-N 396.331 5.435 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1SC1CCCC1 780478999 ALUGJNCPLZRRMJ-HNNXBMFYSA-N 381.501 5.656 30 20 GKED N#Cc1ccc(NC(=S)NC23CCC(C(F)(F)F)(CC2)CC3)cc1Cl 782398371 YBDMFRVMIKOPDH-UHFFFAOYSA-N 387.858 5.153 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C#N)cc2Cl)ccc1OCC(F)(F)F 788359179 AKDHFRMJDXQVKT-UTCJRWHESA-N 395.764 5.057 30 20 GKED Cc1cc(F)ccc1CN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 792733335 UXBLPZAFLIZCQS-HSZRJFAPSA-N 387.458 5.454 30 20 GKED CC(C)c1ccc(N2Cc3ccc(NC(=O)NCC4(CC#N)CC4)cc3C2)cc1 797639894 NKUHKVOZLSRVCP-UHFFFAOYSA-N 388.515 5.146 30 20 GKED CCCCCCCCCNC(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 811995956 YUVGVLJUBZSVSR-GOSISDBHSA-N 376.545 5.324 30 20 GKED C=CCC1(C(=O)OCc2csc(N(C(C)=O)c3ccccc3)n2)CCCCC1 838149572 FMDAYKBXRVAXFH-UHFFFAOYSA-N 398.528 5.398 30 20 GKED CCc1ccc(-c2csc(NC(=O)c3ccccc3SCC#N)n2)cc1 901414438 CZAGUMBHBXYOSQ-UHFFFAOYSA-N 379.510 5.240 30 20 GKED CCN(CC)Cc1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915086927 YLAGMAVARRYSDS-VWLOTQADSA-N 397.522 5.436 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CCC2)c1 915181179 YAZKTOZTYJQITN-XMMPIXPASA-N 380.491 5.711 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2oc3c(C)cccc3c2C)cc1 920110346 DEIFJWOYQGTVKJ-XOBRGWDASA-N 388.467 5.524 30 20 GKED CC(C)c1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 920140424 GXMMGNXRLNUMEA-OAQYLSRUSA-N 399.519 5.614 30 20 GKED O=C(O)c1cc2cc(C=NNc3ccc(Cl)c(C(F)(F)F)c3)ccc2o1 1776090908 INDAHBFYDXLNBW-UHFFFAOYSA-N 382.725 5.249 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2Br)cc1 1776700060 SKYWCADNUIVXFG-FUWURINLSA-N 387.273 5.557 30 20 GKED CCCCCCC[C@H](CC(=O)O)NC/C(C)=C\c1ccccc1OC(F)F 1776782361 LJDSEHMHJUIVSA-BBLCHGJFSA-N 383.479 5.485 30 20 GKED CCCCOc1ccc(C(=O)/C=C\c2ccc(OC)c3oc(C(=O)O)cc23)cc1 1776801478 SRONYMSHGJQBAH-XFFZJAGNSA-N 394.423 5.215 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)cc1 32164012 FIIOXTJCGZRLEX-UHFFFAOYSA-N 395.462 5.191 30 20 GKED N#Cc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 41514615 UFXZDFQRVURXCF-GOSISDBHSA-N 391.883 5.144 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)c2cc(Cl)sc2Cl)cc1 56300547 UFQXLTHNOJAUNV-UHFFFAOYSA-N 395.311 5.121 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCc1ccc(OC(F)F)cc1 66954186 BGSLGCBADUPGRM-CYBMUJFWSA-N 391.443 5.004 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CCC(F)(F)F)c1 124163308 TXHXMQRFFPGTQH-UHFFFAOYSA-N 389.421 5.497 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 159808154 PCKZPKKKNZYRTE-BONVTDFDSA-N 385.876 5.048 30 20 GKED C[C@@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cc2ccccc2s1 170956097 RIWNFBQZCXKWCZ-OAHLLOKOSA-N 375.497 5.208 30 20 GKED N#CCCCCNC(=O)CCc1cn(Cc2ccc(Cl)cc2)c2ccccc12 171499166 VJMONYBQGIKVAK-UHFFFAOYSA-N 393.918 5.086 30 20 GKED CCc1cnc(CN(C)C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 175693685 GDPHMLKZWBBJNX-UHFFFAOYSA-N 392.484 5.033 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C2CC2)cc1 177748530 FRGPZCDQTGVYCX-UHFFFAOYSA-N 387.405 5.250 30 20 GKED N#C[C@@H](NC(=O)c1ccccc1SCc1cccs1)c1ccccc1Cl 179552763 GPJCONAWAOGAHE-GOSISDBHSA-N 398.940 5.688 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2Oc2ccccc2C#N)n1 182147176 RWRVGKZTHSSHPY-QGZVFWFLSA-N 387.464 5.421 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H](c2ccc(C)cc2)C2CCC2)ccc1OC 187338262 DAWNUJBSJFWQFA-XUZZJYLKSA-N 378.516 5.316 30 20 GKED CCN(C(=O)Nc1ccccc1SC[C@H](C)C#N)[C@@H](C)Cc1ccsc1 188911957 BYDPRIMNVVZLRW-CVEARBPZSA-N 387.574 5.485 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(Cl)s1)C(=O)Nc1ccc(Cl)cc1Cl 193467624 QSYPLQKCZHATSQ-XGQHYKRYSA-N 399.686 5.069 30 20 GKED C[C@@H]1CCN(CC(=O)Nc2ccccc2S[C@H](C)CC#N)[C@@H](c2ccco2)C1 245432167 BCWFGVHAWYRINB-ZHALLVOQSA-N 397.544 5.086 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCCCCO[C@H]2CCC[C@@H](C)C2)n1 245838907 BAHOOMQIBXCTRS-SQNIBIBYSA-N 376.566 5.598 30 20 GKED N#Cc1ccc([C@@H](S[C@H](c2ccccc2)c2ccc(Cl)cc2)C(N)=O)cc1 261440567 BOQIMYXORDIDDX-NHCUHLMSSA-N 392.911 5.261 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)c1cccc(-c2nc(C)cs2)c1 303757576 DIKZKGQJKODLTK-UHFFFAOYSA-N 375.497 5.043 30 20 GKED CCCS(=O)(=O)Nc1cccc(N=C(O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c1C 329015770 QGEOXXPGGKLVNY-FGTMMUONSA-N 392.565 5.341 30 20 GKED Cc1cc2c(cc1C)O[C@@H](C(O)=Nc1ccccc1-c1ncc3n1CCCC3)C2 329109530 PWTUETKCRPYEHT-JOCHJYFZSA-N 387.483 5.095 30 20 GKED C=CCCc1ccccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1 410370827 CKCZBEZNQRRWPC-UHFFFAOYSA-N 399.903 5.239 30 20 GKED CCC[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431290647 NHASPJPCTBTSJO-LEWJYISDSA-N 385.458 5.540 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(-c2nccs2)c1)c1ccccc1 432921959 IGQQUKDGZIDZKS-IBGZPJMESA-N 376.485 5.367 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)Nc1ccc(CC#N)cc1 436085412 UACVIVUAARQAIQ-UHFFFAOYSA-N 386.238 5.275 30 20 GKED N#CC1CCC(CNC(=O)c2cc(Cl)ccc2Sc2ccccc2)CC1 441149721 XDQUYLBGZDDIAR-UHFFFAOYSA-N 384.932 5.551 30 20 GKED CC(=O)c1ccc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)o1 445201794 AWIZPXRJMCZKIM-KRWDZBQOSA-N 378.815 5.043 30 20 GKED CC[C@@H](Nc1cc(C(=O)N2CCCCCC2)ccc1OC)c1ccc(C#N)cc1 447598816 IGZWEWVSFBWNDC-OAQYLSRUSA-N 391.515 5.146 30 20 GKED CC(C)[C@@H](C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1)c1ccccc1 463275910 NHRKKWUDCACVQN-HSZRJFAPSA-N 397.478 5.189 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1)c1ccc(C#N)cc1 463406342 VHAKMIREMUSXQR-CQSZACIVSA-N 393.849 5.776 30 20 GKED CC(C)(C)c1cc(NC(=O)[C@@H]2C[C@@H]2c2cc(F)c(F)c(F)c2)c(C#N)s1 464402104 XHFHWBPVRXHKRC-GHMZBOCLSA-N 378.419 5.077 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@@H](c3ccc(Cl)cc3)C3CC3)ccc21 469008144 NMWLUOLWYUQAQP-HSZRJFAPSA-N 393.918 5.486 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 475570893 DIYUJWAVYWNZEW-IFMALSPDSA-N 398.934 5.844 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)CS[C@H](C)c1ccc(C#N)cc1 476165436 UCTUQYKUEONNTG-UZLBHIALSA-N 382.529 5.019 30 20 GKED C=C(C)[C@@H](NCc1coc(-c2ccc(OCC)cc2)n1)c1ccc(F)c(F)c1 481610271 AJMRCBDDYURLLX-OAQYLSRUSA-N 384.426 5.426 30 20 GKED C[C@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(-c2ccccc2)no1 489709847 DIHMFGRQAHTTHQ-INIZCTEOSA-N 382.423 5.574 30 20 GKED N#CCC[C@@H](NC(=O)Nc1ccc(Oc2ccccc2F)nc1)c1ccccc1 490195260 UBXXPEIFJPQIGD-LJQANCHMSA-N 390.418 5.180 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc(C(=O)N(C)C)cc1 494928262 DEJHQCGWXMZHLT-MOPGFXCFSA-N 397.522 5.339 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)c1cccc2ncccc12 501142831 MGCLBGCYOQCDNK-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCSc2c(F)cccc21 503974839 TVRBQJLMRCOPEH-HNNXBMFYSA-N 396.940 5.475 30 20 GKED N#C[C@@H](C(=O)c1occc1-c1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 504561619 UJIJRRWRADAERQ-HNNXBMFYSA-N 396.830 5.839 30 20 GKED C[C@H](NC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccc(C#N)cc1 505364512 RCOINOIGQCSSSK-AOMKIAJQSA-N 389.886 5.361 30 20 GKED N#CCCCOc1cccc(CN2CCC(c3nc4ccccc4s3)CC2)c1 506113283 MMBBBFUVCOUKBQ-UHFFFAOYSA-N 391.540 5.358 30 20 GKED CCN(C(=O)CCC(=O)c1ccc2c(c1)CCCC2)[C@H](C)c1ccc(C#N)cc1 509576742 XZELACYYELAXGA-GOSISDBHSA-N 388.511 5.010 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3cccc(C(F)(F)F)n3)cc2)cc1 510555712 WKVBDWNOGGFXBS-UHFFFAOYSA-N 383.329 5.017 30 20 GKED Cc1sc(CN[C@@H](C)c2ccc(C#N)cc2F)nc1-c1ccc(Cl)cc1 512642301 OIIJJDKVZXLUNA-LBPRGKRZSA-N 385.895 5.634 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1 513942009 JJKHQKKBVLLPLW-UHFFFAOYSA-N 396.541 5.110 30 20 GKED CC(C)(C)c1ccc(-c2ccc(NC(=O)N3CCO[C@@H](C#N)C3)c(Cl)c2)cc1 518514503 XHFXVUMTGUQZGU-SFHVURJKSA-N 397.906 5.061 30 20 GKED CCC(CC)CN(CCC#N)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 520525056 HMQAOHVNFNZYIE-UHFFFAOYSA-N 387.911 5.106 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1ccc(-c2ccccc2)cc1 521327091 QDSYQJIBKMQJGX-GOSISDBHSA-N 386.520 5.929 30 20 GKED N#C[C@H](NC(=O)c1[nH]c2ccc(F)cc2c1Cl)c1cccc(Cl)c1Cl 521768315 CGTWNRJVLKTKSU-ZDUSSCGKSA-N 396.636 5.262 30 20 GKED C=CCCCCCN(C)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1C 523560662 ZERKFJLEARHELC-UHFFFAOYSA-N 385.552 5.077 30 20 GKED CC(C)(C)[C@@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)C(F)(F)F 525288883 BKNUTAOBDKLBAL-GOSISDBHSA-N 394.368 5.196 30 20 GKED C=C(C)Cn1c(S[C@H](CC)c2ccc(F)cc2F)nnc1-c1ccncc1 532273449 SZBXMKBLPCVTGG-GOSISDBHSA-N 386.471 5.438 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN1CCCCC[C@H]1c1ccco1 533435273 XGYDPDKXDLFWTM-MJGOQNOKSA-N 397.544 5.087 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cnc(-c4cccnc4)s3)cc2)c1 534173133 FCDTYZUWRFYRPD-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#CC1(c2ccccc2)CCC(N[C@H]2CCO[C@H]2c2ccc(Cl)cc2)CC1 537096708 IPORTWDPMMIDGT-NULCOVKLSA-N 380.919 5.164 30 20 GKED CC(C)C[C@@H]1C[C@@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 539718494 SVPCYXDRGNHZMK-SIKLNZKXSA-N 393.487 5.066 30 20 GKED N#C[C@@H](NC(=O)CC1CCC(C(F)(F)F)CC1)c1cccc(Cl)c1Cl 541221673 LKBOMKOPQGFZHH-QIMFLAQGSA-N 393.236 5.433 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cccs2)o1)c1nc(-c2ccccc2)cs1 543986527 XXTOAFUASXWYER-CQSZACIVSA-N 376.462 5.622 30 20 GKED C=CCSc1ccccc1NC(=O)CN[C@H](C)c1nc(C(C)(C)C)cs1 544484387 SVFOWXMTUPREJY-CQSZACIVSA-N 389.590 5.008 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)[C@H](C#N)c2ccncn2)c1 545446865 XTYVYFIDVGWLAM-QGZVFWFLSA-N 379.872 5.080 30 20 GKED CCCN(C(=O)Nc1ccc(C(C)(C)C#N)cc1)[C@@H]1CCCc2cccnc21 547829622 ZDZZHLOBEGWNRL-HXUWFJFHSA-N 376.504 5.204 30 20 GKED CC(C)N(C(=O)CSCc1ccc(C#N)cc1)c1ccc(F)cc1Cl 549402062 DMXYVHPBVXMTQZ-UHFFFAOYSA-N 376.884 5.026 30 20 GKED COc1ccc(Cl)cc1NC(=O)C[C@@H](C)N[C@@H](CCCC#N)c1ccccc1 551206063 PDVTVAIYWGDZHC-APWZRJJASA-N 399.922 5.090 30 20 GKED CC(C)(CC(=O)N1CCC(Oc2ccc(C#N)cc2F)CC1)C1CCCCC1 552695321 RJCXRWPAPLPANZ-UHFFFAOYSA-N 386.511 5.064 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1cc(Cl)cc(COC)c1 558595204 IKMDKCJBMPCBKA-UHFFFAOYSA-N 393.936 5.139 30 20 GKED CC(C)(c1noc(C[C@H](CC#N)c2ccccc2)n1)c1ccc(Cl)cc1F 564275096 CMXNXKSEGQDSET-HNNXBMFYSA-N 383.854 5.428 30 20 GKED N#CCC[C@H](C#N)CNc1ccc(Oc2nc3ccccc3s2)c(Cl)c1 570388349 KVWJVGYZVWAMLP-CYBMUJFWSA-N 382.876 5.597 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1ccccc1OCc1ccccc1 581146570 WAPKLWQTZIDXOD-BWKNWUBXSA-N 384.523 6.351 30 20 GKED N#Cc1c(Cl)cccc1SCc1nnc(-c2ccc(Cl)cc2Cl)o1 583224521 SALQQGBNRXTUEA-UHFFFAOYSA-N 396.686 5.861 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)cc1F 584499738 ZSLUNZVBUJGNOB-UHFFFAOYSA-N 389.883 5.139 30 20 GKED C[C@@H](NC1(c2ccc(C#N)cc2)CCC1)c1csc(-c2ccccc2F)n1 594518380 PNZWCVGNPPLPFX-OAHLLOKOSA-N 377.488 5.551 30 20 GKED CC(C)(C#N)c1ccc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2CC2CC2)cc1 602756403 KSIUTZBZTJTEGV-HXUWFJFHSA-N 379.891 5.118 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)C3(c4cccc(Cl)c4)CC3)n2)cc1 603477071 XVDQUKPELWDMJH-UHFFFAOYSA-N 379.872 5.005 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N(Cc2ccccc2)Cc2ccccc2)cc1 609205772 ZRWRGCSGFYRCGM-UHFFFAOYSA-N 383.495 5.722 30 20 GKED CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1cc(C#N)ccc1OC(F)F 609261899 JKABGQUGLDNJBA-KRWDZBQOSA-N 388.414 5.079 30 20 GKED CCC(CC)N(CCOC)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609434520 ULLFKMWSOMKRFB-UHFFFAOYSA-N 381.476 5.019 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 609722879 COWBSDMFCUZLTP-CQSZACIVSA-N 380.831 5.430 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)N[C@H](C)c2ccc(C#N)cc2)c1 609933014 VVHZOIPZWMEZFW-CYBMUJFWSA-N 393.434 5.404 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N[C@H](C)c3cccc(C#N)c3)cc2)n1 610322625 RFTGANQXMLVRGT-CQSZACIVSA-N 394.525 5.357 30 20 GKED Cc1cc(C)c(NC(=O)CCCN2CCC[C@H]2[C@H](C#N)c2ccccc2)c(C)c1 610844139 BTEBTLSIAUYOKH-PKTZIBPZSA-N 389.543 5.102 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N(C[C@@H](C)C#N)C2CC2)c(C(F)(F)F)c1 611095054 PDUWLMQKKFWOJJ-STQMWFEESA-N 399.482 5.752 30 20 GKED N#Cc1cc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)ccc1F 611434532 UGKJDVLUYZNDKW-SFHVURJKSA-N 382.788 5.610 30 20 GKED CC(C)(C)c1nn(Cc2ccccc2)cc1CNCc1ccc(C#N)c(Cl)c1 619749042 YFVSDJBGYONWML-UHFFFAOYSA-N 392.934 5.044 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(Cl)s2)n1)c1ccc2ccccc2n1 619753018 YKHDNRRLYDEMTI-LBPRGKRZSA-N 395.896 5.563 30 20 GKED C=CCCC[C@H](C)NCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 638837031 NSXHVDHANFCWAG-AWEZNQCLSA-N 377.941 5.316 30 20 GKED N#Cc1ccccc1-c1ccc(COC(=O)c2csc(-c3ccccn3)n2)cc1 726642589 HIUBZILODYGMCT-UHFFFAOYSA-N 397.459 5.101 30 20 GKED CCN(CC)[C@H](C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1ccccc1 729521349 XJEYSGRPIMHNSK-DQEYMECFSA-N 397.522 5.364 30 20 GKED Cc1ccc2c(c1)C(=O)/C(=C/c1csc(COc3ccc(Cl)cc3)n1)C2 730948530 GRLJGEGQQTWCNW-XNTDXEJSSA-N 381.884 5.506 30 20 GKED CC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1C 731966653 LIKXJYDBGHILFT-UHFFFAOYSA-N 399.450 5.064 30 20 GKED CC[C@H](Sc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1 732495583 DNJDVSYFOXYRMX-ICSRJNTNSA-N 392.549 5.866 30 20 GKED Cc1nc(CCC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)cs1 733104971 RYOGRNXSJLOQPA-UHFFFAOYSA-N 399.463 5.047 30 20 GKED C=CC[C@H](NC(=O)N(Cc1ccccc1)Cc1ccccc1C)c1ccncc1 734679854 KKHOXZPUJHUTSQ-DEOSSOPVSA-N 385.511 5.419 30 20 GKED C[C@H]1C[C@@H]1c1ccc(CCC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)o1 739594962 BKNGIENZXHYNME-YWZLYKJASA-N 390.508 5.252 30 20 GKED CC[C@@H](C)Oc1cc(/C=C/C(=O)c2c(Cl)nc3sccn23)ccc1OC 741844031 MQTVJINDSGMRTG-HOSRBBHYSA-N 390.892 5.131 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CCC4(CCCC4)C3)cc2F)c1 743138631 CUJTWTSCMFUUKU-UHFFFAOYSA-N 393.462 5.074 30 20 GKED CC(C)OCCOCc1cccc(N=Cc2cc(Cl)cc(Cl)c2O)c1 743538284 LAUAFEGWTQQYAG-UHFFFAOYSA-N 382.287 5.391 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)[C@@H](C)c1ccccc1 746371796 GSAHVYSFXMWIIP-CYBMUJFWSA-N 385.393 5.149 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1SC(F)F 746658212 AOPUEHVLQWHQSI-UHFFFAOYSA-N 389.471 5.563 30 20 GKED Cc1cc(F)ccc1-c1ccc(/C=C\C(=O)c2ccc3c(c2)CCC(=O)N3C)o1 754689907 NJCBDSBWBUUDBL-POHAHGRESA-N 389.426 5.199 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@H]1C)c1ccncc1 759580858 IXYNIQZBMIABHU-BFUOFWGJSA-N 390.314 5.335 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2cccnc2)C2CC2)cc1 759685624 YFRZWDMMJAMQMW-PKTZIBPZSA-N 382.467 5.010 30 20 GKED N#CCOc1ccc(-c2cc(-c3ccncc3)c3c4c(sc3n2)CCC4)cc1 773943781 NMBFFKQSCJYQFJ-UHFFFAOYSA-N 383.476 5.416 30 20 GKED C[C@H](c1ccccc1)N(Cc1ccccc1O)C(=O)[C@@H](C#N)CCc1ccccc1 774091628 VBXNVRSMRLYXFJ-NFBKMPQASA-N 398.506 5.255 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@H]1c1ccccc1 775489784 XVEHDEDLQZAHAC-PUZWTLIVSA-N 381.479 5.567 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccc(Cl)c(OC(F)F)c2)cc1Cl 779731575 DUSZIVNBNRZRLO-UHFFFAOYSA-N 388.226 5.275 30 20 GKED FC(F)(F)c1nc(NN=C2CCC[C@H](C(F)(F)F)C2)c2ccccc2n1 783515362 ZQRFDVQXQCUIAE-VIFPVBQESA-N 376.304 5.169 30 20 GKED COc1ccc(/C=C/C(=O)c2cc(C)c(OC)c(Cl)c2)cc1OCCCC#N 794723857 MUJAQWIFUFSCIA-SOFGYWHQSA-N 399.874 5.244 30 20 GKED O=C(O[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)[C@@H]1CCC(F)(F)C1 796745760 RFYUUXMYRBLNCT-LDYMZIIASA-N 376.243 5.287 30 20 GKED CCN(C(=O)c1ccc(C)c(C#N)c1)[C@H](c1ccc(Cl)cc1)c1ccccn1 799337083 BPOOXCUWZCMPST-JOCHJYFZSA-N 389.886 5.167 30 20 GKED N#Cc1csc(CN[C@@H](c2ccc(F)cc2)c2ccc(C(F)(F)F)cc2)n1 810152762 AWPROHWDGUEIIP-GOSISDBHSA-N 391.393 5.052 30 20 GKED COCc1nc(Cl)cc(NN=C2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)n1 814977426 NQNZSRBNVCDQLC-GFCCVEGCSA-N 398.816 5.031 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(CN3CCCC3)cc2)cc1 915180772 RQRUBYYLSJZOHE-VWLOTQADSA-N 395.506 5.190 30 20 GKED CCCCCCCCC(=O)Nc1ccc(N2CCOCC2)cc1C(F)(F)F 916397530 UBESLIXULUIDIJ-UHFFFAOYSA-N 386.458 5.231 30 20 GKED N#C[C@H](C(=O)Cc1cc2ccccc2o1)c1nc(-c2ccc(Cl)cc2)cs1 920110987 PSZAQXZZBJEISG-QGZVFWFLSA-N 392.867 5.629 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Sc2ccc(F)c(Cl)c2)cc1 924806691 DSECXNGECVCWOR-AWEZNQCLSA-N 376.884 5.215 30 20 GKED COc1ccc(-c2ccccc2C)cc1C=NNc1ccc(Cl)c(C(=O)O)c1 1776034066 KSIYQZNHKSLBMB-UHFFFAOYSA-N 394.858 5.468 30 20 GKED CC(/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O)=C\c1ccccc1C(F)(F)F 1776200189 ZATPSPPPYUXXCP-KQVSHLSWSA-N 386.369 5.490 30 20 GKED CCCCCCCOc1cccc(CNc2ccc([C@@H](C)CC(=O)O)cc2)c1 1776787436 MWOAODNSYIQXEE-IBGZPJMESA-N 383.532 6.226 30 20 GKED COc1cccc(Oc2ccc(/C=C/C(=O)c3csc(C(=O)O)c3)cc2)c1 1777382000 GDQSMNJCFWDQAH-JXMROGBWSA-N 380.421 5.143 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)CCc1ccc(-c2ccccc2F)o1 25320955 PQMMMBBXEDUYEZ-UHFFFAOYSA-N 399.805 5.158 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)C(=O)c1ccc(Cl)cc1 32789144 SGYSBNHYBDWTQA-HNNXBMFYSA-N 397.931 5.072 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1sccc1C1CC1 70859349 SEEHMWFLEKBLCH-UHFFFAOYSA-N 396.459 5.902 30 20 GKED CC(=O)CCCCCCC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 119122751 DEYKATQGISCLDC-UHFFFAOYSA-N 378.472 5.527 30 20 GKED CC[C@@H](C)n1ncc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1C1CC1 127920079 PMRNWDUTEFIEQF-RISCZKNCSA-N 398.919 5.485 30 20 GKED CN(Cc1cscn1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 146770557 BRSJZQBPVZSEKV-SFHVURJKSA-N 396.903 5.116 30 20 GKED CSc1ccc(O[C@H](C)C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)cc1 158773047 MNKGGJVZGLDRJZ-RDTXWAMCSA-N 394.521 5.176 30 20 GKED N#C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)c1ccc(Cl)c(Cl)c1 161221392 VQTYOPODMRMXFQ-SUNKGSAMSA-N 379.209 5.043 30 20 GKED N#Cc1ccc(-c2nnc(CN(Cc3ccccc3Cl)C3CCCC3)o2)cc1 173664659 CMTWNUFLUKVMHT-UHFFFAOYSA-N 392.890 5.206 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@@H](C)Cc2ccc(C(F)(F)F)cc2)n1 177761390 VCFUOVUJQMSGMH-SWLSCSKDSA-N 380.435 5.340 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1cccnc1 293277626 JPIPFKMUFHDDGI-KXBFYZLASA-N 380.517 5.091 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)CCCOc2cccc(Cl)c2Cl)cc1 303060491 ULPBPRSYHZHMLM-UHFFFAOYSA-N 391.298 5.592 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cccc2ccccc12 303216378 SVMVQPOVHGQFEI-UHFFFAOYSA-N 392.458 5.851 30 20 GKED O/C(=N/CC1CCC(C/N=C(/O)[C@@H]2C[C@H]3C=C[C@H]2C3)CC1)[C@H]1C[C@H]2C=C[C@H]1C2 330140528 POJWQQPHKQGPIH-DWQCYQSMSA-N 382.548 5.130 30 20 GKED CC1(C)Oc2ccc(N=C(O)N3CCCC[C@@H]3c3nc4ccccc4o3)cc2O1 330145710 LESQXKCJYALMBW-MRXNPFEDSA-N 393.443 5.108 30 20 GKED C=CCCc1ccccc1NC(=O)c1cnn(-c2ccccc2)c1C(F)(F)F 410364311 LTAHCSCQLYGDRZ-UHFFFAOYSA-N 385.389 5.262 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC2(CCC2)[C@@H]1C1CCOCC1 425663408 LLUNBIKTBXLUDC-QFIPXVFZSA-N 382.548 5.352 30 20 GKED CCn1ncc(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1-c1ccccc1 427607403 TVQSRRXUIUCUBE-INIZCTEOSA-N 390.512 5.074 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)C1(c2cc(F)cc(C(F)(F)F)c2)CC1 427735409 JESORDOSDYTWFV-JTQLQIEISA-N 385.323 5.113 30 20 GKED CSc1ccc(NC(=O)c2cnn(CCC#N)c2-c2ccccc2)cc1Cl 428644556 VXXPPBZQRWLXHZ-UHFFFAOYSA-N 396.903 5.091 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)c2ccc(CCC(F)(F)F)cc2)s1 430612384 RBAYBXOEQOAODA-CQSZACIVSA-N 380.435 5.426 30 20 GKED Cc1c(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)csc1Br 430622302 KUQIRFDIJXBCGM-SECBINFHSA-N 383.336 5.063 30 20 GKED CC(C)(C)c1cc(C(=O)Nc2ccc(Oc3ccccc3C#N)c(F)c2)no1 437459636 OCQDCLCKTWPZOF-UHFFFAOYSA-N 379.391 5.027 30 20 GKED N#Cc1cccc(C(=O)Nc2ccc(Cl)cc2-c2nc(C3CCCC3)no2)c1 439660185 ILYZQXSFXCDVEF-UHFFFAOYSA-N 392.846 5.172 30 20 GKED CC1(C#N)CCC(N[C@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)CC1 449266627 WCSIUSSFLPKPQG-HWOWSKLDSA-N 378.360 5.761 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@](C)(C(=O)OC(C)(C)C)C1 455255734 ZJEJAZYLKWOSNS-QHCPKHFHSA-N 386.536 5.124 30 20 GKED C=C(C)Cn1c(Cc2c[nH]c3ccccc23)nnc1N1CCC[C@H]1c1ccccc1 460543470 MTOLYDKRNWVPMJ-QHCPKHFHSA-N 397.526 5.268 30 20 GKED C=CCOc1ccc(CNC[C@H]2CCCN(C)[C@@H]2c2cccs2)cc1Cl 462729516 QYURJWHCLWQQPF-UTKZUKDTSA-N 390.980 5.139 30 20 GKED C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cn(CCCC#N)c2ccccc12 469455926 AKKHBTYJHURNDA-PKOBYXMFSA-N 389.474 5.102 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1 475553142 YGGURXRXWNOHCT-LAUBAEHRSA-N 380.532 6.445 30 20 GKED C=CCCCCNC(=O)N1CCC(c2nc(-c3ccccc3OC)cs2)CC1 479747850 SKKOYAOHSJPNNS-UHFFFAOYSA-N 399.560 5.064 30 20 GKED N#Cc1ccc(CSCC(=O)N(Cc2ccco2)c2ccc(Cl)cc2)cc1 482630673 CIJISLKUSVXEAM-UHFFFAOYSA-N 396.899 5.271 30 20 GKED CCN(CCC#N)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 492179585 DLKOHYQLGFTNLH-WUKNDPDISA-N 385.467 5.080 30 20 GKED CSc1ccc(N(C)C(=O)c2cccc(OCc3ccccc3C#N)c2)cc1 495146875 HPCRZJVXKZEJDJ-UHFFFAOYSA-N 388.492 5.136 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccc(F)c(F)c2)n1)c1nc2ccccc2s1 505312034 OCYHOOKUVIOADW-LLVKDONJSA-N 397.431 5.188 30 20 GKED O=C(N[C@H](c1c(F)cccc1F)C(F)(F)F)[C@H]1CCC[C@@H](C(F)(F)F)C1 505445602 KHMMMJKGUOEZOQ-IGJMFERPSA-N 389.286 5.053 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(Cl)cc1-c1nc2ccccc2[nH]1 509476870 PZQFRALYEHVVAI-UHFFFAOYSA-N 386.842 5.316 30 20 GKED C[C@@H](NC(=O)CCc1ccc(C#N)cc1)c1ccc(Oc2ccccc2)c(F)c1 515625025 YWYPABBPZPRDIK-QGZVFWFLSA-N 388.442 5.300 30 20 GKED COc1ccccc1C1(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CC1 517844736 VJBAYDANGKTQLF-UHFFFAOYSA-N 384.435 5.029 30 20 GKED COCc1ccc([C@@H]2CCCN2c2c(Br)cc(Cl)cc2C#N)o1 519776768 MNKLEPVECOJQMU-HNNXBMFYSA-N 395.684 5.055 30 20 GKED CCCn1c(C)c(C(=O)Nc2sc(CC)cc2C#N)c2cc(OC)ccc21 520003915 CZZGWJLIOWNMGM-UHFFFAOYSA-N 381.501 5.116 30 20 GKED N#C[C@H](C(=O)c1cccc(Nc2ccccc2)c1)c1nc(-c2ccncc2)cs1 524931687 GLHOQZMMQRPEKK-HXUWFJFHSA-N 396.475 5.439 30 20 GKED COc1ccc(-c2nc(CN3CCC[C@@H]3[C@@H](C#N)c3ccccc3)cs2)cc1 530970907 SGACSTVTVPCBCP-FCHUYYIVSA-N 389.524 5.090 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)n1 531732838 RRUKFGAFQYNJAW-HSZRJFAPSA-N 397.478 5.340 30 20 GKED CC(C)C[C@H]1C[C@H](NC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)CCO1 539718492 SVPCYXDRGNHZMK-KNQAVFIVSA-N 393.487 5.066 30 20 GKED CCc1cnccc1[C@@H](C)NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542974877 QMQGIUMDLXVOBT-QZTJIDSGSA-N 398.510 5.304 30 20 GKED N#C[C@H](C(=O)c1cc(Cl)ccc1Oc1cccc(Cl)c1)c1ccncn1 545447344 MQFQFHYDBGPOBR-INIZCTEOSA-N 384.222 5.066 30 20 GKED COc1ccc(C[C@H](N[C@H]2CCc3ccc(C#N)cc32)c2ccccc2)cc1OC 554997897 QSCCJNDUAWGTAX-ZEQRLZLVSA-N 398.506 5.136 30 20 GKED CC(C)(C(=O)Nc1ccc(Sc2ccncc2)cc1)c1cc(F)cc(C#N)c1 556936889 DEKNDVARPQTVFY-UHFFFAOYSA-N 391.471 5.160 30 20 GKED N#CCc1cccc(-c2nc(-c3ncoc3-c3cccc(C(F)(F)F)c3)no2)c1 558388736 KXXHVVLVDYQOMH-UHFFFAOYSA-N 396.328 5.143 30 20 GKED COc1cccc(CNc2ccc(Oc3ccnc(C#N)c3)cc2)c1OC(C)C 564418146 HEBGCMPMXRIPCW-UHFFFAOYSA-N 389.455 5.153 30 20 GKED CN(C(=O)CCCCCC#N)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 588755773 ZOUCJAFTTGWAIJ-UHFFFAOYSA-N 389.326 6.015 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@@H](C#N)c3ccc4ccccc4n3)sc2c1 591020061 JTTLOEHAOVRAAC-HNNXBMFYSA-N 376.868 5.901 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3cc4ccccc4n3CC#N)n2)cc1 591861751 DDSBXUQWHGJBLH-GOSISDBHSA-N 396.475 5.087 30 20 GKED C=C(C)CN1CCC(NC(=O)c2cc(C)c(-c3cccc(Cl)c3)s2)CC1 592071173 GDOLXIHORBDTSR-UHFFFAOYSA-N 388.964 5.147 30 20 GKED N#C[C@H](C(=O)c1cccc(OC2CCCC2)c1)c1nc2cc(F)ccc2s1 595869197 DEQPRDYRSJLCFT-QGZVFWFLSA-N 380.444 5.247 30 20 GKED N#CC[C@@H]1CCCN(C(=O)Nc2ccc(-c3ccc(Cl)cc3Cl)nc2)C1 596869703 XRUPRXRXVQUSMQ-ZDUSSCGKSA-N 389.286 5.213 30 20 GKED C[C@H]1CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C[C@@H](C)C1(F)F 599738440 WCNFGDNAKVPDTG-GASCZTMLSA-N 385.414 5.106 30 20 GKED C[C@@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1cc2ccccc2o1 603681150 SSQFBOCSHQNYHI-GOSISDBHSA-N 382.463 5.734 30 20 GKED Cc1c(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)cnn1C(C)(C)C 603751206 OVMGAJMDWMYGBH-CQSZACIVSA-N 398.576 5.283 30 20 GKED N#Cc1cccc(CNC(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)c1 603755546 ZGMOWPJLUYQYCB-UHFFFAOYSA-N 398.359 5.313 30 20 GKED CCCOc1c(Br)cc(/C=C\c2ccc(C#N)cn2)cc1OCC 603894150 UCEFPSFZFWUPRN-ALCCZGGFSA-N 387.277 5.074 30 20 GKED COc1cccc(CN(CC(C)C)C(=O)Nc2cc(C#N)ccc2OC(C)C)c1 604502411 ARSVJVAJPHZMST-UHFFFAOYSA-N 395.503 5.044 30 20 GKED Cc1csc(-c2cccc(C(=O)Nc3cccc(C#Cc4ccccn4)c3)c2)n1 606762006 UHEVZOSEQNXCAP-UHFFFAOYSA-N 395.487 5.166 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2ccsc2[nH]1 609072519 OVWGORFEHQGUNH-UHFFFAOYSA-N 387.464 5.241 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1cc2c(Cl)cccc2s1 609377488 GURBDYFNQRSLOJ-GFCCVEGCSA-N 386.929 6.059 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1cccc(Cl)c1Cl 609414288 GARJDYAFWHRZLE-DZKIICNBSA-N 379.674 5.131 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCCC4(CCCCC4)C3)cn2)c1 609554181 UOUIHCVRAHOQLN-UHFFFAOYSA-N 390.487 5.324 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)[C@]1(Cc2ccc(Cl)cc2)C[C@H]2CC[C@H]1C2 609814186 LFRIPVLBGIDIDO-AWRGLXIESA-N 392.930 5.219 30 20 GKED C[C@@H](NC(=O)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1)c1cccc(C#N)c1 610359424 IYTUHFHDAYZCDV-ZHRRBRCNSA-N 390.870 5.209 30 20 GKED Cc1cccc2sc(C(=O)Nc3nc4c(cc3C#N)CCCC4)c(Cl)c12 614297987 VTOHBFFHWQCOBR-UHFFFAOYSA-N 381.888 5.261 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1 619770249 NHJNNNPJRFABPZ-GFCCVEGCSA-N 395.812 5.133 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1cc(Cl)sc1Cl 725844925 BVDGXAKYAYMMEO-UHFFFAOYSA-N 377.256 5.580 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)C1CCCCC1 726324622 DSZCILHUMRIUIM-DNVCBOLYSA-N 377.513 5.465 30 20 GKED N#C[C@@H](C(=O)CSCc1ccc(Cl)cc1)c1nc2cc(F)ccc2s1 730419939 FPHZLRKGAXAPIA-AWEZNQCLSA-N 390.892 5.198 30 20 GKED Cc1cccc(/C=C2/CC(O)(C(F)(F)F)C/C(=C/c3cccc(C)c3)C2=O)c1 735792962 OTKGUZPXVQRVJP-YZLQMOBTSA-N 386.413 5.427 30 20 GKED C=CCOc1ccc(CNc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)cc1 742388069 KLSINCPQAOJXBM-KRWDZBQOSA-N 382.504 5.449 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C/c2ccc(-c3ccncc3)cc2F)cc1 751535009 LFSCLBLNJCUDER-RMKNXTFCSA-N 383.426 5.278 30 20 GKED C#CC[C@H](OC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1ccccn1 754533130 ACGQCWSKAGLDRO-IBGZPJMESA-N 390.266 5.049 30 20 GKED CC(=NO[C@@H](C)c1nnc(-c2ccc(C)c(C)c2)o1)c1cc2ccccc2o1 758410936 OUQFIEWJUOWKDD-INIZCTEOSA-N 375.428 5.601 30 20 GKED CN(CCC#N)c1ccc(CN2CCC(c3nc4ccccc4s3)CC2)cc1 768182556 GLRPHEDYOYPSLZ-UHFFFAOYSA-N 390.556 5.026 30 20 GKED O=C1/C(=C\c2ccc(Oc3cc(F)cc(F)c3)cc2)CCc2nc(O)ccc21 769615994 VEUSHAQPGTUIMW-ZROIWOOFSA-N 379.362 5.070 30 20 GKED N#Cc1cc(/C=C(/Br)c2ncc(-c3ccc(F)cc3)o2)ccc1F 770571890 YZWZKLKPPGSGNW-OVCLIPMQSA-N 387.183 5.384 30 20 GKED CC(C)Oc1ccc(Br)cc1NCc1ccc(O[C@@H](C)C#N)cc1 771198251 RMFWHRMTYPCYBK-AWEZNQCLSA-N 389.293 5.139 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2cccc(CC[C@H](O)c3ccccc3)c2)cc1 793626845 AOECWJKKZLMSQN-DEOSSOPVSA-N 398.506 5.406 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=S)Nc1ccc(OC(F)F)c(Cl)c1 794995600 PNHGYTMNMNZEMM-UHFFFAOYSA-N 396.890 5.717 30 20 GKED N#CC1CCC(CNC(=O)CCN2c3ccccc3Sc3ccccc32)CC1 799386802 DMHUFTROEQAMPP-UHFFFAOYSA-N 391.540 5.126 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(Cc2ccccc2)c1Cl 803178827 ATUFAFMLBDGJIY-UHFFFAOYSA-N 393.918 5.689 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\C(=O)c3ccccc3[C@@H]2C)cs1 809157182 QWNQHFCLGBCGLI-RANIVTSPSA-N 388.492 5.520 30 20 GKED N#C[C@@H](C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)c1cc(C(F)(F)F)ccn1 813213807 QBIJMDOFSMJRIE-TZMCWYRMSA-N 390.258 5.006 30 20 GKED C[C@@]12CC3CC(C(=O)[C@@H](C#N)c4cc(C(F)(F)F)ccn4)(C1)C[C@](C)(C3)C2 813217460 GSFFOAARJCAHSM-PROVZTNQSA-N 376.422 5.273 30 20 GKED CCOC(=O)Nc1ccc(C(=O)N[C@@H](CCCC#N)c2ccccc2)c(Cl)c1 820479614 ZGHCZFRHDJKQAD-IBGZPJMESA-N 399.878 5.073 30 20 GKED C#CC[C@H]1CCCN(C(=O)Nc2ccc(-c3csc(C(F)(F)F)n3)cc2)C1 831759640 JINGXZQFSSJAOV-ZDUSSCGKSA-N 393.434 5.096 30 20 GKED C[C@]1(CCNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C[C@]1(F)Cl 844501330 BIGIBPLJWPTYIR-SESVDKBCSA-N 385.870 5.168 30 20 GKED Fc1ccc(NC(=S)NC(CCC(F)(F)F)CCC(F)(F)F)cc1 849302631 DKCNBSJTESTGOJ-UHFFFAOYSA-N 376.341 5.166 30 20 GKED O=[N+]([O-])c1cc(C(F)F)ccc1N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 853226736 GEIMXFDGICUFKE-RKDXNWHRSA-N 392.246 5.100 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)CCc1ccc(C(C)C)cc1 916905142 ATLALSDBODHQNK-QFIPXVFZSA-N 390.527 5.215 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)CCCOc3ccc(F)cc3)n2)cc1 916975406 ZCKNZSCNBVFIQX-IBGZPJMESA-N 394.471 5.293 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 918548228 QBJHYTHMTDVXRR-KKSFZXQISA-N 375.497 5.156 30 20 GKED COc1cccc(Sc2ccccc2C=NNc2ccc(F)c(C(=O)O)c2)c1 1776062757 JCXQOYKIUIUYAR-UHFFFAOYSA-N 396.443 5.130 30 20 GKED O=C(O)c1ccc(NN=Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)cn1 1776069621 UNZIMUDCZQDEHT-UHFFFAOYSA-N 392.267 5.261 30 20 GKED Cc1ccc(C)c(C(=O)/C=C\c2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c1 1776133759 QEKJFOISPZKSEE-QDGLUTFLSA-N 386.447 5.404 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2ccc(OC)cc2)c1 1776788015 MEFNLNXSJLJCMW-QHCPKHFHSA-N 399.531 5.350 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)C2CCCCCC2)c1 1776788062 NEQUNWZVRMNZDB-QHCPKHFHSA-N 389.580 5.939 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C(=O)O)c2cccc(C)c2C)cc1 1776788306 ZDYIWTZRKYJUEQ-QHCPKHFHSA-N 383.532 5.568 30 20 GKED CSc1ccc(C(=O)/C=C\c2nc3ccccc3c(C(=O)O)c2C)c(Cl)c1 1777403296 LXODMOZRFURYEU-KTKRTIGZSA-N 397.883 5.513 30 20 GKED C[C@@H](NC(=O)CSc1cccc2cccc(Cl)c12)c1ccc(C#N)cc1 31436401 VPKQOSVMMSUWFE-CQSZACIVSA-N 380.900 5.334 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@@H](C)Sc2nc3cc(Cl)ccc3o2)cc1 58594598 QGJXYALCSYWPDJ-CQSZACIVSA-N 399.903 5.217 30 20 GKED CCCc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 63236782 RHJOIFNEDBXAIP-LJQANCHMSA-N 376.481 5.261 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)[C@@H]1CCC[C@@H](C(F)(F)F)C1 70868413 YMRASIKQBXOWGY-NXEZZACHSA-N 387.295 5.074 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1Cl 113144629 WKCCUVAWIWQORV-SMDADKPZSA-N 393.657 5.008 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 133048973 FQKWGJZNYHUJSJ-CQSZACIVSA-N 394.456 5.256 30 20 GKED CCO[C@H](CCNC(=O)c1ccccc1SCc1ccc(C#N)cc1)C(C)C 173551544 QXYCYGWFYKIKGR-OAQYLSRUSA-N 396.556 5.032 30 20 GKED C[C@H](Nc1cccc(OCCCC#N)c1)c1nc(Cc2ccc(Cl)cc2)no1 173968626 PESQKVVVZLYBGW-HNNXBMFYSA-N 396.878 5.169 30 20 GKED CCC(CC)[C@@H]1C[C@H](NC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCO1 181714712 ZNWHIQPREYCSLQ-WDYCEAGBSA-N 389.565 5.186 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N(Cc1cccs1)Cc1cccs1 184351576 ISPHDNYHCDWIMC-OAHLLOKOSA-N 397.525 5.335 30 20 GKED C=C(C)[C@@H](NCc1nnc(-c2cccc(Cl)c2)o1)c1ccc(F)c(F)c1 187783076 PVDFBHGLSSHLSZ-GOSISDBHSA-N 375.806 5.075 30 20 GKED Cn1ccnc1COc1ccc(C(=O)/C=C\c2ccc(Cl)c(Cl)c2)cc1 207054475 YORDRPZUGALPRE-OQFOIZHKSA-N 387.266 5.202 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ccnc3cc(Cl)ccc23)ccc1OC 301283409 QPXUNAHLBSRLKP-INIZCTEOSA-N 381.863 5.190 30 20 GKED Cc1[nH]nc(-c2ccccc2)c1N=C(O)C1CCC(/N=C(/O)C2CCCC2)CC1 330131546 PTVRFDBWYNMGNV-UHFFFAOYSA-N 394.519 5.679 30 20 GKED COc1ccc(N=C(O)N2CC[C@@H]3CCC[C@H]32)cc1N=C(O)C1CCCCC1 330245868 KVIBXWFJEKNKSF-HNAYVOBHSA-N 385.508 5.283 30 20 GKED N=C(O)N1CCCc2ccc(N=C(O)C3(c4cccc(F)c4)CCCCC3)cc21 330311636 NYDVBQUQLSQRQQ-UHFFFAOYSA-N 395.478 5.561 30 20 GKED N#CC1(CCCSCc2c(F)ccc(Br)c2F)CCOCC1 409872800 GYQBKXPOWNFCDM-UHFFFAOYSA-N 390.293 5.061 30 20 GKED CC(C)c1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)c(C(C)C)c1 424061471 FIOOVPIKOBQOIV-GOSISDBHSA-N 384.549 5.017 30 20 GKED C=C(C)C(C)(C)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccc(C)cc2)C1 424664364 OUUBZOCWJPZPNO-UHFFFAOYSA-N 391.515 5.126 30 20 GKED C=CCC1(C(=O)N2CCC(c3cccc(Cl)c3Cl)CC2)CCOCC1 424841223 ZDUBJCDVGJKTIZ-UHFFFAOYSA-N 382.331 5.072 30 20 GKED N#CCSc1cccc(C(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)c1 429868226 NPWLUPLYGVVQLK-LJQANCHMSA-N 398.940 5.537 30 20 GKED Cc1nc(-c2ccc([C@H](C)NC(=O)Nc3cccc(C#N)c3C)cc2)cs1 431701853 IQSVKSVQCVFBFH-AWEZNQCLSA-N 376.485 5.181 30 20 GKED CCOc1ccc(-c2nc(CN[C@H](CCCC#N)c3ccccc3)cs2)cc1 433020949 VMHLAXHKDPNAGJ-JOCHJYFZSA-N 391.540 5.734 30 20 GKED CC(C)COc1cccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)c1 433193277 PFHRYGSYGPOAPJ-YADHBBJMSA-N 377.488 5.025 30 20 GKED CCOc1ccc2c(c1)CCN(C(=O)Nc1ccccc1S[C@@H](C)CC#N)C2 434212314 TUPCLBOAKCPKQR-INIZCTEOSA-N 395.528 5.070 30 20 GKED C[C@](NC(=O)C1CCC(C(F)(F)F)CC1)(c1ccc(F)cc1)C(F)(F)F 436043882 SZISAXGJMXQUBJ-QHAMSDLMSA-N 385.323 5.088 30 20 GKED N#Cc1ccc(SCc2nc(-c3ccccc3F)no2)cc1C(F)(F)F 436057007 ZSVJEMALCHWBHB-UHFFFAOYSA-N 379.338 5.058 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc2ccc(Cl)cc2n1 437558809 NMOOTCBZJPSOAI-CYBMUJFWSA-N 381.888 5.535 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCCC2(CCCCCC2)C1 438079942 ZVHGWWIXFAJZQN-SFHVURJKSA-N 385.577 5.907 30 20 GKED CO[C@H]1CCCC[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 440919023 DKRALPPYFBVSOX-GIVPXCGWSA-N 397.906 5.075 30 20 GKED Cc1ncc(-c2ccc(NC(=O)c3cn(CCCC#N)c4ccccc34)cc2)o1 443904875 WPSKYLYOAPXBGH-UHFFFAOYSA-N 384.439 5.161 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)[C@]1(C#N)C[C@@H]1C 450005124 UVDKTQZBCBOVQW-WNSKOXEYSA-N 390.462 5.220 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](C)c1ccc(F)cc1Cl 458875157 PJCFBEIOCMVHAY-HNNXBMFYSA-N 392.906 5.105 30 20 GKED C=CCn1c(S[C@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1ccccc1F 463030821 ATNJHUICYWGUQC-CYBMUJFWSA-N 384.436 5.032 30 20 GKED N#Cc1cccc(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1F 464092248 MZOAINDKYCNWGV-UHFFFAOYSA-N 397.812 5.354 30 20 GKED CC[C@H](NC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)c1ccc(Cl)s1 465921105 JTFWVYLASDUJQT-IKGGRYGDSA-N 387.936 5.334 30 20 GKED N#CC[C@H](CC(=O)N(Cc1cc(F)ccc1F)C1CCCC1)c1ccccc1 476289469 GTTDVSIAOXFRBJ-GOSISDBHSA-N 382.454 5.324 30 20 GKED C=CCN(CCOC)C(=O)Nc1ccc(S[C@@H](C)CC)cc1C(F)(F)F 483691036 ICKXHMNNCPRWGJ-ZDUSSCGKSA-N 390.471 5.262 30 20 GKED Cc1cc(NCc2ccc(-c3ccccc3C#N)cc2)ccc1C(=O)NC(C)C 487393350 IBWQYUQLXXZTCA-UHFFFAOYSA-N 383.495 5.284 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1ccc(CN(C[C@H]2CCCCO2)C(C)C)cc1 488562977 SWYRZEDYHOGBML-DHIUTWEWSA-N 399.579 5.039 30 20 GKED CN(CC(C)(C)C#N)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccccc1)CC2 497215849 SIGQCUTXJHMUNJ-CYVLTUHYSA-N 395.506 5.343 30 20 GKED CCc1sc(C(=O)[C@H](C#N)c2nc(C(C)C)cs2)cc1Br 498063145 RKCWIHOHBICNED-VIFPVBQESA-N 383.336 5.143 30 20 GKED N#C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1Cl 499954197 DDBASLMCUUUXCJ-HNNXBMFYSA-N 393.855 5.204 30 20 GKED Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@H](C)Oc1ccc(C#N)cc1 500744939 QHOJDYKXGMFHID-KRWDZBQOSA-N 388.492 5.424 30 20 GKED Cc1cccc(NC(=O)c2sc3ccc(C#N)cc3c2C)c1Br 500811451 YHPSVUPIBSDDRO-UHFFFAOYSA-N 385.286 5.405 30 20 GKED C[C@@H](Cc1cncc2ccccc12)C(=O)Nc1nc(-c2cccc(C#N)c2)cs1 502071610 PLYLSCWXWDGQLY-HNNXBMFYSA-N 398.491 5.047 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3ccc(Oc4ccccc4)nc3)n2)c1 502464483 SHBGUONDFXHBNK-UHFFFAOYSA-N 398.447 5.121 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)c(Cl)c3)CC2)cc1 503874328 NQDPZZLQUSDLPW-RTBURBONSA-N 397.305 5.284 30 20 GKED N#CCCN(C(=O)CSc1ncc(-c2ccc(Cl)cc2)o1)c1ccccc1 505065630 QWNHPTVLRNKAHA-UHFFFAOYSA-N 397.887 5.034 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(Oc2ccccn2)cc1 505225850 NYDIKGYHDFUSDP-UHFFFAOYSA-N 391.430 5.665 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3cc(Cl)ccc3C)n2)cc1 511906330 UTRGIZSAPQKKDW-QGZVFWFLSA-N 382.872 5.271 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2Cl)c1 518372930 GHLJEJYXIMBLGQ-IAGOWNOFSA-N 389.282 5.418 30 20 GKED N#CCCC[C@@H](NC(=O)N1CCC(c2cccc(F)c2F)CC1)c1ccccc1 519099611 HEHOLNKHIOFDLN-OAQYLSRUSA-N 397.469 5.289 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)c2)cc1 519122559 MMHCVRDCVCZJTK-UHFFFAOYSA-N 399.362 5.257 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1sc2c(c1-c1nc3ccccc3s1)CCC2 521975929 QFIGXBIWAJZDMY-ZDUSSCGKSA-N 398.553 5.433 30 20 GKED CC(C)N(Cc1ccco1)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 522573380 QIHGWLCUQRBIAC-UHFFFAOYSA-N 394.858 5.648 30 20 GKED Cc1nc(-c2ccsc2)ccc1C(=O)Nc1sc2c(c1C#N)CCCC2 523868189 UBSCUUPMOANYHF-UHFFFAOYSA-N 379.510 5.183 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@@H]2c2cc(Cl)cc(Cl)c2)sc1SCC#N 525656749 YREAVMJMTUCNBF-CHWSQXEVSA-N 398.340 5.116 30 20 GKED C=C[C@H](CC(=O)NCc1cccc(NC(=O)c2ccc(C)cc2)c1)c1ccccc1 535350421 PJWONXJLEBVEFZ-OAQYLSRUSA-N 398.506 5.223 30 20 GKED N#CCCCOc1cccc(CN2CCC[C@@H](c3nc4ccccc4s3)C2)c1 535781619 GUQQYUJTUVHHER-LJQANCHMSA-N 391.540 5.358 30 20 GKED CC[C@@H](C)n1c(SCCCC2(C#N)CCOCC2)nnc1-c1ccccc1 537504982 DYUVSGLDBFPNLM-QGZVFWFLSA-N 384.549 5.109 30 20 GKED N#Cc1cc(C(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)ccc1Cl 540467295 PULPOAAAJAOYMU-UHFFFAOYSA-N 382.250 5.107 30 20 GKED Cc1ccc(Sc2ccc(Cl)cc2)c(C(=O)N2CCC(C)(C#N)CC2)c1 545425336 AHLJZPIKZXVHNW-UHFFFAOYSA-N 384.932 5.566 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1 553311159 WAXVXCLTYKVEPI-DEOSSOPVSA-N 397.478 6.028 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(Oc2cccnc2)cc1 564175605 QQYJQQFWLGDXLL-PKTZIBPZSA-N 398.466 5.178 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N(CC3CC3)C3CCCCC3)cc2)ccn1 567799927 LTPRLBWPOUTDNE-UHFFFAOYSA-N 390.487 5.322 30 20 GKED N#CC1(c2nc(-c3ccc(Sc4ccc(Cl)cc4)cc3)no2)CCOCC1 580058947 KQOMHZIJXILNLY-UHFFFAOYSA-N 397.887 5.113 30 20 GKED CC(C)c1oc([C@@H]2CCCN2C(=O)CCCCCC#N)nc1-c1ccccc1 588377068 PVOBIOLWZIGXNR-IBGZPJMESA-N 379.504 5.603 30 20 GKED Cc1ccc(-c2nn(CCC#N)cc2C(=O)Nc2cccc(F)c2Cl)cc1C 589057365 VLVGBSQIATWABS-UHFFFAOYSA-N 396.853 5.125 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N(C3CCCCC3)C3CC3)cc2)ccn1 589365565 QNSFHJHHUGJYPX-UHFFFAOYSA-N 376.460 5.075 30 20 GKED C=C(C)COc1cccc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2C)c1 589382393 BQXVTYLQXBUPPC-UHFFFAOYSA-N 381.863 5.041 30 20 GKED N#C[C@@H](C(=O)c1ccccc1Oc1ccccc1)c1nc2cc(F)ccc2s1 592974476 YXYHQJBUHZEULX-KRWDZBQOSA-N 388.423 5.718 30 20 GKED CC[C@H](C)n1c(Sc2nc(C#N)c(Cl)s2)nnc1-c1ccccc1 596105051 LYSBVVZYCIWTOJ-JTQLQIEISA-N 375.910 5.049 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(C(C)(C)C)nn1C(C)(C)C 601161928 AFVHCYNQKBXWDM-UHFFFAOYSA-N 386.515 5.295 30 20 GKED C[C@H](Oc1ccccc1C#N)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 603559425 OBGWUPBMORDCFM-ROUUACIJSA-N 390.508 5.177 30 20 GKED COCc1cccc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)c1 603673315 DBANKUKKAFVAPB-OAQYLSRUSA-N 390.870 5.394 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(CSc2ccc(C#N)cc2)cs1 603947468 MSQFPPVCVFPHGA-UHFFFAOYSA-N 383.473 5.131 30 20 GKED C=CCN(C(=O)[C@H](C)c1ccc(F)c(F)c1)c1nc(-c2ccccc2)cs1 607766398 RRZRSBWVHPLYQL-CQSZACIVSA-N 384.451 5.411 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)COc1ccccc1C#N 609066317 CDLZTMZACNXHDM-GOSISDBHSA-N 386.451 5.024 30 20 GKED Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(F)c(C#N)c1 609103223 AQSQKFYCIBLIKA-UHFFFAOYSA-N 396.425 5.111 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)NC[C@@H]3CCOc4ccccc43)cc2)cc1 609422402 QXTUOLKGRCUMQQ-SFHVURJKSA-N 399.450 5.038 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)CNc3cccc(Cl)c3)c2)cc1 609622559 XQFMQSQDMVQAIB-UHFFFAOYSA-N 377.831 5.055 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C)ccc1NC(=O)Nc1ccc(C#N)cc1 610010869 RDFNYOKMGORQIW-UHFFFAOYSA-N 399.429 5.204 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3[C@H]4CC[C@H]3c3ccccc34)cn2)c1 610094049 DWBVXFFWYMTSSN-SFTDATJTSA-N 382.423 5.169 30 20 GKED N#Cc1ccccc1Sc1ccc(C(=O)Nc2c(F)cccc2Cl)cc1 612391557 OSFOGPPDBBLIIV-UHFFFAOYSA-N 382.847 5.754 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3nc(-c4ccccc4)oc3C)n2)cc1 613315232 DABRVSUNJNRTHJ-SFHVURJKSA-N 399.475 5.572 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cc4ccc(F)cc4s3)n2)cc1 613315287 LDPSSTXILDGTPI-INIZCTEOSA-N 392.480 5.962 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1cnc(-c2ccccc2Cl)s1 622702774 RRVWGGAHNHTXKW-UHFFFAOYSA-N 398.915 5.301 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCC(=O)Nc1c(F)cccc1F 635843665 CKRVFNOCRMEDRF-UHFFFAOYSA-N 386.442 5.174 30 20 GKED C[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc(F)ccc1F 675737355 GAALXMNSIMOKSV-GUBZILKMSA-N 375.303 5.525 30 20 GKED C=C[C@@H](CC(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccccc1 677515321 TUMGWLDVBXUNHH-ARLBYUKCSA-N 393.371 5.372 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)CSc2cccc(OC)c2)c1 728181886 HYLHFGOCNMIWKB-UHFFFAOYSA-N 393.533 5.064 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccc(Cl)cc4)sc3C2=O)cc1O 728438446 FPZMVWBTFCYQEF-UVTDQMKNSA-N 397.883 5.390 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)C[C@H](c1ccccc1)C(F)(F)F 728460461 MGJXKPFMBNPNTL-CQSZACIVSA-N 397.780 5.252 30 20 GKED Cc1cccc(COc2ccc(N[C@@H](C)C(=O)Nc3ccccc3C#N)c(C)c2)c1 729855741 TXSASLACBGQWQY-IBGZPJMESA-N 399.494 5.193 30 20 GKED O=C(CSC(F)(F)F)Nc1cc(C(F)(F)F)ccc1SCC(F)F 741603106 KBGOHIHMSOCGTE-UHFFFAOYSA-N 399.328 5.254 30 20 GKED O=C(/C=C/c1cn2cc(Cl)ccc2n1)c1ccc(SCC(F)F)cc1 741841169 DRXBGUQGLWAFEU-QPJJXVBHSA-N 378.831 5.241 30 20 GKED COc1ccc(/C=C2/CCc3nc(-c4ccc(F)cc4)sc3C2=O)cc1C#N 741841613 MSNBDMROVOUXIG-GDNBJRDFSA-N 390.439 5.042 30 20 GKED O=C(O[C@@H](c1cccc(C(F)(F)F)c1)C(F)(F)F)c1ccc(F)cc1F 746439206 JBTBLLOXTBFODH-ZDUSSCGKSA-N 384.222 5.444 30 20 GKED CC(C)(Cc1ccc(Cl)cc1Cl)NC(=O)Nc1cccc(OCC#N)c1 746718964 WBRZLWDAJLSGDZ-UHFFFAOYSA-N 392.286 5.039 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(F)cc2OC(F)F)c1 748440644 PISLINWQKBQBSQ-TWGQIWQCSA-N 375.346 5.006 30 20 GKED C[C@H](OC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)F)(C3)C2)c1ccc(C#N)cc1 751290107 VGLJLTCEAHJRCW-ZCOSWFLJSA-N 377.406 5.311 30 20 GKED CCN(CC)C(=O)Nc1ccc(C(C)=NNc2c(F)cccc2Cl)cc1 769829946 UYFVFWZUIABWRU-UHFFFAOYSA-N 376.863 5.189 30 20 GKED C[C@@H]1C[C@@H](C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3Cl)cs2)CCO1 776513920 BTNIWTLXTGNVHW-SUNKGSAMSA-N 395.311 5.108 30 20 GKED C=CC[C@H](OC(=O)c1nc(-n2nc(C)cc2C)ccc1Cl)c1ccccc1 778738963 KYWQFKMJRQHSHU-SFHVURJKSA-N 381.863 5.012 30 20 GKED N#C[C@H](C(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1)c1nc(-c2ccc(Cl)cc2)cs1 796799394 TXMFGZNPWDFOBE-YRGRVCCFSA-N 398.837 5.618 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)C[C@@H]3CCC(F)(F)C3)cc2F)c1 797856888 QVQJDUBQDRSSNA-AWEZNQCLSA-N 388.389 5.040 30 20 GKED CC(C)[C@H](C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccnc1 797943056 MWYCVYJNXVYYOW-HKUYNNGSSA-N 395.915 5.475 30 20 GKED Cc1cc(O)nc2cc(C(=O)Oc3ccc(-c4ccc(C#N)cc4)cc3)ccc12 807922422 CMGODGQUATZITQ-UHFFFAOYSA-N 380.403 5.007 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OC[C@H]1CC[C@@H](C#N)CC1 809088876 GUCDCHNOIIIHMQ-SOUVJXGZSA-N 388.920 5.242 30 20 GKED Cc1cc(F)ccc1-c1nc(C(C)(C)C(=O)OCC2(C#N)CCCC2)cs1 810661008 WFHMIGLMBTYSDK-UHFFFAOYSA-N 386.492 5.162 30 20 GKED N#C[C@@H](C(=O)CSc1ccc2ccccc2c1)c1cc(C(F)(F)F)ccn1 813218155 MLFNTZZXMVOGIZ-QGZVFWFLSA-N 386.398 5.222 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)C3(C(F)(F)F)CCCC3)n2)cc1 842295165 BHJZGYGQLCZSJA-CQSZACIVSA-N 394.418 5.118 30 20 GKED COC(=O)CCSc1cc(Cl)ccc1N[C@@H](C)c1ccc(C#N)c(F)c1 864025083 MZHQOBHOAVMGKH-LBPRGKRZSA-N 392.883 5.179 30 20 GKED CC(C)(C)OC(=O)Nc1ccc(C(=O)N(O)Cc2cccc3ccccc23)cc1 901370586 KMFSKUXEEWCJNR-UHFFFAOYSA-N 392.455 5.218 30 20 GKED Cc1ccc(-c2nc(CC(=O)[C@H](C#N)c3nc4ccccc4s3)cs2)cc1 915099411 UWSDQYJNXSSZGV-INIZCTEOSA-N 389.505 5.147 30 20 GKED COc1ccc2nc(C)c(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cc2c1 915101665 DVDFGLIHHUELDH-LJQANCHMSA-N 399.475 5.165 30 20 GKED Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1/C=C/C(=O)c1ccncc1 916136408 NIVNZOYFQBUJBW-AATRIKPKSA-N 391.780 5.144 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](CC)c1ccccc1OC 916496787 RLRNVKAQOUZVKT-INIZCTEOSA-N 378.925 5.259 30 20 GKED CC(C)(C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 916975975 HLKLYZDXWLFGDT-QGZVFWFLSA-N 380.900 5.618 30 20 GKED C[C@@H](Cc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921131345 IYTWQTPGPWRFIO-SCLBCKFNSA-N 398.890 5.658 30 20 GKED O=C(O)c1ccccc1NN=Cc1sc(Sc2ccccc2)nc1Cl 1776030810 SPJQAEYNAFQCNV-UHFFFAOYSA-N 389.889 5.092 30 20 GKED C[C@H](C=NNc1ccc(Cl)c(C(=O)O)c1)c1cccc(Br)c1 1776033407 CDTQUCHWXUEFMR-SNVBAGLBSA-N 381.657 5.002 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C\C(=O)c3cccc4ccccc34)s2)c1 1776114524 RPZUHMOBNQIRHG-QBFSEMIESA-N 384.456 6.163 30 20 GKED C/C(=C\c1c(F)ccc2sc(C(=O)O)cc12)c1nc2ccccc2n1CC#N 1776199469 SJUUCRGXWOWZQJ-ZRDIBKRKSA-N 391.427 5.172 30 20 GKED C[C@@H]1Oc2ccc(/C=C\C(=O)c3ccc(-c4ccc(C(=O)O)o4)cc3)cc2[C@H]1C 1776669732 SJQJHKZIEXDORF-NXGLGIDOSA-N 388.419 5.425 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@H]3CCC5)s2)cc1 1777671023 UEHWNXFSCAMNCV-YNGKYYQNSA-N 386.472 5.813 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccc(C)cc2)nc1 61659129 HTBZFSZFOPWCST-UHFFFAOYSA-N 379.485 5.464 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc2c(c1)oc1ccccc12 63391708 RKFREQSBLVOHCB-UHFFFAOYSA-N 381.435 5.678 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)CCC(=O)c2ccc(F)cc2)cc1 65680119 WUZHRSDLYFXVCE-UHFFFAOYSA-N 388.398 5.091 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc(-c2ccccc2)s1 66800306 QYVASICYSBOAKC-AWEZNQCLSA-N 379.510 5.457 30 20 GKED C[C@H](C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1F 109039533 WGWVVICXZLMEDQ-WCQYABFASA-N 386.398 5.207 30 20 GKED CN(C(=O)Nc1ccccc1COc1ccc(CC#N)cc1)C1CCCCC1 126617121 DUTZTZGWAIDABP-UHFFFAOYSA-N 377.488 5.128 30 20 GKED N#Cc1ccc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)s1 134506973 DGLLNTQISQHBIG-CSKARUKUSA-N 392.867 5.422 30 20 GKED COc1cc(O[C@@H](C)c2nnc(-c3ccc(Cl)cc3Cl)o2)ccc1C#N 194489607 BOOUUXZHUGWISV-JTQLQIEISA-N 390.226 5.064 30 20 GKED COc1cc(/C=C\C(=O)c2oc3ccccc3c2C)c(Br)cc1O 214122733 KYMPSQCLNATCPY-FPLPWBNLSA-N 387.229 5.114 30 20 GKED CC1(C)C(O)=Nc2cc(C(O)=Nc3ccc4c(c3)OC3(CCCC3)O4)ccc21 328678388 BCGOJEHJWWNDHK-UHFFFAOYSA-N 378.428 5.244 30 20 GKED N=C(O)C1CCC(/N=C(/O)COc2ccc(Cl)cc2C2CCCCC2)CC1 328983750 YYBZQUVQKFAXFI-UHFFFAOYSA-N 392.927 5.817 30 20 GKED C[C@H]1CN(C(O)=Nc2cccc(-c3ncc4n3CCCC4)c2)[C@@H]1c1ccccc1 330265910 ZXCHBJQUUWBAIM-JTSKRJEESA-N 386.499 5.125 30 20 GKED CC(C)/N=C(/O)[C@@H]1CCC[C@H](/N=C(/O)c2c[nH]nc2-c2ccc(Cl)s2)C1 330294676 FHNDOETUAIWOJB-NEPJUHHUSA-N 394.928 5.020 30 20 GKED CC(C)N(C(=O)c1cccc(SCC#N)c1)c1ccc(Cl)c(Cl)c1 429811207 SXPOBRIWHWISJR-UHFFFAOYSA-N 379.312 5.664 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 432082602 UNDSKCYQJZVUDZ-AOMKIAJQSA-N 397.519 5.415 30 20 GKED COc1ccc([C@@H](NCc2cc(C#N)ccc2OC)c2ccccc2Cl)cc1 434889125 QLCHDIXHRKPONE-HSZRJFAPSA-N 392.886 5.108 30 20 GKED CC(C)(NCc1ccc(C#N)cc1OC(F)F)c1cccc(C(F)(F)F)c1 437149012 YNCYBCWWODPWIZ-UHFFFAOYSA-N 384.348 5.203 30 20 GKED CC(C)[C@@](C)(C#N)NC(=O)CNc1ccc([C@H](C)Sc2ccccc2)cc1 439550460 NHIHJCCLKAJOCL-HTAPYJJXSA-N 381.545 5.006 30 20 GKED Cc1cccc(C(NC(=O)N(C)Cc2cccc(C#N)c2)c2cccc(C)c2)c1 439630668 CZSIYMUGLBUBMB-UHFFFAOYSA-N 383.495 5.106 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2cccc(F)c2)c(OC(F)F)c1 447340259 JEOOXMLLYCSWKR-NRFANRHFSA-N 382.385 5.178 30 20 GKED N#CCc1ccc(NC(=O)NCC[C@H](c2ccccc2)C(F)(F)F)c(Cl)c1 455727678 GJCBSYYHASTIIG-OAHLLOKOSA-N 395.812 5.264 30 20 GKED CCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](C)c1cccc(C#N)c1 463072097 YOKLRQCOBQFXNB-ZDUSSCGKSA-N 376.378 5.108 30 20 GKED C[C@@H](C(=O)Nc1cccc(OCCCC#N)c1)c1ccc(Cl)c(Cl)c1 471342508 PVIDSMHQFZLTDS-CYBMUJFWSA-N 377.271 5.418 30 20 GKED CC(C)N(Cc1cccc(Br)c1)C(=O)C[C@@H](CC#N)c1ccccc1 475171454 DLYNROVTXFUAFR-LJQANCHMSA-N 399.332 5.274 30 20 GKED N#CC[C@H](CC(=O)Nc1ccccc1NC(=O)C[C@H]1C=CCC1)c1ccccc1 475760657 ORJATPITXOGVMZ-AZUAARDMSA-N 387.483 5.007 30 20 GKED CCOc1c(Cl)cc(NC(=O)C[C@H](CC#N)c2ccccc2)cc1Cl 476699899 PQJGKKGTTDVXMY-AWEZNQCLSA-N 377.271 5.418 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@@H]1CCN(c2cccc(Cl)c2)C1=O 476808952 UUJYEPYMFQWGNL-FQEVSTJZSA-N 396.918 5.184 30 20 GKED C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cccc(Oc2ccc(C#N)cc2)c1 477419616 BASKPSCQVAFSQI-AUUYWEPGSA-N 388.389 5.154 30 20 GKED COc1cccc(Oc2ncccc2CN[C@@H]2CCCCc3cc(C#N)ccc32)c1 481664171 XYDCKSLQCBITAY-XMMPIXPASA-N 399.494 5.311 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccc(NC(=O)c2ccco2)cc1 485734699 DIAZBSXZLZYUNE-UHFFFAOYSA-N 378.453 5.062 30 20 GKED C=C[C@H]1CCCCN1C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 488846510 TXPIRYBFEVUFKZ-KRWDZBQOSA-N 391.446 5.087 30 20 GKED COc1cc(C#N)cc(Cl)c1OCc1cc(-c2ccc(Cl)cc2)no1 492349168 FELHQWMKXAGVMZ-UHFFFAOYSA-N 375.211 5.108 30 20 GKED CC(C)(C)c1cnc(CSc2nc3c(c(-c4ccco4)c2C#N)CCC3)o1 497676442 MGUPZHPKFDYUSQ-UHFFFAOYSA-N 379.485 5.280 30 20 GKED C[C@@H](NC(=O)c1cccc(SCC#N)c1)[C@H](C)c1ccccc1C(F)(F)F 499456158 JCJOSPRWUMDCRX-UONOGXRCSA-N 392.446 5.243 30 20 GKED Cc1cccc(C2(C(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)CC2)c1 503161881 XOWCAFFFLXZOOM-UHFFFAOYSA-N 382.463 5.116 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)Nc2cc(C#N)ccc2OC(C)C)c1 505681866 AYBWAMKMHRIOEV-MRXNPFEDSA-N 381.476 5.015 30 20 GKED N#C[C@H](NC(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1)c1ccccc1F 505917166 NMUDDZIAMZHJFO-SFTDATJTSA-N 394.446 5.179 30 20 GKED N#C[C@@H](NC(=O)c1ccc(-c2cccc3cccnc23)cc1)c1ccc(F)cc1 505975278 CRJNYLYBDCPMOW-JOCHJYFZSA-N 381.410 5.036 30 20 GKED C=CCn1c(SC[C@@H]2CCCC(F)(F)C2)nnc1-c1ccccc1OC 509094217 BGCKKTWEYGTRRJ-CQSZACIVSA-N 379.476 5.057 30 20 GKED C[C@H](Sc1nc(-c2ccccc2)ccc1C#N)C(=O)Nc1c(F)cccc1F 510215049 ZHUVJZWWFBJCGI-ZDUSSCGKSA-N 395.434 5.018 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N(C)Cc1ccc(C#N)cc1 510533048 KMDQJDWGNVBPJE-CYBMUJFWSA-N 386.282 5.713 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 511125069 XGTCTPUWLHFOFA-UHFFFAOYSA-N 385.895 5.319 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3cccc(CC#N)c3)c2C#N)C1 514560586 UDLAEMXINNCWKB-MRXNPFEDSA-N 377.513 5.089 30 20 GKED COc1ccc2oc(C(=O)Nc3ccccc3SC[C@H](C)C#N)c(C)c2c1 519425986 BPMBZFSQCBPXMM-CYBMUJFWSA-N 380.469 5.254 30 20 GKED CC[C@H](C)c1ccc(NC(=O)CNc2ccccc2S[C@H](C)CC#N)cc1 520200677 NKOKZDFYHDNPOD-DLBZAZTESA-N 381.545 5.645 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c1 521261261 OUAPNLWSTOURCM-HSZRJFAPSA-N 389.499 5.882 30 20 GKED N#Cc1cccc(CSCc2nc(-c3ccc(C(F)(F)F)cc3)no2)c1 521540895 DZYDCNSJJCKICZ-UHFFFAOYSA-N 375.375 5.060 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)cc1 521752596 BIAIYOHRKLDDMF-BJKOFHAPSA-N 384.479 5.289 30 20 GKED CC(C)[C@@H](C)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524442101 QFOUUSXSAWZESN-OAHLLOKOSA-N 385.895 5.299 30 20 GKED C=C(C)Cn1c(S[C@@H](CC)c2ccc(F)cc2F)nnc1-c1ccncc1 532273450 SZBXMKBLPCVTGG-SFHVURJKSA-N 386.471 5.438 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1ccc(Br)cc1)c1ccccc1 533929147 ANQOHMDOANRNNS-OXQOHEQNSA-N 384.317 5.473 30 20 GKED N#CCc1ccc(C(=O)N2CCC(=Cc3cc(Cl)ccc3Cl)CC2)cc1 534713027 YQZWIPWPZXGSIR-UHFFFAOYSA-N 385.294 5.379 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)NCCCC#N 543326129 IEHMPYZXFZEOCS-UHFFFAOYSA-N 393.466 5.157 30 20 GKED Cc1cc(-c2nnc(CN[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)o2)c(C)o1 543876876 HVLHESQLDJOEOU-INIZCTEOSA-N 398.466 5.336 30 20 GKED CCCOc1ccc(Br)cc1-c1noc(C2(C#N)CCCCC2)n1 547057691 CHSBSTDGJFWBOC-UHFFFAOYSA-N 390.281 5.013 30 20 GKED Cc1ccccc1C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)C1CC1 551778596 DPWXTMHCLGYTKY-HSZRJFAPSA-N 387.527 5.011 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3CC(C4CCC4)C3)cc2Cl)c1 554188527 CZBPULQGFRPOKA-UHFFFAOYSA-N 395.890 5.054 30 20 GKED CC(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cs1 555460430 QGXKWKYCDPQXPE-UHFFFAOYSA-N 376.437 5.175 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)c1C#N 560002419 VRJKPJWWNZBMEI-UHFFFAOYSA-N 378.453 5.206 30 20 GKED N#CCCN(C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccc(F)cc1 561918784 VTSJHEKMVLKEMJ-HOTGVXAUSA-N 377.246 5.183 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2OC(C)(C)C1 588996106 VHEZCCBKQJCKRT-MRXNPFEDSA-N 395.528 5.143 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](C)C1CCC(F)(F)CC1 594069612 FSGKRTWWSNQSHO-KBPBESRZSA-N 381.492 5.274 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)CCCc3nc4ccccc4s3)c2C#N)C1 602755066 SWULWQMLTFNKLX-ZDUSSCGKSA-N 395.553 5.316 30 20 GKED CC[C@H](c1ccc(F)cc1F)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 606431681 LLBLSKOGOBIUCN-GPCCPHFNSA-N 375.303 5.479 30 20 GKED CC(C)c1ccccc1NC(=O)CNc1cccc(Oc2ccc(C#N)cc2)c1 609221240 NIRBOQHWCGBVNZ-UHFFFAOYSA-N 385.467 5.525 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)cc1 609499106 QCNKYXOTGBFJMB-UHFFFAOYSA-N 395.462 5.598 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1ccsc1 609967718 AQLHKULGBLCSHS-INIZCTEOSA-N 378.472 5.404 30 20 GKED CC[C@H](NCc1cccc(OCc2cccc(C#N)c2)c1)c1cc(F)ccc1F 610137626 QLNUCIIILXTAQI-DEOSSOPVSA-N 392.449 5.656 30 20 GKED Cc1[nH]c2ccc(C(=O)[C@@H](C#N)c3nc4cc(Cl)ccc4s3)cc2c1C 613403900 XGLOKAXAWUUYSA-OAHLLOKOSA-N 379.872 5.538 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)[C@H]1C[C@@]1(F)c1ccccc1 619130092 XPECDNAKJLCIJM-UKRRQHHQSA-N 385.323 5.041 30 20 GKED C=C(CNC(=O)C(C)(C)c1csc(-c2ccccc2F)n1)c1ccccc1 646293675 MMPGRKNWVQKRDL-UHFFFAOYSA-N 380.488 5.056 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccc(F)cc2C(F)(F)F)cc1OC 728006874 USHKDJDSTPGZEK-WEVVVXLNSA-N 395.352 5.070 30 20 GKED C=C(Br)CNC(=O)Nc1ccc(O[C@@H](C)c2ccccc2)cc1C 728127280 YDBMNMNPXSMFFD-HNNXBMFYSA-N 389.293 5.165 30 20 GKED C#Cc1ccc(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)nc1 728819631 BCAGZZJZMNQODI-GFCCVEGCSA-N 378.419 5.225 30 20 GKED CC(C)(C)n1cc(C=NNc2cccc(C#N)c2)c(-c2ccccc2Cl)n1 731151672 OPELGZKEFZWGEX-UHFFFAOYSA-N 377.879 5.276 30 20 GKED N#C[C@@H](C(=O)C[C@@H]1CCc2ccccc2C1)c1nc2cc(Cl)ccc2s1 732595996 GQTQPAAHJRJOFZ-DYVFJYSZSA-N 380.900 5.321 30 20 GKED C=CC[C@@H](NC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccncc1 734654765 YESCWNVWYUHJNA-YADHBBJMSA-N 391.902 5.441 30 20 GKED Cc1ccc([C@H](C)CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 738894480 FXMBRLXLPWOONM-NTKDMRAZSA-N 383.495 5.576 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=S)Nc3ccc(Cl)cc3)c2)s1 739437874 QEKOPBTWWBWARK-UHFFFAOYSA-N 383.929 5.427 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3c(Cl)nc4sccn34)s2)cc1 741847734 KULNQLOUMUTETC-SREVYHEPSA-N 385.901 5.377 30 20 GKED C[C@H](C#N)Oc1ccc(/C=C2/C(=O)c3cccc(Br)c3[C@@H]2C)cc1 742435509 UTDXQWTTYQBMQV-HSFOFRNISA-N 382.257 5.123 30 20 GKED O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1ccc2c(c1)COC2 742438026 ZAZJCTSWBYWLJN-QPJJXVBHSA-N 395.798 5.435 30 20 GKED CCC(=NNc1ncnc2scc(-c3ccc(F)cc3)c12)C1CCOCC1 745199612 WEYIXVTZHICFBG-UHFFFAOYSA-N 384.480 5.102 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(Cl)c(C(F)(F)F)c2)cnn1-c1ccccn1 748441122 IQPQEFPGHWFLAX-VURMDHGXSA-N 391.780 5.144 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2cnc(-c3cccs3)s2)cc1 751515418 ZKHODQGVZASADZ-MDZDMXLPSA-N 397.525 5.298 30 20 GKED Cc1nccn1-c1ccc(C(=O)/C=C\c2csc(-c3ccsc3)n2)cc1 751517827 OFXGZPPKGAEXGS-DAXSKMNVSA-N 377.494 5.262 30 20 GKED C[C@@H](CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccc(F)cc1F 752475955 HJNMFKKTQOQRTH-GUYCJALGSA-N 382.435 5.458 30 20 GKED N#Cc1c(NC(=O)/C=C\c2ccnc(Cl)c2)sc2c1-c1ccccc1CC2 757934261 WSWPLPAAJYQJEE-YVMONPNESA-N 391.883 5.086 30 20 GKED O=C(/C=C/c1csc(-c2ccsc2)n1)c1ccc(Br)cc1F 767739575 YOUIPXKDMDZNCE-DUXPYHPUSA-N 394.290 5.669 30 20 GKED O=C(/C(=C/c1cccc2nccn12)c1nc2ccccc2s1)c1ccccc1 769601069 BIONIEHQQSSHFI-SDXDJHTJSA-N 381.460 5.368 30 20 GKED Cc1sc(CNc2snc(Cl)c2C#N)nc1-c1ccc(Cl)cc1 771130710 KGUPICOCOUNHII-UHFFFAOYSA-N 381.313 5.366 30 20 GKED CC(C)(C)Sc1cc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)ccn1 779207240 ZHQFFZIWBYQKQC-ZDUSSCGKSA-N 385.489 5.211 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3O[C@@H](C)C#N)c(F)c2)cc1C 780164188 NONQIVCRQMOKIM-KRWDZBQOSA-N 388.442 5.653 30 20 GKED N#Cc1cc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)ccc1Cl 787094016 QRWGOBYSOQPWTJ-UHFFFAOYSA-N 384.826 5.074 30 20 GKED COc1ccccc1-c1ncc(/C=C2/CCc3c(sc4ccccc34)C2=O)cn1 792886241 SVFLLTYTSXFPCZ-VBKFSLOCSA-N 398.487 5.579 30 20 GKED Cc1c(C(=O)Nc2ccc(OCc3cccnc3)cc2)sc2ccc(C#N)cc12 794288711 OJOHZVUJFVPODF-UHFFFAOYSA-N 399.475 5.308 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)[C@H]3CC[C@@H](C(F)(F)F)C3)cc2)cc1 797097652 ACMAEKIVEVXJEK-LSDHHAIUSA-N 375.346 5.235 30 20 GKED O=C(/C=C\c1cnc(-c2ccncc2)s1)c1csc(-c2ccccc2F)n1 812245465 UPBNDIMSAGJEPG-WAYWQWQTSA-N 393.468 5.364 30 20 GKED C=CCN(CCC#N)C(=O)c1ccccc1Nc1ccc(SC(F)F)cc1 816802897 CMUUTUYJBQGFIK-UHFFFAOYSA-N 387.455 5.287 30 20 GKED CC1(C#N)CCC(N[C@@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)CC1 824423660 TZCSMHBRBAORKS-KQVJYAISSA-N 385.552 5.095 30 20 GKED CCCCOc1ccc(C=NOCc2cc(-c3cccs3)on2)cc1OC 836562540 JEIWOECSFGPSIN-UHFFFAOYSA-N 386.473 5.141 30 20 GKED Cc1ccc(NC(=O)OC(C)(C)C)cc1NC(=O)C(C)(C)c1ccc(C#N)cc1 860397993 PXUODKBVAKTMFL-UHFFFAOYSA-N 393.487 5.130 30 20 GKED Cc1occ(C(F)(F)F)c1C(=O)N[C@@H](CC(F)(F)F)c1ccc(F)cc1 875519753 LKRGDESDODHJNW-LBPRGKRZSA-N 383.263 5.169 30 20 GKED C=CCOc1ccc(/C=C\C(=O)N(C)[C@@H](C)c2cccc(Cl)c2)cc1OC 914490260 HRJRZOFFWLZWTF-DMIOIOJGSA-N 385.891 5.146 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 915085539 CFCQIGXNRFXUMQ-HXUWFJFHSA-N 388.492 5.314 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1 915747261 YFSMUJKFXQUJGW-ZRFOIIEFSA-N 378.884 5.192 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(C#N)cc2)ccc1OCc1ccc(F)cc1 916135409 ZLPVTRMJKSDRCH-SDQBBNPISA-N 387.410 5.181 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc2ccccc12)c1ccc2ccccc2n1 916848924 KSRSBUKQAAGHCO-NRFANRHFSA-N 380.447 5.423 30 20 GKED CCCCc1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(SC(C)C)cc2)cc1 916915141 DXVIZADOOQCUNE-NRFANRHFSA-N 394.540 5.491 30 20 GKED CC[C@@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2cc(Cl)cc(Cl)c2)cc1 916947380 ISXJEFMPGBVVMX-KZULUSFZSA-N 389.282 5.468 30 20 GKED CC(C)(C)c1ccc(OCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 917044178 QYOFYKBNRBZDOZ-MRXNPFEDSA-N 398.915 5.502 30 20 GKED COc1cccc(-c2n[nH]cc2/C=C\C(=O)c2sc(C(C)(C)C)nc2C)c1 918713790 VQOYHWSEGURNCC-KTKRTIGZSA-N 381.501 5.044 30 20 GKED CC(=NNc1cccc(C(F)(F)F)c1)c1cnn(-c2ccc(F)cc2)c1C 920986160 CEDOUUMPLXJPFO-UHFFFAOYSA-N 376.357 5.175 30 20 GKED C=CCn1c2ccccc2n2nc(C)c(C(=O)/C=C\c3ccc(O)c(Cl)c3)c12 921266341 XQDKEJLNPMUJKO-LUAWRHEFSA-N 391.858 5.039 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Br)cs2)cc1 921280391 HRSZUUBBPRFZAS-QGZVFWFLSA-N 397.297 5.418 30 20 GKED O=C(O)c1cccc(NN=C(CCc2ccccc2Cl)c2ccccc2)c1 1776036898 NQRZEMNRVDNWPZ-UHFFFAOYSA-N 378.859 5.487 30 20 GKED CC(C)(C)c1nc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cs1 1776280419 HNIRRPSXCYHDHJ-CLFYSBASSA-N 397.521 5.763 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2cc3c(ccc4ccccc43)o2)cc1)C(=O)O 1776469808 NVGQIVPLCHOTHQ-INDWDQIESA-N 386.403 5.334 30 20 GKED Cc1cccc2c1CC/C(=C\c1ccc(-c3cccc(CC(=O)O)c3)cc1)C2=O 1777457168 AGCONCXAWUARCZ-HYARGMPZSA-N 382.459 5.502 30 20 GKED O=C(O)c1cccc(C(=O)/C=C/c2cc(F)ccc2Oc2cc(F)cc(F)c2)c1 1777685007 UASKHJLVUYIQGI-GQCTYLIASA-N 398.336 5.491 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)c4ccccc4Cl)cc3)CCC2)C1 1790222607 JSCUNFOBJXXHAQ-UHFFFAOYSA-N 394.902 5.054 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 41534248 GZZBQAMPEIJHOP-LJQANCHMSA-N 388.492 5.266 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCC(=O)N[C@H](C)c1ccc(Cl)cc1 66861309 UEORUROEWRKRHQ-LSDHHAIUSA-N 387.936 5.024 30 20 GKED N#CCCSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 78668929 MYHITVHQZPYZRC-CVEARBPZSA-N 390.430 5.453 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 108324453 SOUHRIHHPCOHQX-INIZCTEOSA-N 380.513 5.157 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1 108502174 MGLVSVIOGQIQRS-QFIPXVFZSA-N 386.499 5.728 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc(NC(=O)C(C)C)c1 154597198 KBIDTTBPYYQGSU-UHFFFAOYSA-N 391.924 5.216 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)[C@H](C#N)c1nc2ccccc2n1C(F)F 174001667 LGYAUKTWGSSFCR-ZFWWWQNUSA-N 385.389 5.016 30 20 GKED Cc1ccc(NCc2ccc(-c3ccccc3C#N)cc2)cc1N1CCOC1=O 174909235 GPYBDYXCDHTNIW-UHFFFAOYSA-N 383.451 5.102 30 20 GKED C=C(C)[C@H](NC(=O)N[C@H](c1ccccc1)c1ccncc1)c1ccc(F)c(F)c1 185464541 BFVUECLIAMONGQ-FCHUYYIVSA-N 393.437 5.066 30 20 GKED C=CCC[C@@H](C(=O)Nc1cccc(NC(=O)c2ccncc2)c1)c1ccccc1 186613194 AHHWSHVPPCUVAQ-JOCHJYFZSA-N 385.467 5.022 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccc(Cl)cc1F 188912035 XCHGVZSTMODWIF-LBPRGKRZSA-N 377.872 5.053 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CCc1nc(C)c(-c2ccccc2)o1 189889316 LMIJLIOJLXARCG-UHFFFAOYSA-N 388.511 6.073 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(SCc2csc(C)n2)cc1 189937096 ORGFJWRCSFSHSB-UHFFFAOYSA-N 387.574 5.288 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](C)[C@@H]1CCCN(C2CCC2)C1 191435257 JLYZTIDYVIDVLM-AZUAARDMSA-N 383.580 5.313 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1c(F)cccc1F)c1nc(-c2ccccc2)cs1 247573413 XAUKESHGPCRIHK-QLFBSQMISA-N 380.419 5.068 30 20 GKED COc1cc([C@@H](C)NCCCCC(C)(C)C#N)ccc1OCc1ccncc1 278807547 OYAUPKKFXDJSLD-GOSISDBHSA-N 381.520 5.040 30 20 GKED N#Cc1c(NC(=O)c2scnc2C(F)(F)F)sc2c1CCCCCC2 298652096 WOFJFTGSMVJPRN-UHFFFAOYSA-N 385.436 5.006 30 20 GKED C[C@H]1Cc2c(sc(NC(=O)c3cnc(-c4ccncc4)s3)c2C#N)[C@H](C)C1 410977783 KWBMPDMFRBTMAX-VXGBXAGGSA-N 394.525 5.076 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)N(C)Cc2cccc(C#N)c2)c1C 428768785 VXMFOJPNQULTID-UHFFFAOYSA-N 379.504 5.236 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)[C@H]1c1cccnc1 432771817 ZSFOIHJLEVDHEH-QFIPXVFZSA-N 398.466 5.361 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1CC(F)(F)F)c1ccccc1 432972348 LQDZEPLLZCIIIA-QGZVFWFLSA-N 375.394 5.348 30 20 GKED Cc1cccc([C@H]2CCCCCN2Cc2cn(CCC#N)nc2-c2ccncc2)c1 435125957 IDVAQFBKJCKSRB-XMMPIXPASA-N 399.542 5.285 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(C)CCc1cccs1 437853323 WQJROQSATAIHLA-UHFFFAOYSA-N 391.496 5.427 30 20 GKED C[C@H]1C[C@H](c2ccccc2F)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438638112 QPZZMCLUPFACSP-KPZWWZAWSA-N 391.368 5.331 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(COC2CCCCC2)c1)c1ccccc1 439367502 FYTCGUKMLFCBPO-QHCPKHFHSA-N 391.515 5.702 30 20 GKED Cc1ccc(OCc2ccccc2)c(NC(=O)N(CCC#N)Cc2ccco2)c1 442497679 RXCLJQLEPUEGHV-UHFFFAOYSA-N 389.455 5.115 30 20 GKED Cc1ccc(C)c(OC2CCN(C(=O)Nc3ccc(CC#N)cc3Cl)CC2)c1 455706802 QSPSKMDLOQNWFX-UHFFFAOYSA-N 397.906 5.098 30 20 GKED Cc1sc(NC(=O)c2sc3ccccc3c2Br)c(C#N)c1C 463070963 PQMXHEUCFDOXDN-UHFFFAOYSA-N 391.315 5.466 30 20 GKED CN(Cc1ccc(-c2ccccc2C#N)cc1)Cc1nccn1Cc1ccccc1 464731978 HTRZYZAQWGFXCQ-UHFFFAOYSA-N 392.506 5.102 30 20 GKED CCCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(C#N)cc1)C1CC1 471867377 AAWZQDUSBJESHR-UHFFFAOYSA-N 375.516 5.831 30 20 GKED O=C(Cc1cccc(F)c1)N[C@@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 474261006 WMPLVAPQTSUCLP-HNNXBMFYSA-N 393.302 5.197 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1cc(F)cc(Cl)c1O 474441130 YCILXAVDEKHWMY-UHFFFAOYSA-N 398.846 5.460 30 20 GKED Cc1nc(-c2ccc([C@@H](C)NC(=O)C[C@H](CC#N)c3ccccc3)cc2)cs1 474701858 OMIIUBFKDDPOKY-IERDGZPVSA-N 389.524 5.383 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccccc1)C(F)(F)F 475551039 PLXPSCCMBFUHAN-IBGZPJMESA-N 390.449 6.006 30 20 GKED C=CCCC1(C(=O)NCc2csc(-c3ccc(C(F)(F)F)cc3)n2)CC1 476219008 LGTXKJPZKIZBSJ-UHFFFAOYSA-N 380.435 5.192 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1)c1ccccc1 476318120 HGGPXWOGIMJVET-JPYJTQIMSA-N 389.886 5.028 30 20 GKED Cc1csc(Nc2ccc(C(=O)Nc3cc(C#N)ccc3OC(C)C)cc2)n1 485914829 OBUPFMYHRBRJRT-UHFFFAOYSA-N 392.484 5.106 30 20 GKED COc1ccc2sc(C(=O)N[C@@H](CCCC#N)c3ccccc3)c(C)c2c1 487371666 LTXUQDFVWFYQJL-IBGZPJMESA-N 378.497 5.383 30 20 GKED CC(C)C[C@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 487376846 LJPMWWKFYKRBOB-RXVVDRJESA-N 395.572 5.396 30 20 GKED N#CCCC[C@H](NC(=O)CCc1cc(Cl)cc(Cl)c1)c1ccccc1 487536188 LPDAPBXKOYKPKT-IBGZPJMESA-N 375.299 5.477 30 20 GKED Cc1c(C#N)c(NC(=O)CSc2ccc(C#N)cc2)n(C2CCCCC2)c1C 488854425 NJPNHXRVWOIIKF-UHFFFAOYSA-N 392.528 5.084 30 20 GKED Cc1cc(N2CCCC[C@H]2C)ccc1NCc1cn(C)nc1-c1ccc(C#N)cc1 491034785 UBQQYXMRWWEGHQ-LJQANCHMSA-N 399.542 5.258 30 20 GKED CC(C)[C@H](c1ccccc1)N(C)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 495165736 KYOPYNAIPZVQCA-HSZRJFAPSA-N 388.467 5.200 30 20 GKED Cc1ccccc1[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 508276143 SAPBJWDHLJFJAS-HXUWFJFHSA-N 397.478 5.680 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)N(Cc1ccc(C#N)cc1)CC(C)C 510427171 HYZFBJBZQGTOTJ-JOCHJYFZSA-N 393.531 5.276 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@H]2CCc3cc(F)ccc32)cc1 510703848 QZRFPSCUBKOVLF-NRFANRHFSA-N 387.414 5.299 30 20 GKED CN(CCC(F)(F)F)C(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1 511366412 JCQYWZAZUCQXPY-UHFFFAOYSA-N 393.302 5.536 30 20 GKED N#Cc1ccc(CCC(=O)N[C@@H](c2cccc3ccccc23)C(F)(F)F)cc1 511719539 NLEOBLQDFBDOTP-NRFANRHFSA-N 382.385 5.064 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@@]4(CC=CCC4)C3)cc2)cc1 512524686 VOWXIIOWPZEKDK-DEOSSOPVSA-N 387.483 5.705 30 20 GKED N#Cc1cc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)ccc1Cl 512976822 ASBPJFOCHAOYPY-UHFFFAOYSA-N 394.308 5.231 30 20 GKED N#C[C@@H](C(=O)c1csc(-c2ccc(F)cc2)n1)c1nc2ccccc2s1 513681409 BNRVVCJONDBFLD-ZDUSSCGKSA-N 379.441 5.049 30 20 GKED Cc1ccc(C[C@H](C)NC(=O)Nc2ccccc2SC[C@H](C)C#N)c(C)c1 518719443 XZGXCYNALMOGGX-AEFFLSMTSA-N 381.545 5.308 30 20 GKED CCc1ccccc1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)cc1 519065479 OSYBAXQADRJWIP-KRWDZBQOSA-N 385.467 5.352 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)c1cc(Br)cc2ccccc12 520705190 MTMZZVDVCKATSA-UHFFFAOYSA-N 395.256 5.125 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(c2ccccc2)CCC1 521258891 FVDVJZUSDZJFNL-QGZVFWFLSA-N 379.529 5.182 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Nc1cc(Cl)ccc1Cl 521797145 BKWDRJLHTMGGKL-NSHDSACASA-N 380.300 6.032 30 20 GKED C[C@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)c1c(Cl)cccc1Cl 523820653 WLMPBIGHVUZRGB-OLZOCXBDSA-N 376.287 5.029 30 20 GKED CC(C)(C)[C@@H]1CCCN(C(=O)c2ccc(COc3ccc(C#N)cc3)o2)CC1 523822131 HWGUKEDDKWVUOX-GOSISDBHSA-N 380.488 5.019 30 20 GKED Cc1cc(NC(=O)c2ccc(COc3ccccc3C#N)o2)ccc1OC(C)C 525080031 OECPKBJMRUYKCE-UHFFFAOYSA-N 390.439 5.078 30 20 GKED C[C@H](NCc1ccc(C#N)cc1Cl)c1ccc(OCc2cccnc2)cc1 525885972 XNZSDBLYSSYGRZ-INIZCTEOSA-N 377.875 5.036 30 20 GKED N#CCCCOc1cccc(NC(=O)CCn2ccc3cc(Cl)ccc32)c1 534065021 ONTHXXIJOKIRPU-UHFFFAOYSA-N 381.863 5.006 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H]1c1cccc(Br)c1)c1ccccc1 535354186 JEAYFTCMUHCJOO-OXQOHEQNSA-N 384.317 5.473 30 20 GKED CC(C)C[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)CCO1 537511926 DPRLWWFGLAITBF-KNQAVFIVSA-N 393.487 5.066 30 20 GKED COc1ccc([C@H](N[C@@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)cc1 538406507 ILJBETXBBASJOV-HJPURHCSSA-N 376.887 5.660 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3ccc(C#N)c(F)c3)s2)cc1 538509240 JAFDNBYIESGXJS-HUUCEWRRSA-N 379.504 5.850 30 20 GKED C[C@@H](NCc1ccc(Br)cn1)c1ccc(-c2cccc(C#N)c2)cc1 541088939 HHJKSSDCRAIRIT-OAHLLOKOSA-N 392.300 5.234 30 20 GKED CCC(=O)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 542131201 RNZWCSTUROIRNE-CQSZACIVSA-N 396.418 5.171 30 20 GKED C=CCC[C@H](NC(=O)Cc1ccc2c(c1)COC2)c1ccc(C(F)(F)F)cc1 543457053 IRTCXPZXOMHBPA-FQEVSTJZSA-N 389.417 5.102 30 20 GKED Cc1nc(Cc2ccccc2)sc1[C@H](C)N[C@H](CCCC#N)c1ccccc1 551204928 HLOOHOLDJKFCMB-PGRDOPGGSA-N 389.568 6.128 30 20 GKED N#CCCC[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1 552082956 LBMUNMFVKFZSKY-HXUWFJFHSA-N 392.484 5.243 30 20 GKED CC(C)Oc1cccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 559147050 LHJOVSDUKGVGDW-HNNXBMFYSA-N 397.887 5.136 30 20 GKED CCC1(CC)CCN(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1 574490328 OGMONOMGSWVPNA-UHFFFAOYSA-N 378.476 5.180 30 20 GKED N#CC[C@@H]1CCCN(C(=O)N[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)C1 596534726 QLHQEFJIHMDMBX-SJCJKPOMSA-N 399.844 5.145 30 20 GKED C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)CC1CCC(F)(F)CC1 600038102 NTOGUFFNOATYAN-CYBMUJFWSA-N 388.380 5.162 30 20 GKED CC(C)N(Cc1ccccc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 608784983 NCOFRYJROVYWLH-UHFFFAOYSA-N 386.455 5.188 30 20 GKED Cc1cccc(NC(=O)Nc2cccc(CNc3ncc(C#N)cc3Cl)c2)c1 608886081 SEUUXBPQBOVBEJ-UHFFFAOYSA-N 391.862 5.171 30 20 GKED CC(C)N(Cc1cccc(Cl)c1)C(=O)Nc1cc(C#N)ccc1OC(F)F 609083255 DQKBZONPSYTBBU-UHFFFAOYSA-N 393.821 5.256 30 20 GKED COCc1ccc(C(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)cc1 609484023 BKURLSYDQVQSSN-UHFFFAOYSA-N 390.870 5.205 30 20 GKED CS[C@@H]1CCC[C@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)C1 609773533 JPVOVJRNSPEKKI-FXAWDEMLSA-N 395.528 5.455 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(N2CCC(C)CC2)c1 610096469 AQXVUPMUTLTRNO-UHFFFAOYSA-N 388.515 5.015 30 20 GKED CCCCN(CC(=O)Nc1ccccc1SCC#N)[C@H](C)c1ccc(C)o1 610390281 VDISVFKOYKHYAI-QGZVFWFLSA-N 385.533 5.006 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)CCCCCC2)c1nc2ccccc2n1C(F)F 613401898 RFEUMAGLARHOAF-CQSZACIVSA-N 399.466 5.642 30 20 GKED N#C[C@@H](C(=O)c1cc(Cl)cc(Cl)c1)c1nc2cc(Cl)ccc2s1 613402919 KIXLQCFDLXJLHB-LBPRGKRZSA-N 381.671 5.747 30 20 GKED N#CC[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1Br)c1ccccc1 619439292 VYACEKZBXZMNDN-PXNSSMCTSA-N 397.316 5.200 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n([C@@H]2CCCOC2)c1C 626633946 QUADZCYGCIXJGK-HXUWFJFHSA-N 380.532 5.561 30 20 GKED O=C(NCc1c(F)c(F)cc(F)c1F)Nc1cccc(CCC(F)(F)F)c1 674697438 QMNPGDSXOVQALZ-UHFFFAOYSA-N 394.290 5.060 30 20 GKED Cc1scc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1C 678642559 YUSROSZJNGLJCU-LLVKDONJSA-N 380.416 5.484 30 20 GKED COCc1ccsc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 679367963 CAMKMNVGUBJKPK-LLVKDONJSA-N 396.415 5.013 30 20 GKED C#Cc1cccc(NC(=S)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1 726470578 YAYFSGOCJYLDSR-UHFFFAOYSA-N 397.503 5.122 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2ccc(Br)s2)c1 726740226 YNVWNXGETUGOER-SREVYHEPSA-N 376.275 5.089 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\CCc3sccc3C2=O)cs1 726894320 XYOXXNZPFWTOQE-JLHYYAGUSA-N 398.484 5.241 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccccc3F)nc2C)cc1[N+](=O)[O-] 730150264 QMJFIXLKIGZYBH-VQHVLOKHSA-N 398.415 5.071 30 20 GKED C#CCOc1cccc(NC(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)c1 731111046 NLANAFKQEKQTND-GOSISDBHSA-N 390.508 5.555 30 20 GKED C#CCOc1cccc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1 731112278 DVRCDAHJWMEOFE-IBGZPJMESA-N 388.389 5.086 30 20 GKED CCOC(=O)Nc1ccc(NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 733633344 DLZQZKACBXGIGT-AWEZNQCLSA-N 398.488 5.151 30 20 GKED COC(=O)[C@H](Nc1ccc(Oc2ccccc2Cl)cc1)c1ccc(C#N)cc1 739992148 WDSKDPWZSFGEQT-OAQYLSRUSA-N 392.842 5.330 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccccc2-c2ccc(Cl)cc2)cc1 740014248 OVYWKMBHIQLJDC-ROUUACIJSA-N 390.914 6.149 30 20 GKED Cc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 743036670 OHUMUNCZKJUBAU-UHFFFAOYSA-N 377.444 5.607 30 20 GKED O=C(/C=C\c1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1F 743056830 MUMCSHXYNNEMEI-NKPXIPJASA-N 378.802 5.072 30 20 GKED Fc1ccc(C=NOCc2csc(-c3ccc(C(F)(F)F)cc3)n2)cc1 744180646 XCRKUGJYGYRHCP-UHFFFAOYSA-N 380.366 5.519 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccncc1)c1cc(F)ccc1F 747150563 QCTLCUGMITVQTE-RMKNXTFCSA-N 387.389 5.109 30 20 GKED C[C@H]1/C(=C\c2cnc(-c3ccncc3)s2)C(=O)c2cccc(Br)c21 753144948 RRZRHTZDRQLYIG-ZRRZQRFHSA-N 397.297 5.351 30 20 GKED CC(C)c1nn(Cc2ccccc2)c(Cl)c1C=NNc1ccc(C#N)cc1 754706274 GZGLUHKERNZMJI-UHFFFAOYSA-N 377.879 5.026 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)ON=Cc3ccccc3C(F)(F)F)o2)cc1C 758410438 KFUJFRJPDFBBGC-CQSZACIVSA-N 389.377 5.484 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCC#N)[C@H](C)c1ccccc1C(F)(F)F 766531519 QKOVUZWSFMRVIH-UONOGXRCSA-N 392.446 5.243 30 20 GKED C#CCCCCC(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cn2)c(F)c1 773303636 OZFMSDXKQCPZEA-UHFFFAOYSA-N 380.341 5.164 30 20 GKED CC(=O)CCCCCCC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1 774016826 KQWFSCIHUBKRAD-AWEZNQCLSA-N 390.455 5.194 30 20 GKED C[C@@H](Nc1ccc(N2CCC(O)CC2)c(C#N)c1)c1ccc(-c2ccccc2)cc1 777114697 LURTYZJQPLOPEC-LJQANCHMSA-N 397.522 5.359 30 20 GKED Cc1cc(CNC(=O)Nc2ccccc2O[C@@H](C)C#N)ccc1-c1ccccc1 779449024 HNZISETZXKQQLR-SFHVURJKSA-N 385.467 5.275 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(-c2ccccc2)cc1F 780479745 MBZMHUSOPXUBGO-HNNXBMFYSA-N 375.403 5.428 30 20 GKED C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCCCC(C)(C)C#N 784042039 WPHFEBANAKENHK-ZDUSSCGKSA-N 376.909 5.242 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 796610350 XNQVEYQHFFXWJU-UHFFFAOYSA-N 397.862 5.106 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc2ccc(Cl)nc2s1 798131028 NCICQOHUUSRWFM-UHFFFAOYSA-N 390.855 5.136 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)c2ccccc2Br)n1 798838915 UHMLHKBPBHUOEW-GFCCVEGCSA-N 391.334 5.183 30 20 GKED N#Cc1sc(N2CCC(F)(c3ccccc3C(F)(F)F)CC2)nc1Cl 804683495 MNMPVLSWNTYYQD-UHFFFAOYSA-N 389.805 5.152 30 20 GKED COc1cc(CNC(=S)Nc2c(C(C)C)cccc2C(C)C)ccc1C#N 811710649 QGCNGTAMHYYQOT-UHFFFAOYSA-N 381.545 5.300 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(Br)c1 813057705 PYSAYBZVNJHEMA-BXUZGUMPSA-N 385.286 5.039 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1cccc(Br)c1 813057706 PYSAYBZVNJHEMA-FZMZJTMJSA-N 385.286 5.039 30 20 GKED Cc1ncoc1-c1noc(-c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 820926439 APSODTCEEFJQRM-UHFFFAOYSA-N 378.775 5.017 30 20 GKED COc1ccccc1-c1ccnc(C2CCN(CCCCC(C)(C)C#N)CC2)n1 854095619 BTKXGQYDAWVHHX-UHFFFAOYSA-N 392.547 5.052 30 20 GKED C[C@@H](N[C@H](C)c1cc(F)c(Br)cc1F)c1ccc(OCC#N)cc1 858376945 SYJVRSHPEIOENW-VXGBXAGGSA-N 395.247 5.041 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc(F)cc2F)cc1 915124817 YMUPHWICRIPFEB-SFHVURJKSA-N 379.435 5.429 30 20 GKED C[C@@H]1CCCC[C@H]1OCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915359108 MUUYEQGFDQBHGV-SXSPYAJSSA-N 391.515 5.059 30 20 GKED COc1ccc2oc(C)c(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)c2c1 916156120 GZZJCVOWERORKT-QFIPXVFZSA-N 396.446 5.658 30 20 GKED C[C@@H](NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)c1c(F)cccc1F 916708041 GYMMQNUUGWSGFA-DNVCBOLYSA-N 391.421 5.503 30 20 GKED Cc1cccc(C)c1OCCC(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 917046797 MRUNLJASUBUMNO-OAHLLOKOSA-N 384.888 5.212 30 20 GKED CC(=O)Nc1ccc(/C=C/C(=O)c2ccc(Oc3ccccc3)c(F)c2)cc1 917145124 RSFQBNOOIOPDNY-UKTHLTGXSA-N 375.399 5.473 30 20 GKED Cc1cc(Cl)ccc1S(=O)(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 917738290 ZXYQJFKLXOZYAZ-HXUWFJFHSA-N 396.899 5.105 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccc(Cl)cc3)s2)ccc1Cl 1776033393 ZPLNHTANRTYPMY-UHFFFAOYSA-N 391.279 5.866 30 20 GKED CC(C)c1nn(C(C)(C)C)cc1/C=C1/CCCc2cc(C(=O)O)ccc2C1=O 1776385495 ZKCPTNXMXYWRBE-VBKFSLOCSA-N 380.488 5.062 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2Cl)c1)C(=O)O 1776470699 CVKGEHHWGLUIFS-OFSNVTPPSA-N 398.764 5.107 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(-c2ccccc2C)ccc1OC 1776783767 JOTBXGJDVAIDKL-JOCHJYFZSA-N 397.559 5.964 30 20 GKED COc1ccc(/C=C/C(=O)c2sc(-c3ccc(C)cc3)nc2C)cc1C(=O)O 1777361542 LMEJONFWVNLIEU-UXBLZVDNSA-N 393.464 5.030 30 20 GKED N#C[C@H](C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1nc2ccccc2s1 41499649 KSWIIYHUSTVVKC-GOSISDBHSA-N 397.459 5.039 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 63388611 AJAWKOHXEUDWRN-UHFFFAOYSA-N 383.451 5.571 30 20 GKED C=CCn1c(SCc2ccccc2Oc2cccnc2)nnc1-c1ccco1 63437015 CXTVXUOMKWNRQI-UHFFFAOYSA-N 390.468 5.204 30 20 GKED COc1cc(/C=C\c2nc3cc(-c4ccccc4)ccc3o2)ccc1OCC#N 96767132 WPHRHHVBORVYQR-WQLSENKSSA-N 382.419 5.576 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)COC2CCCCC2)cc1Cl 107875707 TXYQWFOOJGAXOT-FQEVSTJZSA-N 382.891 5.283 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H](c1ccccc1)C1CCC1 108372884 AVSFOSBEAIQJSG-UZUQRXQVSA-N 393.556 5.008 30 20 GKED Cc1ccc(C(=O)N[C@@H](CCC#N)c2ccccc2)cc1NC(=O)c1ccccc1 153471834 MGSRYUKAWJHANX-QFIPXVFZSA-N 397.478 5.022 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F 177061038 PIAGYYVCQAXXSA-UHFFFAOYSA-N 391.846 5.152 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)c3cccc(C#N)c3)s2)cc1 178178891 NTTADFPSFQUSQU-HUUCEWRRSA-N 377.513 5.411 30 20 GKED CC[C@H](CSC)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 181183336 VGJZKQSNXIPINQ-QGZVFWFLSA-N 383.517 5.264 30 20 GKED Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N(CCC#N)CC(C)(C)C 181413699 XVPDURKSBCWTGP-UHFFFAOYSA-N 393.409 5.071 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)c1ccc(OCC#N)cc1 181463371 WXENJGWRRIORKD-HXUWFJFHSA-N 399.538 5.168 30 20 GKED C=C(C)[C@H](NC(=O)Nc1ccc(-c2nnc(CC)o2)cc1)c1ccc(F)c(F)c1 187414865 CMXFGRKVGJFKCS-IBGZPJMESA-N 398.413 5.016 30 20 GKED C[C@H](Oc1ccc(C(=O)Nc2ccccc2O[C@H](C)C#N)cc1)c1ccccc1 191224677 GUIUEZAQCWBRSN-MSOLQXFVSA-N 386.451 5.370 30 20 GKED C=CCc1cc(C(=O)N(c2ccccc2)c2nc(C)cs2)cc(OC)c1OC 302850802 MRLYHHZWBQQSGX-UHFFFAOYSA-N 394.496 5.176 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2cc(Cl)cc(Cl)c2)c1 304053103 PDGWUDYOOKZCRQ-RBUKOAKNSA-N 389.282 5.418 30 20 GKED Cc1nc(-c2ccccc2)oc1/C(O)=N/[C@@H]1CCCc2cn(C3CCCC3)nc21 329318864 IJDNUOLAZHNFCF-LJQANCHMSA-N 390.487 5.344 30 20 GKED Cc1cccc2c1OCC[C@H]2/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 330012196 KEVKDGAAIPYDSM-GHTZIAJQSA-N 393.531 5.282 30 20 GKED CC(C)CCN(CCC#N)C(=O)Nc1ccccc1N(C)Cc1ccccc1 429060008 NFPVIPMABSDIIM-UHFFFAOYSA-N 378.520 5.117 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(COc3ccccc3)cc2)s1 430592211 PRZRRXAFXSLPPW-IBGZPJMESA-N 390.508 5.510 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2ccc(Cl)c(C(F)(F)F)c2)s1 430601804 KJQVODBTZHCNDO-JTQLQIEISA-N 386.826 5.603 30 20 GKED CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 436333859 KGYWCDOXFBDBBS-ZAAXVRCTSA-N 395.528 5.157 30 20 GKED N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1cc(C2CC2)nc2ccc(F)cc12 436349949 FESMQTHOLDPWST-URXFXBBRSA-N 399.469 5.163 30 20 GKED CCOc1ccc([C@@H]2C[C@H]2NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 436355443 YIUHPLJORRQONB-ZAAXVRCTSA-N 395.528 5.015 30 20 GKED N#CCC[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 439396690 ZCASCJIJUUDJSO-QHCPKHFHSA-N 396.450 5.517 30 20 GKED CC(C)c1ccc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1[N+](=O)[O-] 439644821 ILJNNKYDALYTCV-AWEZNQCLSA-N 399.859 5.471 30 20 GKED CCc1ccc(-c2nc(CC(=O)N[C@H](CCC#N)c3ccccc3)cs2)cc1 439679820 YFXKBSOVVAEQFN-OAQYLSRUSA-N 389.524 5.076 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@H]1SCCc2sccc21 443854822 KTQSWVFEENHOGO-KRWDZBQOSA-N 382.535 5.317 30 20 GKED Cc1cccc(NC2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)CC2)c1 458803867 RSALMBILBWIBBF-HSZRJFAPSA-N 390.531 5.016 30 20 GKED N#Cc1ccc(CN(C(=O)Nc2ccc(Cl)cc2OC(F)F)C2CC2)cc1 460228510 BGGBPLIWERWZJG-UHFFFAOYSA-N 391.805 5.010 30 20 GKED CCN(C(=O)c1cc(C2CC2)nc2ccc(F)cc12)[C@H](C)c1ccc(C#N)cc1 463136063 BVQBZTOPAKGPNM-OAHLLOKOSA-N 387.458 5.346 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 464938035 GRVPVNJEPYNTEG-JBXUNAHCSA-N 380.491 5.242 30 20 GKED N#CCc1ccc(NC(=O)NCc2ccc(Oc3ccccc3F)c(F)c2)cc1 466122742 SZTYJYJNISDDNH-UHFFFAOYSA-N 393.393 5.145 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 466673695 VFZMMACPUHRYGV-CQSZACIVSA-N 389.487 5.391 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cnn(-c2cc(C)ccc2C)c1C 476125549 AFZOREVKSMRERX-UHFFFAOYSA-N 387.527 5.902 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(-c2cccc(F)c2)n1 476150964 NUFSLDADQZIXAX-UHFFFAOYSA-N 377.463 5.424 30 20 GKED COc1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)c(C)cc1C 478543686 QCTBWWCPODWTJI-UHFFFAOYSA-N 388.492 5.587 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1scc(C)c1Cl 479631070 CIFKQACZURPEFK-UHFFFAOYSA-N 382.872 5.935 30 20 GKED CC(C)[C@H](NCc1ccc(C#N)cc1Br)c1ccc(F)cc1F 481229092 ASZKKXXFYWTXHW-SFHVURJKSA-N 379.248 5.086 30 20 GKED Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NCc1ccccc1C(C)(C)C#N 486447063 OYGRCWJWBLBAFY-LJQANCHMSA-N 389.543 5.423 30 20 GKED CC(C)Cn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccco1 487230958 YLMKLGCWONSKRH-UHFFFAOYSA-N 380.517 5.288 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(Cc2ccc(F)cc2)n1)c1ccccc1 487248702 DUYNUGPCGUIPFL-IBGZPJMESA-N 393.487 5.038 30 20 GKED C=CC[C@H](C(=O)Nc1cccc(C(=O)N(C)c2ccccc2)c1)c1ccccc1 488670153 GDKVSJWKLLWFTF-QHCPKHFHSA-N 384.479 5.262 30 20 GKED CC(C)Oc1cc(F)ccc1NC(=O)Nc1ccccc1SC[C@@H](C)C#N 491973854 ABLROVNTYYWTMS-AWEZNQCLSA-N 387.480 5.509 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1C[C@@H]1c1ccc([C@@H]2C[C@H]2C)o1 499710984 PUGHMIUDYBNKMU-DMRZNYOFSA-N 375.921 5.436 30 20 GKED C=CCN(Cc1ccccc1)[C@@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 502469258 OPBUFAKGENNEHU-AWEZNQCLSA-N 396.840 5.374 30 20 GKED Cc1cc2occ(CC(=O)Nc3nc(C)c(SCC#N)s3)c2cc1C(C)C 504685000 OCDZOFSCJMLOAT-UHFFFAOYSA-N 399.541 5.426 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1cccc2c1CN(CC(F)(F)F)C2 504823868 BXPWPSKQMLUDFI-UHFFFAOYSA-N 395.469 5.165 30 20 GKED N#CCCn1cc(/C=C\c2nc([C@@H]3C[C@H]3c3ccccc3)no2)c2ccccc21 511985375 BMGWOILOFIPTBL-AMRGAXONSA-N 380.451 5.379 30 20 GKED N#Cc1c(NC(=O)CCc2ncc(-c3ccccc3)o2)sc2c1CCCCC2 514487076 VBHLCEIMFDZUBL-UHFFFAOYSA-N 391.496 5.115 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc(Br)cc1F 518140229 UGUMDFXLCPCSOS-NSHDSACASA-N 393.281 5.092 30 20 GKED COc1ccc2ccccc2c1CN(C(=O)c1cccc(CC#N)c1)C1CCCC1 524386785 VTRYCPVGVNIWNF-UHFFFAOYSA-N 398.506 5.499 30 20 GKED COc1cc(C#N)ccc1OCCS[C@@H](C)c1ccc(OC(F)F)cc1 524887162 HWUCAHCOFCLDLJ-ZDUSSCGKSA-N 379.428 5.041 30 20 GKED N#CC1(NC(=O)c2oc3ccccc3c2COc2ccccc2Cl)CCCC1 533874862 DHXVRAPEAQPJFD-UHFFFAOYSA-N 394.858 5.231 30 20 GKED CN(C(=O)c1c[nH]c(C#N)c1)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 538708609 RTRREFFPKQFYBE-UHFFFAOYSA-N 384.266 5.055 30 20 GKED COc1ccc([C@@H](NCc2cccc(C#N)c2)c2ccccc2Cl)cc1OC 539809382 LGOPWXNVFQRHIV-HSZRJFAPSA-N 392.886 5.108 30 20 GKED Cc1coc(C)c1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 556568779 UGEFNWLKXLLHFU-ZDUSSCGKSA-N 391.279 5.817 30 20 GKED Cc1ccc(S[C@@H](C)C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)cc1 561603612 LRZBRFMZHHRGTO-SJCJKPOMSA-N 379.312 5.164 30 20 GKED CN(C(=O)c1ccc(Cl)cc1)[C@H]1CC[C@H](c2ccc(NCCC#N)cc2)CC1 566129091 VQQKXDSCDPCKJH-LBZQVFOQSA-N 395.934 5.464 30 20 GKED Cc1onc(-c2ccc(Cl)c(Cl)c2)c1C(=O)N1CCC(CCC#N)CC1 567947403 PNAQKNHKTOZKOF-UHFFFAOYSA-N 392.286 5.113 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1 571636436 IPALKCURAAZAOJ-YLJYHZDGSA-N 392.524 5.086 30 20 GKED CNc1ccc(C#N)cc1NC(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1 586818166 LBFVDGGJSCSNOQ-UHFFFAOYSA-N 390.512 5.028 30 20 GKED Cc1nc(N[C@@H](C)c2ccc(OCc3cccnc3)cc2)c(Cl)cc1C#N 589685152 IIRROCNDRTVBPO-AWEZNQCLSA-N 378.863 5.062 30 20 GKED CCCN(CCc1ccccn1)C(=O)Nc1cccc(C#Cc2cccs2)c1 591486879 UUCRGDUBOHHOJN-UHFFFAOYSA-N 389.524 5.030 30 20 GKED C[C@@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(O[C@H](C)c2ccccc2)cc1 595751791 HIPSOVFQMQKANU-RTBURBONSA-N 391.515 5.223 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccc(C2CCOCC2)c1)c1ccccc1 599900539 WVFLINDXOPOTEZ-QFIPXVFZSA-N 377.488 5.137 30 20 GKED Cc1cccc(C2(C(=O)Nc3ccc(Oc4cccc(C#N)c4)nc3)CCC2)c1 603622843 HPURJVHKWSEXTD-UHFFFAOYSA-N 383.451 5.114 30 20 GKED N#Cc1ccc(/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)nc1 603894482 XUXDVZLWVXAPCT-HWKANZROSA-N 396.200 5.054 30 20 GKED CN(Cc1ccoc1)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079983 OXOIFDQPBLKSMC-UHFFFAOYSA-N 395.846 5.048 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CS[C@@H]1CCc2ccccc21 609371290 GJHXFZSTOBYTDS-DNVCBOLYSA-N 382.554 5.440 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cccc(Nc2ccccc2)c1 609820841 MBAKHBUZHJNMTJ-KRWDZBQOSA-N 387.508 5.934 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F 610171130 GUFZBOMZQDQBNX-NVXWUHKLSA-N 380.419 5.307 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(F)c1 610224536 WZXKUVFHLABSAE-QVKFZJNVSA-N 392.861 5.877 30 20 GKED Cc1ccc(C(=O)Nc2cccc(CN[C@@H]3CCCc4cc(C#N)ccc43)c2)cc1 611390916 KTEMSJPKDLYNBH-RUZDIDTESA-N 395.506 5.286 30 20 GKED Cc1ccc(-n2ncc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2C(C)C)cc1 613292507 MROKCJBMEOJWFW-HXUWFJFHSA-N 394.478 5.342 30 20 GKED C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(SCC(F)(F)F)cc1 618802285 HVTFICRUYKRLCD-DJJJIMSYSA-N 376.447 5.551 30 20 GKED O=C(Cc1c[nH]c2ccc(F)cc12)NC(CCC(F)(F)F)CCC(F)(F)F 619125205 KSBAUZCSLUMXMX-UHFFFAOYSA-N 398.322 5.019 30 20 GKED O=C(Cc1cccc(Cl)c1F)NC(CCC(F)(F)F)CCC(F)(F)F 619128218 GWWFJUNVJQPVEE-UHFFFAOYSA-N 393.730 5.191 30 20 GKED O=C(Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)N1CCCC2(CC2)C1 646439183 SCMRRKMNKHUNNJ-UHFFFAOYSA-N 398.322 5.384 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cccc(C(=O)Nc3ccccc3)c2)n1 671769355 XWZAIQMMYWFAJA-SFHVURJKSA-N 389.480 5.009 30 20 GKED N#C[C@H](C(=O)c1cccnc1C1CC1)c1nc2cc(C(F)(F)F)ccc2s1 680169890 REVYGFSEAAPBDQ-CYBMUJFWSA-N 387.386 5.078 30 20 GKED CCN(C(=S)Nc1ccc(C#N)c(Cl)c1)c1ccc(Br)cc1 726485636 TXIDYNZHPIEKOG-UHFFFAOYSA-N 394.725 5.197 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C/c1cccc(OC2CCCC2)c1 730982175 KIERRPBDDOQMQJ-BUHFOSPRSA-N 392.524 5.666 30 20 GKED Cc1cc(C(=O)N(CCC#N)c2ccc(F)cc2)c(C)n1[C@@H](C)c1ccccc1 732093595 IPHPVSLXBZESIO-SFHVURJKSA-N 389.474 5.414 30 20 GKED COc1ccccc1CC(C)(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 732934560 GLIVJDISNLWLJJ-QHCPKHFHSA-N 398.506 5.558 30 20 GKED Cn1cc(C(=O)/C=C\c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc21 733082986 ACWUJBXAYVUFNA-KTKRTIGZSA-N 389.436 5.106 30 20 GKED C#CC[C@@H](OC(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1ccccn1 733691614 ZUFFBRQZRCIJPL-OAQYLSRUSA-N 379.362 5.074 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccc(OC3CCCC3)cc2)c1 733843011 INLPXUMIFRHONT-LJQANCHMSA-N 393.487 5.011 30 20 GKED N#CCOc1ccc(Cl)cc1CN1CCC[C@H]1c1nc2ccccc2s1 735306960 VEHWHEPLRMEQQE-KRWDZBQOSA-N 383.904 5.189 30 20 GKED N#CCOc1ccc(Cl)cc1COC(=O)C[C@H](c1ccccc1)C(F)(F)F 735350588 YFZJUAQZNYBIHU-MRXNPFEDSA-N 397.780 5.022 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)/C=C/c3ccc4ccccc4n3)c2)s1 739591416 WFOFMYLAQSCIDO-JLHYYAGUSA-N 395.487 5.165 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2ccccc2SC[C@H](C)C#N)c1 742996906 DIPSMYHVKCHYPX-GFCCVEGCSA-N 391.949 5.409 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)c1 743028831 VFJHTCQAMXEDAA-HNNXBMFYSA-N 395.528 5.063 30 20 GKED CCCOc1ccc(CCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)cc1 744037167 OTYCUBOIGFISAM-FQEVSTJZSA-N 390.508 5.408 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)ccc1-c1ccccc1 744037197 PKOQLXXNNDUKHP-GOSISDBHSA-N 383.476 5.306 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1 747108795 SKBYPQYSVZQORJ-MLGOLLRUSA-N 389.282 5.007 30 20 GKED N#Cc1ccc(Oc2ccc(OC(=O)c3csc(-c4ccccn4)n3)cc2)cc1 748683213 MEFGQRITZQAMSL-UHFFFAOYSA-N 399.431 5.088 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C/c1ccc(Cl)nc1 758672793 BZPMBRQGYOMFBI-VZUCSPMQSA-N 389.842 5.359 30 20 GKED CN(C(=O)c1cc2c3ccccc3n(C)c2s1)c1cc(Cl)ccc1C#N 764269424 QUAAWJUFBOWWJG-UHFFFAOYSA-N 379.872 5.195 30 20 GKED COc1ccc(/C=C\C(=O)c2c[nH]c3ccccc23)c(OCc2cccnc2)c1 766491956 RWQHDSZXQUSGKG-LUAWRHEFSA-N 384.435 5.047 30 20 GKED COCCOc1c(Cl)cc(NCc2ccc(C(C)(C)C#N)cc2)cc1Cl 774296169 FGVHKDJMMXNWCE-UHFFFAOYSA-N 393.314 5.432 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2ccccc2NCc2ccccc2)n1 776092544 FOVIHLDPTBNFEP-SFHVURJKSA-N 375.497 5.369 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)C23CC(C(F)(F)F)(C2)C3)cc1F 776667040 WWVSIJICJOLIPI-UHFFFAOYSA-N 390.336 5.161 30 20 GKED CC(C)(C)c1ncc(/C=C\C(=O)N(CCC#N)C23CC4CC(CC(C4)C2)C3)s1 776910173 YAIPSPAODVHDIH-WAYWQWQTSA-N 397.588 5.165 30 20 GKED C[C@H](Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1ccc(F)cn1 777691991 IHHFXIMXRGFMCX-VIFPVBQESA-N 382.279 5.354 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1F)C(C)(C)C 780678044 KFLWKDJTGKTTIQ-ORAYPTAESA-N 387.430 5.165 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2cc(Br)cs2)c1 782370973 YMWRFUDKLALEJY-VOTSOKGWSA-N 376.275 5.089 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2sc(C(C)(C)C)nc2C)cn1 792873032 RVZPRSUZTRZFRQ-ZHACJKMWSA-N 393.512 5.111 30 20 GKED FC(F)c1ccc(C=Nn2c(S)nnc2-c2ccc(Cl)cc2Cl)cc1 794474497 ODLZIJCELQBXBA-UHFFFAOYSA-N 399.253 5.360 30 20 GKED C=CCC(C)(C)C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)cc2)n1 796455621 QKRPVLPKAYFCSR-UHFFFAOYSA-N 392.908 5.127 30 20 GKED COc1cccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1F 796801114 XWPIXQUNNULOOM-QGZVFWFLSA-N 394.471 5.075 30 20 GKED CC[C@@H](Oc1ccccc1Cl)C(=O)[C@H](C#N)c1ncc(C(C)(C)C)s1 797571002 MUFZHGJFFNUPJZ-GXTWGEPZSA-N 376.909 5.128 30 20 GKED CC(C)(CCC#N)COC(=O)c1ccccc1SCc1cn2ccccc2n1 798876780 IZUPPHMAJKUZAO-UHFFFAOYSA-N 393.512 5.113 30 20 GKED O=C1/C(=C\c2ccc(-c3cccc(F)c3F)o2)C[C@@H](C(=O)O)c2ccccc21 806560437 LXUJDUVVSDDJPF-XSLBHYSZSA-N 380.346 5.063 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)n1 835200735 OIWRSCPBVRHTIA-ZNMIVQPWSA-N 389.318 5.009 30 20 GKED Cc1cc(OCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)ccc1Cl 915086939 NXWNNCMDJKWCOK-OAQYLSRUSA-N 390.870 5.321 30 20 GKED Cc1ccc(Cl)c(OCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 915101497 CQEAQYOPBGLSPP-OAHLLOKOSA-N 382.872 5.027 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COc2cccc(Cl)c2)cc1 915180053 KPXICMLRJMMZIO-OAQYLSRUSA-N 376.843 5.013 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C/c2ccc(Cl)s2)cc1 915180560 OVCYWHFHZKEJNJ-XSSIKURBSA-N 378.884 5.709 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C\C(=O)c1ccc(F)cc1F 916127712 VDIVVLMMQKPZKP-HJWRWDBZSA-N 376.765 5.148 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C\C(=O)c3cc4ccccc4o3)c2)cc1 916138419 NKVNTUWPVMDSDT-ZROIWOOFSA-N 397.430 5.590 30 20 GKED N#C[C@@H](C(=O)CCCc1ccc(Cl)cc1)C(=O)Nc1cccc2ccccc12 916918458 MPVJEIJQUHSBJX-FQEVSTJZSA-N 390.870 5.163 30 20 GKED N#CC1(C(=O)OCc2cn(-c3ccccc3)nc2-c2ccccc2)CCCCC1 920023648 WNTQEAUYNLOAPS-UHFFFAOYSA-N 385.467 5.057 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3ccc(Cl)cc3)o2)ccc1Cl 1776033364 RGXQZZUMZIUILU-UHFFFAOYSA-N 375.211 5.398 30 20 GKED Cc1cc(COc2ccc(C=NNc3ccc(C(C)C)cc3)cc2)oc1C(=O)O 1776060313 OPJIWKRUOAGLGV-UHFFFAOYSA-N 392.455 5.435 30 20 GKED CC(=NNc1cccc(C(=O)O)c1C)c1ccc(-c2c(F)cccc2F)cc1 1776088638 ZPWAFCOYSODHSE-UHFFFAOYSA-N 380.394 5.475 30 20 GKED O=C(O)C(=O)/C(=C\c1ccc(-c2cccs2)cc1)c1ccc2ccccc2n1 1776117276 SFMFVNFGSKVMAU-JXAWBTAJSA-N 385.444 5.158 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2ccc(Oc3ccc(Cl)cc3C)cc2)CC1 1776161913 YPNCTOGPDFMHHO-UHFFFAOYSA-N 399.918 5.684 30 20 GKED C=CCOc1ccc(CN[C@H](CC(=O)O)c2ccc(C(C)C)cc2)cc1Cl 1776183693 RWSYYUPUOJKLAD-HXUWFJFHSA-N 387.907 5.334 30 20 GKED CC(/C=C1/CCc2oc(C(=O)O)c(C)c2C1=O)=C\c1ccccc1OC(F)F 1776199939 AYDLFYSTQNRSDQ-VDVFTDKOSA-N 388.366 5.046 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2c[nH]c3ccc(C(=O)O)cc23)cc1Cl 1776388588 MNZZJHKLDFFWCT-QPJJXVBHSA-N 383.831 5.203 30 20 GKED O=C(O)COc1ccc(/C=C2/CCc3c(sc4ccccc34)C2=O)cc1Cl 1777645736 BHRDCZWECSYCEL-LCYFTJDESA-N 398.867 5.231 30 20 GKED O=C(O)c1ccc(C(=O)/C=C/c2csc(-c3ccc(Cl)cc3)n2)s1 27123413 OCAZZYDNKARORI-AATRIKPKSA-N 375.858 5.119 30 20 GKED N#C[C@@H](C(=O)/C=C/c1ccco1)c1nc(-c2ccc(Cl)cc2Cl)cs1 51284704 HXNKASMOPWTONE-YVZNUBBCSA-N 389.263 5.600 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)c2ccc3c(c2)CCC3)cc1 55823555 QDGKOBDJKFVDNE-UHFFFAOYSA-N 382.463 5.073 30 20 GKED N#CCCn1cc(C(=O)CSc2nc3cc(Cl)ccc3o2)c2ccccc21 57674409 YGVFFYDGGAKWPF-UHFFFAOYSA-N 395.871 5.325 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccc(F)c(C(F)(F)F)c3)c2C#N)C1 64621588 IYDNCSLXQWFADP-VIFPVBQESA-N 382.382 5.155 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 66955981 KLBPXBYQAUCZRA-FXAWDEMLSA-N 379.529 5.758 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3ccc(C)s3)c2)cc1 71794993 UZOZLJHSPICONG-KPKJPENVSA-N 377.465 5.214 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1nc2cc(Cl)ccc2s1 119969994 PCRFNOISQAKMSC-LLVKDONJSA-N 392.223 5.001 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(NC(=O)OC(C)(C)C)c(C)c2)s1 121639012 QDWUAAYVPAUAKK-UHFFFAOYSA-N 385.489 5.090 30 20 GKED CCOc1ccccc1C(F)(F)C(=O)Nc1ccccc1S[C@H](C)CC#N 131862871 FVYDRUJIBSJSER-CQSZACIVSA-N 390.455 5.210 30 20 GKED CC(C)(C)SCCCC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 132014503 AWCPRNNZJKPHBO-UHFFFAOYSA-N 396.556 5.582 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/Cc3ccc(C)cc3C2=O)cs1 170985733 RCFLWLQGGUFFAR-PDGQHHTCSA-N 388.492 5.267 30 20 GKED C=CCCCC(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 175647307 QLMWMYFJIKVTPS-UHFFFAOYSA-N 394.368 5.392 30 20 GKED Cc1nc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c(C)s1 178554563 OPAMIEPGFPAVLT-UHFFFAOYSA-N 385.436 5.037 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@@H](CCC#N)c1ccccc1 181572433 JMNFKOTYYANMQF-QRWLVFNGSA-N 379.504 5.953 30 20 GKED Cc1csc([C@@H](C)CNC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)n1 184578555 MLVSPJNJTLQIET-AWEZNQCLSA-N 392.484 5.041 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@H](COC)Cc1ccccc1 191518813 PLYJGTMSLFRKPC-NRFANRHFSA-N 380.532 5.260 30 20 GKED C[C@@H]1C[C@H](c2cccnc2)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 248515929 OMNMYGUBXVNOPL-GPMSIDNRSA-N 380.517 5.091 30 20 GKED CC(=O)N(c1nc(/C=C\C(=O)c2ccc(-c3cccs3)cc2)cs1)C1CC1 255435367 LUEBVQBRXNNSNR-FLIBITNWSA-N 394.521 5.283 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H]1CCCC[C@H]1C(C)(C)C 303412098 VAGRPSYXTYGJTE-KZNAEPCWSA-N 387.593 5.071 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)c1ccc(Cl)cc1Cl 329955745 KVXKXEDTFRQXSC-ZOODHJKOSA-N 383.319 5.936 30 20 GKED C[C@@]12CC3CC(/C(O)=N/CCc4nc(-c5ccncc5)cs4)(C1)C[C@](C)(C3)C2 330053125 QABBBIHZHUQZHX-QLOAFGCXSA-N 395.572 5.701 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2C#N)[C@@H](C)C1 410992183 WLKKEKKBFMXEHL-UWVGGRQHSA-N 389.864 5.119 30 20 GKED Cn1cc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c(C(C)(C)C)n1 426265585 HUTVEQHBBRZZGT-CYBMUJFWSA-N 398.576 5.054 30 20 GKED C=CCn1c(SCc2ncccc2C(F)(F)F)nnc1-c1ccc(C)cc1 428086747 BPBKZUQHUIATAU-UHFFFAOYSA-N 390.434 5.146 30 20 GKED COc1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)c(C(F)(F)F)c1 428926384 BVFSOUKSDOONAF-UHFFFAOYSA-N 381.247 5.124 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1cccc(Cl)c1 430638243 FBISYLUKCKGJMH-HNNXBMFYSA-N 398.919 5.078 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2cccc(-c3cnco3)c2)c1 432664924 BCZHGWSPOXHUBE-UHFFFAOYSA-N 381.435 5.404 30 20 GKED Cc1csc(-c2cccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2)n1 432860333 SATBKDSAAATGPI-FQEVSTJZSA-N 390.512 5.675 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(F)cc1C(F)(F)F)c1ccccc1 432864904 IYRLXOSSWSIFSA-INIZCTEOSA-N 379.357 5.401 30 20 GKED N#CCCC[C@@H](NCc1cc(Br)cc2cccnc12)c1ccccc1 433010858 DCLCQFWWHIPFJZ-HXUWFJFHSA-N 394.316 5.522 30 20 GKED CC(C)c1ccc(-c2ncc(CN[C@H](CCCC#N)c3ccccc3)s2)cc1 433011017 MGLOHUZXUOPVFV-HSZRJFAPSA-N 389.568 6.458 30 20 GKED CCN(C[C@@H](C)C#N)C(=O)c1c(-c2c(Cl)cccc2Cl)noc1C(C)C 435526326 NGBSJCZHPDBUCM-LBPRGKRZSA-N 394.302 5.394 30 20 GKED C=CCC[C@H](NC(=O)Nc1cc(NC(=O)C(C)C)ccc1C)c1ccccc1 435652481 BXPDEXFBHHEQRZ-FQEVSTJZSA-N 379.504 5.419 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438664080 KONSBUZLOPGCOE-AWEZNQCLSA-N 395.459 5.776 30 20 GKED C[C@@H](Oc1ccc(C#N)c(Cl)c1)c1nnc(-c2ccc(Cl)cc2Cl)o1 438918370 KKQLBMCDHGVHJW-SECBINFHSA-N 394.645 5.708 30 20 GKED COc1ccccc1NC(=O)c1ccc(NCC#Cc2ccc(Cl)cc2)cc1 443538044 FDGSCTIEPHHVSK-UHFFFAOYSA-N 390.870 5.065 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccc(Br)cc2Cl)C2CC2)c1 446747045 YYLKOCHQWWZFLD-GOSISDBHSA-N 375.697 5.215 30 20 GKED C=CC[C@H](C)NC(=O)Nc1ccc(C)c(Oc2ncccc2Br)c1 448062460 BDYPXBOVWRIPQF-ZDUSSCGKSA-N 390.281 5.031 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(-c2nc3cccc(Cl)c3s2)cc1 448145027 AOYQTMUUQCYHIL-LBPRGKRZSA-N 384.892 5.240 30 20 GKED C=C(C)COc1cc(CN[C@H](c2ccc(OC)cc2)c2ccco2)ccc1OC 449780773 VOYWMZXAGHQWJK-XMMPIXPASA-N 393.483 5.131 30 20 GKED C[C@H](NC(=O)Nc1ccc(CC#N)cc1Cl)c1nc(C(C)(C)C)cs1 455701541 JMOGJFNAAKKDSY-NSHDSACASA-N 376.913 5.043 30 20 GKED C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)N[C@@H](CCCC#N)c1ccccc1 458798331 HUUDURSTMRWYOI-CVDCTZTESA-N 375.516 5.432 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1nnnn1C1CCCCC1 468867454 FSXCGOKUEIRXSB-INIZCTEOSA-N 388.475 5.015 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCCc1ccn(-c2ccccc2)n1 475571904 HKDNBAMVKOTFLZ-UHFFFAOYSA-N 388.515 5.088 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H]1CCCOc2ccc(F)cc21 475573948 UZDFZTFDCRJBJQ-HXUWFJFHSA-N 382.479 5.713 30 20 GKED N#CC[C@@H](CC(=O)N(Cc1ccco1)c1cccc(Cl)c1)c1ccccc1 475925034 DRPBHEGFHUHRDF-SFHVURJKSA-N 378.859 5.554 30 20 GKED C[C@H](c1ccccc1)n1c(SCCCC(C)(C)C#N)nnc1-c1ccccc1 476480900 JLIGJROYMKIKJT-GOSISDBHSA-N 390.556 5.976 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)c1ccc(OCc2ccccc2)cc1 476894938 XPZXQPWITFRMOA-JOCHJYFZSA-N 384.479 5.316 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)C1(Cc2cccc(F)c2)CCC1 484056679 YCNSBYZGWDMTCF-MRXNPFEDSA-N 382.504 5.429 30 20 GKED Cc1c(C(=O)Nc2ccc(O)c(C(F)(F)F)c2)sc2ccc(C#N)cc12 486095711 MMGPNQICUXGRMD-UHFFFAOYSA-N 376.359 5.058 30 20 GKED Cc1nc(CCC(=O)N[C@@H](CCCC#N)c2ccccc2)oc1-c1ccccc1 487156173 MNFYDLSQAJGHDZ-NRFANRHFSA-N 387.483 5.134 30 20 GKED O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1cc(F)cc(C(F)(F)F)c1 488419019 ZGQBUNBYQJTZTA-UHFFFAOYSA-N 383.307 5.230 30 20 GKED C=CCC[C@@H](C(=O)Nc1ccc(-c2nc(C3CC3)no2)cc1C)c1ccccc1 490280083 VEYDUPGFMJIOFX-HXUWFJFHSA-N 387.483 5.611 30 20 GKED CC[C@H](NC(=O)c1cccc(OCc2ccccc2C#N)c1)c1cccs1 502231160 DVROASAIOAFYTK-FQEVSTJZSA-N 376.481 5.080 30 20 GKED C=CCCc1ccccc1NC(=O)N(CCO)Cc1ccc(Cl)c(Cl)c1 505057064 GLGYFKYZXLPFQP-UHFFFAOYSA-N 393.314 5.138 30 20 GKED C=CCOc1ccc(C(=O)N2CCC(c3nc(C(C)(C)C)cs3)CC2)cc1 509675292 JYNQWFCWZOGUKU-UHFFFAOYSA-N 384.545 5.025 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1cc(Cl)ccc1Sc1ccc(F)cc1 510051604 XYLHNIRWFXMYLP-LBPRGKRZSA-N 377.872 5.254 30 20 GKED CC(C)N(Cc1cccs1)C(=O)Nc1ccc(OCC(F)(F)F)c(C#N)c1 513997672 USFJFDBMFZXLAZ-UHFFFAOYSA-N 397.422 5.003 30 20 GKED N#C[C@@H](NC(=O)CSc1ccc(Cl)cc1)c1c(Cl)cccc1Cl 517343271 GSGGCYVRLQEFEO-CQSZACIVSA-N 385.703 5.120 30 20 GKED COc1ccc2oc(C(=O)N[C@@H](C#N)c3ccc(C(C)(C)C)cc3)c(C)c2c1 517492239 PIFUFBAKLKOMEA-IBGZPJMESA-N 376.456 5.042 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3c[nH]cc3-c3ccccc3)cc2)c1 524124506 SRWSJYQAWDNXHU-UHFFFAOYSA-N 393.446 5.385 30 20 GKED N#C[C@H](NC(=O)c1cc2ccccc2o1)c1ccc(OCc2ccccc2)cc1 524337497 NHLIZJXAPCPFIM-NRFANRHFSA-N 382.419 5.006 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1C[C@H]1c1c(F)cccc1Cl 525394491 STGZBKRLXWEZIS-YLJYHZDGSA-N 399.897 5.074 30 20 GKED C[C@@H](NCC#Cc1ccccc1Cl)c1cccc(OCc2ccccn2)c1 538152466 BHMPVZOORAWCNR-GOSISDBHSA-N 376.887 5.016 30 20 GKED CC[C@H](C)[C@H](NCc1nnc(-c2cccc(C#N)c2)o1)c1ccc(Cl)cc1 538188266 PYWDKRXEGBPKME-XOBRGWDASA-N 380.879 5.139 30 20 GKED C[C@H](Nc1cnn(CC(F)F)c1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 539689379 XYHJALRRRZZJNE-QMMMGPOBSA-N 387.274 5.359 30 20 GKED CC[C@@H]1CC[C@@H](C)N1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 540129024 SQPASRADZDPHPC-YLJYHZDGSA-N 377.488 5.126 30 20 GKED CCN(C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1ccc(C#N)c(Cl)c1 540274007 WSNTUBICUQQILQ-INIZCTEOSA-N 380.797 5.301 30 20 GKED COc1cccc([C@@H]2[C@@H](c3ccccc3)CCN2C(=O)Nc2cccc(C#N)c2)c1 541260933 AFGHTAZYPJWPPA-DNQXCXABSA-N 397.478 5.330 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccc2c(c1)CCC(=O)N2 542106409 MQCCJJGBYWJQGI-MSOLQXFVSA-N 395.506 5.522 30 20 GKED C=CCCO[C@@H](C)c1nc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)no1 546295315 NRVGEKRXKFSVNB-VIFPVBQESA-N 380.288 5.428 30 20 GKED Cc1c(Br)cccc1NC(=O)c1sc2ccc(C#N)cc2c1C 550126292 QZTTXDVAYSKHFT-UHFFFAOYSA-N 385.286 5.405 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)C(C)(C)Oc1ccc(C#N)cc1 552963001 MEKKSYQGSSGYPL-UHFFFAOYSA-N 391.515 5.043 30 20 GKED N#CCCn1cc(CNCc2ccc(C3CCCCC3)cc2)c(-c2ccncc2)n1 556884884 RCOJEXLFSUKQFR-UHFFFAOYSA-N 399.542 5.196 30 20 GKED COc1ccccc1[C@H]1C[C@@H](C)CCN1C(=O)C[C@@H](CC#N)c1ccccc1 557816760 KOMFUIYIHSHNKH-CZTZKLFOSA-N 376.500 5.082 30 20 GKED C[C@@H](CCC#N)Sc1nc2scc(-c3ccccc3Cl)c2c(=O)n1C 585728016 IJVBXBNIIXLRJE-NSHDSACASA-N 389.933 5.100 30 20 GKED C[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C[C@@H](C)C1(F)F 599731688 PQPINGMBAKPVOO-HUUCEWRRSA-N 385.414 5.106 30 20 GKED C[C@@H](Nc1cc(Br)cc(Br)c1)c1cccc(C#N)c1 600852611 QIESRTSPCHLXDW-SNVBAGLBSA-N 380.083 5.256 30 20 GKED CC(=O)Nc1cc(NC(=O)Nc2cccc(C#Cc3cccs3)c2)ccc1C 603562512 IYPUXWMVVJSCLG-UHFFFAOYSA-N 389.480 5.059 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC[C@@H]3C3CCCCC3)cn2)c1 603829178 MBAJGZVHJYDJBH-OAQYLSRUSA-N 390.487 5.322 30 20 GKED N#Cc1ccc(SCC(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)cc1 603918519 XRRQWXFRXMOONM-QFIPXVFZSA-N 392.911 5.210 30 20 GKED C=CCn1c(S[C@@H](C)c2ccncc2)nc2sc3c(c2c1=O)CCCCC3 605075912 VYXDNAPFGBVVKC-AWEZNQCLSA-N 397.569 5.161 30 20 GKED CCC[C@H](NC(=O)N(C)Cc1cccc(C#N)c1)c1cccc(C(F)(F)F)c1 608864176 BGWHCKGUQMASNZ-IBGZPJMESA-N 389.421 5.260 30 20 GKED CCCCOc1ccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c(C)c1 608916352 YJKZMQDLTRGUCY-UHFFFAOYSA-N 379.504 5.488 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CS[C@H]1CCc2ccccc21 609371399 IYPSLCVIMGUVOF-KXBFYZLASA-N 382.554 5.298 30 20 GKED C[C@H](Nc1cc(C(F)(F)F)ccc1SCCC#N)c1ccc(F)cc1F 609387075 JNYRHNPCHRVELM-NSHDSACASA-N 386.389 6.162 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)o1 609461070 XXVBZIYUKJJOJI-ZLENFMNRSA-N 377.271 5.023 30 20 GKED CN1CCC[C@@H](CNCC(C)(C)CCC#N)[C@@H]1c1ccc(C(F)(F)F)cc1 610271069 OTXFMOPFUBEUPK-HKUYNNGSSA-N 381.486 5.008 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC(c3cccnc3)CC2)cc1 611261047 DSGDLZSAPKITED-UHFFFAOYSA-N 398.466 5.157 30 20 GKED COc1cccc(CN[C@@H]2CCCc3cc(C#N)ccc32)c1OC1CCCC1 611392655 BFIXBHCSMDLRNC-JOCHJYFZSA-N 376.500 5.055 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)[C@H](C#N)c3ccc4ccccc4n3)s2)cc1 613290560 GGZGYPLAEBEQCY-GOSISDBHSA-N 399.475 5.165 30 20 GKED N#Cc1ccc(C[C@H](C#N)C(=O)Nc2cccc(Sc3ccccc3)c2)cc1 619287345 JKMJAPNFJCXTQT-LJQANCHMSA-N 383.476 5.030 30 20 GKED Cc1ccccc1-n1ncc(C(=O)[C@H](C#N)c2ccc3ccccc3n2)c1C(C)C 682988333 DGUDGRSOSYRAEH-LJQANCHMSA-N 394.478 5.342 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2cnc(-c3ccccc3)nc2)c1 728181831 FNOVRGBLQNNZNF-UHFFFAOYSA-N 395.487 5.033 30 20 GKED Cc1cccc2c1C/C(=C\c1csc(COc3ccc(Cl)cc3)n1)C2=O 729148809 BFQYAFUOXFKJMS-NTEUORMPSA-N 381.884 5.506 30 20 GKED CCC(CC)CN(CCC#N)C(=S)N[C@H](C)c1ccc(Cl)cc1Cl 729642254 JDSHRNZDMVWEJJ-CYBMUJFWSA-N 386.392 5.581 30 20 GKED COc1cc(C#N)cc(Cl)c1OC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 731163389 VYTUEBGECYGLSV-QZTJIDSGSA-N 377.827 5.083 30 20 GKED COc1ccc(/C=C2\CCOc3ccc(Cl)cc3C2=O)cc1OCCCC#N 733749239 UDHPTRFQTOKRJC-FOWTUZBSSA-N 397.858 5.080 30 20 GKED C=CC[C@H](NC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)c1ccncc1 734457541 LHRJYTSWGGNDOH-SDHOMARFSA-N 398.506 5.198 30 20 GKED C=CC[C@H](NC(=O)N[C@H](c1oc2ccccc2c1C)C(C)C)c1ccncc1 734668518 IPHGKSGSDXBWNY-FPOVZHCZSA-N 377.488 5.450 30 20 GKED CC(C)(C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1)c1cccc(Cl)c1 736465894 TWNIOCOPCYJSPT-QFIPXVFZSA-N 388.898 5.912 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1cccc(C(F)(F)F)c1 739142985 NBXLYTDLPNLXSA-KDOFPFPSSA-N 382.385 5.624 30 20 GKED CC(C)[C@@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 744034232 DHXXISPDMNRVLE-UYAOXDASSA-N 394.927 6.080 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)ccc1OC(F)F 745990158 MAGHLMQSMOGIPV-WAPJZHGLSA-N 381.378 5.255 30 20 GKED N#Cc1ccc(/C=C2/SC(=S)N(c3ccccc3C(F)(F)F)C2=O)s1 749015868 AQEUHYONIIFSCD-NTUHNPAUSA-N 396.440 5.044 30 20 GKED Cc1nc(CCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cs1 749912975 YBJXHPPXTLXXTM-OAQYLSRUSA-N 375.497 5.068 30 20 GKED Cn1c2ccccc2c2cc(C(=O)N3CCC[C@@H]3[C@@H](C#N)c3ccccc3)sc21 752046814 COQLIAYLYVFDQJ-PZJWPPBQSA-N 399.519 5.305 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=Cc3ccccc3C(F)(F)F)o2)cc1C 758410437 KFUJFRJPDFBBGC-AWEZNQCLSA-N 389.377 5.484 30 20 GKED C[C@H](C#N)Oc1ccc(CN2CCC[C@H]2c2cccc(Br)c2)cc1 768420240 ACSQYFJCBVPTCT-QRWLVFNGSA-N 385.305 5.077 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cccc(CC[C@H](O)c3ccccc3)c2)cc1 770557546 CYIRPCHVNZGEMA-CLOONOSVSA-N 386.495 5.256 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2ncc(-c3ccccc3)s2)cc1 770571682 VIHHRIFLXSOASK-OUKQBFOZSA-N 391.496 5.236 30 20 GKED CC[C@@H]1C[C@H](CC(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)CCO1 781770243 KZTSFTSXIKJPMV-BNOWGMLFSA-N 396.434 5.087 30 20 GKED C[C@H]1COc2ccccc2CN1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 782553284 OCLFPAVPLQQKIX-FDDCHVKYSA-N 397.478 5.157 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)C(C)(C)c2ccc(OC(F)(F)F)cc2)n1 789393414 UAYNQWQCPQJRTN-CQSZACIVSA-N 396.434 5.319 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(CC[C@@H](O)c3ccccc3)c2)c1 797087823 JJQFZTMYOPNTHU-JOCHJYFZSA-N 390.870 5.130 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)OCC(C)(C)CCC#N)c12 798877628 UFTKYFREQVPAPX-UHFFFAOYSA-N 384.524 5.105 30 20 GKED CCOC(=O)[C@@H]1C/C(=C/c2cccc(-c3cccnc3)c2)C(=O)c2ccccc21 802708915 XTTKZWJPAXBUIJ-QFXXMJIKSA-N 383.447 5.065 30 20 GKED CC(C)(C)c1ncc(/C=C2\CCc3nc(-c4ccccc4)sc3C2=O)cn1 806566474 HPZWQWYQUUQZGK-LFIBNONCSA-N 375.497 5.110 30 20 GKED O=[N+]([O-])c1cc(Cl)cc(C=Nc2ccc(SCc3cccnc3)cc2)c1O 812411469 FDKHHINPWRZAJF-UHFFFAOYSA-N 399.859 5.392 30 20 GKED O=C(c1ccsc1C(F)F)N1CCC[C@H](C(F)(F)F)[C@@H]1C(F)(F)F 821863823 ORSXUWNUIMWRNC-IONNQARKSA-N 381.288 5.031 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C2SCCCS2)cc1Cl 841055374 ILPPPEKZQJYDFI-INIZCTEOSA-N 388.945 5.130 30 20 GKED C/C(=C\C(=O)[C@H](C#N)C(=O)C1(c2ccccc2)CC1)c1cccc(C(F)(F)F)c1 845842122 RHLHHWKHZMGPTF-QZEGLACASA-N 397.396 5.118 30 20 GKED C[C@@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)c(F)c1 850538402 DUICCEXXQATLDO-SZNDQCEHSA-N 395.478 5.382 30 20 GKED N#Cc1ccc(Br)c(CNc2ccc3c(c2)nc2n3CCCCC2)c1 863998193 KTQMKDCRYQILOD-UHFFFAOYSA-N 395.304 5.009 30 20 GKED C=CCN(C(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1)C(C)C 916707626 VGKAERMHXIYOGJ-UHFFFAOYSA-N 383.439 5.181 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)/C=C\c2ccccc2F)cc1 917803657 JAKJTKPILBXBIH-KAMYIIQDSA-N 386.426 5.123 30 20 GKED O=C(/C=C1/COc2ccc(F)cc21)c1ccc(-c2ccccc2[N+](=O)[O-])s1 918156922 XARCMIILTCKKTP-XFXZXTDPSA-N 381.384 5.121 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2CCc3cc(F)ccc32)cc1 919904264 CQJXUUKZUPHMOG-GOTSBHOMSA-N 385.442 5.290 30 20 GKED C[C@H](Cc1ccc(F)cc1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 921131343 IYTWQTPGPWRFIO-FZKQIMNGSA-N 398.890 5.658 30 20 GKED COc1ccc(Cl)cc1C(CC(C)C)=NNc1ccc(C(=O)O)c(F)c1 1776074014 BTHJPSAFPAEMBK-UHFFFAOYSA-N 378.831 5.048 30 20 GKED Cc1c(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)cnn1-c1ccccc1 1776113294 FCSRREJPUYGDQV-QBFSEMIESA-N 398.418 5.035 30 20 GKED CC(C)(C)[C@H]1C/C(=C/c2cccc(C#N)c2)c2nc3ccccc3c(C(=O)O)c2C1 1776121593 OLCPXTFFBFLKMI-OVCORXIESA-N 396.490 5.954 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CCc2ccccc2)C(=O)O)cc1 1776786485 MRBSWSCSJVEXRQ-QHCPKHFHSA-N 383.532 5.211 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](CC(=O)O)c2ccc(OC)cc2)cc1 1776787971 FTYPQSRHJDNSPV-QHCPKHFHSA-N 399.531 5.350 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)c2cc(F)ccc2F)cc1 1776788224 ROZAEIXBRLCLIS-OAQYLSRUSA-N 391.458 5.230 30 20 GKED Cc1cc(Cl)cc(C)c1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777423462 TUVNZXYRWHKZJS-FPLPWBNLSA-N 380.827 5.811 30 20 GKED C=CCn1c(S[C@H](C)C(=O)c2ccc(Cl)cc2)nnc1-c1ccoc1C 35767171 NNFNTXMMWOLNPL-CYBMUJFWSA-N 387.892 5.049 30 20 GKED CCOc1cc(/C=C/C(=O)c2cnn(C(C)C)c2)ccc1OCc1ccccc1 58465481 BWZDXLPDLFQXKC-ZRDIBKRKSA-N 390.483 5.338 30 20 GKED CN(C(=O)c1ccc(CSc2ccc(Cl)cc2)cc1)c1cccc(C#N)c1 60083743 CSTQJHPOXQMHGW-UHFFFAOYSA-N 392.911 5.781 30 20 GKED N#C[C@@H](C(=O)C12CC3CC(CC(C3)C1)C2)c1nc(-c2ccc(Cl)cc2)cs1 60477522 ZAVYXMLPJNCJPE-CTEACUEPSA-N 396.943 5.856 30 20 GKED N#C[C@@H](Sc1nnc(S[C@H](C#N)C2CCCCC2)s1)C1CCCCC1 115184867 FWSWHFVOHQGAAV-HZPDHXFCSA-N 392.619 5.667 30 20 GKED N#CCC[C@@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccccc1 130472401 YONAHMVACHUVGX-HXUWFJFHSA-N 397.931 5.510 30 20 GKED Cc1cc(Br)cc(C(=O)Nc2ccccc2SCCC#N)c1 131404625 BPUJBUONLSBOPZ-UHFFFAOYSA-N 375.291 5.016 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc1Cl 154907775 GKGRQGDENVAYNL-UHFFFAOYSA-N 399.853 5.122 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](SC)c3ccccc3)n2)cc1 172546323 QHZAJMLBYJGUOA-YLJYHZDGSA-N 394.521 5.099 30 20 GKED CN(Cc1nccs1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 175734243 PSNPVKMHHOXENL-KRWDZBQOSA-N 396.903 5.116 30 20 GKED N#Cc1cn(CCCc2ccc(C(F)(F)F)cc2)c2ccc(Cl)cc2c1=O 176732600 XMVIZVKRDHEIOI-UHFFFAOYSA-N 390.792 5.178 30 20 GKED C/C(=C\c1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc(-c2ccncc2)cs1 179028587 GBZUPSQYNAVBQA-JZUUQJBKSA-N 379.872 5.138 30 20 GKED COc1ccc(CN(C)[C@@H](C)c2nc3ccccc3s2)cc1OCCCC#N 179734452 JERRASAJBDEGPG-INIZCTEOSA-N 395.528 5.180 30 20 GKED C[C@H](NCc1nnc(-c2ccc(C#N)cc2)o1)c1ccc(Oc2ccccc2)cc1 181810294 KYJOYOGCHKFIFB-KRWDZBQOSA-N 396.450 5.251 30 20 GKED Cn1c([C@H](C#N)C(=O)c2cc3sc4ccccc4c3s2)nc2ccccc21 195556798 QOSZFNVBGNGKGZ-CYBMUJFWSA-N 387.489 5.493 30 20 GKED COc1ccc(CN[C@H](c2ccccc2C)C(C)(C)C)cc1OCCCC#N 237177840 NECQVAMDJGQSGF-HSZRJFAPSA-N 380.532 5.563 30 20 GKED O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)NCC#Cc1ccccc1 247761332 HNDCHNUTFKYHLZ-UHFFFAOYSA-N 396.465 5.075 30 20 GKED N#CC1(NC(=O)CS[C@@H](c2ccccc2)c2ccc(Cl)cc2)CCCC1 255928170 JQUWCDNAIJRLMK-FQEVSTJZSA-N 384.932 5.115 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1c(Cl)nc2ccccn12 303707679 CAZRWZRPONJLSQ-CSKARUKUSA-N 393.786 5.052 30 20 GKED O/C(Cn1c(C2CCCCC2)nc2ccccc21)=N/[C@@H]1CCOC2(CCC2)C1 328926305 WIOLLSLWIGBOKH-GOSISDBHSA-N 381.520 5.142 30 20 GKED Cc1ccc(C#N)cc1NC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 409761883 FTAFAXLAQFKLDP-UHFFFAOYSA-N 389.402 5.067 30 20 GKED Cc1nc(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2Cl)sc1SCC#N 409817901 IKHVVHGMXMTPMT-NWDGAFQWSA-N 398.340 5.116 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3c(Cl)cccc3[N+](=O)[O-])c2C#N)[C@H](C)C1 410992184 WLKKEKKBFMXEHL-VHSXEESVSA-N 389.864 5.119 30 20 GKED Cc1ccc(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)cc1NC(=O)C(C)(C)C 425651396 LGGJXEDJQIQKBY-INIZCTEOSA-N 392.503 5.076 30 20 GKED C[C@@H](NC(=O)N[C@H](CCC#N)c1ccccc1)c1cc(Cl)ccc1Cl 429060600 BAUUXJHJHRAAJI-FZKQIMNGSA-N 376.287 5.399 30 20 GKED CCCc1c(C(=O)[C@@H](C#N)c2nccc3ccccc23)cnn1-c1ccccc1C 429205524 RJOFDPOENZOBFT-FQEVSTJZSA-N 394.478 5.172 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCCc2ccc(F)cc21 432098563 YOUYRLAWEFUEGK-KDOFPFPSSA-N 383.492 5.277 30 20 GKED N#CCCC[C@@H](NCC[S@](=O)c1cc(Cl)ccc1Cl)c1ccccc1 433021607 RMLXGPKUTPXUJF-CJAUYULYSA-N 395.355 5.126 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCCC(F)(F)C1 433141939 BTCLGVAHPYREMW-CABCVRRESA-N 381.492 5.418 30 20 GKED Cc1nc(-c2ccccc2)sc1C(=O)Nc1ccc(OC(C)C)c(C#N)c1 435356513 IEMCMFBDDGYFNA-UHFFFAOYSA-N 377.469 5.030 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@H]2C2CCC2)cc1F 438660952 OXNWBWQNRNDRQH-IBGZPJMESA-N 379.435 5.286 30 20 GKED Cc1sc(Br)c(C(=O)[C@H](C#N)c2nccc3ccccc23)c1C 442558409 ZDYASIMKHFSKOW-CQSZACIVSA-N 385.286 5.166 30 20 GKED Cc1cc(O)ccc1NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 443598963 CIHOLKADVYJQTC-UHFFFAOYSA-N 377.375 5.148 30 20 GKED Cc1nc(-c2cccs2)sc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443876491 HOAUVGNQMOARJA-UHFFFAOYSA-N 393.415 5.323 30 20 GKED C=CCN(CC=C)C(=O)N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1 444017784 GHPNLZZPXBQXTQ-CQSZACIVSA-N 380.332 5.083 30 20 GKED CCCO[C@@H]1CCCN(CCC(C#N)(c2ccccc2)c2ccccc2)CC1 444611421 RGQDTNQGQFLEEF-XMMPIXPASA-N 376.544 5.167 30 20 GKED CC(C)[C@H](CC(F)(F)F)NC(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 446640974 AJGVBERFLGDWQA-QWHCGFSZSA-N 388.327 5.095 30 20 GKED N#CCSc1cccc(C(=O)Nc2ccnc(Oc3ccc(F)cc3F)c2)c1 448451665 YZBAJCMOTOYKND-UHFFFAOYSA-N 397.406 5.020 30 20 GKED COc1ccccc1[C@@H](C)SCC(=O)c1cn(CCC#N)c2ccccc12 463213820 QLHKNEXREHEEGK-MRXNPFEDSA-N 378.497 5.241 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)N2CCC[C@@H]2/C=C/c2ccccc2)c1 475808225 JBTHMKQNRCFWBW-VDZCTEQFSA-N 398.462 5.048 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)CS[C@@H](C)c1ccc(C#N)cc1 476165425 UCTUQYKUEONNTG-JXFKEZNVSA-N 382.529 5.019 30 20 GKED CO[C@@H](c1ccccc1Cl)[C@@H](C)NC(=O)Nc1ccc(C(C)(C)C#N)cc1 480474736 DFNLMBCABQEPDB-AUUYWEPGSA-N 385.895 5.039 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cnn(CC(C)C)c1C(C)C)c1ccc(F)c(F)c1 480951080 IFYUVVDEUNPXSH-LJQANCHMSA-N 390.478 5.380 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccc(F)c(F)c1 480996009 ZIWACMHWZUVUER-HXUWFJFHSA-N 397.425 5.676 30 20 GKED N#C[C@H](C(=O)c1sc(C2CC2)nc1-c1ccccc1)c1cnc2ccccc2n1 483217773 XUYJZFLHJJZNEW-INIZCTEOSA-N 396.475 5.121 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)NC(=O)c1ccc(C#N)s1 487235164 UKQPLOAZBATVHG-JTQLQIEISA-N 387.917 5.196 30 20 GKED Cc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1OC(C)C 489554782 SLJIGANXQKRUPY-NHCUHLMSSA-N 377.488 5.086 30 20 GKED C[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccc(Oc2cccnc2)cc1 489879877 CEHVHLGJOLJNSH-LJQANCHMSA-N 398.510 5.065 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1 505024767 WNGDCNVHLQDITQ-SFHVURJKSA-N 395.572 5.552 30 20 GKED N#C[C@H](NC(=O)c1cccc(Oc2ccncc2)c1)c1ccc(Cl)c(Cl)c1 505975342 DMYAXCUXWFDTAF-IBGZPJMESA-N 398.249 5.175 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSc1cc(Cl)ccc1F 506396998 UJBRIKURAPMUKD-LBPRGKRZSA-N 394.924 5.462 30 20 GKED COc1cccc(OC)c1Oc1ccc(CNc2ccc(Cl)cc2C#N)cn1 511384343 PELBRPBSLZSYET-UHFFFAOYSA-N 395.846 5.028 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)Cc1nc2cc(C(F)(F)F)ccc2o1 512506094 HAEXAYDHTQHYGO-UHFFFAOYSA-N 392.425 5.202 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1cccc(OCCCC#N)c1 512708114 NRPGEHXSMXYQMI-UHFFFAOYSA-N 395.846 5.238 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)CCCSCCCCC#N 513453235 SJCMZXDPDHOQCV-UHFFFAOYSA-N 383.355 5.212 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)Nc1sc2c(c1C#N)CCCCCC2 515677598 LOIAUWIXDJVENL-UHFFFAOYSA-N 393.434 5.253 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)Nc3ccc(Oc4ccc(C#N)cc4)cc3)o2)cc1 519065336 HRICKKQWENFHBP-QGZVFWFLSA-N 396.450 5.882 30 20 GKED C=CCCOCCCCC(=O)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 537192584 NTOXSEJICJZOIK-LJQANCHMSA-N 383.454 5.522 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccn(-c3ccc(Cl)cc3)n2)c(C#N)s1 539175334 GPLBVAWJHJWIKG-UHFFFAOYSA-N 384.892 5.009 30 20 GKED C[C@H](C#N)CN(C(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1)C1CC1 540120343 HVBYBPIEPOGOCV-GFCCVEGCSA-N 394.418 5.078 30 20 GKED C[C@H](Nc1ccc(Br)cc1C#N)c1nc2ccccc2n1C(F)F 543959371 SOMUCTKTJGHGJI-JTQLQIEISA-N 391.219 5.239 30 20 GKED CC(C)(C#N)CCCCS(=O)(=O)[C@@H](c1ccccc1)c1ccc(Cl)cc1 550001919 COFXHYLJELKDHT-FQEVSTJZSA-N 389.948 5.564 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F 565943525 RGVQTNXZYKBVME-OALUTQOASA-N 388.417 5.173 30 20 GKED COc1cccc([C@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccccc2Cl)c1 566827313 VSTMMVVWNFPWHJ-RPWUZVMVSA-N 388.898 5.587 30 20 GKED CCCn1ncc(C(=O)Nc2sc3c(c2C#N)C[C@@H](C)C[C@@H]3C)c1C1CC1 582287348 SXPGJNHUBBPISY-STQMWFEESA-N 382.533 5.042 30 20 GKED N#C[C@H](NC(=O)C1CC(c2ccc(F)cc2)C1)c1cccc(Cl)c1Cl 590232515 TXYICYLOSMXAJR-FVKWTLKZSA-N 377.246 5.007 30 20 GKED CC[C@H](OCCn1cc(C#N)c(=O)c2cc(C)cc(Cl)c21)c1ccccc1 593424496 IGMYPBHBCSIXMV-FQEVSTJZSA-N 380.875 5.003 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N2CCC[C@H](CCF)C2)cc1 598219323 HIQFPLSUJWXPJA-GOSISDBHSA-N 382.504 5.062 30 20 GKED N#CCCn1cc(CN[C@H]2CCCc3ccc(Cl)cc32)c(-c2ccccc2)n1 599007365 PQHQDQTUFCGAFV-QFIPXVFZSA-N 390.918 5.284 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC2(CCSCC2)CC1 602843127 VJTGGWVQOKNORO-MRXNPFEDSA-N 389.590 5.222 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1Cl 603827905 PJDUEESFEKPNAO-INIZCTEOSA-N 378.863 5.104 30 20 GKED C=C(C)CN(CC)C(=O)Nc1c(C)c(C)nn1-c1ccc(Cl)c(Cl)c1 605213141 HERCQJUIFOHNOZ-UHFFFAOYSA-N 381.307 5.226 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3ccccc3Br)c2)cc1 609175983 SYSPWGCZXLRPRA-UHFFFAOYSA-N 393.240 5.365 30 20 GKED C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)N(C)c1ccc(C#N)cc1F 609216907 QMGCEZMTKSNUGP-SNVBAGLBSA-N 383.275 5.148 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1ccc(Br)cc1F 609427855 WLWFBYTUPHJGHU-LLVKDONJSA-N 393.281 5.235 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@@H]2COc3ccccc32)cc1Cl 609587059 UDIRAWMZAITFKV-VQTJNVASSA-N 388.854 5.110 30 20 GKED N#Cc1ccc(C(F)(F)F)nc1NCc1ccccc1OCc1ccccc1 609669675 DKCWXIAAUCEGHZ-UHFFFAOYSA-N 383.373 5.163 30 20 GKED N#Cc1ccc(-c2nnc(CSC(c3ccccc3)c3ccccc3)o2)cc1 610216830 ABGLPRIWLDYDBE-UHFFFAOYSA-N 383.476 5.631 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)cc1 610634674 BDZRMMDYZIFXCF-FGZHOGPDSA-N 391.515 5.305 30 20 GKED N#C[C@@H](C(=O)c1ccc2[nH]c3c(c2c1)CCCCC3)c1ccc2ccccc2n1 613292748 VIFYATYWVVWIHZ-HXUWFJFHSA-N 379.463 5.475 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC(F)(F)CC3)cc2Cl)cc1 619535647 OFLOGGUJPVCSFZ-UHFFFAOYSA-N 391.805 5.267 30 20 GKED C=CCn1c(S[C@@H](C#N)c2ccc(Cl)cc2)nnc1-c1ccc(OC)cc1 619864022 ZOYDEAQVNDYPBR-SFHVURJKSA-N 396.903 5.150 30 20 GKED Fc1ccccc1-c1csc(N2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)n1 645037816 YANBQJVFRGCMGO-UWVGGRQHSA-N 384.320 5.126 30 20 GKED FC(F)Oc1ccc(Cl)cc1CN1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 674463370 PHESEXJGHRCZMZ-AOOOYVTPSA-N 397.693 5.114 30 20 GKED C=CCn1c(-c2ccc(F)cc2)nn(CN(C)C[C@H](C)c2ccccc2)c1=S 727428455 OHLPAISIBPZRBK-KRWDZBQOSA-N 396.535 5.099 30 20 GKED CC(=NNc1nncc2ccccc12)c1sc(-c2ccc(Cl)cc2)nc1C 727648693 PGTSOGIDFXEJKV-UHFFFAOYSA-N 393.903 5.551 30 20 GKED CC(=NNc1oc(CC(C)C)nc1C#N)c1sc(-c2ccc(C)cc2)nc1C 727651423 XZFNXORREGEXPE-UHFFFAOYSA-N 393.516 5.321 30 20 GKED O=C(O)C(=O)/C(=C\c1cc(-c2ccccc2)cs1)c1ccc2ccccc2n1 728156470 IPVBNQYBCYGLPQ-UYRXBGFRSA-N 385.444 5.158 30 20 GKED C#Cc1cccc(N(Cc2ccco2)C(=O)c2oc3ccccc3c2COC)c1 728185615 NEAOUCQTXIQSOM-UHFFFAOYSA-N 385.419 5.001 30 20 GKED C#CCN(Cc1ccc(F)cc1)C(=S)Nc1c(Cl)ccc(C)c1Cl 728447108 SUEQJCGJWXPFHS-UHFFFAOYSA-N 381.303 5.273 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)/C=C\c2cncc(F)c2)cc1Cl 729318765 CBKMBDUHZVBIIG-QKWWCAPFSA-N 391.833 5.181 30 20 GKED O=C(/C=C/c1ccc(O)c(Cl)c1)c1c[nH]c2cc(Br)ccc12 729937146 MGDYIGWLOSHJIQ-ORCRQEGFSA-N 376.637 5.186 30 20 GKED CC(C)Oc1cccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 731114145 HNDKOCIGTYQINN-INIZCTEOSA-N 383.517 5.047 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc(Cl)cc1Cl 731322357 YDERKGSORMYEIC-LLVKDONJSA-N 396.368 6.197 30 20 GKED Cc1ccc(N=Nc2cc(C)ccc2NC(=O)Cc2ccc(OCC#N)cc2)cc1 731955939 WZXNEBCNMOVHHS-UHFFFAOYSA-N 398.466 5.802 30 20 GKED N#CCOc1ccc(Cl)cc1CSc1nc2ccc([N+](=O)[O-])cc2s1 735230595 DVIHDXQJOOJFJN-UHFFFAOYSA-N 391.861 5.053 30 20 GKED N#Cc1ccccc1NC(=S)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 735242581 RUINNKVKVSKCCD-UHFFFAOYSA-N 390.424 5.068 30 20 GKED CC(=NNc1cc(C)c2ccc(C)c(C)c2n1)c1c(Cl)nc2sccn12 741837665 MPRVDDZBRAIBAO-UHFFFAOYSA-N 383.908 5.359 30 20 GKED CSc1ccc(C(=O)/C=C/c2cc3cnn(C(C)C)c3nc2Cl)cc1F 741846605 HPORFQYJBFNLFU-GQCTYLIASA-N 389.883 5.423 30 20 GKED CC(C)c1ocnc1C(=O)N(Cc1ccc(Cl)cc1)c1cccc(C#N)c1 741970178 WYUNATURFPEXAS-UHFFFAOYSA-N 379.847 5.170 30 20 GKED CCOc1ccc(O)c(C=Nc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)c1 743045178 YWBARHHSVCNNGH-OAHLLOKOSA-N 384.476 5.127 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)s1 749322431 DNRWEPCSOKMCMM-HNAYVOBHSA-N 391.496 5.067 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3c[nH]c4cc(F)ccc34)c(Cl)nc21 749454371 YXGVWLOYWJEUED-UTCJRWHESA-N 382.826 5.182 30 20 GKED CCN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl)c1ccc(C#N)cc1 753175966 GERPJCOVYSEMDK-UHFFFAOYSA-N 399.878 5.225 30 20 GKED N#Cc1ccccc1/C=C1/CC2(CCOCC2)C/C(=C/c2ccccc2C#N)C1=O 755598903 LPHTWGKKWZTEJO-GACBQCINSA-N 394.474 5.057 30 20 GKED N#Cc1ccccc1/C=C1/CC2(CCOCC2)C/C(=C\c2ccccc2C#N)C1=O 755598908 LPHTWGKKWZTEJO-NQGGHMMCSA-N 394.474 5.057 30 20 GKED C=C(C)C[C@H](C)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 767959964 NHMPTSWYMFXARW-SMDDNHRTSA-N 379.312 5.895 30 20 GKED C[C@@H](N(Cc1ccccc1)C(=S)Nc1ccc(C#N)c(Cl)c1)C(C)(C)C 768783155 BNGSPPTYNCPQEO-OAHLLOKOSA-N 385.964 5.845 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2cc(Cl)ccc2[N+](=O)[O-])cc1 773429256 RXKCEAYBUXLVRX-UHFFFAOYSA-N 377.831 5.077 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(CNC(=O)OC(C)(C)C)cc1)c1ccccc1 777832442 MMBKKFCYOVLYFE-GOSISDBHSA-N 380.488 5.010 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)C1(c2cccc(Cl)c2)CCCCC1 780160992 SZZBTGBPRYQLDI-MRXNPFEDSA-N 382.891 5.471 30 20 GKED CCC(C)(C)N(CCC#N)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1Cl 787945007 SGDHMBATEPUHIX-UHFFFAOYSA-N 393.915 5.231 30 20 GKED Cc1ccccc1[C@@H](C)N(CC(C)C)C(=S)Nc1ccc(C#N)c(Cl)c1 789360607 UXUSVQKLNCGGPR-MRXNPFEDSA-N 385.964 5.936 30 20 GKED CSc1cc(O)ccc1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 792732967 ONTFVXITRDJIDW-IBGZPJMESA-N 389.480 5.414 30 20 GKED N#CC[C@H](CC(=O)OCc1ncc(-c2ccc(Cl)cc2)o1)c1ccccc1 795992163 QYYVTCPRMUCABZ-QGZVFWFLSA-N 380.831 5.126 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3cn(C(C)C)nc3C)s2)cc1 798370346 KPXUTGIUEGFRRI-DHZHZOJOSA-N 381.501 5.109 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2cccc3[nH]ccc23)cc1 800519605 SCAGRCYAAUZYJM-HSZRJFAPSA-N 394.478 5.188 30 20 GKED C[C@H](Sc1ccc(Cl)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813211842 ROHXDFSLMQRSOV-IINYFYTJSA-N 384.810 5.111 30 20 GKED CC(C)(CC#N)CNC(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 838754493 CAPWARJNWXMSFQ-LBPRGKRZSA-N 386.348 5.034 30 20 GKED C=CC[C@H](OC(=O)C1(C(F)(F)F)CCOCC1)c1ccc(Cl)c(Cl)c1 857616748 UHWOWZVGCUNDNJ-AWEZNQCLSA-N 397.220 5.513 30 20 GKED C[C@H](Cc1ccc(C#N)cc1)c1nc(-c2ccc(Oc3ccccc3)nc2)no1 904448398 HRHAHSRMTHJFAY-MRXNPFEDSA-N 382.423 5.142 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c1 904508272 KALXIAVEPKFZSQ-VQTJNVASSA-N 398.397 5.206 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)/C=C\c1ccc2ccc(Cl)cc2n1 914501763 MQMMCVMEAJBUFH-QXMHVHEDSA-N 389.886 5.210 30 20 GKED CC(C)c1nn(C)c(Cl)c1C=NNc1c(Cl)cc(Cl)cc1Cl 915934074 RDTGMQQHVGVSEV-UHFFFAOYSA-N 380.106 5.603 30 20 GKED O=C(c1cccc(CON=Cc2cccc(Cl)c2Cl)c1)N1CCCCC1 917623334 WYPNBLGLRHPMSS-UHFFFAOYSA-N 391.298 5.170 30 20 GKED O=C(/C=C\c1csc(-c2ccsc2)n1)c1ccc(Br)s1 920063024 RLZXPKPMHORPQU-UPHRSURJSA-N 382.329 5.592 30 20 GKED N#Cc1ccc(CSc2nc(O)c3c4c(sc3n2)CCCC4)c(Cl)c1 1458728325 LFRROAYJXJDLIO-UHFFFAOYSA-N 387.917 5.093 30 20 GKED CC(=NNc1ccnc(Cl)c1)c1ccc(Oc2ccc(C(=O)O)cc2)cc1 1776091975 QMEHRZWPZMRHQG-UHFFFAOYSA-N 381.819 5.062 30 20 GKED C=C1C[C@@H](C(=O)O)N(Cc2ccc(Oc3cccc(Cl)c3Cl)cc2)C1 1776147039 YECXABNUEGCICA-INIZCTEOSA-N 378.255 5.001 30 20 GKED C[C@@H](Oc1ccc(C(=O)/C=C/c2ccc(F)c(C(=O)O)c2)cc1)c1ccccc1 1776469384 DHIMTPSQPXXLHU-FCONWMNKSA-N 390.410 5.560 30 20 GKED CCCCCCCOc1ccc(CNCc2ccccc2CCC(=O)O)cc1 1776786938 CKLUXVVUWHSSQL-UHFFFAOYSA-N 383.532 5.343 30 20 GKED COc1ccc(-c2ccccc2C)cc1/C=C/C(=O)c1cc(C(=O)O)ccc1C 1777342043 TVVPTRATGSBGRQ-ZRDIBKRKSA-N 386.447 5.573 30 20 GKED O=C(O)c1ccc2scc(/C=C/C(=O)c3cc(Cl)cc(Cl)c3F)c2c1 1777685565 MZTWCMSWLFNVPZ-HNQUOIGGSA-N 395.238 5.942 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1sc(C)c(C)c1C#N 26362746 RYCPJEVSRVNEOF-UHFFFAOYSA-N 387.917 5.574 30 20 GKED N#C[C@H](C(=O)c1ccccc1COc1ccccc1)c1nc2ccccc2s1 41499731 DSSBPYNKWUWECZ-LJQANCHMSA-N 384.460 5.365 30 20 GKED C=CCn1c(S[C@@H]2CCCc3ccccc32)nnc1-c1ccccc1OC 58986781 PSLYPHHKRNSZLD-HXUWFJFHSA-N 377.513 5.309 30 20 GKED CN(C(=O)c1cccc(OCc2cccc(Cl)c2)c1)c1cccc(C#N)c1 63327216 CEBLQSGPXFUBMN-UHFFFAOYSA-N 376.843 5.067 30 20 GKED COc1ccc(CN[C@H](c2ccc(F)cc2)C2CCCC2)cc1OCCCC#N 64614570 PHBHQUHUTIYVDJ-DEOSSOPVSA-N 396.506 5.538 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1S[C@@H](C)CC#N 66955244 RPXFNNWTGFSKEQ-INIZCTEOSA-N 383.517 5.143 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C)Nc1ccccc1SC[C@@H](C)C#N 108407711 JDABZYICLCLCDI-IRXDYDNUSA-N 395.572 5.502 30 20 GKED Cc1cccc([C@@H]2CCCN2C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)n1 123180808 KUWWAHUMMYMMCC-QHCPKHFHSA-N 398.466 5.423 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N[C@H]1CCO[C@@H](c2ccccc2)C1 131197785 FALUPMWRVSRKJA-GBXCKJPGSA-N 398.462 5.001 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccncc1 136725842 JESFFGDDZZKQED-CXAGYDPISA-N 381.888 5.229 30 20 GKED CC[C@H](NCc1cccc(OCCCC#N)c1)c1nc(C(F)(F)F)cs1 174137534 SUXRWKBKPYGDOE-HNNXBMFYSA-N 383.439 5.085 30 20 GKED Cc1occc1-c1nnc(SCCCC(C)(C)C#N)n1Cc1ccccc1 177187610 UBYQULAAJFOEOE-UHFFFAOYSA-N 380.517 5.317 30 20 GKED Cc1csc([C@H](C#N)C(=O)c2nc(-c3ccc(Cl)c(Cl)c3)oc2C)n1 181489244 BYFQYZCJNCVOQV-LLVKDONJSA-N 392.267 5.212 30 20 GKED CC(C)OCCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 182047195 OYFRAKWZDCEJTB-FQEVSTJZSA-N 399.922 5.322 30 20 GKED C=C(C)[C@@H](NCc1ccc(OC)c(OCCCC#N)c1)c1ccc(F)c(F)c1 187371625 BTMXMVCEUCUUGF-JOCHJYFZSA-N 386.442 5.063 30 20 GKED C=CCOc1ccc(CNCCCc2nc(-c3ccncc3)cs2)cc1Cl 237819455 WKKNNMHYCOBQAJ-UHFFFAOYSA-N 399.947 5.146 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)N[C@H](CCC#N)c2ccccc2)C2CC2)o1 246948357 ULWAYDCVVYMHHY-TYCQWZJGSA-N 377.488 5.122 30 20 GKED C=CCOc1c(Br)cc(CN[C@@H](C)c2ccc(C)cc2)cc1OC 302979384 UUTWBQLGCMFUSC-HNNXBMFYSA-N 390.321 5.182 30 20 GKED O/C(=N/Cc1ccc(C/N=C(/O)[C@@H]2CCCCS2)cc1)[C@@H]1CCCCS1 329344188 UESWUTYHIHGXFM-ROUUACIJSA-N 392.590 5.171 30 20 GKED CC(C)c1nc([C@@H]2CCCCN2CC(O)=Nc2c(Cl)cccc2Cl)n[nH]1 329808942 BXIHAWXMWKIPHH-AWEZNQCLSA-N 396.322 5.050 30 20 GKED C[C@H](Cc1c(Cl)cccc1Cl)/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1 330015811 OPEGICGCNQGNKW-LRVUVFPRSA-N 397.346 5.806 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1 429200358 BVXZGKUXKCIBEN-UHFFFAOYSA-N 391.515 5.426 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@@H](C)C[C@@H]1c1ccccc1F 437844871 IYZHIIDUDMHROF-MGPUTAFESA-N 381.451 5.100 30 20 GKED Cc1ccc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(OC(C)C)c1 447059205 KSGPIPRNBSNEMG-KRWDZBQOSA-N 397.544 5.498 30 20 GKED N#CC[C@H](Cc1nc(CSCc2ccc(Cl)cc2)no1)c1ccccc1 453261198 YTIBLBFYCQDTLQ-QGZVFWFLSA-N 383.904 5.396 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F)c1ccccc1 455302573 MNGGZDASMOFHBL-ZWKOTPCHSA-N 393.384 5.005 30 20 GKED C[C@H]1CN(C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)CC[C@H]1c1ccccc1 460644772 XVHCMOAMFOVAHR-FDDCHVKYSA-N 397.478 5.011 30 20 GKED N#C[C@H]1CCC[C@@H](NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 463296719 FYZGZMNYNDFWCG-GOEBONIOSA-N 375.394 5.065 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 464160538 QBUMTWLMRUQRKT-OAQYLSRUSA-N 398.553 5.845 30 20 GKED N#CCCN(C(=O)c1nc2ccccc2cc1Cl)C12CC3CC(CC(C3)C1)C2 464353627 GVNGBINJBLCSMS-UHFFFAOYSA-N 393.918 5.213 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H](c3cccs3)C3CCCC3)ccc21 469276474 VCHNHIWUWRYXNW-QHCPKHFHSA-N 393.556 5.674 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1cc(F)cc(F)c1 469852479 LCODWLDRSJPRFK-UHFFFAOYSA-N 393.393 5.293 30 20 GKED C[C@H]1[C@H](C(F)(F)F)CCN1C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 471285015 CEIRHXWUUXDFQK-SCLBCKFNSA-N 389.377 5.155 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)[C@H]1CCn2c(cnc2C2CCCCC2)C1 473370399 ZZFYLXPPTMBBNK-QFIPXVFZSA-N 391.559 5.098 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCSC[C@@H]1c1ccccc1 475549216 NXLRFIGUAIVOAY-OAQYLSRUSA-N 380.557 5.861 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CCN(C)C)Cc1cccc(C)c1 475578862 RBPXDDNWRGEZQA-UHFFFAOYSA-N 393.575 5.443 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccc1 475639189 BTUMRNKXCKLDHU-FQEVSTJZSA-N 381.435 5.377 30 20 GKED CC1CCC(N(C)C(=O)Nc2ccc(OCc3cccc(C#N)c3)c(F)c2)CC1 481684030 LPKIXGUHWFSHID-UHFFFAOYSA-N 395.478 5.319 30 20 GKED N#Cc1ccc(SCC(=O)N(Cc2ccccc2)Cc2ccc(F)cc2)cc1 486138056 YIOVYSGNCSSQIP-UHFFFAOYSA-N 390.483 5.018 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2cnn(C(C)(C)C)c2-c2ccccc2)cc1 488385045 IKINZFGFHJCSEL-UHFFFAOYSA-N 386.499 5.359 30 20 GKED C=CCC[C@H](C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C)c1ccccc1 488717141 KLHGDMOQEFKFGW-QHCPKHFHSA-N 398.506 5.936 30 20 GKED C[C@@H](NCc1cc(C#N)ccc1Br)c1ccc(C(F)(F)F)cc1 492608531 PUXYKOQZRABLNV-LLVKDONJSA-N 383.211 5.190 30 20 GKED C=CCN(CCc1ccco1)C(=O)c1cccc(-c2ccccc2OCC)c1 496649023 HMOPYVRCYNDIDJ-UHFFFAOYSA-N 375.468 5.216 30 20 GKED Cc1cc(C)c(NC(=O)CSc2ccc(C#N)c(C(F)(F)F)c2)c(Cl)c1 499474325 XGNBICGMJVUTGR-UHFFFAOYSA-N 398.837 5.578 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)c3ccc4ccccc4c3)c2)cc1 501455199 WUCHGJYHMRVIMC-UHFFFAOYSA-N 392.458 5.737 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1cccnc1)Cc1ccccc1C 505001431 SZGBQJPGHKMFIM-UHFFFAOYSA-N 385.511 5.743 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC(C)(C)COCc1ccccc1 505338362 FNWNHFKJBQUWRZ-KRWDZBQOSA-N 397.544 5.198 30 20 GKED CC(C)Sc1ccccc1C(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1 505949603 VKOZWYWNZMWZTK-INIZCTEOSA-N 379.312 5.489 30 20 GKED CC1(C#N)CCN(C(=O)c2c(Cl)cccc2Oc2ccccc2Cl)CC1 507837483 LJLLBNIMMZPLGY-UHFFFAOYSA-N 389.282 5.552 30 20 GKED CCCN(CC)Cc1ccc(C(=O)N(CC)[C@H](C)c2ccc(C#N)cc2)cc1 509239668 LGZNHLRNWQAZSZ-LJQANCHMSA-N 377.532 5.013 30 20 GKED Cc1sc(CNc2ncc(C#N)cc2Cl)nc1-c1ccc(Cl)cc1 513634956 IBTLLTBNOZRCDE-UHFFFAOYSA-N 375.284 5.304 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)cc1OCCC 513661636 UGWALNFEYYIWAP-MRXNPFEDSA-N 394.496 5.364 30 20 GKED C[C@@H](NCc1ccc(Br)cc1C(F)(F)F)c1cccc(C#N)c1 514806133 AIEABXFOXZCBRT-LLVKDONJSA-N 383.211 5.190 30 20 GKED CCc1nc(C)c(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)s1 518150516 CVFLDHWTPBZLAM-UHFFFAOYSA-N 399.463 5.291 30 20 GKED C=CCN(C(=O)[C@@H]1CCOC1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 519069585 JTLGISLWNUXSFM-HXUWFJFHSA-N 390.508 5.033 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)c1ccc(C#N)cc1 519888978 PZYGUZMZCMMVLN-KBPBESRZSA-N 375.394 5.041 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 520941500 PQGUROOEEYWGNL-OAHLLOKOSA-N 389.480 5.563 30 20 GKED Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N(C[C@@H](C)C#N)C1CC1 533599305 OTRKIAMKOOYVHL-FUHWJXTLSA-N 377.488 5.291 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(OCc4ccccc4F)cc3)cc2)CC1 537430410 JIWRINKNJWZCKE-UHFFFAOYSA-N 386.426 5.212 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)c(F)c1 538508576 TVLAUEIMRMHCKL-STQMWFEESA-N 383.467 5.680 30 20 GKED CN(C(=O)c1ccc(C#N)s1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 540632193 FWVNIIOFEHHQMT-JKSUJKDBSA-N 378.419 5.047 30 20 GKED C[C@H](NC(=O)[C@H](C)n1cnc2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 541133115 QQOCEKJBFDUMQA-ROUUACIJSA-N 394.478 5.013 30 20 GKED C[C@H](N[C@H](C)c1ncc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 543861581 RLDRZWQMAHMZDQ-RBUKOAKNSA-N 393.490 6.292 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543863112 JFPACYGHQOXOAJ-PMACEKPBSA-N 397.522 5.520 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 544893189 XKWQONANUCWHHF-ZDUSSCGKSA-N 395.356 5.342 30 20 GKED N#Cc1ccc(Oc2ccc(-c3nc(-c4cccc5cnccc45)no3)cc2)nc1 545792877 ALYOZFOENSJCGG-UHFFFAOYSA-N 391.390 5.011 30 20 GKED Cc1cccn2c(NC(=O)c3ccc(C#N)c(Cl)c3)c(-c3ccccc3)nc12 548607667 RWSOZMONVUEDDU-UHFFFAOYSA-N 386.842 5.087 30 20 GKED N#Cc1ccc(N2CCC(N[C@H]3C[C@H](c4ccc(C(F)(F)F)cc4)C3)CC2)cc1 552264937 BNGYVKVQAOVPPX-XGAFWQRZSA-N 399.460 5.082 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)c1cccc(-c2csc(C)n2)c1 553450854 OWLNZEIZZHROBE-UHFFFAOYSA-N 394.544 5.114 30 20 GKED N#Cc1ccc(CN(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)s1 554883086 URUXJUDBOFNUDI-UHFFFAOYSA-N 388.323 5.524 30 20 GKED N#Cc1cc(C(=O)Nc2ccccc2Oc2ccccc2)cnc1C(F)(F)F 555118924 XYCPSRHYBWSSOT-UHFFFAOYSA-N 383.329 5.017 30 20 GKED C[C@@H](N[C@H](CCO)c1ccc(Cl)c(Cl)c1)c1ccc(C#N)cc1Cl 560584782 JQXNKHUJZJIGGH-ADLMAVQZSA-N 383.706 5.293 30 20 GKED Cc1nn(C(C)C)cc1C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 578665956 UFJXPDBUTJNIDA-OAHLLOKOSA-N 384.892 5.039 30 20 GKED CCNc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccncc2)c(Cl)c1 586797051 IDQDVOSYXGCBCI-UHFFFAOYSA-N 392.846 5.083 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@@H](C)Cc1ccc(C#N)cc1 593967265 PHYKCYNBZPHZHR-HOTGVXAUSA-N 389.524 5.046 30 20 GKED C=CCCCN(C)C(=O)c1cc2c(C)nn(Cc3ccc(Cl)cc3)c2s1 605645005 KNQSSRYJTZAYBW-UHFFFAOYSA-N 387.936 5.146 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2ccc3ccccc3n2)cc2cc(C(F)(F)F)ccc21 608552778 LSDVIOQTFHOWBB-INIZCTEOSA-N 393.368 5.235 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(F)c(F)c(F)c3F)c2)cc1 609176476 JEQXSWSNIAEGAN-UHFFFAOYSA-N 386.304 5.159 30 20 GKED N#Cc1ccc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)cc1 609177884 WUDFWGSXKFQSAI-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCN(C(=O)CCc1ccc(C#N)cc1)[C@H](c1ccccc1)c1ccc(F)cc1 609304670 NCLQNKFJKMQFIK-RUZDIDTESA-N 386.470 5.268 30 20 GKED COc1ccc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c(Cl)c1 609372428 VUGABXVRMZWYHL-UHFFFAOYSA-N 378.815 5.265 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 609566712 GERQKXCGJWLHOE-JOCHJYFZSA-N 398.506 5.539 30 20 GKED Fc1cccc(-c2nc(CN3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)co2)c1 618453432 UPLNRFZDALXIJI-TXEJJXNPSA-N 396.306 5.043 30 20 GKED Cc1ccc(-c2cnc(-c3ccccc3C(=O)NCC#Cc3ccccc3)o2)cc1 642019989 WRMOOYZUDISYSY-UHFFFAOYSA-N 392.458 5.099 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(COc2ccccc2)c1 727224483 IMHGRENLWZCDMH-UHFFFAOYSA-N 399.494 5.580 30 20 GKED Fc1ccc(-c2nc3c(s2)C(=NNc2nncc4ccccc24)CCC3)cc1 727683247 DNRGLPKIOCGHRO-UHFFFAOYSA-N 389.459 5.045 30 20 GKED Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)COc1cccc(C#N)c1 728013088 WGMWPNDAYPKOJQ-SFHVURJKSA-N 386.451 5.024 30 20 GKED C#Cc1ccc(C(=O)N(Cc2ccc(Cl)cc2)[C@@H](C)Cc2cccs2)nc1 728803591 JNPMFMIRQRABIT-INIZCTEOSA-N 394.927 5.051 30 20 GKED COCCOc1ccc(/C=C\C(=O)c2sc(-c3ccccc3F)nc2C)cc1 730464519 FAKJCYRPMYCBRX-XFXZXTDPSA-N 397.471 5.179 30 20 GKED CCn1cc(C(=O)/C=C/c2cn(C(C)(C)C)nc2-c2ccccc2Cl)cn1 731158783 IUYOYSFBMSQIHP-ZHACJKMWSA-N 382.895 5.071 30 20 GKED CCCN(CCc1cccc(F)c1)C(=S)Nc1ccc(C#N)c(Cl)c1 733212198 LDYKVSVWBCXGCL-UHFFFAOYSA-N 375.900 5.002 30 20 GKED O=C(/C=C/c1ccccc1OCc1ccccn1)c1ccc(SC(F)F)cc1 734980917 MSMQQIXYYQCXCW-JLHYYAGUSA-N 397.446 5.871 30 20 GKED N#CCOc1ccc(Cl)cc1COc1ccc(C(=O)c2ccccc2)cc1 735231626 WRSOBCZDDORFOJ-UHFFFAOYSA-N 377.827 5.052 30 20 GKED C[C@@H](C(=O)OCCC(C#N)(c1ccccc1)c1ccccc1)c1ccsc1 738831021 NZKGNYSEQRQFEK-GOSISDBHSA-N 375.493 5.295 30 20 GKED CC(C)(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccc(F)cc1 739596165 SYNWPTLYAVCNPC-UHFFFAOYSA-N 378.472 5.020 30 20 GKED CCN(CCc1cccs1)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740484532 NUTVVZMZHBTHGE-UHFFFAOYSA-N 395.553 5.122 30 20 GKED C[C@H](NC(=S)N[C@H](C)c1cccc(C#N)c1)c1ccc(Cl)cc1Cl 743059189 BHYZBRMUHQCUMN-NEPJUHHUSA-N 378.328 5.151 30 20 GKED C[C@H](CCc1ccccc1F)C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 744035281 LGAHSXIHCSHTNA-IUODEOHRSA-N 386.879 5.534 30 20 GKED CC(=NNc1ccc(C(F)(F)F)nn1)c1sc(-c2ccc(C)cc2)nc1C 754709919 PJLZOUCDZXEJFV-UHFFFAOYSA-N 391.422 5.072 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)/C=C\c1ccnc(Cl)c1 757933404 LQBUSXOIEHVSTM-WTKPLQERSA-N 389.842 5.359 30 20 GKED CC(Cn1nc(C)cc1C)=NO[C@@H](C)c1nc(C)c(-c2ccc(Cl)cc2)o1 763180155 PPBSUBSOTCOHPA-INIZCTEOSA-N 386.883 5.270 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@@H](CC)c2cccc(Br)c2)c1 772984211 NQMXYHNZCFKIGS-ICSRJNTNSA-N 387.321 5.371 30 20 GKED CC[C@H](Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)c1ccc(C#N)cc1 774302145 LBPNNVARVKPQOE-FQEVSTJZSA-N 377.488 5.419 30 20 GKED C[C@@H](C#N)Oc1ccc(CNCc2nc(-c3cc4ccccc4o3)cs2)cc1 775320976 JVZKACLICZMKGE-HNNXBMFYSA-N 389.480 5.137 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)Nc2cc(C#N)cc([N+](=O)[O-])c2Cl)c1C 782545743 XDDCYNZMAZTCJP-UHFFFAOYSA-N 395.802 5.249 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1nccc2ccccc12 792102859 JWUOUQDAQYFKHA-FHWLQOOXSA-N 381.262 5.522 30 20 GKED Cc1cc(NC(=O)c2c(Cl)cc(C#N)cc2Cl)ccc1-c1ccccc1 792825601 OAQPFDZFIRLLKS-UHFFFAOYSA-N 381.262 6.093 30 20 GKED N#CC[C@H](CC(=O)OCc1csc(CCc2ccccc2)n1)c1ccccc1 795990211 JQFMNBKLHXBJSY-HXUWFJFHSA-N 390.508 5.059 30 20 GKED C[C@H](OC(=O)[C@H]1C[C@@H]1C(F)F)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 801478154 GKVNBAMMIXROKJ-CYUDJLOBSA-N 376.243 5.230 30 20 GKED FC(F)(F)c1ccc2sc(NN=C3CCCC[C@H]3[C@H]3CCOC3)nc2c1 814860132 LMNTWFPWMPTVET-AAEUAGOBSA-N 383.439 5.310 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC[C@@]1(C)CC1(Cl)Cl 836387666 CKYIMSPEMQSVOJ-LRDDRELGSA-N 386.348 5.176 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1ccc(Cl)cc1 836497818 XFGFPLKKLSEWJY-HNAYVOBHSA-N 383.879 5.390 30 20 GKED C[C@H]1C[C@@H](C)Cc2c1sc(NC(=O)c1cc(F)c(Cl)nc1Cl)c2C#N 839389787 SRZHCCAUOMXAKE-SFYZADRCSA-N 398.290 5.399 30 20 GKED CC(C)(Oc1ccc(C#N)cc1)c1nc(-c2ccc(C(F)(F)F)s2)no1 904964334 IURCHPGVIBQEJR-UHFFFAOYSA-N 379.363 5.003 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(SC3CCCC3)cc2)cc(OC)c1O 914703685 WWICLNPMYGCYDT-GHXNOFRVSA-N 384.497 5.340 30 20 GKED Cc1ccc([C@H](NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C2CC2)cc1 915350347 UFTKGNLZVRDLTA-DQEYMECFSA-N 395.506 5.923 30 20 GKED CC(=NNc1ccnc2cc(Cl)ccc12)c1cc(C(=O)O)ccc1OC(C)C 1776011727 JAUDHKQGGPCDCT-UHFFFAOYSA-N 397.862 5.210 30 20 GKED CC(C)Sc1cc(Br)ccc1C=NNc1ccccc1C(=O)O 1776030347 POVYCUBZOXAFOV-UHFFFAOYSA-N 393.306 5.094 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C/c2ccc(-c3ccc(O)c(C(=O)O)c3)o2)cc1 1776120064 UTBYKAVJQNSOEY-FMIVXFBMSA-N 390.435 5.544 30 20 GKED O=C(/C=C\c1ccc(-c2ccccc2C(=O)O)cc1)c1ccccc1OC(F)F 1776120216 YPKNWZDLHJNZJN-KAMYIIQDSA-N 394.373 5.549 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2Cl)o1 1776782941 QJLFOMFNHKNOKM-INIZCTEOSA-N 377.912 5.893 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccoc3C)cc2)CCC1 1787364314 XRHXTBJGUWTQCL-UHFFFAOYSA-N 394.515 5.328 30 20 GKED CCc1cc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)sc1C 60488343 DJXRFYKLCLNMQY-HNNXBMFYSA-N 386.929 5.886 30 20 GKED CCc1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)s1 65067592 XMDTYHIBINSGFN-UHFFFAOYSA-N 383.860 5.275 30 20 GKED C[C@H](CC#N)Sc1ccccc1NCC(=O)Nc1cc(Cl)ccc1Cl 66861394 DTNIBSUNVVFKIY-GFCCVEGCSA-N 394.327 5.438 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccccc2F)C1 66953791 RMEBYVJOXOJXBL-HOTGVXAUSA-N 383.492 5.241 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1C)[C@@H](c1ccc(Cl)cc1)c1ccccn1 122733845 CGSRZRVMEQUQIT-QFIPXVFZSA-N 389.886 5.167 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CCCC[C@@H](C)C(C)=O)cc1 151400238 PXSAKOFVCDJLOB-MRXNPFEDSA-N 394.471 5.083 30 20 GKED C=C[C@H](CC(=O)N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 156085456 JACJXDWJOGHGBA-VQTJNVASSA-N 386.495 5.198 30 20 GKED C=C[C@@H](CC(=O)N(c1ccc(F)c(Cl)c1)c1nccs1)c1ccccc1 163861830 LHZGNEUUWJNEHA-AWEZNQCLSA-N 386.879 5.960 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N(Cc1ccco1)Cc1cccs1 171138801 DRLUDXDPXFFRPT-UHFFFAOYSA-N 382.489 5.004 30 20 GKED C=C(C)COc1cccc(NC(=O)N[C@H](c2ccccc2)c2nccs2)c1 171401368 GJNCLQLKBJURBV-LJQANCHMSA-N 379.485 5.009 30 20 GKED C[C@@H](NCc1ccc(-c2nc3ccccc3s2)o1)c1ccc(OCC#N)cc1 171768555 UILNDHBUGONBPX-OAHLLOKOSA-N 389.480 5.309 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)c1ccncc1Cl 174300809 PKVDWGBFMCZBLH-UHFFFAOYSA-N 385.798 5.012 30 20 GKED N#CCSc1cccc(C(=O)Nc2sc(-c3ccccc3)cc2C#N)c1 175647405 VKHMFMFNLJFAFV-UHFFFAOYSA-N 375.478 5.155 30 20 GKED Cc1cccc(C2=CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)CC2)c1 179382992 BMORYWVAOZIEJU-GOSISDBHSA-N 391.540 5.711 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1occc1CSc1ccccc1 182063418 MAYXVGZPAQCMQG-HNNXBMFYSA-N 378.453 5.115 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](c2ccc(C)cc2)C2CCC2)ccc1OC 187338294 DAWNUJBSJFWQFA-URXFXBBRSA-N 378.516 5.316 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3cccc(F)c3C)o2)c1 236899093 UGIMZIRLUHDNPY-GOSISDBHSA-N 378.447 5.365 30 20 GKED C[C@@H](NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)c1ccc(F)c(F)c1 303208428 QMOCVMOAZRLRKK-CQSZACIVSA-N 378.378 5.120 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccccc2OC(F)(F)F)cc1 303888543 PGWDTTIFTOOZJP-IAGOWNOFSA-N 388.389 5.129 30 20 GKED CC(C)n1c([C@H]2CCCN2C(=O)c2ccc(C3(C#N)CC3)cc2)nc2ccccc21 329355475 GSENGYJCCHMEMF-JOCHJYFZSA-N 398.510 5.150 30 20 GKED CC1(C)CCC(c2noc([C@@H]3CCCN(C(O)=Nc4ccccc4)C3)n2)CC1 329370988 AVYRQKQCFUOCRI-QGZVFWFLSA-N 382.508 5.179 30 20 GKED C[C@H](/N=C(/O)[C@H]1CCn2c(cnc2C2CCCCC2)C1)c1cc2ccccc2o1 329415876 CZZSUXWTNNABEA-LPHOPBHVSA-N 391.515 5.957 30 20 GKED OC(=Nc1cccc(-c2ncc3n2CCCC3)c1)N1CCC[C@H]1c1ccsc1 329813196 NHLZQAVQAUDREC-FQEVSTJZSA-N 392.528 5.331 30 20 GKED N#Cc1ccccc1NC(=O)c1ccc(-c2ccc(Br)cc2)s1 409670693 ZFFVAUCQICQKBC-UHFFFAOYSA-N 383.270 5.302 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)c1ccc(C2CC2)cc1 419331708 HFBFGEHUJHDMQW-DLBZAZTESA-N 393.556 5.248 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NC[C@@H]2CCC(F)(F)C2)cc1 435959186 MYGPSQVNHJCIOT-QGZVFWFLSA-N 386.467 5.016 30 20 GKED O=C(NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)Nc1ccc(F)cc1C(F)(F)F 438583475 MUJHIZJJWWSNNC-NXEZZACHSA-N 386.311 5.335 30 20 GKED C[C@H]1CC[C@@H](CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)O1 439111853 NIUJKWRTZORKNN-YOEHRIQHSA-N 384.863 5.290 30 20 GKED N#Cc1cccc(-c2nnc(CN3CCCCC[C@H]3/C=C/c3ccccc3)o2)c1 441048682 SKOPNBWJKFIKQN-TWLJRWAQSA-N 384.483 5.066 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 443115943 OIYDRQBSWGNAQP-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2ccc(C(F)(F)F)cn2)ccc(C(F)(F)F)c1F 443535488 WMXABYGKFKZCFE-LLVKDONJSA-N 390.258 5.057 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)CS[C@@H](C)c2cccc(C#N)c2)cc1 446708676 SEBRGRRVLPRZCB-HTAPYJJXSA-N 394.540 5.115 30 20 GKED O=C(Cc1ccc(NCC#Cc2ccccc2Cl)cc1)Nc1ccccc1F 446989368 DKJIYLXKUQEBEB-UHFFFAOYSA-N 392.861 5.124 30 20 GKED C[C@@H]1CCN(C(=O)c2cscc2C#N)c2cc(C(F)(F)F)ccc2S1 460003077 WCXDCGIQKABLQM-SNVBAGLBSA-N 382.432 5.170 30 20 GKED C[C@H](C(=O)N[C@H](c1ccccc1)c1cc2ccccc2o1)c1cccc(C#N)c1 463242863 PCJBODDMVPMEQH-BXKMTCNYSA-N 380.447 5.314 30 20 GKED N#C[C@H](NC(=O)c1nc2ccccc2cc1Cl)c1c(Cl)cccc1Cl 464398158 NZDGGHJCIKWPAT-HNNXBMFYSA-N 390.657 5.190 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)N3C[C@@H]4CCC[C@H]4C3)cc2Cl)c1 465252669 PNDFCBOKGODRNC-ROUUACIJSA-N 395.890 5.054 30 20 GKED CCOc1ccccc1[C@H](CC)NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 465803804 DPJNBZHBRXOFGA-FDFHNCONSA-N 391.515 5.018 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1 471992505 PAIUJVJJJXYCTL-OAHLLOKOSA-N 397.466 5.401 30 20 GKED Cc1ccc(SC[C@@H](C)NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 473681039 XTGPZEZTPJRWTN-IAGOWNOFSA-N 399.585 5.692 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CCC[C@H](C(F)(F)F)C1 475580491 YVFJEBKSDQMFHS-RDJZCZTQSA-N 382.470 6.029 30 20 GKED N#CC[C@H](CC(=O)N1CCCCC[C@@H]1/C=C/c1cccs1)c1ccccc1 476671585 OOYDOAXDERKTKR-DDVDASKDSA-N 378.541 5.620 30 20 GKED CC(C)(CC(=O)Nc1cccc(OCc2cccc(C#N)c2)c1)C(F)(F)F 479743190 IAJOAAQVCKFISG-UHFFFAOYSA-N 376.378 5.054 30 20 GKED C=C(C)CN(C)C(=O)Nc1ccc(Cl)c(C(=O)N(CC)Cc2ccccc2)c1 481657994 OCSQSFYGASIIFC-UHFFFAOYSA-N 399.922 5.042 30 20 GKED COc1cc(-c2ccccc2)sc1C(=O)[C@@H](C#N)c1nccc2ccccc12 483201442 MXYLJZNJTQSPKL-SFHVURJKSA-N 384.460 5.462 30 20 GKED FC(F)Oc1cccc(CN[C@H](c2ccccc2OC(F)F)C(F)(F)F)c1 491261650 VDVHJHABZDYNOP-CQSZACIVSA-N 397.290 5.283 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1cccc2[nH]ccc12 494752871 VKUNHWRJFVOKLJ-HNNXBMFYSA-N 378.501 5.226 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1c2cccc(F)c2CC[C@H]1C 498887678 CZAHLDLWXMKYQA-VGOFRKELSA-N 398.526 5.014 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc(OCCCC)cc2C)cc1 502634740 NICLOHIKOCPNMH-UHFFFAOYSA-N 396.491 5.125 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)NCC(c2ccccc2)c2ccccc2)cc1 505646974 SQHCLHSJPJGLBU-UHFFFAOYSA-N 383.495 5.441 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(SCc3csc(C)n3)cc2)c1 509112248 QOEDFHWPVKSMCH-UHFFFAOYSA-N 396.537 5.561 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 510676526 YZXYGECQTJCQRT-UHFFFAOYSA-N 383.879 5.197 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Cc1csc(-c2ccc(C)cc2)n1 515873376 OPZIMKYBZURNLE-UHFFFAOYSA-N 380.488 5.015 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1CC1CCCCC1 518255955 KVXZCGALDAWSLZ-MJGOQNOKSA-N 385.577 6.048 30 20 GKED Cc1ccccc1C[C@H](C)NC(=O)c1ccccc1Sc1ccccc1C#N 519114290 JVMCWPHCHBVOMB-SFHVURJKSA-N 386.520 5.379 30 20 GKED Cc1ccnc2sc(C(=O)Nc3ccccc3SC[C@@H](C)C#N)c(C)c12 519422605 ARMCINBHAVPKSL-LBPRGKRZSA-N 381.526 5.417 30 20 GKED C[C@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)C(=O)NC[C@H](C)c1ccccc1 521012610 OWQZNARDGUSEJI-OALUTQOASA-N 399.494 5.071 30 20 GKED N#Cc1c(NC(=O)c2csc(-c3ccccc3Cl)n2)sc2c1CCCC2 524290372 JDZFLHLATXUEHP-UHFFFAOYSA-N 399.928 5.528 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1nc(-c2ccc(C#N)cc2)cs1 525284179 GRURIJYJYOEXOW-UHFFFAOYSA-N 394.525 5.357 30 20 GKED Cc1cccc(NC(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)c1Cl 525822727 RNFLPDARDHKTRB-UHFFFAOYSA-N 380.806 5.704 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C1CCCC1)C1CC1 530599133 QGIQBZCFRJNRAX-UHFFFAOYSA-N 389.499 5.385 30 20 GKED CC(C)C(=O)Nc1ccc(NCc2cccc(OCc3ccccc3C#N)c2)cc1 532890650 MYLHQZBGMWPJEH-UHFFFAOYSA-N 399.494 5.344 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc([C@H]3CCOC3)c2)cc1 534139121 LETFAGCAUAZZIH-FQEVSTJZSA-N 384.435 5.107 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC(F)(c2cccc(Cl)c2)CC1)c1ccccc1 541210474 OWWBUILIDQRVRK-HXUWFJFHSA-N 399.897 5.355 30 20 GKED COc1cc(C#N)ccc1CN[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 543520265 WKIYHDUGSDAKRZ-CYBMUJFWSA-N 397.931 5.503 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1COC(C)(C)CC 543648093 QYAXCJFUDQCSIU-UHFFFAOYSA-N 393.531 5.708 30 20 GKED C[C@H](NC(=O)N(C)[C@@H](C)c1cccc(O)c1)c1ccc(-c2cccc(C#N)c2)cc1 543944203 IUYUWQVNJCIFIZ-ROUUACIJSA-N 399.494 5.394 30 20 GKED CC(C)(C)[C@@](C)(C#N)NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 545919178 HFSYFRVFDPGRTO-MRXNPFEDSA-N 388.842 5.632 30 20 GKED CC[C@@H](CC(F)(F)F)NC(=O)c1ccc(Sc2ccccc2C#N)cc1 546168178 CFRWVEMDCMCQOV-HNNXBMFYSA-N 378.419 5.170 30 20 GKED CCC[C@@]1(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCOC1 554133694 CRVWMDYNSSQTLI-DENIHFKCSA-N 397.906 5.076 30 20 GKED C[C@@H](NC(=O)c1ccc(C(C)(C)C#N)cc1)c1ccc(Oc2cccnc2)cc1 554643489 BMLYAYDVBOYGKX-QGZVFWFLSA-N 385.467 5.166 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2Cc3cccc(Cl)c3C2)cc1 562137862 VKCPSXXEULLKCQ-UHFFFAOYSA-N 389.842 5.552 30 20 GKED CCc1ccc2occ(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)c2c1 573031605 NFMRVDVVTZDDSF-GOSISDBHSA-N 397.459 5.480 30 20 GKED COc1ccccc1[C@H]1C[C@@H](C)CCN1C(=O)Nc1ccc(CC#N)cc1Cl 577471572 IPUFGHYHQKDXMI-MGPUTAFESA-N 397.906 5.420 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)C(CC)(CC)c2ccc(Cl)cc2)cc1 588633082 AKFSCYNVPNYACY-UHFFFAOYSA-N 399.922 5.344 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 596724777 UWWVZAZUGIFZNR-OYRHEFFESA-N 387.483 5.161 30 20 GKED CSc1ccc(Cl)c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 596983561 FSEWRCLJWWDZPJ-LPHOPBHVSA-N 385.920 5.366 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2 602754909 BDRWOYRTPWHLBW-CYBMUJFWSA-N 389.524 5.091 30 20 GKED COc1cccc2cc(C(=O)Nc3cccc(OCc4cccc(C#N)c4)c3)oc12 603638252 FXZJTJKCSDXCLE-UHFFFAOYSA-N 398.418 5.144 30 20 GKED Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)c1 603806805 MMVQVKWEXSZGEJ-ZDUSSCGKSA-N 397.887 5.050 30 20 GKED CC(=O)Nc1c(C)ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)c1C 603934205 QLDZKXPEVCVZJK-UHFFFAOYSA-N 399.494 5.325 30 20 GKED C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1ccccc1C#N 604009941 GUMRGZRGJYMSOK-HZPDHXFCSA-N 381.907 5.227 30 20 GKED Cc1cc(Br)oc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 604457546 RKOYDKZLLBHQMI-UHFFFAOYSA-N 397.228 5.267 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)c3ccc4[nH]c5c(c4c3)CCCCC5)[nH]c12 605362960 BABVYOFKHQTRBA-SFHVURJKSA-N 382.467 5.112 30 20 GKED N#CCCSc1ccccc1NC(=O)c1cc(Br)ccc1Cl 609375270 AJBFWUWQSCYQNB-UHFFFAOYSA-N 395.709 5.361 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H]1CCCc2ccccc21 609399233 JDHUIJMCCMLQPW-OXJNMPFZSA-N 379.529 5.480 30 20 GKED N#Cc1cccc(CNC(=O)Nc2cccc(OCc3ccc(Cl)cc3)c2)c1 609555826 PCURYFVPQSYTDK-UHFFFAOYSA-N 391.858 5.112 30 20 GKED Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)Nc2cc(C#N)ccc2OC(C)C)C1 610016243 KDDJFLVLTLLHKQ-MJGOQNOKSA-N 377.488 5.064 30 20 GKED C[C@@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)Cc1cccs1 610191135 HTBPYOGKGDDBRL-MRXNPFEDSA-N 392.549 5.380 30 20 GKED Cc1noc(C)c1N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 610743001 RGAKZPHFIGYUCG-UHFFFAOYSA-N 396.834 5.277 30 20 GKED Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)[C@H](C#N)c2ccccn2)cc1C 613296631 PUULOZAVIWWOLU-OAQYLSRUSA-N 392.462 5.041 30 20 GKED CC(C)(C)OCc1ccc(NC(=O)c2cn(CCCC#N)c3ccccc23)cc1 618220140 FJHNCHCQKSAKQI-UHFFFAOYSA-N 389.499 5.512 30 20 GKED C[C@@H](c1ccc(C(=O)N[C@H](c2cc(F)ccc2F)C(F)F)cc1)C(F)(F)F 622566705 WATRRGYQHXDSFE-BJOHPYRUSA-N 393.302 5.367 30 20 GKED CC[C@H](C)c1ccccc1OCC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730416474 DDRATZUVGXPPTQ-XJKSGUPXSA-N 382.460 5.204 30 20 GKED Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)/C=C\c1ccccc1C#N 730505170 ZRNDAZFKFWQQAE-PFONDFGASA-N 384.483 5.002 30 20 GKED N#CCCSc1ccccc1NC(=O)COc1ccc(-c2ccccc2)cc1 730982991 YFJPDZLVOCSLMU-UHFFFAOYSA-N 388.492 5.377 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3cccc(F)c3C)o2)cc1NC(C)=O 734304844 YDEUYXUUTZONBW-NTMALXAHSA-N 393.414 5.257 30 20 GKED Cc1nn(C(C)C)c(C)c1C(=O)/C=C\c1ccc(Br)cc1Cl 742433114 PPXGPJIBDKOZDT-VURMDHGXSA-N 381.701 5.393 30 20 GKED C[C@]1(c2ccccc2)C[C@@H]1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 743093855 YTYSHLQBMCGERW-GIFXNVAJSA-N 381.479 5.194 30 20 GKED N#C[C@H](C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1ccc2ccccc2n1 744015364 OYAHOGUDUPGIAO-BZSNNMDCSA-N 381.262 5.522 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2cc3c4ccccc4n(C)c3s2)n1 747197520 GQCKSCNJIDGWAN-CQSZACIVSA-N 379.510 5.463 30 20 GKED N#CC1CCN(C(=O)c2ccccc2Nc2ccc(SC(F)F)cc2)CC1 747198733 AGUUWGASDDCBDL-UHFFFAOYSA-N 387.455 5.121 30 20 GKED C[C@H](OC(=O)c1ccc(C#N)s1)c1ncc(-c2ccc(Cl)cc2Cl)o1 753378524 DEVBICGDEKCUHP-VIFPVBQESA-N 393.251 5.500 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1 756242583 HBOVBDMIGNGYRU-FOIQADDNSA-N 385.492 5.685 30 20 GKED N#Cc1cc(F)ccc1COC(=O)c1sc(-c2ccccc2)nc1C(F)F 761624695 GQWNFDVKDJZULX-UHFFFAOYSA-N 388.370 5.115 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)Nc2ccccc2O[C@@H](C)C#N)c(C)c1 780535724 XGEKOIDOUZPWNY-HOTGVXAUSA-N 383.517 5.821 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)C3(Cc4ccc(F)cc4)CC3)n2)cc1 783075665 DHYBDAMQPJHJHN-IBGZPJMESA-N 390.483 5.457 30 20 GKED C#Cc1cccc(NC(=S)N(C)C[C@@H](C)Oc2ccc(Cl)c(Cl)c2)c1 787200796 ZDIFNHDYFYLGIE-CYBMUJFWSA-N 393.339 5.071 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](C)CC(=O)OCc1ccccc1 789449722 JRCRQQNGSMBIRI-GOSISDBHSA-N 394.515 5.182 30 20 GKED N#CC1(CCCOC(=O)c2cc3sc4ccccc4c3s2)CCOCC1 800103116 PLTXBFQOAFRWKI-UHFFFAOYSA-N 385.510 5.373 30 20 GKED COc1cc([C@H](C)Nc2nc(Cl)c(C#N)s2)ccc1OC1CCCC1 804351918 LORLWCLZNAKQBB-NSHDSACASA-N 377.897 5.171 30 20 GKED COc1cccc([C@H](C)CCCC(=O)[C@H](C#N)c2cc(C(F)(F)F)ccn2)c1 813212666 FNYWTZVRXZXNJG-RDTXWAMCSA-N 390.405 5.259 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@@H]2CCCc3ccc(SC)cc32)ccc1OC 842852089 JRCQJUYBSMVXGA-GHTZIAJQSA-N 396.556 5.265 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2ccc(C(F)(F)F)cc2)cc1 915043928 FALRTPCMWFFIQR-LFYBBSHMSA-N 376.378 5.131 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3c(F)cccc3s2)cc1 915088038 ZLBKDBKABNDYNV-LJQANCHMSA-N 386.451 5.948 30 20 GKED Sc1nnc(-c2ccccc2)n1N=Cc1c(-c2ccccc2)[nH]c2ccccc12 916592184 ADGPTMQRLFHFJB-UHFFFAOYSA-N 395.491 5.264 30 20 GKED CCCCCCOc1ccc(C=NNc2cccc(C(=O)O)c2C)cc1OC 1776086538 ZYMQYZNCSXLQIO-UHFFFAOYSA-N 384.476 5.107 30 20 GKED CC(C)(C)c1ccc(C(=O)/C=C\c2cc(Br)cc(C(=O)O)c2)cc1 1776119746 KOYIBHCDQSEPTH-WTKPLQERSA-N 387.273 5.341 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccc(Cl)cc2)cc1 1776783021 VVTVEDSCQZHMIH-QFIPXVFZSA-N 387.951 6.300 30 20 GKED CCCCCCCOc1ccc(CN[C@H](C)c2ncc(C(=O)O)s2)cc1 1776788268 VIRANNBQPJCJJY-OAHLLOKOSA-N 376.522 5.041 30 20 GKED CCc1ccc(C(=O)/C=C/c2cccc(OCc3ccccc3C(=O)O)c2)s1 1776965941 IPKJYKYLVAXOHV-ZRDIBKRKSA-N 392.476 5.484 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4ccc(F)cc4C3=O)s2)c1 1777684377 YKMGYBUIPQYBMV-RVDMUPIBSA-N 378.424 5.465 30 20 GKED CCc1ccc(N/C(S)=C(/C(=O)c2ccccc2)[n+]2ccccc2CC)cc1 10173456 DPUYOLBWFGKNHN-UHFFFAOYSA-O 389.544 5.150 30 20 GKED C=CCn1c(SCc2cc(C#N)ccc2F)nnc1-c1ccc(Cl)cc1 10240422 RPPJXFOOXVHCOL-UHFFFAOYSA-N 384.867 5.088 30 20 GKED CC(C)(C#N)c1ccc(N[C@H](C(=O)c2c[nH]c3ccccc23)c2ccccc2)cc1 28373793 OCHUROSTSOOWDM-DEOSSOPVSA-N 393.490 6.005 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2ccc(OC3CCCC3)cc2)c1C#N 29377157 AKRUABKBPYOCTB-UHFFFAOYSA-N 393.512 5.126 30 20 GKED CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/C(=O)c2ccc(C)c(C)c2)cs1 54895796 RRSXTJAFNZHMDP-DHZHZOJOSA-N 394.471 5.480 30 20 GKED C=CCn1c(SCc2ccc(C(F)(F)F)cc2)nnc1-c1ccoc1C 57564482 PANRMGDIDNQYCT-UHFFFAOYSA-N 379.407 5.344 30 20 GKED N#C[C@@H](C(=O)c1cc2c(s1)CCC2)c1nc(-c2c(F)cccc2F)cs1 64714428 ZEPJFYGOJNFKRR-NSHDSACASA-N 386.448 5.129 30 20 GKED C=CCN(C(=O)[C@@H](C)Cc1cccc(F)c1)c1nc(-c2ccccc2)cs1 66015187 FFNGLBQKCCXTPD-INIZCTEOSA-N 380.488 5.347 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(C(F)(F)F)cc2)nnc1-c1ccco1 97545503 AXAGCGNRSVZEHJ-GFCCVEGCSA-N 379.407 5.596 30 20 GKED C[C@H](CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1)c1cccc(F)c1 116594580 BOIQDQJOBLAVEB-AUUYWEPGSA-N 389.455 5.191 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)[C@H](C#N)c1nc2ccccc2[nH]1 124748069 HXQCDXNSQWLLPC-JTQLQIEISA-N 398.900 5.200 30 20 GKED N#CCCn1cc(CNc2ccc(-c3nccs3)cc2)c(-c2ccccc2)n1 156173900 OPBMOWVLONWRIO-UHFFFAOYSA-N 385.496 5.199 30 20 GKED C[C@@H](c1ccccc1Cl)N(CC(=O)Nc1ccccc1SCC#N)C1CC1 173224837 IXPRBMIPXUTCDI-HNNXBMFYSA-N 399.947 5.120 30 20 GKED N#CCC[C@@H](NC(=O)c1cc(-c2ccccn2)ccc1Cl)c1ccccc1 179192315 JBPNIZFHKNFKQS-OAQYLSRUSA-N 375.859 5.177 30 20 GKED N#Cc1cc(Cl)ccc1CNc1ccccc1NC(=O)Cc1cccs1 184444902 NIHBVLGXFMYBJA-UHFFFAOYSA-N 381.888 5.066 30 20 GKED C[C@H]1C[C@@H](c2cccnc2)N(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 184633793 AOQHEOAFKHQREP-SBUREZEXSA-N 398.466 5.361 30 20 GKED C=C(C)[C@@H](NCc1ccc(SC(=O)N(C)C)cc1)c1ccc(F)c(F)c1 187777771 UGECMZOPVDGECA-LJQANCHMSA-N 376.472 5.146 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](C)c1cc(F)c(Cl)cc1Cl 195618261 HWMQCSWCMGYVGT-LLVKDONJSA-N 387.307 5.653 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)NCC#Cc1cccc(C(F)(F)F)c1 195632850 VGGZIDHNNCPZMW-UHFFFAOYSA-N 396.412 5.052 30 20 GKED Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)Nc2ccccc2S[C@H](C)CC#N)C1 247435495 XCTQTJPUUBANGN-GUDVDZBRSA-N 393.556 5.799 30 20 GKED COc1ccc(Cl)cc1NC(=O)c1cccc(COc2ccc(C#N)cc2)c1 303571330 BOHDGYUQPRTBNM-UHFFFAOYSA-N 392.842 5.052 30 20 GKED OC1=NC2(CCC2)[C@H](/N=C(/O)C2(c3ccc(Cl)c(Cl)c3)CCC2)CC1 328755223 SRXVPKJWMXJDNI-OAHLLOKOSA-N 381.303 5.413 30 20 GKED OC1=N[C@H](C/C(O)=N/[C@H](c2ccc(Br)cc2)C2CCC2)CCC1 329321153 GQOMZHCMOHUUHL-YJBOKZPZSA-N 379.298 5.146 30 20 GKED O/C(CCc1nc2ccccc2s1)=N/[C@H]1CCCc2cn(C3CCCC3)nc21 329484388 FPERZDMWTVOGLE-SFHVURJKSA-N 394.544 5.575 30 20 GKED C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)c1ccc(OC(F)(F)F)cc1 410245602 CXRVWPAWTAMVHL-ZDUSSCGKSA-N 391.393 5.269 30 20 GKED C[C@@H]1c2c(sc(NC(=O)c3cnc(-c4ccncc4)s3)c2C#N)CC[C@H]1C 410988905 TWPSDBQSHRQPNE-NEPJUHHUSA-N 394.525 5.076 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(C)(C)C(F)(F)F)cc1 429684929 UTTQKIAFMCLFHL-UHFFFAOYSA-N 382.451 5.808 30 20 GKED C[C@@H](CCNC(=O)c1cccc(SCC#N)c1)c1cccc(C(F)(F)F)c1 430627559 MHCDGBAAMYDLOS-AWEZNQCLSA-N 392.446 5.245 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)Cc1occc1C 432846524 OQSKZTQKLOUQGT-UHFFFAOYSA-N 389.455 5.011 30 20 GKED N#C[C@H](NC(=O)c1c(Cl)cc(F)cc1Cl)c1cccc(C(F)(F)F)c1 432991442 JYDLJGOXBXDBMD-ZDUSSCGKSA-N 391.151 5.146 30 20 GKED N#CC1CCC(CNC(=O)Nc2cccc(Cl)c2SCC(F)F)CC1 441679808 GIJKIXNYIHASTO-UHFFFAOYSA-N 387.883 5.149 30 20 GKED CCC1(CC)CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)C1 446828773 YXYRJJQFYBCLPI-UHFFFAOYSA-N 391.515 5.376 30 20 GKED N#CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccccc1 452139495 NSWKTPHNRDSQRR-XUVXKRRUSA-N 397.316 5.104 30 20 GKED C[C@H]1C[C@@H](CC(F)(F)F)[C@@H](C)N1C(=O)Nc1ccccc1SC[C@H](C)C#N 454762995 YFJVAYQKUSZNCQ-BARDWOONSA-N 399.482 5.522 30 20 GKED N#CCCC[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Br)c1)c1ccccc1 456041432 BDHUVFJRHAKKNZ-XUVXKRRUSA-N 397.316 5.104 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](c1cccs1)C(C)(C)CO 459521400 HJFYRSLVGVUPTN-FQEVSTJZSA-N 386.561 5.481 30 20 GKED Cc1ccc(-c2nc3ccc(F)cc3n2C(C)C)cc1NC(=O)C(C)(C)C#N 460254455 VTMPTMVNFMDUSO-UHFFFAOYSA-N 378.451 5.220 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@@H]1CCCN(c2ccccc2Cl)C1=O 463925445 MSLOWCDKZJFKEB-CRAIPNDOSA-N 399.947 5.199 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(F)cc1)C1CCC(C(F)(F)F)CC1 469729128 PKJQUYAWNXFGOQ-ORHYLEIMSA-N 385.323 5.304 30 20 GKED CC(C)(CNC(=O)c1cccc(SCC#N)c1)c1ccc(C(F)(F)F)cc1 469949051 AAPJPPYQEIBTPI-UHFFFAOYSA-N 392.446 5.029 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1ccccc1)[C@@H]1CCOC1 475575767 SNDBSJGIOWONHI-IFMALSPDSA-N 378.516 5.438 30 20 GKED N#Cc1csc(/C=C2\CCn3c2nc2scc(-c4ccccc4)c2c3=O)c1 480325120 IEBBBYDWNHCFGJ-OQLLNIDSSA-N 387.489 5.002 30 20 GKED C[C@@H]1CCCC[C@H]1N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481662658 YAJCCUFBHQVSSB-IIBYNOLFSA-N 395.478 5.319 30 20 GKED CC[C@H](C)n1ncc(NC(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)c1C 482804514 SVMUCEFKCGIQEP-INIZCTEOSA-N 388.471 5.387 30 20 GKED CC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)c1cc(F)cc(Br)c1 486083474 CXPQDFOENPBPFC-VOJFVSQTSA-N 379.248 5.401 30 20 GKED N#Cc1cccc(CN[C@@H](c2ccccc2)c2cc(Br)ccc2F)c1 490135866 IUUMAAAGKBFYIL-NRFANRHFSA-N 395.275 5.339 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(COc2ccccc2)cc1 493983577 OONYHAOVASKFJA-UHFFFAOYSA-N 376.456 5.121 30 20 GKED COc1cc(C)c(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)c(C)c1C 494952477 OOPIUGRUDAVNNJ-UHFFFAOYSA-N 379.504 5.182 30 20 GKED CN(CCCC1(C#N)CCOCC1)[C@@H]1CCC[C@H]1c1ccc(C(F)(F)F)cc1 499619839 OCAQBEUCAMJFOF-VQTJNVASSA-N 394.481 5.374 30 20 GKED N#C[C@@H](NC(=O)CCCOc1cccc2ccccc12)c1ccccc1Cl 499934850 ZBTZXGMTAYHEQG-HXUWFJFHSA-N 378.859 5.033 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3Cl)CC2)cc1 503900071 HERBSYJDQQYSCA-RBUKOAKNSA-N 397.305 5.284 30 20 GKED N#C[C@H](NC(=O)c1cc(C(F)(F)F)ccc1F)c1cccc(Cl)c1Cl 505325193 GUNAXWMYIUJNEN-ZDUSSCGKSA-N 391.151 5.146 30 20 GKED C[C@@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(-c2cccnc2)cc1 507614906 XJOPGRKGHUZEQS-LSCLNCKRSA-N 381.523 5.803 30 20 GKED CC[C@@H]1CCCCN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 508278554 LLDDHSZRVGIHGZ-GOSISDBHSA-N 379.460 5.156 30 20 GKED C=CCn1c(COc2ccccc2F)nnc1SC[C@@H]1CCCC(F)(F)C1 509097057 IAXRLFYSVIYAKW-CQSZACIVSA-N 397.466 5.100 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N2CCC[C@H](C)[C@H]2C)cc1 510094312 UBLSMCLDVAUEGB-JKSUJKDBSA-N 379.460 5.011 30 20 GKED CC(C)Sc1ccc([C@@H](C)NC(=O)C2(c3cc(F)cc(C#N)c3)CC2)cc1 511168961 JIDIICHDRUAQQL-OAHLLOKOSA-N 382.504 5.107 30 20 GKED Cc1ccccc1[C@H](C)NC(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 511515566 WMDMSDFQTIZATN-KRWDZBQOSA-N 398.466 5.002 30 20 GKED C=CCn1c([C@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@@H]1c1cccs1 516895968 VLEGMJZZDIVRHT-MAUKXSAKSA-N 398.507 5.146 30 20 GKED CN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517655751 TXJOHROSFNQXTI-UHFFFAOYSA-N 392.405 5.095 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSc1cccc(Cl)c1 518129916 FLFDUUDPVGFKDP-ZDUSSCGKSA-N 376.934 5.465 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(Br)cc1 519905707 DEVWHOWDBWTYFG-UHFFFAOYSA-N 386.293 5.011 30 20 GKED COc1ccc(CN[C@@H]2CCCC[C@H]2c2ccccc2)cc1OCCCC#N 521830574 KSSLDACUTIEGNW-FCHUYYIVSA-N 378.516 5.194 30 20 GKED N#CC1(c2ccccc2)CCC(NCc2sccc2Br)CC1 522022811 XRCQGENVXBXBOD-UHFFFAOYSA-N 375.335 5.004 30 20 GKED COc1c(C)ccc(NC(=O)c2cccc(COc3cccc(C#N)c3)c2)c1C 524490984 MAMQJEMZYZUCOX-UHFFFAOYSA-N 386.451 5.015 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1c(Cl)cccc1Cl 524854210 NWNRROAHFSVTBY-WMFXKJRFSA-N 397.664 5.270 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCOC4(CCCCC4)C3)c2)c1 532269965 MTPBAPQXRIYOAR-HSZRJFAPSA-N 390.527 5.109 30 20 GKED C=CCCC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C(C)C 534242661 WTWYXVXGXHNKAV-UHFFFAOYSA-N 392.528 5.080 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1 535585617 WKCGGZHXIQNYIR-CQSZACIVSA-N 380.831 5.430 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cccc([C@@H]4CCOC4)c3)c2)cc1 536378195 KXKIOARMBPSEOC-HXUWFJFHSA-N 384.435 5.107 30 20 GKED CC(C)n1ncc2cc(CN[C@@H](C)c3ccc(-c4cccc(C#N)c4)cc3)cnc21 542948341 XJUYQTFMMMHMQK-SFHVURJKSA-N 395.510 5.402 30 20 GKED COc1ccccc1CN(C)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 543016160 BECNNSVDVLDGAW-GOSISDBHSA-N 399.494 5.136 30 20 GKED COc1ccc2cc([C@H](C)C(=O)N(CCC#N)c3ccc(F)cc3)ccc2c1 554286423 GZKBRBLDBGUNIG-INIZCTEOSA-N 376.431 5.038 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OC(C)C)cc1F 554427981 YZVQFVOMBTWBQZ-UHFFFAOYSA-N 388.487 5.001 30 20 GKED CC1(C)CN(C(=O)c2ccc(Sc3ccccc3C#N)cc2)[C@H]1c1cccnc1 561010146 OZWBJUBMZVJGBZ-QFIPXVFZSA-N 399.519 5.328 30 20 GKED CC(C)CO[C@H](C)c1noc(CSCc2ccc(C#N)cc2C(F)(F)F)n1 596347667 NCRKWTLASIVPKC-GFCCVEGCSA-N 399.438 5.127 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H](CCF)C2)cc1Cl 596690593 HDICLPXIHGRKNR-UZLBHIALSA-N 399.897 5.599 30 20 GKED CCc1cccc(CC)c1NC(=O)c1ccc(OCc2ccccc2C#N)cc1 603637271 VPHAPGWWIZMRFZ-UHFFFAOYSA-N 384.479 5.514 30 20 GKED CCSCc1ccc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603960334 KFYJXHFSRSRIPN-UHFFFAOYSA-N 389.480 5.251 30 20 GKED Cc1noc(C)c1[C@H](C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 604547998 RLHBMIZRVGCMSQ-DJJJIMSYSA-N 393.874 5.343 30 20 GKED C[C@@H](CC#N)NC(=O)[C@@H](Sc1cc(Cl)ccc1Cl)c1ccccc1 609306281 JRBVYJOFOHIMTJ-SJCJKPOMSA-N 379.312 5.245 30 20 GKED CC(C)c1ccccc1OCCNC(=O)c1ccccc1-c1ccccc1C#N 609508445 ZWWYZCCXDMQBNV-UHFFFAOYSA-N 384.479 5.157 30 20 GKED C[C@@H](C1CC1)N(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)C1CC1 609723226 VQSDYVARAYDRGL-AWEZNQCLSA-N 380.875 5.407 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)N[C@H]2C[C@@H]2Cc2ccccc2)cc1 610203921 VLYVCWGHAWPOTN-GMAHTHKFSA-N 398.531 5.212 30 20 GKED N#Cc1cc(CSCc2csc(-c3ccc(C(F)(F)F)cc3)n2)ccn1 610954206 IPZFSRDQDSFTRM-UHFFFAOYSA-N 391.443 5.529 30 20 GKED Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)N1CCc2ccc(C#N)cc21 611619248 ZDKGGRLEBLOZQV-UHFFFAOYSA-N 398.249 5.031 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H]1CCC(=O)N(c2cccc(F)c2)C1 613901823 VPERNEDIJXFNJA-SFHVURJKSA-N 394.490 5.059 30 20 GKED C[C@H](c1ccc(F)c(Cl)c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 618447751 BEOBIYLNSMYXGM-FBIMIBRVSA-N 377.731 5.603 30 20 GKED C=CCn1c(SCC(=O)c2ccc([C@@H](C)CC)cc2)nnc1-c1ccncc1 645071784 HEZVDDLWTYLOGX-INIZCTEOSA-N 392.528 5.015 30 20 GKED CC(=O)c1cc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)cs1 645955532 DNXROCUFDLYQAF-NSHDSACASA-N 394.399 5.069 30 20 GKED CC1(CC(F)F)CN(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 646165423 ZCZFCUKFGOWPJO-UHFFFAOYSA-N 390.274 5.233 30 20 GKED Cc1nccnc1[C@@H](C)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 647323539 WRDLXJYQUCUDPY-SNVBAGLBSA-N 381.295 5.248 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)c(F)c1)c1nc2cc(F)ccc2s1 682234175 BZFKANWDMGSSIA-JTQLQIEISA-N 382.313 5.083 30 20 GKED COc1ccc(C(=O)/C=C/c2c(Cl)ccc(Cl)c2Cl)cc1NC(C)=O 726430570 ZICYYKJNCBLXAT-QPJJXVBHSA-N 398.673 5.510 30 20 GKED C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 726485702 RJKUXSUNEOHVOH-LLVKDONJSA-N 397.853 5.620 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3nc(Cl)ccc3Cl)cc2)c1 728006029 OLJLXFSOEPOCJJ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED O=C1/C(=C\c2cccnc2)CCc2nc(-c3ccccc3Br)sc21 730436016 JNZNZTCQCHDRMW-RAXLEYEMSA-N 397.297 5.180 30 20 GKED C[C@@H](C#N)CSc1ccccc1N[C@@H](C)C(=O)Nc1ccc2ccccc2c1 731039949 FQTYHIXXCLJSQL-IRXDYDNUSA-N 389.524 5.531 30 20 GKED O=C1/C(=C\c2ccnc3ccccc23)CSC/C1=C/c1ccnc2ccccc12 731836025 ZMUHJTVHVMGJKJ-AXPXABNXSA-N 394.499 5.566 30 20 GKED C[C@H](NC(=O)c1ccc(Oc2ccc(C#N)cn2)cc1)c1csc2ccccc12 731990592 NTABKWRUFONMQQ-HNNXBMFYSA-N 399.475 5.451 30 20 GKED CCc1ccc([C@H](NC(=O)NCc2cccc(O[C@H](C#N)CC)c2)C(C)C)cc1 733806549 JXSUEXCTMNQERI-JTHBVZDNSA-N 393.531 5.126 30 20 GKED N#Cc1ccc(-c2cccc(CNC(=O)/C=C/c3ccnc4ccccc34)c2)s1 739595015 CIFGASDGBSLOSK-DHZHZOJOSA-N 395.487 5.165 30 20 GKED C[C@H](c1cccs1)N(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740060299 SMYVRSFXKSJERC-CQSZACIVSA-N 381.526 5.251 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1ccc(F)cc1 743447396 OKRCIBUIPCQUAC-HVEPWOEZSA-N 376.456 5.537 30 20 GKED CCc1oc2ccccc2c1C=NO[C@H](C)c1nc(Cc2ccccc2)no1 744446067 ZFANCDCHFWGECA-OAHLLOKOSA-N 375.428 5.081 30 20 GKED CCO[C@@H]1C[C@H](N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1(C)C 748942999 RFPDWEFMKMEMJZ-BHIFYINESA-N 391.515 5.009 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccc(F)cc1F 752482385 UNXYWHYVBVYQDD-YGRLFVJLSA-N 390.842 5.598 30 20 GKED C#CC[C@@H](N[C@@H](C)c1cc(Br)cc(Cl)c1O)c1ccccc1 756777564 ZTMMYVSCDDHPKW-YVEFUNNKSA-N 378.697 5.223 30 20 GKED C=C[C@H](CC(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1)c1ccccc1 759333193 GIDDUGJQFCTARE-LJQANCHMSA-N 394.515 5.052 30 20 GKED C=CCN(C(=O)Nc1ccc2ccn(Cc3cccc(OC)c3)c2c1)C(C)C 763983493 CARGEOFOJPBWJB-UHFFFAOYSA-N 377.488 5.127 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2CCC[C@@H]2c2ccsc2)c1=S 764889962 RAQFJYUTQQRTAM-LJQANCHMSA-N 396.585 5.432 30 20 GKED N#C[C@H](C(=O)CCc1cccc(C(F)(F)F)c1)c1nc2cc(F)ccc2s1 766867412 SFRAHGXMGDQIPY-CQSZACIVSA-N 392.377 5.263 30 20 GKED O=C(/C=C/c1cncc2ccccc12)c1ccc(OC(F)F)cc1OC(F)F 772804479 BWBXKTSNPDTYGY-VMPITWQZSA-N 391.320 5.334 30 20 GKED Nc1c(Cl)cc(C(=O)/C=C/c2c(C3CC3)nc3sccn23)cc1Cl 774554831 FLPUEBVBGYJTJF-ONEGZZNKSA-N 378.284 5.058 30 20 GKED CSc1ccc2cc(CNC3(c4cccc(C#N)c4)CC3)c(Cl)nc2c1 775429986 MBDBYMZRQRANJK-UHFFFAOYSA-N 379.916 5.261 30 20 GKED O=C1/C(=C/c2ccc(OC(F)F)c(F)c2)CCc2ncc(C(F)(F)F)cc21 777470505 SZOPBYPTOXFINC-BJMVGYQFSA-N 387.279 5.053 30 20 GKED Cc1ccc(-c2ccc(C(=O)Nc3ccccc3O[C@H](C)C#N)c(F)c2)cc1C 780164209 NONQIVCRQMOKIM-QGZVFWFLSA-N 388.442 5.653 30 20 GKED COc1ccccc1-c1ccc(C(C)=NNc2ccc3c(=O)[nH]ccc3c2)cc1 789077623 WLUHVGIZKOELQR-UHFFFAOYSA-N 383.451 5.040 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C(C)(C)c2cccc(Cl)c2F)s1 797568261 PJDOGKGPGWXMQD-NSHDSACASA-N 378.900 5.387 30 20 GKED N#CC[C@@H](CC(=O)Oc1ccc(F)cc1C(=O)c1ccccc1)c1ccccc1 802964291 CZBLYQIUVZIESG-IBGZPJMESA-N 387.410 5.050 30 20 GKED CC(C)(O)c1cccc(NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 806200521 GDENOQANBGOSHJ-JOCHJYFZSA-N 385.467 5.213 30 20 GKED C#CCN(Cc1ccccc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1 825991554 ILRSKCNRGCHKGI-UHFFFAOYSA-N 393.487 5.009 30 20 GKED N#CCSc1ccccc1C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 855929678 DXRMEQWJVBHNLC-UHFFFAOYSA-N 398.372 5.086 30 20 GKED FC(F)(F)CCc1noc(-c2ccc(OC(F)(F)F)cc2C(F)(F)F)n1 904871699 ZOQMJJYXGTVOFX-UHFFFAOYSA-N 394.193 5.149 30 20 GKED O=C(/C=C/c1csc(-c2ccccc2)n1)c1ccc(Br)s1 916134737 YABFIGDCXFIYFE-VOTSOKGWSA-N 376.300 5.530 30 20 GKED COc1cc(OC)c(C(=O)/C=C\c2cc(Br)cs2)cc1Cl 916154685 SQRHLPLHTPSEAM-ARJAWSKDSA-N 387.682 5.077 30 20 GKED Cc1nn(Cc2ccccc2Cl)c(Cl)c1C=NNc1ccc(F)cc1 916268251 TUHPTMUCBVGZNA-UHFFFAOYSA-N 377.250 5.132 30 20 GKED Fc1c(F)c(F)c(C=NNc2nc(Cl)c(Cl)cc2Cl)c(F)c1F 916319109 DXILGHPCTJDFNS-UHFFFAOYSA-N 390.526 5.183 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)Cc3csc4ccccc34)n2)cc1 916973984 BSFNUGYKZQHVAI-SFHVURJKSA-N 388.517 5.752 30 20 GKED Cc1cc(C)cc(OCCC(=O)[C@@H](C#N)c2nc(-c3ccccc3)cs2)c1 917026775 OSPUTCXQBMDVQX-LJQANCHMSA-N 376.481 5.072 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@@H]2CCc3cc(F)ccc32)cc1 919904266 CQJXUUKZUPHMOG-XZOQPEGZSA-N 385.442 5.290 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3ccc(F)c(F)c3)cc2)c1 1776125472 JQFSICZTERQYSC-IZZDOVSWSA-N 378.374 5.155 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)CC2 1776374572 ALTMPRNGNJHQFL-IWIPYMOSSA-N 396.486 6.388 30 20 GKED C[C@H](Oc1ccc(/C=C/C(=O)c2ccc(C3CCCCC3)cc2)cc1)C(=O)O 1776469890 ZGRFIXBIDQFGPE-NDCSFFLDSA-N 378.468 5.482 30 20 GKED C[C@H]1C/C(=C/c2ccc(OCc3occc3C(=O)O)cc2)C(=O)c2ccccc21 1776589821 ZOHQPPNFQDASNP-SUCHYCSPSA-N 388.419 5.330 30 20 GKED CCCCCCCOc1ccc(/C=C2/CCc3occ(C(=O)O)c3C2=O)cc1 1776785942 UPRPVPIBAAMWSB-VKAVYKQESA-N 382.456 5.540 30 20 GKED CCn1c2ccccc2c2cc(/C=C3\CCc4oc(C(=O)O)c(C)c4C3=O)ccc21 1777002828 JFYRXZPYESJHBR-FOWTUZBSSA-N 399.446 5.627 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCOc4ccccc4C3=O)s2)c1 1777684359 VNNNQBVCEGJEOV-SQFISAMPSA-N 376.433 5.162 30 20 GKED C=C(C)CC(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cc[nH]c3C)cc2)CCC1 1788806360 MPNZPIKKMXMFIG-UHFFFAOYSA-N 393.531 5.063 30 20 GKED N#C[C@H](C(=O)c1ccc(Cl)cc1)c1nc2cc(C(F)(F)F)ccc2s1 41549164 ONZRTPIHXFTZMG-GFCCVEGCSA-N 380.778 5.459 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](c1ccc(F)cc1)C1CCCC1 63402668 VWNFASSIAIBFGH-QHCPKHFHSA-N 391.490 5.326 30 20 GKED COc1ccccc1[C@@H]1CCCN1C(=O)Nc1ccccc1SC[C@@H](C)C#N 108530505 KHADOTQMULCLEB-LPHOPBHVSA-N 395.528 5.316 30 20 GKED CC(C)Sc1ccc(Cl)cc1NCc1nnc(-c2ccc(C#N)cc2)o1 133811845 YQYHUYKEANNGNJ-UHFFFAOYSA-N 384.892 5.374 30 20 GKED Cc1cccc(COc2cccc(NCc3nnc(-c4ccc(C#N)cc4)o3)c2)c1 133865001 SFWHBFNAZDPEQL-UHFFFAOYSA-N 396.450 5.108 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](C)c1cn(C(C)(C)C)nc1C 135953723 LVPFRWFCRXTMJB-ZDUSSCGKSA-N 394.972 5.120 30 20 GKED CC[C@H](C)N/C(S)=C(/C(=O)c1cc(C)ccc1C)[n+]1ccc(C(C)(C)C)cc1 154479127 LDLRTONFIXJEMI-SFHVURJKSA-O 397.608 5.215 30 20 GKED CC[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1c(C)noc1C 161305161 WROQIQUIKUPUBU-FQEVSTJZSA-N 375.428 5.088 30 20 GKED Cc1ccc(NC(=O)[C@@H](C)Nc2ccccc2SC[C@@H](C)C#N)c(Cl)c1 170991833 ZOQCIOHPOAGDCR-LSDHHAIUSA-N 387.936 5.339 30 20 GKED CCN(Cc1ccc(OC)cc1)C(=O)Nc1ccccc1SC[C@H](C)C#N 171740905 ZAOBOZADNZIBHI-MRXNPFEDSA-N 383.517 5.001 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C/C=C/c1ccccc1F 175465528 XWIATYPCXRAELZ-QPJJXVBHSA-N 387.414 5.235 30 20 GKED Cc1ccc([C@@H](C)NC(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1[N+](=O)[O-] 176989784 GUXULERBJBYNML-DZGCQCFKSA-N 398.488 5.038 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H](C)c2ccc(Br)s2)n1 177765446 QSMJYVSEXZDYBL-UWVGGRQHSA-N 383.336 5.070 30 20 GKED CC(C)Oc1cncc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1 179983153 LCFWSWANSKQAAH-QGZVFWFLSA-N 397.887 5.136 30 20 GKED N#Cc1ccc(Br)c(CNc2cccc(Oc3ccccn3)c2)c1 191697334 UIQCLHLXUQUARY-UHFFFAOYSA-N 380.245 5.120 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccc(C(C)(C)C)cc2)=C(/S)N[C@@H](C)CC)cc1 194973085 QDBSMYXRPWNOHV-KRWDZBQOSA-O 397.608 5.161 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)C/C=C\c1ccccc1F 255593089 XWIATYPCXRAELZ-DAXSKMNVSA-N 387.414 5.235 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(Br)c(Cl)c2)c1 321248170 YXBKCTWERVFAHI-UHFFFAOYSA-N 393.668 5.037 30 20 GKED O/C(=N/CC1CCC(C/N=C(/O)[C@@H]2CCCCS2)CC1)[C@@H]1CCCCS1 329341805 SHKVRAYEOPXYDB-FOIPXRHGSA-N 398.638 5.277 30 20 GKED OC(=Nc1ccc2c(c1)OC1(CCCCC1)O2)C1CCC(/N=C(/O)C2CC2)CC1 329944497 FHDUCUMMTDZRJB-UHFFFAOYSA-N 398.503 5.632 30 20 GKED C=CCCc1ccccc1NC(=O)c1cnn(-c2cccc(C)c2)c1C(F)(F)F 410365681 OGGAAZSWIBBLTJ-UHFFFAOYSA-N 399.416 5.570 30 20 GKED C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1csc(-c2ccccc2F)n1 417366792 NQWVHFHWKROCEM-XOBRGWDASA-N 377.488 5.549 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CC4(CCCC4)C3)cc2Cl)cc1 429364000 RLWPJKDUYLQKKE-UHFFFAOYSA-N 381.863 5.412 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@H]1CCC(F)(F)C1 431109555 DUCVNXBBOJPTFD-INIZCTEOSA-N 385.414 5.216 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1C[C@H](C)C[C@@H]1c1ccccc1F 437844869 IYZHIIDUDMHROF-FOIQADDNSA-N 381.451 5.100 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H](Cc3ccccc3)C2)cc1C(F)(F)F 438644976 CJEXTGVBWFJKGS-MRXNPFEDSA-N 387.405 5.064 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)N[C@@H](CCC#N)c2ccccc2)c(C)c1 439359556 PAYQZKLQGSSBMA-UWJYYQICSA-N 381.545 6.052 30 20 GKED C[C@H](Oc1ccccc1NC(=O)NCC1CCC(C#N)CC1)c1ccccc1 441626210 OUTODOUJHAVJMB-VIQWUECVSA-N 377.488 5.278 30 20 GKED Cc1cccc(-c2cnc([C@H]3CCCN3c3ccc(C(F)(F)F)c(C#N)n3)[nH]2)c1 443510038 MLLARSFATFQSGO-GOSISDBHSA-N 397.404 5.012 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(CSCC)cc1 455888381 GBVRLWROUHTHRE-UHFFFAOYSA-N 386.565 5.327 30 20 GKED COc1ccccc1-c1nc(CNc2ccc(C#N)c(C(F)(F)F)c2)cs1 462167840 INELNGOLJJRCFD-UHFFFAOYSA-N 389.402 5.321 30 20 GKED N#Cc1c(F)cccc1NCc1csc(-c2ccc(C(F)(F)F)cc2)n1 463066316 FQKZWETZESKQAQ-UHFFFAOYSA-N 377.366 5.452 30 20 GKED C[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)c1ccc(F)cc1F 464884130 GJBNFWWQZSDSKU-OAHLLOKOSA-N 376.406 5.037 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N[C@H](C)CC(F)(F)F 467155597 QVCOWUALZKJOQK-CYBMUJFWSA-N 377.366 5.121 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cccc4ccsc34)n2)cc1 467838772 LBAAVSJUNYRPCW-KRWDZBQOSA-N 385.473 5.387 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 467929387 ZXYRIWGGUSAGOF-UHFFFAOYSA-N 375.472 5.569 30 20 GKED Cc1c([C@H](C)N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)cnn1C(C)(C)C 469202490 TUBQTPVFNOPAAQ-ROUUACIJSA-N 386.543 5.897 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)c1ccc2cc[nH]c2c1 473544378 ACHXAVNGTPAODL-UHFFFAOYSA-N 381.435 5.303 30 20 GKED N#Cc1ccc(C2(C(=O)N[C@@H]3CCC[C@@H]3c3ccc(C(F)(F)F)cc3)CC2)cc1 474160805 VQFZMKGOLKFQEN-WOJBJXKFSA-N 398.428 5.061 30 20 GKED C[C@@H](NC(=O)Nc1cc(C#N)cn1C(C)(C)C)c1ccc(-c2cccnc2)cc1 475030695 SIUJGXPHBSZVJX-MRXNPFEDSA-N 387.487 5.059 30 20 GKED N#CC[C@@H](CC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1ccccc1 476282529 FPUJTLKWNVLQNV-FQEVSTJZSA-N 395.462 5.445 30 20 GKED C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)C[C@@H](CC#N)c1ccccc1 476305190 JYHKIVYCDLFLAP-GDBMZVCRSA-N 387.310 5.527 30 20 GKED C[C@@H](c1ccccc1)n1c(SCCCC(C)(C)C#N)nnc1-c1ccccc1 476480916 JLIGJROYMKIKJT-SFHVURJKSA-N 390.556 5.976 30 20 GKED C[C@H](NC(=O)c1occc1COc1cccc(C#N)c1)c1c(F)cccc1Cl 477257572 GQQWGNDBPCZMKW-ZDUSSCGKSA-N 398.821 5.014 30 20 GKED C=CC[C@H](C)NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 477451300 IZWSTPDPMOEHIX-KCEHJNCXSA-N 397.403 5.190 30 20 GKED N#Cc1csc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c1 479656111 AHEILXDKRQOTRK-SFHVURJKSA-N 383.835 5.183 30 20 GKED CC[C@H](NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nc(C)cs1 479693551 XDZHHZDYSKDBGT-SFHVURJKSA-N 393.537 5.356 30 20 GKED COc1ccc(C#N)cc1CNc1ccc(-c2csc(C(F)(F)F)n2)cc1 480141214 CCVRJFGEACHHPN-UHFFFAOYSA-N 389.402 5.321 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(-c2nc(C)co2)ccc1C)c1ccc(F)c(F)c1 480996008 ZIWACMHWZUVUER-FQEVSTJZSA-N 397.425 5.676 30 20 GKED Cc1ccccc1-c1noc(C)c1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 483638473 RILPWZXVAXZZKW-UHFFFAOYSA-N 385.345 5.101 30 20 GKED CC[C@H](C)n1ncc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)c1C 483846253 BWRXLOVQQYOBAC-HNNXBMFYSA-N 389.459 5.471 30 20 GKED C=CCSc1ccccc1C(=O)NCc1ccc(Oc2cccnc2)c(F)c1 486244937 PDSFVMWNSLHIHD-UHFFFAOYSA-N 394.471 5.221 30 20 GKED C[C@H](NC(=O)NCc1ccccc1Sc1ccccc1)c1ccc(C#N)cc1 502626639 IKEAJIJZFGVLAI-KRWDZBQOSA-N 387.508 5.270 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)[C@@H](C#N)c3nc4ccccc4s3)c2)cc1 503579578 PADXHFRSKVDUTC-LJQANCHMSA-N 395.443 5.450 30 20 GKED CCCCOc1ccc(NC(=O)N2CC=C(c3ccc(C#N)cc3)CC2)c(C)c1 503630060 UZSWYIDTMPUYEY-UHFFFAOYSA-N 389.499 5.367 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H](C)c1nc2ccccc2n1C(F)F 505060202 DKAFKUHNXGYOSQ-CQSZACIVSA-N 384.430 5.433 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(C#N)cc2F)c2ccc(F)cc2)cc1 512644194 ZZADYIXHGHTEGN-WNSKOXEYSA-N 378.422 5.285 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N[C@@H](c2cccs2)C2CC2)cc1 512801383 FMAHJNFMHBWBQS-OAQYLSRUSA-N 389.480 5.685 30 20 GKED N#CCCN(Cc1ccccn1)Cc1ccc(-c2ccc(Br)cc2)o1 513750293 FUMCWGOAJYJRNF-UHFFFAOYSA-N 396.288 5.020 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(C2CC2)nn1-c1ccccc1 515105429 VLRZYICKIOMKQH-UHFFFAOYSA-N 378.501 5.031 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)c1ccccc1-c1ccccc1C#N 515665929 RHYVFQQKZQZPFH-UHFFFAOYSA-N 382.463 5.062 30 20 GKED Cc1cccc(OCCCCC(=O)Nc2ccccc2SC[C@H](C)C#N)c1 517461236 GCAPGZLULLFRCF-GOSISDBHSA-N 382.529 5.435 30 20 GKED C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517654143 VHAUAQYZTRTTTI-QGZVFWFLSA-N 388.442 5.517 30 20 GKED C=CCCc1ccccc1NC(=O)NCc1cccc(COCc2ccco2)c1 520998156 RVRIATYWPBVYTI-UHFFFAOYSA-N 390.483 5.437 30 20 GKED Cc1ccc(-c2cc(C(=O)Nc3ccccc3S[C@@H](C)CC#N)n[nH]2)cc1 521329363 BYVLXXJSFBOANF-HNNXBMFYSA-N 376.485 5.032 30 20 GKED Cc1ccc(-c2cnc(COc3c(Br)cccc3CC#N)o2)cc1 521638770 YOYNTWOIPYPDCA-UHFFFAOYSA-N 383.245 5.058 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 533924593 FHVNDPDCCBHEIR-GFCCVEGCSA-N 383.341 5.188 30 20 GKED N#Cc1ccc(CN2CCC(N[C@@H](c3ccccc3)c3cccc(F)c3)CC2)cc1 537288588 JKGAHOLQAFAKNG-SANMLTNESA-N 399.513 5.041 30 20 GKED N#Cc1cccc(CC(=O)N[C@@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)c1 537994686 FGBGFYAFIIFDQT-LJQANCHMSA-N 392.808 5.040 30 20 GKED C[C@@H](Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(C#N)c(F)c1 539651243 ZPUOKKWVOIINAA-MRXNPFEDSA-N 380.467 5.278 30 20 GKED CN(C(=O)c1sccc1C#N)[C@H](c1cccc(C(F)(F)F)c1)C(F)(F)F 541252485 OXZJORSHOKLKPX-CYBMUJFWSA-N 392.324 5.014 30 20 GKED COc1c(F)ccc(F)c1C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1 542968454 ZHQXBVRIFKHYIH-CQSZACIVSA-N 392.405 5.003 30 20 GKED COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H]2CCc3ccc(C#N)cc32)cc1 562095872 LYJXTKDRRPLYIJ-RPBOFIJWSA-N 386.470 5.267 30 20 GKED N#Cc1ccccc1Oc1ccc(-c2nc(Cc3cccnc3)no2)cc1Cl 575442135 QQTUKCUNLNHDQK-UHFFFAOYSA-N 388.814 5.040 30 20 GKED CCCN(C(=O)CCCCCC#N)[C@@H](c1cccnc1)c1ccc(F)cc1F 588928803 XJEIECSCLNKOGJ-QFIPXVFZSA-N 385.458 5.162 30 20 GKED N#CC1(c2ccc(CNCc3nc4c(s3)C[C@@H](c3ccccc3)CC4)cc2)CC1 594944042 GWVAGDVRFRPOOB-FQEVSTJZSA-N 399.563 5.261 30 20 GKED CCN(C(=O)c1cnc(-c2ccccc2Cl)s1)[C@@H](C)c1ccc(C#N)cc1 604517403 UCIAACTVNICXIS-AWEZNQCLSA-N 395.915 5.558 30 20 GKED CC(=O)c1csc(C(=O)[C@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)c1 607274333 HHYUNVDRRAJVBC-NSHDSACASA-N 394.399 5.069 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)COc1c(Cl)cccc1Cl 609371020 UCJFVFQKYAZYAZ-GFCCVEGCSA-N 395.311 5.405 30 20 GKED N#Cc1cccc(CNC(=O)N[C@H](c2ccccc2)c2ccc3ccccc3c2)c1 609471322 RHHPMIULJYOIEY-RUZDIDTESA-N 391.474 5.300 30 20 GKED Cc1ccc([C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(C#N)cn3)cc2)cc1C 609502305 WRJXJCDECUZSIJ-QHCPKHFHSA-N 397.478 5.340 30 20 GKED Cc1ccc2c(Cl)c(C(=O)N[C@@H](C#N)c3ccc(Cl)cc3)sc2c1 609589492 OJFWWUIXVYRTIJ-AWEZNQCLSA-N 375.280 5.511 30 20 GKED CC[C@@H](NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)c1nccs1 609979885 NICLXTQHVHFWMD-QGZVFWFLSA-N 397.887 5.342 30 20 GKED CC(C)[C@@H]1c2ccccc2CCN1C(=O)Nc1ccccc1SC[C@H](C)C#N 610792620 DEMPGIBYOQVYKE-VGOFRKELSA-N 393.556 5.726 30 20 GKED C[C@@]1(C#N)CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)C1 612300497 JIIAKVZFXYCSOJ-KNQAVFIVSA-N 392.890 5.153 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)cc2)cc1)c1ccc2ccccc2n1 613290535 FAQXPOJRYRKGHF-NRFANRHFSA-N 382.394 5.656 30 20 GKED CSc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 613320147 SOFGTEZIKUGYGS-MRXNPFEDSA-N 384.913 5.675 30 20 GKED COc1ccc(-c2nc(C)c([C@@H](C)N[C@H]3CCc4cc(C#N)ccc43)s2)cc1 618806063 NIGFYEUBHJHXEG-SZNDQCEHSA-N 389.524 5.337 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccc(C(F)F)cc1F 619128488 IJOKGVOMLQUMTO-UHFFFAOYSA-N 395.265 5.547 30 20 GKED COc1cc(NC(=O)NC(CCC(F)(F)F)CCC(F)(F)F)ccc1F 666829210 MWPTVSCPHSKIOZ-UHFFFAOYSA-N 390.299 5.009 30 20 GKED Cc1ccc2nc(C3CC3)cc(C(=O)[C@H](C#N)c3ccc4ccccc4n3)c2c1 674407788 HTPXNDNFQGZIJA-HXUWFJFHSA-N 377.447 5.459 30 20 GKED Cc1ccc(C(=O)/C=C/c2ccc(OCc3cc(C)c(C(=O)O)o3)cc2)cc1 729936873 HFUXOJUMLRQHIF-KPKJPENVSA-N 376.408 5.070 30 20 GKED Cc1sc2ncn(N=Cc3ccc([C@H]4C[C@H]4C)o3)c(=O)c2c1-c1ccccc1 732764129 PYUMDAAUMUYBCS-DYVFJYSZSA-N 389.480 5.032 30 20 GKED C=C(C)COc1cc(CNc2ccc(OC)c(Br)c2)ccc1OC 732821919 DRODSOYTVJBBIA-UHFFFAOYSA-N 392.293 5.033 30 20 GKED CC[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc(-c2ccc(OC)cc2)cs1 732903783 WPRURJCJQRFZRS-XLIONFOSSA-N 390.508 5.264 30 20 GKED C[C@@H]1/C(=C/c2cnc(-c3ccccc3)nc2)C(=O)c2cccc(Br)c21 742435103 QCLDEURUWCXKEE-OMJMQIJPSA-N 391.268 5.290 30 20 GKED O=C(/C=C/c1c(Cl)nc(Cl)n1-c1ccccc1)c1ccc2c(c1)COC2 742436949 OXUGFTGCKJPTGZ-CMDGGOBGSA-N 385.250 5.105 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=S)Nc1cc(OC)ccc1Cl 742976795 AGVWTMQTRPWIBH-UHFFFAOYSA-N 387.357 5.449 30 20 GKED CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)[C@H](C#N)c1nc2cc(Cl)ccc2s1 744035989 VCEVWKJAPUZHSX-GUSZCTEKSA-N 390.936 5.500 30 20 GKED CCOc1cccc([C@@H](C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 745267852 AKGQDTVQGKBHQY-HOYKHHGWSA-N 399.494 5.623 30 20 GKED COc1ccc(/C=C2\CCc3cc(SC)ccc3C2=O)cc1OCCCC#N 748148333 SRKRHKZZFSKTQO-QGOAFFKASA-N 393.508 5.312 30 20 GKED N#CCC[C@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 749035030 NLJIXVALJLIUFV-FDWYHIAWSA-N 392.808 5.447 30 20 GKED COc1ccc(C2(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CCC2)cc1 751084329 OCYKWFBCAIZCCB-XMMPIXPASA-N 396.490 5.411 30 20 GKED C[C@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1ccc(C#N)cc1F 753763392 PWWOVZWLXZBMHK-QKKBWIMNSA-N 395.478 5.382 30 20 GKED C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)Nc1cccc(OCC#N)c1 755782791 JGJWFPKBPKXJRE-GFCCVEGCSA-N 390.270 5.047 30 20 GKED CC(=NNc1nc(C(F)(F)F)cs1)c1csc(-c2csc(C)n2)c1 755902288 CETALYYSEWAKBA-UHFFFAOYSA-N 388.465 5.491 30 20 GKED CCCOc1cccc(CC(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 762995092 MQUJBTHXNNSKEX-HXUWFJFHSA-N 390.508 5.326 30 20 GKED N#Cc1ccc(CNc2ccccc2SC[C@@H]2CC2(Cl)Cl)c(F)c1 772926136 BHVFQKGAFWIURW-AWEZNQCLSA-N 381.303 5.595 30 20 GKED C[C@@H](NCc1nc(-c2cc3ccccc3o2)cs1)c1ccc(OCC#N)cc1 775562740 JTCXQGOBIVVBOW-OAHLLOKOSA-N 389.480 5.309 30 20 GKED CCc1cnccc1C(=O)/C=C\c1csc(COc2ccc(Cl)cc2)n1 776190765 YNNWXQFZVYVWEQ-YVMONPNESA-N 384.888 5.229 30 20 GKED CCCc1c(NC(=S)Nc2ccc(C)c(C)c2)cnn1-c1cccc(C#N)c1 783953413 VVSHPLUIAWWSPQ-UHFFFAOYSA-N 389.528 5.122 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSc1nc2ccccc2s1 789720067 UQCVWAMKOYFHSY-UHFFFAOYSA-N 382.554 5.879 30 20 GKED C#CCCOc1ccc(CNCc2cnc(-c3ccc(Cl)cc3)s2)cc1 790637652 WZFJDFCVVQDWMI-UHFFFAOYSA-N 382.916 5.155 30 20 GKED N#C[C@@H](C(=O)COc1ccc(Cl)c2ccccc12)c1nccc2ccccc12 792104446 OUIFEPAFKAAYHZ-IBGZPJMESA-N 386.838 5.297 30 20 GKED COc1ccc2cc(/C=C/C(=O)[C@H](C#N)c3ncc(C(C)(C)C)s3)ccc2c1 797571328 QLZYMVQWZRWPKY-IUYMFKLXSA-N 390.508 5.492 30 20 GKED N#CCCC[C@H](NC(=O)/C=C/c1csc(C(F)(F)F)c1)c1ccccc1 861824039 PEDYTOFULJCXGH-SCOAYWHSSA-N 378.419 5.331 30 20 GKED Cc1cc(Br)ccc1CNc1ccc(Oc2ccnc(C#N)c2)cc1 864028439 QEFQFKRQFSJDPW-UHFFFAOYSA-N 394.272 5.429 30 20 GKED C=CC[C@H](c1ccccc1)c1nc(Cc2coc(-c3ccc(OC)cc3)n2)no1 904327530 MBNLPNQOGDDPLQ-HXUWFJFHSA-N 387.439 5.032 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cc(Cl)nc2ccccc12 914517670 KHDHTBZQNWOIJC-UHFFFAOYSA-N 377.875 5.058 30 20 GKED Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C\C(=O)c1cc(F)ccc1F 916134992 WIDOZAKDZMDDCC-CLFYSBASSA-N 376.765 5.148 30 20 GKED O=C(/C=C/c1cnc(-c2ccccc2)nc1)c1ccc(N2CCCCCC2)cc1 917143312 YBHKXUAELLXZOI-XNTDXEJSSA-N 383.495 5.420 30 20 GKED O=C(/C=C\c1c(Cl)nc(Cl)n1-c1ccccc1)c1ccc(F)cc1F 920063651 CKCLNEKOKGJCDX-HJWRWDBZSA-N 379.193 5.353 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)c1ccc2c(c1)-c1ccccc1C2 920105410 GCTPSBZUELDTMK-JOCHJYFZSA-N 390.442 5.253 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ncc(C(F)(F)F)cc2Cl)c1 925416012 BTUVNRWANLEUCT-IUODEOHRSA-N 397.828 5.286 30 20 GKED CC[C@@H](C)c1nnc(N2CCC[C@](C)(C#N)C2)n1Cc1ccc(C)cc1SC 1752750821 MKNQQQQUQGJUKO-VGOFRKELSA-N 397.592 5.000 30 20 GKED O=C(O)c1cc(NN=Cc2ccc(-c3nc4ccccc4s3)o2)ccc1Cl 1776033357 PBFDHCDMKJSCGU-UHFFFAOYSA-N 397.843 5.354 30 20 GKED N#Cc1c(F)ccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)O)c1Cl 1776120281 AIVYGTMZRIRCDX-XFXZXTDPSA-N 378.790 5.084 30 20 GKED COc1ccc(-c2ccccc2)cc1/C=C1/C[C@@H](C(=O)O)c2ccccc2C1=O 1777341308 FKIRTTPCZOSYDS-PZNLSKEWSA-N 384.431 5.200 30 20 GKED C=CCC(=O)NC1(c2ccc(NC(=O)Cc3ccc4ccccc4c3)cc2)CCC1 1787700596 ADKJNRDCYHLOIE-UHFFFAOYSA-N 398.506 5.093 30 20 GKED Cc1cc(C)cc(NC(=O)[C@@H](C)Sc2nc(C)cc(C(F)(F)F)c2C#N)c1 26143270 NHUILTGJADEHJR-CYBMUJFWSA-N 393.434 5.017 30 20 GKED COc1c(C)ccc(NC(=O)c2ccc(OCc3ccccc3C#N)cc2)c1C 32169418 MYJVGZUQZFUWCO-UHFFFAOYSA-N 386.451 5.015 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1cc(=O)oc2cc3c(cc12)CCC3 68782276 UMCQJSOCIHYXMR-OAHLLOKOSA-N 390.508 5.146 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)cc1 91950909 WTSYLOVLMAHUCU-KRWDZBQOSA-N 393.384 5.442 30 20 GKED N#CCN(C(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C1CCCC1 125079626 BUFAJQPURBYGKJ-UHFFFAOYSA-N 380.300 5.025 30 20 GKED CC(C)Sc1c(Cl)cccc1NC(=O)N(CCC#N)Cc1ccccn1 135055159 CLOGZBCADHFNJB-UHFFFAOYSA-N 388.924 5.183 30 20 GKED CC(C)[C@H]1CCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 155756858 BTKIMDQHTUEXJR-HSZRJFAPSA-N 391.515 5.374 30 20 GKED C=CCn1c(S[C@H](C)c2ncc(-c3ccc(Cl)cc3)o2)nnc1C1CC1 161953540 PVULWISBDZETQF-GFCCVEGCSA-N 386.908 5.503 30 20 GKED CC(C)Oc1cccc(CN(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 163158682 QIUIYSKIGNSHPU-KRWDZBQOSA-N 397.544 5.389 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)c1 171836262 ZALAMPHLMLNCNN-OAQYLSRUSA-N 382.891 5.124 30 20 GKED Cc1ccc2[nH]cc(CCC(=O)Nc3ccccc3S[C@@H](C)CC#N)c2c1 174729939 DXCOISKATAPTBG-INIZCTEOSA-N 377.513 5.442 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1 183617670 QRMDIAWXZNKGQE-OAHLLOKOSA-N 398.422 5.430 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)NC(c1cccs1)c1cccs1 184329456 IVIUIMNPACOICY-CYBMUJFWSA-N 383.498 5.012 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C)[C@@H](C)c1ccc([S@](C)=O)cc1 191477792 UPVFHRPSEQKBEG-HPGBDJQBSA-N 398.572 5.501 30 20 GKED CC(C)C(=O)Nc1ccc(CNc2c(C#N)cnc3c(F)ccc(Cl)c23)cc1 195664071 DFJDGYURRUGWJO-UHFFFAOYSA-N 396.853 5.106 30 20 GKED COc1cc(C(=O)/C=C/c2cn3cc(Cl)ccc3n2)ccc1SC(F)F 195733655 YUEZZPBBYGSZRN-SNAWJCMRSA-N 394.830 5.207 30 20 GKED C=CCn1c(COc2ccc(Cl)cc2)nnc1S[C@H](C)c1ccccc1 255930418 HZFIILDILJZAHB-OAHLLOKOSA-N 385.920 5.550 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NCCCC3(C#N)CCOCC3)s2)cc1 281523296 ZLSGMQHPNSNYQV-KRWDZBQOSA-N 383.561 5.178 30 20 GKED C[C@@H](c1ccccc1F)N(C)C(=O)c1cccc(COc2ccc(C#N)cc2)c1 303652023 ULBRFVMIARNBTI-KRWDZBQOSA-N 388.442 5.110 30 20 GKED Cc1cc(C)c2nc(C3CC3)cc(/C(O)=N/C[C@H]3CCCn4cc(C)nc43)c2c1 328654890 MFUBWNAWLBAEGG-GOSISDBHSA-N 388.515 5.116 30 20 GKED C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)Cc1nc(C(F)(F)F)cs1 425542041 XSVYLSZIJLNLQD-JTQLQIEISA-N 393.356 5.095 30 20 GKED CC(C)[C@@H](NC(=O)N[C@H](CCCC#N)c1ccccc1)c1ccc(F)cc1F 431289039 VTIOASUJTNOMQN-NHCUHLMSSA-N 385.458 5.396 30 20 GKED C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1 438845883 FTYSMECMRBARFE-KXBFYZLASA-N 389.421 5.453 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(NC(=O)c2cccc(Cl)c2)c(F)c1 439377075 IVVCWWGDEPRXOO-OAHLLOKOSA-N 389.858 5.208 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(CC(C)(C)CCC#N)C2)n1 447067875 JRSVBXFGGOZMBY-KRWDZBQOSA-N 383.561 5.328 30 20 GKED CN1[C@H]2CC[C@H]1CC([C@@H](NC1CCC(C)(C#N)CC1)c1ccc(Cl)cc1)C2 449308875 AGPKJOQIWZIMKC-SYQKHLELSA-N 385.983 5.316 30 20 GKED CCC(CC)N(C(=O)[C@H](C)c1cccc(C#N)c1)[C@H]1CCCc2cccnc21 464479558 IUFKNPFLDRSFPU-VGSWGCGISA-N 375.516 5.152 30 20 GKED CC#CCCCC(=O)N(CC)[C@H](c1cccnc1)c1csc2ccccc12 466433475 CTZJVQIHNDAINH-HSZRJFAPSA-N 376.525 5.428 30 20 GKED Cc1cccnc1[C@H]1CCC[C@@H](NC2CCC(Oc3ccccc3C#N)CC2)C1 467342762 LBYQVEUUIGPBDJ-IDJJCAIYSA-N 389.543 5.268 30 20 GKED C[C@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nnnn1C1CCCCC1 468989438 MVZSFOFEUYETRT-INIZCTEOSA-N 388.475 5.015 30 20 GKED CC(C)COc1ccccc1NC(=O)c1cn(CCCC#N)c2ccccc12 468997874 OCIZGJFYLCGDCQ-UHFFFAOYSA-N 375.472 5.232 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 471904703 GKOSKHIWSAKUAD-STQMWFEESA-N 393.339 6.130 30 20 GKED COc1ccc(Br)cc1CNc1ccccc1S[C@@H](C)CC#N 474434892 RBNJTIFQDYLUAF-ZDUSSCGKSA-N 391.334 5.464 30 20 GKED COc1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)ccc1F 477463751 AEBZFTNRRWJUMR-UHFFFAOYSA-N 376.387 5.059 30 20 GKED CN(Cc1ccccc1NCc1ccc(Cl)cc1C#N)C(=O)c1cccs1 478363194 REYKUYNKBVBUHK-UHFFFAOYSA-N 395.915 5.157 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(-c2nc3ccccc3s2)cn1)c1ccccc1 483125423 ZFEDNIILSQVYIJ-QGZVFWFLSA-N 398.491 5.384 30 20 GKED N#C[C@@H](C(=O)c1cccc(-c2c(F)cccc2F)c1)c1nccc2ccccc12 483223166 ASXLSADQEVSIAV-LJQANCHMSA-N 384.385 5.670 30 20 GKED CCc1onc(-c2ccccc2)c1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 483631617 BLRIWINWFJLARV-UHFFFAOYSA-N 385.345 5.047 30 20 GKED C=CCn1c(Cc2ccccc2)nnc1S[C@@H](C)c1cc([N+](=O)[O-])ccc1C 484647830 XFRYOEHXPACLFE-INIZCTEOSA-N 394.500 5.125 30 20 GKED C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NCc2ccccc2C(C)(C)C#N)C1 486440553 BOQDUFBFMSQKJE-RTBURBONSA-N 389.543 5.218 30 20 GKED C=C(C)COc1cc(CNc2ccc(C)c(C(=O)N(C)C(C)C)c2)ccc1OC 487189796 UEKUDSYQHXHTSB-UHFFFAOYSA-N 396.531 5.051 30 20 GKED C=CCn1c(SCc2cc(C(C)=O)ccc2OCC)nnc1-c1cccs1 489428059 OJESELVHGKLBKM-UHFFFAOYSA-N 399.541 5.086 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(-c2ccco2)cc1F 490565626 FMFKNRFIDZNYMD-UHFFFAOYSA-N 375.403 5.177 30 20 GKED N#Cc1ccnc(SCC(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)c1 494075044 KWRLKZPYHVDYLE-UHFFFAOYSA-N 395.871 5.130 30 20 GKED C[C@@H](NC(=O)c1c(Cl)cncc1Cl)c1ccc(-c2cccc(C#N)c2)cc1 498950117 YYSUEIVFRQVXGL-CYBMUJFWSA-N 396.277 5.418 30 20 GKED Cc1c(C(=O)NCc2cccc(-c3cccnc3)c2)sc2ccc(C#N)cc12 500300426 YLYVQACIKMBIGC-UHFFFAOYSA-N 383.476 5.073 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(C)(C#N)CC1)c1ccc(C(F)(F)F)cc1 504396615 OJMYIFGBWSYPAW-QGZVFWFLSA-N 379.426 5.048 30 20 GKED N#C[C@H](NC(=O)c1sccc1-c1ccccc1)c1cccc(Br)c1 506522842 DVEFTHDSPXPLEE-KRWDZBQOSA-N 397.297 5.172 30 20 GKED Cc1ccc(C)c(CC(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 519432865 DLSPCBXBRRWNDE-UHFFFAOYSA-N 392.446 5.509 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCCc1csc2ccccc12 521261751 XGJPSCLIURWHNN-HNNXBMFYSA-N 395.553 5.517 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1Cl 521954814 AYJPDBNHQRQXRJ-ZWKOTPCHSA-N 387.310 5.407 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCCOc2ccccc21 522931199 STYCZABNJFSSAE-MRXNPFEDSA-N 376.909 5.013 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)c2ccc(C(C)C)cc2)nnc1-c1ccco1 525110879 SSRQOXXGEUEIKV-HNNXBMFYSA-N 381.501 5.211 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2cccc(C(F)F)c2F)cc1 528920955 WAAIUASRYCFUMP-SJCJKPOMSA-N 388.389 5.238 30 20 GKED N#CCc1ccnc(NC(=O)c2cccc(Oc3cccc(C(F)(F)F)c3)c2)c1 532435707 YOAIJXCNMHENAL-UHFFFAOYSA-N 397.356 5.211 30 20 GKED C=CCC[C@@H](NCc1nccn1CC(F)(F)F)c1ccc(C(F)(F)F)cc1 532724969 OJEATGOIFLTCQN-OAHLLOKOSA-N 391.359 5.261 30 20 GKED C[C@H](NCCC(=O)Nc1sccc1C#N)c1ccccc1Oc1ccccc1 537053482 RSUFDPVGNMCTEI-INIZCTEOSA-N 391.496 5.091 30 20 GKED C=CCN(Cc1ccccc1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1 537523820 VNZQVCMRFBHJGU-UHFFFAOYSA-N 384.439 5.110 30 20 GKED CCc1cnccc1[C@H](C)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 540227440 CJKUNBOTLCIHLQ-INIZCTEOSA-N 386.455 5.191 30 20 GKED C[C@H](NC(=O)c1occc1Br)c1ccc(-c2cccc(C#N)c2)cc1 542002927 RJOOBKHYFQYZTB-ZDUSSCGKSA-N 395.256 5.072 30 20 GKED CC[C@@H](NC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1ccncc1 542024173 XGZDRRWUHLCWAN-UZUQRXQVSA-N 384.483 5.132 30 20 GKED C[C@@H]1C[C@H](c2noc(-c3ccc(Oc4ccccc4C#N)c(Cl)c3)n2)CCO1 547218447 MXJNXYSIOMNDMF-ZIAGYGMSSA-N 395.846 5.336 30 20 GKED C[C@@H](N[C@H](CCCC#N)c1ccccc1)c1ccc(Br)c(F)c1 551211712 KPVHNICACNQJBY-AUUYWEPGSA-N 375.285 5.674 30 20 GKED Cc1c(C(=O)N2CCC(COc3ccccc3)CC2)sc2ccc(C#N)cc12 555901435 WTOYHDAJICBPKJ-UHFFFAOYSA-N 390.508 5.013 30 20 GKED CSCC[C@](C)(C#N)NC(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)s1 558213213 RQEYHTIGLUGQHV-QGZVFWFLSA-N 399.368 5.487 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(O[C@@H](C)CC)cc1 558320975 WHDMTTIWEMBQER-SFHVURJKSA-N 384.524 5.252 30 20 GKED N#CCC[C@H](C#N)CNc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 566579339 DUAHVCHKMMNJES-CYBMUJFWSA-N 377.341 5.492 30 20 GKED Cc1nc(C(F)(F)F)ccc1C(=O)N(Cc1ccccc1)c1ccccc1C#N 576421714 UCYCSKNRLYQSQB-UHFFFAOYSA-N 395.384 5.128 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(C)cc3)cs2)cc1C1CC1 582102063 QXTHXHJRYJRVPI-IBGZPJMESA-N 388.492 5.495 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)c2cccc(C#N)n2)C(C)C)s1 589359427 YIPVNLOJIRVBSV-UHFFFAOYSA-N 375.497 5.041 30 20 GKED C=C(C)COc1cccc(NC(=O)c2ccccc2OCc2c(C)noc2C)c1 589552815 JVULHIYFRZTLEK-UHFFFAOYSA-N 392.455 5.078 30 20 GKED N#CC1(CC(=O)N2CCC[C@@H]2c2ccc(Br)s2)CCCCC1 597500430 JVPCKWVZQAHIPK-CYBMUJFWSA-N 381.339 5.038 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3c(F)ccc4ccncc34)c(C#N)c2[C@H]1C 598845814 IZROZTUAFBASBI-RYUDHWBXSA-N 379.460 5.245 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(C2CCOCC2)c1)c1ccccc1 599900538 WVFLINDXOPOTEZ-JOCHJYFZSA-N 377.488 5.137 30 20 GKED CCc1noc(C)c1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 603765970 GULMATBMJQFANC-KRWDZBQOSA-N 379.847 5.107 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccccc1SC[C@@H](C)C#N 609376507 BRPMICLCVFXUTC-AWEZNQCLSA-N 377.469 5.154 30 20 GKED CN1CCC[C@@H](CNCC(C)(C)CCC#N)[C@H]1c1ccc(C(F)(F)F)cc1 610271072 OTXFMOPFUBEUPK-PKOBYXMFSA-N 381.486 5.008 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1)c1cccc(C#N)c1 610324052 JXMMTJKYNUYKKX-LLVKDONJSA-N 383.320 5.095 30 20 GKED C[C@H](CNC(=O)N[C@H](C)c1cccc(C#N)c1)c1c(Cl)cccc1Cl 610355444 QVSGTYGEIZVELB-CHWSQXEVSA-N 376.287 5.029 30 20 GKED Cc1nc(-c2ccc(CNC(=O)Nc3ccc(C#N)cc3Cl)s2)cs1 610877137 YDGSKFFDKDPOIT-UHFFFAOYSA-N 388.905 5.027 30 20 GKED Cc1csc(Sc2ccc(NC(=O)N(C[C@H](C)C#N)C3CC3)c(C)c2)n1 611095173 ZLTFZLWGTZPXDW-GFCCVEGCSA-N 386.546 5.067 30 20 GKED COc1ccc(-c2cncc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c2)c(C)c1 626355810 BRYNIPYZDNBYMA-LJQANCHMSA-N 391.496 5.136 30 20 GKED C=CCCc1ccccc1NC(=O)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 669727161 MPXDLIUMDLXAFI-OKILXGFUSA-N 394.359 5.400 30 20 GKED N#CCCCOc1cccc(/C=C/C(=O)c2ccc(N3CCCCC3)c(F)c2)c1 726741281 DKADWDOTMITLMW-FMIVXFBMSA-N 392.474 5.395 30 20 GKED N#CCOc1ccc(CSc2ncnc3sc(-c4ccccc4)cc23)cc1 729241349 VYVBYSQRZLVCOC-UHFFFAOYSA-N 389.505 5.553 30 20 GKED N#Cc1ccc(C(=O)OCCCC(c2ccc(F)cc2)c2ccc(F)cc2)nc1 730894209 FHOIGBPFNMPDEQ-UHFFFAOYSA-N 392.405 5.001 30 20 GKED C#Cc1cccc(NC(=S)Nc2ccc(Cl)cc2OCC(F)(F)F)c1 733754618 IYDSUZARBQJVOR-UHFFFAOYSA-N 384.810 5.071 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CNc2cccc(Cl)c2)cc1 733951314 DETRHAYEJQPVBX-NRFANRHFSA-N 375.859 5.046 30 20 GKED C=CC[C@@H](NC(=O)c1csc(-c2ccc(OCCC)cc2)n1)c1ccncc1 734458874 CJGXRRQCSYDJLD-LJQANCHMSA-N 393.512 5.041 30 20 GKED C=CC[C@H](NCc1sc(Sc2ccccc2)nc1Cl)c1ccncc1 734510828 ZWNDWYUIXMWPRE-INIZCTEOSA-N 387.961 5.750 30 20 GKED C=CC[C@@H](NC(=O)N(Cc1ccco1)Cc1ccc(C)s1)c1ccncc1 734679464 HOIBUHXXDAQQTF-HXUWFJFHSA-N 381.501 5.074 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc(-c3ccccc3)n2C)cc1 744033489 RSTISYKTOCNVOE-UWJYYQICSA-N 399.494 5.167 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3)ns2)cc1 746126373 YGFWUQDGCQOFED-NRFANRHFSA-N 395.487 5.718 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)cc1 748650225 VRRQBMOKYROGDF-UHFFFAOYSA-N 390.508 5.128 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2scnc2-c2ccccc2)cc1OC 749359689 SWLWEDIPBRENBS-ZRDIBKRKSA-N 392.480 5.035 30 20 GKED Cc1c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(=O)oc2ccccc12 750612655 REEXUFKWRWOBSM-UHFFFAOYSA-N 396.402 5.018 30 20 GKED C=CCOc1ccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3o2)cc1OC 751518072 RJFIDCASYBDQJM-ZROIWOOFSA-N 386.791 5.046 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)/C=C\SCc3ccco3)c2)cc1 754235281 KODBTBGUDYRIKQ-BENRWUELSA-N 376.437 5.329 30 20 GKED C[C@@H](N[C@H](C)c1cc(Br)cc(Cl)c1O)c1ccc(C#N)cc1 756456419 MXZKVBKIYOYBRP-GHMZBOCLSA-N 379.685 5.092 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 773100952 HHXMGMMHFQQZMS-SFYKDHMMSA-N 385.935 5.636 30 20 GKED CCCOc1c(Cl)cc(C=NOCc2ccc(C)nc2C)cc1OCC 774723737 HJFUIRCSXASEQH-UHFFFAOYSA-N 376.884 5.090 30 20 GKED Cc1cccc(COc2ccc(NC(=O)Cc3ccccc3CC#N)c(C)c2)c1 776896633 JNVCPGIWCMIKFY-UHFFFAOYSA-N 384.479 5.130 30 20 GKED N#Cc1cccc(COc2ccc(NCc3c[nH]nc3-c3cccs3)cc2)c1 779594614 KHFARQKENDROPQ-UHFFFAOYSA-N 386.480 5.201 30 20 GKED Cc1c(C(=O)O[C@@H](C)c2nnc(-c3ccccc3)o2)sc2ccc(C#N)cc12 796614715 KPGKHVQEYWXXKI-ZDUSSCGKSA-N 389.436 5.049 30 20 GKED Cc1cccc(-c2cc(Cl)ccc2NC(=O)c2ccccc2OCC#N)c1 797365851 WBLLMYOIUQYGLM-UHFFFAOYSA-N 376.843 5.470 30 20 GKED N#C[C@H](C(=O)C[C@H]1CCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 797943537 SHNHGXFNHXDPSP-MWLCHTKSSA-N 388.361 5.317 30 20 GKED C#CC[C@H](NC(=O)c1sc2ccccc2c1Br)c1ccccc1 810751624 CFVDDEXFIVIJGW-HNNXBMFYSA-N 384.298 5.158 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(N2CCCCCC2)cc1 815635470 DFDRFGCLLYENCP-OFVILXPXSA-N 375.560 6.153 30 20 GKED O=C(CCC(F)F)OC(c1cc(F)c(F)c(F)c1)c1cc(F)c(F)c(F)c1 816477778 KAGSYVZIWQAXCI-UHFFFAOYSA-N 398.249 5.199 30 20 GKED O=C(/C=C\c1ccccc1OCc1ccccn1)c1cccc(OC(F)F)c1 819842450 OANJFQVNWHHNIM-QXMHVHEDSA-N 381.378 5.158 30 20 GKED O=C(c1cc2c(F)cccc2s1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 918670569 JUNTYUWJUVTEMP-DTORHVGOSA-N 399.331 5.243 30 20 GKED O=C(O)c1ccc2scc(C=NN(Cc3ccccc3)c3ccccc3)c2c1 1776014761 XHQNTMLYRSOECD-UHFFFAOYSA-N 386.476 5.640 30 20 GKED O=C(O)[C@@H](Oc1cccc(C=NNc2cc(F)cc(Cl)c2)c1)c1ccccc1 1776091459 OAMPXUBXVOFVRI-FQEVSTJZSA-N 398.821 5.130 30 20 GKED CC(C)COc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776332920 MFYLDRVGDPEWBN-XGICHPGQSA-N 390.435 5.576 30 20 GKED C[C@H]1/C(=C\c2ccc(C(=O)O)cc2Cl)C(=O)c2cccc(Br)c21 1776586509 ALWHINMIVUDBLH-PBJWJZLWSA-N 391.648 5.184 30 20 GKED CCCCCCCOc1cccc(CN[C@H](Cc2cc(C)cc(C)c2)C(=O)O)c1 1776787235 GBUHHDVRHKDTNE-XMMPIXPASA-N 397.559 5.438 30 20 GKED CCCCCCCOc1ccc(CN[C@@H](C(=O)O)c2cccc(C)c2C)cc1 1776788305 ZDYIWTZRKYJUEQ-HSZRJFAPSA-N 383.532 5.568 30 20 GKED CCCCCCCOc1cccc(/C=C2/CCc3occ(C(=O)O)c3C2=O)c1 1776788978 HYSZUYJVBDENGE-LGMDPLHJSA-N 382.456 5.540 30 20 GKED C=CCn1c(S[C@@H](C)C(=O)Nc2ccc(C)cc2Cl)nc2ccccc21 22351390 SZZKEDXDIDHVRJ-AWEZNQCLSA-N 385.920 5.303 30 20 GKED N#C[C@H](C(=O)c1csc(-c2ccccc2F)n1)c1nc2ccccc2s1 64667661 YTCNLDRRPQRUNB-GFCCVEGCSA-N 379.441 5.049 30 20 GKED Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1ccc(C#N)c(Cl)c1 66015003 CUCADEACACIPMY-UHFFFAOYSA-N 394.308 5.611 30 20 GKED C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1nc(-c2ccccc2)cs1 107321846 IPOVIHDFLAIJEA-KRWDZBQOSA-N 376.529 5.011 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@@H]1CCCC[C@@H]1C(F)(F)F 108533307 OFFHYWLEBQSNOE-HZSPNIEDSA-N 385.455 5.181 30 20 GKED N#CCOc1cc(F)ccc1NCc1ccc(-c2nc3ccccc3s2)o1 181540294 BKCGOOSHZGRERT-UHFFFAOYSA-N 379.416 5.210 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](Nc2ccccc2)C1 191463111 DIRRHBCFTQMBHC-NRFANRHFSA-N 377.532 5.647 30 20 GKED N#CCCSc1ccccc1NC(=O)c1ccccc1CCC(F)(F)F 270411319 DKRPTPNZZQALGB-UHFFFAOYSA-N 378.419 5.440 30 20 GKED Fc1ccc(-c2csc(N3CCC(C(F)(F)F)(C(F)(F)F)C3)n2)cc1 301619477 XEUOHXSAMAAYRE-UHFFFAOYSA-N 384.320 5.270 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)c1cc2ccccc2o1 303017098 QCAZEAICKIIJSP-HNNXBMFYSA-N 377.444 5.317 30 20 GKED C=CCN(CC=C)C(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C 303251848 BCPLDQZWHLXHID-AWEZNQCLSA-N 375.925 5.217 30 20 GKED N/C(=N/Cc1ncc(-c2ccccc2)o1)Nc1cccc(Oc2ccccc2)c1 304499482 ORYIQOFJOCJARV-UHFFFAOYSA-N 384.439 5.061 30 20 GKED C[C@H](S[C@@H]1CCO[C@H]1C)C(O)=Nc1ccc2c(c1)OC1(CCCCC1)O2 328870934 YDTPTXSRLPYIMQ-SUNYJGFJSA-N 377.506 5.005 30 20 GKED CC(C)c1nc([C@H]2CCCCN2CC(O)=Nc2cc(Cl)ccc2Cl)n[nH]1 329723051 BCYDAFZIOSAROX-OAHLLOKOSA-N 396.322 5.050 30 20 GKED Cc1ccc(C23C[C@H]4C[C@@H](CC(/C(O)=N/[C@@H]5CCc6c[nH]nc6C5)(C4)C2)C3)cc1 329874918 GCLXJNFBYBGQRL-OXYRIKCGSA-N 389.543 5.070 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3csc(-c4ccoc4)n3)cc2)cc1 409518318 CEWNBRZWKCYBRI-UHFFFAOYSA-N 387.420 5.319 30 20 GKED C=CCC1(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)CCOCC1 424641780 NZSOUEWMLLTAKL-LJQANCHMSA-N 379.500 5.446 30 20 GKED N#CCCC[C@H](NC(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1)c1ccccc1 431984936 HKXBIQZRKRSMJJ-RJGXRXQPSA-N 375.516 5.132 30 20 GKED Cc1ccoc1CN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 432997227 WSCNEUXZJBBCDJ-UHFFFAOYSA-N 379.391 5.055 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H](c1cc(F)ccc1F)C(F)F 433851163 AEMSNORATSMAAH-LJQANCHMSA-N 394.412 5.945 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)[C@@H](c1cccnc1)C(C)C 435707175 VWCCKBDPHQSRAN-XMMPIXPASA-N 399.494 5.219 30 20 GKED C[C@H]1C[C@@H](c2cccc(F)c2)N(C(=O)Nc2cccc(C#Cc3ccccn3)c2)C1 438039339 FIQNUPLPKIQXHO-UUOWRZLLSA-N 399.469 5.236 30 20 GKED Cc1ccc(CNC(=O)N[C@@H](CCC#N)c2ccccc2)c(OC(C)(C)C)c1 438851760 ZGMVJNPPFBKORL-FQEVSTJZSA-N 379.504 5.017 30 20 GKED CCC[C@H](Cc1ccccc1)N(CCC)Cc1nnc(-c2ccc(C#N)cc2)o1 441502926 QYFNEQNSFGVOQB-JOCHJYFZSA-N 388.515 5.232 30 20 GKED C[C@@H](Oc1ccc(F)c(C(F)(F)F)c1)C(=O)Nc1ccccc1C(F)(F)F 442857496 GBWGSDMZLLPDKH-SECBINFHSA-N 395.274 5.269 30 20 GKED N#Cc1ccc(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)cc1C(F)(F)F 443881027 RRGZXGLTEFJAJV-HNNXBMFYSA-N 386.295 5.252 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)CS[C@H](C)c2cccc(C#N)c2)cc1 446708678 SEBRGRRVLPRZCB-VGOFRKELSA-N 394.540 5.115 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1 458806385 WDNAZERVNWHGDE-CTNGQTDRSA-N 381.907 5.274 30 20 GKED C[C@H](S[C@@H](C)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1C#N 463207710 BXKHWLDYFOIZJQ-RYUDHWBXSA-N 379.312 5.686 30 20 GKED O=C(Nc1ccccc1CCC(F)(F)F)c1c(F)cc(C(F)(F)F)cc1F 464273647 RUBNYTALUQSACN-UHFFFAOYSA-N 397.265 5.731 30 20 GKED Cc1oc2ccccc2c1CCNC(=O)Nc1ccccc1S[C@@H](C)CC#N 467335274 KCEQRYLBVXPQCN-HNNXBMFYSA-N 393.512 5.500 30 20 GKED C=CCCN(C)C(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 468190500 AUUMFFHBVXUQMK-UHFFFAOYSA-N 382.533 5.006 30 20 GKED C[C@@H]1[C@@H](C(F)(F)F)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 471274072 UCDSJZUPIKSTNI-ACJLOTCBSA-N 389.377 5.155 30 20 GKED C=C(C)COc1cc(CN[C@H](c2ccc(C)cc2)c2ccccn2)ccc1OC 475360173 GPLSXEQPJSBFOB-RUZDIDTESA-N 388.511 5.233 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2nc(-c3ccc(Cl)s3)cs2)c1 476573737 XLKAQZLZBWMCQN-UHFFFAOYSA-N 380.281 5.302 30 20 GKED Cc1cccn2c(NC(=O)C[C@H](CC#N)c3ccccc3)c(-c3ccccc3)nc12 483123072 DENNYRJCOAQMJK-NRFANRHFSA-N 394.478 5.336 30 20 GKED N#CC1(CCCN2CCC[C@@H](Cc3csc4ccccc34)C2)CCOCC1 499631129 NCDXEBPJKLBMTR-IBGZPJMESA-N 382.573 5.256 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 500256579 ZBIMYCOTMLGEKR-INIZCTEOSA-N 381.369 5.455 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccc3c(c2)Cc2ccccc2-3)cc1 502676854 BTZXXPZPFJNIEU-UHFFFAOYSA-N 398.466 5.209 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H]1CCOc2c(Br)cccc21 503889216 WBUIJRUTGPZNSU-VQTJNVASSA-N 397.316 5.202 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1cc(Cl)ccc1F 506382598 QNIQABWCBMMUCO-GFCCVEGCSA-N 394.924 5.604 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc3nc(C4CC4)sc3c2)c1 518909212 RHWPWNIKKNFJTR-UHFFFAOYSA-N 391.496 5.233 30 20 GKED N#C[C@@H](NC(=O)CCc1ccc(-c2ccccc2)[nH]1)c1ccc(Cl)c(Cl)c1 521017290 KFEMGJSPQVGXQI-HXUWFJFHSA-N 398.293 5.302 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1cc2ccccc2o1 524390404 JDAIWNRNTAJCIA-UHFFFAOYSA-N 382.419 5.444 30 20 GKED CC(C)c1ccc(CSc2nnc(SCCC(C)(C)C#N)s2)cc1 524988564 QEQWDVSGDYUCAD-UHFFFAOYSA-N 377.604 5.986 30 20 GKED CCO[C@@H](C)c1nc(CSc2nc(-c3ccccc3)ccc2C#N)cs1 525630891 JSGMTPNDTSMLPM-AWEZNQCLSA-N 381.526 5.467 30 20 GKED C[C@H]1CCCCN1Cc1ccc(NCc2cccc(OCCCC#N)c2)cc1 533211829 RBOCGMNVILZMAV-FQEVSTJZSA-N 377.532 5.356 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3scnc3C3CC3)cc2Cl)cc1 534816616 LDTZRDAFRAZHJQ-UHFFFAOYSA-N 395.871 5.590 30 20 GKED Cc1ccc(NC(=O)c2ccc(C3(C#N)CC3)cc2)c(OCc2ccccc2)c1 537426085 XDSOBSDLPTXSIQ-UHFFFAOYSA-N 382.463 5.382 30 20 GKED N#CC1(c2ccc(C(=O)Nc3ccc(F)cc3-c3ccc(Cl)cc3)cc2)CC1 537470636 QIYZFVPFXUOGJY-UHFFFAOYSA-N 390.845 5.954 30 20 GKED CC(C)(C)c1cc(NC(=O)c2cnc(-c3ccccc3F)s2)c(C#N)s1 539174806 CELPXMIGECJWSD-UHFFFAOYSA-N 385.489 5.432 30 20 GKED O=C(Nc1ccccc1C(F)(F)F)N[C@H](c1cccc(F)c1F)C(F)(F)F 541262221 WCAIUAYRZLNDEV-CYBMUJFWSA-N 398.253 5.409 30 20 GKED C[C@H](CC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1ccccc1C(F)(F)F 542417678 FZQVARGWEHFXPE-OAHLLOKOSA-N 386.417 5.262 30 20 GKED N#Cc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1Cl 548607266 ZOLBFDKLHUBIQW-UHFFFAOYSA-N 389.867 5.741 30 20 GKED COc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)c3ccc(C#N)c(F)c3)s2)cc1 553790926 IELFRMSVXWPHCJ-KGLIPLIRSA-N 395.503 5.550 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCCN2c3ccccc3C[C@H]2C1 568697918 DULGRALASJZIEV-NRFANRHFSA-N 389.543 5.207 30 20 GKED C=CCn1c(S[C@@H](CCOC)c2ccccc2)nnc1-c1ccc(F)cc1 578148757 YIYNQKCROIHBRI-IBGZPJMESA-N 383.492 5.140 30 20 GKED C=CCn1c([C@H](C)Oc2ccc(F)cc2)nnc1N1CCC[C@H]1c1ccsc1 580008374 HUKFDFJOOLCOIE-KXBFYZLASA-N 398.507 5.146 30 20 GKED CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)Sc1nc2c(cc1C#N)CCCC2 585688509 QHWHJAKQJIPLBL-JKSUJKDBSA-N 393.556 5.465 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3cccnc23)cc1Cl 603759001 QYIQUMMVKRRIFL-OAQYLSRUSA-N 397.865 5.796 30 20 GKED Cc1ccc(-c2csc(NC(=O)CSc3ccc(C#N)cc3)n2)c(C)c1 603918243 JQEPOMVNLPFDCL-UHFFFAOYSA-N 379.510 5.029 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 609382672 MSOHNTMPPVIVCC-HNNXBMFYSA-N 389.524 5.551 30 20 GKED Cc1ccc(C)c([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 609398834 VXZHZDCEKWZUAY-FUHWJXTLSA-N 381.545 5.780 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)Nc3ccc4scnc4c3)cc2)cc1 609502613 OZPKRAQAYWOIKP-UHFFFAOYSA-N 385.448 5.407 30 20 GKED N#CCCN(CC1CC1)C(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1 610197218 HDXHDWRAXMNNSV-UHFFFAOYSA-N 389.282 5.552 30 20 GKED C[C@@H](NCC1(c2ccc(Cl)cc2Cl)CCOCC1)c1ccc(C#N)cc1 610341458 RYUOICZYFNCALQ-OAHLLOKOSA-N 389.326 5.264 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H](c1ccccc1)c1ccco1 612203057 QEACHHGROIZLPS-IBGZPJMESA-N 386.904 5.482 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(Br)cc1Cl 615476991 FELYAWRZHNZQPI-UHFFFAOYSA-N 397.675 5.462 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)CCCCC1 625934814 BAYIZTXYLBMNNN-UHFFFAOYSA-N 397.588 5.813 30 20 GKED C=CC[C@H]1CCN(C(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)C1 628484925 YBFAZGKPGHFZFL-ZDUSSCGKSA-N 379.287 5.006 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1 682047533 FIGKYDGAXNLEPV-UHFFFAOYSA-N 378.263 5.193 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2ccc4ncccc4c2)CC3)cc1 727780174 IRXAZWTXROVXJG-JXAWBTAJSA-N 398.487 5.579 30 20 GKED COc1cc(C(C)=NNc2cccc([N+](=O)[O-])c2C)ccc1SC(F)F 727973324 HHYPZVAHHHTYIX-UHFFFAOYSA-N 381.404 5.063 30 20 GKED O=C(/C=C\C1=Cc2ccccc2OC1)c1ccc(OC(F)F)cc1OC(F)F 728156140 BWKLEOZQHVPRRY-YVMONPNESA-N 394.320 5.104 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cccnc2Cl)CC3)cc1 728699121 RWCRJKVHTHZSLF-QBFSEMIESA-N 382.872 5.080 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=S)NC12CC3CC(CC(C3)C1)C2 730954989 QZYGCWURHUXNFJ-HILYYZTDSA-N 385.602 5.194 30 20 GKED C/C(=C\C(=O)[C@H](C#N)c1nc(-c2ccc(C)cc2)cs1)c1cccc(F)c1 732496545 YNSUYDPNZSSKEO-XATQLNLPSA-N 376.456 5.537 30 20 GKED Cc1cc2occ(CC(=O)[C@@H](C#N)c3nc4cccc(C)c4[nH]3)c2cc1C(C)C 735790669 OQFNPPFKVNRJCM-LJQANCHMSA-N 385.467 5.468 30 20 GKED CC[C@H](CC(=O)[C@@H](C#N)C(=O)Nc1cccc2ccccc12)c1ccc(C)cc1 739155709 SWZUNJYFSKGHCO-XMSQKQJNSA-N 384.479 5.380 30 20 GKED CCCOc1cc(CNCc2cccc(-c3ccc(C#N)s3)c2)ccc1OC 740013226 AAUYDTOIZKGRKA-UHFFFAOYSA-N 392.524 5.374 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1)c1nc2ccccc2s1 744016105 JOMCKNHCFZMDMT-RRFJBIMHSA-N 387.291 5.583 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@H](C)c1ccccc1C(F)(F)F 744016774 SSGFRZUKKLLPAN-MLGOLLRUSA-N 398.384 5.190 30 20 GKED CC(=NNc1c(Cl)cc(Cl)cc1Cl)c1ccc([S@@](C)=O)cc1 746367496 MPGKNZRPJNSCFM-JOCHJYFZSA-N 375.708 5.220 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)N[C@H](CCC#N)c1ccccc1 747709984 QPQTYIQFSXHMQX-OAQYLSRUSA-N 379.573 6.265 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)C1 750691478 RINGRHDBJDGAQT-DHLKQENFSA-N 395.506 5.672 30 20 GKED Cc1ncsc1C(=O)/C=C/c1cnc(-c2ccc(Br)cc2)s1 751524441 QZFGRFVQFHEXLF-VOTSOKGWSA-N 391.315 5.234 30 20 GKED CO[C@]1(C)C[C@@H](N(C)C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)C1(C)C 752635776 HMESYEVEDMQVIO-PQNGQFLHSA-N 391.515 5.009 30 20 GKED O=C(/C=C/c1cnc(-c2ccncc2)s1)c1nc(-c2ccccc2)cs1 753144108 JCEPNGCGTLYCDD-VOTSOKGWSA-N 375.478 5.225 30 20 GKED Cc1cc(CCCC(=O)[C@H](C#N)c2nc(-c3ccccc3)cs2)c(C)s1 753401110 ZGAZZLLQMSBHQQ-SFHVURJKSA-N 380.538 5.688 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)C1CC1 754423417 CCLOCTHSEJSSNR-OLZOCXBDSA-N 398.359 5.128 30 20 GKED N#Cc1ccccc1/C=C(\Cl)c1nc(O)c2cc(-c3ccccc3)sc2n1 755581540 NVKOWKLRAIQCMV-YVLHZVERSA-N 389.867 5.672 30 20 GKED Cc1ccccc1-c1cc(C(=O)O[C@H](C#N)C(C)(C)C)c2cnn(C(C)C)c2n1 765630069 ODLUEWBIDCHGFN-HXUWFJFHSA-N 390.487 5.083 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)OCCCCC(C)(C)C#N)c12 768598437 QJTQUHCFUQPLPS-UHFFFAOYSA-N 396.535 5.249 30 20 GKED CC[C@H](NCc1cccc(O[C@@H](C#N)CC)c1)c1cccc(Br)c1 772984212 NQMXYHNZCFKIGS-QUCCMNQESA-N 387.321 5.371 30 20 GKED CN1C(=O)CCc2cc(/C=C\C(=O)c3cc4c(ccc5ccccc54)o3)ccc21 774117787 GGNLJXOFVPONCD-XFFZJAGNSA-N 381.431 5.391 30 20 GKED CSc1cccc(NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1C 775306188 UYYNSCISQLGMKL-FQEVSTJZSA-N 387.508 6.016 30 20 GKED O=C1CSc2sc(C(=O)/C=C\c3ccc(-c4ccccc4F)o3)cc2N1 779462641 PWLQANAVIMYCRA-ALCCZGGFSA-N 385.441 5.088 30 20 GKED C=CCc1cc(CN[C@H](C)c2cc(Br)cs2)cc(OC)c1OC 786848227 JVIZDMCAINOYJG-GFCCVEGCSA-N 396.350 5.107 30 20 GKED Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(C(C)(C)C#N)cc3)o2)cc1C 796039864 SJIMEGKHBSCEMD-MRXNPFEDSA-N 389.455 5.073 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)/C=C/c2ccc3ccc(Cl)cc3n2)s1 797571476 RYCQLPMUOCDIHQ-ROJDOSBLSA-N 395.915 5.532 30 20 GKED COc1ccc(-c2nc3c(s2)C(=O)/C(=C\c2cn(C(C)C)nc2C)CC3)cc1 798370216 GLNLPYUTIRNTMQ-WJDWOHSUSA-N 393.512 5.117 30 20 GKED Cc1cc(C(=O)/C=C/c2cccc(NC(=O)c3ccccc3Cl)c2)oc1C 799896199 HCXIVKNTOUUQJJ-ZHACJKMWSA-N 379.843 5.698 30 20 GKED N#Cc1ccc(F)c(CN[C@H]2CCCc3c2[nH]c2ccc(Br)cc32)c1 808705982 BTLGRLWJAFSRPI-IBGZPJMESA-N 398.279 5.108 30 20 GKED C#C[C@@H](NC(=O)c1ccccc1SCc1cc(C)no1)c1ccc(Cl)cc1 811946949 OUKYBGQEKJJZGC-LJQANCHMSA-N 396.899 5.033 30 20 GKED C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813217221 DHWFMOQRGDFEMF-CXAGYDPISA-N 390.405 5.042 30 20 GKED Cc1c(NCc2ccc(O[C@H](C)C#N)cc2)cccc1NC(=O)OC(C)(C)C 858233377 MPHABTQGANIGPN-OAHLLOKOSA-N 381.476 5.245 30 20 GKED CN(C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1)[C@H]1CCCc2ccccc21 915352406 HXFLCTSKDJRUJU-RPBOFIJWSA-N 395.506 5.883 30 20 GKED Cc1cc(C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2)c(C)n1C1CCCCC1 916885221 PUIGYSMJVIMPOU-FQEVSTJZSA-N 397.906 5.225 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)[C@@H](C)Oc1ccc(Cl)cc1Cl 1776062345 PFRCJPJQHQUBME-SNVBAGLBSA-N 385.222 5.086 30 20 GKED O=C(O)c1cc(NN=C/C=C\c2ccc(OCc3ccccc3)cc2)ccc1F 1776063379 NQMZLAFPIXJPBX-ALXZNIRBSA-N 390.414 5.214 30 20 GKED COc1ccc(C(=O)/C=C\c2ccc(-c3ccc(Cl)cc3)o2)cc1CC(=O)O 1776131826 NFOVXUNIRAJFKK-CLFYSBASSA-N 396.826 5.132 30 20 GKED CC(C)COc1ccccc1/C=C/C(=O)c1cc(C(=O)O)ccc1OC(C)C 1776333759 OUFQKKHALOBTSK-PKNBQFBNSA-N 382.456 5.103 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(-c2ccccc2)ccc1OC 1776783718 FDXBBZOKXIRADW-JOCHJYFZSA-N 383.532 5.656 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(NC(=O)OC(C)(C)C)cc1 1776783907 LHZAKKFVIUOPSL-IBGZPJMESA-N 392.540 5.327 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1sc(C)cc1Br 1776786811 OXCRKVXNKUINIK-CYBMUJFWSA-N 376.360 5.112 30 20 GKED CN(C)Cc1cccc(C(=O)/C=C\c2ccc(-c3ccc(C(=O)O)cc3)cc2)c1 1777033375 HVAZCSJGZCTSPZ-NVNXTCNLSA-N 385.463 5.010 30 20 GKED N#C[C@H](C(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccc2ccccc2n1 47376522 DYPQMRBRNZEWHO-KRWDZBQOSA-N 382.444 5.346 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccccc2Sc2ccccc2)cc1 58685623 MBWNNCLCSOLCAW-UHFFFAOYSA-N 390.533 5.581 30 20 GKED C=CCn1c(SCC(=O)c2c(C)c(C)cc(C)c2C)nnc1-c1ccoc1C 60384075 XLTPDJYQAKUQTQ-UHFFFAOYSA-N 395.528 5.241 30 20 GKED C[C@@H](NCc1cccc(OCCCC#N)c1)c1nc(-c2ccccc2)cs1 107321820 SYCKIOUAWIALHR-QGZVFWFLSA-N 377.513 5.343 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H]1c1ccccc1Cl 108532511 WVXYWMOWGFLMIX-BEFAXECRSA-N 399.947 5.961 30 20 GKED CC(=O)N(c1nc(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)cs1)C1CC1 114990907 RMFGTNSRJJXOST-SDNWHVSQSA-N 388.492 5.222 30 20 GKED N#Cc1ccc(C(F)(F)F)c(NCc2ccc(NC(=O)c3ccco3)cc2)c1 121113497 MFSBXCNRWZGZSQ-UHFFFAOYSA-N 385.345 5.034 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@H](C)Cc3ccccc3F)n2)cc1 122013279 VPDCSUSPJLPLHJ-KDOFPFPSSA-N 394.471 5.013 30 20 GKED C=C(C)COc1cc(CN[C@@H](C)c2nc(-c3ccncc3)cs2)ccc1OC 124113329 LQWXWDCCOARLBV-INIZCTEOSA-N 395.528 5.019 30 20 GKED C[C@H](Sc1cc(C#N)ccn1)C(=O)N1c2ccccc2Sc2ccccc21 125678941 BLPIRFCBEXJOOT-AWEZNQCLSA-N 389.505 5.263 30 20 GKED CCOCCC1(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCCC1 134977529 CHJJNUULEPUANC-KRWDZBQOSA-N 389.565 5.189 30 20 GKED CCc1noc(C)c1NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 156452762 AISLZRLUDJCODC-QGZVFWFLSA-N 394.862 5.498 30 20 GKED C[C@H](NCc1cccc(OCCCC#N)c1)c1cccc(OC(F)(F)F)c1 175753914 LCDNOEFJSFSDNL-HNNXBMFYSA-N 378.394 5.119 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N(Cc3ccc(C#N)cc3)C3CC3)c2)n1 177996556 XDJNVQRYKHNWGE-UHFFFAOYSA-N 386.455 5.027 30 20 GKED N#Cc1cccc(-c2csc(NC(=O)c3scnc3C3CCCC3)n2)c1 185244724 PGUCCVHEUFWKME-UHFFFAOYSA-N 380.498 5.048 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cn(-c2cccc(Cl)c2)nn1 189879930 KJWHGLKAGHPDEX-UHFFFAOYSA-N 380.879 5.025 30 20 GKED C[C@@H]1CCN(C(=O)c2sccc2C#N)c2cc(C(F)(F)F)ccc2S1 194597306 ZWKCSYFJDUKUPK-SNVBAGLBSA-N 382.432 5.170 30 20 GKED COc1cc(C(=O)/C=C\c2nc(-c3ccccc3)cs2)ccc1OC(F)F 206847882 PQPDUTCYLKCNPO-NTMALXAHSA-N 387.407 5.316 30 20 GKED Cc1ccc(N2C(=O)/C(=C\c3cccc(OCCCC#N)c3)SC2=S)cc1 207615406 OILUXSJWURAQQA-XMHGGMMESA-N 394.521 5.083 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@@H](c2ccccc2)c2cccc3ccccc23)cc1 237611259 PNJLZZBHAJFASV-HRFSGMKKSA-N 392.502 6.010 30 20 GKED CCCCc1nc(CON=Cc2cccc(OCc3ccncc3)c2)cs1 255192343 IKMWQHFMLNKBRM-UHFFFAOYSA-N 381.501 5.010 30 20 GKED C[C@@H](Nc1ccc(F)cc1C#N)c1cccc(NC(=O)Cc2ccccc2F)c1 301376585 RQAMIFNNGHLHAY-OAHLLOKOSA-N 391.421 5.191 30 20 GKED Cc1ccc(-n2cc(N=C(O)C3CCC(/N=C(/O)C4CC4)CC3)cn2)c(C)c1 330077059 HJAWIPIQTXXVNB-UHFFFAOYSA-N 380.492 5.002 30 20 GKED COc1cccc(Oc2ccc(NC(=O)N[C@@H](C)c3ccc(C#N)cc3)cc2)c1 409498045 GLACCLWXSAFLCB-INIZCTEOSA-N 387.439 5.242 30 20 GKED CCN(C(=O)c1ccc(OC2CCCC2)c(OC)c1)[C@H](C)c1ccc(C#N)cc1 410290878 WWMSALSOFIBKGD-QGZVFWFLSA-N 392.499 5.112 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N[C@@H]3CCCc4cc(C#N)ccc43)c2)n1 416903619 CMLBAVKOIGMMES-HXUWFJFHSA-N 386.455 5.029 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSCC1CCC(F)(F)CC1 419602487 KVJIXWLMZNQXGI-AWEZNQCLSA-N 398.544 5.578 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@H](C)Nc1ccc(-c2ccncc2)c(C)c1 427824117 IFNVJVIUVJJATO-SFHVURJKSA-N 391.540 5.134 30 20 GKED N#CCC1(CNC(=O)c2oc3ccccc3c2CSC2CCCCC2)CC1 431133747 VGDRNRZVUAQAIJ-UHFFFAOYSA-N 382.529 5.422 30 20 GKED CC(C)(c1ccc(NCc2nnc(-c3ccc(C#N)cc3)o2)cc1)C(F)(F)F 432339009 XWZLFKOJOGMWDO-UHFFFAOYSA-N 386.377 5.060 30 20 GKED N#C[C@@H](CCc1ccccc1)C(=O)Nc1nc(-c2ccccc2Cl)cs1 433339955 CNCVODJMNKZKKU-OAHLLOKOSA-N 381.888 5.175 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)N[C@@H](CCC#N)c1ccccc1 439499060 SXDGAHUTXGOBBL-DEOSSOPVSA-N 399.494 5.741 30 20 GKED Cc1csc(Sc2ccc(NC(=O)NCC3CCC(C#N)CC3)cc2)n1 440938904 UQXXAXBLZCROQE-UHFFFAOYSA-N 386.546 5.054 30 20 GKED C=C(C)Cn1c(S[C@@H]2CCc3c(Cl)cccc32)nnc1-c1ccncc1 443522707 PSDRGTLZIVAITO-GOSISDBHSA-N 382.920 5.349 30 20 GKED N#CCCC[C@H](N[C@@H]1CCc2c1ccc(F)c2Br)c1ccccc1 449339458 KOLPQBBZFVTPDF-RBUKOAKNSA-N 387.296 5.600 30 20 GKED C[C@H](Cc1ccccc1)N1CCC(N[C@H](CCCC#N)c2ccccc2)CC1 449342199 ZTDJMVLDIHBTBR-PXDATVDWSA-N 375.560 5.107 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)N(C)CC(C)(C)C#N 458340815 CBZSZKMPBLVQKQ-CYBMUJFWSA-N 390.940 5.024 30 20 GKED C=C(C)Cn1c(C2CCC2)nnc1N1CCC[C@H]1c1nc2ccccc2s1 460390704 WSTBMHQWMBGUTM-KRWDZBQOSA-N 379.533 5.073 30 20 GKED C[C@@H]1CN(c2c(C#N)cnc3c(F)ccc(Cl)c23)C[C@H](c2ccc(F)cc2)O1 462874748 DRPDTKVFJUVGRC-KZULUSFZSA-N 399.828 5.004 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CC(c3ccccc3F)C2)cc1 463010562 MXZRSRHEAKXRCA-UHFFFAOYSA-N 386.426 5.038 30 20 GKED CCc1c(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)ccn1C 463588219 HVSJPWJSKJHECH-LJQANCHMSA-N 377.875 5.149 30 20 GKED N#Cc1ccc(F)c(CNc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1 464080477 CGJNOIPCMLJOOV-UHFFFAOYSA-N 397.812 5.354 30 20 GKED COc1cc(F)c(F)cc1NC(=O)c1ccccc1Sc1ccccc1C#N 464669681 ODHXVPDXXDJPKX-UHFFFAOYSA-N 396.418 5.249 30 20 GKED N#CCCCn1cc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)c2ccccc21 468808037 CENSSCXVUJNNHN-OAQYLSRUSA-N 385.511 5.355 30 20 GKED C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)C[C@H](CC#N)c1ccccc1 476305199 JYHKIVYCDLFLAP-ZBFHGGJFSA-N 387.310 5.527 30 20 GKED N#Cc1ccccc1OCc1cccc(-c2nc([C@H]3CCC(F)(F)C3)no2)c1 484552013 NTRHIBMECWGOCI-INIZCTEOSA-N 381.382 5.090 30 20 GKED CSC[C@@H]1CCCN(C(=O)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1 489998450 PXAYBLONUCZLPF-IEBWSBKVSA-N 393.556 5.071 30 20 GKED N#CCCCOc1cccc(NC(=O)Nc2ccc(-c3ccco3)cc2F)c1 490528545 SHFOZUBHPQIKRJ-UHFFFAOYSA-N 379.391 5.412 30 20 GKED C[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(OCc2ccc(F)cc2)cc1 492448455 SMUHLYVHKBEXQP-KRWDZBQOSA-N 397.494 5.095 30 20 GKED N#C[C@@H](NC(=O)CCOc1ccccc1-c1ccccc1)c1ccc(Cl)cc1 499810357 AIGQXGXFLUHTLT-OAQYLSRUSA-N 390.870 5.157 30 20 GKED C=CCN(Cc1cccs1)C(=O)NCc1ccccc1OCc1ccccc1 506224337 PRFHQUILMWCMDQ-UHFFFAOYSA-N 392.524 5.225 30 20 GKED Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 507906235 AARBBWYAVZVCMJ-UHFFFAOYSA-N 381.435 5.322 30 20 GKED C=CCCO[C@@H](C)c1nc(C2(c3ccc(Br)s3)CCC2)no1 508663683 HGZAPUKLDFVFNI-NSHDSACASA-N 383.311 5.017 30 20 GKED C=CCC[C@H](NC(=O)N[C@H](C[C@@H]1CCOC1)c1ccccc1)c1ccccc1 510267900 FSPVVZDPALZDGA-AJSBUHFISA-N 378.516 5.161 30 20 GKED FC(F)Oc1ccc([C@H](NCc2cccc(OC(F)F)c2)C(F)(F)F)cc1 510459300 IYYQFKFXBPWPCT-AWEZNQCLSA-N 397.290 5.283 30 20 GKED Cc1ccc([C@@H](C)N(C)C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 510886138 ADKBPLZJJLNIBY-LJQANCHMSA-N 399.494 6.192 30 20 GKED C[C@H](N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccc(C#N)cc1F 512665507 GIDPCCVZIRMKLU-HJPURHCSSA-N 384.458 5.024 30 20 GKED C[C@@H](Oc1ccccc1C#N)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)cc1 518867527 KYSRPBWOTJDOQK-QZTJIDSGSA-N 385.467 5.137 30 20 GKED COCCSc1ccc([C@H](C)Nc2ccc(C#N)c(C(F)(F)F)c2)cc1 520988891 LWNCXRTUJDYUEJ-ZDUSSCGKSA-N 380.435 5.489 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(OC(F)(F)F)cc1 521729092 ABBULETWKSWOKW-ZDUSSCGKSA-N 394.418 5.018 30 20 GKED C[C@@H](NCc1csc(-c2cccc(Br)c2)n1)c1ccc(C#N)cc1 522197669 YGHOSUAMOZDCNC-CYBMUJFWSA-N 398.329 5.295 30 20 GKED CC(C)C[C@H]1CCCCCN1C(=O)c1ccc(COc2ccccc2C#N)o1 524847170 KGBCRGGHLOVAHG-LJQANCHMSA-N 380.488 5.161 30 20 GKED Cc1cc(C(=O)NC[C@H](C)C#N)ccc1N[C@H](C)c1cc(Cl)ccc1Cl 530642780 HFICTBZWBBMLDF-TZMCWYRMSA-N 390.314 5.364 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)NCc1cc(Cl)sc1Cl 536148146 AZUMYKZROKJOOD-LSDHHAIUSA-N 394.327 5.036 30 20 GKED C[C@H](N[C@@H](C)c1nnc(-c2ccccc2)o1)c1ccc(-c2cccc(C#N)c2)cc1 541076903 HEHATEJYXUDQGW-ROUUACIJSA-N 394.478 5.687 30 20 GKED CSCc1cnc(CN[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)s1 549804410 GEBUZDGINZQJIF-OAHLLOKOSA-N 379.554 5.396 30 20 GKED C=CCC[C@@H](NC(=O)[C@@H]1CCCc2cccnc21)c1ccc(C(F)(F)F)cc1 551611223 XBVPIUCUJJOTFQ-RTBURBONSA-N 388.433 5.344 30 20 GKED C[C@@H](c1noc(-c2cn(CCCC#N)c3ccccc23)n1)c1c(F)cccc1F 561895431 WAALCMLOFCVQEP-CQSZACIVSA-N 392.409 5.425 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(C)(C)[C@@H]1c1cccs1 562174233 IWRGNPKWWFYJMW-KDOFPFPSSA-N 385.558 5.757 30 20 GKED Cn1ccc([C@H](N[C@@H]2CCCCc3cc(C#N)ccc32)c2ccc(Cl)cc2)n1 564813587 FSWRQNRRVKEYQC-FYYLOGMGSA-N 390.918 5.092 30 20 GKED CCc1ccccc1NC(=O)C1(C)CCN(c2ccc(Cl)cc2C#N)CC1 588815565 ACVNSJUWLZSQFK-UHFFFAOYSA-N 381.907 5.019 30 20 GKED O=C(Nc1cc(F)ccc1Cl)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 590255029 LRDFCSZWKDCDHL-UHFFFAOYSA-N 385.666 5.769 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2sc3cc(C)ccc3c2Cl)cc1 591119291 RKAROJATIPSLPZ-UHFFFAOYSA-N 399.903 5.423 30 20 GKED CC1(C)CCc2nc(NC(=O)c3c(Cl)cc(C#N)cc3Cl)sc2C1 591324062 LIJCBXIXLNUHGI-UHFFFAOYSA-N 380.300 5.089 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc4cc(F)ccc4s3)cn2)c1 603627223 WICFOQZMUUIMJR-UHFFFAOYSA-N 389.411 5.352 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 603996650 MWKFBPDJYFYIPG-UHFFFAOYSA-N 395.553 5.022 30 20 GKED N#C[C@@H](Cc1ccccc1)Sc1ncnc2scc(-c3ccc(F)cc3)c12 604045228 KGEDSTWXRJUPSL-QGZVFWFLSA-N 391.496 5.724 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 608782287 JTTZAQPGIVYYEI-GOSISDBHSA-N 389.503 5.008 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cccc(F)c3)cc2Cl)c1 609062772 HEWVSWFCOAKXSI-UHFFFAOYSA-N 380.806 5.182 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)[C@@H](C)c1cccs1 609967857 LTDPFFSDYLQTHB-INIZCTEOSA-N 378.472 5.404 30 20 GKED C[C@@H](CC(=O)Nc1cccc(OCCCC#N)c1)c1cccc(C(F)(F)F)c1 609968520 MYMYLCYVVQISRE-HNNXBMFYSA-N 390.405 5.520 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NCc1ccc(C#N)c(Cl)c1 619754624 GEJVDMXWGQMVHG-GFCCVEGCSA-N 385.895 5.634 30 20 GKED O=C(N[C@@H](CC(F)(F)F)c1ccc(F)cc1)c1cccc(OC(F)(F)F)c1 622477766 KKNDOTMXFRHRON-AWEZNQCLSA-N 395.274 5.148 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc(OCCC)c(F)c1 627048183 URIPNYYSVWVOHO-UHFFFAOYSA-N 388.487 5.002 30 20 GKED C[C@@H](NC(=O)CCCC(=O)c1ccc(Cl)c(Cl)c1)c1cccc(C#N)c1 677151089 ZKUDQSTULLOWCE-CYBMUJFWSA-N 389.282 5.095 30 20 GKED C=CCn1c(C)nn(CN2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)c1=S 726787127 NMYYGLCOMNHTNV-KRWDZBQOSA-N 396.482 5.112 30 20 GKED Cc1ccccc1C1(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)CC1 727038064 DQFTWXVDNWKTNA-QGZVFWFLSA-N 392.911 5.680 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=S)Nc3ccc4ccccc4c3)c2)cc1 729160502 UAUZNOIWAZWGAK-UHFFFAOYSA-N 395.487 6.313 30 20 GKED C/C(=C/C(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1)c1ccccc1 729369548 HNVIZPGPPCODKT-OFBYCLMTSA-N 382.463 5.050 30 20 GKED N#CCOc1ccc(Cl)cc1CSCCC(=O)Nc1cccc(Cl)c1 735319398 ZNXSNRBFDIGSNK-UHFFFAOYSA-N 395.311 5.158 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=S)NCCOc1ccc(C#N)cc1 741862571 IUAGUTDVHDCKRM-UHFFFAOYSA-N 381.545 5.170 30 20 GKED COc1ccc(Cl)c(NC(=S)Nc2ccccc2SCCC#N)c1 742997497 IRAOMDFUSWPLOT-UHFFFAOYSA-N 377.922 5.163 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H](C)CCc3cccc(F)c3)n2)cc1 744035003 MAUNLGHDNQPLFJ-OXQOHEQNSA-N 392.499 5.703 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)O[C@@H](c3ccccn3)C(F)(F)F)c2)cc1 747353273 DBRRCZTVVNUOKV-IBGZPJMESA-N 398.340 5.206 30 20 GKED Cc1cccc(C)c1NC(=O)CCCON=C(c1ccccc1)C(F)(F)F 751956245 QALLBWIMIHVTIK-UHFFFAOYSA-N 378.394 5.005 30 20 GKED N#Cc1cc(COC(=O)c2sc(-c3ccccc3)nc2C(F)F)ccc1F 761620194 TVIOEVJNIUSWMX-UHFFFAOYSA-N 388.370 5.115 30 20 GKED C[C@H](OC(=O)c1ncccc1C(F)(F)F)c1ccc(F)c(C(F)(F)F)c1 770761855 PVWUNKDWOTXKOC-QMMMGPOBSA-N 381.247 5.176 30 20 GKED CCOc1ccccc1-c1cccc(C(=O)Nc2ccc(F)cc2OCC#N)c1 772273812 ZEJWZYKOVXHQGL-UHFFFAOYSA-N 390.414 5.046 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@H]1NCc1cc(C#N)ccc1F 775413135 WZPRIXMDOIXGPP-ZMZPIMSZSA-N 391.309 5.033 30 20 GKED C=CC[C@H](C(=O)O[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C)c1ccccc1 778416181 DXCHTCYFQYSEPB-RXVVDRJESA-N 379.500 5.349 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccc2oc(CC(C)(C)C)nc2c1 780576133 JSPROFVGCWMCJE-CQSZACIVSA-N 392.459 5.351 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(F)cc1)c1cccs1 780670538 LUYXJHBIIAIDDF-VBKZILBWSA-N 395.459 5.089 30 20 GKED CC(C)(CC(F)(F)F)NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 782015019 YBISYPLOASMFKZ-KRWDZBQOSA-N 375.394 5.195 30 20 GKED N#CCCn1cc(/C=C/c2nc(-c3ccccc3)cs2)c(-c2ccncc2)n1 788349865 MNDQNALYJQBHAS-BQYQJAHWSA-N 383.480 5.153 30 20 GKED CC(C)n1nc(-c2ccco2)cc1NC(=S)Nc1ccc(C#N)c(Cl)c1 788350522 QAEMJDMOVKHAFP-UHFFFAOYSA-N 385.880 5.058 30 20 GKED N#C[C@H](C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)c1nccc2ccccc12 792089866 AVZHFPGTQNDPKC-ILBGXUMGSA-N 390.486 5.828 30 20 GKED C[C@H](Cc1ccc(Br)cc1)C(=O)[C@H](C#N)c1nccc2ccccc12 792108851 ZKLHRYPQTOQEAO-AUUYWEPGSA-N 393.284 5.052 30 20 GKED COc1ccccc1-c1ncc(/C=C/C(=O)c2ccc(-c3ccccc3)o2)cn1 792883821 HGHZHMNIDKPNDA-VAWYXSNFSA-N 382.419 5.308 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)C(C)(C)c2ccc(Cl)cc2F)s1 797572330 XTEPRFACGUFQSZ-LBPRGKRZSA-N 378.900 5.387 30 20 GKED N#Cc1ccc2c(c1)[C@@H](N[C@H](c1ccccc1)c1ccc3c(c1)CCCO3)CC2 810225618 ISNZXZBFFZPKBB-AZGAKELHSA-N 380.491 5.250 30 20 GKED Cc1ccc(C)n1-c1ccsc1C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1 813213082 IOMKFONUFVQFNK-CQSZACIVSA-N 389.402 5.060 30 20 GKED CC(C)[C@H](Sc1ccccc1)C(=O)[C@@H](C#N)c1cc(C(F)(F)F)ccn1 813213615 OMDZQGPGQSSNPZ-YJBOKZPZSA-N 378.419 5.094 30 20 GKED Cc1ccc(Cl)c(NC(=S)N[C@@H](CCCC#N)c2ccccc2)c1Cl 814210210 MOSPSABTJPLHBV-INIZCTEOSA-N 392.355 6.023 30 20 GKED CN(C)c1ccc(CN[C@@H](CCCC#N)c2ccccc2)c(C(F)(F)F)c1 816627714 VEKQHBITNJEVDF-FQEVSTJZSA-N 375.438 5.296 30 20 GKED CC(C)(C)Sc1ccc(-c2noc([C@@H]3C[C@H]3c3cccc(C#N)c3)n2)nc1 842499876 GXJCMZCMULAXGT-DLBZAZTESA-N 376.485 5.165 30 20 GKED N#Cc1cc(NC(=O)N2CCC[C@@]3(C2)CC3(F)F)ccc1Oc1ccccc1 844640002 YGIFZBWJBKCDBQ-FQEVSTJZSA-N 383.398 5.004 30 20 GKED CC(C)(C)OC(=O)N[C@@H](CCCCC#N)c1nc(-c2ccc(Cl)s2)no1 848608329 DOICVFUGNMLJQN-NSHDSACASA-N 396.900 5.101 30 20 GKED C=CC(C)(C)CC(=O)OCc1csc(N(C(C)=O)c2ccccc2CC)n1 884652366 RLANQIQUTUQCDJ-UHFFFAOYSA-N 386.517 5.036 30 20 GKED CC(C)n1ncc2cc(/C=C3/CSc4ccc(F)cc4C3=O)c(Cl)nc21 913617582 KWQZSOHTZZBFIK-MLPAPPSSSA-N 387.867 5.177 30 20 GKED Cc1ccc(C(=O)Nc2sc3c(c2C#N)CC[C@@H](C(C)(C)C)C3)c(Cl)n1 916039485 NAMRUGXPPVBCMO-GFCCVEGCSA-N 387.936 5.380 30 20 GKED Cc1ccc(N(Cc2cccs2)C(=O)CSCc2ccc(C#N)cc2)cc1 918588116 PPFQQZCAFBJGEQ-UHFFFAOYSA-N 392.549 5.395 30 20 GKED C/C=C/COc1ccc(CCC(C)=NNc2c(F)c(F)nc(F)c2F)cc1 920365303 OTBOKODDEUJTES-IAJLZMLQSA-N 381.373 5.014 30 20 GKED CCCc1ccc(C(=O)/C=C\c2ccc(-c3cccc(C(=O)O)c3)s2)cc1 1776112955 QUEVMTQTHGAHHA-QBFSEMIESA-N 376.477 5.962 30 20 GKED C=CCOc1ccc(CNC[C@@H](CC(=O)O)C2CCCCCC2)cc1Cl 1776184045 OANLRKYBDKKRCU-GOSISDBHSA-N 379.928 5.056 30 20 GKED CC(=C/c1ccccc1C(F)(F)F)/C=C1/C[C@H](C(=O)O)c2ccccc2C1=O 1776200188 ZATPSPPPYUXXCP-JQNIQIFBSA-N 386.369 5.490 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C\c2ccc(/C=C/C(=O)O)o2)c2c(c1)C(C)(C)CC2 1776269180 AFUPWWIPYYQNII-PNQPDEHRSA-N 392.495 5.795 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2cc(C(=O)O)c(Cl)s2)cc1Cl 1776388621 UCVZLJPNCDPXMM-SNAWJCMRSA-N 385.268 5.436 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](CC(=O)O)c2ccccc2F)c1 1776788203 YQABJXDAELMGJH-QFIPXVFZSA-N 387.495 5.481 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)Nc1cccc(C#Cc2cccs2)c1 43996092 QZSJDRWAMUZJAJ-OAHLLOKOSA-N 378.522 5.361 30 20 GKED Cc1cc2occ(CC(=O)[C@H](C#N)c3nc4ccccc4n3C(F)F)c2cc1C 51655482 HTACTDZVAQXMKJ-INIZCTEOSA-N 393.393 5.213 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)C(=O)Nc1ccc(F)c(F)c1 60127434 USBKFXFOFHEZSB-CQSZACIVSA-N 393.393 5.068 30 20 GKED CN(C(=O)c1ccc(CSc2nc3ccccc3s2)cc1)C1(C#N)CCC1 66322381 SCKLVOXNNALDNF-UHFFFAOYSA-N 393.537 5.107 30 20 GKED CCn1cc(CC(=O)Nc2ccccc2S[C@@H](C)CC#N)c2ccccc21 66801948 FYKGWXVUOMJPQY-INIZCTEOSA-N 377.513 5.237 30 20 GKED N#CCCn1cc(CNc2ccc3nc(C4CC4)oc3c2)c(-c2ccccc2)n1 152507682 HRJXUVQRUGOGDF-UHFFFAOYSA-N 383.455 5.094 30 20 GKED Cc1nc(C2CCCC2)sc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 173265403 MPVYMELNTYZGNZ-ZDUSSCGKSA-N 385.558 5.756 30 20 GKED C[C@H](C#N)CSc1ccccc1NCc1csc(-c2ccccc2F)n1 179831174 ZSWMIKKQIRBZSV-CQSZACIVSA-N 383.517 5.813 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc2nc(-c3ccccn3)oc2c1 180290868 HPLLZUSCBPQDEA-UHFFFAOYSA-N 390.468 5.171 30 20 GKED CCC(CC)n1nc(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)cc1C 181102019 RKONYUWWKQIDDO-AWEZNQCLSA-N 386.908 5.306 30 20 GKED C[C@@H](C#N)Oc1ccc(CNc2ccc(OCc3cccc(C#N)c3)cc2)cc1 181430265 RHUFTARPEZNJDC-SFHVURJKSA-N 383.451 5.040 30 20 GKED Cc1c(COc2ccccc2)cccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 181528741 SJTDBXYGAWDETA-UHFFFAOYSA-N 382.463 5.382 30 20 GKED Cc1ccccc1COc1ccccc1C(=O)Nc1ccccc1O[C@@H](C)C#N 182084448 UPCPBZAGEJHSBE-SFHVURJKSA-N 386.451 5.117 30 20 GKED C=CCn1c(SCc2coc(-c3ccc(OC)cc3)n2)nc2ccccc21 248182473 FHFUZNYQXLTENZ-UHFFFAOYSA-N 377.469 5.178 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCc1cc(F)ccc1F 303304349 ZJYOIYIWTYXEKB-UHFFFAOYSA-N 393.393 5.259 30 20 GKED Cc1cc2cc(NC(=O)c3cccc(COc4ccccc4C#N)c3)ccc2[nH]1 303619944 WWMHIGJLQCXAPH-UHFFFAOYSA-N 381.435 5.179 30 20 GKED CC1(/N=C(/O)C2CCN(c3noc4ccc(Cl)cc34)CC2)CCCCC1 328855425 TYMRTIMPVJXXSG-UHFFFAOYSA-N 375.900 5.377 30 20 GKED CC1(C)C(O)=Nc2cc(/C(O)=N/[C@@H]3CCCc4cn(C5CCCC5)nc43)ccc21 329053456 RXTWUUGZLSJPMY-GOSISDBHSA-N 392.503 5.260 30 20 GKED Cc1n[nH]c(C)c1[C@H]1CCCN1C(O)=Nc1ccc2oc(CC(C)(C)C)nc2c1 329332590 WRKPWKSZKPUHAC-QGZVFWFLSA-N 395.507 5.139 30 20 GKED C[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)C1 412198916 GHRANBPRTQYWLC-ZQEFQCJFSA-N 398.428 5.290 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 425380561 DFIZJXSOGBBKOG-KGLIPLIRSA-N 375.394 5.041 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](c2ccccc2)C1 433148167 FYPQUGZMSMAKDX-PKOBYXMFSA-N 379.529 5.492 30 20 GKED C[C@@H](NC(=O)N(C)Cc1ccc(C#N)cc1)c1cccc(OCc2ccccc2)c1 433964325 IPPHHQKWFJIXHN-LJQANCHMSA-N 399.494 5.040 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccc(OC2CCCC2)cc1 437861018 SUGPRFIZUQQAMX-PKTZIBPZSA-N 389.499 5.312 30 20 GKED Cc1nc(-c2ccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)cc2)cs1 440490139 UNMHRZVEOXVOTA-CQSZACIVSA-N 393.537 5.765 30 20 GKED COc1ccc(Sc2ccc(NC(=O)NCC3CCC(C#N)CC3)cc2)cc1 440975539 GBXVSELWBKSZCV-UHFFFAOYSA-N 395.528 5.298 30 20 GKED C=C(C)[C@@H](Cc1nc(C2(c3cccc(C(F)(F)F)c3)CCC2)no1)OCC 445527129 DTBWGSUMMSKEIF-MRXNPFEDSA-N 380.410 5.082 30 20 GKED C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3c(F)cc(C#N)cc3F)c2)C1 445960743 QHPOLMXAJWYFEH-RDTXWAMCSA-N 384.426 5.184 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@@H](C)C[C@H](CC(F)(F)F)[C@H]1C 455252295 UDXKWNDHTFURIM-ZMSDIMECSA-N 382.470 6.122 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)C[C@@H](c1ccccc1)C(F)(F)F 461688945 PGVKLIMCSKLLNJ-INIZCTEOSA-N 375.394 5.055 30 20 GKED Cc1ncn(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)c1C 462776003 NFFMWUUTMCRTLE-UHFFFAOYSA-N 392.462 5.280 30 20 GKED Cc1ccccc1N(C(=O)[C@H](C)c1cccc(C#N)c1)c1nc2ccccc2s1 463066089 BDVIELQQIRJEMF-QGZVFWFLSA-N 397.503 5.945 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)o2)cc1 464407802 HOLHWCQKZDFFBS-MRXNPFEDSA-N 398.340 5.053 30 20 GKED CN(CC[C@@H]1CCCO1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 466372826 CMQFMKJEGWKORC-ICSRJNTNSA-N 397.906 5.028 30 20 GKED CC(C)C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1ccccc1 468756521 ADSQZZHBGHVTDJ-QFIPXVFZSA-N 375.516 5.469 30 20 GKED CC[C@@H]1c2ccsc2CCN1C(=O)c1cn(CCCC#N)c2ccccc12 469114180 VSGFAZAOSJZJAG-LJQANCHMSA-N 377.513 5.156 30 20 GKED N#CCCCN1C(=O)CCc2cc(N[C@H](CC3CCC3)c3ccccc3)ccc21 469240733 PWDODKKPAMMGLI-HSZRJFAPSA-N 387.527 5.613 30 20 GKED N#Cc1ccc(CN(C(=O)c2ccc3nc(-c4ccccc4)oc3c2)C2CC2)cc1 474694863 DPEUDSHGQLMBEA-UHFFFAOYSA-N 393.446 5.171 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@H]1CCSc2c(F)cccc21 475580476 YRLMLTLCARUCRB-IBGZPJMESA-N 384.520 6.036 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)cc1 476410569 PAVVGIDNDISAGF-IBGZPJMESA-N 399.441 5.288 30 20 GKED Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)N(CCC#N)CC(C)(C)C)c12 477777035 NIHBZROREUCYEU-UHFFFAOYSA-N 397.567 5.020 30 20 GKED N#C[C@H](C(=O)c1ccc(Sc2ccc(Cl)cc2)o1)c1nc2ccccc2[nH]1 477842606 AVVJLYHOLIAJAM-CQSZACIVSA-N 393.855 5.451 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1c(F)cccc1N1CCCC1 482234819 BNTYRSAZCPERQX-UHFFFAOYSA-N 395.522 5.600 30 20 GKED CN(C(=O)C[C@@H](CC#N)c1ccccc1)[C@H](c1ccc(Cl)cc1)C(F)(F)F 483836071 DEJSOCSGYMAKQH-VQIMIIECSA-N 394.824 5.489 30 20 GKED CC(C)(C)OC1CC(CC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)C1 485856753 SKLNZAIPFZJYIX-UHFFFAOYSA-N 378.472 5.273 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CSCc1ccc2c(c1)CCC2 486223663 PMNONVSAMAZBMU-MRXNPFEDSA-N 396.581 5.299 30 20 GKED C=C[C@H]1CCCCN1C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1CC 489065640 BPJVLICHBCTAKB-HNNXBMFYSA-N 392.425 5.026 30 20 GKED C=CC[C@@H](C(=O)N1CC=C(c2c[nH]c3ccc(OC)cc23)CC1)c1ccccc1 495049532 SWGSWDLGMKQSCV-OAQYLSRUSA-N 386.495 5.152 30 20 GKED Cc1nc(C(F)(F)F)ccc1NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1 512483509 JTHBLHJRZAKSGU-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C[C@@H]1CSc2ccc(Br)cc2[C@H]1N[C@H]1CCc2ccc(C#N)cc21 515924640 HIVUVLTUQBWGIJ-OACQNMCBSA-N 399.357 5.381 30 20 GKED Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1ccccc1SC[C@H](C)C#N 517456253 HNRYGWCYADAIDW-AEFFLSMTSA-N 396.556 5.776 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1 518028920 ASLNPGTUENIZGT-ZWKOTPCHSA-N 380.513 5.030 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)Cc1cc(Cl)ccc1Cl 521327017 MEFDGVOGFTUOEH-GFCCVEGCSA-N 379.312 5.569 30 20 GKED C[C@H]1CCC[C@](C#N)(NC(=O)c2ccc(COc3ccc4ccccc4c3)o2)C1 523966551 ZZIHVVCKJTYUKK-XDHUDOTRSA-N 388.467 5.214 30 20 GKED N#CCC[C@H](NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc1 532670009 QAWRTVNBXANDEW-KRWDZBQOSA-N 386.339 5.859 30 20 GKED C=C[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1OCCOC)c1ccccc1 536087751 IJIVYZGNXJTYGJ-HNNXBMFYSA-N 393.405 5.029 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(C#N)c(F)c2)c2ccc(F)cc2)cc1 537405634 RDLBEXPWGCERCN-WNSKOXEYSA-N 378.422 5.285 30 20 GKED N#CCCn1cc(CN(Cc2ccc(F)cc2)CC2CC2)c(-c2ccccc2)n1 537624324 JLJIVSQBUPHEBS-UHFFFAOYSA-N 388.490 5.015 30 20 GKED N#Cc1ccccc1-c1ccc(CNCc2ccc(OC[C@@H]3CCCO3)cc2)cc1 538003088 VZZHBVWOIDMMTO-VWLOTQADSA-N 398.506 5.073 30 20 GKED Cc1ccc(-c2nnc(CSc3ccc(C#N)c(C(F)(F)F)c3)o2)cc1 542003647 BNQAIDVZHJWBIJ-UHFFFAOYSA-N 375.375 5.228 30 20 GKED C=CCC[C@H](NC(=O)N(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1 543668040 LKEAABWJYWFWHL-XPWALMASSA-N 396.506 5.395 30 20 GKED N#CCc1ccc(OCc2cccc(NC(=O)Cc3coc4ccccc34)c2)cc1 551933487 HCFYHZRFVURTCR-UHFFFAOYSA-N 396.446 5.259 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(c3c[nH]c4ccc(F)cc34)CC2)c1 558329967 BFTBGIJDIQUOEU-UHFFFAOYSA-N 393.462 5.283 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCCN(C)c2ccccc21 560400086 OKNHHTBVKKLNBW-AEFFLSMTSA-N 394.544 5.174 30 20 GKED Cc1cc2cc(CNC(=O)Nc3ccccc3S[C@@H](C)CC#N)ccc2[nH]1 562166209 BJIIQEGXLKLWQY-HNNXBMFYSA-N 378.501 5.192 30 20 GKED C[C@@H](CC(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1ccc(F)cc1F 564522642 ZUWKSTUZKFMJIL-AWEZNQCLSA-N 393.393 5.156 30 20 GKED COc1cccc(C2(c3noc(-c4cn(CCCC#N)c5ccccc45)n3)CC2)c1 570970911 LQBPKPNDGNZHNG-UHFFFAOYSA-N 398.466 5.084 30 20 GKED N#CC1(c2nc(-c3cccc4sc(C(F)(F)F)nc34)no2)CCCCC1 571307012 YCOGGAMDZZNUNB-UHFFFAOYSA-N 378.379 5.091 30 20 GKED Cc1ccc(SCCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)cc1 580983452 FZZCHKBLZAXYSX-UHFFFAOYSA-N 389.480 5.175 30 20 GKED CC(C)(C#N)c1ccc(C(=O)N2CC[C@H](Sc3cccc(Cl)c3)C2)cc1 590019602 DJZXWWGLRFWDAC-IBGZPJMESA-N 384.932 5.148 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCc1cccc(OC2CC2)c1F 596733876 AFWQIGKGKJAERC-AWEZNQCLSA-N 399.491 5.083 30 20 GKED COC(=O)c1c(Cl)c(Cl)cc(Cl)c1OCc1ccc(C#N)cc1F 599985527 FAAPBBSAOSWYCL-UHFFFAOYSA-N 388.609 5.023 30 20 GKED CN1c2ccccc2C(=O)N(c2ccccc2Cl)C12CCC(C)(C#N)CC2 602763692 ZVNGGXIPCMWEMZ-UHFFFAOYSA-N 379.891 5.237 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)N(C)Cc2ccsc2)cc1 604562021 AUFMBAKCBISZEL-UHFFFAOYSA-N 393.468 5.085 30 20 GKED Cc1cccc(COc2ccc([C@H](C)NC(=O)C3(C#N)CCCCC3)cc2)c1 609033513 ZJGJEHFQEBHGNR-IBGZPJMESA-N 376.500 5.225 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1ccc(Br)cc1F 609384758 QNDMJZOEUFERPA-LBPRGKRZSA-N 379.298 5.452 30 20 GKED CSc1cccc(N(C)C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)c1 609503663 HJWCHDVZGJIGIL-UHFFFAOYSA-N 388.492 5.543 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc2oc(C(C)C)nc2c1 609810510 WBZMUVBHIDLFOO-UHFFFAOYSA-N 376.460 5.267 30 20 GKED CCN(C(=O)c1sc2ccc(OC)cc2c1C)[C@@H](C)c1ccc(C#N)cc1 610226924 SESYKPUSXFAYGC-HNNXBMFYSA-N 378.497 5.313 30 20 GKED N#Cc1cc(Cl)c(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c(Cl)c1 611093140 GNSMNAAQYDQKOV-UHFFFAOYSA-N 393.579 5.790 30 20 GKED N#C[C@H](C(=O)c1sc2cccc(Cl)c2c1Cl)c1ccc2ccccc2n1 613292583 OYARPZZMNANEFS-LBPRGKRZSA-N 397.286 6.246 30 20 GKED C[C@H](NCc1ccc(C(C)(C)C#N)cc1)c1ccc(-c2cccc(C#N)c2)cc1 614182456 SDJKQVLPOQIDCB-IBGZPJMESA-N 379.507 5.877 30 20 GKED Cc1cc(F)ccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 676393903 OYEBLPARPVOWOE-CYBMUJFWSA-N 378.350 5.253 30 20 GKED N#C[C@@H](C(=O)c1ccccc1CCC(F)(F)F)c1nc2cc(F)ccc2s1 677564480 ORWNTMKDMBQJIP-AWEZNQCLSA-N 392.377 5.420 30 20 GKED C=CCOc1ccc(/C=C2\SC(=S)N([C@@H](C)c3cccs3)C2=O)cc1 726629164 JGZCAAYEILYMEG-IGWPVBGESA-N 387.551 5.275 30 20 GKED C[C@@H]1C[C@H](CC(=O)[C@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC(C)(C)C1 727631425 DYAVNCLYEYIIEA-SUMDDJOVSA-N 391.540 5.711 30 20 GKED Cc1cc(-c2ccccc2)ccc1NC(=O)[C@@H]1CCCN1c1ccc(C#N)cc1 728163903 DBAIKOXHNMECOI-DEOSSOPVSA-N 381.479 5.141 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCc2ccc3ccccc3c2)cc1 729553501 RAZNARUCFMBTES-RUZDIDTESA-N 391.474 5.817 30 20 GKED Cc1ccc(Oc2ccccc2CNC(=O)Nc2cccc(OCC#N)c2)cc1 730128751 ADRFTKNJJRUMHW-UHFFFAOYSA-N 387.439 5.011 30 20 GKED C#Cc1cccc(NC(=S)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)c1 730735276 PGBVSWPYJHHNQD-INIZCTEOSA-N 391.565 5.456 30 20 GKED C=CCN(C(=O)Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1)C(C)C 731754939 MYSXBXVKZZBZEO-JOCHJYFZSA-N 391.515 5.092 30 20 GKED N#Cc1ccc(NC(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)nc1 731989076 NTUPTJLQSLSNMB-UHFFFAOYSA-N 390.855 5.136 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(-c2nc(-c3cccc(N)c3)no2)c1 734976258 PMRYRPCJSNGQLT-UHFFFAOYSA-N 388.814 5.303 30 20 GKED Oc1c(Cl)cc(Cl)cc1/C=N\C[C@@H](O)c1cc(Cl)cc(Cl)c1 735618865 GOLNYHRJYHVIKG-VPNRLQGLSA-N 379.070 5.158 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1/C=C\C(=O)c1cccc(-c2ccncc2)c1 741471553 BJIQBGKEVKFYKL-QXMHVHEDSA-N 393.490 5.506 30 20 GKED Cc1ccccc1[C@@H](OC(=O)[C@@H](C)Oc1ccc(C#N)cc1)c1cccs1 748501828 FLEPAGOBRDJOGQ-IIBYNOLFSA-N 377.465 5.028 30 20 GKED N#Cc1ccsc1C(=O)O[C@@H](c1ccccc1C(F)(F)F)C(F)(F)F 750219023 REBPATWDCAOMFH-LBPRGKRZSA-N 379.281 5.099 30 20 GKED O=C(/C=C\c1ccc(-c2cccc(F)c2)s1)c1cccc(N2CCOC2=O)c1 750913154 KSIWCLPDWZOAJL-CLFYSBASSA-N 393.439 5.407 30 20 GKED COc1ccccc1-c1ccc(C(=O)/C=C/c2cnc(-c3ccccn3)s2)cc1 753144968 SFVWWQQUHCQGLZ-BUHFOSPRSA-N 398.487 5.777 30 20 GKED CN1C(=O)CCc2cc(C(=O)/C=C\c3cc(C(F)(F)F)ccc3Cl)ccc21 754690413 VFKQGUWRVIHZOJ-BAQGIRSFSA-N 393.792 5.164 30 20 GKED N#C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 756515245 LEIPNDSDVGTIBW-AYDFFVQHSA-N 393.314 5.247 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)COC/C=C/c2ccccc2)cc1 763259403 JHCOMGSEUORCEL-VFUOJUBFSA-N 382.463 5.011 30 20 GKED COc1cccc(NC(=O)c2ccc(Sc3ccccc3C#N)cc2)c1F 770069626 NOLWKLSRGPUPIK-UHFFFAOYSA-N 378.428 5.109 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Cl)c(Cl)cc2O)c1 774246458 ZTROVPWSRPFBEO-TZMCWYRMSA-N 379.287 5.231 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C 780667868 NTYZARWEGNFYBC-MJPMAJQWSA-N 383.879 5.150 30 20 GKED O=C(/C=C\c1ccc2cnccc2c1)c1ccc(OC(F)F)cc1OC(F)F 782305529 JAFMOYKCTXHXCK-KXFIGUGUSA-N 391.320 5.334 30 20 GKED Cc1noc(C2CC2)c1C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 783965606 INZCNPVIONLZSS-UHFFFAOYSA-N 395.406 5.137 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)Sc1nc2ccccc2s1 789719460 QOUWGRRATOMPCW-HNNXBMFYSA-N 396.581 6.268 30 20 GKED Cc1sc(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)nc1C(C)C 789896578 WPMOHDYZMSDSQS-FQEVSTJZSA-N 389.524 5.412 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(C)(c2cccc(Cl)c2)CC1)c1ccncc1 793030365 UNLHEWPKRRXSKW-HXUWFJFHSA-N 383.923 5.116 30 20 GKED Cc1ccc(CNCc2cccc(-c3ccc(C#N)s3)c2)c(-c2cnn(C)c2)c1 801722829 KUZLJJYBHWPBTF-UHFFFAOYSA-N 398.535 5.286 30 20 GKED N#Cc1ccc(N2CCC(c3nc(-c4cccc(C(F)F)c4)no3)CC2)c(F)c1 809479774 AUXCTVMLAURULZ-UHFFFAOYSA-N 398.388 5.069 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2cnccc2C(F)(F)F)s1 846802438 ZIRWOXUGKHGMMY-UHFFFAOYSA-N 386.443 5.107 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=S)Nc2ccc3ccccc3c2)cc1 915999144 HPKFEBZXXRGUOV-DEOSSOPVSA-N 393.515 6.304 30 20 GKED N#C[C@H](C(=O)Cc1c(Cl)cccc1Cl)c1nc2cc(Cl)ccc2s1 917043636 LLBDQYAFMHACDV-LLVKDONJSA-N 395.698 5.675 30 20 GKED C=CCN(Cc1ccccc1F)C(=S)NCCSc1ccc(Cl)cc1 918164604 VWWIQIAEBMVUGA-UHFFFAOYSA-N 394.968 5.134 30 20 GKED O=C(O)c1cc2c(C=NNc3ccccc3OC(F)(F)F)c(F)ccc2s1 1776056337 CNJIZKSMKOUCTQ-UHFFFAOYSA-N 398.337 5.083 30 20 GKED CC(=NNc1ccc(C(=O)O)c(F)c1)c1ccc(OCc2cccc(C)c2)cc1 1776074187 MOELBCQWWXVUCB-UHFFFAOYSA-N 392.430 5.247 30 20 GKED CC1(C)Sc2ccccc2C(=O)/C1=C/c1c(F)ccc2sc(C(=O)O)cc12 1776573062 NAVLMPHKDQSWSA-ZROIWOOFSA-N 398.480 5.889 30 20 GKED O=C(O)CCOc1ccccc1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 1777640926 DKSHKLBRDGEWCM-LUAWRHEFSA-N 386.403 5.336 30 20 GKED CC(C)(C#N)c1ccc(N[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1 28373767 JCPFVANIMBVJNG-QFIPXVFZSA-N 387.458 5.419 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1sccc1C#N 52032912 BMOSZJODAXIZRI-UHFFFAOYSA-N 382.416 5.121 30 20 GKED CCn1c(C)cc(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)c1C 58426896 NKGVDFAIGWGTHX-UHFFFAOYSA-N 387.483 5.022 30 20 GKED N#Cc1ccc(CSCc2coc(-c3ccc(Br)cc3)n2)cc1 63650949 FKBAYPHAVJNJJU-UHFFFAOYSA-N 385.286 5.409 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@H]1CCc1ccccc1 66954608 WZWQBYOXTBEAIS-ICSRJNTNSA-N 393.556 5.710 30 20 GKED CC(C)(C#N)NC(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1 124358133 UHXBLMWKQDMQLF-UHFFFAOYSA-N 384.888 5.410 30 20 GKED CC(C)n1ncc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1C1CC1 152512623 DXAREGDRGGKHDX-UHFFFAOYSA-N 386.455 5.258 30 20 GKED C=C(C)COc1cc(CNc2cccc(NC(=O)CCC)c2C)ccc1OC 157540631 CDMQHBDJYOTAHM-UHFFFAOYSA-N 382.504 5.309 30 20 GKED N#Cc1csc(CNCc2ccccc2-c2ccc(CN3CCCC3)cc2)c1 177684269 JPWCVBQZYDTZFX-UHFFFAOYSA-N 387.552 5.172 30 20 GKED C[C@@H](c1cccs1)N(C)C(=O)NCc1ccc(-c2ccccc2C#N)cc1 179867671 WKBWOPAASMHRLK-INIZCTEOSA-N 375.497 5.189 30 20 GKED C[C@H](NCc1ccc(-c2ccccc2C#N)cc1)c1cccc(N2CCOC2=O)c1 180220465 OHRFSDDEMOEJHK-SFHVURJKSA-N 397.478 5.033 30 20 GKED COc1cccc(F)c1NC(=O)c1ccc(Sc2ccccc2C#N)cc1 184501967 XFOYGOJSTSKTRT-UHFFFAOYSA-N 378.428 5.109 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)ccn1 192943419 MYPSKYVHTAFHTI-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#CCCCOC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CCC2 208464918 GQJAKYZAJPHDQB-NXVVXOECSA-N 388.492 5.634 30 20 GKED CC(C)n1cc(C(=O)/C=C\c2csc(COc3ccc(Cl)cc3)n2)cn1 255372031 NTXXTJATIDENNG-YVMONPNESA-N 387.892 5.049 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1c(F)cccc1Oc1ccccc1 261465719 YHZKYGCMKRYGRL-UHFFFAOYSA-N 375.403 5.154 30 20 GKED N#Cc1ccc(Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)nc1 301092456 TXZFNHJIWQYCJL-UHFFFAOYSA-N 393.469 5.014 30 20 GKED O/C(=N/[C@H]1CC12CCCCC2)C1CCN(c2noc3ccc(Cl)cc23)CC1 329044958 UNOMUPSWDLMMNY-SFHVURJKSA-N 387.911 5.377 30 20 GKED CC(C)[C@H](/N=C(/O)C1CCS(=O)(=O)CC1)c1ccc(C2CCCCC2)cc1 329253430 WDBXABKGFZXKNG-NRFANRHFSA-N 391.577 5.213 30 20 GKED OC1=N[C@H](/C(O)=N/[C@H](c2ccc(Br)cc2)C2CCC2)CCCC1 329867211 VRCRPLPZHSYKNA-RDJZCZTQSA-N 379.298 5.146 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CCCCC(=O)c1ccc(F)cc1 426992042 PPRXJYLWWNWPJD-INIZCTEOSA-N 398.503 5.459 30 20 GKED CC(C)(C)c1cnc([C@@H](C#N)C(=O)c2occc2COc2ccccc2)s1 430599573 WFOPZDDZUYOFPZ-INIZCTEOSA-N 380.469 5.103 30 20 GKED N#CCSc1cccc(-c2nc(-c3cccc(CN4CCCCC4)c3)no2)c1 430989919 UTDZLKRIPKTSJR-UHFFFAOYSA-N 390.512 5.005 30 20 GKED C=CC1CCN(C(=O)Nc2ccccc2SCc2ccccc2OC)CC1 431732265 DTWPCZOCSBMDKC-UHFFFAOYSA-N 382.529 5.417 30 20 GKED Cc1oc(C#N)cc1C(=O)Nc1ccc(F)cc1-c1nc2ccccc2s1 435699291 ZLGBZDLZIVMHNM-UHFFFAOYSA-N 377.400 5.128 30 20 GKED C[C@@H](OCc1ccccc1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437503531 RXHCYEOJOCYOCA-MRXNPFEDSA-N 390.414 5.033 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1 438403049 ULAAUGIMUNEFKT-UHFFFAOYSA-N 399.903 5.809 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2OC(F)F)C(F)(F)F)c(Cl)c1 439432961 XKYOWACYWPVXMR-HNNXBMFYSA-N 390.739 5.206 30 20 GKED Cc1cccc(Cl)c1NC(=O)c1cccc(COc2cccc(C#N)c2)c1 443105967 CPOHIGNSTLRLLR-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)c1cn(CCCC#N)c2ccccc12 444274001 WCCNPEYNSPYIAF-UHFFFAOYSA-N 394.478 5.568 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NCc1ccc(C#N)cc1Br 444775990 BSVLWJCRMJIMTB-KRWDZBQOSA-N 397.238 5.413 30 20 GKED Cc1oc(-c2ccccc2)c(C(=O)Nc2ccccc2SC[C@H](C)C#N)c1C 445830020 OSJCFLAAPMUXKX-OAHLLOKOSA-N 390.508 6.068 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)Nc3ccc(CC#N)cc3Cl)c12 452645009 MCYYXAZIPVQXCG-UHFFFAOYSA-N 394.862 5.024 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccc(F)cc1OCC(F)F)c1ccccc1 455078269 UNXQTWJTLQJVHN-INIZCTEOSA-N 391.393 5.026 30 20 GKED CCCN(C(=O)Nc1ccc(CC#N)cc1Cl)[C@@H](C)c1ccccc1OC 455707460 RMXYOYZXSGFRAP-HNNXBMFYSA-N 385.895 5.420 30 20 GKED Fc1cc(NCCOCC(F)(F)F)ccc1Oc1ccc(C(F)(F)F)cn1 462235395 UBCUSADJZRUCRM-UHFFFAOYSA-N 398.278 5.023 30 20 GKED Cc1nc(CNC(=O)c2cccc(Oc3cccc(Cl)c3C#N)c2)sc1C 464947452 FDWKBPKSZUVXQB-UHFFFAOYSA-N 397.887 5.007 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NC[C@@]1(C)CCCS1 467915286 CPQGIMRKCYUIIZ-OAQYLSRUSA-N 381.501 5.066 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1C[C@H](C)CC1(C)C 472726082 RHCUIXUJGLTXTA-MRXNPFEDSA-N 377.488 5.098 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1 474418219 RYBZOHIYEVRCQO-UHFFFAOYSA-N 380.451 5.283 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)Nc3ccc(F)cc3F)cc2F)c1 477822610 JSTUPQBFWONKOR-UHFFFAOYSA-N 397.356 5.199 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2ccc(CNc3ccccc3)cc2)c1 478808870 BZGNWASCTUNFCV-UHFFFAOYSA-N 399.494 5.358 30 20 GKED C=C(C)[C@H](NC(=O)c1ccc(OC)c(-c2ccccn2)c1)c1ccc(F)c(F)c1 478920227 FMZLDFOFSAAUGG-QFIPXVFZSA-N 394.421 5.083 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H](c1ccccc1)C(C)(C)C 480569737 PXIXXLKMXFHBBN-NRFANRHFSA-N 382.552 5.339 30 20 GKED C=C(C)[C@H](NCC(=O)Nc1c(C)cc(C)cc1Cl)c1ccc(F)c(F)c1 481597484 XLFPSABISKQLSF-IBGZPJMESA-N 378.850 5.081 30 20 GKED N#CCCn1cc(CN[C@H]2CC[C@@H](c3ccccc3F)C2)c(-c2ccccc2)n1 481812269 CPYDNEVHTPUGMK-CTNGQTDRSA-N 388.490 5.029 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccncc2)c(Cl)c1)c1nccc2ccccc12 483191681 FYBGJPRKPWYXQQ-IBGZPJMESA-N 399.837 5.566 30 20 GKED Cc1ccc(-n2ncc(C(=O)[C@H](C#N)c3nccc4ccccc34)c2C(C)C)cc1 483213835 WDGTZHWRMMBDKJ-OAQYLSRUSA-N 394.478 5.342 30 20 GKED C=CCN(CCOC)C(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 483691035 ICKXHMNNCPRWGJ-CYBMUJFWSA-N 390.471 5.262 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1ccc(C#N)s1 486666603 RYWZZYJEGFVWKA-UHFFFAOYSA-N 382.416 5.121 30 20 GKED N#CCCC[C@H](NC(=O)c1csc(-c2ccc(F)cc2)n1)c1ccccc1 487252170 PPZQJTTYYHPURF-SFHVURJKSA-N 379.460 5.114 30 20 GKED N#Cc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2SCC(F)F)s1 487584530 LNUKZVSJGRIZRV-UHFFFAOYSA-N 392.374 5.248 30 20 GKED COc1cc(C)cc(NC(=O)c2ccccc2Sc2ccccc2C#N)c1C 488163049 OCYJJMJVCWWHRV-UHFFFAOYSA-N 388.492 5.587 30 20 GKED Cc1cc(F)ccc1C1CCN(C(=O)N[C@@H](CCC#N)c2ccccc2)CC1 489786138 NBUIDTCVBAPTJR-QFIPXVFZSA-N 379.479 5.068 30 20 GKED N#Cc1ccc(NC(=O)N2CCC(F)(c3ccccc3C(F)(F)F)CC2)cc1 500089004 LWQWXSVYSZQBSR-UHFFFAOYSA-N 391.368 5.070 30 20 GKED CC(C)(CNCc1cn(CCC#N)nc1-c1ccccc1)c1ccccc1Cl 500895998 KGTYGFODIVSTKR-UHFFFAOYSA-N 392.934 5.185 30 20 GKED CC(C)[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)c1ccc(F)cc1 502576032 RMAYPFHEUCMEQN-AOMKIAJQSA-N 399.535 5.145 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2ccccc2-c2ccccc2)cc1 502659942 GJPDIQUWTLQIHD-UHFFFAOYSA-N 386.455 5.305 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)[C@](C)(C#N)CC(=O)OC(C)(C)C)c(C)c1 503055187 OKHMPSGVKFSGQA-VFNWGFHPSA-N 390.549 5.086 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 511545915 OEBDWPIKNJRFAZ-GOSISDBHSA-N 380.385 5.217 30 20 GKED C[C@@H](CC#N)NC(=O)c1cccc(CSc2cc(Cl)ccc2Cl)c1 512023685 JUOIHJKNVOMUAW-LBPRGKRZSA-N 379.312 5.318 30 20 GKED C=CCN(Cc1ccccc1)C(=O)N[C@@H](C)c1ccc(Oc2cccnc2)cc1 514184534 VPPOJHPODZNFQO-IBGZPJMESA-N 387.483 5.333 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Nc2cccc(OCc3cccc(C#N)c3)c2)c1 515759079 GRDJTTLEWXXJBB-LJQANCHMSA-N 399.494 5.193 30 20 GKED C[C@H]1C[C@H]1c1ccc(CNC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)o1 517652785 AOJOBESPHCUIFW-KSFYIVLOSA-N 386.451 5.191 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc4ccccc4c3)n2)cc1 518516779 YDTYNVDLPHMIFO-HXUWFJFHSA-N 384.460 5.462 30 20 GKED N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCC[C@H]2c2ccsc2)cc1 518548829 OTZCZPDPTGXGMY-FQEVSTJZSA-N 392.455 5.528 30 20 GKED C=CCOc1cccc(CN[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)c1 520203098 HRFBPVIGZMJIAL-GOSISDBHSA-N 381.516 5.432 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cncc(C(F)(F)F)c3)c2)cc1 521937377 CNDLMTPBNIDNOB-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H]3c3cccs3)c2)c1 522306469 RYBWAIFLYBRNND-NRFANRHFSA-N 388.492 5.176 30 20 GKED C[C@H](C#N)CNC(=O)c1cccc(CSc2cc(Cl)cc(Cl)c2)c1 525059353 FMVSKJNFMLNIMY-GFCCVEGCSA-N 379.312 5.175 30 20 GKED C=CCCCCCN(C)C(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1 525475419 MMRPGTFVEXIJNH-UHFFFAOYSA-N 379.504 5.457 30 20 GKED N#CC[C@@H](CC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 527229202 DKZIAPMRJPCKIK-AVRDEDQJSA-N 378.472 5.180 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)NC[C@H](C)C#N 532057068 REVCGXOSSHVAFI-CQSZACIVSA-N 393.466 5.013 30 20 GKED N#Cc1cc(C(=O)Nc2ccc(Cl)cc2OCC(F)(F)F)ccc1Cl 537583139 GNYJXMXLLCVMFJ-UHFFFAOYSA-N 389.160 5.058 30 20 GKED C[C@@H](NCC#Cc1cccc(Cl)c1)c1ccc(OCc2cccnc2)cc1 538124343 ILRFGTMMMAQDDU-GOSISDBHSA-N 376.887 5.016 30 20 GKED C=CCCOCCCCC(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1 540490282 AKJTZKAUIDQBQD-DEOSSOPVSA-N 377.528 5.118 30 20 GKED Cc1cccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)c1 542372322 INPIBYWURYWYFH-PKOBYXMFSA-N 379.529 5.411 30 20 GKED C[C@H]1CCc2c(sc(NC(=O)c3ccc(Cl)cc3C(F)(F)F)c2C#N)C1 547429412 MIRGECBKRIVINL-VIFPVBQESA-N 398.837 5.669 30 20 GKED N#C[C@@H](C(=O)c1cnc(OC2CCCCC2)c(Cl)c1)c1nc2ccccc2o1 551795026 LCRRCYNRPKHIPI-HNNXBMFYSA-N 395.846 5.078 30 20 GKED Cc1c(C(=O)N2CCCCC[C@@H]2[C@@H]2CCCCC2=O)sc2ccc(C#N)cc12 551798424 VVPFBYRPYGZWOM-PKOBYXMFSA-N 394.540 5.226 30 20 GKED C[C@@H](NCc1ccc(C(F)(F)F)cn1)c1ccc(-c2cccc(C#N)c2)cc1 560162083 JKLGACFHIDZLAT-OAHLLOKOSA-N 381.401 5.490 30 20 GKED N#Cc1ccc2c(c1)[C@H](N[C@H]1CCCc3sc(-c4ccc(F)cc4)nc31)CC2 568453021 YIBZCNOCIRZEEY-UXHICEINSA-N 389.499 5.475 30 20 GKED N#CC1(c2ccccn2)CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 580760672 VMVWULHLZGOOFA-QHCPKHFHSA-N 387.914 5.382 30 20 GKED Cc1[nH]c2ccc(C(=O)Nc3ccc(Oc4ccnc(C#N)c4)cc3)cc2c1C 583353217 HVQQYZYJWBJBOX-UHFFFAOYSA-N 382.423 5.096 30 20 GKED N#C[C@H](C(=O)c1cccc(Oc2ccccc2)c1)c1nc2cc(F)ccc2s1 592973625 CLKBOLUBMOQJJJ-GOSISDBHSA-N 388.423 5.718 30 20 GKED N#CC[C@@H]1CCCN(C(=O)N[C@H](CCCc2ccccc2)c2ccccc2)C1 596101169 CTOKQVSHEKVQIO-JTHBVZDNSA-N 375.516 5.086 30 20 GKED COc1ccc(CN[C@@H]2CCCc3ccc(Cl)cc32)cc1OCCCC#N 599024017 XKXXGQOGRYBWDR-HXUWFJFHSA-N 384.907 5.198 30 20 GKED O=C(Nc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1ccc(F)cc1F 605482384 QOOPKNZASOJHMI-UHFFFAOYSA-N 399.237 5.177 30 20 GKED C[C@@H](Cc1ccsc1)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1 609209090 ANLUPYSTOXAOLF-HNNXBMFYSA-N 377.469 5.165 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](Cc1ccccc1)C1CC1 609930277 XSVGZNAHQJFQJA-UZLBHIALSA-N 379.529 5.224 30 20 GKED C[C@H](N[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1)c1cccc(C#N)c1 610343999 YDWPOFZQOROGSA-QWHCGFSZSA-N 386.377 5.039 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(c2ccc(F)cc2)CC1 619126455 TXLMCMVUZULUOB-UHFFFAOYSA-N 385.323 5.027 30 20 GKED O=C(Nc1cccc(C#Cc2cccs2)c1)c1ccc(-c2ccccc2)nc1O 643137333 PTWXZCUEROGEIL-UHFFFAOYSA-N 396.471 5.168 30 20 GKED C[C@H](C(=O)N(CCC(F)(F)F)CC(F)(F)F)c1ccccc1C(F)(F)F 684161664 ZBKQSXAXKDXMRU-VIFPVBQESA-N 395.265 5.152 30 20 GKED COc1ccc([C@@H](NCc2ccc(O[C@H](C)C#N)cc2)c2ccc(C)cc2)cc1 728712073 UQZZRVMPZITNCZ-CLOONOSVSA-N 386.495 5.174 30 20 GKED N#CCCSc1ccccc1NC(=S)Nc1cc(Cl)cc(Cl)c1 730952982 HRULLCHOLZJFPJ-UHFFFAOYSA-N 382.341 5.808 30 20 GKED C[C@H](Cc1ccccc1)C(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 732596300 PDNLTSLIJBNXBA-DOMZBBRYSA-N 388.414 5.370 30 20 GKED O=C1/C(=C/c2csc(COc3ccc(Cl)cc3)n2)Cc2cc(F)ccc21 734305451 VVIBDRZXXOVTIS-UKTHLTGXSA-N 385.847 5.337 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1 740430438 NQGPLOXMQFTQNQ-UHFFFAOYSA-N 389.524 6.040 30 20 GKED O=C(/C=C\c1ccc(Cl)s1)c1ccc(S(=O)(=O)C2CCCC2)cc1 741447567 OLDBWJSMMPWEPN-XFFZJAGNSA-N 380.918 5.014 30 20 GKED CCN(C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1ccc(C#N)cc1 742222987 CHUAYKOLHIXUIH-UHFFFAOYSA-N 395.437 5.579 30 20 GKED CCc1ccc(NC(=S)Nc2ccc(Oc3ccccc3C#N)c(F)c2)cc1 743035306 GGTNQRHIWBIXRY-UHFFFAOYSA-N 391.471 5.861 30 20 GKED CC(=O)N(c1ccc(C)c(C)c1)c1nc(C=NNc2ccc(F)cc2C)cs1 750938439 HSOCLDYWAHCLDG-UHFFFAOYSA-N 396.491 5.338 30 20 GKED C=CC[C@@H](NC(=O)N1CCc2c(Cl)cc(Cl)cc2[C@@H]1C)c1ccncc1 756041615 YIVUSGAIGANYHK-ORAYPTAESA-N 390.314 5.335 30 20 GKED C=CCC[C@H](NCc1cc(C)c(OCc2ccccc2Cl)c(C)c1)C(=O)O 756387292 LDGNFMUQWVQDLZ-FQEVSTJZSA-N 387.907 5.045 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C/C(=O)c1ccc(Br)cc1Cl 765613246 IRQRVUBNPUZEQO-SNAWJCMRSA-N 394.483 5.039 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(F)cc2C(F)(F)F)cc1 767869214 JOFGFJVDPTZCCC-IBGZPJMESA-N 398.359 5.752 30 20 GKED Cc1ccc(/C=C\C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 773982305 DTNBOZUQUGNYHG-INDRUJQFSA-N 379.872 5.057 30 20 GKED N#CCOc1cccc(NCc2nc(-c3cc(Cl)ccc3Cl)cs2)c1 779585479 CDHCOOFWEIAYIZ-UHFFFAOYSA-N 390.295 5.631 30 20 GKED Cc1noc(C2CC2)c1C(=O)Nc1sc2c(c1C#N)CC[C@H](C(C)(C)C)C2 783745683 SJYMBPASRJXJMT-ZDUSSCGKSA-N 383.517 5.197 30 20 GKED C#CCC1(C(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)CCCCC1 788433789 UMGQOXDRVUJMMT-UHFFFAOYSA-N 384.863 5.098 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(F)(F)Cc2ccccc2)cc1 793045286 YSIINXVPPNNOEV-NRFANRHFSA-N 376.406 5.159 30 20 GKED COCC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(Cl)c(Cl)c1 793565217 GXFDXWFFCKQUQD-VBKZILBWSA-N 393.314 5.324 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@H]1CC(c2ccc(C)cc2)=NO1 800566269 UZNZMBARTJVYTN-HXUWFJFHSA-N 391.515 5.162 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3cc(C4CC4)cnc3Cl)c2C#N)[C@@H](C)C1 839387688 GRQBNNOSPPWTEH-QWRGUYRKSA-N 385.920 5.484 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)C3(C(F)(F)F)CCCC3)n2)cc1 842295163 BHJZGYGQLCZSJA-AWEZNQCLSA-N 394.418 5.118 30 20 GKED COc1cccc(-c2csc(CN[C@@H](CCCC#N)c3ccccc3)n2)c1 894606660 JZRBUAWYASKCOE-FQEVSTJZSA-N 377.513 5.343 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(N3CCCCC3)cc2)cc(Cl)c1OC 916154243 FHDXYQNRDFGJDL-WDZFZDKYSA-N 385.891 5.244 30 20 GKED Cc1cc(OCCCC(=O)[C@H](C#N)c2nc3ccccc3s2)ccc1Cl 916627315 MPFKPQWQNXWEDY-HNNXBMFYSA-N 384.888 5.294 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)n2)cc1 916974396 KICLGYHJDNUBLE-ARFHVFGLSA-N 392.446 5.664 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCCOCCc2ccccc2)cc1 917119558 MGXNXKKPHZCXQQ-RUZDIDTESA-N 398.506 5.320 30 20 GKED C=CCOc1ccccc1/C=C1\SC(=S)N([C@@H](C)c2ccccc2)C1=O 917643616 HMNGBOOONJBIEP-NOMGLIDZSA-N 381.522 5.214 30 20 GKED CCCCCCCCCN(C)C(=O)c1cc2c(C(F)(F)F)cc(O)nc2o1 918686769 XCKKSFOISQABIU-UHFFFAOYSA-N 386.414 5.375 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3ccc(F)cc3F)cc2)c1 1776125883 VRPGGTYWPLFFMK-IZZDOVSWSA-N 378.374 5.155 30 20 GKED Cc1cc(C)c(C(=O)O)cc1/C=C/C(=O)c1ccc(OCc2ccccc2)cc1 1776127607 YJJNXVXYYNSWRY-JLHYYAGUSA-N 386.447 5.477 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1cccc(OCC(C)(C)C)c1 1776355416 KZPVKOPTLLGKGR-PKNBQFBNSA-N 396.483 5.493 30 20 GKED CCCCCCCCCCCN(C)Cc1cc2sc(C(=O)O)cc2s1 1776784569 HPPKELWTZZCNNO-UHFFFAOYSA-N 381.607 6.624 30 20 GKED CCCOc1ccc(/C=C2\C[C@@H](C(=O)O)c3ccccc3C2=O)c(OCCC)c1 1776818218 WDJRNFUMTQDJFA-RYEVTAHJSA-N 394.467 5.102 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)c3cc4sccc4s3)CCC2)cc1 1791588971 OWZLPUNKHXOZCY-UHFFFAOYSA-N 396.537 5.287 30 20 GKED C=C(C)CC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC(C)(C)C)CC1 1829066227 WDVOZWHEYISXFB-HXUWFJFHSA-N 390.612 5.035 30 20 GKED CCOc1cc(/C=C/C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1OC(F)F 7739949 NKWPYIMDMGKXMV-XVNBXDOJSA-N 397.761 5.144 30 20 GKED CCc1ccc(C(=O)/C(=C(/S)Nc2ccccc2)[n+]2ccccc2CC)cc1 10170878 CUOFCEVESYRJQE-UHFFFAOYSA-O 389.544 5.150 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)COc2ccc3oc4c(c3c2)CCCC4)cc1 25437867 QYNFZWQGWMEUCR-UHFFFAOYSA-N 388.467 5.130 30 20 GKED CCN(C(=O)c1ccc(C2SCCS2)cc1)[C@@H](C)c1ccc(C#N)cc1 45499582 ZEUZNOXXVRLWTD-HNNXBMFYSA-N 382.554 5.260 30 20 GKED N#Cc1c(NC(=O)CCCCc2nc3ccccc3s2)sc2c1CCC2 60666664 WJLQUODRYJNWOW-UHFFFAOYSA-N 381.526 5.070 30 20 GKED CC(C)(C)[C@H]1CCc2c(sc(NC(=O)Cc3noc4ccccc34)c2C#N)C1 61440333 NYOFJNABXVHRTG-ZDUSSCGKSA-N 393.512 5.093 30 20 GKED COc1ccc(S[C@H](C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 66800280 SUTNIMKPKGPVBZ-LSDHHAIUSA-N 386.542 5.209 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H](c1ccccc1)c1ccco1 66954675 RLEUQZVKCCIMLM-IIBYNOLFSA-N 391.496 5.585 30 20 GKED C=CCn1c(SCCc2ccccc2Cl)nnc1-c1ccccc1OC 72048039 IKBJMUNEDUJFTJ-UHFFFAOYSA-N 385.920 5.128 30 20 GKED Cc1cc(C(=O)Nc2ncccc2OCCCC#N)sc1-c1ccc(F)cc1 72087446 QCODFSMHPOAXMS-UHFFFAOYSA-N 395.459 5.193 30 20 GKED C[C@H](C#N)CSc1ccccc1N[C@H](C)c1nc2ccccc2n1C(F)F 108407906 BBHSHOFAVWXMBI-ZIAGYGMSSA-N 386.471 5.856 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSCc1cc(F)ccc1F 108413045 MTWFFYRMRVZYIY-CYBMUJFWSA-N 392.496 5.231 30 20 GKED Cc1cccnc1[C@H](NC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C 115769542 BCMLJYJAMNVSPK-DNVCBOLYSA-N 382.533 5.161 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N1CCC[C@H]2CCC[C@@H]21 120346111 NFDUXUBKYYGBMA-OFNKIYASSA-N 389.499 5.242 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CCC(F)(F)F 125835014 ZCYFGHMZKOJHMG-UHFFFAOYSA-N 389.421 5.496 30 20 GKED C=CCOc1ccccc1CNc1cccc(C[S@](=O)Cc2ccccc2)c1 133114447 JBADWKWULOWULS-NDEPHWFRSA-N 391.536 5.312 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@H](Nc2ccccc2)C1 151043651 RLDZYAYKYJCELG-HKUYNNGSSA-N 394.544 5.047 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccc(Oc3ccccc3C#N)c(Cl)c2)n1 155858504 BCJRERJLODKGSQ-HNNXBMFYSA-N 393.855 5.259 30 20 GKED CC[C@@H](C)n1ncc(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)c1C1CC1 159658249 YMTUGAJCFBPOIU-QRWLVFNGSA-N 378.520 5.024 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(C3CC3)on2)cc1Cl 171438452 XIUAXHMBNIODFJ-QGZVFWFLSA-N 377.831 5.113 30 20 GKED CCN(C(=O)[C@@H](C)c1ccc(Br)s1)[C@H](C)c1ccc(C#N)cc1 173773155 FBIMQYAFAYWDNN-QWHCGFSZSA-N 391.334 5.095 30 20 GKED C[C@@H](CCc1ccccc1F)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 174001642 LGYAUKTWGSSFCR-DZGCQCFKSA-N 385.389 5.016 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)CCc2ncc(-c3ccccc3Cl)o2)n1 177743222 DNGFGJOYAZEQMT-AWEZNQCLSA-N 399.903 5.384 30 20 GKED C[C@@H](N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1ccc(OCC#N)cc1 181942309 MHMMDQGRIXFFOH-BCHFMIIMSA-N 398.506 5.354 30 20 GKED CCOc1cc(/C=C\C(=O)c2cnn(C(C)C)c2)ccc1OCc1ccccc1 214911986 BWZDXLPDLFQXKC-BENRWUELSA-N 390.483 5.338 30 20 GKED C[C@H](CC#N)Sc1ccccc1N=Cc1cc(Cl)cc([N+](=O)[O-])c1O 255118136 UWTFYMDWKGYPIS-LLVKDONJSA-N 375.837 5.099 30 20 GKED C/C(=C/C(=O)[C@H](C#N)c1nc(-c2ccncc2)cs1)c1cccc(Cl)c1 255392367 QAPOYJOFDYUQHL-GQPJMJRUSA-N 379.872 5.138 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3ccc(-c4nccs4)cc3)c2)cc1 303199687 NWVMGXBBOJZYLW-UHFFFAOYSA-N 397.459 5.726 30 20 GKED Cc1nn(-c2ccccc2)cc1C(=O)Nc1ccc(Oc2ccccc2C#N)cc1 303205156 YRNNTYSEBJZGOG-UHFFFAOYSA-N 394.434 5.097 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3cc(Cl)sc3Cl)cc2)c1 303291139 BDJMDSVUNPKVJH-UHFFFAOYSA-N 389.263 5.971 30 20 GKED C[C@@H]1Cc2c(sc(NC(=O)c3ccc(C(C)(F)F)nc3)c2C#N)[C@H](C)C1 410977237 KPUVQECYPOWNBY-WDEREUQCSA-N 375.444 5.065 30 20 GKED N#CCCC[C@@H](NCCC(=O)Nc1ccccc1C(F)(F)F)c1ccccc1 411752276 DAJSRXWWIXDTCN-GOSISDBHSA-N 389.421 5.059 30 20 GKED Cc1cccc2nc(CCC(=O)Nc3cccc(Oc4ccc(C#N)cc4)c3)[nH]c12 426686443 FGYRHFGFLVQCSK-UHFFFAOYSA-N 396.450 5.107 30 20 GKED C=CCC[C@H](C(=O)Nc1cnn(-c2cc(C)ccn2)c1CCC)c1ccccc1 427927078 YJCSFVCGOIPOSL-FQEVSTJZSA-N 388.515 5.217 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC(c2ncccc2Cl)CC1 429620195 GFOOTQVDHUSIIL-UHFFFAOYSA-N 397.950 5.998 30 20 GKED Cc1ccc(Br)cc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430603097 IZYFIQXWHRYMSF-CYBMUJFWSA-N 377.307 5.002 30 20 GKED Cc1cc2c(Br)ccc(C(=O)[C@@H](C#N)c3nc4ccccc4o3)c2o1 443517304 DEFBNGMTYYAZRA-CYBMUJFWSA-N 395.212 5.135 30 20 GKED CC(C)c1nn(C)c2sc(C(=O)Nc3sc4c(c3C#N)CCCCC4)cc12 443819655 XHRRYRPXGOSZOC-UHFFFAOYSA-N 398.557 5.213 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)N(Cc1ccco1)c1ccccc1C#N 443837559 OPBNCIHNIDNPEQ-KRWDZBQOSA-N 376.431 5.092 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 443874782 BWTUJMRJPVNVQX-UHFFFAOYSA-N 391.352 5.368 30 20 GKED C=CC[C@@H]1N(Cc2nnc(-c3ccccc3Br)o2)CCCC1(C)C 444789818 GBRPIIYSHCCOSC-INIZCTEOSA-N 390.325 5.066 30 20 GKED Cc1cc(NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c(C)cc1O 445239905 NRCCTTUZBOYZCS-UHFFFAOYSA-N 387.439 5.625 30 20 GKED COc1ccccc1-c1csc([C@H]2CCCN(Cc3cccc(C#N)c3)C2)n1 447056992 DENLAKICJMHLDC-IBGZPJMESA-N 389.524 5.070 30 20 GKED N#CCc1ccc(OCc2ccccc2NC(=O)[C@@H]2CCCCC2(F)F)cc1 448749473 FUIKWWYVTKTEMG-IBGZPJMESA-N 384.426 5.096 30 20 GKED CC(C)(CC#N)CNC(=O)c1oc2ccccc2c1CSc1cccs1 457985232 FOWMGTLOSBGXBW-UHFFFAOYSA-N 384.526 5.456 30 20 GKED COc1ccc(N(C)C(=O)c2ccc(Oc3ccc(C#N)cc3C)cc2)cc1F 466884878 ZDSMLAPTMFAUEP-UHFFFAOYSA-N 390.414 5.083 30 20 GKED CCc1c(NC(=O)c2cn(CCCC#N)c3ccccc23)cnn1C(CC)CC 469859423 BQDBEKDPRRBMHX-UHFFFAOYSA-N 391.519 5.317 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CC=C(c3c(F)cccc3F)CC2)cc1 473634818 ZLBMNWTVEJRQAZ-UHFFFAOYSA-N 381.426 5.087 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(NC(=O)N2CCC(F)(C#N)CC2)cc1 477089158 LGPMMHNJGRXBNC-INIZCTEOSA-N 383.492 5.399 30 20 GKED Cc1ccc(-c2nc3cc(F)ccc3n2C(C)C)cc1NC(=O)N[C@H](C)CC#N 481239936 WZHXXHJTTHRQRK-OAHLLOKOSA-N 393.466 5.155 30 20 GKED C=CCN(CC1CCCCC1)C(=O)N[C@H](C)c1nc2ccccc2n1C(F)F 483862472 ZYJHNPKZPJPRBL-OAHLLOKOSA-N 390.478 5.270 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(OCc2cscn2)c1 486238445 BDFBEMUVSHVNSU-UHFFFAOYSA-N 382.510 5.253 30 20 GKED N#CCCC[C@@H](NC(=O)c1csc(CCc2ccccc2)n1)c1ccccc1 487368380 FFKLJOMJMKZZCU-HXUWFJFHSA-N 389.524 5.093 30 20 GKED CCn1c(SCc2ccccc2C(C)(C)C#N)nnc1-c1ccc(F)cc1 489671780 KEOYTOJCKZURHO-UHFFFAOYSA-N 380.492 5.198 30 20 GKED CC(F)(F)c1ccc(CNC(=O)c2c(F)cc(C(F)(F)F)cc2F)cc1 490223592 TYSIWNUCYYUPIA-UHFFFAOYSA-N 379.275 5.025 30 20 GKED N#Cc1ccc(Br)c(CN[C@H](CC(F)(F)F)c2ccccc2)c1 492606639 KNWLUAUTCUAZNU-MRXNPFEDSA-N 383.211 5.104 30 20 GKED COCC1(C#N)CCN(C(=O)Nc2ccc(-c3cccc(Cl)c3)cc2C)CC1 495713885 UCNPTUNKAFKWIR-UHFFFAOYSA-N 397.906 5.100 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 498447936 GWASNALWQVDMJG-PMACEKPBSA-N 386.417 5.119 30 20 GKED N#Cc1cccc(NC(=O)N2CCC(F)(c3ccccc3C(F)(F)F)CC2)c1 500088002 IQKGFUJLPBWUHX-UHFFFAOYSA-N 391.368 5.070 30 20 GKED CC(C)C[C@@H]1CCCN1C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 501127623 CLIHIVCRXHSZIA-QFIPXVFZSA-N 391.515 5.374 30 20 GKED COc1ccc(C2(NC(=O)Nc3ccc(C(C)(C)C#N)cc3)CCCC2)cc1 503284011 NSARKTAYCJMMJL-UHFFFAOYSA-N 377.488 5.087 30 20 GKED CCCC[C@H](NC(=O)N(CCC)Cc1ccc(C#N)cc1)c1ccc(OC)cc1 503797031 OMAXZZKJVOJFTQ-QHCPKHFHSA-N 393.531 5.420 30 20 GKED Cc1ncc(-c2ccccc2)cc1NC(=O)N1CC=C(c2ccc(C#N)cc2)CC1 504162963 PSCYDJPQFDUESA-UHFFFAOYSA-N 394.478 5.250 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CCC2 505092291 HRKVSHWCMHTMCB-CZIZESTLSA-N 395.506 5.535 30 20 GKED CCSc1ccc(Cl)cc1C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1 505969949 DWHXZCDCYKCZBP-OAHLLOKOSA-N 398.837 5.465 30 20 GKED CCN(C(=O)c1sc(Cc2ccccc2)nc1C)[C@@H](C)c1ccc(C#N)cc1 509587717 WSDLBKZMBBNGDG-KRWDZBQOSA-N 389.524 5.137 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@H](C)N[C@@H](C)c1ccc(C#N)cc1F 512661056 PSCQDZNJKSLWLR-STQMWFEESA-N 399.922 6.195 30 20 GKED Cc1c(C(=O)Nc2cc(C#N)ccc2OC(F)F)sc2cc(F)ccc12 512949409 WLPGTKIMDYPCLP-UHFFFAOYSA-N 376.359 5.074 30 20 GKED Cc1c(CSC(C)C)cccc1NC(=O)C(C)(C)c1cc(F)cc(C#N)c1 513350888 JQKPEJPTCYGTJD-UHFFFAOYSA-N 384.520 5.564 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1nc2ccccc2[nH]1 513682838 YYSROSZBRLBLQK-AWEZNQCLSA-N 377.856 5.435 30 20 GKED C=CCC[C@H](NCc1cccc(C(=O)NCc2ccc(C)cc2)c1)c1ccco1 514095638 SAFMWJTWLQALSS-QHCPKHFHSA-N 388.511 5.315 30 20 GKED C[C@H](Oc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 515241059 RZSNSRBNIBCDOV-KKSFZXQISA-N 390.870 5.401 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)Cc1ccccc1Cl 518668675 LIHCRCWJPIWEAT-UHFFFAOYSA-N 398.837 5.546 30 20 GKED C=CCCO[C@H](C)C(=O)N(c1ccc(CC)cc1)c1nc2ccccc2s1 519999431 QJAVMKUGKXXKSI-MRXNPFEDSA-N 380.513 5.505 30 20 GKED Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)Nc3ccc(F)c(C#N)c3)s2)cc1 520785592 CDBPWYZDSVTEIS-AWEZNQCLSA-N 394.475 5.320 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NCCCCCc1ccccc1 521811943 ZVBOQNONFVDYIK-GOSISDBHSA-N 381.545 5.615 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)[C@@H](C)c2cccs2)cc1 523092958 ABMPSYHDPLUZNR-AWEZNQCLSA-N 378.453 5.163 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ncsc3C(F)(F)F)cc2)cc1 525919419 KDULMAVVEYMJOO-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CC(C)C[C@@](C)(C#N)NC(=O)c1oc2ccccc2c1CSc1cccs1 533878211 FLLCTOYTLRXWPN-NRFANRHFSA-N 398.553 5.845 30 20 GKED C=CCN(C(=O)c1cnc2ccc(F)cc2c1)c1nc(-c2ccccc2)cs1 536208022 HAXBIUMFHAADAP-UHFFFAOYSA-N 389.455 5.330 30 20 GKED COc1ccc(C#N)cc1CN[C@@H](c1ccc(Cl)c(C(F)(F)F)c1)C1CC1 538323145 HIPREBCBDDGOQT-LJQANCHMSA-N 394.824 5.480 30 20 GKED N#Cc1ccccc1-c1ccc(CNC(=O)[C@H]2CCCC[C@@H]2C(F)(F)F)cc1 539100180 RRHOWFVLHZCJTN-PMACEKPBSA-N 386.417 5.210 30 20 GKED C[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)[C@H](C)C1CCCCC1 542533700 XGLVMVKCBSAGHM-SQNIBIBYSA-N 387.593 5.214 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1 542535464 PYVWXCHMKAFBBR-BHIFYINESA-N 382.479 5.053 30 20 GKED CCOCc1ccccc1-c1noc(/C=C\c2cn(CCC#N)c3ccccc23)n1 544206066 CAZTVPNGAKANEH-SEYXRHQNSA-N 398.466 5.312 30 20 GKED N#CC[C@@H](CC(=O)NC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1ccccc1 552244048 NLBMOBRPECJHOX-UNMCSNQZSA-N 396.918 5.011 30 20 GKED Cc1ccc(Cl)cc1NC(=O)C[C@H](C)N[C@H](CCCC#N)c1ccccc1 556202222 KMORMGVMBRQSPE-FXAWDEMLSA-N 383.923 5.390 30 20 GKED N#C[C@H](NC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1cccc(C(F)(F)F)c1 557895597 WBBRNWGOBKSNGR-NJYVYQBISA-N 394.396 5.343 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)N3CCSC4(CCC4)CC3)cc2)cc1 578603798 URQPEDUQYDXDQC-UHFFFAOYSA-N 392.524 5.047 30 20 GKED C[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1ccccc1OCc1ccccc1 580642583 AQHWMTYINWSENW-LJQANCHMSA-N 391.515 5.052 30 20 GKED Cc1ccc(-c2ccc(CNC3(c4cccc(C#N)c4)CCOCC3)s2)cc1 594983146 GAUXKILIVOENKD-UHFFFAOYSA-N 388.536 5.391 30 20 GKED Cc1ccccc1-c1ccc(CN(C(=O)CC2(C#N)CCOCC2)C(C)C)s1 597019918 JUTTZOOEFLXJPB-UHFFFAOYSA-N 396.556 5.171 30 20 GKED C[C@H](CC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 599082494 XRROHMFIEXGOCN-MLGOLLRUSA-N 380.797 5.522 30 20 GKED N#Cc1cccc(COc2cccc(NC(=O)c3ccc(C(F)F)cc3)c2)c1 608804334 UIYOVBYEHHRKBW-UHFFFAOYSA-N 378.378 5.327 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cc(Cl)ccc1SCC 609209481 HVMJSISIIYEOQE-UHFFFAOYSA-N 385.920 5.544 30 20 GKED Cc1cc(C)c2cc(C(=O)Nc3ccc(C#N)c(C(F)(F)F)c3)sc2n1 610388487 PJBDPAHFVKTQQY-UHFFFAOYSA-N 375.375 5.056 30 20 GKED CCOc1ccc(Oc2ccc(NC(=O)N3CCC[C@@](C)(C#N)C3)cc2)cc1 612293647 KDLSGSTYMJPXCN-QFIPXVFZSA-N 379.460 5.035 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccccc2OCc2cccc(Cl)c2)C1 612308092 NNZMICBROLLRDL-OAQYLSRUSA-N 383.879 5.077 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-c2cc(C)sc2C)nc2onc(C)c12 620314126 TUIYHWMEZUXFNW-IYBDPMFKSA-N 393.512 5.200 30 20 GKED C=C1C[C@@H]2CC[C@H](C1)N2Cc1csc(N(C(C)=O)c2ccccc2CC)n1 662080195 ITZWRQXEBLHNKS-BGYRXZFFSA-N 381.545 5.073 30 20 GKED Cc1c(C(=O)/C=C/c2cccc(C(F)(F)F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727267798 RLNRLLNLUAKRLO-VOTSOKGWSA-N 394.305 5.035 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)c1csc2ccccc12 730067844 HCFOPQNSGMEKHN-INIZCTEOSA-N 380.513 5.369 30 20 GKED COc1cccc([C@@H]2C[C@H]2C(=O)[C@@H](C#N)c2nc(-c3ccc(C)cc3)cs2)c1 730397161 YMLQUTFZNPBBTA-XUVXKRRUSA-N 388.492 5.107 30 20 GKED CCc1ccc(-c2nc(CC(=O)N(CCC#N)c3ccc(C)cc3)cs2)cc1 732064787 ZIOARINUIIQEDM-UHFFFAOYSA-N 389.524 5.170 30 20 GKED Cc1oc(-c2cccs2)nc1C(=O)N[C@@H](C#N)c1c(Cl)cccc1Cl 733259635 FZAOXMICNKNIMQ-LBPRGKRZSA-N 392.267 5.013 30 20 GKED N#CCOc1ccc(Cl)cc1COc1ccc(C2SCCS2)cc1 735231694 ZYXNGHSEKHCSGE-UHFFFAOYSA-N 377.918 5.300 30 20 GKED C#CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl 735517739 GIQKFMLSDIECDK-ZDUSSCGKSA-N 379.262 5.039 30 20 GKED C[C@@H](Nc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)c1ccc(C#N)cc1 735675116 AQAKXJBQVQNQTB-MRXNPFEDSA-N 377.488 5.025 30 20 GKED CC(C)(CC(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1)c1ccccc1 743462121 FNEQTMVKSRHQPB-OAHLLOKOSA-N 396.462 5.632 30 20 GKED C[C@@H](CC(=O)[C@@H](C#N)c1nc2ccccc2s1)c1ccccc1C(F)(F)F 744017176 ZOGYTCAQMMARCI-GXTWGEPZSA-N 388.414 5.685 30 20 GKED C=CCn1c(SCc2ccnc(Cl)c2)nnc1-c1ccc(Cl)cc1 748586649 LFZQPFZMGPWGFF-UHFFFAOYSA-N 377.300 5.125 30 20 GKED Cc1ccc(-c2nnc([C@H](C)ON=C(c3ccccc3)C(F)(F)F)o2)cc1C 751956785 WEIDLKWDSKFHQB-AWEZNQCLSA-N 389.377 5.398 30 20 GKED Cc1nnc(SCc2cc(Cl)ccc2OCC#N)n1[C@@H]1CCC[C@@H](C)C1 758168592 JMVRAJAJCLJUSL-CXAGYDPISA-N 390.940 5.186 30 20 GKED C=C[C@H](CC(=O)Nc1cnc(Cl)c(Br)c1C)c1ccccc1 759280765 CJZQIKAKOIJNDQ-GFCCVEGCSA-N 379.685 5.104 30 20 GKED CC(C)(C)c1nn(Cc2ccccc2)cc1/C=C/C(=O)c1ccc(OCC#N)cc1 763289914 MROSVPULYCLUJG-SDNWHVSQSA-N 399.494 5.027 30 20 GKED CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2ccc3c(c2)CCCC3)ccc1OC 772979763 MECMJBBKKVUNSZ-HTAPYJJXSA-N 378.516 5.106 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H]2CCCOc3cc4c(cc32)CCCC4)c1 772985052 QAZCAJIEJWIIHX-URXFXBBRSA-N 390.527 5.250 30 20 GKED O=C(/C=C\c1nc2ccc(Br)cc2s1)c1ccc(Cl)nc1 773143052 LLQDVSRQSXPXCG-XQRVVYSFSA-N 379.666 5.003 30 20 GKED COc1ccc(CN[C@H](c2ccc(Cl)c(C(F)(F)F)c2)C2CC2)cc1C#N 773430428 YWYRNXPOGWSRDM-IBGZPJMESA-N 394.824 5.480 30 20 GKED CCc1ccc([C@H](NCc2ccc(OC)c(O[C@@H](C#N)CC)c2)C(C)C)cc1 774450249 SSBKOVNUNHQOGY-ZJSXRUAMSA-N 380.532 5.425 30 20 GKED CC(NCc1cc(Cl)ccc1OCC#N)(c1ccccc1)c1ccccc1 775362716 GLMDPSNDBGYQDC-UHFFFAOYSA-N 376.887 5.296 30 20 GKED CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 775486635 DBPIQYRPTUYSCQ-VABKMULXSA-N 391.515 5.057 30 20 GKED COc1ccc2ccccc2c1-c1cc(CON=Cc2ccccc2F)on1 778022882 GUQBUFUVNXSBNA-UHFFFAOYSA-N 376.387 5.193 30 20 GKED C=CCn1c(=S)sc2c(=O)n(CC3CCC(c4ccccc4)CC3)cnc21 780335683 REALJEMZUSTQHL-UHFFFAOYSA-N 397.569 5.149 30 20 GKED O=C1/C(=C/c2ccc3cnccc3c2)CCOc2ccc(Br)cc21 782321558 BEOUYZJHZFVMTC-XNTDXEJSSA-N 380.241 5.046 30 20 GKED CCCc1c(NC(=S)Nc2ccccc2CC)cnn1-c1cccc(C#N)c1 783951388 CIPWGBXGIZJVNL-UHFFFAOYSA-N 389.528 5.068 30 20 GKED CC1=C[C@@H](C)C[C@@H](C=Nn2c(S)nnc2Cc2cccc3ccccc23)C1 789641433 YDYUSGADFJEGTI-NVXWUHKLSA-N 376.529 5.137 30 20 GKED C=CCC1(C(=O)O[C@H](C)c2nnc(-c3ccc(Cl)cc3Cl)o2)CCC1 791557252 AKKWVKTZPWRRRH-LLVKDONJSA-N 381.259 5.394 30 20 GKED CCOC(=O)[C@H]1C/C(=C\c2ncc(-c3ccccc3)s2)C(=O)c2ccccc21 802709115 ZQSJGMLHGRCOJL-XAVZPLJISA-N 389.476 5.127 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)sc2cc(F)ccc12 805878166 ZOARJIITUSZXIR-ZDUSSCGKSA-N 384.432 5.588 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H]2c3cccc(Br)c3CC2(C)C)cc1 813790023 FOKXVSVIWABDOE-VLIAUNLRSA-N 399.332 5.153 30 20 GKED CC(C)Sc1cc(Br)ccc1C=NN[C@H](C)c1ccncc1 819815686 CFDFHHMWICBWNQ-CYBMUJFWSA-N 378.339 5.029 30 20 GKED C[C@@H](NC(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)c1ccc[nH]1 831920980 GOPYYBJJUKVYGD-SECBINFHSA-N 397.294 5.187 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1nc(-c2ccc(Cl)cc2Cl)cs1 915103254 RAXJDNNIHFKXFS-AZHAFVHUSA-N 391.323 5.729 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)C2(c3ccc(F)cc3)CCC2)cc1 915181090 XCPLLBKDKOSWGY-HSZRJFAPSA-N 384.454 5.542 30 20 GKED O=C(/C=C\c1cc(Br)ccc1OC(F)F)c1ccc(F)cc1F 916128056 IWPAVHGFDWIOSN-KTAJNNJTSA-N 389.142 5.225 30 20 GKED N#CCOc1ccccc1C(=O)Nc1nc(-c2cccc3ccccc23)cs1 919977357 MLPOMCBEASQJQN-UHFFFAOYSA-N 385.448 5.118 30 20 GKED O=C(O)[C@H]1CCC(=NNc2c(Cl)cc(Cl)cc2Cl)c2ccccc21 1776014271 BCTWQRHVFHGLHQ-LBPRGKRZSA-N 383.662 5.425 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3nc4ccccc4s3)s2)c1 1776015103 HZWRSYZNQSYBEK-UHFFFAOYSA-N 379.466 5.169 30 20 GKED CC(=NNc1cc(Cl)nc(Cl)c1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776081968 OYTVUAYVDXFJCX-UHFFFAOYSA-N 390.226 5.183 30 20 GKED CC(C)COc1cccc(/C=C\C(=O)c2cc(C(=O)O)ccc2OC(C)C)c1 1776335234 YAVJGEXVAGXXRY-NTMALXAHSA-N 382.456 5.103 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(NC(=O)OC(C)(C)C)c1 1776783787 JLOVANPSCJUVDL-SFHVURJKSA-N 392.540 5.327 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(OC)c(O[C@H](C)CC)c1 1776784263 ZGSVUWKDHOJSOP-MJGOQNOKSA-N 379.541 5.166 30 20 GKED N#Cc1ccc(/C=C/c2nc3ccccc3c(-c3ccccc3)c2CC(=O)O)s1 1777566501 QZUTWWXMHWENPB-OUKQBFOZSA-N 396.471 5.632 30 20 GKED O=C(O)c1ccc2scc(/C=C\C(=O)c3cc(Cl)c(Cl)cc3O)c2c1 1777685465 BGTYPCZEVKGPCL-IWQZZHSRSA-N 393.247 5.508 30 20 GKED C=CCN(Cc1cccs1)C(=O)c1sc(-c2ccc(OC)cc2)nc1C 24639034 RMOHLVWSUJNLRL-UHFFFAOYSA-N 384.526 5.017 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1ccc(C(=O)N(CCC)CCC)cc1 47599227 SJMHFGOKZWAYDY-UHFFFAOYSA-N 399.560 5.230 30 20 GKED C=CCCO[C@@H](C)C(=O)Nc1ccc(S[C@H](C)CC)cc1C(F)(F)F 60306228 JWICZKKNJRCBHM-OLZOCXBDSA-N 375.456 5.516 30 20 GKED Cc1cccc(C)c1NC(=O)[C@H](C)Nc1ccc(Oc2ccccc2C#N)cc1 66390063 MTVXFFFRSPKRGK-SFHVURJKSA-N 385.467 5.407 30 20 GKED CCCCCCCCc1nnc(NC(=O)c2ccc(Cl)nc2Cl)s1 109146511 YOLNBQMHXRVDJX-UHFFFAOYSA-N 387.336 5.395 30 20 GKED CSCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 124114373 BWHWHMPITSQFAZ-ZDUSSCGKSA-N 399.368 5.826 30 20 GKED N#CCOc1cccc(CC(=O)Nc2ccccc2-c2nc3ccccc3s2)c1 134701505 ZZCABMZTPKHQNW-UHFFFAOYSA-N 399.475 5.047 30 20 GKED C[C@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccc(C#N)cc1 154342553 HCXMYBQYXBKEQT-NWDGAFQWSA-N 382.357 5.173 30 20 GKED Cc1noc(C)c1N(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 158178084 LKKZPYDKCKYCLL-SFHVURJKSA-N 394.862 5.269 30 20 GKED C=C(C)COc1cccc(NC(=O)N2CCC(Nc3cccc(C)c3)CC2)c1 158626149 IUGOWLHNIHPBPP-UHFFFAOYSA-N 379.504 5.058 30 20 GKED C=CCCCN(C)Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 165977388 XWHRYHIZMNALMQ-UHFFFAOYSA-N 391.968 5.496 30 20 GKED N#C[C@H](C(=O)c1ccc(Oc2ccc(F)cc2F)cc1)c1nc2ccccc2o1 171980061 SNQLMTQLSMIGJN-MRXNPFEDSA-N 390.345 5.388 30 20 GKED CCCOc1ccc(Oc2ncccc2CN[C@@H](C)c2ccc(C#N)cc2)cc1 173952970 GOBDNQDSEOXOQW-SFHVURJKSA-N 387.483 5.385 30 20 GKED CC(C)c1ccc(-c2nc(CN(CCC#N)Cc3ccccn3)cs2)cc1 174835879 AXBZNPTYOVFZIB-UHFFFAOYSA-N 376.529 5.244 30 20 GKED C=C[C@H](CC(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1)c1ccccc1 179363343 NDBWDSJHEDNZMN-IEBWSBKVSA-N 380.557 5.088 30 20 GKED CC[C@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 183908113 SPAZUXBNLGGWCY-CQSZACIVSA-N 382.460 5.286 30 20 GKED COCCC(C)(C)CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 183938144 GJKXNUMLYZERMD-IBGZPJMESA-N 399.922 5.180 30 20 GKED CSCc1cccc(CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 188168582 CRKANVHBKOAUDQ-HNNXBMFYSA-N 385.558 5.123 30 20 GKED Cc1csc(C(=O)Nc2ccccc2SCCC#N)c1Br 190927440 GNXFHSTWXUMDQP-UHFFFAOYSA-N 381.320 5.077 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cccc(Oc2ccncc2)c1 217156813 PYLHXFHACWUNPF-UHFFFAOYSA-N 377.419 5.233 30 20 GKED N#CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CCC3)CC1 255061677 WNZRQWVHXUFVEL-OBGWFSINSA-N 397.478 5.080 30 20 GKED CC1(C)C[C@H]2C[C@@](C)(CN2C(O)=Nc2ccc(Cl)c(/C(O)=N/C3CC3)c2)C1 328670038 FNFQIFXLDBREMV-YCRPNKLZSA-N 389.927 5.253 30 20 GKED CC(C)(C)c1ccc(-c2ccc(NC(=O)[C@H](N)CCCC#N)c(Cl)c2)cc1 424090242 BKQNXZSKOOVLEV-LJQANCHMSA-N 383.923 5.264 30 20 GKED N#CCCN(CC1CC1)C(=O)Nc1ccc(OCc2ccccc2Cl)cc1 429028791 NCFWTYDDMORPQR-UHFFFAOYSA-N 383.879 5.077 30 20 GKED CCCOc1ccc(C(=O)[C@@H](C#N)c2ncc(C(C)(C)C)s2)cc1OCC 430645735 OFFFJCSMDXEIIZ-OAHLLOKOSA-N 386.517 5.118 30 20 GKED COc1cc(Oc2ccccc2)ccc1NC(=O)N(C)Cc1cccc(C#N)c1 437874151 SJUVFPYUWKSSHH-UHFFFAOYSA-N 387.439 5.023 30 20 GKED C[C@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438629479 FWSNGOAOTKKVIK-KPZWWZAWSA-N 391.368 5.331 30 20 GKED C=C(C)[C@H](NC(=O)Nc1cc(-c2ccnn2C)ccc1C)c1ccc(F)c(F)c1 439979416 LZNDOIKUQBDDRE-NRFANRHFSA-N 396.441 5.113 30 20 GKED C=CCC[C@H](NC(=O)N(CC)Cc1ccccn1)c1ccc(C(F)(F)F)cc1 441546730 VEQMIMVTQUQQPY-IBGZPJMESA-N 391.437 5.339 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc1NC(=O)CC(C)C 442619760 UNLCFARFEGQPJY-MRXNPFEDSA-N 391.496 5.079 30 20 GKED C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1 455677067 SXKTVEJMDFDHOH-WZONZLPQSA-N 391.515 5.058 30 20 GKED CCc1cccc2c(C3CCN(C(=O)Nc4cccc(CC#N)c4)CC3)c[nH]c12 455916356 IFWPURUADDISTP-UHFFFAOYSA-N 386.499 5.208 30 20 GKED COc1ccc2c(c1)CCC[C@H]2N(C)C(=O)N[C@@H](CCCC#N)c1ccccc1 458857483 ZSMHGHHZVBXUFN-XZOQPEGZSA-N 391.515 5.149 30 20 GKED C[C@H](C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cccc(C#N)c1 462541758 HLCCZFSRGPGPKQ-ZWKOTPCHSA-N 379.463 5.078 30 20 GKED N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CCc1ccc(-c2ccccc2)o1 464958682 GBAJWAKLLBCSAH-PKTZIBPZSA-N 384.479 5.178 30 20 GKED C[C@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)c1cccc(Cl)c1F 469329579 WPGQTTRMLAWOJI-AWEZNQCLSA-N 385.870 5.235 30 20 GKED O=C(N[C@H](CC(F)(F)F)c1ccc(C(F)(F)F)cc1)c1cccc(F)c1F 474258919 KZKRWRZHUZRJLP-CYBMUJFWSA-N 397.265 5.407 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1c1cccc(Cl)c1 475562274 NPGMDMSDLILYTF-OAQYLSRUSA-N 382.935 6.561 30 20 GKED C=C(C)[C@H](N[C@H](C)c1nnc(-c2cccc(Cl)c2)o1)c1ccc(F)c(F)c1 481591173 FVVAKPDFLINPAQ-XIKOKIGWSA-N 389.833 5.636 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1 482197134 COFQXABBQXWXTK-NRFANRHFSA-N 383.511 5.102 30 20 GKED C=CCCCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 484552433 MOVZDSFSTLGMPB-UHFFFAOYSA-N 378.522 5.963 30 20 GKED C=CCN(C(=O)c1cnc(OCC)c(Cl)c1)c1nc(-c2ccccc2)cs1 486943978 DXWLKFYHPDGZDF-UHFFFAOYSA-N 399.903 5.090 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(N2CCCCCC2)cc1C 489408776 NMFMYNGOZYAFPY-UHFFFAOYSA-N 381.520 5.231 30 20 GKED C[C@H](Sc1ccc(C#N)c(C(F)(F)F)c1)C(=O)Nc1ccccc1Cl 499472070 BTAIOZRMHJZKAC-JTQLQIEISA-N 384.810 5.350 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)cc1 505926664 KIWKGAMCVXGHOL-JOCHJYFZSA-N 387.458 5.538 30 20 GKED CCN(C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1)[C@@H](C)c1ccc(C#N)cc1 512796741 JBQKIQXAYNWIHS-CVEARBPZSA-N 388.433 5.680 30 20 GKED COc1ccc(NC(=O)c2cccc(COc3ccccc3C#N)c2)cc1Cl 513422203 SECCSRABCCTIBS-UHFFFAOYSA-N 392.842 5.052 30 20 GKED N#CCc1cccc(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c1 516825378 WONMHNVUSIPYFH-UHFFFAOYSA-N 386.842 5.202 30 20 GKED C[C@@H]1c2ccsc2CCN1C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 517652231 ICEMJBBQROMRNS-MRXNPFEDSA-N 388.492 5.366 30 20 GKED Cn1cc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)c(-c2ccccc2)n1 538953890 JYEHMIDAOASSND-UHFFFAOYSA-N 394.434 5.003 30 20 GKED N#Cc1cc(C(=O)N2CCC(Sc3ccc(Cl)cc3)CC2)ccc1Cl 541597945 RAWUKQXJYPHUOD-UHFFFAOYSA-N 391.323 5.262 30 20 GKED N#Cc1cc(C(=O)N2CCC[C@H](c3cccc(C(F)(F)F)c3)C2)ccc1Cl 553139938 HTHXYVISIJJUQZ-HNNXBMFYSA-N 392.808 5.250 30 20 GKED N#Cc1ccc(CNc2ccc(-n3ccnc3)c(Cl)c2)c(C(F)(F)F)c1 554970736 GCMMQYPUVJERQE-UHFFFAOYSA-N 376.769 5.028 30 20 GKED O=C(CC1(C(F)(F)F)CC1)Nc1ccc(OCC(F)F)c(C(F)(F)F)c1 557906985 ARGUHLQZMQSMCU-UHFFFAOYSA-N 391.258 5.020 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CCC(F)(F)CC1 557978805 FJQGKEMXOWMPRT-UHFFFAOYSA-N 384.426 5.195 30 20 GKED Cc1cccc2[nH]cc(Cc3noc(-c4cn(CCCC#N)c5ccccc45)n3)c12 571803228 POHSHBUBQLZTCC-UHFFFAOYSA-N 395.466 5.376 30 20 GKED N#C[C@@H](NC(=O)c1ccc(C(F)(F)F)s1)c1ccc(Cl)c(Cl)c1 586778536 SZGPIGDOUQWBHA-SNVBAGLBSA-N 379.190 5.068 30 20 GKED C=C(C)COc1cccc(NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)c1 589385053 WMNSRARSXBTVPF-UHFFFAOYSA-N 391.467 5.470 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)o1 589541925 VNHYZTNRGZCUNQ-VFNWGFHPSA-N 387.439 5.033 30 20 GKED CC(C)n1ncc2cc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)ccc21 590118656 NKGNPZOWBUZREH-FQEVSTJZSA-N 375.476 5.174 30 20 GKED N#CC1(CC(=O)Nc2ccc(Oc3ccnc4cc(Cl)ccc34)c(F)c2)CC1 590212907 LUSVZAOAIJMOGP-UHFFFAOYSA-N 395.821 5.452 30 20 GKED CC(C)c1ccc(CSc2nnc(SCc3ccncc3C#N)s2)cc1 592343150 IBDYUZIHUWULSE-UHFFFAOYSA-N 398.582 5.513 30 20 GKED CC(C)CO[C@@H](C)c1noc(CSCc2ccc(C#N)cc2C(F)(F)F)n1 596347668 NCRKWTLASIVPKC-LBPRGKRZSA-N 399.438 5.127 30 20 GKED C[C@H](Nc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@@H]1C)c1cccc(C#N)c1 600849350 OSEWCUBBBBOYTF-ULQDDVLXSA-N 395.934 5.788 30 20 GKED CCOc1ccc(CCC2CCN(C(=O)Nc3ccc(CC#N)cc3)CC2)cc1 603650766 VWNYWIFZZIKOJR-UHFFFAOYSA-N 391.515 5.028 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)N(Cc2ccco2)c2ccccc2)o1 603952095 ZHVCBLJBCVMRED-UHFFFAOYSA-N 398.418 5.170 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cccc(Cl)c3Cl)c2)cc1 609125367 GDHXAIARKDHPQK-UHFFFAOYSA-N 383.234 5.910 30 20 GKED C[C@@H]1C[C@H]1c1ccc(CCC(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)o1 609416389 NMUKFOJGCSBKRR-DJSGYFEHSA-N 377.271 5.023 30 20 GKED CC[C@@H](CC(=O)N[C@@H](C#N)c1ccccc1Br)c1ccc(C)cc1 609994009 IXWOTUWLULHXBO-KXBFYZLASA-N 385.305 5.022 30 20 GKED Cc1ccc(-c2nc(C)c([C@@H](C)N(C)C(=O)Nc3ccc(C#N)cc3)s2)cc1 610089282 RVFFOQHLDWIACB-MRXNPFEDSA-N 390.512 5.524 30 20 GKED CC[C@@](C)(NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)c1nc(C)cs1 610201052 RMCWNWYSIPLREM-JOCHJYFZSA-N 390.512 5.122 30 20 GKED CCc1cc(C#N)c(NC(=O)c2sc(-c3ccccc3)nc2C(F)F)s1 611185018 CTUBVLBEHSCEIV-UHFFFAOYSA-N 389.452 5.496 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccc(Cl)cc2)s1)c1ccc2ccccc2n1 613291103 UEWSRWOXKKESDS-QGZVFWFLSA-N 388.879 6.107 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3cccc(F)c3)s2)cc1NC(C)=O 726427221 GYFDXOXLXPJKEP-VQHVLOKHSA-N 395.455 5.417 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 726532719 QDPQGZZIMWXXIL-UHFFFAOYSA-N 395.553 5.353 30 20 GKED C=C(C)COc1cccc(NC(=O)c2c(C)nn(-c3ccccc3)c2Cl)c1 727330879 XLXIDRDKNLEFIO-UHFFFAOYSA-N 381.863 5.041 30 20 GKED Cc1oc(-c2ccccc2)nc1CON=Cc1cccc(OCc2ccncc2)c1 727435893 XLBDMOJQGMUDDU-UHFFFAOYSA-N 399.450 5.175 30 20 GKED C#Cc1cccc(N(C)C(=O)c2oc3ccccc3c2COc2ccccc2)c1 728483337 YUXOUILPGFEDOO-UHFFFAOYSA-N 381.431 5.270 30 20 GKED N#CCn1c(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)cc2ccccc21 729328990 SLNZQKDKYZCQCC-UHFFFAOYSA-N 392.890 5.061 30 20 GKED Cc1cccc(COc2cccc(CC(=O)[C@@H](C#N)c3nc4ccccc4o3)c2)c1 730071485 NOAUPUBICLHCMO-OAQYLSRUSA-N 396.446 5.134 30 20 GKED CCCCCCCCCNC(=O)N1CCC([C@H](O)c2ccc(F)cc2)CC1 731116168 KKSWBDZTKLEZFM-OAQYLSRUSA-N 378.532 5.031 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=S)Nc1ccc2ccccc2c1 731322137 UNGPZCSKUSBVQE-OAHLLOKOSA-N 377.538 6.043 30 20 GKED O=C1/C(=C/c2ccnc3ccccc23)CSC/C1=C/c1ccnc2ccccc12 731836027 ZMUHJTVHVMGJKJ-LRVMPXQBSA-N 394.499 5.566 30 20 GKED CC(=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1)c1ccccc1Cl 733081344 VWTHCHZNWDMXTK-UHFFFAOYSA-N 391.784 5.047 30 20 GKED CCCCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@H](C)c1ccccc1 733808050 YMZZACIJEDTQLN-DENIHFKCSA-N 393.531 5.440 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)Nc2ccccc2Cc2ccccc2)c1 733842586 YQGRJYKIBKJFMW-JOCHJYFZSA-N 399.494 5.280 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)Nc2cc(Cl)ccc2SC)c1 733844374 LAAAJXDYABBRNQ-HNNXBMFYSA-N 389.908 5.065 30 20 GKED C=CC[C@@H](NC(=O)N1CCC(c2c(C)[nH]c3ccccc23)CC1)c1ccncc1 734682816 GJLPWYWPRARVMT-OAQYLSRUSA-N 388.515 5.078 30 20 GKED COc1ccccc1-c1ccc([C@H](C)N(C)Cc2ccc(OCC#N)cc2)cc1 741804765 LEOMAWDANCDTMN-IBGZPJMESA-N 386.495 5.458 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)[C@H]2SCCc3ccccc32)cc1 742537633 MVEWUHHIPUJXDR-GOTSBHOMSA-N 384.504 5.311 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@]3(C)CCc4ccccc4C3)n2)cc1 744034349 GXUMKGMPPBJQLZ-RDPSFJRHSA-N 386.520 5.490 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\C(=O)c2cc(F)ccc2F)cs1 757476640 YAGZCNCXLUNQOT-POHAHGRESA-N 398.434 5.310 30 20 GKED C=CCn1c(-c2ccccc2C)nn(CN2CCC[C@@H]2c2cccs2)c1=S 764859114 FNCPFOYCDBUMDA-GOSISDBHSA-N 396.585 5.432 30 20 GKED Cn1c(Cl)nc(Cl)c1/C=C\C(=O)c1ccc(Br)cc1Cl 765613244 IRQRVUBNPUZEQO-PLNGDYQASA-N 394.483 5.039 30 20 GKED C[C@@H](NC(=O)c1ccccc1SCC#N)c1ccc(Cl)c2ccccc12 765820481 YDMJVXOQMVABNW-CQSZACIVSA-N 380.900 5.600 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2cc(Cl)ccc2OCC(F)(F)F)cc1 770513464 FZIXUOHBQUVSPB-GFCCVEGCSA-N 384.785 5.184 30 20 GKED N#CCCCOc1cccc(/C=C\C(=O)c2cc(Cl)c(N)c(Cl)c2)c1 773160172 LBQKYXRUFCSGCP-SREVYHEPSA-N 375.255 5.154 30 20 GKED C[C@H](NCc1ccc(N(C)C2CCCCC2)cc1)c1ccc(OCC#N)cc1 776158516 GEGWNTLZPLUFER-IBGZPJMESA-N 377.532 5.209 30 20 GKED C=CC[C@@H](C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)c1ccccc1 778696260 ITQIMSSRDGOTTK-LLVKDONJSA-N 390.270 5.061 30 20 GKED C#CCCCCCC(=O)Nc1c(-c2ccc(Cl)cc2)c(C(F)(F)F)nn1C 779907854 VFHTWFNYOHGOML-UHFFFAOYSA-N 397.828 5.282 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)C[C@H](C)c1c[nH]c2ccccc12 781952360 VHJIYQVZANVTOQ-ZDUSSCGKSA-N 382.847 5.191 30 20 GKED COc1ccc(CNC2(c3cc(C(F)(F)F)ccc3Cl)CC2)cc1C#N 791005709 XFGVPYLWVQOXJL-UHFFFAOYSA-N 380.797 5.018 30 20 GKED CCOC(=O)c1scnc1/C=C\C(=O)c1cc2c(ccc3ccccc32)o1 794940438 ZSFXXMRHEXHHJI-HJWRWDBZSA-N 377.421 5.115 30 20 GKED N#C[C@H](C(=O)C[C@@H]1CCC(F)(F)C1)c1nc2cc(C(F)(F)F)ccc2s1 797943535 SHNHGXFNHXDPSP-GXSJLCMTSA-N 388.361 5.317 30 20 GKED C=CCCc1ccccc1NC(=O)c1c(C)nn(Cc2ccc(F)cc2)c1Cl 800154903 BVUWPKJGYIYYPV-UHFFFAOYSA-N 397.881 5.403 30 20 GKED Cc1csc([C@H](C#N)C(=O)CS[C@@H](c2ccccc2)c2ccc(F)cc2)n1 801660870 JFAKYAYCOVPKJS-QUCCMNQESA-N 396.512 5.290 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)CCSc1cccc(Cl)c1 808978299 JOQNMBVDKWCYPD-QGZVFWFLSA-N 396.899 5.204 30 20 GKED CCc1ccc([C@H](C#N)NC(=O)c2ccc(C3SCCCS3)cc2)cc1 809257879 RCXCGVSUAJJXBX-IBGZPJMESA-N 382.554 5.112 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1F 810255084 VQXUVOHXELPPIY-KRWDZBQOSA-N 377.341 5.085 30 20 GKED CC(=NOCC(F)(F)F)c1sc(-c2ccccc2Br)nc1C 814880919 PAIQJUMJHJOXFJ-UHFFFAOYSA-N 393.228 5.184 30 20 GKED O=C(Nc1ccc(C/N=C/c2cc(Cl)cc(Cl)c2O)cc1)c1ccco1 818212821 CGMKCYBZBLFLRN-SSDVNMTOSA-N 389.238 5.163 30 20 GKED C[C@]1(CNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1(Cl)Cl 836269586 DCXNGPQFGIBIDS-IEBWSBKVSA-N 388.298 5.047 30 20 GKED C=CCn1c(-c2cccs2)nn(CN2CC3(CCC3)[C@@H]2c2ccco2)c1=S 840139789 KVMWRBCTULRENN-KRWDZBQOSA-N 398.557 5.106 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1nc(C2CC2)cs1 842941019 GVMPYQUWWSHZPU-GFCCVEGCSA-N 395.311 5.363 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC[C@@H]2CC2(Cl)Cl)cc1 856822705 NTUIJENZIKOWOT-AEFFLSMTSA-N 388.298 5.047 30 20 GKED C[C@H]1CCCN(Cc2ccc(NCc3cc(C#N)ccc3Br)cc2)C1 864004517 MMJXNFAGRQVHNB-INIZCTEOSA-N 398.348 5.165 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2nc(Cl)ccc2Cl)cc1 915086077 RBVVLAWMFDTAJT-MRXNPFEDSA-N 382.250 5.296 30 20 GKED COc1cc(/C=C/C(=O)c2cccs2)cc(Br)c1OC(F)F 917143073 AAVIYNZUXYTQLJ-SNAWJCMRSA-N 389.217 5.017 30 20 GKED COc1c(Cl)cc(Cl)cc1/C=C/C(=O)c1ccc(N2CCCC2=O)cc1 921265733 RCWJNOKSFOJRSV-RMKNXTFCSA-N 390.266 5.025 30 20 GKED O=C(O)c1cccc(-c2ccc(C=NNc3nc(C(F)(F)F)cs3)s2)c1 1776049096 CRCCAIGTOKMBTO-UHFFFAOYSA-N 397.403 5.035 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(O[C@H](C)c2ccccc2)cc1 1776063950 QVZAODUQWLDMMQ-MRXNPFEDSA-N 392.430 5.500 30 20 GKED CCCCCOc1ccc(C(=O)/C=C/c2csc3ccc(C(=O)O)cc23)cc1 1776125244 AZLFHDONFHXVNM-YRNVUSSQSA-N 394.492 6.065 30 20 GKED C=CCC1(C(=O)O)CCN(Cc2nc(-c3ccc4ccccc4c3)oc2C)CC1 1776162356 LVOOMXYKTLYULV-UHFFFAOYSA-N 390.483 5.046 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C/c1nc2c(s1)CC(C)(C)CC2 1776355181 QKSXUOWOQZBPCC-SOFGYWHQSA-N 399.512 5.040 30 20 GKED C[C@@H]1C/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)s2)C(=O)c2sccc21 1776589446 BDIRQDZAHNXWDX-PKVLTRFUSA-N 380.490 5.948 30 20 GKED CC[C@H](C)c1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776698005 ZHSPKYCSXNJIAN-HVRVZBDQSA-N 398.502 6.390 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C/c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777455814 CNZHYYRYTGADFD-PGECNJAHSA-N 398.458 5.656 30 20 GKED Cc1ccccc1-n1nccc1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777464894 SULFFOFMTKLSJD-KHPPLWFESA-N 398.418 5.035 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3nccc4ccccc34)cc2)c1 1777650922 CYBPCCLMEWMESZ-RAXLEYEMSA-N 393.442 5.425 30 20 GKED N#CCCn1cc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)c(-c2ccccc2)n1 33527910 XBFMZWHTMFYDRK-QBFSEMIESA-N 395.422 5.091 30 20 GKED C=CCN(Cc1cccc(C#N)c1)Cc1csc(COc2ccc(C)cc2)n1 63388182 YVUMTEYCZOSGQI-UHFFFAOYSA-N 389.524 5.090 30 20 GKED C=CCn1c(SCc2csc(C3CCCC3)n2)nc2sccc2c1=O 64024854 SPBCVUVYQZVUML-UHFFFAOYSA-N 389.571 5.050 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)N1CC2C[C@H]3CC1C[C@@H](C2)C3 65814771 FBUKLCVGMZBBSV-ZVBHREPYSA-N 388.536 5.360 30 20 GKED CC(C)[C@@H](NC(=O)CNc1ccccc1S[C@@H](C)CC#N)c1ccccc1 66861005 ZCVIOEKTMUDETR-HTAPYJJXSA-N 381.545 5.006 30 20 GKED N#C[C@@H](C(=O)CSc1cccc(Cl)c1)c1nc(-c2ccccc2)cs1 72076856 PFDLGEIALHOYPY-INIZCTEOSA-N 384.913 5.432 30 20 GKED CC(C)(C)n1cc(C(=O)Nc2ccc(CC#N)cc2)c(-c2ccccc2Cl)n1 108153650 NREQLLVZLGUVLQ-UHFFFAOYSA-N 392.890 5.277 30 20 GKED CCN(CCC(=O)Nc1ccccc1-c1ccccc1)[C@H](C)c1ccc(C#N)cc1 110982853 VSVQRGRREWUJRJ-HXUWFJFHSA-N 397.522 5.637 30 20 GKED Cc1cccnc1[C@@H](NC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C 115769767 TZZZKLACWYYJIA-APWZRJJASA-N 382.533 5.303 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2NC(=O)c2ccsc2)n1 177777194 MIUWYTCVODINJT-OAHLLOKOSA-N 395.509 5.070 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)c2cc(-c3ccccn3)ccc2Cl)c1 179043453 MBLOGNLFPWNZTE-UHFFFAOYSA-N 399.784 5.127 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)CSCc1cn2cc(C)ccc2n1 188070934 JZYYESPZJLDMJP-UHFFFAOYSA-N 393.556 5.367 30 20 GKED N#Cc1ccc(CNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)cc1 221191052 DWVZCBZGSBSASP-UHFFFAOYSA-N 380.369 5.174 30 20 GKED Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)C1CCC(/N=C(/O)C2CC2)CC1 330001539 AIMQHIGXIJXLHW-OOHWJJMZSA-N 391.581 5.020 30 20 GKED C=CCOc1ccc(CN(C(=O)Cc2c(C)nn(C(C)C)c2C)C(C)(C)C)cc1 410732069 JJZVIBPKKCZDQI-UHFFFAOYSA-N 397.563 5.015 30 20 GKED C[C@H]1C[C@@H](C)Cc2sc(NC(=O)c3cnc(-c4ccncc4)s3)c(C#N)c21 411024016 YZGIMSCUTLKAEC-NEPJUHHUSA-N 394.525 5.076 30 20 GKED Cc1nc2ccc(C(=O)Nc3sc(-c4ccccc4)cc3C#N)cc2s1 432754339 YPPKMHWEVGRHET-UHFFFAOYSA-N 375.478 5.457 30 20 GKED CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 432770364 RQHSOVYAXDUSND-NRFANRHFSA-N 375.472 5.105 30 20 GKED COc1cccc(C)c1NC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 436219487 IGCMBPBLFAYNPN-UHFFFAOYSA-N 392.842 5.573 30 20 GKED CCOc1c(F)cccc1C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 437472067 MBJDDDBCRNZXRX-UHFFFAOYSA-N 394.377 5.280 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2cccc(OC(F)F)c2)cc1F 437483458 MBETUEFOOHQQHT-UHFFFAOYSA-N 398.340 5.343 30 20 GKED C[C@@H](c1ccc(Cl)cc1Cl)N(C)Cc1nnc(-c2cccc(C#N)c2)o1 441253667 BCMRPRNANISLGH-LBPRGKRZSA-N 387.270 5.108 30 20 GKED C[C@H](Oc1ccc(F)c(C(F)(F)F)c1)C(=O)Nc1ccccc1C(F)(F)F 442857499 GBWGSDMZLLPDKH-VIFPVBQESA-N 395.274 5.269 30 20 GKED C[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1cc2ccccc2s1 458371833 UBPSFWIWOFZOSK-APWZRJJASA-N 377.513 5.697 30 20 GKED CC(C)CN(Cc1ccccc1F)C(=O)N[C@@H](CCCC#N)c1ccccc1 458804168 SECZARICNNIZTG-QFIPXVFZSA-N 381.495 5.428 30 20 GKED N#Cc1cccc(-c2cc(C(=O)N3C[C@H](c4ccccc4)[C@@H]4CCCC[C@@H]43)on2)c1 469335262 ORJHLGNWLKKRDB-XJUOHMSHSA-N 397.478 5.012 30 20 GKED CC(C)COc1ccc(OCC(=O)Nc2ccccc2S[C@@H](C)CC#N)cc1 473674639 JMANLSGGXFQAOQ-KRWDZBQOSA-N 398.528 5.133 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)C[C@H](CC#N)c1ccccc1 475111573 OTCFJCPUIRMLRP-UZLBHIALSA-N 389.524 5.383 30 20 GKED COc1ccc([C@@H](NC(=O)C[C@H](CC#N)c2ccccc2)c2ccc(C)cc2)cc1 475172398 HWBNRKVJOSSTEC-OZXSUGGESA-N 398.506 5.297 30 20 GKED CC[C@@H](C)n1ncc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)c1C 482562047 RYTXRDDVGFXGKV-WBMJQRKESA-N 398.919 5.430 30 20 GKED Cc1onc(-c2ccccc2Cl)c1C(=O)[C@@H](C#N)c1nccc2ccccc12 483242805 VCBLSKONDNDNOB-KRWDZBQOSA-N 387.826 5.342 30 20 GKED CCCc1ccc([C@@H](NC(=O)NCc2cccc(C#N)c2)c2cccs2)cc1 500225285 HYSXQKATRMSJSF-JOCHJYFZSA-N 389.524 5.161 30 20 GKED CC(C)c1cc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)on1 504267627 WVZIGHZWIDXIBG-UHFFFAOYSA-N 381.819 5.368 30 20 GKED C[C@H](CC#N)N(C)C(=O)c1ccc(CSc2cc(Cl)ccc2Cl)cc1 505118737 FRZQBEYCFNMLDJ-CYBMUJFWSA-N 393.339 5.660 30 20 GKED N#C[C@@H](NC(=O)CCCc1c[nH]c2ccccc12)c1cccc(Cl)c1Cl 505314618 PBQMWQPTGFWJRA-GOSISDBHSA-N 386.282 5.178 30 20 GKED Cc1c(C#N)cccc1C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 509428616 HFKUQJHTCHEFMI-UHFFFAOYSA-N 397.356 5.325 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)c1ccc(SC(C)C)cc1 509524112 GURKAISUXOXFGP-GOSISDBHSA-N 393.556 5.518 30 20 GKED N#C[C@@]1(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)CC12CCCC2 516907424 VOFXIZMJVUCPQI-OAQYLSRUSA-N 399.947 5.130 30 20 GKED Cn1c(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc2ccccc21 517306606 KCRORLNYSCAKQM-MRXNPFEDSA-N 391.883 5.445 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(-c2nccs2)c1 521208914 IBECDZFALSZJEX-UHFFFAOYSA-N 390.512 5.372 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)Cc1cc(Cl)ccc1Cl 521327018 MEFDGVOGFTUOEH-LBPRGKRZSA-N 379.312 5.569 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CCSC[C@H]1c1ccccc1 522458696 URFQOTJDNGBQOY-APWZRJJASA-N 397.569 5.260 30 20 GKED CC[C@@](C)(C#N)NC(=O)Cc1sc(-c2ccccc2)nc1-c1ccc(C)cc1 532072689 FZSBKYINRMBTQQ-QHCPKHFHSA-N 389.524 5.137 30 20 GKED C=CCn1c(SCc2cccc(C#N)c2F)nnc1-c1cccc(Cl)c1 538149348 WLWDFXKJIITVAJ-UHFFFAOYSA-N 384.867 5.088 30 20 GKED C[C@@H](NCc1csc(-c2ccco2)n1)c1ccc(-c2cccc(C#N)c2)cc1 541084195 JLSCABWPNIYAKH-MRXNPFEDSA-N 385.492 5.793 30 20 GKED Cc1cc(C(F)(F)F)c(C#N)c(SCc2sc(C)nc2C(F)(F)F)n1 543694245 QRCUWVAZTYDRRO-UHFFFAOYSA-N 397.369 5.357 30 20 GKED CC[C@H]1CC[C@H](C)N1C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1C 552871598 QQOLZBAGNFGBPZ-PXNSSMCTSA-N 377.488 5.241 30 20 GKED Cc1c(NC(=O)c2ccccc2Oc2ccccc2C#N)cccc1-c1ncco1 553057312 XOEXKRZWXZQUQR-UHFFFAOYSA-N 395.418 5.566 30 20 GKED C=CCN(Cc1ccc(OC)cc1)Cc1cccc(C(=O)Nc2ccccc2)c1 555876127 BIMYJIGVKHMIBH-UHFFFAOYSA-N 386.495 5.136 30 20 GKED Cc1nc(-c2cccnc2)sc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 556198725 WLMHVSMIJRXOSK-OXQOHEQNSA-N 376.529 5.599 30 20 GKED Cc1nc(-c2ccccc2F)sc1[C@@H](C)N[C@H](CCCC#N)c1ccccc1 556198862 YCTYTORKHHHQRW-IIBYNOLFSA-N 393.531 6.343 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1ccc(CN2CCCCC2)cc1 557446036 HIXCNUFPIBZAAI-UHFFFAOYSA-N 388.964 5.216 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)ccn1 562911249 KIYHSHYHMQJLEH-UHFFFAOYSA-N 384.222 5.305 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H](C)c1c(F)cccc1F 568427754 MDMLJUZCDVHNIF-KBPBESRZSA-N 389.471 5.441 30 20 GKED N#Cc1ccc(NC(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)nc1 568525477 RTNQNEQKZRHZCQ-UHFFFAOYSA-N 384.222 5.305 30 20 GKED Cc1cc(C)cc(CN(C)C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)c1 573024121 ROECUUQOEMLABG-UHFFFAOYSA-N 386.455 5.026 30 20 GKED CC(C)OCCCN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 573649954 NAVOSOOFOBTYPU-FQEVSTJZSA-N 399.922 5.274 30 20 GKED Cc1cccc(-c2nc3ccc(F)cc3n2C(C)C)c1NC(=O)[C@H](C)CC#N 598815362 QBCUDKLQDCISHF-OAHLLOKOSA-N 378.451 5.220 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cccc3ncccc23)cc1Cl 603766059 LNIJHPLMJXVROE-OAQYLSRUSA-N 397.865 5.796 30 20 GKED CC(C)[C@@H]1CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 609079910 LGHJAGBCVUGYCP-FQEVSTJZSA-N 397.906 5.443 30 20 GKED N#Cc1ccc(OC(F)F)c(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)c1 609407720 ITZXOXSHLSMYHC-ZWKOTPCHSA-N 378.378 5.055 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)[C@H]1c1ccccc1 609434473 OLYOQFGPLIOCJU-QHCPKHFHSA-N 397.478 5.966 30 20 GKED COc1ccccc1-c1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)c1 609555881 UPGLVATWIAZTPU-UHFFFAOYSA-N 399.494 5.676 30 20 GKED CC(C)n1cc([C@H](C)NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)cn1 609572977 IDYXNLYKORFFSF-INIZCTEOSA-N 389.459 5.011 30 20 GKED N#Cc1c(NC(=O)c2coc(-c3ccccc3)n2)sc2c1-c1ccccc1CC2 609969455 XCXMRAIGYVJOQG-UHFFFAOYSA-N 397.459 5.293 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1-c1nc2ccccc2s1)c1cccc(C#N)c1 610317959 LEJRMAVEXMSDQV-OAHLLOKOSA-N 398.491 5.718 30 20 GKED C[C@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1cccc(C#N)c1 610344919 MPYPGSIVZOMWRL-KRWDZBQOSA-N 386.455 5.085 30 20 GKED CCCN(C(=O)N[C@@H]1CCc2cc(C#N)ccc21)[C@H](C)c1cc2ccccc2o1 618842521 NEJIXKLISQKDAC-IIBYNOLFSA-N 387.483 5.475 30 20 GKED C[C@@H](Cc1cccc(F)c1)C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619126407 RAAIFDNVQKFVNW-NSHDSACASA-N 387.339 5.174 30 20 GKED C=CCC1(NCc2nnc(-c3c(-c4ccccc4)noc3C)o2)CCCCC1 625937804 VWQTZIUFKSQRNC-UHFFFAOYSA-N 378.476 5.069 30 20 GKED COc1ccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2ccc(C)cc2)cc1 728712113 UQZZRVMPZITNCZ-DFBJGRDBSA-N 386.495 5.174 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccn(-c3ccc(Cl)c(Cl)c3)n2)cc1 730214617 LQSWIYVFTOZCOX-UHFFFAOYSA-N 399.281 5.048 30 20 GKED COc1ccccc1C[C@@H](C)CC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1 730688447 XEZJAPOLCVESHJ-APWZRJJASA-N 390.508 5.264 30 20 GKED C=CCOc1ccccc1CNC(=S)Nc1ccc(SC(F)F)cc1 731945428 HZIPZDPLTBOTJL-UHFFFAOYSA-N 380.485 5.053 30 20 GKED C=CC[C@H](NC(=O)NCc1ccccc1Sc1ccccc1)c1ccncc1 734668590 FBFPBVBLLZBCOV-NRFANRHFSA-N 389.524 5.349 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1cccs1 734706612 OAPPCGWPNFZTCZ-AWEZNQCLSA-N 386.929 5.679 30 20 GKED C=CC[C@@H](NC(=O)N[C@H](Cc1ccccc1)c1sccc1C)c1ccncc1 737048539 VYGYPONBLXWDKM-NHCUHLMSSA-N 391.540 5.352 30 20 GKED CC(=NNc1cnc2ccccc2n1)c1ccc(SCC(F)(F)F)cc1 741761911 QLZFISXENACEPU-UHFFFAOYSA-N 376.407 5.120 30 20 GKED CCCn1ccc2ccc(NC(=O)NCc3cccc(O[C@H](C#N)CC)c3)cc21 743179501 NOLLEQSDRLEPMY-FQEVSTJZSA-N 390.487 5.054 30 20 GKED CCOc1cccc(C=Nc2ccc(OCc3ccccn3)c(Cl)c2)c1O 743538445 LUUOFMGVVJXEIJ-UHFFFAOYSA-N 382.847 5.169 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ccc2ccccc2n1)c1ccc(Br)s1 744016735 SLJSXRJKNCHNST-YPMHNXCESA-N 385.286 5.039 30 20 GKED COc1cc(/C=C\C(=O)c2c[nH]c3cc(F)ccc23)ccc1OCC(F)(F)F 750910327 QTHXYWNDJAEXNP-KXFIGUGUSA-N 393.336 5.153 30 20 GKED Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=S)Nc1ccc(C#N)c(Cl)c1 755391912 SWUCXKMCEIKXFE-GFCCVEGCSA-N 392.981 5.490 30 20 GKED C#CC[C@@H](NCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 756995836 KLRYAZYRHTWAAC-LJQANCHMSA-N 386.442 5.683 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)N[C@@H](c2ccccc2)c2ccncc2)cc1 765337752 UAFZTKKUUNLVRE-JPYJTQIMSA-N 378.903 5.653 30 20 GKED C=C(C)C[C@H](C)C(=O)N(c1ccc(CNC(=O)OC(C)(C)C)cc1C)C1CC1 767093928 RTOMTQSZOHRQDM-KRWDZBQOSA-N 386.536 5.117 30 20 GKED C[C@H](CSCc1ccccc1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 772981355 VXVIMIXCCBTDTG-CZUORRHYSA-N 384.501 5.181 30 20 GKED C=C(C)CN(CC)C(=O)N[C@@H]1CCCc2cc(NC(=O)OC(C)(C)C)ccc21 779697563 GTDSNOMUSYXDSX-LJQANCHMSA-N 387.524 5.019 30 20 GKED O=C1/C(=C/c2ccc3cnccc3c2)CCOc2cc(Br)ccc21 782323841 SMNDXCQTTXSSLM-XNTDXEJSSA-N 380.241 5.046 30 20 GKED N#C[C@@H](C(=O)CCCc1ccsc1)c1nc(-c2ccc(Cl)cc2)cs1 783355270 LCDVRPVJIGVSOV-INIZCTEOSA-N 386.929 5.724 30 20 GKED N#C[C@H](C(=O)CCCOc1cccc(Cl)c1Cl)c1nccc2ccccc12 792105283 ULZWPGCFWIAWFV-MRXNPFEDSA-N 399.277 5.577 30 20 GKED CC(C)(C)c1cnc([C@H](C#N)C(=O)CSCc2cccc(Cl)c2)s1 797567929 CPSGYYFYAALVDX-CQSZACIVSA-N 378.950 5.204 30 20 GKED O=C(/C=C\c1ncc(C(F)(F)F)s1)c1csc(-c2ccccc2F)n1 812244430 KGEROTJXHRTGIK-WAYWQWQTSA-N 384.379 5.321 30 20 GKED FC(F)(F)[C@@H]1CCC[C@H](C=Nn2c(S)nnc2-c2ccccc2Cl)C1 853269100 KFMCXPCBGWNEPP-WDEREUQCSA-N 388.846 5.090 30 20 GKED Cc1ncsc1CCOC(=O)c1ccccc1SCc1ccc(C#N)cc1 912720015 AWHKPJAVLZVJKW-UHFFFAOYSA-N 394.521 5.015 30 20 GKED CCCCCCCCCCC(=O)N1CCCN(C(=O)c2ccc(F)cc2)CC1 915698559 GSSROAUPJWMGPR-UHFFFAOYSA-N 390.543 5.031 30 20 GKED N#C[C@H](C(=O)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1)c1ccccn1 916626994 MOBMMSMQKYSHTQ-DTBYZMGXSA-N 376.818 5.291 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2nc3ccccc3s2)c(C)n1[C@@H](C)c1ccccc1 916847619 MZBRQPKXUYSNRS-JXFKEZNVSA-N 399.519 5.814 30 20 GKED Cc1cccc(OCCC(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)c1C 917047483 YMWKURXWIABJLH-OAHLLOKOSA-N 384.888 5.212 30 20 GKED Clc1ccc(CON=Cc2ccccc2Br)c2ncccc12 917394702 OXGZZXFYWGSMIJ-UHFFFAOYSA-N 375.653 5.201 30 20 GKED C[C@H](OC(=O)/C=C/c1ccccc1C#N)c1cccc(NC(=O)c2ccccc2)c1 919046867 QIHKRSKKYODUMH-JJJPLKNQSA-N 396.446 5.128 30 20 GKED C[C@@H]1CCCC[C@@H]1CC(=O)[C@@H](C#N)C(=O)Nc1ccccc1Oc1ccccc1 920790060 NJVHMRFLTLMLBE-QWFCFKBJSA-N 390.483 5.343 30 20 GKED CCCC[C@@H](CC)CN(Cc1ccc(C#N)cc1)c1ccc2nc(O)[nH]c2c1 1653643336 PHPSIBQNXMGRPQ-QGZVFWFLSA-N 376.504 5.363 30 20 GKED Cc1c(NN=C(Cc2ccc(Cl)cc2Cl)CC(C)C)cccc1C(=O)O 1776086848 RVWAODNCQLYCLP-UHFFFAOYSA-N 393.314 6.057 30 20 GKED O=C(/C=C/c1cc(F)c(C(=O)O)c(F)c1)c1ccc(OCc2ccccc2)cc1 1776127328 PTCTYXOFPPBSFX-IZZDOVSWSA-N 394.373 5.138 30 20 GKED CCCCCCCOc1cccc(CNC[C@H](Cc2ccc(C)cc2)C(=O)O)c1 1776788640 DUQJWYVMWDHLGN-QHCPKHFHSA-N 397.559 5.377 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3/CCOc4cc(F)ccc4C3=O)s2)c1 1777684280 DCGUSRCRFWJJOS-KAMYIIQDSA-N 394.423 5.301 30 20 GKED CCc1ccc(OCc2nnc(S[C@@H](C)C#N)n2[C@@H](C)c2ccccc2)cc1 7196517 YITISRVZZDUSAF-IRXDYDNUSA-N 392.528 5.033 30 20 GKED N#Cc1ccccc1Sc1ccccc1C(=O)Nc1ccc(OC(F)F)cc1 15993396 RXGHBVICXDPUKB-UHFFFAOYSA-N 396.418 5.563 30 20 GKED C=CCn1c(SCc2csc(-c3ccc(C)o3)n2)nnc1-c1ccccc1 32316053 TZIMOIVMORNCLX-UHFFFAOYSA-N 394.525 5.448 30 20 GKED CC(C)CC[C@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 71944538 BRVQLTTZDBBPGF-SFHVURJKSA-N 379.504 5.278 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(C)Cc1ccoc1C 102796599 CJDCLZNMBPHEOX-UHFFFAOYSA-N 389.455 5.011 30 20 GKED N#CC1(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)CCCC1 105017792 BMQWWTMLVZTDSH-SFHVURJKSA-N 391.902 5.153 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)CCc1cccc(OC2CCCC2)c1 110590704 WHQAGEZGPGRCHW-UHFFFAOYSA-N 390.527 5.251 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccc(CCC(F)(F)F)cc1 156504037 VIJSHGQRBRBSNL-UHFFFAOYSA-N 379.275 5.592 30 20 GKED CO[C@@H](C)c1nc(C)c(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)s1 176491696 FYRYTIFIPSDLFO-AWEZNQCLSA-N 393.468 5.075 30 20 GKED C[C@H](Nc1ccc(NC(=O)c2cccc(SCC#N)c2)cc1)c1ccccc1 177080212 LVNDULIRNZZJLW-KRWDZBQOSA-N 387.508 5.728 30 20 GKED Cc1nc(Cl)sc1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 177651484 VOTHPKCNJWYSIF-UHFFFAOYSA-N 397.887 5.002 30 20 GKED N#Cc1cccc(CNc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)c1 178316844 SHHAILSLNUKXEY-UHFFFAOYSA-N 385.345 5.034 30 20 GKED N#Cc1ccc(-c2nnc(CNc3cc(Cl)ccc3OCC3CCC3)o2)cc1 188010905 RULYUHOBNVIARO-UHFFFAOYSA-N 394.862 5.053 30 20 GKED C[C@@H](CCC#N)Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 188185393 PXYUQHCXQJLPKU-HNNXBMFYSA-N 382.920 5.431 30 20 GKED C=CCc1cc(C(=O)Nc2ccccc2-c2cccs2)cc(OC)c1OC 247925312 PWVKIPUJFOMRNU-UHFFFAOYSA-N 379.481 5.413 30 20 GKED C[C@@H]1C[C@H](C(O)=Nc2nc(-c3cc(Cl)sc3Cl)cs2)CCC1=O 329384065 OWLGGCFNPNSTOB-HTQZYQBOSA-N 389.329 5.772 30 20 GKED CC(C)(C)C(=O)Nc1ccc(F)c(/C(O)=N/C2CCC(C(F)(F)F)CC2)c1 330913195 IEXPULHVYSTJIY-UHFFFAOYSA-N 388.405 5.236 30 20 GKED C=CCOc1cccc(NC(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)c1 409852573 HZSSIXDRMXWQPO-MRXNPFEDSA-N 393.512 5.566 30 20 GKED C=CCC[C@@H](NC(=O)N[C@H](C)c1nc(C(F)(F)F)cs1)c1ccccc1 425915157 GYBHNSNCRHBLRG-TZMCWYRMSA-N 383.439 5.230 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)c2cccc(SCC#N)c2)c1C 430595552 UTISYANUSMQEAM-UHFFFAOYSA-N 382.529 5.568 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 432758805 PIGROSPEODZTEN-UHFFFAOYSA-N 391.393 5.511 30 20 GKED N#CCC[C@H](NC(=O)c1ccc(Br)c(Cl)c1F)c1ccccc1 435916903 OSTIJHQROHPOBK-AWEZNQCLSA-N 395.659 5.016 30 20 GKED CC(C)(C#N)CCCCS(=O)(=O)C(c1ccc(F)cc1)c1ccc(F)cc1 436098388 BOERGZLSVFOPSD-UHFFFAOYSA-N 391.483 5.189 30 20 GKED N#CCC[C@@H](NC(=O)N1CC=C(c2ccc(Cl)cc2)CC1)c1ccccc1 438854006 VLTAXCOGOFJDJZ-OAQYLSRUSA-N 379.891 5.184 30 20 GKED N#CC(CCN[C@H](c1ccccc1)[C@H]1CCOC1)(c1ccccc1)c1ccccc1 444672068 FCAFPNZUNDZEAN-JYFHCDHNSA-N 396.534 5.254 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccc(F)cc3)n2)CCCCC1 449576323 RQUUQTNUJQUWQT-UHFFFAOYSA-N 387.524 5.335 30 20 GKED COc1ccccc1-c1nc(CN2CCC[C@@H]2[C@@H](C#N)c2ccccc2)cs1 464824154 ULQMFWDUXCDXGJ-LEWJYISDSA-N 389.524 5.090 30 20 GKED C[C@H](NC(=O)N1CCc2cc(-c3cccc(F)c3)ccc21)c1ccc(C#N)cc1 465663186 RWYSLJHGYIKUOH-INIZCTEOSA-N 385.442 5.198 30 20 GKED C=CC[C@@H](CC)NC(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 466367158 QHKFHNURTCMZAJ-OAHLLOKOSA-N 377.941 5.193 30 20 GKED CC[C@@H]1C[C@@H](C)CN1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 467609741 BNTGBTDNQADCSX-ZTNFWEORSA-N 381.907 5.648 30 20 GKED COc1ccc(C#N)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2)c(F)c1 469052951 SNNMROOIYINAPI-UHFFFAOYSA-N 396.805 5.404 30 20 GKED Cc1ccc([C@@H](Nc2ccc3c(c2)CCC(=O)N3CCCC#N)C2CCCC2)o1 469163504 YDVYVDBGIMYPCJ-DEOSSOPVSA-N 391.515 5.514 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](Cc2ccccc2)[C@H]1C 472757316 VYYBXYNHRNHSFM-QWFCFKBJSA-N 393.556 5.566 30 20 GKED C=CCOc1ccc(C(F)(F)F)cc1C(=O)Nc1cc(C(C)=O)ccc1Cl 475298126 BRZJCXPGYMXBKU-UHFFFAOYSA-N 397.780 5.379 30 20 GKED CC1(C)CN(C(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)[C@@H]1c1ccncc1 476241678 KIQFAJDAGQLPSU-HSZRJFAPSA-N 397.478 5.163 30 20 GKED N#CC[C@H](CC(=O)N1CCC(=Cc2ccc(F)c(F)c2)CC1)c1ccccc1 476726827 CBBJLNRELZOOKF-HXUWFJFHSA-N 380.438 5.058 30 20 GKED COc1ccc(CSCC(=O)c2cn(CCC#N)c3ccccc23)cc1Cl 478602674 QEYRTMRCPNYCGT-UHFFFAOYSA-N 398.915 5.333 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N[C@H](C#N)c2ccccc2Cl)s1 481890093 HWVVCFSSUKEULN-QGZVFWFLSA-N 381.888 5.075 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)N(Cc3ccco3)Cc3ccco3)c2)cc1 484864545 NMNRZNVRCLSHHJ-UHFFFAOYSA-N 398.418 5.379 30 20 GKED C=CCSc1ccccc1C(=O)Nc1ccccc1OC[C@H]1CCCCO1 486260829 QXKCIWHRTRZUFM-QGZVFWFLSA-N 383.513 5.165 30 20 GKED CN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(F)c(C(F)(F)F)c1 494012034 WOJBNTSNTDQMHO-UHFFFAOYSA-N 379.275 5.136 30 20 GKED N#Cc1ccccc1-c1ccc(CS(=O)(=O)Cc2c(F)cccc2Cl)cc1 494752278 JZYSVHSBCIFTIO-UHFFFAOYSA-N 399.874 5.133 30 20 GKED O=C(Nc1cccc2oc(C(F)(F)F)nc12)c1cccc(C(F)(F)F)c1F 499513797 MMWXNCJNSYGKGM-UHFFFAOYSA-N 392.230 5.257 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC(Oc2ccc(F)cc2F)CC1 505017043 PTWYWSPYPJTSCF-UHFFFAOYSA-N 386.442 5.159 30 20 GKED Cc1nn(Cc2ccccc2)c(C)c1CNC1CCC(C#N)(c2ccccc2)CC1 507645372 QONGNOHXEBWIFO-UHFFFAOYSA-N 398.554 5.042 30 20 GKED CC1(C#N)CCN(Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 507715126 QEZJWIMCRYKZLX-UHFFFAOYSA-N 385.851 5.166 30 20 GKED Fc1cc(-c2nc([C@H](F)c3ccc(C(F)(F)F)cc3)no2)cc(F)c1F 512014313 DRQFXHYJSUVRJJ-GFCCVEGCSA-N 376.231 5.232 30 20 GKED C=CCOc1cccc(NC(=O)Cc2csc(Cc3cccc(Cl)c3)n2)c1 512517948 CQWPFBPUJCARBK-UHFFFAOYSA-N 398.915 5.133 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@]4(CC=CCC4)C3)cc2)cc1 512524687 VOWXIIOWPZEKDK-XMMPIXPASA-N 387.483 5.705 30 20 GKED N#Cc1cccc(CSc2nnc(-c3ccncc3)n2C2CCCCC2)c1F 515686170 JYUHKJNTCJPIMN-UHFFFAOYSA-N 393.491 5.148 30 20 GKED C[C@H]1CCc2sc(NC(=O)c3cncnc3-c3ccccc3)c(C#N)c2[C@@H]1C 515795591 ITWFIEMNBGYYQH-UONOGXRCSA-N 388.496 5.015 30 20 GKED CC(C)C(=O)Nc1ccc(C(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1 519124651 PRZIQCZLMYZCQB-UHFFFAOYSA-N 399.450 5.197 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@H]1CCc2c(Cl)cccc21 521257042 BJHMBJMKEQLFLG-GUYCJALGSA-N 385.920 5.401 30 20 GKED N#C[C@H](C(=O)c1ccc2ccccc2c1)c1nc(-c2c(F)cccc2F)cs1 521262995 ZKHQPWCQAMTAFH-MRXNPFEDSA-N 390.414 5.732 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)[C@@H]2C[C@H]2c2csc(Br)c2)n1 528966124 HFNYAUAFNWJBAD-TUAOUCFPSA-N 395.347 5.070 30 20 GKED C=C(C)[C@H](CC(=O)N(C)[C@@H](C)c1ccc(-c2ccccc2OC)cc1)OCC 535158079 VULZVSZWQRXWQL-MBSDFSHPSA-N 381.516 5.253 30 20 GKED COc1cc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)ccc1OCc1ccccc1 538151202 PRMOAMYMNABCHY-OALUTQOASA-N 386.495 5.558 30 20 GKED COc1cc(CNCc2ccc(-c3ccccc3C#N)cc2)ccc1OC(F)F 539104581 VEOGTXRMBOFRRR-UHFFFAOYSA-N 394.421 5.125 30 20 GKED C=CCCOCCCCC(=O)N1CCC(c2ccccc2C(F)(F)F)CC1 539388309 KPYGRPQESOKRHO-UHFFFAOYSA-N 383.454 5.174 30 20 GKED CC[C@H]1C[C@H](CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)CCO1 541002237 FQANBMHJOJDJTK-NQIIRXRSSA-N 396.918 5.340 30 20 GKED O=C(CC1CC1)N[C@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 541229590 PRBROLJXPSJGES-GFCCVEGCSA-N 393.249 5.244 30 20 GKED N#CCC1CCN(Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 541921983 JWHDEZBWMVQMNL-UHFFFAOYSA-N 385.851 5.166 30 20 GKED Cc1ccc(NC(=O)C[C@@H](C)Nc2cccc(OCCCC#N)c2)c(Cl)c1 542153932 KCFIPWSBPKYMFH-MRXNPFEDSA-N 385.895 5.160 30 20 GKED N#C[C@@H](C(=O)c1ccn(Cc2ccccc2)c1)c1nc(-c2ccccc2)cs1 542881251 OXHNQFHDOFJMHX-FQEVSTJZSA-N 383.476 5.150 30 20 GKED COc1cc2nc(C)sc2cc1NC(=O)c1sc2ccc(C#N)cc2c1C 550483106 ZDBRRGMPKAHKPO-UHFFFAOYSA-N 393.493 5.260 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc2c(F)ccc(F)c2c1 550519378 NOVSCYKOYOSOJM-LBPRGKRZSA-N 383.423 5.160 30 20 GKED C=C(C)[C@@H](NCc1ccc(Br)cc1C#N)c1ccc(F)c(F)c1 553909488 LWBCAVGZDYVRME-GOSISDBHSA-N 377.232 5.006 30 20 GKED Cc1cc(N2CCCCCC2)ccc1NC(=O)CSCc1ccc(C#N)cc1 557089927 BFCVQKCSXQASSU-UHFFFAOYSA-N 393.556 5.119 30 20 GKED N#CCCC1CCN(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)CC1 577503904 NQECHWYHUBXNKA-HSZRJFAPSA-N 375.516 5.086 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CCC[C@]3(CCSC3)C2)cc1 579439207 CYWUKBIFOPMZJT-QFIPXVFZSA-N 393.512 5.102 30 20 GKED Cc1ccc([C@@H](NCc2ccc(C#N)cc2C(F)(F)F)c2ccccn2)cc1 581076688 AAGHTWHCZOFCGN-OAQYLSRUSA-N 381.401 5.160 30 20 GKED CCSc1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cn1 590208093 NBYQYBMTAWTQCX-OAHLLOKOSA-N 399.928 5.461 30 20 GKED CC(C)[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)c1ccccc1F 595694969 XJOZQJPHLFBPNQ-OPAMFIHVSA-N 399.535 5.145 30 20 GKED N#CCCSc1ccc(C(F)(F)F)cc1NC(=O)CCCc1cccnc1 597180786 VTNBLZDICQWEHI-UHFFFAOYSA-N 393.434 5.068 30 20 GKED CC(C)Oc1ccccc1CNCc1cccc(OCc2cccc(C#N)c2)c1 603942061 DCGCOZYKBQRTSP-UHFFFAOYSA-N 386.495 5.214 30 20 GKED Cc1c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)oc2c(Cl)cccc12 609377024 NUPBFIRIHPXQFE-LBPRGKRZSA-N 384.888 5.899 30 20 GKED COc1ccc(Cl)cc1CNCc1cccc(OCc2ccccc2C#N)c1 609433248 OEKVFRWPUPPJFH-UHFFFAOYSA-N 392.886 5.089 30 20 GKED N#Cc1ccc(CCC(=O)Nc2cc(Cl)ccc2SCC(F)(F)F)cc1 610122160 GKOHBNQXFKQDTA-UHFFFAOYSA-N 398.837 5.437 30 20 GKED N#C[C@H](Cc1ccccc1)Sc1nnc(-c2ccncc2)n1C1CCCCC1 610863404 KJINXVGWOQYSCK-FQEVSTJZSA-N 389.528 5.072 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)Nc2ccc(C(C)(C)C#N)cc2)c(C)c1 614266912 SDGKIDUJKSIYLI-UHFFFAOYSA-N 376.500 5.405 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(Cc2ccc(F)cc2)CC1 619127345 ZKEXRAKUVHVYCF-UHFFFAOYSA-N 399.350 5.318 30 20 GKED O=C(Nc1ccccc1C(F)F)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 645015440 KKPPQVRDMDVACC-DTORHVGOSA-N 390.274 5.219 30 20 GKED C[C@@H](c1ccc(OC(F)F)cc1)N1C[C@@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 674461359 XKWGXNBZQCTPEO-KPXOXKRLSA-N 377.275 5.022 30 20 GKED Fc1ccc2c(c1)[C@H](NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CCCO2 675737614 IJROCXKFEJKXGB-ZIBATOQPSA-N 399.350 5.539 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccccn2)c2ccc(F)cc2)cc1Cl 726474271 VMHFFYKMFPCMJW-UHFFFAOYSA-N 396.878 5.149 30 20 GKED CCc1c(C)sc(NC(=O)c2ccc(C3SCCCS3)cc2)c1C#N 727790632 NICIGSSWJSGCJU-UHFFFAOYSA-N 388.583 5.612 30 20 GKED COc1ccc2oc(C(C)=NNc3ncnc4sc5c(c34)CCC5)c(C)c2c1 729140443 HKJWRBCAILDMAS-UHFFFAOYSA-N 392.484 5.079 30 20 GKED COc1ccc2c(c1)CCC[C@@H]2CC(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 730420764 FXOKWTUFHIRQAH-RDTXWAMCSA-N 394.471 5.130 30 20 GKED Cc1ccccc1-n1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cn1 732634236 YEZDTTJXFCAMSM-HSZRJFAPSA-N 392.462 5.089 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)N[C@@H](C)c2csc3ccccc23)cc1 743474404 HWCJVZVUKOCNCH-ROUUACIJSA-N 391.540 5.196 30 20 GKED N#CCC[C@@H](NC(=O)/C=C(\c1ccc(Cl)cc1)C(F)(F)F)c1ccccc1 749035038 NLJIXVALJLIUFV-VJSYINPZSA-N 392.808 5.447 30 20 GKED Cc1csc(Sc2ccc(NC(=O)/C=C/c3ccccc3C#N)c(C)c2)n1 750826995 SXSPQNOXCNNJEQ-JXMROGBWSA-N 391.521 5.435 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2ccccc2o1)c1ccc(-c2ccccc2)cc1 752479560 SVFHYDVALIFPBG-FQEVSTJZSA-N 380.447 5.649 30 20 GKED Cc1nc2scc(-c3ccccc3)c2c(=O)n1N=Cc1cc(Cl)ccc1F 753687906 ATOOMRCLCKOCDK-UHFFFAOYSA-N 397.862 5.108 30 20 GKED COc1cccc(-c2nc(C=NOc3ccccc3C(F)(F)F)cs2)c1 754712352 NHQYXEFPKWQCAD-UHFFFAOYSA-N 378.375 5.250 30 20 GKED N#Cc1ccccc1/C=C(/Cl)c1nc(O)c2cc(-c3ccccc3)sc2n1 755581539 NVKOWKLRAIQCMV-LICLKQGHSA-N 389.867 5.672 30 20 GKED CCCCCCCNCc1csc(N(C(C)=O)c2ccc(F)cc2F)n1 755738783 MUGVEKSPSUFKKR-UHFFFAOYSA-N 381.492 5.166 30 20 GKED CC(C)(C#N)CCCCOC(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1 768854161 VIUOQLXPKIMBNZ-UHFFFAOYSA-N 385.410 5.073 30 20 GKED C[C@H](Nc1cccc(COCCc2ccccc2)c1)c1ccc(OCC#N)cc1 776887043 SHUXKFFOJZETOF-FQEVSTJZSA-N 386.495 5.521 30 20 GKED Cc1ccc(-c2nc(/C=C3\CCc4ncc(C(F)(F)F)cc4C3=O)co2)cc1 777468772 ZNIBFQBUEAWRET-RIYZIHGNSA-N 384.357 5.276 30 20 GKED COc1cc(-c2ccccc2)ccc1/C=C/C(=O)c1ccc(N2CCOC2=O)cc1 781111719 QFPGMNKJZPNDMD-SDNWHVSQSA-N 399.446 5.215 30 20 GKED CCCCCCC[C@@H](C)CNC(=O)Nc1cccc(NC(=O)N(C)C)c1C 791915076 SPQMBKIGKIZLCN-MRXNPFEDSA-N 376.545 5.207 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCc2ccccc2F)cc1 793462735 DRYVBWPQIWTVPJ-QFIPXVFZSA-N 387.458 5.235 30 20 GKED CCN(C(=O)c1ccc(C)c(C#N)c1)[C@H](c1ccc(Cl)cc1)c1cccnc1 799338095 XGXNAAFDFFYFBV-JOCHJYFZSA-N 389.886 5.167 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1SCC(F)(F)F)c1cccnc1F 808435880 AWTQIMSNMQXPCZ-UHFFFAOYSA-N 398.303 5.146 30 20 GKED COc1ccc(OCc2nc(/C=C3\C(=O)c4ccccc4[C@@H]3C)cs2)cc1 809159317 NJGVUJDYFVTPGY-GNKPEBMXSA-N 377.465 5.114 30 20 GKED N#CCCC[C@@H](NC(=S)Nc1ccc(OC(F)(F)F)cc1)c1ccccc1 814209805 GCPJASLWEQEQDK-QGZVFWFLSA-N 393.434 5.307 30 20 GKED C=CCN(CCC#N)C(=O)c1ccc(CSc2nc3ccccc3s2)cc1 816803371 YFMXYUWVZBYFHZ-UHFFFAOYSA-N 393.537 5.130 30 20 GKED C=CCCC[C@H](c1ccccc1)c1nc([C@@H]2CCC(=O)N(CC3CCC3)C2)no1 904838577 YYXZBEBRNRWJGE-NHCUHLMSSA-N 393.531 5.064 30 20 GKED N#C[C@@H](C(=O)CC(c1ccccc1)c1ccccc1)c1nc2ccccc2s1 916627405 SLFQYRXAMVVEOJ-FQEVSTJZSA-N 382.488 5.695 30 20 GKED C[C@H](CC(=O)[C@H](C#N)c1nc(-c2c(F)cccc2F)cs1)CC(C)(C)C 920805636 DXJWIFBHRYDWMP-OLZOCXBDSA-N 376.472 5.727 30 20 GKED C=C(Br)CSc1nc(O)c2c(C[C@H](C)CC)c(C)sc2n1 1559353012 NFTUMELVCOLPKS-MRVPVSSYSA-N 387.368 5.295 30 20 GKED COc1cc(-c2ccccc2)ccc1C=NNc1ccc(Cl)c(C(=O)O)c1 1776033585 DGAKSDXQJZJYCO-UHFFFAOYSA-N 380.831 5.160 30 20 GKED CCc1c(C(=O)/C=C\c2ccc(O[C@@H](C)C(=O)O)cc2)oc2ccc(C)cc12 1776956298 QMUZLGAUVQOSDB-QIENPNARSA-N 378.424 5.052 30 20 GKED Cc1ccc(-n2cc(C(=O)Nc3ccc(CC#N)cc3)c(-c3ccccc3)n2)cc1 28435004 ANKGQJFBVYNYBV-UHFFFAOYSA-N 392.462 5.166 30 20 GKED N#C[C@H](C(=O)Cc1ccsc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 41538253 LFBPYEUBMFMTOH-CYBMUJFWSA-N 393.320 5.597 30 20 GKED Cc1ccc(-c2nc(C(=O)[C@@H](C#N)c3nc(-c4ccccc4)cs3)cs2)o1 51534562 GDVAQLMAWYHHDF-CQSZACIVSA-N 391.477 5.325 30 20 GKED C=CCOc1cccc(NC(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)c1 55724664 NDGAWJICICJWMB-UHFFFAOYSA-N 386.451 5.064 30 20 GKED N#Cc1cc(NC(=O)c2ccccc2Sc2ccccc2C#N)ccc1Cl 58464848 YCDJEJYSMYDBEI-UHFFFAOYSA-N 389.867 5.487 30 20 GKED C[C@@H](SCCC(=O)Nc1sc2c(c1C#N)CCCC2)c1ccc(F)cc1 62697206 MDEBGOKJRNBABZ-CYBMUJFWSA-N 388.533 5.461 30 20 GKED Cc1cc[n+](/C(C(=O)c2ccc(C)s2)=C(\S)Nc2cc(C)ccc2F)cc1 65940451 YYTCRWNZZTUWQD-UHFFFAOYSA-O 399.536 5.151 30 20 GKED COc1cccc(CCC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)c1 72025306 ZPDAOGWUYNPBGJ-UHFFFAOYSA-N 386.451 5.239 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)Nc2ccc(Cl)nc2)cc1 104232717 YQPMRQPOMUGSLC-UHFFFAOYSA-N 379.872 5.151 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2csc(-c3ccccc3C)n2)cc1 108808275 YXBRDPYTMVBGMH-UHFFFAOYSA-N 391.496 5.078 30 20 GKED Cc1csc(-c2ccc(NC(=O)Nc3cccc(OCCCC#N)c3)cc2)n1 113561120 SJHRURXNAAIRTK-UHFFFAOYSA-N 392.484 5.445 30 20 GKED CC(C)c1csc(CNCc2cccc(OCc3cccc(C#N)c3)c2)n1 125591381 JELLCDLWWOERMR-UHFFFAOYSA-N 377.513 5.007 30 20 GKED Cc1ccc(Br)c(NC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)c1 129639579 KXUVAHIHOORQPN-LPHOPBHVSA-N 398.304 5.061 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)NCc1ccccc1OCC1CC1 159275106 GYIKNSJDCDHOGN-INIZCTEOSA-N 395.528 5.049 30 20 GKED Cc1cccc2c(CCNC(=O)Nc3ccccc3S[C@@H](C)CC#N)c[nH]c12 173122252 QNPSNPYHPAYMIS-INIZCTEOSA-N 392.528 5.235 30 20 GKED C[C@@H](c1cccnc1)N(C)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 174495381 MQBKCCFMDXAQDW-HNNXBMFYSA-N 390.418 5.110 30 20 GKED CCCc1noc2nc(C3CC3)cc(C(=O)[C@@H](C#N)c3nc(C(C)C)cs3)c12 177755354 BVNJSUMGTSAMTI-CQSZACIVSA-N 394.500 5.123 30 20 GKED N#Cc1ccccc1/C=C/C(=O)N(c1ccc(F)c(Cl)c1)c1nccs1 179418084 VVAVVFQDHMCYGQ-VMPITWQZSA-N 383.835 5.185 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12 182132325 QJNNZNKLJZWGII-HNNXBMFYSA-N 383.407 5.038 30 20 GKED N#Cc1ccccc1Oc1ccccc1C(=O)N(CCC(F)(F)F)CC1CC1 183181826 APNKPKVFEXHBNA-UHFFFAOYSA-N 388.389 5.155 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1Cc2ccccc2C2(CC2)C1 187113972 KUXGRDHEHTUHJA-INIZCTEOSA-N 377.513 5.018 30 20 GKED COc1ccc(F)cc1[C@@H](C)NCc1cccc(OCc2cccc(C#N)c2)c1 237180206 IWOOOGQFTDZOTP-QGZVFWFLSA-N 390.458 5.136 30 20 GKED CCn1c(SCc2cn3ccccc3c2C#N)nnc1-c1ccc(Cl)cc1 301757077 AJLHYJJIYAUULP-UHFFFAOYSA-N 393.903 5.035 30 20 GKED C[C@H](/N=C(/O)C1CCC(/N=C(/O)C2CC2)CC1)C1(c2ccccc2)CCCC1 330012865 LGNFEGQFAATJQB-OCDPCBSRSA-N 382.548 5.769 30 20 GKED C[C@H](/C(O)=N/C1(c2noc([C@H]3CCCO3)n2)CCCCCC1)c1ccccc1 330016914 QHFURSNTHKYMIH-FUHWJXTLSA-N 383.492 5.231 30 20 GKED C[C@@H]1CCc2sc(NC(=O)Cc3csc(-c4ccoc4)n3)c(C#N)c2[C@@H]1C 410988964 UBAVULAXZNAPFF-VXGBXAGGSA-N 397.525 5.203 30 20 GKED C=C(C)C(C)(C)C(=O)N1CCC[C@H](c2nc(-c3ccccc3OC)cs2)C1 424816356 ZQYJYKLFORYQEN-INIZCTEOSA-N 384.545 5.127 30 20 GKED COc1ccc([C@H](NCc2cccc(F)c2C#N)c2ccccc2Cl)cc1 427428582 POOJMEUGKBNLNK-QFIPXVFZSA-N 380.850 5.239 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CC[C@H](c2ccccc2F)C1)c1ccccc1 431303626 ZVNRAHMBSYXJAL-IPJJNNNSSA-N 379.479 5.196 30 20 GKED CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)N[C@@H](CCCC#N)c1ccccc1 431305387 BRJBORJQBACTMO-BHDDXSALSA-N 385.552 5.095 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1ccccc1N1CCCCC1)c1ccccc1 432746805 KGEWJNRCZJSZAQ-HXUWFJFHSA-N 376.504 5.234 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cccc(COCC2CC2)c1)c1ccccc1 432752204 JMWGJCJEROTMQW-JOCHJYFZSA-N 377.488 5.170 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCS1 437784949 ZNVLTLLBCXCYHE-MJGOQNOKSA-N 399.947 5.355 30 20 GKED CCc1ncsc1NC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1 437825305 WUOVEQQRJMWTED-UHFFFAOYSA-N 383.860 5.275 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@@H]3c3ccc(Cl)cc3)o2)cc1 441404885 OOAWUVMCHWPOFQ-HXUWFJFHSA-N 392.890 5.379 30 20 GKED N#C[C@H](C(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1nc2ccccc2[nH]1 442611612 UBFLYKHYNBHMNV-OAHLLOKOSA-N 391.352 5.137 30 20 GKED C[C@@H]1CCN(C(=O)N[C@H](CCCC#N)c2ccccc2)[C@H]1c1cccc(F)c1 458808627 ZGNNSOSGYCQVIV-ZPMCFJSWSA-N 379.479 5.353 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)[C@H](C)c1cccc(Br)c1 464483545 QPDLBNXRHXYDEI-OAHLLOKOSA-N 386.333 6.043 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)c1cc(Oc2ccccc2)ccn1 465048516 DXAPUJOVSDIRSR-UHFFFAOYSA-N 384.888 5.417 30 20 GKED COCC[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)C1 467157168 FLYLCCCERQSWOY-SFHVURJKSA-N 393.487 5.021 30 20 GKED C=C(C)CN(Cc1ccccc1)Cc1nnc(-c2c(Cl)cccc2Cl)o1 470907414 STXQVYPAHAWPCJ-UHFFFAOYSA-N 388.298 5.622 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CN(Cc1ccccc1)C(C)(C)C 474287804 YKSQVLXLCLRJRA-SFHVURJKSA-N 395.572 5.320 30 20 GKED CC(C)(C#N)c1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1 474427093 PJNSRFTYRMKZIF-UHFFFAOYSA-N 398.466 5.384 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)c2ccccc2OCc2ccc(F)cc2)n1 474436665 VKLJXMGHHVQLEM-GOSISDBHSA-N 394.471 5.475 30 20 GKED C=C(C)Cn1c(S[C@H](C)c2cccc(Cl)c2F)nnc1-c1ccncc1 478848893 CPJIYMXYSVEPAT-CYBMUJFWSA-N 388.899 5.562 30 20 GKED C=C(C)[C@@H](NC(=O)Nc1cccc(-c2ncc(C)o2)c1)c1ccc(F)c(F)c1 480587944 MKPMQLVQWCRANJ-LJQANCHMSA-N 383.398 5.367 30 20 GKED C[C@@H](c1ccco1)N(C)C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(F)c1 481739830 JVDHACNJDGXISV-HNNXBMFYSA-N 393.418 5.094 30 20 GKED Cc1ccc2c(C(=O)[C@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)csc2c1 483511193 CHPRMMIIQAOZEZ-KRWDZBQOSA-N 399.500 5.695 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(-c2ccccn2)cc1 485191803 OAUKTZFIQLJJEJ-UHFFFAOYSA-N 375.431 5.540 30 20 GKED C=C[C@@H]1CCCCN1C(=O)Nc1cnn(-c2ccc(C(F)(F)F)cc2)c1CC 489090023 TZWPBXSQDGGYHR-OAHLLOKOSA-N 392.425 5.026 30 20 GKED Cc1cccc(Oc2ccccc2NC(=O)N(CCC#N)Cc2ccco2)c1 494194448 HPHBJDZDLRWMDH-UHFFFAOYSA-N 375.428 5.328 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)Nc2cc(C(F)F)ccc2Cl)cc1 497216831 YOWYNXPPASPDKS-UHFFFAOYSA-N 394.809 5.229 30 20 GKED N#CC[C@H](CC(=O)Nc1ccc(F)cc1OCCC(F)(F)F)c1ccccc1 500244866 GOGFCZMZOFBCKG-OAHLLOKOSA-N 394.368 5.183 30 20 GKED CSc1ccccc1[C@@H](C)NC(=O)Nc1ccccc1S[C@@H](C)CC#N 505326741 WPRLLGSJNUUDTM-LSDHHAIUSA-N 385.558 5.685 30 20 GKED N#C[C@@H](NC(=O)c1ccc(SCc2ccccc2)cc1)c1ccccc1F 505982157 PSUYDFJRZLFKOE-OAQYLSRUSA-N 376.456 5.113 30 20 GKED Cc1ccc(-c2ccnn2C)cc1NC(=O)c1sc2ccc(C#N)cc2c1C 512135142 GDDSRUUNSTWVRP-UHFFFAOYSA-N 386.480 5.043 30 20 GKED C[C@@H](Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(C#N)cc1F 512613586 SNJMYNSXBTYQHI-GFCCVEGCSA-N 384.348 5.287 30 20 GKED CSc1cccc(F)c1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 512841314 ZZMTUJIFHRUUNE-UHFFFAOYSA-N 392.455 5.772 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCc4c(Cl)cccc43)c2)c1 517549444 TWLXBJZMSAFXKI-XMMPIXPASA-N 388.898 5.568 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3cccc(C(F)(F)F)c3)cc2)nc1 517656659 OWGJLGPKWRBCSH-UHFFFAOYSA-N 383.329 5.017 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)c3ccc(C(F)(F)F)cn3)cc2)c1 518729299 DPDCHQPSBLVIOG-UHFFFAOYSA-N 383.329 5.017 30 20 GKED CCc1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccc(C#N)c2)cc1 520207690 HJQARBGIJGRTPZ-UHFFFAOYSA-N 392.506 5.263 30 20 GKED CCc1cccc2c1OCC[C@H]2NC(=O)Nc1ccccc1S[C@@H](C)CC#N 520940961 AVWZSRHCWXOVPR-MAUKXSAKSA-N 395.528 5.289 30 20 GKED N#Cc1ccc(CSCC(=O)N2Cc3ccccc3-c3ccccc3C2)cc1 522425091 MVHRIPHMGAOXPV-UHFFFAOYSA-N 384.504 5.001 30 20 GKED Cc1ccc(CCNC(=O)c2ccccc2SCc2ccc(C#N)cc2)cc1 523831391 PVKZXNGUJAJMNY-UHFFFAOYSA-N 386.520 5.132 30 20 GKED C=C(C)COc1cccc(NC(=O)N(C)[C@H](C)c2sc(C(C)C)nc2C)c1 535217152 ZYXFVJDAIICFMS-MRXNPFEDSA-N 387.549 5.755 30 20 GKED CC(C)(C)c1cc(NC(=O)c2ccc(C3(C#N)CC3)cc2)n(Cc2ccccc2)n1 540699050 GMOWNAICEFDWCE-UHFFFAOYSA-N 398.510 5.036 30 20 GKED N#C[C@@H](C(=O)c1ccc(SC2CC2)cc1)c1nc2ccccc2n1C(F)F 542127543 CHBDJCMRFBGPSW-HNNXBMFYSA-N 383.423 5.176 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1 542535467 PYVWXCHMKAFBBR-FSSWDIPSSA-N 382.479 5.053 30 20 GKED N#Cc1cccc(C2(NCc3ccc(Oc4ccccc4F)c(F)c3)CC2)c1 560072253 ZVVPHZXBWIHPAN-UHFFFAOYSA-N 376.406 5.408 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N1CC2(CCC2)[C@@H]1c1ccccc1 562413284 IHJCBXLVLDDOLO-UTKZUKDTSA-N 391.540 5.697 30 20 GKED Cc1c(C(=O)Nc2ccc(Oc3ccccn3)cc2)sc2ccc(C#N)cc12 570111528 QITHTMYJQZMASL-UHFFFAOYSA-N 385.448 5.521 30 20 GKED COCCCCN(Cc1ccccc1)Cc1ccc(C#N)cc1C(F)(F)F 573051576 RNWLMCQDTTZDRE-UHFFFAOYSA-N 376.422 5.006 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)CCSc3ccc(F)cc3)cc2)ccn1 576749560 LFLISKKMPZXLFJ-UHFFFAOYSA-N 393.443 5.006 30 20 GKED C[C@H](N[C@H](C)c1noc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 585753906 MKKLHYCIPDQDLB-ZWKOTPCHSA-N 394.478 5.687 30 20 GKED CN(C(=O)c1cc2ccccc2n1CC#N)c1ccc(Cl)c(C(F)(F)F)c1 589094119 DLIICAPKNOGWPQ-UHFFFAOYSA-N 391.780 5.114 30 20 GKED CC(C)(C#N)c1ccc(CNCc2cc3cc(Br)ccc3[nH]2)cc1 594499792 JWTGIJYTFWQSJV-UHFFFAOYSA-N 382.305 5.021 30 20 GKED C=CCC1(NC(=O)Nc2cccc(C[S@](=O)Cc3ccccc3)c2)CCCC1 596750568 ULYPRWSMDNXQBN-MUUNZHRXSA-N 396.556 5.146 30 20 GKED C[C@@H](Cc1ccco1)C(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 597178757 FWRAISIDDRNNJV-LBPRGKRZSA-N 382.407 5.121 30 20 GKED N#CC[C@@H]1CCCN(C(=O)c2ccc(-c3ccc(Cl)c(Cl)c3)s2)C1 597912210 SORIUPDHMFXNRN-LBPRGKRZSA-N 379.312 5.488 30 20 GKED Cc1ccc(-c2ncc(C(=O)Nc3cc(C#N)ccc3OC(C)C)s2)c(C)c1 604509133 ZUVZFCGLZXFZPV-UHFFFAOYSA-N 391.496 5.338 30 20 GKED CCN(C(=O)Nc1cccc(C#Cc2cccs2)c1)[C@@H](C)c1cccc(O)c1 605409022 ZJHACPPJAHBIGO-KRWDZBQOSA-N 390.508 5.469 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)c1csc(C2CC2)n1 609060419 DIYOMEUHTKLEQP-UHFFFAOYSA-N 389.480 5.032 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Nc1ccc(F)c(C#N)c1 609207611 ILOLMLQHDJIZJQ-LBPRGKRZSA-N 398.438 5.151 30 20 GKED Cc1ccc(C)c([C@H](C)N(C)C(=O)Nc2ccccc2S[C@@H](C)CC#N)c1 609434965 HTYGQJIBRKJOPA-ROUUACIJSA-N 381.545 5.923 30 20 GKED C[C@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609682256 FMVOHMZOXDBDPI-RXVVDRJESA-N 397.478 5.760 30 20 GKED C[C@@H](C#N)CN(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 610097775 QXSSCGMRYICJLS-ZDUSSCGKSA-N 377.366 5.121 30 20 GKED CCc1ccccc1CNC(=O)c1ccccc1SCc1ccc(C#N)cc1 610125989 GVBHDEOHGJRELH-UHFFFAOYSA-N 386.520 5.343 30 20 GKED N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)N(Cc1ccccc1)Cc1ccccc1F 618850361 XENXDDXZBPMIEG-DEOSSOPVSA-N 399.469 5.097 30 20 GKED C=CCCC[C@@H](C)NCc1csc(N(C(C)=O)c2cccc(Cl)c2)n1 638837042 NSXHVDHANFCWAG-CQSZACIVSA-N 377.941 5.316 30 20 GKED CC(=O)c1ccc(-c2ccc(C(=O)N(CC(C)C)c3ccc(C#N)cc3)o2)cc1 642068016 HYIRLBNLVJRSOE-UHFFFAOYSA-N 386.451 5.324 30 20 GKED C[C@H](c1ccco1)N(C)C(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 666170771 ZTNLPCUFNSHOFI-SNVBAGLBSA-N 397.290 5.402 30 20 GKED Cc1cc(C)cc([C@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 730664602 NFCZFASERAFZFZ-CYFREDJKSA-N 383.495 5.842 30 20 GKED CC[C@H](C)Oc1ccccc1/C=C/C(=O)Nc1ccccc1SCCC#N 730981958 FTVOCZHFCJGITK-CLVCIHKQSA-N 380.513 5.522 30 20 GKED O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)CCc2nc(-c3ccccc3F)sc21 731936508 AFCCJTNMHGGUSS-ACCUITESSA-N 380.400 5.070 30 20 GKED CC[C@H](C#N)Oc1cc(C/N=C/c2cc(Cl)cc(Cl)c2O)ccc1OC 733205011 HCWOCKOUHPSLBV-QHBIDGPYSA-N 393.270 5.008 30 20 GKED C=CC[C@@H](NC(=O)Cc1csc(-c2ccc(C(C)C)cc2)n1)c1ccncc1 734460642 ROZKVRIQJOEIQS-OAQYLSRUSA-N 391.540 5.305 30 20 GKED CCOc1ccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c(C)c1 740443113 AXMSKRIXXRSPIE-UHFFFAOYSA-N 391.496 5.316 30 20 GKED Cc1cccc([C@@H](C)CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c1 741396733 RWJCDEBSTOYFOV-CYFREDJKSA-N 383.495 5.576 30 20 GKED C[C@H](NC(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1)c1cccc(C#N)c1 745922963 FYBCXZNNAXFILW-MHECFPHRSA-N 381.479 5.128 30 20 GKED O=C(/C=C/c1cc(-c2ccccc2)cs1)c1ccc(N2CCOC2=O)cc1 748585105 ZNVBZUDIPADWHR-ZHACJKMWSA-N 375.449 5.268 30 20 GKED N#C[C@H](COC(=O)c1csc(-c2ccc(Cl)cc2)n1)Cc1ccccc1 750785173 ZSIUEZHXIKGISM-OAHLLOKOSA-N 382.872 5.003 30 20 GKED N#CC1CCC(COC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)CC1 755973429 KECCIBBQWBDWOV-UHFFFAOYSA-N 394.418 5.316 30 20 GKED CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 760365147 KLKFVOSGMIRVGX-XZOQPEGZSA-N 376.500 5.408 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N[C@@H](C)c2ccc(OCC#N)cc2)cc1 772958786 IADTZSPMYRDRRW-MOPGFXCFSA-N 386.495 5.676 30 20 GKED Cc1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)nn1[C@H](C)C1CC1 776813809 NMLILTJSJQZRDS-VGSWGCGISA-N 384.483 5.070 30 20 GKED COc1ccc(N[C@@H]2CCCc3cc(C#N)ccc32)cc1OCc1cccnc1 776827333 LPNXXEFAELQUBZ-JOCHJYFZSA-N 385.467 5.030 30 20 GKED C=CCSc1ccccc1C(=O)OCC(=O)Nc1c(Cl)cccc1Cl 777075280 CRPATMQKSVTBLH-UHFFFAOYSA-N 396.295 5.067 30 20 GKED Cc1cc(CNC(=O)Nc2ccc(F)cc2OCC#N)ccc1-c1ccccc1 779442588 UQFLQHARHVNWGT-UHFFFAOYSA-N 389.430 5.025 30 20 GKED C[C@@H](OC(=O)Cc1ccc(OCC#N)cc1)c1ccc(SC(F)(F)F)cc1 784106352 IDJOERQCFJKNHA-CYBMUJFWSA-N 395.402 5.048 30 20 GKED Cc1cc(C)c(N2CC[C@@H](Nc3ccccc3S[C@@H](C)CC#N)C2=O)c(C)c1 788796538 FVKPCAJHTBPCTE-AZUAARDMSA-N 393.556 5.224 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 789452174 RAFQECAFFDITHK-UHFFFAOYSA-N 393.575 6.047 30 20 GKED C=CCC1(C(=O)O[C@H](C)c2nnc(-c3ccc(Cl)c(Cl)c3)o2)CCC1 791558315 JMAGENOLMIVYBN-LLVKDONJSA-N 381.259 5.394 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)C[C@@H](CC#N)c3ccccc3)n2)cc1 796633112 GWQUFJFZUWRRJI-WOJBJXKFSA-N 385.492 5.382 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc1 798008659 PNWCEJBMSJDHKC-XWGVYQGASA-N 381.479 5.410 30 20 GKED C[C@H](C#N)Oc1ccc(CNc2ccc(OCC(F)(F)F)c(Cl)c2)cc1 800290836 VGRDFYRXJWRYKH-GFCCVEGCSA-N 384.785 5.184 30 20 GKED C=CCOc1ccc(/C=C\C(=O)Nc2ccccc2-c2cccs2)cc1OC 800696408 SQDBXNHKMRHOBS-QBFSEMIESA-N 391.492 5.640 30 20 GKED C#CCCCCCc1nc([C@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 809532716 KDIJPAIRMWZYHJ-QGZVFWFLSA-N 384.373 5.090 30 20 GKED N#Cc1c(Cl)cccc1SCC(=O)c1ccc(C(F)(F)F)nc1Cl 809960592 QXCTUCMXRBPPLV-UHFFFAOYSA-N 391.201 5.254 30 20 GKED N#Cc1ccc(Oc2ccc3c(-c4ccccc4)cc(=O)oc3c2)cc1[N+](=O)[O-] 811707031 JCIGODPWIPTXQT-UHFFFAOYSA-N 384.347 5.032 30 20 GKED C[C@@H](C(=O)[C@H](C#N)c1cc(C(F)(F)F)ccn1)c1ccccc1C(F)(F)F 813214796 DONKNTNBTDUZQN-ZWNOBZJWSA-N 386.295 5.099 30 20 GKED N#CCCC[C@H](NC(=O)Nc1ccccc1SC(F)F)c1ccccc1 814506561 KEUCJNGJWPSDHU-HNNXBMFYSA-N 375.444 5.558 30 20 GKED C[C@@H](N[C@@H](CCCC#N)c1ccccc1)c1cc(Br)cc(F)c1O 815635958 MRUFQQHGQXSKFQ-ACJLOTCBSA-N 391.284 5.380 30 20 GKED C[C@@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1 824173866 UTJILCRZJKPAEX-HNNXBMFYSA-N 394.475 5.130 30 20 GKED CC[C@@H](C)c1ccc(C(=O)[C@@H](C#N)C(=O)c2sccc2Br)cc1 845846566 HWNGXQJJHSGYTG-BXUZGUMPSA-N 390.302 5.229 30 20 GKED Cc1cc(CN[C@H](CCCC#N)c2ccccc2)c(Br)cc1F 858168720 CSALUCLQJSLANE-LJQANCHMSA-N 375.285 5.421 30 20 GKED C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)/C=C\c1ccccc1C#N)C1CC1 914482164 LZRADYNXIYKFIY-LMRWQKIVSA-N 384.401 5.342 30 20 GKED Cc1ccc(SCC(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1 916977260 OFDKZYMGAXLOQU-QGZVFWFLSA-N 398.940 5.741 30 20 GKED CCc1ccc(CCC(=O)[C@@H](C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1 920138317 DMRVFWIDNAATPH-HXUWFJFHSA-N 390.508 5.190 30 20 GKED CC(=NNc1c(Cl)cccc1Cl)c1sc2ccccc2c1C(=O)O 1776048867 HIGBYZRZWCTSQM-UHFFFAOYSA-N 379.268 5.742 30 20 GKED C=C(Cl)C[C@H](NCc1ccc(Cl)cc1Oc1ccc(F)c(C)c1)C(=O)O 1776143167 SKYLWISATOVZMR-KRWDZBQOSA-N 398.261 5.265 30 20 GKED CC(C)Oc1ccc(C(=O)/C=C/c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776388569 GXSQQMMNLQTYHZ-VQHVLOKHSA-N 384.428 5.422 30 20 GKED CCCCCCCOc1ccc(CNC2CC3(C2)CC2(CC(C(=O)O)C2)C3)cc1 1776786459 XALZVLGJKJQTQF-UHFFFAOYSA-N 399.575 5.549 30 20 GKED CCCCCCCOc1cccc(CN[C@H](C(=O)O)[C@@H](C)c2ccccc2)c1 1776789044 MPYGWLPAMVTVLU-CVDCTZTESA-N 383.532 5.382 30 20 GKED CCc1cccc2cc(/C=C/C(=O)c3cc(C(=O)O)ccc3OC(C)C)oc12 1776977828 LZJAGXINPAYDEY-MDZDMXLPSA-N 378.424 5.377 30 20 GKED Cc1cccc2c1[C@@H](C)/C(=C\c1cccc(OCc3ccccc3C(=O)O)c1)C2=O 1777455815 CNZHYYRYTGADFD-QIWJOQEQSA-N 398.458 5.656 30 20 GKED C=CCC(=O)Nc1ccc(C2(NC(=O)[C@@H](c3ccccc3)C(C)C)CCC2)cc1 1791588632 QGQJGVGCJKZGSR-HSZRJFAPSA-N 390.527 5.136 30 20 GKED C=C(C)CN(CC)C(=O)c1cc2ccccc2cc1OCc1c(C)noc1C 24458819 PIWGNDDJYILMQO-UHFFFAOYSA-N 378.472 5.062 30 20 GKED C=CCN(C(=O)c1cc2ccccc2n1CC)c1nc(-c2ccccc2)cs1 58041078 FLSAFBCSNPEYCP-UHFFFAOYSA-N 387.508 5.618 30 20 GKED N#CCN(C(=O)c1oc2ccccc2c1CSc1ccc(Cl)cc1)C1CC1 63448492 VKAPZGSSDDHOSG-UHFFFAOYSA-N 396.899 5.507 30 20 GKED N#Cc1ccccc1NC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 102831456 FLJCVGXBELFAGW-UHFFFAOYSA-N 380.778 5.697 30 20 GKED O=C(/C=C\c1ccc(-c2nc3ccccc3s2)o1)c1ccc([N+](=O)[O-])cc1 107711135 VGIXTKGPIAIARG-LUAWRHEFSA-N 376.393 5.361 30 20 GKED CC(=O)Nc1ccc(C)c(NCc2cccc(OCc3cccc(C#N)c3)c2)c1 121428464 RRIFIVVWYVYIFS-UHFFFAOYSA-N 385.467 5.016 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 133157297 NBGOLSDFHGAESD-UHFFFAOYSA-N 396.218 5.024 30 20 GKED N#Cc1ccc(-c2nnc(CNc3c(F)cccc3Oc3ccccc3)o2)cc1 133827747 WXCGCPXYZUHRAY-UHFFFAOYSA-N 386.386 5.152 30 20 GKED CCc1onc(C)c1NC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 156452200 NARURNRIHBGLCW-KRWDZBQOSA-N 394.862 5.498 30 20 GKED COc1cc([C@@H](C)N[C@H](CCC#N)c2ccccc2)ccc1SC(F)F 181575875 UVVNRLQTARFDEG-RHSMWYFYSA-N 376.472 5.706 30 20 GKED C[C@H](N[C@H](c1ccccc1)c1cc2ccccc2o1)c1ccc(OCC#N)cc1 181598219 LEVZIRIDXMHXOL-AVRWGWEMSA-N 382.463 5.775 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCOC[C@H]1c1ccc(CC)o1 191506748 VNMNXFPNSURHQM-FQEVSTJZSA-N 382.504 5.299 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCCOc4ccccc43)c2)c1 237855171 YZDIWIWZIKPRIG-XMMPIXPASA-N 384.479 5.141 30 20 GKED CC(C)(C#N)c1ccccc1CON=Cc1cccc(OCc2ccncc2)c1 254976925 GVUGIUGYFGXJKT-UHFFFAOYSA-N 385.467 5.012 30 20 GKED Cc1nc(O)c(C#N)c(C)c1CCC(=O)Nc1ccc(N=Nc2ccccc2)cc1 255145644 QNDOBMRCKRYMRX-UHFFFAOYSA-N 399.454 5.262 30 20 GKED N#CCOc1ccc(CC(=O)N[C@H](CCCc2ccccc2)c2ccccc2)cc1 303481900 OQMNRJIWEHDDCD-RUZDIDTESA-N 398.506 5.012 30 20 GKED CC(C)n1cnnc1SC/C(O)=N/[C@@H]1C[C@H]2CCC(C)(C)c3cccc1c32 329237330 OZBJDQNGZWTECX-RHSMWYFYSA-N 384.549 5.208 30 20 GKED C[C@@H](/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1)c1ccc(Cl)cn1 329353448 UZKSJQQKBVUPNW-GDBMZVCRSA-N 386.927 5.259 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC(c1ccnn1C)C2 374743090 GTDIMDFDIXSSSU-PMACEKPBSA-N 392.547 5.215 30 20 GKED C=CCCc1ccccc1NC(=O)C1(CC)CCN(C(=O)c2ccccc2)CC1 410346936 XYTUXZLFWLKYIJ-UHFFFAOYSA-N 390.527 5.076 30 20 GKED Cc1cc(Br)cc(C)c1NC(=O)CCCSCC1(C#N)CCC1 419461643 LCQBDLQZCZOSAF-UHFFFAOYSA-N 395.366 5.212 30 20 GKED CCC(CC)n1ccc(C(=O)[C@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 431171859 HDYZGLNYWQYZNA-INIZCTEOSA-N 398.919 5.511 30 20 GKED CC(C)(C)c1cc(NC(=O)N[C@@H](CCCC#N)c2ccccc2)n(C(C)(C)C)n1 432785276 KRBQGCCYPROWQR-SFHVURJKSA-N 395.551 5.492 30 20 GKED N#Cc1cccc(OCCCCC(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c1 432839873 AORGIEJGUMFIBJ-JOCHJYFZSA-N 398.453 5.139 30 20 GKED C[C@H](Sc1ccccc1)c1ccc(N[C@H](C(N)=O)c2ccc(C#N)cc2)cc1 437152177 SEVQJYGFKIYCOP-AOMKIAJQSA-N 387.508 5.050 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1csc(C2CCCCC2)n1 444418820 LSOKBRVJMCOOKM-UHFFFAOYSA-N 390.512 5.862 30 20 GKED C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)Nc2ccc(CC#N)cc2Cl)C2CC2)o1 455758731 VSSPZIUNXLKYIW-DYVFJYSZSA-N 383.879 5.319 30 20 GKED CC1(C#N)CCN(C(=O)Nc2ccc(Cl)cc2OCc2ccccc2)CC1 455854646 VEINNTAJHFMURG-UHFFFAOYSA-N 383.879 5.077 30 20 GKED C=CCC[C@H](CC)N[C@@H](c1ccc(Cl)cc1)c1cccc(S(C)(=O)=O)c1 461892048 YWKVXNMTHWYUQJ-FPOVZHCZSA-N 391.964 5.167 30 20 GKED COC(C)(C)C[C@H](C)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 466104275 FRMZDZMPKSABRC-HNAYVOBHSA-N 399.922 5.321 30 20 GKED C=CC[C@@H](CC)NC(=O)c1ccccc1Sc1ccc(Br)cn1 466540706 HARFGZCNJSSTSJ-CQSZACIVSA-N 391.334 5.080 30 20 GKED N#CCCCn1cc(C(=O)N[C@H]2CCSc3ccc(F)cc32)c2ccccc21 468923609 JUMBPNDCLDQMHF-IBGZPJMESA-N 393.487 5.051 30 20 GKED Cc1c(COC(C)(C)C)cccc1NC(=O)[C@@H](Oc1ccccc1C#N)C(C)C 474768701 SBNLAIJMPPLFLM-QFIPXVFZSA-N 394.515 5.224 30 20 GKED N#CC[C@@H](CC(=O)Nc1cccc(Cl)c1Oc1cccnc1)c1ccccc1 475124126 ZUHUJUNAZVDYPY-KRWDZBQOSA-N 391.858 5.553 30 20 GKED C[C@@H](Nc1ccc2c(c1)CCC(=O)N2CCCC#N)[C@H](C)c1ccc(Cl)cc1 475202997 KVTGCILRSWCGOM-DLBZAZTESA-N 395.934 5.527 30 20 GKED N#CC[C@H](CC(=O)N[C@@H](COCc1ccccc1)c1ccccc1)c1ccccc1 476094407 HNDQLUHFDYPAKP-RPBOFIJWSA-N 398.506 5.148 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)C[C@@H](CC#N)c1ccccc1 476604198 TYLRROJJZDVJMT-OAQYLSRUSA-N 383.495 5.633 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2Cl)c1 479401119 VJKYSFRFBRHDLN-OAHLLOKOSA-N 390.817 5.165 30 20 GKED CCc1nc([C@H](C)NC(=O)c2ccc(Sc3ccccc3C#N)cc2)cs1 479625205 HYTPLMFAAOUWKF-AWEZNQCLSA-N 393.537 5.219 30 20 GKED Cc1ccc(N[C@@H]2CCCCc3cc(C#N)ccc32)cc1NC(=O)C(C)(C)C 481990777 MSHYHOFJNFZOTL-OAQYLSRUSA-N 375.516 5.731 30 20 GKED Cc1cc(C(=O)CSCc2ccc(F)cc2C#N)c(C)n1Cc1cccs1 488509817 BFXKEXCXEWENFM-UHFFFAOYSA-N 398.528 5.342 30 20 GKED C=CCOc1ccc(CNC(=O)Nc2ccc3nc(C(F)F)sc3c2)cc1 493176959 PQBSRWNRGWTZFE-UHFFFAOYSA-N 389.427 5.120 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Cc1ccc(Cl)c(Cl)c1 500308197 XPMZETJHFRJLND-UHFFFAOYSA-N 375.299 5.092 30 20 GKED C=CCc1cc(CN[C@@H]2CCc3c2ccc(Cl)c3Cl)cc(OC)c1O 500900859 STUIHNXVRIVWDY-QGZVFWFLSA-N 378.299 5.213 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1 505000762 JTPOSEFYOPXKJA-FQEVSTJZSA-N 394.906 5.704 30 20 GKED COc1ccc(F)cc1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 506802244 ALVUOOXBZGHBNO-UHFFFAOYSA-N 376.387 5.059 30 20 GKED CN1CCC[C@@H](CNC2CCC(C#N)(c3ccccc3)CC2)[C@H]1c1cccs1 507651986 VNYOBVSPPMRCCC-ZOGZRVJRSA-N 393.600 5.125 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC(C)(C#N)CC1)c1cccc(C(F)(F)F)c1 508465490 HPEFNXYDKBDEKD-KRWDZBQOSA-N 381.442 5.128 30 20 GKED CC(C)Oc1ccc(CC[C@@H](C)NC(=O)Nc2ccc(C(C)(C)C#N)cc2)cc1 510605082 IVPSAIPZIMRGJW-GOSISDBHSA-N 393.531 5.418 30 20 GKED Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(Cl)c(C#N)c1 514740407 GUIAWSOQCLIJLK-UHFFFAOYSA-N 390.201 5.220 30 20 GKED N#Cc1ccc(NC(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)cc1Cl 515110327 KMXTYULZWZZTRN-AWEZNQCLSA-N 396.903 5.233 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1 518659605 XKGWFEFZMATCBM-IRXDYDNUSA-N 396.556 5.642 30 20 GKED Cc1cc(C(=O)CCC(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)c(C)s1 518847954 OOWGEGLBXMMVPT-INIZCTEOSA-N 395.311 5.016 30 20 GKED CN(Cc1cccc2ccccc12)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 524417330 XMYQDCREPUKYSN-UHFFFAOYSA-N 396.446 5.156 30 20 GKED CCC(CC)CN(CCC#N)C(=O)c1csc(-c2cccc(Cl)c2)n1 524585540 RPCVPPGGTXETGR-UHFFFAOYSA-N 375.925 5.256 30 20 GKED COc1ccc(-c2csc3ncnc(Oc4cccc(F)c4C#N)c23)cc1 533675919 IOVQSQMWQFVIOW-UHFFFAOYSA-N 377.400 5.170 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)c2cc3ccccc3cc2OC(F)F)n1 536417030 CCFBGMYAYSHPJB-HNNXBMFYSA-N 386.423 5.511 30 20 GKED C=CCC[C@@H](NCc1c(C)nc2sc(C)nn12)c1ccc(C(F)(F)F)cc1 537320437 JYJRLWDACMCYGT-MRXNPFEDSA-N 394.466 5.224 30 20 GKED N#CCCn1cc(CNCc2cc(Cl)sc2Cl)c(-c2ccccc2)n1 537772220 QIGAEVCKBXXKFJ-UHFFFAOYSA-N 391.327 5.122 30 20 GKED Cc1nc(CN(Cc2ccc(C#N)cc2)C2CC2)oc1-c1ccc(Cl)cc1 543244273 AUTZIJANGKUFMY-UHFFFAOYSA-N 377.875 5.340 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1sc(-c2ccccc2)nc1C 544241095 QYHTVNPKVNWJET-UHFFFAOYSA-N 390.512 5.434 30 20 GKED N#Cc1cccc(COc2cccc(CNc3ccc([C@@H]4CCOC4)cc3)c2)c1 555626347 LAVFDJXXBMKJAH-HSZRJFAPSA-N 384.479 5.253 30 20 GKED N#CC1(c2ccc(C(=O)N3CCC[C@@H](c4cccc(C(F)(F)F)c4)C3)cc2)CC1 557074010 GMBJEXVHRSUJRJ-GOSISDBHSA-N 398.428 5.280 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCC2(F)CCC2)cc1Cl 558286834 KAMLUNPUKFZHBQ-SFHVURJKSA-N 385.870 5.399 30 20 GKED C=C(C)CN(Cc1ccc(-c2ccccc2OC)cc1)Cc1ccc(CO)o1 561969252 LIDFFWSWDDHRAR-UHFFFAOYSA-N 377.484 5.026 30 20 GKED CCc1ccc(C[C@H](Cc2ccc(Cl)cc2)NCC2CCC(C#N)CC2)nc1 568438226 LLZYZUKBYHHVIA-VUNKPPBISA-N 395.978 5.371 30 20 GKED N#C[C@]1(C(=O)Nc2ccccc2NCc2ccc(Cl)cc2)CC12CCCC2 571255213 YHYOXDSNCHFUPS-QFIPXVFZSA-N 379.891 5.365 30 20 GKED N#CC[C@H](Cc1nc([C@H](F)c2ccc(C(F)(F)F)cc2)no1)c1ccccc1 576146754 HDUHQWHPFRJXMN-CRAIPNDOSA-N 389.352 5.387 30 20 GKED N#Cc1cc(Oc2ccc(NC(=O)N3CCC[C@H]3c3ccsc3)cc2)ccn1 589365104 QQTANFNVQNSHEJ-FQEVSTJZSA-N 390.468 5.176 30 20 GKED Cc1ccc(CN(CC2CC2)C(=O)Nc2ccccc2S[C@@H](C)CC#N)cn1 592228695 DUMWRXLUKPQKIL-KRWDZBQOSA-N 394.544 5.228 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@](C)(c2cccc(F)c2)C1 593157436 ITENVSGLNXSKHH-ZHRRBRCNSA-N 397.519 5.415 30 20 GKED Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1cc(C#N)cn1C(C)(C)C 603935264 ZRJPCMMHTAQSLY-UHFFFAOYSA-N 398.919 5.452 30 20 GKED N#CCCCOc1cccc(NCC(=O)N(C2CCCCC2)C2CCCCC2)c1 604008862 WFGOGLQHUUAYEB-UHFFFAOYSA-N 397.563 5.275 30 20 GKED N#Cc1cccc(OCc2ccoc2C(=O)Nc2ccc3c4c(cccc24)CC3)c1 608802699 GYCBQTSCDFMECF-UHFFFAOYSA-N 394.430 5.234 30 20 GKED C[C@@H](NC(=O)Nc1cc(C#N)ccc1OC(F)F)c1ccccc1C(F)(F)F 609082964 HZJOEERPKJGZFY-SNVBAGLBSA-N 399.319 5.061 30 20 GKED Cc1ccccc1CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 609378426 LIYQYXOMNKKAGH-UHFFFAOYSA-N 378.419 5.201 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCS[C@H](c2ccccc2)C1 609811029 ILLLLEMZKLTPHJ-JXFKEZNVSA-N 397.569 5.260 30 20 GKED COc1cc(Br)c(CS[C@@H](C)c2ccc(C#N)cc2)cc1OC 609825320 QPOYRYFOHQQYFG-LBPRGKRZSA-N 392.318 5.332 30 20 GKED CCN(C(=O)c1cc(NC(=O)C(C)C)ccc1Cl)[C@H](C)c1ccc(C#N)cc1 610171361 PBSMTESOMUNLQJ-OAHLLOKOSA-N 397.906 5.029 30 20 GKED CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)N[C@@H](C)c1cccc(C#N)c1 610406516 CKVIOLSVJXDPKP-HNNXBMFYSA-N 389.421 5.258 30 20 GKED CC(F)(F)c1ccc(C(=O)NC(CCC(F)(F)F)CCC(F)(F)F)cc1 619129091 NZHFLNQGFRNTLK-UHFFFAOYSA-N 391.302 5.582 30 20 GKED Cc1ccc2c(Cl)c(C(=O)[C@H](C#N)c3cc(C(F)(F)F)ccn3)sc2c1 643779759 OQJPTGGKEJDBGN-GFCCVEGCSA-N 394.805 5.767 30 20 GKED CCOc1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1F 683765609 RWNSMJVXPSTLOJ-VXGBXAGGSA-N 387.339 5.224 30 20 GKED CC(=NNc1nc2ccccc2n1C)c1sc(-c2ccc(Cl)cc2)nc1C 727651286 RHVJEVSKJVXICQ-UHFFFAOYSA-N 395.919 5.495 30 20 GKED COC(=O)c1ccc(/C=C/C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)o1 727654487 NARHZJHWABUEHE-VQHVLOKHSA-N 387.844 5.048 30 20 GKED O=C(c1cc(F)c(F)c(F)c1F)N1CCC[C@H]1c1ccccc1C(F)(F)F 728035168 JTWBLOOBCIFAOP-ZDUSSCGKSA-N 391.286 5.239 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2sccc2OC(F)F)cc1 729316614 OUFULSHWKQKUOM-INIZCTEOSA-N 384.407 5.257 30 20 GKED CC(C)(C)c1ccc(/C=C/C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 730417127 LBQRKBQCVDINHK-BHMZLHOFSA-N 378.472 5.623 30 20 GKED N#C[C@H](NC(=O)Cc1ccc(Cl)cc1Cl)c1ccc(Cl)c(Cl)c1 731645661 POOGNRXGGYDYAH-HNNXBMFYSA-N 388.081 5.224 30 20 GKED C/C(=C/C(=O)N[C@H](C#N)c1cccc(C(F)(F)F)c1)c1ccccc1Cl 731645921 UPGUYNYDODDPAV-QJWNTBNXSA-N 378.781 5.143 30 20 GKED FC(F)(F)c1cccc(NN=C2CCCc3nc(-c4ccccc4)sc32)n1 739421639 NUPLHPVZZADIBG-UHFFFAOYSA-N 388.418 5.376 30 20 GKED Cc1ccc(N(C)C(C)C)c(C(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 741564020 QQMFRHJDDQXYRK-KRWDZBQOSA-N 381.545 5.344 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)cc1 742057091 OLPKRVGHDPFRJT-UHFFFAOYSA-N 394.396 5.640 30 20 GKED C=CCc1cc(OCC)cc(CN(C)C[C@H]2CCCO[C@H]2c2ccccc2)c1O 747806076 PKZMIYBYBNCACT-BWKNWUBXSA-N 395.543 5.119 30 20 GKED CC[C@H](C(=O)[C@@H](C#N)c1nc2ccccc2s1)c1cccc(C(F)(F)F)c1 752159229 DOGSPNZKFIYLRG-LSDHHAIUSA-N 388.414 5.685 30 20 GKED Cc1sc([C@@H](C)/N=C\c2ccc(O)c(O)c2O)nc1-c1ccc(Cl)cc1 755032573 XYIOPCHQFLQVPZ-INRAOFHCSA-N 388.876 5.069 30 20 GKED C/C(=C/c1ccccc1Cl)C(=O)[C@@H](C#N)C(=O)c1c(C)[nH]c2ccccc12 756505399 RCKIEFRKLPWYAN-QAAVPBIRSA-N 376.843 5.125 30 20 GKED CCc1ccc(CC(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 763005537 VBDAAEXCTRIZAE-HNNXBMFYSA-N 382.435 5.070 30 20 GKED COc1cc(/C=C/C(=O)c2cc(Br)ccc2F)cc(Cl)c1OC 763122347 QDCGVWKLPRTXLG-ZZXKWVIFSA-N 399.643 5.155 30 20 GKED C=CCC[C@@H](NC(=O)N1CCC(O)(c2cccc(C)c2C)CC1)c1ccccc1 768401523 BZXPSJFWOWJHQY-HSZRJFAPSA-N 392.543 5.004 30 20 GKED N#C[C@@H](C(=O)[C@H](F)c1ccccc1)c1nc2cc(C(F)(F)F)ccc2s1 769294637 RPGYWBMZDFSXDL-SWLSCSKDSA-N 378.350 5.202 30 20 GKED CCN(Cc1cccc(NCc2ccc(C#N)cc2F)c1)C(=O)OC(C)(C)C 772929719 SENBTICLQAANAR-UHFFFAOYSA-N 383.467 5.066 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@H](C)c2ccccc2OC(F)(F)F)c1 772985719 XPUBXHHYJCQCAJ-GDBMZVCRSA-N 378.394 5.117 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(CN[C@H](C)c2ccc(C#N)cc2F)cc1 781421176 FNQDMFJTLDUNNE-JKSUJKDBSA-N 397.494 5.134 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)CSCCSC(C)(C)C 783554810 UQRYWVAYGNTLPF-AWEZNQCLSA-N 382.620 5.142 30 20 GKED CCCc1c(NC(=S)Nc2cccc(Cl)c2)cnn1-c1cccc(C#N)c1 783954079 RPZYIACMPJYHTQ-UHFFFAOYSA-N 395.919 5.159 30 20 GKED C[C@@H](C#N)Oc1ccc(CNC(C)(C)Cc2ccc(C(F)(F)F)cc2)cc1 785553999 FNQCULJANPEJDR-HNNXBMFYSA-N 376.422 5.107 30 20 GKED O=C1/C(=C\c2cnc(-c3ccncc3)s2)CCc2cc(Br)ccc21 794956986 MHASGTKDYBEOEI-UVTDQMKNSA-N 397.297 5.180 30 20 GKED CCOC(=O)[C@H]1C/C(=C/c2cnc(-c3ccccc3)s2)C(=O)c2ccccc21 802708077 RFFZJFWNMDHSTK-WNJRYGEDSA-N 389.476 5.127 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)/C(F)=C/C3CCCCC3)n2)cc1 815921939 XVMTVEKWSBIDQD-PGLQMZEQSA-N 379.460 5.292 30 20 GKED N#C[C@@H](C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1cc(C(F)(F)F)ccn1 835456714 VQXZSTNAMKUHFL-YNEHKIRRSA-N 399.199 5.387 30 20 GKED CC(C)=CCC[C@@H](C)CC(=O)[C@H](C#N)c1nc(O)c2c3c(sc2n1)CCCC3 842682364 WVFISDBJAWCWHY-ZBFHGGJFSA-N 397.544 5.225 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCc2ccc(Cl)cc2)cc1 915352584 MMJPOHSMGQPPSO-JOCHJYFZSA-N 389.886 5.360 30 20 GKED O=C(Nc1cccc(/C=C\C(=O)c2cc(F)ccc2F)c1)c1ccc(Cl)cc1 916134469 KPMHINMNUPCIKT-WCIBSUBMSA-N 397.808 5.767 30 20 GKED COc1cc(Br)c(/C=C/C(=O)c2cc(C)sc2C)cc1OC 916155886 KGRNUCPIWXNMIJ-AATRIKPKSA-N 381.291 5.041 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(OCc3ccccc3)c(OC)c2)s1 917880457 DXVRBXAMNUHEHT-UHFFFAOYSA-N 392.480 5.022 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1cnc(CCC(F)(F)F)s1 932392200 BZOICUFSWLQTDJ-NSHDSACASA-N 399.463 5.285 30 20 GKED Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccccc1-c1ccccc1C#N 44551343 PFANOCNRGIQPNQ-UHFFFAOYSA-N 395.462 5.135 30 20 GKED COc1cc(C(=O)[C@@H](C#N)c2nc3ccccc3s2)ccc1OC1CCCC1 48824126 SFNSBFMLAJWXMD-MRXNPFEDSA-N 392.480 5.116 30 20 GKED C[C@@H](OCC1CC1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 64682158 MQYHCHASXFDBJA-QMTHXVAHSA-N 395.311 5.108 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)COc2ccccc2Cl)cc1 65680150 ATFWSMQHEVIYIE-UHFFFAOYSA-N 378.815 5.021 30 20 GKED C=CCC(CC=C)C(=O)N(Cc1ccccc1)[C@@H](C)c1cccc(NC(C)=O)c1 122117145 RDQKINBCURUHJX-IBGZPJMESA-N 390.527 5.503 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 125406368 RGSITWPTKYOWOU-HSZRJFAPSA-N 398.466 5.423 30 20 GKED C[C@@H](NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccc(C#N)cc1 174056474 YPCDTLLZZGKGLH-HXUWFJFHSA-N 392.506 5.321 30 20 GKED Cc1nc(Cc2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 177773167 WBVFVKAMUUUBHD-OAHLLOKOSA-N 399.516 5.251 30 20 GKED CC[C@@H](CSC)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 181183317 VGJZKQSNXIPINQ-KRWDZBQOSA-N 383.517 5.264 30 20 GKED CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)[C@H](C#N)c1nc(C(C)C)cs1 181211477 DUUOBNQJPVAHLM-AWEZNQCLSA-N 389.502 5.165 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@H](C1CCCC1)C(F)(F)F 184011898 BQHMYPCGLIOBKN-BLLLJJGKSA-N 385.455 5.323 30 20 GKED COc1cc(C)c(NC(=O)Nc2ccccc2S[C@H](C)CC#N)cc1OC 264991041 KHRSKHOISCEJEW-CQSZACIVSA-N 385.489 5.051 30 20 GKED C=CCOc1ccccc1CNC(=O)N(Cc1ccco1)Cc1ccc(C)s1 303451619 IQVHCDMHNAJHOD-UHFFFAOYSA-N 396.512 5.126 30 20 GKED N#CC1(CCCN[C@@H](CCCc2ccccc2)c2ccccc2)CCOCC1 410419072 OIPHNWXUFJNJAP-DEOSSOPVSA-N 376.544 5.441 30 20 GKED N#CC1(CCSCc2nc(O)c3c(-c4ccco4)csc3n2)CCCCC1 419351957 ICSUYRZMMIUJNH-UHFFFAOYSA-N 399.541 5.754 30 20 GKED CCOc1cccc2cc([C@H](C)NC(=O)N(C)[C@@H](C)c3cccc(C#N)c3)oc12 425401882 QVMQJRXLKBWICQ-HOTGVXAUSA-N 391.471 5.167 30 20 GKED N#CCSc1cccc(C(=O)N2CCC(c3cccc4ccccc34)CC2)c1 429864919 GIRFXVLRUAVZIW-UHFFFAOYSA-N 386.520 5.475 30 20 GKED CN(Cc1cccs1)C(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1 438650782 QSRDOUTXJASCTL-UHFFFAOYSA-N 381.432 5.215 30 20 GKED CC(C)n1nc(-c2ccccc2)cc1NC(=O)N[C@H](CCC#N)c1ccccc1 439398144 SDYIFAWGXCDJRH-HXUWFJFHSA-N 387.487 5.298 30 20 GKED C[C@H](CC#N)N(C)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 444401441 YGYIRIHVSILFJQ-LLVKDONJSA-N 396.249 5.691 30 20 GKED CCOc1ccc([C@H]2CCCN2C(=O)CS[C@@H](C)c2ccc(C#N)cc2)cc1 447015413 GITGJBGPCZREHO-HTAPYJJXSA-N 394.540 5.115 30 20 GKED CC[C@]1(C)Oc2ccc(NC(=O)N[C@H](CCCC#N)c3ccccc3)cc2O1 455251536 KKLQUMQOWKSOIU-XMSQKQJNSA-N 379.460 5.141 30 20 GKED Cc1cccc(C)c1NC(=O)CNc1ccc(Oc2ccccc2C#N)c(F)c1 463235449 MSWTYJKWGSOOPU-UHFFFAOYSA-N 389.430 5.157 30 20 GKED CN(C(=O)c1cc(F)c(C(F)(F)F)cc1F)[C@H]1CCCC[C@H]1C(F)(F)F 464599255 BIARLSAGMVVNHW-RNCFNFMXSA-N 389.286 5.177 30 20 GKED Cc1csc(-c2cccc(C(=O)N3CCC[C@@H]3[C@H](C#N)c3ccccc3)c2)n1 464960947 LRADYWPKOMSHDG-NHCUHLMSSA-N 387.508 5.031 30 20 GKED C[C@H](NC(=O)N(Cc1c(F)cccc1F)C1CCCC1)c1ccc(C#N)cc1 465659943 MSMVQHFWFGTTLR-HNNXBMFYSA-N 383.442 5.052 30 20 GKED CCC[C@@H](CC1CCCC1)C(=O)Nc1ccc2c(c1)CCC(=O)N2CCCC#N 470771202 FFVIJBDRDNPKPG-FQEVSTJZSA-N 395.547 5.205 30 20 GKED C[C@H](c1ccccc1Cl)N(C)CC(=O)c1cn(CCC#N)c2ccccc12 472426202 AVFVGYQKLZGTMF-MRXNPFEDSA-N 379.891 5.084 30 20 GKED Cc1nc(CC2CC2)oc1C(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 475022833 LHWXJZPMRGMNSG-HNNXBMFYSA-N 397.887 5.203 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1 475572298 INIKVLPQAOQESW-DHIUTWEWSA-N 387.527 5.842 30 20 GKED C[C@H](Cc1cccs1)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1 480244304 ALTURFOTAZINCW-OAHLLOKOSA-N 377.469 5.165 30 20 GKED CCS[C@@H]1CCCCN(C(=O)c2ccc(Oc3cccc(F)c3C#N)cc2)C1 480346783 HLTLUDSELQCOOR-GOSISDBHSA-N 398.503 5.237 30 20 GKED C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 480566386 ZJWCPJKNLPZXHD-RDBSUJKOSA-N 385.455 5.276 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H](CC(F)(F)F)c1ccc(F)cc1 481655415 KUCBUZAZFRHFPO-WOJBJXKFSA-N 376.397 5.748 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnn(-c2cc(C)ccc2C)c1C 485497687 VVSLFRIVMTZBQD-UHFFFAOYSA-N 377.513 5.328 30 20 GKED N#CCC[C@@H](NC(=O)N1CCC[C@@H](c2ccc(F)cc2)CC1)c1ccccc1 487936557 SBEBKAWHRYQTAZ-XMSQKQJNSA-N 379.479 5.150 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1C)c1ccccc1 488695918 AVKAJSWMZSGAPG-UGKGYDQZSA-N 390.527 5.308 30 20 GKED C=CCN(Cc1cccs1)[C@@H](C)C(=O)Nc1ccccc1-c1ccccc1 499054221 IPURUQWBKHTJOO-SFHVURJKSA-N 376.525 5.430 30 20 GKED N#C[C@H](NC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1Cl)c1ccccc1Cl 499951500 DTBCAUYHDOHMQS-XEZPLFJOSA-N 379.674 5.131 30 20 GKED C=CCN(C(=O)c1cc(F)c(Cl)cc1Cl)c1nc2c(s1)CCCC2 500299037 PSQNGQVRYUGXDP-UHFFFAOYSA-N 385.291 5.301 30 20 GKED CCCC[C@@H](NC(=O)N(CCC)Cc1ccc(C#N)cc1)c1ccc(OC)cc1 503797029 OMAXZZKJVOJFTQ-HSZRJFAPSA-N 393.531 5.420 30 20 GKED COc1ccc([C@@H]2CCCN2c2c(C#N)cnc3ccc(OC(F)F)cc23)cc1 507116317 OPBZSKKFOCAOMT-FQEVSTJZSA-N 395.409 5.058 30 20 GKED N#Cc1ccc(NC(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)cc1Cl 509511283 VTQOZDLUOOOVJV-HNNXBMFYSA-N 385.748 5.166 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1Oc1cccc(F)c1 517303853 VLWPCEIHDLCFIF-UHFFFAOYSA-N 375.403 5.154 30 20 GKED C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CCC(CCC#N)CC1 518526183 LUUJSEDZKUDKDG-LBPRGKRZSA-N 379.291 5.120 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 521932405 NHQNIQXBHASRSU-IBGZPJMESA-N 386.882 5.508 30 20 GKED CC[C@@H]1CCCN1C(=O)Nc1ccc(OCc2cccc(C#N)c2)c(Cl)c1 524154281 WLSFKQQANJVLBC-GOSISDBHSA-N 383.879 5.197 30 20 GKED Cn1ccc2c(C(=O)Nc3ccc(OCc4cccc(C#N)c4)c(F)c3)cccc21 524496146 HXWLDTWAZJRRKV-UHFFFAOYSA-N 399.425 5.020 30 20 GKED N#Cc1cccc(OCc2cccc(C(=O)Nc3cccc(C(F)F)c3)c2)c1 524505229 QFCXMOYACDIASQ-UHFFFAOYSA-N 378.378 5.327 30 20 GKED C=C(C)[C@@H](CC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N)OCC 534475035 UDOIGQOGZLILDZ-OAHLLOKOSA-N 386.439 5.021 30 20 GKED N#CC1(CCCNc2ccc(-c3csc(C(F)(F)F)n3)cc2)CCOCC1 537533583 OHPBCMCJGFNYEF-UHFFFAOYSA-N 395.450 5.341 30 20 GKED N#CCCCOc1cccc(NC2CCN(Cc3ccc(Cl)cc3)CC2)c1 541901882 WKHPTZSVJXCJAV-UHFFFAOYSA-N 383.923 5.099 30 20 GKED C[C@H](NCc1coc(-c2ccccc2)n1)c1ccc(-c2cccc(C#N)c2)cc1 542012280 RNGGBQNGZOMELV-SFHVURJKSA-N 379.463 5.731 30 20 GKED C=CCn1c(S[C@H](C)c2nnc(C)s2)nnc1-c1ccc(C(C)(C)C)cc1 542338535 AVVGGPRCPRAAQA-CYBMUJFWSA-N 399.589 5.442 30 20 GKED Cc1cccc([C@H]2CCN(C(=O)Nc3ccccc3S[C@H](C)CC#N)C2)c1 542372321 INPIBYWURYWYFH-MJGOQNOKSA-N 379.529 5.411 30 20 GKED N#C[C@@H](NC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1)C1CC1 544413049 XRUHLARCPOJCCT-MRXNPFEDSA-N 394.393 5.028 30 20 GKED N#Cc1ccc(C[S@@](=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1F 549681299 HQDQAANFEDRFKD-HFZDXXHNSA-N 383.875 5.389 30 20 GKED N#CCCN(C(=O)c1cc(-c2ccccc2)ccc1Cl)c1ccc(F)cc1 553943796 JKAUDNYWQVXQCX-UHFFFAOYSA-N 378.834 5.707 30 20 GKED Cc1c([C@@H](C)N[C@H](CCCC#N)c2ccccc2)cnn1-c1cccc(Cl)c1 556198704 WBOICCOKSSRPSB-UZUQRXQVSA-N 392.934 5.920 30 20 GKED C=CCC[C@@H](NCc1cccc(NC(=O)c2ccc(F)cc2)c1)c1ccco1 556866115 QGSLKTDOBGMYSD-OAQYLSRUSA-N 378.447 5.468 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1)c1ccccc1 557488060 FQFFJVYHDJYTMJ-RTFZILSDSA-N 376.500 5.136 30 20 GKED CCC(C)(C)OCc1cccc(NC(=O)NCc2ccc(CC#N)cc2)c1C 567816249 MLWKZOVWOJGRHY-UHFFFAOYSA-N 379.504 5.088 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(F)cc1)C1CCC1 576607078 ZOYRWDUCXNXMNK-QFIPXVFZSA-N 379.479 5.159 30 20 GKED COc1cc([C@H](C)N[C@@H]2CCc3ccc(C#N)cc32)ccc1OCCC(C)C 580015916 IKEMHCOCQWOZQF-HTAPYJJXSA-N 378.516 5.330 30 20 GKED N#Cc1ccc(CN[C@H](c2c(Cl)cccc2Cl)C2CC2)c([N+](=O)[O-])c1 580080452 DMJYSCGVYVSOLP-SFHVURJKSA-N 376.243 5.014 30 20 GKED N#Cc1ccccc1COc1cccc(CNC2(c3cccc(Cl)c3)CC2)c1 584202706 FEZJWYAICKJZFE-UHFFFAOYSA-N 388.898 5.570 30 20 GKED N#Cc1ccc(CN[C@@H]2COc3c2ccc(Cl)c3Cl)c(C(F)(F)F)c1 589508004 NILBOJJHSXHOEG-CQSZACIVSA-N 387.188 5.107 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCc2ccc(F)cc2[C@@H](C)C1 593158410 VKTXRWPFNYVWBW-JKSUJKDBSA-N 397.519 5.414 30 20 GKED Cc1ccc2c(c1)[C@@H](NC(=O)c1ccccc1Sc1ccccc1C#N)CC2 609303651 BZXOVWSFUSDYNR-NRFANRHFSA-N 384.504 5.435 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc2nc(C(F)F)[nH]c2c1 609377956 LZJJOXQIDQDGES-LLVKDONJSA-N 386.427 5.005 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCC[C@@H](Cc2ccccc2)C1 609438935 OZHZYAUWISYIMR-ICSRJNTNSA-N 393.556 5.567 30 20 GKED C[C@@H](NC(=O)NCc1ccc(C#N)cc1)c1ccccc1-c1ccc(Cl)cc1 610090299 ZBXIWWDLNJEQKU-MRXNPFEDSA-N 389.886 5.439 30 20 GKED CN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(CSC2CCCC2)c1 610147835 NXBCDAIPIXETNG-UHFFFAOYSA-N 379.529 5.398 30 20 GKED CCN(C(=O)c1cc2ccccc2n1CC#N)[C@@H](Cc1ccc(F)cc1)C(C)C 610309943 DNCNVEISURLQFD-QFIPXVFZSA-N 391.490 5.033 30 20 GKED Cc1ccc(Sc2ncccc2C(=O)N[C@H](C)c2cccc(C#N)c2)cc1C 610361706 FRYMQJRLNKKHSL-QGZVFWFLSA-N 387.508 5.212 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)N[C@H](C)c3cccc(C#N)c3)s2)c(C)c1 610364842 YRIYGERSGKXONY-OAHLLOKOSA-N 375.497 5.098 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1 613403467 PVOYPTDINNMNSM-CQSZACIVSA-N 393.855 5.403 30 20 GKED CC(C)Sc1ccc(C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 613407479 URLNNKFBBOVUAL-OAHLLOKOSA-N 386.929 5.940 30 20 GKED Fc1cccc2[nH]cc([C@H](NCc3nc(C(F)(F)F)cs3)C(F)(F)F)c12 646063173 NXDHCVXWQPUYNX-ZDUSSCGKSA-N 397.319 5.176 30 20 GKED C=CC[C@@H]1CCCN(Cc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)C1 661381963 QZPUPNIRWZPNHZ-MRXNPFEDSA-N 389.952 5.269 30 20 GKED CCn1nc(C(F)(F)F)c(C(=O)Nc2cccc(C(F)F)c2)c1C(F)F 676165414 HFHSIIOYXIUUBD-UHFFFAOYSA-N 383.267 5.049 30 20 GKED CC(C)c1ncc(C(=O)[C@@H](C#N)c2nc3cc(C(F)(F)F)ccc3s2)s1 676498561 VRYYYMQAWNWBEZ-SNVBAGLBSA-N 395.431 5.385 30 20 GKED CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1 725854504 LCBZUEGCIQSCSF-UHFFFAOYSA-N 389.503 5.008 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccccc2Cc2ccccc2)cc1Cl 726439080 ZSOHXFCJIJFXLT-UHFFFAOYSA-N 377.900 5.611 30 20 GKED O=C(/C=C/c1cn(-c2ccccc2)nn1)c1ccc(Cl)c(Cl)c1Cl 727744830 MBZZXRWACOIPCD-RMKNXTFCSA-N 378.646 5.124 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])c2)cc1 729375659 PRCOYHMQBBUUAV-UHFFFAOYSA-N 393.786 5.164 30 20 GKED COc1cccc(/C=C/C(=O)c2nc(-c3ccccc3)cs2)c1OC(F)F 730084290 AOQRZVPTZGYBST-ZHACJKMWSA-N 387.407 5.316 30 20 GKED Cc1[nH]c2ccccc2c1C(=O)[C@H](C#N)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 730918285 ZTNPGKRIFLASQR-BHDDXSALSA-N 392.458 5.325 30 20 GKED C#CC[C@H](OC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccn1 733693037 RPZAYPDZRHODJJ-HNNXBMFYSA-N 387.279 5.041 30 20 GKED C=CC[C@H](NC(=O)N[C@H](C)C(c1ccccc1)c1ccccc1)c1ccncc1 734660759 AGQCNEDJLLBKRU-XXBNENTESA-N 385.511 5.219 30 20 GKED C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccccc2-c2ccc(Cl)cc2)cc1 740014245 OVYWKMBHIQLJDC-QZTJIDSGSA-N 390.914 6.149 30 20 GKED C[C@@H](CN(C)C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1 740060199 QFSMSASDLQRRHA-KRWDZBQOSA-N 389.524 5.232 30 20 GKED COc1ccc(CN[C@@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)cc1C#N 742369909 IXFLQAWSXHSLPG-ZDUSSCGKSA-N 397.931 5.503 30 20 GKED O=C(/C=C\c1ccc(Oc2cnccn2)cc1)c1cc2cc(Cl)ccc2o1 743055987 AWVYJEYNQHDPSI-CLTKARDFSA-N 376.799 5.565 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc(C23CC4CC(CC(C4)C2)C3)cs1)c1ccco1 744037743 ZTCVIJJFIOHLDE-WMRFHSIXSA-N 380.513 5.184 30 20 GKED CC(C)(C(=O)[C@H](C#N)c1nc2cc(F)ccc2s1)c1ccc2ccccc2c1 744119668 UOKRRQNOCSHJSF-SFHVURJKSA-N 388.467 5.743 30 20 GKED CCCC[C@@H](ON=C(C)C)C(=O)Nc1cccc(C(=O)Nc2ccccc2)c1C 757936715 LUIDBGJZINXEBE-OAQYLSRUSA-N 395.503 5.157 30 20 GKED C[C@@H](C(=O)Nc1cc(C#N)cc([N+](=O)[O-])c1Cl)c1ccc(Cl)c(Cl)c1 764304687 CQTBNNTUSJUAIE-MRVPVSSYSA-N 398.633 5.169 30 20 GKED C[C@@H](C#N)Oc1ccc(/C=C(\Cl)c2nc3cc(C(F)(F)F)ccc3o2)cc1 764434743 ZBHDTAHMTBMZPX-LWHXSLQUSA-N 392.764 5.874 30 20 GKED N#Cc1ccnc(NC(=O)c2cc(-c3ccc(Cl)s3)nc3ccccc23)c1 766955991 DDTCAZSLKJPOLN-UHFFFAOYSA-N 390.855 5.136 30 20 GKED O=C(/C=C\c1cnc(-c2ccccn2)s1)c1ccc(Br)cc1F 767736284 JLKBKHOMETUKLY-ALCCZGGFSA-N 389.249 5.003 30 20 GKED N#Cc1ccc(NC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c(Cl)c1 767849460 FNKPIPLSNPMNPU-CQSZACIVSA-N 393.796 5.252 30 20 GKED C=CCc1cc(CN[C@H](C)c2ccc(F)cc2OC(F)F)cc(OC)c1OC 772945365 FDQQLIBZMBFOCV-CYBMUJFWSA-N 395.421 5.024 30 20 GKED COc1ccc(Sc2ccc(NC(=O)Cc3ccccc3CC#N)cc2)cc1 776891010 UAINLULGIXKIHA-UHFFFAOYSA-N 388.492 5.094 30 20 GKED N#C[C@@H](C(=O)C1=CCCCC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 783069693 KPSUYCVSBDWGNB-AWEZNQCLSA-N 377.296 5.794 30 20 GKED N#Cc1cc(F)cc(C2(C(=O)Nc3ccc([C@@H](C#N)c4ccccc4)cc3)CC2)c1 795203502 CKTDVHKOUKGWKR-QHCPKHFHSA-N 395.437 5.023 30 20 GKED CC(C)(C)OCCCC(=O)Nc1cc(C(F)(F)F)ccc1SCCC#N 796276047 RYHRUKRJWXTDAJ-UHFFFAOYSA-N 388.455 5.245 30 20 GKED Cc1oc(C(C)C)nc1C(=O)OCc1c(F)c(F)c(C(F)(F)F)c(F)c1F 802817035 BUTNOFKBUCZGND-UHFFFAOYSA-N 399.262 5.039 30 20 GKED CC(C)c1ccc2c(Cl)c(C(=O)Nc3n[nH]c(C4CC4)c3C#N)sc2c1 807699148 JWWOAVMDBXZNOO-UHFFFAOYSA-N 384.892 5.403 30 20 GKED C[C@@H](OC(=O)CCCC#N)c1nc2cc(Cl)ccc2n1Cc1ccccc1 812617139 FOGAASCEVKYPLL-OAHLLOKOSA-N 381.863 5.036 30 20 GKED CC(C)(C#N)[C@H]1CCCC1=NNc1ccc(-c2cccc(C(F)(F)F)c2)nn1 814926880 OEUOIFOLFDGQJO-HNNXBMFYSA-N 387.409 5.280 30 20 GKED C[C@H](OC(=O)CC1(C#N)CC1)c1nc2cc(Cl)ccc2n1Cc1ccccc1 815413952 LKXAHKVRSHHBLO-HNNXBMFYSA-N 393.874 5.036 30 20 GKED C=C(Cl)CSc1nc(C)c(CC(=O)Nc2ncsc2C(C)C)s1 823890829 AZSMZVWSDDTMOC-UHFFFAOYSA-N 387.983 5.057 30 20 GKED Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3cnn(C(C)C)c3Cl)n2)cc1 860475346 ZHDYXLNIHNJWFZ-AWEZNQCLSA-N 384.892 5.039 30 20 GKED CC[C@@H](C)c1ccc(C(=O)/C=C/c2cn(CCC#N)nc2-c2ccncc2)cc1 863197639 VHRIHNDSILKTPW-QZEKMECESA-N 384.483 5.268 30 20 GKED O=C(Nc1ccc(C(=O)N(O)Cc2cccc3ccccc23)cc1)c1ccccc1 901370381 GEYLKUKZQBBYJQ-UHFFFAOYSA-N 396.446 5.124 30 20 GKED CNC(=O)c1ccc(/C=C\C(=O)c2ccc(-c3ccc(Cl)cc3)s2)cc1 912859380 PEOCDJGIBFBVOZ-WCIBSUBMSA-N 381.884 5.324 30 20 GKED CC(C)c1cccc(C(C)C)c1NC(=O)CON=C1CCOc2ccccc21 915214845 OYDVBONIFCUJNZ-UHFFFAOYSA-N 380.488 5.075 30 20 GKED CC(=NNc1c(F)c(F)nc(F)c1F)c1cccc(OCc2ccccc2)c1 915948876 VKJBOABVZVHBAI-UHFFFAOYSA-N 389.352 5.053 30 20 GKED Cc1ccc(C)c(C(=O)CCC(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)c1 917046523 KPGQNSLVUHAKDC-INIZCTEOSA-N 396.899 5.406 30 20 GKED CCCC[C@H](CC)COc1ccc(C(=O)/C=C/c2cncc(C(=O)O)c2)cc1 1776125709 QVQLHGGDJMKFFI-CRVDFBCUSA-N 381.472 5.271 30 20 GKED CCCCCCCSc1ccc(C(=O)N2CCc3cc(C(=O)O)ccc32)cc1 1776787527 NLMFEGZQKGMDDB-UHFFFAOYSA-N 397.540 5.650 30 20 GKED CCc1oc2ccccc2c1/C=C\C(=O)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776999118 AWUYYCVLIVJPKF-QXMHVHEDSA-N 386.403 5.850 30 20 GKED COc1ccc2c(c1)C[C@@H](C)/C(=C\c1c(F)ccc3sc(C(=O)O)cc13)C2=O 1777372561 JVYWZZCDNXFSBX-BTAWCLGRSA-N 396.439 5.206 30 20 GKED CCCCCCn1c(SCC(=O)Nc2sccc2C#N)nc2ccccc21 8759542 CJQSPJLLAKZYDY-UHFFFAOYSA-N 398.557 5.281 30 20 GKED Cc1cccc(N/C(S)=C(/C(=O)c2cc3ccccc3o2)[n+]2ccccc2)c1 27173786 KNUWQGYUQSBUIL-UHFFFAOYSA-O 387.484 5.080 30 20 GKED Cc1nc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)cs1 45344820 KBVADFIXNPFZCN-SFHVURJKSA-N 396.903 5.082 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)/C(O)=N/c1nnc(-c2ccsc2)s1 52496265 LYFYNUIIFOJICL-SNVBAGLBSA-N 378.910 5.159 30 20 GKED O=C(NCc1cccc(C(F)(F)F)c1)Nc1cc(C(F)(F)F)ccc1F 97543483 WVWBCDACLRTJLS-UHFFFAOYSA-N 380.263 5.185 30 20 GKED C=C[C@H](CC(=O)Nc1cccc(C[S@](=O)C2CCCCC2)c1)c1ccccc1 135042936 HULVQHZQOCQHQQ-PIIWDFAUSA-N 395.568 5.566 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NCc2nc(C3CC3)cs2)cc1 165037636 VPKINHHDEOMBRS-UHFFFAOYSA-N 390.468 5.006 30 20 GKED N#C[C@@H](C(=O)C1(Cc2ccccc2)CCC1)c1nc2ccccc2n1C(F)F 177135949 BWYIWPZKEJDCDK-INIZCTEOSA-N 379.410 5.021 30 20 GKED COc1ccc(-c2csc(CNCc3cccc(OCCCC#N)c3)c2)cc1 177583847 QNDFKSYPBVLRSD-UHFFFAOYSA-N 392.524 5.396 30 20 GKED COc1ccc([C@@H](N[C@@H](C)c2ccc(OCC#N)cc2)c2ccc(F)cc2)cc1 181621790 AQSRCMUNGXRZMZ-XDHUDOTRSA-N 390.458 5.177 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2cccc(F)c2)C1 191442794 KZSUOFNNMADUCU-OAQYLSRUSA-N 382.479 5.283 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H](CN2CCC(C)CC2)C1 191488426 IUZIZCNKZLJKKE-OAQYLSRUSA-N 397.607 5.514 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)c2sccc2OC(F)F)cc1 303274160 RZVZITIMVOIXAO-UHFFFAOYSA-N 386.379 5.266 30 20 GKED OC(=Nc1cccc2ccsc12)N1CCC(/N=C(/O)CC2CCCC2)CC1 328833854 RWEVBONRENPVLZ-UHFFFAOYSA-N 385.533 5.448 30 20 GKED C/C(O)=N/C1(c2noc([C@@H]3C[C@H]3c3ccc4ccccc4c3)n2)CCCCC1 329441256 KETHOELVYBYJDN-VQTJNVASSA-N 375.472 5.630 30 20 GKED N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC(c3ccc(C(F)(F)F)cc3)CC2)c1 412227830 DVBSVNFQCJLKNM-LEWJYISDSA-N 398.428 5.087 30 20 GKED N#CCC1(CNC(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1 430427482 OQLJZPJHVJCHAE-SFHVURJKSA-N 388.298 5.076 30 20 GKED CC(C)n1ncc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)c1-c1ccccc1 430596499 OPTKSIAWJZWRKH-INIZCTEOSA-N 392.528 5.375 30 20 GKED COc1cc(Cl)c(Cl)cc1C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1 430645786 OIAOCWWNALPDMS-SNVBAGLBSA-N 383.300 5.246 30 20 GKED CN(Cc1ccccc1NC(=O)[C@H](C#N)CCc1ccccc1)C1CCCCC1 433234736 TVYWLLLWFZAWJY-NRFANRHFSA-N 389.543 5.162 30 20 GKED CC(C)Oc1ccc(NC(=O)N(Cc2ccco2)Cc2cccs2)cc1C#N 435554054 LHCOPCHLCSKIHC-UHFFFAOYSA-N 395.484 5.234 30 20 GKED CS[C@@H]1CCCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2)C1 435603845 ANJQIZNAFGSNAR-HXUWFJFHSA-N 381.501 5.100 30 20 GKED N#Cc1ccc(CNC2(c3ccc(Cl)c(Cl)c3)CC2)c(OC(F)F)c1 437408372 UWIFQKMPASVHLV-UHFFFAOYSA-N 383.225 5.245 30 20 GKED C=CCC[C@@H](NCc1cncn1Cc1ccccc1)c1ccc(C(F)(F)F)cc1 445811328 REHOBTQFYYFAOK-JOCHJYFZSA-N 399.460 5.747 30 20 GKED C[C@@H](C(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1)c1cccc(C#N)c1 463592930 SNZPBMZDNZCHSY-OPAMFIHVSA-N 399.881 5.609 30 20 GKED Cc1nn(C)c2cc(NC(=O)c3ccccc3Sc3ccccc3C#N)ccc12 464580848 CCEZSKIRQZWRPW-UHFFFAOYSA-N 398.491 5.157 30 20 GKED CC[C@H](C)C[C@H](C)NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 466162941 KCRWWFKGRYGGQB-ROUUACIJSA-N 379.504 5.278 30 20 GKED O=C(Nc1cccc(OCC(F)(F)F)c1)c1cc(C(F)(F)F)ccc1F 471230529 SKEWRNONNHWGIV-UHFFFAOYSA-N 381.247 5.038 30 20 GKED Cc1ccc(C#N)cc1NC(=O)N(Cc1ccccc1)[C@@H](C)c1cccs1 476796021 WZLCKDMWTQMJIY-KRWDZBQOSA-N 375.497 5.724 30 20 GKED N#C[C@H](Sc1nnc(-c2ccccc2F)n1Cc1ccco1)C1CCCCC1 489650969 PEBHYHDTANUFGJ-IBGZPJMESA-N 396.491 5.290 30 20 GKED C=CCOc1ccc(-c2nnc(SCc3cc(-c4ccccc4)no3)o2)cc1 489755937 DEFWQMSGFUHBKO-UHFFFAOYSA-N 391.452 5.249 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N[C@@H](COc2ccccc2F)C(C)(C)C)cc1 490666404 FWHGFJPPQQWNTK-FQEVSTJZSA-N 397.494 5.242 30 20 GKED C=CCc1cc(CNCc2cccc(Oc3ccccc3)c2)cc(OC)c1O 500259456 WSKXZIRWCGKTMT-UHFFFAOYSA-N 375.468 5.211 30 20 GKED Cc1coc(-c2ccc(C)c(NC(=O)N3CC=C(c4ccc(C#N)cc4)CC3)c2)n1 502642538 MNAHHFSKLKYASJ-UHFFFAOYSA-N 398.466 5.151 30 20 GKED COc1ccc(-c2csc([C@H](C#N)C(=O)c3ccc(C)c(Cl)c3)n2)cc1 503540754 XZZGRZVZCIIWGB-MRXNPFEDSA-N 382.872 5.271 30 20 GKED N#Cc1ccc(OCc2ccc(C(=O)N3CCC[C@H]3/C=C\c3ccccc3)o2)cc1 505359953 OTULENATGXMDLC-OMCJBDSBSA-N 398.462 5.048 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 509926009 HFXXQGWHCKHTMS-LLVKDONJSA-N 396.249 5.548 30 20 GKED C[C@H]1CCCCCN1C(=O)Nc1ccccc1COc1ccc(CC#N)cc1 512719323 BKMHULDBTRSHDR-SFHVURJKSA-N 377.488 5.128 30 20 GKED CC[C@@H]1C[C@@H](CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCO1 513654615 WWSJWPKNSKWBCQ-SCWSEQNSSA-N 396.918 5.529 30 20 GKED Cc1cc(-c2nc(C3CC3)no2)ccc1NCc1ccc(C#N)cc1C(F)(F)F 515160035 KOQFFQCLWRHSKP-UHFFFAOYSA-N 398.388 5.425 30 20 GKED N#C[C@@H](C(=O)c1cccc(C(F)(F)F)c1)c1nc2cc(Cl)ccc2s1 515547335 UYTFDKJQACCHLS-LBPRGKRZSA-N 380.778 5.459 30 20 GKED N#CCCCOc1cccc(NC(=O)C2(c3cccc(Cl)c3)CCCC2)c1 515614239 BWWKHTFVWCIOBH-UHFFFAOYSA-N 382.891 5.473 30 20 GKED C[C@@H](c1ccccc1Cl)N(C)C(=O)Nc1ccccc1SC[C@H](C)C#N 517473260 MAHGJFPCRYPTQS-CABCVRRESA-N 387.936 5.817 30 20 GKED COc1cccc([C@H]2C[C@@H]2C(=O)Nc2sc3c(c2C#N)CCCCCC3)c1 518028917 ASLNPGTUENIZGT-MSOLQXFVSA-N 380.513 5.030 30 20 GKED C[C@@H](Nc1ccc(NC(=O)c2ccc(C#N)cn2)cc1Cl)c1ccccc1 518072816 LYMQIOJJYDDIHV-CQSZACIVSA-N 376.847 5.032 30 20 GKED C[C@@H](c1ccc(F)cc1)N(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1 520597929 LNMPSTRGPFFBBX-INIZCTEOSA-N 389.430 5.715 30 20 GKED C=CCN(CC=C)C(=O)c1ccc(NC(=O)N2CCCC3(CCCCC3)C2)cc1 524151942 FMHIFNDQCZKTMZ-UHFFFAOYSA-N 395.547 5.079 30 20 GKED Cc1cccc([C@H]2CCCN2C(=O)Nc2ccccc2C#Cc2ccccc2)n1 531968386 HZPRUOOKZRPYKB-XMMPIXPASA-N 381.479 5.159 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccccc1CCC(F)(F)F 535472017 DHVPMROTLPVSPM-AWEZNQCLSA-N 392.446 5.828 30 20 GKED Cc1cccc(-c2n[nH]cc2CNCc2ccc(-c3ccccc3C#N)cc2)c1 538002706 QUHFYTPUMCYRGX-UHFFFAOYSA-N 378.479 5.214 30 20 GKED C=CCCC[C@H](C)NC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 538333394 YAORMULFBDTEBY-ZDUSSCGKSA-N 382.451 5.232 30 20 GKED N#C[C@H](C(=O)c1ccn(Cc2ccccc2)c1)c1nc2cc(Cl)ccc2s1 541018123 DQRSGAAISCMFHE-QGZVFWFLSA-N 391.883 5.290 30 20 GKED N#Cc1ccc(Cl)cc1N(Cc1ccccc1)C(=O)CCCC1CCOCC1 542136266 BKGUMSJYLYVBKP-UHFFFAOYSA-N 396.918 5.342 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)c2ncoc2-c2cccc(C(F)(F)F)c2)cc1 542223651 HGVWRXMIZSSIKI-UHFFFAOYSA-N 399.372 5.414 30 20 GKED C[C@H](N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1)c1cn(-c2ccccc2)nn1 542934933 XSTKXAPIKUYUDX-MOPGFXCFSA-N 393.494 5.218 30 20 GKED C[C@H](N[C@@H](CCCC#N)c1ccccc1)c1ccc(SCC(F)(F)F)cc1 551222829 MUWFVUFNLWTZPW-JXFKEZNVSA-N 392.490 6.427 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)c2sc3ccc(C#N)cc3c2C)cc1 555845079 XJTGYIURJFHQLB-UHFFFAOYSA-N 389.480 5.041 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)NC1CC(C)(c2ccccc2)C1 557581862 JSFMIQIHBIGRQX-FVYSKSNYSA-N 379.529 5.180 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N1CC(C)(C)[C@@H]1C1CC1 570250774 UEVBUQUCNFXVAB-NRFANRHFSA-N 375.472 5.311 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC[C@@H](O)COc1cccc2ccccc12 576936993 UFMPIJARSYABQX-IEBWSBKVSA-N 392.524 5.086 30 20 GKED CCc1sc(-c2nnc(CSc3nc4c(cc3C#N)CCCC4)o2)cc1C 585688388 IKZHMGOQXBZROO-UHFFFAOYSA-N 396.541 5.107 30 20 GKED COc1cc([C@H](C)NCc2ccc(C3(C#N)CC3)cc2)ccc1OC1CCCC1 594924588 KCAVBTKZEIGFOL-SFHVURJKSA-N 390.527 5.423 30 20 GKED N#Cc1c(NC(=O)c2ccc(C(F)F)cc2)sc2c1-c1ccccc1CC2 608805131 XFPNKBUQVGNEOH-UHFFFAOYSA-N 380.419 5.575 30 20 GKED CN(Cc1ccccc1-c1ccccc1)C(=O)c1cc2ccccc2n1CC#N 609169942 ZSWVLPVRQFLLRF-UHFFFAOYSA-N 379.463 5.104 30 20 GKED CCC[C@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccn1 609208593 WNAVDOXCDZAIIN-QFIPXVFZSA-N 386.455 5.408 30 20 GKED CCOc1ccccc1[C@@H](CC)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 609401916 JYMLTCTUGHOKRM-FUHWJXTLSA-N 397.544 5.610 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2ccc(C#N)cc2)nc1 609682637 UQPSQOHQZVOUKM-XLIONFOSSA-N 398.466 5.155 30 20 GKED COc1ccc(CNCc2c(C)c(C)c(C)c(C)c2C)cc1OCCCC#N 610932673 MSTLZRQNZHWFLP-UHFFFAOYSA-N 380.532 5.210 30 20 GKED C[C@]1(C#N)CCCN(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)C1 612302555 CUXBZITYNJTSBQ-OAQYLSRUSA-N 394.862 5.162 30 20 GKED O=C(Nc1cccc(F)c1Cl)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 672847139 BUNAFWDSVORHKG-YUMQZZPRSA-N 392.702 5.074 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H]1CCC(F)(F)C1)c1ccc(C(F)(F)F)cc1 676725870 QYGANGCTQWHZEX-HUUCEWRRSA-N 376.369 5.200 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N[C@H](c2ccccc2)C2CCC2)cc1 729552360 FPQSMSMOQORWDG-LOSJGSFVSA-N 395.506 6.005 30 20 GKED C[C@H](CSc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 731973403 XVXSOASIHYJVAE-JPYJTQIMSA-N 386.520 5.709 30 20 GKED C#CC[C@H](OC(=O)c1csc(-c2ccc(C(C)C)cc2)n1)c1ccccn1 733691491 TUVNWOWDMHQKNV-FQEVSTJZSA-N 376.481 5.250 30 20 GKED CCOc1cccc(C=Nc2cccc(C[S@](=O)C3CCCCC3)c2)c1O 734979210 MCGDITUQVUJNCM-MHZLTWQESA-N 385.529 5.123 30 20 GKED COc1ccccc1[C@@H](C)SCC(=O)N(CCC#N)c1ccc(C)c(C)c1 742455813 WLFKTNLHTFZEKK-GOSISDBHSA-N 382.529 5.053 30 20 GKED CCN(CCC#N)Cn1nc(-c2cccc(C)c2)n([C@@H]2CCCC[C@@H]2C)c1=S 742539273 HGVRQMMBAOCVHH-AZUAARDMSA-N 397.592 5.334 30 20 GKED CC(=NNc1ncnc2c1oc1ccccc12)c1c(C)nn(-c2ccccc2)c1C 746488861 MQDSYYJUOUUVCY-UHFFFAOYSA-N 396.454 5.015 30 20 GKED COc1ccc(C=NN=C(c2ccccc2)c2ccccc2)cc1OCCCC#N 747356673 CTLRTYRCLYPMKY-UHFFFAOYSA-N 397.478 5.249 30 20 GKED N#CCOc1ccc(Cl)cc1CSCc1ncc(-c2cccc(F)c2)o1 747847669 SNQYQVYZBJPPPY-UHFFFAOYSA-N 388.851 5.470 30 20 GKED Cc1cc(SC2CCCCC2)ccc1NC(=S)Nc1ccccc1C#N 748157824 NHWFWMCTEQFZNS-UHFFFAOYSA-N 381.570 6.100 30 20 GKED CCc1ccc(C(C)(C)C(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 750691026 WEWFZFZMMLKSRN-MRXNPFEDSA-N 381.426 5.148 30 20 GKED C=C(Cl)COc1ccc([C@H](C)NCc2ccc(OC(F)F)c(OC)c2)cc1 764640183 GTXXEFNXNVOWOB-AWEZNQCLSA-N 397.849 5.279 30 20 GKED Cc1cccc2nc([C@@H](C#N)C(=O)C[C@H](C)c3ccc(Br)cc3)[nH]c12 770542283 MOEXHAJVXNQSRV-BBRMVZONSA-N 396.288 5.004 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@H](C#N)C(=O)c1coc2cc(C)c(C)cc12 770839113 MYKJQWLKJILXLZ-LJQANCHMSA-N 388.467 5.136 30 20 GKED Cc1cccc(C)c1N=C1NC(=O)/C(=C/c2ccc(F)cc2C(F)(F)F)S1 771843364 ZAVCMHRIFHHKEX-NVNXTCNLSA-N 394.393 5.353 30 20 GKED C[C@H](Nc1ccc(OCc2cccc(C#N)c2)c(F)c1)c1nc2ccccc2o1 777941355 PXZKUVVASCQBFH-HNNXBMFYSA-N 387.414 5.591 30 20 GKED CC(C)c1csc([C@@H](C#N)C(=O)COc2ccc(-c3ccccc3)cc2)n1 780401648 GFQVYISAGDOCTR-IBGZPJMESA-N 376.481 5.189 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H](F)CC3CCCCC3)n2)cc1 796662968 UHULMOCYNDUQCC-MSOLQXFVSA-N 381.476 5.167 30 20 GKED N#CCCCOc1cccc(NC(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)c1 801664040 KWMYNEPPADZQOE-QGZVFWFLSA-N 380.341 5.037 30 20 GKED Cc1nc(Cl)ccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 802045253 JCYPWXXIQTXEHM-LLVKDONJSA-N 395.793 5.162 30 20 GKED N#Cc1sc(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)nc1Cl 804339632 BJWHYBUIECLDFS-UHFFFAOYSA-N 380.812 5.234 30 20 GKED C[C@H](NCc1ccc(Br)cc1C#N)c1cccc(OC(F)(F)F)c1 805747994 JSLMTIILFRZCGK-NSHDSACASA-N 399.210 5.070 30 20 GKED N#C[C@@H](C(=O)C1(CCF)CC1)c1nc(-c2ccc(Cl)cc2Cl)cs1 810531035 FENCRSUNSPGTAI-LBPRGKRZSA-N 383.275 5.433 30 20 GKED Cc1nc(C)c(/C=C2/CC(c3ccccc3)C/C(=C/c3oc(C)nc3C)C2=O)o1 821028608 USTRFRNULGVLPC-FDYZEBBJSA-N 388.467 5.510 30 20 GKED CCOP(=O)(CCC=NNc1cc(C)c2cc(Cl)ccc2n1)OCC 834936465 XAWGUFRHGVHCSU-UHFFFAOYSA-N 383.816 5.251 30 20 GKED N#C[C@@H](C(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1nc(C2CC2)cs1 842941824 SXDPMLYCLJNBJW-GRFABLRMSA-N 396.821 5.496 30 20 GKED Cn1c(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc(Cl)c1Cl 915084988 CNFHFZCHYMPXHC-INIZCTEOSA-N 384.266 5.240 30 20 GKED Cc1ccc2c(CC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)coc2c1 915179472 FVCSIYXZBZNEAA-HSZRJFAPSA-N 380.447 5.578 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1ccc(Oc2ccccc2)nc1 916039931 ZMUUEUBEPJXULF-UHFFFAOYSA-N 394.814 5.017 30 20 GKED Cc1ccc(Cl)cc1Oc1ccccc1C=NNc1cccc(C(=O)O)c1C 1776088772 HRMBMZWXIXKZPS-UHFFFAOYSA-N 394.858 5.893 30 20 GKED CC(C)Cc1ccc(C(=O)/C=C/c2ccc(-c3ccccc3C(=O)O)cc2)s1 1776339878 IRVZKBGFWUPVLC-UKTHLTGXSA-N 390.504 6.208 30 20 GKED C[C@H](Oc1cccc(C(=O)/C=C\c2cc(Cl)cc(C(F)(F)F)c2)c1)C(=O)O 1776470950 RFEQEZYSLDHELA-GZTOBOFZSA-N 398.764 5.107 30 20 GKED CC1(C)C/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2ccccc21 1776526466 HFFRWHNJBQRZQD-HMAPJEAMSA-N 396.486 5.928 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1cc(Br)cc(F)c1F 1776783730 GGEDJXVVTIWFST-CQSZACIVSA-N 392.284 5.021 30 20 GKED CCCCCCCOc1ccc(/C=C/c2cc(C(=O)O)c3cnn(C)c3n2)cc1 1776785895 LMJBDQOMLNWXRE-DHZHZOJOSA-N 393.487 5.186 30 20 GKED CCCCc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776805937 GWAHZPCIAQTASH-LUAWRHEFSA-N 382.456 5.977 30 20 GKED CCCOc1ccc(C(=O)/C=C\c2c(F)ccc3sc(C(=O)O)cc23)cc1 1776816383 CKLCBFAGPAGQAE-CLFYSBASSA-N 384.428 5.424 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\C(=O)c2cccs2)cs1 54895348 NTOOKOCLEPTAER-TWGQIWQCSA-N 388.901 5.439 30 20 GKED CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/C(=O)c2cccc(C)c2)cs1 54897119 GWAJRIFWBWJLSB-DHZHZOJOSA-N 396.899 5.686 30 20 GKED N#CCCCOc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1 55569776 IQNOWKPEFSFUOS-UHFFFAOYSA-N 398.553 5.490 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1nc2cc(F)c(F)cc2s1 58779367 VPZZTWGJOUDVMH-UHFFFAOYSA-N 391.402 5.365 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 66347866 GTWGYLMWOVMNOO-FQEVSTJZSA-N 395.915 5.204 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N(Cc1cccc(F)c1)C1CC1 66954426 VXUPJVDEPJBKRC-OAHLLOKOSA-N 383.492 5.416 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 92358785 KCQRIINSXJUUBX-MRXNPFEDSA-N 386.414 5.279 30 20 GKED CC(C)Oc1cccc([C@@H](C)NC(=O)c2ccccc2-c2ccccc2C#N)c1 107633723 GSJAFKRMPCVQKK-GOSISDBHSA-N 384.479 5.503 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)CCCc1cccs1 116948677 QIVONPLTTGXNPR-UHFFFAOYSA-N 377.469 5.077 30 20 GKED COc1cccc2cc(C(=O)Nc3ccc(Oc4ncccc4C#N)cc3C)oc12 120621446 OLAVMDZWYZWPCK-UHFFFAOYSA-N 399.406 5.061 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](c2ccccc2)c2nccs2)cc1 123360689 JCECQKKFYFRCNT-OXJNMPFZSA-N 384.932 5.715 30 20 GKED C[C@H](c1ccccn1)N(C)C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1 172233903 OLZUEHOJTQVZMG-OAHLLOKOSA-N 391.858 5.232 30 20 GKED C[C@@H](Nc1ccc(NC(=O)C2(c3ccc(C#N)cc3)CC2)cc1)c1ccccc1 189397709 JUISHPAKPHMUAN-GOSISDBHSA-N 381.479 5.402 30 20 GKED C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)c1cccc(C#N)c1 189791933 WSLIVNVCBKGALR-MRXNPFEDSA-N 386.480 5.311 30 20 GKED COc1cccc(Cl)c1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 192217295 UQZUBBUCSRZGDB-ZDUSSCGKSA-N 389.908 5.065 30 20 GKED CCO[C@H](C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccccc1 194485167 CRSVEYBYWFRYBV-XLIONFOSSA-N 396.899 5.418 30 20 GKED N#Cc1cccc(COc2cccc(CN[C@@H]3CCSc4ccccc43)c2)c1 237855328 JJHBOTYNFRHGQM-HSZRJFAPSA-N 386.520 5.464 30 20 GKED COc1ccc(/C=C\C(=O)c2cccc(-c3ccncc3)c2)cc1OCCCC#N 255459592 OMBCWTFOXJIYSN-CLFYSBASSA-N 398.462 5.336 30 20 GKED COc1ccc([C@@H]2CCCN2C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 264587601 ZQPPHGGZCDYWQM-UZLBHIALSA-N 395.528 5.316 30 20 GKED Cc1ccc(Cl)cc1NC(=O)c1cccc(COc2ccccc2C#N)c1 303593027 SPFVZYCAAGLUPP-UHFFFAOYSA-N 376.843 5.351 30 20 GKED Cc1ccc([C@@H]2CCCCN2C(O)=Nc2nc(C3CCOCC3)cs2)cc1 329463220 UHILLEHLLMBBRB-IBGZPJMESA-N 385.533 5.118 30 20 GKED N#CC1(CCSc2nnc(COc3ccc(Cl)cc3)o2)CCCCC1 412987898 ZUAMIXXEPXGKOX-UHFFFAOYSA-N 377.897 5.258 30 20 GKED N#Cc1ccccc1COc1cccc(CNC[C@@H]2CCO[C@H]2c2ccccc2)c1 428702435 RRSSFGKXRVCXNL-OZXSUGGESA-N 398.506 5.005 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1ccc(Cl)cc1 430596700 KAMYHFMYIILATM-HNNXBMFYSA-N 398.919 5.078 30 20 GKED CCOc1ccc(-c2nc(CN[C@@H](CCCC#N)c3ccccc3)cs2)cc1 433020954 VMHLAXHKDPNAGJ-QFIPXVFZSA-N 391.540 5.734 30 20 GKED CCc1ccc([C@@H]2CCN(C(=O)Nc3ccccc3S[C@@H](C)CC#N)C2)cc1 433144504 MNFADGUROKRQFY-FXAWDEMLSA-N 393.556 5.665 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1nc(C2CCCCC2)no1)c1ccccc1 435761349 FNWLQHWVMBAXDB-LPHOPBHVSA-N 382.508 5.185 30 20 GKED C[C@@H]1C[C@H](c2cccc(F)c2)N(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1 438629482 FWSNGOAOTKKVIK-KZULUSFZSA-N 391.368 5.331 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC(Cc2ccccc2Cl)C1 438641302 LEGIUHQEELTGSV-OAHLLOKOSA-N 399.947 5.441 30 20 GKED N#Cc1ccc(-c2csc([C@@H](C#N)C(=O)c3ccc(OC4CCC4)cc3)n2)cc1 442881568 ZPHWIKKZFHWHIL-FQEVSTJZSA-N 399.475 5.103 30 20 GKED C=CCc1cccc(C(C)C)c1NS(=O)(=O)c1ccc(CC#N)cc1Cl 451002268 BHGAMJCVGJCPPL-UHFFFAOYSA-N 388.920 5.059 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1C[C@@H](C(F)(F)F)OC(C)(C)C1 455255837 ZUSLZPCKMWIFOY-INIZCTEOSA-N 384.442 5.112 30 20 GKED CC(C)CCn1ncc(NC(=O)N[C@H](CCCC#N)c2ccccc2)c1C(C)C 455270291 SVWIEDHCZRBCPZ-HXUWFJFHSA-N 395.551 5.609 30 20 GKED N#CCCC[C@H](NC(=O)N1CCCC[C@@H]1c1ccc(F)cc1F)c1ccccc1 458803409 REYZXIGUTKSDQX-FCHUYYIVSA-N 397.469 5.637 30 20 GKED CC1(C)CN(C(=O)N[C@H](CCCC#N)c2ccccc2)CC[C@H]1C(F)(F)F 458812234 CPKQPFGHKYHXKV-IAGOWNOFSA-N 381.442 5.042 30 20 GKED CC(C)(CC#N)CNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 459236286 QQVSMRYWTFPKEQ-GOSISDBHSA-N 380.879 5.057 30 20 GKED COc1ccc(C)cc1[C@H](C)NC(=O)Nc1ccccc1SC[C@@H](C)C#N 459403417 QJYPXRXPWBWJND-HOTGVXAUSA-N 383.517 5.138 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)Nc3ccccc3CC(F)(F)F)cc2)nc1 460397076 BHQFKISRRPFRTG-UHFFFAOYSA-N 397.356 5.103 30 20 GKED C=CCOCCCC(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 463282823 SRCKLKOYYOFTEE-UHFFFAOYSA-N 378.299 5.182 30 20 GKED C=C[C@@H](C)NC(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 465160967 WKHVYPJGRBBOTD-GFCCVEGCSA-N 392.381 5.045 30 20 GKED CSc1cc(C)ccc1CNC(=O)Nc1ccccc1S[C@@H](C)CC#N 465252875 KWYBEOPTCUQWSJ-HNNXBMFYSA-N 385.558 5.433 30 20 GKED CSc1ccc([C@H](C)NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)cc1 466480773 GBIVELAHTZCDAI-KRWDZBQOSA-N 381.545 5.209 30 20 GKED C[C@H](C#N)CN(C)C(=O)Nc1ccc2nc(-c3cccc(Cl)c3)sc2c1 470593990 CKOJSHAZICOWHU-GFCCVEGCSA-N 384.892 5.240 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1ccc(F)cc1 476503497 IFBROAVVHPOUSR-ZDUSSCGKSA-N 386.496 5.409 30 20 GKED Cc1ccccc1-c1nc(C)c(C(=O)N2CC=C(c3ccc(C#N)cc3)CC2)s1 479995536 OZMPXCGDQKFYOU-UHFFFAOYSA-N 399.519 5.228 30 20 GKED N#Cc1ccccc1OCc1cccc(C(=O)Nc2cncc(Cl)c2Cl)c1 480845538 VYTBBNVSQKQYNM-UHFFFAOYSA-N 398.249 5.091 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccc(OC(F)F)cc2)cc1F 483957641 PRBAXKWEJOOSBH-NRFANRHFSA-N 382.385 5.178 30 20 GKED C[C@@H](NC(=O)CSCc1ccc(F)cc1C#N)c1ccc(Cl)c(Cl)c1 488589055 XPMRLSFRSKGJBM-LLVKDONJSA-N 397.302 5.115 30 20 GKED C=CCN(C(=O)CC1CC(OC(C)(C)C)C1)c1nc(-c2ccccc2)cs1 489546666 YDNLCZYRCBNMCD-UHFFFAOYSA-N 384.545 5.313 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)Nc2cnn([C@@H](C)C3CC3)c2)cc1 491004833 UAXKAJNDMIYCSS-INIZCTEOSA-N 386.455 5.079 30 20 GKED N#CCc1ccc(NC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)cc1 495497017 MAYZQHZYGMWSHW-UHFFFAOYSA-N 388.279 5.435 30 20 GKED CC[C@H](OC1CCCC1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 498073917 PNLTZMOTXLVZSK-QFIPXVFZSA-N 378.472 5.335 30 20 GKED C[C@@H]1CCC[C@H](OCCCCCC(=O)Nc2cc(C#N)ccc2OC(F)F)C1 499369230 NUNGSMZNGYGBEM-WBVHZDCISA-N 394.462 5.254 30 20 GKED Cc1nc(C(=O)N(Cc2ccc(-c3ccccc3F)s2)C(C)C)ccc1C#N 503939583 CTSIFAODTZFTMU-UHFFFAOYSA-N 393.487 5.180 30 20 GKED N#CC1(CCCSCc2ccc(Br)cc2Cl)CCOCC1 507702520 LLFIKKWQWYXJAW-UHFFFAOYSA-N 388.758 5.436 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(N[C@@H](C)c2nc(C(C)C)no2)cc1 507832218 YUJBZAASPCZJOI-AWEZNQCLSA-N 378.432 5.039 30 20 GKED C=CCOc1cccc(NC(=O)N2Cc3ccccc3[C@@H](c3ccccc3)C2)c1 510982916 MLDPTRLUYFDXRT-XMMPIXPASA-N 384.479 5.431 30 20 GKED CC(C)[C@@H](Sc1ccc(C#N)cn1)C(=O)Nc1cc(Cl)ccc1Cl 511850410 UFAYAGOUTAUBBW-MRXNPFEDSA-N 380.300 5.015 30 20 GKED N#CC1(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)CCCCC1 512935890 NKBQSXVTTCQARE-UHFFFAOYSA-N 393.434 5.165 30 20 GKED COC1(c2noc(C3(c4ccc(C#N)cc4)CC3)n2)CCC(c2ccccc2)CC1 514757295 HPCOWOLHTUDOAQ-UHFFFAOYSA-N 399.494 5.221 30 20 GKED CCN(C(=O)CCc1ccc(Cl)cc1Cl)[C@@H](C)c1ccc(C#N)cc1 515130920 AJMIYFGCDLJFOW-AWEZNQCLSA-N 375.299 5.407 30 20 GKED N#Cc1ccccc1N(Cc1ccccc1)C(=O)C1CC(c2cccc(F)c2)C1 515243296 SPHHWDBEWBIUBB-UHFFFAOYSA-N 384.454 5.424 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)c1ccc(-c2ccccc2Cl)o1 518662991 XDGHLNJPGHMWQT-CQSZACIVSA-N 396.899 6.104 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)C1(Sc2ccccc2)CCCC1 521094926 MONSUWIDQFUIHH-UHFFFAOYSA-N 376.525 5.178 30 20 GKED C=CCN(CCc1ccccc1)C(=O)NCc1ccc(-c2csc(C)n2)cc1 523336286 BUVHFRZUHJRCNZ-UHFFFAOYSA-N 391.540 5.059 30 20 GKED O=C(Nc1cc(C(F)(F)F)ccc1F)N[C@H](CC(F)(F)F)c1ccccc1 524440343 ILRWFDPUJOMRME-CQSZACIVSA-N 394.290 5.660 30 20 GKED C=CCC[C@@H](NCc1cnc([C@@H]2CCCO2)s1)c1ccc(C(F)(F)F)cc1 535184962 ITCXOEBZGAPHII-MSOLQXFVSA-N 396.478 5.811 30 20 GKED CC[C@H](CSC)NC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 539303859 DZUOOWHCYLMYBS-CRAIPNDOSA-N 387.936 5.259 30 20 GKED COc1ccccc1[C@@H](NCCCC1(C#N)CCOCC1)c1ccccc1Cl 539711087 AEJNZTVUOPSUDW-QFIPXVFZSA-N 398.934 5.128 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)Cc2cnc3ccc(C#N)cn23)cc1 539836019 UERMRTBASNKMCI-GOSISDBHSA-N 396.494 5.075 30 20 GKED C[C@H](NC(=O)N(C)Cc1cccc(F)c1)c1ccc(-c2cccc(C#N)c2)cc1 541157842 OMNAYDZRLOPONK-KRWDZBQOSA-N 387.458 5.267 30 20 GKED N#Cc1cc(C(=O)N2CCC[C@@H]2c2ccc(Br)s2)ccc1Cl 543346950 JDGDBNPNZSKTIO-CYBMUJFWSA-N 395.709 5.013 30 20 GKED N#Cc1ccc(Oc2cccc(-c3nc(COCc4ccccc4)no3)c2)cc1 545683782 LTROQZIMKPDGJK-UHFFFAOYSA-N 383.407 5.117 30 20 GKED N#CCCN(C(=O)c1cccc(-c2c(F)cccc2F)c1)c1ccc(F)cc1 555771333 UOIZBQHAQMRBGL-UHFFFAOYSA-N 380.369 5.331 30 20 GKED Cc1cccc(Oc2ccccc2NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c1 558826368 XLSMBNKXGQOQBG-UHFFFAOYSA-N 397.356 5.325 30 20 GKED CC[C@H](C)n1ncc(NC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)c1C1CC1 560295020 OUYNGWWIPBQAQL-NBHGPNQESA-N 391.519 5.035 30 20 GKED C=CCN(C(=O)c1ccoc1CCC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 561485458 YYRUWXCVHUFZMP-UHFFFAOYSA-N 397.456 5.097 30 20 GKED C[C@H](CC(=O)N(CCC#N)c1ccc(F)cc1)c1ccc(C(F)(F)F)cc1 561800088 OGPOLSJGDQSVNB-CQSZACIVSA-N 378.369 5.285 30 20 GKED C=CCn1c(-c2ccccc2)nnc1N1CCC[C@@H]1c1nc2ccccc2s1 572446402 SJHXRHIEPLJTEV-GOSISDBHSA-N 387.512 5.082 30 20 GKED N#Cc1cc(Br)ccc1CSCc1cc2ccccc2nc1O 588915106 OWFABPHHWWQCOO-UHFFFAOYSA-N 385.286 5.008 30 20 GKED N#C[C@]1(C(=O)Nc2ccc(O)c(-c3nc4ccccc4s3)c2)CC12CCCC2 590687833 GWFDHURIBVICIC-QFIPXVFZSA-N 389.480 5.081 30 20 GKED N#CC[C@H]1CCCN(C(=O)c2cc(F)ccc2-c2cccc(C(F)(F)F)c2)C1 597914442 SBCPZEULTJCYIZ-CQSZACIVSA-N 390.380 5.277 30 20 GKED C=CCOc1ccccc1CNC(=O)Nc1ccccc1COc1ccccc1 601133941 QWEISSJMXVOBTL-UHFFFAOYSA-N 388.467 5.152 30 20 GKED N#Cc1ccc(Cl)cc1NC(=O)CSCc1ccc(Cl)cc1Cl 603766929 JPWTYDLILQQRQN-UHFFFAOYSA-N 385.703 5.390 30 20 GKED CSCc1c(C(=O)Nc2cccc(OCCCC#N)c2)oc2ccccc12 603969739 ZVKYXQPSJAVZLP-UHFFFAOYSA-N 380.469 5.231 30 20 GKED CCC(C)(C)NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 604046412 GJAMAFDCUMDWTD-AWEZNQCLSA-N 385.895 5.109 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(OC(F)F)c(Cl)c1 608914963 AJLARZMVXWGQTL-UHFFFAOYSA-N 393.821 5.256 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC(C)(C)c1ccccc1F 609434693 JMFKVJBMIQFPOV-HNNXBMFYSA-N 385.508 5.319 30 20 GKED C[C@H]1[C@@H](c2ccccc2)C[C@@H](C)N1C(=O)c1ccc(Oc2ccc(C#N)cn2)cc1 610187191 YQWVONHWNCKGOO-STSQHVNTSA-N 397.478 5.152 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 610226965 XWIBZOFQNIHWFR-WOJBJXKFSA-N 387.310 5.406 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1cccc(C#N)c1 610324210 SYPSXRXEJHFSFD-INIZCTEOSA-N 382.423 5.105 30 20 GKED C[C@H](NC(=O)Nc1ccccc1O[C@@H](C)c1ccccc1)c1cccc(C#N)c1 610325064 MADWSNWXDJSYPI-ROUUACIJSA-N 385.467 5.581 30 20 GKED C[C@@H](NCc1cnc(-c2ccc(Br)cc2)s1)c1cccc(C#N)c1 611038890 CHXWZIKLDLYWJG-CYBMUJFWSA-N 398.329 5.295 30 20 GKED N#C[C@@H](C(=O)c1ccc2c3c(cccc13)CC2)c1nc2cc(Cl)ccc2s1 613407052 FWTXRORNKCMCQG-KRWDZBQOSA-N 388.879 5.692 30 20 GKED O=C(CCCF)N[C@@H](c1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F 613419056 JBOFTHSYCBWMLA-NSHDSACASA-N 399.228 5.194 30 20 GKED C=CCn1c(S[C@H](C)c2ccc(Cl)c(Cl)c2)nnc1-c1ccncc1 615346721 YUAXCOFZWYTATG-GFCCVEGCSA-N 391.327 5.686 30 20 GKED CC(F)(F)CCCNC(=O)c1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1 615457778 MCMGMVGGPWUDFJ-UHFFFAOYSA-N 395.265 5.141 30 20 GKED FC(F)Oc1cccc(Cl)c1CN1C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C1 678299111 VAMCJZKNOODHRC-IUCAKERBSA-N 397.693 5.114 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(C)n(CC(F)(F)F)c1C 682821359 BFQYYNNPCXNVLM-UHFFFAOYSA-N 378.438 5.771 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C/c3ccc(O)c(Cl)c3)s2)cc1 727975983 ZOHYVEDZQHVJGX-ONNFQVAWSA-N 385.872 5.382 30 20 GKED Cc1ccccc1CCC(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 729069102 CRXYESXKPHOAHE-OAHLLOKOSA-N 388.414 5.433 30 20 GKED CC[C@H](NC(=O)Nc1ccccc1SC[C@@H](C)C#N)c1ccccc1OC 731113984 BCXWEKNXFRENIC-RDJZCZTQSA-N 383.517 5.220 30 20 GKED CC(C)[C@H](NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccn1 736512175 KJYKTVRVCWPOEY-QFIPXVFZSA-N 389.430 5.012 30 20 GKED N#C[C@H](C(=O)CC/C=C\c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 739156154 LHICBJDRBKQLMK-LKJUBWIJSA-N 392.911 6.133 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156228 LRODLDQOSZKATB-CRAIPNDOSA-N 395.453 5.925 30 20 GKED O=C(/C=C/c1cnn(Cc2ccccc2)c1)c1ccc(SCC(F)F)cc1 741848269 XIDGIYXYUBEXNL-IZZDOVSWSA-N 384.451 5.185 30 20 GKED C[C@H](C(=O)OCc1cc(Cl)ccc1OCC#N)c1ccccc1C(F)(F)F 745309398 ONRMDAQUMGZXLB-LBPRGKRZSA-N 397.780 5.108 30 20 GKED COc1cc(/C=C\C(=O)c2ccc(-c3ccncc3)cc2)c(SC)cc1OC 745990554 UDNQOTHJVLELSB-HJWRWDBZSA-N 391.492 5.384 30 20 GKED CC(C)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(C(F)(F)F)cc1 747930115 YAADZTKZIMZGEF-YWZLYKJASA-N 376.422 5.483 30 20 GKED COC1CCC(CC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CC1 758437781 YVMFSZNOGKCWBO-IOYBJCICSA-N 396.918 5.529 30 20 GKED C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)[C@@H](C#N)c1nc2ccccc2s1 760180590 FCBKWBGXPRWUEB-SWLSCSKDSA-N 382.872 5.035 30 20 GKED CC(C)(C)Sc1ccc(-c2noc(CSCc3ccc(C#N)cc3)n2)nc1 762388983 XIOIFEQMOHYRCO-UHFFFAOYSA-N 396.541 5.327 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)Nc1ccc(F)cc1OCC#N 766543305 FOHPFUYNIXQNDA-PKNBQFBNSA-N 379.218 5.077 30 20 GKED C[C@H](OC(=O)c1cc2ccccc2n1CC#N)c1nc(-c2ccccc2)cs1 767979295 GXYNKJHYIQYLML-HNNXBMFYSA-N 387.464 5.206 30 20 GKED Cc1ccccc1[C@H](CC(F)(F)F)NC(=O)Nc1ccccc1O[C@@H](C)C#N 770652851 MDCQKGQVAYBFKH-YOEHRIQHSA-N 391.393 5.101 30 20 GKED COc1ccc(CN[C@@H](C)c2ccc3ccccc3c2OC(F)F)cc1C#N 773072539 ANAZTXLEZUDPGO-AWEZNQCLSA-N 382.410 5.172 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2cc(Cl)c(Cl)cc2O)c1 774246457 ZTROVPWSRPFBEO-OCCSQVGLSA-N 379.287 5.231 30 20 GKED CCc1cccc(CC)c1NC(=O)[C@@H](C#N)C(=O)c1ccc(-c2ccccc2)o1 784831594 MUFWZYHBNLGZRP-IBGZPJMESA-N 386.451 5.033 30 20 GKED COc1ccccc1-c1ncc(/C=C2\CSc3cc(C)c(C)cc3C2=O)cn1 792890261 MYHAWAUZQTWRNZ-LICLKQGHSA-N 388.492 5.141 30 20 GKED CC[C@@H](C)CON=Cc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 793159164 LGYIKYFUMQBNIZ-GFCCVEGCSA-N 399.438 5.243 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3CC[C@@H](C(F)(F)F)C3)n2)cc1 796800978 XMPRTMROYIGHAM-RRFJBIMHSA-N 378.419 5.273 30 20 GKED CCc1cccc(C)c1NN=Cc1csc(N(C(C)=O)c2ccc(C)cc2)n1 799495300 QOKQEFZIIPFBBO-UHFFFAOYSA-N 392.528 5.453 30 20 GKED C#C[C@H](NC(=O)Nc1cnn([C@@H](C)CC)c1C1CC1)c1ccc(Cl)cc1F 806373990 OJPMQSSLKDWBRV-SJCJKPOMSA-N 388.874 5.020 30 20 GKED Cc1ccccc1C1(C(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)CCCC1 810537323 RZKBOGKLHSASDO-INIZCTEOSA-N 393.437 5.428 30 20 GKED CC(C)(C#N)CCCOC(=O)C(C)(C)c1csc(-c2cc(F)ccc2F)n1 811362498 ZMGZXBSQFMLJRW-UHFFFAOYSA-N 392.471 5.239 30 20 GKED C[C@@H](OC(=O)c1c(F)cc(C(F)(F)F)cc1F)c1ccc(C(F)(F)F)cn1 813241880 MVAWZNHPYNNXOV-SSDOTTSWSA-N 399.237 5.315 30 20 GKED CN(CCCc1ccccc1)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915359690 XLQOQODRCLPJQJ-XMMPIXPASA-N 383.495 5.439 30 20 GKED CCc1cccc2c(C=Nn3cnnc3SCc3ccc(Cl)cc3)c[nH]c12 916546299 KNYPXYONFJARAN-UHFFFAOYSA-N 395.919 5.150 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)C(=O)Nc2ccccc2Cl)c(C)n1C1CCCCC1 916912970 UHEDTCPVTAUJOM-GOSISDBHSA-N 397.906 5.225 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@H](C#N)C(=O)c2sc(C(C)C)nc2C)cc1 916951442 YIWXSUNUSIHXJP-SUMWQHHRSA-N 383.517 5.050 30 20 GKED Cn1cc(/C=C\C(=O)c2ccc(-c3ccc(F)cc3)s2)c(-c2ccncc2)n1 920065683 FTFREQPUZFJUAD-DAXSKMNVSA-N 389.455 5.246 30 20 GKED O=C(O)c1ccc(NN=Cc2cccc(OCc3ccccc3Cl)c2)cc1F 1776073592 CJUMUSAMPONDQL-UHFFFAOYSA-N 398.821 5.202 30 20 GKED C[C@@H](Oc1ccc(/C=C/C(=O)c2ccc(-c3cccs3)cc2)cc1)C(=O)O 1776469861 WPTQURNFDHBJSW-MRHLJLSQSA-N 378.449 5.163 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](CC(=O)O)C2CCCC2)cc1 1776786291 MIYRMESKQMIYBJ-NRFANRHFSA-N 375.553 5.407 30 20 GKED COc1ccc2c(c1)C[C@H](C)/C(=C\c1ccc(-c3ccc(C(=O)O)cc3)cc1)C2=O 1777372598 MSSJWZGIFPMPFJ-GCMSVZMUSA-N 398.458 5.519 30 20 GKED O=C(O)c1cccc(-c2ccc(/C=C3\CCc4ccc(Cl)cc4C3=O)s2)c1 1777684291 GOBQWLSWWQOMCM-RVDMUPIBSA-N 394.879 5.979 30 20 GKED N#CCC[C@@H](C#N)CSc1nc2cc(Cl)ccc2n1Cc1ccccc1 7034440 MOOIYTSFCNIGHZ-INIZCTEOSA-N 380.904 5.274 30 20 GKED CCc1cc[n+](/C(C(=O)c2ccccc2)=C(/S)Nc2ccccc2CC)cc1 10174263 BBBGBUOMEZPCBM-UHFFFAOYSA-O 389.544 5.150 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)c1ccc(-c2cnco2)cc1 56470417 STOYXSXNESQEMM-UHFFFAOYSA-N 395.418 5.566 30 20 GKED COc1ccc(S[C@H](C)C(=O)Nc2ccccc2S[C@H](C)CC#N)cc1 66800281 SUTNIMKPKGPVBZ-HUUCEWRRSA-N 386.542 5.209 30 20 GKED N#C[C@H](C(=O)[C@@H](Sc1ccc(F)cc1F)c1ccccc1)c1ccccn1 106353751 LHIUDRKQZBOWQE-KKSFZXQISA-N 380.419 5.070 30 20 GKED N#C[C@H](C(=O)CSc1ccc(F)c(F)c1)c1nc2cc(Cl)ccc2s1 120021031 KCFVMBZDIUVLBC-LLVKDONJSA-N 394.855 5.196 30 20 GKED Cc1nc(NC(=O)Cc2csc3ccc(Cl)cc23)sc1SCC#N 121221081 VUDJHXHQDZSQAH-UHFFFAOYSA-N 393.946 5.117 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)CSc1nccc2ccccc12 121319587 RDIQUUDPEMBXJR-OAHLLOKOSA-N 393.537 5.360 30 20 GKED C=CCn1c(SCCCCC#N)nc2scc(-c3cccs3)c2c1=O 135777134 LKAWPKCPQRLOJW-UHFFFAOYSA-N 387.555 5.158 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)[C@@H](C)c3c(F)cccc3F)n2)cc1 154389203 DLXREJCBGYJOCO-WFASDCNBSA-N 398.434 5.077 30 20 GKED Cc1nc(-c2cccc(C(=O)Nc3ccccc3S[C@H](C)CC#N)c2)cs1 173265723 YNCWBHRIIQBEBI-CQSZACIVSA-N 393.537 5.765 30 20 GKED C[C@@H](CCc1cccc(F)c1)C(=O)[C@@H](C#N)c1nc2ccccc2n1C(F)F 174000829 NQUARCKKDQYMKP-XJKSGUPXSA-N 385.389 5.016 30 20 GKED O=C(/C=C\c1cccc(Oc2ccccc2)c1)c1cccc(N2CCOC2=O)c1 207667608 AXZNBUGSQBWGAL-SEYXRHQNSA-N 385.419 5.332 30 20 GKED C[C@@H](OC(=O)/C=C\c1ccccc1C#N)c1ccccc1NC(=O)c1ccccc1 255616370 FVJAEVQNBRNMAD-WBYGGXTKSA-N 396.446 5.128 30 20 GKED CCCc1ncc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)s1 304026685 MFCSWUUYLCWZEU-UHFFFAOYSA-N 377.469 5.320 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NCc1c(F)ccc(Br)c1F 410325382 XTPSMHRUKCWRRQ-NSHDSACASA-N 397.288 5.734 30 20 GKED CC1(C)CCC[C@H]1N(Cc1ccccc1)Cc1nnc(-c2cccc(C#N)c2)o1 426821278 RLPKYOWQJLMBTO-OAQYLSRUSA-N 386.499 5.189 30 20 GKED C[C@@H](CCCC(F)(F)F)NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1 427956566 HUEGIYKCLUCNAM-AWEZNQCLSA-N 375.394 5.153 30 20 GKED CC(C)(c1ccc(NC(=O)CSc2ccc(C#N)cc2)cc1)C(F)(F)F 428436638 GAOMKKMYENCMIP-UHFFFAOYSA-N 378.419 5.129 30 20 GKED N#CCCC[C@@H](NC(=O)Nc1cc(C(F)F)ccc1Cl)c1ccccc1 433261086 UVGWKJBCFRCMLI-MRXNPFEDSA-N 377.822 5.834 30 20 GKED CCOc1ccc([C@@H]2CCCN2C(=O)Nc2ccc(OC(C)C)c(C#N)c2)cc1 435543254 KBRLKFPXFCJQPO-NRFANRHFSA-N 393.487 5.113 30 20 GKED Oc1cc(F)cc(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436408843 LMNRIKJQFQLWFR-HNNXBMFYSA-N 381.291 5.333 30 20 GKED C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(C(F)(F)F)c(C)c1 438520208 YXDUTEUTLVONGA-UHFFFAOYSA-N 393.365 5.142 30 20 GKED COc1cccc(C(C)(C)CNC(=O)Nc2ccccc2SC[C@@H](C)C#N)c1 442189186 BLQQAIPBAYTXOT-INIZCTEOSA-N 397.544 5.046 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(Cl)cc(F)c1F 442200012 KYEDQRPUKFHDAH-UHFFFAOYSA-N 377.822 5.180 30 20 GKED N#Cc1ccccc1COc1ccc(C(=O)Nc2cc(Cl)c(Cl)cn2)cc1 443961563 QRLIVSJMJBARNZ-UHFFFAOYSA-N 398.249 5.091 30 20 GKED CC[C@@H](CC#N)NC(=O)c1c(Cl)cccc1Oc1ccc(F)c(Cl)c1 444322855 JZNHZSHPFXFTKD-NSHDSACASA-N 381.234 5.347 30 20 GKED C=CC[C@H]1N(C(=O)Nc2ccc(OC3CCOCC3)c(C)c2)CCCC1(C)C 444898729 PGPWFDAMTTUALR-OAQYLSRUSA-N 386.536 5.151 30 20 GKED O=C(c1cc(F)cc(C(F)(F)F)c1)N(Cc1cccs1)CC(F)(F)F 446101784 BYJLJIBEXPNESK-UHFFFAOYSA-N 385.304 5.111 30 20 GKED COc1ccccc1NC(=O)c1ccc(NCC#Cc2cccc(Cl)c2)cc1 448106970 DDMBVFFEUVSQLT-UHFFFAOYSA-N 390.870 5.065 30 20 GKED COc1cccc([C@H]2C[C@H](NC(=O)Nc3ccccc3SC[C@H](C)C#N)C2)c1 454743239 DLKZCQZDOLJKKG-KBAYOESNSA-N 395.528 5.015 30 20 GKED COC[C@H](c1ccc(Cl)cc1)N(C)C(=O)N[C@H](CCCC#N)c1ccccc1 458835762 KHWOYHJYFJRIGS-NHCUHLMSSA-N 399.922 5.104 30 20 GKED N#CCCC[C@H](NC(=O)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1)c1ccccc1 458842359 PHBVKXWDBUTOKN-ZWKOTPCHSA-N 393.453 5.186 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)n2C)c(C(F)(F)F)c1 460074639 KKQYJULRMACYOR-LLVKDONJSA-N 381.423 5.058 30 20 GKED N#Cc1cccnc1Oc1ccccc1NCc1csc(-c2ccsc2)n1 462209168 NZVMNTSXFJKOFN-UHFFFAOYSA-N 390.493 5.543 30 20 GKED C=CCn1c(S[C@H](C)c2ccccc2[N+](=O)[O-])nnc1-c1ccc(F)cc1 463047884 IYLMLSYVJITOFX-CYBMUJFWSA-N 384.436 5.032 30 20 GKED C[C@H](Nc1ccc(C#N)cc1C(F)(F)F)c1nc2ccccc2n1C(F)F 463442165 UEZRPGFUVXKCQL-JTQLQIEISA-N 380.320 5.495 30 20 GKED C=C[C@H](C)NC(=O)c1ccccc1SCc1ccc(Br)cc1 465143817 FJBMOWKPWBPIMB-ZDUSSCGKSA-N 376.319 5.046 30 20 GKED COc1ccccc1-c1ccc([C@@H](C)N(C)C(=O)NCc2ccc(C#N)cc2)cc1 465513958 CSKCPBNWBPYECJ-GOSISDBHSA-N 399.494 5.136 30 20 GKED C[C@@H](NCc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1ccc(C#N)c(F)c1 468028812 JBOJWMQTXNZLNM-CRAIPNDOSA-N 391.515 5.277 30 20 GKED CN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccc2cc[nH]c2c1 473585967 VBRONORPSGXNNE-UHFFFAOYSA-N 385.398 5.248 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)c1cc2cccc(F)c2o1 473920638 DYQQOFYPYQTKSY-HNNXBMFYSA-N 379.435 5.126 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)c1cc(F)c(Cl)cc1Cl 474188328 GYCBDWPLSKAZEK-GXTWGEPZSA-N 379.262 5.397 30 20 GKED CSc1ccc(NC(=O)c2occc2COc2cccc(C#N)c2)cc1Cl 474768986 TWZQAQWQYDYOCE-UHFFFAOYSA-N 398.871 5.358 30 20 GKED Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)C[C@H](CC#N)c1ccccc1 475111567 OTCFJCPUIRMLRP-JXFKEZNVSA-N 389.524 5.383 30 20 GKED N#Cc1ccc(-c2nnc(CSCc3ccc(C(F)(F)F)cc3)o2)cc1 475896536 KNIBUUQAWPQQMM-UHFFFAOYSA-N 375.375 5.060 30 20 GKED N#CCCC[C@@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccccc1 487264518 GJCZBRWUAITWJN-MRXNPFEDSA-N 386.282 5.640 30 20 GKED C=CC[C@@H](C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1)c1ccccc1 488619798 ANGKYPGZGKSGEC-NTKDMRAZSA-N 398.506 5.476 30 20 GKED C=C[C@H]1CCCCN1C(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 488866077 LFRWQCPZSPIRDQ-YOEHRIQHSA-N 390.936 5.184 30 20 GKED COc1cc(NC(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)c(OC)c1 505309313 ARLAWEZZAJTFQN-ZDUSSCGKSA-N 385.489 5.051 30 20 GKED Cc1ccc(C(=O)Nc2sc(C)c(C)c2C#N)cc1NC(=O)c1ccccc1 506560685 GORZHJXBUPHOBO-UHFFFAOYSA-N 389.480 5.050 30 20 GKED C[C@H]1C[C@H](NC2CCC(C#N)(c3ccccc3)CC2)CCN1Cc1ccccc1 507651506 UCBRWMJEZMWOSB-DCJWPQLDSA-N 387.571 5.033 30 20 GKED C=CCC[C@H](NC(=O)N1CCCCC[C@H]1c1c(C)n[nH]c1C)c1ccccc1 510630656 TXZXGUNTQQFTAM-SFTDATJTSA-N 380.536 5.361 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3sc4c(c3C#N)CCCCC4)cs2)o1 512136532 DNNKOOLUIAEKJS-UHFFFAOYSA-N 383.498 5.166 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)N(Cc1ccccc1)C(C)C 513876056 INYKFXLBSQEJMZ-UHFFFAOYSA-N 399.494 6.102 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1cccc([N+](=O)[O-])c1 517711979 RDNYQBFJVYPVGA-UHFFFAOYSA-N 388.383 5.211 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCC[C@H]1c1ccccc1 519062661 VEPOZPSDNZRKLQ-XZOQPEGZSA-N 375.516 5.205 30 20 GKED Cc1nc(-c2ccco2)ccc1C(=O)Nc1sc(-c2ccccc2)cc1C#N 523869766 FBTWYBMDLLZQMD-UHFFFAOYSA-N 385.448 5.503 30 20 GKED N#Cc1cc(NC(=O)c2ncsc2C(F)(F)F)ccc1Oc1ccccc1 525927418 MIFBPOCICIRJGK-UHFFFAOYSA-N 389.358 5.078 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)N2CCC(Oc3ccc(C#N)cc3)CC2)cc1 525944849 VOKVVRRTIVVRKV-LJQANCHMSA-N 390.527 5.245 30 20 GKED C[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1cc2ccccc2s1 527491594 DURQRXQZUGASNP-INIZCTEOSA-N 378.497 5.199 30 20 GKED C[C@H](c1cccc(C#N)c1)N(C)C(=O)Nc1ccc2c(c1)CCC1(CCC1)O2 529169521 GBGDLZXZDOXJOS-MRXNPFEDSA-N 375.472 5.031 30 20 GKED O=C(Nc1ccc(F)cc1C(F)(F)F)c1ccccc1CCC(F)(F)F 535449162 AUILVKRCJLKACJ-UHFFFAOYSA-N 379.275 5.592 30 20 GKED Cn1cc(C(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)c(-c2ccccc2)n1 538997586 KHUFKYMLDFYTDV-UHFFFAOYSA-N 394.434 5.003 30 20 GKED Cc1ccccc1CNc1ccccc1NC(=O)C(C)(C)Oc1ccc(C#N)cc1 541154968 YALPYXKQNNOLFS-UHFFFAOYSA-N 399.494 5.275 30 20 GKED C[C@@H](NC(=O)Nc1cnn(C(C)(C)C)c1)c1ccc(-c2cccc(C#N)c2)cc1 542026456 QBHGPUIMEFJYKX-MRXNPFEDSA-N 387.487 5.059 30 20 GKED N#C[C@H](C(=O)c1ccc(SC2CC2)cc1)c1nc(-c2ccccc2)cs1 543056982 GVBGGYXPHASAQD-GOSISDBHSA-N 376.506 5.555 30 20 GKED C[C@H](NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1ccc(C#N)cc1 552836710 PYXFTKJDLSNWNF-FQEVSTJZSA-N 392.506 5.321 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCC[C@@](C)(c3ccccc3)CC2)cc1 558279638 XHWIZRVRMYRZAX-XMMPIXPASA-N 375.516 5.463 30 20 GKED N#CC1(c2ccccn2)CCN(Cc2ccc(Oc3cccc(F)c3)cc2)CC1 558620881 SWCUYMPFUUWLHV-UHFFFAOYSA-N 387.458 5.070 30 20 GKED Cc1csc(Sc2ccc(NC(=O)c3ccc(F)c(C#N)c3)c(C)c2)n1 560020775 UMXZEFTZYHRITE-UHFFFAOYSA-N 383.473 5.174 30 20 GKED N#CC1(CC[S@@](=O)Cc2nc(-c3ccccc3Cl)cs2)CCCCC1 565587619 FPHBRMJBLQJUFR-RUZDIDTESA-N 392.977 5.576 30 20 GKED O=C(NCc1ccc(F)cc1C(F)(F)F)Nc1ccc(F)cc1C(F)(F)F 590336853 WQBIVYITHIUJGT-UHFFFAOYSA-N 398.253 5.324 30 20 GKED CCOc1ccc(C[C@H](C)C(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 591173686 AZONBEZPWOZQML-SJORKVTESA-N 382.529 5.154 30 20 GKED N#C[C@@H](C(=O)c1ccc2c(c1)Cc1ccccc1-2)c1nc2cc(F)ccc2s1 592974527 SPRAJPRCXWAEKC-IBGZPJMESA-N 384.435 5.497 30 20 GKED C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)N3Cc4ccc(C#N)cc4C3)c2)C1 594070956 KIRUFSIIHLHZEI-HXOBKFHXSA-N 389.499 5.201 30 20 GKED Cc1cc(C(=O)Nc2ccccc2S[C@@H](C)CC#N)c(C)n1[C@H]1CCCOC1 599410095 XICOMFSRYFCRJT-WMZOPIPTSA-N 397.544 5.103 30 20 GKED Cc1cc([C@@H](C)NC(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)c(C)s1 603693572 ZBYFVJNCNQEMRB-CQSZACIVSA-N 392.484 5.307 30 20 GKED N#Cc1ccsc1C(=O)Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 609033263 OTGJGJUWVOHXJA-UHFFFAOYSA-N 389.411 5.352 30 20 GKED CCC[C@@H](NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)c1ccccn1 609208592 WNAVDOXCDZAIIN-JOCHJYFZSA-N 386.455 5.408 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)c3ncoc3-c3ccccc3)cc2)cc1 609558611 QMYYLFLUNZLVLC-UHFFFAOYSA-N 381.391 5.258 30 20 GKED CC(C)N(CCC#N)C(=O)c1ccc(Oc2cccc(Br)c2)cc1 609569492 AUPUIWOGGZEAPA-UHFFFAOYSA-N 387.277 5.006 30 20 GKED Cc1cccc2sc(C(=O)[C@H](C#N)c3nc4ccccc4s3)c(Cl)c12 613289539 CFQQNQHDFJRPJT-NSHDSACASA-N 382.897 5.963 30 20 GKED Fc1ccc2ncnc(N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c2c1 614305692 NFTHZGYMSOHZGL-JZYVYDRUSA-N 381.295 5.090 30 20 GKED N#Cc1ccc(CNC(=O)c2ccccc2SCc2ccco2)cc1Cl 619765571 DDWPOQAPAQBGAJ-UHFFFAOYSA-N 382.872 5.027 30 20 GKED CCN(CCC(F)(F)F)C(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 623059854 UPQNFVLYXJKFCQ-UHFFFAOYSA-N 381.238 5.139 30 20 GKED C=CCN(Cc1cccs1)C(=O)[C@@H](C)Nc1ccc(COC(C)(C)C)cc1 674486713 BPCBCJWSBBAPRU-QGZVFWFLSA-N 386.561 5.078 30 20 GKED O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(Cl)c(F)c1 677956984 PTHPGTXOSZEXLG-IUCAKERBSA-N 391.714 5.118 30 20 GKED Cc1cc(CN2C[C@H](C(F)(F)F)[C@@H](C(F)(F)F)C2)c(OC(F)F)cc1C 678297120 KEIXVNRCRGATHQ-RYUDHWBXSA-N 391.302 5.077 30 20 GKED CC[C@@H](C)Oc1ccccc1/C=C/C(=O)Nc1cccc(OCCCC#N)c1 729827665 RVKXTODXWRDAAH-KAUXGEHWSA-N 378.472 5.198 30 20 GKED COc1cc(C2(C(=O)[C@H](C#N)c3ccc4ccccc4n3)CCCC2)ccc1C 731136520 PIJAZRCZURPVLO-HXUWFJFHSA-N 384.479 5.240 30 20 GKED CCOc1ccc(-c2csc(NC(=O)c3ccccc3SCC#N)n2)cc1 734437377 FFPZGDRWNISNED-UHFFFAOYSA-N 395.509 5.077 30 20 GKED C=CC[C@H](NC(=O)N[C@@H](C)c1ccccc1Oc1ccccc1)c1ccncc1 734665978 VOXLBJWSYKYHSI-AVRDEDQJSA-N 387.483 5.552 30 20 GKED CSc1cccc(NC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)c1 740427576 NABBQLWPKBCKMD-UHFFFAOYSA-N 379.510 5.330 30 20 GKED Cc1nn(Cc2ccc(Cl)cc2)c(C)c1/C=C/C(=O)c1ccc([N+](=O)[O-])cc1 740763961 JUZBUJKCCYZZJI-VAWYXSNFSA-N 395.846 5.006 30 20 GKED C=CC[C@H](NC(=O)c1ccc(-c2cc(F)c(F)c(F)c2)cc1)c1ccncc1 742075618 FREFFDQMXPOZOZ-FQEVSTJZSA-N 382.385 5.213 30 20 GKED COc1cccc(-c2nc(/C=C3/C(=O)c4ccsc4S[C@H]3C)cs2)c1 742435782 AIRBIJQNZUZARG-UJFYRASASA-N 385.535 5.641 30 20 GKED N#Cc1ccc2c(c1)CC/C(=C\c1csc(-c3ccc(Cl)cc3)n1)C2=O 742437221 KFGUNFSANIZKOB-MHWRWJLKSA-N 376.868 5.548 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1csc(-c2ccc(O)cc2)n1 746237409 DQAUJVZDYUIUGD-ZDUSSCGKSA-N 395.509 5.020 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)N2CC[C@@H](c3ccccc3)C2)cc1 746763297 ASBWERHTHOTYSN-VWNXMTODSA-N 381.479 5.363 30 20 GKED C=CCc1cc(OCC)cc(CN(C)C[C@@H]2CCCO[C@H]2c2ccccc2)c1O 747806077 PKZMIYBYBNCACT-OFVILXPXSA-N 395.543 5.119 30 20 GKED C=CC[C@H](N[C@H]1CCc2c(Cl)cc(Br)cc21)c1ccncc1 760329599 KXZAUNAMKXKJHT-ROUUACIJSA-N 377.713 5.392 30 20 GKED C[C@@H](NC(=O)/C=C(/c1ccc(Cl)cc1)C(F)(F)F)c1ccc(C#N)cc1 761713486 SKFBTDOPRGYEBD-HJPCULJESA-N 378.781 5.035 30 20 GKED COc1ccc(O)c(C=Nc2ccc(NC(=O)c3cccc(Cl)c3)c(F)c2)c1 766011223 XCXWEBYVJLHJFZ-UHFFFAOYSA-N 398.821 5.196 30 20 GKED C/C(=C\c1c(Cl)cccc1Cl)C(=O)Nc1ncccc1OCCCC#N 766482008 NXCJLKBTRDMDIC-OUKQBFOZSA-N 390.270 5.113 30 20 GKED CN(C)C(=O)Sc1ccc(CSCc2ccccc2C(C)(C)C#N)cc1 767828516 PKOGYSIHGCYWRX-UHFFFAOYSA-N 384.570 5.695 30 20 GKED CC[C@H](C#N)Oc1cccc(CN[C@@H](C)c2ccc(N3CCCCC3)c(F)c2)c1 772983856 MNSVOVJPTOCVOM-GHTZIAJQSA-N 395.522 5.348 30 20 GKED Cc1nc(COC(=O)c2ccc(C#N)c(Cl)c2)oc1-c1ccc(Cl)cc1 778548572 WHDXDOULBONLKE-UHFFFAOYSA-N 387.222 5.186 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)c1ccccc1 793390283 NQFQIRQWARKFHB-XLIONFOSSA-N 386.417 5.456 30 20 GKED COc1cccc(C2(C(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)c1 795204269 IJORWIGHXKFQRV-HSZRJFAPSA-N 382.463 5.021 30 20 GKED C[C@H](OC(=O)C[C@@H](CC#N)c1ccccc1)c1nc(-c2ccc(Cl)cc2)no1 795984624 UOWZBHXEPYFLHD-WMLDXEAASA-N 395.846 5.082 30 20 GKED CC(C)(C)OC(=O)Nc1cccc(COC(=O)C[C@@H](CC#N)c2ccccc2)c1 795987160 UBJDBUULDZYMBL-LJQANCHMSA-N 394.471 5.164 30 20 GKED Cc1cccc2cc(C(=O)[C@@H](C#N)C(=O)Nc3cccc4ccccc34)sc12 808979094 FBYCAUTTXDQDCY-GOSISDBHSA-N 384.460 5.324 30 20 GKED CC(=NNc1ccc(OC(F)(F)F)cc1)c1nc2ccccc2n1C(F)F 812461373 RLHQYJUZTPJKMB-UHFFFAOYSA-N 384.308 5.166 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccsc1C(F)F 825440374 FIGBPGJTNITTAL-UHFFFAOYSA-N 383.304 5.469 30 20 GKED CCCCCCCC[C@H](C)C(=O)N1CCCC[C@@H]1c1nnc(C2CCC2)o1 854461183 UQECPAZNWBQTFB-PKOBYXMFSA-N 375.557 5.777 30 20 GKED O=C(CCCc1ncc(-c2ccccc2)o1)N(O)Cc1cccc2ccccc12 901370075 QCRYSHYGBGNVMS-UHFFFAOYSA-N 386.451 5.236 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1 915085343 ARVNDCMPGGHQCW-OAQYLSRUSA-N 397.865 5.796 30 20 GKED CC(=O)Nc1ccc(NCc2cccc(OCc3cccc(C#N)c3)c2)cc1C 916841895 DBYDSWLLYPNEOQ-UHFFFAOYSA-N 385.467 5.016 30 20 GKED Cc1csc([C@@H](C#N)C(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)n1 916843697 COUMNJVFLMPKSD-INIZCTEOSA-N 399.422 5.287 30 20 GKED CCCCCOc1ccc(C(=O)[C@@H](C#N)C(=O)c2c(C)[nH]c3ccccc23)cc1 920106525 QXXKJHVHAMMZHC-HXUWFJFHSA-N 388.467 5.251 30 20 GKED CC(=NNc1ccc(Cl)c(C(=O)O)c1)C(c1ccccc1)c1ccccc1 1776033174 HZUSXTARDGXIHA-UHFFFAOYSA-N 378.859 5.658 30 20 GKED COc1cc(C(=O)O)ccc1NN=C(CC1CC1)c1cccc(C(F)(F)F)c1 1776051317 FUOAGANHBAPYLC-UHFFFAOYSA-N 392.377 5.029 30 20 GKED O=C(/C=C\c1c(F)ccc(C(=O)O)c1F)c1ccc(OCc2ccccc2)cc1 1776126975 CRSYZFVRGPCUSV-QBFSEMIESA-N 394.373 5.138 30 20 GKED COc1ccc(C(=O)/C=C/c2ccc(-c3ccc(C(=O)O)cc3)cc2)c(F)c1 1776128389 YVUMEARESZBPAJ-YIXHJXPBSA-N 376.383 5.096 30 20 GKED CC(C)Cc1cccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)c1 1776341494 UGGQRELRWLCXJV-SDNWHVSQSA-N 398.502 6.075 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cc(F)cc(Cl)c1Cl 1776354422 GQYNEJQZOCMPSU-HYXAFXHYSA-N 397.229 5.514 30 20 GKED CCCCCCCCCCCN(C)c1c(C(=O)O)cnc2c(C)c(C)ccc12 1776787845 YJPIBTDKRNFMQF-UHFFFAOYSA-N 384.564 6.517 30 20 GKED CCCCCCCOc1ccc(CN[C@H](CC(=O)O)c2ccsc2)cc1 1776788298 YQLWHJJBYUZYIJ-HXUWFJFHSA-N 375.534 5.403 30 20 GKED CCCCc1ccc(C(=O)/C=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)cc1 1776805913 AHNZIWOFNGPIFS-SFQUDFHCSA-N 398.502 6.219 30 20 GKED Cc1cccc2c(C(=O)/C=C\c3ccc(-c4ccccc4C(=O)O)cc3)coc12 1777449080 OWZYKJBOQLVPBL-KAMYIIQDSA-N 382.415 6.003 30 20 GKED N#Cc1ccc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)cc1 6251370 AAPSHVDNDWJBOF-UHFFFAOYSA-N 375.931 5.481 30 20 GKED N#CCOc1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1 23605677 APXMSEHANDCMOY-PKNBQFBNSA-N 390.420 5.122 30 20 GKED Cc1c(C(=O)Nc2nc(-c3ccc(C#N)cc3)cs2)sc2ccc(F)cc12 64679968 ZVWAXFJIWMAYQU-UHFFFAOYSA-N 393.468 5.596 30 20 GKED C=CCOc1ccc(C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)cc1 65782612 QCOSJSZXRNTQPD-UHFFFAOYSA-N 394.858 5.131 30 20 GKED Cc1cccc(C(C)C)c1NC(=O)[C@H](C)Nc1ccccc1SC[C@H](C)C#N 108408465 ZGPQWKGDYOFPBG-AEFFLSMTSA-N 395.572 5.809 30 20 GKED C=C[C@H](CC(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccccc1 122703879 QYMKYSOWGUQGKJ-LJQANCHMSA-N 391.515 5.393 30 20 GKED COc1cc(CN[C@H](CCC#N)c2ccccc2)ccc1OCc1ccccc1 130407679 KVYHKRUAQVIFGO-HSZRJFAPSA-N 386.495 5.409 30 20 GKED Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)Nc2ccc(F)cc2OCC#N)cc1 135255879 HWHNFAOULOMLEA-IERDGZPVSA-N 381.451 5.042 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](C)c1cccc(OCc2ccccn2)c1)c1ccccc1 156085697 JACJXDWJOGHGBA-PMACEKPBSA-N 386.495 5.198 30 20 GKED N#C[C@H](NC(=O)[C@H]1CCCC[C@@H]1C(F)(F)F)c1cccc(Cl)c1Cl 157955267 ZTLQNKZJJMDIMP-GAFUQQFSSA-N 379.209 5.043 30 20 GKED CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2ccc(SC(C)C)cc2)ccc1OC 180811205 STFQPXVNLWBAKX-XLIONFOSSA-N 398.572 5.727 30 20 GKED CCOc1ccc([C@H](N[C@H](C)c2ccc(OCC#N)cc2)c2ccccc2)cc1 181599776 MAKAPJFGSKICOF-KBMIEXCESA-N 386.495 5.428 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H](C)c1cn(C)c2ccccc12 185727802 NSMYLBFZFSCCKB-HZPDHXFCSA-N 377.513 5.315 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@@H](c2cccc(OC)c2)C1 191433068 YUPWXXYNYRJQFE-JOCHJYFZSA-N 394.515 5.153 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cccc(Br)c1F 192294236 JUXZIHIDWKHXAJ-LLVKDONJSA-N 393.281 5.235 30 20 GKED CC(C)[C@H](NC(=O)CSc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 303204877 PJRYJHJBIGIBKV-IBGZPJMESA-N 392.446 5.183 30 20 GKED Cc1cc(Br)c(C(=O)Nc2sc(C(C)(C)C)cc2C#N)s1 411007817 PSMIOEAXZHUZKK-UHFFFAOYSA-N 383.336 5.302 30 20 GKED COc1cc([C@@H](C)NCc2cccc(F)c2C#N)ccc1OCc1ccccc1 428315787 DXFGXGRAOAPBLQ-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2C[C@H]3CCCC[C@@H]3C2)cc1F 428880854 MFRLPGXPBYPZSU-IAGOWNOFSA-N 379.435 5.144 30 20 GKED Cc1nc(CC(=O)N(Cc2ccccc2)c2cc(Cl)ccc2C#N)c(C)s1 429203664 WOFTZFIAIXCAFF-UHFFFAOYSA-N 395.915 5.061 30 20 GKED C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)Nc1ccc(C#N)cc1Cl 430365168 DDTFLJQCTHETLR-AWEZNQCLSA-N 391.858 5.008 30 20 GKED C[C@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1cccc(C#N)c1 442909644 WBLYKZGTJQQYOO-VIFPVBQESA-N 382.798 5.126 30 20 GKED C=CCC[C@H](NC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1)c1ccccc1 455669147 XOBUQXPDQMRWQZ-QFIPXVFZSA-N 377.488 5.031 30 20 GKED N#C[C@@H]1CCC[C@@H](NCc2ccc(Oc3ccccc3C(F)(F)F)nc2)C1 463296718 FYZGZMNYNDFWCG-GDBMZVCRSA-N 375.394 5.065 30 20 GKED C[C@@H](NC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1)c1ccc(C#N)cc1 467923128 PHALPCYNKJRNKI-MRXNPFEDSA-N 396.450 5.173 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cc(-c2ccccc2)ns1 475816588 YAHAXYBEKPWMHD-UHFFFAOYSA-N 376.485 5.126 30 20 GKED CSc1ccc(NC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)cc1Cl 475973294 AMUOWFBYIFXABJ-AEFFLSMTSA-N 385.920 5.366 30 20 GKED C=CC[C@@H](C)NC(=O)C12C[C@@H]3C[C@H](C1)CC(C(F)(F)[C@@H](F)C(F)(F)F)(C3)C2 477451294 IZWSTPDPMOEHIX-JSZOFEHESA-N 397.403 5.190 30 20 GKED C=C(C)[C@H](N[C@@H](C)c1ccc(-n2cncn2)cc1Cl)c1ccc(F)c(F)c1 480696298 VBXMVINAAHMTHJ-RBZFPXEDSA-N 388.849 5.167 30 20 GKED CC[C@@](C)(NC(=O)c1ccc(Sc2ccccc2C#N)cc1)c1nccs1 480842006 JPBIAQGDLNIDFF-OAQYLSRUSA-N 393.537 5.221 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cnn([C@H](C)CC)c1C1CC1 480932803 WFBNLBUARXIGJI-CYBMUJFWSA-N 392.956 5.667 30 20 GKED N#Cc1c(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)sc2c1CCCC2 482162961 JDWWZJVPPVWCNE-OAHLLOKOSA-N 378.419 5.173 30 20 GKED Cc1cc(Cl)cnc1NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1 485096797 PSCWSFPKDLWINX-UHFFFAOYSA-N 377.831 5.154 30 20 GKED C=CCSc1ccccc1C(=O)N[C@H](C)c1ccc(SCCOC)cc1 486223416 JCAIQITXXZMQAO-MRXNPFEDSA-N 387.570 5.194 30 20 GKED C[C@H](CC(=O)N[C@@H](C#N)c1ccc(Cl)c(Cl)c1)c1c[nH]c2ccccc12 486429677 GEDGBOKWPAWDAG-BLVKFPJESA-N 386.282 5.349 30 20 GKED N#CCCC[C@H](NC(=O)COc1ccc2oc3ccccc3c2c1)c1ccccc1 487515129 OBYDJFYZHCAFPH-QFIPXVFZSA-N 398.462 5.516 30 20 GKED C=C[C@H]1CCCCN1Cc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 489442196 SKCYKBNKIRBZTG-FQEVSTJZSA-N 383.561 5.293 30 20 GKED C=C(C)CN(CC)C(=O)[C@@H](C)SCc1coc(-c2ccc(Cl)cc2)n1 497846600 MGGXLMHPIIGNMK-CQSZACIVSA-N 378.925 5.041 30 20 GKED C[C@H](CCCC(F)(F)F)NC(=O)Nc1ccc(OCC(F)(F)F)c(F)c1 504950507 STOUCMXFQNWCQD-SECBINFHSA-N 390.299 5.009 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@H]3/C=C/c3ccccc3)cc2)nc1 505359514 KVNUYRNFDLYHOO-UBQCRTFRSA-N 395.462 5.064 30 20 GKED Cc1oc(C(C)C)cc1C(=O)Nc1cccc(C(=O)Nc2cccc(C#N)c2)c1 507189355 AJTKXTNFGUWKKW-UHFFFAOYSA-N 387.439 5.088 30 20 GKED C=CCN(CCc1ccccc1)C(=O)c1ccc(Oc2ccncc2)c(Cl)c1 510817459 WFGDSSSNWFUTDB-UHFFFAOYSA-N 392.886 5.398 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NS(=O)(=O)c1ccccc1Cl 511734677 OLASKOPXFCOBBL-UHFFFAOYSA-N 398.871 5.113 30 20 GKED CCCc1nc(C)c(C(=O)Nc2sc3c(c2C#N)-c2ccccc2CC3)s1 515625055 MVLMMAXWUABWEI-UHFFFAOYSA-N 393.537 5.355 30 20 GKED C=CCOc1cccc(N[C@H](C(=O)Nc2ccc(OC)cc2)c2ccccc2)c1 518248082 DBTMOZFVMUEGRW-QHCPKHFHSA-N 388.467 5.052 30 20 GKED N#Cc1ccc(-c2csc(NC(=O)c3cccc(OC4CCCC4)c3)n2)cc1 518686817 ICVPFYJEYCRXFY-UHFFFAOYSA-N 389.480 5.255 30 20 GKED Cc1ccccc1[C@H]1CCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)C1 521257969 ODZJBKXANIFWSI-AEFFLSMTSA-N 379.529 5.268 30 20 GKED Cc1nc(-c2ccc(Cl)cc2)sc1[C@@H](C)NC(=O)c1cccc(CC#N)c1 521631840 WIZRTQPXGLEUFZ-CYBMUJFWSA-N 395.915 5.329 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc3ncccc3c2)cc1Cl 523318072 NTEUKDKJYFFQNC-NRFANRHFSA-N 397.865 5.796 30 20 GKED N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2nc(C3CC3)cs2)c1 523877296 RDIZDQGOLLCCBQ-UHFFFAOYSA-N 395.871 5.590 30 20 GKED C=CCCCCCN(C)C(=O)Nc1cc(Cl)ccc1OC[C@H]1CCCO1 524831982 LTCAZXXJEHYQGA-QGZVFWFLSA-N 380.916 5.108 30 20 GKED N#CCC[C@H](NC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1)c1ccccc1 532654723 XPWNIESJFQRKBH-FPOVZHCZSA-N 393.487 5.321 30 20 GKED CC(C)C[C@](C)(C#N)NC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 533876289 MSCOGQXEXSJPEK-LJQANCHMSA-N 394.302 5.026 30 20 GKED Cc1cc(C)n(-c2ccc(CN[C@H](C)c3cccc(C#N)c3)c(C(F)(F)F)c2)n1 539498954 YOEGWIUFZHBANY-MRXNPFEDSA-N 398.432 5.230 30 20 GKED C[C@@](NC(=O)c1ccc(F)cc1C(F)(F)F)(c1ccc(F)cc1)C(F)(F)F 542868963 VPUMLMWDFTZNMD-OAHLLOKOSA-N 397.265 5.191 30 20 GKED N#CCc1ccnc(NCc2ccc(-c3ccccc3Br)cc2)c1 548935170 FXRXTYANTYZVAS-UHFFFAOYSA-N 378.273 5.189 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cnc2c(F)ccc(F)c2c1 550519376 NOVSCYKOYOSOJM-GFCCVEGCSA-N 383.423 5.160 30 20 GKED COc1cc(NC(=O)c2ccccc2-c2ccccc2C#N)cc2cccnc12 557466213 NTJCEMZEJNMIQF-UHFFFAOYSA-N 379.419 5.034 30 20 GKED Cc1cccc2c(Cc3noc(-c4cn(CCCC#N)c5ccccc45)n3)c[nH]c12 558323457 MMEKAZLNHKPMRX-UHFFFAOYSA-N 395.466 5.376 30 20 GKED N#Cc1cccc(C2(NCc3coc(-c4ccc(C(F)(F)F)cc4)n3)CC2)c1 560168809 VELLLKMAWYSFLR-UHFFFAOYSA-N 383.373 5.011 30 20 GKED CCc1ccc([C@@H](C#N)NC(=O)c2ccc(Oc3ccncc3)c(Cl)c2)cc1 572076996 PODKZQALQQHYJL-HXUWFJFHSA-N 391.858 5.084 30 20 GKED Cc1cc(Cl)c2c(c1)c(=O)c(C#N)cn2Cc1csc(-c2ccsc2)n1 573626976 HRKQWZKETMZXPJ-UHFFFAOYSA-N 397.912 5.068 30 20 GKED C[C@H](Nc1ccc(Oc2ccnc(C#N)c2)cc1)c1nccn1-c1ccccc1 579418999 ZOFVQWQCMYOWEM-KRWDZBQOSA-N 381.439 5.104 30 20 GKED COc1ccc(C[C@H](N[C@@H]2CCc3ccc(C#N)cc32)c2ccc(OC)cc2)cc1 581303429 ZLQTWSRVNJIIMJ-FTJBHMTQSA-N 398.506 5.136 30 20 GKED N#Cc1ccc(N2CCC(N[C@H]3C[C@H](c4cccc(C(F)(F)F)c4)C3)CC2)cc1 583768857 BUSBEHBSSRMSKA-XGAFWQRZSA-N 399.460 5.082 30 20 GKED C=C(C)CN(CC)C(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1 588765920 CLUKJNUWWHZCEO-UHFFFAOYSA-N 383.439 5.183 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N[C@@H](C)c1ccc2c(c1)CCCO2 596736161 UIMHOWDGAXVVHH-HOTGVXAUSA-N 395.528 5.289 30 20 GKED C[C@@H](Nc1ccc(NC(=O)CC2(C#N)CCOCC2)cc1Cl)c1ccccc1 597132397 QASZDBDGQZBUBP-MRXNPFEDSA-N 397.906 5.162 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]21 599390119 FLUOAFKUYUBFNS-ALIQFICWSA-N 382.916 5.116 30 20 GKED CCC[C@@H](C(=O)Nc1ncc(Cc2ccc(C#N)cc2)s1)c1ccccc1 602229713 ROIQUUCNZKTXCV-HXUWFJFHSA-N 375.497 5.128 30 20 GKED Cc1ccc(CCCC(=O)Nc2ccc(Oc3ncccc3C#N)cc2C)cc1 603756075 IRAVZYCNBGCNEE-UHFFFAOYSA-N 385.467 5.324 30 20 GKED C=CCCCN(C)C(=O)Nc1cc(-c2nc3cc(F)ccc3n2C)ccc1C 607403712 HZKIWPAKGCUOFE-UHFFFAOYSA-N 380.467 5.118 30 20 GKED CC(C)(C)c1ccc(CCCCC(=O)N(CCC#N)Cc2cccnc2)cc1 608878244 FIDBLSMJRLCSLZ-UHFFFAOYSA-N 377.532 5.034 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3cc4c(F)cccc4[nH]3)cc2)c1 609073357 CYTXBFPPHKHJMO-UHFFFAOYSA-N 385.398 5.010 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)N(CCC(C)C)C1CC1 609078862 RDLWLCWOEXOSOF-UHFFFAOYSA-N 391.515 5.488 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N(C)Cc1ccc(Cl)s1 609399455 YYURITJSDHQCDL-GFCCVEGCSA-N 379.938 5.317 30 20 GKED Cc1ccc(F)cc1NC(=O)[C@H](C)Nc1ccc(Oc2cccc(C#N)c2)cc1 609432434 OFXPABDKJKJOPH-INIZCTEOSA-N 389.430 5.237 30 20 GKED N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)N2CCC[C@H]2C2CCC2)c1 609731430 PIUDBMAYCACOJJ-FQEVSTJZSA-N 380.875 5.409 30 20 GKED CCN(CC[S@@](=O)c1cc(Cl)ccc1Cl)[C@@H](C)c1ccc(C#N)cc1 609798394 ZNOPBUSZSUKIPN-HWRSSNJWSA-N 395.355 5.056 30 20 GKED COCc1c(C(=O)[C@H](C#N)c2nc3cc(Cl)ccc3s2)oc2ccccc12 613407477 URLKWDBLZFABTL-ZDUSSCGKSA-N 396.855 5.332 30 20 GKED O=C(NC(CCC(F)(F)F)CCC(F)(F)F)C1(c2ccccc2F)CC1 619125791 WDUXDADDSVLERT-UHFFFAOYSA-N 385.323 5.027 30 20 GKED FC(F)(F)C(F)(c1ccc(N[C@H]2CCN3CCC[C@@H]3C2)cc1)C(F)(F)F 647229885 XFRBFFAVEFJXCM-UONOGXRCSA-N 384.339 5.015 30 20 GKED Cc1nc(-c2ccc(F)cc2)sc1C(=O)[C@@H](C#N)c1nc(C2CC2)cs1 647374245 YXBFQGCANZKVMD-CQSZACIVSA-N 383.473 5.082 30 20 GKED C[C@@H](C(=O)Nc1ccc(C(F)(C(F)(F)F)C(F)(F)F)cc1)C(F)(F)F 648494378 MPCUJJGTCKFNKL-LURJTMIESA-N 385.201 5.113 30 20 GKED O=C(N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)C1(C(F)(F)F)CCCCC1 667004167 KXPXWTVAYILUNU-UWVGGRQHSA-N 399.297 5.089 30 20 GKED COc1ccc2c(c1F)CC[C@@H]2N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 675638005 DAUHULBNTPGNOL-OXIWPEFWSA-N 399.350 5.321 30 20 GKED N#Cc1ccc(NC(=S)Nc2ccccc2COc2ccccc2)cc1Cl 726472444 OVNICHOQUAURRW-UHFFFAOYSA-N 393.899 5.600 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/CCc3sccc3C2=O)cs1 726891331 ISTRGDRRWBFVMJ-PTNGSMBKSA-N 394.521 5.410 30 20 GKED N#CCOc1cccc(/C=C\C(=O)c2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 730152066 ZHULXFCGRYGFTK-HJWRWDBZSA-N 390.420 5.122 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)cc1 739180023 GWFPOPKBRWZCDT-KDOFPFPSSA-N 380.488 5.929 30 20 GKED N#Cc1cccc(N(Cc2ccc(Cl)cc2)C(=O)c2ccc(Cl)nc2)c1 741969971 RXHIKXGFCMAOPN-UHFFFAOYSA-N 382.250 5.107 30 20 GKED C#Cc1cccc(N(Cc2cccs2)C(=O)c2cnc([C@@H](C)OCC)s2)c1 742660041 SXFNUQUEABNXIX-OAHLLOKOSA-N 396.537 5.130 30 20 GKED CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H]2c2cccc(C)c2C)c1 743612918 YZPQCAXICPLJEX-REWPJTCUSA-N 391.515 5.031 30 20 GKED CC(=NN=Cc1cccc(Oc2cccc(C(F)(F)F)c2)c1)c1cnccn1 745201956 OXDCPPAZBLACRD-UHFFFAOYSA-N 384.361 5.131 30 20 GKED N#CCC[C@@H](NC(=O)Nc1cccc(COc2ccccc2)c1)c1ccccc1 748570812 WXWGBFHOXYTXJV-HSZRJFAPSA-N 385.467 5.432 30 20 GKED CC(C)c1ccc(-c2nc(CC(=O)N(C)c3ccc(C#N)cc3)cs2)cc1 749149548 CLHPWNGNPQVPGI-UHFFFAOYSA-N 375.497 5.011 30 20 GKED CCCC[C@H](ON=C(C)C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 757854246 GKQCLQRZMODMTI-VXKWHMMOSA-N 377.488 5.252 30 20 GKED C=CC[C@H](NC(=O)N1CCc2cc(Cl)c(Cl)cc2[C@@H]1C)c1ccncc1 759580887 IXYNIQZBMIABHU-DJJJIMSYSA-N 390.314 5.335 30 20 GKED C=C(Cl)COc1ccc([C@H](C)N[C@H](C)c2cc(OC)c(OC)cc2F)cc1 766000655 FOFQDWSVFLXAHR-LSDHHAIUSA-N 393.886 5.386 30 20 GKED C[C@@H]1CCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)[C@H](c2ccco2)C1 775487087 HSTJMLFBKCHOKU-YSZBQJHXSA-N 399.494 5.940 30 20 GKED C[C@H](CCN[C@H](C)c1ccc(OCC#N)cc1)c1cccc(C(F)(F)F)c1 776163211 QIEZEJAAMARHOH-HZPDHXFCSA-N 376.422 5.452 30 20 GKED C#CCCCCC(=O)N(c1nc2ccccc2s1)c1ccccc1C(C)C 776307299 XNIIDCSGNZZXEI-UHFFFAOYSA-N 376.525 6.278 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC1CCC(O)(c2ccccc2)CC1 789457689 JYIBAQDOYXAUCW-UHFFFAOYSA-N 392.543 5.490 30 20 GKED CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)[C@H](C#N)c1nccc2ccccc12 792100011 CLOGUBMCINGJEK-KNQAVFIVSA-N 378.859 5.168 30 20 GKED C[C@H](CSCC(=O)[C@H](C#N)c1nc(-c2ccccc2)cs1)c1ccccc1 794441367 OTLZJYPCGIRMAS-APWZRJJASA-N 392.549 5.523 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](c2cccc(OC(F)(F)F)c2)C2CC2)cc1 796469115 FLJUMWNHVQKBME-XOBRGWDASA-N 390.405 5.117 30 20 GKED N#Cc1cc(-c2ccccc2)sc1NC(=O)c1cc(C2CC2)cnc1Cl 796592042 OQLQPJFPPHNBMT-UHFFFAOYSA-N 379.872 5.465 30 20 GKED CC[C@H](C)c1ccc(NC(=O)[C@@H](C#N)C(=O)c2ccc3nccc(C)c3c2)cc1 796791195 DAJOOBPAEOARGN-BTYIYWSLSA-N 385.467 5.018 30 20 GKED C[C@H](OC(=O)CCCCCC#N)c1nnc(-c2ccc(Cl)cc2Cl)o1 805696551 DSJQPVVWORMETD-NSHDSACASA-N 382.247 5.122 30 20 GKED CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)CC[C@H]2c2ccccc2)c1 806806239 AGKBBLJJQNNTIK-AAIMPIBUSA-N 391.515 5.050 30 20 GKED Cc1c(C(=O)N2CC=C(c3ccc(Cl)nc3)CC2)sc2ccc(C#N)cc12 815939335 IQYDBPPXABIGDX-UHFFFAOYSA-N 393.899 5.059 30 20 GKED Cc1cc(C)c(C(=O)CCCC(=O)[C@H](C#N)c2nc(C3CC3)cs2)c(C)c1 842942701 QITVVDOMTOUFDN-KRWDZBQOSA-N 380.513 5.175 30 20 GKED Cc1ccc([C@@H]2C[C@H]2C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)cc1C 850790422 LOIJQDMWJKQNLD-PWRODBHTSA-N 397.503 5.279 30 20 GKED Cc1nc(SCC(C)C)sc1CC(=O)[C@H](C#N)c1nccc2ccccc12 850987229 XHZBJBQHVLJAIE-KRWDZBQOSA-N 395.553 5.167 30 20 GKED O=C(O[C@H](c1ccccn1)C(F)(F)F)c1ccc(C(F)(F)C(F)(F)F)cc1 857599825 GZUFZAGAUYDLNY-GFCCVEGCSA-N 399.237 5.196 30 20 GKED C=CCNC(=O)Nc1ccc(NCc2cc(Cl)cc(Br)c2)cc1 864034363 GPYUBRFILJBRQS-UHFFFAOYSA-N 394.700 5.022 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)CCc2c[nH]c3ccccc23)cc1 915086548 LOYDQZWPWBUFMB-HSZRJFAPSA-N 379.463 5.395 30 20 GKED CC(=O)N(c1ccc(C)cc1)c1nc(C=NNc2ccc(Cl)cc2)cs1 917530696 WEVAKKGJRLLRQF-UHFFFAOYSA-N 384.892 5.236 30 20 GKED Cc1ccc(COc2ccc(C=NNc3ccc(Cl)c(C(=O)O)c3)cc2)cc1 1776033362 QXGBAMGKJPUFQU-UHFFFAOYSA-N 394.858 5.372 30 20 GKED CCC(=NNc1cccc(C(=O)O)c1)[C@@H](C)c1cccc(Br)c1 1776038376 HPHNRDDQHBRVEF-LBPRGKRZSA-N 375.266 5.129 30 20 GKED CC(=NNc1ccc(F)c(C(=O)O)c1)c1ccc(O[C@@H](C)c2ccccc2)cc1 1776063949 QVZAODUQWLDMMQ-INIZCTEOSA-N 392.430 5.500 30 20 GKED CC(C)Oc1ccc(/C=C\C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)cc1 1776356054 ZECNNBYSBYWDGC-XGICHPGQSA-N 376.408 5.328 30 20 GKED CC(C)c1ccc2c(c1)C(=O)/C(=C\c1c(F)ccc3sc(C(=O)O)cc13)CC2 1776374708 UXBSCBGSRTXTEB-GDNBJRDFSA-N 394.467 6.075 30 20 GKED C[C@H](Oc1ccc(C(=O)/C=C\c2cccc(CC(=O)O)c2)cc1)c1ccccc1 1776469376 BOUDTSKPPZPORK-BXBOZWQASA-N 386.447 5.350 30 20 GKED CCCCCCCOc1ccc(CNC[C@H](CC(=O)O)Cc2ccccc2)cc1 1776786225 CIIMOPJBLXMLMU-QHCPKHFHSA-N 397.559 5.459 30 20 GKED Cc1cccc2c1C(=O)/C(=C/c1cccc(OCc3cccc(C(=O)O)c3)c1)C2 1777455716 POLSDJOECVQERG-SRZZPIQSSA-N 384.431 5.095 30 20 GKED N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc(OCC(F)(F)F)cc1 14708812 WJPMBFBDNYMRJQ-UHFFFAOYSA-N 396.368 5.419 30 20 GKED C=CCNC(=O)Nc1ccc(NC(=O)c2cc3ccc(C(C)(C)C)cc3[nH]2)cc1 29070279 YHYOTMMRAPQKIK-UHFFFAOYSA-N 390.487 5.025 30 20 GKED Cc1ccc(C)c(C(=O)c2ccccc2C(=O)[C@@H](C#N)c2nc3ccccc3o2)c1 41542713 RARKNCLXZLZYDH-HXUWFJFHSA-N 394.430 5.166 30 20 GKED C=CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(C2SCCS2)c1 63389991 LZXMFSFWRHPATG-UHFFFAOYSA-N 395.553 5.257 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)c1cc(Br)ccc1F 66800557 MKENGLWDTVKYRT-LLVKDONJSA-N 393.281 5.235 30 20 GKED N#Cc1ccc(N2CCC([C@@H](O)c3ccc(Cl)cc3)CC2)cc1C(F)(F)F 78721874 ATRVEBFUDCKKNN-IBGZPJMESA-N 394.824 5.180 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(-c3ccccc3)o2)nnc1-c1ccco1 118611702 PPFQFSSXUFCKSR-AWEZNQCLSA-N 378.457 5.232 30 20 GKED C[C@@H](Sc1ccccn1)C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1 134978789 WGJMNODIGDFRTK-IUODEOHRSA-N 399.928 5.216 30 20 GKED CCCN(CCC)C(=O)c1cccc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c1 177764648 RRYWIDCUFDKACJ-GOSISDBHSA-N 397.544 5.019 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1 180055293 TVVXONQCKGUBOD-IIBYNOLFSA-N 388.471 5.218 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NCc1cccc(Cn2cccn2)c1 191503606 PRAOHHDUHMUCGZ-UHFFFAOYSA-N 388.515 5.105 30 20 GKED CC1(C)CN(C(=O)Nc2ccc(F)cc2C(F)(F)F)CC[C@H]1C(F)(F)F 192201903 TXMKWMLTGQOZSH-GFCCVEGCSA-N 386.311 5.287 30 20 GKED Cc1ccc(C)c(NC(=O)[C@H](C)Nc2cccc(Oc3ccc(C#N)cc3)c2)c1 303324720 VQEYAMZFZYFMCZ-SFHVURJKSA-N 385.467 5.407 30 20 GKED CC(O)=Nc1cc(N=C(O)Nc2ccc3c(c2)OC2(CCCCC2)O3)ccc1C 329386588 QMLGSKDJFVFNRY-UHFFFAOYSA-N 395.459 5.692 30 20 GKED COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)N(CCC#N)CC1CC1 429057190 XVWANABYSFDLSR-UHFFFAOYSA-N 397.450 5.093 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NC[C@@H]1CCC(F)(F)C1 432073009 VHYMMPPRKCTKLE-GOSISDBHSA-N 399.441 5.003 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CC[C@](C)(c2ccc(F)cc2)C1 432100941 WHPMWPRHTPNOPS-AOMKIAJQSA-N 397.519 5.273 30 20 GKED Cc1nc(-c2cccc(NC(=O)N[C@@H](CCCC#N)c3ccccc3)c2)oc1C 432768234 OBDVPFGVINYGHD-NRFANRHFSA-N 388.471 5.515 30 20 GKED C[C@@H](NC(=O)Nc1ccc(COCc2ccccc2)cc1)c1ccc(C#N)cc1 438371487 MILUGFRVIUIIRP-GOSISDBHSA-N 385.467 5.158 30 20 GKED CCCc1c(NC(=O)Nc2ccc(Cl)cc2F)cnn1-c1cccc(C#N)c1 439234921 JLQXTOZOPITAIP-UHFFFAOYSA-N 397.841 5.133 30 20 GKED C=CC[C@@H](CC)NC(=O)Nc1ccc(Oc2ncc(Cl)cn2)c(Cl)c1 439398874 SFNNJZIEYQFULM-GFCCVEGCSA-N 381.263 5.052 30 20 GKED Cc1ccc(-c2cc(C(F)(F)F)c(C#N)c(SCc3cnoc3C)n2)o1 445597342 PECKOPIKINIFNP-UHFFFAOYSA-N 379.363 5.129 30 20 GKED N#CCc1ccc(NC(=O)N2CCC(Cc3cccc(F)c3)CC2)c(Cl)c1 455700847 JAJMPZUVECCDOW-UHFFFAOYSA-N 385.870 5.032 30 20 GKED C=C(C)Cn1c(-c2ccccc2OC)nnc1N1CCC[C@H]1c1ccc(C)s1 460558017 WNEZPZOQKGOHNI-SFHVURJKSA-N 394.544 5.241 30 20 GKED C[C@H](S[C@H](C)C(=O)Nc1ccccc1C#N)c1ccc(Cl)c(Cl)c1 463207708 BXKHWLDYFOIZJQ-NWDGAFQWSA-N 379.312 5.686 30 20 GKED Cc1cc(F)cc(C(=O)Nc2cc(C(F)(F)F)ccc2SCCC#N)c1 463751707 QVHJHHUTFVAHFR-UHFFFAOYSA-N 382.382 5.411 30 20 GKED CCOc1ccc(N(CCC#N)C(=O)[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1 467249674 GJWPBLGPBLQHQD-HNNXBMFYSA-N 390.405 5.154 30 20 GKED N#Cc1ccc(Oc2ccc(NC(=O)N3CCC4(CCC4)C3)cc2Cl)cc1 467906258 PCWFLOHIQORIGR-UHFFFAOYSA-N 381.863 5.412 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccccc3COc3ccc(CC#N)cc3)cc2o1 470828103 ROMSYOBBMCMXJH-UHFFFAOYSA-N 397.434 5.034 30 20 GKED Cc1ccc(C(F)(F)F)cc1NC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1 473054396 CWMMHAXPGBVDGI-PKOBYXMFSA-N 387.405 5.318 30 20 GKED N#C[C@H](C(=O)c1ncoc1-c1ccc(F)cc1)c1nc2cc(Cl)ccc2s1 473479350 BKUBVXSSEIHNLP-CYBMUJFWSA-N 397.818 5.234 30 20 GKED N#CCc1ccc(NC(=O)NC2(c3cc(C(F)(F)F)ccc3Cl)CC2)cc1 483504625 DEDWSVOBLLTFRF-UHFFFAOYSA-N 393.796 5.236 30 20 GKED CSc1nc(C2CC2)cc(C(=O)Nc2ccc(-c3ccco3)cc2F)c1C#N 487539920 OPJSQMLVVXKKPS-UHFFFAOYSA-N 393.443 5.204 30 20 GKED C[C@@H](Nc1ccc(Oc2cccc(C#N)c2)cc1)c1nc(-c2ccccc2)no1 489709849 DIHMFGRQAHTTHQ-MRXNPFEDSA-N 382.423 5.574 30 20 GKED C=CCNC(=O)Nc1ccc(N[C@@H](C)c2ccc(OC(F)(F)F)cc2)cc1 495592312 NOBOYFDHZTVDKG-ZDUSSCGKSA-N 379.382 5.066 30 20 GKED CC[C@H]1C[C@]1(NCc1ccc(OC)c(OCCCC#N)c1)c1cccc(C)c1 500526690 FNTKTLOMTIXARI-GBXCKJPGSA-N 378.516 5.101 30 20 GKED Cc1cc(F)ccc1N(Cc1cccc(C#N)c1)C(=O)c1cccc2ncccc12 501152645 YQIKUBKBTPUQSD-UHFFFAOYSA-N 395.437 5.401 30 20 GKED C=CCCc1ccccc1NC(=O)N(Cc1ccc(O)cc1)Cc1ccco1 505010707 KSAHNGKSMNQPPV-UHFFFAOYSA-N 376.456 5.338 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1 505062987 WVASBKZBAMIMIR-HXUWFJFHSA-N 380.488 5.191 30 20 GKED Cc1ccc(-c2nc(C)sc2CC(=O)N[C@@H](C#N)c2ccccc2Cl)cc1 505658395 HHLBYQRKGJVYIB-SFHVURJKSA-N 395.915 5.004 30 20 GKED CCN(Cc1ccccc1)C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1 509891080 QNJPUIOKXYAPNW-UHFFFAOYSA-N 399.494 5.386 30 20 GKED C[C@H](N[C@H](C)c1ccc(C#N)cc1F)c1cccc(OCc2ccccn2)c1 512646524 AVWUZJWCXZAOGN-DLBZAZTESA-N 375.447 5.083 30 20 GKED CCC1(C)CCN(C(=O)Nc2cccc(COc3ccc(CC#N)cc3)c2)CC1 517115035 JXLXJGKLATUSSY-UHFFFAOYSA-N 391.515 5.376 30 20 GKED N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@@H]3CC3CCCCC3)cc2)nc1 518399085 RFLYOHQSURJZER-OAQYLSRUSA-N 389.499 5.321 30 20 GKED Cc1ccc(-c2nc(C)c(C(=O)Nc3ccccc3SC[C@H](C)C#N)s2)o1 519427438 GWAFVMACNZOMMZ-GFCCVEGCSA-N 397.525 5.524 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N[C@@H](c1ccccc1)C(C)(C)C 519450822 KIUQYPVVLZRXRA-JXFKEZNVSA-N 381.545 5.847 30 20 GKED Cc1ccc(-c2nc(C(=O)Nc3ccccc3SCCC#N)cs2)cc1 520804435 NKVAIPQONBSUTG-UHFFFAOYSA-N 379.510 5.377 30 20 GKED CC(C)(C)[C@H](NC(=O)CCCCOc1cccc(C#N)c1)c1ccc(F)cc1 521935888 JPEBODYZIWPLAP-JOCHJYFZSA-N 382.479 5.150 30 20 GKED N#Cc1ccccc1COc1cccc(CNc2cccc(OC(F)F)c2)c1 522283562 OWLDHIWQEAYJKI-UHFFFAOYSA-N 380.394 5.351 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)N[C@H](C)c1cc2ccccc2s1 526957529 JGNNYNRJZURNHV-HUUCEWRRSA-N 395.553 6.036 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)[C@@H]1COc2ccccc21 533630721 WPCHFDVWMGPRJM-ZHRRBRCNSA-N 399.450 5.037 30 20 GKED CCN(C(=O)c1ccc(Cl)c(Br)c1)c1ccc(C#N)c(Cl)c1 536973373 CEHAJESMXVEQKN-UHFFFAOYSA-N 398.087 5.294 30 20 GKED N#Cc1c(NC(=O)c2ccc(C(F)(F)F)cc2Cl)sc2c1CCCC2 538193004 OGGKIOVLVVLETE-UHFFFAOYSA-N 384.810 5.423 30 20 GKED C=CCC[C@@H](NCc1cnn(C)c1C(F)(F)F)c1ccc(C(F)(F)F)cc1 539331851 PTWZKSDVIWYAFC-OAHLLOKOSA-N 391.359 5.255 30 20 GKED CC(C)C[C@H]1C[C@H](NC(=O)Nc2ccc(Oc3ccccc3C#N)cc2)CCO1 539716155 KJDBCCLSZNPWIO-CTNGQTDRSA-N 393.487 5.066 30 20 GKED C=C[C@@H](CC(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)c1ccccc1 541241699 GNXAYRHWNBJDIX-SFHVURJKSA-N 395.462 5.721 30 20 GKED COc1ccc([C@@H](C)NCc2ccc(-c3ccccc3C#N)cc2)c(C)c1OC 552276719 HUAGNNSFDRQHKO-GOSISDBHSA-N 386.495 5.402 30 20 GKED C=CCC[C@@H](NCc1cnn(-c2ccc(Br)cc2)c1)c1ccco1 552277508 WNEZQPWZYREHBC-GOSISDBHSA-N 386.293 5.025 30 20 GKED COC(=O)c1csc([C@@H](C)N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)c1 560548796 BUAKOVLLPHBHSH-HZPDHXFCSA-N 390.508 5.485 30 20 GKED CCc1csc(NC(=O)c2ccccc2SCc2ccc(C#N)cc2)n1 573749659 SMATXMNFDOMPGG-UHFFFAOYSA-N 379.510 5.122 30 20 GKED COc1ccc(C(=O)[C@H](C#N)c2nc3cc(F)ccc3s2)c2ccccc12 592975558 IYUZFYZAOGNWJK-INIZCTEOSA-N 376.412 5.087 30 20 GKED COc1ccc2c(c1)[C@H](C(=O)Nc1ccccc1SC[C@H](C)C#N)CCC2 593975091 LYWVJIFQJZTTBT-CRAIPNDOSA-N 380.513 5.006 30 20 GKED N#CC1(c2ccc(CNC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2)CC1 594914759 KRCFLJHZMUNGCW-HUUCEWRRSA-N 390.371 5.241 30 20 GKED CCN(C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)c1ccccc1OC 609297937 OYFWOOUUNVEXCC-UHFFFAOYSA-N 390.414 5.165 30 20 GKED CCN(CC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@H](C)c1ccc(F)cc1 609385334 RWBFNVRWGREODB-DLBZAZTESA-N 399.535 5.242 30 20 GKED N#Cc1ccc(CSCC(=O)Nc2ccc(OC3CCCCC3)cc2)cc1 609695896 NWTXBESXRYCZET-UHFFFAOYSA-N 380.513 5.142 30 20 GKED CCOc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H](C)c1cccc(C#N)c1 610432011 SOYJHWAKEVELAX-UTKZUKDTSA-N 379.504 5.105 30 20 GKED Cc1ccc([C@H]2CCN(C(=O)Nc3ccc(Oc4ccc(C#N)cc4)nc3)C2)cc1 612299033 OVHTWDMIEIRHPN-FQEVSTJZSA-N 398.466 5.075 30 20 GKED N#Cc1cc(Cl)c(C(=O)N[C@H]2CC[C@@H](c3cccc(F)c3)C2)c(Cl)c1 619457099 RCLXZMCWAWETCM-HIFRSBDPSA-N 377.246 5.070 30 20 GKED COc1ccc2c(c1F)CC[C@@H]2NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 675638004 DAUHULBNTPGNOL-BHDSKKPTSA-N 399.350 5.321 30 20 GKED COc1ccc(NC(=S)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1F 726461486 UEHARIWVXMJHFK-LJQANCHMSA-N 391.471 5.299 30 20 GKED CNC(=O)c1ccc(/C=C\C(=O)c2sc(-c3ccc(Cl)cc3)nc2C)cc1 727654105 HMHUEDUABDCOEG-XGICHPGQSA-N 396.899 5.028 30 20 GKED Cc1cccc(COc2ccc(C(=O)/C=C\c3cnc4c(c3)c(C)nn4C)cc2)c1 727654990 QUSNYMIQNDRKOF-GHXNOFRVSA-N 397.478 5.060 30 20 GKED N#CCCSc1ccccc1NC(=O)/C=C\c1cccc(OC2CCCC2)c1 730982176 KIERRPBDDOQMQJ-YPKPFQOOSA-N 392.524 5.666 30 20 GKED C#CCCOc1ccc(CN[C@@H](C)c2ccc(-c3csc(C)n3)cc2)cc1 733322490 JHUYOZYDNQRQEL-KRWDZBQOSA-N 376.525 5.371 30 20 GKED Cc1ccccc1[C@@H](C)CC(=O)[C@H](C#N)C(=O)Nc1cc(Cl)cc(Cl)c1 734966008 SOLKGKPISFGCHE-UGSOOPFHSA-N 389.282 5.143 30 20 GKED N#C[C@H](C(=O)CC/C=C/c1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1 739156157 LHICBJDRBKQLMK-RRGNZLCHSA-N 392.911 6.133 30 20 GKED Cc1ccc(NC(=S)NCc2cccc(-c3ccc(C#N)s3)c2)cc1F 739436415 BTRXOUQZPPXTSU-UHFFFAOYSA-N 381.501 5.221 30 20 GKED C=CCCCCCN(C)Cn1nc(-c2ccc(C)cc2)c2ccccc2c1=O 739887407 PSAKLGRUBLVRJM-UHFFFAOYSA-N 375.516 5.008 30 20 GKED O=C(/C=C/c1csc(-c2ccccn2)n1)c1ccc(SCC(F)F)cc1 741848027 ULIJXCGQKDZXQP-RMKNXTFCSA-N 388.464 5.458 30 20 GKED C/C(=C/C(=O)[C@@H](C#N)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc(F)cc1 743446916 GHXIONWKQHVSQR-ADYSOMBNSA-N 396.874 5.882 30 20 GKED C[C@H](C(=O)[C@H](C#N)c1nc2ccccc2s1)c1ccc(Br)s1 744016614 PFIKBELCXQNBJX-UWVGGRQHSA-N 391.315 5.100 30 20 GKED N#C[C@H](C(=O)[C@@H]1CCSc2ccccc21)c1nc2cc(Cl)ccc2s1 744035814 RYWVHTHVIJONRT-ZIAGYGMSSA-N 384.913 5.406 30 20 GKED CCc1oc2ccccc2c1C=NO[C@@H](C)c1nc(Cc2ccccc2)no1 744446063 ZFANCDCHFWGECA-HNNXBMFYSA-N 375.428 5.081 30 20 GKED N#CCSc1ccccc1C(=O)N1CCC(c2cccc3ccccc23)CC1 746860215 RPFAITRYTFATBZ-UHFFFAOYSA-N 386.520 5.475 30 20 GKED O=[N+]([O-])c1ccccc1-c1ccc(C=NOc2ccccc2C(F)(F)F)o1 754712963 YCMVZISOMNVYGT-UHFFFAOYSA-N 376.290 5.287 30 20 GKED N#Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@@H]3CC[C@@H]4CCCC[C@H]4C3)n2)cc1 756530157 SSUAWSPVNBDBMZ-IJXRJRJASA-N 389.524 5.465 30 20 GKED Cc1cccc2nc([C@H](C#N)C(=O)CCCCCO[C@H]3CCC[C@H](C)C3)[nH]c12 766648045 HNGVBEKMUFPAHC-YTQUADARSA-N 381.520 5.203 30 20 GKED C=CCC[C@@H](NC(=O)N[C@@H](c1ccccc1)C1CCOCC1)c1ccccc1 771992246 VQUGZPKQCHBIPX-PKTZIBPZSA-N 378.516 5.161 30 20 GKED C=C(Cl)COc1ccc([C@@H](C)Nc2ccc(NC(=O)c3ccco3)cc2)cc1 776804315 GWXIRBCKDNCKTB-MRXNPFEDSA-N 396.874 5.836 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCCC[C@H]1/C=C\c1ccccc1 780678901 QOQQWCFFCMPIAO-YOEPJQAMSA-N 389.499 5.467 30 20 GKED CC1(C#N)CCN(C(=O)/C(=C\c2ccc(Cl)cc2)c2ccc(F)cc2)CC1 781027861 ZPZZVEBTEHJCRG-ZHZULCJRSA-N 382.866 5.172 30 20 GKED C[C@]1(C#N)CCCN(C(=O)c2cc(-c3ccccc3Cl)nc3ccccc23)C1 784743289 CMWZYMIILDWREM-HSZRJFAPSA-N 389.886 5.321 30 20 GKED COc1cccc(C(=O)/C(=C/c2c(Cl)oc3ccccc23)c2ncc[nH]2)c1 787167251 BXXFHJBFCXDYKW-ATVHPVEESA-N 378.815 5.241 30 20 GKED N#C[C@H](C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1cnc2ccccc2n1 792099464 BJEFTQMKZUDRKS-FYGXRCCRSA-N 399.450 5.387 30 20 GKED Cc1ccccc1Nc1ccccc1-c1noc(-c2ccccc2OCC#N)n1 809441763 KVPZFRUYWQPQED-UHFFFAOYSA-N 382.423 5.358 30 20 GKED CCOc1cc(C#N)cc(Cl)c1OC(=O)c1nc2ccccc2cc1Cl 812835842 WQMDXKGEZUVXMG-UHFFFAOYSA-N 387.222 5.031 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)cc1 814577799 RZRGQPGULOSGCE-AGILITTLSA-N 399.469 5.549 30 20 GKED N#C[C@@H](C(=O)C1(c2c(F)cccc2F)CCC1)c1nc2cc(F)ccc2s1 817716201 JCTAOXDBKWXQFH-LBPRGKRZSA-N 386.398 5.012 30 20 GKED Cc1cc(C)c(NC(=O)[C@@H](C)ON=Cc2ccccc2C(F)(F)F)c(C)c1 818613405 NPKBHRNFBLBGFP-OAHLLOKOSA-N 378.394 5.008 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2cc3cc(F)ccc3s2)cc1 915086523 KIVNHSJTYWRPBC-HXUWFJFHSA-N 386.451 5.948 30 20 GKED Cc1ccc(C(=O)CCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)cc1 915088009 YOQDJKUIZXHFKT-HSZRJFAPSA-N 382.463 5.252 30 20 GKED N#C[C@@H](C(=O)[C@H]1Cc2ccccc2S1)c1nc(-c2ccc(Cl)cc2)cs1 915102340 XKCSZAVXODVXJR-MAUKXSAKSA-N 396.924 5.357 30 20 GKED C[C@@H](SCc1ccccc1)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 916050530 CFTQJDNCUIVNLE-JPYJTQIMSA-N 386.520 5.602 30 20 GKED COc1ccc(OCc2ccccn2)c(C=NNc2cccc(Cl)c2C)c1 921258557 WYVUGUIRJFGPLS-UHFFFAOYSA-N 381.863 5.077 30 20 GKED Cc1ccc(NN=Cc2cccc(O[C@@H](C(=O)O)c3ccccc3)c2)c(Cl)c1 1776060858 SFEDKJKBCJVGET-OAQYLSRUSA-N 394.858 5.299 30 20 GKED Cc1c(NN=C2CCCC[C@H]2c2cc(F)c(F)c(F)c2)cccc1C(=O)O 1776089203 HDUKXXYPKKHTBO-AWEZNQCLSA-N 376.378 5.236 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-n2cnc3ccccc32)cc1 1776782699 BEOXMNOQFHWZKZ-FQEVSTJZSA-N 393.531 5.319 30 20 GKED CCCCCCCCOc1ccc(/C=C\c2nc(C)c(CC(=O)O)c(O)n2)cc1 1776785433 ABYIDTRPFWYVJR-KAMYIIQDSA-N 398.503 5.027 30 20 GKED C=CC[C@@H](C(=C)C)C(=O)NC1(c2ccc(NC(=O)c3ccsc3)cc2)CCC1 1787287245 WGOLJFQIVMXKGU-FQEVSTJZSA-N 394.540 5.264 30 20 GKED CCc1cccc(N/C(S)=C(/C(=O)c2ccc(C)c(C)c2)[n+]2ccccc2)c1 14872170 AZEWVNNYXLGUJW-UHFFFAOYSA-O 389.544 5.204 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2Cl)o1)c1nc2ccccc2s1 36092593 GHUKSULAWWKVOU-ZDUSSCGKSA-N 378.840 5.700 30 20 GKED C=CCn1c(C)nnc1SCc1csc(-c2ccc(C(F)(F)F)cc2)n1 55490264 ZQEQDTILDOHULR-UHFFFAOYSA-N 396.463 5.207 30 20 GKED Cc1nc(-c2ccc(NC(=O)c3ccccc3-c3ccccc3C#N)cc2)oc1C 56133038 WXGVATKMFVREIF-UHFFFAOYSA-N 393.446 5.749 30 20 GKED N#CCCCOc1cccc(NC(=O)c2csc(-c3ccc(Cl)cc3)n2)c1 108296190 ZRUNRSNSRWBRSX-UHFFFAOYSA-N 397.887 5.398 30 20 GKED CC(C)COc1ccccc1NC(=O)c1ccc(COc2ccccc2C#N)o1 108329062 PSXAVNZSTXPTAD-UHFFFAOYSA-N 390.439 5.017 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N1CC[C@H](c2ccc(Cl)cc2)C1 111766965 SGXFJXZPAAQWQV-WBVHZDCISA-N 399.947 5.756 30 20 GKED CC[C@H](C#N)Oc1cccc(CNCc2ccc(-c3c(F)cccc3F)o2)c1 115618500 AUOFUKMLFZZYPL-MRXNPFEDSA-N 382.410 5.196 30 20 GKED Cc1cc(OCc2ccccc2)ccc1NC(=O)N(C)Cc1ccc(C#N)cc1 117461175 WTFLFUWJYKSZMH-UHFFFAOYSA-N 385.467 5.110 30 20 GKED Cc1cccc(NC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)c1Br 120706907 NKGDWEDTEDXQTJ-SJLPKXTDSA-N 398.304 5.061 30 20 GKED C=CCn1c(SCc2ncc(-c3cccs3)o2)nnc1-c1cccs1 123216590 MWVQUCVSLDOWGN-UHFFFAOYSA-N 386.527 5.201 30 20 GKED Cc1ccc(C)c(NC(=O)[C@@H](C)Sc2nc(-c3ccccc3)ccc2C#N)c1 138669880 RKNDVKKQXAZSQW-QGZVFWFLSA-N 387.508 5.356 30 20 GKED CC[C@@H](CC#N)NC(=O)c1oc2ccccc2c1CSc1ccccc1F 183908091 SPAZUXBNLGGWCY-AWEZNQCLSA-N 382.460 5.286 30 20 GKED Cc1cnc([C@H](C)CNC(=O)c2ccccc2Sc2ccccc2C#N)s1 184069208 TUEKTPQVKIJUIX-CQSZACIVSA-N 393.537 5.008 30 20 GKED COc1ccc(-c2cc(C(=O)[C@H](C#N)c3nc(C)cs3)c3ccccc3n2)cc1 193271007 FGVCQNJDOZVYDA-IBGZPJMESA-N 399.475 5.165 30 20 GKED COc1ccc(F)cc1[C@@H](C)NCc1cccc(OCc2ccccc2C#N)c1 237180244 GKRABFXEGMPPON-QGZVFWFLSA-N 390.458 5.136 30 20 GKED N#CC1(CCCN[C@H]2CCC[C@H]2c2ccccc2C(F)(F)F)CCOCC1 281208884 CZJUZZIAIHFIMA-HKUYNNGSSA-N 380.454 5.032 30 20 GKED Cc1sc([C@H](C)Nc2snc(Cl)c2C#N)nc1-c1ccc(Cl)cc1 301966797 VSOWIMMVLVSKIG-QMMMGPOBSA-N 395.340 5.927 30 20 GKED N#C[C@H](NC(=O)c1coc2ccccc12)c1ccc(OCc2ccccc2)cc1 303579430 MIXPYGXKADMYQY-QFIPXVFZSA-N 382.419 5.006 30 20 GKED N#CCCCOc1cccc(N[C@@H]2CCc3sc(Br)cc32)c1 319886264 JORMDOMOYRMCEG-OAHLLOKOSA-N 377.307 5.293 30 20 GKED Cc1nc(-c2cccc(N=C(O)[C@@H]3CCCC[C@H]3C(=O)N3CCCC3)c2)cs1 329227294 BAFFYTZSAHPGSQ-RTBURBONSA-N 397.544 5.135 30 20 GKED Cc1cc(C)c(N/C(O)=N/[C@H]2CCOC3(CCCCC3)C2)c(Br)c1 330354911 PZMHXNCFOLVIQW-HNNXBMFYSA-N 395.341 5.274 30 20 GKED N#Cc1ccc(-c2nc(-c3ccc(Oc4cccc(Cl)c4Cl)nc3)no2)o1 426456912 FLWGSPOCYAKDKY-UHFFFAOYSA-N 399.193 5.362 30 20 GKED CC(C)Oc1ccc(-c2ccc(NCCCC3(C#N)CCOCC3)c(F)c2)cc1 427862029 UYZYRSLFZMOMLW-UHFFFAOYSA-N 396.506 5.792 30 20 GKED C[C@H](NC(=O)N(Cc1ccc(C#N)cc1)C1CC1)c1cc(Cl)ccc1Cl 430167251 VJNHGPWGCDHBIV-ZDUSSCGKSA-N 388.298 5.300 30 20 GKED Cc1cc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)nn1-c1ccccc1Cl 430607259 XZGSYNAIFYGTHE-ZDUSSCGKSA-N 398.919 5.078 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)c(Cl)c2)CCS1 437784945 ZNVLTLLBCXCYHE-HKUYNNGSSA-N 399.947 5.355 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(-c2nccs2)c1 437881203 ASHAQOQWGVOMLJ-VQTJNVASSA-N 388.496 5.114 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1 438496868 YVVSRSIVEQHGTD-UHFFFAOYSA-N 386.455 5.190 30 20 GKED CC(C)c1ccc(-c2ncc(CN(C#N)c3ccc(F)c(C#N)c3)s2)cc1 439704968 DZUDVVCHWSYMRF-UHFFFAOYSA-N 376.460 5.432 30 20 GKED COc1cccc([C@@H]2C[C@H](C)CN2C(=O)N[C@H](CCCC#N)c2ccccc2)c1 458799702 JTSYJDDNHILJAL-NMNUPHIUSA-N 391.515 5.223 30 20 GKED O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N(Cc1ccc(F)cc1)CC(F)(F)F 460453968 YOEWXXIBJQGVNI-OLZOCXBDSA-N 385.323 5.085 30 20 GKED C[C@@H](C(=O)Nc1ccc(NCc2ccccc2)c(Cl)c1)c1cccc(C#N)c1 462002171 WKUHYTKYIKFQFU-MRXNPFEDSA-N 389.886 5.566 30 20 GKED COc1ccccc1[C@@H](C)SCC(=O)N(CCC#N)c1cc(C)cc(C)c1 463209557 KGVVIWYPZPKPBM-GOSISDBHSA-N 382.529 5.053 30 20 GKED COc1ccc([N+](=O)[O-])cc1CNc1ccc(Oc2ccccc2C#N)c(F)c1 463219878 BHVDZUNQFFJGFM-UHFFFAOYSA-N 393.374 5.019 30 20 GKED CC#CCCCC(=O)Nc1ccc(Oc2nncc3ccccc23)c(Cl)c1 466861935 HLCNRIFEHMNHEN-UHFFFAOYSA-N 379.847 5.208 30 20 GKED C=CCC(CC=C)C(=O)NCc1cccc(NC(=O)Nc2cccc(C)c2)c1 467822121 IXYXFBONGACYDM-UHFFFAOYSA-N 377.488 5.024 30 20 GKED Cc1ccc(C#N)cc1NC(=O)c1ccc(-n2ncc3ccccc32)cc1Cl 469532943 JQPRYOXCHZHCJY-UHFFFAOYSA-N 386.842 5.111 30 20 GKED O=C(Nc1ccc(F)cc1OCC(F)(F)F)c1cc(C(F)(F)F)ccc1F 471310260 DGOMJMSLQXEKET-UHFFFAOYSA-N 399.237 5.177 30 20 GKED Cc1c(N[C@H](C)C(C)C)cccc1C(=O)Nc1cccc(OCCCC#N)c1 474335053 CMMPVIQICRUEGL-GOSISDBHSA-N 379.504 5.386 30 20 GKED COc1ccc(N(Cc2ccccc2)C(=O)C[C@@H](CC#N)c2ccccc2)cc1 475901876 APELTFUGGCKWIK-JOCHJYFZSA-N 384.479 5.316 30 20 GKED Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(C(C)(C)C#N)cc1 476336305 IWGWYBBTBUJQBM-SFHVURJKSA-N 375.516 5.427 30 20 GKED C=CCn1c(S[C@@H](C)c2ncc(C(C)(C)C)o2)nnc1-c1cccc(C)c1 476469176 UYKWFYOHFBCBJZ-HNNXBMFYSA-N 382.533 5.578 30 20 GKED N#C[C@H](C(=O)c1ccc(Sc2ccc(Cl)cc2)o1)c1nc2ccccc2o1 478101893 CXRJUXUMNSTIGG-CQSZACIVSA-N 394.839 5.715 30 20 GKED N#CCCn1cc(CNc2cc(F)ccc2OCC2CC2)c(-c2ccccc2)n1 483399185 AIXMQHGORFMVKU-UHFFFAOYSA-N 390.462 5.004 30 20 GKED N#CCCC[C@@H](NC(=O)CCCc1cccc(C(F)(F)F)c1)c1ccccc1 487241311 MRDIPDXPYOLGBW-HXUWFJFHSA-N 388.433 5.579 30 20 GKED N#CCC[C@H](NC(=O)N1CCC[C@H](c2ccc(F)cc2)CC1)c1ccccc1 487936552 SBEBKAWHRYQTAZ-AVRDEDQJSA-N 379.479 5.150 30 20 GKED N#Cc1c(F)cccc1C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1 488682802 HDRWLLFSXDSXKA-SFHVURJKSA-N 389.817 5.259 30 20 GKED C[C@H](Sc1nc2c(c(-c3ccco3)c1C#N)CCC2)c1nc(C(C)(C)C)no1 498057687 LPXPTSVSRKUERZ-LBPRGKRZSA-N 394.500 5.236 30 20 GKED Cc1c(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)sc2ccc(C#N)cc12 499115731 GJCKZRDIDVQSSV-UHFFFAOYSA-N 386.423 5.399 30 20 GKED CSCc1ccc(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500733592 OVHWZRNAYMSRAB-UHFFFAOYSA-N 388.492 5.774 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]3c3cccc4ccccc34)CC2)cc1 503901014 LCZVLONCPZHDIR-LOSJGSFVSA-N 378.475 5.131 30 20 GKED Cc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)NCCCCC#N)cc1 505085582 BGAKJVZBJPDOOH-LVZFUZTISA-N 395.506 5.454 30 20 GKED C=CCn1c([C@H](C)CC)nnc1N1CCC(c2nc3cc(Cl)ccc3o2)CC1 508813603 POXZWLWYYVOJHF-CQSZACIVSA-N 399.926 5.156 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1 510240482 KMDORRSFGRBRGS-UHFFFAOYSA-N 398.462 5.226 30 20 GKED C=CCOc1cccc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c1 510995296 IZJLMQWUEJVWAF-UHFFFAOYSA-N 375.472 5.144 30 20 GKED N#Cc1ccc(CCC(=O)N[C@H](c2cccc3ccccc23)C(F)(F)F)cc1 511719540 NLEOBLQDFBDOTP-OAQYLSRUSA-N 382.385 5.064 30 20 GKED Cc1ccc(Cn2nc(C)c(CNc3cccc(OCCCC#N)c3)c2C)cc1 513202163 OVRHYROXQVVNGX-UHFFFAOYSA-N 388.515 5.151 30 20 GKED Cc1c(C(=O)N(CC(C)C)c2ccc(C#N)cc2)cnn1-c1cccc(Cl)c1 515372368 SEWFEUAMZJBMBY-UHFFFAOYSA-N 392.890 5.009 30 20 GKED Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)Nc1ccc(F)cc1F 517712049 WDMHMYUGIXFLMB-UHFFFAOYSA-N 379.366 5.581 30 20 GKED COc1ccc(CCC(=O)Nc2cccc(Oc3ccc(C#N)cc3)c2)cc1F 519127919 VBKGNCHGPRSWMW-UHFFFAOYSA-N 390.414 5.070 30 20 GKED Cc1cccc(OCCCCC(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)c1 521015085 ITJMPAVHEGEBMJ-LJQANCHMSA-N 391.298 5.232 30 20 GKED O=C(NCc1cccc(C(F)(F)F)c1)Nc1ccc(F)cc1C(F)(F)F 524441064 PYYZPCCPEVQQJV-UHFFFAOYSA-N 380.263 5.185 30 20 GKED Cc1cccc(NC(=O)NC2CCC(Oc3ccccc3C#N)CC2)c1Cl 525312741 TUQYGFLHPHWPTB-UHFFFAOYSA-N 383.879 5.032 30 20 GKED C[C@@H](Cc1ccccc1)n1cccc1C(=O)[C@H](C#N)c1nc2ccccc2s1 538046410 WRRDGCLEOSOYFO-WMZOPIPTSA-N 385.492 5.392 30 20 GKED COc1ccc([C@H](N[C@H](C)c2ccc(C#N)cc2)c2ccccc2Cl)cc1 538406508 ILJBETXBBASJOV-MWTRTKDXSA-N 376.887 5.660 30 20 GKED N#Cc1ccc(Oc2cccc(-c3nc([C@H]4OCCc5ccccc54)no3)c2)cc1 547132999 ZWBCAEYVVGAQKR-QFIPXVFZSA-N 395.418 5.063 30 20 GKED Cc1nc(-c2ccc(OCCC(C#N)(c3ccccc3)c3ccccc3)cc2)no1 554658421 JFNMYMFFZDFFRK-UHFFFAOYSA-N 395.462 5.324 30 20 GKED N#Cc1ccc(Br)c(CSCc2ccc(C(F)(F)F)cn2)c1 559951896 LCEPZAFESQFVOJ-UHFFFAOYSA-N 387.224 5.168 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cccc2c1OCC[C@@H]2OC 560038630 VKEFKQZPBQFGPN-INIZCTEOSA-N 392.908 5.092 30 20 GKED C[C@@H](NC(=O)[C@@H]1CCC(=O)c2ccccc21)c1ccc(-c2cccc(C#N)c2)cc1 560088494 MPKIPENNISUQOD-MZNJEOGPSA-N 394.474 5.163 30 20 GKED CC[C@H](NC1CCC(C#N)(c2ccccc2)CC1)c1ccc(OC)c(OC)c1 560571484 IMLYAIJQNJTIOD-DQBMGFJSSA-N 378.516 5.149 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)NC[C@@H]2CCOc3ccccc32)cc1 567398296 RTKSLNMOWXERGG-SFHVURJKSA-N 399.450 5.038 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cc(Br)c(F)cc2Cl)c1 588941050 DWQPVWUWLGDHPV-UHFFFAOYSA-N 388.023 5.019 30 20 GKED N#CCCC[C@H](NC(=O)Nc1cccnc1Oc1ccccc1)c1ccccc1 590106598 GQPPJRCTTWNRCA-FQEVSTJZSA-N 386.455 5.431 30 20 GKED N#Cc1cccc2c1CN(C(=O)Nc1cc(Cl)ccc1OC1CCCC1)C2 593184032 SHYSBHHTTPLXED-UHFFFAOYSA-N 381.863 5.081 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)Cc1cccc2ccccc12 603601277 UTADHMKDKPJTLR-UHFFFAOYSA-N 393.446 5.388 30 20 GKED CC(C)OCc1ccc(C(=O)Nc2sc3c(c2C#N)CCCCCC3)cc1 603996422 PEQPHUHHINQFJD-UHFFFAOYSA-N 382.529 5.456 30 20 GKED CC(C)=C[C@@H]1[C@H](C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)C1(C)C 604003408 ABKIPROAUYSJLC-FYYLOGMGSA-N 388.511 5.509 30 20 GKED C=C(C)COc1cccc(NC(=O)CSCc2coc(-c3ccccc3)n2)c1 608947418 WFEFIWAARCSUNP-UHFFFAOYSA-N 394.496 5.168 30 20 GKED COc1ccc(-c2nnc(S[C@H](C#N)C3CCCCC3)n2CC(C)C)cc1 609648550 HWBDVKUSRMYTJY-LJQANCHMSA-N 384.549 5.174 30 20 GKED C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 609682255 FMVOHMZOXDBDPI-NQIIRXRSSA-N 397.478 5.760 30 20 GKED C[C@H]1[C@H](c2ccccc2)CCN1C(=O)Nc1ccc(Oc2cccc(C#N)c2)nc1 610583964 ORLLOWGMPJNTTG-HTAPYJJXSA-N 398.466 5.155 30 20 GKED C[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cccc(C#N)c1 611084182 OMHVEJJXBPBPQE-LBPRGKRZSA-N 388.323 5.839 30 20 GKED N#Cc1ccc(CN[C@@H](c2ccccc2)c2ccccc2Br)c(F)c1 611519488 JZIQSDJTCOHFQI-NRFANRHFSA-N 395.275 5.339 30 20 GKED N#C[C@H](C(=O)c1ccc2c(c1)CCC2)c1nc(-c2ccc(Cl)cc2)cs1 613319168 SUDITNKSCDMMJM-GOSISDBHSA-N 378.884 5.442 30 20 GKED C=CCC1(NCc2csc(N(C(C)=O)c3ccccc3CC)n2)CCCCC1 625937448 ZUBFMSJJWGQGDG-UHFFFAOYSA-N 397.588 5.759 30 20 GKED N#C[C@@H](C(=O)c1ccc(C(F)(F)F)s1)c1nc2cc(Cl)ccc2s1 671751721 MJUBAOLVVMSJAE-QMMMGPOBSA-N 386.807 5.520 30 20 GKED N#C[C@H](C(=O)c1ccc(CCC(F)(F)F)cc1)c1nc2cc(F)ccc2s1 676999243 SHCUXXDXXOXLBH-CQSZACIVSA-N 392.377 5.420 30 20 GKED CCCc1c(C(=O)[C@H](C#N)c2ccc3ccccc3n2)cnn1-c1ccc(F)cc1 679881941 XXMSALQHFZYAOS-LJQANCHMSA-N 398.441 5.002 30 20 GKED COc1ccc(-c2nc(C)c(C(=O)/C=C\c3cccc(OC)c3OC)s2)cc1 727973880 BCRQOYZDHWPPKP-RAXLEYEMSA-N 395.480 5.040 30 20 GKED CCCCCCOCC(=O)[C@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 730922659 XMTZKTGHVLCMQF-ZDUSSCGKSA-N 384.423 5.088 30 20 GKED N#Cc1ccccc1-c1ccc(CN(Cc2ccccc2O)C[C@@H]2CCCO2)cc1 731845247 WNGCZOTVTVIIGF-DEOSSOPVSA-N 398.506 5.112 30 20 GKED COc1cc(C(=O)/C=C\c2cc(C(F)(F)F)ccc2F)ccc1OC(F)F 733206249 DWMXASRQPUJOBF-KXFIGUGUSA-N 390.279 5.351 30 20 GKED C#CCCOc1ccc(CN[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1 733328141 INFGLIYNKONPRQ-MRXNPFEDSA-N 394.515 5.511 30 20 GKED Cc1cccc(COc2c(C)cc(C=Nn3cnnc3-c3ccccc3)cc2C)c1 734364146 WVYCYNIHOWSHRQ-UHFFFAOYSA-N 396.494 5.332 30 20 GKED CC(C)c1ccc([C@@H](C)CC(=O)[C@@H](C#N)c2nc3cc(F)ccc3s2)cc1 739180022 GWFPOPKBRWZCDT-KBXCAEBGSA-N 380.488 5.929 30 20 GKED Cc1ncsc1/C=C/C(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1C 743056544 YCMQSGLJAYRHNC-AATRIKPKSA-N 378.284 5.149 30 20 GKED N#C[C@H](C(=O)[C@H]1Cc2ccccc21)c1nc(-c2ccc(Cl)cc2Cl)cs1 744035140 KMLVVPNRIRLCAU-JKSUJKDBSA-N 399.302 5.633 30 20 GKED N#CCc1ccc(NC(=O)/C=C\c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 744235904 BBCQJHBXEFQBFF-UTCJRWHESA-N 398.306 5.442 30 20 GKED CC(C)(Cc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 753807706 VEOQTZGDXGNGDG-OAHLLOKOSA-N 386.879 5.534 30 20 GKED C=CCC(CC=C)C(=O)OCC(=O)N1c2ccccc2Sc2ccccc21 759008185 RVOHIYKGPSCWGQ-UHFFFAOYSA-N 379.481 5.128 30 20 GKED O=C(/C=C\c1ccc(F)c(C(F)(F)F)c1)c1cc(Br)ncc1F 762428210 WZMUEJFFGQHBPY-RQOWECAXSA-N 392.121 5.037 30 20 GKED C=CC[C@H](N[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1)c1ccncc1 766022544 WUGQNKRBPUWXJB-UUOWRZLLSA-N 376.475 5.768 30 20 GKED Cc1ccc(-c2ncc(C(=O)OC[C@H](C#N)Cc3cccs3)s2)c(C)c1 772732094 FHVZDTSGRSLCJA-HNNXBMFYSA-N 382.510 5.028 30 20 GKED N#C[C@@H](C(=O)C1(c2c(Cl)cccc2Cl)CCC1)c1nc2ccccc2o1 774054400 OXEHSYLZZSECRN-LBPRGKRZSA-N 385.250 5.433 30 20 GKED C=CCCC(=O)Nc1ccc(COC(=O)c2csc(-c3ccccc3)n2)cc1 774583106 RNEISKUTYPEFIX-UHFFFAOYSA-N 392.480 5.072 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cnc(Cl)c(Br)c1C 776908595 YUVOERUDJNCZBZ-UHFFFAOYSA-N 397.725 5.336 30 20 GKED C#CCCCCCC(=O)N(Cc1ccccc1)[C@H]1CCOc2ccc(OC)cc21 779967346 KPSUOGDJRPZXBC-QHCPKHFHSA-N 391.511 5.131 30 20 GKED C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1 780675408 WPOVFSCFOLUHGD-UONOGXRCSA-N 391.393 5.221 30 20 GKED C#Cc1cccc(N(Cc2ccccc2)C(=S)NCCCCC(F)(F)F)c1 794977651 DWEJAEZIQJQCNS-UHFFFAOYSA-N 390.474 5.282 30 20 GKED N#Cc1ccc(Cl)c(C(=O)Nc2cccc(CC[C@H](O)c3ccccc3)c2)c1 797087827 JJQFZTMYOPNTHU-QFIPXVFZSA-N 390.870 5.130 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)N1CCC(C)(c2cccc(Cl)c2)CC1 797643375 VQDIVSRVIJGHQA-MRXNPFEDSA-N 397.906 5.216 30 20 GKED Cc1cc(CN[C@H](CCCNC(=O)OC(C)(C)C)c2ccccc2)ccc1C#N 810135116 IWBOUDRULMWQNZ-JOCHJYFZSA-N 393.531 5.003 30 20 GKED N#CCCC[C@@H](NC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1ccccc1 817320147 YMHGNKGCDPCFCI-QZMUEMGWSA-N 389.886 5.453 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1 915086640 MAVJEUPRGKJSNV-SFHVURJKSA-N 381.262 5.901 30 20 GKED CCOc1cccc2cc(C(=O)/C=C\c3ccc(OC)c(OC(F)F)c3)oc12 916130424 UTBUJBDWSAVURY-CLFYSBASSA-N 388.366 5.338 30 20 GKED Cc1cc([C@H](C#N)C(=O)c2cc(C)n(-c3cccc(C(C)C)c3)c2C)nc(C)n1 916880385 QAHPVHAOEKDDRZ-QFIPXVFZSA-N 386.499 5.114 30 20 GKED CCc1ccc(NC(=O)[C@H](C#N)C(=O)c2ccc(-c3ccccc3Cl)o2)cc1 916911179 RKVQJEVCKYHXOZ-QGZVFWFLSA-N 392.842 5.124 30 20 GKED CCCCc1ccc(NC(=O)[C@H](C#N)C(=O)c2oc3ccc(F)cc3c2C)cc1 916913533 HHNAAGDIXAJSJS-LJQANCHMSA-N 392.430 5.184 30 20 GKED CC1(C)CN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)[C@@H]1c1ccccc1 919904873 XEHBPGZGBPEENY-BJKOFHAPSA-N 395.506 5.957 30 20 GKED CC(=Nn1c2ccccc2c2ccccc21)c1ccc(-c2ccc(C(=O)O)o2)cc1 1776112834 MDTGKCMXOANQHV-UHFFFAOYSA-N 394.430 6.025 30 20 GKED CC(C)Oc1ccc(C(=O)O)cc1C(=O)/C=C\c1cccc(C(F)F)c1F 1776355358 BUICCTORVPYIDU-VURMDHGXSA-N 378.346 5.145 30 20 GKED C[C@H]1C/C(=C/c2ccc(-c3cccc(CC(=O)O)c3)cc2)C(=O)c2sccc21 1776589748 UKYGRVJNLIEEEU-DKNZLLBESA-N 388.488 5.816 30 20 GKED CCCCCCCOc1ccc(CNc2cccc(C(=O)O)c2OC(C)C)cc1 1776789013 KDQPLMDUODRPNB-UHFFFAOYSA-N 399.531 6.133 30 20 GKED O=C(/C=C/c1cc2cc(F)ccc2o1)c1ccc(-c2ccc(C(=O)O)o2)cc1 1777569346 GSDNFLOOIHUYBP-VOTSOKGWSA-N 376.339 5.426 30 20 GKED C=CCCC(C)(C)C(=O)Nc1ccc(C2(NC(=O)C3=CCCS3)CCC2)cc1 1785840760 CAKQQLXPIXUYND-UHFFFAOYSA-N 398.572 5.134 30 20 GKED Cc1cc(C)c(C#N)c(SCC(=O)Nc2ccccc2Oc2ccccc2)n1 5643250 RWRNRKONPNASFB-UHFFFAOYSA-N 389.480 5.093 30 20 GKED COc1ccccc1N(CCC#N)C(=O)[C@@H](C)Sc1ccc2ccccc2c1 22249809 QVSCICYVZCXRRQ-QGZVFWFLSA-N 390.508 5.276 30 20 GKED Cc1[nH]c2ccc(C(=O)[C@@H](C#N)c3nc4ccccc4n3C(F)F)cc2c1C 41559594 JRJHTFRUVRNJBJ-OAHLLOKOSA-N 378.382 5.020 30 20 GKED N#Cc1ccc(CCC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1 57084400 CKTJGMGTUUNMJD-OAQYLSRUSA-N 380.900 5.112 30 20 GKED C[C@@H](Nc1ccc(Oc2ccccc2C#N)cc1)C(=O)Nc1ccc(F)c(F)c1 60036166 OGMBTGJLVUBLKE-CQSZACIVSA-N 393.393 5.068 30 20 GKED Cc1c(C(=O)[C@H](C#N)c2nc(-c3c(F)cccc3F)cs2)oc2ccccc12 64714434 ATNXOYNIHYOELS-ZDUSSCGKSA-N 394.402 5.633 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CCc1ncc(-c2ccccc2)o1 66800958 FLSMKEXRKRZGPJ-INIZCTEOSA-N 391.496 5.307 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)c1cnn(-c2ccccc2Cl)c1 108239437 DXPCOGLSXSYLSQ-AWEZNQCLSA-N 396.903 5.030 30 20 GKED C[C@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)N(C(=O)CCc2ccc(C#N)cc2)C1 136069875 RSPNSUSXHJVIDD-YWZLYKJASA-N 386.417 5.119 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCC[C@@H](Nc2ccccc2)C1 151043738 RLDZYAYKYJCELG-PKOBYXMFSA-N 394.544 5.047 30 20 GKED C=CCn1c(S[C@@H](C)c2ccc(Cl)cc2Cl)nnc1-c1cnccn1 178299888 DCJCSMMJDRCRCX-NSHDSACASA-N 392.315 5.081 30 20 GKED CC[C@H](NCc1ccc(OC)c(O[C@@H](C#N)CC)c1)c1ccc(Cl)s1 180812481 AEHVZZASDSLWIY-CABCVRRESA-N 378.925 5.332 30 20 GKED Cc1ccc(SC2CCCC2)c(C(=O)Nc2ccccc2O[C@@H](C)C#N)c1 182076048 RVYVVDRWVUTLPV-INIZCTEOSA-N 380.513 5.573 30 20 GKED C[C@@](C#N)(CCc1ccccc1)NC(=O)c1ccc(Cl)cc1C(F)(F)F 186420949 YRCHYCRDAVGARZ-SFHVURJKSA-N 380.797 5.004 30 20 GKED C[C@@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1 237503610 GJGVQCQZMDLDRO-ZWKOTPCHSA-N 390.458 5.760 30 20 GKED C=CCN(C(=O)c1cccc(OC(F)F)c1)c1nc(-c2ccccc2)cs1 301144888 LITZRFBCAUKBOP-UHFFFAOYSA-N 386.423 5.244 30 20 GKED CCCCOc1cccc(NC(=O)c2occc2COc2cccc(C#N)c2)c1 303099319 BMJMSFHEOLYGSM-UHFFFAOYSA-N 390.439 5.161 30 20 GKED OC(=Nc1c[nH]nc1-c1ccccc1)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329437064 JYRLMPNDQGTYRR-GOSISDBHSA-N 389.503 5.172 30 20 GKED N#CC1(CC[S@@](=O)Cc2csc(CCc3ccccc3)n2)CCCCC1 417151394 RHKLRGJJOIQTEA-AREMUKBSSA-N 386.586 5.041 30 20 GKED N#CC1(CC[S@@](=O)Cc2csc(-c3ccc(Cl)cc3)n2)CCCCC1 417159487 ORERZXFWQWWXAM-RUZDIDTESA-N 392.977 5.576 30 20 GKED C=CC[C@H](C(=O)Nc1ccc(Oc2nncc3ccccc23)cc1)c1ccccc1 428027992 CZBAPAWAFUBHKS-QFIPXVFZSA-N 395.462 5.721 30 20 GKED N#Cc1ccc(NC(=O)c2sc3cc(Cl)ccc3c2Cl)c(Cl)c1 430357874 SVUSFCDPALSZAB-UHFFFAOYSA-N 381.671 5.985 30 20 GKED Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)[C@@H]1[C@H](C)[C@H]1c1ccccc1 430392853 KIEGSKZSYUNHFV-URZJWIJPSA-N 383.451 5.042 30 20 GKED Cc1ccccc1-c1nnc(SCCCCC(C)(C)C#N)n1Cc1ccco1 436133622 CFTNNBJBVJEPBS-UHFFFAOYSA-N 394.544 5.707 30 20 GKED N#Cc1ccc(-c2nnc(CN3CCCCC[C@@H]3/C=C/c3ccccc3)o2)cc1 441181931 OVMUFWSGZRLXNS-OWSFEGEDSA-N 384.483 5.066 30 20 GKED N#CCCCn1cc(C(=O)N2CCCSc3ccccc32)c2ccccc21 443904868 HDALUUHMXRSNMY-UHFFFAOYSA-N 375.497 5.088 30 20 GKED C[C@@H](c1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1)C(F)(F)F 453780843 QBMSXRJVUODFLM-FZMZJTMJSA-N 380.435 5.596 30 20 GKED COc1ccc([C@H](NCc2ccc(C#N)cc2F)c2ccccc2Cl)c(C)c1 462172621 VYHJEERGLPYXKC-QHCPKHFHSA-N 394.877 5.547 30 20 GKED CCCN(C(=O)CCCC#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 463088199 SHHFNMNERXCHJL-UHFFFAOYSA-N 382.316 5.554 30 20 GKED N#C[C@@H](NC(=O)c1c(F)cccc1Sc1ccccc1)c1ccccc1F 464398456 LKYFAZXYBJYXKW-GOSISDBHSA-N 380.419 5.111 30 20 GKED CC#CCCCC(=O)N(CC)[C@@H]1CCSc2ccc(Br)cc21 464443005 UQCQCYJTICNXDM-MRXNPFEDSA-N 380.351 5.028 30 20 GKED N#Cc1ccc(Oc2cccc(C(=O)Nc3cnccc3-c3ccccc3)c2)cc1 468117905 UXYXNYXAXIJEKP-UHFFFAOYSA-N 391.430 5.665 30 20 GKED O=C(CC1CCC(C(F)(F)F)CC1)Nc1cc(F)c(OC(F)F)cc1F 468215352 LQNDKHWULSBFEQ-UHFFFAOYSA-N 387.295 5.264 30 20 GKED C[C@@H](Nc1cccc(Oc2ccc(C#N)cc2)c1)c1cn(-c2ccccc2)nn1 471648319 LHWIZGKYWZGZOV-QGZVFWFLSA-N 381.439 5.104 30 20 GKED CC[C@@H]1CN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC[C@H]1c1ccccc1 472683874 NZFMXUIELSANAN-XMSQKQJNSA-N 375.516 5.535 30 20 GKED COc1cc(-n2cccc2)c(Cl)cc1C(=O)[C@@H](C#N)c1nc(C(C)C)cs1 474451047 YHBHUCQAGLCXDZ-CQSZACIVSA-N 399.903 5.209 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(CC)Cc1ccc(Cl)s1 475558711 LRFIRSFWUBZPRI-UHFFFAOYSA-N 376.953 6.307 30 20 GKED CC(C)c1csc(CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)n1 478790419 DMTZYONXVMAIHO-UHFFFAOYSA-N 392.484 5.252 30 20 GKED Cc1cc(Br)cc(Cl)c1C(=O)N[C@H](C#N)c1ccccc1Cl 480818702 UZXVODFCAMAHRC-CQSZACIVSA-N 398.087 5.059 30 20 GKED C=CCN(Cc1ccc(Cl)s1)C(=O)Nc1cn(-c2ccccc2)nc1C 481288621 HBISNRXJZQUMRZ-UHFFFAOYSA-N 386.908 5.116 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CC(C)(C)Cc2oc(C)cc21 482723987 OPQRFEQLHFNYSV-HXUWFJFHSA-N 398.551 5.167 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1 486437350 UVWUNNAXNHNXSC-UHFFFAOYSA-N 377.469 5.144 30 20 GKED C=CCOc1ccc(CN[C@@H](C)c2nc(C(F)(F)F)cs2)cc1Cl 486811317 LNBATOPJELHLJW-JTQLQIEISA-N 376.831 5.231 30 20 GKED C=CCC[C@H](C(=O)Nc1ccc(OCC2CCOCC2)cc1)c1ccccc1 489024056 KJNIRVLOLMLARP-QHCPKHFHSA-N 379.500 5.181 30 20 GKED CC(C)(C)c1nc2ccc(NC(=O)N(CCC#N)Cc3ccco3)cc2s1 494143704 ACQZUNXBWXWGHL-UHFFFAOYSA-N 382.489 5.135 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCCC[C@H]2CCc2ccccc2)cc1 497653877 YLUFPGCQNQGPHY-QFIPXVFZSA-N 375.516 5.507 30 20 GKED CC(C)Cn1ncc(NC(=O)Nc2ccccc2S[C@H](C)CC#N)c1C(C)C 499892462 ZQHNRISSFZLRAM-MRXNPFEDSA-N 399.564 5.701 30 20 GKED Cc1nc(-c2cccs2)ccc1C(=O)N(CC(C)C)c1ccc(C#N)cc1 500241840 SZHFBETZJGFYCT-UHFFFAOYSA-N 375.497 5.293 30 20 GKED C=CCCc1ccccc1NC(=O)N(CC(C)C)[C@@H]1CCCc2cccnc21 505034502 FFBJWEKRXRKQTM-JOCHJYFZSA-N 377.532 5.768 30 20 GKED C=CCCc1ccccc1NC(=O)N[C@H]1c2ccccc2CC[C@H]1n1ccnc1 505036363 WBHZZMTUJXSDJC-PKTZIBPZSA-N 386.499 5.052 30 20 GKED C=CCCc1ccccc1NC(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1 505041061 YJFBTEPYEVHAFP-HXUWFJFHSA-N 388.870 5.203 30 20 GKED C=CCOc1ccc(CN(Cc2cnc([C@H]3CCCO3)s2)C(C)(C)C)cc1 506051629 PJPIVFIAUCMXPM-HXUWFJFHSA-N 386.561 5.360 30 20 GKED N#CC1(CCCNc2cccc(-c3ccc(Br)cc3)c2)CCOCC1 506295561 RSTFVJJIHAAQNV-UHFFFAOYSA-N 399.332 5.629 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1ccc(C)cc1OCC(F)(F)F 511018035 ZGVPXWAYHLEBCC-UHFFFAOYSA-N 396.384 5.295 30 20 GKED CC[C@@H]1CCCC[C@H]1NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1 511398744 OGWKAWSQZJNEPI-DENIHFKCSA-N 391.515 5.422 30 20 GKED CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)c(Cl)c1 513862616 XTVSNZNGTPYNKI-SFHVURJKSA-N 399.878 5.037 30 20 GKED CC[C@@H](C)c1ccccc1OCC(=O)Nc1ccccc1S[C@@H](C)CC#N 517517743 IPXFOVCFVLZWBW-SJORKVTESA-N 382.529 5.612 30 20 GKED C[C@H](NC(=O)c1ccc(-c2ccc(OC(F)F)cc2)s1)c1ccc(C#N)cc1 518026974 BNYOVXWWLHECMV-ZDUSSCGKSA-N 398.434 5.379 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)Cc1c(Cl)cccc1Cl 518140360 YQKUYJUESUDKDM-LBPRGKRZSA-N 379.312 5.426 30 20 GKED COc1cc(CSc2nc(C)cc(C(F)(F)F)c2C#N)ccc1SC 518304875 IKTQWNSTZUZAEQ-UHFFFAOYSA-N 384.448 5.303 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)c2ccc3[nH]ccc3c2)cc1Cl 518590701 WJNOMYRRLQQNDA-HXUWFJFHSA-N 385.854 5.729 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 521800851 SCXACABWVHURAD-AWEZNQCLSA-N 397.500 5.539 30 20 GKED C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)Nc1cccc(C#Cc2ccccn2)c1 523032813 VPZRCUTXLQRGIY-WIYYLYMNSA-N 399.469 5.030 30 20 GKED Cc1sc([C@H](C)NC(=O)c2sccc2C#N)nc1-c1ccc(Cl)cc1 531518944 FJSRVGAJZWRRAT-JTQLQIEISA-N 387.917 5.196 30 20 GKED C[C@@H](NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)[C@H]1COc2ccccc21 532849681 RDZIHFCIFMUSBS-IIBYNOLFSA-N 399.450 5.037 30 20 GKED C=CCCOCCCCC(=O)NC[C@@H]1CC2c3ccccc3C1c1ccccc12 538266047 YTWKNOPNDTWYDV-VRXIZKAYSA-N 389.539 5.163 30 20 GKED N#CCC1CCN(C(=O)c2sc3cc(Cl)cc(Cl)c3c2Cl)CC1 541049228 NIBNDVLEKRNSHY-UHFFFAOYSA-N 387.719 5.627 30 20 GKED C[C@H](NCCC(C)(C)C#N)c1nc(-c2ccc(Br)cc2)cs1 543494746 DBNWDFKZMRLAON-LBPRGKRZSA-N 378.339 5.163 30 20 GKED C=CCSCCNC(=O)Nc1ccc([C@H](C#N)c2ccccc2)c(Cl)c1 543760669 WHNZFVOEKSMEHW-GOSISDBHSA-N 385.920 5.036 30 20 GKED N#C[C@@H](NC(=O)c1cc(Cl)c(F)cc1Cl)c1cccc(C(F)(F)F)c1 550936558 SBDYRWKZEIWZJN-CQSZACIVSA-N 391.151 5.146 30 20 GKED C=CCC[C@@H](NCc1cc(-c2c(OC)ccc3ccccc23)no1)c1ccco1 552068388 UZGWEMSHQZHEQT-HXUWFJFHSA-N 388.467 5.894 30 20 GKED C=CCN(Cc1cccs1)C(=O)Nc1cc(F)ccc1OCC(F)(F)F 554634216 QISQBNFWEVXGHA-UHFFFAOYSA-N 388.386 5.048 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)c1ccc(OC(F)F)c(F)c1 555995707 REWNRWMFYTVSDQ-NSHDSACASA-N 380.391 5.074 30 20 GKED N#Cc1ccc(C[C@H](C#N)c2nc(-c3ccc(OC4CCCCC4)cc3)no2)cc1 563568429 QEMRLAMQLATQAA-HXUWFJFHSA-N 398.466 5.170 30 20 GKED C[C@H](c1ncc(-c2ccc(Cl)cc2Cl)o1)N1CCC(CCC#N)CC1 567790055 MKQSSBCKRIHJDB-CYBMUJFWSA-N 378.303 5.725 30 20 GKED CN(Cc1ccc(Cl)cc1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 570490365 SIBZYOJOVFQCQN-UHFFFAOYSA-N 392.846 5.063 30 20 GKED C=CCCO[C@@H](C)c1nc([C@@H](OCC)c2ccc(F)cc2C(F)(F)F)no1 577680847 WYHSFOWMISQTOB-NHYWBVRUSA-N 388.361 5.007 30 20 GKED N#CC1(CC(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)CC1 590975111 VLYDICSWSZDDNF-UHFFFAOYSA-N 387.508 5.080 30 20 GKED N#Cc1ccc(Oc2cccc(NC(=O)N3[C@H]4CC[C@H]3CC(F)(F)C4)c2)cc1 599737984 SYQRCHKBASQRHQ-IRXDYDNUSA-N 383.398 5.145 30 20 GKED N#Cc1ccccc1OCc1ccc(C(=O)Nc2ccc(Cl)c(Cl)c2)o1 603944860 QRQOKJCIULMVLW-UHFFFAOYSA-N 387.222 5.289 30 20 GKED CC(C)CN(Cc1ccc(C#N)cc1)Cc1ccc(OCc2ccncc2)cc1 604512509 OJWCITOFKJOLIU-UHFFFAOYSA-N 385.511 5.190 30 20 GKED CC(C)(C)[C@H](NC(=O)NCc1ccc(C#N)cc1)c1cccc(C(F)(F)F)c1 608918969 XNPIDZPQHGODQW-GOSISDBHSA-N 389.421 5.164 30 20 GKED C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056114 AFHMLPLACCJAPF-OAHLLOKOSA-N 394.858 5.217 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1(c2ccc(F)cc2)CCC1 609436681 RXBCUKHQPKZSCR-HNNXBMFYSA-N 383.492 5.421 30 20 GKED C[C@H](NCc1csc(COc2ccc(Cl)cc2)n1)c1ccc(C#N)cc1 609598414 CBWDMGIZRYDINJ-AWEZNQCLSA-N 383.904 5.098 30 20 GKED C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(NC(=O)c2ccccc2)c1 611390657 MZLXJYMWGYPJHK-IQGLISFBSA-N 395.506 5.539 30 20 GKED CC(C)(C#N)c1ccc(NC(=O)N2CCn3c(cc4cc(Cl)ccc43)C2)cc1 617267968 AMXAIFARAVLISM-UHFFFAOYSA-N 392.890 5.144 30 20 GKED C[C@H](N[C@H](C)c1ccc(F)cc1C(F)(F)F)c1nc(C(F)(F)F)cs1 623973174 IZHIAHHQAIAGSL-SFYZADRCSA-N 386.336 5.732 30 20 GKED Fc1ccc(C(F)(F)F)c(-c2noc([C@H](C[C@H]3CCCO3)C(F)(F)F)n2)c1 650535538 YALLXGNQVVVZCO-SKDRFNHKSA-N 398.278 5.110 30 20 GKED N#Cc1ccc(NC(=S)N(Cc2ccc3ccccc3c2)C2CC2)cc1Cl 726475502 BBLZAEWXQHZKOT-UHFFFAOYSA-N 391.927 5.726 30 20 GKED CC(C)n1ncc2cc(/C=C\C(=O)c3cn(C)c4ccccc34)c(Cl)nc21 726740531 IXOZQOABLKJOCS-HJWRWDBZSA-N 378.863 5.053 30 20 GKED C/C(=C\C(=O)[C@@H](C#N)c1nc2cc(Cl)ccc2s1)c1ccccc1Cl 727629036 QPUFAQTUXKHUEV-BMGYJQCNSA-N 387.291 5.883 30 20 GKED CCc1ccc([C@H](C)C(=O)[C@H](C#N)C(=O)Nc2ccc(Cl)cc2Cl)cc1 727953876 IAECSIIJROKXEB-LRDDRELGSA-N 389.282 5.007 30 20 GKED CC(C)Sc1ccc(C(=O)/C=C/c2ccc(N3CCOCC3)c(F)c2)cc1 728441993 SHQFRPQVMCXJBG-ONNFQVAWSA-N 385.504 5.059 30 20 GKED Cc1ccccc1OCCCNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1 729552501 HBXGGUUHDPTLAB-QHCPKHFHSA-N 399.494 5.241 30 20 GKED COc1ccc(C2(NC(=O)Nc3ccc([C@H](C#N)c4ccccc4)cc3)CC2)cc1 731752558 JNLQXDFQUSLQOO-HSZRJFAPSA-N 397.478 5.161 30 20 GKED N#CCOc1ccccc1C(=O)N[C@H](c1ccccc1)c1cccc2ccccc12 732016589 VOBOFDWRUYIDHB-RUZDIDTESA-N 392.458 5.262 30 20 GKED CCc1nc([C@@H](C)NC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cs1 732417819 KPRUEGLPSDTFKK-BEFAXECRSA-N 390.512 5.244 30 20 GKED CC[C@@H](C#N)Oc1cc(CNc2ccc(C(F)(F)F)c(Cl)n2)ccc1OC 733303144 GYKXMIDRIXXAGX-LBPRGKRZSA-N 399.800 5.055 30 20 GKED Cc1cccc(/C=C2\CC(O)(C(F)(F)F)C/C(=C\c3cccc(C)c3)C2=O)c1 735792960 OTKGUZPXVQRVJP-AYKLPDECSA-N 386.413 5.427 30 20 GKED CC(C)c1ccc([C@H](C)CC(=O)[C@H](C#N)c2nc3ccccc3n2C(F)F)cc1 739156237 LRODLDQOSZKATB-QAPCUYQASA-N 395.453 5.925 30 20 GKED C[C@@H](CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)c1ccccc1F 739599406 MADCTVYFZVFCNV-HNNXBMFYSA-N 378.472 5.236 30 20 GKED C[C@H](N[C@@H](C)c1cccc(C#N)c1)C(=O)Nc1ccc(Oc2ccccc2)cc1 743490547 HUOPQLXSQBYABQ-ROUUACIJSA-N 385.467 5.028 30 20 GKED O=C(/C=C/c1ccc(OCc2ccncc2)cc1)c1ccc(-c2ccncc2)cc1 745990537 SUBWFOMPMSNAPL-XCVCLJGOSA-N 392.458 5.619 30 20 GKED Cc1cc(C(=O)[C@@H](C#N)c2nc(C(C)C)cs2)c(C)n1[C@@H](C)c1ccccc1 747198499 XYFPKISPSGNDOQ-OXJNMPFZSA-N 391.540 5.784 30 20 GKED CC(C)c1csc([C@H](C#N)C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)n1 747198674 JUKFGZCTTMQSEY-HZSPNIEDSA-N 379.312 5.553 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1ccc(C2SCCCS2)cc1 748326560 DZUUGZYIAKGVFU-UHFFFAOYSA-N 397.569 5.501 30 20 GKED O=C(/C=C/c1ccc(-c2ccccc2F)s1)c1ccc(N2CCOC2=O)cc1 748583752 FHXDPLHZYJLAES-PKNBQFBNSA-N 393.439 5.407 30 20 GKED C#CCCCCCC(=O)N1CC[C@H](c2ccccc2)[C@H]1c1cccc(OC)c1 752913188 ATPKZEKOBXWJDN-ILBGXUMGSA-N 375.512 5.336 30 20 GKED COC1CCC(CCNC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)CC1 755754777 BBHMZHKPEDGMBD-UWFXLKAESA-N 391.515 5.059 30 20 GKED N#CC1CCC(COC(=O)CCCC(=O)c2ccc(Cl)c(Cl)c2)CC1 755969433 MKNKJGOGXAJJEH-UHFFFAOYSA-N 382.287 5.220 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)c(-c2cccs2)n1 768319331 MPDHQKGPVJZMRY-IBGZPJMESA-N 398.491 5.056 30 20 GKED CC(C)NC(=O)Nc1ccc(C(=O)/C=C/c2cccc(-c3cccnc3)c2)cc1 768491778 FRLYOLISNGIVHG-MDWZMJQESA-N 385.467 5.175 30 20 GKED CC[C@@H](C#N)Oc1cccc(CN[C@H](C)c2sccc2Br)c1 772985737 XSVRIBFGURBZOH-OCCSQVGLSA-N 379.323 5.042 30 20 GKED C#CC[C@@H](N[C@H](C)c1ccc(OC(F)F)cc1OC(F)F)c1ccccc1 773117245 USZDIZSOAQCIEZ-CXAGYDPISA-N 381.369 5.305 30 20 GKED O=C(/C=C/c1ccc(-c2cccc(F)c2F)o1)c1cccc(N2CCOC2=O)c1 790218100 GCNGESJYXPIZOQ-VQHVLOKHSA-N 395.361 5.078 30 20 GKED N#C[C@H](C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1cnc2ccccc2n1 792099458 BJEFTQMKZUDRKS-CKDFRHGISA-N 399.450 5.387 30 20 GKED COc1ccc(C(=O)Nc2cccc(/C=C/C(=O)c3cc(C)c(C)o3)c2)cc1 799896148 GSWUBWDXGTVMEB-KPKJPENVSA-N 375.424 5.053 30 20 GKED N#CCCCCCC(=O)[C@H](C#N)c1nc(-c2ccc(Cl)cc2Cl)cs1 805857071 MEFRTYGLAVZAFA-AWEZNQCLSA-N 392.311 5.767 30 20 GKED O=C1/C(=C/c2ccc(-c3cccc(F)c3F)o2)C[C@@H](C(=O)O)c2ccccc21 806560434 LXUJDUVVSDDJPF-DPCFLFMUSA-N 380.346 5.063 30 20 GKED CC(C)Oc1cccc([C@@H](OC(=O)C[C@@H](CC#N)c2ccccc2)C(F)F)c1 810804478 COOWRUJVWJOQBI-DYESRHJHSA-N 387.426 5.411 30 20 GKED N#Cc1ccc(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)cc1[N+](=O)[O-] 811718352 FDWGYMIBBXSWEE-UHFFFAOYSA-N 384.347 5.032 30 20 GKED CCN(C(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-])c1ccc(C#N)c(Cl)c1 813088532 VGXUIZNKOGLNBK-UHFFFAOYSA-N 398.633 5.093 30 20 GKED C[C@H](NCc1ccnc(Br)c1)c1ccc(-c2cccc(C#N)c2)cc1 815092301 YTIOZDVGGSNMLJ-HNNXBMFYSA-N 392.300 5.234 30 20 GKED CC(C)(C(=O)OCC1CCC(C#N)CC1)c1csc(-c2ccccc2F)n1 816046099 KNZQMIPPXRCCFF-UHFFFAOYSA-N 386.492 5.100 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1[C@H]2CC[C@H]1CC(c1cnn(C)c1)C2 879352466 SKQDFCQPWSWKSW-SFTDATJTSA-N 392.547 5.215 30 20 GKED CC(C)Sc1ccccc1C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 915180232 MGUBKPVWDTWRGD-JOCHJYFZSA-N 386.520 6.095 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC2(c3ccccc3)CCC2)cc1 915352760 KAYIGWYJBCVAGW-DEOSSOPVSA-N 395.506 5.585 30 20 GKED CC(C)Oc1ccc(CNC(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)cc1 915353846 QYPOLEBTWWLCCA-DEOSSOPVSA-N 399.494 5.451 30 20 GKED CCCOc1c(Cl)cc(/C=C/C(=O)c2ccc(OC)cc2F)cc1OC 916549570 SHGMJQFNMFMVMO-VMPITWQZSA-N 378.827 5.181 30 20 GKED CC(C)COC1CCN(C(=O)Nc2ccc([C@@H](C#N)c3ccccc3)cc2)CC1 918034554 SHLHBYIQHUYMHN-QHCPKHFHSA-N 391.515 5.011 30 20 GKED CCCC[C@@H](CC)COc1ccc(C(=O)/C=C\c2cncc(C(=O)O)c2)cc1 1776125712 QVQLHGGDJMKFFI-UUKWBXHYSA-N 381.472 5.271 30 20 GKED O=C(O)CCOc1cccc(/C=C/C(=O)c2ccc(Oc3ccccc3)cc2)c1 1776126295 INUZIAWVBXOXMP-NTEUORMPSA-N 388.419 5.229 30 20 GKED C=CCCC1(C(=O)O)CCN([C@H](C)c2ccc(Oc3ccccc3)cc2)CC1 1776168112 WHFJQAOSMJGTHC-LJQANCHMSA-N 379.500 5.673 30 20 GKED CCCCCCCOc1cccc(CN[C@H](CCCCCCC)CC(=O)O)c1 1776787912 FIKRBLKYSMYIGL-JOCHJYFZSA-N 391.596 6.329 30 20 GKED Cc1ccccc1COc1ccc(C(=O)/C=C\c2cc(C(=O)O)ccc2F)cc1 1777472288 JIRGCKOIVWBNDY-LCYFTJDESA-N 390.410 5.307 30 20 GKED Cc1ccc(Oc2ccccc2NC(=O)COc2ccc(C#N)cc2Cl)cc1 11157687 WPDMAZCFCDZFEI-UHFFFAOYSA-N 392.842 5.330 30 20 GKED Cc1sc(NC(=O)COc2cc(Cl)c(Cl)cc2Cl)c(C#N)c1C 14596013 VCYUSLIYKXTMEZ-UHFFFAOYSA-N 389.691 5.214 30 20 GKED CCCN/C(S)=C(/C(=O)c1ccc(C(C)C)cc1)[n+]1ccc(C(C)(C)C)cc1 22805302 ZHQAUVCUBIYKRE-UHFFFAOYSA-O 397.608 5.333 30 20 GKED C[C@H](NC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1ccc(C#N)cc1 26114593 SJZJQIQJBUGOQW-KRWDZBQOSA-N 396.446 5.374 30 20 GKED N#Cc1ccc(CSc2ccccc2C(=O)NCc2cc(F)cc(F)c2)cc1 30500877 SYBRRNSPVPHJCV-UHFFFAOYSA-N 394.446 5.059 30 20 GKED Cc1nc(Cc2ccccc2)sc1/C(O)=N/c1nnc(C2CCCCC2)s1 30562006 NDGDXAFQAFXZGD-UHFFFAOYSA-N 398.557 5.578 30 20 GKED C[C@H](Cc1cccs1)NC(=O)c1ccccc1Sc1ccccc1C#N 33205974 UEABIRXHAASKHP-OAHLLOKOSA-N 378.522 5.132 30 20 GKED C[C@@H](NC(=O)Nc1ccccc1COc1ccc(CC#N)cc1)c1ccccc1 48161358 DIXSIXLRCVPOOL-GOSISDBHSA-N 385.467 5.214 30 20 GKED O=C(/C=C/c1ccc(OCc2ccccc2)cc1)c1cccc(N2CCOC2=O)c1 60097717 UJXIJEDODUXMQV-SDNWHVSQSA-N 399.446 5.118 30 20 GKED N#Cc1cccc(COc2cccc(CNCc3csc4ccccc34)c2)c1 61047722 WBYVFALIWHAFKX-UHFFFAOYSA-N 384.504 5.642 30 20 GKED Cn1cc(C(=O)Nc2ccccc2COc2ccc(CC#N)cc2)c2ccccc21 65654702 DOXHJWKFCRLCMU-UHFFFAOYSA-N 395.462 5.076 30 20 GKED Cc1nc(C(C)C)sc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 66544639 LIVNLYFXKCDZCY-OAHLLOKOSA-N 392.509 5.060 30 20 GKED C=CCN(C(=O)c1cc(-c2ccco2)nc2c1cnn2C(C)C)c1ccccc1 71846395 LJGUNWYNEXFWCF-UHFFFAOYSA-N 386.455 5.105 30 20 GKED C=CCN(Cc1cccs1)C(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1 107340597 ZOSSRCUMJPSSQW-HNNXBMFYSA-N 383.542 5.330 30 20 GKED COc1ccc([C@@H](C)N(C)C(=O)Nc2ccccc2SC[C@@H](C)C#N)cc1 108533391 GXBZDBIGRLLQKK-JKSUJKDBSA-N 383.517 5.172 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)NC1(c2nccs2)CCCC1 116500596 DPOYESYHHNOWFP-CQSZACIVSA-N 386.546 5.128 30 20 GKED CC(C)(C)c1ccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)s1 123262517 HXDHMEBXNPNPMZ-OAHLLOKOSA-N 391.521 5.531 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)N[C@H]1CCOC2(CCCCC2)C1 124699192 DYHCSNXZRNBPDS-SJORKVTESA-N 387.549 5.084 30 20 GKED Cc1c(NC(=O)N[C@@H](C)c2ccc(C#N)cc2)cccc1C(=O)Nc1ccccc1 154964853 NKBDHPAIJMQCKZ-KRWDZBQOSA-N 398.466 5.002 30 20 GKED CCC(CC)c1cc(CNC(=O)Nc2ccccc2S[C@@H](C)CC#N)on1 173123190 ZPOKCKZKBZVKGK-AWEZNQCLSA-N 386.521 5.294 30 20 GKED CCC(CC)c1cc(CNC(=O)Nc2ccccc2S[C@H](C)CC#N)on1 173123197 ZPOKCKZKBZVKGK-CQSZACIVSA-N 386.521 5.294 30 20 GKED C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)c1ccc(C#N)cc1 173980810 OVQWJLLLTNWDBI-IRXDYDNUSA-N 387.458 5.361 30 20 GKED Cc1ccc(C(=O)Nc2ccc(F)cc2OCC#N)c(Sc2ccccc2)c1 183120642 ZYWYVXDUZYLWCV-UHFFFAOYSA-N 392.455 5.440 30 20 GKED C[C@H](N[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1ccc(C#N)cc1 185019205 PGFGQUGDQPFEGK-IFXJQAMLSA-N 377.488 5.549 30 20 GKED C=CC[C@@H](C(=O)Nc1cccc(CN(C)Cc2cscn2)c1)c1ccccc1 187884973 UBVOMFQWUPYEND-JOCHJYFZSA-N 391.540 5.074 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)Cc1c(C)nn(-c2ccccc2)c1C 189868947 BDAAQDSIVSJHKK-UHFFFAOYSA-N 387.527 5.522 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1cc(OC)ccc1Br 189908748 CTTGQGSAUNDELM-UHFFFAOYSA-N 388.305 5.562 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@@H]1C[C@@H](O)c1ccco1 191447699 LJRHTHXPNQTOGX-UYAOXDASSA-N 382.504 5.252 30 20 GKED C=CCOc1ccccc1C(=O)N[C@@H](C)c1sc(-c2ccccc2)nc1C 195606930 AIWWYIQZXJVXGV-HNNXBMFYSA-N 378.497 5.174 30 20 GKED CCCc1ccc([C@@H](NCc2ccc(O[C@@H](C)C#N)cc2)c2cccs2)cc1 236965052 AVCADWHFUVNHPH-MHECFPHRSA-N 390.552 5.871 30 20 GKED N#CCCCOc1cccc(NCc2cccc(OCc3ccccc3C#N)c2)c1 237827250 HFBVHPCARWCGTM-UHFFFAOYSA-N 397.478 5.432 30 20 GKED C[C@]1(/C(O)=N/[C@@H]2CCCCC[C@H]2c2ccccc2C(F)(F)F)CCC(O)=NC1 328689659 BMBLJACSUCSJPL-VPWXQRGCSA-N 396.453 5.835 30 20 GKED COc1cccc2c1CC[C@@H]2/N=C(/O)[C@@H]1CCn2c(cnc2C2CCCCC2)C1 329423811 GEANGJRKCOYSKY-UTKZUKDTSA-N 393.531 5.146 30 20 GKED COc1ccccc1-c1nnc(S[C@@H]2CC[C@H](C#N)C2)n1-c1ccc(C)cc1 430145833 KAGWQHZHNXJYHJ-FUHWJXTLSA-N 390.512 5.036 30 20 GKED N#CCCC[C@@H](NC(=O)N[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1ccccc1 431313774 QHNIPGVVHVXFDZ-RBZQAINGSA-N 383.495 5.430 30 20 GKED N#CCCC[C@H](NC(=O)N[C@H]1CCCOc2cc(Cl)ccc21)c1ccccc1 431454929 CMPXTYBLDASIGS-PMACEKPBSA-N 397.906 5.288 30 20 GKED N#CCCC[C@H](NCC(=O)Nc1ccccc1Oc1ccccc1)c1ccccc1 433011676 POKZWUASDMTJCB-QFIPXVFZSA-N 399.494 5.442 30 20 GKED N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1Cc1ccccc1 437596189 VPWMLSMSLMPTHA-UKILVPOCSA-N 395.506 5.581 30 20 GKED C[C@H](Nc1ccc(Oc2ccccc2C#N)cc1)c1ncc(-c2ccccc2)o1 439574172 QTGPQZLNHZTNLJ-KRWDZBQOSA-N 381.435 6.179 30 20 GKED C=CCC[C@H](NC(=O)N1CCC[C@@H]1c1ccc[nH]1)c1ccc(C(F)(F)F)cc1 442289178 FQLWXZLEYQDOBX-PKOBYXMFSA-N 391.437 5.588 30 20 GKED N#CC1CCC(CNC(=O)c2ccccc2NCc2ccccc2Cl)CC1 443391932 WXHQHAAUIWGKOX-UHFFFAOYSA-N 381.907 5.012 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=O)N2CC3(CCC3)[C@@H]2c2ccco2)cc1 454573506 VUIBUAKFEWUWCK-QFIPXVFZSA-N 399.450 5.703 30 20 GKED N#Cc1cccc(-c2nnc(COc3c(Cl)cc(Cl)cc3Cl)o2)c1 462560024 SAQJKZBJDFLRKO-UHFFFAOYSA-N 380.618 5.147 30 20 GKED CCCN(CCc1ccccn1)C(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1 464932827 DSMPADOTHNVMGT-UHFFFAOYSA-N 399.494 5.149 30 20 GKED COc1ccccc1-c1ccc([C@H](C)NC(=O)N(C)Cc2ccc(C#N)cc2)cc1 466089632 WIDVHYXVEQTXMX-SFHVURJKSA-N 399.494 5.136 30 20 GKED CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C 466121369 HSSYWFKVFSWEAF-NPFVIJTESA-N 395.934 5.529 30 20 GKED CCSCC[C@H](C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1C 467049345 VHTKHKXPWQVDGP-INIZCTEOSA-N 383.517 5.312 30 20 GKED CCCNc1ccc(C#N)cc1NC(=O)c1cc(Cl)ccc1Br 468842799 FLCIJSKVDJUEGP-UHFFFAOYSA-N 392.684 5.048 30 20 GKED Cc1nc2ccc(C(=O)Nc3ccc(Oc4ccccc4C#N)c(F)c3)cc2o1 470972681 ZIPRJPOVPXRRGA-UHFFFAOYSA-N 387.370 5.192 30 20 GKED C=CCCCCNC(=O)N1CCC[C@@H]1c1nc(-c2ccccc2)c(C(C)C)o1 474099082 XKAPBTAYBNAGFI-LJQANCHMSA-N 381.520 5.668 30 20 GKED CC(C)c1cccc(C(=O)[C@@H](C#N)c2nc(-c3ccc(Cl)cc3)cs2)n1 474821512 LHDOLWRCHOUQNW-OAHLLOKOSA-N 381.888 5.472 30 20 GKED N#Cc1ccc(C[S@@](=O)Cc2ccc(Oc3ccccc3F)c(F)c2)cc1 476894678 XGSXOMFCBWLYCI-HHHXNRCGSA-N 383.419 5.078 30 20 GKED C[C@@H](CNC(=O)Nc1ccc([C@@H](C#N)c2ccccc2)c(Cl)c1)C(F)(F)F 480354657 HKRXMYHDXGBCKE-LRDDRELGSA-N 395.812 5.315 30 20 GKED N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccnc(Oc2ccccc2F)c1 481996665 DVUNJHNJMDLGJY-QFIPXVFZSA-N 387.458 5.442 30 20 GKED COc1cc(Cl)c(Cl)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 484996204 NRGSGXXIAPLYBA-UHFFFAOYSA-N 392.286 5.316 30 20 GKED C=CCN(CC1CCCCC1)C(=O)Nc1ccc(C(=O)N[C@@H](C)CC)cc1C 485247159 RHNVVUHQAFGQLE-SFHVURJKSA-N 385.552 5.124 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)CSC(C)(C)c1ccccc1 485495229 BPNFEGCGMNGQFL-INIZCTEOSA-N 384.570 5.688 30 20 GKED N#CCCC[C@H](NC(=O)c1cnc(-c2ccc(F)c(F)c2)s1)c1ccccc1 487541215 SXHWIRNKTISWHP-SFHVURJKSA-N 397.450 5.253 30 20 GKED C=CCN(CCc1ccco1)C(=O)Nc1ccc(COCc2ccccc2)cc1 492154795 FBEQJYBTQNWYQZ-UHFFFAOYSA-N 390.483 5.259 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1c2cccc(F)c2CC[C@@H]1C 498887677 CZAHLDLWXMKYQA-JTSKRJEESA-N 398.526 5.014 30 20 GKED CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(C#N)cc2)c(C(F)(F)F)c1 499558212 XSGDFTRAJYLHHQ-GFCCVEGCSA-N 378.419 5.720 30 20 GKED N#CCCN(Cc1cccnc1)Cc1ccc(-c2cccc(Cl)c2Cl)o1 505895114 UNEBRTSPCCXVGG-UHFFFAOYSA-N 386.282 5.564 30 20 GKED C=CCN(Cc1ccc(Cl)s1)[C@@H](C)c1nc2ccccc2n1C(F)F 506253292 HYSFJAODKWMPDI-LBPRGKRZSA-N 381.879 5.896 30 20 GKED N#Cc1cccc(OCCCCC(=O)Nc2cccc(Nc3ccccc3)c2)c1 511479538 UPNRYILJRBZPOM-UHFFFAOYSA-N 385.467 5.490 30 20 GKED C=CCN(C(=O)CCc1ccc(OCC)cc1)c1nc(-c2ccccc2)cs1 512394480 FNHRJPMGVFPCFO-UHFFFAOYSA-N 392.524 5.361 30 20 GKED O=C(c1ccc(F)c(C(F)(F)F)c1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 513539355 PYYBHLJSBWDNEM-CYBMUJFWSA-N 383.307 5.039 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 520865597 KOQVZFMEGGEYDT-HBGVWJBISA-N 386.520 5.834 30 20 GKED N#Cc1ccc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)cc1Cl 521119907 HFGMATWTWJKBFX-UHFFFAOYSA-N 398.897 5.736 30 20 GKED C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccccc1SCCC#N 521717534 ZQTAEVSIYBAZGJ-MRXNPFEDSA-N 382.529 5.396 30 20 GKED C[C@H](CC#N)Sc1ccccc1NC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 521801345 ZQQRUNZRDUHHTC-CZAAIQMYSA-N 386.520 5.976 30 20 GKED C[C@@H](NC(=O)N1CCC[C@H]1c1ccccn1)c1ccc(-c2cccc(C#N)c2)cc1 522027035 MJMSIRFHJCRFBT-KOSHJBKYSA-N 396.494 5.228 30 20 GKED N#Cc1cccc(CNc2ccc(C(=O)N3CCC[C@H]3c3ccccc3)cc2)c1 530675031 ZXJNBRKDERSUFH-DEOSSOPVSA-N 381.479 5.148 30 20 GKED N#Cc1ccc(SCC(=O)N[C@H](c2ccccc2)c2cccs2)c(Cl)c1 532844154 MEOYOKDOMMKYAI-HXUWFJFHSA-N 398.940 5.271 30 20 GKED COc1ccc(CN2CCS[C@H](C)[C@H]2c2ccccc2)cc1OCCCC#N 536662064 NFBYYTIGRGWUHK-JPYJTQIMSA-N 396.556 5.056 30 20 GKED Cn1ncc(C(=O)Nc2ccc(Oc3ccccc3C#N)cc2)c1-c1ccccc1 538237441 XPEMVQQKBSSBTG-UHFFFAOYSA-N 394.434 5.003 30 20 GKED N#Cc1cccc(-c2nnc(CN[C@H](CC3CCCCC3)c3ccccc3)o2)c1 539262917 ORHZFBBMODSHOD-JOCHJYFZSA-N 386.499 5.410 30 20 GKED N#Cc1ccc2ncc(CNc3cccc(OCc4ccc(Cl)cc4)c3)n2c1 539932545 XKVJWPYNHDIISE-UHFFFAOYSA-N 388.858 5.050 30 20 GKED C[C@H](NCc1cnn(Cc2ccccc2)c1)c1ccc(-c2cccc(C#N)c2)cc1 543875553 BUYYELXQPLJUBX-FQEVSTJZSA-N 392.506 5.321 30 20 GKED CC(C)c1ccc(NC(=O)C[C@@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 551206106 PPYZCRKUTPSDOA-AUSIDOKSSA-N 377.532 5.552 30 20 GKED CCCN(CC)Cc1ccc(C(=O)[C@H](C#N)c2ncc(C(C)(C)C)s2)cc1 554325974 WEMOVQQHACFLBD-SFHVURJKSA-N 383.561 5.163 30 20 GKED C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)C[C@H](CC#N)c1ccccc1 558001855 JEBGMDGTJHFKHS-AEFFLSMTSA-N 388.433 5.182 30 20 GKED N#CC1CCC(CNC(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)CC1 562514854 SLCCJUHGJSNENM-JFIBYHEFSA-N 387.936 5.120 30 20 GKED N#CCCC1CCN(C(=O)[C@H]2CCCO[C@@H]2c2ccc(Cl)cc2Cl)CC1 579477287 DIUXCIWZVHBOLN-PKOBYXMFSA-N 395.330 5.003 30 20 GKED COc1cc([C@@H](C)NCc2ccc(C3(C#N)CC3)cc2)ccc1OC1CCCC1 594924586 KCAVBTKZEIGFOL-GOSISDBHSA-N 390.527 5.423 30 20 GKED Cc1cccc(-c2nc3cc(F)ccc3n2C(C)C)c1NC(=O)[C@H](C)CC#N 598814939 NHJKVAARJKSDPJ-OAHLLOKOSA-N 378.451 5.220 30 20 GKED Cc1ccc([C@H](C)N(C)C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)cc1 603692405 SZDHXJYDRUKMFR-KRWDZBQOSA-N 386.455 5.279 30 20 GKED CCCN(C(=O)c1cccc(CC#N)c1)[C@H](C)c1ccccc1Br 603962628 LMABBJMDKCOMEY-OAHLLOKOSA-N 385.305 5.129 30 20 GKED Cc1nc2ccccc2c(C)c1CC(=O)Nc1sc(-c2ccccc2)cc1C#N 603969138 GARDNQQTHWOFMP-UHFFFAOYSA-N 397.503 5.633 30 20 GKED Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccccc1SCc1ccc(C#N)cc1 604333721 LKMPKXFLSVHOLZ-HSZRJFAPSA-N 398.531 5.576 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)c2cc(F)c(F)c(F)c2F)c1 605633943 KBHPHZJNPSJSRS-UHFFFAOYSA-N 397.315 5.458 30 20 GKED COc1cccc(C2(C(=O)Nc3ccccc3SC[C@@H](C)C#N)CCCC2)c1 609408354 VKECCTKIJHNQFB-KRWDZBQOSA-N 394.540 5.397 30 20 GKED N#CCc1ccc(Oc2ccc(C(=O)NCc3ccc(Cl)s3)cc2)cc1 609499128 RPFYNIQWLMZEOD-UHFFFAOYSA-N 382.872 5.190 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCS[C@@H](c2ccccc2)C1 609811107 NQBAUKNNLQMNTC-OXJNMPFZSA-N 397.569 5.403 30 20 GKED N#CCCCOc1cccc(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)c1 609987539 JWTAHYYVAMWTHJ-UHFFFAOYSA-N 396.450 5.237 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccccc3NCc3ccccc3)CC2)cc1 611247182 JMWHGOFDNZEAIR-UHFFFAOYSA-N 393.490 5.100 30 20 GKED C=CCOc1ccc(C(=O)[C@@H](C#N)c2nc(-c3c(F)cccc3F)cs2)cc1 620304654 ZUGMXUAFPLKNID-OAHLLOKOSA-N 396.418 5.143 30 20 GKED CCCCCC[C@H](C)CC(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 727955674 MVHJTZOZIAJCCB-QFBILLFUSA-N 379.529 5.855 30 20 GKED C[C@@H](NC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)c1ccc(C#N)cc1 728067906 FFYBZHSTYPEGEI-AUUYWEPGSA-N 387.405 5.185 30 20 GKED N#Cc1ccccc1NC(=S)N(Cc1ccccc1F)c1ccccc1F 729821831 YGQDUSAKWZMGRP-UHFFFAOYSA-N 379.435 5.240 30 20 GKED COc1ccc(OC(F)F)c(/C=C\C(=O)c2ccc(Br)s2)c1 732926223 IRUCBZMKENPQDN-RQOWECAXSA-N 389.217 5.017 30 20 GKED Cc1csc(C(C)(C)NC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)n1 734930644 WLQKPKRIKBASCL-LJQANCHMSA-N 390.512 5.164 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3csc(-c4ccccn4)n3)c2)s1 740013235 AHGYVJWJZITAGM-UHFFFAOYSA-N 388.521 5.095 30 20 GKED N#Cc1cccc(COc2ccc(NCc3csc([N+](=O)[O-])c3)cc2Cl)c1 742261610 NVPQKOHVTPXHCZ-UHFFFAOYSA-N 399.859 5.372 30 20 GKED C[C@H](NC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1cccc(C#N)c1 743777025 NEIRIUANAYTOEF-JECSTDCCSA-N 378.781 5.121 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)[C@H]3SCCc4ccccc43)n2)cc1 744031555 MQGPLJWZEBEZLQ-NQIIRXRSSA-N 390.533 5.325 30 20 GKED CC(=NO[C@H](C)c1nc(-c2ccc(C)c(F)c2)no1)c1cc2ccccc2o1 744444711 ZZXJQPQQUZIDAH-CQSZACIVSA-N 379.391 5.432 30 20 GKED CC(C)n1cc(C(=O)/C=C/c2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)cn1 746686442 DEWHANJHEULTGC-ZRDIBKRKSA-N 390.443 5.036 30 20 GKED CC(C)[C@H]1CC[C@H](C(=O)[C@@H](C#N)c2nc(-c3ccc(C#N)cc3)cs2)CC1 753540644 WWSHWNVAZJGFME-BHIYHBOVSA-N 377.513 5.320 30 20 GKED N#CCc1cccc(C(=O)O[C@@H](c2cccnc2)c2cccc(C(F)(F)F)c2)c1 759587011 DZZHEJBPZPGLBE-HXUWFJFHSA-N 396.368 5.113 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)Cc2ccc(F)cc2Cl)cc1 767871059 YGGQPKPGSQJVCH-FQEVSTJZSA-N 378.834 5.316 30 20 GKED O=C(/C=C/c1nccc2ccccc12)c1ccc(OC[C@H]2CCCCO2)c(F)c1 771097789 KWVNRWXAJDYAMZ-JBVUFVISSA-N 391.442 5.218 30 20 GKED C[C@H](C#N)Oc1ccccc1NC(=O)Nc1ccccc1SC(F)(F)F 780505179 HPYVCUDOUSQIBB-LLVKDONJSA-N 381.379 5.233 30 20 GKED C=C[C@@H](CC(=O)OCc1nnc(-c2cc(C)c(CC)s2)o1)c1ccccc1 784402591 LNRCCPHPVNEVBY-HNNXBMFYSA-N 382.485 5.072 30 20 GKED CC(C)(C)CC(=NNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)C1CC1 787157481 IQGYDGWFLJUQKI-UHFFFAOYSA-N 377.414 5.172 30 20 GKED C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)[C@@H](C#N)c1nccc2ccccc12 792101197 FUDZNPLOCQEBKK-LRDDRELGSA-N 385.250 5.185 30 20 GKED C[C@@H](C(=O)[C@@H](C#N)c1ncc(C(C)(C)C)s1)c1c(Cl)cccc1Cl 797572764 IBTSYDCKTFZBRB-GHMZBOCLSA-N 381.328 5.727 30 20 GKED Cc1cccc2cc(C(=O)Nc3ccccc3SCCC#N)c(Cl)nc12 813398957 GJZWNEHLYLSTMN-UHFFFAOYSA-N 381.888 5.455 30 20 GKED CC[C@@H](CC(F)(F)F)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 835110042 MIEIWIZHVBJYKR-VHSXEESVSA-N 388.361 5.243 30 20 GKED O[C@H]1CCc2cc(-c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3)cnc21 854203550 QKPWRMYWYLSGGY-ZDUSSCGKSA-N 379.275 5.018 30 20 GKED Cc1ccc(CO[C@H](C)C(=O)[C@@H](C#N)c2nc3cc(Cl)ccc3s2)cc1 860479068 IPCHZCUQSAKTMA-CZUORRHYSA-N 384.888 5.040 30 20 GKED CCN(C(=O)/C=C\c1ccc2ccc(Cl)cc2n1)[C@H](C)c1ccc(C#N)cc1 914509700 XZQKBMRGRYNIMQ-BFFYNSAMSA-N 389.886 5.383 30 20 GKED Oc1ccc2ccccc2c1/C=N\C1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 914703224 RSGPFNJTPCPAIM-CUQZYKJISA-N 389.339 5.874 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 915085502 CCLSUJBXLDNYMT-FQEVSTJZSA-N 391.268 5.357 30 20 GKED N#C[C@H](c1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2c2cccnc2)cc1 915351965 FAOAQWZMCCAXPM-PKTZIBPZSA-N 382.467 5.106 30 20 GKED CCCC[C@H](CC)CNC(=S)Nc1ccccc1Oc1ncccc1C#N 916000205 GNCAZKAULNDQOD-INIZCTEOSA-N 382.533 5.248 30 20 GKED O=C(/C=C/c1c(Cl)nc2sccn12)c1ccc(N2CCCCC2)c(F)c1 916128933 KNGSCDZMBHOOGE-VOTSOKGWSA-N 389.883 5.075 30 20 GKED N#C[C@H](C(=O)CCCc1ccc(Cl)cc1)C(=O)Nc1cccc2ccccc12 916918459 MPVJEIJQUHSBJX-HXUWFJFHSA-N 390.870 5.163 30 20 GKED CC(C)CN(CCC#N)C(=O)c1ccc(COc2ccc3ccccc3c2)o1 917363466 KOSBUJFXRPTPHL-UHFFFAOYSA-N 376.456 5.024 30 20 GKED CCc1cc(C#N)c(NC(=O)Cc2csc(-c3ccc(C(C)C)cc3)n2)s1 917880548 KNWIYRLQKPYKNV-UHFFFAOYSA-N 395.553 5.610 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCc2cc(F)ccc2F)cc1 919713842 ISIDWLHWHCJJCC-NRFANRHFSA-N 376.406 5.192 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C/C(=O)c3ccccc3Cl)cc2)c1 1776115029 KFIAKFZLUYQQFC-JLHYYAGUSA-N 376.839 5.530 30 20 GKED C=CCCC[C@@H](NCc1cc(F)ccc1Oc1ccc(SC)cc1)C(=O)O 1776170687 AZUKYDHRJKTBIF-LJQANCHMSA-N 389.492 5.239 30 20 GKED CC(C)Sc1cccc(Cl)c1/C=C1/CCc2ncc(C(=O)O)cc2C1=O 1776365029 KMPRNGJFBHWMHH-WQLSENKSSA-N 387.888 5.146 30 20 GKED CC(C)c1nn(-c2ccccc2)c(Cl)c1/C=C\C(=O)c1cccc(C(=O)O)c1 1776385228 LYSUQYLCSWILAD-QXMHVHEDSA-N 394.858 5.243 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1ccc(-c2ccccc2Cl)s1 1776782767 HAXWTOMWOHBQOI-INIZCTEOSA-N 393.980 6.362 30 20 GKED CCCCCCC[C@@H](CC(=O)O)NCc1cccc(C(F)(F)C(F)(F)F)c1 1776784776 URFBYPRMDAMINR-INIZCTEOSA-N 395.412 5.634 30 20 GKED Cc1ccc(-c2ncc(/C=C\C(=O)c3cc(C(=O)O)ccc3OC(C)C)s2)o1 1777431413 CVVTZYYHJZHNHE-SREVYHEPSA-N 397.452 5.093 30 20 GKED C=CC[C@H](C)C(=O)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791254574 TYBUITANKAUNHN-ZGXWSNOMSA-N 394.559 5.159 30 20 GKED C=C1CC(C(=O)NC2(c3ccc(NC(=O)C4(C)CCCCC4)cc3)CCC2)C1 1791532913 UGDFAHNOMHVXQT-UHFFFAOYSA-N 380.532 5.057 30 20 GKED C[C@@H](C#N)OC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(Cl)cc1)CC2 4549109 AXUDSZCBQDNAIR-AOHITCTBSA-N 388.854 5.444 30 20 GKED C=CCOc1ccc(/C=C/C(=O)Nc2ccccc2SC(F)F)cc1OC 15322574 HCTOVTLIJOAUNN-PKNBQFBNSA-N 391.439 5.227 30 20 GKED Cc1nc(-c2ccc(N[C@H](C)C(=O)Nc3ccc(C#N)c(Cl)c3)cc2)cs1 28912666 SQXOGCQVYRTOBK-GFCCVEGCSA-N 396.903 5.083 30 20 GKED C[C@@H](CC#N)Sc1ccccc1NC(=O)N(C)Cc1ccc(F)cc1F 66956341 PSKXDUZLOWPLPE-ZDUSSCGKSA-N 375.444 5.023 30 20 GKED CCCN(CC(=O)Nc1c(C(C)C)cccc1C(C)C)Cc1ccc(C#N)cc1 107701001 BQRKFMQMSOPRTO-UHFFFAOYSA-N 391.559 5.656 30 20 GKED CN(Cc1ccc(Cl)nc1)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 109027819 GZQHHBDFXCGBOV-UHFFFAOYSA-N 392.846 5.063 30 20 GKED N#C[C@H](C(=O)CCCc1cc(Cl)sc1Cl)c1nc2ccccc2[nH]1 119837120 KFQACIJUMSNCEL-LLVKDONJSA-N 378.284 5.130 30 20 GKED C=CCN(Cc1ccccc1F)C(=O)Nc1cc(-c2nc(C)co2)ccc1C 120997956 JFQZIANUPHXEOA-UHFFFAOYSA-N 379.435 5.318 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Nc1ccccc1OCC(F)F 137445925 XIXXACWVPAZDAZ-CYBMUJFWSA-N 391.443 5.226 30 20 GKED Cc1ccc2oc(CN(Cc3ccco3)C(=O)NCc3ccc(C#N)cc3)cc2c1 153681227 FETYJYNRUJMROK-UHFFFAOYSA-N 399.450 5.118 30 20 GKED N#CCC[C@@H](NC(=O)N1CCCC[C@@H]1c1cc2ccccc2[nH]1)c1ccccc1 160560117 BQGZDFCUPQWCAE-NFBKMPQASA-N 386.499 5.450 30 20 GKED Cc1ccccc1[C@@H]1CCCN1CC(=O)Nc1ccccc1SC[C@@H](C)C#N 170984862 GOEYIMSOWBIDCL-UWJYYQICSA-N 393.556 5.022 30 20 GKED N#CCCCCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 171503176 VCIIOEJDAAMNNN-MSUUIHNZSA-N 385.467 5.128 30 20 GKED Cc1cc(C(=O)Nc2ccc(C(C)(C)C#N)cc2)ccc1NC(=O)CC(C)C 172760326 ZWWRHRNQZANYCI-UHFFFAOYSA-N 377.488 5.033 30 20 GKED Cc1sc([C@@H](C)NC(=O)Cc2ccc(C#N)cc2)nc1-c1ccc(Cl)cc1 176242729 CSUBFCQARSFSAL-CYBMUJFWSA-N 395.915 5.064 30 20 GKED Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(C2(C#N)CC2)cc1 179727119 ALHXYQQPUTZUHK-UHFFFAOYSA-N 395.462 5.055 30 20 GKED Cc1cnc([C@H](C)CNC(=O)Nc2ccc(Oc3cccc(C#N)c3)cc2)s1 185220561 CNQSCGPTIAWRJP-CQSZACIVSA-N 392.484 5.041 30 20 GKED C[C@@H](CCNCc1ccc(O[C@H](C)C#N)cc1)c1cccc(C(F)(F)F)c1 237566814 HNGSADOEAXTBCA-JKSUJKDBSA-N 376.422 5.280 30 20 GKED C[C@H](Nc1nc(C(F)(F)F)ccc1C#N)c1ccc(OCc2cccnc2)cc1 301247950 BFKIVJTXCVOAFV-AWEZNQCLSA-N 398.388 5.119 30 20 GKED CCCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 303429284 FJNNXHQZGKYDPY-WOJBJXKFSA-N 386.417 5.119 30 20 GKED N#CCOc1ccc(CC(=O)Nc2ccc(Oc3ccccc3Cl)cc2)cc1 303502225 RRQGKULNAWTLJG-UHFFFAOYSA-N 392.842 5.216 30 20 GKED O=C1CC[C@@H](/C(O)=N/C2(c3ccc(Cl)cc3)CCOCC2)c2ccccc21 328874823 RUGJEHRJJNBWNZ-LJQANCHMSA-N 383.875 5.063 30 20 GKED N=C(O)[C@@H]1CCCN1Cc1cccc(N=C(O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)c1 328975072 BFEZBCSMZBBGTL-WJMWBRGCSA-N 383.536 5.381 30 20 GKED CC(C)c1ncc(Cl)c(C(=O)Nc2sc3c(c2C#N)[C@H](C)C[C@@H](C)C3)n1 411011729 MFTMWWCNVQTQGK-GHMZBOCLSA-N 388.924 5.125 30 20 GKED C[C@H](c1ccc(Oc2ccccc2)cc1)S(=O)(=O)CCCCC(C)(C)C#N 414432059 YWBMCTHGEUCYLX-GOSISDBHSA-N 385.529 5.675 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N(C1CC1)[C@@H](C)C(=O)OC(C)(C)C 417043290 OSSVNTLJWYBIED-INIZCTEOSA-N 386.536 5.265 30 20 GKED C=C(C)[C@@H](NC(=O)N[C@@H](CCCC#N)c1ccccc1)c1ccc(F)c(F)c1 431465546 OOXBUWWPFOPYEK-LEWJYISDSA-N 383.442 5.316 30 20 GKED CC(C)Sc1ccc([C@H](C)NC(=O)N[C@H](CCCC#N)c2ccccc2)cc1 431931052 MBDWECSXBNUELD-PGRDOPGGSA-N 395.572 5.982 30 20 GKED N#CCCn1cc(/C=C\c2nc3cc(Cl)ccc3s2)c(-c2ccncc2)n1 432701137 XDUASTCRJPEMBU-DJWKRKHSSA-N 391.887 5.292 30 20 GKED CN(CC(C)(C)C#N)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)cc1 432967920 SEEMVVQFGPASSV-UHFFFAOYSA-N 391.393 5.511 30 20 GKED COc1ccc(C#N)cc1CNc1ccc(Oc2cccc(C(F)(F)F)n2)cc1 434884355 ZWOGKTGFMRJTKE-UHFFFAOYSA-N 399.372 5.385 30 20 GKED Fc1ccc(F)c(CN[C@@H](CC(F)(F)F)c2ccc(C(F)(F)F)cc2)c1 436406545 IKYSGGXIWFHWGV-HNNXBMFYSA-N 383.282 5.767 30 20 GKED CC[C@H]1CN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CCCO1 439353428 PXMGRFZLHMCZDM-AZUAARDMSA-N 397.906 5.028 30 20 GKED Cc1cc(NC(=O)N[C@H](CCC#N)c2ccccc2)ccc1OCC(F)(F)F 439396935 PRVGTUBZBUAMRA-QGZVFWFLSA-N 391.393 5.103 30 20 GKED C[C@H](N[C@@H]1CCC[C@H](c2ccnn2C)C1)c1ccc(-c2cccc(C#N)c2)cc1 448024556 ZAFUCOHJBPCMBL-GKVQRAMASA-N 384.527 5.336 30 20 GKED CCN(C(=O)N[C@H](CCCC#N)c1ccccc1)[C@@H](C)Cc1ccc(OC)cc1 458827373 DDFYXUUADPNWBS-WMZHIEFXSA-N 393.531 5.093 30 20 GKED COc1ccc([C@@H](NCc2ccc(C#N)cc2)c2ccccc2Cl)c(C)c1 462173703 DHMQUHSQSKCWLB-HSZRJFAPSA-N 376.887 5.408 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)CCc1cncc2ccccc12 462489240 CORRHPUKEWXTNH-MRXNPFEDSA-N 375.497 5.058 30 20 GKED C=C(C)C[C@@H](C)C(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)cs1 466545126 MKHUTHPCLALXHK-OLZOCXBDSA-N 393.350 5.352 30 20 GKED C[C@H](NC(=O)C[C@@H](CC#N)c1ccccc1)C(c1ccccc1)c1ccccc1 474791210 QXXKJIXBLPQHRI-GBXCKJPGSA-N 382.507 5.411 30 20 GKED N#C[C@@H](C(=O)c1ccc(-c2ccccc2C(F)(F)F)o1)c1nc2ccccc2o1 474949437 DHQJPOIHROJNJD-ZDUSSCGKSA-N 396.324 5.597 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)NC[C@@H](c1ccco1)N1CCCCC1 475556420 QQKSFXRWPQTXDC-NRFANRHFSA-N 395.547 5.480 30 20 GKED COc1cc(C#N)ccc1Oc1ccc(NC(=O)CC(C)(C)C(F)(F)F)cc1 479944882 ZIQCBOLPZCWCEL-UHFFFAOYSA-N 392.377 5.276 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1cc(Cl)cc(F)c1F 484487509 KPBAXZYTAOFSOG-UHFFFAOYSA-N 382.842 5.006 30 20 GKED Cc1cccc(NC(=O)c2cn(CCCC#N)c3ccccc23)c1Br 487193810 BULQUUGBSFSCIM-UHFFFAOYSA-N 396.288 5.268 30 20 GKED Cc1cc(NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)c(Cl)cc1F 487344925 KTTHOLIQCBXJIP-UHFFFAOYSA-N 392.702 5.136 30 20 GKED CCOc1ccc(CC(=O)Nc2ccc(Oc3ccc(C#N)cc3)cc2C)cc1 500754314 MXLJGOIQSPGYNK-UHFFFAOYSA-N 386.451 5.239 30 20 GKED N#Cc1ccc(C2=CCN(C(=O)c3ccc(OC4CCC4)cc3Cl)CC2)cc1 503902285 RCIUKJLEHRKCAW-UHFFFAOYSA-N 392.886 5.072 30 20 GKED O=C(CCCC(F)(F)F)N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F 505401800 FNLTXUYPGFVOHL-LLVKDONJSA-N 381.238 5.158 30 20 GKED CCOc1ccc(C#N)cc1NC(=O)N1CCCCC[C@H]1c1ccc(OC)cc1 510859189 HTWGFJTXUVCWPY-NRFANRHFSA-N 393.487 5.115 30 20 GKED Cc1oc(-c2ccccc2)nc1C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1 518234140 XRQDQANVQZIVQO-UHFFFAOYSA-N 395.418 5.566 30 20 GKED CCOc1cccc2cc([C@@H](C)Nc3nc(C(F)(F)F)ccc3C#N)oc12 522408606 HVFJIBOEBPLAGX-LLVKDONJSA-N 375.350 5.290 30 20 GKED CN(C(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1)C(C1CC1)C1CC1 522633228 IIRSUWSCISTNTM-UHFFFAOYSA-N 380.875 5.265 30 20 GKED CN(C(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1)c1ccccc1F 523958102 LHHAMKFHIVAHAF-UHFFFAOYSA-N 380.806 5.420 30 20 GKED C=CCCOCCCCC(=O)Nc1ccccc1-c1nc2ccccc2s1 538265994 LEAGIIOIMCLCOK-UHFFFAOYSA-N 380.513 5.665 30 20 GKED CC(C)C[C@H](NC(=O)N1CCC(CC#N)CC1)c1cccc(C(F)(F)F)c1 542894932 IIJPTGRAUVGBRW-SFHVURJKSA-N 381.442 5.128 30 20 GKED C[C@H](NC(=O)CCC(=O)c1cccs1)c1ccc(-c2cccc(C#N)c2)cc1 543918959 RWKIHPMRPRUVKQ-INIZCTEOSA-N 388.492 5.127 30 20 GKED CC(C)c1ccc(NC(=O)C[C@H](C)N[C@H](CCCC#N)c2ccccc2)cc1 551206108 PPYZCRKUTPSDOA-WMZHIEFXSA-N 377.532 5.552 30 20 GKED C[C@H](NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)c1ccc2n[nH]cc2c1 558345833 ZKUJVTJMNAISAM-HNNXBMFYSA-N 397.438 5.110 30 20 GKED CCOc1ccc(-n2c(S[C@@H](C)CCC#N)nnc2-c2cccs2)cc1 559996825 MCXZPDPPSKIGSQ-AWEZNQCLSA-N 384.530 5.179 30 20 GKED N#CC[C@H](CC(=O)N1CCC(c2c[nH]c3ccc(F)cc23)CC1)c1ccccc1 561718118 VVKWZJKSKQTBRF-LJQANCHMSA-N 389.474 5.101 30 20 GKED CC(C)c1oc([C@H]2CCCN2c2ncc(C#N)cc2F)nc1-c1ccccc1 566665340 NITQBGJIKHGLBW-GOSISDBHSA-N 376.435 5.212 30 20 GKED N#CCCn1cc(CNCCCCc2ccc(Cl)s2)c(-c2ccccc2)n1 572065801 WPCTVLWVGRKQNB-UHFFFAOYSA-N 398.963 5.291 30 20 GKED C=CCn1c(C2CCCC2)nnc1N1CCC[C@H]1c1nc2ccccc2s1 576620008 KEAXNOIYHGBKBE-KRWDZBQOSA-N 379.533 5.073 30 20 GKED Cc1c(C(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)sc2ccc(C#N)cc12 589985253 MVPBYRXJCWLEBO-UONOGXRCSA-N 380.435 5.180 30 20 GKED Cc1c([C@H](C)N[C@@H](CCCC#N)c2ccccc2)nnn1-c1ccc(Cl)cc1 590257342 NEJKHWVEUAGMOG-KKSFZXQISA-N 393.922 5.315 30 20 GKED N#Cc1ccsc1NC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 591312162 MHSYDPLFKHOSJO-UHFFFAOYSA-N 389.455 5.478 30 20 GKED CCc1cc(C#N)c(NC(=O)c2ccc(-c3nc4ccccc4s3)s2)s1 604030274 OAHKXTMUJKKZBS-UHFFFAOYSA-N 395.534 5.773 30 20 GKED COc1ccc(CSc2nnc(S[C@@H](C#N)Cc3ccccc3)s2)cc1 604041557 HHIXSOLWXXRNTO-QGZVFWFLSA-N 399.566 5.066 30 20 GKED C=CCN(C(=O)C1CC=CC1)c1nc(-c2ccc(Cl)c(Cl)c2)cs1 607059790 GAUBXMAZSHKDSG-UHFFFAOYSA-N 379.312 5.602 30 20 GKED Cc1nc(-c2ccc(NC(=O)N(Cc3ccc(C#N)cc3)C(C)C)cc2)oc1C 609042611 OYCIXJHUJIQLOP-UHFFFAOYSA-N 388.471 5.273 30 20 GKED CC(C)CN(Cc1ccccc1)C(=O)c1ccc(COc2ccc(C#N)cc2)o1 609056328 HCYBJBRWJDORMT-UHFFFAOYSA-N 388.467 5.029 30 20 GKED C[C@@H](NC(=O)Nc1cc(Cl)ccc1N1CCCCC1)c1cccc(C#N)c1 610317764 QXJZSRVUUCMNNP-OAHLLOKOSA-N 382.895 5.085 30 20 GKED N#CCn1c(C(=O)N2CCCCC[C@H]2/C=C/c2ccccc2)cc2ccccc21 610655091 SHQMGYDLASSRRR-FRFYRWIFSA-N 383.495 5.263 30 20 GKED N#Cc1cc2c(nc1NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)CCCC2 611227007 QUKKZAVWYKQZAW-STQMWFEESA-N 391.359 5.153 30 20 GKED COc1cc(Br)ccc1[C@@H](C)NCc1ccc(C(C)(C)C#N)cc1 615811497 NZXLKNXIYZEZCG-CQSZACIVSA-N 387.321 5.110 30 20 GKED COc1ccc(CNc2ccc(C(F)(C(F)(F)F)C(F)(F)F)cc2)cc1O 647229675 LWPSGYDDLUSIOG-UHFFFAOYSA-N 397.290 5.302 30 20 GKED Cc1ncc(/C=C/C(=O)N(Cc2cccc(C#N)c2)c2ccc(F)cc2C)s1 732730246 QQALZMHJEOAFFK-VQHVLOKHSA-N 391.471 5.017 30 20 GKED CC(C)(Oc1cccc(Cl)c1)C(=O)[C@@H](C#N)c1nc2cc(F)ccc2s1 733053740 MTDIODJDDYRFED-CQSZACIVSA-N 388.851 5.123 30 20 GKED CC(CCc1cccc(C)c1)=NNc1cc(C(F)(F)F)nc(-c2ccccn2)n1 733081393 XGKHYRWGJRKPKV-UHFFFAOYSA-N 399.420 5.286 30 20 GKED CC(C)(Cc1ccccc1)C(=O)[C@@H](C#N)c1nc(-c2c(F)cccc2F)cs1 735595999 KMCOSUCHMOMQFJ-OAHLLOKOSA-N 396.462 5.533 30 20 GKED Cc1c(C#N)c(NC(=O)CS[C@H](C)c2cccs2)n(C2CCCC2)c1C 737405368 NIWFHFJOAFXRPB-OAHLLOKOSA-N 387.574 5.586 30 20 GKED CC[C@@H](c1ccncc1)N(CC)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1 740435550 PVFSWQSVIQHLEF-RPWUZVMVSA-N 398.510 5.742 30 20 GKED C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCCCOc2ccc(C#N)cc2)cc1 742264080 OXMOFYKFVFBVMZ-QGZVFWFLSA-N 395.503 5.025 30 20 GKED O=C1/C(=C/c2nc3ccc(F)cc3s2)CCc2ncc(C(F)(F)F)cc21 761486886 QMMMGMOHBLXCHV-WEVVVXLNSA-N 378.350 5.062 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)/C=C/c3ccc4[nH]ccc4c3)n2)cc1 765915016 IIWCOZNKPUMVCH-NTPDMAOXSA-N 383.476 5.490 30 20 GKED Cc1nc(-c2cccs2)c(CC(=O)OCc2ccccc2C(C)(C)C#N)s1 767989181 WYOSJDFNSAZQIL-UHFFFAOYSA-N 396.537 5.267 30 20 GKED N#Cc1ccc(-c2cccc(CNCc3ncc(-c4ccccc4)s3)c2)s1 770738292 JWAGTOFTFWKSHB-UHFFFAOYSA-N 387.533 5.700 30 20 GKED O=C(/C=C\c1nc2ccc(Br)cc2s1)c1ccc(F)cc1F 773125351 OCCSIXLKPQGZGH-WAYWQWQTSA-N 380.213 5.233 30 20 GKED C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2ccc(Cl)cc2C#N)cc1 774305243 QNORNVAYROTTRI-AWEZNQCLSA-N 385.895 5.409 30 20 GKED C[C@@H](N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21)c1cccc(C#N)c1 779071768 DYKAPZAYQPGORR-VFNWGFHPSA-N 377.488 5.243 30 20 GKED COc1ccc2cccc(CC(=O)[C@@H](C#N)c3nc4cc(F)ccc4s3)c2c1 780359709 YEAGVGIXMJGOED-GOSISDBHSA-N 390.439 5.016 30 20 GKED N#C[C@H](C(=O)C[C@H](Cc1ccccc1)c1ccccc1)c1cnc2ccccc2n1 792105070 TUJOAUKIGSYXJX-VXKWHMMOSA-N 391.474 5.223 30 20 GKED Cn1cc(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c2cc(F)ccc21 797707310 LBIMDIQJLMKVPK-OAQYLSRUSA-N 383.426 5.225 30 20 GKED C#C[C@H](NC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1)c1ccc(Cl)cc1 810197611 SAYIQTREYAQEFV-IBGZPJMESA-N 379.847 5.108 30 20 GKED Cc1ccc(-c2nc(/C=C/C(=O)c3ccc(Br)nc3)cs2)cc1 811695282 CACYBTREIKQATL-BQYQJAHWSA-N 385.286 5.172 30 20 GKED CCc1nn(C)c(CC)c1C=NNc1cc(C(F)(F)F)cc(C(F)(F)F)c1 814948947 MVMJOTULMBQCRS-UHFFFAOYSA-N 392.347 5.029 30 20 GKED Cc1cc(C(=O)N[C@H](CCCC#N)c2ccccc2)c(C)n1[C@@H](C)c1ccccc1 817318547 CLFKNPWLSDPEIO-NBGIEHNGSA-N 399.538 5.879 30 20 GKED Cc1occ(C(F)(F)F)c1C(=O)N[C@H](CC(F)(F)F)c1ccc(F)cc1 875519750 LKRGDESDODHJNW-GFCCVEGCSA-N 383.263 5.169 30 20 GKED Cc1cc(F)ccc1N(Cc1ccc(C#N)cc1)C(=O)/C=C/c1cccs1 914521132 WCLDQRXBPZZGPE-PKNBQFBNSA-N 376.456 5.314 30 20 GKED Cc1cc(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)c(C)n1[C@H](C)c1ccccc1 914758734 NQTLQNXYBICUBT-LJQANCHMSA-N 397.522 5.391 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)CCSc2ccc(F)cc2)cc1 915179210 BFCBCWKCZBWBGS-QFIPXVFZSA-N 390.483 5.602 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(-c3ccccc3)on2)cc1 915180830 SFYWAIKUFGTPQS-NRFANRHFSA-N 379.419 5.249 30 20 GKED COc1cc(C=NOCc2c(Cl)ccc3cccnc23)ccc1OC(F)F 917394039 PQRYCFZKEZSPKO-UHFFFAOYSA-N 392.789 5.049 30 20 GKED COc1ccc(-c2csc([C@@H](C#N)C(=O)CCc3ccc(Cl)cc3)n2)cc1 920143609 SJOMFRCVYOAROE-SFHVURJKSA-N 396.899 5.281 30 20 GKED O=C(O)c1cccc(NN=Cc2ccc(-c3ccc(C(F)(F)F)cc3)s2)c1 1776036786 QEFMZFVACPYJEW-UHFFFAOYSA-N 390.386 5.578 30 20 GKED CC(C)(C)c1cc(C(=O)/C=C/c2ccc(/C=C\C(=O)O)o2)c2c(c1)C(C)(C)CC2 1776269179 AFUPWWIPYYQNII-GOOGBFEESA-N 392.495 5.795 30 20 GKED CCCCCCC[C@@H](C)CNc1c(C(=O)O)cnc2c(OC)cc(OC)cc12 1776782282 BLEUCESPDNXQLJ-OAHLLOKOSA-N 388.508 5.359 30 20 GKED CCCCCCCOc1cccc(CNC2(C(=O)O)CCC(CC)CC2)c1 1776787215 DQIOKMBORUOOMK-UHFFFAOYSA-N 375.553 5.549 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](c2ccccc2)[C@H](C)C(=O)O)c1 1776787305 ODIMZLOZQNFUAM-WMZHIEFXSA-N 383.532 5.587 30 20 GKED COc1ccc(/C=C/C(=O)c2ccc(-c3ccc(C(=O)O)o3)cc2)c(Cl)c1 1777360811 RGGLMEODXGJLGW-VQHVLOKHSA-N 382.799 5.203 30 20 GKED O=C(O)Cc1cccc(-c2ccc(/C=C\C(=O)c3nc4ccccc4s3)cc2)c1 1777650908 BJQWQPMDRQEOOL-RAXLEYEMSA-N 399.471 5.487 30 20 GKED O=C(O)c1ccc(-c2ccc(/C=C3\C(=O)c4cccc5c4[C@@H]3CCC5)cc2)cc1 1777671067 YRYJXNDSYKBFFH-FYYJVHHASA-N 380.443 5.752 30 20 GKED C=CCN(C(=O)c1cc(F)c(F)c(F)c1F)c1nc(-c2ccccc2)cs1 14723835 HGSBEWMIKZMFLK-UHFFFAOYSA-N 392.377 5.199 30 20 GKED COc1cc(C(=O)Nc2cccc(C#N)c2)ccc1OCc1ccc(Cl)cc1 15644271 XKWVDMSFYGSOKP-UHFFFAOYSA-N 392.842 5.052 30 20 GKED Cc1nc(Cc2ccccc2)sc1C(=O)[C@@H](C#N)c1nc2ccccc2s1 41498025 XJWDCOXULSMJMV-OAHLLOKOSA-N 389.505 5.142 30 20 GKED N#C[C@H](C(=O)CCc1ccc2ccccc2c1)c1nc2ccccc2n1C(F)F 54466142 YHUUDLDJNOKABA-GOSISDBHSA-N 389.405 5.394 30 20 GKED CCOc1ccccc1CN(C)C(=O)Nc1ccccc1S[C@H](C)CC#N 66954904 JGIJSKNGLYCNQN-MRXNPFEDSA-N 383.517 5.143 30 20 GKED CC[C@H]1c2ccsc2CCN1C(=O)Nc1ccccc1S[C@H](C)CC#N 66955768 OAEIBHWRZIMSGV-PBHICJAKSA-N 385.558 5.684 30 20 GKED C[C@@H](Nc1ccc(Oc2ccc(C#N)cc2)cc1)c1nnc(-c2ccccc2)o1 72040942 RNGMLSMPGVJZND-MRXNPFEDSA-N 382.423 5.574 30 20 GKED Cc1ccc(N(CCC#N)C(=O)c2ccc(Oc3ccncc3)c(Cl)c2)cc1 114321149 UMXMIGIBHHGJFL-UHFFFAOYSA-N 391.858 5.396 30 20 GKED N#C[C@H](C(=O)CCCCCc1cccs1)c1nc(-c2ccncc2)cs1 114621148 GLJYYYMLJBGAQJ-QGZVFWFLSA-N 381.526 5.246 30 20 GKED Cc1ccc2cc(C(=O)[C@@H](C#N)c3nc(-c4ccc(C#N)cc4)cs3)ccc2n1 120037912 ZABQPAWHIXLLRS-LJQANCHMSA-N 394.459 5.028 30 20 GKED Cc1cc(-c2nc3cc(F)ccc3n2C(C)C)ccc1NC(=O)N(C)CCC#N 126869436 WDAVHIAJEAWKSM-UHFFFAOYSA-N 393.466 5.109 30 20 GKED Cc1cc(Cl)ccc1C(=O)[C@@H](C#N)c1nc(-c2ccc(C#N)cc2)cs1 151657419 HIJRBVKXJGUKJN-QGZVFWFLSA-N 377.856 5.134 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCC[C@H]2c2ccncc2)cc1 155356632 WENPITHGASCLJQ-QFIPXVFZSA-N 383.451 5.031 30 20 GKED C[C@@H](C#N)CSc1ccccc1NC(=O)[C@@H](OC(C)(C)C)c1ccccc1 156695384 FLXCTXGYQLEBTO-JXFKEZNVSA-N 382.529 5.433 30 20 GKED C[C@@H](CCC(=O)[C@H](C#N)C(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 160175928 XPJQNWTXOZCRCG-BBRMVZONSA-N 389.282 5.225 30 20 GKED CC(C)CCOC1CCN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1 170869598 CHKSZHUVUILRDZ-UHFFFAOYSA-N 392.499 5.018 30 20 GKED CC(C)c1ccc(CSc2nnc(SCCCSCC#N)s2)cc1 174007545 CLMMDLWSXQKOFX-UHFFFAOYSA-N 395.644 5.693 30 20 GKED N#Cc1cccc(COc2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)c1 176211595 OKEWEXBWFRYHNQ-UHFFFAOYSA-N 397.261 5.696 30 20 GKED CC[C@H](C)Sc1ccc(NC(=O)c2cc(C#N)cn2C)c(C(F)(F)F)c1 176978218 UCTAXAYSIZXYTJ-NSHDSACASA-N 381.423 5.058 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1cn2cc(Cl)cc(Cl)c2n1 177235632 VZNXHVCKEDRLEW-LBPRGKRZSA-N 391.327 5.505 30 20 GKED CC(C)[C@H](NC(=O)CNc1ccccc1S[C@H](C)CC#N)c1ccc(F)cc1 178392153 MVBKQJKHXHVMBW-ZHRRBRCNSA-N 399.535 5.145 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)c1ccc(CNC(=O)C=C(C)C)cc1 189883566 GVCZTAXKKLXIFN-UHFFFAOYSA-N 390.527 5.373 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCO[C@H](c2ccc(F)c(C)c2)C1 191450012 CLXKUPIORCZXAH-QFIPXVFZSA-N 396.506 5.591 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1cccc(Cl)c1Cl 194068890 ZOOVEUMEXUWRQN-GFCCVEGCSA-N 379.312 5.426 30 20 GKED C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1 195547997 AVUVFBDUSTXJOY-OAHLLOKOSA-N 392.421 5.173 30 20 GKED C=C(C)COc1cc(CN[C@H](C)c2ccc(-c3cccnc3)cc2)ccc1OC 237343847 HSFKDTAWFBCPPB-LJQANCHMSA-N 388.511 5.563 30 20 GKED CC(C)COc1ccc(CC(=O)Nc2ccccc2SC[C@H](C)C#N)cc1 303319888 TZTNYBSBODPJBV-QGZVFWFLSA-N 382.529 5.154 30 20 GKED Cc1nc([C@@H]2CCCOC2)sc1/C(O)=N/[C@@H]1CC[C@H](Cc2ccccc2)C1 329036520 YVEQEPSTZVLPFB-GUDVDZBRSA-N 384.545 5.062 30 20 GKED CO[C@H]1CCCN(C(=O)Nc2ccc([C@H](C#N)c3ccccc3)c(Cl)c2)CC1 378623850 MDVKUOQXCPQWEM-AZUAARDMSA-N 397.906 5.028 30 20 GKED C=CCc1cccc(C(C)C)c1NC(=O)N1CCC[C@H]1COc1cccnc1C 417047572 VLCGOHDZXZJJPQ-FQEVSTJZSA-N 393.531 5.317 30 20 GKED Cc1c(C(=O)Nc2ccc(Cc3ccncc3)cc2)sc2ccc(C#N)cc12 427983690 UTTFKDFGYUWHPY-UHFFFAOYSA-N 383.476 5.320 30 20 GKED CCCc1onc(-c2c(Cl)cccc2Cl)c1C(=O)N[C@H](CC)CC#N 432318148 PTGWCVLAVKQWLL-LLVKDONJSA-N 380.275 5.023 30 20 GKED CC(C)(C#N)CCCCSc1nnc(-c2cccs2)n1Cc1ccco1 436212964 WQBCYDIISIJULY-UHFFFAOYSA-N 386.546 5.460 30 20 GKED N#C[C@@H](c1ccccc1)c1ccc(NC(=O)c2cc(F)c(O)c(F)c2)cc1Cl 436531321 HDFMRNDNTRLOGG-INIZCTEOSA-N 398.796 5.232 30 20 GKED C[C@H](C(=O)Nc1ccc(O)c(-c2nc3ccccc3s2)c1)c1cccc(C#N)c1 436703085 FYJOCDITOYEGEK-AWEZNQCLSA-N 399.475 5.283 30 20 GKED Cc1ccc(-c2csc([C@H](C#N)C(=O)c3ncoc3-c3ccc(C)cc3)n2)cc1 442684343 SELJNMUFYDNILE-GOSISDBHSA-N 399.475 5.572 30 20 GKED C[C@H](NC1CCC(C)(C#N)CC1)c1cccc(NC(=O)Cc2ccccc2F)c1 449082730 PKOZGGJJLFVMHS-QWMSRCPPSA-N 393.506 5.130 30 20 GKED C[C@@H]1C[C@H](c2ccccc2F)N(C(=O)N[C@@H](CCCC#N)c2ccccc2)C1 458799688 JSFXBILHVZDDIY-VOQZNFBZSA-N 379.479 5.353 30 20 GKED N#Cc1cccc(-n2ccc(C(=O)Nc3ccc(Cl)cc3-c3ccccc3)n2)c1 466339378 DQPACHIIXBGODA-UHFFFAOYSA-N 398.853 5.317 30 20 GKED Cc1ccc([C@H]2CCC[C@@H]2Nc2ccc3c(c2)CCC(=O)N3CCCC#N)cc1 469273563 VUJFDVPDEIGGPP-PKTZIBPZSA-N 387.527 5.326 30 20 GKED C[C@H](c1ccccc1Br)N(C)C(=O)C[C@@H](CC#N)c1ccccc1 474693463 IPHMISVUYJXHDY-NVXWUHKLSA-N 385.305 5.056 30 20 GKED N#CC[C@H](CC(=O)N1CCC[C@@H]1c1cccc(Br)c1)c1ccccc1 475031696 ODZGPMAQCRXASP-YLJYHZDGSA-N 397.316 5.200 30 20 GKED C=CCC(C)(C)C(=O)N[C@@H](C)c1nc(-c2ccc(Br)cc2)cs1 477998530 YUEPCOAEEATDSF-LBPRGKRZSA-N 393.350 5.352 30 20 GKED CCN(C(=O)c1ccc(C#N)cc1)[C@H](c1cccnc1)c1csc2ccccc12 480970305 YFJGRAUUHFFGHS-HSZRJFAPSA-N 397.503 5.420 30 20 GKED C=C(C)CN1CCC(N[C@H](C)c2sc(-c3ccc(Cl)cc3)nc2C)CC1 482645718 IEXIJDKTRGAKKZ-OAHLLOKOSA-N 389.996 5.463 30 20 GKED C=CCOc1cccc(NC(=O)N(CCC(F)(F)F)Cc2ccccc2)c1 483857912 LHQPELQPJKEXNJ-UHFFFAOYSA-N 378.394 5.238 30 20 GKED C=CCSc1ccccc1C(=O)Nc1cccc2c1CN(c1ccccn1)C2 486436519 QPAPBLUCMVUEET-UHFFFAOYSA-N 387.508 5.132 30 20 GKED N#CCCC[C@@H](NC(=O)c1cc(C2CC2)nc2ccc(F)cc12)c1ccccc1 487235726 AUGQTHUDLCFRGZ-OAQYLSRUSA-N 387.458 5.416 30 20 GKED C[C@H](CC(=O)N[C@H](CCCC#N)c1ccccc1)c1cccc(C(F)(F)F)c1 487299397 ORDAWANATRNSGK-OXQOHEQNSA-N 388.433 5.750 30 20 GKED Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Nc1ccccc1S[C@@H](C)CC#N 490251954 TZDGUSGWIIJXPU-AVRDEDQJSA-N 395.572 6.250 30 20 GKED COc1cc(Cl)c(C)cc1NC(=O)Nc1ccccc1S[C@H](C)CC#N 503202922 SMDCFUUDUHMQHR-CYBMUJFWSA-N 389.908 5.695 30 20 GKED CCc1c(NC(=O)c2sc3ccc(C#N)cc3c2C)cnn1-c1ccccc1 505094389 SWOICTGWBQWYJZ-UHFFFAOYSA-N 386.480 5.082 30 20 GKED CN(C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[C@H]1CCc2ccccc2C1 510763336 MZHRRADIRWXNBP-QHCPKHFHSA-N 396.490 5.174 30 20 GKED CCc1nc2cc(NC(=O)c3cccc(COc4ccccc4C#N)c3)ccc2o1 513540453 LGDGXIFBGGEHJE-UHFFFAOYSA-N 397.434 5.093 30 20 GKED CC(C)(C(=O)Nc1ccc(Cl)cc1Br)c1cc(F)cc(C#N)c1 514814922 ZZABNECVDUZUKU-UHFFFAOYSA-N 395.659 5.030 30 20 GKED N#CCCn1cc(CN[C@@H]2CCCc3sc(Cl)cc32)c(-c2ccccc2)n1 515954492 UYXFUFITNIYECT-GOSISDBHSA-N 396.947 5.346 30 20 GKED CN(Cc1cccc(C#N)c1)C(=O)[C@@H](Sc1ccc(F)cc1)c1ccccc1 518537850 LBVRUGPIMSYFEH-QFIPXVFZSA-N 390.483 5.189 30 20 GKED N#Cc1ccc(Nc2cccc(C(=O)Nc3ccc([C@H]4CCOC4)cc3)c2)cc1 521932811 KFJXYNIJVHFNTM-FQEVSTJZSA-N 383.451 5.058 30 20 GKED C[C@H](C#N)CN(C(=O)Nc1cc(Cl)ccc1SCC(F)(F)F)C1CC1 533596396 LEYLGCOFEFUHTF-SNVBAGLBSA-N 391.846 5.150 30 20 GKED CC(C)(C)[C@@H]1CCc2c(sc(NC(=O)c3scnc3C3CC3)c2C#N)C1 534029281 YYGPRGXHJBYWIE-GFCCVEGCSA-N 385.558 5.357 30 20 GKED C=C[C@@H](CC(=O)N[C@@H](c1ccccc1)c1nc2ccccc2n1C)c1ccccc1 535366610 ZAUNEEVPVGMPSI-DFBJGRDBSA-N 395.506 5.139 30 20 GKED CC[C@@H]1CC[C@H](C)N1C(=O)Nc1ccc(Oc2ccc(C#N)cc2OC)cc1 536818483 XLEVQPOHFXIWTF-MAUKXSAKSA-N 379.460 5.154 30 20 GKED C[C@@H](C#N)CSc1ccccc1NCc1c(F)cccc1Br 538940697 QLWTXKIUFHRPAL-LBPRGKRZSA-N 379.298 5.452 30 20 GKED Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)cc1 544483433 NQAVBFGSQGWLEP-GAJHUEQPSA-N 397.478 5.277 30 20 GKED CC1(C)C[C@@H](NC(=O)Nc2ccc(Oc3ccc(C#N)cc3)c(Cl)c2)CCO1 546640173 CKEZAVMTUSTPMB-INIZCTEOSA-N 399.878 5.083 30 20 GKED Cc1cccc(NC(=O)[C@@H](C)Nc2ccc(Oc3cccc(C#N)c3)cc2)c1C 553640432 WUTLORCLNVTUFI-GOSISDBHSA-N 385.467 5.407 30 20 GKED C[C@](C#N)(NC(=O)Cc1csc(-c2ccc(Cl)s2)n1)C1CCCCC1 559596118 KXCMAQWTYRSHJT-GOSISDBHSA-N 393.965 5.046 30 20 GKED CCC[C@@H](NC(=O)N1CCC(CCC#N)CC1)c1cccc(C(F)(F)F)c1 566617473 PFGDKFCHDICRNB-GOSISDBHSA-N 381.442 5.272 30 20 GKED CN(Cc1cc2ccccc2o1)C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1 574443920 YFDOMGZSNJUQSG-UHFFFAOYSA-N 398.422 5.156 30 20 GKED CCCC(C)(C)N(Cc1nnc(-c2ccc(C#N)cc2)o1)Cc1cccs1 575140272 NEWVVMIMVUCKHW-UHFFFAOYSA-N 380.517 5.251 30 20 GKED CCCOc1ccc(Cl)cc1NC(=O)N(Cc1ccc(C#N)cc1)C(C)C 578120818 HWHNTWAXZMWMDJ-UHFFFAOYSA-N 385.895 5.443 30 20 GKED C=CCCC(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 588629868 WGKRDDKWVKHXMA-UHFFFAOYSA-N 382.847 5.479 30 20 GKED Cc1cc([C@@H](NC(=O)N2CCC[C@H](CC#N)C2)c2ccccc2Cl)ccc1F 596398635 QWVOCBKFVZLJKZ-IIBYNOLFSA-N 399.897 5.212 30 20 GKED Cc1ccc(-c2noc([C@@H](C)Nc3cccc(OCCCC#N)c3)n2)cc1F 604044326 IIQNVFYNTQTTBY-OAHLLOKOSA-N 380.423 5.040 30 20 GKED Cc1ccc(C)n1-c1sccc1C(=O)Nc1cccc(OCCCC#N)c1 604176284 QOEZSACKUMCJGW-UHFFFAOYSA-N 379.485 5.091 30 20 GKED Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)NCCCc1ccccc1 609078771 NADLKPKKQHRXLY-UHFFFAOYSA-N 399.494 5.200 30 20 GKED CC(C)(C)CN(CCC#N)C(=O)c1ccc(COc2ccc(Cl)cc2)cc1 609191387 JPYPMDBWDOIKSC-UHFFFAOYSA-N 384.907 5.321 30 20 GKED C[C@H](C#N)CSc1ccccc1NC(=O)Cc1ccc(Cl)c(Cl)c1 609376636 GUQAGSGLIFRNHO-GFCCVEGCSA-N 379.312 5.426 30 20 GKED Cc1cc(C(=O)CS[C@H](C)c2ccc(C#N)cc2)c(C)n1-c1nccs1 609825947 DAYVMCHAEPSBLD-OAHLLOKOSA-N 381.526 5.099 30 20 GKED C[C@@H](Nc1cccc(CSC2CCCC2)c1)C(=O)Nc1ccccc1C#N 610139735 BOTQBHWZJBQUHL-MRXNPFEDSA-N 379.529 5.173 30 20 GKED N#Cc1c(NC(=O)c2cnc3ccsc3c2)sc2c1-c1ccccc1CC2 610224863 APDFNCMFUUOMGS-UHFFFAOYSA-N 387.489 5.247 30 20 GKED Cc1c(NCC(C)(C)C)cccc1C(=O)Nc1ccccc1S[C@@H](C)CC#N 610704315 SQGQMHAXWPEVRQ-INIZCTEOSA-N 395.572 6.100 30 20 GKED N#Cc1cccc(Oc2ccc(NC(=O)N3CCC(c4ccccn4)CC3)cc2)c1 611095358 TYOSGRNHAPXWTI-UHFFFAOYSA-N 398.466 5.157 30 20 GKED CSc1cccc(F)c1C(=O)NC(CCC(F)(F)F)CCC(F)(F)F 619127050 QQJUPOCXQMWGDX-UHFFFAOYSA-N 391.352 5.331 30 20 GKED C[C@H](NC(=O)c1ccccc1SCc1ccc(C#N)cc1)c1ccsc1 619777639 QRDKPDCWNGXVON-HNNXBMFYSA-N 378.522 5.403 30 20 GKED O=C(CNc1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cc(F)ccc1F 641933594 HDPUDOXWJZDGTP-UHFFFAOYSA-N 398.253 5.053 30 20 GKED CCCc1[nH]ccc1C(=O)[C@@H](C#N)c1nc2cc(C(F)(F)F)ccc2s1 643369701 BITZPIMSSGLRAZ-GFCCVEGCSA-N 377.391 5.086 30 20 GKED O=C(N[C@H](c1ccccc1C(F)(F)F)C(F)(F)F)c1ccc(C(F)F)nc1 653736541 OVQYCQAHOQEORO-GFCCVEGCSA-N 398.253 5.071 30 20 GKED C=CCC[C@H](NC(=O)N[C@@H](C)c1cnccc1C)c1ccc(C(F)(F)F)cc1 678451760 PFWGIRRCUVYADS-KXBFYZLASA-N 391.437 5.477 30 20 GKED N#C[C@H](C(=O)c1cc2cc(Cl)sc2[nH]1)c1nc2cc(F)ccc2s1 685788231 YAYDIXMOHPNXCU-SECBINFHSA-N 375.837 5.122 30 20 GKED CCC[C@H](NC(=O)Nc1cccc(OCC#N)c1)c1cccc(C(F)(F)F)c1 726845904 RHUBZDBJCZZMSZ-SFHVURJKSA-N 391.393 5.271 30 20 GKED Cc1ccc(NN=Cc2c(Cl)cccc2OCc2ccccc2Cl)nn1 729938087 OMQJTKAJRULBSX-UHFFFAOYSA-N 387.270 5.117 30 20 GKED O=C(/C=C/c1ccc(-c2nc3ccccc3s2)o1)c1csc(C(=O)O)c1 730149364 WFCUSHQHFCNDTA-FNORWQNLSA-N 381.434 5.212 30 20 GKED N#C[C@H](C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1nc(-c2ccccc2)cs1 731287669 IAQPFSPNHSHJBZ-BHDDXSALSA-N 394.499 5.943 30 20 GKED CC(=O)Nc1ccc(/C=C2/CCc3nc(-c4ccccc4F)sc3C2=O)cc1 731938685 RHPSUGVBZGKNGW-QINSGFPZSA-N 392.455 5.120 30 20 GKED Cc1ccc(SCC(F)(F)F)c(NC(=O)/C=C\c2ccccc2C#N)c1 736502171 XBTQLVPNABKTLJ-CLFYSBASSA-N 376.403 5.173 30 20 GKED N#CCSc1ccccc1C(=O)Nc1cccc(CSC2CCCC2)c1 740847937 KAUNOXXFZAKLIV-UHFFFAOYSA-N 382.554 5.730 30 20 GKED N#Cc1ccccc1Oc1ccc(NC(=S)N[C@@H]2CCc3ccccc3C2)cc1 742989815 IFFLHLXGVXPOJW-OAQYLSRUSA-N 399.519 5.194 30 20 GKED Cc1ccc(N(CCC#N)C(=O)[C@H](C)Nc2ccc3oc(C(C)C)nc3c2)cc1 743467446 AWCSEOHZAKIOQB-KRWDZBQOSA-N 390.487 5.007 30 20 GKED N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccc(SC(F)F)cc1 752616452 TYOCZSQNJGZOPI-QZTJIDSGSA-N 387.455 5.305 30 20 GKED C=CCN(C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1)C(C)C 756213939 JKJXQKWOHVAJFW-ZDUSSCGKSA-N 377.941 5.439 30 20 GKED N#C[C@H](C(=O)CCn1ccc2cc(Cl)ccc21)c1nc2ccccc2s1 759182068 DCJDNSIAWQSEBU-OAHLLOKOSA-N 379.872 5.171 30 20 GKED C=CCn1c(SCc2cccc(Cl)n2)nnc1-c1cccc(Cl)c1 765333157 MORUVWFWCLGEQB-UHFFFAOYSA-N 377.300 5.125 30 20 GKED C#CC[C@H](NCc1ccccc1CN[C@H](CC#C)c1ccccc1)c1ccccc1 775400934 UJBOCZJJJOWWNV-HNRBIFIRSA-N 392.546 5.395 30 20 GKED COc1ccc(-c2csc3ncnc(NN=C(C)C4CCSCC4)c23)cc1 777426872 MBLFKEZPQPBQJP-UHFFFAOYSA-N 398.557 5.298 30 20 GKED CC(C)(C#N)CCCOC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 783234275 KHRUWMYRBHZRRH-UHFFFAOYSA-N 383.300 5.604 30 20 GKED N#Cc1ccc(C[C@H](C#N)C(=O)Nc2ccc(N=Nc3ccccc3)cc2)cc1 791440786 VBFLDBOXTLOKQE-LJQANCHMSA-N 379.423 5.295 30 20 GKED N#Cc1cccc(COc2ccc(N[C@@H]3CCCC34CCOCC4)cc2F)c1 800519063 JUVIUFOFNAKRID-JOCHJYFZSA-N 380.463 5.038 30 20 GKED CCN(C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)[C@H](C)c1ccc(C#N)cc1 801657691 OSQXVPDTXVDLCL-ACJLOTCBSA-N 378.369 5.197 30 20 GKED C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)Nc1ccc2cc(OC)ccc2c1 806612518 HXECUFVSUTVOQF-UHFFFAOYSA-N 392.503 5.236 30 20 GKED C[C@H](N[C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccc(OCC#N)cc1 810243943 NMZWDNRZZLDJRQ-RNODOKPDSA-N 375.299 5.698 30 20 GKED N#CC1(CCCOC(=O)[C@@H](c2ccccc2)c2ccc(Cl)cc2)CCOCC1 850239417 PQHCOGHEGAYHPF-NRFANRHFSA-N 397.902 5.116 30 20 GKED N#Cc1c(NC(=O)c2cc(-c3ccco3)nc3ccccc23)sc2c1CCC2 877887844 WVUUHYIWZFURRM-UHFFFAOYSA-N 385.448 5.169 30 20 GKED Cc1ccc(C)c(OCCC(=O)Nc2ccc([C@H](C#N)c3ccccc3)cc2)c1 915181012 WGVAKGVSWAXHAS-HSZRJFAPSA-N 384.479 5.367 30 20 GKED COc1ccc2cc(/C=C\C(=O)[C@H](C#N)c3nc4ccccc4s3)ccc2c1 916846070 GNNKKSHYVFPXGI-ABMFHFBKSA-N 384.460 5.348 30 20 GKED C[C@H](NCCC(C#N)(c1ccccc1)c1ccccc1)c1ccc2nc(O)oc2c1 1473684987 NUSPSHAYYNZUDD-SFHVURJKSA-N 397.478 5.084 30 20 GKED O=C(O)c1cc(C=NNc2c(Cl)cc(Cl)cc2Cl)sc1Cl 1776014715 SSTRRZFGYKVQHI-UHFFFAOYSA-N 384.071 5.506 30 20 GKED CC1(C)[C@H]2CC[C@@]1(C)[C@@H](NN=Cc1ccc(-c3cccc(C(=O)O)c3)s1)C2 1776057437 YACOCROSACLSCA-BPXKWBHBSA-N 382.529 5.252 30 20 GKED Cc1c(/C=C/C(=O)c2ccc(-c3ccccc3)cc2)nc2ccccc2c1C(=O)O 1776131321 OFXQQAXVFMGIGY-FOCLMDBBSA-N 393.442 5.805 30 20 GKED C=CCc1cc(CNCCCCCCCCCCCC(=O)O)cc(OC)c1O 1776186999 NVZVOMCIBHWPBU-UHFFFAOYSA-N 391.552 5.205 30 20 GKED C[C@@H](Oc1ccc(/C=C\C(=O)c2ccc(Cl)c(C(F)(F)F)c2)cc1)C(=O)O 1776469776 JZAPTIORBUIVIP-KSHIFHCESA-N 398.764 5.107 30 20 GKED CC[C@@H](C)n1ncc2c(C(=O)O)cc(/C=C/c3ccc(C(C)(C)C#N)cc3)nc21 1776702136 YNITZXQJGNTUOT-KUCQQTCKSA-N 388.471 5.072 30 20 GKED CCCCCCC[C@H](CC(=O)O)NCc1ccc(Oc2ccccc2OC)cc1 1776784747 QVNWLCKPMDVRAY-HXUWFJFHSA-N 399.531 5.781 30 20 GKED CCCCCCCSc1ccc(C(=O)Nc2ccc(C(=O)O)c(F)c2)cc1 1776787531 QUPNOILJAZDHPA-UHFFFAOYSA-N 389.492 5.839 30 20 GKED CCCCCCCOc1cccc(CN[C@@H](C(=O)O)c2cccc(C)c2C)c1 1776788124 SXBXYKNBTJCODB-HSZRJFAPSA-N 383.532 5.568 30 20 GKED CCCCCCCOc1cccc(CNC[C@@H](Cc2cccc(C)c2)C(=O)O)c1 1776788709 QADDQCARFUFZEC-HSZRJFAPSA-N 397.559 5.377 30 20 GKED CCCCCCCOc1cccc(/C=C/c2cc(C(=O)O)c3ccccc3n2)c1 1776789090 POSZDHQWYQECJF-CCEZHUSRSA-N 389.495 6.453 30 20 GKED C=C(C)CC(C)(C)C(=O)Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3C3CC3)CCC2)cc1 1789622279 HVTSJFGZACLWMW-LEWJYISDSA-N 394.559 5.159 30 20 GKED